*HEADER    TRANSFERASE                             29-OCT-09   2WWV
*TITLE     NMR STRUCTURE OF THE IIACHITOBIOSE-IIBCHITOBIOSE COMPLEX OF
*TITLE    2 THE N,N'-DIACETYLCHITOBOISE BRANCE OF THE E. COLI
*TITLE    3 PHOSPHOTRANSFERASE SYSTEM.
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: N\,N'-DIACETYLCHITOBIOSE-SPECIFIC
*COMPND   3  PHOSPHOTRANSFERASE ENZYME IIA COMPONENT;
*COMPND   4 CHAIN: A, B, C;
*COMPND   5 FRAGMENT: RESIDUES 14-116;
*COMPND   6 SYNONYM: IIACHB, PTS SYSTEM
*COMPND   7  N\,N'-DIACETYLCHITOBIOSE-SPECIFIC EIIA COMPONENT,
*COMPND   8  EIIA-CHB, EIII-CHB;
*COMPND   9 EC: 2.7.1.-;
*COMPND  10 ENGINEERED: YES;
*COMPND  11 MUTATION: YES;
*COMPND  12 MOL_ID: 2;
*COMPND  13 MOLECULE: N\,N'-DIACETYLCHITOBIOSE-SPECIFIC
*COMPND  14  PHOSPHOTRANSFERASE ENZYME IIB COMPONENT;
*COMPND  15 CHAIN: D;
*COMPND  16 SYNONYM: IIBCHB, PTS SYSTEM
*COMPND  17  N\,N'-DIACETYLCHITOBIOSE-SPECIFIC EIIB COMPONENT;
*COMPND  18 EC: 2.7.1.69
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;
*SOURCE   3 ORGANISM_TAXID: 562;
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   5 EXPRESSION_SYSTEM_TAXID: 562;
*SOURCE   6 MOL_ID: 2;
*SOURCE   7 SYNTHETIC: YES;
*SOURCE   8 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;
*SOURCE   9 ORGANISM_TAXID: 562
*KEYWDS    KINASE, PHOSPHOTRANSFERASE SYSTEM, CHITOBIOSE, TRANSFERASE,
*KEYWDS   2 SUGAR TRANSPORT
*EXPDTA    SOLUTION NMR
*AUTHOR    Y.S.SANG,M.CAI,G.M.CLORE
*REVDAT   1   03-NOV-09 2WWV    0




!Experimental restraints for IIAChb-IIBChb complex

!A. NOE DATA

!1 Intermolecular NOE data
assign (resid 9 and name he# and segid a) (resid 84 and name he# and segid d) 3.0 1.2 1.5

assign (resid 68  and name HE# and segid C ) (resid 18 and name  HD# and segid D )  2.5  0.7  1.2 
assign (resid 68  and name HE# and segid C ) (resid 18 and name  HG and segid D )  4.0  2.2  1.2
assign (resid 68  and name HG# and segid C ) (resid 18 and name  HD# and segid D )  4.0  2.2  1.2

assign (resid 68  and name HE# and segid C ) (resid 87 and name  HG1# and segid D )  3.0 2.2 1.5 
assign (resid 68  and name HE# and segid C ) (resid 87 and name  HG2# and segid D )  4.0 2.2 1.5
assign (resid 68  and name HE# and segid C ) (resid 87 and name  HB and segid D )  4.0  2.2  1.5

assign ((resid 68  and name HE# and segid C) or (resid 9 and name he# and segid A) )
     (resid 19 and name  HD1# and segid D )  5.0  3.2  1.5
assign ((resid 68  and name HE# and segid C ) or (resid 9 and name he# and segid A) )
     (resid 19 and name  HD2# and segid D )  4.0  2.2  1.5


assign (resid  12 and name HD1# and segid A  ) (resid 12 and name  HB# and segid D )  4.0  2.2  2.0 
assign (resid  12 and name HD1# and segid A  ) (resid 11 and name  HB# and segid D )  5.0  3.2  1.5 
assign (resid 12 and name HD1# and segid A ) (resid 14  and (name HB# or name HG#) and segid D )  5.0  2.2  1.5
assign (resid 12 and name HD1# and segid A ) (resid 14  and name HE# and segid D )  5.0  3.2  2.0


assign (resid  13 and name HD1# and  segid A ) (resid 11 and ( name HA or name HB#) and segid D )  3.0  1.2  1.0
assign (resid  13 and name HD1# and  segid A ) (resid 60 and  name HG2#  and segid D )  3.0  1.2  1.5
assign (resid  13 and name HD1# and  segid A ) ( resid 62 and name  HE#  and segid D )  3.0  1.2  1.0 
assign (resid  13 and name HD1# and  segid A ) ( resid 62 and  name HD# and segid D )  4.0  2.2  2.5

assign (resid  73 and name HG1# and (segid A) ) (resid 14 and name  HE# and segid D )  4.0  2.2  2.0 
assign (resid  73 and name HG2# and (segid A) ) (resid 14 and name  HE# and segid D )  4.0  2.2  2.5
assign (resid  73 and name HG1# and (segid A) ) (resid 14 and name  HG# and segid D )  5.0  3.2  1.5 
assign (resid  73 and name HG2# and (segid A) ) (resid 14 and name  HG# and segid D )  5.0  3.2  2.5
assign (resid  73 and name HG# and (segid A ) ) (resid 15 and name  HB# and segid D )  5.0  3.2  1.5
assign (resid  73 and name HG1# and (segid A) ) (resid 15 and name  HA and segid D )  4.0  2.2  2.5
assign (resid  73 and name HN and (segid A ) ) (resid 14 and name  HE# and segid D )  5.0  3.2  1.5

assign (resid 59 and name HD1# and segid C ) (resid 13 and name  HA# and segid D )  4.0  2.2  1.5
assign (resid 59 and name HD1# and segid C ) (resid 14 and name  HE# and segid D )  4.0 2.2 2.0 
assign (resid 59 and name HD1# and segid C ) (resid 14 and name   HA and segid D )  3.0  1.2  1.0
assign (resid 59 and name HD1# and segid C ) (resid 14 and (name  HG# or name HB#) and segid D )  3.0  1.2  1.5
assign (resid 59 and name HD1# and segid C ) (resid 17 and (name  HA or name HB#) and segid D )  5.0  3.2  1.5

assign (resid 70 and name  HG*  and segid C ) (resid 14 and name  HE# and segid D )  3.0  1.2  1.5 
assign (resid 70 and name  HN  and segid  C ) (resid 14 and name  HE# and segid D )  5.0  3.2  1.5
assign (resid 71 and name  HN  and segid  C ) (resid 14 and name  HE# and segid D )  5.0  3.2  1.5

assign (resid 74 and name HD1# and segid C  ) (resid 14 and name  HE# and segid D )  3.0  1.2  1.5 
assign (resid 74 and name HD2# and segid C  ) (resid 14 and name  HE# and segid D )  3.0  1.2  1.5
assign (resid 74 and name HD1# and segid C  ) (resid 14 and name  HG# and segid D )  5.0  3.2  1.5
assign (resid 74 and name HD2# and segid C  ) (resid 14 and name  HG# and segid D )  4.0  2.2  1.5
assign (resid 75 and name HG1# and segid C ) (resid 14 and name   HE# and segid D )  4.0 2.2 2.0 
assign (resid 75 and name HG2# and segid C ) (resid 14 and name   HE# and segid D )  5.0  3.2  1.5
assign (resid 75 and name  HN  and segid  C ) (resid 14 and name  HE# and segid D )  5.0  3.2  1.5
assign (resid 78 and name  HE2#  and segid  C ) (resid 14 and name  HE# and segid D )  4.0  2.2  2.0


!2. Intramolecular NOE data related to active site loop of IIBChb


assign (resid   8 and name   HG and segid D) (resid   9 and name   HN and segid D )  4.0  2.2  2.0 
assign (resid   8 and name   HA and segid D) (resid   9 and name  HD# and segid D )  5.0  3.2  2.0 
assign (resid   8 and name  HB# and segid D) (resid   9 and name   HN and segid D )  3.0  1.2  1.0 

assign (resid   9 and name  HD# and segid D) (resid   9 and name  HE# and segid D )  3.0  1.2  1.0 
assign (resid   9 and name  HD# and segid D) (resid   9 and name   HZ and segid D )  5.0  3.2  2.0 
assign (resid   9 and name  HD# and segid D) (resid   9 and name   HN and segid D )  5.0  3.2  2.0 
assign (resid   9 and name  HD# and segid D) (resid   9 and name   HA and segid D )  5.0  3.2  2.0 
assign (resid   9 and name  HB# and segid D) (resid   9 and name   HN and segid D )  5.0  3.2  2.0 
assign (resid   9 and name   HA and segid D) (resid   9 and name  HE# and segid D )  5.0  3.2  2.0 
assign (resid   9 and name   HA and segid D) (resid   9 and name   HN and segid D )  4.0  2.2  2.0 
assign (resid   9 and name  HD# and segid D) (resid  10 and name   HN and segid D )  5.0  3.2  2.0 
assign (resid   9 and name  HB# and segid D) (resid  10 and name   HN and segid D )  5.0  3.2  2.0 
assign (resid   9 and name   HA and segid D) (resid  10 and name   HN and segid D )  3.0  1.2  1.0 
assign (resid   9 and name   HA and segid D) (resid  38 and name   HA and segid D )  5.0  3.2  2.0 
assign (resid   9 and name   HA and segid D) (resid  38 and name  HB# and segid D )  4.0  2.2  2.0 
assign (resid   9 and name  HD# and segid D) (resid  39 and name  HB# and segid D )  5.0  3.2  2.0 
assign (resid   9 and name  HD# and segid D) (resid  39 and name   HN and segid D )  5.0  3.2  2.0 
assign (resid   9 and name  HE# and segid D) (resid  39 and name  HB# and segid D )  5.0  3.2  2.0 
assign (resid   9 and name   HA and segid D) (resid  39 and name   HN and segid D )  4.0  2.2  2.0 
assign (resid   9 and name  HD# and segid D) (resid  41 and name  HB# and segid D )  5.0  3.2  2.0 
assign (resid   9 and name  HD# and segid D) (resid  41 and name   HA and segid D )  5.0  3.2  2.0 
assign (resid   9 and name  HB# and segid D) (resid  41 and name  HB# and segid D )  5.0  3.2  2.0 
assign (resid   9 and name  HB# and segid D) (resid  41 and name   HA and segid D )  4.0  2.2  1.5 
assign (resid   9 and name   HA and segid D) (resid  41 and name   HA and segid D )  4.0  2.2  1.5 
assign (resid   9 and name  HE# and segid D) (resid  43 and name  HB# and segid D )  5.0  3.2  2.0 
assign (resid   9 and name  HE# and segid D) (resid  44 and name  HB# and segid D )  5.0  3.2  2.5 
assign (resid   9 and name   HZ and segid D) (resid  44 and name  HB# and segid D )  5.0  3.2  2.5 
assign (resid   9 and name  HE# and segid D) (resid  47 and name   HN and segid D )  5.0  3.2  2.0 
assign (resid   9 and name  HE# and segid D) (resid  47 and name  HB# and segid D )  5.0  3.2  2.0 
assign (resid   9 and name   HZ and segid D) (resid  47 and name  HB# and segid D )  5.0  3.2  2.0 
assign (resid   9 and name  HE# and segid D) (resid  48 and name   HN and segid D )  5.0  3.2  2.0 
assign (resid   9 and name   HZ and segid D) (resid  48 and name   HN and segid D )  5.0  3.2  2.0 
assign (resid   9 and name   HZ and segid D) (resid  48 and name  HA# and segid D )  5.0  3.2  2.0 
assign (resid   9 and name  HD# and segid D) (resid  54 and name  HG* and segid D )  3.0  1.2  1.5 
assign (resid   9 and name  HE# and segid D) (resid  54 and name  HG* and segid D )  4.0  2.2  2.0 
assign (resid   9 and name   HZ and segid D) (resid  54 and name  HG* and segid D )  5.0  3.2  2.5 
assign (resid   9 and name  HD# and segid D) (resid  56 and name  HD* and segid D )  4.0  2.2  2.0 
assign (resid   9 and name  HE# and segid D) (resid  56 and name  HD* and segid D )  5.0  3.2  2.5 
assign (resid   9 and name  HB# and segid D) (resid  56 and name  HD* and segid D )  4.0  2.2  2.0 
assign (resid   9 and name   HA and segid D) (resid  56 and name  HD* and segid D )  4.0  2.2  2.0 
assign (resid   9 and name  HB# and segid D) (resid  60 and name HD1# and segid D )  3.0  1.2  1.5 
assign (resid   9 and name   HN and segid D) (resid  60 and name HD1# and segid D )  5.0  3.2  2.5 
assign (resid   9 and name   HA and segid D) (resid  60 and name HD1# and segid D )  4.0  2.2  2.0 


assign (resid  10 and name  HB# and segid D) (resid  11 and name   HN and segid D )  3.0  1.2  1.0 
assign (resid  10 and name  HB# and segid D) (resid  12 and name   HN and segid D )  5.0  3.2  2.0 
assign (resid  10 and name  HB# and segid D) (resid  16 and name   HB and segid D )  5.0  3.2  2.0 
assign (resid  10 and name  HB# and segid D) (resid  16 and name HG2# and segid D )  3.0  1.2  1.5 
assign (resid  10 and name  HB# and segid D) (resid  38 and name  HB# and segid D )  4.0  2.2  2.0 

assign (resid  11 and name  HB# and segid D) (resid  11 and name   HN and segid D )  5.0  3.2  2.0 
assign (resid  11 and name  HB# and segid D) (resid  11 and name   HA and segid D )  3.0  1.2  1.0 
assign (resid  11 and name  HB# and segid D) (resid  41 and name  HG# and segid D )  5.0  3.2  2.0 
assign (resid  11 and name  HB# and segid D) (resid  41 and name  HB# and segid D )  5.0  3.2  2.0 
assign (resid  11 and name  HB# and segid D) (resid  60 and name HG2# and segid D )  4.0  2.2  2.0 
assign (resid  11 and name   HN and segid D) (resid  60 and name HG2# and segid D )  5.0  3.2  2.5 

assign (resid  12 and name  HB# and segid D) (resid  12 and name   HN and segid D )  3.0  1.2  1.5 
assign (resid  12 and name  HB# and segid D) (resid  13 and name   HN and segid D )  4.0  2.2  2.5 
assign (resid  12 and name  HB# and segid D) (resid  14 and name  HG# and segid D )  4.0  2.2  2.0 


assign (resid  13 and name  HA# and segid D) (resid  13 and name   HN and segid D )  4.0  2.2  2.0 

assign (resid  14 and name  HB# and segid D) (resid  15 and name  HB# and segid D )  5.0  3.2  2.0 
assign (resid  14 and name  HG# and segid D) (resid  15 and name   HA and segid D )  5.0  3.2  2.0 


assign (resid   9 and name   HN and segid D) (resid  10 and name   HN and segid D )  4.0  2.2  1.0 
assign (resid   9 and name  HD# and segid D) (resid  10 and name   HN and segid D )  4.0  2.2  2.0 
assign (resid   9 and name   HN and segid D) (resid  55 and name   HN and segid D )  4.0  2.2  2.0 
assign (resid   9 and name   HN and segid D) (resid  57 and name   HN and segid D )  3.0  1.2  1.5 

assign (resid  10 and name   HN and segid D) (resid  13 and name   HN and segid D )  5.0  3.2  2.5 
assign (resid  10 and name   HN and segid D) (resid  39 and name   HN and segid D )  3.0  1.2  1.5 
assign (resid  10 and name   HN and segid D) (resid  41 and name   HN and segid D )  3.0  1.2  1.5 
assign (resid  10 and name   HN and segid D) (resid  43 and name   HN and segid D )  5.0  3.2  2.5 
assign (resid  10 and name   HN and segid D) (resid  44 and name   HN and segid D )  5.0  3.2  2.5 

assign (resid  11 and name   HN and segid D) (resid  12 and name   HN and segid D )  4.0  2.2  2.0 

assign (resid  12 and name   HN and segid D) (resid  13 and name   HN and segid D )  5.0  3.2  2.5 
assign (resid  12 and name   HN and segid D) (resid  14 and name   HN and segid D )  4.0  2.2  2.0 
assign (resid  12 and name   HN and segid D) (resid  16 and name   HN and segid D )  5.0  3.2  2.5 
assign (resid  12 and name   HN and segid D) (resid  41 and name   HN and segid D )  5.0  3.2  2.5 

assign (resid  14 and name   HN and segid D) (resid  16 and name   HN and segid D )  4.0  2.2  1.0 
assign (resid  14 and name   HN and segid D) (resid  17 and name   HN and segid D )  5.0  3.2  2.5 

assign (resid  15 and name   HN and segid D) (resid  16 and name   HN and segid D )  5.0  3.2  2.5 

assign (resid  16 and name   HN and segid D) (resid  17 and name   HN and segid D )  3.0  1.2  1.5 







B. Torsion angle restraints for unphosphorylated complex.

!1. IIA  (just listed for subunit A, but identical for subunits B and C)

! IIA Backbone Phi & Psi angles for mobile loop

assign (resid 59 and name C  and segid A) (resid 60 and name N  and segid A)
       (resid 60 and name CA and segid A) (resid 60 and name C  and segid A)  1.0   -65.0  20.0  2
assign (resid 60 and name N  and segid A) (resid 60 and name CA and segid A)
       (resid 60 and name C  and segid A) (resid 61 and name N  and segid A)  1.0   -40.0  30.0  2


assign (resid 61 and name C  and segid A) (resid 62 and name N  and segid A)
       (resid 62 and name CA and segid A) (resid 62 and name C  and segid A)  1.0   -60.0  30.0  2

assign (resid 62 and name C  and segid A) (resid 63 and name N  and segid A)
       (resid 63 and name CA and segid A) (resid 63 and name C  and segid A)  1.0   -100.0  60.0  2

assign (resid 63 and name C  and segid A) (resid 64 and name N  and segid A)
       (resid 64 and name CA and segid A) (resid 64 and name C  and segid A)  1.0   90.0  40.0  2

assign (resid 64 and name C  and segid A) (resid 65 and name N  and segid A)
       (resid 65 and name CA and segid A) (resid 65 and name C  and segid A)  1.0   -90.0  50.0  2

assign (resid 65 and name C  and segid A) (resid 66 and name N  and segid A)
       (resid 66 and name CA and segid A) (resid 66 and name C  and segid A)  1.0    -90.0  80.0  2

assign (resid 66 and name C  and segid A) (resid 67 and name N  and segid A)
       (resid 67 and name CA and segid A) (resid 67 and name C  and segid A)  1.0   -60.0  30.0  2

assign (resid 67 and name C  and segid A) (resid 68 and name N  and segid A)
       (resid 68 and name CA and segid A) (resid 68 and name C  and segid A)  1.0  -75.0  30.0  2
assign (resid 68 and name N  and segid A) (resid 68 and name CA and segid A)
       (resid 68 and name C  and segid A) (resid 69 and name N  and segid A)  1.0   -25.0  30.0  2

assign (resid 68 and name C  and segid A) (resid 69 and name N  and segid A)
       (resid 69 and name CA and segid A) (resid 69 and name C  and segid A)  1.0   -80.0  40.0  2

assign (resid 69 and name C  and segid A) (resid 70 and name N  and segid A)
       (resid 70 and name CA and segid A) (resid 70 and name C  and segid A)  1.0  -130.0  30.0  2
assign (resid 70 and name N  and segid A) (resid 70 and name CA and segid A)
       (resid 70 and name C  and segid A) (resid 71 and name N  and segid A)  1.0   165.0  30.0  2

assign (resid 70 and name C  and segid A) (resid 71 and name N  and segid A)
       (resid 71 and name CA and segid A) (resid 71 and name C  and segid A)  1.0  -90.0  30.0  2
assign (resid 71 and name N  and segid A) (resid 71 and name CA and segid A)
       (resid 71 and name C  and segid A) (resid 72 and name N  and segid A)  1.0   140.0  30.0  2

assign (resid 71 and name C  and segid A) (resid 72 and name N  and segid A)
       (resid 72 and name CA and segid A) (resid 72 and name C  and segid A) 1.0 -60.0 20.0 2
assign (resid 72 and name N  and segid A) (resid 72 and name CA and segid A)
       (resid 72 and name C  and segid A) (resid 73 and name N  and segid A) 1.0 -40.0 20.0 2

assign (resid 72 and name C  and segid A) (resid 73 and name N  and segid A)
       (resid 73 and name CA and segid A) (resid 73 and name C  and segid A) 1.0 -60.0 20.0 2
assign (resid 73 and name N  and segid A) (resid 73 and name CA and segid A)
       (resid 73 and name C  and segid A) (resid 74 and name N  and segid A) 1.0 -40.0 20.0 2

assign (resid 73 and name C  and segid A) (resid 74 and name N  and segid A)
       (resid 74 and name CA and segid A) (resid 74 and name C  and segid A) 1.0 -60.0 20.0 2
assign (resid 74 and name N  and segid A) (resid 74 and name CA and segid A)
       (resid 74 and name C  and segid A) (resid 75 and name N  and segid A) 1.0 -40.0 20.0 2

assign (resid 74 and name C  and segid A) (resid 75 and name N  and segid A)
       (resid 75 and name CA and segid A) (resid 75 and name C  and segid A) 1.0 -60.0 20.0 2
assign (resid 75 and name N  and segid A) (resid 75 and name CA and segid A)
       (resid 75 and name C  and segid A) (resid 76 and name N  and segid A) 1.0 -30.0 20.0 2

assign (resid 75 and name C  and segid A) (resid 76 and name N  and segid A)
       (resid 76 and name CA and segid A) (resid 76 and name C  and segid A) 1.0 -60.0 20.0 2
assign (resid 76 and name N  and segid A) (resid 76 and name CA and segid A)
       (resid 76 and name C  and segid A) (resid 77 and name N  and segid A) 1.0 -30.0 20.0 2

assign (resid 76 and name C  and segid A) (resid 77 and name N  and segid A)
       (resid 77 and name CA and segid A) (resid 77 and name C  and segid A) 1.0 -60.0 20.0 2
assign (resid 77 and name N  and segid A) (resid 77 and name CA and segid A)
       (resid 77 and name C  and segid A) (resid 78 and name N  and segid A) 1.0 -30.0 20.0 2



!!! Interfacial sidechain torsion angles

!E5
assign (resid 5 and name n and segid A)  (resid 5 and name ca and segid A)
       (resid 5 and name cb and segid A) (resid 5 and name cg and segid A) 1.0 -120.0 80.0 2

!E6
assign (resid 6 and name n and segid A)  (resid 6 and name ca and segid A)
       (resid 6 and name cb and segid A) (resid 6 and name cg and segid A) 1.0 -120.0 80.0 2

!V8
assign (resid 8 and name n and segid A)  (resid 8 and name ca and segid A)
       (resid 8 and name cb and segid A) (resid 8 and name cg1 and segid A) 1.0 180.0 25.0 2

!M9
assign (resid 9 and name n and segid A)  (resid 9 and name ca and segid A)
       (resid 9 and name cb and segid A) (resid 9 and name cg and segid A) 1.0 -60.0 25.0 2
assign (resid 9 and name ca and segid A) (resid 9 and name cb and segid A)
       (resid 9 and name cg and segid A) (resid 9 and name sd  and segid A) 1.0 180.0 25.0 2



!I12
assign (resid 12 and name n and segid A)  (resid 12 and name ca and segid A)
       (resid 12 and name cb and segid A) (resid 12 and name cg1 and segid A) 1.0 -60.0 20.0 2
assign (resid 12 and name ca and segid A) (resid 12 and name cb and segid A)
       (resid 12 and name cg1 and segid A) (resid 12 and name cd1 and segid A) 1.0 -60.0 25.0 2

!I13
assign (resid 13 and name n and segid A)  (resid 13 and name ca and segid A)
       (resid 13 and name cb and segid A) (resid 13 and name cg1 and segid A) 1.0 -60.0 35.0 2
assign (resid 13 and name ca and segid A) (resid 13 and name cb and segid A)
       (resid 13 and name cg1 and segid A) (resid 13 and name cd1 and segid A) 1.0 -60.0 35.0 2

!S15
assign (resid 15 and name n and segid A)  (resid 15 and name ca and segid A)
       (resid 15 and name cb and segid A) (resid 15 and name og and segid A) 1.0  60.0 20.0 2

!Q17
assign (resid 17 and name n and segid A)  (resid 17 and name ca and segid A)
       (resid 17 and name cb and segid A) (resid 17 and name cg and segid A) 1.0 -120.0 80.0 2


!R19
assign (resid 19 and name n and segid A)  (resid 19 and name ca and segid A)
       (resid 19 and name cb and segid A) (resid 19 and name cg and segid A) 1.0 180.0 25.0 2


!S20
assign (resid 20 and name n and segid A)  (resid 20 and name ca and segid A)
       (resid 20 and name cb and segid A) (resid 20 and name og and segid A) 1.0  180.0 20.0 2

!L21
assign (resid 21 and name n and segid A)  (resid 21 and name ca and segid A)
       (resid 21 and name cb and segid A) (resid 21 and name cg and segid A) 1.0 -60.0 20.0 2
assign (resid 21 and name ca and segid A) (resid 21 and name cb and segid A)
       (resid 21 and name cg and segid A) (resid 21 and name cd1 and segid A) 1.0 180.0 25.0 2

!Y23
assign (resid 23 and name n and segid A)  (resid 23 and name ca and segid A)
       (resid 23 and name cb and segid A) (resid 23 and name cg and segid A) 1.0 180.0 20.0 2
assign (resid 23 and name ca and segid A) (resid 23 and name cb and segid A)
       (resid 23 and name cg and segid A) (resid 23 and name cd1 and segid A) 1.0 90.0 20.0 2

!Q28
assign (resid 28 and name n and segid A)  (resid 28 and name ca and segid A)
       (resid 28 and name cb and segid A) (resid 28 and name cg and segid A) 1.0 -60.0 25.0 2


!R45
assign (resid 45 and name n and segid A)  (resid 45 and name ca and segid A)
       (resid 45 and name cb and segid A) (resid 45 and name cg and segid A) 1.0 180.0 25.0 2
!       (resid 45 and name cd and segid A) (resid 45 and name ne  and segid A) 1.0 60.0 40.0 2

!M46
assign (resid 46 and name n and segid A)  (resid 46 and name ca and segid A)
       (resid 46 and name cb and segid A) (resid 46 and name cg and segid A) 1.0 -60.0 25.0 2
assign (resid 46 and name ca and segid A) (resid 46 and name cb and segid A)
       (resid 46 and name cg and segid A) (resid 46 and name sd  and segid A) 1.0 180.0 25.0 2

!N49
assign (resid 49 and name n and segid A)  (resid 49 and name ca and segid A)
       (resid 49 and name cb and segid A) (resid 49 and name cg and segid A) 1.0 180.0 20.0 2

!H52
assign (resid 52 and name n and segid A)  (resid 52 and name ca and segid A)
       (resid 52 and name cb and segid A) (resid 52 and name cg and segid A) 1.0 180.0 20.0 2
assign (resid 52 and name ca and segid A)  (resid 52 and name cb and segid A)
       (resid 52 and name cg and segid A) (resid 52 and name ND1 and segid A) 1.0 -80.0 20.0 2

!L53
assign (resid 53 and name n and segid A)  (resid 53 and name ca and segid A)
       (resid 53 and name cb and segid A) (resid 53 and name cg and segid A) 1.0 -60.0 20.0 2
assign (resid 53 and name ca and segid A) (resid 53 and name cb and segid A)
       (resid 53 and name cg and segid A) (resid 53 and name cd1 and segid A) 1.0 180.0 20.0 2


!T56
assign (resid 56 and name n and segid A)  (resid 56 and name ca and segid A)
       (resid 56 and name cb and segid A) (resid 56 and name og1 and segid A) 1.0  -60.0 20.0 2
!K57
assign (resid 57 and name n and segid A)  (resid 57 and name ca and segid A)
       (resid 57 and name cb and segid A) (resid 57 and name cg and segid A) 1.0 180.0 25.0 2


!I59
assign (resid 59 and name n and segid A)  (resid 59 and name ca and segid A)
       (resid 59 and name cb and segid A) (resid 59 and name cg1 and segid A) 1.0 180.0 30.0 2
assign (resid 59 and name ca and segid A) (resid 59 and name cb and segid A)
       (resid 59 and name cg1 and segid A) (resid 59 and name cd1 and segid A) 1.0 180.0 20.0 2

!E60
assign (resid 60 and name n and segid A)  (resid 60 and name ca and segid A)
       (resid 60 and name cb and segid A) (resid 60 and name cg and segid A) 1.0 120.0 85.0 2

!!D62
assign (resid 62 and name n and segid A)  (resid 62 and name ca and segid A)
       (resid 62 and name cb and segid A) (resid 62 and name cg and segid A) 1.0 120.0 80.0 2
!Q65
assign (resid 65 and name n and segid A)  (resid 65 and name ca and segid A)
       (resid 65 and name cb and segid A) (resid 65 and name cg and segid A) 1.0 -60.0 20.0 2

!K67
assign (resid 67 and name n and segid A)  (resid 67 and name ca and segid A)
       (resid 67 and name cb and segid A) (resid 67 and name cg and segid A) 1.0 0.0 85.0 2

!M68
assign (resid 68 and name n and segid A)  (resid 68 and name ca and segid A)
       (resid 68 and name cb and segid A) (resid 68 and name cg and segid A) 1.0 -60.0 20.0 2

!V70
assign (resid 70 and name n and segid A)  (resid 70 and name ca and segid A)
       (resid 70 and name cb and segid A) (resid 70 and name cg1 and segid A) 1.0 -60.0 20.0 2
!S71
assign (resid 71 and name n and segid A)  (resid 71 and name ca and segid A)
       (resid 71 and name cb and segid A) (resid 71 and name og and segid A) 1.0 180.0 20.0 2

!L72
assign (resid 72 and name n and segid A)  (resid 72 and name ca and segid A)
       (resid 72 and name cb and segid A) (resid 72 and name cg and segid A) 1.0 -60.0 20.0 2
assign (resid 72 and name ca and segid A) (resid 72 and name cb and segid A)
       (resid 72 and name cg and segid A) (resid 72 and name cd1 and segid A) 1.0 180.0 20.0 2

!V73
assign (resid 73 and name n and segid A)  (resid 73 and name ca and segid A)
       (resid 73 and name cb and segid A) (resid 73 and name cg1 and segid A) 1.0 -60.0 20.0 2

!L74
assign (resid 74 and name n and segid A)  (resid 74 and name ca and segid A)
       (resid 74 and name cb and segid A) (resid 74 and name cg and segid A) 1.0 180.0 20.0 2
assign (resid 74 and name ca and segid A) (resid 74 and name cb and segid A)
       (resid 74 and name cg and segid A) (resid 74 and name cd1 and segid A) 1.0 60.0 20.0 2

!V75
assign (resid 75 and name n and segid A)  (resid 75 and name ca and segid A)
       (resid 75 and name cb and segid A) (resid 75 and name cg1 and segid A) 1.0 180.0 20.0 2

!E76
assign (resid 76 and name n and segid A)  (resid 76 and name ca and segid A)
       (resid 76 and name cb and segid A) (resid 76 and name cg and segid A) 1.0 180.0 30.0 2
assign (resid 76 and name ca and segid A) (resid 76 and name cb and segid A)
       (resid 76 and name cg and segid A) (resid 76 and name cd and segid A) 1.0 120.0 80.0 2

assign (resid 76 and name cb and segid A) (resid 76 and name cg and segid A)
       (resid 76 and name cd and segid A) (resid 76 and name oe1 and segid A) 1.0 0.0 90.0 2
 
!Q78
assign (resid 78 and name n and segid A)  (resid 78 and name ca and segid A)
       (resid 78 and name cb and segid A) (resid 78 and name cg and segid A) 1.0 180.0 20.0 2
assign (resid 78 and name ca and segid A) (resid 78 and name cb and segid A)
       (resid 78 and name cg and segid A) (resid 78 and name cd and segid A) 1.0 180.0 20.0 2

!L79
assign (resid 79 and name n and segid A)  (resid 79 and name ca and segid A)
       (resid 79 and name cb and segid A) (resid 79 and name cg and segid A) 1.0 180.0 20.0 2
assign (resid 79 and name ca and segid A) (resid 79 and name cb and segid A)
       (resid 79 and name cg and segid A) (resid 79 and name cd1 and segid A) 1.0 60.0 20.0 2

!H80
assign (resid 80 and name n and segid A)  (resid 80 and name ca and segid A)
       (resid 80 and name cb and segid A) (resid 80 and name cg and segid A) 1.0 -60.0 30.0 2
assign (resid 80 and name ca and segid A) (resid 80 and name cb and segid A)
       (resid 80 and name cg and segid A) (resid 80 and name nd1 and segid A) 1.0 -120.0 50.0 2

!M85
assign (resid 85 and name n and segid A)  (resid 85 and name ca and segid A)
       (resid 85 and name cb and segid A) (resid 85 and name cg and segid A) 1.0 180.0 20.0 2
assign (resid 85 and name ca and segid A) (resid 85 and name cb and segid A)
       (resid 85 and name cg and segid A) (resid 85 and name sd and segid A) 1.0 180.0 20.0 2



!2. IIB


!!! IIB 

!active site phi/psi

assign (resid   8 and name C  and segid D)  (resid  9 and name N  and segid D)
       (resid   9  and name CA and segid D) (resid  9 and name C  and segid D)  1.0  -130.0  30.0  2
assign (resid   9  and name N  and segid D) (resid  9 and name CA and segid D)
       (resid   9  and name C  and segid D) (resid 10 and name N  and segid D)  1.0   160.0  40.0  2

assign (resid   9 and name C  and segid D) (resid  10 and name N  and segid D)
       (resid  10 and name CA and segid D) (resid  10 and name C  and segid D)  1.0  -125.0  50.0  2
assign (resid  10 and name N  and segid D) (resid  10 and name CA and segid D)
       (resid  10 and name C  and segid D) (resid  11 and name N  and segid D)  1.0   130.0  20.0  2

assign (resid  10 and name C  and segid D) (resid  11 and name N  and segid D)
       (resid  11 and name CA and segid D) (resid  11 and name C  and segid D)  1.0 -100.0 50.0 2 
assign (resid  11 and name N  and segid D) (resid  11 and name CA and segid D)
       (resid  11 and name C  and segid D) (resid  12 and name N  and segid D)  1.0   90.0 100.0 2 

assign (resid  11 and name C  and segid D) (resid  12 and name N  and segid D)
       (resid  12 and name CA and segid D) (resid  12 and name C  and segid D)  1.0   -110.0  60.0  2
assign (resid  12 and name N  and segid D) (resid  12 and name CA and segid D)
       (resid  12 and name C  and segid D) (resid  13 and name N  and segid D)  1.0    90.0 100.0 2 

assign (resid  12 and name C  and segid D) (resid  13 and name N  and segid D)
       (resid  13 and name CA and segid D) (resid  13 and name C  and segid D)  1.0   -110.0 70.0 2

assign (resid  13 and name C  and segid D) (resid  14 and name N  and segid D)
       (resid  14 and name CA and segid D) (resid  14 and name C  and segid D)  1.0   -80.0 40.0 2 
assign (resid  14 and name N  and segid D) (resid  14 and name CA and segid D)
       (resid  14 and name C  and segid D) (resid  15 and name N  and segid D)  1.0   -40.0  30.0  2

assign (resid  14 and name C  and segid D) (resid  15 and name N  and segid D)
       (resid  15 and name CA and segid D) (resid  15 and name C  and segid D)  1.0   -65.0  20.0  2
assign (resid  15 and name N  and segid D) (resid  15 and name CA and segid D)
       (resid  15 and name C  and segid D) (resid  16 and name N  and segid D)  1.0   -40.0  30.0  2

assign (resid  15 and name C  and segid D) (resid  16 and name N  and segid D)  
       (resid  16 and name CA and segid D) (resid  16 and name C  and segid D)  1.0   -65.0   20.0  2
assign (resid  16 and name N  and segid D) (resid  16 and name CA and segid D)  
       (resid  16 and name C  and segid D) (resid  17 and name N  and segid D)  1.0   -45.0   30.0  2

assign (resid  16 and name C  and segid D) (resid  17 and name N  and segid D)
       (resid  17 and name CA and segid D) (resid  17 and name C  and segid D)  1.0   -60.0   20.0  2
assign (resid  17 and name N  and segid D) (resid  17 and name CA and segid D)
       (resid  17 and name C  and segid D) (resid  18 and name N  and segid D)  1.0   -40.0   30.0  2



!side chain
!F9
assign (resid 9 and name n and segid D)  (resid 9 and name ca and segid D)
       (resid 9 and name cb and segid D) (resid 9 and name cg and segid D) 1.0 -60.0 20.0 2
assign (resid 9 and name ca and segid D) (resid 9 and name cb and segid D)
       (resid 9 and name cg and segid D) (resid 9 and name cd1 and segid D) 1.0 -90.0 20.0 2
!S10
assign (resid 10 and name n and segid D)  (resid 10 and name ca and segid D)
      (resid 10 and name cb and segid D) (resid 10 and name og and segid D) 1.0 120.0 90.0 2

!M14
assign (resid 14 and name n and segid D)  (resid 14 and name ca and segid D) 
       (resid 14 and name cb and segid D) (resid 14 and name cg and segid D) 1.0 180.0 20.0 2 

!S15
assign (resid 15 and name n and segid D)  (resid 15 and name ca and segid D)
       (resid 15 and name cb and segid D) (resid 15 and name og and segid D) 1.0 -120.0 90.0 2
!T16
assign (resid 16 and name n and segid D)  (resid 16 and name ca and segid D)
       (resid 16 and name cb and segid D) (resid 16 and name og1 and segid D) 1.0 -60.0 20.0 2


!S17
assign (resid 17 and name n and segid D)  (resid 17 and name ca and segid D)
       (resid 17 and name cb and segid D) (resid 17 and name og and segid D) 1.0 -60.0 20.0 2

!L18
assign (resid 18 and name n and segid D)  (resid 18 and name ca and segid D)
       (resid 18 and name cb and segid D) (resid 18 and name cg and segid D) 1.0 180.0 20.0 2
assign (resid 18 and name ca and segid D) (resid 18 and name cb and segid D)
       (resid 18 and name cg and segid D) (resid 18 and name cd1 and segid D) 1.0 60.0 20.0 2

!L19
assign (resid 19 and name n and segid D)  (resid 19 and name ca and segid D)
       (resid 19 and name cb and segid D) (resid 19 and name cg and segid D) 1.0 180.0 20.0 2
assign (resid 19 and name ca and segid D) (resid 19 and name cb and segid D)
       (resid 19 and name cg and segid D) (resid 19 and name cd1 and segid D) 1.0 60.0 20.0 2

!V20
assign (resid 20 and name n and segid D)  (resid 20 and name ca and segid D)
       (resid 20 and name cb and segid D) (resid 20 and name cg1 and segid D) 1.0  180.0 20.0 2


!S21
assign (resid 21 and name n and segid D)  (resid 21 and name ca and segid D)
       (resid 21 and name cb and segid D) (resid 21 and name og and segid D) 1.0  60.0 30.0 2

!K22
assign (resid 22 and name n and segid D)  (resid 22 and name ca and segid D)
       (resid 22 and name cb and segid D) (resid 22 and name cg and segid D) 1.0  -120.0 80.0 2

!R24
assign (resid 24 and name n and segid D)  (resid 24 and name ca and segid D)
       (resid 24 and name cb and segid D) (resid 24 and name cg and segid D) 1.0  -120.0 80.0 2


!E37
assign (resid 37 and name n and segid D)  (resid 37 and name ca and segid D)
       (resid 37 and name cb and segid D) (resid 37 and name cg and segid D) 1.0  -60.0 20.0 2

!Y39
assign (resid 39 and name n and segid D)  (resid 39 and name ca and segid D)
       (resid 39 and name cb and segid D) (resid 39 and name cg and segid D) 1.0 -60.0 20.0 2
assign (resid 39 and name ca and segid D) (resid 39 and name cb and segid D)
       (resid 39 and name cg and segid D) (resid 39 and name cd1 and segid D) 1.0 -90.0 20.0 2

!E41
assign (resid 41 and name n and segid D)  (resid 41 and name ca and segid D)
       (resid 41 and name cb and segid D) (resid 41 and name cg and segid D) 1.0  60.0 20.0 2

!T42
assign (resid 42 and name n and segid D)  (resid 42 and name ca and segid D)
       (resid 42 and name cb and segid D) (resid 42 and name og1 and segid D) 1.0 60.0 20.0 2

!L43
assign (resid 43 and name n and segid D)  (resid 43 and name ca and segid D)
       (resid 43 and name cb and segid D) (resid 43 and name cg and segid D) 1.0 -60.0 20.0 2
assign (resid 43 and name ca and segid D) (resid 43 and name cb and segid D)
       (resid 43 and name cg and segid D) (resid 43 and name cd1 and segid D) 1.0 180.0 20.0 2

!E46
assign (resid 46 and name n and segid D)  (resid 46 and name ca and segid D)
       (resid 46 and name cb and segid D) (resid 46 and name cg and segid D) 1.0  -120.0 80.0 2

!K47
assign (resid 47 and name n and segid D)  (resid 47 and name ca and segid D)
       (resid 47 and name cb and segid D) (resid 47 and name cg and segid D) 1.0  -120.0 80.0 2


!Q59
assign (resid 59 and name n and segid D)  (resid 59 and name ca and segid D)
       (resid 59 and name cb and segid D) (resid 59 and name cg and segid D) 1.0  -120.0 80.0 2


!I60
assign (resid 60 and name n and segid D)  (resid 60 and name ca and segid D)
       (resid 60 and name cb and segid D) (resid 60 and name cg1 and segid D) 1.0   60.0 30.0 2
assign (resid 60 and name ca and segid D) (resid 60 and name cb and segid D)
       (resid 60 and name cg1 and segid D) (resid 60 and name cd1 and segid D) 1.0 180.0 40.0 2


!Y62
assign (resid 62 and name n and segid D)  (resid 62 and name ca and segid D)
       (resid 62 and name cb and segid D) (resid 62 and name cg and segid D) 1.0  70.0 20.0 2
assign (resid 62 and name ca and segid D) (resid 62 and name cb and segid D)
       (resid 62 and name cg and segid D) (resid 62 and name cd1 and segid D) 1.0 -90.0 20.0 2

!M63
assign (resid 63 and name n and segid D)  (resid 63 and name ca and segid D)
       (resid 63 and name cb and segid D) (resid 63 and name cg and segid D) 1.0 -60.0 20.0 2
assign (resid 63 and name ca and segid D)  (resid 63 and name cb and segid D)
       (resid 63 and name cg and segid D) (resid 63 and name sd and segid D) 1.0 180.0 20.0 2

!S81
assign (resid 81 and name n and segid D)  (resid 81 and name ca and segid D)
       (resid 81 and name cb and segid D) (resid 81 and name og and segid D) 1.0  60.0 20.0 2

!L82
assign (resid 82 and name n and segid D)  (resid 82 and name ca and segid D)
       (resid 82 and name cb and segid D) (resid 82 and name cg and segid D) 1.0 -60.0 20.0 2
assign (resid 82 and name ca and segid D) (resid 82 and name cb and segid D)
       (resid 82 and name cg and segid D) (resid 82 and name cd1 and segid D) 1.0 180.0 20.0 2


!Y84
assign (resid 84 and name n and segid D)  (resid 84 and name ca and segid D)
       (resid 84 and name cb and segid D) (resid 84 and name cg and segid D) 1.0 180.0  25.0 2
assign (resid 84 and name ca and segid D) (resid 84 and name cb and segid D)
       (resid 84 and name cg and segid D) (resid 84 and name cd1 and segid D) 1.0 -90.0 30.0 2

!K86
assign (resid 86 and name n and segid D)  (resid 86 and name ca and segid D)
       (resid 86 and name cb and segid D) (resid 86 and name cg and segid D) 1.0  -120.0 80.0 2

!V87
assign (resid 87 and name n and segid D)  (resid 87 and name ca and segid D)
       (resid 87 and name cb and segid D) (resid 87 and name cg1 and segid D) 1.0 180.0 30.0 2



C. Torsion angle restraints for phosphoryl transition state

!1. IIA as for unphosphorylated complex except active site His76 (His89 in true numbering of IIBChb)
!H76
assign (resid 76 and name n and segid A)  (resid 76 and name ca and segid A)
       (resid 76 and name cb and segid A) (resid 76 and name cg and segid A) 1.0 180.0 30.0 2

!2. IIB active site loop phi/psi

assign (resid   8 and name C  and segid D)  (resid  9 and name N  and segid D)
       (resid   9  and name CA and segid D) (resid  9 and name C  and segid D)  1.0  -130.0  30.0  2
assign (resid   9  and name N  and segid D) (resid  9 and name CA and segid D)
       (resid   9  and name C  and segid D) (resid 10 and name N  and segid D)  1.0   160.0  40.0  2

assign (resid   9 and name C  and segid D) (resid  10 and name N  and segid D)
       (resid  10 and name CA and segid D) (resid  10 and name C  and segid D)  1.0  -125.0  50.0  2
assign (resid  10 and name N  and segid D) (resid  10 and name CA and segid D)
       (resid  10 and name C  and segid D) (resid  11 and name N  and segid D)  1.0   150.0  50.0  2

assign (resid  10 and name C  and segid D) (resid  11 and name N  and segid D)
       (resid  11 and name CA and segid D) (resid  11 and name C  and segid D)  1.0 -65.0 15.0 2 
assign (resid  11 and name N  and segid D) (resid  11 and name CA and segid D)
       (resid  11 and name C  and segid D) (resid  12 and name N  and segid D)  1.0   -30.0 20.0 2 

assign (resid  11 and name C  and segid D) (resid  12 and name N  and segid D)
       (resid  12 and name CA and segid D) (resid  12 and name C  and segid D)  1.0   -100.0  30.0  2
assign (resid  12 and name N  and segid D) (resid  12 and name CA and segid D)
       (resid  12 and name C  and segid D) (resid  13 and name N  and segid D)  1.0    10.0 50.0 2 

assign (resid  12 and name C  and segid D) (resid  13 and name N  and segid D)
       (resid  13 and name CA and segid D) (resid  13 and name C  and segid D)  1.0   110.0 70.0 2

assign (resid  13 and name C  and segid D) (resid  14 and name N  and segid D)
       (resid  14 and name CA and segid D) (resid  14 and name C  and segid D)  1.0   -95.0 30.0 2 

assign (resid  14 and name C  and segid D) (resid  15 and name N  and segid D)
       (resid  15 and name CA and segid D) (resid  15 and name C  and segid D)  1.0   -65.0  20.0  2
assign (resid  15 and name N  and segid D) (resid  15 and name CA and segid D)
       (resid  15 and name C  and segid D) (resid  16 and name N  and segid D)  1.0   -40.0  20.0  2

assign (resid  15 and name C  and segid D) (resid  16 and name N  and segid D)
       (resid  16 and name CA and segid D) (resid  16 and name C  and segid D)  1.0   -75.0   30.0  2
assign (resid  16 and name N  and segid D) (resid  16 and name CA and segid D)
       (resid  16 and name C  and segid D) (resid  17 and name N  and segid D)  1.0   -30.0   20.0  2

assign (resid  16 and name C  and segid D) (resid  17 and name N  and segid D)
       (resid  17 and name CA and segid D) (resid  17 and name C  and segid D)  1.0   -60.0   20.0  2
assign (resid  17 and name N  and segid D) (resid  17 and name CA and segid D)
       (resid  17 and name C  and segid D) (resid  18 and name N  and segid D)  1.0   -40.0   30.0  2


!3. IIB interfacial side chains: same as for unphosphorylated complex

D. Calpha/Cbeta chemical shift restraints for active site loop in unphosphorylated complex
 
!F9
assign (resid  8 and name c  and segid D) (resid 9 and name n  and segid D)
       (resid  9 and name ca and segid D) (resid 9 and name c  and segid D)
       (resid  10 and name n  and segid D)                            56.19 41.0

! S10
assign (resid  9 and name c  and segid D) (resid  10 and name n  and segid D)
       (resid  10 and name ca and segid D) (resid 10 and name c  and segid D)
       (resid  11 and name n  and segid D)                            57.17 65.0

! S11
assign (resid  10 and name c  and segid D) (resid 11 and name n  and segid D)
       (resid  11 and name ca and segid D) (resid 11 and name c  and segid D)
       (resid  12 and name n  and segid D)                            57.86 63.71

! A12
assign (resid  11 and name c  and segid D) (resid 12 and name n  and segid D)
       (resid  12 and name ca and segid D) (resid 12 and name c  and segid D)
       (resid  13 and name n  and segid D)                            52.41 19.13

! G13
assign (resid  12 and name c  and segid D) (resid 13 and name n  and segid D)
       (resid  13 and name ca and segid D) (resid 13 and name c  and segid D)
       (resid  14 and name n  and segid D)                            46.42 0.0

! M14
assign (resid  13 and name c  and segid D) (resid 14 and name n  and segid D)
       (resid  14 and name ca and segid D) (resid 14 and name c  and segid D)
       (resid  15 and name n  and segid D)                            58.12 32.02

! S15
assign (resid  14 and name c  and segid D) (resid 15 and name n  and segid D)
       (resid  15 and name ca and segid D) (resid 15 and name c  and segid D)
       (resid  16 and name n  and segid D)                            61.53 62.38

! T16
assign (resid  15 and name c  and segid D) (resid 16 and name n  and segid D)
       (resid  16 and name ca and segid D) (resid 16 and name c  and segid D)
       (resid  17 and name n  and segid D)                            65.85 68.55


!E. Calpha/Cbeta chemical shift restraints for active site loop of IIB in transition state
!taken from shifts of free phosphorylated IIBChb

!F9
assign (resid  8 and name c  and segid D) (resid 9 and name n  and segid D)
       (resid  9 and name ca and segid D) (resid 9 and name c  and segid D)
       (resid  10 and name n  and segid D)                           56.25 43.19

! S11
assign (resid  10 and name c  and segid D) (resid 11 and name n  and segid D)
       (resid  11 and name ca and segid D) (resid 11 and name c  and segid D)
       (resid  12 and name n  and segid D)                            63.8 63.2

! A12
assign (resid  11 and name c  and segid D) (resid 12 and name n  and segid D)
       (resid  12 and name ca and segid D) (resid 12 and name c  and segid D)
       (resid  13 and name n  and segid D)                            52.25 19.93

! G13
assign (resid  12 and name c  and segid D) (resid 13 and name n  and segid D)
       (resid  13 and name ca and segid D) (resid 13 and name c  and segid D)
       (resid  14 and name n  and segid D)                            45.16 0.0

! M14
assign (resid  13 and name c  and segid D) (resid 14 and name n  and segid D)
       (resid  14 and name ca and segid D) (resid 14 and name c  and segid D)
       (resid  15 and name n  and segid D)                            56.77 34.43

! S15
assign (resid  14 and name c  and segid D) (resid 15 and name n  and segid D)
       (resid  15 and name ca and segid D) (resid 15 and name c  and segid D)
       (resid  16 and name n  and segid D)                            62.24 62.13

! T16
assign (resid  15 and name c  and segid D) (resid 16 and name n  and segid D)
       (resid  16 and name ca and segid D) (resid 16 and name c  and segid D)
       (resid  17 and name n  and segid D)                            62.30 69.02




!F. RDCs for free IIBChb used in the calculation of the unphoshprylated complex

!1. 100 mM NaCl/10 mg/ml pf1


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid   6  and name N and segid D   )
       ( resid   6  and name HN and segid D  )    15.630     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid   7  and name N and segid D   )
       ( resid   7  and name HN and segid D  )    23.111     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid   8  and name N and segid D   )
       ( resid   8  and name HN and segid D  )    -1.703     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid   9  and name N and segid D   )
       ( resid   9  and name HN and segid D  )    -6.082     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  10  and name N and segid D   )
       ( resid  10  and name HN and segid D  )   -10.400     0.700


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  11  and name N and segid D   )
       ( resid  11  and name HN and segid D  )    -9.305     0.700


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  12  and name N and segid D   )
       ( resid  12  and name HN and segid D  )    -8.150     0.700



assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  13  and name N and segid D   )
       ( resid  13  and name HN and segid D  )    -2.980     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  16  and name N and segid D   )
       ( resid  16  and name HN and segid D  )   -24.936     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  17  and name N and segid D   )
       ( resid  17  and name HN and segid D  )   -35.093     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  19  and name N and segid D   )
       ( resid  19  and name HN and segid D  )   -36.187     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  20  and name N and segid D   )
       ( resid  20  and name HN and segid D  )   -37.951     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  21  and name N and segid D   )
       ( resid  21  and name HN and segid D  )   -34.910     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  22  and name N and segid D   )
       ( resid  22  and name HN and segid D  )   -42.817     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  24  and name N and segid D   )
       ( resid  24  and name HN and segid D  )   -32.964     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  26  and name N and segid D   )
       ( resid  26  and name HN and segid D  )   -39.228     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  28  and name N and segid D   )
       ( resid  28  and name HN and segid D  )   -23.963     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  30  and name N and segid D   )
       ( resid  30  and name HN and segid D  )   -36.005     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  31  and name N and segid D   )
       ( resid  31  and name HN and segid D  )    14.657     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  32  and name N and segid D   )
       ( resid  32  and name HN and segid D  )    20.496     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  34  and name N and segid D   )
       ( resid  34  and name HN and segid D  )    47.804     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  35  and name N and segid D   )
       ( resid  35  and name HN and segid D  )    35.153     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  36  and name N and segid D   )
       ( resid  36  and name HN and segid D  )    15.266     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  37  and name N and segid D   )
       ( resid  37  and name HN and segid D  )    16.786     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  38  and name N and segid D   )
       ( resid  38  and name HN and segid D  )     9.123     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  39  and name N and segid D   )
       ( resid  39  and name HN and segid D  )    -6.568     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  41  and name N and segid D   )
       ( resid  41  and name HN and segid D  )    22.503     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  42  and name N and segid D   )
       ( resid  42  and name HN and segid D  )    42.512     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  43  and name N and segid D   )
       ( resid  43  and name HN and segid D  )    45.006     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  44  and name N and segid D   )
       ( resid  44  and name HN and segid D  )   -21.956     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  47  and name N and segid D   )
       ( resid  47  and name HN and segid D  )   -21.469     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  48  and name N and segid D   )
       ( resid  48  and name HN and segid D  )   -39.836     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  49  and name N and segid D   )
       ( resid  49  and name HN and segid D  )   -23.354     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  50  and name N and segid D   )
       ( resid  50  and name HN and segid D  )    -8.393     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  51  and name N and segid D   )
       ( resid  51  and name HN and segid D  )   -20.314     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  52  and name N and segid D   )
       ( resid  52  and name HN and segid D  )    44.824     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  53  and name N and segid D   )
       ( resid  53  and name HN and segid D  )     8.515     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  54  and name N and segid D   )
       ( resid  54  and name HN and segid D  )    13.441     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  55  and name N and segid D   )
       ( resid  55  and name HN and segid D  )    -6.751     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  56  and name N and segid D   )
       ( resid  56  and name HN and segid D  )    -5.170     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  57  and name N and segid D   )
       ( resid  57  and name HN and segid D  )    -2.554     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  59  and name N and segid D   )
       ( resid  59  and name HN and segid D  )   -10.583     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  60  and name N and segid D   )
       ( resid  60  and name HN and segid D  )   -33.815     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  61  and name N and segid D   )
       ( resid  61  and name HN and segid D  )    48.412     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  62  and name N and segid D   )
       ( resid  62  and name HN and segid D  )    35.944     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  66  and name N and segid D   )
       ( resid  66  and name HN and segid D  )    33.390     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  67  and name N and segid D   )
       ( resid  67  and name HN and segid D  )    21.043     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  68  and name N and segid D   )
       ( resid  68  and name HN and segid D  )    -9.427     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  69  and name N and segid D   )
       ( resid  69  and name HN and segid D  )    -3.710     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  70  and name N and segid D   )
       ( resid  70  and name HN and segid D  )    32.721     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  71  and name N and segid D   )
       ( resid  71  and name HN and segid D  )    -1.764     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  73  and name N and segid D   )
       ( resid  73  and name HN and segid D  )   -14.049     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  76  and name N and segid D   )
       ( resid  76  and name HN and segid D  )    11.495     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  77  and name N and segid D   )
       ( resid  77  and name HN and segid D  )    -3.223     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  78  and name N and segid D   )
       ( resid  78  and name HN and segid D  )    -2.676     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  79  and name N and segid D   )
       ( resid  79  and name HN and segid D  )   -12.225     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  80  and name N and segid D   )
       ( resid  80  and name HN and segid D  )   -40.201     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  81  and name N and segid D   )
       ( resid  81  and name HN and segid D  )    13.198     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  82  and name N and segid D   )
       ( resid  82  and name HN and segid D  )    22.990     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  83  and name N and segid D   )
       ( resid  83  and name HN and segid D  )    36.248     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  84  and name N and segid D   )
       ( resid  84  and name HN and segid D  )    15.205     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  85  and name N and segid D   )
       ( resid  85  and name HN and segid D  )     8.697     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  86  and name N and segid D   )
       ( resid  86  and name HN and segid D  )    35.093     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  88  and name N and segid D   )
       ( resid  88  and name HN and segid D  )   -17.881     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  89  and name N and segid D   )
       ( resid  89  and name HN and segid D  )    46.222     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  90  and name N and segid D   )
       ( resid  90  and name HN and segid D  )    45.736     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  91  and name N and segid D   )
       ( resid  91  and name HN and segid D  )    39.958     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  92  and name N and segid D   )
       ( resid  92  and name HN and segid D  )    41.661     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  94  and name N and segid D   )
       ( resid  94  and name HN and segid D  )    48.716     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  95  and name N and segid D   )
       ( resid  95  and name HN and segid D  )    32.660     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  97  and name N and segid D   )
       ( resid  97  and name HN and segid D  )    53.582     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  98  and name N and segid D   )
       ( resid  98  and name HN and segid D  )    35.336     0.700

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid 100  and name N and segid D   )
       ( resid 100  and name HN and segid D  )    45.493     0.700


!2. 400 mM NaCl/17 mg/ml pf1


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid   3  and name N and segid D   )
       ( resid   3  and name HN and segid D  )     5.717     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid   4  and name N and segid D   )
       ( resid   4  and name HN and segid D  )     2.494     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid   5  and name N and segid D   )
       ( resid   5  and name HN and segid D  )     8.575     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid   6  and name N and segid D   )
       ( resid   6  and name HN and segid D  )     3.953     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid   7  and name N and segid D   )
       ( resid   7  and name HN and segid D  )    12.650     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid   8  and name N and segid D   )
       ( resid   8  and name HN and segid D  )     9.549     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid   9  and name N and segid D   )
       ( resid   9  and name HN and segid D  )    12.590     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  10  and name N and segid D   )
       ( resid  10  and name HN and segid D  )    10.096     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  11  and name N and segid D   )
       ( resid  11  and name HN and segid D  )     6.386     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  12  and name N and segid D   )
       ( resid  12  and name HN and segid D  )    -1.581     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  13  and name N and segid D   )
       ( resid  13  and name HN and segid D  )    -3.345     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  16  and name N and segid D   )
       ( resid  16  and name HN and segid D  )    -9.062     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  17  and name N and segid D   )
       ( resid  17  and name HN and segid D  )   -10.583     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  18  and name N and segid D   )
       ( resid  18  and name HN and segid D  )   -15.509     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  19  and name N and segid D   )
       ( resid  19  and name HN and segid D  )   -17.333     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  20  and name N and segid D   )
       ( resid  20  and name HN and segid D  )   -14.840     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  21  and name N and segid D   )
       ( resid  21  and name HN and segid D  )   -13.198     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  22  and name N and segid D   )
       ( resid  22  and name HN and segid D  )    -16.143     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  23  and name N and segid D   )
       ( resid  23  and name HN and segid D  )   -16.360     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  24  and name N and segid D   )
       ( resid  24  and name HN and segid D  )   -10.522     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  25  and name N and segid D   )
       ( resid  25  and name HN and segid D  )   -14.779     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  26  and name N and segid D   )
       ( resid  26  and name HN and segid D  )   -16.969     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  27  and name N and segid D   )
       ( resid  27  and name HN and segid D  )   -12.772     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  28  and name N and segid D   )
       ( resid  28  and name HN and segid D  )    -9.244     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  29  and name N and segid D   )
       ( resid  29  and name HN and segid D  )   -16.421     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  30  and name N and segid D   )
       ( resid  30  and name HN and segid D  )   -16.482     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  31  and name N and segid D   )
       ( resid  31  and name HN and segid D  )     7.116     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  32  and name N and segid D   )
       ( resid  32  and name HN and segid D  )     5.778     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  34  and name N and segid D   )
       ( resid  34  and name HN and segid D  )     4.561     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  35  and name N and segid D   )
       ( resid  35  and name HN and segid D  )     7.055     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  36  and name N and segid D   )
       ( resid  36  and name HN and segid D  )     4.926     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  37  and name N and segid D   )
       ( resid  37  and name HN and segid D  )    10.400     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  38  and name N and segid D   )
       ( resid  38  and name HN and segid D  )    11.495     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  39  and name N and segid D   )
       ( resid  39  and name HN and segid D  )    12.650     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  41  and name N and segid D   )
       ( resid  41  and name HN and segid D  )     2.007     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  42  and name N and segid D   )
       ( resid  42  and name HN and segid D  )     8.332     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  43  and name N and segid D   )
       ( resid  43  and name HN and segid D  )     3.284     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  44  and name N and segid D   )
       ( resid  44  and name HN and segid D  )    -9.427     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  47  and name N and segid D   )
       ( resid  47  and name HN and segid D  )    -8.271     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  48  and name N and segid D   )
       ( resid  48  and name HN and segid D  )   -15.691     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  49  and name N and segid D   )
       ( resid  49  and name HN and segid D  )    -2.372     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  50  and name N and segid D   )
       ( resid  50  and name HN and segid D  )    -0.730     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  51  and name N and segid D   )
       ( resid  51  and name HN and segid D  )   -14.657     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  52  and name N and segid D   )
       ( resid  52  and name HN and segid D  )     7.481     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  53  and name N and segid D   )
       ( resid  53  and name HN and segid D  )    15.752     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  54  and name N and segid D   )
       ( resid  54  and name HN and segid D  )    12.042     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  55  and name N and segid D   )
       ( resid  55  and name HN and segid D  )    12.833     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  56  and name N and segid D   )
       ( resid  56  and name HN and segid D  )    10.218     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  57  and name N and segid D   )
       ( resid  57  and name HN and segid D  )     7.542     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  59  and name N and segid D   )
       ( resid  59  and name HN and segid D  )    -2.494     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  60  and name N and segid D   )
       ( resid  60  and name HN and segid D  )   -16.117     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  61  and name N and segid D   )
       ( resid  61  and name HN and segid D  )     4.318     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  62  and name N and segid D   )
       ( resid  62  and name HN and segid D  )     7.359     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  63  and name N and segid D   )
       ( resid  63  and name HN and segid D  )     1.764     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  64  and name N and segid D   )
       ( resid  64  and name HN and segid D  )     5.778     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  66  and name N and segid D   )
       ( resid  66  and name HN and segid D  )     3.771     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  67  and name N and segid D   )
       ( resid  67  and name HN and segid D  )     5.535     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  68  and name N and segid D   )
       ( resid  68  and name HN and segid D  )    -1.095     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  69  and name N and segid D   )
       ( resid  69  and name HN and segid D  )    -3.467     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  70  and name N and segid D   )
       ( resid  70  and name HN and segid D  )     4.501     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  71  and name N and segid D   )
       ( resid  71  and name HN and segid D  )     3.892     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  73  and name N and segid D   )
       ( resid  73  and name HN and segid D  )     6.021     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  76  and name N and segid D   )
       ( resid  76  and name HN and segid D  )    11.373     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  77  and name N and segid D   )
       ( resid  77  and name HN and segid D  )    10.704     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  78  and name N and segid D   )
       ( resid  78  and name HN and segid D  )    13.259     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  79  and name N and segid D   )
       ( resid  79  and name HN and segid D  )     3.163     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  80  and name N and segid D   )
       ( resid  80  and name HN and segid D  )   -13.928     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  81  and name N and segid D   )
       ( resid  81  and name HN and segid D  )     4.501     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  84  and name N and segid D   )
       ( resid  84  and name HN and segid D  )     4.136     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  85  and name N and segid D   )
       ( resid  85  and name HN and segid D  )    10.339     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  86  and name N and segid D   )
       ( resid  86  and name HN and segid D  )    10.826     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  89  and name N and segid D   )
       ( resid  89  and name HN and segid D  )     7.055     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  90  and name N and segid D   )
       ( resid  90  and name HN and segid D  )     4.683     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  91  and name N and segid D   )
       ( resid  91  and name HN and segid D  )     5.656     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  92  and name N and segid D   )
       ( resid  92  and name HN and segid D  )    10.826     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  93  and name N and segid D   )
       ( resid  93  and name HN and segid D  )     6.751     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  94  and name N and segid D   )
       ( resid  94  and name HN and segid D  )     6.204     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  95  and name N and segid D   )
       ( resid  95  and name HN and segid D  )     7.785     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  96  and name N and segid D   )
       ( resid  96  and name HN and segid D  )     7.481     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  97  and name N and segid D   )
       ( resid  97  and name HN and segid D  )     5.656     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  98  and name N and segid D   )
       ( resid  98  and name HN and segid D  )     4.440     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  99  and name N and segid D   )
       ( resid  99  and name HN and segid D  )     8.819     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 100  and name N and segid D   )
       ( resid 100  and name HN and segid D  )     4.257     1.000


!G. RDCs for phosphorylated IIBChb used in the calculation on the phosphoryl transition state

!1. 100 mM NaCl/10mg/ml phage pf1


assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid   4  and name N and segid D   )
       ( resid   4  and name HN and segid D  )    40.520     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid   5  and name N and segid D   )
       ( resid   5  and name HN and segid D  )     2.700     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid   6  and name N and segid D   )
       ( resid   6  and name HN and segid D  )    -5.230     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid   8  and name N and segid D   )
       ( resid   8  and name HN and segid D  )     3.290     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid   9  and name N and segid D   )
       ( resid   9  and name HN and segid D  )     7.680     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  10  and name N and segid D   )
       ( resid  10  and name HN and segid D  )    28.890     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  11  and name N and segid D   )
       ( resid  11  and name HN and segid D  )    24.400     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  12  and name N and segid D   )
       ( resid  12  and name HN and segid D  )    35.600     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  13  and name N and segid D   )
       ( resid  13  and name HN and segid D  )    -0.070     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  14  and name N and segid D   )
       ( resid  14  and name HN and segid D  )   -17.110     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  16  and name N and segid D   )
       ( resid  16  and name HN and segid D  )    34.690     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  17  and name N and segid D   )
       ( resid  17  and name HN and segid D  )   -22.250     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  19  and name N and segid D   )
       ( resid  19  and name HN and segid D  )   -15.050     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  20  and name N and segid D   )
       ( resid  20  and name HN and segid D  )   -18.120     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  21  and name N and segid D   )
       ( resid  21  and name HN and segid D  )   -39.670     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  23  and name N and segid D   )
       ( resid  23  and name HN and segid D  )   -14.270     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  24  and name N and segid D   )
       ( resid  24  and name HN and segid D  )   -32.400     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  26  and name N and segid D   )
       ( resid  26  and name HN and segid D  )   -17.380     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  28  and name N and segid D   )
       ( resid  28  and name HN and segid D  )   -37.160     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  30  and name N and segid D   )
       ( resid  30  and name HN and segid D  )   -14.920     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  32  and name N and segid D   )
       ( resid  32  and name HN and segid D  )   -24.900     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  34  and name N and segid D   )
       ( resid  34  and name HN and segid D  )    19.210     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  35  and name N and segid D   )
       ( resid  35  and name HN and segid D  )     1.080     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  36  and name N and segid D   )
       ( resid  36  and name HN and segid D  )    -1.670     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  37  and name N and segid D   )
       ( resid  37  and name HN and segid D  )    -5.760     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  38  and name N and segid D   )
       ( resid  38  and name HN and segid D  )    -5.470     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  39  and name N and segid D   )
       ( resid  39  and name HN and segid D  )     0.840     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  42  and name N and segid D   )
       ( resid  42  and name HN and segid D  )   -11.410     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  43  and name N and segid D   )
       ( resid  43  and name HN and segid D  )    33.180     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  45  and name N and segid D   )
       ( resid  45  and name HN and segid D  )   -34.850     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  46  and name N and segid D   )
       ( resid  46  and name HN and segid D  )   -26.700     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  48  and name N and segid D   )
       ( resid  48  and name HN and segid D  )   -21.370     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  51  and name N and segid D   )
       ( resid  51  and name HN and segid D  )    -3.820     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  52  and name N and segid D   )
       ( resid  52  and name HN and segid D  )     4.990     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  53  and name N and segid D   )
       ( resid  53  and name HN and segid D  )    -8.110     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  54  and name N and segid D   )
       ( resid  54  and name HN and segid D  )    -9.440     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  55  and name N and segid D   )
       ( resid  55  and name HN and segid D  )    -1.840     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  56  and name N and segid D   )
       ( resid  56  and name HN and segid D  )    -2.570     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  62  and name N and segid D   )
       ( resid  62  and name HN and segid D  )   -15.500     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  64  and name N and segid D   )
       ( resid  64  and name HN and segid D  )    18.450     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  66  and name N and segid D   )
       ( resid  66  and name HN and segid D  )    -1.340     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  67  and name N and segid D   )
       ( resid  67  and name HN and segid D  )    18.200     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  68  and name N and segid D   )
       ( resid  68  and name HN and segid D  )   -10.290     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  69  and name N and segid D   )
       ( resid  69  and name HN and segid D  )   -28.510     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  70  and name N and segid D   )
       ( resid  70  and name HN and segid D  )     8.450     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  71  and name N and segid D   )
       ( resid  71  and name HN and segid D  )     3.430     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  73  and name N and segid D   )
       ( resid  73  and name HN and segid D  )     3.550     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  76  and name N and segid D   )
       ( resid  76  and name HN and segid D  )    -5.610     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  77  and name N and segid D   )
       ( resid  77  and name HN and segid D  )    -4.470     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  78  and name N and segid D   )
       ( resid  78  and name HN and segid D  )    -2.920     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  79  and name N and segid D   )
       ( resid  79  and name HN and segid D  )    -0.260     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  82  and name N and segid D   )
       ( resid  82  and name HN and segid D  )   -15.670     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  83  and name N and segid D   )
       ( resid  83  and name HN and segid D  )    -3.010     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  84  and name N and segid D   )
       ( resid  84  and name HN and segid D  )    -5.060     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  85  and name N and segid D   )
       ( resid  85  and name HN and segid D  )     5.200     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  86  and name N and segid D   )
       ( resid  86  and name HN and segid D  )   -13.970     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  88  and name N and segid D   )
       ( resid  88  and name HN and segid D  )    -9.380     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  89  and name N and segid D   )
       ( resid  89  and name HN and segid D  )    -0.590     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  90  and name N and segid D   )
       ( resid  90  and name HN and segid D  )     8.980     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  92  and name N and segid D   )
       ( resid  92  and name HN and segid D  )   -13.080     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  93  and name N and segid D   )
       ( resid  93  and name HN and segid D  )    13.280     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  94  and name N and segid D   )
       ( resid  94  and name HN and segid D  )     6.000     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  95  and name N and segid D   )
       ( resid  95  and name HN and segid D  )   -18.900     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  96  and name N and segid D   )
       ( resid  96  and name HN and segid D  )    -0.280     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  97  and name N and segid D   )
       ( resid  97  and name HN and segid D  )    16.890     1.000

assign ( resid 500  and name OO  )
       ( resid 500  and name Z   )
       ( resid 500  and name X   )
       ( resid 500  and name Y   )
       ( resid  98  and name N and segid D   )
       ( resid  98  and name HN and segid D  )   -10.420     1.000

!2. 200 mM NaCl/15 mg/ml pf1

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid   4  and name N and segid D   )
       ( resid   4  and name HN and segid D  )    15.120     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid   5  and name N and segid D   )
       ( resid   5  and name HN and segid D  )    -1.100     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid   6  and name N and segid D   )
       ( resid   6  and name HN and segid D  )    -0.450     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid   8  and name N and segid D   )
       ( resid   8  and name HN and segid D  )     1.630     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid   9  and name N and segid D   )
       ( resid   9  and name HN and segid D  )     8.740     1.000


assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  10  and name N and segid D   )
       ( resid  10  and name HN and segid D  )    16.290     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  11  and name N and segid D   )
       ( resid  11  and name HN and segid D  )    12.950     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  12  and name N and segid D   )
       ( resid  12  and name HN and segid D  )    16.940     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  13  and name N and segid D   )
       ( resid  13  and name HN and segid D  )     4.100     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  14  and name N and segid D   )
       ( resid  14  and name HN and segid D  )    -7.390     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  16  and name N and segid D   )
       ( resid  16  and name HN and segid D  )    12.350     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  17  and name N and segid D   )
       ( resid  17  and name HN and segid D  )   -11.360     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  19  and name N and segid D   )
       ( resid  19  and name HN and segid D  )   -11.060     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  20  and name N and segid D   )
       ( resid  20  and name HN and segid D  )   -12.320     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  21  and name N and segid D   )
       ( resid  21  and name HN and segid D  )   -18.390     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  22  and name N and segid D   )
       ( resid  22  and name HN and segid D  )   -13.410     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  23  and name N and segid D   )
       ( resid  23  and name HN and segid D  )    -8.550     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  24  and name N and segid D   )
       ( resid  24  and name HN and segid D  )   -17.280     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  26  and name N and segid D   )
       ( resid  26  and name HN and segid D  )   -12.270     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  27  and name N and segid D   )
       ( resid  27  and name HN and segid D  )   -12.840     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  28  and name N and segid D   )
       ( resid  28  and name HN and segid D  )   -19.370     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  30  and name N and segid D   )
       ( resid  30  and name HN and segid D  )   -10.870     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  32  and name N and segid D   )
       ( resid  32  and name HN and segid D  )   -11.290     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  34  and name N and segid D   )
       ( resid  34  and name HN and segid D  )     6.760     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  35  and name N and segid D   )
       ( resid  35  and name HN and segid D  )     0.380     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  36  and name N and segid D   )
       ( resid  36  and name HN and segid D  )     0.430     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  37  and name N and segid D   )
       ( resid  37  and name HN and segid D  )     0.690     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  38  and name N and segid D   )
       ( resid  38  and name HN and segid D  )     1.530     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  39  and name N and segid D   )
       ( resid  39  and name HN and segid D  )     6.040     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  42  and name N and segid D   )
       ( resid  42  and name HN and segid D  )    -5.040     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  43  and name N and segid D   )
       ( resid  43  and name HN and segid D  )    14.810     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  45  and name N and segid D   )
       ( resid  45  and name HN and segid D  )   -19.280     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  46  and name N and segid D   )
       ( resid  46  and name HN and segid D  )   -13.730     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  47  and name N and segid D   )
       ( resid  47  and name HN and segid D  )   -15.290     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  48  and name N and segid D   )
       ( resid  48  and name HN and segid D  )   -14.420     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  49  and name N and segid D   )
       ( resid  49  and name HN and segid D  )    -2.350     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  51  and name N and segid D   )
       ( resid  51  and name HN and segid D  )    -5.200     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  52  and name N and segid D   )
       ( resid  52  and name HN and segid D  )     3.190     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  53  and name N and segid D   )
       ( resid  53  and name HN and segid D  )     4.900     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  54  and name N and segid D   )
       ( resid  54  and name HN and segid D  )     1.170     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  55  and name N and segid D   )
       ( resid  55  and name HN and segid D  )     5.450     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  56  and name N and segid D   )
       ( resid  56  and name HN and segid D  )     3.540     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  59  and name N and segid D   )
       ( resid  59  and name HN and segid D  )    -0.230     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  60  and name N and segid D   )
       ( resid  60  and name HN and segid D  )    -9.270     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  61  and name N and segid D   )
       ( resid  61  and name HN and segid D  )     6.660     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  62  and name N and segid D   )
       ( resid  62  and name HN and segid D  )    -7.480     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  64  and name N and segid D   )
       ( resid  64  and name HN and segid D  )     7.720     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  66  and name N and segid D   )
       ( resid  66  and name HN and segid D  )    -0.870     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  67  and name N and segid D   )
       ( resid  67  and name HN and segid D  )    10.640     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  68  and name N and segid D   )
       ( resid  68  and name HN and segid D  )    -1.810     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  70  and name N and segid D   )
       ( resid  70  and name HN and segid D  )     4.400     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  71  and name N and segid D   )
       ( resid  71  and name HN and segid D  )     5.800     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  73  and name N and segid D   )
       ( resid  73  and name HN and segid D  )     4.830     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  76  and name N and segid D   )
       ( resid  76  and name HN and segid D  )     1.330     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  77  and name N and segid D   )
       ( resid  77  and name HN and segid D  )     3.090     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  78  and name N and segid D   )
       ( resid  78  and name HN and segid D  )     4.070     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  79  and name N and segid D   )
       ( resid  79  and name HN and segid D  )    -2.440     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  80  and name N and segid D   )
       ( resid  80  and name HN and segid D  )   -19.100     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  81  and name N and segid D   )
       ( resid  81  and name HN and segid D  )     1.730     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  82  and name N and segid D   )
       ( resid  82  and name HN and segid D  )    -5.280     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  83  and name N and segid D   )
       ( resid  83  and name HN and segid D  )    -1.380     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  84  and name N and segid D   )
       ( resid  84  and name HN and segid D  )    -0.970     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  86  and name N and segid D   )
       ( resid  86  and name HN and segid D  )    -5.850     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  88  and name N and segid D   )
       ( resid  88  and name HN and segid D  )    -4.570     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  89  and name N and segid D   )
       ( resid  89  and name HN and segid D  )    -1.180     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  90  and name N and segid D   )
       ( resid  90  and name HN and segid D  )     3.080     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  92  and name N and segid D   )
       ( resid  92  and name HN and segid D  )    -3.340     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  93  and name N and segid D   )
       ( resid  93  and name HN and segid D  )     4.220     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  94  and name N and segid D   )
       ( resid  94  and name HN and segid D  )    -0.050     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  95  and name N and segid D   )
       ( resid  95  and name HN and segid D  )    -7.270     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  96  and name N and segid D   )
       ( resid  96  and name HN and segid D  )    -0.170     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  97  and name N and segid D   )
       ( resid  97  and name HN and segid D  )     5.070     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid  98  and name N and segid D   )
       ( resid  98  and name HN and segid D  )    -6.460     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 100  and name N and segid D   )
       ( resid 100  and name HN and segid D  )     2.440     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 101  and name N and segid D   )
       ( resid 101  and name HN and segid D  )     1.040     1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( resid 102  and name N and segid D   )
       ( resid 102  and name HN and segid D  )    -9.550     1.000


!H. planarity restraints for phosphoryl transition state intermediate:


group
  select ( (resid 10 and name og and segid d) or 
        (resid 200 and name p and segid d) 
     or (resid 76 and (name ne2 or name cd2 or name ce1 ) and segid A)
         )
  weight=$kplan
end


!G. Geometric restraints for phosphoryl transition state


topology 
  presidue TP
     group
     modify atom 1NE2 charge=0.0 end
     modify atom 1cd2 charge=0.0 end
     modify atom 1ce1 charge=0.0 end
     group
     modify atom 2cb charge=0.0 end 
     modify atom 2sg  charge=0.0 end 
     delete atom 2hg  charge=0.0 end
     group
     modify atom 3P charge=0.0 end
     modify atom 3O1P charge=0.0 end
     modify atom 3O2P charge=0.0 end
     modify atom 3O3P charge=0.0 end 
   add bond 1NE2 3P
   add bond 2sg 3P
   add angle 2cb 2sg 3p
   add angle 1NE2 3P 2sg
   add angle 1NE2 3P 3O1P
   add angle 1NE2 3P 3O2P
   add angle 1NE2 3P 3O3P
   add angle 2sg   3P 3O1P 
   add angle 2sg   3P 3O2P
   add angle 2sg   3P 3O3P 
   add angle 1cd2 1ne2 3p
   add angle 1ce1 1ne2 3p
  end
end

evaluate ($ktran=500.0)
evaluate ($ktran2 = $ktran/2)
evaluate ($ktran25 = $ktran/2.5)

param
   bond PPP NB 500.0 3.3 
   bond PPP S  500.0 3.3 
   angle NB PPP S  $ktran 180.0
   angle NB PPP OP1 $ktran 90.0
   angle NB PPP OP2 $ktran 90.0
   angle NB PPP OP3 $ktran 90.0
   angle S PPP OP1 $ktran 90.0
   angle S PPP OP2 $ktran 90.0
   angle S PPP OP3 $ktran 90.0
   angle CV NB  PPP $ktran2 120.0
   angle CR NB  PPP $ktran2 120.0
   angle CT S PPP  $ktran2 97.0 
end

patch TP
  reference=1=(segid A and resid 76) reference=2=(segid D and resid 10) reference=3=(segid D and resid 200)
end



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1           H3       ALA   1 -12.149 -15.892  -2.316
    2    H2   ALA   1           H2       ALA   1 -11.202 -17.032  -3.152
    3    H3   ALA   1           H1       ALA   1 -12.351 -16.097  -3.989
    4    HA   ALA   1           HA       ALA   1 -13.740 -17.805  -3.741
    5    HB3  ALA   1           HB1      ALA   1 -12.333 -19.566  -3.273
    6    HB1  ALA   1           HB2      ALA   1 -13.089 -19.452  -1.684
    7    HB2  ALA   1           HB3      ALA   1 -11.518 -18.703  -1.969
    8    H    GLU   2           H        GLU   2 -15.357 -18.662  -2.083
    9    HA   GLU   2           HA       GLU   2 -17.015 -16.947  -1.030
   10    HB2  GLU   2           HB2      GLU   2 -16.060 -19.361   0.524
   11    HB3  GLU   2           HB3      GLU   2 -17.589 -18.519   0.775
   12    HG2  GLU   2           HG2      GLU   2 -18.563 -19.618  -0.954
   13    HG3  GLU   2           HG3      GLU   2 -17.243 -19.213  -2.041
   14    H    GLU   3           H        GLU   3 -15.093 -18.279   1.597
   15    HA   GLU   3           HA       GLU   3 -15.327 -15.920   3.145
   16    HB2  GLU   3           HB2      GLU   3 -13.727 -18.457   3.405
   17    HB3  GLU   3           HB3      GLU   3 -13.502 -17.131   4.547
   18    HG2  GLU   3           HG2      GLU   3 -15.694 -17.292   5.367
   19    HG3  GLU   3           HG3      GLU   3 -16.286 -18.101   3.922
   20    H    LEU   4           H        LEU   4 -12.365 -17.387   1.759
   21    HA   LEU   4           HA       LEU   4 -10.541 -15.471   2.349
   22    HB2  LEU   4           HB2      LEU   4 -10.765 -16.781  -0.371
   23    HB3  LEU   4           HB3      LEU   4  -9.317 -16.050   0.310
   24    HG   LEU   4           HG       LEU   4 -10.797 -18.451   1.433
   25   HD13  LEU   4          HD11      LEU   4  -9.157 -19.801   0.509
   26   HD12  LEU   4          HD12      LEU   4  -7.955 -18.511   0.476
   27   HD11  LEU   4          HD13      LEU   4  -9.244 -18.545  -0.726
   28   HD23  LEU   4          HD21      LEU   4  -8.545 -18.496   2.814
   29   HD22  LEU   4          HD22      LEU   4  -9.872 -17.462   3.340
   30   HD21  LEU   4          HD23      LEU   4  -8.513 -16.769   2.454
   31    H    GLU   5           H        GLU   5 -12.878 -15.288  -0.325
   32    HA   GLU   5           HA       GLU   5 -11.889 -12.803  -1.336
   33    HB2  GLU   5           HB2      GLU   5 -13.224 -14.398  -2.695
   34    HB3  GLU   5           HB3      GLU   5 -14.626 -14.049  -1.683
   35    HG2  GLU   5           HG2      GLU   5 -14.508 -11.673  -2.322
   36    HG3  GLU   5           HG3      GLU   5 -13.098 -12.011  -3.326
   37    H    GLU   6           H        GLU   6 -14.609 -13.688   0.760
   38    HA   GLU   6           HA       GLU   6 -15.528 -11.015   1.149
   39    HB2  GLU   6           HB2      GLU   6 -16.930 -13.033   1.557
   40    HB3  GLU   6           HB3      GLU   6 -15.907 -13.433   2.935
   41    HG2  GLU   6           HG2      GLU   6 -17.824 -12.250   3.790
   42    HG3  GLU   6           HG3      GLU   6 -16.448 -11.152   3.880
   43    H    VAL   7           H        VAL   7 -13.208 -13.107   2.729
   44    HA   VAL   7           HA       VAL   7 -12.750 -11.520   5.049
   45    HB   VAL   7           HB       VAL   7 -11.035 -13.559   3.607
   46   HG11  VAL   7          HG11      VAL   7 -10.575 -12.014   6.165
   47   HG13  VAL   7          HG12      VAL   7  -9.474 -12.227   4.805
   48   HG12  VAL   7          HG13      VAL   7  -9.819 -13.582   5.880
   49   HG21  VAL   7          HG21      VAL   7 -13.283 -14.131   4.830
   50   HG23  VAL   7          HG22      VAL   7 -12.357 -13.846   6.304
   51   HG22  VAL   7          HG23      VAL   7 -11.857 -15.108   5.180
   52    H    VAL   8           H        VAL   8 -11.239 -11.639   1.839
   53    HA   VAL   8           HA       VAL   8  -9.186  -9.752   2.324
   54    HB   VAL   8           HB       VAL   8 -10.646 -10.465  -0.230
   55   HG12  VAL   8          HG11      VAL   8  -8.526  -9.434  -1.267
   56   HG11  VAL   8          HG12      VAL   8  -8.266  -8.676   0.305
   57   HG13  VAL   8          HG13      VAL   8  -9.723  -8.311  -0.620
   58   HG23  VAL   8          HG21      VAL   8  -7.795 -11.204   0.208
   59   HG22  VAL   8          HG22      VAL   8  -9.106 -12.153  -0.484
   60   HG21  VAL   8          HG23      VAL   8  -8.942 -12.028   1.265
   61    H    MET   9           H        MET   9 -12.534  -9.386   1.163
   62    HA   MET   9           HA       MET   9 -12.487  -6.611   0.717
   63    HB2  MET   9           HB2      MET   9 -14.684  -8.504   1.542
   64    HB3  MET   9           HB3      MET   9 -14.983  -6.775   1.345
   65    HG2  MET   9           HG2      MET   9 -14.133  -6.892  -0.969
   66    HG3  MET   9           HG3      MET   9 -13.841  -8.620  -0.774
   67    HE3  MET   9           HE1      MET   9 -17.362  -6.607   0.520
   68    HE2  MET   9           HE2      MET   9 -17.595  -6.214  -1.181
   69    HE1  MET   9           HE3      MET   9 -16.079  -5.793  -0.387
   70    H    GLY  10           H        GLY  10 -13.138  -8.494   3.652
   71    HA3  GLY  10           HA2      GLY  10 -13.698  -6.305   5.362
   72    HA2  GLY  10           HA3      GLY  10 -13.125  -7.889   5.883
   73    H    LEU  11           H        LEU  11 -10.679  -8.004   4.568
   74    HA   LEU  11           HA       LEU  11  -8.987  -6.553   6.318
   75    HB2  LEU  11           HB2      LEU  11  -8.432  -7.984   3.717
   76    HB3  LEU  11           HB3      LEU  11  -7.166  -7.268   4.712
   77    HG   LEU  11           HG       LEU  11  -9.155  -9.309   5.737
   78   HD13  LEU  11          HD11      LEU  11  -7.927 -10.545   4.177
   79   HD12  LEU  11          HD12      LEU  11  -6.990 -10.771   5.653
   80   HD11  LEU  11          HD13      LEU  11  -6.456  -9.608   4.441
   81   HD22  LEU  11          HD21      LEU  11  -8.308  -8.283   7.649
   82   HD21  LEU  11          HD22      LEU  11  -6.773  -7.875   6.885
   83   HD23  LEU  11          HD23      LEU  11  -7.088  -9.531   7.401
   84    H    ILE  12           H        ILE  12  -9.892  -6.025   2.926
   85    HA   ILE  12           HA       ILE  12  -8.215  -3.787   2.490
   86    HB   ILE  12           HB       ILE  12 -10.865  -4.476   1.198
   87   HG12  ILE  12          HG12      ILE  12  -8.821  -6.120   1.133
   88   HG13  ILE  12          HG13      ILE  12  -9.687  -5.778  -0.350
   89   HG23  ILE  12          HG21      ILE  12 -10.284  -2.148   0.759
   90   HG22  ILE  12          HG22      ILE  12  -9.962  -3.080  -0.696
   91   HG21  ILE  12          HG23      ILE  12  -8.660  -2.610   0.357
   92   HD13  ILE  12          HD11      ILE  12  -7.972  -4.217  -1.034
   93   HD12  ILE  12          HD12      ILE  12  -7.182  -5.718  -0.554
   94   HD11  ILE  12          HD13      ILE  12  -7.176  -4.341   0.523
   95    H    ILE  13           H        ILE  13 -11.574  -4.071   3.585
   96    HA   ILE  13           HA       ILE  13 -12.052  -1.286   3.843
   97    HB   ILE  13           HB       ILE  13 -13.241  -3.710   5.213
   98   HG12  ILE  13          HG12      ILE  13 -13.470  -3.167   2.674
   99   HG13  ILE  13          HG13      ILE  13 -14.890  -3.643   3.580
  100   HG22  ILE  13          HG21      ILE  13 -15.160  -2.010   5.699
  101   HG21  ILE  13          HG22      ILE  13 -13.913  -0.782   5.530
  102   HG23  ILE  13          HG23      ILE  13 -13.762  -2.024   6.770
  103   HD13  ILE  13          HD11      ILE  13 -15.617  -1.343   3.793
  104   HD12  ILE  13          HD12      ILE  13 -15.251  -1.662   2.109
  105   HD11  ILE  13          HD13      ILE  13 -14.103  -0.771   3.085
  106    H    ASN  14           H        ASN  14 -10.924  -3.760   6.128
  107    HA   ASN  14           HA       ASN  14 -10.734  -2.111   8.407
  108    HB2  ASN  14           HB2      ASN  14 -10.463  -4.717   8.096
  109    HB3  ASN  14           HB3      ASN  14  -8.757  -4.319   7.937
  110   HD21  ASN  14          HD21      ASN  14  -9.382  -5.839  10.119
  111   HD22  ASN  14          HD22      ASN  14  -9.361  -4.912  11.540
  112    H    SER  15           H        SER  15  -8.327  -2.927   5.919
  113    HA   SER  15           HA       SER  15  -6.194  -1.414   6.984
  114    HB2  SER  15           HB2      SER  15  -5.171  -1.633   4.828
  115    HB3  SER  15           HB3      SER  15  -6.119  -3.098   5.057
  116    HG   SER  15           HG       SER  15  -6.658  -0.845   3.461
  117    H    GLY  16           H        GLY  16  -8.802  -0.577   4.734
  118    HA3  GLY  16           HA2      GLY  16  -7.964   2.068   4.171
  119    HA2  GLY  16           HA3      GLY  16  -9.610   1.460   4.011
  120    H    GLN  17           H        GLN  17 -10.148   0.742   6.664
  121    HA   GLN  17           HA       GLN  17 -10.875   3.246   7.794
  122    HB2  GLN  17           HB2      GLN  17 -12.072   1.125   8.277
  123    HB3  GLN  17           HB3      GLN  17 -10.667   0.562   9.184
  124    HG2  GLN  17           HG2      GLN  17 -12.284   1.503  10.744
  125    HG3  GLN  17           HG3      GLN  17 -10.880   2.566  10.664
  126   HE21  GLN  17          HE21      GLN  17 -11.938   4.570  11.094
  127   HE22  GLN  17          HE22      GLN  17 -13.136   5.217  10.079
  128    H    ALA  18           H        ALA  18  -8.227   0.989   8.423
  129    HA   ALA  18           HA       ALA  18  -7.140   2.224  10.689
  130    HB2  ALA  18           HB1      ALA  18  -6.512   0.007   9.331
  131    HB3  ALA  18           HB2      ALA  18  -5.355   0.804  10.398
  132    HB1  ALA  18           HB3      ALA  18  -5.280   1.076   8.656
  133    H    ARG  19           H        ARG  19  -6.373   2.739   7.238
  134    HA   ARG  19           HA       ARG  19  -4.492   4.804   7.658
  135    HB2  ARG  19           HB2      ARG  19  -4.810   3.651   5.467
  136    HB3  ARG  19           HB3      ARG  19  -6.360   4.478   5.287
  137    HG2  ARG  19           HG2      ARG  19  -5.250   6.659   5.345
  138    HG3  ARG  19           HG3      ARG  19  -3.694   5.889   5.653
  139    HD2  ARG  19           HD2      ARG  19  -3.824   6.468   3.307
  140    HD3  ARG  19           HD3      ARG  19  -3.894   4.708   3.461
  141    HE   ARG  19           HE       ARG  19  -6.535   5.593   3.449
  142   HH21  ARG  19          HH11      ARG  19  -7.731   5.730   1.530
  143   HH22  ARG  19          HH12      ARG  19  -6.910   5.809   0.010
  144   HH11  ARG  19          HH21      ARG  19  -3.760   5.672   1.415
  145   HH12  ARG  19          HH22      ARG  19  -4.660   5.773  -0.055
  146    H    SER  20           H        SER  20  -7.991   4.885   7.057
  147    HA   SER  20           HA       SER  20  -8.374   7.637   6.996
  148    HB2  SER  20           HB2      SER  20 -10.080   5.731   6.641
  149    HB3  SER  20           HB3      SER  20 -10.302   5.794   8.388
  150    HG   SER  20           HG       SER  20 -10.896   7.947   8.194
  151    H    LEU  21           H        LEU  21  -8.354   5.467   9.810
  152    HA   LEU  21           HA       LEU  21  -8.814   7.468  11.766
  153    HB2  LEU  21           HB2      LEU  21  -7.439   4.778  11.936
  154    HB3  LEU  21           HB3      LEU  21  -7.751   5.800  13.336
  155    HG   LEU  21           HG       LEU  21  -9.922   4.885  11.427
  156   HD11  LEU  21          HD11      LEU  21  -8.850   3.644  13.962
  157   HD13  LEU  21          HD12      LEU  21  -9.123   2.875  12.399
  158   HD12  LEU  21          HD13      LEU  21 -10.496   3.339  13.405
  159   HD23  LEU  21          HD21      LEU  21 -11.250   5.367  13.665
  160   HD22  LEU  21          HD22      LEU  21 -10.821   6.717  12.618
  161   HD21  LEU  21          HD23      LEU  21  -9.863   6.382  14.052
  162    H    ALA  22           H        ALA  22  -5.848   6.116  10.365
  163    HA   ALA  22           HA       ALA  22  -3.982   7.455  11.982
  164    HB2  ALA  22           HB1      ALA  22  -3.547   5.598  10.299
  165    HB1  ALA  22           HB2      ALA  22  -2.364   6.905  10.328
  166    HB3  ALA  22           HB3      ALA  22  -3.581   6.844   9.052
  167    H    TYR  23           H        TYR  23  -5.307   8.445   8.794
  168    HA   TYR  23           HA       TYR  23  -3.996  10.954   8.713
  169    HB2  TYR  23           HB2      TYR  23  -5.066  10.023   6.725
  170    HB3  TYR  23           HB3      TYR  23  -6.646  10.117   7.505
  171    HD1  TYR  23           HD1      TYR  23  -3.762  12.188   6.355
  172    HD2  TYR  23           HD2      TYR  23  -7.909  12.111   7.469
  173    HE1  TYR  23           HE1      TYR  23  -4.012  14.533   5.586
  174    HE2  TYR  23           HE2      TYR  23  -8.160  14.455   6.698
  175    HH   TYR  23           HH       TYR  23  -5.710  16.059   4.871
  176    H    ALA  24           H        ALA  24  -7.106   9.952  10.096
  177    HA   ALA  24           HA       ALA  24  -7.968  12.537  10.855
  178    HB1  ALA  24           HB1      ALA  24  -9.775  11.270  11.327
  179    HB2  ALA  24           HB2      ALA  24  -8.944  10.713  12.778
  180    HB3  ALA  24           HB3      ALA  24  -8.809   9.796  11.279
  181    H    ALA  25           H        ALA  25  -5.943  10.106  12.441
  182    HA   ALA  25           HA       ALA  25  -5.618  11.372  14.937
  183    HB2  ALA  25           HB1      ALA  25  -4.828   9.025  14.127
  184    HB3  ALA  25           HB2      ALA  25  -3.822   9.898  15.285
  185    HB1  ALA  25           HB3      ALA  25  -3.385   9.877  13.576
  186    H    LEU  26           H        LEU  26  -3.829  11.675  11.896
  187    HA   LEU  26           HA       LEU  26  -1.889  13.518  12.805
  188    HB2  LEU  26           HB2      LEU  26  -1.575  12.360  10.707
  189    HB3  LEU  26           HB3      LEU  26  -3.055  13.051  10.048
  190    HG   LEU  26           HG       LEU  26  -2.062  15.311  10.174
  191   HD12  LEU  26          HD11      LEU  26   0.476  15.358  10.589
  192   HD11  LEU  26          HD12      LEU  26   0.267  13.778  11.340
  193   HD13  LEU  26          HD13      LEU  26  -0.554  15.188  12.010
  194   HD21  LEU  26          HD21      LEU  26  -0.299  13.267   8.789
  195   HD23  LEU  26          HD22      LEU  26  -0.359  14.987   8.411
  196   HD22  LEU  26          HD23      LEU  26  -1.772  13.974   8.126
  197    H    LYS  27           H        LYS  27  -5.075  13.964  11.324
  198    HA   LYS  27           HA       LYS  27  -5.046  16.752  11.114
  199    HB2  LYS  27           HB2      LYS  27  -6.775  15.254  10.134
  200    HB3  LYS  27           HB3      LYS  27  -7.430  14.998  11.751
  201    HG2  LYS  27           HG2      LYS  27  -7.883  17.401  11.976
  202    HG3  LYS  27           HG3      LYS  27  -7.177  17.698  10.384
  203    HD2  LYS  27           HD2      LYS  27  -8.895  16.243   9.353
  204    HD3  LYS  27           HD3      LYS  27  -9.607  15.963  10.944
  205    HE2  LYS  27           HE2      LYS  27 -10.073  18.371  11.176
  206    HE3  LYS  27           HE3      LYS  27  -9.333  18.673   9.600
  207    HZ3  LYS  27           HZ1      LYS  27 -11.709  18.524   9.358
  208    HZ2  LYS  27           HZ2      LYS  27 -11.743  17.011  10.135
  209    HZ1  LYS  27           HZ3      LYS  27 -10.999  17.174   8.613
  210    H    GLN  28           H        GLN  28  -5.917  14.670  13.850
  211    HA   GLN  28           HA       GLN  28  -6.831  16.673  15.617
  212    HB2  GLN  28           HB2      GLN  28  -5.405  14.059  16.172
  213    HB3  GLN  28           HB3      GLN  28  -6.157  15.062  17.414
  214    HG2  GLN  28           HG2      GLN  28  -7.598  13.903  15.010
  215    HG3  GLN  28           HG3      GLN  28  -7.662  13.238  16.642
  216   HE21  GLN  28          HE21      GLN  28  -9.520  15.013  14.627
  217   HE22  GLN  28          HE22      GLN  28 -10.290  16.036  15.740
  218    H    ALA  29           H        ALA  29  -3.600  15.402  14.934
  219    HA   ALA  29           HA       ALA  29  -2.175  16.821  16.907
  220    HB1  ALA  29           HB1      ALA  29  -0.238  16.141  15.791
  221    HB3  ALA  29           HB2      ALA  29  -0.993  16.251  14.201
  222    HB2  ALA  29           HB3      ALA  29  -1.404  14.920  15.282
  223    H    LYS  30           H        LYS  30  -3.039  17.678  13.573
  224    HA   LYS  30           HA       LYS  30  -1.646  20.128  13.462
  225    HB2  LYS  30           HB2      LYS  30  -4.170  19.230  12.057
  226    HB3  LYS  30           HB3      LYS  30  -3.347  20.749  11.706
  227    HG2  LYS  30           HG2      LYS  30  -1.268  19.468  11.199
  228    HG3  LYS  30           HG3      LYS  30  -2.165  17.967  11.450
  229    HD2  LYS  30           HD2      LYS  30  -3.733  18.589   9.652
  230    HD3  LYS  30           HD3      LYS  30  -2.859  20.102   9.403
  231    HE2  LYS  30           HE2      LYS  30  -0.819  18.820   8.829
  232    HE3  LYS  30           HE3      LYS  30  -1.711  17.312   9.048
  233    HZ2  LYS  30           HZ1      LYS  30  -1.540  18.174   6.702
  234    HZ1  LYS  30           HZ2      LYS  30  -2.591  19.432   7.165
  235    HZ3  LYS  30           HZ3      LYS  30  -3.106  17.812   7.243
  236    H    GLN  31           H        GLN  31  -4.741  19.263  14.878
  237    HA   GLN  31           HA       GLN  31  -5.520  22.017  15.318
  238    HB2  GLN  31           HB2      GLN  31  -6.686  19.570  16.651
  239    HB3  GLN  31           HB3      GLN  31  -7.455  21.136  16.398
  240    HG2  GLN  31           HG2      GLN  31  -6.740  20.352  13.812
  241    HG3  GLN  31           HG3      GLN  31  -7.256  18.848  14.566
  242   HE21  GLN  31          HE21      GLN  31  -8.675  20.405  12.457
  243   HE22  GLN  31          HE22      GLN  31 -10.191  20.791  13.113
  244    H    GLY  32           H        GLY  32  -3.198  20.108  16.646
  245    HA3  GLY  32           HA2      GLY  32  -1.800  20.585  18.446
  246    HA2  GLY  32           HA3      GLY  32  -2.935  21.824  18.965
  247    H    ASP  33           H        ASP  33  -4.342  18.775  18.315
  248    HA   ASP  33           HA       ASP  33  -4.750  18.327  21.197
  249    HB2  ASP  33           HB2      ASP  33  -6.152  17.298  18.724
  250    HB3  ASP  33           HB3      ASP  33  -6.494  16.692  20.343
  251    H    PHE  34           H        PHE  34  -2.578  17.488  21.506
  252    HA   PHE  34           HA       PHE  34  -1.566  15.238  20.114
  253    HB2  PHE  34           HB2      PHE  34  -0.954  16.237  22.904
  254    HB3  PHE  34           HB3      PHE  34  -0.019  15.015  22.042
  255    HD1  PHE  34           HD1      PHE  34  -0.208  18.443  22.763
  256    HD2  PHE  34           HD2      PHE  34   0.635  15.731  19.539
  257    HE1  PHE  34           HE1      PHE  34   1.078  20.216  21.602
  258    HE2  PHE  34           HE2      PHE  34   1.916  17.507  18.383
  259    HZ   PHE  34           HZ       PHE  34   2.140  19.746  19.419
  260    H    ALA  35           H        ALA  35  -3.607  15.517  22.976
  261    HA   ALA  35           HA       ALA  35  -3.382  12.859  23.883
  262    HB3  ALA  35           HB1      ALA  35  -5.843  13.476  24.738
  263    HB1  ALA  35           HB2      ALA  35  -5.317  15.095  24.276
  264    HB2  ALA  35           HB3      ALA  35  -4.398  14.181  25.471
  265    H    ALA  36           H        ALA  36  -5.839  14.356  21.778
  266    HA   ALA  36           HA       ALA  36  -7.243  11.935  21.310
  267    HB1  ALA  36           HB1      ALA  36  -8.706  13.347  20.348
  268    HB3  ALA  36           HB2      ALA  36  -7.536  13.768  19.097
  269    HB2  ALA  36           HB3      ALA  36  -7.564  14.662  20.618
  270    H    ALA  37           H        ALA  37  -4.571  13.529  19.634
  271    HA   ALA  37           HA       ALA  37  -4.528  11.885  17.344
  272    HB3  ALA  37           HB1      ALA  37  -2.544  13.612  18.759
  273    HB2  ALA  37           HB2      ALA  37  -3.075  13.659  17.079
  274    HB1  ALA  37           HB3      ALA  37  -1.915  12.436  17.605
  275    H    LYS  38           H        LYS  38  -2.769  11.599  20.422
  276    HA   LYS  38           HA       LYS  38  -1.432   9.204  19.942
  277    HB2  LYS  38           HB2      LYS  38  -1.763  10.973  22.081
  278    HB3  LYS  38           HB3      LYS  38  -2.375   9.443  22.704
  279    HG2  LYS  38           HG2      LYS  38  -0.275   8.331  22.171
  280    HG3  LYS  38           HG3      LYS  38   0.326   9.776  21.352
  281    HD2  LYS  38           HD2      LYS  38   0.490  11.003  23.382
  282    HD3  LYS  38           HD3      LYS  38  -0.524   9.851  24.254
  283    HE2  LYS  38           HE2      LYS  38   1.833   9.549  24.873
  284    HE3  LYS  38           HE3      LYS  38   1.236   8.127  24.015
  285    HZ3  LYS  38           HZ1      LYS  38   2.534   8.545  22.232
  286    HZ2  LYS  38           HZ2      LYS  38   3.485   9.382  23.365
  287    HZ1  LYS  38           HZ3      LYS  38   2.401  10.233  22.371
  288    H    ALA  39           H        ALA  39  -4.673   9.689  21.344
  289    HA   ALA  39           HA       ALA  39  -5.219   6.968  21.859
  290    HB3  ALA  39           HB1      ALA  39  -7.388   8.899  21.084
  291    HB2  ALA  39           HB2      ALA  39  -6.491   9.137  22.585
  292    HB1  ALA  39           HB3      ALA  39  -7.400   7.647  22.327
  293    H    MET  40           H        MET  40  -5.815   8.968  19.004
  294    HA   MET  40           HA       MET  40  -7.282   7.023  17.552
  295    HB2  MET  40           HB2      MET  40  -5.684   9.423  16.638
  296    HB3  MET  40           HB3      MET  40  -6.705   8.454  15.571
  297    HG2  MET  40           HG2      MET  40  -7.746   9.708  18.125
  298    HG3  MET  40           HG3      MET  40  -7.808  10.536  16.571
  299    HE3  MET  40           HE1      MET  40 -10.383   8.896  14.514
  300    HE2  MET  40           HE2      MET  40  -8.631   9.021  14.365
  301    HE1  MET  40           HE3      MET  40  -9.556  10.384  14.993
  302    H    MET  41           H        MET  41  -3.794   7.779  17.671
  303    HA   MET  41           HA       MET  41  -3.027   6.020  15.577
  304    HB2  MET  41           HB2      MET  41  -1.414   6.705  18.047
  305    HB3  MET  41           HB3      MET  41  -0.793   6.054  16.534
  306    HG2  MET  41           HG2      MET  41  -1.961   8.227  15.522
  307    HG3  MET  41           HG3      MET  41  -1.728   8.822  17.164
  308    HE2  MET  41           HE1      MET  41   1.201   6.741  17.533
  309    HE1  MET  41           HE2      MET  41   0.406   8.034  18.427
  310    HE3  MET  41           HE3      MET  41   2.028   8.284  17.783
  311    H    ASP  42           H        ASP  42  -3.409   5.558  19.065
  312    HA   ASP  42           HA       ASP  42  -2.359   2.971  19.235
  313    HB2  ASP  42           HB2      ASP  42  -3.242   4.732  21.051
  314    HB3  ASP  42           HB3      ASP  42  -4.663   3.699  20.982
  315    H    GLN  43           H        GLN  43  -5.698   4.054  18.730
  316    HA   GLN  43           HA       GLN  43  -6.827   1.459  18.545
  317    HB2  GLN  43           HB2      GLN  43  -7.765   4.102  17.406
  318    HB3  GLN  43           HB3      GLN  43  -8.720   2.617  17.390
  319    HG2  GLN  43           HG2      GLN  43  -8.426   2.507  19.898
  320    HG3  GLN  43           HG3      GLN  43  -7.710   4.116  19.820
  321   HE21  GLN  43          HE21      GLN  43  -9.890   4.189  21.321
  322   HE22  GLN  43          HE22      GLN  43 -11.254   4.754  20.487
  323    H    SER  44           H        SER  44  -5.499   3.672  16.125
  324    HA   SER  44           HA       SER  44  -6.192   2.175  13.842
  325    HB2  SER  44           HB2      SER  44  -4.949   4.567  14.277
  326    HB3  SER  44           HB3      SER  44  -3.590   3.577  13.750
  327    HG   SER  44           HG       SER  44  -4.707   4.536  11.984
  328    H    ARG  45           H        ARG  45  -3.314   2.086  15.923
  329    HA   ARG  45           HA       ARG  45  -1.822   0.136  14.548
  330    HB2  ARG  45           HB2      ARG  45  -0.989   1.569  16.411
  331    HB3  ARG  45           HB3      ARG  45  -1.975   0.636  17.535
  332    HG2  ARG  45           HG2      ARG  45  -0.732  -1.418  16.900
  333    HG3  ARG  45           HG3      ARG  45   0.278  -0.461  15.818
  334    HD2  ARG  45           HD2      ARG  45   1.005   0.931  17.769
  335    HD3  ARG  45           HD3      ARG  45   0.089  -0.145  18.847
  336    HE   ARG  45           HE       ARG  45   1.797  -1.737  17.272
  337   HH21  ARG  45          HH11      ARG  45   3.702  -2.545  18.112
  338   HH22  ARG  45          HH12      ARG  45   4.470  -1.750  19.441
  339   HH11  ARG  45          HH21      ARG  45   2.086   0.740  19.653
  340   HH12  ARG  45          HH22      ARG  45   3.555   0.113  20.311
  341    H    MET  46           H        MET  46  -4.218  -0.189  17.149
  342    HA   MET  46           HA       MET  46  -4.035  -2.986  17.465
  343    HB2  MET  46           HB2      MET  46  -6.215  -0.989  18.059
  344    HB3  MET  46           HB3      MET  46  -6.414  -2.709  18.403
  345    HG2  MET  46           HG2      MET  46  -4.426  -2.692  19.824
  346    HG3  MET  46           HG3      MET  46  -4.123  -1.007  19.427
  347    HE2  MET  46           HE1      MET  46  -7.317  -2.851  22.095
  348    HE1  MET  46           HE2      MET  46  -6.261  -3.620  20.914
  349    HE3  MET  46           HE3      MET  46  -7.725  -2.803  20.375
  350    H    ALA  47           H        ALA  47  -6.066  -0.988  15.363
  351    HA   ALA  47           HA       ALA  47  -7.672  -3.051  14.305
  352    HB3  ALA  47           HB1      ALA  47  -8.364  -0.818  13.880
  353    HB1  ALA  47           HB2      ALA  47  -7.871  -1.455  12.311
  354    HB2  ALA  47           HB3      ALA  47  -6.797  -0.378  13.205
  355    H    LEU  48           H        LEU  48  -4.560  -1.730  13.250
  356    HA   LEU  48           HA       LEU  48  -4.271  -3.327  10.914
  357    HB2  LEU  48           HB2      LEU  48  -2.220  -2.033  12.719
  358    HB3  LEU  48           HB3      LEU  48  -1.847  -2.757  11.155
  359    HG   LEU  48           HG       LEU  48  -3.881  -0.548  11.535
  360   HD13  LEU  48          HD11      LEU  48  -1.763   0.340  12.199
  361   HD12  LEU  48          HD12      LEU  48  -2.040   0.887  10.545
  362   HD11  LEU  48          HD13      LEU  48  -0.937  -0.453  10.858
  363   HD22  LEU  48          HD21      LEU  48  -4.347  -1.542   9.463
  364   HD21  LEU  48          HD22      LEU  48  -2.662  -1.970   9.170
  365   HD23  LEU  48          HD23      LEU  48  -3.189  -0.294   9.005
  366    H    ASN  49           H        ASN  49  -3.225  -3.708  14.262
  367    HA   ASN  49           HA       ASN  49  -1.612  -5.965  13.940
  368    HB2  ASN  49           HB2      ASN  49  -1.657  -4.613  15.983
  369    HB3  ASN  49           HB3      ASN  49  -3.305  -5.129  16.313
  370   HD21  ASN  49          HD21      ASN  49  -2.862  -6.263  18.260
  371   HD22  ASN  49          HD22      ASN  49  -1.895  -7.656  18.316
  372    H    GLU  50           H        GLU  50  -5.082  -5.702  14.609
  373    HA   GLU  50           HA       GLU  50  -5.584  -8.503  14.727
  374    HB2  GLU  50           HB2      GLU  50  -7.176  -6.818  15.597
  375    HB3  GLU  50           HB3      GLU  50  -7.471  -6.261  13.948
  376    HG2  GLU  50           HG2      GLU  50  -8.328  -8.462  13.317
  377    HG3  GLU  50           HG3      GLU  50  -7.945  -9.099  14.913
  378    H    ALA  51           H        ALA  51  -5.659  -6.113  12.123
  379    HA   ALA  51           HA       ALA  51  -6.638  -7.851  10.107
  380    HB2  ALA  51           HB1      ALA  51  -6.423  -6.043   8.731
  381    HB1  ALA  51           HB2      ALA  51  -4.785  -5.687   9.279
  382    HB3  ALA  51           HB3      ALA  51  -6.171  -5.177  10.246
  383    H    HIS  52           H        HIS  52  -3.350  -6.931  11.089
  384    HA   HIS  52           HA       HIS  52  -1.946  -8.422   9.145
  385    HB2  HIS  52           HB2      HIS  52  -0.933  -6.674  10.599
  386    HB3  HIS  52           HB3      HIS  52  -1.072  -7.773  11.970
  387    HD1  HIS  52           HD1      HIS  52   0.383  -9.984  11.874
  388    HD2  HIS  52           HD2      HIS  52   1.215  -7.217   8.869
  389    HE1  HIS  52           HE1      HIS  52   2.591 -10.681  10.851
  390    HE2  HIS  52           HE2      HIS  52   3.113  -9.005   9.017
  391    H    LEU  53           H        LEU  53  -3.157  -9.292  12.360
  392    HA   LEU  53           HA       LEU  53  -1.953 -11.833  12.563
  393    HB2  LEU  53           HB2      LEU  53  -4.442 -10.654  13.771
  394    HB3  LEU  53           HB3      LEU  53  -3.978 -12.328  14.070
  395    HG   LEU  53           HG       LEU  53  -2.088  -9.998  14.540
  396   HD13  LEU  53          HD11      LEU  53  -3.998  -9.662  15.994
  397   HD12  LEU  53          HD12      LEU  53  -2.674 -10.313  16.959
  398   HD11  LEU  53          HD13      LEU  53  -3.997 -11.361  16.457
  399   HD23  LEU  53          HD21      LEU  53  -1.199 -11.804  16.226
  400   HD22  LEU  53          HD22      LEU  53  -0.794 -11.962  14.520
  401   HD21  LEU  53          HD23      LEU  53  -2.069 -12.948  15.209
  402    H    VAL  54           H        VAL  54  -5.066 -10.815  11.195
  403    HA   VAL  54           HA       VAL  54  -5.973 -13.414  10.516
  404    HB   VAL  54           HB       VAL  54  -6.626 -10.686   9.372
  405   HG12  VAL  54          HG11      VAL  54  -8.724 -12.071   8.564
  406   HG11  VAL  54          HG12      VAL  54  -7.609 -13.434   8.641
  407   HG13  VAL  54          HG13      VAL  54  -7.252 -12.062   7.595
  408   HG22  VAL  54          HG21      VAL  54  -7.534 -10.719  11.523
  409   HG21  VAL  54          HG22      VAL  54  -7.784 -12.463  11.510
  410   HG23  VAL  54          HG23      VAL  54  -8.867 -11.411  10.599
  411    H    GLN  55           H        GLN  55  -4.106 -10.964   8.720
  412    HA   GLN  55           HA       GLN  55  -3.971 -12.437   6.308
  413    HB2  GLN  55           HB2      GLN  55  -3.372 -10.172   6.110
  414    HB3  GLN  55           HB3      GLN  55  -2.261 -10.241   7.476
  415    HG2  GLN  55           HG2      GLN  55  -0.542 -11.088   6.204
  416    HG3  GLN  55           HG3      GLN  55  -1.613 -12.069   5.213
  417   HE21  GLN  55          HE21      GLN  55  -1.630 -11.386   3.089
  418   HE22  GLN  55          HE22      GLN  55  -1.434  -9.783   2.574
  419    H    THR  56           H        THR  56  -1.867 -12.402   9.190
  420    HA   THR  56           HA       THR  56   0.215 -14.000   8.279
  421    HB   THR  56           HB       THR  56  -1.028 -14.246  11.027
  422    HG1  THR  56           HG1      THR  56  -0.182 -12.078   9.857
  423   HG21  THR  56          HG21      THR  56   0.915 -15.757  10.117
  424   HG23  THR  56          HG22      THR  56   1.053 -15.039  11.722
  425   HG22  THR  56          HG23      THR  56   1.896 -14.313  10.355
  426    H    LYS  57           H        LYS  57  -2.905 -15.037   9.643
  427    HA   LYS  57           HA       LYS  57  -2.455 -17.833   9.407
  428    HB2  LYS  57           HB2      LYS  57  -4.277 -16.731  10.746
  429    HB3  LYS  57           HB3      LYS  57  -5.070 -16.304   9.237
  430    HG2  LYS  57           HG2      LYS  57  -5.316 -18.666   8.656
  431    HG3  LYS  57           HG3      LYS  57  -4.447 -19.138  10.115
  432    HD2  LYS  57           HD2      LYS  57  -6.220 -18.105  11.501
  433    HD3  LYS  57           HD3      LYS  57  -7.099 -17.658  10.040
  434    HE2  LYS  57           HE2      LYS  57  -6.397 -20.501  10.862
  435    HE3  LYS  57           HE3      LYS  57  -7.992 -19.769  11.025
  436    HZ3  LYS  57           HZ1      LYS  57  -8.316 -19.752   8.771
  437    HZ2  LYS  57           HZ2      LYS  57  -7.420 -21.185   8.954
  438    HZ1  LYS  57           HZ3      LYS  57  -6.658 -19.768   8.408
  439    H    LEU  58           H        LEU  58  -3.788 -15.400   7.222
  440    HA   LEU  58           HA       LEU  58  -4.586 -17.233   5.222
  441    HB2  LEU  58           HB2      LEU  58  -3.984 -14.284   5.077
  442    HB3  LEU  58           HB3      LEU  58  -4.645 -15.226   3.739
  443    HG   LEU  58           HG       LEU  58  -5.927 -15.039   6.486
  444   HD11  LEU  58          HD11      LEU  58  -6.227 -13.401   3.988
  445   HD13  LEU  58          HD12      LEU  58  -6.219 -12.888   5.675
  446   HD12  LEU  58          HD13      LEU  58  -7.640 -13.685   5.005
  447   HD22  LEU  58          HD21      LEU  58  -6.886 -16.952   5.622
  448   HD21  LEU  58          HD22      LEU  58  -6.546 -16.506   3.950
  449   HD23  LEU  58          HD23      LEU  58  -7.911 -15.779   4.797
  450    H    ILE  59           H        ILE  59  -1.453 -16.015   6.081
  451    HA   ILE  59           HA       ILE  59  -0.352 -16.750   3.448
  452    HB   ILE  59           HB       ILE  59   0.412 -14.677   5.007
  453   HG12  ILE  59          HG12      ILE  59   2.501 -16.342   3.583
  454   HG13  ILE  59          HG13      ILE  59   1.316 -15.388   2.728
  455   HG21  ILE  59          HG21      ILE  59   1.155 -16.436   6.781
  456   HG23  ILE  59          HG22      ILE  59   2.262 -15.135   6.404
  457   HG22  ILE  59          HG23      ILE  59   2.503 -16.738   5.711
  458   HD13  ILE  59          HD11      ILE  59   3.287 -14.029   2.947
  459   HD12  ILE  59          HD12      ILE  59   3.392 -14.382   4.670
  460   HD11  ILE  59          HD13      ILE  59   2.080 -13.378   4.052
  461    H    GLU  60           H        GLU  60  -0.365 -17.845   6.819
  462    HA   GLU  60           HA       GLU  60   1.669 -19.821   6.563
  463    HB2  GLU  60           HB2      GLU  60   0.906 -19.033   8.750
  464    HB3  GLU  60           HB3      GLU  60  -0.701 -19.689   8.447
  465    HG2  GLU  60           HG2      GLU  60   0.252 -21.966   8.311
  466    HG3  GLU  60           HG3      GLU  60   1.860 -21.308   8.614
  467    H    GLY  61           H        GLY  61  -1.841 -19.925   6.074
  468    HA3  GLY  61           HA2      GLY  61  -1.589 -22.721   5.126
  469    HA2  GLY  61           HA3      GLY  61  -3.076 -21.985   5.716
  470    H    ASP  62           H        ASP  62  -0.844 -20.413   3.508
  471    HA   ASP  62           HA       ASP  62  -2.510 -19.326   1.734
  472    HB2  ASP  62           HB2      ASP  62  -0.761 -19.602   0.015
  473    HB3  ASP  62           HB3      ASP  62  -0.077 -19.154   1.574
  474    H    ALA  63           H        ALA  63  -4.181 -19.970   0.479
  475    HA   ALA  63           HA       ALA  63  -4.878 -22.707   0.102
  476    HB2  ALA  63           HB1      ALA  63  -6.703 -21.928  -1.154
  477    HB1  ALA  63           HB2      ALA  63  -5.862 -20.448  -1.616
  478    HB3  ALA  63           HB3      ALA  63  -6.416 -20.664   0.045
  479    H    GLY  64           H        GLY  64  -5.502 -21.685  -2.854
  480    HA3  GLY  64           HA2      GLY  64  -4.299 -21.626  -4.902
  481    HA2  GLY  64           HA3      GLY  64  -2.904 -22.302  -4.076
  482    H    GLU  65           H        GLU  65  -5.349 -22.987  -6.233
  483    HA   GLU  65           HA       GLU  65  -6.044 -25.626  -5.519
  484    HB2  GLU  65           HB2      GLU  65  -6.038 -24.224  -8.189
  485    HB3  GLU  65           HB3      GLU  65  -6.685 -25.846  -7.940
  486    HG2  GLU  65           HG2      GLU  65  -8.260 -24.999  -6.272
  487    HG3  GLU  65           HG3      GLU  65  -7.579 -23.380  -6.421
  488    H    GLY  66           H        GLY  66  -3.450 -24.342  -7.448
  489    HA3  GLY  66           HA2      GLY  66  -2.406 -26.925  -8.236
  490    HA2  GLY  66           HA3      GLY  66  -1.746 -25.354  -8.647
  491    H    LYS  67           H        LYS  67  -0.048 -27.325  -8.033
  492    HA   LYS  67           HA       LYS  67   0.728 -28.018  -5.572
  493    HB2  LYS  67           HB2      LYS  67   3.156 -27.631  -6.493
  494    HB3  LYS  67           HB3      LYS  67   2.088 -28.822  -7.247
  495    HG2  LYS  67           HG2      LYS  67   1.407 -27.212  -8.942
  496    HG3  LYS  67           HG3      LYS  67   2.335 -25.937  -8.153
  497    HD2  LYS  67           HD2      LYS  67   4.420 -27.198  -8.588
  498    HD3  LYS  67           HD3      LYS  67   3.482 -28.449  -9.406
  499    HE2  LYS  67           HE2      LYS  67   2.672 -26.781 -11.036
  500    HE3  LYS  67           HE3      LYS  67   3.614 -25.532 -10.225
  501    HZ3  LYS  67           HZ1      LYS  67   5.418 -26.160 -11.314
  502    HZ2  LYS  67           HZ2      LYS  67   4.464 -27.228 -12.228
  503    HZ1  LYS  67           HZ3      LYS  67   5.239 -27.771 -10.817
  504    H    MET  68           H        MET  68   3.053 -25.772  -6.583
  505    HA   MET  68           HA       MET  68   3.418 -24.592  -4.060
  506    HB2  MET  68           HB2      MET  68   4.352 -23.705  -6.790
  507    HB3  MET  68           HB3      MET  68   4.965 -23.076  -5.260
  508    HG2  MET  68           HG2      MET  68   5.033 -25.997  -6.073
  509    HG3  MET  68           HG3      MET  68   6.403 -24.891  -6.188
  510    HE1  MET  68           HE1      MET  68   7.536 -23.811  -4.555
  511    HE3  MET  68           HE2      MET  68   7.616 -24.163  -2.830
  512    HE2  MET  68           HE3      MET  68   6.343 -23.115  -3.451
  513    H    LYS  69           H        LYS  69   1.675 -23.396  -6.913
  514    HA   LYS  69           HA       LYS  69   1.355 -20.774  -6.449
  515    HB2  LYS  69           HB2      LYS  69   0.320 -21.958  -8.318
  516    HB3  LYS  69           HB3      LYS  69  -0.931 -22.569  -7.229
  517    HG2  LYS  69           HG2      LYS  69  -1.624 -20.295  -6.682
  518    HG3  LYS  69           HG3      LYS  69  -0.324 -19.634  -7.674
  519    HD2  LYS  69           HD2      LYS  69  -1.319 -20.690  -9.674
  520    HD3  LYS  69           HD3      LYS  69  -2.628 -21.330  -8.678
  521    HE2  LYS  69           HE2      LYS  69  -3.291 -19.041  -8.057
  522    HE3  LYS  69           HE3      LYS  69  -1.971 -18.390  -9.029
  523    HZ1  LYS  69           HZ1      LYS  69  -3.443 -20.171 -10.608
  524    HZ3  LYS  69           HZ2      LYS  69  -3.260 -18.493 -10.802
  525    HZ2  LYS  69           HZ3      LYS  69  -4.537 -19.109  -9.866
  526    H    VAL  70           H        VAL  70  -0.045 -19.333  -5.418
  527    HA   VAL  70           HA       VAL  70  -1.464 -20.379  -3.032
  528    HB   VAL  70           HB       VAL  70  -0.752 -18.297  -1.858
  529   HG12  VAL  70          HG11      VAL  70   1.732 -19.648  -2.887
  530   HG11  VAL  70          HG12      VAL  70   0.562 -20.553  -1.923
  531   HG13  VAL  70          HG13      VAL  70   1.351 -19.130  -1.243
  532   HG21  VAL  70          HG21      VAL  70   0.584 -17.813  -4.515
  533   HG23  VAL  70          HG22      VAL  70   1.357 -17.213  -3.050
  534   HG22  VAL  70          HG23      VAL  70  -0.265 -16.671  -3.471
  535    H    SER  71           H        SER  71  -2.968 -18.639  -2.150
  536    HA   SER  71           HA       SER  71  -4.937 -17.974  -4.058
  537    HB2  SER  71           HB2      SER  71  -5.341 -18.217  -1.582
  538    HB3  SER  71           HB3      SER  71  -4.502 -16.688  -1.338
  539    HG   SER  71           HG       SER  71  -6.905 -17.191  -2.752
  540    H    LEU  72           H        LEU  72  -5.116 -16.331  -5.404
  541    HA   LEU  72           HA       LEU  72  -3.012 -14.517  -5.891
  542    HB2  LEU  72           HB2      LEU  72  -5.876 -14.587  -6.837
  543    HB3  LEU  72           HB3      LEU  72  -4.689 -13.419  -7.412
  544    HG   LEU  72           HG       LEU  72  -4.253 -16.421  -7.544
  545   HD12  LEU  72          HD11      LEU  72  -5.156 -14.574  -9.771
  546   HD11  LEU  72          HD12      LEU  72  -6.238 -15.650  -8.887
  547   HD13  LEU  72          HD13      LEU  72  -4.933 -16.322  -9.864
  548   HD23  LEU  72          HD21      LEU  72  -2.708 -15.524  -9.471
  549   HD22  LEU  72          HD22      LEU  72  -2.135 -15.397  -7.816
  550   HD21  LEU  72          HD23      LEU  72  -2.824 -13.989  -8.618
  551    H    VAL  73           H        VAL  73  -6.106 -14.162  -4.262
  552    HA   VAL  73           HA       VAL  73  -6.157 -11.390  -3.919
  553    HB   VAL  73           HB       VAL  73  -7.869 -11.749  -2.327
  554   HG11  VAL  73          HG11      VAL  73  -8.289 -12.526  -4.693
  555   HG13  VAL  73          HG12      VAL  73  -9.313 -13.294  -3.482
  556   HG12  VAL  73          HG13      VAL  73  -7.933 -14.166  -4.152
  557   HG23  VAL  73          HG21      VAL  73  -8.146 -14.268  -1.554
  558   HG22  VAL  73          HG22      VAL  73  -7.047 -13.189  -0.697
  559   HG21  VAL  73          HG23      VAL  73  -6.414 -14.334  -1.878
  560    H    LEU  74           H        LEU  74  -4.214 -13.749  -2.329
  561    HA   LEU  74           HA       LEU  74  -3.804 -12.600   0.191
  562    HB2  LEU  74           HB2      LEU  74  -3.013 -14.814  -0.287
  563    HB3  LEU  74           HB3      LEU  74  -1.976 -14.216  -1.582
  564    HG   LEU  74           HG       LEU  74  -0.655 -12.937   0.076
  565   HD12  LEU  74          HD11      LEU  74  -1.099 -13.632   2.524
  566   HD11  LEU  74          HD12      LEU  74  -2.691 -14.140   1.959
  567   HD13  LEU  74          HD13      LEU  74  -2.201 -12.451   1.816
  568   HD21  LEU  74          HD21      LEU  74  -0.431 -15.494  -0.530
  569   HD23  LEU  74          HD22      LEU  74  -0.857 -15.681   1.156
  570   HD22  LEU  74          HD23      LEU  74   0.574 -14.774   0.726
  571    H    VAL  75           H        VAL  75  -1.915 -12.210  -2.768
  572    HA   VAL  75           HA       VAL  75  -0.122 -10.279  -1.764
  573    HB   VAL  75           HB       VAL  75  -1.077 -10.777  -4.585
  574   HG11  VAL  75          HG11      VAL  75   1.195  -9.041  -3.519
  575   HG13  VAL  75          HG12      VAL  75  -0.228  -8.481  -4.386
  576   HG12  VAL  75          HG13      VAL  75   0.968  -9.465  -5.212
  577   HG21  VAL  75          HG21      VAL  75   1.423 -11.552  -3.038
  578   HG23  VAL  75          HG22      VAL  75   1.158 -11.873  -4.751
  579   HG22  VAL  75          HG23      VAL  75   0.136 -12.649  -3.541
  580    H    GLU  76           H        GLU  76  -3.274  -9.944  -3.421
  581    HA   GLU  76           HA       GLU  76  -3.332  -7.130  -3.530
  582    HB2  GLU  76           HB2      GLU  76  -4.989  -8.558  -4.694
  583    HB3  GLU  76           HB3      GLU  76  -5.630  -9.083  -3.145
  584    HG2  GLU  76           HG2      GLU  76  -7.103  -7.371  -4.004
  585    HG3  GLU  76           HG3      GLU  76  -6.234  -6.674  -2.651
  586    H    ALA  77           H        ALA  77  -4.436  -9.353  -0.984
  587    HA   ALA  77           HA       ALA  77  -5.397  -7.349   0.770
  588    HB2  ALA  77           HB1      ALA  77  -5.698  -9.939   0.845
  589    HB3  ALA  77           HB2      ALA  77  -5.615  -9.042   2.360
  590    HB1  ALA  77           HB3      ALA  77  -4.200  -9.915   1.776
  591    H    GLN  78           H        GLN  78  -2.246  -8.893   0.408
  592    HA   GLN  78           HA       GLN  78  -0.990  -7.724   2.654
  593    HB2  GLN  78           HB2      GLN  78  -0.142  -9.668   1.267
  594    HB3  GLN  78           HB3      GLN  78   0.336  -8.494   0.043
  595    HG2  GLN  78           HG2      GLN  78   1.798  -7.375   1.648
  596    HG3  GLN  78           HG3      GLN  78   1.279  -8.474   2.923
  597   HE21  GLN  78          HE21      GLN  78   1.255 -10.895   1.270
  598   HE22  GLN  78          HE22      GLN  78   2.875 -11.261   0.914
  599    H    LEU  79           H        LEU  79  -1.360  -6.672  -0.695
  600    HA   LEU  79           HA       LEU  79   0.323  -4.443  -0.688
  601    HB2  LEU  79           HB2      LEU  79  -0.703  -5.257  -2.740
  602    HB3  LEU  79           HB3      LEU  79  -2.307  -4.865  -2.131
  603    HG   LEU  79           HG       LEU  79  -1.767  -2.478  -2.112
  604   HD13  LEU  79          HD11      LEU  79   0.473  -2.229  -1.601
  605   HD12  LEU  79          HD12      LEU  79   0.521  -1.947  -3.341
  606   HD11  LEU  79          HD13      LEU  79   0.978  -3.522  -2.691
  607   HD23  LEU  79          HD21      LEU  79  -1.134  -2.285  -4.665
  608   HD22  LEU  79          HD22      LEU  79  -2.659  -3.034  -4.204
  609   HD21  LEU  79          HD23      LEU  79  -1.285  -4.042  -4.646
  610    H    HIS  80           H        HIS  80  -3.143  -4.607   0.140
  611    HA   HIS  80           HA       HIS  80  -3.337  -1.849   0.796
  612    HB2  HIS  80           HB2      HIS  80  -5.036  -4.259   1.122
  613    HB3  HIS  80           HB3      HIS  80  -5.358  -2.916   2.223
  614    HD1  HIS  80           HD1      HIS  80  -6.977  -1.284   1.311
  615    HD2  HIS  80           HD2      HIS  80  -4.784  -3.102  -1.733
  616    HE1  HIS  80           HE1      HIS  80  -7.819  -0.294  -0.870
  617    HE2  HIS  80           HE2      HIS  80  -6.488  -1.396  -2.735
  618    H    LEU  81           H        LEU  81  -2.845  -4.738   2.797
  619    HA   LEU  81           HA       LEU  81  -2.833  -3.384   5.277
  620    HB2  LEU  81           HB2      LEU  81  -1.612  -6.002   4.404
  621    HB3  LEU  81           HB3      LEU  81  -1.586  -5.439   6.076
  622    HG   LEU  81           HG       LEU  81  -4.132  -5.698   4.450
  623   HD12  LEU  81          HD11      LEU  81  -4.433  -7.759   6.004
  624   HD11  LEU  81          HD12      LEU  81  -2.681  -7.687   6.188
  625   HD13  LEU  81          HD13      LEU  81  -3.390  -7.922   4.590
  626   HD23  LEU  81          HD21      LEU  81  -4.974  -5.894   6.952
  627   HD22  LEU  81          HD22      LEU  81  -4.651  -4.307   6.258
  628   HD21  LEU  81          HD23      LEU  81  -3.463  -5.064   7.320
  629    H    MET  82           H        MET  82  -0.152  -4.292   3.108
  630    HA   MET  82           HA       MET  82   1.931  -3.392   4.788
  631    HB2  MET  82           HB2      MET  82   1.715  -3.742   1.797
  632    HB3  MET  82           HB3      MET  82   3.197  -3.169   2.558
  633    HG2  MET  82           HG2      MET  82   1.792  -5.757   3.290
  634    HG3  MET  82           HG3      MET  82   3.163  -5.650   2.189
  635    HE3  MET  82           HE1      MET  82   6.179  -4.907   4.169
  636    HE2  MET  82           HE2      MET  82   5.255  -3.542   3.548
  637    HE1  MET  82           HE3      MET  82   5.344  -5.035   2.616
  638    H    THR  83           H        THR  83   0.108  -1.758   2.228
  639    HA   THR  83           HA       THR  83   1.519   0.691   2.307
  640    HB   THR  83           HB       THR  83  -0.657   1.613   1.319
  641    HG1  THR  83           HG1      THR  83  -2.308   0.315   1.217
  642   HG22  THR  83          HG21      THR  83  -0.388  -0.211  -0.676
  643   HG21  THR  83          HG22      THR  83   1.113  -0.500   0.200
  644   HG23  THR  83          HG23      THR  83   0.751   1.111  -0.419
  645    H    SER  84           H        SER  84  -1.486  -0.337   3.912
  646    HA   SER  84           HA       SER  84  -1.981   2.096   5.250
  647    HB2  SER  84           HB2      SER  84  -2.814  -0.740   5.823
  648    HB3  SER  84           HB3      SER  84  -3.307   0.604   6.853
  649    HG   SER  84           HG       SER  84  -3.767   0.282   4.062
  650    H    MET  85           H        MET  85  -0.271  -0.833   6.387
  651    HA   MET  85           HA       MET  85   0.250   0.101   8.989
  652    HB2  MET  85           HB2      MET  85   0.542  -2.245   8.312
  653    HB3  MET  85           HB3      MET  85   1.928  -1.782   7.324
  654    HG2  MET  85           HG2      MET  85   3.065  -0.911   9.350
  655    HG3  MET  85           HG3      MET  85   1.688  -1.421  10.326
  656    HE2  MET  85           HE1      MET  85   0.932  -4.507   9.136
  657    HE1  MET  85           HE2      MET  85   0.801  -3.511  10.584
  658    HE3  MET  85           HE3      MET  85   1.698  -5.025  10.641
  659    H    LEU  86           H        LEU  86   2.183   0.348   6.036
  660    HA   LEU  86           HA       LEU  86   4.399   1.661   7.186
  661    HB2  LEU  86           HB2      LEU  86   4.205   0.572   4.881
  662    HB3  LEU  86           HB3      LEU  86   3.398   2.052   4.364
  663    HG   LEU  86           HG       LEU  86   5.427   3.300   5.340
  664   HD11  LEU  86          HD11      LEU  86   6.131   0.691   6.147
  665   HD13  LEU  86          HD12      LEU  86   7.136   2.135   6.239
  666   HD12  LEU  86          HD13      LEU  86   7.244   1.083   4.831
  667   HD23  LEU  86          HD21      LEU  86   6.142   1.530   2.994
  668   HD22  LEU  86          HD22      LEU  86   6.536   3.228   3.251
  669   HD21  LEU  86          HD23      LEU  86   4.883   2.759   2.855
  670    H    ALA  87           H        ALA  87   1.486   2.901   5.600
  671    HA   ALA  87           HA       ALA  87   2.082   5.631   5.675
  672    HB1  ALA  87           HB1      ALA  87  -0.229   4.003   5.140
  673    HB3  ALA  87           HB2      ALA  87   0.083   5.662   4.635
  674    HB2  ALA  87           HB3      ALA  87  -0.710   5.346   6.180
  675    H    ARG  88           H        ARG  88   0.392   3.638   8.072
  676    HA   ARG  88           HA       ARG  88  -0.117   5.693   9.913
  677    HB2  ARG  88           HB2      ARG  88  -1.057   3.341   9.987
  678    HB3  ARG  88           HB3      ARG  88   0.484   2.842  10.694
  679    HG2  ARG  88           HG2      ARG  88   0.010   4.922  12.308
  680    HG3  ARG  88           HG3      ARG  88  -1.657   4.597  11.854
  681    HD2  ARG  88           HD2      ARG  88  -1.765   2.751  13.106
  682    HD3  ARG  88           HD3      ARG  88  -0.176   2.167  12.575
  683    HE   ARG  88           HE       ARG  88  -0.708   3.438  15.026
  684   HH21  ARG  88          HH11      ARG  88   0.852   4.453  16.260
  685   HH22  ARG  88          HH12      ARG  88   2.371   4.877  15.554
  686   HH11  ARG  88          HH21      ARG  88   1.571   3.610  12.447
  687   HH12  ARG  88          HH22      ARG  88   2.787   4.384  13.406
  688    H    GLU  89           H        GLU  89   2.678   3.472   9.695
  689    HA   GLU  89           HA       GLU  89   3.942   4.368  12.035
  690    HB2  GLU  89           HB2      GLU  89   4.599   2.345  10.697
  691    HB3  GLU  89           HB3      GLU  89   5.374   3.436   9.547
  692    HG2  GLU  89           HG2      GLU  89   6.861   4.287  11.287
  693    HG3  GLU  89           HG3      GLU  89   6.026   3.335  12.511
  694    H    LEU  90           H        LEU  90   4.257   5.515   8.704
  695    HA   LEU  90           HA       LEU  90   6.187   7.518   9.282
  696    HB2  LEU  90           HB2      LEU  90   4.180   7.179   7.056
  697    HB3  LEU  90           HB3      LEU  90   5.411   8.450   7.073
  698    HG   LEU  90           HG       LEU  90   6.085   5.514   7.416
  699   HD12  LEU  90          HD11      LEU  90   6.832   5.740   4.975
  700   HD11  LEU  90          HD12      LEU  90   5.816   7.180   4.922
  701   HD13  LEU  90          HD13      LEU  90   5.097   5.608   5.271
  702   HD22  LEU  90          HD21      LEU  90   7.982   6.666   8.093
  703   HD21  LEU  90          HD22      LEU  90   7.632   8.068   7.082
  704   HD23  LEU  90          HD23      LEU  90   8.291   6.601   6.359
  705    H    ILE  91           H        ILE  91   2.648   7.532   9.135
  706    HA   ILE  91           HA       ILE  91   2.305  10.305   9.577
  707    HB   ILE  91           HB       ILE  91   0.516   7.931  10.128
  708   HG12  ILE  91          HG12      ILE  91   0.265  10.206   8.136
  709   HG13  ILE  91          HG13      ILE  91   1.126   8.711   7.768
  710   HG22  ILE  91          HG21      ILE  91  -1.218   9.988  10.186
  711   HG21  ILE  91          HG22      ILE  91   0.183  10.821  10.855
  712   HG23  ILE  91          HG23      ILE  91  -0.452   9.386  11.656
  713   HD13  ILE  91          HD11      ILE  91  -0.818   7.422   7.818
  714   HD12  ILE  91          HD12      ILE  91  -1.408   8.934   7.131
  715   HD11  ILE  91          HD13      ILE  91  -1.678   8.576   8.837
  716    H    THR  92           H        THR  92   2.711   7.571  11.787
  717    HA   THR  92           HA       THR  92   2.268   8.953  14.206
  718    HB   THR  92           HB       THR  92   4.078   6.617  13.548
  719    HG1  THR  92           HG1      THR  92   2.110   5.858  13.451
  720   HG22  THR  92          HG21      THR  92   3.696   6.341  16.183
  721   HG21  THR  92          HG22      THR  92   3.630   8.100  16.104
  722   HG23  THR  92          HG23      THR  92   5.063   7.244  15.533
  723    H    GLU  93           H        GLU  93   5.219   8.501  12.273
  724    HA   GLU  93           HA       GLU  93   6.971   9.935  13.964
  725    HB2  GLU  93           HB2      GLU  93   7.059   9.611  10.950
  726    HB3  GLU  93           HB3      GLU  93   8.399  10.146  11.963
  727    HG2  GLU  93           HG2      GLU  93   6.993   7.509  12.419
  728    HG3  GLU  93           HG3      GLU  93   8.377   7.659  11.343
  729    H    LEU  94           H        LEU  94   4.920  10.938  11.249
  730    HA   LEU  94           HA       LEU  94   5.721  13.643  11.139
  731    HB2  LEU  94           HB2      LEU  94   3.133  12.271  10.391
  732    HB3  LEU  94           HB3      LEU  94   3.388  13.998  10.143
  733    HG   LEU  94           HG       LEU  94   5.409  12.010   9.099
  734   HD11  LEU  94          HD11      LEU  94   2.666  12.552   8.036
  735   HD13  LEU  94          HD12      LEU  94   3.651  11.097   7.915
  736   HD12  LEU  94          HD13      LEU  94   3.984  12.474   6.866
  737   HD23  LEU  94          HD21      LEU  94   5.655  13.840   7.370
  738   HD22  LEU  94          HD22      LEU  94   6.069  14.340   9.010
  739   HD21  LEU  94          HD23      LEU  94   4.517  14.802   8.311
  740    H    ILE  95           H        ILE  95   3.187  12.028  13.036
  741    HA   ILE  95           HA       ILE  95   2.139  14.380  14.223
  742    HB   ILE  95           HB       ILE  95   2.163  11.501  15.158
  743   HG12  ILE  95          HG12      ILE  95  -0.062  13.266  14.103
  744   HG13  ILE  95          HG13      ILE  95   0.897  12.205  13.075
  745   HG21  ILE  95          HG21      ILE  95   0.875  13.975  16.351
  746   HG23  ILE  95          HG22      ILE  95   1.926  12.811  17.160
  747   HG22  ILE  95          HG23      ILE  95   0.292  12.345  16.687
  748   HD13  ILE  95          HD11      ILE  95  -0.002  10.268  14.001
  749   HD12  ILE  95          HD12      ILE  95  -1.386  11.355  14.073
  750   HD11  ILE  95          HD13      ILE  95  -0.420  11.064  15.519
  751    H    GLU  96           H        GLU  96   4.740  12.170  15.226
  752    HA   GLU  96           HA       GLU  96   5.292  13.379  17.714
  753    HB2  GLU  96           HB2      GLU  96   6.246  11.220  17.074
  754    HB3  GLU  96           HB3      GLU  96   7.177  11.992  15.791
  755    HG2  GLU  96           HG2      GLU  96   8.824  12.550  17.252
  756    HG3  GLU  96           HG3      GLU  96   7.675  13.363  18.304
  757    H    LEU  97           H        LEU  97   6.364  14.142  14.425
  758    HA   LEU  97           HA       LEU  97   8.245  16.147  15.130
  759    HB2  LEU  97           HB2      LEU  97   6.655  15.584  12.637
  760    HB3  LEU  97           HB3      LEU  97   7.670  17.019  12.753
  761    HG   LEU  97           HG       LEU  97   8.707  14.226  13.323
  762   HD12  LEU  97          HD11      LEU  97   9.703  14.415  11.005
  763   HD11  LEU  97          HD12      LEU  97   8.648  15.801  10.737
  764   HD13  LEU  97          HD13      LEU  97   7.953  14.208  11.037
  765   HD23  LEU  97          HD21      LEU  97  10.873  15.509  12.576
  766   HD22  LEU  97          HD22      LEU  97  10.253  15.782  14.204
  767   HD21  LEU  97          HD23      LEU  97   9.935  16.960  12.931
  768    H    HIS  98           H        HIS  98   4.753  16.269  14.475
  769    HA   HIS  98           HA       HIS  98   4.445  19.068  14.600
  770    HB2  HIS  98           HB2      HIS  98   2.562  16.814  15.334
  771    HB3  HIS  98           HB3      HIS  98   2.090  18.513  15.384
  772    HD1  HIS  98           HD1      HIS  98   3.120  15.793  12.989
  773    HD2  HIS  98           HD2      HIS  98   1.731  19.721  12.853
  774    HE1  HIS  98           HE1      HIS  98   2.559  16.271  10.563
  775    HE2  HIS  98           HE2      HIS  98   1.716  18.657  10.459
  776    H    GLU  99           H        GLU  99   4.586  16.589  17.108
  777    HA   GLU  99           HA       GLU  99   3.973  18.289  19.300
  778    HB2  GLU  99           HB2      GLU  99   3.892  15.807  19.406
  779    HB3  GLU  99           HB3      GLU  99   5.652  15.768  19.298
  780    HG2  GLU  99           HG2      GLU  99   5.836  17.068  21.367
  781    HG3  GLU  99           HG3      GLU  99   4.083  17.203  21.463
  782    H    LYS 100           H        LYS 100   7.029  17.363  17.739
  783    HA   LYS 100           HA       LYS 100   8.680  18.776  19.590
  784    HB2  LYS 100           HB2      LYS 100   9.181  17.843  16.755
  785    HB3  LYS 100           HB3      LYS 100  10.409  18.620  17.760
  786    HG2  LYS 100           HG2      LYS 100  10.038  16.874  19.507
  787    HG3  LYS 100           HG3      LYS 100   8.909  16.063  18.419
  788    HD2  LYS 100           HD2      LYS 100  10.704  15.780  16.753
  789    HD3  LYS 100           HD3      LYS 100  11.838  16.603  17.826
  790    HE2  LYS 100           HE2      LYS 100  11.448  14.853  19.550
  791    HE3  LYS 100           HE3      LYS 100  10.375  14.010  18.428
  792    HZ1  LYS 100           HZ1      LYS 100  13.194  14.686  17.770
  793    HZ3  LYS 100           HZ2      LYS 100  12.153  13.625  16.946
  794    HZ2  LYS 100           HZ3      LYS 100  12.743  13.213  18.486
  795    H    LEU 101           H        LEU 101   6.983  19.686  16.631
  796    HA   LEU 101           HA       LEU 101   8.189  22.246  16.288
  797    HB2  LEU 101           HB2      LEU 101   5.597  21.001  15.405
  798    HB3  LEU 101           HB3      LEU 101   5.843  22.732  15.192
  799    HG   LEU 101           HG       LEU 101   7.885  20.719  14.233
  800   HD12  LEU 101          HD11      LEU 101   6.730  21.213  11.946
  801   HD11  LEU 101          HD12      LEU 101   5.329  21.642  12.925
  802   HD13  LEU 101          HD13      LEU 101   5.999  20.014  13.013
  803   HD21  LEU 101          HD21      LEU 101   7.248  23.627  13.667
  804   HD23  LEU 101          HD22      LEU 101   8.232  22.667  12.564
  805   HD22  LEU 101          HD23      LEU 101   8.773  22.932  14.221
  806    H    LYS 102           H        LYS 102   6.655  21.112  18.907
  807    HA   LYS 102           HA       LYS 102   6.020  22.209  20.836
  808    HB2  LYS 102           HB2      LYS 102   7.296  24.199  19.704
  809    HB3  LYS 102           HB3      LYS 102   5.695  24.798  19.327
  810    HG2  LYS 102           HG2      LYS 102   7.073  24.555  21.979
  811    HG3  LYS 102           HG3      LYS 102   6.117  25.879  21.346
  812    HD2  LYS 102           HD2      LYS 102   4.881  23.242  22.234
  813    HD3  LYS 102           HD3      LYS 102   5.125  24.607  23.313
  814    HE2  LYS 102           HE2      LYS 102   2.847  24.192  21.825
  815    HE3  LYS 102           HE3      LYS 102   3.346  25.742  22.502
  816    HZ2  LYS 102           HZ1      LYS 102   2.815  25.840  20.122
  817    HZ1  LYS 102           HZ2      LYS 102   4.079  24.761  19.803
  818    HZ3  LYS 102           HZ3      LYS 102   4.418  26.294  20.440
  819    H    ALA 103           H        ALA 103   4.377  23.737  18.063
  820    HA   ALA 103           HA       ALA 103   1.921  24.310  18.947
  821    HB1  ALA 103           HB1      ALA 103   1.025  23.458  16.707
  822    HB2  ALA 103           HB2      ALA 103   2.674  22.925  16.379
  823    HB3  ALA 103           HB3      ALA 103   2.334  24.637  16.640

  No H/Q in entry =         823
  In of MODEL    1
    1    H1   ALA   1           H3       ALA   1  10.643 -20.250  -6.179
    2    H2   ALA   1           H2       ALA   1   9.679 -20.464  -7.564
    3    H3   ALA   1           H1       ALA   1   9.244 -21.206  -6.098
    4    HA   ALA   1           HA       ALA   1  10.288 -23.015  -6.832
    5    HB1  ALA   1           HB1      ALA   1  10.382 -22.663  -9.109
    6    HB2  ALA   1           HB2      ALA   1  12.109 -22.508  -8.781
    7    HB3  ALA   1           HB3      ALA   1  11.107 -21.063  -8.936
    8    H    GLU   2           H        GLU   2  12.573 -23.961  -6.888
    9    HA   GLU   2           HA       GLU   2  13.955 -23.869  -4.677
   10    HB2  GLU   2           HB2      GLU   2  15.310 -23.743  -7.377
   11    HB3  GLU   2           HB3      GLU   2  16.040 -24.348  -5.890
   12    HG2  GLU   2           HG2      GLU   2  15.028 -26.368  -6.124
   13    HG3  GLU   2           HG3      GLU   2  13.455 -25.626  -6.384
   14    H    GLU   3           H        GLU   3  15.722 -22.008  -7.085
   15    HA   GLU   3           HA       GLU   3  16.872 -20.313  -5.131
   16    HB2  GLU   3           HB2      GLU   3  16.815 -20.320  -8.141
   17    HB3  GLU   3           HB3      GLU   3  17.559 -18.987  -7.259
   18    HG2  GLU   3           HG2      GLU   3  19.224 -20.355  -6.332
   19    HG3  GLU   3           HG3      GLU   3  18.281 -21.824  -6.548
   20    H    LEU   4           H        LEU   4  14.588 -19.478  -7.764
   21    HA   LEU   4           HA       LEU   4  14.116 -16.868  -7.161
   22    HB2  LEU   4           HB2      LEU   4  11.945 -18.849  -7.883
   23    HB3  LEU   4           HB3      LEU   4  11.866 -17.101  -8.088
   24    HG   LEU   4           HG       LEU   4  13.834 -18.965  -9.456
   25   HD13  LEU   4          HD11      LEU   4  12.531 -18.825 -11.365
   26   HD12  LEU   4          HD12      LEU   4  11.820 -17.280 -10.903
   27   HD11  LEU   4          HD13      LEU   4  11.270 -18.769 -10.136
   28   HD23  LEU   4          HD21      LEU   4  14.165 -16.723 -10.815
   29   HD22  LEU   4          HD22      LEU   4  15.026 -16.959  -9.295
   30   HD21  LEU   4          HD23      LEU   4  13.572 -15.966  -9.336
   31    H    GLU   5           H        GLU   5  12.638 -19.649  -5.509
   32    HA   GLU   5           HA       GLU   5  10.958 -18.075  -3.810
   33    HB2  GLU   5           HB2      GLU   5  10.536 -20.456  -4.323
   34    HB3  GLU   5           HB3      GLU   5  11.972 -20.887  -3.392
   35    HG2  GLU   5           HG2      GLU   5  11.004 -19.847  -1.388
   36    HG3  GLU   5           HG3      GLU   5   9.576 -19.384  -2.311
   37    H    GLU   6           H        GLU   6  14.108 -19.647  -3.364
   38    HA   GLU   6           HA       GLU   6  14.460 -18.782  -0.669
   39    HB2  GLU   6           HB2      GLU   6  15.685 -20.698  -1.682
   40    HB3  GLU   6           HB3      GLU   6  16.568 -19.557  -2.701
   41    HG2  GLU   6           HG2      GLU   6  17.951 -20.024  -0.784
   42    HG3  GLU   6           HG3      GLU   6  17.318 -18.389  -0.591
   43    H    VAL   7           H        VAL   7  15.221 -17.464  -3.823
   44    HA   VAL   7           HA       VAL   7  16.903 -15.330  -2.966
   45    HB   VAL   7           HB       VAL   7  15.197 -15.706  -5.441
   46   HG11  VAL   7          HG11      VAL   7  17.085 -13.486  -4.637
   47   HG13  VAL   7          HG12      VAL   7  15.442 -13.349  -5.260
   48   HG12  VAL   7          HG13      VAL   7  16.752 -13.852  -6.330
   49   HG21  VAL   7          HG21      VAL   7  17.307 -17.156  -4.869
   50   HG23  VAL   7          HG22      VAL   7  18.209 -15.694  -5.272
   51   HG22  VAL   7          HG23      VAL   7  17.173 -16.450  -6.481
   52    H    VAL   8           H        VAL   8  13.411 -15.610  -3.520
   53    HA   VAL   8           HA       VAL   8  12.739 -12.902  -3.057
   54    HB   VAL   8           HB       VAL   8  11.138 -15.437  -2.623
   55   HG12  VAL   8          HG11      VAL   8   9.186 -13.758  -2.761
   56   HG11  VAL   8          HG12      VAL   8  10.388 -12.515  -2.410
   57   HG13  VAL   8          HG13      VAL   8  10.092 -13.808  -1.249
   58   HG23  VAL   8          HG21      VAL   8  10.470 -13.508  -4.794
   59   HG22  VAL   8          HG22      VAL   8  10.511 -15.269  -4.828
   60   HG21  VAL   8          HG23      VAL   8  12.005 -14.353  -4.996
   61    H    MET   9           H        MET   9  13.014 -15.700  -0.868
   62    HA   MET   9           HA       MET   9  12.196 -14.423   1.498
   63    HB2  MET   9           HB2      MET   9  14.115 -16.691   0.968
   64    HB3  MET   9           HB3      MET   9  13.801 -16.109   2.604
   65    HG2  MET   9           HG2      MET   9  11.395 -16.526   2.308
   66    HG3  MET   9           HG3      MET   9  11.688 -17.080   0.658
   67    HE3  MET   9           HE1      MET   9  13.974 -18.193   4.073
   68    HE2  MET   9           HE2      MET   9  12.478 -18.915   4.657
   69    HE1  MET   9           HE3      MET   9  12.503 -17.220   4.181
   70    H    GLY  10           H        GLY  10  15.377 -14.643  -0.059
   71    HA3  GLY  10           HA2      GLY  10  16.833 -13.211   1.906
   72    HA2  GLY  10           HA3      GLY  10  17.295 -13.381   0.213
   73    H    LEU  11           H        LEU  11  15.123 -12.171  -1.030
   74    HA   LEU  11           HA       LEU  11  15.799  -9.423  -0.876
   75    HB2  LEU  11           HB2      LEU  11  13.435 -10.845  -2.105
   76    HB3  LEU  11           HB3      LEU  11  13.710  -9.110  -2.271
   77    HG   LEU  11           HG       LEU  11  15.744 -11.214  -3.052
   78   HD13  LEU  11          HD11      LEU  11  13.999 -11.592  -4.571
   79   HD12  LEU  11          HD12      LEU  11  14.997 -10.410  -5.415
   80   HD11  LEU  11          HD13      LEU  11  13.522  -9.894  -4.598
   81   HD22  LEU  11          HD21      LEU  11  16.969  -9.245  -2.834
   82   HD21  LEU  11          HD22      LEU  11  15.590  -8.215  -3.215
   83   HD23  LEU  11          HD23      LEU  11  16.424  -9.085  -4.502
   84    H    ILE  12           H        ILE  12  13.037 -11.255   0.399
   85    HA   ILE  12           HA       ILE  12  11.636  -9.033   1.452
   86    HB   ILE  12           HB       ILE  12  11.684 -11.912   2.409
   87   HG12  ILE  12          HG12      ILE  12  10.992 -11.290  -0.039
   88   HG13  ILE  12          HG13      ILE  12   9.970 -12.378   0.877
   89   HG23  ILE  12          HG21      ILE  12  10.732 -10.513   4.143
   90   HG22  ILE  12          HG22      ILE  12   9.401 -11.333   3.328
   91   HG21  ILE  12          HG23      ILE  12   9.750  -9.643   2.966
   92   HD13  ILE  12          HD11      ILE  12   8.437 -10.570   1.375
   93   HD12  ILE  12          HD12      ILE  12   8.728 -10.589  -0.364
   94   HD11  ILE  12          HD13      ILE  12   9.524  -9.401   0.644
   95    H    ILE  13           H        ILE  13  14.038 -11.223   2.864
   96    HA   ILE  13           HA       ILE  13  14.070 -10.035   5.440
   97    HB   ILE  13           HB       ILE  13  16.138 -11.601   3.879
   98   HG12  ILE  13          HG12      ILE  13  13.862 -12.574   4.723
   99   HG13  ILE  13          HG13      ILE  13  15.341 -13.493   4.984
  100   HG22  ILE  13          HG21      ILE  13  17.135 -11.951   6.253
  101   HG21  ILE  13          HG22      ILE  13  16.263 -10.486   6.686
  102   HG23  ILE  13          HG23      ILE  13  17.494 -10.438   5.424
  103   HD13  ILE  13          HD11      ILE  13  15.474 -12.725   7.298
  104   HD12  ILE  13          HD12      ILE  13  13.859 -13.363   7.009
  105   HD11  ILE  13          HD13      ILE  13  14.122 -11.625   7.038
  106    H    ASN  14           H        ASN  14  16.020  -9.504   2.519
  107    HA   ASN  14           HA       ASN  14  17.754  -7.550   3.574
  108    HB2  ASN  14           HB2      ASN  14  17.738  -8.824   1.262
  109    HB3  ASN  14           HB3      ASN  14  16.837  -7.414   0.721
  110   HD21  ASN  14          HD21      ASN  14  19.279  -7.744  -0.464
  111   HD22  ASN  14          HD22      ASN  14  20.416  -6.653   0.159
  112    H    SER  15           H        SER  15  14.641  -7.226   1.881
  113    HA   SER  15           HA       SER  15  14.513  -4.406   1.928
  114    HB2  SER  15           HB2      SER  15  12.179  -4.668   1.440
  115    HB3  SER  15           HB3      SER  15  12.986  -6.025   0.665
  116    HG   SER  15           HG       SER  15  11.453  -5.960   3.023
  117    H    GLY  16           H        GLY  16  13.434  -6.864   4.240
  118    HA3  GLY  16           HA2      GLY  16  12.203  -5.117   6.092
  119    HA2  GLY  16           HA3      GLY  16  12.827  -6.720   6.459
  120    H    GLN  17           H        GLN  17  15.537  -6.373   5.866
  121    HA   GLN  17           HA       GLN  17  16.486  -5.138   8.242
  122    HB2  GLN  17           HB2      GLN  17  17.719  -6.929   7.041
  123    HB3  GLN  17           HB3      GLN  17  18.036  -5.803   5.720
  124    HG2  GLN  17           HG2      GLN  17  19.976  -5.846   7.181
  125    HG3  GLN  17           HG3      GLN  17  19.175  -4.285   7.352
  126   HE21  GLN  17          HE21      GLN  17  19.746  -3.860   9.551
  127   HE22  GLN  17          HE22      GLN  17  19.240  -4.841  10.841
  128    H    ALA  18           H        ALA  18  16.290  -4.072   4.878
  129    HA   ALA  18           HA       ALA  18  17.711  -1.670   5.097
  130    HB1  ALA  18           HB1      ALA  18  16.600  -2.899   3.034
  131    HB3  ALA  18           HB2      ALA  18  16.854  -1.154   3.013
  132    HB2  ALA  18           HB3      ALA  18  15.259  -1.809   3.384
  133    H    ARG  19           H        ARG  19  14.215  -2.279   5.496
  134    HA   ARG  19           HA       ARG  19  13.529   0.369   6.202
  135    HB2  ARG  19           HB2      ARG  19  11.860  -1.396   5.622
  136    HB3  ARG  19           HB3      ARG  19  12.207  -2.186   7.161
  137    HG2  ARG  19           HG2      ARG  19  11.483  -0.196   8.394
  138    HG3  ARG  19           HG3      ARG  19  11.227   0.674   6.883
  139    HD2  ARG  19           HD2      ARG  19   9.091  -0.134   7.705
  140    HD3  ARG  19           HD3      ARG  19   9.516  -1.015   6.232
  141    HE   ARG  19           HE       ARG  19  10.485  -2.544   8.342
  142   HH21  ARG  19          HH11      ARG  19   9.246  -4.189   9.287
  143   HH22  ARG  19          HH12      ARG  19   7.526  -4.174   9.116
  144   HH11  ARG  19          HH21      ARG  19   7.482  -1.275   7.243
  145   HH12  ARG  19          HH22      ARG  19   6.528  -2.524   7.954
  146    H    SER  20           H        SER  20  14.406  -2.449   8.171
  147    HA   SER  20           HA       SER  20  14.115  -1.343  10.705
  148    HB2  SER  20           HB2      SER  20  14.767  -3.755  10.034
  149    HB3  SER  20           HB3      SER  20  16.423  -3.154  10.018
  150    HG   SER  20           HG       SER  20  16.174  -2.548  12.170
  151    H    LEU  21           H        LEU  21  16.958  -1.270   8.569
  152    HA   LEU  21           HA       LEU  21  18.622   0.233  10.302
  153    HB2  LEU  21           HB2      LEU  21  18.602  -0.055   7.290
  154    HB3  LEU  21           HB3      LEU  21  19.849   0.825   8.171
  155    HG   LEU  21           HG       LEU  21  19.142  -2.069   8.740
  156   HD11  LEU  21          HD11      LEU  21  21.176  -0.847   6.870
  157   HD13  LEU  21          HD12      LEU  21  19.976  -2.088   6.515
  158   HD12  LEU  21          HD13      LEU  21  21.370  -2.473   7.524
  159   HD23  LEU  21          HD21      LEU  21  21.642  -1.860   9.602
  160   HD22  LEU  21          HD22      LEU  21  20.327  -1.306  10.632
  161   HD21  LEU  21          HD23      LEU  21  21.261  -0.144   9.704
  162    H    ALA  22           H        ALA  22  16.353   1.178   7.743
  163    HA   ALA  22           HA       ALA  22  16.873   3.940   7.748
  164    HB3  ALA  22           HB1      ALA  22  15.479   2.683   6.073
  165    HB2  ALA  22           HB2      ALA  22  14.762   4.193   6.635
  166    HB1  ALA  22           HB3      ALA  22  14.182   2.652   7.267
  167    H    TYR  23           H        TYR  23  14.388   2.114   9.588
  168    HA   TYR  23           HA       TYR  23  13.411   4.350  11.030
  169    HB2  TYR  23           HB2      TYR  23  12.189   2.228  11.015
  170    HB3  TYR  23           HB3      TYR  23  13.525   1.428  11.844
  171    HD1  TYR  23           HD1      TYR  23  11.011   4.165  12.198
  172    HD2  TYR  23           HD2      TYR  23  13.714   1.492  14.199
  173    HE1  TYR  23           HE1      TYR  23  10.078   4.859  14.390
  174    HE2  TYR  23           HE2      TYR  23  12.780   2.186  16.389
  175    HH   TYR  23           HH       TYR  23   9.902   4.070  16.645
  176    H    ALA  24           H        ALA  24  16.070   2.093  11.675
  177    HA   ALA  24           HA       ALA  24  16.733   3.101  14.235
  178    HB1  ALA  24           HB1      ALA  24  18.101   1.315  14.077
  179    HB3  ALA  24           HB2      ALA  24  19.123   2.239  12.975
  180    HB2  ALA  24           HB3      ALA  24  17.835   1.221  12.337
  181    H    ALA  25           H        ALA  25  17.685   4.025  10.954
  182    HA   ALA  25           HA       ALA  25  19.619   5.973  11.594
  183    HB1  ALA  25           HB1      ALA  25  18.909   5.013   9.281
  184    HB3  ALA  25           HB2      ALA  25  19.400   6.704   9.369
  185    HB2  ALA  25           HB3      ALA  25  17.688   6.286   9.301
  186    H    LEU  26           H        LEU  26  16.103   6.180  11.231
  187    HA   LEU  26           HA       LEU  26  15.863   8.962  11.673
  188    HB2  LEU  26           HB2      LEU  26  14.009   7.713  10.748
  189    HB3  LEU  26           HB3      LEU  26  13.923   6.689  12.177
  190    HG   LEU  26           HG       LEU  26  13.306   8.648  13.551
  191   HD12  LEU  26          HD11      LEU  26  12.633  10.741  12.219
  192   HD11  LEU  26          HD12      LEU  26  13.618  10.089  10.911
  193   HD13  LEU  26          HD13      LEU  26  14.360  10.483  12.463
  194   HD21  LEU  26          HD21      LEU  26  11.633   8.317  11.042
  195   HD23  LEU  26          HD22      LEU  26  11.068   9.017  12.556
  196   HD22  LEU  26          HD23      LEU  26  11.529   7.318  12.491
  197    H    LYS  27           H        LYS  27  15.769   6.189  13.875
  198    HA   LYS  27           HA       LYS  27  15.169   7.559  16.238
  199    HB2  LYS  27           HB2      LYS  27  15.210   5.083  15.981
  200    HB3  LYS  27           HB3      LYS  27  16.973   5.145  15.938
  201    HG2  LYS  27           HG2      LYS  27  17.017   6.138  18.185
  202    HG3  LYS  27           HG3      LYS  27  15.250   6.147  18.230
  203    HD2  LYS  27           HD2      LYS  27  15.238   3.679  18.001
  204    HD3  LYS  27           HD3      LYS  27  17.003   3.678  17.990
  205    HE2  LYS  27           HE2      LYS  27  17.031   4.674  20.243
  206    HE3  LYS  27           HE3      LYS  27  15.265   4.706  20.257
  207    HZ3  LYS  27           HZ1      LYS  27  16.062   2.761  21.414
  208    HZ2  LYS  27           HZ2      LYS  27  16.981   2.282  20.065
  209    HZ1  LYS  27           HZ3      LYS  27  15.283   2.279  19.985
  210    H    GLN  28           H        GLN  28  18.288   6.987  14.649
  211    HA   GLN  28           HA       GLN  28  19.967   8.085  16.636
  212    HB2  GLN  28           HB2      GLN  28  20.259   8.039  13.621
  213    HB3  GLN  28           HB3      GLN  28  21.543   8.506  14.736
  214    HG2  GLN  28           HG2      GLN  28  20.122   5.828  14.759
  215    HG3  GLN  28           HG3      GLN  28  21.711   6.119  14.056
  216   HE21  GLN  28          HE21      GLN  28  20.421   4.785  16.735
  217   HE22  GLN  28          HE22      GLN  28  21.594   5.205  17.885
  218    H    ALA  29           H        ALA  29  18.209   9.551  13.939
  219    HA   ALA  29           HA       ALA  29  19.197  12.177  14.184
  220    HB2  ALA  29           HB1      ALA  29  17.496  12.802  12.710
  221    HB1  ALA  29           HB2      ALA  29  16.357  11.626  13.365
  222    HB3  ALA  29           HB3      ALA  29  17.689  11.086  12.344
  223    H    LYS  30           H        LYS  30  16.426  10.571  15.709
  224    HA   LYS  30           HA       LYS  30  15.403  12.825  17.059
  225    HB2  LYS  30           HB2      LYS  30  15.302   9.886  17.772
  226    HB3  LYS  30           HB3      LYS  30  14.432  11.135  18.662
  227    HG2  LYS  30           HG2      LYS  30  13.305  11.811  16.541
  228    HG3  LYS  30           HG3      LYS  30  14.114  10.475  15.719
  229    HD2  LYS  30           HD2      LYS  30  13.048   8.868  17.252
  230    HD3  LYS  30           HD3      LYS  30  12.248  10.193  18.098
  231    HE2  LYS  30           HE2      LYS  30  11.078  10.815  16.004
  232    HE3  LYS  30           HE3      LYS  30  11.858   9.462  15.177
  233    HZ2  LYS  30           HZ1      LYS  30   9.551   9.047  16.058
  234    HZ1  LYS  30           HZ2      LYS  30  10.218   9.107  17.625
  235    HZ3  LYS  30           HZ3      LYS  30  10.731   7.920  16.519
  236    H    GLN  31           H        GLN  31  18.071  10.667  17.803
  237    HA   GLN  31           HA       GLN  31  18.395  11.691  20.495
  238    HB2  GLN  31           HB2      GLN  31  20.423  10.122  18.895
  239    HB3  GLN  31           HB3      GLN  31  20.288  10.251  20.649
  240    HG2  GLN  31           HG2      GLN  31  17.778   9.288  19.883
  241    HG3  GLN  31           HG3      GLN  31  18.883   8.444  18.806
  242   HE21  GLN  31          HE21      GLN  31  17.344   7.300  21.085
  243   HE22  GLN  31          HE22      GLN  31  18.502   6.646  22.138
  244    H    GLY  32           H        GLY  32  18.910  13.001  17.524
  245    HA3  GLY  32           HA2      GLY  32  19.888  15.048  17.004
  246    HA2  GLY  32           HA3      GLY  32  20.645  15.060  18.592
  247    H    ASP  33           H        ASP  33  21.077  12.163  16.824
  248    HA   ASP  33           HA       ASP  33  23.900  12.847  16.356
  249    HB2  ASP  33           HB2      ASP  33  22.400  10.226  16.480
  250    HB3  ASP  33           HB3      ASP  33  24.086  10.347  15.985
  251    H    PHE  34           H        PHE  34  23.414  14.163  14.471
  252    HA   PHE  34           HA       PHE  34  22.069  13.167  12.186
  253    HB2  PHE  34           HB2      PHE  34  24.193  15.309  12.410
  254    HB3  PHE  34           HB3      PHE  34  23.208  15.011  10.979
  255    HD1  PHE  34           HD1      PHE  34  23.452  16.955  13.887
  256    HD2  PHE  34           HD2      PHE  34  20.582  14.822  11.507
  257    HE1  PHE  34           HE1      PHE  34  21.631  18.349  14.830
  258    HE2  PHE  34           HE2      PHE  34  18.765  16.216  12.453
  259    HZ   PHE  34           HZ       PHE  34  19.292  17.980  14.109
  260    H    ALA  35           H        ALA  35  25.444  12.995  13.195
  261    HA   ALA  35           HA       ALA  35  26.553  12.170  10.741
  262    HB3  ALA  35           HB1      ALA  35  28.237  11.012  12.464
  263    HB2  ALA  35           HB2      ALA  35  27.370  12.038  13.607
  264    HB1  ALA  35           HB3      ALA  35  28.204  12.760  12.232
  265    H    ALA  36           H        ALA  36  25.444  10.219  13.512
  266    HA   ALA  36           HA       ALA  36  25.939   7.729  12.244
  267    HB2  ALA  36           HB1      ALA  36  25.510   6.987  14.322
  268    HB3  ALA  36           HB2      ALA  36  23.821   7.475  14.170
  269    HB1  ALA  36           HB3      ALA  36  25.017   8.613  14.789
  270    H    ALA  37           H        ALA  37  23.108   9.844  12.371
  271    HA   ALA  37           HA       ALA  37  21.260   8.063  11.200
  272    HB3  ALA  37           HB1      ALA  37  21.472  11.027  11.484
  273    HB1  ALA  37           HB2      ALA  37  20.165   9.945  11.959
  274    HB2  ALA  37           HB3      ALA  37  20.352  10.412  10.268
  275    H    LYS  38           H        LYS  38  23.348  10.529   9.714
  276    HA   LYS  38           HA       LYS  38  22.711  10.090   7.038
  277    HB2  LYS  38           HB2      LYS  38  24.514  11.660   8.479
  278    HB3  LYS  38           HB3      LYS  38  25.551  10.672   7.456
  279    HG2  LYS  38           HG2      LYS  38  24.383  11.431   5.458
  280    HG3  LYS  38           HG3      LYS  38  23.185  12.283   6.436
  281    HD2  LYS  38           HD2      LYS  38  24.772  13.891   7.184
  282    HD3  LYS  38           HD3      LYS  38  26.137  12.910   6.651
  283    HE2  LYS  38           HE2      LYS  38  25.771  14.775   5.094
  284    HE3  LYS  38           HE3      LYS  38  25.444  13.233   4.294
  285    HZ3  LYS  38           HZ1      LYS  38  23.245  13.667   4.163
  286    HZ2  LYS  38           HZ2      LYS  38  23.759  15.285   4.245
  287    HZ1  LYS  38           HZ3      LYS  38  23.189  14.502   5.640
  288    H    ALA  39           H        ALA  39  25.233   8.510   8.999
  289    HA   ALA  39           HA       ALA  39  26.310   6.921   6.935
  290    HB2  ALA  39           HB1      ALA  39  26.226   5.966   9.781
  291    HB1  ALA  39           HB2      ALA  39  27.171   7.395   9.361
  292    HB3  ALA  39           HB3      ALA  39  27.531   5.844   8.602
  293    H    MET  40           H        MET  40  23.700   6.299   9.235
  294    HA   MET  40           HA       MET  40  23.271   3.589   8.508
  295    HB2  MET  40           HB2      MET  40  21.444   5.627   9.794
  296    HB3  MET  40           HB3      MET  40  21.046   3.915   9.625
  297    HG2  MET  40           HG2      MET  40  23.591   4.874  10.963
  298    HG3  MET  40           HG3      MET  40  22.098   4.593  11.857
  299    HE3  MET  40           HE1      MET  40  21.554   0.957  12.043
  300    HE2  MET  40           HE2      MET  40  20.678   2.253  11.232
  301    HE1  MET  40           HE3      MET  40  21.417   2.549  12.804
  302    H    MET  41           H        MET  41  21.841   6.631   7.312
  303    HA   MET  41           HA       MET  41  19.891   5.420   5.643
  304    HB2  MET  41           HB2      MET  41  21.357   8.017   5.122
  305    HB3  MET  41           HB3      MET  41  19.832   7.513   4.405
  306    HG2  MET  41           HG2      MET  41  19.087   7.328   6.957
  307    HG3  MET  41           HG3      MET  41  20.390   8.493   7.176
  308    HE2  MET  41           HE1      MET  41  19.820   9.768   3.835
  309    HE1  MET  41           HE2      MET  41  20.774  10.217   5.245
  310    HE3  MET  41           HE3      MET  41  19.495  11.288   4.678
  311    H    ASP  42           H        ASP  42  23.258   6.361   5.088
  312    HA   ASP  42           HA       ASP  42  23.353   5.879   2.331
  313    HB2  ASP  42           HB2      ASP  42  25.098   6.891   4.098
  314    HB3  ASP  42           HB3      ASP  42  25.765   5.269   3.975
  315    H    GLN  43           H        GLN  43  24.089   3.736   5.058
  316    HA   GLN  43           HA       GLN  43  24.767   1.478   3.483
  317    HB2  GLN  43           HB2      GLN  43  23.743   1.664   6.326
  318    HB3  GLN  43           HB3      GLN  43  24.330   0.176   5.575
  319    HG2  GLN  43           HG2      GLN  43  26.487   1.398   5.060
  320    HG3  GLN  43           HG3      GLN  43  25.896   2.724   6.056
  321   HE21  GLN  43          HE21      GLN  43  28.135   1.767   7.096
  322   HE22  GLN  43          HE22      GLN  43  27.867   0.687   8.375
  323    H    SER  44           H        SER  44  21.704   2.598   4.864
  324    HA   SER  44           HA       SER  44  20.148   0.344   4.198
  325    HB2  SER  44           HB2      SER  44  19.692   2.873   5.336
  326    HB3  SER  44           HB3      SER  44  18.658   2.820   3.911
  327    HG   SER  44           HG       SER  44  17.570   1.876   5.637
  328    H    ARG  45           H        ARG  45  20.874   3.307   2.384
  329    HA   ARG  45           HA       ARG  45  19.352   2.806   0.081
  330    HB2  ARG  45           HB2      ARG  45  20.483   4.950   0.659
  331    HB3  ARG  45           HB3      ARG  45  22.032   4.203   0.276
  332    HG2  ARG  45           HG2      ARG  45  21.251   3.786  -2.037
  333    HG3  ARG  45           HG3      ARG  45  19.714   4.556  -1.653
  334    HD2  ARG  45           HD2      ARG  45  20.953   6.662  -1.075
  335    HD3  ARG  45           HD3      ARG  45  22.454   5.895  -1.642
  336    HE   ARG  45           HE       ARG  45  20.525   5.640  -3.677
  337   HH21  ARG  45          HH11      ARG  45  20.510   7.004  -5.444
  338   HH22  ARG  45          HH12      ARG  45  21.258   8.558  -5.344
  339   HH11  ARG  45          HH21      ARG  45  22.241   8.153  -2.058
  340   HH12  ARG  45          HH22      ARG  45  22.238   9.208  -3.424
  341    H    MET  46           H        MET  46  22.721   1.951   0.831
  342    HA   MET  46           HA       MET  46  23.332   0.754  -1.650
  343    HB2  MET  46           HB2      MET  46  24.441   0.441   1.140
  344    HB3  MET  46           HB3      MET  46  25.103  -0.451  -0.234
  345    HG2  MET  46           HG2      MET  46  25.542   1.651  -1.420
  346    HG3  MET  46           HG3      MET  46  24.819   2.567  -0.105
  347    HE2  MET  46           HE1      MET  46  28.803   0.380  -0.282
  348    HE1  MET  46           HE2      MET  46  27.410   0.259  -1.352
  349    HE3  MET  46           HE3      MET  46  27.424  -0.634   0.168
  350    H    ALA  47           H        ALA  47  21.957  -0.577   1.331
  351    HA   ALA  47           HA       ALA  47  21.916  -3.292   0.537
  352    HB2  ALA  47           HB1      ALA  47  21.536  -2.826   2.840
  353    HB3  ALA  47           HB2      ALA  47  20.002  -3.438   2.224
  354    HB1  ALA  47           HB3      ALA  47  20.224  -1.706   2.476
  355    H    LEU  48           H        LEU  48  19.551  -0.677   0.173
  356    HA   LEU  48           HA       LEU  48  17.512  -2.224  -1.072
  357    HB2  LEU  48           HB2      LEU  48  18.153   0.733  -1.197
  358    HB3  LEU  48           HB3      LEU  48  16.685   0.013  -1.860
  359    HG   LEU  48           HG       LEU  48  17.542  -0.275   1.029
  360   HD13  LEU  48          HD11      LEU  48  17.114   2.023   0.835
  361   HD12  LEU  48          HD12      LEU  48  15.559   1.370   1.348
  362   HD11  LEU  48          HD13      LEU  48  15.827   1.788  -0.345
  363   HD22  LEU  48          HD21      LEU  48  16.021  -1.998   0.655
  364   HD21  LEU  48          HD22      LEU  48  15.142  -1.103  -0.585
  365   HD23  LEU  48          HD23      LEU  48  14.929  -0.694   1.117
  366    H    ASN  49           H        ASN  49  20.191  -0.289  -2.311
  367    HA   ASN  49           HA       ASN  49  19.538  -0.384  -5.034
  368    HB2  ASN  49           HB2      ASN  49  21.213   1.140  -4.107
  369    HB3  ASN  49           HB3      ASN  49  22.252  -0.219  -3.691
  370   HD21  ASN  49          HD21      ASN  49  23.992   0.327  -5.089
  371   HD22  ASN  49          HD22      ASN  49  23.849   0.336  -6.780
  372    H    GLU  50           H        GLU  50  21.533  -2.564  -3.066
  373    HA   GLU  50           HA       GLU  50  22.240  -4.324  -5.187
  374    HB2  GLU  50           HB2      GLU  50  23.440  -4.286  -3.022
  375    HB3  GLU  50           HB3      GLU  50  22.001  -4.917  -2.222
  376    HG2  GLU  50           HG2      GLU  50  22.097  -6.955  -3.574
  377    HG3  GLU  50           HG3      GLU  50  23.469  -6.320  -4.479
  378    H    ALA  51           H        ALA  51  19.586  -4.261  -2.858
  379    HA   ALA  51           HA       ALA  51  18.429  -6.742  -3.605
  380    HB3  ALA  51           HB1      ALA  51  16.836  -6.237  -2.049
  381    HB1  ALA  51           HB2      ALA  51  16.616  -4.593  -2.654
  382    HB2  ALA  51           HB3      ALA  51  17.978  -4.970  -1.598
  383    H    HIS  52           H        HIS  52  17.828  -3.400  -4.651
  384    HA   HIS  52           HA       HIS  52  15.715  -3.942  -6.446
  385    HB2  HIS  52           HB2      HIS  52  16.359  -1.671  -5.654
  386    HB3  HIS  52           HB3      HIS  52  17.809  -1.765  -6.651
  387    HD1  HIS  52           HD1      HIS  52  17.444  -1.867  -9.274
  388    HD2  HIS  52           HD2      HIS  52  14.000  -1.078  -7.062
  389    HE1  HIS  52           HE1      HIS  52  15.717  -1.013 -10.917
  390    HE2  HIS  52           HE2      HIS  52  13.612  -0.527  -9.584
  391    H    LEU  53           H        LEU  53  19.233  -3.934  -6.884
  392    HA   LEU  53           HA       LEU  53  19.288  -4.260  -9.683
  393    HB2  LEU  53           HB2      LEU  53  21.227  -5.005  -7.508
  394    HB3  LEU  53           HB3      LEU  53  21.542  -5.398  -9.195
  395    HG   LEU  53           HG       LEU  53  20.858  -2.586  -8.283
  396   HD13  LEU  53          HD11      LEU  53  22.893  -3.211  -7.127
  397   HD12  LEU  53          HD12      LEU  53  23.330  -2.173  -8.483
  398   HD11  LEU  53          HD13      LEU  53  23.562  -3.913  -8.598
  399   HD23  LEU  53          HD21      LEU  53  22.278  -2.147 -10.440
  400   HD22  LEU  53          HD22      LEU  53  20.606  -2.668 -10.623
  401   HD21  LEU  53          HD23      LEU  53  21.911  -3.821 -10.837
  402    H    VAL  54           H        VAL  54  19.189  -6.637  -7.048
  403    HA   VAL  54           HA       VAL  54  19.320  -8.938  -8.699
  404    HB   VAL  54           HB       VAL  54  18.168  -8.509  -5.931
  405   HG12  VAL  54          HG11      VAL  54  18.504 -11.125  -5.917
  406   HG11  VAL  54          HG12      VAL  54  18.316 -10.964  -7.663
  407   HG13  VAL  54          HG13      VAL  54  17.026 -10.435  -6.585
  408   HG22  VAL  54          HG21      VAL  54  20.483  -8.286  -5.712
  409   HG21  VAL  54          HG22      VAL  54  20.823  -9.382  -7.050
  410   HG23  VAL  54          HG23      VAL  54  20.298 -10.025  -5.494
  411    H    GLN  55           H        GLN  55  16.585  -7.042  -7.420
  412    HA   GLN  55           HA       GLN  55  14.571  -8.720  -8.484
  413    HB2  GLN  55           HB2      GLN  55  13.817  -7.192  -6.863
  414    HB3  GLN  55           HB3      GLN  55  14.602  -5.823  -7.645
  415    HG2  GLN  55           HG2      GLN  55  12.874  -5.513  -9.134
  416    HG3  GLN  55           HG3      GLN  55  12.561  -7.236  -9.297
  417   HE21  GLN  55          HE21      GLN  55  10.558  -7.791  -8.487
  418   HE22  GLN  55          HE22      GLN  55   9.782  -7.036  -7.181
  419    H    THR  56           H        THR  56  16.294  -5.917  -9.857
  420    HA   THR  56           HA       THR  56  14.851  -5.572 -12.205
  421    HB   THR  56           HB       THR  56  17.870  -5.467 -12.045
  422    HG1  THR  56           HG1      THR  56  16.199  -4.232 -10.512
  423   HG21  THR  56          HG21      THR  56  16.495  -5.191 -14.252
  424   HG23  THR  56          HG22      THR  56  17.756  -4.017 -13.875
  425   HG22  THR  56          HG23      THR  56  16.063  -3.619 -13.576
  426    H    LYS  57           H        LYS  57  17.514  -7.853 -11.588
  427    HA   LYS  57           HA       LYS  57  17.517  -9.058 -14.162
  428    HB2  LYS  57           HB2      LYS  57  19.310  -9.293 -12.414
  429    HB3  LYS  57           HB3      LYS  57  18.212 -10.295 -11.477
  430    HG2  LYS  57           HG2      LYS  57  18.130 -11.951 -13.267
  431    HG3  LYS  57           HG3      LYS  57  19.139 -10.936 -14.291
  432    HD2  LYS  57           HD2      LYS  57  20.983 -11.119 -12.650
  433    HD3  LYS  57           HD3      LYS  57  19.978 -12.161 -11.643
  434    HE2  LYS  57           HE2      LYS  57  20.827 -12.767 -14.498
  435    HE3  LYS  57           HE3      LYS  57  21.516 -13.511 -13.057
  436    HZ3  LYS  57           HZ1      LYS  57  19.614 -14.684 -12.638
  437    HZ2  LYS  57           HZ2      LYS  57  19.618 -14.681 -14.336
  438    HZ1  LYS  57           HZ3      LYS  57  18.613 -13.609 -13.484
  439    H    LEU  58           H        LEU  58  15.744  -9.723 -11.181
  440    HA   LEU  58           HA       LEU  58  14.534 -12.107 -12.104
  441    HB2  LEU  58           HB2      LEU  58  13.732 -10.197  -9.915
  442    HB3  LEU  58           HB3      LEU  58  12.934 -11.740 -10.224
  443    HG   LEU  58           HG       LEU  58  15.906 -11.443  -9.675
  444   HD11  LEU  58          HD11      LEU  58  13.540 -11.866  -7.877
  445   HD13  LEU  58          HD12      LEU  58  14.988 -10.894  -7.620
  446   HD12  LEU  58          HD13      LEU  58  15.070 -12.649  -7.478
  447   HD22  LEU  58          HD21      LEU  58  15.798 -13.510 -10.693
  448   HD21  LEU  58          HD22      LEU  58  14.086 -13.728 -10.329
  449   HD23  LEU  58          HD23      LEU  58  15.298 -14.016  -9.081
  450    H    ILE  59           H        ILE  59  13.843  -8.777 -12.799
  451    HA   ILE  59           HA       ILE  59  11.130  -9.444 -13.733
  452    HB   ILE  59           HB       ILE  59  11.923  -7.153 -12.538
  453   HG12  ILE  59          HG12      ILE  59  10.014  -7.058 -14.885
  454   HG13  ILE  59          HG13      ILE  59   9.601  -7.811 -13.366
  455   HG21  ILE  59          HG21      ILE  59  13.462  -6.755 -14.602
  456   HG23  ILE  59          HG22      ILE  59  12.480  -5.419 -14.043
  457   HG22  ILE  59          HG23      ILE  59  11.986  -6.359 -15.448
  458   HD13  ILE  59          HD11      ILE  59   8.786  -5.553 -13.270
  459   HD12  ILE  59          HD12      ILE  59  10.341  -4.923 -13.808
  460   HD11  ILE  59          HD13      ILE  59  10.191  -5.649 -12.207
  461    H    GLU  60           H        GLU  60  14.327  -8.580 -14.999
  462    HA   GLU  60           HA       GLU  60  13.541  -8.195 -17.708
  463    HB2  GLU  60           HB2      GLU  60  15.718  -7.446 -16.862
  464    HB3  GLU  60           HB3      GLU  60  16.190  -9.116 -16.556
  465    HG2  GLU  60           HG2      GLU  60  15.996  -9.618 -18.967
  466    HG3  GLU  60           HG3      GLU  60  15.519  -7.949 -19.275
  467    H    GLY  61           H        GLY  61  14.538 -11.063 -15.882
  468    HA3  GLY  61           HA2      GLY  61  14.002 -12.724 -18.276
  469    HA2  GLY  61           HA3      GLY  61  15.039 -13.194 -16.933
  470    H    ASP  62           H        ASP  62  11.910 -11.664 -16.564
  471    HA   ASP  62           HA       ASP  62  10.844 -13.101 -14.584
  472    HB2  ASP  62           HB2      ASP  62   8.619 -12.654 -15.531
  473    HB3  ASP  62           HB3      ASP  62   9.678 -11.253 -15.667
  474    H    ALA  63           H        ALA  63  10.487 -15.217 -14.130
  475    HA   ALA  63           HA       ALA  63  10.796 -17.297 -16.061
  476    HB2  ALA  63           HB1      ALA  63  10.307 -18.791 -14.290
  477    HB3  ALA  63           HB2      ALA  63   9.339 -17.592 -13.435
  478    HB1  ALA  63           HB3      ALA  63  11.093 -17.420 -13.507
  479    H    GLY  64           H        GLY  64   8.280 -18.502 -14.546
  480    HA3  GLY  64           HA2      GLY  64   5.928 -18.445 -14.874
  481    HA2  GLY  64           HA3      GLY  64   6.172 -17.395 -16.263
  482    H    GLU  65           H        GLU  65   5.338 -20.477 -15.360
  483    HA   GLU  65           HA       GLU  65   6.665 -22.051 -17.292
  484    HB2  GLU  65           HB2      GLU  65   4.052 -22.464 -15.847
  485    HB3  GLU  65           HB3      GLU  65   4.789 -23.673 -16.896
  486    HG2  GLU  65           HG2      GLU  65   6.803 -23.697 -15.515
  487    HG3  GLU  65           HG3      GLU  65   6.150 -22.417 -14.496
  488    H    GLY  66           H        GLY  66   3.654 -20.306 -17.373
  489    HA3  GLY  66           HA2      GLY  66   2.913 -21.186 -20.027
  490    HA2  GLY  66           HA3      GLY  66   2.032 -20.067 -19.008
  491    H    LYS  67           H        LYS  67   2.179 -19.546 -21.622
  492    HA   LYS  67           HA       LYS  67   4.168 -18.275 -22.866
  493    HB2  LYS  67           HB2      LYS  67   2.296 -16.658 -23.724
  494    HB3  LYS  67           HB3      LYS  67   2.201 -18.390 -24.068
  495    HG2  LYS  67           HG2      LYS  67   0.732 -18.735 -22.150
  496    HG3  LYS  67           HG3      LYS  67   0.892 -17.042 -21.687
  497    HD2  LYS  67           HD2      LYS  67  -0.183 -16.361 -23.802
  498    HD3  LYS  67           HD3      LYS  67  -0.350 -18.058 -24.259
  499    HE2  LYS  67           HE2      LYS  67  -1.733 -18.468 -22.258
  500    HE3  LYS  67           HE3      LYS  67  -1.566 -16.776 -21.793
  501    HZ3  LYS  67           HZ1      LYS  67  -3.191 -16.218 -23.168
  502    HZ2  LYS  67           HZ2      LYS  67  -3.475 -17.866 -23.456
  503    HZ1  LYS  67           HZ3      LYS  67  -2.439 -16.988 -24.478
  504    H    MET  68           H        MET  68   2.004 -15.797 -22.126
  505    HA   MET  68           HA       MET  68   3.946 -13.861 -21.557
  506    HB2  MET  68           HB2      MET  68   0.974 -13.858 -21.026
  507    HB3  MET  68           HB3      MET  68   2.012 -12.433 -20.968
  508    HG2  MET  68           HG2      MET  68   1.681 -14.219 -23.393
  509    HG3  MET  68           HG3      MET  68   0.855 -12.678 -23.163
  510    HE1  MET  68           HE1      MET  68   1.687 -10.599 -22.997
  511    HE3  MET  68           HE2      MET  68   3.237  -9.974 -23.551
  512    HE2  MET  68           HE3      MET  68   3.092 -10.631 -21.923
  513    H    LYS  69           H        LYS  69   1.927 -15.753 -19.301
  514    HA   LYS  69           HA       LYS  69   2.094 -14.390 -16.984
  515    HB2  LYS  69           HB2      LYS  69   0.992 -16.565 -17.238
  516    HB3  LYS  69           HB3      LYS  69   2.568 -17.362 -17.227
  517    HG2  LYS  69           HG2      LYS  69   3.028 -16.507 -14.985
  518    HG3  LYS  69           HG3      LYS  69   1.511 -15.606 -14.993
  519    HD2  LYS  69           HD2      LYS  69   0.259 -17.730 -15.180
  520    HD3  LYS  69           HD3      LYS  69   1.781 -18.623 -15.140
  521    HE2  LYS  69           HE2      LYS  69   2.281 -17.681 -12.916
  522    HE3  LYS  69           HE3      LYS  69   0.761 -16.788 -12.952
  523    HZ1  LYS  69           HZ1      LYS  69   0.241 -19.478 -13.541
  524    HZ3  LYS  69           HZ2      LYS  69  -0.285 -18.567 -12.208
  525    HZ2  LYS  69           HZ3      LYS  69   1.182 -19.420 -12.131
  526    H    VAL  70           H        VAL  70   3.399 -14.282 -15.097
  527    HA   VAL  70           HA       VAL  70   6.278 -14.864 -15.505
  528    HB   VAL  70           HB       VAL  70   6.740 -12.771 -14.232
  529   HG12  VAL  70          HG11      VAL  70   5.001 -12.067 -16.587
  530   HG11  VAL  70          HG12      VAL  70   6.483 -12.993 -16.824
  531   HG13  VAL  70          HG13      VAL  70   6.556 -11.379 -16.117
  532   HG21  VAL  70          HG21      VAL  70   3.728 -12.643 -14.294
  533   HG23  VAL  70          HG22      VAL  70   4.659 -11.145 -14.298
  534   HG22  VAL  70          HG23      VAL  70   4.824 -12.281 -12.960
  535    H    SER  71           H        SER  71   7.452 -14.732 -13.326
  536    HA   SER  71           HA       SER  71   6.457 -16.682 -11.545
  537    HB2  SER  71           HB2      SER  71   8.868 -16.068 -11.796
  538    HB3  SER  71           HB3      SER  71   8.530 -14.549 -10.969
  539    HG   SER  71           HG       SER  71   8.330 -17.200  -9.996
  540    H    LEU  72           H        LEU  72   5.064 -16.550  -9.912
  541    HA   LEU  72           HA       LEU  72   3.502 -14.244  -9.475
  542    HB2  LEU  72           HB2      LEU  72   3.805 -16.796  -7.899
  543    HB3  LEU  72           HB3      LEU  72   2.634 -15.543  -7.497
  544    HG   LEU  72           HG       LEU  72   2.787 -16.845 -10.235
  545   HD12  LEU  72          HD11      LEU  72   0.875 -17.481  -7.971
  546   HD11  LEU  72          HD12      LEU  72   2.258 -18.483  -8.405
  547   HD13  LEU  72          HD13      LEU  72   0.939 -18.257  -9.553
  548   HD23  LEU  72          HD21      LEU  72   0.300 -16.030 -10.135
  549   HD22  LEU  72          HD22      LEU  72   1.546 -14.837 -10.469
  550   HD21  LEU  72          HD23      LEU  72   0.866 -14.970  -8.850
  551    H    VAL  73           H        VAL  73   6.168 -15.660  -7.699
  552    HA   VAL  73           HA       VAL  73   6.100 -14.118  -5.372
  553    HB   VAL  73           HB       VAL  73   8.284 -14.917  -4.941
  554   HG11  VAL  73          HG11      VAL  73   6.437 -16.632  -5.143
  555   HG13  VAL  73          HG12      VAL  73   8.062 -17.277  -5.380
  556   HG12  VAL  73          HG13      VAL  73   7.021 -16.973  -6.771
  557   HG23  VAL  73          HG21      VAL  73   9.462 -16.090  -7.005
  558   HG22  VAL  73          HG22      VAL  73   9.632 -14.354  -6.749
  559   HG21  VAL  73          HG23      VAL  73   8.474 -14.961  -7.933
  560    H    LEU  74           H        LEU  74   7.083 -13.230  -8.552
  561    HA   LEU  74           HA       LEU  74   9.018 -11.269  -8.067
  562    HB2  LEU  74           HB2      LEU  74   8.575 -12.021 -10.303
  563    HB3  LEU  74           HB3      LEU  74   6.899 -11.482 -10.204
  564    HG   LEU  74           HG       LEU  74   7.665  -9.140  -9.994
  565   HD12  LEU  74          HD11      LEU  74  10.156  -8.800 -10.591
  566   HD11  LEU  74          HD12      LEU  74  10.369 -10.483 -10.109
  567   HD13  LEU  74          HD13      LEU  74   9.787  -9.297  -8.940
  568   HD21  LEU  74          HD21      LEU  74   7.424 -10.563 -12.210
  569   HD23  LEU  74          HD22      LEU  74   9.139 -10.239 -12.310
  570   HD22  LEU  74          HD23      LEU  74   8.011  -8.903 -12.255
  571    H    VAL  75           H        VAL  75   5.520 -10.905  -8.421
  572    HA   VAL  75           HA       VAL  75   5.409  -8.147  -7.844
  573    HB   VAL  75           HB       VAL  75   3.332 -10.302  -7.452
  574   HG11  VAL  75          HG11      VAL  75   3.127  -7.263  -7.290
  575   HG13  VAL  75          HG12      VAL  75   2.830  -8.402  -5.986
  576   HG12  VAL  75          HG13      VAL  75   1.745  -8.352  -7.367
  577   HG21  VAL  75          HG21      VAL  75   3.808  -8.196  -9.589
  578   HG23  VAL  75          HG22      VAL  75   2.419  -9.280  -9.535
  579   HG22  VAL  75          HG23      VAL  75   4.039  -9.933  -9.782
  580    H    GLU  76           H        GLU  76   5.171 -11.018  -5.724
  581    HA   GLU  76           HA       GLU  76   4.693  -9.651  -3.308
  582    HB2  GLU  76           HB2      GLU  76   4.528 -12.116  -3.522
  583    HB3  GLU  76           HB3      GLU  76   6.261 -12.213  -3.781
  584    HG2  GLU  76           HG2      GLU  76   5.834 -12.787  -1.474
  585    HG3  GLU  76           HG3      GLU  76   6.596 -11.207  -1.480
  586    H    ALA  77           H        ALA  77   7.758 -10.547  -4.867
  587    HA   ALA  77           HA       ALA  77   9.441  -9.487  -2.855
  588    HB1  ALA  77           HB1      ALA  77   9.999 -11.020  -4.892
  589    HB2  ALA  77           HB2      ALA  77  11.206  -9.863  -4.332
  590    HB3  ALA  77           HB3      ALA  77  10.228  -9.496  -5.753
  591    H    GLN  78           H        GLN  78   8.043  -8.088  -5.774
  592    HA   GLN  78           HA       GLN  78   9.382  -5.601  -5.678
  593    HB2  GLN  78           HB2      GLN  78   8.065  -6.559  -7.621
  594    HB3  GLN  78           HB3      GLN  78   6.598  -6.117  -6.751
  595    HG2  GLN  78           HG2      GLN  78   7.271  -3.771  -6.742
  596    HG3  GLN  78           HG3      GLN  78   8.796  -4.180  -7.527
  597   HE21  GLN  78          HE21      GLN  78   7.669  -6.151  -9.386
  598   HE22  GLN  78          HE22      GLN  78   6.740  -5.286 -10.514
  599    H    LEU  79           H        LEU  79   6.368  -6.749  -4.245
  600    HA   LEU  79           HA       LEU  79   5.362  -4.343  -3.245
  601    HB2  LEU  79           HB2      LEU  79   4.057  -6.401  -3.183
  602    HB3  LEU  79           HB3      LEU  79   5.205  -7.131  -2.064
  603    HG   LEU  79           HG       LEU  79   4.644  -5.485  -0.344
  604   HD13  LEU  79          HD11      LEU  79   4.169  -3.477  -1.402
  605   HD12  LEU  79          HD12      LEU  79   2.546  -4.008  -0.962
  606   HD11  LEU  79          HD13      LEU  79   3.129  -4.234  -2.609
  607   HD23  LEU  79          HD21      LEU  79   2.059  -5.989  -0.254
  608   HD22  LEU  79          HD22      LEU  79   3.205  -7.323  -0.140
  609   HD21  LEU  79          HD23      LEU  79   2.391  -6.995  -1.666
  610    H    HIS  80           H        HIS  80   7.554  -6.662  -1.652
  611    HA   HIS  80           HA       HIS  80   7.833  -5.110   0.711
  612    HB2  HIS  80           HB2      HIS  80   9.183  -7.472  -0.478
  613    HB3  HIS  80           HB3      HIS  80  10.088  -6.567   0.737
  614    HD1  HIS  80           HD1      HIS  80   9.598  -7.197   3.081
  615    HD2  HIS  80           HD2      HIS  80   6.388  -8.071   0.569
  616    HE1  HIS  80           HE1      HIS  80   7.830  -8.303   4.532
  617    HE2  HIS  80           HE2      HIS  80   5.867  -8.840   3.009
  618    H    LEU  81           H        LEU  81   9.843  -5.388  -2.198
  619    HA   LEU  81           HA       LEU  81  11.878  -3.635  -1.323
  620    HB2  LEU  81           HB2      LEU  81  10.964  -4.441  -4.085
  621    HB3  LEU  81           HB3      LEU  81  12.379  -3.428  -3.796
  622    HG   LEU  81           HG       LEU  81  11.996  -6.146  -2.513
  623   HD12  LEU  81          HD11      LEU  81  13.817  -6.771  -4.259
  624   HD11  LEU  81          HD12      LEU  81  13.247  -5.353  -5.136
  625   HD13  LEU  81          HD13      LEU  81  12.140  -6.680  -4.794
  626   HD23  LEU  81          HD21      LEU  81  14.623  -5.820  -2.497
  627   HD22  LEU  81          HD22      LEU  81  13.637  -5.059  -1.251
  628   HD21  LEU  81          HD23      LEU  81  14.213  -4.110  -2.620
  629    H    MET  82           H        MET  82   8.955  -3.017  -3.266
  630    HA   MET  82           HA       MET  82   9.485  -0.291  -3.776
  631    HB2  MET  82           HB2      MET  82   6.931  -1.894  -3.648
  632    HB3  MET  82           HB3      MET  82   6.925  -0.171  -4.019
  633    HG2  MET  82           HG2      MET  82   8.535  -2.244  -5.545
  634    HG3  MET  82           HG3      MET  82   6.967  -1.629  -6.061
  635    HE3  MET  82           HE1      MET  82   7.403   1.823  -7.245
  636    HE2  MET  82           HE2      MET  82   7.027   1.601  -5.538
  637    HE1  MET  82           HE3      MET  82   6.368   0.485  -6.729
  638    H    THR  83           H        THR  83   7.696  -1.887  -1.167
  639    HA   THR  83           HA       THR  83   6.834   0.463   0.150
  640    HB   THR  83           HB       THR  83   6.703  -1.105   2.173
  641    HG1  THR  83           HG1      THR  83   7.467  -3.053   1.951
  642   HG22  THR  83          HG21      THR  83   5.057  -2.682   0.708
  643   HG21  THR  83          HG22      THR  83   5.281  -1.356  -0.428
  644   HG23  THR  83          HG23      THR  83   4.637  -1.038   1.183
  645    H    SER  84           H        SER  84   9.665  -1.623   0.682
  646    HA   SER  84           HA       SER  84  10.716  -0.181   2.866
  647    HB2  SER  84           HB2      SER  84  11.979  -2.027   0.849
  648    HB3  SER  84           HB3      SER  84  12.921  -1.265   2.130
  649    HG   SER  84           HG       SER  84  10.651  -2.962   2.392
  650    H    MET  85           H        MET  85  11.473   0.070  -0.622
  651    HA   MET  85           HA       MET  85  13.465   2.042  -0.375
  652    HB2  MET  85           HB2      MET  85  13.070   0.749  -2.436
  653    HB3  MET  85           HB3      MET  85  11.546   1.605  -2.672
  654    HG2  MET  85           HG2      MET  85  12.777   3.755  -2.759
  655    HG3  MET  85           HG3      MET  85  14.294   2.882  -2.564
  656    HE2  MET  85           HE1      MET  85  13.964   0.206  -4.634
  657    HE1  MET  85           HE2      MET  85  15.183   1.231  -3.879
  658    HE3  MET  85           HE3      MET  85  15.090   1.137  -5.633
  659    H    LEU  86           H        LEU  86   9.975   2.365  -0.890
  660    HA   LEU  86           HA       LEU  86   9.902   5.177  -1.082
  661    HB2  LEU  86           HB2      LEU  86   8.064   3.509  -1.654
  662    HB3  LEU  86           HB3      LEU  86   7.732   3.425   0.076
  663    HG   LEU  86           HG       LEU  86   7.564   5.985   0.014
  664   HD11  LEU  86          HD11      LEU  86   8.345   5.542  -2.685
  665   HD13  LEU  86          HD12      LEU  86   7.903   7.071  -1.931
  666   HD12  LEU  86          HD13      LEU  86   6.671   6.101  -2.734
  667   HD23  LEU  86          HD21      LEU  86   5.436   4.620  -1.647
  668   HD22  LEU  86          HD22      LEU  86   5.241   5.884  -0.435
  669   HD21  LEU  86          HD23      LEU  86   5.644   4.242   0.064
  670    H    ALA  87           H        ALA  87   9.439   3.007   1.672
  671    HA   ALA  87           HA       ALA  87   8.883   4.926   3.633
  672    HB1  ALA  87           HB1      ALA  87   9.698   2.108   3.558
  673    HB3  ALA  87           HB2      ALA  87   8.569   2.921   4.640
  674    HB2  ALA  87           HB3      ALA  87  10.297   2.958   4.986
  675    H    ARG  88           H        ARG  88  11.971   3.507   2.662
  676    HA   ARG  88           HA       ARG  88  13.575   4.895   4.491
  677    HB2  ARG  88           HB2      ARG  88  14.250   2.919   3.095
  678    HB3  ARG  88           HB3      ARG  88  14.401   4.007   1.719
  679    HG2  ARG  88           HG2      ARG  88  15.869   5.332   3.662
  680    HG3  ARG  88           HG3      ARG  88  16.193   3.645   4.048
  681    HD2  ARG  88           HD2      ARG  88  17.463   3.345   2.203
  682    HD3  ARG  88           HD3      ARG  88  16.325   4.210   1.166
  683    HE   ARG  88           HE       ARG  88  18.716   5.284   2.212
  684   HH21  ARG  88          HH11      ARG  88  19.055   7.503   2.010
  685   HH22  ARG  88          HH12      ARG  88  17.702   8.570   1.862
  686   HH11  ARG  88          HH21      ARG  88  15.375   6.027   1.928
  687   HH12  ARG  88          HH22      ARG  88  15.616   7.732   1.790
  688    H    GLU  89           H        GLU  89  12.603   5.779   1.164
  689    HA   GLU  89           HA       GLU  89  14.143   8.143   1.001
  690    HB2  GLU  89           HB2      GLU  89  13.004   7.092  -0.945
  691    HB3  GLU  89           HB3      GLU  89  11.457   7.631  -0.291
  692    HG2  GLU  89           HG2      GLU  89  12.153   9.970  -0.461
  693    HG3  GLU  89           HG3      GLU  89  13.759   9.482  -0.994
  694    H    LEU  90           H        LEU  90  10.814   7.628   2.128
  695    HA   LEU  90           HA       LEU  90  10.291  10.362   2.694
  696    HB2  LEU  90           HB2      LEU  90   9.102   7.789   3.729
  697    HB3  LEU  90           HB3      LEU  90   8.467   9.384   4.145
  698    HG   LEU  90           HG       LEU  90   8.890   8.495   1.280
  699   HD12  LEU  90          HD11      LEU  90   6.357   8.160   1.341
  700   HD11  LEU  90          HD12      LEU  90   6.510   8.156   3.098
  701   HD13  LEU  90          HD13      LEU  90   7.333   6.925   2.138
  702   HD22  LEU  90          HD21      LEU  90   8.590  10.802   1.198
  703   HD21  LEU  90          HD22      LEU  90   7.602  10.837   2.657
  704   HD23  LEU  90          HD23      LEU  90   6.908  10.275   1.137
  705    H    ILE  91           H        ILE  91  11.559   7.691   4.626
  706    HA   ILE  91           HA       ILE  91  11.694   9.065   7.090
  707    HB   ILE  91           HB       ILE  91  13.255   6.727   5.976
  708   HG12  ILE  91          HG12      ILE  91  11.236   6.897   8.233
  709   HG13  ILE  91          HG13      ILE  91  10.768   6.608   6.558
  710   HG22  ILE  91          HG21      ILE  91  13.723   6.524   8.618
  711   HG21  ILE  91          HG22      ILE  91  13.643   8.282   8.511
  712   HG23  ILE  91          HG23      ILE  91  14.824   7.394   7.550
  713   HD13  ILE  91          HD11      ILE  91  11.777   4.509   6.496
  714   HD12  ILE  91          HD12      ILE  91  11.182   4.572   8.155
  715   HD11  ILE  91          HD13      ILE  91  12.883   4.888   7.817
  716    H    THR  92           H        THR  92  13.914   8.892   4.341
  717    HA   THR  92           HA       THR  92  16.074  10.295   5.497
  718    HB   THR  92           HB       THR  92  15.091  10.158   2.636
  719    HG1  THR  92           HG1      THR  92  15.927   8.264   3.049
  720   HG22  THR  92          HG21      THR  92  17.659  10.854   2.343
  721   HG21  THR  92          HG22      THR  92  17.347  11.680   3.869
  722   HG23  THR  92          HG23      THR  92  16.377  12.060   2.446
  723    H    GLU  93           H        GLU  93  13.185  11.435   3.762
  724    HA   GLU  93           HA       GLU  93  13.772  14.198   3.867
  725    HB2  GLU  93           HB2      GLU  93  11.072  12.817   3.884
  726    HB3  GLU  93           HB3      GLU  93  11.355  14.516   3.506
  727    HG2  GLU  93           HG2      GLU  93  12.701  12.273   1.987
  728    HG3  GLU  93           HG3      GLU  93  11.153  12.949   1.497
  729    H    LEU  94           H        LEU  94  12.034  12.044   6.084
  730    HA   LEU  94           HA       LEU  94  11.217  13.995   7.953
  731    HB2  LEU  94           HB2      LEU  94  11.801  11.042   8.238
  732    HB3  LEU  94           HB3      LEU  94  11.226  12.021   9.584
  733    HG   LEU  94           HG       LEU  94   9.744  12.059   6.954
  734   HD11  LEU  94          HD11      LEU  94   9.831   9.846   8.966
  735   HD13  LEU  94          HD12      LEU  94   9.531   9.777   7.231
  736   HD12  LEU  94          HD13      LEU  94   8.250  10.294   8.327
  737   HD23  LEU  94          HD21      LEU  94   7.822  12.459   8.551
  738   HD22  LEU  94          HD22      LEU  94   9.057  13.717   8.585
  739   HD21  LEU  94          HD23      LEU  94   8.997  12.504   9.863
  740    H    ILE  95           H        ILE  95  14.197  12.073   7.725
  741    HA   ILE  95           HA       ILE  95  15.360  13.007  10.137
  742    HB   ILE  95           HB       ILE  95  16.604  11.932   7.593
  743   HG12  ILE  95          HG12      ILE  95  16.309  10.740  10.365
  744   HG13  ILE  95          HG13      ILE  95  15.144  10.474   9.069
  745   HG21  ILE  95          HG21      ILE  95  17.855  12.752  10.233
  746   HG23  ILE  95          HG22      ILE  95  18.317  13.275   8.613
  747   HG22  ILE  95          HG23      ILE  95  18.628  11.618   9.127
  748   HD13  ILE  95          HD11      ILE  95  16.629   9.195   7.812
  749   HD12  ILE  95          HD12      ILE  95  17.102   8.753   9.450
  750   HD11  ILE  95          HD13      ILE  95  18.052   9.933   8.547
  751    H    GLU  96           H        GLU  96  15.513  14.229   6.798
  752    HA   GLU  96           HA       GLU  96  17.354  16.314   7.269
  753    HB2  GLU  96           HB2      GLU  96  16.693  15.642   5.012
  754    HB3  GLU  96           HB3      GLU  96  15.048  16.196   5.309
  755    HG2  GLU  96           HG2      GLU  96  15.608  18.325   4.760
  756    HG3  GLU  96           HG3      GLU  96  16.906  18.333   5.943
  757    H    LEU  97           H        LEU  97  13.843  16.119   7.697
  758    HA   LEU  97           HA       LEU  97  13.418  18.854   8.329
  759    HB2  LEU  97           HB2      LEU  97  11.907  16.326   8.951
  760    HB3  LEU  97           HB3      LEU  97  11.389  17.874   9.617
  761    HG   LEU  97           HG       LEU  97  11.875  17.449   6.653
  762   HD12  LEU  97          HD11      LEU  97   9.352  17.314   6.534
  763   HD11  LEU  97          HD12      LEU  97   9.345  17.120   8.285
  764   HD13  LEU  97          HD13      LEU  97  10.130  15.911   7.268
  765   HD23  LEU  97          HD21      LEU  97  10.132  19.408   6.678
  766   HD22  LEU  97          HD22      LEU  97  11.812  19.774   7.070
  767   HD21  LEU  97          HD23      LEU  97  10.623  19.605   8.360
  768    H    HIS  98           H        HIS  98  14.247  16.037  10.335
  769    HA   HIS  98           HA       HIS  98  14.084  17.306  12.846
  770    HB2  HIS  98           HB2      HIS  98  15.841  15.050  11.853
  771    HB3  HIS  98           HB3      HIS  98  15.837  15.594  13.533
  772    HD1  HIS  98           HD1      HIS  98  13.643  13.950  10.945
  773    HD2  HIS  98           HD2      HIS  98  13.532  14.883  15.006
  774    HE1  HIS  98           HE1      HIS  98  11.621  12.753  11.901
  775    HE2  HIS  98           HE2      HIS  98  11.533  13.313  14.370
  776    H    GLU  99           H        GLU  99  16.639  17.189  10.413
  777    HA   GLU  99           HA       GLU  99  18.620  18.531  11.939
  778    HB2  GLU  99           HB2      GLU  99  19.104  17.238   9.874
  779    HB3  GLU  99           HB3      GLU  99  18.291  18.487   8.929
  780    HG2  GLU  99           HG2      GLU  99  19.895  20.165   9.714
  781    HG3  GLU  99           HG3      GLU  99  20.677  18.968  10.742
  782    H    LYS 100           H        LYS 100  16.095  19.680   9.717
  783    HA   LYS 100           HA       LYS 100  16.885  22.419   9.852
  784    HB2  LYS 100           HB2      LYS 100  14.256  21.121   9.101
  785    HB3  LYS 100           HB3      LYS 100  14.552  22.860   9.005
  786    HG2  LYS 100           HG2      LYS 100  16.525  22.411   7.540
  787    HG3  LYS 100           HG3      LYS 100  16.116  20.693   7.564
  788    HD2  LYS 100           HD2      LYS 100  13.920  21.195   6.561
  789    HD3  LYS 100           HD3      LYS 100  14.313  22.914   6.545
  790    HE2  LYS 100           HE2      LYS 100  16.273  22.433   5.087
  791    HE3  LYS 100           HE3      LYS 100  15.812  20.728   5.060
  792    HZ1  LYS 100           HZ1      LYS 100  13.982  22.913   4.217
  793    HZ3  LYS 100           HZ2      LYS 100  13.802  21.243   3.960
  794    HZ2  LYS 100           HZ3      LYS 100  15.011  22.105   3.136
  795    H    LEU 101           H        LEU 101  14.792  20.375  11.824
  796    HA   LEU 101           HA       LEU 101  13.621  22.446  13.394
  797    HB2  LEU 101           HB2      LEU 101  14.069  19.499  13.788
  798    HB3  LEU 101           HB3      LEU 101  13.530  20.482  15.146
  799    HG   LEU 101           HG       LEU 101  12.113  20.559  12.476
  800   HD12  LEU 101          HD11      LEU 101  10.457  18.996  13.749
  801   HD11  LEU 101          HD12      LEU 101  11.852  18.589  14.746
  802   HD13  LEU 101          HD13      LEU 101  11.886  18.276  13.010
  803   HD21  LEU 101          HD21      LEU 101  11.453  21.360  15.325
  804   HD23  LEU 101          HD22      LEU 101  10.193  21.127  14.115
  805   HD22  LEU 101          HD23      LEU 101  11.426  22.364  13.873
  806    H    LYS 102           H        LYS 102  16.769  21.843  12.961
  807    HA   LYS 102           HA       LYS 102  18.614  22.721  14.031
  808    HB2  LYS 102           HB2      LYS 102  16.796  24.236  15.159
  809    HB3  LYS 102           HB3      LYS 102  17.005  23.179  16.540
  810    HG2  LYS 102           HG2      LYS 102  18.894  25.190  15.364
  811    HG3  LYS 102           HG3      LYS 102  18.512  24.880  17.044
  812    HD2  LYS 102           HD2      LYS 102  20.184  22.965  15.365
  813    HD3  LYS 102           HD3      LYS 102  20.870  24.292  16.294
  814    HE2  LYS 102           HE2      LYS 102  20.477  21.745  17.271
  815    HE3  LYS 102           HE3      LYS 102  20.692  23.191  18.258
  816    HZ2  LYS 102           HZ1      LYS 102  18.726  21.905  18.879
  817    HZ1  LYS 102           HZ2      LYS 102  18.082  22.129  17.329
  818    HZ3  LYS 102           HZ3      LYS 102  18.309  23.462  18.351
  819    H    ALA 103           H        ALA 103  16.544  21.120  16.458
  820    HA   ALA 103           HA       ALA 103  18.273  19.918  18.117
  821    HB2  ALA 103           HB1      ALA 103  16.692  17.907  18.117
  822    HB1  ALA 103           HB2      ALA 103  15.796  18.755  16.857
  823    HB3  ALA 103           HB3      ALA 103  15.972  19.481  18.453

  No H/Q in entry =         823
  In of MODEL    1
    1    H1   ALA   1           H3       ALA   1  -1.592  -7.101 -21.423
    2    H2   ALA   1           H2       ALA   1  -2.385  -8.536 -20.966
    3    H3   ALA   1           H1       ALA   1  -0.777  -8.585 -21.520
    4    HA   ALA   1           HA       ALA   1  -1.609  -9.062 -23.515
    5    HB1  ALA   1           HB1      ALA   1  -3.745  -9.782 -23.040
    6    HB2  ALA   1           HB2      ALA   1  -4.186  -8.274 -23.843
    7    HB3  ALA   1           HB3      ALA   1  -4.126  -8.349 -22.084
    8    H    GLU   2           H        GLU   2  -2.440  -7.879 -25.509
    9    HA   GLU   2           HA       GLU   2  -1.043  -5.866 -26.392
   10    HB2  GLU   2           HB2      GLU   2  -4.050  -5.938 -26.711
   11    HB3  GLU   2           HB3      GLU   2  -2.930  -5.077 -27.762
   12    HG2  GLU   2           HG2      GLU   2  -2.424  -6.969 -28.911
   13    HG3  GLU   2           HG3      GLU   2  -2.126  -7.870 -27.431
   14    H    GLU   3           H        GLU   3  -4.206  -4.610 -25.497
   15    HA   GLU   3           HA       GLU   3  -3.163  -2.051 -24.876
   16    HB2  GLU   3           HB2      GLU   3  -5.849  -3.368 -24.542
   17    HB3  GLU   3           HB3      GLU   3  -5.554  -1.751 -23.900
   18    HG2  GLU   3           HG2      GLU   3  -5.198  -0.830 -26.029
   19    HG3  GLU   3           HG3      GLU   3  -4.800  -2.387 -26.748
   20    H    LEU   4           H        LEU   4  -4.752  -4.405 -22.690
   21    HA   LEU   4           HA       LEU   4  -4.390  -3.169 -20.303
   22    HB2  LEU   4           HB2      LEU   4  -3.843  -6.111 -20.763
   23    HB3  LEU   4           HB3      LEU   4  -4.251  -5.361 -19.222
   24    HG   LEU   4           HG       LEU   4  -6.022  -5.444 -21.686
   25   HD13  LEU   4          HD11      LEU   4  -7.213  -7.161 -20.684
   26   HD12  LEU   4          HD12      LEU   4  -6.730  -6.695 -19.054
   27   HD11  LEU   4          HD13      LEU   4  -5.592  -7.540 -20.102
   28   HD23  LEU   4          HD21      LEU   4  -7.709  -4.630 -19.822
   29   HD22  LEU   4          HD22      LEU   4  -6.671  -3.460 -20.636
   30   HD21  LEU   4          HD23      LEU   4  -6.245  -4.044 -19.028
   31    H    GLU   5           H        GLU   5  -1.889  -5.014 -22.026
   32    HA   GLU   5           HA       GLU   5   0.093  -4.722 -19.989
   33    HB2  GLU   5           HB2      GLU   5   0.173  -6.500 -21.724
   34    HB3  GLU   5           HB3      GLU   5   0.460  -5.266 -22.950
   35    HG2  GLU   5           HG2      GLU   5   2.531  -4.595 -21.826
   36    HG3  GLU   5           HG3      GLU   5   2.241  -5.771 -20.547
   37    H    GLU   6           H        GLU   6  -0.542  -3.018 -23.040
   38    HA   GLU   6           HA       GLU   6   1.625  -1.183 -22.776
   39    HB2  GLU   6           HB2      GLU   6   0.490  -1.679 -24.934
   40    HB3  GLU   6           HB3      GLU   6  -0.954  -0.866 -24.332
   41    HG2  GLU   6           HG2      GLU   6   0.282   0.730 -25.656
   42    HG3  GLU   6           HG3      GLU   6   0.459   1.192 -23.965
   43    H    VAL   7           H        VAL   7  -1.714  -1.256 -21.733
   44    HA   VAL   7           HA       VAL   7  -1.939   1.459 -20.905
   45    HB   VAL   7           HB       VAL   7  -3.399  -1.058 -20.062
   46   HG11  VAL   7          HG11      VAL   7  -3.778   1.833 -19.257
   47   HG13  VAL   7          HG12      VAL   7  -3.677   0.411 -18.217
   48   HG12  VAL   7          HG13      VAL   7  -5.109   0.676 -19.211
   49   HG21  VAL   7          HG21      VAL   7  -3.555   0.011 -22.453
   50   HG23  VAL   7          HG22      VAL   7  -4.503   1.261 -21.646
   51   HG22  VAL   7          HG23      VAL   7  -5.047  -0.417 -21.614
   52    H    VAL   8           H        VAL   8  -0.949  -1.520 -19.252
   53    HA   VAL   8           HA       VAL   8  -0.633  -0.432 -16.660
   54    HB   VAL   8           HB       VAL   8   0.762  -2.754 -18.014
   55   HG12  VAL   8          HG11      VAL   8   1.214  -3.406 -15.567
   56   HG11  VAL   8          HG12      VAL   8   0.847  -1.727 -15.170
   57   HG13  VAL   8          HG13      VAL   8   2.201  -2.106 -16.233
   58   HG23  VAL   8          HG21      VAL   8  -1.185  -3.171 -15.796
   59   HG22  VAL   8          HG22      VAL   8  -0.999  -4.053 -17.308
   60   HG21  VAL   8          HG23      VAL   8  -1.885  -2.532 -17.282
   61    H    MET   9           H        MET   9   1.617  -0.738 -19.405
   62    HA   MET   9           HA       MET   9   3.902   0.310 -18.145
   63    HB2  MET   9           HB2      MET   9   2.956   0.335 -21.010
   64    HB3  MET   9           HB3      MET   9   4.473   1.093 -20.532
   65    HG2  MET   9           HG2      MET   9   5.252  -1.039 -19.578
   66    HG3  MET   9           HG3      MET   9   3.727  -1.804 -20.029
   67    HE3  MET   9           HE1      MET   9   6.004   0.768 -22.547
   68    HE2  MET   9           HE2      MET   9   7.265  -0.453 -22.403
   69    HE1  MET   9           HE3      MET   9   6.559   0.250 -20.950
   70    H    GLY  10           H        GLY  10   1.217   1.906 -19.829
   71    HA3  GLY  10           HA2      GLY  10   2.179   4.560 -19.592
   72    HA2  GLY  10           HA3      GLY  10   0.490   4.099 -19.796
   73    H    LEU  11           H        LEU  11   0.090   2.578 -17.505
   74    HA   LEU  11           HA       LEU  11  -0.441   4.561 -15.552
   75    HB2  LEU  11           HB2      LEU  11  -0.373   1.545 -15.387
   76    HB3  LEU  11           HB3      LEU  11  -0.883   2.572 -14.047
   77    HG   LEU  11           HG       LEU  11  -2.121   2.677 -16.811
   78   HD13  LEU  11          HD11      LEU  11  -2.704   0.536 -16.050
   79   HD12  LEU  11          HD12      LEU  11  -4.055   1.529 -15.508
   80   HD11  LEU  11          HD13      LEU  11  -2.799   1.053 -14.366
   81   HD22  LEU  11          HD21      LEU  11  -2.712   4.696 -15.810
   82   HD21  LEU  11          HD22      LEU  11  -2.637   4.035 -14.178
   83   HD23  LEU  11          HD23      LEU  11  -4.012   3.665 -15.219
   84    H    ILE  12           H        ILE  12   2.102   2.094 -15.787
   85    HA   ILE  12           HA       ILE  12   3.307   2.639 -13.284
   86    HB   ILE  12           HB       ILE  12   4.561   1.591 -15.844
   87   HG12  ILE  12          HG12      ILE  12   2.550   0.362 -14.696
   88   HG13  ILE  12          HG13      ILE  12   3.950  -0.575 -15.177
   89   HG23  ILE  12          HG21      ILE  12   6.316   2.329 -14.352
   90   HG22  ILE  12          HG22      ILE  12   6.237   0.570 -14.250
   91   HG21  ILE  12          HG23      ILE  12   5.535   1.560 -12.971
   92   HD13  ILE  12          HD11      ILE  12   4.768  -0.573 -12.896
   93   HD12  ILE  12          HD12      ILE  12   3.087  -1.103 -12.886
   94   HD11  ILE  12          HD13      ILE  12   3.495   0.529 -12.402
   95    H    ILE  13           H        ILE  13   3.909   3.893 -16.545
   96    HA   ILE  13           HA       ILE  13   6.046   5.615 -15.825
   97    HB   ILE  13           HB       ILE  13   4.015   5.687 -18.071
   98   HG12  ILE  13          HG12      ILE  13   5.858   3.852 -17.786
   99   HG13  ILE  13          HG13      ILE  13   5.609   4.585 -19.366
  100   HG22  ILE  13          HG21      ILE  13   5.804   7.252 -19.137
  101   HG21  ILE  13          HG22      ILE  13   6.320   7.552 -17.481
  102   HG23  ILE  13          HG23      ILE  13   4.675   7.950 -17.974
  103   HD13  ILE  13          HD11      ILE  13   7.528   6.051 -19.057
  104   HD12  ILE  13          HD12      ILE  13   8.028   4.407 -18.674
  105   HD11  ILE  13          HD13      ILE  13   7.685   5.545 -17.376
  106    H    ASN  14           H        ASN  14   2.539   6.109 -16.094
  107    HA   ASN  14           HA       ASN  14   2.497   8.857 -15.465
  108    HB2  ASN  14           HB2      ASN  14   0.604   7.213 -16.290
  109    HB3  ASN  14           HB3      ASN  14   0.283   7.039 -14.570
  110   HD21  ASN  14          HD21      ASN  14  -1.737   8.191 -16.005
  111   HD22  ASN  14          HD22      ASN  14  -1.800   9.865 -15.742
  112    H    SER  15           H        SER  15   2.202   5.986 -13.380
  113    HA   SER  15           HA       SER  15   1.896   7.363 -10.935
  114    HB2  SER  15           HB2      SER  15   2.447   5.280  -9.880
  115    HB3  SER  15           HB3      SER  15   1.615   4.857 -11.372
  116    HG   SER  15           HG       SER  15   4.361   4.755 -10.763
  117    H    GLY  16           H        GLY  16   4.771   6.262 -12.692
  118    HA3  GLY  16           HA2      GLY  16   6.697   7.025 -10.764
  119    HA2  GLY  16           HA3      GLY  16   7.000   6.817 -12.487
  120    H    GLN  17           H        GLN  17   5.309   8.771 -13.555
  121    HA   GLN  17           HA       GLN  17   6.885  11.115 -13.254
  122    HB2  GLN  17           HB2      GLN  17   5.546  10.606 -15.289
  123    HB3  GLN  17           HB3      GLN  17   4.071  10.876 -14.361
  124    HG2  GLN  17           HG2      GLN  17   4.600  12.910 -15.576
  125    HG3  GLN  17           HG3      GLN  17   4.867  13.192 -13.857
  126   HE21  GLN  17          HE21      GLN  17   6.567  14.745 -14.009
  127   HE22  GLN  17          HE22      GLN  17   8.069  14.403 -14.722
  128    H    ALA  18           H        ALA  18   3.786  10.098 -11.901
  129    HA   ALA  18           HA       ALA  18   3.058  12.490 -10.642
  130    HB1  ALA  18           HB1      ALA  18   1.932  10.031 -10.857
  131    HB2  ALA  18           HB2      ALA  18   1.382  11.254  -9.714
  132    HB3  ALA  18           HB3      ALA  18   2.474   9.974  -9.180
  133    H    ARG  19           H        ARG  19   4.936   9.732  -9.356
  134    HA   ARG  19           HA       ARG  19   5.467  10.898  -6.837
  135    HB2  ARG  19           HB2      ARG  19   5.884   8.494  -7.357
  136    HB3  ARG  19           HB3      ARG  19   7.239   8.979  -8.380
  137    HG2  ARG  19           HG2      ARG  19   8.358  10.026  -6.461
  138    HG3  ARG  19           HG3      ARG  19   6.983   9.639  -5.428
  139    HD2  ARG  19           HD2      ARG  19   8.747   8.008  -5.065
  140    HD3  ARG  19           HD3      ARG  19   7.374   7.221  -5.849
  141    HE   ARG  19           HE       ARG  19   9.077   8.037  -7.898
  142   HH21  ARG  19          HH11      ARG  19  10.640   6.632  -8.745
  143   HH22  ARG  19          HH12      ARG  19  11.187   5.287  -7.806
  144   HH11  ARG  19          HH21      ARG  19   9.153   6.015  -5.114
  145   HH12  ARG  19          HH22      ARG  19  10.342   4.938  -5.749
  146    H    SER  20           H        SER  20   7.284  10.922  -9.886
  147    HA   SER  20           HA       SER  20   9.526  12.344  -9.067
  148    HB2  SER  20           HB2      SER  20   9.001  11.307 -11.375
  149    HB3  SER  20           HB3      SER  20   8.219  12.844 -11.730
  150    HG   SER  20           HG       SER  20  10.165  13.883 -11.339
  151    H    LEU  21           H        LEU  21   6.425  13.603 -10.267
  152    HA   LEU  21           HA       LEU  21   7.089  16.351 -10.051
  153    HB2  LEU  21           HB2      LEU  21   4.425  14.920  -9.969
  154    HB3  LEU  21           HB3      LEU  21   4.585  16.675  -9.973
  155    HG   LEU  21           HG       LEU  21   5.798  14.890 -12.103
  156   HD11  LEU  21          HD11      LEU  21   3.104  16.253 -11.944
  157   HD13  LEU  21          HD12      LEU  21   3.457  14.567 -12.326
  158   HD12  LEU  21          HD13      LEU  21   3.847  15.833 -13.488
  159   HD23  LEU  21          HD21      LEU  21   5.534  17.216 -13.340
  160   HD22  LEU  21          HD22      LEU  21   6.908  16.971 -12.267
  161   HD21  LEU  21          HD23      LEU  21   5.510  17.875 -11.707
  162    H    ALA  22           H        ALA  22   5.583  14.065  -7.796
  163    HA   ALA  22           HA       ALA  22   4.975  15.877  -5.734
  164    HB3  ALA  22           HB1      ALA  22   4.221  13.482  -5.890
  165    HB2  ALA  22           HB2      ALA  22   4.808  13.960  -4.297
  166    HB1  ALA  22           HB3      ALA  22   5.834  13.002  -5.365
  167    H    TYR  23           H        TYR  23   7.915  13.858  -6.167
  168    HA   TYR  23           HA       TYR  23   9.295  14.888  -3.918
  169    HB2  TYR  23           HB2      TYR  23  10.088  12.879  -5.069
  170    HB3  TYR  23           HB3      TYR  23  10.398  13.814  -6.532
  171    HD1  TYR  23           HD1      TYR  23  11.371  13.477  -2.944
  172    HD2  TYR  23           HD2      TYR  23  12.423  15.006  -6.819
  173    HE1  TYR  23           HE1      TYR  23  13.627  14.064  -2.100
  174    HE2  TYR  23           HE2      TYR  23  14.679  15.594  -5.973
  175    HH   TYR  23           HH       TYR  23  15.839  14.498  -2.916
  176    H    ALA  24           H        ALA  24   9.108  15.985  -7.287
  177    HA   ALA  24           HA       ALA  24  10.997  18.077  -7.047
  178    HB2  ALA  24           HB1      ALA  24  10.554  18.131  -9.256
  179    HB3  ALA  24           HB2      ALA  24   8.996  18.876  -8.899
  180    HB1  ALA  24           HB3      ALA  24   9.128  17.123  -9.024
  181    H    ALA  25           H        ALA  25   7.519  17.882  -6.425
  182    HA   ALA  25           HA       ALA  25   7.029  20.599  -5.864
  183    HB1  ALA  25           HB1      ALA  25   5.375  18.594  -6.059
  184    HB2  ALA  25           HB2      ALA  25   5.002  19.885  -4.914
  185    HB3  ALA  25           HB3      ALA  25   5.698  18.368  -4.339
  186    H    LEU  26           H        LEU  26   8.108  17.930  -3.806
  187    HA   LEU  26           HA       LEU  26   8.207  19.369  -1.374
  188    HB2  LEU  26           HB2      LEU  26   8.313  16.953  -1.361
  189    HB3  LEU  26           HB3      LEU  26   9.783  16.964  -2.332
  190    HG   LEU  26           HG       LEU  26  10.993  18.093  -0.495
  191   HD12  LEU  26          HD11      LEU  26   9.767  18.103   1.765
  192   HD11  LEU  26          HD12      LEU  26   8.280  17.955   0.831
  193   HD13  LEU  26          HD13      LEU  26   9.318  19.365   0.617
  194   HD21  LEU  26          HD21      LEU  26   9.470  15.621   0.386
  195   HD23  LEU  26          HD22      LEU  26  10.984  16.193   1.081
  196   HD22  LEU  26          HD23      LEU  26  10.940  15.628  -0.587
  197    H    LYS  27           H        LYS  27  10.626  18.800  -3.897
  198    HA   LYS  27           HA       LYS  27  12.805  20.055  -2.674
  199    HB2  LYS  27           HB2      LYS  27  12.912  18.701  -4.759
  200    HB3  LYS  27           HB3      LYS  27  12.140  20.027  -5.629
  201    HG2  LYS  27           HG2      LYS  27  13.999  21.523  -5.056
  202    HG3  LYS  27           HG3      LYS  27  14.766  20.238  -4.115
  203    HD2  LYS  27           HD2      LYS  27  14.915  18.844  -6.165
  204    HD3  LYS  27           HD3      LYS  27  14.193  20.156  -7.098
  205    HE2  LYS  27           HE2      LYS  27  16.074  21.633  -6.490
  206    HE3  LYS  27           HE3      LYS  27  16.800  20.326  -5.549
  207    HZ3  LYS  27           HZ1      LYS  27  17.788  20.423  -7.736
  208    HZ2  LYS  27           HZ2      LYS  27  16.262  20.295  -8.476
  209    HZ1  LYS  27           HZ3      LYS  27  16.892  18.991  -7.587
  210    H    GLN  28           H        GLN  28  10.175  21.417  -4.626
  211    HA   GLN  28           HA       GLN  28  11.121  24.074  -4.788
  212    HB2  GLN  28           HB2      GLN  28   8.291  22.995  -4.667
  213    HB3  GLN  28           HB3      GLN  28   8.701  24.665  -5.058
  214    HG2  GLN  28           HG2      GLN  28   9.689  22.235  -6.582
  215    HG3  GLN  28           HG3      GLN  28   8.364  23.279  -7.097
  216   HE21  GLN  28          HE21      GLN  28  11.484  22.749  -7.845
  217   HE22  GLN  28          HE22      GLN  28  11.992  24.327  -8.214
  218    H    ALA  29           H        ALA  29   9.198  22.379  -2.345
  219    HA   ALA  29           HA       ALA  29   8.638  24.574  -0.671
  220    HB2  ALA  29           HB1      ALA  29   7.917  23.006   0.903
  221    HB1  ALA  29           HB2      ALA  29   9.145  21.827   0.441
  222    HB3  ALA  29           HB3      ALA  29   7.757  22.110  -0.608
  223    H    LYS  30           H        LYS  30  11.380  22.321  -0.734
  224    HA   LYS  30           HA       LYS  30  12.694  23.290   1.566
  225    HB2  LYS  30           HB2      LYS  30  13.796  22.002  -0.941
  226    HB3  LYS  30           HB3      LYS  30  14.777  22.371   0.479
  227    HG2  LYS  30           HG2      LYS  30  13.232  20.984   1.864
  228    HG3  LYS  30           HG3      LYS  30  12.349  20.552   0.396
  229    HD2  LYS  30           HD2      LYS  30  14.398  19.574  -0.563
  230    HD3  LYS  30           HD3      LYS  30  15.301  20.019   0.887
  231    HE2  LYS  30           HE2      LYS  30  13.804  18.584   2.247
  232    HE3  LYS  30           HE3      LYS  30  12.932  18.119   0.781
  233    HZ2  LYS  30           HZ1      LYS  30  14.733  16.553   1.546
  234    HZ1  LYS  30           HZ2      LYS  30  15.863  17.745   1.090
  235    HZ3  LYS  30           HZ3      LYS  30  14.831  17.052  -0.072
  236    H    GLN  31           H        GLN  31  12.577  24.483  -1.735
  237    HA   GLN  31           HA       GLN  31  14.719  26.390  -1.320
  238    HB2  GLN  31           HB2      GLN  31  12.675  26.418  -3.544
  239    HB3  GLN  31           HB3      GLN  31  14.291  27.123  -3.548
  240    HG2  GLN  31           HG2      GLN  31  14.769  24.431  -2.964
  241    HG3  GLN  31           HG3      GLN  31  13.465  24.366  -4.142
  242   HE21  GLN  31          HE21      GLN  31  16.312  23.587  -4.544
  243   HE22  GLN  31          HE22      GLN  31  16.879  24.560  -5.814
  244    H    GLY  32           H        GLY  32  11.646  26.194  -0.173
  245    HA3  GLY  32           HA2      GLY  32  10.482  27.760   1.096
  246    HA2  GLY  32           HA3      GLY  32  11.600  29.000   0.541
  247    H    ASP  33           H        ASP  33  10.245  27.080  -1.945
  248    HA   ASP  33           HA       ASP  33   8.568  29.341  -2.807
  249    HB2  ASP  33           HB2      ASP  33   9.674  26.923  -4.242
  250    HB3  ASP  33           HB3      ASP  33   8.517  28.030  -4.975
  251    H    PHE  34           H        PHE  34   6.883  28.861  -1.241
  252    HA   PHE  34           HA       PHE  34   5.517  26.381  -1.137
  253    HB2  PHE  34           HB2      PHE  34   4.541  29.165  -0.466
  254    HB3  PHE  34           HB3      PHE  34   3.701  27.671  -0.049
  255    HD1  PHE  34           HD1      PHE  34   5.937  30.086   1.157
  256    HD2  PHE  34           HD2      PHE  34   5.281  25.841   1.117
  257    HE1  PHE  34           HE1      PHE  34   7.330  29.850   3.194
  258    HE2  PHE  34           HE2      PHE  34   6.676  25.609   3.152
  259    HZ   PHE  34           HZ       PHE  34   7.695  27.614   4.190
  260    H    ALA  35           H        ALA  35   5.070  29.236  -3.157
  261    HA   ALA  35           HA       ALA  35   2.522  28.604  -4.179
  262    HB3  ALA  35           HB1      ALA  35   3.565  29.996  -6.221
  263    HB2  ALA  35           HB2      ALA  35   4.781  30.368  -4.999
  264    HB1  ALA  35           HB3      ALA  35   3.088  30.768  -4.709
  265    H    ALA  36           H        ALA  36   5.754  27.945  -5.532
  266    HA   ALA  36           HA       ALA  36   4.772  26.503  -7.771
  267    HB3  ALA  36           HB1      ALA  36   6.930  26.638  -8.388
  268    HB2  ALA  36           HB2      ALA  36   7.418  25.616  -7.034
  269    HB1  ALA  36           HB3      ALA  36   7.302  27.364  -6.824
  270    H    ALA  37           H        ALA  37   5.735  25.524  -4.513
  271    HA   ALA  37           HA       ALA  37   5.692  22.734  -4.933
  272    HB2  ALA  37           HB1      ALA  37   5.422  24.532  -2.560
  273    HB1  ALA  37           HB2      ALA  37   6.562  23.219  -2.849
  274    HB3  ALA  37           HB3      ALA  37   4.903  22.858  -2.376
  275    H    LYS  38           H        LYS  38   3.147  24.932  -3.771
  276    HA   LYS  38           HA       LYS  38   1.058  23.107  -3.542
  277    HB2  LYS  38           HB2      LYS  38   1.394  25.866  -3.300
  278    HB3  LYS  38           HB3      LYS  38   0.195  25.708  -4.578
  279    HG2  LYS  38           HG2      LYS  38  -1.246  24.381  -3.130
  280    HG3  LYS  38           HG3      LYS  38  -0.001  24.332  -1.874
  281    HD2  LYS  38           HD2      LYS  38  -0.201  26.669  -1.434
  282    HD3  LYS  38           HD3      LYS  38  -1.115  26.948  -2.917
  283    HE2  LYS  38           HE2      LYS  38  -2.618  26.979  -0.977
  284    HE3  LYS  38           HE3      LYS  38  -2.984  25.598  -2.015
  285    HZ3  LYS  38           HZ1      LYS  38  -2.249  24.136  -0.477
  286    HZ2  LYS  38           HZ2      LYS  38  -2.607  25.394   0.608
  287    HZ1  LYS  38           HZ3      LYS  38  -1.011  25.151   0.083
  288    H    ALA  39           H        ALA  39   2.026  25.006  -6.397
  289    HA   ALA  39           HA       ALA  39  -0.046  24.121  -8.097
  290    HB2  ALA  39           HB1      ALA  39   2.687  24.782  -9.153
  291    HB1  ALA  39           HB2      ALA  39   1.713  26.040  -8.392
  292    HB3  ALA  39           HB3      ALA  39   1.105  25.195  -9.815
  293    H    MET  40           H        MET  40   3.200  22.843  -7.514
  294    HA   MET  40           HA       MET  40   3.114  20.816  -9.499
  295    HB2  MET  40           HB2      MET  40   4.725  21.058  -6.952
  296    HB3  MET  40           HB3      MET  40   4.982  19.799  -8.162
  297    HG2  MET  40           HG2      MET  40   5.022  22.753  -8.837
  298    HG3  MET  40           HG3      MET  40   6.474  21.861  -8.386
  299    HE3  MET  40           HE1      MET  40   7.358  19.642 -11.188
  300    HE2  MET  40           HE2      MET  40   6.797  19.324  -9.549
  301    HE1  MET  40           HE3      MET  40   7.884  20.677  -9.853
  302    H    MET  41           H        MET  41   2.200  20.864  -6.075
  303    HA   MET  41           HA       MET  41   1.684  18.097  -5.788
  304    HB2  MET  41           HB2      MET  41   0.338  20.451  -4.444
  305    HB3  MET  41           HB3      MET  41   0.192  18.774  -3.931
  306    HG2  MET  41           HG2      MET  41   2.901  19.013  -3.970
  307    HG3  MET  41           HG3      MET  41   2.451  20.670  -3.579
  308    HE2  MET  41           HE1      MET  41  -0.581  19.404  -1.848
  309    HE1  MET  41           HE2      MET  41   0.227  20.921  -2.231
  310    HE3  MET  41           HE3      MET  41   0.172  20.355  -0.561
  311    H    ASP  42           H        ASP  42  -0.371  20.806  -6.770
  312    HA   ASP  42           HA       ASP  42  -2.804  19.430  -6.901
  313    HB2  ASP  42           HB2      ASP  42  -2.113  22.004  -7.166
  314    HB3  ASP  42           HB3      ASP  42  -2.262  21.602  -8.873
  315    H    GLN  43           H        GLN  43  -0.368  20.028  -9.406
  316    HA   GLN  43           HA       GLN  43  -1.747  18.693 -11.491
  317    HB2  GLN  43           HB2      GLN  43   1.208  19.229 -11.112
  318    HB3  GLN  43           HB3      GLN  43   0.498  18.580 -12.592
  319    HG2  GLN  43           HG2      GLN  43  -1.027  20.597 -12.639
  320    HG3  GLN  43           HG3      GLN  43  -0.077  21.264 -11.314
  321   HE21  GLN  43          HE21      GLN  43   0.073  22.878 -13.405
  322   HE22  GLN  43          HE22      GLN  43   1.489  22.663 -14.312
  323    H    SER  44           H        SER  44   0.612  17.576  -9.097
  324    HA   SER  44           HA       SER  44   0.963  14.968 -10.114
  325    HB2  SER  44           HB2      SER  44   1.849  16.420  -7.883
  326    HB3  SER  44           HB3      SER  44   0.996  15.033  -7.207
  327    HG   SER  44           HG       SER  44   3.111  14.425  -7.633
  328    H    ARG  45           H        ARG  45  -1.365  16.279  -7.780
  329    HA   ARG  45           HA       ARG  45  -2.735  13.911  -7.137
  330    HB2  ARG  45           HB2      ARG  45  -2.948  16.081  -5.952
  331    HB3  ARG  45           HB3      ARG  45  -3.809  16.738  -7.340
  332    HG2  ARG  45           HG2      ARG  45  -5.563  15.001  -7.051
  333    HG3  ARG  45           HG3      ARG  45  -4.714  14.400  -5.626
  334    HD2  ARG  45           HD2      ARG  45  -4.935  16.668  -4.577
  335    HD3  ARG  45           HD3      ARG  45  -5.926  17.177  -5.961
  336    HE   ARG  45           HE       ARG  45  -7.020  14.797  -4.913
  337   HH21  ARG  45          HH11      ARG  45  -8.856  14.864  -3.642
  338   HH22  ARG  45          HH12      ARG  45  -9.261  16.304  -2.777
  339   HH11  ARG  45          HH21      ARG  45  -6.496  18.050  -3.900
  340   HH12  ARG  45          HH22      ARG  45  -7.919  18.108  -2.922
  341    H    MET  46           H        MET  46  -3.337  16.303  -9.695
  342    HA   MET  46           HA       MET  46  -5.668  15.111 -10.752
  343    HB2  MET  46           HB2      MET  46  -3.579  16.945 -11.938
  344    HB3  MET  46           HB3      MET  46  -4.964  16.381 -12.878
  345    HG2  MET  46           HG2      MET  46  -6.504  17.318 -11.229
  346    HG3  MET  46           HG3      MET  46  -5.158  17.809 -10.208
  347    HE2  MET  46           HE1      MET  46  -6.662  19.557 -14.124
  348    HE1  MET  46           HE2      MET  46  -7.008  17.996 -13.385
  349    HE3  MET  46           HE3      MET  46  -5.530  18.211 -14.322
  350    H    ALA  47           H        ALA  47  -2.236  14.653 -11.509
  351    HA   ALA  47           HA       ALA  47  -2.570  12.916 -13.714
  352    HB3  ALA  47           HB1      ALA  47  -0.398  13.823 -13.366
  353    HB2  ALA  47           HB2      ALA  47  -0.245  12.096 -13.026
  354    HB1  ALA  47           HB3      ALA  47  -0.346  13.252 -11.697
  355    H    LEU  48           H        LEU  48  -2.295  12.294 -10.238
  356    HA   LEU  48           HA       LEU  48  -2.369   9.453 -10.387
  357    HB2  LEU  48           HB2      LEU  48  -3.146  11.372  -8.180
  358    HB3  LEU  48           HB3      LEU  48  -3.039   9.623  -7.973
  359    HG   LEU  48           HG       LEU  48  -0.753  11.336  -8.977
  360   HD13  LEU  48          HD11      LEU  48  -1.041  12.111  -6.788
  361   HD12  LEU  48          HD12      LEU  48   0.132  10.813  -6.586
  362   HD11  LEU  48          HD13      LEU  48  -1.564  10.539  -6.187
  363   HD22  LEU  48          HD21      LEU  48  -0.239   9.152  -9.611
  364   HD21  LEU  48          HD22      LEU  48  -1.103   8.435  -8.252
  365   HD23  LEU  48          HD23      LEU  48   0.464   9.200  -7.995
  366    H    ASN  49           H        ASN  49  -4.850  11.928  -9.993
  367    HA   ASN  49           HA       ASN  49  -7.023  10.250  -9.448
  368    HB2  ASN  49           HB2      ASN  49  -7.086  12.679  -9.137
  369    HB3  ASN  49           HB3      ASN  49  -6.950  12.925 -10.874
  370   HD21  ASN  49          HD21      ASN  49  -9.005  13.929 -11.150
  371   HD22  ASN  49          HD22      ASN  49 -10.468  13.109 -10.897
  372    H    GLU  50           H        GLU  50  -5.753  11.446 -12.540
  373    HA   GLU  50           HA       GLU  50  -7.698  10.171 -14.181
  374    HB2  GLU  50           HB2      GLU  50  -6.246  11.998 -15.001
  375    HB3  GLU  50           HB3      GLU  50  -4.844  10.936 -14.860
  376    HG2  GLU  50           HG2      GLU  50  -5.807   9.388 -16.491
  377    HG3  GLU  50           HG3      GLU  50  -7.274  10.356 -16.582
  378    H    ALA  51           H        ALA  51  -4.521   9.206 -12.973
  379    HA   ALA  51           HA       ALA  51  -4.363   6.749 -14.383
  380    HB2  ALA  51           HB1      ALA  51  -2.380   6.479 -13.282
  381    HB1  ALA  51           HB2      ALA  51  -3.071   6.902 -11.716
  382    HB3  ALA  51           HB3      ALA  51  -2.625   8.172 -12.854
  383    H    HIS  52           H        HIS  52  -5.542   7.583 -11.136
  384    HA   HIS  52           HA       HIS  52  -6.209   4.971 -10.296
  385    HB2  HIS  52           HB2      HIS  52  -6.083   6.952  -8.800
  386    HB3  HIS  52           HB3      HIS  52  -7.560   7.571  -9.539
  387    HD1  HIS  52           HD1      HIS  52  -9.763   6.150  -9.162
  388    HD2  HIS  52           HD2      HIS  52  -6.481   4.907  -6.914
  389    HE1  HIS  52           HE1      HIS  52 -10.667   4.612  -7.364
  390    HE2  HIS  52           HE2      HIS  52  -8.677   3.845  -5.985
  391    H    LEU  53           H        LEU  53  -8.046   7.410 -12.092
  392    HA   LEU  53           HA       LEU  53 -10.543   6.101 -12.101
  393    HB2  LEU  53           HB2      LEU  53  -9.272   8.084 -13.976
  394    HB3  LEU  53           HB3      LEU  53 -10.866   7.407 -14.297
  395    HG   LEU  53           HG       LEU  53 -10.167   8.730 -11.657
  396   HD13  LEU  53          HD11      LEU  53  -9.864  10.408 -13.382
  397   HD12  LEU  53          HD12      LEU  53 -11.405  10.710 -12.578
  398   HD11  LEU  53          HD13      LEU  53 -11.370   9.938 -14.161
  399   HD23  LEU  53          HD21      LEU  53 -12.752   9.111 -11.804
  400   HD22  LEU  53          HD22      LEU  53 -12.162   7.514 -11.360
  401   HD21  LEU  53          HD23      LEU  53 -12.723   7.816 -12.994
  402    H    VAL  54           H        VAL  54  -7.791   5.915 -14.337
  403    HA   VAL  54           HA       VAL  54  -9.001   4.130 -16.174
  404    HB   VAL  54           HB       VAL  54  -6.097   4.658 -15.493
  405   HG12  VAL  54          HG11      VAL  54  -5.842   3.567 -17.879
  406   HG11  VAL  54          HG12      VAL  54  -7.366   2.777 -17.473
  407   HG13  VAL  54          HG13      VAL  54  -5.949   2.535 -16.453
  408   HG22  VAL  54          HG21      VAL  54  -6.880   6.593 -16.545
  409   HG21  VAL  54          HG22      VAL  54  -8.067   5.718 -17.510
  410   HG23  VAL  54          HG23      VAL  54  -6.360   5.648 -17.940
  411    H    GLN  55           H        GLN  55  -6.999   3.606 -13.273
  412    HA   GLN  55           HA       GLN  55  -6.891   0.789 -13.520
  413    HB2  GLN  55           HB2      GLN  55  -5.342   1.700 -12.004
  414    HB3  GLN  55           HB3      GLN  55  -6.564   2.661 -11.177
  415    HG2  GLN  55           HG2      GLN  55  -7.242   0.904  -9.854
  416    HG3  GLN  55           HG3      GLN  55  -7.009  -0.286 -11.128
  417   HE21  GLN  55          HE21      GLN  55  -5.377  -1.723 -10.629
  418   HE22  GLN  55          HE22      GLN  55  -3.995  -1.360  -9.718
  419    H    THR  56           H        THR  56  -9.236   2.942 -11.913
  420    HA   THR  56           HA       THR  56 -10.809   1.053 -10.618
  421    HB   THR  56           HB       THR  56 -11.919   3.429 -12.132
  422    HG1  THR  56           HG1      THR  56 -10.039   3.428 -10.321
  423   HG21  THR  56          HG21      THR  56 -13.376   1.616 -10.934
  424   HG23  THR  56          HG22      THR  56 -13.726   3.322 -10.654
  425   HG22  THR  56          HG23      THR  56 -12.816   2.398  -9.457
  426    H    LYS  57           H        LYS  57 -11.017   2.124 -14.007
  427    HA   LYS  57           HA       LYS  57 -13.162   0.421 -14.756
  428    HB2  LYS  57           HB2      LYS  57 -12.296   2.374 -16.078
  429    HB3  LYS  57           HB3      LYS  57 -10.853   1.439 -16.445
  430    HG2  LYS  57           HG2      LYS  57 -12.185  -0.235 -17.616
  431    HG3  LYS  57           HG3      LYS  57 -13.671   0.601 -17.183
  432    HD2  LYS  57           HD2      LYS  57 -12.920   2.584 -18.473
  433    HD3  LYS  57           HD3      LYS  57 -11.458   1.718 -18.937
  434    HE2  LYS  57           HE2      LYS  57 -14.296   0.836 -19.582
  435    HE3  LYS  57           HE3      LYS  57 -13.187   1.587 -20.727
  436    HZ3  LYS  57           HZ1      LYS  57 -11.858  -0.257 -20.794
  437    HZ2  LYS  57           HZ2      LYS  57 -13.385  -0.976 -20.598
  438    HZ1  LYS  57           HZ3      LYS  57 -12.340  -0.816 -19.267
  439    H    LEU  58           H        LEU  58  -9.655   0.012 -14.696
  440    HA   LEU  58           HA       LEU  58  -9.647  -2.510 -15.976
  441    HB2  LEU  58           HB2      LEU  58  -7.622  -1.199 -14.172
  442    HB3  LEU  58           HB3      LEU  58  -7.351  -2.722 -15.020
  443    HG   LEU  58           HG       LEU  58  -8.120  -0.127 -16.393
  444   HD11  LEU  58          HD11      LEU  58  -5.467  -1.345 -15.697
  445   HD13  LEU  58          HD12      LEU  58  -5.972   0.343 -15.654
  446   HD12  LEU  58          HD13      LEU  58  -5.627  -0.431 -17.197
  447   HD22  LEU  58          HD21      LEU  58  -8.686  -1.698 -17.979
  448   HD21  LEU  58          HD22      LEU  58  -7.637  -2.937 -17.292
  449   HD23  LEU  58          HD23      LEU  58  -6.954  -1.663 -18.302
  450    H    ILE  59           H        ILE  59 -10.476  -1.601 -12.729
  451    HA   ILE  59           HA       ILE  59 -10.107  -4.362 -11.771
  452    HB   ILE  59           HB       ILE  59  -9.676  -2.090 -10.379
  453   HG12  ILE  59          HG12      ILE  59 -11.039  -4.443  -9.052
  454   HG13  ILE  59          HG13      ILE  59  -9.393  -4.514  -9.628
  455   HG21  ILE  59          HG21      ILE  59 -12.215  -1.585 -10.641
  456   HG23  ILE  59          HG22      ILE  59 -11.504  -1.398  -9.054
  457   HG22  ILE  59          HG23      ILE  59 -12.445  -2.837  -9.441
  458   HD13  ILE  59          HD11      ILE  59  -9.281  -3.909  -7.320
  459   HD12  ILE  59          HD12      ILE  59 -10.504  -2.662  -7.528
  460   HD11  ILE  59          HD13      ILE  59  -8.902  -2.456  -8.239
  461    H    GLU  60           H        GLU  60 -12.680  -2.066 -12.589
  462    HA   GLU  60           HA       GLU  60 -14.855  -3.593 -11.572
  463    HB2  GLU  60           HB2      GLU  60 -15.106  -1.234 -12.164
  464    HB3  GLU  60           HB3      GLU  60 -14.741  -1.594 -13.849
  465    HG2  GLU  60           HG2      GLU  60 -16.754  -3.066 -13.937
  466    HG3  GLU  60           HG3      GLU  60 -17.141  -2.592 -12.296
  467    H    GLY  61           H        GLY  61 -13.180  -3.578 -14.686
  468    HA3  GLY  61           HA2      GLY  61 -14.878  -5.838 -15.568
  469    HA2  GLY  61           HA3      GLY  61 -14.040  -4.731 -16.650
  470    H    ASP  62           H        ASP  62 -12.659  -6.162 -13.760
  471    HA   ASP  62           HA       ASP  62 -10.219  -6.829 -14.655
  472    HB2  ASP  62           HB2      ASP  62 -10.212  -8.644 -12.977
  473    HB3  ASP  62           HB3      ASP  62 -10.963  -7.180 -12.352
  474    H    ALA  63           H        ALA  63  -9.382  -8.002 -16.312
  475    HA   ALA  63           HA       ALA  63 -10.948  -9.673 -18.013
  476    HB3  ALA  63           HB1      ALA  63  -8.906 -10.074 -19.178
  477    HB2  ALA  63           HB2      ALA  63  -7.937  -9.813 -17.729
  478    HB1  ALA  63           HB3      ALA  63  -8.729  -8.448 -18.521
  479    H    GLY  64           H        GLY  64  -8.363 -11.509 -17.837
  480    HA3  GLY  64           HA2      GLY  64  -7.700 -13.377 -16.542
  481    HA2  GLY  64           HA3      GLY  64  -9.195 -13.246 -15.626
  482    H    GLU  65           H        GLU  65  -7.622 -15.083 -17.878
  483    HA   GLU  65           HA       GLU  65  -9.685 -15.700 -19.710
  484    HB2  GLU  65           HB2      GLU  65  -7.259 -17.271 -18.845
  485    HB3  GLU  65           HB3      GLU  65  -8.335 -17.769 -20.151
  486    HG2  GLU  65           HG2      GLU  65  -7.897 -15.690 -21.355
  487    HG3  GLU  65           HG3      GLU  65  -6.891 -15.109 -20.028
  488    H    GLY  66           H        GLY  66  -8.777 -17.078 -16.645
  489    HA3  GLY  66           HA2      GLY  66 -10.738 -19.204 -16.721
  490    HA2  GLY  66           HA3      GLY  66  -9.617 -18.853 -15.421
  491    H    LYS  67           H        LYS  67 -12.099 -19.576 -14.771
  492    HA   LYS  67           HA       LYS  67 -14.219 -17.960 -14.617
  493    HB2  LYS  67           HB2      LYS  67 -14.455 -18.880 -12.179
  494    HB3  LYS  67           HB3      LYS  67 -14.485 -19.990 -13.554
  495    HG2  LYS  67           HG2      LYS  67 -12.100 -20.452 -13.281
  496    HG3  LYS  67           HG3      LYS  67 -11.995 -19.274 -11.976
  497    HD2  LYS  67           HD2      LYS  67 -13.558 -20.627 -10.626
  498    HD3  LYS  67           HD3      LYS  67 -13.656 -21.809 -11.932
  499    HE2  LYS  67           HE2      LYS  67 -11.233 -22.221 -11.762
  500    HE3  LYS  67           HE3      LYS  67 -11.114 -21.022 -10.474
  501    HZ3  LYS  67           HZ1      LYS  67 -11.747 -22.528  -9.001
  502    HZ2  LYS  67           HZ2      LYS  67 -11.702 -23.712 -10.217
  503    HZ1  LYS  67           HZ3      LYS  67 -13.150 -22.889  -9.882
  504    H    MET  68           H        MET  68 -13.015 -17.985 -11.469
  505    HA   MET  68           HA       MET  68 -13.578 -15.299 -10.911
  506    HB2  MET  68           HB2      MET  68 -11.874 -17.286  -9.407
  507    HB3  MET  68           HB3      MET  68 -12.449 -15.752  -8.756
  508    HG2  MET  68           HG2      MET  68 -14.246 -17.946  -9.828
  509    HG3  MET  68           HG3      MET  68 -13.913 -17.668  -8.118
  510    HE1  MET  68           HE1      MET  68 -14.402 -15.905  -6.816
  511    HE3  MET  68           HE2      MET  68 -15.629 -14.660  -7.042
  512    HE2  MET  68           HE3      MET  68 -14.009 -14.420  -7.695
  513    H    LYS  69           H        LYS  69 -10.434 -16.822 -11.664
  514    HA   LYS  69           HA       LYS  69  -8.627 -15.004 -10.865
  515    HB2  LYS  69           HB2      LYS  69  -8.087 -17.056 -12.096
  516    HB3  LYS  69           HB3      LYS  69  -8.612 -16.293 -13.599
  517    HG2  LYS  69           HG2      LYS  69  -6.895 -14.561 -13.353
  518    HG3  LYS  69           HG3      LYS  69  -6.403 -15.241 -11.804
  519    HD2  LYS  69           HD2      LYS  69  -5.764 -17.345 -12.933
  520    HD3  LYS  69           HD3      LYS  69  -6.236 -16.648 -14.484
  521    HE2  LYS  69           HE2      LYS  69  -4.557 -14.872 -14.217
  522    HE3  LYS  69           HE3      LYS  69  -4.101 -15.525 -12.645
  523    HZ1  LYS  69           HZ1      LYS  69  -4.031 -17.589 -14.548
  524    HZ3  LYS  69           HZ2      LYS  69  -2.749 -16.939 -13.643
  525    HZ2  LYS  69           HZ3      LYS  69  -3.150 -16.274 -15.155
  526    H    VAL  70           H        VAL  70  -7.467 -13.196 -11.678
  527    HA   VAL  70           HA       VAL  70  -8.935 -11.505 -13.621
  528    HB   VAL  70           HB       VAL  70  -8.284  -9.559 -12.213
  529   HG12  VAL  70          HG11      VAL  70  -9.788 -11.503 -10.476
  530   HG11  VAL  70          HG12      VAL  70 -10.477 -10.967 -12.010
  531   HG13  VAL  70          HG13      VAL  70 -10.108  -9.791 -10.749
  532   HG21  VAL  70          HG21      VAL  70  -7.107 -11.771 -10.543
  533   HG23  VAL  70          HG22      VAL  70  -7.727 -10.327  -9.743
  534   HG22  VAL  70          HG23      VAL  70  -6.426 -10.190 -10.925
  535    H    SER  71           H        SER  71  -7.475  -9.649 -14.346
  536    HA   SER  71           HA       SER  71  -5.187 -10.656 -15.658
  537    HB2  SER  71           HB2      SER  71  -6.494  -8.646 -16.385
  538    HB3  SER  71           HB3      SER  71  -5.823  -7.765 -15.013
  539    HG   SER  71           HG       SER  71  -4.486  -8.878 -17.247
  540    H    LEU  72           H        LEU  72  -3.175 -10.947 -14.986
  541    HA   LEU  72           HA       LEU  72  -2.458 -10.717 -12.275
  542    HB2  LEU  72           HB2      LEU  72  -0.806 -11.153 -14.758
  543    HB3  LEU  72           HB3      LEU  72  -0.136 -11.203 -13.131
  544    HG   LEU  72           HG       LEU  72  -2.480 -12.923 -14.002
  545   HD12  LEU  72          HD11      LEU  72   0.438 -13.721 -13.791
  546   HD11  LEU  72          HD12      LEU  72  -0.383 -13.384 -15.315
  547   HD13  LEU  72          HD13      LEU  72  -0.907 -14.738 -14.313
  548   HD23  LEU  72          HD21      LEU  72  -1.465 -14.307 -12.024
  549   HD22  LEU  72          HD22      LEU  72  -2.446 -12.905 -11.629
  550   HD21  LEU  72          HD23      LEU  72  -0.689 -12.794 -11.573
  551    H    VAL  73           H        VAL  73  -1.752  -8.708 -15.063
  552    HA   VAL  73           HA       VAL  73   0.159  -6.994 -13.965
  553    HB   VAL  73           HB       VAL  73  -0.236  -5.590 -15.830
  554   HG11  VAL  73          HG11      VAL  73   0.596  -7.925 -16.294
  555   HG13  VAL  73          HG12      VAL  73  -0.213  -7.164 -17.663
  556   HG12  VAL  73          HG13      VAL  73  -1.061  -8.372 -16.700
  557   HG23  VAL  73          HG21      VAL  73  -2.407  -6.177 -17.221
  558   HG22  VAL  73          HG22      VAL  73  -2.502  -5.064 -15.857
  559   HG21  VAL  73          HG23      VAL  73  -3.000  -6.745 -15.659
  560    H    LEU  74           H        LEU  74  -3.238  -7.127 -13.409
  561    HA   LEU  74           HA       LEU  74  -3.871  -4.472 -12.808
  562    HB2  LEU  74           HB2      LEU  74  -5.596  -6.138 -12.975
  563    HB3  LEU  74           HB3      LEU  74  -4.896  -7.066 -11.650
  564    HG   LEU  74           HG       LEU  74  -5.357  -5.192 -10.099
  565   HD12  LEU  74          HD11      LEU  74  -6.971  -3.422 -11.049
  566   HD11  LEU  74          HD12      LEU  74  -6.408  -3.936 -12.638
  567   HD13  LEU  74          HD13      LEU  74  -5.268  -3.257 -11.476
  568   HD21  LEU  74          HD21      LEU  74  -7.047  -7.051 -10.939
  569   HD23  LEU  74          HD22      LEU  74  -7.894  -5.642 -11.542
  570   HD22  LEU  74          HD23      LEU  74  -7.561  -5.780  -9.833
  571    H    VAL  75           H        VAL  75  -2.818  -7.044 -10.635
  572    HA   VAL  75           HA       VAL  75  -2.630  -5.482  -8.298
  573    HB   VAL  75           HB       VAL  75  -1.117  -7.971  -9.076
  574   HG11  VAL  75          HG11      VAL  75  -1.343  -6.499  -6.412
  575   HG13  VAL  75          HG12      VAL  75   0.122  -6.737  -7.352
  576   HG12  VAL  75          HG13      VAL  75  -0.670  -8.114  -6.608
  577   HG21  VAL  75          HG21      VAL  75  -3.546  -7.432  -7.328
  578   HG23  VAL  75          HG22      VAL  75  -2.774  -9.006  -7.523
  579   HG22  VAL  75          HG23      VAL  75  -3.563  -8.233  -8.900
  580    H    GLU  76           H        GLU  76  -0.215  -6.239 -10.829
  581    HA   GLU  76           HA       GLU  76   1.963  -4.876  -9.675
  582    HB2  GLU  76           HB2      GLU  76   2.185  -6.355 -11.648
  583    HB3  GLU  76           HB3      GLU  76   1.254  -5.219 -12.613
  584    HG2  GLU  76           HG2      GLU  76   3.589  -4.861 -13.114
  585    HG3  GLU  76           HG3      GLU  76   3.047  -3.482 -12.175
  586    H    ALA  77           H        ALA  77  -0.574  -3.697 -11.871
  587    HA   ALA  77           HA       ALA  77   0.402  -1.046 -12.057
  588    HB1  ALA  77           HB1      ALA  77  -1.451  -2.289 -13.431
  589    HB2  ALA  77           HB2      ALA  77  -1.592  -0.551 -13.161
  590    HB3  ALA  77           HB3      ALA  77  -2.533  -1.674 -12.180
  591    H    GLN  78           H        GLN  78  -1.860  -2.605  -9.841
  592    HA   GLN  78           HA       GLN  78  -2.681  -0.286  -8.450
  593    HB2  GLN  78           HB2      GLN  78  -3.751  -2.584  -8.371
  594    HB3  GLN  78           HB3      GLN  78  -2.433  -3.080  -7.311
  595    HG2  GLN  78           HG2      GLN  78  -3.045  -1.357  -5.695
  596    HG3  GLN  78           HG3      GLN  78  -4.318  -0.772  -6.766
  597   HE21  GLN  78          HE21      GLN  78  -5.252  -3.406  -7.634
  598   HE22  GLN  78          HE22      GLN  78  -6.004  -4.130  -6.295
  599    H    LEU  79           H        LEU  79   0.010  -2.524  -7.988
  600    HA   LEU  79           HA       LEU  79   0.979  -1.611  -5.534
  601    HB2  LEU  79           HB2      LEU  79   1.862  -3.619  -6.593
  602    HB3  LEU  79           HB3      LEU  79   2.503  -2.668  -7.930
  603    HG   LEU  79           HG       LEU  79   4.051  -1.513  -6.429
  604   HD13  LEU  79          HD11      LEU  79   3.043  -1.266  -4.364
  605   HD12  LEU  79          HD12      LEU  79   4.129  -2.607  -4.014
  606   HD11  LEU  79          HD13      LEU  79   2.426  -2.919  -4.344
  607   HD23  LEU  79          HD21      LEU  79   5.274  -3.650  -5.516
  608   HD22  LEU  79          HD22      LEU  79   5.071  -3.459  -7.255
  609   HD21  LEU  79          HD23      LEU  79   3.999  -4.532  -6.359
  610    H    HIS  80           H        HIS  80   1.845  -0.502  -8.811
  611    HA   HIS  80           HA       HIS  80   3.638   1.501  -7.895
  612    HB2  HIS  80           HB2      HIS  80   2.356   0.788 -10.476
  613    HB3  HIS  80           HB3      HIS  80   2.940   2.444 -10.311
  614    HD1  HIS  80           HD1      HIS  80   5.340   2.759 -10.832
  615    HD2  HIS  80           HD2      HIS  80   4.546  -1.152  -9.626
  616    HE1  HIS  80           HE1      HIS  80   7.538   1.496 -10.991
  617    HE2  HIS  80           HE2      HIS  80   7.066  -0.891 -10.259
  618    H    LEU  81           H        LEU  81   0.234   1.634  -8.879
  619    HA   LEU  81           HA       LEU  81  -0.061   4.426  -8.560
  620    HB2  LEU  81           HB2      LEU  81  -2.060   2.166  -8.473
  621    HB3  LEU  81           HB3      LEU  81  -2.524   3.866  -8.389
  622    HG   LEU  81           HG       LEU  81  -0.820   2.720 -10.618
  623   HD12  LEU  81          HD11      LEU  81  -3.053   3.018 -11.921
  624   HD11  LEU  81          HD12      LEU  81  -3.810   2.950 -10.330
  625   HD13  LEU  81          HD13      LEU  81  -2.857   1.587 -10.911
  626   HD23  LEU  81          HD21      LEU  81  -1.932   4.851 -11.725
  627   HD22  LEU  81          HD22      LEU  81  -0.518   5.037 -10.691
  628   HD21  LEU  81          HD23      LEU  81  -2.126   5.376 -10.054
  629    H    MET  82           H        MET  82  -0.703   1.743  -6.301
  630    HA   MET  82           HA       MET  82  -1.769   3.329  -4.221
  631    HB2  MET  82           HB2      MET  82  -0.375   0.653  -4.248
  632    HB3  MET  82           HB3      MET  82  -0.961   1.379  -2.754
  633    HG2  MET  82           HG2      MET  82  -2.687   0.863  -5.195
  634    HG3  MET  82           HG3      MET  82  -2.602  -0.205  -3.795
  635    HE3  MET  82           HE1      MET  82  -4.341   1.443  -0.989
  636    HE2  MET  82           HE2      MET  82  -2.612   1.733  -1.173
  637    HE1  MET  82           HE3      MET  82  -3.288   0.169  -1.621
  638    H    THR  83           H        THR  83   1.541   2.267  -4.903
  639    HA   THR  83           HA       THR  83   2.747   3.389  -2.605
  640    HB   THR  83           HB       THR  83   4.844   3.344  -4.076
  641    HG1  THR  83           HG1      THR  83   4.611   2.808  -6.098
  642   HG22  THR  83          HG21      THR  83   4.421   0.682  -4.398
  643   HG21  THR  83          HG22      THR  83   3.127   1.055  -3.261
  644   HG23  THR  83          HG23      THR  83   4.803   1.414  -2.841
  645    H    SER  84           H        SER  84   2.370   4.653  -5.911
  646    HA   SER  84           HA       SER  84   3.690   7.105  -5.464
  647    HB2  SER  84           HB2      SER  84   1.629   6.249  -7.482
  648    HB3  SER  84           HB3      SER  84   2.294   7.881  -7.462
  649    HG   SER  84           HG       SER  84   3.686   5.416  -7.742
  650    H    MET  85           H        MET  85   0.202   6.322  -5.293
  651    HA   MET  85           HA       MET  85  -0.681   8.928  -4.703
  652    HB2  MET  85           HB2      MET  85  -2.187   7.103  -5.366
  653    HB3  MET  85           HB3      MET  85  -1.896   6.308  -3.820
  654    HG2  MET  85           HG2      MET  85  -2.781   8.305  -2.642
  655    HG3  MET  85           HG3      MET  85  -3.104   9.064  -4.200
  656    HE2  MET  85           HE1      MET  85  -4.468   6.585  -6.067
  657    HE1  MET  85           HE2      MET  85  -4.435   8.339  -5.907
  658    HE3  MET  85           HE3      MET  85  -5.961   7.476  -5.748
  659    H    LEU  86           H        LEU  86   0.257   6.281  -2.548
  660    HA   LEU  86           HA       LEU  86  -0.289   7.589  -0.111
  661    HB2  LEU  86           HB2      LEU  86   0.193   5.120  -0.495
  662    HB3  LEU  86           HB3      LEU  86   1.898   5.562  -0.590
  663    HG   LEU  86           HG       LEU  86   1.562   6.729   1.673
  664   HD11  LEU  86          HD11      LEU  86  -1.126   5.942   1.202
  665   HD13  LEU  86          HD12      LEU  86  -0.467   6.699   2.650
  666   HD12  LEU  86          HD13      LEU  86  -0.545   4.942   2.538
  667   HD23  LEU  86          HD21      LEU  86   1.154   3.734   1.806
  668   HD22  LEU  86          HD22      LEU  86   2.148   4.754   2.843
  669   HD21  LEU  86          HD23      LEU  86   2.653   4.427   1.186
  670    H    ALA  87           H        ALA  87   2.696   7.308  -1.996
  671    HA   ALA  87           HA       ALA  87   4.390   8.736  -0.275
  672    HB3  ALA  87           HB1      ALA  87   4.495   7.714  -2.978
  673    HB2  ALA  87           HB2      ALA  87   5.826   8.057  -1.877
  674    HB1  ALA  87           HB3      ALA  87   5.205   9.330  -2.927
  675    H    ARG  88           H        ARG  88   2.439   9.850  -3.001
  676    HA   ARG  88           HA       ARG  88   3.196  12.544  -2.893
  677    HB2  ARG  88           HB2      ARG  88   1.951  11.377  -4.748
  678    HB3  ARG  88           HB3      ARG  88   0.492  11.515  -3.767
  679    HG2  ARG  88           HG2      ARG  88   1.496  14.102  -3.692
  680    HG3  ARG  88           HG3      ARG  88   1.925  13.585  -5.320
  681    HD2  ARG  88           HD2      ARG  88  -0.216  13.650  -6.020
  682    HD3  ARG  88           HD3      ARG  88  -0.800  12.798  -4.589
  683    HE   ARG  88           HE       ARG  88  -1.005  15.573  -5.017
  684   HH21  ARG  88          HH11      ARG  88  -1.541  16.906  -3.284
  685   HH22  ARG  88          HH12      ARG  88  -1.243  16.376  -1.665
  686   HH11  ARG  88          HH21      ARG  88   0.022  13.325  -2.634
  687   HH12  ARG  88          HH22      ARG  88  -0.376  14.343  -1.297
  688    H    GLU  89           H        GLU  89   0.501  10.860  -1.250
  689    HA   GLU  89           HA       GLU  89  -0.620  13.170  -0.054
  690    HB2  GLU  89           HB2      GLU  89  -1.726  10.925  -0.134
  691    HB3  GLU  89           HB3      GLU  89  -0.600  10.380   1.110
  692    HG2  GLU  89           HG2      GLU  89  -1.431  12.079   2.663
  693    HG3  GLU  89           HG3      GLU  89  -2.485  12.740   1.416
  694    H    LEU  90           H        LEU  90   1.842  10.895   1.130
  695    HA   LEU  90           HA       LEU  90   2.190  12.150   3.656
  696    HB2  LEU  90           HB2      LEU  90   3.973  10.379   1.986
  697    HB3  LEU  90           HB3      LEU  90   4.388  10.903   3.623
  698    HG   LEU  90           HG       LEU  90   1.761   9.542   2.964
  699   HD12  LEU  90          HD11      LEU  90   2.910   7.506   3.981
  700   HD11  LEU  90          HD12      LEU  90   4.428   8.368   3.737
  701   HD13  LEU  90          HD13      LEU  90   3.419   7.951   2.351
  702   HD22  LEU  90          HD21      LEU  90   1.490  10.472   5.083
  703   HD21  LEU  90          HD22      LEU  90   3.208  10.374   5.467
  704   HD23  LEU  90          HD23      LEU  90   2.209   8.922   5.519
  705    H    ILE  91           H        ILE  91   3.794  12.530   0.529
  706    HA   ILE  91           HA       ILE  91   5.761  14.373   1.363
  707    HB   ILE  91           HB       ILE  91   4.454  13.867  -1.316
  708   HG12  ILE  91          HG12      ILE  91   7.288  13.396  -0.338
  709   HG13  ILE  91          HG13      ILE  91   6.011  12.193  -0.173
  710   HG22  ILE  91          HG21      ILE  91   6.671  15.222  -2.007
  711   HG21  ILE  91          HG22      ILE  91   6.356  16.026  -0.469
  712   HG23  ILE  91          HG23      ILE  91   5.134  16.045  -1.739
  713   HD13  ILE  91          HD11      ILE  91   5.841  11.861  -2.479
  714   HD12  ILE  91          HD12      ILE  91   7.574  12.113  -2.265
  715   HD11  ILE  91          HD13      ILE  91   6.559  13.429  -2.856
  716    H    THR  92           H        THR  92   2.398  14.787   0.352
  717    HA   THR  92           HA       THR  92   2.360  17.610   0.282
  718    HB   THR  92           HB       THR  92   0.200  15.609   0.986
  719    HG1  THR  92           HG1      THR  92   0.507  15.424  -1.098
  720   HG22  THR  92          HG21      THR  92  -1.209  17.762   0.256
  721   HG21  THR  92          HG22      THR  92   0.179  18.596   0.951
  722   HG23  THR  92          HG23      THR  92  -0.758  17.473   1.936
  723    H    GLU  93           H        GLU  93   1.819  15.316   2.943
  724    HA   GLU  93           HA       GLU  93   1.278  17.225   4.955
  725    HB2  GLU  93           HB2      GLU  93   2.602  14.506   5.200
  726    HB3  GLU  93           HB3      GLU  93   1.906  15.435   6.530
  727    HG2  GLU  93           HG2      GLU  93   0.299  14.642   4.093
  728    HG3  GLU  93           HG3      GLU  93   0.404  13.625   5.524
  729    H    LEU  94           H        LEU  94   4.292  15.751   3.812
  730    HA   LEU  94           HA       LEU  94   6.036  16.912   5.697
  731    HB2  LEU  94           HB2      LEU  94   6.444  15.937   2.870
  732    HB3  LEU  94           HB3      LEU  94   7.770  16.603   3.818
  733    HG   LEU  94           HG       LEU  94   6.038  14.404   4.959
  734   HD11  LEU  94          HD11      LEU  94   8.136  14.180   2.830
  735   HD13  LEU  94          HD12      LEU  94   6.694  13.201   3.094
  736   HD12  LEU  94          HD13      LEU  94   8.120  12.957   4.103
  737   HD23  LEU  94          HD21      LEU  94   8.229  13.880   6.115
  738   HD22  LEU  94          HD22      LEU  94   7.556  15.457   6.526
  739   HD21  LEU  94          HD23      LEU  94   8.895  15.338   5.385
  740    H    ILE  95           H        ILE  95   4.894  18.069   2.543
  741    HA   ILE  95           HA       ILE  95   6.457  20.432   2.477
  742    HB   ILE  95           HB       ILE  95   3.817  19.733   1.172
  743   HG12  ILE  95          HG12      ILE  95   6.605  20.078   0.036
  744   HG13  ILE  95          HG13      ILE  95   5.961  18.524   0.555
  745   HG21  ILE  95          HG21      ILE  95   5.556  22.207   0.945
  746   HG23  ILE  95          HG22      ILE  95   3.831  22.133   1.300
  747   HG22  ILE  95          HG23      ILE  95   4.417  21.730  -0.315
  748   HD13  ILE  95          HD11      ILE  95   4.403  18.436  -1.175
  749   HD12  ILE  95          HD12      ILE  95   5.749  19.257  -1.965
  750   HD11  ILE  95          HD13      ILE  95   4.373  20.188  -1.376
  751    H    GLU  96           H        GLU  96   3.210  19.772   3.772
  752    HA   GLU  96           HA       GLU  96   2.578  22.418   4.514
  753    HB2  GLU  96           HB2      GLU  96   0.911  20.629   4.530
  754    HB3  GLU  96           HB3      GLU  96   1.775  19.809   5.829
  755    HG2  GLU  96           HG2      GLU  96   0.748  21.094   7.393
  756    HG3  GLU  96           HG3      GLU  96   1.278  22.567   6.592
  757    H    LEU  97           H        LEU  97   4.430  19.880   6.149
  758    HA   LEU  97           HA       LEU  97   4.780  21.238   8.615
  759    HB2  LEU  97           HB2      LEU  97   6.327  19.070   7.209
  760    HB3  LEU  97           HB3      LEU  97   6.913  19.763   8.720
  761    HG   LEU  97           HG       LEU  97   4.107  18.657   8.410
  762   HD12  LEU  97          HD11      LEU  97   5.054  16.653   9.630
  763   HD11  LEU  97          HD12      LEU  97   6.663  17.288   9.286
  764   HD13  LEU  97          HD13      LEU  97   5.596  16.822   7.960
  765   HD23  LEU  97          HD21      LEU  97   4.559  18.373  10.976
  766   HD22  LEU  97          HD22      LEU  97   4.174  19.982  10.366
  767   HD21  LEU  97          HD23      LEU  97   5.847  19.549  10.713
  768    H    HIS  98           H        HIS  98   6.653  21.251   5.591
  769    HA   HIS  98           HA       HIS  98   8.801  22.841   6.487
  770    HB2  HIS  98           HB2      HIS  98   7.510  22.572   3.761
  771    HB3  HIS  98           HB3      HIS  98   8.947  23.557   4.049
  772    HD1  HIS  98           HD1      HIS  98   7.748  19.982   4.080
  773    HD2  HIS  98           HD2      HIS  98  11.321  22.092   4.500
  774    HE1  HIS  98           HE1      HIS  98   9.608  18.259   4.030
  775    HE2  HIS  98           HE2      HIS  98  11.789  19.523   4.286
  776    H    GLU  99           H        GLU  99   5.578  23.661   5.306
  777    HA   GLU  99           HA       GLU  99   5.947  26.477   5.239
  778    HB2  GLU  99           HB2      GLU  99   4.073  25.298   4.111
  779    HB3  GLU  99           HB3      GLU  99   3.377  24.940   5.691
  780    HG2  GLU  99           HG2      GLU  99   3.189  27.333   6.184
  781    HG3  GLU  99           HG3      GLU  99   3.965  27.730   4.654
  782    H    LYS 100           H        LYS 100   4.822  24.246   7.767
  783    HA   LYS 100           HA       LYS 100   4.228  26.305   9.654
  784    HB2  LYS 100           HB2      LYS 100   4.812  23.357  10.010
  785    HB3  LYS 100           HB3      LYS 100   4.360  24.432  11.338
  786    HG2  LYS 100           HG2      LYS 100   2.293  25.059  10.087
  787    HG3  LYS 100           HG3      LYS 100   2.725  23.888   8.838
  788    HD2  LYS 100           HD2      LYS 100   2.651  22.072  10.506
  789    HD3  LYS 100           HD3      LYS 100   2.237  23.238  11.765
  790    HE2  LYS 100           HE2      LYS 100   0.183  23.849  10.498
  791    HE3  LYS 100           HE3      LYS 100   0.588  22.626   9.287
  792    HZ1  LYS 100           HZ1      LYS 100   0.321  21.968  12.170
  793    HZ3  LYS 100           HZ2      LYS 100   0.310  20.909  10.838
  794    HZ2  LYS 100           HZ3      LYS 100  -1.009  21.946  11.114
  795    H    LEU 101           H        LEU 101   7.157  24.515   8.828
  796    HA   LEU 101           HA       LEU 101   8.751  25.367  11.031
  797    HB2  LEU 101           HB2      LEU 101   9.351  24.373   8.256
  798    HB3  LEU 101           HB3      LEU 101  10.650  25.045   9.237
  799    HG   LEU 101           HG       LEU 101   8.824  22.887  10.306
  800   HD12  LEU 101          HD11      LEU 101  10.882  21.396   9.704
  801   HD11  LEU 101          HD12      LEU 101  11.247  22.656   8.528
  802   HD13  LEU 101          HD13      LEU 101   9.720  21.779   8.435
  803   HD21  LEU 101          HD21      LEU 101  11.544  24.005  11.032
  804   HD23  LEU 101          HD22      LEU 101  11.005  22.433  11.617
  805   HD22  LEU 101          HD23      LEU 101  10.108  23.888  12.049
  806    H    LYS 102           H        LYS 102   7.165  27.219   8.883
  807    HA   LYS 102           HA       LYS 102   7.236  29.512   8.584
  808    HB2  LYS 102           HB2      LYS 102   8.799  29.407  10.683
  809    HB3  LYS 102           HB3      LYS 102  10.099  29.601   9.524
  810    HG2  LYS 102           HG2      LYS 102   7.988  31.552  10.378
  811    HG3  LYS 102           HG3      LYS 102   9.700  31.815  10.127
  812    HD2  LYS 102           HD2      LYS 102   7.752  31.380   7.827
  813    HD3  LYS 102           HD3      LYS 102   8.130  32.962   8.491
  814    HE2  LYS 102           HE2      LYS 102   9.508  31.775   6.422
  815    HE3  LYS 102           HE3      LYS 102  10.120  33.086   7.430
  816    HZ2  LYS 102           HZ1      LYS 102  11.646  31.185   7.262
  817    HZ1  LYS 102           HZ2      LYS 102  10.486  30.202   8.007
  818    HZ3  LYS 102           HZ3      LYS 102  11.174  31.493   8.862
  819    H    ALA 103           H        ALA 103  10.497  28.179   8.026
  820    HA   ALA 103           HA       ALA 103  11.459  29.551   5.946
  821    HB2  ALA 103           HB1      ALA 103  12.351  27.337   5.026
  822    HB1  ALA 103           HB2      ALA 103  11.457  26.564   6.334
  823    HB3  ALA 103           HB3      ALA 103  12.743  27.713   6.705

  No H/Q in entry =         823
  In of MODEL    1
    1    H1   LYS   3           H1       LYS   3 -31.241   6.437 -19.586
    2    H2   LYS   3           H3       LYS   3 -30.248   6.180 -20.940
    3    H3   LYS   3           H2       LYS   3 -31.640   5.234 -20.715
    4    HA   LYS   3           HA       LYS   3 -30.637   3.819 -19.340
    5    HB2  LYS   3           HB2      LYS   3 -28.356   5.266 -20.637
    6    HB3  LYS   3           HB3      LYS   3 -28.031   4.033 -19.418
    7    HG2  LYS   3           HG2      LYS   3 -29.445   2.472 -20.806
    8    HG3  LYS   3           HG3      LYS   3 -29.400   3.699 -22.070
    9    HD2  LYS   3           HD2      LYS   3 -26.917   3.591 -22.016
   10    HD3  LYS   3           HD3      LYS   3 -27.035   2.268 -20.858
   11    HE2  LYS   3           HE2      LYS   3 -28.526   1.124 -22.602
   12    HE3  LYS   3           HE3      LYS   3 -27.907   2.328 -23.732
   13    HZ3  LYS   3           HZ1      LYS   3 -26.105   1.111 -24.022
   14    HZ2  LYS   3           HZ2      LYS   3 -26.734  -0.081 -22.990
   15    HZ1  LYS   3           HZ3      LYS   3 -25.749   1.153 -22.362
   16    H    LYS   4           H        LYS   4 -30.694   3.633 -17.282
   17    HA   LYS   4           HA       LYS   4 -29.973   5.886 -15.582
   18    HB2  LYS   4           HB2      LYS   4 -31.169   3.176 -14.942
   19    HB3  LYS   4           HB3      LYS   4 -30.954   4.490 -13.788
   20    HG2  LYS   4           HG2      LYS   4 -32.756   4.477 -16.214
   21    HG3  LYS   4           HG3      LYS   4 -33.251   4.490 -14.522
   22    HD2  LYS   4           HD2      LYS   4 -32.559   6.708 -14.207
   23    HD3  LYS   4           HD3      LYS   4 -31.516   6.681 -15.629
   24    HE2  LYS   4           HE2      LYS   4 -33.444   8.061 -16.066
   25    HE3  LYS   4           HE3      LYS   4 -33.520   6.609 -17.065
   26    HZ3  LYS   4           HZ1      LYS   4 -35.097   5.662 -15.541
   27    HZ2  LYS   4           HZ2      LYS   4 -35.653   7.168 -16.096
   28    HZ1  LYS   4           HZ3      LYS   4 -35.000   7.026 -14.534
   29    H    HIS   5           H        HIS   5 -28.508   5.940 -13.985
   30    HA   HIS   5           HA       HIS   5 -26.223   4.120 -14.351
   31    HB2  HIS   5           HB2      HIS   5 -26.482   6.849 -13.087
   32    HB3  HIS   5           HB3      HIS   5 -25.001   5.895 -13.086
   33    HD1  HIS   5           HD1      HIS   5 -23.527   7.129 -14.647
   34    HD2  HIS   5           HD2      HIS   5 -27.325   6.539 -16.222
   35    HE1  HIS   5           HE1      HIS   5 -23.355   7.761 -17.085
   36    HE2  HIS   5           HE2      HIS   5 -25.670   7.389 -18.014
   37    H    ILE   6           H        ILE   6 -25.996   2.519 -13.067
   38    HA   ILE   6           HA       ILE   6 -26.977   2.729 -10.301
   39    HB   ILE   6           HB       ILE   6 -26.148   0.295 -11.888
   40   HG12  ILE   6          HG12      ILE   6 -28.894   1.213 -11.023
   41   HG13  ILE   6          HG13      ILE   6 -28.248   1.410 -12.652
   42   HG23  ILE   6          HG21      ILE   6 -26.525  -0.997 -10.055
   43   HG22  ILE   6          HG22      ILE   6 -27.684   0.135  -9.355
   44   HG21  ILE   6          HG23      ILE   6 -25.955   0.469  -9.254
   45   HD13  ILE   6          HD11      ILE   6 -28.705  -0.699 -13.198
   46   HD12  ILE   6          HD12      ILE   6 -29.724  -0.712 -11.758
   47   HD11  ILE   6          HD13      ILE   6 -28.071  -1.322 -11.675
   48    H    TYR   7           H        TYR   7 -25.221   3.342  -8.996
   49    HA   TYR   7           HA       TYR   7 -22.508   2.399  -9.690
   50    HB2  TYR   7           HB2      TYR   7 -23.475   4.802  -8.160
   51    HB3  TYR   7           HB3      TYR   7 -21.790   4.287  -8.205
   52    HD1  TYR   7           HD1      TYR   7 -22.823   3.411 -11.317
   53    HD2  TYR   7           HD2      TYR   7 -22.157   6.935  -9.014
   54    HE1  TYR   7           HE1      TYR   7 -22.387   4.684 -13.381
   55    HE2  TYR   7           HE2      TYR   7 -21.763   8.213 -11.069
   56    HH   TYR   7           HH       TYR   7 -21.976   8.174 -13.303
   57    H    LEU   8           H        LEU   8 -21.546   1.018  -8.387
   58    HA   LEU   8           HA       LEU   8 -22.683   0.468  -5.718
   59    HB2  LEU   8           HB2      LEU   8 -20.976  -1.157  -7.583
   60    HB3  LEU   8           HB3      LEU   8 -21.166  -1.575  -5.881
   61    HG   LEU   8           HG       LEU   8 -23.646  -1.737  -6.312
   62   HD13  LEU   8          HD11      LEU   8 -23.770  -0.477  -8.396
   63   HD12  LEU   8          HD12      LEU   8 -24.301  -2.135  -8.672
   64   HD11  LEU   8          HD13      LEU   8 -22.692  -1.627  -9.182
   65   HD23  LEU   8          HD21      LEU   8 -22.368  -3.743  -8.045
   66   HD22  LEU   8          HD22      LEU   8 -23.458  -3.939  -6.673
   67   HD21  LEU   8          HD23      LEU   8 -21.752  -3.592  -6.400
   68    H    PHE   9           H        PHE   9 -21.426   0.847  -3.923
   69    HA   PHE   9           HA       PHE   9 -18.633   1.777  -4.399
   70    HB2  PHE   9           HB2      PHE   9 -20.652   2.826  -2.419
   71    HB3  PHE   9           HB3      PHE   9 -18.947   3.253  -2.415
   72    HD1  PHE   9           HD1      PHE   9 -17.987   4.640  -4.161
   73    HD2  PHE   9           HD2      PHE   9 -22.149   3.598  -4.215
   74    HE1  PHE   9           HE1      PHE   9 -18.393   6.348  -5.907
   75    HE2  PHE   9           HE2      PHE   9 -22.557   5.320  -5.956
   76    HZ   PHE   9           HZ       PHE   9 -20.675   6.690  -6.807
   77    H    SER  10           H        SER  10 -17.055   0.819  -3.279
   78    HA   SER  10           HA       SER  10 -17.288  -0.115  -0.605
   79    HB2  SER  10           HB2      SER  10 -18.499  -1.972  -1.675
   80    HB3  SER  10           HB3      SER  10 -17.149  -2.215  -2.770
   81    HG   SER  10           HG       SER  10 -15.874  -2.782  -1.046
   82    H    SER  11           H        SER  11 -15.272  -0.020   0.250
   83    HA   SER  11           HA       SER  11 -13.084   0.855  -1.265
   84    HB2  SER  11           HB2      SER  11 -13.605   0.846   1.338
   85    HB3  SER  11           HB3      SER  11 -12.571  -0.583   1.281
   86    HG   SER  11           HG       SER  11 -11.254   1.003  -0.146
   87    H    ALA  12           H        ALA  12 -14.294  -1.837  -2.099
   88    HA   ALA  12           HA       ALA  12 -11.712  -3.071  -2.651
   89    HB1  ALA  12           HB1      ALA  12 -13.949  -4.590  -1.294
   90    HB3  ALA  12           HB2      ALA  12 -12.348  -4.256  -0.635
   91    HB2  ALA  12           HB3      ALA  12 -12.521  -5.337  -2.016
   92    H    GLY  13           H        GLY  13 -12.499  -2.006  -4.666
   93    HA3  GLY  13           HA2      GLY  13 -14.727  -2.691  -6.153
   94    HA2  GLY  13           HA3      GLY  13 -13.174  -2.233  -6.866
   95    H    MET  14           H        MET  14 -11.698  -4.550  -5.895
   96    HA   MET  14           HA       MET  14 -12.036  -6.269  -8.045
   97    HB2  MET  14           HB2      MET  14 -10.013  -6.375  -6.679
   98    HB3  MET  14           HB3      MET  14 -10.920  -7.060  -5.331
   99    HG2  MET  14           HG2      MET  14 -11.480  -9.029  -6.738
  100    HG3  MET  14           HG3      MET  14 -10.545  -8.336  -8.065
  101    HE2  MET  14           HE1      MET  14  -7.867  -7.122  -6.769
  102    HE1  MET  14           HE2      MET  14  -8.305  -7.981  -8.243
  103    HE3  MET  14           HE3      MET  14  -6.988  -8.584  -7.241
  104    H    SER  15           H        SER  15 -13.317  -6.854  -4.763
  105    HA   SER  15           HA       SER  15 -14.676  -9.258  -5.573
  106    HB2  SER  15           HB2      SER  15 -14.277  -9.162  -3.239
  107    HB3  SER  15           HB3      SER  15 -14.935  -7.533  -3.114
  108    HG   SER  15           HG       SER  15 -16.223  -9.985  -3.166
  109    H    THR  16           H        THR  16 -15.726  -5.873  -5.159
  110    HA   THR  16           HA       THR  16 -18.512  -6.333  -5.743
  111    HB   THR  16           HB       THR  16 -16.915  -3.785  -6.180
  112    HG1  THR  16           HG1      THR  16 -17.052  -5.073  -3.978
  113   HG22  THR  16          HG21      THR  16 -19.773  -4.067  -5.280
  114   HG21  THR  16          HG22      THR  16 -19.357  -4.083  -7.002
  115   HG23  THR  16          HG23      THR  16 -18.982  -2.672  -6.001
  116    H    SER  17           H        SER  17 -15.637  -5.753  -7.561
  117    HA   SER  17           HA       SER  17 -16.757  -4.960 -10.051
  118    HB2  SER  17           HB2      SER  17 -14.137  -6.340  -9.418
  119    HB3  SER  17           HB3      SER  17 -14.577  -5.757 -11.022
  120    HG   SER  17           HG       SER  17 -14.876  -3.926  -8.990
  121    H    LEU  18           H        LEU  18 -16.191  -8.134  -8.666
  122    HA   LEU  18           HA       LEU  18 -16.770  -9.585 -11.054
  123    HB2  LEU  18           HB2      LEU  18 -15.556 -10.598  -9.184
  124    HB3  LEU  18           HB3      LEU  18 -16.970 -10.402  -8.150
  125    HG   LEU  18           HG       LEU  18 -18.235 -11.951  -9.535
  126   HD11  LEU  18          HD11      LEU  18 -15.782 -11.769 -11.250
  127   HD13  LEU  18          HD12      LEU  18 -17.480 -11.705 -11.722
  128   HD12  LEU  18          HD13      LEU  18 -16.751 -13.242 -11.262
  129   HD23  LEU  18          HD21      LEU  18 -15.561 -13.144  -8.885
  130   HD22  LEU  18          HD22      LEU  18 -17.131 -13.949  -8.919
  131   HD21  LEU  18          HD23      LEU  18 -16.786 -12.741  -7.681
  132    H    LEU  19           H        LEU  19 -18.747  -8.435  -8.325
  133    HA   LEU  19           HA       LEU  19 -21.208  -9.602  -9.191
  134    HB2  LEU  19           HB2      LEU  19 -20.944  -8.814  -6.920
  135    HB3  LEU  19           HB3      LEU  19 -20.663  -7.171  -7.493
  136    HG   LEU  19           HG       LEU  19 -22.982  -6.974  -8.172
  137   HD12  LEU  19          HD11      LEU  19 -24.593  -8.766  -7.591
  138   HD11  LEU  19          HD12      LEU  19 -23.241  -9.808  -7.154
  139   HD13  LEU  19          HD13      LEU  19 -23.437  -9.272  -8.822
  140   HD22  LEU  19          HD21      LEU  19 -22.406  -6.343  -5.923
  141   HD21  LEU  19          HD22      LEU  19 -22.603  -8.006  -5.368
  142   HD23  LEU  19          HD23      LEU  19 -24.003  -7.091  -5.930
  143    H    VAL  20           H        VAL  20 -19.712  -6.427  -9.815
  144    HA   VAL  20           HA       VAL  20 -21.819  -5.354 -11.368
  145    HB   VAL  20           HB       VAL  20 -18.830  -4.758 -11.465
  146   HG11  VAL  20          HG11      VAL  20 -21.120  -3.592 -13.022
  147   HG13  VAL  20          HG12      VAL  20 -19.500  -4.016 -13.578
  148   HG12  VAL  20          HG13      VAL  20 -19.744  -2.579 -12.584
  149   HG21  VAL  20          HG21      VAL  20 -21.180  -3.529 -10.084
  150   HG23  VAL  20          HG22      VAL  20 -19.741  -2.578 -10.445
  151   HG22  VAL  20          HG23      VAL  20 -19.618  -4.008  -9.420
  152    H    SER  21           H        SER  21 -19.056  -7.381 -12.429
  153    HA   SER  21           HA       SER  21 -19.831  -7.212 -15.180
  154    HB2  SER  21           HB2      SER  21 -18.393  -9.170 -15.550
  155    HB3  SER  21           HB3      SER  21 -17.567  -7.945 -14.587
  156    HG   SER  21           HG       SER  21 -17.980  -9.147 -12.760
  157    H    LYS  22           H        LYS  22 -20.904  -9.452 -12.658
  158    HA   LYS  22           HA       LYS  22 -22.436 -11.034 -14.517
  159    HB2  LYS  22           HB2      LYS  22 -21.681 -11.804 -12.230
  160    HB3  LYS  22           HB3      LYS  22 -22.933 -10.761 -11.558
  161    HG2  LYS  22           HG2      LYS  22 -23.902 -12.880 -11.575
  162    HG3  LYS  22           HG3      LYS  22 -24.571 -12.090 -13.003
  163    HD2  LYS  22           HD2      LYS  22 -22.998 -13.263 -14.430
  164    HD3  LYS  22           HD3      LYS  22 -22.226 -13.993 -13.022
  165    HE2  LYS  22           HE2      LYS  22 -24.325 -15.173 -12.494
  166    HE3  LYS  22           HE3      LYS  22 -25.081 -14.456 -13.917
  167    HZ2  LYS  22           HZ1      LYS  22 -24.340 -16.739 -14.278
  168    HZ1  LYS  22           HZ2      LYS  22 -22.736 -16.270 -13.976
  169    HZ3  LYS  22           HZ3      LYS  22 -23.565 -15.645 -15.319
  170    H    MET  23           H        MET  23 -23.165  -8.152 -12.591
  171    HA   MET  23           HA       MET  23 -25.971  -8.218 -13.108
  172    HB2  MET  23           HB2      MET  23 -24.125  -5.923 -12.481
  173    HB3  MET  23           HB3      MET  23 -25.870  -5.750 -12.661
  174    HG2  MET  23           HG2      MET  23 -26.269  -7.093 -10.721
  175    HG3  MET  23           HG3      MET  23 -24.559  -7.509 -10.598
  176    HE2  MET  23           HE1      MET  23 -26.859  -3.882  -9.340
  177    HE1  MET  23           HE2      MET  23 -27.108  -4.819 -10.812
  178    HE3  MET  23           HE3      MET  23 -26.073  -3.391 -10.842
  179    H    ARG  24           H        ARG  24 -23.210  -6.755 -14.853
  180    HA   ARG  24           HA       ARG  24 -24.700  -5.411 -16.828
  181    HB2  ARG  24           HB2      ARG  24 -21.884  -6.546 -16.876
  182    HB3  ARG  24           HB3      ARG  24 -22.552  -5.617 -18.195
  183    HG2  ARG  24           HG2      ARG  24 -22.744  -3.613 -16.781
  184    HG3  ARG  24           HG3      ARG  24 -22.214  -4.557 -15.364
  185    HD2  ARG  24           HD2      ARG  24 -20.270  -3.386 -16.243
  186    HD3  ARG  24           HD3      ARG  24 -20.113  -5.098 -16.615
  187    HE   ARG  24           HE       ARG  24 -21.209  -4.155 -18.865
  188   HH21  ARG  24          HH11      ARG  24 -19.747  -4.718 -20.476
  189   HH22  ARG  24          HH12      ARG  24 -18.107  -4.179 -20.372
  190   HH11  ARG  24          HH21      ARG  24 -18.577  -3.034 -17.056
  191   HH12  ARG  24          HH22      ARG  24 -17.428  -3.174 -18.349
  192    H    ALA  25           H        ALA  25 -23.584  -8.756 -16.620
  193    HA   ALA  25           HA       ALA  25 -24.205  -9.529 -19.277
  194    HB1  ALA  25           HB1      ALA  25 -23.515 -11.577 -18.623
  195    HB3  ALA  25           HB2      ALA  25 -24.578 -11.584 -17.216
  196    HB2  ALA  25           HB3      ALA  25 -23.020 -10.762 -17.139
  197    H    GLN  26           H        GLN  26 -26.042  -9.629 -16.262
  198    HA   GLN  26           HA       GLN  26 -28.385 -10.804 -17.312
  199    HB2  GLN  26           HB2      GLN  26 -27.877  -9.110 -14.885
  200    HB3  GLN  26           HB3      GLN  26 -29.440  -9.823 -15.257
  201    HG2  GLN  26           HG2      GLN  26 -26.859 -11.295 -14.811
  202    HG3  GLN  26           HG3      GLN  26 -28.223 -11.214 -13.704
  203   HE21  GLN  26          HE21      GLN  26 -27.006 -13.352 -15.023
  204   HE22  GLN  26          HE22      GLN  26 -28.048 -14.380 -15.846
  205    H    ALA  27           H        ALA  27 -27.444  -7.419 -16.843
  206    HA   ALA  27           HA       ALA  27 -29.928  -6.303 -17.611
  207    HB1  ALA  27           HB1      ALA  27 -28.120  -5.017 -16.461
  208    HB3  ALA  27           HB2      ALA  27 -28.703  -4.217 -17.921
  209    HB2  ALA  27           HB3      ALA  27 -27.170  -5.087 -17.946
  210    H    GLU  28           H        GLU  28 -27.223  -7.491 -19.498
  211    HA   GLU  28           HA       GLU  28 -28.146  -6.392 -21.996
  212    HB2  GLU  28           HB2      GLU  28 -25.772  -7.095 -21.379
  213    HB3  GLU  28           HB3      GLU  28 -26.320  -8.753 -21.620
  214    HG2  GLU  28           HG2      GLU  28 -25.165  -7.935 -23.566
  215    HG3  GLU  28           HG3      GLU  28 -26.862  -8.247 -23.928
  216    H    LYS  29           H        LYS  29 -28.327  -9.534 -20.411
  217    HA   LYS  29           HA       LYS  29 -29.626 -10.956 -22.452
  218    HB2  LYS  29           HB2      LYS  29 -28.587 -11.987 -20.467
  219    HB3  LYS  29           HB3      LYS  29 -29.859 -11.300 -19.461
  220    HG2  LYS  29           HG2      LYS  29 -31.520 -12.643 -20.566
  221    HG3  LYS  29           HG3      LYS  29 -30.318 -13.256 -21.699
  222    HD2  LYS  29           HD2      LYS  29 -29.185 -14.464 -19.989
  223    HD3  LYS  29           HD3      LYS  29 -30.095 -13.649 -18.718
  224    HE2  LYS  29           HE2      LYS  29 -30.852 -15.988 -19.136
  225    HE3  LYS  29           HE3      LYS  29 -32.125 -14.786 -19.358
  226    HZ1  LYS  29           HZ1      LYS  29 -31.553 -14.867 -21.786
  227    HZ3  LYS  29           HZ2      LYS  29 -32.278 -16.267 -21.154
  228    HZ2  LYS  29           HZ3      LYS  29 -30.607 -16.236 -21.445
  229    H    TYR  30           H        TYR  30 -31.022  -8.904 -19.906
  230    HA   TYR  30           HA       TYR  30 -33.681  -9.319 -21.167
  231    HB2  TYR  30           HB2      TYR  30 -33.036  -8.228 -18.418
  232    HB3  TYR  30           HB3      TYR  30 -34.651  -8.468 -19.083
  233    HD1  TYR  30           HD1      TYR  30 -35.566 -10.751 -19.352
  234    HD2  TYR  30           HD2      TYR  30 -31.736 -10.078 -17.618
  235    HE1  TYR  30           HE1      TYR  30 -35.485 -13.098 -18.608
  236    HE2  TYR  30           HE2      TYR  30 -31.656 -12.409 -16.878
  237    HH   TYR  30           HH       TYR  30 -33.296 -14.741 -18.031
  238    H    GLU  31           H        GLU  31 -31.507  -7.314 -21.914
  239    HA   GLU  31           HA       GLU  31 -31.426  -5.139 -22.687
  240    HB2  GLU  31           HB2      GLU  31 -34.321  -5.836 -23.226
  241    HB3  GLU  31           HB3      GLU  31 -33.475  -4.455 -23.921
  242    HG2  GLU  31           HG2      GLU  31 -32.001  -5.868 -25.140
  243    HG3  GLU  31           HG3      GLU  31 -32.572  -7.300 -24.286
  244    H    VAL  32           H        VAL  32 -31.635  -5.100 -19.954
  245    HA   VAL  32           HA       VAL  32 -33.496  -2.999 -19.254
  246    HB   VAL  32           HB       VAL  32 -31.111  -4.032 -17.687
  247   HG12  VAL  32          HG11      VAL  32 -32.653  -3.250 -15.779
  248   HG11  VAL  32          HG12      VAL  32 -33.480  -2.316 -17.024
  249   HG13  VAL  32          HG13      VAL  32 -31.774  -2.022 -16.691
  250   HG21  VAL  32          HG21      VAL  32 -32.880  -5.734 -18.421
  251   HG23  VAL  32          HG22      VAL  32 -33.923  -4.932 -17.246
  252   HG22  VAL  32          HG23      VAL  32 -32.409  -5.669 -16.723

  No H/Q in entry =         252
  In of MODEL    1
    1    HA   PRO  33           HA       PRO  33 -30.454  -0.037 -20.849
    2    HB2  PRO  33           HB2      PRO  33 -31.964   2.184 -20.679
    3    HB3  PRO  33           HB3      PRO  33 -32.430   0.908 -21.804
    4    HG2  PRO  33           HG2      PRO  33 -33.408   1.360 -18.984
    5    HG3  PRO  33           HG3      PRO  33 -34.367   1.187 -20.454
    6    HD2  PRO  33           HD2      PRO  33 -33.920  -0.924 -18.835
    7    HD3  PRO  33           HD3      PRO  33 -33.976  -1.125 -20.586
    8    H    VAL  34           H        VAL  34 -29.199  -0.627 -18.908
    9    HA   VAL  34           HA       VAL  34 -28.919   1.759 -17.204
   10    HB   VAL  34           HB       VAL  34 -28.345   0.252 -15.298
   11   HG12  VAL  34          HG11      VAL  34 -30.759  -0.625 -15.020
   12   HG11  VAL  34          HG12      VAL  34 -31.070   0.170 -16.561
   13   HG13  VAL  34          HG13      VAL  34 -30.521   1.115 -15.176
   14   HG21  VAL  34          HG21      VAL  34 -28.525  -1.727 -17.353
   15   HG23  VAL  34          HG22      VAL  34 -29.587  -2.118 -16.000
   16   HG22  VAL  34          HG23      VAL  34 -27.870  -1.839 -15.719
   17    H    ILE  35           H        ILE  35 -26.946   2.173 -16.347
   18    HA   ILE  35           HA       ILE  35 -24.636   0.873 -17.632
   19    HB   ILE  35           HB       ILE  35 -25.038   3.743 -16.756
   20   HG12  ILE  35          HG12      ILE  35 -24.048   2.495 -19.327
   21   HG13  ILE  35          HG13      ILE  35 -25.679   3.110 -19.058
   22   HG21  ILE  35          HG21      ILE  35 -22.476   2.217 -17.091
   23   HG23  ILE  35          HG22      ILE  35 -22.934   3.368 -15.836
   24   HG22  ILE  35          HG23      ILE  35 -22.546   3.939 -17.459
   25   HD11  ILE  35          HD11      ILE  35 -24.279   5.290 -18.402
   26   HD13  ILE  35          HD12      ILE  35 -24.810   4.945 -20.048
   27   HD12  ILE  35          HD13      ILE  35 -23.160   4.563 -19.555
   28    H    ILE  36           H        ILE  36 -23.412  -0.188 -16.053
   29    HA   ILE  36           HA       ILE  36 -23.862   0.360 -13.171
   30    HB   ILE  36           HB       ILE  36 -23.031  -2.316 -14.338
   31   HG12  ILE  36          HG12      ILE  36 -25.842  -1.527 -13.565
   32   HG13  ILE  36          HG13      ILE  36 -25.264  -1.469 -15.230
   33   HG23  ILE  36          HG21      ILE  36 -23.389  -3.194 -12.245
   34   HG22  ILE  36          HG22      ILE  36 -24.518  -1.920 -11.781
   35   HG21  ILE  36          HG23      ILE  36 -22.788  -1.587 -11.837
   36   HD13  ILE  36          HD11      ILE  36 -25.428  -3.677 -15.489
   37   HD12  ILE  36          HD12      ILE  36 -26.499  -3.588 -14.091
   38   HD11  ILE  36          HD13      ILE  36 -24.801  -4.013 -13.875
   39    H    GLU  37           H        GLU  37 -22.085   0.964 -12.045
   40    HA   GLU  37           HA       GLU  37 -19.391   0.189 -12.971
   41    HB2  GLU  37           HB2      GLU  37 -20.286   2.962 -12.201
   42    HB3  GLU  37           HB3      GLU  37 -18.600   2.469 -12.354
   43    HG2  GLU  37           HG2      GLU  37 -18.886   2.096 -14.715
   44    HG3  GLU  37           HG3      GLU  37 -20.604   2.474 -14.592
   45    H    ALA  38           H        ALA  38 -17.910  -0.087 -11.289
   46    HA   ALA  38           HA       ALA  38 -18.951   0.027  -8.518
   47    HB1  ALA  38           HB1      ALA  38 -17.231  -1.878  -9.983
   48    HB3  ALA  38           HB2      ALA  38 -18.285  -2.146  -8.595
   49    HB2  ALA  38           HB3      ALA  38 -16.675  -1.469  -8.360
   50    H    PHE  39           H        PHE  39 -17.717   1.203  -7.012
   51    HA   PHE  39           HA       PHE  39 -15.189   2.427  -7.872
   52    HB2  PHE  39           HB2      PHE  39 -17.608   3.889  -6.829
   53    HB3  PHE  39           HB3      PHE  39 -15.981   4.557  -6.721
   54    HD1  PHE  39           HD1      PHE  39 -14.656   4.619  -8.972
   55    HD2  PHE  39           HD2      PHE  39 -18.902   4.391  -8.650
   56    HE1  PHE  39           HE1      PHE  39 -14.867   5.545 -11.262
   57    HE2  PHE  39           HE2      PHE  39 -19.129   5.308 -10.931
   58    HZ   PHE  39           HZ       PHE  39 -17.117   5.859 -12.257

  No H/Q in entry =          58
  In of MODEL    1
    1    HA   PRO  40           HA       PRO  40 -14.265   1.575  -3.601
    2    HB2  PRO  40           HB2      PRO  40 -12.504   3.580  -2.943
    3    HB3  PRO  40           HB3      PRO  40 -12.053   2.274  -4.038
    4    HG2  PRO  40           HG2      PRO  40 -13.080   5.024  -4.727
    5    HG3  PRO  40           HG3      PRO  40 -11.651   4.197  -5.347
    6    HD2  PRO  40           HD2      PRO  40 -13.868   4.140  -6.764
    7    HD3  PRO  40           HD3      PRO  40 -12.911   2.668  -6.604
    8    H    GLU  41           H        GLU  41 -14.895   2.503  -1.451
    9    HA   GLU  41           HA       GLU  41 -17.144   4.199  -1.403
   10    HB2  GLU  41           HB2      GLU  41 -16.811   4.217   1.047
   11    HB3  GLU  41           HB3      GLU  41 -16.751   2.592   0.362
   12    HG2  GLU  41           HG2      GLU  41 -15.025   2.544   1.888
   13    HG3  GLU  41           HG3      GLU  41 -14.187   2.932   0.385
   14    H    THR  42           H        THR  42 -13.815   5.126  -1.422
   15    HA   THR  42           HA       THR  42 -14.179   7.657  -0.153
   16    HB   THR  42           HB       THR  42 -12.021   8.262  -1.228
   17    HG1  THR  42           HG1      THR  42 -11.361   5.916  -2.255
   18   HG23  THR  42          HG21      THR  42 -10.676   6.662  -0.058
   19   HG22  THR  42          HG22      THR  42 -11.932   5.429  -0.179
   20   HG21  THR  42          HG23      THR  42 -12.171   6.831   0.862
   21    H    LEU  43           H        LEU  43 -15.069   6.632  -3.280
   22    HA   LEU  43           HA       LEU  43 -15.327   9.426  -4.187
   23    HB2  LEU  43           HB2      LEU  43 -15.686   6.813  -5.645
   24    HB3  LEU  43           HB3      LEU  43 -15.885   8.411  -6.364
   25    HG   LEU  43           HG       LEU  43 -13.287   7.262  -5.369
   26   HD12  LEU  43          HD11      LEU  43 -13.939   7.865  -8.223
   27   HD11  LEU  43          HD12      LEU  43 -14.462   6.337  -7.516
   28   HD13  LEU  43          HD13      LEU  43 -12.748   6.747  -7.556
   29   HD21  LEU  43          HD21      LEU  43 -14.074   9.873  -6.647
   30   HD23  LEU  43          HD22      LEU  43 -12.427   9.251  -6.741
   31   HD22  LEU  43          HD23      LEU  43 -13.146   9.605  -5.172
   32    H    ALA  44           H        ALA  44 -17.274   7.553  -2.384
   33    HA   ALA  44           HA       ALA  44 -19.747   7.436  -3.717
   34    HB3  ALA  44           HB1      ALA  44 -19.612   6.272  -1.646
   35    HB2  ALA  44           HB2      ALA  44 -20.724   7.607  -1.347
   36    HB1  ALA  44           HB3      ALA  44 -19.056   7.708  -0.787
   37    H    GLY  45           H        GLY  45 -18.340  10.205  -2.116
   38    HA3  GLY  45           HA2      GLY  45 -20.781  11.706  -2.450
   39    HA2  GLY  45           HA3      GLY  45 -19.240  12.321  -1.854
   40    H    GLU  46           H        GLU  46 -17.698  11.442  -4.160
   41    HA   GLU  46           HA       GLU  46 -18.336  13.695  -5.880
   42    HB2  GLU  46           HB2      GLU  46 -16.133  11.627  -5.925
   43    HB3  GLU  46           HB3      GLU  46 -16.268  12.949  -7.085
   44    HG2  GLU  46           HG2      GLU  46 -15.974  14.573  -5.319
   45    HG3  GLU  46           HG3      GLU  46 -15.940  13.288  -4.111
   46    H    LYS  47           H        LYS  47 -18.204  10.188  -6.396
   47    HA   LYS  47           HA       LYS  47 -19.294  10.465  -9.069
   48    HB2  LYS  47           HB2      LYS  47 -18.128   8.330  -7.433
   49    HB3  LYS  47           HB3      LYS  47 -19.493   7.805  -8.418
   50    HG2  LYS  47           HG2      LYS  47 -17.420   7.433  -9.589
   51    HG3  LYS  47           HG3      LYS  47 -18.368   8.673 -10.408
   52    HD2  LYS  47           HD2      LYS  47 -17.032  10.418  -9.402
   53    HD3  LYS  47           HD3      LYS  47 -16.138   9.227  -8.459
   54    HE2  LYS  47           HE2      LYS  47 -14.782   9.828 -10.319
   55    HE3  LYS  47           HE3      LYS  47 -15.396   8.204 -10.618
   56    HZ2  LYS  47           HZ1      LYS  47 -15.527  10.163 -12.386
   57    HZ1  LYS  47           HZ2      LYS  47 -17.021  10.387 -11.612
   58    HZ3  LYS  47           HZ3      LYS  47 -16.650   8.891 -12.324
   59    H    GLY  48           H        GLY  48 -20.626   9.633  -5.943
   60    HA3  GLY  48           HA2      GLY  48 -23.005   8.458  -6.719
   61    HA2  GLY  48           HA3      GLY  48 -22.787   9.419  -5.257
   62    H    GLN  49           H        GLN  49 -22.206  11.879  -6.770
   63    HA   GLN  49           HA       GLN  49 -24.769  12.987  -6.897
   64    HB2  GLN  49           HB2      GLN  49 -22.222  13.888  -8.229
   65    HB3  GLN  49           HB3      GLN  49 -23.688  14.847  -8.129
   66    HG2  GLN  49           HG2      GLN  49 -23.536  14.816  -5.691
   67    HG3  GLN  49           HG3      GLN  49 -22.084  13.835  -5.791
   68   HE21  GLN  49          HE21      GLN  49 -21.978  16.035  -4.467
   69   HE22  GLN  49          HE22      GLN  49 -21.056  17.308  -5.083
   70    H    ASN  50           H        ASN  50 -23.076  11.166  -9.321
   71    HA   ASN  50           HA       ASN  50 -24.955  12.080 -11.390
   72    HB2  ASN  50           HB2      ASN  50 -22.369  10.553 -11.650
   73    HB3  ASN  50           HB3      ASN  50 -23.416  11.007 -12.986
   74   HD21  ASN  50          HD21      ASN  50 -20.788  11.822 -11.348
   75   HD22  ASN  50          HD22      ASN  50 -20.558  13.465 -11.652
   76    H    ALA  51           H        ALA  51 -24.941   9.674  -9.198
   77    HA   ALA  51           HA       ALA  51 -25.714   7.569 -11.075
   78    HB2  ALA  51           HB1      ALA  51 -25.133   6.183  -9.418
   79    HB3  ALA  51           HB2      ALA  51 -26.261   6.964  -8.311
   80    HB1  ALA  51           HB3      ALA  51 -24.623   7.593  -8.489
   81    H    ASP  52           H        ASP  52 -27.717   6.506 -10.966
   82    HA   ASP  52           HA       ASP  52 -29.905   8.319 -10.266
   83    HB2  ASP  52           HB2      ASP  52 -29.704   5.853 -11.992
   84    HB3  ASP  52           HB3      ASP  52 -31.251   6.573 -11.546
   85    H    VAL  53           H        VAL  53 -28.303   5.412  -9.310
   86    HA   VAL  53           HA       VAL  53 -29.751   5.479  -6.797
   87    HB   VAL  53           HB       VAL  53 -31.143   3.863  -8.083
   88   HG11  VAL  53          HG11      VAL  53 -29.389   3.041  -9.618
   89   HG13  VAL  53          HG12      VAL  53 -30.223   1.726  -8.791
   90   HG12  VAL  53          HG13      VAL  53 -28.616   2.218  -8.265
   91   HG23  VAL  53          HG21      VAL  53 -30.324   1.849  -6.433
   92   HG22  VAL  53          HG22      VAL  53 -31.455   3.143  -6.041
   93   HG21  VAL  53          HG23      VAL  53 -29.750   3.308  -5.624
   94    H    VAL  54           H        VAL  54 -28.443   5.010  -5.149
   95    HA   VAL  54           HA       VAL  54 -25.679   4.178  -5.770
   96    HB   VAL  54           HB       VAL  54 -26.759   5.903  -3.483
   97   HG11  VAL  54          HG11      VAL  54 -24.178   4.494  -3.798
   98   HG13  VAL  54          HG12      VAL  54 -24.937   5.140  -2.344
   99   HG12  VAL  54          HG13      VAL  54 -24.028   6.209  -3.412
  100   HG22  VAL  54          HG21      VAL  54 -25.899   7.743  -4.539
  101   HG21  VAL  54          HG22      VAL  54 -26.440   6.784  -5.915
  102   HG23  VAL  54          HG23      VAL  54 -24.735   6.800  -5.471
  103    H    LEU  55           H        LEU  55 -25.087   2.243  -5.169
  104    HA   LEU  55           HA       LEU  55 -26.601   0.882  -3.028
  105    HB2  LEU  55           HB2      LEU  55 -25.035  -0.232  -5.345
  106    HB3  LEU  55           HB3      LEU  55 -25.799  -1.196  -4.080
  107    HG   LEU  55           HG       LEU  55 -27.231   0.438  -6.166
  108   HD13  LEU  55          HD11      LEU  55 -26.925  -1.387  -7.426
  109   HD12  LEU  55          HD12      LEU  55 -27.886  -2.290  -6.255
  110   HD11  LEU  55          HD13      LEU  55 -26.131  -2.226  -6.097
  111   HD23  LEU  55          HD21      LEU  55 -28.529  -1.551  -4.359
  112   HD22  LEU  55          HD22      LEU  55 -29.223  -0.151  -5.178
  113   HD21  LEU  55          HD23      LEU  55 -28.208   0.073  -3.754
  114    H    LEU  56           H        LEU  56 -25.455   0.247  -1.234
  115    HA   LEU  56           HA       LEU  56 -22.521   0.646  -1.265
  116    HB2  LEU  56           HB2      LEU  56 -24.331   0.379   1.122
  117    HB3  LEU  56           HB3      LEU  56 -22.622   0.810   1.127
  118    HG   LEU  56           HG       LEU  56 -24.919   2.509   0.193
  119   HD11  LEU  56          HD11      LEU  56 -23.811   2.070   2.708
  120   HD13  LEU  56          HD12      LEU  56 -24.801   3.450   2.231
  121   HD12  LEU  56          HD13      LEU  56 -23.044   3.557   2.152
  122   HD23  LEU  56          HD21      LEU  56 -22.975   4.212   0.045
  123   HD22  LEU  56          HD22      LEU  56 -23.352   3.146  -1.308
  124   HD21  LEU  56          HD23      LEU  56 -22.002   2.769  -0.239
  125    H    GLY  57           H        GLY  57 -21.141  -0.995  -0.762
  126    HA3  GLY  57           HA2      GLY  57 -22.064  -3.677  -1.024
  127    HA2  GLY  57           HA3      GLY  57 -20.441  -3.193  -0.534

  No H/Q in entry =         127
  In of MODEL    1
    1    HA   PRO  58           HA       PRO  58 -23.261  -4.316   3.147
    2    HB2  PRO  58           HB2      PRO  58 -22.577  -6.933   3.697
    3    HB3  PRO  58           HB3      PRO  58 -23.959  -6.504   2.689
    4    HG2  PRO  58           HG2      PRO  58 -21.228  -7.365   1.892
    5    HG3  PRO  58           HG3      PRO  58 -22.790  -7.810   1.205
    6    HD2  PRO  58           HD2      PRO  58 -21.178  -5.965   0.029
    7    HD3  PRO  58           HD3      PRO  58 -22.936  -5.877  -0.077
    8    H    GLN  59           H        GLN  59 -19.888  -4.774   2.541
    9    HA   GLN  59           HA       GLN  59 -19.142  -4.854   5.303
   10    HB2  GLN  59           HB2      GLN  59 -17.543  -3.939   2.906
   11    HB3  GLN  59           HB3      GLN  59 -16.896  -4.203   4.513
   12    HG2  GLN  59           HG2      GLN  59 -18.152  -6.313   2.765
   13    HG3  GLN  59           HG3      GLN  59 -16.426  -6.060   2.976
   14   HE21  GLN  59          HE21      GLN  59 -18.657  -7.860   3.801
   15   HE22  GLN  59          HE22      GLN  59 -18.429  -8.619   5.264
   16    H    ILE  60           H        ILE  60 -20.069  -2.254   3.150
   17    HA   ILE  60           HA       ILE  60 -19.224  -0.343   5.242
   18    HB   ILE  60           HB       ILE  60 -19.454   1.427   3.453
   19   HG12  ILE  60          HG12      ILE  60 -19.234  -0.745   1.416
   20   HG13  ILE  60          HG13      ILE  60 -20.829  -0.246   1.978
   21   HG21  ILE  60          HG21      ILE  60 -17.326   0.225   4.181
   22   HG23  ILE  60          HG22      ILE  60 -17.297   1.164   2.690
   23   HG22  ILE  60          HG23      ILE  60 -17.428  -0.593   2.623
   24   HD12  ILE  60          HD11      ILE  60 -18.812   1.294   0.387
   25   HD11  ILE  60          HD12      ILE  60 -19.956   2.164   1.408
   26   HD13  ILE  60          HD13      ILE  60 -20.546   1.114   0.121
   27    H    ALA  61           H        ALA  61 -21.679  -1.930   5.267
   28    HA   ALA  61           HA       ALA  61 -23.904  -0.255   4.839
   29    HB1  ALA  61           HB1      ALA  61 -25.123  -1.775   6.127
   30    HB2  ALA  61           HB2      ALA  61 -23.729  -2.186   7.125
   31    HB3  ALA  61           HB3      ALA  61 -23.819  -2.756   5.458
   32    H    TYR  62           H        TYR  62 -21.706  -0.430   7.641
   33    HA   TYR  62           HA       TYR  62 -23.266   1.189   9.343
   34    HB2  TYR  62           HB2      TYR  62 -21.259   1.549  10.617
   35    HB3  TYR  62           HB3      TYR  62 -21.258  -0.119  10.049
   36    HD1  TYR  62           HD1      TYR  62 -19.628  -0.870   8.364
   37    HD2  TYR  62           HD2      TYR  62 -19.586   3.152   9.805
   38    HE1  TYR  62           HE1      TYR  62 -17.410  -0.531   7.342
   39    HE2  TYR  62           HE2      TYR  62 -17.354   3.486   8.785
   40    HH   TYR  62           HH       TYR  62 -15.953   1.055   6.702
   41    H    MET  63           H        MET  63 -21.615   2.111   6.512
   42    HA   MET  63           HA       MET  63 -21.449   4.927   7.270
   43    HB2  MET  63           HB2      MET  63 -20.836   3.463   4.703
   44    HB3  MET  63           HB3      MET  63 -20.640   5.203   4.925
   45    HG2  MET  63           HG2      MET  63 -18.919   4.835   6.568
   46    HG3  MET  63           HG3      MET  63 -19.159   3.093   6.469
   47    HE3  MET  63           HE1      MET  63 -18.585   5.735   3.081
   48    HE2  MET  63           HE2      MET  63 -17.048   5.965   3.915
   49    HE1  MET  63           HE3      MET  63 -18.567   6.221   4.778
   50    H    LEU  64           H        LEU  64 -24.011   3.096   6.256
   51    HA   LEU  64           HA       LEU  64 -25.214   4.561   4.207
   52    HB2  LEU  64           HB2      LEU  64 -26.086   2.436   5.074
   53    HB3  LEU  64           HB3      LEU  64 -26.547   3.246   6.572
   54    HG   LEU  64           HG       LEU  64 -28.238   4.529   5.367
   55   HD13  LEU  64          HD11      LEU  64 -27.947   4.819   3.141
   56   HD12  LEU  64          HD12      LEU  64 -28.595   3.189   2.958
   57   HD11  LEU  64          HD13      LEU  64 -26.851   3.445   3.026
   58   HD23  LEU  64          HD21      LEU  64 -28.756   1.734   4.554
   59   HD22  LEU  64          HD22      LEU  64 -29.746   2.848   5.498
   60   HD21  LEU  64          HD23      LEU  64 -28.374   2.036   6.249

  No H/Q in entry =          60
  In of MODEL    1
    1    HA   PRO  65           HA       PRO  65 -27.399   7.656   7.022
    2    HB2  PRO  65           HB2      PRO  65 -25.405   7.760   9.285
    3    HB3  PRO  65           HB3      PRO  65 -27.143   8.043   9.333
    4    HG2  PRO  65           HG2      PRO  65 -26.219   5.767  10.211
    5    HG3  PRO  65           HG3      PRO  65 -27.636   5.759   9.161
    6    HD2  PRO  65           HD2      PRO  65 -24.762   5.156   8.452
    7    HD3  PRO  65           HD3      PRO  65 -26.221   4.283   7.981
    8    H    GLU  66           H        GLU  66 -23.843   7.593   7.103
    9    HA   GLU  66           HA       GLU  66 -23.540  10.399   6.762
   10    HB2  GLU  66           HB2      GLU  66 -21.730   8.103   6.064
   11    HB3  GLU  66           HB3      GLU  66 -21.276   9.799   5.896
   12    HG2  GLU  66           HG2      GLU  66 -21.494  10.116   8.271
   13    HG3  GLU  66           HG3      GLU  66 -22.022   8.446   8.464
   14    H    ILE  67           H        ILE  67 -23.641   7.705   4.449
   15    HA   ILE  67           HA       ILE  67 -23.215   9.463   2.196
   16    HB   ILE  67           HB       ILE  67 -24.120   6.556   2.308
   17   HG12  ILE  67          HG12      ILE  67 -21.485   7.739   1.419
   18   HG13  ILE  67          HG13      ILE  67 -21.786   7.283   3.095
   19   HG21  ILE  67          HG21      ILE  67 -24.053   8.484   0.126
   20   HG23  ILE  67          HG22      ILE  67 -24.682   6.836   0.138
   21   HG22  ILE  67          HG23      ILE  67 -22.972   7.123  -0.180
   22   HD12  ILE  67          HD11      ILE  67 -21.363   5.564   0.706
   23   HD11  ILE  67          HD12      ILE  67 -22.382   4.963   2.014
   24   HD13  ILE  67          HD13      ILE  67 -20.709   5.417   2.338
   25    H    GLN  68           H        GLN  68 -26.092   8.382   3.798
   26    HA   GLN  68           HA       GLN  68 -27.913   9.362   1.841
   27    HB2  GLN  68           HB2      GLN  68 -28.177   8.938   4.814
   28    HB3  GLN  68           HB3      GLN  68 -29.493   9.558   3.831
   29    HG2  GLN  68           HG2      GLN  68 -29.525   7.558   2.509
   30    HG3  GLN  68           HG3      GLN  68 -28.079   6.959   3.302
   31   HE21  GLN  68          HE21      GLN  68 -30.261   5.612   3.131
   32   HE22  GLN  68          HE22      GLN  68 -31.096   5.127   4.533
   33    H    ARG  69           H        ARG  69 -26.309  10.960   4.619
   34    HA   ARG  69           HA       ARG  69 -27.662  13.456   4.266
   35    HB2  ARG  69           HB2      ARG  69 -25.325  12.481   5.839
   36    HB3  ARG  69           HB3      ARG  69 -25.396  14.209   5.519
   37    HG2  ARG  69           HG2      ARG  69 -27.715  14.239   6.486
   38    HG3  ARG  69           HG3      ARG  69 -27.515  12.539   6.921
   39    HD2  ARG  69           HD2      ARG  69 -25.815  14.865   7.893
   40    HD3  ARG  69           HD3      ARG  69 -26.951  13.941   8.864
   41    HE   ARG  69           HE       ARG  69 -24.340  13.020   7.900
   42   HH21  ARG  69          HH11      ARG  69 -23.543  11.227   9.057
   43   HH22  ARG  69          HH12      ARG  69 -24.577  10.390  10.164
   44   HH11  ARG  69          HH21      ARG  69 -27.303  12.448   9.577
   45   HH12  ARG  69          HH22      ARG  69 -26.707  11.079  10.457
   46    H    LEU  70           H        LEU  70 -24.795  12.068   2.881
   47    HA   LEU  70           HA       LEU  70 -23.667  14.454   1.769
   48    HB2  LEU  70           HB2      LEU  70 -22.686  12.118   2.314
   49    HB3  LEU  70           HB3      LEU  70 -23.298  11.692   0.717
   50    HG   LEU  70           HG       LEU  70 -21.695  13.081  -0.333
   51   HD11  LEU  70          HD11      LEU  70 -20.876  13.857   2.475
   52   HD13  LEU  70          HD12      LEU  70 -21.563  14.922   1.249
   53   HD12  LEU  70          HD13      LEU  70 -19.955  14.238   1.018
   54   HD22  LEU  70          HD21      LEU  70 -20.272  11.352  -0.136
   55   HD21  LEU  70          HD22      LEU  70 -21.204  10.802   1.257
   56   HD23  LEU  70          HD23      LEU  70 -19.814  11.863   1.488
   57    H    LEU  71           H        LEU  71 -25.831  11.948   0.592
   58    HA   LEU  71           HA       LEU  71 -26.342  13.495  -1.891
   59    HB2  LEU  71           HB2      LEU  71 -26.566  10.503  -1.513
   60    HB3  LEU  71           HB3      LEU  71 -26.686  11.399  -3.027
   61    HG   LEU  71           HG       LEU  71 -24.169  11.359  -1.360
   62   HD12  LEU  71          HD11      LEU  71 -24.226   9.787  -3.830
   63   HD11  LEU  71          HD12      LEU  71 -25.243   9.140  -2.543
   64   HD13  LEU  71          HD13      LEU  71 -23.523   9.402  -2.258
   65   HD22  LEU  71          HD21      LEU  71 -24.257  13.209  -2.812
   66   HD21  LEU  71          HD22      LEU  71 -24.759  12.200  -4.170
   67   HD23  LEU  71          HD23      LEU  71 -23.140  12.028  -3.492

  No H/Q in entry =          67
  In of MODEL    1
    1    HA   PRO  72           HA       PRO  72 -30.216  13.012   0.712
    2    HB2  PRO  72           HB2      PRO  72 -31.056  15.580   0.687
    3    HB3  PRO  72           HB3      PRO  72 -29.753  15.094   1.771
    4    HG2  PRO  72           HG2      PRO  72 -29.552  16.350  -0.955
    5    HG3  PRO  72           HG3      PRO  72 -28.785  16.863   0.547
    6    HD2  PRO  72           HD2      PRO  72 -27.455  15.335  -1.250
    7    HD3  PRO  72           HD3      PRO  72 -27.205  15.126   0.482
    8    H    ASN  73           H        ASN  73 -29.579  14.036  -2.480
    9    HA   ASN  73           HA       ASN  73 -32.440  13.763  -3.124
   10    HB2  ASN  73           HB2      ASN  73 -31.961  14.914  -5.194
   11    HB3  ASN  73           HB3      ASN  73 -31.434  15.858  -3.811
   12   HD21  ASN  73          HD21      ASN  73 -30.633  15.958  -6.485
   13   HD22  ASN  73          HD22      ASN  73 -28.966  15.788  -6.677
   14    H    LYS  74           H        LYS  74 -30.479  11.483  -2.747
   15    HA   LYS  74           HA       LYS  74 -31.052  10.152  -5.327
   16    HB2  LYS  74           HB2      LYS  74 -28.525   9.801  -3.708
   17    HB3  LYS  74           HB3      LYS  74 -28.913   9.027  -5.245
   18    HG2  LYS  74           HG2      LYS  74 -28.623  11.989  -4.975
   19    HG3  LYS  74           HG3      LYS  74 -27.257  10.922  -5.300
   20    HD2  LYS  74           HD2      LYS  74 -28.378  10.048  -7.267
   21    HD3  LYS  74           HD3      LYS  74 -29.789  11.050  -6.927
   22    HE2  LYS  74           HE2      LYS  74 -28.546  13.055  -7.320
   23    HE3  LYS  74           HE3      LYS  74 -27.033  12.154  -7.429
   24    HZ2  LYS  74           HZ1      LYS  74 -28.493  12.818  -9.543
   25    HZ1  LYS  74           HZ2      LYS  74 -29.162  11.293  -9.207
   26    HZ3  LYS  74           HZ3      LYS  74 -27.495  11.445  -9.496

  No H/Q in entry =          26
  In of MODEL    1
    1    HA   PRO  75           HA       PRO  75 -32.480   7.112  -2.428
    2    HB2  PRO  75           HB2      PRO  75 -32.806   4.934  -4.061
    3    HB3  PRO  75           HB3      PRO  75 -33.919   6.299  -4.101
    4    HG2  PRO  75           HG2      PRO  75 -31.583   5.721  -5.880
    5    HG3  PRO  75           HG3      PRO  75 -33.226   6.184  -6.321
    6    HD2  PRO  75           HD2      PRO  75 -31.268   8.029  -6.231
    7    HD3  PRO  75           HD3      PRO  75 -32.898   8.431  -5.688
    8    H    VAL  76           H        VAL  76 -31.039   6.013  -1.076
    9    HA   VAL  76           HA       VAL  76 -28.584   4.806  -2.205
   10    HB   VAL  76           HB       VAL  76 -28.864   6.215   0.485
   11   HG11  VAL  76          HG11      VAL  76 -26.517   4.937  -0.931
   12   HG13  VAL  76          HG12      VAL  76 -27.221   4.458   0.615
   13   HG12  VAL  76          HG13      VAL  76 -26.360   5.990   0.476
   14   HG22  VAL  76          HG21      VAL  76 -28.176   8.128  -0.357
   15   HG21  VAL  76          HG22      VAL  76 -28.722   7.473  -1.903
   16   HG23  VAL  76          HG23      VAL  76 -27.022   7.358  -1.446
   17    H    GLU  77           H        GLU  77 -28.388   2.636  -1.640
   18    HA   GLU  77           HA       GLU  77 -29.188   1.797   0.994
   19    HB2  GLU  77           HB2      GLU  77 -30.810   0.177   0.422
   20    HB3  GLU  77           HB3      GLU  77 -31.342   1.721  -0.246
   21    HG2  GLU  77           HG2      GLU  77 -30.736   1.006  -2.449
   22    HG3  GLU  77           HG3      GLU  77 -30.109  -0.511  -1.808
   23    H    VAL  78           H        VAL  78 -28.882  -0.308   1.607
   24    HA   VAL  78           HA       VAL  78 -26.221  -1.083   0.708
   25    HB   VAL  78           HB       VAL  78 -27.943  -2.005   3.049
   26   HG11  VAL  78          HG11      VAL  78 -25.612  -3.229   1.903
   27   HG13  VAL  78          HG12      VAL  78 -26.528  -3.723   3.328
   28   HG12  VAL  78          HG13      VAL  78 -25.198  -2.578   3.487
   29   HG22  VAL  78          HG21      VAL  78 -26.475  -0.686   4.421
   30   HG21  VAL  78          HG22      VAL  78 -27.199   0.319   3.165
   31   HG23  VAL  78          HG23      VAL  78 -25.527  -0.219   3.009
   32    H    ILE  79           H        ILE  79 -25.699  -2.975  -0.238
   33    HA   ILE  79           HA       ILE  79 -27.769  -4.404  -1.623
   34    HB   ILE  79           HB       ILE  79 -24.784  -4.963  -1.407
   35   HG12  ILE  79          HG12      ILE  79 -26.405  -3.793  -3.674
   36   HG13  ILE  79          HG13      ILE  79 -25.525  -2.817  -2.497
   37   HG22  ILE  79          HG21      ILE  79 -25.891  -6.080  -3.754
   38   HG21  ILE  79          HG22      ILE  79 -26.884  -6.624  -2.401
   39   HG23  ILE  79          HG23      ILE  79 -25.145  -6.918  -2.393
   40   HD13  ILE  79          HD11      ILE  79 -24.107  -2.903  -4.314
   41   HD12  ILE  79          HD12      ILE  79 -24.461  -4.601  -4.634
   42   HD11  ILE  79          HD13      ILE  79 -23.476  -4.152  -3.240
   43    H    ASP  80           H        ASP  80 -28.653  -6.332  -1.085
   44    HA   ASP  80           HA       ASP  80 -28.614  -7.291   1.540
   45    HB2  ASP  80           HB2      ASP  80 -30.369  -7.815  -0.115
   46    HB3  ASP  80           HB3      ASP  80 -29.217  -8.814  -1.003
   47    H    SER  81           H        SER  81 -27.092  -8.465   2.649
   48    HA   SER  81           HA       SER  81 -24.598  -9.143   1.448
   49    HB2  SER  81           HB2      SER  81 -24.062 -10.224   3.596
   50    HB3  SER  81           HB3      SER  81 -24.749  -8.619   3.843
   51    HG   SER  81           HG       SER  81 -26.550  -9.473   4.595
   52    H    LEU  82           H        LEU  82 -27.329 -11.216   1.718
   53    HA   LEU  82           HA       LEU  82 -25.801 -13.586   1.149
   54    HB2  LEU  82           HB2      LEU  82 -28.730 -13.066   0.701
   55    HB3  LEU  82           HB3      LEU  82 -27.938 -14.634   0.847
   56    HG   LEU  82           HG       LEU  82 -28.275 -12.628   3.057
   57   HD12  LEU  82          HD11      LEU  82 -29.756 -14.490   3.952
   58   HD11  LEU  82          HD12      LEU  82 -29.685 -15.200   2.338
   59   HD13  LEU  82          HD13      LEU  82 -30.400 -13.604   2.570
   60   HD23  LEU  82          HD21      LEU  82 -27.497 -14.692   4.367
   61   HD22  LEU  82          HD22      LEU  82 -26.278 -13.821   3.440
   62   HD21  LEU  82          HD23      LEU  82 -26.957 -15.322   2.810
   63    H    LEU  83           H        LEU  83 -27.734 -11.301  -0.725
   64    HA   LEU  83           HA       LEU  83 -27.538 -12.607  -3.225
   65    HB2  LEU  83           HB2      LEU  83 -27.925  -9.711  -2.515
   66    HB3  LEU  83           HB3      LEU  83 -27.958 -10.320  -4.169
   67    HG   LEU  83           HG       LEU  83 -30.001 -10.735  -2.007
   68   HD13  LEU  83          HD11      LEU  83 -30.737  -8.857  -3.032
   69   HD12  LEU  83          HD12      LEU  83 -31.207  -9.939  -4.343
   70   HD11  LEU  83          HD13      LEU  83 -29.664  -9.085  -4.412
   71   HD23  LEU  83          HD21      LEU  83 -30.144 -11.932  -4.759
   72   HD22  LEU  83          HD22      LEU  83 -31.120 -12.304  -3.339
   73   HD21  LEU  83          HD23      LEU  83 -29.436 -12.822  -3.411
   74    H    TYR  84           H        TYR  84 -25.568 -10.276  -1.493
   75    HA   TYR  84           HA       TYR  84 -23.697  -9.760  -3.608
   76    HB2  TYR  84           HB2      TYR  84 -24.204  -8.312  -1.558
   77    HB3  TYR  84           HB3      TYR  84 -23.203  -9.442  -0.650
   78    HD1  TYR  84           HD1      TYR  84 -20.833  -9.327  -0.730
   79    HD2  TYR  84           HD2      TYR  84 -23.166  -6.970  -3.421
   80    HE1  TYR  84           HE1      TYR  84 -18.794  -8.108  -1.410
   81    HE2  TYR  84           HE2      TYR  84 -21.134  -5.752  -4.118
   82    HH   TYR  84           HH       TYR  84 -18.800  -5.258  -2.920
   83    H    GLY  85           H        GLY  85 -23.482 -11.828  -0.705
   84    HA3  GLY  85           HA2      GLY  85 -20.912 -12.785  -1.202
   85    HA2  GLY  85           HA3      GLY  85 -22.153 -13.640  -0.286
   86    H    LYS  86           H        LYS  86 -23.998 -13.950  -2.359
   87    HA   LYS  86           HA       LYS  86 -22.962 -16.307  -3.667
   88    HB2  LYS  86           HB2      LYS  86 -25.229 -16.069  -2.678
   89    HB3  LYS  86           HB3      LYS  86 -25.602 -14.862  -3.907
   90    HG2  LYS  86           HG2      LYS  86 -25.464 -16.525  -5.628
   91    HG3  LYS  86           HG3      LYS  86 -24.988 -17.743  -4.443
   92    HD2  LYS  86           HD2      LYS  86 -27.092 -17.363  -3.222
   93    HD3  LYS  86           HD3      LYS  86 -27.569 -16.169  -4.426
   94    HE2  LYS  86           HE2      LYS  86 -26.990 -19.065  -5.030
   95    HE3  LYS  86           HE3      LYS  86 -28.603 -18.395  -4.783
   96    HZ1  LYS  86           HZ1      LYS  86 -27.552 -16.696  -6.586
   97    HZ3  LYS  86           HZ2      LYS  86 -28.532 -18.028  -6.977
   98    HZ2  LYS  86           HZ3      LYS  86 -26.842 -18.165  -7.060
   99    H    VAL  87           H        VAL  87 -22.920 -13.074  -4.490
  100    HA   VAL  87           HA       VAL  87 -22.605 -11.861  -6.405
  101    HB   VAL  87           HB       VAL  87 -21.541 -14.384  -7.725
  102   HG11  VAL  87          HG11      VAL  87 -21.804 -12.052  -8.869
  103   HG13  VAL  87          HG12      VAL  87 -20.275 -12.911  -9.049
  104   HG12  VAL  87          HG13      VAL  87 -20.416 -11.595  -7.886
  105   HG22  VAL  87          HG21      VAL  87 -19.357 -13.928  -6.740
  106   HG21  VAL  87          HG22      VAL  87 -20.552 -14.303  -5.500
  107   HG23  VAL  87          HG23      VAL  87 -20.058 -12.633  -5.771
  108    H    ASP  88           H        ASP  88 -25.127 -12.488  -6.073
  109    HA   ASP  88           HA       ASP  88 -26.255 -13.642  -8.498
  110    HB2  ASP  88           HB2      ASP  88 -27.257 -13.929  -6.181
  111    HB3  ASP  88           HB3      ASP  88 -27.694 -12.222  -6.246
  112    H    GLY  89           H        GLY  89 -25.536 -12.357 -10.111
  113    HA3  GLY  89           HA2      GLY  89 -25.693  -9.579 -10.252
  114    HA2  GLY  89           HA3      GLY  89 -25.675 -10.670 -11.636
  115    H    LEU  90           H        LEU  90 -28.134 -12.010 -11.222
  116    HA   LEU  90           HA       LEU  90 -29.926 -10.036 -12.297
  117    HB2  LEU  90           HB2      LEU  90 -30.011 -12.418 -12.929
  118    HB3  LEU  90           HB3      LEU  90 -30.523 -12.816 -11.288
  119    HG   LEU  90           HG       LEU  90 -32.631 -11.673 -11.631
  120   HD13  LEU  90          HD11      LEU  90 -32.434  -9.903 -13.069
  121   HD12  LEU  90          HD12      LEU  90 -32.982 -11.110 -14.233
  122   HD11  LEU  90          HD13      LEU  90 -31.265 -10.734 -14.097
  123   HD23  LEU  90          HD21      LEU  90 -32.571 -13.251 -14.101
  124   HD22  LEU  90          HD22      LEU  90 -33.555 -13.439 -12.649
  125   HD21  LEU  90          HD23      LEU  90 -31.906 -14.064 -12.684
  126    H    GLY  91           H        GLY  91 -29.777 -11.606  -9.145
  127    HA3  GLY  91           HA2      GLY  91 -32.108 -10.497  -8.086
  128    HA2  GLY  91           HA3      GLY  91 -30.723 -11.062  -7.153
  129    H    VAL  92           H        VAL  92 -28.788  -9.233  -7.966
  130    HA   VAL  92           HA       VAL  92 -29.563  -6.958  -6.371
  131    HB   VAL  92           HB       VAL  92 -27.017  -7.415  -7.972
  132   HG12  VAL  92          HG11      VAL  92 -27.171  -5.578  -5.606
  133   HG11  VAL  92          HG12      VAL  92 -27.828  -4.996  -7.137
  134   HG13  VAL  92          HG13      VAL  92 -26.137  -5.481  -7.032
  135   HG22  VAL  92          HG21      VAL  92 -26.811  -9.038  -6.413
  136   HG21  VAL  92          HG22      VAL  92 -27.950  -8.271  -5.306
  137   HG23  VAL  92          HG23      VAL  92 -26.292  -7.683  -5.411
  138    H    LEU  93           H        LEU  93 -29.155  -7.551  -9.804
  139    HA   LEU  93           HA       LEU  93 -29.478  -4.894 -10.678
  140    HB2  LEU  93           HB2      LEU  93 -28.848  -6.722 -12.177
  141    HB3  LEU  93           HB3      LEU  93 -30.446  -7.441 -11.972
  142    HG   LEU  93           HG       LEU  93 -31.440  -5.446 -13.056
  143   HD11  LEU  93          HD11      LEU  93 -29.576  -3.877 -12.515
  144   HD13  LEU  93          HD12      LEU  93 -30.013  -3.867 -14.225
  145   HD12  LEU  93          HD13      LEU  93 -28.570  -4.725 -13.689
  146   HD23  LEU  93          HD21      LEU  93 -30.402  -5.973 -15.353
  147   HD22  LEU  93          HD22      LEU  93 -31.255  -7.242 -14.476
  148   HD21  LEU  93          HD23      LEU  93 -29.490  -7.200 -14.474
  149    H    LYS  94           H        LYS  94 -31.874  -7.437  -9.886
  150    HA   LYS  94           HA       LYS  94 -34.206  -5.964 -10.483
  151    HB2  LYS  94           HB2      LYS  94 -33.713  -8.195  -8.518
  152    HB3  LYS  94           HB3      LYS  94 -35.304  -7.482  -8.773
  153    HG2  LYS  94           HG2      LYS  94 -35.220  -8.207 -11.123
  154    HG3  LYS  94           HG3      LYS  94 -33.667  -8.978 -10.808
  155    HD2  LYS  94           HD2      LYS  94 -34.800 -10.341  -9.014
  156    HD3  LYS  94           HD3      LYS  94 -36.338  -9.670  -9.557
  157    HE2  LYS  94           HE2      LYS  94 -35.826 -10.554 -11.843
  158    HE3  LYS  94           HE3      LYS  94 -34.418 -11.364 -11.154
  159    HZ3  LYS  94           HZ1      LYS  94 -36.281 -12.866 -11.359
  160    HZ2  LYS  94           HZ2      LYS  94 -37.247 -11.853 -10.397
  161    HZ1  LYS  94           HZ3      LYS  94 -35.895 -12.626  -9.723
  162    H    ALA  95           H        ALA  95 -32.388  -6.164  -7.435
  163    HA   ALA  95           HA       ALA  95 -34.227  -4.601  -5.924
  164    HB2  ALA  95           HB1      ALA  95 -31.864  -6.006  -5.414
  165    HB3  ALA  95           HB2      ALA  95 -32.836  -5.118  -4.243
  166    HB1  ALA  95           HB3      ALA  95 -31.481  -4.325  -5.045
  167    H    ALA  96           H        ALA  96 -31.575  -3.725  -8.000
  168    HA   ALA  96           HA       ALA  96 -31.457  -0.981  -7.167
  169    HB2  ALA  96           HB1      ALA  96 -30.090  -0.721  -9.269
  170    HB3  ALA  96           HB2      ALA  96 -30.408  -2.419  -9.626
  171    HB1  ALA  96           HB3      ALA  96 -29.491  -1.978  -8.185
  172    H    VAL  97           H        VAL  97 -32.999  -2.624  -9.892
  173    HA   VAL  97           HA       VAL  97 -34.047  -0.289 -11.099
  174    HB   VAL  97           HB       VAL  97 -34.883  -3.206 -11.206
  175   HG11  VAL  97          HG11      VAL  97 -36.656  -1.173 -11.650
  176   HG13  VAL  97          HG12      VAL  97 -36.728  -2.749 -12.441
  177   HG12  VAL  97          HG13      VAL  97 -35.962  -1.388 -13.258
  178   HG21  VAL  97          HG21      VAL  97 -33.584  -1.345 -13.199
  179   HG23  VAL  97          HG22      VAL  97 -34.052  -3.015 -13.525
  180   HG22  VAL  97          HG23      VAL  97 -32.801  -2.665 -12.330
  181    H    ALA  98           H        ALA  98 -35.254  -2.511  -8.612
  182    HA   ALA  98           HA       ALA  98 -37.803  -1.345  -8.239
  183    HB1  ALA  98           HB1      ALA  98 -36.813  -3.576  -7.253
  184    HB3  ALA  98           HB2      ALA  98 -37.986  -2.661  -6.303
  185    HB2  ALA  98           HB3      ALA  98 -36.265  -2.537  -5.939
  186    H    ALA  99           H        ALA  99 -34.719  -0.614  -6.571
  187    HA   ALA  99           HA       ALA  99 -35.832   1.345  -4.868
  188    HB1  ALA  99           HB1      ALA  99 -33.191   0.445  -5.631
  189    HB2  ALA  99           HB2      ALA  99 -33.736   1.168  -4.117
  190    HB3  ALA  99           HB3      ALA  99 -33.247   2.199  -5.461
  191    H    ILE 100           H        ILE 100 -34.785   1.539  -8.219
  192    HA   ILE 100           HA       ILE 100 -34.933   4.393  -8.375
  193    HB   ILE 100           HB       ILE 100 -35.049   2.287 -10.561
  194   HG12  ILE 100          HG12      ILE 100 -32.864   4.241  -9.844
  195   HG13  ILE 100          HG13      ILE 100 -32.919   2.581  -9.249
  196   HG21  ILE 100          HG21      ILE 100 -35.440   5.213 -10.627
  197   HG23  ILE 100          HG22      ILE 100 -35.957   3.976 -11.772
  198   HG22  ILE 100          HG23      ILE 100 -34.299   4.574 -11.811
  199   HD12  ILE 100          HD11      ILE 100 -32.373   3.593 -12.001
  200   HD11  ILE 100          HD12      ILE 100 -33.052   1.980 -11.784
  201   HD13  ILE 100          HD13      ILE 100 -31.502   2.390 -11.052
  202    H    LYS 101           H        LYS 101 -37.254   1.825  -9.162
  203    HA   LYS 101           HA       LYS 101 -39.316   3.519 -10.126
  204    HB2  LYS 101           HB2      LYS 101 -39.232   0.719  -9.061
  205    HB3  LYS 101           HB3      LYS 101 -40.775   1.505  -9.391
  206    HG2  LYS 101           HG2      LYS 101 -40.296   1.686 -11.684
  207    HG3  LYS 101           HG3      LYS 101 -38.605   1.256 -11.437
  208    HD2  LYS 101           HD2      LYS 101 -39.874  -0.617 -12.367
  209    HD3  LYS 101           HD3      LYS 101 -39.253  -0.991 -10.759
  210    HE2  LYS 101           HE2      LYS 101 -41.325  -1.673 -10.270
  211    HE3  LYS 101           HE3      LYS 101 -41.762   0.035 -10.235
  212    HZ3  LYS 101           HZ1      LYS 101 -42.652  -0.064 -12.357
  213    HZ2  LYS 101           HZ2      LYS 101 -43.131  -1.548 -11.684
  214    HZ1  LYS 101           HZ3      LYS 101 -41.822  -1.490 -12.764
  215    H    LYS 102           H        LYS 102 -38.845   1.964  -6.951
  216    HA   LYS 102           HA       LYS 102 -41.081   3.158  -5.729
  217    HB2  LYS 102           HB2      LYS 102 -39.867   1.255  -4.755
  218    HB3  LYS 102           HB3      LYS 102 -38.464   2.289  -4.486
  219    HG2  LYS 102           HG2      LYS 102 -39.768   3.664  -2.960
  220    HG3  LYS 102           HG3      LYS 102 -41.173   2.634  -3.230
  221    HD2  LYS 102           HD2      LYS 102 -39.970   0.732  -2.246
  222    HD3  LYS 102           HD3      LYS 102 -38.564   1.763  -1.973
  223    HE2  LYS 102           HE2      LYS 102 -39.905   3.224  -0.532
  224    HE3  LYS 102           HE3      LYS 102 -41.326   2.224  -0.825
  225    HZ1  LYS 102           HZ1      LYS 102 -39.628   0.428   0.140
  226    HZ3  LYS 102           HZ2      LYS 102 -40.730   1.305   1.088
  227    HZ2  LYS 102           HZ3      LYS 102 -39.112   1.814   0.975
  228    H    ALA 103           H        ALA 103 -38.110   4.539  -6.707
  229    HA   ALA 103           HA       ALA 103 -38.310   6.814  -4.873
  230    HB2  ALA 103           HB1      ALA 103 -36.308   7.563  -6.428
  231    HB3  ALA 103           HB2      ALA 103 -36.290   5.854  -6.865
  232    HB1  ALA 103           HB3      ALA 103 -36.061   6.337  -5.185
  233    H    ALA 104           H        ALA 104 -38.933   6.167  -8.235
  234    HA   ALA 104           HA       ALA 104 -39.487   8.971  -8.795
  235    HB2  ALA 104           HB1      ALA 104 -39.533   8.354 -11.012
  236    HB1  ALA 104           HB2      ALA 104 -40.278   6.792 -10.671
  237    HB3  ALA 104           HB3      ALA 104 -38.553   7.030 -10.383
  238    H    ALA 105           H        ALA 105 -41.121   6.844  -7.041
  239    HA   ALA 105           HA       ALA 105 -43.530   8.263  -6.986
  240    HB2  ALA 105           HB1      ALA 105 -44.281   7.459  -9.045
  241    HB3  ALA 105           HB2      ALA 105 -44.932   6.252  -7.937
  242    HB1  ALA 105           HB3      ALA 105 -43.466   5.908  -8.851

  No H/Q in entry =         242
  In of MODEL    2
    1    H1   ALA   1           H3       ALA   1 -12.063 -16.015  -2.526
    2    H2   ALA   1           H2       ALA   1 -11.105 -17.149  -3.357
    3    H3   ALA   1           H1       ALA   1 -12.253 -16.218  -4.200
    4    HA   ALA   1           HA       ALA   1 -13.636 -17.932  -3.966
    5    HB3  ALA   1           HB1      ALA   1 -12.225 -19.689  -3.490
    6    HB1  ALA   1           HB2      ALA   1 -12.993 -19.580  -1.906
    7    HB2  ALA   1           HB3      ALA   1 -11.423 -18.824  -2.179

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLU   2           H        GLU   2 -15.261 -18.799  -2.320
    2    HA   GLU   2           HA       GLU   2 -16.933 -17.092  -1.276
    3    HB2  GLU   2           HB2      GLU   2 -15.980 -19.505   0.281
    4    HB3  GLU   2           HB3      GLU   2 -17.514 -18.669   0.522
    5    HG2  GLU   2           HG2      GLU   2 -18.471 -19.769  -1.216
    6    HG3  GLU   2           HG3      GLU   2 -17.145 -19.358  -2.292

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLU   3           H        GLU   3 -15.025 -18.420   1.363
    2    HA   GLU   3           HA       GLU   3 -15.280 -16.065   2.913
    3    HB2  GLU   3           HB2      GLU   3 -13.671 -18.595   3.180
    4    HB3  GLU   3           HB3      GLU   3 -13.460 -17.271   4.325
    5    HG2  GLU   3           HG2      GLU   3 -15.657 -17.442   5.129
    6    HG3  GLU   3           HG3      GLU   3 -16.235 -18.251   3.678

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LEU   4           H        LEU   4 -12.301 -17.518   1.545
    2    HA   LEU   4           HA       LEU   4 -10.490 -15.595   2.151
    3    HB2  LEU   4           HB2      LEU   4 -10.690 -16.901  -0.573
    4    HB3  LEU   4           HB3      LEU   4  -9.249 -16.165   0.120
    5    HG   LEU   4           HG       LEU   4 -10.727 -18.574   1.229
    6   HD13  LEU   4          HD11      LEU   4  -9.075 -19.916   0.314
    7   HD12  LEU   4          HD12      LEU   4  -7.878 -18.621   0.292
    8   HD11  LEU   4          HD13      LEU   4  -9.158 -18.659  -0.919
    9   HD23  LEU   4          HD21      LEU   4  -8.485 -18.612   2.626
   10   HD22  LEU   4          HD22      LEU   4  -9.819 -17.584   3.143
   11   HD21  LEU   4          HD23      LEU   4  -8.458 -16.884   2.268

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLU   5           H        GLU   5 -12.809 -15.418  -0.540
    2    HA   GLU   5           HA       GLU   5 -11.823 -12.927  -1.540
    3    HB2  GLU   5           HB2      GLU   5 -13.152 -14.543  -2.895
    4    HB3  GLU   5           HB3      GLU   5 -14.562 -14.160  -1.908
    5    HG2  GLU   5           HG2      GLU   5 -14.683 -12.796  -3.892
    6    HG3  GLU   5           HG3      GLU   5 -14.253 -11.741  -2.547

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLU   6           H        GLU   6 -14.554 -13.826   0.536
    2    HA   GLU   6           HA       GLU   6 -15.487 -11.158   0.923
    3    HB2  GLU   6           HB2      GLU   6 -15.892 -13.704   2.506
    4    HB3  GLU   6           HB3      GLU   6 -16.698 -12.182   2.884
    5    HG2  GLU   6           HG2      GLU   6 -17.724 -12.136   0.667
    6    HG3  GLU   6           HG3      GLU   6 -16.862 -13.604   0.212

  No H/Q in entry =           6
  In of MODEL    2
    1    H    VAL   7           H        VAL   7 -13.170 -13.242   2.515
    2    HA   VAL   7           HA       VAL   7 -12.735 -11.657   4.842
    3    HB   VAL   7           HB       VAL   7 -11.002 -13.687   3.409
    4   HG11  VAL   7          HG11      VAL   7 -10.566 -12.144   5.972
    5   HG13  VAL   7          HG12      VAL   7  -9.454 -12.351   4.619
    6   HG12  VAL   7          HG13      VAL   7  -9.802 -13.708   5.690
    7   HG21  VAL   7          HG21      VAL   7 -13.255 -14.270   4.615
    8   HG23  VAL   7          HG22      VAL   7 -12.341 -13.984   6.096
    9   HG22  VAL   7          HG23      VAL   7 -11.828 -15.242   4.973

  No H/Q in entry =           9
  In of MODEL    2
    1    H    VAL   8           H        VAL   8 -11.200 -11.765   1.642
    2    HA   VAL   8           HA       VAL   8  -9.159  -9.871   2.144
    3    HB   VAL   8           HB       VAL   8 -10.598 -10.575  -0.424
    4   HG13  VAL   8          HG11      VAL   8  -9.656  -8.421  -0.791
    5   HG12  VAL   8          HG12      VAL   8  -8.465  -9.550  -1.438
    6   HG11  VAL   8          HG13      VAL   8  -8.210  -8.809   0.142
    7   HG23  VAL   8          HG21      VAL   8  -7.758 -11.334   0.026
    8   HG22  VAL   8          HG22      VAL   8  -9.075 -12.278  -0.662
    9   HG21  VAL   8          HG23      VAL   8  -8.910 -12.147   1.087

  No H/Q in entry =           9
  In of MODEL    2
    1    H    MET   9           H        MET   9 -12.500  -9.516   0.960
    2    HA   MET   9           HA       MET   9 -12.461  -6.740   0.519
    3    HB2  MET   9           HB2      MET   9 -14.629  -8.688   1.256
    4    HB3  MET   9           HB3      MET   9 -14.972  -6.957   1.205
    5    HG2  MET   9           HG2      MET   9 -13.903  -6.982  -1.132
    6    HG3  MET   9           HG3      MET   9 -14.032  -8.738  -1.045
    7    HE3  MET   9           HE1      MET   9 -17.524  -9.691  -1.321
    8    HE2  MET   9           HE2      MET   9 -16.869  -9.479   0.300
    9    HE1  MET   9           HE3      MET   9 -15.826 -10.068  -0.991

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLY  10           H        GLY  10 -13.126  -8.631   3.447
    2    HA3  GLY  10           HA2      GLY  10 -13.707  -6.447   5.156
    3    HA2  GLY  10           HA3      GLY  10 -13.131  -8.029   5.678

  No H/Q in entry =           3
  In of MODEL    2
    1    H    LEU  11           H        LEU  11 -10.675  -8.132   4.380
    2    HA   LEU  11           HA       LEU  11  -9.001  -6.677   6.145
    3    HB2  LEU  11           HB2      LEU  11  -8.422  -8.101   3.545
    4    HB3  LEU  11           HB3      LEU  11  -7.166  -7.381   4.551
    5    HG   LEU  11           HG       LEU  11  -9.154  -9.432   5.558
    6   HD13  LEU  11          HD11      LEU  11  -7.909 -10.660   4.006
    7   HD12  LEU  11          HD12      LEU  11  -6.982 -10.886   5.488
    8   HD11  LEU  11          HD13      LEU  11  -6.445  -9.718   4.281
    9   HD22  LEU  11          HD21      LEU  11  -8.325  -8.406   7.478
   10   HD21  LEU  11          HD22      LEU  11  -6.786  -7.990   6.725
   11   HD23  LEU  11          HD23      LEU  11  -7.098  -9.648   7.237

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  12           H        ILE  12  -9.885  -6.148   2.748
    2    HA   ILE  12           HA       ILE  12  -8.214  -3.901   2.327
    3    HB   ILE  12           HB       ILE  12 -10.851  -4.604   1.015
    4   HG12  ILE  12          HG12      ILE  12  -8.798  -6.234   0.958
    5   HG13  ILE  12          HG13      ILE  12  -9.651  -5.888  -0.532
    6   HG23  ILE  12          HG21      ILE  12 -10.293  -2.272   0.581
    7   HG22  ILE  12          HG22      ILE  12  -9.938  -3.197  -0.872
    8   HG21  ILE  12          HG23      ILE  12  -8.656  -2.713   0.200
    9   HD12  ILE  12          HD11      ILE  12  -7.143  -5.812  -0.715
   10   HD11  ILE  12          HD12      ILE  12  -7.157  -4.441   0.391
   11   HD13  ILE  12          HD13      ILE  12  -7.925  -4.310  -1.172

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  13           H        ILE  13 -11.579  -4.201   3.398
    2    HA   ILE  13           HA       ILE  13 -12.071  -1.419   3.657
    3    HB   ILE  13           HB       ILE  13 -13.259  -3.849   5.014
    4   HG12  ILE  13          HG12      ILE  13 -13.471  -3.297   2.473
    5   HG13  ILE  13          HG13      ILE  13 -14.892  -3.793   3.368
    6   HG23  ILE  13          HG21      ILE  13 -13.687  -2.068   6.544
    7   HG22  ILE  13          HG22      ILE  13 -15.169  -2.252   5.614
    8   HG21  ILE  13          HG23      ILE  13 -14.058  -0.934   5.247
    9   HD12  ILE  13          HD11      ILE  13 -15.081  -1.696   1.833
   10   HD11  ILE  13          HD12      ILE  13 -14.195  -0.896   3.117
   11   HD13  ILE  13          HD13      ILE  13 -15.754  -1.612   3.464

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ASN  14           H        ASN  14 -10.949  -3.891   5.946
    2    HA   ASN  14           HA       ASN  14 -10.782  -2.245   8.228
    3    HB2  ASN  14           HB2      ASN  14 -10.498  -4.850   7.915
    4    HB3  ASN  14           HB3      ASN  14  -8.792  -4.444   7.769
    5   HD21  ASN  14          HD21      ASN  14  -9.427  -5.970   9.944
    6   HD22  ASN  14          HD22      ASN  14  -9.420  -5.046  11.366

  No H/Q in entry =           6
  In of MODEL    2
    1    H    SER  15           H        SER  15  -8.354  -3.047   5.756
    2    HA   SER  15           HA       SER  15  -6.235  -1.527   6.839
    3    HB2  SER  15           HB2      SER  15  -5.194  -1.742   4.693
    4    HB3  SER  15           HB3      SER  15  -6.143  -3.208   4.907
    5    HG   SER  15           HG       SER  15  -7.207  -2.654   3.202

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLY  16           H        GLY  16  -8.830  -0.697   4.571
    2    HA3  GLY  16           HA2      GLY  16  -8.000   1.952   4.018
    3    HA2  GLY  16           HA3      GLY  16  -9.642   1.337   3.846

  No H/Q in entry =           3
  In of MODEL    2
    1    H    GLN  17           H        GLN  17 -10.195   0.613   6.494
    2    HA   GLN  17           HA       GLN  17 -10.941   3.112   7.623
    3    HB2  GLN  17           HB2      GLN  17 -10.817   0.334   8.811
    4    HB3  GLN  17           HB3      GLN  17 -11.464   1.729   9.674
    5    HG2  GLN  17           HG2      GLN  17 -13.132   2.077   7.915
    6    HG3  GLN  17           HG3      GLN  17 -12.458   0.739   6.986
    7   HE21  GLN  17          HE21      GLN  17 -14.951   0.131   7.380
    8   HE22  GLN  17          HE22      GLN  17 -15.231  -0.852   8.736

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ALA  18           H        ALA  18  -8.289   0.865   8.267
    2    HA   ALA  18           HA       ALA  18  -7.223   2.101  10.542
    3    HB2  ALA  18           HB1      ALA  18  -6.575  -0.111   9.185
    4    HB3  ALA  18           HB2      ALA  18  -5.430   0.689  10.262
    5    HB1  ALA  18           HB3      ALA  18  -5.344   0.964   8.521

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ARG  19           H        ARG  19  -6.433   2.625   7.098
    2    HA   ARG  19           HA       ARG  19  -4.564   4.697   7.534
    3    HB2  ARG  19           HB2      ARG  19  -4.861   3.546   5.340
    4    HB3  ARG  19           HB3      ARG  19  -6.413   4.366   5.149
    5    HG2  ARG  19           HG2      ARG  19  -5.313   6.553   5.219
    6    HG3  ARG  19           HG3      ARG  19  -3.756   5.788   5.537
    7    HD2  ARG  19           HD2      ARG  19  -3.872   6.370   3.191
    8    HD3  ARG  19           HD3      ARG  19  -3.935   4.610   3.341
    9    HE   ARG  19           HE       ARG  19  -6.580   5.484   3.312
   10   HH21  ARG  19          HH11      ARG  19  -7.763   5.620   1.385
   11   HH22  ARG  19          HH12      ARG  19  -6.932   5.704  -0.129
   12   HH11  ARG  19          HH21      ARG  19  -3.791   5.578   1.298
   13   HH12  ARG  19          HH22      ARG  19  -4.681   5.678  -0.178

  No H/Q in entry =          13
  In of MODEL    2
    1    H    SER  20           H        SER  20  -8.059   4.765   6.908
    2    HA   SER  20           HA       SER  20  -8.452   7.515   6.849
    3    HB2  SER  20           HB2      SER  20 -10.149   5.606   6.476
    4    HB3  SER  20           HB3      SER  20 -10.381   5.658   8.223
    5    HG   SER  20           HG       SER  20 -10.921   7.605   6.268

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU  21           H        LEU  21  -8.444   5.341   9.660
    2    HA   LEU  21           HA       LEU  21  -8.926   7.336  11.616
    3    HB2  LEU  21           HB2      LEU  21  -7.538   4.654  11.793
    4    HB3  LEU  21           HB3      LEU  21  -7.871   5.671  13.192
    5    HG   LEU  21           HG       LEU  21 -10.013   4.735  11.260
    6   HD12  LEU  21          HD11      LEU  21 -10.596   3.213  13.268
    7   HD11  LEU  21          HD12      LEU  21  -8.943   3.515  13.802
    8   HD13  LEU  21          HD13      LEU  21  -9.239   2.735  12.247
    9   HD23  LEU  21          HD21      LEU  21 -11.375   5.228  13.474
   10   HD22  LEU  21          HD22      LEU  21 -10.940   6.571  12.424
   11   HD21  LEU  21          HD23      LEU  21 -10.001   6.253  13.873

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ALA  22           H        ALA  22  -5.945   5.999  10.234
    2    HA   ALA  22           HA       ALA  22  -4.095   7.343  11.866
    3    HB2  ALA  22           HB1      ALA  22  -3.641   5.490  10.183
    4    HB1  ALA  22           HB2      ALA  22  -2.463   6.803  10.223
    5    HB3  ALA  22           HB3      ALA  22  -3.671   6.739   8.939

  No H/Q in entry =           5
  In of MODEL    2
    1    H    TYR  23           H        TYR  23  -5.402   8.333   8.670
    2    HA   TYR  23           HA       TYR  23  -4.101  10.847   8.603
    3    HB2  TYR  23           HB2      TYR  23  -5.155   9.913   6.606
    4    HB3  TYR  23           HB3      TYR  23  -6.740  10.003   7.375
    5    HD1  TYR  23           HD1      TYR  23  -3.854  12.079   6.240
    6    HD2  TYR  23           HD2      TYR  23  -8.005  11.997   7.338
    7    HE1  TYR  23           HE1      TYR  23  -4.103  14.423   5.470
    8    HE2  TYR  23           HE2      TYR  23  -8.255  14.341   6.567
    9    HH   TYR  23           HH       TYR  23  -5.509  16.105   5.133

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ALA  24           H        ALA  24  -7.217   9.830   9.962
    2    HA   ALA  24           HA       ALA  24  -8.095  12.410  10.719
    3    HB1  ALA  24           HB1      ALA  24  -9.899  11.135  11.176
    4    HB2  ALA  24           HB2      ALA  24  -9.077  10.579  12.632
    5    HB3  ALA  24           HB3      ALA  24  -8.927   9.665  11.132

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA  25           H        ALA  25  -6.071   9.985  12.315
    2    HA   ALA  25           HA       ALA  25  -5.770  11.249  14.816
    3    HB2  ALA  25           HB1      ALA  25  -4.964   8.906  14.008
    4    HB3  ALA  25           HB2      ALA  25  -3.969   9.781  15.174
    5    HB1  ALA  25           HB3      ALA  25  -3.520   9.765  13.468

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU  26           H        LEU  26  -3.960  11.564  11.788
    2    HA   LEU  26           HA       LEU  26  -2.034  13.414  12.714
    3    HB2  LEU  26           HB2      LEU  26  -1.700  12.260  10.616
    4    HB3  LEU  26           HB3      LEU  26  -3.178  12.946   9.948
    5    HG   LEU  26           HG       LEU  26  -2.196  15.210  10.084
    6   HD12  LEU  26          HD11      LEU  26   0.339  15.266  10.517
    7   HD11  LEU  26          HD12      LEU  26   0.131  13.685  11.265
    8   HD13  LEU  26          HD13      LEU  26  -0.701  15.091  11.930
    9   HD21  LEU  26          HD21      LEU  26  -0.414  13.176   8.709
   10   HD23  LEU  26          HD22      LEU  26  -0.478  14.895   8.333
   11   HD22  LEU  26          HD23      LEU  26  -1.885  13.878   8.036

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LYS  27           H        LYS  27  -5.211  13.848  11.211
    2    HA   LYS  27           HA       LYS  27  -5.192  16.637  11.005
    3    HB2  LYS  27           HB2      LYS  27  -6.909  15.133  10.010
    4    HB3  LYS  27           HB3      LYS  27  -7.574  14.872  11.622
    5    HG2  LYS  27           HG2      LYS  27  -8.038  17.273  11.848
    6    HG3  LYS  27           HG3      LYS  27  -7.322  17.575  10.261
    7    HD2  LYS  27           HD2      LYS  27  -9.027  16.114   9.216
    8    HD3  LYS  27           HD3      LYS  27  -9.749  15.829  10.802
    9    HE2  LYS  27           HE2      LYS  27 -10.226  18.235  11.034
   10    HE3  LYS  27           HE3      LYS  27  -9.476  18.542   9.464
   11    HZ3  LYS  27           HZ1      LYS  27 -11.850  18.384   9.205
   12    HZ2  LYS  27           HZ2      LYS  27 -11.883  16.870   9.978
   13    HZ1  LYS  27           HZ3      LYS  27 -11.129  17.039   8.462

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLN  28           H        GLN  28  -6.074  14.547  13.731
    2    HA   GLN  28           HA       GLN  28  -7.009  16.544  15.495
    3    HB2  GLN  28           HB2      GLN  28  -5.577  13.932  16.055
    4    HB3  GLN  28           HB3      GLN  28  -6.339  14.931  17.294
    5    HG2  GLN  28           HG2      GLN  28  -7.772  13.789  14.879
    6    HG3  GLN  28           HG3      GLN  28  -7.829  13.098  16.500
    7   HE21  GLN  28          HE21      GLN  28  -9.713  14.879  14.524
    8   HE22  GLN  28          HE22      GLN  28 -10.481  15.886  15.653

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ALA  29           H        ALA  29  -3.768  15.287  14.833
    2    HA   ALA  29           HA       ALA  29  -2.363  16.708  16.818
    3    HB1  ALA  29           HB1      ALA  29  -0.415  16.038  15.715
    4    HB3  ALA  29           HB2      ALA  29  -1.160  16.148  14.120
    5    HB2  ALA  29           HB3      ALA  29  -1.573  14.814  15.196

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LYS  30           H        LYS  30  -3.207  17.568  13.480
    2    HA   LYS  30           HA       LYS  30  -1.823  20.023  13.382
    3    HB2  LYS  30           HB2      LYS  30  -4.334  19.117  11.958
    4    HB3  LYS  30           HB3      LYS  30  -3.514  20.640  11.615
    5    HG2  LYS  30           HG2      LYS  30  -1.427  19.368  11.121
    6    HG3  LYS  30           HG3      LYS  30  -2.319  17.863  11.363
    7    HD2  LYS  30           HD2      LYS  30  -3.876  18.482   9.556
    8    HD3  LYS  30           HD3      LYS  30  -3.007  19.999   9.315
    9    HE2  LYS  30           HE2      LYS  30  -0.957  18.726   8.754
   10    HE3  LYS  30           HE3      LYS  30  -1.845  17.214   8.963
   11    HZ2  LYS  30           HZ1      LYS  30  -1.661  18.080   6.620
   12    HZ1  LYS  30           HZ2      LYS  30  -2.721  19.333   7.077
   13    HZ3  LYS  30           HZ3      LYS  30  -3.229  17.711   7.150

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLN  31           H        GLN  31  -4.925  19.144  14.775
    2    HA   GLN  31           HA       GLN  31  -5.719  21.894  15.213
    3    HB2  GLN  31           HB2      GLN  31  -6.884  19.439  16.534
    4    HB3  GLN  31           HB3      GLN  31  -7.657  21.003  16.279
    5    HG2  GLN  31           HG2      GLN  31  -6.921  20.226  13.696
    6    HG3  GLN  31           HG3      GLN  31  -7.436  18.718  14.444
    7   HE21  GLN  31          HE21      GLN  31  -8.846  20.273  12.328
    8   HE22  GLN  31          HE22      GLN  31 -10.368  20.652  12.974

  No H/Q in entry =           8
  In of MODEL    2
    1    H    GLY  32           H        GLY  32  -3.398  19.992  16.555
    2    HA3  GLY  32           HA2      GLY  32  -2.015  20.472  18.366
    3    HA2  GLY  32           HA3      GLY  32  -3.159  21.705  18.878

  No H/Q in entry =           3
  In of MODEL    2
    1    H    ASP  33           H        ASP  33  -4.549  18.651  18.214
    2    HA   ASP  33           HA       ASP  33  -4.975  18.197  21.092
    3    HB2  ASP  33           HB2      ASP  33  -6.355  17.166  18.608
    4    HB3  ASP  33           HB3      ASP  33  -6.706  16.557  20.223

  No H/Q in entry =           4
  In of MODEL    2
    1    H    PHE  34           H        PHE  34  -2.801  17.367  21.415
    2    HA   PHE  34           HA       PHE  34  -1.771  15.124  20.027
    3    HB2  PHE  34           HB2      PHE  34  -1.182  16.120  22.823
    4    HB3  PHE  34           HB3      PHE  34  -0.236  14.904  21.966
    5    HD1  PHE  34           HD1      PHE  34  -0.445  18.329  22.691
    6    HD2  PHE  34           HD2      PHE  34   0.432  15.626  19.469
    7    HE1  PHE  34           HE1      PHE  34   0.842  20.110  21.542
    8    HE2  PHE  34           HE2      PHE  34   1.715  17.409  18.324
    9    HZ   PHE  34           HZ       PHE  34   1.922  19.648  19.365

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ALA  35           H        ALA  35  -3.833  15.389  22.875
    2    HA   ALA  35           HA       ALA  35  -3.603  12.731  23.779
    3    HB3  ALA  35           HB1      ALA  35  -6.072  13.337  24.618
    4    HB1  ALA  35           HB2      ALA  35  -5.550  14.959  24.162
    5    HB2  ALA  35           HB3      ALA  35  -4.636  14.046  25.362

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA  36           H        ALA  36  -6.052  14.221  21.659
    2    HA   ALA  36           HA       ALA  36  -7.442  11.795  21.177
    3    HB1  ALA  36           HB1      ALA  36  -8.904  13.202  20.208
    4    HB3  ALA  36           HB2      ALA  36  -7.726  13.630  18.966
    5    HB2  ALA  36           HB3      ALA  36  -7.770  14.521  20.487

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA  37           H        ALA  37  -4.764  13.403  19.523
    2    HA   ALA  37           HA       ALA  37  -4.699  11.763  17.231
    3    HB3  ALA  37           HB1      ALA  37  -2.732  13.495  18.663
    4    HB2  ALA  37           HB2      ALA  37  -3.251  13.543  16.979
    5    HB1  ALA  37           HB3      ALA  37  -2.090  12.324  17.511

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LYS  38           H        LYS  38  -2.961  11.479  20.321
    2    HA   LYS  38           HA       LYS  38  -1.610   9.090  19.847
    3    HB2  LYS  38           HB2      LYS  38  -1.964  10.855  21.986
    4    HB3  LYS  38           HB3      LYS  38  -2.573   9.321  22.602
    5    HG2  LYS  38           HG2      LYS  38  -0.465   8.219  22.083
    6    HG3  LYS  38           HG3      LYS  38   0.136   9.667  21.270
    7    HD2  LYS  38           HD2      LYS  38   0.280  10.892  23.303
    8    HD3  LYS  38           HD3      LYS  38  -0.735   9.734  24.166
    9    HE2  LYS  38           HE2      LYS  38   1.619   9.441  24.802
   10    HE3  LYS  38           HE3      LYS  38   1.033   8.018  23.937
   11    HZ3  LYS  38           HZ1      LYS  38   2.342   8.444  22.164
   12    HZ2  LYS  38           HZ2      LYS  38   3.282   9.284  23.305
   13    HZ1  LYS  38           HZ3      LYS  38   2.202  10.132  22.304

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ALA  39           H        ALA  39  -4.863   9.559  21.226
    2    HA   ALA  39           HA       ALA  39  -5.402   6.836  21.733
    3    HB3  ALA  39           HB1      ALA  39  -7.573   8.759  20.946
    4    HB2  ALA  39           HB2      ALA  39  -6.687   8.997  22.453
    5    HB1  ALA  39           HB3      ALA  39  -7.588   7.504  22.187

  No H/Q in entry =           5
  In of MODEL    2
    1    H    MET  40           H        MET  40  -5.985   8.837  18.878
    2    HA   MET  40           HA       MET  40  -7.433   6.888  17.411
    3    HB2  MET  40           HB2      MET  40  -5.839   9.296  16.513
    4    HB3  MET  40           HB3      MET  40  -6.849   8.326  15.437
    5    HG2  MET  40           HG2      MET  40  -7.913   9.570  17.985
    6    HG3  MET  40           HG3      MET  40  -7.967  10.401  16.433
    7    HE3  MET  40           HE1      MET  40 -10.521   8.753  14.354
    8    HE2  MET  40           HE2      MET  40  -8.768   8.886  14.218
    9    HE1  MET  40           HE3      MET  40  -9.703  10.245  14.842

  No H/Q in entry =           9
  In of MODEL    2
    1    H    MET  41           H        MET  41  -3.950   7.659  17.557
    2    HA   MET  41           HA       MET  41  -3.160   5.907  15.466
    3    HB2  MET  41           HB2      MET  41  -1.568   6.594  17.949
    4    HB3  MET  41           HB3      MET  41  -0.933   5.949  16.439
    5    HG2  MET  41           HG2      MET  41  -2.104   8.118  15.422
    6    HG3  MET  41           HG3      MET  41  -1.885   8.712  17.066
    7    HE2  MET  41           HE1      MET  41   1.051   6.642  17.453
    8    HE1  MET  41           HE2      MET  41   0.243   7.931  18.343
    9    HE3  MET  41           HE3      MET  41   1.869   8.188  17.711

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ASP  42           H        ASP  42  -3.565   5.438  18.950
    2    HA   ASP  42           HA       ASP  42  -2.505   2.854  19.123
    3    HB2  ASP  42           HB2      ASP  42  -3.409   4.609  20.936
    4    HB3  ASP  42           HB3      ASP  42  -4.826   3.570  20.855

  No H/Q in entry =           4
  In of MODEL    2
    1    H    GLN  43           H        GLN  43  -5.846   3.924  18.597
    2    HA   GLN  43           HA       GLN  43  -6.962   1.325  18.400
    3    HB2  GLN  43           HB2      GLN  43  -7.904   3.966  17.258
    4    HB3  GLN  43           HB3      GLN  43  -8.852   2.477  17.233
    5    HG2  GLN  43           HG2      GLN  43  -8.575   2.364  19.742
    6    HG3  GLN  43           HG3      GLN  43  -7.866   3.976  19.673
    7   HE21  GLN  43          HE21      GLN  43 -10.057   4.038  21.157
    8   HE22  GLN  43          HE22      GLN  43 -11.417   4.598  20.315

  No H/Q in entry =           8
  In of MODEL    2
    1    H    SER  44           H        SER  44  -5.627   3.547  15.993
    2    HA   SER  44           HA       SER  44  -6.297   2.051  13.702
    3    HB2  SER  44           HB2      SER  44  -5.067   4.448  14.149
    4    HB3  SER  44           HB3      SER  44  -3.700   3.464  13.631
    5    HG   SER  44           HG       SER  44  -4.809   4.422  11.858

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ARG  45           H        ARG  45  -3.433   1.971  15.803
    2    HA   ARG  45           HA       ARG  45  -1.924   0.029  14.436
    3    HB2  ARG  45           HB2      ARG  45  -1.110   1.462  16.308
    4    HB3  ARG  45           HB3      ARG  45  -2.100   0.524  17.423
    5    HG2  ARG  45           HG2      ARG  45  -0.844  -1.524  16.793
    6    HG3  ARG  45           HG3      ARG  45   0.170  -0.561  15.721
    7    HD2  ARG  45           HD2      ARG  45   0.877   0.831  17.678
    8    HD3  ARG  45           HD3      ARG  45  -0.043  -0.250  18.748
    9    HE   ARG  45           HE       ARG  45   1.684  -1.833  17.183
   10   HH21  ARG  45          HH11      ARG  45   3.586  -2.635  18.036
   11   HH22  ARG  45          HH12      ARG  45   4.341  -1.838  19.371
   12   HH11  ARG  45          HH21      ARG  45   1.945   0.642  19.570
   13   HH12  ARG  45          HH22      ARG  45   3.412   0.019  20.237

  No H/Q in entry =          13
  In of MODEL    2
    1    H    MET  46           H        MET  46  -4.337  -0.310  17.019
    2    HA   MET  46           HA       MET  46  -4.145  -3.107  17.333
    3    HB2  MET  46           HB2      MET  46  -6.331  -1.115  17.918
    4    HB3  MET  46           HB3      MET  46  -6.536  -2.837  18.249
    5    HG2  MET  46           HG2      MET  46  -4.563  -2.832  19.689
    6    HG3  MET  46           HG3      MET  46  -4.249  -1.148  19.303
    7    HE3  MET  46           HE1      MET  46  -7.874  -2.916  20.214
    8    HE2  MET  46           HE2      MET  46  -7.480  -2.992  21.928
    9    HE1  MET  46           HE3      MET  46  -6.418  -3.761  20.753

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ALA  47           H        ALA  47  -6.168  -1.113  15.219
    2    HA   ALA  47           HA       ALA  47  -7.759  -3.182  14.146
    3    HB3  ALA  47           HB1      ALA  47  -8.456  -0.951  13.720
    4    HB1  ALA  47           HB2      ALA  47  -7.950  -1.583  12.154
    5    HB2  ALA  47           HB3      ALA  47  -6.886  -0.503  13.056

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU  48           H        LEU  48  -4.644  -1.846  13.116
    2    HA   LEU  48           HA       LEU  48  -4.332  -3.439  10.780
    3    HB2  LEU  48           HB2      LEU  48  -2.300  -2.138  12.601
    4    HB3  LEU  48           HB3      LEU  48  -1.913  -2.859  11.038
    5    HG   LEU  48           HG       LEU  48  -3.958  -0.658  11.408
    6   HD13  LEU  48          HD11      LEU  48  -1.849   0.238  12.088
    7   HD12  LEU  48          HD12      LEU  48  -2.117   0.786  10.433
    8   HD11  LEU  48          HD13      LEU  48  -1.010  -0.550  10.752
    9   HD22  LEU  48          HD21      LEU  48  -4.405  -1.651   9.331
   10   HD21  LEU  48          HD22      LEU  48  -2.717  -2.072   9.049
   11   HD23  LEU  48          HD23      LEU  48  -3.249  -0.398   8.882

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ASN  49           H        ASN  49  -3.308  -3.820  14.134
    2    HA   ASN  49           HA       ASN  49  -1.684  -6.070  13.820
    3    HB2  ASN  49           HB2      ASN  49  -1.743  -4.726  15.865
    4    HB3  ASN  49           HB3      ASN  49  -3.395  -5.236  16.180
    5   HD21  ASN  49          HD21      ASN  49  -1.360  -5.717  18.079
    6   HD22  ASN  49          HD22      ASN  49  -1.071  -7.386  18.165

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLU  50           H        GLU  50  -5.160  -5.822  14.465
    2    HA   GLU  50           HA       GLU  50  -5.650  -8.625  14.575
    3    HB2  GLU  50           HB2      GLU  50  -7.256  -6.949  15.436
    4    HB3  GLU  50           HB3      GLU  50  -7.542  -6.390  13.786
    5    HG2  GLU  50           HG2      GLU  50  -8.385  -8.594  13.146
    6    HG3  GLU  50           HG3      GLU  50  -8.010  -9.232  14.743

  No H/Q in entry =           6
  In of MODEL    2
    1    H    ALA  51           H        ALA  51  -5.717  -6.232  11.974
    2    HA   ALA  51           HA       ALA  51  -6.674  -7.971   9.948
    3    HB2  ALA  51           HB1      ALA  51  -6.457  -6.160   8.577
    4    HB1  ALA  51           HB2      ALA  51  -4.825  -5.797   9.137
    5    HB3  ALA  51           HB3      ALA  51  -6.220  -5.295  10.095

  No H/Q in entry =           5
  In of MODEL    2
    1    H    HIS  52           H        HIS  52  -3.398  -7.038  10.955
    2    HA   HIS  52           HA       HIS  52  -1.973  -8.521   9.019
    3    HB2  HIS  52           HB2      HIS  52  -0.970  -6.774  10.472
    4    HB3  HIS  52           HB3      HIS  52  -1.130  -7.860  11.852
    5    HD1  HIS  52           HD1      HIS  52   0.242 -10.165  11.680
    6    HD2  HIS  52           HD2      HIS  52   1.279  -7.246   8.890
    7    HE1  HIS  52           HE1      HIS  52   2.484 -10.853  10.722
    8    HE2  HIS  52           HE2      HIS  52   3.129  -9.084   9.019

  No H/Q in entry =           8
  In of MODEL    2
    1    H    LEU  53           H        LEU  53  -3.204  -9.401  12.224
    2    HA   LEU  53           HA       LEU  53  -1.990 -11.937  12.432
    3    HB2  LEU  53           HB2      LEU  53  -4.491 -10.770  13.625
    4    HB3  LEU  53           HB3      LEU  53  -4.025 -12.442  13.922
    5    HG   LEU  53           HG       LEU  53  -2.134 -10.118  14.405
    6   HD12  LEU  53          HD11      LEU  53  -2.761 -10.542  16.854
    7   HD11  LEU  53          HD12      LEU  53  -4.168 -11.404  16.233
    8   HD13  LEU  53          HD13      LEU  53  -3.957  -9.692  15.881
    9   HD21  LEU  53          HD21      LEU  53  -2.177 -13.052  15.135
   10   HD23  LEU  53          HD22      LEU  53  -1.262 -11.902  16.105
   11   HD22  LEU  53          HD23      LEU  53  -0.864 -12.131  14.412

  No H/Q in entry =          11
  In of MODEL    2
    1    H    VAL  54           H        VAL  54  -5.097 -10.930  11.043
    2    HA   VAL  54           HA       VAL  54  -5.989 -13.531  10.354
    3    HB   VAL  54           HB       VAL  54  -6.645 -10.805   9.210
    4   HG12  VAL  54          HG11      VAL  54  -8.732 -12.197   8.384
    5   HG11  VAL  54          HG12      VAL  54  -7.612 -13.556   8.467
    6   HG13  VAL  54          HG13      VAL  54  -7.253 -12.180   7.425
    7   HG22  VAL  54          HG21      VAL  54  -7.568 -10.844  11.354
    8   HG21  VAL  54          HG22      VAL  54  -7.811 -12.589  11.336
    9   HG23  VAL  54          HG23      VAL  54  -8.892 -11.541  10.419

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLN  55           H        GLN  55  -4.119 -11.071   8.575
    2    HA   GLN  55           HA       GLN  55  -3.961 -12.539   6.161
    3    HB2  GLN  55           HB2      GLN  55  -3.370 -10.271   5.972
    4    HB3  GLN  55           HB3      GLN  55  -2.269 -10.339   7.346
    5    HG2  GLN  55           HG2      GLN  55  -0.537 -11.177   6.084
    6    HG3  GLN  55           HG3      GLN  55  -1.597 -12.160   5.084
    7   HE21  GLN  55          HE21      GLN  55  -1.602 -11.474   2.961
    8   HE22  GLN  55          HE22      GLN  55  -1.409  -9.869   2.449

  No H/Q in entry =           8
  In of MODEL    2
    1    H    THR  56           H        THR  56  -1.878 -12.501   9.058
    2    HA   THR  56           HA       THR  56   0.217 -14.089   8.160
    3    HB   THR  56           HB       THR  56  -1.104 -14.109  10.887
    4    HG1  THR  56           HG1      THR  56  -0.062 -12.150   9.850
    5   HG21  THR  56          HG21      THR  56   1.575 -15.163   9.942
    6   HG23  THR  56          HG22      THR  56   0.250 -16.103  10.629
    7   HG22  THR  56          HG23      THR  56   1.134 -14.958  11.637

  No H/Q in entry =           7
  In of MODEL    2
    1    H    LYS  57           H        LYS  57  -2.908 -15.141   9.501
    2    HA   LYS  57           HA       LYS  57  -2.444 -17.934   9.263
    3    HB2  LYS  57           HB2      LYS  57  -4.279 -16.856  10.593
    4    HB3  LYS  57           HB3      LYS  57  -5.060 -16.406   9.086
    5    HG2  LYS  57           HG2      LYS  57  -5.310 -18.757   8.469
    6    HG3  LYS  57           HG3      LYS  57  -4.450 -19.253   9.925
    7    HD2  LYS  57           HD2      LYS  57  -6.765 -19.509  10.439
    8    HD3  LYS  57           HD3      LYS  57  -6.273 -18.019  11.246
    9    HE2  LYS  57           HE2      LYS  57  -7.284 -16.657   9.552
   10    HE3  LYS  57           HE3      LYS  57  -7.498 -18.027   8.465
   11    HZ1  LYS  57           HZ1      LYS  57  -8.814 -18.848  10.649
   12    HZ3  LYS  57           HZ2      LYS  57  -9.542 -18.068   9.327
   13    HZ2  LYS  57           HZ3      LYS  57  -9.106 -17.176  10.706

  No H/Q in entry =          13
  In of MODEL    2
    1    H    LEU  58           H        LEU  58  -3.772 -15.503   7.073
    2    HA   LEU  58           HA       LEU  58  -4.549 -17.336   5.063
    3    HB2  LEU  58           HB2      LEU  58  -3.957 -14.385   4.927
    4    HB3  LEU  58           HB3      LEU  58  -4.605 -15.328   3.584
    5    HG   LEU  58           HG       LEU  58  -5.907 -15.150   6.321
    6   HD11  LEU  58          HD11      LEU  58  -6.197 -13.509   3.824
    7   HD13  LEU  58          HD12      LEU  58  -6.203 -12.999   5.512
    8   HD12  LEU  58          HD13      LEU  58  -7.616 -13.801   4.831
    9   HD22  LEU  58          HD21      LEU  58  -6.853 -17.066   5.448
   10   HD21  LEU  58          HD22      LEU  58  -6.503 -16.615   3.779
   11   HD23  LEU  58          HD23      LEU  58  -7.876 -15.895   4.618

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  59           H        ILE  59  -1.427 -16.107   5.947
    2    HA   ILE  59           HA       ILE  59  -0.304 -16.833   3.320
    3    HB   ILE  59           HB       ILE  59   0.440 -14.762   4.898
    4   HG12  ILE  59          HG12      ILE  59   2.548 -16.394   3.469
    5   HG13  ILE  59          HG13      ILE  59   1.348 -15.461   2.612
    6   HG23  ILE  59          HG21      ILE  59   2.291 -15.240   6.287
    7   HG22  ILE  59          HG22      ILE  59   2.534 -16.826   5.591
    8   HG21  ILE  59          HG23      ILE  59   1.173 -16.527   6.671
    9   HD12  ILE  59          HD11      ILE  59   3.408 -14.154   2.898
   10   HD11  ILE  59          HD12      ILE  59   3.291 -14.359   4.644
   11   HD13  ILE  59          HD13      ILE  59   2.076 -13.414   3.783

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLU  60           H        GLU  60  -0.336 -17.933   6.690
    2    HA   GLU  60           HA       GLU  60   1.707 -19.901   6.446
    3    HB2  GLU  60           HB2      GLU  60   1.103 -19.297   8.650
    4    HB3  GLU  60           HB3      GLU  60  -0.613 -19.538   8.336
    5    HG2  GLU  60           HG2      GLU  60   0.435 -21.384   9.689
    6    HG3  GLU  60           HG3      GLU  60  -0.307 -21.941   8.190

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLY  61           H        GLY  61  -1.799 -20.018   5.932
    2    HA3  GLY  61           HA2      GLY  61  -1.528 -22.811   4.981
    3    HA2  GLY  61           HA3      GLY  61  -3.022 -22.082   5.561

  No H/Q in entry =           3
  In of MODEL    2
    1    H    ASP  62           H        ASP  62  -0.781 -20.498   3.372
    2    HA   ASP  62           HA       ASP  62  -2.831 -19.873   1.505
    3    HB2  ASP  62           HB2      ASP  62  -0.989 -18.916   0.184
    4    HB3  ASP  62           HB3      ASP  62  -0.882 -18.433   1.874

  No H/Q in entry =           4
  In of MODEL    2
    1    H    ALA  63           H        ALA  63  -3.518 -22.259   1.234
    2    HA   ALA  63           HA       ALA  63  -1.914 -24.058  -0.291
    3    HB1  ALA  63           HB1      ALA  63  -3.975 -25.294  -0.654
    4    HB3  ALA  63           HB2      ALA  63  -4.920 -23.919  -0.083
    5    HB2  ALA  63           HB3      ALA  63  -3.860 -24.783   1.031

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLY  64           H        GLY  64  -4.294 -21.583  -1.115
    2    HA3  GLY  64           HA2      GLY  64  -4.722 -20.464  -3.075
    3    HA2  GLY  64           HA3      GLY  64  -3.218 -21.116  -3.705

  No H/Q in entry =           3
  In of MODEL    2
    1    H    GLU  65           H        GLU  65  -4.696 -21.095  -5.701
    2    HA   GLU  65           HA       GLU  65  -6.834 -22.910  -5.915
    3    HB2  GLU  65           HB2      GLU  65  -5.001 -21.811  -8.048
    4    HB3  GLU  65           HB3      GLU  65  -6.488 -22.705  -8.368
    5    HG2  GLU  65           HG2      GLU  65  -6.333 -20.163  -6.725
    6    HG3  GLU  65           HG3      GLU  65  -6.825 -20.231  -8.416

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLY  66           H        GLY  66  -3.425 -23.283  -6.536
    2    HA3  GLY  66           HA2      GLY  66  -3.760 -26.169  -7.024
    3    HA2  GLY  66           HA3      GLY  66  -2.433 -25.203  -7.638

  No H/Q in entry =           3
  In of MODEL    2
    1    H    LYS  67           H        LYS  67  -1.455 -27.247  -6.612
    2    HA   LYS  67           HA       LYS  67  -1.271 -27.566  -3.841
    3    HB2  LYS  67           HB2      LYS  67   0.713 -28.392  -5.962
    4    HB3  LYS  67           HB3      LYS  67   0.588 -29.061  -4.330
    5    HG2  LYS  67           HG2      LYS  67  -1.709 -29.043  -6.305
    6    HG3  LYS  67           HG3      LYS  67  -0.615 -30.410  -6.105
    7    HD2  LYS  67           HD2      LYS  67  -1.239 -30.239  -3.580
    8    HD3  LYS  67           HD3      LYS  67  -2.620 -29.300  -4.155
    9    HE2  LYS  67           HE2      LYS  67  -3.491 -31.465  -4.200
   10    HE3  LYS  67           HE3      LYS  67  -2.905 -31.287  -5.854
   11    HZ1  LYS  67           HZ1      LYS  67  -0.765 -32.167  -4.323
   12    HZ3  LYS  67           HZ2      LYS  67  -1.616 -33.032  -5.511
   13    HZ2  LYS  67           HZ3      LYS  67  -2.091 -33.128  -3.883

  No H/Q in entry =          13
  In of MODEL    2
    1    H    MET  68           H        MET  68   1.515 -26.688  -5.786
    2    HA   MET  68           HA       MET  68   2.997 -25.552  -3.674
    3    HB2  MET  68           HB2      MET  68   3.317 -25.306  -6.666
    4    HB3  MET  68           HB3      MET  68   4.526 -24.812  -5.480
    5    HG2  MET  68           HG2      MET  68   3.391 -27.613  -5.720
    6    HG3  MET  68           HG3      MET  68   4.949 -27.103  -6.374
    7    HE2  MET  68           HE1      MET  68   6.250 -25.167  -4.038
    8    HE1  MET  68           HE2      MET  68   6.769 -26.289  -5.294
    9    HE3  MET  68           HE3      MET  68   7.266 -26.556  -3.625

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LYS  69           H        LYS  69   1.028 -24.017  -6.210
    2    HA   LYS  69           HA       LYS  69   1.854 -21.381  -5.713
    3    HB2  LYS  69           HB2      LYS  69  -0.644 -22.440  -6.999
    4    HB3  LYS  69           HB3      LYS  69  -0.239 -20.722  -6.923
    5    HG2  LYS  69           HG2      LYS  69   1.910 -21.165  -8.035
    6    HG3  LYS  69           HG3      LYS  69   1.523 -22.884  -8.111
    7    HD2  LYS  69           HD2      LYS  69  -0.455 -22.377  -9.500
    8    HD3  LYS  69           HD3      LYS  69  -0.056 -20.658  -9.433
    9    HE2  LYS  69           HE2      LYS  69   2.109 -21.107 -10.521
   10    HE3  LYS  69           HE3      LYS  69   1.730 -22.828 -10.574
   11    HZ1  LYS  69           HZ1      LYS  69  -0.381 -22.024 -11.792
   12    HZ3  LYS  69           HZ2      LYS  69   1.085 -22.113 -12.647
   13    HZ2  LYS  69           HZ3      LYS  69   0.515 -20.614 -12.086

  No H/Q in entry =          13
  In of MODEL    2
    1    H    VAL  70           H        VAL  70   0.112 -19.599  -5.234
    2    HA   VAL  70           HA       VAL  70  -1.292 -20.255  -2.707
    3    HB   VAL  70           HB       VAL  70  -0.577 -18.023  -1.858
    4   HG12  VAL  70          HG11      VAL  70   1.732 -19.803  -2.693
    5   HG11  VAL  70          HG12      VAL  70   0.691 -20.086  -1.297
    6   HG13  VAL  70          HG13      VAL  70   1.731 -18.662  -1.348
    7   HG22  VAL  70          HG21      VAL  70  -0.108 -16.699  -3.757
    8   HG21  VAL  70          HG22      VAL  70   0.835 -17.975  -4.524
    9   HG23  VAL  70          HG23      VAL  70   1.509 -17.082  -3.163

  No H/Q in entry =           9
  In of MODEL    2
    1    H    SER  71           H        SER  71  -2.922 -18.608  -2.142
    2    HA   SER  71           HA       SER  71  -4.745 -18.106  -4.247
    3    HB2  SER  71           HB2      SER  71  -5.418 -18.294  -1.851
    4    HB3  SER  71           HB3      SER  71  -4.589 -16.778  -1.515
    5    HG   SER  71           HG       SER  71  -6.634 -17.077  -3.460

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU  72           H        LEU  72  -5.007 -16.420  -5.564
    2    HA   LEU  72           HA       LEU  72  -2.907 -14.596  -6.034
    3    HB2  LEU  72           HB2      LEU  72  -5.766 -14.660  -6.998
    4    HB3  LEU  72           HB3      LEU  72  -4.564 -13.509  -7.572
    5    HG   LEU  72           HG       LEU  72  -4.157 -16.515  -7.684
    6   HD12  LEU  72          HD11      LEU  72  -4.650 -16.189 -10.151
    7   HD11  LEU  72          HD12      LEU  72  -5.276 -14.592  -9.738
    8   HD13  LEU  72          HD13      LEU  72  -6.049 -16.037  -9.088
    9   HD22  LEU  72          HD21      LEU  72  -2.040 -15.531  -7.935
   10   HD21  LEU  72          HD22      LEU  72  -2.673 -14.107  -8.742
   11   HD23  LEU  72          HD23      LEU  72  -2.585 -15.640  -9.605

  No H/Q in entry =          11
  In of MODEL    2
    1    H    VAL  73           H        VAL  73  -6.013 -14.256  -4.426
    2    HA   VAL  73           HA       VAL  73  -6.079 -11.485  -4.079
    3    HB   VAL  73           HB       VAL  73  -7.796 -11.857  -2.489
    4   HG11  VAL  73          HG11      VAL  73  -8.171 -12.626  -4.883
    5   HG13  VAL  73          HG12      VAL  73  -9.242 -13.345  -3.683
    6   HG12  VAL  73          HG13      VAL  73  -7.878 -14.270  -4.314
    7   HG21  VAL  73          HG21      VAL  73  -6.332 -14.436  -2.059
    8   HG23  VAL  73          HG22      VAL  73  -8.069 -14.395  -1.759
    9   HG22  VAL  73          HG23      VAL  73  -6.994 -13.316  -0.868

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LEU  74           H        LEU  74  -4.137 -13.839  -2.479
    2    HA   LEU  74           HA       LEU  74  -3.750 -12.692   0.045
    3    HB2  LEU  74           HB2      LEU  74  -2.948 -14.905  -0.441
    4    HB3  LEU  74           HB3      LEU  74  -1.894 -14.292  -1.714
    5    HG   LEU  74           HG       LEU  74  -0.595 -13.030  -0.037
    6   HD13  LEU  74          HD11      LEU  74  -2.165 -12.521   1.672
    7   HD12  LEU  74          HD12      LEU  74  -1.090 -13.711   2.408
    8   HD11  LEU  74          HD13      LEU  74  -2.675 -14.204   1.814
    9   HD23  LEU  74          HD21      LEU  74  -0.809 -15.771   1.094
   10   HD22  LEU  74          HD22      LEU  74   0.598 -14.855   0.600
   11   HD21  LEU  74          HD23      LEU  74  -0.406 -15.613  -0.614

  No H/Q in entry =          11
  In of MODEL    2
    1    H    VAL  75           H        VAL  75  -1.842 -12.290  -2.900
    2    HA   VAL  75           HA       VAL  75  -0.064 -10.353  -1.879
    3    HB   VAL  75           HB       VAL  75  -0.996 -10.854  -4.707
    4   HG13  VAL  75          HG11      VAL  75  -0.165  -8.541  -4.511
    5   HG12  VAL  75          HG12      VAL  75   1.047  -9.529  -5.314
    6   HG11  VAL  75          HG13      VAL  75   1.245  -9.106  -3.621
    7   HG21  VAL  75          HG21      VAL  75   1.451 -11.648  -3.091
    8   HG23  VAL  75          HG22      VAL  75   1.305 -11.884  -4.832
    9   HG22  VAL  75          HG23      VAL  75   0.214 -12.729  -3.734

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLU  76           H        GLU  76  -3.205 -10.028  -3.559
    2    HA   GLU  76           HA       GLU  76  -3.274  -7.214  -3.664
    3    HB2  GLU  76           HB2      GLU  76  -4.913  -8.699  -4.824
    4    HB3  GLU  76           HB3      GLU  76  -5.594  -9.141  -3.266
    5    HG2  GLU  76           HG2      GLU  76  -6.256  -6.801  -2.869
    6    HG3  GLU  76           HG3      GLU  76  -5.570  -6.320  -4.409

  No H/Q in entry =           6
  In of MODEL    2
    1    H    ALA  77           H        ALA  77  -4.388  -9.446  -1.129
    2    HA   ALA  77           HA       ALA  77  -5.369  -7.449   0.621
    3    HB1  ALA  77           HB1      ALA  77  -4.243 -10.174   1.317
    4    HB2  ALA  77           HB2      ALA  77  -5.914  -9.846   0.858
    5    HB3  ALA  77           HB3      ALA  77  -5.264  -9.176   2.352

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLN  78           H        GLN  78  -2.209  -8.979   0.280
    2    HA   GLN  78           HA       GLN  78  -0.974  -7.808   2.537
    3    HB2  GLN  78           HB2      GLN  78  -0.092  -9.745   1.189
    4    HB3  GLN  78           HB3      GLN  78   0.347  -8.598  -0.074
    5    HG2  GLN  78           HG2      GLN  78   1.788  -7.393   1.516
    6    HG3  GLN  78           HG3      GLN  78   1.352  -8.536   2.785
    7   HE21  GLN  78          HE21      GLN  78   4.079  -8.242   1.956
    8   HE22  GLN  78          HE22      GLN  78   4.555  -9.673   1.176

  No H/Q in entry =           8
  In of MODEL    2
    1    H    LEU  79           H        LEU  79  -1.324  -6.753  -0.814
    2    HA   LEU  79           HA       LEU  79   0.349  -4.517  -0.791
    3    HB2  LEU  79           HB2      LEU  79  -0.659  -5.331  -2.851
    4    HB3  LEU  79           HB3      LEU  79  -2.269  -4.948  -2.254
    5    HG   LEU  79           HG       LEU  79  -1.738  -2.558  -2.227
    6   HD13  LEU  79          HD11      LEU  79   0.497  -2.301  -1.700
    7   HD12  LEU  79          HD12      LEU  79   0.556  -2.016  -3.439
    8   HD11  LEU  79          HD13      LEU  79   1.015  -3.590  -2.788
    9   HD23  LEU  79          HD21      LEU  79  -1.088  -2.358  -4.775
   10   HD22  LEU  79          HD22      LEU  79  -2.613  -3.114  -4.326
   11   HD21  LEU  79          HD23      LEU  79  -1.232  -4.116  -4.760

  No H/Q in entry =          11
  In of MODEL    2
    1    H    HIS  80           H        HIS  80  -3.122  -4.697   0.012
    2    HA   HIS  80           HA       HIS  80  -3.333  -1.941   0.671
    3    HB2  HIS  80           HB2      HIS  80  -5.023  -4.358   0.981
    4    HB3  HIS  80           HB3      HIS  80  -5.358  -3.018   2.081
    5    HD1  HIS  80           HD1      HIS  80  -6.978  -1.391   1.161
    6    HD2  HIS  80           HD2      HIS  80  -4.756  -3.195  -1.870
    7    HE1  HIS  80           HE1      HIS  80  -7.809  -0.401  -1.025
    8    HE2  HIS  80           HE2      HIS  80  -6.460  -1.495  -2.882

  No H/Q in entry =           8
  In of MODEL    2
    1    H    LEU  81           H        LEU  81  -2.842  -4.831   2.670
    2    HA   LEU  81           HA       LEU  81  -2.853  -3.481   5.153
    3    HB2  LEU  81           HB2      LEU  81  -1.616  -6.092   4.285
    4    HB3  LEU  81           HB3      LEU  81  -1.604  -5.531   5.958
    5    HG   LEU  81           HG       LEU  81  -4.137  -5.798   4.313
    6   HD12  LEU  81          HD11      LEU  81  -4.440  -7.863   5.861
    7   HD11  LEU  81          HD12      LEU  81  -2.690  -7.784   6.059
    8   HD13  LEU  81          HD13      LEU  81  -3.387  -8.019   4.455
    9   HD23  LEU  81          HD21      LEU  81  -4.996  -6.002   6.809
   10   HD22  LEU  81          HD22      LEU  81  -4.675  -4.413   6.119
   11   HD21  LEU  81          HD23      LEU  81  -3.491  -5.166   7.188

  No H/Q in entry =          11
  In of MODEL    2
    1    H    MET  82           H        MET  82  -0.154  -4.374   3.001
    2    HA   MET  82           HA       MET  82   1.914  -3.468   4.698
    3    HB2  MET  82           HB2      MET  82   1.721  -3.814   1.705
    4    HB3  MET  82           HB3      MET  82   3.195  -3.236   2.477
    5    HG2  MET  82           HG2      MET  82   1.795  -5.831   3.195
    6    HG3  MET  82           HG3      MET  82   3.173  -5.716   2.104
    7    HE3  MET  82           HE1      MET  82   6.172  -4.964   4.107
    8    HE2  MET  82           HE2      MET  82   5.247  -3.602   3.481
    9    HE1  MET  82           HE3      MET  82   5.349  -5.093   2.548

  No H/Q in entry =           9
  In of MODEL    2
    1    H    THR  83           H        THR  83   0.102  -1.837   2.127
    2    HA   THR  83           HA       THR  83   1.503   0.617   2.220
    3    HB   THR  83           HB       THR  83  -0.671   1.532   1.218
    4    HG1  THR  83           HG1      THR  83  -2.315   0.227   1.102
    5   HG22  THR  83          HG21      THR  83  -0.380  -0.287  -0.778
    6   HG21  THR  83          HG22      THR  83   1.116  -0.572   0.109
    7   HG23  THR  83          HG23      THR  83   0.752   1.039  -0.511

  No H/Q in entry =           7
  In of MODEL    2
    1    H    SER  84           H        SER  84  -1.510  -0.426   3.803
    2    HA   SER  84           HA       SER  84  -2.025   2.004   5.141
    3    HB2  SER  84           HB2      SER  84  -2.850  -0.837   5.703
    4    HB3  SER  84           HB3      SER  84  -3.355   0.503   6.731
    5    HG   SER  84           HG       SER  84  -3.794   0.184   3.937

  No H/Q in entry =           5
  In of MODEL    2
    1    H    MET  85           H        MET  85  -0.310  -0.920   6.285
    2    HA   MET  85           HA       MET  85   0.189   0.012   8.892
    3    HB2  MET  85           HB2      MET  85   0.494  -2.332   8.221
    4    HB3  MET  85           HB3      MET  85   1.880  -1.864   7.233
    5    HG2  MET  85           HG2      MET  85   3.046  -1.030   9.231
    6    HG3  MET  85           HG3      MET  85   1.652  -1.441  10.228
    7    HE2  MET  85           HE1      MET  85   4.728  -4.096   8.231
    8    HE1  MET  85           HE2      MET  85   4.234  -2.454   7.825
    9    HE3  MET  85           HE3      MET  85   3.308  -3.822   7.216

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LEU  86           H        LEU  86   2.141   0.271   5.953
    2    HA   LEU  86           HA       LEU  86   4.343   1.592   7.121
    3    HB2  LEU  86           HB2      LEU  86   4.171   0.505   4.813
    4    HB3  LEU  86           HB3      LEU  86   3.361   1.983   4.293
    5    HG   LEU  86           HG       LEU  86   5.378   3.238   5.285
    6   HD11  LEU  86          HD11      LEU  86   6.087   0.630   6.093
    7   HD13  LEU  86          HD12      LEU  86   7.085   2.079   6.195
    8   HD12  LEU  86          HD13      LEU  86   7.207   1.029   4.785
    9   HD23  LEU  86          HD21      LEU  86   6.116   1.475   2.942
   10   HD22  LEU  86          HD22      LEU  86   6.502   3.174   3.204
   11   HD21  LEU  86          HD23      LEU  86   4.854   2.699   2.795

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ALA  87           H        ALA  87   1.437   2.822   5.516
    2    HA   ALA  87           HA       ALA  87   2.020   5.555   5.600
    3    HB1  ALA  87           HB1      ALA  87  -0.279   3.918   5.046
    4    HB3  ALA  87           HB2      ALA  87   0.029   5.579   4.545
    5    HB2  ALA  87           HB3      ALA  87  -0.774   5.257   6.084

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ARG  88           H        ARG  88   0.322   3.550   7.982
    2    HA   ARG  88           HA       ARG  88  -0.209   5.601   9.822
    3    HB2  ARG  88           HB2      ARG  88  -1.139   3.245   9.886
    4    HB3  ARG  88           HB3      ARG  88   0.399   2.751  10.603
    5    HG2  ARG  88           HG2      ARG  88  -0.096   4.826  12.216
    6    HG3  ARG  88           HG3      ARG  88  -1.758   4.495  11.750
    7    HD2  ARG  88           HD2      ARG  88  -1.867   2.647  12.998
    8    HD3  ARG  88           HD3      ARG  88  -0.272   2.070  12.479
    9    HE   ARG  88           HE       ARG  88  -0.826   3.335  14.927
   10   HH21  ARG  88          HH11      ARG  88   0.720   4.355  16.174
   11   HH22  ARG  88          HH12      ARG  88   2.242   4.786  15.479
   12   HH11  ARG  88          HH21      ARG  88   1.470   3.521  12.365
   13   HH12  ARG  88          HH22      ARG  88   2.675   4.298  13.334

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLU  89           H        GLU  89   2.597   3.392   9.621
    2    HA   GLU  89           HA       GLU  89   3.840   4.289  11.971
    3    HB2  GLU  89           HB2      GLU  89   4.515   2.271  10.635
    4    HB3  GLU  89           HB3      GLU  89   5.294   3.367   9.492
    5    HG2  GLU  89           HG2      GLU  89   6.765   4.222  11.244
    6    HG3  GLU  89           HG3      GLU  89   5.926   3.264  12.460

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LEU  90           H        LEU  90   4.174   5.443   8.644
    2    HA   LEU  90           HA       LEU  90   6.092   7.452   9.238
    3    HB2  LEU  90           HB2      LEU  90   4.102   7.109   6.999
    4    HB3  LEU  90           HB3      LEU  90   5.327   8.385   7.026
    5    HG   LEU  90           HG       LEU  90   6.011   5.452   7.369
    6   HD12  LEU  90          HD11      LEU  90   6.775   5.684   4.934
    7   HD11  LEU  90          HD12      LEU  90   5.754   7.121   4.876
    8   HD13  LEU  90          HD13      LEU  90   5.038   5.545   5.217
    9   HD22  LEU  90          HD21      LEU  90   7.899   6.611   8.062
   10   HD21  LEU  90          HD22      LEU  90   7.550   8.012   7.050
   11   HD23  LEU  90          HD23      LEU  90   8.221   6.549   6.330

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  91           H        ILE  91   2.554   7.452   9.066
    2    HA   ILE  91           HA       ILE  91   2.196  10.224   9.510
    3    HB   ILE  91           HB       ILE  91   0.413   7.841  10.045
    4   HG12  ILE  91          HG12      ILE  91   0.167  10.118   8.055
    5   HG13  ILE  91          HG13      ILE  91   1.037   8.627   7.691
    6   HG22  ILE  91          HG21      ILE  91  -1.330   9.891  10.094
    7   HG21  ILE  91          HG22      ILE  91   0.063  10.729  10.774
    8   HG23  ILE  91          HG23      ILE  91  -0.572   9.290  11.569
    9   HD13  ILE  91          HD11      ILE  91  -0.902   7.330   7.724
   10   HD12  ILE  91          HD12      ILE  91  -1.494   8.841   7.036
   11   HD11  ILE  91          HD13      ILE  91  -1.774   8.479   8.740

  No H/Q in entry =          11
  In of MODEL    2
    1    H    THR  92           H        THR  92   2.598   7.488  11.719
    2    HA   THR  92           HA       THR  92   2.132   8.863  14.137
    3    HB   THR  92           HB       THR  92   3.957   6.537  13.489
    4    HG1  THR  92           HG1      THR  92   1.992   5.769  13.376
    5   HG22  THR  92          HG21      THR  92   3.557   6.255  16.120
    6   HG21  THR  92          HG22      THR  92   3.484   8.014  16.043
    7   HG23  THR  92          HG23      THR  92   4.925   7.165  15.482

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLU  93           H        GLU  93   5.098   8.427  12.224
    2    HA   GLU  93           HA       GLU  93   6.833   9.866  13.931
    3    HB2  GLU  93           HB2      GLU  93   6.943   9.546  10.917
    4    HB3  GLU  93           HB3      GLU  93   8.274  10.086  11.939
    5    HG2  GLU  93           HG2      GLU  93   6.876   7.442  12.382
    6    HG3  GLU  93           HG3      GLU  93   8.266   7.600  11.315

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LEU  94           H        LEU  94   4.797  10.864  11.202
    2    HA   LEU  94           HA       LEU  94   5.587  13.573  11.102
    3    HB2  LEU  94           HB2      LEU  94   3.010  12.191  10.333
    4    HB3  LEU  94           HB3      LEU  94   3.260  13.920  10.090
    5    HG   LEU  94           HG       LEU  94   5.296  11.942   9.058
    6   HD11  LEU  94          HD11      LEU  94   2.559  12.474   7.975
    7   HD13  LEU  94          HD12      LEU  94   3.551  11.023   7.859
    8   HD12  LEU  94          HD13      LEU  94   3.885  12.403   6.815
    9   HD23  LEU  94          HD21      LEU  94   5.547  13.776   7.333
   10   HD22  LEU  94          HD22      LEU  94   5.948  14.274   8.977
   11   HD21  LEU  94          HD23      LEU  94   4.399  14.732   8.267

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  95           H        ILE  95   3.046  11.944  12.979
    2    HA   ILE  95           HA       ILE  95   1.980  14.290  14.162
    3    HB   ILE  95           HB       ILE  95   2.009  11.410  15.092
    4   HG12  ILE  95          HG12      ILE  95  -0.215  13.167  14.024
    5   HG13  ILE  95          HG13      ILE  95   0.755  12.112  13.001
    6   HG21  ILE  95          HG21      ILE  95   0.703  13.877  16.280
    7   HG23  ILE  95          HG22      ILE  95   1.753  12.716  17.094
    8   HG22  ILE  95          HG23      ILE  95   0.124  12.244  16.609
    9   HD13  ILE  95          HD11      ILE  95  -0.142  10.170  13.918
   10   HD12  ILE  95          HD12      ILE  95  -1.532  11.250  13.982
   11   HD11  ILE  95          HD13      ILE  95  -0.575  10.961  15.434

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLU  96           H        GLU  96   4.583  12.090  15.180
    2    HA   GLU  96           HA       GLU  96   5.112  13.297  17.673
    3    HB2  GLU  96           HB2      GLU  96   6.079  11.143  17.037
    4    HB3  GLU  96           HB3      GLU  96   7.017  11.920  15.762
    5    HG2  GLU  96           HG2      GLU  96   8.651  12.483  17.235
    6    HG3  GLU  96           HG3      GLU  96   7.491  13.290  18.280

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LEU  97           H        LEU  97   6.205  14.070  14.394
    2    HA   LEU  97           HA       LEU  97   8.072  16.081  15.115
    3    HB2  LEU  97           HB2      LEU  97   6.502  15.515  12.609
    4    HB3  LEU  97           HB3      LEU  97   7.510  16.954  12.736
    5    HG   LEU  97           HG       LEU  97   8.555  14.165  13.308
    6   HD12  LEU  97          HD11      LEU  97   9.567  14.362  10.998
    7   HD11  LEU  97          HD12      LEU  97   8.508  15.744  10.724
    8   HD13  LEU  97          HD13      LEU  97   7.818  14.148  11.017
    9   HD23  LEU  97          HD21      LEU  97  10.721  15.458  12.578
   10   HD22  LEU  97          HD22      LEU  97  10.088  15.726  14.202
   11   HD21  LEU  97          HD23      LEU  97   9.774  16.905  12.930

  No H/Q in entry =          11
  In of MODEL    2
    1    H    HIS  98           H        HIS  98   4.584  16.189  14.435
    2    HA   HIS  98           HA       HIS  98   4.263  18.987  14.563
    3    HB2  HIS  98           HB2      HIS  98   2.385  16.724  15.280
    4    HB3  HIS  98           HB3      HIS  98   1.905  18.421  15.329
    5    HD1  HIS  98           HD1      HIS  98   2.964  15.709  12.937
    6    HD2  HIS  98           HD2      HIS  98   1.559  19.632  12.797
    7    HE1  HIS  98           HE1      HIS  98   2.418  16.189  10.508
    8    HE2  HIS  98           HE2      HIS  98   1.567  18.571  10.401

  No H/Q in entry =           8
  In of MODEL    2
    1    H    GLU  99           H        GLU  99   4.397  16.504  17.068
    2    HA   GLU  99           HA       GLU  99   3.761  18.199  19.258
    3    HB2  GLU  99           HB2      GLU  99   3.690  15.716  19.359
    4    HB3  GLU  99           HB3      GLU  99   5.451  15.684  19.264
    5    HG2  GLU  99           HG2      GLU  99   5.615  16.982  21.336
    6    HG3  GLU  99           HG3      GLU  99   3.861  17.110  21.419

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LYS 100           H        LYS 100   6.833  17.288  17.716
    2    HA   LYS 100           HA       LYS 100   8.464  18.704  19.582
    3    HB2  LYS 100           HB2      LYS 100   8.990  17.778  16.749
    4    HB3  LYS 100           HB3      LYS 100  10.207  18.559  17.764
    5    HG2  LYS 100           HG2      LYS 100   9.831  16.809  19.506
    6    HG3  LYS 100           HG3      LYS 100   8.713  15.995  18.408
    7    HD2  LYS 100           HD2      LYS 100  10.521  15.722  16.755
    8    HD3  LYS 100           HD3      LYS 100  11.644  16.548  17.837
    9    HE2  LYS 100           HE2      LYS 100  11.248  14.793  19.556
   10    HE3  LYS 100           HE3      LYS 100  10.188  13.947  18.425
   11    HZ1  LYS 100           HZ1      LYS 100  13.008  14.637  17.788
   12    HZ3  LYS 100           HZ2      LYS 100  11.978  13.572  16.955
   13    HZ2  LYS 100           HZ3      LYS 100  12.558  13.160  18.498

  No H/Q in entry =          13
  In of MODEL    2
    1    H    LEU 101           H        LEU 101   6.784  19.613  16.613
    2    HA   LEU 101           HA       LEU 101   7.982  22.178  16.281
    3    HB2  LEU 101           HB2      LEU 101   5.402  20.924  15.378
    4    HB3  LEU 101           HB3      LEU 101   5.642  22.656  15.170
    5    HG   LEU 101           HG       LEU 101   7.699  20.653  14.222
    6   HD12  LEU 101          HD11      LEU 101   6.559  21.146  11.928
    7   HD11  LEU 101          HD12      LEU 101   5.149  21.568  12.898
    8   HD13  LEU 101          HD13      LEU 101   5.825  19.942  12.987
    9   HD21  LEU 101          HD21      LEU 101   7.054  23.560  13.656
   10   HD23  LEU 101          HD22      LEU 101   8.050  22.605  12.559
   11   HD22  LEU 101          HD23      LEU 101   8.578  22.869  14.220

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LYS 102           H        LYS 102   6.435  21.034  18.888
    2    HA   LYS 102           HA       LYS 102   5.781  22.125  20.814
    3    HB2  LYS 102           HB2      LYS 102   7.057  24.122  19.695
    4    HB3  LYS 102           HB3      LYS 102   5.456  24.714  19.307
    5    HG2  LYS 102           HG2      LYS 102   6.816  24.473  21.969
    6    HG3  LYS 102           HG3      LYS 102   5.859  25.794  21.331
    7    HD2  LYS 102           HD2      LYS 102   4.628  23.150  22.206
    8    HD3  LYS 102           HD3      LYS 102   4.859  24.515  23.288
    9    HE2  LYS 102           HE2      LYS 102   2.593  24.093  21.784
   10    HE3  LYS 102           HE3      LYS 102   3.080  25.644  22.467
   11    HZ2  LYS 102           HZ1      LYS 102   2.566  25.743  20.083
   12    HZ1  LYS 102           HZ2      LYS 102   3.837  24.670  19.771
   13    HZ3  LYS 102           HZ3      LYS 102   4.165  26.204  20.413

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ALA 103           H        ALA 103   4.152  23.651  18.032
    2    HA   ALA 103           HA       ALA 103   1.687  24.211  18.899
    3    HB1  ALA 103           HB1      ALA 103   0.810  23.359  16.652
    4    HB2  ALA 103           HB2      ALA 103   2.464  22.833  16.334
    5    HB3  ALA 103           HB3      ALA 103   2.115  24.544  16.595

  No H/Q in entry =           5
  In of MODEL    2
    1    H1   ALA   1           H3       ALA   1  10.774 -20.272  -6.233
    2    H2   ALA   1           H2       ALA   1   9.821 -20.487  -7.625
    3    H3   ALA   1           H1       ALA   1   9.379 -21.234  -6.164
    4    HA   ALA   1           HA       ALA   1  10.435 -23.037  -6.893
    5    HB1  ALA   1           HB1      ALA   1  10.544 -22.681  -9.168
    6    HB2  ALA   1           HB2      ALA   1  12.268 -22.519  -8.828
    7    HB3  ALA   1           HB3      ALA   1  11.261 -21.079  -8.988

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLU   2           H        GLU   2  12.725 -23.973  -6.933
    2    HA   GLU   2           HA       GLU   2  14.091 -23.879  -4.712
    3    HB2  GLU   2           HB2      GLU   2  15.464 -23.744  -7.402
    4    HB3  GLU   2           HB3      GLU   2  16.186 -24.348  -5.912
    5    HG2  GLU   2           HG2      GLU   2  15.184 -26.371  -6.156
    6    HG3  GLU   2           HG3      GLU   2  13.610 -25.636  -6.426

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLU   3           H        GLU   3  15.867 -22.008  -7.105
    2    HA   GLU   3           HA       GLU   3  16.996 -20.310  -5.141
    3    HB2  GLU   3           HB2      GLU   3  16.960 -20.313  -8.151
    4    HB3  GLU   3           HB3      GLU   3  17.692 -18.978  -7.261
    5    HG2  GLU   3           HG2      GLU   3  19.357 -20.341  -6.325
    6    HG3  GLU   3           HG3      GLU   3  18.421 -21.814  -6.550

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LEU   4           H        LEU   4  14.727 -19.481  -7.788
    2    HA   LEU   4           HA       LEU   4  14.240 -16.874  -7.185
    3    HB2  LEU   4           HB2      LEU   4  12.082 -18.863  -7.926
    4    HB3  LEU   4           HB3      LEU   4  11.998 -17.115  -8.128
    5    HG   LEU   4           HG       LEU   4  13.983 -18.968  -9.485
    6   HD13  LEU   4          HD11      LEU   4  12.693 -18.831 -11.404
    7   HD12  LEU   4          HD12      LEU   4  11.972 -17.289 -10.944
    8   HD11  LEU   4          HD13      LEU   4  11.423 -18.782 -10.183
    9   HD23  LEU   4          HD21      LEU   4  14.314 -16.723 -10.838
   10   HD22  LEU   4          HD22      LEU   4  15.166 -16.958  -9.312
   11   HD21  LEU   4          HD23      LEU   4  13.707 -15.971  -9.363

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLU   5           H        GLU   5  12.761 -19.664  -5.548
    2    HA   GLU   5           HA       GLU   5  11.063 -18.100  -3.858
    3    HB2  GLU   5           HB2      GLU   5  10.671 -20.489  -4.387
    4    HB3  GLU   5           HB3      GLU   5  12.086 -20.904  -3.418
    5    HG2  GLU   5           HG2      GLU   5  10.159 -21.147  -1.996
    6    HG3  GLU   5           HG3      GLU   5  11.012 -19.691  -1.486

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLU   6           H        GLU   6  14.216 -19.659  -3.392
    2    HA   GLU   6           HA       GLU   6  14.545 -18.796  -0.693
    3    HB2  GLU   6           HB2      GLU   6  16.524 -19.725  -2.786
    4    HB3  GLU   6           HB3      GLU   6  16.962 -19.376  -1.112
    5    HG2  GLU   6           HG2      GLU   6  15.400 -21.073  -0.312
    6    HG3  GLU   6           HG3      GLU   6  14.848 -21.379  -1.959

  No H/Q in entry =           6
  In of MODEL    2
    1    H    VAL   7           H        VAL   7  15.324 -17.470  -3.840
    2    HA   VAL   7           HA       VAL   7  16.990 -15.331  -2.968
    3    HB   VAL   7           HB       VAL   7  15.303 -15.710  -5.456
    4   HG11  VAL   7          HG11      VAL   7  17.177 -13.483  -4.635
    5   HG13  VAL   7          HG12      VAL   7  15.538 -13.353  -5.269
    6   HG12  VAL   7          HG13      VAL   7  16.857 -13.848  -6.330
    7   HG21  VAL   7          HG21      VAL   7  17.416 -17.152  -4.870
    8   HG23  VAL   7          HG22      VAL   7  18.314 -15.686  -5.265
    9   HG22  VAL   7          HG23      VAL   7  17.291 -16.444  -6.482

  No H/Q in entry =           9
  In of MODEL    2
    1    H    VAL   8           H        VAL   8  13.503 -15.625  -3.547
    2    HA   VAL   8           HA       VAL   8  12.816 -12.920  -3.085
    3    HB   VAL   8           HB       VAL   8  11.219 -15.460  -2.656
    4   HG13  VAL   8          HG11      VAL   8  10.161 -13.813  -1.306
    5   HG12  VAL   8          HG12      VAL   8   9.265 -13.786  -2.825
    6   HG11  VAL   8          HG13      VAL   8  10.462 -12.537  -2.485
    7   HG23  VAL   8          HG21      VAL   8  10.538 -13.572  -4.848
    8   HG22  VAL   8          HG22      VAL   8  10.654 -15.329  -4.874
    9   HG21  VAL   8          HG23      VAL   8  12.109 -14.351  -5.027

  No H/Q in entry =           9
  In of MODEL    2
    1    H    MET   9           H        MET   9  13.088 -15.721  -0.898
    2    HA   MET   9           HA       MET   9  12.248 -14.451   1.464
    3    HB2  MET   9           HB2      MET   9  14.124 -16.737   0.906
    4    HB3  MET   9           HB3      MET   9  13.918 -16.129   2.549
    5    HG2  MET   9           HG2      MET   9  11.387 -16.370   2.135
    6    HG3  MET   9           HG3      MET   9  11.836 -17.342   0.732
    7    HE3  MET   9           HE1      MET   9  13.215 -20.515   1.888
    8    HE2  MET   9           HE2      MET   9  14.304 -19.185   1.508
    9    HE1  MET   9           HE3      MET   9  12.803 -19.370   0.606

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLY  10           H        GLY  10  15.441 -14.655  -0.070
    2    HA3  GLY  10           HA2      GLY  10  16.876 -13.220   1.907
    3    HA2  GLY  10           HA3      GLY  10  17.352 -13.385   0.217

  No H/Q in entry =           3
  In of MODEL    2
    1    H    LEU  11           H        LEU  11  15.183 -12.182  -1.039
    2    HA   LEU  11           HA       LEU  11  15.846  -9.432  -0.876
    3    HB2  LEU  11           HB2      LEU  11  13.498 -10.862  -2.125
    4    HB3  LEU  11           HB3      LEU  11  13.766  -9.125  -2.285
    5    HG   LEU  11           HG       LEU  11  15.815 -11.220  -3.056
    6   HD13  LEU  11          HD11      LEU  11  14.082 -11.603  -4.587
    7   HD12  LEU  11          HD12      LEU  11  15.081 -10.415  -5.423
    8   HD11  LEU  11          HD13      LEU  11  13.599  -9.906  -4.615
    9   HD22  LEU  11          HD21      LEU  11  17.029  -9.246  -2.825
   10   HD21  LEU  11          HD22      LEU  11  15.649  -8.221  -3.215
   11   HD23  LEU  11          HD23      LEU  11  16.496  -9.085  -4.497

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  12           H        ILE  12  13.083 -11.277   0.376
    2    HA   ILE  12           HA       ILE  12  11.665  -9.063   1.422
    3    HB   ILE  12           HB       ILE  12  11.719 -11.942   2.378
    4   HG12  ILE  12          HG12      ILE  12  11.045 -11.321  -0.077
    5   HG13  ILE  12          HG13      ILE  12  10.020 -12.416   0.831
    6   HG23  ILE  12          HG21      ILE  12  10.745 -10.556   4.105
    7   HG22  ILE  12          HG22      ILE  12   9.422 -11.371   3.272
    8   HG21  ILE  12          HG23      ILE  12   9.775  -9.680   2.922
    9   HD12  ILE  12          HD11      ILE  12   8.773 -10.637  -0.416
   10   HD11  ILE  12          HD12      ILE  12   9.576  -9.430   0.587
   11   HD13  ILE  12          HD13      ILE  12   8.489 -10.595   1.315

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  13           H        ILE  13  14.067 -11.245   2.848
    2    HA   ILE  13           HA       ILE  13  14.075 -10.061   5.426
    3    HB   ILE  13           HB       ILE  13  16.160 -11.617   3.877
    4   HG12  ILE  13          HG12      ILE  13  13.880 -12.597   4.711
    5   HG13  ILE  13          HG13      ILE  13  15.361 -13.513   4.970
    6   HG23  ILE  13          HG21      ILE  13  17.428 -10.345   5.458
    7   HG22  ILE  13          HG22      ILE  13  17.246 -11.945   6.166
    8   HG21  ILE  13          HG23      ILE  13  16.245 -10.610   6.738
    9   HD12  ILE  13          HD11      ILE  13  13.697 -13.198   6.983
   10   HD11  ILE  13          HD12      ILE  13  14.397 -11.585   7.070
   11   HD13  ILE  13          HD13      ILE  13  15.425 -13.000   7.262

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ASN  14           H        ASN  14  16.043  -9.518   2.520
    2    HA   ASN  14           HA       ASN  14  17.762  -7.558   3.590
    3    HB2  ASN  14           HB2      ASN  14  17.768  -8.829   1.277
    4    HB3  ASN  14           HB3      ASN  14  16.865  -7.421   0.731
    5   HD21  ASN  14          HD21      ASN  14  19.317  -7.739  -0.437
    6   HD22  ASN  14          HD22      ASN  14  20.445  -6.644   0.196

  No H/Q in entry =           6
  In of MODEL    2
    1    H    SER  15           H        SER  15  14.660  -7.244   1.876
    2    HA   SER  15           HA       SER  15  14.520  -4.425   1.926
    3    HB2  SER  15           HB2      SER  15  12.195  -4.695   1.413
    4    HB3  SER  15           HB3      SER  15  13.009  -6.057   0.653
    5    HG   SER  15           HG       SER  15  11.817  -7.290   1.843

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLY  16           H        GLY  16  13.435  -6.891   4.227
    2    HA3  GLY  16           HA2      GLY  16  12.183  -5.152   6.073
    3    HA2  GLY  16           HA3      GLY  16  12.812  -6.753   6.442

  No H/Q in entry =           3
  In of MODEL    2
    1    H    GLN  17           H        GLN  17  15.523  -6.393   5.868
    2    HA   GLN  17           HA       GLN  17  16.451  -5.158   8.253
    3    HB2  GLN  17           HB2      GLN  17  17.898  -5.998   5.726
    4    HB3  GLN  17           HB3      GLN  17  18.726  -5.388   7.160
    5    HG2  GLN  17           HG2      GLN  17  17.776  -7.197   8.510
    6    HG3  GLN  17           HG3      GLN  17  16.874  -7.789   7.117
    7   HE21  GLN  17          HE21      GLN  17  18.348  -9.781   7.885
    8   HE22  GLN  17          HE22      GLN  17  19.836  -9.913   7.079

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ALA  18           H        ALA  18  16.274  -4.088   4.890
    2    HA   ALA  18           HA       ALA  18  17.683  -1.680   5.123
    3    HB2  ALA  18           HB1      ALA  18  16.593  -2.911   3.049
    4    HB3  ALA  18           HB2      ALA  18  16.839  -1.165   3.032
    5    HB1  ALA  18           HB3      ALA  18  15.244  -1.827   3.392

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ARG  19           H        ARG  19  14.187  -2.305   5.495
    2    HA   ARG  19           HA       ARG  19  13.486   0.339   6.201
    3    HB2  ARG  19           HB2      ARG  19  11.828  -1.431   5.605
    4    HB3  ARG  19           HB3      ARG  19  12.167  -2.223   7.146
    5    HG2  ARG  19           HG2      ARG  19  11.427  -0.237   8.377
    6    HG3  ARG  19           HG3      ARG  19  11.178   0.634   6.865
    7    HD2  ARG  19           HD2      ARG  19   9.039  -0.184   7.671
    8    HD3  ARG  19           HD3      ARG  19   9.478  -1.062   6.199
    9    HE   ARG  19           HE       ARG  19  10.438  -2.590   8.314
   10   HH21  ARG  19          HH11      ARG  19   9.200  -4.242   9.247
   11   HH22  ARG  19          HH12      ARG  19   7.481  -4.233   9.064
   12   HH11  ARG  19          HH21      ARG  19   7.438  -1.331   7.195
   13   HH12  ARG  19          HH22      ARG  19   6.484  -2.586   7.898

  No H/Q in entry =          13
  In of MODEL    2
    1    H    SER  20           H        SER  20  14.360  -2.478   8.171
    2    HA   SER  20           HA       SER  20  14.046  -1.378  10.704
    3    HB2  SER  20           HB2      SER  20  14.713  -3.786  10.034
    4    HB3  SER  20           HB3      SER  20  16.366  -3.177  10.030
    5    HG   SER  20           HG       SER  20  14.537  -3.430  12.148

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU  21           H        LEU  21  16.904  -1.289   8.589
    2    HA   LEU  21           HA       LEU  21  18.550   0.218  10.337
    3    HB2  LEU  21           HB2      LEU  21  18.554  -0.060   7.323
    4    HB3  LEU  21           HB3      LEU  21  19.792   0.816   8.219
    5    HG   LEU  21           HG       LEU  21  19.081  -2.082   8.759
    6   HD12  LEU  21          HD11      LEU  21  21.355  -2.443   7.580
    7   HD11  LEU  21          HD12      LEU  21  21.113  -0.830   6.910
    8   HD13  LEU  21          HD13      LEU  21  19.954  -2.111   6.561
    9   HD23  LEU  21          HD21      LEU  21  21.555  -1.890   9.674
   10   HD22  LEU  21          HD22      LEU  21  20.231  -1.312  10.677
   11   HD21  LEU  21          HD23      LEU  21  21.199  -0.169   9.762

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ALA  22           H        ALA  22  16.295   1.158   7.762
    2    HA   ALA  22           HA       ALA  22  16.804   3.922   7.775
    3    HB3  ALA  22           HB1      ALA  22  15.427   2.662   6.089
    4    HB2  ALA  22           HB2      ALA  22  14.700   4.168   6.648
    5    HB1  ALA  22           HB3      ALA  22  14.121   2.624   7.274

  No H/Q in entry =           5
  In of MODEL    2
    1    H    TYR  23           H        TYR  23  14.313   2.083   9.595
    2    HA   TYR  23           HA       TYR  23  13.316   4.312  11.034
    3    HB2  TYR  23           HB2      TYR  23  12.102   2.186  11.008
    4    HB3  TYR  23           HB3      TYR  23  13.437   1.390  11.843
    5    HD1  TYR  23           HD1      TYR  23  10.903   4.108  12.187
    6    HD2  TYR  23           HD2      TYR  23  13.617   1.456  14.200
    7    HE1  TYR  23           HE1      TYR  23   9.953   4.795  14.374
    8    HE2  TYR  23           HE2      TYR  23  12.666   2.141  16.385
    9    HH   TYR  23           HH       TYR  23   9.982   4.485  16.567

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ALA  24           H        ALA  24  15.980   2.065  11.694
    2    HA   ALA  24           HA       ALA  24  16.621   3.072  14.261
    3    HB1  ALA  24           HB1      ALA  24  17.997   1.292  14.109
    4    HB3  ALA  24           HB2      ALA  24  19.023   2.222  13.016
    5    HB2  ALA  24           HB3      ALA  24  17.744   1.200  12.367

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA  25           H        ALA  25  17.593   4.005  10.987
    2    HA   ALA  25           HA       ALA  25  19.513   5.960  11.644
    3    HB1  ALA  25           HB1      ALA  25  18.824   5.001   9.325
    4    HB3  ALA  25           HB2      ALA  25  19.307   6.694   9.419
    5    HB2  ALA  25           HB3      ALA  25  17.598   6.269   9.338

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU  26           H        LEU  26  15.999   6.153  11.256
    2    HA   LEU  26           HA       LEU  26  15.744   8.933  11.701
    3    HB2  LEU  26           HB2      LEU  26  13.902   7.678  10.761
    4    HB3  LEU  26           HB3      LEU  26  13.811   6.652  12.188
    5    HG   LEU  26           HG       LEU  26  13.175   8.606  13.560
    6   HD12  LEU  26          HD11      LEU  26  12.504  10.698  12.227
    7   HD11  LEU  26          HD12      LEU  26  13.500  10.052  10.925
    8   HD13  LEU  26          HD13      LEU  26  14.230  10.447  12.482
    9   HD21  LEU  26          HD21      LEU  26  11.521   8.272  11.039
   10   HD23  LEU  26          HD22      LEU  26  10.943   8.967  12.550
   11   HD22  LEU  26          HD23      LEU  26  11.412   7.270  12.486

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LYS  27           H        LYS  27  15.646   6.156  13.898
    2    HA   LYS  27           HA       LYS  27  15.023   7.520  16.259
    3    HB2  LYS  27           HB2      LYS  27  15.077   5.045  15.999
    4    HB3  LYS  27           HB3      LYS  27  16.840   5.114  15.968
    5    HG2  LYS  27           HG2      LYS  27  16.864   6.104  18.217
    6    HG3  LYS  27           HG3      LYS  27  15.097   6.106  18.249
    7    HD2  LYS  27           HD2      LYS  27  15.096   3.638  18.016
    8    HD3  LYS  27           HD3      LYS  27  16.861   3.644  18.018
    9    HE2  LYS  27           HE2      LYS  27  16.869   4.637  20.273
   10    HE3  LYS  27           HE3      LYS  27  15.103   4.661  20.274
   11    HZ3  LYS  27           HZ1      LYS  27  15.900   2.718  21.434
   12    HZ2  LYS  27           HZ2      LYS  27  16.831   2.245  20.091
   13    HZ1  LYS  27           HZ3      LYS  27  15.133   2.234  19.999

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLN  28           H        GLN  28  18.157   6.964  14.691
    2    HA   GLN  28           HA       GLN  28  19.816   8.065  16.692
    3    HB2  GLN  28           HB2      GLN  28  20.125   8.014  13.679
    4    HB3  GLN  28           HB3      GLN  28  21.399   8.504  14.796
    5    HG2  GLN  28           HG2      GLN  28  20.009   5.811  14.841
    6    HG3  GLN  28           HG3      GLN  28  21.592   6.112  14.126
    7   HE21  GLN  28          HE21      GLN  28  20.335   4.781  16.820
    8   HE22  GLN  28          HE22      GLN  28  21.507   5.226  17.963

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ALA  29           H        ALA  29  18.072   9.529  13.985
    2    HA   ALA  29           HA       ALA  29  19.047  12.158  14.241
    3    HB2  ALA  29           HB1      ALA  29  17.354  12.778  12.756
    4    HB1  ALA  29           HB2      ALA  29  16.215  11.597  13.401
    5    HB3  ALA  29           HB3      ALA  29  17.557  11.064  12.388

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LYS  30           H        LYS  30  16.272  10.538  15.744
    2    HA   LYS  30           HA       LYS  30  15.230  12.786  17.090
    3    HB2  LYS  30           HB2      LYS  30  15.136   9.845  17.798
    4    HB3  LYS  30           HB3      LYS  30  14.254  11.090  18.683
    5    HG2  LYS  30           HG2      LYS  30  13.140  11.764  16.555
    6    HG3  LYS  30           HG3      LYS  30  13.961  10.432  15.736
    7    HD2  LYS  30           HD2      LYS  30  12.890   8.819  17.260
    8    HD3  LYS  30           HD3      LYS  30  12.079  10.139  18.103
    9    HE2  LYS  30           HE2      LYS  30  10.921  10.760  16.001
   10    HE3  LYS  30           HE3      LYS  30  11.713   9.411  15.177
   11    HZ2  LYS  30           HZ1      LYS  30   9.401   8.985  16.041
   12    HZ1  LYS  30           HZ2      LYS  30  10.057   9.045  17.613
   13    HZ3  LYS  30           HZ3      LYS  30  10.582   7.863  16.508

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLN  31           H        GLN  31  17.902  10.638  17.850
    2    HA   GLN  31           HA       GLN  31  18.202  11.658  20.545
    3    HB2  GLN  31           HB2      GLN  31  20.248  10.101  18.958
    4    HB3  GLN  31           HB3      GLN  31  20.100  10.227  20.711
    5    HG2  GLN  31           HG2      GLN  31  17.600   9.254  19.925
    6    HG3  GLN  31           HG3      GLN  31  18.716   8.417  18.854
    7   HE21  GLN  31          HE21      GLN  31  17.165   7.262  21.121
    8   HE22  GLN  31          HE22      GLN  31  18.318   6.612  22.181

  No H/Q in entry =           8
  In of MODEL    2
    1    H    GLY  32           H        GLY  32  18.733  12.975  17.580
    2    HA3  GLY  32           HA2      GLY  32  19.706  15.027  17.070
    3    HA2  GLY  32           HA3      GLY  32  20.451  15.040  18.664

  No H/Q in entry =           3
  In of MODEL    2
    1    H    ASP  33           H        ASP  33  20.908  12.148  16.894
    2    HA   ASP  33           HA       ASP  33  23.732  12.844  16.448
    3    HB2  ASP  33           HB2      ASP  33  22.242  10.217  16.557
    4    HB3  ASP  33           HB3      ASP  33  23.931  10.346  16.074

  No H/Q in entry =           4
  In of MODEL    2
    1    H    PHE  34           H        PHE  34  23.254  14.161  14.561
    2    HA   PHE  34           HA       PHE  34  21.929  13.163  12.265
    3    HB2  PHE  34           HB2      PHE  34  24.042  15.314  12.508
    4    HB3  PHE  34           HB3      PHE  34  23.069  15.014  11.069
    5    HD1  PHE  34           HD1      PHE  34  23.284  16.954  13.982
    6    HD2  PHE  34           HD2      PHE  34  20.440  14.813  11.578
    7    HE1  PHE  34           HE1      PHE  34  21.450  18.339  14.913
    8    HE2  PHE  34           HE2      PHE  34  18.610  16.198  12.513
    9    HZ   PHE  34           HZ       PHE  34  19.119  17.962  14.176

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ALA  35           H        ALA  35  25.297  13.003  13.298
    2    HA   ALA  35           HA       ALA  35  26.427  12.188  10.850
    3    HB3  ALA  35           HB1      ALA  35  28.104  11.034  12.584
    4    HB2  ALA  35           HB2      ALA  35  27.224  12.054  13.722
    5    HB1  ALA  35           HB3      ALA  35  28.065  12.782  12.354

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA  36           H        ALA  36  25.307  10.227  13.611
    2    HA   ALA  36           HA       ALA  36  25.821   7.741  12.342
    3    HB2  ALA  36           HB1      ALA  36  25.381   6.995  14.416
    4    HB3  ALA  36           HB2      ALA  36  23.690   7.475  14.253
    5    HB1  ALA  36           HB3      ALA  36  24.877   8.618  14.882

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA  37           H        ALA  37  22.981   9.844  12.452
    2    HA   ALA  37           HA       ALA  37  21.148   8.057  11.266
    3    HB3  ALA  37           HB1      ALA  37  21.346  11.022  11.555
    4    HB1  ALA  37           HB2      ALA  37  20.040   9.933  12.020
    5    HB2  ALA  37           HB3      ALA  37  20.237  10.404  10.331

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LYS  38           H        LYS  38  23.237  10.534   9.798
    2    HA   LYS  38           HA       LYS  38  22.621  10.097   7.117
    3    HB2  LYS  38           HB2      LYS  38  24.406  11.672   8.573
    4    HB3  LYS  38           HB3      LYS  38  25.455  10.690   7.556
    5    HG2  LYS  38           HG2      LYS  38  24.299  11.448   5.551
    6    HG3  LYS  38           HG3      LYS  38  23.089  12.293   6.522
    7    HD2  LYS  38           HD2      LYS  38  24.665  13.907   7.283
    8    HD3  LYS  38           HD3      LYS  38  26.037  12.932   6.759
    9    HE2  LYS  38           HE2      LYS  38  25.675  14.798   5.202
   10    HE3  LYS  38           HE3      LYS  38  25.360  13.256   4.398
   11    HZ3  LYS  38           HZ1      LYS  38  23.160  13.681   4.251
   12    HZ2  LYS  38           HZ2      LYS  38  23.667  15.301   4.340
   13    HZ1  LYS  38           HZ3      LYS  38  23.090  14.514   5.729

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ALA  39           H        ALA  39  25.135   8.525   9.094
    2    HA   ALA  39           HA       ALA  39  26.234   6.943   7.034
    3    HB2  ALA  39           HB1      ALA  39  26.133   5.983   9.879
    4    HB1  ALA  39           HB2      ALA  39  27.075   7.417   9.467
    5    HB3  ALA  39           HB3      ALA  39  27.447   5.869   8.709

  No H/Q in entry =           5
  In of MODEL    2
    1    H    MET  40           H        MET  40  23.610   6.307   9.315
    2    HA   MET  40           HA       MET  40  23.198   3.596   8.581
    3    HB2  MET  40           HB2      MET  40  21.352   5.625   9.857
    4    HB3  MET  40           HB3      MET  40  20.963   3.912   9.682
    5    HG2  MET  40           HG2      MET  40  23.494   4.879  11.040
    6    HG3  MET  40           HG3      MET  40  21.996   4.590  11.923
    7    HE3  MET  40           HE1      MET  40  21.466   0.952  12.100
    8    HE2  MET  40           HE2      MET  40  20.590   2.245  11.284
    9    HE1  MET  40           HE3      MET  40  21.317   2.542  12.862

  No H/Q in entry =           9
  In of MODEL    2
    1    H    MET  41           H        MET  41  21.763   6.634   7.379
    2    HA   MET  41           HA       MET  41  19.830   5.418   5.695
    3    HB2  MET  41           HB2      MET  41  21.289   8.022   5.188
    4    HB3  MET  41           HB3      MET  41  19.771   7.512   4.460
    5    HG2  MET  41           HG2      MET  41  19.009   7.320   7.006
    6    HG3  MET  41           HG3      MET  41  20.305   8.491   7.235
    7    HE2  MET  41           HE1      MET  41  19.754   9.768   3.893
    8    HE1  MET  41           HE2      MET  41  20.696  10.219   5.311
    9    HE3  MET  41           HE3      MET  41  19.417  11.285   4.736

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ASP  42           H        ASP  42  23.197   6.373   5.165
    2    HA   ASP  42           HA       ASP  42  23.313   5.896   2.409
    3    HB2  ASP  42           HB2      ASP  42  25.042   6.913   4.189
    4    HB3  ASP  42           HB3      ASP  42  25.716   5.294   4.068

  No H/Q in entry =           4
  In of MODEL    2
    1    H    GLN  43           H        GLN  43  24.039   3.752   5.137
    2    HA   GLN  43           HA       GLN  43  24.737   1.499   3.563
    3    HB2  GLN  43           HB2      GLN  43  23.693   1.677   6.399
    4    HB3  GLN  43           HB3      GLN  43  24.292   0.192   5.650
    5    HG2  GLN  43           HG2      GLN  43  26.446   1.424   5.153
    6    HG3  GLN  43           HG3      GLN  43  25.843   2.747   6.146
    7   HE21  GLN  43          HE21      GLN  43  28.079   1.797   7.200
    8   HE22  GLN  43          HE22      GLN  43  27.806   0.714   8.476

  No H/Q in entry =           8
  In of MODEL    2
    1    H    SER  44           H        SER  44  21.660   2.605   4.924
    2    HA   SER  44           HA       SER  44  20.119   0.345   4.244
    3    HB2  SER  44           HB2      SER  44  19.644   2.871   5.383
    4    HB3  SER  44           HB3      SER  44  18.620   2.816   3.950
    5    HG   SER  44           HG       SER  44  17.524   1.864   5.666

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ARG  45           H        ARG  45  20.845   3.314   2.440
    2    HA   ARG  45           HA       ARG  45  19.342   2.810   0.125
    3    HB2  ARG  45           HB2      ARG  45  20.460   4.958   0.714
    4    HB3  ARG  45           HB3      ARG  45  22.015   4.218   0.341
    5    HG2  ARG  45           HG2      ARG  45  21.252   3.802  -1.978
    6    HG3  ARG  45           HG3      ARG  45  19.709   4.565  -1.604
    7    HD2  ARG  45           HD2      ARG  45  20.935   6.674  -1.014
    8    HD3  ARG  45           HD3      ARG  45  22.443   5.914  -1.571
    9    HE   ARG  45           HE       ARG  45  20.529   5.655  -3.620
   10   HH21  ARG  45          HH11      ARG  45  20.521   7.021  -5.385
   11   HH22  ARG  45          HH12      ARG  45  21.263   8.579  -5.278
   12   HH11  ARG  45          HH21      ARG  45  22.224   8.172  -1.985
   13   HH12  ARG  45          HH22      ARG  45  22.225   9.230  -3.350

  No H/Q in entry =          13
  In of MODEL    2
    1    H    MET  46           H        MET  46  22.709   1.969   0.897
    2    HA   MET  46           HA       MET  46  23.343   0.778  -1.581
    3    HB2  MET  46           HB2      MET  46  24.434   0.473   1.217
    4    HB3  MET  46           HB3      MET  46  25.104  -0.426  -0.147
    5    HG2  MET  46           HG2      MET  46  25.555   1.667  -1.342
    6    HG3  MET  46           HG3      MET  46  24.817   2.593  -0.040
    7    HE3  MET  46           HE1      MET  46  27.420  -0.600   0.303
    8    HE2  MET  46           HE2      MET  46  28.800   0.396  -0.147
    9    HE1  MET  46           HE3      MET  46  27.423   0.267  -1.240

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ALA  47           H        ALA  47  21.952  -0.563   1.388
    2    HA   ALA  47           HA       ALA  47  21.928  -3.278   0.589
    3    HB2  ALA  47           HB1      ALA  47  21.530  -2.817   2.891
    4    HB3  ALA  47           HB2      ALA  47  20.003  -3.435   2.262
    5    HB1  ALA  47           HB3      ALA  47  20.215  -1.701   2.519

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU  48           H        LEU  48  19.555  -0.672   0.213
    2    HA   LEU  48           HA       LEU  48  17.532  -2.226  -1.049
    3    HB2  LEU  48           HB2      LEU  48  18.161   0.734  -1.164
    4    HB3  LEU  48           HB3      LEU  48  16.700   0.009  -1.839
    5    HG   LEU  48           HG       LEU  48  17.538  -0.280   1.055
    6   HD13  LEU  48          HD11      LEU  48  17.101   2.017   0.862
    7   HD12  LEU  48          HD12      LEU  48  15.545   1.357   1.362
    8   HD11  LEU  48          HD13      LEU  48  15.824   1.778  -0.328
    9   HD22  LEU  48          HD21      LEU  48  16.026  -2.008   0.668
   10   HD21  LEU  48          HD22      LEU  48  15.153  -1.115  -0.577
   11   HD23  LEU  48          HD23      LEU  48  14.926  -0.709   1.124

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ASN  49           H        ASN  49  20.211  -0.277  -2.266
    2    HA   ASN  49           HA       ASN  49  19.577  -0.371  -4.994
    3    HB2  ASN  49           HB2      ASN  49  21.240   1.159  -4.053
    4    HB3  ASN  49           HB3      ASN  49  22.280  -0.196  -3.630
    5   HD21  ASN  49          HD21      ASN  49  23.230   1.855  -5.316
    6   HD22  ASN  49          HD22      ASN  49  23.431   1.237  -6.883

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLU  50           H        GLU  50  21.568  -2.545  -3.015
    2    HA   GLU  50           HA       GLU  50  22.297  -4.299  -5.133
    3    HB2  GLU  50           HB2      GLU  50  23.481  -4.260  -2.960
    4    HB3  GLU  50           HB3      GLU  50  22.039  -4.898  -2.171
    5    HG2  GLU  50           HG2      GLU  50  22.154  -6.933  -3.525
    6    HG3  GLU  50           HG3      GLU  50  23.530  -6.291  -4.419

  No H/Q in entry =           6
  In of MODEL    2
    1    H    ALA  51           H        ALA  51  19.626  -4.251  -2.823
    2    HA   ALA  51           HA       ALA  51  18.485  -6.735  -3.582
    3    HB3  ALA  51           HB1      ALA  51  16.879  -6.240  -2.037
    4    HB1  ALA  51           HB2      ALA  51  16.656  -4.596  -2.641
    5    HB2  ALA  51           HB3      ALA  51  18.012  -4.969  -1.576

  No H/Q in entry =           5
  In of MODEL    2
    1    H    HIS  52           H        HIS  52  17.878  -3.395  -4.628
    2    HA   HIS  52           HA       HIS  52  15.779  -3.942  -6.439
    3    HB2  HIS  52           HB2      HIS  52  16.395  -1.670  -5.644
    4    HB3  HIS  52           HB3      HIS  52  17.867  -1.756  -6.611
    5    HD1  HIS  52           HD1      HIS  52  17.506  -2.003  -9.263
    6    HD2  HIS  52           HD2      HIS  52  14.116  -0.941  -7.082
    7    HE1  HIS  52           HE1      HIS  52  15.825  -1.117 -10.937
    8    HE2  HIS  52           HE2      HIS  52  13.754  -0.465  -9.622

  No H/Q in entry =           8
  In of MODEL    2
    1    H    LEU  53           H        LEU  53  19.300  -3.920  -6.851
    2    HA   LEU  53           HA       LEU  53  19.377  -4.241  -9.650
    3    HB2  LEU  53           HB2      LEU  53  21.303  -4.980  -7.462
    4    HB3  LEU  53           HB3      LEU  53  21.633  -5.371  -9.147
    5    HG   LEU  53           HG       LEU  53  20.929  -2.562  -8.241
    6   HD12  LEU  53          HD11      LEU  53  23.451  -2.194  -8.518
    7   HD11  LEU  53          HD12      LEU  53  23.608  -3.949  -8.436
    8   HD13  LEU  53          HD13      LEU  53  22.945  -3.060  -7.070
    9   HD21  LEU  53          HD21      LEU  53  22.044  -3.799 -10.764
   10   HD23  LEU  53          HD22      LEU  53  22.362  -2.111 -10.379
   11   HD22  LEU  53          HD23      LEU  53  20.713  -2.660 -10.611

  No H/Q in entry =          11
  In of MODEL    2
    1    H    VAL  54           H        VAL  54  19.269  -6.622  -7.019
    2    HA   VAL  54           HA       VAL  54  19.422  -8.920  -8.673
    3    HB   VAL  54           HB       VAL  54  18.248  -8.500  -5.913
    4   HG12  VAL  54          HG11      VAL  54  18.595 -11.114  -5.901
    5   HG11  VAL  54          HG12      VAL  54  18.418 -10.952  -7.648
    6   HG13  VAL  54          HG13      VAL  54  17.119 -10.430  -6.578
    7   HG22  VAL  54          HG21      VAL  54  20.560  -8.268  -5.677
    8   HG21  VAL  54          HG22      VAL  54  20.915  -9.360  -7.014
    9   HG23  VAL  54          HG23      VAL  54  20.381 -10.008  -5.463

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLN  55           H        GLN  55  16.669  -7.038  -7.411
    2    HA   GLN  55           HA       GLN  55  14.670  -8.723  -8.492
    3    HB2  GLN  55           HB2      GLN  55  13.898  -7.200  -6.874
    4    HB3  GLN  55           HB3      GLN  55  14.683  -5.826  -7.648
    5    HG2  GLN  55           HG2      GLN  55  12.965  -5.521  -9.149
    6    HG3  GLN  55           HG3      GLN  55  12.660  -7.245  -9.317
    7   HE21  GLN  55          HE21      GLN  55  10.653  -7.810  -8.522
    8   HE22  GLN  55          HE22      GLN  55   9.865  -7.060  -7.220

  No H/Q in entry =           8
  In of MODEL    2
    1    H    THR  56           H        THR  56  16.391  -5.910  -9.848
    2    HA   THR  56           HA       THR  56  14.964  -5.567 -12.206
    3    HB   THR  56           HB       THR  56  17.961  -5.383 -11.809
    4    HG1  THR  56           HG1      THR  56  16.288  -4.056 -10.591
    5   HG21  THR  56          HG21      THR  56  16.148  -4.339 -13.997
    6   HG23  THR  56          HG22      THR  56  17.462  -5.500 -14.173
    7   HG22  THR  56          HG23      THR  56  17.819  -3.821 -13.767

  No H/Q in entry =           7
  In of MODEL    2
    1    H    LYS  57           H        LYS  57  17.631  -7.838 -11.574
    2    HA   LYS  57           HA       LYS  57  17.658  -9.039 -14.149
    3    HB2  LYS  57           HB2      LYS  57  19.442  -9.271 -12.396
    4    HB3  LYS  57           HB3      LYS  57  18.341 -10.271 -11.458
    5    HG2  LYS  57           HG2      LYS  57  18.266 -11.932 -13.245
    6    HG3  LYS  57           HG3      LYS  57  19.282 -10.922 -14.266
    7    HD2  LYS  57           HD2      LYS  57  20.755 -12.534 -13.313
    8    HD3  LYS  57           HD3      LYS  57  21.037 -11.055 -12.397
    9    HE2  LYS  57           HE2      LYS  57  19.740 -11.836 -10.543
   10    HE3  LYS  57           HE3      LYS  57  19.067 -13.173 -11.473
   11    HZ1  LYS  57           HZ1      LYS  57  21.690 -13.628 -11.700
   12    HZ3  LYS  57           HZ2      LYS  57  20.701 -14.323 -10.508
   13    HZ2  LYS  57           HZ3      LYS  57  21.625 -12.944 -10.150

  No H/Q in entry =          13
  In of MODEL    2
    1    H    LEU  58           H        LEU  58  15.867  -9.716 -11.182
    2    HA   LEU  58           HA       LEU  58  14.674 -12.103 -12.117
    3    HB2  LEU  58           HB2      LEU  58  13.848 -10.200  -9.931
    4    HB3  LEU  58           HB3      LEU  58  13.058 -11.746 -10.248
    5    HG   LEU  58           HG       LEU  58  16.025 -11.438  -9.677
    6   HD11  LEU  58          HD11      LEU  58  13.648 -11.874  -7.897
    7   HD13  LEU  58          HD12      LEU  58  15.090 -10.896  -7.629
    8   HD12  LEU  58          HD13      LEU  58  15.179 -12.651  -7.488
    9   HD22  LEU  58          HD21      LEU  58  15.933 -13.503 -10.700
   10   HD21  LEU  58          HD22      LEU  58  14.219 -13.729 -10.348
   11   HD23  LEU  58          HD23      LEU  58  15.424 -14.014  -9.091

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  59           H        ILE  59  13.974  -8.775 -12.812
    2    HA   ILE  59           HA       ILE  59  11.270  -9.452 -13.766
    3    HB   ILE  59           HB       ILE  59  12.046  -7.159 -12.563
    4   HG12  ILE  59          HG12      ILE  59  10.153  -7.055 -14.920
    5   HG13  ILE  59          HG13      ILE  59   9.732  -7.836 -13.418
    6   HG23  ILE  59          HG21      ILE  59  12.597  -5.431 -14.081
    7   HG22  ILE  59          HG22      ILE  59  12.142  -6.379 -15.479
    8   HG21  ILE  59          HG23      ILE  59  13.617  -6.754 -14.593
    9   HD13  ILE  59          HD11      ILE  59   8.917  -5.533 -13.395
   10   HD12  ILE  59          HD12      ILE  59  10.545  -4.945 -13.731
   11   HD11  ILE  59          HD13      ILE  59  10.191  -5.730 -12.190

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLU  60           H        GLU  60  14.472  -8.573 -15.009
    2    HA   GLU  60           HA       GLU  60  13.704  -8.187 -17.722
    3    HB2  GLU  60           HB2      GLU  60  15.844  -7.379 -17.102
    4    HB3  GLU  60           HB3      GLU  60  16.308  -8.919 -16.383
    5    HG2  GLU  60           HG2      GLU  60  17.357  -8.480 -18.638
    6    HG3  GLU  60           HG3      GLU  60  16.426  -9.975 -18.558

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLY  61           H        GLY  61  14.699 -11.054 -15.894
    2    HA3  GLY  61           HA2      GLY  61  14.188 -12.713 -18.294
    3    HA2  GLY  61           HA3      GLY  61  15.217 -13.181 -16.944

  No H/Q in entry =           3
  In of MODEL    2
    1    H    ASP  62           H        ASP  62  12.079 -11.666 -16.598
    2    HA   ASP  62           HA       ASP  62  11.165 -13.658 -14.791
    3    HB2  ASP  62           HB2      ASP  62   9.074 -12.386 -14.811
    4    HB3  ASP  62           HB3      ASP  62  10.462 -11.315 -14.651

  No H/Q in entry =           4
  In of MODEL    2
    1    H    ALA  63           H        ALA  63  11.570 -15.532 -16.392
    2    HA   ALA  63           HA       ALA  63   9.822 -15.949 -18.609
    3    HB3  ALA  63           HB1      ALA  63  10.541 -18.293 -18.460
    4    HB2  ALA  63           HB2      ALA  63  11.228 -17.991 -16.865
    5    HB1  ALA  63           HB3      ALA  63  11.922 -17.211 -18.287

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLY  64           H        GLY  64   9.658 -16.771 -15.188
    2    HA3  GLY  64           HA2      GLY  64   7.891 -17.339 -13.834
    3    HA2  GLY  64           HA3      GLY  64   6.815 -16.851 -15.136

  No H/Q in entry =           3
  In of MODEL    2
    1    H    GLU  65           H        GLU  65   5.642 -18.802 -14.139
    2    HA   GLU  65           HA       GLU  65   6.642 -21.407 -14.508
    3    HB2  GLU  65           HB2      GLU  65   3.794 -20.424 -14.348
    4    HB3  GLU  65           HB3      GLU  65   4.271 -22.120 -14.286
    5    HG2  GLU  65           HG2      GLU  65   5.262 -19.985 -12.379
    6    HG3  GLU  65           HG3      GLU  65   3.970 -21.128 -12.016

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLY  66           H        GLY  66   4.698 -19.370 -16.565
    2    HA3  GLY  66           HA2      GLY  66   4.872 -21.313 -18.770
    3    HA2  GLY  66           HA3      GLY  66   3.616 -20.104 -18.604

  No H/Q in entry =           3
  In of MODEL    2
    1    H    LYS  67           H        LYS  67   4.455 -19.989 -20.943
    2    HA   LYS  67           HA       LYS  67   6.906 -18.810 -21.578
    3    HB2  LYS  67           HB2      LYS  67   4.313 -18.677 -23.122
    4    HB3  LYS  67           HB3      LYS  67   5.937 -18.422 -23.774
    5    HG2  LYS  67           HG2      LYS  67   5.085 -20.960 -22.355
    6    HG3  LYS  67           HG3      LYS  67   5.044 -20.767 -24.105
    7    HD2  LYS  67           HD2      LYS  67   7.541 -20.068 -23.853
    8    HD3  LYS  67           HD3      LYS  67   7.431 -20.855 -22.276
    9    HE2  LYS  67           HE2      LYS  67   8.101 -22.629 -23.644
   10    HE3  LYS  67           HE3      LYS  67   6.349 -22.822 -23.629
   11    HZ1  LYS  67           HZ1      LYS  67   6.977 -21.028 -25.662
   12    HZ3  LYS  67           HZ2      LYS  67   6.357 -22.601 -25.812
   13    HZ2  LYS  67           HZ3      LYS  67   8.037 -22.343 -25.822

  No H/Q in entry =          13
  In of MODEL    2
    1    H    MET  68           H        MET  68   3.869 -17.145 -22.129
    2    HA   MET  68           HA       MET  68   4.955 -14.547 -22.156
    3    HB2  MET  68           HB2      MET  68   2.104 -15.486 -21.817
    4    HB3  MET  68           HB3      MET  68   2.587 -13.825 -22.165
    5    HG2  MET  68           HG2      MET  68   3.276 -16.212 -23.900
    6    HG3  MET  68           HG3      MET  68   1.961 -15.083 -24.224
    7    HE2  MET  68           HE1      MET  68   3.236 -12.109 -23.499
    8    HE1  MET  68           HE2      MET  68   2.045 -12.835 -24.575
    9    HE3  MET  68           HE3      MET  68   3.367 -11.886 -25.249

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LYS  69           H        LYS  69   3.294 -16.311 -19.530
    2    HA   LYS  69           HA       LYS  69   2.974 -14.088 -17.827
    3    HB2  LYS  69           HB2      LYS  69   3.019 -17.051 -17.274
    4    HB3  LYS  69           HB3      LYS  69   2.646 -15.844 -16.041
    5    HG2  LYS  69           HG2      LYS  69   0.822 -14.961 -17.444
    6    HG3  LYS  69           HG3      LYS  69   1.194 -16.159 -18.683
    7    HD2  LYS  69           HD2      LYS  69   0.677 -17.971 -17.101
    8    HD3  LYS  69           HD3      LYS  69   0.323 -16.782 -15.846
    9    HE2  LYS  69           HE2      LYS  69  -1.484 -15.844 -17.240
   10    HE3  LYS  69           HE3      LYS  69  -1.133 -17.033 -18.494
   11    HZ1  LYS  69           HZ1      LYS  69  -1.467 -18.707 -16.573
   12    HZ3  LYS  69           HZ2      LYS  69  -2.824 -18.037 -17.342
   13    HZ2  LYS  69           HZ3      LYS  69  -2.318 -17.441 -15.835

  No H/Q in entry =          13
  In of MODEL    2
    1    H    VAL  70           H        VAL  70   3.857 -14.251 -15.416
    2    HA   VAL  70           HA       VAL  70   6.806 -14.537 -15.492
    3    HB   VAL  70           HB       VAL  70   6.929 -12.493 -14.077
    4   HG12  VAL  70          HG11      VAL  70   5.488 -12.089 -16.717
    5   HG11  VAL  70          HG12      VAL  70   7.219 -12.378 -16.543
    6   HG13  VAL  70          HG13      VAL  70   6.503 -10.901 -15.901
    7   HG22  VAL  70          HG21      VAL  70   4.845 -12.260 -13.010
    8   HG21  VAL  70          HG22      VAL  70   3.949 -12.612 -14.487
    9   HG23  VAL  70          HG23      VAL  70   4.725 -11.042 -14.281

  No H/Q in entry =           9
  In of MODEL    2
    1    H    SER  71           H        SER  71   7.747 -14.659 -13.287
    2    HA   SER  71           HA       SER  71   6.555 -16.684 -11.711
    3    HB2  SER  71           HB2      SER  71   8.989 -16.251 -11.750
    4    HB3  SER  71           HB3      SER  71   8.721 -14.706 -10.947
    5    HG   SER  71           HG       SER  71   7.840 -17.198  -9.917

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU  72           H        LEU  72   5.207 -16.590 -10.000
    2    HA   LEU  72           HA       LEU  72   3.632 -14.291  -9.571
    3    HB2  LEU  72           HB2      LEU  72   3.934 -16.840  -7.991
    4    HB3  LEU  72           HB3      LEU  72   2.749 -15.594  -7.606
    5    HG   LEU  72           HG       LEU  72   2.945 -16.896 -10.341
    6   HD12  LEU  72          HD11      LEU  72   0.885 -18.156  -9.561
    7   HD11  LEU  72          HD12      LEU  72   1.269 -17.621  -7.926
    8   HD13  LEU  72          HD13      LEU  72   2.396 -18.657  -8.800
    9   HD22  LEU  72          HD21      LEU  72   1.693 -14.928 -10.605
   10   HD21  LEU  72          HD22      LEU  72   1.011 -15.011  -8.989
   11   HD23  LEU  72          HD23      LEU  72   0.436 -16.105 -10.243

  No H/Q in entry =          11
  In of MODEL    2
    1    H    VAL  73           H        VAL  73   6.290 -15.698  -7.778
    2    HA   VAL  73           HA       VAL  73   6.200 -14.161  -5.449
    3    HB   VAL  73           HB       VAL  73   8.399 -14.938  -5.014
    4   HG11  VAL  73          HG11      VAL  73   6.529 -16.648  -5.209
    5   HG13  VAL  73          HG12      VAL  73   8.160 -17.296  -5.385
    6   HG12  VAL  73          HG13      VAL  73   7.156 -17.031  -6.810
    7   HG21  VAL  73          HG21      VAL  73   8.567 -15.029  -8.006
    8   HG23  VAL  73          HG22      VAL  73   9.564 -16.137  -7.067
    9   HG22  VAL  73          HG23      VAL  73   9.731 -14.396  -6.843

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LEU  74           H        LEU  74   7.202 -13.264  -8.620
    2    HA   LEU  74           HA       LEU  74   9.125 -11.295  -8.119
    3    HB2  LEU  74           HB2      LEU  74   8.695 -12.050 -10.358
    4    HB3  LEU  74           HB3      LEU  74   7.020 -11.505 -10.270
    5    HG   LEU  74           HG       LEU  74   7.793  -9.167 -10.054
    6   HD13  LEU  74          HD11      LEU  74   9.903  -9.321  -8.987
    7   HD12  LEU  74          HD12      LEU  74  10.296  -8.845 -10.639
    8   HD11  LEU  74          HD13      LEU  74  10.491 -10.524 -10.135
    9   HD23  LEU  74          HD21      LEU  74   9.298 -10.249 -12.379
   10   HD22  LEU  74          HD22      LEU  74   8.137  -8.944 -12.290
   11   HD21  LEU  74          HD23      LEU  74   7.574 -10.600 -12.275

  No H/Q in entry =          11
  In of MODEL    2
    1    H    VAL  75           H        VAL  75   5.628 -10.945  -8.497
    2    HA   VAL  75           HA       VAL  75   5.501  -8.188  -7.916
    3    HB   VAL  75           HB       VAL  75   3.433 -10.355  -7.549
    4   HG13  VAL  75          HG11      VAL  75   2.910  -8.462  -6.060
    5   HG12  VAL  75          HG12      VAL  75   1.838  -8.418  -7.453
    6   HG11  VAL  75          HG13      VAL  75   3.211  -7.325  -7.371
    7   HG21  VAL  75          HG21      VAL  75   3.981  -8.259  -9.675
    8   HG23  VAL  75          HG22      VAL  75   2.519  -9.242  -9.620
    9   HG22  VAL  75          HG23      VAL  75   4.088 -10.008  -9.869

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLU  76           H        GLU  76   5.260 -11.064  -5.803
    2    HA   GLU  76           HA       GLU  76   4.760  -9.702  -3.388
    3    HB2  GLU  76           HB2      GLU  76   4.627 -12.183  -3.654
    4    HB3  GLU  76           HB3      GLU  76   6.375 -12.243  -3.812
    5    HG2  GLU  76           HG2      GLU  76   6.636 -11.360  -1.530
    6    HG3  GLU  76           HG3      GLU  76   4.895 -11.250  -1.344

  No H/Q in entry =           6
  In of MODEL    2
    1    H    ALA  77           H        ALA  77   7.839 -10.583  -4.926
    2    HA   ALA  77           HA       ALA  77   9.504  -9.520  -2.900
    3    HB3  ALA  77           HB1      ALA  77  10.082  -9.801  -5.860
    4    HB1  ALA  77           HB2      ALA  77  10.312 -11.062  -4.650
    5    HB2  ALA  77           HB3      ALA  77  11.281  -9.590  -4.584

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLN  78           H        GLN  78   8.120  -8.121  -5.828
    2    HA   GLN  78           HA       GLN  78   9.449  -5.629  -5.718
    3    HB2  GLN  78           HB2      GLN  78   8.170  -6.566  -7.681
    4    HB3  GLN  78           HB3      GLN  78   6.682  -6.186  -6.819
    5    HG2  GLN  78           HG2      GLN  78   7.325  -3.815  -6.736
    6    HG3  GLN  78           HG3      GLN  78   8.821  -4.184  -7.590
    7   HE21  GLN  78          HE21      GLN  78   6.898  -2.375  -8.709
    8   HE22  GLN  78          HE22      GLN  78   6.228  -3.100 -10.090

  No H/Q in entry =           8
  In of MODEL    2
    1    H    LEU  79           H        LEU  79   6.429  -6.792  -4.309
    2    HA   LEU  79           HA       LEU  79   5.406  -4.392  -3.312
    3    HB2  LEU  79           HB2      LEU  79   4.109  -6.455  -3.263
    4    HB3  LEU  79           HB3      LEU  79   5.252  -7.182  -2.137
    5    HG   LEU  79           HG       LEU  79   4.672  -5.541  -0.418
    6   HD13  LEU  79          HD11      LEU  79   4.196  -3.533  -1.476
    7   HD12  LEU  79          HD12      LEU  79   2.572  -4.072  -1.049
    8   HD11  LEU  79          HD13      LEU  79   3.168  -4.293  -2.692
    9   HD23  LEU  79          HD21      LEU  79   2.089  -6.057  -0.347
   10   HD22  LEU  79          HD22      LEU  79   3.239  -7.385  -0.227
   11   HD21  LEU  79          HD23      LEU  79   2.435  -7.059  -1.759

  No H/Q in entry =          11
  In of MODEL    2
    1    H    HIS  80           H        HIS  80   7.596  -6.704  -1.707
    2    HA   HIS  80           HA       HIS  80   7.851  -5.155   0.661
    3    HB2  HIS  80           HB2      HIS  80   9.220  -7.509  -0.522
    4    HB3  HIS  80           HB3      HIS  80  10.113  -6.602   0.700
    5    HD1  HIS  80           HD1      HIS  80   9.609  -7.238   3.040
    6    HD2  HIS  80           HD2      HIS  80   6.420  -8.121   0.504
    7    HE1  HIS  80           HE1      HIS  80   7.835  -8.354   4.476
    8    HE2  HIS  80           HE2      HIS  80   5.885  -8.896   2.938

  No H/Q in entry =           8
  In of MODEL    2
    1    H    LEU  81           H        LEU  81   9.883  -5.419  -2.235
    2    HA   LEU  81           HA       LEU  81  11.905  -3.659  -1.343
    3    HB2  LEU  81           HB2      LEU  81  11.014  -4.465  -4.112
    4    HB3  LEU  81           HB3      LEU  81  12.423  -3.446  -3.812
    5    HG   LEU  81           HG       LEU  81  12.042  -6.168  -2.536
    6   HD12  LEU  81          HD11      LEU  81  13.878  -6.783  -4.269
    7   HD11  LEU  81          HD12      LEU  81  13.308  -5.365  -5.148
    8   HD13  LEU  81          HD13      LEU  81  12.205  -6.698  -4.817
    9   HD23  LEU  81          HD21      LEU  81  14.668  -5.831  -2.500
   10   HD22  LEU  81          HD22      LEU  81  13.669  -5.077  -1.260
   11   HD21  LEU  81          HD23      LEU  81  14.251  -4.123  -2.624

  No H/Q in entry =          11
  In of MODEL    2
    1    H    MET  82           H        MET  82   8.993  -3.051  -3.305
    2    HA   MET  82           HA       MET  82   9.515  -0.322  -3.807
    3    HB2  MET  82           HB2      MET  82   6.968  -1.936  -3.700
    4    HB3  MET  82           HB3      MET  82   6.957  -0.212  -4.068
    5    HG2  MET  82           HG2      MET  82   8.587  -2.276  -5.586
    6    HG3  MET  82           HG3      MET  82   7.019  -1.667  -6.113
    7    HE3  MET  82           HE1      MET  82   7.450   1.789  -7.288
    8    HE2  MET  82           HE2      MET  82   7.063   1.563  -5.584
    9    HE1  MET  82           HE3      MET  82   6.417   0.446  -6.782

  No H/Q in entry =           9
  In of MODEL    2
    1    H    THR  83           H        THR  83   7.714  -1.929  -1.214
    2    HA   THR  83           HA       THR  83   6.834   0.415   0.100
    3    HB   THR  83           HB       THR  83   6.694  -1.156   2.120
    4    HG1  THR  83           HG1      THR  83   7.469  -3.101   1.901
    5   HG22  THR  83          HG21      THR  83   5.066  -2.738   0.642
    6   HG21  THR  83          HG22      THR  83   5.292  -1.410  -0.491
    7   HG23  THR  83          HG23      THR  83   4.635  -1.097   1.116

  No H/Q in entry =           7
  In of MODEL    2
    1    H    SER  84           H        SER  84   9.669  -1.660   0.649
    2    HA   SER  84           HA       SER  84  10.699  -0.217   2.844
    3    HB2  SER  84           HB2      SER  84  11.983  -2.054   0.833
    4    HB3  SER  84           HB3      SER  84  12.913  -1.291   2.121
    5    HG   SER  84           HG       SER  84  10.649  -2.997   2.365

  No H/Q in entry =           5
  In of MODEL    2
    1    H    MET  85           H        MET  85  11.480   0.043  -0.638
    2    HA   MET  85           HA       MET  85  13.461   2.023  -0.374
    3    HB2  MET  85           HB2      MET  85  13.087   0.731  -2.441
    4    HB3  MET  85           HB3      MET  85  11.561   1.581  -2.686
    5    HG2  MET  85           HG2      MET  85  12.754   3.728  -2.808
    6    HG3  MET  85           HG3      MET  85  14.283   2.904  -2.516
    7    HE2  MET  85           HE1      MET  85  11.622   2.945  -6.183
    8    HE1  MET  85           HE2      MET  85  11.213   3.268  -4.500
    9    HE3  MET  85           HE3      MET  85  11.252   1.610  -5.081

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LEU  86           H        LEU  86   9.974   2.331  -0.913
    2    HA   LEU  86           HA       LEU  86   9.891   5.143  -1.101
    3    HB2  LEU  86           HB2      LEU  86   8.064   3.469  -1.690
    4    HB3  LEU  86           HB3      LEU  86   7.720   3.381   0.038
    5    HG   LEU  86           HG       LEU  86   7.541   5.940  -0.022
    6   HD11  LEU  86          HD11      LEU  86   8.343   5.505  -2.716
    7   HD13  LEU  86          HD12      LEU  86   7.890   7.030  -1.962
    8   HD12  LEU  86          HD13      LEU  86   6.667   6.057  -2.776
    9   HD23  LEU  86          HD21      LEU  86   5.431   4.569  -1.699
   10   HD22  LEU  86          HD22      LEU  86   5.222   5.830  -0.487
   11   HD21  LEU  86          HD23      LEU  86   5.629   4.190   0.012

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ALA  87           H        ALA  87   9.417   2.967   1.645
    2    HA   ALA  87           HA       ALA  87   8.838   4.881   3.606
    3    HB1  ALA  87           HB1      ALA  87   9.666   2.066   3.532
    4    HB3  ALA  87           HB2      ALA  87   8.526   2.873   4.606
    5    HB2  ALA  87           HB3      ALA  87  10.251   2.917   4.965

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ARG  88           H        ARG  88  11.940   3.476   2.654
    2    HA   ARG  88           HA       ARG  88  13.524   4.869   4.497
    3    HB2  ARG  88           HB2      ARG  88  14.218   2.897   3.103
    4    HB3  ARG  88           HB3      ARG  88  14.374   3.988   1.729
    5    HG2  ARG  88           HG2      ARG  88  15.822   5.316   3.685
    6    HG3  ARG  88           HG3      ARG  88  16.151   3.630   4.070
    7    HD2  ARG  88           HD2      ARG  88  17.435   3.338   2.235
    8    HD3  ARG  88           HD3      ARG  88  16.302   4.200   1.190
    9    HE   ARG  88           HE       ARG  88  18.680   5.282   2.255
   10   HH21  ARG  88          HH11      ARG  88  19.012   7.503   2.059
   11   HH22  ARG  88          HH12      ARG  88  17.655   8.565   1.903
   12   HH11  ARG  88          HH21      ARG  88  15.338   6.012   1.948
   13   HH12  ARG  88          HH22      ARG  88  15.573   7.718   1.815

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLU  89           H        GLU  89  12.573   5.753   1.164
    2    HA   GLU  89           HA       GLU  89  14.104   8.124   1.015
    3    HB2  GLU  89           HB2      GLU  89  12.983   7.071  -0.940
    4    HB3  GLU  89           HB3      GLU  89  11.430   7.603  -0.296
    5    HG2  GLU  89           HG2      GLU  89  12.117   9.945  -0.457
    6    HG3  GLU  89           HG3      GLU  89  13.728   9.464  -0.980

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LEU  90           H        LEU  90  10.770   7.594   2.119
    2    HA   LEU  90           HA       LEU  90  10.231  10.324   2.684
    3    HB2  LEU  90           HB2      LEU  90   9.046   7.745   3.707
    4    HB3  LEU  90           HB3      LEU  90   8.400   9.336   4.121
    5    HG   LEU  90           HG       LEU  90   8.848   8.454   1.258
    6   HD12  LEU  90          HD11      LEU  90   6.316   8.108   1.300
    7   HD11  LEU  90          HD12      LEU  90   6.457   8.102   3.058
    8   HD13  LEU  90          HD13      LEU  90   7.291   6.876   2.103
    9   HD22  LEU  90          HD21      LEU  90   8.539  10.760   1.177
   10   HD21  LEU  90          HD22      LEU  90   7.540  10.788   2.629
   11   HD23  LEU  90          HD23      LEU  90   6.859  10.225   1.103

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  91           H        ILE  91  11.497   7.655   4.622
    2    HA   ILE  91           HA       ILE  91  11.608   9.026   7.089
    3    HB   ILE  91           HB       ILE  91  13.187   6.696   5.982
    4   HG12  ILE  91          HG12      ILE  91  11.151   6.854   8.225
    5   HG13  ILE  91          HG13      ILE  91  10.696   6.567   6.546
    6   HG22  ILE  91          HG21      ILE  91  13.637   6.491   8.627
    7   HG21  ILE  91          HG22      ILE  91  13.550   8.249   8.522
    8   HG23  ILE  91          HG23      ILE  91  14.742   7.367   7.569
    9   HD13  ILE  91          HD11      ILE  91  11.714   4.472   6.488
   10   HD12  ILE  91          HD12      ILE  91  11.107   4.529   8.143
   11   HD11  ILE  91          HD13      ILE  91  12.809   4.853   7.818

  No H/Q in entry =          11
  In of MODEL    2
    1    H    THR  92           H        THR  92  13.848   8.867   4.355
    2    HA   THR  92           HA       THR  92  15.994  10.277   5.529
    3    HB   THR  92           HB       THR  92  15.032  10.140   2.661
    4    HG1  THR  92           HG1      THR  92  15.873   8.250   3.076
    5   HG22  THR  92          HG21      THR  92  17.599  10.848   2.387
    6   HG21  THR  92          HG22      THR  92  17.273  11.669   3.912
    7   HG23  THR  92          HG23      THR  92  16.312  12.048   2.483

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLU  93           H        GLU  93  13.113  11.408   3.775
    2    HA   GLU  93           HA       GLU  93  13.687  14.173   3.889
    3    HB2  GLU  93           HB2      GLU  93  10.993  12.781   3.884
    4    HB3  GLU  93           HB3      GLU  93  11.272  14.482   3.511
    5    HG2  GLU  93           HG2      GLU  93  12.637  12.246   1.998
    6    HG3  GLU  93           HG3      GLU  93  11.090  12.917   1.498

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LEU  94           H        LEU  94  11.942  12.008   6.090
    2    HA   LEU  94           HA       LEU  94  11.104  13.952   7.956
    3    HB2  LEU  94           HB2      LEU  94  11.699  11.002   8.240
    4    HB3  LEU  94           HB3      LEU  94  11.109  11.976   9.584
    5    HG   LEU  94           HG       LEU  94   9.646  12.013   6.944
    6   HD11  LEU  94          HD11      LEU  94   9.728   9.796   8.953
    7   HD13  LEU  94          HD12      LEU  94   9.441   9.729   7.216
    8   HD12  LEU  94          HD13      LEU  94   8.150  10.239   8.303
    9   HD23  LEU  94          HD21      LEU  94   7.711  12.402   8.528
   10   HD22  LEU  94          HD22      LEU  94   8.941  13.665   8.572
   11   HD21  LEU  94          HD23      LEU  94   8.877  12.450   9.848

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  95           H        ILE  95  14.093  12.044   7.746
    2    HA   ILE  95           HA       ILE  95  15.235  12.978  10.167
    3    HB   ILE  95           HB       ILE  95  16.502  11.913   7.631
    4   HG12  ILE  95          HG12      ILE  95  16.193  10.716  10.399
    5   HG13  ILE  95          HG13      ILE  95  15.038  10.447   9.095
    6   HG21  ILE  95          HG21      ILE  95  17.731  12.734  10.282
    7   HG23  ILE  95          HG22      ILE  95  18.202  13.262   8.665
    8   HG22  ILE  95          HG23      ILE  95  18.516  11.605   9.179
    9   HD13  ILE  95          HD11      ILE  95  16.537   9.176   7.846
   10   HD12  ILE  95          HD12      ILE  95  17.000   8.733   9.486
   11   HD11  ILE  95          HD13      ILE  95  17.952   9.918   8.593

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLU  96           H        GLU  96  15.407  14.207   6.832
    2    HA   GLU  96           HA       GLU  96  17.236  16.299   7.319
    3    HB2  GLU  96           HB2      GLU  96  16.594  15.628   5.056
    4    HB3  GLU  96           HB3      GLU  96  14.944  16.174   5.343
    5    HG2  GLU  96           HG2      GLU  96  15.500  18.306   4.801
    6    HG3  GLU  96           HG3      GLU  96  16.789  18.318   5.993

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LEU  97           H        LEU  97  13.723  16.088   7.722
    2    HA   LEU  97           HA       LEU  97  13.283  18.820   8.355
    3    HB2  LEU  97           HB2      LEU  97  11.777  16.285   8.962
    4    HB3  LEU  97           HB3      LEU  97  11.248  17.830   9.627
    5    HG   LEU  97           HG       LEU  97  11.757  17.412   6.666
    6   HD12  LEU  97          HD11      LEU  97   9.235  17.266   6.529
    7   HD11  LEU  97          HD12      LEU  97   9.217  17.070   8.280
    8   HD13  LEU  97          HD13      LEU  97  10.014  15.866   7.266
    9   HD23  LEU  97          HD21      LEU  97  10.005  19.364   6.682
   10   HD22  LEU  97          HD22      LEU  97  11.681  19.735   7.087
   11   HD21  LEU  97          HD23      LEU  97  10.483  19.559   8.368

  No H/Q in entry =          11
  In of MODEL    2
    1    H    HIS  98           H        HIS  98  14.108  16.004  10.362
    2    HA   HIS  98           HA       HIS  98  13.922  17.268  12.875
    3    HB2  HIS  98           HB2      HIS  98  15.695  15.021  11.891
    4    HB3  HIS  98           HB3      HIS  98  15.677  15.562  13.571
    5    HD1  HIS  98           HD1      HIS  98  13.509  13.913  10.965
    6    HD2  HIS  98           HD2      HIS  98  13.365  14.839  15.027
    7    HE1  HIS  98           HE1      HIS  98  11.485  12.706  11.904
    8    HE2  HIS  98           HE2      HIS  98  11.377  13.262  14.374

  No H/Q in entry =           8
  In of MODEL    2
    1    H    GLU  99           H        GLU  99  16.495  17.166  10.460
    2    HA   GLU  99           HA       GLU  99  18.460  18.513  12.001
    3    HB2  GLU  99           HB2      GLU  99  18.964  17.225   9.938
    4    HB3  GLU  99           HB3      GLU  99  18.153  18.473   8.989
    5    HG2  GLU  99           HG2      GLU  99  19.743  20.156   9.789
    6    HG3  GLU  99           HG3      GLU  99  20.523  18.961  10.820

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LYS 100           H        LYS 100  15.945  19.655   9.764
    2    HA   LYS 100           HA       LYS 100  16.724  22.398   9.909
    3    HB2  LYS 100           HB2      LYS 100  14.105  21.090   9.137
    4    HB3  LYS 100           HB3      LYS 100  14.394  22.830   9.045
    5    HG2  LYS 100           HG2      LYS 100  16.380  22.392   7.594
    6    HG3  LYS 100           HG3      LYS 100  15.978  20.672   7.612
    7    HD2  LYS 100           HD2      LYS 100  13.787  21.166   6.594
    8    HD3  LYS 100           HD3      LYS 100  14.172  22.887   6.583
    9    HE2  LYS 100           HE2      LYS 100  16.146  22.417   5.140
   10    HE3  LYS 100           HE3      LYS 100  15.691  20.709   5.106
   11    HZ1  LYS 100           HZ1      LYS 100  13.859  22.889   4.253
   12    HZ3  LYS 100           HZ2      LYS 100  13.687  21.217   3.993
   13    HZ2  LYS 100           HZ3      LYS 100  14.899  22.086   3.179

  No H/Q in entry =          13
  In of MODEL    2
    1    H    LEU 101           H        LEU 101  14.625  20.342  11.862
    2    HA   LEU 101           HA       LEU 101  13.434  22.405  13.427
    3    HB2  LEU 101           HB2      LEU 101  13.891  19.459  13.820
    4    HB3  LEU 101           HB3      LEU 101  13.339  20.438  15.175
    5    HG   LEU 101           HG       LEU 101  11.940  20.513  12.495
    6   HD12  LEU 101          HD11      LEU 101  10.282  18.941  13.754
    7   HD11  LEU 101          HD12      LEU 101  11.671  18.538  14.760
    8   HD13  LEU 101          HD13      LEU 101  11.720  18.229  13.024
    9   HD21  LEU 101          HD21      LEU 101  11.257  21.307  15.341
   10   HD23  LEU 101          HD22      LEU 101  10.007  21.071  14.121
   11   HD22  LEU 101          HD23      LEU 101  11.235  22.313  13.891

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LYS 102           H        LYS 102  16.588  21.816  13.016
    2    HA   LYS 102           HA       LYS 102  18.421  22.700  14.101
    3    HB2  LYS 102           HB2      LYS 102  16.589  24.206  15.218
    4    HB3  LYS 102           HB3      LYS 102  16.792  23.147  16.598
    5    HG2  LYS 102           HG2      LYS 102  18.682  25.168  15.439
    6    HG3  LYS 102           HG3      LYS 102  18.289  24.854  17.116
    7    HD2  LYS 102           HD2      LYS 102  19.980  22.949  15.446
    8    HD3  LYS 102           HD3      LYS 102  20.654  24.276  16.382
    9    HE2  LYS 102           HE2      LYS 102  20.264  21.727  17.352
   10    HE3  LYS 102           HE3      LYS 102  20.467  23.172  18.342
   11    HZ2  LYS 102           HZ1      LYS 102  18.501  21.877  18.948
   12    HZ1  LYS 102           HZ2      LYS 102  17.868  22.100  17.393
   13    HZ3  LYS 102           HZ3      LYS 102  18.082  23.433  18.419

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ALA 103           H        ALA 103  16.341  21.086  16.510
    2    HA   ALA 103           HA       ALA 103  18.063  19.889  18.179
    3    HB2  ALA 103           HB1      ALA 103  16.491  17.872  18.165
    4    HB1  ALA 103           HB2      ALA 103  15.599  18.718  16.900
    5    HB3  ALA 103           HB3      ALA 103  15.761  19.442  18.498

  No H/Q in entry =           5
  In of MODEL    2
    1    H1   ALA   1           H3       ALA   1  -1.407  -7.150 -21.544
    2    H2   ALA   1           H2       ALA   1  -2.197  -8.589 -21.094
    3    H3   ALA   1           H1       ALA   1  -0.585  -8.630 -21.637
    4    HA   ALA   1           HA       ALA   1  -1.401  -9.108 -23.639
    5    HB1  ALA   1           HB1      ALA   1  -3.537  -9.837 -23.180
    6    HB2  ALA   1           HB2      ALA   1  -3.978  -8.330 -23.983
    7    HB3  ALA   1           HB3      ALA   1  -3.930  -8.407 -22.224

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLU   2           H        GLU   2  -2.222  -7.925 -25.636
    2    HA   GLU   2           HA       GLU   2  -0.828  -5.905 -26.506
    3    HB2  GLU   2           HB2      GLU   2  -3.832  -5.989 -26.847
    4    HB3  GLU   2           HB3      GLU   2  -2.708  -5.121 -27.889
    5    HG2  GLU   2           HG2      GLU   2  -2.185  -7.010 -29.037
    6    HG3  GLU   2           HG3      GLU   2  -1.894  -7.912 -27.556

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLU   3           H        GLU   3  -4.002  -4.664 -25.632
    2    HA   GLU   3           HA       GLU   3  -2.974  -2.101 -25.000
    3    HB2  GLU   3           HB2      GLU   3  -5.657  -3.430 -24.687
    4    HB3  GLU   3           HB3      GLU   3  -5.373  -1.812 -24.040
    5    HG2  GLU   3           HG2      GLU   3  -5.006  -0.887 -26.165
    6    HG3  GLU   3           HG3      GLU   3  -4.597  -2.441 -26.884

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LEU   4           H        LEU   4  -4.569  -4.466 -22.829
    2    HA   LEU   4           HA       LEU   4  -4.229  -3.232 -20.437
    3    HB2  LEU   4           HB2      LEU   4  -3.667  -6.171 -20.898
    4    HB3  LEU   4           HB3      LEU   4  -4.088  -5.424 -19.358
    5    HG   LEU   4           HG       LEU   4  -5.842  -5.511 -21.836
    6   HD13  LEU   4          HD11      LEU   4  -7.033  -7.234 -20.845
    7   HD12  LEU   4          HD12      LEU   4  -6.563  -6.769 -19.211
    8   HD11  LEU   4          HD13      LEU   4  -5.415  -7.608 -20.252
    9   HD23  LEU   4          HD21      LEU   4  -7.545  -4.707 -19.982
   10   HD22  LEU   4          HD22      LEU   4  -6.507  -3.531 -20.787
   11   HD21  LEU   4          HD23      LEU   4  -6.090  -4.117 -19.177

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLU   5           H        GLU   5  -1.708  -5.064 -22.146
    2    HA   GLU   5           HA       GLU   5   0.258  -4.766 -20.094
    3    HB2  GLU   5           HB2      GLU   5   0.339  -6.536 -21.851
    4    HB3  GLU   5           HB3      GLU   5   0.672  -5.288 -23.051
    5    HG2  GLU   5           HG2      GLU   5   2.789  -6.219 -22.395
    6    HG3  GLU   5           HG3      GLU   5   2.680  -4.621 -21.658

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLU   6           H        GLU   6  -0.363  -3.060 -23.146
    2    HA   GLU   6           HA       GLU   6   1.795  -1.217 -22.864
    3    HB2  GLU   6           HB2      GLU   6  -0.754  -1.135 -24.492
    4    HB3  GLU   6           HB3      GLU   6   0.504   0.096 -24.592
    5    HG2  GLU   6           HG2      GLU   6   2.144  -1.581 -25.270
    6    HG3  GLU   6           HG3      GLU   6   0.948  -2.863 -25.078

  No H/Q in entry =           6
  In of MODEL    2
    1    H    VAL   7           H        VAL   7  -1.551  -1.305 -21.845
    2    HA   VAL   7           HA       VAL   7  -1.793   1.408 -21.014
    3    HB   VAL   7           HB       VAL   7  -3.248  -1.117 -20.186
    4   HG11  VAL   7          HG11      VAL   7  -3.645   1.771 -19.379
    5   HG13  VAL   7          HG12      VAL   7  -3.546   0.349 -18.341
    6   HG12  VAL   7          HG13      VAL   7  -4.972   0.609 -19.345
    7   HG21  VAL   7          HG21      VAL   7  -3.393  -0.044 -22.577
    8   HG23  VAL   7          HG22      VAL   7  -4.351   1.200 -21.774
    9   HG22  VAL   7          HG23      VAL   7  -4.888  -0.480 -21.749

  No H/Q in entry =           9
  In of MODEL    2
    1    H    VAL   8           H        VAL   8  -0.802  -1.570 -19.359
    2    HA   VAL   8           HA       VAL   8  -0.510  -0.485 -16.763
    3    HB   VAL   8           HB       VAL   8   0.916  -2.795 -18.105
    4   HG13  VAL   8          HG11      VAL   8   2.313  -2.126 -16.294
    5   HG12  VAL   8          HG12      VAL   8   1.342  -3.457 -15.665
    6   HG11  VAL   8          HG13      VAL   8   0.931  -1.794 -15.251
    7   HG23  VAL   8          HG21      VAL   8  -1.061  -3.246 -15.926
    8   HG22  VAL   8          HG22      VAL   8  -0.856  -4.103 -17.451
    9   HG21  VAL   8          HG23      VAL   8  -1.748  -2.586 -17.409

  No H/Q in entry =           9
  In of MODEL    2
    1    H    MET   9           H        MET   9   1.762  -0.777 -19.492
    2    HA   MET   9           HA       MET   9   4.032   0.279 -18.215
    3    HB2  MET   9           HB2      MET   9   3.100   0.235 -21.076
    4    HB3  MET   9           HB3      MET   9   4.565   1.105 -20.626
    5    HG2  MET   9           HG2      MET   9   5.280  -1.068 -19.439
    6    HG3  MET   9           HG3      MET   9   3.984  -1.846 -20.350
    7    HE3  MET   9           HE1      MET   9   4.929  -1.948 -23.877
    8    HE2  MET   9           HE2      MET   9   3.926  -0.631 -23.276
    9    HE1  MET   9           HE3      MET   9   3.783  -2.236 -22.564

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLY  10           H        GLY  10   1.353   1.866 -19.915
    2    HA3  GLY  10           HA2      GLY  10   2.302   4.524 -19.667
    3    HA2  GLY  10           HA3      GLY  10   0.616   4.056 -19.884

  No H/Q in entry =           3
  In of MODEL    2
    1    H    LEU  11           H        LEU  11   0.207   2.530 -17.599
    2    HA   LEU  11           HA       LEU  11  -0.346   4.507 -15.646
    3    HB2  LEU  11           HB2      LEU  11  -0.267   1.492 -15.485
    4    HB3  LEU  11           HB3      LEU  11  -0.790   2.514 -14.148
    5    HG   LEU  11           HG       LEU  11  -2.009   2.619 -16.920
    6   HD13  LEU  11          HD11      LEU  11  -2.589   0.474 -16.167
    7   HD12  LEU  11          HD12      LEU  11  -3.948   1.461 -15.633
    8   HD11  LEU  11          HD13      LEU  11  -2.698   0.987 -14.483
    9   HD22  LEU  11          HD21      LEU  11  -2.616   4.634 -15.921
   10   HD21  LEU  11          HD22      LEU  11  -2.550   3.970 -14.289
   11   HD23  LEU  11          HD23      LEU  11  -3.916   3.596 -15.340

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  12           H        ILE  12   2.209   2.051 -15.867
    2    HA   ILE  12           HA       ILE  12   3.394   2.597 -13.355
    3    HB   ILE  12           HB       ILE  12   4.673   1.561 -15.907
    4   HG12  ILE  12          HG12      ILE  12   2.654   0.323 -14.780
    5   HG13  ILE  12          HG13      ILE  12   4.060  -0.609 -15.255
    6   HG23  ILE  12          HG21      ILE  12   6.403   2.310 -14.380
    7   HG22  ILE  12          HG22      ILE  12   6.345   0.548 -14.314
    8   HG21  ILE  12          HG23      ILE  12   5.618   1.504 -13.024
    9   HD12  ILE  12          HD11      ILE  12   3.189  -1.157 -12.974
   10   HD11  ILE  12          HD12      ILE  12   3.570   0.491 -12.476
   11   HD13  ILE  12          HD13      ILE  12   4.851  -0.597 -12.959

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  13           H        ILE  13   4.013   3.859 -16.609
    2    HA   ILE  13           HA       ILE  13   6.138   5.589 -15.872
    3    HB   ILE  13           HB       ILE  13   4.123   5.659 -18.131
    4   HG12  ILE  13          HG12      ILE  13   5.961   3.824 -17.840
    5   HG13  ILE  13          HG13      ILE  13   5.730   4.566 -19.419
    6   HG23  ILE  13          HG21      ILE  13   4.815   7.934 -17.896
    7   HG22  ILE  13          HG22      ILE  13   5.782   7.278 -19.212
    8   HG21  ILE  13          HG23      ILE  13   6.495   7.477 -17.612
    9   HD12  ILE  13          HD11      ILE  13   8.172   4.351 -18.438
   10   HD11  ILE  13          HD12      ILE  13   7.705   5.763 -17.497
   11   HD13  ILE  13          HD13      ILE  13   7.688   5.835 -19.255

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ASN  14           H        ASN  14   2.631   6.069 -16.165
    2    HA   ASN  14           HA       ASN  14   2.573   8.815 -15.532
    3    HB2  ASN  14           HB2      ASN  14   0.692   7.164 -16.373
    4    HB3  ASN  14           HB3      ASN  14   0.360   6.987 -14.655
    5   HD21  ASN  14          HD21      ASN  14  -1.654   8.133 -16.103
    6   HD22  ASN  14          HD22      ASN  14  -1.726   9.806 -15.838

  No H/Q in entry =           6
  In of MODEL    2
    1    H    SER  15           H        SER  15   2.275   5.940 -13.453
    2    HA   SER  15           HA       SER  15   1.946   7.312 -11.009
    3    HB2  SER  15           HB2      SER  15   2.494   5.230  -9.953
    4    HB3  SER  15           HB3      SER  15   1.681   4.805 -11.455
    5    HG   SER  15           HG       SER  15   3.431   3.817 -12.011

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLY  16           H        GLY  16   4.838   6.226 -12.747
    2    HA3  GLY  16           HA2      GLY  16   6.747   6.993 -10.803
    3    HA2  GLY  16           HA3      GLY  16   7.063   6.790 -12.525

  No H/Q in entry =           3
  In of MODEL    2
    1    H    GLN  17           H        GLN  17   5.372   8.738 -13.602
    2    HA   GLN  17           HA       GLN  17   6.935  11.088 -13.286
    3    HB2  GLN  17           HB2      GLN  17   4.198  10.641 -14.506
    4    HB3  GLN  17           HB3      GLN  17   5.044  12.187 -14.570
    5    HG2  GLN  17           HG2      GLN  17   6.923  11.153 -15.743
    6    HG3  GLN  17           HG3      GLN  17   6.157   9.569 -15.617
    7   HE21  GLN  17          HE21      GLN  17   6.538   9.992 -18.160
    8   HE22  GLN  17          HE22      GLN  17   5.195  10.646 -18.967

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ALA  18           H        ALA  18   3.831  10.056 -11.957
    2    HA   ALA  18           HA       ALA  18   3.085  12.443 -10.700
    3    HB1  ALA  18           HB1      ALA  18   1.970   9.980 -10.926
    4    HB2  ALA  18           HB2      ALA  18   1.407  11.198  -9.785
    5    HB3  ALA  18           HB3      ALA  18   2.500   9.923  -9.246

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ARG  19           H        ARG  19   4.964   9.692  -9.404
    2    HA   ARG  19           HA       ARG  19   5.473  10.856  -6.880
    3    HB2  ARG  19           HB2      ARG  19   5.904   8.454  -7.400
    4    HB3  ARG  19           HB3      ARG  19   7.264   8.947  -8.413
    5    HG2  ARG  19           HG2      ARG  19   8.364   9.995  -6.484
    6    HG3  ARG  19           HG3      ARG  19   6.984   9.601  -5.461
    7    HD2  ARG  19           HD2      ARG  19   8.752   7.976  -5.089
    8    HD3  ARG  19           HD3      ARG  19   7.388   7.185  -5.883
    9    HE   ARG  19           HE       ARG  19   9.102   8.011  -7.920
   10   HH21  ARG  19          HH11      ARG  19  10.677   6.614  -8.757
   11   HH22  ARG  19          HH12      ARG  19  11.223   5.270  -7.816
   12   HH11  ARG  19          HH21      ARG  19   9.166   5.985  -5.138
   13   HH12  ARG  19          HH22      ARG  19  10.365   4.913  -5.766

  No H/Q in entry =          13
  In of MODEL    2
    1    H    SER  20           H        SER  20   7.311  10.892  -9.916
    2    HA   SER  20           HA       SER  20   9.542  12.322  -9.078
    3    HB2  SER  20           HB2      SER  20   9.036  11.286 -11.392
    4    HB3  SER  20           HB3      SER  20   8.252  12.821 -11.750
    5    HG   SER  20           HG       SER  20  10.949  12.256 -11.194

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU  21           H        LEU  21   6.443  13.570 -10.298
    2    HA   LEU  21           HA       LEU  21   7.095  16.320 -10.073
    3    HB2  LEU  21           HB2      LEU  21   4.435  14.880 -10.010
    4    HB3  LEU  21           HB3      LEU  21   4.590  16.634 -10.015
    5    HG   LEU  21           HG       LEU  21   5.822  14.849 -12.135
    6   HD12  LEU  21          HD11      LEU  21   3.875  15.807 -13.531
    7   HD11  LEU  21          HD12      LEU  21   3.123  16.196 -11.984
    8   HD13  LEU  21          HD13      LEU  21   3.489  14.520 -12.389
    9   HD23  LEU  21          HD21      LEU  21   5.578  17.163 -13.383
   10   HD22  LEU  21          HD22      LEU  21   6.930  16.938 -12.276
   11   HD21  LEU  21          HD23      LEU  21   5.514  17.837 -11.757

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ALA  22           H        ALA  22   5.582  14.024  -7.833
    2    HA   ALA  22           HA       ALA  22   4.952  15.830  -5.772
    3    HB3  ALA  22           HB1      ALA  22   4.209  13.433  -5.937
    4    HB2  ALA  22           HB2      ALA  22   4.783  13.911  -4.339
    5    HB1  ALA  22           HB3      ALA  22   5.820  12.958  -5.402

  No H/Q in entry =           5
  In of MODEL    2
    1    H    TYR  23           H        TYR  23   7.903  13.825  -6.187
    2    HA   TYR  23           HA       TYR  23   9.263  14.857  -3.927
    3    HB2  TYR  23           HB2      TYR  23  10.072  12.853  -5.077
    4    HB3  TYR  23           HB3      TYR  23  10.390  13.792  -6.535
    5    HD1  TYR  23           HD1      TYR  23  11.324  13.482  -2.932
    6    HD2  TYR  23           HD2      TYR  23  12.424  14.962  -6.812
    7    HE1  TYR  23           HE1      TYR  23  13.571  14.076  -2.068
    8    HE2  TYR  23           HE2      TYR  23  14.671  15.557  -5.948
    9    HH   TYR  23           HH       TYR  23  15.589  14.849  -2.575

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ALA  24           H        ALA  24   9.096  15.958  -7.296
    2    HA   ALA  24           HA       ALA  24  10.974  18.057  -7.039
    3    HB2  ALA  24           HB1      ALA  24  10.546  18.113  -9.251
    4    HB3  ALA  24           HB2      ALA  24   8.983  18.851  -8.904
    5    HB1  ALA  24           HB3      ALA  24   9.123  17.099  -9.030

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA  25           H        ALA  25   7.492  17.847  -6.442
    2    HA   ALA  25           HA       ALA  25   6.987  20.562  -5.881
    3    HB1  ALA  25           HB1      ALA  25   5.343  18.550  -6.090
    4    HB2  ALA  25           HB2      ALA  25   4.957  19.837  -4.946
    5    HB3  ALA  25           HB3      ALA  25   5.655  18.322  -4.368

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU  26           H        LEU  26   8.063  17.894  -3.819
    2    HA   LEU  26           HA       LEU  26   8.139  19.329  -1.384
    3    HB2  LEU  26           HB2      LEU  26   8.254  16.914  -1.374
    4    HB3  LEU  26           HB3      LEU  26   9.731  16.932  -2.334
    5    HG   LEU  26           HG       LEU  26  10.923  18.063  -0.487
    6   HD12  LEU  26          HD11      LEU  26   9.681  18.064   1.764
    7   HD11  LEU  26          HD12      LEU  26   8.202  17.912   0.819
    8   HD13  LEU  26          HD13      LEU  26   9.235  19.327   0.615
    9   HD21  LEU  26          HD21      LEU  26   9.405  15.584   0.379
   10   HD23  LEU  26          HD22      LEU  26  10.911  16.160   1.086
   11   HD22  LEU  26          HD23      LEU  26  10.882  15.598  -0.584

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LYS  27           H        LYS  27  10.578  18.774  -3.891
    2    HA   LYS  27           HA       LYS  27  12.742  20.036  -2.650
    3    HB2  LYS  27           HB2      LYS  27  12.870  18.686  -4.736
    4    HB3  LYS  27           HB3      LYS  27  12.099  20.010  -5.609
    5    HG2  LYS  27           HG2      LYS  27  13.947  21.513  -5.021
    6    HG3  LYS  27           HG3      LYS  27  14.713  20.229  -4.077
    7    HD2  LYS  27           HD2      LYS  27  14.883  18.840  -6.128
    8    HD3  LYS  27           HD3      LYS  27  14.162  20.150  -7.063
    9    HE2  LYS  27           HE2      LYS  27  16.032  21.634  -6.440
   10    HE3  LYS  27           HE3      LYS  27  16.756  20.328  -5.496
   11    HZ3  LYS  27           HZ1      LYS  27  17.760  20.433  -7.675
   12    HZ2  LYS  27           HZ2      LYS  27  16.240  20.300  -8.426
   13    HZ1  LYS  27           HZ3      LYS  27  16.869  18.996  -7.535

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLN  28           H        GLN  28  10.121  21.390  -4.619
    2    HA   GLN  28           HA       GLN  28  11.056  24.051  -4.770
    3    HB2  GLN  28           HB2      GLN  28   8.234  22.951  -4.678
    4    HB3  GLN  28           HB3      GLN  28   8.630  24.629  -5.047
    5    HG2  GLN  28           HG2      GLN  28   9.670  22.234  -6.588
    6    HG3  GLN  28           HG3      GLN  28   8.322  23.247  -7.100
    7   HE21  GLN  28          HE21      GLN  28  11.479  22.808  -7.803
    8   HE22  GLN  28          HE22      GLN  28  11.937  24.400  -8.171

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ALA  29           H        ALA  29   9.124  22.345  -2.344
    2    HA   ALA  29           HA       ALA  29   8.542  24.534  -0.669
    3    HB2  ALA  29           HB1      ALA  29   7.817  22.962   0.896
    4    HB1  ALA  29           HB2      ALA  29   9.053  21.788   0.442
    5    HB3  ALA  29           HB3      ALA  29   7.672  22.067  -0.617

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LYS  30           H        LYS  30  11.294  22.293  -0.716
    2    HA   LYS  30           HA       LYS  30  12.587  23.264   1.594
    3    HB2  LYS  30           HB2      LYS  30  13.713  21.984  -0.907
    4    HB3  LYS  30           HB3      LYS  30  14.683  22.355   0.521
    5    HG2  LYS  30           HG2      LYS  30  13.133  20.959   1.892
    6    HG3  LYS  30           HG3      LYS  30  12.262  20.527   0.417
    7    HD2  LYS  30           HD2      LYS  30  14.323  19.559  -0.528
    8    HD3  LYS  30           HD3      LYS  30  15.213  20.005   0.929
    9    HE2  LYS  30           HE2      LYS  30  13.713  18.562   2.275
   10    HE3  LYS  30           HE3      LYS  30  12.853  18.095   0.802
   11    HZ2  LYS  30           HZ1      LYS  30  14.655  16.536   1.578
   12    HZ1  LYS  30           HZ2      LYS  30  15.783  17.733   1.133
   13    HZ3  LYS  30           HZ3      LYS  30  14.762  17.037  -0.038

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLN  31           H        GLN  31  12.489  24.462  -1.706
    2    HA   GLN  31           HA       GLN  31  14.621  26.376  -1.273
    3    HB2  GLN  31           HB2      GLN  31  12.592  26.400  -3.511
    4    HB3  GLN  31           HB3      GLN  31  14.206  27.111  -3.502
    5    HG2  GLN  31           HG2      GLN  31  14.690  24.421  -2.919
    6    HG3  GLN  31           HG3      GLN  31  13.395  24.352  -4.106
    7   HE21  GLN  31          HE21      GLN  31  16.248  23.586  -4.490
    8   HE22  GLN  31          HE22      GLN  31  16.820  24.563  -5.754

  No H/Q in entry =           8
  In of MODEL    2
    1    H    GLY  32           H        GLY  32  11.540  26.166  -0.148
    2    HA3  GLY  32           HA2      GLY  32  10.360  27.725   1.115
    3    HA2  GLY  32           HA3      GLY  32  11.477  28.971   0.570

  No H/Q in entry =           3
  In of MODEL    2
    1    H    ASP  33           H        ASP  33  10.149  27.049  -1.928
    2    HA   ASP  33           HA       ASP  33   8.468  29.304  -2.799
    3    HB2  ASP  33           HB2      ASP  33   9.595  26.894  -4.229
    4    HB3  ASP  33           HB3      ASP  33   8.437  27.997  -4.969

  No H/Q in entry =           4
  In of MODEL    2
    1    H    PHE  34           H        PHE  34   6.774  28.815  -1.246
    2    HA   PHE  34           HA       PHE  34   5.418  26.329  -1.155
    3    HB2  PHE  34           HB2      PHE  34   4.425  29.108  -0.487
    4    HB3  PHE  34           HB3      PHE  34   3.588  27.610  -0.079
    5    HD1  PHE  34           HD1      PHE  34   5.806  30.032   1.147
    6    HD2  PHE  34           HD2      PHE  34   5.168  25.785   1.096
    7    HE1  PHE  34           HE1      PHE  34   7.185  29.799   3.193
    8    HE2  PHE  34           HE2      PHE  34   6.549  25.555   3.141
    9    HZ   PHE  34           HZ       PHE  34   7.552  27.563   4.189

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ALA  35           H        ALA  35   4.973  29.186  -3.174
    2    HA   ALA  35           HA       ALA  35   2.435  28.545  -4.215
    3    HB3  ALA  35           HB1      ALA  35   3.487  29.944  -6.248
    4    HB2  ALA  35           HB2      ALA  35   4.693  30.319  -5.016
    5    HB1  ALA  35           HB3      ALA  35   2.996  30.712  -4.738

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA  36           H        ALA  36   5.679  27.901  -5.546
    2    HA   ALA  36           HA       ALA  36   4.719  26.459  -7.794
    3    HB3  ALA  36           HB1      ALA  36   6.881  26.603  -8.395
    4    HB2  ALA  36           HB2      ALA  36   7.364  25.581  -7.040
    5    HB1  ALA  36           HB3      ALA  36   7.239  27.329  -6.828

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA  37           H        ALA  37   5.663  25.479  -4.531
    2    HA   ALA  37           HA       ALA  37   5.635  22.690  -4.956
    3    HB2  ALA  37           HB1      ALA  37   5.340  24.482  -2.582
    4    HB1  ALA  37           HB2      ALA  37   6.488  23.175  -2.865
    5    HB3  ALA  37           HB3      ALA  37   4.827  22.805  -2.404

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LYS  38           H        LYS  38   3.072  24.874  -3.809
    2    HA   LYS  38           HA       LYS  38   0.990  23.041  -3.597
    3    HB2  LYS  38           HB2      LYS  38   1.312  25.801  -3.348
    4    HB3  LYS  38           HB3      LYS  38   0.123  25.639  -4.635
    5    HG2  LYS  38           HG2      LYS  38  -1.323  24.304  -3.200
    6    HG3  LYS  38           HG3      LYS  38  -0.087  24.258  -1.935
    7    HD2  LYS  38           HD2      LYS  38  -0.299  26.594  -1.493
    8    HD3  LYS  38           HD3      LYS  38  -1.204  26.871  -2.982
    9    HE2  LYS  38           HE2      LYS  38  -2.720  26.893  -1.053
   10    HE3  LYS  38           HE3      LYS  38  -3.074  25.512  -2.095
   11    HZ3  LYS  38           HZ1      LYS  38  -2.344  24.051  -0.555
   12    HZ2  LYS  38           HZ2      LYS  38  -2.715  25.306   0.530
   13    HZ1  LYS  38           HZ3      LYS  38  -1.114  25.070   0.016

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ALA  39           H        ALA  39   1.970  24.948  -6.442
    2    HA   ALA  39           HA       ALA  39  -0.086  24.057  -8.158
    3    HB2  ALA  39           HB1      ALA  39   2.651  24.731  -9.194
    4    HB1  ALA  39           HB2      ALA  39   1.667  25.984  -8.438
    5    HB3  ALA  39           HB3      ALA  39   1.072  25.138  -9.867

  No H/Q in entry =           5
  In of MODEL    2
    1    H    MET  40           H        MET  40   3.161  22.792  -7.554
    2    HA   MET  40           HA       MET  40   3.097  20.768  -9.543
    3    HB2  MET  40           HB2      MET  40   4.689  21.012  -6.984
    4    HB3  MET  40           HB3      MET  40   4.960  19.756  -8.195
    5    HG2  MET  40           HG2      MET  40   4.993  22.712  -8.865
    6    HG3  MET  40           HG3      MET  40   6.445  21.824  -8.404
    7    HE3  MET  40           HE1      MET  40   7.358  19.613 -11.203
    8    HE2  MET  40           HE2      MET  40   6.787  19.291  -9.569
    9    HE1  MET  40           HE3      MET  40   7.871  20.649  -9.863

  No H/Q in entry =           9
  In of MODEL    2
    1    H    MET  41           H        MET  41   2.158  20.806  -6.125
    2    HA   MET  41           HA       MET  41   1.652  18.037  -5.846
    3    HB2  MET  41           HB2      MET  41   0.287  20.383  -4.508
    4    HB3  MET  41           HB3      MET  41   0.144  18.704  -3.999
    5    HG2  MET  41           HG2      MET  41   2.853  18.955  -4.018
    6    HG3  MET  41           HG3      MET  41   2.392  20.609  -3.628
    7    HE2  MET  41           HE1      MET  41  -0.646  19.328  -1.921
    8    HE1  MET  41           HE2      MET  41   0.158  20.849  -2.295
    9    HE3  MET  41           HE3      MET  41   0.093  20.280  -0.627

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ASP  42           H        ASP  42  -0.407  20.739  -6.839
    2    HA   ASP  42           HA       ASP  42  -2.833  19.352  -6.990
    3    HB2  ASP  42           HB2      ASP  42  -2.151  21.930  -7.246
    4    HB3  ASP  42           HB3      ASP  42  -2.286  21.530  -8.955

  No H/Q in entry =           4
  In of MODEL    2
    1    H    GLN  43           H        GLN  43  -0.382  19.965  -9.476
    2    HA   GLN  43           HA       GLN  43  -1.740  18.628 -11.573
    3    HB2  GLN  43           HB2      GLN  43   1.210  19.175 -11.171
    4    HB3  GLN  43           HB3      GLN  43   0.513  18.526 -12.658
    5    HG2  GLN  43           HG2      GLN  43  -1.020  20.537 -12.713
    6    HG3  GLN  43           HG3      GLN  43  -0.083  21.205 -11.380
    7   HE21  GLN  43          HE21      GLN  43   0.076  22.824 -13.467
    8   HE22  GLN  43          HE22      GLN  43   1.499  22.616 -14.365

  No H/Q in entry =           8
  In of MODEL    2
    1    H    SER  44           H        SER  44   0.606  17.516  -9.164
    2    HA   SER  44           HA       SER  44   0.975  14.911 -10.183
    3    HB2  SER  44           HB2      SER  44   1.840  16.363  -7.943
    4    HB3  SER  44           HB3      SER  44   0.987  14.972  -7.275
    5    HG   SER  44           HG       SER  44   3.108  14.374  -7.686

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ARG  45           H        ARG  45  -1.374  16.209  -7.863
    2    HA   ARG  45           HA       ARG  45  -2.740  13.834  -7.233
    3    HB2  ARG  45           HB2      ARG  45  -2.970  16.002  -6.046
    4    HB3  ARG  45           HB3      ARG  45  -3.823  16.657  -7.440
    5    HG2  ARG  45           HG2      ARG  45  -5.572  14.913  -7.166
    6    HG3  ARG  45           HG3      ARG  45  -4.731  14.312  -5.736
    7    HD2  ARG  45           HD2      ARG  45  -4.970  16.578  -4.685
    8    HD3  ARG  45           HD3      ARG  45  -5.953  17.085  -6.075
    9    HE   ARG  45           HE       ARG  45  -7.044  14.699  -5.039
   10   HH21  ARG  45          HH11      ARG  45  -8.889  14.756  -3.781
   11   HH22  ARG  45          HH12      ARG  45  -9.306  16.193  -2.917
   12   HH11  ARG  45          HH21      ARG  45  -6.541  17.953  -4.017
   13   HH12  ARG  45          HH22      ARG  45  -7.971  18.004  -3.049

  No H/Q in entry =          13
  In of MODEL    2
    1    H    MET  46           H        MET  46  -3.333  16.228  -9.792
    2    HA   MET  46           HA       MET  46  -5.652  15.028 -10.867
    3    HB2  MET  46           HB2      MET  46  -3.563  16.878 -12.026
    4    HB3  MET  46           HB3      MET  46  -4.926  16.302 -12.989
    5    HG2  MET  46           HG2      MET  46  -6.505  17.222 -11.367
    6    HG3  MET  46           HG3      MET  46  -5.181  17.723 -10.321
    7    HE3  MET  46           HE1      MET  46  -5.474  18.125 -14.434
    8    HE2  MET  46           HE2      MET  46  -6.609  19.462 -14.276
    9    HE1  MET  46           HE3      MET  46  -6.981  17.906 -13.534

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ALA  47           H        ALA  47  -2.213  14.586 -11.601
    2    HA   ALA  47           HA       ALA  47  -2.523  12.851 -13.811
    3    HB3  ALA  47           HB1      ALA  47  -0.358  13.766 -13.445
    4    HB2  ALA  47           HB2      ALA  47  -0.200  12.040 -13.108
    5    HB1  ALA  47           HB3      ALA  47  -0.315  13.193 -11.777

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU  48           H        LEU  48  -2.270  12.224 -10.334
    2    HA   LEU  48           HA       LEU  48  -2.331   9.383 -10.488
    3    HB2  LEU  48           HB2      LEU  48  -3.132  11.296  -8.283
    4    HB3  LEU  48           HB3      LEU  48  -3.020   9.547  -8.079
    5    HG   LEU  48           HG       LEU  48  -0.734  11.271  -9.063
    6   HD13  LEU  48          HD11      LEU  48  -1.040  12.041  -6.876
    7   HD12  LEU  48          HD12      LEU  48   0.136  10.747  -6.667
    8   HD11  LEU  48          HD13      LEU  48  -1.561  10.466  -6.280
    9   HD22  LEU  48          HD21      LEU  48  -0.206   9.090  -9.697
   10   HD21  LEU  48          HD22      LEU  48  -1.076   8.367  -8.345
   11   HD23  LEU  48          HD23      LEU  48   0.486   9.138  -8.076

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ASN  49           H        ASN  49  -4.826  11.848 -10.108
    2    HA   ASN  49           HA       ASN  49  -6.996  10.159  -9.581
    3    HB2  ASN  49           HB2      ASN  49  -7.078  12.584  -9.263
    4    HB3  ASN  49           HB3      ASN  49  -6.917  12.839 -10.997
    5   HD21  ASN  49          HD21      ASN  49  -9.141  13.881  -9.618
    6   HD22  ASN  49          HD22      ASN  49 -10.534  13.035 -10.088

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLU  50           H        GLU  50  -5.709  11.365 -12.661
    2    HA   GLU  50           HA       GLU  50  -7.637  10.085 -14.319
    3    HB2  GLU  50           HB2      GLU  50  -6.186  11.919 -15.126
    4    HB3  GLU  50           HB3      GLU  50  -4.781  10.863 -14.976
    5    HG2  GLU  50           HG2      GLU  50  -5.725   9.314 -16.617
    6    HG3  GLU  50           HG3      GLU  50  -7.197  10.275 -16.716

  No H/Q in entry =           6
  In of MODEL    2
    1    H    ALA  51           H        ALA  51  -4.464   9.131 -13.089
    2    HA   ALA  51           HA       ALA  51  -4.286   6.677 -14.502
    3    HB2  ALA  51           HB1      ALA  51  -2.310   6.414 -13.387
    4    HB1  ALA  51           HB2      ALA  51  -3.014   6.831 -11.825
    5    HB3  ALA  51           HB3      ALA  51  -2.565   8.105 -12.958

  No H/Q in entry =           5
  In of MODEL    2
    1    H    HIS  52           H        HIS  52  -5.491   7.501 -11.262
    2    HA   HIS  52           HA       HIS  52  -6.153   4.885 -10.431
    3    HB2  HIS  52           HB2      HIS  52  -6.047   6.855  -8.926
    4    HB3  HIS  52           HB3      HIS  52  -7.511   7.484  -9.681
    5    HD1  HIS  52           HD1      HIS  52  -9.697   5.932  -9.441
    6    HD2  HIS  52           HD2      HIS  52  -6.506   4.944  -6.949
    7    HE1  HIS  52           HE1      HIS  52 -10.638   4.428  -7.634
    8    HE2  HIS  52           HE2      HIS  52  -8.705   3.817  -6.105

  No H/Q in entry =           8
  In of MODEL    2
    1    H    LEU  53           H        LEU  53  -7.988   7.319 -12.236
    2    HA   LEU  53           HA       LEU  53 -10.479   6.000 -12.265
    3    HB2  LEU  53           HB2      LEU  53  -9.203   7.992 -14.127
    4    HB3  LEU  53           HB3      LEU  53 -10.791   7.308 -14.462
    5    HG   LEU  53           HG       LEU  53 -10.120   8.626 -11.812
    6   HD12  LEU  53          HD11      LEU  53 -11.450  10.574 -12.802
    7   HD11  LEU  53          HD12      LEU  53 -11.197   9.818 -14.375
    8   HD13  LEU  53          HD13      LEU  53  -9.818  10.363 -13.424
    9   HD21  LEU  53          HD21      LEU  53 -12.664   7.764 -13.207
   10   HD23  LEU  53          HD22      LEU  53 -12.689   9.000 -11.955
   11   HD22  LEU  53          HD23      LEU  53 -12.144   7.379 -11.572

  No H/Q in entry =          11
  In of MODEL    2
    1    H    VAL  54           H        VAL  54  -7.710   5.829 -14.482
    2    HA   VAL  54           HA       VAL  54  -8.900   4.042 -16.331
    3    HB   VAL  54           HB       VAL  54  -6.003   4.581 -15.628
    4   HG12  VAL  54          HG11      VAL  54  -5.727   3.495 -18.013
    5   HG11  VAL  54          HG12      VAL  54  -7.250   2.698 -17.620
    6   HG13  VAL  54          HG13      VAL  54  -5.839   2.460 -16.590
    7   HG22  VAL  54          HG21      VAL  54  -6.786   6.514 -16.682
    8   HG21  VAL  54          HG22      VAL  54  -7.963   5.636 -17.657
    9   HG23  VAL  54          HG23      VAL  54  -6.253   5.574 -18.075

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLN  55           H        GLN  55  -6.917   3.522 -13.415
    2    HA   GLN  55           HA       GLN  55  -6.795   0.706 -13.666
    3    HB2  GLN  55           HB2      GLN  55  -5.260   1.621 -12.137
    4    HB3  GLN  55           HB3      GLN  55  -6.493   2.575 -11.318
    5    HG2  GLN  55           HG2      GLN  55  -7.172   0.813 -10.003
    6    HG3  GLN  55           HG3      GLN  55  -6.926  -0.373 -11.277
    7   HE21  GLN  55          HE21      GLN  55  -5.291  -1.805 -10.768
    8   HE22  GLN  55          HE22      GLN  55  -3.917  -1.437  -9.847

  No H/Q in entry =           8
  In of MODEL    2
    1    H    THR  56           H        THR  56  -9.161   2.846 -12.073
    2    HA   THR  56           HA       THR  56 -10.734   0.949 -10.792
    3    HB   THR  56           HB       THR  56 -11.650   3.437 -12.264
    4    HG1  THR  56           HG1      THR  56 -10.067   3.418 -10.389
    5   HG21  THR  56          HG21      THR  56 -13.021   1.706 -10.193
    6   HG23  THR  56          HG22      THR  56 -13.542   1.974 -11.858
    7   HG22  THR  56          HG23      THR  56 -13.592   3.296 -10.691

  No H/Q in entry =           7
  In of MODEL    2
    1    H    LYS  57           H        LYS  57 -10.923   2.024 -14.181
    2    HA   LYS  57           HA       LYS  57 -13.056   0.313 -14.947
    3    HB2  LYS  57           HB2      LYS  57 -12.187   2.272 -16.260
    4    HB3  LYS  57           HB3      LYS  57 -10.739   1.342 -16.619
    5    HG2  LYS  57           HG2      LYS  57 -12.061  -0.337 -17.799
    6    HG3  LYS  57           HG3      LYS  57 -13.550   0.502 -17.379
    7    HD2  LYS  57           HD2      LYS  57 -13.053   1.163 -19.618
    8    HD3  LYS  57           HD3      LYS  57 -12.587   2.534 -18.613
    9    HE2  LYS  57           HE2      LYS  57 -10.260   1.972 -18.754
   10    HE3  LYS  57           HE3      LYS  57 -10.604   0.385 -19.441
   11    HZ1  LYS  57           HZ1      LYS  57 -11.822   2.007 -21.187
   12    HZ3  LYS  57           HZ2      LYS  57 -10.237   1.421 -21.367
   13    HZ2  LYS  57           HZ3      LYS  57 -10.506   2.971 -20.724

  No H/Q in entry =          13
  In of MODEL    2
    1    H    LEU  58           H        LEU  58  -9.547  -0.082 -14.863
    2    HA   LEU  58           HA       LEU  58  -9.520  -2.601 -16.147
    3    HB2  LEU  58           HB2      LEU  58  -7.513  -1.285 -14.326
    4    HB3  LEU  58           HB3      LEU  58  -7.230  -2.805 -15.175
    5    HG   LEU  58           HG       LEU  58  -8.000  -0.211 -16.550
    6   HD11  LEU  58          HD11      LEU  58  -5.346  -1.419 -15.836
    7   HD13  LEU  58          HD12      LEU  58  -5.859   0.267 -15.794
    8   HD12  LEU  58          HD13      LEU  58  -5.500  -0.504 -17.336
    9   HD22  LEU  58          HD21      LEU  58  -8.547  -1.782 -18.142
   10   HD21  LEU  58          HD22      LEU  58  -7.499  -3.018 -17.450
   11   HD23  LEU  58          HD23      LEU  58  -6.813  -1.739 -18.452

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  59           H        ILE  59 -10.375  -1.701 -12.904
    2    HA   ILE  59           HA       ILE  59 -10.002  -4.462 -11.948
    3    HB   ILE  59           HB       ILE  59  -9.595  -2.185 -10.552
    4   HG12  ILE  59          HG12      ILE  59 -10.941  -4.547  -9.226
    5   HG13  ILE  59          HG13      ILE  59  -9.298  -4.616  -9.810
    6   HG23  ILE  59          HG21      ILE  59 -11.445  -1.521  -9.248
    7   HG22  ILE  59          HG22      ILE  59 -12.362  -2.960  -9.631
    8   HG21  ILE  59          HG23      ILE  59 -12.138  -1.700 -10.842
    9   HD13  ILE  59          HD11      ILE  59  -9.336  -4.016  -7.438
   10   HD12  ILE  59          HD12      ILE  59 -10.353  -2.629  -7.799
   11   HD11  ILE  59          HD13      ILE  59  -8.694  -2.686  -8.396

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLU  60           H        GLU  60 -12.578  -2.176 -12.781
    2    HA   GLU  60           HA       GLU  60 -14.754  -3.713 -11.781
    3    HB2  GLU  60           HB2      GLU  60 -15.233  -1.457 -12.295
    4    HB3  GLU  60           HB3      GLU  60 -14.494  -1.572 -13.889
    5    HG2  GLU  60           HG2      GLU  60 -17.043  -1.560 -13.862
    6    HG3  GLU  60           HG3      GLU  60 -16.306  -2.890 -14.731

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLY  61           H        GLY  61 -13.057  -3.686 -14.883
    2    HA3  GLY  61           HA2      GLY  61 -14.739  -5.951 -15.782
    3    HA2  GLY  61           HA3      GLY  61 -13.898  -4.840 -16.856

  No H/Q in entry =           3
  In of MODEL    2
    1    H    ASP  62           H        ASP  62 -12.533  -6.270 -13.958
    2    HA   ASP  62           HA       ASP  62 -10.220  -7.170 -15.361
    3    HB2  ASP  62           HB2      ASP  62  -9.553  -8.049 -13.159
    4    HB3  ASP  62           HB3      ASP  62 -10.143  -6.396 -13.034

  No H/Q in entry =           4
  In of MODEL    2
    1    H    ALA  63           H        ALA  63 -11.533  -8.542 -16.975
    2    HA   ALA  63           HA       ALA  63 -12.725 -11.014 -16.172
    3    HB3  ALA  63           HB1      ALA  63 -12.518 -11.609 -18.557
    4    HB2  ALA  63           HB2      ALA  63 -11.405 -10.265 -18.807
    5    HB1  ALA  63           HB3      ALA  63 -13.091  -9.950 -18.392

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLY  64           H        GLY  64  -9.476 -10.053 -17.108
    2    HA3  GLY  64           HA2      GLY  64  -7.430 -11.053 -16.817
    3    HA2  GLY  64           HA3      GLY  64  -8.203 -12.164 -15.695

  No H/Q in entry =           3
  In of MODEL    2
    1    H    GLU  65           H        GLU  65  -6.550 -13.615 -16.827
    2    HA   GLU  65           HA       GLU  65  -6.908 -14.375 -19.513
    3    HB2  GLU  65           HB2      GLU  65  -5.722 -15.916 -17.204
    4    HB3  GLU  65           HB3      GLU  65  -5.607 -16.400 -18.896
    5    HG2  GLU  65           HG2      GLU  65  -4.638 -13.746 -17.799
    6    HG3  GLU  65           HG3      GLU  65  -3.602 -15.135 -18.122

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLY  66           H        GLY  66  -8.248 -15.643 -16.555
    2    HA3  GLY  66           HA2      GLY  66  -9.998 -17.478 -18.050
    3    HA2  GLY  66           HA3      GLY  66  -9.510 -17.701 -16.382

  No H/Q in entry =           3
  In of MODEL    2
    1    H    LYS  67           H        LYS  67 -11.975 -18.036 -16.500
    2    HA   LYS  67           HA       LYS  67 -13.746 -15.888 -16.742
    3    HB2  LYS  67           HB2      LYS  67 -14.070 -18.407 -15.108
    4    HB3  LYS  67           HB3      LYS  67 -15.372 -17.353 -15.675
    5    HG2  LYS  67           HG2      LYS  67 -13.362 -18.673 -17.522
    6    HG3  LYS  67           HG3      LYS  67 -14.944 -19.358 -17.156
    7    HD2  LYS  67           HD2      LYS  67 -15.868 -17.041 -17.904
    8    HD3  LYS  67           HD3      LYS  67 -14.287 -16.838 -18.663
    9    HE2  LYS  67           HE2      LYS  67 -15.513 -17.843 -20.386
   10    HE3  LYS  67           HE3      LYS  67 -14.737 -19.235 -19.628
   11    HZ1  LYS  67           HZ1      LYS  67 -17.089 -18.756 -18.234
   12    HZ3  LYS  67           HZ2      LYS  67 -16.739 -20.062 -19.260
   13    HZ2  LYS  67           HZ3      LYS  67 -17.487 -18.669 -19.881

  No H/Q in entry =          13
  In of MODEL    2
    1    H    MET  68           H        MET  68 -13.237 -17.513 -13.678
    2    HA   MET  68           HA       MET  68 -14.113 -15.382 -12.061
    3    HB2  MET  68           HB2      MET  68 -12.475 -17.823 -11.373
    4    HB3  MET  68           HB3      MET  68 -13.249 -16.760 -10.198
    5    HG2  MET  68           HG2      MET  68 -14.707 -18.249 -12.400
    6    HG3  MET  68           HG3      MET  68 -14.636 -18.762 -10.713
    7    HE2  MET  68           HE1      MET  68 -14.995 -15.954  -8.987
    8    HE1  MET  68           HE2      MET  68 -15.350 -17.674  -8.846
    9    HE3  MET  68           HE3      MET  68 -16.654 -16.498  -8.699

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LYS  69           H        LYS  69 -10.789 -16.386 -12.920
    2    HA   LYS  69           HA       LYS  69  -9.487 -14.724 -11.059
    3    HB2  LYS  69           HB2      LYS  69  -8.548 -15.988 -13.630
    4    HB3  LYS  69           HB3      LYS  69  -7.471 -15.104 -12.546
    5    HG2  LYS  69           HG2      LYS  69  -8.093 -16.608 -10.691
    6    HG3  LYS  69           HG3      LYS  69  -9.181 -17.486 -11.763
    7    HD2  LYS  69           HD2      LYS  69  -7.277 -18.120 -13.193
    8    HD3  LYS  69           HD3      LYS  69  -6.181 -17.234 -12.130
    9    HE2  LYS  69           HE2      LYS  69  -6.825 -18.695 -10.246
   10    HE3  LYS  69           HE3      LYS  69  -7.911 -19.586 -11.310
   11    HZ1  LYS  69           HZ1      LYS  69  -5.779 -19.847 -12.739
   12    HZ3  LYS  69           HZ2      LYS  69  -6.023 -20.857 -11.396
   13    HZ2  LYS  69           HZ3      LYS  69  -4.972 -19.526 -11.282

  No H/Q in entry =          13
  In of MODEL    2
    1    H    VAL  70           H        VAL  70  -7.659 -13.130 -11.924
    2    HA   VAL  70           HA       VAL  70  -8.904 -11.113 -13.703
    3    HB   VAL  70           HB       VAL  70  -8.002  -9.374 -12.174
    4   HG12  VAL  70          HG11      VAL  70  -9.844 -11.375 -10.830
    5   HG11  VAL  70          HG12      VAL  70 -10.354 -10.162 -12.006
    6   HG13  VAL  70          HG13      VAL  70  -9.720  -9.660 -10.440
    7   HG22  VAL  70          HG21      VAL  70  -6.223 -10.362 -10.986
    8   HG21  VAL  70          HG22      VAL  70  -7.143 -11.828 -10.655
    9   HG23  VAL  70          HG23      VAL  70  -7.501 -10.345  -9.771

  No H/Q in entry =           9
  In of MODEL    2
    1    H    SER  71           H        SER  71  -7.300  -9.540 -14.521
    2    HA   SER  71           HA       SER  71  -5.077 -10.796 -15.743
    3    HB2  SER  71           HB2      SER  71  -6.196  -8.791 -16.679
    4    HB3  SER  71           HB3      SER  71  -5.602  -7.841 -15.319
    5    HG   SER  71           HG       SER  71  -3.937  -9.334 -17.066

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU  72           H        LEU  72  -3.020 -11.013 -15.124
    2    HA   LEU  72           HA       LEU  72  -2.323 -10.784 -12.407
    3    HB2  LEU  72           HB2      LEU  72  -0.641 -11.198 -14.874
    4    HB3  LEU  72           HB3      LEU  72   0.002 -11.270 -13.237
    5    HG   LEU  72           HG       LEU  72  -2.330 -12.975 -14.165
    6   HD12  LEU  72          HD11      LEU  72  -0.584 -14.813 -14.229
    7   HD11  LEU  72          HD12      LEU  72   0.643 -13.551 -14.131
    8   HD13  LEU  72          HD13      LEU  72  -0.445 -13.617 -15.518
    9   HD22  LEU  72          HD21      LEU  72  -2.341 -12.999 -11.815
   10   HD21  LEU  72          HD22      LEU  72  -0.594 -12.863 -11.694
   11   HD23  LEU  72          HD23      LEU  72  -1.326 -14.387 -12.188

  No H/Q in entry =          11
  In of MODEL    2
    1    H    VAL  73           H        VAL  73  -1.605  -8.768 -15.187
    2    HA   VAL  73           HA       VAL  73   0.290  -7.048 -14.073
    3    HB   VAL  73           HB       VAL  73  -0.108  -5.634 -15.935
    4   HG11  VAL  73          HG11      VAL  73   0.748  -7.983 -16.370
    5   HG13  VAL  73          HG12      VAL  73   0.004  -7.193 -17.760
    6   HG12  VAL  73          HG13      VAL  73  -0.893  -8.410 -16.853
    7   HG21  VAL  73          HG21      VAL  73  -2.853  -6.831 -15.793
    8   HG23  VAL  73          HG22      VAL  73  -2.253  -6.266 -17.352
    9   HG22  VAL  73          HG23      VAL  73  -2.381  -5.143 -15.998

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LEU  74           H        LEU  74  -3.110  -7.195 -13.542
    2    HA   LEU  74           HA       LEU  74  -3.759  -4.544 -12.941
    3    HB2  LEU  74           HB2      LEU  74  -5.470  -6.226 -13.124
    4    HB3  LEU  74           HB3      LEU  74  -4.781  -7.140 -11.785
    5    HG   LEU  74           HG       LEU  74  -5.272  -5.263 -10.251
    6   HD13  LEU  74          HD11      LEU  74  -5.168  -3.335 -11.633
    7   HD12  LEU  74          HD12      LEU  74  -6.876  -3.498 -11.231
    8   HD11  LEU  74          HD13      LEU  74  -6.288  -4.019 -12.811
    9   HD23  LEU  74          HD21      LEU  74  -7.816  -5.718 -11.720
   10   HD22  LEU  74          HD22      LEU  74  -7.447  -5.865 -10.016
   11   HD21  LEU  74          HD23      LEU  74  -6.949  -7.127 -11.116

  No H/Q in entry =          11
  In of MODEL    2
    1    H    VAL  75           H        VAL  75  -2.710  -7.115 -10.765
    2    HA   VAL  75           HA       VAL  75  -2.545  -5.556  -8.423
    3    HB   VAL  75           HB       VAL  75  -1.029  -8.043  -9.200
    4   HG13  VAL  75          HG11      VAL  75   0.233  -6.807  -7.478
    5   HG12  VAL  75          HG12      VAL  75  -0.576  -8.178  -6.732
    6   HG11  VAL  75          HG13      VAL  75  -1.241  -6.564  -6.547
    7   HG21  VAL  75          HG21      VAL  75  -3.487  -7.461  -7.513
    8   HG23  VAL  75          HG22      VAL  75  -2.679  -9.028  -7.557
    9   HG22  VAL  75          HG23      VAL  75  -3.434  -8.382  -9.016

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLU  76           H        GLU  76  -0.109  -6.299 -10.939
    2    HA   GLU  76           HA       GLU  76   2.055  -4.928  -9.767
    3    HB2  GLU  76           HB2      GLU  76   2.254  -6.416 -11.759
    4    HB3  GLU  76           HB3      GLU  76   1.388  -5.226 -12.719
    5    HG2  GLU  76           HG2      GLU  76   3.184  -3.583 -12.341
    6    HG3  GLU  76           HG3      GLU  76   4.064  -4.732 -11.353

  No H/Q in entry =           6
  In of MODEL    2
    1    H    ALA  77           H        ALA  77  -0.471  -3.757 -11.979
    2    HA   ALA  77           HA       ALA  77   0.495  -1.102 -12.154
    3    HB3  ALA  77           HB1      ALA  77  -2.354  -2.109 -12.412
    4    HB1  ALA  77           HB2      ALA  77  -1.169  -2.045 -13.718
    5    HB2  ALA  77           HB3      ALA  77  -1.752  -0.552 -12.983

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLN  78           H        GLN  78  -1.776  -2.674  -9.957
    2    HA   GLN  78           HA       GLN  78  -2.617  -0.360  -8.568
    3    HB2  GLN  78           HB2      GLN  78  -3.704  -2.631  -8.487
    4    HB3  GLN  78           HB3      GLN  78  -2.371  -3.173  -7.470
    5    HG2  GLN  78           HG2      GLN  78  -2.922  -1.441  -5.816
    6    HG3  GLN  78           HG3      GLN  78  -4.251  -0.884  -6.831
    7   HE21  GLN  78          HE21      GLN  78  -4.730  -1.866  -4.177
    8   HE22  GLN  78          HE22      GLN  78  -5.587  -3.326  -4.300

  No H/Q in entry =           8
  In of MODEL    2
    1    H    LEU  79           H        LEU  79   0.080  -2.587  -8.091
    2    HA   LEU  79           HA       LEU  79   1.027  -1.674  -5.628
    3    HB2  LEU  79           HB2      LEU  79   1.927  -3.677  -6.684
    4    HB3  LEU  79           HB3      LEU  79   2.574  -2.722  -8.014
    5    HG   LEU  79           HG       LEU  79   4.105  -1.563  -6.501
    6   HD13  LEU  79          HD11      LEU  79   3.082  -1.323  -4.443
    7   HD12  LEU  79          HD12      LEU  79   4.171  -2.660  -4.087
    8   HD11  LEU  79          HD13      LEU  79   2.472  -2.978  -4.429
    9   HD23  LEU  79          HD21      LEU  79   5.331  -3.696  -5.583
   10   HD22  LEU  79          HD22      LEU  79   5.140  -3.503  -7.323
   11   HD21  LEU  79          HD23      LEU  79   4.066  -4.582  -6.436

  No H/Q in entry =          11
  In of MODEL    2
    1    H    HIS  80           H        HIS  80   1.912  -0.557  -8.897
    2    HA   HIS  80           HA       HIS  80   3.691   1.453  -7.965
    3    HB2  HIS  80           HB2      HIS  80   2.430   0.738 -10.556
    4    HB3  HIS  80           HB3      HIS  80   3.005   2.397 -10.385
    5    HD1  HIS  80           HD1      HIS  80   5.408   2.722 -10.888
    6    HD2  HIS  80           HD2      HIS  80   4.622  -1.194  -9.694
    7    HE1  HIS  80           HE1      HIS  80   7.613   1.469 -11.033
    8    HE2  HIS  80           HE2      HIS  80   7.145  -0.921 -10.308

  No H/Q in entry =           8
  In of MODEL    2
    1    H    LEU  81           H        LEU  81   0.294   1.572  -8.973
    2    HA   LEU  81           HA       LEU  81  -0.016   4.363  -8.652
    3    HB2  LEU  81           HB2      LEU  81  -2.005   2.095  -8.583
    4    HB3  LEU  81           HB3      LEU  81  -2.478   3.793  -8.499
    5    HG   LEU  81           HG       LEU  81  -0.753   2.657 -10.718
    6   HD12  LEU  81          HD11      LEU  81  -2.978   2.948 -12.037
    7   HD11  LEU  81          HD12      LEU  81  -3.746   2.874 -10.451
    8   HD13  LEU  81          HD13      LEU  81  -2.783   1.516 -11.027
    9   HD23  LEU  81          HD21      LEU  81  -1.866   4.786 -11.830
   10   HD22  LEU  81          HD22      LEU  81  -0.460   4.975 -10.786
   11   HD21  LEU  81          HD23      LEU  81  -2.074   5.306 -10.159

  No H/Q in entry =          11
  In of MODEL    2
    1    H    MET  82           H        MET  82  -0.662   1.674  -6.401
    2    HA   MET  82           HA       MET  82  -1.750   3.252  -4.327
    3    HB2  MET  82           HB2      MET  82  -0.345   0.582  -4.348
    4    HB3  MET  82           HB3      MET  82  -0.944   1.303  -2.857
    5    HG2  MET  82           HG2      MET  82  -2.651   0.784  -5.311
    6    HG3  MET  82           HG3      MET  82  -2.571  -0.286  -3.913
    7    HE3  MET  82           HE1      MET  82  -4.337   1.350  -1.116
    8    HE2  MET  82           HE2      MET  82  -2.609   1.648  -1.287
    9    HE1  MET  82           HE3      MET  82  -3.274   0.081  -1.743

  No H/Q in entry =           9
  In of MODEL    2
    1    H    THR  83           H        THR  83   1.569   2.205  -4.987
    2    HA   THR  83           HA       THR  83   2.754   3.329  -2.679
    3    HB   THR  83           HB       THR  83   4.862   3.295  -4.135
    4    HG1  THR  83           HG1      THR  83   4.645   2.761  -6.160
    5   HG22  THR  83          HG21      THR  83   4.452   0.631  -4.464
    6   HG21  THR  83          HG22      THR  83   3.149   0.997  -3.336
    7   HG23  THR  83          HG23      THR  83   4.820   1.362  -2.903

  No H/Q in entry =           7
  In of MODEL    2
    1    H    SER  84           H        SER  84   2.396   4.596  -5.985
    2    HA   SER  84           HA       SER  84   3.702   7.053  -5.525
    3    HB2  SER  84           HB2      SER  84   1.659   6.191  -7.559
    4    HB3  SER  84           HB3      SER  84   2.317   7.826  -7.532
    5    HG   SER  84           HG       SER  84   3.722   5.367  -7.806

  No H/Q in entry =           5
  In of MODEL    2
    1    H    MET  85           H        MET  85   0.216   6.255  -5.380
    2    HA   MET  85           HA       MET  85  -0.682   8.856  -4.792
    3    HB2  MET  85           HB2      MET  85  -2.177   7.029  -5.470
    4    HB3  MET  85           HB3      MET  85  -1.892   6.229  -3.924
    5    HG2  MET  85           HG2      MET  85  -2.824   8.165  -2.729
    6    HG3  MET  85           HG3      MET  85  -3.067   9.003  -4.260
    7    HE2  MET  85           HE1      MET  85  -5.263   5.490  -2.438
    8    HE1  MET  85           HE2      MET  85  -3.622   6.059  -2.144
    9    HE3  MET  85           HE3      MET  85  -3.942   4.978  -3.497

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LEU  86           H        LEU  86   0.251   6.210  -2.635
    2    HA   LEU  86           HA       LEU  86  -0.317   7.512  -0.200
    3    HB2  LEU  86           HB2      LEU  86   0.178   5.045  -0.585
    4    HB3  LEU  86           HB3      LEU  86   1.881   5.494  -0.667
    5    HG   LEU  86           HG       LEU  86   1.525   6.656   1.596
    6   HD11  LEU  86          HD11      LEU  86  -1.157   5.859   1.105
    7   HD13  LEU  86          HD12      LEU  86  -0.511   6.617   2.559
    8   HD12  LEU  86          HD13      LEU  86  -0.582   4.860   2.443
    9   HD23  LEU  86          HD21      LEU  86   1.128   3.660   1.721
   10   HD22  LEU  86          HD22      LEU  86   2.111   4.682   2.767
   11   HD21  LEU  86          HD23      LEU  86   2.629   4.360   1.113

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ALA  87           H        ALA  87   2.682   7.246  -2.065
    2    HA   ALA  87           HA       ALA  87   4.359   8.678  -0.329
    3    HB3  ALA  87           HB1      ALA  87   4.487   7.661  -3.033
    4    HB2  ALA  87           HB2      ALA  87   5.808   8.008  -1.922
    5    HB1  ALA  87           HB3      ALA  87   5.189   9.280  -2.974

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ARG  88           H        ARG  88   2.422   9.788  -3.067
    2    HA   ARG  88           HA       ARG  88   3.167  12.486  -2.950
    3    HB2  ARG  88           HB2      ARG  88   1.940  11.317  -4.815
    4    HB3  ARG  88           HB3      ARG  88   0.474  11.447  -3.844
    5    HG2  ARG  88           HG2      ARG  88   1.466  14.038  -3.758
    6    HG3  ARG  88           HG3      ARG  88   1.909  13.525  -5.384
    7    HD2  ARG  88           HD2      ARG  88  -0.228  13.582  -6.099
    8    HD3  ARG  88           HD3      ARG  88  -0.818  12.726  -4.674
    9    HE   ARG  88           HE       ARG  88  -1.031  15.501  -5.099
   10   HH21  ARG  88          HH11      ARG  88  -1.586  16.828  -3.368
   11   HH22  ARG  88          HH12      ARG  88  -1.297  16.297  -1.747
   12   HH11  ARG  88          HH21      ARG  88  -0.012  13.253  -2.712
   13   HH12  ARG  88          HH22      ARG  88  -0.424  14.267  -1.376

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLU  89           H        GLU  89   0.467  10.788  -1.328
    2    HA   GLU  89           HA       GLU  89  -0.672  13.091  -0.137
    3    HB2  GLU  89           HB2      GLU  89  -1.768  10.841  -0.228
    4    HB3  GLU  89           HB3      GLU  89  -0.649  10.299   1.023
    5    HG2  GLU  89           HG2      GLU  89  -1.497  11.993   2.572
    6    HG3  GLU  89           HG3      GLU  89  -2.546  12.651   1.319

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LEU  90           H        LEU  90   1.791  10.825   1.061
    2    HA   LEU  90           HA       LEU  90   2.115  12.077   3.591
    3    HB2  LEU  90           HB2      LEU  90   3.918  10.316   1.931
    4    HB3  LEU  90           HB3      LEU  90   4.319  10.840   3.572
    5    HG   LEU  90           HG       LEU  90   1.702   9.469   2.893
    6   HD12  LEU  90          HD11      LEU  90   2.853   7.435   3.914
    7   HD11  LEU  90          HD12      LEU  90   4.369   8.304   3.683
    8   HD13  LEU  90          HD13      LEU  90   3.372   7.885   2.289
    9   HD22  LEU  90          HD21      LEU  90   1.413  10.393   5.011
   10   HD21  LEU  90          HD22      LEU  90   3.128  10.302   5.407
   11   HD23  LEU  90          HD23      LEU  90   2.135   8.846   5.450

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  91           H        ILE  91   3.740  12.468   0.476
    2    HA   ILE  91           HA       ILE  91   5.694  14.318   1.328
    3    HB   ILE  91           HB       ILE  91   4.408  13.812  -1.361
    4   HG12  ILE  91          HG12      ILE  91   7.237  13.351  -0.364
    5   HG13  ILE  91          HG13      ILE  91   5.964  12.142  -0.209
    6   HG22  ILE  91          HG21      ILE  91   6.624  15.177  -2.035
    7   HG21  ILE  91          HG22      ILE  91   6.295  15.977  -0.497
    8   HG23  ILE  91          HG23      ILE  91   5.082  15.993  -1.776
    9   HD13  ILE  91          HD11      ILE  91   5.812  11.813  -2.517
   10   HD12  ILE  91          HD12      ILE  91   7.542  12.072  -2.290
   11   HD11  ILE  91          HD13      ILE  91   6.525  13.385  -2.887

  No H/Q in entry =          11
  In of MODEL    2
    1    H    THR  92           H        THR  92   2.336  14.720   0.293
    2    HA   THR  92           HA       THR  92   2.287  17.543   0.227
    3    HB   THR  92           HB       THR  92   0.131  15.531   0.913
    4    HG1  THR  92           HG1      THR  92   0.453  15.352  -1.169
    5   HG22  THR  92          HG21      THR  92  -1.282  17.680   0.176
    6   HG21  THR  92          HG22      THR  92   0.097  18.518   0.883
    7   HG23  THR  92          HG23      THR  92  -0.842  17.391   1.859

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLU  93           H        GLU  93   1.737  15.243   2.881
    2    HA   GLU  93           HA       GLU  93   1.173  17.146   4.892
    3    HB2  GLU  93           HB2      GLU  93   2.507  14.432   5.143
    4    HB3  GLU  93           HB3      GLU  93   1.798  15.356   6.469
    5    HG2  GLU  93           HG2      GLU  93   0.212  14.561   4.019
    6    HG3  GLU  93           HG3      GLU  93   0.310  13.541   5.449

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LEU  94           H        LEU  94   4.201  15.687   3.768
    2    HA   LEU  94           HA       LEU  94   5.927  16.852   5.668
    3    HB2  LEU  94           HB2      LEU  94   6.359  15.883   2.842
    4    HB3  LEU  94           HB3      LEU  94   7.676  16.553   3.801
    5    HG   LEU  94           HG       LEU  94   5.945  14.345   4.926
    6   HD11  LEU  94          HD11      LEU  94   8.059  14.133   2.812
    7   HD13  LEU  94          HD12      LEU  94   6.619  13.148   3.063
    8   HD12  LEU  94          HD13      LEU  94   8.039  12.908   4.082
    9   HD23  LEU  94          HD21      LEU  94   8.130  13.829   6.097
   10   HD22  LEU  94          HD22      LEU  94   7.447  15.402   6.505
   11   HD21  LEU  94          HD23      LEU  94   8.795  15.291   5.373

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  95           H        ILE  95   4.803  18.009   2.507
    2    HA   ILE  95           HA       ILE  95   6.356  20.379   2.456
    3    HB   ILE  95           HB       ILE  95   3.728  19.671   1.131
    4   HG12  ILE  95          HG12      ILE  95   6.523  20.029   0.015
    5   HG13  ILE  95          HG13      ILE  95   5.882  18.472   0.528
    6   HG21  ILE  95          HG21      ILE  95   5.459  22.152   0.920
    7   HG23  ILE  95          HG22      ILE  95   3.732  22.071   1.263
    8   HG22  ILE  95          HG23      ILE  95   4.331  21.672  -0.348
    9   HD13  ILE  95          HD11      ILE  95   4.337  18.380  -1.214
   10   HD12  ILE  95          HD12      ILE  95   5.685  19.208  -1.992
   11   HD11  ILE  95          HD13      ILE  95   4.301  20.132  -1.412

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLU  96           H        GLU  96   3.103  19.703   3.726
    2    HA   GLU  96           HA       GLU  96   2.455  22.346   4.468
    3    HB2  GLU  96           HB2      GLU  96   0.795  20.549   4.470
    4    HB3  GLU  96           HB3      GLU  96   1.653  19.731   5.773
    5    HG2  GLU  96           HG2      GLU  96   0.610  21.009   7.332
    6    HG3  GLU  96           HG3      GLU  96   1.140  22.485   6.537

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LEU  97           H        LEU  97   4.305  19.813   6.112
    2    HA   LEU  97           HA       LEU  97   4.632  21.168   8.583
    3    HB2  LEU  97           HB2      LEU  97   6.198  19.009   7.185
    4    HB3  LEU  97           HB3      LEU  97   6.770  19.701   8.701
    5    HG   LEU  97           HG       LEU  97   3.972  18.585   8.369
    6   HD12  LEU  97          HD11      LEU  97   4.918  16.582   9.593
    7   HD11  LEU  97          HD12      LEU  97   6.527  17.225   9.261
    8   HD13  LEU  97          HD13      LEU  97   5.471  16.757   7.927
    9   HD23  LEU  97          HD21      LEU  97   4.407  18.299  10.938
   10   HD22  LEU  97          HD22      LEU  97   4.019  19.906  10.328
   11   HD21  LEU  97          HD23      LEU  97   5.691  19.480  10.687

  No H/Q in entry =          11
  In of MODEL    2
    1    H    HIS  98           H        HIS  98   6.527  21.193   5.573
    2    HA   HIS  98           HA       HIS  98   8.661  22.791   6.486
    3    HB2  HIS  98           HB2      HIS  98   7.392  22.521   3.750
    4    HB3  HIS  98           HB3      HIS  98   8.822  23.511   4.051
    5    HD1  HIS  98           HD1      HIS  98   7.638  19.932   4.067
    6    HD2  HIS  98           HD2      HIS  98  11.199  22.056   4.517
    7    HE1  HIS  98           HE1      HIS  98   9.506  18.216   4.028
    8    HE2  HIS  98           HE2      HIS  98  11.679  19.489   4.302

  No H/Q in entry =           8
  In of MODEL    2
    1    H    GLU  99           H        GLU  99   5.444  23.600   5.284
    2    HA   GLU  99           HA       GLU  99   5.802  26.417   5.224
    3    HB2  GLU  99           HB2      GLU  99   3.941  25.232   4.080
    4    HB3  GLU  99           HB3      GLU  99   3.235  24.868   5.655
    5    HG2  GLU  99           HG2      GLU  99   3.033  27.260   6.150
    6    HG3  GLU  99           HG3      GLU  99   3.818  27.663   4.626

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LYS 100           H        LYS 100   4.668  24.178   7.741
    2    HA   LYS 100           HA       LYS 100   4.051  26.231   9.626
    3    HB2  LYS 100           HB2      LYS 100   4.645  23.284   9.982
    4    HB3  LYS 100           HB3      LYS 100   4.180  24.356  11.309
    5    HG2  LYS 100           HG2      LYS 100   2.119  24.976  10.043
    6    HG3  LYS 100           HG3      LYS 100   2.565  23.809   8.796
    7    HD2  LYS 100           HD2      LYS 100   2.487  21.990  10.460
    8    HD3  LYS 100           HD3      LYS 100   2.058  23.152  11.718
    9    HE2  LYS 100           HE2      LYS 100   0.011  23.756  10.438
   10    HE3  LYS 100           HE3      LYS 100   0.429  22.537   9.227
   11    HZ1  LYS 100           HZ1      LYS 100   0.146  21.874  12.107
   12    HZ3  LYS 100           HZ2      LYS 100   0.148  20.817  10.774
   13    HZ2  LYS 100           HZ3      LYS 100  -1.177  21.848  11.041

  No H/Q in entry =          13
  In of MODEL    2
    1    H    LEU 101           H        LEU 101   6.994  24.455   8.819
    2    HA   LEU 101           HA       LEU 101   8.569  25.310  11.034
    3    HB2  LEU 101           HB2      LEU 101   9.193  24.323   8.262
    4    HB3  LEU 101           HB3      LEU 101  10.482  24.999   9.253
    5    HG   LEU 101           HG       LEU 101   8.657  22.831  10.305
    6   HD12  LEU 101          HD11      LEU 101  10.726  21.350   9.716
    7   HD11  LEU 101          HD12      LEU 101  11.093  22.613   8.544
    8   HD13  LEU 101          HD13      LEU 101   9.571  21.730   8.440
    9   HD21  LEU 101          HD21      LEU 101  11.367  23.960  11.053
   10   HD23  LEU 101          HD22      LEU 101  10.830  22.384  11.631
   11   HD22  LEU 101          HD23      LEU 101   9.925  23.835  12.059

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LYS 102           H        LYS 102   6.990  27.159   8.877
    2    HA   LYS 102           HA       LYS 102   7.054  29.452   8.582
    3    HB2  LYS 102           HB2      LYS 102   8.603  29.350  10.693
    4    HB3  LYS 102           HB3      LYS 102   9.910  29.552   9.544
    5    HG2  LYS 102           HG2      LYS 102   7.785  31.492  10.385
    6    HG3  LYS 102           HG3      LYS 102   9.497  31.763  10.147
    7    HD2  LYS 102           HD2      LYS 102   7.567  31.323   7.832
    8    HD3  LYS 102           HD3      LYS 102   7.934  32.906   8.501
    9    HE2  LYS 102           HE2      LYS 102   9.332  31.728   6.441
   10    HE3  LYS 102           HE3      LYS 102   9.931  33.040   7.455
   11    HZ2  LYS 102           HZ1      LYS 102  11.466  31.145   7.295
   12    HZ1  LYS 102           HZ2      LYS 102  10.305  30.156   8.030
   13    HZ3  LYS 102           HZ3      LYS 102  10.981  31.449   8.892

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ALA 103           H        ALA 103  10.324  28.133   8.046
    2    HA   ALA 103           HA       ALA 103  11.296  29.513   5.975
    3    HB2  ALA 103           HB1      ALA 103  12.203  27.304   5.058
    4    HB1  ALA 103           HB2      ALA 103  11.303  26.526   6.358
    5    HB3  ALA 103           HB3      ALA 103  12.582  27.679   6.740

  No H/Q in entry =           5
  In of MODEL    2
    1    H1   LYS   3           H1       LYS   3 -31.493   6.349 -19.411
    2    H2   LYS   3           H3       LYS   3 -30.535   6.059 -20.782
    3    H3   LYS   3           H2       LYS   3 -31.929   5.130 -20.509
    4    HA   LYS   3           HA       LYS   3 -30.906   3.730 -19.132
    5    HB2  LYS   3           HB2      LYS   3 -28.644   5.135 -20.506
    6    HB3  LYS   3           HB3      LYS   3 -28.300   3.921 -19.274
    7    HG2  LYS   3           HG2      LYS   3 -29.760   2.347 -20.600
    8    HG3  LYS   3           HG3      LYS   3 -29.734   3.551 -21.887
    9    HD2  LYS   3           HD2      LYS   3 -27.252   3.423 -21.888
   10    HD3  LYS   3           HD3      LYS   3 -27.353   2.121 -20.704
   11    HE2  LYS   3           HE2      LYS   3 -28.894   0.961 -22.393
   12    HE3  LYS   3           HE3      LYS   3 -28.291   2.139 -23.557
   13    HZ3  LYS   3           HZ1      LYS   3 -26.506   0.901 -23.868
   14    HZ2  LYS   3           HZ2      LYS   3 -27.121  -0.267 -22.800
   15    HZ1  LYS   3           HZ3      LYS   3 -26.112   0.969 -22.218

  No H/Q in entry =          15
  In of MODEL    2
    1    H    LYS   4           H        LYS   4 -30.917   3.582 -17.070
    2    HA   LYS   4           HA       LYS   4 -30.138   5.858 -15.428
    3    HB2  LYS   4           HB2      LYS   4 -31.342   3.170 -14.712
    4    HB3  LYS   4           HB3      LYS   4 -31.088   4.503 -13.586
    5    HG2  LYS   4           HG2      LYS   4 -32.947   4.462 -15.970
    6    HG3  LYS   4           HG3      LYS   4 -33.401   4.509 -14.268
    7    HD2  LYS   4           HD2      LYS   4 -32.685   6.726 -14.008
    8    HD3  LYS   4           HD3      LYS   4 -31.675   6.666 -15.453
    9    HE2  LYS   4           HE2      LYS   4 -33.601   8.054 -15.870
   10    HE3  LYS   4           HE3      LYS   4 -33.711   6.586 -16.842
   11    HZ3  LYS   4           HZ1      LYS   4 -35.261   5.680 -15.266
   12    HZ2  LYS   4           HZ2      LYS   4 -35.818   7.181 -15.833
   13    HZ1  LYS   4           HZ3      LYS   4 -35.129   7.059 -14.285

  No H/Q in entry =          13
  In of MODEL    2
    1    H    HIS   5           H        HIS   5 -28.636   5.927 -13.866
    2    HA   HIS   5           HA       HIS   5 -26.375   4.082 -14.252
    3    HB2  HIS   5           HB2      HIS   5 -26.583   6.834 -13.031
    4    HB3  HIS   5           HB3      HIS   5 -25.109   5.868 -13.048
    5    HD1  HIS   5           HD1      HIS   5 -23.662   7.062 -14.664
    6    HD2  HIS   5           HD2      HIS   5 -27.500   6.477 -16.141
    7    HE1  HIS   5           HE1      HIS   5 -23.541   7.649 -17.115
    8    HE2  HIS   5           HE2      HIS   5 -25.880   7.280 -17.984

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ILE   6           H        ILE   6 -26.132   2.503 -12.945
    2    HA   ILE   6           HA       ILE   6 -27.047   2.769 -10.161
    3    HB   ILE   6           HB       ILE   6 -26.275   0.301 -11.722
    4   HG12  ILE   6          HG12      ILE   6 -28.992   1.258 -10.812
    5   HG13  ILE   6          HG13      ILE   6 -28.382   1.419 -12.458
    6   HG23  ILE   6          HG21      ILE   6 -26.620  -0.955  -9.859
    7   HG22  ILE   6          HG22      ILE   6 -27.753   0.199  -9.152
    8   HG21  ILE   6          HG23      ILE   6 -26.019   0.520  -9.098
    9   HD13  ILE   6          HD11      ILE   6 -28.870  -0.694 -12.956
   10   HD12  ILE   6          HD12      ILE   6 -29.856  -0.674 -11.493
   11   HD11  ILE   6          HD13      ILE   6 -28.206  -1.295 -11.437

  No H/Q in entry =          11
  In of MODEL    2
    1    H    TYR   7           H        TYR   7 -25.256   3.390  -8.909
    2    HA   TYR   7           HA       TYR   7 -22.568   2.411  -9.648
    3    HB2  TYR   7           HB2      TYR   7 -23.478   4.849  -8.139
    4    HB3  TYR   7           HB3      TYR   7 -21.799   4.319  -8.214
    5    HD1  TYR   7           HD1      TYR   7 -22.912   3.396 -11.285
    6    HD2  TYR   7           HD2      TYR   7 -22.164   6.955  -9.062
    7    HE1  TYR   7           HE1      TYR   7 -22.513   4.629 -13.381
    8    HE2  TYR   7           HE2      TYR   7 -21.806   8.193 -11.148
    9    HH   TYR   7           HH       TYR   7 -22.071   8.117 -13.376

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LEU   8           H        LEU   8 -21.587   1.046  -8.343
    2    HA   LEU   8           HA       LEU   8 -22.666   0.552  -5.639
    3    HB2  LEU   8           HB2      LEU   8 -21.017  -1.120  -7.514
    4    HB3  LEU   8           HB3      LEU   8 -21.171  -1.506  -5.800
    5    HG   LEU   8           HG       LEU   8 -23.660  -1.654  -6.171
    6   HD13  LEU   8          HD11      LEU   8 -23.823  -0.430  -8.273
    7   HD12  LEU   8          HD12      LEU   8 -24.373  -2.088  -8.508
    8   HD11  LEU   8          HD13      LEU   8 -22.772  -1.603  -9.064
    9   HD23  LEU   8          HD21      LEU   8 -22.440  -3.701  -7.897
   10   HD22  LEU   8          HD22      LEU   8 -23.500  -3.864  -6.497
   11   HD21  LEU   8          HD23      LEU   8 -21.785  -3.527  -6.270

  No H/Q in entry =          11
  In of MODEL    2
    1    H    PHE   9           H        PHE   9 -21.355   0.922  -3.878
    2    HA   PHE   9           HA       PHE   9 -18.568   1.828  -4.433
    3    HB2  PHE   9           HB2      PHE   9 -20.536   2.913  -2.423
    4    HB3  PHE   9           HB3      PHE   9 -18.823   3.308  -2.433
    5    HD1  PHE   9           HD1      PHE   9 -17.842   4.627  -4.239
    6    HD2  PHE   9           HD2      PHE   9 -22.042   3.759  -4.158
    7    HE1  PHE   9           HE1      PHE   9 -18.230   6.341  -5.983
    8    HE2  PHE   9           HE2      PHE   9 -22.431   5.486  -5.899
    9    HZ   PHE   9           HZ       PHE   9 -20.523   6.773  -6.816

  No H/Q in entry =           9
  In of MODEL    2
    1    H    SER  10           H        SER  10 -16.973   0.852  -3.359
    2    HA   SER  10           HA       SER  10 -17.143  -0.070  -0.672
    3    HB2  SER  10           HB2      SER  10 -17.137  -2.406  -0.945
    4    HB3  SER  10           HB3      SER  10 -18.390  -1.857  -2.046
    5    HG   SER  10           HG       SER  10 -15.856  -2.885  -2.555

  No H/Q in entry =           5
  In of MODEL    2
    1    H    SER  11           H        SER  11 -15.103  -0.003   0.131
    2    HA   SER  11           HA       SER  11 -12.948   0.861  -1.440
    3    HB2  SER  11           HB2      SER  11 -13.391   0.892   1.164
    4    HB3  SER  11           HB3      SER  11 -12.413  -0.576   1.109
    5    HG   SER  11           HG       SER  11 -10.716   0.576   0.565

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA  12           H        ALA  12 -14.189  -1.815  -2.246
    2    HA   ALA  12           HA       ALA  12 -11.631  -3.067  -2.864
    3    HB1  ALA  12           HB1      ALA  12 -13.779  -4.428  -1.258
    4    HB2  ALA  12           HB2      ALA  12 -12.043  -4.371  -0.958
    5    HB3  ALA  12           HB3      ALA  12 -12.676  -5.358  -2.275

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLY  13           H        GLY  13 -12.380  -2.059  -4.881
    2    HA3  GLY  13           HA2      GLY  13 -14.685  -2.685  -6.293
    3    HA2  GLY  13           HA3      GLY  13 -13.146  -2.256  -7.051

  No H/Q in entry =           3
  In of MODEL    2
    1    H    MET  14           H        MET  14 -11.628  -4.559  -6.255
    2    HA   MET  14           HA       MET  14 -12.159  -6.269  -8.365
    3    HB2  MET  14           HB2      MET  14 -10.028  -6.379  -7.164
    4    HB3  MET  14           HB3      MET  14 -10.825  -7.094  -5.763
    5    HG2  MET  14           HG2      MET  14 -11.485  -9.038  -7.155
    6    HG3  MET  14           HG3      MET  14 -10.672  -8.315  -8.543
    7    HE2  MET  14           HE1      MET  14  -7.885  -7.102  -7.398
    8    HE1  MET  14           HE2      MET  14  -8.461  -7.882  -8.870
    9    HE3  MET  14           HE3      MET  14  -7.059  -8.536  -8.025

  No H/Q in entry =           9
  In of MODEL    2
    1    H    SER  15           H        SER  15 -13.215  -6.833  -4.993
    2    HA   SER  15           HA       SER  15 -14.606  -9.251  -5.721
    3    HB2  SER  15           HB2      SER  15 -14.040  -9.168  -3.419
    4    HB3  SER  15           HB3      SER  15 -14.703  -7.546  -3.236
    5    HG   SER  15           HG       SER  15 -16.661  -9.040  -4.153

  No H/Q in entry =           5
  In of MODEL    2
    1    H    THR  16           H        THR  16 -15.660  -5.877  -5.173
    2    HA   THR  16           HA       THR  16 -18.470  -6.341  -5.603
    3    HB   THR  16           HB       THR  16 -16.906  -3.792  -6.144
    4    HG1  THR  16           HG1      THR  16 -16.567  -3.689  -4.102
    5   HG22  THR  16          HG21      THR  16 -19.118  -2.817  -5.334
    6   HG21  THR  16          HG22      THR  16 -19.789  -4.449  -5.496
    7   HG23  THR  16          HG23      THR  16 -19.153  -3.598  -6.910

  No H/Q in entry =           7
  In of MODEL    2
    1    H    SER  17           H        SER  17 -15.717  -5.761  -7.532
    2    HA   SER  17           HA       SER  17 -16.887  -5.003 -10.009
    3    HB2  SER  17           HB2      SER  17 -14.258  -6.361  -9.375
    4    HB3  SER  17           HB3      SER  17 -14.729  -5.884 -11.007
    5    HG   SER  17           HG       SER  17 -13.425  -4.371  -9.632

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU  18           H        LEU  18 -16.317  -8.156  -8.581
    2    HA   LEU  18           HA       LEU  18 -16.961  -9.644 -10.929
    3    HB2  LEU  18           HB2      LEU  18 -15.714 -10.560  -8.974
    4    HB3  LEU  18           HB3      LEU  18 -17.202 -10.472  -8.032
    5    HG   LEU  18           HG       LEU  18 -18.272 -12.010  -9.670
    6   HD13  LEU  18          HD11      LEU  18 -17.091 -11.795 -11.668
    7   HD12  LEU  18          HD12      LEU  18 -16.470 -13.321 -11.037
    8   HD11  LEU  18          HD13      LEU  18 -15.524 -11.844 -10.861
    9   HD23  LEU  18          HD21      LEU  18 -16.854 -14.010  -8.980
   10   HD22  LEU  18          HD22      LEU  18 -17.562 -13.011  -7.709
   11   HD21  LEU  18          HD23      LEU  18 -15.857 -12.835  -8.120

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LEU  19           H        LEU  19 -18.867  -8.429  -8.176
    2    HA   LEU  19           HA       LEU  19 -21.355  -9.590  -8.963
    3    HB2  LEU  19           HB2      LEU  19 -20.999  -8.747  -6.712
    4    HB3  LEU  19           HB3      LEU  19 -20.780  -7.115  -7.340
    5    HG   LEU  19           HG       LEU  19 -23.112  -6.951  -7.895
    6   HD11  LEU  19          HD11      LEU  19 -23.085  -9.878  -7.297
    7   HD13  LEU  19          HD12      LEU  19 -23.880  -9.009  -8.608
    8   HD12  LEU  19          HD13      LEU  19 -24.554  -8.957  -6.980
    9   HD21  LEU  19          HD21      LEU  19 -22.459  -7.942  -5.142
   10   HD23  LEU  19          HD22      LEU  19 -24.070  -7.361  -5.566
   11   HD22  LEU  19          HD23      LEU  19 -22.679  -6.284  -5.701

  No H/Q in entry =          11
  In of MODEL    2
    1    H    VAL  20           H        VAL  20 -19.848  -6.440  -9.678
    2    HA   VAL  20           HA       VAL  20 -21.981  -5.376 -11.202
    3    HB   VAL  20           HB       VAL  20 -18.994  -4.810 -11.456
    4   HG13  VAL  20          HG11      VAL  20 -19.654  -2.749 -12.627
    5   HG12  VAL  20          HG12      VAL  20 -21.344  -3.248 -12.559
    6   HG11  VAL  20          HG13      VAL  20 -20.189  -4.175 -13.516
    7   HG22  VAL  20          HG21      VAL  20 -19.541  -4.065  -9.353
    8   HG21  VAL  20          HG22      VAL  20 -21.195  -3.662  -9.810
    9   HG23  VAL  20          HG23      VAL  20 -19.861  -2.630 -10.326

  No H/Q in entry =           9
  In of MODEL    2
    1    H    SER  21           H        SER  21 -19.261  -7.446 -12.290
    2    HA   SER  21           HA       SER  21 -20.098  -7.319 -15.025
    3    HB2  SER  21           HB2      SER  21 -18.684  -9.294 -15.393
    4    HB3  SER  21           HB3      SER  21 -17.827  -8.060 -14.471
    5    HG   SER  21           HG       SER  21 -17.977  -9.249 -12.688

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LYS  22           H        LYS  22 -21.131  -9.504 -12.438
    2    HA   LYS  22           HA       LYS  22 -22.718 -11.105 -14.234
    3    HB2  LYS  22           HB2      LYS  22 -22.582 -10.816 -11.253
    4    HB3  LYS  22           HB3      LYS  22 -23.914 -11.693 -12.002
    5    HG2  LYS  22           HG2      LYS  22 -22.479 -13.415 -11.551
    6    HG3  LYS  22           HG3      LYS  22 -21.980 -13.004 -13.191
    7    HD2  LYS  22           HD2      LYS  22 -20.149 -11.630 -12.272
    8    HD3  LYS  22           HD3      LYS  22 -20.633 -12.105 -10.643
    9    HE2  LYS  22           HE2      LYS  22 -19.732 -14.021 -12.804
   10    HE3  LYS  22           HE3      LYS  22 -18.704 -13.412 -11.508
   11    HZ2  LYS  22           HZ1      LYS  22 -20.795 -15.427 -11.436
   12    HZ1  LYS  22           HZ2      LYS  22 -20.693 -14.400 -10.087
   13    HZ3  LYS  22           HZ3      LYS  22 -19.347 -15.323 -10.554

  No H/Q in entry =          13
  In of MODEL    2
    1    H    MET  23           H        MET  23 -23.379  -8.183 -12.344
    2    HA   MET  23           HA       MET  23 -26.197  -8.234 -12.795
    3    HB2  MET  23           HB2      MET  23 -24.318  -5.944 -12.251
    4    HB3  MET  23           HB3      MET  23 -26.064  -5.759 -12.394
    5    HG2  MET  23           HG2      MET  23 -26.429  -7.065 -10.422
    6    HG3  MET  23           HG3      MET  23 -24.720  -7.493 -10.331
    7    HE2  MET  23           HE1      MET  23 -26.961  -3.824  -9.085
    8    HE1  MET  23           HE2      MET  23 -27.253  -4.785 -10.533
    9    HE3  MET  23           HE3      MET  23 -26.205  -3.368 -10.613

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ARG  24           H        ARG  24 -23.465  -6.825 -14.628
    2    HA   ARG  24           HA       ARG  24 -24.989  -5.505 -16.593
    3    HB2  ARG  24           HB2      ARG  24 -22.184  -6.663 -16.682
    4    HB3  ARG  24           HB3      ARG  24 -22.874  -5.756 -18.004
    5    HG2  ARG  24           HG2      ARG  24 -23.026  -3.724 -16.616
    6    HG3  ARG  24           HG3      ARG  24 -22.452  -4.647 -15.203
    7    HD2  ARG  24           HD2      ARG  24 -20.538  -3.491 -16.170
    8    HD3  ARG  24           HD3      ARG  24 -20.393  -5.211 -16.507
    9    HE   ARG  24           HE       ARG  24 -21.561  -4.319 -18.742
   10   HH21  ARG  24          HH11      ARG  24 -20.151  -4.921 -20.386
   11   HH22  ARG  24          HH12      ARG  24 -18.508  -4.382 -20.347
   12   HH11  ARG  24          HH21      ARG  24 -18.871  -3.161 -17.045
   13   HH12  ARG  24          HH22      ARG  24 -17.764  -3.333 -18.370

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ALA  25           H        ALA  25 -23.896  -8.855 -16.351
    2    HA   ALA  25           HA       ALA  25 -24.584  -9.669 -18.977
    3    HB1  ALA  25           HB1      ALA  25 -23.897 -11.711 -18.304
    4    HB3  ALA  25           HB2      ALA  25 -24.926 -11.685 -16.872
    5    HB2  ALA  25           HB3      ALA  25 -23.362 -10.875 -16.846

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLN  26           H        GLN  26 -26.353  -9.700 -15.919
    2    HA   GLN  26           HA       GLN  26 -28.729 -10.874 -16.895
    3    HB2  GLN  26           HB2      GLN  26 -28.150  -9.141 -14.512
    4    HB3  GLN  26           HB3      GLN  26 -29.727  -9.847 -14.834
    5    HG2  GLN  26           HG2      GLN  26 -27.149 -11.333 -14.421
    6    HG3  GLN  26           HG3      GLN  26 -28.487 -11.220 -13.284
    7   HE21  GLN  26          HE21      GLN  26 -27.318 -13.393 -14.592
    8   HE22  GLN  26          HE22      GLN  26 -28.388 -14.425 -15.373

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ALA  27           H        ALA  27 -27.750  -7.488 -16.507
    2    HA   ALA  27           HA       ALA  27 -30.241  -6.365 -17.239
    3    HB1  ALA  27           HB1      ALA  27 -28.395  -5.075 -16.153
    4    HB3  ALA  27           HB2      ALA  27 -29.006  -4.295 -17.615
    5    HB2  ALA  27           HB3      ALA  27 -27.480  -5.179 -17.659

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLU  28           H        GLU  28 -27.591  -7.609 -19.166
    2    HA   GLU  28           HA       GLU  28 -28.563  -6.548 -21.662
    3    HB2  GLU  28           HB2      GLU  28 -26.180  -7.260 -21.087
    4    HB3  GLU  28           HB3      GLU  28 -26.748  -8.917 -21.285
    5    HG2  GLU  28           HG2      GLU  28 -25.631  -8.144 -23.272
    6    HG3  GLU  28           HG3      GLU  28 -27.338  -8.447 -23.589

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LYS  29           H        LYS  29 -28.732  -9.660 -20.016
    2    HA   LYS  29           HA       LYS  29 -30.089 -11.105 -22.001
    3    HB2  LYS  29           HB2      LYS  29 -29.014 -12.111 -20.023
    4    HB3  LYS  29           HB3      LYS  29 -30.257 -11.393 -19.000
    5    HG2  LYS  29           HG2      LYS  29 -31.954 -12.742 -20.042
    6    HG3  LYS  29           HG3      LYS  29 -30.783 -13.385 -21.192
    7    HD2  LYS  29           HD2      LYS  29 -29.621 -14.573 -19.487
    8    HD3  LYS  29           HD3      LYS  29 -30.494 -13.728 -18.209
    9    HE2  LYS  29           HE2      LYS  29 -31.280 -16.066 -18.569
   10    HE3  LYS  29           HE3      LYS  29 -32.549 -14.859 -18.781
   11    HZ1  LYS  29           HZ1      LYS  29 -32.033 -14.987 -21.220
   12    HZ3  LYS  29           HZ2      LYS  29 -32.755 -16.369 -20.548
   13    HZ2  LYS  29           HZ3      LYS  29 -31.091 -16.357 -20.878

  No H/Q in entry =          13
  In of MODEL    2
    1    H    TYR  30           H        TYR  30 -31.409  -8.997 -19.461
    2    HA   TYR  30           HA       TYR  30 -34.101  -9.410 -20.653
    3    HB2  TYR  30           HB2      TYR  30 -33.382  -8.278 -17.939
    4    HB3  TYR  30           HB3      TYR  30 -35.014  -8.514 -18.562
    5    HD1  TYR  30           HD1      TYR  30 -35.955 -10.794 -18.768
    6    HD2  TYR  30           HD2      TYR  30 -32.080 -10.123 -17.137
    7    HE1  TYR  30           HE1      TYR  30 -35.875 -13.127 -17.985
    8    HE2  TYR  30           HE2      TYR  30 -32.001 -12.442 -16.357
    9    HH   TYR  30           HH       TYR  30 -33.688 -14.779 -17.429

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLU  31           H        GLU  31 -31.928  -7.439 -21.485
    2    HA   GLU  31           HA       GLU  31 -31.847  -5.278 -22.298
    3    HB2  GLU  31           HB2      GLU  31 -34.759  -5.960 -22.758
    4    HB3  GLU  31           HB3      GLU  31 -33.917  -4.598 -23.497
    5    HG2  GLU  31           HG2      GLU  31 -32.485  -6.045 -24.724
    6    HG3  GLU  31           HG3      GLU  31 -33.047  -7.457 -23.832

  No H/Q in entry =           6
  In of MODEL    2
    1    H    VAL  32           H        VAL  32 -31.992  -5.188 -19.562
    2    HA   VAL  32           HA       VAL  32 -33.819  -3.060 -18.857
    3    HB   VAL  32           HB       VAL  32 -31.407  -4.086 -17.328
    4   HG12  VAL  32          HG11      VAL  32 -32.897  -3.256 -15.399
    5   HG11  VAL  32          HG12      VAL  32 -33.745  -2.338 -16.642
    6   HG13  VAL  32          HG13      VAL  32 -32.029  -2.053 -16.353
    7   HG21  VAL  32          HG21      VAL  32 -33.206  -5.785 -17.990
    8   HG23  VAL  32          HG22      VAL  32 -34.214  -4.953 -16.806
    9   HG22  VAL  32          HG23      VAL  32 -32.695  -5.694 -16.304

  No H/Q in entry =           9
  In of MODEL    2
    1    HA   PRO  33           HA       PRO  33 -30.790  -0.153 -20.575
    2    HB2  PRO  33           HB2      PRO  33 -32.277   2.084 -20.410
    3    HB3  PRO  33           HB3      PRO  33 -32.779   0.792 -21.501
    4    HG2  PRO  33           HG2      PRO  33 -33.689   1.303 -18.668
    5    HG3  PRO  33           HG3      PRO  33 -34.683   1.112 -20.112
    6    HD2  PRO  33           HD2      PRO  33 -34.215  -0.974 -18.466
    7    HD3  PRO  33           HD3      PRO  33 -34.313  -1.206 -20.212

  No H/Q in entry =           7
  In of MODEL    2
    1    H    VAL  34           H        VAL  34 -29.495  -0.720 -18.653
    2    HA   VAL  34           HA       VAL  34 -29.156   1.694 -16.999
    3    HB   VAL  34           HB       VAL  34 -28.551   0.217 -15.081
    4   HG12  VAL  34          HG11      VAL  34 -30.965  -0.636 -14.731
    5   HG11  VAL  34          HG12      VAL  34 -31.304   0.136 -16.279
    6   HG13  VAL  34          HG13      VAL  34 -30.716   1.100 -14.923
    7   HG21  VAL  34          HG21      VAL  34 -28.795  -1.797 -17.096
    8   HG23  VAL  34          HG22      VAL  34 -29.828  -2.155 -15.711
    9   HG22  VAL  34          HG23      VAL  34 -28.103  -1.886 -15.476

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ILE  35           H        ILE  35 -27.160   2.106 -16.195
    2    HA   ILE  35           HA       ILE  35 -24.892   0.764 -17.510
    3    HB   ILE  35           HB       ILE  35 -25.250   3.652 -16.677
    4   HG12  ILE  35          HG12      ILE  35 -24.329   2.350 -19.247
    5   HG13  ILE  35          HG13      ILE  35 -25.949   2.983 -18.952
    6   HG21  ILE  35          HG21      ILE  35 -22.709   2.098 -17.044
    7   HG23  ILE  35          HG22      ILE  35 -23.128   3.274 -15.799
    8   HG22  ILE  35          HG23      ILE  35 -22.773   3.815 -17.441
    9   HD11  ILE  35          HD11      ILE  35 -24.515   5.163 -18.366
   10   HD13  ILE  35          HD12      ILE  35 -25.088   4.794 -19.994
   11   HD12  ILE  35          HD13      ILE  35 -23.430   4.406 -19.532

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ILE  36           H        ILE  36 -23.640  -0.280 -15.941
    2    HA   ILE  36           HA       ILE  36 -24.018   0.323 -13.058
    3    HB   ILE  36           HB       ILE  36 -23.238  -2.380 -14.197
    4   HG12  ILE  36          HG12      ILE  36 -26.022  -1.555 -13.374
    5   HG13  ILE  36          HG13      ILE  36 -25.483  -1.529 -15.053
    6   HG23  ILE  36          HG21      ILE  36 -23.554  -3.218 -12.082
    7   HG22  ILE  36          HG22      ILE  36 -24.661  -1.927 -11.613
    8   HG21  ILE  36          HG23      ILE  36 -22.929  -1.610 -11.716
    9   HD13  ILE  36          HD11      ILE  36 -25.672  -3.741 -15.268
   10   HD12  ILE  36          HD12      ILE  36 -26.708  -3.618 -13.847
   11   HD11  ILE  36          HD13      ILE  36 -25.010  -4.053 -13.664

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLU  37           H        GLU  37 -22.210   0.931 -11.986
    2    HA   GLU  37           HA       GLU  37 -19.546   0.117 -12.959
    3    HB2  GLU  37           HB2      GLU  37 -20.377   2.911 -12.193
    4    HB3  GLU  37           HB3      GLU  37 -18.710   2.390 -12.432
    5    HG2  GLU  37           HG2      GLU  37 -20.839   2.433 -14.553
    6    HG3  GLU  37           HG3      GLU  37 -19.601   3.666 -14.318

  No H/Q in entry =           6
  In of MODEL    2
    1    H    ALA  38           H        ALA  38 -18.028  -0.143 -11.307
    2    HA   ALA  38           HA       ALA  38 -19.003   0.029  -8.516
    3    HB1  ALA  38           HB1      ALA  38 -17.334  -1.916  -9.985
    4    HB3  ALA  38           HB2      ALA  38 -18.357  -2.151  -8.569
    5    HB2  ALA  38           HB3      ALA  38 -16.736  -1.482  -8.383

  No H/Q in entry =           5
  In of MODEL    2
    1    H    PHE  39           H        PHE  39 -17.725   1.220  -7.061
    2    HA   PHE  39           HA       PHE  39 -15.209   2.408  -8.000
    3    HB2  PHE  39           HB2      PHE  39 -17.593   3.907  -6.934
    4    HB3  PHE  39           HB3      PHE  39 -15.959   4.564  -6.864
    5    HD1  PHE  39           HD1      PHE  39 -14.673   4.581  -9.137
    6    HD2  PHE  39           HD2      PHE  39 -18.914   4.390  -8.740
    7    HE1  PHE  39           HE1      PHE  39 -14.916   5.474 -11.436
    8    HE2  PHE  39           HE2      PHE  39 -19.173   5.273 -11.031
    9    HZ   PHE  39           HZ       PHE  39 -17.180   5.789 -12.398

  No H/Q in entry =           9
  In of MODEL    2
    1    HA   PRO  40           HA       PRO  40 -14.191   1.624  -3.737
    2    HB2  PRO  40           HB2      PRO  40 -12.399   3.623  -3.155
    3    HB3  PRO  40           HB3      PRO  40 -11.985   2.295  -4.239
    4    HG2  PRO  40           HG2      PRO  40 -13.009   5.041  -4.949
    5    HG3  PRO  40           HG3      PRO  40 -11.597   4.197  -5.586
    6    HD2  PRO  40           HD2      PRO  40 -13.848   4.127  -6.955
    7    HD3  PRO  40           HD3      PRO  40 -12.899   2.652  -6.788

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLU  41           H        GLU  41 -14.764   2.595  -1.590
    2    HA   GLU  41           HA       GLU  41 -16.998   4.311  -1.520
    3    HB2  GLU  41           HB2      GLU  41 -16.512   4.417   0.944
    4    HB3  GLU  41           HB3      GLU  41 -16.670   2.790   0.283
    5    HG2  GLU  41           HG2      GLU  41 -14.865   2.580   1.706
    6    HG3  GLU  41           HG3      GLU  41 -14.092   2.841   0.143

  No H/Q in entry =           6
  In of MODEL    2
    1    H    THR  42           H        THR  42 -13.662   5.208  -1.633
    2    HA   THR  42           HA       THR  42 -13.976   7.765  -0.401
    3    HB   THR  42           HB       THR  42 -11.836   8.331  -1.523
    4    HG1  THR  42           HG1      THR  42 -11.058   6.159  -2.602
    5   HG23  THR  42          HG21      THR  42 -10.479   6.714  -0.384
    6   HG22  THR  42          HG22      THR  42 -11.762   5.505  -0.457
    7   HG21  THR  42          HG23      THR  42 -11.944   6.920   0.577

  No H/Q in entry =           7
  In of MODEL    2
    1    H    LEU  43           H        LEU  43 -14.947   6.693  -3.488
    2    HA   LEU  43           HA       LEU  43 -15.203   9.472  -4.439
    3    HB2  LEU  43           HB2      LEU  43 -15.631   6.842  -5.847
    4    HB3  LEU  43           HB3      LEU  43 -15.807   8.433  -6.585
    5    HG   LEU  43           HG       LEU  43 -13.218   7.243  -5.619
    6   HD12  LEU  43          HD11      LEU  43 -13.842   7.827  -8.470
    7   HD11  LEU  43          HD12      LEU  43 -14.492   6.354  -7.755
    8   HD13  LEU  43          HD13      LEU  43 -12.751   6.626  -7.778
    9   HD23  LEU  43          HD21      LEU  43 -12.304   9.183  -6.977
   10   HD22  LEU  43          HD22      LEU  43 -13.091   9.610  -5.457
   11   HD21  LEU  43          HD23      LEU  43 -13.943   9.834  -6.984

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ALA  44           H        ALA  44 -17.122   7.648  -2.557
    2    HA   ALA  44           HA       ALA  44 -19.627   7.529  -3.832
    3    HB2  ALA  44           HB1      ALA  44 -19.453   6.401  -1.743
    4    HB3  ALA  44           HB2      ALA  44 -20.548   7.751  -1.443
    5    HB1  ALA  44           HB3      ALA  44 -18.866   7.847  -0.922

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLY  45           H        GLY  45 -18.160  10.313  -2.313
    2    HA3  GLY  45           HA2      GLY  45 -20.595  11.829  -2.618
    3    HA2  GLY  45           HA3      GLY  45 -19.037  12.441  -2.069

  No H/Q in entry =           3
  In of MODEL    2
    1    H    GLU  46           H        GLU  46 -17.555  11.508  -4.393
    2    HA   GLU  46           HA       GLU  46 -18.215  13.737  -6.138
    3    HB2  GLU  46           HB2      GLU  46 -16.028  11.652  -6.181
    4    HB3  GLU  46           HB3      GLU  46 -16.182  12.936  -7.380
    5    HG2  GLU  46           HG2      GLU  46 -15.844  14.614  -5.671
    6    HG3  GLU  46           HG3      GLU  46 -15.775  13.365  -4.428

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LYS  47           H        LYS  47 -18.125  10.219  -6.594
    2    HA   LYS  47           HA       LYS  47 -19.274  10.458  -9.245
    3    HB2  LYS  47           HB2      LYS  47 -18.086   8.343  -7.599
    4    HB3  LYS  47           HB3      LYS  47 -19.479   7.812  -8.541
    5    HG2  LYS  47           HG2      LYS  47 -17.448   7.399  -9.762
    6    HG3  LYS  47           HG3      LYS  47 -18.392   8.647 -10.574
    7    HD2  LYS  47           HD2      LYS  47 -17.004  10.375  -9.563
    8    HD3  LYS  47           HD3      LYS  47 -16.076   9.144  -8.707
    9    HE2  LYS  47           HE2      LYS  47 -15.338   8.211 -10.836
   10    HE3  LYS  47           HE3      LYS  47 -16.282   9.423 -11.700
   11    HZ3  LYS  47           HZ1      LYS  47 -14.016  10.112 -11.575
   12    HZ2  LYS  47           HZ2      LYS  47 -13.994   9.922  -9.887
   13    HZ1  LYS  47           HZ3      LYS  47 -14.950  11.137 -10.594

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLY  48           H        GLY  48 -20.539   9.693  -6.076
    2    HA3  GLY  48           HA2      GLY  48 -22.945   8.526  -6.775
    3    HA2  GLY  48           HA3      GLY  48 -22.686   9.511  -5.336

  No H/Q in entry =           3
  In of MODEL    2
    1    H    GLN  49           H        GLN  49 -22.119  11.939  -6.907
    2    HA   GLN  49           HA       GLN  49 -24.674  13.066  -6.994
    3    HB2  GLN  49           HB2      GLN  49 -22.153  13.922  -8.400
    4    HB3  GLN  49           HB3      GLN  49 -23.607  14.895  -8.282
    5    HG2  GLN  49           HG2      GLN  49 -23.399  14.906  -5.849
    6    HG3  GLN  49           HG3      GLN  49 -21.959  13.912  -5.965
    7   HE21  GLN  49          HE21      GLN  49 -21.802  16.133  -4.684
    8   HE22  GLN  49          HE22      GLN  49 -20.886  17.387  -5.344

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ASN  50           H        ASN  50 -23.053  11.188  -9.423
    2    HA   ASN  50           HA       ASN  50 -24.973  12.082 -11.464
    3    HB2  ASN  50           HB2      ASN  50 -22.407  10.527 -11.756
    4    HB3  ASN  50           HB3      ASN  50 -23.481  10.967 -13.076
    5   HD21  ASN  50          HD21      ASN  50 -20.809  11.788 -11.514
    6   HD22  ASN  50          HD22      ASN  50 -20.572  13.425 -11.853

  No H/Q in entry =           6
  In of MODEL    2
    1    H    ALA  51           H        ALA  51 -24.928   9.714  -9.230
    2    HA   ALA  51           HA       ALA  51 -25.762   7.584 -11.051
    3    HB2  ALA  51           HB1      ALA  51 -25.155   6.223  -9.383
    4    HB3  ALA  51           HB2      ALA  51 -26.250   7.032  -8.264
    5    HB1  ALA  51           HB3      ALA  51 -24.611   7.644  -8.491

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ASP  52           H        ASP  52 -27.771   6.540 -10.877
    2    HA   ASP  52           HA       ASP  52 -29.927   8.385 -10.159
    3    HB2  ASP  52           HB2      ASP  52 -29.786   5.886 -11.845
    4    HB3  ASP  52           HB3      ASP  52 -31.316   6.628 -11.377

  No H/Q in entry =           4
  In of MODEL    2
    1    H    VAL  53           H        VAL  53 -28.326   5.480  -9.190
    2    HA   VAL  53           HA       VAL  53 -29.715   5.605  -6.644
    3    HB   VAL  53           HB       VAL  53 -31.150   3.978  -7.869
    4   HG11  VAL  53          HG11      VAL  53 -29.440   3.114  -9.429
    5   HG13  VAL  53          HG12      VAL  53 -30.264   1.821  -8.560
    6   HG12  VAL  53          HG13      VAL  53 -28.642   2.310  -8.079
    7   HG23  VAL  53          HG21      VAL  53 -30.309   1.987  -6.203
    8   HG22  VAL  53          HG22      VAL  53 -31.422   3.298  -5.807
    9   HG21  VAL  53          HG23      VAL  53 -29.706   3.456  -5.433

  No H/Q in entry =           9
  In of MODEL    2
    1    H    VAL  54           H        VAL  54 -28.373   5.154  -5.017
    2    HA   VAL  54           HA       VAL  54 -25.632   4.288  -5.688
    3    HB   VAL  54           HB       VAL  54 -26.644   6.061  -3.409
    4   HG11  VAL  54          HG11      VAL  54 -24.082   4.625  -3.758
    5   HG13  VAL  54          HG12      VAL  54 -24.801   5.302  -2.298
    6   HG12  VAL  54          HG13      VAL  54 -23.910   6.345  -3.406
    7   HG22  VAL  54          HG21      VAL  54 -25.793   7.875  -4.517
    8   HG21  VAL  54          HG22      VAL  54 -26.375   6.896  -5.863
    9   HG23  VAL  54          HG23      VAL  54 -24.659   6.906  -5.458

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LEU  55           H        LEU  55 -25.042   2.358  -5.066
    2    HA   LEU  55           HA       LEU  55 -26.517   1.048  -2.868
    3    HB2  LEU  55           HB2      LEU  55 -25.016  -0.121  -5.199
    4    HB3  LEU  55           HB3      LEU  55 -25.757  -1.055  -3.900
    5    HG   LEU  55           HG       LEU  55 -27.224   0.554  -5.981
    6   HD13  LEU  55          HD11      LEU  55 -26.963  -1.295  -7.215
    7   HD12  LEU  55          HD12      LEU  55 -27.903  -2.169  -6.006
    8   HD11  LEU  55          HD13      LEU  55 -26.144  -2.118  -5.889
    9   HD23  LEU  55          HD21      LEU  55 -28.496  -1.392  -4.110
   10   HD22  LEU  55          HD22      LEU  55 -29.197   0.000  -4.937
   11   HD21  LEU  55          HD23      LEU  55 -28.148   0.241  -3.541

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LEU  56           H        LEU  56 -25.335   0.436  -1.089
    2    HA   LEU  56           HA       LEU  56 -22.399   0.808  -1.195
    3    HB2  LEU  56           HB2      LEU  56 -24.155   0.600   1.239
    4    HB3  LEU  56           HB3      LEU  56 -22.443   1.016   1.196
    5    HG   LEU  56           HG       LEU  56 -24.748   2.717   0.286
    6   HD11  LEU  56          HD11      LEU  56 -23.586   2.314   2.781
    7   HD13  LEU  56          HD12      LEU  56 -24.575   3.693   2.302
    8   HD12  LEU  56          HD13      LEU  56 -22.819   3.784   2.179
    9   HD23  LEU  56          HD21      LEU  56 -22.793   4.400   0.062
   10   HD22  LEU  56          HD22      LEU  56 -23.211   3.313  -1.263
   11   HD21  LEU  56          HD23      LEU  56 -21.839   2.945  -0.219

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLY  57           H        GLY  57 -21.022  -0.836  -0.695
    2    HA3  GLY  57           HA2      GLY  57 -21.971  -3.514  -0.887
    3    HA2  GLY  57           HA3      GLY  57 -20.335  -3.035  -0.440

  No H/Q in entry =           3
  In of MODEL    2
    1    HA   PRO  58           HA       PRO  58 -23.078  -4.069   3.322
    2    HB2  PRO  58           HB2      PRO  58 -22.403  -6.682   3.903
    3    HB3  PRO  58           HB3      PRO  58 -23.804  -6.257   2.919
    4    HG2  PRO  58           HG2      PRO  58 -21.100  -7.157   2.075
    5    HG3  PRO  58           HG3      PRO  58 -22.681  -7.600   1.432
    6    HD2  PRO  58           HD2      PRO  58 -21.082  -5.790   0.186
    7    HD3  PRO  58           HD3      PRO  58 -22.842  -5.689   0.119

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLN  59           H        GLN  59 -19.724  -4.566   2.646
    2    HA   GLN  59           HA       GLN  59 -18.914  -4.604   5.391
    3    HB2  GLN  59           HB2      GLN  59 -17.231  -3.545   3.134
    4    HB3  GLN  59           HB3      GLN  59 -16.702  -4.280   4.633
    5    HG2  GLN  59           HG2      GLN  59 -16.338  -6.002   3.186
    6    HG3  GLN  59           HG3      GLN  59 -17.982  -6.370   3.680
    7   HE21  GLN  59          HE21      GLN  59 -18.616  -7.183   1.989
    8   HE22  GLN  59          HE22      GLN  59 -18.928  -6.790   0.403

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ILE  60           H        ILE  60 -19.870  -2.034   3.214
    2    HA   ILE  60           HA       ILE  60 -18.961  -0.095   5.251
    3    HB   ILE  60           HB       ILE  60 -19.204   1.647   3.444
    4   HG12  ILE  60          HG12      ILE  60 -19.089  -0.549   1.425
    5   HG13  ILE  60          HG13      ILE  60 -20.656  -0.021   2.036
    6   HG23  ILE  60          HG21      ILE  60 -17.060   1.402   2.782
    7   HG22  ILE  60          HG22      ILE  60 -17.244  -0.315   2.428
    8   HG21  ILE  60          HG23      ILE  60 -17.095   0.229   4.098
    9   HD11  ILE  60          HD11      ILE  60 -19.845   2.362   1.403
   10   HD13  ILE  60          HD12      ILE  60 -20.364   1.278   0.112
   11   HD12  ILE  60          HD13      ILE  60 -18.645   1.523   0.421

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ALA  61           H        ALA  61 -21.428  -1.659   5.362
    2    HA   ALA  61           HA       ALA  61 -23.648   0.026   4.955
    3    HB1  ALA  61           HB1      ALA  61 -24.850  -1.459   6.298
    4    HB2  ALA  61           HB2      ALA  61 -23.435  -1.865   7.270
    5    HB3  ALA  61           HB3      ALA  61 -23.569  -2.463   5.617

  No H/Q in entry =           5
  In of MODEL    2
    1    H    TYR  62           H        TYR  62 -21.386  -0.118   7.708
    2    HA   TYR  62           HA       TYR  62 -22.894   1.545   9.417
    3    HB2  TYR  62           HB2      TYR  62 -20.843   1.926  10.626
    4    HB3  TYR  62           HB3      TYR  62 -20.892   0.239  10.116
    5    HD1  TYR  62           HD1      TYR  62 -19.329  -0.601   8.407
    6    HD2  TYR  62           HD2      TYR  62 -19.155   3.461   9.723
    7    HE1  TYR  62           HE1      TYR  62 -17.134  -0.346   7.314
    8    HE2  TYR  62           HE2      TYR  62 -16.946   3.710   8.631
    9    HH   TYR  62           HH       TYR  62 -15.666   2.706   6.907

  No H/Q in entry =           9
  In of MODEL    2
    1    H    MET  63           H        MET  63 -21.301   2.403   6.532
    2    HA   MET  63           HA       MET  63 -21.095   5.230   7.236
    3    HB2  MET  63           HB2      MET  63 -20.555   3.717   4.680
    4    HB3  MET  63           HB3      MET  63 -20.337   5.458   4.870
    5    HG2  MET  63           HG2      MET  63 -18.604   5.069   6.526
    6    HG3  MET  63           HG3      MET  63 -18.827   3.329   6.360
    7    HE1  MET  63           HE1      MET  63 -18.139   6.545   4.862
    8    HE3  MET  63           HE2      MET  63 -18.425   6.147   3.168
    9    HE2  MET  63           HE3      MET  63 -16.773   6.284   3.774

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LEU  64           H        LEU  64 -23.694   3.404   6.314
    2    HA   LEU  64           HA       LEU  64 -24.932   4.843   4.267
    3    HB2  LEU  64           HB2      LEU  64 -25.802   2.742   5.192
    4    HB3  LEU  64           HB3      LEU  64 -26.221   3.581   6.685
    5    HG   LEU  64           HG       LEU  64 -27.928   4.858   5.496
    6   HD13  LEU  64          HD11      LEU  64 -27.688   5.106   3.261
    7   HD12  LEU  64          HD12      LEU  64 -28.352   3.478   3.121
    8   HD11  LEU  64          HD13      LEU  64 -26.605   3.720   3.144
    9   HD23  LEU  64          HD21      LEU  64 -28.489   2.053   4.747
   10   HD22  LEU  64          HD22      LEU  64 -29.447   3.192   5.691
   11   HD21  LEU  64          HD23      LEU  64 -28.064   2.382   6.427

  No H/Q in entry =          11
  In of MODEL    2
    1    HA   PRO  65           HA       PRO  65 -27.026   8.005   7.076
    2    HB2  PRO  65           HB2      PRO  65 -24.978   8.133   9.290
    3    HB3  PRO  65           HB3      PRO  65 -26.714   8.431   9.372
    4    HG2  PRO  65           HG2      PRO  65 -25.788   6.163  10.269
    5    HG3  PRO  65           HG3      PRO  65 -27.229   6.149   9.253
    6    HD2  PRO  65           HD2      PRO  65 -24.378   5.510   8.489
    7    HD3  PRO  65           HD3      PRO  65 -25.852   4.640   8.068

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLU  66           H        GLU  66 -23.469   7.913   7.076
    2    HA   GLU  66           HA       GLU  66 -23.151  10.710   6.678
    3    HB2  GLU  66           HB2      GLU  66 -21.376   8.387   5.980
    4    HB3  GLU  66           HB3      GLU  66 -20.913  10.076   5.771
    5    HG2  GLU  66           HG2      GLU  66 -21.072  10.437   8.144
    6    HG3  GLU  66           HG3      GLU  66 -21.611   8.775   8.378

  No H/Q in entry =           6
  In of MODEL    2
    1    H    ILE  67           H        ILE  67 -23.327   7.977   4.416
    2    HA   ILE  67           HA       ILE  67 -22.940   9.691   2.123
    3    HB   ILE  67           HB       ILE  67 -23.867   6.794   2.308
    4   HG12  ILE  67          HG12      ILE  67 -21.243   7.939   1.338
    5   HG13  ILE  67          HG13      ILE  67 -21.509   7.515   3.027
    6   HG21  ILE  67          HG21      ILE  67 -23.833   8.681   0.090
    7   HG23  ILE  67          HG22      ILE  67 -24.475   7.041   0.146
    8   HG22  ILE  67          HG23      ILE  67 -22.771   7.308  -0.215
    9   HD12  ILE  67          HD11      ILE  67 -21.156   5.749   0.661
   10   HD11  ILE  67          HD12      ILE  67 -22.149   5.182   2.002
   11   HD13  ILE  67          HD13      ILE  67 -20.465   5.626   2.280

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLN  68           H        GLN  68 -25.788   8.662   3.809
    2    HA   GLN  68           HA       GLN  68 -27.646   9.624   1.878
    3    HB2  GLN  68           HB2      GLN  68 -27.845   9.255   4.864
    4    HB3  GLN  68           HB3      GLN  68 -29.177   9.870   3.900
    5    HG2  GLN  68           HG2      GLN  68 -29.255   7.846   2.616
    6    HG3  GLN  68           HG3      GLN  68 -27.797   7.249   3.386
    7   HE21  GLN  68          HE21      GLN  68 -29.995   5.918   3.289
    8   HE22  GLN  68          HE22      GLN  68 -30.800   5.466   4.718

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ARG  69           H        ARG  69 -25.964  11.257   4.589
    2    HA   ARG  69           HA       ARG  69 -27.305  13.759   4.223
    3    HB2  ARG  69           HB2      ARG  69 -24.940  12.791   5.758
    4    HB3  ARG  69           HB3      ARG  69 -25.004  14.513   5.409
    5    HG2  ARG  69           HG2      ARG  69 -27.300  14.581   6.429
    6    HG3  ARG  69           HG3      ARG  69 -27.103  12.886   6.890
    7    HD2  ARG  69           HD2      ARG  69 -25.362  15.214   7.780
    8    HD3  ARG  69           HD3      ARG  69 -26.482  14.319   8.794
    9    HE   ARG  69           HE       ARG  69 -23.902  13.358   7.786
   10   HH21  ARG  69          HH11      ARG  69 -23.093  11.578   8.957
   11   HH22  ARG  69          HH12      ARG  69 -24.109  10.770  10.102
   12   HH11  ARG  69          HH21      ARG  69 -26.831  12.841   9.542
   13   HH12  ARG  69          HH22      ARG  69 -26.225  11.483  10.432

  No H/Q in entry =          13
  In of MODEL    2
    1    H    LEU  70           H        LEU  70 -24.481  12.321   2.798
    2    HA   LEU  70           HA       LEU  70 -23.361  14.677   1.617
    3    HB2  LEU  70           HB2      LEU  70 -22.386  12.343   2.182
    4    HB3  LEU  70           HB3      LEU  70 -23.039  11.893   0.606
    5    HG   LEU  70           HG       LEU  70 -21.450  13.250  -0.505
    6   HD11  LEU  70          HD11      LEU  70 -20.559  14.068   2.269
    7   HD13  LEU  70          HD12      LEU  70 -21.265  15.118   1.040
    8   HD12  LEU  70          HD13      LEU  70 -19.669  14.415   0.784
    9   HD22  LEU  70          HD21      LEU  70 -20.035  11.512  -0.310
   10   HD21  LEU  70          HD22      LEU  70 -20.940  10.996   1.113
   11   HD23  LEU  70          HD23      LEU  70 -19.536  12.048   1.293

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LEU  71           H        LEU  71 -25.571  12.170   0.536
    2    HA   LEU  71           HA       LEU  71 -26.127  13.677  -1.962
    3    HB2  LEU  71           HB2      LEU  71 -26.367  10.694  -1.526
    4    HB3  LEU  71           HB3      LEU  71 -26.514  11.564  -3.052
    5    HG   LEU  71           HG       LEU  71 -23.961  11.531  -1.444
    6   HD12  LEU  71          HD11      LEU  71 -24.088   9.916  -3.882
    7   HD11  LEU  71          HD12      LEU  71 -25.080   9.302  -2.562
    8   HD13  LEU  71          HD13      LEU  71 -23.352   9.554  -2.321
    9   HD22  LEU  71          HD21      LEU  71 -24.067  13.356  -2.926
   10   HD21  LEU  71          HD22      LEU  71 -24.608  12.328  -4.253
   11   HD23  LEU  71          HD23      LEU  71 -22.976  12.154  -3.610

  No H/Q in entry =          11
  In of MODEL    2
    1    HA   PRO  72           HA       PRO  72 -29.944  13.274   0.737
    2    HB2  PRO  72           HB2      PRO  72 -30.763  15.848   0.685
    3    HB3  PRO  72           HB3      PRO  72 -29.438  15.370   1.748
    4    HG2  PRO  72           HG2      PRO  72 -29.292  16.575  -1.004
    5    HG3  PRO  72           HG3      PRO  72 -28.485  17.108   0.471
    6    HD2  PRO  72           HD2      PRO  72 -27.210  15.537  -1.329
    7    HD3  PRO  72           HD3      PRO  72 -26.922  15.358   0.399

  No H/Q in entry =           7
  In of MODEL    2
    1    H    ASN  73           H        ASN  73 -29.373  14.235  -2.485
    2    HA   ASN  73           HA       ASN  73 -32.250  13.976  -3.059
    3    HB2  ASN  73           HB2      ASN  73 -31.810  15.086  -5.161
    4    HB3  ASN  73           HB3      ASN  73 -31.243  16.049  -3.806
    5   HD21  ASN  73          HD21      ASN  73 -30.503  16.094  -6.500
    6   HD22  ASN  73          HD22      ASN  73 -28.842  15.907  -6.727

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LYS  74           H        LYS  74 -30.300  11.686  -2.686
    2    HA   LYS  74           HA       LYS  74 -30.943  10.314  -5.228
    3    HB2  LYS  74           HB2      LYS  74 -28.383   9.970  -3.662
    4    HB3  LYS  74           HB3      LYS  74 -28.812   9.172  -5.176
    5    HG2  LYS  74           HG2      LYS  74 -28.491  12.136  -4.965
    6    HG3  LYS  74           HG3      LYS  74 -27.142  11.051  -5.303
    7    HD2  LYS  74           HD2      LYS  74 -28.316  10.152  -7.227
    8    HD3  LYS  74           HD3      LYS  74 -29.711  11.173  -6.873
    9    HE2  LYS  74           HE2      LYS  74 -28.460  13.160  -7.331
   10    HE3  LYS  74           HE3      LYS  74 -26.957  12.244  -7.458
   11    HZ2  LYS  74           HZ1      LYS  74 -28.460  12.882  -9.550
   12    HZ1  LYS  74           HZ2      LYS  74 -29.134  11.370  -9.171
   13    HZ3  LYS  74           HZ3      LYS  74 -27.473  11.502  -9.502

  No H/Q in entry =          13
  In of MODEL    2
    1    HA   PRO  75           HA       PRO  75 -32.328   7.339  -2.243
    2    HB2  PRO  75           HB2      PRO  75 -32.710   5.134  -3.828
    3    HB3  PRO  75           HB3      PRO  75 -33.813   6.509  -3.868
    4    HG2  PRO  75           HG2      PRO  75 -31.524   5.880  -5.690
    5    HG3  PRO  75           HG3      PRO  75 -33.174   6.348  -6.101
    6    HD2  PRO  75           HD2      PRO  75 -31.198   8.178  -6.090
    7    HD3  PRO  75           HD3      PRO  75 -32.811   8.604  -5.516

  No H/Q in entry =           7
  In of MODEL    2
    1    H    VAL  76           H        VAL  76 -30.866   6.251  -0.905
    2    HA   VAL  76           HA       VAL  76 -28.447   5.003  -2.069
    3    HB   VAL  76           HB       VAL  76 -28.654   6.461   0.600
    4   HG11  VAL  76          HG11      VAL  76 -26.350   5.138  -0.845
    5   HG13  VAL  76          HG12      VAL  76 -27.023   4.694   0.724
    6   HG12  VAL  76          HG13      VAL  76 -26.153   6.215   0.539
    7   HG22  VAL  76          HG21      VAL  76 -27.970   8.354  -0.291
    8   HG21  VAL  76          HG22      VAL  76 -28.556   7.676  -1.811
    9   HG23  VAL  76          HG23      VAL  76 -26.848   7.554  -1.392

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLU  77           H        GLU  77 -28.257   2.842  -1.470
    2    HA   GLU  77           HA       GLU  77 -29.003   2.057   1.196
    3    HB2  GLU  77           HB2      GLU  77 -30.650   0.441   0.692
    4    HB3  GLU  77           HB3      GLU  77 -31.186   1.977   0.008
    5    HG2  GLU  77           HG2      GLU  77 -30.635   1.218  -2.195
    6    HG3  GLU  77           HG3      GLU  77 -30.007  -0.293  -1.542

  No H/Q in entry =           6
  In of MODEL    2
    1    H    VAL  78           H        VAL  78 -28.700  -0.039   1.840
    2    HA   VAL  78           HA       VAL  78 -26.067  -0.854   0.894
    3    HB   VAL  78           HB       VAL  78 -27.742  -1.718   3.291
    4   HG11  VAL  78          HG11      VAL  78 -25.448  -2.983   2.112
    5   HG13  VAL  78          HG12      VAL  78 -26.335  -3.444   3.567
    6   HG12  VAL  78          HG13      VAL  78 -24.992  -2.307   3.675
    7   HG22  VAL  78          HG21      VAL  78 -26.231  -0.388   4.604
    8   HG21  VAL  78          HG22      VAL  78 -26.976   0.601   3.348
    9   HG23  VAL  78          HG23      VAL  78 -25.313   0.044   3.162

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ILE  79           H        ILE  79 -25.582  -2.766  -0.030
    2    HA   ILE  79           HA       ILE  79 -27.696  -4.202  -1.341
    3    HB   ILE  79           HB       ILE  79 -24.711  -4.783  -1.184
    4   HG12  ILE  79          HG12      ILE  79 -26.374  -3.639  -3.434
    5   HG13  ILE  79          HG13      ILE  79 -25.459  -2.650  -2.294
    6   HG22  ILE  79          HG21      ILE  79 -25.881  -5.932  -3.485
    7   HG21  ILE  79          HG22      ILE  79 -26.847  -6.442  -2.100
    8   HG23  ILE  79          HG23      ILE  79 -25.112  -6.751  -2.126
    9   HD13  ILE  79          HD11      ILE  79 -24.085  -2.780  -4.143
   10   HD12  ILE  79          HD12      ILE  79 -24.461  -4.481  -4.423
   11   HD11  ILE  79          HD13      ILE  79 -23.441  -4.016  -3.061

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ASP  80           H        ASP  80 -28.583  -6.113  -0.748
    2    HA   ASP  80           HA       ASP  80 -28.491  -7.025   1.893
    3    HB2  ASP  80           HB2      ASP  80 -30.289  -7.562   0.287
    4    HB3  ASP  80           HB3      ASP  80 -29.166  -8.586  -0.609

  No H/Q in entry =           4
  In of MODEL    2
    1    H    SER  81           H        SER  81 -26.953  -8.192   2.986
    2    HA   SER  81           HA       SER  81 -24.495  -8.913   1.741
    3    HB2  SER  81           HB2      SER  81 -23.916  -9.958   3.894
    4    HB3  SER  81           HB3      SER  81 -24.588  -8.345   4.130
    5    HG   SER  81           HG       SER  81 -26.297  -9.160   5.039

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU  82           H        LEU  82 -27.234 -10.957   2.110
    2    HA   LEU  82           HA       LEU  82 -25.740 -13.350   1.549
    3    HB2  LEU  82           HB2      LEU  82 -28.669 -12.680   1.358
    4    HB3  LEU  82           HB3      LEU  82 -28.000 -14.293   1.123
    5    HG   LEU  82           HG       LEU  82 -27.856 -12.732   3.684
    6   HD11  LEU  82          HD11      LEU  82 -30.164 -13.453   2.983
    7   HD13  LEU  82          HD12      LEU  82 -29.596 -14.195   4.481
    8   HD12  LEU  82          HD13      LEU  82 -29.576 -15.117   2.978
    9   HD22  LEU  82          HD21      LEU  82 -26.038 -14.205   3.623
   10   HD21  LEU  82          HD22      LEU  82 -26.945 -15.431   2.738
   11   HD23  LEU  82          HD23      LEU  82 -27.288 -15.142   4.444

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LEU  83           H        LEU  83 -27.698 -11.082  -0.321
    2    HA   LEU  83           HA       LEU  83 -27.571 -12.434  -2.801
    3    HB2  LEU  83           HB2      LEU  83 -27.916  -9.522  -2.133
    4    HB3  LEU  83           HB3      LEU  83 -27.993 -10.160  -3.776
    5    HG   LEU  83           HG       LEU  83 -29.988 -10.519  -1.560
    6   HD13  LEU  83          HD11      LEU  83 -30.733  -8.653  -2.602
    7   HD12  LEU  83          HD12      LEU  83 -31.242  -9.754  -3.880
    8   HD11  LEU  83          HD13      LEU  83 -29.694  -8.915  -4.002
    9   HD23  LEU  83          HD21      LEU  83 -30.205 -11.763  -4.286
   10   HD22  LEU  83          HD22      LEU  83 -31.152 -12.102  -2.837
   11   HD21  LEU  83          HD23      LEU  83 -29.474 -12.635  -2.939

  No H/Q in entry =          11
  In of MODEL    2
    1    H    TYR  84           H        TYR  84 -25.542 -10.090  -1.157
    2    HA   TYR  84           HA       TYR  84 -23.715  -9.628  -3.323
    3    HB2  TYR  84           HB2      TYR  84 -24.173  -8.152  -1.267
    4    HB3  TYR  84           HB3      TYR  84 -23.125  -9.265  -0.391
    5    HD1  TYR  84           HD1      TYR  84 -20.778  -9.062  -0.500
    6    HD2  TYR  84           HD2      TYR  84 -23.210  -6.894  -3.260
    7    HE1  TYR  84           HE1      TYR  84 -18.779  -7.834  -1.278
    8    HE2  TYR  84           HE2      TYR  84 -21.219  -5.667  -4.055
    9    HH   TYR  84           HH       TYR  84 -18.192  -6.605  -3.617

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLY  85           H        GLY  85 -23.451 -11.645  -0.389
    2    HA3  GLY  85           HA2      GLY  85 -20.901 -12.632  -0.929
    3    HA2  GLY  85           HA3      GLY  85 -22.127 -13.461   0.031

  No H/Q in entry =           3
  In of MODEL    2
    1    H    LYS  86           H        LYS  86 -24.022 -13.793  -1.992
    2    HA   LYS  86           HA       LYS  86 -23.037 -16.180  -3.281
    3    HB2  LYS  86           HB2      LYS  86 -25.274 -15.926  -2.250
    4    HB3  LYS  86           HB3      LYS  86 -25.668 -14.712  -3.467
    5    HG2  LYS  86           HG2      LYS  86 -25.557 -16.389  -5.195
    6    HG3  LYS  86           HG3      LYS  86 -25.125 -17.608  -3.997
    7    HD2  LYS  86           HD2      LYS  86 -27.216 -17.151  -2.784
    8    HD3  LYS  86           HD3      LYS  86 -27.650 -15.944  -3.992
    9    HE2  LYS  86           HE2      LYS  86 -28.827 -17.847  -4.657
   10    HE3  LYS  86           HE3      LYS  86 -27.398 -17.858  -5.691
   11    HZ2  LYS  86           HZ1      LYS  86 -27.720 -19.389  -3.162
   12    HZ1  LYS  86           HZ2      LYS  86 -26.338 -19.393  -4.150
   13    HZ3  LYS  86           HZ3      LYS  86 -27.797 -20.038  -4.729

  No H/Q in entry =          13
  In of MODEL    2
    1    H    VAL  87           H        VAL  87 -22.987 -12.962  -4.164
    2    HA   VAL  87           HA       VAL  87 -22.707 -11.787  -6.106
    3    HB   VAL  87           HB       VAL  87 -21.732 -14.267  -7.531
    4   HG11  VAL  87          HG11      VAL  87 -21.751 -11.993  -8.602
    5   HG13  VAL  87          HG12      VAL  87 -20.139 -12.704  -8.494
    6   HG12  VAL  87          HG13      VAL  87 -20.628 -11.448  -7.357
    7   HG21  VAL  87          HG21      VAL  87 -20.300 -12.902  -5.265
    8   HG23  VAL  87          HG22      VAL  87 -19.502 -13.927  -6.453
    9   HG22  VAL  87          HG23      VAL  87 -20.738 -14.603  -5.396

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ASP  88           H        ASP  88 -25.225 -12.386  -5.705
    2    HA   ASP  88           HA       ASP  88 -26.418 -13.574  -8.083
    3    HB2  ASP  88           HB2      ASP  88 -27.370 -13.809  -5.739
    4    HB3  ASP  88           HB3      ASP  88 -27.794 -12.101  -5.824

  No H/Q in entry =           4
  In of MODEL    2
    1    H    GLY  89           H        GLY  89 -25.726 -12.323  -9.735
    2    HA3  GLY  89           HA2      GLY  89 -25.863  -9.546  -9.922
    3    HA2  GLY  89           HA3      GLY  89 -25.887 -10.663 -11.286

  No H/Q in entry =           3
  In of MODEL    2
    1    H    LEU  90           H        LEU  90 -28.347 -11.973 -10.790
    2    HA   LEU  90           HA       LEU  90 -30.147 -10.003 -11.859
    3    HB2  LEU  90           HB2      LEU  90 -30.265 -12.395 -12.446
    4    HB3  LEU  90           HB3      LEU  90 -30.743 -12.760 -10.788
    5    HG   LEU  90           HG       LEU  90 -32.849 -11.604 -11.103
    6   HD13  LEU  90          HD11      LEU  90 -32.670  -9.862 -12.576
    7   HD12  LEU  90          HD12      LEU  90 -33.256 -11.086 -13.706
    8   HD11  LEU  90          HD13      LEU  90 -31.533 -10.721 -13.616
    9   HD23  LEU  90          HD21      LEU  90 -32.859 -13.226 -13.544
   10   HD22  LEU  90          HD22      LEU  90 -33.810 -13.380 -12.067
   11   HD21  LEU  90          HD23      LEU  90 -32.168 -14.020 -12.129

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLY  91           H        GLY  91 -29.938 -11.518  -8.685
    2    HA3  GLY  91           HA2      GLY  91 -32.234 -10.370  -7.592
    3    HA2  GLY  91           HA3      GLY  91 -30.832 -10.930  -6.681

  No H/Q in entry =           3
  In of MODEL    2
    1    H    VAL  92           H        VAL  92 -28.901  -9.133  -7.573
    2    HA   VAL  92           HA       VAL  92 -29.620  -6.824  -5.999
    3    HB   VAL  92           HB       VAL  92 -27.117  -7.331  -7.650
    4   HG12  VAL  92          HG11      VAL  92 -27.200  -5.451  -5.315
    5   HG11  VAL  92          HG12      VAL  92 -27.888  -4.891  -6.841
    6   HG13  VAL  92          HG13      VAL  92 -26.199  -5.389  -6.766
    7   HG22  VAL  92          HG21      VAL  92 -26.887  -8.928  -6.068
    8   HG21  VAL  92          HG22      VAL  92 -27.995  -8.132  -4.948
    9   HG23  VAL  92          HG23      VAL  92 -26.334  -7.559  -5.103

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LEU  93           H        LEU  93 -29.297  -7.480  -9.430
    2    HA   LEU  93           HA       LEU  93 -29.618  -4.837 -10.343
    3    HB2  LEU  93           HB2      LEU  93 -29.039  -6.697 -11.824
    4    HB3  LEU  93           HB3      LEU  93 -30.637  -7.399 -11.570
    5    HG   LEU  93           HG       LEU  93 -31.639  -5.414 -12.666
    6   HD11  LEU  93          HD11      LEU  93 -29.751  -3.852 -12.196
    7   HD13  LEU  93          HD12      LEU  93 -30.227  -3.868 -13.896
    8   HD12  LEU  93          HD13      LEU  93 -28.779  -4.730 -13.378
    9   HD23  LEU  93          HD21      LEU  93 -30.659  -5.991 -14.977
   10   HD22  LEU  93          HD22      LEU  93 -31.503  -7.236 -14.057
   11   HD21  LEU  93          HD23      LEU  93 -29.738  -7.210 -14.097

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LYS  94           H        LYS  94 -32.017  -7.345  -9.451
    2    HA   LYS  94           HA       LYS  94 -34.349  -5.862 -10.021
    3    HB2  LYS  94           HB2      LYS  94 -33.830  -8.063  -8.028
    4    HB3  LYS  94           HB3      LYS  94 -35.420  -7.340  -8.259
    5    HG2  LYS  94           HG2      LYS  94 -35.396  -8.108 -10.597
    6    HG3  LYS  94           HG3      LYS  94 -33.842  -8.887 -10.305
    7    HD2  LYS  94           HD2      LYS  94 -34.945 -10.207  -8.461
    8    HD3  LYS  94           HD3      LYS  94 -36.489  -9.532  -8.980
    9    HE2  LYS  94           HE2      LYS  94 -36.039 -10.462 -11.260
   10    HE3  LYS  94           HE3      LYS  94 -34.622 -11.271 -10.591
   11    HZ3  LYS  94           HZ1      LYS  94 -36.500 -12.761 -10.725
   12    HZ2  LYS  94           HZ2      LYS  94 -37.436 -11.722  -9.760
   13    HZ1  LYS  94           HZ3      LYS  94 -36.075 -12.496  -9.103

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ALA  95           H        ALA  95 -32.463  -6.025  -7.013
    2    HA   ALA  95           HA       ALA  95 -34.253  -4.419  -5.488
    3    HB2  ALA  95           HB1      ALA  95 -31.891  -5.835  -5.007
    4    HB3  ALA  95           HB2      ALA  95 -32.829  -4.918  -3.830
    5    HB1  ALA  95           HB3      ALA  95 -31.486  -4.151  -4.678

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA  96           H        ALA  96 -31.643  -3.602  -7.639
    2    HA   ALA  96           HA       ALA  96 -31.483  -0.846  -6.859
    3    HB2  ALA  96           HB1      ALA  96 -30.163  -0.635  -8.997
    4    HB3  ALA  96           HB2      ALA  96 -30.503  -2.335  -9.315
    5    HB1  ALA  96           HB3      ALA  96 -29.550  -1.876  -7.905

  No H/Q in entry =           5
  In of MODEL    2
    1    H    VAL  97           H        VAL  97 -33.102  -2.523  -9.517
    2    HA   VAL  97           HA       VAL  97 -34.158  -0.201 -10.742
    3    HB   VAL  97           HB       VAL  97 -35.020  -3.111 -10.777
    4   HG11  VAL  97          HG11      VAL  97 -36.786  -1.072 -11.217
    5   HG13  VAL  97          HG12      VAL  97 -36.890  -2.660 -11.977
    6   HG12  VAL  97          HG13      VAL  97 -36.131  -1.321 -12.837
    7   HG21  VAL  97          HG21      VAL  97 -33.752  -1.298 -12.833
    8   HG23  VAL  97          HG22      VAL  97 -34.241  -2.970 -13.118
    9   HG22  VAL  97          HG23      VAL  97 -32.961  -2.610 -11.959

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ALA  98           H        ALA  98 -35.325  -2.367  -8.188
    2    HA   ALA  98           HA       ALA  98 -37.856  -1.174  -7.777
    3    HB1  ALA  98           HB1      ALA  98 -36.861  -3.395  -6.775
    4    HB3  ALA  98           HB2      ALA  98 -38.004  -2.454  -5.815
    5    HB2  ALA  98           HB3      ALA  98 -36.273  -2.337  -5.492

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA  99           H        ALA  99 -34.728  -0.439  -6.195
    2    HA   ALA  99           HA       ALA  99 -35.783   1.559  -4.501
    3    HB1  ALA  99           HB1      ALA  99 -33.169   0.622  -5.310
    4    HB2  ALA  99           HB2      ALA  99 -33.673   1.376  -3.797
    5    HB3  ALA  99           HB3      ALA  99 -33.207   2.380  -5.169

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ILE 100           H        ILE 100 -34.813   1.684  -7.878
    2    HA   ILE 100           HA       ILE 100 -34.942   4.536  -8.082
    3    HB   ILE 100           HB       ILE 100 -35.125   2.392 -10.227
    4   HG12  ILE 100          HG12      ILE 100 -32.909   4.340  -9.595
    5   HG13  ILE 100          HG13      ILE 100 -32.964   2.691  -8.971
    6   HG21  ILE 100          HG21      ILE 100 -35.494   5.321 -10.337
    7   HG23  ILE 100          HG22      ILE 100 -36.048   4.067 -11.447
    8   HG22  ILE 100          HG23      ILE 100 -34.385   4.651 -11.535
    9   HD12  ILE 100          HD11      ILE 100 -32.473   3.650 -11.753
   10   HD11  ILE 100          HD12      ILE 100 -33.160   2.047 -11.490
   11   HD13  ILE 100          HD13      ILE 100 -31.590   2.457 -10.802

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LYS 101           H        LYS 101 -37.301   1.975  -8.769
    2    HA   LYS 101           HA       LYS 101 -39.371   3.670  -9.717
    3    HB2  LYS 101           HB2      LYS 101 -39.285   0.888  -8.604
    4    HB3  LYS 101           HB3      LYS 101 -40.829   1.682  -8.912
    5    HG2  LYS 101           HG2      LYS 101 -40.402   1.818 -11.218
    6    HG3  LYS 101           HG3      LYS 101 -38.710   1.378 -11.003
    7    HD2  LYS 101           HD2      LYS 101 -40.015  -0.501 -11.869
    8    HD3  LYS 101           HD3      LYS 101 -39.360  -0.851 -10.270
    9    HE2  LYS 101           HE2      LYS 101 -41.426  -1.507  -9.721
   10    HE3  LYS 101           HE3      LYS 101 -41.847   0.205  -9.707
   11    HZ3  LYS 101           HZ1      LYS 101 -42.788   0.076 -11.805
   12    HZ2  LYS 101           HZ2      LYS 101 -43.262  -1.392 -11.094
   13    HZ1  LYS 101           HZ3      LYS 101 -41.979  -1.364 -12.205

  No H/Q in entry =          13
  In of MODEL    2
    1    H    LYS 102           H        LYS 102 -38.839   2.168  -6.526
    2    HA   LYS 102           HA       LYS 102 -41.036   3.402  -5.275
    3    HB2  LYS 102           HB2      LYS 102 -39.816   1.505  -4.294
    4    HB3  LYS 102           HB3      LYS 102 -38.399   2.533  -4.076
    5    HG2  LYS 102           HG2      LYS 102 -39.656   3.946  -2.545
    6    HG3  LYS 102           HG3      LYS 102 -41.075   2.923  -2.765
    7    HD2  LYS 102           HD2      LYS 102 -39.865   1.028  -1.774
    8    HD3  LYS 102           HD3      LYS 102 -38.445   2.052  -1.552
    9    HE2  LYS 102           HE2      LYS 102 -39.740   3.550  -0.108
   10    HE3  LYS 102           HE3      LYS 102 -41.176   2.557  -0.350
   11    HZ1  LYS 102           HZ1      LYS 102 -39.470   0.764   0.608
   12    HZ3  LYS 102           HZ2      LYS 102 -40.542   1.666   1.565
   13    HZ2  LYS 102           HZ3      LYS 102 -38.925   2.160   1.406

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ALA 103           H        ALA 103 -38.078   4.739  -6.344
    2    HA   ALA 103           HA       ALA 103 -38.217   7.048  -4.547
    3    HB2  ALA 103           HB1      ALA 103 -36.245   7.751  -6.161
    4    HB3  ALA 103           HB2      ALA 103 -36.252   6.036  -6.569
    5    HB1  ALA 103           HB3      ALA 103 -35.979   6.546  -4.903

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA 104           H        ALA 104 -38.922   6.347  -7.882
    2    HA   ALA 104           HA       ALA 104 -39.466   9.146  -8.479
    3    HB2  ALA 104           HB1      ALA 104 -39.569   8.490 -10.684
    4    HB1  ALA 104           HB2      ALA 104 -40.318   6.941 -10.297
    5    HB3  ALA 104           HB3      ALA 104 -38.586   7.169 -10.053

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA 105           H        ALA 105 -41.077   7.064  -6.651
    2    HA   ALA 105           HA       ALA 105 -43.472   8.505  -6.565
    3    HB2  ALA 105           HB1      ALA 105 -44.276   7.670  -8.592
    4    HB3  ALA 105           HB2      ALA 105 -44.912   6.489  -7.447
    5    HB1  ALA 105           HB3      ALA 105 -43.470   6.116  -8.389
    6    H1   ALA   1           H3       ALA   1 -12.066 -16.016  -2.341
    7    H2   ALA   1           H2       ALA   1 -11.110 -17.150  -3.176
    8    H3   ALA   1           H1       ALA   1 -12.265 -16.222  -4.014
    9    HA   ALA   1           HA       ALA   1 -13.644 -17.938  -3.768
   10    HB3  ALA   1           HB1      ALA   1 -12.228 -19.691  -3.298
   11    HB1  ALA   1           HB2      ALA   1 -12.986 -19.581  -1.710
   12    HB2  ALA   1           HB3      ALA   1 -11.419 -18.823  -1.993

  No H/Q in entry =          12
  In of MODEL    3
    1    H    GLU   2           H        GLU   2 -15.258 -18.804  -2.111
    2    HA   GLU   2           HA       GLU   2 -16.926 -17.099  -1.060
    3    HB2  GLU   2           HB2      GLU   2 -15.960 -19.507   0.495
    4    HB3  GLU   2           HB3      GLU   2 -17.494 -18.673   0.745
    5    HG2  GLU   2           HG2      GLU   2 -18.460 -19.778  -0.986
    6    HG3  GLU   2           HG3      GLU   2 -17.141 -19.366  -2.071

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLU   3           H        GLU   3 -15.000 -18.419   1.569
    2    HA   GLU   3           HA       GLU   3 -15.249 -16.062   3.117
    3    HB2  GLU   3           HB2      GLU   3 -13.635 -18.589   3.379
    4    HB3  GLU   3           HB3      GLU   3 -13.419 -17.262   4.521
    5    HG2  GLU   3           HG2      GLU   3 -15.611 -17.435   5.338
    6    HG3  GLU   3           HG3      GLU   3 -16.196 -18.248   3.892

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LEU   4           H        LEU   4 -12.277 -17.512   1.734
    2    HA   LEU   4           HA       LEU   4 -10.465 -15.585   2.325
    3    HB2  LEU   4           HB2      LEU   4 -10.679 -16.897  -0.394
    4    HB3  LEU   4           HB3      LEU   4  -9.236 -16.157   0.288
    5    HG   LEU   4           HG       LEU   4 -10.703 -18.566   1.410
    6   HD13  LEU   4          HD11      LEU   4  -9.054 -19.907   0.488
    7   HD12  LEU   4          HD12      LEU   4  -7.859 -18.611   0.456
    8   HD11  LEU   4          HD13      LEU   4  -9.147 -18.652  -0.747
    9   HD23  LEU   4          HD21      LEU   4  -8.452 -18.599   2.794
   10   HD22  LEU   4          HD22      LEU   4  -9.785 -17.572   3.317
   11   HD21  LEU   4          HD23      LEU   4  -8.430 -16.871   2.433

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLU   5           H        GLU   5 -12.800 -15.416  -0.351
    2    HA   GLU   5           HA       GLU   5 -11.824 -12.926  -1.361
    3    HB2  GLU   5           HB2      GLU   5 -13.151 -14.532  -2.717
    4    HB3  GLU   5           HB3      GLU   5 -14.556 -14.181  -1.711
    5    HG2  GLU   5           HG2      GLU   5 -14.468 -11.821  -2.367
    6    HG3  GLU   5           HG3      GLU   5 -13.024 -12.129  -3.331

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLU   6           H        GLU   6 -14.541 -13.826   0.732
    2    HA   GLU   6           HA       GLU   6 -15.476 -11.158   1.120
    3    HB2  GLU   6           HB2      GLU   6 -15.867 -13.701   2.713
    4    HB3  GLU   6           HB3      GLU   6 -16.675 -12.180   3.088
    5    HG2  GLU   6           HG2      GLU   6 -16.843 -13.598   0.415
    6    HG3  GLU   6           HG3      GLU   6 -18.075 -13.686   1.672

  No H/Q in entry =           6
  In of MODEL    3
    1    H    VAL   7           H        VAL   7 -13.146 -13.236   2.702
    2    HA   VAL   7           HA       VAL   7 -12.699 -11.646   5.023
    3    HB   VAL   7           HB       VAL   7 -10.972 -13.677   3.583
    4   HG11  VAL   7          HG11      VAL   7 -10.523 -12.128   6.141
    5   HG13  VAL   7          HG12      VAL   7  -9.419 -12.335   4.782
    6   HG12  VAL   7          HG13      VAL   7  -9.758 -13.692   5.858
    7   HG21  VAL   7          HG21      VAL   7 -13.217 -14.261   4.804
    8   HG23  VAL   7          HG22      VAL   7 -12.294 -13.970   6.279
    9   HG22  VAL   7          HG23      VAL   7 -11.786 -15.229   5.155

  No H/Q in entry =           9
  In of MODEL    3
    1    H    VAL   8           H        VAL   8 -11.184 -11.757   1.815
    2    HA   VAL   8           HA       VAL   8  -9.143  -9.859   2.301
    3    HB   VAL   8           HB       VAL   8 -10.596 -10.576  -0.256
    4   HG12  VAL   8          HG11      VAL   8  -8.414  -9.555  -1.245
    5   HG11  VAL   8          HG12      VAL   8  -8.273  -8.737   0.312
    6   HG13  VAL   8          HG13      VAL   8  -9.684  -8.453  -0.708
    7   HG21  VAL   8          HG21      VAL   8  -8.828 -12.088   1.274
    8   HG23  VAL   8          HG22      VAL   8  -7.760 -11.312   0.109
    9   HG22  VAL   8          HG23      VAL   8  -9.098 -12.307  -0.456

  No H/Q in entry =           9
  In of MODEL    3
    1    H    MET   9           H        MET   9 -12.492  -9.512   1.137
    2    HA   MET   9           HA       MET   9 -12.459  -6.737   0.691
    3    HB2  MET   9           HB2      MET   9 -14.645  -8.645   1.510
    4    HB3  MET   9           HB3      MET   9 -14.955  -6.918   1.321
    5    HG2  MET   9           HG2      MET   9 -14.071  -7.030  -0.995
    6    HG3  MET   9           HG3      MET   9 -13.831  -8.767  -0.802
    7    HE1  MET   9           HE1      MET   9 -15.958  -5.881  -0.415
    8    HE3  MET   9           HE2      MET   9 -17.362  -6.604   0.363
    9    HE2  MET   9           HE3      MET   9 -17.420  -6.212  -1.353

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLY  10           H        GLY  10 -13.103  -8.623   3.625
    2    HA3  GLY  10           HA2      GLY  10 -13.678  -6.438   5.335
    3    HA2  GLY  10           HA3      GLY  10 -13.096  -8.018   5.856

  No H/Q in entry =           3
  In of MODEL    3
    1    H    LEU  11           H        LEU  11 -10.648  -8.119   4.543
    2    HA   LEU  11           HA       LEU  11  -8.966  -6.658   6.296
    3    HB2  LEU  11           HB2      LEU  11  -8.400  -8.086   3.695
    4    HB3  LEU  11           HB3      LEU  11  -7.139  -7.363   4.691
    5    HG   LEU  11           HG       LEU  11  -9.118  -9.415   5.715
    6   HD13  LEU  11          HD11      LEU  11  -7.881 -10.644   4.157
    7   HD12  LEU  11          HD12      LEU  11  -6.944 -10.865   5.634
    8   HD11  LEU  11          HD13      LEU  11  -6.416  -9.699   4.422
    9   HD22  LEU  11          HD21      LEU  11  -8.279  -8.384   7.628
   10   HD21  LEU  11          HD22      LEU  11  -6.745  -7.967   6.865
   11   HD23  LEU  11          HD23      LEU  11  -7.052  -9.625   7.381

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  12           H        ILE  12  -9.871  -6.136   2.903
    2    HA   ILE  12           HA       ILE  12  -8.206  -3.888   2.468
    3    HB   ILE  12           HB       ILE  12 -10.850  -4.594   1.173
    4   HG12  ILE  12          HG12      ILE  12  -8.799  -6.227   1.109
    5   HG13  ILE  12          HG13      ILE  12  -9.660  -5.883  -0.378
    6   HG22  ILE  12          HG21      ILE  12  -9.982  -3.192  -0.712
    7   HG21  ILE  12          HG22      ILE  12  -8.639  -2.696   0.309
    8   HG23  ILE  12          HG23      ILE  12 -10.273  -2.286   0.741
    9   HD12  ILE  12          HD11      ILE  12  -7.156  -5.810  -0.579
   10   HD11  ILE  12          HD12      ILE  12  -7.157  -4.442   0.530
   11   HD13  ILE  12          HD13      ILE  12  -7.936  -4.306  -1.027

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  13           H        ILE  13 -11.564  -4.192   3.560
    2    HA   ILE  13           HA       ILE  13 -12.059  -1.409   3.817
    3    HB   ILE  13           HB       ILE  13 -13.235  -3.840   5.186
    4   HG12  ILE  13          HG12      ILE  13 -13.464  -3.301   2.647
    5   HG13  ILE  13          HG13      ILE  13 -14.884  -3.782   3.552
    6   HG22  ILE  13          HG21      ILE  13 -15.158  -2.197   5.717
    7   HG21  ILE  13          HG22      ILE  13 -13.978  -0.917   5.462
    8   HG23  ILE  13          HG23      ILE  13 -13.722  -2.109   6.734
    9   HD11  ILE  13          HD11      ILE  13 -14.121  -0.890   3.075
   10   HD13  ILE  13          HD12      ILE  13 -15.606  -1.507   3.770
   11   HD12  ILE  13          HD13      ILE  13 -15.267  -1.794   2.078

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ASN  14           H        ASN  14 -10.919  -3.876   6.103
    2    HA   ASN  14           HA       ASN  14 -10.741  -2.226   8.382
    3    HB2  ASN  14           HB2      ASN  14 -10.455  -4.831   8.072
    4    HB3  ASN  14           HB3      ASN  14  -8.751  -4.423   7.915
    5   HD21  ASN  14          HD21      ASN  14  -9.370  -5.946  10.096
    6   HD22  ASN  14          HD22      ASN  14  -9.356  -5.019  11.517

  No H/Q in entry =           6
  In of MODEL    3
    1    H    SER  15           H        SER  15  -8.326  -3.029   5.896
    2    HA   SER  15           HA       SER  15  -6.204  -1.503   6.964
    3    HB2  SER  15           HB2      SER  15  -5.178  -1.714   4.808
    4    HB3  SER  15           HB3      SER  15  -6.113  -3.186   5.039
    5    HG   SER  15           HG       SER  15  -6.957  -2.613   3.196

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLY  16           H        GLY  16  -8.814  -0.681   4.711
    2    HA3  GLY  16           HA2      GLY  16  -7.990   1.969   4.148
    3    HA2  GLY  16           HA3      GLY  16  -9.633   1.351   3.987

  No H/Q in entry =           3
  In of MODEL    3
    1    H    GLN  17           H        GLN  17 -10.169   0.630   6.640
    2    HA   GLN  17           HA       GLN  17 -10.912   3.130   7.768
    3    HB2  GLN  17           HB2      GLN  17 -12.125   1.045   8.269
    4    HB3  GLN  17           HB3      GLN  17 -10.707   0.422   9.113
    5    HG2  GLN  17           HG2      GLN  17 -10.836   2.213  10.753
    6    HG3  GLN  17           HG3      GLN  17 -12.153   2.976   9.866
    7   HE21  GLN  17          HE21      GLN  17 -12.504   2.184  12.583
    8   HE22  GLN  17          HE22      GLN  17 -13.606   0.893  12.630

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ALA  18           H        ALA  18  -8.252   0.888   8.401
    2    HA   ALA  18           HA       ALA  18  -7.174   2.129  10.667
    3    HB2  ALA  18           HB1      ALA  18  -6.532  -0.084   9.310
    4    HB3  ALA  18           HB2      ALA  18  -5.381   0.720  10.379
    5    HB1  ALA  18           HB3      ALA  18  -5.306   0.992   8.637

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ARG  19           H        ARG  19  -6.406   2.648   7.217
    2    HA   ARG  19           HA       ARG  19  -4.538   4.724   7.639
    3    HB2  ARG  19           HB2      ARG  19  -4.846   3.569   5.448
    4    HB3  ARG  19           HB3      ARG  19  -6.401   4.387   5.266
    5    HG2  ARG  19           HG2      ARG  19  -5.304   6.575   5.326
    6    HG3  ARG  19           HG3      ARG  19  -3.744   5.813   5.635
    7    HD2  ARG  19           HD2      ARG  19  -3.874   6.391   3.289
    8    HD3  ARG  19           HD3      ARG  19  -3.934   4.631   3.443
    9    HE   ARG  19           HE       ARG  19  -6.581   5.502   3.428
   10   HH21  ARG  19          HH11      ARG  19  -7.775   5.632   1.508
   11   HH22  ARG  19          HH12      ARG  19  -6.953   5.715  -0.011
   12   HH11  ARG  19          HH21      ARG  19  -3.804   5.596   1.397
   13   HH12  ARG  19          HH22      ARG  19  -4.703   5.692  -0.074

  No H/Q in entry =          13
  In of MODEL    3
    1    H    SER  20           H        SER  20  -8.037   4.786   7.034
    2    HA   SER  20           HA       SER  20  -8.435   7.536   6.973
    3    HB2  SER  20           HB2      SER  20 -10.209   5.907   6.478
    4    HB3  SER  20           HB3      SER  20 -10.248   5.432   8.174
    5    HG   SER  20           HG       SER  20 -11.205   7.710   6.917

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU  21           H        LEU  21  -8.406   5.366   9.787
    2    HA   LEU  21           HA       LEU  21  -8.879   7.364  11.742
    3    HB2  LEU  21           HB2      LEU  21  -7.489   4.683  11.915
    4    HB3  LEU  21           HB3      LEU  21  -7.810   5.702  13.315
    5    HG   LEU  21           HG       LEU  21  -9.973   4.775  11.401
    6   HD11  LEU  21          HD11      LEU  21  -8.983   3.563  13.994
    7   HD13  LEU  21          HD12      LEU  21  -9.063   2.791  12.410
    8   HD12  LEU  21          HD13      LEU  21 -10.549   3.176  13.280
    9   HD22  LEU  21          HD21      LEU  21 -10.877   6.592  12.575
   10   HD21  LEU  21          HD22      LEU  21  -9.933   6.272  14.026
   11   HD23  LEU  21          HD23      LEU  21 -11.315   5.259  13.640

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ALA  22           H        ALA  22  -5.904   6.029  10.345
    2    HA   ALA  22           HA       ALA  22  -4.047   7.379  11.963
    3    HB2  ALA  22           HB1      ALA  22  -3.600   5.524  10.281
    4    HB1  ALA  22           HB2      ALA  22  -2.424   6.838  10.312
    5    HB3  ALA  22           HB3      ALA  22  -3.640   6.770   9.035

  No H/Q in entry =           5
  In of MODEL    3
    1    H    TYR  23           H        TYR  23  -5.375   8.361   8.774
    2    HA   TYR  23           HA       TYR  23  -4.078  10.877   8.694
    3    HB2  TYR  23           HB2      TYR  23  -5.140   9.941   6.705
    4    HB3  TYR  23           HB3      TYR  23  -6.722  10.025   7.483
    5    HD1  TYR  23           HD1      TYR  23  -3.844  12.121   6.358
    6    HD2  TYR  23           HD2      TYR  23  -8.002  12.004   7.424
    7    HE1  TYR  23           HE1      TYR  23  -4.107  14.464   5.588
    8    HE2  TYR  23           HE2      TYR  23  -8.265  14.346   6.653
    9    HH   TYR  23           HH       TYR  23  -5.502  16.160   5.312

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ALA  24           H        ALA  24  -7.184   9.857  10.074
    2    HA   ALA  24           HA       ALA  24  -8.062  12.438  10.831
    3    HB1  ALA  24           HB1      ALA  24  -9.861  11.161  11.302
    4    HB2  ALA  24           HB2      ALA  24  -9.029  10.609  12.754
    5    HB3  ALA  24           HB3      ALA  24  -8.887   9.692  11.255

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA  25           H        ALA  25  -6.024  10.018  12.420
    2    HA   ALA  25           HA       ALA  25  -5.710  11.287  14.917
    3    HB2  ALA  25           HB1      ALA  25  -4.905   8.944  14.108
    4    HB3  ALA  25           HB2      ALA  25  -3.905   9.823  15.266
    5    HB1  ALA  25           HB3      ALA  25  -3.466   9.805  13.558

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU  26           H        LEU  26  -3.919  11.600  11.878
    2    HA   LEU  26           HA       LEU  26  -1.990  13.454  12.788
    3    HB2  LEU  26           HB2      LEU  26  -1.667  12.297  10.690
    4    HB3  LEU  26           HB3      LEU  26  -3.150  12.979  10.030
    5    HG   LEU  26           HG       LEU  26  -2.171  15.246  10.157
    6   HD12  LEU  26          HD11      LEU  26   0.366  15.306  10.575
    7   HD11  LEU  26          HD12      LEU  26   0.166  13.726  11.326
    8   HD13  LEU  26          HD13      LEU  26  -0.664  15.131  11.994
    9   HD21  LEU  26          HD21      LEU  26  -0.394  13.212   8.774
   10   HD23  LEU  26          HD22      LEU  26  -0.463  14.931   8.396
   11   HD22  LEU  26          HD23      LEU  26  -1.870  13.910   8.110

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LYS  27           H        LYS  27  -5.177  13.881  11.304
    2    HA   LYS  27           HA       LYS  27  -5.164  16.669  11.093
    3    HB2  LYS  27           HB2      LYS  27  -6.883  15.161  10.112
    4    HB3  LYS  27           HB3      LYS  27  -7.539  14.902  11.728
    5    HG2  LYS  27           HG2      LYS  27  -8.005  17.303  11.952
    6    HG3  LYS  27           HG3      LYS  27  -7.299  17.603  10.361
    7    HD2  LYS  27           HD2      LYS  27  -9.008  16.138   9.329
    8    HD3  LYS  27           HD3      LYS  27  -9.720  15.855  10.919
    9    HE2  LYS  27           HE2      LYS  27 -10.200  18.260  11.150
   10    HE3  LYS  27           HE3      LYS  27  -9.459  18.565   9.575
   11    HZ3  LYS  27           HZ1      LYS  27 -11.834  18.404   9.330
   12    HZ2  LYS  27           HZ2      LYS  27 -11.861  16.890  10.107
   13    HZ1  LYS  27           HZ3      LYS  27 -11.116  17.058   8.585

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLN  28           H        GLN  28  -6.025  14.583  13.828
    2    HA   GLN  28           HA       GLN  28  -6.953  16.581  15.594
    3    HB2  GLN  28           HB2      GLN  28  -5.515  13.973  16.149
    4    HB3  GLN  28           HB3      GLN  28  -6.269  14.972  17.392
    5    HG2  GLN  28           HG2      GLN  28  -7.718  13.827  14.989
    6    HG3  GLN  28           HG3      GLN  28  -7.762  13.136  16.610
    7   HE21  GLN  28          HE21      GLN  28  -9.655  14.924  14.644
    8   HE22  GLN  28          HE22      GLN  28 -10.419  15.927  15.780

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ALA  29           H        ALA  29  -3.715  15.328  14.915
    2    HA   ALA  29           HA       ALA  29  -2.300  16.755  16.889
    3    HB1  ALA  29           HB1      ALA  29  -0.358  16.086  15.776
    4    HB3  ALA  29           HB2      ALA  29  -1.111  16.192  14.185
    5    HB2  ALA  29           HB3      ALA  29  -1.516  14.859  15.265

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LYS  30           H        LYS  30  -3.165  17.607  13.554
    2    HA   LYS  30           HA       LYS  30  -1.786  20.065  13.445
    3    HB2  LYS  30           HB2      LYS  30  -4.303  19.153  12.037
    4    HB3  LYS  30           HB3      LYS  30  -3.488  20.676  11.687
    5    HG2  LYS  30           HG2      LYS  30  -1.402  19.407  11.182
    6    HG3  LYS  30           HG3      LYS  30  -2.290  17.901  11.432
    7    HD2  LYS  30           HD2      LYS  30  -3.859  18.514   9.633
    8    HD3  LYS  30           HD3      LYS  30  -2.994  20.032   9.384
    9    HE2  LYS  30           HE2      LYS  30  -0.945  18.761   8.813
   10    HE3  LYS  30           HE3      LYS  30  -1.830  17.248   9.031
   11    HZ2  LYS  30           HZ1      LYS  30  -1.661  18.111   6.685
   12    HZ1  LYS  30           HZ2      LYS  30  -2.720  19.363   7.146
   13    HZ3  LYS  30           HZ3      LYS  30  -3.225  17.740   7.224

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLN  31           H        GLN  31  -4.878  19.183  14.857
    2    HA   GLN  31           HA       GLN  31  -5.673  21.932  15.296
    3    HB2  GLN  31           HB2      GLN  31  -6.826  19.479  16.628
    4    HB3  GLN  31           HB3      GLN  31  -7.603  21.040  16.375
    5    HG2  GLN  31           HG2      GLN  31  -6.881  20.260  13.789
    6    HG3  GLN  31           HG3      GLN  31  -7.390  18.753  14.542
    7   HE21  GLN  31          HE21      GLN  31  -8.815  20.302  12.432
    8   HE22  GLN  31          HE22      GLN  31 -10.334  20.680  13.086

  No H/Q in entry =           8
  In of MODEL    3
    1    H    GLY  32           H        GLY  32  -3.341  20.037  16.627
    2    HA3  GLY  32           HA2      GLY  32  -1.948  20.522  18.429
    3    HA2  GLY  32           HA3      GLY  32  -3.091  21.754  18.946

  No H/Q in entry =           3
  In of MODEL    3
    1    H    ASP  33           H        ASP  33  -4.480  18.697  18.295
    2    HA   ASP  33           HA       ASP  33  -4.888  18.247  21.177
    3    HB2  ASP  33           HB2      ASP  33  -6.281  17.210  18.702
    4    HB3  ASP  33           HB3      ASP  33  -6.622  16.603  20.320

  No H/Q in entry =           4
  In of MODEL    3
    1    H    PHE  34           H        PHE  34  -2.711  17.420  21.488
    2    HA   PHE  34           HA       PHE  34  -1.686  15.176  20.097
    3    HB2  PHE  34           HB2      PHE  34  -1.082  16.179  22.888
    4    HB3  PHE  34           HB3      PHE  34  -0.139  14.962  22.027
    5    HD1  PHE  34           HD1      PHE  34  -0.349  18.389  22.748
    6    HD2  PHE  34           HD2      PHE  34   0.513  15.682  19.525
    7    HE1  PHE  34           HE1      PHE  34   0.929  20.169  21.588
    8    HE2  PHE  34           HE2      PHE  34   1.786  17.465  18.370
    9    HZ   PHE  34           HZ       PHE  34   1.996  19.706  19.406

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ALA  35           H        ALA  35  -3.731  15.443  22.957
    2    HA   ALA  35           HA       ALA  35  -3.492  12.787  23.865
    3    HB3  ALA  35           HB1      ALA  35  -5.957  13.391  24.717
    4    HB1  ALA  35           HB2      ALA  35  -5.440  15.013  24.255
    5    HB2  ALA  35           HB3      ALA  35  -4.518  14.103  25.451

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA  36           H        ALA  36  -5.956  14.270  21.756
    2    HA   ALA  36           HA       ALA  36  -7.345  11.841  21.287
    3    HB1  ALA  36           HB1      ALA  36  -8.814  13.245  20.324
    4    HB3  ALA  36           HB2      ALA  36  -7.645  13.672  19.074
    5    HB2  ALA  36           HB3      ALA  36  -7.681  14.566  20.595

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA  37           H        ALA  37  -4.680  13.450  19.615
    2    HA   ALA  37           HA       ALA  37  -4.625  11.806  17.324
    3    HB3  ALA  37           HB1      ALA  37  -2.652  13.545  18.742
    4    HB2  ALA  37           HB2      ALA  37  -3.182  13.588  17.061
    5    HB1  ALA  37           HB3      ALA  37  -2.016  12.372  17.588

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LYS  38           H        LYS  38  -2.868  11.531  20.405
    2    HA   LYS  38           HA       LYS  38  -1.517   9.143  19.927
    3    HB2  LYS  38           HB2      LYS  38  -1.861  10.911  22.065
    4    HB3  LYS  38           HB3      LYS  38  -2.464   9.377  22.687
    5    HG2  LYS  38           HG2      LYS  38  -0.357   8.277  22.157
    6    HG3  LYS  38           HG3      LYS  38   0.237   9.725  21.338
    7    HD2  LYS  38           HD2      LYS  38   0.391  10.954  23.368
    8    HD3  LYS  38           HD3      LYS  38  -0.617   9.796  24.239
    9    HE2  LYS  38           HE2      LYS  38   1.741   9.508  24.861
   10    HE3  LYS  38           HE3      LYS  38   1.153   8.082  24.002
   11    HZ3  LYS  38           HZ1      LYS  38   2.450   8.507  22.221
   12    HZ2  LYS  38           HZ2      LYS  38   3.396   9.350  23.355
   13    HZ1  LYS  38           HZ3      LYS  38   2.308  10.194  22.359

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ALA  39           H        ALA  39  -4.762   9.609  21.324
    2    HA   ALA  39           HA       ALA  39  -5.294   6.886  21.839
    3    HB3  ALA  39           HB1      ALA  39  -7.472   8.805  21.062
    4    HB2  ALA  39           HB2      ALA  39  -6.578   9.047  22.563
    5    HB1  ALA  39           HB3      ALA  39  -7.479   7.552  22.305

  No H/Q in entry =           5
  In of MODEL    3
    1    H    MET  40           H        MET  40  -5.897   8.882  18.984
    2    HA   MET  40           HA       MET  40  -7.351   6.928  17.530
    3    HB2  MET  40           HB2      MET  40  -5.766   9.337  16.617
    4    HB3  MET  40           HB3      MET  40  -6.781   8.363  15.550
    5    HG2  MET  40           HG2      MET  40  -7.831   9.611  18.102
    6    HG3  MET  40           HG3      MET  40  -7.896  10.439  16.548
    7    HE3  MET  40           HE1      MET  40 -10.460   8.783  14.488
    8    HE2  MET  40           HE2      MET  40  -8.708   8.919  14.341
    9    HE1  MET  40           HE3      MET  40  -9.641  10.277  14.968

  No H/Q in entry =           9
  In of MODEL    3
    1    H    MET  41           H        MET  41  -3.868   7.704  17.653
    2    HA   MET  41           HA       MET  41  -3.088   5.950  15.560
    3    HB2  MET  41           HB2      MET  41  -1.482   6.644  18.032
    4    HB3  MET  41           HB3      MET  41  -0.856   5.997  16.519
    5    HG2  MET  41           HG2      MET  41  -2.035   8.163  15.506
    6    HG3  MET  41           HG3      MET  41  -1.807   8.760  17.148
    7    HE2  MET  41           HE1      MET  41   1.133   6.695  17.521
    8    HE1  MET  41           HE2      MET  41   0.329   7.984  18.413
    9    HE3  MET  41           HE3      MET  41   1.951   8.243  17.771

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ASP  42           H        ASP  42  -3.472   5.486  19.047
    2    HA   ASP  42           HA       ASP  42  -2.407   2.905  19.219
    3    HB2  ASP  42           HB2      ASP  42  -3.303   4.661  21.033
    4    HB3  ASP  42           HB3      ASP  42  -4.718   3.620  20.963

  No H/Q in entry =           4
  In of MODEL    3
    1    H    GLN  43           H        GLN  43  -5.752   3.969  18.710
    2    HA   GLN  43           HA       GLN  43  -6.866   1.368  18.524
    3    HB2  GLN  43           HB2      GLN  43  -7.818   4.005  17.384
    4    HB3  GLN  43           HB3      GLN  43  -8.764   2.515  17.367
    5    HG2  GLN  43           HG2      GLN  43  -8.472   2.406  19.875
    6    HG3  GLN  43           HG3      GLN  43  -7.766   4.019  19.798
    7   HE21  GLN  43          HE21      GLN  43  -9.948   4.080  21.296
    8   HE22  GLN  43          HE22      GLN  43 -11.314   4.637  20.461

  No H/Q in entry =           8
  In of MODEL    3
    1    H    SER  44           H        SER  44  -5.548   3.587  16.106
    2    HA   SER  44           HA       SER  44  -6.230   2.086  13.821
    3    HB2  SER  44           HB2      SER  44  -5.001   4.486  14.257
    4    HB3  SER  44           HB3      SER  44  -3.635   3.504  13.733
    5    HG   SER  44           HG       SER  44  -4.756   4.456  11.965

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ARG  45           H        ARG  45  -3.353   2.014  15.905
    2    HA   ARG  45           HA       ARG  45  -1.849   0.072  14.533
    3    HB2  ARG  45           HB2      ARG  45  -1.026   1.510  16.397
    4    HB3  ARG  45           HB3      ARG  45  -2.008   0.572  17.520
    5    HG2  ARG  45           HG2      ARG  45  -0.753  -1.475  16.886
    6    HG3  ARG  45           HG3      ARG  45   0.253  -0.512  15.806
    7    HD2  ARG  45           HD2      ARG  45   0.970   0.884  17.757
    8    HD3  ARG  45           HD3      ARG  45   0.058  -0.197  18.834
    9    HE   ARG  45           HE       ARG  45   1.778  -1.779  17.261
   10   HH21  ARG  45          HH11      ARG  45   3.686  -2.577  18.104
   11   HH22  ARG  45          HH12      ARG  45   4.448  -1.777  19.433
   12   HH11  ARG  45          HH21      ARG  45   2.050   0.700  19.642
   13   HH12  ARG  45          HH22      ARG  45   3.521   0.080  20.302

  No H/Q in entry =          13
  In of MODEL    3
    1    H    MET  46           H        MET  46  -4.246  -0.266  17.131
    2    HA   MET  46           HA       MET  46  -4.048  -3.062  17.448
    3    HB2  MET  46           HB2      MET  46  -6.239  -1.077  18.039
    4    HB3  MET  46           HB3      MET  46  -6.429  -2.798  18.384
    5    HG2  MET  46           HG2      MET  46  -4.444  -2.769  19.807
    6    HG3  MET  46           HG3      MET  46  -4.149  -1.083  19.410
    7    HE2  MET  46           HE1      MET  46  -7.044  -3.113  22.119
    8    HE1  MET  46           HE2      MET  46  -6.404  -3.664  20.574
    9    HE3  MET  46           HE3      MET  46  -7.915  -2.762  20.621

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ALA  47           H        ALA  47  -6.087  -1.075  15.344
    2    HA   ALA  47           HA       ALA  47  -7.681  -3.148  14.283
    3    HB3  ALA  47           HB1      ALA  47  -8.384  -0.919  13.858
    4    HB1  ALA  47           HB2      ALA  47  -7.886  -1.553  12.289
    5    HB2  ALA  47           HB3      ALA  47  -6.819  -0.470  13.184

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU  48           H        LEU  48  -4.575  -1.809  13.232
    2    HA   LEU  48           HA       LEU  48  -4.274  -3.405  10.897
    3    HB2  LEU  48           HB2      LEU  48  -2.233  -2.099  12.703
    4    HB3  LEU  48           HB3      LEU  48  -1.854  -2.821  11.140
    5    HG   LEU  48           HG       LEU  48  -3.900  -0.623  11.518
    6   HD13  LEU  48          HD11      LEU  48  -1.789   0.277  12.184
    7   HD12  LEU  48          HD12      LEU  48  -2.067   0.822  10.530
    8   HD11  LEU  48          HD13      LEU  48  -0.956  -0.512  10.844
    9   HD22  LEU  48          HD21      LEU  48  -4.359  -1.620   9.445
   10   HD21  LEU  48          HD22      LEU  48  -2.671  -2.039   9.154
   11   HD23  LEU  48          HD23      LEU  48  -3.207  -0.366   8.988

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ASN  49           H        ASN  49  -3.229  -3.779  14.246
    2    HA   ASN  49           HA       ASN  49  -1.604  -6.028  13.926
    3    HB2  ASN  49           HB2      ASN  49  -1.651  -4.681  15.968
    4    HB3  ASN  49           HB3      ASN  49  -3.302  -5.192  16.293
    5   HD21  ASN  49          HD21      ASN  49  -2.863  -6.320  18.248
    6   HD22  ASN  49          HD22      ASN  49  -1.902  -7.718  18.308

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLU  50           H        GLU  50  -5.076  -5.784  14.591
    2    HA   GLU  50           HA       GLU  50  -5.562  -8.587  14.709
    3    HB2  GLU  50           HB2      GLU  50  -7.165  -6.912  15.577
    4    HB3  GLU  50           HB3      GLU  50  -7.461  -6.356  13.927
    5    HG2  GLU  50           HG2      GLU  50  -8.304  -8.563  13.296
    6    HG3  GLU  50           HG3      GLU  50  -7.920  -9.197  14.892

  No H/Q in entry =           6
  In of MODEL    3
    1    H    ALA  51           H        ALA  51  -5.648  -6.199  12.104
    2    HA   ALA  51           HA       ALA  51  -6.614  -7.943  10.087
    3    HB2  ALA  51           HB1      ALA  51  -6.408  -6.133   8.712
    4    HB1  ALA  51           HB2      ALA  51  -4.773  -5.767   9.262
    5    HB3  ALA  51           HB3      ALA  51  -6.163  -5.265  10.226

  No H/Q in entry =           5
  In of MODEL    3
    1    H    HIS  52           H        HIS  52  -3.333  -7.003  11.073
    2    HA   HIS  52           HA       HIS  52  -1.918  -8.487   9.131
    3    HB2  HIS  52           HB2      HIS  52  -0.914  -6.734  10.583
    4    HB3  HIS  52           HB3      HIS  52  -1.054  -7.829  11.957
    5    HD1  HIS  52           HD1      HIS  52   0.421 -10.020  11.888
    6    HD2  HIS  52           HD2      HIS  52   1.230  -7.288   8.845
    7    HE1  HIS  52           HE1      HIS  52   2.633 -10.716  10.869
    8    HE2  HIS  52           HE2      HIS  52   3.139  -9.060   9.012

  No H/Q in entry =           8
  In of MODEL    3
    1    H    LEU  53           H        LEU  53  -3.128  -9.363  12.344
    2    HA   LEU  53           HA       LEU  53  -1.909 -11.897  12.549
    3    HB2  LEU  53           HB2      LEU  53  -4.405 -10.731  13.755
    4    HB3  LEU  53           HB3      LEU  53  -3.935 -12.402  14.052
    5    HG   LEU  53           HG       LEU  53  -2.055 -10.066  14.526
    6   HD11  LEU  53          HD11      LEU  53  -4.128  -9.898  15.925
    7   HD13  LEU  53          HD12      LEU  53  -2.666 -10.169  16.874
    8   HD12  LEU  53          HD13      LEU  53  -3.777 -11.500  16.566
    9   HD23  LEU  53          HD21      LEU  53  -1.150 -11.864  16.207
   10   HD22  LEU  53          HD22      LEU  53  -0.759 -12.032  14.498
   11   HD21  LEU  53          HD23      LEU  53  -2.027 -13.015  15.204

  No H/Q in entry =          11
  In of MODEL    3
    1    H    VAL  54           H        VAL  54  -5.026 -10.897  11.178
    2    HA   VAL  54           HA       VAL  54  -5.918 -13.501  10.498
    3    HB   VAL  54           HB       VAL  54  -6.585 -10.777   9.353
    4   HG12  VAL  54          HG11      VAL  54  -8.674 -12.174   8.542
    5   HG11  VAL  54          HG12      VAL  54  -7.552 -13.531   8.621
    6   HG13  VAL  54          HG13      VAL  54  -7.201 -12.157   7.575
    7   HG22  VAL  54          HG21      VAL  54  -7.495 -10.815  11.503
    8   HG21  VAL  54          HG22      VAL  54  -7.736 -12.560  11.489
    9   HG23  VAL  54          HG23      VAL  54  -8.823 -11.515  10.577

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLN  55           H        GLN  55  -4.063 -11.041   8.704
    2    HA   GLN  55           HA       GLN  55  -3.917 -12.513   6.291
    3    HB2  GLN  55           HB2      GLN  55  -3.330 -10.245   6.095
    4    HB3  GLN  55           HB3      GLN  55  -2.221 -10.308   7.462
    5    HG2  GLN  55           HG2      GLN  55  -0.495 -11.145   6.192
    6    HG3  GLN  55           HG3      GLN  55  -1.560 -12.132   5.199
    7   HE21  GLN  55          HE21      GLN  55  -1.578 -11.449   3.075
    8   HE22  GLN  55          HE22      GLN  55  -1.391  -9.845   2.560

  No H/Q in entry =           8
  In of MODEL    3
    1    H    THR  56           H        THR  56  -1.816 -12.466   9.176
    2    HA   THR  56           HA       THR  56   0.275 -14.053   8.268
    3    HB   THR  56           HB       THR  56  -0.968 -14.308  11.014
    4    HG1  THR  56           HG1      THR  56   0.149 -12.184   9.761
    5   HG22  THR  56          HG21      THR  56   1.460 -14.630  11.630
    6   HG21  THR  56          HG22      THR  56   1.821 -14.691   9.904
    7   HG23  THR  56          HG23      THR  56   0.782 -15.916  10.633

  No H/Q in entry =           7
  In of MODEL    3
    1    H    LYS  57           H        LYS  57  -2.840 -15.107   9.629
    2    HA   LYS  57           HA       LYS  57  -2.373 -17.901   9.394
    3    HB2  LYS  57           HB2      LYS  57  -4.201 -16.824  10.734
    4    HB3  LYS  57           HB3      LYS  57  -4.992 -16.376   9.230
    5    HG2  LYS  57           HG2      LYS  57  -5.228 -18.735   8.615
    6    HG3  LYS  57           HG3      LYS  57  -4.382 -19.220  10.082
    7    HD2  LYS  57           HD2      LYS  57  -6.172 -18.195  11.451
    8    HD3  LYS  57           HD3      LYS  57  -7.028 -17.731   9.981
    9    HE2  LYS  57           HE2      LYS  57  -7.206 -20.120   9.338
   10    HE3  LYS  57           HE3      LYS  57  -6.369 -20.588  10.815
   11    HZ2  LYS  57           HZ1      LYS  57  -9.096 -19.997  10.444
   12    HZ1  LYS  57           HZ2      LYS  57  -8.436 -18.889  11.551
   13    HZ3  LYS  57           HZ3      LYS  57  -8.308 -20.560  11.839

  No H/Q in entry =          13
  In of MODEL    3
    1    H    LEU  58           H        LEU  58  -3.718 -15.475   7.207
    2    HA   LEU  58           HA       LEU  58  -4.504 -17.313   5.205
    3    HB2  LEU  58           HB2      LEU  58  -3.918 -14.361   5.061
    4    HB3  LEU  58           HB3      LEU  58  -4.572 -15.307   3.723
    5    HG   LEU  58           HG       LEU  58  -5.858 -15.127   6.468
    6   HD11  LEU  58          HD11      LEU  58  -6.165 -13.491   3.970
    7   HD13  LEU  58          HD12      LEU  58  -6.162 -12.977   5.657
    8   HD12  LEU  58          HD13      LEU  58  -7.578 -13.782   4.985
    9   HD22  LEU  58          HD21      LEU  58  -6.806 -17.046   5.603
   10   HD21  LEU  58          HD22      LEU  58  -6.466 -16.597   3.931
   11   HD23  LEU  58          HD23      LEU  58  -7.836 -15.878   4.777

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  59           H        ILE  59  -1.378 -16.077   6.068
    2    HA   ILE  59           HA       ILE  59  -0.270 -16.806   3.436
    3    HB   ILE  59           HB       ILE  59   0.481 -14.731   5.004
    4   HG12  ILE  59          HG12      ILE  59   2.575 -16.372   3.563
    5   HG13  ILE  59          HG13      ILE  59   1.379 -15.424   2.717
    6   HG22  ILE  59          HG21      ILE  59   2.589 -16.756   5.699
    7   HG21  ILE  59          HG22      ILE  59   1.228 -16.507   6.770
    8   HG23  ILE  59          HG23      ILE  59   2.324 -15.177   6.401
    9   HD13  ILE  59          HD11      ILE  59   3.300 -14.020   2.916
   10   HD12  ILE  59          HD12      ILE  59   3.490 -14.427   4.620
   11   HD11  ILE  59          HD13      ILE  59   2.136 -13.425   4.098

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLU  60           H        GLU  60  -0.280 -17.900   6.808
    2    HA   GLU  60           HA       GLU  60   1.765 -19.865   6.555
    3    HB2  GLU  60           HB2      GLU  60   0.979 -19.069   8.738
    4    HB3  GLU  60           HB3      GLU  60  -0.611 -19.767   8.434
    5    HG2  GLU  60           HG2      GLU  60   0.402 -22.019   8.305
    6    HG3  GLU  60           HG3      GLU  60   1.990 -21.319   8.614

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLY  61           H        GLY  61  -1.744 -19.989   6.062
    2    HA3  GLY  61           HA2      GLY  61  -1.475 -22.784   5.114
    3    HA2  GLY  61           HA3      GLY  61  -2.966 -22.056   5.702

  No H/Q in entry =           3
  In of MODEL    3
    1    H    ASP  62           H        ASP  62  -0.744 -20.469   3.498
    2    HA   ASP  62           HA       ASP  62  -2.845 -19.983   1.603
    3    HB2  ASP  62           HB2      ASP  62  -1.009 -18.852   0.331
    4    HB3  ASP  62           HB3      ASP  62  -1.186 -18.277   1.986

  No H/Q in entry =           4
  In of MODEL    3
    1    H    ALA  63           H        ALA  63  -0.988 -22.712   2.088
    2    HA   ALA  63           HA       ALA  63  -0.163 -23.463  -0.514
    3    HB2  ALA  63           HB1      ALA  63   0.413 -24.603   1.674
    4    HB3  ALA  63           HB2      ALA  63   0.025 -25.663   0.319
    5    HB1  ALA  63           HB3      ALA  63  -1.172 -25.375   1.583

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLY  64           H        GLY  64  -3.222 -23.833   1.224
    2    HA3  GLY  64           HA2      GLY  64  -5.326 -24.453   0.554
    3    HA2  GLY  64           HA3      GLY  64  -4.913 -23.693  -0.973

  No H/Q in entry =           3
  In of MODEL    3
    1    H    GLU  65           H        GLU  65  -5.474 -25.053  -2.585
    2    HA   GLU  65           HA       GLU  65  -5.903 -27.775  -2.351
    3    HB2  GLU  65           HB2      GLU  65  -5.146 -26.150  -4.776
    4    HB3  GLU  65           HB3      GLU  65  -5.655 -27.837  -4.851
    5    HG2  GLU  65           HG2      GLU  65  -7.786 -27.273  -3.787
    6    HG3  GLU  65           HG3      GLU  65  -7.280 -25.594  -3.620

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLY  66           H        GLY  66  -4.650 -29.115  -4.268
    2    HA3  GLY  66           HA2      GLY  66  -2.328 -30.129  -3.052
    3    HA2  GLY  66           HA3      GLY  66  -2.914 -30.534  -4.653

  No H/Q in entry =           3
  In of MODEL    3
    1    H    LYS  67           H        LYS  67  -2.749 -27.817  -5.640
    2    HA   LYS  67           HA       LYS  67  -0.127 -27.885  -6.669
    3    HB2  LYS  67           HB2      LYS  67  -2.297 -25.798  -6.812
    4    HB3  LYS  67           HB3      LYS  67  -0.785 -25.707  -7.724
    5    HG2  LYS  67           HG2      LYS  67  -1.242 -27.852  -8.786
    6    HG3  LYS  67           HG3      LYS  67  -2.692 -28.064  -7.808
    7    HD2  LYS  67           HD2      LYS  67  -3.487 -27.280  -9.900
    8    HD3  LYS  67           HD3      LYS  67  -3.506 -25.856  -8.857
    9    HE2  LYS  67           HE2      LYS  67  -1.433 -25.052  -9.781
   10    HE3  LYS  67           HE3      LYS  67  -1.170 -26.564 -10.649
   11    HZ3  LYS  67           HZ1      LYS  67  -2.015 -24.878 -12.130
   12    HZ2  LYS  67           HZ2      LYS  67  -3.367 -24.626 -11.134
   13    HZ1  LYS  67           HZ3      LYS  67  -3.170 -26.106 -11.945

  No H/Q in entry =          13
  In of MODEL    3
    1    H    MET  68           H        MET  68   1.588 -26.542  -6.513
    2    HA   MET  68           HA       MET  68   2.395 -25.737  -3.950
    3    HB2  MET  68           HB2      MET  68   3.532 -25.051  -6.662
    4    HB3  MET  68           HB3      MET  68   4.356 -24.786  -5.125
    5    HG2  MET  68           HG2      MET  68   3.370 -27.476  -6.118
    6    HG3  MET  68           HG3      MET  68   5.044 -26.922  -6.204
    7    HE1  MET  68           HE1      MET  68   6.293 -26.055  -4.497
    8    HE3  MET  68           HE2      MET  68   6.468 -26.812  -2.916
    9    HE2  MET  68           HE3      MET  68   5.419 -25.410  -3.102

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LYS  69           H        LYS  69   1.179 -23.790  -6.667
    2    HA   LYS  69           HA       LYS  69   1.830 -21.267  -5.886
    3    HB2  LYS  69           HB2      LYS  69  -0.696 -22.206  -7.207
    4    HB3  LYS  69           HB3      LYS  69  -0.274 -20.500  -7.014
    5    HG2  LYS  69           HG2      LYS  69   1.858 -20.883  -8.183
    6    HG3  LYS  69           HG3      LYS  69   1.451 -22.589  -8.376
    7    HD2  LYS  69           HD2      LYS  69  -0.525 -21.977  -9.711
    8    HD3  LYS  69           HD3      LYS  69  -0.137 -20.267  -9.507
    9    HE2  LYS  69           HE2      LYS  69   2.023 -20.613 -10.643
   10    HE3  LYS  69           HE3      LYS  69   1.647 -22.324 -10.841
   11    HZ2  LYS  69           HZ1      LYS  69   0.769 -20.090 -12.381
   12    HZ1  LYS  69           HZ2      LYS  69  -0.541 -21.020 -11.827
   13    HZ3  LYS  69           HZ3      LYS  69   0.693 -21.744 -12.743

  No H/Q in entry =          13
  In of MODEL    3
    1    H    VAL  70           H        VAL  70   0.052 -19.513  -5.299
    2    HA   VAL  70           HA       VAL  70  -1.289 -20.316  -2.781
    3    HB   VAL  70           HB       VAL  70  -0.571 -18.150  -1.808
    4   HG11  VAL  70          HG11      VAL  70   1.576 -20.021  -2.822
    5   HG13  VAL  70          HG12      VAL  70   0.797 -20.023  -1.239
    6   HG12  VAL  70          HG13      VAL  70   1.911 -18.726  -1.671
    7   HG23  VAL  70          HG21      VAL  70   1.402 -17.015  -3.083
    8   HG22  VAL  70          HG22      VAL  70  -0.235 -16.710  -3.659
    9   HG21  VAL  70          HG23      VAL  70   0.788 -17.871  -4.499

  No H/Q in entry =           9
  In of MODEL    3
    1    H    SER  71           H        SER  71  -2.877 -18.639  -2.081
    2    HA   SER  71           HA       SER  71  -4.785 -18.081  -4.092
    3    HB2  SER  71           HB2      SER  71  -5.287 -18.294  -1.627
    4    HB3  SER  71           HB3      SER  71  -4.519 -16.729  -1.382
    5    HG   SER  71           HG       SER  71  -7.002 -17.203  -2.075

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU  72           H        LEU  72  -5.027 -16.416  -5.421
    2    HA   LEU  72           HA       LEU  72  -2.932 -14.589  -5.906
    3    HB2  LEU  72           HB2      LEU  72  -5.795 -14.670  -6.854
    4    HB3  LEU  72           HB3      LEU  72  -4.608 -13.503  -7.432
    5    HG   LEU  72           HG       LEU  72  -4.188 -16.507  -7.560
    6   HD13  LEU  72          HD11      LEU  72  -6.085 -15.972  -8.966
    7   HD12  LEU  72          HD12      LEU  72  -4.683 -16.194 -10.012
    8   HD11  LEU  72          HD13      LEU  72  -5.251 -14.569  -9.633
    9   HD21  LEU  72          HD21      LEU  72  -2.714 -14.084  -8.575
   10   HD23  LEU  72          HD22      LEU  72  -2.598 -15.589  -9.471
   11   HD22  LEU  72          HD23      LEU  72  -2.064 -15.523  -7.794

  No H/Q in entry =          11
  In of MODEL    3
    1    H    VAL  73           H        VAL  73  -6.030 -14.251  -4.280
    2    HA   VAL  73           HA       VAL  73  -6.097 -11.480  -3.938
    3    HB   VAL  73           HB       VAL  73  -7.795 -11.855  -2.319
    4   HG11  VAL  73          HG11      VAL  73  -8.240 -12.558  -4.701
    5   HG13  VAL  73          HG12      VAL  73  -9.255 -13.362  -3.507
    6   HG12  VAL  73          HG13      VAL  73  -7.884 -14.216  -4.215
    7   HG21  VAL  73          HG21      VAL  73  -6.372 -14.478  -1.970
    8   HG23  VAL  73          HG22      VAL  73  -8.092 -14.373  -1.595
    9   HG22  VAL  73          HG23      VAL  73  -6.940 -13.348  -0.740

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LEU  74           H        LEU  74  -4.142 -13.828  -2.345
    2    HA   LEU  74           HA       LEU  74  -3.742 -12.676   0.175
    3    HB2  LEU  74           HB2      LEU  74  -2.941 -14.890  -0.319
    4    HB3  LEU  74           HB3      LEU  74  -1.890 -14.273  -1.592
    5    HG   LEU  74           HG       LEU  74  -0.593 -13.009   0.089
    6   HD12  LEU  74          HD11      LEU  74  -1.082 -13.707   2.531
    7   HD11  LEU  74          HD12      LEU  74  -2.670 -14.196   1.935
    8   HD13  LEU  74          HD13      LEU  74  -2.158 -12.513   1.804
    9   HD23  LEU  74          HD21      LEU  74  -0.783 -15.749   1.220
   10   HD22  LEU  74          HD22      LEU  74   0.612 -14.830   0.699
   11   HD21  LEU  74          HD23      LEU  74  -0.409 -15.597  -0.496

  No H/Q in entry =          11
  In of MODEL    3
    1    H    VAL  75           H        VAL  75  -1.852 -12.276  -2.782
    2    HA   VAL  75           HA       VAL  75  -0.071 -10.335  -1.776
    3    HB   VAL  75           HB       VAL  75  -1.021 -10.820  -4.601
    4   HG12  VAL  75          HG11      VAL  75   1.058  -9.524  -5.207
    5   HG11  VAL  75          HG12      VAL  75   1.246  -9.117  -3.508
    6   HG13  VAL  75          HG13      VAL  75  -0.153  -8.535  -4.397
    7   HG21  VAL  75          HG21      VAL  75   0.277 -12.599  -3.209
    8   HG23  VAL  75          HG22      VAL  75   1.649 -11.503  -3.366
    9   HG22  VAL  75          HG23      VAL  75   0.900 -12.190  -4.808

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLU  76           H        GLU  76  -3.223 -10.017  -3.437
    2    HA   GLU  76           HA       GLU  76  -3.297  -7.204  -3.546
    3    HB2  GLU  76           HB2      GLU  76  -4.945  -8.644  -4.711
    4    HB3  GLU  76           HB3      GLU  76  -5.587  -9.168  -3.161
    5    HG2  GLU  76           HG2      GLU  76  -7.066  -7.467  -4.022
    6    HG3  GLU  76           HG3      GLU  76  -6.195  -6.757  -2.676

  No H/Q in entry =           6
  In of MODEL    3
    1    H    ALA  77           H        ALA  77  -4.392  -9.433  -1.001
    2    HA   ALA  77           HA       ALA  77  -5.365  -7.434   0.751
    3    HB2  ALA  77           HB1      ALA  77  -5.054  -9.206   2.519
    4    HB1  ALA  77           HB2      ALA  77  -4.324 -10.225   1.279
    5    HB3  ALA  77           HB3      ALA  77  -6.005  -9.718   1.125

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLN  78           H        GLN  78  -2.206  -8.960   0.393
    2    HA   GLN  78           HA       GLN  78  -0.959  -7.784   2.641
    3    HB2  GLN  78           HB2      GLN  78  -0.099  -9.724   1.254
    4    HB3  GLN  78           HB3      GLN  78   0.375  -8.546   0.032
    5    HG2  GLN  78           HG2      GLN  78   1.830  -7.421   1.638
    6    HG3  GLN  78           HG3      GLN  78   1.312  -8.521   2.913
    7   HE21  GLN  78          HE21      GLN  78   1.309 -10.952   1.300
    8   HE22  GLN  78          HE22      GLN  78   2.928 -11.309   0.932

  No H/Q in entry =           8
  In of MODEL    3
    1    H    LEU  79           H        LEU  79  -1.331  -6.735  -0.709
    2    HA   LEU  79           HA       LEU  79   0.339  -4.496  -0.700
    3    HB2  LEU  79           HB2      LEU  79  -0.680  -5.316  -2.753
    4    HB3  LEU  79           HB3      LEU  79  -2.287  -4.934  -2.146
    5    HG   LEU  79           HG       LEU  79  -1.760  -2.543  -2.127
    6   HD13  LEU  79          HD11      LEU  79   0.478  -2.282  -1.614
    7   HD12  LEU  79          HD12      LEU  79   0.527  -1.999  -3.353
    8   HD11  LEU  79          HD13      LEU  79   0.992  -3.572  -2.702
    9   HD23  LEU  79          HD21      LEU  79  -1.125  -2.346  -4.679
   10   HD22  LEU  79          HD22      LEU  79  -2.646  -3.104  -4.219
   11   HD21  LEU  79          HD23      LEU  79  -1.266  -4.104  -4.660

  No H/Q in entry =          11
  In of MODEL    3
    1    H    HIS  80           H        HIS  80  -3.127  -4.680   0.124
    2    HA   HIS  80           HA       HIS  80  -3.337  -1.923   0.779
    3    HB2  HIS  80           HB2      HIS  80  -5.023  -4.342   1.104
    4    HB3  HIS  80           HB3      HIS  80  -5.353  -3.001   2.204
    5    HD1  HIS  80           HD1      HIS  80  -6.981  -1.378   1.290
    6    HD2  HIS  80           HD2      HIS  80  -4.774  -3.184  -1.751
    7    HE1  HIS  80           HE1      HIS  80  -7.826  -0.393  -0.892
    8    HE2  HIS  80           HE2      HIS  80  -6.487  -1.488  -2.755

  No H/Q in entry =           8
  In of MODEL    3
    1    H    LEU  81           H        LEU  81  -2.831  -4.809   2.781
    2    HA   LEU  81           HA       LEU  81  -2.829  -3.455   5.261
    3    HB2  LEU  81           HB2      LEU  81  -1.593  -6.066   4.390
    4    HB3  LEU  81           HB3      LEU  81  -1.572  -5.502   6.062
    5    HG   LEU  81           HG       LEU  81  -4.114  -5.775   4.433
    6   HD12  LEU  81          HD11      LEU  81  -4.405  -7.838   5.986
    7   HD11  LEU  81          HD12      LEU  81  -2.654  -7.756   6.173
    8   HD13  LEU  81          HD13      LEU  81  -3.360  -7.995   4.574
    9   HD23  LEU  81          HD21      LEU  81  -4.958  -5.977   6.934
   10   HD22  LEU  81          HD22      LEU  81  -4.643  -4.388   6.240
   11   HD21  LEU  81          HD23      LEU  81  -3.452  -5.138   7.303

  No H/Q in entry =          11
  In of MODEL    3
    1    H    MET  82           H        MET  82  -0.141  -4.347   3.095
    2    HA   MET  82           HA       MET  82   1.936  -3.436   4.778
    3    HB2  MET  82           HB2      MET  82   1.725  -3.787   1.786
    4    HB3  MET  82           HB3      MET  82   3.203  -3.205   2.549
    5    HG2  MET  82           HG2      MET  82   1.811  -5.801   3.280
    6    HG3  MET  82           HG3      MET  82   3.183  -5.686   2.180
    7    HE3  MET  82           HE1      MET  82   6.192  -4.926   4.164
    8    HE2  MET  82           HE2      MET  82   5.262  -3.566   3.541
    9    HE1  MET  82           HE3      MET  82   5.360  -5.058   2.610

  No H/Q in entry =           9
  In of MODEL    3
    1    H    THR  83           H        THR  83   0.106  -1.812   2.215
    2    HA   THR  83           HA       THR  83   1.503   0.645   2.295
    3    HB   THR  83           HB       THR  83  -0.678   1.554   1.305
    4    HG1  THR  83           HG1      THR  83  -2.321   0.247   1.201
    5   HG22  THR  83          HG21      THR  83  -0.396  -0.268  -0.690
    6   HG21  THR  83          HG22      THR  83   1.106  -0.549   0.189
    7   HG23  THR  83          HG23      THR  83   0.736   1.060  -0.431

  No H/Q in entry =           7
  In of MODEL    3
    1    H    SER  84           H        SER  84  -1.498  -0.400   3.898
    2    HA   SER  84           HA       SER  84  -2.009   2.031   5.235
    3    HB2  SER  84           HB2      SER  84  -2.826  -0.810   5.807
    4    HB3  SER  84           HB3      SER  84  -3.327   0.531   6.836
    5    HG   SER  84           HG       SER  84  -3.783   0.207   4.044

  No H/Q in entry =           5
  In of MODEL    3
    1    H    MET  85           H        MET  85  -0.283  -0.888   6.374
    2    HA   MET  85           HA       MET  85   0.230   0.049   8.976
    3    HB2  MET  85           HB2      MET  85   0.535  -2.294   8.312
    4    HB3  MET  85           HB3      MET  85   1.909  -1.830   7.307
    5    HG2  MET  85           HG2      MET  85   3.079  -0.963   9.305
    6    HG3  MET  85           HG3      MET  85   1.705  -1.427  10.308
    7    HE2  MET  85           HE1      MET  85   5.010  -4.000   8.561
    8    HE1  MET  85           HE2      MET  85   4.873  -2.247   8.675
    9    HE3  MET  85           HE3      MET  85   3.987  -3.114   7.425

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LEU  86           H        LEU  86   2.165   0.306   6.025
    2    HA   LEU  86           HA       LEU  86   4.371   1.632   7.178
    3    HB2  LEU  86           HB2      LEU  86   4.187   0.542   4.872
    4    HB3  LEU  86           HB3      LEU  86   3.371   2.017   4.355
    5    HG   LEU  86           HG       LEU  86   5.393   3.277   5.333
    6   HD11  LEU  86          HD11      LEU  86   6.111   0.672   6.141
    7   HD13  LEU  86          HD12      LEU  86   7.107   2.122   6.234
    8   HD12  LEU  86          HD13      LEU  86   7.222   1.070   4.826
    9   HD23  LEU  86          HD21      LEU  86   6.120   1.511   2.988
   10   HD22  LEU  86          HD22      LEU  86   6.504   3.211   3.245
   11   HD21  LEU  86          HD23      LEU  86   4.854   2.733   2.847

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ALA  87           H        ALA  87   1.453   2.856   5.588
    2    HA   ALA  87           HA       ALA  87   2.034   5.589   5.664
    3    HB1  ALA  87           HB1      ALA  87  -0.267   3.947   5.126
    4    HB3  ALA  87           HB2      ALA  87   0.036   5.608   4.621
    5    HB2  ALA  87           HB3      ALA  87  -0.757   5.287   6.165

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ARG  88           H        ARG  88   0.353   3.586   8.059
    2    HA   ARG  88           HA       ARG  88  -0.170   5.639   9.899
    3    HB2  ARG  88           HB2      ARG  88  -1.097   3.281   9.972
    4    HB3  ARG  88           HB3      ARG  88   0.446   2.792  10.681
    5    HG2  ARG  88           HG2      ARG  88  -0.042   4.869  12.294
    6    HG3  ARG  88           HG3      ARG  88  -1.707   4.534  11.838
    7    HD2  ARG  88           HD2      ARG  88  -1.805   2.688  13.090
    8    HD3  ARG  88           HD3      ARG  88  -0.212   2.112  12.562
    9    HE   ARG  88           HE       ARG  88  -0.754   3.381  15.012
   10   HH21  ARG  88          HH11      ARG  88   0.798   4.405  16.248
   11   HH22  ARG  88          HH12      ARG  88   2.316   4.837  15.543
   12   HH11  ARG  88          HH21      ARG  88   1.527   3.566  12.435
   13   HH12  ARG  88          HH22      ARG  88   2.737   4.346  13.396

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLU  89           H        GLU  89   2.638   3.434   9.685
    2    HA   GLU  89           HA       GLU  89   3.893   4.337  12.026
    3    HB2  GLU  89           HB2      GLU  89   4.564   2.318  10.689
    4    HB3  GLU  89           HB3      GLU  89   5.334   3.413   9.540
    5    HG2  GLU  89           HG2      GLU  89   6.814   4.273  11.281
    6    HG3  GLU  89           HG3      GLU  89   5.983   3.316  12.504

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LEU  90           H        LEU  90   4.206   5.486   8.695
    2    HA   LEU  90           HA       LEU  90   6.124   7.499   9.275
    3    HB2  LEU  90           HB2      LEU  90   4.122   7.149   7.047
    4    HB3  LEU  90           HB3      LEU  90   5.345   8.426   7.065
    5    HG   LEU  90           HG       LEU  90   6.035   5.495   7.409
    6   HD12  LEU  90          HD11      LEU  90   6.784   5.725   4.969
    7   HD11  LEU  90          HD12      LEU  90   5.760   7.159   4.915
    8   HD13  LEU  90          HD13      LEU  90   5.049   5.583   5.263
    9   HD22  LEU  90          HD21      LEU  90   7.925   6.658   8.088
   10   HD21  LEU  90          HD22      LEU  90   7.568   8.057   7.076
   11   HD23  LEU  90          HD23      LEU  90   8.236   6.594   6.355

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  91           H        ILE  91   2.585   7.493   9.124
    2    HA   ILE  91           HA       ILE  91   2.226  10.265   9.565
    3    HB   ILE  91           HB       ILE  91   0.449   7.880  10.114
    4   HG12  ILE  91          HG12      ILE  91   0.188  10.153   8.122
    5   HG13  ILE  91          HG13      ILE  91   1.058   8.663   7.755
    6   HG22  ILE  91          HG21      ILE  91  -1.296   9.927  10.170
    7   HG21  ILE  91          HG22      ILE  91   0.100  10.769  10.841
    8   HG23  ILE  91          HG23      ILE  91  -0.528   9.330  11.642
    9   HD13  ILE  91          HD11      ILE  91  -0.879   7.363   7.803
   10   HD12  ILE  91          HD12      ILE  91  -1.477   8.872   7.116
   11   HD11  ILE  91          HD13      ILE  91  -1.747   8.512   8.821

  No H/Q in entry =          11
  In of MODEL    3
    1    H    THR  92           H        THR  92   2.645   7.533  11.776
    2    HA   THR  92           HA       THR  92   2.191   8.912  14.195
    3    HB   THR  92           HB       THR  92   4.015   6.587  13.539
    4    HG1  THR  92           HG1      THR  92   2.052   5.817  13.440
    5   HG22  THR  92          HG21      THR  92   3.632   6.309  16.174
    6   HG21  THR  92          HG22      THR  92   3.556   8.068  16.094
    7   HG23  THR  92          HG23      THR  92   4.995   7.220  15.525

  No H/Q in entry =           7
  In of MODEL    3
    1    H    GLU  93           H        GLU  93   5.147   8.477  12.265
    2    HA   GLU  93           HA       GLU  93   6.889   9.922  13.958
    3    HB2  GLU  93           HB2      GLU  93   6.982   9.597  10.944
    4    HB3  GLU  93           HB3      GLU  93   8.318  10.140  11.958
    5    HG2  GLU  93           HG2      GLU  93   6.927   7.495  12.414
    6    HG3  GLU  93           HG3      GLU  93   8.310   7.653  11.338

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LEU  94           H        LEU  94   4.836  10.912  11.240
    2    HA   LEU  94           HA       LEU  94   5.621  13.622  11.131
    3    HB2  LEU  94           HB2      LEU  94   3.041  12.235  10.380
    4    HB3  LEU  94           HB3      LEU  94   3.287  13.963  10.132
    5    HG   LEU  94           HG       LEU  94   5.320  11.987   9.091
    6   HD11  LEU  94          HD11      LEU  94   2.575  12.513   8.024
    7   HD13  LEU  94          HD12      LEU  94   3.569  11.064   7.905
    8   HD12  LEU  94          HD13      LEU  94   3.895  12.443   6.856
    9   HD23  LEU  94          HD21      LEU  94   5.558  13.819   7.362
   10   HD22  LEU  94          HD22      LEU  94   5.968  14.320   9.003
   11   HD21  LEU  94          HD23      LEU  94   4.414  14.774   8.301

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  95           H        ILE  95   3.094  11.992  13.026
    2    HA   ILE  95           HA       ILE  95   2.032  14.338  14.211
    3    HB   ILE  95           HB       ILE  95   2.070  11.460  15.146
    4   HG12  ILE  95          HG12      ILE  95  -0.163  13.212  14.088
    5   HG13  ILE  95          HG13      ILE  95   0.803  12.157  13.061
    6   HG21  ILE  95          HG21      ILE  95   0.767  13.927  16.338
    7   HG23  ILE  95          HG22      ILE  95   1.824  12.769  17.147
    8   HG22  ILE  95          HG23      ILE  95   0.193  12.294  16.673
    9   HD13  ILE  95          HD11      ILE  95  -0.086  10.215  13.987
   10   HD12  ILE  95          HD12      ILE  95  -1.477  11.293  14.057
   11   HD11  ILE  95          HD13      ILE  95  -0.511  11.008  15.504

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLU  96           H        GLU  96   4.643  12.144  15.217
    2    HA   GLU  96           HA       GLU  96   5.186  13.356  17.705
    3    HB2  GLU  96           HB2      GLU  96   6.153  11.203  17.067
    4    HB3  GLU  96           HB3      GLU  96   7.081  11.979  15.785
    5    HG2  GLU  96           HG2      GLU  96   8.723  12.547  17.247
    6    HG3  GLU  96           HG3      GLU  96   7.568  13.354  18.298

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LEU  97           H        LEU  97   6.258  14.125  14.418
    2    HA   LEU  97           HA       LEU  97   8.126  16.140  15.124
    3    HB2  LEU  97           HB2      LEU  97   6.542  15.568  12.630
    4    HB3  LEU  97           HB3      LEU  97   7.549  17.009  12.747
    5    HG   LEU  97           HG       LEU  97   8.601  14.222  13.318
    6   HD12  LEU  97          HD11      LEU  97   9.599  14.416  11.002
    7   HD11  LEU  97          HD12      LEU  97   8.536  15.797  10.732
    8   HD13  LEU  97          HD13      LEU  97   7.850  14.200  11.032
    9   HD23  LEU  97          HD21      LEU  97  10.760  15.517  12.573
   10   HD22  LEU  97          HD22      LEU  97  10.137  15.787  14.201
   11   HD21  LEU  97          HD23      LEU  97   9.814  16.963  12.928

  No H/Q in entry =          11
  In of MODEL    3
    1    H    HIS  98           H        HIS  98   4.634  16.242  14.466
    2    HA   HIS  98           HA       HIS  98   4.310  19.040  14.590
    3    HB2  HIS  98           HB2      HIS  98   2.439  16.775  15.322
    4    HB3  HIS  98           HB3      HIS  98   1.957  18.472  15.371
    5    HD1  HIS  98           HD1      HIS  98   3.005  15.757  12.978
    6    HD2  HIS  98           HD2      HIS  98   1.594  19.677  12.839
    7    HE1  HIS  98           HE1      HIS  98   2.444  16.232  10.551
    8    HE2  HIS  98           HE2      HIS  98   1.589  18.613  10.446

  No H/Q in entry =           8
  In of MODEL    3
    1    H    GLU  99           H        GLU  99   4.462  16.562  17.099
    2    HA   GLU  99           HA       GLU  99   3.837  18.259  19.289
    3    HB2  GLU  99           HB2      GLU  99   3.770  15.776  19.396
    4    HB3  GLU  99           HB3      GLU  99   5.530  15.747  19.289
    5    HG2  GLU  99           HG2      GLU  99   5.705  17.048  21.359
    6    HG3  GLU  99           HG3      GLU  99   3.951  17.174  21.452

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LYS 100           H        LYS 100   6.900  17.350  17.731
    2    HA   LYS 100           HA       LYS 100   8.541  18.772  19.585
    3    HB2  LYS 100           HB2      LYS 100   9.051  17.842  16.750
    4    HB3  LYS 100           HB3      LYS 100  10.273  18.626  17.757
    5    HG2  LYS 100           HG2      LYS 100   9.910  16.879  19.504
    6    HG3  LYS 100           HG3      LYS 100   8.787  16.061  18.414
    7    HD2  LYS 100           HD2      LYS 100  10.585  15.788  16.750
    8    HD3  LYS 100           HD3      LYS 100  11.713  16.618  17.825
    9    HE2  LYS 100           HE2      LYS 100  11.331  14.865  19.549
   10    HE3  LYS 100           HE3      LYS 100  10.265  14.016  18.425
   11    HZ1  LYS 100           HZ1      LYS 100  13.080  14.708  17.771
   12    HZ3  LYS 100           HZ2      LYS 100  12.047  13.641  16.945
   13    HZ2  LYS 100           HZ3      LYS 100  12.637  13.233  18.486

  No H/Q in entry =          13
  In of MODEL    3
    1    H    LEU 101           H        LEU 101   6.842  19.673  16.624
    2    HA   LEU 101           HA       LEU 101   8.033  22.239  16.281
    3    HB2  LEU 101           HB2      LEU 101   5.450  20.980  15.396
    4    HB3  LEU 101           HB3      LEU 101   5.686  22.712  15.183
    5    HG   LEU 101           HG       LEU 101   7.741  20.710  14.226
    6   HD12  LEU 101          HD11      LEU 101   6.586  21.198  11.938
    7   HD11  LEU 101          HD12      LEU 101   5.182  21.619  12.916
    8   HD13  LEU 101          HD13      LEU 101   5.860  19.995  13.004
    9   HD21  LEU 101          HD21      LEU 101   7.088  23.615  13.660
   10   HD23  LEU 101          HD22      LEU 101   8.078  22.660  12.557
   11   HD22  LEU 101          HD23      LEU 101   8.616  22.928  14.215

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LYS 102           H        LYS 102   6.504  21.097  18.899
    2    HA   LYS 102           HA       LYS 102   5.860  22.190  20.827
    3    HB2  LYS 102           HB2      LYS 102   7.126  24.188  19.697
    4    HB3  LYS 102           HB3      LYS 102   5.522  24.777  19.317
    5    HG2  LYS 102           HG2      LYS 102   6.899  24.543  21.972
    6    HG3  LYS 102           HG3      LYS 102   5.935  25.861  21.337
    7    HD2  LYS 102           HD2      LYS 102   4.714  23.217  22.224
    8    HD3  LYS 102           HD3      LYS 102   4.949  24.584  23.303
    9    HE2  LYS 102           HE2      LYS 102   2.675  24.156  21.813
   10    HE3  LYS 102           HE3      LYS 102   3.164  25.708  22.490
   11    HZ2  LYS 102           HZ1      LYS 102   2.635  25.803  20.109
   12    HZ1  LYS 102           HZ2      LYS 102   3.906  24.731  19.791
   13    HZ3  LYS 102           HZ3      LYS 102   4.235  26.267  20.429

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ALA 103           H        ALA 103   4.211  23.709  18.052
    2    HA   ALA 103           HA       ALA 103   1.751  24.268  18.933
    3    HB1  ALA 103           HB1      ALA 103   0.863  23.410  16.693
    4    HB2  ALA 103           HB2      ALA 103   2.515  22.886  16.366
    5    HB3  ALA 103           HB3      ALA 103   2.165  24.597  16.626
    6    H1   ALA   1           H3       ALA   1  10.756 -20.245  -6.178
    7    H2   ALA   1           H2       ALA   1   9.795 -20.464  -7.564
    8    H3   ALA   1           H1       ALA   1   9.362 -21.208  -6.099
    9    HA   ALA   1           HA       ALA   1  10.417 -23.011  -6.831
   10    HB1  ALA   1           HB1      ALA   1  10.511 -22.659  -9.108
   11    HB2  ALA   1           HB2      ALA   1  12.237 -22.494  -8.778
   12    HB3  ALA   1           HB3      ALA   1  11.227 -21.055  -8.934

  No H/Q in entry =          12
  In of MODEL    3
    1    H    GLU   2           H        GLU   2  12.708 -23.944  -6.884
    2    HA   GLU   2           HA       GLU   2  14.087 -23.844  -4.671
    3    HB2  GLU   2           HB2      GLU   2  15.444 -23.711  -7.370
    4    HB3  GLU   2           HB3      GLU   2  16.176 -24.311  -5.882
    5    HG2  GLU   2           HG2      GLU   2  15.175 -26.337  -6.117
    6    HG3  GLU   2           HG3      GLU   2  13.598 -25.604  -6.379

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLU   3           H        GLU   3  15.845 -21.974  -7.078
    2    HA   GLU   3           HA       GLU   3  16.984 -20.271  -5.123
    3    HB2  GLU   3           HB2      GLU   3  16.930 -20.280  -8.133
    4    HB3  GLU   3           HB3      GLU   3  17.665 -18.942  -7.250
    5    HG2  GLU   3           HG2      GLU   3  19.338 -20.300  -6.321
    6    HG3  GLU   3           HG3      GLU   3  18.403 -21.775  -6.538

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LEU   4           H        LEU   4  14.698 -19.450  -7.758
    2    HA   LEU   4           HA       LEU   4  14.211 -16.843  -7.156
    3    HB2  LEU   4           HB2      LEU   4  12.051 -18.836  -7.881
    4    HB3  LEU   4           HB3      LEU   4  11.963 -17.089  -8.085
    5    HG   LEU   4           HG       LEU   4  13.943 -18.941  -9.451
    6   HD13  LEU   4          HD11      LEU   4  12.641 -18.809 -11.362
    7   HD12  LEU   4          HD12      LEU   4  11.921 -17.268 -10.900
    8   HD11  LEU   4          HD13      LEU   4  11.378 -18.760 -10.135
    9   HD23  LEU   4          HD21      LEU   4  14.263 -16.698 -10.810
   10   HD22  LEU   4          HD22      LEU   4  15.124 -16.929  -9.289
   11   HD21  LEU   4          HD23      LEU   4  13.663 -15.944  -9.332

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLU   5           H        GLU   5  12.746 -19.632  -5.505
    2    HA   GLU   5           HA       GLU   5  11.056 -18.068  -3.809
    3    HB2  GLU   5           HB2      GLU   5  10.651 -20.453  -4.324
    4    HB3  GLU   5           HB3      GLU   5  12.085 -20.872  -3.385
    5    HG2  GLU   5           HG2      GLU   5  11.103 -19.843  -1.386
    6    HG3  GLU   5           HG3      GLU   5   9.678 -19.378  -2.316

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLU   6           H        GLU   6  14.214 -19.622  -3.359
    2    HA   GLU   6           HA       GLU   6  14.558 -18.754  -0.663
    3    HB2  GLU   6           HB2      GLU   6  16.528 -19.679  -2.765
    4    HB3  GLU   6           HB3      GLU   6  16.971 -19.333  -1.093
    5    HG2  GLU   6           HG2      GLU   6  14.850 -21.332  -1.928
    6    HG3  GLU   6           HG3      GLU   6  16.504 -21.755  -1.487

  No H/Q in entry =           6
  In of MODEL    3
    1    H    VAL   7           H        VAL   7  15.315 -17.432  -3.817
    2    HA   VAL   7           HA       VAL   7  16.984 -15.289  -2.958
    3    HB   VAL   7           HB       VAL   7  15.282 -15.674  -5.435
    4   HG11  VAL   7          HG11      VAL   7  17.157 -13.443  -4.630
    5   HG13  VAL   7          HG12      VAL   7  15.514 -13.316  -5.254
    6   HG12  VAL   7          HG13      VAL   7  16.828 -13.812  -6.322
    7   HG21  VAL   7          HG21      VAL   7  17.401 -17.112  -4.860
    8   HG23  VAL   7          HG22      VAL   7  18.294 -15.645  -5.263
    9   HG22  VAL   7          HG23      VAL   7  17.265 -16.407  -6.472

  No H/Q in entry =           9
  In of MODEL    3
    1    H    VAL   8           H        VAL   8  13.494 -15.589  -3.516
    2    HA   VAL   8           HA       VAL   8  12.806 -12.884  -3.054
    3    HB   VAL   8           HB       VAL   8  11.221 -15.431  -2.628
    4   HG12  VAL   8          HG11      VAL   8   9.266 -13.730  -2.784
    5   HG11  VAL   8          HG12      VAL   8  10.474 -12.518  -2.356
    6   HG13  VAL   8          HG13      VAL   8  10.134 -13.850  -1.253
    7   HG21  VAL   8          HG21      VAL   8  12.071 -14.255  -4.994
    8   HG23  VAL   8          HG22      VAL   8  10.482 -13.530  -4.770
    9   HG22  VAL   8          HG23      VAL   8  10.645 -15.281  -4.847

  No H/Q in entry =           9
  In of MODEL    3
    1    H    MET   9           H        MET   9  13.094 -15.681  -0.865
    2    HA   MET   9           HA       MET   9  12.267 -14.408   1.501
    3    HB2  MET   9           HB2      MET   9  14.198 -16.666   0.972
    4    HB3  MET   9           HB3      MET   9  13.881 -16.084   2.607
    5    HG2  MET   9           HG2      MET   9  11.467 -16.500   2.289
    6    HG3  MET   9           HG3      MET   9  11.788 -17.091   0.657
    7    HE1  MET   9           HE1      MET   9  12.576 -17.113   4.167
    8    HE3  MET   9           HE2      MET   9  13.954 -18.208   4.215
    9    HE2  MET   9           HE3      MET   9  12.363 -18.782   4.708

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLY  10           H        GLY  10  15.451 -14.610  -0.053
    2    HA3  GLY  10           HA2      GLY  10  16.896 -13.170   1.913
    3    HA2  GLY  10           HA3      GLY  10  17.362 -13.337   0.221

  No H/Q in entry =           3
  In of MODEL    3
    1    H    LEU  11           H        LEU  11  15.183 -12.139  -1.024
    2    HA   LEU  11           HA       LEU  11  15.843  -9.388  -0.870
    3    HB2  LEU  11           HB2      LEU  11  13.489 -10.823  -2.102
    4    HB3  LEU  11           HB3      LEU  11  13.754  -9.086  -2.267
    5    HG   LEU  11           HG       LEU  11  15.801 -11.179  -3.046
    6   HD13  LEU  11          HD11      LEU  11  14.060 -11.567  -4.566
    7   HD12  LEU  11          HD12      LEU  11  15.053 -10.379  -5.410
    8   HD11  LEU  11          HD13      LEU  11  13.574  -9.872  -4.594
    9   HD22  LEU  11          HD21      LEU  11  17.014  -9.204  -2.826
   10   HD21  LEU  11          HD22      LEU  11  15.630  -8.181  -3.210
   11   HD23  LEU  11          HD23      LEU  11  16.470  -9.046  -4.495

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  12           H        ILE  12  13.091 -11.235   0.402
    2    HA   ILE  12           HA       ILE  12  11.676  -9.021   1.453
    3    HB   ILE  12           HB       ILE  12  11.739 -11.900   2.412
    4   HG12  ILE  12          HG12      ILE  12  11.048 -11.280  -0.039
    5   HG13  ILE  12          HG13      ILE  12  10.035 -12.379   0.875
    6   HG22  ILE  12          HG21      ILE  12   9.452 -11.334   3.324
    7   HG21  ILE  12          HG22      ILE  12   9.787  -9.640   2.967
    8   HG23  ILE  12          HG23      ILE  12  10.778 -10.508   4.140
    9   HD12  ILE  12          HD11      ILE  12   8.766 -10.611  -0.358
   10   HD11  ILE  12          HD12      ILE  12   9.578  -9.395   0.626
   11   HD13  ILE  12          HD13      ILE  12   8.504 -10.557   1.376

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  13           H        ILE  13  14.089 -11.197   2.868
    2    HA   ILE  13           HA       ILE  13  14.111 -10.009   5.444
    3    HB   ILE  13           HB       ILE  13  16.191 -11.562   3.886
    4   HG12  ILE  13          HG12      ILE  13  13.918 -12.549   4.725
    5   HG13  ILE  13          HG13      ILE  13  15.402 -13.461   4.987
    6   HG22  ILE  13          HG21      ILE  13  17.220 -11.905   6.226
    7   HG21  ILE  13          HG22      ILE  13  16.295 -10.493   6.717
    8   HG23  ILE  13          HG23      ILE  13  17.512 -10.351   5.448
    9   HD11  ILE  13          HD11      ILE  13  14.219 -11.586   7.067
   10   HD13  ILE  13          HD12      ILE  13  15.529 -12.743   7.281
   11   HD12  ILE  13          HD13      ILE  13  13.889 -13.316   7.009

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ASN  14           H        ASN  14  16.061  -9.467   2.525
    2    HA   ASN  14           HA       ASN  14  17.783  -7.503   3.582
    3    HB2  ASN  14           HB2      ASN  14  17.777  -8.778   1.271
    4    HB3  ASN  14           HB3      ASN  14  16.869  -7.372   0.728
    5   HD21  ASN  14          HD21      ASN  14  19.314  -7.689  -0.454
    6   HD22  ASN  14          HD22      ASN  14  20.444  -6.591   0.170

  No H/Q in entry =           6
  In of MODEL    3
    1    H    SER  15           H        SER  15  14.670  -7.197   1.886
    2    HA   SER  15           HA       SER  15  14.526  -4.377   1.932
    3    HB2  SER  15           HB2      SER  15  12.197  -4.652   1.436
    4    HB3  SER  15           HB3      SER  15  13.010  -6.011   0.670
    5    HG   SER  15           HG       SER  15  11.617  -7.123   1.794

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLY  16           H        GLY  16  13.459  -6.842   4.243
    2    HA3  GLY  16           HA2      GLY  16  12.215  -5.101   6.094
    3    HA2  GLY  16           HA3      GLY  16  12.849  -6.701   6.462

  No H/Q in entry =           3
  In of MODEL    3
    1    H    GLN  17           H        GLN  17  15.556  -6.338   5.871
    2    HA   GLN  17           HA       GLN  17  16.496  -5.098   8.248
    3    HB2  GLN  17           HB2      GLN  17  17.758  -6.873   7.087
    4    HB3  GLN  17           HB3      GLN  17  18.028  -5.790   5.723
    5    HG2  GLN  17           HG2      GLN  17  19.297  -4.260   7.118
    6    HG3  GLN  17           HG3      GLN  17  18.920  -5.203   8.558
    7   HE21  GLN  17          HE21      GLN  17  21.631  -4.744   7.804
    8   HE22  GLN  17          HE22      GLN  17  22.310  -6.217   7.308

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ALA  18           H        ALA  18  16.298  -4.034   4.884
    2    HA   ALA  18           HA       ALA  18  17.705  -1.623   5.105
    3    HB2  ALA  18           HB1      ALA  18  16.604  -2.858   3.040
    4    HB3  ALA  18           HB2      ALA  18  16.847  -1.112   3.019
    5    HB1  ALA  18           HB3      ALA  18  15.255  -1.776   3.389

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ARG  19           H        ARG  19  14.211  -2.252   5.500
    2    HA   ARG  19           HA       ARG  19  13.510   0.392   6.205
    3    HB2  ARG  19           HB2      ARG  19  11.852  -1.382   5.622
    4    HB3  ARG  19           HB3      ARG  19  12.201  -2.171   7.162
    5    HG2  ARG  19           HG2      ARG  19  11.465  -0.184   8.394
    6    HG3  ARG  19           HG3      ARG  19  11.206   0.684   6.882
    7    HD2  ARG  19           HD2      ARG  19   9.073  -0.136   7.703
    8    HD3  ARG  19           HD3      ARG  19   9.505  -1.015   6.230
    9    HE   ARG  19           HE       ARG  19  10.480  -2.538   8.341
   10   HH21  ARG  19          HH11      ARG  19   9.250  -4.190   9.285
   11   HH22  ARG  19          HH12      ARG  19   7.530  -4.185   9.112
   12   HH11  ARG  19          HH21      ARG  19   7.471  -1.286   7.238
   13   HH12  ARG  19          HH22      ARG  19   6.523  -2.541   7.949

  No H/Q in entry =          13
  In of MODEL    3
    1    H    SER  20           H        SER  20  14.400  -2.421   8.175
    2    HA   SER  20           HA       SER  20  14.101  -1.316  10.708
    3    HB2  SER  20           HB2      SER  20  14.635  -3.693  10.331
    4    HB3  SER  20           HB3      SER  20  16.247  -3.243   9.781
    5    HG   SER  20           HG       SER  20  15.170  -3.317  12.332

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU  21           H        LEU  21  16.946  -1.227   8.575
    2    HA   LEU  21           HA       LEU  21  18.599   0.285  10.310
    3    HB2  LEU  21           HB2      LEU  21  18.584  -0.002   7.298
    4    HB3  LEU  21           HB3      LEU  21  19.826   0.884   8.182
    5    HG   LEU  21           HG       LEU  21  19.130  -2.015   8.740
    6   HD11  LEU  21          HD11      LEU  21  21.243  -0.798   6.943
    7   HD13  LEU  21          HD12      LEU  21  19.974  -1.934   6.489
    8   HD12  LEU  21          HD13      LEU  21  21.305  -2.465   7.516
    9   HD22  LEU  21          HD21      LEU  21  20.276  -1.252  10.637
   10   HD21  LEU  21          HD22      LEU  21  21.239  -0.091   9.729
   11   HD23  LEU  21          HD23      LEU  21  21.621  -1.803   9.641

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ALA  22           H        ALA  22  16.327   1.218   7.748
    2    HA   ALA  22           HA       ALA  22  16.832   3.982   7.753
    3    HB3  ALA  22           HB1      ALA  22  15.447   2.717   6.077
    4    HB2  ALA  22           HB2      ALA  22  14.721   4.223   6.638
    5    HB1  ALA  22           HB3      ALA  22  14.149   2.679   7.270

  No H/Q in entry =           5
  In of MODEL    3
    1    H    TYR  23           H        TYR  23  14.355   2.142   9.591
    2    HA   TYR  23           HA       TYR  23  13.363   4.373  11.032
    3    HB2  TYR  23           HB2      TYR  23  12.152   2.246  11.017
    4    HB3  TYR  23           HB3      TYR  23  13.493   1.452  11.843
    5    HD1  TYR  23           HD1      TYR  23  10.974   4.184  12.205
    6    HD2  TYR  23           HD2      TYR  23  13.674   1.503  14.198
    7    HE1  TYR  23           HE1      TYR  23  10.039   4.872  14.398
    8    HE2  TYR  23           HE2      TYR  23  12.739   2.190  16.389
    9    HH   TYR  23           HH       TYR  23  10.130   4.616  16.594

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ALA  24           H        ALA  24  16.035   2.131  11.680
    2    HA   ALA  24           HA       ALA  24  16.690   3.143  14.241
    3    HB1  ALA  24           HB1      ALA  24  18.067   1.365  14.084
    4    HB3  ALA  24           HB2      ALA  24  19.086   2.295  12.983
    5    HB2  ALA  24           HB3      ALA  24  17.804   1.269  12.344

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA  25           H        ALA  25  17.640   4.072  10.960
    2    HA   ALA  25           HA       ALA  25  19.562   6.031  11.602
    3    HB1  ALA  25           HB1      ALA  25  18.860   5.067   9.289
    4    HB3  ALA  25           HB2      ALA  25  19.341   6.761   9.377
    5    HB2  ALA  25           HB3      ALA  25  17.632   6.333   9.307

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU  26           H        LEU  26  16.045   6.218  11.235
    2    HA   LEU  26           HA       LEU  26  15.789   8.999  11.677
    3    HB2  LEU  26           HB2      LEU  26  13.942   7.739  10.750
    4    HB3  LEU  26           HB3      LEU  26  13.861   6.715  12.179
    5    HG   LEU  26           HG       LEU  26  13.231   8.670  13.552
    6   HD12  LEU  26          HD11      LEU  26  12.548  10.759  12.219
    7   HD11  LEU  26          HD12      LEU  26  13.538  10.113  10.913
    8   HD13  LEU  26          HD13      LEU  26  14.276  10.511  12.465
    9   HD21  LEU  26          HD21      LEU  26  11.563   8.330  11.041
   10   HD23  LEU  26          HD22      LEU  26  10.992   9.026  12.554
   11   HD22  LEU  26          HD23      LEU  26  11.464   7.330  12.490

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LYS  27           H        LYS  27  15.708   6.226  13.879
    2    HA   LYS  27           HA       LYS  27  15.097   7.593  16.242
    3    HB2  LYS  27           HB2      LYS  27  15.153   5.117  15.985
    4    HB3  LYS  27           HB3      LYS  27  16.916   5.189  15.944
    5    HG2  LYS  27           HG2      LYS  27  16.952   6.182  18.190
    6    HG3  LYS  27           HG3      LYS  27  15.185   6.181  18.233
    7    HD2  LYS  27           HD2      LYS  27  15.186   3.713  18.005
    8    HD3  LYS  27           HD3      LYS  27  16.951   3.722  17.995
    9    HE2  LYS  27           HE2      LYS  27  16.971   4.719  20.249
   10    HE3  LYS  27           HE3      LYS  27  15.205   4.740  20.261
   11    HZ3  LYS  27           HZ1      LYS  27  16.012   2.800  21.419
   12    HZ2  LYS  27           HZ2      LYS  27  16.936   2.326  20.071
   13    HZ1  LYS  27           HZ3      LYS  27  15.238   2.313  19.989

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLN  28           H        GLN  28  18.222   7.038  14.656
    2    HA   GLN  28           HA       GLN  28  19.892   8.146  16.645
    3    HB2  GLN  28           HB2      GLN  28  20.182   8.089  13.630
    4    HB3  GLN  28           HB3      GLN  28  21.463   8.585  14.738
    5    HG2  GLN  28           HG2      GLN  28  20.079   5.888  14.795
    6    HG3  GLN  28           HG3      GLN  28  21.658   6.192  14.074
    7   HE21  GLN  28          HE21      GLN  28  20.433   4.842  16.763
    8   HE22  GLN  28          HE22      GLN  28  21.600   5.301  17.906

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ALA  29           H        ALA  29  18.129   9.602  13.946
    2    HA   ALA  29           HA       ALA  29  19.101  12.233  14.191
    3    HB2  ALA  29           HB1      ALA  29  17.399  12.848  12.716
    4    HB1  ALA  29           HB2      ALA  29  16.265  11.666  13.369
    5    HB3  ALA  29           HB3      ALA  29  17.602  11.133  12.349

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LYS  30           H        LYS  30  16.338  10.612  15.714
    2    HA   LYS  30           HA       LYS  30  15.301  12.860  17.062
    3    HB2  LYS  30           HB2      LYS  30  15.216   9.920  17.775
    4    HB3  LYS  30           HB3      LYS  30  14.337  11.165  18.664
    5    HG2  LYS  30           HG2      LYS  30  13.209  11.833  16.542
    6    HG3  LYS  30           HG3      LYS  30  14.027  10.502  15.720
    7    HD2  LYS  30           HD2      LYS  30  12.968   8.890  17.253
    8    HD3  LYS  30           HD3      LYS  30  12.160  10.210  18.098
    9    HE2  LYS  30           HE2      LYS  30  10.989  10.825  16.002
   10    HE3  LYS  30           HE3      LYS  30  11.777   9.476  15.176
   11    HZ2  LYS  30           HZ1      LYS  30   9.471   9.048  16.055
   12    HZ1  LYS  30           HZ2      LYS  30  10.136   9.112  17.623
   13    HZ3  LYS  30           HZ3      LYS  30  10.657   7.928  16.517

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLN  31           H        GLN  31  17.981  10.717  17.810
    2    HA   GLN  31           HA       GLN  31  18.295  11.743  20.501
    3    HB2  GLN  31           HB2      GLN  31  20.334  10.185  18.904
    4    HB3  GLN  31           HB3      GLN  31  20.197  10.314  20.658
    5    HG2  GLN  31           HG2      GLN  31  17.693   9.337  19.889
    6    HG3  GLN  31           HG3      GLN  31  18.803   8.499  18.813
    7   HE21  GLN  31          HE21      GLN  31  17.268   7.346  21.091
    8   HE22  GLN  31          HE22      GLN  31  18.429   6.699  22.145

  No H/Q in entry =           8
  In of MODEL    3
    1    H    GLY  32           H        GLY  32  18.806  13.055  17.531
    2    HA3  GLY  32           HA2      GLY  32  19.773  15.108  17.012
    3    HA2  GLY  32           HA3      GLY  32  20.528  15.124  18.601

  No H/Q in entry =           3
  In of MODEL    3
    1    H    ASP  33           H        ASP  33  20.978  12.230  16.833
    2    HA   ASP  33           HA       ASP  33  23.798  12.930  16.369
    3    HB2  ASP  33           HB2      ASP  33  22.313  10.301  16.491
    4    HB3  ASP  33           HB3      ASP  33  23.999  10.431  15.998

  No H/Q in entry =           4
  In of MODEL    3
    1    H    PHE  34           H        PHE  34  23.307  14.243  14.483
    2    HA   PHE  34           HA       PHE  34  21.970  13.239  12.197
    3    HB2  PHE  34           HB2      PHE  34  24.081  15.394  12.423
    4    HB3  PHE  34           HB3      PHE  34  23.100  15.090  10.991
    5    HD1  PHE  34           HD1      PHE  34  23.330  17.035  13.899
    6    HD2  PHE  34           HD2      PHE  34  20.475  14.885  11.516
    7    HE1  PHE  34           HE1      PHE  34  21.499  18.419  14.839
    8    HE2  PHE  34           HE2      PHE  34  18.648  16.269  12.459
    9    HZ   PHE  34           HZ       PHE  34  19.164  18.036  14.116

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ALA  35           H        ALA  35  25.345  13.086  13.210
    2    HA   ALA  35           HA       ALA  35  26.461  12.268  10.757
    3    HB3  ALA  35           HB1      ALA  35  28.150  11.120  12.482
    4    HB2  ALA  35           HB2      ALA  35  27.276  12.141  13.623
    5    HB1  ALA  35           HB3      ALA  35  28.107  12.867  12.250

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA  36           H        ALA  36  25.361  10.310  13.527
    2    HA   ALA  36           HA       ALA  36  25.870   7.823  12.260
    3    HB2  ALA  36           HB1      ALA  36  25.444   7.079  14.337
    4    HB3  ALA  36           HB2      ALA  36  23.752   7.557  14.183
    5    HB1  ALA  36           HB3      ALA  36  24.941   8.702  14.804

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA  37           H        ALA  37  23.028   9.922  12.383
    2    HA   ALA  37           HA       ALA  37  21.191   8.130  11.210
    3    HB3  ALA  37           HB1      ALA  37  21.386  11.096  11.494
    4    HB1  ALA  37           HB2      ALA  37  20.085  10.006  11.968
    5    HB2  ALA  37           HB3      ALA  37  20.271  10.474  10.277

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LYS  38           H        LYS  38  23.267  10.608   9.727
    2    HA   LYS  38           HA       LYS  38  22.635  10.165   7.050
    3    HB2  LYS  38           HB2      LYS  38  24.427  11.746   8.492
    4    HB3  LYS  38           HB3      LYS  38  25.472  10.764   7.471
    5    HG2  LYS  38           HG2      LYS  38  24.302  11.516   5.471
    6    HG3  LYS  38           HG3      LYS  38  23.097  12.361   6.448
    7    HD2  LYS  38           HD2      LYS  38  24.675  13.978   7.197
    8    HD3  LYS  38           HD3      LYS  38  26.046  13.005   6.666
    9    HE2  LYS  38           HE2      LYS  38  25.671  14.867   5.108
   10    HE3  LYS  38           HE3      LYS  38  25.353  13.324   4.309
   11    HZ3  LYS  38           HZ1      LYS  38  23.152  13.745   4.174
   12    HZ2  LYS  38           HZ2      LYS  38  23.657  15.366   4.257
   13    HZ1  LYS  38           HZ3      LYS  38  23.090  14.580   5.652

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ALA  39           H        ALA  39  25.164   8.600   9.014
    2    HA   ALA  39           HA       ALA  39  26.253   7.017   6.951
    3    HB2  ALA  39           HB1      ALA  39  26.171   6.062   9.797
    4    HB1  ALA  39           HB2      ALA  39  27.108   7.496   9.378
    5    HB3  ALA  39           HB3      ALA  39  27.478   5.947   8.620

  No H/Q in entry =           5
  In of MODEL    3
    1    H    MET  40           H        MET  40  23.644   6.380   9.248
    2    HA   MET  40           HA       MET  40  23.231   3.668   8.521
    3    HB2  MET  40           HB2      MET  40  21.391   5.696   9.805
    4    HB3  MET  40           HB3      MET  40  21.003   3.982   9.635
    5    HG2  MET  40           HG2      MET  40  23.540   4.955  10.976
    6    HG3  MET  40           HG3      MET  40  22.048   4.666  11.868
    7    HE3  MET  40           HE1      MET  40  21.525   1.027  12.055
    8    HE2  MET  40           HE2      MET  40  20.642   2.317  11.242
    9    HE1  MET  40           HE3      MET  40  21.378   2.618  12.815

  No H/Q in entry =           9
  In of MODEL    3
    1    H    MET  41           H        MET  41  21.785   6.702   7.323
    2    HA   MET  41           HA       MET  41  19.843   5.479   5.652
    3    HB2  MET  41           HB2      MET  41  21.296   8.085   5.133
    4    HB3  MET  41           HB3      MET  41  19.774   7.571   4.414
    5    HG2  MET  41           HG2      MET  41  19.028   7.383   6.965
    6    HG3  MET  41           HG3      MET  41  20.323   8.556   7.185
    7    HE2  MET  41           HE1      MET  41  19.750   9.827   3.843
    8    HE1  MET  41           HE2      MET  41  20.700  10.281   5.255
    9    HE3  MET  41           HE3      MET  41  19.416  11.345   4.685

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ASP  42           H        ASP  42  23.206   6.439   5.100
    2    HA   ASP  42           HA       ASP  42  23.307   5.957   2.344
    3    HB2  ASP  42           HB2      ASP  42  25.044   6.980   4.112
    4    HB3  ASP  42           HB3      ASP  42  25.720   5.362   3.991

  No H/Q in entry =           4
  In of MODEL    3
    1    H    GLN  43           H        GLN  43  24.052   3.819   5.072
    2    HA   GLN  43           HA       GLN  43  24.744   1.565   3.497
    3    HB2  GLN  43           HB2      GLN  43  23.716   1.745   6.339
    4    HB3  GLN  43           HB3      GLN  43  24.313   0.261   5.590
    5    HG2  GLN  43           HG2      GLN  43  26.463   1.495   5.077
    6    HG3  GLN  43           HG3      GLN  43  25.864   2.818   6.072
    7   HE21  GLN  43          HE21      GLN  43  28.107   1.874   7.114
    8   HE22  GLN  43          HE22      GLN  43  27.843   0.792   8.394

  No H/Q in entry =           8
  In of MODEL    3
    1    H    SER  44           H        SER  44  21.674   2.668   4.875
    2    HA   SER  44           HA       SER  44  20.132   0.404   4.208
    3    HB2  SER  44           HB2      SER  44  19.660   2.932   5.345
    4    HB3  SER  44           HB3      SER  44  18.627   2.872   3.919
    5    HG   SER  44           HG       SER  44  17.543   1.922   5.644

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ARG  45           H        ARG  45  20.842   3.372   2.395
    2    HA   ARG  45           HA       ARG  45  19.326   2.861   0.090
    3    HB2  ARG  45           HB2      ARG  45  20.444   5.012   0.669
    4    HB3  ARG  45           HB3      ARG  45  21.998   4.274   0.287
    5    HG2  ARG  45           HG2      ARG  45  21.222   3.852  -2.027
    6    HG3  ARG  45           HG3      ARG  45  19.680   4.614  -1.644
    7    HD2  ARG  45           HD2      ARG  45  20.906   6.726  -1.065
    8    HD3  ARG  45           HD3      ARG  45  22.412   5.968  -1.630
    9    HE   ARG  45           HE       ARG  45  20.487   5.702  -3.667
   10   HH21  ARG  45          HH11      ARG  45  20.466   7.065  -5.435
   11   HH22  ARG  45          HH12      ARG  45  21.206   8.624  -5.334
   12   HH11  ARG  45          HH21      ARG  45  22.187   8.225  -2.046
   13   HH12  ARG  45          HH22      ARG  45  22.179   9.280  -3.413

  No H/Q in entry =          13
  In of MODEL    3
    1    H    MET  46           H        MET  46  22.699   2.026   0.843
    2    HA   MET  46           HA       MET  46  23.320   0.832  -1.636
    3    HB2  MET  46           HB2      MET  46  24.428   0.534   1.155
    4    HB3  MET  46           HB3      MET  46  25.092  -0.366  -0.213
    5    HG2  MET  46           HG2      MET  46  25.527   1.728  -1.413
    6    HG3  MET  46           HG3      MET  46  24.801   2.652  -0.104
    7    HE2  MET  46           HE1      MET  46  28.737   0.627  -0.570
    8    HE1  MET  46           HE2      MET  46  27.167   0.145  -1.205
    9    HE3  MET  46           HE3      MET  46  27.709  -0.479   0.351

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ALA  47           H        ALA  47  21.949  -0.506   1.343
    2    HA   ALA  47           HA       ALA  47  21.924  -3.222   0.549
    3    HB2  ALA  47           HB1      ALA  47  21.539  -2.758   2.852
    4    HB3  ALA  47           HB2      ALA  47  20.009  -3.379   2.234
    5    HB1  ALA  47           HB3      ALA  47  20.221  -1.645   2.486

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU  48           H        LEU  48  19.545  -0.621   0.182
    2    HA   LEU  48           HA       LEU  48  17.516  -2.179  -1.065
    3    HB2  LEU  48           HB2      LEU  48  18.140   0.781  -1.189
    4    HB3  LEU  48           HB3      LEU  48  16.677   0.053  -1.854
    5    HG   LEU  48           HG       LEU  48  17.532  -0.230   1.036
    6   HD13  LEU  48          HD11      LEU  48  17.091   2.066   0.841
    7   HD12  LEU  48          HD12      LEU  48  15.539   1.404   1.352
    8   HD11  LEU  48          HD13      LEU  48  15.807   1.823  -0.340
    9   HD22  LEU  48          HD21      LEU  48  16.021  -1.961   0.661
   10   HD21  LEU  48          HD22      LEU  48  15.139  -1.071  -0.581
   11   HD23  LEU  48          HD23      LEU  48  14.922  -0.663   1.121

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ASN  49           H        ASN  49  20.185  -0.228  -2.301
    2    HA   ASN  49           HA       ASN  49  19.536  -0.328  -5.025
    3    HB2  ASN  49           HB2      ASN  49  21.201   1.206  -4.098
    4    HB3  ASN  49           HB3      ASN  49  22.246  -0.146  -3.678
    5   HD21  ASN  49          HD21      ASN  49  23.988   0.385  -5.074
    6   HD22  ASN  49          HD22      ASN  49  23.848   0.402  -6.764

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLU  50           H        GLU  50  21.541  -2.496  -3.054
    2    HA   GLU  50           HA       GLU  50  22.260  -4.252  -5.174
    3    HB2  GLU  50           HB2      GLU  50  23.458  -4.207  -3.008
    4    HB3  GLU  50           HB3      GLU  50  22.021  -4.847  -2.210
    5    HG2  GLU  50           HG2      GLU  50  22.131  -6.884  -3.561
    6    HG3  GLU  50           HG3      GLU  50  23.500  -6.241  -4.464

  No H/Q in entry =           6
  In of MODEL    3
    1    H    ALA  51           H        ALA  51  19.603  -4.204  -2.848
    2    HA   ALA  51           HA       ALA  51  18.462  -6.691  -3.596
    3    HB3  ALA  51           HB1      ALA  51  16.864  -6.196  -2.043
    4    HB1  ALA  51           HB2      ALA  51  16.635  -4.554  -2.647
    5    HB2  ALA  51           HB3      ALA  51  17.998  -4.923  -1.590

  No H/Q in entry =           5
  In of MODEL    3
    1    H    HIS  52           H        HIS  52  17.843  -3.353  -4.644
    2    HA   HIS  52           HA       HIS  52  15.735  -3.907  -6.441
    3    HB2  HIS  52           HB2      HIS  52  16.359  -1.633  -5.650
    4    HB3  HIS  52           HB3      HIS  52  17.817  -1.719  -6.638
    5    HD1  HIS  52           HD1      HIS  52  17.476  -1.799  -9.260
    6    HD2  HIS  52           HD2      HIS  52  13.998  -1.079  -7.077
    7    HE1  HIS  52           HE1      HIS  52  15.753  -0.962 -10.915
    8    HE2  HIS  52           HE2      HIS  52  13.627  -0.517  -9.601

  No H/Q in entry =           8
  In of MODEL    3
    1    H    LEU  53           H        LEU  53  19.253  -3.880  -6.874
    2    HA   LEU  53           HA       LEU  53  19.313  -4.206  -9.673
    3    HB2  LEU  53           HB2      LEU  53  21.253  -4.935  -7.494
    4    HB3  LEU  53           HB3      LEU  53  21.574  -5.334  -9.180
    5    HG   LEU  53           HG       LEU  53  20.882  -2.522  -8.269
    6   HD11  LEU  53          HD11      LEU  53  22.972  -3.365  -7.178
    7   HD13  LEU  53          HD12      LEU  53  23.265  -2.035  -8.298
    8   HD12  LEU  53          HD13      LEU  53  23.632  -3.688  -8.778
    9   HD23  LEU  53          HD21      LEU  53  22.287  -2.091 -10.445
   10   HD22  LEU  53          HD22      LEU  53  20.606  -2.588 -10.602
   11   HD21  LEU  53          HD23      LEU  53  21.890  -3.759 -10.837

  No H/Q in entry =          11
  In of MODEL    3
    1    H    VAL  54           H        VAL  54  19.225  -6.583  -7.038
    2    HA   VAL  54           HA       VAL  54  19.371  -8.883  -8.689
    3    HB   VAL  54           HB       VAL  54  18.213  -8.460  -5.923
    4   HG12  VAL  54          HG11      VAL  54  18.564 -11.074  -5.908
    5   HG11  VAL  54          HG12      VAL  54  18.377 -10.915  -7.654
    6   HG13  VAL  54          HG13      VAL  54  17.083 -10.393  -6.578
    7   HG22  VAL  54          HG21      VAL  54  20.526  -8.225  -5.701
    8   HG21  VAL  54          HG22      VAL  54  20.875  -9.318  -7.038
    9   HG23  VAL  54          HG23      VAL  54  20.352  -9.965  -5.483

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLN  55           H        GLN  55  16.624  -7.003  -7.413
    2    HA   GLN  55           HA       GLN  55  14.620  -8.693  -8.480
    3    HB2  GLN  55           HB2      GLN  55  13.856  -7.169  -6.859
    4    HB3  GLN  55           HB3      GLN  55  14.634  -5.795  -7.641
    5    HG2  GLN  55           HG2      GLN  55  12.906  -5.495  -9.132
    6    HG3  GLN  55           HG3      GLN  55  12.603  -7.220  -9.295
    7   HE21  GLN  55          HE21      GLN  55  10.602  -7.787  -8.487
    8   HE22  GLN  55          HE22      GLN  55   9.820  -7.035  -7.182

  No H/Q in entry =           8
  In of MODEL    3
    1    H    THR  56           H        THR  56  16.329  -5.880  -9.851
    2    HA   THR  56           HA       THR  56  14.887  -5.543 -12.201
    3    HB   THR  56           HB       THR  56  17.905  -5.423 -12.045
    4    HG1  THR  56           HG1      THR  56  16.001  -4.029 -10.717
    5   HG22  THR  56          HG21      THR  56  17.507  -3.538 -13.669
    6   HG21  THR  56          HG22      THR  56  15.811  -4.019 -13.718
    7   HG23  THR  56          HG23      THR  56  17.059  -5.130 -14.284

  No H/Q in entry =           7
  In of MODEL    3
    1    H    LYS  57           H        LYS  57  17.562  -7.809 -11.580
    2    HA   LYS  57           HA       LYS  57  17.575  -9.014 -14.154
    3    HB2  LYS  57           HB2      LYS  57  19.370  -9.242 -12.413
    4    HB3  LYS  57           HB3      LYS  57  18.277 -10.238 -11.464
    5    HG2  LYS  57           HG2      LYS  57  18.182 -11.897 -13.263
    6    HG3  LYS  57           HG3      LYS  57  19.219 -10.896 -14.271
    7    HD2  LYS  57           HD2      LYS  57  21.037 -11.100 -12.608
    8    HD3  LYS  57           HD3      LYS  57  20.005 -12.119 -11.605
    9    HE2  LYS  57           HE2      LYS  57  19.848 -13.770 -13.451
   10    HE3  LYS  57           HE3      LYS  57  20.908 -12.768 -14.441
   11    HZ2  LYS  57           HZ1      LYS  57  21.600 -14.630 -12.446
   12    HZ1  LYS  57           HZ2      LYS  57  22.169 -13.094 -11.998
   13    HZ3  LYS  57           HZ3      LYS  57  22.615 -13.764 -13.494

  No H/Q in entry =          13
  In of MODEL    3
    1    H    LEU  58           H        LEU  58  15.802  -9.689 -11.175
    2    HA   LEU  58           HA       LEU  58  14.607 -12.080 -12.099
    3    HB2  LEU  58           HB2      LEU  58  13.792 -10.174  -9.911
    4    HB3  LEU  58           HB3      LEU  58  13.002 -11.722 -10.221
    5    HG   LEU  58           HG       LEU  58  15.972 -11.408  -9.668
    6   HD11  LEU  58          HD11      LEU  58  13.606 -11.845  -7.873
    7   HD13  LEU  58          HD12      LEU  58  15.049 -10.864  -7.615
    8   HD12  LEU  58          HD13      LEU  58  15.141 -12.618  -7.473
    9   HD22  LEU  58          HD21      LEU  58  15.877 -13.475 -10.687
   10   HD21  LEU  58          HD22      LEU  58  14.166 -13.703 -10.325
   11   HD23  LEU  58          HD23      LEU  58  15.378 -13.985  -9.075

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  59           H        ILE  59  13.898  -8.754 -12.796
    2    HA   ILE  59           HA       ILE  59  11.190  -9.437 -13.732
    3    HB   ILE  59           HB       ILE  59  11.969  -7.141 -12.536
    4   HG12  ILE  59          HG12      ILE  59  10.060  -7.053 -14.884
    5   HG13  ILE  59          HG13      ILE  59   9.650  -7.816 -13.369
    6   HG22  ILE  59          HG21      ILE  59  12.044  -6.341 -15.434
    7   HG21  ILE  59          HG22      ILE  59  13.523  -6.738 -14.589
    8   HG23  ILE  59          HG23      ILE  59  12.516  -5.403 -14.037
    9   HD13  ILE  59          HD11      ILE  59   8.818  -5.582 -13.221
   10   HD12  ILE  59          HD12      ILE  59  10.335  -4.919 -13.824
   11   HD11  ILE  59          HD13      ILE  59  10.266  -5.637 -12.215

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLU  60           H        GLU  60  14.383  -8.554 -14.995
    2    HA   GLU  60           HA       GLU  60  13.598  -8.175 -17.705
    3    HB2  GLU  60           HB2      GLU  60  15.770  -7.414 -16.851
    4    HB3  GLU  60           HB3      GLU  60  16.251  -9.083 -16.553
    5    HG2  GLU  60           HG2      GLU  60  16.058  -9.575 -18.967
    6    HG3  GLU  60           HG3      GLU  60  15.576  -7.906 -19.268

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLY  61           H        GLY  61  14.609 -11.037 -15.878
    2    HA3  GLY  61           HA2      GLY  61  14.086 -12.701 -18.272
    3    HA2  GLY  61           HA3      GLY  61  15.124 -13.165 -16.928

  No H/Q in entry =           3
  In of MODEL    3
    1    H    ASP  62           H        ASP  62  11.987 -11.653 -16.562
    2    HA   ASP  62           HA       ASP  62  11.088 -13.755 -14.829
    3    HB2  ASP  62           HB2      ASP  62   9.013 -12.372 -14.723
    4    HB3  ASP  62           HB3      ASP  62  10.479 -11.489 -14.312

  No H/Q in entry =           4
  In of MODEL    3
    1    H    ALA  63           H        ALA  63  11.163 -13.624 -18.166
    2    HA   ALA  63           HA       ALA  63   8.599 -14.530 -18.958
    3    HB3  ALA  63           HB1      ALA  63  10.519 -13.773 -20.453
    4    HB2  ALA  63           HB2      ALA  63   9.639 -15.198 -21.000
    5    HB1  ALA  63           HB3      ALA  63  11.211 -15.378 -20.223

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLY  64           H        GLY  64  11.473 -16.236 -17.831
    2    HA3  GLY  64           HA2      GLY  64  11.839 -18.400 -17.165
    3    HA2  GLY  64           HA3      GLY  64  10.179 -18.354 -16.587

  No H/Q in entry =           3
  In of MODEL    3
    1    H    GLU  65           H        GLU  65   9.190 -20.174 -17.265
    2    HA   GLU  65           HA       GLU  65   9.957 -21.785 -19.371
    3    HB2  GLU  65           HB2      GLU  65   7.228 -21.415 -18.145
    4    HB3  GLU  65           HB3      GLU  65   7.620 -22.697 -19.291
    5    HG2  GLU  65           HG2      GLU  65   9.365 -23.540 -17.803
    6    HG3  GLU  65           HG3      GLU  65   9.071 -22.221 -16.672

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLY  66           H        GLY  66   7.943 -22.361 -20.974
    2    HA3  GLY  66           HA2      GLY  66   8.218 -20.625 -23.166
    3    HA2  GLY  66           HA3      GLY  66   7.085 -21.957 -23.042

  No H/Q in entry =           3
  In of MODEL    3
    1    H    LYS  67           H        LYS  67   5.703 -20.885 -20.748
    2    HA   LYS  67           HA       LYS  67   3.708 -19.413 -22.072
    3    HB2  LYS  67           HB2      LYS  67   4.175 -20.007 -19.155
    4    HB3  LYS  67           HB3      LYS  67   2.718 -19.216 -19.770
    5    HG2  LYS  67           HG2      LYS  67   2.248 -21.110 -21.228
    6    HG3  LYS  67           HG3      LYS  67   3.760 -21.886 -20.762
    7    HD2  LYS  67           HD2      LYS  67   2.108 -22.966 -19.449
    8    HD3  LYS  67           HD3      LYS  67   2.851 -21.799 -18.352
    9    HE2  LYS  67           HE2      LYS  67   1.042 -20.246 -18.641
   10    HE3  LYS  67           HE3      LYS  67   0.368 -21.186 -19.972
   11    HZ3  LYS  67           HZ1      LYS  67  -0.852 -21.599 -17.949
   12    HZ2  LYS  67           HZ2      LYS  67   0.569 -22.056 -17.141
   13    HZ1  LYS  67           HZ3      LYS  67  -0.030 -23.007 -18.416

  No H/Q in entry =          13
  In of MODEL    3
    1    H    MET  68           H        MET  68   2.936 -17.387 -21.871
    2    HA   MET  68           HA       MET  68   4.764 -15.264 -21.878
    3    HB2  MET  68           HB2      MET  68   1.755 -15.248 -21.625
    4    HB3  MET  68           HB3      MET  68   2.746 -13.836 -21.995
    5    HG2  MET  68           HG2      MET  68   2.669 -16.378 -23.644
    6    HG3  MET  68           HG3      MET  68   1.827 -14.883 -24.050
    7    HE1  MET  68           HE1      MET  68   2.716 -12.785 -24.155
    8    HE3  MET  68           HE2      MET  68   4.179 -12.377 -25.048
    9    HE2  MET  68           HE3      MET  68   4.235 -12.504 -23.292

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LYS  69           H        LYS  69   2.556 -16.329 -19.278
    2    HA   LYS  69           HA       LYS  69   2.605 -14.167 -17.610
    3    HB2  LYS  69           HB2      LYS  69   2.601 -17.104 -16.936
    4    HB3  LYS  69           HB3      LYS  69   2.345 -15.839 -15.731
    5    HG2  LYS  69           HG2      LYS  69   0.464 -14.947 -17.055
    6    HG3  LYS  69           HG3      LYS  69   0.714 -16.212 -18.260
    7    HD2  LYS  69           HD2      LYS  69   0.257 -17.932 -16.550
    8    HD3  LYS  69           HD3      LYS  69  -0.005 -16.664 -15.349
    9    HE2  LYS  69           HE2      LYS  69  -1.855 -15.757 -16.720
   10    HE3  LYS  69           HE3      LYS  69  -1.605 -17.044 -17.898
   11    HZ2  LYS  69           HZ1      LYS  69  -2.970 -17.123 -15.391
   12    HZ1  LYS  69           HZ2      LYS  69  -1.797 -18.345 -15.511
   13    HZ3  LYS  69           HZ3      LYS  69  -3.023 -18.221 -16.681

  No H/Q in entry =          13
  In of MODEL    3
    1    H    VAL  70           H        VAL  70   3.620 -14.346 -15.214
    2    HA   VAL  70           HA       VAL  70   6.553 -14.674 -15.462
    3    HB   VAL  70           HB       VAL  70   6.819 -12.595 -14.141
    4   HG11  VAL  70          HG11      VAL  70   5.282 -12.430 -16.743
    5   HG13  VAL  70          HG12      VAL  70   7.031 -12.362 -16.520
    6   HG12  VAL  70          HG13      VAL  70   6.020 -11.021 -15.981
    7   HG23  VAL  70          HG21      VAL  70   4.693 -11.088 -14.113
    8   HG22  VAL  70          HG22      VAL  70   4.800 -12.382 -12.920
    9   HG21  VAL  70          HG23      VAL  70   3.797 -12.588 -14.356

  No H/Q in entry =           9
  In of MODEL    3
    1    H    SER  71           H        SER  71   7.607 -14.689 -13.278
    2    HA   SER  71           HA       SER  71   6.524 -16.682 -11.597
    3    HB2  SER  71           HB2      SER  71   8.955 -16.102 -11.768
    4    HB3  SER  71           HB3      SER  71   8.621 -14.617 -10.879
    5    HG   SER  71           HG       SER  71   9.114 -16.983  -9.889

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU  72           H        LEU  72   5.160 -16.577  -9.918
    2    HA   LEU  72           HA       LEU  72   3.584 -14.280  -9.483
    3    HB2  LEU  72           HB2      LEU  72   3.900 -16.828  -7.905
    4    HB3  LEU  72           HB3      LEU  72   2.719 -15.583  -7.506
    5    HG   LEU  72           HG       LEU  72   2.890 -16.897 -10.238
    6   HD13  LEU  72          HD11      LEU  72   2.321 -18.631  -8.660
    7   HD12  LEU  72          HD12      LEU  72   0.825 -18.131  -9.447
    8   HD11  LEU  72          HD13      LEU  72   1.194 -17.565  -7.818
    9   HD21  LEU  72          HD21      LEU  72   1.000 -14.982  -8.885
   10   HD23  LEU  72          HD22      LEU  72   0.382 -16.058 -10.127
   11   HD22  LEU  72          HD23      LEU  72   1.659 -14.910 -10.515

  No H/Q in entry =          11
  In of MODEL    3
    1    H    VAL  73           H        VAL  73   6.256 -15.680  -7.703
    2    HA   VAL  73           HA       VAL  73   6.177 -14.139  -5.377
    3    HB   VAL  73           HB       VAL  73   8.394 -14.900  -4.965
    4   HG11  VAL  73          HG11      VAL  73   6.545 -16.613  -5.051
    5   HG13  VAL  73          HG12      VAL  73   8.155 -17.274  -5.336
    6   HG12  VAL  73          HG13      VAL  73   7.062 -17.001  -6.692
    7   HG21  VAL  73          HG21      VAL  73   8.500 -15.066  -7.960
    8   HG23  VAL  73          HG22      VAL  73   9.531 -16.130  -7.004
    9   HG22  VAL  73          HG23      VAL  73   9.678 -14.380  -6.841

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LEU  74           H        LEU  74   7.159 -13.245  -8.556
    2    HA   LEU  74           HA       LEU  74   9.081 -11.273  -8.069
    3    HB2  LEU  74           HB2      LEU  74   8.633 -12.038 -10.305
    4    HB3  LEU  74           HB3      LEU  74   6.963 -11.483 -10.207
    5    HG   LEU  74           HG       LEU  74   7.745  -9.150 -10.008
    6   HD12  LEU  74          HD11      LEU  74  10.253  -8.846 -10.599
    7   HD11  LEU  74          HD12      LEU  74  10.436 -10.516 -10.066
    8   HD13  LEU  74          HD13      LEU  74   9.854  -9.291  -8.940
    9   HD23  LEU  74          HD21      LEU  74   9.251 -10.242 -12.325
   10   HD22  LEU  74          HD22      LEU  74   8.088  -8.938 -12.243
   11   HD21  LEU  74          HD23      LEU  74   7.527 -10.594 -12.221

  No H/Q in entry =          11
  In of MODEL    3
    1    H    VAL  75           H        VAL  75   5.582 -10.929  -8.427
    2    HA   VAL  75           HA       VAL  75   5.454  -8.172  -7.850
    3    HB   VAL  75           HB       VAL  75   3.383 -10.330  -7.440
    4   HG12  VAL  75          HG11      VAL  75   1.787  -8.383  -7.386
    5   HG11  VAL  75          HG12      VAL  75   3.170  -7.299  -7.359
    6   HG13  VAL  75          HG13      VAL  75   2.887  -8.390  -6.012
    7   HG21  VAL  75          HG21      VAL  75   4.352  -9.726  -9.777
    8   HG23  VAL  75          HG22      VAL  75   3.501  -8.197  -9.575
    9   HG22  VAL  75          HG23      VAL  75   2.599  -9.712  -9.590

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLU  76           H        GLU  76   5.230 -11.044  -5.730
    2    HA   GLU  76           HA       GLU  76   4.742  -9.679  -3.314
    3    HB2  GLU  76           HB2      GLU  76   4.591 -12.145  -3.529
    4    HB3  GLU  76           HB3      GLU  76   6.325 -12.232  -3.785
    5    HG2  GLU  76           HG2      GLU  76   5.909 -12.807  -1.481
    6    HG3  GLU  76           HG3      GLU  76   6.646 -11.216  -1.483

  No H/Q in entry =           6
  In of MODEL    3
    1    H    ALA  77           H        ALA  77   7.814 -10.558  -4.870
    2    HA   ALA  77           HA       ALA  77   9.489  -9.488  -2.856
    3    HB2  ALA  77           HB1      ALA  77  11.207  -9.411  -4.718
    4    HB3  ALA  77           HB2      ALA  77   9.936  -9.974  -5.803
    5    HB1  ALA  77           HB3      ALA  77  10.453 -10.983  -4.453

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLN  78           H        GLN  78   8.086  -8.097  -5.777
    2    HA   GLN  78           HA       GLN  78   9.411  -5.603  -5.680
    3    HB2  GLN  78           HB2      GLN  78   8.103  -6.568  -7.624
    4    HB3  GLN  78           HB3      GLN  78   6.631  -6.137  -6.756
    5    HG2  GLN  78           HG2      GLN  78   7.282  -3.787  -6.747
    6    HG3  GLN  78           HG3      GLN  78   8.815  -4.181  -7.523
    7   HE21  GLN  78          HE21      GLN  78   7.730  -6.154  -9.396
    8   HE22  GLN  78          HE22      GLN  78   6.794  -5.300 -10.526

  No H/Q in entry =           8
  In of MODEL    3
    1    H    LEU  79           H        LEU  79   6.402  -6.768  -4.250
    2    HA   LEU  79           HA       LEU  79   5.381  -4.368  -3.252
    3    HB2  LEU  79           HB2      LEU  79   4.088  -6.433  -3.191
    4    HB3  LEU  79           HB3      LEU  79   5.238  -7.156  -2.071
    5    HG   LEU  79           HG       LEU  79   4.666  -5.513  -0.351
    6   HD13  LEU  79          HD11      LEU  79   4.181  -3.508  -1.410
    7   HD12  LEU  79          HD12      LEU  79   2.560  -4.049  -0.972
    8   HD11  LEU  79          HD13      LEU  79   3.146  -4.271  -2.618
    9   HD23  LEU  79          HD21      LEU  79   2.084  -6.032  -0.264
   10   HD22  LEU  79          HD22      LEU  79   3.237  -7.359  -0.148
   11   HD21  LEU  79          HD23      LEU  79   2.423  -7.036  -1.676

  No H/Q in entry =          11
  In of MODEL    3
    1    H    HIS  80           H        HIS  80   7.584  -6.674  -1.656
    2    HA   HIS  80           HA       HIS  80   7.851  -5.120   0.708
    3    HB2  HIS  80           HB2      HIS  80   9.216  -7.475  -0.480
    4    HB3  HIS  80           HB3      HIS  80  10.115  -6.564   0.736
    5    HD1  HIS  80           HD1      HIS  80   9.626  -7.196   3.080
    6    HD2  HIS  80           HD2      HIS  80   6.424  -8.089   0.564
    7    HE1  HIS  80           HE1      HIS  80   7.862  -8.312   4.529
    8    HE2  HIS  80           HE2      HIS  80   5.904  -8.861   3.003

  No H/Q in entry =           8
  In of MODEL    3
    1    H    LEU  81           H        LEU  81   9.866  -5.387  -2.199
    2    HA   LEU  81           HA       LEU  81  11.890  -3.622  -1.322
    3    HB2  LEU  81           HB2      LEU  81  10.984  -4.434  -4.085
    4    HB3  LEU  81           HB3      LEU  81  12.393  -3.412  -3.795
    5    HG   LEU  81           HG       LEU  81  12.024  -6.133  -2.512
    6   HD12  LEU  81          HD11      LEU  81  13.851  -6.747  -4.255
    7   HD11  LEU  81          HD12      LEU  81  13.273  -5.332  -5.133
    8   HD13  LEU  81          HD13      LEU  81  12.174  -6.666  -4.793
    9   HD23  LEU  81          HD21      LEU  81  14.650  -5.791  -2.493
   10   HD22  LEU  81          HD22      LEU  81  13.657  -5.036  -1.248
   11   HD21  LEU  81          HD23      LEU  81  14.229  -4.084  -2.617

  No H/Q in entry =          11
  In of MODEL    3
    1    H    MET  82           H        MET  82   8.966  -3.021  -3.268
    2    HA   MET  82           HA       MET  82   9.481  -0.292  -3.778
    3    HB2  MET  82           HB2      MET  82   6.937  -1.910  -3.653
    4    HB3  MET  82           HB3      MET  82   6.921  -0.187  -4.024
    5    HG2  MET  82           HG2      MET  82   8.545  -2.251  -5.548
    6    HG3  MET  82           HG3      MET  82   6.973  -1.645  -6.066
    7    HE3  MET  82           HE1      MET  82   7.391   1.810  -7.250
    8    HE2  MET  82           HE2      MET  82   7.015   1.586  -5.543
    9    HE1  MET  82           HE3      MET  82   6.363   0.466  -6.735

  No H/Q in entry =           9
  In of MODEL    3
    1    H    THR  83           H        THR  83   7.698  -1.898  -1.171
    2    HA   THR  83           HA       THR  83   6.822   0.447   0.144
    3    HB   THR  83           HB       THR  83   6.697  -1.121   2.168
    4    HG1  THR  83           HG1      THR  83   7.473  -3.065   1.947
    5   HG22  THR  83          HG21      THR  83   5.062  -2.707   0.701
    6   HG21  THR  83          HG22      THR  83   5.279  -1.381  -0.435
    7   HG23  THR  83          HG23      THR  83   4.632  -1.066   1.175

  No H/Q in entry =           7
  In of MODEL    3
    1    H    SER  84           H        SER  84   9.663  -1.622   0.680
    2    HA   SER  84           HA       SER  84  10.704  -0.174   2.865
    3    HB2  SER  84           HB2      SER  84  11.979  -2.013   0.850
    4    HB3  SER  84           HB3      SER  84  12.916  -1.246   2.131
    5    HG   SER  84           HG       SER  84  10.656  -2.956   2.391

  No H/Q in entry =           5
  In of MODEL    3
    1    H    MET  85           H        MET  85  11.464   0.081  -0.622
    2    HA   MET  85           HA       MET  85  13.444   2.064  -0.373
    3    HB2  MET  85           HB2      MET  85  13.075   0.778  -2.436
    4    HB3  MET  85           HB3      MET  85  11.531   1.599  -2.669
    5    HG2  MET  85           HG2      MET  85  12.700   3.772  -2.779
    6    HG3  MET  85           HG3      MET  85  14.241   2.951  -2.551
    7    HE2  MET  85           HE1      MET  85  11.681   3.302  -6.283
    8    HE1  MET  85           HE2      MET  85  11.592   4.174  -4.754
    9    HE3  MET  85           HE3      MET  85  10.953   2.539  -4.861

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LEU  86           H        LEU  86   9.952   2.367  -0.892
    2    HA   LEU  86           HA       LEU  86   9.864   5.178  -1.084
    3    HB2  LEU  86           HB2      LEU  86   8.036   3.501  -1.658
    4    HB3  LEU  86           HB3      LEU  86   7.703   3.414   0.071
    5    HG   LEU  86           HG       LEU  86   7.520   5.973   0.009
    6   HD11  LEU  86          HD11      LEU  86   8.306   5.534  -2.690
    7   HD13  LEU  86          HD12      LEU  86   7.855   7.061  -1.936
    8   HD12  LEU  86          HD13      LEU  86   6.629   6.084  -2.740
    9   HD23  LEU  86          HD21      LEU  86   5.402   4.596  -1.654
   10   HD22  LEU  86          HD22      LEU  86   5.198   5.859  -0.443
   11   HD21  LEU  86          HD23      LEU  86   5.610   4.220   0.057

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ALA  87           H        ALA  87   9.410   3.006   1.669
    2    HA   ALA  87           HA       ALA  87   8.841   4.922   3.630
    3    HB1  ALA  87           HB1      ALA  87   9.672   2.109   3.556
    4    HB3  ALA  87           HB2      ALA  87   8.537   2.915   4.636
    5    HB2  ALA  87           HB3      ALA  87  10.265   2.963   4.984

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ARG  88           H        ARG  88  11.938   3.520   2.662
    2    HA   ARG  88           HA       ARG  88  13.532   4.919   4.493
    3    HB2  ARG  88           HB2      ARG  88  14.220   2.946   3.098
    4    HB3  ARG  88           HB3      ARG  88  14.367   4.035   1.722
    5    HG2  ARG  88           HG2      ARG  88  15.824   5.368   3.667
    6    HG3  ARG  88           HG3      ARG  88  16.158   3.683   4.053
    7    HD2  ARG  88           HD2      ARG  88  17.432   3.390   2.210
    8    HD3  ARG  88           HD3      ARG  88  16.290   4.248   1.171
    9    HE   ARG  88           HE       ARG  88  18.673   5.336   2.220
   10   HH21  ARG  88          HH11      ARG  88  19.000   7.557   2.018
   11   HH22  ARG  88          HH12      ARG  88  17.641   8.617   1.868
   12   HH11  ARG  88          HH21      ARG  88  15.328   6.060   1.931
   13   HH12  ARG  88          HH22      ARG  88  15.560   7.766   1.794

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLU  89           H        GLU  89  12.559   5.796   1.164
    2    HA   GLU  89           HA       GLU  89  14.086   8.169   1.003
    3    HB2  GLU  89           HB2      GLU  89  12.955   7.111  -0.944
    4    HB3  GLU  89           HB3      GLU  89  11.404   7.641  -0.291
    5    HG2  GLU  89           HG2      GLU  89  12.087   9.984  -0.461
    6    HG3  GLU  89           HG3      GLU  89  13.696   9.505  -0.992

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LEU  90           H        LEU  90  10.758   7.635   2.127
    2    HA   LEU  90           HA       LEU  90  10.219  10.366   2.691
    3    HB2  LEU  90           HB2      LEU  90   9.044   7.786   3.725
    4    HB3  LEU  90           HB3      LEU  90   8.399   9.378   4.141
    5    HG   LEU  90           HG       LEU  90   8.831   8.491   1.276
    6   HD12  LEU  90          HD11      LEU  90   6.300   8.141   1.334
    7   HD11  LEU  90          HD12      LEU  90   6.451   8.139   3.091
    8   HD13  LEU  90          HD13      LEU  90   7.281   6.912   2.133
    9   HD22  LEU  90          HD21      LEU  90   8.517  10.796   1.193
   10   HD21  LEU  90          HD22      LEU  90   7.528  10.826   2.651
   11   HD23  LEU  90          HD23      LEU  90   6.838  10.259   1.130

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  91           H        ILE  91  11.500   7.703   4.626
    2    HA   ILE  91           HA       ILE  91  11.624   9.077   7.089
    3    HB   ILE  91           HB       ILE  91  13.200   6.748   5.977
    4   HG12  ILE  91          HG12      ILE  91  11.178   6.907   8.232
    5   HG13  ILE  91          HG13      ILE  91  10.713   6.616   6.556
    6   HG22  ILE  91          HG21      ILE  91  13.666   6.548   8.620
    7   HG21  ILE  91          HG22      ILE  91  13.576   8.306   8.512
    8   HG23  ILE  91          HG23      ILE  91  14.764   7.424   7.553
    9   HD13  ILE  91          HD11      ILE  91  11.734   4.522   6.496
   10   HD12  ILE  91          HD12      ILE  91  11.136   4.581   8.154
   11   HD11  ILE  91          HD13      ILE  91  12.836   4.908   7.818

  No H/Q in entry =          11
  In of MODEL    3
    1    H    THR  92           H        THR  92  13.848   8.917   4.343
    2    HA   THR  92           HA       THR  92  15.999  10.333   5.501
    3    HB   THR  92           HB       THR  92  15.020  10.189   2.639
    4    HG1  THR  92           HG1      THR  92  15.867   8.301   3.053
    5   HG22  THR  92          HG21      THR  92  17.585  10.900   2.348
    6   HG21  THR  92          HG22      THR  92  17.266  11.724   3.874
    7   HG23  THR  92          HG23      THR  92  16.296  12.098   2.450

  No H/Q in entry =           7
  In of MODEL    3
    1    H    GLU  93           H        GLU  93  13.106  11.456   3.763
    2    HA   GLU  93           HA       GLU  93  13.677  14.222   3.868
    3    HB2  GLU  93           HB2      GLU  93  10.984  12.826   3.882
    4    HB3  GLU  93           HB3      GLU  93  11.259  14.527   3.504
    5    HG2  GLU  93           HG2      GLU  93  12.618  12.290   1.987
    6    HG3  GLU  93           HG3      GLU  93  11.067  12.958   1.495

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LEU  94           H        LEU  94  11.948  12.059   6.083
    2    HA   LEU  94           HA       LEU  94  11.118  14.005   7.951
    3    HB2  LEU  94           HB2      LEU  94  11.719  11.056   8.237
    4    HB3  LEU  94           HB3      LEU  94  11.136  12.031   9.583
    5    HG   LEU  94           HG       LEU  94   9.657  12.061   6.951
    6   HD11  LEU  94          HD11      LEU  94   9.755   9.848   8.963
    7   HD13  LEU  94          HD12      LEU  94   9.457   9.778   7.228
    8   HD12  LEU  94          HD13      LEU  94   8.172  10.287   8.322
    9   HD23  LEU  94          HD21      LEU  94   7.731  12.450   8.546
   10   HD22  LEU  94          HD22      LEU  94   8.959  13.715   8.581
   11   HD21  LEU  94          HD23      LEU  94   8.904  12.502   9.859

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  95           H        ILE  95  14.109  12.100   7.727
    2    HA   ILE  95           HA       ILE  95  15.264  13.040  10.139
    3    HB   ILE  95           HB       ILE  95  16.517  11.973   7.597
    4   HG12  ILE  95          HG12      ILE  95  16.226  10.780  10.369
    5   HG13  ILE  95          HG13      ILE  95  15.064  10.507   9.072
    6   HG21  ILE  95          HG21      ILE  95  17.761  12.800  10.239
    7   HG23  ILE  95          HG22      ILE  95  18.222  13.326   8.619
    8   HG22  ILE  95          HG23      ILE  95  18.541  11.670   9.134
    9   HD13  ILE  95          HD11      ILE  95  16.558   9.236   7.817
   10   HD12  ILE  95          HD12      ILE  95  17.031   8.797   9.455
   11   HD11  ILE  95          HD13      ILE  95  17.976   9.982   8.553

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLU  96           H        GLU  96  15.414  14.263   6.801
    2    HA   GLU  96           HA       GLU  96  17.243  16.359   7.274
    3    HB2  GLU  96           HB2      GLU  96  16.588  15.683   5.016
    4    HB3  GLU  96           HB3      GLU  96  14.939  16.227   5.311
    5    HG2  GLU  96           HG2      GLU  96  15.488  18.359   4.762
    6    HG3  GLU  96           HG3      GLU  96  16.785  18.375   5.947

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LEU  97           H        LEU  97  13.732  16.144   7.698
    2    HA   LEU  97           HA       LEU  97  13.292  18.876   8.329
    3    HB2  LEU  97           HB2      LEU  97  11.794  16.340   8.950
    4    HB3  LEU  97           HB3      LEU  97  11.267  17.885   9.614
    5    HG   LEU  97           HG       LEU  97  11.758  17.462   6.652
    6   HD12  LEU  97          HD11      LEU  97   9.236  17.313   6.530
    7   HD11  LEU  97          HD12      LEU  97   9.228  17.119   8.281
    8   HD13  LEU  97          HD13      LEU  97  10.021  15.915   7.264
    9   HD23  LEU  97          HD21      LEU  97  10.004  19.412   6.675
   10   HD22  LEU  97          HD22      LEU  97  11.681  19.787   7.068
   11   HD21  LEU  97          HD23      LEU  97  10.492  19.611   8.357

  No H/Q in entry =          11
  In of MODEL    3
    1    H    HIS  98           H        HIS  98  14.134  16.064  10.336
    2    HA   HIS  98           HA       HIS  98  13.961  17.333  12.847
    3    HB2  HIS  98           HB2      HIS  98  15.731  15.086  11.857
    4    HB3  HIS  98           HB3      HIS  98  15.723  15.631  13.536
    5    HD1  HIS  98           HD1      HIS  98  13.541  13.974  10.946
    6    HD2  HIS  98           HD2      HIS  98  13.420  14.907  15.007
    7    HE1  HIS  98           HE1      HIS  98  11.525  12.766  11.899
    8    HE2  HIS  98           HE2      HIS  98  11.431  13.325  14.368

  No H/Q in entry =           8
  In of MODEL    3
    1    H    GLU  99           H        GLU  99  16.519  17.230  10.417
    2    HA   GLU  99           HA       GLU  99  18.491  18.583  11.945
    3    HB2  GLU  99           HB2      GLU  99  18.985  17.293   9.881
    4    HB3  GLU  99           HB3      GLU  99  18.166  18.538   8.934
    5    HG2  GLU  99           HG2      GLU  99  19.759  20.224   9.722
    6    HG3  GLU  99           HG3      GLU  99  20.546  19.032  10.750

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LYS 100           H        LYS 100  15.962  19.717   9.720
    2    HA   LYS 100           HA       LYS 100  16.737  22.462   9.856
    3    HB2  LYS 100           HB2      LYS 100  14.115  21.149   9.102
    4    HB3  LYS 100           HB3      LYS 100  14.401  22.889   9.005
    5    HG2  LYS 100           HG2      LYS 100  16.379  22.451   7.543
    6    HG3  LYS 100           HG3      LYS 100  15.979  20.731   7.567
    7    HD2  LYS 100           HD2      LYS 100  13.782  21.220   6.561
    8    HD3  LYS 100           HD3      LYS 100  14.165  22.942   6.545
    9    HE2  LYS 100           HE2      LYS 100  16.130  22.472   5.090
   10    HE3  LYS 100           HE3      LYS 100  15.678  20.763   5.062
   11    HZ1  LYS 100           HZ1      LYS 100  13.837  22.939   4.217
   12    HZ3  LYS 100           HZ2      LYS 100  13.666  21.267   3.960
   13    HZ2  LYS 100           HZ3      LYS 100  14.872  22.135   3.138

  No H/Q in entry =          13
  In of MODEL    3
    1    H    LEU 101           H        LEU 101  14.652  20.406  11.825
    2    HA   LEU 101           HA       LEU 101  13.468  22.470  13.394
    3    HB2  LEU 101           HB2      LEU 101  13.932  19.525  13.789
    4    HB3  LEU 101           HB3      LEU 101  13.386  20.506  15.146
    5    HG   LEU 101           HG       LEU 101  11.972  20.574  12.474
    6   HD12  LEU 101          HD11      LEU 101  10.323  19.002  13.746
    7   HD11  LEU 101          HD12      LEU 101  11.719  18.603  14.744
    8   HD13  LEU 101          HD13      LEU 101  11.758  18.291  13.008
    9   HD21  LEU 101          HD21      LEU 101  11.304  21.371  15.323
   10   HD23  LEU 101          HD22      LEU 101  10.047  21.132  14.111
   11   HD22  LEU 101          HD23      LEU 101  11.272  22.376  13.871

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LYS 102           H        LYS 102  16.620  21.885  12.965
    2    HA   LYS 102           HA       LYS 102  18.458  22.774  14.037
    3    HB2  LYS 102           HB2      LYS 102  16.631  24.278  15.162
    4    HB3  LYS 102           HB3      LYS 102  16.844  23.222  16.543
    5    HG2  LYS 102           HG2      LYS 102  18.723  25.244  15.370
    6    HG3  LYS 102           HG3      LYS 102  18.341  24.932  17.049
    7    HD2  LYS 102           HD2      LYS 102  20.025  23.027  15.373
    8    HD3  LYS 102           HD3      LYS 102  20.703  24.357  16.302
    9    HE2  LYS 102           HE2      LYS 102  20.323  21.809  17.279
   10    HE3  LYS 102           HE3      LYS 102  20.529  23.256  18.265
   11    HZ2  LYS 102           HZ1      LYS 102  18.569  21.959  18.885
   12    HZ1  LYS 102           HZ2      LYS 102  17.926  22.179  17.334
   13    HZ3  LYS 102           HZ3      LYS 102  18.144  23.514  18.356

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ALA 103           H        ALA 103  16.395  21.161  16.461
    2    HA   ALA 103           HA       ALA 103  18.129  19.969  18.123
    3    HB2  ALA 103           HB1      ALA 103  16.560  17.949  18.121
    4    HB1  ALA 103           HB2      ALA 103  15.660  18.792  16.860
    5    HB3  ALA 103           HB3      ALA 103  15.830  19.519  18.456
    6    H1   ALA   1           H3       ALA   1  -1.537  -7.167 -21.437
    7    H2   ALA   1           H2       ALA   1  -2.322  -8.606 -20.981
    8    H3   ALA   1           H1       ALA   1  -0.713  -8.646 -21.533
    9    HA   ALA   1           HA       ALA   1  -1.540  -9.128 -23.529
   10    HB1  ALA   1           HB1      ALA   1  -3.673  -9.860 -23.056
   11    HB2  ALA   1           HB2      ALA   1  -4.121  -8.355 -23.860
   12    HB3  ALA   1           HB3      ALA   1  -4.063  -8.429 -22.100

  No H/Q in entry =          12
  In of MODEL    3
    1    H    GLU   2           H        GLU   2  -2.376  -7.950 -25.523
    2    HA   GLU   2           HA       GLU   2  -0.989  -5.929 -26.405
    3    HB2  GLU   2           HB2      GLU   2  -3.996  -6.019 -26.728
    4    HB3  GLU   2           HB3      GLU   2  -2.879  -5.151 -27.778
    5    HG2  GLU   2           HG2      GLU   2  -2.361  -7.041 -28.926
    6    HG3  GLU   2           HG3      GLU   2  -2.059  -7.940 -27.445

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLU   3           H        GLU   3  -4.160  -4.692 -25.514
    2    HA   GLU   3           HA       GLU   3  -3.133  -2.126 -24.893
    3    HB2  GLU   3           HB2      GLU   3  -5.812  -3.459 -24.561
    4    HB3  GLU   3           HB3      GLU   3  -5.527  -1.840 -23.919
    5    HG2  GLU   3           HG2      GLU   3  -5.173  -0.917 -26.047
    6    HG3  GLU   3           HG3      GLU   3  -4.766  -2.472 -26.766

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LEU   4           H        LEU   4  -4.710  -4.490 -22.708
    2    HA   LEU   4           HA       LEU   4  -4.359  -3.251 -20.320
    3    HB2  LEU   4           HB2      LEU   4  -3.794  -6.190 -20.780
    4    HB3  LEU   4           HB3      LEU   4  -4.208  -5.442 -19.239
    5    HG   LEU   4           HG       LEU   4  -5.976  -5.536 -21.706
    6   HD13  LEU   4          HD11      LEU   4  -7.159  -7.258 -20.705
    7   HD12  LEU   4          HD12      LEU   4  -6.680  -6.790 -19.074
    8   HD11  LEU   4          HD13      LEU   4  -5.536  -7.629 -20.121
    9   HD23  LEU   4          HD21      LEU   4  -7.669  -4.730 -19.843
   10   HD22  LEU   4          HD22      LEU   4  -6.638  -3.555 -20.656
   11   HD21  LEU   4          HD23      LEU   4  -6.210  -4.137 -19.048

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLU   5           H        GLU   5  -1.845  -5.082 -22.041
    2    HA   GLU   5           HA       GLU   5   0.133  -4.778 -20.002
    3    HB2  GLU   5           HB2      GLU   5   0.211  -6.552 -21.751
    4    HB3  GLU   5           HB3      GLU   5   0.524  -5.308 -22.961
    5    HG2  GLU   5           HG2      GLU   5   2.578  -4.654 -21.780
    6    HG3  GLU   5           HG3      GLU   5   2.266  -5.868 -20.541

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLU   6           H        GLU   6  -0.509  -3.079 -23.053
    2    HA   GLU   6           HA       GLU   6   1.648  -1.231 -22.787
    3    HB2  GLU   6           HB2      GLU   6  -0.912  -1.153 -24.399
    4    HB3  GLU   6           HB3      GLU   6   0.348   0.076 -24.510
    5    HG2  GLU   6           HG2      GLU   6   0.778  -2.885 -24.992
    6    HG3  GLU   6           HG3      GLU   6   0.578  -1.681 -26.263

  No H/Q in entry =           6
  In of MODEL    3
    1    H    VAL   7           H        VAL   7  -1.692  -1.322 -21.748
    2    HA   VAL   7           HA       VAL   7  -1.933   1.391 -20.920
    3    HB   VAL   7           HB       VAL   7  -3.380  -1.134 -20.079
    4   HG11  VAL   7          HG11      VAL   7  -3.776   1.755 -19.274
    5   HG13  VAL   7          HG12      VAL   7  -3.669   0.334 -18.234
    6   HG12  VAL   7          HG13      VAL   7  -5.101   0.590 -19.230
    7   HG21  VAL   7          HG21      VAL   7  -3.540  -0.066 -22.470
    8   HG23  VAL   7          HG22      VAL   7  -4.495   1.178 -21.664
    9   HG22  VAL   7          HG23      VAL   7  -5.029  -0.503 -21.633

  No H/Q in entry =           9
  In of MODEL    3
    1    H    VAL   8           H        VAL   8  -0.928  -1.582 -19.266
    2    HA   VAL   8           HA       VAL   8  -0.622  -0.492 -16.673
    3    HB   VAL   8           HB       VAL   8   0.786  -2.807 -18.026
    4   HG12  VAL   8          HG11      VAL   8   1.183  -3.435 -15.531
    5   HG11  VAL   8          HG12      VAL   8   0.916  -1.720 -15.216
    6   HG13  VAL   8          HG13      VAL   8   2.239  -2.229 -16.265
    7   HG21  VAL   8          HG21      VAL   8  -1.868  -2.563 -17.226
    8   HG23  VAL   8          HG22      VAL   8  -1.112  -3.289 -15.812
    9   HG22  VAL   8          HG23      VAL   8  -1.005  -4.093 -17.374

  No H/Q in entry =           9
  In of MODEL    3
    1    H    MET   9           H        MET   9   1.634  -0.786 -19.416
    2    HA   MET   9           HA       MET   9   3.911   0.276 -18.154
    3    HB2  MET   9           HB2      MET   9   2.968   0.294 -21.020
    4    HB3  MET   9           HB3      MET   9   4.480   1.063 -20.540
    5    HG2  MET   9           HG2      MET   9   5.252  -1.075 -19.562
    6    HG3  MET   9           HG3      MET   9   3.745  -1.842 -20.068
    7    HE1  MET   9           HE1      MET   9   6.570   0.240 -20.858
    8    HE3  MET   9           HE2      MET   9   6.196   0.717 -22.512
    9    HE2  MET   9           HE3      MET   9   7.397  -0.536 -22.214

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLY  10           H        GLY  10   1.219   1.856 -19.841
    2    HA3  GLY  10           HA2      GLY  10   2.165   4.516 -19.603
    3    HA2  GLY  10           HA3      GLY  10   0.479   4.045 -19.809

  No H/Q in entry =           3
  In of MODEL    3
    1    H    LEU  11           H        LEU  11   0.086   2.522 -17.519
    2    HA   LEU  11           HA       LEU  11  -0.459   4.502 -15.566
    3    HB2  LEU  11           HB2      LEU  11  -0.374   1.487 -15.400
    4    HB3  LEU  11           HB3      LEU  11  -0.891   2.511 -14.062
    5    HG   LEU  11           HG       LEU  11  -2.126   2.609 -16.827
    6   HD13  LEU  11          HD11      LEU  11  -2.699   0.464 -16.066
    7   HD12  LEU  11          HD12      LEU  11  -4.056   1.450 -15.525
    8   HD11  LEU  11          HD13      LEU  11  -2.798   0.980 -14.382
    9   HD22  LEU  11          HD21      LEU  11  -2.731   4.624 -15.827
   10   HD21  LEU  11          HD22      LEU  11  -2.654   3.963 -14.194
   11   HD23  LEU  11          HD23      LEU  11  -4.026   3.586 -15.237

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  12           H        ILE  12   2.099   2.049 -15.797
    2    HA   ILE  12           HA       ILE  12   3.298   2.601 -13.294
    3    HB   ILE  12           HB       ILE  12   4.563   1.562 -15.852
    4   HG12  ILE  12          HG12      ILE  12   2.553   0.324 -14.706
    5   HG13  ILE  12          HG13      ILE  12   3.954  -0.606 -15.195
    6   HG22  ILE  12          HG21      ILE  12   6.243   0.551 -14.265
    7   HG21  ILE  12          HG22      ILE  12   5.530   1.518 -12.974
    8   HG23  ILE  12          HG23      ILE  12   6.303   2.312 -14.345
    9   HD12  ILE  12          HD11      ILE  12   3.108  -1.156 -12.906
   10   HD11  ILE  12          HD12      ILE  12   3.490   0.492 -12.410
   11   HD13  ILE  12          HD13      ILE  12   4.770  -0.593 -12.907

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  13           H        ILE  13   3.896   3.858 -16.554
    2    HA   ILE  13           HA       ILE  13   6.022   5.593 -15.832
    3    HB   ILE  13           HB       ILE  13   3.993   5.657 -18.079
    4   HG12  ILE  13          HG12      ILE  13   5.833   3.823 -17.796
    5   HG13  ILE  13          HG13      ILE  13   5.592   4.563 -19.375
    6   HG22  ILE  13          HG21      ILE  13   5.725   7.239 -19.159
    7   HG21  ILE  13          HG22      ILE  13   6.329   7.504 -17.527
    8   HG23  ILE  13          HG23      ILE  13   4.667   7.930 -17.929
    9   HD11  ILE  13          HD11      ILE  13   7.674   5.534 -17.383
   10   HD13  ILE  13          HD12      ILE  13   7.492   6.016 -19.066
   11   HD12  ILE  13          HD13      ILE  13   8.010   4.380 -18.674

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ASN  14           H        ASN  14   2.513   6.067 -16.105
    2    HA   ASN  14           HA       ASN  14   2.454   8.814 -15.476
    3    HB2  ASN  14           HB2      ASN  14   0.571   7.159 -16.304
    4    HB3  ASN  14           HB3      ASN  14   0.249   6.984 -14.583
    5   HD21  ASN  14          HD21      ASN  14  -1.775   8.125 -16.021
    6   HD22  ASN  14          HD22      ASN  14  -1.848   9.798 -15.758

  No H/Q in entry =           6
  In of MODEL    3
    1    H    SER  15           H        SER  15   2.174   5.942 -13.391
    2    HA   SER  15           HA       SER  15   1.857   7.318 -10.947
    3    HB2  SER  15           HB2      SER  15   2.413   5.238  -9.891
    4    HB3  SER  15           HB3      SER  15   1.594   4.808 -11.389
    5    HG   SER  15           HG       SER  15   3.346   3.688 -11.714

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLY  16           H        GLY  16   4.740   6.233 -12.700
    2    HA3  GLY  16           HA2      GLY  16   6.659   7.007 -10.770
    3    HA2  GLY  16           HA3      GLY  16   6.965   6.801 -12.493

  No H/Q in entry =           3
  In of MODEL    3
    1    H    GLN  17           H        GLN  17   5.265   8.745 -13.563
    2    HA   GLN  17           HA       GLN  17   6.827  11.098 -13.261
    3    HB2  GLN  17           HB2      GLN  17   5.528  10.626 -15.306
    4    HB3  GLN  17           HB3      GLN  17   4.029  10.791 -14.393
    5    HG2  GLN  17           HG2      GLN  17   4.507  13.120 -13.913
    6    HG3  GLN  17           HG3      GLN  17   6.101  12.984 -14.656
    7   HE21  GLN  17          HE21      GLN  17   4.240  14.900 -15.631
    8   HE22  GLN  17          HE22      GLN  17   3.733  14.426 -17.181

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ALA  18           H        ALA  18   3.732  10.063 -11.911
    2    HA   ALA  18           HA       ALA  18   2.989  12.451 -10.653
    3    HB1  ALA  18           HB1      ALA  18   1.877   9.986 -10.869
    4    HB2  ALA  18           HB2      ALA  18   1.319  11.206  -9.727
    5    HB3  ALA  18           HB3      ALA  18   2.417   9.932  -9.192

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ARG  19           H        ARG  19   4.881   9.705  -9.364
    2    HA   ARG  19           HA       ARG  19   5.403  10.874  -6.845
    3    HB2  ARG  19           HB2      ARG  19   5.834   8.472  -7.364
    4    HB3  ARG  19           HB3      ARG  19   7.188   8.965  -8.386
    5    HG2  ARG  19           HG2      ARG  19   8.298  10.018  -6.465
    6    HG3  ARG  19           HG3      ARG  19   6.924   9.624  -5.434
    7    HD2  ARG  19           HD2      ARG  19   8.697   8.002  -5.069
    8    HD3  ARG  19           HD3      ARG  19   7.330   7.208  -5.854
    9    HE   ARG  19           HE       ARG  19   9.030   8.033  -7.902
   10   HH21  ARG  19          HH11      ARG  19  10.602   6.637  -8.747
   11   HH22  ARG  19          HH12      ARG  19  11.156   5.295  -7.806
   12   HH11  ARG  19          HH21      ARG  19   9.114   6.011  -5.118
   13   HH12  ARG  19          HH22      ARG  19  10.311   4.941  -5.751

  No H/Q in entry =          13
  In of MODEL    3
    1    H    SER  20           H        SER  20   7.223  10.908  -9.892
    2    HA   SER  20           HA       SER  20   9.456  12.343  -9.070
    3    HB2  SER  20           HB2      SER  20   9.245  11.344 -11.315
    4    HB3  SER  20           HB3      SER  20   8.025  12.543 -11.729
    5    HG   SER  20           HG       SER  20  10.773  12.781 -11.489

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU  21           H        LEU  21   6.349  13.584 -10.274
    2    HA   LEU  21           HA       LEU  21   6.998  16.336 -10.058
    3    HB2  LEU  21           HB2      LEU  21   4.342  14.887  -9.981
    4    HB3  LEU  21           HB3      LEU  21   4.491  16.643  -9.980
    5    HG   LEU  21           HG       LEU  21   5.709  14.866 -12.115
    6   HD11  LEU  21          HD11      LEU  21   3.040  16.295 -12.007
    7   HD13  LEU  21          HD12      LEU  21   3.334  14.575 -12.273
    8   HD12  LEU  21          HD13      LEU  21   3.778  15.747 -13.513
    9   HD22  LEU  21          HD21      LEU  21   6.831  16.920 -12.266
   10   HD21  LEU  21          HD22      LEU  21   5.442  17.851 -11.711
   11   HD23  LEU  21          HD23      LEU  21   5.470  17.207 -13.346

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ALA  22           H        ALA  22   5.502  14.041  -7.804
    2    HA   ALA  22           HA       ALA  22   4.882  15.850  -5.743
    3    HB3  ALA  22           HB1      ALA  22   4.141  13.451  -5.900
    4    HB2  ALA  22           HB2      ALA  22   4.723  13.932  -4.306
    5    HB1  ALA  22           HB3      ALA  22   5.756  12.979  -5.373

  No H/Q in entry =           5
  In of MODEL    3
    1    H    TYR  23           H        TYR  23   7.833  13.848  -6.173
    2    HA   TYR  23           HA       TYR  23   9.205  14.886  -3.922
    3    HB2  TYR  23           HB2      TYR  23  10.010  12.881  -5.073
    4    HB3  TYR  23           HB3      TYR  23  10.317  13.818  -6.535
    5    HD1  TYR  23           HD1      TYR  23  11.271  13.522  -2.935
    6    HD2  TYR  23           HD2      TYR  23  12.352  14.984  -6.828
    7    HE1  TYR  23           HE1      TYR  23  13.523  14.121  -2.086
    8    HE2  TYR  23           HE2      TYR  23  14.602  15.585  -5.978
    9    HH   TYR  23           HH       TYR  23  15.508  14.966  -2.581

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ALA  24           H        ALA  24   9.016  15.981  -7.292
    2    HA   ALA  24           HA       ALA  24  10.892  18.084  -7.050
    3    HB2  ALA  24           HB1      ALA  24  10.451  18.135  -9.259
    4    HB3  ALA  24           HB2      ALA  24   8.889  18.872  -8.904
    5    HB1  ALA  24           HB3      ALA  24   9.030  17.119  -9.028

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA  25           H        ALA  25   7.414  17.869  -6.432
    2    HA   ALA  25           HA       ALA  25   6.908  20.584  -5.872
    3    HB1  ALA  25           HB1      ALA  25   5.266  18.569  -6.068
    4    HB2  ALA  25           HB2      ALA  25   4.885  19.858  -4.924
    5    HB3  ALA  25           HB3      ALA  25   5.588  18.345  -4.348

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU  26           H        LEU  26   8.000  17.921  -3.812
    2    HA   LEU  26           HA       LEU  26   8.089  19.361  -1.380
    3    HB2  LEU  26           HB2      LEU  26   8.208  16.946  -1.366
    4    HB3  LEU  26           HB3      LEU  26   9.679  16.965  -2.336
    5    HG   LEU  26           HG       LEU  26  10.881  18.101  -0.498
    6   HD12  LEU  26          HD11      LEU  26   9.652  18.103   1.761
    7   HD11  LEU  26          HD12      LEU  26   8.167  17.948   0.825
    8   HD13  LEU  26          HD13      LEU  26   9.197  19.363   0.613
    9   HD21  LEU  26          HD21      LEU  26   9.371  15.620   0.382
   10   HD23  LEU  26          HD22      LEU  26  10.880  16.200   1.079
   11   HD22  LEU  26          HD23      LEU  26  10.842  15.636  -0.590

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LYS  27           H        LYS  27  10.514  18.805  -3.900
    2    HA   LYS  27           HA       LYS  27  12.683  20.072  -2.674
    3    HB2  LYS  27           HB2      LYS  27  12.801  18.720  -4.760
    4    HB3  LYS  27           HB3      LYS  27  12.023  20.041  -5.630
    5    HG2  LYS  27           HG2      LYS  27  13.872  21.547  -5.056
    6    HG3  LYS  27           HG3      LYS  27  14.645  20.266  -4.114
    7    HD2  LYS  27           HD2      LYS  27  14.805  18.874  -6.163
    8    HD3  LYS  27           HD3      LYS  27  14.077  20.181  -7.097
    9    HE2  LYS  27           HE2      LYS  27  15.948  21.669  -6.487
   10    HE3  LYS  27           HE3      LYS  27  16.680  20.366  -5.545
   11    HZ3  LYS  27           HZ1      LYS  27  17.671  20.469  -7.731
   12    HZ2  LYS  27           HZ2      LYS  27  16.146  20.332  -8.472
   13    HZ1  LYS  27           HZ3      LYS  27  16.782  19.031  -7.583

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLN  28           H        GLN  28  10.048  21.420  -4.630
    2    HA   GLN  28           HA       GLN  28  10.979  24.082  -4.791
    3    HB2  GLN  28           HB2      GLN  28   8.159  22.978  -4.680
    4    HB3  GLN  28           HB3      GLN  28   8.551  24.656  -5.055
    5    HG2  GLN  28           HG2      GLN  28   9.581  22.257  -6.597
    6    HG3  GLN  28           HG3      GLN  28   8.232  23.271  -7.104
    7   HE21  GLN  28          HE21      GLN  28  11.378  22.823  -7.832
    8   HE22  GLN  28          HE22      GLN  28  11.840  24.413  -8.202

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ALA  29           H        ALA  29   9.063  22.377  -2.351
    2    HA   ALA  29           HA       ALA  29   8.489  24.568  -0.677
    3    HB2  ALA  29           HB1      ALA  29   7.775  22.997   0.896
    4    HB1  ALA  29           HB2      ALA  29   9.010  21.824   0.436
    5    HB3  ALA  29           HB3      ALA  29   7.622  22.099  -0.614

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LYS  30           H        LYS  30  11.244  22.331  -0.736
    2    HA   LYS  30           HA       LYS  30  12.549  23.307   1.565
    3    HB2  LYS  30           HB2      LYS  30  13.662  22.025  -0.941
    4    HB3  LYS  30           HB3      LYS  30  14.639  22.400   0.481
    5    HG2  LYS  30           HG2      LYS  30  13.100  21.004   1.863
    6    HG3  LYS  30           HG3      LYS  30  12.221  20.568   0.394
    7    HD2  LYS  30           HD2      LYS  30  14.278  19.601  -0.562
    8    HD3  LYS  30           HD3      LYS  30  15.176  20.052   0.889
    9    HE2  LYS  30           HE2      LYS  30  13.686  18.608   2.247
   10    HE3  LYS  30           HE3      LYS  30  12.818  18.138   0.780
   11    HZ2  LYS  30           HZ1      LYS  30  14.627  16.583   1.548
   12    HZ1  LYS  30           HZ2      LYS  30  15.751  17.781   1.093
   13    HZ3  LYS  30           HZ3      LYS  30  14.724  17.082  -0.070

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLN  31           H        GLN  31  12.429  24.500  -1.736
    2    HA   GLN  31           HA       GLN  31  14.560  26.418  -1.319
    3    HB2  GLN  31           HB2      GLN  31  12.519  26.435  -3.546
    4    HB3  GLN  31           HB3      GLN  31  14.131  27.149  -3.548
    5    HG2  GLN  31           HG2      GLN  31  14.623  24.460  -2.963
    6    HG3  GLN  31           HG3      GLN  31  13.321  24.387  -4.142
    7   HE21  GLN  31          HE21      GLN  31  16.173  23.625  -4.541
    8   HE22  GLN  31          HE22      GLN  31  16.735  24.600  -5.810

  No H/Q in entry =           8
  In of MODEL    3
    1    H    GLY  32           H        GLY  32  11.487  26.205  -0.176
    2    HA3  GLY  32           HA2      GLY  32  10.312  27.764   1.091
    3    HA2  GLY  32           HA3      GLY  32  11.424  29.011   0.538

  No H/Q in entry =           3
  In of MODEL    3
    1    H    ASP  33           H        ASP  33  10.083  27.083  -1.949
    2    HA   ASP  33           HA       ASP  33   8.394  29.334  -2.813
    3    HB2  ASP  33           HB2      ASP  33   9.516  26.923  -4.247
    4    HB3  ASP  33           HB3      ASP  33   8.353  28.023  -4.982

  No H/Q in entry =           4
  In of MODEL    3
    1    H    PHE  34           H        PHE  34   6.710  28.845  -1.249
    2    HA   PHE  34           HA       PHE  34   5.358  26.357  -1.147
    3    HB2  PHE  34           HB2      PHE  34   4.366  29.136  -0.477
    4    HB3  PHE  34           HB3      PHE  34   3.533  27.637  -0.061
    5    HD1  PHE  34           HD1      PHE  34   5.755  30.065   1.147
    6    HD2  PHE  34           HD2      PHE  34   5.123  25.816   1.107
    7    HE1  PHE  34           HE1      PHE  34   7.147  29.837   3.186
    8    HE2  PHE  34           HE2      PHE  34   6.517  25.592   3.144
    9    HZ   PHE  34           HZ       PHE  34   7.523  27.603   4.182

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ALA  35           H        ALA  35   4.897  29.209  -3.167
    2    HA   ALA  35           HA       ALA  35   2.354  28.563  -4.192
    3    HB3  ALA  35           HB1      ALA  35   3.391  29.960  -6.234
    4    HB2  ALA  35           HB2      ALA  35   4.604  30.339  -5.010
    5    HB1  ALA  35           HB3      ALA  35   2.909  30.730  -4.722

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA  36           H        ALA  36   5.591  27.922  -5.542
    2    HA   ALA  36           HA       ALA  36   4.620  26.474  -7.781
    3    HB3  ALA  36           HB1      ALA  36   6.778  26.621  -8.396
    4    HB2  ALA  36           HB2      ALA  36   7.270  25.602  -7.042
    5    HB1  ALA  36           HB3      ALA  36   7.144  27.350  -6.832

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA  37           H        ALA  37   5.585  25.501  -4.523
    2    HA   ALA  37           HA       ALA  37   5.558  22.711  -4.942
    3    HB2  ALA  37           HB1      ALA  37   5.275  24.507  -2.570
    4    HB1  ALA  37           HB2      ALA  37   6.423  23.201  -2.857
    5    HB3  ALA  37           HB3      ALA  37   4.766  22.830  -2.386

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LYS  38           H        LYS  38   2.999  24.894  -3.784
    2    HA   LYS  38           HA       LYS  38   0.921  23.058  -3.556
    3    HB2  LYS  38           HB2      LYS  38   1.241  25.818  -3.314
    4    HB3  LYS  38           HB3      LYS  38   0.044  25.653  -4.594
    5    HG2  LYS  38           HG2      LYS  38  -1.391  24.318  -3.148
    6    HG3  LYS  38           HG3      LYS  38  -0.148  24.276  -1.890
    7    HD2  LYS  38           HD2      LYS  38  -0.361  26.612  -1.451
    8    HD3  LYS  38           HD3      LYS  38  -1.275  26.886  -2.935
    9    HE2  LYS  38           HE2      LYS  38  -2.780  26.909  -0.996
   10    HE3  LYS  38           HE3      LYS  38  -3.137  25.525  -2.034
   11    HZ3  LYS  38           HZ1      LYS  38  -2.396  24.068  -0.496
   12    HZ2  LYS  38           HZ2      LYS  38  -2.762  25.325   0.589
   13    HZ1  LYS  38           HZ3      LYS  38  -1.164  25.090   0.066

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ALA  39           H        ALA  39   1.881  24.962  -6.411
    2    HA   ALA  39           HA       ALA  39  -0.184  24.065  -8.112
    3    HB2  ALA  39           HB1      ALA  39   2.546  24.741  -9.166
    4    HB1  ALA  39           HB2      ALA  39   1.564  25.994  -8.406
    5    HB3  ALA  39           HB3      ALA  39   0.963  25.145  -9.830

  No H/Q in entry =           5
  In of MODEL    3
    1    H    MET  40           H        MET  40   3.069  22.806  -7.526
    2    HA   MET  40           HA       MET  40   2.996  20.778  -9.511
    3    HB2  MET  40           HB2      MET  40   4.603  21.029  -6.962
    4    HB3  MET  40           HB3      MET  40   4.869  19.771  -8.172
    5    HG2  MET  40           HG2      MET  40   4.893  22.726  -8.847
    6    HG3  MET  40           HG3      MET  40   6.349  21.842  -8.394
    7    HE3  MET  40           HE1      MET  40   7.249  19.627 -11.194
    8    HE2  MET  40           HE2      MET  40   6.688  19.307  -9.556
    9    HE1  MET  40           HE3      MET  40   7.768  20.666  -9.860

  No H/Q in entry =           9
  In of MODEL    3
    1    H    MET  41           H        MET  41   2.078  20.821  -6.088
    2    HA   MET  41           HA       MET  41   1.578  18.051  -5.801
    3    HB2  MET  41           HB2      MET  41   0.216  20.397  -4.459
    4    HB3  MET  41           HB3      MET  41   0.080  18.719  -3.946
    5    HG2  MET  41           HG2      MET  41   2.788  18.974  -3.982
    6    HG3  MET  41           HG3      MET  41   2.327  20.628  -3.592
    7    HE2  MET  41           HE1      MET  41  -0.699  19.345  -1.864
    8    HE1  MET  41           HE2      MET  41   0.100  20.867  -2.246
    9    HE3  MET  41           HE3      MET  41   0.047  20.301  -0.576

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ASP  42           H        ASP  42  -0.492  20.748  -6.786
    2    HA   ASP  42           HA       ASP  42  -2.916  19.358  -6.920
    3    HB2  ASP  42           HB2      ASP  42  -2.240  21.936  -7.184
    4    HB3  ASP  42           HB3      ASP  42  -2.385  21.533  -8.892

  No H/Q in entry =           4
  In of MODEL    3
    1    H    GLN  43           H        GLN  43  -0.481  19.970  -9.422
    2    HA   GLN  43           HA       GLN  43  -1.850  18.627 -11.508
    3    HB2  GLN  43           HB2      GLN  43   1.101  19.180 -11.125
    4    HB3  GLN  43           HB3      GLN  43   0.397  18.527 -12.606
    5    HG2  GLN  43           HG2      GLN  43  -1.139  20.535 -12.655
    6    HG3  GLN  43           HG3      GLN  43  -0.195  21.207 -11.329
    7   HE21  GLN  43          HE21      GLN  43  -0.052  22.822 -13.421
    8   HE22  GLN  43          HE22      GLN  43   1.366  22.615 -14.326

  No H/Q in entry =           8
  In of MODEL    3
    1    H    SER  44           H        SER  44   0.512  17.523  -9.112
    2    HA   SER  44           HA       SER  44   0.879  14.917 -10.128
    3    HB2  SER  44           HB2      SER  44   1.755  16.374  -7.896
    4    HB3  SER  44           HB3      SER  44   0.909  14.983  -7.221
    5    HG   SER  44           HG       SER  44   3.028  14.387  -7.644

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ARG  45           H        ARG  45  -1.458  16.215  -7.796
    2    HA   ARG  45           HA       ARG  45  -2.816  13.839  -7.154
    3    HB2  ARG  45           HB2      ARG  45  -3.042  16.009  -5.970
    4    HB3  ARG  45           HB3      ARG  45  -3.905  16.661  -7.360
    5    HG2  ARG  45           HG2      ARG  45  -5.650  14.914  -7.072
    6    HG3  ARG  45           HG3      ARG  45  -4.799  14.317  -5.646
    7    HD2  ARG  45           HD2      ARG  45  -5.035  16.585  -4.598
    8    HD3  ARG  45           HD3      ARG  45  -6.027  17.088  -5.983
    9    HE   ARG  45           HE       ARG  45  -7.108  14.701  -4.936
   10   HH21  ARG  45          HH11      ARG  45  -8.946  14.758  -3.667
   11   HH22  ARG  45          HH12      ARG  45  -9.360  16.196  -2.803
   12   HH11  ARG  45          HH21      ARG  45  -6.604  17.958  -3.922
   13   HH12  ARG  45          HH22      ARG  45  -8.029  18.008  -2.946

  No H/Q in entry =          13
  In of MODEL    3
    1    H    MET  46           H        MET  46  -3.428  16.228  -9.713
    2    HA   MET  46           HA       MET  46  -5.752  15.023 -10.773
    3    HB2  MET  46           HB2      MET  46  -3.673  16.873 -11.949
    4    HB3  MET  46           HB3      MET  46  -5.043  16.294 -12.901
    5    HG2  MET  46           HG2      MET  46  -6.609  17.214 -11.266
    6    HG3  MET  46           HG3      MET  46  -5.276  17.722 -10.235
    7    HE2  MET  46           HE1      MET  46  -7.018  19.362 -13.992
    8    HE1  MET  46           HE2      MET  46  -6.882  17.682 -13.480
    9    HE3  MET  46           HE3      MET  46  -5.608  18.402 -14.463

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ALA  47           H        ALA  47  -2.316  14.584 -11.527
    2    HA   ALA  47           HA       ALA  47  -2.637  12.845 -13.731
    3    HB3  ALA  47           HB1      ALA  47  -0.472  13.764 -13.381
    4    HB2  ALA  47           HB2      ALA  47  -0.309  12.039 -13.041
    5    HB1  ALA  47           HB3      ALA  47  -0.418  13.194 -11.712

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU  48           H        LEU  48  -2.363  12.225 -10.255
    2    HA   LEU  48           HA       LEU  48  -2.420   9.383 -10.404
    3    HB2  LEU  48           HB2      LEU  48  -3.211  11.299  -8.198
    4    HB3  LEU  48           HB3      LEU  48  -3.095   9.550  -7.991
    5    HG   LEU  48           HG       LEU  48  -0.817  11.276  -8.992
    6   HD13  LEU  48          HD11      LEU  48  -1.112  12.049  -6.804
    7   HD12  LEU  48          HD12      LEU  48   0.068  10.758  -6.600
    8   HD11  LEU  48          HD13      LEU  48  -1.627  10.474  -6.203
    9   HD22  LEU  48          HD21      LEU  48  -0.290   9.095  -9.625
   10   HD21  LEU  48          HD22      LEU  48  -1.151   8.373  -8.267
   11   HD23  LEU  48          HD23      LEU  48   0.411   9.147  -8.008

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ASN  49           H        ASN  49  -4.916  11.845 -10.013
    2    HA   ASN  49           HA       ASN  49  -7.081  10.154  -9.470
    3    HB2  ASN  49           HB2      ASN  49  -7.163  12.579  -9.158
    4    HB3  ASN  49           HB3      ASN  49  -7.016  12.832 -10.892
    5   HD21  ASN  49          HD21      ASN  49  -9.070  13.809 -11.215
    6   HD22  ASN  49          HD22      ASN  49 -10.531  12.989 -10.959

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLU  50           H        GLU  50  -5.814  11.357 -12.560
    2    HA   GLU  50           HA       GLU  50  -7.750  10.071 -14.204
    3    HB2  GLU  50           HB2      GLU  50  -6.307  11.906 -15.023
    4    HB3  GLU  50           HB3      GLU  50  -4.899  10.852 -14.880
    5    HG2  GLU  50           HG2      GLU  50  -5.851   9.299 -16.512
    6    HG3  GLU  50           HG3      GLU  50  -7.324  10.258 -16.604

  No H/Q in entry =           6
  In of MODEL    3
    1    H    ALA  51           H        ALA  51  -4.568   9.124 -12.992
    2    HA   ALA  51           HA       ALA  51  -4.395   6.668 -14.401
    3    HB2  ALA  51           HB1      ALA  51  -2.412   6.409 -13.298
    4    HB1  ALA  51           HB2      ALA  51  -3.107   6.828 -11.733
    5    HB3  ALA  51           HB3      ALA  51  -2.667   8.101 -12.871

  No H/Q in entry =           5
  In of MODEL    3
    1    H    HIS  52           H        HIS  52  -5.582   7.495 -11.156
    2    HA   HIS  52           HA       HIS  52  -6.235   4.880 -10.317
    3    HB2  HIS  52           HB2      HIS  52  -6.122   6.858  -8.819
    4    HB3  HIS  52           HB3      HIS  52  -7.598   7.474  -9.562
    5    HD1  HIS  52           HD1      HIS  52  -9.802   6.065  -9.179
    6    HD2  HIS  52           HD2      HIS  52  -6.518   4.793  -6.949
    7    HE1  HIS  52           HE1      HIS  52 -10.707   4.519  -7.389
    8    HE2  HIS  52           HE2      HIS  52  -8.717   3.735  -6.020

  No H/Q in entry =           8
  In of MODEL    3
    1    H    LEU  53           H        LEU  53  -8.084   7.308 -12.115
    2    HA   LEU  53           HA       LEU  53 -10.573   5.985 -12.126
    3    HB2  LEU  53           HB2      LEU  53  -9.312   7.976 -13.999
    4    HB3  LEU  53           HB3      LEU  53 -10.901   7.289 -14.324
    5    HG   LEU  53           HG       LEU  53 -10.208   8.626 -11.688
    6   HD11  LEU  53          HD11      LEU  53  -9.963  10.200 -13.620
    7   HD13  LEU  53          HD12      LEU  53 -11.284  10.635 -12.535
    8   HD12  LEU  53          HD13      LEU  53 -11.626   9.847 -14.071
    9   HD23  LEU  53          HD21      LEU  53 -12.809   8.970 -11.845
   10   HD22  LEU  53          HD22      LEU  53 -12.184   7.402 -11.353
   11   HD21  LEU  53          HD23      LEU  53 -12.750   7.641 -12.994

  No H/Q in entry =          11
  In of MODEL    3
    1    H    VAL  54           H        VAL  54  -7.818   5.814 -14.359
    2    HA   VAL  54           HA       VAL  54  -9.016   4.022 -16.198
    3    HB   VAL  54           HB       VAL  54  -6.116   4.567 -15.514
    4   HG12  VAL  54          HG11      VAL  54  -5.852   3.477 -17.899
    5   HG11  VAL  54          HG12      VAL  54  -7.371   2.679 -17.495
    6   HG13  VAL  54          HG13      VAL  54  -5.954   2.445 -16.473
    7   HG22  VAL  54          HG21      VAL  54  -6.908   6.497 -16.566
    8   HG21  VAL  54          HG22      VAL  54  -8.089   5.616 -17.533
    9   HG23  VAL  54          HG23      VAL  54  -6.381   5.555 -17.961

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLN  55           H        GLN  55  -7.014   3.510 -13.294
    2    HA   GLN  55           HA       GLN  55  -6.890   0.694 -13.541
    3    HB2  GLN  55           HB2      GLN  55  -5.347   1.614 -12.023
    4    HB3  GLN  55           HB3      GLN  55  -6.577   2.568 -11.198
    5    HG2  GLN  55           HG2      GLN  55  -7.245   0.807  -9.875
    6    HG3  GLN  55           HG3      GLN  55  -7.005  -0.381 -11.149
    7   HE21  GLN  55          HE21      GLN  55  -5.364  -1.810 -10.648
    8   HE22  GLN  55          HE22      GLN  55  -3.985  -1.438  -9.735

  No H/Q in entry =           8
  In of MODEL    3
    1    H    THR  56           H        THR  56  -9.249   2.834 -11.937
    2    HA   THR  56           HA       THR  56 -10.812   0.936 -10.643
    3    HB   THR  56           HB       THR  56 -11.935   3.305 -12.159
    4    HG1  THR  56           HG1      THR  56 -10.165   3.183 -10.114
    5   HG22  THR  56          HG21      THR  56 -13.501   3.294 -10.172
    6   HG21  THR  56          HG22      THR  56 -12.795   1.743  -9.715
    7   HG23  THR  56          HG23      THR  56 -13.658   1.904 -11.245

  No H/Q in entry =           7
  In of MODEL    3
    1    H    LYS  57           H        LYS  57 -11.022   2.005 -14.033
    2    HA   LYS  57           HA       LYS  57 -13.157   0.289 -14.784
    3    HB2  LYS  57           HB2      LYS  57 -12.303   2.246 -16.107
    4    HB3  LYS  57           HB3      LYS  57 -10.852   1.323 -16.468
    5    HG2  LYS  57           HG2      LYS  57 -12.187  -0.376 -17.624
    6    HG3  LYS  57           HG3      LYS  57 -13.667   0.488 -17.225
    7    HD2  LYS  57           HD2      LYS  57 -12.875   2.437 -18.536
    8    HD3  LYS  57           HD3      LYS  57 -11.408   1.555 -18.956
    9    HE2  LYS  57           HE2      LYS  57 -12.766  -0.182 -20.079
   10    HE3  LYS  57           HE3      LYS  57 -14.242   0.687 -19.664
   11    HZ2  LYS  57           HZ1      LYS  57 -12.491   1.114 -21.827
   12    HZ1  LYS  57           HZ2      LYS  57 -12.542   2.515 -20.867
   13    HZ3  LYS  57           HZ3      LYS  57 -13.977   1.861 -21.498

  No H/Q in entry =          13
  In of MODEL    3
    1    H    LEU  58           H        LEU  58  -9.648  -0.100 -14.720
    2    HA   LEU  58           HA       LEU  58  -9.624  -2.621 -16.000
    3    HB2  LEU  58           HB2      LEU  58  -7.608  -1.299 -14.193
    4    HB3  LEU  58           HB3      LEU  58  -7.328  -2.820 -15.041
    5    HG   LEU  58           HG       LEU  58  -8.111  -0.230 -16.415
    6   HD11  LEU  58          HD11      LEU  58  -5.451  -1.433 -15.716
    7   HD13  LEU  58          HD12      LEU  58  -5.966   0.253 -15.674
    8   HD12  LEU  58          HD13      LEU  58  -5.615  -0.520 -17.217
    9   HD22  LEU  58          HD21      LEU  58  -8.665  -1.804 -18.002
   10   HD21  LEU  58          HD22      LEU  58  -7.610  -3.037 -17.314
   11   HD23  LEU  58          HD23      LEU  58  -6.933  -1.759 -18.323

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  59           H        ILE  59 -10.462  -1.717 -12.754
    2    HA   ILE  59           HA       ILE  59 -10.079  -4.476 -11.795
    3    HB   ILE  59           HB       ILE  59  -9.666  -2.197 -10.405
    4   HG12  ILE  59          HG12      ILE  59 -11.002  -4.565  -9.076
    5   HG13  ILE  59          HG13      ILE  59  -9.357  -4.620  -9.655
    6   HG22  ILE  59          HG21      ILE  59 -12.419  -2.953  -9.466
    7   HG21  ILE  59          HG22      ILE  59 -12.209  -1.710 -10.677
    8   HG23  ILE  59          HG23      ILE  59 -11.495  -1.521  -9.079
    9   HD13  ILE  59          HD11      ILE  59  -9.202  -4.007  -7.368
   10   HD12  ILE  59          HD12      ILE  59 -10.489  -2.820  -7.527
   11   HD11  ILE  59          HD13      ILE  59  -8.918  -2.524  -8.273

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLU  60           H        GLU  60 -12.663  -2.195 -12.616
    2    HA   GLU  60           HA       GLU  60 -14.831  -3.734 -11.601
    3    HB2  GLU  60           HB2      GLU  60 -15.076  -1.369 -12.203
    4    HB3  GLU  60           HB3      GLU  60 -14.740  -1.747 -13.890
    5    HG2  GLU  60           HG2      GLU  60 -16.755  -3.210 -13.937
    6    HG3  GLU  60           HG3      GLU  60 -17.111  -2.738 -12.288

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLY  61           H        GLY  61 -13.153  -3.710 -14.713
    2    HA3  GLY  61           HA2      GLY  61 -14.836  -5.979 -15.598
    3    HA2  GLY  61           HA3      GLY  61 -14.003  -4.868 -16.678

  No H/Q in entry =           3
  In of MODEL    3
    1    H    ASP  62           H        ASP  62 -12.615  -6.286 -13.786
    2    HA   ASP  62           HA       ASP  62 -10.369  -7.281 -15.283
    3    HB2  ASP  62           HB2      ASP  62  -9.613  -8.039 -13.012
    4    HB3  ASP  62           HB3      ASP  62  -9.985  -6.321 -13.107

  No H/Q in entry =           4
  In of MODEL    3
    1    H    ALA  63           H        ALA  63 -13.416  -8.587 -14.825
    2    HA   ALA  63           HA       ALA  63 -12.945 -11.300 -14.169
    3    HB2  ALA  63           HB1      ALA  63 -15.187 -10.078 -14.424
    4    HB3  ALA  63           HB2      ALA  63 -15.123 -11.705 -15.100
    5    HB1  ALA  63           HB3      ALA  63 -14.999 -10.301 -16.163

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLY  64           H        GLY  64 -12.847  -9.555 -17.229
    2    HA3  GLY  64           HA2      GLY  64 -12.083 -10.107 -19.318
    3    HA2  GLY  64           HA3      GLY  64 -10.882 -11.070 -18.470

  No H/Q in entry =           3
  In of MODEL    3
    1    H    GLU  65           H        GLU  65 -10.817 -13.031 -19.410
    2    HA   GLU  65           HA       GLU  65 -12.784 -14.200 -20.951
    3    HB2  GLU  65           HB2      GLU  65 -10.612 -15.508 -19.316
    4    HB3  GLU  65           HB3      GLU  65 -11.612 -16.371 -20.485
    5    HG2  GLU  65           HG2      GLU  65 -10.868 -14.878 -22.273
    6    HG3  GLU  65           HG3      GLU  65  -9.924 -13.935 -21.122

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLY  66           H        GLY  66 -13.312 -16.672 -20.201
    2    HA3  GLY  66           HA2      GLY  66 -15.651 -16.503 -18.660
    3    HA2  GLY  66           HA3      GLY  66 -14.872 -17.981 -19.191

  No H/Q in entry =           3
  In of MODEL    3
    1    H    LYS  67           H        LYS  67 -12.402 -17.475 -17.797
    2    HA   LYS  67           HA       LYS  67 -12.986 -18.751 -15.364
    3    HB2  LYS  67           HB2      LYS  67 -10.471 -17.467 -16.413
    4    HB3  LYS  67           HB3      LYS  67 -10.540 -18.399 -14.912
    5    HG2  LYS  67           HG2      LYS  67 -11.374 -20.353 -16.106
    6    HG3  LYS  67           HG3      LYS  67 -11.459 -19.436 -17.609
    7    HD2  LYS  67           HD2      LYS  67  -9.437 -20.659 -17.778
    8    HD3  LYS  67           HD3      LYS  67  -8.931 -19.037 -17.296
    9    HE2  LYS  67           HE2      LYS  67  -8.691 -19.707 -14.995
   10    HE3  LYS  67           HE3      LYS  67  -9.460 -21.264 -15.311
   11    HZ3  LYS  67           HZ1      LYS  67  -7.078 -21.512 -15.211
   12    HZ2  LYS  67           HZ2      LYS  67  -6.863 -20.331 -16.412
   13    HZ1  LYS  67           HZ3      LYS  67  -7.611 -21.808 -16.793

  No H/Q in entry =          13
  In of MODEL    3
    1    H    MET  68           H        MET  68 -12.776 -18.187 -13.269
    2    HA   MET  68           HA       MET  68 -13.860 -15.734 -12.452
    3    HB2  MET  68           HB2      MET  68 -12.389 -17.842 -10.869
    4    HB3  MET  68           HB3      MET  68 -13.342 -16.533 -10.168
    5    HG2  MET  68           HG2      MET  68 -14.412 -18.617 -12.094
    6    HG3  MET  68           HG3      MET  68 -14.647 -18.639 -10.345
    7    HE1  MET  68           HE1      MET  68 -15.408 -16.927  -9.044
    8    HE3  MET  68           HE2      MET  68 -16.892 -16.034  -9.370
    9    HE2  MET  68           HE3      MET  68 -15.331 -15.286  -9.704

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LYS  69           H        LYS  69 -10.448 -16.806 -12.436
    2    HA   LYS  69           HA       LYS  69  -9.307 -14.919 -10.830
    3    HB2  LYS  69           HB2      LYS  69  -8.251 -16.165 -13.364
    4    HB3  LYS  69           HB3      LYS  69  -7.251 -15.188 -12.288
    5    HG2  LYS  69           HG2      LYS  69  -7.809 -16.695 -10.406
    6    HG3  LYS  69           HG3      LYS  69  -8.793 -17.676 -11.491
    7    HD2  LYS  69           HD2      LYS  69  -6.802 -18.172 -12.858
    8    HD3  LYS  69           HD3      LYS  69  -5.814 -17.190 -11.776
    9    HE2  LYS  69           HE2      LYS  69  -6.392 -18.677  -9.893
   10    HE3  LYS  69           HE3      LYS  69  -7.382 -19.659 -10.971
   11    HZ2  LYS  69           HZ1      LYS  69  -4.544 -19.646 -10.615
   12    HZ1  LYS  69           HZ2      LYS  69  -4.985 -19.486 -12.248
   13    HZ3  LYS  69           HZ3      LYS  69  -5.535 -20.815 -11.342

  No H/Q in entry =          13
  In of MODEL    3
    1    H    VAL  70           H        VAL  70  -7.547 -13.247 -11.769
    2    HA   VAL  70           HA       VAL  70  -8.928 -11.341 -13.567
    3    HB   VAL  70           HB       VAL  70  -8.162  -9.517 -12.085
    4   HG11  VAL  70          HG11      VAL  70  -9.884 -11.692 -10.877
    5   HG13  VAL  70          HG12      VAL  70 -10.418 -10.258 -11.753
    6   HG12  VAL  70          HG13      VAL  70  -9.714 -10.097 -10.145
    7   HG23  VAL  70          HG21      VAL  70  -7.477 -10.315  -9.699
    8   HG22  VAL  70          HG22      VAL  70  -6.258 -10.380 -10.970
    9   HG21  VAL  70          HG23      VAL  70  -7.096 -11.850 -10.478

  No H/Q in entry =           9
  In of MODEL    3
    1    H    SER  71           H        SER  71  -7.401  -9.647 -14.363
    2    HA   SER  71           HA       SER  71  -5.146 -10.776 -15.636
    3    HB2  SER  71           HB2      SER  71  -6.389  -8.752 -16.437
    4    HB3  SER  71           HB3      SER  71  -5.689  -7.845 -15.099
    5    HG   SER  71           HG       SER  71  -4.628  -8.270 -17.444

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU  72           H        LEU  72  -3.105 -11.021 -15.001
    2    HA   LEU  72           HA       LEU  72  -2.393 -10.787 -12.289
    3    HB2  LEU  72           HB2      LEU  72  -0.730 -11.207 -14.768
    4    HB3  LEU  72           HB3      LEU  72  -0.069 -11.265 -13.137
    5    HG   LEU  72           HG       LEU  72  -2.396 -12.991 -14.048
    6   HD13  LEU  72          HD11      LEU  72  -0.485 -13.639 -15.371
    7   HD12  LEU  72          HD12      LEU  72  -0.644 -14.819 -14.072
    8   HD11  LEU  72          HD13      LEU  72   0.580 -13.554 -13.968
    9   HD21  LEU  72          HD21      LEU  72  -0.683 -12.815 -11.576
   10   HD23  LEU  72          HD22      LEU  72  -1.379 -14.365 -12.026
   11   HD22  LEU  72          HD23      LEU  72  -2.430 -12.991 -11.694

  No H/Q in entry =          11
  In of MODEL    3
    1    H    VAL  73           H        VAL  73  -1.695  -8.775 -15.077
    2    HA   VAL  73           HA       VAL  73   0.205  -7.050 -13.977
    3    HB   VAL  73           HB       VAL  73  -0.227  -5.625 -15.834
    4   HG11  VAL  73          HG11      VAL  73   0.700  -7.935 -16.279
    5   HG13  VAL  73          HG12      VAL  73  -0.099  -7.192 -17.663
    6   HG12  VAL  73          HG13      VAL  73  -0.931  -8.433 -16.727
    7   HG21  VAL  73          HG21      VAL  73  -2.941  -6.900 -15.711
    8   HG23  VAL  73          HG22      VAL  73  -2.349  -6.293 -17.255
    9   HG22  VAL  73          HG23      VAL  73  -2.517  -5.197 -15.884

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LEU  74           H        LEU  74  -3.192  -7.201 -13.425
    2    HA   LEU  74           HA       LEU  74  -3.841  -4.550 -12.825
    3    HB2  LEU  74           HB2      LEU  74  -5.551  -6.236 -12.995
    4    HB3  LEU  74           HB3      LEU  74  -4.852  -7.146 -11.658
    5    HG   LEU  74           HG       LEU  74  -5.343  -5.274 -10.123
    6   HD12  LEU  74          HD11      LEU  74  -6.954  -3.509 -11.112
    7   HD11  LEU  74          HD12      LEU  74  -6.333  -4.015 -12.683
    8   HD13  LEU  74          HD13      LEU  74  -5.238  -3.334 -11.479
    9   HD23  LEU  74          HD21      LEU  74  -7.895  -5.695 -11.579
   10   HD22  LEU  74          HD22      LEU  74  -7.511  -5.883  -9.883
   11   HD21  LEU  74          HD23      LEU  74  -7.034  -7.124 -11.015

  No H/Q in entry =          11
  In of MODEL    3
    1    H    VAL  75           H        VAL  75  -2.776  -7.116 -10.651
    2    HA   VAL  75           HA       VAL  75  -2.599  -5.552  -8.313
    3    HB   VAL  75           HB       VAL  75  -1.065  -8.031  -9.087
    4   HG12  VAL  75          HG11      VAL  75  -0.625  -8.171  -6.611
    5   HG11  VAL  75          HG12      VAL  75  -1.328  -6.571  -6.433
    6   HG13  VAL  75          HG13      VAL  75   0.152  -6.777  -7.352
    7   HG21  VAL  75          HG21      VAL  75  -3.654  -7.983  -8.824
    8   HG23  VAL  75          HG22      VAL  75  -3.332  -7.731  -7.108
    9   HG22  VAL  75          HG23      VAL  75  -2.761  -9.197  -7.908

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLU  76           H        GLU  76  -0.177  -6.296 -10.842
    2    HA   GLU  76           HA       GLU  76   1.992  -4.920  -9.686
    3    HB2  GLU  76           HB2      GLU  76   2.228  -6.398 -11.657
    4    HB3  GLU  76           HB3      GLU  76   1.288  -5.271 -12.623
    5    HG2  GLU  76           HG2      GLU  76   3.614  -4.886 -13.129
    6    HG3  GLU  76           HG3      GLU  76   3.069  -3.518 -12.178

  No H/Q in entry =           6
  In of MODEL    3
    1    H    ALA  77           H        ALA  77  -0.549  -3.756 -11.884
    2    HA   ALA  77           HA       ALA  77   0.411  -1.100 -12.069
    3    HB2  ALA  77           HB1      ALA  77  -1.981  -0.584 -12.731
    4    HB3  ALA  77           HB2      ALA  77  -2.355  -2.277 -12.410
    5    HB1  ALA  77           HB3      ALA  77  -1.202  -1.854 -13.674

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLN  78           H        GLN  78  -1.843  -2.672  -9.856
    2    HA   GLN  78           HA       GLN  78  -2.680  -0.357  -8.466
    3    HB2  GLN  78           HB2      GLN  78  -3.732  -2.664  -8.389
    4    HB3  GLN  78           HB3      GLN  78  -2.417  -3.147  -7.322
    5    HG2  GLN  78           HG2      GLN  78  -3.050  -1.425  -5.713
    6    HG3  GLN  78           HG3      GLN  78  -4.321  -0.851  -6.792
    7   HE21  GLN  78          HE21      GLN  78  -5.247  -3.481  -7.659
    8   HE22  GLN  78          HE22      GLN  78  -5.995  -4.211  -6.322

  No H/Q in entry =           8
  In of MODEL    3
    1    H    LEU  79           H        LEU  79   0.024  -2.579  -8.001
    2    HA   LEU  79           HA       LEU  79   0.984  -1.661  -5.546
    3    HB2  LEU  79           HB2      LEU  79   1.880  -3.664  -6.603
    4    HB3  LEU  79           HB3      LEU  79   2.518  -2.710  -7.939
    5    HG   LEU  79           HG       LEU  79   4.057  -1.546  -6.437
    6   HD13  LEU  79          HD11      LEU  79   3.045  -1.304  -4.373
    7   HD12  LEU  79          HD12      LEU  79   4.139  -2.639  -4.022
    8   HD11  LEU  79          HD13      LEU  79   2.438  -2.960  -4.354
    9   HD23  LEU  79          HD21      LEU  79   5.291  -3.675  -5.523
   10   HD22  LEU  79          HD22      LEU  79   5.089  -3.486  -7.262
   11   HD21  LEU  79          HD23      LEU  79   4.022  -4.565  -6.367

  No H/Q in entry =          11
  In of MODEL    3
    1    H    HIS  80           H        HIS  80   1.848  -0.547  -8.822
    2    HA   HIS  80           HA       HIS  80   3.629   1.466  -7.904
    3    HB2  HIS  80           HB2      HIS  80   2.354   0.745 -10.487
    4    HB3  HIS  80           HB3      HIS  80   2.928   2.405 -10.321
    5    HD1  HIS  80           HD1      HIS  80   5.326   2.734 -10.840
    6    HD2  HIS  80           HD2      HIS  80   4.553  -1.182  -9.634
    7    HE1  HIS  80           HE1      HIS  80   7.532   1.484 -10.996
    8    HE2  HIS  80           HE2      HIS  80   7.073  -0.906 -10.264

  No H/Q in entry =           8
  In of MODEL    3
    1    H    LEU  81           H        LEU  81   0.225   1.579  -8.892
    2    HA   LEU  81           HA       LEU  81  -0.086   4.369  -8.573
    3    HB2  LEU  81           HB2      LEU  81  -2.072   2.099  -8.489
    4    HB3  LEU  81           HB3      LEU  81  -2.546   3.796  -8.405
    5    HG   LEU  81           HG       LEU  81  -0.834   2.659 -10.633
    6   HD12  LEU  81          HD11      LEU  81  -3.067   2.944 -11.938
    7   HD11  LEU  81          HD12      LEU  81  -3.825   2.873 -10.348
    8   HD13  LEU  81          HD13      LEU  81  -2.863   1.515 -10.927
    9   HD23  LEU  81          HD21      LEU  81  -1.956   4.784 -11.741
   10   HD22  LEU  81          HD22      LEU  81  -0.544   4.978 -10.706
   11   HD21  LEU  81          HD23      LEU  81  -2.155   5.308 -10.070

  No H/Q in entry =          11
  In of MODEL    3
    1    H    MET  82           H        MET  82  -0.715   1.683  -6.315
    2    HA   MET  82           HA       MET  82  -1.793   3.264  -4.236
    3    HB2  MET  82           HB2      MET  82  -0.383   0.596  -4.262
    4    HB3  MET  82           HB3      MET  82  -0.975   1.319  -2.768
    5    HG2  MET  82           HG2      MET  82  -2.695   0.792  -5.211
    6    HG3  MET  82           HG3      MET  82  -2.606  -0.275  -3.811
    7    HE3  MET  82           HE1      MET  82  -4.357   1.363  -1.007
    8    HE2  MET  82           HE2      MET  82  -2.631   1.663  -1.189
    9    HE1  MET  82           HE3      MET  82  -3.297   0.095  -1.638

  No H/Q in entry =           9
  In of MODEL    3
    1    H    THR  83           H        THR  83   1.524   2.220  -4.914
    2    HA   THR  83           HA       THR  83   2.721   3.350  -2.615
    3    HB   THR  83           HB       THR  83   4.820   3.317  -4.084
    4    HG1  THR  83           HG1      THR  83   4.592   2.779  -6.107
    5   HG22  THR  83          HG21      THR  83   4.413   0.652  -4.406
    6   HG21  THR  83          HG22      THR  83   3.115   1.018  -3.271
    7   HG23  THR  83          HG23      THR  83   4.789   1.386  -2.849

  No H/Q in entry =           7
  In of MODEL    3
    1    H    SER  84           H        SER  84   2.341   4.611  -5.921
    2    HA   SER  84           HA       SER  84   3.646   7.071  -5.473
    3    HB2  SER  84           HB2      SER  84   1.592   6.202  -7.494
    4    HB3  SER  84           HB3      SER  84   2.248   7.839  -7.474
    5    HG   SER  84           HG       SER  84   3.655   5.382  -7.752

  No H/Q in entry =           5
  In of MODEL    3
    1    H    MET  85           H        MET  85   0.162   6.268  -5.306
    2    HA   MET  85           HA       MET  85  -0.736   8.869  -4.718
    3    HB2  MET  85           HB2      MET  85  -2.234   7.041  -5.383
    4    HB3  MET  85           HB3      MET  85  -1.936   6.239  -3.842
    5    HG2  MET  85           HG2      MET  85  -2.842   8.203  -2.644
    6    HG3  MET  85           HG3      MET  85  -3.144   8.999  -4.187
    7    HE2  MET  85           HE1      MET  85  -5.497   5.713  -2.119
    8    HE1  MET  85           HE2      MET  85  -4.209   6.748  -1.507
    9    HE3  MET  85           HE3      MET  85  -3.811   5.369  -2.528

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LEU  86           H        LEU  86   0.214   6.227  -2.561
    2    HA   LEU  86           HA       LEU  86  -0.342   7.533  -0.126
    3    HB2  LEU  86           HB2      LEU  86   0.155   5.066  -0.509
    4    HB3  LEU  86           HB3      LEU  86   1.857   5.518  -0.602
    5    HG   LEU  86           HG       LEU  86   1.512   6.683   1.661
    6   HD11  LEU  86          HD11      LEU  86  -1.171   5.881   1.187
    7   HD13  LEU  86          HD12      LEU  86  -0.518   6.642   2.636
    8   HD12  LEU  86          HD13      LEU  86  -0.586   4.884   2.523
    9   HD23  LEU  86          HD21      LEU  86   1.121   3.686   1.794
   10   HD22  LEU  86          HD22      LEU  86   2.108   4.712   2.832
   11   HD21  LEU  86          HD23      LEU  86   2.617   4.387   1.176

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ALA  87           H        ALA  87   2.647   7.268  -2.007
    2    HA   ALA  87           HA       ALA  87   4.331   8.706  -0.284
    3    HB3  ALA  87           HB1      ALA  87   4.445   7.684  -2.987
    4    HB2  ALA  87           HB2      ALA  87   5.773   8.035  -1.885
    5    HB1  ALA  87           HB3      ALA  87   5.145   9.304  -2.935

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ARG  88           H        ARG  88   2.376   9.808  -3.013
    2    HA   ARG  88           HA       ARG  88   3.118  12.507  -2.904
    3    HB2  ARG  88           HB2      ARG  88   1.882  11.333  -4.760
    4    HB3  ARG  88           HB3      ARG  88   0.421  11.463  -3.780
    5    HG2  ARG  88           HG2      ARG  88   1.410  14.055  -3.705
    6    HG3  ARG  88           HG3      ARG  88   1.844  13.540  -5.332
    7    HD2  ARG  88           HD2      ARG  88  -0.297  13.593  -6.035
    8    HD3  ARG  88           HD3      ARG  88  -0.877  12.738  -4.605
    9    HE   ARG  88           HE       ARG  88  -1.098  15.512  -5.033
   10   HH21  ARG  88          HH11      ARG  88  -1.644  16.842  -3.301
   11   HH22  ARG  88          HH12      ARG  88  -1.345  16.314  -1.681
   12   HH11  ARG  88          HH21      ARG  88  -0.061  13.270  -2.648
   13   HH12  ARG  88          HH22      ARG  88  -0.466  14.285  -1.312

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLU  89           H        GLU  89   0.431  10.808  -1.264
    2    HA   GLU  89           HA       GLU  89  -0.705  13.112  -0.069
    3    HB2  GLU  89           HB2      GLU  89  -1.798  10.860  -0.150
    4    HB3  GLU  89           HB3      GLU  89  -0.670  10.322   1.095
    5    HG2  GLU  89           HG2      GLU  89  -1.512  12.017   2.647
    6    HG3  GLU  89           HG3      GLU  89  -2.569  12.671   1.399

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LEU  90           H        LEU  90   1.769  10.851   1.118
    2    HA   LEU  90           HA       LEU  90   2.106  12.108   3.644
    3    HB2  LEU  90           HB2      LEU  90   3.902  10.347   1.976
    4    HB3  LEU  90           HB3      LEU  90   4.312  10.874   3.614
    5    HG   LEU  90           HG       LEU  90   1.693   9.498   2.952
    6   HD12  LEU  90          HD11      LEU  90   2.853   7.468   3.970
    7   HD11  LEU  90          HD12      LEU  90   4.367   8.339   3.728
    8   HD13  LEU  90          HD13      LEU  90   3.362   7.916   2.341
    9   HD22  LEU  90          HD21      LEU  90   1.415  10.426   5.070
   10   HD21  LEU  90          HD22      LEU  90   3.133  10.338   5.456
   11   HD23  LEU  90          HD23      LEU  90   2.142   8.880   5.508

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  91           H        ILE  91   3.712  12.497   0.518
    2    HA   ILE  91           HA       ILE  91   5.668  14.351   1.355
    3    HB   ILE  91           HB       ILE  91   4.367  13.838  -1.325
    4   HG12  ILE  91          HG12      ILE  91   7.202  13.383  -0.344
    5   HG13  ILE  91          HG13      ILE  91   5.932  12.173  -0.180
    6   HG22  ILE  91          HG21      ILE  91   6.577  15.205  -2.015
    7   HG21  ILE  91          HG22      ILE  91   6.256  16.008  -0.477
    8   HG23  ILE  91          HG23      ILE  91   5.035  16.019  -1.748
    9   HD13  ILE  91          HD11      ILE  91   5.767  11.840  -2.486
   10   HD12  ILE  91          HD12      ILE  91   7.498  12.101  -2.270
   11   HD11  ILE  91          HD13      ILE  91   6.476  13.412  -2.863

  No H/Q in entry =          11
  In of MODEL    3
    1    H    THR  92           H        THR  92   2.304  14.746   0.340
    2    HA   THR  92           HA       THR  92   2.249  17.569   0.269
    3    HB   THR  92           HB       THR  92   0.101  15.555   0.971
    4    HG1  THR  92           HG1      THR  92   0.411  15.372  -1.112
    5   HG22  THR  92          HG21      THR  92  -1.320  17.700   0.239
    6   HG21  THR  92          HG22      THR  92   0.062  18.542   0.936
    7   HG23  THR  92          HG23      THR  92  -0.870  17.414   1.920

  No H/Q in entry =           7
  In of MODEL    3
    1    H    GLU  93           H        GLU  93   1.719  15.272   2.930
    2    HA   GLU  93           HA       GLU  93   1.164  17.177   4.941
    3    HB2  GLU  93           HB2      GLU  93   2.504  14.467   5.189
    4    HB3  GLU  93           HB3      GLU  93   1.801  15.391   6.517
    5    HG2  GLU  93           HG2      GLU  93   0.201  14.589   4.078
    6    HG3  GLU  93           HG3      GLU  93   0.310  13.573   5.510

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LEU  94           H        LEU  94   4.188  15.721   3.802
    2    HA   LEU  94           HA       LEU  94   5.923  16.892   5.689
    3    HB2  LEU  94           HB2      LEU  94   6.340  15.919   2.862
    4    HB3  LEU  94           HB3      LEU  94   7.661  16.593   3.812
    5    HG   LEU  94           HG       LEU  94   5.941  14.384   4.952
    6   HD11  LEU  94          HD11      LEU  94   8.042  14.171   2.825
    7   HD13  LEU  94          HD12      LEU  94   6.605  13.184   3.087
    8   HD12  LEU  94          HD13      LEU  94   8.031  12.949   4.097
    9   HD23  LEU  94          HD21      LEU  94   8.133  13.873   6.110
   10   HD22  LEU  94          HD22      LEU  94   7.450  15.446   6.520
   11   HD21  LEU  94          HD23      LEU  94   8.792  15.335   5.380

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  95           H        ILE  95   4.778  18.042   2.533
    2    HA   ILE  95           HA       ILE  95   6.328  20.414   2.469
    3    HB   ILE  95           HB       ILE  95   3.693  19.700   1.161
    4   HG12  ILE  95          HG12      ILE  95   6.480  20.061   0.028
    5   HG13  ILE  95          HG13      ILE  95   5.845  18.503   0.547
    6   HG21  ILE  95          HG21      ILE  95   5.419  22.184   0.935
    7   HG23  ILE  95          HG22      ILE  95   3.694  22.100   1.288
    8   HG22  ILE  95          HG23      ILE  95   4.284  21.700  -0.325
    9   HD13  ILE  95          HD11      ILE  95   4.290  18.406  -1.185
   10   HD12  ILE  95          HD12      ILE  95   5.632  19.235  -1.973
   11   HD11  ILE  95          HD13      ILE  95   4.249  20.158  -1.387

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLU  96           H        GLU  96   3.083  19.735   3.760
    2    HA   GLU  96           HA       GLU  96   2.436  22.379   4.501
    3    HB2  GLU  96           HB2      GLU  96   0.778  20.580   4.516
    4    HB3  GLU  96           HB3      GLU  96   1.645  19.765   5.815
    5    HG2  GLU  96           HG2      GLU  96   0.610  21.044   7.379
    6    HG3  GLU  96           HG3      GLU  96   1.133  22.520   6.578

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LEU  97           H        LEU  97   4.300  19.851   6.138
    2    HA   LEU  97           HA       LEU  97   4.640  21.211   8.605
    3    HB2  LEU  97           HB2      LEU  97   6.200  19.052   7.201
    4    HB3  LEU  97           HB3      LEU  97   6.780  19.748   8.712
    5    HG   LEU  97           HG       LEU  97   3.982  18.627   8.400
    6   HD12  LEU  97          HD11      LEU  97   4.938  16.628   9.621
    7   HD11  LEU  97          HD12      LEU  97   6.544  17.272   9.278
    8   HD13  LEU  97          HD13      LEU  97   5.481  16.800   7.952
    9   HD23  LEU  97          HD21      LEU  97   4.432  18.345  10.966
   10   HD22  LEU  97          HD22      LEU  97   4.038  19.951  10.355
   11   HD21  LEU  97          HD23      LEU  97   5.713  19.528  10.705

  No H/Q in entry =          11
  In of MODEL    3
    1    H    HIS  98           H        HIS  98   6.516  21.234   5.583
    2    HA   HIS  98           HA       HIS  98   8.653  22.837   6.481
    3    HB2  HIS  98           HB2      HIS  98   7.368  22.561   3.754
    4    HB3  HIS  98           HB3      HIS  98   8.798  23.553   4.043
    5    HD1  HIS  98           HD1      HIS  98   7.619  19.972   4.073
    6    HD2  HIS  98           HD2      HIS  98  11.180  22.102   4.498
    7    HE1  HIS  98           HE1      HIS  98   9.490  18.259   4.026
    8    HE2  HIS  98           HE2      HIS  98  11.663  19.536   4.284

  No H/Q in entry =           8
  In of MODEL    3
    1    H    GLU  99           H        GLU  99   5.427  23.639   5.297
    2    HA   GLU  99           HA       GLU  99   5.781  26.457   5.230
    3    HB2  GLU  99           HB2      GLU  99   3.914  25.267   4.100
    4    HB3  GLU  99           HB3      GLU  99   3.219  24.904   5.679
    5    HG2  GLU  99           HG2      GLU  99   3.016  27.296   6.171
    6    HG3  GLU  99           HG3      GLU  99   3.792  27.698   4.642

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LYS 100           H        LYS 100   4.665  24.220   7.757
    2    HA   LYS 100           HA       LYS 100   4.057  26.275   9.643
    3    HB2  LYS 100           HB2      LYS 100   4.657  23.330  10.000
    4    HB3  LYS 100           HB3      LYS 100   4.198  24.403  11.328
    5    HG2  LYS 100           HG2      LYS 100   2.129  25.018  10.074
    6    HG3  LYS 100           HG3      LYS 100   2.569  23.849   8.826
    7    HD2  LYS 100           HD2      LYS 100   2.504  22.033  10.493
    8    HD3  LYS 100           HD3      LYS 100   2.081  23.196  11.752
    9    HE2  LYS 100           HE2      LYS 100   0.025  23.796  10.483
   10    HE3  LYS 100           HE3      LYS 100   0.438  22.575   9.272
   11    HZ1  LYS 100           HZ1      LYS 100   0.173  21.916  12.154
   12    HZ3  LYS 100           HZ2      LYS 100   0.169  20.857  10.823
   13    HZ2  LYS 100           HZ3      LYS 100  -1.156  21.886  11.097

  No H/Q in entry =          13
  In of MODEL    3
    1    H    LEU 101           H        LEU 101   6.997  24.502   8.821
    2    HA   LEU 101           HA       LEU 101   8.584  25.363  11.025
    3    HB2  LEU 101           HB2      LEU 101   9.193  24.372   8.251
    4    HB3  LEU 101           HB3      LEU 101  10.487  25.052   9.233
    5    HG   LEU 101           HG       LEU 101   8.672  22.884  10.300
    6   HD12  LEU 101          HD11      LEU 101  10.739  21.404   9.701
    7   HD11  LEU 101          HD12      LEU 101  11.098  22.666   8.525
    8   HD13  LEU 101          HD13      LEU 101   9.577  21.780   8.431
    9   HD21  LEU 101          HD21      LEU 101  11.385  24.017  11.029
   10   HD23  LEU 101          HD22      LEU 101  10.854  22.442  11.613
   11   HD22  LEU 101          HD23      LEU 101   9.948  23.892  12.045

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LYS 102           H        LYS 102   6.990  27.206   8.875
    2    HA   LYS 102           HA       LYS 102   7.049  29.498   8.575
    3    HB2  LYS 102           HB2      LYS 102   8.610  29.403  10.677
    4    HB3  LYS 102           HB3      LYS 102   9.910  29.605   9.520
    5    HG2  LYS 102           HG2      LYS 102   7.787  31.543  10.371
    6    HG3  LYS 102           HG3      LYS 102   9.497  31.816  10.122
    7    HD2  LYS 102           HD2      LYS 102   7.554  31.369   7.819
    8    HD3  LYS 102           HD3      LYS 102   7.923  32.954   8.483
    9    HE2  LYS 102           HE2      LYS 102   9.310  31.774   6.417
   10    HE3  LYS 102           HE3      LYS 102   9.913  33.089   7.425
   11    HZ2  LYS 102           HZ1      LYS 102  11.450  31.197   7.259
   12    HZ1  LYS 102           HZ2      LYS 102  10.294  30.207   8.002
   13    HZ3  LYS 102           HZ3      LYS 102  10.974  31.503   8.858

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ALA 103           H        ALA 103  10.317  28.184   8.022
    2    HA   ALA 103           HA       ALA 103  11.274  29.562   5.943
    3    HB2  ALA 103           HB1      ALA 103  12.179  27.352   5.024
    4    HB1  ALA 103           HB2      ALA 103  11.288  26.575   6.331
    5    HB3  ALA 103           HB3      ALA 103  12.567  27.731   6.703
    6    H1   LYS   3           H1       LYS   3 -31.045   6.547 -19.595
    7    H2   LYS   3           H3       LYS   3 -30.053   6.263 -20.944
    8    H3   LYS   3           H2       LYS   3 -31.459   5.340 -20.716
    9    HA   LYS   3           HA       LYS   3 -30.479   3.923 -19.324
   10    HB2  LYS   3           HB2      LYS   3 -28.175   5.327 -20.628
   11    HB3  LYS   3           HB3      LYS   3 -27.870   4.099 -19.398
   12    HG2  LYS   3           HG2      LYS   3 -29.303   2.545 -20.776
   13    HG3  LYS   3           HG3      LYS   3 -29.238   3.761 -22.051
   14    HD2  LYS   3           HD2      LYS   3 -26.757   3.620 -21.990
   15    HD3  LYS   3           HD3      LYS   3 -26.896   2.308 -20.820
   16    HE2  LYS   3           HE2      LYS   3 -28.399   1.171 -22.558
   17    HE3  LYS   3           HE3      LYS   3 -27.760   2.356 -23.696
   18    HZ3  LYS   3           HZ1      LYS   3 -25.975   1.111 -23.973
   19    HZ2  LYS   3           HZ2      LYS   3 -26.623  -0.062 -22.931
   20    HZ1  LYS   3           HZ3      LYS   3 -25.622   1.162 -22.312

  No H/Q in entry =          20
  In of MODEL    3
    1    H    LYS   4           H        LYS   4 -30.544   3.756 -17.265
    2    HA   LYS   4           HA       LYS   4 -29.795   6.012 -15.583
    3    HB2  LYS   4           HB2      LYS   4 -31.031   3.325 -14.923
    4    HB3  LYS   4           HB3      LYS   4 -30.799   4.646 -13.779
    5    HG2  LYS   4           HG2      LYS   4 -32.596   4.636 -16.210
    6    HG3  LYS   4           HG3      LYS   4 -33.094   4.672 -14.520
    7    HD2  LYS   4           HD2      LYS   4 -32.373   6.882 -14.221
    8    HD3  LYS   4           HD3      LYS   4 -31.327   6.829 -15.640
    9    HE2  LYS   4           HE2      LYS   4 -33.234   8.232 -16.095
   10    HE3  LYS   4           HE3      LYS   4 -33.327   6.773 -17.081
   11    HZ3  LYS   4           HZ1      LYS   4 -34.921   5.860 -15.553
   12    HZ2  LYS   4           HZ2      LYS   4 -35.456   7.370 -16.121
   13    HZ1  LYS   4           HZ3      LYS   4 -34.808   7.231 -14.557

  No H/Q in entry =          13
  In of MODEL    3
    1    H    HIS   5           H        HIS   5 -28.333   6.059 -13.984
    2    HA   HIS   5           HA       HIS   5 -26.072   4.205 -14.327
    3    HB2  HIS   5           HB2      HIS   5 -26.298   6.948 -13.087
    4    HB3  HIS   5           HB3      HIS   5 -24.828   5.974 -13.076
    5    HD1  HIS   5           HD1      HIS   5 -23.335   7.174 -14.643
    6    HD2  HIS   5           HD2      HIS   5 -27.136   6.623 -16.222
    7    HE1  HIS   5           HE1      HIS   5 -23.148   7.783 -17.086
    8    HE2  HIS   5           HE2      HIS   5 -25.466   7.435 -18.017

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ILE   6           H        ILE   6 -25.871   2.613 -13.029
    2    HA   ILE   6           HA       ILE   6 -26.855   2.860 -10.267
    3    HB   ILE   6           HB       ILE   6 -26.057   0.401 -11.831
    4   HG12  ILE   6          HG12      ILE   6 -28.792   1.364 -10.981
    5   HG13  ILE   6          HG13      ILE   6 -28.139   1.538 -12.610
    6   HG23  ILE   6          HG21      ILE   6 -26.457  -0.869  -9.989
    7   HG22  ILE   6          HG22      ILE   6 -27.602   0.284  -9.301
    8   HG21  ILE   6          HG23      ILE   6 -25.868   0.595  -9.199
    9   HD13  ILE   6          HD11      ILE   6 -28.626  -0.568 -13.139
   10   HD12  ILE   6          HD12      ILE   6 -29.647  -0.555 -11.702
   11   HD11  ILE   6          HD13      ILE   6 -28.003  -1.186 -11.610

  No H/Q in entry =          11
  In of MODEL    3
    1    H    TYR   7           H        TYR   7 -25.094   3.460  -8.964
    2    HA   TYR   7           HA       TYR   7 -22.393   2.473  -9.642
    3    HB2  TYR   7           HB2      TYR   7 -23.330   4.901  -8.136
    4    HB3  TYR   7           HB3      TYR   7 -21.652   4.363  -8.173
    5    HD1  TYR   7           HD1      TYR   7 -22.691   3.475 -11.279
    6    HD2  TYR   7           HD2      TYR   7 -21.980   7.009  -9.006
    7    HE1  TYR   7           HE1      TYR   7 -22.231   4.724 -13.354
    8    HE2  TYR   7           HE2      TYR   7 -21.563   8.264 -11.071
    9    HH   TYR   7           HH       TYR   7 -21.772   8.208 -13.305

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LEU   8           H        LEU   8 -21.454   1.090  -8.327
    2    HA   LEU   8           HA       LEU   8 -22.604   0.579  -5.655
    3    HB2  LEU   8           HB2      LEU   8 -20.916  -1.086  -7.502
    4    HB3  LEU   8           HB3      LEU   8 -21.116  -1.487  -5.796
    5    HG   LEU   8           HG       LEU   8 -23.596  -1.618  -6.232
    6   HD13  LEU   8          HD11      LEU   8 -23.699  -0.374  -8.327
    7   HD12  LEU   8          HD12      LEU   8 -24.252  -2.027  -8.591
    8   HD11  LEU   8          HD13      LEU   8 -22.634  -1.545  -9.102
    9   HD23  LEU   8          HD21      LEU   8 -22.343  -3.656  -7.945
   10   HD22  LEU   8          HD22      LEU   8 -23.439  -3.825  -6.574
   11   HD21  LEU   8          HD23      LEU   8 -21.728  -3.500  -6.299

  No H/Q in entry =          11
  In of MODEL    3
    1    H    PHE   9           H        PHE   9 -21.338   0.945  -3.861
    2    HA   PHE   9           HA       PHE   9 -18.538   1.847  -4.352
    3    HB2  PHE   9           HB2      PHE   9 -20.558   2.915  -2.387
    4    HB3  PHE   9           HB3      PHE   9 -18.843   3.297  -2.326
    5    HD1  PHE   9           HD1      PHE   9 -17.780   4.619  -4.087
    6    HD2  PHE   9           HD2      PHE   9 -21.993   3.811  -4.154
    7    HE1  PHE   9           HE1      PHE   9 -18.087   6.361  -5.820
    8    HE2  PHE   9           HE2      PHE   9 -22.302   5.565  -5.881
    9    HZ   PHE   9           HZ       PHE   9 -20.347   6.836  -6.722

  No H/Q in entry =           9
  In of MODEL    3
    1    H    SER  10           H        SER  10 -16.965   0.859  -3.255
    2    HA   SER  10           HA       SER  10 -17.180  -0.067  -0.577
    3    HB2  SER  10           HB2      SER  10 -17.039  -2.444  -0.919
    4    HB3  SER  10           HB3      SER  10 -18.452  -1.858  -1.781
    5    HG   SER  10           HG       SER  10 -15.884  -2.316  -2.893

  No H/Q in entry =           5
  In of MODEL    3
    1    H    SER  11           H        SER  11 -15.166   0.047   0.239
    2    HA   SER  11           HA       SER  11 -12.975   0.863  -1.291
    3    HB2  SER  11           HB2      SER  11 -13.489   0.856   1.323
    4    HB3  SER  11           HB3      SER  11 -12.437  -0.559   1.252
    5    HG   SER  11           HG       SER  11 -11.575   1.589  -0.237

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA  12           H        ALA  12 -14.211  -1.809  -2.118
    2    HA   ALA  12           HA       ALA  12 -11.648  -3.077  -2.671
    3    HB2  ALA  12           HB1      ALA  12 -12.195  -5.236  -1.852
    4    HB1  ALA  12           HB2      ALA  12 -13.869  -4.782  -1.542
    5    HB3  ALA  12           HB3      ALA  12 -12.578  -4.119  -0.541

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLY  13           H        GLY  13 -12.413  -2.045  -4.687
    2    HA3  GLY  13           HA2      GLY  13 -14.666  -2.711  -6.154
    3    HA2  GLY  13           HA3      GLY  13 -13.113  -2.268  -6.878

  No H/Q in entry =           3
  In of MODEL    3
    1    H    MET  14           H        MET  14 -11.618  -4.571  -5.972
    2    HA   MET  14           HA       MET  14 -12.022  -6.304  -8.093
    3    HB2  MET  14           HB2      MET  14  -9.966  -6.404  -6.771
    4    HB3  MET  14           HB3      MET  14 -10.842  -7.094  -5.407
    5    HG2  MET  14           HG2      MET  14 -11.428  -9.060  -6.801
    6    HG3  MET  14           HG3      MET  14 -10.535  -8.362  -8.152
    7    HE1  MET  14           HE1      MET  14  -8.344  -7.729  -8.223
    8    HE3  MET  14           HE2      MET  14  -6.977  -8.497  -7.419
    9    HE2  MET  14           HE3      MET  14  -7.773  -7.121  -6.661

  No H/Q in entry =           9
  In of MODEL    3
    1    H    SER  15           H        SER  15 -13.257  -6.833  -4.786
    2    HA   SER  15           HA       SER  15 -14.629  -9.247  -5.573
    3    HB2  SER  15           HB2      SER  15 -14.895  -7.574  -3.066
    4    HB3  SER  15           HB3      SER  15 -15.862  -9.011  -3.380
    5    HG   SER  15           HG       SER  15 -14.009 -10.236  -3.447

  No H/Q in entry =           5
  In of MODEL    3
    1    H    THR  16           H        THR  16 -15.674  -5.862  -5.059
    2    HA   THR  16           HA       THR  16 -18.469  -6.324  -5.586
    3    HB   THR  16           HB       THR  16 -16.886  -3.774  -6.056
    4    HG1  THR  16           HG1      THR  16 -16.451  -4.379  -3.990
    5   HG23  THR  16          HG21      THR  16 -18.971  -2.667  -5.756
    6   HG22  THR  16          HG22      THR  16 -19.747  -4.135  -5.138
    7   HG21  THR  16          HG23      THR  16 -19.303  -4.007  -6.846

  No H/Q in entry =           7
  In of MODEL    3
    1    H    SER  17           H        SER  17 -15.642  -5.755  -7.427
    2    HA   SER  17           HA       SER  17 -16.744  -4.970  -9.926
    3    HB2  SER  17           HB2      SER  17 -14.138  -6.339  -9.230
    4    HB3  SER  17           HB3      SER  17 -14.564  -5.865 -10.874
    5    HG   SER  17           HG       SER  17 -13.630  -4.080 -10.258

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU  18           H        LEU  18 -16.228  -8.138  -8.513
    2    HA   LEU  18           HA       LEU  18 -16.819  -9.602 -10.890
    3    HB2  LEU  18           HB2      LEU  18 -15.624 -10.599  -8.988
    4    HB3  LEU  18           HB3      LEU  18 -17.061 -10.403  -7.984
    5    HG   LEU  18           HG       LEU  18 -18.296 -11.940  -9.437
    6   HD11  LEU  18          HD11      LEU  18 -15.731 -11.840 -10.994
    7   HD13  LEU  18          HD12      LEU  18 -17.391 -11.713 -11.577
    8   HD12  LEU  18          HD13      LEU  18 -16.754 -13.274 -11.062
    9   HD22  LEU  18          HD21      LEU  18 -17.332 -13.910  -8.652
   10   HD21  LEU  18          HD22      LEU  18 -16.868 -12.669  -7.485
   11   HD23  LEU  18          HD23      LEU  18 -15.705 -13.231  -8.686

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LEU  19           H        LEU  19 -18.788  -8.400  -8.176
    2    HA   LEU  19           HA       LEU  19 -21.261  -9.541  -9.037
    3    HB2  LEU  19           HB2      LEU  19 -20.989  -8.736  -6.773
    4    HB3  LEU  19           HB3      LEU  19 -20.690  -7.101  -7.361
    5    HG   LEU  19           HG       LEU  19 -23.001  -6.869  -8.026
    6   HD11  LEU  19          HD11      LEU  19 -23.229  -9.744  -7.136
    7   HD13  LEU  19          HD12      LEU  19 -23.570  -9.082  -8.734
    8   HD12  LEU  19          HD13      LEU  19 -24.621  -8.687  -7.375
    9   HD21  LEU  19          HD21      LEU  19 -22.546  -7.891  -5.236
   10   HD23  LEU  19          HD22      LEU  19 -24.045  -7.120  -5.754
   11   HD22  LEU  19          HD23      LEU  19 -22.529  -6.220  -5.801

  No H/Q in entry =          11
  In of MODEL    3
    1    H    VAL  20           H        VAL  20 -19.720  -6.392  -9.684
    2    HA   VAL  20           HA       VAL  20 -21.808  -5.304 -11.253
    3    HB   VAL  20           HB       VAL  20 -18.811  -4.750 -11.358
    4   HG12  VAL  20          HG11      VAL  20 -19.474  -2.656 -12.576
    5   HG11  VAL  20          HG12      VAL  20 -21.091  -3.334 -12.760
    6   HG13  VAL  20          HG13      VAL  20 -19.709  -4.130 -13.514
    7   HG21  VAL  20          HG21      VAL  20 -21.136  -3.384 -10.039
    8   HG23  VAL  20          HG22      VAL  20 -19.581  -2.595 -10.289
    9   HG22  VAL  20          HG23      VAL  20 -19.682  -4.044  -9.288

  No H/Q in entry =           9
  In of MODEL    3
    1    H    SER  21           H        SER  21 -19.072  -7.378 -12.289
    2    HA   SER  21           HA       SER  21 -19.838  -7.222 -15.043
    3    HB2  SER  21           HB2      SER  21 -18.429  -9.208 -15.390
    4    HB3  SER  21           HB3      SER  21 -17.587  -7.980 -14.446
    5    HG   SER  21           HG       SER  21 -18.118 -10.503 -13.817

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LYS  22           H        LYS  22 -20.948  -9.425 -12.504
    2    HA   LYS  22           HA       LYS  22 -22.498 -11.001 -14.355
    3    HB2  LYS  22           HB2      LYS  22 -22.845 -10.681 -11.370
    4    HB3  LYS  22           HB3      LYS  22 -23.598 -11.916 -12.377
    5    HG2  LYS  22           HG2      LYS  22 -20.627 -11.638 -11.952
    6    HG3  LYS  22           HG3      LYS  22 -21.671 -12.740 -11.055
    7    HD2  LYS  22           HD2      LYS  22 -22.269 -13.870 -13.155
    8    HD3  LYS  22           HD3      LYS  22 -21.200 -12.779 -14.038
    9    HE2  LYS  22           HE2      LYS  22 -19.278 -13.643 -12.759
   10    HE3  LYS  22           HE3      LYS  22 -20.351 -14.747 -11.898
   11    HZ3  LYS  22           HZ1      LYS  22 -20.463 -16.138 -13.635
   12    HZ2  LYS  22           HZ2      LYS  22 -18.972 -15.434 -14.042
   13    HZ1  LYS  22           HZ3      LYS  22 -20.396 -14.902 -14.798

  No H/Q in entry =          13
  In of MODEL    3
    1    H    MET  23           H        MET  23 -23.192  -8.092 -12.455
    2    HA   MET  23           HA       MET  23 -25.997  -8.124 -12.978
    3    HB2  MET  23           HB2      MET  23 -24.120  -5.850 -12.366
    4    HB3  MET  23           HB3      MET  23 -25.862  -5.653 -12.552
    5    HG2  MET  23           HG2      MET  23 -26.284  -6.975 -10.602
    6    HG3  MET  23           HG3      MET  23 -24.580  -7.413 -10.471
    7    HE2  MET  23           HE1      MET  23 -26.832  -3.743  -9.250
    8    HE1  MET  23           HE2      MET  23 -27.092  -4.690 -10.714
    9    HE3  MET  23           HE3      MET  23 -26.036  -3.278 -10.754

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ARG  24           H        ARG  24 -23.211  -6.714 -14.728
    2    HA   ARG  24           HA       ARG  24 -24.678  -5.368 -16.719
    3    HB2  ARG  24           HB2      ARG  24 -22.230  -5.014 -16.315
    4    HB3  ARG  24           HB3      ARG  24 -21.917  -6.604 -16.966
    5    HG2  ARG  24           HG2      ARG  24 -22.825  -5.867 -19.193
    6    HG3  ARG  24           HG3      ARG  24 -23.038  -4.234 -18.507
    7    HD2  ARG  24           HD2      ARG  24 -20.413  -5.794 -18.627
    8    HD3  ARG  24           HD3      ARG  24 -20.870  -4.471 -19.692
    9    HE   ARG  24           HE       ARG  24 -19.983  -4.123 -17.005
   10   HH21  ARG  24          HH11      ARG  24 -20.609  -2.187 -16.048
   11   HH22  ARG  24          HH12      ARG  24 -20.997  -0.827 -17.042
   12   HH11  ARG  24          HH21      ARG  24 -20.947  -2.811 -19.971
   13   HH12  ARG  24          HH22      ARG  24 -21.184  -1.204 -19.362

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ALA  25           H        ALA  25 -23.609  -8.725 -16.479
    2    HA   ALA  25           HA       ALA  25 -24.234  -9.513 -19.131
    3    HB1  ALA  25           HB1      ALA  25 -23.575 -11.564 -18.457
    4    HB3  ALA  25           HB2      ALA  25 -24.641 -11.546 -17.052
    5    HB2  ALA  25           HB3      ALA  25 -23.072 -10.744 -16.980

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLN  26           H        GLN  26 -26.080  -9.562 -16.119
    2    HA   GLN  26           HA       GLN  26 -28.436 -10.713 -17.165
    3    HB2  GLN  26           HB2      GLN  26 -27.910  -9.005 -14.752
    4    HB3  GLN  26           HB3      GLN  26 -29.483  -9.698 -15.121
    5    HG2  GLN  26           HG2      GLN  26 -26.923 -11.203 -14.657
    6    HG3  GLN  26           HG3      GLN  26 -28.289 -11.092 -13.553
    7   HE21  GLN  26          HE21      GLN  26 -27.099 -13.260 -14.851
    8   HE22  GLN  26          HE22      GLN  26 -28.153 -14.279 -15.668

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ALA  27           H        ALA  27 -27.449  -7.336 -16.723
    2    HA   ALA  27           HA       ALA  27 -29.916  -6.193 -17.507
    3    HB1  ALA  27           HB1      ALA  27 -28.092  -4.922 -16.363
    4    HB3  ALA  27           HB2      ALA  27 -28.660  -4.127 -17.832
    5    HB2  ALA  27           HB3      ALA  27 -27.139  -5.019 -17.846

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLU  28           H        GLU  28 -27.223  -7.435 -19.377
    2    HA   GLU  28           HA       GLU  28 -28.126  -6.345 -21.886
    3    HB2  GLU  28           HB2      GLU  28 -25.762  -7.076 -21.258
    4    HB3  GLU  28           HB3      GLU  28 -26.333  -8.728 -21.486
    5    HG2  GLU  28           HG2      GLU  28 -25.162  -7.943 -23.437
    6    HG3  GLU  28           HG3      GLU  28 -26.862  -8.235 -23.800

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LYS  29           H        LYS  29 -28.353  -9.471 -20.274
    2    HA   LYS  29           HA       LYS  29 -29.668 -10.891 -22.308
    3    HB2  LYS  29           HB2      LYS  29 -28.647 -11.920 -20.311
    4    HB3  LYS  29           HB3      LYS  29 -29.913 -11.205 -19.313
    5    HG2  LYS  29           HG2      LYS  29 -31.590 -12.535 -20.410
    6    HG3  LYS  29           HG3      LYS  29 -30.394 -13.174 -21.536
    7    HD2  LYS  29           HD2      LYS  29 -29.281 -14.384 -19.812
    8    HD3  LYS  29           HD3      LYS  29 -30.182 -13.545 -18.551
    9    HE2  LYS  29           HE2      LYS  29 -30.971 -15.876 -18.950
   10    HE3  LYS  29           HE3      LYS  29 -32.228 -14.660 -19.185
   11    HZ1  LYS  29           HZ1      LYS  29 -31.650 -14.769 -21.611
   12    HZ3  LYS  29           HZ2      LYS  29 -32.396 -16.154 -20.970
   13    HZ2  LYS  29           HZ3      LYS  29 -30.724 -16.147 -21.257

  No H/Q in entry =          13
  In of MODEL    3
    1    H    TYR  30           H        TYR  30 -31.041  -8.798 -19.781
    2    HA   TYR  30           HA       TYR  30 -33.702  -9.187 -21.045
    3    HB2  TYR  30           HB2      TYR  30 -33.047  -8.082 -18.304
    4    HB3  TYR  30           HB3      TYR  30 -34.665  -8.303 -18.971
    5    HD1  TYR  30           HD1      TYR  30 -35.612 -10.577 -19.223
    6    HD2  TYR  30           HD2      TYR  30 -31.776  -9.942 -17.486
    7    HE1  TYR  30           HE1      TYR  30 -35.565 -12.917 -18.459
    8    HE2  TYR  30           HE2      TYR  30 -31.730 -12.268 -16.725
    9    HH   TYR  30           HH       TYR  30 -33.400 -14.586 -17.862

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLU  31           H        GLU  31 -31.499  -7.219 -21.804
    2    HA   GLU  31           HA       GLU  31 -31.386  -5.052 -22.596
    3    HB2  GLU  31           HB2      GLU  31 -34.289  -5.714 -23.136
    4    HB3  GLU  31           HB3      GLU  31 -33.421  -4.350 -23.841
    5    HG2  GLU  31           HG2      GLU  31 -31.965  -5.794 -25.045
    6    HG3  GLU  31           HG3      GLU  31 -32.557  -7.211 -24.180

  No H/Q in entry =           6
  In of MODEL    3
    1    H    VAL  32           H        VAL  32 -31.600  -4.986 -19.864
    2    HA   VAL  32           HA       VAL  32 -33.434  -2.854 -19.186
    3    HB   VAL  32           HB       VAL  32 -31.067  -3.907 -17.605
    4   HG12  VAL  32          HG11      VAL  32 -32.601  -3.086 -15.707
    5   HG11  VAL  32          HG12      VAL  32 -33.413  -2.152 -16.964
    6   HG13  VAL  32          HG13      VAL  32 -31.704  -1.879 -16.629
    7   HG21  VAL  32          HG21      VAL  32 -32.857  -5.590 -18.328
    8   HG23  VAL  32          HG22      VAL  32 -33.892  -4.763 -17.163
    9   HG22  VAL  32          HG23      VAL  32 -32.389  -5.518 -16.630

  No H/Q in entry =           9
  In of MODEL    3
    1    HA   PRO  33           HA       PRO  33 -30.347   0.052 -20.799
    2    HB2  PRO  33           HB2      PRO  33 -31.826   2.295 -20.653
    3    HB3  PRO  33           HB3      PRO  33 -32.307   1.015 -21.768
    4    HG2  PRO  33           HG2      PRO  33 -33.286   1.506 -18.955
    5    HG3  PRO  33           HG3      PRO  33 -34.243   1.333 -20.425
    6    HD2  PRO  33           HD2      PRO  33 -33.828  -0.770 -18.786
    7    HD3  PRO  33           HD3      PRO  33 -33.883  -0.986 -20.536

  No H/Q in entry =           7
  In of MODEL    3
    1    H    VAL  34           H        VAL  34 -29.104  -0.540 -18.851
    2    HA   VAL  34           HA       VAL  34 -28.794   1.857 -17.167
    3    HB   VAL  34           HB       VAL  34 -28.247   0.360 -15.247
    4   HG12  VAL  34          HG11      VAL  34 -30.674  -0.483 -14.966
    5   HG11  VAL  34          HG12      VAL  34 -30.969   0.304 -16.516
    6   HG13  VAL  34          HG13      VAL  34 -30.410   1.253 -15.138
    7   HG21  VAL  34          HG21      VAL  34 -28.449  -1.635 -17.285
    8   HG23  VAL  34          HG22      VAL  34 -29.520  -2.000 -15.931
    9   HG22  VAL  34          HG23      VAL  34 -27.800  -1.742 -15.649

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ILE  35           H        ILE  35 -26.817   2.252 -16.308
    2    HA   ILE  35           HA       ILE  35 -24.525   0.907 -17.577
    3    HB   ILE  35           HB       ILE  35 -24.888   3.791 -16.727
    4   HG12  ILE  35          HG12      ILE  35 -23.909   2.507 -19.284
    5   HG13  ILE  35          HG13      ILE  35 -25.531   3.147 -19.025
    6   HG21  ILE  35          HG21      ILE  35 -22.346   2.226 -17.042
    7   HG23  ILE  35          HG22      ILE  35 -22.791   3.394 -15.799
    8   HG22  ILE  35          HG23      ILE  35 -22.391   3.947 -17.425
    9   HD11  ILE  35          HD11      ILE  35 -24.103   5.312 -18.383
   10   HD13  ILE  35          HD12      ILE  35 -24.636   4.961 -20.028
   11   HD12  ILE  35          HD13      ILE  35 -22.992   4.560 -19.528

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ILE  36           H        ILE  36 -23.319  -0.157 -15.985
    2    HA   ILE  36           HA       ILE  36 -23.767   0.423 -13.109
    3    HB   ILE  36           HB       ILE  36 -22.971  -2.274 -14.251
    4   HG12  ILE  36          HG12      ILE  36 -25.772  -1.441 -13.492
    5   HG13  ILE  36          HG13      ILE  36 -25.190  -1.404 -15.157
    6   HG23  ILE  36          HG21      ILE  36 -23.347  -3.129 -12.152
    7   HG22  ILE  36          HG22      ILE  36 -24.458  -1.836 -11.701
    8   HG21  ILE  36          HG23      ILE  36 -22.723  -1.528 -11.757
    9   HD13  ILE  36          HD11      ILE  36 -25.385  -3.612 -15.397
   10   HD12  ILE  36          HD12      ILE  36 -26.457  -3.495 -14.002
   11   HD11  ILE  36          HD13      ILE  36 -24.766  -3.942 -13.779

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLU  37           H        GLU  37 -21.984   1.012 -11.984
    2    HA   GLU  37           HA       GLU  37 -19.300   0.191 -12.897
    3    HB2  GLU  37           HB2      GLU  37 -20.163   2.983 -12.160
    4    HB3  GLU  37           HB3      GLU  37 -18.481   2.469 -12.291
    5    HG2  GLU  37           HG2      GLU  37 -18.786   2.039 -14.660
    6    HG3  GLU  37           HG3      GLU  37 -20.478   2.521 -14.535

  No H/Q in entry =           6
  In of MODEL    3
    1    H    ALA  38           H        ALA  38 -17.826  -0.091 -11.209
    2    HA   ALA  38           HA       ALA  38 -18.872   0.061  -8.442
    3    HB1  ALA  38           HB1      ALA  38 -17.176  -1.880  -9.886
    4    HB3  ALA  38           HB2      ALA  38 -18.236  -2.122  -8.498
    5    HB2  ALA  38           HB3      ALA  38 -16.617  -1.464  -8.265

  No H/Q in entry =           5
  In of MODEL    3
    1    H    PHE  39           H        PHE  39 -17.625   1.233  -6.944
    2    HA   PHE  39           HA       PHE  39 -15.080   2.415  -7.808
    3    HB2  PHE  39           HB2      PHE  39 -17.284   4.010  -6.501
    4    HB3  PHE  39           HB3      PHE  39 -15.701   4.603  -7.002
    5    HD1  PHE  39           HD1      PHE  39 -15.189   4.972  -9.340
    6    HD2  PHE  39           HD2      PHE  39 -19.048   3.666  -8.079
    7    HE1  PHE  39           HE1      PHE  39 -16.113   5.604 -11.552
    8    HE2  PHE  39           HE2      PHE  39 -19.982   4.286 -10.278
    9    HZ   PHE  39           HZ       PHE  39 -18.515   5.227 -12.032

  No H/Q in entry =           9
  In of MODEL    3
    1    HA   PRO  40           HA       PRO  40 -14.176   1.587  -3.528
    2    HB2  PRO  40           HB2      PRO  40 -12.388   3.572  -2.882
    3    HB3  PRO  40           HB3      PRO  40 -11.954   2.251  -3.966
    4    HG2  PRO  40           HG2      PRO  40 -12.939   5.009  -4.679
    5    HG3  PRO  40           HG3      PRO  40 -11.522   4.156  -5.291
    6    HD2  PRO  40           HD2      PRO  40 -13.736   4.120  -6.710
    7    HD3  PRO  40           HD3      PRO  40 -12.802   2.635  -6.538

  No H/Q in entry =           7
  In of MODEL    3
    1    H    GLU  41           H        GLU  41 -14.798   2.541  -1.387
    2    HA   GLU  41           HA       GLU  41 -17.023   4.270  -1.359
    3    HB2  GLU  41           HB2      GLU  41 -16.875   4.177   1.026
    4    HB3  GLU  41           HB3      GLU  41 -16.448   2.585   0.399
    5    HG2  GLU  41           HG2      GLU  41 -14.099   3.016   0.796
    6    HG3  GLU  41           HG3      GLU  41 -14.462   4.661   1.316

  No H/Q in entry =           6
  In of MODEL    3
    1    H    THR  42           H        THR  42 -13.682   5.150  -1.378
    2    HA   THR  42           HA       THR  42 -14.013   7.696  -0.132
    3    HB   THR  42           HB       THR  42 -11.843   8.262  -1.192
    4    HG1  THR  42           HG1      THR  42 -12.008   5.672  -2.344
    5   HG22  THR  42          HG21      THR  42 -11.900   5.441  -0.092
    6   HG21  THR  42          HG22      THR  42 -11.928   6.904   0.893
    7   HG23  THR  42          HG23      THR  42 -10.517   6.536  -0.098

  No H/Q in entry =           7
  In of MODEL    3
    1    H    LEU  43           H        LEU  43 -14.911   6.657  -3.253
    2    HA   LEU  43           HA       LEU  43 -15.128   9.446  -4.184
    3    HB2  LEU  43           HB2      LEU  43 -15.535   6.832  -5.627
    4    HB3  LEU  43           HB3      LEU  43 -15.680   8.431  -6.353
    5    HG   LEU  43           HG       LEU  43 -13.131   7.194  -5.341
    6   HD11  LEU  43          HD11      LEU  43 -14.319   6.343  -7.513
    7   HD13  LEU  43          HD12      LEU  43 -12.590   6.683  -7.524
    8   HD12  LEU  43          HD13      LEU  43 -13.722   7.858  -8.191
    9   HD23  LEU  43          HD21      LEU  43 -12.158   9.161  -6.629
   10   HD22  LEU  43          HD22      LEU  43 -12.963   9.548  -5.107
   11   HD21  LEU  43          HD23      LEU  43 -13.788   9.837  -6.638

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ALA  44           H        ALA  44 -17.104   7.616  -2.369
    2    HA   ALA  44           HA       ALA  44 -19.575   7.522  -3.707
    3    HB3  ALA  44           HB1      ALA  44 -19.462   6.374  -1.626
    4    HB2  ALA  44           HB2      ALA  44 -20.556   7.727  -1.341
    5    HB1  ALA  44           HB3      ALA  44 -18.887   7.809  -0.777

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLY  45           H        GLY  45 -18.134  10.285  -2.126
    2    HA3  GLY  45           HA2      GLY  45 -20.553  11.817  -2.480
    3    HA2  GLY  45           HA3      GLY  45 -19.004  12.416  -1.885

  No H/Q in entry =           3
  In of MODEL    3
    1    H    GLU  46           H        GLU  46 -17.470  11.495  -4.180
    2    HA   GLU  46           HA       GLU  46 -18.072  13.742  -5.921
    3    HB2  GLU  46           HB2      GLU  46 -15.754  13.165  -5.265
    4    HB3  GLU  46           HB3      GLU  46 -15.921  11.626  -6.110
    5    HG2  GLU  46           HG2      GLU  46 -16.193  12.805  -8.222
    6    HG3  GLU  46           HG3      GLU  46 -16.051  14.351  -7.386

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LYS  47           H        LYS  47 -17.989  10.229  -6.405
    2    HA   LYS  47           HA       LYS  47 -19.069  10.499  -9.083
    3    HB2  LYS  47           HB2      LYS  47 -18.551   8.071  -7.358
    4    HB3  LYS  47           HB3      LYS  47 -19.091   8.018  -9.036
    5    HG2  LYS  47           HG2      LYS  47 -16.548   9.378  -8.238
    6    HG3  LYS  47           HG3      LYS  47 -16.618   7.650  -8.576
    7    HD2  LYS  47           HD2      LYS  47 -17.570   8.141 -10.791
    8    HD3  LYS  47           HD3      LYS  47 -17.436   9.865 -10.450
    9    HE2  LYS  47           HE2      LYS  47 -15.563   9.191 -11.791
   10    HE3  LYS  47           HE3      LYS  47 -14.992   9.567 -10.166
   11    HZ2  LYS  47           HZ1      LYS  47 -15.067   7.039 -11.568
   12    HZ1  LYS  47           HZ2      LYS  47 -15.520   6.975  -9.932
   13    HZ3  LYS  47           HZ3      LYS  47 -13.998   7.592 -10.370

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLY  48           H        GLY  48 -20.418   9.711  -5.954
    2    HA3  GLY  48           HA2      GLY  48 -22.812   8.564  -6.726
    3    HA2  GLY  48           HA3      GLY  48 -22.584   9.534  -5.271

  No H/Q in entry =           3
  In of MODEL    3
    1    H    GLN  49           H        GLN  49 -21.966  11.972  -6.805
    2    HA   GLN  49           HA       GLN  49 -24.512  13.115  -6.948
    3    HB2  GLN  49           HB2      GLN  49 -21.950  13.969  -8.280
    4    HB3  GLN  49           HB3      GLN  49 -23.402  14.949  -8.192
    5    HG2  GLN  49           HG2      GLN  49 -23.257  14.937  -5.754
    6    HG3  GLN  49           HG3      GLN  49 -21.818  13.936  -5.842
    7   HE21  GLN  49          HE21      GLN  49 -21.684  16.145  -4.537
    8   HE22  GLN  49          HE22      GLN  49 -20.743  17.400  -5.161

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ASN  50           H        ASN  50 -22.839  11.250  -9.351
    2    HA   ASN  50           HA       ASN  50 -24.700  12.173 -11.432
    3    HB2  ASN  50           HB2      ASN  50 -22.136  10.607 -11.673
    4    HB3  ASN  50           HB3      ASN  50 -23.174  11.063 -13.016
    5   HD21  ASN  50          HD21      ASN  50 -20.538  11.856 -11.378
    6   HD22  ASN  50          HD22      ASN  50 -20.284  13.494 -11.696

  No H/Q in entry =           6
  In of MODEL    3
    1    H    ALA  51           H        ALA  51 -24.725   9.785  -9.220
    2    HA   ALA  51           HA       ALA  51 -25.524   7.675 -11.080
    3    HB2  ALA  51           HB1      ALA  51 -24.966   6.296  -9.410
    4    HB3  ALA  51           HB2      ALA  51 -26.086   7.101  -8.312
    5    HB1  ALA  51           HB3      ALA  51 -24.439   7.706  -8.491

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ASP  52           H        ASP  52 -27.542   6.641 -10.967
    2    HA   ASP  52           HA       ASP  52 -29.705   8.491 -10.289
    3    HB2  ASP  52           HB2      ASP  52 -29.534   6.008 -11.992
    4    HB3  ASP  52           HB3      ASP  52 -31.072   6.752 -11.557

  No H/Q in entry =           4
  In of MODEL    3
    1    H    VAL  53           H        VAL  53 -28.145   5.568  -9.304
    2    HA   VAL  53           HA       VAL  53 -29.599   5.679  -6.794
    3    HB   VAL  53           HB       VAL  53 -31.011   4.071  -8.069
    4   HG11  VAL  53          HG11      VAL  53 -29.265   3.211  -9.594
    5   HG13  VAL  53          HG12      VAL  53 -30.119   1.914  -8.757
    6   HG12  VAL  53          HG13      VAL  53 -28.506   2.390  -8.231
    7   HG23  VAL  53          HG21      VAL  53 -30.222   2.060  -6.401
    8   HG22  VAL  53          HG22      VAL  53 -31.338   3.373  -6.022
    9   HG21  VAL  53          HG23      VAL  53 -29.631   3.518  -5.603

  No H/Q in entry =           9
  In of MODEL    3
    1    H    VAL  54           H        VAL  54 -28.301   5.205  -5.138
    2    HA   VAL  54           HA       VAL  54 -25.548   4.330  -5.746
    3    HB   VAL  54           HB       VAL  54 -26.609   6.090  -3.478
    4   HG11  VAL  54          HG11      VAL  54 -24.047   4.642  -3.774
    5   HG13  VAL  54          HG12      VAL  54 -24.800   5.310  -2.327
    6   HG12  VAL  54          HG13      VAL  54 -23.874   6.358  -3.403
    7   HG22  VAL  54          HG21      VAL  54 -25.720   7.908  -4.546
    8   HG21  VAL  54          HG22      VAL  54 -26.272   6.944  -5.915
    9   HG23  VAL  54          HG23      VAL  54 -24.568   6.941  -5.467

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LEU  55           H        LEU  55 -24.985   2.392  -5.127
    2    HA   LEU  55           HA       LEU  55 -26.522   1.070  -2.979
    3    HB2  LEU  55           HB2      LEU  55 -24.967  -0.086  -5.282
    4    HB3  LEU  55           HB3      LEU  55 -25.747  -1.027  -4.011
    5    HG   LEU  55           HG       LEU  55 -27.151   0.608  -6.113
    6   HD13  LEU  55          HD11      LEU  55 -26.868  -1.231  -7.357
    7   HD12  LEU  55          HD12      LEU  55 -27.844  -2.110  -6.181
    8   HD11  LEU  55          HD13      LEU  55 -26.088  -2.071  -6.019
    9   HD23  LEU  55          HD21      LEU  55 -28.481  -1.347  -4.293
   10   HD22  LEU  55          HD22      LEU  55 -29.154   0.056  -5.126
   11   HD21  LEU  55          HD23      LEU  55 -28.139   0.279  -3.700

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LEU  56           H        LEU  56 -25.389   0.436  -1.175
    2    HA   LEU  56           HA       LEU  56 -22.449   0.793  -1.203
    3    HB2  LEU  56           HB2      LEU  56 -24.269   0.572   1.182
    4    HB3  LEU  56           HB3      LEU  56 -22.554   0.980   1.187
    5    HG   LEU  56           HG       LEU  56 -24.825   2.702   0.233
    6   HD11  LEU  56          HD11      LEU  56 -23.730   2.270   2.754
    7   HD13  LEU  56          HD12      LEU  56 -24.699   3.659   2.262
    8   HD12  LEU  56          HD13      LEU  56 -22.940   3.741   2.186
    9   HD23  LEU  56          HD21      LEU  56 -22.856   4.376   0.075
   10   HD22  LEU  56          HD22      LEU  56 -23.246   3.304  -1.270
   11   HD21  LEU  56          HD23      LEU  56 -21.904   2.918  -0.194

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLY  57           H        GLY  57 -21.094  -0.863  -0.685
    2    HA3  GLY  57           HA2      GLY  57 -22.051  -3.533  -0.924
    3    HA2  GLY  57           HA3      GLY  57 -20.425  -3.067  -0.430

  No H/Q in entry =           3
  In of MODEL    3
    1    HA   PRO  58           HA       PRO  58 -23.269  -4.120   3.250
    2    HB2  PRO  58           HB2      PRO  58 -22.624  -6.742   3.824
    3    HB3  PRO  58           HB3      PRO  58 -23.996  -6.301   2.808
    4    HG2  PRO  58           HG2      PRO  58 -21.276  -7.208   2.026
    5    HG3  PRO  58           HG3      PRO  58 -22.842  -7.636   1.339
    6    HD2  PRO  58           HD2      PRO  58 -21.203  -5.825   0.150
    7    HD3  PRO  58           HD3      PRO  58 -22.960  -5.713   0.040

  No H/Q in entry =           7
  In of MODEL    3
    1    H    GLN  59           H        GLN  59 -19.902  -4.630   2.655
    2    HA   GLN  59           HA       GLN  59 -19.164  -4.696   5.420
    3    HB2  GLN  59           HB2      GLN  59 -17.672  -4.125   2.882
    4    HB3  GLN  59           HB3      GLN  59 -16.928  -3.791   4.433
    5    HG2  GLN  59           HG2      GLN  59 -16.248  -5.959   3.589
    6    HG3  GLN  59           HG3      GLN  59 -17.184  -6.138   5.064
    7   HE21  GLN  59          HE21      GLN  59 -17.912  -7.948   4.663
    8   HE22  GLN  59          HE22      GLN  59 -18.974  -8.705   3.630

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ILE  60           H        ILE  60 -20.049  -2.103   3.243
    2    HA   ILE  60           HA       ILE  60 -19.182  -0.185   5.319
    3    HB   ILE  60           HB       ILE  60 -19.361   1.574   3.529
    4   HG12  ILE  60          HG12      ILE  60 -19.227  -0.592   1.480
    5   HG13  ILE  60          HG13      ILE  60 -20.803  -0.067   2.072
    6   HG23  ILE  60          HG21      ILE  60 -17.241   1.127   2.565
    7   HG22  ILE  60          HG22      ILE  60 -17.415  -0.603   2.855
    8   HG21  ILE  60          HG23      ILE  60 -17.243   0.505   4.216
    9   HD11  ILE  60          HD11      ILE  60 -20.007   2.317   1.484
   10   HD13  ILE  60          HD12      ILE  60 -20.445   1.245   0.154
   11   HD12  ILE  60          HD13      ILE  60 -18.748   1.517   0.545

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ALA  61           H        ALA  61 -21.660  -1.738   5.353
    2    HA   ALA  61           HA       ALA  61 -23.859  -0.037   4.905
    3    HB1  ALA  61           HB1      ALA  61 -25.103  -1.527   6.202
    4    HB2  ALA  61           HB2      ALA  61 -23.717  -1.950   7.208
    5    HB3  ALA  61           HB3      ALA  61 -23.811  -2.532   5.546

  No H/Q in entry =           5
  In of MODEL    3
    1    H    TYR  62           H        TYR  62 -21.671  -0.218   7.714
    2    HA   TYR  62           HA       TYR  62 -23.212   1.438   9.397
    3    HB2  TYR  62           HB2      TYR  62 -21.174   1.816  10.649
    4    HB3  TYR  62           HB3      TYR  62 -21.251   0.124  10.160
    5    HD1  TYR  62           HD1      TYR  62 -19.654  -0.788   8.538
    6    HD2  TYR  62           HD2      TYR  62 -19.456   3.315   9.714
    7    HE1  TYR  62           HE1      TYR  62 -17.433  -0.600   7.486
    8    HE2  TYR  62           HE2      TYR  62 -17.220   3.498   8.664
    9    HH   TYR  62           HH       TYR  62 -15.319   1.266   8.065

  No H/Q in entry =           9
  In of MODEL    3
    1    H    MET  63           H        MET  63 -21.541   2.312   6.563
    2    HA   MET  63           HA       MET  63 -21.338   5.132   7.298
    3    HB2  MET  63           HB2      MET  63 -20.736   3.634   4.747
    4    HB3  MET  63           HB3      MET  63 -20.525   5.375   4.949
    5    HG2  MET  63           HG2      MET  63 -18.838   4.974   6.655
    6    HG3  MET  63           HG3      MET  63 -19.050   3.235   6.461
    7    HE1  MET  63           HE1      MET  63 -18.512   6.456   4.918
    8    HE3  MET  63           HE2      MET  63 -18.514   6.037   3.206
    9    HE2  MET  63           HE3      MET  63 -16.985   6.276   4.052

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LEU  64           H        LEU  64 -23.923   3.329   6.293
    2    HA   LEU  64           HA       LEU  64 -25.100   4.793   4.228
    3    HB2  LEU  64           HB2      LEU  64 -26.005   2.688   5.112
    4    HB3  LEU  64           HB3      LEU  64 -26.458   3.517   6.600
    5    HG   LEU  64           HG       LEU  64 -28.126   4.813   5.381
    6   HD13  LEU  64          HD11      LEU  64 -27.828   5.080   3.153
    7   HD12  LEU  64          HD12      LEU  64 -28.497   3.457   2.982
    8   HD11  LEU  64          HD13      LEU  64 -26.751   3.689   3.053
    9   HD23  LEU  64          HD21      LEU  64 -28.682   2.018   4.592
   10   HD22  LEU  64          HD22      LEU  64 -29.659   3.154   5.522
   11   HD21  LEU  64          HD23      LEU  64 -28.300   2.330   6.285

  No H/Q in entry =          11
  In of MODEL    3
    1    HA   PRO  65           HA       PRO  65 -27.248   7.941   7.011
    2    HB2  PRO  65           HB2      PRO  65 -25.258   8.039   9.278
    3    HB3  PRO  65           HB3      PRO  65 -26.993   8.345   9.318
    4    HG2  PRO  65           HG2      PRO  65 -26.103   6.064  10.219
    5    HG3  PRO  65           HG3      PRO  65 -27.517   6.067   9.166
    6    HD2  PRO  65           HD2      PRO  65 -24.651   5.419   8.469
    7    HD3  PRO  65           HD3      PRO  65 -26.119   4.561   8.002

  No H/Q in entry =           7
  In of MODEL    3
    1    H    GLU  66           H        GLU  66 -23.694   7.830   7.102
    2    HA   GLU  66           HA       GLU  66 -23.351  10.629   6.737
    3    HB2  GLU  66           HB2      GLU  66 -21.571   8.303   6.063
    4    HB3  GLU  66           HB3      GLU  66 -21.093   9.989   5.881
    5    HG2  GLU  66           HG2      GLU  66 -21.312  10.331   8.253
    6    HG3  GLU  66           HG3      GLU  66 -21.865   8.669   8.459

  No H/Q in entry =           6
  In of MODEL    3
    1    H    ILE  67           H        ILE  67 -23.484   7.917   4.447
    2    HA   ILE  67           HA       ILE  67 -23.028   9.649   2.180
    3    HB   ILE  67           HB       ILE  67 -23.974   6.755   2.314
    4   HG12  ILE  67          HG12      ILE  67 -21.322   7.894   1.422
    5   HG13  ILE  67          HG13      ILE  67 -21.632   7.456   3.101
    6   HG21  ILE  67          HG21      ILE  67 -23.875   8.663   0.116
    7   HG23  ILE  67          HG22      ILE  67 -24.527   7.024   0.141
    8   HG22  ILE  67          HG23      ILE  67 -22.813   7.286  -0.174
    9   HD12  ILE  67          HD11      ILE  67 -21.228   5.711   0.729
   10   HD11  ILE  67          HD12      ILE  67 -22.258   5.137   2.039
   11   HD13  ILE  67          HD13      ILE  67 -20.580   5.569   2.363

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLN  68           H        GLN  68 -25.924   8.621   3.784
    2    HA   GLN  68           HA       GLN  68 -27.726   9.609   1.814
    3    HB2  GLN  68           HB2      GLN  68 -28.005   9.215   4.790
    4    HB3  GLN  68           HB3      GLN  68 -29.308   9.846   3.799
    5    HG2  GLN  68           HG2      GLN  68 -29.365   7.834   2.495
    6    HG3  GLN  68           HG3      GLN  68 -27.929   7.223   3.296
    7   HE21  GLN  68          HE21      GLN  68 -30.131   5.905   3.131
    8   HE22  GLN  68          HE22      GLN  68 -30.975   5.444   4.535

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ARG  69           H        ARG  69 -26.106  11.209   4.582
    2    HA   ARG  69           HA       ARG  69 -27.424  13.721   4.204
    3    HB2  ARG  69           HB2      ARG  69 -25.105  12.728   5.792
    4    HB3  ARG  69           HB3      ARG  69 -25.151  14.453   5.456
    5    HG2  ARG  69           HG2      ARG  69 -27.471  14.524   6.418
    6    HG3  ARG  69           HG3      ARG  69 -27.297  12.824   6.868
    7    HD2  ARG  69           HD2      ARG  69 -25.565  15.135   7.824
    8    HD3  ARG  69           HD3      ARG  69 -26.716  14.236   8.799
    9    HE   ARG  69           HE       ARG  69 -24.117  13.270   7.850
   10   HH21  ARG  69          HH11      ARG  69 -23.347  11.476   9.024
   11   HH22  ARG  69          HH12      ARG  69 -24.396  10.663  10.137
   12   HH11  ARG  69          HH21      ARG  69 -27.092  12.754   9.526
   13   HH12  ARG  69          HH22      ARG  69 -26.517  11.384  10.418

  No H/Q in entry =          13
  In of MODEL    3
    1    H    LEU  70           H        LEU  70 -24.573  12.281   2.838
    2    HA   LEU  70           HA       LEU  70 -23.410  14.641   1.709
    3    HB2  LEU  70           HB2      LEU  70 -22.461  12.297   2.276
    4    HB3  LEU  70           HB3      LEU  70 -23.077  11.865   0.682
    5    HG   LEU  70           HG       LEU  70 -21.453  13.222  -0.377
    6   HD11  LEU  70          HD11      LEU  70 -20.629  14.012   2.426
    7   HD13  LEU  70          HD12      LEU  70 -21.298  15.076   1.190
    8   HD12  LEU  70          HD13      LEU  70 -19.699  14.367   0.968
    9   HD22  LEU  70          HD21      LEU  70 -20.053  11.476  -0.162
   10   HD21  LEU  70          HD22      LEU  70 -20.996  10.952   1.234
   11   HD23  LEU  70          HD23      LEU  70 -19.592  11.995   1.460

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LEU  71           H        LEU  71 -25.606  12.156   0.548
    2    HA   LEU  71           HA       LEU  71 -26.089  13.688  -1.949
    3    HB2  LEU  71           HB2      LEU  71 -26.356  10.703  -1.546
    4    HB3  LEU  71           HB3      LEU  71 -26.460  11.588  -3.068
    5    HG   LEU  71           HG       LEU  71 -23.948  11.527  -1.395
    6   HD12  LEU  71          HD11      LEU  71 -24.021   9.934  -3.851
    7   HD11  LEU  71          HD12      LEU  71 -25.051   9.313  -2.561
    8   HD13  LEU  71          HD13      LEU  71 -23.327   9.555  -2.274
    9   HD22  LEU  71          HD21      LEU  71 -24.007  13.365  -2.864
   10   HD21  LEU  71          HD22      LEU  71 -24.519  12.352  -4.213
   11   HD23  LEU  71          HD23      LEU  71 -22.904  12.163  -3.529

  No H/Q in entry =          11
  In of MODEL    3
    1    HA   PRO  72           HA       PRO  72 -29.976  13.283   0.647
    2    HB2  PRO  72           HB2      PRO  72 -30.780  15.861   0.598
    3    HB3  PRO  72           HB3      PRO  72 -29.486  15.367   1.690
    4    HG2  PRO  72           HG2      PRO  72 -29.261  16.596  -1.047
    5    HG3  PRO  72           HG3      PRO  72 -28.491  17.111   0.454
    6    HD2  PRO  72           HD2      PRO  72 -27.178  15.548  -1.328
    7    HD3  PRO  72           HD3      PRO  72 -26.935  15.352   0.406

  No H/Q in entry =           7
  In of MODEL    3
    1    H    ASN  73           H        ASN  73 -29.317  14.269  -2.550
    2    HA   ASN  73           HA       ASN  73 -32.180  14.031  -3.200
    3    HB2  ASN  73           HB2      ASN  73 -31.681  15.156  -5.279
    4    HB3  ASN  73           HB3      ASN  73 -31.143  16.106  -3.902
    5   HD21  ASN  73          HD21      ASN  73 -30.334  16.171  -6.575
    6   HD22  ASN  73          HD22      ASN  73 -28.670  15.976  -6.761

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LYS  74           H        LYS  74 -30.252  11.727  -2.798
    2    HA   LYS  74           HA       LYS  74 -30.838  10.381  -5.368
    3    HB2  LYS  74           HB2      LYS  74 -28.321  10.010  -3.740
    4    HB3  LYS  74           HB3      LYS  74 -28.715   9.227  -5.270
    5    HG2  LYS  74           HG2      LYS  74 -28.384  12.188  -5.026
    6    HG3  LYS  74           HG3      LYS  74 -27.033  11.098  -5.339
    7    HD2  LYS  74           HD2      LYS  74 -28.161  10.224  -7.299
    8    HD3  LYS  74           HD3      LYS  74 -29.559  11.248  -6.973
    9    HE2  LYS  74           HE2      LYS  74 -28.286  13.232  -7.381
   10    HE3  LYS  74           HE3      LYS  74 -26.786  12.309  -7.477
   11    HZ2  LYS  74           HZ1      LYS  74 -28.232  12.975  -9.601
   12    HZ1  LYS  74           HZ2      LYS  74 -28.922  11.463  -9.253
   13    HZ3  LYS  74           HZ3      LYS  74 -27.254  11.588  -9.540

  No H/Q in entry =          13
  In of MODEL    3
    1    HA   PRO  75           HA       PRO  75 -32.315   7.388  -2.446
    2    HB2  PRO  75           HB2      PRO  75 -32.667   5.199  -4.060
    3    HB3  PRO  75           HB3      PRO  75 -33.762   6.580  -4.116
    4    HG2  PRO  75           HG2      PRO  75 -31.430   5.955  -5.884
    5    HG3  PRO  75           HG3      PRO  75 -33.065   6.436  -6.333
    6    HD2  PRO  75           HD2      PRO  75 -31.081   8.255  -6.254
    7    HD3  PRO  75           HD3      PRO  75 -32.706   8.685  -5.718

  No H/Q in entry =           7
  In of MODEL    3
    1    H    VAL  76           H        VAL  76 -30.893   6.280  -1.081
    2    HA   VAL  76           HA       VAL  76 -28.451   5.029  -2.193
    3    HB   VAL  76           HB       VAL  76 -28.718   6.464   0.483
    4   HG11  VAL  76          HG11      VAL  76 -26.386   5.141  -0.916
    5   HG13  VAL  76          HG12      VAL  76 -27.100   4.686   0.632
    6   HG12  VAL  76          HG13      VAL  76 -26.217   6.205   0.481
    7   HG22  VAL  76          HG21      VAL  76 -28.001   8.362  -0.375
    8   HG21  VAL  76          HG22      VAL  76 -28.553   7.699  -1.915
    9   HG23  VAL  76          HG23      VAL  76 -26.856   7.565  -1.453

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLU  77           H        GLU  77 -28.287   2.861  -1.610
    2    HA   GLU  77           HA       GLU  77 -29.106   2.056   1.029
    3    HB2  GLU  77           HB2      GLU  77 -30.748   0.454   0.468
    4    HB3  GLU  77           HB3      GLU  77 -31.258   1.999  -0.215
    5    HG2  GLU  77           HG2      GLU  77 -30.656   1.258  -2.410
    6    HG3  GLU  77           HG3      GLU  77 -30.052  -0.263  -1.755

  No H/Q in entry =           6
  In of MODEL    3
    1    H    VAL  78           H        VAL  78 -28.830  -0.047   1.662
    2    HA   VAL  78           HA       VAL  78 -26.178  -0.867   0.775
    3    HB   VAL  78           HB       VAL  78 -27.918  -1.743   3.120
    4   HG11  VAL  78          HG11      VAL  78 -25.602  -3.010   1.990
    5   HG13  VAL  78          HG12      VAL  78 -26.528  -3.480   3.417
    6   HG12  VAL  78          HG13      VAL  78 -25.182  -2.351   3.570
    7   HG22  VAL  78          HG21      VAL  78 -26.435  -0.434   4.484
    8   HG21  VAL  78          HG22      VAL  78 -27.142   0.570   3.219
    9   HG23  VAL  78          HG23      VAL  78 -25.478   0.006   3.070

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ILE  79           H        ILE  79 -25.680  -2.774  -0.154
    2    HA   ILE  79           HA       ILE  79 -27.768  -4.186  -1.531
    3    HB   ILE  79           HB       ILE  79 -24.791  -4.784  -1.302
    4   HG12  ILE  79          HG12      ILE  79 -26.390  -3.612  -3.584
    5   HG13  ILE  79          HG13      ILE  79 -25.498  -2.638  -2.412
    6   HG22  ILE  79          HG21      ILE  79 -25.907  -5.906  -3.643
    7   HG21  ILE  79          HG22      ILE  79 -26.911  -6.424  -2.287
    8   HG23  ILE  79          HG23      ILE  79 -25.177  -6.743  -2.272
    9   HD13  ILE  79          HD11      ILE  79 -24.079  -2.759  -4.226
   10   HD12  ILE  79          HD12      ILE  79 -24.456  -4.455  -4.531
   11   HD11  ILE  79          HD13      ILE  79 -23.468  -4.008  -3.140

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ASP  80           H        ASP  80 -28.679  -6.097  -0.978
    2    HA   ASP  80           HA       ASP  80 -28.660  -7.034   1.656
    3    HB2  ASP  80           HB2      ASP  80 -30.418  -7.547   0.000
    4    HB3  ASP  80           HB3      ASP  80 -29.279  -8.568  -0.876

  No H/Q in entry =           4
  In of MODEL    3
    1    H    SER  81           H        SER  81 -27.157  -8.218   2.778
    2    HA   SER  81           HA       SER  81 -24.670  -8.941   1.590
    3    HB2  SER  81           HB2      SER  81 -24.155 -10.014   3.748
    4    HB3  SER  81           HB3      SER  81 -24.817  -8.396   3.979
    5    HG   SER  81           HG       SER  81 -26.793  -9.320   4.468

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU  82           H        LEU  82 -27.430 -10.974   1.870
    2    HA   LEU  82           HA       LEU  82 -25.934 -13.371   1.325
    3    HB2  LEU  82           HB2      LEU  82 -28.855 -12.689   1.054
    4    HB3  LEU  82           HB3      LEU  82 -28.182 -14.304   0.843
    5    HG   LEU  82           HG       LEU  82 -28.130 -12.733   3.402
    6   HD11  LEU  82          HD11      LEU  82 -29.854 -15.048   2.487
    7   HD13  LEU  82          HD12      LEU  82 -30.404 -13.401   2.806
    8   HD12  LEU  82          HD13      LEU  82 -29.810 -14.404   4.129
    9   HD21  LEU  82          HD21      LEU  82 -27.145 -15.421   2.498
   10   HD23  LEU  82          HD22      LEU  82 -27.556 -15.135   4.189
   11   HD22  LEU  82          HD23      LEU  82 -26.291 -14.180   3.415

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LEU  83           H        LEU  83 -27.831 -11.075  -0.574
    2    HA   LEU  83           HA       LEU  83 -27.648 -12.405  -3.062
    3    HB2  LEU  83           HB2      LEU  83 -27.995  -9.498  -2.377
    4    HB3  LEU  83           HB3      LEU  83 -28.033 -10.120  -4.026
    5    HG   LEU  83           HG       LEU  83 -30.086 -10.489  -1.865
    6   HD13  LEU  83          HD11      LEU  83 -30.794  -8.610  -2.908
    7   HD12  LEU  83          HD12      LEU  83 -31.275  -9.695  -4.211
    8   HD11  LEU  83          HD13      LEU  83 -29.721  -8.864  -4.284
    9   HD23  LEU  83          HD21      LEU  83 -30.240 -11.708  -4.607
   10   HD22  LEU  83          HD22      LEU  83 -31.224 -12.053  -3.187
   11   HD21  LEU  83          HD23      LEU  83 -29.548 -12.594  -3.250

  No H/Q in entry =          11
  In of MODEL    3
    1    H    TYR  84           H        TYR  84 -25.649 -10.088  -1.344
    2    HA   TYR  84           HA       TYR  84 -23.765  -9.616  -3.459
    3    HB2  TYR  84           HB2      TYR  84 -24.267  -8.155  -1.405
    4    HB3  TYR  84           HB3      TYR  84 -23.250  -9.283  -0.509
    5    HD1  TYR  84           HD1      TYR  84 -20.888  -9.143  -0.603
    6    HD2  TYR  84           HD2      TYR  84 -23.254  -6.838  -3.308
    7    HE1  TYR  84           HE1      TYR  84 -18.861  -7.923  -1.319
    8    HE2  TYR  84           HE2      TYR  84 -21.236  -5.618  -4.040
    9    HH   TYR  84           HH       TYR  84 -18.963  -5.591  -3.948

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLY  85           H        GLY  85 -23.587 -11.661  -0.538
    2    HA3  GLY  85           HA2      GLY  85 -21.029 -12.658  -1.020
    3    HA2  GLY  85           HA3      GLY  85 -22.284 -13.488  -0.100

  No H/Q in entry =           3
  In of MODEL    3
    1    H    LYS  86           H        LYS  86 -24.128 -13.790  -2.174
    2    HA   LYS  86           HA       LYS  86 -23.123 -16.172  -3.460
    3    HB2  LYS  86           HB2      LYS  86 -25.739 -14.675  -3.636
    4    HB3  LYS  86           HB3      LYS  86 -25.442 -16.283  -4.293
    5    HG2  LYS  86           HG2      LYS  86 -25.244 -15.658  -1.379
    6    HG3  LYS  86           HG3      LYS  86 -26.735 -16.178  -2.163
    7    HD2  LYS  86           HD2      LYS  86 -25.573 -18.171  -3.028
    8    HD3  LYS  86           HD3      LYS  86 -24.097 -17.655  -2.214
    9    HE2  LYS  86           HE2      LYS  86 -25.256 -17.803  -0.052
   10    HE3  LYS  86           HE3      LYS  86 -26.708 -18.361  -0.881
   11    HZ2  LYS  86           HZ1      LYS  86 -25.367 -20.198  -0.002
   12    HZ1  LYS  86           HZ2      LYS  86 -24.065 -19.718  -0.984
   13    HZ3  LYS  86           HZ3      LYS  86 -25.506 -20.270  -1.693

  No H/Q in entry =          13
  In of MODEL    3
    1    H    VAL  87           H        VAL  87 -23.033 -12.947  -4.312
    2    HA   VAL  87           HA       VAL  87 -22.698 -11.756  -6.235
    3    HB   VAL  87           HB       VAL  87 -21.686 -14.262  -7.604
    4   HG11  VAL  87          HG11      VAL  87 -21.800 -11.815  -8.565
    5   HG13  VAL  87          HG12      VAL  87 -20.352 -12.788  -8.830
    6   HG12  VAL  87          HG13      VAL  87 -20.372 -11.561  -7.562
    7   HG21  VAL  87          HG21      VAL  87 -20.220 -12.730  -5.465
    8   HG23  VAL  87          HG22      VAL  87 -19.497 -13.929  -6.534
    9   HG22  VAL  87          HG23      VAL  87 -20.742 -14.411  -5.384

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ASP  88           H        ASP  88 -25.229 -12.344  -5.904
    2    HA   ASP  88           HA       ASP  88 -26.367 -13.505  -8.322
    3    HB2  ASP  88           HB2      ASP  88 -27.378 -13.756  -6.006
    4    HB3  ASP  88           HB3      ASP  88 -27.792 -12.044  -6.086

  No H/Q in entry =           4
  In of MODEL    3
    1    H    GLY  89           H        GLY  89 -25.626 -12.242  -9.943
    2    HA3  GLY  89           HA2      GLY  89 -25.744  -9.464 -10.110
    3    HA2  GLY  89           HA3      GLY  89 -25.738 -10.567 -11.484

  No H/Q in entry =           3
  In of MODEL    3
    1    H    LEU  90           H        LEU  90 -28.217 -11.869 -11.064
    2    HA   LEU  90           HA       LEU  90 -29.978  -9.880 -12.161
    3    HB2  LEU  90           HB2      LEU  90 -30.095 -12.266 -12.771
    4    HB3  LEU  90           HB3      LEU  90 -30.616 -12.642 -11.129
    5    HG   LEU  90           HG       LEU  90 -32.707 -11.473 -11.488
    6   HD13  LEU  90          HD11      LEU  90 -32.482  -9.717 -12.939
    7   HD12  LEU  90          HD12      LEU  90 -33.044 -10.928 -14.094
    8   HD11  LEU  90          HD13      LEU  90 -31.323 -10.574 -13.958
    9   HD23  LEU  90          HD21      LEU  90 -32.664 -13.073 -13.943
   10   HD22  LEU  90          HD22      LEU  90 -33.653 -13.234 -12.493
   11   HD21  LEU  90          HD23      LEU  90 -32.013 -13.883 -12.518

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLY  91           H        GLY  91 -29.858 -11.424  -8.995
    2    HA3  GLY  91           HA2      GLY  91 -32.177 -10.273  -7.951
    3    HA2  GLY  91           HA3      GLY  91 -30.801 -10.849  -7.010

  No H/Q in entry =           3
  In of MODEL    3
    1    H    VAL  92           H        VAL  92 -28.838  -9.055  -7.835
    2    HA   VAL  92           HA       VAL  92 -29.586  -6.757  -6.260
    3    HB   VAL  92           HB       VAL  92 -27.043  -7.262  -7.851
    4   HG12  VAL  92          HG11      VAL  92 -27.176  -5.403  -5.501
    5   HG11  VAL  92          HG12      VAL  92 -27.822  -4.826  -7.040
    6   HG13  VAL  92          HG13      VAL  92 -26.138  -5.333  -6.926
    7   HG22  VAL  92          HG21      VAL  92 -26.862  -8.874  -6.278
    8   HG21  VAL  92          HG22      VAL  92 -27.995  -8.082  -5.180
    9   HG23  VAL  92          HG23      VAL  92 -26.328  -7.517  -5.287

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LEU  93           H        LEU  93 -29.179  -7.383  -9.687
    2    HA   LEU  93           HA       LEU  93 -29.461  -4.730 -10.584
    3    HB2  LEU  93           HB2      LEU  93 -28.854  -6.580 -12.066
    4    HB3  LEU  93           HB3      LEU  93 -30.463  -7.275 -11.859
    5    HG   LEU  93           HG       LEU  93 -31.425  -5.276 -12.963
    6   HD11  LEU  93          HD11      LEU  93 -29.542  -3.727 -12.431
    7   HD13  LEU  93          HD12      LEU  93 -29.974  -3.727 -14.142
    8   HD12  LEU  93          HD13      LEU  93 -28.544  -4.600 -13.595
    9   HD23  LEU  93          HD21      LEU  93 -30.390  -5.837 -15.253
   10   HD22  LEU  93          HD22      LEU  93 -31.263  -7.086 -14.366
   11   HD21  LEU  93          HD23      LEU  93 -29.498  -7.070 -14.361

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LYS  94           H        LYS  94 -31.895  -7.233  -9.777
    2    HA   LYS  94           HA       LYS  94 -34.205  -5.732 -10.392
    3    HB2  LYS  94           HB2      LYS  94 -33.748  -7.954  -8.406
    4    HB3  LYS  94           HB3      LYS  94 -35.329  -7.220  -8.672
    5    HG2  LYS  94           HG2      LYS  94 -35.249  -7.967 -11.016
    6    HG3  LYS  94           HG3      LYS  94 -33.707  -8.757 -10.690
    7    HD2  LYS  94           HD2      LYS  94 -34.864 -10.088  -8.887
    8    HD3  LYS  94           HD3      LYS  94 -36.390  -9.401  -9.440
    9    HE2  LYS  94           HE2      LYS  94 -35.885 -10.311 -11.716
   10    HE3  LYS  94           HE3      LYS  94 -34.492 -11.135 -11.017
   11    HZ3  LYS  94           HZ1      LYS  94 -36.374 -12.613 -11.213
   12    HZ2  LYS  94           HZ2      LYS  94 -37.328 -11.577 -10.263
   13    HZ1  LYS  94           HZ3      LYS  94 -35.989 -12.364  -9.579

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ALA  95           H        ALA  95 -32.397  -5.931  -7.338
    2    HA   ALA  95           HA       ALA  95 -34.217  -4.330  -5.847
    3    HB2  ALA  95           HB1      ALA  95 -31.875  -5.764  -5.317
    4    HB3  ALA  95           HB2      ALA  95 -32.838  -4.852  -4.156
    5    HB1  ALA  95           HB3      ALA  95 -31.470  -4.085  -4.962

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA  96           H        ALA  96 -31.549  -3.509  -7.922
    2    HA   ALA  96           HA       ALA  96 -31.394  -0.760  -7.112
    3    HB2  ALA  96           HB1      ALA  96 -30.018  -0.538  -9.214
    4    HB3  ALA  96           HB2      ALA  96 -30.360  -2.234  -9.557
    5    HB1  ALA  96           HB3      ALA  96 -29.440  -1.792  -8.117

  No H/Q in entry =           5
  In of MODEL    3
    1    H    VAL  97           H        VAL  97 -32.952  -2.405  -9.827
    2    HA   VAL  97           HA       VAL  97 -33.965  -0.066 -11.057
    3    HB   VAL  97           HB       VAL  97 -34.841  -2.972 -11.140
    4   HG11  VAL  97          HG11      VAL  97 -36.585  -0.918 -11.607
    5   HG13  VAL  97          HG12      VAL  97 -36.677  -2.499 -12.384
    6   HG12  VAL  97          HG13      VAL  97 -35.890  -1.157 -13.210
    7   HG21  VAL  97          HG21      VAL  97 -33.512  -1.147 -13.147
    8   HG23  VAL  97          HG22      VAL  97 -34.002  -2.812 -13.459
    9   HG22  VAL  97          HG23      VAL  97 -32.750  -2.470 -12.264

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ALA  98           H        ALA  98 -35.209  -2.249  -8.553
    2    HA   ALA  98           HA       ALA  98 -37.743  -1.045  -8.196
    3    HB1  ALA  98           HB1      ALA  98 -36.786  -3.280  -7.189
    4    HB3  ALA  98           HB2      ALA  98 -37.948  -2.341  -6.250
    5    HB2  ALA  98           HB3      ALA  98 -36.226  -2.238  -5.882

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA  99           H        ALA  99 -34.652  -0.342  -6.528
    2    HA   ALA  99           HA       ALA  99 -35.741   1.647  -4.844
    3    HB1  ALA  99           HB1      ALA  99 -33.112   0.703  -5.594
    4    HB2  ALA  99           HB2      ALA  99 -33.650   1.447  -4.087
    5    HB3  ALA  99           HB3      ALA  99 -33.144   2.460  -5.438

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ILE 100           H        ILE 100 -34.684   1.796  -8.194
    2    HA   ILE 100           HA       ILE 100 -34.791   4.651  -8.375
    3    HB   ILE 100           HB       ILE 100 -34.931   2.528 -10.543
    4   HG12  ILE 100          HG12      ILE 100 -32.723   4.458  -9.837
    5   HG13  ILE 100          HG13      ILE 100 -32.801   2.804  -9.230
    6   HG21  ILE 100          HG21      ILE 100 -35.282   5.459 -10.636
    7   HG23  ILE 100          HG22      ILE 100 -35.814   4.218 -11.771
    8   HG22  ILE 100          HG23      ILE 100 -34.147   4.794 -11.812
    9   HD12  ILE 100          HD11      ILE 100 -32.235   3.785 -11.989
   10   HD11  ILE 100          HD12      ILE 100 -32.936   2.183 -11.758
   11   HD13  ILE 100          HD13      ILE 100 -31.382   2.578 -11.027

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LYS 101           H        LYS 101 -37.147   2.109  -9.145
    2    HA   LYS 101           HA       LYS 101 -39.182   3.824 -10.130
    3    HB2  LYS 101           HB2      LYS 101 -39.140   1.033  -9.040
    4    HB3  LYS 101           HB3      LYS 101 -40.671   1.837  -9.381
    5    HG2  LYS 101           HG2      LYS 101 -40.184   1.992 -11.674
    6    HG3  LYS 101           HG3      LYS 101 -38.500   1.541 -11.419
    7    HD2  LYS 101           HD2      LYS 101 -39.793  -0.324 -12.335
    8    HD3  LYS 101           HD3      LYS 101 -39.181  -0.691 -10.723
    9    HE2  LYS 101           HE2      LYS 101 -41.263  -1.342 -10.233
   10    HE3  LYS 101           HE3      LYS 101 -41.677   0.373 -10.215
   11    HZ3  LYS 101           HZ1      LYS 101 -42.563   0.268 -12.338
   12    HZ2  LYS 101           HZ2      LYS 101 -43.064  -1.203 -11.652
   13    HZ1  LYS 101           HZ3      LYS 101 -41.752  -1.173 -12.731

  No H/Q in entry =          13
  In of MODEL    3
    1    H    LYS 102           H        LYS 102 -38.740   2.290  -6.941
    2    HA   LYS 102           HA       LYS 102 -40.962   3.525  -5.735
    3    HB2  LYS 102           HB2      LYS 102 -39.777   1.614  -4.741
    4    HB3  LYS 102           HB3      LYS 102 -38.362   2.631  -4.477
    5    HG2  LYS 102           HG2      LYS 102 -39.649   4.037  -2.966
    6    HG3  LYS 102           HG3      LYS 102 -41.068   3.024  -3.232
    7    HD2  LYS 102           HD2      LYS 102 -39.893   1.114  -2.227
    8    HD3  LYS 102           HD3      LYS 102 -38.475   2.128  -1.959
    9    HE2  LYS 102           HE2      LYS 102 -39.798   3.619  -0.535
   10    HE3  LYS 102           HE3      LYS 102 -41.233   2.638  -0.823
   11    HZ1  LYS 102           HZ1      LYS 102 -39.561   0.827   0.162
   12    HZ3  LYS 102           HZ2      LYS 102 -40.652   1.726   1.100
   13    HZ2  LYS 102           HZ3      LYS 102 -39.029   2.212   0.986

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ALA 103           H        ALA 103 -37.970   4.856  -6.716
    2    HA   ALA 103           HA       ALA 103 -38.143   7.150  -4.902
    3    HB2  ALA 103           HB1      ALA 103 -36.127   7.856  -6.459
    4    HB3  ALA 103           HB2      ALA 103 -36.132   6.144  -6.881
    5    HB1  ALA 103           HB3      ALA 103 -35.900   6.638  -5.205

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA 104           H        ALA 104 -38.768   6.482  -8.260
    2    HA   ALA 104           HA       ALA 104 -39.280   9.289  -8.846
    3    HB2  ALA 104           HB1      ALA 104 -39.330   8.653 -11.057
    4    HB1  ALA 104           HB2      ALA 104 -40.097   7.105 -10.705
    5    HB3  ALA 104           HB3      ALA 104 -38.371   7.321 -10.415

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA 105           H        ALA 105 -40.949   7.200  -7.077
    2    HA   ALA 105           HA       ALA 105 -43.338   8.653  -7.041
    3    HB2  ALA 105           HB1      ALA 105 -44.094   7.841  -9.095
    4    HB3  ALA 105           HB2      ALA 105 -44.765   6.653  -7.978
    5    HB1  ALA 105           HB3      ALA 105 -43.301   6.281  -8.885

  No H/Q in entry =           5
  In of MODEL    4
    1    H1   ALA   1           H3       ALA   1 -12.112 -16.039  -2.415
    2    H2   ALA   1           H2       ALA   1 -11.158 -17.174  -3.250
    3    H3   ALA   1           H1       ALA   1 -12.310 -16.244  -4.088
    4    HA   ALA   1           HA       ALA   1 -13.691 -17.958  -3.844
    5    HB3  ALA   1           HB1      ALA   1 -12.278 -19.714  -3.374
    6    HB1  ALA   1           HB2      ALA   1 -13.037 -19.603  -1.786
    7    HB2  ALA   1           HB3      ALA   1 -11.468 -18.847  -2.068

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLU   2           H        GLU   2 -15.307 -18.824  -2.188
    2    HA   GLU   2           HA       GLU   2 -16.974 -17.117  -1.137
    3    HB2  GLU   2           HB2      GLU   2 -16.012 -19.527   0.417
    4    HB3  GLU   2           HB3      GLU   2 -17.544 -18.692   0.666
    5    HG2  GLU   2           HG2      GLU   2 -18.511 -19.794  -1.065
    6    HG3  GLU   2           HG3      GLU   2 -17.191 -19.384  -2.150

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLU   3           H        GLU   3 -15.051 -18.441   1.492
    2    HA   GLU   3           HA       GLU   3 -15.298 -16.084   3.041
    3    HB2  GLU   3           HB2      GLU   3 -13.687 -18.613   3.302
    4    HB3  GLU   3           HB3      GLU   3 -13.470 -17.287   4.445
    5    HG2  GLU   3           HG2      GLU   3 -15.663 -17.458   5.261
    6    HG3  GLU   3           HG3      GLU   3 -16.248 -18.270   3.815

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LEU   4           H        LEU   4 -12.327 -17.537   1.658
    2    HA   LEU   4           HA       LEU   4 -10.513 -15.613   2.252
    3    HB2  LEU   4           HB2      LEU   4 -10.727 -16.923  -0.468
    4    HB3  LEU   4           HB3      LEU   4  -9.283 -16.185   0.215
    5    HG   LEU   4           HG       LEU   4 -10.754 -18.593   1.335
    6   HD13  LEU   4          HD11      LEU   4  -9.107 -19.936   0.412
    7   HD12  LEU   4          HD12      LEU   4  -7.910 -18.640   0.382
    8   HD11  LEU   4          HD13      LEU   4  -9.197 -18.680  -0.822
    9   HD23  LEU   4          HD21      LEU   4  -8.504 -18.629   2.720
   10   HD22  LEU   4          HD22      LEU   4  -9.836 -17.601   3.243
   11   HD21  LEU   4          HD23      LEU   4  -8.480 -16.902   2.360

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLU   5           H        GLU   5 -12.846 -15.440  -0.426
    2    HA   GLU   5           HA       GLU   5 -11.867 -12.950  -1.434
    3    HB2  GLU   5           HB2      GLU   5 -13.192 -14.549  -2.796
    4    HB3  GLU   5           HB3      GLU   5 -14.598 -14.209  -1.785
    5    HG2  GLU   5           HG2      GLU   5 -14.521 -11.845  -2.430
    6    HG3  GLU   5           HG3      GLU   5 -13.077 -12.141  -3.398

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLU   6           H        GLU   6 -14.586 -13.848   0.658
    2    HA   GLU   6           HA       GLU   6 -15.518 -11.179   1.047
    3    HB2  GLU   6           HB2      GLU   6 -15.912 -13.719   2.644
    4    HB3  GLU   6           HB3      GLU   6 -16.724 -12.198   3.010
    5    HG2  GLU   6           HG2      GLU   6 -16.879 -13.631   0.344
    6    HG3  GLU   6           HG3      GLU   6 -18.116 -13.713   1.596

  No H/Q in entry =           6
  In of MODEL    4
    1    H    VAL   7           H        VAL   7 -13.192 -13.261   2.629
    2    HA   VAL   7           HA       VAL   7 -12.744 -11.673   4.951
    3    HB   VAL   7           HB       VAL   7 -11.018 -13.704   3.511
    4   HG11  VAL   7          HG11      VAL   7 -10.569 -12.158   6.070
    5   HG13  VAL   7          HG12      VAL   7  -9.465 -12.366   4.712
    6   HG12  VAL   7          HG13      VAL   7  -9.806 -13.722   5.786
    7   HG21  VAL   7          HG21      VAL   7 -13.265 -14.287   4.730
    8   HG23  VAL   7          HG22      VAL   7 -12.342 -13.998   6.206
    9   HG22  VAL   7          HG23      VAL   7 -11.835 -15.257   5.081

  No H/Q in entry =           9
  In of MODEL    4
    1    H    VAL   8           H        VAL   8 -11.227 -11.784   1.743
    2    HA   VAL   8           HA       VAL   8  -9.184  -9.888   2.232
    3    HB   VAL   8           HB       VAL   8 -10.637 -10.596  -0.328
    4   HG12  VAL   8          HG11      VAL   8  -8.475  -9.581  -1.331
    5   HG11  VAL   8          HG12      VAL   8  -8.278  -8.796   0.236
    6   HG13  VAL   8          HG13      VAL   8  -9.707  -8.463  -0.742
    7   HG21  VAL   8          HG21      VAL   8  -8.935 -12.161   1.178
    8   HG23  VAL   8          HG22      VAL   8  -7.798 -11.345   0.110
    9   HG22  VAL   8          HG23      VAL   8  -9.105 -12.306  -0.573

  No H/Q in entry =           9
  In of MODEL    4
    1    H    MET   9           H        MET   9 -12.532  -9.537   1.066
    2    HA   MET   9           HA       MET   9 -12.496  -6.761   0.622
    3    HB2  MET   9           HB2      MET   9 -14.690  -8.658   1.450
    4    HB3  MET   9           HB3      MET   9 -14.990  -6.932   1.236
    5    HG2  MET   9           HG2      MET   9 -14.207  -7.045  -1.072
    6    HG3  MET   9           HG3      MET   9 -13.779  -8.744  -0.871
    7    HE1  MET   9           HE1      MET   9 -16.339  -6.081  -0.615
    8    HE3  MET   9           HE2      MET   9 -17.173  -7.004   0.632
    9    HE2  MET   9           HE3      MET   9 -17.914  -6.812  -0.954

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLY  10           H        GLY  10 -13.144  -8.648   3.555
    2    HA3  GLY  10           HA2      GLY  10 -13.717  -6.463   5.265
    3    HA2  GLY  10           HA3      GLY  10 -13.137  -8.044   5.785

  No H/Q in entry =           3
  In of MODEL    4
    1    H    LEU  11           H        LEU  11 -10.688  -8.148   4.474
    2    HA   LEU  11           HA       LEU  11  -9.005  -6.690   6.228
    3    HB2  LEU  11           HB2      LEU  11  -8.440  -8.117   3.627
    4    HB3  LEU  11           HB3      LEU  11  -7.179  -7.396   4.624
    5    HG   LEU  11           HG       LEU  11  -9.160  -9.446   5.646
    6   HD13  LEU  11          HD11      LEU  11  -7.924 -10.676   4.087
    7   HD12  LEU  11          HD12      LEU  11  -6.988 -10.899   5.565
    8   HD11  LEU  11          HD13      LEU  11  -6.458  -9.733   4.354
    9   HD22  LEU  11          HD21      LEU  11  -8.321  -8.417   7.560
   10   HD21  LEU  11          HD22      LEU  11  -6.786  -8.002   6.798
   11   HD23  LEU  11          HD23      LEU  11  -7.095  -9.660   7.313

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  12           H        ILE  12  -9.908  -6.165   2.835
    2    HA   ILE  12           HA       ILE  12  -8.240  -3.918   2.403
    3    HB   ILE  12           HB       ILE  12 -10.887  -4.612   1.105
    4   HG12  ILE  12          HG12      ILE  12  -8.834  -6.255   1.053
    5   HG13  ILE  12          HG13      ILE  12  -9.714  -5.930  -0.426
    6   HG22  ILE  12          HG21      ILE  12  -9.967  -3.233  -0.791
    7   HG21  ILE  12          HG22      ILE  12  -8.662  -2.716   0.271
    8   HG23  ILE  12          HG23      ILE  12 -10.315  -2.321   0.645
    9   HD12  ILE  12          HD11      ILE  12  -7.224  -5.858  -0.682
   10   HD11  ILE  12          HD12      ILE  12  -7.189  -4.496   0.435
   11   HD13  ILE  12          HD13      ILE  12  -7.999  -4.344  -1.106

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  13           H        ILE  13 -11.599  -4.219   3.492
    2    HA   ILE  13           HA       ILE  13 -12.090  -1.436   3.751
    3    HB   ILE  13           HB       ILE  13 -13.270  -3.866   5.117
    4   HG12  ILE  13          HG12      ILE  13 -13.498  -3.316   2.577
    5   HG13  ILE  13          HG13      ILE  13 -14.914  -3.809   3.480
    6   HG22  ILE  13          HG21      ILE  13 -15.201  -2.146   5.573
    7   HG21  ILE  13          HG22      ILE  13 -13.923  -0.943   5.461
    8   HG23  ILE  13          HG23      ILE  13 -13.831  -2.213   6.679
    9   HD11  ILE  13          HD11      ILE  13 -14.169  -0.908   3.031
   10   HD13  ILE  13          HD12      ILE  13 -15.657  -1.546   3.704
   11   HD12  ILE  13          HD13      ILE  13 -15.296  -1.811   2.012

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ASN  14           H        ASN  14 -10.955  -3.905   6.037
    2    HA   ASN  14           HA       ASN  14 -10.776  -2.256   8.316
    3    HB2  ASN  14           HB2      ASN  14 -10.493  -4.862   8.004
    4    HB3  ASN  14           HB3      ASN  14  -8.788  -4.455   7.848
    5   HD21  ASN  14          HD21      ASN  14  -9.410  -5.979  10.029
    6   HD22  ASN  14          HD22      ASN  14  -9.395  -5.053  11.450

  No H/Q in entry =           6
  In of MODEL    4
    1    H    SER  15           H        SER  15  -8.361  -3.061   5.831
    2    HA   SER  15           HA       SER  15  -6.237  -1.539   6.901
    3    HB2  SER  15           HB2      SER  15  -5.212  -1.747   4.743
    4    HB3  SER  15           HB3      SER  15  -6.145  -3.221   4.976
    5    HG   SER  15           HG       SER  15  -7.475  -2.631   3.447

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLY  16           H        GLY  16  -8.845  -0.712   4.647
    2    HA3  GLY  16           HA2      GLY  16  -8.018   1.937   4.086
    3    HA2  GLY  16           HA3      GLY  16  -9.661   1.321   3.924

  No H/Q in entry =           3
  In of MODEL    4
    1    H    GLN  17           H        GLN  17 -10.200   0.600   6.576
    2    HA   GLN  17           HA       GLN  17 -10.940   3.100   7.706
    3    HB2  GLN  17           HB2      GLN  17 -12.142   0.994   8.194
    4    HB3  GLN  17           HB3      GLN  17 -10.731   0.403   9.073
    5    HG2  GLN  17           HG2      GLN  17 -10.903   2.319  10.627
    6    HG3  GLN  17           HG3      GLN  17 -12.324   2.892   9.755
    7   HE21  GLN  17          HE21      GLN  17 -14.251   2.253  10.714
    8   HE22  GLN  17          HE22      GLN  17 -14.464   0.837  11.627

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ALA  18           H        ALA  18  -8.283   0.854   8.338
    2    HA   ALA  18           HA       ALA  18  -7.205   2.093  10.606
    3    HB2  ALA  18           HB1      ALA  18  -6.565  -0.120   9.248
    4    HB3  ALA  18           HB2      ALA  18  -5.414   0.682  10.317
    5    HB1  ALA  18           HB3      ALA  18  -5.337   0.955   8.576

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ARG  19           H        ARG  19  -6.435   2.613   7.156
    2    HA   ARG  19           HA       ARG  19  -4.564   4.687   7.580
    3    HB2  ARG  19           HB2      ARG  19  -4.873   3.533   5.389
    4    HB3  ARG  19           HB3      ARG  19  -6.426   4.353   5.206
    5    HG2  ARG  19           HG2      ARG  19  -5.327   6.540   5.267
    6    HG3  ARG  19           HG3      ARG  19  -3.768   5.776   5.577
    7    HD2  ARG  19           HD2      ARG  19  -3.897   6.355   3.232
    8    HD3  ARG  19           HD3      ARG  19  -3.958   4.595   3.384
    9    HE   ARG  19           HE       ARG  19  -6.604   5.469   3.369
   10   HH21  ARG  19          HH11      ARG  19  -7.798   5.601   1.448
   11   HH22  ARG  19          HH12      ARG  19  -6.975   5.684  -0.071
   12   HH11  ARG  19          HH21      ARG  19  -3.826   5.561   1.339
   13   HH12  ARG  19          HH22      ARG  19  -4.724   5.659  -0.132

  No H/Q in entry =          13
  In of MODEL    4
    1    H    SER  20           H        SER  20  -8.063   4.752   6.974
    2    HA   SER  20           HA       SER  20  -8.457   7.503   6.913
    3    HB2  SER  20           HB2      SER  20 -10.229   5.860   6.422
    4    HB3  SER  20           HB3      SER  20 -10.279   5.413   8.126
    5    HG   SER  20           HG       SER  20 -10.829   7.956   6.983

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU  21           H        LEU  21  -8.433   5.332   9.727
    2    HA   LEU  21           HA       LEU  21  -8.904   7.329  11.683
    3    HB2  LEU  21           HB2      LEU  21  -7.509   4.650  11.859
    4    HB3  LEU  21           HB3      LEU  21  -7.848   5.667  13.257
    5    HG   LEU  21           HG       LEU  21  -9.991   4.735  11.326
    6   HD13  LEU  21          HD11      LEU  21 -10.514   2.963  12.856
    7   HD12  LEU  21          HD12      LEU  21  -9.367   3.570  14.050
    8   HD11  LEU  21          HD13      LEU  21  -8.781   2.862  12.544
    9   HD21  LEU  21          HD21      LEU  21  -9.954   6.225  13.942
   10   HD23  LEU  21          HD22      LEU  21 -11.343   5.210  13.569
   11   HD22  LEU  21          HD23      LEU  21 -10.923   6.546  12.508

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ALA  22           H        ALA  22  -5.930   5.992  10.286
    2    HA   ALA  22           HA       ALA  22  -4.072   7.338  11.906
    3    HB2  ALA  22           HB1      ALA  22  -3.627   5.483  10.223
    4    HB1  ALA  22           HB2      ALA  22  -2.450   6.796  10.255
    5    HB3  ALA  22           HB3      ALA  22  -3.664   6.730   8.977

  No H/Q in entry =           5
  In of MODEL    4
    1    H    TYR  23           H        TYR  23  -5.398   8.323   8.717
    2    HA   TYR  23           HA       TYR  23  -4.097  10.838   8.639
    3    HB2  TYR  23           HB2      TYR  23  -5.160   9.904   6.649
    4    HB3  TYR  23           HB3      TYR  23  -6.742   9.989   7.426
    5    HD1  TYR  23           HD1      TYR  23  -3.864  12.082   6.297
    6    HD2  TYR  23           HD2      TYR  23  -8.019  11.971   7.377
    7    HE1  TYR  23           HE1      TYR  23  -4.124  14.426   5.528
    8    HE2  TYR  23           HE2      TYR  23  -8.281  14.315   6.608
    9    HH   TYR  23           HH       TYR  23  -5.536  16.102   5.197

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ALA  24           H        ALA  24  -7.205   9.822  10.016
    2    HA   ALA  24           HA       ALA  24  -8.080  12.402  10.775
    3    HB1  ALA  24           HB1      ALA  24  -9.882  11.127  11.244
    4    HB2  ALA  24           HB2      ALA  24  -9.051  10.573  12.696
    5    HB3  ALA  24           HB3      ALA  24  -8.909   9.657  11.197

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA  25           H        ALA  25  -6.046   9.979  12.363
    2    HA   ALA  25           HA       ALA  25  -5.732  11.247  14.861
    3    HB2  ALA  25           HB1      ALA  25  -4.930   8.903  14.051
    4    HB3  ALA  25           HB2      ALA  25  -3.929   9.780  15.211
    5    HB1  ALA  25           HB3      ALA  25  -3.489   9.762  13.502

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU  26           H        LEU  26  -3.939  11.559  11.823
    2    HA   LEU  26           HA       LEU  26  -2.009  13.410  12.736
    3    HB2  LEU  26           HB2      LEU  26  -1.686  12.254  10.637
    4    HB3  LEU  26           HB3      LEU  26  -3.168  12.939   9.976
    5    HG   LEU  26           HG       LEU  26  -2.186  15.204  10.105
    6   HD12  LEU  26          HD11      LEU  26   0.351  15.261  10.524
    7   HD11  LEU  26          HD12      LEU  26   0.149  13.681  11.274
    8   HD13  LEU  26          HD13      LEU  26  -0.680  15.087  11.943
    9   HD21  LEU  26          HD21      LEU  26  -0.411  13.169   8.722
   10   HD23  LEU  26          HD22      LEU  26  -0.478  14.888   8.344
   11   HD22  LEU  26          HD23      LEU  26  -1.886  13.869   8.057

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LYS  27           H        LYS  27  -5.194  13.842  11.250
    2    HA   LYS  27           HA       LYS  27  -5.178  16.630  11.041
    3    HB2  LYS  27           HB2      LYS  27  -6.899  15.125  10.057
    4    HB3  LYS  27           HB3      LYS  27  -7.555  14.866  11.673
    5    HG2  LYS  27           HG2      LYS  27  -8.019  17.267  11.899
    6    HG3  LYS  27           HG3      LYS  27  -7.311  17.567  10.308
    7    HD2  LYS  27           HD2      LYS  27  -9.022  16.105   9.274
    8    HD3  LYS  27           HD3      LYS  27  -9.735  15.821  10.864
    9    HE2  LYS  27           HE2      LYS  27 -10.211  18.227  11.096
   10    HE3  LYS  27           HE3      LYS  27  -9.470  18.532   9.521
   11    HZ3  LYS  27           HZ1      LYS  27 -11.845  18.374   9.275
   12    HZ2  LYS  27           HZ2      LYS  27 -11.874  16.860  10.051
   13    HZ1  LYS  27           HZ3      LYS  27 -11.128  17.027   8.530

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLN  28           H        GLN  28  -6.043  14.543  13.774
    2    HA   GLN  28           HA       GLN  28  -6.969  16.542  15.541
    3    HB2  GLN  28           HB2      GLN  28  -5.529  13.935  16.101
    4    HB3  GLN  28           HB3      GLN  28  -6.295  14.932  17.338
    5    HG2  GLN  28           HG2      GLN  28  -7.725  13.784  14.924
    6    HG3  GLN  28           HG3      GLN  28  -7.775  13.089  16.543
    7   HE21  GLN  28          HE21      GLN  28  -9.673  14.863  14.575
    8   HE22  GLN  28          HE22      GLN  28 -10.444  15.864  15.708

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ALA  29           H        ALA  29  -3.732  15.285  14.863
    2    HA   ALA  29           HA       ALA  29  -2.316  16.709  16.838
    3    HB1  ALA  29           HB1      ALA  29  -0.374  16.039  15.726
    4    HB3  ALA  29           HB2      ALA  29  -1.127  16.147  14.134
    5    HB2  ALA  29           HB3      ALA  29  -1.534  14.813  15.214

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LYS  30           H        LYS  30  -3.178  17.565  13.503
    2    HA   LYS  30           HA       LYS  30  -1.797  20.021  13.396
    3    HB2  LYS  30           HB2      LYS  30  -4.315  19.112  11.986
    4    HB3  LYS  30           HB3      LYS  30  -3.497  20.635  11.638
    5    HG2  LYS  30           HG2      LYS  30  -1.412  19.363  11.133
    6    HG3  LYS  30           HG3      LYS  30  -2.302  17.858  11.382
    7    HD2  LYS  30           HD2      LYS  30  -3.870  18.474   9.582
    8    HD3  LYS  30           HD3      LYS  30  -3.003  19.991   9.335
    9    HE2  LYS  30           HE2      LYS  30  -0.956  18.718   8.764
   10    HE3  LYS  30           HE3      LYS  30  -1.842  17.206   8.980
   11    HZ2  LYS  30           HZ1      LYS  30  -1.671  18.070   6.635
   12    HZ1  LYS  30           HZ2      LYS  30  -2.729  19.323   7.097
   13    HZ3  LYS  30           HZ3      LYS  30  -3.236  17.701   7.173

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLN  31           H        GLN  31  -4.890  19.141  14.806
    2    HA   GLN  31           HA       GLN  31  -5.683  21.892  15.246
    3    HB2  GLN  31           HB2      GLN  31  -6.839  19.439  16.576
    4    HB3  GLN  31           HB3      GLN  31  -7.614  21.001  16.323
    5    HG2  GLN  31           HG2      GLN  31  -6.892  20.222  13.738
    6    HG3  GLN  31           HG3      GLN  31  -7.403  18.715  14.490
    7   HE21  GLN  31          HE21      GLN  31  -8.825  20.267  12.380
    8   HE22  GLN  31          HE22      GLN  31 -10.344  20.646  13.034

  No H/Q in entry =           8
  In of MODEL    4
    1    H    GLY  32           H        GLY  32  -3.354  19.992  16.577
    2    HA3  GLY  32           HA2      GLY  32  -1.960  20.475  18.380
    3    HA2  GLY  32           HA3      GLY  32  -3.102  21.708  18.897

  No H/Q in entry =           3
  In of MODEL    4
    1    H    ASP  33           H        ASP  33  -4.495  18.653  18.244
    2    HA   ASP  33           HA       ASP  33  -4.905  18.202  21.125
    3    HB2  ASP  33           HB2      ASP  33  -6.298  17.168  18.649
    4    HB3  ASP  33           HB3      ASP  33  -6.640  16.560  20.267

  No H/Q in entry =           4
  In of MODEL    4
    1    H    PHE  34           H        PHE  34  -2.729  17.373  21.437
    2    HA   PHE  34           HA       PHE  34  -1.705  15.128  20.046
    3    HB2  PHE  34           HB2      PHE  34  -1.102  16.128  22.838
    4    HB3  PHE  34           HB3      PHE  34  -0.160  14.911  21.976
    5    HD1  PHE  34           HD1      PHE  34  -0.366  18.338  22.699
    6    HD2  PHE  34           HD2      PHE  34   0.494  15.631  19.475
    7    HE1  PHE  34           HE1      PHE  34   0.914  20.117  21.540
    8    HE2  PHE  34           HE2      PHE  34   1.770  17.414  18.321
    9    HZ   PHE  34           HZ       PHE  34   1.982  19.654  19.358

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ALA  35           H        ALA  35  -3.752  15.396  22.905
    2    HA   ALA  35           HA       ALA  35  -3.516  12.739  23.811
    3    HB3  ALA  35           HB1      ALA  35  -5.981  13.345  24.662
    4    HB1  ALA  35           HB2      ALA  35  -5.462  14.967  24.202
    5    HB2  ALA  35           HB3      ALA  35  -4.541  14.056  25.397

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA  36           H        ALA  36  -5.977  14.226  21.702
    2    HA   ALA  36           HA       ALA  36  -7.369  11.799  21.231
    3    HB1  ALA  36           HB1      ALA  36  -8.837  13.205  20.268
    4    HB3  ALA  36           HB2      ALA  36  -7.666  13.632  19.019
    5    HB2  ALA  36           HB3      ALA  36  -7.702  14.524  20.540

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA  37           H        ALA  37  -4.701  13.406  19.560
    2    HA   ALA  37           HA       ALA  37  -4.648  11.763  17.269
    3    HB3  ALA  37           HB1      ALA  37  -2.673  13.498  18.689
    4    HB2  ALA  37           HB2      ALA  37  -3.202  13.544  17.008
    5    HB1  ALA  37           HB3      ALA  37  -2.038  12.326  17.535

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LYS  38           H        LYS  38  -2.892  11.484  20.351
    2    HA   LYS  38           HA       LYS  38  -1.544   9.095  19.872
    3    HB2  LYS  38           HB2      LYS  38  -1.886  10.862  22.011
    4    HB3  LYS  38           HB3      LYS  38  -2.492   9.329  22.631
    5    HG2  LYS  38           HG2      LYS  38  -0.386   8.226  22.102
    6    HG3  LYS  38           HG3      LYS  38   0.210   9.674  21.284
    7    HD2  LYS  38           HD2      LYS  38   0.364  10.901  23.315
    8    HD3  LYS  38           HD3      LYS  38  -0.645   9.744  24.185
    9    HE2  LYS  38           HE2      LYS  38   1.712   9.453  24.808
   10    HE3  LYS  38           HE3      LYS  38   1.123   8.028  23.948
   11    HZ3  LYS  38           HZ1      LYS  38   2.422   8.453  22.167
   12    HZ2  LYS  38           HZ2      LYS  38   3.367   9.294  23.303
   13    HZ1  LYS  38           HZ3      LYS  38   2.281  10.140  22.307

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ALA  39           H        ALA  39  -4.789   9.564  21.268
    2    HA   ALA  39           HA       ALA  39  -5.324   6.841  21.781
    3    HB3  ALA  39           HB1      ALA  39  -7.500   8.763  21.004
    4    HB2  ALA  39           HB2      ALA  39  -6.606   9.003  22.506
    5    HB1  ALA  39           HB3      ALA  39  -7.509   7.510  22.246

  No H/Q in entry =           5
  In of MODEL    4
    1    H    MET  40           H        MET  40  -5.924   8.839  18.927
    2    HA   MET  40           HA       MET  40  -7.379   6.888  17.471
    3    HB2  MET  40           HB2      MET  40  -5.791   9.296  16.560
    4    HB3  MET  40           HB3      MET  40  -6.806   8.323  15.492
    5    HG2  MET  40           HG2      MET  40  -7.857   9.571  18.044
    6    HG3  MET  40           HG3      MET  40  -7.920  10.400  16.491
    7    HE3  MET  40           HE1      MET  40 -10.485   8.749  14.428
    8    HE2  MET  40           HE2      MET  40  -8.733   8.882  14.282
    9    HE1  MET  40           HE3      MET  40  -9.665  10.241  14.910

  No H/Q in entry =           9
  In of MODEL    4
    1    H    MET  41           H        MET  41  -3.896   7.660  17.596
    2    HA   MET  41           HA       MET  41  -3.117   5.906  15.502
    3    HB2  MET  41           HB2      MET  41  -1.511   6.597  17.976
    4    HB3  MET  41           HB3      MET  41  -0.885   5.950  16.463
    5    HG2  MET  41           HG2      MET  41  -2.061   8.118  15.450
    6    HG3  MET  41           HG3      MET  41  -1.834   8.713  17.093
    7    HE2  MET  41           HE1      MET  41   1.105   6.645  17.466
    8    HE1  MET  41           HE2      MET  41   0.302   7.934  18.359
    9    HE3  MET  41           HE3      MET  41   1.924   8.192  17.717

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ASP  42           H        ASP  42  -3.503   5.440  18.989
    2    HA   ASP  42           HA       ASP  42  -2.441   2.858  19.160
    3    HB2  ASP  42           HB2      ASP  42  -3.335   4.614  20.975
    4    HB3  ASP  42           HB3      ASP  42  -4.752   3.574  20.904

  No H/Q in entry =           4
  In of MODEL    4
    1    H    GLN  43           H        GLN  43  -5.785   3.926  18.651
    2    HA   GLN  43           HA       GLN  43  -6.901   1.326  18.462
    3    HB2  GLN  43           HB2      GLN  43  -7.850   3.965  17.323
    4    HB3  GLN  43           HB3      GLN  43  -8.797   2.476  17.304
    5    HG2  GLN  43           HG2      GLN  43  -8.507   2.366  19.813
    6    HG3  GLN  43           HG3      GLN  43  -7.799   3.979  19.737
    7   HE21  GLN  43          HE21      GLN  43  -9.981   4.041  21.234
    8   HE22  GLN  43          HE22      GLN  43 -11.346   4.600  20.398

  No H/Q in entry =           8
  In of MODEL    4
    1    H    SER  44           H        SER  44  -5.580   3.546  16.045
    2    HA   SER  44           HA       SER  44  -6.262   2.047  13.760
    3    HB2  SER  44           HB2      SER  44  -5.031   4.445  14.198
    4    HB3  SER  44           HB3      SER  44  -3.666   3.461  13.673
    5    HG   SER  44           HG       SER  44  -4.785   4.416  11.906

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ARG  45           H        ARG  45  -3.387   1.971  15.846
    2    HA   ARG  45           HA       ARG  45  -1.885   0.027  14.472
    3    HB2  ARG  45           HB2      ARG  45  -1.061   1.463  16.338
    4    HB3  ARG  45           HB3      ARG  45  -2.044   0.526  17.459
    5    HG2  ARG  45           HG2      ARG  45  -0.791  -1.522  16.826
    6    HG3  ARG  45           HG3      ARG  45   0.217  -0.560  15.746
    7    HD2  ARG  45           HD2      ARG  45   0.934   0.834  17.698
    8    HD3  ARG  45           HD3      ARG  45   0.021  -0.246  18.774
    9    HE   ARG  45           HE       ARG  45   1.739  -1.830  17.201
   10   HH21  ARG  45          HH11      ARG  45   3.646  -2.630  18.045
   11   HH22  ARG  45          HH12      ARG  45   4.409  -1.832  19.375
   12   HH11  ARG  45          HH21      ARG  45   2.013   0.647  19.584
   13   HH12  ARG  45          HH22      ARG  45   3.483   0.026  20.244

  No H/Q in entry =          13
  In of MODEL    4
    1    H    MET  46           H        MET  46  -4.283  -0.309  17.069
    2    HA   MET  46           HA       MET  46  -4.088  -3.106  17.385
    3    HB2  MET  46           HB2      MET  46  -6.271  -1.114  17.980
    4    HB3  MET  46           HB3      MET  46  -6.475  -2.836  18.315
    5    HG2  MET  46           HG2      MET  46  -4.496  -2.829  19.744
    6    HG3  MET  46           HG3      MET  46  -4.181  -1.146  19.353
    7    HE2  MET  46           HE1      MET  46  -7.251  -3.060  22.044
    8    HE1  MET  46           HE2      MET  46  -6.382  -3.738  20.672
    9    HE3  MET  46           HE3      MET  46  -7.885  -2.859  20.406

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ALA  47           H        ALA  47  -6.124  -1.116  15.281
    2    HA   ALA  47           HA       ALA  47  -7.720  -3.185  14.218
    3    HB3  ALA  47           HB1      ALA  47  -8.420  -0.956  13.794
    4    HB1  ALA  47           HB2      ALA  47  -7.922  -1.590  12.225
    5    HB2  ALA  47           HB3      ALA  47  -6.854  -0.508  13.121

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU  48           H        LEU  48  -4.612  -1.850  13.169
    2    HA   LEU  48           HA       LEU  48  -4.311  -3.445  10.833
    3    HB2  LEU  48           HB2      LEU  48  -2.269  -2.142  12.642
    4    HB3  LEU  48           HB3      LEU  48  -1.891  -2.864  11.078
    5    HG   LEU  48           HG       LEU  48  -3.935  -0.664  11.456
    6   HD13  LEU  48          HD11      LEU  48  -1.823   0.233  12.124
    7   HD12  LEU  48          HD12      LEU  48  -2.099   0.780  10.470
    8   HD11  LEU  48          HD13      LEU  48  -0.990  -0.556  10.784
    9   HD22  LEU  48          HD21      LEU  48  -4.393  -1.659   9.383
   10   HD21  LEU  48          HD22      LEU  48  -2.706  -2.080   9.092
   11   HD23  LEU  48          HD23      LEU  48  -3.240  -0.406   8.927

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ASN  49           H        ASN  49  -3.269  -3.822  14.183
    2    HA   ASN  49           HA       ASN  49  -1.646  -6.072  13.862
    3    HB2  ASN  49           HB2      ASN  49  -1.670  -4.748  15.906
    4    HB3  ASN  49           HB3      ASN  49  -3.337  -5.206  16.223
    5   HD21  ASN  49          HD21      ASN  49  -0.089  -6.666  15.804
    6   HD22  ASN  49          HD22      ASN  49  -0.367  -7.956  16.873

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLU  50           H        GLU  50  -5.118  -5.825  14.526
    2    HA   GLU  50           HA       GLU  50  -5.607  -8.628  14.642
    3    HB2  GLU  50           HB2      GLU  50  -7.209  -6.951  15.510
    4    HB3  GLU  50           HB3      GLU  50  -7.503  -6.394  13.861
    5    HG2  GLU  50           HG2      GLU  50  -8.349  -8.599  13.228
    6    HG3  GLU  50           HG3      GLU  50  -7.966  -9.235  14.824

  No H/Q in entry =           6
  In of MODEL    4
    1    H    ALA  51           H        ALA  51  -5.689  -6.238  12.039
    2    HA   ALA  51           HA       ALA  51  -6.657  -7.979  10.020
    3    HB2  ALA  51           HB1      ALA  51  -6.448  -6.169   8.646
    4    HB1  ALA  51           HB2      ALA  51  -4.812  -5.806   9.197
    5    HB3  ALA  51           HB3      ALA  51  -6.202  -5.302  10.161

  No H/Q in entry =           5
  In of MODEL    4
    1    H    HIS  52           H        HIS  52  -3.375  -7.044  11.008
    2    HA   HIS  52           HA       HIS  52  -1.961  -8.529   9.066
    3    HB2  HIS  52           HB2      HIS  52  -0.955  -6.778  10.518
    4    HB3  HIS  52           HB3      HIS  52  -1.097  -7.872  11.893
    5    HD1  HIS  52           HD1      HIS  52   0.298 -10.154  11.717
    6    HD2  HIS  52           HD2      HIS  52   1.266  -7.247   8.890
    7    HE1  HIS  52           HE1      HIS  52   2.529 -10.831  10.729
    8    HE2  HIS  52           HE2      HIS  52   3.133  -9.069   9.003

  No H/Q in entry =           8
  In of MODEL    4
    1    H    LEU  53           H        LEU  53  -3.173  -9.405  12.278
    2    HA   LEU  53           HA       LEU  53  -1.958 -11.941  12.482
    3    HB2  LEU  53           HB2      LEU  53  -4.453 -10.772  13.688
    4    HB3  LEU  53           HB3      LEU  53  -3.985 -12.444  13.984
    5    HG   LEU  53           HG       LEU  53  -2.098 -10.114  14.459
    6   HD12  LEU  53          HD11      LEU  53  -2.706 -10.602  16.920
    7   HD11  LEU  53          HD12      LEU  53  -4.137 -11.403  16.273
    8   HD13  LEU  53          HD13      LEU  53  -3.875  -9.690  15.970
    9   HD21  LEU  53          HD21      LEU  53  -2.114 -13.053  15.174
   10   HD23  LEU  53          HD22      LEU  53  -1.197 -11.900  16.138
   11   HD22  LEU  53          HD23      LEU  53  -0.814 -12.119  14.441

  No H/Q in entry =          11
  In of MODEL    4
    1    H    VAL  54           H        VAL  54  -5.073 -10.937  11.110
    2    HA   VAL  54           HA       VAL  54  -5.968 -13.539  10.428
    3    HB   VAL  54           HB       VAL  54  -6.630 -10.814   9.284
    4   HG12  VAL  54          HG11      VAL  54  -8.721 -12.208   8.472
    5   HG11  VAL  54          HG12      VAL  54  -7.601 -13.566   8.550
    6   HG13  VAL  54          HG13      VAL  54  -7.248 -12.192   7.505
    7   HG22  VAL  54          HG21      VAL  54  -7.542 -10.851  11.434
    8   HG21  VAL  54          HG22      VAL  54  -7.784 -12.596  11.419
    9   HG23  VAL  54          HG23      VAL  54  -8.870 -11.549  10.507

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLN  55           H        GLN  55  -4.108 -11.080   8.636
    2    HA   GLN  55           HA       GLN  55  -3.963 -12.551   6.223
    3    HB2  GLN  55           HB2      GLN  55  -3.373 -10.283   6.028
    4    HB3  GLN  55           HB3      GLN  55  -2.265 -10.348   7.396
    5    HG2  GLN  55           HG2      GLN  55  -0.540 -11.187   6.126
    6    HG3  GLN  55           HG3      GLN  55  -1.605 -12.172   5.132
    7   HE21  GLN  55          HE21      GLN  55  -1.622 -11.488   3.009
    8   HE22  GLN  55          HE22      GLN  55  -1.433  -9.884   2.494

  No H/Q in entry =           8
  In of MODEL    4
    1    H    THR  56           H        THR  56  -1.864 -12.508   9.108
    2    HA   THR  56           HA       THR  56   0.226 -14.097   8.200
    3    HB   THR  56           HB       THR  56  -1.019 -14.350  10.946
    4    HG1  THR  56           HG1      THR  56   0.081 -12.223   9.698
    5   HG21  THR  56          HG21      THR  56   0.928 -15.854  10.048
    6   HG23  THR  56          HG22      THR  56   1.074 -15.120  11.646
    7   HG22  THR  56          HG23      THR  56   1.906 -14.404  10.265

  No H/Q in entry =           7
  In of MODEL    4
    1    H    LYS  57           H        LYS  57  -2.890 -15.148   9.559
    2    HA   LYS  57           HA       LYS  57  -2.427 -17.942   9.323
    3    HB2  LYS  57           HB2      LYS  57  -4.255 -16.859  10.661
    4    HB3  LYS  57           HB3      LYS  57  -5.046 -16.418   9.156
    5    HG2  LYS  57           HG2      LYS  57  -5.300 -18.768   8.553
    6    HG3  LYS  57           HG3      LYS  57  -4.422 -19.261   9.997
    7    HD2  LYS  57           HD2      LYS  57  -6.186 -18.235  11.408
    8    HD3  LYS  57           HD3      LYS  57  -7.079 -17.789   9.954
    9    HE2  LYS  57           HE2      LYS  57  -6.317 -20.644  10.662
   10    HE3  LYS  57           HE3      LYS  57  -7.890 -19.939  11.021
   11    HZ3  LYS  57           HZ1      LYS  57  -8.535 -20.244   8.941
   12    HZ2  LYS  57           HZ2      LYS  57  -7.116 -21.140   8.680
   13    HZ1  LYS  57           HZ3      LYS  57  -7.153 -19.480   8.319

  No H/Q in entry =          13
  In of MODEL    4
    1    H    LEU  58           H        LEU  58  -3.768 -15.514   7.137
    2    HA   LEU  58           HA       LEU  58  -4.555 -17.349   5.134
    3    HB2  LEU  58           HB2      LEU  58  -3.965 -14.398   4.991
    4    HB3  LEU  58           HB3      LEU  58  -4.620 -15.342   3.653
    5    HG   LEU  58           HG       LEU  58  -5.907 -15.162   6.397
    6   HD11  LEU  58          HD11      LEU  58  -6.211 -13.524   3.900
    7   HD13  LEU  58          HD12      LEU  58  -6.208 -13.012   5.587
    8   HD12  LEU  58          HD13      LEU  58  -7.625 -13.815   4.914
    9   HD22  LEU  58          HD21      LEU  58  -6.857 -17.079   5.531
   10   HD21  LEU  58          HD22      LEU  58  -6.516 -16.630   3.859
   11   HD23  LEU  58          HD23      LEU  58  -7.886 -15.910   4.705

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  59           H        ILE  59  -1.429 -16.118   5.999
    2    HA   ILE  59           HA       ILE  59  -0.320 -16.847   3.367
    3    HB   ILE  59           HB       ILE  59   0.432 -14.772   4.931
    4   HG12  ILE  59          HG12      ILE  59   2.540 -16.415   3.513
    5   HG13  ILE  59          HG13      ILE  59   1.339 -15.489   2.649
    6   HG21  ILE  59          HG21      ILE  59   1.185 -16.537   6.698
    7   HG23  ILE  59          HG22      ILE  59   2.279 -15.222   6.332
    8   HG22  ILE  59          HG23      ILE  59   2.538 -16.818   5.628
    9   HD12  ILE  59          HD11      ILE  59   3.487 -14.248   2.999
   10   HD11  ILE  59          HD12      ILE  59   3.176 -14.309   4.733
   11   HD13  ILE  59          HD13      ILE  59   2.083 -13.422   3.670

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLU  60           H        GLU  60  -0.333 -17.943   6.738
    2    HA   GLU  60           HA       GLU  60   1.710 -19.910   6.485
    3    HB2  GLU  60           HB2      GLU  60   0.902 -19.098   8.665
    4    HB3  GLU  60           HB3      GLU  60  -0.670 -19.837   8.361
    5    HG2  GLU  60           HG2      GLU  60   0.417 -22.064   8.228
    6    HG3  GLU  60           HG3      GLU  60   1.973 -21.312   8.572

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLY  61           H        GLY  61  -1.799 -20.029   5.990
    2    HA3  GLY  61           HA2      GLY  61  -1.533 -22.823   5.041
    3    HA2  GLY  61           HA3      GLY  61  -3.024 -22.094   5.628

  No H/Q in entry =           3
  In of MODEL    4
    1    H    ASP  62           H        ASP  62  -0.799 -20.507   3.427
    2    HA   ASP  62           HA       ASP  62  -2.851 -19.893   1.562
    3    HB2  ASP  62           HB2      ASP  62  -0.920 -19.058   0.185
    4    HB3  ASP  62           HB3      ASP  62  -0.987 -18.399   1.817

  No H/Q in entry =           4
  In of MODEL    4
    1    H    ALA  63           H        ALA  63  -3.711 -21.155  -0.001
    2    HA   ALA  63           HA       ALA  63  -2.032 -23.340  -1.123
    3    HB3  ALA  63           HB1      ALA  63  -4.036 -23.995   0.346
    4    HB1  ALA  63           HB2      ALA  63  -3.874 -24.765  -1.231
    5    HB2  ALA  63           HB3      ALA  63  -5.029 -23.451  -1.008

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLY  64           H        GLY  64  -5.049 -21.574  -1.843
    2    HA3  GLY  64           HA2      GLY  64  -5.773 -20.480  -3.730
    3    HA2  GLY  64           HA3      GLY  64  -4.100 -20.399  -4.255

  No H/Q in entry =           3
  In of MODEL    4
    1    H    GLU  65           H        GLU  65  -3.831 -21.308  -6.211
    2    HA   GLU  65           HA       GLU  65  -5.752 -22.982  -7.410
    3    HB2  GLU  65           HB2      GLU  65  -2.880 -22.425  -8.138
    4    HB3  GLU  65           HB3      GLU  65  -3.978 -23.370  -9.144
    5    HG2  GLU  65           HG2      GLU  65  -5.518 -21.480  -9.303
    6    HG3  GLU  65           HG3      GLU  65  -4.503 -20.533  -8.218

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLY  66           H        GLY  66  -2.876 -23.680  -5.624
    2    HA3  GLY  66           HA2      GLY  66  -3.633 -26.429  -5.220
    3    HA2  GLY  66           HA3      GLY  66  -2.173 -26.231  -6.167

  No H/Q in entry =           3
  In of MODEL    4
    1    H    LYS  67           H        LYS  67  -1.683 -27.629  -4.123
    2    HA   LYS  67           HA       LYS  67  -1.355 -26.472  -1.606
    3    HB2  LYS  67           HB2      LYS  67   0.029 -28.797  -2.930
    4    HB3  LYS  67           HB3      LYS  67   0.232 -28.384  -1.223
    5    HG2  LYS  67           HG2      LYS  67  -2.212 -28.521  -0.896
    6    HG3  LYS  67           HG3      LYS  67  -2.416 -28.946  -2.594
    7    HD2  LYS  67           HD2      LYS  67  -1.074 -30.986  -2.249
    8    HD3  LYS  67           HD3      LYS  67  -0.868 -30.562  -0.548
    9    HE2  LYS  67           HE2      LYS  67  -3.310 -30.641  -0.223
   10    HE3  LYS  67           HE3      LYS  67  -3.528 -31.050  -1.923
   11    HZ3  LYS  67           HZ1      LYS  67  -3.570 -33.083  -0.828
   12    HZ2  LYS  67           HZ2      LYS  67  -2.295 -32.671   0.216
   13    HZ1  LYS  67           HZ3      LYS  67  -1.985 -32.992  -1.423

  No H/Q in entry =          13
  In of MODEL    4
    1    H    MET  68           H        MET  68   0.953 -26.766  -4.235
    2    HA   MET  68           HA       MET  68   3.214 -25.696  -2.930
    3    HB2  MET  68           HB2      MET  68   2.515 -25.860  -5.863
    4    HB3  MET  68           HB3      MET  68   4.114 -25.467  -5.229
    5    HG2  MET  68           HG2      MET  68   2.589 -28.022  -4.647
    6    HG3  MET  68           HG3      MET  68   3.921 -27.875  -5.795
    7    HE3  MET  68           HE1      MET  68   7.011 -27.385  -4.012
    8    HE2  MET  68           HE2      MET  68   6.117 -25.866  -4.050
    9    HE1  MET  68           HE3      MET  68   5.992 -26.990  -5.402

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LYS  69           H        LYS  69   0.732 -24.123  -4.938
    2    HA   LYS  69           HA       LYS  69   2.103 -21.577  -4.741
    3    HB2  LYS  69           HB2      LYS  69  -0.391 -22.390  -6.202
    4    HB3  LYS  69           HB3      LYS  69   0.222 -20.732  -6.164
    5    HG2  LYS  69           HG2      LYS  69   2.381 -21.494  -7.060
    6    HG3  LYS  69           HG3      LYS  69   1.792 -23.157  -7.086
    7    HD2  LYS  69           HD2      LYS  69   0.016 -22.503  -8.670
    8    HD3  LYS  69           HD3      LYS  69   0.617 -20.843  -8.653
    9    HE2  LYS  69           HE2      LYS  69   2.792 -21.609  -9.518
   10    HE3  LYS  69           HE3      LYS  69   2.208 -23.274  -9.521
   11    HZ1  LYS  69           HZ1      LYS  69   0.541 -21.350 -10.910
   12    HZ3  LYS  69           HZ2      LYS  69   0.970 -22.936 -11.344
   13    HZ2  LYS  69           HZ3      LYS  69   2.050 -21.654 -11.623

  No H/Q in entry =          13
  In of MODEL    4
    1    H    VAL  70           H        VAL  70   0.172 -19.684  -4.726
    2    HA   VAL  70           HA       VAL  70  -1.246 -19.979  -2.142
    3    HB   VAL  70           HB       VAL  70  -0.583 -17.656  -1.586
    4   HG11  VAL  70          HG11      VAL  70   0.818 -19.834  -1.084
    5   HG13  VAL  70          HG12      VAL  70   1.494 -18.246  -0.718
    6   HG12  VAL  70          HG13      VAL  70   1.980 -19.094  -2.186
    7   HG22  VAL  70          HG21      VAL  70  -0.190 -16.623  -3.704
    8   HG21  VAL  70          HG22      VAL  70   0.914 -17.901  -4.207
    9   HG23  VAL  70          HG23      VAL  70   1.414 -16.743  -2.977

  No H/Q in entry =           9
  In of MODEL    4
    1    H    SER  71           H        SER  71  -2.984 -18.430  -1.875
    2    HA   SER  71           HA       SER  71  -4.671 -18.175  -4.143
    3    HB2  SER  71           HB2      SER  71  -5.548 -18.277  -1.821
    4    HB3  SER  71           HB3      SER  71  -4.796 -16.725  -1.472
    5    HG   SER  71           HG       SER  71  -6.081 -15.899  -3.256

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU  72           H        LEU  72  -5.072 -16.445  -5.492
    2    HA   LEU  72           HA       LEU  72  -2.975 -14.621  -5.975
    3    HB2  LEU  72           HB2      LEU  72  -5.838 -14.691  -6.924
    4    HB3  LEU  72           HB3      LEU  72  -4.644 -13.534  -7.504
    5    HG   LEU  72           HG       LEU  72  -4.235 -16.540  -7.622
    6   HD13  LEU  72          HD11      LEU  72  -4.836 -16.367 -10.000
    7   HD12  LEU  72          HD12      LEU  72  -5.179 -14.649  -9.799
    8   HD11  LEU  72          HD13      LEU  72  -6.185 -15.850  -8.988
    9   HD21  LEU  72          HD21      LEU  72  -2.772 -14.125  -8.678
   10   HD23  LEU  72          HD22      LEU  72  -2.648 -15.650  -9.539
   11   HD22  LEU  72          HD23      LEU  72  -2.113 -15.541  -7.865

  No H/Q in entry =          11
  In of MODEL    4
    1    H    VAL  73           H        VAL  73  -6.073 -14.280  -4.351
    2    HA   VAL  73           HA       VAL  73  -6.137 -11.509  -4.007
    3    HB   VAL  73           HB       VAL  73  -7.838 -11.883  -2.392
    4   HG11  VAL  73          HG11      VAL  73  -8.228 -12.626  -4.799
    5   HG13  VAL  73          HG12      VAL  73  -9.307 -13.332  -3.597
    6   HG12  VAL  73          HG13      VAL  73  -7.962 -14.278  -4.237
    7   HG23  VAL  73          HG21      VAL  73  -8.138 -14.399  -1.660
    8   HG22  VAL  73          HG22      VAL  73  -6.984 -13.370  -0.810
    9   HG21  VAL  73          HG23      VAL  73  -6.418 -14.507  -2.035

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LEU  74           H        LEU  74  -4.186 -13.860  -2.414
    2    HA   LEU  74           HA       LEU  74  -3.786 -12.711   0.106
    3    HB2  LEU  74           HB2      LEU  74  -2.984 -14.922  -0.375
    4    HB3  LEU  74           HB3      LEU  74  -1.944 -14.315  -1.663
    5    HG   LEU  74           HG       LEU  74  -0.642 -13.029   0.007
    6   HD11  LEU  74          HD11      LEU  74  -2.666 -14.273   1.877
    7   HD13  LEU  74          HD12      LEU  74  -2.205 -12.575   1.743
    8   HD12  LEU  74          HD13      LEU  74  -1.084 -13.740   2.448
    9   HD21  LEU  74          HD21      LEU  74  -0.382 -15.575  -0.620
   10   HD23  LEU  74          HD22      LEU  74  -0.826 -15.788   1.058
   11   HD22  LEU  74          HD23      LEU  74   0.601 -14.862   0.656

  No H/Q in entry =          11
  In of MODEL    4
    1    H    VAL  75           H        VAL  75  -1.894 -12.311  -2.850
    2    HA   VAL  75           HA       VAL  75  -0.111 -10.372  -1.841
    3    HB   VAL  75           HB       VAL  75  -1.060 -10.865  -4.665
    4   HG12  VAL  75          HG11      VAL  75   1.005  -9.553  -5.280
    5   HG11  VAL  75          HG12      VAL  75   1.197  -9.141  -3.582
    6   HG13  VAL  75          HG13      VAL  75  -0.209  -8.571  -4.468
    7   HG21  VAL  75          HG21      VAL  75   0.226 -12.656  -3.326
    8   HG23  VAL  75          HG22      VAL  75   1.592 -11.539  -3.367
    9   HG22  VAL  75          HG23      VAL  75   0.927 -12.175  -4.873

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLU  76           H        GLU  76  -3.261 -10.050  -3.504
    2    HA   GLU  76           HA       GLU  76  -3.332  -7.236  -3.611
    3    HB2  GLU  76           HB2      GLU  76  -4.979  -8.695  -4.771
    4    HB3  GLU  76           HB3      GLU  76  -5.635  -9.184  -3.216
    5    HG2  GLU  76           HG2      GLU  76  -7.091  -7.483  -4.116
    6    HG3  GLU  76           HG3      GLU  76  -6.221  -6.759  -2.777

  No H/Q in entry =           6
  In of MODEL    4
    1    H    ALA  77           H        ALA  77  -4.431  -9.466  -1.068
    2    HA   ALA  77           HA       ALA  77  -5.403  -7.467   0.685
    3    HB2  ALA  77           HB1      ALA  77  -5.818  -9.974   0.824
    4    HB3  ALA  77           HB2      ALA  77  -5.470  -9.167   2.353
    5    HB1  ALA  77           HB3      ALA  77  -4.215 -10.108   1.549

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLN  78           H        GLN  78  -2.245  -8.996   0.328
    2    HA   GLN  78           HA       GLN  78  -0.997  -7.823   2.577
    3    HB2  GLN  78           HB2      GLN  78  -0.143  -9.763   1.182
    4    HB3  GLN  78           HB3      GLN  78   0.342  -8.581  -0.031
    5    HG2  GLN  78           HG2      GLN  78   1.789  -7.467   1.593
    6    HG3  GLN  78           HG3      GLN  78   1.267  -8.579   2.855
    7   HE21  GLN  78          HE21      GLN  78   1.271 -10.997   1.231
    8   HE22  GLN  78          HE22      GLN  78   2.890 -11.350   0.859

  No H/Q in entry =           8
  In of MODEL    4
    1    H    LEU  79           H        LEU  79  -1.367  -6.772  -0.773
    2    HA   LEU  79           HA       LEU  79   0.306  -4.534  -0.762
    3    HB2  LEU  79           HB2      LEU  79  -0.713  -5.352  -2.816
    4    HB3  LEU  79           HB3      LEU  79  -2.320  -4.968  -2.210
    5    HG   LEU  79           HG       LEU  79  -1.790  -2.578  -2.189
    6   HD13  LEU  79          HD11      LEU  79   0.448  -2.320  -1.674
    7   HD12  LEU  79          HD12      LEU  79   0.498  -2.036  -3.414
    8   HD11  LEU  79          HD13      LEU  79   0.960  -3.610  -2.763
    9   HD23  LEU  79          HD21      LEU  79  -1.154  -2.381  -4.741
   10   HD22  LEU  79          HD22      LEU  79  -2.676  -3.137  -4.282
   11   HD21  LEU  79          HD23      LEU  79  -1.297  -4.139  -4.722

  No H/Q in entry =          11
  In of MODEL    4
    1    H    HIS  80           H        HIS  80  -3.161  -4.715   0.060
    2    HA   HIS  80           HA       HIS  80  -3.368  -1.958   0.717
    3    HB2  HIS  80           HB2      HIS  80  -5.057  -4.376   1.039
    4    HB3  HIS  80           HB3      HIS  80  -5.386  -3.035   2.140
    5    HD1  HIS  80           HD1      HIS  80  -7.012  -1.409   1.227
    6    HD2  HIS  80           HD2      HIS  80  -4.805  -3.216  -1.814
    7    HE1  HIS  80           HE1      HIS  80  -7.854  -0.422  -0.956
    8    HE2  HIS  80           HE2      HIS  80  -6.516  -1.518  -2.818

  No H/Q in entry =           8
  In of MODEL    4
    1    H    LEU  81           H        LEU  81  -2.866  -4.846   2.717
    2    HA   LEU  81           HA       LEU  81  -2.864  -3.493   5.199
    3    HB2  LEU  81           HB2      LEU  81  -1.630  -6.105   4.326
    4    HB3  LEU  81           HB3      LEU  81  -1.609  -5.542   5.999
    5    HG   LEU  81           HG       LEU  81  -4.152  -5.812   4.369
    6   HD12  LEU  81          HD11      LEU  81  -4.446  -7.875   5.920
    7   HD11  LEU  81          HD12      LEU  81  -2.694  -7.795   6.108
    8   HD13  LEU  81          HD13      LEU  81  -3.400  -8.033   4.509
    9   HD23  LEU  81          HD21      LEU  81  -4.997  -6.014   6.869
   10   HD22  LEU  81          HD22      LEU  81  -4.680  -4.425   6.176
   11   HD21  LEU  81          HD23      LEU  81  -3.490  -5.176   7.239

  No H/Q in entry =          11
  In of MODEL    4
    1    H    MET  82           H        MET  82  -0.176  -4.388   3.033
    2    HA   MET  82           HA       MET  82   1.901  -3.479   4.717
    3    HB2  MET  82           HB2      MET  82   1.691  -3.829   1.726
    4    HB3  MET  82           HB3      MET  82   3.169  -3.249   2.489
    5    HG2  MET  82           HG2      MET  82   1.774  -5.844   3.218
    6    HG3  MET  82           HG3      MET  82   3.146  -5.730   2.119
    7    HE3  MET  82           HE1      MET  82   6.156  -4.975   4.105
    8    HE2  MET  82           HE2      MET  82   5.227  -3.613   3.482
    9    HE1  MET  82           HE3      MET  82   5.324  -5.105   2.550

  No H/Q in entry =           9
  In of MODEL    4
    1    H    THR  83           H        THR  83   0.074  -1.852   2.155
    2    HA   THR  83           HA       THR  83   1.474   0.603   2.237
    3    HB   THR  83           HB       THR  83  -0.705   1.516   1.246
    4    HG1  THR  83           HG1      THR  83  -2.349   0.211   1.141
    5   HG22  THR  83          HG21      THR  83  -0.424  -0.306  -0.750
    6   HG21  THR  83          HG22      THR  83   1.077  -0.589   0.129
    7   HG23  THR  83          HG23      THR  83   0.709   1.021  -0.490

  No H/Q in entry =           7
  In of MODEL    4
    1    H    SER  84           H        SER  84  -1.529  -0.439   3.837
    2    HA   SER  84           HA       SER  84  -2.037   1.992   5.176
    3    HB2  SER  84           HB2      SER  84  -2.858  -0.848   5.746
    4    HB3  SER  84           HB3      SER  84  -3.358   0.493   6.775
    5    HG   SER  84           HG       SER  84  -3.813   0.170   3.983

  No H/Q in entry =           5
  In of MODEL    4
    1    H    MET  85           H        MET  85  -0.316  -0.930   6.314
    2    HA   MET  85           HA       MET  85   0.197   0.005   8.917
    3    HB2  MET  85           HB2      MET  85   0.500  -2.339   8.241
    4    HB3  MET  85           HB3      MET  85   1.885  -1.871   7.253
    5    HG2  MET  85           HG2      MET  85   3.057  -1.045   9.247
    6    HG3  MET  85           HG3      MET  85   1.659  -1.439  10.248
    7    HE3  MET  85           HE1      MET  85   3.284  -3.822   7.240
    8    HE2  MET  85           HE2      MET  85   4.694  -4.153   8.244
    9    HE1  MET  85           HE3      MET  85   4.256  -2.488   7.874

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LEU  86           H        LEU  86   2.134   0.262   5.967
    2    HA   LEU  86           HA       LEU  86   4.342   1.584   7.121
    3    HB2  LEU  86           HB2      LEU  86   4.157   0.495   4.815
    4    HB3  LEU  86           HB3      LEU  86   3.343   1.972   4.298
    5    HG   LEU  86           HG       LEU  86   5.366   3.229   5.277
    6   HD11  LEU  86          HD11      LEU  86   6.080   0.622   6.084
    7   HD13  LEU  86          HD12      LEU  86   7.078   2.071   6.179
    8   HD12  LEU  86          HD13      LEU  86   7.193   1.020   4.770
    9   HD23  LEU  86          HD21      LEU  86   6.092   1.463   2.932
   10   HD22  LEU  86          HD22      LEU  86   6.478   3.162   3.190
   11   HD21  LEU  86          HD23      LEU  86   4.828   2.687   2.791

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ALA  87           H        ALA  87   1.426   2.812   5.531
    2    HA   ALA  87           HA       ALA  87   2.009   5.544   5.608
    3    HB1  ALA  87           HB1      ALA  87  -0.293   3.906   5.069
    4    HB3  ALA  87           HB2      ALA  87   0.012   5.567   4.565
    5    HB2  ALA  87           HB3      ALA  87  -0.782   5.246   6.109

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ARG  88           H        ARG  88   0.325   3.542   8.002
    2    HA   ARG  88           HA       ARG  88  -0.197   5.594   9.843
    3    HB2  ARG  88           HB2      ARG  88  -1.126   3.238   9.914
    4    HB3  ARG  88           HB3      ARG  88   0.416   2.746  10.623
    5    HG2  ARG  88           HG2      ARG  88  -0.070   4.823  12.237
    6    HG3  ARG  88           HG3      ARG  88  -1.735   4.490  11.780
    7    HD2  ARG  88           HD2      ARG  88  -1.836   2.644  13.032
    8    HD3  ARG  88           HD3      ARG  88  -0.244   2.067  12.504
    9    HE   ARG  88           HE       ARG  88  -0.785   3.334  14.954
   10   HH21  ARG  88          HH11      ARG  88   0.767   4.356  16.191
   11   HH22  ARG  88          HH12      ARG  88   2.286   4.787  15.487
   12   HH11  ARG  88          HH21      ARG  88   1.497   3.518  12.379
   13   HH12  ARG  88          HH22      ARG  88   2.707   4.297  13.340

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLU  89           H        GLU  89   2.609   3.386   9.628
    2    HA   GLU  89           HA       GLU  89   3.864   4.287  11.971
    3    HB2  GLU  89           HB2      GLU  89   4.533   2.268  10.633
    4    HB3  GLU  89           HB3      GLU  89   5.305   3.362   9.485
    5    HG2  GLU  89           HG2      GLU  89   6.785   4.220  11.228
    6    HG3  GLU  89           HG3      GLU  89   5.953   3.263  12.449

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LEU  90           H        LEU  90   4.180   5.437   8.641
    2    HA   LEU  90           HA       LEU  90   6.100   7.448   9.222
    3    HB2  LEU  90           HB2      LEU  90   4.098   7.101   6.994
    4    HB3  LEU  90           HB3      LEU  90   5.323   8.377   7.013
    5    HG   LEU  90           HG       LEU  90   6.010   5.445   7.355
    6   HD12  LEU  90          HD11      LEU  90   6.760   5.675   4.916
    7   HD11  LEU  90          HD12      LEU  90   5.738   7.111   4.862
    8   HD13  LEU  90          HD13      LEU  90   5.025   5.536   5.209
    9   HD22  LEU  90          HD21      LEU  90   7.901   6.605   8.036
   10   HD21  LEU  90          HD22      LEU  90   7.546   8.006   7.025
   11   HD23  LEU  90          HD23      LEU  90   8.213   6.542   6.303

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  91           H        ILE  91   2.562   7.446   9.070
    2    HA   ILE  91           HA       ILE  91   2.205  10.218   9.513
    3    HB   ILE  91           HB       ILE  91   0.425   7.835  10.060
    4   HG12  ILE  91          HG12      ILE  91   0.168  10.109   8.068
    5   HG13  ILE  91          HG13      ILE  91   1.036   8.618   7.701
    6   HG22  ILE  91          HG21      ILE  91  -1.317   9.884  10.116
    7   HG21  ILE  91          HG22      ILE  91   0.079  10.724  10.788
    8   HG23  ILE  91          HG23      ILE  91  -0.551   9.285  11.587
    9   HD13  ILE  91          HD11      ILE  91  -0.902   7.321   7.747
   10   HD12  ILE  91          HD12      ILE  91  -1.498   8.831   7.061
   11   HD11  ILE  91          HD13      ILE  91  -1.769   8.471   8.766

  No H/Q in entry =          11
  In of MODEL    4
    1    H    THR  92           H        THR  92   2.620   7.485  11.722
    2    HA   THR  92           HA       THR  92   2.167   8.863  14.141
    3    HB   THR  92           HB       THR  92   3.989   6.536  13.485
    4    HG1  THR  92           HG1      THR  92   2.024   5.768  13.384
    5   HG22  THR  92          HG21      THR  92   3.604   6.257  16.119
    6   HG21  THR  92          HG22      THR  92   3.529   8.016  16.041
    7   HG23  THR  92          HG23      THR  92   4.968   7.166  15.472

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLU  93           H        GLU  93   5.123   8.425  12.213
    2    HA   GLU  93           HA       GLU  93   6.866   9.867  13.908
    3    HB2  GLU  93           HB2      GLU  93   6.960   9.544  10.894
    4    HB3  GLU  93           HB3      GLU  93   8.296  10.085  11.908
    5    HG2  GLU  93           HG2      GLU  93   6.901   7.441  12.362
    6    HG3  GLU  93           HG3      GLU  93   8.286   7.598  11.287

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LEU  94           H        LEU  94   4.815  10.862  11.189
    2    HA   LEU  94           HA       LEU  94   5.603  13.570  11.082
    3    HB2  LEU  94           HB2      LEU  94   3.023  12.187  10.329
    4    HB3  LEU  94           HB3      LEU  94   3.271  13.915  10.082
    5    HG   LEU  94           HG       LEU  94   5.302  11.936   9.041
    6   HD11  LEU  94          HD11      LEU  94   2.558  12.467   7.973
    7   HD13  LEU  94          HD12      LEU  94   3.550  11.016   7.853
    8   HD12  LEU  94          HD13      LEU  94   3.878  12.395   6.805
    9   HD23  LEU  94          HD21      LEU  94   5.543  13.769   7.313
   10   HD22  LEU  94          HD22      LEU  94   5.952  14.269   8.954
   11   HD21  LEU  94          HD23      LEU  94   4.399  14.725   8.252

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  95           H        ILE  95   3.073  11.943  12.974
    2    HA   ILE  95           HA       ILE  95   2.014  14.289  14.161
    3    HB   ILE  95           HB       ILE  95   2.048  11.410  15.094
    4   HG12  ILE  95          HG12      ILE  95  -0.183  13.166  14.036
    5   HG13  ILE  95          HG13      ILE  95   0.783  12.110  13.009
    6   HG21  ILE  95          HG21      ILE  95   0.748  13.878  16.286
    7   HG23  ILE  95          HG22      ILE  95   1.803  12.719  17.096
    8   HG22  ILE  95          HG23      ILE  95   0.171  12.245  16.620
    9   HD13  ILE  95          HD11      ILE  95  -0.109  10.168  13.933
   10   HD12  ILE  95          HD12      ILE  95  -1.498  11.248  14.004
   11   HD11  ILE  95          HD13      ILE  95  -0.533  10.961  15.451

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLU  96           H        GLU  96   4.622  12.091  15.167
    2    HA   GLU  96           HA       GLU  96   5.165  13.301  17.656
    3    HB2  GLU  96           HB2      GLU  96   6.129  11.147  17.017
    4    HB3  GLU  96           HB3      GLU  96   7.059  11.923  15.736
    5    HG2  GLU  96           HG2      GLU  96   8.701  12.488  17.199
    6    HG3  GLU  96           HG3      GLU  96   7.547  13.296  18.250

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LEU  97           H        LEU  97   6.239  14.071  14.369
    2    HA   LEU  97           HA       LEU  97   8.110  16.083  15.078
    3    HB2  LEU  97           HB2      LEU  97   6.526  15.515  12.582
    4    HB3  LEU  97           HB3      LEU  97   7.535  16.954  12.701
    5    HG   LEU  97           HG       LEU  97   8.584  14.166  13.271
    6   HD12  LEU  97          HD11      LEU  97   9.582  14.360  10.955
    7   HD11  LEU  97          HD12      LEU  97   8.521  15.742  10.685
    8   HD13  LEU  97          HD13      LEU  97   7.833  14.146  10.984
    9   HD23  LEU  97          HD21      LEU  97  10.744  15.459  12.528
   10   HD22  LEU  97          HD22      LEU  97  10.121  15.729  14.155
   11   HD21  LEU  97          HD23      LEU  97   9.800  16.905  12.882

  No H/Q in entry =          11
  In of MODEL    4
    1    H    HIS  98           H        HIS  98   4.618  16.190  14.418
    2    HA   HIS  98           HA       HIS  98   4.297  18.988  14.544
    3    HB2  HIS  98           HB2      HIS  98   2.423  16.725  15.274
    4    HB3  HIS  98           HB3      HIS  98   1.943  18.422  15.323
    5    HD1  HIS  98           HD1      HIS  98   2.989  15.707  12.929
    6    HD2  HIS  98           HD2      HIS  98   1.583  19.630  12.792
    7    HE1  HIS  98           HE1      HIS  98   2.430  16.184  10.502
    8    HE2  HIS  98           HE2      HIS  98   1.577  18.567  10.398

  No H/Q in entry =           8
  In of MODEL    4
    1    H    GLU  99           H        GLU  99   4.446  16.508  17.051
    2    HA   GLU  99           HA       GLU  99   3.821  18.204  19.242
    3    HB2  GLU  99           HB2      GLU  99   3.751  15.722  19.347
    4    HB3  GLU  99           HB3      GLU  99   5.512  15.691  19.242
    5    HG2  GLU  99           HG2      GLU  99   5.687  16.991  21.312
    6    HG3  GLU  99           HG3      GLU  99   3.933  17.118  21.404

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LYS 100           H        LYS 100   6.884  17.293  17.685
    2    HA   LYS 100           HA       LYS 100   8.525  18.712  19.540
    3    HB2  LYS 100           HB2      LYS 100   9.036  17.783  16.705
    4    HB3  LYS 100           HB3      LYS 100  10.258  18.565  17.713
    5    HG2  LYS 100           HG2      LYS 100   9.893  16.817  19.458
    6    HG3  LYS 100           HG3      LYS 100   8.769  16.001  18.368
    7    HD2  LYS 100           HD2      LYS 100  10.567  15.727  16.705
    8    HD3  LYS 100           HD3      LYS 100  11.696  16.555  17.780
    9    HE2  LYS 100           HE2      LYS 100  11.311  14.802  19.503
   10    HE3  LYS 100           HE3      LYS 100  10.244  13.954  18.379
   11    HZ1  LYS 100           HZ1      LYS 100  13.061  14.644  17.726
   12    HZ3  LYS 100           HZ2      LYS 100  12.026  13.578  16.899
   13    HZ2  LYS 100           HZ3      LYS 100  12.616  13.168  18.440

  No H/Q in entry =          13
  In of MODEL    4
    1    H    LEU 101           H        LEU 101   6.829  19.616  16.579
    2    HA   LEU 101           HA       LEU 101   8.024  22.182  16.238
    3    HB2  LEU 101           HB2      LEU 101   5.440  20.926  15.351
    4    HB3  LEU 101           HB3      LEU 101   5.678  22.658  15.139
    5    HG   LEU 101           HG       LEU 101   7.731  20.654  14.182
    6   HD12  LEU 101          HD11      LEU 101   6.577  21.144  11.894
    7   HD11  LEU 101          HD12      LEU 101   5.173  21.567  12.871
    8   HD13  LEU 101          HD13      LEU 101   5.850  19.941  12.959
    9   HD21  LEU 101          HD21      LEU 101   7.081  23.560  13.617
   10   HD23  LEU 101          HD22      LEU 101   8.071  22.604  12.515
   11   HD22  LEU 101          HD23      LEU 101   8.608  22.871  14.173

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LYS 102           H        LYS 102   6.492  21.040  18.855
    2    HA   LYS 102           HA       LYS 102   5.848  22.133  20.783
    3    HB2  LYS 102           HB2      LYS 102   7.117  24.129  19.654
    4    HB3  LYS 102           HB3      LYS 102   5.514  24.721  19.274
    5    HG2  LYS 102           HG2      LYS 102   6.889  24.483  21.929
    6    HG3  LYS 102           HG3      LYS 102   5.927  25.803  21.295
    7    HD2  LYS 102           HD2      LYS 102   4.702  23.160  22.180
    8    HD3  LYS 102           HD3      LYS 102   4.939  24.526  23.259
    9    HE2  LYS 102           HE2      LYS 102   2.665  24.101  21.768
   10    HE3  LYS 102           HE3      LYS 102   3.155  25.653  22.447
   11    HZ2  LYS 102           HZ1      LYS 102   2.628  25.750  20.066
   12    HZ1  LYS 102           HZ2      LYS 102   3.898  24.676  19.748
   13    HZ3  LYS 102           HZ3      LYS 102   4.228  26.211  20.387

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ALA 103           H        ALA 103   4.203  23.655  18.008
    2    HA   ALA 103           HA       ALA 103   1.743  24.216  18.888
    3    HB1  ALA 103           HB1      ALA 103   0.854  23.361  16.647
    4    HB2  ALA 103           HB2      ALA 103   2.506  22.835  16.321
    5    HB3  ALA 103           HB3      ALA 103   2.158  24.546  16.582

  No H/Q in entry =           5
  In of MODEL    4
    1    H1   ALA   1           H3       ALA   1  10.707 -20.293  -6.244
    2    H2   ALA   1           H2       ALA   1   9.746 -20.510  -7.630
    3    H3   ALA   1           H1       ALA   1   9.312 -21.255  -6.166
    4    HA   ALA   1           HA       ALA   1  10.364 -23.059  -6.899
    5    HB1  ALA   1           HB1      ALA   1  10.460 -22.705  -9.175
    6    HB2  ALA   1           HB2      ALA   1  12.186 -22.542  -8.844
    7    HB3  ALA   1           HB3      ALA   1  11.178 -21.102  -9.001

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLU   2           H        GLU   2  12.654 -23.994  -6.951
    2    HA   GLU   2           HA       GLU   2  14.032 -23.897  -4.737
    3    HB2  GLU   2           HB2      GLU   2  15.391 -23.764  -7.435
    4    HB3  GLU   2           HB3      GLU   2  16.121 -24.366  -5.948
    5    HG2  GLU   2           HG2      GLU   2  15.118 -26.390  -6.184
    6    HG3  GLU   2           HG3      GLU   2  13.543 -25.656  -6.447

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLU   3           H        GLU   3  15.794 -22.027  -7.142
    2    HA   GLU   3           HA       GLU   3  16.934 -20.327  -5.186
    3    HB2  GLU   3           HB2      GLU   3  16.882 -20.334  -8.196
    4    HB3  GLU   3           HB3      GLU   3  17.618 -18.997  -7.312
    5    HG2  GLU   3           HG2      GLU   3  19.288 -20.358  -6.383
    6    HG3  GLU   3           HG3      GLU   3  18.352 -21.832  -6.601

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LEU   4           H        LEU   4  14.650 -19.502  -7.822
    2    HA   LEU   4           HA       LEU   4  14.166 -16.894  -7.218
    3    HB2  LEU   4           HB2      LEU   4  12.004 -18.885  -7.945
    4    HB3  LEU   4           HB3      LEU   4  11.918 -17.137  -8.149
    5    HG   LEU   4           HG       LEU   4  13.896 -18.991  -9.514
    6   HD13  LEU   4          HD11      LEU   4  12.596 -18.856 -11.426
    7   HD12  LEU   4          HD12      LEU   4  11.877 -17.315 -10.964
    8   HD11  LEU   4          HD13      LEU   4  11.333 -18.807 -10.199
    9   HD23  LEU   4          HD21      LEU   4  14.220 -16.748 -10.872
   10   HD22  LEU   4          HD22      LEU   4  15.079 -16.980  -9.351
   11   HD21  LEU   4          HD23      LEU   4  13.620 -15.994  -9.394

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLU   5           H        GLU   5  12.697 -19.683  -5.570
    2    HA   GLU   5           HA       GLU   5  11.008 -18.117  -3.873
    3    HB2  GLU   5           HB2      GLU   5  10.595 -20.499  -4.387
    4    HB3  GLU   5           HB3      GLU   5  12.034 -20.926  -3.458
    5    HG2  GLU   5           HG2      GLU   5  11.067 -19.911  -1.448
    6    HG3  GLU   5           HG3      GLU   5   9.644 -19.420  -2.364

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLU   6           H        GLU   6  14.164 -19.675  -3.423
    2    HA   GLU   6           HA       GLU   6  14.508 -18.809  -0.726
    3    HB2  GLU   6           HB2      GLU   6  16.482 -19.731  -2.827
    4    HB3  GLU   6           HB3      GLU   6  16.917 -19.395  -1.150
    5    HG2  GLU   6           HG2      GLU   6  14.800 -21.386  -2.009
    6    HG3  GLU   6           HG3      GLU   6  16.450 -21.813  -1.557

  No H/Q in entry =           6
  In of MODEL    4
    1    H    VAL   7           H        VAL   7  15.268 -17.486  -3.879
    2    HA   VAL   7           HA       VAL   7  16.939 -15.346  -3.018
    3    HB   VAL   7           HB       VAL   7  15.238 -15.728  -5.496
    4   HG11  VAL   7          HG11      VAL   7  17.115 -13.500  -4.689
    5   HG13  VAL   7          HG12      VAL   7  15.473 -13.370  -5.314
    6   HG12  VAL   7          HG13      VAL   7  16.787 -13.867  -6.381
    7   HG21  VAL   7          HG21      VAL   7  17.354 -17.169  -4.921
    8   HG23  VAL   7          HG22      VAL   7  18.250 -15.702  -5.323
    9   HG22  VAL   7          HG23      VAL   7  17.220 -16.463  -6.533

  No H/Q in entry =           9
  In of MODEL    4
    1    H    VAL   8           H        VAL   8  13.449 -15.641  -3.578
    2    HA   VAL   8           HA       VAL   8  12.763 -12.937  -3.115
    3    HB   VAL   8           HB       VAL   8  11.168 -15.475  -2.673
    4   HG12  VAL   8          HG11      VAL   8   9.222 -13.776  -2.864
    5   HG11  VAL   8          HG12      VAL   8  10.430 -12.552  -2.471
    6   HG13  VAL   8          HG13      VAL   8  10.090 -13.854  -1.332
    7   HG21  VAL   8          HG21      VAL   8  12.046 -14.368  -5.053
    8   HG23  VAL   8          HG22      VAL   8  10.476 -13.594  -4.855
    9   HG22  VAL   8          HG23      VAL   8  10.589 -15.349  -4.896

  No H/Q in entry =           9
  In of MODEL    4
    1    H    MET   9           H        MET   9  13.048 -15.734  -0.927
    2    HA   MET   9           HA       MET   9  12.221 -14.462   1.439
    3    HB2  MET   9           HB2      MET   9  14.146 -16.723   0.908
    4    HB3  MET   9           HB3      MET   9  13.835 -16.141   2.544
    5    HG2  MET   9           HG2      MET   9  11.451 -16.598   2.299
    6    HG3  MET   9           HG3      MET   9  11.690 -17.069   0.616
    7    HE1  MET   9           HE1      MET   9  12.511 -17.511   4.183
    8    HE3  MET   9           HE2      MET   9  14.129 -18.072   3.770
    9    HE2  MET   9           HE3      MET   9  12.955 -19.203   4.436

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLY  10           H        GLY  10  15.405 -14.667  -0.113
    2    HA3  GLY  10           HA2      GLY  10  16.851 -13.230   1.854
    3    HA2  GLY  10           HA3      GLY  10  17.317 -13.396   0.162

  No H/Q in entry =           3
  In of MODEL    4
    1    H    LEU  11           H        LEU  11  15.141 -12.195  -1.084
    2    HA   LEU  11           HA       LEU  11  15.804  -9.445  -0.927
    3    HB2  LEU  11           HB2      LEU  11  13.449 -10.877  -2.161
    4    HB3  LEU  11           HB3      LEU  11  13.716  -9.140  -2.325
    5    HG   LEU  11           HG       LEU  11  15.761 -11.235  -3.105
    6   HD13  LEU  11          HD11      LEU  11  14.020 -11.620  -4.626
    7   HD12  LEU  11          HD12      LEU  11  15.015 -10.433  -5.468
    8   HD11  LEU  11          HD13      LEU  11  13.536  -9.924  -4.653
    9   HD22  LEU  11          HD21      LEU  11  16.977  -9.261  -2.883
   10   HD21  LEU  11          HD22      LEU  11  15.594  -8.236  -3.266
   11   HD23  LEU  11          HD23      LEU  11  16.433  -9.102  -4.552

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  12           H        ILE  12  13.049 -11.289   0.342
    2    HA   ILE  12           HA       ILE  12  11.636  -9.074   1.394
    3    HB   ILE  12           HB       ILE  12  11.696 -11.954   2.351
    4   HG12  ILE  12          HG12      ILE  12  11.008 -11.338  -0.099
    5   HG13  ILE  12          HG13      ILE  12   9.985 -12.428   0.816
    6   HG22  ILE  12          HG21      ILE  12   9.407 -11.383   3.259
    7   HG21  ILE  12          HG22      ILE  12   9.749  -9.690   2.909
    8   HG23  ILE  12          HG23      ILE  12  10.734 -10.565   4.081
    9   HD12  ILE  12          HD11      ILE  12   8.744 -10.641  -0.433
   10   HD11  ILE  12          HD12      ILE  12   9.545  -9.440   0.579
   11   HD13  ILE  12          HD13      ILE  12   8.457 -10.608   1.298

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  13           H        ILE  13  14.046 -11.254   2.809
    2    HA   ILE  13           HA       ILE  13  14.068 -10.067   5.386
    3    HB   ILE  13           HB       ILE  13  16.148 -11.622   3.828
    4   HG12  ILE  13          HG12      ILE  13  13.876 -12.610   4.659
    5   HG13  ILE  13          HG13      ILE  13  15.357 -13.521   4.931
    6   HG22  ILE  13          HG21      ILE  13  17.090 -11.971   6.254
    7   HG21  ILE  13          HG22      ILE  13  16.274 -10.453   6.603
    8   HG23  ILE  13          HG23      ILE  13  17.528 -10.515   5.365
    9   HD11  ILE  13          HD11      ILE  13  14.164 -11.641   7.001
   10   HD13  ILE  13          HD12      ILE  13  15.472 -12.799   7.224
   11   HD12  ILE  13          HD13      ILE  13  13.832 -13.371   6.944

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ASN  14           H        ASN  14  16.020  -9.527   2.468
    2    HA   ASN  14           HA       ASN  14  17.744  -7.565   3.527
    3    HB2  ASN  14           HB2      ASN  14  17.737  -8.838   1.215
    4    HB3  ASN  14           HB3      ASN  14  16.831  -7.432   0.672
    5   HD21  ASN  14          HD21      ASN  14  19.276  -7.750  -0.509
    6   HD22  ASN  14          HD22      ASN  14  20.408  -6.654   0.117

  No H/Q in entry =           6
  In of MODEL    4
    1    H    SER  15           H        SER  15  14.633  -7.254   1.829
    2    HA   SER  15           HA       SER  15  14.491  -4.435   1.877
    3    HB2  SER  15           HB2      SER  15  12.165  -4.706   1.374
    4    HB3  SER  15           HB3      SER  15  12.974  -6.072   0.616
    5    HG   SER  15           HG       SER  15  12.043  -7.386   1.977

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLY  16           H        GLY  16  13.420  -6.899   4.186
    2    HA3  GLY  16           HA2      GLY  16  12.178  -5.158   6.037
    3    HA2  GLY  16           HA3      GLY  16  12.809  -6.759   6.405

  No H/Q in entry =           3
  In of MODEL    4
    1    H    GLN  17           H        GLN  17  15.518  -6.399   5.815
    2    HA   GLN  17           HA       GLN  17  16.458  -5.161   8.194
    3    HB2  GLN  17           HB2      GLN  17  17.704  -6.944   7.000
    4    HB3  GLN  17           HB3      GLN  17  18.010  -5.824   5.673
    5    HG2  GLN  17           HG2      GLN  17  19.187  -4.307   7.236
    6    HG3  GLN  17           HG3      GLN  17  18.907  -5.454   8.545
    7   HE21  GLN  17          HE21      GLN  17  20.667  -6.801   8.908
    8   HE22  GLN  17          HE22      GLN  17  21.783  -7.289   7.726

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ALA  18           H        ALA  18  16.262  -4.095   4.830
    2    HA   ALA  18           HA       ALA  18  17.672  -1.686   5.053
    3    HB2  ALA  18           HB1      ALA  18  16.570  -2.919   2.987
    4    HB3  ALA  18           HB2      ALA  18  16.816  -1.173   2.967
    5    HB1  ALA  18           HB3      ALA  18  15.223  -1.835   3.336

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ARG  19           H        ARG  19  14.178  -2.311   5.446
    2    HA   ARG  19           HA       ARG  19  13.480   0.334   6.152
    3    HB2  ARG  19           HB2      ARG  19  11.819  -1.438   5.568
    4    HB3  ARG  19           HB3      ARG  19  12.167  -2.228   7.107
    5    HG2  ARG  19           HG2      ARG  19  11.432  -0.241   8.340
    6    HG3  ARG  19           HG3      ARG  19  11.175   0.628   6.828
    7    HD2  ARG  19           HD2      ARG  19   9.041  -0.190   7.647
    8    HD3  ARG  19           HD3      ARG  19   9.472  -1.069   6.174
    9    HE   ARG  19           HE       ARG  19  10.445  -2.594   8.285
   10   HH21  ARG  19          HH11      ARG  19   9.212  -4.245   9.227
   11   HH22  ARG  19          HH12      ARG  19   7.492  -4.237   9.053
   12   HH11  ARG  19          HH21      ARG  19   7.438  -1.338   7.182
   13   HH12  ARG  19          HH22      ARG  19   6.488  -2.592   7.891

  No H/Q in entry =          13
  In of MODEL    4
    1    H    SER  20           H        SER  20  14.365  -2.481   8.121
    2    HA   SER  20           HA       SER  20  14.066  -1.378  10.654
    3    HB2  SER  20           HB2      SER  20  14.600  -3.757  10.264
    4    HB3  SER  20           HB3      SER  20  16.218  -3.302   9.735
    5    HG   SER  20           HG       SER  20  15.046  -2.910  12.291

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU  21           H        LEU  21  16.912  -1.291   8.523
    2    HA   LEU  21           HA       LEU  21  18.567   0.219  10.260
    3    HB2  LEU  21           HB2      LEU  21  18.554  -0.063   7.246
    4    HB3  LEU  21           HB3      LEU  21  19.796   0.815   8.135
    5    HG   LEU  21           HG       LEU  21  19.090  -2.082   8.689
    6   HD13  LEU  21          HD11      LEU  21  20.942  -2.733   7.315
    7   HD12  LEU  21          HD12      LEU  21  21.464  -1.061   7.112
    8   HD11  LEU  21          HD13      LEU  21  19.978  -1.618   6.346
    9   HD21  LEU  21          HD21      LEU  21  21.198  -0.158   9.657
   10   HD23  LEU  21          HD22      LEU  21  21.586  -1.873   9.586
   11   HD22  LEU  21          HD23      LEU  21  20.258  -1.317  10.590

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ALA  22           H        ALA  22  16.297   1.155   7.697
    2    HA   ALA  22           HA       ALA  22  16.805   3.919   7.704
    3    HB3  ALA  22           HB1      ALA  22  15.419   2.657   6.027
    4    HB2  ALA  22           HB2      ALA  22  14.695   4.163   6.588
    5    HB1  ALA  22           HB3      ALA  22  14.120   2.619   7.219

  No H/Q in entry =           5
  In of MODEL    4
    1    H    TYR  23           H        TYR  23  14.325   2.081   9.540
    2    HA   TYR  23           HA       TYR  23  13.335   4.312  10.981
    3    HB2  TYR  23           HB2      TYR  23  12.122   2.186  10.964
    4    HB3  TYR  23           HB3      TYR  23  13.461   1.391  11.793
    5    HD1  TYR  23           HD1      TYR  23  10.928   4.108  12.147
    6    HD2  TYR  23           HD2      TYR  23  13.655   1.460  14.149
    7    HE1  TYR  23           HE1      TYR  23   9.990   4.796  14.339
    8    HE2  TYR  23           HE2      TYR  23  12.717   2.149  16.338
    9    HH   TYR  23           HH       TYR  23  10.018   4.474  16.532

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ALA  24           H        ALA  24  16.004   2.067  11.629
    2    HA   ALA  24           HA       ALA  24  16.658   3.076  14.191
    3    HB1  ALA  24           HB1      ALA  24  18.034   1.297  14.034
    4    HB3  ALA  24           HB2      ALA  24  19.054   2.226  12.934
    5    HB2  ALA  24           HB3      ALA  24  17.771   1.202  12.293

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA  25           H        ALA  25  17.611   4.006  10.912
    2    HA   ALA  25           HA       ALA  25  19.535   5.963  11.555
    3    HB1  ALA  25           HB1      ALA  25  18.833   5.001   9.241
    4    HB3  ALA  25           HB2      ALA  25  19.317   6.694   9.331
    5    HB2  ALA  25           HB3      ALA  25  17.606   6.268   9.259

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU  26           H        LEU  26  16.019   6.154  11.187
    2    HA   LEU  26           HA       LEU  26  15.765   8.935  11.630
    3    HB2  LEU  26           HB2      LEU  26  13.918   7.678  10.702
    4    HB3  LEU  26           HB3      LEU  26  13.835   6.653  12.130
    5    HG   LEU  26           HG       LEU  26  13.207   8.608  13.504
    6   HD12  LEU  26          HD11      LEU  26  12.527  10.698  12.171
    7   HD11  LEU  26          HD12      LEU  26  13.517  10.052  10.865
    8   HD13  LEU  26          HD13      LEU  26  14.255  10.449  12.418
    9   HD21  LEU  26          HD21      LEU  26  11.539   8.271  10.992
   10   HD23  LEU  26          HD22      LEU  26  10.969   8.967  12.505
   11   HD22  LEU  26          HD23      LEU  26  11.438   7.271  12.441

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LYS  27           H        LYS  27  15.681   6.160  13.830
    2    HA   LYS  27           HA       LYS  27  15.070   7.527  16.194
    3    HB2  LYS  27           HB2      LYS  27  15.123   5.051  15.935
    4    HB3  LYS  27           HB3      LYS  27  16.886   5.121  15.895
    5    HG2  LYS  27           HG2      LYS  27  16.922   6.113  18.142
    6    HG3  LYS  27           HG3      LYS  27  15.155   6.114  18.184
    7    HD2  LYS  27           HD2      LYS  27  15.154   3.646  17.954
    8    HD3  LYS  27           HD3      LYS  27  16.919   3.653  17.946
    9    HE2  LYS  27           HE2      LYS  27  16.939   4.648  20.200
   10    HE3  LYS  27           HE3      LYS  27  15.173   4.672  20.211
   11    HZ3  LYS  27           HZ1      LYS  27  15.977   2.730  21.369
   12    HZ2  LYS  27           HZ2      LYS  27  16.900   2.256  20.021
   13    HZ1  LYS  27           HZ3      LYS  27  15.203   2.245  19.938

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLN  28           H        GLN  28  18.195   6.969  14.609
    2    HA   GLN  28           HA       GLN  28  19.865   8.074  16.600
    3    HB2  GLN  28           HB2      GLN  28  20.159   8.024  13.585
    4    HB3  GLN  28           HB3      GLN  28  21.439   8.508  14.697
    5    HG2  GLN  28           HG2      GLN  28  20.044   5.817  14.732
    6    HG3  GLN  28           HG3      GLN  28  21.631   6.120  14.028
    7   HE21  GLN  28          HE21      GLN  28  20.357   4.779  16.709
    8   HE22  GLN  28          HE22      GLN  28  21.523   5.218  17.860

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ALA  29           H        ALA  29  18.105   9.534  13.900
    2    HA   ALA  29           HA       ALA  29  19.081  12.163  14.148
    3    HB2  ALA  29           HB1      ALA  29  17.379  12.782  12.672
    4    HB1  ALA  29           HB2      ALA  29  16.244  11.600  13.324
    5    HB3  ALA  29           HB3      ALA  29  17.581  11.067  12.305

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LYS  30           H        LYS  30  16.315  10.544  15.668
    2    HA   LYS  30           HA       LYS  30  15.279  12.793  17.017
    3    HB2  LYS  30           HB2      LYS  30  15.191   9.853  17.729
    4    HB3  LYS  30           HB3      LYS  30  14.313  11.098  18.617
    5    HG2  LYS  30           HG2      LYS  30  13.187  11.769  16.495
    6    HG3  LYS  30           HG3      LYS  30  14.004  10.438  15.673
    7    HD2  LYS  30           HD2      LYS  30  12.942   8.826  17.204
    8    HD3  LYS  30           HD3      LYS  30  12.135  10.147  18.050
    9    HE2  LYS  30           HE2      LYS  30  10.966  10.764  15.954
   10    HE3  LYS  30           HE3      LYS  30  11.753   9.415  15.128
   11    HZ2  LYS  30           HZ1      LYS  30   9.446   8.989  16.005
   12    HZ1  LYS  30           HZ2      LYS  30  10.110   9.051  17.573
   13    HZ3  LYS  30           HZ3      LYS  30  10.630   7.868  16.467

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLN  31           H        GLN  31  17.956  10.647  17.765
    2    HA   GLN  31           HA       GLN  31  18.271  11.671  20.457
    3    HB2  GLN  31           HB2      GLN  31  20.309  10.112  18.860
    4    HB3  GLN  31           HB3      GLN  31  20.171  10.240  20.614
    5    HG2  GLN  31           HG2      GLN  31  17.666   9.266  19.843
    6    HG3  GLN  31           HG3      GLN  31  18.776   8.427  18.767
    7   HE21  GLN  31          HE21      GLN  31  17.239   7.275  21.044
    8   HE22  GLN  31          HE22      GLN  31  18.398   6.626  22.098

  No H/Q in entry =           8
  In of MODEL    4
    1    H    GLY  32           H        GLY  32  18.785  12.984  17.488
    2    HA3  GLY  32           HA2      GLY  32  19.754  15.036  16.970
    3    HA2  GLY  32           HA3      GLY  32  20.509  15.051  18.560

  No H/Q in entry =           3
  In of MODEL    4
    1    H    ASP  33           H        ASP  33  20.957  12.157  16.791
    2    HA   ASP  33           HA       ASP  33  23.777  12.854  16.328
    3    HB2  ASP  33           HB2      ASP  33  22.289  10.226  16.448
    4    HB3  ASP  33           HB3      ASP  33  23.976  10.355  15.956

  No H/Q in entry =           4
  In of MODEL    4
    1    H    PHE  34           H        PHE  34  23.289  14.168  14.442
    2    HA   PHE  34           HA       PHE  34  21.952  13.167  12.155
    3    HB2  PHE  34           HB2      PHE  34  24.065  15.319  12.384
    4    HB3  PHE  34           HB3      PHE  34  23.085  15.017  10.951
    5    HD1  PHE  34           HD1      PHE  34  23.315  16.961  13.860
    6    HD2  PHE  34           HD2      PHE  34  20.459  14.816  11.474
    7    HE1  PHE  34           HE1      PHE  34  21.486  18.346  14.800
    8    HE2  PHE  34           HE2      PHE  34  18.633  16.201  12.418
    9    HZ   PHE  34           HZ       PHE  34  19.150  17.967  14.076

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ALA  35           H        ALA  35  25.326  13.010  13.170
    2    HA   ALA  35           HA       ALA  35  26.442  12.192  10.717
    3    HB3  ALA  35           HB1      ALA  35  28.129  11.040  12.442
    4    HB2  ALA  35           HB2      ALA  35  27.255  12.062  13.584
    5    HB1  ALA  35           HB3      ALA  35  28.088  12.788  12.211

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA  36           H        ALA  36  25.338  10.234  13.485
    2    HA   ALA  36           HA       ALA  36  25.846   7.747  12.217
    3    HB2  ALA  36           HB1      ALA  36  25.417   7.002  14.293
    4    HB3  ALA  36           HB2      ALA  36  23.726   7.482  14.139
    5    HB1  ALA  36           HB3      ALA  36  24.916   8.626  14.761

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA  37           H        ALA  37  23.005   9.849  12.340
    2    HA   ALA  37           HA       ALA  37  21.167   8.060  11.166
    3    HB3  ALA  37           HB1      ALA  37  21.366  11.026  11.451
    4    HB1  ALA  37           HB2      ALA  37  20.063   9.937  11.924
    5    HB2  ALA  37           HB3      ALA  37  20.250  10.406  10.233

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LYS  38           H        LYS  38  23.247  10.536   9.684
    2    HA   LYS  38           HA       LYS  38  22.616  10.096   7.007
    3    HB2  LYS  38           HB2      LYS  38  24.409  11.673   8.451
    4    HB3  LYS  38           HB3      LYS  38  25.453  10.690   7.430
    5    HG2  LYS  38           HG2      LYS  38  24.285  11.445   5.429
    6    HG3  LYS  38           HG3      LYS  38  23.080  12.291   6.406
    7    HD2  LYS  38           HD2      LYS  38  24.659  13.906   7.157
    8    HD3  LYS  38           HD3      LYS  38  26.029  12.931   6.627
    9    HE2  LYS  38           HE2      LYS  38  25.658  14.795   5.070
   10    HE3  LYS  38           HE3      LYS  38  25.339  13.253   4.269
   11    HZ3  LYS  38           HZ1      LYS  38  23.138  13.676   4.134
   12    HZ2  LYS  38           HZ2      LYS  38  23.645  15.296   4.218
   13    HZ1  LYS  38           HZ3      LYS  38  23.076  14.511   5.611

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ALA  39           H        ALA  39  25.141   8.527   8.971
    2    HA   ALA  39           HA       ALA  39  26.229   6.943   6.908
    3    HB2  ALA  39           HB1      ALA  39  26.145   5.986   9.754
    4    HB1  ALA  39           HB2      ALA  39  27.085   7.420   9.335
    5    HB3  ALA  39           HB3      ALA  39  27.452   5.871   8.577

  No H/Q in entry =           5
  In of MODEL    4
    1    H    MET  40           H        MET  40  23.618   6.308   9.203
    2    HA   MET  40           HA       MET  40  23.203   3.597   8.475
    3    HB2  MET  40           HB2      MET  40  21.364   5.626   9.759
    4    HB3  MET  40           HB3      MET  40  20.975   3.912   9.588
    5    HG2  MET  40           HG2      MET  40  23.513   4.882  10.931
    6    HG3  MET  40           HG3      MET  40  22.020   4.594  11.822
    7    HE3  MET  40           HE1      MET  40  21.492   0.955  12.006
    8    HE2  MET  40           HE2      MET  40  20.611   2.247  11.194
    9    HE1  MET  40           HE3      MET  40  21.347   2.546  12.767

  No H/Q in entry =           9
  In of MODEL    4
    1    H    MET  41           H        MET  41  21.761   6.633   7.277
    2    HA   MET  41           HA       MET  41  19.819   5.414   5.605
    3    HB2  MET  41           HB2      MET  41  21.275   8.018   5.088
    4    HB3  MET  41           HB3      MET  41  19.753   7.507   4.368
    5    HG2  MET  41           HG2      MET  41  19.005   7.317   6.919
    6    HG3  MET  41           HG3      MET  41  20.301   8.489   7.140
    7    HE2  MET  41           HE1      MET  41  19.731   9.762   3.799
    8    HE1  MET  41           HE2      MET  41  20.681  10.215   5.211
    9    HE3  MET  41           HE3      MET  41  19.399  11.280   4.642

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ASP  42           H        ASP  42  23.183   6.370   5.055
    2    HA   ASP  42           HA       ASP  42  23.284   5.889   2.299
    3    HB2  ASP  42           HB2      ASP  42  25.022   6.909   4.069
    4    HB3  ASP  42           HB3      ASP  42  25.696   5.290   3.946

  No H/Q in entry =           4
  In of MODEL    4
    1    H    GLN  43           H        GLN  43  24.026   3.749   5.026
    2    HA   GLN  43           HA       GLN  43  24.716   1.495   3.451
    3    HB2  GLN  43           HB2      GLN  43  23.687   1.675   6.292
    4    HB3  GLN  43           HB3      GLN  43  24.282   0.190   5.542
    5    HG2  GLN  43           HG2      GLN  43  26.434   1.421   5.031
    6    HG3  GLN  43           HG3      GLN  43  25.836   2.745   6.026
    7   HE21  GLN  43          HE21      GLN  43  28.077   1.798   7.069
    8   HE22  GLN  43          HE22      GLN  43  27.812   0.715   8.348

  No H/Q in entry =           8
  In of MODEL    4
    1    H    SER  44           H        SER  44  21.646   2.600   4.828
    2    HA   SER  44           HA       SER  44  20.102   0.339   4.158
    3    HB2  SER  44           HB2      SER  44  19.632   2.866   5.297
    4    HB3  SER  44           HB3      SER  44  18.601   2.809   3.870
    5    HG   SER  44           HG       SER  44  17.514   1.859   5.593

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ARG  45           H        ARG  45  20.817   3.307   2.347
    2    HA   ARG  45           HA       ARG  45  19.301   2.800   0.041
    3    HB2  ARG  45           HB2      ARG  45  20.422   4.949   0.622
    4    HB3  ARG  45           HB3      ARG  45  21.975   4.209   0.241
    5    HG2  ARG  45           HG2      ARG  45  21.199   3.789  -2.074
    6    HG3  ARG  45           HG3      ARG  45  19.658   4.553  -1.692
    7    HD2  ARG  45           HD2      ARG  45  20.886   6.663  -1.111
    8    HD3  ARG  45           HD3      ARG  45  22.391   5.903  -1.675
    9    HE   ARG  45           HE       ARG  45  20.467   5.641  -3.714
   10   HH21  ARG  45          HH11      ARG  45  20.449   7.005  -5.480
   11   HH22  ARG  45          HH12      ARG  45  21.190   8.563  -5.379
   12   HH11  ARG  45          HH21      ARG  45  22.169   8.161  -2.091
   13   HH12  ARG  45          HH22      ARG  45  22.163   9.217  -3.457

  No H/Q in entry =          13
  In of MODEL    4
    1    H    MET  46           H        MET  46  22.672   1.960   0.796
    2    HA   MET  46           HA       MET  46  23.293   0.767  -1.684
    3    HB2  MET  46           HB2      MET  46  24.400   0.472   1.107
    4    HB3  MET  46           HB3      MET  46  25.061  -0.438  -0.255
    5    HG2  MET  46           HG2      MET  46  25.513   1.643  -1.465
    6    HG3  MET  46           HG3      MET  46  24.779   2.582  -0.171
    7    HE2  MET  46           HE1      MET  46  28.754   0.462  -0.409
    8    HE1  MET  46           HE2      MET  46  27.269   0.166  -1.309
    9    HE3  MET  46           HE3      MET  46  27.505  -0.594   0.264

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ALA  47           H        ALA  47  21.919  -0.571   1.293
    2    HA   ALA  47           HA       ALA  47  21.892  -3.287   0.498
    3    HB2  ALA  47           HB1      ALA  47  21.506  -2.824   2.801
    4    HB3  ALA  47           HB2      ALA  47  19.976  -3.443   2.182
    5    HB1  ALA  47           HB3      ALA  47  20.189  -1.709   2.436

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU  48           H        LEU  48  19.515  -0.683   0.131
    2    HA   LEU  48           HA       LEU  48  17.486  -2.238  -1.117
    3    HB2  LEU  48           HB2      LEU  48  18.114   0.722  -1.240
    4    HB3  LEU  48           HB3      LEU  48  16.650  -0.004  -1.906
    5    HG   LEU  48           HG       LEU  48  17.503  -0.290   0.985
    6   HD13  LEU  48          HD11      LEU  48  17.065   2.006   0.791
    7   HD12  LEU  48          HD12      LEU  48  15.512   1.346   1.301
    8   HD11  LEU  48          HD13      LEU  48  15.781   1.766  -0.391
    9   HD22  LEU  48          HD21      LEU  48  15.990  -2.019   0.608
   10   HD21  LEU  48          HD22      LEU  48  15.109  -1.128  -0.634
   11   HD23  LEU  48          HD23      LEU  48  14.892  -0.720   1.068

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ASN  49           H        ASN  49  20.158  -0.290  -2.351
    2    HA   ASN  49           HA       ASN  49  19.509  -0.387  -5.075
    3    HB2  ASN  49           HB2      ASN  49  21.171   1.150  -4.173
    4    HB3  ASN  49           HB3      ASN  49  22.207  -0.193  -3.707
    5   HD21  ASN  49          HD21      ASN  49  20.709   1.284  -6.609
    6   HD22  ASN  49          HD22      ASN  49  21.961   0.843  -7.665

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLU  50           H        GLU  50  21.511  -2.558  -3.105
    2    HA   GLU  50           HA       GLU  50  22.229  -4.315  -5.225
    3    HB2  GLU  50           HB2      GLU  50  23.426  -4.272  -3.059
    4    HB3  GLU  50           HB3      GLU  50  21.988  -4.910  -2.261
    5    HG2  GLU  50           HG2      GLU  50  22.096  -6.947  -3.614
    6    HG3  GLU  50           HG3      GLU  50  23.467  -6.305  -4.516

  No H/Q in entry =           6
  In of MODEL    4
    1    H    ALA  51           H        ALA  51  19.571  -4.265  -2.901
    2    HA   ALA  51           HA       ALA  51  18.427  -6.750  -3.651
    3    HB3  ALA  51           HB1      ALA  51  16.830  -6.253  -2.098
    4    HB1  ALA  51           HB2      ALA  51  16.603  -4.611  -2.702
    5    HB2  ALA  51           HB3      ALA  51  17.964  -4.982  -1.644

  No H/Q in entry =           5
  In of MODEL    4
    1    H    HIS  52           H        HIS  52  17.813  -3.411  -4.697
    2    HA   HIS  52           HA       HIS  52  15.705  -3.961  -6.495
    3    HB2  HIS  52           HB2      HIS  52  16.333  -1.688  -5.701
    4    HB3  HIS  52           HB3      HIS  52  17.790  -1.775  -6.691
    5    HD1  HIS  52           HD1      HIS  52  17.399  -1.994  -9.333
    6    HD2  HIS  52           HD2      HIS  52  14.020  -0.990  -7.108
    7    HE1  HIS  52           HE1      HIS  52  15.688  -1.117 -10.983
    8    HE2  HIS  52           HE2      HIS  52  13.623  -0.500  -9.641

  No H/Q in entry =           8
  In of MODEL    4
    1    H    LEU  53           H        LEU  53  19.223  -3.938  -6.927
    2    HA   LEU  53           HA       LEU  53  19.284  -4.262  -9.726
    3    HB2  LEU  53           HB2      LEU  53  21.223  -5.000  -7.549
    4    HB3  LEU  53           HB3      LEU  53  21.543  -5.389  -9.236
    5    HG   LEU  53           HG       LEU  53  20.848  -2.582  -8.316
    6   HD12  LEU  53          HD11      LEU  53  23.381  -2.237  -8.659
    7   HD11  LEU  53          HD12      LEU  53  23.511  -3.989  -8.518
    8   HD13  LEU  53          HD13      LEU  53  22.876  -3.044  -7.177
    9   HD21  LEU  53          HD21      LEU  53  21.926  -3.811 -10.859
   10   HD23  LEU  53          HD22      LEU  53  22.252  -2.125 -10.472
   11   HD22  LEU  53          HD23      LEU  53  20.600  -2.670 -10.683

  No H/Q in entry =          11
  In of MODEL    4
    1    H    VAL  54           H        VAL  54  19.192  -6.641  -7.092
    2    HA   VAL  54           HA       VAL  54  19.336  -8.940  -8.744
    3    HB   VAL  54           HB       VAL  54  18.177  -8.517  -5.979
    4   HG12  VAL  54          HG11      VAL  54  18.525 -11.132  -5.965
    5   HG11  VAL  54          HG12      VAL  54  18.339 -10.971  -7.711
    6   HG13  VAL  54          HG13      VAL  54  17.045 -10.448  -6.635
    7   HG22  VAL  54          HG21      VAL  54  20.491  -8.285  -5.756
    8   HG21  VAL  54          HG22      VAL  54  20.839  -9.378  -7.093
    9   HG23  VAL  54          HG23      VAL  54  20.314 -10.024  -5.538

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLN  55           H        GLN  55  16.590  -7.058  -7.469
    2    HA   GLN  55           HA       GLN  55  14.585  -8.744  -8.537
    3    HB2  GLN  55           HB2      GLN  55  13.822  -7.220  -6.916
    4    HB3  GLN  55           HB3      GLN  55  14.603  -5.847  -7.697
    5    HG2  GLN  55           HG2      GLN  55  12.876  -5.544  -9.188
    6    HG3  GLN  55           HG3      GLN  55  12.570  -7.268  -9.352
    7   HE21  GLN  55          HE21      GLN  55  10.568  -7.833  -8.546
    8   HE22  GLN  55          HE22      GLN  55   9.787  -7.082  -7.241

  No H/Q in entry =           8
  In of MODEL    4
    1    H    THR  56           H        THR  56  16.299  -5.933  -9.906
    2    HA   THR  56           HA       THR  56  14.858  -5.593 -12.256
    3    HB   THR  56           HB       THR  56  17.876  -5.475 -12.094
    4    HG1  THR  56           HG1      THR  56  16.011  -4.123 -10.720
    5   HG21  THR  56          HG21      THR  56  16.509  -5.201 -14.301
    6   HG23  THR  56          HG22      THR  56  17.753  -4.012 -13.915
    7   HG22  THR  56          HG23      THR  56  16.054  -3.638 -13.623

  No H/Q in entry =           7
  In of MODEL    4
    1    H    LYS  57           H        LYS  57  17.529  -7.862 -11.636
    2    HA   LYS  57           HA       LYS  57  17.543  -9.066 -14.210
    3    HB2  LYS  57           HB2      LYS  57  19.335  -9.295 -12.463
    4    HB3  LYS  57           HB3      LYS  57  18.240 -10.297 -11.523
    5    HG2  LYS  57           HG2      LYS  57  18.153 -11.949 -13.328
    6    HG3  LYS  57           HG3      LYS  57  19.189 -10.941 -14.331
    7    HD2  LYS  57           HD2      LYS  57  21.000 -11.140 -12.649
    8    HD3  LYS  57           HD3      LYS  57  19.970 -12.189 -11.676
    9    HE2  LYS  57           HE2      LYS  57  20.757 -12.793 -14.546
   10    HE3  LYS  57           HE3      LYS  57  21.597 -13.456 -13.145
   11    HZ3  LYS  57           HZ1      LYS  57  20.021 -14.961 -12.871
   12    HZ2  LYS  57           HZ2      LYS  57  19.365 -14.482 -14.362
   13    HZ1  LYS  57           HZ3      LYS  57  18.788 -13.799 -12.919

  No H/Q in entry =          13
  In of MODEL    4
    1    H    LEU  58           H        LEU  58  15.768  -9.740 -11.232
    2    HA   LEU  58           HA       LEU  58  14.570 -12.129 -12.158
    3    HB2  LEU  58           HB2      LEU  58  13.756 -10.223  -9.970
    4    HB3  LEU  58           HB3      LEU  58  12.965 -11.771 -10.281
    5    HG   LEU  58           HG       LEU  58  15.935 -11.460  -9.727
    6   HD11  LEU  58          HD11      LEU  58  13.568 -11.895  -7.933
    7   HD13  LEU  58          HD12      LEU  58  15.011 -10.916  -7.674
    8   HD12  LEU  58          HD13      LEU  58  15.101 -12.671  -7.532
    9   HD22  LEU  58          HD21      LEU  58  15.838 -13.527 -10.747
   10   HD21  LEU  58          HD22      LEU  58  14.126 -13.753 -10.385
   11   HD23  LEU  58          HD23      LEU  58  15.338 -14.037  -9.135

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  59           H        ILE  59  13.865  -8.802 -12.854
    2    HA   ILE  59           HA       ILE  59  11.157  -9.481 -13.791
    3    HB   ILE  59           HB       ILE  59  11.931  -7.189 -12.592
    4   HG12  ILE  59          HG12      ILE  59  10.043  -7.078 -14.954
    5   HG13  ILE  59          HG13      ILE  59   9.618  -7.862 -13.454
    6   HG21  ILE  59          HG21      ILE  59  13.479  -6.793 -14.659
    7   HG23  ILE  59          HG22      ILE  59  12.512  -5.455 -14.080
    8   HG22  ILE  59          HG23      ILE  59  12.002  -6.372 -15.494
    9   HD12  ILE  59          HD11      ILE  59   8.849  -5.487 -13.563
   10   HD11  ILE  59          HD12      ILE  59  10.539  -4.995 -13.647
   11   HD13  ILE  59          HD13      ILE  59   9.929  -5.807 -12.203

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLU  60           H        GLU  60  14.352  -8.602 -15.053
    2    HA   GLU  60           HA       GLU  60  13.569  -8.220 -17.763
    3    HB2  GLU  60           HB2      GLU  60  15.743  -7.467 -16.893
    4    HB3  GLU  60           HB3      GLU  60  16.222  -9.140 -16.622
    5    HG2  GLU  60           HG2      GLU  60  16.023  -9.596 -19.041
    6    HG3  GLU  60           HG3      GLU  60  15.537  -7.925 -19.316

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLY  61           H        GLY  61  14.575 -11.084 -15.936
    2    HA3  GLY  61           HA2      GLY  61  14.051 -12.746 -18.332
    3    HA2  GLY  61           HA3      GLY  61  15.088 -13.212 -16.988

  No H/Q in entry =           3
  In of MODEL    4
    1    H    ASP  62           H        ASP  62  11.953 -11.696 -16.622
    2    HA   ASP  62           HA       ASP  62  11.042 -13.690 -14.816
    3    HB2  ASP  62           HB2      ASP  62   8.889 -12.426 -14.963
    4    HB3  ASP  62           HB3      ASP  62  10.283 -11.427 -14.565

  No H/Q in entry =           4
  In of MODEL    4
    1    H    ALA  63           H        ALA  63  10.172 -15.655 -15.254
    2    HA   ALA  63           HA       ALA  63   8.784 -16.024 -17.864
    3    HB1  ALA  63           HB1      ALA  63  11.032 -17.236 -17.493
    4    HB3  ALA  63           HB2      ALA  63   9.666 -18.207 -18.038
    5    HB2  ALA  63           HB3      ALA  63  10.152 -18.241 -16.343

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLY  64           H        GLY  64   9.114 -17.658 -14.719
    2    HA3  GLY  64           HA2      GLY  64   7.551 -18.409 -13.209
    3    HA2  GLY  64           HA3      GLY  64   6.374 -17.364 -13.993

  No H/Q in entry =           3
  In of MODEL    4
    1    H    GLU  65           H        GLU  65   4.655 -18.485 -14.697
    2    HA   GLU  65           HA       GLU  65   4.639 -21.289 -14.944
    3    HB2  GLU  65           HB2      GLU  65   2.704 -19.205 -15.941
    4    HB3  GLU  65           HB3      GLU  65   2.406 -20.940 -16.035
    5    HG2  GLU  65           HG2      GLU  65   2.618 -21.145 -13.611
    6    HG3  GLU  65           HG3      GLU  65   3.017 -19.433 -13.477

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLY  66           H        GLY  66   5.140 -18.772 -17.260
    2    HA3  GLY  66           HA2      GLY  66   6.238 -20.597 -19.202
    3    HA2  GLY  66           HA3      GLY  66   4.757 -19.817 -19.719

  No H/Q in entry =           3
  In of MODEL    4
    1    H    LYS  67           H        LYS  67   6.582 -19.300 -21.370
    2    HA   LYS  67           HA       LYS  67   8.545 -17.394 -20.830
    3    HB2  LYS  67           HB2      LYS  67   7.128 -18.149 -23.378
    4    HB3  LYS  67           HB3      LYS  67   8.502 -17.038 -23.326
    5    HG2  LYS  67           HG2      LYS  67   9.859 -18.759 -22.194
    6    HG3  LYS  67           HG3      LYS  67   8.494 -19.870 -22.238
    7    HD2  LYS  67           HD2      LYS  67   8.518 -19.813 -24.701
    8    HD3  LYS  67           HD3      LYS  67   9.882 -18.693 -24.662
    9    HE2  LYS  67           HE2      LYS  67  11.242 -20.371 -23.482
   10    HE3  LYS  67           HE3      LYS  67   9.880 -21.490 -23.487
   11    HZ3  LYS  67           HZ1      LYS  67  11.106 -22.136 -25.319
   12    HZ2  LYS  67           HZ2      LYS  67  11.505 -20.545 -25.757
   13    HZ1  LYS  67           HZ3      LYS  67   9.928 -21.129 -26.011

  No H/Q in entry =          13
  In of MODEL    4
    1    H    MET  68           H        MET  68   5.281 -16.949 -22.031
    2    HA   MET  68           HA       MET  68   5.353 -14.163 -22.449
    3    HB2  MET  68           HB2      MET  68   3.031 -16.016 -21.911
    4    HB3  MET  68           HB3      MET  68   2.886 -14.357 -22.493
    5    HG2  MET  68           HG2      MET  68   4.413 -16.564 -23.903
    6    HG3  MET  68           HG3      MET  68   2.806 -15.994 -24.356
    7    HE3  MET  68           HE1      MET  68   3.038 -12.681 -25.745
    8    HE2  MET  68           HE2      MET  68   3.192 -12.567 -23.994
    9    HE1  MET  68           HE3      MET  68   2.170 -13.816 -24.701

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LYS  69           H        LYS  69   4.342 -16.033 -19.572
    2    HA   LYS  69           HA       LYS  69   3.575 -13.589 -18.203
    3    HB2  LYS  69           HB2      LYS  69   3.407 -16.496 -17.424
    4    HB3  LYS  69           HB3      LYS  69   2.929 -15.179 -16.349
    5    HG2  LYS  69           HG2      LYS  69   1.352 -14.349 -18.052
    6    HG3  LYS  69           HG3      LYS  69   1.829 -15.658 -19.135
    7    HD2  LYS  69           HD2      LYS  69   1.024 -17.315 -17.501
    8    HD3  LYS  69           HD3      LYS  69   0.558 -16.013 -16.404
    9    HE2  LYS  69           HE2      LYS  69  -1.008 -15.136 -18.089
   10    HE3  LYS  69           HE3      LYS  69  -0.533 -16.417 -19.204
   11    HZ1  LYS  69           HZ1      LYS  69  -1.387 -17.264 -16.560
   12    HZ3  LYS  69           HZ2      LYS  69  -1.691 -17.962 -18.078
   13    HZ2  LYS  69           HZ3      LYS  69  -2.598 -16.623 -17.558

  No H/Q in entry =          13
  In of MODEL    4
    1    H    VAL  70           H        VAL  70   4.106 -14.049 -15.551
    2    HA   VAL  70           HA       VAL  70   7.056 -14.142 -15.328
    3    HB   VAL  70           HB       VAL  70   6.944 -12.203 -13.798
    4   HG11  VAL  70          HG11      VAL  70   7.163 -12.082 -16.408
    5   HG13  VAL  70          HG12      VAL  70   6.892 -10.593 -15.502
    6   HG12  VAL  70          HG13      VAL  70   5.550 -11.376 -16.333
    7   HG22  VAL  70          HG21      VAL  70   4.728 -12.289 -12.908
    8   HG21  VAL  70          HG22      VAL  70   4.008 -12.346 -14.515
    9   HG23  VAL  70          HG23      VAL  70   4.734 -10.850 -13.928

  No H/Q in entry =           9
  In of MODEL    4
    1    H    SER  71           H        SER  71   7.799 -14.533 -13.133
    2    HA   SER  71           HA       SER  71   6.434 -16.632 -11.800
    3    HB2  SER  71           HB2      SER  71   8.877 -16.341 -11.667
    4    HB3  SER  71           HB3      SER  71   8.652 -14.829 -10.789
    5    HG   SER  71           HG       SER  71   7.424 -16.140  -9.251

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU  72           H        LEU  72   5.117 -16.616  -9.984
    2    HA   LEU  72           HA       LEU  72   3.543 -14.317  -9.549
    3    HB2  LEU  72           HB2      LEU  72   3.856 -16.864  -7.966
    4    HB3  LEU  72           HB3      LEU  72   2.672 -15.619  -7.578
    5    HG   LEU  72           HG       LEU  72   2.856 -16.929 -10.310
    6   HD13  LEU  72          HD11      LEU  72   0.944 -18.306  -9.605
    7   HD12  LEU  72          HD12      LEU  72   1.006 -17.587  -7.997
    8   HD11  LEU  72          HD13      LEU  72   2.333 -18.604  -8.559
    9   HD21  LEU  72          HD21      LEU  72   0.957 -15.030  -8.950
   10   HD23  LEU  72          HD22      LEU  72   0.333 -16.118 -10.178
   11   HD22  LEU  72          HD23      LEU  72   1.598 -14.964 -10.588

  No H/Q in entry =          11
  In of MODEL    4
    1    H    VAL  73           H        VAL  73   6.213 -15.721  -7.769
    2    HA   VAL  73           HA       VAL  73   6.134 -14.182  -5.441
    3    HB   VAL  73           HB       VAL  73   8.344 -14.951  -5.024
    4   HG11  VAL  73          HG11      VAL  73   6.455 -16.654  -5.191
    5   HG13  VAL  73          HG12      VAL  73   8.086 -17.307  -5.347
    6   HG12  VAL  73          HG13      VAL  73   7.090 -17.067  -6.782
    7   HG23  VAL  73          HG21      VAL  73   9.507 -16.160  -7.050
    8   HG22  VAL  73          HG22      VAL  73   9.629 -14.408  -6.898
    9   HG21  VAL  73          HG23      VAL  73   8.469 -15.117  -8.023

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LEU  74           H        LEU  74   7.119 -13.288  -8.619
    2    HA   LEU  74           HA       LEU  74   9.043 -11.318  -8.130
    3    HB2  LEU  74           HB2      LEU  74   8.609 -12.069 -10.367
    4    HB3  LEU  74           HB3      LEU  74   6.930 -11.542 -10.271
    5    HG   LEU  74           HG       LEU  74   7.683  -9.194 -10.052
    6   HD11  LEU  74          HD11      LEU  74  10.392 -10.525 -10.192
    7   HD13  LEU  74          HD12      LEU  74   9.815  -9.348  -9.013
    8   HD12  LEU  74          HD13      LEU  74  10.171  -8.840 -10.663
    9   HD21  LEU  74          HD21      LEU  74   7.417 -10.592 -12.268
   10   HD23  LEU  74          HD22      LEU  74   9.138 -10.303 -12.378
   11   HD22  LEU  74          HD23      LEU  74   8.039  -8.944 -12.316

  No H/Q in entry =          11
  In of MODEL    4
    1    H    VAL  75           H        VAL  75   5.545 -10.970  -8.490
    2    HA   VAL  75           HA       VAL  75   5.420  -8.213  -7.911
    3    HB   VAL  75           HB       VAL  75   3.350 -10.376  -7.520
    4   HG12  VAL  75          HG11      VAL  75   1.751  -8.427  -7.437
    5   HG11  VAL  75          HG12      VAL  75   3.136  -7.347  -7.376
    6   HG13  VAL  75          HG13      VAL  75   2.844  -8.469  -6.058
    7   HG21  VAL  75          HG21      VAL  75   4.280  -9.782  -9.849
    8   HG23  VAL  75          HG22      VAL  75   3.522  -8.207  -9.624
    9   HG22  VAL  75          HG23      VAL  75   2.532  -9.667  -9.649

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLU  76           H        GLU  76   5.192 -11.085  -5.793
    2    HA   GLU  76           HA       GLU  76   4.704  -9.722  -3.377
    3    HB2  GLU  76           HB2      GLU  76   4.557 -12.193  -3.609
    4    HB3  GLU  76           HB3      GLU  76   6.296 -12.271  -3.835
    5    HG2  GLU  76           HG2      GLU  76   5.847 -12.849  -1.539
    6    HG3  GLU  76           HG3      GLU  76   6.567 -11.250  -1.526

  No H/Q in entry =           6
  In of MODEL    4
    1    H    ALA  77           H        ALA  77   7.775 -10.603  -4.932
    2    HA   ALA  77           HA       ALA  77   9.451  -9.537  -2.916
    3    HB1  ALA  77           HB1      ALA  77  10.130 -11.088  -4.804
    4    HB2  ALA  77           HB2      ALA  77  11.231  -9.746  -4.494
    5    HB3  ALA  77           HB3      ALA  77  10.119  -9.675  -5.859

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLN  78           H        GLN  78   8.050  -8.142  -5.837
    2    HA   GLN  78           HA       GLN  78   9.379  -5.650  -5.738
    3    HB2  GLN  78           HB2      GLN  78   8.067  -6.615  -7.683
    4    HB3  GLN  78           HB3      GLN  78   6.598  -6.175  -6.815
    5    HG2  GLN  78           HG2      GLN  78   7.268  -3.828  -6.807
    6    HG3  GLN  78           HG3      GLN  78   8.793  -4.235  -7.591
    7   HE21  GLN  78          HE21      GLN  78   7.708  -6.189  -9.467
    8   HE22  GLN  78          HE22      GLN  78   6.762  -5.335 -10.587

  No H/Q in entry =           8
  In of MODEL    4
    1    H    LEU  79           H        LEU  79   6.367  -6.812  -4.311
    2    HA   LEU  79           HA       LEU  79   5.349  -4.411  -3.311
    3    HB2  LEU  79           HB2      LEU  79   4.053  -6.474  -3.252
    4    HB3  LEU  79           HB3      LEU  79   5.202  -7.200  -2.132
    5    HG   LEU  79           HG       LEU  79   4.631  -5.557  -0.411
    6   HD13  LEU  79          HD11      LEU  79   4.149  -3.551  -1.469
    7   HD12  LEU  79          HD12      LEU  79   2.528  -4.090  -1.032
    8   HD11  LEU  79          HD13      LEU  79   3.114  -4.312  -2.679
    9   HD23  LEU  79          HD21      LEU  79   2.049  -6.073  -0.326
   10   HD22  LEU  79          HD22      LEU  79   3.200  -7.402  -0.210
   11   HD21  LEU  79          HD23      LEU  79   2.387  -7.077  -1.738

  No H/Q in entry =          11
  In of MODEL    4
    1    H    HIS  80           H        HIS  80   7.549  -6.721  -1.716
    2    HA   HIS  80           HA       HIS  80   7.816  -5.169   0.649
    3    HB2  HIS  80           HB2      HIS  80   9.179  -7.524  -0.539
    4    HB3  HIS  80           HB3      HIS  80  10.079  -6.615   0.677
    5    HD1  HIS  80           HD1      HIS  80   9.588  -7.248   3.021
    6    HD2  HIS  80           HD2      HIS  80   6.385  -8.136   0.503
    7    HE1  HIS  80           HE1      HIS  80   7.822  -8.363   4.468
    8    HE2  HIS  80           HE2      HIS  80   5.864  -8.908   2.942

  No H/Q in entry =           8
  In of MODEL    4
    1    H    LEU  81           H        LEU  81   9.832  -5.436  -2.257
    2    HA   LEU  81           HA       LEU  81  11.858  -3.674  -1.378
    3    HB2  LEU  81           HB2      LEU  81  10.952  -4.483  -4.141
    4    HB3  LEU  81           HB3      LEU  81  12.362  -3.464  -3.850
    5    HG   LEU  81           HG       LEU  81  11.990  -6.184  -2.569
    6   HD12  LEU  81          HD11      LEU  81  13.816  -6.800  -4.312
    7   HD11  LEU  81          HD12      LEU  81  13.241  -5.384  -5.190
    8   HD13  LEU  81          HD13      LEU  81  12.140  -6.717  -4.850
    9   HD23  LEU  81          HD21      LEU  81  14.615  -5.846  -2.549
   10   HD22  LEU  81          HD22      LEU  81  13.623  -5.090  -1.304
   11   HD21  LEU  81          HD23      LEU  81  14.197  -4.138  -2.672

  No H/Q in entry =          11
  In of MODEL    4
    1    H    MET  82           H        MET  82   8.936  -3.069  -3.325
    2    HA   MET  82           HA       MET  82   9.454  -0.340  -3.833
    3    HB2  MET  82           HB2      MET  82   6.908  -1.955  -3.711
    4    HB3  MET  82           HB3      MET  82   6.894  -0.232  -4.080
    5    HG2  MET  82           HG2      MET  82   8.516  -2.296  -5.604
    6    HG3  MET  82           HG3      MET  82   6.945  -1.689  -6.123
    7    HE3  MET  82           HE1      MET  82   7.369   1.766  -7.305
    8    HE2  MET  82           HE2      MET  82   6.991   1.542  -5.598
    9    HE1  MET  82           HE3      MET  82   6.339   0.423  -6.791

  No H/Q in entry =           9
  In of MODEL    4
    1    H    THR  83           H        THR  83   7.668  -1.945  -1.228
    2    HA   THR  83           HA       THR  83   6.794   0.400   0.088
    3    HB   THR  83           HB       THR  83   6.666  -1.169   2.111
    4    HG1  THR  83           HG1      THR  83   7.440  -3.113   1.889
    5   HG22  THR  83          HG21      THR  83   5.030  -2.753   0.643
    6   HG21  THR  83          HG22      THR  83   5.249  -1.426  -0.493
    7   HG23  THR  83          HG23      THR  83   4.602  -1.111   1.117

  No H/Q in entry =           7
  In of MODEL    4
    1    H    SER  84           H        SER  84   9.633  -1.673   0.624
    2    HA   SER  84           HA       SER  84  10.674  -0.227   2.811
    3    HB2  SER  84           HB2      SER  84  11.948  -2.066   0.795
    4    HB3  SER  84           HB3      SER  84  12.885  -1.301   2.077
    5    HG   SER  84           HG       SER  84  10.623  -3.008   2.335

  No H/Q in entry =           5
  In of MODEL    4
    1    H    MET  85           H        MET  85  11.436   0.029  -0.676
    2    HA   MET  85           HA       MET  85  13.418   2.010  -0.425
    3    HB2  MET  85           HB2      MET  85  13.031   0.715  -2.488
    4    HB3  MET  85           HB3      MET  85  11.505   1.567  -2.725
    5    HG2  MET  85           HG2      MET  85  12.693   3.709  -2.869
    6    HG3  MET  85           HG3      MET  85  14.224   2.896  -2.561
    7    HE3  MET  85           HE1      MET  85  11.212   1.564  -5.127
    8    HE2  MET  85           HE2      MET  85  11.573   2.881  -6.239
    9    HE1  MET  85           HE3      MET  85  11.173   3.242  -4.565

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LEU  86           H        LEU  86   9.927   2.317  -0.945
    2    HA   LEU  86           HA       LEU  86   9.843   5.128  -1.136
    3    HB2  LEU  86           HB2      LEU  86   8.013   3.453  -1.712
    4    HB3  LEU  86           HB3      LEU  86   7.678   3.366   0.017
    5    HG   LEU  86           HG       LEU  86   7.499   5.926  -0.044
    6   HD11  LEU  86          HD11      LEU  86   8.286   5.487  -2.742
    7   HD13  LEU  86          HD12      LEU  86   7.836   7.014  -1.987
    8   HD12  LEU  86          HD13      LEU  86   6.609   6.039  -2.793
    9   HD23  LEU  86          HD21      LEU  86   5.380   4.552  -1.708
   10   HD22  LEU  86          HD22      LEU  86   5.177   5.814  -0.497
   11   HD21  LEU  86          HD23      LEU  86   5.587   4.174   0.003

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ALA  87           H        ALA  87   9.385   2.955   1.616
    2    HA   ALA  87           HA       ALA  87   8.816   4.871   3.577
    3    HB1  ALA  87           HB1      ALA  87   9.644   2.057   3.502
    4    HB3  ALA  87           HB2      ALA  87   8.510   2.864   4.582
    5    HB2  ALA  87           HB3      ALA  87  10.237   2.909   4.931

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ARG  88           H        ARG  88  11.913   3.466   2.610
    2    HA   ARG  88           HA       ARG  88  13.507   4.861   4.443
    3    HB2  ARG  88           HB2      ARG  88  14.194   2.888   3.047
    4    HB3  ARG  88           HB3      ARG  88  14.342   3.978   1.671
    5    HG2  ARG  88           HG2      ARG  88  15.800   5.309   3.618
    6    HG3  ARG  88           HG3      ARG  88  16.132   3.623   4.003
    7    HD2  ARG  88           HD2      ARG  88  17.406   3.330   2.161
    8    HD3  ARG  88           HD3      ARG  88  16.266   4.190   1.122
    9    HE   ARG  88           HE       ARG  88  18.650   5.274   2.172
   10   HH21  ARG  88          HH11      ARG  88  18.980   7.495   1.972
   11   HH22  ARG  88          HH12      ARG  88  17.622   8.556   1.821
   12   HH11  ARG  88          HH21      ARG  88  15.306   6.002   1.883
   13   HH12  ARG  88          HH22      ARG  88  15.540   7.708   1.746

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLU  89           H        GLU  89  12.537   5.742   1.114
    2    HA   GLU  89           HA       GLU  89  14.067   8.113   0.954
    3    HB2  GLU  89           HB2      GLU  89  12.935   7.057  -0.993
    4    HB3  GLU  89           HB3      GLU  89  11.385   7.589  -0.341
    5    HG2  GLU  89           HG2      GLU  89  12.070   9.931  -0.509
    6    HG3  GLU  89           HG3      GLU  89  13.679   9.451  -1.040

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LEU  90           H        LEU  90  10.738   7.582   2.077
    2    HA   LEU  90           HA       LEU  90  10.202  10.314   2.642
    3    HB2  LEU  90           HB2      LEU  90   9.023   7.735   3.674
    4    HB3  LEU  90           HB3      LEU  90   8.380   9.327   4.091
    5    HG   LEU  90           HG       LEU  90   8.812   8.441   1.225
    6   HD12  LEU  90          HD11      LEU  90   6.280   8.094   1.282
    7   HD11  LEU  90          HD12      LEU  90   6.430   8.090   3.039
    8   HD13  LEU  90          HD13      LEU  90   7.260   6.864   2.081
    9   HD22  LEU  90          HD21      LEU  90   8.501  10.747   1.144
   10   HD21  LEU  90          HD22      LEU  90   7.511  10.776   2.601
   11   HD23  LEU  90          HD23      LEU  90   6.822  10.212   1.080

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  91           H        ILE  91  11.479   7.647   4.576
    2    HA   ILE  91           HA       ILE  91  11.603   9.021   7.040
    3    HB   ILE  91           HB       ILE  91  13.177   6.690   5.928
    4   HG12  ILE  91          HG12      ILE  91  11.154   6.850   8.182
    5   HG13  ILE  91          HG13      ILE  91  10.690   6.560   6.506
    6   HG22  ILE  91          HG21      ILE  91  13.642   6.488   8.570
    7   HG21  ILE  91          HG22      ILE  91  13.553   8.246   8.464
    8   HG23  ILE  91          HG23      ILE  91  14.741   7.364   7.505
    9   HD13  ILE  91          HD11      ILE  91  11.707   4.466   6.445
   10   HD12  ILE  91          HD12      ILE  91  11.110   4.525   8.103
   11   HD11  ILE  91          HD13      ILE  91  12.810   4.849   7.768

  No H/Q in entry =          11
  In of MODEL    4
    1    H    THR  92           H        THR  92  13.828   8.860   4.295
    2    HA   THR  92           HA       THR  92  15.980  10.272   5.455
    3    HB   THR  92           HB       THR  92  15.003  10.131   2.593
    4    HG1  THR  92           HG1      THR  92  15.847   8.241   3.005
    5   HG22  THR  92          HG21      THR  92  17.568  10.839   2.303
    6   HG21  THR  92          HG22      THR  92  17.250  11.663   3.830
    7   HG23  THR  92          HG23      THR  92  16.281  12.039   2.405

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLU  93           H        GLU  93  13.089  11.399   3.716
    2    HA   GLU  93           HA       GLU  93  13.664  14.164   3.823
    3    HB2  GLU  93           HB2      GLU  93  10.969  12.772   3.835
    4    HB3  GLU  93           HB3      GLU  93  11.246  14.473   3.459
    5    HG2  GLU  93           HG2      GLU  93  12.604  12.236   1.941
    6    HG3  GLU  93           HG3      GLU  93  11.054  12.905   1.448

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LEU  94           H        LEU  94  11.931  12.002   6.036
    2    HA   LEU  94           HA       LEU  94  11.103  13.948   7.905
    3    HB2  LEU  94           HB2      LEU  94  11.700  10.998   8.189
    4    HB3  LEU  94           HB3      LEU  94  11.118  11.974   9.535
    5    HG   LEU  94           HG       LEU  94   9.640  12.007   6.903
    6   HD11  LEU  94          HD11      LEU  94   9.734   9.792   8.914
    7   HD13  LEU  94          HD12      LEU  94   9.437   9.724   7.179
    8   HD12  LEU  94          HD13      LEU  94   8.152  10.234   8.272
    9   HD23  LEU  94          HD21      LEU  94   7.714  12.397   8.497
   10   HD22  LEU  94          HD22      LEU  94   8.943  13.660   8.533
   11   HD21  LEU  94          HD23      LEU  94   8.886  12.447   9.811

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  95           H        ILE  95  14.091  12.040   7.681
    2    HA   ILE  95           HA       ILE  95  15.247  12.978  10.095
    3    HB   ILE  95           HB       ILE  95  16.499  11.910   7.553
    4   HG12  ILE  95          HG12      ILE  95  16.206  10.716  10.323
    5   HG13  ILE  95          HG13      ILE  95  15.044  10.445   9.026
    6   HG21  ILE  95          HG21      ILE  95  17.743  12.734  10.195
    7   HG23  ILE  95          HG22      ILE  95  18.205  13.261   8.575
    8   HG22  ILE  95          HG23      ILE  95  18.522  11.604   9.090
    9   HD13  ILE  95          HD11      ILE  95  16.536   9.173   7.770
   10   HD12  ILE  95          HD12      ILE  95  17.009   8.733   9.409
   11   HD11  ILE  95          HD13      ILE  95  17.955   9.917   8.508

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLU  96           H        GLU  96  15.400  14.202   6.757
    2    HA   GLU  96           HA       GLU  96  17.230  16.296   7.232
    3    HB2  GLU  96           HB2      GLU  96  16.576  15.622   4.973
    4    HB3  GLU  96           HB3      GLU  96  14.928  16.168   5.268
    5    HG2  GLU  96           HG2      GLU  96  15.480  18.299   4.721
    6    HG3  GLU  96           HG3      GLU  96  16.776  18.313   5.906

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LEU  97           H        LEU  97  13.719  16.084   7.654
    2    HA   LEU  97           HA       LEU  97  13.282  18.817   8.287
    3    HB2  LEU  97           HB2      LEU  97  11.780  16.282   8.905
    4    HB3  LEU  97           HB3      LEU  97  11.255  17.827   9.570
    5    HG   LEU  97           HG       LEU  97  11.747  17.406   6.608
    6   HD12  LEU  97          HD11      LEU  97   9.225  17.259   6.485
    7   HD11  LEU  97          HD12      LEU  97   9.216  17.065   8.236
    8   HD13  LEU  97          HD13      LEU  97  10.008  15.860   7.219
    9   HD23  LEU  97          HD21      LEU  97   9.995  19.358   6.631
   10   HD22  LEU  97          HD22      LEU  97  11.673  19.730   7.026
   11   HD21  LEU  97          HD23      LEU  97  10.483  19.555   8.314

  No H/Q in entry =          11
  In of MODEL    4
    1    H    HIS  98           H        HIS  98  14.120  16.003  10.292
    2    HA   HIS  98           HA       HIS  98  13.947  17.270  12.804
    3    HB2  HIS  98           HB2      HIS  98  15.715  15.022  11.813
    4    HB3  HIS  98           HB3      HIS  98  15.706  15.566  13.493
    5    HD1  HIS  98           HD1      HIS  98  13.524  13.913  10.901
    6    HD2  HIS  98           HD2      HIS  98  13.402  14.844  14.962
    7    HE1  HIS  98           HE1      HIS  98  11.506  12.706  11.852
    8    HE2  HIS  98           HE2      HIS  98  11.412  13.265  14.322

  No H/Q in entry =           8
  In of MODEL    4
    1    H    GLU  99           H        GLU  99  16.506  17.166  10.375
    2    HA   GLU  99           HA       GLU  99  18.479  18.516  11.904
    3    HB2  GLU  99           HB2      GLU  99  18.972  17.226   9.840
    4    HB3  GLU  99           HB3      GLU  99  18.155  18.472   8.894
    5    HG2  GLU  99           HG2      GLU  99  19.750  20.156   9.683
    6    HG3  GLU  99           HG3      GLU  99  20.535  18.963  10.711

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LYS 100           H        LYS 100  15.952  19.654   9.679
    2    HA   LYS 100           HA       LYS 100  16.730  22.397   9.817
    3    HB2  LYS 100           HB2      LYS 100  14.108  21.088   9.061
    4    HB3  LYS 100           HB3      LYS 100  14.396  22.828   8.966
    5    HG2  LYS 100           HG2      LYS 100  16.374  22.389   7.505
    6    HG3  LYS 100           HG3      LYS 100  15.972  20.669   7.526
    7    HD2  LYS 100           HD2      LYS 100  13.776  21.161   6.520
    8    HD3  LYS 100           HD3      LYS 100  14.160  22.882   6.505
    9    HE2  LYS 100           HE2      LYS 100  16.126  22.411   5.051
   10    HE3  LYS 100           HE3      LYS 100  15.672  20.703   5.022
   11    HZ1  LYS 100           HZ1      LYS 100  13.834  22.881   4.177
   12    HZ3  LYS 100           HZ2      LYS 100  13.662  21.209   3.919
   13    HZ2  LYS 100           HZ3      LYS 100  14.868  22.077   3.098

  No H/Q in entry =          13
  In of MODEL    4
    1    H    LEU 101           H        LEU 101  14.643  20.343  11.784
    2    HA   LEU 101           HA       LEU 101  13.459  22.407  13.354
    3    HB2  LEU 101           HB2      LEU 101  13.920  19.462  13.747
    4    HB3  LEU 101           HB3      LEU 101  13.375  20.443  15.104
    5    HG   LEU 101           HG       LEU 101  11.962  20.514  12.432
    6   HD12  LEU 101          HD11      LEU 101  10.311  18.943  13.702
    7   HD11  LEU 101          HD12      LEU 101  11.706  18.542  14.701
    8   HD13  LEU 101          HD13      LEU 101  11.745  18.230  12.965
    9   HD21  LEU 101          HD21      LEU 101  11.294  21.311  15.281
   10   HD23  LEU 101          HD22      LEU 101  10.037  21.073  14.068
   11   HD22  LEU 101          HD23      LEU 101  11.264  22.316  13.829

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LYS 102           H        LYS 102  16.612  21.819  12.925
    2    HA   LYS 102           HA       LYS 102  18.450  22.705  13.999
    3    HB2  LYS 102           HB2      LYS 102  16.624  24.211  15.125
    4    HB3  LYS 102           HB3      LYS 102  16.835  23.154  16.505
    5    HG2  LYS 102           HG2      LYS 102  18.718  25.174  15.334
    6    HG3  LYS 102           HG3      LYS 102  18.334  24.862  17.013
    7    HD2  LYS 102           HD2      LYS 102  20.017  22.956  15.336
    8    HD3  LYS 102           HD3      LYS 102  20.696  24.285  16.266
    9    HE2  LYS 102           HE2      LYS 102  20.312  21.736  17.241
   10    HE3  LYS 102           HE3      LYS 102  20.520  23.182  18.229
   11    HZ2  LYS 102           HZ1      LYS 102  18.558  21.887  18.847
   12    HZ1  LYS 102           HZ2      LYS 102  17.916  22.109  17.296
   13    HZ3  LYS 102           HZ3      LYS 102  18.135  23.443  18.318

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ALA 103           H        ALA 103  16.384  21.093  16.421
    2    HA   ALA 103           HA       ALA 103  18.116  19.898  18.083
    3    HB2  ALA 103           HB1      ALA 103  16.544  17.880  18.080
    4    HB1  ALA 103           HB2      ALA 103  15.646  18.725  16.818
    5    HB3  ALA 103           HB3      ALA 103  15.816  19.451  18.415

  No H/Q in entry =           5
  In of MODEL    4
    1    H1   ALA   1           H3       ALA   1  -1.564  -7.191 -21.502
    2    H2   ALA   1           H2       ALA   1  -2.351  -8.630 -21.046
    3    H3   ALA   1           H1       ALA   1  -0.742  -8.672 -21.598
    4    HA   ALA   1           HA       ALA   1  -1.568  -9.152 -23.594
    5    HB1  ALA   1           HB1      ALA   1  -3.702  -9.881 -23.123
    6    HB2  ALA   1           HB2      ALA   1  -4.148  -8.375 -23.926
    7    HB3  ALA   1           HB3      ALA   1  -4.091  -8.451 -22.167

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLU   2           H        GLU   2  -2.401  -7.972 -25.589
    2    HA   GLU   2           HA       GLU   2  -1.012  -5.952 -26.469
    3    HB2  GLU   2           HB2      GLU   2  -4.019  -6.037 -26.792
    4    HB3  GLU   2           HB3      GLU   2  -2.901  -5.171 -27.842
    5    HG2  GLU   2           HG2      GLU   2  -2.384  -7.061 -28.991
    6    HG3  GLU   2           HG3      GLU   2  -2.084  -7.961 -27.510

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLU   3           H        GLU   3  -4.182  -4.711 -25.579
    2    HA   GLU   3           HA       GLU   3  -3.152  -2.147 -24.955
    3    HB2  GLU   3           HB2      GLU   3  -5.833  -3.477 -24.625
    4    HB3  GLU   3           HB3      GLU   3  -5.546  -1.858 -23.982
    5    HG2  GLU   3           HG2      GLU   3  -5.190  -0.935 -26.110
    6    HG3  GLU   3           HG3      GLU   3  -4.785  -2.490 -26.830

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LEU   4           H        LEU   4  -4.733  -4.510 -22.772
    2    HA   LEU   4           HA       LEU   4  -4.381  -3.273 -20.384
    3    HB2  LEU   4           HB2      LEU   4  -3.820  -6.213 -20.844
    4    HB3  LEU   4           HB3      LEU   4  -4.234  -5.465 -19.303
    5    HG   LEU   4           HG       LEU   4  -6.001  -5.555 -21.771
    6   HD13  LEU   4          HD11      LEU   4  -7.186  -7.277 -20.772
    7   HD12  LEU   4          HD12      LEU   4  -6.707  -6.810 -19.140
    8   HD11  LEU   4          HD13      LEU   4  -5.564  -7.650 -20.187
    9   HD23  LEU   4          HD21      LEU   4  -7.694  -4.749 -19.909
   10   HD22  LEU   4          HD22      LEU   4  -6.661  -3.574 -20.720
   11   HD21  LEU   4          HD23      LEU   4  -6.235  -4.157 -19.112

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLU   5           H        GLU   5  -1.869  -5.106 -22.104
    2    HA   GLU   5           HA       GLU   5   0.109  -4.806 -20.064
    3    HB2  GLU   5           HB2      GLU   5   0.197  -6.582 -21.800
    4    HB3  GLU   5           HB3      GLU   5   0.485  -5.344 -23.024
    5    HG2  GLU   5           HG2      GLU   5   2.550  -4.669 -21.892
    6    HG3  GLU   5           HG3      GLU   5   2.259  -5.850 -20.616

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLU   6           H        GLU   6  -0.530  -3.104 -23.114
    2    HA   GLU   6           HA       GLU   6   1.629  -1.259 -22.846
    3    HB2  GLU   6           HB2      GLU   6  -0.931  -1.171 -24.457
    4    HB3  GLU   6           HB3      GLU   6   0.337   0.049 -24.571
    5    HG2  GLU   6           HG2      GLU   6   0.761  -2.916 -25.039
    6    HG3  GLU   6           HG3      GLU   6   0.540  -1.725 -26.320

  No H/Q in entry =           6
  In of MODEL    4
    1    H    VAL   7           H        VAL   7  -1.711  -1.347 -21.809
    2    HA   VAL   7           HA       VAL   7  -1.950   1.367 -20.980
    3    HB   VAL   7           HB       VAL   7  -3.400  -1.157 -20.140
    4   HG11  VAL   7          HG11      VAL   7  -3.793   1.731 -19.334
    5   HG13  VAL   7          HG12      VAL   7  -3.688   0.310 -18.295
    6   HG12  VAL   7          HG13      VAL   7  -5.119   0.569 -19.291
    7   HG21  VAL   7          HG21      VAL   7  -3.557  -0.088 -22.532
    8   HG23  VAL   7          HG22      VAL   7  -4.512   1.157 -21.725
    9   HG22  VAL   7          HG23      VAL   7  -5.048  -0.523 -21.695

  No H/Q in entry =           9
  In of MODEL    4
    1    H    VAL   8           H        VAL   8  -0.949  -1.609 -19.327
    2    HA   VAL   8           HA       VAL   8  -0.643  -0.521 -16.733
    3    HB   VAL   8           HB       VAL   8   0.774  -2.833 -18.082
    4   HG12  VAL   8          HG11      VAL   8   1.169  -3.478 -15.606
    5   HG11  VAL   8          HG12      VAL   8   0.846  -1.781 -15.252
    6   HG13  VAL   8          HG13      VAL   8   2.199  -2.222 -16.293
    7   HG21  VAL   8          HG21      VAL   8  -1.884  -2.625 -17.371
    8   HG23  VAL   8          HG22      VAL   8  -1.182  -3.268 -15.891
    9   HG22  VAL   8          HG23      VAL   8  -0.997  -4.149 -17.403

  No H/Q in entry =           9
  In of MODEL    4
    1    H    MET   9           H        MET   9   1.614  -0.816 -19.475
    2    HA   MET   9           HA       MET   9   3.891   0.243 -18.211
    3    HB2  MET   9           HB2      MET   9   2.950   0.264 -21.078
    4    HB3  MET   9           HB3      MET   9   4.464   1.029 -20.597
    5    HG2  MET   9           HG2      MET   9   5.287  -1.081 -19.688
    6    HG3  MET   9           HG3      MET   9   3.745  -1.863 -20.038
    7    HE1  MET   9           HE1      MET   9   6.665   0.046 -21.209
    8    HE3  MET   9           HE2      MET   9   5.730   0.761 -22.519
    9    HE2  MET   9           HE3      MET   9   6.988  -0.417 -22.884

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLY  10           H        GLY  10   1.202   1.827 -19.898
    2    HA3  GLY  10           HA2      GLY  10   2.152   4.486 -19.659
    3    HA2  GLY  10           HA3      GLY  10   0.465   4.017 -19.866

  No H/Q in entry =           3
  In of MODEL    4
    1    H    LEU  11           H        LEU  11   0.069   2.493 -17.577
    2    HA   LEU  11           HA       LEU  11  -0.475   4.472 -15.623
    3    HB2  LEU  11           HB2      LEU  11  -0.393   1.457 -15.459
    4    HB3  LEU  11           HB3      LEU  11  -0.910   2.481 -14.120
    5    HG   LEU  11           HG       LEU  11  -2.144   2.582 -16.886
    6   HD13  LEU  11          HD11      LEU  11  -2.719   0.438 -16.127
    7   HD12  LEU  11          HD12      LEU  11  -4.075   1.425 -15.586
    8   HD11  LEU  11          HD13      LEU  11  -2.819   0.953 -14.442
    9   HD22  LEU  11          HD21      LEU  11  -2.746   4.598 -15.885
   10   HD21  LEU  11          HD22      LEU  11  -2.671   3.936 -14.253
   11   HD23  LEU  11          HD23      LEU  11  -4.042   3.561 -15.296

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  12           H        ILE  12   2.080   2.017 -15.855
    2    HA   ILE  12           HA       ILE  12   3.279   2.566 -13.350
    3    HB   ILE  12           HB       ILE  12   4.546   1.529 -15.907
    4   HG12  ILE  12          HG12      ILE  12   2.531   0.290 -14.775
    5   HG13  ILE  12          HG13      ILE  12   3.935  -0.640 -15.253
    6   HG22  ILE  12          HG21      ILE  12   6.213   0.504 -14.307
    7   HG21  ILE  12          HG22      ILE  12   5.507   1.492 -13.028
    8   HG23  ILE  12          HG23      ILE  12   6.290   2.263 -14.406
    9   HD12  ILE  12          HD11      ILE  12   3.073  -1.190 -12.971
   10   HD11  ILE  12          HD12      ILE  12   3.449   0.458 -12.473
   11   HD13  ILE  12          HD13      ILE  12   4.735  -0.626 -12.959

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  13           H        ILE  13   3.880   3.824 -16.609
    2    HA   ILE  13           HA       ILE  13   6.008   5.556 -15.886
    3    HB   ILE  13           HB       ILE  13   3.979   5.630 -18.134
    4   HG12  ILE  13          HG12      ILE  13   5.808   3.784 -17.851
    5   HG13  ILE  13          HG13      ILE  13   5.571   4.525 -19.430
    6   HG22  ILE  13          HG21      ILE  13   5.831   7.174 -19.179
    7   HG21  ILE  13          HG22      ILE  13   6.252   7.506 -17.503
    8   HG23  ILE  13          HG23      ILE  13   4.634   7.879 -18.091
    9   HD11  ILE  13          HD11      ILE  13   7.654   5.497 -17.440
   10   HD13  ILE  13          HD12      ILE  13   7.485   5.955 -19.131
   11   HD12  ILE  13          HD13      ILE  13   7.989   4.323 -18.711

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ASN  14           H        ASN  14   2.500   6.034 -16.160
    2    HA   ASN  14           HA       ASN  14   2.444   8.782 -15.529
    3    HB2  ASN  14           HB2      ASN  14   0.559   7.129 -16.359
    4    HB3  ASN  14           HB3      ASN  14   0.236   6.953 -14.638
    5   HD21  ASN  14          HD21      ASN  14  -1.786   8.097 -16.077
    6   HD22  ASN  14          HD22      ASN  14  -1.857   9.771 -15.813

  No H/Q in entry =           6
  In of MODEL    4
    1    H    SER  15           H        SER  15   2.159   5.908 -13.446
    2    HA   SER  15           HA       SER  15   1.842   7.283 -11.002
    3    HB2  SER  15           HB2      SER  15   2.400   5.202  -9.947
    4    HB3  SER  15           HB3      SER  15   1.573   4.776 -11.441
    5    HG   SER  15           HG       SER  15   3.363   3.968 -12.201

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLY  16           H        GLY  16   4.725   6.196 -12.754
    2    HA3  GLY  16           HA2      GLY  16   6.644   6.966 -10.822
    3    HA2  GLY  16           HA3      GLY  16   6.951   6.761 -12.545

  No H/Q in entry =           3
  In of MODEL    4
    1    H    GLN  17           H        GLN  17   5.253   8.708 -13.615
    2    HA   GLN  17           HA       GLN  17   6.818  11.058 -13.310
    3    HB2  GLN  17           HB2      GLN  17   5.496  10.558 -15.351
    4    HB3  GLN  17           HB3      GLN  17   4.011  10.790 -14.429
    5    HG2  GLN  17           HG2      GLN  17   4.681  13.116 -13.933
    6    HG3  GLN  17           HG3      GLN  17   6.153  12.887 -14.875
    7   HE21  GLN  17          HE21      GLN  17   5.968  13.654 -16.979
    8   HE22  GLN  17          HE22      GLN  17   4.523  13.715 -17.869

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ALA  18           H        ALA  18   3.721  10.027 -11.963
    2    HA   ALA  18           HA       ALA  18   2.981  12.415 -10.704
    3    HB1  ALA  18           HB1      ALA  18   1.866   9.951 -10.922
    4    HB2  ALA  18           HB2      ALA  18   1.309  11.171  -9.779
    5    HB3  ALA  18           HB3      ALA  18   2.405   9.896  -9.244

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ARG  19           H        ARG  19   4.868   9.666  -9.416
    2    HA   ARG  19           HA       ARG  19   5.391  10.833  -6.896
    3    HB2  ARG  19           HB2      ARG  19   5.820   8.431  -7.416
    4    HB3  ARG  19           HB3      ARG  19   7.174   8.922  -8.437
    5    HG2  ARG  19           HG2      ARG  19   8.285   9.974  -6.515
    6    HG3  ARG  19           HG3      ARG  19   6.910   9.580  -5.485
    7    HD2  ARG  19           HD2      ARG  19   8.681   7.956  -5.120
    8    HD3  ARG  19           HD3      ARG  19   7.313   7.164  -5.906
    9    HE   ARG  19           HE       ARG  19   9.015   7.988  -7.953
   10   HH21  ARG  19          HH11      ARG  19  10.586   6.590  -8.797
   11   HH22  ARG  19          HH12      ARG  19  11.138   5.248  -7.858
   12   HH11  ARG  19          HH21      ARG  19   9.095   5.965  -5.169
   13   HH12  ARG  19          HH22      ARG  19  10.291   4.893  -5.802

  No H/Q in entry =          13
  In of MODEL    4
    1    H    SER  20           H        SER  20   7.212  10.866  -9.942
    2    HA   SER  20           HA       SER  20   9.447  12.298  -9.118
    3    HB2  SER  20           HB2      SER  20   9.238  11.302 -11.362
    4    HB3  SER  20           HB3      SER  20   8.016  12.499 -11.777
    5    HG   SER  20           HG       SER  20  10.743  12.927 -11.125

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU  21           H        LEU  21   6.341  13.544 -10.323
    2    HA   LEU  21           HA       LEU  21   6.993  16.294 -10.105
    3    HB2  LEU  21           HB2      LEU  21   4.334  14.853 -10.024
    4    HB3  LEU  21           HB3      LEU  21   4.490  16.609 -10.034
    5    HG   LEU  21           HG       LEU  21   5.711  14.822 -12.157
    6   HD13  LEU  21          HD11      LEU  21   3.810  15.264 -13.545
    7   HD12  LEU  21          HD12      LEU  21   3.160  16.434 -12.395
    8   HD11  LEU  21          HD13      LEU  21   3.169  14.718 -11.995
    9   HD21  LEU  21          HD21      LEU  21   5.414  17.793 -11.754
   10   HD23  LEU  21          HD22      LEU  21   5.450  17.160 -13.397
   11   HD22  LEU  21          HD23      LEU  21   6.818  16.897 -12.327

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ALA  22           H        ALA  22   5.494  14.000  -7.853
    2    HA   ALA  22           HA       ALA  22   4.875  15.808  -5.791
    3    HB3  ALA  22           HB1      ALA  22   4.131  13.410  -5.950
    4    HB2  ALA  22           HB2      ALA  22   4.714  13.891  -4.355
    5    HB1  ALA  22           HB3      ALA  22   5.745  12.937  -5.422

  No H/Q in entry =           5
  In of MODEL    4
    1    H    TYR  23           H        TYR  23   7.824  13.803  -6.220
    2    HA   TYR  23           HA       TYR  23   9.196  14.838  -3.968
    3    HB2  TYR  23           HB2      TYR  23   9.999  12.834  -5.120
    4    HB3  TYR  23           HB3      TYR  23  10.308  13.770  -6.582
    5    HD1  TYR  23           HD1      TYR  23  11.261  13.472  -2.981
    6    HD2  TYR  23           HD2      TYR  23  12.343  14.934  -6.874
    7    HE1  TYR  23           HE1      TYR  23  13.513  14.069  -2.132
    8    HE2  TYR  23           HE2      TYR  23  14.594  15.533  -6.024
    9    HH   TYR  23           HH       TYR  23  15.517  14.869  -2.641

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ALA  24           H        ALA  24   9.010  15.935  -7.338
    2    HA   ALA  24           HA       ALA  24  10.888  18.036  -7.094
    3    HB2  ALA  24           HB1      ALA  24  10.449  18.089  -9.304
    4    HB3  ALA  24           HB2      ALA  24   8.887  18.827  -8.948
    5    HB1  ALA  24           HB3      ALA  24   9.027  17.075  -9.074

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA  25           H        ALA  25   7.410  17.825  -6.478
    2    HA   ALA  25           HA       ALA  25   6.907  20.540  -5.916
    3    HB1  ALA  25           HB1      ALA  25   5.263  18.527  -6.114
    4    HB2  ALA  25           HB2      ALA  25   4.882  19.816  -4.970
    5    HB3  ALA  25           HB3      ALA  25   5.584  18.302  -4.394

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU  26           H        LEU  26   7.995  17.875  -3.858
    2    HA   LEU  26           HA       LEU  26   8.084  19.313  -1.424
    3    HB2  LEU  26           HB2      LEU  26   8.200  16.898  -1.412
    4    HB3  LEU  26           HB3      LEU  26   9.672  16.916  -2.381
    5    HG   LEU  26           HG       LEU  26  10.874  18.049  -0.542
    6   HD12  LEU  26          HD11      LEU  26   9.644  18.052   1.716
    7   HD11  LEU  26          HD12      LEU  26   8.159  17.899   0.780
    8   HD13  LEU  26          HD13      LEU  26   9.192  19.313   0.569
    9   HD21  LEU  26          HD21      LEU  26   9.361  15.570   0.336
   10   HD23  LEU  26          HD22      LEU  26  10.871  16.148   1.033
   11   HD22  LEU  26          HD23      LEU  26  10.833  15.584  -0.635

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LYS  27           H        LYS  27  10.509  18.756  -3.944
    2    HA   LYS  27           HA       LYS  27  12.680  20.020  -2.716
    3    HB2  LYS  27           HB2      LYS  27  12.797  18.668  -4.802
    4    HB3  LYS  27           HB3      LYS  27  12.021  19.991  -5.672
    5    HG2  LYS  27           HG2      LYS  27  13.872  21.495  -5.096
    6    HG3  LYS  27           HG3      LYS  27  14.643  20.213  -4.155
    7    HD2  LYS  27           HD2      LYS  27  14.802  18.821  -6.205
    8    HD3  LYS  27           HD3      LYS  27  14.076  20.130  -7.138
    9    HE2  LYS  27           HE2      LYS  27  15.948  21.615  -6.527
   10    HE3  LYS  27           HE3      LYS  27  16.678  20.310  -5.585
   11    HZ3  LYS  27           HZ1      LYS  27  17.670  20.414  -7.770
   12    HZ2  LYS  27           HZ2      LYS  27  16.146  20.279  -8.513
   13    HZ1  LYS  27           HZ3      LYS  27  16.780  18.977  -7.624

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLN  28           H        GLN  28  10.047  21.372  -4.672
    2    HA   GLN  28           HA       GLN  28  10.981  24.033  -4.832
    3    HB2  GLN  28           HB2      GLN  28   8.158  22.939  -4.718
    4    HB3  GLN  28           HB3      GLN  28   8.558  24.612  -5.103
    5    HG2  GLN  28           HG2      GLN  28   9.567  22.194  -6.631
    6    HG3  GLN  28           HG3      GLN  28   8.232  23.225  -7.146
    7   HE21  GLN  28          HE21      GLN  28  11.389  22.732  -7.841
    8   HE22  GLN  28          HE22      GLN  28  11.867  24.314  -8.228

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ALA  29           H        ALA  29   9.063  22.328  -2.393
    2    HA   ALA  29           HA       ALA  29   8.490  24.520  -0.718
    3    HB2  ALA  29           HB1      ALA  29   7.774  22.948   0.853
    4    HB1  ALA  29           HB2      ALA  29   9.008  21.775   0.393
    5    HB3  ALA  29           HB3      ALA  29   7.620  22.052  -0.658

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LYS  30           H        LYS  30  11.242  22.279  -0.778
    2    HA   LYS  30           HA       LYS  30  12.548  23.253   1.524
    3    HB2  LYS  30           HB2      LYS  30  13.660  21.971  -0.981
    4    HB3  LYS  30           HB3      LYS  30  14.637  22.344   0.441
    5    HG2  LYS  30           HG2      LYS  30  13.096  20.949   1.822
    6    HG3  LYS  30           HG3      LYS  30  12.217  20.514   0.352
    7    HD2  LYS  30           HD2      LYS  30  14.273  19.546  -0.603
    8    HD3  LYS  30           HD3      LYS  30  15.171  19.994   0.849
    9    HE2  LYS  30           HE2      LYS  30  13.678  18.552   2.205
   10    HE3  LYS  30           HE3      LYS  30  12.811  18.084   0.737
   11    HZ2  LYS  30           HZ1      LYS  30  14.617  16.526   1.505
   12    HZ1  LYS  30           HZ2      LYS  30  15.743  17.723   1.051
   13    HZ3  LYS  30           HZ3      LYS  30  14.716  17.025  -0.113

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLN  31           H        GLN  31  12.431  24.447  -1.776
    2    HA   GLN  31           HA       GLN  31  14.564  26.363  -1.357
    3    HB2  GLN  31           HB2      GLN  31  12.523  26.383  -3.584
    4    HB3  GLN  31           HB3      GLN  31  14.136  27.095  -3.585
    5    HG2  GLN  31           HG2      GLN  31  14.625  24.406  -3.001
    6    HG3  GLN  31           HG3      GLN  31  13.323  24.335  -4.182
    7   HE21  GLN  31          HE21      GLN  31  16.175  23.569  -4.580
    8   HE22  GLN  31          HE22      GLN  31  16.739  24.545  -5.848

  No H/Q in entry =           8
  In of MODEL    4
    1    H    GLY  32           H        GLY  32  11.490  26.153  -0.215
    2    HA3  GLY  32           HA2      GLY  32  10.316  27.713   1.053
    3    HA2  GLY  32           HA3      GLY  32  11.430  28.958   0.500

  No H/Q in entry =           3
  In of MODEL    4
    1    H    ASP  33           H        ASP  33  10.088  27.033  -1.988
    2    HA   ASP  33           HA       ASP  33   8.402  29.287  -2.852
    3    HB2  ASP  33           HB2      ASP  33   9.521  26.875  -4.286
    4    HB3  ASP  33           HB3      ASP  33   8.360  27.977  -5.021

  No H/Q in entry =           4
  In of MODEL    4
    1    H    PHE  34           H        PHE  34   6.716  28.799  -1.289
    2    HA   PHE  34           HA       PHE  34   5.362  26.313  -1.188
    3    HB2  PHE  34           HB2      PHE  34   4.372  29.092  -0.518
    4    HB3  PHE  34           HB3      PHE  34   3.538  27.594  -0.103
    5    HD1  PHE  34           HD1      PHE  34   5.762  30.018   1.107
    6    HD2  PHE  34           HD2      PHE  34   5.125  25.771   1.065
    7    HE1  PHE  34           HE1      PHE  34   7.152  29.788   3.146
    8    HE2  PHE  34           HE2      PHE  34   6.517  25.544   3.102
    9    HZ   PHE  34           HZ       PHE  34   7.525  27.553   4.142

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ALA  35           H        ALA  35   4.905  29.167  -3.208
    2    HA   ALA  35           HA       ALA  35   2.361  28.524  -4.234
    3    HB3  ALA  35           HB1      ALA  35   3.402  29.921  -6.274
    4    HB2  ALA  35           HB2      ALA  35   4.614  30.298  -5.050
    5    HB1  ALA  35           HB3      ALA  35   2.919  30.690  -4.763

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA  36           H        ALA  36   5.598  27.879  -5.583
    2    HA   ALA  36           HA       ALA  36   4.627  26.434  -7.824
    3    HB3  ALA  36           HB1      ALA  36   6.785  26.579  -8.437
    4    HB2  ALA  36           HB2      ALA  36   7.275  25.559  -7.083
    5    HB1  ALA  36           HB3      ALA  36   7.152  27.306  -6.873

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA  37           H        ALA  37   5.589  25.459  -4.565
    2    HA   ALA  37           HA       ALA  37   5.559  22.669  -4.986
    3    HB2  ALA  37           HB1      ALA  37   5.277  24.464  -2.613
    4    HB1  ALA  37           HB2      ALA  37   6.424  23.157  -2.901
    5    HB3  ALA  37           HB3      ALA  37   4.766  22.787  -2.430

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LYS  38           H        LYS  38   3.002  24.854  -3.827
    2    HA   LYS  38           HA       LYS  38   0.922  23.020  -3.602
    3    HB2  LYS  38           HB2      LYS  38   1.245  25.780  -3.358
    4    HB3  LYS  38           HB3      LYS  38   0.048  25.617  -4.638
    5    HG2  LYS  38           HG2      LYS  38  -1.389  24.283  -3.194
    6    HG3  LYS  38           HG3      LYS  38  -0.146  24.239  -1.936
    7    HD2  LYS  38           HD2      LYS  38  -0.357  26.575  -1.495
    8    HD3  LYS  38           HD3      LYS  38  -1.270  26.850  -2.979
    9    HE2  LYS  38           HE2      LYS  38  -2.776  26.874  -1.042
   10    HE3  LYS  38           HE3      LYS  38  -3.134  25.491  -2.081
   11    HZ3  LYS  38           HZ1      LYS  38  -2.396  24.032  -0.543
   12    HZ2  LYS  38           HZ2      LYS  38  -2.761  25.289   0.543
   13    HZ1  LYS  38           HZ3      LYS  38  -1.163  25.053   0.020

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ALA  39           H        ALA  39   1.885  24.924  -6.455
    2    HA   ALA  39           HA       ALA  39  -0.179  24.031  -8.158
    3    HB2  ALA  39           HB1      ALA  39   2.551  24.705  -9.210
    4    HB1  ALA  39           HB2      ALA  39   1.571  25.958  -8.450
    5    HB3  ALA  39           HB3      ALA  39   0.969  25.111  -9.874

  No H/Q in entry =           5
  In of MODEL    4
    1    H    MET  40           H        MET  40   3.071  22.767  -7.571
    2    HA   MET  40           HA       MET  40   2.997  20.741  -9.557
    3    HB2  MET  40           HB2      MET  40   4.603  20.988  -7.007
    4    HB3  MET  40           HB3      MET  40   4.868  19.732  -8.218
    5    HG2  MET  40           HG2      MET  40   4.895  22.686  -8.891
    6    HG3  MET  40           HG3      MET  40   6.350  21.800  -8.438
    7    HE3  MET  40           HE1      MET  40   7.249  19.586 -11.239
    8    HE2  MET  40           HE2      MET  40   6.687  19.265  -9.602
    9    HE1  MET  40           HE3      MET  40   7.769  20.623  -9.904

  No H/Q in entry =           9
  In of MODEL    4
    1    H    MET  41           H        MET  41   2.077  20.783  -6.134
    2    HA   MET  41           HA       MET  41   1.573  18.014  -5.850
    3    HB2  MET  41           HB2      MET  41   0.214  20.361  -4.507
    4    HB3  MET  41           HB3      MET  41   0.076  18.683  -3.994
    5    HG2  MET  41           HG2      MET  41   2.784  18.934  -4.029
    6    HG3  MET  41           HG3      MET  41   2.325  20.589  -3.638
    7    HE2  MET  41           HE1      MET  41  -0.703  19.309  -1.913
    8    HE1  MET  41           HE2      MET  41   0.098  20.829  -2.294
    9    HE3  MET  41           HE3      MET  41   0.043  20.263  -0.624

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ASP  42           H        ASP  42  -0.493  20.714  -6.834
    2    HA   ASP  42           HA       ASP  42  -2.918  19.326  -6.970
    3    HB2  ASP  42           HB2      ASP  42  -2.239  21.904  -7.232
    4    HB3  ASP  42           HB3      ASP  42  -2.384  21.502  -8.940

  No H/Q in entry =           4
  In of MODEL    4
    1    H    GLN  43           H        GLN  43  -0.481  19.937  -9.470
    2    HA   GLN  43           HA       GLN  43  -1.851  18.597 -11.558
    3    HB2  GLN  43           HB2      GLN  43   1.101  19.146 -11.173
    4    HB3  GLN  43           HB3      GLN  43   0.396  18.494 -12.655
    5    HG2  GLN  43           HG2      GLN  43  -1.137  20.505 -12.704
    6    HG3  GLN  43           HG3      GLN  43  -0.193  21.175 -11.377
    7   HE21  GLN  43          HE21      GLN  43  -0.047  22.791 -13.467
    8   HE22  GLN  43          HE22      GLN  43   1.372  22.583 -14.372

  No H/Q in entry =           8
  In of MODEL    4
    1    H    SER  44           H        SER  44   0.509  17.489  -9.161
    2    HA   SER  44           HA       SER  44   0.874  14.883 -10.178
    3    HB2  SER  44           HB2      SER  44   1.750  16.338  -7.945
    4    HB3  SER  44           HB3      SER  44   0.902  14.947  -7.271
    5    HG   SER  44           HG       SER  44   3.020  14.349  -7.694

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ARG  45           H        ARG  45  -1.464  16.182  -7.847
    2    HA   ARG  45           HA       ARG  45  -2.825  13.808  -7.207
    3    HB2  ARG  45           HB2      ARG  45  -3.049  15.977  -6.022
    4    HB3  ARG  45           HB3      ARG  45  -3.910  16.631  -7.412
    5    HG2  ARG  45           HG2      ARG  45  -5.657  14.886  -7.126
    6    HG3  ARG  45           HG3      ARG  45  -4.808  14.287  -5.700
    7    HD2  ARG  45           HD2      ARG  45  -5.041  16.554  -4.650
    8    HD3  ARG  45           HD3      ARG  45  -6.032  17.059  -6.035
    9    HE   ARG  45           HE       ARG  45  -7.117  14.674  -4.990
   10   HH21  ARG  45          HH11      ARG  45  -8.955  14.732  -3.722
   11   HH22  ARG  45          HH12      ARG  45  -9.368  16.170  -2.858
   12   HH11  ARG  45          HH21      ARG  45  -6.609  17.929  -3.975
   13   HH12  ARG  45          HH22      ARG  45  -8.034  17.980  -2.999

  No H/Q in entry =          13
  In of MODEL    4
    1    H    MET  46           H        MET  46  -3.433  16.199  -9.765
    2    HA   MET  46           HA       MET  46  -5.757  14.997 -10.827
    3    HB2  MET  46           HB2      MET  46  -3.677  16.851 -11.994
    4    HB3  MET  46           HB3      MET  46  -5.038  16.267 -12.956
    5    HG2  MET  46           HG2      MET  46  -6.620  17.184 -11.339
    6    HG3  MET  46           HG3      MET  46  -5.301  17.687 -10.289
    7    HE2  MET  46           HE1      MET  46  -6.869  19.407 -14.147
    8    HE1  MET  46           HE2      MET  46  -7.001  17.770 -13.513
    9    HE3  MET  46           HE3      MET  46  -5.588  18.230 -14.462

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ALA  47           H        ALA  47  -2.322  14.555 -11.579
    2    HA   ALA  47           HA       ALA  47  -2.644  12.817 -13.785
    3    HB3  ALA  47           HB1      ALA  47  -0.477  13.733 -13.433
    4    HB2  ALA  47           HB2      ALA  47  -0.317  12.008 -13.094
    5    HB1  ALA  47           HB3      ALA  47  -0.425  13.162 -11.764

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU  48           H        LEU  48  -2.372  12.195 -10.309
    2    HA   LEU  48           HA       LEU  48  -2.433   9.353 -10.460
    3    HB2  LEU  48           HB2      LEU  48  -3.222  11.268  -8.252
    4    HB3  LEU  48           HB3      LEU  48  -3.108   9.520  -8.046
    5    HG   LEU  48           HG       LEU  48  -0.828  11.243  -9.045
    6   HD13  LEU  48          HD11      LEU  48  -1.123  12.016  -6.857
    7   HD12  LEU  48          HD12      LEU  48   0.056  10.723  -6.653
    8   HD11  LEU  48          HD13      LEU  48  -1.640  10.441  -6.257
    9   HD22  LEU  48          HD21      LEU  48  -0.303   9.062  -9.679
   10   HD21  LEU  48          HD22      LEU  48  -1.166   8.340  -8.322
   11   HD23  LEU  48          HD23      LEU  48   0.398   9.112  -8.062

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ASN  49           H        ASN  49  -4.926  11.818 -10.068
    2    HA   ASN  49           HA       ASN  49  -7.092  10.129  -9.527
    3    HB2  ASN  49           HB2      ASN  49  -7.197  12.541  -9.202
    4    HB3  ASN  49           HB3      ASN  49  -7.003  12.816 -10.929
    5   HD21  ASN  49          HD21      ASN  49  -9.216  11.233  -8.594
    6   HD22  ASN  49          HD22      ASN  49 -10.614  11.490  -9.516

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLU  50           H        GLU  50  -5.823  11.332 -12.616
    2    HA   GLU  50           HA       GLU  50  -7.760  10.049 -14.261
    3    HB2  GLU  50           HB2      GLU  50  -6.314  11.883 -15.078
    4    HB3  GLU  50           HB3      GLU  50  -4.908  10.828 -14.935
    5    HG2  GLU  50           HG2      GLU  50  -5.861   9.276 -16.569
    6    HG3  GLU  50           HG3      GLU  50  -7.333  10.237 -16.662

  No H/Q in entry =           6
  In of MODEL    4
    1    H    ALA  51           H        ALA  51  -4.579   9.098 -13.048
    2    HA   ALA  51           HA       ALA  51  -4.409   6.642 -14.459
    3    HB2  ALA  51           HB1      ALA  51  -2.426   6.381 -13.355
    4    HB1  ALA  51           HB2      ALA  51  -3.122   6.800 -11.790
    5    HB3  ALA  51           HB3      ALA  51  -2.679   8.073 -12.927

  No H/Q in entry =           5
  In of MODEL    4
    1    H    HIS  52           H        HIS  52  -5.596   7.470 -11.214
    2    HA   HIS  52           HA       HIS  52  -6.253   4.854 -10.376
    3    HB2  HIS  52           HB2      HIS  52  -6.138   6.836  -8.880
    4    HB3  HIS  52           HB3      HIS  52  -7.618   7.448  -9.620
    5    HD1  HIS  52           HD1      HIS  52  -9.794   5.916  -9.320
    6    HD2  HIS  52           HD2      HIS  52  -6.545   4.887  -6.921
    7    HE1  HIS  52           HE1      HIS  52 -10.697   4.398  -7.505
    8    HE2  HIS  52           HE2      HIS  52  -8.728   3.762  -6.032

  No H/Q in entry =           8
  In of MODEL    4
    1    H    LEU  53           H        LEU  53  -8.098   7.286 -12.174
    2    HA   LEU  53           HA       LEU  53 -10.589   5.965 -12.187
    3    HB2  LEU  53           HB2      LEU  53  -9.324   7.956 -14.059
    4    HB3  LEU  53           HB3      LEU  53 -10.914   7.271 -14.385
    5    HG   LEU  53           HG       LEU  53 -10.222   8.604 -11.746
    6   HD12  LEU  53          HD11      LEU  53 -11.614  10.518 -12.749
    7   HD11  LEU  53          HD12      LEU  53 -11.313   9.762 -14.314
    8   HD13  LEU  53          HD13      LEU  53  -9.966  10.347 -13.342
    9   HD21  LEU  53          HD21      LEU  53 -12.768   7.683 -13.091
   10   HD23  LEU  53          HD22      LEU  53 -12.804   8.956 -11.877
   11   HD22  LEU  53          HD23      LEU  53 -12.230   7.356 -11.450

  No H/Q in entry =          11
  In of MODEL    4
    1    H    VAL  54           H        VAL  54  -7.832   5.793 -14.419
    2    HA   VAL  54           HA       VAL  54  -9.032   4.003 -16.260
    3    HB   VAL  54           HB       VAL  54  -6.131   4.544 -15.574
    4   HG12  VAL  54          HG11      VAL  54  -5.868   3.455 -17.959
    5   HG11  VAL  54          HG12      VAL  54  -7.388   2.658 -17.556
    6   HG13  VAL  54          HG13      VAL  54  -5.972   2.423 -16.534
    7   HG22  VAL  54          HG21      VAL  54  -6.921   6.476 -16.625
    8   HG21  VAL  54          HG22      VAL  54  -8.102   5.597 -17.593
    9   HG23  VAL  54          HG23      VAL  54  -6.395   5.534 -18.020

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLN  55           H        GLN  55  -7.032   3.487 -13.355
    2    HA   GLN  55           HA       GLN  55  -6.911   0.671 -13.603
    3    HB2  GLN  55           HB2      GLN  55  -5.368   1.588 -12.084
    4    HB3  GLN  55           HB3      GLN  55  -6.597   2.543 -11.259
    5    HG2  GLN  55           HG2      GLN  55  -7.268   0.782  -9.938
    6    HG3  GLN  55           HG3      GLN  55  -7.028  -0.405 -11.212
    7   HE21  GLN  55          HE21      GLN  55  -5.390  -1.836 -10.711
    8   HE22  GLN  55          HE22      GLN  55  -4.011  -1.467  -9.797

  No H/Q in entry =           8
  In of MODEL    4
    1    H    THR  56           H        THR  56  -9.269   2.813 -11.999
    2    HA   THR  56           HA       THR  56 -10.835   0.916 -10.707
    3    HB   THR  56           HB       THR  56 -11.950   3.290 -12.222
    4    HG1  THR  56           HG1      THR  56 -10.156   3.185 -10.226
    5   HG21  THR  56          HG21      THR  56 -13.410   1.473 -11.042
    6   HG23  THR  56          HG22      THR  56 -13.760   3.177 -10.743
    7   HG22  THR  56          HG23      THR  56 -12.853   2.238  -9.554

  No H/Q in entry =           7
  In of MODEL    4
    1    H    LYS  57           H        LYS  57 -11.042   1.987 -14.097
    2    HA   LYS  57           HA       LYS  57 -13.178   0.275 -14.849
    3    HB2  LYS  57           HB2      LYS  57 -12.316   2.232 -16.169
    4    HB3  LYS  57           HB3      LYS  57 -10.871   1.302 -16.536
    5    HG2  LYS  57           HG2      LYS  57 -12.201  -0.377 -17.706
    6    HG3  LYS  57           HG3      LYS  57 -13.688   0.461 -17.276
    7    HD2  LYS  57           HD2      LYS  57 -12.933   2.443 -18.566
    8    HD3  LYS  57           HD3      LYS  57 -11.470   1.574 -19.030
    9    HE2  LYS  57           HE2      LYS  57 -14.289   0.617 -19.644
   10    HE3  LYS  57           HE3      LYS  57 -13.272   1.483 -20.795
   11    HZ3  LYS  57           HZ1      LYS  57 -12.180  -0.365 -21.262
   12    HZ2  LYS  57           HZ2      LYS  57 -13.313  -1.224 -20.331
   13    HZ1  LYS  57           HZ3      LYS  57 -11.864  -0.684 -19.627

  No H/Q in entry =          13
  In of MODEL    4
    1    H    LEU  58           H        LEU  58  -9.670  -0.119 -14.784
    2    HA   LEU  58           HA       LEU  58  -9.648  -2.639 -16.065
    3    HB2  LEU  58           HB2      LEU  58  -7.631  -1.320 -14.257
    4    HB3  LEU  58           HB3      LEU  58  -7.353  -2.842 -15.106
    5    HG   LEU  58           HG       LEU  58  -8.131  -0.250 -16.479
    6   HD11  LEU  58          HD11      LEU  58  -5.473  -1.456 -15.779
    7   HD13  LEU  58          HD12      LEU  58  -5.987   0.230 -15.736
    8   HD12  LEU  58          HD13      LEU  58  -5.636  -0.542 -17.279
    9   HD22  LEU  58          HD21      LEU  58  -8.687  -1.823 -18.066
   10   HD21  LEU  58          HD22      LEU  58  -7.634  -3.057 -17.379
   11   HD23  LEU  58          HD23      LEU  58  -6.955  -1.779 -18.386

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  59           H        ILE  59 -10.486  -1.736 -12.819
    2    HA   ILE  59           HA       ILE  59 -10.107  -4.496 -11.862
    3    HB   ILE  59           HB       ILE  59  -9.688  -2.223 -10.468
    4   HG12  ILE  59          HG12      ILE  59 -11.046  -4.574  -9.135
    5   HG13  ILE  59          HG13      ILE  59  -9.403  -4.653  -9.722
    6   HG21  ILE  59          HG21      ILE  59 -12.234  -1.739 -10.736
    7   HG23  ILE  59          HG22      ILE  59 -11.519  -1.530  -9.154
    8   HG22  ILE  59          HG23      ILE  59 -12.449  -2.979  -9.524
    9   HD12  ILE  59          HD11      ILE  59  -9.561  -4.036  -7.309
   10   HD11  ILE  59          HD12      ILE  59 -10.389  -2.561  -7.786
   11   HD13  ILE  59          HD13      ILE  59  -8.717  -2.832  -8.279

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLU  60           H        GLU  60 -12.688  -2.211 -12.683
    2    HA   GLU  60           HA       GLU  60 -14.858  -3.748 -11.670
    3    HB2  GLU  60           HB2      GLU  60 -15.098  -1.382 -12.271
    4    HB3  GLU  60           HB3      GLU  60 -14.765  -1.761 -13.958
    5    HG2  GLU  60           HG2      GLU  60 -16.783  -3.207 -14.018
    6    HG3  GLU  60           HG3      GLU  60 -17.131  -2.767 -12.359

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLY  61           H        GLY  61 -13.178  -3.725 -14.781
    2    HA3  GLY  61           HA2      GLY  61 -14.864  -5.991 -15.668
    3    HA2  GLY  61           HA3      GLY  61 -14.029  -4.880 -16.747

  No H/Q in entry =           3
  In of MODEL    4
    1    H    ASP  62           H        ASP  62 -12.647  -6.305 -13.855
    2    HA   ASP  62           HA       ASP  62 -10.345  -7.213 -15.270
    3    HB2  ASP  62           HB2      ASP  62  -9.753  -8.190 -13.029
    4    HB3  ASP  62           HB3      ASP  62 -10.124  -6.469 -12.994

  No H/Q in entry =           4
  In of MODEL    4
    1    H    ALA  63           H        ALA  63 -10.104  -9.070 -16.420
    2    HA   ALA  63           HA       ALA  63 -11.798 -11.413 -15.695
    3    HB1  ALA  63           HB1      ALA  63 -12.207 -10.202 -17.958
    4    HB2  ALA  63           HB2      ALA  63 -11.990 -11.951 -18.004
    5    HB3  ALA  63           HB3      ALA  63 -10.656 -10.885 -18.446

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLY  64           H        GLY  64  -8.883 -10.637 -17.573
    2    HA3  GLY  64           HA2      GLY  64  -6.764 -11.524 -17.568
    3    HA2  GLY  64           HA3      GLY  64  -7.113 -12.199 -15.981

  No H/Q in entry =           3
  In of MODEL    4
    1    H    GLU  65           H        GLU  65  -6.890 -14.350 -15.942
    2    HA   GLU  65           HA       GLU  65  -6.695 -15.924 -18.267
    3    HB2  GLU  65           HB2      GLU  65  -7.107 -16.703 -15.383
    4    HB3  GLU  65           HB3      GLU  65  -6.808 -17.864 -16.677
    5    HG2  GLU  65           HG2      GLU  65  -4.684 -16.782 -17.206
    6    HG3  GLU  65           HG3      GLU  65  -4.987 -15.541 -15.991

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLY  66           H        GLY  66  -9.350 -15.256 -16.147
    2    HA3  GLY  66           HA2      GLY  66 -11.285 -16.209 -18.063
    3    HA2  GLY  66           HA3      GLY  66 -11.246 -17.121 -16.566

  No H/Q in entry =           3
  In of MODEL    4
    1    H    LYS  67           H        LYS  67 -13.563 -16.194 -16.943
    2    HA   LYS  67           HA       LYS  67 -14.171 -13.525 -16.420
    3    HB2  LYS  67           HB2      LYS  67 -15.762 -16.055 -16.046
    4    HB3  LYS  67           HB3      LYS  67 -16.448 -14.439 -15.834
    5    HG2  LYS  67           HG2      LYS  67 -15.746 -13.829 -18.117
    6    HG3  LYS  67           HG3      LYS  67 -15.047 -15.431 -18.335
    7    HD2  LYS  67           HD2      LYS  67 -17.274 -16.450 -18.044
    8    HD3  LYS  67           HD3      LYS  67 -17.977 -14.846 -17.819
    9    HE2  LYS  67           HE2      LYS  67 -17.225 -14.189 -20.074
   10    HE3  LYS  67           HE3      LYS  67 -16.508 -15.785 -20.303
   11    HZ3  LYS  67           HZ1      LYS  67 -18.570 -15.971 -21.301
   12    HZ2  LYS  67           HZ2      LYS  67 -19.356 -15.048 -20.111
   13    HZ1  LYS  67           HZ3      LYS  67 -18.849 -16.631 -19.765

  No H/Q in entry =          13
  In of MODEL    4
    1    H    MET  68           H        MET  68 -13.976 -16.231 -14.198
    2    HA   MET  68           HA       MET  68 -14.785 -14.912 -11.843
    3    HB2  MET  68           HB2      MET  68 -13.063 -17.361 -12.232
    4    HB3  MET  68           HB3      MET  68 -13.774 -16.859 -10.698
    5    HG2  MET  68           HG2      MET  68 -15.333 -17.489 -13.222
    6    HG3  MET  68           HG3      MET  68 -15.171 -18.561 -11.829
    7    HE3  MET  68           HE1      MET  68 -17.043 -17.226  -9.053
    8    HE2  MET  68           HE2      MET  68 -15.531 -16.336  -9.214
    9    HE1  MET  68           HE3      MET  68 -15.588 -18.046  -9.637

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LYS  69           H        LYS  69 -11.499 -15.408 -13.178
    2    HA   LYS  69           HA       LYS  69 -10.327 -14.111 -10.862
    3    HB2  LYS  69           HB2      LYS  69  -9.125 -15.408 -13.305
    4    HB3  LYS  69           HB3      LYS  69  -8.153 -14.624 -12.057
    5    HG2  LYS  69           HG2      LYS  69  -9.144 -16.103 -10.347
    6    HG3  LYS  69           HG3      LYS  69 -10.126 -16.881 -11.586
    7    HD2  LYS  69           HD2      LYS  69  -8.082 -17.631 -12.745
    8    HD3  LYS  69           HD3      LYS  69  -7.094 -16.851 -11.509
    9    HE2  LYS  69           HE2      LYS  69  -8.110 -18.294  -9.783
   10    HE3  LYS  69           HE3      LYS  69  -9.096 -19.077 -11.017
   11    HZ1  LYS  69           HZ1      LYS  69  -6.238 -18.993 -11.529
   12    HZ3  LYS  69           HZ2      LYS  69  -7.357 -20.242 -11.800
   13    HZ2  LYS  69           HZ3      LYS  69  -6.725 -19.986 -10.244

  No H/Q in entry =          13
  In of MODEL    4
    1    H    VAL  70           H        VAL  70  -8.092 -12.836 -11.816
    2    HA   VAL  70           HA       VAL  70  -9.090 -10.584 -13.457
    3    HB   VAL  70           HB       VAL  70  -7.961  -9.031 -11.910
    4   HG11  VAL  70          HG11      VAL  70 -10.408  -9.901 -11.657
    5   HG13  VAL  70          HG12      VAL  70  -9.696  -8.998 -10.320
    6   HG12  VAL  70          HG13      VAL  70  -9.785 -10.757 -10.248
    7   HG22  VAL  70          HG21      VAL  70  -6.225 -10.347 -10.925
    8   HG21  VAL  70          HG22      VAL  70  -7.363 -11.598 -10.426
    9   HG23  VAL  70          HG23      VAL  70  -7.351 -10.039  -9.603

  No H/Q in entry =           9
  In of MODEL    4
    1    H    SER  71           H        SER  71  -7.360  -9.298 -14.389
    2    HA   SER  71           HA       SER  71  -5.297 -10.843 -15.579
    3    HB2  SER  71           HB2      SER  71  -6.235  -8.825 -16.647
    4    HB3  SER  71           HB3      SER  71  -5.571  -7.834 -15.350
    5    HG   SER  71           HG       SER  71  -3.490  -8.764 -15.972

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU  72           H        LEU  72  -3.140 -11.048 -15.068
    2    HA   LEU  72           HA       LEU  72  -2.428 -10.816 -12.356
    3    HB2  LEU  72           HB2      LEU  72  -0.764 -11.237 -14.834
    4    HB3  LEU  72           HB3      LEU  72  -0.105 -11.297 -13.203
    5    HG   LEU  72           HG       LEU  72  -2.433 -13.019 -14.115
    6   HD13  LEU  72          HD11      LEU  72  -0.791 -14.843 -14.304
    7   HD12  LEU  72          HD12      LEU  72   0.511 -13.721 -13.908
    8   HD11  LEU  72          HD13      LEU  72  -0.389 -13.533 -15.414
    9   HD21  LEU  72          HD21      LEU  72  -0.712 -12.857 -11.646
   10   HD23  LEU  72          HD22      LEU  72  -1.429 -14.397 -12.097
   11   HD22  LEU  72          HD23      LEU  72  -2.462 -13.010 -11.758

  No H/Q in entry =          11
  In of MODEL    4
    1    H    VAL  73           H        VAL  73  -1.726  -8.803 -15.142
    2    HA   VAL  73           HA       VAL  73   0.175  -7.081 -14.041
    3    HB   VAL  73           HB       VAL  73  -0.248  -5.659 -15.898
    4   HG11  VAL  73          HG11      VAL  73   0.645  -7.997 -16.330
    5   HG13  VAL  73          HG12      VAL  73  -0.108  -7.217 -17.720
    6   HG12  VAL  73          HG13      VAL  73  -0.988  -8.447 -16.816
    7   HG23  VAL  73          HG21      VAL  73  -2.376  -6.295 -17.318
    8   HG22  VAL  73          HG22      VAL  73  -2.539  -5.219 -15.931
    9   HG21  VAL  73          HG23      VAL  73  -2.971  -6.922 -15.781

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LEU  74           H        LEU  74  -3.223  -7.228 -13.490
    2    HA   LEU  74           HA       LEU  74  -3.869  -4.577 -12.889
    3    HB2  LEU  74           HB2      LEU  74  -5.584  -6.253 -13.059
    4    HB3  LEU  74           HB3      LEU  74  -4.884  -7.175 -11.733
    5    HG   LEU  74           HG       LEU  74  -5.350  -5.290 -10.189
    6   HD11  LEU  74          HD11      LEU  74  -6.426  -4.074 -12.736
    7   HD13  LEU  74          HD12      LEU  74  -5.297  -3.366 -11.581
    8   HD12  LEU  74          HD13      LEU  74  -6.999  -3.551 -11.150
    9   HD21  LEU  74          HD21      LEU  74  -7.011  -7.182 -10.969
   10   HD23  LEU  74          HD22      LEU  74  -7.878  -5.814 -11.633
   11   HD22  LEU  74          HD23      LEU  74  -7.560  -5.881  -9.917

  No H/Q in entry =          11
  In of MODEL    4
    1    H    VAL  75           H        VAL  75  -2.807  -7.145 -10.715
    2    HA   VAL  75           HA       VAL  75  -2.630  -5.583  -8.377
    3    HB   VAL  75           HB       VAL  75  -1.100  -8.063  -9.152
    4   HG12  VAL  75          HG11      VAL  75  -0.666  -8.204  -6.671
    5   HG11  VAL  75          HG12      VAL  75  -1.353  -6.596  -6.502
    6   HG13  VAL  75          HG13      VAL  75   0.125  -6.821  -7.420
    7   HG21  VAL  75          HG21      VAL  75  -3.667  -8.065  -8.914
    8   HG23  VAL  75          HG22      VAL  75  -3.396  -7.718  -7.206
    9   HG22  VAL  75          HG23      VAL  75  -2.786  -9.216  -7.909

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLU  76           H        GLU  76  -0.207  -6.329 -10.905
    2    HA   GLU  76           HA       GLU  76   1.962  -4.956  -9.747
    3    HB2  GLU  76           HB2      GLU  76   2.177  -6.438 -11.727
    4    HB3  GLU  76           HB3      GLU  76   1.267  -5.283 -12.688
    5    HG2  GLU  76           HG2      GLU  76   3.604  -4.939 -13.172
    6    HG3  GLU  76           HG3      GLU  76   3.078  -3.570 -12.211

  No H/Q in entry =           6
  In of MODEL    4
    1    H    ALA  77           H        ALA  77  -0.577  -3.788 -11.946
    2    HA   ALA  77           HA       ALA  77   0.388  -1.132 -12.129
    3    HB1  ALA  77           HB1      ALA  77  -1.368  -2.255 -13.599
    4    HB2  ALA  77           HB2      ALA  77  -1.721  -0.599 -13.105
    5    HB3  ALA  77           HB3      ALA  77  -2.518  -1.947 -12.296

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLN  78           H        GLN  78  -1.870  -2.703  -9.918
    2    HA   GLN  78           HA       GLN  78  -2.704  -0.387  -8.527
    3    HB2  GLN  78           HB2      GLN  78  -3.763  -2.692  -8.451
    4    HB3  GLN  78           HB3      GLN  78  -2.445  -3.180  -7.387
    5    HG2  GLN  78           HG2      GLN  78  -3.071  -1.460  -5.773
    6    HG3  GLN  78           HG3      GLN  78  -4.343  -0.881  -6.847
    7   HE21  GLN  78          HE21      GLN  78  -5.280  -3.504  -7.720
    8   HE22  GLN  78          HE22      GLN  78  -6.025  -4.237  -6.383

  No H/Q in entry =           8
  In of MODEL    4
    1    H    LEU  79           H        LEU  79  -0.004  -2.613  -8.062
    2    HA   LEU  79           HA       LEU  79   0.957  -1.697  -5.606
    3    HB2  LEU  79           HB2      LEU  79   1.851  -3.701  -6.664
    4    HB3  LEU  79           HB3      LEU  79   2.490  -2.747  -7.999
    5    HG   LEU  79           HG       LEU  79   4.030  -1.586  -6.496
    6   HD13  LEU  79          HD11      LEU  79   3.017  -1.344  -4.432
    7   HD12  LEU  79          HD12      LEU  79   4.109  -2.680  -4.081
    8   HD11  LEU  79          HD13      LEU  79   2.408  -2.999  -4.414
    9   HD23  LEU  79          HD21      LEU  79   5.261  -3.717  -5.582
   10   HD22  LEU  79          HD22      LEU  79   5.060  -3.527  -7.321
   11   HD21  LEU  79          HD23      LEU  79   3.991  -4.605  -6.428

  No H/Q in entry =          11
  In of MODEL    4
    1    H    HIS  80           H        HIS  80   1.823  -0.583  -8.880
    2    HA   HIS  80           HA       HIS  80   3.606   1.428  -7.961
    3    HB2  HIS  80           HB2      HIS  80   2.331   0.710 -10.545
    4    HB3  HIS  80           HB3      HIS  80   2.907   2.369 -10.378
    5    HD1  HIS  80           HD1      HIS  80   5.306   2.695 -10.895
    6    HD2  HIS  80           HD2      HIS  80   4.528  -1.221  -9.692
    7    HE1  HIS  80           HE1      HIS  80   7.511   1.442 -11.051
    8    HE2  HIS  80           HE2      HIS  80   7.048  -0.948 -10.321

  No H/Q in entry =           8
  In of MODEL    4
    1    H    LEU  81           H        LEU  81   0.203   1.545  -8.950
    2    HA   LEU  81           HA       LEU  81  -0.105   4.336  -8.630
    3    HB2  LEU  81           HB2      LEU  81  -2.094   2.067  -8.548
    4    HB3  LEU  81           HB3      LEU  81  -2.566   3.765  -8.464
    5    HG   LEU  81           HG       LEU  81  -0.854   2.627 -10.691
    6   HD12  LEU  81          HD11      LEU  81  -3.086   2.916 -11.997
    7   HD11  LEU  81          HD12      LEU  81  -3.845   2.844 -10.407
    8   HD13  LEU  81          HD13      LEU  81  -2.884   1.486 -10.987
    9   HD23  LEU  81          HD21      LEU  81  -1.973   4.755 -11.799
   10   HD22  LEU  81          HD22      LEU  81  -0.561   4.946 -10.762
   11   HD21  LEU  81          HD23      LEU  81  -2.172   5.277 -10.128

  No H/Q in entry =          11
  In of MODEL    4
    1    H    MET  82           H        MET  82  -0.738   1.649  -6.374
    2    HA   MET  82           HA       MET  82  -1.815   3.230  -4.295
    3    HB2  MET  82           HB2      MET  82  -0.409   0.560  -4.321
    4    HB3  MET  82           HB3      MET  82  -1.000   1.283  -2.827
    5    HG2  MET  82           HG2      MET  82  -2.720   0.760  -5.271
    6    HG3  MET  82           HG3      MET  82  -2.633  -0.308  -3.872
    7    HE3  MET  82           HE1      MET  82  -4.383   1.330  -1.068
    8    HE2  MET  82           HE2      MET  82  -2.656   1.628  -1.249
    9    HE1  MET  82           HE3      MET  82  -3.324   0.061  -1.699

  No H/Q in entry =           9
  In of MODEL    4
    1    H    THR  83           H        THR  83   1.500   2.182  -4.972
    2    HA   THR  83           HA       THR  83   2.698   3.309  -2.672
    3    HB   THR  83           HB       THR  83   4.797   3.275  -4.139
    4    HG1  THR  83           HG1      THR  83   4.570   2.738  -6.162
    5   HG22  THR  83          HG21      THR  83   4.387   0.610  -4.463
    6   HG21  THR  83          HG22      THR  83   3.090   0.978  -3.328
    7   HG23  THR  83          HG23      THR  83   4.763   1.343  -2.905

  No H/Q in entry =           7
  In of MODEL    4
    1    H    SER  84           H        SER  84   2.321   4.573  -5.977
    2    HA   SER  84           HA       SER  84   3.628   7.031  -5.527
    3    HB2  SER  84           HB2      SER  84   1.574   6.166  -7.549
    4    HB3  SER  84           HB3      SER  84   2.232   7.802  -7.528
    5    HG   SER  84           HG       SER  84   3.636   5.343  -7.806

  No H/Q in entry =           5
  In of MODEL    4
    1    H    MET  85           H        MET  85   0.144   6.232  -5.362
    2    HA   MET  85           HA       MET  85  -0.751   8.834  -4.772
    3    HB2  MET  85           HB2      MET  85  -2.247   6.998  -5.439
    4    HB3  MET  85           HB3      MET  85  -1.958   6.210  -3.889
    5    HG2  MET  85           HG2      MET  85  -2.892   8.146  -2.703
    6    HG3  MET  85           HG3      MET  85  -3.127   8.986  -4.235
    7    HE3  MET  85           HE1      MET  85  -3.988   4.973  -3.477
    8    HE2  MET  85           HE2      MET  85  -5.340   5.450  -2.451
    9    HE1  MET  85           HE3      MET  85  -3.724   6.058  -2.105

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LEU  86           H        LEU  86   0.194   6.190  -2.617
    2    HA   LEU  86           HA       LEU  86  -0.361   7.494  -0.181
    3    HB2  LEU  86           HB2      LEU  86   0.133   5.028  -0.565
    4    HB3  LEU  86           HB3      LEU  86   1.835   5.477  -0.657
    5    HG   LEU  86           HG       LEU  86   1.491   6.642   1.606
    6   HD11  LEU  86          HD11      LEU  86  -1.193   5.843   1.130
    7   HD13  LEU  86          HD12      LEU  86  -0.540   6.602   2.580
    8   HD12  LEU  86          HD13      LEU  86  -0.610   4.845   2.466
    9   HD23  LEU  86          HD21      LEU  86   1.096   3.645   1.737
   10   HD22  LEU  86          HD22      LEU  86   2.084   4.669   2.777
   11   HD21  LEU  86          HD23      LEU  86   2.593   4.345   1.120

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ALA  87           H        ALA  87   2.628   7.228  -2.061
    2    HA   ALA  87           HA       ALA  87   4.313   8.662  -0.336
    3    HB3  ALA  87           HB1      ALA  87   4.427   7.642  -3.040
    4    HB2  ALA  87           HB2      ALA  87   5.755   7.991  -1.937
    5    HB1  ALA  87           HB3      ALA  87   5.129   9.261  -2.987

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ARG  88           H        ARG  88   2.361   9.768  -3.066
    2    HA   ARG  88           HA       ARG  88   3.106  12.466  -2.955
    3    HB2  ARG  88           HB2      ARG  88   1.869  11.295  -4.812
    4    HB3  ARG  88           HB3      ARG  88   0.408  11.426  -3.833
    5    HG2  ARG  88           HG2      ARG  88   1.400  14.017  -3.755
    6    HG3  ARG  88           HG3      ARG  88   1.834  13.502  -5.383
    7    HD2  ARG  88           HD2      ARG  88  -0.306  13.558  -6.087
    8    HD3  ARG  88           HD3      ARG  88  -0.888  12.703  -4.657
    9    HE   ARG  88           HE       ARG  88  -1.105  15.477  -5.084
   10   HH21  ARG  88          HH11      ARG  88  -1.650  16.807  -3.352
   11   HH22  ARG  88          HH12      ARG  88  -1.353  16.278  -1.732
   12   HH11  ARG  88          HH21      ARG  88  -0.072  13.233  -2.700
   13   HH12  ARG  88          HH22      ARG  88  -0.477  14.248  -1.363

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLU  89           H        GLU  89   0.416  10.770  -1.317
    2    HA   GLU  89           HA       GLU  89  -0.718  13.074  -0.122
    3    HB2  GLU  89           HB2      GLU  89  -1.813  10.823  -0.204
    4    HB3  GLU  89           HB3      GLU  89  -0.687  10.283   1.041
    5    HG2  GLU  89           HG2      GLU  89  -1.527  11.978   2.593
    6    HG3  GLU  89           HG3      GLU  89  -2.583  12.635   1.345

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LEU  90           H        LEU  90   1.753  10.809   1.065
    2    HA   LEU  90           HA       LEU  90   2.091  12.065   3.592
    3    HB2  LEU  90           HB2      LEU  90   3.885  10.303   1.924
    4    HB3  LEU  90           HB3      LEU  90   4.295  10.828   3.562
    5    HG   LEU  90           HG       LEU  90   1.675   9.455   2.899
    6   HD12  LEU  90          HD11      LEU  90   2.832   7.423   3.916
    7   HD11  LEU  90          HD12      LEU  90   4.347   8.293   3.675
    8   HD13  LEU  90          HD13      LEU  90   3.342   7.872   2.287
    9   HD22  LEU  90          HD21      LEU  90   1.397  10.382   5.017
   10   HD21  LEU  90          HD22      LEU  90   3.114  10.292   5.404
   11   HD23  LEU  90          HD23      LEU  90   2.121   8.836   5.454

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  91           H        ILE  91   3.698  12.453   0.468
    2    HA   ILE  91           HA       ILE  91   5.656  14.305   1.307
    3    HB   ILE  91           HB       ILE  91   4.355  13.794  -1.375
    4   HG12  ILE  91          HG12      ILE  91   7.190  13.336  -0.393
    5   HG13  ILE  91          HG13      ILE  91   5.919  12.127  -0.230
    6   HG22  ILE  91          HG21      ILE  91   6.568  15.159  -2.062
    7   HG21  ILE  91          HG22      ILE  91   6.247  15.962  -0.524
    8   HG23  ILE  91          HG23      ILE  91   5.027  15.976  -1.796
    9   HD13  ILE  91          HD11      ILE  91   5.754  11.795  -2.536
   10   HD12  ILE  91          HD12      ILE  91   7.485  12.055  -2.320
   11   HD11  ILE  91          HD13      ILE  91   6.465  13.367  -2.912

  No H/Q in entry =          11
  In of MODEL    4
    1    H    THR  92           H        THR  92   2.293  14.704   0.290
    2    HA   THR  92           HA       THR  92   2.242  17.527   0.221
    3    HB   THR  92           HB       THR  92   0.090  15.515   0.921
    4    HG1  THR  92           HG1      THR  92   0.401  15.334  -1.163
    5   HG22  THR  92          HG21      THR  92  -1.328  17.663   0.189
    6   HG21  THR  92          HG22      THR  92   0.056  18.502   0.887
    7   HG23  THR  92          HG23      THR  92  -0.878  17.375   1.870

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLU  93           H        GLU  93   1.707  15.230   2.880
    2    HA   GLU  93           HA       GLU  93   1.154  17.134   4.892
    3    HB2  GLU  93           HB2      GLU  93   2.490  14.422   5.139
    4    HB3  GLU  93           HB3      GLU  93   1.788  15.347   6.467
    5    HG2  GLU  93           HG2      GLU  93   0.188  14.548   4.027
    6    HG3  GLU  93           HG3      GLU  93   0.296  13.530   5.458

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LEU  94           H        LEU  94   4.176  15.675   3.753
    2    HA   LEU  94           HA       LEU  94   5.912  16.843   5.642
    3    HB2  LEU  94           HB2      LEU  94   6.329  15.871   2.815
    4    HB3  LEU  94           HB3      LEU  94   7.650  16.543   3.766
    5    HG   LEU  94           HG       LEU  94   5.927  14.336   4.903
    6   HD11  LEU  94          HD11      LEU  94   8.029  14.121   2.777
    7   HD13  LEU  94          HD12      LEU  94   6.591  13.136   3.038
    8   HD12  LEU  94          HD13      LEU  94   8.016  12.898   4.049
    9   HD23  LEU  94          HD21      LEU  94   8.118  13.821   6.062
   10   HD22  LEU  94          HD22      LEU  94   7.437  15.395   6.472
   11   HD21  LEU  94          HD23      LEU  94   8.779  15.282   5.333

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  95           H        ILE  95   4.770  17.996   2.486
    2    HA   ILE  95           HA       ILE  95   6.322  20.367   2.424
    3    HB   ILE  95           HB       ILE  95   3.687  19.657   1.114
    4   HG12  ILE  95          HG12      ILE  95   6.476  20.014  -0.017
    5   HG13  ILE  95          HG13      ILE  95   5.839  18.457   0.500
    6   HG21  ILE  95          HG21      ILE  95   5.416  22.138   0.891
    7   HG23  ILE  95          HG22      ILE  95   3.691  22.056   1.243
    8   HG22  ILE  95          HG23      ILE  95   4.281  21.656  -0.370
    9   HD13  ILE  95          HD11      ILE  95   4.284  18.363  -1.232
   10   HD12  ILE  95          HD12      ILE  95   5.627  19.190  -2.019
   11   HD11  ILE  95          HD13      ILE  95   4.246  20.115  -1.433

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLU  96           H        GLU  96   3.076  19.691   3.713
    2    HA   GLU  96           HA       GLU  96   2.432  22.334   4.455
    3    HB2  GLU  96           HB2      GLU  96   0.772  20.537   4.468
    4    HB3  GLU  96           HB3      GLU  96   1.638  19.721   5.768
    5    HG2  GLU  96           HG2      GLU  96   0.603  21.000   7.331
    6    HG3  GLU  96           HG3      GLU  96   1.128  22.476   6.532

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LEU  97           H        LEU  97   4.292  19.804   6.092
    2    HA   LEU  97           HA       LEU  97   4.632  21.162   8.560
    3    HB2  LEU  97           HB2      LEU  97   6.191  19.002   7.156
    4    HB3  LEU  97           HB3      LEU  97   6.771  19.696   8.667
    5    HG   LEU  97           HG       LEU  97   3.972  18.578   8.353
    6   HD12  LEU  97          HD11      LEU  97   4.925  16.577   9.573
    7   HD11  LEU  97          HD12      LEU  97   6.532  17.221   9.232
    8   HD13  LEU  97          HD13      LEU  97   5.469  16.750   7.904
    9   HD23  LEU  97          HD21      LEU  97   4.421  18.295  10.919
   10   HD22  LEU  97          HD22      LEU  97   4.029  19.902  10.309
   11   HD21  LEU  97          HD23      LEU  97   5.703  19.477  10.659

  No H/Q in entry =          11
  In of MODEL    4
    1    H    HIS  98           H        HIS  98   6.510  21.185   5.539
    2    HA   HIS  98           HA       HIS  98   8.649  22.784   6.439
    3    HB2  HIS  98           HB2      HIS  98   7.364  22.511   3.710
    4    HB3  HIS  98           HB3      HIS  98   8.796  23.502   4.002
    5    HD1  HIS  98           HD1      HIS  98   7.613  19.922   4.029
    6    HD2  HIS  98           HD2      HIS  98  11.176  22.047   4.456
    7    HE1  HIS  98           HE1      HIS  98   9.481  18.207   3.981
    8    HE2  HIS  98           HE2      HIS  98  11.655  19.481   4.242

  No H/Q in entry =           8
  In of MODEL    4
    1    H    GLU  99           H        GLU  99   5.424  23.590   5.253
    2    HA   GLU  99           HA       GLU  99   5.781  26.408   5.188
    3    HB2  GLU  99           HB2      GLU  99   3.914  25.221   4.056
    4    HB3  GLU  99           HB3      GLU  99   3.217  24.859   5.635
    5    HG2  GLU  99           HG2      GLU  99   3.017  27.250   6.129
    6    HG3  GLU  99           HG3      GLU  99   3.794  27.652   4.600

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LYS 100           H        LYS 100   4.662  24.171   7.714
    2    HA   LYS 100           HA       LYS 100   4.055  26.226   9.600
    3    HB2  LYS 100           HB2      LYS 100   4.652  23.280   9.956
    4    HB3  LYS 100           HB3      LYS 100   4.193  24.353  11.284
    5    HG2  LYS 100           HG2      LYS 100   2.126  24.971  10.029
    6    HG3  LYS 100           HG3      LYS 100   2.565  23.802   8.781
    7    HD2  LYS 100           HD2      LYS 100   2.497  21.985  10.447
    8    HD3  LYS 100           HD3      LYS 100   2.075  23.149  11.707
    9    HE2  LYS 100           HE2      LYS 100   0.020  23.751  10.437
   10    HE3  LYS 100           HE3      LYS 100   0.432  22.531   9.225
   11    HZ1  LYS 100           HZ1      LYS 100   0.165  21.870  12.108
   12    HZ3  LYS 100           HZ2      LYS 100   0.160  20.812  10.776
   13    HZ2  LYS 100           HZ3      LYS 100  -1.164  21.842  11.049

  No H/Q in entry =          13
  In of MODEL    4
    1    H    LEU 101           H        LEU 101   6.994  24.450   8.779
    2    HA   LEU 101           HA       LEU 101   8.581  25.308  10.984
    3    HB2  LEU 101           HB2      LEU 101   9.189  24.318   8.210
    4    HB3  LEU 101           HB3      LEU 101  10.484  24.995   9.193
    5    HG   LEU 101           HG       LEU 101   8.666  22.829  10.258
    6   HD12  LEU 101          HD11      LEU 101  10.732  21.347   9.659
    7   HD11  LEU 101          HD12      LEU 101  11.092  22.610   8.483
    8   HD13  LEU 101          HD13      LEU 101   9.570  21.725   8.388
    9   HD21  LEU 101          HD21      LEU 101  11.380  23.959  10.989
   10   HD23  LEU 101          HD22      LEU 101  10.846  22.384  11.572
   11   HD22  LEU 101          HD23      LEU 101   9.943  23.835  12.004

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LYS 102           H        LYS 102   6.989  27.154   8.834
    2    HA   LYS 102           HA       LYS 102   7.051  29.446   8.536
    3    HB2  LYS 102           HB2      LYS 102   8.611  29.348  10.638
    4    HB3  LYS 102           HB3      LYS 102   9.912  29.549   9.482
    5    HG2  LYS 102           HG2      LYS 102   7.791  31.489  10.333
    6    HG3  LYS 102           HG3      LYS 102   9.502  31.761  10.085
    7    HD2  LYS 102           HD2      LYS 102   7.559  31.317   7.781
    8    HD3  LYS 102           HD3      LYS 102   7.930  32.901   8.446
    9    HE2  LYS 102           HE2      LYS 102   9.316  31.721   6.380
   10    HE3  LYS 102           HE3      LYS 102   9.921  33.035   7.389
   11    HZ2  LYS 102           HZ1      LYS 102  11.455  31.140   7.222
   12    HZ1  LYS 102           HZ2      LYS 102  10.298  30.152   7.965
   13    HZ3  LYS 102           HZ3      LYS 102  10.979  31.446   8.822

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ALA 103           H        ALA 103  10.319  28.129   7.983
    2    HA   ALA 103           HA       ALA 103  11.278  29.507   5.906
    3    HB2  ALA 103           HB1      ALA 103  12.181  27.296   4.986
    4    HB1  ALA 103           HB2      ALA 103  11.288  26.519   6.292
    5    HB3  ALA 103           HB3      ALA 103  12.569  27.673   6.665

  No H/Q in entry =           5
  In of MODEL    4
    1    H1   LYS   3           H1       LYS   3 -31.170   6.527 -19.463
    2    H2   LYS   3           H3       LYS   3 -30.191   6.254 -20.823
    3    H3   LYS   3           H2       LYS   3 -31.592   5.325 -20.585
    4    HA   LYS   3           HA       LYS   3 -30.595   3.903 -19.212
    5    HB2  LYS   3           HB2      LYS   3 -28.308   5.319 -20.531
    6    HB3  LYS   3           HB3      LYS   3 -27.988   4.087 -19.310
    7    HG2  LYS   3           HG2      LYS   3 -29.431   2.537 -20.681
    8    HG3  LYS   3           HG3      LYS   3 -29.381   3.759 -21.951
    9    HD2  LYS   3           HD2      LYS   3 -26.899   3.622 -21.915
   10    HD3  LYS   3           HD3      LYS   3 -27.024   2.305 -20.750
   11    HE2  LYS   3           HE2      LYS   3 -28.541   1.173 -22.480
   12    HE3  LYS   3           HE3      LYS   3 -27.916   2.366 -23.618
   13    HZ3  LYS   3           HZ1      LYS   3 -26.131   1.126 -23.918
   14    HZ2  LYS   3           HZ2      LYS   3 -26.765  -0.055 -22.876
   15    HZ1  LYS   3           HZ3      LYS   3 -25.762   1.170 -22.261

  No H/Q in entry =          15
  In of MODEL    4
    1    H    LYS   4           H        LYS   4 -30.639   3.726 -17.153
    2    HA   LYS   4           HA       LYS   4 -29.879   5.975 -15.467
    3    HB2  LYS   4           HB2      LYS   4 -31.102   3.283 -14.808
    4    HB3  LYS   4           HB3      LYS   4 -30.863   4.599 -13.660
    5    HG2  LYS   4           HG2      LYS   4 -32.683   4.597 -16.072
    6    HG3  LYS   4           HG3      LYS   4 -33.165   4.622 -14.377
    7    HD2  LYS   4           HD2      LYS   4 -32.446   6.832 -14.075
    8    HD3  LYS   4           HD3      LYS   4 -31.414   6.789 -15.505
    9    HE2  LYS   4           HE2      LYS   4 -33.328   8.190 -15.933
   10    HE3  LYS   4           HE3      LYS   4 -33.428   6.736 -16.926
   11    HZ3  LYS   4           HZ1      LYS   4 -35.004   5.812 -15.387
   12    HZ2  LYS   4           HZ2      LYS   4 -35.548   7.323 -15.943
   13    HZ1  LYS   4           HZ3      LYS   4 -34.885   7.178 -14.386

  No H/Q in entry =          13
  In of MODEL    4
    1    H    HIS   5           H        HIS   5 -28.401   6.017 -13.881
    2    HA   HIS   5           HA       HIS   5 -26.141   4.171 -14.256
    3    HB2  HIS   5           HB2      HIS   5 -26.359   6.906 -13.000
    4    HB3  HIS   5           HB3      HIS   5 -24.888   5.936 -13.009
    5    HD1  HIS   5           HD1      HIS   5 -23.413   7.147 -14.585
    6    HD2  HIS   5           HD2      HIS   5 -27.228   6.596 -16.129
    7    HE1  HIS   5           HE1      HIS   5 -23.251   7.769 -17.025
    8    HE2  HIS   5           HE2      HIS   5 -25.578   7.420 -17.936

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ILE   6           H        ILE   6 -25.922   2.573 -12.970
    2    HA   ILE   6           HA       ILE   6 -26.881   2.802 -10.196
    3    HB   ILE   6           HB       ILE   6 -26.093   0.354 -11.781
    4   HG12  ILE   6          HG12      ILE   6 -28.820   1.307 -10.898
    5   HG13  ILE   6          HG13      ILE   6 -28.184   1.490 -12.533
    6   HG23  ILE   6          HG21      ILE   6 -26.470  -0.926  -9.940
    7   HG22  ILE   6          HG22      ILE   6 -27.611   0.221  -9.235
    8   HG21  ILE   6          HG23      ILE   6 -25.878   0.535  -9.149
    9   HD13  ILE   6          HD11      ILE   6 -28.670  -0.614 -13.068
   10   HD12  ILE   6          HD12      ILE   6 -29.679  -0.611 -11.620
   11   HD11  ILE   6          HD13      ILE   6 -28.032  -1.239 -11.547

  No H/Q in entry =          11
  In of MODEL    4
    1    H    TYR   7           H        TYR   7 -25.108   3.400  -8.907
    2    HA   TYR   7           HA       TYR   7 -22.412   2.423  -9.618
    3    HB2  TYR   7           HB2      TYR   7 -23.338   4.842  -8.089
    4    HB3  TYR   7           HB3      TYR   7 -21.660   4.308  -8.145
    5    HD1  TYR   7           HD1      TYR   7 -22.727   3.432 -11.247
    6    HD2  TYR   7           HD2      TYR   7 -22.002   6.956  -8.962
    7    HE1  TYR   7           HE1      TYR   7 -22.292   4.693 -13.318
    8    HE2  TYR   7           HE2      TYR   7 -21.608   8.224 -11.025
    9    HH   TYR   7           HH       TYR   7 -21.839   8.179 -13.257

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LEU   8           H        LEU   8 -21.456   1.036  -8.318
    2    HA   LEU   8           HA       LEU   8 -22.578   0.509  -5.638
    3    HB2  LEU   8           HB2      LEU   8 -20.906  -1.143  -7.510
    4    HB3  LEU   8           HB3      LEU   8 -21.087  -1.553  -5.803
    5    HG   LEU   8           HG       LEU   8 -23.571  -1.687  -6.215
    6   HD13  LEU   8          HD11      LEU   8 -23.698  -0.433  -8.304
    7   HD12  LEU   8          HD12      LEU   8 -24.249  -2.086  -8.570
    8   HD11  LEU   8          HD13      LEU   8 -22.638  -1.599  -9.094
    9   HD23  LEU   8          HD21      LEU   8 -22.330  -3.713  -7.951
   10   HD22  LEU   8          HD22      LEU   8 -23.413  -3.892  -6.571
   11   HD21  LEU   8          HD23      LEU   8 -21.701  -3.565  -6.312

  No H/Q in entry =          11
  In of MODEL    4
    1    H    PHE   9           H        PHE   9 -21.294   0.883  -3.854
    2    HA   PHE   9           HA       PHE   9 -18.505   1.797  -4.379
    3    HB2  PHE   9           HB2      PHE   9 -20.511   2.848  -2.391
    4    HB3  PHE   9           HB3      PHE   9 -18.797   3.236  -2.341
    5    HD1  PHE   9           HD1      PHE   9 -17.753   4.574  -4.101
    6    HD2  PHE   9           HD2      PHE   9 -21.961   3.740  -4.146
    7    HE1  PHE   9           HE1      PHE   9 -18.080   6.321  -5.826
    8    HE2  PHE   9           HE2      PHE   9 -22.290   5.499  -5.866
    9    HZ   PHE   9           HZ       PHE   9 -20.347   6.785  -6.712

  No H/Q in entry =           9
  In of MODEL    4
    1    H    SER  10           H        SER  10 -16.916   0.779  -3.338
    2    HA   SER  10           HA       SER  10 -17.091  -0.146  -0.650
    3    HB2  SER  10           HB2      SER  10 -18.341  -1.993  -1.670
    4    HB3  SER  10           HB3      SER  10 -17.047  -2.230  -2.835
    5    HG   SER  10           HG       SER  10 -16.595  -3.643  -1.261

  No H/Q in entry =           5
  In of MODEL    4
    1    H    SER  11           H        SER  11 -15.067  -0.001   0.141
    2    HA   SER  11           HA       SER  11 -12.900   0.834  -1.413
    3    HB2  SER  11           HB2      SER  11 -11.668   0.837   0.554
    4    HB3  SER  11           HB3      SER  11 -13.328   0.978   1.139
    5    HG   SER  11           HG       SER  11 -11.552  -1.188   1.213

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA  12           H        ALA  12 -14.140  -1.882  -2.185
    2    HA   ALA  12           HA       ALA  12 -11.566  -3.116  -2.780
    3    HB2  ALA  12           HB1      ALA  12 -12.076  -5.277  -1.939
    4    HB1  ALA  12           HB2      ALA  12 -13.750  -4.835  -1.603
    5    HB3  ALA  12           HB3      ALA  12 -12.448  -4.155  -0.628

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLY  13           H        GLY  13 -12.349  -2.121  -4.787
    2    HA3  GLY  13           HA2      GLY  13 -14.609  -2.791  -6.239
    3    HA2  GLY  13           HA3      GLY  13 -13.060  -2.354  -6.974

  No H/Q in entry =           3
  In of MODEL    4
    1    H    MET  14           H        MET  14 -11.577  -4.653  -6.044
    2    HA   MET  14           HA       MET  14 -11.974  -6.402  -8.158
    3    HB2  MET  14           HB2      MET  14  -9.918  -6.490  -6.835
    4    HB3  MET  14           HB3      MET  14 -10.795  -7.165  -5.463
    5    HG2  MET  14           HG2      MET  14 -11.380  -9.147  -6.837
    6    HG3  MET  14           HG3      MET  14 -10.486  -8.463  -8.195
    7    HE1  MET  14           HE1      MET  14  -8.276  -7.936  -8.341
    8    HE3  MET  14           HE2      MET  14  -6.916  -8.619  -7.452
    9    HE2  MET  14           HE3      MET  14  -7.751  -7.204  -6.817

  No H/Q in entry =           9
  In of MODEL    4
    1    H    SER  15           H        SER  15 -13.247  -6.860  -4.862
    2    HA   SER  15           HA       SER  15 -14.610  -9.296  -5.626
    3    HB2  SER  15           HB2      SER  15 -13.972  -8.938  -3.256
    4    HB3  SER  15           HB3      SER  15 -15.098  -7.587  -3.172
    5    HG   SER  15           HG       SER  15 -15.642 -10.094  -2.717

  No H/Q in entry =           5
  In of MODEL    4
    1    H    THR  16           H        THR  16 -15.643  -5.902  -5.126
    2    HA   THR  16           HA       THR  16 -18.440  -6.360  -5.644
    3    HB   THR  16           HB       THR  16 -16.854  -3.813  -6.124
    4    HG1  THR  16           HG1      THR  16 -16.434  -4.513  -4.048
    5   HG23  THR  16          HG21      THR  16 -18.982  -2.726  -5.658
    6   HG22  THR  16          HG22      THR  16 -19.740  -4.290  -5.313
    7   HG21  THR  16          HG23      THR  16 -19.201  -3.898  -6.952

  No H/Q in entry =           7
  In of MODEL    4
    1    H    SER  17           H        SER  17 -15.620  -5.800  -7.511
    2    HA   SER  17           HA       SER  17 -16.750  -5.005  -9.995
    3    HB2  SER  17           HB2      SER  17 -14.134  -6.376  -9.335
    4    HB3  SER  17           HB3      SER  17 -14.577  -5.885 -10.970
    5    HG   SER  17           HG       SER  17 -13.548  -4.152 -10.270

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU  18           H        LEU  18 -16.211  -8.180  -8.603
    2    HA   LEU  18           HA       LEU  18 -16.823  -9.632 -10.981
    3    HB2  LEU  18           HB2      LEU  18 -15.607 -10.639  -9.099
    4    HB3  LEU  18           HB3      LEU  18 -17.032 -10.448  -8.077
    5    HG   LEU  18           HG       LEU  18 -18.283 -11.988  -9.493
    6   HD13  LEU  18          HD11      LEU  18 -17.459 -11.729 -11.664
    7   HD12  LEU  18          HD12      LEU  18 -16.785 -13.288 -11.190
    8   HD11  LEU  18          HD13      LEU  18 -15.780 -11.841 -11.142
    9   HD23  LEU  18          HD21      LEU  18 -16.949 -14.030  -9.033
   10   HD22  LEU  18          HD22      LEU  18 -17.140 -12.944  -7.655
   11   HD21  LEU  18          HD23      LEU  18 -15.617 -12.981  -8.544

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LEU  19           H        LEU  19 -18.768  -8.450  -8.242
    2    HA   LEU  19           HA       LEU  19 -21.248  -9.591  -9.084
    3    HB2  LEU  19           HB2      LEU  19 -20.955  -8.796  -6.819
    4    HB3  LEU  19           HB3      LEU  19 -20.665  -7.159  -7.402
    5    HG   LEU  19           HG       LEU  19 -23.041  -7.105  -8.192
    6   HD12  LEU  19          HD11      LEU  19 -23.259  -9.618  -6.526
    7   HD11  LEU  19          HD12      LEU  19 -23.386  -9.552  -8.283
    8   HD13  LEU  19          HD13      LEU  19 -24.592  -8.746  -7.281
    9   HD21  LEU  19          HD21      LEU  19 -22.481  -7.520  -5.263
   10   HD23  LEU  19          HD22      LEU  19 -23.944  -6.778  -5.915
   11   HD22  LEU  19          HD23      LEU  19 -22.376  -6.008  -6.163

  No H/Q in entry =          11
  In of MODEL    4
    1    H    VAL  20           H        VAL  20 -19.719  -6.436  -9.731
    2    HA   VAL  20           HA       VAL  20 -21.825  -5.343 -11.273
    3    HB   VAL  20           HB       VAL  20 -18.830  -4.783 -11.409
    4   HG11  VAL  20          HG11      VAL  20 -21.139  -3.410 -12.800
    5   HG13  VAL  20          HG12      VAL  20 -19.708  -4.125 -13.542
    6   HG12  VAL  20          HG13      VAL  20 -19.560  -2.656 -12.578
    7   HG21  VAL  20          HG21      VAL  20 -21.141  -3.451 -10.035
    8   HG23  VAL  20          HG22      VAL  20 -19.608  -2.631 -10.322
    9   HG22  VAL  20          HG23      VAL  20 -19.656  -4.085  -9.326

  No H/Q in entry =           9
  In of MODEL    4
    1    H    SER  21           H        SER  21 -19.095  -7.407 -12.346
    2    HA   SER  21           HA       SER  21 -19.888  -7.239 -15.092
    3    HB2  SER  21           HB2      SER  21 -18.476  -9.215 -15.465
    4    HB3  SER  21           HB3      SER  21 -17.630  -7.995 -14.516
    5    HG   SER  21           HG       SER  21 -17.667  -9.246 -12.820

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LYS  22           H        LYS  22 -20.969  -9.457 -12.553
    2    HA   LYS  22           HA       LYS  22 -22.533 -11.027 -14.396
    3    HB2  LYS  22           HB2      LYS  22 -22.832 -10.722 -11.405
    4    HB3  LYS  22           HB3      LYS  22 -23.621 -11.942 -12.404
    5    HG2  LYS  22           HG2      LYS  22 -20.638 -11.704 -12.044
    6    HG3  LYS  22           HG3      LYS  22 -21.675 -12.795 -11.125
    7    HD2  LYS  22           HD2      LYS  22 -22.342 -13.904 -13.220
    8    HD3  LYS  22           HD3      LYS  22 -21.266 -12.830 -14.118
    9    HE2  LYS  22           HE2      LYS  22 -19.332 -13.745 -12.944
   10    HE3  LYS  22           HE3      LYS  22 -20.383 -14.772 -11.969
   11    HZ3  LYS  22           HZ1      LYS  22 -20.871 -16.118 -13.772
   12    HZ2  LYS  22           HZ2      LYS  22 -19.209 -15.810 -13.944
   13    HZ1  LYS  22           HZ3      LYS  22 -20.331 -14.981 -14.911

  No H/Q in entry =          13
  In of MODEL    4
    1    H    MET  23           H        MET  23 -23.214  -8.129 -12.475
    2    HA   MET  23           HA       MET  23 -26.024  -8.165 -12.971
    3    HB2  MET  23           HB2      MET  23 -24.146  -5.890 -12.366
    4    HB3  MET  23           HB3      MET  23 -25.891  -5.696 -12.534
    5    HG2  MET  23           HG2      MET  23 -26.290  -7.029 -10.585
    6    HG3  MET  23           HG3      MET  23 -24.585  -7.464 -10.474
    7    HE2  MET  23           HE1      MET  23 -26.832  -3.805  -9.212
    8    HE1  MET  23           HE2      MET  23 -27.105  -4.744 -10.679
    9    HE3  MET  23           HE3      MET  23 -26.052  -3.330 -10.722

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ARG  24           H        ARG  24 -23.259  -6.740 -14.741
    2    HA   ARG  24           HA       ARG  24 -24.747  -5.386 -16.711
    3    HB2  ARG  24           HB2      ARG  24 -22.310  -5.006 -16.347
    4    HB3  ARG  24           HB3      ARG  24 -21.980  -6.608 -16.960
    5    HG2  ARG  24           HG2      ARG  24 -21.514  -5.255 -18.841
    6    HG3  ARG  24           HG3      ARG  24 -23.197  -5.759 -19.142
    7    HD2  ARG  24           HD2      ARG  24 -23.011  -3.325 -19.433
    8    HD3  ARG  24           HD3      ARG  24 -23.974  -3.698 -18.009
    9    HE   ARG  24           HE       ARG  24 -22.573  -2.626 -16.679
   10   HH21  ARG  24          HH11      ARG  24 -21.372  -0.729 -16.771
   11   HH22  ARG  24          HH12      ARG  24 -19.968  -0.652 -17.778
   12   HH11  ARG  24          HH21      ARG  24 -20.756  -3.746 -19.305
   13   HH12  ARG  24          HH22      ARG  24 -19.607  -2.446 -19.265

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ALA  25           H        ALA  25 -23.670  -8.744 -16.499
    2    HA   ALA  25           HA       ALA  25 -24.319  -9.519 -19.148
    3    HB1  ALA  25           HB1      ALA  25 -23.648 -11.572 -18.491
    4    HB3  ALA  25           HB2      ALA  25 -24.701 -11.562 -17.076
    5    HB2  ALA  25           HB3      ALA  25 -23.133 -10.758 -17.015

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLN  26           H        GLN  26 -26.135  -9.586 -16.118
    2    HA   GLN  26           HA       GLN  26 -28.499 -10.738 -17.147
    3    HB2  GLN  26           HB2      GLN  26 -27.953  -9.041 -14.731
    4    HB3  GLN  26           HB3      GLN  26 -29.528  -9.737 -15.088
    5    HG2  GLN  26           HG2      GLN  26 -26.961 -11.237 -14.656
    6    HG3  GLN  26           HG3      GLN  26 -28.315 -11.136 -13.539
    7   HE21  GLN  26          HE21      GLN  26 -27.133 -13.294 -14.859
    8   HE22  GLN  26          HE22      GLN  26 -28.193 -14.312 -15.671

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ALA  27           H        ALA  27 -27.515  -7.362 -16.698
    2    HA   ALA  27           HA       ALA  27 -29.992  -6.220 -17.452
    3    HB1  ALA  27           HB1      ALA  27 -28.160  -4.951 -16.320
    4    HB3  ALA  27           HB2      ALA  27 -28.744  -4.150 -17.779
    5    HB2  ALA  27           HB3      ALA  27 -27.221  -5.037 -17.811

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLU  28           H        GLU  28 -27.316  -7.446 -19.353
    2    HA   GLU  28           HA       GLU  28 -28.244  -6.346 -21.849
    3    HB2  GLU  28           HB2      GLU  28 -25.874  -7.075 -21.247
    4    HB3  GLU  28           HB3      GLU  28 -26.443  -8.726 -21.478
    5    HG2  GLU  28           HG2      GLU  28 -25.293  -7.929 -23.436
    6    HG3  GLU  28           HG3      GLU  28 -26.996  -8.222 -23.784

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LYS  29           H        LYS  29 -28.450  -9.480 -20.250
    2    HA   LYS  29           HA       LYS  29 -29.780 -10.894 -22.277
    3    HB2  LYS  29           HB2      LYS  29 -28.738 -11.930 -20.297
    4    HB3  LYS  29           HB3      LYS  29 -29.996 -11.223 -19.283
    5    HG2  LYS  29           HG2      LYS  29 -31.680 -12.551 -20.371
    6    HG3  LYS  29           HG3      LYS  29 -30.494 -13.182 -21.510
    7    HD2  LYS  29           HD2      LYS  29 -29.362 -14.398 -19.805
    8    HD3  LYS  29           HD3      LYS  29 -30.253 -13.568 -18.530
    9    HE2  LYS  29           HE2      LYS  29 -31.039 -15.899 -18.934
   10    HE3  LYS  29           HE3      LYS  29 -32.301 -14.683 -19.150
   11    HZ1  LYS  29           HZ1      LYS  29 -31.747 -14.780 -21.582
   12    HZ3  LYS  29           HZ2      LYS  29 -32.485 -16.168 -20.940
   13    HZ2  LYS  29           HZ3      LYS  29 -30.816 -16.157 -21.244

  No H/Q in entry =          13
  In of MODEL    4
    1    H    TYR  30           H        TYR  30 -31.133  -8.816 -19.728
    2    HA   TYR  30           HA       TYR  30 -33.807  -9.204 -20.968
    3    HB2  TYR  30           HB2      TYR  30 -33.128  -8.112 -18.227
    4    HB3  TYR  30           HB3      TYR  30 -34.751  -8.334 -18.880
    5    HD1  TYR  30           HD1      TYR  30 -35.695 -10.608 -19.133
    6    HD2  TYR  30           HD2      TYR  30 -31.844  -9.973 -17.431
    7    HE1  TYR  30           HE1      TYR  30 -35.635 -12.952 -18.381
    8    HE2  TYR  30           HE2      TYR  30 -31.785 -12.303 -16.683
    9    HH   TYR  30           HH       TYR  30 -33.462 -14.619 -17.814

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLU  31           H        GLU  31 -31.616  -7.229 -21.738
    2    HA   GLU  31           HA       GLU  31 -31.515  -5.057 -22.520
    3    HB2  GLU  31           HB2      GLU  31 -34.421  -5.723 -23.035
    4    HB3  GLU  31           HB3      GLU  31 -33.564  -4.352 -23.741
    5    HG2  GLU  31           HG2      GLU  31 -32.116  -5.787 -24.966
    6    HG3  GLU  31           HG3      GLU  31 -32.697  -7.210 -24.103

  No H/Q in entry =           6
  In of MODEL    4
    1    H    VAL  32           H        VAL  32 -31.702  -5.005 -19.785
    2    HA   VAL  32           HA       VAL  32 -33.533  -2.880 -19.079
    3    HB   VAL  32           HB       VAL  32 -31.149  -3.936 -17.526
    4   HG12  VAL  32          HG11      VAL  32 -32.667  -3.128 -15.610
    5   HG11  VAL  32          HG12      VAL  32 -33.492  -2.189 -16.853
    6   HG13  VAL  32          HG13      VAL  32 -31.781  -1.915 -16.534
    7   HG21  VAL  32          HG21      VAL  32 -32.942  -5.619 -18.241
    8   HG23  VAL  32          HG22      VAL  32 -33.967  -4.801 -17.061
    9   HG22  VAL  32          HG23      VAL  32 -32.458  -5.554 -16.546

  No H/Q in entry =           9
  In of MODEL    4
    1    HA   PRO  33           HA       PRO  33 -30.469   0.040 -20.707
    2    HB2  PRO  33           HB2      PRO  33 -31.952   2.279 -20.535
    3    HB3  PRO  33           HB3      PRO  33 -32.441   1.005 -21.652
    4    HG2  PRO  33           HG2      PRO  33 -33.392   1.478 -18.826
    5    HG3  PRO  33           HG3      PRO  33 -34.364   1.310 -20.288
    6    HD2  PRO  33           HD2      PRO  33 -33.929  -0.799 -18.664
    7    HD3  PRO  33           HD3      PRO  33 -34.000  -1.006 -20.414

  No H/Q in entry =           7
  In of MODEL    4
    1    H    VAL  34           H        VAL  34 -29.206  -0.558 -18.774
    2    HA   VAL  34           HA       VAL  34 -28.886   1.831 -17.081
    3    HB   VAL  34           HB       VAL  34 -28.315   0.325 -15.174
    4   HG12  VAL  34          HG11      VAL  34 -30.738  -0.524 -14.875
    5   HG11  VAL  34          HG12      VAL  34 -31.050   0.270 -16.417
    6   HG13  VAL  34          HG13      VAL  34 -30.480   1.213 -15.039
    7   HG21  VAL  34          HG21      VAL  34 -28.533  -1.660 -17.220
    8   HG23  VAL  34          HG22      VAL  34 -29.590  -2.034 -15.858
    9   HG22  VAL  34          HG23      VAL  34 -27.867  -1.773 -15.591

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ILE  35           H        ILE  35 -26.900   2.226 -16.240
    2    HA   ILE  35           HA       ILE  35 -24.617   0.893 -17.538
    3    HB   ILE  35           HB       ILE  35 -24.979   3.771 -16.669
    4   HG12  ILE  35          HG12      ILE  35 -24.022   2.502 -19.243
    5   HG13  ILE  35          HG13      ILE  35 -25.644   3.137 -18.965
    6   HG21  ILE  35          HG21      ILE  35 -22.437   2.214 -17.018
    7   HG23  ILE  35          HG22      ILE  35 -22.872   3.374 -15.765
    8   HG22  ILE  35          HG23      ILE  35 -22.490   3.936 -17.392
    9   HD11  ILE  35          HD11      ILE  35 -24.213   5.303 -18.326
   10   HD13  ILE  35          HD12      ILE  35 -24.761   4.959 -19.968
   11   HD12  ILE  35          HD13      ILE  35 -23.112   4.559 -19.485

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ILE  36           H        ILE  36 -23.393  -0.176 -15.964
    2    HA   ILE  36           HA       ILE  36 -23.816   0.388 -13.080
    3    HB   ILE  36           HB       ILE  36 -23.024  -2.303 -14.244
    4   HG12  ILE  36          HG12      ILE  36 -25.819  -1.478 -13.454
    5   HG13  ILE  36          HG13      ILE  36 -25.254  -1.432 -15.124
    6   HG23  ILE  36          HG21      ILE  36 -23.377  -3.168 -12.146
    7   HG22  ILE  36          HG22      ILE  36 -24.487  -1.880 -11.677
    8   HG21  ILE  36          HG23      ILE  36 -22.753  -1.568 -11.748
    9   HD13  ILE  36          HD11      ILE  36 -25.446  -3.639 -15.372
   10   HD12  ILE  36          HD12      ILE  36 -26.505  -3.533 -13.967
   11   HD11  ILE  36          HD13      ILE  36 -24.810  -3.977 -13.762

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLU  37           H        GLU  37 -22.023   0.975 -11.971
    2    HA   GLU  37           HA       GLU  37 -19.345   0.165 -12.913
    3    HB2  GLU  37           HB2      GLU  37 -20.210   2.950 -12.157
    4    HB3  GLU  37           HB3      GLU  37 -18.527   2.442 -12.301
    5    HG2  GLU  37           HG2      GLU  37 -18.827   2.036 -14.665
    6    HG3  GLU  37           HG3      GLU  37 -20.530   2.475 -14.539

  No H/Q in entry =           6
  In of MODEL    4
    1    H    ALA  38           H        ALA  38 -17.854  -0.123 -11.242
    2    HA   ALA  38           HA       ALA  38 -18.873   0.013  -8.464
    3    HB1  ALA  38           HB1      ALA  38 -17.187  -1.917  -9.935
    4    HB3  ALA  38           HB2      ALA  38 -18.234  -2.168  -8.537
    5    HB2  ALA  38           HB3      ALA  38 -16.613  -1.508  -8.317

  No H/Q in entry =           5
  In of MODEL    4
    1    H    PHE  39           H        PHE  39 -17.614   1.180  -6.973
    2    HA   PHE  39           HA       PHE  39 -15.079   2.372  -7.856
    3    HB2  PHE  39           HB2      PHE  39 -17.477   3.863  -6.810
    4    HB3  PHE  39           HB3      PHE  39 -15.843   4.513  -6.697
    5    HD1  PHE  39           HD1      PHE  39 -14.512   4.544  -8.952
    6    HD2  PHE  39           HD2      PHE  39 -18.761   4.398  -8.626
    7    HE1  PHE  39           HE1      PHE  39 -14.707   5.473 -11.241
    8    HE2  PHE  39           HE2      PHE  39 -18.973   5.318 -10.907
    9    HZ   PHE  39           HZ       PHE  39 -16.951   5.829 -12.235

  No H/Q in entry =           9
  In of MODEL    4
    1    HA   PRO  40           HA       PRO  40 -14.132   1.525  -3.588
    2    HB2  PRO  40           HB2      PRO  40 -12.343   3.512  -2.950
    3    HB3  PRO  40           HB3      PRO  40 -11.917   2.196  -4.044
    4    HG2  PRO  40           HG2      PRO  40 -12.913   4.955  -4.735
    5    HG3  PRO  40           HG3      PRO  40 -11.502   4.108  -5.365
    6    HD2  PRO  40           HD2      PRO  40 -13.730   4.072  -6.764
    7    HD3  PRO  40           HD3      PRO  40 -12.788   2.591  -6.604

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLU  41           H        GLU  41 -14.736   2.467  -1.437
    2    HA   GLU  41           HA       GLU  41 -16.964   4.190  -1.378
    3    HB2  GLU  41           HB2      GLU  41 -16.827   4.053   0.990
    4    HB3  GLU  41           HB3      GLU  41 -16.319   2.484   0.364
    5    HG2  GLU  41           HG2      GLU  41 -13.967   3.124   0.724
    6    HG3  GLU  41           HG3      GLU  41 -14.506   4.661   1.401

  No H/Q in entry =           6
  In of MODEL    4
    1    H    THR  42           H        THR  42 -13.625   5.078  -1.426
    2    HA   THR  42           HA       THR  42 -13.950   7.618  -0.162
    3    HB   THR  42           HB       THR  42 -11.790   8.193  -1.235
    4    HG1  THR  42           HG1      THR  42 -11.802   5.608  -2.365
    5   HG21  THR  42          HG21      THR  42 -11.848   6.814   0.836
    6   HG23  THR  42          HG22      THR  42 -10.451   6.451  -0.180
    7   HG22  THR  42          HG23      THR  42 -11.836   5.361  -0.164

  No H/Q in entry =           7
  In of MODEL    4
    1    H    LEU  43           H        LEU  43 -14.875   6.592  -3.280
    2    HA   LEU  43           HA       LEU  43 -15.108   9.385  -4.195
    3    HB2  LEU  43           HB2      LEU  43 -15.501   6.769  -5.638
    4    HB3  LEU  43           HB3      LEU  43 -15.698   8.365  -6.362
    5    HG   LEU  43           HG       LEU  43 -13.097   7.213  -5.385
    6   HD13  LEU  43          HD11      LEU  43 -12.568   6.708  -7.588
    7   HD12  LEU  43          HD12      LEU  43 -13.815   7.772  -8.237
    8   HD11  LEU  43          HD13      LEU  43 -14.265   6.239  -7.494
    9   HD23  LEU  43          HD21      LEU  43 -12.239   9.182  -6.782
   10   HD22  LEU  43          HD22      LEU  43 -12.958   9.560  -5.216
   11   HD21  LEU  43          HD23      LEU  43 -13.885   9.808  -6.695

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ALA  44           H        ALA  44 -17.063   7.541  -2.370
    2    HA   ALA  44           HA       ALA  44 -19.546   7.449  -3.684
    3    HB3  ALA  44           HB1      ALA  44 -19.410   6.291  -1.610
    4    HB2  ALA  44           HB2      ALA  44 -20.504   7.640  -1.308
    5    HB1  ALA  44           HB3      ALA  44 -18.830   7.723  -0.760

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLY  45           H        GLY  45 -18.096  10.207  -2.104
    2    HA3  GLY  45           HA2      GLY  45 -20.521  11.735  -2.426
    3    HA2  GLY  45           HA3      GLY  45 -18.968  12.334  -1.843

  No H/Q in entry =           3
  In of MODEL    4
    1    H    GLU  46           H        GLU  46 -17.455  11.428  -4.157
    2    HA   GLU  46           HA       GLU  46 -18.078  13.683  -5.881
    3    HB2  GLU  46           HB2      GLU  46 -15.753  13.120  -5.258
    4    HB3  GLU  46           HB3      GLU  46 -15.923  11.573  -6.088
    5    HG2  GLU  46           HG2      GLU  46 -16.229  12.738  -8.207
    6    HG3  GLU  46           HG3      GLU  46 -16.070  14.288  -7.383

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LYS  47           H        LYS  47 -17.993  10.172  -6.384
    2    HA   LYS  47           HA       LYS  47 -19.100  10.454  -9.051
    3    HB2  LYS  47           HB2      LYS  47 -18.548   8.022  -7.340
    4    HB3  LYS  47           HB3      LYS  47 -19.122   7.969  -9.007
    5    HG2  LYS  47           HG2      LYS  47 -16.563   9.325  -8.246
    6    HG3  LYS  47           HG3      LYS  47 -16.645   7.603  -8.614
    7    HD2  LYS  47           HD2      LYS  47 -17.646   8.138 -10.799
    8    HD3  LYS  47           HD3      LYS  47 -17.492   9.855 -10.431
    9    HE2  LYS  47           HE2      LYS  47 -15.068   9.607 -10.272
   10    HE3  LYS  47           HE3      LYS  47 -15.219   7.886 -10.630
   11    HZ3  LYS  47           HZ1      LYS  47 -15.039   8.463 -12.739
   12    HZ2  LYS  47           HZ2      LYS  47 -15.236  10.115 -12.400
   13    HZ1  LYS  47           HZ3      LYS  47 -16.599   9.125 -12.626

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLY  48           H        GLY  48 -20.416   9.647  -5.912
    2    HA3  GLY  48           HA2      GLY  48 -22.815   8.498  -6.665
    3    HA2  GLY  48           HA3      GLY  48 -22.575   9.462  -5.208

  No H/Q in entry =           3
  In of MODEL    4
    1    H    GLN  49           H        GLN  49 -21.977  11.909  -6.735
    2    HA   GLN  49           HA       GLN  49 -24.526  13.046  -6.848
    3    HB2  GLN  49           HB2      GLN  49 -21.981  13.914  -8.201
    4    HB3  GLN  49           HB3      GLN  49 -23.433  14.889  -8.093
    5    HG2  GLN  49           HG2      GLN  49 -23.264  14.866  -5.657
    6    HG3  GLN  49           HG3      GLN  49 -21.824  13.868  -5.764
    7   HE21  GLN  49          HE21      GLN  49 -21.682  16.071  -4.450
    8   HE22  GLN  49          HE22      GLN  49 -20.750  17.330  -5.077

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ASN  50           H        ASN  50 -22.874  11.198  -9.277
    2    HA   ASN  50           HA       ASN  50 -24.757  12.127 -11.334
    3    HB2  ASN  50           HB2      ASN  50 -22.192  10.568 -11.609
    4    HB3  ASN  50           HB3      ASN  50 -23.244  11.028 -12.939
    5   HD21  ASN  50          HD21      ASN  50 -20.594  11.819 -11.323
    6   HD22  ASN  50          HD22      ASN  50 -20.346  13.460 -11.635

  No H/Q in entry =           6
  In of MODEL    4
    1    H    ALA  51           H        ALA  51 -24.756   9.728  -9.134
    2    HA   ALA  51           HA       ALA  51 -25.568   7.625 -10.998
    3    HB2  ALA  51           HB1      ALA  51 -24.990   6.239  -9.340
    4    HB3  ALA  51           HB2      ALA  51 -26.101   7.036  -8.227
    5    HB1  ALA  51           HB3      ALA  51 -24.457   7.645  -8.420

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ASP  52           H        ASP  52 -27.582   6.586 -10.870
    2    HA   ASP  52           HA       ASP  52 -29.742   8.427 -10.160
    3    HB2  ASP  52           HB2      ASP  52 -29.583   5.953 -11.879
    4    HB3  ASP  52           HB3      ASP  52 -31.119   6.693 -11.424

  No H/Q in entry =           4
  In of MODEL    4
    1    H    VAL  53           H        VAL  53 -28.167   5.504  -9.206
    2    HA   VAL  53           HA       VAL  53 -29.595   5.598  -6.683
    3    HB   VAL  53           HB       VAL  53 -31.016   3.994  -7.951
    4   HG11  VAL  53          HG11      VAL  53 -29.284   3.146  -9.497
    5   HG13  VAL  53          HG12      VAL  53 -30.127   1.843  -8.659
    6   HG12  VAL  53          HG13      VAL  53 -28.510   2.320  -8.146
    7   HG23  VAL  53          HG21      VAL  53 -30.207   1.977  -6.301
    8   HG22  VAL  53          HG22      VAL  53 -31.321   3.285  -5.904
    9   HG21  VAL  53          HG23      VAL  53 -29.612   3.432  -5.502

  No H/Q in entry =           9
  In of MODEL    4
    1    H    VAL  54           H        VAL  54 -28.281   5.120  -5.041
    2    HA   VAL  54           HA       VAL  54 -25.532   4.253  -5.680
    3    HB   VAL  54           HB       VAL  54 -26.574   5.999  -3.393
    4   HG11  VAL  54          HG11      VAL  54 -24.012   4.558  -3.722
    5   HG13  VAL  54          HG12      VAL  54 -24.752   5.219  -2.264
    6   HG12  VAL  54          HG13      VAL  54 -23.840   6.272  -3.344
    7   HG22  VAL  54          HG21      VAL  54 -25.700   7.825  -4.462
    8   HG21  VAL  54          HG22      VAL  54 -26.264   6.866  -5.829
    9   HG23  VAL  54          HG23      VAL  54 -24.554   6.865  -5.399

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LEU  55           H        LEU  55 -24.959   2.313  -5.077
    2    HA   LEU  55           HA       LEU  55 -26.471   0.978  -2.921
    3    HB2  LEU  55           HB2      LEU  55 -24.937  -0.163  -5.244
    4    HB3  LEU  55           HB3      LEU  55 -25.702  -1.114  -3.970
    5    HG   LEU  55           HG       LEU  55 -27.130   0.530  -6.051
    6   HD13  LEU  55          HD11      LEU  55 -26.856  -1.302  -7.307
    7   HD12  LEU  55          HD12      LEU  55 -27.817  -2.190  -6.125
    8   HD11  LEU  55          HD13      LEU  55 -26.060  -2.147  -5.980
    9   HD23  LEU  55          HD21      LEU  55 -28.438  -1.437  -4.228
   10   HD22  LEU  55          HD22      LEU  55 -29.122  -0.032  -5.046
   11   HD21  LEU  55          HD23      LEU  55 -28.094   0.186  -3.630

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LEU  56           H        LEU  56 -25.319   0.337  -1.131
    2    HA   LEU  56           HA       LEU  56 -22.381   0.701  -1.187
    3    HB2  LEU  56           HB2      LEU  56 -24.176   0.464   1.215
    4    HB3  LEU  56           HB3      LEU  56 -22.462   0.874   1.205
    5    HG   LEU  56           HG       LEU  56 -24.746   2.596   0.283
    6   HD11  LEU  56          HD11      LEU  56 -23.625   2.154   2.791
    7   HD13  LEU  56          HD12      LEU  56 -24.602   3.543   2.315
    8   HD12  LEU  56          HD13      LEU  56 -22.845   3.631   2.222
    9   HD23  LEU  56          HD21      LEU  56 -22.783   4.277   0.114
   10   HD22  LEU  56          HD22      LEU  56 -23.183   3.209  -1.233
   11   HD21  LEU  56          HD23      LEU  56 -21.829   2.821  -0.172

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLY  57           H        GLY  57 -21.017  -0.955  -0.690
    2    HA3  GLY  57           HA2      GLY  57 -21.968  -3.626  -0.936
    3    HA2  GLY  57           HA3      GLY  57 -20.340  -3.158  -0.450

  No H/Q in entry =           3
  In of MODEL    4
    1    HA   PRO  58           HA       PRO  58 -23.146  -4.236   3.249
    2    HB2  PRO  58           HB2      PRO  58 -22.489  -6.860   3.804
    3    HB3  PRO  58           HB3      PRO  58 -23.872  -6.417   2.804
    4    HG2  PRO  58           HG2      PRO  58 -21.158  -7.314   1.989
    5    HG3  PRO  58           HG3      PRO  58 -22.730  -7.743   1.317
    6    HD2  PRO  58           HD2      PRO  58 -21.106  -5.921   0.122
    7    HD3  PRO  58           HD3      PRO  58 -22.864  -5.812   0.029

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLN  59           H        GLN  59 -19.783  -4.736   2.620
    2    HA   GLN  59           HA       GLN  59 -19.018  -4.815   5.376
    3    HB2  GLN  59           HB2      GLN  59 -17.404  -3.888   2.995
    4    HB3  GLN  59           HB3      GLN  59 -16.771  -4.244   4.589
    5    HG2  GLN  59           HG2      GLN  59 -18.097  -6.234   2.754
    6    HG3  GLN  59           HG3      GLN  59 -16.364  -6.043   2.960
    7   HE21  GLN  59          HE21      GLN  59 -18.582  -7.853   3.693
    8   HE22  GLN  59          HE22      GLN  59 -18.380  -8.673   5.127

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ILE  60           H        ILE  60 -19.930  -2.212   3.221
    2    HA   ILE  60           HA       ILE  60 -19.047  -0.304   5.299
    3    HB   ILE  60           HB       ILE  60 -19.258   1.464   3.512
    4   HG12  ILE  60          HG12      ILE  60 -19.107  -0.702   1.463
    5   HG13  ILE  60          HG13      ILE  60 -20.687  -0.191   2.057
    6   HG21  ILE  60          HG21      ILE  60 -17.156   0.102   4.196
    7   HG23  ILE  60          HG22      ILE  60 -17.110   1.202   2.819
    8   HG22  ILE  60          HG23      ILE  60 -17.286  -0.533   2.555
    9   HD11  ILE  60          HD11      ILE  60 -19.866   2.208   1.478
   10   HD13  ILE  60          HD12      ILE  60 -20.379   1.146   0.166
   11   HD12  ILE  60          HD13      ILE  60 -18.661   1.381   0.490

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ALA  61           H        ALA  61 -21.520  -1.861   5.349
    2    HA   ALA  61           HA       ALA  61 -23.729  -0.163   4.931
    3    HB1  ALA  61           HB1      ALA  61 -24.957  -1.664   6.233
    4    HB2  ALA  61           HB2      ALA  61 -23.559  -2.088   7.222
    5    HB3  ALA  61           HB3      ALA  61 -23.668  -2.662   5.559

  No H/Q in entry =           5
  In of MODEL    4
    1    H    TYR  62           H        TYR  62 -21.511  -0.353   7.717
    2    HA   TYR  62           HA       TYR  62 -23.040   1.290   9.425
    3    HB2  TYR  62           HB2      TYR  62 -20.993   1.664  10.660
    4    HB3  TYR  62           HB3      TYR  62 -21.068  -0.024  10.159
    5    HD1  TYR  62           HD1      TYR  62 -19.508  -0.901   8.463
    6    HD2  TYR  62           HD2      TYR  62 -19.264   3.160   9.772
    7    HE1  TYR  62           HE1      TYR  62 -17.297  -0.693   7.391
    8    HE2  TYR  62           HE2      TYR  62 -17.039   3.361   8.702
    9    HH   TYR  62           HH       TYR  62 -15.938   1.277   6.447

  No H/Q in entry =           9
  In of MODEL    4
    1    H    MET  63           H        MET  63 -21.399   2.183   6.578
    2    HA   MET  63           HA       MET  63 -21.195   4.999   7.325
    3    HB2  MET  63           HB2      MET  63 -20.615   3.515   4.761
    4    HB3  MET  63           HB3      MET  63 -20.406   5.255   4.969
    5    HG2  MET  63           HG2      MET  63 -18.690   4.867   6.634
    6    HG3  MET  63           HG3      MET  63 -18.918   3.126   6.482
    7    HE1  MET  63           HE1      MET  63 -18.385   6.305   4.860
    8    HE3  MET  63           HE2      MET  63 -18.366   5.859   3.154
    9    HE2  MET  63           HE3      MET  63 -16.847   6.098   4.020

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LEU  64           H        LEU  64 -23.786   3.195   6.336
    2    HA   LEU  64           HA       LEU  64 -24.986   4.667   4.291
    3    HB2  LEU  64           HB2      LEU  64 -25.878   2.555   5.173
    4    HB3  LEU  64           HB3      LEU  64 -26.318   3.375   6.671
    5    HG   LEU  64           HG       LEU  64 -28.002   4.674   5.474
    6   HD13  LEU  64          HD11      LEU  64 -27.726   4.953   3.245
    7   HD12  LEU  64          HD12      LEU  64 -28.393   3.330   3.071
    8   HD11  LEU  64          HD13      LEU  64 -26.646   3.565   3.126
    9   HD23  LEU  64          HD21      LEU  64 -28.559   1.882   4.675
   10   HD22  LEU  64          HD22      LEU  64 -29.528   3.012   5.621
   11   HD21  LEU  64          HD23      LEU  64 -28.161   2.187   6.367

  No H/Q in entry =          11
  In of MODEL    4
    1    HA   PRO  65           HA       PRO  65 -27.114   7.797   7.111
    2    HB2  PRO  65           HB2      PRO  65 -25.102   7.886   9.358
    3    HB3  PRO  65           HB3      PRO  65 -26.837   8.189   9.418
    4    HG2  PRO  65           HG2      PRO  65 -25.933   5.906  10.297
    5    HG3  PRO  65           HG3      PRO  65 -27.357   5.911   9.258
    6    HD2  PRO  65           HD2      PRO  65 -24.497   5.272   8.530
    7    HD3  PRO  65           HD3      PRO  65 -25.968   4.414   8.073

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLU  66           H        GLU  66 -23.559   7.693   7.166
    2    HA   GLU  66           HA       GLU  66 -23.226  10.493   6.813
    3    HB2  GLU  66           HB2      GLU  66 -21.447   8.174   6.109
    4    HB3  GLU  66           HB3      GLU  66 -20.975   9.865   5.932
    5    HG2  GLU  66           HG2      GLU  66 -21.171  10.193   8.307
    6    HG3  GLU  66           HG3      GLU  66 -21.718   8.529   8.509

  No H/Q in entry =           6
  In of MODEL    4
    1    H    ILE  67           H        ILE  67 -23.376   7.793   4.510
    2    HA   ILE  67           HA       ILE  67 -22.946   9.538   2.247
    3    HB   ILE  67           HB       ILE  67 -23.885   6.641   2.376
    4   HG12  ILE  67          HG12      ILE  67 -21.242   7.791   1.463
    5   HG13  ILE  67          HG13      ILE  67 -21.536   7.344   3.144
    6   HG21  ILE  67          HG21      ILE  67 -23.810   8.560   0.187
    7   HG23  ILE  67          HG22      ILE  67 -24.458   6.921   0.210
    8   HG22  ILE  67          HG23      ILE  67 -22.748   7.187  -0.121
    9   HD12  ILE  67          HD11      ILE  67 -21.152   5.611   0.759
   10   HD11  ILE  67          HD12      ILE  67 -22.167   5.028   2.076
   11   HD13  ILE  67          HD13      ILE  67 -20.487   5.463   2.386

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLN  68           H        GLN  68 -25.823   8.495   3.874
    2    HA   GLN  68           HA       GLN  68 -27.647   9.490   1.927
    3    HB2  GLN  68           HB2      GLN  68 -27.895   9.079   4.904
    4    HB3  GLN  68           HB3      GLN  68 -29.210   9.712   3.929
    5    HG2  GLN  68           HG2      GLN  68 -29.275   7.707   2.615
    6    HG3  GLN  68           HG3      GLN  68 -27.830   7.095   3.399
    7   HE21  GLN  68          HE21      GLN  68 -30.030   5.773   3.249
    8   HE22  GLN  68          HE22      GLN  68 -30.860   5.303   4.659

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ARG  69           H        ARG  69 -26.003  11.079   4.688
    2    HA   ARG  69           HA       ARG  69 -27.330  13.590   4.335
    3    HB2  ARG  69           HB2      ARG  69 -24.993  12.593   5.895
    4    HB3  ARG  69           HB3      ARG  69 -25.046  14.321   5.569
    5    HG2  ARG  69           HG2      ARG  69 -27.358  14.382   6.553
    6    HG3  ARG  69           HG3      ARG  69 -27.175  12.680   6.993
    7    HD2  ARG  69           HD2      ARG  69 -25.440  14.990   7.943
    8    HD3  ARG  69           HD3      ARG  69 -26.579  14.083   8.927
    9    HE   ARG  69           HE       ARG  69 -23.986  13.128   7.946
   10   HH21  ARG  69          HH11      ARG  69 -23.201  11.329   9.103
   11   HH22  ARG  69          HH12      ARG  69 -24.237  10.508  10.222
   12   HH11  ARG  69          HH21      ARG  69 -26.943  12.596   9.648
   13   HH12  ARG  69          HH22      ARG  69 -26.356  11.224  10.527

  No H/Q in entry =          13
  In of MODEL    4
    1    H    LEU  70           H        LEU  70 -24.490  12.163   2.934
    2    HA   LEU  70           HA       LEU  70 -23.343  14.531   1.806
    3    HB2  LEU  70           HB2      LEU  70 -22.384  12.187   2.351
    4    HB3  LEU  70           HB3      LEU  70 -23.015  11.761   0.760
    5    HG   LEU  70           HG       LEU  70 -21.404  13.128  -0.307
    6   HD11  LEU  70          HD11      LEU  70 -20.554  13.904   2.492
    7   HD13  LEU  70          HD12      LEU  70 -21.238  14.974   1.268
    8   HD12  LEU  70          HD13      LEU  70 -19.639  14.270   1.027
    9   HD22  LEU  70          HD21      LEU  70 -19.999  11.384  -0.114
   10   HD21  LEU  70          HD22      LEU  70 -20.927  10.850   1.288
   11   HD23  LEU  70          HD23      LEU  70 -19.523  11.895   1.505

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LEU  71           H        LEU  71 -25.545  12.048   0.653
    2    HA   LEU  71           HA       LEU  71 -26.056  13.592  -1.831
    3    HB2  LEU  71           HB2      LEU  71 -26.312  10.603  -1.441
    4    HB3  LEU  71           HB3      LEU  71 -26.433  11.495  -2.957
    5    HG   LEU  71           HG       LEU  71 -23.905  11.431  -1.310
    6   HD12  LEU  71          HD11      LEU  71 -23.999   9.851  -3.772
    7   HD11  LEU  71          HD12      LEU  71 -25.014   9.222  -2.475
    8   HD13  LEU  71          HD13      LEU  71 -23.288   9.465  -2.204
    9   HD22  LEU  71          HD21      LEU  71 -23.983  13.277  -2.767
   10   HD21  LEU  71          HD22      LEU  71 -24.505  12.269  -4.117
   11   HD23  LEU  71          HD23      LEU  71 -22.883  12.081  -3.450

  No H/Q in entry =          11
  In of MODEL    4
    1    HA   PRO  72           HA       PRO  72 -29.917  13.163   0.801
    2    HB2  PRO  72           HB2      PRO  72 -30.726  15.741   0.773
    3    HB3  PRO  72           HB3      PRO  72 -29.420  15.243   1.849
    4    HG2  PRO  72           HG2      PRO  72 -29.226  16.487  -0.883
    5    HG3  PRO  72           HG3      PRO  72 -28.442  16.996   0.613
    6    HD2  PRO  72           HD2      PRO  72 -27.143  15.446  -1.189
    7    HD3  PRO  72           HD3      PRO  72 -26.882  15.241   0.542

  No H/Q in entry =           7
  In of MODEL    4
    1    H    ASN  73           H        ASN  73 -29.291  14.168  -2.398
    2    HA   ASN  73           HA       ASN  73 -32.160  13.926  -3.019
    3    HB2  ASN  73           HB2      ASN  73 -31.684  15.064  -5.099
    4    HB3  ASN  73           HB3      ASN  73 -31.135  16.007  -3.721
    5   HD21  ASN  73          HD21      ASN  73 -30.352  16.088  -6.402
    6   HD22  ASN  73          HD22      ASN  73 -28.689  15.898  -6.606

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LYS  74           H        LYS  74 -30.223  11.625  -2.648
    2    HA   LYS  74           HA       LYS  74 -30.831  10.290  -5.220
    3    HB2  LYS  74           HB2      LYS  74 -28.296   9.917  -3.619
    4    HB3  LYS  74           HB3      LYS  74 -28.704   9.141  -5.149
    5    HG2  LYS  74           HG2      LYS  74 -28.378  12.101  -4.892
    6    HG3  LYS  74           HG3      LYS  74 -27.027  11.017  -5.224
    7    HD2  LYS  74           HD2      LYS  74 -28.173  10.148  -7.178
    8    HD3  LYS  74           HD3      LYS  74 -29.570  11.168  -6.832
    9    HE2  LYS  74           HE2      LYS  74 -28.306  13.157  -7.243
   10    HE3  LYS  74           HE3      LYS  74 -26.804  12.238  -7.359
   11    HZ2  LYS  74           HZ1      LYS  74 -28.273  12.912  -9.465
   12    HZ1  LYS  74           HZ2      LYS  74 -28.957  11.396  -9.118
   13    HZ3  LYS  74           HZ3      LYS  74 -27.291  11.527  -9.420

  No H/Q in entry =          13
  In of MODEL    4
    1    HA   PRO  75           HA       PRO  75 -32.272   7.279  -2.298
    2    HB2  PRO  75           HB2      PRO  75 -32.636   5.098  -3.921
    3    HB3  PRO  75           HB3      PRO  75 -33.734   6.477  -3.958
    4    HG2  PRO  75           HG2      PRO  75 -31.419   5.864  -5.753
    5    HG3  PRO  75           HG3      PRO  75 -33.059   6.345  -6.182
    6    HD2  PRO  75           HD2      PRO  75 -31.079   8.168  -6.115
    7    HD3  PRO  75           HD3      PRO  75 -32.699   8.591  -5.560

  No H/Q in entry =           7
  In of MODEL    4
    1    H    VAL  76           H        VAL  76 -30.834   6.168  -0.953
    2    HA   VAL  76           HA       VAL  76 -28.401   4.927  -2.096
    3    HB   VAL  76           HB       VAL  76 -28.646   6.349   0.589
    4   HG11  VAL  76          HG11      VAL  76 -26.324   5.039  -0.838
    5   HG13  VAL  76          HG12      VAL  76 -27.022   4.573   0.715
    6   HG12  VAL  76          HG13      VAL  76 -26.144   6.095   0.563
    7   HG22  VAL  76          HG21      VAL  76 -27.941   8.251  -0.265
    8   HG21  VAL  76          HG22      VAL  76 -28.506   7.596  -1.802
    9   HG23  VAL  76          HG23      VAL  76 -26.804   7.464  -1.359

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLU  77           H        GLU  77 -28.227   2.758  -1.525
    2    HA   GLU  77           HA       GLU  77 -29.018   1.938   1.118
    3    HB2  GLU  77           HB2      GLU  77 -30.662   0.335   0.565
    4    HB3  GLU  77           HB3      GLU  77 -31.182   1.881  -0.105
    5    HG2  GLU  77           HG2      GLU  77 -30.600   1.153  -2.310
    6    HG3  GLU  77           HG3      GLU  77 -29.987  -0.370  -1.668

  No H/Q in entry =           6
  In of MODEL    4
    1    H    VAL  78           H        VAL  78 -28.731  -0.168   1.737
    2    HA   VAL  78           HA       VAL  78 -26.086  -0.978   0.820
    3    HB   VAL  78           HB       VAL  78 -27.801  -1.870   3.178
    4   HG11  VAL  78          HG11      VAL  78 -25.494  -3.126   2.018
    5   HG13  VAL  78          HG12      VAL  78 -26.404  -3.605   3.452
    6   HG12  VAL  78          HG13      VAL  78 -25.060  -2.474   3.597
    7   HG22  VAL  78          HG21      VAL  78 -26.308  -0.564   4.534
    8   HG21  VAL  78          HG22      VAL  78 -27.030   0.445   3.280
    9   HG23  VAL  78          HG23      VAL  78 -25.365  -0.115   3.113

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ILE  79           H        ILE  79 -25.593  -2.880  -0.123
    2    HA   ILE  79           HA       ILE  79 -27.691  -4.289  -1.487
    3    HB   ILE  79           HB       ILE  79 -24.711  -4.882  -1.291
    4   HG12  ILE  79          HG12      ILE  79 -26.334  -3.701  -3.551
    5   HG13  ILE  79          HG13      ILE  79 -25.434  -2.731  -2.383
    6   HG22  ILE  79          HG21      ILE  79 -25.848  -5.995  -3.626
    7   HG21  ILE  79          HG22      ILE  79 -26.837  -6.521  -2.264
    8   HG23  ILE  79          HG23      ILE  79 -25.102  -6.836  -2.267
    9   HD13  ILE  79          HD11      ILE  79 -24.032  -2.841  -4.210
   10   HD12  ILE  79          HD12      ILE  79 -24.408  -4.536  -4.521
   11   HD11  ILE  79          HD13      ILE  79 -23.407  -4.094  -3.136

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ASP  80           H        ASP  80 -28.592  -6.205  -0.935
    2    HA   ASP  80           HA       ASP  80 -28.545  -7.154   1.694
    3    HB2  ASP  80           HB2      ASP  80 -30.318  -7.663   0.053
    4    HB3  ASP  80           HB3      ASP  80 -29.186  -8.679  -0.840

  No H/Q in entry =           4
  In of MODEL    4
    1    H    SER  81           H        SER  81 -27.029  -8.341   2.795
    2    HA   SER  81           HA       SER  81 -24.553  -9.053   1.579
    3    HB2  SER  81           HB2      SER  81 -23.946 -10.025   3.709
    4    HB3  SER  81           HB3      SER  81 -24.802  -8.513   4.009
    5    HG   SER  81           HG       SER  81 -25.525 -11.113   4.555

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU  82           H        LEU  82 -27.305 -11.094   1.875
    2    HA   LEU  82           HA       LEU  82 -25.809 -13.483   1.304
    3    HB2  LEU  82           HB2      LEU  82 -28.732 -12.796   1.086
    4    HB3  LEU  82           HB3      LEU  82 -28.070 -14.408   0.822
    5    HG   LEU  82           HG       LEU  82 -27.926 -12.911   3.420
    6   HD12  LEU  82          HD11      LEU  82 -29.665 -14.498   4.153
    7   HD11  LEU  82          HD12      LEU  82 -29.751 -15.152   2.515
    8   HD13  LEU  82          HD13      LEU  82 -30.242 -13.486   2.827
    9   HD21  LEU  82          HD21      LEU  82 -27.088 -15.617   2.421
   10   HD23  LEU  82          HD22      LEU  82 -27.419 -15.343   4.131
   11   HD22  LEU  82          HD23      LEU  82 -26.144 -14.431   3.322

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LEU  83           H        LEU  83 -27.729 -11.183  -0.564
    2    HA   LEU  83           HA       LEU  83 -27.568 -12.500  -3.060
    3    HB2  LEU  83           HB2      LEU  83 -27.914  -9.597  -2.357
    4    HB3  LEU  83           HB3      LEU  83 -27.967 -10.211  -4.010
    5    HG   LEU  83           HG       LEU  83 -29.999 -10.595  -1.830
    6   HD13  LEU  83          HD11      LEU  83 -30.721  -8.712  -2.857
    7   HD12  LEU  83          HD12      LEU  83 -31.213  -9.792  -4.160
    8   HD11  LEU  83          HD13      LEU  83 -29.661  -8.958  -4.244
    9   HD23  LEU  83          HD21      LEU  83 -30.177 -11.800  -4.577
   10   HD22  LEU  83          HD22      LEU  83 -31.146 -12.156  -3.149
   11   HD21  LEU  83          HD23      LEU  83 -29.470 -12.693  -3.231

  No H/Q in entry =          11
  In of MODEL    4
    1    H    TYR  84           H        TYR  84 -25.557 -10.187  -1.351
    2    HA   TYR  84           HA       TYR  84 -23.696  -9.699  -3.482
    3    HB2  TYR  84           HB2      TYR  84 -24.159  -8.222  -1.457
    4    HB3  TYR  84           HB3      TYR  84 -23.206  -9.372  -0.523
    5    HD1  TYR  84           HD1      TYR  84 -20.812  -9.895  -1.534
    6    HD2  TYR  84           HD2      TYR  84 -23.075  -6.368  -2.355
    7    HE1  TYR  84           HE1      TYR  84 -18.738  -8.738  -2.217
    8    HE2  TYR  84           HE2      TYR  84 -21.012  -5.203  -3.050
    9    HH   TYR  84           HH       TYR  84 -18.307  -5.699  -2.320

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLY  85           H        GLY  85 -23.484 -11.760  -0.573
    2    HA3  GLY  85           HA2      GLY  85 -20.929 -12.747  -1.086
    3    HA2  GLY  85           HA3      GLY  85 -22.173 -13.585  -0.158

  No H/Q in entry =           3
  In of MODEL    4
    1    H    LYS  86           H        LYS  86 -24.036 -13.882  -2.216
    2    HA   LYS  86           HA       LYS  86 -23.039 -16.254  -3.522
    3    HB2  LYS  86           HB2      LYS  86 -25.444 -15.330  -2.572
    4    HB3  LYS  86           HB3      LYS  86 -25.631 -15.145  -4.315
    5    HG2  LYS  86           HG2      LYS  86 -24.986 -17.699  -2.889
    6    HG3  LYS  86           HG3      LYS  86 -26.565 -17.227  -3.519
    7    HD2  LYS  86           HD2      LYS  86 -25.561 -16.990  -5.771
    8    HD3  LYS  86           HD3      LYS  86 -24.021 -17.552  -5.121
    9    HE2  LYS  86           HE2      LYS  86 -25.032 -19.685  -4.525
   10    HE3  LYS  86           HE3      LYS  86 -26.596 -19.123  -5.117
   11    HZ2  LYS  86           HZ1      LYS  86 -24.264 -20.010  -6.599
   12    HZ1  LYS  86           HZ2      LYS  86 -25.033 -18.631  -7.229
   13    HZ3  LYS  86           HZ3      LYS  86 -25.909 -20.071  -7.020

  No H/Q in entry =          13
  In of MODEL    4
    1    H    VAL  87           H        VAL  87 -22.965 -13.025  -4.358
    2    HA   VAL  87           HA       VAL  87 -22.651 -11.823  -6.280
    3    HB   VAL  87           HB       VAL  87 -21.632 -14.352  -7.619
    4   HG11  VAL  87          HG11      VAL  87 -21.840 -12.021  -8.748
    5   HG13  VAL  87          HG12      VAL  87 -20.305 -12.877  -8.899
    6   HG12  VAL  87          HG13      VAL  87 -20.474 -11.569  -7.729
    7   HG23  VAL  87          HG21      VAL  87 -19.925 -12.648  -5.834
    8   HG22  VAL  87          HG22      VAL  87 -19.544 -14.207  -6.562
    9   HG21  VAL  87          HG23      VAL  87 -20.726 -14.108  -5.258

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ASP  88           H        ASP  88 -25.178 -12.419  -5.926
    2    HA   ASP  88           HA       ASP  88 -26.336 -13.569  -8.339
    3    HB2  ASP  88           HB2      ASP  88 -27.325 -13.835  -6.014
    4    HB3  ASP  88           HB3      ASP  88 -27.743 -12.124  -6.081

  No H/Q in entry =           4
  In of MODEL    4
    1    H    GLY  89           H        GLY  89 -25.614 -12.298  -9.962
    2    HA3  GLY  89           HA2      GLY  89 -25.739  -9.519 -10.112
    3    HA2  GLY  89           HA3      GLY  89 -25.746 -10.615 -11.493

  No H/Q in entry =           3
  In of MODEL    4
    1    H    LEU  90           H        LEU  90 -28.217 -11.925 -11.055
    2    HA   LEU  90           HA       LEU  90 -29.993  -9.934 -12.124
    3    HB2  LEU  90           HB2      LEU  90 -30.110 -12.317 -12.745
    4    HB3  LEU  90           HB3      LEU  90 -30.615 -12.703 -11.100
    5    HG   LEU  90           HG       LEU  90 -32.713 -11.536 -11.432
    6   HD13  LEU  90          HD11      LEU  90 -32.505  -9.773 -12.877
    7   HD12  LEU  90          HD12      LEU  90 -33.076 -10.980 -14.033
    8   HD11  LEU  90          HD13      LEU  90 -31.354 -10.621 -13.912
    9   HD23  LEU  90          HD21      LEU  90 -32.689 -13.124 -13.896
   10   HD22  LEU  90          HD22      LEU  90 -33.664 -13.295 -12.436
   11   HD21  LEU  90          HD23      LEU  90 -32.023 -13.940 -12.481

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLY  91           H        GLY  91 -29.839 -11.494  -8.967
    2    HA3  GLY  91           HA2      GLY  91 -32.149 -10.353  -7.895
    3    HA2  GLY  91           HA3      GLY  91 -30.763 -10.931  -6.970

  No H/Q in entry =           3
  In of MODEL    4
    1    H    VAL  92           H        VAL  92 -28.813  -9.128  -7.805
    2    HA   VAL  92           HA       VAL  92 -29.549  -6.839  -6.211
    3    HB   VAL  92           HB       VAL  92 -27.022  -7.331  -7.830
    4   HG12  VAL  92          HG11      VAL  92 -27.136  -5.485  -5.469
    5   HG11  VAL  92          HG12      VAL  92 -27.798  -4.900  -6.998
    6   HG13  VAL  92          HG13      VAL  92 -26.112  -5.404  -6.904
    7   HG22  VAL  92          HG21      VAL  92 -26.822  -8.951  -6.267
    8   HG21  VAL  92          HG22      VAL  92 -27.945  -8.168  -5.154
    9   HG23  VAL  92          HG23      VAL  92 -26.280  -7.597  -5.274

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LEU  93           H        LEU  93 -29.175  -7.448  -9.645
    2    HA   LEU  93           HA       LEU  93 -29.473  -4.790 -10.527
    3    HB2  LEU  93           HB2      LEU  93 -28.877  -6.632 -12.024
    4    HB3  LEU  93           HB3      LEU  93 -30.480  -7.332 -11.804
    5    HG   LEU  93           HG       LEU  93 -31.459  -5.329 -12.888
    6   HD11  LEU  93          HD11      LEU  93 -29.573  -3.779 -12.367
    7   HD13  LEU  93          HD12      LEU  93 -30.024  -3.771 -14.074
    8   HD12  LEU  93          HD13      LEU  93 -28.586  -4.644 -13.545
    9   HD23  LEU  93          HD21      LEU  93 -30.444  -5.876 -15.191
   10   HD22  LEU  93          HD22      LEU  93 -31.306  -7.132 -14.302
   11   HD21  LEU  93          HD23      LEU  93 -29.541  -7.111 -14.314

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LYS  94           H        LYS  94 -31.893  -7.304  -9.708
    2    HA   LYS  94           HA       LYS  94 -34.212  -5.805 -10.293
    3    HB2  LYS  94           HB2      LYS  94 -33.730  -8.035  -8.323
    4    HB3  LYS  94           HB3      LYS  94 -35.314  -7.304  -8.569
    5    HG2  LYS  94           HG2      LYS  94 -35.256  -8.039 -10.916
    6    HG3  LYS  94           HG3      LYS  94 -33.710  -8.826 -10.611
    7    HD2  LYS  94           HD2      LYS  94 -34.846 -10.170  -8.803
    8    HD3  LYS  94           HD3      LYS  94 -36.379  -9.483  -9.337
    9    HE2  LYS  94           HE2      LYS  94 -35.895 -10.381 -11.624
   10    HE3  LYS  94           HE3      LYS  94 -34.492 -11.204 -10.942
   11    HZ3  LYS  94           HZ1      LYS  94 -36.373 -12.686 -11.127
   12    HZ2  LYS  94           HZ2      LYS  94 -37.321 -11.658 -10.162
   13    HZ1  LYS  94           HZ3      LYS  94 -35.972 -12.445  -9.495

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ALA  95           H        ALA  95 -32.374  -6.015  -7.257
    2    HA   ALA  95           HA       ALA  95 -34.182  -4.425  -5.740
    3    HB2  ALA  95           HB1      ALA  95 -31.832  -5.857  -5.241
    4    HB3  ALA  95           HB2      ALA  95 -32.785  -4.953  -4.066
    5    HB1  ALA  95           HB3      ALA  95 -31.427  -4.178  -4.882

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA  96           H        ALA  96 -31.536  -3.587  -7.838
    2    HA   ALA  96           HA       ALA  96 -31.380  -0.843  -7.015
    3    HB2  ALA  96           HB1      ALA  96 -30.026  -0.607  -9.129
    4    HB3  ALA  96           HB2      ALA  96 -30.366  -2.302  -9.477
    5    HB1  ALA  96           HB3      ALA  96 -29.433  -1.865  -8.045

  No H/Q in entry =           5
  In of MODEL    4
    1    H    VAL  97           H        VAL  97 -32.962  -2.478  -9.722
    2    HA   VAL  97           HA       VAL  97 -33.991  -0.134 -10.931
    3    HB   VAL  97           HB       VAL  97 -34.862  -3.042 -11.021
    4   HG11  VAL  97          HG11      VAL  97 -36.615  -0.990 -11.458
    5   HG13  VAL  97          HG12      VAL  97 -36.711  -2.568 -12.243
    6   HG12  VAL  97          HG13      VAL  97 -35.934  -1.219 -13.071
    7   HG21  VAL  97          HG21      VAL  97 -33.556  -1.204 -13.030
    8   HG23  VAL  97          HG22      VAL  97 -34.046  -2.869 -13.346
    9   HG22  VAL  97          HG23      VAL  97 -32.783  -2.530 -12.162

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ALA  98           H        ALA  98 -35.205  -2.333  -8.425
    2    HA   ALA  98           HA       ALA  98 -37.738  -1.137  -8.038
    3    HB1  ALA  98           HB1      ALA  98 -36.766  -3.375  -7.052
    4    HB3  ALA  98           HB2      ALA  98 -37.921  -2.443  -6.097
    5    HB2  ALA  98           HB3      ALA  98 -36.196  -2.338  -5.745

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA  99           H        ALA  99 -34.633  -0.435  -6.397
    2    HA   ALA  99           HA       ALA  99 -35.709   1.542  -4.692
    3    HB1  ALA  99           HB1      ALA  99 -33.086   0.609  -5.473
    4    HB2  ALA  99           HB2      ALA  99 -33.610   1.344  -3.957
    5    HB3  ALA  99           HB3      ALA  99 -33.120   2.365  -5.308

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ILE 100           H        ILE 100 -34.685   1.711  -8.051
    2    HA   ILE 100           HA       ILE 100 -34.802   4.567  -8.217
    3    HB   ILE 100           HB       ILE 100 -34.959   2.454 -10.395
    4   HG12  ILE 100          HG12      ILE 100 -32.746   4.385  -9.701
    5   HG13  ILE 100          HG13      ILE 100 -32.816   2.728  -9.100
    6   HG21  ILE 100          HG21      ILE 100 -35.316   5.385 -10.469
    7   HG23  ILE 100          HG22      ILE 100 -35.857   4.150 -11.605
    8   HG22  ILE 100          HG23      ILE 100 -34.191   4.729 -11.659
    9   HD12  ILE 100          HD11      ILE 100 -32.279   3.724 -11.860
   10   HD11  ILE 100          HD12      ILE 100 -32.974   2.120 -11.631
   11   HD13  ILE 100          HD13      ILE 100 -31.414   2.515 -10.912

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LYS 101           H        LYS 101 -37.158   2.024  -8.977
    2    HA   LYS 101           HA       LYS 101 -39.207   3.738  -9.932
    3    HB2  LYS 101           HB2      LYS 101 -39.148   0.941  -8.858
    4    HB3  LYS 101           HB3      LYS 101 -40.684   1.745  -9.180
    5    HG2  LYS 101           HG2      LYS 101 -40.221   1.911 -11.476
    6    HG3  LYS 101           HG3      LYS 101 -38.532   1.463 -11.240
    7    HD2  LYS 101           HD2      LYS 101 -39.831  -0.399 -12.153
    8    HD3  LYS 101           HD3      LYS 101 -39.202  -0.774 -10.548
    9    HE2  LYS 101           HE2      LYS 101 -41.278  -1.431 -10.042
   10    HE3  LYS 101           HE3      LYS 101 -41.695   0.282 -10.011
   11    HZ3  LYS 101           HZ1      LYS 101 -42.603   0.185 -12.125
   12    HZ2  LYS 101           HZ2      LYS 101 -43.093  -1.289 -11.443
   13    HZ1  LYS 101           HZ3      LYS 101 -41.792  -1.251 -12.533

  No H/Q in entry =          13
  In of MODEL    4
    1    H    LYS 102           H        LYS 102 -38.730   2.190  -6.755
    2    HA   LYS 102           HA       LYS 102 -40.944   3.413  -5.521
    3    HB2  LYS 102           HB2      LYS 102 -39.744   1.500  -4.549
    4    HB3  LYS 102           HB3      LYS 102 -38.328   2.519  -4.294
    5    HG2  LYS 102           HG2      LYS 102 -39.604   3.914  -2.764
    6    HG3  LYS 102           HG3      LYS 102 -41.023   2.900  -3.020
    7    HD2  LYS 102           HD2      LYS 102 -39.834   0.987  -2.037
    8    HD3  LYS 102           HD3      LYS 102 -38.416   2.003  -1.779
    9    HE2  LYS 102           HE2      LYS 102 -39.728   3.484  -0.333
   10    HE3  LYS 102           HE3      LYS 102 -41.164   2.501  -0.613
   11    HZ1  LYS 102           HZ1      LYS 102 -39.478   0.688   0.346
   12    HZ3  LYS 102           HZ2      LYS 102 -40.563   1.580   1.301
   13    HZ2  LYS 102           HZ3      LYS 102 -38.941   2.070   1.174

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ALA 103           H        ALA 103 -37.964   4.756  -6.526
    2    HA   ALA 103           HA       ALA 103 -38.123   7.041  -4.699
    3    HB2  ALA 103           HB1      ALA 103 -36.125   7.759  -6.272
    4    HB3  ALA 103           HB2      ALA 103 -36.131   6.049  -6.703
    5    HB1  ALA 103           HB3      ALA 103 -35.883   6.536  -5.026

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA 104           H        ALA 104 -38.779   6.388  -8.054
    2    HA   ALA 104           HA       ALA 104 -39.304   9.196  -8.620
    3    HB2  ALA 104           HB1      ALA 104 -39.375   8.572 -10.834
    4    HB1  ALA 104           HB2      ALA 104 -40.136   7.021 -10.482
    5    HB3  ALA 104           HB3      ALA 104 -38.406   7.239 -10.207

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA 105           H        ALA 105 -40.951   7.095  -6.846
    2    HA   ALA 105           HA       ALA 105 -43.342   8.543  -6.778
    3    HB2  ALA 105           HB1      ALA 105 -44.118   7.739  -8.829
    4    HB3  ALA 105           HB2      ALA 105 -44.775   6.544  -7.712
    5    HB1  ALA 105           HB3      ALA 105 -43.318   6.179  -8.635

  No H/Q in entry =           5
  In of MODEL    5
    1    H1   ALA   1           H3       ALA   1 -11.984 -16.151  -2.400
    2    H2   ALA   1           H2       ALA   1 -11.021 -17.278  -3.235
    3    H3   ALA   1           H1       ALA   1 -12.180 -16.357  -4.074
    4    HA   ALA   1           HA       ALA   1 -13.548 -18.082  -3.831
    5    HB3  ALA   1           HB1      ALA   1 -12.121 -19.827  -3.361
    6    HB1  ALA   1           HB2      ALA   1 -12.882 -19.722  -1.773
    7    HB2  ALA   1           HB3      ALA   1 -11.320 -18.954  -2.054

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLU   2           H        GLU   2 -15.158 -18.960  -2.177
    2    HA   GLU   2           HA       GLU   2 -16.839 -17.266  -1.126
    3    HB2  GLU   2           HB2      GLU   2 -15.859 -19.669   0.428
    4    HB3  GLU   2           HB3      GLU   2 -17.398 -18.846   0.677
    5    HG2  GLU   2           HG2      GLU   2 -18.355 -19.956  -1.056
    6    HG3  GLU   2           HG3      GLU   2 -17.038 -19.535  -2.139

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLU   3           H        GLU   3 -14.907 -18.576   1.504
    2    HA   GLU   3           HA       GLU   3 -15.174 -16.222   3.053
    3    HB2  GLU   3           HB2      GLU   3 -13.543 -18.739   3.315
    4    HB3  GLU   3           HB3      GLU   3 -13.338 -17.411   4.458
    5    HG2  GLU   3           HG2      GLU   3 -15.530 -17.599   5.273
    6    HG3  GLU   3           HG3      GLU   3 -16.108 -18.415   3.826

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LEU   4           H        LEU   4 -12.191 -17.652   1.673
    2    HA   LEU   4           HA       LEU   4 -10.392 -15.714   2.268
    3    HB2  LEU   4           HB2      LEU   4 -10.594 -17.024  -0.453
    4    HB3  LEU   4           HB3      LEU   4  -9.157 -16.276   0.232
    5    HG   LEU   4           HG       LEU   4 -10.609 -18.695   1.350
    6   HD13  LEU   4          HD11      LEU   4  -8.951 -20.025   0.428
    7   HD12  LEU   4          HD12      LEU   4  -7.765 -18.720   0.399
    8   HD11  LEU   4          HD13      LEU   4  -9.050 -18.770  -0.806
    9   HD23  LEU   4          HD21      LEU   4  -8.360 -18.714   2.736
   10   HD22  LEU   4          HD22      LEU   4  -9.700 -17.696   3.259
   11   HD21  LEU   4          HD23      LEU   4  -8.349 -16.986   2.377

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLU   5           H        GLU   5 -12.725 -15.558  -0.411
    2    HA   GLU   5           HA       GLU   5 -11.765 -13.060  -1.419
    3    HB2  GLU   5           HB2      GLU   5 -13.088 -14.690  -2.765
    4    HB3  GLU   5           HB3      GLU   5 -14.496 -14.313  -1.772
    5    HG2  GLU   5           HG2      GLU   5 -14.645 -12.951  -3.750
    6    HG3  GLU   5           HG3      GLU   5 -14.191 -11.891  -2.417

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLU   6           H        GLU   6 -14.477 -13.980   0.671
    2    HA   GLU   6           HA       GLU   6 -15.430 -11.318   1.060
    3    HB2  GLU   6           HB2      GLU   6 -15.806 -13.866   2.648
    4    HB3  GLU   6           HB3      GLU   6 -16.624 -12.350   3.027
    5    HG2  GLU   6           HG2      GLU   6 -17.668 -12.317   0.822
    6    HG3  GLU   6           HG3      GLU   6 -16.786 -13.769   0.354

  No H/Q in entry =           6
  In of MODEL    5
    1    H    VAL   7           H        VAL   7 -13.089 -13.382   2.643
    2    HA   VAL   7           HA       VAL   7 -12.655 -11.791   4.966
    3    HB   VAL   7           HB       VAL   7 -10.913 -13.809   3.527
    4   HG11  VAL   7          HG11      VAL   7 -10.477 -12.259   6.086
    5   HG13  VAL   7          HG12      VAL   7  -9.370 -12.459   4.728
    6   HG12  VAL   7          HG13      VAL   7  -9.702 -13.818   5.802
    7   HG21  VAL   7          HG21      VAL   7 -13.155 -14.409   4.744
    8   HG23  VAL   7          HG22      VAL   7 -12.236 -14.114   6.220
    9   HG22  VAL   7          HG23      VAL   7 -11.719 -15.368   5.096

  No H/Q in entry =           9
  In of MODEL    5
    1    H    VAL   8           H        VAL   8 -11.136 -11.890   1.759
    2    HA   VAL   8           HA       VAL   8  -9.107  -9.979   2.250
    3    HB   VAL   8           HB       VAL   8 -10.552 -10.715  -0.306
    4   HG11  VAL   8          HG11      VAL   8  -8.272  -8.827   0.258
    5   HG13  VAL   8          HG12      VAL   8  -9.678  -8.582  -0.779
    6   HG12  VAL   8          HG13      VAL   8  -8.381  -9.660  -1.293
    7   HG22  VAL   8          HG21      VAL   8  -8.990 -12.393  -0.541
    8   HG21  VAL   8          HG22      VAL   8  -8.805 -12.219   1.202
    9   HG23  VAL   8          HG23      VAL   8  -7.687 -11.401   0.116

  No H/Q in entry =           9
  In of MODEL    5
    1    H    MET   9           H        MET   9 -12.457  -9.653   1.081
    2    HA   MET   9           HA       MET   9 -12.442  -6.877   0.637
    3    HB2  MET   9           HB2      MET   9 -14.612  -8.808   1.442
    4    HB3  MET   9           HB3      MET   9 -14.939  -7.081   1.277
    5    HG2  MET   9           HG2      MET   9 -14.012  -7.172  -1.042
    6    HG3  MET   9           HG3      MET   9 -13.839  -8.918  -0.868
    7    HE1  MET   9           HE1      MET   9 -15.964  -5.955  -0.421
    8    HE3  MET   9           HE2      MET   9 -17.623  -6.396  -0.819
    9    HE2  MET   9           HE3      MET   9 -16.450  -6.161  -2.111

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLY  10           H        GLY  10 -13.077  -8.770   3.570
    2    HA3  GLY  10           HA2      GLY  10 -13.668  -6.589   5.280
    3    HA2  GLY  10           HA3      GLY  10 -13.076  -8.166   5.801

  No H/Q in entry =           3
  In of MODEL    5
    1    H    LEU  11           H        LEU  11 -10.626  -8.250   4.491
    2    HA   LEU  11           HA       LEU  11  -8.956  -6.780   6.246
    3    HB2  LEU  11           HB2      LEU  11  -8.378  -8.202   3.645
    4    HB3  LEU  11           HB3      LEU  11  -7.123  -7.471   4.644
    5    HG   LEU  11           HG       LEU  11  -9.089  -9.537   5.663
    6   HD13  LEU  11          HD11      LEU  11  -7.842 -10.757   4.106
    7   HD12  LEU  11          HD12      LEU  11  -6.906 -10.973   5.584
    8   HD11  LEU  11          HD13      LEU  11  -6.384  -9.802   4.373
    9   HD22  LEU  11          HD21      LEU  11  -8.259  -8.502   7.578
   10   HD21  LEU  11          HD22      LEU  11  -6.727  -8.075   6.817
   11   HD23  LEU  11          HD23      LEU  11  -7.024  -9.735   7.332

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  12           H        ILE  12  -9.860  -6.261   2.853
    2    HA   ILE  12           HA       ILE  12  -8.209  -4.002   2.422
    3    HB   ILE  12           HB       ILE  12 -10.849  -4.720   1.123
    4   HG12  ILE  12          HG12      ILE  12  -8.788  -6.344   1.064
    5   HG13  ILE  12          HG13      ILE  12  -9.654  -6.010  -0.421
    6   HG23  ILE  12          HG21      ILE  12 -10.329  -2.402   0.654
    7   HG22  ILE  12          HG22      ILE  12  -9.905  -3.328  -0.780
    8   HG21  ILE  12          HG23      ILE  12  -8.671  -2.805   0.329
    9   HD11  ILE  12          HD11      ILE  12  -7.162  -4.536   0.472
   10   HD13  ILE  12          HD12      ILE  12  -7.954  -4.435  -1.099
   11   HD12  ILE  12          HD13      ILE  12  -7.148  -5.909  -0.619

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  13           H        ILE  13 -11.567  -4.328   3.509
    2    HA   ILE  13           HA       ILE  13 -12.080  -1.549   3.768
    3    HB   ILE  13           HB       ILE  13 -13.242  -3.989   5.134
    4   HG12  ILE  13          HG12      ILE  13 -13.470  -3.432   2.591
    5   HG13  ILE  13          HG13      ILE  13 -14.878  -3.951   3.492
    6   HG23  ILE  13          HG21      ILE  13 -13.847  -2.384   6.693
    7   HG22  ILE  13          HG22      ILE  13 -15.190  -2.236   5.567
    8   HG21  ILE  13          HG23      ILE  13 -13.867  -1.075   5.515
    9   HD12  ILE  13          HD11      ILE  13 -15.258  -1.923   2.013
   10   HD11  ILE  13          HD12      ILE  13 -14.170  -1.060   3.083
   11   HD13  ILE  13          HD13      ILE  13 -15.671  -1.696   3.716

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ASN  14           H        ASN  14 -10.927  -4.010   6.054
    2    HA   ASN  14           HA       ASN  14 -10.762  -2.360   8.334
    3    HB2  ASN  14           HB2      ASN  14 -10.459  -4.964   8.022
    4    HB3  ASN  14           HB3      ASN  14  -8.757  -4.544   7.867
    5   HD21  ASN  14          HD21      ASN  14  -9.369  -6.073  10.047
    6   HD22  ASN  14          HD22      ASN  14  -9.362  -5.147  11.468

  No H/Q in entry =           6
  In of MODEL    5
    1    H    SER  15           H        SER  15  -8.339  -3.146   5.851
    2    HA   SER  15           HA       SER  15  -6.228  -1.608   6.922
    3    HB2  SER  15           HB2      SER  15  -5.198  -1.812   4.768
    4    HB3  SER  15           HB3      SER  15  -6.127  -3.289   4.994
    5    HG   SER  15           HG       SER  15  -7.419  -2.713   3.437

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLY  16           H        GLY  16  -8.841  -0.800   4.666
    2    HA3  GLY  16           HA2      GLY  16  -8.034   1.855   4.107
    3    HA2  GLY  16           HA3      GLY  16  -9.672   1.227   3.943

  No H/Q in entry =           3
  In of MODEL    5
    1    H    GLN  17           H        GLN  17 -10.207   0.500   6.594
    2    HA   GLN  17           HA       GLN  17 -10.967   2.994   7.724
    3    HB2  GLN  17           HB2      GLN  17 -10.819   0.216   8.906
    4    HB3  GLN  17           HB3      GLN  17 -11.461   1.604   9.784
    5    HG2  GLN  17           HG2      GLN  17 -13.145   1.958   8.034
    6    HG3  GLN  17           HG3      GLN  17 -12.482   0.615   7.104
    7   HE21  GLN  17          HE21      GLN  17 -12.029  -0.621  10.022
    8   HE22  GLN  17          HE22      GLN  17 -13.541  -1.331  10.329

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ALA  18           H        ALA  18  -8.294   0.769   8.358
    2    HA   ALA  18           HA       ALA  18  -7.227   2.016  10.627
    3    HB2  ALA  18           HB1      ALA  18  -6.568  -0.192   9.269
    4    HB3  ALA  18           HB2      ALA  18  -5.424   0.619  10.339
    5    HB1  ALA  18           HB3      ALA  18  -5.349   0.892   8.598

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ARG  19           H        ARG  19  -6.458   2.543   7.178
    2    HA   ARG  19           HA       ARG  19  -4.604   4.631   7.603
    3    HB2  ARG  19           HB2      ARG  19  -4.902   3.475   5.411
    4    HB3  ARG  19           HB3      ARG  19  -6.462   4.283   5.228
    5    HG2  ARG  19           HG2      ARG  19  -5.379   6.478   5.291
    6    HG3  ARG  19           HG3      ARG  19  -3.815   5.726   5.601
    7    HD2  ARG  19           HD2      ARG  19  -3.946   6.305   3.256
    8    HD3  ARG  19           HD3      ARG  19  -3.995   4.544   3.408
    9    HE   ARG  19           HE       ARG  19  -6.647   5.398   3.391
   10   HH21  ARG  19          HH11      ARG  19  -7.840   5.521   1.469
   11   HH22  ARG  19          HH12      ARG  19  -7.017   5.611  -0.049
   12   HH11  ARG  19          HH21      ARG  19  -3.868   5.512   1.363
   13   HH12  ARG  19          HH22      ARG  19  -4.766   5.603  -0.109

  No H/Q in entry =          13
  In of MODEL    5
    1    H    SER  20           H        SER  20  -8.102   4.669   6.995
    2    HA   SER  20           HA       SER  20  -8.518   7.417   6.935
    3    HB2  SER  20           HB2      SER  20 -10.277   5.764   6.441
    4    HB3  SER  20           HB3      SER  20 -10.324   5.310   8.142
    5    HG   SER  20           HG       SER  20 -10.903   7.848   7.006

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU  21           H        LEU  21  -8.479   5.245   9.747
    2    HA   LEU  21           HA       LEU  21  -8.967   7.238  11.703
    3    HB2  LEU  21           HB2      LEU  21  -7.555   4.568  11.879
    4    HB3  LEU  21           HB3      LEU  21  -7.893   5.583  13.277
    5    HG   LEU  21           HG       LEU  21 -10.028   4.616  11.351
    6   HD11  LEU  21          HD11      LEU  21  -9.097   3.477  14.000
    7   HD13  LEU  21          HD12      LEU  21  -9.077   2.673  12.431
    8   HD12  LEU  21          HD13      LEU  21 -10.615   3.031  13.219
    9   HD21  LEU  21          HD21      LEU  21 -10.009   6.199  13.906
   10   HD23  LEU  21          HD22      LEU  21 -11.377   5.131  13.605
   11   HD22  LEU  21          HD23      LEU  21 -11.011   6.425  12.474

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ALA  22           H        ALA  22  -5.982   5.924  10.309
    2    HA   ALA  22           HA       ALA  22  -4.136   7.285  11.930
    3    HB2  ALA  22           HB1      ALA  22  -3.675   5.434  10.247
    4    HB1  ALA  22           HB2      ALA  22  -2.507   6.756  10.280
    5    HB3  ALA  22           HB3      ALA  22  -3.721   6.681   9.002

  No H/Q in entry =           5
  In of MODEL    5
    1    H    TYR  23           H        TYR  23  -5.466   8.260   8.740
    2    HA   TYR  23           HA       TYR  23  -4.185  10.785   8.664
    3    HB2  TYR  23           HB2      TYR  23  -5.240   9.842   6.672
    4    HB3  TYR  23           HB3      TYR  23  -6.823   9.917   7.449
    5    HD1  TYR  23           HD1      TYR  23  -3.962  12.022   6.304
    6    HD2  TYR  23           HD2      TYR  23  -8.108  11.897   7.414
    7    HE1  TYR  23           HE1      TYR  23  -4.237  14.363   5.534
    8    HE2  TYR  23           HE2      TYR  23  -8.384  14.239   6.643
    9    HH   TYR  23           HH       TYR  23  -7.014  16.220   6.258

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ALA  24           H        ALA  24  -7.286   9.744  10.039
    2    HA   ALA  24           HA       ALA  24  -8.181  12.318  10.798
    3    HB1  ALA  24           HB1      ALA  24  -9.973  11.029  11.265
    4    HB2  ALA  24           HB2      ALA  24  -9.139  10.481  12.717
    5    HB3  ALA  24           HB3      ALA  24  -8.990   9.567  11.218

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA  25           H        ALA  25  -6.130   9.911  12.387
    2    HA   ALA  25           HA       ALA  25  -5.827  11.180  14.885
    3    HB2  ALA  25           HB1      ALA  25  -5.006   8.842  14.075
    4    HB3  ALA  25           HB2      ALA  25  -4.013   9.727  15.235
    5    HB1  ALA  25           HB3      ALA  25  -3.572   9.713  13.527

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU  26           H        LEU  26  -4.035  11.507  11.848
    2    HA   LEU  26           HA       LEU  26  -2.119  13.373  12.762
    3    HB2  LEU  26           HB2      LEU  26  -1.787  12.220  10.664
    4    HB3  LEU  26           HB3      LEU  26  -3.273  12.893  10.002
    5    HG   LEU  26           HG       LEU  26  -2.309  15.165  10.132
    6   HD12  LEU  26          HD11      LEU  26   0.228  15.242  10.553
    7   HD11  LEU  26          HD12      LEU  26   0.037  13.660  11.302
    8   HD13  LEU  26          HD13      LEU  26  -0.803  15.059  11.971
    9   HD21  LEU  26          HD21      LEU  26  -0.517  13.144   8.750
   10   HD23  LEU  26          HD22      LEU  26  -0.597  14.863   8.372
   11   HD22  LEU  26          HD23      LEU  26  -1.997  13.833   8.084

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LYS  27           H        LYS  27  -5.307  13.780  11.275
    2    HA   LYS  27           HA       LYS  27  -5.312  16.568  11.066
    3    HB2  LYS  27           HB2      LYS  27  -7.020  15.050  10.081
    4    HB3  LYS  27           HB3      LYS  27  -7.676  14.785  11.696
    5    HG2  LYS  27           HG2      LYS  27  -8.158  17.183  11.922
    6    HG3  LYS  27           HG3      LYS  27  -7.452  17.489  10.332
    7    HD2  LYS  27           HD2      LYS  27  -9.150  16.013   9.296
    8    HD3  LYS  27           HD3      LYS  27  -9.863  15.724  10.885
    9    HE2  LYS  27           HE2      LYS  27 -10.358  18.126  11.118
   10    HE3  LYS  27           HE3      LYS  27  -9.618  18.438   9.544
   11    HZ3  LYS  27           HZ1      LYS  27 -11.992  18.260   9.296
   12    HZ2  LYS  27           HZ2      LYS  27 -12.009  16.746  10.072
   13    HZ1  LYS  27           HZ3      LYS  27 -11.264  16.920   8.552

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLN  28           H        GLN  28  -6.163  14.474  13.798
    2    HA   GLN  28           HA       GLN  28  -7.106  16.465  15.564
    3    HB2  GLN  28           HB2      GLN  28  -5.652  13.865  16.118
    4    HB3  GLN  28           HB3      GLN  28  -6.412  14.860  17.362
    5    HG2  GLN  28           HG2      GLN  28  -7.851  13.704  14.959
    6    HG3  GLN  28           HG3      GLN  28  -7.896  13.017  16.582
    7   HE21  GLN  28          HE21      GLN  28  -9.803  14.778  14.611
    8   HE22  GLN  28          HE22      GLN  28 -10.569  15.786  15.740

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ALA  29           H        ALA  29  -3.858  15.234  14.888
    2    HA   ALA  29           HA       ALA  29  -2.455  16.669  16.865
    3    HB1  ALA  29           HB1      ALA  29  -0.507  16.013  15.754
    4    HB3  ALA  29           HB2      ALA  29  -1.260  16.116  14.162
    5    HB2  ALA  29           HB3      ALA  29  -1.657  14.779  15.241

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LYS  30           H        LYS  30  -3.322  17.518  13.530
    2    HA   LYS  30           HA       LYS  30  -1.959  19.984  13.424
    3    HB2  LYS  30           HB2      LYS  30  -4.469  19.057  12.012
    4    HB3  LYS  30           HB3      LYS  30  -3.663  20.586  11.665
    5    HG2  LYS  30           HG2      LYS  30  -1.568  19.330  11.161
    6    HG3  LYS  30           HG3      LYS  30  -2.446  17.818  11.409
    7    HD2  LYS  30           HD2      LYS  30  -4.018  18.423   9.608
    8    HD3  LYS  30           HD3      LYS  30  -3.162  19.946   9.362
    9    HE2  LYS  30           HE2      LYS  30  -1.105  18.689   8.792
   10    HE3  LYS  30           HE3      LYS  30  -1.979  17.171   9.008
   11    HZ2  LYS  30           HZ1      LYS  30  -1.813  18.036   6.663
   12    HZ1  LYS  30           HZ2      LYS  30  -2.881  19.281   7.124
   13    HZ3  LYS  30           HZ3      LYS  30  -3.376  17.655   7.200

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLN  31           H        GLN  31  -5.046  19.081  14.832
    2    HA   GLN  31           HA       GLN  31  -5.860  21.825  15.272
    3    HB2  GLN  31           HB2      GLN  31  -6.999  19.363  16.601
    4    HB3  GLN  31           HB3      GLN  31  -7.786  20.920  16.348
    5    HG2  GLN  31           HG2      GLN  31  -7.056  20.146  13.762
    6    HG3  GLN  31           HG3      GLN  31  -7.555  18.635  14.514
    7   HE21  GLN  31          HE21      GLN  31  -8.988  20.176  12.403
    8   HE22  GLN  31          HE22      GLN  31 -10.510  20.543  13.056

  No H/Q in entry =           8
  In of MODEL    5
    1    H    GLY  32           H        GLY  32  -3.517  19.943  16.604
    2    HA3  GLY  32           HA2      GLY  32  -2.129  20.436  18.408
    3    HA2  GLY  32           HA3      GLY  32  -3.281  21.661  18.925

  No H/Q in entry =           3
  In of MODEL    5
    1    H    ASP  33           H        ASP  33  -4.649  18.595  18.270
    2    HA   ASP  33           HA       ASP  33  -5.058  18.140  21.151
    3    HB2  ASP  33           HB2      ASP  33  -6.441  17.096  18.674
    4    HB3  ASP  33           HB3      ASP  33  -6.780  16.485  20.291

  No H/Q in entry =           4
  In of MODEL    5
    1    H    PHE  34           H        PHE  34  -2.876  17.328  21.464
    2    HA   PHE  34           HA       PHE  34  -1.834  15.092  20.073
    3    HB2  PHE  34           HB2      PHE  34  -1.240  16.096  22.865
    4    HB3  PHE  34           HB3      PHE  34  -0.289  14.886  22.004
    5    HD1  PHE  34           HD1      PHE  34  -0.522  18.311  22.727
    6    HD2  PHE  34           HD2      PHE  34   0.362  15.611  19.503
    7    HE1  PHE  34           HE1      PHE  34   0.746  20.100  21.570
    8    HE2  PHE  34           HE2      PHE  34   1.624  17.404  18.351
    9    HZ   PHE  34           HZ       PHE  34   1.818  19.645  19.389

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ALA  35           H        ALA  35  -3.885  15.343  22.930
    2    HA   ALA  35           HA       ALA  35  -3.629  12.688  23.836
    3    HB3  ALA  35           HB1      ALA  35  -6.099  13.275  24.686
    4    HB1  ALA  35           HB2      ALA  35  -5.592  14.900  24.226
    5    HB2  ALA  35           HB3      ALA  35  -4.665  13.996  25.422

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA  36           H        ALA  36  -6.100  14.156  21.726
    2    HA   ALA  36           HA       ALA  36  -7.473  11.719  21.254
    3    HB1  ALA  36           HB1      ALA  36  -8.950  13.113  20.290
    4    HB3  ALA  36           HB2      ALA  36  -7.783  13.549  19.042
    5    HB2  ALA  36           HB3      ALA  36  -7.826  14.441  20.563

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA  37           H        ALA  37  -4.816  13.346  19.585
    2    HA   ALA  37           HA       ALA  37  -4.749  11.704  17.294
    3    HB3  ALA  37           HB1      ALA  37  -2.789  13.454  18.715
    4    HB2  ALA  37           HB2      ALA  37  -3.316  13.496  17.034
    5    HB1  ALA  37           HB3      ALA  37  -2.143  12.287  17.561

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LYS  38           H        LYS  38  -2.993  11.438  20.376
    2    HA   LYS  38           HA       LYS  38  -1.626   9.060  19.898
    3    HB2  LYS  38           HB2      LYS  38  -1.983  10.823  22.037
    4    HB3  LYS  38           HB3      LYS  38  -2.578   9.286  22.657
    5    HG2  LYS  38           HG2      LYS  38  -0.463   8.199  22.128
    6    HG3  LYS  38           HG3      LYS  38   0.122   9.652  21.311
    7    HD2  LYS  38           HD2      LYS  38   0.266  10.880  23.343
    8    HD3  LYS  38           HD3      LYS  38  -0.735   9.715  24.212
    9    HE2  LYS  38           HE2      LYS  38   1.624   9.442  24.836
   10    HE3  LYS  38           HE3      LYS  38   1.046   8.012  23.976
   11    HZ3  LYS  38           HZ1      LYS  38   2.343   8.448  22.196
   12    HZ2  LYS  38           HZ2      LYS  38   3.281   9.296  23.332
   13    HZ1  LYS  38           HZ3      LYS  38   2.189  10.134  22.335

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ALA  39           H        ALA  39  -4.875   9.503  21.292
    2    HA   ALA  39           HA       ALA  39  -5.390   6.777  21.804
    3    HB3  ALA  39           HB1      ALA  39  -7.580   8.681  21.026
    4    HB2  ALA  39           HB2      ALA  39  -6.689   8.928  22.528
    5    HB1  ALA  39           HB3      ALA  39  -7.580   7.428  22.268

  No H/Q in entry =           5
  In of MODEL    5
    1    H    MET  40           H        MET  40  -6.003   8.770  18.950
    2    HA   MET  40           HA       MET  40  -7.443   6.809  17.492
    3    HB2  MET  40           HB2      MET  40  -5.872   9.228  16.583
    4    HB3  MET  40           HB3      MET  40  -6.879   8.248  15.514
    5    HG2  MET  40           HG2      MET  40  -7.941   9.487  18.066
    6    HG3  MET  40           HG3      MET  40  -8.009  10.316  16.513
    7    HE3  MET  40           HE1      MET  40 -10.560   8.646  14.448
    8    HE2  MET  40           HE2      MET  40  -8.809   8.793  14.303
    9    HE1  MET  40           HE3      MET  40  -9.752  10.144  14.931

  No H/Q in entry =           9
  In of MODEL    5
    1    H    MET  41           H        MET  41  -3.965   7.607  17.620
    2    HA   MET  41           HA       MET  41  -3.171   5.860  15.527
    3    HB2  MET  41           HB2      MET  41  -1.572   6.562  18.001
    4    HB3  MET  41           HB3      MET  41  -0.940   5.920  16.489
    5    HG2  MET  41           HG2      MET  41  -2.133   8.079  15.476
    6    HG3  MET  41           HG3      MET  41  -1.911   8.676  17.119
    7    HE2  MET  41           HE1      MET  41   1.043   6.631  17.493
    8    HE1  MET  41           HE2      MET  41   0.230   7.914  18.386
    9    HE3  MET  41           HE3      MET  41   1.850   8.184  17.746

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ASP  42           H        ASP  42  -3.556   5.390  19.014
    2    HA   ASP  42           HA       ASP  42  -2.474   2.816  19.184
    3    HB2  ASP  42           HB2      ASP  42  -3.383   4.565  20.999
    4    HB3  ASP  42           HB3      ASP  42  -4.792   3.514  20.927

  No H/Q in entry =           4
  In of MODEL    5
    1    H    GLN  43           H        GLN  43  -5.826   3.858  18.673
    2    HA   GLN  43           HA       GLN  43  -6.922   1.250  18.484
    3    HB2  GLN  43           HB2      GLN  43  -7.890   3.882  17.344
    4    HB3  GLN  43           HB3      GLN  43  -8.826   2.386  17.325
    5    HG2  GLN  43           HG2      GLN  43  -8.537   2.278  19.833
    6    HG3  GLN  43           HG3      GLN  43  -7.841   3.895  19.758
    7   HE21  GLN  43          HE21      GLN  43 -10.025   3.940  21.254
    8   HE22  GLN  43          HE22      GLN  43 -11.394   4.489  20.417

  No H/Q in entry =           8
  In of MODEL    5
    1    H    SER  44           H        SER  44  -5.616   3.481  16.068
    2    HA   SER  44           HA       SER  44  -6.285   1.977  13.782
    3    HB2  SER  44           HB2      SER  44  -5.073   4.384  14.221
    4    HB3  SER  44           HB3      SER  44  -3.700   3.411  13.697
    5    HG   SER  44           HG       SER  44  -4.826   4.357  11.929

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ARG  45           H        ARG  45  -3.411   1.922  15.869
    2    HA   ARG  45           HA       ARG  45  -1.893  -0.009  14.496
    3    HB2  ARG  45           HB2      ARG  45  -1.081   1.432  16.363
    4    HB3  ARG  45           HB3      ARG  45  -2.059   0.488  17.484
    5    HG2  ARG  45           HG2      ARG  45  -0.789  -1.551  16.850
    6    HG3  ARG  45           HG3      ARG  45   0.212  -0.581  15.772
    7    HD2  ARG  45           HD2      ARG  45   0.917   0.819  17.725
    8    HD3  ARG  45           HD3      ARG  45   0.012  -0.269  18.799
    9    HE   ARG  45           HE       ARG  45   1.743  -1.839  17.228
   10   HH21  ARG  45          HH11      ARG  45   3.656  -2.625  18.072
   11   HH22  ARG  45          HH12      ARG  45   4.411  -1.821  19.403
   12   HH11  ARG  45          HH21      ARG  45   1.996   0.640  19.611
   13   HH12  ARG  45          HH22      ARG  45   3.471   0.030  20.272

  No H/Q in entry =          13
  In of MODEL    5
    1    H    MET  46           H        MET  46  -4.291  -0.365  17.092
    2    HA   MET  46           HA       MET  46  -4.074  -3.160  17.407
    3    HB2  MET  46           HB2      MET  46  -6.276  -1.188  17.999
    4    HB3  MET  46           HB3      MET  46  -6.460  -2.910  18.337
    5    HG2  MET  46           HG2      MET  46  -4.488  -2.881  19.772
    6    HG3  MET  46           HG3      MET  46  -4.181  -1.199  19.369
    7    HE1  MET  46           HE1      MET  46  -6.343  -3.797  20.765
    8    HE3  MET  46           HE2      MET  46  -7.836  -2.948  20.382
    9    HE2  MET  46           HE3      MET  46  -7.312  -3.077  22.058

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ALA  47           H        ALA  47  -6.124  -1.185  15.302
    2    HA   ALA  47           HA       ALA  47  -7.703  -3.267  14.238
    3    HB3  ALA  47           HB1      ALA  47  -8.420  -1.043  13.814
    4    HB1  ALA  47           HB2      ALA  47  -7.916  -1.672  12.245
    5    HB2  ALA  47           HB3      ALA  47  -6.857  -0.582  13.142

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU  48           H        LEU  48  -4.604  -1.908  13.191
    2    HA   LEU  48           HA       LEU  48  -4.290  -3.500  10.855
    3    HB2  LEU  48           HB2      LEU  48  -2.260  -2.181  12.665
    4    HB3  LEU  48           HB3      LEU  48  -1.875  -2.900  11.101
    5    HG   LEU  48           HG       LEU  48  -3.936  -0.716  11.479
    6   HD13  LEU  48          HD11      LEU  48  -1.831   0.198  12.148
    7   HD12  LEU  48          HD12      LEU  48  -2.111   0.742  10.494
    8   HD11  LEU  48          HD13      LEU  48  -0.992  -0.585  10.809
    9   HD22  LEU  48          HD21      LEU  48  -4.385  -1.714   9.405
   10   HD21  LEU  48          HD22      LEU  48  -2.694  -2.122   9.115
   11   HD23  LEU  48          HD23      LEU  48  -3.241  -0.452   8.950

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ASN  49           H        ASN  49  -3.247  -3.870  14.205
    2    HA   ASN  49           HA       ASN  49  -1.606  -6.107  13.886
    3    HB2  ASN  49           HB2      ASN  49  -1.674  -4.755  15.929
    4    HB3  ASN  49           HB3      ASN  49  -3.315  -5.296  16.255
    5   HD21  ASN  49          HD21      ASN  49  -2.858  -6.424  18.202
    6   HD22  ASN  49          HD22      ASN  49  -1.867  -7.801  18.261

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLU  50           H        GLU  50  -5.081  -5.886  14.547
    2    HA   GLU  50           HA       GLU  50  -5.549  -8.693  14.662
    3    HB2  GLU  50           HB2      GLU  50  -7.164  -7.029  15.529
    4    HB3  GLU  50           HB3      GLU  50  -7.461  -6.474  13.880
    5    HG2  GLU  50           HG2      GLU  50  -8.290  -8.685  13.246
    6    HG3  GLU  50           HG3      GLU  50  -7.903  -9.318  14.842

  No H/Q in entry =           6
  In of MODEL    5
    1    H    ALA  51           H        ALA  51  -5.647  -6.303  12.059
    2    HA   ALA  51           HA       ALA  51  -6.600  -8.052  10.039
    3    HB2  ALA  51           HB1      ALA  51  -6.404  -6.240   8.666
    4    HB1  ALA  51           HB2      ALA  51  -4.772  -5.864   9.218
    5    HB3  ALA  51           HB3      ALA  51  -6.166  -5.371  10.181

  No H/Q in entry =           5
  In of MODEL    5
    1    H    HIS  52           H        HIS  52  -3.326  -7.091  11.030
    2    HA   HIS  52           HA       HIS  52  -1.899  -8.564   9.088
    3    HB2  HIS  52           HB2      HIS  52  -0.875  -6.820  10.499
    4    HB3  HIS  52           HB3      HIS  52  -1.071  -7.854  11.914
    5    HD1  HIS  52           HD1      HIS  52   0.254 -10.204  11.816
    6    HD2  HIS  52           HD2      HIS  52   1.413  -7.354   9.004
    7    HE1  HIS  52           HE1      HIS  52   2.507 -10.947  10.930
    8    HE2  HIS  52           HE2      HIS  52   3.227  -9.219   9.213

  No H/Q in entry =           8
  In of MODEL    5
    1    H    LEU  53           H        LEU  53  -3.107  -9.451  12.300
    2    HA   LEU  53           HA       LEU  53  -1.872 -11.977  12.504
    3    HB2  LEU  53           HB2      LEU  53  -4.376 -10.827  13.708
    4    HB3  LEU  53           HB3      LEU  53  -3.897 -12.497  14.005
    5    HG   LEU  53           HG       LEU  53  -2.031 -10.151  14.484
    6   HD13  LEU  53          HD11      LEU  53  -3.827  -9.755  15.987
    7   HD12  LEU  53          HD12      LEU  53  -2.627 -10.632  16.937
    8   HD11  LEU  53          HD13      LEU  53  -4.040 -11.473  16.308
    9   HD22  LEU  53          HD21      LEU  53  -0.716 -12.106  14.461
   10   HD21  LEU  53          HD22      LEU  53  -2.008 -13.094  15.134
   11   HD23  LEU  53          HD23      LEU  53  -1.129 -11.982  16.167

  No H/Q in entry =          11
  In of MODEL    5
    1    H    VAL  54           H        VAL  54  -4.994 -10.997  11.130
    2    HA   VAL  54           HA       VAL  54  -5.868 -13.606  10.447
    3    HB   VAL  54           HB       VAL  54  -6.551 -10.886   9.303
    4   HG12  VAL  54          HG11      VAL  54  -8.631 -12.296   8.489
    5   HG11  VAL  54          HG12      VAL  54  -7.500 -13.645   8.568
    6   HG13  VAL  54          HG13      VAL  54  -7.157 -12.268   7.524
    7   HG22  VAL  54          HG21      VAL  54  -7.464 -10.931  11.452
    8   HG21  VAL  54          HG22      VAL  54  -7.693 -12.678  11.437
    9   HG23  VAL  54          HG23      VAL  54  -8.786 -11.639  10.525

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLN  55           H        GLN  55  -4.027 -11.133   8.657
    2    HA   GLN  55           HA       GLN  55  -3.869 -12.601   6.244
    3    HB2  GLN  55           HB2      GLN  55  -3.296 -10.329   6.049
    4    HB3  GLN  55           HB3      GLN  55  -2.189 -10.386   7.418
    5    HG2  GLN  55           HG2      GLN  55  -0.456 -11.211   6.149
    6    HG3  GLN  55           HG3      GLN  55  -1.513 -12.204   5.154
    7   HE21  GLN  55          HE21      GLN  55  -1.533 -11.520   3.031
    8   HE22  GLN  55          HE22      GLN  55  -1.356  -9.914   2.517

  No H/Q in entry =           8
  In of MODEL    5
    1    H    THR  56           H        THR  56  -1.772 -12.543   9.130
    2    HA   THR  56           HA       THR  56   0.331 -14.115   8.223
    3    HB   THR  56           HB       THR  56  -0.913 -14.382  10.968
    4    HG1  THR  56           HG1      THR  56   1.000 -12.491  10.083
    5   HG22  THR  56          HG21      THR  56   2.017 -14.386  10.330
    6   HG21  THR  56          HG22      THR  56   1.069 -15.846  10.040
    7   HG23  THR  56          HG23      THR  56   1.165 -15.163  11.663

  No H/Q in entry =           7
  In of MODEL    5
    1    H    LYS  57           H        LYS  57  -2.778 -15.191   9.580
    2    HA   LYS  57           HA       LYS  57  -2.293 -17.981   9.343
    3    HB2  LYS  57           HB2      LYS  57  -4.130 -16.915  10.681
    4    HB3  LYS  57           HB3      LYS  57  -4.923 -16.475   9.176
    5    HG2  LYS  57           HG2      LYS  57  -5.147 -18.833   8.566
    6    HG3  LYS  57           HG3      LYS  57  -4.287 -19.315  10.026
    7    HD2  LYS  57           HD2      LYS  57  -6.077 -18.297  11.408
    8    HD3  LYS  57           HD3      LYS  57  -6.950 -17.856   9.940
    9    HE2  LYS  57           HE2      LYS  57  -6.217 -20.696  10.743
   10    HE3  LYS  57           HE3      LYS  57  -7.818 -19.983  10.929
   11    HZ2  LYS  57           HZ1      LYS  57  -6.673 -21.160   8.647
   12    HZ1  LYS  57           HZ2      LYS  57  -7.011 -19.530   8.309
   13    HZ3  LYS  57           HZ3      LYS  57  -8.247 -20.559   8.857

  No H/Q in entry =          13
  In of MODEL    5
    1    H    LEU  58           H        LEU  58  -3.651 -15.563   7.157
    2    HA   LEU  58           HA       LEU  58  -4.423 -17.404   5.153
    3    HB2  LEU  58           HB2      LEU  58  -3.856 -14.448   5.012
    4    HB3  LEU  58           HB3      LEU  58  -4.502 -15.397   3.672
    5    HG   LEU  58           HG       LEU  58  -5.793 -15.228   6.415
    6   HD11  LEU  58          HD11      LEU  58  -6.108 -13.592   3.919
    7   HD13  LEU  58          HD12      LEU  58  -6.110 -13.080   5.606
    8   HD12  LEU  58          HD13      LEU  58  -7.520 -13.894   4.932
    9   HD22  LEU  58          HD21      LEU  58  -6.727 -17.152   5.548
   10   HD21  LEU  58          HD22      LEU  58  -6.389 -16.700   3.878
   11   HD23  LEU  58          HD23      LEU  58  -7.764 -15.991   4.722

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  59           H        ILE  59  -1.307 -16.149   6.021
    2    HA   ILE  59           HA       ILE  59  -0.191 -16.869   3.389
    3    HB   ILE  59           HB       ILE  59   0.545 -14.788   4.954
    4   HG12  ILE  59          HG12      ILE  59   2.667 -16.414   3.538
    5   HG13  ILE  59          HG13      ILE  59   1.458 -15.499   2.672
    6   HG22  ILE  59          HG21      ILE  59   2.654 -16.808   5.668
    7   HG21  ILE  59          HG22      ILE  59   1.293 -16.545   6.733
    8   HG23  ILE  59          HG23      ILE  59   2.393 -15.222   6.355
    9   HD12  ILE  59          HD11      ILE  59   3.519 -14.432   4.591
   10   HD11  ILE  59          HD12      ILE  59   2.165 -13.465   4.011
   11   HD13  ILE  59          HD13      ILE  59   3.372 -14.066   2.873

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLU  60           H        GLU  60  -0.197 -17.965   6.760
    2    HA   GLU  60           HA       GLU  60   1.861 -19.917   6.508
    3    HB2  GLU  60           HB2      GLU  60   1.054 -19.117   8.690
    4    HB3  GLU  60           HB3      GLU  60  -0.520 -19.851   8.382
    5    HG2  GLU  60           HG2      GLU  60   0.540 -22.080   8.264
    6    HG3  GLU  60           HG3      GLU  60   2.114 -21.347   8.567

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLY  61           H        GLY  61  -1.647 -20.063   6.011
    2    HA3  GLY  61           HA2      GLY  61  -1.358 -22.855   5.061
    3    HA2  GLY  61           HA3      GLY  61  -2.855 -22.137   5.648

  No H/Q in entry =           3
  In of MODEL    5
    1    H    ASP  62           H        ASP  62  -0.640 -20.534   3.447
    2    HA   ASP  62           HA       ASP  62  -2.706 -19.952   1.579
    3    HB2  ASP  62           HB2      ASP  62  -0.863 -18.977   0.250
    4    HB3  ASP  62           HB3      ASP  62  -0.818 -18.449   1.928

  No H/Q in entry =           4
  In of MODEL    5
    1    H    ALA  63           H        ALA  63  -2.727 -22.739   1.800
    2    HA   ALA  63           HA       ALA  63  -1.205 -24.101  -0.181
    3    HB1  ALA  63           HB1      ALA  63  -2.474 -25.178   1.693
    4    HB3  ALA  63           HB2      ALA  63  -2.718 -25.916   0.111
    5    HB2  ALA  63           HB3      ALA  63  -3.957 -24.860   0.791

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLY  64           H        GLY  64  -4.360 -22.502  -0.207
    2    HA3  GLY  64           HA2      GLY  64  -5.777 -21.882  -1.899
    3    HA2  GLY  64           HA3      GLY  64  -4.327 -21.696  -2.871

  No H/Q in entry =           3
  In of MODEL    5
    1    H    GLU  65           H        GLU  65  -4.796 -22.632  -4.799
    2    HA   GLU  65           HA       GLU  65  -6.585 -24.794  -5.104
    3    HB2  GLU  65           HB2      GLU  65  -4.486 -23.674  -6.956
    4    HB3  GLU  65           HB3      GLU  65  -5.627 -24.935  -7.422
    5    HG2  GLU  65           HG2      GLU  65  -7.512 -23.466  -6.908
    6    HG3  GLU  65           HG3      GLU  65  -6.411 -22.213  -6.342

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLY  66           H        GLY  66  -5.536 -26.549  -6.780
    2    HA3  GLY  66           HA2      GLY  66  -4.375 -28.524  -5.151
    3    HA2  GLY  66           HA3      GLY  66  -4.572 -28.605  -6.890

  No H/Q in entry =           3
  In of MODEL    5
    1    H    LYS  67           H        LYS  67  -2.949 -26.304  -7.454
    2    HA   LYS  67           HA       LYS  67  -0.394 -27.596  -7.517
    3    HB2  LYS  67           HB2      LYS  67  -1.375 -24.945  -8.562
    4    HB3  LYS  67           HB3      LYS  67   0.259 -25.564  -8.832
    5    HG2  LYS  67           HG2      LYS  67  -0.674 -27.608  -9.846
    6    HG3  LYS  67           HG3      LYS  67  -2.307 -27.003  -9.576
    7    HD2  LYS  67           HD2      LYS  67  -1.853 -25.089 -11.057
    8    HD3  LYS  67           HD3      LYS  67  -0.208 -25.677 -11.318
    9    HE2  LYS  67           HE2      LYS  67  -1.093 -27.763 -12.282
   10    HE3  LYS  67           HE3      LYS  67  -2.741 -27.199 -12.007
   11    HZ3  LYS  67           HZ1      LYS  67  -2.360 -25.370 -13.496
   12    HZ2  LYS  67           HZ2      LYS  67  -1.980 -26.821 -14.289
   13    HZ1  LYS  67           HZ3      LYS  67  -0.739 -25.817 -13.709

  No H/Q in entry =          13
  In of MODEL    5
    1    H    MET  68           H        MET  68   1.604 -26.701  -6.953
    2    HA   MET  68           HA       MET  68   1.946 -26.082  -4.288
    3    HB2  MET  68           HB2      MET  68   3.765 -25.536  -6.634
    4    HB3  MET  68           HB3      MET  68   4.265 -25.444  -4.945
    5    HG2  MET  68           HG2      MET  68   3.059 -27.903  -6.246
    6    HG3  MET  68           HG3      MET  68   4.787 -27.655  -5.986
    7    HE1  MET  68           HE1      MET  68   5.754 -26.935  -4.067
    8    HE3  MET  68           HE2      MET  68   5.644 -27.945  -2.627
    9    HE2  MET  68           HE3      MET  68   4.828 -26.383  -2.664

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LYS  69           H        LYS  69   0.706 -23.953  -6.562
    2    HA   LYS  69           HA       LYS  69   1.956 -21.540  -5.771
    3    HB2  LYS  69           HB2      LYS  69  -0.617 -22.043  -7.233
    4    HB3  LYS  69           HB3      LYS  69   0.040 -20.428  -6.939
    5    HG2  LYS  69           HG2      LYS  69   2.125 -21.038  -8.066
    6    HG3  LYS  69           HG3      LYS  69   1.529 -22.678  -8.320
    7    HD2  LYS  69           HD2      LYS  69  -0.350 -21.757  -9.665
    8    HD3  LYS  69           HD3      LYS  69   0.333 -20.142  -9.470
    9    HE2  LYS  69           HE2      LYS  69   1.824 -22.479 -10.695
   10    HE3  LYS  69           HE3      LYS  69   0.989 -21.239 -11.629
   11    HZ1  LYS  69           HZ1      LYS  69   2.383 -19.582 -10.423
   12    HZ3  LYS  69           HZ2      LYS  69   3.246 -20.603 -11.470
   13    HZ2  LYS  69           HZ3      LYS  69   3.287 -20.872  -9.793

  No H/Q in entry =          13
  In of MODEL    5
    1    H    VAL  70           H        VAL  70   0.126 -19.634  -5.310
    2    HA   VAL  70           HA       VAL  70  -1.206 -20.362  -2.765
    3    HB   VAL  70           HB       VAL  70  -0.473 -18.171  -1.855
    4   HG11  VAL  70          HG11      VAL  70   0.851 -20.218  -1.416
    5   HG13  VAL  70          HG12      VAL  70   1.878 -18.785  -1.486
    6   HG12  VAL  70          HG13      VAL  70   1.813 -19.891  -2.857
    7   HG21  VAL  70          HG21      VAL  70   0.998 -18.001  -4.510
    8   HG23  VAL  70          HG22      VAL  70   1.437 -17.021  -3.113
    9   HG22  VAL  70          HG23      VAL  70  -0.157 -16.845  -3.844

  No H/Q in entry =           9
  In of MODEL    5
    1    H    SER  71           H        SER  71  -2.807 -18.699  -2.110
    2    HA   SER  71           HA       SER  71  -4.698 -18.162  -4.143
    3    HB2  SER  71           HB2      SER  71  -5.255 -18.369  -1.704
    4    HB3  SER  71           HB3      SER  71  -4.451 -16.829  -1.421
    5    HG   SER  71           HG       SER  71  -5.994 -16.205  -3.293

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU  72           H        LEU  72  -4.940 -16.502  -5.473
    2    HA   LEU  72           HA       LEU  72  -2.856 -14.662  -5.954
    3    HB2  LEU  72           HB2      LEU  72  -5.685 -14.910  -6.936
    4    HB3  LEU  72           HB3      LEU  72  -4.669 -13.550  -7.405
    5    HG   LEU  72           HG       LEU  72  -3.805 -16.439  -7.739
    6   HD11  LEU  72          HD11      LEU  72  -5.319 -14.591  -9.586
    7   HD13  LEU  72          HD12      LEU  72  -5.698 -16.259  -9.151
    8   HD12  LEU  72          HD13      LEU  72  -4.331 -15.912 -10.210
    9   HD22  LEU  72          HD21      LEU  72  -1.866 -15.145  -7.930
   10   HD21  LEU  72          HD22      LEU  72  -2.719 -13.756  -8.584
   11   HD23  LEU  72          HD23      LEU  72  -2.424 -15.164  -9.600

  No H/Q in entry =          11
  In of MODEL    5
    1    H    VAL  73           H        VAL  73  -5.958 -14.346  -4.332
    2    HA   VAL  73           HA       VAL  73  -6.044 -11.575  -3.987
    3    HB   VAL  73           HB       VAL  73  -7.754 -11.957  -2.397
    4   HG13  VAL  73          HG11      VAL  73  -9.164 -13.568  -3.544
    5   HG12  VAL  73          HG12      VAL  73  -7.755 -14.343  -4.265
    6   HG11  VAL  73          HG13      VAL  73  -8.203 -12.707  -4.747
    7   HG23  VAL  73          HG21      VAL  73  -8.005 -14.479  -1.630
    8   HG22  VAL  73          HG22      VAL  73  -6.916 -13.391  -0.769
    9   HG21  VAL  73          HG23      VAL  73  -6.272 -14.528  -1.954

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LEU  74           H        LEU  74  -4.076 -13.911  -2.394
    2    HA   LEU  74           HA       LEU  74  -3.686 -12.759   0.127
    3    HB2  LEU  74           HB2      LEU  74  -2.867 -14.964  -0.356
    4    HB3  LEU  74           HB3      LEU  74  -1.830 -14.348  -1.642
    5    HG   LEU  74           HG       LEU  74  -0.526 -13.069   0.020
    6   HD13  LEU  74          HD11      LEU  74  -2.096 -12.572   1.738
    7   HD12  LEU  74          HD12      LEU  74  -0.988 -13.735   2.470
    8   HD11  LEU  74          HD13      LEU  74  -2.572 -14.262   1.898
    9   HD22  LEU  74          HD21      LEU  74   0.704 -14.896   0.676
   10   HD21  LEU  74          HD22      LEU  74  -0.316 -15.620  -0.547
   11   HD23  LEU  74          HD23      LEU  74  -0.721 -15.822   1.142

  No H/Q in entry =          11
  In of MODEL    5
    1    H    VAL  75           H        VAL  75  -1.795 -12.344  -2.828
    2    HA   VAL  75           HA       VAL  75  -0.028 -10.392  -1.817
    3    HB   VAL  75           HB       VAL  75  -0.970 -10.894  -4.642
    4   HG11  VAL  75          HG11      VAL  75   1.269  -9.131  -3.555
    5   HG13  VAL  75          HG12      VAL  75  -0.143  -8.598  -4.455
    6   HG12  VAL  75          HG13      VAL  75   1.083  -9.572  -5.249
    7   HG23  VAL  75          HG21      VAL  75   1.642 -11.570  -3.251
    8   HG22  VAL  75          HG22      VAL  75   1.114 -12.109  -4.846
    9   HG21  VAL  75          HG23      VAL  75   0.301 -12.707  -3.398

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLU  76           H        GLU  76  -3.180 -10.094  -3.482
    2    HA   GLU  76           HA       GLU  76  -3.272  -7.281  -3.589
    3    HB2  GLU  76           HB2      GLU  76  -4.904  -8.795  -4.735
    4    HB3  GLU  76           HB3      GLU  76  -5.581  -9.215  -3.170
    5    HG2  GLU  76           HG2      GLU  76  -6.253  -6.877  -2.805
    6    HG3  GLU  76           HG3      GLU  76  -5.560  -6.407  -4.345

  No H/Q in entry =           6
  In of MODEL    5
    1    H    ALA  77           H        ALA  77  -4.355  -9.519  -1.047
    2    HA   ALA  77           HA       ALA  77  -5.344  -7.528   0.706
    3    HB3  ALA  77           HB1      ALA  77  -5.985  -9.792   1.107
    4    HB2  ALA  77           HB2      ALA  77  -4.984  -9.312   2.476
    5    HB1  ALA  77           HB3      ALA  77  -4.306 -10.323   1.202

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLN  78           H        GLN  78  -2.174  -9.033   0.350
    2    HA   GLN  78           HA       GLN  78  -0.937  -7.850   2.600
    3    HB2  GLN  78           HB2      GLN  78  -0.046  -9.781   1.249
    4    HB3  GLN  78           HB3      GLN  78   0.377  -8.631  -0.016
    5    HG2  GLN  78           HG2      GLN  78   1.814  -7.413   1.572
    6    HG3  GLN  78           HG3      GLN  78   1.396  -8.565   2.838
    7   HE21  GLN  78          HE21      GLN  78   4.115  -8.246   2.006
    8   HE22  GLN  78          HE22      GLN  78   4.602  -9.668   1.215

  No H/Q in entry =           8
  In of MODEL    5
    1    H    LEU  79           H        LEU  79  -1.312  -6.801  -0.750
    2    HA   LEU  79           HA       LEU  79   0.343  -4.551  -0.737
    3    HB2  LEU  79           HB2      LEU  79  -0.669  -5.376  -2.792
    4    HB3  LEU  79           HB3      LEU  79  -2.278  -5.005  -2.187
    5    HG   LEU  79           HG       LEU  79  -1.767  -2.611  -2.165
    6   HD13  LEU  79          HD11      LEU  79   0.469  -2.336  -1.649
    7   HD12  LEU  79          HD12      LEU  79   0.517  -2.051  -3.388
    8   HD11  LEU  79          HD13      LEU  79   0.991  -3.621  -2.738
    9   HD23  LEU  79          HD21      LEU  79  -1.131  -2.408  -4.716
   10   HD22  LEU  79          HD22      LEU  79  -2.648  -3.176  -4.259
   11   HD21  LEU  79          HD23      LEU  79  -1.261  -4.167  -4.699

  No H/Q in entry =          11
  In of MODEL    5
    1    H    HIS  80           H        HIS  80  -3.123  -4.758   0.083
    2    HA   HIS  80           HA       HIS  80  -3.352  -2.004   0.740
    3    HB2  HIS  80           HB2      HIS  80  -5.022  -4.434   1.061
    4    HB3  HIS  80           HB3      HIS  80  -5.362  -3.096   2.161
    5    HD1  HIS  80           HD1      HIS  80  -7.000  -1.483   1.247
    6    HD2  HIS  80           HD2      HIS  80  -4.777  -3.272  -1.793
    7    HE1  HIS  80           HE1      HIS  80  -7.849  -0.502  -0.935
    8    HE2  HIS  80           HE2      HIS  80  -6.500  -1.587  -2.798

  No H/Q in entry =           8
  In of MODEL    5
    1    H    LEU  81           H        LEU  81  -2.829  -4.888   2.740
    2    HA   LEU  81           HA       LEU  81  -2.839  -3.535   5.222
    3    HB2  LEU  81           HB2      LEU  81  -1.585  -6.138   4.350
    4    HB3  LEU  81           HB3      LEU  81  -1.569  -5.575   6.022
    5    HG   LEU  81           HG       LEU  81  -4.108  -5.864   4.390
    6   HD12  LEU  81          HD11      LEU  81  -4.387  -7.930   5.941
    7   HD11  LEU  81          HD12      LEU  81  -2.636  -7.836   6.130
    8   HD13  LEU  81          HD13      LEU  81  -3.339  -8.079   4.531
    9   HD23  LEU  81          HD21      LEU  81  -4.953  -6.073   6.890
   10   HD22  LEU  81          HD22      LEU  81  -4.648  -4.481   6.198
   11   HD21  LEU  81          HD23      LEU  81  -3.453  -5.224   7.261

  No H/Q in entry =          11
  In of MODEL    5
    1    H    MET  82           H        MET  82  -0.142  -4.409   3.058
    2    HA   MET  82           HA       MET  82   1.926  -3.485   4.743
    3    HB2  MET  82           HB2      MET  82   1.721  -3.835   1.751
    4    HB3  MET  82           HB3      MET  82   3.194  -3.244   2.516
    5    HG2  MET  82           HG2      MET  82   1.819  -5.850   3.244
    6    HG3  MET  82           HG3      MET  82   3.191  -5.725   2.146
    7    HE3  MET  82           HE1      MET  82   6.193  -4.947   4.133
    8    HE2  MET  82           HE2      MET  82   5.254  -3.593   3.511
    9    HE1  MET  82           HE3      MET  82   5.363  -5.084   2.578

  No H/Q in entry =           9
  In of MODEL    5
    1    H    THR  83           H        THR  83   0.088  -1.871   2.180
    2    HA   THR  83           HA       THR  83   1.470   0.595   2.264
    3    HB   THR  83           HB       THR  83  -0.716   1.491   1.272
    4    HG1  THR  83           HG1      THR  83  -2.350   0.173   1.165
    5   HG22  THR  83          HG21      THR  83  -0.420  -0.328  -0.725
    6   HG21  THR  83          HG22      THR  83   1.083  -0.600   0.155
    7   HG23  THR  83          HG23      THR  83   0.703   1.007  -0.464

  No H/Q in entry =           7
  In of MODEL    5
    1    H    SER  84           H        SER  84  -1.526  -0.471   3.862
    2    HA   SER  84           HA       SER  84  -2.054   1.955   5.200
    3    HB2  SER  84           HB2      SER  84  -2.854  -0.891   5.769
    4    HB3  SER  84           HB3      SER  84  -3.365   0.446   6.799
    5    HG   SER  84           HG       SER  84  -3.815   0.121   4.006

  No H/Q in entry =           5
  In of MODEL    5
    1    H    MET  85           H        MET  85  -0.311  -0.953   6.339
    2    HA   MET  85           HA       MET  85   0.193  -0.015   8.942
    3    HB2  MET  85           HB2      MET  85   0.514  -2.356   8.268
    4    HB3  MET  85           HB3      MET  85   1.894  -1.878   7.278
    5    HG2  MET  85           HG2      MET  85   3.064  -1.043   9.270
    6    HG3  MET  85           HG3      MET  85   1.670  -1.445  10.273
    7    HE1  MET  85           HE1      MET  85   4.261  -2.473   7.892
    8    HE3  MET  85           HE2      MET  85   3.331  -3.834   7.270
    9    HE2  MET  85           HE3      MET  85   4.736  -4.128   8.289

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LEU  86           H        LEU  86   2.129   0.258   5.994
    2    HA   LEU  86           HA       LEU  86   4.326   1.597   7.150
    3    HB2  LEU  86           HB2      LEU  86   4.151   0.507   4.844
    4    HB3  LEU  86           HB3      LEU  86   3.327   1.978   4.326
    5    HG   LEU  86           HG       LEU  86   5.338   3.250   5.307
    6   HD11  LEU  86          HD11      LEU  86   6.073   0.649   6.114
    7   HD13  LEU  86          HD12      LEU  86   7.059   2.106   6.210
    8   HD12  LEU  86          HD13      LEU  86   7.183   1.055   4.801
    9   HD23  LEU  86          HD21      LEU  86   6.080   1.490   2.962
   10   HD22  LEU  86          HD22      LEU  86   6.453   3.192   3.221
   11   HD21  LEU  86          HD23      LEU  86   4.806   2.704   2.820

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ALA  87           H        ALA  87   1.402   2.803   5.558
    2    HA   ALA  87           HA       ALA  87   1.964   5.539   5.636
    3    HB1  ALA  87           HB1      ALA  87  -0.325   3.883   5.095
    4    HB3  ALA  87           HB2      ALA  87  -0.033   5.547   4.592
    5    HB2  ALA  87           HB3      ALA  87  -0.825   5.219   6.134

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ARG  88           H        ARG  88   0.294   3.524   8.028
    2    HA   ARG  88           HA       ARG  88  -0.245   5.572   9.869
    3    HB2  ARG  88           HB2      ARG  88  -1.156   3.208   9.940
    4    HB3  ARG  88           HB3      ARG  88   0.389   2.728  10.650
    5    HG2  ARG  88           HG2      ARG  88  -0.114   4.801  12.264
    6    HG3  ARG  88           HG3      ARG  88  -1.776   4.455  11.806
    7    HD2  ARG  88           HD2      ARG  88  -1.864   2.608  13.056
    8    HD3  ARG  88           HD3      ARG  88  -0.267   2.043  12.529
    9    HE   ARG  88           HE       ARG  88  -0.820   3.306  14.979
   10   HH21  ARG  88          HH11      ARG  88   0.724   4.339  16.218
   11   HH22  ARG  88          HH12      ARG  88   2.240   4.782  15.515
   12   HH11  ARG  88          HH21      ARG  88   1.463   3.508  12.406
   13   HH12  ARG  88          HH22      ARG  88   2.667   4.296  13.368

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLU  89           H        GLU  89   2.578   3.385   9.656
    2    HA   GLU  89           HA       GLU  89   3.825   4.295  12.000
    3    HB2  GLU  89           HB2      GLU  89   4.510   2.281  10.662
    4    HB3  GLU  89           HB3      GLU  89   5.274   3.382   9.514
    5    HG2  GLU  89           HG2      GLU  89   6.746   4.251  11.258
    6    HG3  GLU  89           HG3      GLU  89   5.921   3.287  12.480

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LEU  90           H        LEU  90   4.133   5.448   8.670
    2    HA   LEU  90           HA       LEU  90   6.038   7.474   9.253
    3    HB2  LEU  90           HB2      LEU  90   4.040   7.112   7.023
    4    HB3  LEU  90           HB3      LEU  90   5.255   8.398   7.043
    5    HG   LEU  90           HG       LEU  90   5.964   5.470   7.386
    6   HD12  LEU  90          HD11      LEU  90   6.714   5.707   4.947
    7   HD11  LEU  90          HD12      LEU  90   5.681   7.135   4.893
    8   HD13  LEU  90          HD13      LEU  90   4.980   5.554   5.239
    9   HD22  LEU  90          HD21      LEU  90   7.846   6.645   8.068
   10   HD21  LEU  90          HD22      LEU  90   7.480   8.043   7.057
   11   HD23  LEU  90          HD23      LEU  90   8.159   6.585   6.335

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  91           H        ILE  91   2.499   7.444   9.098
    2    HA   ILE  91           HA       ILE  91   2.121  10.214   9.541
    3    HB   ILE  91           HB       ILE  91   0.360   7.817  10.087
    4   HG12  ILE  91          HG12      ILE  91   0.086  10.090   8.096
    5   HG13  ILE  91          HG13      ILE  91   0.966   8.605   7.729
    6   HG22  ILE  91          HG21      ILE  91  -1.399   9.853  10.142
    7   HG21  ILE  91          HG22      ILE  91  -0.010  10.703  10.815
    8   HG23  ILE  91          HG23      ILE  91  -0.629   9.259  11.614
    9   HD13  ILE  91          HD11      ILE  91  -0.962   7.293   7.773
   10   HD12  ILE  91          HD12      ILE  91  -1.570   8.799   7.087
   11   HD11  ILE  91          HD13      ILE  91  -1.839   8.436   8.792

  No H/Q in entry =          11
  In of MODEL    5
    1    H    THR  92           H        THR  92   2.556   7.483  11.750
    2    HA   THR  92           HA       THR  92   2.090   8.857  14.170
    3    HB   THR  92           HB       THR  92   3.930   6.545  13.515
    4    HG1  THR  92           HG1      THR  92   1.972   5.761  13.412
    5   HG22  THR  92          HG21      THR  92   3.546   6.262  16.148
    6   HG21  THR  92          HG22      THR  92   3.458   8.021  16.070
    7   HG23  THR  92          HG23      THR  92   4.903   7.182  15.502

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLU  93           H        GLU  93   5.051   8.443  12.243
    2    HA   GLU  93           HA       GLU  93   6.782   9.898  13.940
    3    HB2  GLU  93           HB2      GLU  93   6.880   9.576  10.925
    4    HB3  GLU  93           HB3      GLU  93   8.211  10.127  11.941
    5    HG2  GLU  93           HG2      GLU  93   6.837   7.473  12.393
    6    HG3  GLU  93           HG3      GLU  93   8.221   7.640  11.319

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LEU  94           H        LEU  94   4.725  10.877  11.220
    2    HA   LEU  94           HA       LEU  94   5.493  13.591  11.114
    3    HB2  LEU  94           HB2      LEU  94   2.923  12.188  10.358
    4    HB3  LEU  94           HB3      LEU  94   3.158  13.919  10.113
    5    HG   LEU  94           HG       LEU  94   5.205  11.956   9.072
    6   HD11  LEU  94          HD11      LEU  94   2.458  12.465   8.003
    7   HD13  LEU  94          HD12      LEU  94   3.461  11.022   7.883
    8   HD12  LEU  94          HD13      LEU  94   3.779  12.404   6.835
    9   HD23  LEU  94          HD21      LEU  94   5.433  13.791   7.345
   10   HD22  LEU  94          HD22      LEU  94   5.837  14.294   8.986
   11   HD21  LEU  94          HD23      LEU  94   4.281  14.738   8.283

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  95           H        ILE  95   2.974  11.944  13.004
    2    HA   ILE  95           HA       ILE  95   1.895  14.282  14.190
    3    HB   ILE  95           HB       ILE  95   1.951  11.404  15.123
    4   HG12  ILE  95          HG12      ILE  95  -0.292  13.142  14.064
    5   HG13  ILE  95          HG13      ILE  95   0.682  12.094  13.037
    6   HG21  ILE  95          HG21      ILE  95   0.631  13.861  16.315
    7   HG23  ILE  95          HG22      ILE  95   1.694  12.710  17.125
    8   HG22  ILE  95          HG23      ILE  95   0.067  12.224  16.648
    9   HD13  ILE  95          HD11      ILE  95  -0.195  10.145  13.960
   10   HD12  ILE  95          HD12      ILE  95  -1.593  11.214  14.030
   11   HD11  ILE  95          HD13      ILE  95  -0.627  10.935  15.478

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLU  96           H        GLU  96   4.520  12.104  15.198
    2    HA   GLU  96           HA       GLU  96   5.052  13.318  17.687
    3    HB2  GLU  96           HB2      GLU  96   6.033  11.172  17.048
    4    HB3  GLU  96           HB3      GLU  96   6.958  11.955  15.768
    5    HG2  GLU  96           HG2      GLU  96   8.595  12.532  17.232
    6    HG3  GLU  96           HG3      GLU  96   7.434  13.331  18.283

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LEU  97           H        LEU  97   6.122  14.097  14.402
    2    HA   LEU  97           HA       LEU  97   7.976  16.123  15.112
    3    HB2  LEU  97           HB2      LEU  97   6.399  15.543  12.615
    4    HB3  LEU  97           HB3      LEU  97   7.396  16.990  12.734
    5    HG   LEU  97           HG       LEU  97   8.466  14.210  13.305
    6   HD12  LEU  97          HD11      LEU  97   9.465  14.412  10.989
    7   HD11  LEU  97          HD12      LEU  97   8.393  15.786  10.719
    8   HD13  LEU  97          HD13      LEU  97   7.718  14.184  11.017
    9   HD23  LEU  97          HD21      LEU  97  10.618  15.519  12.563
   10   HD22  LEU  97          HD22      LEU  97   9.991  15.784  14.190
   11   HD21  LEU  97          HD23      LEU  97   9.662  16.959  12.917

  No H/Q in entry =          11
  In of MODEL    5
    1    H    HIS  98           H        HIS  98   4.485  16.203  14.449
    2    HA   HIS  98           HA       HIS  98   4.142  18.998  14.575
    3    HB2  HIS  98           HB2      HIS  98   2.285  16.721  15.304
    4    HB3  HIS  98           HB3      HIS  98   1.792  18.414  15.353
    5    HD1  HIS  98           HD1      HIS  98   2.861  15.708  12.959
    6    HD2  HIS  98           HD2      HIS  98   1.424  19.619  12.822
    7    HE1  HIS  98           HE1      HIS  98   2.300  16.181  10.532
    8    HE2  HIS  98           HE2      HIS  98   1.428  18.557  10.428

  No H/Q in entry =           8
  In of MODEL    5
    1    H    GLU  99           H        GLU  99   4.308  16.519  17.082
    2    HA   GLU  99           HA       GLU  99   3.669  18.210  19.273
    3    HB2  GLU  99           HB2      GLU  99   3.618  15.728  19.378
    4    HB3  GLU  99           HB3      GLU  99   5.379  15.710  19.274
    5    HG2  GLU  99           HG2      GLU  99   5.543  17.011  21.344
    6    HG3  GLU  99           HG3      GLU  99   3.788  17.125  21.436

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LYS 100           H        LYS 100   6.740  17.323  17.718
    2    HA   LYS 100           HA       LYS 100   8.369  18.754  19.575
    3    HB2  LYS 100           HB2      LYS 100   8.888  17.830  16.740
    4    HB3  LYS 100           HB3      LYS 100  10.104  18.621  17.748
    5    HG2  LYS 100           HG2      LYS 100   9.751  16.870  19.494
    6    HG3  LYS 100           HG3      LYS 100   8.634  16.046  18.402
    7    HD2  LYS 100           HD2      LYS 100  10.436  15.786  16.740
    8    HD3  LYS 100           HD3      LYS 100  11.558  16.622  17.816
    9    HE2  LYS 100           HE2      LYS 100  11.185  14.866  19.539
   10    HE3  LYS 100           HE3      LYS 100  10.125  14.010  18.413
   11    HZ1  LYS 100           HZ1      LYS 100  12.937  14.722  17.762
   12    HZ3  LYS 100           HZ2      LYS 100  11.911  13.648  16.935
   13    HZ2  LYS 100           HZ3      LYS 100  12.503  13.243  18.476

  No H/Q in entry =          13
  In of MODEL    5
    1    H    LEU 101           H        LEU 101   6.668  19.646  16.613
    2    HA   LEU 101           HA       LEU 101   7.843  22.221  16.273
    3    HB2  LEU 101           HB2      LEU 101   5.269  20.945  15.384
    4    HB3  LEU 101           HB3      LEU 101   5.494  22.679  15.172
    5    HG   LEU 101           HG       LEU 101   7.563  20.692  14.217
    6   HD12  LEU 101          HD11      LEU 101   6.407  21.173  11.928
    7   HD11  LEU 101          HD12      LEU 101   4.999  21.584  12.904
    8   HD13  LEU 101          HD13      LEU 101   5.688  19.964  12.992
    9   HD21  LEU 101          HD21      LEU 101   6.891  23.592  13.651
   10   HD23  LEU 101          HD22      LEU 101   7.889  22.644  12.550
   11   HD22  LEU 101          HD23      LEU 101   8.423  22.915  14.208

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LYS 102           H        LYS 102   6.318  21.067  18.888
    2    HA   LYS 102           HA       LYS 102   5.664  22.154  20.816
    3    HB2  LYS 102           HB2      LYS 102   6.919  24.160  19.689
    4    HB3  LYS 102           HB3      LYS 102   5.312  24.740  19.308
    5    HG2  LYS 102           HG2      LYS 102   6.687  24.512  21.964
    6    HG3  LYS 102           HG3      LYS 102   5.715  25.824  21.329
    7    HD2  LYS 102           HD2      LYS 102   4.510  23.172  22.213
    8    HD3  LYS 102           HD3      LYS 102   4.735  24.540  23.293
    9    HE2  LYS 102           HE2      LYS 102   2.466  24.098  21.800
   10    HE3  LYS 102           HE3      LYS 102   2.943  25.653  22.479
   11    HZ2  LYS 102           HZ1      LYS 102   2.417  25.746  20.098
   12    HZ1  LYS 102           HZ2      LYS 102   3.695  24.683  19.780
   13    HZ3  LYS 102           HZ3      LYS 102   4.013  26.220  20.420

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ALA 103           H        ALA 103   4.009  23.664  18.041
    2    HA   ALA 103           HA       ALA 103   1.545  24.206  18.919
    3    HB1  ALA 103           HB1      ALA 103   0.664  23.345  16.677
    4    HB2  ALA 103           HB2      ALA 103   2.320  22.832  16.352
    5    HB3  ALA 103           HB3      ALA 103   1.959  24.539  16.613

  No H/Q in entry =           5
  In of MODEL    5
    1    H1   ALA   1           H3       ALA   1  10.869 -20.228  -6.215
    2    H2   ALA   1           H2       ALA   1   9.910 -20.452  -7.602
    3    H3   ALA   1           H1       ALA   1   9.481 -21.200  -6.138
    4    HA   ALA   1           HA       ALA   1  10.548 -22.996  -6.870
    5    HB1  ALA   1           HB1      ALA   1  10.643 -22.641  -9.147
    6    HB2  ALA   1           HB2      ALA   1  12.367 -22.465  -8.815
    7    HB3  ALA   1           HB3      ALA   1  11.349 -21.033  -8.971

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLU   2           H        GLU   2  12.846 -23.913  -6.921
    2    HA   GLU   2           HA       GLU   2  14.221 -23.806  -4.707
    3    HB2  GLU   2           HB2      GLU   2  15.581 -23.662  -7.404
    4    HB3  GLU   2           HB3      GLU   2  16.315 -24.259  -5.916
    5    HG2  GLU   2           HG2      GLU   2  15.327 -26.291  -6.153
    6    HG3  GLU   2           HG3      GLU   2  13.746 -25.568  -6.417

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLU   3           H        GLU   3  15.970 -21.923  -7.110
    2    HA   GLU   3           HA       GLU   3  17.096 -20.214  -5.153
    3    HB2  GLU   3           HB2      GLU   3  17.045 -20.221  -8.163
    4    HB3  GLU   3           HB3      GLU   3  17.770 -18.879  -7.278
    5    HG2  GLU   3           HG2      GLU   3  19.451 -20.227  -6.348
    6    HG3  GLU   3           HG3      GLU   3  18.526 -21.708  -6.567

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LEU   4           H        LEU   4  14.807 -19.406  -7.790
    2    HA   LEU   4           HA       LEU   4  14.302 -16.802  -7.186
    3    HB2  LEU   4           HB2      LEU   4  12.157 -18.809  -7.915
    4    HB3  LEU   4           HB3      LEU   4  12.057 -17.062  -8.119
    5    HG   LEU   4           HG       LEU   4  14.050 -18.901  -9.483
    6   HD13  LEU   4          HD11      LEU   4  12.750 -18.776 -11.396
    7   HD12  LEU   4          HD12      LEU   4  12.020 -17.240 -10.934
    8   HD11  LEU   4          HD13      LEU   4  11.486 -18.736 -10.170
    9   HD23  LEU   4          HD21      LEU   4  14.358 -16.655 -10.840
   10   HD22  LEU   4          HD22      LEU   4  15.218 -16.881  -9.318
   11   HD21  LEU   4          HD23      LEU   4  13.751 -15.905  -9.363

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLU   5           H        GLU   5  12.854 -19.602  -5.539
    2    HA   GLU   5           HA       GLU   5  11.151 -18.050  -3.844
    3    HB2  GLU   5           HB2      GLU   5  10.788 -20.450  -4.375
    4    HB3  GLU   5           HB3      GLU   5  12.200 -20.843  -3.390
    5    HG2  GLU   5           HG2      GLU   5  10.273 -21.097  -1.977
    6    HG3  GLU   5           HG3      GLU   5  11.090 -19.616  -1.480

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLU   6           H        GLU   6  14.319 -19.584  -3.391
    2    HA   GLU   6           HA       GLU   6  14.654 -18.716  -0.694
    3    HB2  GLU   6           HB2      GLU   6  16.624 -19.638  -2.798
    4    HB3  GLU   6           HB3      GLU   6  17.076 -19.271  -1.132
    5    HG2  GLU   6           HG2      GLU   6  15.553 -20.979  -0.298
    6    HG3  GLU   6           HG3      GLU   6  14.963 -21.293  -1.930

  No H/Q in entry =           6
  In of MODEL    5
    1    H    VAL   7           H        VAL   7  15.407 -17.387  -3.846
    2    HA   VAL   7           HA       VAL   7  17.060 -15.233  -2.984
    3    HB   VAL   7           HB       VAL   7  15.364 -15.628  -5.464
    4   HG11  VAL   7          HG11      VAL   7  17.224 -13.386  -4.654
    5   HG13  VAL   7          HG12      VAL   7  15.581 -13.269  -5.281
    6   HG12  VAL   7          HG13      VAL   7  16.899 -13.755  -6.347
    7   HG21  VAL   7          HG21      VAL   7  17.491 -17.052  -4.887
    8   HG23  VAL   7          HG22      VAL   7  18.376 -15.579  -5.288
    9   HG22  VAL   7          HG23      VAL   7  17.352 -16.347  -6.499

  No H/Q in entry =           9
  In of MODEL    5
    1    H    VAL   8           H        VAL   8  13.573 -15.556  -3.547
    2    HA   VAL   8           HA       VAL   8  12.867 -12.856  -3.083
    3    HB   VAL   8           HB       VAL   8  11.295 -15.411  -2.653
    4   HG11  VAL   8          HG11      VAL   8  10.543 -12.501  -2.391
    5   HG13  VAL   8          HG12      VAL   8  10.181 -13.836  -1.297
    6   HG12  VAL   8          HG13      VAL   8   9.337 -13.707  -2.839
    7   HG22  VAL   8          HG21      VAL   8  10.689 -15.257  -4.875
    8   HG21  VAL   8          HG22      VAL   8  12.157 -14.294  -5.014
    9   HG23  VAL   8          HG23      VAL   8  10.599 -13.497  -4.823

  No H/Q in entry =           9
  In of MODEL    5
    1    H    MET   9           H        MET   9  13.171 -15.652  -0.896
    2    HA   MET   9           HA       MET   9  12.333 -14.387   1.470
    3    HB2  MET   9           HB2      MET   9  14.267 -16.638   0.933
    4    HB3  MET   9           HB3      MET   9  13.971 -16.053   2.571
    5    HG2  MET   9           HG2      MET   9  11.536 -16.448   2.248
    6    HG3  MET   9           HG3      MET   9  11.879 -17.105   0.647
    7    HE1  MET   9           HE1      MET   9  12.717 -17.033   4.210
    8    HE3  MET   9           HE2      MET   9  13.172 -18.658   4.714
    9    HE2  MET   9           HE3      MET   9  11.474 -18.264   4.464

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLY  10           H        GLY  10  15.520 -14.567  -0.080
    2    HA3  GLY  10           HA2      GLY  10  16.953 -13.119   1.889
    3    HA2  GLY  10           HA3      GLY  10  17.422 -13.281   0.197

  No H/Q in entry =           3
  In of MODEL    5
    1    H    LEU  11           H        LEU  11  15.237 -12.097  -1.050
    2    HA   LEU  11           HA       LEU  11  15.879  -9.341  -0.893
    3    HB2  LEU  11           HB2      LEU  11  13.536 -10.791  -2.129
    4    HB3  LEU  11           HB3      LEU  11  13.789  -9.053  -2.292
    5    HG   LEU  11           HG       LEU  11  15.851 -11.132  -3.071
    6   HD13  LEU  11          HD11      LEU  11  14.114 -11.530  -4.593
    7   HD12  LEU  11          HD12      LEU  11  15.100 -10.335  -5.435
    8   HD11  LEU  11          HD13      LEU  11  13.617  -9.838  -4.620
    9   HD22  LEU  11          HD21      LEU  11  17.051  -9.148  -2.848
   10   HD21  LEU  11          HD22      LEU  11  15.661  -8.134  -3.232
   11   HD23  LEU  11          HD23      LEU  11  16.508  -8.993  -4.517

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  12           H        ILE  12  13.137 -11.208   0.374
    2    HA   ILE  12           HA       ILE  12  11.706  -9.004   1.425
    3    HB   ILE  12           HB       ILE  12  11.788 -11.881   2.386
    4   HG12  ILE  12          HG12      ILE  12  11.101 -11.268  -0.068
    5   HG13  ILE  12          HG13      ILE  12  10.095 -12.377   0.842
    6   HG23  ILE  12          HG21      ILE  12  10.805 -10.496   4.112
    7   HG22  ILE  12          HG22      ILE  12   9.488 -11.326   3.286
    8   HG21  ILE  12          HG23      ILE  12   9.825  -9.634   2.928
    9   HD11  ILE  12          HD11      ILE  12   9.606  -9.397   0.600
   10   HD13  ILE  12          HD12      ILE  12   8.538 -10.583   1.348
   11   HD12  ILE  12          HD13      ILE  12   8.812 -10.617  -0.381

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  13           H        ILE  13  14.132 -11.165   2.841
    2    HA   ILE  13           HA       ILE  13  14.143  -9.979   5.419
    3    HB   ILE  13           HB       ILE  13  16.234 -11.518   3.862
    4   HG12  ILE  13          HG12      ILE  13  13.964 -12.514   4.707
    5   HG13  ILE  13          HG13      ILE  13  15.452 -13.421   4.953
    6   HG23  ILE  13          HG21      ILE  13  17.620 -10.433   5.379
    7   HG22  ILE  13          HG22      ILE  13  17.165 -11.850   6.318
    8   HG21  ILE  13          HG23      ILE  13  16.365 -10.304   6.609
    9   HD12  ILE  13          HD11      ILE  13  13.915 -13.252   6.998
   10   HD11  ILE  13          HD12      ILE  13  14.323 -11.540   7.037
   11   HD13  ILE  13          HD13      ILE  13  15.583 -12.748   7.254

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ASN  14           H        ASN  14  16.093  -9.422   2.503
    2    HA   ASN  14           HA       ASN  14  17.801  -7.448   3.563
    3    HB2  ASN  14           HB2      ASN  14  17.806  -8.720   1.250
    4    HB3  ASN  14           HB3      ASN  14  16.889  -7.321   0.708
    5   HD21  ASN  14          HD21      ASN  14  19.338  -7.620  -0.472
    6   HD22  ASN  14          HD22      ASN  14  20.460  -6.515   0.155

  No H/Q in entry =           6
  In of MODEL    5
    1    H    SER  15           H        SER  15  14.688  -7.160   1.863
    2    HA   SER  15           HA       SER  15  14.526  -4.342   1.912
    3    HB2  SER  15           HB2      SER  15  12.200  -4.631   1.410
    4    HB3  SER  15           HB3      SER  15  13.022  -5.987   0.647
    5    HG   SER  15           HG       SER  15  12.106  -7.315   2.006

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLY  16           H        GLY  16  13.472  -6.815   4.220
    2    HA3  GLY  16           HA2      GLY  16  12.215  -5.084   6.070
    3    HA2  GLY  16           HA3      GLY  16  12.858  -6.680   6.437

  No H/Q in entry =           3
  In of MODEL    5
    1    H    GLN  17           H        GLN  17  15.564  -6.299   5.850
    2    HA   GLN  17           HA       GLN  17  16.493  -5.054   8.229
    3    HB2  GLN  17           HB2      GLN  17  17.930  -5.892   5.697
    4    HB3  GLN  17           HB3      GLN  17  18.765  -5.263   7.117
    5    HG2  GLN  17           HG2      GLN  17  17.842  -7.068   8.493
    6    HG3  GLN  17           HG3      GLN  17  16.941  -7.684   7.108
    7   HE21  GLN  17          HE21      GLN  17  19.566  -6.741   5.531
    8   HE22  GLN  17          HE22      GLN  17  20.575  -8.092   5.714

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ALA  18           H        ALA  18  16.292  -3.989   4.866
    2    HA   ALA  18           HA       ALA  18  17.682  -1.569   5.090
    3    HB2  ALA  18           HB1      ALA  18  16.592  -2.810   3.023
    4    HB3  ALA  18           HB2      ALA  18  16.824  -1.062   3.003
    5    HB1  ALA  18           HB3      ALA  18  15.236  -1.737   3.371

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ARG  19           H        ARG  19  14.193  -2.222   5.480
    2    HA   ARG  19           HA       ARG  19  13.474   0.417   6.186
    3    HB2  ARG  19           HB2      ARG  19  11.827  -1.367   5.601
    4    HB3  ARG  19           HB3      ARG  19  12.180  -2.154   7.141
    5    HG2  ARG  19           HG2      ARG  19  11.430  -0.174   8.373
    6    HG3  ARG  19           HG3      ARG  19  11.167   0.694   6.861
    7    HD2  ARG  19           HD2      ARG  19   9.039  -0.140   7.679
    8    HD3  ARG  19           HD3      ARG  19   9.478  -1.016   6.206
    9    HE   ARG  19           HE       ARG  19  10.460  -2.534   8.317
   10   HH21  ARG  19          HH11      ARG  19   9.240  -4.195   9.258
   11   HH22  ARG  19          HH12      ARG  19   7.520  -4.200   9.083
   12   HH11  ARG  19          HH21      ARG  19   7.445  -1.301   7.212
   13   HH12  ARG  19          HH22      ARG  19   6.504  -2.562   7.921

  No H/Q in entry =          13
  In of MODEL    5
    1    H    SER  20           H        SER  20  14.380  -2.391   8.155
    2    HA   SER  20           HA       SER  20  14.070  -1.290  10.689
    3    HB2  SER  20           HB2      SER  20  14.621  -3.664  10.310
    4    HB3  SER  20           HB3      SER  20  16.231  -3.202   9.764
    5    HG   SER  20           HG       SER  20  15.079  -2.818  12.330

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU  21           H        LEU  21  16.917  -1.181   8.559
    2    HA   LEU  21           HA       LEU  21  18.559   0.341  10.298
    3    HB2  LEU  21           HB2      LEU  21  18.549   0.057   7.285
    4    HB3  LEU  21           HB3      LEU  21  19.784   0.948   8.172
    5    HG   LEU  21           HG       LEU  21  19.104  -1.958   8.712
    6   HD11  LEU  21          HD11      LEU  21  21.272  -0.730   6.985
    7   HD13  LEU  21          HD12      LEU  21  19.972  -1.796   6.455
    8   HD12  LEU  21          HD13      LEU  21  21.252  -2.419   7.494
    9   HD21  LEU  21          HD21      LEU  21  21.135  -0.002   9.753
   10   HD23  LEU  21          HD22      LEU  21  21.608  -1.691   9.625
   11   HD22  LEU  21          HD23      LEU  21  20.244  -1.239  10.634

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ALA  22           H        ALA  22  16.284   1.260   7.734
    2    HA   ALA  22           HA       ALA  22  16.770   4.028   7.742
    3    HB3  ALA  22           HB1      ALA  22  15.395   2.755   6.063
    4    HB2  ALA  22           HB2      ALA  22  14.659   4.256   6.624
    5    HB1  ALA  22           HB3      ALA  22  14.096   2.708   7.254

  No H/Q in entry =           5
  In of MODEL    5
    1    H    TYR  23           H        TYR  23  14.303   2.171   9.575
    2    HA   TYR  23           HA       TYR  23  13.295   4.393  11.016
    3    HB2  TYR  23           HB2      TYR  23  12.100   2.256  10.997
    4    HB3  TYR  23           HB3      TYR  23  13.445   1.474  11.828
    5    HD1  TYR  23           HD1      TYR  23  10.884   4.166  12.177
    6    HD2  TYR  23           HD2      TYR  23  13.636   1.551  14.186
    7    HE1  TYR  23           HE1      TYR  23   9.936   4.849  14.365
    8    HE2  TYR  23           HE2      TYR  23  12.687   2.232  16.373
    9    HH   TYR  23           HH       TYR  23  11.449   4.065  17.347

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ALA  24           H        ALA  24  15.981   2.169  11.666
    2    HA   ALA  24           HA       ALA  24  16.626   3.183  14.228
    3    HB1  ALA  24           HB1      ALA  24  18.016   1.414  14.072
    4    HB3  ALA  24           HB2      ALA  24  19.029   2.352  12.973
    5    HB2  ALA  24           HB3      ALA  24  17.755   1.318  12.331

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA  25           H        ALA  25  17.574   4.121  10.950
    2    HA   ALA  25           HA       ALA  25  19.482   6.092  11.595
    3    HB1  ALA  25           HB1      ALA  25  18.789   5.125   9.280
    4    HB3  ALA  25           HB2      ALA  25  19.260   6.822   9.370
    5    HB2  ALA  25           HB3      ALA  25  17.553   6.383   9.298

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU  26           H        LEU  26  15.965   6.256  11.224
    2    HA   LEU  26           HA       LEU  26  15.690   9.035  11.668
    3    HB2  LEU  26           HB2      LEU  26  13.853   7.764  10.738
    4    HB3  LEU  26           HB3      LEU  26  13.777   6.738  12.166
    5    HG   LEU  26           HG       LEU  26  13.132   8.688  13.539
    6   HD12  LEU  26          HD11      LEU  26  12.437  10.773  12.207
    7   HD11  LEU  26          HD12      LEU  26  13.433  10.134  10.902
    8   HD13  LEU  26          HD13      LEU  26  14.167  10.537  12.455
    9   HD21  LEU  26          HD21      LEU  26  11.469   8.339  11.026
   10   HD23  LEU  26          HD22      LEU  26  10.892   9.030  12.540
   11   HD22  LEU  26          HD23      LEU  26  11.375   7.337  12.475

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LYS  27           H        LYS  27  15.625   6.259  13.867
    2    HA   LYS  27           HA       LYS  27  15.002   7.621  16.230
    3    HB2  LYS  27           HB2      LYS  27  15.074   5.146  15.972
    4    HB3  LYS  27           HB3      LYS  27  16.837   5.229  15.933
    5    HG2  LYS  27           HG2      LYS  27  16.864   6.221  18.180
    6    HG3  LYS  27           HG3      LYS  27  15.097   6.209  18.221
    7    HD2  LYS  27           HD2      LYS  27  15.115   3.741  17.991
    8    HD3  LYS  27           HD3      LYS  27  16.880   3.761  17.984
    9    HE2  LYS  27           HE2      LYS  27  16.891   4.756  20.238
   10    HE3  LYS  27           HE3      LYS  27  15.124   4.766  20.248
   11    HZ3  LYS  27           HZ1      LYS  27  15.943   2.830  21.406
   12    HZ2  LYS  27           HZ2      LYS  27  16.871   2.364  20.058
   13    HZ1  LYS  27           HZ3      LYS  27  15.173   2.339  19.974

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLN  28           H        GLN  28  18.132   7.088  14.648
    2    HA   GLN  28           HA       GLN  28  19.793   8.205  16.640
    3    HB2  GLN  28           HB2      GLN  28  20.087   8.151  13.625
    4    HB3  GLN  28           HB3      GLN  28  21.363   8.655  14.735
    5    HG2  GLN  28           HG2      GLN  28  19.998   5.950  14.788
    6    HG3  GLN  28           HG3      GLN  28  21.577   6.265  14.071
    7   HE21  GLN  28          HE21      GLN  28  20.330   4.933  16.773
    8   HE22  GLN  28          HE22      GLN  28  21.503   5.387  17.911

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ALA  29           H        ALA  29  18.023   9.651  13.939
    2    HA   ALA  29           HA       ALA  29  18.978  12.289  14.188
    3    HB2  ALA  29           HB1      ALA  29  17.273  12.894  12.711
    4    HB1  ALA  29           HB2      ALA  29  16.147  11.704  13.362
    5    HB3  ALA  29           HB3      ALA  29  17.489  11.181  12.344

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LYS  30           H        LYS  30  16.224  10.648  15.706
    2    HA   LYS  30           HA       LYS  30  15.170  12.888  17.055
    3    HB2  LYS  30           HB2      LYS  30  15.104   9.947  17.766
    4    HB3  LYS  30           HB3      LYS  30  14.216  11.186  18.655
    5    HG2  LYS  30           HG2      LYS  30  13.086  11.849  16.532
    6    HG3  LYS  30           HG3      LYS  30  13.914  10.523  15.710
    7    HD2  LYS  30           HD2      LYS  30  12.863   8.903  17.240
    8    HD3  LYS  30           HD3      LYS  30  12.046  10.217  18.086
    9    HE2  LYS  30           HE2      LYS  30  10.873  10.827  15.989
   10    HE3  LYS  30           HE3      LYS  30  11.671   9.483  15.163
   11    HZ2  LYS  30           HZ1      LYS  30   9.367   9.039  16.038
   12    HZ1  LYS  30           HZ2      LYS  30  10.030   9.107  17.607
   13    HZ3  LYS  30           HZ3      LYS  30  10.560   7.927  16.501

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLN  31           H        GLN  31  17.863  10.762  17.804
    2    HA   GLN  31           HA       GLN  31  18.168  11.788  20.497
    3    HB2  GLN  31           HB2      GLN  31  20.219  10.245  18.901
    4    HB3  GLN  31           HB3      GLN  31  20.079  10.372  20.655
    5    HG2  GLN  31           HG2      GLN  31  17.582   9.379  19.882
    6    HG3  GLN  31           HG3      GLN  31  18.700   8.549  18.807
    7   HE21  GLN  31          HE21      GLN  31  17.169   7.384  21.082
    8   HE22  GLN  31          HE22      GLN  31  18.333   6.744  22.137

  No H/Q in entry =           8
  In of MODEL    5
    1    H    GLY  32           H        GLY  32  18.674  13.107  17.529
    2    HA3  GLY  32           HA2      GLY  32  19.627  15.166  17.012
    3    HA2  GLY  32           HA3      GLY  32  20.381  15.186  18.602

  No H/Q in entry =           3
  In of MODEL    5
    1    H    ASP  33           H        ASP  33  20.852  12.296  16.833
    2    HA   ASP  33           HA       ASP  33  23.668  13.015  16.372
    3    HB2  ASP  33           HB2      ASP  33  22.200  10.376  16.491
    4    HB3  ASP  33           HB3      ASP  33  23.886  10.517  15.999

  No H/Q in entry =           4
  In of MODEL    5
    1    H    PHE  34           H        PHE  34  23.170  14.326  14.486
    2    HA   PHE  34           HA       PHE  34  21.843  13.315  12.198
    3    HB2  PHE  34           HB2      PHE  34  23.939  15.483  12.428
    4    HB3  PHE  34           HB3      PHE  34  22.962  15.174  10.994
    5    HD1  PHE  34           HD1      PHE  34  23.175  17.118  13.904
    6    HD2  PHE  34           HD2      PHE  34  20.337  14.952  11.516
    7    HE1  PHE  34           HE1      PHE  34  21.335  18.490  14.843
    8    HE2  PHE  34           HE2      PHE  34  18.501  16.323  12.459
    9    HZ   PHE  34           HZ       PHE  34  19.003  18.092  14.118

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ALA  35           H        ALA  35  25.217  13.183  13.214
    2    HA   ALA  35           HA       ALA  35  26.341  12.374  10.762
    3    HB3  ALA  35           HB1      ALA  35  28.036  11.236  12.489
    4    HB2  ALA  35           HB2      ALA  35  27.154  12.250  13.630
    5    HB1  ALA  35           HB3      ALA  35  27.982  12.983  12.257

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA  36           H        ALA  36  25.251  10.407  13.529
    2    HA   ALA  36           HA       ALA  36  25.778   7.925  12.261
    3    HB2  ALA  36           HB1      ALA  36  25.355   7.176  14.337
    4    HB3  ALA  36           HB2      ALA  36  23.659   7.643  14.182
    5    HB1  ALA  36           HB3      ALA  36  24.840   8.796  14.805

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA  37           H        ALA  37  22.922  10.005  12.383
    2    HA   ALA  37           HA       ALA  37  21.098   8.202  11.207
    3    HB3  ALA  37           HB1      ALA  37  21.274  11.169  11.492
    4    HB1  ALA  37           HB2      ALA  37  19.979  10.070  11.964
    5    HB2  ALA  37           HB3      ALA  37  20.164  10.541  10.274

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LYS  38           H        LYS  38  23.160  10.694   9.727
    2    HA   LYS  38           HA       LYS  38  22.534  10.249   7.049
    3    HB2  LYS  38           HB2      LYS  38  24.314  11.840   8.495
    4    HB3  LYS  38           HB3      LYS  38  25.366  10.866   7.474
    5    HG2  LYS  38           HG2      LYS  38  24.193  11.612   5.473
    6    HG3  LYS  38           HG3      LYS  38  22.982  12.449   6.449
    7    HD2  LYS  38           HD2      LYS  38  24.548  14.076   7.202
    8    HD3  LYS  38           HD3      LYS  38  25.926  13.112   6.672
    9    HE2  LYS  38           HE2      LYS  38  25.541  14.973   5.115
   10    HE3  LYS  38           HE3      LYS  38  25.234  13.428   4.314
   11    HZ3  LYS  38           HZ1      LYS  38  23.031  13.835   4.177
   12    HZ2  LYS  38           HZ2      LYS  38  23.525  15.459   4.262
   13    HZ1  LYS  38           HZ3      LYS  38  22.961  14.668   5.655

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ALA  39           H        ALA  39  25.070   8.700   9.015
    2    HA   ALA  39           HA       ALA  39  26.172   7.125   6.952
    3    HB2  ALA  39           HB1      ALA  39  26.093   6.167   9.798
    4    HB1  ALA  39           HB2      ALA  39  27.022   7.608   9.380
    5    HB3  ALA  39           HB3      ALA  39  27.402   6.062   8.622

  No H/Q in entry =           5
  In of MODEL    5
    1    H    MET  40           H        MET  40  23.564   6.469   9.245
    2    HA   MET  40           HA       MET  40  23.170   3.755   8.517
    3    HB2  MET  40           HB2      MET  40  21.315   5.770   9.800
    4    HB3  MET  40           HB3      MET  40  20.939   4.053   9.628
    5    HG2  MET  40           HG2      MET  40  23.469   5.042  10.973
    6    HG3  MET  40           HG3      MET  40  21.977   4.742  11.863
    7    HE3  MET  40           HE1      MET  40  21.477   1.100  12.046
    8    HE2  MET  40           HE2      MET  40  20.588   2.385  11.233
    9    HE1  MET  40           HE3      MET  40  21.319   2.689  12.807

  No H/Q in entry =           9
  In of MODEL    5
    1    H    MET  41           H        MET  41  21.706   6.780   7.319
    2    HA   MET  41           HA       MET  41  19.774   5.547   5.645
    3    HB2  MET  41           HB2      MET  41  21.210   8.161   5.129
    4    HB3  MET  41           HB3      MET  41  19.693   7.639   4.408
    5    HG2  MET  41           HG2      MET  41  18.945   7.443   6.958
    6    HG3  MET  41           HG3      MET  41  20.232   8.625   7.180
    7    HE2  MET  41           HE1      MET  41  19.654   9.894   3.839
    8    HE1  MET  41           HE2      MET  41  20.600  10.354   5.252
    9    HE3  MET  41           HE3      MET  41  19.309  11.409   4.682

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ASP  42           H        ASP  42  23.131   6.528   5.098
    2    HA   ASP  42           HA       ASP  42  23.238   6.049   2.341
    3    HB2  ASP  42           HB2      ASP  42  24.967   7.082   4.112
    4    HB3  ASP  42           HB3      ASP  42  25.653   5.469   3.990

  No H/Q in entry =           4
  In of MODEL    5
    1    H    GLN  43           H        GLN  43  23.994   3.915   5.069
    2    HA   GLN  43           HA       GLN  43  24.703   1.665   3.493
    3    HB2  GLN  43           HB2      GLN  43  23.670   1.837   6.334
    4    HB3  GLN  43           HB3      GLN  43  24.278   0.357   5.583
    5    HG2  GLN  43           HG2      GLN  43  26.420   1.605   5.075
    6    HG3  GLN  43           HG3      GLN  43  25.811   2.924   6.070
    7   HE21  GLN  43          HE21      GLN  43  28.059   1.994   7.114
    8   HE22  GLN  43          HE22      GLN  43  27.801   0.909   8.392

  No H/Q in entry =           8
  In of MODEL    5
    1    H    SER  44           H        SER  44  21.624   2.747   4.868
    2    HA   SER  44           HA       SER  44  20.097   0.475   4.197
    3    HB2  SER  44           HB2      SER  44  19.607   2.998   5.336
    4    HB3  SER  44           HB3      SER  44  18.577   2.933   3.908
    5    HG   SER  44           HG       SER  44  17.497   1.974   5.631

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ARG  45           H        ARG  45  20.791   3.448   2.387
    2    HA   ARG  45           HA       ARG  45  19.280   2.929   0.080
    3    HB2  ARG  45           HB2      ARG  45  20.384   5.087   0.662
    4    HB3  ARG  45           HB3      ARG  45  21.943   4.359   0.282
    5    HG2  ARG  45           HG2      ARG  45  21.172   3.934  -2.034
    6    HG3  ARG  45           HG3      ARG  45  19.625   4.685  -1.652
    7    HD2  ARG  45           HD2      ARG  45  20.836   6.805  -1.070
    8    HD3  ARG  45           HD3      ARG  45  22.348   6.057  -1.634
    9    HE   ARG  45           HE       ARG  45  20.426   5.780  -3.673
   10   HH21  ARG  45          HH11      ARG  45  20.399   7.145  -5.440
   11   HH22  ARG  45          HH12      ARG  45  21.128   8.708  -5.338
   12   HH11  ARG  45          HH21      ARG  45  22.109   8.313  -2.049
   13   HH12  ARG  45          HH22      ARG  45  22.095   9.369  -3.415

  No H/Q in entry =          13
  In of MODEL    5
    1    H    MET  46           H        MET  46  22.657   2.116   0.837
    2    HA   MET  46           HA       MET  46  23.289   0.928  -1.643
    3    HB2  MET  46           HB2      MET  46  24.396   0.634   1.149
    4    HB3  MET  46           HB3      MET  46  25.067  -0.260  -0.218
    5    HG2  MET  46           HG2      MET  46  25.503   1.830  -1.414
    6    HG3  MET  46           HG3      MET  46  24.751   2.755  -0.121
    7    HE1  MET  46           HE1      MET  46  27.281   0.391  -1.267
    8    HE3  MET  46           HE2      MET  46  27.516  -0.380   0.299
    9    HE2  MET  46           HE3      MET  46  28.762   0.688  -0.344

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ALA  47           H        ALA  47  21.924  -0.422   1.333
    2    HA   ALA  47           HA       ALA  47  21.918  -3.137   0.537
    3    HB2  ALA  47           HB1      ALA  47  21.527  -2.677   2.840
    4    HB3  ALA  47           HB2      ALA  47  20.002  -3.308   2.220
    5    HB1  ALA  47           HB3      ALA  47  20.202  -1.573   2.474

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU  48           H        LEU  48  19.522  -0.551   0.170
    2    HA   LEU  48           HA       LEU  48  17.505  -2.122  -1.080
    3    HB2  LEU  48           HB2      LEU  48  18.110   0.842  -1.202
    4    HB3  LEU  48           HB3      LEU  48  16.652   0.106  -1.869
    5    HG   LEU  48           HG       LEU  48  17.506  -0.174   1.022
    6   HD13  LEU  48          HD11      LEU  48  17.050   2.119   0.828
    7   HD12  LEU  48          HD12      LEU  48  15.502   1.447   1.337
    8   HD11  LEU  48          HD13      LEU  48  15.768   1.869  -0.355
    9   HD22  LEU  48          HD21      LEU  48  16.007  -1.915   0.644
   10   HD21  LEU  48          HD22      LEU  48  15.120  -1.030  -0.599
   11   HD23  LEU  48          HD23      LEU  48  14.898  -0.625   1.103

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ASN  49           H        ASN  49  20.162  -0.153  -2.312
    2    HA   ASN  49           HA       ASN  49  19.517  -0.255  -5.037
    3    HB2  ASN  49           HB2      ASN  49  21.172   1.289  -4.105
    4    HB3  ASN  49           HB3      ASN  49  22.225  -0.058  -3.688
    5   HD21  ASN  49          HD21      ASN  49  23.962   0.497  -5.082
    6   HD22  ASN  49          HD22      ASN  49  23.823   0.515  -6.773

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLU  50           H        GLU  50  21.534  -2.411  -3.066
    2    HA   GLU  50           HA       GLU  50  22.267  -4.161  -5.186
    3    HB2  GLU  50           HB2      GLU  50  23.462  -4.110  -3.018
    4    HB3  GLU  50           HB3      GLU  50  22.028  -4.759  -2.222
    5    HG2  GLU  50           HG2      GLU  50  22.153  -6.794  -3.575
    6    HG3  GLU  50           HG3      GLU  50  23.519  -6.142  -4.476

  No H/Q in entry =           6
  In of MODEL    5
    1    H    ALA  51           H        ALA  51  19.607  -4.132  -2.863
    2    HA   ALA  51           HA       ALA  51  18.483  -6.626  -3.614
    3    HB3  ALA  51           HB1      ALA  51  16.880  -6.142  -2.062
    4    HB1  ALA  51           HB2      ALA  51  16.641  -4.501  -2.666
    5    HB2  ALA  51           HB3      ALA  51  18.005  -4.862  -1.607

  No H/Q in entry =           5
  In of MODEL    5
    1    H    HIS  52           H        HIS  52  17.843  -3.291  -4.660
    2    HA   HIS  52           HA       HIS  52  15.741  -3.858  -6.460
    3    HB2  HIS  52           HB2      HIS  52  16.303  -1.581  -5.690
    4    HB3  HIS  52           HB3      HIS  52  17.812  -1.653  -6.600
    5    HD1  HIS  52           HD1      HIS  52  17.539  -1.948  -9.269
    6    HD2  HIS  52           HD2      HIS  52  14.089  -0.838  -7.211
    7    HE1  HIS  52           HE1      HIS  52  15.919  -1.072 -11.007
    8    HE2  HIS  52           HE2      HIS  52  13.810  -0.390  -9.768

  No H/Q in entry =           8
  In of MODEL    5
    1    H    LEU  53           H        LEU  53  19.259  -3.807  -6.889
    2    HA   LEU  53           HA       LEU  53  19.325  -4.131  -9.688
    3    HB2  LEU  53           HB2      LEU  53  21.267  -4.853  -7.510
    4    HB3  LEU  53           HB3      LEU  53  21.592  -5.241  -9.197
    5    HG   LEU  53           HG       LEU  53  20.875  -2.438  -8.279
    6   HD13  LEU  53          HD11      LEU  53  22.906  -2.910  -7.133
    7   HD12  LEU  53          HD12      LEU  53  23.393  -2.058  -8.598
    8   HD11  LEU  53          HD13      LEU  53  23.557  -3.807  -8.502
    9   HD22  LEU  53          HD21      LEU  53  20.621  -2.498 -10.619
   10   HD21  LEU  53          HD22      LEU  53  21.906  -3.683 -10.821
   11   HD23  LEU  53          HD23      LEU  53  22.305  -2.013 -10.469

  No H/Q in entry =          11
  In of MODEL    5
    1    H    VAL  54           H        VAL  54  19.249  -6.510  -7.055
    2    HA   VAL  54           HA       VAL  54  19.412  -8.808  -8.707
    3    HB   VAL  54           HB       VAL  54  18.248  -8.395  -5.942
    4   HG12  VAL  54          HG11      VAL  54  18.616 -11.006  -5.929
    5   HG11  VAL  54          HG12      VAL  54  18.430 -10.847  -7.676
    6   HG13  VAL  54          HG13      VAL  54  17.132 -10.334  -6.600
    7   HG22  VAL  54          HG21      VAL  54  20.560  -8.144  -5.718
    8   HG21  VAL  54          HG22      VAL  54  20.917  -9.235  -7.055
    9   HG23  VAL  54          HG23      VAL  54  20.396  -9.886  -5.501

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLN  55           H        GLN  55  16.651  -6.947  -7.433
    2    HA   GLN  55           HA       GLN  55  14.660  -8.649  -8.504
    3    HB2  GLN  55           HB2      GLN  55  13.884  -7.131  -6.883
    4    HB3  GLN  55           HB3      GLN  55  14.654  -5.752  -7.663
    5    HG2  GLN  55           HG2      GLN  55  12.926  -5.462  -9.155
    6    HG3  GLN  55           HG3      GLN  55  12.634  -7.188  -9.320
    7   HE21  GLN  55          HE21      GLN  55  10.636  -7.769  -8.515
    8   HE22  GLN  55          HE22      GLN  55   9.848  -7.024  -7.210

  No H/Q in entry =           8
  In of MODEL    5
    1    H    THR  56           H        THR  56  16.352  -5.824  -9.871
    2    HA   THR  56           HA       THR  56  14.910  -5.495 -12.222
    3    HB   THR  56           HB       THR  56  17.927  -5.354 -12.055
    4    HG1  THR  56           HG1      THR  56  16.024  -3.357 -11.411
    5   HG22  THR  56          HG21      THR  56  16.140  -3.493 -13.581
    6   HG21  THR  56          HG22      THR  56  16.503  -5.082 -14.254
    7   HG23  THR  56          HG23      THR  56  17.813  -3.953 -13.905

  No H/Q in entry =           7
  In of MODEL    5
    1    H    LYS  57           H        LYS  57  17.599  -7.744 -11.600
    2    HA   LYS  57           HA       LYS  57  17.623  -8.947 -14.174
    3    HB2  LYS  57           HB2      LYS  57  19.422  -9.168 -12.445
    4    HB3  LYS  57           HB3      LYS  57  18.334 -10.156 -11.480
    5    HG2  LYS  57           HG2      LYS  57  18.236 -11.837 -13.250
    6    HG3  LYS  57           HG3      LYS  57  19.251 -10.843 -14.288
    7    HD2  LYS  57           HD2      LYS  57  21.083 -11.001 -12.615
    8    HD3  LYS  57           HD3      LYS  57  20.074 -12.058 -11.629
    9    HE2  LYS  57           HE2      LYS  57  20.932 -12.640 -14.487
   10    HE3  LYS  57           HE3      LYS  57  21.657 -13.366 -13.053
   11    HZ2  LYS  57           HZ1      LYS  57  19.345 -14.153 -14.425
   12    HZ1  LYS  57           HZ2      LYS  57  18.897 -13.675 -12.860
   13    HZ3  LYS  57           HZ3      LYS  57  20.073 -14.880 -13.077

  No H/Q in entry =          13
  In of MODEL    5
    1    H    LEU  58           H        LEU  58  15.852  -9.635 -11.198
    2    HA   LEU  58           HA       LEU  58  14.673 -12.033 -12.125
    3    HB2  LEU  58           HB2      LEU  58  13.843 -10.134  -9.937
    4    HB3  LEU  58           HB3      LEU  58  13.064 -11.687 -10.249
    5    HG   LEU  58           HG       LEU  58  16.031 -11.355  -9.693
    6   HD11  LEU  58          HD11      LEU  58  13.666 -11.808  -7.900
    7   HD13  LEU  58          HD12      LEU  58  15.102 -10.818  -7.640
    8   HD12  LEU  58          HD13      LEU  58  15.205 -12.572  -7.499
    9   HD22  LEU  58          HD21      LEU  58  15.951 -13.422 -10.713
   10   HD21  LEU  58          HD22      LEU  58  14.241 -13.660 -10.353
   11   HD23  LEU  58          HD23      LEU  58  15.453 -13.935  -9.102

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  59           H        ILE  59  13.943  -8.711 -12.820
    2    HA   ILE  59           HA       ILE  59  11.240  -9.411 -13.760
    3    HB   ILE  59           HB       ILE  59  12.005  -7.110 -12.563
    4   HG12  ILE  59          HG12      ILE  59  10.095  -7.030 -14.909
    5   HG13  ILE  59          HG13      ILE  59   9.691  -7.804 -13.399
    6   HG22  ILE  59          HG21      ILE  59  12.065  -6.300 -15.455
    7   HG21  ILE  59          HG22      ILE  59  13.551  -6.704 -14.626
    8   HG23  ILE  59          HG23      ILE  59  12.550  -5.371 -14.057
    9   HD12  ILE  59          HD11      ILE  59  10.391  -4.903 -13.817
   10   HD11  ILE  59          HD12      ILE  59  10.257  -5.641 -12.221
   11   HD13  ILE  59          HD13      ILE  59   8.844  -5.556 -13.275

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLU  60           H        GLU  60  14.430  -8.507 -15.019
    2    HA   GLU  60           HA       GLU  60  13.645  -8.130 -17.729
    3    HB2  GLU  60           HB2      GLU  60  15.813  -7.363 -16.855
    4    HB3  GLU  60           HB3      GLU  60  16.306  -9.034 -16.590
    5    HG2  GLU  60           HG2      GLU  60  16.113  -9.483 -19.009
    6    HG3  GLU  60           HG3      GLU  60  15.607  -7.816 -19.281

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLY  61           H        GLY  61  14.672 -10.987 -15.903
    2    HA3  GLY  61           HA2      GLY  61  14.163 -12.653 -18.299
    3    HA2  GLY  61           HA3      GLY  61  15.202 -13.111 -16.954

  No H/Q in entry =           3
  In of MODEL    5
    1    H    ASP  62           H        ASP  62  12.053 -11.620 -16.594
    2    HA   ASP  62           HA       ASP  62  11.166 -13.639 -14.794
    3    HB2  ASP  62           HB2      ASP  62   9.056 -12.366 -14.803
    4    HB3  ASP  62           HB3      ASP  62  10.455 -11.321 -14.568

  No H/Q in entry =           4
  In of MODEL    5
    1    H    ALA  63           H        ALA  63  11.798 -15.020 -17.150
    2    HA   ALA  63           HA       ALA  63   9.592 -15.487 -18.886
    3    HB2  ALA  63           HB1      ALA  63  11.997 -16.185 -19.267
    4    HB1  ALA  63           HB2      ALA  63  10.799 -17.431 -19.616
    5    HB3  ALA  63           HB3      ALA  63  11.725 -17.494 -18.116

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLY  64           H        GLY  64  10.649 -17.003 -15.878
    2    HA3  GLY  64           HA2      GLY  64   9.616 -18.424 -14.405
    3    HA2  GLY  64           HA3      GLY  64   8.111 -17.691 -14.943

  No H/Q in entry =           3
  In of MODEL    5
    1    H    GLU  65           H        GLU  65   6.744 -19.374 -15.270
    2    HA   GLU  65           HA       GLU  65   7.570 -21.941 -16.101
    3    HB2  GLU  65           HB2      GLU  65   4.850 -20.639 -16.102
    4    HB3  GLU  65           HB3      GLU  65   5.125 -22.339 -16.485
    5    HG2  GLU  65           HG2      GLU  65   6.139 -22.706 -14.293
    6    HG3  GLU  65           HG3      GLU  65   5.973 -20.994 -13.903

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLY  66           H        GLY  66   5.913 -22.820 -17.962
    2    HA3  GLY  66           HA2      GLY  66   7.185 -22.274 -20.409
    3    HA2  GLY  66           HA3      GLY  66   5.728 -23.223 -20.193

  No H/Q in entry =           3
  In of MODEL    5
    1    H    LYS  67           H        LYS  67   4.163 -21.104 -19.073
    2    HA   LYS  67           HA       LYS  67   3.243 -19.914 -21.504
    3    HB2  LYS  67           HB2      LYS  67   2.302 -19.727 -18.646
    4    HB3  LYS  67           HB3      LYS  67   1.475 -18.952 -20.003
    5    HG2  LYS  67           HG2      LYS  67   1.280 -21.136 -21.138
    6    HG3  LYS  67           HG3      LYS  67   2.099 -21.914 -19.786
    7    HD2  LYS  67           HD2      LYS  67   0.278 -21.210 -18.275
    8    HD3  LYS  67           HD3      LYS  67  -0.547 -20.441 -19.634
    9    HE2  LYS  67           HE2      LYS  67  -0.686 -22.615 -20.790
   10    HE3  LYS  67           HE3      LYS  67   0.146 -23.388 -19.442
   11    HZ3  LYS  67           HZ1      LYS  67  -1.655 -22.784 -17.989
   12    HZ2  LYS  67           HZ2      LYS  67  -2.274 -23.631 -19.324
   13    HZ1  LYS  67           HZ3      LYS  67  -2.438 -21.942 -19.235

  No H/Q in entry =          13
  In of MODEL    5
    1    H    MET  68           H        MET  68   2.823 -17.762 -21.925
    2    HA   MET  68           HA       MET  68   4.926 -16.005 -21.830
    3    HB2  MET  68           HB2      MET  68   1.976 -15.420 -22.100
    4    HB3  MET  68           HB3      MET  68   3.260 -14.266 -22.463
    5    HG2  MET  68           HG2      MET  68   2.983 -16.991 -23.760
    6    HG3  MET  68           HG3      MET  68   2.465 -15.474 -24.494
    7    HE1  MET  68           HE1      MET  68   3.668 -13.566 -24.630
    8    HE3  MET  68           HE2      MET  68   5.181 -13.550 -25.533
    9    HE2  MET  68           HE3      MET  68   5.207 -13.349 -23.783

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LYS  69           H        LYS  69   3.091 -16.786 -19.111
    2    HA   LYS  69           HA       LYS  69   2.890 -14.234 -17.881
    3    HB2  LYS  69           HB2      LYS  69   2.722 -17.034 -16.776
    4    HB3  LYS  69           HB3      LYS  69   2.454 -15.591 -15.794
    5    HG2  LYS  69           HG2      LYS  69   0.673 -14.857 -17.312
    6    HG3  LYS  69           HG3      LYS  69   0.957 -16.257 -18.345
    7    HD2  LYS  69           HD2      LYS  69   0.380 -17.746 -16.438
    8    HD3  LYS  69           HD3      LYS  69   0.017 -16.322 -15.463
    9    HE2  LYS  69           HE2      LYS  69  -1.329 -16.956 -18.103
   10    HE3  LYS  69           HE3      LYS  69  -2.016 -17.344 -16.527
   11    HZ1  LYS  69           HZ1      LYS  69  -1.752 -14.925 -15.991
   12    HZ3  LYS  69           HZ2      LYS  69  -2.923 -15.286 -17.166
   13    HZ2  LYS  69           HZ3      LYS  69  -1.413 -14.662 -17.631

  No H/Q in entry =          13
  In of MODEL    5
    1    H    VAL  70           H        VAL  70   3.770 -14.409 -15.304
    2    HA   VAL  70           HA       VAL  70   6.717 -14.643 -15.474
    3    HB   VAL  70           HB       VAL  70   6.880 -12.564 -14.136
    4   HG11  VAL  70          HG11      VAL  70   7.042 -12.484 -16.607
    5   HG13  VAL  70          HG12      VAL  70   6.308 -11.014 -15.965
    6   HG12  VAL  70          HG13      VAL  70   5.298 -12.254 -16.708
    7   HG21  VAL  70          HG21      VAL  70   3.865 -12.559 -14.519
    8   HG23  VAL  70          HG22      VAL  70   4.775 -11.120 -14.067
    9   HG22  VAL  70          HG23      VAL  70   4.750 -12.519 -12.994

  No H/Q in entry =           9
  In of MODEL    5
    1    H    SER  71           H        SER  71   7.725 -14.685 -13.290
    2    HA   SER  71           HA       SER  71   6.626 -16.693 -11.632
    3    HB2  SER  71           HB2      SER  71   9.052 -16.149 -11.756
    4    HB3  SER  71           HB3      SER  71   8.730 -14.630 -10.922
    5    HG   SER  71           HG       SER  71   7.620 -16.186  -9.353

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU  72           H        LEU  72   5.253 -16.594  -9.958
    2    HA   LEU  72           HA       LEU  72   3.662 -14.307  -9.523
    3    HB2  LEU  72           HB2      LEU  72   3.975 -16.925  -8.092
    4    HB3  LEU  72           HB3      LEU  72   2.925 -15.663  -7.451
    5    HG   LEU  72           HG       LEU  72   2.716 -16.678 -10.304
    6   HD11  LEU  72          HD11      LEU  72   1.362 -17.618  -7.768
    7   HD13  LEU  72          HD12      LEU  72   2.233 -18.586  -8.956
    8   HD12  LEU  72          HD13      LEU  72   0.665 -17.890  -9.365
    9   HD22  LEU  72          HD21      LEU  72   1.533 -14.663 -10.229
   10   HD21  LEU  72          HD22      LEU  72   1.094 -14.850  -8.539
   11   HD23  LEU  72          HD23      LEU  72   0.275 -15.803  -9.773

  No H/Q in entry =          11
  In of MODEL    5
    1    H    VAL  73           H        VAL  73   6.341 -15.691  -7.742
    2    HA   VAL  73           HA       VAL  73   6.249 -14.152  -5.414
    3    HB   VAL  73           HB       VAL  73   8.444 -14.922  -4.980
    4   HG13  VAL  73          HG11      VAL  73   8.261 -17.295  -5.458
    5   HG12  VAL  73          HG12      VAL  73   7.160 -16.979  -6.800
    6   HG11  VAL  73          HG13      VAL  73   6.646 -16.664  -5.143
    7   HG23  VAL  73          HG21      VAL  73   9.645 -16.079  -7.031
    8   HG22  VAL  73          HG22      VAL  73   9.775 -14.337  -6.797
    9   HG21  VAL  73          HG23      VAL  73   8.634 -14.985  -7.974

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LEU  74           H        LEU  74   7.228 -13.250  -8.591
    2    HA   LEU  74           HA       LEU  74   9.138 -11.266  -8.101
    3    HB2  LEU  74           HB2      LEU  74   8.707 -12.023 -10.338
    4    HB3  LEU  74           HB3      LEU  74   7.026 -11.501 -10.243
    5    HG   LEU  74           HG       LEU  74   7.762  -9.153 -10.038
    6   HD13  LEU  74          HD11      LEU  74   9.874  -9.282  -8.962
    7   HD12  LEU  74          HD12      LEU  74  10.256  -8.782 -10.609
    8   HD11  LEU  74          HD13      LEU  74  10.485 -10.460 -10.121
    9   HD22  LEU  74          HD21      LEU  74   8.109  -8.920 -12.294
   10   HD21  LEU  74          HD22      LEU  74   7.578 -10.585 -12.234
   11   HD23  LEU  74          HD23      LEU  74   9.286 -10.230 -12.356

  No H/Q in entry =          11
  In of MODEL    5
    1    H    VAL  75           H        VAL  75   5.636 -10.944  -8.462
    2    HA   VAL  75           HA       VAL  75   5.490  -8.188  -7.884
    3    HB   VAL  75           HB       VAL  75   3.437 -10.366  -7.492
    4   HG11  VAL  75          HG11      VAL  75   3.194  -7.329  -7.352
    5   HG13  VAL  75          HG12      VAL  75   2.914  -8.462  -6.038
    6   HG12  VAL  75          HG13      VAL  75   1.828  -8.438  -7.418
    7   HG23  VAL  75          HG21      VAL  75   3.700  -8.212  -9.612
    8   HG22  VAL  75          HG22      VAL  75   2.569  -9.564  -9.606
    9   HG21  VAL  75          HG23      VAL  75   4.295  -9.858  -9.825

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLU  76           H        GLU  76   5.283 -11.063  -5.766
    2    HA   GLU  76           HA       GLU  76   4.783  -9.704  -3.350
    3    HB2  GLU  76           HB2      GLU  76   4.675 -12.190  -3.625
    4    HB3  GLU  76           HB3      GLU  76   6.423 -12.229  -3.770
    5    HG2  GLU  76           HG2      GLU  76   6.665 -11.351  -1.488
    6    HG3  GLU  76           HG3      GLU  76   4.923 -11.240  -1.313

  No H/Q in entry =           6
  In of MODEL    5
    1    H    ALA  77           H        ALA  77   7.862 -10.561  -4.903
    2    HA   ALA  77           HA       ALA  77   9.528  -9.482  -2.886
    3    HB1  ALA  77           HB1      ALA  77  10.515 -10.962  -4.472
    4    HB2  ALA  77           HB2      ALA  77  11.241  -9.381  -4.761
    5    HB3  ALA  77           HB3      ALA  77   9.973  -9.979  -5.833

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLN  78           H        GLN  78   8.118  -8.098  -5.808
    2    HA   GLN  78           HA       GLN  78   9.427  -5.595  -5.707
    3    HB2  GLN  78           HB2      GLN  78   8.155  -6.535  -7.667
    4    HB3  GLN  78           HB3      GLN  78   6.662  -6.187  -6.796
    5    HG2  GLN  78           HG2      GLN  78   7.268  -3.803  -6.701
    6    HG3  GLN  78           HG3      GLN  78   8.762  -4.144  -7.573
    7   HE21  GLN  78          HE21      GLN  78   6.837  -2.358  -8.684
    8   HE22  GLN  78          HE22      GLN  78   6.147  -3.087 -10.053

  No H/Q in entry =           8
  In of MODEL    5
    1    H    LEU  79           H        LEU  79   6.424  -6.781  -4.282
    2    HA   LEU  79           HA       LEU  79   5.386  -4.388  -3.283
    3    HB2  LEU  79           HB2      LEU  79   4.107  -6.462  -3.225
    4    HB3  LEU  79           HB3      LEU  79   5.261  -7.178  -2.104
    5    HG   LEU  79           HG       LEU  79   4.675  -5.541  -0.384
    6   HD13  LEU  79          HD11      LEU  79   4.179  -3.537  -1.442
    7   HD12  LEU  79          HD12      LEU  79   2.561  -4.089  -1.006
    8   HD11  LEU  79          HD13      LEU  79   3.151  -4.307  -2.652
    9   HD23  LEU  79          HD21      LEU  79   2.097  -6.077  -0.300
   10   HD22  LEU  79          HD22      LEU  79   3.259  -7.396  -0.184
   11   HD21  LEU  79          HD23      LEU  79   2.445  -7.077  -1.712

  No H/Q in entry =          11
  In of MODEL    5
    1    H    HIS  80           H        HIS  80   7.603  -6.681  -1.686
    2    HA   HIS  80           HA       HIS  80   7.857  -5.128   0.679
    3    HB2  HIS  80           HB2      HIS  80   9.239  -7.472  -0.509
    4    HB3  HIS  80           HB3      HIS  80  10.130  -6.557   0.708
    5    HD1  HIS  80           HD1      HIS  80   9.643  -7.194   3.052
    6    HD2  HIS  80           HD2      HIS  80   6.449  -8.106   0.531
    7    HE1  HIS  80           HE1      HIS  80   7.885  -8.323   4.497
    8    HE2  HIS  80           HE2      HIS  80   5.932  -8.882   2.970

  No H/Q in entry =           8
  In of MODEL    5
    1    H    LEU  81           H        LEU  81   9.877  -5.379  -2.226
    2    HA   LEU  81           HA       LEU  81  11.889  -3.601  -1.346
    3    HB2  LEU  81           HB2      LEU  81  10.991  -4.417  -4.109
    4    HB3  LEU  81           HB3      LEU  81  12.393  -3.387  -3.817
    5    HG   LEU  81           HG       LEU  81  12.041  -6.110  -2.537
    6   HD12  LEU  81          HD11      LEU  81  13.873  -6.712  -4.278
    7   HD11  LEU  81          HD12      LEU  81  13.287  -5.300  -5.156
    8   HD13  LEU  81          HD13      LEU  81  12.196  -6.641  -4.818
    9   HD23  LEU  81          HD21      LEU  81  14.663  -5.752  -2.515
   10   HD22  LEU  81          HD22      LEU  81  13.665  -5.004  -1.270
   11   HD21  LEU  81          HD23      LEU  81  14.232  -4.047  -2.638

  No H/Q in entry =          11
  In of MODEL    5
    1    H    MET  82           H        MET  82   8.963  -3.018  -3.294
    2    HA   MET  82           HA       MET  82   9.461  -0.285  -3.801
    3    HB2  MET  82           HB2      MET  82   6.927  -1.920  -3.681
    4    HB3  MET  82           HB3      MET  82   6.900  -0.197  -4.050
    5    HG2  MET  82           HG2      MET  82   8.539  -2.249  -5.574
    6    HG3  MET  82           HG3      MET  82   6.964  -1.653  -6.093
    7    HE3  MET  82           HE1      MET  82   7.361   1.805  -7.274
    8    HE2  MET  82           HE2      MET  82   6.984   1.578  -5.568
    9    HE1  MET  82           HE3      MET  82   6.341   0.454  -6.762

  No H/Q in entry =           9
  In of MODEL    5
    1    H    THR  83           H        THR  83   7.685  -1.905  -1.198
    2    HA   THR  83           HA       THR  83   6.792   0.434   0.118
    3    HB   THR  83           HB       THR  83   6.675  -1.137   2.140
    4    HG1  THR  83           HG1      THR  83   7.464  -3.076   1.919
    5   HG22  THR  83          HG21      THR  83   5.052  -2.733   0.671
    6   HG21  THR  83          HG22      THR  83   5.262  -1.404  -0.464
    7   HG23  THR  83          HG23      THR  83   4.611  -1.095   1.146

  No H/Q in entry =           7
  In of MODEL    5
    1    H    SER  84           H        SER  84   9.646  -1.618   0.656
    2    HA   SER  84           HA       SER  84  10.675  -0.165   2.843
    3    HB2  SER  84           HB2      SER  84  11.965  -1.993   0.828
    4    HB3  SER  84           HB3      SER  84  12.895  -1.222   2.111
    5    HG   SER  84           HG       SER  84  10.646  -2.946   2.367

  No H/Q in entry =           5
  In of MODEL    5
    1    H    MET  85           H        MET  85  11.437   0.098  -0.643
    2    HA   MET  85           HA       MET  85  13.404   2.094  -0.390
    3    HB2  MET  85           HB2      MET  85  13.039   0.803  -2.453
    4    HB3  MET  85           HB3      MET  85  11.496   1.626  -2.690
    5    HG2  MET  85           HG2      MET  85  12.642   3.789  -2.838
    6    HG3  MET  85           HG3      MET  85  14.189   3.008  -2.528
    7    HE1  MET  85           HE1      MET  85  11.139   3.314  -4.541
    8    HE3  MET  85           HE2      MET  85  11.190   1.644  -5.096
    9    HE2  MET  85           HE3      MET  85  11.559   2.945  -6.220

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LEU  86           H        LEU  86   9.911   2.374  -0.913
    2    HA   LEU  86           HA       LEU  86   9.805   5.185  -1.103
    3    HB2  LEU  86           HB2      LEU  86   7.988   3.496  -1.681
    4    HB3  LEU  86           HB3      LEU  86   7.654   3.406   0.048
    5    HG   LEU  86           HG       LEU  86   7.454   5.964  -0.012
    6   HD11  LEU  86          HD11      LEU  86   8.246   5.532  -2.710
    7   HD13  LEU  86          HD12      LEU  86   7.784   7.055  -1.955
    8   HD12  LEU  86          HD13      LEU  86   6.566   6.071  -2.762
    9   HD23  LEU  86          HD21      LEU  86   5.347   4.574  -1.678
   10   HD22  LEU  86          HD22      LEU  86   5.133   5.835  -0.467
   11   HD21  LEU  86          HD23      LEU  86   5.556   4.198   0.033

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ALA  87           H        ALA  87   9.362   3.008   1.648
    2    HA   ALA  87           HA       ALA  87   8.778   4.919   3.610
    3    HB1  ALA  87           HB1      ALA  87   9.627   2.111   3.535
    4    HB3  ALA  87           HB2      ALA  87   8.486   2.909   4.614
    5    HB2  ALA  87           HB3      ALA  87  10.213   2.968   4.964

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ARG  88           H        ARG  88  11.885   3.538   2.644
    2    HA   ARG  88           HA       ARG  88  13.468   4.945   4.478
    3    HB2  ARG  88           HB2      ARG  88  14.170   2.978   3.083
    4    HB3  ARG  88           HB3      ARG  88  14.311   4.069   1.707
    5    HG2  ARG  88           HG2      ARG  88  15.758   5.411   3.655
    6    HG3  ARG  88           HG3      ARG  88  16.102   3.727   4.040
    7    HD2  ARG  88           HD2      ARG  88  17.380   3.444   2.198
    8    HD3  ARG  88           HD3      ARG  88  16.234   4.296   1.159
    9    HE   ARG  88           HE       ARG  88  18.609   5.398   2.211
   10   HH21  ARG  88          HH11      ARG  88  18.922   7.621   2.011
   11   HH22  ARG  88          HH12      ARG  88  17.555   8.672   1.860
   12   HH11  ARG  88          HH21      ARG  88  15.260   6.100   1.919
   13   HH12  ARG  88          HH22      ARG  88  15.481   7.808   1.784

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLU  89           H        GLU  89  12.493   5.819   1.149
    2    HA   GLU  89           HA       GLU  89  14.005   8.202   0.991
    3    HB2  GLU  89           HB2      GLU  89  12.883   7.138  -0.958
    4    HB3  GLU  89           HB3      GLU  89  11.328   7.658  -0.307
    5    HG2  GLU  89           HG2      GLU  89  11.995  10.005  -0.474
    6    HG3  GLU  89           HG3      GLU  89  13.608   9.537  -1.004

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LEU  90           H        LEU  90  10.679   7.646   2.111
    2    HA   LEU  90           HA       LEU  90  10.121  10.372   2.676
    3    HB2  LEU  90           HB2      LEU  90   8.962   7.784   3.707
    4    HB3  LEU  90           HB3      LEU  90   8.306   9.371   4.123
    5    HG   LEU  90           HG       LEU  90   8.747   8.489   1.258
    6   HD12  LEU  90          HD11      LEU  90   6.218   8.123   1.313
    7   HD11  LEU  90          HD12      LEU  90   6.367   8.120   3.071
    8   HD13  LEU  90          HD13      LEU  90   7.207   6.900   2.112
    9   HD22  LEU  90          HD21      LEU  90   8.419  10.793   1.177
   10   HD21  LEU  90          HD22      LEU  90   7.427  10.814   2.634
   11   HD23  LEU  90          HD23      LEU  90   6.743  10.245   1.112

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  91           H        ILE  91  11.418   7.716   4.611
    2    HA   ILE  91           HA       ILE  91  11.530   9.090   7.075
    3    HB   ILE  91           HB       ILE  91  13.122   6.772   5.963
    4   HG12  ILE  91          HG12      ILE  91  11.096   6.915   8.216
    5   HG13  ILE  91          HG13      ILE  91  10.636   6.622   6.540
    6   HG22  ILE  91          HG21      ILE  91  13.587   6.572   8.606
    7   HG21  ILE  91          HG22      ILE  91  13.485   8.329   8.500
    8   HG23  ILE  91          HG23      ILE  91  14.680   7.457   7.542
    9   HD13  ILE  91          HD11      ILE  91  11.670   4.536   6.479
   10   HD12  ILE  91          HD12      ILE  91  11.070   4.590   8.136
   11   HD11  ILE  91          HD13      ILE  91  12.768   4.927   7.803

  No H/Q in entry =          11
  In of MODEL    5
    1    H    THR  92           H        THR  92  13.758   8.946   4.331
    2    HA   THR  92           HA       THR  92  15.899  10.375   5.493
    3    HB   THR  92           HB       THR  92  14.924  10.227   2.630
    4    HG1  THR  92           HG1      THR  92  15.782   8.344   3.043
    5   HG22  THR  92          HG21      THR  92  17.484  10.955   2.343
    6   HG21  THR  92          HG22      THR  92  17.158  11.776   3.869
    7   HG23  THR  92          HG23      THR  92  16.187  12.144   2.444

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLU  93           H        GLU  93  13.000  11.480   3.752
    2    HA   GLU  93           HA       GLU  93  13.553  14.250   3.860
    3    HB2  GLU  93           HB2      GLU  93  10.869  12.836   3.870
    4    HB3  GLU  93           HB3      GLU  93  11.133  14.539   3.494
    5    HG2  GLU  93           HG2      GLU  93  12.509  12.313   1.977
    6    HG3  GLU  93           HG3      GLU  93  10.954  12.971   1.483

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LEU  94           H        LEU  94  11.836  12.074   6.072
    2    HA   LEU  94           HA       LEU  94  10.991  14.013   7.940
    3    HB2  LEU  94           HB2      LEU  94  11.611  11.068   8.225
    4    HB3  LEU  94           HB3      LEU  94  11.020  12.038   9.570
    5    HG   LEU  94           HG       LEU  94   9.544  12.060   6.937
    6   HD11  LEU  94          HD11      LEU  94   9.654   9.846   8.948
    7   HD13  LEU  94          HD12      LEU  94   9.358   9.776   7.212
    8   HD12  LEU  94          HD13      LEU  94   8.069  10.276   8.305
    9   HD23  LEU  94          HD21      LEU  94   7.613  12.435   8.530
   10   HD22  LEU  94          HD22      LEU  94   8.833  13.708   8.567
   11   HD21  LEU  94          HD23      LEU  94   8.785  12.494   9.845

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  95           H        ILE  95  13.994  12.128   7.718
    2    HA   ILE  95           HA       ILE  95  15.141  13.074  10.133
    3    HB   ILE  95           HB       ILE  95  16.403  12.017   7.591
    4   HG12  ILE  95          HG12      ILE  95  16.117  10.819  10.361
    5   HG13  ILE  95          HG13      ILE  95  14.958  10.540   9.063
    6   HG21  ILE  95          HG21      ILE  95  17.638  12.850  10.235
    7   HG23  ILE  95          HG22      ILE  95  18.098  13.380   8.616
    8   HG22  ILE  95          HG23      ILE  95  18.427  11.726   9.130
    9   HD13  ILE  95          HD11      ILE  95  16.461   9.280   7.809
   10   HD12  ILE  95          HD12      ILE  95  16.936   8.843   9.447
   11   HD11  ILE  95          HD13      ILE  95  17.874  10.034   8.547

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLU  96           H        GLU  96  15.287  14.300   6.795
    2    HA   GLU  96           HA       GLU  96  17.100  16.408   7.272
    3    HB2  GLU  96           HB2      GLU  96  16.453  15.729   5.012
    4    HB3  GLU  96           HB3      GLU  96  14.800  16.262   5.306
    5    HG2  GLU  96           HG2      GLU  96  15.336  18.398   4.760
    6    HG3  GLU  96           HG3      GLU  96  16.631  18.422   5.946

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LEU  97           H        LEU  97  13.591  16.169   7.691
    2    HA   LEU  97           HA       LEU  97  13.132  18.898   8.324
    3    HB2  LEU  97           HB2      LEU  97  11.650  16.352   8.941
    4    HB3  LEU  97           HB3      LEU  97  11.112  17.893   9.607
    5    HG   LEU  97           HG       LEU  97  11.610  17.476   6.644
    6   HD12  LEU  97          HD11      LEU  97   9.089  17.310   6.520
    7   HD11  LEU  97          HD12      LEU  97   9.080  17.115   8.270
    8   HD13  LEU  97          HD13      LEU  97   9.882  15.916   7.254
    9   HD23  LEU  97          HD21      LEU  97   9.842  19.414   6.666
   10   HD22  LEU  97          HD22      LEU  97  11.517  19.799   7.063
   11   HD21  LEU  97          HD23      LEU  97  10.327  19.615   8.350

  No H/Q in entry =          11
  In of MODEL    5
    1    H    HIS  98           H        HIS  98  13.990  16.090  10.330
    2    HA   HIS  98           HA       HIS  98  13.806  17.355  12.842
    3    HB2  HIS  98           HB2      HIS  98  15.592  15.122  11.852
    4    HB3  HIS  98           HB3      HIS  98  15.578  15.665  13.531
    5    HD1  HIS  98           HD1      HIS  98  13.411  13.995  10.938
    6    HD2  HIS  98           HD2      HIS  98  13.278  14.925  14.999
    7    HE1  HIS  98           HE1      HIS  98  11.401  12.773  11.888
    8    HE2  HIS  98           HE2      HIS  98  11.301  13.331  14.357

  No H/Q in entry =           8
  In of MODEL    5
    1    H    GLU  99           H        GLU  99  16.368  17.272  10.415
    2    HA   GLU  99           HA       GLU  99  18.329  18.637  11.946
    3    HB2  GLU  99           HB2      GLU  99  18.833  17.351   9.881
    4    HB3  GLU  99           HB3      GLU  99  18.008  18.591   8.935
    5    HG2  GLU  99           HG2      GLU  99  19.589  20.287   9.725
    6    HG3  GLU  99           HG3      GLU  99  20.383  19.099  10.754

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LYS 100           H        LYS 100  15.795  19.756   9.719
    2    HA   LYS 100           HA       LYS 100  16.552  22.505   9.858
    3    HB2  LYS 100           HB2      LYS 100  13.940  21.175   9.100
    4    HB3  LYS 100           HB3      LYS 100  14.214  22.918   9.005
    5    HG2  LYS 100           HG2      LYS 100  16.197  22.494   7.545
    6    HG3  LYS 100           HG3      LYS 100  15.808  20.771   7.566
    7    HD2  LYS 100           HD2      LYS 100  13.609  21.246   6.559
    8    HD3  LYS 100           HD3      LYS 100  13.980  22.971   6.545
    9    HE2  LYS 100           HE2      LYS 100  15.950  22.515   5.091
   10    HE3  LYS 100           HE3      LYS 100  15.510  20.803   5.062
   11    HZ1  LYS 100           HZ1      LYS 100  13.656  22.967   4.216
   12    HZ3  LYS 100           HZ2      LYS 100  13.496  21.294   3.958
   13    HZ2  LYS 100           HZ3      LYS 100  14.697  22.172   3.137

  No H/Q in entry =          13
  In of MODEL    5
    1    H    LEU 101           H        LEU 101  14.479  20.434  11.823
    2    HA   LEU 101           HA       LEU 101  13.279  22.489  13.393
    3    HB2  LEU 101           HB2      LEU 101  13.762  19.547  13.785
    4    HB3  LEU 101           HB3      LEU 101  13.208  20.523  15.142
    5    HG   LEU 101           HG       LEU 101  11.796  20.584  12.469
    6   HD12  LEU 101          HD11      LEU 101  10.156  19.000  13.738
    7   HD11  LEU 101          HD12      LEU 101  11.554  18.610  14.737
    8   HD13  LEU 101          HD13      LEU 101  11.596  18.299  13.001
    9   HD21  LEU 101          HD21      LEU 101  11.120  21.375  15.317
   10   HD23  LEU 101          HD22      LEU 101   9.866  21.128  14.104
   11   HD22  LEU 101          HD23      LEU 101  11.084  22.380  13.866

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LYS 102           H        LYS 102  16.435  21.925  12.966
    2    HA   LYS 102           HA       LYS 102  18.266  22.825  14.041
    3    HB2  LYS 102           HB2      LYS 102  16.428  24.317  15.166
    4    HB3  LYS 102           HB3      LYS 102  16.646  23.261  16.546
    5    HG2  LYS 102           HG2      LYS 102  18.514  25.296  15.376
    6    HG3  LYS 102           HG3      LYS 102  18.132  24.980  17.055
    7    HD2  LYS 102           HD2      LYS 102  19.830  23.087  15.379
    8    HD3  LYS 102           HD3      LYS 102  20.498  24.421  16.310
    9    HE2  LYS 102           HE2      LYS 102  20.134  21.870  17.284
   10    HE3  LYS 102           HE3      LYS 102  20.329  23.317  18.272
   11    HZ2  LYS 102           HZ1      LYS 102  18.377  22.007  18.888
   12    HZ1  LYS 102           HZ2      LYS 102  17.734  22.224  17.337
   13    HZ3  LYS 102           HZ3      LYS 102  17.943  23.560  18.360

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ALA 103           H        ALA 103  16.211  21.197  16.462
    2    HA   ALA 103           HA       ALA 103  17.951  20.015  18.124
    3    HB2  ALA 103           HB1      ALA 103  16.395  17.985  18.120
    4    HB1  ALA 103           HB2      ALA 103  15.491  18.823  16.858
    5    HB3  ALA 103           HB3      ALA 103  15.654  19.550  18.455

  No H/Q in entry =           5
  In of MODEL    5
    1    H1   ALA   1           H3       ALA   1  -1.492  -7.219 -21.478
    2    H2   ALA   1           H2       ALA   1  -2.268  -8.664 -21.024
    3    H3   ALA   1           H1       ALA   1  -0.659  -8.693 -21.574
    4    HA   ALA   1           HA       ALA   1  -1.480  -9.179 -23.571
    5    HB1  ALA   1           HB1      ALA   1  -3.609  -9.925 -23.102
    6    HB2  ALA   1           HB2      ALA   1  -4.066  -8.422 -23.904
    7    HB3  ALA   1           HB3      ALA   1  -4.009  -8.497 -22.145

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLU   2           H        GLU   2  -2.321  -8.004 -25.566
    2    HA   GLU   2           HA       GLU   2  -0.947  -5.974 -26.445
    3    HB2  GLU   2           HB2      GLU   2  -3.952  -6.083 -26.771
    4    HB3  GLU   2           HB3      GLU   2  -2.840  -5.207 -27.819
    5    HG2  GLU   2           HG2      GLU   2  -2.308  -7.093 -28.968
    6    HG3  GLU   2           HG3      GLU   2  -2.003  -7.991 -27.487

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLU   3           H        GLU   3  -4.127  -4.758 -25.557
    2    HA   GLU   3           HA       GLU   3  -3.117  -2.186 -24.932
    3    HB2  GLU   3           HB2      GLU   3  -5.788  -3.537 -24.604
    4    HB3  GLU   3           HB3      GLU   3  -5.514  -1.916 -23.961
    5    HG2  GLU   3           HG2      GLU   3  -5.164  -0.989 -26.088
    6    HG3  GLU   3           HG3      GLU   3  -4.746  -2.541 -26.808

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LEU   4           H        LEU   4  -4.682  -4.561 -22.751
    2    HA   LEU   4           HA       LEU   4  -4.341  -3.323 -20.362
    3    HB2  LEU   4           HB2      LEU   4  -3.757  -6.257 -20.822
    4    HB3  LEU   4           HB3      LEU   4  -4.177  -5.513 -19.282
    5    HG   LEU   4           HG       LEU   4  -5.941  -5.617 -21.751
    6   HD13  LEU   4          HD11      LEU   4  -7.114  -7.348 -20.752
    7   HD12  LEU   4          HD12      LEU   4  -6.640  -6.878 -19.121
    8   HD11  LEU   4          HD13      LEU   4  -5.490  -7.708 -20.167
    9   HD23  LEU   4          HD21      LEU   4  -7.642  -4.824 -19.890
   10   HD22  LEU   4          HD22      LEU   4  -6.617  -3.641 -20.700
   11   HD21  LEU   4          HD23      LEU   4  -6.188  -4.221 -19.092

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLU   5           H        GLU   5  -1.813  -5.136 -22.081
    2    HA   GLU   5           HA       GLU   5   0.161  -4.820 -20.039
    3    HB2  GLU   5           HB2      GLU   5   0.239  -6.590 -21.804
    4    HB3  GLU   5           HB3      GLU   5   0.575  -5.335 -22.998
    5    HG2  GLU   5           HG2      GLU   5   2.689  -6.274 -22.333
    6    HG3  GLU   5           HG3      GLU   5   2.579  -4.673 -21.605

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLU   6           H        GLU   6  -0.489  -3.123 -23.090
    2    HA   GLU   6           HA       GLU   6   1.655  -1.261 -22.820
    3    HB2  GLU   6           HB2      GLU   6  -0.901  -1.209 -24.438
    4    HB3  GLU   6           HB3      GLU   6   0.340   0.041 -24.541
    5    HG2  GLU   6           HG2      GLU   6   1.998  -1.599 -25.241
    6    HG3  GLU   6           HG3      GLU   6   0.841  -2.909 -25.018

  No H/Q in entry =           6
  In of MODEL    5
    1    H    VAL   7           H        VAL   7  -1.685  -1.375 -21.785
    2    HA   VAL   7           HA       VAL   7  -1.945   1.336 -20.955
    3    HB   VAL   7           HB       VAL   7  -3.376  -1.199 -20.117
    4   HG11  VAL   7          HG11      VAL   7  -3.792   1.686 -19.311
    5   HG13  VAL   7          HG12      VAL   7  -3.676   0.265 -18.272
    6   HG12  VAL   7          HG13      VAL   7  -5.109   0.513 -19.269
    7   HG21  VAL   7          HG21      VAL   7  -3.540  -0.131 -22.508
    8   HG23  VAL   7          HG22      VAL   7  -4.505   1.107 -21.702
    9   HG22  VAL   7          HG23      VAL   7  -5.028  -0.577 -21.673

  No H/Q in entry =           9
  In of MODEL    5
    1    H    VAL   8           H        VAL   8  -0.922  -1.632 -19.302
    2    HA   VAL   8           HA       VAL   8  -0.626  -0.542 -16.708
    3    HB   VAL   8           HB       VAL   8   0.804  -2.844 -18.059
    4   HG11  VAL   8          HG11      VAL   8   0.920  -1.745 -15.256
    5   HG13  VAL   8          HG12      VAL   8   2.244  -2.282 -16.291
    6   HG12  VAL   8          HG13      VAL   8   1.170  -3.467 -15.547
    7   HG22  VAL   8          HG21      VAL   8  -0.957  -4.169 -17.373
    8   HG21  VAL   8          HG22      VAL   8  -1.843  -2.648 -17.335
    9   HG23  VAL   8          HG23      VAL   8  -1.146  -3.295 -15.853

  No H/Q in entry =           9
  In of MODEL    5
    1    H    MET   9           H        MET   9   1.635  -0.819 -19.449
    2    HA   MET   9           HA       MET   9   3.903   0.257 -18.183
    3    HB2  MET   9           HB2      MET   9   2.961   0.258 -21.048
    4    HB3  MET   9           HB3      MET   9   4.461   1.055 -20.573
    5    HG2  MET   9           HG2      MET   9   5.246  -1.078 -19.562
    6    HG3  MET   9           HG3      MET   9   3.771  -1.864 -20.127
    7    HE1  MET   9           HE1      MET   9   6.605   0.319 -20.885
    8    HE3  MET   9           HE2      MET   9   7.120   0.025 -22.543
    9    HE2  MET   9           HE3      MET   9   7.537  -1.130 -21.280

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLY  10           H        GLY  10   1.203   1.821 -19.872
    2    HA3  GLY  10           HA2      GLY  10   2.132   4.487 -19.631
    3    HA2  GLY  10           HA3      GLY  10   0.449   4.005 -19.839

  No H/Q in entry =           3
  In of MODEL    5
    1    H    LEU  11           H        LEU  11   0.063   2.478 -17.551
    2    HA   LEU  11           HA       LEU  11  -0.497   4.452 -15.597
    3    HB2  LEU  11           HB2      LEU  11  -0.393   1.438 -15.434
    4    HB3  LEU  11           HB3      LEU  11  -0.918   2.457 -14.095
    5    HG   LEU  11           HG       LEU  11  -2.151   2.549 -16.861
    6   HD13  LEU  11          HD11      LEU  11  -2.710   0.401 -16.103
    7   HD12  LEU  11          HD12      LEU  11  -4.074   1.377 -15.563
    8   HD11  LEU  11          HD13      LEU  11  -2.815   0.915 -14.419
    9   HD22  LEU  11          HD21      LEU  11  -2.769   4.560 -15.861
   10   HD21  LEU  11          HD22      LEU  11  -2.690   3.898 -14.228
   11   HD23  LEU  11          HD23      LEU  11  -4.058   3.513 -15.273

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  12           H        ILE  12   2.077   2.017 -15.828
    2    HA   ILE  12           HA       ILE  12   3.269   2.575 -13.322
    3    HB   ILE  12           HB       ILE  12   4.542   1.544 -15.880
    4   HG12  ILE  12          HG12      ILE  12   2.542   0.291 -14.737
    5   HG13  ILE  12          HG13      ILE  12   3.953  -0.629 -15.218
    6   HG23  ILE  12          HG21      ILE  12   6.289   2.294 -14.390
    7   HG22  ILE  12          HG22      ILE  12   6.219   0.537 -14.271
    8   HG21  ILE  12          HG23      ILE  12   5.508   1.535 -13.004
    9   HD11  ILE  12          HD11      ILE  12   3.480   0.478 -12.439
   10   HD13  ILE  12          HD12      ILE  12   4.770  -0.616 -12.935
   11   HD12  ILE  12          HD13      ILE  12   3.108  -1.166 -12.927

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  13           H        ILE  13   3.863   3.838 -16.581
    2    HA   ILE  13           HA       ILE  13   5.977   5.586 -15.855
    3    HB   ILE  13           HB       ILE  13   3.950   5.639 -18.104
    4   HG12  ILE  13          HG12      ILE  13   5.812   3.821 -17.814
    5   HG13  ILE  13          HG13      ILE  13   5.552   4.547 -19.396
    6   HG23  ILE  13          HG21      ILE  13   4.560   7.883 -18.081
    7   HG22  ILE  13          HG22      ILE  13   5.797   7.218 -19.140
    8   HG21  ILE  13          HG23      ILE  13   6.175   7.557 -17.452
    9   HD12  ILE  13          HD11      ILE  13   7.995   4.403 -18.679
   10   HD11  ILE  13          HD12      ILE  13   7.607   5.572 -17.422
   11   HD13  ILE  13          HD13      ILE  13   7.440   6.018 -19.116

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ASN  14           H        ASN  14   2.465   6.037 -16.131
    2    HA   ASN  14           HA       ASN  14   2.388   8.784 -15.501
    3    HB2  ASN  14           HB2      ASN  14   0.517   7.117 -16.332
    4    HB3  ASN  14           HB3      ASN  14   0.194   6.938 -14.612
    5   HD21  ASN  14          HD21      ASN  14  -1.837   8.067 -16.051
    6   HD22  ASN  14          HD22      ASN  14  -1.920   9.739 -15.787

  No H/Q in entry =           6
  In of MODEL    5
    1    H    SER  15           H        SER  15   2.124   5.908 -13.418
    2    HA   SER  15           HA       SER  15   1.795   7.280 -10.974
    3    HB2  SER  15           HB2      SER  15   2.371   5.203  -9.918
    4    HB3  SER  15           HB3      SER  15   1.545   4.771 -11.412
    5    HG   SER  15           HG       SER  15   3.331   3.956 -12.159

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLY  16           H        GLY  16   4.687   6.215 -12.724
    2    HA3  GLY  16           HA2      GLY  16   6.599   7.000 -10.791
    3    HA2  GLY  16           HA3      GLY  16   6.908   6.798 -12.514

  No H/Q in entry =           3
  In of MODEL    5
    1    H    GLN  17           H        GLN  17   5.196   8.731 -13.584
    2    HA   GLN  17           HA       GLN  17   6.743  11.094 -13.278
    3    HB2  GLN  17           HB2      GLN  17   4.007  10.614 -14.490
    4    HB3  GLN  17           HB3      GLN  17   4.827  12.175 -14.550
    5    HG2  GLN  17           HG2      GLN  17   6.721  11.174 -15.728
    6    HG3  GLN  17           HG3      GLN  17   5.978   9.580 -15.611
    7   HE21  GLN  17          HE21      GLN  17   3.299  11.290 -16.048
    8   HE22  GLN  17          HE22      GLN  17   3.239  11.392 -17.742

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ALA  18           H        ALA  18   3.653  10.038 -11.933
    2    HA   ALA  18           HA       ALA  18   2.893  12.420 -10.675
    3    HB1  ALA  18           HB1      ALA  18   1.797   9.948 -10.894
    4    HB2  ALA  18           HB2      ALA  18   1.230  11.163  -9.751
    5    HB3  ALA  18           HB3      ALA  18   2.336   9.897  -9.216

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ARG  19           H        ARG  19   4.801   9.685  -9.385
    2    HA   ARG  19           HA       ARG  19   5.313  10.856  -6.865
    3    HB2  ARG  19           HB2      ARG  19   5.761   8.458  -7.385
    4    HB3  ARG  19           HB3      ARG  19   7.112   8.960  -8.405
    5    HG2  ARG  19           HG2      ARG  19   8.213  10.019  -6.482
    6    HG3  ARG  19           HG3      ARG  19   6.841   9.615  -5.453
    7    HD2  ARG  19           HD2      ARG  19   8.624   8.004  -5.087
    8    HD3  ARG  19           HD3      ARG  19   7.262   7.202  -5.874
    9    HE   ARG  19           HE       ARG  19   8.960   8.039  -7.920
   10   HH21  ARG  19          HH11      ARG  19  10.542   6.654  -8.764
   11   HH22  ARG  19          HH12      ARG  19  11.104   5.316  -7.824
   12   HH11  ARG  19          HH21      ARG  19   9.054   6.016  -5.137
   13   HH12  ARG  19          HH22      ARG  19  10.258   4.954  -5.769

  No H/Q in entry =          13
  In of MODEL    5
    1    H    SER  20           H        SER  20   7.136  10.904  -9.910
    2    HA   SER  20           HA       SER  20   9.359  12.353  -9.084
    3    HB2  SER  20           HB2      SER  20   9.158  11.355 -11.330
    4    HB3  SER  20           HB3      SER  20   7.929  12.544 -11.744
    5    HG   SER  20           HG       SER  20  10.640  13.022 -11.046

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU  21           H        LEU  21   6.245  13.575 -10.291
    2    HA   LEU  21           HA       LEU  21   6.876  16.330 -10.071
    3    HB2  LEU  21           HB2      LEU  21   4.228  14.869  -9.993
    4    HB3  LEU  21           HB3      LEU  21   4.370  16.625 -10.003
    5    HG   LEU  21           HG       LEU  21   5.591  14.837 -12.126
    6   HD11  LEU  21          HD11      LEU  21   2.943  16.315 -12.078
    7   HD13  LEU  21          HD12      LEU  21   3.185  14.574 -12.227
    8   HD12  LEU  21          HD13      LEU  21   3.673  15.646 -13.538
    9   HD21  LEU  21          HD21      LEU  21   5.358  17.804 -11.693
   10   HD23  LEU  21          HD22      LEU  21   5.322  17.202 -13.348
   11   HD22  LEU  21          HD23      LEU  21   6.719  16.887 -12.331

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ALA  22           H        ALA  22   5.392  14.024  -7.821
    2    HA   ALA  22           HA       ALA  22   4.758  15.827  -5.760
    3    HB3  ALA  22           HB1      ALA  22   4.033  13.424  -5.919
    4    HB2  ALA  22           HB2      ALA  22   4.610  13.908  -4.324
    5    HB1  ALA  22           HB3      ALA  22   5.650  12.963  -5.391

  No H/Q in entry =           5
  In of MODEL    5
    1    H    TYR  23           H        TYR  23   7.723  13.845  -6.187
    2    HA   TYR  23           HA       TYR  23   9.085  14.890  -3.934
    3    HB2  TYR  23           HB2      TYR  23   9.905  12.892  -5.086
    4    HB3  TYR  23           HB3      TYR  23  10.208  13.832  -6.547
    5    HD1  TYR  23           HD1      TYR  23  11.169  13.512  -2.953
    6    HD2  TYR  23           HD2      TYR  23  12.224  15.038  -6.829
    7    HE1  TYR  23           HE1      TYR  23  13.416  14.125  -2.101
    8    HE2  TYR  23           HE2      TYR  23  14.470  15.652  -5.975
    9    HH   TYR  23           HH       TYR  23  15.547  16.149  -3.829

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ALA  24           H        ALA  24   8.893  15.987  -7.303
    2    HA   ALA  24           HA       ALA  24  10.755  18.102  -7.058
    3    HB2  ALA  24           HB1      ALA  24  10.316  18.152  -9.268
    4    HB3  ALA  24           HB2      ALA  24   8.749  18.878  -8.914
    5    HB1  ALA  24           HB3      ALA  24   8.902  17.127  -9.039

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA  25           H        ALA  25   7.278  17.863  -6.444
    2    HA   ALA  25           HA       ALA  25   6.753  20.575  -5.882
    3    HB1  ALA  25           HB1      ALA  25   5.125  18.549  -6.082
    4    HB2  ALA  25           HB2      ALA  25   4.734  19.835  -4.938
    5    HB3  ALA  25           HB3      ALA  25   5.447  18.326  -4.362

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU  26           H        LEU  26   7.861  17.918  -3.824
    2    HA   LEU  26           HA       LEU  26   7.937  19.356  -1.390
    3    HB2  LEU  26           HB2      LEU  26   8.072  16.942  -1.378
    4    HB3  LEU  26           HB3      LEU  26   9.544  16.971  -2.346
    5    HG   LEU  26           HG       LEU  26  10.736  18.114  -0.506
    6   HD12  LEU  26          HD11      LEU  26   9.505  18.107   1.751
    7   HD11  LEU  26          HD12      LEU  26   8.022  17.942   0.814
    8   HD13  LEU  26          HD13      LEU  26   9.043  19.364   0.604
    9   HD21  LEU  26          HD21      LEU  26   9.242  15.623   0.370
   10   HD23  LEU  26          HD22      LEU  26  10.746  16.212   1.069
   11   HD22  LEU  26          HD23      LEU  26  10.714  15.648  -0.600

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LYS  27           H        LYS  27  10.368  18.818  -3.908
    2    HA   LYS  27           HA       LYS  27  12.528  20.099  -2.679
    3    HB2  LYS  27           HB2      LYS  27  12.657  18.748  -4.765
    4    HB3  LYS  27           HB3      LYS  27  11.871  20.065  -5.635
    5    HG2  LYS  27           HG2      LYS  27  13.710  21.583  -5.058
    6    HG3  LYS  27           HG3      LYS  27  14.490  20.307  -4.116
    7    HD2  LYS  27           HD2      LYS  27  14.661  18.917  -6.166
    8    HD3  LYS  27           HD3      LYS  27  13.926  20.220  -7.100
    9    HE2  LYS  27           HE2      LYS  27  15.787  21.720  -6.487
   10    HE3  LYS  27           HE3      LYS  27  16.526  20.420  -5.544
   11    HZ3  LYS  27           HZ1      LYS  27  17.519  20.532  -7.729
   12    HZ2  LYS  27           HZ2      LYS  27  15.996  20.385  -8.473
   13    HZ1  LYS  27           HZ3      LYS  27  16.640  19.088  -7.584

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLN  28           H        GLN  28   9.887  21.430  -4.636
    2    HA   GLN  28           HA       GLN  28  10.800  24.098  -4.794
    3    HB2  GLN  28           HB2      GLN  28   7.987  22.977  -4.687
    4    HB3  GLN  28           HB3      GLN  28   8.369  24.658  -5.061
    5    HG2  GLN  28           HG2      GLN  28   9.410  22.262  -6.602
    6    HG3  GLN  28           HG3      GLN  28   8.061  23.276  -7.111
    7   HE21  GLN  28          HE21      GLN  28  11.222  22.832  -7.813
    8   HE22  GLN  28          HE22      GLN  28  11.678  24.423  -8.189

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ALA  29           H        ALA  29   8.893  22.379  -2.357
    2    HA   ALA  29           HA       ALA  29   8.302  24.565  -0.682
    3    HB2  ALA  29           HB1      ALA  29   7.597  22.988   0.888
    4    HB1  ALA  29           HB2      ALA  29   8.840  21.824   0.429
    5    HB3  ALA  29           HB3      ALA  29   7.451  22.091  -0.623

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LYS  30           H        LYS  30  11.072  22.346  -0.741
    2    HA   LYS  30           HA       LYS  30  12.368  23.329   1.562
    3    HB2  LYS  30           HB2      LYS  30  13.492  22.056  -0.943
    4    HB3  LYS  30           HB3      LYS  30  14.465  22.437   0.480
    5    HG2  LYS  30           HG2      LYS  30  12.934  21.030   1.860
    6    HG3  LYS  30           HG3      LYS  30  12.059  20.589   0.390
    7    HD2  LYS  30           HD2      LYS  30  14.123  19.636  -0.565
    8    HD3  LYS  30           HD3      LYS  30  15.017  20.092   0.888
    9    HE2  LYS  30           HE2      LYS  30  13.535  18.637   2.243
   10    HE3  LYS  30           HE3      LYS  30  12.672  18.163   0.774
   11    HZ2  LYS  30           HZ1      LYS  30  14.490  16.618   1.543
   12    HZ1  LYS  30           HZ2      LYS  30  15.606  17.824   1.091
   13    HZ3  LYS  30           HZ3      LYS  30  14.585  17.119  -0.074

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLN  31           H        GLN  31  12.244  24.523  -1.738
    2    HA   GLN  31           HA       GLN  31  14.362  26.456  -1.317
    3    HB2  GLN  31           HB2      GLN  31  12.323  26.460  -3.545
    4    HB3  GLN  31           HB3      GLN  31  13.931  27.185  -3.545
    5    HG2  GLN  31           HG2      GLN  31  14.439  24.499  -2.962
    6    HG3  GLN  31           HG3      GLN  31  13.139  24.419  -4.143
    7   HE21  GLN  31          HE21      GLN  31  15.997  23.675  -4.539
    8   HE22  GLN  31          HE22      GLN  31  16.554  24.655  -5.807

  No H/Q in entry =           8
  In of MODEL    5
    1    H    GLY  32           H        GLY  32  11.289  26.222  -0.177
    2    HA3  GLY  32           HA2      GLY  32  10.103  27.772   1.090
    3    HA2  GLY  32           HA3      GLY  32  11.207  29.026   0.539

  No H/Q in entry =           3
  In of MODEL    5
    1    H    ASP  33           H        ASP  33   9.882  27.092  -1.951
    2    HA   ASP  33           HA       ASP  33   8.179  29.332  -2.816
    3    HB2  ASP  33           HB2      ASP  33   9.318  26.929  -4.250
    4    HB3  ASP  33           HB3      ASP  33   8.148  28.022  -4.985

  No H/Q in entry =           4
  In of MODEL    5
    1    H    PHE  34           H        PHE  34   6.496  28.830  -1.254
    2    HA   PHE  34           HA       PHE  34   5.161  26.334  -1.155
    3    HB2  PHE  34           HB2      PHE  34   4.149  29.106  -0.484
    4    HB3  PHE  34           HB3      PHE  34   3.326  27.601  -0.070
    5    HD1  PHE  34           HD1      PHE  34   5.530  30.043   1.142
    6    HD2  PHE  34           HD2      PHE  34   4.926  25.790   1.098
    7    HE1  PHE  34           HE1      PHE  34   6.921  29.822   3.182
    8    HE2  PHE  34           HE2      PHE  34   6.319  25.574   3.136
    9    HZ   PHE  34           HZ       PHE  34   7.311  27.590   4.178

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ALA  35           H        ALA  35   4.683  29.185  -3.174
    2    HA   ALA  35           HA       ALA  35   2.145  28.522  -4.202
    3    HB3  ALA  35           HB1      ALA  35   3.176  29.928  -6.241
    4    HB2  ALA  35           HB2      ALA  35   4.385  30.314  -5.016
    5    HB1  ALA  35           HB3      ALA  35   2.686  30.694  -4.730

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA  36           H        ALA  36   5.388  27.904  -5.548
    2    HA   ALA  36           HA       ALA  36   4.429  26.451  -7.790
    3    HB3  ALA  36           HB1      ALA  36   6.587  26.613  -8.402
    4    HB2  ALA  36           HB2      ALA  36   7.084  25.596  -7.048
    5    HB1  ALA  36           HB3      ALA  36   6.947  27.343  -6.838

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA  37           H        ALA  37   5.397  25.482  -4.531
    2    HA   ALA  37           HA       ALA  37   5.389  22.693  -4.953
    3    HB2  ALA  37           HB1      ALA  37   5.091  24.485  -2.580
    4    HB1  ALA  37           HB2      ALA  37   6.248  23.187  -2.867
    5    HB3  ALA  37           HB3      ALA  37   4.593  22.804  -2.398

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LYS  38           H        LYS  38   2.814  24.858  -3.795
    2    HA   LYS  38           HA       LYS  38   0.748  23.008  -3.572
    3    HB2  LYS  38           HB2      LYS  38   1.049  25.770  -3.327
    4    HB3  LYS  38           HB3      LYS  38  -0.145  25.598  -4.608
    5    HG2  LYS  38           HG2      LYS  38  -1.573  24.253  -3.165
    6    HG3  LYS  38           HG3      LYS  38  -0.331  24.218  -1.906
    7    HD2  LYS  38           HD2      LYS  38  -0.560  26.552  -1.465
    8    HD3  LYS  38           HD3      LYS  38  -1.474  26.821  -2.950
    9    HE2  LYS  38           HE2      LYS  38  -2.981  26.833  -1.013
   10    HE3  LYS  38           HE3      LYS  38  -3.328  25.447  -2.053
   11    HZ3  LYS  38           HZ1      LYS  38  -2.579  23.994  -0.514
   12    HZ2  LYS  38           HZ2      LYS  38  -2.955  25.247   0.571
   13    HZ1  LYS  38           HZ3      LYS  38  -1.355  25.024   0.049

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ALA  39           H        ALA  39   1.698  24.920  -6.424
    2    HA   ALA  39           HA       ALA  39  -0.358  24.011  -8.128
    3    HB2  ALA  39           HB1      ALA  39   2.368  24.706  -9.179
    4    HB1  ALA  39           HB2      ALA  39   1.377  25.951  -8.419
    5    HB3  ALA  39           HB3      ALA  39   0.783  25.100  -9.844

  No H/Q in entry =           5
  In of MODEL    5
    1    H    MET  40           H        MET  40   2.902  22.773  -7.540
    2    HA   MET  40           HA       MET  40   2.844  20.746  -9.526
    3    HB2  MET  40           HB2      MET  40   4.447  21.005  -6.975
    4    HB3  MET  40           HB3      MET  40   4.722  19.751  -8.186
    5    HG2  MET  40           HG2      MET  40   4.727  22.706  -8.858
    6    HG3  MET  40           HG3      MET  40   6.189  21.831  -8.404
    7    HE3  MET  40           HE1      MET  40   7.107  19.624 -11.205
    8    HE2  MET  40           HE2      MET  40   6.546  19.299  -9.568
    9    HE1  MET  40           HE3      MET  40   7.617  20.665  -9.869

  No H/Q in entry =           9
  In of MODEL    5
    1    H    MET  41           H        MET  41   1.922  20.780  -6.104
    2    HA   MET  41           HA       MET  41   1.440  18.007  -5.820
    3    HB2  MET  41           HB2      MET  41   0.061  20.343  -4.477
    4    HB3  MET  41           HB3      MET  41  -0.065  18.664  -3.966
    5    HG2  MET  41           HG2      MET  41   2.641  18.936  -3.998
    6    HG3  MET  41           HG3      MET  41   2.170  20.588  -3.607
    7    HE2  MET  41           HE1      MET  41  -0.850  19.284  -1.885
    8    HE1  MET  41           HE2      MET  41  -0.060  20.810  -2.264
    9    HE3  MET  41           HE3      MET  41  -0.112  20.243  -0.595

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ASP  42           H        ASP  42  -0.646  20.691  -6.805
    2    HA   ASP  42           HA       ASP  42  -3.062  19.285  -6.943
    3    HB2  ASP  42           HB2      ASP  42  -2.402  21.868  -7.204
    4    HB3  ASP  42           HB3      ASP  42  -2.542  21.466  -8.912

  No H/Q in entry =           4
  In of MODEL    5
    1    H    GLN  43           H        GLN  43  -0.627  19.915  -9.441
    2    HA   GLN  43           HA       GLN  43  -1.985  18.565 -11.530
    3    HB2  GLN  43           HB2      GLN  43   0.962  19.137 -11.144
    4    HB3  GLN  43           HB3      GLN  43   0.263  18.480 -12.626
    5    HG2  GLN  43           HG2      GLN  43  -1.286  20.479 -12.675
    6    HG3  GLN  43           HG3      GLN  43  -0.348  21.156 -11.348
    7   HE21  GLN  43          HE21      GLN  43  -0.212  22.773 -13.437
    8   HE22  GLN  43          HE22      GLN  43   1.208  22.576 -14.342

  No H/Q in entry =           8
  In of MODEL    5
    1    H    SER  44           H        SER  44   0.381  17.475  -9.132
    2    HA   SER  44           HA       SER  44   0.767  14.872 -10.150
    3    HB2  SER  44           HB2      SER  44   1.630  16.333  -7.915
    4    HB3  SER  44           HB3      SER  44   0.792  14.935  -7.243
    5    HG   SER  44           HG       SER  44   2.916  14.354  -7.663

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ARG  45           H        ARG  45  -1.582  16.153  -7.820
    2    HA   ARG  45           HA       ARG  45  -2.925  13.768  -7.181
    3    HB2  ARG  45           HB2      ARG  45  -3.167  15.935  -5.995
    4    HB3  ARG  45           HB3      ARG  45  -4.032  16.582  -7.386
    5    HG2  ARG  45           HG2      ARG  45  -5.766  14.824  -7.101
    6    HG3  ARG  45           HG3      ARG  45  -4.913  14.231  -5.675
    7    HD2  ARG  45           HD2      ARG  45  -5.165  16.497  -4.625
    8    HD3  ARG  45           HD3      ARG  45  -6.158  16.994  -6.011
    9    HE   ARG  45           HE       ARG  45  -7.225  14.600  -4.967
   10   HH21  ARG  45          HH11      ARG  45  -9.065  14.644  -3.700
   11   HH22  ARG  45          HH12      ARG  45  -9.489  16.078  -2.835
   12   HH11  ARG  45          HH21      ARG  45  -6.743  17.859  -3.950
   13   HH12  ARG  45          HH22      ARG  45  -8.169  17.899  -2.975

  No H/Q in entry =          13
  In of MODEL    5
    1    H    MET  46           H        MET  46  -3.550  16.154  -9.739
    2    HA   MET  46           HA       MET  46  -5.864  14.934 -10.803
    3    HB2  MET  46           HB2      MET  46  -3.797  16.803 -11.971
    4    HB3  MET  46           HB3      MET  46  -5.156  16.211 -12.930
    5    HG2  MET  46           HG2      MET  46  -6.741  17.122 -11.315
    6    HG3  MET  46           HG3      MET  46  -5.426  17.624 -10.260
    7    HE1  MET  46           HE1      MET  46  -7.146  17.738 -13.478
    8    HE3  MET  46           HE2      MET  46  -5.714  18.151 -14.416
    9    HE2  MET  46           HE3      MET  46  -6.960  19.368 -14.138

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ALA  47           H        ALA  47  -2.425  14.519 -11.552
    2    HA   ALA  47           HA       ALA  47  -2.732  12.780 -13.759
    3    HB3  ALA  47           HB1      ALA  47  -0.573  13.712 -13.405
    4    HB2  ALA  47           HB2      ALA  47  -0.399  11.988 -13.066
    5    HB1  ALA  47           HB3      ALA  47  -0.517  13.141 -11.736

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU  48           H        LEU  48  -2.458  12.158 -10.283
    2    HA   LEU  48           HA       LEU  48  -2.496   9.317 -10.434
    3    HB2  LEU  48           HB2      LEU  48  -3.302  11.225  -8.227
    4    HB3  LEU  48           HB3      LEU  48  -3.175   9.477  -8.021
    5    HG   LEU  48           HG       LEU  48  -0.907  11.219  -9.018
    6   HD13  LEU  48          HD11      LEU  48  -1.209  11.989  -6.830
    7   HD12  LEU  48          HD12      LEU  48  -0.021  10.705  -6.626
    8   HD11  LEU  48          HD13      LEU  48  -1.715  10.410  -6.231
    9   HD22  LEU  48          HD21      LEU  48  -0.365   9.042  -9.652
   10   HD21  LEU  48          HD22      LEU  48  -1.223   8.313  -8.296
   11   HD23  LEU  48          HD23      LEU  48   0.334   9.097  -8.035

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ASN  49           H        ASN  49  -5.009  11.762 -10.044
    2    HA   ASN  49           HA       ASN  49  -7.163  10.056  -9.505
    3    HB2  ASN  49           HB2      ASN  49  -7.253  12.486  -9.194
    4    HB3  ASN  49           HB3      ASN  49  -7.120  12.732 -10.931
    5   HD21  ASN  49          HD21      ASN  49  -9.184  13.694 -11.239
    6   HD22  ASN  49          HD22      ASN  49 -10.639  12.864 -10.967

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLU  50           H        GLU  50  -5.900  11.270 -12.593
    2    HA   GLU  50           HA       GLU  50  -7.826   9.972 -14.239
    3    HB2  GLU  50           HB2      GLU  50  -6.394  11.817 -15.055
    4    HB3  GLU  50           HB3      GLU  50  -4.980  10.773 -14.911
    5    HG2  GLU  50           HG2      GLU  50  -5.920   9.214 -16.546
    6    HG3  GLU  50           HG3      GLU  50  -7.399  10.164 -16.639

  No H/Q in entry =           6
  In of MODEL    5
    1    H    ALA  51           H        ALA  51  -4.639   9.045 -13.024
    2    HA   ALA  51           HA       ALA  51  -4.449   6.592 -14.435
    3    HB2  ALA  51           HB1      ALA  51  -2.465   6.345 -13.330
    4    HB1  ALA  51           HB2      ALA  51  -3.165   6.758 -11.765
    5    HB3  ALA  51           HB3      ALA  51  -2.731   8.035 -12.902

  No H/Q in entry =           5
  In of MODEL    5
    1    H    HIS  52           H        HIS  52  -5.645   7.409 -11.191
    2    HA   HIS  52           HA       HIS  52  -6.282   4.788 -10.354
    3    HB2  HIS  52           HB2      HIS  52  -6.186   6.717  -8.825
    4    HB3  HIS  52           HB3      HIS  52  -7.613   7.402  -9.603
    5    HD1  HIS  52           HD1      HIS  52  -9.843   5.878  -9.455
    6    HD2  HIS  52           HD2      HIS  52  -6.760   4.849  -6.845
    7    HE1  HIS  52           HE1      HIS  52 -10.874   4.400  -7.675
    8    HE2  HIS  52           HE2      HIS  52  -9.007   3.765  -6.075

  No H/Q in entry =           8
  In of MODEL    5
    1    H    LEU  53           H        LEU  53  -8.145   7.206 -12.153
    2    HA   LEU  53           HA       LEU  53 -10.625   5.866 -12.168
    3    HB2  LEU  53           HB2      LEU  53  -9.374   7.867 -14.039
    4    HB3  LEU  53           HB3      LEU  53 -10.958   7.170 -14.365
    5    HG   LEU  53           HG       LEU  53 -10.277   8.508 -11.726
    6   HD13  LEU  53          HD11      LEU  53 -10.033  10.252 -13.325
    7   HD12  LEU  53          HD12      LEU  53 -11.684  10.411 -12.725
    8   HD11  LEU  53          HD13      LEU  53 -11.380   9.662 -14.290
    9   HD22  LEU  53          HD21      LEU  53 -12.253   7.265 -11.403
   10   HD21  LEU  53          HD22      LEU  53 -12.791   7.516 -13.059
   11   HD23  LEU  53          HD23      LEU  53 -12.897   8.825 -11.897

  No H/Q in entry =          11
  In of MODEL    5
    1    H    VAL  54           H        VAL  54  -7.866   5.716 -14.398
    2    HA   VAL  54           HA       VAL  54  -9.050   3.917 -16.239
    3    HB   VAL  54           HB       VAL  54  -6.154   4.480 -15.551
    4   HG12  VAL  54          HG11      VAL  54  -5.881   3.394 -17.937
    5   HG11  VAL  54          HG12      VAL  54  -7.395   2.585 -17.535
    6   HG13  VAL  54          HG13      VAL  54  -5.978   2.360 -16.512
    7   HG22  VAL  54          HG21      VAL  54  -6.958   6.406 -16.603
    8   HG21  VAL  54          HG22      VAL  54  -8.132   5.518 -17.572
    9   HG23  VAL  54          HG23      VAL  54  -6.424   5.469 -17.998

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLN  55           H        GLN  55  -7.049   3.416 -13.333
    2    HA   GLN  55           HA       GLN  55  -6.905   0.601 -13.582
    3    HB2  GLN  55           HB2      GLN  55  -5.371   1.530 -12.062
    4    HB3  GLN  55           HB3      GLN  55  -6.607   2.475 -11.237
    5    HG2  GLN  55           HG2      GLN  55  -7.266   0.709  -9.917
    6    HG3  GLN  55           HG3      GLN  55  -7.016  -0.477 -11.192
    7   HE21  GLN  55          HE21      GLN  55  -5.367  -1.895 -10.689
    8   HE22  GLN  55          HE22      GLN  55  -3.991  -1.515  -9.775

  No H/Q in entry =           8
  In of MODEL    5
    1    H    THR  56           H        THR  56  -9.280   2.724 -11.979
    2    HA   THR  56           HA       THR  56 -10.833   0.815 -10.689
    3    HB   THR  56           HB       THR  56 -11.970   3.177 -12.205
    4    HG1  THR  56           HG1      THR  56 -10.882   3.100  -9.589
    5   HG22  THR  56          HG21      THR  56 -12.867   2.180  -9.524
    6   HG21  THR  56          HG22      THR  56 -13.382   1.324 -10.977
    7   HG23  THR  56          HG23      THR  56 -13.790   3.027 -10.765

  No H/Q in entry =           7
  In of MODEL    5
    1    H    LYS  57           H        LYS  57 -11.046   1.885 -14.078
    2    HA   LYS  57           HA       LYS  57 -13.169   0.156 -14.833
    3    HB2  LYS  57           HB2      LYS  57 -12.324   2.120 -16.153
    4    HB3  LYS  57           HB3      LYS  57 -10.868   1.205 -16.515
    5    HG2  LYS  57           HG2      LYS  57 -12.185  -0.493 -17.681
    6    HG3  LYS  57           HG3      LYS  57 -13.676   0.345 -17.268
    7    HD2  LYS  57           HD2      LYS  57 -12.920   2.316 -18.567
    8    HD3  LYS  57           HD3      LYS  57 -11.446   1.457 -19.004
    9    HE2  LYS  57           HE2      LYS  57 -14.261   0.516 -19.667
   10    HE3  LYS  57           HE3      LYS  57 -13.182   1.318 -20.806
   11    HZ2  LYS  57           HZ1      LYS  57 -13.272  -1.394 -20.093
   12    HZ1  LYS  57           HZ2      LYS  57 -11.762  -0.766 -19.634
   13    HZ3  LYS  57           HZ3      LYS  57 -12.287  -0.635 -21.246

  No H/Q in entry =          13
  In of MODEL    5
    1    H    LEU  58           H        LEU  58  -9.657  -0.210 -14.765
    2    HA   LEU  58           HA       LEU  58  -9.615  -2.730 -16.047
    3    HB2  LEU  58           HB2      LEU  58  -7.610  -1.396 -14.237
    4    HB3  LEU  58           HB3      LEU  58  -7.319  -2.915 -15.086
    5    HG   LEU  58           HG       LEU  58  -8.117  -0.329 -16.459
    6   HD11  LEU  58          HD11      LEU  58  -5.450  -1.515 -15.757
    7   HD13  LEU  58          HD12      LEU  58  -5.976   0.167 -15.715
    8   HD12  LEU  58          HD13      LEU  58  -5.618  -0.602 -17.258
    9   HD22  LEU  58          HD21      LEU  58  -8.659  -1.906 -18.047
   10   HD21  LEU  58          HD22      LEU  58  -7.597  -3.132 -17.359
   11   HD23  LEU  58          HD23      LEU  58  -6.927  -1.849 -18.366

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  59           H        ILE  59 -10.462  -1.834 -12.801
    2    HA   ILE  59           HA       ILE  59 -10.062  -4.591 -11.844
    3    HB   ILE  59           HB       ILE  59  -9.669  -2.308 -10.452
    4   HG12  ILE  59          HG12      ILE  59 -10.981  -4.685  -9.120
    5   HG13  ILE  59          HG13      ILE  59  -9.339  -4.732  -9.710
    6   HG22  ILE  59          HG21      ILE  59 -12.410  -3.094  -9.505
    7   HG21  ILE  59          HG22      ILE  59 -12.223  -1.854 -10.725
    8   HG23  ILE  59          HG23      ILE  59 -11.503  -1.647  -9.130
    9   HD12  ILE  59          HD11      ILE  59 -10.460  -2.894  -7.614
   10   HD11  ILE  59          HD12      ILE  59  -8.869  -2.665  -8.329
   11   HD13  ILE  59          HD13      ILE  59  -9.215  -4.120  -7.391

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLU  60           H        GLU  60 -12.661  -2.326 -12.666
    2    HA   GLU  60           HA       GLU  60 -14.820  -3.880 -11.655
    3    HB2  GLU  60           HB2      GLU  60 -15.061  -1.508 -12.266
    4    HB3  GLU  60           HB3      GLU  60 -14.753  -1.903 -13.953
    5    HG2  GLU  60           HG2      GLU  60 -16.770  -3.340 -13.981
    6    HG3  GLU  60           HG3      GLU  60 -17.087  -2.917 -12.312

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLY  61           H        GLY  61 -13.138  -3.843 -14.765
    2    HA3  GLY  61           HA2      GLY  61 -14.806  -6.122 -15.653
    3    HA2  GLY  61           HA3      GLY  61 -13.979  -5.005 -16.732

  No H/Q in entry =           3
  In of MODEL    5
    1    H    ASP  62           H        ASP  62 -12.586  -6.419 -13.839
    2    HA   ASP  62           HA       ASP  62 -10.283  -7.319 -15.263
    3    HB2  ASP  62           HB2      ASP  62  -9.602  -8.195 -13.049
    4    HB3  ASP  62           HB3      ASP  62 -10.141  -6.521 -12.962

  No H/Q in entry =           4
  In of MODEL    5
    1    H    ALA  63           H        ALA  63 -12.457  -8.599 -16.495
    2    HA   ALA  63           HA       ALA  63 -13.017 -11.222 -15.548
    3    HB3  ALA  63           HB1      ALA  63 -14.213  -9.937 -17.404
    4    HB1  ALA  63           HB2      ALA  63 -13.862 -11.625 -17.773
    5    HB2  ALA  63           HB3      ALA  63 -12.853 -10.345 -18.448

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLY  64           H        GLY  64 -10.512  -9.909 -17.648
    2    HA3  GLY  64           HA2      GLY  64  -8.548 -10.764 -18.462
    3    HA2  GLY  64           HA3      GLY  64  -8.503 -11.722 -16.988

  No H/Q in entry =           3
  In of MODEL    5
    1    H    GLU  65           H        GLU  65  -7.942 -13.731 -17.661
    2    HA   GLU  65           HA       GLU  65  -8.646 -14.834 -20.154
    3    HB2  GLU  65           HB2      GLU  65  -7.710 -16.147 -17.605
    4    HB3  GLU  65           HB3      GLU  65  -7.909 -17.007 -19.132
    5    HG2  GLU  65           HG2      GLU  65  -6.313 -15.516 -20.223
    6    HG3  GLU  65           HG3      GLU  65  -6.160 -14.562 -18.749

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLY  66           H        GLY  66  -9.487 -17.313 -19.811
    2    HA3  GLY  66           HA2      GLY  66 -12.291 -17.153 -19.784
    3    HA2  GLY  66           HA3      GLY  66 -11.343 -18.627 -19.817

  No H/Q in entry =           3
  In of MODEL    5
    1    H    LYS  67           H        LYS  67 -10.022 -18.197 -17.321
    2    HA   LYS  67           HA       LYS  67 -12.004 -19.301 -15.583
    3    HB2  LYS  67           HB2      LYS  67  -9.085 -18.649 -15.209
    4    HB3  LYS  67           HB3      LYS  67 -10.079 -19.443 -13.980
    5    HG2  LYS  67           HG2      LYS  67 -10.657 -21.226 -15.581
    6    HG3  LYS  67           HG3      LYS  67  -9.685 -20.434 -16.821
    7    HD2  LYS  67           HD2      LYS  67  -7.665 -20.735 -15.437
    8    HD3  LYS  67           HD3      LYS  67  -8.637 -21.527 -14.194
    9    HE2  LYS  67           HE2      LYS  67  -9.289 -23.277 -15.810
   10    HE3  LYS  67           HE3      LYS  67  -8.318 -22.488 -17.054
   11    HZ3  LYS  67           HZ1      LYS  67  -6.351 -22.850 -15.743
   12    HZ2  LYS  67           HZ2      LYS  67  -7.150 -24.331 -15.973
   13    HZ1  LYS  67           HZ3      LYS  67  -7.260 -23.526 -14.482

  No H/Q in entry =          13
  In of MODEL    5
    1    H    MET  68           H        MET  68 -12.521 -18.672 -13.496
    2    HA   MET  68           HA       MET  68 -13.604 -16.170 -13.167
    3    HB2  MET  68           HB2      MET  68 -12.701 -18.141 -11.068
    4    HB3  MET  68           HB3      MET  68 -13.742 -16.754 -10.750
    5    HG2  MET  68           HG2      MET  68 -14.363 -18.946 -12.752
    6    HG3  MET  68           HG3      MET  68 -15.037 -18.852 -11.123
    7    HE1  MET  68           HE1      MET  68 -15.961 -17.036 -10.153
    8    HE3  MET  68           HE2      MET  68 -17.409 -16.315 -10.852
    9    HE2  MET  68           HE3      MET  68 -15.888 -15.424 -10.878

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LYS  69           H        LYS  69 -10.279 -16.732 -13.124
    2    HA   LYS  69           HA       LYS  69  -9.505 -15.004 -11.010
    3    HB2  LYS  69           HB2      LYS  69  -8.004 -16.115 -13.375
    4    HB3  LYS  69           HB3      LYS  69  -7.236 -15.131 -12.128
    5    HG2  LYS  69           HG2      LYS  69  -7.969 -16.722 -10.400
    6    HG3  LYS  69           HG3      LYS  69  -8.781 -17.694 -11.626
    7    HD2  LYS  69           HD2      LYS  69  -6.590 -18.051 -12.754
    8    HD3  LYS  69           HD3      LYS  69  -5.802 -17.155 -11.454
    9    HE2  LYS  69           HE2      LYS  69  -7.492 -19.635 -11.026
   10    HE3  LYS  69           HE3      LYS  69  -5.732 -19.642 -11.127
   11    HZ1  LYS  69           HZ1      LYS  69  -5.758 -17.988  -9.275
   12    HZ3  LYS  69           HZ2      LYS  69  -6.304 -19.539  -8.851
   13    HZ2  LYS  69           HZ3      LYS  69  -7.419 -18.282  -9.104

  No H/Q in entry =          13
  In of MODEL    5
    1    H    VAL  70           H        VAL  70  -7.544 -13.334 -11.876
    2    HA   VAL  70           HA       VAL  70  -8.880 -11.354 -13.630
    3    HB   VAL  70           HB       VAL  70  -8.071  -9.587 -12.099
    4   HG11  VAL  70          HG11      VAL  70 -10.364 -10.491 -11.873
    5   HG13  VAL  70          HG12      VAL  70  -9.713 -10.009 -10.305
    6   HG12  VAL  70          HG13      VAL  70  -9.764 -11.714 -10.752
    7   HG21  VAL  70          HG21      VAL  70  -7.156 -11.977 -10.464
    8   HG23  VAL  70          HG22      VAL  70  -7.361 -10.369  -9.773
    9   HG22  VAL  70          HG23      VAL  70  -6.169 -10.637 -11.045

  No H/Q in entry =           9
  In of MODEL    5
    1    H    SER  71           H        SER  71  -7.334  -9.698 -14.422
    2    HA   SER  71           HA       SER  71  -5.081 -10.848 -15.685
    3    HB2  SER  71           HB2      SER  71  -6.288  -8.838 -16.532
    4    HB3  SER  71           HB3      SER  71  -5.654  -7.917 -15.171
    5    HG   SER  71           HG       SER  71  -3.536  -8.868 -16.036

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU  72           H        LEU  72  -3.043 -11.088 -15.047
    2    HA   LEU  72           HA       LEU  72  -2.335 -10.852 -12.334
    3    HB2  LEU  72           HB2      LEU  72  -0.779 -11.371 -14.845
    4    HB3  LEU  72           HB3      LEU  72   0.036 -11.206 -13.293
    5    HG   LEU  72           HG       LEU  72  -2.265 -13.132 -13.742
    6   HD11  LEU  72          HD11      LEU  72   0.718 -13.498 -14.066
    7   HD13  LEU  72          HD12      LEU  72  -0.559 -13.909 -15.209
    8   HD12  LEU  72          HD13      LEU  72  -0.360 -14.855 -13.734
    9   HD22  LEU  72          HD21      LEU  72  -2.032 -12.913 -11.427
   10   HD21  LEU  72          HD22      LEU  72  -0.307 -12.594 -11.513
   11   HD23  LEU  72          HD23      LEU  72  -0.911 -14.231 -11.752

  No H/Q in entry =          11
  In of MODEL    5
    1    H    VAL  73           H        VAL  73  -1.647  -8.832 -15.119
    2    HA   VAL  73           HA       VAL  73   0.240  -7.096 -14.016
    3    HB   VAL  73           HB       VAL  73  -0.171  -5.693 -15.880
    4   HG13  VAL  73          HG11      VAL  73  -0.143  -7.273 -17.720
    5   HG12  VAL  73          HG12      VAL  73  -0.930  -8.501 -16.730
    6   HG11  VAL  73          HG13      VAL  73   0.715  -7.991 -16.358
    7   HG23  VAL  73          HG21      VAL  73  -2.329  -6.319 -17.279
    8   HG22  VAL  73          HG22      VAL  73  -2.443  -5.203 -15.920
    9   HG21  VAL  73          HG23      VAL  73  -2.917  -6.890 -15.717

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LEU  74           H        LEU  74  -3.156  -7.270 -13.468
    2    HA   LEU  74           HA       LEU  74  -3.823  -4.623 -12.867
    3    HB2  LEU  74           HB2      LEU  74  -5.526  -6.313 -13.038
    4    HB3  LEU  74           HB3      LEU  74  -4.819  -7.230 -11.711
    5    HG   LEU  74           HG       LEU  74  -5.317  -5.378 -10.157
    6   HD13  LEU  74          HD11      LEU  74  -5.205  -3.431 -11.514
    7   HD12  LEU  74          HD12      LEU  74  -6.913  -3.593 -11.110
    8   HD11  LEU  74          HD13      LEU  74  -6.331  -4.095 -12.698
    9   HD22  LEU  74          HD21      LEU  74  -7.522  -5.969  -9.924
   10   HD21  LEU  74          HD22      LEU  74  -6.983  -7.207 -11.038
   11   HD23  LEU  74          HD23      LEU  74  -7.854  -5.822 -11.647

  No H/Q in entry =          11
  In of MODEL    5
    1    H    VAL  75           H        VAL  75  -2.743  -7.184 -10.693
    2    HA   VAL  75           HA       VAL  75  -2.579  -5.621  -8.354
    3    HB   VAL  75           HB       VAL  75  -1.030  -8.089  -9.128
    4   HG11  VAL  75          HG11      VAL  75  -1.300  -6.632  -6.460
    5   HG13  VAL  75          HG12      VAL  75   0.175  -6.832  -7.392
    6   HG12  VAL  75          HG13      VAL  75  -0.593  -8.231  -6.661
    7   HG23  VAL  75          HG21      VAL  75  -3.376  -7.701  -7.243
    8   HG22  VAL  75          HG22      VAL  75  -2.692  -9.231  -7.791
    9   HG21  VAL  75          HG23      VAL  75  -3.565  -8.198  -8.925

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLU  76           H        GLU  76  -0.150  -6.348 -10.880
    2    HA   GLU  76           HA       GLU  76   2.008  -4.958  -9.721
    3    HB2  GLU  76           HB2      GLU  76   2.195  -6.449 -11.718
    4    HB3  GLU  76           HB3      GLU  76   1.336  -5.249 -12.672
    5    HG2  GLU  76           HG2      GLU  76   3.139  -3.620 -12.293
    6    HG3  GLU  76           HG3      GLU  76   4.010  -4.768 -11.295

  No H/Q in entry =           6
  In of MODEL    5
    1    H    ALA  77           H        ALA  77  -0.538  -3.809 -11.922
    2    HA   ALA  77           HA       ALA  77   0.406  -1.146 -12.104
    3    HB1  ALA  77           HB1      ALA  77  -1.200  -1.913 -13.711
    4    HB2  ALA  77           HB2      ALA  77  -1.986  -0.645 -12.770
    5    HB3  ALA  77           HB3      ALA  77  -2.354  -2.338 -12.446

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLN  78           H        GLN  78  -1.841  -2.735  -9.894
    2    HA   GLN  78           HA       GLN  78  -2.694  -0.426  -8.504
    3    HB2  GLN  78           HB2      GLN  78  -3.763  -2.706  -8.415
    4    HB3  GLN  78           HB3      GLN  78  -2.420  -3.236  -7.405
    5    HG2  GLN  78           HG2      GLN  78  -2.975  -1.504  -5.750
    6    HG3  GLN  78           HG3      GLN  78  -4.317  -0.964  -6.757
    7   HE21  GLN  78          HE21      GLN  78  -4.765  -1.947  -4.097
    8   HE22  GLN  78          HE22      GLN  78  -5.609  -3.416  -4.212

  No H/Q in entry =           8
  In of MODEL    5
    1    H    LEU  79           H        LEU  79   0.023  -2.631  -8.037
    2    HA   LEU  79           HA       LEU  79   0.975  -1.708  -5.580
    3    HB2  LEU  79           HB2      LEU  79   1.885  -3.704  -6.638
    4    HB3  LEU  79           HB3      LEU  79   2.518  -2.745  -7.973
    5    HG   LEU  79           HG       LEU  79   4.048  -1.573  -6.468
    6   HD13  LEU  79          HD11      LEU  79   3.032  -1.339  -4.405
    7   HD12  LEU  79          HD12      LEU  79   4.134  -2.667  -4.053
    8   HD11  LEU  79          HD13      LEU  79   2.436  -2.999  -4.387
    9   HD23  LEU  79          HD21      LEU  79   5.295  -3.695  -5.553
   10   HD22  LEU  79          HD22      LEU  79   5.094  -3.505  -7.293
   11   HD21  LEU  79          HD23      LEU  79   4.033  -4.592  -6.400

  No H/Q in entry =          11
  In of MODEL    5
    1    H    HIS  80           H        HIS  80   1.835  -0.587  -8.854
    2    HA   HIS  80           HA       HIS  80   3.602   1.438  -7.933
    3    HB2  HIS  80           HB2      HIS  80   2.334   0.710 -10.517
    4    HB3  HIS  80           HB3      HIS  80   2.897   2.374 -10.350
    5    HD1  HIS  80           HD1      HIS  80   5.294   2.718 -10.866
    6    HD2  HIS  80           HD2      HIS  80   4.545  -1.203  -9.663
    7    HE1  HIS  80           HE1      HIS  80   7.508   1.483 -11.020
    8    HE2  HIS  80           HE2      HIS  80   7.063  -0.910 -10.290

  No H/Q in entry =           8
  In of MODEL    5
    1    H    LEU  81           H        LEU  81   0.199   1.529  -8.924
    2    HA   LEU  81           HA       LEU  81  -0.131   4.317  -8.604
    3    HB2  LEU  81           HB2      LEU  81  -2.102   2.033  -8.524
    4    HB3  LEU  81           HB3      LEU  81  -2.588   3.727  -8.439
    5    HG   LEU  81           HG       LEU  81  -0.865   2.603 -10.665
    6   HD12  LEU  81          HD11      LEU  81  -3.099   2.875 -11.973
    7   HD11  LEU  81          HD12      LEU  81  -3.859   2.797 -10.384
    8   HD13  LEU  81          HD13      LEU  81  -2.887   1.446 -10.963
    9   HD23  LEU  81          HD21      LEU  81  -2.000   4.722 -11.774
   10   HD22  LEU  81          HD22      LEU  81  -0.591   4.924 -10.736
   11   HD21  LEU  81          HD23      LEU  81  -2.204   5.243 -10.103

  No H/Q in entry =          11
  In of MODEL    5
    1    H    MET  82           H        MET  82  -0.745   1.625  -6.348
    2    HA   MET  82           HA       MET  82  -1.836   3.197  -4.270
    3    HB2  MET  82           HB2      MET  82  -0.409   0.538  -4.296
    4    HB3  MET  82           HB3      MET  82  -1.007   1.256  -2.802
    5    HG2  MET  82           HG2      MET  82  -2.721   0.720  -5.248
    6    HG3  MET  82           HG3      MET  82  -2.627  -0.347  -3.849
    7    HE3  MET  82           HE1      MET  82  -4.391   1.277  -1.045
    8    HE2  MET  82           HE2      MET  82  -2.667   1.589  -1.225
    9    HE1  MET  82           HE3      MET  82  -3.322   0.016  -1.676

  No H/Q in entry =           9
  In of MODEL    5
    1    H    THR  83           H        THR  83   1.488   2.175  -4.945
    2    HA   THR  83           HA       THR  83   2.675   3.311  -2.644
    3    HB   THR  83           HB       THR  83   4.776   3.293  -4.110
    4    HG1  THR  83           HG1      THR  83   4.554   2.755  -6.133
    5   HG22  THR  83          HG21      THR  83   4.387   0.625  -4.435
    6   HG21  THR  83          HG22      THR  83   3.086   0.983  -3.300
    7   HG23  THR  83          HG23      THR  83   4.756   1.361  -2.876

  No H/Q in entry =           7
  In of MODEL    5
    1    H    SER  84           H        SER  84   2.291   4.572  -5.949
    2    HA   SER  84           HA       SER  84   3.579   7.040  -5.498
    3    HB2  SER  84           HB2      SER  84   1.533   6.160  -7.521
    4    HB3  SER  84           HB3      SER  84   2.179   7.801  -7.499
    5    HG   SER  84           HG       SER  84   3.602   5.353  -7.778

  No H/Q in entry =           5
  In of MODEL    5
    1    H    MET  85           H        MET  85   0.101   6.215  -5.335
    2    HA   MET  85           HA       MET  85  -0.815   8.809  -4.746
    3    HB2  MET  85           HB2      MET  85  -2.303   6.976  -5.414
    4    HB3  MET  85           HB3      MET  85  -1.997   6.169  -3.877
    5    HG2  MET  85           HG2      MET  85  -2.942   8.076  -2.657
    6    HG3  MET  85           HG3      MET  85  -3.189   8.940  -4.174
    7    HE1  MET  85           HE1      MET  85  -3.755   5.990  -2.080
    8    HE3  MET  85           HE2      MET  85  -4.048   4.906  -3.438
    9    HE2  MET  85           HE3      MET  85  -5.390   5.401  -2.410

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LEU  86           H        LEU  86   0.150   6.172  -2.590
    2    HA   LEU  86           HA       LEU  86  -0.417   7.472  -0.154
    3    HB2  LEU  86           HB2      LEU  86   0.096   5.009  -0.539
    4    HB3  LEU  86           HB3      LEU  86   1.795   5.472  -0.629
    5    HG   LEU  86           HG       LEU  86   1.440   6.633   1.634
    6   HD11  LEU  86          HD11      LEU  86  -1.237   5.814   1.156
    7   HD13  LEU  86          HD12      LEU  86  -0.591   6.578   2.606
    8   HD12  LEU  86          HD13      LEU  86  -0.647   4.820   2.492
    9   HD23  LEU  86          HD21      LEU  86   1.068   3.634   1.764
   10   HD22  LEU  86          HD22      LEU  86   2.048   4.665   2.804
   11   HD21  LEU  86          HD23      LEU  86   2.560   4.345   1.148

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ALA  87           H        ALA  87   2.575   7.229  -2.033
    2    HA   ALA  87           HA       ALA  87   4.248   8.676  -0.307
    3    HB3  ALA  87           HB1      ALA  87   4.371   7.657  -3.010
    4    HB2  ALA  87           HB2      ALA  87   5.696   8.016  -1.906
    5    HB1  ALA  87           HB3      ALA  87   5.061   9.282  -2.956

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ARG  88           H        ARG  88   2.289   9.768  -3.037
    2    HA   ARG  88           HA       ARG  88   3.013  12.471  -2.925
    3    HB2  ARG  88           HB2      ARG  88   1.787  11.291  -4.783
    4    HB3  ARG  88           HB3      ARG  88   0.324  11.410  -3.805
    5    HG2  ARG  88           HG2      ARG  88   1.296  14.009  -3.726
    6    HG3  ARG  88           HG3      ARG  88   1.735  13.498  -5.354
    7    HD2  ARG  88           HD2      ARG  88  -0.406  13.537  -6.059
    8    HD3  ARG  88           HD3      ARG  88  -0.982  12.677  -4.630
    9    HE   ARG  88           HE       ARG  88  -1.220  15.450  -5.057
   10   HH21  ARG  88          HH11      ARG  88  -1.777  16.775  -3.324
   11   HH22  ARG  88          HH12      ARG  88  -1.476  16.248  -1.704
   12   HH11  ARG  88          HH21      ARG  88  -0.171  13.213  -2.673
   13   HH12  ARG  88          HH22      ARG  88  -0.584  14.225  -1.335

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLU  89           H        GLU  89   0.335  10.753  -1.289
    2    HA   GLU  89           HA       GLU  89  -0.817  13.049  -0.094
    3    HB2  GLU  89           HB2      GLU  89  -1.895  10.790  -0.178
    4    HB3  GLU  89           HB3      GLU  89  -0.765  10.258   1.068
    5    HG2  GLU  89           HG2      GLU  89  -1.620  11.946   2.620
    6    HG3  GLU  89           HG3      GLU  89  -2.680  12.595   1.371

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LEU  90           H        LEU  90   1.670  10.803   1.094
    2    HA   LEU  90           HA       LEU  90   1.997  12.060   3.621
    3    HB2  LEU  90           HB2      LEU  90   3.805  10.313   1.954
    4    HB3  LEU  90           HB3      LEU  90   4.210  10.841   3.593
    5    HG   LEU  90           HG       LEU  90   1.601   9.448   2.927
    6   HD12  LEU  90          HD11      LEU  90   2.773   7.425   3.945
    7   HD11  LEU  90          HD12      LEU  90   4.281   8.306   3.705
    8   HD13  LEU  90          HD13      LEU  90   3.281   7.878   2.316
    9   HD22  LEU  90          HD21      LEU  90   1.314  10.373   5.046
   10   HD21  LEU  90          HD22      LEU  90   3.033  10.296   5.434
   11   HD23  LEU  90          HD23      LEU  90   2.051   8.832   5.483

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  91           H        ILE  91   3.603  12.462   0.498
    2    HA   ILE  91           HA       ILE  91   5.546  14.328   1.338
    3    HB   ILE  91           HB       ILE  91   4.251  13.809  -1.344
    4   HG12  ILE  91          HG12      ILE  91   7.088  13.372  -0.360
    5   HG13  ILE  91          HG13      ILE  91   5.826  12.153  -0.198
    6   HG22  ILE  91          HG21      ILE  91   6.453  15.191  -2.030
    7   HG21  ILE  91          HG22      ILE  91   6.125  15.990  -0.492
    8   HG23  ILE  91          HG23      ILE  91   4.906  15.995  -1.764
    9   HD13  ILE  91          HD11      ILE  91   5.665  11.821  -2.505
   10   HD12  ILE  91          HD12      ILE  91   7.395  12.093  -2.287
   11   HD11  ILE  91          HD13      ILE  91   6.364  13.397  -2.880

  No H/Q in entry =          11
  In of MODEL    5
    1    H    THR  92           H        THR  92   2.180  14.702   0.319
    2    HA   THR  92           HA       THR  92   2.108  17.525   0.251
    3    HB   THR  92           HB       THR  92  -0.029  15.496   0.949
    4    HG1  THR  92           HG1      THR  92   0.285  15.317  -1.134
    5   HG22  THR  92          HG21      THR  92  -1.463  17.633   0.217
    6   HG21  THR  92          HG22      THR  92  -0.086  18.483   0.916
    7   HG23  THR  92          HG23      THR  92  -1.012  17.348   1.898

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLU  93           H        GLU  93   1.589  15.222   2.910
    2    HA   GLU  93           HA       GLU  93   1.020  17.123   4.921
    3    HB2  GLU  93           HB2      GLU  93   2.377  14.420   5.168
    4    HB3  GLU  93           HB3      GLU  93   1.667  15.340   6.497
    5    HG2  GLU  93           HG2      GLU  93   0.075  14.529   4.055
    6    HG3  GLU  93           HG3      GLU  93   0.189  13.512   5.487

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LEU  94           H        LEU  94   4.054  15.687   3.785
    2    HA   LEU  94           HA       LEU  94   5.780  16.868   5.675
    3    HB2  LEU  94           HB2      LEU  94   6.206  15.900   2.848
    4    HB3  LEU  94           HB3      LEU  94   7.521  16.582   3.799
    5    HG   LEU  94           HG       LEU  94   5.814  14.361   4.935
    6   HD11  LEU  94          HD11      LEU  94   7.920  14.163   2.811
    7   HD13  LEU  94          HD12      LEU  94   6.489  13.167   3.070
    8   HD12  LEU  94          HD13      LEU  94   7.915  12.940   4.082
    9   HD23  LEU  94          HD21      LEU  94   8.009  13.863   6.095
   10   HD22  LEU  94          HD22      LEU  94   7.315  15.431   6.506
   11   HD21  LEU  94          HD23      LEU  94   8.659  15.329   5.367

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  95           H        ILE  95   4.631  18.012   2.518
    2    HA   ILE  95           HA       ILE  95   6.165  20.395   2.457
    3    HB   ILE  95           HB       ILE  95   3.536  19.665   1.146
    4   HG12  ILE  95          HG12      ILE  95   6.322  20.044   0.016
    5   HG13  ILE  95          HG13      ILE  95   5.697  18.482   0.533
    6   HG21  ILE  95          HG21      ILE  95   5.246  22.160   0.924
    7   HG23  ILE  95          HG22      ILE  95   3.521  22.065   1.275
    8   HG22  ILE  95          HG23      ILE  95   4.116  21.670  -0.338
    9   HD13  ILE  95          HD11      ILE  95   4.144  18.377  -1.200
   10   HD12  ILE  95          HD12      ILE  95   5.482  19.214  -1.987
   11   HD11  ILE  95          HD13      ILE  95   4.092  20.128  -1.401

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLU  96           H        GLU  96   2.923  19.694   3.744
    2    HA   GLU  96           HA       GLU  96   2.258  22.332   4.487
    3    HB2  GLU  96           HB2      GLU  96   0.612  20.522   4.498
    4    HB3  GLU  96           HB3      GLU  96   1.483  19.712   5.798
    5    HG2  GLU  96           HG2      GLU  96   0.437  20.983   7.361
    6    HG3  GLU  96           HG3      GLU  96   0.951  22.464   6.562

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LEU  97           H        LEU  97   4.136  19.816   6.124
    2    HA   LEU  97           HA       LEU  97   4.464  21.176   8.592
    3    HB2  LEU  97           HB2      LEU  97   6.040  19.029   7.189
    4    HB3  LEU  97           HB3      LEU  97   6.615  19.727   8.701
    5    HG   LEU  97           HG       LEU  97   3.824  18.588   8.384
    6   HD12  LEU  97          HD11      LEU  97   4.792  16.594   9.605
    7   HD11  LEU  97          HD12      LEU  97   6.394  17.249   9.264
    8   HD13  LEU  97          HD13      LEU  97   5.336  16.771   7.937
    9   HD23  LEU  97          HD21      LEU  97   4.273  18.307  10.951
   10   HD22  LEU  97          HD22      LEU  97   3.870  19.911  10.341
   11   HD21  LEU  97          HD23      LEU  97   5.547  19.499  10.692

  No H/Q in entry =          11
  In of MODEL    5
    1    H    HIS  98           H        HIS  98   6.344  21.214   5.573
    2    HA   HIS  98           HA       HIS  98   8.470  22.830   6.474
    3    HB2  HIS  98           HB2      HIS  98   7.189  22.547   3.745
    4    HB3  HIS  98           HB3      HIS  98   8.613  23.549   4.037
    5    HD1  HIS  98           HD1      HIS  98   7.457  19.960   4.063
    6    HD2  HIS  98           HD2      HIS  98  11.004  22.113   4.493
    7    HE1  HIS  98           HE1      HIS  98   9.339  18.259   4.016
    8    HE2  HIS  98           HE2      HIS  98  11.503  19.550   4.278

  No H/Q in entry =           8
  In of MODEL    5
    1    H    GLU  99           H        GLU  99   5.240  23.611   5.287
    2    HA   GLU  99           HA       GLU  99   5.575  26.432   5.222
    3    HB2  GLU  99           HB2      GLU  99   3.718  25.230   4.089
    4    HB3  GLU  99           HB3      GLU  99   3.023  24.862   5.667
    5    HG2  GLU  99           HG2      GLU  99   2.804  27.252   6.161
    6    HG3  GLU  99           HG3      GLU  99   3.579  27.660   4.633

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LYS 100           H        LYS 100   4.471  24.186   7.747
    2    HA   LYS 100           HA       LYS 100   3.847  26.235   9.633
    3    HB2  LYS 100           HB2      LYS 100   4.467  23.294   9.989
    4    HB3  LYS 100           HB3      LYS 100   3.999  24.363  11.317
    5    HG2  LYS 100           HG2      LYS 100   1.928  24.966  10.061
    6    HG3  LYS 100           HG3      LYS 100   2.376  23.800   8.812
    7    HD2  LYS 100           HD2      LYS 100   2.321  21.983  10.478
    8    HD3  LYS 100           HD3      LYS 100   1.890  23.142  11.738
    9    HE2  LYS 100           HE2      LYS 100  -0.169  23.729  10.467
   10    HE3  LYS 100           HE3      LYS 100   0.254  22.512   9.255
   11    HZ1  LYS 100           HZ1      LYS 100  -0.011  21.849  12.137
   12    HZ3  LYS 100           HZ2      LYS 100  -0.006  20.792  10.805
   13    HZ2  LYS 100           HZ3      LYS 100  -1.338  21.811  11.078

  No H/Q in entry =          13
  In of MODEL    5
    1    H    LEU 101           H        LEU 101   6.801  24.482   8.813
    2    HA   LEU 101           HA       LEU 101   8.379  25.352  11.020
    3    HB2  LEU 101           HB2      LEU 101   8.997  24.367   8.246
    4    HB3  LEU 101           HB3      LEU 101  10.286  25.055   9.230
    5    HG   LEU 101           HG       LEU 101   8.484  22.874  10.293
    6   HD12  LEU 101          HD11      LEU 101  10.562  21.408   9.695
    7   HD11  LEU 101          HD12      LEU 101  10.913  22.674   8.520
    8   HD13  LEU 101          HD13      LEU 101   9.398  21.778   8.424
    9   HD21  LEU 101          HD21      LEU 101  11.188  24.025  11.026
   10   HD23  LEU 101          HD22      LEU 101  10.667  22.446  11.609
   11   HD22  LEU 101          HD23      LEU 101   9.752  23.889  12.040

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LYS 102           H        LYS 102   6.775  27.186   8.869
    2    HA   LYS 102           HA       LYS 102   6.819  29.479   8.571
    3    HB2  LYS 102           HB2      LYS 102   8.379  29.393  10.675
    4    HB3  LYS 102           HB3      LYS 102   9.679  29.603   9.519
    5    HG2  LYS 102           HG2      LYS 102   7.542  31.527  10.369
    6    HG3  LYS 102           HG3      LYS 102   9.251  31.812  10.122
    7    HD2  LYS 102           HD2      LYS 102   7.314  31.354   7.818
    8    HD3  LYS 102           HD3      LYS 102   7.671  32.941   8.483
    9    HE2  LYS 102           HE2      LYS 102   9.068  31.771   6.417
   10    HE3  LYS 102           HE3      LYS 102   9.662  33.090   7.427
   11    HZ2  LYS 102           HZ1      LYS 102  11.211  31.207   7.261
   12    HZ1  LYS 102           HZ2      LYS 102  10.061  30.210   8.003
   13    HZ3  LYS 102           HZ3      LYS 102  10.732  31.509   8.860

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ALA 103           H        ALA 103  10.097  28.187   8.020
    2    HA   ALA 103           HA       ALA 103  11.047  29.573   5.944
    3    HB2  ALA 103           HB1      ALA 103  11.968  27.369   5.025
    4    HB1  ALA 103           HB2      ALA 103  11.080  26.585   6.330
    5    HB3  ALA 103           HB3      ALA 103  12.352  27.749   6.704

  No H/Q in entry =           5
  In of MODEL    5
    1    H1   LYS   3           H1       LYS   3 -31.057   6.655 -19.451
    2    H2   LYS   3           H3       LYS   3 -30.096   6.345 -20.816
    3    H3   LYS   3           H2       LYS   3 -31.514   5.449 -20.554
    4    HA   LYS   3           HA       LYS   3 -30.533   4.023 -19.172
    5    HB2  LYS   3           HB2      LYS   3 -28.230   5.376 -20.528
    6    HB3  LYS   3           HB3      LYS   3 -27.924   4.151 -19.296
    7    HG2  LYS   3           HG2      LYS   3 -29.410   2.616 -20.635
    8    HG3  LYS   3           HG3      LYS   3 -29.348   3.822 -21.920
    9    HD2  LYS   3           HD2      LYS   3 -26.868   3.635 -21.905
   10    HD3  LYS   3           HD3      LYS   3 -27.009   2.334 -20.723
   11    HE2  LYS   3           HE2      LYS   3 -28.565   1.213 -22.426
   12    HE3  LYS   3           HE3      LYS   3 -27.927   2.379 -23.583
   13    HZ3  LYS   3           HZ1      LYS   3 -26.169   1.100 -23.885
   14    HZ2  LYS   3           HZ2      LYS   3 -26.819  -0.056 -22.824
   15    HZ1  LYS   3           HZ3      LYS   3 -25.785   1.155 -22.232

  No H/Q in entry =          15
  In of MODEL    5
    1    H    LYS   4           H        LYS   4 -30.562   3.870 -17.112
    2    HA   LYS   4           HA       LYS   4 -29.742   6.124 -15.458
    3    HB2  LYS   4           HB2      LYS   4 -31.014   3.464 -14.757
    4    HB3  LYS   4           HB3      LYS   4 -30.737   4.788 -13.627
    5    HG2  LYS   4           HG2      LYS   4 -32.579   4.795 -16.023
    6    HG3  LYS   4           HG3      LYS   4 -33.044   4.850 -14.324
    7    HD2  LYS   4           HD2      LYS   4 -32.277   7.049 -14.055
    8    HD3  LYS   4           HD3      LYS   4 -31.260   6.968 -15.493
    9    HE2  LYS   4           HE2      LYS   4 -33.149   8.402 -15.921
   10    HE3  LYS   4           HE3      LYS   4 -33.288   6.939 -16.896
   11    HZ3  LYS   4           HZ1      LYS   4 -34.869   6.065 -15.332
   12    HZ2  LYS   4           HZ2      LYS   4 -35.386   7.581 -15.901
   13    HZ1  LYS   4           HZ3      LYS   4 -34.711   7.440 -14.348

  No H/Q in entry =          13
  In of MODEL    5
    1    H    HIS   5           H        HIS   5 -28.250   6.154 -13.887
    2    HA   HIS   5           HA       HIS   5 -26.030   4.257 -14.260
    3    HB2  HIS   5           HB2      HIS   5 -26.182   7.011 -13.036
    4    HB3  HIS   5           HB3      HIS   5 -24.731   6.011 -13.044
    5    HD1  HIS   5           HD1      HIS   5 -23.246   7.173 -14.648
    6    HD2  HIS   5           HD2      HIS   5 -27.085   6.681 -16.152
    7    HE1  HIS   5           HE1      HIS   5 -23.093   7.762 -17.097
    8    HE2  HIS   5           HE2      HIS   5 -25.435   7.451 -17.982

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ILE   6           H        ILE   6 -25.833   2.670 -12.956
    2    HA   ILE   6           HA       ILE   6 -26.761   2.952 -10.177
    3    HB   ILE   6           HB       ILE   6 -26.036   0.470 -11.739
    4   HG12  ILE   6          HG12      ILE   6 -28.737   1.489 -10.845
    5   HG13  ILE   6          HG13      ILE   6 -28.112   1.639 -12.488
    6   HG23  ILE   6          HG21      ILE   6 -26.425  -0.781  -9.881
    7   HG22  ILE   6          HG22      ILE   6 -27.534   0.397  -9.180
    8   HG21  ILE   6          HG23      ILE   6 -25.795   0.677  -9.112
    9   HD13  ILE   6          HD11      ILE   6 -28.646  -0.461 -12.993
   10   HD12  ILE   6          HD12      ILE   6 -29.640  -0.420 -11.536
   11   HD11  ILE   6          HD13      ILE   6 -28.006  -1.081 -11.470

  No H/Q in entry =          11
  In of MODEL    5
    1    H    TYR   7           H        TYR   7 -24.964   3.528  -8.911
    2    HA   TYR   7           HA       TYR   7 -22.296   2.488  -9.634
    3    HB2  TYR   7           HB2      TYR   7 -23.159   4.943  -8.127
    4    HB3  TYR   7           HB3      TYR   7 -21.493   4.374  -8.191
    5    HD1  TYR   7           HD1      TYR   7 -22.605   3.485 -11.272
    6    HD2  TYR   7           HD2      TYR   7 -21.788   7.019  -9.036
    7    HE1  TYR   7           HE1      TYR   7 -22.162   4.711 -13.362
    8    HE2  TYR   7           HE2      TYR   7 -21.387   8.253 -11.116
    9    HH   TYR   7           HH       TYR   7 -21.639   8.188 -13.346

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LEU   8           H        LEU   8 -21.356   1.097  -8.326
    2    HA   LEU   8           HA       LEU   8 -22.465   0.624  -5.630
    3    HB2  LEU   8           HB2      LEU   8 -20.843  -1.082  -7.497
    4    HB3  LEU   8           HB3      LEU   8 -21.017  -1.469  -5.785
    5    HG   LEU   8           HG       LEU   8 -23.507  -1.558  -6.174
    6   HD13  LEU   8          HD11      LEU   8 -23.627  -0.326  -8.275
    7   HD12  LEU   8          HD12      LEU   8 -24.214  -1.970  -8.517
    8   HD11  LEU   8          HD13      LEU   8 -22.598  -1.522  -9.061
    9   HD23  LEU   8          HD21      LEU   8 -22.324  -3.629  -7.896
   10   HD22  LEU   8          HD22      LEU   8 -23.397  -3.769  -6.504
   11   HD21  LEU   8          HD23      LEU   8 -21.676  -3.474  -6.264

  No H/Q in entry =          11
  In of MODEL    5
    1    H    PHE   9           H        PHE   9 -21.151   0.954  -3.856
    2    HA   PHE   9           HA       PHE   9 -18.349   1.814  -4.403
    3    HB2  PHE   9           HB2      PHE   9 -20.315   2.903  -2.395
    4    HB3  PHE   9           HB3      PHE   9 -18.590   3.238  -2.342
    5    HD1  PHE   9           HD1      PHE   9 -17.498   4.501  -4.158
    6    HD2  PHE   9           HD2      PHE   9 -21.747   3.917  -4.073
    7    HE1  PHE   9           HE1      PHE   9 -17.776   6.273  -5.864
    8    HE2  PHE   9           HE2      PHE   9 -22.026   5.701  -5.775
    9    HZ   PHE   9           HZ       PHE   9 -20.038   6.875  -6.677

  No H/Q in entry =           9
  In of MODEL    5
    1    H    SER  10           H        SER  10 -16.779   0.758  -3.382
    2    HA   SER  10           HA       SER  10 -16.951  -0.196  -0.699
    3    HB2  SER  10           HB2      SER  10 -18.223  -2.006  -1.813
    4    HB3  SER  10           HB3      SER  10 -16.863  -2.271  -2.893
    5    HG   SER  10           HG       SER  10 -16.068  -3.473  -1.395

  No H/Q in entry =           5
  In of MODEL    5
    1    H    SER  11           H        SER  11 -14.924  -0.064   0.089
    2    HA   SER  11           HA       SER  11 -12.759   0.772  -1.470
    3    HB2  SER  11           HB2      SER  11 -13.202   0.832   1.121
    4    HB3  SER  11           HB3      SER  11 -12.267  -0.664   1.094
    5    HG   SER  11           HG       SER  11 -10.596   0.603   0.979

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA  12           H        ALA  12 -14.008  -1.916  -2.261
    2    HA   ALA  12           HA       ALA  12 -11.455  -3.163  -2.893
    3    HB2  ALA  12           HB1      ALA  12 -12.119  -5.394  -2.158
    4    HB1  ALA  12           HB2      ALA  12 -13.644  -4.761  -1.541
    5    HB3  ALA  12           HB3      ALA  12 -12.123  -4.277  -0.791

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLY  13           H        GLY  13 -12.218  -2.193  -4.903
    2    HA3  GLY  13           HA2      GLY  13 -14.524  -2.795  -6.310
    3    HA2  GLY  13           HA3      GLY  13 -12.973  -2.423  -7.076

  No H/Q in entry =           3
  In of MODEL    5
    1    H    MET  14           H        MET  14 -11.516  -4.740  -6.251
    2    HA   MET  14           HA       MET  14 -12.081  -6.485  -8.317
    3    HB2  MET  14           HB2      MET  14  -9.964  -6.636  -7.103
    4    HB3  MET  14           HB3      MET  14 -10.789  -7.281  -5.684
    5    HG2  MET  14           HG2      MET  14 -11.507  -9.246  -7.020
    6    HG3  MET  14           HG3      MET  14 -10.661  -8.592  -8.424
    7    HE1  MET  14           HE1      MET  14  -8.454  -8.075  -8.646
    8    HE3  MET  14           HE2      MET  14  -7.071  -8.844  -7.869
    9    HE2  MET  14           HE3      MET  14  -7.804  -7.419  -7.136

  No H/Q in entry =           9
  In of MODEL    5
    1    H    SER  15           H        SER  15 -13.192  -6.931  -4.950
    2    HA   SER  15           HA       SER  15 -14.637  -9.333  -5.635
    3    HB2  SER  15           HB2      SER  15 -13.919  -8.951  -3.294
    4    HB3  SER  15           HB3      SER  15 -15.014  -7.576  -3.196
    5    HG   SER  15           HG       SER  15 -16.670  -9.201  -3.893

  No H/Q in entry =           5
  In of MODEL    5
    1    H    THR  16           H        THR  16 -15.617  -5.929  -5.130
    2    HA   THR  16           HA       THR  16 -18.432  -6.344  -5.578
    3    HB   THR  16           HB       THR  16 -16.817  -3.827  -6.114
    4    HG1  THR  16           HG1      THR  16 -16.324  -4.258  -4.068
    5   HG22  THR  16          HG21      THR  16 -19.023  -2.814  -5.318
    6   HG21  THR  16          HG22      THR  16 -19.718  -4.433  -5.503
    7   HG23  THR  16          HG23      THR  16 -19.047  -3.582  -6.901

  No H/Q in entry =           7
  In of MODEL    5
    1    H    SER  17           H        SER  17 -15.653  -5.848  -7.490
    2    HA   SER  17           HA       SER  17 -16.788  -5.058  -9.972
    3    HB2  SER  17           HB2      SER  17 -14.197  -6.474  -9.320
    4    HB3  SER  17           HB3      SER  17 -14.645  -5.992 -10.957
    5    HG   SER  17           HG       SER  17 -15.012  -3.918  -9.347

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU  18           H        LEU  18 -16.303  -8.227  -8.548
    2    HA   LEU  18           HA       LEU  18 -16.966  -9.694 -10.903
    3    HB2  LEU  18           HB2      LEU  18 -15.753 -10.703  -9.020
    4    HB3  LEU  18           HB3      LEU  18 -17.164 -10.471  -7.988
    5    HG   LEU  18           HG       LEU  18 -18.459 -12.007  -9.363
    6   HD11  LEU  18          HD11      LEU  18 -16.004 -11.875 -11.077
    7   HD13  LEU  18          HD12      LEU  18 -17.702 -11.810 -11.550
    8   HD12  LEU  18          HD13      LEU  18 -16.977 -13.343 -11.069
    9   HD21  LEU  18          HD21      LEU  18 -16.929 -12.763  -7.500
   10   HD23  LEU  18          HD22      LEU  18 -15.838 -13.321  -8.770
   11   HD22  LEU  18          HD23      LEU  18 -17.466 -13.990  -8.649

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LEU  19           H        LEU  19 -18.861  -8.440  -8.161
    2    HA   LEU  19           HA       LEU  19 -21.370  -9.540  -8.967
    3    HB2  LEU  19           HB2      LEU  19 -21.068  -8.737  -6.718
    4    HB3  LEU  19           HB3      LEU  19 -20.702  -7.116  -7.306
    5    HG   LEU  19           HG       LEU  19 -23.042  -6.878  -8.043
    6   HD11  LEU  19          HD11      LEU  19 -23.402  -9.550  -6.674
    7   HD13  LEU  19          HD12      LEU  19 -23.580  -9.237  -8.400
    8   HD12  LEU  19          HD13      LEU  19 -24.706  -8.513  -7.252
    9   HD22  LEU  19          HD21      LEU  19 -22.550  -5.927  -5.971
   10   HD21  LEU  19          HD22      LEU  19 -22.413  -7.497  -5.180
   11   HD23  LEU  19          HD23      LEU  19 -23.995  -6.895  -5.675

  No H/Q in entry =          11
  In of MODEL    5
    1    H    VAL  20           H        VAL  20 -19.784  -6.424  -9.666
    2    HA   VAL  20           HA       VAL  20 -21.882  -5.307 -11.202
    3    HB   VAL  20           HB       VAL  20 -18.877  -4.810 -11.361
    4   HG12  VAL  20          HG11      VAL  20 -19.485  -2.738 -12.611
    5   HG11  VAL  20          HG12      VAL  20 -21.143  -3.329 -12.721
    6   HG13  VAL  20          HG13      VAL  20 -19.839  -4.211 -13.513
    7   HG23  VAL  20          HG21      VAL  20 -19.643  -2.608 -10.327
    8   HG22  VAL  20          HG22      VAL  20 -19.653  -4.039  -9.299
    9   HG21  VAL  20          HG23      VAL  20 -21.162  -3.439  -9.988

  No H/Q in entry =           9
  In of MODEL    5
    1    H    SER  21           H        SER  21 -19.203  -7.438 -12.275
    2    HA   SER  21           HA       SER  21 -20.019  -7.286 -15.015
    3    HB2  SER  21           HB2      SER  21 -18.651  -9.297 -15.377
    4    HB3  SER  21           HB3      SER  21 -17.770  -8.082 -14.451
    5    HG   SER  21           HG       SER  21 -19.029 -10.419 -13.498

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LYS  22           H        LYS  22 -21.121  -9.452 -12.441
    2    HA   LYS  22           HA       LYS  22 -22.733 -11.012 -14.251
    3    HB2  LYS  22           HB2      LYS  22 -22.972 -10.667 -11.259
    4    HB3  LYS  22           HB3      LYS  22 -23.835 -11.862 -12.225
    5    HG2  LYS  22           HG2      LYS  22 -20.837 -11.744 -11.941
    6    HG3  LYS  22           HG3      LYS  22 -21.895 -12.783 -10.987
    7    HD2  LYS  22           HD2      LYS  22 -22.658 -13.881 -13.055
    8    HD3  LYS  22           HD3      LYS  22 -21.559 -12.862 -13.986
    9    HE2  LYS  22           HE2      LYS  22 -19.641 -13.843 -12.816
   10    HE3  LYS  22           HE3      LYS  22 -20.729 -14.845 -11.854
   11    HZ3  LYS  22           HZ1      LYS  22 -21.332 -16.085 -13.740
   12    HZ2  LYS  22           HZ2      LYS  22 -19.639 -15.966 -13.778
   13    HZ1  LYS  22           HZ3      LYS  22 -20.582 -14.997 -14.806

  No H/Q in entry =          13
  In of MODEL    5
    1    H    MET  23           H        MET  23 -23.337  -8.079 -12.358
    2    HA   MET  23           HA       MET  23 -26.152  -8.062 -12.830
    3    HB2  MET  23           HB2      MET  23 -24.224  -5.819 -12.268
    4    HB3  MET  23           HB3      MET  23 -25.964  -5.592 -12.422
    5    HG2  MET  23           HG2      MET  23 -26.374  -6.893 -10.456
    6    HG3  MET  23           HG3      MET  23 -24.677  -7.362 -10.353
    7    HE2  MET  23           HE1      MET  23 -26.838  -3.643  -9.116
    8    HE1  MET  23           HE2      MET  23 -27.142  -4.594 -10.568
    9    HE3  MET  23           HE3      MET  23 -26.062  -3.202 -10.638

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ARG  24           H        ARG  24 -23.376  -6.716 -14.641
    2    HA   ARG  24           HA       ARG  24 -24.853  -5.354 -16.613
    3    HB2  ARG  24           HB2      ARG  24 -22.070  -6.556 -16.640
    4    HB3  ARG  24           HB3      ARG  24 -22.723  -5.702 -18.015
    5    HG2  ARG  24           HG2      ARG  24 -23.068  -3.682 -16.417
    6    HG3  ARG  24           HG3      ARG  24 -22.002  -4.575 -15.302
    7    HD2  ARG  24           HD2      ARG  24 -21.337  -3.936 -18.213
    8    HD3  ARG  24           HD3      ARG  24 -20.773  -3.009 -16.829
    9    HE   ARG  24           HE       ARG  24 -19.814  -5.649 -17.456
   10   HH21  ARG  24          HH11      ARG  24 -18.618  -6.521 -15.763
   11   HH22  ARG  24          HH12      ARG  24 -17.804  -5.468 -14.659
   12   HH11  ARG  24          HH21      ARG  24 -19.453  -2.627 -15.978
   13   HH12  ARG  24          HH22      ARG  24 -18.296  -3.165 -14.801

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ALA  25           H        ALA  25 -23.843  -8.730 -16.371
    2    HA   ALA  25           HA       ALA  25 -24.531  -9.523 -19.004
    3    HB1  ALA  25           HB1      ALA  25 -23.896 -11.581 -18.329
    4    HB3  ALA  25           HB2      ALA  25 -24.935 -11.534 -16.905
    5    HB2  ALA  25           HB3      ALA  25 -23.352 -10.760 -16.867

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLN  26           H        GLN  26 -26.320  -9.518 -15.958
    2    HA   GLN  26           HA       GLN  26 -28.717 -10.634 -16.953
    3    HB2  GLN  26           HB2      GLN  26 -28.115  -8.920 -14.562
    4    HB3  GLN  26           HB3      GLN  26 -29.706  -9.586 -14.896
    5    HG2  GLN  26           HG2      GLN  26 -27.166 -11.135 -14.469
    6    HG3  GLN  26           HG3      GLN  26 -28.509 -10.992 -13.342
    7   HE21  GLN  26          HE21      GLN  26 -27.382 -13.189 -14.647
    8   HE22  GLN  26          HE22      GLN  26 -28.471 -14.194 -15.436

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ALA  27           H        ALA  27 -27.661  -7.272 -16.551
    2    HA   ALA  27           HA       ALA  27 -30.121  -6.090 -17.297
    3    HB1  ALA  27           HB1      ALA  27 -28.253  -4.845 -16.197
    4    HB3  ALA  27           HB2      ALA  27 -28.834  -4.049 -17.660
    5    HB2  ALA  27           HB3      ALA  27 -27.330  -4.969 -17.696

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLU  28           H        GLU  28 -27.486  -7.392 -19.208
    2    HA   GLU  28           HA       GLU  28 -28.416  -6.303 -21.709
    3    HB2  GLU  28           HB2      GLU  28 -26.055  -7.072 -21.119
    4    HB3  GLU  28           HB3      GLU  28 -26.660  -8.715 -21.325
    5    HG2  GLU  28           HG2      GLU  28 -25.511  -7.964 -23.302
    6    HG3  GLU  28           HG3      GLU  28 -27.223  -8.227 -23.632

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LYS  29           H        LYS  29 -28.669  -9.413 -20.071
    2    HA   LYS  29           HA       LYS  29 -30.047 -10.822 -22.069
    3    HB2  LYS  29           HB2      LYS  29 -29.008 -11.857 -20.085
    4    HB3  LYS  29           HB3      LYS  29 -30.242 -11.113 -19.069
    5    HG2  LYS  29           HG2      LYS  29 -31.963 -12.419 -20.126
    6    HG3  LYS  29           HG3      LYS  29 -30.801 -13.087 -21.269
    7    HD2  LYS  29           HD2      LYS  29 -29.678 -14.306 -19.559
    8    HD3  LYS  29           HD3      LYS  29 -30.540 -13.442 -18.286
    9    HE2  LYS  29           HE2      LYS  29 -31.378 -15.761 -18.655
   10    HE3  LYS  29           HE3      LYS  29 -32.616 -14.523 -18.875
   11    HZ1  LYS  29           HZ1      LYS  29 -32.086 -14.659 -21.310
   12    HZ3  LYS  29           HZ2      LYS  29 -32.846 -16.024 -20.645
   13    HZ2  LYS  29           HZ3      LYS  29 -31.180 -16.051 -20.963

  No H/Q in entry =          13
  In of MODEL    5
    1    H    TYR  30           H        TYR  30 -31.334  -8.689 -19.533
    2    HA   TYR  30           HA       TYR  30 -34.026  -9.036 -20.744
    3    HB2  TYR  30           HB2      TYR  30 -33.300  -7.926 -18.023
    4    HB3  TYR  30           HB3      TYR  30 -34.933  -8.123 -18.658
    5    HD1  TYR  30           HD1      TYR  30 -35.925 -10.380 -18.877
    6    HD2  TYR  30           HD2      TYR  30 -32.047  -9.804 -17.216
    7    HE1  TYR  30           HE1      TYR  30 -35.907 -12.716 -18.097
    8    HE2  TYR  30           HE2      TYR  30 -32.029 -12.125 -16.440
    9    HH   TYR  30           HH       TYR  30 -33.763 -14.420 -17.529

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLU  31           H        GLU  31 -31.803  -7.114 -21.557
    2    HA   GLU  31           HA       GLU  31 -31.665  -4.955 -22.366
    3    HB2  GLU  31           HB2      GLU  31 -34.589  -5.566 -22.847
    4    HB3  GLU  31           HB3      GLU  31 -33.711  -4.223 -23.577
    5    HG2  GLU  31           HG2      GLU  31 -32.303  -5.702 -24.797
    6    HG3  GLU  31           HG3      GLU  31 -32.905  -7.102 -23.912

  No H/Q in entry =           6
  In of MODEL    5
    1    H    VAL  32           H        VAL  32 -31.826  -4.868 -19.631
    2    HA   VAL  32           HA       VAL  32 -33.608  -2.697 -18.934
    3    HB   VAL  32           HB       VAL  32 -31.231  -3.784 -17.389
    4   HG12  VAL  32          HG11      VAL  32 -32.715  -2.922 -15.469
    5   HG11  VAL  32          HG12      VAL  32 -33.532  -1.982 -16.717
    6   HG13  VAL  32          HG13      VAL  32 -31.813  -1.738 -16.415
    7   HG21  VAL  32          HG21      VAL  32 -33.065  -5.438 -18.068
    8   HG23  VAL  32          HG22      VAL  32 -34.062  -4.585 -16.889
    9   HG22  VAL  32          HG23      VAL  32 -32.564  -5.363 -16.379

  No H/Q in entry =           9
  In of MODEL    5
    1    HA   PRO  33           HA       PRO  33 -30.500   0.141 -20.624
    2    HB2  PRO  33           HB2      PRO  33 -31.934   2.412 -20.464
    3    HB3  PRO  33           HB3      PRO  33 -32.460   1.134 -21.562
    4    HG2  PRO  33           HG2      PRO  33 -33.376   1.660 -18.733
    5    HG3  PRO  33           HG3      PRO  33 -34.364   1.495 -20.185
    6    HD2  PRO  33           HD2      PRO  33 -33.958  -0.604 -18.540
    7    HD3  PRO  33           HD3      PRO  33 -34.049  -0.830 -20.287

  No H/Q in entry =           7
  In of MODEL    5
    1    H    VAL  34           H        VAL  34 -29.231  -0.460 -18.694
    2    HA   VAL  34           HA       VAL  34 -28.847   1.941 -17.033
    3    HB   VAL  34           HB       VAL  34 -28.291   0.445 -15.113
    4   HG12  VAL  34          HG11      VAL  34 -30.727  -0.350 -14.782
    5   HG11  VAL  34          HG12      VAL  34 -31.037   0.433 -16.330
    6   HG13  VAL  34          HG13      VAL  34 -30.435   1.380 -14.969
    7   HG21  VAL  34          HG21      VAL  34 -28.567  -1.558 -17.134
    8   HG23  VAL  34          HG22      VAL  34 -29.619  -1.894 -15.758
    9   HG22  VAL  34          HG23      VAL  34 -27.888  -1.665 -15.510

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ILE  35           H        ILE  35 -26.847   2.305 -16.214
    2    HA   ILE  35           HA       ILE  35 -24.603   0.911 -17.516
    3    HB   ILE  35           HB       ILE  35 -24.899   3.806 -16.678
    4   HG12  ILE  35          HG12      ILE  35 -23.990   2.487 -19.244
    5   HG13  ILE  35          HG13      ILE  35 -25.597   3.159 -18.960
    6   HG21  ILE  35          HG21      ILE  35 -22.392   2.193 -17.031
    7   HG23  ILE  35          HG22      ILE  35 -22.793   3.377 -15.788
    8   HG22  ILE  35          HG23      ILE  35 -22.413   3.911 -17.425
    9   HD11  ILE  35          HD11      ILE  35 -24.117   5.302 -18.360
   10   HD13  ILE  35          HD12      ILE  35 -24.687   4.950 -19.992
   11   HD12  ILE  35          HD13      ILE  35 -23.042   4.523 -19.520

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ILE  36           H        ILE  36 -23.387  -0.164 -15.940
    2    HA   ILE  36           HA       ILE  36 -23.772   0.441 -13.060
    3    HB   ILE  36           HB       ILE  36 -23.046  -2.278 -14.198
    4   HG12  ILE  36          HG12      ILE  36 -25.816  -1.388 -13.393
    5   HG13  ILE  36          HG13      ILE  36 -25.265  -1.372 -15.068
    6   HG23  ILE  36          HG21      ILE  36 -23.397  -3.111 -12.087
    7   HG22  ILE  36          HG22      ILE  36 -24.476  -1.796 -11.624
    8   HG21  ILE  36          HG23      ILE  36 -22.737  -1.519 -11.714
    9   HD13  ILE  36          HD11      ILE  36 -25.504  -3.578 -15.289
   10   HD12  ILE  36          HD12      ILE  36 -26.548  -3.433 -13.875
   11   HD11  ILE  36          HD13      ILE  36 -24.861  -3.909 -13.681

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLU  37           H        GLU  37 -21.957   1.004 -11.973
    2    HA   GLU  37           HA       GLU  37 -19.306   0.130 -12.929
    3    HB2  GLU  37           HB2      GLU  37 -19.976   2.937 -12.060
    4    HB3  GLU  37           HB3      GLU  37 -18.384   2.336 -12.524
    5    HG2  GLU  37           HG2      GLU  37 -20.748   2.578 -14.362
    6    HG3  GLU  37           HG3      GLU  37 -19.430   3.743 -14.234

  No H/Q in entry =           6
  In of MODEL    5
    1    H    ALA  38           H        ALA  38 -17.806  -0.169 -11.267
    2    HA   ALA  38           HA       ALA  38 -18.797   0.020  -8.483
    3    HB1  ALA  38           HB1      ALA  38 -17.163  -1.961  -9.945
    4    HB3  ALA  38           HB2      ALA  38 -18.202  -2.175  -8.535
    5    HB2  ALA  38           HB3      ALA  38 -16.566  -1.544  -8.338

  No H/Q in entry =           5
  In of MODEL    5
    1    H    PHE  39           H        PHE  39 -17.500   1.178  -7.016
    2    HA   PHE  39           HA       PHE  39 -14.950   2.308  -7.935
    3    HB2  PHE  39           HB2      PHE  39 -17.298   3.865  -6.869
    4    HB3  PHE  39           HB3      PHE  39 -15.649   4.481  -6.814
    5    HD1  PHE  39           HD1      PHE  39 -14.379   4.478  -9.090
    6    HD2  PHE  39           HD2      PHE  39 -18.621   4.354  -8.674
    7    HE1  PHE  39           HE1      PHE  39 -14.619   5.370 -11.389
    8    HE2  PHE  39           HE2      PHE  39 -18.876   5.235 -10.966
    9    HZ   PHE  39           HZ       PHE  39 -16.881   5.718 -12.343

  No H/Q in entry =           9
  In of MODEL    5
    1    HA   PRO  40           HA       PRO  40 -13.982   1.492  -3.667
    2    HB2  PRO  40           HB2      PRO  40 -12.146   3.447  -3.068
    3    HB3  PRO  40           HB3      PRO  40 -11.757   2.112  -4.152
    4    HG2  PRO  40           HG2      PRO  40 -12.709   4.883  -4.864
    5    HG3  PRO  40           HG3      PRO  40 -11.315   4.005  -5.494
    6    HD2  PRO  40           HD2      PRO  40 -13.556   3.994  -6.876
    7    HD3  PRO  40           HD3      PRO  40 -12.644   2.494  -6.708

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLU  41           H        GLU  41 -14.546   2.471  -1.522
    2    HA   GLU  41           HA       GLU  41 -16.739   4.240  -1.464
    3    HB2  GLU  41           HB2      GLU  41 -16.328   4.303   0.990
    4    HB3  GLU  41           HB3      GLU  41 -16.404   2.670   0.326
    5    HG2  GLU  41           HG2      GLU  41 -14.632   2.494   1.774
    6    HG3  GLU  41           HG3      GLU  41 -13.812   2.860   0.256

  No H/Q in entry =           6
  In of MODEL    5
    1    H    THR  42           H        THR  42 -13.383   5.059  -1.552
    2    HA   THR  42           HA       THR  42 -13.645   7.619  -0.317
    3    HB   THR  42           HB       THR  42 -11.485   8.138  -1.426
    4    HG1  THR  42           HG1      THR  42 -11.271   7.149  -3.277
    5   HG21  THR  42          HG21      THR  42 -11.659   5.362  -0.225
    6   HG23  THR  42          HG22      THR  42 -11.460   6.871   0.669
    7   HG22  THR  42          HG23      THR  42 -10.177   6.303  -0.397

  No H/Q in entry =           7
  In of MODEL    5
    1    H    LEU  43           H        LEU  43 -14.619   6.576  -3.413
    2    HA   LEU  43           HA       LEU  43 -14.802   9.362  -4.359
    3    HB2  LEU  43           HB2      LEU  43 -15.226   6.726  -5.754
    4    HB3  LEU  43           HB3      LEU  43 -15.465   8.303  -6.505
    5    HG   LEU  43           HG       LEU  43 -12.816   7.245  -5.550
    6   HD11  LEU  43          HD11      LEU  43 -14.007   6.120  -7.568
    7   HD13  LEU  43          HD12      LEU  43 -12.328   6.627  -7.733
    8   HD12  LEU  43          HD13      LEU  43 -13.617   7.620  -8.410
    9   HD23  LEU  43          HD21      LEU  43 -12.120   9.165  -7.174
   10   HD22  LEU  43          HD22      LEU  43 -12.627   9.561  -5.531
   11   HD21  LEU  43          HD23      LEU  43 -13.750   9.769  -6.875

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ALA  44           H        ALA  44 -16.777   7.581  -2.495
    2    HA   ALA  44           HA       ALA  44 -19.275   7.523  -3.786
    3    HB2  ALA  44           HB1      ALA  44 -19.143   6.387  -1.700
    4    HB3  ALA  44           HB2      ALA  44 -20.207   7.761  -1.403
    5    HB1  ALA  44           HB3      ALA  44 -18.527   7.817  -0.871

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLY  45           H        GLY  45 -17.754  10.269  -2.252
    2    HA3  GLY  45           HA2      GLY  45 -20.151  11.843  -2.570
    3    HA2  GLY  45           HA3      GLY  45 -18.582  12.417  -2.009

  No H/Q in entry =           3
  In of MODEL    5
    1    H    GLU  46           H        GLU  46 -17.107  11.454  -4.325
    2    HA   GLU  46           HA       GLU  46 -17.701  13.700  -6.070
    3    HB2  GLU  46           HB2      GLU  46 -15.569  11.559  -6.130
    4    HB3  GLU  46           HB3      GLU  46 -15.676  12.882  -7.292
    5    HG2  GLU  46           HG2      GLU  46 -15.259  14.502  -5.575
    6    HG3  GLU  46           HG3      GLU  46 -15.330  13.257  -4.327

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LYS  47           H        LYS  47 -17.691  10.183  -6.532
    2    HA   LYS  47           HA       LYS  47 -18.816  10.455  -9.191
    3    HB2  LYS  47           HB2      LYS  47 -17.693   8.307  -7.540
    4    HB3  LYS  47           HB3      LYS  47 -19.088   7.813  -8.499
    5    HG2  LYS  47           HG2      LYS  47 -17.072   7.351  -9.711
    6    HG3  LYS  47           HG3      LYS  47 -17.954   8.647 -10.514
    7    HD2  LYS  47           HD2      LYS  47 -16.513  10.293  -9.366
    8    HD3  LYS  47           HD3      LYS  47 -15.594   8.962  -8.667
    9    HE2  LYS  47           HE2      LYS  47 -15.917   9.516 -11.610
   10    HE3  LYS  47           HE3      LYS  47 -14.490   9.886 -10.643
   11    HZ2  LYS  47           HZ1      LYS  47 -14.343   7.789 -11.902
   12    HZ1  LYS  47           HZ2      LYS  47 -15.617   7.168 -10.969
   13    HZ3  LYS  47           HZ3      LYS  47 -14.148   7.587 -10.227

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLY  48           H        GLY  48 -20.120   9.713  -6.032
    2    HA3  GLY  48           HA2      GLY  48 -22.549   8.604  -6.751
    3    HA2  GLY  48           HA3      GLY  48 -22.275   9.580  -5.308

  No H/Q in entry =           3
  In of MODEL    5
    1    H    GLN  49           H        GLN  49 -21.642  11.996  -6.869
    2    HA   GLN  49           HA       GLN  49 -24.169  13.183  -6.972
    3    HB2  GLN  49           HB2      GLN  49 -21.618  13.983  -8.359
    4    HB3  GLN  49           HB3      GLN  49 -23.050  14.990  -8.249
    5    HG2  GLN  49           HG2      GLN  49 -22.859  14.991  -5.814
    6    HG3  GLN  49           HG3      GLN  49 -21.440  13.963  -5.922
    7   HE21  GLN  49          HE21      GLN  49 -21.242  16.178  -4.636
    8   HE22  GLN  49          HE22      GLN  49 -20.291  17.411  -5.285

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ASN  50           H        ASN  50 -22.577  11.274  -9.394
    2    HA   ASN  50           HA       ASN  50 -24.459  12.216 -11.446
    3    HB2  ASN  50           HB2      ASN  50 -21.929  10.603 -11.723
    4    HB3  ASN  50           HB3      ASN  50 -22.983  11.070 -13.050
    5   HD21  ASN  50          HD21      ASN  50 -20.302  11.825 -11.467
    6   HD22  ASN  50          HD22      ASN  50 -20.025  13.455 -11.801

  No H/Q in entry =           6
  In of MODEL    5
    1    H    ALA  51           H        ALA  51 -24.486   9.844  -9.217
    2    HA   ALA  51           HA       ALA  51 -25.357   7.737 -11.048
    3    HB2  ALA  51           HB1      ALA  51 -24.793   6.359  -9.379
    4    HB3  ALA  51           HB2      ALA  51 -25.877   7.192  -8.266
    5    HB1  ALA  51           HB3      ALA  51 -24.223   7.765  -8.480

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ASP  52           H        ASP  52 -27.391   6.741 -10.889
    2    HA   ASP  52           HA       ASP  52 -29.508   8.634 -10.184
    3    HB2  ASP  52           HB2      ASP  52 -29.414   6.137 -11.874
    4    HB3  ASP  52           HB3      ASP  52 -30.929   6.913 -11.414

  No H/Q in entry =           4
  In of MODEL    5
    1    H    VAL  53           H        VAL  53 -27.983   5.690  -9.209
    2    HA   VAL  53           HA       VAL  53 -29.386   5.843  -6.674
    3    HB   VAL  53           HB       VAL  53 -30.851   4.254  -7.911
    4   HG11  VAL  53          HG11      VAL  53 -29.150   3.353  -9.461
    5   HG13  VAL  53          HG12      VAL  53 -30.012   2.077  -8.600
    6   HG12  VAL  53          HG13      VAL  53 -28.380   2.526  -8.107
    7   HG23  VAL  53          HG21      VAL  53 -30.068   2.240  -6.243
    8   HG22  VAL  53          HG22      VAL  53 -31.152   3.576  -5.853
    9   HG21  VAL  53          HG23      VAL  53 -29.435   3.692  -5.466

  No H/Q in entry =           9
  In of MODEL    5
    1    H    VAL  54           H        VAL  54 -28.067   5.357  -5.038
    2    HA   VAL  54           HA       VAL  54 -25.342   4.428  -5.691
    3    HB   VAL  54           HB       VAL  54 -26.328   6.221  -3.416
    4   HG11  VAL  54          HG11      VAL  54 -23.799   4.725  -3.750
    5   HG13  VAL  54          HG12      VAL  54 -24.512   5.417  -2.293
    6   HG12  VAL  54          HG13      VAL  54 -23.588   6.439  -3.393
    7   HG22  VAL  54          HG21      VAL  54 -25.427   8.016  -4.514
    8   HG21  VAL  54          HG22      VAL  54 -26.022   7.053  -5.865
    9   HG23  VAL  54          HG23      VAL  54 -24.310   7.023  -5.449

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LEU  55           H        LEU  55 -24.802   2.484  -5.070
    2    HA   LEU  55           HA       LEU  55 -26.323   1.204  -2.885
    3    HB2  LEU  55           HB2      LEU  55 -24.832   0.006  -5.208
    4    HB3  LEU  55           HB3      LEU  55 -25.605  -0.914  -3.917
    5    HG   LEU  55           HG       LEU  55 -27.018   0.733  -6.004
    6   HD13  LEU  55          HD11      LEU  55 -26.792  -1.119  -7.241
    7   HD12  LEU  55          HD12      LEU  55 -27.762  -1.972  -6.040
    8   HD11  LEU  55          HD13      LEU  55 -26.003  -1.964  -5.911
    9   HD23  LEU  55          HD21      LEU  55 -28.351  -1.185  -4.146
   10   HD22  LEU  55          HD22      LEU  55 -29.013   0.224  -4.975
   11   HD21  LEU  55          HD23      LEU  55 -27.967   0.437  -3.570

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LEU  56           H        LEU  56 -25.167   0.561  -1.099
    2    HA   LEU  56           HA       LEU  56 -22.223   0.865  -1.183
    3    HB2  LEU  56           HB2      LEU  56 -24.001   0.693   1.237
    4    HB3  LEU  56           HB3      LEU  56 -22.279   1.067   1.207
    5    HG   LEU  56           HG       LEU  56 -24.536   2.825   0.284
    6   HD11  LEU  56          HD11      LEU  56 -23.402   2.389   2.787
    7   HD13  LEU  56          HD12      LEU  56 -24.355   3.793   2.304
    8   HD12  LEU  56          HD13      LEU  56 -22.597   3.843   2.194
    9   HD23  LEU  56          HD21      LEU  56 -22.541   4.463   0.077
   10   HD22  LEU  56          HD22      LEU  56 -22.976   3.388  -1.252
   11   HD21  LEU  56          HD23      LEU  56 -21.620   2.985  -0.200

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLY  57           H        GLY  57 -20.888  -0.813  -0.679
    2    HA3  GLY  57           HA2      GLY  57 -21.897  -3.467  -0.884
    3    HA2  GLY  57           HA3      GLY  57 -20.254  -3.028  -0.422

  No H/Q in entry =           3
  In of MODEL    5
    1    HA   PRO  58           HA       PRO  58 -23.048  -4.004   3.318
    2    HB2  PRO  58           HB2      PRO  58 -22.439  -6.634   3.896
    3    HB3  PRO  58           HB3      PRO  58 -23.823  -6.174   2.905
    4    HG2  PRO  58           HG2      PRO  58 -21.135  -7.135   2.077
    5    HG3  PRO  58           HG3      PRO  58 -22.722  -7.541   1.423
    6    HD2  PRO  58           HD2      PRO  58 -21.071  -5.766   0.191
    7    HD3  PRO  58           HD3      PRO  58 -22.828  -5.623   0.114

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLN  59           H        GLN  59 -19.702  -4.580   2.664
    2    HA   GLN  59           HA       GLN  59 -18.913  -4.641   5.414
    3    HB2  GLN  59           HB2      GLN  59 -17.155  -3.581   3.226
    4    HB3  GLN  59           HB3      GLN  59 -16.702  -4.442   4.683
    5    HG2  GLN  59           HG2      GLN  59 -16.369  -5.944   2.906
    6    HG3  GLN  59           HG3      GLN  59 -17.850  -6.464   3.692
    7   HE21  GLN  59          HE21      GLN  59 -18.750  -7.244   2.107
    8   HE22  GLN  59          HE22      GLN  59 -19.405  -6.798   0.644

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ILE  60           H        ILE  60 -19.792  -2.046   3.236
    2    HA   ILE  60           HA       ILE  60 -18.852  -0.132   5.283
    3    HB   ILE  60           HB       ILE  60 -19.046   1.618   3.477
    4   HG12  ILE  60          HG12      ILE  60 -18.961  -0.585   1.463
    5   HG13  ILE  60          HG13      ILE  60 -20.520  -0.011   2.053
    6   HG22  ILE  60          HG21      ILE  60 -17.118  -0.431   2.537
    7   HG21  ILE  60          HG22      ILE  60 -16.964   0.233   4.163
    8   HG23  ILE  60          HG23      ILE  60 -16.908   1.304   2.764
    9   HD11  ILE  60          HD11      ILE  60 -19.623   2.347   1.423
   10   HD13  ILE  60          HD12      ILE  60 -20.177   1.279   0.135
   11   HD12  ILE  60          HD13      ILE  60 -18.451   1.462   0.447

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ALA  61           H        ALA  61 -21.356  -1.638   5.374
    2    HA   ALA  61           HA       ALA  61 -23.533   0.100   4.955
    3    HB1  ALA  61           HB1      ALA  61 -24.779  -1.360   6.286
    4    HB2  ALA  61           HB2      ALA  61 -23.382  -1.801   7.268
    5    HB3  ALA  61           HB3      ALA  61 -23.518  -2.392   5.612

  No H/Q in entry =           5
  In of MODEL    5
    1    H    TYR  62           H        TYR  62 -21.295  -0.104   7.724
    2    HA   TYR  62           HA       TYR  62 -22.775   1.591   9.425
    3    HB2  TYR  62           HB2      TYR  62 -20.722   1.923  10.649
    4    HB3  TYR  62           HB3      TYR  62 -20.810   0.238  10.138
    5    HD1  TYR  62           HD1      TYR  62 -19.264  -0.638   8.429
    6    HD2  TYR  62           HD2      TYR  62 -18.986   3.411   9.767
    7    HE1  TYR  62           HE1      TYR  62 -17.056  -0.438   7.350
    8    HE2  TYR  62           HE2      TYR  62 -16.764   3.606   8.689
    9    HH   TYR  62           HH       TYR  62 -15.144   2.496   7.678

  No H/Q in entry =           9
  In of MODEL    5
    1    H    MET  63           H        MET  63 -21.141   2.417   6.554
    2    HA   MET  63           HA       MET  63 -20.874   5.237   7.266
    3    HB2  MET  63           HB2      MET  63 -20.353   3.719   4.708
    4    HB3  MET  63           HB3      MET  63 -20.093   5.453   4.907
    5    HG2  MET  63           HG2      MET  63 -18.370   5.029   6.551
    6    HG3  MET  63           HG3      MET  63 -18.654   3.294   6.425
    7    HE2  MET  63           HE1      MET  63 -16.507   6.155   3.884
    8    HE1  MET  63           HE2      MET  63 -18.001   6.436   4.778
    9    HE3  MET  63           HE3      MET  63 -18.065   5.975   3.077

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LEU  64           H        LEU  64 -23.509   3.475   6.322
    2    HA   LEU  64           HA       LEU  64 -24.699   4.947   4.269
    3    HB2  LEU  64           HB2      LEU  64 -25.624   2.864   5.183
    4    HB3  LEU  64           HB3      LEU  64 -26.034   3.710   6.675
    5    HG   LEU  64           HG       LEU  64 -27.702   5.029   5.478
    6   HD13  LEU  64          HD11      LEU  64 -27.441   5.277   3.244
    7   HD12  LEU  64          HD12      LEU  64 -28.142   3.665   3.096
    8   HD11  LEU  64          HD13      LEU  64 -26.390   3.865   3.133
    9   HD23  LEU  64          HD21      LEU  64 -28.323   2.241   4.718
   10   HD22  LEU  64          HD22      LEU  64 -29.261   3.399   5.659
   11   HD21  LEU  64          HD23      LEU  64 -27.903   2.556   6.402

  No H/Q in entry =          11
  In of MODEL    5
    1    HA   PRO  65           HA       PRO  65 -26.737   8.152   7.071
    2    HB2  PRO  65           HB2      PRO  65 -24.702   8.227   9.299
    3    HB3  PRO  65           HB3      PRO  65 -26.431   8.566   9.370
    4    HG2  PRO  65           HG2      PRO  65 -25.564   6.274  10.268
    5    HG3  PRO  65           HG3      PRO  65 -26.998   6.297   9.242
    6    HD2  PRO  65           HD2      PRO  65 -24.158   5.592   8.497
    7    HD3  PRO  65           HD3      PRO  65 -25.650   4.758   8.062

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLU  66           H        GLU  66 -23.183   7.976   7.095
    2    HA   GLU  66           HA       GLU  66 -22.797  10.765   6.705
    3    HB2  GLU  66           HB2      GLU  66 -21.072   8.402   6.014
    4    HB3  GLU  66           HB3      GLU  66 -20.567  10.080   5.812
    5    HG2  GLU  66           HG2      GLU  66 -20.735  10.440   8.184
    6    HG3  GLU  66           HG3      GLU  66 -21.314   8.790   8.412

  No H/Q in entry =           6
  In of MODEL    5
    1    H    ILE  67           H        ILE  67 -23.022   8.042   4.437
    2    HA   ILE  67           HA       ILE  67 -22.577   9.751   2.150
    3    HB   ILE  67           HB       ILE  67 -23.573   6.875   2.321
    4   HG12  ILE  67          HG12      ILE  67 -20.917   7.960   1.372
    5   HG13  ILE  67          HG13      ILE  67 -21.204   7.539   3.059
    6   HG21  ILE  67          HG21      ILE  67 -23.481   8.767   0.108
    7   HG23  ILE  67          HG22      ILE  67 -24.162   7.141   0.157
    8   HG22  ILE  67          HG23      ILE  67 -22.449   7.368  -0.193
    9   HD12  ILE  67          HD11      ILE  67 -20.877   5.771   0.692
   10   HD11  ILE  67          HD12      ILE  67 -21.893   5.225   2.024
   11   HD13  ILE  67          HD13      ILE  67 -20.201   5.629   2.314

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLN  68           H        GLN  68 -25.461   8.786   3.814
    2    HA   GLN  68           HA       GLN  68 -27.282   9.795   1.872
    3    HB2  GLN  68           HB2      GLN  68 -27.511   9.425   4.855
    4    HB3  GLN  68           HB3      GLN  68 -28.822  10.073   3.884
    5    HG2  GLN  68           HG2      GLN  68 -28.939   8.055   2.594
    6    HG3  GLN  68           HG3      GLN  68 -27.501   7.421   3.373
    7   HE21  GLN  68          HE21      GLN  68 -29.727   6.143   3.259
    8   HE22  GLN  68          HE22      GLN  68 -30.553   5.706   4.681

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ARG  69           H        ARG  69 -25.582  11.382   4.599
    2    HA   ARG  69           HA       ARG  69 -26.860  13.915   4.228
    3    HB2  ARG  69           HB2      ARG  69 -24.530  12.890   5.779
    4    HB3  ARG  69           HB3      ARG  69 -24.551  14.614   5.432
    5    HG2  ARG  69           HG2      ARG  69 -26.851  14.733   6.436
    6    HG3  ARG  69           HG3      ARG  69 -26.699  13.034   6.896
    7    HD2  ARG  69           HD2      ARG  69 -24.908  15.318   7.802
    8    HD3  ARG  69           HD3      ARG  69 -26.057  14.447   8.806
    9    HE   ARG  69           HE       ARG  69 -23.493  13.428   7.814
   10   HH21  ARG  69          HH11      ARG  69 -22.734  11.628   8.986
   11   HH22  ARG  69          HH12      ARG  69 -23.776  10.841  10.123
   12   HH11  ARG  69          HH21      ARG  69 -26.445  12.977   9.548
   13   HH12  ARG  69          HH22      ARG  69 -25.878  11.603  10.439

  No H/Q in entry =          13
  In of MODEL    5
    1    H    LEU  70           H        LEU  70 -24.062  12.414   2.819
    2    HA   LEU  70           HA       LEU  70 -22.877  14.746   1.652
    3    HB2  LEU  70           HB2      LEU  70 -21.961  12.389   2.218
    4    HB3  LEU  70           HB3      LEU  70 -22.614  11.958   0.637
    5    HG   LEU  70           HG       LEU  70 -20.986  13.279  -0.460
    6   HD11  LEU  70          HD11      LEU  70 -20.095  14.070   2.322
    7   HD13  LEU  70          HD12      LEU  70 -20.768  15.139   1.090
    8   HD12  LEU  70          HD13      LEU  70 -19.187  14.400   0.844
    9   HD22  LEU  70          HD21      LEU  70 -19.615  11.508  -0.260
   10   HD21  LEU  70          HD22      LEU  70 -20.541  11.010   1.156
   11   HD23  LEU  70          HD23      LEU  70 -19.114  12.028   1.349

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LEU  71           H        LEU  71 -25.139  12.294   0.550
    2    HA   LEU  71           HA       LEU  71 -25.642  13.819  -1.949
    3    HB2  LEU  71           HB2      LEU  71 -25.954  10.841  -1.521
    4    HB3  LEU  71           HB3      LEU  71 -26.071  11.717  -3.046
    5    HG   LEU  71           HG       LEU  71 -23.530  11.622  -1.421
    6   HD12  LEU  71          HD11      LEU  71 -23.678  10.016  -3.863
    7   HD11  LEU  71          HD12      LEU  71 -24.694   9.421  -2.551
    8   HD13  LEU  71          HD13      LEU  71 -22.962   9.633  -2.297
    9   HD22  LEU  71          HD21      LEU  71 -23.583  13.452  -2.900
   10   HD21  LEU  71          HD22      LEU  71 -24.139  12.439  -4.232
   11   HD23  LEU  71          HD23      LEU  71 -22.515  12.225  -3.578

  No H/Q in entry =          11
  In of MODEL    5
    1    HA   PRO  72           HA       PRO  72 -29.487  13.501   0.722
    2    HB2  PRO  72           HB2      PRO  72 -30.243  16.094   0.671
    3    HB3  PRO  72           HB3      PRO  72 -28.939  15.582   1.742
    4    HG2  PRO  72           HG2      PRO  72 -28.743  16.790  -1.007
    5    HG3  PRO  72           HG3      PRO  72 -27.935  17.300   0.476
    6    HD2  PRO  72           HD2      PRO  72 -26.685  15.702  -1.320
    7    HD3  PRO  72           HD3      PRO  72 -26.413  15.513   0.411

  No H/Q in entry =           7
  In of MODEL    5
    1    H    ASN  73           H        ASN  73 -28.870  14.454  -2.494
    2    HA   ASN  73           HA       ASN  73 -31.748  14.265  -3.088
    3    HB2  ASN  73           HB2      ASN  73 -31.268  15.368  -5.184
    4    HB3  ASN  73           HB3      ASN  73 -30.687  16.315  -3.823
    5   HD21  ASN  73          HD21      ASN  73 -29.927  16.348  -6.511
    6   HD22  ASN  73          HD22      ASN  73 -28.270  16.122  -6.727

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LYS  74           H        LYS  74 -29.854  11.929  -2.706
    2    HA   LYS  74           HA       LYS  74 -30.513  10.576  -5.256
    3    HB2  LYS  74           HB2      LYS  74 -27.973  10.170  -3.672
    4    HB3  LYS  74           HB3      LYS  74 -28.409   9.385  -5.191
    5    HG2  LYS  74           HG2      LYS  74 -28.021  12.340  -4.972
    6    HG3  LYS  74           HG3      LYS  74 -26.696  11.225  -5.302
    7    HD2  LYS  74           HD2      LYS  74 -27.877  10.358  -7.237
    8    HD3  LYS  74           HD3      LYS  74 -29.249  11.410  -6.890
    9    HE2  LYS  74           HE2      LYS  74 -27.949  13.367  -7.335
   10    HE3  LYS  74           HE3      LYS  74 -26.467  12.417  -7.453
   11    HZ2  LYS  74           HZ1      LYS  74 -27.940  13.095  -9.554
   12    HZ1  LYS  74           HZ2      LYS  74 -28.652  11.598  -9.183
   13    HZ3  LYS  74           HZ3      LYS  74 -26.987  11.692  -9.502

  No H/Q in entry =          13
  In of MODEL    5
    1    HA   PRO  75           HA       PRO  75 -31.989   7.629  -2.286
    2    HB2  PRO  75           HB2      PRO  75 -32.412   5.438  -3.879
    3    HB3  PRO  75           HB3      PRO  75 -33.482   6.838  -3.924
    4    HG2  PRO  75           HG2      PRO  75 -31.195   6.158  -5.732
    5    HG3  PRO  75           HG3      PRO  75 -32.829   6.666  -6.153
    6    HD2  PRO  75           HD2      PRO  75 -30.812   8.450  -6.123
    7    HD3  PRO  75           HD3      PRO  75 -32.419   8.912  -5.559

  No H/Q in entry =           7
  In of MODEL    5
    1    H    VAL  76           H        VAL  76 -30.562   6.505  -0.941
    2    HA   VAL  76           HA       VAL  76 -28.165   5.202  -2.091
    3    HB   VAL  76           HB       VAL  76 -28.355   6.660   0.580
    4   HG11  VAL  76          HG11      VAL  76 -26.073   5.286  -0.852
    5   HG13  VAL  76          HG12      VAL  76 -26.767   4.854   0.712
    6   HG12  VAL  76          HG13      VAL  76 -25.860   6.355   0.535
    7   HG22  VAL  76          HG21      VAL  76 -27.621   8.538  -0.303
    8   HG21  VAL  76          HG22      VAL  76 -28.212   7.876  -1.827
    9   HG23  VAL  76          HG23      VAL  76 -26.510   7.714  -1.397

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLU  77           H        GLU  77 -28.029   3.037  -1.495
    2    HA   GLU  77           HA       GLU  77 -28.812   2.263   1.165
    3    HB2  GLU  77           HB2      GLU  77 -30.494   0.688   0.645
    4    HB3  GLU  77           HB3      GLU  77 -30.988   2.238  -0.039
    5    HG2  GLU  77           HG2      GLU  77 -30.441   1.470  -2.240
    6    HG3  GLU  77           HG3      GLU  77 -29.853  -0.056  -1.586

  No H/Q in entry =           6
  In of MODEL    5
    1    H    VAL  78           H        VAL  78 -28.563   0.160   1.806
    2    HA   VAL  78           HA       VAL  78 -25.943  -0.715   0.876
    3    HB   VAL  78           HB       VAL  78 -27.655  -1.544   3.258
    4   HG11  VAL  78          HG11      VAL  78 -25.384  -2.861   2.094
    5   HG13  VAL  78          HG12      VAL  78 -26.291  -3.304   3.541
    6   HG12  VAL  78          HG13      VAL  78 -24.923  -2.199   3.662
    7   HG22  VAL  78          HG21      VAL  78 -26.123  -0.253   4.586
    8   HG21  VAL  78          HG22      VAL  78 -26.836   0.756   3.326
    9   HG23  VAL  78          HG23      VAL  78 -25.184   0.161   3.151

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ILE  79           H        ILE  79 -25.498  -2.637  -0.049
    2    HA   ILE  79           HA       ILE  79 -27.636  -4.019  -1.379
    3    HB   ILE  79           HB       ILE  79 -24.666  -4.670  -1.202
    4   HG12  ILE  79          HG12      ILE  79 -26.287  -3.483  -3.460
    5   HG13  ILE  79          HG13      ILE  79 -25.357  -2.519  -2.312
    6   HG22  ILE  79          HG21      ILE  79 -25.848  -5.787  -3.512
    7   HG21  ILE  79          HG22      ILE  79 -26.834  -6.277  -2.135
    8   HG23  ILE  79          HG23      ILE  79 -25.106  -6.627  -2.151
    9   HD13  ILE  79          HD11      ILE  79 -23.973  -2.677  -4.151
   10   HD12  ILE  79          HD12      ILE  79 -24.387  -4.368  -4.438
   11   HD11  ILE  79          HD13      ILE  79 -23.365  -3.930  -3.068

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ASP  80           H        ASP  80 -28.572  -5.909  -0.796
    2    HA   ASP  80           HA       ASP  80 -28.520  -6.829   1.845
    3    HB2  ASP  80           HB2      ASP  80 -30.317  -7.321   0.225
    4    HB3  ASP  80           HB3      ASP  80 -29.214  -8.369  -0.666

  No H/Q in entry =           4
  In of MODEL    5
    1    H    SER  81           H        SER  81 -27.018  -8.034   2.946
    2    HA   SER  81           HA       SER  81 -24.567  -8.810   1.716
    3    HB2  SER  81           HB2      SER  81 -24.030  -9.877   3.871
    4    HB3  SER  81           HB3      SER  81 -24.661  -8.246   4.104
    5    HG   SER  81           HG       SER  81 -26.297  -9.021   5.116

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU  82           H        LEU  82 -27.358 -10.790   2.062
    2    HA   LEU  82           HA       LEU  82 -25.916 -13.217   1.506
    3    HB2  LEU  82           HB2      LEU  82 -28.827 -12.478   1.295
    4    HB3  LEU  82           HB3      LEU  82 -28.194 -14.106   1.063
    5    HG   LEU  82           HG       LEU  82 -28.027 -12.552   3.627
    6   HD13  LEU  82          HD11      LEU  82 -29.787 -14.057   4.406
    7   HD12  LEU  82          HD12      LEU  82 -29.840 -14.841   2.825
    8   HD11  LEU  82          HD13      LEU  82 -30.349 -13.160   2.995
    9   HD23  LEU  82          HD21      LEU  82 -27.526 -14.969   4.394
   10   HD22  LEU  82          HD22      LEU  82 -26.251 -14.081   3.563
   11   HD21  LEU  82          HD23      LEU  82 -27.199 -15.284   2.689

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LEU  83           H        LEU  83 -27.806 -10.900  -0.372
    2    HA   LEU  83           HA       LEU  83 -27.694 -12.248  -2.854
    3    HB2  LEU  83           HB2      LEU  83 -27.976  -9.331  -2.184
    4    HB3  LEU  83           HB3      LEU  83 -28.055  -9.963  -3.828
    5    HG   LEU  83           HG       LEU  83 -30.075 -10.280  -1.626
    6   HD13  LEU  83          HD11      LEU  83 -30.768  -8.396  -2.668
    7   HD12  LEU  83          HD12      LEU  83 -31.293  -9.481  -3.955
    8   HD11  LEU  83          HD13      LEU  83 -29.725  -8.679  -4.062
    9   HD23  LEU  83          HD21      LEU  83 -30.302 -11.514  -4.356
   10   HD22  LEU  83          HD22      LEU  83 -31.265 -11.833  -2.915
   11   HD21  LEU  83          HD23      LEU  83 -29.601 -12.405  -3.006

  No H/Q in entry =          11
  In of MODEL    5
    1    H    TYR  84           H        TYR  84 -25.621  -9.957  -1.190
    2    HA   TYR  84           HA       TYR  84 -23.769  -9.532  -3.344
    3    HB2  TYR  84           HB2      TYR  84 -24.181  -8.018  -1.339
    4    HB3  TYR  84           HB3      TYR  84 -23.255  -9.180  -0.391
    5    HD1  TYR  84           HD1      TYR  84 -20.853  -9.365  -0.635
    6    HD2  TYR  84           HD2      TYR  84 -23.079  -6.619  -3.031
    7    HE1  TYR  84           HE1      TYR  84 -18.743  -8.278  -1.327
    8    HE2  TYR  84           HE2      TYR  84 -20.977  -5.530  -3.739
    9    HH   TYR  84           HH       TYR  84 -17.969  -6.911  -3.317

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLY  85           H        GLY  85 -23.574 -11.562  -0.412
    2    HA3  GLY  85           HA2      GLY  85 -21.044 -12.608  -0.936
    3    HA2  GLY  85           HA3      GLY  85 -22.295 -13.410   0.013

  No H/Q in entry =           3
  In of MODEL    5
    1    H    LYS  86           H        LYS  86 -24.184 -13.692  -2.024
    2    HA   LYS  86           HA       LYS  86 -23.247 -16.101  -3.312
    3    HB2  LYS  86           HB2      LYS  86 -25.460 -15.948  -2.351
    4    HB3  LYS  86           HB3      LYS  86 -25.831 -14.543  -3.350
    5    HG2  LYS  86           HG2      LYS  86 -26.978 -16.489  -4.154
    6    HG3  LYS  86           HG3      LYS  86 -25.772 -15.962  -5.329
    7    HD2  LYS  86           HD2      LYS  86 -24.233 -17.649  -4.634
    8    HD3  LYS  86           HD3      LYS  86 -25.212 -18.047  -3.223
    9    HE2  LYS  86           HE2      LYS  86 -25.588 -19.754  -4.837
   10    HE3  LYS  86           HE3      LYS  86 -27.032 -18.743  -4.813
   11    HZ2  LYS  86           HZ1      LYS  86 -26.287 -19.230  -7.077
   12    HZ1  LYS  86           HZ2      LYS  86 -24.796 -18.483  -6.755
   13    HZ3  LYS  86           HZ3      LYS  86 -26.224 -17.565  -6.746

  No H/Q in entry =          13
  In of MODEL    5
    1    H    VAL  87           H        VAL  87 -23.114 -12.883  -4.187
    2    HA   VAL  87           HA       VAL  87 -22.793 -11.711  -6.125
    3    HB   VAL  87           HB       VAL  87 -21.837 -14.276  -7.439
    4   HG13  VAL  87          HG11      VAL  87 -20.522 -12.855  -8.773
    5   HG12  VAL  87          HG12      VAL  87 -20.607 -11.532  -7.608
    6   HG11  VAL  87          HG13      VAL  87 -22.017 -11.940  -8.584
    7   HG22  VAL  87          HG21      VAL  87 -19.704 -14.096  -6.429
    8   HG21  VAL  87          HG22      VAL  87 -20.886 -14.073  -5.121
    9   HG23  VAL  87          HG23      VAL  87 -20.126 -12.573  -5.648

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ASP  88           H        ASP  88 -25.328 -12.251  -5.742
    2    HA   ASP  88           HA       ASP  88 -26.532 -13.405  -8.131
    3    HB2  ASP  88           HB2      ASP  88 -27.504 -13.623  -5.794
    4    HB3  ASP  88           HB3      ASP  88 -27.889 -11.904  -5.878

  No H/Q in entry =           4
  In of MODEL    5
    1    H    GLY  89           H        GLY  89 -25.798 -12.167  -9.775
    2    HA3  GLY  89           HA2      GLY  89 -25.869  -9.388  -9.957
    3    HA2  GLY  89           HA3      GLY  89 -25.910 -10.500 -11.325

  No H/Q in entry =           3
  In of MODEL    5
    1    H    LEU  90           H        LEU  90 -28.403 -11.754 -10.849
    2    HA   LEU  90           HA       LEU  90 -30.149  -9.740 -11.925
    3    HB2  LEU  90           HB2      LEU  90 -30.320 -12.127 -12.518
    4    HB3  LEU  90           HB3      LEU  90 -30.818 -12.483 -10.865
    5    HG   LEU  90           HG       LEU  90 -32.893 -11.279 -11.191
    6   HD13  LEU  90          HD11      LEU  90 -32.664  -9.537 -12.659
    7   HD12  LEU  90          HD12      LEU  90 -33.269 -10.744 -13.795
    8   HD11  LEU  90          HD13      LEU  90 -31.539 -10.421 -13.693
    9   HD23  LEU  90          HD21      LEU  90 -32.925 -12.894 -13.636
   10   HD22  LEU  90          HD22      LEU  90 -33.889 -13.029 -12.166
   11   HD21  LEU  90          HD23      LEU  90 -32.262 -13.708 -12.217

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLY  91           H        GLY  91 -29.998 -11.266  -8.753
    2    HA3  GLY  91           HA2      GLY  91 -32.275 -10.066  -7.673
    3    HA2  GLY  91           HA3      GLY  91 -30.893 -10.661  -6.754

  No H/Q in entry =           3
  In of MODEL    5
    1    H    VAL  92           H        VAL  92 -28.914  -8.907  -7.628
    2    HA   VAL  92           HA       VAL  92 -29.589  -6.586  -6.055
    3    HB   VAL  92           HB       VAL  92 -27.086  -7.148  -7.690
    4   HG12  VAL  92          HG11      VAL  92 -27.142  -5.272  -5.351
    5   HG11  VAL  92          HG12      VAL  92 -27.806  -4.693  -6.880
    6   HG13  VAL  92          HG13      VAL  92 -26.129  -5.230  -6.794
    7   HG22  VAL  92          HG21      VAL  92 -26.906  -8.753  -6.109
    8   HG21  VAL  92          HG22      VAL  92 -28.002  -7.934  -4.996
    9   HG23  VAL  92          HG23      VAL  92 -26.327  -7.400  -5.137

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LEU  93           H        LEU  93 -29.257  -7.243  -9.485
    2    HA   LEU  93           HA       LEU  93 -29.509  -4.590 -10.394
    3    HB2  LEU  93           HB2      LEU  93 -28.964  -6.460 -11.875
    4    HB3  LEU  93           HB3      LEU  93 -30.580  -7.124 -11.633
    5    HG   LEU  93           HG       LEU  93 -31.528  -5.115 -12.732
    6   HD11  LEU  93          HD11      LEU  93 -29.607  -3.599 -12.247
    7   HD13  LEU  93          HD12      LEU  93 -30.071  -3.601 -13.949
    8   HD12  LEU  93          HD13      LEU  93 -28.646  -4.497 -13.422
    9   HD23  LEU  93          HD21      LEU  93 -30.545  -5.710 -15.038
   10   HD22  LEU  93          HD22      LEU  93 -31.424  -6.938 -14.126
   11   HD21  LEU  93          HD23      LEU  93 -29.659  -6.952 -14.153

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LYS  94           H        LYS  94 -31.973  -7.044  -9.524
    2    HA   LYS  94           HA       LYS  94 -34.266  -5.505 -10.107
    3    HB2  LYS  94           HB2      LYS  94 -33.812  -7.720  -8.115
    4    HB3  LYS  94           HB3      LYS  94 -35.384  -6.960  -8.356
    5    HG2  LYS  94           HG2      LYS  94 -35.362  -7.723 -10.695
    6    HG3  LYS  94           HG3      LYS  94 -33.828  -8.539 -10.394
    7    HD2  LYS  94           HD2      LYS  94 -34.975  -9.838  -8.560
    8    HD3  LYS  94           HD3      LYS  94 -36.499  -9.126  -9.089
    9    HE2  LYS  94           HE2      LYS  94 -36.054 -10.061 -11.368
   10    HE3  LYS  94           HE3      LYS  94 -34.662 -10.904 -10.690
   11    HZ3  LYS  94           HZ1      LYS  94 -36.574 -12.349 -10.841
   12    HZ2  LYS  94           HZ2      LYS  94 -37.492 -11.291  -9.879
   13    HZ1  LYS  94           HZ3      LYS  94 -36.153 -12.097  -9.215

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ALA  95           H        ALA  95 -32.405  -5.718  -7.086
    2    HA   ALA  95           HA       ALA  95 -34.167  -4.073  -5.571
    3    HB2  ALA  95           HB1      ALA  95 -31.842  -5.546  -5.077
    4    HB3  ALA  95           HB2      ALA  95 -32.767  -4.609  -3.904
    5    HB1  ALA  95           HB3      ALA  95 -31.399  -3.872  -4.741

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA  96           H        ALA  96 -31.523  -3.314  -7.702
    2    HA   ALA  96           HA       ALA  96 -31.304  -0.563  -6.914
    3    HB2  ALA  96           HB1      ALA  96 -29.964  -0.380  -9.042
    4    HB3  ALA  96           HB2      ALA  96 -30.343  -2.071  -9.367
    5    HB1  ALA  96           HB3      ALA  96 -29.388  -1.637  -7.949

  No H/Q in entry =           5
  In of MODEL    5
    1    H    VAL  97           H        VAL  97 -32.943  -2.197  -9.587
    2    HA   VAL  97           HA       VAL  97 -33.936   0.152 -10.814
    3    HB   VAL  97           HB       VAL  97 -34.866  -2.737 -10.861
    4   HG11  VAL  97          HG11      VAL  97 -36.581  -0.656 -11.309
    5   HG13  VAL  97          HG12      VAL  97 -36.716  -2.240 -12.074
    6   HG12  VAL  97          HG13      VAL  97 -35.920  -0.917 -12.925
    7   HG21  VAL  97          HG21      VAL  97 -33.542  -0.951 -12.904
    8   HG23  VAL  97          HG22      VAL  97 -34.068  -2.609 -13.196
    9   HG22  VAL  97          HG23      VAL  97 -32.787  -2.282 -12.027

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ALA  98           H        ALA  98 -35.171  -1.992  -8.273
    2    HA   ALA  98           HA       ALA  98 -37.676  -0.739  -7.878
    3    HB1  ALA  98           HB1      ALA  98 -36.741  -2.986  -6.873
    4    HB3  ALA  98           HB2      ALA  98 -37.867  -2.019  -5.918
    5    HB2  ALA  98           HB3      ALA  98 -36.138  -1.945  -5.584

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA  99           H        ALA  99 -34.543  -0.082  -6.272
    2    HA   ALA  99           HA       ALA  99 -35.563   1.937  -4.582
    3    HB1  ALA  99           HB1      ALA  99 -32.966   0.941  -5.373
    4    HB2  ALA  99           HB2      ALA  99 -33.461   1.704  -3.861
    5    HB3  ALA  99           HB3      ALA  99 -32.963   2.698  -5.229

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ILE 100           H        ILE 100 -34.566   2.046  -7.952
    2    HA   ILE 100           HA       ILE 100 -34.626   4.901  -8.150
    3    HB   ILE 100           HB       ILE 100 -34.846   2.767 -10.300
    4   HG12  ILE 100          HG12      ILE 100 -32.589   4.660  -9.649
    5   HG13  ILE 100          HG13      ILE 100 -32.686   3.012  -9.029
    6   HG21  ILE 100          HG21      ILE 100 -35.144   5.703 -10.406
    7   HG23  ILE 100          HG22      ILE 100 -35.720   4.465 -11.523
    8   HG22  ILE 100          HG23      ILE 100 -34.043   5.009 -11.598
    9   HD12  ILE 100          HD11      ILE 100 -32.153   3.964 -11.804
   10   HD11  ILE 100          HD12      ILE 100 -32.880   2.377 -11.550
   11   HD13  ILE 100          HD13      ILE 100 -31.305   2.749 -10.851

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LYS 101           H        LYS 101 -37.041   2.397  -8.859
    2    HA   LYS 101           HA       LYS 101 -39.064   4.142  -9.816
    3    HB2  LYS 101           HB2      LYS 101 -39.051   1.357  -8.708
    4    HB3  LYS 101           HB3      LYS 101 -40.573   2.188  -9.027
    5    HG2  LYS 101           HG2      LYS 101 -40.127   2.318 -11.329
    6    HG3  LYS 101           HG3      LYS 101 -38.447   1.839 -11.103
    7    HD2  LYS 101           HD2      LYS 101 -39.791  -0.007 -11.982
    8    HD3  LYS 101           HD3      LYS 101 -39.155  -0.377 -10.379
    9    HE2  LYS 101           HE2      LYS 101 -41.239  -0.985  -9.847
   10    HE3  LYS 101           HE3      LYS 101 -41.621   0.737  -9.832
   11    HZ3  LYS 101           HZ1      LYS 101 -42.549   0.635 -11.937
   12    HZ2  LYS 101           HZ2      LYS 101 -43.063  -0.822 -11.233
   13    HZ1  LYS 101           HZ3      LYS 101 -41.772  -0.823 -12.335

  No H/Q in entry =          13
  In of MODEL    5
    1    H    LYS 102           H        LYS 102 -38.589   2.622  -6.625
    2    HA   LYS 102           HA       LYS 102 -40.766   3.904  -5.386
    3    HB2  LYS 102           HB2      LYS 102 -39.597   1.978  -4.402
    4    HB3  LYS 102           HB3      LYS 102 -38.158   2.971  -4.173
    5    HG2  LYS 102           HG2      LYS 102 -39.391   4.410  -2.647
    6    HG3  LYS 102           HG3      LYS 102 -40.833   3.422  -2.879
    7    HD2  LYS 102           HD2      LYS 102 -39.674   1.497  -1.884
    8    HD3  LYS 102           HD3      LYS 102 -38.233   2.487  -1.649
    9    HE2  LYS 102           HE2      LYS 102 -39.502   4.011  -0.211
   10    HE3  LYS 102           HE3      LYS 102 -40.960   3.054  -0.466
   11    HZ1  LYS 102           HZ1      LYS 102 -39.303   1.218   0.500
   12    HZ3  LYS 102           HZ2      LYS 102 -40.360   2.144   1.453
   13    HZ2  LYS 102           HZ3      LYS 102 -38.730   2.600   1.306

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ALA 103           H        ALA 103 -37.768   5.174  -6.432
    2    HA   ALA 103           HA       ALA 103 -37.865   7.482  -4.632
    3    HB2  ALA 103           HB1      ALA 103 -35.866   8.142  -6.231
    4    HB3  ALA 103           HB2      ALA 103 -35.912   6.428  -6.642
    5    HB1  ALA 103           HB3      ALA 103 -35.639   6.928  -4.973

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA 104           H        ALA 104 -38.564   6.805  -7.973
    2    HA   ALA 104           HA       ALA 104 -39.038   9.617  -8.568
    3    HB2  ALA 104           HB1      ALA 104 -39.141   8.968 -10.773
    4    HB1  ALA 104           HB2      ALA 104 -39.930   7.436 -10.396
    5    HB3  ALA 104           HB3      ALA 104 -38.193   7.622 -10.140

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA 105           H        ALA 105 -40.710   7.570  -6.755
    2    HA   ALA 105           HA       ALA 105 -43.071   9.066  -6.683
    3    HB2  ALA 105           HB1      ALA 105 -43.881   8.256  -8.717
    4    HB3  ALA 105           HB2      ALA 105 -44.552   7.086  -7.580
    5    HB1  ALA 105           HB3      ALA 105 -43.112   6.682  -8.512

  No H/Q in entry =           5
  In of MODEL    6
    1    H1   ALA   1           H3       ALA   1 -12.058 -16.120  -2.395
    2    H2   ALA   1           H2       ALA   1 -11.097 -17.252  -3.227
    3    H3   ALA   1           H1       ALA   1 -12.251 -16.328  -4.069
    4    HA   ALA   1           HA       ALA   1 -13.626 -18.047  -3.826
    5    HB3  ALA   1           HB1      ALA   1 -12.207 -19.796  -3.351
    6    HB1  ALA   1           HB2      ALA   1 -12.970 -19.687  -1.765
    7    HB2  ALA   1           HB3      ALA   1 -11.404 -18.925  -2.044

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLU   2           H        GLU   2 -15.243 -18.917  -2.174
    2    HA   GLU   2           HA       GLU   2 -16.919 -17.215  -1.129
    3    HB2  GLU   2           HB2      GLU   2 -15.951 -19.620   0.431
    4    HB3  GLU   2           HB3      GLU   2 -17.488 -18.790   0.675
    5    HG2  GLU   2           HG2      GLU   2 -18.445 -19.899  -1.057
    6    HG3  GLU   2           HG3      GLU   2 -17.124 -19.484  -2.139

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLU   3           H        GLU   3 -14.997 -18.529   1.507
    2    HA   GLU   3           HA       GLU   3 -15.258 -16.171   3.052
    3    HB2  GLU   3           HB2      GLU   3 -13.637 -18.694   3.321
    4    HB3  GLU   3           HB3      GLU   3 -13.429 -17.366   4.462
    5    HG2  GLU   3           HG2      GLU   3 -15.623 -17.544   5.273
    6    HG3  GLU   3           HG3      GLU   3 -16.201 -18.360   3.826

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LEU   4           H        LEU   4 -12.277 -17.614   1.679
    2    HA   LEU   4           HA       LEU   4 -10.472 -15.682   2.275
    3    HB2  LEU   4           HB2      LEU   4 -10.674 -16.996  -0.444
    4    HB3  LEU   4           HB3      LEU   4  -9.235 -16.252   0.242
    5    HG   LEU   4           HG       LEU   4 -10.699 -18.664   1.361
    6   HD13  LEU   4          HD11      LEU   4  -9.044 -20.001   0.444
    7   HD12  LEU   4          HD12      LEU   4  -7.853 -18.701   0.416
    8   HD11  LEU   4          HD13      LEU   4  -9.137 -18.747  -0.792
    9   HD23  LEU   4          HD21      LEU   4  -8.453 -18.689   2.751
   10   HD22  LEU   4          HD22      LEU   4  -9.790 -17.666   3.270
   11   HD21  LEU   4          HD23      LEU   4  -8.434 -16.962   2.390

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLU   5           H        GLU   5 -12.800 -15.521  -0.409
    2    HA   GLU   5           HA       GLU   5 -11.828 -13.028  -1.417
    3    HB2  GLU   5           HB2      GLU   5 -13.140 -14.629  -2.785
    4    HB3  GLU   5           HB3      GLU   5 -14.549 -14.306  -1.774
    5    HG2  GLU   5           HG2      GLU   5 -14.478 -11.931  -2.406
    6    HG3  GLU   5           HG3      GLU   5 -13.049 -12.229  -3.395

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLU   6           H        GLU   6 -14.548 -13.935   0.669
    2    HA   GLU   6           HA       GLU   6 -15.492 -11.270   1.052
    3    HB2  GLU   6           HB2      GLU   6 -16.881 -13.296   1.455
    4    HB3  GLU   6           HB3      GLU   6 -15.858 -13.691   2.835
    5    HG2  GLU   6           HG2      GLU   6 -16.448 -11.558   3.904
    6    HG3  GLU   6           HG3      GLU   6 -17.447 -11.128   2.517

  No H/Q in entry =           6
  In of MODEL    6
    1    H    VAL   7           H        VAL   7 -13.161 -13.340   2.642
    2    HA   VAL   7           HA       VAL   7 -12.726 -11.747   4.964
    3    HB   VAL   7           HB       VAL   7 -10.988 -13.774   3.530
    4   HG11  VAL   7          HG11      VAL   7 -10.551 -12.222   6.089
    5   HG13  VAL   7          HG12      VAL   7  -9.443 -12.428   4.733
    6   HG12  VAL   7          HG13      VAL   7  -9.781 -13.784   5.808
    7   HG21  VAL   7          HG21      VAL   7 -13.235 -14.364   4.744
    8   HG23  VAL   7          HG22      VAL   7 -12.318 -14.070   6.222
    9   HG22  VAL   7          HG23      VAL   7 -11.803 -15.328   5.100

  No H/Q in entry =           9
  In of MODEL    6
    1    H    VAL   8           H        VAL   8 -11.201 -11.856   1.760
    2    HA   VAL   8           HA       VAL   8  -9.166  -9.952   2.252
    3    HB   VAL   8           HB       VAL   8 -10.610 -10.664  -0.313
    4   HG11  VAL   8          HG11      VAL   8  -8.230  -8.887   0.251
    5   HG13  VAL   8          HG12      VAL   8  -9.671  -8.516  -0.698
    6   HG12  VAL   8          HG13      VAL   8  -8.470  -9.647  -1.325
    7   HG21  VAL   8          HG21      VAL   8  -8.903 -12.221   1.205
    8   HG23  VAL   8          HG22      VAL   8  -7.774 -11.415   0.121
    9   HG22  VAL   8          HG23      VAL   8  -9.089 -12.382  -0.542

  No H/Q in entry =           9
  In of MODEL    6
    1    H    MET   9           H        MET   9 -12.512  -9.615   1.077
    2    HA   MET   9           HA       MET   9 -12.486  -6.840   0.629
    3    HB2  MET   9           HB2      MET   9 -14.642  -8.796   1.375
    4    HB3  MET   9           HB3      MET   9 -14.994  -7.067   1.324
    5    HG2  MET   9           HG2      MET   9 -13.931  -7.090  -1.016
    6    HG3  MET   9           HG3      MET   9 -14.057  -8.846  -0.928
    7    HE1  MET   9           HE1      MET   9 -15.891 -10.186  -0.881
    8    HE3  MET   9           HE2      MET   9 -17.591  -9.778  -1.092
    9    HE2  MET   9           HE3      MET   9 -16.833  -9.568   0.483

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLY  10           H        GLY  10 -13.134  -8.726   3.563
    2    HA3  GLY  10           HA2      GLY  10 -13.720  -6.541   5.269
    3    HA2  GLY  10           HA3      GLY  10 -13.135  -8.119   5.793

  No H/Q in entry =           3
  In of MODEL    6
    1    H    LEU  11           H        LEU  11 -10.683  -8.215   4.488
    2    HA   LEU  11           HA       LEU  11  -9.010  -6.748   6.244
    3    HB2  LEU  11           HB2      LEU  11  -8.433  -8.177   3.646
    4    HB3  LEU  11           HB3      LEU  11  -7.177  -7.449   4.646
    5    HG   LEU  11           HG       LEU  11  -9.153  -9.506   5.665
    6   HD13  LEU  11          HD11      LEU  11  -7.907 -10.732   4.111
    7   HD12  LEU  11          HD12      LEU  11  -6.975 -10.950   5.591
    8   HD11  LEU  11          HD13      LEU  11  -6.446  -9.783   4.380
    9   HD22  LEU  11          HD21      LEU  11  -8.322  -8.471   7.580
   10   HD21  LEU  11          HD22      LEU  11  -6.788  -8.051   6.821
   11   HD23  LEU  11          HD23      LEU  11  -7.091  -9.709   7.337

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  12           H        ILE  12  -9.906  -6.231   2.848
    2    HA   ILE  12           HA       ILE  12  -8.246  -3.978   2.418
    3    HB   ILE  12           HB       ILE  12 -10.884  -4.696   1.115
    4   HG12  ILE  12          HG12      ILE  12  -8.820  -6.315   1.054
    5   HG13  ILE  12          HG13      ILE  12  -9.681  -5.977  -0.434
    6   HG22  ILE  12          HG21      ILE  12  -9.982  -3.297  -0.777
    7   HG21  ILE  12          HG22      ILE  12  -8.691  -2.761   0.291
    8   HG23  ILE  12          HG23      ILE  12 -10.352  -2.396   0.661
    9   HD12  ILE  12          HD11      ILE  12  -7.181  -5.885  -0.639
   10   HD11  ILE  12          HD12      ILE  12  -7.187  -4.524   0.482
   11   HD13  ILE  12          HD13      ILE  12  -7.968  -4.380  -1.074

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  13           H        ILE  13 -11.607  -4.291   3.499
    2    HA   ILE  13           HA       ILE  13 -12.110  -1.509   3.753
    3    HB   ILE  13           HB       ILE  13 -13.284  -3.945   5.114
    4   HG12  ILE  13          HG12      ILE  13 -13.510  -3.380   2.575
    5   HG13  ILE  13          HG13      ILE  13 -14.921  -3.891   3.475
    6   HG21  ILE  13          HG21      ILE  13 -14.039  -1.031   5.379
    7   HG23  ILE  13          HG22      ILE  13 -13.752  -2.193   6.666
    8   HG22  ILE  13          HG23      ILE  13 -15.206  -2.314   5.679
    9   HD11  ILE  13          HD11      ILE  13 -14.208  -0.979   3.063
   10   HD13  ILE  13          HD12      ILE  13 -15.697  -1.647   3.702
   11   HD12  ILE  13          HD13      ILE  13 -15.306  -1.880   2.013

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ASN  14           H        ASN  14 -10.970  -3.971   6.044
    2    HA   ASN  14           HA       ASN  14 -10.804  -2.319   8.323
    3    HB2  ASN  14           HB2      ASN  14 -10.509  -4.924   8.015
    4    HB3  ASN  14           HB3      ASN  14  -8.806  -4.511   7.862
    5   HD21  ASN  14          HD21      ASN  14  -9.427  -6.034  10.043
    6   HD22  ASN  14          HD22      ASN  14  -9.420  -5.107  11.463

  No H/Q in entry =           6
  In of MODEL    6
    1    H    SER  15           H        SER  15  -8.379  -3.117   5.845
    2    HA   SER  15           HA       SER  15  -6.264  -1.585   6.918
    3    HB2  SER  15           HB2      SER  15  -5.231  -1.795   4.765
    4    HB3  SER  15           HB3      SER  15  -6.164  -3.269   4.994
    5    HG   SER  15           HG       SER  15  -7.446  -2.697   3.428

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLY  16           H        GLY  16  -8.870  -0.772   4.656
    2    HA3  GLY  16           HA2      GLY  16  -8.052   1.880   4.095
    3    HA2  GLY  16           HA3      GLY  16  -9.692   1.258   3.929

  No H/Q in entry =           3
  In of MODEL    6
    1    H    GLN  17           H        GLN  17 -10.234   0.537   6.580
    2    HA   GLN  17           HA       GLN  17 -10.987   3.035   7.705
    3    HB2  GLN  17           HB2      GLN  17 -12.170   0.907   8.185
    4    HB3  GLN  17           HB3      GLN  17 -10.764   0.352   9.095
    5    HG2  GLN  17           HG2      GLN  17 -12.396   1.283  10.648
    6    HG3  GLN  17           HG3      GLN  17 -10.994   2.348  10.579
    7   HE21  GLN  17          HE21      GLN  17 -12.012   4.370  10.969
    8   HE22  GLN  17          HE22      GLN  17 -13.224   5.010   9.966

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ALA  18           H        ALA  18  -8.324   0.801   8.347
    2    HA   ALA  18           HA       ALA  18  -7.256   2.047  10.616
    3    HB2  ALA  18           HB1      ALA  18  -6.603  -0.165   9.262
    4    HB3  ALA  18           HB2      ALA  18  -5.458   0.642  10.334
    5    HB1  ALA  18           HB3      ALA  18  -5.378   0.914   8.592

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ARG  19           H        ARG  19  -6.479   2.566   7.168
    2    HA   ARG  19           HA       ARG  19  -4.618   4.648   7.594
    3    HB2  ARG  19           HB2      ARG  19  -4.916   3.490   5.403
    4    HB3  ARG  19           HB3      ARG  19  -6.472   4.304   5.215
    5    HG2  ARG  19           HG2      ARG  19  -5.382   6.495   5.277
    6    HG3  ARG  19           HG3      ARG  19  -3.821   5.737   5.592
    7    HD2  ARG  19           HD2      ARG  19  -3.946   6.314   3.245
    8    HD3  ARG  19           HD3      ARG  19  -4.001   4.553   3.399
    9    HE   ARG  19           HE       ARG  19  -6.650   5.416   3.376
   10   HH21  ARG  19          HH11      ARG  19  -7.839   5.542   1.452
   11   HH22  ARG  19          HH12      ARG  19  -7.013   5.626  -0.064
   12   HH11  ARG  19          HH21      ARG  19  -3.867   5.518   1.354
   13   HH12  ARG  19          HH22      ARG  19  -4.762   5.610  -0.120

  No H/Q in entry =          13
  In of MODEL    6
    1    H    SER  20           H        SER  20  -8.115   4.699   6.978
    2    HA   SER  20           HA       SER  20  -8.520   7.447   6.914
    3    HB2  SER  20           HB2      SER  20 -10.210   5.528   6.553
    4    HB3  SER  20           HB3      SER  20 -10.438   5.588   8.299
    5    HG   SER  20           HG       SER  20 -10.456   8.071   7.320

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU  21           H        LEU  21  -8.494   5.279   9.730
    2    HA   LEU  21           HA       LEU  21  -8.979   7.277  11.682
    3    HB2  LEU  21           HB2      LEU  21  -7.582   4.600  11.860
    4    HB3  LEU  21           HB3      LEU  21  -7.908   5.619  13.258
    5    HG   LEU  21           HG       LEU  21 -10.066   4.689  11.341
    6   HD13  LEU  21          HD11      LEU  21  -9.052   2.735  12.402
    7   HD12  LEU  21          HD12      LEU  21 -10.639   3.034  13.112
    8   HD11  LEU  21          HD13      LEU  21  -9.179   3.499  13.987
    9   HD23  LEU  21          HD21      LEU  21 -11.404   5.155  13.576
   10   HD22  LEU  21          HD22      LEU  21 -10.980   6.511  12.537
   11   HD21  LEU  21          HD23      LEU  21 -10.025   6.176  13.973

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ALA  22           H        ALA  22  -5.996   5.950  10.295
    2    HA   ALA  22           HA       ALA  22  -4.148   7.306  11.918
    3    HB2  ALA  22           HB1      ALA  22  -3.690   5.451  10.238
    4    HB1  ALA  22           HB2      ALA  22  -2.518   6.769  10.272
    5    HB3  ALA  22           HB3      ALA  22  -3.729   6.696   8.991

  No H/Q in entry =           5
  In of MODEL    6
    1    H    TYR  23           H        TYR  23  -5.468   8.282   8.724
    2    HA   TYR  23           HA       TYR  23  -4.178  10.802   8.647
    3    HB2  TYR  23           HB2      TYR  23  -5.234   9.858   6.656
    4    HB3  TYR  23           HB3      TYR  23  -6.817   9.944   7.429
    5    HD1  TYR  23           HD1      TYR  23  -3.947  12.024   6.265
    6    HD2  TYR  23           HD2      TYR  23  -8.087  11.937   7.405
    7    HE1  TYR  23           HE1      TYR  23  -4.208  14.366   5.490
    8    HE2  TYR  23           HE2      TYR  23  -8.349  14.279   6.629
    9    HH   TYR  23           HH       TYR  23  -5.579  16.098   5.313

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ALA  24           H        ALA  24  -7.285   9.775  10.017
    2    HA   ALA  24           HA       ALA  24  -8.172  12.353  10.771
    3    HB1  ALA  24           HB1      ALA  24  -9.970  11.071  11.237
    4    HB2  ALA  24           HB2      ALA  24  -9.140  10.522  12.691
    5    HB3  ALA  24           HB3      ALA  24  -8.992   9.605  11.193

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA  25           H        ALA  25  -6.133   9.940  12.367
    2    HA   ALA  25           HA       ALA  25  -5.830  11.211  14.864
    3    HB2  ALA  25           HB1      ALA  25  -5.016   8.870  14.059
    4    HB3  ALA  25           HB2      ALA  25  -4.022   9.752  15.220
    5    HB1  ALA  25           HB3      ALA  25  -3.578   9.734  13.513

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU  26           H        LEU  26  -4.031  11.527  11.830
    2    HA   LEU  26           HA       LEU  26  -2.110  13.387  12.745
    3    HB2  LEU  26           HB2      LEU  26  -1.778  12.230  10.649
    4    HB3  LEU  26           HB3      LEU  26  -3.261  12.908   9.984
    5    HG   LEU  26           HG       LEU  26  -2.288  15.177  10.112
    6   HD12  LEU  26          HD11      LEU  26   0.248  15.245  10.538
    7   HD11  LEU  26          HD12      LEU  26   0.050  13.664  11.289
    8   HD13  LEU  26          HD13      LEU  26  -0.786  15.068  11.954
    9   HD21  LEU  26          HD21      LEU  26  -0.501  13.147   8.736
   10   HD23  LEU  26          HD22      LEU  26  -0.574  14.865   8.356
   11   HD22  LEU  26          HD23      LEU  26  -1.977  13.841   8.067

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LYS  27           H        LYS  27  -5.293  13.805  11.251
    2    HA   LYS  27           HA       LYS  27  -5.287  16.593  11.038
    3    HB2  LYS  27           HB2      LYS  27  -7.000  15.079  10.053
    4    HB3  LYS  27           HB3      LYS  27  -7.659  14.819  11.667
    5    HG2  LYS  27           HG2      LYS  27  -8.133  17.219  11.889
    6    HG3  LYS  27           HG3      LYS  27  -7.423  17.520  10.299
    7    HD2  LYS  27           HD2      LYS  27  -9.125  16.049   9.263
    8    HD3  LYS  27           HD3      LYS  27  -9.841  15.765  10.851
    9    HE2  LYS  27           HE2      LYS  27 -10.328  18.169  11.079
   10    HE3  LYS  27           HE3      LYS  27  -9.584  18.476   9.506
   11    HZ3  LYS  27           HZ1      LYS  27 -11.957  18.307   9.254
   12    HZ2  LYS  27           HZ2      LYS  27 -11.982  16.794  10.032
   13    HZ1  LYS  27           HZ3      LYS  27 -11.233  16.963   8.513

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLN  28           H        GLN  28  -6.151  14.505  13.773
    2    HA   GLN  28           HA       GLN  28  -7.090  16.502  15.534
    3    HB2  GLN  28           HB2      GLN  28  -5.643  13.900  16.099
    4    HB3  GLN  28           HB3      GLN  28  -6.411  14.897  17.335
    5    HG2  GLN  28           HG2      GLN  28  -7.835  13.735  14.924
    6    HG3  GLN  28           HG3      GLN  28  -7.891  13.054  16.549
    7   HE21  GLN  28          HE21      GLN  28  -9.788  14.800  14.563
    8   HE22  GLN  28          HE22      GLN  28 -10.561  15.815  15.681

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ALA  29           H        ALA  29  -3.846  15.258  14.866
    2    HA   ALA  29           HA       ALA  29  -2.441  16.690  16.843
    3    HB1  ALA  29           HB1      ALA  29  -0.494  16.026  15.736
    4    HB3  ALA  29           HB2      ALA  29  -1.243  16.129  14.143
    5    HB2  ALA  29           HB3      ALA  29  -1.647  14.795  15.223

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LYS  30           H        LYS  30  -3.298  17.538  13.505
    2    HA   LYS  30           HA       LYS  30  -1.926  19.999  13.398
    3    HB2  LYS  30           HB2      LYS  30  -4.436  19.079  11.983
    4    HB3  LYS  30           HB3      LYS  30  -3.625  20.605  11.635
    5    HG2  LYS  30           HG2      LYS  30  -1.533  19.341  11.137
    6    HG3  LYS  30           HG3      LYS  30  -2.418  17.832  11.386
    7    HD2  LYS  30           HD2      LYS  30  -3.983  18.440   9.581
    8    HD3  LYS  30           HD3      LYS  30  -3.122  19.960   9.334
    9    HE2  LYS  30           HE2      LYS  30  -1.068  18.695   8.770
   10    HE3  LYS  30           HE3      LYS  30  -1.948  17.179   8.986
   11    HZ2  LYS  30           HZ1      LYS  30  -1.775  18.041   6.640
   12    HZ1  LYS  30           HZ2      LYS  30  -2.839  19.290   7.098
   13    HZ3  LYS  30           HZ3      LYS  30  -3.340  17.666   7.175

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLN  31           H        GLN  31  -5.019  19.109  14.802
    2    HA   GLN  31           HA       GLN  31  -5.824  21.857  15.237
    3    HB2  GLN  31           HB2      GLN  31  -6.974  19.401  16.567
    4    HB3  GLN  31           HB3      GLN  31  -7.755  20.960  16.310
    5    HG2  GLN  31           HG2      GLN  31  -7.023  20.180  13.727
    6    HG3  GLN  31           HG3      GLN  31  -7.530  18.672  14.480
    7   HE21  GLN  31          HE21      GLN  31  -8.953  20.216  12.364
    8   HE22  GLN  31          HE22      GLN  31 -10.474  20.590  13.014

  No H/Q in entry =           8
  In of MODEL    6
    1    H    GLY  32           H        GLY  32  -3.491  19.968  16.576
    2    HA3  GLY  32           HA2      GLY  32  -2.104  20.458  18.381
    3    HA2  GLY  32           HA3      GLY  32  -3.252  21.688  18.894

  No H/Q in entry =           3
  In of MODEL    6
    1    H    ASP  33           H        ASP  33  -4.630  18.627  18.242
    2    HA   ASP  33           HA       ASP  33  -5.047  18.177  21.122
    3    HB2  ASP  33           HB2      ASP  33  -6.429  17.135  18.644
    4    HB3  ASP  33           HB3      ASP  33  -6.773  16.528  20.261

  No H/Q in entry =           4
  In of MODEL    6
    1    H    PHE  34           H        PHE  34  -2.868  17.357  21.440
    2    HA   PHE  34           HA       PHE  34  -1.832  15.115  20.054
    3    HB2  PHE  34           HB2      PHE  34  -1.240  16.121  22.846
    4    HB3  PHE  34           HB3      PHE  34  -0.291  14.906  21.989
    5    HD1  PHE  34           HD1      PHE  34  -0.512  18.333  22.707
    6    HD2  PHE  34           HD2      PHE  34   0.367  15.626  19.488
    7    HE1  PHE  34           HE1      PHE  34   0.764  20.116  21.549
    8    HE2  PHE  34           HE2      PHE  34   1.638  17.412  18.336
    9    HZ   PHE  34           HZ       PHE  34   1.839  19.654  19.371

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ALA  35           H        ALA  35  -3.887  15.378  22.908
    2    HA   ALA  35           HA       ALA  35  -3.643  12.723  23.817
    3    HB3  ALA  35           HB1      ALA  35  -6.112  13.320  24.662
    4    HB1  ALA  35           HB2      ALA  35  -5.599  14.944  24.201
    5    HB2  ALA  35           HB3      ALA  35  -4.677  14.037  25.400

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA  36           H        ALA  36  -6.104  14.197  21.701
    2    HA   ALA  36           HA       ALA  36  -7.485  11.765  21.229
    3    HB1  ALA  36           HB1      ALA  36  -8.956  13.164  20.260
    4    HB3  ALA  36           HB2      ALA  36  -7.784  13.594  19.014
    5    HB2  ALA  36           HB3      ALA  36  -7.827  14.488  20.534

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA  37           H        ALA  37  -4.820  13.380  19.563
    2    HA   ALA  37           HA       ALA  37  -4.754  11.735  17.274
    3    HB3  ALA  37           HB1      ALA  37  -2.790  13.480  18.697
    4    HB2  ALA  37           HB2      ALA  37  -3.314  13.521  17.015
    5    HB1  ALA  37           HB3      ALA  37  -2.147  12.308  17.546

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LYS  38           H        LYS  38  -3.005  11.466  20.360
    2    HA   LYS  38           HA       LYS  38  -1.646   9.082  19.888
    3    HB2  LYS  38           HB2      LYS  38  -2.001  10.850  22.024
    4    HB3  LYS  38           HB3      LYS  38  -2.602   9.315  22.645
    5    HG2  LYS  38           HG2      LYS  38  -0.491   8.221  22.122
    6    HG3  LYS  38           HG3      LYS  38   0.102   9.670  21.304
    7    HD2  LYS  38           HD2      LYS  38   0.246  10.900  23.334
    8    HD3  LYS  38           HD3      LYS  38  -0.761   9.740  24.202
    9    HE2  LYS  38           HE2      LYS  38   1.596   9.459  24.832
   10    HE3  LYS  38           HE3      LYS  38   1.014   8.031  23.972
   11    HZ3  LYS  38           HZ1      LYS  38   2.316   8.459  22.194
   12    HZ2  LYS  38           HZ2      LYS  38   3.256   9.305  23.331
   13    HZ1  LYS  38           HZ3      LYS  38   2.169  10.145  22.331

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ALA  39           H        ALA  39  -4.896   9.540  21.275
    2    HA   ALA  39           HA       ALA  39  -5.422   6.816  21.790
    3    HB3  ALA  39           HB1      ALA  39  -7.604   8.728  21.005
    4    HB2  ALA  39           HB2      ALA  39  -6.715   8.974  22.509
    5    HB1  ALA  39           HB3      ALA  39  -7.610   7.476  22.249

  No H/Q in entry =           5
  In of MODEL    6
    1    H    MET  40           H        MET  40  -6.023   8.808  18.932
    2    HA   MET  40           HA       MET  40  -7.467   6.850  17.475
    3    HB2  MET  40           HB2      MET  40  -5.886   9.262  16.565
    4    HB3  MET  40           HB3      MET  40  -6.894   8.285  15.495
    5    HG2  MET  40           HG2      MET  40  -7.956   9.531  18.044
    6    HG3  MET  40           HG3      MET  40  -8.018  10.358  16.489
    7    HE3  MET  40           HE1      MET  40 -10.571   8.694  14.422
    8    HE2  MET  40           HE2      MET  40  -8.820   8.834  14.280
    9    HE1  MET  40           HE3      MET  40  -9.759  10.190  14.904

  No H/Q in entry =           9
  In of MODEL    6
    1    H    MET  41           H        MET  41  -3.987   7.635  17.608
    2    HA   MET  41           HA       MET  41  -3.196   5.882  15.518
    3    HB2  MET  41           HB2      MET  41  -1.598   6.582  17.995
    4    HB3  MET  41           HB3      MET  41  -0.966   5.936  16.484
    5    HG2  MET  41           HG2      MET  41  -2.148   8.098  15.466
    6    HG3  MET  41           HG3      MET  41  -1.927   8.696  17.109
    7    HE2  MET  41           HE1      MET  41   1.018   6.640  17.491
    8    HE1  MET  41           HE2      MET  41   0.208   7.927  18.381
    9    HE3  MET  41           HE3      MET  41   1.831   8.190  17.743

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ASP  42           H        ASP  42  -3.588   5.419  19.005
    2    HA   ASP  42           HA       ASP  42  -2.517   2.841  19.181
    3    HB2  ASP  42           HB2      ASP  42  -3.422   4.596  20.992
    4    HB3  ASP  42           HB3      ASP  42  -4.835   3.550  20.918

  No H/Q in entry =           4
  In of MODEL    6
    1    H    GLN  43           H        GLN  43  -5.863   3.895  18.662
    2    HA   GLN  43           HA       GLN  43  -6.969   1.291  18.474
    3    HB2  GLN  43           HB2      GLN  43  -7.925   3.925  17.330
    4    HB3  GLN  43           HB3      GLN  43  -8.867   2.432  17.310
    5    HG2  GLN  43           HG2      GLN  43  -8.582   2.326  19.819
    6    HG3  GLN  43           HG3      GLN  43  -7.880   3.941  19.744
    7   HE21  GLN  43          HE21      GLN  43 -10.067   3.996  21.235
    8   HE22  GLN  43          HE22      GLN  43 -11.432   4.549  20.395

  No H/Q in entry =           8
  In of MODEL    6
    1    H    SER  44           H        SER  44  -5.650   3.513  16.058
    2    HA   SER  44           HA       SER  44  -6.321   2.009  13.773
    3    HB2  SER  44           HB2      SER  44  -5.100   4.412  14.211
    4    HB3  SER  44           HB3      SER  44  -3.730   3.433  13.691
    5    HG   SER  44           HG       SER  44  -4.849   4.381  11.919

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ARG  45           H        ARG  45  -3.451   1.946  15.865
    2    HA   ARG  45           HA       ARG  45  -1.937   0.007  14.498
    3    HB2  ARG  45           HB2      ARG  45  -1.124   1.448  16.364
    4    HB3  ARG  45           HB3      ARG  45  -2.106   0.508  17.484
    5    HG2  ARG  45           HG2      ARG  45  -0.843  -1.535  16.856
    6    HG3  ARG  45           HG3      ARG  45   0.164  -0.571  15.778
    7    HD2  ARG  45           HD2      ARG  45   0.870   0.829  17.731
    8    HD3  ARG  45           HD3      ARG  45  -0.041  -0.254  18.805
    9    HE   ARG  45           HE       ARG  45   1.687  -1.833  17.239
   10   HH21  ARG  45          HH11      ARG  45   3.595  -2.625  18.088
   11   HH22  ARG  45          HH12      ARG  45   4.351  -1.822  19.419
   12   HH11  ARG  45          HH21      ARG  45   1.945   0.648  19.619
   13   HH12  ARG  45          HH22      ARG  45   3.416   0.034  20.283

  No H/Q in entry =          13
  In of MODEL    6
    1    H    MET  46           H        MET  46  -4.341  -0.336  17.090
    2    HA   MET  46           HA       MET  46  -4.135  -3.131  17.409
    3    HB2  MET  46           HB2      MET  46  -6.345  -1.160  17.986
    4    HB3  MET  46           HB3      MET  46  -6.510  -2.881  18.347
    5    HG2  MET  46           HG2      MET  46  -4.488  -2.794  19.744
    6    HG3  MET  46           HG3      MET  46  -4.286  -1.090  19.369
    7    HE2  MET  46           HE1      MET  46  -4.602   0.108  21.866
    8    HE1  MET  46           HE2      MET  46  -4.002  -1.543  21.978
    9    HE3  MET  46           HE3      MET  46  -5.272  -0.999  23.070

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ALA  47           H        ALA  47  -6.174  -1.152  15.297
    2    HA   ALA  47           HA       ALA  47  -7.759  -3.229  14.233
    3    HB3  ALA  47           HB1      ALA  47  -8.467  -1.003  13.805
    4    HB1  ALA  47           HB2      ALA  47  -7.963  -1.637  12.238
    5    HB2  ALA  47           HB3      ALA  47  -6.901  -0.549  13.135

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU  48           H        LEU  48  -4.653  -1.883  13.191
    2    HA   LEU  48           HA       LEU  48  -4.341  -3.479  10.857
    3    HB2  LEU  48           HB2      LEU  48  -2.309  -2.166  12.669
    4    HB3  LEU  48           HB3      LEU  48  -1.923  -2.888  11.107
    5    HG   LEU  48           HG       LEU  48  -3.977  -0.696  11.478
    6   HD13  LEU  48          HD11      LEU  48  -1.870   0.211  12.149
    7   HD12  LEU  48          HD12      LEU  48  -2.145   0.754  10.494
    8   HD11  LEU  48          HD13      LEU  48  -1.031  -0.577  10.813
    9   HD22  LEU  48          HD21      LEU  48  -4.426  -1.695   9.405
   10   HD21  LEU  48          HD22      LEU  48  -2.737  -2.110   9.119
   11   HD23  LEU  48          HD23      LEU  48  -3.277  -0.438   8.950

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ASN  49           H        ASN  49  -3.305  -3.849  14.210
    2    HA   ASN  49           HA       ASN  49  -1.672  -6.092  13.896
    3    HB2  ASN  49           HB2      ASN  49  -1.720  -4.754  15.939
    4    HB3  ASN  49           HB3      ASN  49  -3.377  -5.247  16.256
    5   HD21  ASN  49          HD21      ASN  49  -1.487  -5.762  18.215
    6   HD22  ASN  49          HD22      ASN  49  -1.154  -7.425  18.283

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLU  50           H        GLU  50  -5.147  -5.858  14.551
    2    HA   GLU  50           HA       GLU  50  -5.626  -8.663  14.669
    3    HB2  GLU  50           HB2      GLU  50  -7.236  -6.992  15.531
    4    HB3  GLU  50           HB3      GLU  50  -7.529  -6.438  13.880
    5    HG2  GLU  50           HG2      GLU  50  -8.364  -8.647  13.248
    6    HG3  GLU  50           HG3      GLU  50  -7.982  -9.279  14.845

  No H/Q in entry =           6
  In of MODEL    6
    1    H    ALA  51           H        ALA  51  -5.711  -6.276  12.063
    2    HA   ALA  51           HA       ALA  51  -6.666  -8.024  10.043
    3    HB2  ALA  51           HB1      ALA  51  -6.461  -6.215   8.668
    4    HB1  ALA  51           HB2      ALA  51  -4.828  -5.844   9.222
    5    HB3  ALA  51           HB3      ALA  51  -6.223  -5.345  10.182

  No H/Q in entry =           5
  In of MODEL    6
    1    H    HIS  52           H        HIS  52  -3.391  -7.075  11.038
    2    HA   HIS  52           HA       HIS  52  -1.966  -8.556   9.102
    3    HB2  HIS  52           HB2      HIS  52  -0.947  -6.809  10.524
    4    HB3  HIS  52           HB3      HIS  52  -1.132  -7.859  11.929
    5    HD1  HIS  52           HD1      HIS  52   0.205 -10.198  11.806
    6    HD2  HIS  52           HD2      HIS  52   1.330  -7.324   9.004
    7    HE1  HIS  52           HE1      HIS  52   2.455 -10.925  10.898
    8    HE2  HIS  52           HE2      HIS  52   3.153  -9.184   9.187

  No H/Q in entry =           8
  In of MODEL    6
    1    H    LEU  53           H        LEU  53  -3.183  -9.434  12.312
    2    HA   LEU  53           HA       LEU  53  -1.958 -11.963  12.522
    3    HB2  LEU  53           HB2      LEU  53  -4.463 -10.808  13.719
    4    HB3  LEU  53           HB3      LEU  53  -3.982 -12.475  14.022
    5    HG   LEU  53           HG       LEU  53  -2.134 -10.113  14.503
    6   HD13  LEU  53          HD11      LEU  53  -2.717 -10.356  16.890
    7   HD12  LEU  53          HD12      LEU  53  -3.909 -11.586  16.471
    8   HD11  LEU  53          HD13      LEU  53  -4.132  -9.924  15.936
    9   HD22  LEU  53          HD21      LEU  53  -0.777 -12.030  14.478
   10   HD21  LEU  53          HD22      LEU  53  -2.058 -13.062  15.102
   11   HD23  LEU  53          HD23      LEU  53  -1.221 -11.961  16.179

  No H/Q in entry =          11
  In of MODEL    6
    1    H    VAL  54           H        VAL  54  -5.073 -10.974  11.141
    2    HA   VAL  54           HA       VAL  54  -5.956 -13.580  10.460
    3    HB   VAL  54           HB       VAL  54  -6.627 -10.859   9.311
    4   HG12  VAL  54          HG11      VAL  54  -8.710 -12.262   8.495
    5   HG11  VAL  54          HG12      VAL  54  -7.584 -13.616   8.578
    6   HG13  VAL  54          HG13      VAL  54  -7.234 -12.242   7.532
    7   HG22  VAL  54          HG21      VAL  54  -7.543 -10.898  11.459
    8   HG21  VAL  54          HG22      VAL  54  -7.779 -12.644  11.445
    9   HG23  VAL  54          HG23      VAL  54  -8.867 -11.602  10.529

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLN  55           H        GLN  55  -4.102 -11.116   8.670
    2    HA   GLN  55           HA       GLN  55  -3.945 -12.589   6.259
    3    HB2  GLN  55           HB2      GLN  55  -3.364 -10.319   6.063
    4    HB3  GLN  55           HB3      GLN  55  -2.259 -10.379   7.433
    5    HG2  GLN  55           HG2      GLN  55  -0.527 -11.212   6.168
    6    HG3  GLN  55           HG3      GLN  55  -1.586 -12.202   5.173
    7   HE21  GLN  55          HE21      GLN  55  -1.599 -11.521   3.049
    8   HE22  GLN  55          HE22      GLN  55  -1.415  -9.916   2.533

  No H/Q in entry =           8
  In of MODEL    6
    1    H    THR  56           H        THR  56  -1.853 -12.535   9.149
    2    HA   THR  56           HA       THR  56   0.246 -14.116   8.249
    3    HB   THR  56           HB       THR  56  -1.008 -14.365  10.991
    4    HG1  THR  56           HG1      THR  56   1.080 -12.617  10.567
    5   HG23  THR  56          HG21      THR  56   1.071 -15.153  11.699
    6   HG22  THR  56          HG22      THR  56   1.921 -14.421  10.338
    7   HG21  THR  56          HG23      THR  56   0.945 -15.870  10.094

  No H/Q in entry =           7
  In of MODEL    6
    1    H    LYS  57           H        LYS  57  -2.870 -15.178   9.601
    2    HA   LYS  57           HA       LYS  57  -2.395 -17.970   9.369
    3    HB2  LYS  57           HB2      LYS  57  -4.232 -16.889  10.700
    4    HB3  LYS  57           HB3      LYS  57  -5.021 -16.459   9.191
    5    HG2  LYS  57           HG2      LYS  57  -5.161 -18.863   8.596
    6    HG3  LYS  57           HG3      LYS  57  -4.431 -19.275  10.145
    7    HD2  LYS  57           HD2      LYS  57  -6.968 -17.639   9.952
    8    HD3  LYS  57           HD3      LYS  57  -6.991 -19.400  10.034
    9    HE2  LYS  57           HE2      LYS  57  -5.587 -19.211  12.150
   10    HE3  LYS  57           HE3      LYS  57  -5.886 -17.474  12.115
   11    HZ1  LYS  57           HZ1      LYS  57  -8.305 -18.893  11.756
   12    HZ3  LYS  57           HZ2      LYS  57  -7.880 -17.787  12.974
   13    HZ2  LYS  57           HZ3      LYS  57  -7.521 -19.438  13.159

  No H/Q in entry =          13
  In of MODEL    6
    1    H    LEU  58           H        LEU  58  -3.740 -15.550   7.177
    2    HA   LEU  58           HA       LEU  58  -4.515 -17.391   5.174
    3    HB2  LEU  58           HB2      LEU  58  -3.937 -14.437   5.029
    4    HB3  LEU  58           HB3      LEU  58  -4.584 -15.386   3.690
    5    HG   LEU  58           HG       LEU  58  -5.879 -15.208   6.431
    6   HD11  LEU  58          HD11      LEU  58  -6.183 -13.574   3.931
    7   HD13  LEU  58          HD12      LEU  58  -6.186 -13.060   5.618
    8   HD12  LEU  58          HD13      LEU  58  -7.598 -13.869   4.942
    9   HD22  LEU  58          HD21      LEU  58  -6.819 -17.130   5.564
   10   HD21  LEU  58          HD22      LEU  58  -6.476 -16.682   3.894
   11   HD23  LEU  58          HD23      LEU  58  -7.850 -15.966   4.735

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  59           H        ILE  59  -1.396 -16.146   6.045
    2    HA   ILE  59           HA       ILE  59  -0.278 -16.874   3.417
    3    HB   ILE  59           HB       ILE  59   0.463 -14.795   4.984
    4   HG12  ILE  59          HG12      ILE  59   2.582 -16.424   3.570
    5   HG13  ILE  59          HG13      ILE  59   1.375 -15.513   2.701
    6   HG22  ILE  59          HG21      ILE  59   2.563 -16.824   5.697
    7   HG21  ILE  59          HG22      ILE  59   1.204 -16.553   6.763
    8   HG23  ILE  59          HG23      ILE  59   2.313 -15.236   6.381
    9   HD13  ILE  59          HD11      ILE  59   3.342 -14.122   2.925
   10   HD12  ILE  59          HD12      ILE  59   3.385 -14.412   4.662
   11   HD11  ILE  59          HD13      ILE  59   2.077 -13.460   3.959

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLU  60           H        GLU  60  -0.295 -17.966   6.789
    2    HA   GLU  60           HA       GLU  60   1.756 -19.925   6.543
    3    HB2  GLU  60           HB2      GLU  60   0.948 -19.120   8.723
    4    HB3  GLU  60           HB3      GLU  60  -0.627 -19.848   8.414
    5    HG2  GLU  60           HG2      GLU  60   0.424 -22.082   8.303
    6    HG3  GLU  60           HG3      GLU  60   2.001 -21.355   8.603

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLY  61           H        GLY  61  -1.751 -20.059   6.040
    2    HA3  GLY  61           HA2      GLY  61  -1.471 -22.853   5.095
    3    HA2  GLY  61           HA3      GLY  61  -2.966 -22.129   5.678

  No H/Q in entry =           3
  In of MODEL    6
    1    H    ASP  62           H        ASP  62  -0.739 -20.541   3.478
    2    HA   ASP  62           HA       ASP  62  -2.752 -19.839   1.638
    3    HB2  ASP  62           HB2      ASP  62  -0.857 -19.105   0.224
    4    HB3  ASP  62           HB3      ASP  62  -0.696 -18.555   1.889

  No H/Q in entry =           4
  In of MODEL    6
    1    H    ALA  63           H        ALA  63  -0.474 -22.574   1.651
    2    HA   ALA  63           HA       ALA  63  -0.859 -23.462  -1.003
    3    HB1  ALA  63           HB1      ALA  63  -0.239 -25.020   1.504
    4    HB3  ALA  63           HB2      ALA  63   0.912 -24.377   0.332
    5    HB2  ALA  63           HB3      ALA  63  -0.174 -25.690  -0.129

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLY  64           H        GLY  64  -1.817 -25.962   1.034
    2    HA3  GLY  64           HA2      GLY  64  -3.818 -27.031   1.466
    3    HA2  GLY  64           HA3      GLY  64  -4.665 -25.574   0.975

  No H/Q in entry =           3
  In of MODEL    6
    1    H    GLU  65           H        GLU  65  -2.380 -26.861  -1.278
    2    HA   GLU  65           HA       GLU  65  -4.532 -28.249  -2.728
    3    HB2  GLU  65           HB2      GLU  65  -2.793 -26.048  -3.838
    4    HB3  GLU  65           HB3      GLU  65  -3.769 -27.128  -4.835
    5    HG2  GLU  65           HG2      GLU  65  -5.804 -26.405  -3.705
    6    HG3  GLU  65           HG3      GLU  65  -4.866 -25.406  -2.597

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLY  66           H        GLY  66  -1.290 -27.278  -3.632
    2    HA3  GLY  66           HA2      GLY  66  -0.085 -29.842  -3.327
    3    HA2  GLY  66           HA3      GLY  66  -0.482 -29.518  -5.003

  No H/Q in entry =           3
  In of MODEL    6
    1    H    LYS  67           H        LYS  67   0.514 -27.731  -6.049
    2    HA   LYS  67           HA       LYS  67   3.280 -27.530  -5.467
    3    HB2  LYS  67           HB2      LYS  67   1.521 -26.193  -7.514
    4    HB3  LYS  67           HB3      LYS  67   3.275 -25.984  -7.454
    5    HG2  LYS  67           HG2      LYS  67   3.579 -28.427  -7.602
    6    HG3  LYS  67           HG3      LYS  67   1.831 -28.645  -7.660
    7    HD2  LYS  67           HD2      LYS  67   1.715 -27.412  -9.769
    8    HD3  LYS  67           HD3      LYS  67   3.450 -27.090  -9.699
    9    HE2  LYS  67           HE2      LYS  67   3.296 -28.974 -11.116
   10    HE3  LYS  67           HE3      LYS  67   3.717 -29.662  -9.549
   11    HZ2  LYS  67           HZ1      LYS  67   1.655 -30.477 -11.029
   12    HZ1  LYS  67           HZ2      LYS  67   0.882 -29.332 -10.040
   13    HZ3  LYS  67           HZ3      LYS  67   1.723 -30.633  -9.342

  No H/Q in entry =          13
  In of MODEL    6
    1    H    MET  68           H        MET  68   4.500 -25.525  -5.481
    2    HA   MET  68           HA       MET  68   4.216 -24.038  -3.203
    3    HB2  MET  68           HB2      MET  68   5.583 -23.341  -5.798
    4    HB3  MET  68           HB3      MET  68   5.774 -22.403  -4.316
    5    HG2  MET  68           HG2      MET  68   6.578 -24.417  -3.140
    6    HG3  MET  68           HG3      MET  68   6.390 -25.358  -4.622
    7    HE3  MET  68           HE1      MET  68   9.065 -25.480  -3.217
    8    HE2  MET  68           HE2      MET  68  10.176 -25.251  -4.566
    9    HE1  MET  68           HE3      MET  68   8.708 -26.197  -4.793

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LYS  69           H        LYS  69   1.988 -23.855  -5.592
    2    HA   LYS  69           HA       LYS  69   1.620 -21.083  -5.941
    3    HB2  LYS  69           HB2      LYS  69  -0.408 -23.284  -6.253
    4    HB3  LYS  69           HB3      LYS  69  -0.562 -21.634  -6.870
    5    HG2  LYS  69           HG2      LYS  69   1.776 -23.430  -7.549
    6    HG3  LYS  69           HG3      LYS  69   0.323 -23.330  -8.544
    7    HD2  LYS  69           HD2      LYS  69   0.728 -20.774  -8.523
    8    HD3  LYS  69           HD3      LYS  69   2.354 -21.178  -7.969
    9    HE2  LYS  69           HE2      LYS  69   2.727 -22.568  -9.938
   10    HE3  LYS  69           HE3      LYS  69   1.068 -22.305 -10.472
   11    HZ3  LYS  69           HZ1      LYS  69   1.532 -19.953 -10.676
   12    HZ2  LYS  69           HZ2      LYS  69   2.621 -20.851 -11.620
   13    HZ1  LYS  69           HZ3      LYS  69   3.123 -20.189 -10.138

  No H/Q in entry =          13
  In of MODEL    6
    1    H    VAL  70           H        VAL  70   0.173 -19.586  -5.130
    2    HA   VAL  70           HA       VAL  70  -1.201 -20.275  -2.596
    3    HB   VAL  70           HB       VAL  70  -0.540 -18.030  -1.743
    4   HG12  VAL  70          HG11      VAL  70   1.821 -19.730  -2.595
    5   HG11  VAL  70          HG12      VAL  70   0.788 -20.067  -1.206
    6   HG13  VAL  70          HG13      VAL  70   1.780 -18.608  -1.235
    7   HG22  VAL  70          HG21      VAL  70  -0.169 -16.787  -3.779
    8   HG21  VAL  70          HG22      VAL  70   1.022 -17.956  -4.344
    9   HG23  VAL  70          HG23      VAL  70   1.404 -16.903  -2.985

  No H/Q in entry =           9
  In of MODEL    6
    1    H    SER  71           H        SER  71  -2.861 -18.648  -2.026
    2    HA   SER  71           HA       SER  71  -4.704 -18.190  -4.121
    3    HB2  SER  71           HB2      SER  71  -5.358 -18.369  -1.718
    4    HB3  SER  71           HB3      SER  71  -4.552 -16.837  -1.401
    5    HG   SER  71           HG       SER  71  -6.593 -17.172  -3.342

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU  72           H        LEU  72  -5.009 -16.502  -5.454
    2    HA   LEU  72           HA       LEU  72  -2.918 -14.670  -5.934
    3    HB2  LEU  72           HB2      LEU  72  -5.778 -14.755  -6.891
    4    HB3  LEU  72           HB3      LEU  72  -4.588 -13.591  -7.468
    5    HG   LEU  72           HG       LEU  72  -4.151 -16.592  -7.580
    6   HD11  LEU  72          HD11      LEU  72  -5.262 -14.691  -9.663
    7   HD13  LEU  72          HD12      LEU  72  -6.072 -16.096  -8.968
    8   HD12  LEU  72          HD13      LEU  72  -4.679 -16.315 -10.026
    9   HD22  LEU  72          HD21      LEU  72  -2.047 -15.576  -7.838
   10   HD21  LEU  72          HD22      LEU  72  -2.703 -14.169  -8.657
   11   HD23  LEU  72          HD23      LEU  72  -2.596 -15.708  -9.505

  No H/Q in entry =          11
  In of MODEL    6
    1    H    VAL  73           H        VAL  73  -6.021 -14.340  -4.318
    2    HA   VAL  73           HA       VAL  73  -6.097 -11.568  -3.977
    3    HB   VAL  73           HB       VAL  73  -7.808 -11.944  -2.381
    4   HG12  VAL  73          HG11      VAL  73  -7.980 -14.411  -4.100
    5   HG11  VAL  73          HG12      VAL  73  -8.073 -12.805  -4.820
    6   HG13  VAL  73          HG13      VAL  73  -9.269 -13.305  -3.624
    7   HG22  VAL  73          HG21      VAL  73  -6.977 -13.394  -0.764
    8   HG21  VAL  73          HG22      VAL  73  -6.346 -14.528  -1.959
    9   HG23  VAL  73          HG23      VAL  73  -8.077 -14.468  -1.629

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LEU  74           H        LEU  74  -4.141 -13.910  -2.378
    2    HA   LEU  74           HA       LEU  74  -3.751 -12.755   0.143
    3    HB2  LEU  74           HB2      LEU  74  -2.942 -14.967  -0.347
    4    HB3  LEU  74           HB3      LEU  74  -1.888 -14.348  -1.617
    5    HG   LEU  74           HG       LEU  74  -0.608 -13.072   0.073
    6   HD12  LEU  74          HD11      LEU  74  -1.092 -13.790   2.509
    7   HD11  LEU  74          HD12      LEU  74  -2.672 -14.299   1.909
    8   HD13  LEU  74          HD13      LEU  74  -2.184 -12.608   1.788
    9   HD21  LEU  74          HD21      LEU  74  -0.373 -15.636  -0.539
   10   HD23  LEU  74          HD22      LEU  74  -0.796 -15.815   1.149
   11   HD22  LEU  74          HD23      LEU  74   0.629 -14.902   0.712

  No H/Q in entry =          11
  In of MODEL    6
    1    H    VAL  75           H        VAL  75  -1.854 -12.352  -2.809
    2    HA   VAL  75           HA       VAL  75  -0.081 -10.405  -1.798
    3    HB   VAL  75           HB       VAL  75  -1.020 -10.910  -4.623
    4   HG11  VAL  75          HG11      VAL  75   1.222  -9.150  -3.538
    5   HG13  VAL  75          HG12      VAL  75  -0.188  -8.614  -4.438
    6   HG12  VAL  75          HG13      VAL  75   1.036  -9.592  -5.231
    7   HG22  VAL  75          HG21      VAL  75   0.197 -12.770  -3.555
    8   HG21  VAL  75          HG22      VAL  75   1.486 -11.666  -3.077
    9   HG23  VAL  75          HG23      VAL  75   1.208 -12.009  -4.785

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLU  76           H        GLU  76  -3.228 -10.097  -3.469
    2    HA   GLU  76           HA       GLU  76  -3.310  -7.284  -3.580
    3    HB2  GLU  76           HB2      GLU  76  -4.945  -8.788  -4.729
    4    HB3  GLU  76           HB3      GLU  76  -5.624  -9.213  -3.166
    5    HG2  GLU  76           HG2      GLU  76  -6.296  -6.877  -2.792
    6    HG3  GLU  76           HG3      GLU  76  -5.598  -6.400  -4.328

  No H/Q in entry =           6
  In of MODEL    6
    1    H    ALA  77           H        ALA  77  -4.406  -9.515  -1.037
    2    HA   ALA  77           HA       ALA  77  -5.391  -7.518   0.711
    3    HB1  ALA  77           HB1      ALA  77  -4.415 -10.336   1.149
    4    HB3  ALA  77           HB2      ALA  77  -6.071  -9.730   1.177
    5    HB2  ALA  77           HB3      ALA  77  -4.963  -9.326   2.487

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLN  78           H        GLN  78  -2.226  -9.035   0.364
    2    HA   GLN  78           HA       GLN  78  -0.989  -7.854   2.614
    3    HB2  GLN  78           HB2      GLN  78  -0.100  -9.790   1.274
    4    HB3  GLN  78           HB3      GLN  78   0.324  -8.647   0.001
    5    HG2  GLN  78           HG2      GLN  78   1.766  -7.423   1.579
    6    HG3  GLN  78           HG3      GLN  78   1.347  -8.567   2.852
    7   HE21  GLN  78          HE21      GLN  78   3.301  -9.723   3.133
    8   HE22  GLN  78          HE22      GLN  78   4.110 -10.527   1.874

  No H/Q in entry =           8
  In of MODEL    6
    1    H    LEU  79           H        LEU  79  -1.354  -6.808  -0.737
    2    HA   LEU  79           HA       LEU  79   0.310  -4.564  -0.725
    3    HB2  LEU  79           HB2      LEU  79  -0.701  -5.388  -2.780
    4    HB3  LEU  79           HB3      LEU  79  -2.310  -5.010  -2.179
    5    HG   LEU  79           HG       LEU  79  -1.790  -2.618  -2.159
    6   HD13  LEU  79          HD11      LEU  79   0.446  -2.350  -1.639
    7   HD12  LEU  79          HD12      LEU  79   0.498  -2.068  -3.379
    8   HD11  LEU  79          HD13      LEU  79   0.966  -3.639  -2.726
    9   HD23  LEU  79          HD21      LEU  79  -1.148  -2.421  -4.710
   10   HD22  LEU  79          HD22      LEU  79  -2.669  -3.183  -4.254
   11   HD21  LEU  79          HD23      LEU  79  -1.285  -4.180  -4.690

  No H/Q in entry =          11
  In of MODEL    6
    1    H    HIS  80           H        HIS  80  -3.158  -4.757   0.089
    2    HA   HIS  80           HA       HIS  80  -3.378  -2.001   0.742
    3    HB2  HIS  80           HB2      HIS  80  -5.058  -4.425   1.063
    4    HB3  HIS  80           HB3      HIS  80  -5.395  -3.084   2.161
    5    HD1  HIS  80           HD1      HIS  80  -7.025  -1.466   1.242
    6    HD2  HIS  80           HD2      HIS  80  -4.803  -3.267  -1.792
    7    HE1  HIS  80           HE1      HIS  80  -7.866  -0.484  -0.944
    8    HE2  HIS  80           HE2      HIS  80  -6.518  -1.577  -2.802

  No H/Q in entry =           8
  In of MODEL    6
    1    H    LEU  81           H        LEU  81  -2.870  -4.884   2.747
    2    HA   LEU  81           HA       LEU  81  -2.879  -3.528   5.226
    3    HB2  LEU  81           HB2      LEU  81  -1.633  -6.136   4.360
    4    HB3  LEU  81           HB3      LEU  81  -1.618  -5.572   6.032
    5    HG   LEU  81           HG       LEU  81  -4.156  -5.853   4.396
    6   HD12  LEU  81          HD11      LEU  81  -4.445  -7.916   5.949
    7   HD11  LEU  81          HD12      LEU  81  -2.694  -7.829   6.142
    8   HD13  LEU  81          HD13      LEU  81  -3.395  -8.071   4.541
    9   HD23  LEU  81          HD21      LEU  81  -5.006  -6.055   6.894
   10   HD22  LEU  81          HD22      LEU  81  -4.693  -4.466   6.200
   11   HD21  LEU  81          HD23      LEU  81  -3.504  -5.212   7.267

  No H/Q in entry =          11
  In of MODEL    6
    1    H    MET  82           H        MET  82  -0.182  -4.415   3.069
    2    HA   MET  82           HA       MET  82   1.887  -3.496   4.757
    3    HB2  MET  82           HB2      MET  82   1.686  -3.850   1.765
    4    HB3  MET  82           HB3      MET  82   3.160  -3.264   2.532
    5    HG2  MET  82           HG2      MET  82   1.773  -5.863   3.260
    6    HG3  MET  82           HG3      MET  82   3.148  -5.745   2.165
    7    HE3  MET  82           HE1      MET  82   6.150  -4.976   4.157
    8    HE2  MET  82           HE2      MET  82   5.217  -3.618   3.531
    9    HE1  MET  82           HE3      MET  82   5.322  -5.111   2.601

  No H/Q in entry =           9
  In of MODEL    6
    1    H    THR  83           H        THR  83   0.060  -1.879   2.188
    2    HA   THR  83           HA       THR  83   1.451   0.581   2.271
    3    HB   THR  83           HB       THR  83  -0.730   1.484   1.274
    4    HG1  THR  83           HG1      THR  83  -2.369   0.173   1.165
    5   HG22  THR  83          HG21      THR  83  -0.437  -0.338  -0.720
    6   HG21  THR  83          HG22      THR  83   1.063  -0.614   0.164
    7   HG23  THR  83          HG23      THR  83   0.690   0.993  -0.458

  No H/Q in entry =           7
  In of MODEL    6
    1    H    SER  84           H        SER  84  -1.552  -0.471   3.865
    2    HA   SER  84           HA       SER  84  -2.074   1.960   5.199
    3    HB2  SER  84           HB2      SER  84  -2.885  -0.883   5.771
    4    HB3  SER  84           HB3      SER  84  -3.393   0.457   6.797
    5    HG   SER  84           HG       SER  84  -3.839   0.130   4.004

  No H/Q in entry =           5
  In of MODEL    6
    1    H    MET  85           H        MET  85  -0.344  -0.954   6.345
    2    HA   MET  85           HA       MET  85   0.159  -0.014   8.948
    3    HB2  MET  85           HB2      MET  85   0.473  -2.358   8.279
    4    HB3  MET  85           HB3      MET  85   1.855  -1.886   7.289
    5    HG2  MET  85           HG2      MET  85   3.018  -1.041   9.287
    6    HG3  MET  85           HG3      MET  85   1.626  -1.461  10.284
    7    HE2  MET  85           HE1      MET  85   3.909  -4.082  11.612
    8    HE1  MET  85           HE2      MET  85   3.370  -2.407  11.688
    9    HE3  MET  85           HE3      MET  85   4.814  -2.820  10.770

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LEU  86           H        LEU  86   2.102   0.247   6.003
    2    HA   LEU  86           HA       LEU  86   4.301   1.580   7.161
    3    HB2  LEU  86           HB2      LEU  86   4.127   0.487   4.856
    4    HB3  LEU  86           HB3      LEU  86   3.309   1.960   4.335
    5    HG   LEU  86           HG       LEU  86   5.323   3.226   5.318
    6   HD11  LEU  86          HD11      LEU  86   6.047   0.624   6.130
    7   HD13  LEU  86          HD12      LEU  86   7.038   2.077   6.225
    8   HD12  LEU  86          HD13      LEU  86   7.161   1.024   4.818
    9   HD23  LEU  86          HD21      LEU  86   6.063   1.461   2.977
   10   HD22  LEU  86          HD22      LEU  86   6.442   3.162   3.234
   11   HD21  LEU  86          HD23      LEU  86   4.794   2.679   2.831

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ALA  87           H        ALA  87   1.385   2.794   5.562
    2    HA   ALA  87           HA       ALA  87   1.957   5.529   5.637
    3    HB1  ALA  87           HB1      ALA  87  -0.337   3.881   5.095
    4    HB3  ALA  87           HB2      ALA  87  -0.038   5.542   4.589
    5    HB2  ALA  87           HB3      ALA  87  -0.835   5.220   6.131

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ARG  88           H        ARG  88   0.275   3.523   8.029
    2    HA   ARG  88           HA       ARG  88  -0.260   5.575   9.866
    3    HB2  ARG  88           HB2      ARG  88  -1.180   3.216   9.938
    4    HB3  ARG  88           HB3      ARG  88   0.362   2.730  10.652
    5    HG2  ARG  88           HG2      ARG  88  -0.136   4.807  12.262
    6    HG3  ARG  88           HG3      ARG  88  -1.799   4.467  11.801
    7    HD2  ARG  88           HD2      ARG  88  -1.896   2.622  13.055
    8    HD3  ARG  88           HD3      ARG  88  -0.300   2.051  12.531
    9    HE   ARG  88           HE       ARG  88  -0.852   3.319  14.979
   10   HH21  ARG  88          HH11      ARG  88   0.693   4.348  16.219
   11   HH22  ARG  88          HH12      ARG  88   2.212   4.784  15.518
   12   HH11  ARG  88          HH21      ARG  88   1.436   3.509  12.409
   13   HH12  ARG  88          HH22      ARG  88   2.641   4.293  13.373

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLU  89           H        GLU  89   2.555   3.378   9.662
    2    HA   GLU  89           HA       GLU  89   3.801   4.286  12.006
    3    HB2  GLU  89           HB2      GLU  89   4.481   2.268  10.673
    4    HB3  GLU  89           HB3      GLU  89   5.252   3.364   9.525
    5    HG2  GLU  89           HG2      GLU  89   6.724   4.230  11.271
    6    HG3  GLU  89           HG3      GLU  89   5.893   3.271  12.491

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LEU  90           H        LEU  90   4.121   5.434   8.675
    2    HA   LEU  90           HA       LEU  90   6.032   7.453   9.260
    3    HB2  LEU  90           HB2      LEU  90   4.037   7.096   7.027
    4    HB3  LEU  90           HB3      LEU  90   5.256   8.377   7.047
    5    HG   LEU  90           HG       LEU  90   5.954   5.447   7.395
    6   HD12  LEU  90          HD11      LEU  90   6.709   5.678   4.957
    7   HD11  LEU  90          HD12      LEU  90   5.681   7.109   4.899
    8   HD13  LEU  90          HD13      LEU  90   4.974   5.532   5.246
    9   HD22  LEU  90          HD21      LEU  90   7.838   6.616   8.079
   10   HD21  LEU  90          HD22      LEU  90   7.480   8.014   7.065
   11   HD23  LEU  90          HD23      LEU  90   8.155   6.552   6.347

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  91           H        ILE  91   2.493   7.437   9.098
    2    HA   ILE  91           HA       ILE  91   2.125  10.208   9.537
    3    HB   ILE  91           HB       ILE  91   0.353   7.818  10.082
    4   HG12  ILE  91          HG12      ILE  91   0.092  10.090   8.087
    5   HG13  ILE  91          HG13      ILE  91   0.966   8.602   7.725
    6   HG22  ILE  91          HG21      ILE  91  -1.398   9.861  10.131
    7   HG21  ILE  91          HG22      ILE  91  -0.007  10.707  10.806
    8   HG23  ILE  91          HG23      ILE  91  -0.633   9.267  11.606
    9   HD13  ILE  91          HD11      ILE  91  -0.966   7.297   7.767
   10   HD12  ILE  91          HD12      ILE  91  -1.567   8.804   7.077
   11   HD11  ILE  91          HD13      ILE  91  -1.841   8.444   8.782

  No H/Q in entry =          11
  In of MODEL    6
    1    H    THR  92           H        THR  92   2.545   7.479  11.750
    2    HA   THR  92           HA       THR  92   2.080   8.858  14.167
    3    HB   THR  92           HB       THR  92   3.913   6.538  13.518
    4    HG1  THR  92           HG1      THR  92   1.951   5.762  13.413
    5   HG22  THR  92          HG21      THR  92   3.522   6.260  16.152
    6   HG21  THR  92          HG22      THR  92   3.441   8.019  16.071
    7   HG23  THR  92          HG23      THR  92   4.884   7.174  15.507

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLU  93           H        GLU  93   5.042   8.430  12.246
    2    HA   GLU  93           HA       GLU  93   6.775   9.880  13.944
    3    HB2  GLU  93           HB2      GLU  93   6.879   9.554  10.931
    4    HB3  GLU  93           HB3      GLU  93   8.210  10.102  11.948
    5    HG2  GLU  93           HG2      GLU  93   6.825   7.453  12.401
    6    HG3  GLU  93           HG3      GLU  93   8.211   7.614  11.330

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LEU  94           H        LEU  94   4.728  10.864  11.219
    2    HA   LEU  94           HA       LEU  94   5.506  13.575  11.111
    3    HB2  LEU  94           HB2      LEU  94   2.932  12.181  10.352
    4    HB3  LEU  94           HB3      LEU  94   3.174  13.910  10.105
    5    HG   LEU  94           HG       LEU  94   5.216  11.938   9.071
    6   HD11  LEU  94          HD11      LEU  94   2.473  12.456   7.996
    7   HD13  LEU  94          HD12      LEU  94   3.471  11.009   7.880
    8   HD12  LEU  94          HD13      LEU  94   3.796  12.389   6.831
    9   HD23  LEU  94          HD21      LEU  94   5.454  13.769   7.341
   10   HD22  LEU  94          HD22      LEU  94   5.857  14.273   8.983
   11   HD21  LEU  94          HD23      LEU  94   4.304  14.722   8.276

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  95           H        ILE  95   2.977  11.940  12.999
    2    HA   ILE  95           HA       ILE  95   1.905  14.284  14.180
    3    HB   ILE  95           HB       ILE  95   1.949  11.406  15.117
    4   HG12  ILE  95          HG12      ILE  95  -0.286  13.152  14.051
    5   HG13  ILE  95          HG13      ILE  95   0.686  12.098  13.027
    6   HG21  ILE  95          HG21      ILE  95   0.636  13.870  16.303
    7   HG23  ILE  95          HG22      ILE  95   1.693  12.716  17.116
    8   HG22  ILE  95          HG23      ILE  95   0.065  12.235  16.637
    9   HD13  ILE  95          HD11      ILE  95  -0.200  10.154  13.951
   10   HD12  ILE  95          HD12      ILE  95  -1.594  11.229  14.017
   11   HD11  ILE  95          HD13      ILE  95  -0.632  10.947  15.467

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLU  96           H        GLU  96   4.520  12.097  15.195
    2    HA   GLU  96           HA       GLU  96   5.052  13.313  17.684
    3    HB2  GLU  96           HB2      GLU  96   6.026  11.161  17.050
    4    HB3  GLU  96           HB3      GLU  96   6.956  11.940  15.770
    5    HG2  GLU  96           HG2      GLU  96   8.592  12.513  17.237
    6    HG3  GLU  96           HG3      GLU  96   7.432  13.317  18.284

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LEU  97           H        LEU  97   6.131  14.082  14.399
    2    HA   LEU  97           HA       LEU  97   7.992  16.103  15.110
    3    HB2  LEU  97           HB2      LEU  97   6.417  15.525  12.611
    4    HB3  LEU  97           HB3      LEU  97   7.419  16.969  12.730
    5    HG   LEU  97           HG       LEU  97   8.478  14.185  13.307
    6   HD12  LEU  97          HD11      LEU  97   9.482  14.381  10.993
    7   HD11  LEU  97          HD12      LEU  97   8.416  15.758  10.719
    8   HD13  LEU  97          HD13      LEU  97   7.733  14.159  11.018
    9   HD23  LEU  97          HD21      LEU  97  10.635  15.486  12.567
   10   HD22  LEU  97          HD22      LEU  97  10.006  15.755  14.192
   11   HD21  LEU  97          HD23      LEU  97   9.684  16.929  12.918

  No H/Q in entry =          11
  In of MODEL    6
    1    H    HIS  98           H        HIS  98   4.501  16.195  14.441
    2    HA   HIS  98           HA       HIS  98   4.169  18.992  14.563
    3    HB2  HIS  98           HB2      HIS  98   2.303  16.722  15.291
    4    HB3  HIS  98           HB3      HIS  98   1.815  18.417  15.337
    5    HD1  HIS  98           HD1      HIS  98   2.879  15.704  12.948
    6    HD2  HIS  98           HD2      HIS  98   1.457  19.621  12.803
    7    HE1  HIS  98           HE1      HIS  98   2.324  16.176  10.520
    8    HE2  HIS  98           HE2      HIS  98   1.462  18.555  10.411

  No H/Q in entry =           8
  In of MODEL    6
    1    H    GLU  99           H        GLU  99   4.321  16.516  17.073
    2    HA   GLU  99           HA       GLU  99   3.684  18.212  19.261
    3    HB2  GLU  99           HB2      GLU  99   3.624  15.730  19.368
    4    HB3  GLU  99           HB3      GLU  99   5.385  15.705  19.268
    5    HG2  GLU  99           HG2      GLU  99   5.550  17.008  21.337
    6    HG3  GLU  99           HG3      GLU  99   3.795  17.129  21.425

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LYS 100           H        LYS 100   6.755  17.311  17.713
    2    HA   LYS 100           HA       LYS 100   8.386  18.739  19.570
    3    HB2  LYS 100           HB2      LYS 100   8.907  17.808  16.737
    4    HB3  LYS 100           HB3      LYS 100  10.123  18.597  17.747
    5    HG2  LYS 100           HG2      LYS 100   9.761  16.849  19.494
    6    HG3  LYS 100           HG3      LYS 100   8.643  16.028  18.402
    7    HD2  LYS 100           HD2      LYS 100  10.447  15.759  16.743
    8    HD3  LYS 100           HD3      LYS 100  11.570  16.592  17.821
    9    HE2  LYS 100           HE2      LYS 100  11.187  14.840  19.545
   10    HE3  LYS 100           HE3      LYS 100  10.127  13.987  18.419
   11    HZ1  LYS 100           HZ1      LYS 100  12.942  14.687  17.772
   12    HZ3  LYS 100           HZ2      LYS 100  11.914  13.616  16.944
   13    HZ2  LYS 100           HZ3      LYS 100  12.501  13.210  18.487

  No H/Q in entry =          13
  In of MODEL    6
    1    H    LEU 101           H        LEU 101   6.693  19.633  16.604
    2    HA   LEU 101           HA       LEU 101   7.879  22.203  16.263
    3    HB2  LEU 101           HB2      LEU 101   5.302  20.935  15.371
    4    HB3  LEU 101           HB3      LEU 101   5.533  22.668  15.157
    5    HG   LEU 101           HG       LEU 101   7.597  20.672  14.208
    6   HD12  LEU 101          HD11      LEU 101   6.447  21.154  11.916
    7   HD11  LEU 101          HD12      LEU 101   5.039  21.572  12.889
    8   HD13  LEU 101          HD13      LEU 101   5.722  19.950  12.981
    9   HD21  LEU 101          HD21      LEU 101   6.937  23.574  13.637
   10   HD23  LEU 101          HD22      LEU 101   7.934  22.621  12.539
   11   HD22  LEU 101          HD23      LEU 101   8.466  22.892  14.198

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LYS 102           H        LYS 102   6.344  21.058  18.877
    2    HA   LYS 102           HA       LYS 102   5.692  22.150  20.802
    3    HB2  LYS 102           HB2      LYS 102   6.956  24.150  19.674
    4    HB3  LYS 102           HB3      LYS 102   5.351  24.735  19.290
    5    HG2  LYS 102           HG2      LYS 102   6.721  24.506  21.948
    6    HG3  LYS 102           HG3      LYS 102   5.755  25.821  21.310
    7    HD2  LYS 102           HD2      LYS 102   4.538  23.174  22.195
    8    HD3  LYS 102           HD3      LYS 102   4.767  24.543  23.273
    9    HE2  LYS 102           HE2      LYS 102   2.498  24.107  21.777
   10    HE3  LYS 102           HE3      LYS 102   2.981  25.662  22.455
   11    HZ2  LYS 102           HZ1      LYS 102   2.459  25.754  20.072
   12    HZ1  LYS 102           HZ2      LYS 102   3.734  24.685  19.759
   13    HZ3  LYS 102           HZ3      LYS 102   4.057  26.222  20.397

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ALA 103           H        ALA 103   4.047  23.663  18.022
    2    HA   ALA 103           HA       ALA 103   1.583  24.215  18.894
    3    HB1  ALA 103           HB1      ALA 103   0.703  23.354  16.652
    4    HB2  ALA 103           HB2      ALA 103   2.358  22.834  16.331
    5    HB3  ALA 103           HB3      ALA 103   2.003  24.544  16.589

  No H/Q in entry =           5
  In of MODEL    6
    1    H1   ALA   1           H3       ALA   1  10.787 -20.287  -6.161
    2    H2   ALA   1           H2       ALA   1   9.830 -20.510  -7.550
    3    H3   ALA   1           H1       ALA   1   9.396 -21.255  -6.086
    4    HA   ALA   1           HA       ALA   1  10.457 -23.055  -6.814
    5    HB1  ALA   1           HB1      ALA   1  10.558 -22.704  -9.091
    6    HB2  ALA   1           HB2      ALA   1  12.282 -22.534  -8.756
    7    HB3  ALA   1           HB3      ALA   1  11.269 -21.098  -8.916

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLU   2           H        GLU   2  12.751 -23.982  -6.859
    2    HA   GLU   2           HA       GLU   2  14.123 -23.877  -4.643
    3    HB2  GLU   2           HB2      GLU   2  15.488 -23.741  -7.337
    4    HB3  GLU   2           HB3      GLU   2  16.217 -24.339  -5.847
    5    HG2  GLU   2           HG2      GLU   2  15.223 -26.367  -6.083
    6    HG3  GLU   2           HG3      GLU   2  13.645 -25.639  -6.351

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLU   3           H        GLU   3  15.884 -22.003  -7.045
    2    HA   GLU   3           HA       GLU   3  17.012 -20.296  -5.088
    3    HB2  GLU   3           HB2      GLU   3  16.967 -20.306  -8.098
    4    HB3  GLU   3           HB3      GLU   3  17.696 -18.966  -7.214
    5    HG2  GLU   3           HG2      GLU   3  19.369 -20.319  -6.279
    6    HG3  GLU   3           HG3      GLU   3  18.439 -21.797  -6.498

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LEU   4           H        LEU   4  14.731 -19.483  -7.731
    2    HA   LEU   4           HA       LEU   4  14.235 -16.876  -7.131
    3    HB2  LEU   4           HB2      LEU   4  12.083 -18.876  -7.862
    4    HB3  LEU   4           HB3      LEU   4  11.991 -17.129  -8.067
    5    HG   LEU   4           HG       LEU   4  13.980 -18.977  -9.426
    6   HD13  LEU   4          HD11      LEU   4  12.683 -18.850 -11.341
    7   HD12  LEU   4          HD12      LEU   4  11.958 -17.310 -10.883
    8   HD11  LEU   4          HD13      LEU   4  11.417 -18.804 -10.117
    9   HD23  LEU   4          HD21      LEU   4  14.298 -16.734 -10.785
   10   HD22  LEU   4          HD22      LEU   4  15.155 -16.962  -9.262
   11   HD21  LEU   4          HD23      LEU   4  13.692 -15.981  -9.310

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLU   5           H        GLU   5  12.773 -19.669  -5.483
    2    HA   GLU   5           HA       GLU   5  11.073 -18.108  -3.793
    3    HB2  GLU   5           HB2      GLU   5  10.671 -20.491  -4.304
    4    HB3  GLU   5           HB3      GLU   5  12.110 -20.912  -3.373
    5    HG2  GLU   5           HG2      GLU   5  11.134 -19.892  -1.366
    6    HG3  GLU   5           HG3      GLU   5   9.707 -19.419  -2.287

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLU   6           H        GLU   6  14.234 -19.653  -3.332
    2    HA   GLU   6           HA       GLU   6  14.568 -18.782  -0.636
    3    HB2  GLU   6           HB2      GLU   6  15.821 -20.687  -1.593
    4    HB3  GLU   6           HB3      GLU   6  16.659 -19.577  -2.681
    5    HG2  GLU   6           HG2      GLU   6  17.607 -18.378  -0.767
    6    HG3  GLU   6           HG3      GLU   6  16.725 -19.421   0.348

  No H/Q in entry =           6
  In of MODEL    6
    1    H    VAL   7           H        VAL   7  15.331 -17.460  -3.789
    2    HA   VAL   7           HA       VAL   7  16.991 -15.312  -2.926
    3    HB   VAL   7           HB       VAL   7  15.298 -15.704  -5.408
    4   HG11  VAL   7          HG11      VAL   7  17.165 -13.467  -4.598
    5   HG13  VAL   7          HG12      VAL   7  15.523 -13.345  -5.228
    6   HG12  VAL   7          HG13      VAL   7  16.842 -13.838  -6.292
    7   HG21  VAL   7          HG21      VAL   7  17.419 -17.135  -4.826
    8   HG23  VAL   7          HG22      VAL   7  18.309 -15.666  -5.227
    9   HG22  VAL   7          HG23      VAL   7  17.286 -16.432  -6.439

  No H/Q in entry =           9
  In of MODEL    6
    1    H    VAL   8           H        VAL   8  13.504 -15.622  -3.495
    2    HA   VAL   8           HA       VAL   8  12.807 -12.920  -3.036
    3    HB   VAL   8           HB       VAL   8  11.223 -15.465  -2.600
    4   HG11  VAL   8          HG11      VAL   8  10.454 -12.547  -2.419
    5   HG13  VAL   8          HG12      VAL   8  10.154 -13.830  -1.247
    6   HG12  VAL   8          HG13      VAL   8   9.263 -13.799  -2.768
    7   HG21  VAL   8          HG21      VAL   8  12.096 -14.360  -4.977
    8   HG23  VAL   8          HG22      VAL   8  10.534 -13.573  -4.778
    9   HG22  VAL   8          HG23      VAL   8  10.632 -15.329  -4.822

  No H/Q in entry =           9
  In of MODEL    6
    1    H    MET   9           H        MET   9  13.097 -15.714  -0.844
    2    HA   MET   9           HA       MET   9  12.258 -14.442   1.518
    3    HB2  MET   9           HB2      MET   9  14.144 -16.721   0.959
    4    HB3  MET   9           HB3      MET   9  13.938 -16.110   2.602
    5    HG2  MET   9           HG2      MET   9  11.405 -16.361   2.186
    6    HG3  MET   9           HG3      MET   9  11.861 -17.343   0.793
    7    HE1  MET   9           HE1      MET   9  12.856 -19.402   0.707
    8    HE3  MET   9           HE2      MET   9  13.351 -20.472   2.015
    9    HE2  MET   9           HE3      MET   9  14.362 -19.096   1.580

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLY  10           H        GLY  10  15.448 -14.636  -0.026
    2    HA3  GLY  10           HA2      GLY  10  16.883 -13.190   1.943
    3    HA2  GLY  10           HA3      GLY  10  17.354 -13.357   0.252

  No H/Q in entry =           3
  In of MODEL    6
    1    H    LEU  11           H        LEU  11  15.176 -12.166  -1.000
    2    HA   LEU  11           HA       LEU  11  15.828  -9.413  -0.845
    3    HB2  LEU  11           HB2      LEU  11  13.482 -10.856  -2.083
    4    HB3  LEU  11           HB3      LEU  11  13.742  -9.118  -2.249
    5    HG   LEU  11           HG       LEU  11  15.798 -11.206  -3.021
    6   HD13  LEU  11          HD11      LEU  11  14.062 -11.600  -4.546
    7   HD12  LEU  11          HD12      LEU  11  15.054 -10.410  -5.387
    8   HD11  LEU  11          HD13      LEU  11  13.571  -9.906  -4.576
    9   HD22  LEU  11          HD21      LEU  11  17.005  -9.227  -2.798
   10   HD21  LEU  11          HD22      LEU  11  15.619  -8.208  -3.186
   11   HD23  LEU  11          HD23      LEU  11  16.465  -9.072  -4.469

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  12           H        ILE  12  13.077 -11.267   0.419
    2    HA   ILE  12           HA       ILE  12  11.652  -9.056   1.465
    3    HB   ILE  12           HB       ILE  12  11.721 -11.935   2.426
    4   HG12  ILE  12          HG12      ILE  12  11.036 -11.324  -0.027
    5   HG13  ILE  12          HG13      ILE  12  10.016 -12.417   0.887
    6   HG22  ILE  12          HG21      ILE  12   9.384 -11.329   3.273
    7   HG21  ILE  12          HG22      ILE  12   9.827  -9.642   3.017
    8   HG23  ILE  12          HG23      ILE  12  10.732 -10.627   4.166
    9   HD12  ILE  12          HD11      ILE  12   8.765 -10.643  -0.363
   10   HD11  ILE  12          HD12      ILE  12   9.566  -9.433   0.636
   11   HD13  ILE  12          HD13      ILE  12   8.483 -10.596   1.368

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  13           H        ILE  13  14.068 -11.225   2.888
    2    HA   ILE  13           HA       ILE  13  14.078 -10.035   5.464
    3    HB   ILE  13           HB       ILE  13  16.162 -11.589   3.911
    4   HG12  ILE  13          HG12      ILE  13  13.894 -12.576   4.758
    5   HG13  ILE  13          HG13      ILE  13  15.379 -13.483   5.024
    6   HG21  ILE  13          HG21      ILE  13  16.261 -10.499   6.728
    7   HG23  ILE  13          HG22      ILE  13  17.480 -10.360   5.469
    8   HG22  ILE  13          HG23      ILE  13  17.202 -11.912   6.259
    9   HD11  ILE  13          HD11      ILE  13  14.185 -11.602   7.093
   10   HD13  ILE  13          HD12      ILE  13  15.508 -12.742   7.315
   11   HD12  ILE  13          HD13      ILE  13  13.874 -13.335   7.048

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ASN  14           H        ASN  14  16.036  -9.490   2.551
    2    HA   ASN  14           HA       ASN  14  17.749  -7.521   3.611
    3    HB2  ASN  14           HB2      ASN  14  17.753  -8.796   1.301
    4    HB3  ASN  14           HB3      ASN  14  16.843  -7.394   0.755
    5   HD21  ASN  14          HD21      ASN  14  19.292  -7.704  -0.420
    6   HD22  ASN  14          HD22      ASN  14  20.418  -6.603   0.207

  No H/Q in entry =           6
  In of MODEL    6
    1    H    SER  15           H        SER  15  14.641  -7.224   1.905
    2    HA   SER  15           HA       SER  15  14.488  -4.405   1.950
    3    HB2  SER  15           HB2      SER  15  12.165  -4.686   1.441
    4    HB3  SER  15           HB3      SER  15  12.981  -6.049   0.686
    5    HG   SER  15           HG       SER  15  12.017  -7.359   2.020

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLY  16           H        GLY  16  13.421  -6.871   4.259
    2    HA3  GLY  16           HA2      GLY  16  12.167  -5.132   6.105
    3    HA2  GLY  16           HA3      GLY  16  12.804  -6.730   6.476

  No H/Q in entry =           3
  In of MODEL    6
    1    H    GLN  17           H        GLN  17  15.512  -6.360   5.893
    2    HA   GLN  17           HA       GLN  17  16.441  -5.116   8.272
    3    HB2  GLN  17           HB2      GLN  17  17.691  -6.899   7.068
    4    HB3  GLN  17           HB3      GLN  17  18.013  -5.762   5.759
    5    HG2  GLN  17           HG2      GLN  17  19.938  -5.811   7.244
    6    HG3  GLN  17           HG3      GLN  17  19.133  -4.252   7.406
    7   HE21  GLN  17          HE21      GLN  17  19.611  -3.795   9.609
    8   HE22  GLN  17          HE22      GLN  17  19.117  -4.789  10.893

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ALA  18           H        ALA  18  16.250  -4.054   4.907
    2    HA   ALA  18           HA       ALA  18  17.650  -1.640   5.130
    3    HB2  ALA  18           HB1      ALA  18  16.558  -2.879   3.063
    4    HB3  ALA  18           HB2      ALA  18  16.797  -1.132   3.041
    5    HB1  ALA  18           HB3      ALA  18  15.206  -1.800   3.407

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ARG  19           H        ARG  19  14.157  -2.278   5.515
    2    HA   ARG  19           HA       ARG  19  13.447   0.364   6.216
    3    HB2  ARG  19           HB2      ARG  19  11.795  -1.415   5.630
    4    HB3  ARG  19           HB3      ARG  19  12.142  -2.201   7.172
    5    HG2  ARG  19           HG2      ARG  19  11.396  -0.216   8.400
    6    HG3  ARG  19           HG3      ARG  19  11.139   0.651   6.887
    7    HD2  ARG  19           HD2      ARG  19   9.007  -0.175   7.701
    8    HD3  ARG  19           HD3      ARG  19   9.445  -1.054   6.230
    9    HE   ARG  19           HE       ARG  19  10.418  -2.573   8.346
   10   HH21  ARG  19          HH11      ARG  19   9.190  -4.228   9.286
   11   HH22  ARG  19          HH12      ARG  19   7.470  -4.227   9.108
   12   HH11  ARG  19          HH21      ARG  19   7.409  -1.330   7.233
   13   HH12  ARG  19          HH22      ARG  19   6.463  -2.587   7.941

  No H/Q in entry =          13
  In of MODEL    6
    1    H    SER  20           H        SER  20  14.339  -2.445   8.191
    2    HA   SER  20           HA       SER  20  14.028  -1.339  10.722
    3    HB2  SER  20           HB2      SER  20  14.704  -3.746  10.056
    4    HB3  SER  20           HB3      SER  20  16.354  -3.131  10.046
    5    HG   SER  20           HG       SER  20  15.093  -2.276  12.243

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU  21           H        LEU  21  16.879  -1.244   8.598
    2    HA   LEU  21           HA       LEU  21  18.524   0.274  10.337
    3    HB2  LEU  21           HB2      LEU  21  18.518  -0.014   7.325
    4    HB3  LEU  21           HB3      LEU  21  19.755   0.874   8.213
    5    HG   LEU  21           HG       LEU  21  19.065  -2.024   8.775
    6   HD13  LEU  21          HD11      LEU  21  19.908  -1.819   6.482
    7   HD12  LEU  21          HD12      LEU  21  21.139  -2.553   7.509
    8   HD11  LEU  21          HD13      LEU  21  21.273  -0.856   7.052
    9   HD23  LEU  21          HD21      LEU  21  21.547  -1.815   9.662
   10   HD22  LEU  21          HD22      LEU  21  20.231  -1.232  10.675
   11   HD21  LEU  21          HD23      LEU  21  21.185  -0.094   9.738

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ALA  22           H        ALA  22  16.257   1.199   7.768
    2    HA   ALA  22           HA       ALA  22  16.754   3.965   7.773
    3    HB3  ALA  22           HB1      ALA  22  15.377   2.695   6.093
    4    HB2  ALA  22           HB2      ALA  22  14.645   4.199   6.651
    5    HB1  ALA  22           HB3      ALA  22  14.075   2.654   7.282

  No H/Q in entry =           5
  In of MODEL    6
    1    H    TYR  23           H        TYR  23  14.276   2.119   9.604
    2    HA   TYR  23           HA       TYR  23  13.274   4.348  11.040
    3    HB2  TYR  23           HB2      TYR  23  12.071   2.216  11.022
    4    HB3  TYR  23           HB3      TYR  23  13.410   1.428  11.856
    5    HD1  TYR  23           HD1      TYR  23  10.857   4.127  12.199
    6    HD2  TYR  23           HD2      TYR  23  13.603   1.510  14.214
    7    HE1  TYR  23           HE1      TYR  23   9.909   4.815  14.386
    8    HE2  TYR  23           HE2      TYR  23  12.656   2.197  16.400
    9    HH   TYR  23           HH       TYR  23  10.057   4.634  16.590

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ALA  24           H        ALA  24  15.950   2.114  11.698
    2    HA   ALA  24           HA       ALA  24  16.594   3.129  14.260
    3    HB1  ALA  24           HB1      ALA  24  17.977   1.355  14.109
    4    HB3  ALA  24           HB2      ALA  24  18.996   2.287  13.010
    5    HB2  ALA  24           HB3      ALA  24  17.719   1.258  12.368

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA  25           H        ALA  25  17.552   4.059  10.982
    2    HA   ALA  25           HA       ALA  25  19.466   6.024  11.628
    3    HB1  ALA  25           HB1      ALA  25  18.774   5.056   9.314
    4    HB3  ALA  25           HB2      ALA  25  19.250   6.751   9.402
    5    HB2  ALA  25           HB3      ALA  25  17.542   6.319   9.327

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU  26           H        LEU  26  15.950   6.201  11.251
    2    HA   LEU  26           HA       LEU  26  15.685   8.981  11.690
    3    HB2  LEU  26           HB2      LEU  26  13.845   7.715  10.759
    4    HB3  LEU  26           HB3      LEU  26  13.762   6.692  12.188
    5    HG   LEU  26           HG       LEU  26  13.122   8.646  13.557
    6   HD12  LEU  26          HD11      LEU  26  12.438  10.732  12.221
    7   HD11  LEU  26          HD12      LEU  26  13.433  10.088  10.918
    8   HD13  LEU  26          HD13      LEU  26  14.166  10.490  12.472
    9   HD21  LEU  26          HD21      LEU  26  11.463   8.300  11.042
   10   HD23  LEU  26          HD22      LEU  26  10.886   8.996  12.553
   11   HD22  LEU  26          HD23      LEU  26  11.362   7.301  12.492

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LYS  27           H        LYS  27  15.605   6.209  13.893
    2    HA   LYS  27           HA       LYS  27  14.983   7.576  16.253
    3    HB2  LYS  27           HB2      LYS  27  15.047   5.100  15.998
    4    HB3  LYS  27           HB3      LYS  27  16.809   5.176  15.963
    5    HG2  LYS  27           HG2      LYS  27  16.836   6.171  18.208
    6    HG3  LYS  27           HG3      LYS  27  15.069   6.166  18.246
    7    HD2  LYS  27           HD2      LYS  27  15.078   3.698  18.019
    8    HD3  LYS  27           HD3      LYS  27  16.843   3.711  18.015
    9    HE2  LYS  27           HE2      LYS  27  16.853   4.709  20.268
   10    HE3  LYS  27           HE3      LYS  27  15.087   4.726  20.275
   11    HZ3  LYS  27           HZ1      LYS  27  15.896   2.789  21.437
   12    HZ2  LYS  27           HZ2      LYS  27  16.825   2.317  20.092
   13    HZ1  LYS  27           HZ3      LYS  27  15.127   2.299  20.005

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLN  28           H        GLN  28  18.114   7.029  14.677
    2    HA   GLN  28           HA       GLN  28  19.775   8.142  16.671
    3    HB2  GLN  28           HB2      GLN  28  20.079   8.096  13.657
    4    HB3  GLN  28           HB3      GLN  28  21.354   8.576  14.776
    5    HG2  GLN  28           HG2      GLN  28  19.957   5.887  14.811
    6    HG3  GLN  28           HG3      GLN  28  21.538   6.187  14.092
    7   HE21  GLN  28          HE21      GLN  28  20.288   4.847  16.784
    8   HE22  GLN  28          HE22      GLN  28  21.466   5.285  17.925

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ALA  29           H        ALA  29  18.016   9.592  13.965
    2    HA   ALA  29           HA       ALA  29  18.981  12.226  14.212
    3    HB2  ALA  29           HB1      ALA  29  17.281  12.835  12.731
    4    HB1  ALA  29           HB2      ALA  29  16.149  11.650  13.382
    5    HB3  ALA  29           HB3      ALA  29  17.490  11.121  12.367

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LYS  30           H        LYS  30  16.218  10.598  15.728
    2    HA   LYS  30           HA       LYS  30  15.170  12.844  17.072
    3    HB2  LYS  30           HB2      LYS  30  15.091   9.904  17.786
    4    HB3  LYS  30           HB3      LYS  30  14.206  11.147  18.671
    5    HG2  LYS  30           HG2      LYS  30  13.082  11.811  16.545
    6    HG3  LYS  30           HG3      LYS  30  13.907  10.482  15.727
    7    HD2  LYS  30           HD2      LYS  30  12.847   8.867  17.257
    8    HD3  LYS  30           HD3      LYS  30  12.033  10.186  18.100
    9    HE2  LYS  30           HE2      LYS  30  10.867  10.797  16.000
   10    HE3  LYS  30           HE3      LYS  30  11.661   9.449  15.177
   11    HZ2  LYS  30           HZ1      LYS  30   9.354   9.015  16.049
   12    HZ1  LYS  30           HZ2      LYS  30  10.014   9.082  17.619
   13    HZ3  LYS  30           HZ3      LYS  30  10.541   7.899  16.515

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLN  31           H        GLN  31  17.853  10.709  17.828
    2    HA   GLN  31           HA       GLN  31  18.157  11.737  20.520
    3    HB2  GLN  31           HB2      GLN  31  20.205  10.184  18.930
    4    HB3  GLN  31           HB3      GLN  31  20.062  10.314  20.683
    5    HG2  GLN  31           HG2      GLN  31  17.563   9.329  19.907
    6    HG3  GLN  31           HG3      GLN  31  18.679   8.494  18.835
    7   HE21  GLN  31          HE21      GLN  31  17.140   7.338  21.109
    8   HE22  GLN  31          HE22      GLN  31  18.299   6.695  22.167

  No H/Q in entry =           8
  In of MODEL    6
    1    H    GLY  32           H        GLY  32  18.673  13.050  17.551
    2    HA3  GLY  32           HA2      GLY  32  19.635  15.104  17.033
    3    HA2  GLY  32           HA3      GLY  32  20.386  15.124  18.624

  No H/Q in entry =           3
  In of MODEL    6
    1    H    ASP  33           H        ASP  33  20.850  12.230  16.860
    2    HA   ASP  33           HA       ASP  33  23.669  12.937  16.403
    3    HB2  ASP  33           HB2      ASP  33  22.191  10.304  16.523
    4    HB3  ASP  33           HB3      ASP  33  23.878  10.439  16.035

  No H/Q in entry =           4
  In of MODEL    6
    1    H    PHE  34           H        PHE  34  23.180  14.248  14.515
    2    HA   PHE  34           HA       PHE  34  21.853  13.239  12.226
    3    HB2  PHE  34           HB2      PHE  34  23.957  15.399  12.457
    4    HB3  PHE  34           HB3      PHE  34  22.981  15.092  11.022
    5    HD1  PHE  34           HD1      PHE  34  23.196  17.040  13.929
    6    HD2  PHE  34           HD2      PHE  34  20.355  14.880  11.539
    7    HE1  PHE  34           HE1      PHE  34  21.359  18.419  14.863
    8    HE2  PHE  34           HE2      PHE  34  18.522  16.260  12.476
    9    HZ   PHE  34           HZ       PHE  34  19.027  18.029  14.134

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ALA  35           H        ALA  35  25.225  13.096  13.249
    2    HA   ALA  35           HA       ALA  35  26.351  12.279  10.800
    3    HB3  ALA  35           HB1      ALA  35  28.038  11.137  12.531
    4    HB2  ALA  35           HB2      ALA  35  27.157  12.156  13.669
    5    HB1  ALA  35           HB3      ALA  35  27.990  12.884  12.297

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA  36           H        ALA  36  25.247  10.320  13.568
    2    HA   ALA  36           HA       ALA  36  25.768   7.834  12.304
    3    HB2  ALA  36           HB1      ALA  36  25.337   7.090  14.380
    4    HB3  ALA  36           HB2      ALA  36  23.644   7.563  14.221
    5    HB1  ALA  36           HB3      ALA  36  24.828   8.712  14.844

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA  37           H        ALA  37  22.919   9.925  12.417
    2    HA   ALA  37           HA       ALA  37  21.091   8.127  11.240
    3    HB3  ALA  37           HB1      ALA  37  21.277  11.094  11.522
    4    HB1  ALA  37           HB2      ALA  37  19.977  10.000  11.993
    5    HB2  ALA  37           HB3      ALA  37  20.167  10.468  10.303

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LYS  38           H        LYS  38  23.164  10.610   9.761
    2    HA   LYS  38           HA       LYS  38  22.542  10.164   7.083
    3    HB2  LYS  38           HB2      LYS  38  24.325  11.750   8.529
    4    HB3  LYS  38           HB3      LYS  38  25.375  10.770   7.512
    5    HG2  LYS  38           HG2      LYS  38  24.209  11.518   5.508
    6    HG3  LYS  38           HG3      LYS  38  22.999  12.360   6.481
    7    HD2  LYS  38           HD2      LYS  38  24.570  13.982   7.234
    8    HD3  LYS  38           HD3      LYS  38  25.945  13.013   6.708
    9    HE2  LYS  38           HE2      LYS  38  25.570  14.873   5.148
   10    HE3  LYS  38           HE3      LYS  38  25.259  13.328   4.348
   11    HZ3  LYS  38           HZ1      LYS  38  23.057  13.743   4.207
   12    HZ2  LYS  38           HZ2      LYS  38  23.558  15.365   4.290
   13    HZ1  LYS  38           HZ3      LYS  38  22.988  14.579   5.683

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ALA  39           H        ALA  39  25.069   8.607   9.055
    2    HA   ALA  39           HA       ALA  39  26.168   7.025   6.996
    3    HB2  ALA  39           HB1      ALA  39  26.080   6.071   9.843
    4    HB1  ALA  39           HB2      ALA  39  27.015   7.508   9.426
    5    HB3  ALA  39           HB3      ALA  39  27.391   5.960   8.670

  No H/Q in entry =           5
  In of MODEL    6
    1    H    MET  40           H        MET  40  23.554   6.383   9.286
    2    HA   MET  40           HA       MET  40  23.151   3.669   8.560
    3    HB2  MET  40           HB2      MET  40  21.301   5.692   9.837
    4    HB3  MET  40           HB3      MET  40  20.919   3.977   9.667
    5    HG2  MET  40           HG2      MET  40  23.450   4.958  11.015
    6    HG3  MET  40           HG3      MET  40  21.955   4.665  11.903
    7    HE3  MET  40           HE1      MET  40  21.441   1.025  12.090
    8    HE2  MET  40           HE2      MET  40  20.558   2.312  11.274
    9    HE1  MET  40           HE3      MET  40  21.288   2.616  12.849

  No H/Q in entry =           9
  In of MODEL    6
    1    H    MET  41           H        MET  41  21.700   6.698   7.355
    2    HA   MET  41           HA       MET  41  19.767   5.469   5.680
    3    HB2  MET  41           HB2      MET  41  21.214   8.078   5.163
    4    HB3  MET  41           HB3      MET  41  19.696   7.560   4.440
    5    HG2  MET  41           HG2      MET  41  18.942   7.371   6.989
    6    HG3  MET  41           HG3      MET  41  20.234   8.548   7.212
    7    HE2  MET  41           HE1      MET  41  19.667   9.815   3.868
    8    HE1  MET  41           HE2      MET  41  20.611  10.273   5.282
    9    HE3  MET  41           HE3      MET  41  19.326  11.332   4.708

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ASP  42           H        ASP  42  23.129   6.438   5.137
    2    HA   ASP  42           HA       ASP  42  23.239   5.955   2.382
    3    HB2  ASP  42           HB2      ASP  42  24.968   6.983   4.154
    4    HB3  ASP  42           HB3      ASP  42  25.649   5.367   4.036

  No H/Q in entry =           4
  In of MODEL    6
    1    H    GLN  43           H        GLN  43  23.982   3.821   5.113
    2    HA   GLN  43           HA       GLN  43  24.685   1.567   3.542
    3    HB2  GLN  43           HB2      GLN  43  23.648   1.746   6.381
    4    HB3  GLN  43           HB3      GLN  43  24.251   0.263   5.634
    5    HG2  GLN  43           HG2      GLN  43  26.399   1.502   5.127
    6    HG3  GLN  43           HG3      GLN  43  25.793   2.825   6.119
    7   HE21  GLN  43          HE21      GLN  43  28.036   1.887   7.169
    8   HE22  GLN  43          HE22      GLN  43  27.771   0.806   8.448

  No H/Q in entry =           8
  In of MODEL    6
    1    H    SER  44           H        SER  44  21.607   2.662   4.910
    2    HA   SER  44           HA       SER  44  20.074   0.394   4.239
    3    HB2  SER  44           HB2      SER  44  19.591   2.921   5.374
    4    HB3  SER  44           HB3      SER  44  18.564   2.858   3.944
    5    HG   SER  44           HG       SER  44  17.476   1.905   5.666

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ARG  45           H        ARG  45  20.782   3.362   2.426
    2    HA   ARG  45           HA       ARG  45  19.274   2.846   0.117
    3    HB2  ARG  45           HB2      ARG  45  20.384   5.001   0.698
    4    HB3  ARG  45           HB3      ARG  45  21.941   4.266   0.322
    5    HG2  ARG  45           HG2      ARG  45  21.173   3.841  -1.994
    6    HG3  ARG  45           HG3      ARG  45  19.628   4.599  -1.617
    7    HD2  ARG  45           HD2      ARG  45  20.847   6.715  -1.035
    8    HD3  ARG  45           HD3      ARG  45  22.356   5.960  -1.595
    9    HE   ARG  45           HE       ARG  45  20.438   5.688  -3.638
   10   HH21  ARG  45          HH11      ARG  45  20.419   7.050  -5.406
   11   HH22  ARG  45          HH12      ARG  45  21.153   8.611  -5.305
   12   HH11  ARG  45          HH21      ARG  45  22.126   8.216  -2.014
   13   HH12  ARG  45          HH22      ARG  45  22.119   9.271  -3.381

  No H/Q in entry =          13
  In of MODEL    6
    1    H    MET  46           H        MET  46  22.646   2.021   0.881
    2    HA   MET  46           HA       MET  46  23.278   0.827  -1.596
    3    HB2  MET  46           HB2      MET  46  24.378   0.510   1.199
    4    HB3  MET  46           HB3      MET  46  25.058  -0.355  -0.183
    5    HG2  MET  46           HG2      MET  46  25.450   1.780  -1.345
    6    HG3  MET  46           HG3      MET  46  24.741   2.658   0.005
    7    HE2  MET  46           HE1      MET  46  26.925   4.161   0.907
    8    HE1  MET  46           HE2      MET  46  27.026   3.753  -0.802
    9    HE3  MET  46           HE3      MET  46  28.452   3.592   0.221

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ALA  47           H        ALA  47  21.902  -0.513   1.380
    2    HA   ALA  47           HA       ALA  47  21.888  -3.229   0.588
    3    HB2  ALA  47           HB1      ALA  47  21.494  -2.765   2.889
    4    HB3  ALA  47           HB2      ALA  47  19.968  -3.391   2.267
    5    HB1  ALA  47           HB3      ALA  47  20.174  -1.656   2.519

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU  48           H        LEU  48  19.502  -0.635   0.212
    2    HA   LEU  48           HA       LEU  48  17.482  -2.200  -1.039
    3    HB2  LEU  48           HB2      LEU  48  18.098   0.762  -1.164
    4    HB3  LEU  48           HB3      LEU  48  16.639   0.030  -1.833
    5    HG   LEU  48           HG       LEU  48  17.486  -0.249   1.060
    6   HD13  LEU  48          HD11      LEU  48  17.039   2.045   0.862
    7   HD12  LEU  48          HD12      LEU  48  15.487   1.379   1.369
    8   HD11  LEU  48          HD13      LEU  48  15.759   1.798  -0.323
    9   HD22  LEU  48          HD21      LEU  48  15.981  -1.985   0.681
   10   HD21  LEU  48          HD22      LEU  48  15.100  -1.098  -0.564
   11   HD23  LEU  48          HD23      LEU  48  14.876  -0.690   1.137

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ASN  49           H        ASN  49  20.149  -0.243  -2.269
    2    HA   ASN  49           HA       ASN  49  19.508  -0.346  -4.995
    3    HB2  ASN  49           HB2      ASN  49  21.165   1.194  -4.068
    4    HB3  ASN  49           HB3      ASN  49  22.212  -0.152  -3.636
    5   HD21  ASN  49          HD21      ASN  49  23.241   1.822  -5.298
    6   HD22  ASN  49          HD22      ASN  49  23.409   1.223  -6.876

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLU  50           H        GLU  50  21.513  -2.507  -3.017
    2    HA   GLU  50           HA       GLU  50  22.244  -4.262  -5.133
    3    HB2  GLU  50           HB2      GLU  50  23.434  -4.213  -2.963
    4    HB3  GLU  50           HB3      GLU  50  21.997  -4.856  -2.169
    5    HG2  GLU  50           HG2      GLU  50  22.117  -6.893  -3.519
    6    HG3  GLU  50           HG3      GLU  50  23.487  -6.247  -4.419

  No H/Q in entry =           6
  In of MODEL    6
    1    H    ALA  51           H        ALA  51  19.580  -4.221  -2.815
    2    HA   ALA  51           HA       ALA  51  18.447  -6.711  -3.565
    3    HB3  ALA  51           HB1      ALA  51  16.844  -6.219  -2.017
    4    HB1  ALA  51           HB2      ALA  51  16.612  -4.578  -2.623
    5    HB2  ALA  51           HB3      ALA  51  17.972  -4.942  -1.562

  No H/Q in entry =           5
  In of MODEL    6
    1    H    HIS  52           H        HIS  52  17.822  -3.376  -4.617
    2    HA   HIS  52           HA       HIS  52  15.721  -3.936  -6.420
    3    HB2  HIS  52           HB2      HIS  52  16.304  -1.660  -5.646
    4    HB3  HIS  52           HB3      HIS  52  17.800  -1.740  -6.574
    5    HD1  HIS  52           HD1      HIS  52  17.486  -2.047  -9.241
    6    HD2  HIS  52           HD2      HIS  52  14.077  -0.899  -7.134
    7    HE1  HIS  52           HE1      HIS  52  15.847  -1.163 -10.958
    8    HE2  HIS  52           HE2      HIS  52  13.764  -0.458  -9.688

  No H/Q in entry =           8
  In of MODEL    6
    1    H    LEU  53           H        LEU  53  19.240  -3.900  -6.843
    2    HA   LEU  53           HA       LEU  53  19.310  -4.227  -9.641
    3    HB2  LEU  53           HB2      LEU  53  21.246  -4.957  -7.459
    4    HB3  LEU  53           HB3      LEU  53  21.572  -5.342  -9.147
    5    HG   LEU  53           HG       LEU  53  20.870  -2.541  -8.212
    6   HD13  LEU  53          HD11      LEU  53  23.292  -2.069  -8.335
    7   HD12  LEU  53          HD12      LEU  53  23.603  -3.771  -8.675
    8   HD11  LEU  53          HD13      LEU  53  22.948  -3.291  -7.114
    9   HD22  LEU  53          HD21      LEU  53  20.593  -2.576 -10.548
   10   HD21  LEU  53          HD22      LEU  53  21.861  -3.777 -10.774
   11   HD23  LEU  53          HD23      LEU  53  22.285  -2.113 -10.414

  No H/Q in entry =          11
  In of MODEL    6
    1    H    VAL  54           H        VAL  54  19.220  -6.603  -7.005
    2    HA   VAL  54           HA       VAL  54  19.378  -8.903  -8.654
    3    HB   VAL  54           HB       VAL  54  18.210  -8.482  -5.892
    4   HG12  VAL  54          HG11      VAL  54  18.569 -11.095  -5.874
    5   HG11  VAL  54          HG12      VAL  54  18.386 -10.937  -7.621
    6   HG13  VAL  54          HG13      VAL  54  17.088 -10.419  -6.549
    7   HG22  VAL  54          HG21      VAL  54  20.522  -8.240  -5.663
    8   HG21  VAL  54          HG22      VAL  54  20.878  -9.334  -6.998
    9   HG23  VAL  54          HG23      VAL  54  20.352  -9.980  -5.444

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLN  55           H        GLN  55  16.621  -7.031  -7.388
    2    HA   GLN  55           HA       GLN  55  14.626  -8.726  -8.459
    3    HB2  GLN  55           HB2      GLN  55  13.852  -7.203  -6.842
    4    HB3  GLN  55           HB3      GLN  55  14.629  -5.828  -7.622
    5    HG2  GLN  55           HG2      GLN  55  12.905  -5.534  -9.118
    6    HG3  GLN  55           HG3      GLN  55  12.607  -7.259  -9.281
    7   HE21  GLN  55          HE21      GLN  55  10.605  -7.831  -8.479
    8   HE22  GLN  55          HE22      GLN  55   9.818  -7.081  -7.176

  No H/Q in entry =           8
  In of MODEL    6
    1    H    THR  56           H        THR  56  16.331  -5.910  -9.827
    2    HA   THR  56           HA       THR  56  14.895  -5.578 -12.181
    3    HB   THR  56           HB       THR  56  17.912  -5.448 -12.009
    4    HG1  THR  56           HG1      THR  56  16.410  -3.179 -11.610
    5   HG23  THR  56          HG21      THR  56  17.801  -4.040 -13.859
    6   HG22  THR  56          HG22      THR  56  16.127  -3.589 -13.540
    7   HG21  THR  56          HG23      THR  56  16.499  -5.177 -14.212

  No H/Q in entry =           7
  In of MODEL    6
    1    H    LYS  57           H        LYS  57  17.574  -7.836 -11.551
    2    HA   LYS  57           HA       LYS  57  17.599  -9.043 -14.124
    3    HB2  LYS  57           HB2      LYS  57  19.389  -9.265 -12.378
    4    HB3  LYS  57           HB3      LYS  57  18.296 -10.263 -11.432
    5    HG2  LYS  57           HG2      LYS  57  18.183 -11.885 -13.306
    6    HG3  LYS  57           HG3      LYS  57  19.333 -10.907 -14.208
    7    HD2  LYS  57           HD2      LYS  57  19.956 -11.993 -11.454
    8    HD3  LYS  57           HD3      LYS  57  20.314 -12.896 -12.926
    9    HE2  LYS  57           HE2      LYS  57  21.609 -10.871 -13.742
   10    HE3  LYS  57           HE3      LYS  57  21.418 -10.175 -12.134
   11    HZ1  LYS  57           HZ1      LYS  57  22.323 -12.851 -11.961
   12    HZ3  LYS  57           HZ2      LYS  57  23.046 -11.432 -11.373
   13    HZ2  LYS  57           HZ3      LYS  57  23.355 -11.949 -12.960

  No H/Q in entry =          13
  In of MODEL    6
    1    H    LEU  58           H        LEU  58  15.819  -9.720 -11.150
    2    HA   LEU  58           HA       LEU  58  14.633 -12.116 -12.076
    3    HB2  LEU  58           HB2      LEU  58  13.806 -10.211  -9.892
    4    HB3  LEU  58           HB3      LEU  58  13.022 -11.761 -10.203
    5    HG   LEU  58           HG       LEU  58  15.989 -11.439  -9.642
    6   HD11  LEU  58          HD11      LEU  58  13.619 -11.880  -7.853
    7   HD13  LEU  58          HD12      LEU  58  15.058 -10.896  -7.592
    8   HD12  LEU  58          HD13      LEU  58  15.155 -12.650  -7.448
    9   HD22  LEU  58          HD21      LEU  58  15.903 -13.507 -10.660
   10   HD21  LEU  58          HD22      LEU  58  14.191 -13.739 -10.303
   11   HD23  LEU  58          HD23      LEU  58  15.400 -14.016  -9.048

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  59           H        ILE  59  13.917  -8.792 -12.777
    2    HA   ILE  59           HA       ILE  59  11.213  -9.483 -13.721
    3    HB   ILE  59           HB       ILE  59  11.984  -7.183 -12.526
    4   HG12  ILE  59          HG12      ILE  59  10.082  -7.087 -14.876
    5   HG13  ILE  59          HG13      ILE  59   9.671  -7.876 -13.376
    6   HG22  ILE  59          HG21      ILE  59  12.057  -6.381 -15.421
    7   HG21  ILE  59          HG22      ILE  59  13.538  -6.782 -14.581
    8   HG23  ILE  59          HG23      ILE  59  12.534  -5.447 -14.023
    9   HD13  ILE  59          HD11      ILE  59   8.830  -5.613 -13.272
   10   HD12  ILE  59          HD12      ILE  59  10.406  -4.973 -13.733
   11   HD11  ILE  59          HD13      ILE  59  10.194  -5.743 -12.160

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLU  60           H        GLU  60  14.408  -8.592 -14.975
    2    HA   GLU  60           HA       GLU  60  13.630  -8.217 -17.688
    3    HB2  GLU  60           HB2      GLU  60  15.800  -7.457 -16.806
    4    HB3  GLU  60           HB3      GLU  60  16.285  -9.131 -16.546
    5    HG2  GLU  60           HG2      GLU  60  16.090  -9.571 -18.968
    6    HG3  GLU  60           HG3      GLU  60  15.596  -7.900 -19.232

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLY  61           H        GLY  61  14.643 -11.075 -15.856
    2    HA3  GLY  61           HA2      GLY  61  14.132 -12.742 -18.250
    3    HA2  GLY  61           HA3      GLY  61  15.167 -13.202 -16.903

  No H/Q in entry =           3
  In of MODEL    6
    1    H    ASP  62           H        ASP  62  12.023 -11.699 -16.549
    2    HA   ASP  62           HA       ASP  62  11.107 -13.595 -14.684
    3    HB2  ASP  62           HB2      ASP  62   8.932 -12.455 -14.950
    4    HB3  ASP  62           HB3      ASP  62  10.260 -11.319 -14.734

  No H/Q in entry =           4
  In of MODEL    6
    1    H    ALA  63           H        ALA  63  10.584 -13.378 -18.208
    2    HA   ALA  63           HA       ALA  63   8.522 -15.304 -18.439
    3    HB2  ALA  63           HB1      ALA  63  10.747 -14.569 -20.360
    4    HB3  ALA  63           HB2      ALA  63   9.125 -13.881 -20.313
    5    HB1  ALA  63           HB3      ALA  63   9.353 -15.565 -20.784

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLY  64           H        GLY  64  11.099 -16.399 -20.279
    2    HA3  GLY  64           HA2      GLY  64  12.506 -18.228 -20.187
    3    HA2  GLY  64           HA3      GLY  64  12.227 -18.311 -18.453

  No H/Q in entry =           3
  In of MODEL    6
    1    H    GLU  65           H        GLU  65   9.445 -18.268 -20.520
    2    HA   GLU  65           HA       GLU  65   9.226 -21.196 -20.350
    3    HB2  GLU  65           HB2      GLU  65   7.199 -19.215 -19.324
    4    HB3  GLU  65           HB3      GLU  65   6.839 -20.917 -19.613
    5    HG2  GLU  65           HG2      GLU  65   8.583 -21.592 -18.043
    6    HG3  GLU  65           HG3      GLU  65   9.050 -19.910 -17.800

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLY  66           H        GLY  66   6.885 -18.736 -21.173
    2    HA3  GLY  66           HA2      GLY  66   7.070 -19.047 -24.004
    3    HA2  GLY  66           HA3      GLY  66   5.687 -19.896 -23.347

  No H/Q in entry =           3
  In of MODEL    6
    1    H    LYS  67           H        LYS  67   4.051 -18.685 -22.281
    2    HA   LYS  67           HA       LYS  67   3.397 -16.285 -23.636
    3    HB2  LYS  67           HB2      LYS  67   2.078 -17.772 -21.371
    4    HB3  LYS  67           HB3      LYS  67   1.375 -16.344 -22.141
    5    HG2  LYS  67           HG2      LYS  67   1.504 -17.460 -24.339
    6    HG3  LYS  67           HG3      LYS  67   2.203 -18.886 -23.577
    7    HD2  LYS  67           HD2      LYS  67   0.164 -19.225 -22.269
    8    HD3  LYS  67           HD3      LYS  67  -0.538 -17.755 -22.950
    9    HE2  LYS  67           HE2      LYS  67  -1.446 -19.481 -24.286
   10    HE3  LYS  67           HE3      LYS  67  -0.113 -18.852 -25.253
   11    HZ2  LYS  67           HZ1      LYS  67  -0.439 -21.433 -24.665
   12    HZ1  LYS  67           HZ2      LYS  67   0.589 -20.962 -23.398
   13    HZ3  LYS  67           HZ3      LYS  67   1.063 -20.728 -25.013

  No H/Q in entry =          13
  In of MODEL    6
    1    H    MET  68           H        MET  68   2.616 -14.340 -22.639
    2    HA   MET  68           HA       MET  68   4.518 -12.800 -21.449
    3    HB2  MET  68           HB2      MET  68   1.516 -12.557 -21.329
    4    HB3  MET  68           HB3      MET  68   2.615 -11.292 -20.780
    5    HG2  MET  68           HG2      MET  68   3.654 -11.224 -23.021
    6    HG3  MET  68           HG3      MET  68   2.537 -12.474 -23.571
    7    HE3  MET  68           HE1      MET  68   2.682  -9.977 -25.248
    8    HE2  MET  68           HE2      MET  68   0.972  -9.621 -25.476
    9    HE1  MET  68           HE3      MET  68   1.521 -11.295 -25.460

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LYS  69           H        LYS  69   3.255 -15.375 -19.812
    2    HA   LYS  69           HA       LYS  69   2.681 -14.300 -17.268
    3    HB2  LYS  69           HB2      LYS  69   3.574 -17.094 -17.996
    4    HB3  LYS  69           HB3      LYS  69   2.828 -16.615 -16.469
    5    HG2  LYS  69           HG2      LYS  69   1.532 -16.122 -19.158
    6    HG3  LYS  69           HG3      LYS  69   1.224 -17.567 -18.196
    7    HD2  LYS  69           HD2      LYS  69   0.669 -15.918 -16.275
    8    HD3  LYS  69           HD3      LYS  69   0.551 -14.701 -17.548
    9    HE2  LYS  69           HE2      LYS  69  -1.150 -15.999 -18.702
   10    HE3  LYS  69           HE3      LYS  69  -0.967 -17.324 -17.555
   11    HZ1  LYS  69           HZ1      LYS  69  -1.703 -15.851 -15.788
   12    HZ3  LYS  69           HZ2      LYS  69  -2.876 -15.959 -17.011
   13    HZ2  LYS  69           HZ3      LYS  69  -1.890 -14.580 -16.894

  No H/Q in entry =          13
  In of MODEL    6
    1    H    VAL  70           H        VAL  70   3.790 -14.253 -15.289
    2    HA   VAL  70           HA       VAL  70   6.738 -14.531 -15.416
    3    HB   VAL  70           HB       VAL  70   6.889 -12.506 -13.980
    4   HG12  VAL  70          HG11      VAL  70   5.396 -12.049 -16.581
    5   HG11  VAL  70          HG12      VAL  70   7.125 -12.372 -16.456
    6   HG13  VAL  70          HG13      VAL  70   6.453 -10.892 -15.773
    7   HG22  VAL  70          HG21      VAL  70   4.718 -12.470 -12.921
    8   HG21  VAL  70          HG22      VAL  70   3.899 -12.444 -14.482
    9   HG23  VAL  70          HG23      VAL  70   4.796 -11.028 -13.934

  No H/Q in entry =           9
  In of MODEL    6
    1    H    SER  71           H        SER  71   7.705 -14.660 -13.214
    2    HA   SER  71           HA       SER  71   6.547 -16.706 -11.642
    3    HB2  SER  71           HB2      SER  71   8.978 -16.228 -11.698
    4    HB3  SER  71           HB3      SER  71   8.685 -14.704 -10.862
    5    HG   SER  71           HG       SER  71   7.810 -17.207  -9.865

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU  72           H        LEU  72   5.192 -16.638  -9.921
    2    HA   LEU  72           HA       LEU  72   3.608 -14.344  -9.492
    3    HB2  LEU  72           HB2      LEU  72   3.927 -16.888  -7.907
    4    HB3  LEU  72           HB3      LEU  72   2.738 -15.648  -7.520
    5    HG   LEU  72           HG       LEU  72   2.928 -16.946 -10.257
    6   HD11  LEU  72          HD11      LEU  72   1.217 -17.676  -7.863
    7   HD13  LEU  72          HD12      LEU  72   2.413 -18.697  -8.658
    8   HD12  LEU  72          HD13      LEU  72   0.927 -18.262  -9.501
    9   HD22  LEU  72          HD21      LEU  72   1.660 -14.983 -10.501
   10   HD21  LEU  72          HD22      LEU  72   0.980 -15.089  -8.885
   11   HD23  LEU  72          HD23      LEU  72   0.416 -16.177 -10.149

  No H/Q in entry =          11
  In of MODEL    6
    1    H    VAL  73           H        VAL  73   6.279 -15.736  -7.703
    2    HA   VAL  73           HA       VAL  73   6.188 -14.194  -5.378
    3    HB   VAL  73           HB       VAL  73   8.384 -14.968  -4.942
    4   HG12  VAL  73          HG11      VAL  73   7.304 -17.115  -6.759
    5   HG11  VAL  73          HG12      VAL  73   6.449 -16.668  -5.282
    6   HG13  VAL  73          HG13      VAL  73   8.097 -17.288  -5.194
    7   HG22  VAL  73          HG21      VAL  73   9.716 -14.400  -6.763
    8   HG21  VAL  73          HG22      VAL  73   8.567 -15.044  -7.934
    9   HG23  VAL  73          HG23      VAL  73   9.574 -16.143  -6.992

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LEU  74           H        LEU  74   7.177 -13.300  -8.554
    2    HA   LEU  74           HA       LEU  74   9.093 -11.322  -8.063
    3    HB2  LEU  74           HB2      LEU  74   8.653 -12.089 -10.300
    4    HB3  LEU  74           HB3      LEU  74   6.981 -11.539 -10.208
    5    HG   LEU  74           HG       LEU  74   7.765  -9.202  -9.996
    6   HD12  LEU  74          HD11      LEU  74  10.259  -8.882 -10.591
    7   HD11  LEU  74          HD12      LEU  74  10.459 -10.566 -10.111
    8   HD13  LEU  74          HD13      LEU  74   9.886  -9.377  -8.942
    9   HD21  LEU  74          HD21      LEU  74   7.523 -10.636 -12.212
   10   HD23  LEU  74          HD22      LEU  74   9.236 -10.299 -12.311
   11   HD22  LEU  74          HD23      LEU  74   8.099  -8.971 -12.256

  No H/Q in entry =          11
  In of MODEL    6
    1    H    VAL  75           H        VAL  75   5.594 -10.988  -8.432
    2    HA   VAL  75           HA       VAL  75   5.457  -8.230  -7.857
    3    HB   VAL  75           HB       VAL  75   3.398 -10.404  -7.476
    4   HG11  VAL  75          HG11      VAL  75   3.155  -7.367  -7.315
    5   HG13  VAL  75          HG12      VAL  75   2.882  -8.507  -6.005
    6   HG12  VAL  75          HG13      VAL  75   1.791  -8.478  -7.380
    7   HG22  VAL  75          HG21      VAL  75   4.113 -10.019  -9.798
    8   HG21  VAL  75          HG22      VAL  75   3.861  -8.286  -9.605
    9   HG23  VAL  75          HG23      VAL  75   2.484  -9.387  -9.562

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLU  76           H        GLU  76   5.234 -11.102  -5.736
    2    HA   GLU  76           HA       GLU  76   4.735  -9.737  -3.322
    3    HB2  GLU  76           HB2      GLU  76   4.618 -12.223  -3.592
    4    HB3  GLU  76           HB3      GLU  76   6.366 -12.269  -3.737
    5    HG2  GLU  76           HG2      GLU  76   6.601 -11.371  -1.455
    6    HG3  GLU  76           HG3      GLU  76   4.858 -11.288  -1.283

  No H/Q in entry =           6
  In of MODEL    6
    1    H    ALA  77           H        ALA  77   7.814 -10.608  -4.869
    2    HA   ALA  77           HA       ALA  77   9.480  -9.533  -2.850
    3    HB3  ALA  77           HB1      ALA  77   9.897 -10.109  -5.777
    4    HB1  ALA  77           HB2      ALA  77  10.525 -10.987  -4.383
    5    HB2  ALA  77           HB3      ALA  77  11.170  -9.396  -4.787

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLN  78           H        GLN  78   8.082  -8.147  -5.776
    2    HA   GLN  78           HA       GLN  78   9.400  -5.649  -5.677
    3    HB2  GLN  78           HB2      GLN  78   8.127  -6.586  -7.638
    4    HB3  GLN  78           HB3      GLN  78   6.635  -6.233  -6.771
    5    HG2  GLN  78           HG2      GLN  78   7.242  -3.851  -6.680
    6    HG3  GLN  78           HG3      GLN  78   8.742  -4.195  -7.539
    7   HE21  GLN  78          HE21      GLN  78   8.372  -3.256  -9.588
    8   HE22  GLN  78          HE22      GLN  78   7.038  -3.624 -10.570

  No H/Q in entry =           8
  In of MODEL    6
    1    H    LEU  79           H        LEU  79   6.389  -6.821  -4.256
    2    HA   LEU  79           HA       LEU  79   5.358  -4.424  -3.262
    3    HB2  LEU  79           HB2      LEU  79   4.071  -6.492  -3.203
    4    HB3  LEU  79           HB3      LEU  79   5.221  -7.211  -2.079
    5    HG   LEU  79           HG       LEU  79   4.638  -5.569  -0.362
    6   HD13  LEU  79          HD11      LEU  79   4.151  -3.566  -1.424
    7   HD12  LEU  79          HD12      LEU  79   2.530  -4.111  -0.990
    8   HD11  LEU  79          HD13      LEU  79   3.122  -4.333  -2.635
    9   HD23  LEU  79          HD21      LEU  79   2.058  -6.096  -0.283
   10   HD22  LEU  79          HD22      LEU  79   3.214  -7.419  -0.162
   11   HD21  LEU  79          HD23      LEU  79   2.404  -7.099  -1.693

  No H/Q in entry =          11
  In of MODEL    6
    1    H    HIS  80           H        HIS  80   7.564  -6.723  -1.658
    2    HA   HIS  80           HA       HIS  80   7.819  -5.167   0.706
    3    HB2  HIS  80           HB2      HIS  80   9.195  -7.518  -0.476
    4    HB3  HIS  80           HB3      HIS  80  10.087  -6.604   0.742
    5    HD1  HIS  80           HD1      HIS  80   9.593  -7.237   3.085
    6    HD2  HIS  80           HD2      HIS  80   6.400  -8.140   0.560
    7    HE1  HIS  80           HE1      HIS  80   7.828  -8.357   4.529
    8    HE2  HIS  80           HE2      HIS  80   5.876  -8.911   2.998

  No H/Q in entry =           8
  In of MODEL    6
    1    H    LEU  81           H        LEU  81   9.844  -5.429  -2.195
    2    HA   LEU  81           HA       LEU  81  11.860  -3.658  -1.313
    3    HB2  LEU  81           HB2      LEU  81  10.964  -4.475  -4.078
    4    HB3  LEU  81           HB3      LEU  81  12.370  -3.449  -3.784
    5    HG   LEU  81           HG       LEU  81  12.005  -6.170  -2.501
    6   HD12  LEU  81          HD11      LEU  81  13.838  -6.780  -4.238
    7   HD11  LEU  81          HD12      LEU  81  13.259  -5.367  -5.119
    8   HD13  LEU  81          HD13      LEU  81  12.163  -6.704  -4.781
    9   HD23  LEU  81          HD21      LEU  81  14.629  -5.821  -2.474
   10   HD22  LEU  81          HD22      LEU  81  13.631  -5.068  -1.232
   11   HD21  LEU  81          HD23      LEU  81  14.205  -4.115  -2.600

  No H/Q in entry =          11
  In of MODEL    6
    1    H    MET  82           H        MET  82   8.941  -3.067  -3.268
    2    HA   MET  82           HA       MET  82   9.449  -0.337  -3.778
    3    HB2  MET  82           HB2      MET  82   6.909  -1.962  -3.660
    4    HB3  MET  82           HB3      MET  82   6.889  -0.239  -4.032
    5    HG2  MET  82           HG2      MET  82   8.524  -2.299  -5.549
    6    HG3  MET  82           HG3      MET  82   6.952  -1.698  -6.073
    7    HE3  MET  82           HE1      MET  82   7.364   1.757  -7.257
    8    HE2  MET  82           HE2      MET  82   6.983   1.533  -5.552
    9    HE1  MET  82           HE3      MET  82   6.338   0.411  -6.745

  No H/Q in entry =           9
  In of MODEL    6
    1    H    THR  83           H        THR  83   7.663  -1.946  -1.176
    2    HA   THR  83           HA       THR  83   6.776   0.397   0.136
    3    HB   THR  83           HB       THR  83   6.650  -1.170   2.160
    4    HG1  THR  83           HG1      THR  83   7.431  -3.112   1.943
    5   HG22  THR  83          HG21      THR  83   5.024  -2.762   0.690
    6   HG21  THR  83          HG22      THR  83   5.240  -1.435  -0.447
    7   HG23  THR  83          HG23      THR  83   4.587  -1.121   1.161

  No H/Q in entry =           7
  In of MODEL    6
    1    H    SER  84           H        SER  84   9.622  -1.664   0.681
    2    HA   SER  84           HA       SER  84  10.652  -0.212   2.869
    3    HB2  SER  84           HB2      SER  84  11.938  -2.048   0.859
    4    HB3  SER  84           HB3      SER  84  12.869  -1.278   2.142
    5    HG   SER  84           HG       SER  84  10.613  -2.993   2.397

  No H/Q in entry =           5
  In of MODEL    6
    1    H    MET  85           H        MET  85  11.421   0.043  -0.616
    2    HA   MET  85           HA       MET  85  13.395   2.033  -0.363
    3    HB2  MET  85           HB2      MET  85  13.029   0.740  -2.425
    4    HB3  MET  85           HB3      MET  85  11.490   1.567  -2.665
    5    HG2  MET  85           HG2      MET  85  12.660   3.733  -2.785
    6    HG3  MET  85           HG3      MET  85  14.200   2.920  -2.525
    7    HE2  MET  85           HE1      MET  85  14.829   3.784  -6.076
    8    HE1  MET  85           HE2      MET  85  14.878   4.296  -4.391
    9    HE3  MET  85           HE3      MET  85  13.522   4.771  -5.405

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LEU  86           H        LEU  86   9.905   2.325  -0.892
    2    HA   LEU  86           HA       LEU  86   9.809   5.136  -1.086
    3    HB2  LEU  86           HB2      LEU  86   7.987   3.453  -1.665
    4    HB3  LEU  86           HB3      LEU  86   7.649   3.367   0.063
    5    HG   LEU  86           HG       LEU  86   7.459   5.925  -0.001
    6   HD11  LEU  86          HD11      LEU  86   8.255   5.487  -2.697
    7   HD13  LEU  86          HD12      LEU  86   7.797   7.012  -1.945
    8   HD12  LEU  86          HD13      LEU  86   6.577   6.032  -2.753
    9   HD23  LEU  86          HD21      LEU  86   5.350   4.541  -1.669
   10   HD22  LEU  86          HD22      LEU  86   5.139   5.804  -0.460
   11   HD21  LEU  86          HD23      LEU  86   5.554   4.167   0.043

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ALA  87           H        ALA  87   9.353   2.964   1.667
    2    HA   ALA  87           HA       ALA  87   8.772   4.880   3.625
    3    HB1  ALA  87           HB1      ALA  87   9.611   2.069   3.555
    4    HB3  ALA  87           HB2      ALA  87   8.471   2.873   4.631
    5    HB2  ALA  87           HB3      ALA  87  10.198   2.925   4.984

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ARG  88           H        ARG  88  11.876   3.486   2.667
    2    HA   ARG  88           HA       ARG  88  13.460   4.890   4.502
    3    HB2  ARG  88           HB2      ARG  88  14.158   2.918   3.110
    4    HB3  ARG  88           HB3      ARG  88  14.306   4.007   1.734
    5    HG2  ARG  88           HG2      ARG  88  15.754   5.346   3.682
    6    HG3  ARG  88           HG3      ARG  88  16.091   3.661   4.070
    7    HD2  ARG  88           HD2      ARG  88  17.371   3.371   2.231
    8    HD3  ARG  88           HD3      ARG  88  16.231   4.226   1.188
    9    HE   ARG  88           HE       ARG  88  18.607   5.320   2.244
   10   HH21  ARG  88          HH11      ARG  88  18.929   7.542   2.041
   11   HH22  ARG  88          HH12      ARG  88  17.567   8.598   1.887
   12   HH11  ARG  88          HH21      ARG  88  15.262   6.035   1.945
   13   HH12  ARG  88          HH22      ARG  88  15.489   7.742   1.807

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLU  89           H        GLU  89  12.495   5.763   1.170
    2    HA   GLU  89           HA       GLU  89  14.016   8.139   1.011
    3    HB2  GLU  89           HB2      GLU  89  12.894   7.078  -0.938
    4    HB3  GLU  89           HB3      GLU  89  11.340   7.604  -0.291
    5    HG2  GLU  89           HG2      GLU  89  12.016   9.949  -0.460
    6    HG3  GLU  89           HG3      GLU  89  13.628   9.474  -0.986

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LEU  90           H        LEU  90  10.687   7.597   2.126
    2    HA   LEU  90           HA       LEU  90  10.138  10.327   2.687
    3    HB2  LEU  90           HB2      LEU  90   8.967   7.745   3.719
    4    HB3  LEU  90           HB3      LEU  90   8.316   9.335   4.131
    5    HG   LEU  90           HG       LEU  90   8.759   8.447   1.268
    6   HD12  LEU  90          HD11      LEU  90   6.229   8.091   1.319
    7   HD11  LEU  90          HD12      LEU  90   6.375   8.089   3.077
    8   HD13  LEU  90          HD13      LEU  90   7.212   6.865   2.122
    9   HD22  LEU  90          HD21      LEU  90   8.440  10.752   1.183
   10   HD21  LEU  90          HD22      LEU  90   7.446  10.779   2.638
   11   HD23  LEU  90          HD23      LEU  90   6.762  10.210   1.116

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  91           H        ILE  91  11.421   7.668   4.627
    2    HA   ILE  91           HA       ILE  91  11.534   9.045   7.090
    3    HB   ILE  91           HB       ILE  91  13.119   6.720   5.984
    4   HG12  ILE  91          HG12      ILE  91  11.090   6.874   8.233
    5   HG13  ILE  91          HG13      ILE  91  10.631   6.580   6.556
    6   HG22  ILE  91          HG21      ILE  91  13.578   6.522   8.628
    7   HG21  ILE  91          HG22      ILE  91  13.483   8.280   8.519
    8   HG23  ILE  91          HG23      ILE  91  14.676   7.401   7.564
    9   HD13  ILE  91          HD11      ILE  91  11.658   4.490   6.500
   10   HD12  ILE  91          HD12      ILE  91  11.055   4.548   8.156
   11   HD11  ILE  91          HD13      ILE  91  12.755   4.879   7.825

  No H/Q in entry =          11
  In of MODEL    6
    1    H    THR  92           H        THR  92  13.766   8.890   4.350
    2    HA   THR  92           HA       THR  92  15.910  10.312   5.514
    3    HB   THR  92           HB       THR  92  14.940  10.164   2.649
    4    HG1  THR  92           HG1      THR  92  15.791   8.278   3.066
    5   HG22  THR  92          HG21      THR  92  17.503  10.882   2.366
    6   HG21  THR  92          HG22      THR  92  17.178  11.706   3.890
    7   HG23  THR  92          HG23      THR  92  16.211  12.076   2.463

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLU  93           H        GLU  93  13.019  11.425   3.766
    2    HA   GLU  93           HA       GLU  93  13.582  14.193   3.872
    3    HB2  GLU  93           HB2      GLU  93  10.893  12.790   3.878
    4    HB3  GLU  93           HB3      GLU  93  11.164  14.491   3.501
    5    HG2  GLU  93           HG2      GLU  93  12.534  12.258   1.989
    6    HG3  GLU  93           HG3      GLU  93  10.983  12.921   1.491

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LEU  94           H        LEU  94  11.852  12.027   6.083
    2    HA   LEU  94           HA       LEU  94  11.012  13.971   7.947
    3    HB2  LEU  94           HB2      LEU  94  11.620  11.024   8.236
    4    HB3  LEU  94           HB3      LEU  94  11.030  11.999   9.580
    5    HG   LEU  94           HG       LEU  94   9.559  12.023   6.944
    6   HD11  LEU  94          HD11      LEU  94   9.657   9.811   8.958
    7   HD13  LEU  94          HD12      LEU  94   9.364   9.739   7.222
    8   HD12  LEU  94          HD13      LEU  94   8.075  10.246   8.311
    9   HD23  LEU  94          HD21      LEU  94   7.627  12.408   8.533
   10   HD22  LEU  94          HD22      LEU  94   8.851  13.676   8.570
   11   HD21  LEU  94          HD23      LEU  94   8.796  12.464   9.849

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  95           H        ILE  95  14.008  12.075   7.733
    2    HA   ILE  95           HA       ILE  95  15.154  13.020  10.148
    3    HB   ILE  95           HB       ILE  95  16.417  11.955   7.611
    4   HG12  ILE  95          HG12      ILE  95  16.121  10.762  10.382
    5   HG13  ILE  95          HG13      ILE  95  14.964  10.485   9.082
    6   HG21  ILE  95          HG21      ILE  95  17.650  12.787  10.256
    7   HG23  ILE  95          HG22      ILE  95  18.115  13.313   8.636
    8   HG22  ILE  95          HG23      ILE  95  18.437  11.659   9.153
    9   HD13  ILE  95          HD11      ILE  95  16.464   9.218   7.832
   10   HD12  ILE  95          HD12      ILE  95  16.934   8.781   9.472
   11   HD11  ILE  95          HD13      ILE  95  17.878   9.968   8.572

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLU  96           H        GLU  96  15.310  14.241   6.810
    2    HA   GLU  96           HA       GLU  96  17.131  16.342   7.286
    3    HB2  GLU  96           HB2      GLU  96  16.485  15.663   5.027
    4    HB3  GLU  96           HB3      GLU  96  14.834  16.203   5.317
    5    HG2  GLU  96           HG2      GLU  96  15.379  18.336   4.769
    6    HG3  GLU  96           HG3      GLU  96  16.672  18.356   5.957

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LEU  97           H        LEU  97  13.620  16.118   7.700
    2    HA   LEU  97           HA       LEU  97  13.170  18.849   8.328
    3    HB2  LEU  97           HB2      LEU  97  11.677  16.309   8.946
    4    HB3  LEU  97           HB3      LEU  97  11.144  17.853   9.608
    5    HG   LEU  97           HG       LEU  97  11.646  17.430   6.648
    6   HD12  LEU  97          HD11      LEU  97   9.124  17.273   6.518
    7   HD11  LEU  97          HD12      LEU  97   9.112  17.081   8.269
    8   HD13  LEU  97          HD13      LEU  97   9.911  15.878   7.256
    9   HD23  LEU  97          HD21      LEU  97   9.885  19.375   6.664
   10   HD22  LEU  97          HD22      LEU  97  11.561  19.755   7.063
   11   HD21  LEU  97          HD23      LEU  97  10.368  19.576   8.348

  No H/Q in entry =          11
  In of MODEL    6
    1    H    HIS  98           H        HIS  98  14.014  16.041  10.340
    2    HA   HIS  98           HA       HIS  98  13.830  17.310  12.850
    3    HB2  HIS  98           HB2      HIS  98  15.610  15.068  11.866
    4    HB3  HIS  98           HB3      HIS  98  15.594  15.614  13.544
    5    HD1  HIS  98           HD1      HIS  98  13.426  13.949  10.949
    6    HD2  HIS  98           HD2      HIS  98  13.289  14.884  15.009
    7    HE1  HIS  98           HE1      HIS  98  11.410  12.736  11.897
    8    HE2  HIS  98           HE2      HIS  98  11.307  13.297  14.366

  No H/Q in entry =           8
  In of MODEL    6
    1    H    GLU  99           H        GLU  99  16.396  17.214  10.427
    2    HA   GLU  99           HA       GLU  99  18.360  18.573  11.960
    3    HB2  GLU  99           HB2      GLU  99  18.863  17.283   9.898
    4    HB3  GLU  99           HB3      GLU  99  18.043  18.525   8.949
    5    HG2  GLU  99           HG2      GLU  99  19.629  20.216   9.740
    6    HG3  GLU  99           HG3      GLU  99  20.417  19.027  10.771

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LYS 100           H        LYS 100  15.834  19.699   9.727
    2    HA   LYS 100           HA       LYS 100  16.600  22.445   9.863
    3    HB2  LYS 100           HB2      LYS 100  13.985  21.124   9.102
    4    HB3  LYS 100           HB3      LYS 100  14.266  22.866   9.006
    5    HG2  LYS 100           HG2      LYS 100  16.250  22.433   7.550
    6    HG3  LYS 100           HG3      LYS 100  15.855  20.711   7.573
    7    HD2  LYS 100           HD2      LYS 100  13.659  21.193   6.561
    8    HD3  LYS 100           HD3      LYS 100  14.037  22.916   6.545
    9    HE2  LYS 100           HE2      LYS 100  16.008  22.451   5.096
   10    HE3  LYS 100           HE3      LYS 100  15.561  20.741   5.068
   11    HZ1  LYS 100           HZ1      LYS 100  13.717  22.911   4.215
   12    HZ3  LYS 100           HZ2      LYS 100  13.551  21.238   3.959
   13    HZ2  LYS 100           HZ3      LYS 100  14.757  22.110   3.140

  No H/Q in entry =          13
  In of MODEL    6
    1    H    LEU 101           H        LEU 101  14.516  20.385  11.828
    2    HA   LEU 101           HA       LEU 101  13.321  22.446  13.392
    3    HB2  LEU 101           HB2      LEU 101  13.792  19.503  13.790
    4    HB3  LEU 101           HB3      LEU 101  13.240  20.483  15.144
    5    HG   LEU 101           HG       LEU 101  11.833  20.546  12.468
    6   HD12  LEU 101          HD11      LEU 101  10.185  18.970  13.736
    7   HD11  LEU 101          HD12      LEU 101  11.579  18.575  14.739
    8   HD13  LEU 101          HD13      LEU 101  11.624  18.262  13.003
    9   HD21  LEU 101          HD21      LEU 101  11.155  21.343  15.314
   10   HD23  LEU 101          HD22      LEU 101   9.902  21.100  14.099
   11   HD22  LEU 101          HD23      LEU 101  11.125  22.347  13.862

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LYS 102           H        LYS 102  16.476  21.870  12.972
    2    HA   LYS 102           HA       LYS 102  18.309  22.765  14.049
    3    HB2  LYS 102           HB2      LYS 102  16.474  24.265  15.168
    4    HB3  LYS 102           HB3      LYS 102  16.686  23.210  16.551
    5    HG2  LYS 102           HG2      LYS 102  18.563  25.236  15.382
    6    HG3  LYS 102           HG3      LYS 102  18.177  24.925  17.060
    7    HD2  LYS 102           HD2      LYS 102  19.871  23.023  15.390
    8    HD3  LYS 102           HD3      LYS 102  20.542  24.356  16.320
    9    HE2  LYS 102           HE2      LYS 102  20.166  21.807  17.297
   10    HE3  LYS 102           HE3      LYS 102  20.365  23.255  18.284
   11    HZ2  LYS 102           HZ1      LYS 102  18.408  21.953  18.898
   12    HZ1  LYS 102           HZ2      LYS 102  17.768  22.170  17.345
   13    HZ3  LYS 102           HZ3      LYS 102  17.980  23.506  18.367

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ALA 103           H        ALA 103  16.243  21.147  16.468
    2    HA   ALA 103           HA       ALA 103  17.975  19.961  18.136
    3    HB2  ALA 103           HB1      ALA 103  16.412  17.937  18.131
    4    HB1  ALA 103           HB2      ALA 103  15.513  18.777  16.866
    5    HB3  ALA 103           HB3      ALA 103  15.676  19.505  18.463

  No H/Q in entry =           5
  In of MODEL    6
    1    H1   ALA   1           H3       ALA   1  -1.497  -7.253 -21.466
    2    H2   ALA   1           H2       ALA   1  -2.279  -8.694 -21.011
    3    H3   ALA   1           H1       ALA   1  -0.668  -8.730 -21.558
    4    HA   ALA   1           HA       ALA   1  -1.488  -9.216 -23.556
    5    HB1  ALA   1           HB1      ALA   1  -3.620  -9.953 -23.090
    6    HB2  ALA   1           HB2      ALA   1  -4.070  -8.450 -23.895
    7    HB3  ALA   1           HB3      ALA   1  -4.017  -8.523 -22.136

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLU   2           H        GLU   2  -2.321  -8.041 -25.554
    2    HA   GLU   2           HA       GLU   2  -0.938  -6.017 -26.433
    3    HB2  GLU   2           HB2      GLU   2  -3.943  -6.115 -26.764
    4    HB3  GLU   2           HB3      GLU   2  -2.825  -5.245 -27.812
    5    HG2  GLU   2           HG2      GLU   2  -2.298  -7.134 -28.957
    6    HG3  GLU   2           HG3      GLU   2  -1.999  -8.031 -27.475

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLU   3           H        GLU   3  -4.114  -4.788 -25.553
    2    HA   GLU   3           HA       GLU   3  -3.096  -2.219 -24.929
    3    HB2  GLU   3           HB2      GLU   3  -5.773  -3.559 -24.605
    4    HB3  GLU   3           HB3      GLU   3  -5.493  -1.939 -23.963
    5    HG2  GLU   3           HG2      GLU   3  -5.136  -1.016 -26.091
    6    HG3  GLU   3           HG3      GLU   3  -4.723  -2.570 -26.808

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LEU   4           H        LEU   4  -4.674  -4.586 -22.748
    2    HA   LEU   4           HA       LEU   4  -4.333  -3.345 -20.360
    3    HB2  LEU   4           HB2      LEU   4  -3.759  -6.282 -20.816
    4    HB3  LEU   4           HB3      LEU   4  -4.179  -5.534 -19.277
    5    HG   LEU   4           HG       LEU   4  -5.939  -5.635 -21.749
    6   HD13  LEU   4          HD11      LEU   4  -7.120  -7.360 -20.750
    7   HD12  LEU   4          HD12      LEU   4  -6.648  -6.890 -19.118
    8   HD11  LEU   4          HD13      LEU   4  -5.499  -7.726 -20.161
    9   HD23  LEU   4          HD21      LEU   4  -7.640  -4.833 -19.892
   10   HD22  LEU   4          HD22      LEU   4  -6.610  -3.655 -20.702
   11   HD21  LEU   4          HD23      LEU   4  -6.186  -4.235 -19.092

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLU   5           H        GLU   5  -1.809  -5.170 -22.072
    2    HA   GLU   5           HA       GLU   5   0.163  -4.859 -20.027
    3    HB2  GLU   5           HB2      GLU   5   0.254  -6.635 -21.770
    4    HB3  GLU   5           HB3      GLU   5   0.558  -5.394 -22.985
    5    HG2  GLU   5           HG2      GLU   5   2.615  -4.730 -21.835
    6    HG3  GLU   5           HG3      GLU   5   2.307  -5.908 -20.560

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLU   6           H        GLU   6  -0.475  -3.163 -23.081
    2    HA   GLU   6           HA       GLU   6   1.676  -1.309 -22.810
    3    HB2  GLU   6           HB2      GLU   6   0.557  -1.814 -24.973
    4    HB3  GLU   6           HB3      GLU   6  -0.899  -1.018 -24.377
    5    HG2  GLU   6           HG2      GLU   6   0.363   1.080 -24.084
    6    HG3  GLU   6           HG3      GLU   6   1.821   0.286 -24.677

  No H/Q in entry =           6
  In of MODEL    6
    1    H    VAL   7           H        VAL   7  -1.667  -1.409 -21.780
    2    HA   VAL   7           HA       VAL   7  -1.918   1.304 -20.955
    3    HB   VAL   7           HB       VAL   7  -3.360  -1.225 -20.116
    4   HG11  VAL   7          HG11      VAL   7  -3.767   1.663 -19.315
    5   HG13  VAL   7          HG12      VAL   7  -3.659   0.243 -18.274
    6   HG12  VAL   7          HG13      VAL   7  -5.089   0.495 -19.274
    7   HG21  VAL   7          HG21      VAL   7  -3.516  -0.159 -22.509
    8   HG23  VAL   7          HG22      VAL   7  -4.478   1.084 -21.707
    9   HG22  VAL   7          HG23      VAL   7  -5.007  -0.599 -21.676

  No H/Q in entry =           9
  In of MODEL    6
    1    H    VAL   8           H        VAL   8  -0.910  -1.665 -19.296
    2    HA   VAL   8           HA       VAL   8  -0.614  -0.573 -16.703
    3    HB   VAL   8           HB       VAL   8   0.820  -2.880 -18.044
    4   HG11  VAL   8          HG11      VAL   8   0.847  -1.850 -15.202
    5   HG13  VAL   8          HG12      VAL   8   2.222  -2.231 -16.239
    6   HG12  VAL   8          HG13      VAL   8   1.226  -3.529 -15.583
    7   HG21  VAL   8          HG21      VAL   8  -1.843  -2.689 -17.359
    8   HG23  VAL   8          HG22      VAL   8  -1.154  -3.317 -15.866
    9   HG22  VAL   8          HG23      VAL   8  -0.947  -4.207 -17.370

  No H/Q in entry =           9
  In of MODEL    6
    1    H    MET   9           H        MET   9   1.650  -0.862 -19.439
    2    HA   MET   9           HA       MET   9   3.921   0.207 -18.171
    3    HB2  MET   9           HB2      MET   9   2.980   0.152 -21.029
    4    HB3  MET   9           HB3      MET   9   4.443   1.029 -20.585
    5    HG2  MET   9           HG2      MET   9   5.167  -1.139 -19.394
    6    HG3  MET   9           HG3      MET   9   3.875  -1.923 -20.306
    7    HE1  MET   9           HE1      MET   9   3.690  -2.317 -22.539
    8    HE3  MET   9           HE2      MET   9   4.816  -1.974 -23.849
    9    HE2  MET   9           HE3      MET   9   3.803  -0.685 -23.208

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLY  10           H        GLY  10   1.229   1.778 -19.867
    2    HA3  GLY  10           HA2      GLY  10   2.168   4.441 -19.628
    3    HA2  GLY  10           HA3      GLY  10   0.483   3.965 -19.838

  No H/Q in entry =           3
  In of MODEL    6
    1    H    LEU  11           H        LEU  11   0.087   2.443 -17.548
    2    HA   LEU  11           HA       LEU  11  -0.469   4.422 -15.598
    3    HB2  LEU  11           HB2      LEU  11  -0.376   1.407 -15.431
    4    HB3  LEU  11           HB3      LEU  11  -0.900   2.431 -14.094
    5    HG   LEU  11           HG       LEU  11  -2.127   2.524 -16.864
    6   HD13  LEU  11          HD11      LEU  11  -2.696   0.378 -16.103
    7   HD12  LEU  11          HD12      LEU  11  -4.057   1.360 -15.567
    8   HD11  LEU  11          HD13      LEU  11  -2.802   0.895 -14.420
    9   HD22  LEU  11          HD21      LEU  11  -2.740   4.538 -15.867
   10   HD21  LEU  11          HD22      LEU  11  -2.666   3.878 -14.233
   11   HD23  LEU  11          HD23      LEU  11  -4.034   3.497 -15.280

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  12           H        ILE  12   2.096   1.977 -15.821
    2    HA   ILE  12           HA       ILE  12   3.286   2.533 -13.314
    3    HB   ILE  12           HB       ILE  12   4.561   1.495 -15.868
    4   HG12  ILE  12          HG12      ILE  12   2.553   0.251 -14.727
    5   HG13  ILE  12          HG13      ILE  12   3.963  -0.675 -15.204
    6   HG22  ILE  12          HG21      ILE  12   6.231   0.483 -14.259
    7   HG21  ILE  12          HG22      ILE  12   5.525   1.484 -12.990
    8   HG23  ILE  12          HG23      ILE  12   6.305   2.240 -14.378
    9   HD12  ILE  12          HD11      ILE  12   3.100  -1.214 -12.916
   10   HD11  ILE  12          HD12      ILE  12   3.484   0.435 -12.428
   11   HD13  ILE  12          HD13      ILE  12   4.763  -0.656 -12.914

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  13           H        ILE  13   3.891   3.790 -16.573
    2    HA   ILE  13           HA       ILE  13   6.010   5.531 -15.846
    3    HB   ILE  13           HB       ILE  13   3.989   5.584 -18.100
    4   HG12  ILE  13          HG12      ILE  13   5.842   3.764 -17.810
    5   HG13  ILE  13          HG13      ILE  13   5.602   4.501 -19.389
    6   HG21  ILE  13          HG21      ILE  13   6.316   7.432 -17.543
    7   HG23  ILE  13          HG22      ILE  13   4.654   7.867 -17.920
    8   HG22  ILE  13          HG23      ILE  13   5.692   7.196 -19.177
    9   HD11  ILE  13          HD11      ILE  13   7.662   5.506 -17.392
   10   HD13  ILE  13          HD12      ILE  13   7.493   5.958 -19.085
   11   HD12  ILE  13          HD13      ILE  13   8.020   4.333 -18.659

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ASN  14           H        ASN  14   2.501   5.995 -16.130
    2    HA   ASN  14           HA       ASN  14   2.432   8.743 -15.503
    3    HB2  ASN  14           HB2      ASN  14   0.556   7.082 -16.335
    4    HB3  ASN  14           HB3      ASN  14   0.230   6.907 -14.615
    5   HD21  ASN  14          HD21      ASN  14  -1.794   8.041 -16.060
    6   HD22  ASN  14          HD22      ASN  14  -1.872   9.714 -15.799

  No H/Q in entry =           6
  In of MODEL    6
    1    H    SER  15           H        SER  15   2.153   5.871 -13.417
    2    HA   SER  15           HA       SER  15   1.825   7.247 -10.975
    3    HB2  SER  15           HB2      SER  15   2.380   5.171  -9.917
    4    HB3  SER  15           HB3      SER  15   1.574   4.736 -11.419
    5    HG   SER  15           HG       SER  15   3.370   3.921 -12.143

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLY  16           H        GLY  16   4.717   6.169 -12.719
    2    HA3  GLY  16           HA2      GLY  16   6.628   6.950 -10.783
    3    HA2  GLY  16           HA3      GLY  16   6.940   6.744 -12.505

  No H/Q in entry =           3
  In of MODEL    6
    1    H    GLN  17           H        GLN  17   5.237   8.682 -13.581
    2    HA   GLN  17           HA       GLN  17   6.792  11.039 -13.276
    3    HB2  GLN  17           HB2      GLN  17   5.462  10.515 -15.316
    4    HB3  GLN  17           HB3      GLN  17   3.983  10.780 -14.392
    5    HG2  GLN  17           HG2      GLN  17   4.522  12.810 -15.623
    6    HG3  GLN  17           HG3      GLN  17   4.750  13.101 -13.900
    7   HE21  GLN  17          HE21      GLN  17   6.468  14.618 -13.938
    8   HE22  GLN  17          HE22      GLN  17   7.975  14.306 -14.654

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ALA  18           H        ALA  18   3.696   9.997 -11.935
    2    HA   ALA  18           HA       ALA  18   2.943  12.384 -10.681
    3    HB1  ALA  18           HB1      ALA  18   1.838   9.915 -10.898
    4    HB2  ALA  18           HB2      ALA  18   1.273  11.134  -9.758
    5    HB3  ALA  18           HB3      ALA  18   2.373   9.864  -9.219

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ARG  19           H        ARG  19   4.838   9.644  -9.384
    2    HA   ARG  19           HA       ARG  19   5.349  10.816  -6.864
    3    HB2  ARG  19           HB2      ARG  19   5.789   8.415  -7.381
    4    HB3  ARG  19           HB3      ARG  19   7.144   8.911  -8.398
    5    HG2  ARG  19           HG2      ARG  19   8.246   9.969  -6.475
    6    HG3  ARG  19           HG3      ARG  19   6.870   9.571  -5.448
    7    HD2  ARG  19           HD2      ARG  19   8.646   7.954  -5.077
    8    HD3  ARG  19           HD3      ARG  19   7.283   7.156  -5.865
    9    HE   ARG  19           HE       ARG  19   8.988   7.984  -7.909
   10   HH21  ARG  19          HH11      ARG  19  10.566   6.592  -8.748
   11   HH22  ARG  19          HH12      ARG  19  11.121   5.253  -7.805
   12   HH11  ARG  19          HH21      ARG  19   9.069   5.965  -5.123
   13   HH12  ARG  19          HH22      ARG  19  10.270   4.897  -5.751

  No H/Q in entry =          13
  In of MODEL    6
    1    H    SER  20           H        SER  20   7.178  10.853  -9.906
    2    HA   SER  20           HA       SER  20   9.405  12.294  -9.078
    3    HB2  SER  20           HB2      SER  20   8.896  11.251 -11.388
    4    HB3  SER  20           HB3      SER  20   8.106  12.783 -11.748
    5    HG   SER  20           HG       SER  20  10.481  13.223 -10.582

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU  21           H        LEU  21   6.298  13.526 -10.292
    2    HA   LEU  21           HA       LEU  21   6.938  16.280 -10.075
    3    HB2  LEU  21           HB2      LEU  21   4.287  14.825 -10.005
    4    HB3  LEU  21           HB3      LEU  21   4.431  16.581 -10.007
    5    HG   LEU  21           HG       LEU  21   5.668  14.809 -12.134
    6   HD13  LEU  21          HD11      LEU  21   3.229  14.549 -12.168
    7   HD12  LEU  21          HD12      LEU  21   3.754  15.508 -13.552
    8   HD11  LEU  21          HD13      LEU  21   3.026  16.301 -12.156
    9   HD23  LEU  21          HD21      LEU  21   5.401  17.127 -13.373
   10   HD22  LEU  21          HD22      LEU  21   6.762  16.903 -12.279
   11   HD21  LEU  21          HD23      LEU  21   5.346  17.792 -11.744

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ALA  22           H        ALA  22   5.442  13.982  -7.825
    2    HA   ALA  22           HA       ALA  22   4.811  15.791  -5.767
    3    HB3  ALA  22           HB1      ALA  22   4.077  13.390  -5.924
    4    HB2  ALA  22           HB2      ALA  22   4.654  13.874  -4.329
    5    HB1  ALA  22           HB3      ALA  22   5.692  12.923  -5.393

  No H/Q in entry =           5
  In of MODEL    6
    1    H    TYR  23           H        TYR  23   7.769  13.797  -6.186
    2    HA   TYR  23           HA       TYR  23   9.131  14.840  -3.932
    3    HB2  TYR  23           HB2      TYR  23   9.945  12.837  -5.080
    4    HB3  TYR  23           HB3      TYR  23  10.255  13.774  -6.541
    5    HD1  TYR  23           HD1      TYR  23  11.210  13.449  -2.947
    6    HD2  TYR  23           HD2      TYR  23  12.274  14.978  -6.819
    7    HE1  TYR  23           HE1      TYR  23  13.457  14.055  -2.091
    8    HE2  TYR  23           HE2      TYR  23  14.521  15.584  -5.962
    9    HH   TYR  23           HH       TYR  23  15.394  15.037  -2.548

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ALA  24           H        ALA  24   8.949  15.932  -7.303
    2    HA   ALA  24           HA       ALA  24  10.819  18.041  -7.057
    3    HB2  ALA  24           HB1      ALA  24  10.384  18.089  -9.268
    4    HB3  ALA  24           HB2      ALA  24   8.819  18.822  -8.918
    5    HB1  ALA  24           HB3      ALA  24   8.966  17.070  -9.040

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA  25           H        ALA  25   7.340  17.816  -6.449
    2    HA   ALA  25           HA       ALA  25   6.824  20.530  -5.892
    3    HB1  ALA  25           HB1      ALA  25   5.189  18.511  -6.092
    4    HB2  ALA  25           HB2      ALA  25   4.800  19.799  -4.950
    5    HB3  ALA  25           HB3      ALA  25   5.506  18.289  -4.371

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU  26           H        LEU  26   7.918  17.872  -3.828
    2    HA   LEU  26           HA       LEU  26   7.995  19.314  -1.396
    3    HB2  LEU  26           HB2      LEU  26   8.121  16.899  -1.381
    4    HB3  LEU  26           HB3      LEU  26   9.595  16.921  -2.346
    5    HG   LEU  26           HG       LEU  26  10.788  18.062  -0.505
    6   HD12  LEU  26          HD11      LEU  26   9.552  18.062   1.750
    7   HD11  LEU  26          HD12      LEU  26   8.071  17.902   0.810
    8   HD13  LEU  26          HD13      LEU  26   9.098  19.320   0.600
    9   HD21  LEU  26          HD21      LEU  26   9.282  15.578   0.371
   10   HD23  LEU  26          HD22      LEU  26  10.788  16.162   1.072
   11   HD22  LEU  26          HD23      LEU  26  10.756  15.596  -0.596

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LYS  27           H        LYS  27  10.429  18.763  -3.909
    2    HA   LYS  27           HA       LYS  27  12.591  20.037  -2.677
    3    HB2  LYS  27           HB2      LYS  27  12.719  18.683  -4.761
    4    HB3  LYS  27           HB3      LYS  27  11.940  20.002  -5.635
    5    HG2  LYS  27           HG2      LYS  27  13.783  21.514  -5.056
    6    HG3  LYS  27           HG3      LYS  27  14.557  20.236  -4.111
    7    HD2  LYS  27           HD2      LYS  27  14.727  18.842  -6.159
    8    HD3  LYS  27           HD3      LYS  27  13.998  20.147  -7.096
    9    HE2  LYS  27           HE2      LYS  27  15.863  21.641  -6.481
   10    HE3  LYS  27           HE3      LYS  27  16.596  20.340  -5.536
   11    HZ3  LYS  27           HZ1      LYS  27  17.593  20.444  -7.719
   12    HZ2  LYS  27           HZ2      LYS  27  16.071  20.303  -8.465
   13    HZ1  LYS  27           HZ3      LYS  27  16.708  19.004  -7.573

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLN  28           H        GLN  28   9.958  21.376  -4.642
    2    HA   GLN  28           HA       GLN  28  10.882  24.040  -4.802
    3    HB2  GLN  28           HB2      GLN  28   8.063  22.932  -4.696
    4    HB3  GLN  28           HB3      GLN  28   8.456  24.608  -5.077
    5    HG2  GLN  28           HG2      GLN  28   9.485  22.201  -6.606
    6    HG3  GLN  28           HG3      GLN  28   8.143  23.221  -7.122
    7   HE21  GLN  28          HE21      GLN  28  11.303  22.754  -7.813
    8   HE22  GLN  28          HE22      GLN  28  11.771  24.340  -8.196

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ALA  29           H        ALA  29   8.964  22.331  -2.366
    2    HA   ALA  29           HA       ALA  29   8.378  24.522  -0.695
    3    HB2  ALA  29           HB1      ALA  29   7.665  22.950   0.877
    4    HB1  ALA  29           HB2      ALA  29   8.904  21.781   0.421
    5    HB3  ALA  29           HB3      ALA  29   7.518  22.051  -0.634

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LYS  30           H        LYS  30  11.140  22.293  -0.745
    2    HA   LYS  30           HA       LYS  30  12.436  23.274   1.559
    3    HB2  LYS  30           HB2      LYS  30  13.559  21.994  -0.942
    4    HB3  LYS  30           HB3      LYS  30  14.531  22.372   0.482
    5    HG2  LYS  30           HG2      LYS  30  12.992  20.973   1.861
    6    HG3  LYS  30           HG3      LYS  30  12.119  20.533   0.390
    7    HD2  LYS  30           HD2      LYS  30  14.181  19.572  -0.560
    8    HD3  LYS  30           HD3      LYS  30  15.073  20.026   0.894
    9    HE2  LYS  30           HE2      LYS  30  13.583  18.579   2.248
   10    HE3  LYS  30           HE3      LYS  30  12.721  18.105   0.779
   11    HZ2  LYS  30           HZ1      LYS  30  14.532  16.555   1.553
   12    HZ1  LYS  30           HZ2      LYS  30  15.654  17.756   1.101
   13    HZ3  LYS  30           HZ3      LYS  30  14.632  17.053  -0.065

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLN  31           H        GLN  31  12.322  24.464  -1.743
    2    HA   GLN  31           HA       GLN  31  14.447  26.389  -1.321
    3    HB2  GLN  31           HB2      GLN  31  12.412  26.398  -3.553
    4    HB3  GLN  31           HB3      GLN  31  14.022  27.117  -3.551
    5    HG2  GLN  31           HG2      GLN  31  14.520  24.430  -2.963
    6    HG3  GLN  31           HG3      GLN  31  13.221  24.353  -4.146
    7   HE21  GLN  31          HE21      GLN  31  16.077  23.598  -4.536
    8   HE22  GLN  31          HE22      GLN  31  16.640  24.574  -5.804

  No H/Q in entry =           8
  In of MODEL    6
    1    H    GLY  32           H        GLY  32  11.371  26.168  -0.186
    2    HA3  GLY  32           HA2      GLY  32  10.188  27.725   1.076
    3    HA2  GLY  32           HA3      GLY  32  11.298  28.974   0.526

  No H/Q in entry =           3
  In of MODEL    6
    1    H    ASP  33           H        ASP  33   9.970  27.041  -1.964
    2    HA   ASP  33           HA       ASP  33   8.277  29.287  -2.835
    3    HB2  ASP  33           HB2      ASP  33   9.410  26.877  -4.264
    4    HB3  ASP  33           HB3      ASP  33   8.246  27.974  -5.003

  No H/Q in entry =           4
  In of MODEL    6
    1    H    PHE  34           H        PHE  34   6.590  28.793  -1.276
    2    HA   PHE  34           HA       PHE  34   5.245  26.302  -1.175
    3    HB2  PHE  34           HB2      PHE  34   4.242  29.078  -0.510
    4    HB3  PHE  34           HB3      PHE  34   3.413  27.578  -0.096
    5    HD1  PHE  34           HD1      PHE  34   5.624  30.012   1.117
    6    HD2  PHE  34           HD2      PHE  34   5.004  25.762   1.078
    7    HE1  PHE  34           HE1      PHE  34   7.010  29.789   3.160
    8    HE2  PHE  34           HE2      PHE  34   6.392  25.543   3.119
    9    HZ   PHE  34           HZ       PHE  34   7.389  27.558   4.159

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ALA  35           H        ALA  35   4.781  29.152  -3.199
    2    HA   ALA  35           HA       ALA  35   2.243  28.498  -4.231
    3    HB3  ALA  35           HB1      ALA  35   3.283  29.897  -6.271
    4    HB2  ALA  35           HB2      ALA  35   4.491  30.280  -5.044
    5    HB1  ALA  35           HB3      ALA  35   2.793  30.666  -4.761

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA  36           H        ALA  36   5.486  27.865  -5.571
    2    HA   ALA  36           HA       ALA  36   4.526  26.413  -7.812
    3    HB3  ALA  36           HB1      ALA  36   6.685  26.566  -8.421
    4    HB2  ALA  36           HB2      ALA  36   7.176  25.549  -7.064
    5    HB1  ALA  36           HB3      ALA  36   7.045  27.296  -6.856

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA  37           H        ALA  37   5.483  25.445  -4.550
    2    HA   ALA  37           HA       ALA  37   5.466  22.655  -4.968
    3    HB2  ALA  37           HB1      ALA  37   5.171  24.451  -2.598
    4    HB1  ALA  37           HB2      ALA  37   6.323  23.148  -2.881
    5    HB3  ALA  37           HB3      ALA  37   4.666  22.773  -2.415

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LYS  38           H        LYS  38   2.897  24.831  -3.819
    2    HA   LYS  38           HA       LYS  38   0.824  22.989  -3.597
    3    HB2  LYS  38           HB2      LYS  38   1.135  25.751  -3.355
    4    HB3  LYS  38           HB3      LYS  38  -0.058  25.582  -4.638
    5    HG2  LYS  38           HG2      LYS  38  -1.494  24.243  -3.195
    6    HG3  LYS  38           HG3      LYS  38  -0.253  24.206  -1.934
    7    HD2  LYS  38           HD2      LYS  38  -0.474  26.541  -1.497
    8    HD3  LYS  38           HD3      LYS  38  -1.384  26.811  -2.984
    9    HE2  LYS  38           HE2      LYS  38  -2.896  26.832  -1.050
   10    HE3  LYS  38           HE3      LYS  38  -3.246  25.446  -2.088
   11    HZ3  LYS  38           HZ1      LYS  38  -2.505  23.992  -0.547
   12    HZ2  LYS  38           HZ2      LYS  38  -2.878  25.248   0.537
   13    HZ1  LYS  38           HZ3      LYS  38  -1.278  25.018   0.018

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ALA  39           H        ALA  39   1.787  24.894  -6.449
    2    HA   ALA  39           HA       ALA  39  -0.270  23.991  -8.156
    3    HB2  ALA  39           HB1      ALA  39   2.461  24.674  -9.202
    4    HB1  ALA  39           HB2      ALA  39   1.473  25.924  -8.446
    5    HB3  ALA  39           HB3      ALA  39   0.878  25.072  -9.871

  No H/Q in entry =           5
  In of MODEL    6
    1    H    MET  40           H        MET  40   2.984  22.740  -7.560
    2    HA   MET  40           HA       MET  40   2.923  20.711  -9.543
    3    HB2  MET  40           HB2      MET  40   4.521  20.968  -6.990
    4    HB3  MET  40           HB3      MET  40   4.794  19.711  -8.198
    5    HG2  MET  40           HG2      MET  40   4.812  22.665  -8.875
    6    HG3  MET  40           HG3      MET  40   6.269  21.785  -8.417
    7    HE3  MET  40           HE1      MET  40   7.184  19.572 -11.214
    8    HE2  MET  40           HE2      MET  40   6.619  19.250  -9.577
    9    HE1  MET  40           HE3      MET  40   7.696  20.612  -9.878

  No H/Q in entry =           9
  In of MODEL    6
    1    H    MET  41           H        MET  41   1.994  20.754  -6.123
    2    HA   MET  41           HA       MET  41   1.501  17.983  -5.836
    3    HB2  MET  41           HB2      MET  41   0.129  20.326  -4.500
    4    HB3  MET  41           HB3      MET  41  -0.004  18.648  -3.986
    5    HG2  MET  41           HG2      MET  41   2.703  18.910  -4.014
    6    HG3  MET  41           HG3      MET  41   2.237  20.564  -3.626
    7    HE2  MET  41           HE1      MET  41  -0.791  19.273  -1.907
    8    HE1  MET  41           HE2      MET  41   0.005  20.797  -2.287
    9    HE3  MET  41           HE3      MET  41  -0.052  20.232  -0.617

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ASP  42           H        ASP  42  -0.573  20.673  -6.829
    2    HA   ASP  42           HA       ASP  42  -2.993  19.276  -6.969
    3    HB2  ASP  42           HB2      ASP  42  -2.323  21.856  -7.233
    4    HB3  ASP  42           HB3      ASP  42  -2.462  21.452  -8.941

  No H/Q in entry =           4
  In of MODEL    6
    1    H    GLN  43           H        GLN  43  -0.552  19.894  -9.464
    2    HA   GLN  43           HA       GLN  43  -1.911  18.546 -11.554
    3    HB2  GLN  43           HB2      GLN  43   1.037  19.107 -11.163
    4    HB3  GLN  43           HB3      GLN  43   0.339  18.451 -12.645
    5    HG2  GLN  43           HG2      GLN  43  -1.202  20.455 -12.700
    6    HG3  GLN  43           HG3      GLN  43  -0.264  21.130 -11.372
    7   HE21  GLN  43          HE21      GLN  43  -0.119  22.745 -13.463
    8   HE22  GLN  43          HE22      GLN  43   1.302  22.541 -14.365

  No H/Q in entry =           8
  In of MODEL    6
    1    H    SER  44           H        SER  44   0.447  17.450  -9.149
    2    HA   SER  44           HA       SER  44   0.824  14.845 -10.163
    3    HB2  SER  44           HB2      SER  44   1.689  16.305  -7.929
    4    HB3  SER  44           HB3      SER  44   0.845  14.912  -7.256
    5    HG   SER  44           HG       SER  44   2.967  14.322  -7.672

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ARG  45           H        ARG  45  -1.524  16.137  -7.839
    2    HA   ARG  45           HA       ARG  45  -2.877  13.758  -7.200
    3    HB2  ARG  45           HB2      ARG  45  -3.113  15.928  -6.018
    4    HB3  ARG  45           HB3      ARG  45  -3.973  16.576  -7.410
    5    HG2  ARG  45           HG2      ARG  45  -5.714  14.825  -7.127
    6    HG3  ARG  45           HG3      ARG  45  -4.866  14.231  -5.698
    7    HD2  ARG  45           HD2      ARG  45  -5.111  16.499  -4.652
    8    HD3  ARG  45           HD3      ARG  45  -6.101  16.998  -6.040
    9    HE   ARG  45           HE       ARG  45  -7.178  14.610  -4.995
   10   HH21  ARG  45          HH11      ARG  45  -9.020  14.662  -3.731
   11   HH22  ARG  45          HH12      ARG  45  -9.440  16.099  -2.870
   12   HH11  ARG  45          HH21      ARG  45  -6.686  17.868  -3.982
   13   HH12  ARG  45          HH22      ARG  45  -8.114  17.915  -3.010

  No H/Q in entry =          13
  In of MODEL    6
    1    H    MET  46           H        MET  46  -3.488  16.143  -9.762
    2    HA   MET  46           HA       MET  46  -5.805  14.931 -10.828
    3    HB2  MET  46           HB2      MET  46  -3.724  16.775 -12.017
    4    HB3  MET  46           HB3      MET  46  -5.115  16.208 -12.949
    5    HG2  MET  46           HG2      MET  46  -6.640  17.126 -11.256
    6    HG3  MET  46           HG3      MET  46  -5.271  17.665 -10.291
    7    HE2  MET  46           HE1      MET  46  -5.617  20.450 -10.331
    8    HE1  MET  46           HE2      MET  46  -7.126  19.565 -10.528
    9    HE3  MET  46           HE3      MET  46  -6.787  20.955 -11.558

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ALA  47           H        ALA  47  -2.366  14.502 -11.571
    2    HA   ALA  47           HA       ALA  47  -2.676  12.761 -13.776
    3    HB3  ALA  47           HB1      ALA  47  -0.514  13.685 -13.419
    4    HB2  ALA  47           HB2      ALA  47  -0.347  11.961 -13.078
    5    HB1  ALA  47           HB3      ALA  47  -0.463  13.116 -11.750

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU  48           H        LEU  48  -2.410  12.143 -10.299
    2    HA   LEU  48           HA       LEU  48  -2.459   9.301 -10.446
    3    HB2  LEU  48           HB2      LEU  48  -3.262  11.216  -8.243
    4    HB3  LEU  48           HB3      LEU  48  -3.141   9.468  -8.035
    5    HG   LEU  48           HG       LEU  48  -0.865  11.199  -9.030
    6   HD13  LEU  48          HD11      LEU  48  -1.169  11.973  -6.843
    7   HD12  LEU  48          HD12      LEU  48   0.014  10.685  -6.635
    8   HD11  LEU  48          HD13      LEU  48  -1.681  10.397  -6.243
    9   HD22  LEU  48          HD21      LEU  48  -0.330   9.019  -9.660
   10   HD21  LEU  48          HD22      LEU  48  -1.194   8.295  -8.304
   11   HD23  LEU  48          HD23      LEU  48   0.366   9.074  -8.041

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ASN  49           H        ASN  49  -4.963  11.756 -10.064
    2    HA   ASN  49           HA       ASN  49  -7.124  10.059  -9.526
    3    HB2  ASN  49           HB2      ASN  49  -7.227  12.479  -9.209
    4    HB3  ASN  49           HB3      ASN  49  -7.052  12.741 -10.940
    5   HD21  ASN  49          HD21      ASN  49  -9.284  13.810  -9.674
    6   HD22  ASN  49          HD22      ASN  49 -10.672  12.946 -10.124

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLU  50           H        GLU  50  -5.851  11.264 -12.613
    2    HA   GLU  50           HA       GLU  50  -7.779   9.971 -14.262
    3    HB2  GLU  50           HB2      GLU  50  -6.339  11.810 -15.078
    4    HB3  GLU  50           HB3      GLU  50  -4.929  10.761 -14.930
    5    HG2  GLU  50           HG2      GLU  50  -5.871   9.203 -16.564
    6    HG3  GLU  50           HG3      GLU  50  -7.347  10.158 -16.661

  No H/Q in entry =           6
  In of MODEL    6
    1    H    ALA  51           H        ALA  51  -4.598   9.034 -13.040
    2    HA   ALA  51           HA       ALA  51  -4.414   6.578 -14.447
    3    HB2  ALA  51           HB1      ALA  51  -2.434   6.325 -13.338
    4    HB1  ALA  51           HB2      ALA  51  -3.135   6.743 -11.775
    5    HB3  ALA  51           HB3      ALA  51  -2.694   8.016 -12.913

  No H/Q in entry =           5
  In of MODEL    6
    1    H    HIS  52           H        HIS  52  -5.614   7.404 -11.206
    2    HA   HIS  52           HA       HIS  52  -6.262   4.787 -10.367
    3    HB2  HIS  52           HB2      HIS  52  -6.161   6.730  -8.848
    4    HB3  HIS  52           HB3      HIS  52  -7.597   7.399  -9.621
    5    HD1  HIS  52           HD1      HIS  52  -9.817   5.871  -9.443
    6    HD2  HIS  52           HD2      HIS  52  -6.703   4.852  -6.867
    7    HE1  HIS  52           HE1      HIS  52 -10.825   4.389  -7.653
    8    HE2  HIS  52           HE2      HIS  52  -8.938   3.759  -6.074

  No H/Q in entry =           8
  In of MODEL    6
    1    H    LEU  53           H        LEU  53  -8.112   7.209 -12.172
    2    HA   LEU  53           HA       LEU  53 -10.597   5.879 -12.190
    3    HB2  LEU  53           HB2      LEU  53  -9.337   7.870 -14.066
    4    HB3  LEU  53           HB3      LEU  53 -10.926   7.181 -14.386
    5    HG   LEU  53           HG       LEU  53 -10.223   8.533 -11.760
    6   HD12  LEU  53          HD11      LEU  53 -11.427  10.503 -12.646
    7   HD11  LEU  53          HD12      LEU  53 -11.589   9.695 -14.207
    8   HD13  LEU  53          HD13      LEU  53  -9.996  10.148 -13.606
    9   HD22  LEU  53          HD21      LEU  53 -12.191   7.285 -11.404
   10   HD21  LEU  53          HD22      LEU  53 -12.750   7.526 -13.056
   11   HD23  LEU  53          HD23      LEU  53 -12.845   8.840 -11.899

  No H/Q in entry =          11
  In of MODEL    6
    1    H    VAL  54           H        VAL  54  -7.835   5.715 -14.415
    2    HA   VAL  54           HA       VAL  54  -9.022   3.918 -16.256
    3    HB   VAL  54           HB       VAL  54  -6.126   4.471 -15.564
    4   HG12  VAL  54          HG11      VAL  54  -5.852   3.381 -17.947
    5   HG11  VAL  54          HG12      VAL  54  -7.370   2.578 -17.547
    6   HG13  VAL  54          HG13      VAL  54  -5.955   2.349 -16.521
    7   HG22  VAL  54          HG21      VAL  54  -6.920   6.398 -16.619
    8   HG21  VAL  54          HG22      VAL  54  -8.096   5.513 -17.589
    9   HG23  VAL  54          HG23      VAL  54  -6.387   5.457 -18.012

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLN  55           H        GLN  55  -7.028   3.414 -13.346
    2    HA   GLN  55           HA       GLN  55  -6.895   0.598 -13.590
    3    HB2  GLN  55           HB2      GLN  55  -5.360   1.523 -12.068
    4    HB3  GLN  55           HB3      GLN  55  -6.594   2.474 -11.248
    5    HG2  GLN  55           HG2      GLN  55  -7.262   0.712  -9.926
    6    HG3  GLN  55           HG3      GLN  55  -7.014  -0.477 -11.199
    7   HE21  GLN  55          HE21      GLN  55  -5.371  -1.900 -10.691
    8   HE22  GLN  55          HE22      GLN  55  -3.996  -1.524  -9.775

  No H/Q in entry =           8
  In of MODEL    6
    1    H    THR  56           H        THR  56  -9.265   2.732 -11.995
    2    HA   THR  56           HA       THR  56 -10.827   0.830 -10.705
    3    HB   THR  56           HB       THR  56 -11.946   3.199 -12.225
    4    HG1  THR  56           HG1      THR  56 -11.332   3.461  -9.561
    5   HG23  THR  56          HG21      THR  56 -13.770   3.065 -10.781
    6   HG22  THR  56          HG22      THR  56 -12.865   2.174  -9.557
    7   HG21  THR  56          HG23      THR  56 -13.391   1.362 -11.032

  No H/Q in entry =           7
  In of MODEL    6
    1    H    LYS  57           H        LYS  57 -11.030   1.896 -14.096
    2    HA   LYS  57           HA       LYS  57 -13.158   0.175 -14.852
    3    HB2  LYS  57           HB2      LYS  57 -12.301   2.134 -16.172
    4    HB3  LYS  57           HB3      LYS  57 -10.850   1.210 -16.533
    5    HG2  LYS  57           HG2      LYS  57 -12.243  -0.518 -17.640
    6    HG3  LYS  57           HG3      LYS  57 -13.678   0.452 -17.324
    7    HD2  LYS  57           HD2      LYS  57 -11.310   1.535 -18.866
    8    HD3  LYS  57           HD3      LYS  57 -12.640   0.695 -19.659
    9    HE2  LYS  57           HE2      LYS  57 -14.217   2.351 -18.535
   10    HE3  LYS  57           HE3      LYS  57 -12.794   3.272 -18.052
   11    HZ1  LYS  57           HZ1      LYS  57 -12.635   2.607 -20.791
   12    HZ3  LYS  57           HZ2      LYS  57 -12.661   4.141 -20.060
   13    HZ2  LYS  57           HZ3      LYS  57 -14.117   3.369 -20.477

  No H/Q in entry =          13
  In of MODEL    6
    1    H    LEU  58           H        LEU  58  -9.648  -0.205 -14.778
    2    HA   LEU  58           HA       LEU  58  -9.613  -2.727 -16.056
    3    HB2  LEU  58           HB2      LEU  58  -7.606  -1.398 -14.244
    4    HB3  LEU  58           HB3      LEU  58  -7.319  -2.919 -15.090
    5    HG   LEU  58           HG       LEU  58  -8.105  -0.331 -16.468
    6   HD11  LEU  58          HD11      LEU  58  -5.443  -1.526 -15.760
    7   HD13  LEU  58          HD12      LEU  58  -5.964   0.157 -15.721
    8   HD12  LEU  58          HD13      LEU  58  -5.606  -0.615 -17.262
    9   HD22  LEU  58          HD21      LEU  58  -8.650  -1.909 -18.055
   10   HD21  LEU  58          HD22      LEU  58  -7.594  -3.138 -17.363
   11   HD23  LEU  58          HD23      LEU  58  -6.917  -1.858 -18.371

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  59           H        ILE  59 -10.462  -1.823 -12.812
    2    HA   ILE  59           HA       ILE  59 -10.075  -4.580 -11.851
    3    HB   ILE  59           HB       ILE  59  -9.670  -2.301 -10.460
    4   HG12  ILE  59          HG12      ILE  59 -11.014  -4.658  -9.123
    5   HG13  ILE  59          HG13      ILE  59  -9.373  -4.732  -9.714
    6   HG22  ILE  59          HG21      ILE  59 -12.415  -3.056  -9.506
    7   HG21  ILE  59          HG22      ILE  59 -12.229  -1.840 -10.750
    8   HG23  ILE  59          HG23      ILE  59 -11.502  -1.605  -9.163
    9   HD13  ILE  59          HD11      ILE  59  -9.313  -4.123  -7.378
   10   HD12  ILE  59          HD12      ILE  59 -10.445  -2.808  -7.654
   11   HD11  ILE  59          HD13      ILE  59  -8.817  -2.726  -8.327

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLU  60           H        GLU  60 -12.663  -2.307 -12.681
    2    HA   GLU  60           HA       GLU  60 -14.830  -3.851 -11.672
    3    HB2  GLU  60           HB2      GLU  60 -15.069  -1.483 -12.281
    4    HB3  GLU  60           HB3      GLU  60 -14.745  -1.872 -13.968
    5    HG2  GLU  60           HG2      GLU  60 -16.761  -3.331 -13.995
    6    HG3  GLU  60           HG3      GLU  60 -17.103  -2.856 -12.344

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLY  61           H        GLY  61 -13.142  -3.824 -14.779
    2    HA3  GLY  61           HA2      GLY  61 -14.817  -6.098 -15.667
    3    HA2  GLY  61           HA3      GLY  61 -13.983  -4.986 -16.746

  No H/Q in entry =           3
  In of MODEL    6
    1    H    ASP  62           H        ASP  62 -12.603  -6.403 -13.849
    2    HA   ASP  62           HA       ASP  62 -10.249  -7.233 -15.170
    3    HB2  ASP  62           HB2      ASP  62  -9.750  -8.343 -13.004
    4    HB3  ASP  62           HB3      ASP  62 -10.281  -6.677 -12.802

  No H/Q in entry =           4
  In of MODEL    6
    1    H    ALA  63           H        ALA  63 -13.223  -9.026 -14.348
    2    HA   ALA  63           HA       ALA  63 -12.288 -11.655 -14.853
    3    HB3  ALA  63           HB1      ALA  63 -15.035 -10.408 -15.242
    4    HB2  ALA  63           HB2      ALA  63 -14.458 -11.229 -13.792
    5    HB1  ALA  63           HB3      ALA  63 -14.717 -12.143 -15.280

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLY  64           H        GLY  64 -14.840 -11.133 -16.929
    2    HA3  GLY  64           HA2      GLY  64 -15.093 -10.999 -19.219
    3    HA2  GLY  64           HA3      GLY  64 -13.419 -10.472 -19.338

  No H/Q in entry =           3
  In of MODEL    6
    1    H    GLU  65           H        GLU  65 -14.106 -13.396 -17.600
    2    HA   GLU  65           HA       GLU  65 -13.379 -15.014 -19.943
    3    HB2  GLU  65           HB2      GLU  65 -11.933 -15.018 -17.296
    4    HB3  GLU  65           HB3      GLU  65 -11.760 -16.289 -18.507
    5    HG2  GLU  65           HG2      GLU  65 -10.998 -14.651 -20.160
    6    HG3  GLU  65           HG3      GLU  65 -11.225 -13.346 -18.996

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLY  66           H        GLY  66 -13.532 -15.791 -16.538
    2    HA3  GLY  66           HA2      GLY  66 -16.086 -17.062 -16.606
    3    HA2  GLY  66           HA3      GLY  66 -14.779 -18.229 -16.646

  No H/Q in entry =           3
  In of MODEL    6
    1    H    LYS  67           H        LYS  67 -13.337 -18.338 -14.867
    2    HA   LYS  67           HA       LYS  67 -14.652 -18.149 -12.364
    3    HB2  LYS  67           HB2      LYS  67 -11.847 -18.922 -13.141
    4    HB3  LYS  67           HB3      LYS  67 -12.463 -19.023 -11.486
    5    HG2  LYS  67           HG2      LYS  67 -14.316 -20.460 -12.256
    6    HG3  LYS  67           HG3      LYS  67 -13.708 -20.361 -13.908
    7    HD2  LYS  67           HD2      LYS  67 -11.636 -21.481 -13.249
    8    HD3  LYS  67           HD3      LYS  67 -12.166 -21.511 -11.565
    9    HE2  LYS  67           HE2      LYS  67 -12.739 -23.662 -12.365
   10    HE3  LYS  67           HE3      LYS  67 -14.254 -22.761 -12.452
   11    HZ2  LYS  67           HZ1      LYS  67 -13.213 -24.120 -14.495
   12    HZ1  LYS  67           HZ2      LYS  67 -12.560 -22.582 -14.796
   13    HZ3  LYS  67           HZ3      LYS  67 -14.242 -22.785 -14.681

  No H/Q in entry =          13
  In of MODEL    6
    1    H    MET  68           H        MET  68 -13.748 -17.271 -10.421
    2    HA   MET  68           HA       MET  68 -13.705 -14.559 -10.272
    3    HB2  MET  68           HB2      MET  68 -12.372 -16.580  -8.476
    4    HB3  MET  68           HB3      MET  68 -12.543 -14.875  -8.062
    5    HG2  MET  68           HG2      MET  68 -14.990 -15.056  -8.314
    6    HG3  MET  68           HG3      MET  68 -14.821 -16.764  -8.727
    7    HE3  MET  68           HE1      MET  68 -16.760 -16.056  -6.535
    8    HE2  MET  68           HE2      MET  68 -16.331 -17.214  -5.279
    9    HE1  MET  68           HE3      MET  68 -16.296 -17.707  -6.970

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LYS  69           H        LYS  69 -11.313 -16.129 -11.927
    2    HA   LYS  69           HA       LYS  69  -8.966 -14.881 -10.991
    3    HB2  LYS  69           HB2      LYS  69  -9.566 -16.003 -13.733
    4    HB3  LYS  69           HB3      LYS  69  -7.957 -15.644 -13.104
    5    HG2  LYS  69           HG2      LYS  69  -9.899 -17.509 -11.716
    6    HG3  LYS  69           HG3      LYS  69  -8.680 -18.066 -12.861
    7    HD2  LYS  69           HD2      LYS  69  -6.986 -16.796 -11.373
    8    HD3  LYS  69           HD3      LYS  69  -8.268 -16.786 -10.162
    9    HE2  LYS  69           HE2      LYS  69  -8.405 -19.215 -10.213
   10    HE3  LYS  69           HE3      LYS  69  -7.243 -19.286 -11.537
   11    HZ1  LYS  69           HZ1      LYS  69  -5.586 -18.291 -10.081
   12    HZ3  LYS  69           HZ2      LYS  69  -6.182 -19.739  -9.424
   13    HZ2  LYS  69           HZ3      LYS  69  -6.705 -18.244  -8.808

  No H/Q in entry =          13
  In of MODEL    6
    1    H    VAL  70           H        VAL  70  -7.661 -13.197 -11.744
    2    HA   VAL  70           HA       VAL  70  -8.943 -11.212 -13.531
    3    HB   VAL  70           HB       VAL  70  -8.035  -9.443 -12.045
    4   HG12  VAL  70          HG11      VAL  70  -9.812 -11.430 -10.598
    5   HG11  VAL  70          HG12      VAL  70 -10.376 -10.290 -11.821
    6   HG13  VAL  70          HG13      VAL  70  -9.723  -9.695 -10.296
    7   HG22  VAL  70          HG21      VAL  70  -6.194 -10.549 -10.958
    8   HG21  VAL  70          HG22      VAL  70  -7.239 -11.846 -10.380
    9   HG23  VAL  70          HG23      VAL  70  -7.375 -10.230  -9.687

  No H/Q in entry =           9
  In of MODEL    6
    1    H    SER  71           H        SER  71  -7.358  -9.641 -14.394
    2    HA   SER  71           HA       SER  71  -5.146 -10.894 -15.633
    3    HB2  SER  71           HB2      SER  71  -6.277  -8.892 -16.559
    4    HB3  SER  71           HB3      SER  71  -5.666  -7.939 -15.209
    5    HG   SER  71           HG       SER  71  -4.016  -9.438 -16.961

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU  72           H        LEU  72  -3.074 -11.108 -15.032
    2    HA   LEU  72           HA       LEU  72  -2.370 -10.870 -12.318
    3    HB2  LEU  72           HB2      LEU  72  -0.694 -11.283 -14.790
    4    HB3  LEU  72           HB3      LEU  72  -0.044 -11.346 -13.155
    5    HG   LEU  72           HG       LEU  72  -2.370 -13.067 -14.072
    6   HD11  LEU  72          HD11      LEU  72   0.600 -13.672 -13.994
    7   HD13  LEU  72          HD12      LEU  72  -0.441 -13.667 -15.417
    8   HD12  LEU  72          HD13      LEU  72  -0.656 -14.898 -14.173
    9   HD22  LEU  72          HD21      LEU  72  -2.378 -13.073 -11.720
   10   HD21  LEU  72          HD22      LEU  72  -0.631 -12.942 -11.604
   11   HD23  LEU  72          HD23      LEU  72  -1.367 -14.466 -12.090

  No H/Q in entry =          11
  In of MODEL    6
    1    H    VAL  73           H        VAL  73  -1.669  -8.857 -15.105
    2    HA   VAL  73           HA       VAL  73   0.223  -7.126 -14.001
    3    HB   VAL  73           HB       VAL  73  -0.188  -5.718 -15.865
    4   HG12  VAL  73          HG11      VAL  73  -1.016  -8.427 -16.897
    5   HG11  VAL  73          HG12      VAL  73   0.594  -8.167 -16.225
    6   HG13  VAL  73          HG13      VAL  73   0.068  -7.250 -17.636
    7   HG22  VAL  73          HG21      VAL  73  -2.467  -5.244 -15.912
    8   HG21  VAL  73          HG22      VAL  73  -2.925  -6.935 -15.720
    9   HG23  VAL  73          HG23      VAL  73  -2.333  -6.354 -17.277

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LEU  74           H        LEU  74  -3.176  -7.287 -13.459
    2    HA   LEU  74           HA       LEU  74  -3.834  -4.637 -12.862
    3    HB2  LEU  74           HB2      LEU  74  -5.537  -6.330 -13.037
    4    HB3  LEU  74           HB3      LEU  74  -4.841  -7.234 -11.694
    5    HG   LEU  74           HG       LEU  74  -5.338  -5.348 -10.171
    6   HD12  LEU  74          HD11      LEU  74  -6.967  -3.609 -11.167
    7   HD11  LEU  74          HD12      LEU  74  -6.362  -4.130 -12.739
    8   HD13  LEU  74          HD13      LEU  74  -5.257  -3.423 -11.558
    9   HD21  LEU  74          HD21      LEU  74  -7.001  -7.232 -11.005
   10   HD23  LEU  74          HD22      LEU  74  -7.854  -5.840 -11.636
   11   HD22  LEU  74          HD23      LEU  74  -7.540  -5.952  -9.922

  No H/Q in entry =          11
  In of MODEL    6
    1    H    VAL  75           H        VAL  75  -2.768  -7.199 -10.683
    2    HA   VAL  75           HA       VAL  75  -2.602  -5.634  -8.346
    3    HB   VAL  75           HB       VAL  75  -1.071  -8.113  -9.119
    4   HG11  VAL  75          HG11      VAL  75  -1.293  -6.623  -6.465
    5   HG13  VAL  75          HG12      VAL  75   0.171  -6.884  -7.402
    6   HG12  VAL  75          HG13      VAL  75  -0.633  -8.246  -6.642
    7   HG22  VAL  75          HG21      VAL  75  -3.514  -8.382  -8.940
    8   HG21  VAL  75          HG22      VAL  75  -3.500  -7.589  -7.365
    9   HG23  VAL  75          HG23      VAL  75  -2.721  -9.158  -7.569

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLU  76           H        GLU  76  -0.171  -6.373 -10.867
    2    HA   GLU  76           HA       GLU  76   1.990  -4.989  -9.705
    3    HB2  GLU  76           HB2      GLU  76   2.185  -6.482 -11.696
    4    HB3  GLU  76           HB3      GLU  76   1.318  -5.292 -12.655
    5    HG2  GLU  76           HG2      GLU  76   3.113  -3.650 -12.284
    6    HG3  GLU  76           HG3      GLU  76   3.994  -4.793 -11.290

  No H/Q in entry =           6
  In of MODEL    6
    1    H    ALA  77           H        ALA  77  -0.547  -3.834 -11.912
    2    HA   ALA  77           HA       ALA  77   0.407  -1.175 -12.096
    3    HB3  ALA  77           HB1      ALA  77  -2.303  -2.437 -12.506
    4    HB1  ALA  77           HB2      ALA  77  -1.179  -1.827 -13.721
    5    HB2  ALA  77           HB3      ALA  77  -2.056  -0.698 -12.687

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLN  78           H        GLN  78  -1.850  -2.752  -9.889
    2    HA   GLN  78           HA       GLN  78  -2.697  -0.438  -8.503
    3    HB2  GLN  78           HB2      GLN  78  -3.775  -2.713  -8.413
    4    HB3  GLN  78           HB3      GLN  78  -2.437  -3.249  -7.400
    5    HG2  GLN  78           HG2      GLN  78  -2.987  -1.511  -5.748
    6    HG3  GLN  78           HG3      GLN  78  -4.326  -0.969  -6.757
    7   HE21  GLN  78          HE21      GLN  78  -6.151  -1.635  -5.552
    8   HE22  GLN  78          HE22      GLN  78  -6.414  -3.233  -5.043

  No H/Q in entry =           8
  In of MODEL    6
    1    H    LEU  79           H        LEU  79   0.011  -2.653  -8.028
    2    HA   LEU  79           HA       LEU  79   0.962  -1.730  -5.570
    3    HB2  LEU  79           HB2      LEU  79   1.866  -3.731  -6.624
    4    HB3  LEU  79           HB3      LEU  79   2.505  -2.776  -7.959
    5    HG   LEU  79           HG       LEU  79   4.036  -1.607  -6.453
    6   HD13  LEU  79          HD11      LEU  79   3.018  -1.367  -4.392
    7   HD12  LEU  79          HD12      LEU  79   4.114  -2.699  -4.036
    8   HD11  LEU  79          HD13      LEU  79   2.415  -3.025  -4.373
    9   HD23  LEU  79          HD21      LEU  79   5.274  -3.733  -5.533
   10   HD22  LEU  79          HD22      LEU  79   5.077  -3.545  -7.273
   11   HD21  LEU  79          HD23      LEU  79   4.010  -4.627  -6.381

  No H/Q in entry =          11
  In of MODEL    6
    1    H    HIS  80           H        HIS  80   1.832  -0.616  -8.844
    2    HA   HIS  80           HA       HIS  80   3.605   1.403  -7.923
    3    HB2  HIS  80           HB2      HIS  80   2.339   0.676 -10.509
    4    HB3  HIS  80           HB3      HIS  80   2.908   2.338 -10.343
    5    HD1  HIS  80           HD1      HIS  80   5.307   2.673 -10.854
    6    HD2  HIS  80           HD2      HIS  80   4.542  -1.244  -9.648
    7    HE1  HIS  80           HE1      HIS  80   7.517   1.429 -11.003
    8    HE2  HIS  80           HE2      HIS  80   7.062  -0.962 -10.271

  No H/Q in entry =           8
  In of MODEL    6
    1    H    LEU  81           H        LEU  81   0.204   1.505  -8.921
    2    HA   LEU  81           HA       LEU  81  -0.116   4.295  -8.605
    3    HB2  LEU  81           HB2      LEU  81  -2.096   2.019  -8.525
    4    HB3  LEU  81           HB3      LEU  81  -2.575   3.715  -8.444
    5    HG   LEU  81           HG       LEU  81  -0.853   2.581 -10.665
    6   HD12  LEU  81          HD11      LEU  81  -3.083   2.859 -11.978
    7   HD11  LEU  81          HD12      LEU  81  -3.846   2.787 -10.390
    8   HD13  LEU  81          HD13      LEU  81  -2.878   1.431 -10.965
    9   HD23  LEU  81          HD21      LEU  81  -1.978   4.703 -11.779
   10   HD22  LEU  81          HD22      LEU  81  -0.570   4.901 -10.739
   11   HD21  LEU  81          HD23      LEU  81  -2.183   5.227 -10.109

  No H/Q in entry =          11
  In of MODEL    6
    1    H    MET  82           H        MET  82  -0.745   1.609  -6.346
    2    HA   MET  82           HA       MET  82  -1.833   3.187  -4.272
    3    HB2  MET  82           HB2      MET  82  -0.416   0.523  -4.292
    4    HB3  MET  82           HB3      MET  82  -1.014   1.245  -2.800
    5    HG2  MET  82           HG2      MET  82  -2.726   0.713  -5.248
    6    HG3  MET  82           HG3      MET  82  -2.638  -0.353  -3.848
    7    HE3  MET  82           HE1      MET  82  -4.402   1.281  -1.049
    8    HE2  MET  82           HE2      MET  82  -2.676   1.586  -1.226
    9    HE1  MET  82           HE3      MET  82  -3.336   0.016  -1.677

  No H/Q in entry =           9
  In of MODEL    6
    1    H    THR  83           H        THR  83   1.488   2.152  -4.939
    2    HA   THR  83           HA       THR  83   2.675   3.287  -2.638
    3    HB   THR  83           HB       THR  83   4.779   3.259  -4.100
    4    HG1  THR  83           HG1      THR  83   4.559   2.719  -6.123
    5   HG22  THR  83          HG21      THR  83   4.380   0.592  -4.422
    6   HG21  THR  83          HG22      THR  83   3.078   0.956  -3.291
    7   HG23  THR  83          HG23      THR  83   4.750   1.329  -2.864

  No H/Q in entry =           7
  In of MODEL    6
    1    H    SER  84           H        SER  84   2.302   4.545  -5.946
    2    HA   SER  84           HA       SER  84   3.599   7.009  -5.495
    3    HB2  SER  84           HB2      SER  84   1.553   6.133  -7.521
    4    HB3  SER  84           HB3      SER  84   2.205   7.772  -7.500
    5    HG   SER  84           HG       SER  84   3.619   5.318  -7.773

  No H/Q in entry =           5
  In of MODEL    6
    1    H    MET  85           H        MET  85   0.117   6.196  -5.338
    2    HA   MET  85           HA       MET  85  -0.790   8.795  -4.754
    3    HB2  MET  85           HB2      MET  85  -2.281   6.962  -5.422
    4    HB3  MET  85           HB3      MET  85  -1.985   6.162  -3.879
    5    HG2  MET  85           HG2      MET  85  -2.912   8.107  -2.682
    6    HG3  MET  85           HG3      MET  85  -3.186   8.926  -4.219
    7    HE2  MET  85           HE1      MET  85  -6.767   8.314  -3.447
    8    HE1  MET  85           HE2      MET  85  -5.353   9.339  -3.211
    9    HE3  MET  85           HE3      MET  85  -5.775   8.138  -1.994

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LEU  86           H        LEU  86   0.161   6.157  -2.593
    2    HA   LEU  86           HA       LEU  86  -0.406   7.463  -0.160
    3    HB2  LEU  86           HB2      LEU  86   0.099   4.998  -0.540
    4    HB3  LEU  86           HB3      LEU  86   1.799   5.453  -0.628
    5    HG   LEU  86           HG       LEU  86   1.445   6.619   1.633
    6   HD11  LEU  86          HD11      LEU  86  -1.235   5.809   1.151
    7   HD13  LEU  86          HD12      LEU  86  -0.588   6.573   2.602
    8   HD12  LEU  86          HD13      LEU  86  -0.651   4.815   2.490
    9   HD23  LEU  86          HD21      LEU  86   1.062   3.621   1.766
   10   HD22  LEU  86          HD22      LEU  86   2.043   4.651   2.807
   11   HD21  LEU  86          HD23      LEU  86   2.557   4.326   1.152

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ALA  87           H        ALA  87   2.589   7.206  -2.032
    2    HA   ALA  87           HA       ALA  87   4.264   8.649  -0.305
    3    HB3  ALA  87           HB1      ALA  87   4.388   7.626  -3.007
    4    HB2  ALA  87           HB2      ALA  87   5.712   7.981  -1.901
    5    HB1  ALA  87           HB3      ALA  87   5.084   9.248  -2.954

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ARG  88           H        ARG  88   2.314   9.744  -3.040
    2    HA   ARG  88           HA       ARG  88   3.048  12.445  -2.931
    3    HB2  ARG  88           HB2      ARG  88   1.821  11.266  -4.790
    4    HB3  ARG  88           HB3      ARG  88   0.357  11.393  -3.815
    5    HG2  ARG  88           HG2      ARG  88   1.338  13.988  -3.738
    6    HG3  ARG  88           HG3      ARG  88   1.778  13.473  -5.364
    7    HD2  ARG  88           HD2      ARG  88  -0.361  13.519  -6.073
    8    HD3  ARG  88           HD3      ARG  88  -0.942  12.664  -4.644
    9    HE   ARG  88           HE       ARG  88  -1.169  15.437  -5.074
   10   HH21  ARG  88          HH11      ARG  88  -1.725  16.766  -3.345
   11   HH22  ARG  88          HH12      ARG  88  -1.429  16.240  -1.724
   12   HH11  ARG  88          HH21      ARG  88  -0.134  13.199  -2.686
   13   HH12  ARG  88          HH22      ARG  88  -0.546  14.214  -1.351

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLU  89           H        GLU  89   0.361  10.740  -1.298
    2    HA   GLU  89           HA       GLU  89  -0.785  13.041  -0.108
    3    HB2  GLU  89           HB2      GLU  89  -1.871  10.786  -0.191
    4    HB3  GLU  89           HB3      GLU  89  -0.746  10.251   1.058
    5    HG2  GLU  89           HG2      GLU  89  -1.597  11.945   2.606
    6    HG3  GLU  89           HG3      GLU  89  -2.653  12.596   1.354

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LEU  90           H        LEU  90   1.692  10.787   1.088
    2    HA   LEU  90           HA       LEU  90   2.018  12.047   3.614
    3    HB2  LEU  90           HB2      LEU  90   3.823  10.290   1.953
    4    HB3  LEU  90           HB3      LEU  90   4.227  10.819   3.591
    5    HG   LEU  90           HG       LEU  90   1.614   9.435   2.923
    6   HD12  LEU  90          HD11      LEU  90   2.777   7.409   3.945
    7   HD11  LEU  90          HD12      LEU  90   4.288   8.284   3.707
    8   HD13  LEU  90          HD13      LEU  90   3.289   7.858   2.317
    9   HD22  LEU  90          HD21      LEU  90   1.327  10.364   5.039
   10   HD21  LEU  90          HD22      LEU  90   3.044  10.281   5.430
   11   HD23  LEU  90          HD23      LEU  90   2.057   8.821   5.480

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  91           H        ILE  91   3.632  12.438   0.493
    2    HA   ILE  91           HA       ILE  91   5.580  14.298   1.335
    3    HB   ILE  91           HB       ILE  91   4.288  13.780  -1.350
    4   HG12  ILE  91          HG12      ILE  91   7.122  13.334  -0.360
    5   HG13  ILE  91          HG13      ILE  91   5.855  12.120  -0.199
    6   HG22  ILE  91          HG21      ILE  91   6.497  15.153  -2.033
    7   HG21  ILE  91          HG22      ILE  91   6.169  15.956  -0.496
    8   HG23  ILE  91          HG23      ILE  91   4.952  15.963  -1.771
    9   HD13  ILE  91          HD11      ILE  91   5.697  11.785  -2.505
   10   HD12  ILE  91          HD12      ILE  91   7.427  12.051  -2.284
   11   HD11  ILE  91          HD13      ILE  91   6.403  13.359  -2.881

  No H/Q in entry =          11
  In of MODEL    6
    1    H    THR  92           H        THR  92   2.218  14.684   0.309
    2    HA   THR  92           HA       THR  92   2.156  17.506   0.237
    3    HB   THR  92           HB       THR  92   0.011  15.487   0.933
    4    HG1  THR  92           HG1      THR  92   0.328  15.304  -1.149
    5   HG22  THR  92          HG21      THR  92  -1.414  17.628   0.196
    6   HG21  THR  92          HG22      THR  92  -0.036  18.473   0.896
    7   HG23  THR  92          HG23      THR  92  -0.968  17.344   1.878

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLU  93           H        GLU  93   1.624  15.210   2.897
    2    HA   GLU  93           HA       GLU  93   1.058  17.115   4.905
    3    HB2  GLU  93           HB2      GLU  93   2.404  14.408   5.159
    4    HB3  GLU  93           HB3      GLU  93   1.695  15.331   6.484
    5    HG2  GLU  93           HG2      GLU  93   0.105  14.523   4.041
    6    HG3  GLU  93           HG3      GLU  93   0.212  13.508   5.474

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LEU  94           H        LEU  94   4.089  15.666   3.776
    2    HA   LEU  94           HA       LEU  94   5.815  16.843   5.668
    3    HB2  LEU  94           HB2      LEU  94   6.243  15.870   2.843
    4    HB3  LEU  94           HB3      LEU  94   7.559  16.548   3.796
    5    HG   LEU  94           HG       LEU  94   5.842  14.335   4.932
    6   HD11  LEU  94          HD11      LEU  94   7.950  14.126   2.811
    7   HD13  LEU  94          HD12      LEU  94   6.515  13.136   3.070
    8   HD12  LEU  94          HD13      LEU  94   7.939  12.905   4.085
    9   HD23  LEU  94          HD21      LEU  94   8.032  13.830   6.097
   10   HD22  LEU  94          HD22      LEU  94   7.344  15.402   6.504
   11   HD21  LEU  94          HD23      LEU  94   8.689  15.293   5.368

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  95           H        ILE  95   4.677  17.988   2.508
    2    HA   ILE  95           HA       ILE  95   6.220  20.364   2.446
    3    HB   ILE  95           HB       ILE  95   3.591  19.642   1.131
    4   HG12  ILE  95          HG12      ILE  95   6.380  20.010   0.006
    5   HG13  ILE  95          HG13      ILE  95   5.748  18.451   0.524
    6   HG21  ILE  95          HG21      ILE  95   5.310  22.130   0.909
    7   HG23  ILE  95          HG22      ILE  95   3.584  22.042   1.257
    8   HG22  ILE  95          HG23      ILE  95   4.180  21.643  -0.354
    9   HD13  ILE  95          HD11      ILE  95   4.198  18.348  -1.212
   10   HD12  ILE  95          HD12      ILE  95   5.540  19.180  -1.997
   11   HD11  ILE  95          HD13      ILE  95   4.153  20.100  -1.415

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLU  96           H        GLU  96   2.973  19.677   3.728
    2    HA   GLU  96           HA       GLU  96   2.316  22.319   4.466
    3    HB2  GLU  96           HB2      GLU  96   0.664  20.515   4.477
    4    HB3  GLU  96           HB3      GLU  96   1.529  19.704   5.779
    5    HG2  GLU  96           HG2      GLU  96   0.485  20.981   7.339
    6    HG3  GLU  96           HG3      GLU  96   1.006  22.458   6.538

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LEU  97           H        LEU  97   4.182  19.798   6.110
    2    HA   LEU  97           HA       LEU  97   4.511  21.160   8.577
    3    HB2  LEU  97           HB2      LEU  97   6.081  19.005   7.179
    4    HB3  LEU  97           HB3      LEU  97   6.655  19.703   8.691
    5    HG   LEU  97           HG       LEU  97   3.861  18.574   8.371
    6   HD12  LEU  97          HD11      LEU  97   4.819  16.578   9.597
    7   HD11  LEU  97          HD12      LEU  97   6.424  17.227   9.258
    8   HD13  LEU  97          HD13      LEU  97   5.367  16.751   7.929
    9   HD23  LEU  97          HD21      LEU  97   4.305  18.295  10.939
   10   HD22  LEU  97          HD22      LEU  97   3.908  19.900  10.326
   11   HD21  LEU  97          HD23      LEU  97   5.583  19.482  10.681

  No H/Q in entry =          11
  In of MODEL    6
    1    H    HIS  98           H        HIS  98   6.396  21.187   5.561
    2    HA   HIS  98           HA       HIS  98   8.526  22.796   6.464
    3    HB2  HIS  98           HB2      HIS  98   7.250  22.514   3.733
    4    HB3  HIS  98           HB3      HIS  98   8.676  23.511   4.027
    5    HD1  HIS  98           HD1      HIS  98   7.508  19.926   4.055
    6    HD2  HIS  98           HD2      HIS  98  11.061  22.067   4.489
    7    HE1  HIS  98           HE1      HIS  98   9.383  18.219   4.014
    8    HE2  HIS  98           HE2      HIS  98  11.551  19.502   4.279

  No H/Q in entry =           8
  In of MODEL    6
    1    H    GLU  99           H        GLU  99   5.301  23.588   5.270
    2    HA   GLU  99           HA       GLU  99   5.648  26.407   5.202
    3    HB2  GLU  99           HB2      GLU  99   3.788  25.211   4.067
    4    HB3  GLU  99           HB3      GLU  99   3.088  24.848   5.644
    5    HG2  GLU  99           HG2      GLU  99   2.878  27.239   6.135
    6    HG3  GLU  99           HG3      GLU  99   3.657  27.642   4.608

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LYS 100           H        LYS 100   4.531  24.168   7.727
    2    HA   LYS 100           HA       LYS 100   3.911  26.223   9.610
    3    HB2  LYS 100           HB2      LYS 100   4.519  23.280   9.971
    4    HB3  LYS 100           HB3      LYS 100   4.052  24.353  11.296
    5    HG2  LYS 100           HG2      LYS 100   1.985  24.961  10.036
    6    HG3  LYS 100           HG3      LYS 100   2.432  23.793   8.790
    7    HD2  LYS 100           HD2      LYS 100   2.367  21.977  10.458
    8    HD3  LYS 100           HD3      LYS 100   1.938  23.140  11.715
    9    HE2  LYS 100           HE2      LYS 100  -0.116  23.733  10.439
   10    HE3  LYS 100           HE3      LYS 100   0.304  22.513   9.231
   11    HZ1  LYS 100           HZ1      LYS 100   0.031  21.855  12.113
   12    HZ3  LYS 100           HZ2      LYS 100   0.035  20.795  10.782
   13    HZ2  LYS 100           HZ3      LYS 100  -1.294  21.821  11.051

  No H/Q in entry =          13
  In of MODEL    6
    1    H    LEU 101           H        LEU 101   6.859  24.458   8.798
    2    HA   LEU 101           HA       LEU 101   8.437  25.325  11.006
    3    HB2  LEU 101           HB2      LEU 101   9.056  24.334   8.235
    4    HB3  LEU 101           HB3      LEU 101  10.346  25.018   9.220
    5    HG   LEU 101           HG       LEU 101   8.533  22.845  10.283
    6   HD12  LEU 101          HD11      LEU 101  10.607  21.371   9.691
    7   HD11  LEU 101          HD12      LEU 101  10.965  22.633   8.515
    8   HD13  LEU 101          HD13      LEU 101   9.447  21.743   8.417
    9   HD21  LEU 101          HD21      LEU 101  11.241  23.987  11.020
   10   HD23  LEU 101          HD22      LEU 101  10.712  22.410  11.603
   11   HD22  LEU 101          HD23      LEU 101   9.802  23.858  12.031

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LYS 102           H        LYS 102   6.843  27.162   8.850
    2    HA   LYS 102           HA       LYS 102   6.897  29.454   8.549
    3    HB2  LYS 102           HB2      LYS 102   8.452  29.365  10.656
    4    HB3  LYS 102           HB3      LYS 102   9.755  29.569   9.502
    5    HG2  LYS 102           HG2      LYS 102   7.624  31.502  10.346
    6    HG3  LYS 102           HG3      LYS 102   9.334  31.780  10.102
    7    HD2  LYS 102           HD2      LYS 102   7.400  31.326   7.794
    8    HD3  LYS 102           HD3      LYS 102   7.762  32.912   8.458
    9    HE2  LYS 102           HE2      LYS 102   9.158  31.735   6.396
   10    HE3  LYS 102           HE3      LYS 102   9.755  33.052   7.405
   11    HZ2  LYS 102           HZ1      LYS 102  11.297  31.164   7.245
   12    HZ1  LYS 102           HZ2      LYS 102  10.142  30.172   7.986
   13    HZ3  LYS 102           HZ3      LYS 102  10.816  31.470   8.843

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ALA 103           H        ALA 103  10.171  28.149   8.006
    2    HA   ALA 103           HA       ALA 103  11.130  29.528   5.930
    3    HB2  ALA 103           HB1      ALA 103  12.044  27.320   5.015
    4    HB1  ALA 103           HB2      ALA 103  11.151  26.541   6.320
    5    HB3  ALA 103           HB3      ALA 103  12.426  27.701   6.695

  No H/Q in entry =           5
  In of MODEL    6
    1    H1   LYS   3           H1       LYS   3 -30.978   6.608 -19.578
    2    H2   LYS   3           H3       LYS   3 -30.006   6.299 -20.936
    3    H3   LYS   3           H2       LYS   3 -31.422   5.398 -20.684
    4    HA   LYS   3           HA       LYS   3 -30.446   3.978 -19.291
    5    HB2  LYS   3           HB2      LYS   3 -28.138   5.338 -20.633
    6    HB3  LYS   3           HB3      LYS   3 -27.836   4.117 -19.397
    7    HG2  LYS   3           HG2      LYS   3 -29.307   2.572 -20.744
    8    HG3  LYS   3           HG3      LYS   3 -29.239   3.776 -22.030
    9    HD2  LYS   3           HD2      LYS   3 -26.760   3.600 -21.996
   10    HD3  LYS   3           HD3      LYS   3 -26.904   2.300 -20.814
   11    HE2  LYS   3           HE2      LYS   3 -28.443   1.170 -22.525
   12    HE3  LYS   3           HE3      LYS   3 -27.801   2.335 -23.680
   13    HZ3  LYS   3           HZ1      LYS   3 -26.036   1.063 -23.966
   14    HZ2  LYS   3           HZ2      LYS   3 -26.689  -0.093 -22.907
   15    HZ1  LYS   3           HZ3      LYS   3 -25.664   1.122 -22.311

  No H/Q in entry =          15
  In of MODEL    6
    1    H    LYS   4           H        LYS   4 -30.490   3.830 -17.230
    2    HA   LYS   4           HA       LYS   4 -29.690   6.090 -15.576
    3    HB2  LYS   4           HB2      LYS   4 -30.956   3.427 -14.879
    4    HB3  LYS   4           HB3      LYS   4 -30.692   4.754 -13.749
    5    HG2  LYS   4           HG2      LYS   4 -32.517   4.749 -16.159
    6    HG3  LYS   4           HG3      LYS   4 -32.995   4.806 -14.464
    7    HD2  LYS   4           HD2      LYS   4 -32.239   7.007 -14.193
    8    HD3  LYS   4           HD3      LYS   4 -31.211   6.927 -15.623
    9    HE2  LYS   4           HE2      LYS   4 -33.103   8.354 -16.067
   10    HE3  LYS   4           HE3      LYS   4 -33.228   6.888 -17.041
   11    HZ3  LYS   4           HZ1      LYS   4 -34.817   6.012 -15.487
   12    HZ2  LYS   4           HZ2      LYS   4 -35.336   7.524 -16.061
   13    HZ1  LYS   4           HZ3      LYS   4 -34.672   7.389 -14.505

  No H/Q in entry =          13
  In of MODEL    6
    1    H    HIS   5           H        HIS   5 -28.209   6.129 -13.994
    2    HA   HIS   5           HA       HIS   5 -25.979   4.240 -14.348
    3    HB2  HIS   5           HB2      HIS   5 -26.150   6.996 -13.129
    4    HB3  HIS   5           HB3      HIS   5 -24.695   6.001 -13.125
    5    HD1  HIS   5           HD1      HIS   5 -23.203   7.165 -14.720
    6    HD2  HIS   5           HD2      HIS   5 -27.030   6.656 -16.251
    7    HE1  HIS   5           HE1      HIS   5 -23.036   7.751 -17.170
    8    HE2  HIS   5           HE2      HIS   5 -25.368   7.428 -18.071

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ILE   6           H        ILE   6 -25.785   2.656 -13.039
    2    HA   ILE   6           HA       ILE   6 -26.735   2.940 -10.267
    3    HB   ILE   6           HB       ILE   6 -25.990   0.457 -11.819
    4   HG12  ILE   6          HG12      ILE   6 -28.700   1.467 -10.946
    5   HG13  ILE   6          HG13      ILE   6 -28.063   1.617 -12.584
    6   HG23  ILE   6          HG21      ILE   6 -26.385  -0.791  -9.961
    7   HG22  ILE   6          HG22      ILE   6 -27.506   0.385  -9.270
    8   HG21  ILE   6          HG23      ILE   6 -25.767   0.671  -9.191
    9   HD13  ILE   6          HD11      ILE   6 -28.586  -0.486 -13.089
   10   HD12  ILE   6          HD12      ILE   6 -29.591  -0.446 -11.640
   11   HD11  ILE   6          HD13      ILE   6 -27.955  -1.101 -11.561

  No H/Q in entry =          11
  In of MODEL    6
    1    H    TYR   7           H        TYR   7 -24.950   3.526  -8.989
    2    HA   TYR   7           HA       TYR   7 -22.271   2.495  -9.690
    3    HB2  TYR   7           HB2      TYR   7 -23.155   4.949  -8.195
    4    HB3  TYR   7           HB3      TYR   7 -21.487   4.387  -8.245
    5    HD1  TYR   7           HD1      TYR   7 -22.574   3.487 -11.333
    6    HD2  TYR   7           HD2      TYR   7 -21.787   7.029  -9.098
    7    HE1  TYR   7           HE1      TYR   7 -22.120   4.711 -13.421
    8    HE2  TYR   7           HE2      TYR   7 -21.375   8.261 -11.178
    9    HH   TYR   7           HH       TYR   7 -21.611   8.189 -13.409

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LEU   8           H        LEU   8 -21.336   1.110  -8.373
    2    HA   LEU   8           HA       LEU   8 -22.463   0.637  -5.684
    3    HB2  LEU   8           HB2      LEU   8 -20.821  -1.067  -7.535
    4    HB3  LEU   8           HB3      LEU   8 -21.007  -1.450  -5.825
    5    HG   LEU   8           HG       LEU   8 -23.493  -1.549  -6.231
    6   HD13  LEU   8          HD11      LEU   8 -23.603  -0.322  -8.335
    7   HD12  LEU   8          HD12      LEU   8 -24.181  -1.969  -8.578
    8   HD11  LEU   8          HD13      LEU   8 -22.564  -1.515  -9.111
    9   HD23  LEU   8          HD21      LEU   8 -22.289  -3.619  -7.940
   10   HD22  LEU   8          HD22      LEU   8 -23.372  -3.761  -6.556
   11   HD21  LEU   8          HD23      LEU   8 -21.654  -3.458  -6.304

  No H/Q in entry =          11
  In of MODEL    6
    1    H    PHE   9           H        PHE   9 -21.164   0.987  -3.901
    2    HA   PHE   9           HA       PHE   9 -18.360   1.852  -4.436
    3    HB2  PHE   9           HB2      PHE   9 -20.347   2.943  -2.452
    4    HB3  PHE   9           HB3      PHE   9 -18.623   3.278  -2.374
    5    HD1  PHE   9           HD1      PHE   9 -17.505   4.548  -4.163
    6    HD2  PHE   9           HD2      PHE   9 -21.753   3.943  -4.166
    7    HE1  PHE   9           HE1      PHE   9 -17.756   6.316  -5.879
    8    HE2  PHE   9           HE2      PHE   9 -22.004   5.723  -5.876
    9    HZ   PHE   9           HZ       PHE   9 -20.003   6.905  -6.739

  No H/Q in entry =           9
  In of MODEL    6
    1    H    SER  10           H        SER  10 -16.788   0.818  -3.394
    2    HA   SER  10           HA       SER  10 -16.968  -0.128  -0.713
    3    HB2  SER  10           HB2      SER  10 -17.020  -2.449  -1.001
    4    HB3  SER  10           HB3      SER  10 -18.226  -1.882  -2.144
    5    HG   SER  10           HG       SER  10 -16.198  -3.375  -2.676

  No H/Q in entry =           5
  In of MODEL    6
    1    H    SER  11           H        SER  11 -14.949   0.001   0.079
    2    HA   SER  11           HA       SER  11 -12.776   0.827  -1.472
    3    HB2  SER  11           HB2      SER  11 -11.472   0.644   0.513
    4    HB3  SER  11           HB3      SER  11 -13.097   1.129   1.002
    5    HG   SER  11           HG       SER  11 -13.244  -1.418   1.003

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA  12           H        ALA  12 -14.018  -1.872  -2.252
    2    HA   ALA  12           HA       ALA  12 -11.454  -3.125  -2.841
    3    HB3  ALA  12           HB1      ALA  12 -12.211  -4.206  -0.728
    4    HB2  ALA  12           HB2      ALA  12 -12.091  -5.333  -2.078
    5    HB1  ALA  12           HB3      ALA  12 -13.670  -4.741  -1.566

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLY  13           H        GLY  13 -12.174  -2.162  -4.873
    2    HA3  GLY  13           HA2      GLY  13 -14.464  -2.745  -6.309
    3    HA2  GLY  13           HA3      GLY  13 -12.899  -2.394  -7.057

  No H/Q in entry =           3
  In of MODEL    6
    1    H    MET  14           H        MET  14 -11.470  -4.730  -6.228
    2    HA   MET  14           HA       MET  14 -12.075  -6.464  -8.296
    3    HB2  MET  14           HB2      MET  14  -9.944  -6.630  -7.097
    4    HB3  MET  14           HB3      MET  14 -10.763  -7.286  -5.681
    5    HG2  MET  14           HG2      MET  14 -11.504  -9.229  -7.036
    6    HG3  MET  14           HG3      MET  14 -10.659  -8.567  -8.436
    7    HE3  MET  14           HE1      MET  14  -7.065  -8.864  -7.883
    8    HE2  MET  14           HE2      MET  14  -7.798  -7.427  -7.175
    9    HE1  MET  14           HE3      MET  14  -8.443  -8.086  -8.675

  No H/Q in entry =           9
  In of MODEL    6
    1    H    SER  15           H        SER  15 -13.165  -6.883  -4.919
    2    HA   SER  15           HA       SER  15 -14.618  -9.288  -5.564
    3    HB2  SER  15           HB2      SER  15 -14.765  -7.502  -3.126
    4    HB3  SER  15           HB3      SER  15 -15.792  -8.915  -3.350
    5    HG   SER  15           HG       SER  15 -13.995 -10.213  -3.398

  No H/Q in entry =           5
  In of MODEL    6
    1    H    THR  16           H        THR  16 -15.606  -5.870  -5.114
    2    HA   THR  16           HA       THR  16 -18.412  -6.318  -5.591
    3    HB   THR  16           HB       THR  16 -16.818  -3.786  -6.117
    4    HG1  THR  16           HG1      THR  16 -17.853  -3.519  -3.820
    5   HG21  THR  16          HG21      THR  16 -19.163  -3.832  -6.921
    6   HG23  THR  16          HG22      THR  16 -18.949  -2.683  -5.589
    7   HG22  THR  16          HG23      THR  16 -19.693  -4.262  -5.300

  No H/Q in entry =           7
  In of MODEL    6
    1    H    SER  17           H        SER  17 -15.613  -5.811  -7.480
    2    HA   SER  17           HA       SER  17 -16.733  -5.030  -9.973
    3    HB2  SER  17           HB2      SER  17 -14.139  -6.430  -9.293
    4    HB3  SER  17           HB3      SER  17 -14.577  -5.967 -10.938
    5    HG   SER  17           HG       SER  17 -13.633  -4.449  -8.892

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU  18           H        LEU  18 -16.245  -8.195  -8.539
    2    HA   LEU  18           HA       LEU  18 -16.886  -9.669 -10.896
    3    HB2  LEU  18           HB2      LEU  18 -15.684 -10.688  -9.024
    4    HB3  LEU  18           HB3      LEU  18 -17.078 -10.428  -7.976
    5    HG   LEU  18           HG       LEU  18 -18.406 -11.900  -9.516
    6   HD11  LEU  18          HD11      LEU  18 -15.668 -12.217 -10.736
    7   HD13  LEU  18          HD12      LEU  18 -17.189 -11.836 -11.542
    8   HD12  LEU  18          HD13      LEU  18 -16.911 -13.454 -10.904
    9   HD21  LEU  18          HD21      LEU  18 -16.008 -13.012  -8.097
   10   HD23  LEU  18          HD22      LEU  18 -17.354 -13.988  -8.692
   11   HD22  LEU  18          HD23      LEU  18 -17.633 -12.764  -7.452

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LEU  19           H        LEU  19 -18.806  -8.417  -8.171
    2    HA   LEU  19           HA       LEU  19 -21.305  -9.529  -8.993
    3    HB2  LEU  19           HB2      LEU  19 -20.974  -8.698  -6.737
    4    HB3  LEU  19           HB3      LEU  19 -20.696  -7.071  -7.356
    5    HG   LEU  19           HG       LEU  19 -23.017  -6.852  -7.968
    6   HD13  LEU  19          HD11      LEU  19 -23.832  -8.900  -8.657
    7   HD12  LEU  19          HD12      LEU  19 -24.524  -8.805  -7.038
    8   HD11  LEU  19          HD13      LEU  19 -23.074  -9.767  -7.321
    9   HD22  LEU  19          HD21      LEU  19 -22.501  -6.201  -5.751
   10   HD21  LEU  19          HD22      LEU  19 -22.520  -7.870  -5.184
   11   HD23  LEU  19          HD23      LEU  19 -24.022  -7.091  -5.682

  No H/Q in entry =          11
  In of MODEL    6
    1    H    VAL  20           H        VAL  20 -19.726  -6.408  -9.686
    2    HA   VAL  20           HA       VAL  20 -21.817  -5.302 -11.239
    3    HB   VAL  20           HB       VAL  20 -18.813  -4.794 -11.367
    4   HG13  VAL  20          HG11      VAL  20 -19.616  -4.163 -13.524
    5   HG12  VAL  20          HG12      VAL  20 -19.520  -2.672 -12.587
    6   HG11  VAL  20          HG13      VAL  20 -21.080  -3.451 -12.847
    7   HG22  VAL  20          HG21      VAL  20 -19.614  -4.002  -9.325
    8   HG21  VAL  20          HG22      VAL  20 -21.122  -3.429 -10.034
    9   HG23  VAL  20          HG23      VAL  20 -19.614  -2.581 -10.371

  No H/Q in entry =           9
  In of MODEL    6
    1    H    SER  21           H        SER  21 -19.122  -7.426 -12.288
    2    HA   SER  21           HA       SER  21 -19.918  -7.282 -15.035
    3    HB2  SER  21           HB2      SER  21 -18.540  -9.289 -15.381
    4    HB3  SER  21           HB3      SER  21 -17.671  -8.068 -14.456
    5    HG   SER  21           HG       SER  21 -17.666  -9.314 -12.774

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LYS  22           H        LYS  22 -21.030  -9.447 -12.464
    2    HA   LYS  22           HA       LYS  22 -22.623 -11.016 -14.283
    3    HB2  LYS  22           HB2      LYS  22 -21.845 -11.676 -11.919
    4    HB3  LYS  22           HB3      LYS  22 -23.197 -10.699 -11.352
    5    HG2  LYS  22           HG2      LYS  22 -24.028 -12.876 -11.365
    6    HG3  LYS  22           HG3      LYS  22 -24.658 -12.167 -12.851
    7    HD2  LYS  22           HD2      LYS  22 -22.927 -13.270 -14.150
    8    HD3  LYS  22           HD3      LYS  22 -22.204 -13.916 -12.677
    9    HE2  LYS  22           HE2      LYS  22 -25.000 -14.558 -13.636
   10    HE3  LYS  22           HE3      LYS  22 -23.589 -15.575 -13.924
   11    HZ2  LYS  22           HZ1      LYS  22 -25.242 -15.888 -11.878
   12    HZ1  LYS  22           HZ2      LYS  22 -24.093 -14.863 -11.160
   13    HZ3  LYS  22           HZ3      LYS  22 -23.607 -16.343 -11.837

  No H/Q in entry =          13
  In of MODEL    6
    1    H    MET  23           H        MET  23 -23.253  -8.082 -12.401
    2    HA   MET  23           HA       MET  23 -26.064  -8.077 -12.892
    3    HB2  MET  23           HB2      MET  23 -24.148  -5.826 -12.321
    4    HB3  MET  23           HB3      MET  23 -25.889  -5.605 -12.490
    5    HG2  MET  23           HG2      MET  23 -26.308  -6.904 -10.523
    6    HG3  MET  23           HG3      MET  23 -24.609  -7.365 -10.408
    7    HE2  MET  23           HE1      MET  23 -26.794  -3.654  -9.193
    8    HE1  MET  23           HE2      MET  23 -27.084  -4.608 -10.646
    9    HE3  MET  23           HE3      MET  23 -26.008  -3.212 -10.710

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ARG  24           H        ARG  24 -23.279  -6.723 -14.686
    2    HA   ARG  24           HA       ARG  24 -24.749  -5.371 -16.672
    3    HB2  ARG  24           HB2      ARG  24 -22.293  -5.049 -16.299
    4    HB3  ARG  24           HB3      ARG  24 -22.008  -6.650 -16.937
    5    HG2  ARG  24           HG2      ARG  24 -22.811  -5.965 -19.172
    6    HG3  ARG  24           HG3      ARG  24 -23.215  -4.352 -18.527
    7    HD2  ARG  24           HD2      ARG  24 -21.030  -4.178 -19.560
    8    HD3  ARG  24           HD3      ARG  24 -20.811  -4.146 -17.815
    9    HE   ARG  24           HE       ARG  24 -20.451  -6.750 -18.421
   10   HH21  ARG  24          HH11      ARG  24 -18.435  -7.232 -17.552
   11   HH22  ARG  24          HH12      ARG  24 -17.055  -6.301 -18.022
   12   HH11  ARG  24          HH21      ARG  24 -19.086  -3.917 -19.670
   13   HH12  ARG  24          HH22      ARG  24 -17.450  -4.347 -19.282

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ALA  25           H        ALA  25 -23.726  -8.743 -16.416
    2    HA   ALA  25           HA       ALA  25 -24.393  -9.544 -19.052
    3    HB1  ALA  25           HB1      ALA  25 -23.755 -11.599 -18.369
    4    HB3  ALA  25           HB2      ALA  25 -24.804 -11.552 -16.952
    5    HB2  ALA  25           HB3      ALA  25 -23.224 -10.773 -16.904

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLN  26           H        GLN  26 -26.204  -9.540 -16.020
    2    HA   GLN  26           HA       GLN  26 -28.589 -10.666 -17.029
    3    HB2  GLN  26           HB2      GLN  26 -28.010  -8.946 -14.637
    4    HB3  GLN  26           HB3      GLN  26 -29.596  -9.620 -14.982
    5    HG2  GLN  26           HG2      GLN  26 -27.054 -11.157 -14.534
    6    HG3  GLN  26           HG3      GLN  26 -28.405 -11.017 -13.415
    7   HE21  GLN  26          HE21      GLN  26 -27.262 -13.213 -14.708
    8   HE22  GLN  26          HE22      GLN  26 -28.339 -14.224 -15.504

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ALA  27           H        ALA  27 -27.548  -7.300 -16.627
    2    HA   ALA  27           HA       ALA  27 -30.007  -6.129 -17.393
    3    HB1  ALA  27           HB1      ALA  27 -28.152  -4.875 -16.281
    4    HB3  ALA  27           HB2      ALA  27 -28.726  -4.084 -17.751
    5    HB2  ALA  27           HB3      ALA  27 -27.219  -4.997 -17.773

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLU  28           H        GLU  28 -27.355  -7.425 -19.282
    2    HA   GLU  28           HA       GLU  28 -28.270  -6.344 -21.791
    3    HB2  GLU  28           HB2      GLU  28 -25.910  -7.104 -21.183
    4    HB3  GLU  28           HB3      GLU  28 -26.507  -8.749 -21.390
    5    HG2  GLU  28           HG2      GLU  28 -25.347  -7.998 -23.361
    6    HG3  GLU  28           HG3      GLU  28 -27.055  -8.267 -23.702

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LYS  29           H        LYS  29 -28.523  -9.452 -20.149
    2    HA   LYS  29           HA       LYS  29 -29.882 -10.871 -22.154
    3    HB2  LYS  29           HB2      LYS  29 -28.853 -11.896 -20.161
    4    HB3  LYS  29           HB3      LYS  29 -30.097 -11.156 -19.155
    5    HG2  LYS  29           HG2      LYS  29 -31.804 -12.471 -20.222
    6    HG3  LYS  29           HG3      LYS  29 -30.631 -13.137 -21.356
    7    HD2  LYS  29           HD2      LYS  29 -29.517 -14.347 -19.635
    8    HD3  LYS  29           HD3      LYS  29 -30.392 -13.486 -18.370
    9    HE2  LYS  29           HE2      LYS  29 -31.217 -15.808 -18.740
   10    HE3  LYS  29           HE3      LYS  29 -32.459 -14.575 -18.972
   11    HZ1  LYS  29           HZ1      LYS  29 -31.911 -14.713 -21.403
   12    HZ3  LYS  29           HZ2      LYS  29 -32.670 -16.081 -20.740
   13    HZ2  LYS  29           HZ3      LYS  29 -31.001 -16.103 -21.047

  No H/Q in entry =          13
  In of MODEL    6
    1    H    TYR  30           H        TYR  30 -31.195  -8.737 -19.632
    2    HA   TYR  30           HA       TYR  30 -33.877  -9.097 -20.862
    3    HB2  TYR  30           HB2      TYR  30 -33.175  -7.979 -18.139
    4    HB3  TYR  30           HB3      TYR  30 -34.803  -8.183 -18.784
    5    HD1  TYR  30           HD1      TYR  30 -35.784 -10.445 -19.006
    6    HD2  TYR  30           HD2      TYR  30 -31.921  -9.851 -17.318
    7    HE1  TYR  30           HE1      TYR  30 -35.762 -12.779 -18.222
    8    HE2  TYR  30           HE2      TYR  30 -31.899 -12.170 -16.538
    9    HH   TYR  30           HH       TYR  30 -33.616 -14.473 -17.635

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLU  31           H        GLU  31 -31.655  -7.169 -21.663
    2    HA   GLU  31           HA       GLU  31 -31.519  -5.010 -22.475
    3    HB2  GLU  31           HB2      GLU  31 -34.437  -5.634 -22.976
    4    HB3  GLU  31           HB3      GLU  31 -33.559  -4.289 -23.703
    5    HG2  GLU  31           HG2      GLU  31 -32.137  -5.765 -24.909
    6    HG3  GLU  31           HG3      GLU  31 -32.740  -7.166 -24.025

  No H/Q in entry =           6
  In of MODEL    6
    1    H    VAL  32           H        VAL  32 -31.701  -4.918 -19.741
    2    HA   VAL  32           HA       VAL  32 -33.496  -2.754 -19.061
    3    HB   VAL  32           HB       VAL  32 -31.127  -3.827 -17.498
    4   HG12  VAL  32          HG11      VAL  32 -32.627  -2.969 -15.590
    5   HG11  VAL  32          HG12      VAL  32 -33.439  -2.033 -16.845
    6   HG13  VAL  32          HG13      VAL  32 -31.722  -1.782 -16.532
    7   HG21  VAL  32          HG21      VAL  32 -32.949  -5.490 -18.187
    8   HG23  VAL  32          HG22      VAL  32 -33.958  -4.639 -17.016
    9   HG22  VAL  32          HG23      VAL  32 -32.461  -5.410 -16.494

  No H/Q in entry =           9
  In of MODEL    6
    1    HA   PRO  33           HA       PRO  33 -30.386   0.093 -20.734
    2    HB2  PRO  33           HB2      PRO  33 -31.832   2.358 -20.590
    3    HB3  PRO  33           HB3      PRO  33 -32.344   1.077 -21.689
    4    HG2  PRO  33           HG2      PRO  33 -33.283   1.606 -18.868
    5    HG3  PRO  33           HG3      PRO  33 -34.259   1.434 -20.326
    6    HD2  PRO  33           HD2      PRO  33 -33.856  -0.661 -18.675
    7    HD3  PRO  33           HD3      PRO  33 -33.934  -0.890 -20.422

  No H/Q in entry =           7
  In of MODEL    6
    1    H    VAL  34           H        VAL  34 -29.129  -0.499 -18.794
    2    HA   VAL  34           HA       VAL  34 -28.767   1.908 -17.135
    3    HB   VAL  34           HB       VAL  34 -28.219   0.418 -15.209
    4   HG12  VAL  34          HG11      VAL  34 -30.654  -0.386 -14.894
    5   HG11  VAL  34          HG12      VAL  34 -30.956   0.392 -16.446
    6   HG13  VAL  34          HG13      VAL  34 -30.368   1.343 -15.082
    7   HG21  VAL  34          HG21      VAL  34 -28.473  -1.590 -17.227
    8   HG23  VAL  34          HG22      VAL  34 -29.533  -1.928 -15.858
    9   HG22  VAL  34          HG23      VAL  34 -27.806  -1.693 -15.598

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ILE  35           H        ILE  35 -26.775   2.280 -16.303
    2    HA   ILE  35           HA       ILE  35 -24.516   0.892 -17.586
    3    HB   ILE  35           HB       ILE  35 -24.829   3.788 -16.756
    4   HG12  ILE  35          HG12      ILE  35 -23.898   2.468 -19.313
    5   HG13  ILE  35          HG13      ILE  35 -25.507   3.134 -19.042
    6   HG21  ILE  35          HG21      ILE  35 -22.313   2.185 -17.087
    7   HG23  ILE  35          HG22      ILE  35 -22.727   3.369 -15.849
    8   HG22  ILE  35          HG23      ILE  35 -22.339   3.901 -17.485
    9   HD11  ILE  35          HD11      ILE  35 -24.041   5.284 -18.435
   10   HD13  ILE  35          HD12      ILE  35 -24.597   4.926 -20.071
   11   HD12  ILE  35          HD13      ILE  35 -22.954   4.507 -19.586

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ILE  36           H        ILE  36 -23.306  -0.175 -15.999
    2    HA   ILE  36           HA       ILE  36 -23.714   0.436 -13.122
    3    HB   ILE  36           HB       ILE  36 -22.970  -2.283 -14.251
    4   HG12  ILE  36          HG12      ILE  36 -25.750  -1.402 -13.467
    5   HG13  ILE  36          HG13      ILE  36 -25.186  -1.388 -15.138
    6   HG23  ILE  36          HG21      ILE  36 -23.334  -3.114 -12.140
    7   HG22  ILE  36          HG22      ILE  36 -24.422  -1.802 -11.688
    8   HG21  ILE  36          HG23      ILE  36 -22.683  -1.519 -11.766
    9   HD13  ILE  36          HD11      ILE  36 -25.416  -3.595 -15.356
   10   HD12  ILE  36          HD12      ILE  36 -26.470  -3.452 -13.951
   11   HD11  ILE  36          HD13      ILE  36 -24.783  -3.921 -13.744

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLU  37           H        GLU  37 -21.910   1.008 -12.024
    2    HA   GLU  37           HA       GLU  37 -19.249   0.140 -12.959
    3    HB2  GLU  37           HB2      GLU  37 -20.076   2.951 -12.254
    4    HB3  GLU  37           HB3      GLU  37 -18.398   2.419 -12.363
    5    HG2  GLU  37           HG2      GLU  37 -18.659   1.982 -14.721
    6    HG3  GLU  37           HG3      GLU  37 -20.364   2.422 -14.634

  No H/Q in entry =           6
  In of MODEL    6
    1    H    ALA  38           H        ALA  38 -17.760  -0.149 -11.286
    2    HA   ALA  38           HA       ALA  38 -18.772   0.043  -8.509
    3    HB1  ALA  38           HB1      ALA  38 -17.119  -1.935  -9.955
    4    HB3  ALA  38           HB2      ALA  38 -18.168  -2.149  -8.553
    5    HB2  ALA  38           HB3      ALA  38 -16.536  -1.514  -8.344

  No H/Q in entry =           5
  In of MODEL    6
    1    H    PHE  39           H        PHE  39 -17.490   1.209  -7.035
    2    HA   PHE  39           HA       PHE  39 -14.939   2.346  -7.938
    3    HB2  PHE  39           HB2      PHE  39 -17.304   3.894  -6.899
    4    HB3  PHE  39           HB3      PHE  39 -15.657   4.517  -6.819
    5    HD1  PHE  39           HD1      PHE  39 -14.355   4.500  -9.084
    6    HD2  PHE  39           HD2      PHE  39 -18.602   4.401  -8.715
    7    HE1  PHE  39           HE1      PHE  39 -14.564   5.391 -11.386
    8    HE2  PHE  39           HE2      PHE  39 -18.826   5.284 -11.010
    9    HZ   PHE  39           HZ       PHE  39 -16.814   5.754 -12.365

  No H/Q in entry =           9
  In of MODEL    6
    1    HA   PRO  40           HA       PRO  40 -13.998   1.543  -3.662
    2    HB2  PRO  40           HB2      PRO  40 -12.174   3.506  -3.053
    3    HB3  PRO  40           HB3      PRO  40 -11.772   2.170  -4.132
    4    HG2  PRO  40           HG2      PRO  40 -12.731   4.936  -4.855
    5    HG3  PRO  40           HG3      PRO  40 -11.328   4.065  -5.473
    6    HD2  PRO  40           HD2      PRO  40 -13.559   4.037  -6.874
    7    HD3  PRO  40           HD3      PRO  40 -12.640   2.544  -6.693

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLU  41           H        GLU  41 -14.582   2.525  -1.523
    2    HA   GLU  41           HA       GLU  41 -16.781   4.285  -1.484
    3    HB2  GLU  41           HB2      GLU  41 -16.539   4.264   0.927
    4    HB3  GLU  41           HB3      GLU  41 -16.295   2.637   0.289
    5    HG2  GLU  41           HG2      GLU  41 -14.613   2.736   1.831
    6    HG3  GLU  41           HG3      GLU  41 -13.764   3.301   0.393

  No H/Q in entry =           6
  In of MODEL    6
    1    H    THR  42           H        THR  42 -13.428   5.116  -1.549
    2    HA   THR  42           HA       THR  42 -13.708   7.677  -0.321
    3    HB   THR  42           HB       THR  42 -11.541   8.202  -1.394
    4    HG1  THR  42           HG1      THR  42 -10.858   5.953  -2.479
    5   HG23  THR  42          HG21      THR  42 -10.238   6.551  -0.253
    6   HG22  THR  42          HG22      THR  42 -11.525   5.351  -0.389
    7   HG21  THR  42          HG23      THR  42 -11.724   6.741   0.677

  No H/Q in entry =           7
  In of MODEL    6
    1    H    LEU  43           H        LEU  43 -14.656   6.625  -3.422
    2    HA   LEU  43           HA       LEU  43 -14.844   9.409  -4.376
    3    HB2  LEU  43           HB2      LEU  43 -15.245   6.767  -5.767
    4    HB3  LEU  43           HB3      LEU  43 -15.489   8.341  -6.523
    5    HG   LEU  43           HG       LEU  43 -12.840   7.296  -5.552
    6   HD13  LEU  43          HD11      LEU  43 -12.333   6.692  -7.737
    7   HD12  LEU  43          HD12      LEU  43 -13.630   7.676  -8.414
    8   HD11  LEU  43          HD13      LEU  43 -14.012   6.170  -7.581
    9   HD22  LEU  43          HD21      LEU  43 -12.724   9.636  -5.517
   10   HD21  LEU  43          HD22      LEU  43 -13.754   9.802  -6.939
   11   HD23  LEU  43          HD23      LEU  43 -12.100   9.216  -7.112

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ALA  44           H        ALA  44 -16.826   7.623  -2.521
    2    HA   ALA  44           HA       ALA  44 -19.314   7.553  -3.831
    3    HB2  ALA  44           HB1      ALA  44 -19.192   6.422  -1.742
    4    HB3  ALA  44           HB2      ALA  44 -20.263   7.793  -1.455
    5    HB1  ALA  44           HB3      ALA  44 -18.587   7.855  -0.912

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLY  45           H        GLY  45 -17.814  10.308  -2.291
    2    HA3  GLY  45           HA2      GLY  45 -20.214  11.871  -2.631
    3    HA2  GLY  45           HA3      GLY  45 -18.652  12.453  -2.058

  No H/Q in entry =           3
  In of MODEL    6
    1    H    GLU  46           H        GLU  46 -17.157  11.491  -4.362
    2    HA   GLU  46           HA       GLU  46 -17.747  13.731  -6.116
    3    HB2  GLU  46           HB2      GLU  46 -15.608  11.597  -6.168
    4    HB3  GLU  46           HB3      GLU  46 -15.709  12.931  -7.317
    5    HG2  GLU  46           HG2      GLU  46 -14.134  13.683  -5.819
    6    HG3  GLU  46           HG3      GLU  46 -15.613  14.433  -5.220

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LYS  47           H        LYS  47 -17.719  10.213  -6.571
    2    HA   LYS  47           HA       LYS  47 -18.826  10.475  -9.238
    3    HB2  LYS  47           HB2      LYS  47 -17.739   8.320  -7.558
    4    HB3  LYS  47           HB3      LYS  47 -19.092   7.839  -8.581
    5    HG2  LYS  47           HG2      LYS  47 -16.957   7.413  -9.661
    6    HG3  LYS  47           HG3      LYS  47 -17.899   8.613 -10.545
    7    HD2  LYS  47           HD2      LYS  47 -16.599  10.404  -9.621
    8    HD3  LYS  47           HD3      LYS  47 -15.754   9.295  -8.543
    9    HE2  LYS  47           HE2      LYS  47 -14.307   9.788 -10.377
   10    HE3  LYS  47           HE3      LYS  47 -14.869   8.127 -10.559
   11    HZ1  LYS  47           HZ1      LYS  47 -16.492  10.161 -11.829
   12    HZ3  LYS  47           HZ2      LYS  47 -16.031   8.625 -12.387
   13    HZ2  LYS  47           HZ3      LYS  47 -14.948   9.929 -12.498

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLY  48           H        GLY  48 -20.151   9.735  -6.088
    2    HA3  GLY  48           HA2      GLY  48 -22.569   8.615  -6.821
    3    HA2  GLY  48           HA3      GLY  48 -22.311   9.595  -5.378

  No H/Q in entry =           3
  In of MODEL    6
    1    H    GLN  49           H        GLN  49 -21.675  12.011  -6.940
    2    HA   GLN  49           HA       GLN  49 -24.206  13.188  -7.064
    3    HB2  GLN  49           HB2      GLN  49 -21.649  13.995  -8.433
    4    HB3  GLN  49           HB3      GLN  49 -23.084  14.996  -8.336
    5    HG2  GLN  49           HG2      GLN  49 -22.911  15.003  -5.900
    6    HG3  GLN  49           HG3      GLN  49 -21.489  13.980  -5.995
    7   HE21  GLN  49          HE21      GLN  49 -21.308  16.198  -4.712
    8   HE22  GLN  49          HE22      GLN  49 -20.357  17.433  -5.358

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ASN  50           H        ASN  50 -22.588  11.279  -9.470
    2    HA   ASN  50           HA       ASN  50 -24.459  12.210 -11.537
    3    HB2  ASN  50           HB2      ASN  50 -21.921  10.606 -11.793
    4    HB3  ASN  50           HB3      ASN  50 -22.967  11.066 -13.129
    5   HD21  ASN  50          HD21      ASN  50 -20.301  11.835 -11.528
    6   HD22  ASN  50          HD22      ASN  50 -20.028  13.466 -11.862

  No H/Q in entry =           6
  In of MODEL    6
    1    H    ALA  51           H        ALA  51 -24.493   9.843  -9.304
    2    HA   ALA  51           HA       ALA  51 -25.343   7.729 -11.137
    3    HB2  ALA  51           HB1      ALA  51 -24.786   6.355  -9.462
    4    HB3  ALA  51           HB2      ALA  51 -25.881   7.187  -8.358
    5    HB1  ALA  51           HB3      ALA  51 -24.228   7.766  -8.562

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ASP  52           H        ASP  52 -27.375   6.725 -10.991
    2    HA   ASP  52           HA       ASP  52 -29.503   8.611 -10.305
    3    HB2  ASP  52           HB2      ASP  52 -29.388   6.112 -11.989
    4    HB3  ASP  52           HB3      ASP  52 -30.910   6.882 -11.542

  No H/Q in entry =           4
  In of MODEL    6
    1    H    VAL  53           H        VAL  53 -27.974   5.676  -9.313
    2    HA   VAL  53           HA       VAL  53 -29.397   5.827  -6.788
    3    HB   VAL  53           HB       VAL  53 -30.846   4.230  -8.033
    4   HG11  VAL  53          HG11      VAL  53 -29.131   3.332  -9.570
    5   HG13  VAL  53          HG12      VAL  53 -29.994   2.056  -8.713
    6   HG12  VAL  53          HG13      VAL  53 -28.368   2.512  -8.208
    7   HG23  VAL  53          HG21      VAL  53 -30.068   2.223  -6.356
    8   HG22  VAL  53          HG22      VAL  53 -31.159   3.555  -5.976
    9   HG21  VAL  53          HG23      VAL  53 -29.447   3.679  -5.578

  No H/Q in entry =           9
  In of MODEL    6
    1    H    VAL  54           H        VAL  54 -28.087   5.350  -5.143
    2    HA   VAL  54           HA       VAL  54 -25.354   4.430  -5.774
    3    HB   VAL  54           HB       VAL  54 -26.364   6.224  -3.509
    4   HG11  VAL  54          HG11      VAL  54 -23.826   4.737  -3.822
    5   HG13  VAL  54          HG12      VAL  54 -24.552   5.428  -2.372
    6   HG12  VAL  54          HG13      VAL  54 -23.625   6.453  -3.468
    7   HG22  VAL  54          HG21      VAL  54 -25.462   8.020  -4.604
    8   HG21  VAL  54          HG22      VAL  54 -26.043   7.053  -5.958
    9   HG23  VAL  54          HG23      VAL  54 -24.334   7.029  -5.529

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LEU  55           H        LEU  55 -24.812   2.489  -5.145
    2    HA   LEU  55           HA       LEU  55 -26.343   1.208  -2.968
    3    HB2  LEU  55           HB2      LEU  55 -24.831   0.011  -5.278
    4    HB3  LEU  55           HB3      LEU  55 -25.610  -0.909  -3.990
    5    HG   LEU  55           HG       LEU  55 -27.015   0.729  -6.091
    6   HD13  LEU  55          HD11      LEU  55 -26.772  -1.125  -7.322
    7   HD12  LEU  55          HD12      LEU  55 -27.746  -1.979  -6.126
    8   HD11  LEU  55          HD13      LEU  55 -25.989  -1.964  -5.985
    9   HD23  LEU  55          HD21      LEU  55 -28.351  -1.192  -4.239
   10   HD22  LEU  55          HD22      LEU  55 -29.014   0.214  -5.075
   11   HD21  LEU  55          HD23      LEU  55 -27.979   0.434  -3.664

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LEU  56           H        LEU  56 -25.198   0.573  -1.172
    2    HA   LEU  56           HA       LEU  56 -22.255   0.888  -1.237
    3    HB2  LEU  56           HB2      LEU  56 -24.049   0.714   1.171
    4    HB3  LEU  56           HB3      LEU  56 -22.329   1.096   1.153
    5    HG   LEU  56           HG       LEU  56 -24.586   2.842   0.210
    6   HD11  LEU  56          HD11      LEU  56 -23.467   2.416   2.723
    7   HD13  LEU  56          HD12      LEU  56 -24.423   3.815   2.230
    8   HD12  LEU  56          HD13      LEU  56 -22.664   3.871   2.133
    9   HD23  LEU  56          HD21      LEU  56 -22.595   4.487   0.015
   10   HD22  LEU  56          HD22      LEU  56 -23.016   3.408  -1.315
   11   HD21  LEU  56          HD23      LEU  56 -21.667   3.013  -0.252

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLY  57           H        GLY  57 -20.917  -0.783  -0.718
    2    HA3  GLY  57           HA2      GLY  57 -21.913  -3.442  -0.926
    3    HA2  GLY  57           HA3      GLY  57 -20.276  -2.994  -0.450

  No H/Q in entry =           3
  In of MODEL    6
    1    HA   PRO  58           HA       PRO  58 -23.093  -3.975   3.269
    2    HB2  PRO  58           HB2      PRO  58 -22.479  -6.601   3.858
    3    HB3  PRO  58           HB3      PRO  58 -23.857  -6.149   2.854
    4    HG2  PRO  58           HG2      PRO  58 -21.159  -7.102   2.048
    5    HG3  PRO  58           HG3      PRO  58 -22.739  -7.514   1.383
    6    HD2  PRO  58           HD2      PRO  58 -21.087  -5.736   0.160
    7    HD3  PRO  58           HD3      PRO  58 -22.844  -5.600   0.069

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLN  59           H        GLN  59 -19.741  -4.539   2.641
    2    HA   GLN  59           HA       GLN  59 -18.972  -4.592   5.397
    3    HB2  GLN  59           HB2      GLN  59 -17.198  -3.526   3.224
    4    HB3  GLN  59           HB3      GLN  59 -16.757  -4.391   4.681
    5    HG2  GLN  59           HG2      GLN  59 -16.408  -5.867   2.870
    6    HG3  GLN  59           HG3      GLN  59 -17.861  -6.419   3.688
    7   HE21  GLN  59          HE21      GLN  59 -18.754  -7.225   2.105
    8   HE22  GLN  59          HE22      GLN  59 -19.456  -6.787   0.662

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ILE  60           H        ILE  60 -19.845  -2.004   3.206
    2    HA   ILE  60           HA       ILE  60 -18.927  -0.083   5.258
    3    HB   ILE  60           HB       ILE  60 -19.128   1.662   3.437
    4   HG12  ILE  60          HG12      ILE  60 -19.005  -0.585   1.463
    5   HG13  ILE  60          HG13      ILE  60 -20.565   0.043   1.997
    6   HG22  ILE  60          HG21      ILE  60 -17.154  -0.370   2.556
    7   HG21  ILE  60          HG22      ILE  60 -17.035   0.327   4.170
    8   HG23  ILE  60          HG23      ILE  60 -16.976   1.372   2.752
    9   HD13  ILE  60          HD11      ILE  60 -20.203   1.326   0.108
   10   HD12  ILE  60          HD12      ILE  60 -18.455   1.364   0.341
   11   HD11  ILE  60          HD13      ILE  60 -19.500   2.367   1.346

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ALA  61           H        ALA  61 -21.425  -1.598   5.332
    2    HA   ALA  61           HA       ALA  61 -23.606   0.131   4.894
    3    HB1  ALA  61           HB1      ALA  61 -24.856  -1.331   6.220
    4    HB2  ALA  61           HB2      ALA  61 -23.464  -1.765   7.212
    5    HB3  ALA  61           HB3      ALA  61 -23.586  -2.360   5.556

  No H/Q in entry =           5
  In of MODEL    6
    1    H    TYR  62           H        TYR  62 -21.387  -0.058   7.679
    2    HA   TYR  62           HA       TYR  62 -22.886   1.633   9.367
    3    HB2  TYR  62           HB2      TYR  62 -20.822   1.999  10.587
    4    HB3  TYR  62           HB3      TYR  62 -20.940   0.301  10.125
    5    HD1  TYR  62           HD1      TYR  62 -19.421  -0.643   8.421
    6    HD2  TYR  62           HD2      TYR  62 -19.052   3.424   9.682
    7    HE1  TYR  62           HE1      TYR  62 -17.210  -0.511   7.336
    8    HE2  TYR  62           HE2      TYR  62 -16.828   3.549   8.599
    9    HH   TYR  62           HH       TYR  62 -15.008   1.368   7.955

  No H/Q in entry =           9
  In of MODEL    6
    1    H    MET  63           H        MET  63 -21.235   2.460   6.505
    2    HA   MET  63           HA       MET  63 -20.983   5.283   7.213
    3    HB2  MET  63           HB2      MET  63 -20.434   3.756   4.667
    4    HB3  MET  63           HB3      MET  63 -20.191   5.494   4.855
    5    HG2  MET  63           HG2      MET  63 -18.479   5.096   6.517
    6    HG3  MET  63           HG3      MET  63 -18.743   3.358   6.396
    7    HE2  MET  63           HE1      MET  63 -16.619   6.243   3.869
    8    HE1  MET  63           HE2      MET  63 -18.140   6.499   4.724
    9    HE3  MET  63           HE3      MET  63 -18.153   6.022   3.025

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LEU  64           H        LEU  64 -23.605   3.508   6.254
    2    HA   LEU  64           HA       LEU  64 -24.786   4.972   4.190
    3    HB2  LEU  64           HB2      LEU  64 -25.709   2.887   5.102
    4    HB3  LEU  64           HB3      LEU  64 -26.133   3.734   6.589
    5    HG   LEU  64           HG       LEU  64 -27.798   5.044   5.377
    6   HD13  LEU  64          HD11      LEU  64 -27.521   5.289   3.144
    7   HD12  LEU  64          HD12      LEU  64 -28.215   3.674   2.994
    8   HD11  LEU  64          HD13      LEU  64 -26.464   3.882   3.043
    9   HD23  LEU  64          HD21      LEU  64 -28.402   2.252   4.618
   10   HD22  LEU  64          HD22      LEU  64 -29.351   3.410   5.550
   11   HD21  LEU  64          HD23      LEU  64 -27.996   2.572   6.304

  No H/Q in entry =          11
  In of MODEL    6
    1    HA   PRO  65           HA       PRO  65 -26.856   8.174   6.969
    2    HB2  PRO  65           HB2      PRO  65 -24.838   8.261   9.213
    3    HB3  PRO  65           HB3      PRO  65 -26.568   8.594   9.271
    4    HG2  PRO  65           HG2      PRO  65 -25.700   6.307  10.180
    5    HG3  PRO  65           HG3      PRO  65 -27.126   6.322   9.144
    6    HD2  PRO  65           HD2      PRO  65 -24.278   5.626   8.420
    7    HD3  PRO  65           HD3      PRO  65 -25.764   4.786   7.977

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLU  66           H        GLU  66 -23.303   8.012   7.021
    2    HA   GLU  66           HA       GLU  66 -22.924  10.802   6.629
    3    HB2  GLU  66           HB2      GLU  66 -21.185   8.445   5.955
    4    HB3  GLU  66           HB3      GLU  66 -20.686  10.124   5.753
    5    HG2  GLU  66           HG2      GLU  66 -20.872  10.488   8.123
    6    HG3  GLU  66           HG3      GLU  66 -21.446   8.837   8.349

  No H/Q in entry =           6
  In of MODEL    6
    1    H    ILE  67           H        ILE  67 -23.122   8.073   4.364
    2    HA   ILE  67           HA       ILE  67 -22.667   9.780   2.076
    3    HB   ILE  67           HB       ILE  67 -23.654   6.900   2.247
    4   HG12  ILE  67          HG12      ILE  67 -20.994   7.994   1.315
    5   HG13  ILE  67          HG13      ILE  67 -21.292   7.575   3.000
    6   HG21  ILE  67          HG21      ILE  67 -23.552   8.788   0.031
    7   HG23  ILE  67          HG22      ILE  67 -24.227   7.160   0.077
    8   HG22  ILE  67          HG23      ILE  67 -22.513   7.393  -0.261
    9   HD12  ILE  67          HD11      ILE  67 -20.941   5.803   0.639
   10   HD11  ILE  67          HD12      ILE  67 -21.965   5.255   1.965
   11   HD13  ILE  67          HD13      ILE  67 -20.276   5.667   2.267

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLN  68           H        GLN  68 -25.559   8.807   3.722
    2    HA   GLN  68           HA       GLN  68 -27.370   9.805   1.764
    3    HB2  GLN  68           HB2      GLN  68 -27.619   9.440   4.747
    4    HB3  GLN  68           HB3      GLN  68 -28.925  10.081   3.764
    5    HG2  GLN  68           HG2      GLN  68 -29.025   8.059   2.479
    6    HG3  GLN  68           HG3      GLN  68 -27.590   7.434   3.269
    7   HE21  GLN  68          HE21      GLN  68 -29.811   6.146   3.141
    8   HE22  GLN  68          HE22      GLN  68 -30.646   5.709   4.559

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ARG  69           H        ARG  69 -25.696  11.405   4.500
    2    HA   ARG  69           HA       ARG  69 -26.981  13.932   4.115
    3    HB2  ARG  69           HB2      ARG  69 -24.658  12.918   5.684
    4    HB3  ARG  69           HB3      ARG  69 -24.684  14.641   5.335
    5    HG2  ARG  69           HG2      ARG  69 -26.992  14.754   6.322
    6    HG3  ARG  69           HG3      ARG  69 -26.836  13.056   6.785
    7    HD2  ARG  69           HD2      ARG  69 -25.061  15.349   7.701
    8    HD3  ARG  69           HD3      ARG  69 -26.213  14.475   8.697
    9    HE   ARG  69           HE       ARG  69 -23.639  13.464   7.726
   10   HH21  ARG  69          HH11      ARG  69 -22.881  11.669   8.908
   11   HH22  ARG  69          HH12      ARG  69 -23.929  10.881  10.039
   12   HH11  ARG  69          HH21      ARG  69 -26.601  13.005   9.440
   13   HH12  ARG  69          HH22      ARG  69 -26.036  11.635  10.338

  No H/Q in entry =          13
  In of MODEL    6
    1    H    LEU  70           H        LEU  70 -24.167  12.439   2.729
    2    HA   LEU  70           HA       LEU  70 -22.983  14.772   1.566
    3    HB2  LEU  70           HB2      LEU  70 -22.062  12.420   2.143
    4    HB3  LEU  70           HB3      LEU  70 -22.702  11.984   0.559
    5    HG   LEU  70           HG       LEU  70 -21.070  13.308  -0.529
    6   HD11  LEU  70          HD11      LEU  70 -20.203  14.109   2.258
    7   HD13  LEU  70          HD12      LEU  70 -20.872  15.172   1.020
    8   HD12  LEU  70          HD13      LEU  70 -19.285  14.439   0.786
    9   HD22  LEU  70          HD21      LEU  70 -19.694  11.543  -0.315
   10   HD21  LEU  70          HD22      LEU  70 -20.629  11.045   1.095
   11   HD23  LEU  70          HD23      LEU  70 -19.207  12.069   1.297

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LEU  71           H        LEU  71 -25.227  12.309   0.452
    2    HA   LEU  71           HA       LEU  71 -25.718  13.827  -2.053
    3    HB2  LEU  71           HB2      LEU  71 -26.022  10.850  -1.621
    4    HB3  LEU  71           HB3      LEU  71 -26.131  11.722  -3.149
    5    HG   LEU  71           HG       LEU  71 -23.601  11.640  -1.504
    6   HD12  LEU  71          HD11      LEU  71 -23.726  10.028  -3.944
    7   HD11  LEU  71          HD12      LEU  71 -24.749   9.432  -2.638
    8   HD13  LEU  71          HD13      LEU  71 -23.019   9.651  -2.373
    9   HD22  LEU  71          HD21      LEU  71 -23.651  13.467  -2.988
   10   HD21  LEU  71          HD22      LEU  71 -24.193  12.449  -4.322
   11   HD23  LEU  71          HD23      LEU  71 -22.573  12.243  -3.656

  No H/Q in entry =          11
  In of MODEL    6
    1    HA   PRO  72           HA       PRO  72 -29.580  13.499   0.592
    2    HB2  PRO  72           HB2      PRO  72 -30.347  16.089   0.530
    3    HB3  PRO  72           HB3      PRO  72 -29.047  15.585   1.610
    4    HG2  PRO  72           HG2      PRO  72 -28.837  16.788  -1.139
    5    HG3  PRO  72           HG3      PRO  72 -28.042  17.304   0.348
    6    HD2  PRO  72           HD2      PRO  72 -26.773  15.708  -1.435
    7    HD3  PRO  72           HD3      PRO  72 -26.512  15.523   0.299

  No H/Q in entry =           7
  In of MODEL    6
    1    H    ASN  73           H        ASN  73 -28.944  14.450  -2.622
    2    HA   ASN  73           HA       ASN  73 -31.817  14.247  -3.237
    3    HB2  ASN  73           HB2      ASN  73 -31.326  15.347  -5.331
    4    HB3  ASN  73           HB3      ASN  73 -30.759  16.300  -3.968
    5   HD21  ASN  73          HD21      ASN  73 -29.980  16.331  -6.651
    6   HD22  ASN  73          HD22      ASN  73 -28.320  16.111  -6.855

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LYS  74           H        LYS  74 -29.917  11.918  -2.837
    2    HA   LYS  74           HA       LYS  74 -30.552  10.559  -5.389
    3    HB2  LYS  74           HB2      LYS  74 -28.022  10.166  -3.786
    4    HB3  LYS  74           HB3      LYS  74 -28.444   9.377  -5.306
    5    HG2  LYS  74           HG2      LYS  74 -28.069  12.334  -5.090
    6    HG3  LYS  74           HG3      LYS  74 -26.737  11.223  -5.408
    7    HD2  LYS  74           HD2      LYS  74 -27.900  10.347  -7.350
    8    HD3  LYS  74           HD3      LYS  74 -29.280  11.394  -7.015
    9    HE2  LYS  74           HE2      LYS  74 -27.984  13.357  -7.455
   10    HE3  LYS  74           HE3      LYS  74 -26.498  12.412  -7.561
   11    HZ2  LYS  74           HZ1      LYS  74 -27.958  13.079  -9.673
   12    HZ1  LYS  74           HZ2      LYS  74 -28.667  11.581  -9.304
   13    HZ3  LYS  74           HZ3      LYS  74 -26.999  11.680  -9.611

  No H/Q in entry =          13
  In of MODEL    6
    1    HA   PRO  75           HA       PRO  75 -32.037   7.613  -2.424
    2    HB2  PRO  75           HB2      PRO  75 -32.441   5.416  -4.015
    3    HB3  PRO  75           HB3      PRO  75 -33.515   6.812  -4.071
    4    HG2  PRO  75           HG2      PRO  75 -31.213   6.138  -5.860
    5    HG3  PRO  75           HG3      PRO  75 -32.847   6.639  -6.294
    6    HD2  PRO  75           HD2      PRO  75 -30.836   8.430  -6.254
    7    HD3  PRO  75           HD3      PRO  75 -32.448   8.887  -5.703

  No H/Q in entry =           7
  In of MODEL    6
    1    H    VAL  76           H        VAL  76 -30.617   6.496  -1.066
    2    HA   VAL  76           HA       VAL  76 -28.206   5.201  -2.195
    3    HB   VAL  76           HB       VAL  76 -28.421   6.663   0.471
    4   HG11  VAL  76          HG11      VAL  76 -26.124   5.295  -0.942
    5   HG13  VAL  76          HG12      VAL  76 -26.828   4.863   0.619
    6   HG12  VAL  76          HG13      VAL  76 -25.926   6.368   0.445
    7   HG22  VAL  76          HG21      VAL  76 -27.688   8.541  -0.410
    8   HG21  VAL  76          HG22      VAL  76 -28.266   7.875  -1.938
    9   HG23  VAL  76          HG23      VAL  76 -26.566   7.720  -1.495

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLU  77           H        GLU  77 -28.067   3.037  -1.594
    2    HA   GLU  77           HA       GLU  77 -28.866   2.266   1.061
    3    HB2  GLU  77           HB2      GLU  77 -30.538   0.683   0.533
    4    HB3  GLU  77           HB3      GLU  77 -31.033   2.229  -0.159
    5    HG2  GLU  77           HG2      GLU  77 -30.467   1.460  -2.353
    6    HG3  GLU  77           HG3      GLU  77 -29.877  -0.063  -1.693

  No H/Q in entry =           6
  In of MODEL    6
    1    H    VAL  78           H        VAL  78 -28.613   0.164   1.708
    2    HA   VAL  78           HA       VAL  78 -25.984  -0.701   0.799
    3    HB   VAL  78           HB       VAL  78 -27.709  -1.533   3.171
    4   HG11  VAL  78          HG11      VAL  78 -25.424  -2.842   2.026
    5   HG13  VAL  78          HG12      VAL  78 -26.341  -3.287   3.467
    6   HG12  VAL  78          HG13      VAL  78 -24.977  -2.176   3.595
    7   HG22  VAL  78          HG21      VAL  78 -26.192  -0.233   4.507
    8   HG21  VAL  78          HG22      VAL  78 -26.899   0.770   3.241
    9   HG23  VAL  78          HG23      VAL  78 -25.245   0.181   3.078

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ILE  79           H        ILE  79 -25.523  -2.624  -0.119
    2    HA   ILE  79           HA       ILE  79 -27.647  -4.017  -1.460
    3    HB   ILE  79           HB       ILE  79 -24.676  -4.657  -1.261
    4   HG12  ILE  79          HG12      ILE  79 -26.284  -3.480  -3.534
    5   HG13  ILE  79          HG13      ILE  79 -25.366  -2.509  -2.381
    6   HG22  ILE  79          HG21      ILE  79 -25.836  -5.782  -3.578
    7   HG21  ILE  79          HG22      ILE  79 -26.831  -6.274  -2.207
    8   HG23  ILE  79          HG23      ILE  79 -25.101  -6.617  -2.209
    9   HD13  ILE  79          HD11      ILE  79 -23.969  -2.667  -4.209
   10   HD12  ILE  79          HD12      ILE  79 -24.374  -4.360  -4.496
   11   HD11  ILE  79          HD13      ILE  79 -23.363  -3.915  -3.119

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ASP  80           H        ASP  80 -28.579  -5.909  -0.880
    2    HA   ASP  80           HA       ASP  80 -28.543  -6.824   1.761
    3    HB2  ASP  80           HB2      ASP  80 -30.327  -7.327   0.130
    4    HB3  ASP  80           HB3      ASP  80 -29.213  -8.372  -0.751

  No H/Q in entry =           4
  In of MODEL    6
    1    H    SER  81           H        SER  81 -27.044  -8.021   2.877
    2    HA   SER  81           HA       SER  81 -24.582  -8.790   1.666
    3    HB2  SER  81           HB2      SER  81 -24.057  -9.850   3.827
    4    HB3  SER  81           HB3      SER  81 -24.696  -8.221   4.051
    5    HG   SER  81           HG       SER  81 -25.586  -9.816   5.462

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU  82           H        LEU  82 -27.367 -10.780   1.995
    2    HA   LEU  82           HA       LEU  82 -25.912 -13.202   1.455
    3    HB2  LEU  82           HB2      LEU  82 -28.824 -12.475   1.222
    4    HB3  LEU  82           HB3      LEU  82 -28.184 -14.101   0.997
    5    HG   LEU  82           HG       LEU  82 -28.048 -12.541   3.559
    6   HD13  LEU  82          HD11      LEU  82 -29.810 -14.023   4.330
    7   HD12  LEU  82          HD12      LEU  82 -29.815 -14.872   2.782
    8   HD11  LEU  82          HD13      LEU  82 -30.358 -13.195   2.871
    9   HD21  LEU  82          HD21      LEU  82 -27.178 -15.262   2.631
   10   HD23  LEU  82          HD22      LEU  82 -27.531 -14.954   4.331
   11   HD22  LEU  82          HD23      LEU  82 -26.255 -14.048   3.519

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LEU  83           H        LEU  83 -27.797 -10.896  -0.443
    2    HA   LEU  83           HA       LEU  83 -27.663 -12.249  -2.921
    3    HB2  LEU  83           HB2      LEU  83 -27.960  -9.332  -2.258
    4    HB3  LEU  83           HB3      LEU  83 -28.026  -9.967  -3.901
    5    HG   LEU  83           HG       LEU  83 -30.059 -10.288  -1.713
    6   HD13  LEU  83          HD11      LEU  83 -30.752  -8.408  -2.765
    7   HD12  LEU  83          HD12      LEU  83 -31.264  -9.498  -4.052
    8   HD11  LEU  83          HD13      LEU  83 -29.699  -8.690  -4.150
    9   HD23  LEU  83          HD21      LEU  83 -30.262 -11.528  -4.443
   10   HD22  LEU  83          HD22      LEU  83 -31.235 -11.847  -3.008
   11   HD21  LEU  83          HD23      LEU  83 -29.567 -12.414  -3.085

  No H/Q in entry =          11
  In of MODEL    6
    1    H    TYR  84           H        TYR  84 -25.611  -9.946  -1.246
    2    HA   TYR  84           HA       TYR  84 -23.745  -9.520  -3.386
    3    HB2  TYR  84           HB2      TYR  84 -24.199  -8.031  -1.346
    4    HB3  TYR  84           HB3      TYR  84 -23.200  -9.168  -0.443
    5    HD1  TYR  84           HD1      TYR  84 -20.843  -9.044  -0.518
    6    HD2  TYR  84           HD2      TYR  84 -23.164  -6.786  -3.302
    7    HE1  TYR  84           HE1      TYR  84 -18.795  -7.871  -1.256
    8    HE2  TYR  84           HE2      TYR  84 -21.125  -5.614  -4.057
    9    HH   TYR  84           HH       TYR  84 -18.116  -6.655  -3.541

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLY  85           H        GLY  85 -23.563 -11.542  -0.450
    2    HA3  GLY  85           HA2      GLY  85 -21.025 -12.580  -0.953
    3    HA2  GLY  85           HA3      GLY  85 -22.280 -13.384  -0.011

  No H/Q in entry =           3
  In of MODEL    6
    1    H    LYS  86           H        LYS  86 -24.153 -13.678  -2.062
    2    HA   LYS  86           HA       LYS  86 -23.197 -16.084  -3.337
    3    HB2  LYS  86           HB2      LYS  86 -25.443 -15.786  -2.338
    4    HB3  LYS  86           HB3      LYS  86 -25.796 -14.565  -3.560
    5    HG2  LYS  86           HG2      LYS  86 -25.685 -16.249  -5.287
    6    HG3  LYS  86           HG3      LYS  86 -25.307 -17.474  -4.075
    7    HD2  LYS  86           HD2      LYS  86 -27.410 -16.953  -2.906
    8    HD3  LYS  86           HD3      LYS  86 -27.790 -15.749  -4.136
    9    HE2  LYS  86           HE2      LYS  86 -27.832 -17.494  -5.843
   10    HE3  LYS  86           HE3      LYS  86 -27.426 -18.703  -4.625
   11    HZ3  LYS  86           HZ1      LYS  86 -29.609 -18.899  -4.321
   12    HZ2  LYS  86           HZ2      LYS  86 -29.954 -17.495  -5.213
   13    HZ1  LYS  86           HZ3      LYS  86 -29.563 -17.377  -3.566

  No H/Q in entry =          13
  In of MODEL    6
    1    H    VAL  87           H        VAL  87 -23.070 -12.869  -4.219
    2    HA   VAL  87           HA       VAL  87 -22.740 -11.700  -6.157
    3    HB   VAL  87           HB       VAL  87 -21.793 -14.200  -7.562
    4   HG11  VAL  87          HG11      VAL  87 -21.802 -11.703  -8.414
    5   HG13  VAL  87          HG12      VAL  87 -20.406 -12.734  -8.729
    6   HG12  VAL  87          HG13      VAL  87 -20.361 -11.566  -7.409
    7   HG21  VAL  87          HG21      VAL  87 -20.956 -14.269  -5.189
    8   HG23  VAL  87          HG22      VAL  87 -20.094 -12.772  -5.536
    9   HG22  VAL  87          HG23      VAL  87 -19.712 -14.238  -6.437

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ASP  88           H        ASP  88 -25.275 -12.248  -5.791
    2    HA   ASP  88           HA       ASP  88 -26.458 -13.412  -8.185
    3    HB2  ASP  88           HB2      ASP  88 -27.446 -13.629  -5.856
    4    HB3  ASP  88           HB3      ASP  88 -27.835 -11.912  -5.946

  No H/Q in entry =           4
  In of MODEL    6
    1    H    GLY  89           H        GLY  89 -25.717 -12.174  -9.827
    2    HA3  GLY  89           HA2      GLY  89 -25.797  -9.396 -10.015
    3    HA2  GLY  89           HA3      GLY  89 -25.824 -10.512 -11.381

  No H/Q in entry =           3
  In of MODEL    6
    1    H    LEU  90           H        LEU  90 -28.315 -11.774 -10.921
    2    HA   LEU  90           HA       LEU  90 -30.061  -9.769 -12.014
    3    HB2  LEU  90           HB2      LEU  90 -30.218 -12.158 -12.603
    4    HB3  LEU  90           HB3      LEU  90 -30.726 -12.513 -10.952
    5    HG   LEU  90           HG       LEU  90 -32.805 -11.316 -11.296
    6   HD13  LEU  90          HD11      LEU  90 -32.571  -9.576 -12.766
    7   HD12  LEU  90          HD12      LEU  90 -33.164 -10.789 -13.904
    8   HD11  LEU  90          HD13      LEU  90 -31.435 -10.458 -13.791
    9   HD23  LEU  90          HD21      LEU  90 -32.812 -12.938 -13.739
   10   HD22  LEU  90          HD22      LEU  90 -33.787 -13.072 -12.276
   11   HD21  LEU  90          HD23      LEU  90 -32.156 -13.745 -12.314

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLY  91           H        GLY  91 -29.927 -11.287  -8.837
    2    HA3  GLY  91           HA2      GLY  91 -32.216 -10.094  -7.777
    3    HA2  GLY  91           HA3      GLY  91 -30.838 -10.682  -6.846

  No H/Q in entry =           3
  In of MODEL    6
    1    H    VAL  92           H        VAL  92 -28.860  -8.923  -7.710
    2    HA   VAL  92           HA       VAL  92 -29.555  -6.600  -6.146
    3    HB   VAL  92           HB       VAL  92 -27.039  -7.157  -7.762
    4   HG12  VAL  92          HG11      VAL  92 -27.119  -5.276  -5.427
    5   HG11  VAL  92          HG12      VAL  92 -27.774  -4.702  -6.961
    6   HG13  VAL  92          HG13      VAL  92 -26.095  -5.233  -6.863
    7   HG22  VAL  92          HG21      VAL  92 -26.863  -8.757  -6.177
    8   HG21  VAL  92          HG22      VAL  92 -27.972  -7.941  -5.072
    9   HG23  VAL  92          HG23      VAL  92 -26.297  -7.400  -5.204

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LEU  93           H        LEU  93 -29.197  -7.264  -9.572
    2    HA   LEU  93           HA       LEU  93 -29.452  -4.613 -10.489
    3    HB2  LEU  93           HB2      LEU  93 -28.889  -6.484 -11.962
    4    HB3  LEU  93           HB3      LEU  93 -30.504  -7.154 -11.730
    5    HG   LEU  93           HG       LEU  93 -31.451  -5.151 -12.840
    6   HD11  LEU  93          HD11      LEU  93 -29.539  -3.626 -12.343
    7   HD13  LEU  93          HD12      LEU  93 -29.992  -3.633 -14.049
    8   HD12  LEU  93          HD13      LEU  93 -28.568  -4.523 -13.511
    9   HD23  LEU  93          HD21      LEU  93 -30.450  -5.747 -15.137
   10   HD22  LEU  93          HD22      LEU  93 -31.331  -6.976 -14.229
   11   HD21  LEU  93          HD23      LEU  93 -29.566  -6.984 -14.244

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LYS  94           H        LYS  94 -31.913  -7.075  -9.632
    2    HA   LYS  94           HA       LYS  94 -34.207  -5.546 -10.235
    3    HB2  LYS  94           HB2      LYS  94 -33.759  -7.756  -8.234
    4    HB3  LYS  94           HB3      LYS  94 -35.332  -7.002  -8.488
    5    HG2  LYS  94           HG2      LYS  94 -35.291  -7.770 -10.825
    6    HG3  LYS  94           HG3      LYS  94 -33.755  -8.579 -10.512
    7    HD2  LYS  94           HD2      LYS  94 -34.911  -9.878  -8.683
    8    HD3  LYS  94           HD3      LYS  94 -36.434  -9.173  -9.226
    9    HE2  LYS  94           HE2      LYS  94 -35.969 -10.111 -11.500
   10    HE3  LYS  94           HE3      LYS  94 -34.578 -10.948 -10.809
   11    HZ3  LYS  94           HZ1      LYS  94 -36.483 -12.401 -10.971
   12    HZ2  LYS  94           HZ2      LYS  94 -37.413 -11.343 -10.019
   13    HZ1  LYS  94           HZ3      LYS  94 -36.076 -12.144  -9.343

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ALA  95           H        ALA  95 -32.367  -5.745  -7.199
    2    HA   ALA  95           HA       ALA  95 -34.147  -4.105  -5.701
    3    HB2  ALA  95           HB1      ALA  95 -31.820  -5.568  -5.186
    4    HB3  ALA  95           HB2      ALA  95 -32.756  -4.632  -4.022
    5    HB1  ALA  95           HB3      ALA  95 -31.387  -3.892  -4.851

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA  96           H        ALA  96 -31.491  -3.340  -7.814
    2    HA   ALA  96           HA       ALA  96 -31.288  -0.587  -7.030
    3    HB2  ALA  96           HB1      ALA  96 -29.934  -0.402  -9.149
    4    HB3  ALA  96           HB2      ALA  96 -30.303  -2.095  -9.472
    5    HB1  ALA  96           HB3      ALA  96 -29.360  -1.655  -8.048

  No H/Q in entry =           5
  In of MODEL    6
    1    H    VAL  97           H        VAL  97 -32.901  -2.232  -9.712
    2    HA   VAL  97           HA       VAL  97 -33.894   0.111 -10.950
    3    HB   VAL  97           HB       VAL  97 -34.812  -2.782 -10.999
    4   HG11  VAL  97          HG11      VAL  97 -36.532  -0.708 -11.463
    5   HG13  VAL  97          HG12      VAL  97 -36.656  -2.295 -12.225
    6   HG12  VAL  97          HG13      VAL  97 -35.858  -0.970 -13.073
    7   HG21  VAL  97          HG21      VAL  97 -33.480  -0.995 -13.035
    8   HG23  VAL  97          HG22      VAL  97 -33.998  -2.655 -13.328
    9   HG22  VAL  97          HG23      VAL  97 -32.727  -2.320 -12.151

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ALA  98           H        ALA  98 -35.140  -2.033  -8.414
    2    HA   ALA  98           HA       ALA  98 -37.653  -0.789  -8.039
    3    HB1  ALA  98           HB1      ALA  98 -36.715  -3.030  -7.023
    4    HB3  ALA  98           HB2      ALA  98 -37.853  -2.066  -6.080
    5    HB2  ALA  98           HB3      ALA  98 -36.126  -1.984  -5.732

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA  99           H        ALA  99 -34.534  -0.116  -6.412
    2    HA   ALA  99           HA       ALA  99 -35.573   1.902  -4.734
    3    HB1  ALA  99           HB1      ALA  99 -32.967   0.914  -5.505
    4    HB2  ALA  99           HB2      ALA  99 -33.476   1.679  -3.998
    5    HB3  ALA  99           HB3      ALA  99 -32.972   2.672  -5.364

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ILE 100           H        ILE 100 -34.553   2.008  -8.096
    2    HA   ILE 100           HA       ILE 100 -34.622   4.862  -8.301
    3    HB   ILE 100           HB       ILE 100 -34.817   2.723 -10.449
    4   HG12  ILE 100          HG12      ILE 100 -32.573   4.626  -9.785
    5   HG13  ILE 100          HG13      ILE 100 -32.669   2.978  -9.162
    6   HG21  ILE 100          HG21      ILE 100 -35.126   5.658 -10.563
    7   HG23  ILE 100          HG22      ILE 100 -35.689   4.416 -11.681
    8   HG22  ILE 100          HG23      ILE 100 -34.016   4.967 -11.745
    9   HD12  ILE 100          HD11      ILE 100 -32.119   3.928 -11.935
   10   HD11  ILE 100          HD12      ILE 100 -32.841   2.338 -11.683
   11   HD13  ILE 100          HD13      ILE 100 -31.273   2.717 -10.973

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LYS 101           H        LYS 101 -37.021   2.349  -9.022
    2    HA   LYS 101           HA       LYS 101 -39.044   4.083  -9.998
    3    HB2  LYS 101           HB2      LYS 101 -39.028   1.300  -8.885
    4    HB3  LYS 101           HB3      LYS 101 -40.552   2.125  -9.215
    5    HG2  LYS 101           HG2      LYS 101 -40.089   2.252 -11.515
    6    HG3  LYS 101           HG3      LYS 101 -38.409   1.780 -11.275
    7    HD2  LYS 101           HD2      LYS 101 -39.740  -0.074 -12.161
    8    HD3  LYS 101           HD3      LYS 101 -39.114  -0.437 -10.552
    9    HE2  LYS 101           HE2      LYS 101 -41.199  -1.052 -10.034
   10    HE3  LYS 101           HE3      LYS 101 -41.589   0.669 -10.025
   11    HZ3  LYS 101           HZ1      LYS 101 -42.501   0.558 -12.137
   12    HZ2  LYS 101           HZ2      LYS 101 -43.015  -0.900 -11.432
   13    HZ1  LYS 101           HZ3      LYS 101 -41.715  -0.898 -12.526

  No H/Q in entry =          13
  In of MODEL    6
    1    H    LYS 102           H        LYS 102 -38.587   2.571  -6.800
    2    HA   LYS 102           HA       LYS 102 -40.777   3.847  -5.580
    3    HB2  LYS 102           HB2      LYS 102 -39.608   1.928  -4.583
    4    HB3  LYS 102           HB3      LYS 102 -38.175   2.927  -4.344
    5    HG2  LYS 102           HG2      LYS 102 -39.425   4.364  -2.831
    6    HG3  LYS 102           HG3      LYS 102 -40.861   3.369  -3.072
    7    HD2  LYS 102           HD2      LYS 102 -39.703   1.451  -2.064
    8    HD3  LYS 102           HD3      LYS 102 -38.267   2.447  -1.822
    9    HE2  LYS 102           HE2      LYS 102 -39.551   3.970  -0.395
   10    HE3  LYS 102           HE3      LYS 102 -41.004   3.006  -0.659
   11    HZ1  LYS 102           HZ1      LYS 102 -39.347   1.179   0.323
   12    HZ3  LYS 102           HZ2      LYS 102 -40.415   2.102   1.266
   13    HZ2  LYS 102           HZ3      LYS 102 -38.786   2.564   1.129

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ALA 103           H        ALA 103 -37.778   5.126  -6.607
    2    HA   ALA 103           HA       ALA 103 -37.896   7.438  -4.812
    3    HB2  ALA 103           HB1      ALA 103 -35.889   8.102  -6.398
    4    HB3  ALA 103           HB2      ALA 103 -35.924   6.387  -6.805
    5    HB1  ALA 103           HB3      ALA 103 -35.665   6.891  -5.135

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA 104           H        ALA 104 -38.569   6.750  -8.156
    2    HA   ALA 104           HA       ALA 104 -39.049   9.559  -8.760
    3    HB2  ALA 104           HB1      ALA 104 -39.133   8.907 -10.965
    4    HB1  ALA 104           HB2      ALA 104 -39.918   7.373 -10.591
    5    HB3  ALA 104           HB3      ALA 104 -38.186   7.566 -10.322

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA 105           H        ALA 105 -40.726   7.510  -6.955
    2    HA   ALA 105           HA       ALA 105 -43.094   8.998  -6.904
    3    HB2  ALA 105           HB1      ALA 105 -43.886   8.180  -8.942
    4    HB3  ALA 105           HB2      ALA 105 -44.561   7.010  -7.807
    5    HB1  ALA 105           HB3      ALA 105 -43.112   6.610  -8.728

  No H/Q in entry =           5
  In of MODEL    7
    1    H1   ALA   1           H3       ALA   1 -12.497 -15.355  -2.470
    2    H2   ALA   1           H2       ALA   1 -11.573 -16.513  -3.308
    3    H3   ALA   1           H1       ALA   1 -12.697 -15.547  -4.144
    4    HA   ALA   1           HA       ALA   1 -14.127 -17.222  -3.912
    5    HB3  ALA   1           HB1      ALA   1 -12.765 -19.019  -3.446
    6    HB1  ALA   1           HB2      ALA   1 -13.525 -18.894  -1.860
    7    HB2  ALA   1           HB3      ALA   1 -11.935 -18.182  -2.134

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLU   2           H        GLU   2 -15.771 -18.048  -2.264
    2    HA   GLU   2           HA       GLU   2 -17.392 -16.299  -1.209
    3    HB2  GLU   2           HB2      GLU   2 -16.502 -18.743   0.336
    4    HB3  GLU   2           HB3      GLU   2 -18.011 -17.865   0.586
    5    HG2  GLU   2           HG2      GLU   2 -19.004 -18.932  -1.153
    6    HG3  GLU   2           HG3      GLU   2 -17.670 -18.554  -2.233

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLU   3           H        GLU   3 -15.514 -17.690   1.419
    2    HA   GLU   3           HA       GLU   3 -15.698 -15.334   2.978
    3    HB2  GLU   3           HB2      GLU   3 -14.160 -17.910   3.232
    4    HB3  GLU   3           HB3      GLU   3 -13.908 -16.596   4.381
    5    HG2  GLU   3           HG2      GLU   3 -16.107 -16.708   5.191
    6    HG3  GLU   3           HG3      GLU   3 -16.712 -17.495   3.739

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LEU   4           H        LEU   4 -12.765 -16.865   1.596
    2    HA   LEU   4           HA       LEU   4 -10.899 -14.996   2.203
    3    HB2  LEU   4           HB2      LEU   4 -11.143 -16.287  -0.524
    4    HB3  LEU   4           HB3      LEU   4  -9.681 -15.594   0.167
    5    HG   LEU   4           HG       LEU   4 -11.222 -17.964   1.272
    6   HD13  LEU   4          HD11      LEU   4  -9.612 -19.349   0.347
    7   HD12  LEU   4          HD12      LEU   4  -8.379 -18.088   0.326
    8   HD11  LEU   4          HD13      LEU   4  -9.663 -18.085  -0.881
    9   HD23  LEU   4          HD21      LEU   4  -8.978 -18.071   2.662
   10   HD22  LEU   4          HD22      LEU   4 -10.282 -17.007   3.187
   11   HD21  LEU   4          HD23      LEU   4  -8.903 -16.343   2.310

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLU   5           H        GLU   5 -13.219 -14.744  -0.479
    2    HA   GLU   5           HA       GLU   5 -12.167 -12.279  -1.474
    3    HB2  GLU   5           HB2      GLU   5 -13.547 -13.855  -2.829
    4    HB3  GLU   5           HB3      GLU   5 -14.942 -13.428  -1.837
    5    HG2  GLU   5           HG2      GLU   5 -15.030 -12.058  -3.815
    6    HG3  GLU   5           HG3      GLU   5 -14.550 -11.019  -2.474

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLU   6           H        GLU   6 -14.916 -13.108   0.607
    2    HA   GLU   6           HA       GLU   6 -15.772 -10.416   1.006
    3    HB2  GLU   6           HB2      GLU   6 -17.240 -12.376   1.398
    4    HB3  GLU   6           HB3      GLU   6 -16.218 -12.850   2.755
    5    HG2  GLU   6           HG2      GLU   6 -16.701 -10.714   3.878
    6    HG3  GLU   6           HG3      GLU   6 -17.707 -10.219   2.519

  No H/Q in entry =           6
  In of MODEL    7
    1    H    VAL   7           H        VAL   7 -13.510 -12.570   2.584
    2    HA   VAL   7           HA       VAL   7 -13.023 -11.006   4.915
    3    HB   VAL   7           HB       VAL   7 -11.352 -13.080   3.470
    4   HG11  VAL   7          HG11      VAL   7 -10.866 -11.558   6.037
    5   HG13  VAL   7          HG12      VAL   7  -9.764 -11.792   4.680
    6   HG12  VAL   7          HG13      VAL   7 -10.147 -13.143   5.747
    7   HG21  VAL   7          HG21      VAL   7 -13.618 -13.603   4.680
    8   HG23  VAL   7          HG22      VAL   7 -12.691 -13.348   6.160
    9   HG22  VAL   7          HG23      VAL   7 -12.217 -14.616   5.031

  No H/Q in entry =           9
  In of MODEL    7
    1    H    VAL   8           H        VAL   8 -11.502 -11.146   1.710
    2    HA   VAL   8           HA       VAL   8  -9.407  -9.312   2.213
    3    HB   VAL   8           HB       VAL   8 -10.872  -9.976  -0.351
    4   HG13  VAL   8          HG11      VAL   8  -9.895  -7.845  -0.732
    5   HG12  VAL   8          HG12      VAL   8  -8.716  -8.992  -1.369
    6   HG11  VAL   8          HG13      VAL   8  -8.458  -8.248   0.209
    7   HG21  VAL   8          HG21      VAL   8  -9.219 -11.589   1.142
    8   HG23  VAL   8          HG22      VAL   8  -8.046 -10.778   0.109
    9   HG22  VAL   8          HG23      VAL   8  -9.358 -11.703  -0.615

  No H/Q in entry =           9
  In of MODEL    7
    1    H    MET   9           H        MET   9 -12.740  -8.859   1.041
    2    HA   MET   9           HA       MET   9 -12.624  -6.084   0.609
    3    HB2  MET   9           HB2      MET   9 -14.870  -7.928   1.415
    4    HB3  MET   9           HB3      MET   9 -15.126  -6.193   1.227
    5    HG2  MET   9           HG2      MET   9 -14.235  -6.330  -1.086
    6    HG3  MET   9           HG3      MET   9 -14.051  -8.073  -0.894
    7    HE3  MET   9           HE1      MET   9 -17.884  -5.594  -1.018
    8    HE2  MET   9           HE2      MET   9 -16.546  -5.315  -2.129
    9    HE1  MET   9           HE3      MET   9 -16.293  -5.137  -0.395

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLY  10           H        GLY  10 -13.333  -7.965   3.532
    2    HA3  GLY  10           HA2      GLY  10 -13.848  -5.773   5.251
    3    HA2  GLY  10           HA3      GLY  10 -13.314  -7.372   5.765

  No H/Q in entry =           3
  In of MODEL    7
    1    H    LEU  11           H        LEU  11 -10.866  -7.539   4.460
    2    HA   LEU  11           HA       LEU  11  -9.147  -6.138   6.224
    3    HB2  LEU  11           HB2      LEU  11  -8.616  -7.569   3.618
    4    HB3  LEU  11           HB3      LEU  11  -7.337  -6.889   4.622
    5    HG   LEU  11           HG       LEU  11  -9.380  -8.886   5.629
    6   HD13  LEU  11          HD11      LEU  11  -8.174 -10.143   4.068
    7   HD12  LEU  11          HD12      LEU  11  -7.249 -10.400   5.546
    8   HD11  LEU  11          HD13      LEU  11  -6.683  -9.244   4.342
    9   HD22  LEU  11          HD21      LEU  11  -8.516  -7.891   7.550
   10   HD21  LEU  11          HD22      LEU  11  -6.968  -7.516   6.793
   11   HD23  LEU  11          HD23      LEU  11  -7.326  -9.167   7.300

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  12           H        ILE  12 -10.026  -5.572   2.832
    2    HA   ILE  12           HA       ILE  12  -8.293  -3.372   2.414
    3    HB   ILE  12           HB       ILE  12 -10.955  -3.984   1.106
    4   HG12  ILE  12          HG12      ILE  12  -8.954  -5.686   1.051
    5   HG13  ILE  12          HG13      ILE  12  -9.814  -5.325  -0.431
    6   HG23  ILE  12          HG21      ILE  12 -10.309  -1.676   0.670
    7   HG22  ILE  12          HG22      ILE  12  -9.990  -2.615  -0.782
    8   HG21  ILE  12          HG23      ILE  12  -8.690  -2.179   0.290
    9   HD12  ILE  12          HD11      ILE  12  -7.305  -5.331  -0.640
   10   HD11  ILE  12          HD12      ILE  12  -7.267  -3.944   0.446
   11   HD13  ILE  12          HD13      ILE  12  -8.049  -3.816  -1.113

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  13           H        ILE  13 -11.662  -3.581   3.494
    2    HA   ILE  13           HA       ILE  13 -12.075  -0.787   3.764
    3    HB   ILE  13           HB       ILE  13 -13.327  -3.195   5.103
    4   HG12  ILE  13          HG12      ILE  13 -13.541  -2.584   2.571
    5   HG13  ILE  13          HG13      ILE  13 -14.966  -3.065   3.470
    6   HG21  ILE  13          HG21      ILE  13 -13.898  -0.261   5.469
    7   HG23  ILE  13          HG22      ILE  13 -13.803  -1.520   6.693
    8   HG22  ILE  13          HG23      ILE  13 -15.202  -1.435   5.625
    9   HD12  ILE  13          HD11      ILE  13 -15.264  -0.994   2.023
   10   HD11  ILE  13          HD12      ILE  13 -14.148  -0.195   3.114
   11   HD13  ILE  13          HD13      ILE  13 -15.676  -0.788   3.730

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ASN  14           H        ASN  14 -11.016  -3.298   6.041
    2    HA   ASN  14           HA       ASN  14 -10.796  -1.665   8.329
    3    HB2  ASN  14           HB2      ASN  14 -10.586  -4.277   8.005
    4    HB3  ASN  14           HB3      ASN  14  -8.871  -3.918   7.856
    5   HD21  ASN  14          HD21      ASN  14  -9.541  -5.433  10.028
    6   HD22  ASN  14          HD22      ASN  14  -9.504  -4.515  11.453

  No H/Q in entry =           6
  In of MODEL    7
    1    H    SER  15           H        SER  15  -8.398  -2.527   5.846
    2    HA   SER  15           HA       SER  15  -6.235  -1.071   6.928
    3    HB2  SER  15           HB2      SER  15  -5.209  -1.302   4.773
    4    HB3  SER  15           HB3      SER  15  -6.189  -2.746   4.994
    5    HG   SER  15           HG       SER  15  -6.901  -2.099   3.096

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLY  16           H        GLY  16  -8.812  -0.160   4.671
    2    HA3  GLY  16           HA2      GLY  16  -7.909   2.467   4.125
    3    HA2  GLY  16           HA3      GLY  16  -9.568   1.899   3.956

  No H/Q in entry =           3
  In of MODEL    7
    1    H    GLN  17           H        GLN  17 -10.134   1.181   6.603
    2    HA   GLN  17           HA       GLN  17 -10.805   3.696   7.743
    3    HB2  GLN  17           HB2      GLN  17 -12.094   1.668   8.238
    4    HB3  GLN  17           HB3      GLN  17 -10.695   0.965   9.051
    5    HG2  GLN  17           HG2      GLN  17 -10.718   2.760  10.712
    6    HG3  GLN  17           HG3      GLN  17 -12.054   3.547   9.874
    7   HE21  GLN  17          HE21      GLN  17 -12.319   2.723  12.596
    8   HE22  GLN  17          HE22      GLN  17 -13.438   1.446  12.661

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ALA  18           H        ALA  18  -8.216   1.373   8.371
    2    HA   ALA  18           HA       ALA  18  -7.108   2.569  10.647
    3    HB2  ALA  18           HB1      ALA  18  -6.528   0.345   9.280
    4    HB3  ALA  18           HB2      ALA  18  -5.357   1.109  10.357
    5    HB1  ALA  18           HB3      ALA  18  -5.268   1.388   8.616

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ARG  19           H        ARG  19  -6.315   3.083   7.202
    2    HA   ARG  19           HA       ARG  19  -4.387   5.101   7.640
    3    HB2  ARG  19           HB2      ARG  19  -4.723   3.966   5.443
    4    HB3  ARG  19           HB3      ARG  19  -6.251   4.831   5.260
    5    HG2  ARG  19           HG2      ARG  19  -5.090   6.985   5.334
    6    HG3  ARG  19           HG3      ARG  19  -3.554   6.176   5.644
    7    HD2  ARG  19           HD2      ARG  19  -3.660   6.769   3.301
    8    HD3  ARG  19           HD3      ARG  19  -3.773   5.011   3.445
    9    HE   ARG  19           HE       ARG  19  -6.392   5.960   3.427
   10   HH21  ARG  19          HH11      ARG  19  -7.577   6.135   1.504
   11   HH22  ARG  19          HH12      ARG  19  -6.748   6.201  -0.012
   12   HH11  ARG  19          HH21      ARG  19  -3.608   5.982   1.405
   13   HH12  ARG  19          HH22      ARG  19  -4.499   6.112  -0.068

  No H/Q in entry =          13
  In of MODEL    7
    1    H    SER  20           H        SER  20  -7.880   5.269   7.025
    2    HA   SER  20           HA       SER  20  -8.196   8.030   6.977
    3    HB2  SER  20           HB2      SER  20  -9.947   6.171   6.602
    4    HB3  SER  20           HB3      SER  20 -10.172   6.223   8.350
    5    HG   SER  20           HG       SER  20 -10.478   8.331   6.475

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU  21           H        LEU  21  -8.240   5.846   9.780
    2    HA   LEU  21           HA       LEU  21  -8.660   7.847  11.744
    3    HB2  LEU  21           HB2      LEU  21  -7.352   5.124  11.906
    4    HB3  LEU  21           HB3      LEU  21  -7.643   6.145  13.310
    5    HG   LEU  21           HG       LEU  21  -9.823   5.274  11.388
    6   HD12  LEU  21          HD11      LEU  21 -10.453   3.761  13.365
    7   HD11  LEU  21          HD12      LEU  21  -8.822   4.052  13.965
    8   HD13  LEU  21          HD13      LEU  21  -9.059   3.265  12.404
    9   HD22  LEU  21          HD21      LEU  21 -10.711   7.116  12.518
   10   HD21  LEU  21          HD22      LEU  21  -9.753   6.838  13.968
   11   HD23  LEU  21          HD23      LEU  21 -11.151   5.828  13.635

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ALA  22           H        ALA  22  -5.722   6.432  10.349
    2    HA   ALA  22           HA       ALA  22  -3.831   7.717  11.980
    3    HB2  ALA  22           HB1      ALA  22  -3.434   5.858  10.289
    4    HB1  ALA  22           HB2      ALA  22  -2.219   7.137  10.330
    5    HB3  ALA  22           HB3      ALA  22  -3.432   7.111   9.049

  No H/Q in entry =           5
  In of MODEL    7
    1    H    TYR  23           H        TYR  23  -5.119   8.754   8.792
    2    HA   TYR  23           HA       TYR  23  -3.747  11.231   8.729
    3    HB2  TYR  23           HB2      TYR  23  -4.831  10.337   6.731
    4    HB3  TYR  23           HB3      TYR  23  -6.411  10.463   7.506
    5    HD1  TYR  23           HD1      TYR  23  -3.475  12.472   6.377
    6    HD2  TYR  23           HD2      TYR  23  -7.626  12.489   7.476
    7    HE1  TYR  23           HE1      TYR  23  -3.666  14.825   5.619
    8    HE2  TYR  23           HE2      TYR  23  -7.818  14.842   6.716
    9    HH   TYR  23           HH       TYR  23  -5.106  16.487   5.136

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ALA  24           H        ALA  24  -6.886  10.297  10.094
    2    HA   ALA  24           HA       ALA  24  -7.689  12.899  10.862
    3    HB1  ALA  24           HB1      ALA  24  -9.527  11.673  11.321
    4    HB2  ALA  24           HB2      ALA  24  -8.716  11.090  12.772
    5    HB3  ALA  24           HB3      ALA  24  -8.597  10.177  11.269

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA  25           H        ALA  25  -5.729  10.411  12.444
    2    HA   ALA  25           HA       ALA  25  -5.385  11.658  14.948
    3    HB2  ALA  25           HB1      ALA  25  -4.648   9.296  14.130
    4    HB3  ALA  25           HB2      ALA  25  -3.626  10.139  15.296
    5    HB1  ALA  25           HB3      ALA  25  -3.182  10.116  13.588

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU  26           H        LEU  26  -3.577  11.933  11.916
    2    HA   LEU  26           HA       LEU  26  -1.596  13.724  12.842
    3    HB2  LEU  26           HB2      LEU  26  -1.302  12.569  10.739
    4    HB3  LEU  26           HB3      LEU  26  -2.762  13.298  10.078
    5    HG   LEU  26           HG       LEU  26  -1.715  15.534  10.220
    6   HD12  LEU  26          HD11      LEU  26   0.821  15.517  10.645
    7   HD11  LEU  26          HD12      LEU  26   0.572  13.939  11.388
    8   HD13  LEU  26          HD13      LEU  26  -0.219  15.365  12.061
    9   HD21  LEU  26          HD21      LEU  26   0.004  13.455   8.832
   10   HD23  LEU  26          HD22      LEU  26  -0.013  15.177   8.462
   11   HD22  LEU  26          HD23      LEU  26  -1.449  14.200   8.167

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LYS  27           H        LYS  27  -4.764  14.253  11.351
    2    HA   LYS  27           HA       LYS  27  -4.668  17.041  11.154
    3    HB2  LYS  27           HB2      LYS  27  -6.428  15.590  10.160
    4    HB3  LYS  27           HB3      LYS  27  -7.096  15.342  11.773
    5    HG2  LYS  27           HG2      LYS  27  -7.491  17.754  12.008
    6    HG3  LYS  27           HG3      LYS  27  -6.772  18.041  10.421
    7    HD2  LYS  27           HD2      LYS  27  -8.520  16.633   9.376
    8    HD3  LYS  27           HD3      LYS  27  -9.246  16.363  10.963
    9    HE2  LYS  27           HE2      LYS  27  -9.654  18.780  11.205
   10    HE3  LYS  27           HE3      LYS  27  -8.900  19.072   9.634
   11    HZ3  LYS  27           HZ1      LYS  27 -11.278  18.982   9.381
   12    HZ2  LYS  27           HZ2      LYS  27 -11.352  17.466  10.150
   13    HZ1  LYS  27           HZ3      LYS  27 -10.598  17.619   8.632

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLN  28           H        GLN  28  -5.599  14.967  13.876
    2    HA   GLN  28           HA       GLN  28  -6.473  16.983  15.650
    3    HB2  GLN  28           HB2      GLN  28  -5.113  14.330  16.196
    4    HB3  GLN  28           HB3      GLN  28  -5.843  15.345  17.441
    5    HG2  GLN  28           HG2      GLN  28  -7.314  14.251  15.027
    6    HG3  GLN  28           HG3      GLN  28  -7.387  13.560  16.647
    7   HE21  GLN  28          HE21      GLN  28  -9.235  15.380  14.683
    8   HE22  GLN  28          HE22      GLN  28  -9.966  16.415  15.812

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ALA  29           H        ALA  29  -3.271  15.637  14.974
    2    HA   ALA  29           HA       ALA  29  -1.820  17.012  16.959
    3    HB1  ALA  29           HB1      ALA  29   0.105  16.291  15.849
    4    HB3  ALA  29           HB2      ALA  29  -0.641  16.428  14.256
    5    HB2  ALA  29           HB3      ALA  29  -1.089  15.101  15.328

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LYS  30           H        LYS  30  -2.649  17.906  13.627
    2    HA   LYS  30           HA       LYS  30  -1.197  20.322  13.534
    3    HB2  LYS  30           HB2      LYS  30  -3.736  19.493  12.114
    4    HB3  LYS  30           HB3      LYS  30  -2.875  20.993  11.774
    5    HG2  LYS  30           HG2      LYS  30  -0.826  19.665  11.269
    6    HG3  LYS  30           HG3      LYS  30  -1.759  18.184  11.509
    7    HD2  LYS  30           HD2      LYS  30  -3.304  18.853   9.708
    8    HD3  LYS  30           HD3      LYS  30  -2.394  20.346   9.470
    9    HE2  LYS  30           HE2      LYS  30  -0.382  19.018   8.898
   10    HE3  LYS  30           HE3      LYS  30  -1.311  17.531   9.105
   11    HZ2  LYS  30           HZ1      LYS  30  -1.109  18.400   6.765
   12    HZ1  LYS  30           HZ2      LYS  30  -2.133  19.681   7.229
   13    HZ3  LYS  30           HZ3      LYS  30  -2.686  18.073   7.297

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLN  31           H        GLN  31  -4.318  19.525  14.932
    2    HA   GLN  31           HA       GLN  31  -5.033  22.295  15.383
    3    HB2  GLN  31           HB2      GLN  31  -6.263  19.870  16.699
    4    HB3  GLN  31           HB3      GLN  31  -6.992  21.456  16.452
    5    HG2  GLN  31           HG2      GLN  31  -6.286  20.667  13.864
    6    HG3  GLN  31           HG3      GLN  31  -6.841  19.172  14.608
    7   HE21  GLN  31          HE21      GLN  31  -8.213  20.774  12.502
    8   HE22  GLN  31          HE22      GLN  31  -9.722  21.193  13.154

  No H/Q in entry =           8
  In of MODEL    7
    1    H    GLY  32           H        GLY  32  -2.763  20.324  16.711
    2    HA3  GLY  32           HA2      GLY  32  -1.361  20.758  18.520
    3    HA2  GLY  32           HA3      GLY  32  -2.469  22.022  19.040

  No H/Q in entry =           3
  In of MODEL    7
    1    H    ASP  33           H        ASP  33  -3.946  19.010  18.369
    2    HA   ASP  33           HA       ASP  33  -4.377  18.558  21.247
    3    HB2  ASP  33           HB2      ASP  33  -5.792  17.575  18.763
    4    HB3  ASP  33           HB3      ASP  33  -6.155  16.970  20.377

  No H/Q in entry =           4
  In of MODEL    7
    1    H    PHE  34           H        PHE  34  -2.226  17.665  21.560
    2    HA   PHE  34           HA       PHE  34  -1.263  15.399  20.161
    3    HB2  PHE  34           HB2      PHE  34  -0.639  16.369  22.959
    4    HB3  PHE  34           HB3      PHE  34   0.270  15.129  22.094
    5    HD1  PHE  34           HD1      PHE  34   0.160  18.557  22.832
    6    HD2  PHE  34           HD2      PHE  34   0.952  15.841  19.598
    7    HE1  PHE  34           HE1      PHE  34   1.494  20.304  21.685
    8    HE2  PHE  34           HE2      PHE  34   2.280  17.592  18.456
    9    HZ   PHE  34           HZ       PHE  34   2.553  19.820  19.504

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ALA  35           H        ALA  35  -3.309  15.712  23.016
    2    HA   ALA  35           HA       ALA  35  -3.151  13.046  23.911
    3    HB3  ALA  35           HB1      ALA  35  -5.600  13.718  24.759
    4    HB1  ALA  35           HB2      ALA  35  -5.034  15.326  24.307
    5    HB2  ALA  35           HB3      ALA  35  -4.142  14.383  25.501

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA  36           H        ALA  36  -5.563  14.611  21.803
    2    HA   ALA  36           HA       ALA  36  -7.023  12.228  21.317
    3    HB1  ALA  36           HB1      ALA  36  -8.447  13.679  20.357
    4    HB3  ALA  36           HB2      ALA  36  -7.262  14.078  19.113
    5    HB2  ALA  36           HB3      ALA  36  -7.275  14.964  20.637

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA  37           H        ALA  37  -4.306  13.765  19.660
    2    HA   ALA  37           HA       ALA  37  -4.293  12.132  17.362
    3    HB3  ALA  37           HB1      ALA  37  -2.274  13.804  18.794
    4    HB2  ALA  37           HB2      ALA  37  -2.796  13.872  17.112
    5    HB1  ALA  37           HB3      ALA  37  -1.669  12.619  17.636

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LYS  38           H        LYS  38  -2.554  11.789  20.446
    2    HA   LYS  38           HA       LYS  38  -1.273   9.364  19.959
    3    HB2  LYS  38           HB2      LYS  38  -1.571  11.130  22.106
    4    HB3  LYS  38           HB3      LYS  38  -2.222   9.612  22.718
    5    HG2  LYS  38           HG2      LYS  38  -0.147   8.453  22.188
    6    HG3  LYS  38           HG3      LYS  38   0.492   9.887  21.379
    7    HD2  LYS  38           HD2      LYS  38   0.677  11.100  23.416
    8    HD3  LYS  38           HD3      LYS  38  -0.368   9.968  24.278
    9    HE2  LYS  38           HE2      LYS  38   1.979   9.606  24.906
   10    HE3  LYS  38           HE3      LYS  38   1.351   8.203  24.037
   11    HZ3  LYS  38           HZ1      LYS  38   2.666   8.599  22.262
   12    HZ2  LYS  38           HZ2      LYS  38   3.632   9.407  23.403
   13    HZ1  LYS  38           HZ3      LYS  38   2.574  10.289  22.409

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ALA  39           H        ALA  39  -4.507   9.920  21.350
    2    HA   ALA  39           HA       ALA  39  -5.121   7.211  21.849
    3    HB3  ALA  39           HB1      ALA  39  -7.240   9.197  21.076
    4    HB2  ALA  39           HB2      ALA  39  -6.343   9.405  22.580
    5    HB1  ALA  39           HB3      ALA  39  -7.287   7.939  22.312

  No H/Q in entry =           5
  In of MODEL    7
    1    H    MET  40           H        MET  40  -5.657   9.238  19.002
    2    HA   MET  40           HA       MET  40  -7.163   7.336  17.534
    3    HB2  MET  40           HB2      MET  40  -5.505   9.702  16.638
    4    HB3  MET  40           HB3      MET  40  -6.544   8.764  15.563
    5    HG2  MET  40           HG2      MET  40  -7.565  10.029  18.119
    6    HG3  MET  40           HG3      MET  40  -7.601  10.866  16.569
    7    HE3  MET  40           HE1      MET  40 -10.206   9.299  14.492
    8    HE2  MET  40           HE2      MET  40  -8.451   9.383  14.351
    9    HE1  MET  40           HE3      MET  40  -9.345  10.765  14.983

  No H/Q in entry =           9
  In of MODEL    7
    1    H    MET  41           H        MET  41  -3.660   8.008  17.671
    2    HA   MET  41           HA       MET  41  -2.926   6.242  15.572
    3    HB2  MET  41           HB2      MET  41  -1.307   6.875  18.052
    4    HB3  MET  41           HB3      MET  41  -0.696   6.217  16.538
    5    HG2  MET  41           HG2      MET  41  -1.807   8.423  15.532
    6    HG3  MET  41           HG3      MET  41  -1.567   9.004  17.178
    7    HE2  MET  41           HE1      MET  41   1.310   6.851  17.549
    8    HE1  MET  41           HE2      MET  41   0.542   8.158  18.446
    9    HE3  MET  41           HE3      MET  41   2.173   8.372  17.810

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ASP  42           H        ASP  42  -3.334   5.771  19.055
    2    HA   ASP  42           HA       ASP  42  -2.346   3.159  19.216
    3    HB2  ASP  42           HB2      ASP  42  -3.195   4.932  21.038
    4    HB3  ASP  42           HB3      ASP  42  -4.640   3.933  20.958

  No H/Q in entry =           4
  In of MODEL    7
    1    H    GLN  43           H        GLN  43  -5.657   4.324  18.704
    2    HA   GLN  43           HA       GLN  43  -6.847   1.759  18.501
    3    HB2  GLN  43           HB2      GLN  43  -7.717   4.429  17.372
    4    HB3  GLN  43           HB3      GLN  43  -8.706   2.968  17.344
    5    HG2  GLN  43           HG2      GLN  43  -8.426   2.838  19.852
    6    HG3  GLN  43           HG3      GLN  43  -7.671   4.429  19.786
    7   HE21  GLN  43          HE21      GLN  43  -9.855   4.547  21.277
    8   HE22  GLN  43          HE22      GLN  43 -11.202   5.149  20.441

  No H/Q in entry =           8
  In of MODEL    7
    1    H    SER  44           H        SER  44  -5.456   3.951  16.098
    2    HA   SER  44           HA       SER  44  -6.175   2.482  13.804
    3    HB2  SER  44           HB2      SER  44  -4.877   4.842  14.256
    4    HB3  SER  44           HB3      SER  44  -3.539   3.822  13.730
    5    HG   SER  44           HG       SER  44  -4.626   4.817  11.964

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ARG  45           H        ARG  45  -3.309   2.314  15.896
    2    HA   ARG  45           HA       ARG  45  -1.859   0.335  14.517
    3    HB2  ARG  45           HB2      ARG  45  -0.999   1.738  16.391
    4    HB3  ARG  45           HB3      ARG  45  -2.012   0.824  17.506
    5    HG2  ARG  45           HG2      ARG  45  -0.816  -1.256  16.866
    6    HG3  ARG  45           HG3      ARG  45   0.222  -0.318  15.793
    7    HD2  ARG  45           HD2      ARG  45   0.973   1.046  17.754
    8    HD3  ARG  45           HD3      ARG  45   0.027  -0.013  18.822
    9    HE   ARG  45           HE       ARG  45   1.703  -1.637  17.247
   10   HH21  ARG  45          HH11      ARG  45   3.584  -2.496  18.091
   11   HH22  ARG  45          HH12      ARG  45   4.366  -1.726  19.426
   12   HH11  ARG  45          HH21      ARG  45   2.041   0.820  19.641
   13   HH12  ARG  45          HH22      ARG  45   3.492   0.154  20.302

  No H/Q in entry =          13
  In of MODEL    7
    1    H    MET  46           H        MET  46  -4.273   0.055  17.107
    2    HA   MET  46           HA       MET  46  -4.158  -2.747  17.410
    3    HB2  MET  46           HB2      MET  46  -6.291  -0.701  18.006
    4    HB3  MET  46           HB3      MET  46  -6.535  -2.416  18.339
    5    HG2  MET  46           HG2      MET  46  -4.553  -2.456  19.768
    6    HG3  MET  46           HG3      MET  46  -4.207  -0.778  19.382
    7    HE3  MET  46           HE1      MET  46  -7.987  -2.368  20.466
    8    HE2  MET  46           HE2      MET  46  -7.287  -2.672  22.053
    9    HE1  MET  46           HE3      MET  46  -6.505  -3.322  20.616

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ALA  47           H        ALA  47  -6.131  -0.690  15.310
    2    HA   ALA  47           HA       ALA  47  -7.783  -2.709  14.234
    3    HB3  ALA  47           HB1      ALA  47  -8.418  -0.458  13.818
    4    HB1  ALA  47           HB2      ALA  47  -7.934  -1.098  12.248
    5    HB2  ALA  47           HB3      ALA  47  -6.838  -0.052  13.151

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU  48           H        LEU  48  -4.635  -1.458  13.199
    2    HA   LEU  48           HA       LEU  48  -4.374  -3.050  10.856
    3    HB2  LEU  48           HB2      LEU  48  -2.301  -1.814  12.676
    4    HB3  LEU  48           HB3      LEU  48  -1.939  -2.539  11.109
    5    HG   LEU  48           HG       LEU  48  -3.920  -0.284  11.493
    6   HD13  LEU  48          HD11      LEU  48  -1.785   0.550  12.170
    7   HD12  LEU  48          HD12      LEU  48  -2.042   1.112  10.517
    8   HD11  LEU  48          HD13      LEU  48  -0.972  -0.257  10.829
    9   HD22  LEU  48          HD21      LEU  48  -4.402  -1.256   9.414
   10   HD21  LEU  48          HD22      LEU  48  -2.726  -1.723   9.125
   11   HD23  LEU  48          HD23      LEU  48  -3.212  -0.034   8.966

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ASN  49           H        ASN  49  -3.352  -3.472  14.206
    2    HA   ASN  49           HA       ASN  49  -1.793  -5.766  13.880
    3    HB2  ASN  49           HB2      ASN  49  -1.777  -4.458  15.931
    4    HB3  ASN  49           HB3      ASN  49  -3.462  -4.853  16.238
    5   HD21  ASN  49          HD21      ASN  49  -0.236  -6.363  15.927
    6   HD22  ASN  49          HD22      ASN  49  -0.580  -7.672  16.951

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLU  50           H        GLU  50  -5.258  -5.422  14.536
    2    HA   GLU  50           HA       GLU  50  -5.828  -8.211  14.637
    3    HB2  GLU  50           HB2      GLU  50  -7.383  -6.493  15.509
    4    HB3  GLU  50           HB3      GLU  50  -7.657  -5.921  13.862
    5    HG2  GLU  50           HG2      GLU  50  -8.564  -8.098  13.216
    6    HG3  GLU  50           HG3      GLU  50  -8.203  -8.751  14.810

  No H/Q in entry =           6
  In of MODEL    7
    1    H    ALA  51           H        ALA  51  -5.835  -5.808  12.045
    2    HA   ALA  51           HA       ALA  51  -6.846  -7.512  10.016
    3    HB3  ALA  51           HB1      ALA  51  -6.582  -5.702   8.651
    4    HB1  ALA  51           HB2      ALA  51  -4.939  -5.388   9.207
    5    HB2  ALA  51           HB3      ALA  51  -6.316  -4.850  10.170

  No H/Q in entry =           5
  In of MODEL    7
    1    H    HIS  52           H        HIS  52  -3.542  -6.675  11.016
    2    HA   HIS  52           HA       HIS  52  -2.165  -8.190   9.071
    3    HB2  HIS  52           HB2      HIS  52  -1.123  -6.472  10.544
    4    HB3  HIS  52           HB3      HIS  52  -1.283  -7.585  11.903
    5    HD1  HIS  52           HD1      HIS  52   0.159  -9.787  11.821
    6    HD2  HIS  52           HD2      HIS  52   0.982  -7.071   8.766
    7    HE1  HIS  52           HE1      HIS  52   2.346 -10.523  10.776
    8    HE2  HIS  52           HE2      HIS  52   2.861  -8.879   8.912

  No H/Q in entry =           8
  In of MODEL    7
    1    H    LEU  53           H        LEU  53  -3.411  -9.047  12.276
    2    HA   LEU  53           HA       LEU  53  -2.269 -11.617  12.471
    3    HB2  LEU  53           HB2      LEU  53  -4.733 -10.384  13.676
    4    HB3  LEU  53           HB3      LEU  53  -4.312 -12.069  13.966
    5    HG   LEU  53           HG       LEU  53  -2.362  -9.796  14.455
    6   HD12  LEU  53          HD11      LEU  53  -2.980 -10.204  16.899
    7   HD11  LEU  53          HD12      LEU  53  -4.395 -11.069  16.298
    8   HD13  LEU  53          HD13      LEU  53  -4.188  -9.359  15.937
    9   HD21  LEU  53          HD21      LEU  53  -2.462 -12.736  15.147
   10   HD23  LEU  53          HD22      LEU  53  -1.527 -11.619  16.136
   11   HD22  LEU  53          HD23      LEU  53  -1.129 -11.829  14.441

  No H/Q in entry =          11
  In of MODEL    7
    1    H    VAL  54           H        VAL  54  -5.350 -10.518  11.096
    2    HA   VAL  54           HA       VAL  54  -6.317 -13.090  10.400
    3    HB   VAL  54           HB       VAL  54  -6.899 -10.342   9.267
    4   HG12  VAL  54          HG11      VAL  54  -9.027 -11.672   8.443
    5   HG11  VAL  54          HG12      VAL  54  -7.945 -13.062   8.518
    6   HG13  VAL  54          HG13      VAL  54  -7.551 -11.694   7.480
    7   HG22  VAL  54          HG21      VAL  54  -7.817 -10.364  11.414
    8   HG21  VAL  54          HG22      VAL  54  -8.109 -12.101  11.391
    9   HG23  VAL  54          HG23      VAL  54  -9.162 -11.019  10.481

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLN  55           H        GLN  55  -4.384 -10.678   8.624
    2    HA   GLN  55           HA       GLN  55  -4.275 -12.141   6.205
    3    HB2  GLN  55           HB2      GLN  55  -3.620  -9.890   6.021
    4    HB3  GLN  55           HB3      GLN  55  -2.518  -9.993   7.392
    5    HG2  GLN  55           HG2      GLN  55  -0.813 -10.875   6.122
    6    HG3  GLN  55           HG3      GLN  55  -1.904 -11.824   5.121
    7   HE21  GLN  55          HE21      GLN  55  -1.895 -11.131   3.001
    8   HE22  GLN  55          HE22      GLN  55  -1.659  -9.530   2.494

  No H/Q in entry =           8
  In of MODEL    7
    1    H    THR  56           H        THR  56  -2.182 -12.171   9.095
    2    HA   THR  56           HA       THR  56  -0.136 -13.815   8.185
    3    HB   THR  56           HB       THR  56  -1.395 -14.046  10.926
    4    HG1  THR  56           HG1      THR  56   0.267 -12.091   9.768
    5   HG22  THR  56          HG21      THR  56   1.006 -14.460  11.557
    6   HG21  THR  56          HG22      THR  56   1.393 -14.491   9.837
    7   HG23  THR  56          HG23      THR  56   0.313 -15.705  10.520

  No H/Q in entry =           7
  In of MODEL    7
    1    H    LYS  57           H        LYS  57  -3.285 -14.783   9.531
    2    HA   LYS  57           HA       LYS  57  -2.901 -17.588   9.283
    3    HB2  LYS  57           HB2      LYS  57  -4.701 -16.463  10.624
    4    HB3  LYS  57           HB3      LYS  57  -5.473 -15.985   9.119
    5    HG2  LYS  57           HG2      LYS  57  -5.795 -18.324   8.495
    6    HG3  LYS  57           HG3      LYS  57  -4.940 -18.853   9.942
    7    HD2  LYS  57           HD2      LYS  57  -6.680 -17.788  11.351
    8    HD3  LYS  57           HD3      LYS  57  -7.548 -17.296   9.897
    9    HE2  LYS  57           HE2      LYS  57  -6.885 -20.183  10.570
   10    HE3  LYS  57           HE3      LYS  57  -8.435 -19.431  10.939
   11    HZ1  LYS  57           HZ1      LYS  57  -8.194 -18.793   8.380
   12    HZ3  LYS  57           HZ2      LYS  57  -8.943 -20.223   8.915
   13    HZ2  LYS  57           HZ3      LYS  57  -7.329 -20.254   8.383

  No H/Q in entry =          13
  In of MODEL    7
    1    H    LEU  58           H        LEU  58  -4.166 -15.112   7.105
    2    HA   LEU  58           HA       LEU  58  -5.000 -16.915   5.092
    3    HB2  LEU  58           HB2      LEU  58  -4.326 -13.981   4.964
    4    HB3  LEU  58           HB3      LEU  58  -5.004 -14.901   3.619
    5    HG   LEU  58           HG       LEU  58  -6.293 -14.696   6.361
    6   HD11  LEU  58          HD11      LEU  58  -6.544 -13.039   3.871
    7   HD13  LEU  58          HD12      LEU  58  -6.530 -12.534   5.561
    8   HD12  LEU  58          HD13      LEU  58  -7.967 -13.294   4.881
    9   HD22  LEU  58          HD21      LEU  58  -7.295 -16.582   5.484
   10   HD21  LEU  58          HD22      LEU  58  -6.937 -16.135   3.816
   11   HD23  LEU  58          HD23      LEU  58  -8.287 -15.380   4.661

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  59           H        ILE  59  -1.842 -15.778   5.970
    2    HA   ILE  59           HA       ILE  59  -0.749 -16.526   3.338
    3    HB   ILE  59           HB       ILE  59   0.059 -14.482   4.918
    4   HG12  ILE  59          HG12      ILE  59   2.108 -16.178   3.475
    5   HG13  ILE  59          HG13      ILE  59   0.944 -15.190   2.631
    6   HG22  ILE  59          HG21      ILE  59   2.097 -16.580   5.612
    7   HG21  ILE  59          HG22      ILE  59   0.746 -16.278   6.682
    8   HG23  ILE  59          HG23      ILE  59   1.893 -14.991   6.312
    9   HD13  ILE  59          HD11      ILE  59   1.754 -13.182   3.783
   10   HD12  ILE  59          HD12      ILE  59   3.079 -13.984   2.941
   11   HD11  ILE  59          HD13      ILE  59   2.904 -14.165   4.688

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLU  60           H        GLU  60  -0.801 -17.637   6.703
    2    HA   GLU  60           HA       GLU  60   1.185 -19.660   6.446
    3    HB2  GLU  60           HB2      GLU  60   0.433 -18.866   8.634
    4    HB3  GLU  60           HB3      GLU  60  -1.189 -19.479   8.320
    5    HG2  GLU  60           HG2      GLU  60  -0.301 -21.778   8.183
    6    HG3  GLU  60           HG3      GLU  60   1.326 -21.168   8.479

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLY  61           H        GLY  61  -2.324 -19.677   5.942
    2    HA3  GLY  61           HA2      GLY  61  -2.135 -22.473   4.981
    3    HA2  GLY  61           HA3      GLY  61  -3.607 -21.704   5.568

  No H/Q in entry =           3
  In of MODEL    7
    1    H    ASP  62           H        ASP  62  -1.329 -20.175   3.377
    2    HA   ASP  62           HA       ASP  62  -3.386 -19.536   1.505
    3    HB2  ASP  62           HB2      ASP  62  -1.519 -18.557   0.205
    4    HB3  ASP  62           HB3      ASP  62  -1.502 -18.041   1.889

  No H/Q in entry =           4
  In of MODEL    7
    1    H    ALA  63           H        ALA  63  -3.940 -22.009   1.292
    2    HA   ALA  63           HA       ALA  63  -2.276 -23.686  -0.307
    3    HB1  ALA  63           HB1      ALA  63  -4.113 -25.149  -0.437
    4    HB3  ALA  63           HB2      ALA  63  -5.275 -23.842  -0.212
    5    HB2  ALA  63           HB3      ALA  63  -4.270 -24.369   1.138

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLY  64           H        GLY  64  -4.862 -21.388  -1.026
    2    HA3  GLY  64           HA2      GLY  64  -5.365 -20.243  -2.962
    3    HA2  GLY  64           HA3      GLY  64  -3.913 -20.913  -3.687

  No H/Q in entry =           3
  In of MODEL    7
    1    H    GLU  65           H        GLU  65  -5.062 -21.247  -5.674
    2    HA   GLU  65           HA       GLU  65  -7.452 -22.741  -5.832
    3    HB2  GLU  65           HB2      GLU  65  -5.309 -22.187  -7.881
    4    HB3  GLU  65           HB3      GLU  65  -6.821 -23.018  -8.251
    5    HG2  GLU  65           HG2      GLU  65  -8.108 -21.087  -7.467
    6    HG3  GLU  65           HG3      GLU  65  -6.621 -20.258  -7.013

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLY  66           H        GLY  66  -4.104 -23.672  -5.979
    2    HA3  GLY  66           HA2      GLY  66  -4.842 -26.504  -5.707
    3    HA2  GLY  66           HA3      GLY  66  -3.639 -26.021  -6.886

  No H/Q in entry =           3
  In of MODEL    7
    1    H    LYS  67           H        LYS  67  -2.242 -27.501  -5.799
    2    HA   LYS  67           HA       LYS  67  -1.505 -27.329  -3.102
    3    HB2  LYS  67           HB2      LYS  67  -0.049 -28.458  -5.489
    4    HB3  LYS  67           HB3      LYS  67   0.455 -28.701  -3.811
    5    HG2  LYS  67           HG2      LYS  67  -1.802 -29.622  -3.297
    6    HG3  LYS  67           HG3      LYS  67  -2.231 -29.462  -4.999
    7    HD2  LYS  67           HD2      LYS  67   0.147 -31.077  -4.052
    8    HD3  LYS  67           HD3      LYS  67  -1.456 -31.776  -4.292
    9    HE2  LYS  67           HE2      LYS  67  -1.384 -30.775  -6.646
   10    HE3  LYS  67           HE3      LYS  67   0.331 -30.480  -6.359
   11    HZ3  LYS  67           HZ1      LYS  67   0.661 -32.817  -5.970
   12    HZ2  LYS  67           HZ2      LYS  67  -0.084 -32.600  -7.481
   13    HZ1  LYS  67           HZ3      LYS  67  -0.995 -33.128  -6.148

  No H/Q in entry =          13
  In of MODEL    7
    1    H    MET  68           H        MET  68   0.713 -26.609  -5.733
    2    HA   MET  68           HA       MET  68   2.514 -25.084  -4.192
    3    HB2  MET  68           HB2      MET  68   2.136 -25.252  -7.183
    4    HB3  MET  68           HB3      MET  68   3.530 -24.530  -6.381
    5    HG2  MET  68           HG2      MET  68   3.257 -27.014  -5.145
    6    HG3  MET  68           HG3      MET  68   2.920 -27.346  -6.846
    7    HE1  MET  68           HE1      MET  68   4.733 -25.176  -4.609
    8    HE3  MET  68           HE2      MET  68   5.800 -24.370  -5.757
    9    HE2  MET  68           HE3      MET  68   6.436 -25.640  -4.718

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LYS  69           H        LYS  69  -0.128 -24.068  -6.343
    2    HA   LYS  69           HA       LYS  69   0.556 -21.325  -6.346
    3    HB2  LYS  69           HB2      LYS  69  -2.025 -22.703  -7.024
    4    HB3  LYS  69           HB3      LYS  69  -1.745 -20.971  -7.241
    5    HG2  LYS  69           HG2      LYS  69   0.200 -21.445  -8.665
    6    HG3  LYS  69           HG3      LYS  69  -0.046 -23.176  -8.441
    7    HD2  LYS  69           HD2      LYS  69  -2.262 -23.008  -9.505
    8    HD3  LYS  69           HD3      LYS  69  -2.026 -21.272  -9.723
    9    HE2  LYS  69           HE2      LYS  69  -0.037 -21.712 -11.118
   10    HE3  LYS  69           HE3      LYS  69  -0.274 -23.446 -10.904
   11    HZ1  LYS  69           HZ1      LYS  69  -2.446 -23.236 -11.949
   12    HZ3  LYS  69           HZ2      LYS  69  -1.213 -22.701 -12.988
   13    HZ2  LYS  69           HZ3      LYS  69  -2.194 -21.574 -12.178

  No H/Q in entry =          13
  In of MODEL    7
    1    H    VAL  70           H        VAL  70  -0.698 -19.506  -5.552
    2    HA   VAL  70           HA       VAL  70  -1.951 -20.007  -2.909
    3    HB   VAL  70           HB       VAL  70  -0.955 -17.863  -2.166
    4   HG13  VAL  70          HG11      VAL  70   1.370 -18.659  -1.987
    5   HG12  VAL  70          HG12      VAL  70   1.073 -19.824  -3.279
    6   HG11  VAL  70          HG13      VAL  70   0.233 -19.985  -1.735
    7   HG23  VAL  70          HG21      VAL  70   0.832 -16.816  -3.585
    8   HG22  VAL  70          HG22      VAL  70  -0.760 -16.738  -4.336
    9   HG21  VAL  70          HG23      VAL  70   0.412 -17.930  -4.887

  No H/Q in entry =           9
  In of MODEL    7
    1    H    SER  71           H        SER  71  -3.402 -18.264  -2.228
    2    HA   SER  71           HA       SER  71  -5.336 -17.598  -4.194
    3    HB2  SER  71           HB2      SER  71  -5.804 -17.822  -1.726
    4    HB3  SER  71           HB3      SER  71  -4.936 -16.312  -1.469
    5    HG   SER  71           HG       SER  71  -7.342 -16.780  -2.874

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU  72           H        LEU  72  -5.464 -15.948  -5.531
    2    HA   LEU  72           HA       LEU  72  -3.314 -14.183  -6.001
    3    HB2  LEU  72           HB2      LEU  72  -6.175 -14.173  -6.958
    4    HB3  LEU  72           HB3      LEU  72  -4.953 -13.039  -7.526
    5    HG   LEU  72           HG       LEU  72  -4.609 -16.052  -7.664
    6   HD11  LEU  72          HD11      LEU  72  -5.559 -14.115  -9.797
    7   HD13  LEU  72          HD12      LEU  72  -6.532 -15.373  -9.036
    8   HD12  LEU  72          HD13      LEU  72  -5.170 -15.815 -10.065
    9   HD22  LEU  72          HD21      LEU  72  -2.470 -15.119  -7.907
   10   HD21  LEU  72          HD22      LEU  72  -3.069 -13.668  -8.693
   11   HD23  LEU  72          HD23      LEU  72  -3.019 -15.189  -9.578

  No H/Q in entry =          11
  In of MODEL    7
    1    H    VAL  73           H        VAL  73  -6.406 -13.761  -4.382
    2    HA   VAL  73           HA       VAL  73  -6.392 -10.991  -4.025
    3    HB   VAL  73           HB       VAL  73  -8.122 -11.314  -2.451
    4   HG11  VAL  73          HG11      VAL  73  -8.386 -12.216  -4.883
    5   HG13  VAL  73          HG12      VAL  73  -9.610 -12.639  -3.689
    6   HG12  VAL  73          HG13      VAL  73  -8.361 -13.807  -4.123
    7   HG23  VAL  73          HG21      VAL  73  -8.456 -13.824  -1.670
    8   HG22  VAL  73          HG22      VAL  73  -7.340 -12.765  -0.810
    9   HG21  VAL  73          HG23      VAL  73  -6.723 -13.928  -1.984

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LEU  74           H        LEU  74  -4.512 -13.404  -2.440
    2    HA   LEU  74           HA       LEU  74  -4.086 -12.278   0.087
    3    HB2  LEU  74           HB2      LEU  74  -3.348 -14.511  -0.409
    4    HB3  LEU  74           HB3      LEU  74  -2.281 -13.923  -1.683
    5    HG   LEU  74           HG       LEU  74  -0.947 -12.698  -0.002
    6   HD13  LEU  74          HD11      LEU  74  -2.495 -12.170   1.720
    7   HD12  LEU  74          HD12      LEU  74  -1.446 -13.394   2.439
    8   HD11  LEU  74          HD13      LEU  74  -3.046 -13.842   1.845
    9   HD21  LEU  74          HD21      LEU  74  -0.835 -15.287  -0.598
   10   HD23  LEU  74          HD22      LEU  74  -1.213 -15.417   1.105
   11   HD22  LEU  74          HD23      LEU  74   0.232 -14.568   0.606

  No H/Q in entry =          11
  In of MODEL    7
    1    H    VAL  75           H        VAL  75  -2.176 -11.919  -2.862
    2    HA   VAL  75           HA       VAL  75  -0.340 -10.036  -1.840
    3    HB   VAL  75           HB       VAL  75  -1.295 -10.494  -4.667
    4   HG11  VAL  75          HG11      VAL  75   1.013  -8.822  -3.578
    5   HG13  VAL  75          HG12      VAL  75  -0.387  -8.224  -4.455
    6   HG12  VAL  75          HG13      VAL  75   0.792  -9.236  -5.275
    7   HG23  VAL  75          HG21      VAL  75   1.351 -11.224  -3.397
    8   HG22  VAL  75          HG22      VAL  75   0.634 -11.866  -4.876
    9   HG21  VAL  75          HG23      VAL  75  -0.039 -12.308  -3.306

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLU  76           H        GLU  76  -3.476  -9.617  -3.509
    2    HA   GLU  76           HA       GLU  76  -3.466  -6.802  -3.604
    3    HB2  GLU  76           HB2      GLU  76  -5.152  -8.196  -4.777
    4    HB3  GLU  76           HB3      GLU  76  -5.819  -8.693  -3.231
    5    HG2  GLU  76           HG2      GLU  76  -7.238  -6.947  -4.093
    6    HG3  GLU  76           HG3      GLU  76  -6.340  -6.255  -2.756

  No H/Q in entry =           6
  In of MODEL    7
    1    H    ALA  77           H        ALA  77  -4.635  -9.011  -1.073
    2    HA   ALA  77           HA       ALA  77  -5.554  -6.993   0.687
    3    HB1  ALA  77           HB1      ALA  77  -4.443  -9.663   1.551
    4    HB2  ALA  77           HB2      ALA  77  -6.032  -9.494   0.807
    5    HB3  ALA  77           HB3      ALA  77  -5.688  -8.696   2.340

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLN  78           H        GLN  78  -2.440  -8.610   0.330
    2    HA   GLN  78           HA       GLN  78  -1.165  -7.483   2.588
    3    HB2  GLN  78           HB2      GLN  78  -0.342  -9.439   1.230
    4    HB3  GLN  78           HB3      GLN  78   0.124  -8.300  -0.029
    5    HG2  GLN  78           HG2      GLN  78   1.603  -7.141   1.561
    6    HG3  GLN  78           HG3      GLN  78   1.141  -8.278   2.825
    7   HE21  GLN  78          HE21      GLN  78   3.873  -8.045   1.972
    8   HE22  GLN  78          HE22      GLN  78   4.307  -9.488   1.190

  No H/Q in entry =           8
  In of MODEL    7
    1    H    LEU  79           H        LEU  79  -1.496  -6.406  -0.758
    2    HA   LEU  79           HA       LEU  79   0.240  -4.218  -0.733
    3    HB2  LEU  79           HB2      LEU  79  -0.797  -4.997  -2.793
    4    HB3  LEU  79           HB3      LEU  79  -2.394  -4.570  -2.189
    5    HG   LEU  79           HG       LEU  79  -1.796  -2.196  -2.156
    6   HD13  LEU  79          HD11      LEU  79   0.448  -2.004  -1.634
    7   HD12  LEU  79          HD12      LEU  79   0.510  -1.714  -3.372
    8   HD11  LEU  79          HD13      LEU  79   0.925  -3.303  -2.728
    9   HD23  LEU  79          HD21      LEU  79  -1.148  -2.006  -4.705
   10   HD22  LEU  79          HD22      LEU  79  -2.692  -2.720  -4.253
   11   HD21  LEU  79          HD23      LEU  79  -1.341  -3.758  -4.695

  No H/Q in entry =          11
  In of MODEL    7
    1    H    HIS  80           H        HIS  80  -3.233  -4.303   0.080
    2    HA   HIS  80           HA       HIS  80  -3.363  -1.545   0.749
    3    HB2  HIS  80           HB2      HIS  80  -5.121  -3.914   1.056
    4    HB3  HIS  80           HB3      HIS  80  -5.414  -2.570   2.162
    5    HD1  HIS  80           HD1      HIS  80  -6.990  -0.894   1.253
    6    HD2  HIS  80           HD2      HIS  80  -4.829  -2.749  -1.791
    7    HE1  HIS  80           HE1      HIS  80  -7.799   0.127  -0.927
    8    HE2  HIS  80           HE2      HIS  80  -6.487  -0.998  -2.792

  No H/Q in entry =           8
  In of MODEL    7
    1    H    LEU  81           H        LEU  81  -2.949  -4.454   2.737
    2    HA   LEU  81           HA       LEU  81  -2.914  -3.113   5.225
    3    HB2  LEU  81           HB2      LEU  81  -1.754  -5.756   4.343
    4    HB3  LEU  81           HB3      LEU  81  -1.721  -5.202   6.019
    5    HG   LEU  81           HG       LEU  81  -4.266  -5.391   4.381
    6   HD12  LEU  81          HD11      LEU  81  -4.622  -7.452   5.922
    7   HD11  LEU  81          HD12      LEU  81  -2.870  -7.423   6.115
    8   HD13  LEU  81          HD13      LEU  81  -3.578  -7.633   4.513
    9   HD23  LEU  81          HD21      LEU  81  -5.123  -5.580   6.878
   10   HD22  LEU  81          HD22      LEU  81  -4.758  -3.997   6.193
   11   HD21  LEU  81          HD23      LEU  81  -3.594  -4.788   7.256

  No H/Q in entry =          11
  In of MODEL    7
    1    H    MET  82           H        MET  82  -0.247  -4.075   3.062
    2    HA   MET  82           HA       MET  82   1.850  -3.234   4.755
    3    HB2  MET  82           HB2      MET  82   1.638  -3.563   1.762
    4    HB3  MET  82           HB3      MET  82   3.130  -3.030   2.532
    5    HG2  MET  82           HG2      MET  82   1.660  -5.587   3.245
    6    HG3  MET  82           HG3      MET  82   3.038  -5.507   2.150
    7    HE3  MET  82           HE1      MET  82   6.063  -4.847   4.146
    8    HE2  MET  82           HE2      MET  82   5.175  -3.457   3.528
    9    HE1  MET  82           HE3      MET  82   5.231  -4.947   2.589

  No H/Q in entry =           9
  In of MODEL    7
    1    H    THR  83           H        THR  83   0.077  -1.543   2.196
    2    HA   THR  83           HA       THR  83   1.547   0.870   2.293
    3    HB   THR  83           HB       THR  83  -0.603   1.849   1.301
    4    HG1  THR  83           HG1      THR  83  -2.284   0.593   1.185
    5   HG22  THR  83          HG21      THR  83  -0.369   0.030  -0.703
    6   HG21  THR  83          HG22      THR  83   1.121  -0.300   0.179
    7   HG23  THR  83          HG23      THR  83   0.801   1.323  -0.434

  No H/Q in entry =           7
  In of MODEL    7
    1    H    SER  84           H        SER  84  -1.489  -0.093   3.881
    2    HA   SER  84           HA       SER  84  -1.931   2.345   5.229
    3    HB2  SER  84           HB2      SER  84  -2.834  -0.473   5.784
    4    HB3  SER  84           HB3      SER  84  -3.299   0.877   6.819
    5    HG   SER  84           HG       SER  84  -3.755   0.581   4.024

  No H/Q in entry =           5
  In of MODEL    7
    1    H    MET  85           H        MET  85  -0.297  -0.630   6.358
    2    HA   MET  85           HA       MET  85   0.236   0.278   8.967
    3    HB2  MET  85           HB2      MET  85   0.474  -2.069   8.294
    4    HB3  MET  85           HB3      MET  85   1.862  -1.642   7.293
    5    HG2  MET  85           HG2      MET  85   3.074  -0.845   9.278
    6    HG3  MET  85           HG3      MET  85   1.677  -1.212  10.290
    7    HE1  MET  85           HE1      MET  85   4.147  -2.286   7.834
    8    HE3  MET  85           HE2      MET  85   3.272  -3.712   7.283
    9    HE2  MET  85           HE3      MET  85   4.696  -3.900   8.300

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LEU  86           H        LEU  86   2.187   0.493   6.023
    2    HA   LEU  86           HA       LEU  86   4.428   1.747   7.189
    3    HB2  LEU  86           HB2      LEU  86   4.218   0.674   4.877
    4    HB3  LEU  86           HB3      LEU  86   3.449   2.176   4.365
    5    HG   LEU  86           HG       LEU  86   5.503   3.370   5.355
    6   HD11  LEU  86          HD11      LEU  86   6.141   0.740   6.152
    7   HD13  LEU  86          HD12      LEU  86   7.180   2.160   6.256
    8   HD12  LEU  86          HD13      LEU  86   7.268   1.112   4.842
    9   HD23  LEU  86          HD21      LEU  86   6.185   1.595   3.003
   10   HD22  LEU  86          HD22      LEU  86   6.619   3.281   3.270
   11   HD21  LEU  86          HD23      LEU  86   4.957   2.855   2.865

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ALA  87           H        ALA  87   1.553   3.065   5.597
    2    HA   ALA  87           HA       ALA  87   2.214   5.779   5.688
    3    HB1  ALA  87           HB1      ALA  87  -0.133   4.210   5.136
    4    HB3  ALA  87           HB2      ALA  87   0.220   5.863   4.640
    5    HB2  ALA  87           HB3      ALA  87  -0.587   5.558   6.180

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ARG  88           H        ARG  88   0.467   3.815   8.069
    2    HA   ARG  88           HA       ARG  88  -0.001   5.873   9.918
    3    HB2  ARG  88           HB2      ARG  88  -0.997   3.544   9.976
    4    HB3  ARG  88           HB3      ARG  88   0.528   3.005  10.686
    5    HG2  ARG  88           HG2      ARG  88   0.097   5.087  12.309
    6    HG3  ARG  88           HG3      ARG  88  -1.575   4.804  11.846
    7    HD2  ARG  88           HD2      ARG  88  -1.732   2.955  13.089
    8    HD3  ARG  88           HD3      ARG  88  -0.156   2.336  12.562
    9    HE   ARG  88           HE       ARG  88  -0.667   3.607  15.017
   10   HH21  ARG  88          HH11      ARG  88   0.911   4.578  16.263
   11   HH22  ARG  88          HH12      ARG  88   2.443   4.969  15.564
   12   HH11  ARG  88          HH21      ARG  88   1.626   3.738  12.448
   13   HH12  ARG  88          HH22      ARG  88   2.856   4.477  13.416

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLU  89           H        GLU  89   2.741   3.586   9.700
    2    HA   GLU  89           HA       GLU  89   4.016   4.440  12.050
    3    HB2  GLU  89           HB2      GLU  89   4.630   2.409  10.705
    4    HB3  GLU  89           HB3      GLU  89   5.436   3.486   9.563
    5    HG2  GLU  89           HG2      GLU  89   6.935   4.293  11.313
    6    HG3  GLU  89           HG3      GLU  89   6.073   3.355  12.529

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LEU  90           H        LEU  90   4.373   5.596   8.726
    2    HA   LEU  90           HA       LEU  90   6.348   7.548   9.321
    3    HB2  LEU  90           HB2      LEU  90   4.343   7.269   7.086
    4    HB3  LEU  90           HB3      LEU  90   5.603   8.510   7.114
    5    HG   LEU  90           HG       LEU  90   6.205   5.557   7.445
    6   HD12  LEU  90          HD11      LEU  90   6.968   5.777   5.008
    7   HD11  LEU  90          HD12      LEU  90   5.987   7.242   4.959
    8   HD13  LEU  90          HD13      LEU  90   5.229   5.686   5.297
    9   HD22  LEU  90          HD21      LEU  90   8.127   6.660   8.136
   10   HD21  LEU  90          HD22      LEU  90   7.814   8.075   7.130
   11   HD23  LEU  90          HD23      LEU  90   8.442   6.596   6.403

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  91           H        ILE  91   2.811   7.648   9.160
    2    HA   ILE  91           HA       ILE  91   2.533  10.427   9.615
    3    HB   ILE  91           HB       ILE  91   0.684   8.093  10.147
    4   HG12  ILE  91          HG12      ILE  91   0.497  10.384   8.165
    5   HG13  ILE  91          HG13      ILE  91   1.323   8.870   7.793
    6   HG22  ILE  91          HG21      ILE  91  -0.999  10.192  10.208
    7   HG21  ILE  91          HG22      ILE  91   0.419  10.988  10.887
    8   HG23  ILE  91          HG23      ILE  91  -0.254   9.564  11.679
    9   HD13  ILE  91          HD11      ILE  91  -0.651   7.628   7.828
   10   HD12  ILE  91          HD12      ILE  91  -1.202   9.158   7.147
   11   HD11  ILE  91          HD13      ILE  91  -1.488   8.798   8.850

  No H/Q in entry =          11
  In of MODEL    7
    1    H    THR  92           H        THR  92   2.864   7.673  11.813
    2    HA   THR  92           HA       THR  92   2.444   9.052  14.237
    3    HB   THR  92           HB       THR  92   4.200   6.678  13.575
    4    HG1  THR  92           HG1      THR  92   2.215   5.966  13.466
    5   HG22  THR  92          HG21      THR  92   3.800   6.398  16.207
    6   HG21  THR  92          HG22      THR  92   3.777   8.158  16.136
    7   HG23  THR  92          HG23      THR  92   5.192   7.271  15.567

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLU  93           H        GLU  93   5.391   8.539  12.314
    2    HA   GLU  93           HA       GLU  93   7.170   9.923  14.020
    3    HB2  GLU  93           HB2      GLU  93   7.263   9.611  11.004
    4    HB3  GLU  93           HB3      GLU  93   8.611  10.109  12.025
    5    HG2  GLU  93           HG2      GLU  93   7.141   7.505  12.463
    6    HG3  GLU  93           HG3      GLU  93   8.531   7.627  11.392

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LEU  94           H        LEU  94   5.156  10.988  11.301
    2    HA   LEU  94           HA       LEU  94   6.022  13.674  11.208
    3    HB2  LEU  94           HB2      LEU  94   3.404  12.368  10.442
    4    HB3  LEU  94           HB3      LEU  94   3.702  14.090  10.205
    5    HG   LEU  94           HG       LEU  94   5.678  12.059   9.159
    6   HD11  LEU  94          HD11      LEU  94   2.954  12.672   8.087
    7   HD13  LEU  94          HD12      LEU  94   3.905  11.194   7.963
    8   HD12  LEU  94          HD13      LEU  94   4.275  12.568   6.922
    9   HD23  LEU  94          HD21      LEU  94   5.976  13.891   7.440
   10   HD22  LEU  94          HD22      LEU  94   6.395  14.372   9.084
   11   HD21  LEU  94          HD23      LEU  94   4.858  14.876   8.381

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  95           H        ILE  95   3.441  12.110  13.087
    2    HA   ILE  95           HA       ILE  95   2.446  14.481  14.282
    3    HB   ILE  95           HB       ILE  95   2.396  11.598  15.202
    4   HG12  ILE  95          HG12      ILE  95   0.219  13.421  14.146
    5   HG13  ILE  95          HG13      ILE  95   1.156  12.343  13.117
    6   HG21  ILE  95          HG21      ILE  95   1.163  14.096  16.402
    7   HG23  ILE  95          HG22      ILE  95   2.182  12.904  17.209
    8   HG22  ILE  95          HG23      ILE  95   0.539  12.479  16.727
    9   HD13  ILE  95          HD11      ILE  95   0.207  10.423  14.029
   10   HD12  ILE  95          HD12      ILE  95  -1.151  11.542  14.102
   11   HD11  ILE  95          HD13      ILE  95  -0.199  11.221  15.550

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLU  96           H        GLU  96   4.988  12.205  15.284
    2    HA   GLU  96           HA       GLU  96   5.559  13.388  17.780
    3    HB2  GLU  96           HB2      GLU  96   6.463  11.209  17.133
    4    HB3  GLU  96           HB3      GLU  96   7.417  11.965  15.858
    5    HG2  GLU  96           HG2      GLU  96   9.071  12.475  17.328
    6    HG3  GLU  96           HG3      GLU  96   7.938  13.311  18.379

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LEU  97           H        LEU  97   6.663  14.141  14.499
    2    HA   LEU  97           HA       LEU  97   8.588  16.096  15.222
    3    HB2  LEU  97           HB2      LEU  97   6.995  15.584  12.720
    4    HB3  LEU  97           HB3      LEU  97   8.044  16.993  12.848
    5    HG   LEU  97           HG       LEU  97   9.012  14.174  13.407
    6   HD12  LEU  97          HD11      LEU  97  10.022  14.350  11.095
    7   HD11  LEU  97          HD12      LEU  97   9.001  15.763  10.829
    8   HD13  LEU  97          HD13      LEU  97   8.267  14.186  11.118
    9   HD23  LEU  97          HD21      LEU  97  11.210  15.408  12.675
   10   HD22  LEU  97          HD22      LEU  97  10.590  15.688  14.302
   11   HD21  LEU  97          HD23      LEU  97  10.306  16.879  13.034

  No H/Q in entry =          11
  In of MODEL    7
    1    H    HIS  98           H        HIS  98   5.103  16.305  14.554
    2    HA   HIS  98           HA       HIS  98   4.861  19.110  14.692
    3    HB2  HIS  98           HB2      HIS  98   2.922  16.899  15.407
    4    HB3  HIS  98           HB3      HIS  98   2.490  18.609  15.463
    5    HD1  HIS  98           HD1      HIS  98   3.465  15.876  13.058
    6    HD2  HIS  98           HD2      HIS  98   2.171  19.838  12.936
    7    HE1  HIS  98           HE1      HIS  98   2.926  16.380  10.633
    8    HE2  HIS  98           HE2      HIS  98   2.142  18.786  10.537

  No H/Q in entry =           8
  In of MODEL    7
    1    H    GLU  99           H        GLU  99   4.933  16.616  17.188
    2    HA   GLU  99           HA       GLU  99   4.351  18.320  19.385
    3    HB2  GLU  99           HB2      GLU  99   4.210  15.840  19.478
    4    HB3  GLU  99           HB3      GLU  99   5.969  15.759  19.377
    5    HG2  GLU  99           HG2      GLU  99   6.176  17.044  21.454
    6    HG3  GLU  99           HG3      GLU  99   4.426  17.221  21.543

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LYS 100           H        LYS 100   7.391  17.328  17.832
    2    HA   LYS 100           HA       LYS 100   9.067  18.691  19.697
    3    HB2  LYS 100           HB2      LYS 100   9.558  17.761  16.859
    4    HB3  LYS 100           HB3      LYS 100  10.799  18.503  17.873
    5    HG2  LYS 100           HG2      LYS 100  10.380  16.758  19.610
    6    HG3  LYS 100           HG3      LYS 100   9.236  15.980  18.513
    7    HD2  LYS 100           HD2      LYS 100  11.031  15.662  16.853
    8    HD3  LYS 100           HD3      LYS 100  12.180  16.453  17.935
    9    HE2  LYS 100           HE2      LYS 100  11.740  14.703  19.649
   10    HE3  LYS 100           HE3      LYS 100  10.653  13.892  18.518
   11    HZ1  LYS 100           HZ1      LYS 100  13.489  14.504  17.875
   12    HZ3  LYS 100           HZ2      LYS 100  12.427  13.472  17.041
   13    HZ2  LYS 100           HZ3      LYS 100  13.000  13.038  18.581

  No H/Q in entry =          13
  In of MODEL    7
    1    H    LEU 101           H        LEU 101   7.405  19.657  16.736
    2    HA   LEU 101           HA       LEU 101   8.673  22.189  16.410
    3    HB2  LEU 101           HB2      LEU 101   6.057  21.011  15.511
    4    HB3  LEU 101           HB3      LEU 101   6.345  22.737  15.307
    5    HG   LEU 101           HG       LEU 101   8.342  20.680  14.347
    6   HD12  LEU 101          HD11      LEU 101   7.209  21.213  12.058
    7   HD11  LEU 101          HD12      LEU 101   5.815  21.671  13.033
    8   HD13  LEU 101          HD13      LEU 101   6.445  20.027  13.115
    9   HD21  LEU 101          HD21      LEU 101   7.777  23.606  13.793
   10   HD23  LEU 101          HD22      LEU 101   8.742  22.627  12.689
   11   HD22  LEU 101          HD23      LEU 101   9.283  22.871  14.350

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LYS 102           H        LYS 102   7.102  21.080  19.018
    2    HA   LYS 102           HA       LYS 102   6.485  22.181  20.949
    3    HB2  LYS 102           HB2      LYS 102   7.814  24.146  19.833
    4    HB3  LYS 102           HB3      LYS 102   6.230  24.785  19.452
    5    HG2  LYS 102           HG2      LYS 102   7.590  24.496  22.109
    6    HG3  LYS 102           HG3      LYS 102   6.668  25.845  21.479
    7    HD2  LYS 102           HD2      LYS 102   5.366  23.234  22.348
    8    HD3  LYS 102           HD3      LYS 102   5.638  24.588  23.435
    9    HE2  LYS 102           HE2      LYS 102   3.357  24.236  21.936
   10    HE3  LYS 102           HE3      LYS 102   3.890  25.769  22.623
   11    HZ2  LYS 102           HZ1      LYS 102   3.371  25.892  20.241
   12    HZ1  LYS 102           HZ2      LYS 102   4.611  24.784  19.921
   13    HZ3  LYS 102           HZ3      LYS 102   4.984  26.306  20.568

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ALA 103           H        ALA 103   4.891  23.763  18.178
    2    HA   ALA 103           HA       ALA 103   2.446  24.390  19.054
    3    HB1  ALA 103           HB1      ALA 103   1.539  23.571  16.807
    4    HB2  ALA 103           HB2      ALA 103   3.176  23.000  16.483
    5    HB3  ALA 103           HB3      ALA 103   2.877  24.718  16.751

  No H/Q in entry =           5
  In of MODEL    7
    1    H1   ALA   1           H3       ALA   1  10.200 -20.242  -6.262
    2    H2   ALA   1           H2       ALA   1   9.237 -20.425  -7.652
    3    H3   ALA   1           H1       ALA   1   8.778 -21.164  -6.192
    4    HA   ALA   1           HA       ALA   1   9.781 -22.994  -6.930
    5    HB1  ALA   1           HB1      ALA   1   9.893 -22.633  -9.205
    6    HB2  ALA   1           HB2      ALA   1  11.622 -22.521  -8.869
    7    HB3  ALA   1           HB3      ALA   1  10.656 -21.052  -9.021

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLU   2           H        GLU   2  12.044 -23.994  -6.981
    2    HA   GLU   2           HA       GLU   2  13.418 -23.946  -4.764
    3    HB2  GLU   2           HB2      GLU   2  14.787 -23.840  -7.458
    4    HB3  GLU   2           HB3      GLU   2  15.496 -24.469  -5.971
    5    HG2  GLU   2           HG2      GLU   2  14.436 -26.463  -6.219
    6    HG3  GLU   2           HG3      GLU   2  12.883 -25.682  -6.483

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLU   3           H        GLU   3  15.239 -22.117  -7.156
    2    HA   GLU   3           HA       GLU   3  16.422 -20.459  -5.189
    3    HB2  GLU   3           HB2      GLU   3  16.377 -20.450  -8.199
    4    HB3  GLU   3           HB3      GLU   3  17.149 -19.139  -7.307
    5    HG2  GLU   3           HG2      GLU   3  18.777 -20.552  -6.380
    6    HG3  GLU   3           HG3      GLU   3  17.799 -21.997  -6.607

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LEU   4           H        LEU   4  14.169 -19.556  -7.826
    2    HA   LEU   4           HA       LEU   4  13.758 -16.939  -7.212
    3    HB2  LEU   4           HB2      LEU   4  11.542 -18.864  -7.954
    4    HB3  LEU   4           HB3      LEU   4  11.507 -17.113  -8.149
    5    HG   LEU   4           HG       LEU   4  13.434 -19.017  -9.519
    6   HD13  LEU   4          HD11      LEU   4  12.143 -18.836 -11.433
    7   HD12  LEU   4          HD12      LEU   4  11.468 -17.277 -10.965
    8   HD11  LEU   4          HD13      LEU   4  10.879 -18.756 -10.209
    9   HD23  LEU   4          HD21      LEU   4  13.826 -16.777 -10.865
   10   HD22  LEU   4          HD22      LEU   4  14.674 -17.041  -9.343
   11   HD21  LEU   4          HD23      LEU   4  13.244 -16.013  -9.385

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLU   5           H        GLU   5  12.206 -19.692  -5.580
    2    HA   GLU   5           HA       GLU   5  10.557 -18.087  -3.881
    3    HB2  GLU   5           HB2      GLU   5  10.097 -20.463  -4.417
    4    HB3  GLU   5           HB3      GLU   5  11.502 -20.920  -3.451
    5    HG2  GLU   5           HG2      GLU   5   9.574 -21.113  -2.026
    6    HG3  GLU   5           HG3      GLU   5  10.463 -19.678  -1.515

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLU   6           H        GLU   6  13.666 -19.736  -3.429
    2    HA   GLU   6           HA       GLU   6  14.028 -18.893  -0.728
    3    HB2  GLU   6           HB2      GLU   6  15.219 -20.831  -1.691
    4    HB3  GLU   6           HB3      GLU   6  16.089 -19.747  -2.778
    5    HG2  GLU   6           HG2      GLU   6  17.064 -18.573  -0.853
    6    HG3  GLU   6           HG3      GLU   6  16.175 -19.622   0.250

  No H/Q in entry =           6
  In of MODEL    7
    1    H    VAL   7           H        VAL   7  14.834 -17.578  -3.873
    2    HA   VAL   7           HA       VAL   7  16.563 -15.490  -2.998
    3    HB   VAL   7           HB       VAL   7  14.858 -15.812  -5.482
    4   HG11  VAL   7          HG11      VAL   7  16.797 -13.642  -4.659
    5   HG13  VAL   7          HG12      VAL   7  15.160 -13.462  -5.288
    6   HG12  VAL   7          HG13      VAL   7  16.462 -13.991  -6.355
    7   HG21  VAL   7          HG21      VAL   7  16.931 -17.315  -4.909
    8   HG23  VAL   7          HG22      VAL   7  17.869 -15.873  -5.301
    9   HG22  VAL   7          HG23      VAL   7  16.821 -16.598  -6.517

  No H/Q in entry =           9
  In of MODEL    7
    1    H    VAL   8           H        VAL   8  13.067 -15.683  -3.568
    2    HA   VAL   8           HA       VAL   8  12.458 -12.962  -3.094
    3    HB   VAL   8           HB       VAL   8  10.791 -15.456  -2.670
    4   HG13  VAL   8          HG11      VAL   8   9.786 -13.786  -1.309
    5   HG12  VAL   8          HG12      VAL   8   8.885 -13.729  -2.824
    6   HG11  VAL   8          HG13      VAL   8  10.115 -12.515  -2.486
    7   HG21  VAL   8          HG21      VAL   8  11.703 -14.393  -5.043
    8   HG23  VAL   8          HG22      VAL   8  10.186 -13.521  -4.843
    9   HG22  VAL   8          HG23      VAL   8  10.189 -15.281  -4.890

  No H/Q in entry =           9
  In of MODEL    7
    1    H    MET   9           H        MET   9  12.657 -15.776  -0.918
    2    HA   MET   9           HA       MET   9  11.861 -14.492   1.451
    3    HB2  MET   9           HB2      MET   9  13.726 -16.803   0.918
    4    HB3  MET   9           HB3      MET   9  13.418 -16.222   2.555
    5    HG2  MET   9           HG2      MET   9  10.992 -16.560   2.216
    6    HG3  MET   9           HG3      MET   9  11.312 -17.163   0.589
    7    HE3  MET   9           HE1      MET   9  12.464 -18.994   4.602
    8    HE2  MET   9           HE2      MET   9  10.843 -18.364   4.321
    9    HE1  MET   9           HE3      MET   9  12.235 -17.295   4.170

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLY  10           H        GLY  10  15.042 -14.781  -0.094
    2    HA3  GLY  10           HA2      GLY  10  16.523 -13.394   1.884
    3    HA2  GLY  10           HA3      GLY  10  16.989 -13.566   0.192

  No H/Q in entry =           3
  In of MODEL    7
    1    H    LEU  11           H        LEU  11  14.851 -12.298  -1.053
    2    HA   LEU  11           HA       LEU  11  15.592  -9.568  -0.882
    3    HB2  LEU  11           HB2      LEU  11  13.200 -10.926  -2.129
    4    HB3  LEU  11           HB3      LEU  11  13.517  -9.198  -2.284
    5    HG   LEU  11           HG       LEU  11  15.504 -11.346  -3.068
    6   HD13  LEU  11          HD11      LEU  11  13.756 -11.675  -4.596
    7   HD12  LEU  11          HD12      LEU  11  14.786 -10.513  -5.430
    8   HD11  LEU  11          HD13      LEU  11  13.321  -9.965  -4.616
    9   HD22  LEU  11          HD21      LEU  11  16.774  -9.409  -2.835
   10   HD21  LEU  11          HD22      LEU  11  15.422  -8.344  -3.217
   11   HD23  LEU  11          HD23      LEU  11  16.240  -9.227  -4.504

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  12           H        ILE  12  12.782 -11.339   0.371
    2    HA   ILE  12           HA       ILE  12  11.430  -9.089   1.430
    3    HB   ILE  12           HB       ILE  12  11.405 -11.972   2.379
    4   HG12  ILE  12          HG12      ILE  12  10.747 -11.327  -0.075
    5   HG13  ILE  12          HG13      ILE  12   9.696 -12.399   0.830
    6   HG23  ILE  12          HG21      ILE  12  10.462 -10.585   4.113
    7   HG22  ILE  12          HG22      ILE  12   9.109 -11.324   3.256
    8   HG21  ILE  12          HG23      ILE  12   9.545  -9.645   2.938
    9   HD12  ILE  12          HD11      ILE  12   8.502 -10.577  -0.418
   10   HD11  ILE  12          HD12      ILE  12   9.323  -9.402   0.607
   11   HD13  ILE  12          HD13      ILE  12   8.206 -10.550   1.312

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  13           H        ILE  13  13.773 -11.344   2.841
    2    HA   ILE  13           HA       ILE  13  13.822 -10.170   5.423
    3    HB   ILE  13           HB       ILE  13  15.854 -11.781   3.861
    4   HG12  ILE  13          HG12      ILE  13  13.549 -12.689   4.718
    5   HG13  ILE  13          HG13      ILE  13  15.003 -13.655   4.948
    6   HG21  ILE  13          HG21      ILE  13  16.015 -10.616   6.630
    7   HG23  ILE  13          HG22      ILE  13  17.265 -10.700   5.397
    8   HG22  ILE  13          HG23      ILE  13  16.806 -12.152   6.285
    9   HD12  ILE  13          HD11      ILE  13  13.496 -13.441   7.008
   10   HD11  ILE  13          HD12      ILE  13  13.956 -11.742   7.048
   11   HD13  ILE  13          HD13      ILE  13  15.182 -12.988   7.251

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ASN  14           H        ASN  14  15.797  -9.672   2.513
    2    HA   ASN  14           HA       ASN  14  17.573  -7.765   3.585
    3    HB2  ASN  14           HB2      ASN  14  17.536  -9.027   1.267
    4    HB3  ASN  14           HB3      ASN  14  16.672  -7.592   0.729
    5   HD21  ASN  14          HD21      ASN  14  19.110  -7.975  -0.448
    6   HD22  ASN  14          HD22      ASN  14  20.271  -6.915   0.186

  No H/Q in entry =           6
  In of MODEL    7
    1    H    SER  15           H        SER  15  14.476  -7.357   1.881
    2    HA   SER  15           HA       SER  15  14.416  -4.535   1.942
    3    HB2  SER  15           HB2      SER  15  12.075  -4.740   1.448
    4    HB3  SER  15           HB3      SER  15  12.856  -6.106   0.662
    5    HG   SER  15           HG       SER  15  11.324  -7.110   1.756

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLY  16           H        GLY  16  13.268  -6.979   4.237
    2    HA3  GLY  16           HA2      GLY  16  12.072  -5.211   6.093
    3    HA2  GLY  16           HA3      GLY  16  12.656  -6.831   6.454

  No H/Q in entry =           3
  In of MODEL    7
    1    H    GLN  17           H        GLN  17  15.375  -6.546   5.873
    2    HA   GLN  17           HA       GLN  17  16.344  -5.346   8.260
    3    HB2  GLN  17           HB2      GLN  17  17.571  -7.146   7.123
    4    HB3  GLN  17           HB3      GLN  17  17.843  -6.097   5.731
    5    HG2  GLN  17           HG2      GLN  17  19.141  -4.551   7.104
    6    HG3  GLN  17           HG3      GLN  17  18.804  -5.508   8.545
    7   HE21  GLN  17          HE21      GLN  17  21.493  -5.046   7.709
    8   HE22  GLN  17          HE22      GLN  17  22.152  -6.517   7.180

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ALA  18           H        ALA  18  16.188  -4.260   4.901
    2    HA   ALA  18           HA       ALA  18  17.665  -1.893   5.138
    3    HB1  ALA  18           HB1      ALA  18  16.534  -3.085   3.064
    4    HB3  ALA  18           HB2      ALA  18  16.829  -1.346   3.052
    5    HB2  ALA  18           HB3      ALA  18  15.217  -1.964   3.414

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ARG  19           H        ARG  19  14.153  -2.420   5.519
    2    HA   ARG  19           HA       ARG  19  13.529   0.240   6.236
    3    HB2  ARG  19           HB2      ARG  19  11.820  -1.481   5.640
    4    HB3  ARG  19           HB3      ARG  19  12.141  -2.287   7.177
    5    HG2  ARG  19           HG2      ARG  19  11.461  -0.286   8.417
    6    HG3  ARG  19           HG3      ARG  19  11.232   0.597   6.908
    7    HD2  ARG  19           HD2      ARG  19   9.074  -0.163   7.718
    8    HD3  ARG  19           HD3      ARG  19   9.484  -1.047   6.242
    9    HE   ARG  19           HE       ARG  19  10.406  -2.609   8.349
   10   HH21  ARG  19          HH11      ARG  19   9.125  -4.229   9.280
   11   HH22  ARG  19          HH12      ARG  19   7.406  -4.171   9.102
   12   HH11  ARG  19          HH21      ARG  19   7.440  -1.263   7.243
   13   HH12  ARG  19          HH22      ARG  19   6.453  -2.492   7.945

  No H/Q in entry =          13
  In of MODEL    7
    1    H    SER  20           H        SER  20  14.329  -2.608   8.194
    2    HA   SER  20           HA       SER  20  14.054  -1.508  10.732
    3    HB2  SER  20           HB2      SER  20  14.651  -3.931  10.050
    4    HB3  SER  20           HB3      SER  20  16.322  -3.370  10.046
    5    HG   SER  20           HG       SER  20  14.462  -3.316  12.189

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU  21           H        LEU  21  16.907  -1.493   8.608
    2    HA   LEU  21           HA       LEU  21  18.600  -0.039  10.356
    3    HB2  LEU  21           HB2      LEU  21  18.586  -0.308   7.342
    4    HB3  LEU  21           HB3      LEU  21  19.850   0.533   8.235
    5    HG   LEU  21           HG       LEU  21  19.065  -2.349   8.760
    6   HD12  LEU  21          HD11      LEU  21  21.294  -2.799   7.578
    7   HD11  LEU  21          HD12      LEU  21  21.186  -1.149   6.969
    8   HD13  LEU  21          HD13      LEU  21  19.944  -2.326   6.545
    9   HD22  LEU  21          HD21      LEU  21  20.211  -1.681  10.680
   10   HD21  LEU  21          HD22      LEU  21  21.181  -0.486   9.827
   11   HD23  LEU  21          HD23      LEU  21  21.568  -2.192   9.681

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ALA  22           H        ALA  22  16.365   0.974   7.792
    2    HA   ALA  22           HA       ALA  22  16.951   3.722   7.813
    3    HB3  ALA  22           HB1      ALA  22  15.534   2.508   6.127
    4    HB2  ALA  22           HB2      ALA  22  14.852   4.032   6.693
    5    HB1  ALA  22           HB3      ALA  22  14.232   2.502   7.315

  No H/Q in entry =           5
  In of MODEL    7
    1    H    TYR  23           H        TYR  23  14.415   1.947   9.634
    2    HA   TYR  23           HA       TYR  23  13.486   4.199  11.083
    3    HB2  TYR  23           HB2      TYR  23  12.212   2.109  11.055
    4    HB3  TYR  23           HB3      TYR  23  13.526   1.271  11.880
    5    HD1  TYR  23           HD1      TYR  23  11.073   4.059  12.248
    6    HD2  TYR  23           HD2      TYR  23  13.718   1.321  14.237
    7    HE1  TYR  23           HE1      TYR  23  10.152   4.763  14.441
    8    HE2  TYR  23           HE2      TYR  23  12.797   2.023  16.429
    9    HH   TYR  23           HH       TYR  23  10.082   4.300  16.637

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ALA  24           H        ALA  24  16.087   1.875  11.728
    2    HA   ALA  24           HA       ALA  24  16.764   2.854  14.296
    3    HB1  ALA  24           HB1      ALA  24  18.089   1.037  14.134
    4    HB3  ALA  24           HB2      ALA  24  19.138   1.942  13.041
    5    HB2  ALA  24           HB3      ALA  24  17.828   0.958  12.392

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA  25           H        ALA  25  17.752   3.771  11.023
    2    HA   ALA  25           HA       ALA  25  19.729   5.669  11.681
    3    HB1  ALA  25           HB1      ALA  25  19.006   4.738   9.360
    4    HB3  ALA  25           HB2      ALA  25  19.537   6.416   9.459
    5    HB2  ALA  25           HB3      ALA  25  17.816   6.040   9.381

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU  26           H        LEU  26  16.221   5.963  11.304
    2    HA   LEU  26           HA       LEU  26  16.045   8.747  11.760
    3    HB2  LEU  26           HB2      LEU  26  14.166   7.548  10.821
    4    HB3  LEU  26           HB3      LEU  26  14.050   6.519  12.244
    5    HG   LEU  26           HG       LEU  26  13.474   8.485  13.626
    6   HD12  LEU  26          HD11      LEU  26  12.857  10.600  12.301
    7   HD11  LEU  26          HD12      LEU  26  13.832   9.932  10.995
    8   HD13  LEU  26          HD13      LEU  26  14.577  10.300  12.551
    9   HD21  LEU  26          HD21      LEU  26  11.804   8.208  11.108
   10   HD23  LEU  26          HD22      LEU  26  11.250   8.913  12.623
   11   HD22  LEU  26          HD23      LEU  26  11.670   7.204  12.552

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LYS  27           H        LYS  27  15.876   5.966  13.947
    2    HA   LYS  27           HA       LYS  27  15.298   7.339  16.315
    3    HB2  LYS  27           HB2      LYS  27  15.281   4.864  16.046
    4    HB3  LYS  27           HB3      LYS  27  17.045   4.883  16.010
    5    HG2  LYS  27           HG2      LYS  27  17.104   5.864  18.262
    6    HG3  LYS  27           HG3      LYS  27  15.338   5.916  18.300
    7    HD2  LYS  27           HD2      LYS  27  15.267   3.450  18.058
    8    HD3  LYS  27           HD3      LYS  27  17.031   3.406  18.054
    9    HE2  LYS  27           HE2      LYS  27  17.074   4.390  20.313
   10    HE3  LYS  27           HE3      LYS  27  15.309   4.464  20.320
   11    HZ3  LYS  27           HZ1      LYS  27  16.055   2.495  21.470
   12    HZ2  LYS  27           HZ2      LYS  27  16.968   2.001  20.122
   13    HZ1  LYS  27           HZ3      LYS  27  15.270   2.039  20.035

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLN  28           H        GLN  28  18.410   6.700  14.736
    2    HA   GLN  28           HA       GLN  28  20.106   7.747  16.735
    3    HB2  GLN  28           HB2      GLN  28  20.406   7.702  13.721
    4    HB3  GLN  28           HB3      GLN  28  21.697   8.146  14.838
    5    HG2  GLN  28           HG2      GLN  28  20.225   5.496  14.867
    6    HG3  GLN  28           HG3      GLN  28  21.816   5.753  14.155
    7   HE21  GLN  28          HE21      GLN  28  20.530   4.430  16.831
    8   HE22  GLN  28          HE22      GLN  28  21.711   4.837  17.981

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ALA  29           H        ALA  29  18.396   9.269  14.038
    2    HA   ALA  29           HA       ALA  29  19.445  11.869  14.301
    3    HB2  ALA  29           HB1      ALA  29  17.766  12.542  12.823
    4    HB1  ALA  29           HB2      ALA  29  16.596  11.390  13.467
    5    HB3  ALA  29           HB3      ALA  29  17.920  10.824  12.449

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LYS  30           H        LYS  30  16.631  10.322  15.807
    2    HA   LYS  30           HA       LYS  30  15.656  12.593  17.164
    3    HB2  LYS  30           HB2      LYS  30  15.482   9.654  17.861
    4    HB3  LYS  30           HB3      LYS  30  14.637  10.920  18.754
    5    HG2  LYS  30           HG2      LYS  30  13.536  11.632  16.632
    6    HG3  LYS  30           HG3      LYS  30  14.317  10.281  15.806
    7    HD2  LYS  30           HD2      LYS  30  13.206   8.694  17.327
    8    HD3  LYS  30           HD3      LYS  30  12.435  10.033  18.177
    9    HE2  LYS  30           HE2      LYS  30  11.289  10.694  16.080
   10    HE3  LYS  30           HE3      LYS  30  12.039   9.326  15.250
   11    HZ2  LYS  30           HZ1      LYS  30   9.719   8.962  16.119
   12    HZ1  LYS  30           HZ2      LYS  30  10.381   8.998  17.689
   13    HZ3  LYS  30           HZ3      LYS  30  10.869   7.805  16.579

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLN  31           H        GLN  31  18.269  10.368  17.908
    2    HA   GLN  31           HA       GLN  31  18.605  11.370  20.606
    3    HB2  GLN  31           HB2      GLN  31  20.602   9.761  19.006
    4    HB3  GLN  31           HB3      GLN  31  20.463   9.885  20.761
    5    HG2  GLN  31           HG2      GLN  31  17.933   8.986  19.979
    6    HG3  GLN  31           HG3      GLN  31  19.022   8.121  18.902
    7   HE21  GLN  31          HE21      GLN  31  17.446   7.003  21.169
    8   HE22  GLN  31          HE22      GLN  31  18.584   6.316  22.223

  No H/Q in entry =           8
  In of MODEL    7
    1    H    GLY  32           H        GLY  32  19.164  12.682  17.644
    2    HA3  GLY  32           HA2      GLY  32  20.193  14.708  17.138
    3    HA2  GLY  32           HA3      GLY  32  20.943  14.694  18.729

  No H/Q in entry =           3
  In of MODEL    7
    1    H    ASP  33           H        ASP  33  21.313  11.797  16.948
    2    HA   ASP  33           HA       ASP  33  24.154  12.414  16.496
    3    HB2  ASP  33           HB2      ASP  33  22.591   9.830  16.600
    4    HB3  ASP  33           HB3      ASP  33  24.282   9.912  16.113

  No H/Q in entry =           4
  In of MODEL    7
    1    H    PHE  34           H        PHE  34  23.708  13.751  14.615
    2    HA   PHE  34           HA       PHE  34  22.349  12.799  12.320
    3    HB2  PHE  34           HB2      PHE  34  24.522  14.889  12.563
    4    HB3  PHE  34           HB3      PHE  34  23.537  14.621  11.127
    5    HD1  PHE  34           HD1      PHE  34  23.815  16.544  14.045
    6    HD2  PHE  34           HD2      PHE  34  20.905  14.492  11.643
    7    HE1  PHE  34           HE1      PHE  34  22.024  17.977  14.988
    8    HE2  PHE  34           HE2      PHE  34  19.118  15.925  12.588
    9    HZ   PHE  34           HZ       PHE  34  19.681  17.668  14.256

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ALA  35           H        ALA  35  25.714  12.541  13.342
    2    HA   ALA  35           HA       ALA  35  26.813  11.702  10.888
    3    HB3  ALA  35           HB1      ALA  35  28.462  10.495  12.612
    4    HB2  ALA  35           HB2      ALA  35  27.615  11.536  13.756
    5    HB1  ALA  35           HB3      ALA  35  28.472  12.245  12.389

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA  36           H        ALA  36  25.646   9.764  13.645
    2    HA   ALA  36           HA       ALA  36  26.086   7.269  12.366
    3    HB2  ALA  36           HB1      ALA  36  25.631   6.528  14.438
    4    HB3  ALA  36           HB2      ALA  36  23.954   7.057  14.282
    5    HB1  ALA  36           HB3      ALA  36  25.175   8.163  14.912

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA  37           H        ALA  37  23.307   9.451  12.492
    2    HA   ALA  37           HA       ALA  37  21.421   7.721  11.305
    3    HB3  ALA  37           HB1      ALA  37  21.704  10.678  11.604
    4    HB1  ALA  37           HB2      ALA  37  20.369   9.625  12.069
    5    HB2  ALA  37           HB3      ALA  37  20.574  10.096  10.381

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LYS  38           H        LYS  38  23.575  10.143   9.840
    2    HA   LYS  38           HA       LYS  38  22.938   9.733   7.159
    3    HB2  LYS  38           HB2      LYS  38  24.772  11.252   8.615
    4    HB3  LYS  38           HB3      LYS  38  25.790  10.245   7.592
    5    HG2  LYS  38           HG2      LYS  38  24.649  11.042   5.592
    6    HG3  LYS  38           HG3      LYS  38  23.467  11.917   6.570
    7    HD2  LYS  38           HD2      LYS  38  25.090  13.483   7.332
    8    HD3  LYS  38           HD3      LYS  38  26.432  12.472   6.800
    9    HE2  LYS  38           HE2      LYS  38  26.118  14.353   5.251
   10    HE3  LYS  38           HE3      LYS  38  25.757  12.824   4.442
   11    HZ3  LYS  38           HZ1      LYS  38  23.570  13.311   4.304
   12    HZ2  LYS  38           HZ2      LYS  38  24.123  14.915   4.397
   13    HZ1  LYS  38           HZ3      LYS  38  23.528  14.140   5.785

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ALA  39           H        ALA  39  25.413   8.084   9.122
    2    HA   ALA  39           HA       ALA  39  26.461   6.479   7.054
    3    HB2  ALA  39           HB1      ALA  39  26.341   5.512   9.895
    4    HB1  ALA  39           HB2      ALA  39  27.323   6.920   9.486
    5    HB3  ALA  39           HB3      ALA  39  27.648   5.365   8.721

  No H/Q in entry =           5
  In of MODEL    7
    1    H    MET  40           H        MET  40  23.827   5.908   9.340
    2    HA   MET  40           HA       MET  40  23.336   3.214   8.598
    3    HB2  MET  40           HB2      MET  40  21.553   5.289   9.887
    4    HB3  MET  40           HB3      MET  40  21.115   3.588   9.707
    5    HG2  MET  40           HG2      MET  40  23.676   4.478  11.061
    6    HG3  MET  40           HG3      MET  40  22.173   4.229  11.947
    7    HE3  MET  40           HE1      MET  40  21.541   0.606  12.113
    8    HE2  MET  40           HE2      MET  40  20.700   1.926  11.304
    9    HE1  MET  40           HE3      MET  40  21.439   2.197  12.881

  No H/Q in entry =           9
  In of MODEL    7
    1    H    MET  41           H        MET  41  21.984   6.295   7.411
    2    HA   MET  41           HA       MET  41  20.012   5.140   5.729
    3    HB2  MET  41           HB2      MET  41  21.543   7.703   5.227
    4    HB3  MET  41           HB3      MET  41  20.010   7.239   4.501
    5    HG2  MET  41           HG2      MET  41  19.250   7.060   7.049
    6    HG3  MET  41           HG3      MET  41  20.579   8.192   7.279
    7    HE2  MET  41           HE1      MET  41  20.054   9.497   3.942
    8    HE1  MET  41           HE2      MET  41  21.012   9.916   5.359
    9    HE3  MET  41           HE3      MET  41  19.762  11.020   4.791

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ASP  42           H        ASP  42  23.404   6.002   5.192
    2    HA   ASP  42           HA       ASP  42  23.498   5.531   2.433
    3    HB2  ASP  42           HB2      ASP  42  25.260   6.493   4.212
    4    HB3  ASP  42           HB3      ASP  42  25.888   4.856   4.084

  No H/Q in entry =           4
  In of MODEL    7
    1    H    GLN  43           H        GLN  43  24.172   3.358   5.153
    2    HA   GLN  43           HA       GLN  43  24.801   1.092   3.568
    3    HB2  GLN  43           HB2      GLN  43  23.770   1.288   6.408
    4    HB3  GLN  43           HB3      GLN  43  24.325  -0.209   5.652
    5    HG2  GLN  43           HG2      GLN  43  26.512   0.963   5.152
    6    HG3  GLN  43           HG3      GLN  43  25.949   2.298   6.152
    7   HE21  GLN  43          HE21      GLN  43  28.160   1.282   7.196
    8   HE22  GLN  43          HE22      GLN  43  27.860   0.202   8.469

  No H/Q in entry =           8
  In of MODEL    7
    1    H    SER  44           H        SER  44  21.761   2.279   4.943
    2    HA   SER  44           HA       SER  44  20.154   0.066   4.259
    3    HB2  SER  44           HB2      SER  44  19.754   2.600   5.408
    4    HB3  SER  44           HB3      SER  44  18.725   2.579   3.978
    5    HG   SER  44           HG       SER  44  17.607   1.652   5.695

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ARG  45           H        ARG  45  20.958   3.020   2.463
    2    HA   ARG  45           HA       ARG  45  19.434   2.567   0.151
    3    HB2  ARG  45           HB2      ARG  45  20.615   4.680   0.745
    4    HB3  ARG  45           HB3      ARG  45  22.147   3.898   0.364
    5    HG2  ARG  45           HG2      ARG  45  21.365   3.512  -1.955
    6    HG3  ARG  45           HG3      ARG  45  19.846   4.317  -1.573
    7    HD2  ARG  45           HD2      ARG  45  21.132   6.389  -0.979
    8    HD3  ARG  45           HD3      ARG  45  22.617   5.589  -1.543
    9    HE   ARG  45           HE       ARG  45  20.691   5.391  -3.587
   10   HH21  ARG  45          HH11      ARG  45  20.716   6.763  -5.348
   11   HH22  ARG  45          HH12      ARG  45  21.501   8.299  -5.237
   12   HH11  ARG  45          HH21      ARG  45  22.460   7.853  -1.949
   13   HH12  ARG  45          HH22      ARG  45  22.488   8.915  -3.310

  No H/Q in entry =          13
  In of MODEL    7
    1    H    MET  46           H        MET  46  22.778   1.628   0.910
    2    HA   MET  46           HA       MET  46  23.371   0.429  -1.574
    3    HB2  MET  46           HB2      MET  46  24.461   0.080   1.219
    4    HB3  MET  46           HB3      MET  46  25.105  -0.828  -0.153
    5    HG2  MET  46           HG2      MET  46  25.603   1.262  -1.335
    6    HG3  MET  46           HG3      MET  46  24.898   2.197  -0.023
    7    HE3  MET  46           HE1      MET  46  27.595  -1.043   0.390
    8    HE2  MET  46           HE2      MET  46  28.804  -0.003  -0.357
    9    HE1  MET  46           HE3      MET  46  27.278  -0.305  -1.186

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ALA  47           H        ALA  47  21.952  -0.883   1.394
    2    HA   ALA  47           HA       ALA  47  21.849  -3.593   0.586
    3    HB2  ALA  47           HB1      ALA  47  21.471  -3.130   2.890
    4    HB3  ALA  47           HB2      ALA  47  19.925  -3.702   2.265
    5    HB1  ALA  47           HB3      ALA  47  20.187  -1.976   2.527

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU  48           H        LEU  48  19.549  -0.921   0.226
    2    HA   LEU  48           HA       LEU  48  17.479  -2.412  -1.035
    3    HB2  LEU  48           HB2      LEU  48  18.192   0.529  -1.142
    4    HB3  LEU  48           HB3      LEU  48  16.709  -0.151  -1.815
    5    HG   LEU  48           HG       LEU  48  17.547  -0.474   1.076
    6   HD13  LEU  48          HD11      LEU  48  17.175   1.834   0.892
    7   HD12  LEU  48          HD12      LEU  48  15.602   1.217   1.395
    8   HD11  LEU  48          HD13      LEU  48  15.887   1.636  -0.295
    9   HD22  LEU  48          HD21      LEU  48  15.986  -2.158   0.687
   10   HD21  LEU  48          HD22      LEU  48  15.134  -1.236  -0.552
   11   HD23  LEU  48          HD23      LEU  48  14.924  -0.830   1.151

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ASN  49           H        ASN  49  20.209  -0.535  -2.253
    2    HA   ASN  49           HA       ASN  49  19.565  -0.601  -4.979
    3    HB2  ASN  49           HB2      ASN  49  21.266   0.886  -4.078
    4    HB3  ASN  49           HB3      ASN  49  22.259  -0.483  -3.594
    5   HD21  ASN  49          HD21      ASN  49  20.887   1.106  -6.491
    6   HD22  ASN  49          HD22      ASN  49  22.114   0.590  -7.543

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLU  50           H        GLU  50  21.499  -2.838  -3.014
    2    HA   GLU  50           HA       GLU  50  22.172  -4.604  -5.141
    3    HB2  GLU  50           HB2      GLU  50  23.364  -4.606  -2.971
    4    HB3  GLU  50           HB3      GLU  50  21.906  -5.206  -2.180
    5    HG2  GLU  50           HG2      GLU  50  21.959  -7.238  -3.542
    6    HG3  GLU  50           HG3      GLU  50  23.350  -6.632  -4.438

  No H/Q in entry =           6
  In of MODEL    7
    1    H    ALA  51           H        ALA  51  19.511  -4.489  -2.823
    2    HA   ALA  51           HA       ALA  51  18.298  -6.937  -3.587
    3    HB3  ALA  51           HB1      ALA  51  16.711  -6.402  -2.036
    4    HB1  ALA  51           HB2      ALA  51  16.533  -4.751  -2.632
    5    HB2  ALA  51           HB3      ALA  51  17.881  -5.165  -1.573

  No H/Q in entry =           5
  In of MODEL    7
    1    H    HIS  52           H        HIS  52  17.782  -3.577  -4.619
    2    HA   HIS  52           HA       HIS  52  15.664  -4.059  -6.425
    3    HB2  HIS  52           HB2      HIS  52  16.364  -1.808  -5.615
    4    HB3  HIS  52           HB3      HIS  52  17.810  -1.933  -6.616
    5    HD1  HIS  52           HD1      HIS  52  17.458  -1.954  -9.229
    6    HD2  HIS  52           HD2      HIS  52  13.998  -1.207  -7.027
    7    HE1  HIS  52           HE1      HIS  52  15.744  -1.064 -10.867
    8    HE2  HIS  52           HE2      HIS  52  13.629  -0.603  -9.540

  No H/Q in entry =           8
  In of MODEL    7
    1    H    LEU  53           H        LEU  53  19.183  -4.134  -6.848
    2    HA   LEU  53           HA       LEU  53  19.241  -4.447  -9.649
    3    HB2  LEU  53           HB2      LEU  53  21.152  -5.253  -7.471
    4    HB3  LEU  53           HB3      LEU  53  21.466  -5.638  -9.161
    5    HG   LEU  53           HG       LEU  53  20.848  -2.819  -8.219
    6   HD12  LEU  53          HD11      LEU  53  23.372  -2.515  -8.512
    7   HD11  LEU  53          HD12      LEU  53  23.486  -4.275  -8.470
    8   HD13  LEU  53          HD13      LEU  53  22.862  -3.399  -7.077
    9   HD21  LEU  53          HD21      LEU  53  21.890  -4.061 -10.770
   10   HD23  LEU  53          HD22      LEU  53  22.276  -2.391 -10.369
   11   HD22  LEU  53          HD23      LEU  53  20.605  -2.873 -10.586

  No H/Q in entry =          11
  In of MODEL    7
    1    H    VAL  54           H        VAL  54  19.075  -6.834  -7.026
    2    HA   VAL  54           HA       VAL  54  19.158  -9.129  -8.688
    3    HB   VAL  54           HB       VAL  54  18.004  -8.686  -5.924
    4   HG12  VAL  54          HG11      VAL  54  18.277 -11.309  -5.922
    5   HG11  VAL  54          HG12      VAL  54  18.100 -11.135  -7.667
    6   HG13  VAL  54          HG13      VAL  54  16.819 -10.581  -6.592
    7   HG22  VAL  54          HG21      VAL  54  20.322  -8.520  -5.694
    8   HG21  VAL  54          HG22      VAL  54  20.642  -9.617  -7.036
    9   HG23  VAL  54          HG23      VAL  54  20.095 -10.255  -5.485

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLN  55           H        GLN  55  16.463  -7.175  -7.411
    2    HA   GLN  55           HA       GLN  55  14.413  -8.798  -8.492
    3    HB2  GLN  55           HB2      GLN  55  13.690  -7.260  -6.866
    4    HB3  GLN  55           HB3      GLN  55  14.511  -5.906  -7.638
    5    HG2  GLN  55           HG2      GLN  55  12.798  -5.547  -9.133
    6    HG3  GLN  55           HG3      GLN  55  12.443  -7.261  -9.305
    7   HE21  GLN  55          HE21      GLN  55  10.424  -7.773  -8.507
    8   HE22  GLN  55          HE22      GLN  55   9.661  -7.005  -7.200

  No H/Q in entry =           8
  In of MODEL    7
    1    H    THR  56           H        THR  56  16.210  -6.031  -9.844
    2    HA   THR  56           HA       THR  56  14.785  -5.639 -12.196
    3    HB   THR  56           HB       THR  56  17.805  -5.607 -12.022
    4    HG1  THR  56           HG1      THR  56  15.832  -3.854 -11.054
    5   HG22  THR  56          HG21      THR  56  17.492  -3.730 -13.659
    6   HG21  THR  56          HG22      THR  56  15.774  -4.123 -13.706
    7   HG23  THR  56          HG23      THR  56  16.963  -5.299 -14.270

  No H/Q in entry =           7
  In of MODEL    7
    1    H    LYS  57           H        LYS  57  17.390  -7.986 -11.580
    2    HA   LYS  57           HA       LYS  57  17.375  -9.178 -14.159
    3    HB2  LYS  57           HB2      LYS  57  19.157  -9.468 -12.415
    4    HB3  LYS  57           HB3      LYS  57  18.032 -10.435 -11.474
    5    HG2  LYS  57           HG2      LYS  57  17.898 -12.091 -13.265
    6    HG3  LYS  57           HG3      LYS  57  18.945 -11.111 -14.286
    7    HD2  LYS  57           HD2      LYS  57  20.774 -11.351 -12.634
    8    HD3  LYS  57           HD3      LYS  57  19.732 -12.358 -11.631
    9    HE2  LYS  57           HE2      LYS  57  20.455 -13.017 -14.507
   10    HE3  LYS  57           HE3      LYS  57  21.298 -13.687 -13.111
   11    HZ1  LYS  57           HZ1      LYS  57  18.805 -14.220 -12.434
   12    HZ3  LYS  57           HZ2      LYS  57  19.753 -15.282 -13.360
   13    HZ2  LYS  57           HZ3      LYS  57  18.633 -14.259 -14.121

  No H/Q in entry =          13
  In of MODEL    7
    1    H    LEU  58           H        LEU  58  15.574  -9.815 -11.189
    2    HA   LEU  58           HA       LEU  58  14.311 -12.165 -12.129
    3    HB2  LEU  58           HB2      LEU  58  13.546 -10.247  -9.934
    4    HB3  LEU  58           HB3      LEU  58  12.712 -11.769 -10.254
    5    HG   LEU  58           HG       LEU  58  15.688 -11.546  -9.691
    6   HD11  LEU  58          HD11      LEU  58  13.305 -11.921  -7.905
    7   HD13  LEU  58          HD12      LEU  58  14.775 -10.985  -7.638
    8   HD12  LEU  58          HD13      LEU  58  14.814 -12.743  -7.504
    9   HD22  LEU  58          HD21      LEU  58  15.535 -13.605 -10.721
   10   HD21  LEU  58          HD22      LEU  58  13.816 -13.783 -10.365
   11   HD23  LEU  58          HD23      LEU  58  15.016 -14.107  -9.112

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  59           H        ILE  59  13.703  -8.815 -12.810
    2    HA   ILE  59           HA       ILE  59  10.979  -9.413 -13.758
    3    HB   ILE  59           HB       ILE  59  11.825  -7.146 -12.549
    4   HG12  ILE  59          HG12      ILE  59   9.917  -7.009 -14.896
    5   HG13  ILE  59          HG13      ILE  59   9.488  -7.741 -13.371
    6   HG22  ILE  59          HG21      ILE  59  11.924  -6.337 -15.443
    7   HG21  ILE  59          HG22      ILE  59  13.391  -6.780 -14.599
    8   HG23  ILE  59          HG23      ILE  59  12.423  -5.418 -14.043
    9   HD13  ILE  59          HD11      ILE  59   9.963  -5.647 -12.186
   10   HD12  ILE  59          HD12      ILE  59   8.767  -5.380 -13.454
   11   HD11  ILE  59          HD13      ILE  59  10.444  -4.896 -13.709

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLU  60           H        GLU  60  14.201  -8.619 -15.007
    2    HA   GLU  60           HA       GLU  60  13.436  -8.203 -17.717
    3    HB2  GLU  60           HB2      GLU  60  15.624  -7.506 -16.869
    4    HB3  GLU  60           HB3      GLU  60  16.055  -9.184 -16.550
    5    HG2  GLU  60           HG2      GLU  60  15.875  -9.700 -18.955
    6    HG3  GLU  60           HG3      GLU  60  15.426  -8.027 -19.283

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLY  61           H        GLY  61  14.355 -11.103 -15.902
    2    HA3  GLY  61           HA2      GLY  61  13.790 -12.738 -18.306
    3    HA2  GLY  61           HA3      GLY  61  14.810 -13.240 -16.962

  No H/Q in entry =           3
  In of MODEL    7
    1    H    ASP  62           H        ASP  62  11.717 -11.637 -16.597
    2    HA   ASP  62           HA       ASP  62  10.751 -13.661 -14.834
    3    HB2  ASP  62           HB2      ASP  62   8.716 -12.283 -14.770
    4    HB3  ASP  62           HB3      ASP  62  10.165 -11.312 -14.535

  No H/Q in entry =           4
  In of MODEL    7
    1    H    ALA  63           H        ALA  63  11.090 -15.409 -16.651
    2    HA   ALA  63           HA       ALA  63   9.196 -15.613 -18.777
    3    HB3  ALA  63           HB1      ALA  63  10.007 -17.822 -19.070
    4    HB2  ALA  63           HB2      ALA  63  10.486 -17.956 -17.379
    5    HB1  ALA  63           HB3      ALA  63  11.393 -16.908 -18.471

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLY  64           H        GLY  64   9.249 -16.742 -15.441
    2    HA3  GLY  64           HA2      GLY  64   7.536 -17.346 -14.023
    3    HA2  GLY  64           HA3      GLY  64   6.393 -16.861 -15.270

  No H/Q in entry =           3
  In of MODEL    7
    1    H    GLU  65           H        GLU  65   5.105 -18.733 -14.768
    2    HA   GLU  65           HA       GLU  65   6.119 -21.362 -14.851
    3    HB2  GLU  65           HB2      GLU  65   3.325 -20.306 -15.262
    4    HB3  GLU  65           HB3      GLU  65   3.719 -22.022 -15.158
    5    HG2  GLU  65           HG2      GLU  65   4.675 -21.702 -12.931
    6    HG3  GLU  65           HG3      GLU  65   4.381 -19.967 -13.030

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLY  66           H        GLY  66   4.739 -19.328 -17.313
    2    HA3  GLY  66           HA2      GLY  66   5.665 -21.173 -19.405
    3    HA2  GLY  66           HA3      GLY  66   4.051 -20.498 -19.478

  No H/Q in entry =           3
  In of MODEL    7
    1    H    LYS  67           H        LYS  67   4.707 -19.731 -21.568
    2    HA   LYS  67           HA       LYS  67   6.825 -17.974 -22.043
    3    HB2  LYS  67           HB2      LYS  67   4.220 -18.367 -23.514
    4    HB3  LYS  67           HB3      LYS  67   5.582 -17.426 -24.136
    5    HG2  LYS  67           HG2      LYS  67   7.050 -19.421 -23.845
    6    HG3  LYS  67           HG3      LYS  67   5.645 -20.353 -23.336
    7    HD2  LYS  67           HD2      LYS  67   5.785 -18.929 -26.003
    8    HD3  LYS  67           HD3      LYS  67   6.285 -20.608 -25.782
    9    HE2  LYS  67           HE2      LYS  67   3.984 -21.006 -24.735
   10    HE3  LYS  67           HE3      LYS  67   3.535 -19.421 -25.366
   11    HZ3  LYS  67           HZ1      LYS  67   4.014 -20.149 -27.577
   12    HZ2  LYS  67           HZ2      LYS  67   2.967 -21.278 -26.862
   13    HZ1  LYS  67           HZ3      LYS  67   4.621 -21.631 -27.021

  No H/Q in entry =          13
  In of MODEL    7
    1    H    MET  68           H        MET  68   3.471 -16.968 -22.300
    2    HA   MET  68           HA       MET  68   3.949 -14.212 -22.015
    3    HB2  MET  68           HB2      MET  68   1.408 -15.809 -21.682
    4    HB3  MET  68           HB3      MET  68   1.487 -14.052 -21.825
    5    HG2  MET  68           HG2      MET  68   2.525 -16.014 -23.891
    6    HG3  MET  68           HG3      MET  68   1.005 -15.126 -24.007
    7    HE2  MET  68           HE1      MET  68   2.122 -12.060 -22.722
    8    HE1  MET  68           HE2      MET  68   0.782 -12.804 -23.591
    9    HE3  MET  68           HE3      MET  68   1.760 -11.572 -24.384

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LYS  69           H        LYS  69   2.908 -16.613 -19.580
    2    HA   LYS  69           HA       LYS  69   2.277 -14.706 -17.583
    3    HB2  LYS  69           HB2      LYS  69   2.860 -17.661 -17.425
    4    HB3  LYS  69           HB3      LYS  69   2.330 -16.697 -16.044
    5    HG2  LYS  69           HG2      LYS  69   0.323 -15.995 -17.294
    6    HG3  LYS  69           HG3      LYS  69   0.848 -16.957 -18.677
    7    HD2  LYS  69           HD2      LYS  69   0.725 -19.003 -17.315
    8    HD3  LYS  69           HD3      LYS  69   0.218 -18.049 -15.919
    9    HE2  LYS  69           HE2      LYS  69  -1.785 -17.303 -17.139
   10    HE3  LYS  69           HE3      LYS  69  -1.279 -18.232 -18.549
   11    HZ1  LYS  69           HZ1      LYS  69  -1.378 -20.244 -17.195
   12    HZ3  LYS  69           HZ2      LYS  69  -2.885 -19.465 -17.268
   13    HZ2  LYS  69           HZ3      LYS  69  -1.927 -19.338 -15.871

  No H/Q in entry =          13
  In of MODEL    7
    1    H    VAL  70           H        VAL  70   3.268 -14.440 -15.440
    2    HA   VAL  70           HA       VAL  70   6.231 -14.579 -15.508
    3    HB   VAL  70           HB       VAL  70   6.227 -12.455 -14.233
    4   HG13  VAL  70          HG11      VAL  70   5.579 -11.001 -16.119
    5   HG12  VAL  70          HG12      VAL  70   4.685 -12.339 -16.842
    6   HG11  VAL  70          HG13      VAL  70   6.440 -12.427 -16.698
    7   HG23  VAL  70          HG21      VAL  70   4.102 -11.150 -14.091
    8   HG22  VAL  70          HG22      VAL  70   4.008 -12.661 -13.187
    9   HG21  VAL  70          HG23      VAL  70   3.229 -12.529 -14.763

  No H/Q in entry =           9
  In of MODEL    7
    1    H    SER  71           H        SER  71   7.216 -14.574 -13.345
    2    HA   SER  71           HA       SER  71   6.136 -16.549 -11.623
    3    HB2  SER  71           HB2      SER  71   8.568 -16.005 -11.814
    4    HB3  SER  71           HB3      SER  71   8.256 -14.483 -10.982
    5    HG   SER  71           HG       SER  71   7.983 -17.135 -10.036

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU  72           H        LEU  72   4.728 -16.390  -9.999
    2    HA   LEU  72           HA       LEU  72   3.219 -14.049  -9.557
    3    HB2  LEU  72           HB2      LEU  72   3.455 -16.612  -7.988
    4    HB3  LEU  72           HB3      LEU  72   2.308 -15.335  -7.591
    5    HG   LEU  72           HG       LEU  72   2.453 -16.632 -10.333
    6   HD11  LEU  72          HD11      LEU  72   0.627 -17.264  -7.994
    7   HD13  LEU  72          HD12      LEU  72   1.874 -18.325  -8.645
    8   HD12  LEU  72          HD13      LEU  72   0.464 -17.922  -9.622
    9   HD22  LEU  72          HD21      LEU  72   1.267 -14.620 -10.583
   10   HD21  LEU  72          HD22      LEU  72   0.581 -14.693  -8.968
   11   HD23  LEU  72          HD23      LEU  72  -0.025 -15.760 -10.232

  No H/Q in entry =          11
  In of MODEL    7
    1    H    VAL  73           H        VAL  73   5.843 -15.537  -7.777
    2    HA   VAL  73           HA       VAL  73   5.803 -14.006  -5.443
    3    HB   VAL  73           HB       VAL  73   7.962 -14.862  -5.004
    4   HG11  VAL  73          HG11      VAL  73   5.972 -16.499  -5.415
    5   HG13  VAL  73          HG12      VAL  73   7.600 -17.165  -5.278
    6   HG12  VAL  73          HG13      VAL  73   6.862 -16.954  -6.866
    7   HG23  VAL  73          HG21      VAL  73   9.129 -16.043  -7.068
    8   HG22  VAL  73          HG22      VAL  73   9.334 -14.313  -6.798
    9   HG21  VAL  73          HG23      VAL  73   8.172 -14.887  -7.995

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LEU  74           H        LEU  74   6.820 -13.126  -8.614
    2    HA   LEU  74           HA       LEU  74   8.799 -11.215  -8.111
    3    HB2  LEU  74           HB2      LEU  74   8.340 -11.950 -10.352
    4    HB3  LEU  74           HB3      LEU  74   6.683 -11.357 -10.257
    5    HG   LEU  74           HG       LEU  74   7.527  -9.042 -10.031
    6   HD13  LEU  74          HD11      LEU  74   9.639  -9.261  -8.983
    7   HD12  LEU  74          HD12      LEU  74  10.037  -8.798 -10.637
    8   HD11  LEU  74          HD13      LEU  74  10.180 -10.482 -10.133
    9   HD21  LEU  74          HD21      LEU  74   7.254 -10.462 -12.255
   10   HD23  LEU  74          HD22      LEU  74   8.972 -10.156 -12.352
   11   HD22  LEU  74          HD23      LEU  74   7.861  -8.808 -12.289

  No H/Q in entry =          11
  In of MODEL    7
    1    H    VAL  75           H        VAL  75   5.313 -10.765  -8.477
    2    HA   VAL  75           HA       VAL  75   5.265  -8.008  -7.886
    3    HB   VAL  75           HB       VAL  75   3.137 -10.115  -7.517
    4   HG11  VAL  75          HG11      VAL  75   2.991  -7.073  -7.345
    5   HG13  VAL  75          HG12      VAL  75   2.687  -8.206  -6.036
    6   HG12  VAL  75          HG13      VAL  75   1.592  -8.140  -7.409
    7   HG23  VAL  75          HG21      VAL  75   3.333  -7.924  -9.591
    8   HG22  VAL  75          HG22      VAL  75   2.352  -9.388  -9.639
    9   HG21  VAL  75          HG23      VAL  75   4.101  -9.491  -9.839

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLU  76           H        GLU  76   4.950 -10.883  -5.782
    2    HA   GLU  76           HA       GLU  76   4.495  -9.516  -3.361
    3    HB2  GLU  76           HB2      GLU  76   4.275 -11.979  -3.598
    4    HB3  GLU  76           HB3      GLU  76   6.009 -12.111  -3.832
    5    HG2  GLU  76           HG2      GLU  76   5.553 -12.686  -1.537
    6    HG3  GLU  76           HG3      GLU  76   6.324 -11.111  -1.521

  No H/Q in entry =           6
  In of MODEL    7
    1    H    ALA  77           H        ALA  77   7.544 -10.478  -4.912
    2    HA   ALA  77           HA       ALA  77   9.244  -9.470  -2.888
    3    HB3  ALA  77           HB1      ALA  77   9.922  -9.605  -5.827
    4    HB1  ALA  77           HB2      ALA  77   9.878 -11.030  -4.789
    5    HB2  ALA  77           HB3      ALA  77  11.022  -9.732  -4.454

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLN  78           H        GLN  78   7.891  -8.022  -5.805
    2    HA   GLN  78           HA       GLN  78   9.290  -5.569  -5.691
    3    HB2  GLN  78           HB2      GLN  78   7.988  -6.453  -7.658
    4    HB3  GLN  78           HB3      GLN  78   6.508  -6.057  -6.789
    5    HG2  GLN  78           HG2      GLN  78   7.189  -3.697  -6.685
    6    HG3  GLN  78           HG3      GLN  78   8.680  -4.083  -7.542
    7   HE21  GLN  78          HE21      GLN  78   6.804  -2.231  -8.653
    8   HE22  GLN  78          HE22      GLN  78   6.117  -2.932 -10.039

  No H/Q in entry =           8
  In of MODEL    7
    1    H    LEU  79           H        LEU  79   6.243  -6.651  -4.277
    2    HA   LEU  79           HA       LEU  79   5.291  -4.227  -3.269
    3    HB2  LEU  79           HB2      LEU  79   3.937  -6.253  -3.222
    4    HB3  LEU  79           HB3      LEU  79   5.062  -7.015  -2.103
    5    HG   LEU  79           HG       LEU  79   4.533  -5.366  -0.376
    6   HD13  LEU  79          HD11      LEU  79   4.111  -3.341  -1.426
    7   HD12  LEU  79          HD12      LEU  79   2.474  -3.836  -0.996
    8   HD11  LEU  79          HD13      LEU  79   3.058  -4.067  -2.641
    9   HD23  LEU  79          HD21      LEU  79   1.937  -5.808  -0.299
   10   HD22  LEU  79          HD22      LEU  79   3.050  -7.169  -0.187
   11   HD21  LEU  79          HD23      LEU  79   2.250  -6.814  -1.716

  No H/Q in entry =          11
  In of MODEL    7
    1    H    HIS  80           H        HIS  80   7.420  -6.606  -1.679
    2    HA   HIS  80           HA       HIS  80   7.726  -5.073   0.694
    3    HB2  HIS  80           HB2      HIS  80   9.024  -7.461  -0.502
    4    HB3  HIS  80           HB3      HIS  80   9.945  -6.584   0.721
    5    HD1  HIS  80           HD1      HIS  80   9.430  -7.213   3.061
    6    HD2  HIS  80           HD2      HIS  80   6.211  -7.997   0.531
    7    HE1  HIS  80           HE1      HIS  80   7.630  -8.284   4.498
    8    HE2  HIS  80           HE2      HIS  80   5.661  -8.765   2.964

  No H/Q in entry =           8
  In of MODEL    7
    1    H    LEU  81           H        LEU  81   9.740  -5.384  -2.208
    2    HA   LEU  81           HA       LEU  81  11.814  -3.685  -1.316
    3    HB2  LEU  81           HB2      LEU  81  10.892  -4.455  -4.086
    4    HB3  LEU  81           HB3      LEU  81  12.330  -3.478  -3.786
    5    HG   LEU  81           HG       LEU  81  11.877  -6.193  -2.519
    6   HD12  LEU  81          HD11      LEU  81  13.689  -6.852  -4.260
    7   HD11  LEU  81          HD12      LEU  81  13.157  -5.416  -5.132
    8   HD13  LEU  81          HD13      LEU  81  12.017  -6.719  -4.802
    9   HD23  LEU  81          HD21      LEU  81  14.511  -5.930  -2.490
   10   HD22  LEU  81          HD22      LEU  81  13.537  -5.152  -1.244
   11   HD21  LEU  81          HD23      LEU  81  14.142  -4.210  -2.607

  No H/Q in entry =          11
  In of MODEL    7
    1    H    MET  82           H        MET  82   8.915  -2.987  -3.268
    2    HA   MET  82           HA       MET  82   9.512  -0.272  -3.762
    3    HB2  MET  82           HB2      MET  82   6.920  -1.814  -3.653
    4    HB3  MET  82           HB3      MET  82   6.957  -0.090  -4.015
    5    HG2  MET  82           HG2      MET  82   8.523  -2.193  -5.544
    6    HG3  MET  82           HG3      MET  82   6.972  -1.538  -6.064
    7    HE3  MET  82           HE1      MET  82   7.497   1.908  -7.229
    8    HE2  MET  82           HE2      MET  82   7.108   1.687  -5.524
    9    HE1  MET  82           HE3      MET  82   6.427   0.593  -6.724

  No H/Q in entry =           9
  In of MODEL    7
    1    H    THR  83           H        THR  83   7.674  -1.837  -1.169
    2    HA   THR  83           HA       THR  83   6.864   0.526   0.156
    3    HB   THR  83           HB       THR  83   6.686  -1.049   2.171
    4    HG1  THR  83           HG1      THR  83   7.405  -3.013   1.943
    5   HG22  THR  83          HG21      THR  83   5.009  -2.578   0.692
    6   HG21  THR  83          HG22      THR  83   5.269  -1.253  -0.437
    7   HG23  THR  83          HG23      THR  83   4.627  -0.927   1.173

  No H/Q in entry =           7
  In of MODEL    7
    1    H    SER  84           H        SER  84   9.641  -1.630   0.690
    2    HA   SER  84           HA       SER  84  10.718  -0.225   2.886
    3    HB2  SER  84           HB2      SER  84  11.944  -2.091   0.865
    4    HB3  SER  84           HB3      SER  84  12.899  -1.359   2.153
    5    HG   SER  84           HG       SER  84  10.588  -3.001   2.397

  No H/Q in entry =           5
  In of MODEL    7
    1    H    MET  85           H        MET  85  11.495   0.025  -0.598
    2    HA   MET  85           HA       MET  85  13.532   1.948  -0.333
    3    HB2  MET  85           HB2      MET  85  13.121   0.677  -2.402
    4    HB3  MET  85           HB3      MET  85  11.614   1.563  -2.639
    5    HG2  MET  85           HG2      MET  85  12.851   3.680  -2.766
    6    HG3  MET  85           HG3      MET  85  14.364   2.827  -2.470
    7    HE1  MET  85           HE1      MET  85  11.296   3.197  -4.408
    8    HE3  MET  85           HE2      MET  85  11.326   1.590  -5.126
    9    HE2  MET  85           HE3      MET  85  11.715   2.990  -6.115

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LEU  86           H        LEU  86  10.053   2.356  -0.860
    2    HA   LEU  86           HA       LEU  86  10.050   5.170  -1.038
    3    HB2  LEU  86           HB2      LEU  86   8.174   3.551  -1.627
    4    HB3  LEU  86           HB3      LEU  86   7.833   3.465   0.101
    5    HG   LEU  86           HG       LEU  86   7.726   6.029   0.052
    6   HD11  LEU  86          HD11      LEU  86   8.508   5.581  -2.646
    7   HD13  LEU  86          HD12      LEU  86   8.100   7.116  -1.886
    8   HD12  LEU  86          HD13      LEU  86   6.848   6.181  -2.699
    9   HD23  LEU  86          HD21      LEU  86   5.574   4.724  -1.624
   10   HD22  LEU  86          HD22      LEU  86   5.404   5.986  -0.407
   11   HD21  LEU  86          HD23      LEU  86   5.765   4.333   0.085

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ALA  87           H        ALA  87   9.522   2.998   1.702
    2    HA   ALA  87           HA       ALA  87   9.004   4.921   3.671
    3    HB1  ALA  87           HB1      ALA  87   9.752   2.084   3.585
    4    HB3  ALA  87           HB2      ALA  87   8.638   2.919   4.666
    5    HB2  ALA  87           HB3      ALA  87  10.365   2.913   5.019

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ARG  88           H        ARG  88  12.062   3.432   2.705
    2    HA   ARG  88           HA       ARG  88  13.690   4.773   4.548
    3    HB2  ARG  88           HB2      ARG  88  14.324   2.788   3.145
    4    HB3  ARG  88           HB3      ARG  88  14.507   3.879   1.775
    5    HG2  ARG  88           HG2      ARG  88  15.998   5.158   3.731
    6    HG3  ARG  88           HG3      ARG  88  16.280   3.462   4.109
    7    HD2  ARG  88           HD2      ARG  88  17.550   3.141   2.269
    8    HD3  ARG  88           HD3      ARG  88  16.438   4.038   1.231
    9    HE   ARG  88           HE       ARG  88  18.849   5.049   2.292
   10   HH21  ARG  88          HH11      ARG  88  19.243   7.260   2.103
   11   HH22  ARG  88          HH12      ARG  88  17.916   8.361   1.954
   12   HH11  ARG  88          HH21      ARG  88  15.528   5.874   1.998
   13   HH12  ARG  88          HH22      ARG  88  15.811   7.573   1.870

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLU  89           H        GLU  89  12.754   5.696   1.221
    2    HA   GLU  89           HA       GLU  89  14.352   8.023   1.076
    3    HB2  GLU  89           HB2      GLU  89  13.196   7.009  -0.879
    4    HB3  GLU  89           HB3      GLU  89  11.660   7.582  -0.228
    5    HG2  GLU  89           HG2      GLU  89  12.412   9.905  -0.384
    6    HG3  GLU  89           HG3      GLU  89  14.008   9.381  -0.913

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LEU  90           H        LEU  90  11.007   7.583   2.188
    2    HA   LEU  90           HA       LEU  90  10.547  10.326   2.765
    3    HB2  LEU  90           HB2      LEU  90   9.292   7.777   3.782
    4    HB3  LEU  90           HB3      LEU  90   8.693   9.385   4.204
    5    HG   LEU  90           HG       LEU  90   9.108   8.500   1.336
    6   HD12  LEU  90          HD11      LEU  90   6.567   8.226   1.385
    7   HD11  LEU  90          HD12      LEU  90   6.713   8.209   3.142
    8   HD13  LEU  90          HD13      LEU  90   7.509   6.964   2.180
    9   HD22  LEU  90          HD21      LEU  90   8.863  10.814   1.264
   10   HD21  LEU  90          HD22      LEU  90   7.870  10.865   2.720
   11   HD23  LEU  90          HD23      LEU  90   7.169  10.328   1.194

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  91           H        ILE  91  11.742   7.615   4.689
    2    HA   ILE  91           HA       ILE  91  11.899   8.973   7.160
    3    HB   ILE  91           HB       ILE  91  13.409   6.604   6.041
    4   HG12  ILE  91          HG12      ILE  91  11.385   6.811   8.291
    5   HG13  ILE  91          HG13      ILE  91  10.917   6.543   6.612
    6   HG22  ILE  91          HG21      ILE  91  13.861   6.377   8.684
    7   HG21  ILE  91          HG22      ILE  91  13.823   8.137   8.585
    8   HG23  ILE  91          HG23      ILE  91  14.987   7.225   7.625
    9   HD13  ILE  91          HD11      ILE  91  11.875   4.420   6.544
   10   HD12  ILE  91          HD12      ILE  91  11.275   4.488   8.201
   11   HD11  ILE  91          HD13      ILE  91  12.984   4.766   7.871

  No H/Q in entry =          11
  In of MODEL    7
    1    H    THR  92           H        THR  92  14.126   8.761   4.420
    2    HA   THR  92           HA       THR  92  16.315  10.106   5.592
    3    HB   THR  92           HB       THR  92  15.341  10.006   2.726
    4    HG1  THR  92           HG1      THR  92  16.130   8.091   3.132
    5   HG22  THR  92          HG21      THR  92  17.926  10.642   2.447
    6   HG21  THR  92          HG22      THR  92  17.628  11.467   3.976
    7   HG23  THR  92          HG23      THR  92  16.673  11.878   2.551

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLU  93           H        GLU  93  13.462  11.323   3.851
    2    HA   GLU  93           HA       GLU  93  14.114  14.071   3.972
    3    HB2  GLU  93           HB2      GLU  93  11.381  12.756   3.971
    4    HB3  GLU  93           HB3      GLU  93  11.707  14.449   3.603
    5    HG2  GLU  93           HG2      GLU  93  13.005  12.181   2.078
    6    HG3  GLU  93           HG3      GLU  93  11.475  12.898   1.585

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LEU  94           H        LEU  94  12.315  11.949   6.171
    2    HA   LEU  94           HA       LEU  94  11.538  13.909   8.047
    3    HB2  LEU  94           HB2      LEU  94  12.050  10.942   8.319
    4    HB3  LEU  94           HB3      LEU  94  11.492  11.927   9.668
    5    HG   LEU  94           HG       LEU  94  10.022  12.015   7.032
    6   HD11  LEU  94          HD11      LEU  94  10.048   9.789   9.033
    7   HD13  LEU  94          HD12      LEU  94   9.754   9.737   7.296
    8   HD12  LEU  94          HD13      LEU  94   8.481  10.279   8.389
    9   HD23  LEU  94          HD21      LEU  94   8.104  12.453   8.623
   10   HD22  LEU  94          HD22      LEU  94   9.369  13.680   8.668
   11   HD21  LEU  94          HD23      LEU  94   9.274  12.463   9.940

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  95           H        ILE  95  14.471  11.917   7.821
    2    HA   ILE  95           HA       ILE  95  15.646  12.811  10.242
    3    HB   ILE  95           HB       ILE  95  16.875  11.719   7.698
    4   HG12  ILE  95          HG12      ILE  95  16.540  10.521  10.462
    5   HG13  ILE  95          HG13      ILE  95  15.374  10.289   9.161
    6   HG21  ILE  95          HG21      ILE  95  18.134  12.495  10.348
    7   HG23  ILE  95          HG22      ILE  95  18.615  13.016   8.731
    8   HG22  ILE  95          HG23      ILE  95  18.884  11.349   9.239
    9   HD13  ILE  95          HD11      ILE  95  16.833   8.981   7.903
   10   HD12  ILE  95          HD12      ILE  95  17.288   8.520   9.541
   11   HD11  ILE  95          HD13      ILE  95  18.271   9.681   8.648

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLU  96           H        GLU  96  15.843  14.045   6.910
    2    HA   GLU  96           HA       GLU  96  17.731  16.083   7.399
    3    HB2  GLU  96           HB2      GLU  96  17.064  15.439   5.136
    4    HB3  GLU  96           HB3      GLU  96  15.431  16.030   5.429
    5    HG2  GLU  96           HG2      GLU  96  16.045  18.148   4.893
    6    HG3  GLU  96           HG3      GLU  96  17.338  18.119   6.082

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LEU  97           H        LEU  97  14.215  15.971   7.812
    2    HA   LEU  97           HA       LEU  97  13.854  18.712   8.456
    3    HB2  LEU  97           HB2      LEU  97  12.279  16.218   9.059
    4    HB3  LEU  97           HB3      LEU  97  11.796  17.775   9.730
    5    HG   LEU  97           HG       LEU  97  12.284  17.353   6.767
    6   HD12  LEU  97          HD11      LEU  97   9.759  17.279   6.637
    7   HD11  LEU  97          HD12      LEU  97   9.740  17.077   8.387
    8   HD13  LEU  97          HD13      LEU  97  10.500  15.854   7.367
    9   HD23  LEU  97          HD21      LEU  97  10.588  19.354   6.795
   10   HD22  LEU  97          HD22      LEU  97  12.275  19.676   7.196
   11   HD21  LEU  97          HD23      LEU  97  11.077  19.529   8.480

  No H/Q in entry =          11
  In of MODEL    7
    1    H    HIS  98           H        HIS  98  14.606  15.866  10.451
    2    HA   HIS  98           HA       HIS  98  14.463  17.126  12.968
    3    HB2  HIS  98           HB2      HIS  98  16.169  14.833  11.971
    4    HB3  HIS  98           HB3      HIS  98  16.171  15.369  13.653
    5    HD1  HIS  98           HD1      HIS  98  13.949  13.791  11.048
    6    HD2  HIS  98           HD2      HIS  98  13.843  14.706  15.114
    7    HE1  HIS  98           HE1      HIS  98  11.895  12.638  11.989
    8    HE2  HIS  98           HE2      HIS  98  11.810  13.188  14.461

  No H/Q in entry =           8
  In of MODEL    7
    1    H    GLU  99           H        GLU  99  17.025  16.960  10.545
    2    HA   GLU  99           HA       GLU  99  19.031  18.246  12.085
    3    HB2  GLU  99           HB2      GLU  99  19.492  16.952  10.016
    4    HB3  GLU  99           HB3      GLU  99  18.714  18.225   9.074
    5    HG2  GLU  99           HG2      GLU  99  20.354  19.859   9.875
    6    HG3  GLU  99           HG3      GLU  99  21.102  18.639  10.899

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LYS 100           H        LYS 100  16.543  19.466   9.860
    2    HA   LYS 100           HA       LYS 100  17.399  22.185  10.012
    3    HB2  LYS 100           HB2      LYS 100  14.742  20.955   9.243
    4    HB3  LYS 100           HB3      LYS 100  15.080  22.686   9.157
    5    HG2  LYS 100           HG2      LYS 100  17.049  22.197   7.698
    6    HG3  LYS 100           HG3      LYS 100  16.598  20.490   7.711
    7    HD2  LYS 100           HD2      LYS 100  14.419  21.048   6.702
    8    HD3  LYS 100           HD3      LYS 100  14.853  22.758   6.696
    9    HE2  LYS 100           HE2      LYS 100  16.808  22.238   5.245
   10    HE3  LYS 100           HE3      LYS 100  16.305  20.544   5.206
   11    HZ1  LYS 100           HZ1      LYS 100  14.533  22.777   4.367
   12    HZ3  LYS 100           HZ2      LYS 100  14.313  21.112   4.101
   13    HZ2  LYS 100           HZ3      LYS 100  15.546  21.949   3.287

  No H/Q in entry =          13
  In of MODEL    7
    1    H    LEU 101           H        LEU 101  15.249  20.182  11.964
    2    HA   LEU 101           HA       LEU 101  14.121  22.272  13.541
    3    HB2  LEU 101           HB2      LEU 101  14.496  19.313  13.921
    4    HB3  LEU 101           HB3      LEU 101  13.976  20.303  15.281
    5    HG   LEU 101           HG       LEU 101  12.572  20.427  12.606
    6   HD12  LEU 101          HD11      LEU 101  10.873  18.898  13.865
    7   HD11  LEU 101          HD12      LEU 101  12.254  18.452  14.865
    8   HD13  LEU 101          HD13      LEU 101  12.289  18.148  13.128
    9   HD21  LEU 101          HD21      LEU 101  11.920  21.229  15.457
   10   HD23  LEU 101          HD22      LEU 101  10.660  21.033  14.240
   11   HD22  LEU 101          HD23      LEU 101  11.923  22.241  14.010

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LYS 102           H        LYS 102  17.256  21.596  13.117
    2    HA   LYS 102           HA       LYS 102  19.116  22.424  14.199
    3    HB2  LYS 102           HB2      LYS 102  17.331  23.977  15.327
    4    HB3  LYS 102           HB3      LYS 102  17.508  22.908  16.703
    5    HG2  LYS 102           HG2      LYS 102  19.451  24.879  15.546
    6    HG3  LYS 102           HG3      LYS 102  19.054  24.570  17.223
    7    HD2  LYS 102           HD2      LYS 102  20.686  22.624  15.541
    8    HD3  LYS 102           HD3      LYS 102  21.400  23.929  16.479
    9    HE2  LYS 102           HE2      LYS 102  20.942  21.388  17.442
   10    HE3  LYS 102           HE3      LYS 102  21.187  22.823  18.436
   11    HZ2  LYS 102           HZ1      LYS 102  19.188  21.582  19.043
   12    HZ1  LYS 102           HZ2      LYS 102  18.556  21.829  17.492
   13    HZ3  LYS 102           HZ3      LYS 102  18.811  23.151  18.521

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ALA 103           H        ALA 103  16.999  20.861  16.609
    2    HA   ALA 103           HA       ALA 103  18.691  19.609  18.270
    3    HB2  ALA 103           HB1      ALA 103  17.063  17.638  18.253
    4    HB1  ALA 103           HB2      ALA 103  16.192  18.513  16.993
    5    HB3  ALA 103           HB3      ALA 103  16.379  19.227  18.594

  No H/Q in entry =           5
  In of MODEL    7
    1    H1   ALA   1           H3       ALA   1  -1.651  -6.726 -21.489
    2    H2   ALA   1           H2       ALA   1  -2.480  -8.143 -21.042
    3    H3   ALA   1           H1       ALA   1  -0.871  -8.228 -21.590
    4    HA   ALA   1           HA       ALA   1  -1.706  -8.675 -23.591
    5    HB1  ALA   1           HB1      ALA   1  -3.861  -9.346 -23.128
    6    HB2  ALA   1           HB2      ALA   1  -4.262  -7.824 -23.925
    7    HB3  ALA   1           HB3      ALA   1  -4.211  -7.909 -22.166

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLU   2           H        GLU   2  -2.500  -7.463 -25.582
    2    HA   GLU   2           HA       GLU   2  -1.052  -5.479 -26.449
    3    HB2  GLU   2           HB2      GLU   2  -4.058  -5.478 -26.780
    4    HB3  GLU   2           HB3      GLU   2  -2.913  -4.638 -27.823
    5    HG2  GLU   2           HG2      GLU   2  -2.447  -6.537 -28.979
    6    HG3  GLU   2           HG3      GLU   2  -2.178  -7.452 -27.502

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLU   3           H        GLU   3  -4.187  -4.153 -25.561
    2    HA   GLU   3           HA       GLU   3  -3.086  -1.622 -24.922
    3    HB2  GLU   3           HB2      GLU   3  -5.804  -2.876 -24.606
    4    HB3  GLU   3           HB3      GLU   3  -5.473  -1.269 -23.955
    5    HG2  GLU   3           HG2      GLU   3  -5.085  -0.347 -26.077
    6    HG3  GLU   3           HG3      GLU   3  -4.722  -1.909 -26.803

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LEU   4           H        LEU   4  -4.739  -3.949 -22.755
    2    HA   LEU   4           HA       LEU   4  -4.359  -2.734 -20.360
    3    HB2  LEU   4           HB2      LEU   4  -3.880  -5.686 -20.833
    4    HB3  LEU   4           HB3      LEU   4  -4.276  -4.933 -19.289
    5    HG   LEU   4           HG       LEU   4  -6.039  -4.962 -21.762
    6   HD13  LEU   4          HD11      LEU   4  -7.275  -6.654 -20.773
    7   HD12  LEU   4          HD12      LEU   4  -6.788  -6.208 -19.139
    8   HD11  LEU   4          HD13      LEU   4  -5.666  -7.075 -20.187
    9   HD23  LEU   4          HD21      LEU   4  -7.713  -4.116 -19.900
   10   HD22  LEU   4          HD22      LEU   4  -6.645  -2.967 -20.704
   11   HD21  LEU   4          HD23      LEU   4  -6.240  -3.570 -19.097

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLU   5           H        GLU   5  -1.895  -4.630 -22.083
    2    HA   GLU   5           HA       GLU   5   0.085  -4.395 -20.036
    3    HB2  GLU   5           HB2      GLU   5   0.113  -6.162 -21.795
    4    HB3  GLU   5           HB3      GLU   5   0.471  -4.920 -22.997
    5    HG2  GLU   5           HG2      GLU   5   2.566  -5.911 -22.351
    6    HG3  GLU   5           HG3      GLU   5   2.505  -4.306 -21.622

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLU   6           H        GLU   6  -0.497  -2.662 -23.080
    2    HA   GLU   6           HA       GLU   6   1.713  -0.880 -22.798
    3    HB2  GLU   6           HB2      GLU   6   0.609  -1.318 -24.969
    4    HB3  GLU   6           HB3      GLU   6  -0.852  -0.531 -24.371
    5    HG2  GLU   6           HG2      GLU   6   0.400   1.563 -24.042
    6    HG3  GLU   6           HG3      GLU   6   1.869   0.781 -24.623

  No H/Q in entry =           6
  In of MODEL    7
    1    H    VAL   7           H        VAL   7  -1.631  -0.878 -21.769
    2    HA   VAL   7           HA       VAL   7  -1.794   1.838 -20.928
    3    HB   VAL   7           HB       VAL   7  -3.317  -0.648 -20.104
    4   HG11  VAL   7          HG11      VAL   7  -3.630   2.247 -19.286
    5   HG13  VAL   7          HG12      VAL   7  -3.568   0.819 -18.253
    6   HG12  VAL   7          HG13      VAL   7  -4.989   1.123 -19.252
    7   HG21  VAL   7          HG21      VAL   7  -3.438   0.437 -22.491
    8   HG23  VAL   7          HG22      VAL   7  -4.359   1.705 -21.681
    9   HG22  VAL   7          HG23      VAL   7  -4.943   0.041 -21.660

  No H/Q in entry =           9
  In of MODEL    7
    1    H    VAL   8           H        VAL   8  -0.883  -1.173 -19.287
    2    HA   VAL   8           HA       VAL   8  -0.552  -0.106 -16.687
    3    HB   VAL   8           HB       VAL   8   0.802  -2.451 -18.042
    4   HG13  VAL   8          HG11      VAL   8   2.228  -1.844 -16.237
    5   HG12  VAL   8          HG12      VAL   8   1.206  -3.129 -15.595
    6   HG11  VAL   8          HG13      VAL   8   0.866  -1.448 -15.191
    7   HG21  VAL   8          HG21      VAL   8  -1.850  -2.176 -17.349
    8   HG23  VAL   8          HG22      VAL   8  -1.178  -2.832 -15.860
    9   HG22  VAL   8          HG23      VAL   8  -1.004  -3.723 -17.368

  No H/Q in entry =           9
  In of MODEL    7
    1    H    MET   9           H        MET   9   1.702  -0.452 -19.425
    2    HA   MET   9           HA       MET   9   4.006   0.535 -18.151
    3    HB2  MET   9           HB2      MET   9   3.072   0.593 -21.020
    4    HB3  MET   9           HB3      MET   9   4.605   1.318 -20.532
    5    HG2  MET   9           HG2      MET   9   5.313  -0.846 -19.563
    6    HG3  MET   9           HG3      MET   9   3.786  -1.568 -20.074
    7    HE3  MET   9           HE1      MET   9   7.207   0.027 -22.626
    8    HE2  MET   9           HE2      MET   9   7.512  -1.010 -21.237
    9    HE1  MET   9           HE3      MET   9   6.686   0.529 -21.015

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLY  10           H        GLY  10   1.367   2.203 -19.837
    2    HA3  GLY  10           HA2      GLY  10   2.392   4.832 -19.583
    3    HA2  GLY  10           HA3      GLY  10   0.693   4.413 -19.796

  No H/Q in entry =           3
  In of MODEL    7
    1    H    LEU  11           H        LEU  11   0.247   2.890 -17.515
    2    HA   LEU  11           HA       LEU  11  -0.245   4.875 -15.553
    3    HB2  LEU  11           HB2      LEU  11  -0.250   1.859 -15.404
    4    HB3  LEU  11           HB3      LEU  11  -0.740   2.890 -14.061
    5    HG   LEU  11           HG       LEU  11  -1.964   3.040 -16.829
    6   HD13  LEU  11          HD11      LEU  11  -2.602   0.909 -16.082
    7   HD12  LEU  11          HD12      LEU  11  -3.930   1.932 -15.540
    8   HD11  LEU  11          HD13      LEU  11  -2.691   1.419 -14.395
    9   HD22  LEU  11          HD21      LEU  11  -2.511   5.067 -15.821
   10   HD21  LEU  11          HD22      LEU  11  -2.459   4.395 -14.191
   11   HD23  LEU  11          HD23      LEU  11  -3.838   4.065 -15.240

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  12           H        ILE  12   2.240   2.349 -15.790
    2    HA   ILE  12           HA       ILE  12   3.447   2.852 -13.281
    3    HB   ILE  12           HB       ILE  12   4.689   1.790 -15.840
    4   HG12  ILE  12          HG12      ILE  12   2.639   0.604 -14.713
    5   HG13  ILE  12          HG13      ILE  12   4.018  -0.364 -15.193
    6   HG23  ILE  12          HG21      ILE  12   6.453   2.472 -14.332
    7   HG22  ILE  12          HG22      ILE  12   6.327   0.715 -14.240
    8   HG21  ILE  12          HG23      ILE  12   5.642   1.717 -12.962
    9   HD12  ILE  12          HD11      ILE  12   3.125  -0.885 -12.908
   10   HD11  ILE  12          HD12      ILE  12   3.576   0.745 -12.410
   11   HD13  ILE  12          HD13      ILE  12   4.810  -0.395 -12.902

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  13           H        ILE  13   4.092   4.108 -16.532
    2    HA   ILE  13           HA       ILE  13   6.267   5.775 -15.795
    3    HB   ILE  13           HB       ILE  13   4.249   5.903 -18.049
    4   HG12  ILE  13          HG12      ILE  13   6.057   4.031 -17.761
    5   HG13  ILE  13          HG13      ILE  13   5.822   4.772 -19.340
    6   HG21  ILE  13          HG21      ILE  13   6.561   7.723 -17.405
    7   HG23  ILE  13          HG22      ILE  13   4.946   8.149 -17.959
    8   HG22  ILE  13          HG23      ILE  13   6.103   7.442 -19.087
    9   HD12  ILE  13          HD11      ILE  13   8.259   4.551 -18.604
   10   HD11  ILE  13          HD12      ILE  13   7.896   5.742 -17.361
   11   HD13  ILE  13          HD13      ILE  13   7.754   6.177 -19.060

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ASN  14           H        ASN  14   2.774   6.354 -16.076
    2    HA   ASN  14           HA       ASN  14   2.796   9.099 -15.433
    3    HB2  ASN  14           HB2      ASN  14   0.867   7.505 -16.274
    4    HB3  ASN  14           HB3      ASN  14   0.534   7.331 -14.556
    5   HD21  ASN  14          HD21      ASN  14  -1.451   8.538 -15.994
    6   HD22  ASN  14          HD22      ASN  14  -1.474  10.212 -15.723

  No H/Q in entry =           6
  In of MODEL    7
    1    H    SER  15           H        SER  15   2.423   6.226 -13.364
    2    HA   SER  15           HA       SER  15   2.139   7.598 -10.913
    3    HB2  SER  15           HB2      SER  15   2.629   5.497  -9.867
    4    HB3  SER  15           HB3      SER  15   1.804   5.100 -11.370
    5    HG   SER  15           HG       SER  15   3.535   3.893 -11.598

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLY  16           H        GLY  16   4.995   6.436 -12.664
    2    HA3  GLY  16           HA2      GLY  16   6.930   7.143 -10.724
    3    HA2  GLY  16           HA3      GLY  16   7.235   6.937 -12.447

  No H/Q in entry =           3
  In of MODEL    7
    1    H    GLN  17           H        GLN  17   5.597   8.936 -13.512
    2    HA   GLN  17           HA       GLN  17   7.227  11.240 -13.192
    3    HB2  GLN  17           HB2      GLN  17   5.934  10.833 -15.246
    4    HB3  GLN  17           HB3      GLN  17   4.429  11.003 -14.343
    5    HG2  GLN  17           HG2      GLN  17   4.965  13.322 -13.803
    6    HG3  GLN  17           HG3      GLN  17   6.533  13.170 -14.596
    7   HE21  GLN  17          HE21      GLN  17   4.625  15.123 -15.462
    8   HE22  GLN  17          HE22      GLN  17   4.085  14.686 -17.011

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ALA  18           H        ALA  18   4.098  10.291 -11.858
    2    HA   ALA  18           HA       ALA  18   3.424  12.693 -10.590
    3    HB1  ALA  18           HB1      ALA  18   2.239  10.264 -10.822
    4    HB2  ALA  18           HB2      ALA  18   1.714  11.493  -9.674
    5    HB3  ALA  18           HB3      ALA  18   2.772  10.185  -9.143

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ARG  19           H        ARG  19   5.229   9.885  -9.309
    2    HA   ARG  19           HA       ARG  19   5.777  11.026  -6.783
    3    HB2  ARG  19           HB2      ARG  19   6.139   8.615  -7.313
    4    HB3  ARG  19           HB3      ARG  19   7.509   9.072  -8.328
    5    HG2  ARG  19           HG2      ARG  19   8.645  10.082  -6.399
    6    HG3  ARG  19           HG3      ARG  19   7.256   9.723  -5.373
    7    HD2  ARG  19           HD2      ARG  19   8.980   8.048  -5.012
    8    HD3  ARG  19           HD3      ARG  19   7.591   7.299  -5.805
    9    HE   ARG  19           HE       ARG  19   9.322   8.083  -7.844
   10   HH21  ARG  19          HH11      ARG  19  10.854   6.645  -8.691
   11   HH22  ARG  19          HH12      ARG  19  11.365   5.283  -7.756
   12   HH11  ARG  19          HH21      ARG  19   9.337   6.046  -5.069
   13   HH12  ARG  19          HH22      ARG  19  10.503   4.944  -5.705

  No H/Q in entry =          13
  In of MODEL    7
    1    H    SER  20           H        SER  20   7.607  11.021  -9.824
    2    HA   SER  20           HA       SER  20   9.880  12.384  -8.988
    3    HB2  SER  20           HB2      SER  20   9.338  11.372 -11.304
    4    HB3  SER  20           HB3      SER  20   8.596  12.929 -11.655
    5    HG   SER  20           HG       SER  20  11.279  12.380 -10.915

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU  21           H        LEU  21   6.814  13.724 -10.195
    2    HA   LEU  21           HA       LEU  21   7.544  16.454  -9.962
    3    HB2  LEU  21           HB2      LEU  21   4.844  15.089  -9.896
    4    HB3  LEU  21           HB3      LEU  21   5.049  16.838  -9.895
    5    HG   LEU  21           HG       LEU  21   6.215  15.022 -12.026
    6   HD12  LEU  21          HD11      LEU  21   4.307  16.026 -13.419
    7   HD11  LEU  21          HD12      LEU  21   3.577  16.493 -11.882
    8   HD13  LEU  21          HD13      LEU  21   3.856  14.789 -12.244
    9   HD22  LEU  21          HD21      LEU  21   7.403  17.020 -12.224
   10   HD21  LEU  21          HD22      LEU  21   6.085  18.003 -11.594
   11   HD23  LEU  21          HD23      LEU  21   6.015  17.397 -13.241

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ALA  22           H        ALA  22   5.973  14.193  -7.725
    2    HA   ALA  22           HA       ALA  22   5.401  16.009  -5.656
    3    HB3  ALA  22           HB1      ALA  22   4.589  13.634  -5.827
    4    HB2  ALA  22           HB2      ALA  22   5.181  14.090  -4.229
    5    HB1  ALA  22           HB3      ALA  22   6.188  13.112  -5.299

  No H/Q in entry =           5
  In of MODEL    7
    1    H    TYR  23           H        TYR  23   8.293  13.922  -6.087
    2    HA   TYR  23           HA       TYR  23   9.688  14.907  -3.827
    3    HB2  TYR  23           HB2      TYR  23  10.437  12.886  -4.988
    4    HB3  TYR  23           HB3      TYR  23  10.777  13.822  -6.442
    5    HD1  TYR  23           HD1      TYR  23  11.714  13.453  -2.847
    6    HD2  TYR  23           HD2      TYR  23  12.839  14.949  -6.715
    7    HE1  TYR  23           HE1      TYR  23  13.980  13.980  -1.986
    8    HE2  TYR  23           HE2      TYR  23  15.104  15.476  -5.853
    9    HH   TYR  23           HH       TYR  23  16.058  14.606  -2.543

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ALA  24           H        ALA  24   9.542  16.025  -7.192
    2    HA   ALA  24           HA       ALA  24  11.479  18.070  -6.934
    3    HB2  ALA  24           HB1      ALA  24  11.047  18.146  -9.144
    4    HB3  ALA  24           HB2      ALA  24   9.506  18.926  -8.789
    5    HB1  ALA  24           HB3      ALA  24   9.596  17.171  -8.922

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA  25           H        ALA  25   7.995  17.955  -6.327
    2    HA   ALA  25           HA       ALA  25   7.568  20.681  -5.754
    3    HB1  ALA  25           HB1      ALA  25   5.867  18.717  -5.966
    4    HB2  ALA  25           HB2      ALA  25   5.521  20.011  -4.816
    5    HB3  ALA  25           HB3      ALA  25   6.177  18.475  -4.246

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU  26           H        LEU  26   8.574  17.977  -3.705
    2    HA   LEU  26           HA       LEU  26   8.698  19.401  -1.265
    3    HB2  LEU  26           HB2      LEU  26   8.745  16.983  -1.264
    4    HB3  LEU  26           HB3      LEU  26  10.219  16.963  -2.229
    5    HG   LEU  26           HG       LEU  26  11.448  18.054  -0.382
    6   HD12  LEU  26          HD11      LEU  26  10.213  18.081   1.873
    7   HD11  LEU  26          HD12      LEU  26   8.727  17.975   0.932
    8   HD13  LEU  26          HD13      LEU  26   9.800  19.360   0.730
    9   HD21  LEU  26          HD21      LEU  26   9.863  15.615   0.480
   10   HD23  LEU  26          HD22      LEU  26  11.386  16.146   1.185
   11   HD22  LEU  26          HD23      LEU  26  11.336  15.591  -0.486

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LYS  27           H        LYS  27  11.113  18.786  -3.781
    2    HA   LYS  27           HA       LYS  27  13.315  19.982  -2.543
    3    HB2  LYS  27           HB2      LYS  27  13.399  18.637  -4.634
    4    HB3  LYS  27           HB3      LYS  27  12.663  19.985  -5.500
    5    HG2  LYS  27           HG2      LYS  27  14.555  21.433  -4.913
    6    HG3  LYS  27           HG3      LYS  27  15.286  20.125  -3.975
    7    HD2  LYS  27           HD2      LYS  27  15.411  18.739  -6.031
    8    HD3  LYS  27           HD3      LYS  27  14.725  20.072  -6.960
    9    HE2  LYS  27           HE2      LYS  27  16.638  21.500  -6.337
   10    HE3  LYS  27           HE3      LYS  27  17.328  20.171  -5.400
   11    HZ3  LYS  27           HZ1      LYS  27  18.328  20.256  -7.582
   12    HZ2  LYS  27           HZ2      LYS  27  16.802  20.168  -8.329
   13    HZ1  LYS  27           HZ3      LYS  27  17.397  18.844  -7.445

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLN  28           H        GLN  28  10.727  21.417  -4.499
    2    HA   GLN  28           HA       GLN  28  11.737  24.051  -4.643
    3    HB2  GLN  28           HB2      GLN  28   8.885  23.032  -4.546
    4    HB3  GLN  28           HB3      GLN  28   9.329  24.699  -4.912
    5    HG2  GLN  28           HG2      GLN  28  10.279  22.272  -6.463
    6    HG3  GLN  28           HG3      GLN  28   8.976  23.346  -6.971
    7   HE21  GLN  28          HE21      GLN  28  12.080  22.769  -7.727
    8   HE22  GLN  28          HE22      GLN  28  12.622  24.342  -8.065

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ALA  29           H        ALA  29   9.765  22.391  -2.217
    2    HA   ALA  29           HA       ALA  29   9.250  24.590  -0.534
    3    HB2  ALA  29           HB1      ALA  29   8.486  23.032   1.029
    4    HB1  ALA  29           HB2      ALA  29   9.686  21.826   0.566
    5    HB3  ALA  29           HB3      ALA  29   8.310  22.148  -0.487

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LYS  30           H        LYS  30  11.938  22.272  -0.597
    2    HA   LYS  30           HA       LYS  30  13.264  23.198   1.713
    3    HB2  LYS  30           HB2      LYS  30  14.346  21.896  -0.796
    4    HB3  LYS  30           HB3      LYS  30  15.330  22.234   0.630
    5    HG2  LYS  30           HG2      LYS  30  13.746  20.878   2.001
    6    HG3  LYS  30           HG3      LYS  30  12.859  20.475   0.527
    7    HD2  LYS  30           HD2      LYS  30  14.888  19.453  -0.428
    8    HD3  LYS  30           HD3      LYS  30  15.795  19.869   1.028
    9    HE2  LYS  30           HE2      LYS  30  14.259  18.463   2.374
   10    HE3  LYS  30           HE3      LYS  30  13.382  18.027   0.902
   11    HZ2  LYS  30           HZ1      LYS  30  15.141  16.414   1.667
   12    HZ1  LYS  30           HZ2      LYS  30  16.301  17.581   1.222
   13    HZ3  LYS  30           HZ3      LYS  30  15.258  16.918   0.052

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLN  31           H        GLN  31  13.190  24.410  -1.582
    2    HA   GLN  31           HA       GLN  31  15.376  26.262  -1.149
    3    HB2  GLN  31           HB2      GLN  31  13.343  26.351  -3.381
    4    HB3  GLN  31           HB3      GLN  31  14.975  27.016  -3.375
    5    HG2  GLN  31           HG2      GLN  31  15.385  24.311  -2.802
    6    HG3  GLN  31           HG3      GLN  31  14.085  24.283  -3.986
    7   HE21  GLN  31          HE21      GLN  31  16.915  23.438  -4.381
    8   HE22  GLN  31          HE22      GLN  31  17.510  24.403  -5.643

  No H/Q in entry =           8
  In of MODEL    7
    1    H    GLY  32           H        GLY  32  12.294  26.135  -0.016
    2    HA3  GLY  32           HA2      GLY  32  11.163  27.722   1.256
    3    HA2  GLY  32           HA3      GLY  32  12.313  28.937   0.713

  No H/Q in entry =           3
  In of MODEL    7
    1    H    ASP  33           H        ASP  33  10.923  27.063  -1.788
    2    HA   ASP  33           HA       ASP  33   9.304  29.368  -2.646
    3    HB2  ASP  33           HB2      ASP  33  10.358  26.931  -4.088
    4    HB3  ASP  33           HB3      ASP  33   9.230  28.069  -4.821

  No H/Q in entry =           4
  In of MODEL    7
    1    H    PHE  34           H        PHE  34   7.601  28.920  -1.089
    2    HA   PHE  34           HA       PHE  34   6.176  26.474  -1.003
    3    HB2  PHE  34           HB2      PHE  34   5.264  29.277  -0.322
    4    HB3  PHE  34           HB3      PHE  34   4.386  27.802   0.083
    5    HD1  PHE  34           HD1      PHE  34   6.675  30.156   1.311
    6    HD2  PHE  34           HD2      PHE  34   5.917  25.929   1.247
    7    HE1  PHE  34           HE1      PHE  34   8.054  29.876   3.352
    8    HE2  PHE  34           HE2      PHE  34   7.298  25.653   3.286
    9    HZ   PHE  34           HZ       PHE  34   8.360  27.628   4.338

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ALA  35           H        ALA  35   5.806  29.349  -3.011
    2    HA   ALA  35           HA       ALA  35   3.248  28.784  -4.046
    3    HB1  ALA  35           HB1      ALA  35   4.333  30.160  -6.077
    4    HB3  ALA  35           HB2      ALA  35   5.552  30.496  -4.848
    5    HB2  ALA  35           HB3      ALA  35   3.868  30.936  -4.563

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA  36           H        ALA  36   6.468  28.053  -5.390
    2    HA   ALA  36           HA       ALA  36   5.462  26.647  -7.640
    3    HB3  ALA  36           HB1      ALA  36   7.625  26.733  -8.247
    4    HB2  ALA  36           HB2      ALA  36   8.082  25.693  -6.897
    5    HB1  ALA  36           HB3      ALA  36   8.008  27.442  -6.679

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA  37           H        ALA  37   6.387  25.629  -4.383
    2    HA   ALA  37           HA       ALA  37   6.279  22.843  -4.818
    3    HB2  ALA  37           HB1      ALA  37   6.042  24.634  -2.437
    4    HB1  ALA  37           HB2      ALA  37   7.152  23.297  -2.728
    5    HB3  ALA  37           HB3      ALA  37   5.483  22.973  -2.263

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LYS  38           H        LYS  38   3.782  25.095  -3.655
    2    HA   LYS  38           HA       LYS  38   1.650  23.320  -3.444
    3    HB2  LYS  38           HB2      LYS  38   2.051  26.069  -3.186
    4    HB3  LYS  38           HB3      LYS  38   0.853  25.946  -4.470
    5    HG2  LYS  38           HG2      LYS  38  -0.625  24.647  -3.035
    6    HG3  LYS  38           HG3      LYS  38   0.613  24.562  -1.774
    7    HD2  LYS  38           HD2      LYS  38   0.468  26.901  -1.323
    8    HD3  LYS  38           HD3      LYS  38  -0.433  27.209  -2.808
    9    HE2  LYS  38           HE2      LYS  38  -1.943  27.267  -0.874
   10    HE3  LYS  38           HE3      LYS  38  -2.338  25.900  -1.920
   11    HZ3  LYS  38           HZ1      LYS  38  -1.645  24.413  -0.387
   12    HZ2  LYS  38           HZ2      LYS  38  -1.977  25.675   0.703
   13    HZ1  LYS  38           HZ3      LYS  38  -0.385  25.396   0.183

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ALA  39           H        ALA  39   2.674  25.210  -6.285
    2    HA   ALA  39           HA       ALA  39   0.590  24.384  -7.997
    3    HB2  ALA  39           HB1      ALA  39   3.341  24.984  -9.040
    4    HB1  ALA  39           HB2      ALA  39   2.395  26.261  -8.276
    5    HB3  ALA  39           HB3      ALA  39   1.773  25.437  -9.706

  No H/Q in entry =           5
  In of MODEL    7
    1    H    MET  40           H        MET  40   3.801  23.025  -7.408
    2    HA   MET  40           HA       MET  40   3.674  21.010  -9.404
    3    HB2  MET  40           HB2      MET  40   5.280  21.200  -6.849
    4    HB3  MET  40           HB3      MET  40   5.512  19.942  -8.065
    5    HG2  MET  40           HG2      MET  40   5.626  22.898  -8.724
    6    HG3  MET  40           HG3      MET  40   7.054  21.968  -8.271
    7    HE3  MET  40           HE1      MET  40   7.897  19.742 -11.081
    8    HE2  MET  40           HE2      MET  40   7.321  19.430  -9.446
    9    HE1  MET  40           HE3      MET  40   8.442  20.758  -9.739

  No H/Q in entry =           9
  In of MODEL    7
    1    H    MET  41           H        MET  41   2.747  21.063  -5.983
    2    HA   MET  41           HA       MET  41   2.164  18.308  -5.712
    3    HB2  MET  41           HB2      MET  41   0.869  20.687  -4.362
    4    HB3  MET  41           HB3      MET  41   0.681  19.011  -3.858
    5    HG2  MET  41           HG2      MET  41   3.395  19.185  -3.885
    6    HG3  MET  41           HG3      MET  41   2.983  20.850  -3.487
    7    HE2  MET  41           HE1      MET  41  -0.085  19.649  -1.776
    8    HE1  MET  41           HE2      MET  41   0.760  21.148  -2.147
    9    HE3  MET  41           HE3      MET  41   0.684  20.576  -0.480

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ASP  42           H        ASP  42   0.179  21.070  -6.689
    2    HA   ASP  42           HA       ASP  42  -2.286  19.754  -6.837
    3    HB2  ASP  42           HB2      ASP  42  -1.532  22.311  -7.086
    4    HB3  ASP  42           HB3      ASP  42  -1.684  21.922  -8.796

  No H/Q in entry =           4
  In of MODEL    7
    1    H    GLN  43           H        GLN  43   0.175  20.306  -9.329
    2    HA   GLN  43           HA       GLN  43  -1.228  19.015 -11.426
    3    HB2  GLN  43           HB2      GLN  43   1.738  19.478 -11.032
    4    HB3  GLN  43           HB3      GLN  43   1.019  18.853 -12.518
    5    HG2  GLN  43           HG2      GLN  43  -0.457  20.907 -12.562
    6    HG3  GLN  43           HG3      GLN  43   0.503  21.544 -11.229
    7   HE21  GLN  43          HE21      GLN  43   0.701  23.165 -13.312
    8   HE22  GLN  43          HE22      GLN  43   2.115  22.920 -14.214

  No H/Q in entry =           8
  In of MODEL    7
    1    H    SER  44           H        SER  44   1.094  17.829  -9.029
    2    HA   SER  44           HA       SER  44   1.386  15.219 -10.057
    3    HB2  SER  44           HB2      SER  44   2.298  16.638  -7.815
    4    HB3  SER  44           HB3      SER  44   1.409  15.268  -7.150
    5    HG   SER  44           HG       SER  44   3.510  14.612  -7.570

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ARG  45           H        ARG  45  -0.919  16.573  -7.726
    2    HA   ARG  45           HA       ARG  45  -2.349  14.236  -7.100
    3    HB2  ARG  45           HB2      ARG  45  -2.514  16.405  -5.905
    4    HB3  ARG  45           HB3      ARG  45  -3.353  17.089  -7.294
    5    HG2  ARG  45           HG2      ARG  45  -5.150  15.394  -7.021
    6    HG3  ARG  45           HG3      ARG  45  -4.322  14.765  -5.596
    7    HD2  ARG  45           HD2      ARG  45  -4.493  17.033  -4.536
    8    HD3  ARG  45           HD3      ARG  45  -5.465  17.572  -5.921
    9    HE   ARG  45           HE       ARG  45  -6.620  15.214  -4.890
   10   HH21  ARG  45          HH11      ARG  45  -8.459  15.319  -3.626
   11   HH22  ARG  45          HH12      ARG  45  -8.833  16.763  -2.756
   12   HH11  ARG  45          HH21      ARG  45  -6.023  18.449  -3.858
   13   HH12  ARG  45          HH22      ARG  45  -7.448  18.536  -2.886

  No H/Q in entry =          13
  In of MODEL    7
    1    H    MET  46           H        MET  46  -2.882  16.655  -9.649
    2    HA   MET  46           HA       MET  46  -5.237  15.524 -10.722
    3    HB2  MET  46           HB2      MET  46  -3.100  17.316 -11.885
    4    HB3  MET  46           HB3      MET  46  -4.487  16.786 -12.840
    5    HG2  MET  46           HG2      MET  46  -6.024  17.749 -11.205
    6    HG3  MET  46           HG3      MET  46  -4.680  18.202 -10.164
    7    HE3  MET  46           HE1      MET  46  -4.958  18.797 -14.341
    8    HE2  MET  46           HE2      MET  46  -6.220  19.977 -14.006
    9    HE1  MET  46           HE3      MET  46  -6.376  18.333 -13.389

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ALA  47           H        ALA  47  -1.814  14.988 -11.467
    2    HA   ALA  47           HA       ALA  47  -2.179  13.271 -13.682
    3    HB3  ALA  47           HB1      ALA  47   0.011  14.123 -13.320
    4    HB2  ALA  47           HB2      ALA  47   0.122  12.392 -12.989
    5    HB1  ALA  47           HB3      ALA  47   0.044  13.543 -11.654

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU  48           H        LEU  48  -1.934  12.624 -10.208
    2    HA   LEU  48           HA       LEU  48  -2.076   9.787 -10.372
    3    HB2  LEU  48           HB2      LEU  48  -2.816  11.713  -8.158
    4    HB3  LEU  48           HB3      LEU  48  -2.752   9.961  -7.960
    5    HG   LEU  48           HG       LEU  48  -0.421  11.623  -8.945
    6   HD13  LEU  48          HD11      LEU  48  -0.700  12.394  -6.754
    7   HD12  LEU  48          HD12      LEU  48   0.441  11.067  -6.554
    8   HD11  LEU  48          HD13      LEU  48  -1.263  10.832  -6.163
    9   HD22  LEU  48          HD21      LEU  48   0.043   9.431  -9.588
   10   HD21  LEU  48          HD22      LEU  48  -0.844   8.728  -8.237
   11   HD23  LEU  48          HD23      LEU  48   0.740   9.454  -7.969

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ASN  49           H        ASN  49  -4.498  12.319  -9.976
    2    HA   ASN  49           HA       ASN  49  -6.714  10.691  -9.448
    3    HB2  ASN  49           HB2      ASN  49  -6.758  13.101  -9.109
    4    HB3  ASN  49           HB3      ASN  49  -6.538  13.382 -10.832
    5   HD21  ASN  49          HD21      ASN  49  -8.831  11.988  -8.473
    6   HD22  ASN  49          HD22      ASN  49 -10.208  12.229  -9.433

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLU  50           H        GLU  50  -5.402  11.871 -12.528
    2    HA   GLU  50           HA       GLU  50  -7.371  10.652 -14.184
    3    HB2  GLU  50           HB2      GLU  50  -5.871  12.447 -14.989
    4    HB3  GLU  50           HB3      GLU  50  -4.496  11.352 -14.847
    5    HG2  GLU  50           HG2      GLU  50  -5.489   9.835 -16.491
    6    HG3  GLU  50           HG3      GLU  50  -6.932  10.838 -16.582

  No H/Q in entry =           6
  In of MODEL    7
    1    H    ALA  51           H        ALA  51  -4.222   9.604 -12.967
    2    HA   ALA  51           HA       ALA  51  -4.118   7.152 -14.389
    3    HB2  ALA  51           HB1      ALA  51  -2.147   6.829 -13.282
    4    HB1  ALA  51           HB2      ALA  51  -2.834   7.260 -11.716
    5    HB3  ALA  51           HB3      ALA  51  -2.352   8.525 -12.846

  No H/Q in entry =           5
  In of MODEL    7
    1    H    HIS  52           H        HIS  52  -5.290   7.998 -11.144
    2    HA   HIS  52           HA       HIS  52  -6.023   5.398 -10.320
    3    HB2  HIS  52           HB2      HIS  52  -5.856   7.373  -8.816
    4    HB3  HIS  52           HB3      HIS  52  -7.321   8.023  -9.554
    5    HD1  HIS  52           HD1      HIS  52  -9.555   6.691  -9.143
    6    HD2  HIS  52           HD2      HIS  52  -6.286   5.280  -6.978
    7    HE1  HIS  52           HE1      HIS  52 -10.487   5.150  -7.363
    8    HE2  HIS  52           HE2      HIS  52  -8.505   4.282  -6.033

  No H/Q in entry =           8
  In of MODEL    7
    1    H    LEU  53           H        LEU  53  -7.794   7.890 -12.111
    2    HA   LEU  53           HA       LEU  53 -10.321   6.641 -12.136
    3    HB2  LEU  53           HB2      LEU  53  -8.996   8.602 -13.998
    4    HB3  LEU  53           HB3      LEU  53 -10.605   7.965 -14.326
    5    HG   LEU  53           HG       LEU  53  -9.876   9.264 -11.681
    6   HD12  LEU  53          HD11      LEU  53 -11.165  11.243 -12.651
    7   HD11  LEU  53          HD12      LEU  53 -10.967  10.477 -14.228
    8   HD13  LEU  53          HD13      LEU  53  -9.553  10.986 -13.308
    9   HD21  LEU  53          HD21      LEU  53 -12.441   8.416 -13.032
   10   HD23  LEU  53          HD22      LEU  53 -12.451   9.704 -11.833
   11   HD22  LEU  53          HD23      LEU  53 -11.924   8.093 -11.383

  No H/Q in entry =          11
  In of MODEL    7
    1    H    VAL  54           H        VAL  54  -7.565   6.400 -14.362
    2    HA   VAL  54           HA       VAL  54  -8.810   4.654 -16.213
    3    HB   VAL  54           HB       VAL  54  -5.897   5.109 -15.518
    4   HG12  VAL  54          HG11      VAL  54  -5.658   4.024 -17.908
    5   HG11  VAL  54          HG12      VAL  54  -7.202   3.269 -17.512
    6   HG13  VAL  54          HG13      VAL  54  -5.795   2.988 -16.488
    7   HG22  VAL  54          HG21      VAL  54  -6.628   7.067 -16.562
    8   HG21  VAL  54          HG22      VAL  54  -7.832   6.226 -17.537
    9   HG23  VAL  54          HG23      VAL  54  -6.125   6.117 -17.960

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLN  55           H        GLN  55  -6.833   4.068 -13.306
    2    HA   GLN  55           HA       GLN  55  -6.792   1.250 -13.567
    3    HB2  GLN  55           HB2      GLN  55  -5.228   2.116 -12.040
    4    HB3  GLN  55           HB3      GLN  55  -6.430   3.102 -11.214
    5    HG2  GLN  55           HG2      GLN  55  -7.155   1.355  -9.902
    6    HG3  GLN  55           HG3      GLN  55  -6.946   0.167 -11.182
    7   HE21  GLN  55          HE21      GLN  55  -5.351  -1.312 -10.683
    8   HE22  GLN  55          HE22      GLN  55  -3.964  -0.987  -9.764

  No H/Q in entry =           8
  In of MODEL    7
    1    H    THR  56           H        THR  56  -9.092   3.451 -11.959
    2    HA   THR  56           HA       THR  56 -10.715   1.594 -10.680
    3    HB   THR  56           HB       THR  56 -11.758   4.004 -12.186
    4    HG1  THR  56           HG1      THR  56 -10.324   3.750  -9.782
    5   HG22  THR  56          HG21      THR  56 -13.356   4.032 -10.246
    6   HG21  THR  56          HG22      THR  56 -12.675   2.488  -9.731
    7   HG23  THR  56          HG23      THR  56 -13.512   2.612 -11.279

  No H/Q in entry =           7
  In of MODEL    7
    1    H    LYS  57           H        LYS  57 -10.882   2.686 -14.065
    2    HA   LYS  57           HA       LYS  57 -13.065   1.039 -14.831
    3    HB2  LYS  57           HB2      LYS  57 -12.150   2.975 -16.142
    4    HB3  LYS  57           HB3      LYS  57 -10.725   2.013 -16.503
    5    HG2  LYS  57           HG2      LYS  57 -12.087   0.369 -17.686
    6    HG3  LYS  57           HG3      LYS  57 -13.555   1.242 -17.265
    7    HD2  LYS  57           HD2      LYS  57 -12.750   3.204 -18.548
    8    HD3  LYS  57           HD3      LYS  57 -11.297   2.312 -18.993
    9    HE2  LYS  57           HE2      LYS  57 -14.116   1.381 -19.638
   10    HE3  LYS  57           HE3      LYS  57 -13.097   2.264 -20.774
   11    HZ1  LYS  57           HZ1      LYS  57 -11.423   0.358 -20.070
   12    HZ3  LYS  57           HZ2      LYS  57 -12.526   0.177 -21.349
   13    HZ2  LYS  57           HZ3      LYS  57 -12.876  -0.479 -19.820

  No H/Q in entry =          13
  In of MODEL    7
    1    H    LEU  58           H        LEU  58  -9.569   0.545 -14.759
    2    HA   LEU  58           HA       LEU  58  -9.616  -1.969 -16.052
    3    HB2  LEU  58           HB2      LEU  58  -7.567  -0.717 -14.232
    4    HB3  LEU  58           HB3      LEU  58  -7.330  -2.241 -15.087
    5    HG   LEU  58           HG       LEU  58  -8.031   0.378 -16.450
    6   HD11  LEU  58          HD11      LEU  58  -5.410  -0.907 -15.749
    7   HD13  LEU  58          HD12      LEU  58  -5.875   0.793 -15.700
    8   HD12  LEU  58          HD13      LEU  58  -5.543   0.018 -17.246
    9   HD22  LEU  58          HD21      LEU  58  -8.627  -1.171 -18.046
   10   HD21  LEU  58          HD22      LEU  58  -7.612  -2.438 -17.362
   11   HD23  LEU  58          HD23      LEU  58  -6.894  -1.176 -18.362

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  59           H        ILE  59 -10.436  -1.057 -12.803
    2    HA   ILE  59           HA       ILE  59 -10.139  -3.831 -11.858
    3    HB   ILE  59           HB       ILE  59  -9.662  -1.573 -10.454
    4   HG12  ILE  59          HG12      ILE  59 -11.070  -3.909  -9.145
    5   HG13  ILE  59          HG13      ILE  59  -9.422  -4.003  -9.716
    6   HG22  ILE  59          HG21      ILE  59 -12.437  -2.253  -9.523
    7   HG21  ILE  59          HG22      ILE  59 -12.193  -1.014 -10.732
    8   HG23  ILE  59          HG23      ILE  59 -11.474  -0.848  -9.133
    9   HD13  ILE  59          HD11      ILE  59  -8.788  -2.117  -8.289
   10   HD12  ILE  59          HD12      ILE  59  -9.482  -3.415  -7.326
   11   HD11  ILE  59          HD13      ILE  59 -10.447  -1.990  -7.713

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLU  60           H        GLU  60 -12.652  -1.470 -12.675
    2    HA   GLU  60           HA       GLU  60 -14.867  -2.949 -11.674
    3    HB2  GLU  60           HB2      GLU  60 -15.081  -0.590 -12.245
    4    HB3  GLU  60           HB3      GLU  60 -14.680  -0.928 -13.926
    5    HG2  GLU  60           HG2      GLU  60 -16.713  -2.345 -14.107
    6    HG3  GLU  60           HG3      GLU  60 -17.128  -1.934 -12.456

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLY  61           H        GLY  61 -13.179  -2.959 -14.781
    2    HA3  GLY  61           HA2      GLY  61 -14.927  -5.172 -15.682
    3    HA2  GLY  61           HA3      GLY  61 -14.058  -4.081 -16.755

  No H/Q in entry =           3
  In of MODEL    7
    1    H    ASP  62           H        ASP  62 -12.724  -5.558 -13.866
    2    HA   ASP  62           HA       ASP  62 -10.467  -6.557 -15.317
    3    HB2  ASP  62           HB2      ASP  62  -9.776  -7.406 -13.093
    4    HB3  ASP  62           HB3      ASP  62 -10.238  -5.709 -13.043

  No H/Q in entry =           4
  In of MODEL    7
    1    H    ALA  63           H        ALA  63 -12.060  -7.903 -16.788
    2    HA   ALA  63           HA       ALA  63 -13.197 -10.331 -15.818
    3    HB2  ALA  63           HB1      ALA  63 -13.458 -10.903 -18.122
    4    HB3  ALA  63           HB2      ALA  63 -12.085  -9.910 -18.603
    5    HB1  ALA  63           HB3      ALA  63 -13.586  -9.146 -18.076

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLY  64           H        GLY  64 -10.044  -9.481 -17.130
    2    HA3  GLY  64           HA2      GLY  64  -7.991 -10.503 -16.918
    3    HA2  GLY  64           HA3      GLY  64  -8.725 -11.657 -15.813

  No H/Q in entry =           3
  In of MODEL    7
    1    H    GLU  65           H        GLU  65  -7.523 -13.361 -16.834
    2    HA   GLU  65           HA       GLU  65  -7.654 -13.907 -19.595
    3    HB2  GLU  65           HB2      GLU  65  -7.060 -15.695 -17.241
    4    HB3  GLU  65           HB3      GLU  65  -6.921 -16.220 -18.919
    5    HG2  GLU  65           HG2      GLU  65  -5.304 -14.448 -19.378
    6    HG3  GLU  65           HG3      GLU  65  -5.482 -13.830 -17.736

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLY  66           H        GLY  66  -9.627 -14.952 -16.928
    2    HA3  GLY  66           HA2      GLY  66 -11.649 -16.001 -18.786
    3    HA2  GLY  66           HA3      GLY  66 -11.167 -16.940 -17.385

  No H/Q in entry =           3
  In of MODEL    7
    1    H    LYS  67           H        LYS  67 -13.407 -16.916 -16.827
    2    HA   LYS  67           HA       LYS  67 -14.918 -14.615 -16.339
    3    HB2  LYS  67           HB2      LYS  67 -15.157 -17.410 -15.232
    4    HB3  LYS  67           HB3      LYS  67 -16.388 -16.155 -15.038
    5    HG2  LYS  67           HG2      LYS  67 -16.465 -15.887 -17.514
    6    HG3  LYS  67           HG3      LYS  67 -15.316 -17.214 -17.670
    7    HD2  LYS  67           HD2      LYS  67 -17.973 -17.505 -16.249
    8    HD3  LYS  67           HD3      LYS  67 -17.756 -17.856 -17.966
    9    HE2  LYS  67           HE2      LYS  67 -15.825 -19.385 -17.260
   10    HE3  LYS  67           HE3      LYS  67 -16.430 -19.213 -15.611
   11    HZ3  LYS  67           HZ1      LYS  67 -18.547 -20.085 -16.302
   12    HZ2  LYS  67           HZ2      LYS  67 -17.322 -21.175 -16.745
   13    HZ1  LYS  67           HZ3      LYS  67 -18.035 -20.174 -17.916

  No H/Q in entry =          13
  In of MODEL    7
    1    H    MET  68           H        MET  68 -13.952 -16.798 -13.769
    2    HA   MET  68           HA       MET  68 -14.234 -14.953 -11.668
    3    HB2  MET  68           HB2      MET  68 -12.708 -17.555 -11.799
    4    HB3  MET  68           HB3      MET  68 -13.097 -16.686 -10.314
    5    HG2  MET  68           HG2      MET  68 -15.131 -17.706 -12.319
    6    HG3  MET  68           HG3      MET  68 -14.744 -18.478 -10.779
    7    HE2  MET  68           HE1      MET  68 -14.424 -15.573  -8.839
    8    HE1  MET  68           HE2      MET  68 -14.577 -17.325  -8.718
    9    HE3  MET  68           HE3      MET  68 -15.849 -16.290  -8.072

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LYS  69           H        LYS  69 -11.285 -15.957 -13.428
    2    HA   LYS  69           HA       LYS  69  -9.485 -14.663 -11.673
    3    HB2  LYS  69           HB2      LYS  69  -9.178 -15.617 -14.520
    4    HB3  LYS  69           HB3      LYS  69  -7.839 -14.990 -13.556
    5    HG2  LYS  69           HG2      LYS  69  -8.269 -16.706 -11.833
    6    HG3  LYS  69           HG3      LYS  69  -9.613 -17.329 -12.789
    7    HD2  LYS  69           HD2      LYS  69  -8.073 -17.891 -14.621
    8    HD3  LYS  69           HD3      LYS  69  -6.720 -17.238 -13.695
    9    HE2  LYS  69           HE2      LYS  69  -7.119 -18.904 -11.922
   10    HE3  LYS  69           HE3      LYS  69  -8.481 -19.553 -12.833
   11    HZ1  LYS  69           HZ1      LYS  69  -6.942 -20.056 -14.653
   12    HZ3  LYS  69           HZ2      LYS  69  -6.523 -20.871 -13.223
   13    HZ2  LYS  69           HZ3      LYS  69  -5.645 -19.500 -13.712

  No H/Q in entry =          13
  In of MODEL    7
    1    H    VAL  70           H        VAL  70  -7.960 -12.910 -12.158
    2    HA   VAL  70           HA       VAL  70  -9.171 -10.722 -13.754
    3    HB   VAL  70           HB       VAL  70  -8.299  -9.168 -12.043
    4   HG13  VAL  70          HG11      VAL  70  -9.945  -9.723 -10.294
    5   HG12  VAL  70          HG12      VAL  70 -10.051 -11.372 -10.913
    6   HG11  VAL  70          HG13      VAL  70 -10.620 -10.023 -11.895
    7   HG23  VAL  70          HG21      VAL  70  -7.473 -10.090  -9.880
    8   HG22  VAL  70          HG22      VAL  70  -6.431 -10.556 -11.222
    9   HG21  VAL  70          HG23      VAL  70  -7.570 -11.719 -10.547

  No H/Q in entry =           9
  In of MODEL    7
    1    H    SER  71           H        SER  71  -7.594  -9.096 -14.451
    2    HA   SER  71           HA       SER  71  -5.345 -10.223 -15.759
    3    HB2  SER  71           HB2      SER  71  -6.557  -8.167 -16.519
    4    HB3  SER  71           HB3      SER  71  -5.876  -7.306 -15.142
    5    HG   SER  71           HG       SER  71  -4.573  -8.440 -17.377

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU  72           H        LEU  72  -3.353 -10.565 -15.078
    2    HA   LEU  72           HA       LEU  72  -2.642 -10.366 -12.362
    3    HB2  LEU  72           HB2      LEU  72  -0.985 -10.823 -14.838
    4    HB3  LEU  72           HB3      LEU  72  -0.331 -10.908 -13.206
    5    HG   LEU  72           HG       LEU  72  -2.712 -12.555 -14.117
    6   HD11  LEU  72          HD11      LEU  72   0.219 -13.329 -13.976
    7   HD13  LEU  72          HD12      LEU  72  -0.725 -13.140 -15.452
    8   HD12  LEU  72          HD13      LEU  72  -1.117 -14.430 -14.317
    9   HD22  LEU  72          HD21      LEU  72  -2.709 -12.558 -11.763
   10   HD21  LEU  72          HD22      LEU  72  -0.957 -12.492 -11.656
   11   HD23  LEU  72          HD23      LEU  72  -1.753 -13.988 -12.141

  No H/Q in entry =          11
  In of MODEL    7
    1    H    VAL  73           H        VAL  73  -1.876  -8.360 -15.138
    2    HA   VAL  73           HA       VAL  73   0.071  -6.698 -14.023
    3    HB   VAL  73           HB       VAL  73  -0.276  -5.280 -15.883
    4   HG11  VAL  73          HG11      VAL  73   0.353  -7.781 -16.254
    5   HG13  VAL  73          HG12      VAL  73  -0.094  -6.811 -17.657
    6   HG12  VAL  73          HG13      VAL  73  -1.264  -7.921 -16.942
    7   HG23  VAL  73          HG21      VAL  73  -2.467  -5.806 -17.279
    8   HG22  VAL  73          HG22      VAL  73  -2.519  -4.679 -15.925
    9   HG21  VAL  73          HG23      VAL  73  -3.077  -6.339 -15.713

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LEU  74           H        LEU  74  -3.331  -6.752 -13.482
    2    HA   LEU  74           HA       LEU  74  -3.903  -4.085 -12.870
    3    HB2  LEU  74           HB2      LEU  74  -5.664  -5.713 -13.052
    4    HB3  LEU  74           HB3      LEU  74  -4.994  -6.658 -11.726
    5    HG   LEU  74           HG       LEU  74  -5.423  -4.782 -10.173
    6   HD13  LEU  74          HD11      LEU  74  -5.268  -2.843 -11.533
    7   HD12  LEU  74          HD12      LEU  74  -6.980  -2.963 -11.131
    8   HD11  LEU  74          HD13      LEU  74  -6.409  -3.484 -12.716
    9   HD21  LEU  74          HD21      LEU  74  -7.161  -6.587 -11.062
   10   HD23  LEU  74          HD22      LEU  74  -7.965  -5.137 -11.623
   11   HD22  LEU  74          HD23      LEU  74  -7.631  -5.331  -9.919

  No H/Q in entry =          11
  In of MODEL    7
    1    H    VAL  75           H        VAL  75  -2.921  -6.693 -10.706
    2    HA   VAL  75           HA       VAL  75  -2.705  -5.148  -8.360
    3    HB   VAL  75           HB       VAL  75  -1.249  -7.668  -9.144
    4   HG11  VAL  75          HG11      VAL  75  -1.455  -6.211  -6.470
    5   HG13  VAL  75          HG12      VAL  75   0.009  -6.465  -7.408
    6   HG12  VAL  75          HG13      VAL  75  -0.810  -7.836  -6.680
    7   HG23  VAL  75          HG21      VAL  75  -3.506  -7.287  -7.167
    8   HG22  VAL  75          HG22      VAL  75  -2.972  -8.781  -7.939
    9   HG21  VAL  75          HG23      VAL  75  -3.832  -7.559  -8.879

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLU  76           H        GLU  76  -0.298  -5.950 -10.885
    2    HA   GLU  76           HA       GLU  76   1.907  -4.645  -9.715
    3    HB2  GLU  76           HB2      GLU  76   2.094  -6.122 -11.698
    4    HB3  GLU  76           HB3      GLU  76   1.206  -4.949 -12.658
    5    HG2  GLU  76           HG2      GLU  76   3.545  -4.645 -13.149
    6    HG3  GLU  76           HG3      GLU  76   3.053  -3.272 -12.174

  No H/Q in entry =           6
  In of MODEL    7
    1    H    ALA  77           H        ALA  77  -0.592  -3.395 -11.915
    2    HA   ALA  77           HA       ALA  77   0.448  -0.767 -12.084
    3    HB3  ALA  77           HB1      ALA  77  -2.479  -1.502 -12.262
    4    HB1  ALA  77           HB2      ALA  77  -1.334  -1.831 -13.563
    5    HB2  ALA  77           HB3      ALA  77  -1.644  -0.169 -13.061

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLN  78           H        GLN  78  -1.859  -2.283  -9.886
    2    HA   GLN  78           HA       GLN  78  -2.631   0.049  -8.486
    3    HB2  GLN  78           HB2      GLN  78  -3.784  -2.188  -8.408
    4    HB3  GLN  78           HB3      GLN  78  -2.462  -2.776  -7.403
    5    HG2  GLN  78           HG2      GLN  78  -2.950  -1.036  -5.735
    6    HG3  GLN  78           HG3      GLN  78  -4.271  -0.438  -6.739
    7   HE21  GLN  78          HE21      GLN  78  -4.751  -1.423  -4.083
    8   HE22  GLN  78          HE22      GLN  78  -5.651  -2.857  -4.207

  No H/Q in entry =           8
  In of MODEL    7
    1    H    LEU  79           H        LEU  79   0.004  -2.255  -8.025
    2    HA   LEU  79           HA       LEU  79   0.984  -1.378  -5.562
    3    HB2  LEU  79           HB2      LEU  79   1.823  -3.402  -6.627
    4    HB3  LEU  79           HB3      LEU  79   2.493  -2.460  -7.956
    5    HG   LEU  79           HG       LEU  79   4.061  -1.350  -6.444
    6   HD13  LEU  79          HD11      LEU  79   3.051  -1.089  -4.381
    7   HD12  LEU  79          HD12      LEU  79   4.103  -2.458  -4.033
    8   HD11  LEU  79          HD13      LEU  79   2.395  -2.727  -4.372
    9   HD23  LEU  79          HD21      LEU  79   5.229  -3.521  -5.536
   10   HD22  LEU  79          HD22      LEU  79   5.038  -3.316  -7.275
   11   HD21  LEU  79          HD23      LEU  79   3.936  -4.368  -6.389

  No H/Q in entry =          11
  In of MODEL    7
    1    H    HIS  80           H        HIS  80   1.890  -0.274  -8.829
    2    HA   HIS  80           HA       HIS  80   3.728   1.681  -7.896
    3    HB2  HIS  80           HB2      HIS  80   2.440   1.011 -10.486
    4    HB3  HIS  80           HB3      HIS  80   3.062   2.652 -10.310
    5    HD1  HIS  80           HD1      HIS  80   5.471   2.912 -10.820
    6    HD2  HIS  80           HD2      HIS  80   4.578  -0.985  -9.636
    7    HE1  HIS  80           HE1      HIS  80   7.639   1.597 -10.976
    8    HE2  HIS  80           HE2      HIS  80   7.106  -0.781 -10.258

  No H/Q in entry =           8
  In of MODEL    7
    1    H    LEU  81           H        LEU  81   0.332   1.900  -8.893
    2    HA   LEU  81           HA       LEU  81   0.103   4.696  -8.561
    3    HB2  LEU  81           HB2      LEU  81  -1.950   2.485  -8.494
    4    HB3  LEU  81           HB3      LEU  81  -2.374   4.196  -8.403
    5    HG   LEU  81           HG       LEU  81  -0.689   3.019 -10.631
    6   HD12  LEU  81          HD11      LEU  81  -2.909   3.378 -11.941
    7   HD11  LEU  81          HD12      LEU  81  -3.674   3.321 -10.354
    8   HD13  LEU  81          HD13      LEU  81  -2.751   1.938 -10.938
    9   HD23  LEU  81          HD21      LEU  81  -1.744   5.183 -11.732
   10   HD22  LEU  81          HD22      LEU  81  -0.330   5.329 -10.691
   11   HD21  LEU  81          HD23      LEU  81  -1.932   5.703 -10.059

  No H/Q in entry =          11
  In of MODEL    7
    1    H    MET  82           H        MET  82  -0.613   2.019  -6.318
    2    HA   MET  82           HA       MET  82  -1.650   3.620  -4.235
    3    HB2  MET  82           HB2      MET  82  -0.320   0.911  -4.270
    4    HB3  MET  82           HB3      MET  82  -0.894   1.644  -2.774
    5    HG2  MET  82           HG2      MET  82  -2.622   1.181  -5.225
    6    HG3  MET  82           HG3      MET  82  -2.569   0.105  -3.830
    7    HE3  MET  82           HE1      MET  82  -4.279   1.780  -1.023
    8    HE2  MET  82           HE2      MET  82  -2.544   2.029  -1.198
    9    HE1  MET  82           HE3      MET  82  -3.255   0.484  -1.657

  No H/Q in entry =           9
  In of MODEL    7
    1    H    THR  83           H        THR  83   1.636   2.481  -4.908
    2    HA   THR  83           HA       THR  83   2.860   3.563  -2.600
    3    HB   THR  83           HB       THR  83   4.961   3.475  -4.063
    4    HG1  THR  83           HG1      THR  83   4.724   2.955  -6.089
    5   HG22  THR  83          HG21      THR  83   4.476   0.825  -4.400
    6   HG21  THR  83          HG22      THR  83   3.187   1.224  -3.266
    7   HG23  THR  83          HG23      THR  83   4.869   1.540  -2.837

  No H/Q in entry =           7
  In of MODEL    7
    1    H    SER  84           H        SER  84   2.527   4.852  -5.901
    2    HA   SER  84           HA       SER  84   3.904   7.270  -5.436
    3    HB2  SER  84           HB2      SER  84   1.831   6.473  -7.467
    4    HB3  SER  84           HB3      SER  84   2.535   8.089  -7.436
    5    HG   SER  84           HG       SER  84   3.869   5.592  -7.723

  No H/Q in entry =           5
  In of MODEL    7
    1    H    MET  85           H        MET  85   0.397   6.570  -5.283
    2    HA   MET  85           HA       MET  85  -0.425   9.193  -4.683
    3    HB2  MET  85           HB2      MET  85  -1.976   7.416  -5.363
    4    HB3  MET  85           HB3      MET  85  -1.704   6.595  -3.827
    5    HG2  MET  85           HG2      MET  85  -2.579   8.540  -2.607
    6    HG3  MET  85           HG3      MET  85  -2.800   9.406  -4.126
    7    HE1  MET  85           HE1      MET  85  -3.411   6.456  -2.067
    8    HE3  MET  85           HE2      MET  85  -3.847   5.385  -3.396
    9    HE2  MET  85           HE3      MET  85  -5.096   5.978  -2.306

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LEU  86           H        LEU  86   0.440   6.514  -2.538
    2    HA   LEU  86           HA       LEU  86  -0.085   7.822  -0.097
    3    HB2  LEU  86           HB2      LEU  86   0.340   5.344  -0.492
    4    HB3  LEU  86           HB3      LEU  86   2.054   5.745  -0.578
    5    HG   LEU  86           HG       LEU  86   1.737   6.909   1.690
    6   HD11  LEU  86          HD11      LEU  86  -0.967   6.189   1.204
    7   HD13  LEU  86          HD12      LEU  86  -0.296   6.923   2.659
    8   HD12  LEU  86          HD13      LEU  86  -0.416   5.169   2.537
    9   HD23  LEU  86          HD21      LEU  86   1.257   3.924   1.806
   10   HD22  LEU  86          HD22      LEU  86   2.271   4.915   2.853
   11   HD21  LEU  86          HD23      LEU  86   2.775   4.584   1.196

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ALA  87           H        ALA  87   2.900   7.479  -1.972
    2    HA   ALA  87           HA       ALA  87   4.621   8.857  -0.236
    3    HB3  ALA  87           HB1      ALA  87   4.713   7.846  -2.944
    4    HB2  ALA  87           HB2      ALA  87   6.047   8.152  -1.836
    5    HB1  ALA  87           HB3      ALA  87   5.461   9.444  -2.881

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ARG  88           H        ARG  88   2.709  10.031  -2.965
    2    HA   ARG  88           HA       ARG  88   3.530  12.706  -2.840
    3    HB2  ARG  88           HB2      ARG  88   2.265  11.579  -4.705
    4    HB3  ARG  88           HB3      ARG  88   0.806  11.747  -3.730
    5    HG2  ARG  88           HG2      ARG  88   1.871  14.308  -3.637
    6    HG3  ARG  88           HG3      ARG  88   2.294  13.789  -5.266
    7    HD2  ARG  88           HD2      ARG  88   0.158  13.909  -5.975
    8    HD3  ARG  88           HD3      ARG  88  -0.451  13.064  -4.551
    9    HE   ARG  88           HE       ARG  88  -0.588  15.846  -4.965
   10   HH21  ARG  88          HH11      ARG  88  -1.099  17.182  -3.228
   11   HH22  ARG  88          HH12      ARG  88  -0.821  16.637  -1.610
   12   HH11  ARG  88          HH21      ARG  88   0.374  13.562  -2.590
   13   HH12  ARG  88          HH22      ARG  88  -0.004  14.582  -1.249

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLU  89           H        GLU  89   0.788  11.079  -1.216
    2    HA   GLU  89           HA       GLU  89  -0.282  13.409  -0.013
    3    HB2  GLU  89           HB2      GLU  89  -1.441  11.191  -0.109
    4    HB3  GLU  89           HB3      GLU  89  -0.334  10.613   1.137
    5    HG2  GLU  89           HG2      GLU  89  -1.130  12.325   2.695
    6    HG3  GLU  89           HG3      GLU  89  -2.163  13.017   1.447

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LEU  90           H        LEU  90   2.120  11.070   1.169
    2    HA   LEU  90           HA       LEU  90   2.487  12.303   3.703
    3    HB2  LEU  90           HB2      LEU  90   4.234  10.498   2.031
    4    HB3  LEU  90           HB3      LEU  90   4.655  11.004   3.673
    5    HG   LEU  90           HG       LEU  90   1.998   9.710   2.997
    6   HD12  LEU  90          HD11      LEU  90   3.094   7.641   4.007
    7   HD11  LEU  90          HD12      LEU  90   4.634   8.469   3.774
    8   HD13  LEU  90          HD13      LEU  90   3.621   8.083   2.382
    9   HD22  LEU  90          HD21      LEU  90   1.741  10.635   5.119
   10   HD21  LEU  90          HD22      LEU  90   3.455  10.494   5.509
   11   HD23  LEU  90          HD23      LEU  90   2.420   9.067   5.550

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  91           H        ILE  91   4.113  12.660   0.584
    2    HA   ILE  91           HA       ILE  91   6.120  14.451   1.437
    3    HB   ILE  91           HB       ILE  91   4.813  13.991  -1.251
    4   HG12  ILE  91          HG12      ILE  91   7.630  13.446  -0.264
    5   HG13  ILE  91          HG13      ILE  91   6.325  12.274  -0.109
    6   HG22  ILE  91          HG21      ILE  91   7.065  15.295  -1.926
    7   HG21  ILE  91          HG22      ILE  91   6.763  16.099  -0.385
    8   HG23  ILE  91          HG23      ILE  91   5.547  16.154  -1.660
    9   HD13  ILE  91          HD11      ILE  91   6.156  11.958  -2.418
   10   HD12  ILE  91          HD12      ILE  91   7.894  12.166  -2.195
   11   HD11  ILE  91          HD13      ILE  91   6.913  13.510  -2.784

  No H/Q in entry =          11
  In of MODEL    7
    1    H    THR  92           H        THR  92   2.773  14.951   0.413
    2    HA   THR  92           HA       THR  92   2.803  17.775   0.357
    3    HB   THR  92           HB       THR  92   0.593  15.822   1.043
    4    HG1  THR  92           HG1      THR  92   0.904  15.641  -1.041
    5   HG22  THR  92          HG21      THR  92  -0.762  18.013   0.318
    6   HG21  THR  92          HG22      THR  92   0.643  18.809   1.023
    7   HG23  THR  92          HG23      THR  92  -0.325  17.705   1.998

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLU  93           H        GLU  93   2.196  15.481   3.005
    2    HA   GLU  93           HA       GLU  93   1.692  17.392   5.024
    3    HB2  GLU  93           HB2      GLU  93   2.949  14.641   5.261
    4    HB3  GLU  93           HB3      GLU  93   2.271  15.580   6.593
    5    HG2  GLU  93           HG2      GLU  93   0.655  14.838   4.145
    6    HG3  GLU  93           HG3      GLU  93   0.729  13.811   5.572

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LEU  94           H        LEU  94   4.674  15.852   3.886
    2    HA   LEU  94           HA       LEU  94   6.438  16.961   5.785
    3    HB2  LEU  94           HB2      LEU  94   6.834  15.991   2.954
    4    HB3  LEU  94           HB3      LEU  94   8.172  16.620   3.911
    5    HG   LEU  94           HG       LEU  94   6.383  14.458   5.034
    6   HD11  LEU  94          HD11      LEU  94   8.484  14.193   2.912
    7   HD13  LEU  94          HD12      LEU  94   7.017  13.248   3.165
    8   HD12  LEU  94          HD13      LEU  94   8.433  12.965   4.178
    9   HD23  LEU  94          HD21      LEU  94   8.556  13.876   6.196
   10   HD22  LEU  94          HD22      LEU  94   7.918  15.466   6.612
   11   HD21  LEU  94          HD23      LEU  94   9.260  15.321   5.475

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  95           H        ILE  95   5.337  18.161   2.631
    2    HA   ILE  95           HA       ILE  95   6.957  20.486   2.584
    3    HB   ILE  95           HB       ILE  95   4.306  19.858   1.264
    4   HG12  ILE  95          HG12      ILE  95   7.106  20.141   0.141
    5   HG13  ILE  95          HG13      ILE  95   6.424  18.600   0.650
    6   HG21  ILE  95          HG21      ILE  95   6.106  22.290   1.057
    7   HG23  ILE  95          HG22      ILE  95   4.378  22.256   1.404
    8   HG22  ILE  95          HG23      ILE  95   4.961  21.847  -0.209
    9   HD13  ILE  95          HD11      ILE  95   4.871  18.559  -1.087
   10   HD12  ILE  95          HD12      ILE  95   6.240  19.351  -1.867
   11   HD11  ILE  95          HD13      ILE  95   4.884  20.312  -1.279

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLU  96           H        GLU  96   3.689  19.898   3.862
    2    HA   GLU  96           HA       GLU  96   3.119  22.555   4.615
    3    HB2  GLU  96           HB2      GLU  96   1.409  20.806   4.615
    4    HB3  GLU  96           HB3      GLU  96   2.247  19.959   5.913
    5    HG2  GLU  96           HG2      GLU  96   1.245  21.261   7.480
    6    HG3  GLU  96           HG3      GLU  96   1.814  22.725   6.688

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LEU  97           H        LEU  97   4.902  19.965   6.244
    2    HA   LEU  97           HA       LEU  97   5.274  21.302   8.719
    3    HB2  LEU  97           HB2      LEU  97   6.774  19.104   7.309
    4    HB3  LEU  97           HB3      LEU  97   7.370  19.775   8.825
    5    HG   LEU  97           HG       LEU  97   4.540  18.739   8.498
    6   HD12  LEU  97          HD11      LEU  97   5.433  16.706   9.712
    7   HD11  LEU  97          HD12      LEU  97   7.059  17.305   9.377
    8   HD13  LEU  97          HD13      LEU  97   5.986  16.871   8.045
    9   HD23  LEU  97          HD21      LEU  97   4.975  18.431  11.064
   10   HD22  LEU  97          HD22      LEU  97   4.630  20.051  10.461
   11   HD21  LEU  97          HD23      LEU  97   6.291  19.577  10.813

  No H/Q in entry =          11
  In of MODEL    7
    1    H    HIS  98           H        HIS  98   7.160  21.284   5.703
    2    HA   HIS  98           HA       HIS  98   9.341  22.818   6.615
    3    HB2  HIS  98           HB2      HIS  98   8.056  22.594   3.883
    4    HB3  HIS  98           HB3      HIS  98   9.514  23.542   4.182
    5    HD1  HIS  98           HD1      HIS  98   8.230  19.997   4.189
    6    HD2  HIS  98           HD2      HIS  98  11.851  22.018   4.635
    7    HE1  HIS  98           HE1      HIS  98  10.048  18.230   4.138
    8    HE2  HIS  98           HE2      HIS  98  12.257  19.440   4.410

  No H/Q in entry =           8
  In of MODEL    7
    1    H    GLU  99           H        GLU  99   6.144  23.721   5.426
    2    HA   GLU  99           HA       GLU  99   6.581  26.528   5.375
    3    HB2  GLU  99           HB2      GLU  99   4.684  25.400   4.233
    4    HB3  GLU  99           HB3      GLU  99   3.973  25.051   5.808
    5    HG2  GLU  99           HG2      GLU  99   3.840  27.445   6.312
    6    HG3  GLU  99           HG3      GLU  99   4.632  27.831   4.788

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LYS 100           H        LYS 100   5.392  24.312   7.887
    2    HA   LYS 100           HA       LYS 100   4.839  26.375   9.782
    3    HB2  LYS 100           HB2      LYS 100   5.351  23.412  10.125
    4    HB3  LYS 100           HB3      LYS 100   4.920  24.491  11.457
    5    HG2  LYS 100           HG2      LYS 100   2.874  25.174  10.200
    6    HG3  LYS 100           HG3      LYS 100   3.282  23.999   8.947
    7    HD2  LYS 100           HD2      LYS 100   3.158  22.177  10.605
    8    HD3  LYS 100           HD3      LYS 100   2.766  23.346  11.869
    9    HE2  LYS 100           HE2      LYS 100   0.733  24.013  10.597
   10    HE3  LYS 100           HE3      LYS 100   1.113  22.787   9.381
   11    HZ1  LYS 100           HZ1      LYS 100   0.819  22.121  12.259
   12    HZ3  LYS 100           HZ2      LYS 100   0.788  21.070  10.922
   13    HZ2  LYS 100           HZ3      LYS 100  -0.506  22.136  11.197

  No H/Q in entry =          13
  In of MODEL    7
    1    H    LEU 101           H        LEU 101   7.728  24.520   8.959
    2    HA   LEU 101           HA       LEU 101   9.333  25.322  11.172
    3    HB2  LEU 101           HB2      LEU 101   9.921  24.327   8.395
    4    HB3  LEU 101           HB3      LEU 101  11.231  24.963   9.384
    5    HG   LEU 101           HG       LEU 101   9.349  22.845  10.435
    6   HD12  LEU 101          HD11      LEU 101  11.374  21.307   9.834
    7   HD11  LEU 101          HD12      LEU 101  11.773  22.564   8.665
    8   HD13  LEU 101          HD13      LEU 101  10.227  21.724   8.562
    9   HD21  LEU 101          HD21      LEU 101  12.092  23.893  11.178
   10   HD23  LEU 101          HD22      LEU 101  11.513  22.332  11.752
   11   HD22  LEU 101          HD23      LEU 101  10.650  23.806  12.188

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LYS 102           H        LYS 102   7.801  27.222   9.027
    2    HA   LYS 102           HA       LYS 102   7.929  29.514   8.740
    3    HB2  LYS 102           HB2      LYS 102   9.480  29.361  10.845
    4    HB3  LYS 102           HB3      LYS 102  10.789  29.530   9.693
    5    HG2  LYS 102           HG2      LYS 102   8.722  31.526  10.548
    6    HG3  LYS 102           HG3      LYS 102  10.441  31.750  10.305
    7    HD2  LYS 102           HD2      LYS 102   8.492  31.373   7.995
    8    HD3  LYS 102           HD3      LYS 102   8.906  32.942   8.668
    9    HE2  LYS 102           HE2      LYS 102  10.263  31.732   6.599
   10    HE3  LYS 102           HE3      LYS 102  10.903  33.024   7.616
   11    HZ2  LYS 102           HZ1      LYS 102  12.383  31.087   7.445
   12    HZ1  LYS 102           HZ2      LYS 102  11.196  30.128   8.180
   13    HZ3  LYS 102           HZ3      LYS 102  11.912  31.399   9.044

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ALA 103           H        ALA 103  11.159  28.106   8.189
    2    HA   ALA 103           HA       ALA 103  12.163  29.465   6.120
    3    HB2  ALA 103           HB1      ALA 103  13.004  27.234   5.192
    4    HB1  ALA 103           HB2      ALA 103  12.086  26.477   6.493
    5    HB3  ALA 103           HB3      ALA 103  13.398  27.592   6.874

  No H/Q in entry =           5
  In of MODEL    7
    1    H1   LYS   3           H1       LYS   3 -32.026   5.333 -19.678
    2    H2   LYS   3           H3       LYS   3 -31.033   5.119 -21.038
    3    H3   LYS   3           H2       LYS   3 -32.354   4.085 -20.781
    4    HA   LYS   3           HA       LYS   3 -31.242   2.767 -19.391
    5    HB2  LYS   3           HB2      LYS   3 -29.079   4.343 -20.739
    6    HB3  LYS   3           HB3      LYS   3 -28.658   3.157 -19.503
    7    HG2  LYS   3           HG2      LYS   3 -29.975   1.477 -20.846
    8    HG3  LYS   3           HG3      LYS   3 -30.028   2.681 -22.133
    9    HD2  LYS   3           HD2      LYS   3 -27.543   2.745 -22.106
   10    HD3  LYS   3           HD3      LYS   3 -27.558   1.439 -20.922
   11    HE2  LYS   3           HE2      LYS   3 -28.984   0.164 -22.629
   12    HE3  LYS   3           HE3      LYS   3 -28.461   1.386 -23.787
   13    HZ3  LYS   3           HZ1      LYS   3 -26.582   0.290 -24.076
   14    HZ2  LYS   3           HZ2      LYS   3 -27.117  -0.923 -23.015
   15    HZ1  LYS   3           HZ3      LYS   3 -26.214   0.386 -22.422

  No H/Q in entry =          15
  In of MODEL    7
    1    H    LYS   4           H        LYS   4 -31.265   2.617 -17.330
    2    HA   LYS   4           HA       LYS   4 -30.684   4.944 -15.679
    3    HB2  LYS   4           HB2      LYS   4 -31.684   2.172 -14.977
    4    HB3  LYS   4           HB3      LYS   4 -31.548   3.519 -13.849
    5    HG2  LYS   4           HG2      LYS   4 -33.369   3.336 -16.254
    6    HG3  LYS   4           HG3      LYS   4 -33.846   3.347 -14.557
    7    HD2  LYS   4           HD2      LYS   4 -33.307   5.613 -14.289
    8    HD3  LYS   4           HD3      LYS   4 -32.278   5.631 -15.722
    9    HE2  LYS   4           HE2      LYS   4 -34.301   6.867 -16.163
   10    HE3  LYS   4           HE3      LYS   4 -34.286   5.395 -17.134
   11    HZ3  LYS   4           HZ1      LYS   4 -35.779   4.370 -15.576
   12    HZ2  LYS   4           HZ2      LYS   4 -36.443   5.824 -16.150
   13    HZ1  LYS   4           HZ3      LYS   4 -35.766   5.756 -14.595

  No H/Q in entry =          13
  In of MODEL    7
    1    H    HIS   5           H        HIS   5 -29.209   5.128 -14.101
    2    HA   HIS   5           HA       HIS   5 -26.809   3.464 -14.459
    3    HB2  HIS   5           HB2      HIS   5 -27.242   6.190 -13.242
    4    HB3  HIS   5           HB3      HIS   5 -25.698   5.342 -13.242
    5    HD1  HIS   5           HD1      HIS   5 -24.330   6.645 -14.841
    6    HD2  HIS   5           HD2      HIS   5 -28.093   5.766 -16.361
    7    HE1  HIS   5           HE1      HIS   5 -24.226   7.242 -17.290
    8    HE2  HIS   5           HE2      HIS   5 -26.520   6.694 -18.186

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ILE   6           H        ILE   6 -26.459   1.907 -13.149
    2    HA   ILE   6           HA       ILE   6 -27.424   2.100 -10.376
    3    HB   ILE   6           HB       ILE   6 -26.445  -0.300 -11.929
    4   HG12  ILE   6          HG12      ILE   6 -29.239   0.443 -11.050
    5   HG13  ILE   6          HG13      ILE   6 -28.625   0.653 -12.689
    6   HG23  ILE   6          HG21      ILE   6 -26.714  -1.580 -10.069
    7   HG22  ILE   6          HG22      ILE   6 -27.941  -0.518  -9.376
    8   HG21  ILE   6          HG23      ILE   6 -26.238  -0.065  -9.301
    9   HD13  ILE   6          HD11      ILE   6 -28.942  -1.491 -13.192
   10   HD12  ILE   6          HD12      ILE   6 -29.943  -1.549 -11.741
   11   HD11  ILE   6          HD13      ILE   6 -28.250  -2.041 -11.665

  No H/Q in entry =          11
  In of MODEL    7
    1    H    TYR   7           H        TYR   7 -25.701   2.856  -9.104
    2    HA   TYR   7           HA       TYR   7 -22.937   2.090  -9.811
    3    HB2  TYR   7           HB2      TYR   7 -24.051   4.448  -8.313
    4    HB3  TYR   7           HB3      TYR   7 -22.336   4.050  -8.369
    5    HD1  TYR   7           HD1      TYR   7 -23.338   3.046 -11.453
    6    HD2  TYR   7           HD2      TYR   7 -22.892   6.650  -9.221
    7    HE1  TYR   7           HE1      TYR   7 -23.011   4.308 -13.544
    8    HE2  TYR   7           HE2      TYR   7 -22.608   7.914 -11.304
    9    HH   TYR   7           HH       TYR   7 -22.840   7.819 -13.534

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LEU   8           H        LEU   8 -21.869   0.803  -8.496
    2    HA   LEU   8           HA       LEU   8 -22.937   0.225  -5.803
    3    HB2  LEU   8           HB2      LEU   8 -21.143  -1.313  -7.658
    4    HB3  LEU   8           HB3      LEU   8 -21.285  -1.711  -5.947
    5    HG   LEU   8           HG       LEU   8 -23.752  -2.051  -6.346
    6   HD13  LEU   8          HD11      LEU   8 -23.985  -0.841  -8.451
    7   HD12  LEU   8          HD12      LEU   8 -24.402  -2.537  -8.692
    8   HD11  LEU   8          HD13      LEU   8 -22.838  -1.929  -9.230
    9   HD23  LEU   8          HD21      LEU   8 -22.358  -3.996  -8.058
   10   HD22  LEU   8          HD22      LEU   8 -23.418  -4.241  -6.671
   11   HD21  LEU   8          HD23      LEU   8 -21.737  -3.773  -6.423

  No H/Q in entry =          11
  In of MODEL    7
    1    H    PHE   9           H        PHE   9 -21.675   0.690  -4.022
    2    HA   PHE   9           HA       PHE   9 -18.961   1.806  -4.548
    3    HB2  PHE   9           HB2      PHE   9 -21.030   2.744  -2.566
    4    HB3  PHE   9           HB3      PHE   9 -19.350   3.260  -2.548
    5    HD1  PHE   9           HD1      PHE   9 -18.436   4.655  -4.330
    6    HD2  PHE   9           HD2      PHE   9 -22.562   3.475  -4.333
    7    HE1  PHE   9           HE1      PHE   9 -18.917   6.340  -6.080
    8    HE2  PHE   9           HE2      PHE   9 -23.044   5.172  -6.078
    9    HZ   PHE   9           HZ       PHE   9 -21.219   6.600  -6.958

  No H/Q in entry =           9
  In of MODEL    7
    1    H    SER  10           H        SER  10 -17.300   0.954  -3.442
    2    HA   SER  10           HA       SER  10 -17.441   0.034  -0.757
    3    HB2  SER  10           HB2      SER  10 -18.551  -1.899  -1.844
    4    HB3  SER  10           HB3      SER  10 -17.149  -2.088  -2.885
    5    HG   SER  10           HG       SER  10 -17.103  -2.140  -0.053

  No H/Q in entry =           5
  In of MODEL    7
    1    H    SER  11           H        SER  11 -15.415   0.174   0.084
    2    HA   SER  11           HA       SER  11 -13.300   1.191  -1.475
    3    HB2  SER  11           HB2      SER  11 -12.115   1.344   0.503
    4    HB3  SER  11           HB3      SER  11 -13.781   1.323   1.084
    5    HG   SER  11           HG       SER  11 -11.779  -0.603   1.254

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA  12           H        ALA  12 -14.340  -1.554  -2.258
    2    HA   ALA  12           HA       ALA  12 -11.702  -2.674  -2.785
    3    HB1  ALA  12           HB1      ALA  12 -13.781  -4.066  -1.136
    4    HB2  ALA  12           HB2      ALA  12 -12.034  -4.000  -0.909
    5    HB3  ALA  12           HB3      ALA  12 -12.718  -5.010  -2.183

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLY  13           H        GLY  13 -12.616  -1.647  -4.800
    2    HA3  GLY  13           HA2      GLY  13 -14.784  -2.521  -6.270
    3    HA2  GLY  13           HA3      GLY  13 -13.271  -1.959  -6.997

  No H/Q in entry =           3
  In of MODEL    7
    1    H    MET  14           H        MET  14 -11.711  -4.217  -5.843
    2    HA   MET  14           HA       MET  14 -11.860  -5.978  -8.008
    3    HB2  MET  14           HB2      MET  14  -9.905  -5.864  -6.457
    4    HB3  MET  14           HB3      MET  14 -10.830  -6.776  -5.264
    5    HG2  MET  14           HG2      MET  14  -9.539  -8.411  -6.402
    6    HG3  MET  14           HG3      MET  14 -11.132  -8.535  -7.150
    7    HE2  MET  14           HE1      MET  14  -7.708  -8.862  -7.891
    8    HE1  MET  14           HE2      MET  14  -7.535  -7.193  -7.347
    9    HE3  MET  14           HE3      MET  14  -7.181  -7.607  -9.023

  No H/Q in entry =           9
  In of MODEL    7
    1    H    SER  15           H        SER  15 -13.204  -6.527  -4.765
    2    HA   SER  15           HA       SER  15 -14.440  -9.020  -5.541
    3    HB2  SER  15           HB2      SER  15 -14.058  -8.900  -3.210
    4    HB3  SER  15           HB3      SER  15 -14.747  -7.282  -3.098
    5    HG   SER  15           HG       SER  15 -16.199  -9.627  -3.825

  No H/Q in entry =           5
  In of MODEL    7
    1    H    THR  16           H        THR  16 -15.586  -5.668  -5.202
    2    HA   THR  16           HA       THR  16 -18.363  -6.221  -5.766
    3    HB   THR  16           HB       THR  16 -16.839  -3.639  -6.258
    4    HG1  THR  16           HG1      THR  16 -16.433  -4.144  -4.173
    5   HG21  THR  16          HG21      THR  16 -19.223  -3.937  -7.106
    6   HG23  THR  16          HG22      THR  16 -18.970  -2.577  -5.999
    7   HG22  THR  16          HG23      THR  16 -19.706  -4.079  -5.420

  No H/Q in entry =           7
  In of MODEL    7
    1    H    SER  17           H        SER  17 -15.500  -5.531  -7.615
    2    HA   SER  17           HA       SER  17 -16.696  -4.864 -10.106
    3    HB2  SER  17           HB2      SER  17 -13.977  -6.003  -9.430
    4    HB3  SER  17           HB3      SER  17 -14.462  -5.590 -11.074
    5    HG   SER  17           HG       SER  17 -14.680  -3.733  -8.968

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU  18           H        LEU  18 -15.900  -7.965  -8.671
    2    HA   LEU  18           HA       LEU  18 -16.401  -9.496 -11.026
    3    HB2  LEU  18           HB2      LEU  18 -15.102 -10.384  -9.147
    4    HB3  LEU  18           HB3      LEU  18 -16.521 -10.275  -8.106
    5    HG   LEU  18           HG       LEU  18 -17.678 -11.933  -9.462
    6   HD12  LEU  18          HD11      LEU  18 -16.106 -13.144 -11.173
    7   HD11  LEU  18          HD12      LEU  18 -15.247 -11.603 -11.186
    8   HD13  LEU  18          HD13      LEU  18 -16.945 -11.670 -11.655
    9   HD23  LEU  18          HD21      LEU  18 -14.913 -12.854  -8.735
   10   HD22  LEU  18          HD22      LEU  18 -16.364 -13.849  -8.877
   11   HD21  LEU  18          HD23      LEU  18 -16.250 -12.635  -7.604

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LEU  19           H        LEU  19 -18.426  -8.434  -8.295
    2    HA   LEU  19           HA       LEU  19 -20.808  -9.783  -9.112
    3    HB2  LEU  19           HB2      LEU  19 -20.587  -8.943  -6.860
    4    HB3  LEU  19           HB3      LEU  19 -20.407  -7.295  -7.459
    5    HG   LEU  19           HG       LEU  19 -22.742  -7.259  -8.138
    6   HD12  LEU  19          HD11      LEU  19 -24.154  -9.225  -7.203
    7   HD11  LEU  19          HD12      LEU  19 -22.640 -10.126  -7.258
    8   HD13  LEU  19          HD13      LEU  19 -23.313  -9.443  -8.737
    9   HD23  LEU  19          HD21      LEU  19 -23.732  -7.440  -5.851
   10   HD22  LEU  19          HD22      LEU  19 -22.256  -6.479  -5.947
   11   HD21  LEU  19          HD23      LEU  19 -22.199  -8.122  -5.307

  No H/Q in entry =          11
  In of MODEL    7
    1    H    VAL  20           H        VAL  20 -19.540  -6.525  -9.809
    2    HA   VAL  20           HA       VAL  20 -21.733  -5.629 -11.358
    3    HB   VAL  20           HB       VAL  20 -18.793  -4.831 -11.509
    4   HG11  VAL  20          HG11      VAL  20 -21.198  -3.602 -12.880
    5   HG13  VAL  20          HG12      VAL  20 -19.791  -4.322 -13.661
    6   HG12  VAL  20          HG13      VAL  20 -19.621  -2.822 -12.750
    7   HG22  VAL  20          HG21      VAL  20 -19.666  -4.159  -9.441
    8   HG21  VAL  20          HG22      VAL  20 -21.204  -3.674 -10.153
    9   HG23  VAL  20          HG23      VAL  20 -19.751  -2.725 -10.465

  No H/Q in entry =           9
  In of MODEL    7
    1    H    SER  21           H        SER  21 -18.848  -7.480 -12.413
    2    HA   SER  21           HA       SER  21 -19.661  -7.417 -15.157
    3    HB2  SER  21           HB2      SER  21 -18.095  -9.279 -15.508
    4    HB3  SER  21           HB3      SER  21 -17.347  -7.980 -14.581
    5    HG   SER  21           HG       SER  21 -17.471  -9.169 -12.777

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LYS  22           H        LYS  22 -20.551  -9.677 -12.583
    2    HA   LYS  22           HA       LYS  22 -21.990 -11.395 -14.397
    3    HB2  LYS  22           HB2      LYS  22 -22.156 -11.068 -11.401
    4    HB3  LYS  22           HB3      LYS  22 -23.073 -12.264 -12.316
    5    HG2  LYS  22           HG2      LYS  22 -20.064 -12.123 -12.173
    6    HG3  LYS  22           HG3      LYS  22 -21.079 -13.213 -11.230
    7    HD2  LYS  22           HD2      LYS  22 -21.977 -13.958 -13.563
    8    HD3  LYS  22           HD3      LYS  22 -20.480 -13.240 -14.162
    9    HE2  LYS  22           HE2      LYS  22 -20.852 -15.615 -12.362
   10    HE3  LYS  22           HE3      LYS  22 -19.908 -15.483 -13.847
   11    HZ1  LYS  22           HZ1      LYS  22 -18.371 -14.017 -12.616
   12    HZ3  LYS  22           HZ2      LYS  22 -18.429 -15.604 -12.013
   13    HZ2  LYS  22           HZ3      LYS  22 -19.232 -14.354 -11.192

  No H/Q in entry =          13
  In of MODEL    7
    1    H    MET  23           H        MET  23 -22.896  -8.534 -12.515
    2    HA   MET  23           HA       MET  23 -25.696  -8.802 -12.998
    3    HB2  MET  23           HB2      MET  23 -24.005  -6.376 -12.434
    4    HB3  MET  23           HB3      MET  23 -25.760  -6.325 -12.597
    5    HG2  MET  23           HG2      MET  23 -26.046  -7.657 -10.629
    6    HG3  MET  23           HG3      MET  23 -24.310  -7.951 -10.517
    7    HE2  MET  23           HE1      MET  23 -26.841  -4.467  -9.299
    8    HE1  MET  23           HE2      MET  23 -27.041  -5.448 -10.750
    9    HE3  MET  23           HE3      MET  23 -26.106  -3.953 -10.818

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ARG  24           H        ARG  24 -23.060  -7.186 -14.800
    2    HA   ARG  24           HA       ARG  24 -24.658  -5.985 -16.782
    3    HB2  ARG  24           HB2      ARG  24 -22.316  -5.325 -16.519
    4    HB3  ARG  24           HB3      ARG  24 -21.782  -6.942 -16.906
    5    HG2  ARG  24           HG2      ARG  24 -22.574  -6.691 -19.246
    6    HG3  ARG  24           HG3      ARG  24 -23.175  -5.060 -18.849
    7    HD2  ARG  24           HD2      ARG  24 -20.968  -4.814 -19.844
    8    HD3  ARG  24           HD3      ARG  24 -20.852  -4.470 -18.123
    9    HE   ARG  24           HE       ARG  24 -19.400  -6.105 -17.813
   10   HH21  ARG  24          HH11      ARG  24 -17.648  -6.969 -18.927
   11   HH22  ARG  24          HH12      ARG  24 -17.921  -7.917 -20.349
   12   HH11  ARG  24          HH21      ARG  24 -21.342  -7.013 -20.431
   13   HH12  ARG  24          HH22      ARG  24 -20.111  -7.944 -21.224

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ALA  25           H        ALA  25 -23.313  -9.241 -16.527
    2    HA   ALA  25           HA       ALA  25 -23.906 -10.104 -19.163
    3    HB1  ALA  25           HB1      ALA  25 -23.070 -12.088 -18.480
    4    HB3  ALA  25           HB2      ALA  25 -24.115 -12.141 -17.060
    5    HB2  ALA  25           HB3      ALA  25 -22.618 -11.213 -17.017

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLN  26           H        GLN  26 -25.701 -10.274 -16.125
    2    HA   GLN  26           HA       GLN  26 -27.968 -11.627 -17.128
    3    HB2  GLN  26           HB2      GLN  26 -27.553  -9.857 -14.737
    4    HB3  GLN  26           HB3      GLN  26 -29.067 -10.681 -15.078
    5    HG2  GLN  26           HG2      GLN  26 -26.387 -11.964 -14.635
    6    HG3  GLN  26           HG3      GLN  26 -27.742 -11.956 -13.515
    7   HE21  GLN  26          HE21      GLN  26 -26.394 -14.031 -14.809
    8   HE22  GLN  26          HE22      GLN  26 -27.371 -15.142 -15.601

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ALA  27           H        ALA  27 -27.258  -8.175 -16.729
    2    HA   ALA  27           HA       ALA  27 -29.821  -7.248 -17.490
    3    HB1  ALA  27           HB1      ALA  27 -28.093  -5.820 -16.383
    4    HB3  ALA  27           HB2      ALA  27 -28.744  -5.089 -17.851
    5    HB2  ALA  27           HB3      ALA  27 -27.155  -5.853 -17.878

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLU  28           H        GLU  28 -27.059  -8.283 -19.385
    2    HA   GLU  28           HA       GLU  28 -28.082  -7.298 -21.892
    3    HB2  GLU  28           HB2      GLU  28 -25.658  -7.824 -21.290
    4    HB3  GLU  28           HB3      GLU  28 -26.094  -9.520 -21.495
    5    HG2  GLU  28           HG2      GLU  28 -25.016  -8.661 -23.469
    6    HG3  GLU  28           HG3      GLU  28 -26.692  -9.095 -23.805

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LYS  29           H        LYS  29 -28.029 -10.414 -20.248
    2    HA   LYS  29           HA       LYS  29 -29.248 -11.959 -22.249
    3    HB2  LYS  29           HB2      LYS  29 -28.120 -12.880 -20.258
    4    HB3  LYS  29           HB3      LYS  29 -29.427 -12.262 -19.249
    5    HG2  LYS  29           HG2      LYS  29 -31.003 -13.736 -20.311
    6    HG3  LYS  29           HG3      LYS  29 -29.773 -14.286 -21.448
    7    HD2  LYS  29           HD2      LYS  29 -28.542 -15.382 -19.729
    8    HD3  LYS  29           HD3      LYS  29 -29.492 -14.608 -18.462
    9    HE2  LYS  29           HE2      LYS  29 -30.091 -17.000 -18.830
   10    HE3  LYS  29           HE3      LYS  29 -31.446 -15.894 -19.057
   11    HZ1  LYS  29           HZ1      LYS  29 -30.893 -15.980 -21.490
   12    HZ3  LYS  29           HZ2      LYS  29 -31.515 -17.414 -20.826
   13    HZ2  LYS  29           HZ3      LYS  29 -29.853 -17.274 -21.136

  No H/Q in entry =          13
  In of MODEL    7
    1    H    TYR  30           H        TYR  30 -30.756  -9.961 -19.725
    2    HA   TYR  30           HA       TYR  30 -33.393 -10.581 -20.947
    3    HB2  TYR  30           HB2      TYR  30 -32.796  -9.398 -18.226
    4    HB3  TYR  30           HB3      TYR  30 -34.398  -9.759 -18.868
    5    HD1  TYR  30           HD1      TYR  30 -35.156 -12.105 -19.085
    6    HD2  TYR  30           HD2      TYR  30 -31.364 -11.138 -17.407
    7    HE1  TYR  30           HE1      TYR  30 -34.907 -14.426 -18.300
    8    HE2  TYR  30           HE2      TYR  30 -31.116 -13.444 -16.627
    9    HH   TYR  30           HH       TYR  30 -32.604 -15.903 -17.718

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLU  31           H        GLU  31 -31.370  -8.446 -21.755
    2    HA   GLU  31           HA       GLU  31 -31.447  -6.285 -22.568
    3    HB2  GLU  31           HB2      GLU  31 -34.292  -7.189 -23.062
    4    HB3  GLU  31           HB3      GLU  31 -33.550  -5.766 -23.791
    5    HG2  GLU  31           HG2      GLU  31 -31.995  -7.097 -25.000
    6    HG3  GLU  31           HG3      GLU  31 -32.457  -8.550 -24.114

  No H/Q in entry =           6
  In of MODEL    7
    1    H    VAL  32           H        VAL  32 -31.630  -6.209 -19.833
    2    HA   VAL  32           HA       VAL  32 -33.624  -4.228 -19.150
    3    HB   VAL  32           HB       VAL  32 -31.158  -5.066 -17.593
    4   HG12  VAL  32          HG11      VAL  32 -32.730  -4.356 -15.681
    5   HG11  VAL  32          HG12      VAL  32 -33.632  -3.504 -16.934
    6   HG13  VAL  32          HG13      VAL  32 -31.947  -3.088 -16.625
    7   HG21  VAL  32          HG21      VAL  32 -32.812  -6.898 -18.276
    8   HG23  VAL  32          HG22      VAL  32 -33.896  -6.148 -17.103
    9   HG22  VAL  32          HG23      VAL  32 -32.330  -6.770 -16.584

  No H/Q in entry =           9
  In of MODEL    7
    1    HA   PRO  33           HA       PRO  33 -30.810  -1.095 -20.832
    2    HB2  PRO  33           HB2      PRO  33 -32.467   1.020 -20.686
    3    HB3  PRO  33           HB3      PRO  33 -32.855  -0.306 -21.782
    4    HG2  PRO  33           HG2      PRO  33 -33.833   0.131 -18.960
    5    HG3  PRO  33           HG3      PRO  33 -34.793  -0.135 -20.415
    6    HD2  PRO  33           HD2      PRO  33 -34.185  -2.180 -18.763
    7    HD3  PRO  33           HD3      PRO  33 -34.244  -2.417 -20.511

  No H/Q in entry =           7
  In of MODEL    7
    1    H    VAL  34           H        VAL  34 -29.497  -1.561 -18.896
    2    HA   VAL  34           HA       VAL  34 -29.364   0.870 -17.238
    3    HB   VAL  34           HB       VAL  34 -28.669  -0.558 -15.313
    4   HG12  VAL  34          HG11      VAL  34 -31.015  -1.594 -14.991
    5   HG11  VAL  34          HG12      VAL  34 -31.394  -0.850 -16.543
    6   HG13  VAL  34          HG13      VAL  34 -30.898   0.155 -15.181
    7   HG21  VAL  34          HG21      VAL  34 -28.733  -2.583 -17.330
    8   HG23  VAL  34          HG22      VAL  34 -29.752  -3.020 -15.958
    9   HG22  VAL  34          HG23      VAL  34 -28.055  -2.619 -15.703

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ILE  35           H        ILE  35 -27.416   1.435 -16.412
    2    HA   ILE  35           HA       ILE  35 -25.035   0.272 -17.700
    3    HB   ILE  35           HB       ILE  35 -25.626   3.124 -16.870
    4   HG12  ILE  35          HG12      ILE  35 -24.577   1.899 -19.430
    5   HG13  ILE  35          HG13      ILE  35 -26.244   2.406 -19.154
    6   HG21  ILE  35          HG21      ILE  35 -22.967   1.772 -17.207
    7   HG23  ILE  35          HG22      ILE  35 -23.491   2.911 -15.970
    8   HG22  ILE  35          HG23      ILE  35 -23.160   3.478 -17.606
    9   HD11  ILE  35          HD11      ILE  35 -24.991   4.688 -18.552
   10   HD13  ILE  35          HD12      ILE  35 -25.514   4.277 -20.187
   11   HD12  ILE  35          HD13      ILE  35 -23.837   4.019 -19.706

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ILE  36           H        ILE  36 -23.726  -0.672 -16.116
    2    HA   ILE  36           HA       ILE  36 -24.182  -0.102 -13.239
    3    HB   ILE  36           HB       ILE  36 -23.182  -2.737 -14.368
    4   HG12  ILE  36          HG12      ILE  36 -26.031  -2.129 -13.577
    5   HG13  ILE  36          HG13      ILE  36 -25.475  -2.061 -15.250
    6   HG23  ILE  36          HG21      ILE  36 -23.457  -3.598 -12.255
    7   HG22  ILE  36          HG22      ILE  36 -24.666  -2.397 -11.801
    8   HG21  ILE  36          HG23      ILE  36 -22.963  -1.947 -11.883
    9   HD13  ILE  36          HD11      ILE  36 -25.491  -4.280 -15.467
   10   HD12  ILE  36          HD12      ILE  36 -26.551  -4.238 -14.058
   11   HD11  ILE  36          HD13      ILE  36 -24.825  -4.542 -13.854

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLU  37           H        GLU  37 -22.439   0.643 -12.145
    2    HA   GLU  37           HA       GLU  37 -19.709   0.038 -13.087
    3    HB2  GLU  37           HB2      GLU  37 -20.728   2.762 -12.291
    4    HB3  GLU  37           HB3      GLU  37 -19.040   2.352 -12.600
    5    HG2  GLU  37           HG2      GLU  37 -21.245   2.275 -14.638
    6    HG3  GLU  37           HG3      GLU  37 -20.089   3.589 -14.433

  No H/Q in entry =           6
  In of MODEL    7
    1    H    ALA  38           H        ALA  38 -18.195  -0.106 -11.417
    2    HA   ALA  38           HA       ALA  38 -19.212  -0.011  -8.638
    3    HB1  ALA  38           HB1      ALA  38 -17.381  -1.820 -10.087
    4    HB3  ALA  38           HB2      ALA  38 -18.400  -2.135  -8.682
    5    HB2  ALA  38           HB3      ALA  38 -16.837  -1.343  -8.479

  No H/Q in entry =           5
  In of MODEL    7
    1    H    PHE  39           H        PHE  39 -18.047   1.275  -7.168
    2    HA   PHE  39           HA       PHE  39 -15.620   2.653  -8.079
    3    HB2  PHE  39           HB2      PHE  39 -18.122   3.965  -7.035
    4    HB3  PHE  39           HB3      PHE  39 -16.544   4.745  -6.957
    5    HD1  PHE  39           HD1      PHE  39 -15.248   4.846  -9.227
    6    HD2  PHE  39           HD2      PHE  39 -19.467   4.352  -8.846
    7    HE1  PHE  39           HE1      PHE  39 -15.545   5.713 -11.530
    8    HE2  PHE  39           HE2      PHE  39 -19.779   5.208 -11.139
    9    HZ   PHE  39           HZ       PHE  39 -17.822   5.862 -12.501

  No H/Q in entry =           9
  In of MODEL    7
    1    HA   PRO  40           HA       PRO  40 -14.594   1.948  -3.804
    2    HB2  PRO  40           HB2      PRO  40 -12.969   4.081  -3.202
    3    HB3  PRO  40           HB3      PRO  40 -12.441   2.787  -4.278
    4    HG2  PRO  40           HG2      PRO  40 -13.661   5.447  -5.004
    5    HG3  PRO  40           HG3      PRO  40 -12.185   4.709  -5.627
    6    HD2  PRO  40           HD2      PRO  40 -14.407   4.475  -7.016
    7    HD3  PRO  40           HD3      PRO  40 -13.351   3.075  -6.842

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLU  41           H        GLU  41 -15.266   2.870  -1.664
    2    HA   GLU  41           HA       GLU  41 -17.625   4.408  -1.620
    3    HB2  GLU  41           HB2      GLU  41 -17.440   4.351   0.763
    4    HB3  GLU  41           HB3      GLU  41 -16.886   2.794   0.145
    5    HG2  GLU  41           HG2      GLU  41 -14.555   3.519   0.451
    6    HG3  GLU  41           HG3      GLU  41 -15.131   5.050   1.110

  No H/Q in entry =           6
  In of MODEL    7
    1    H    THR  42           H        THR  42 -14.368   5.561  -1.694
    2    HA   THR  42           HA       THR  42 -14.892   8.085  -0.466
    3    HB   THR  42           HB       THR  42 -12.792   8.816  -1.582
    4    HG1  THR  42           HG1      THR  42 -12.691   6.187  -2.635
    5   HG22  THR  42          HG21      THR  42 -12.579   6.031  -0.413
    6   HG21  THR  42          HG22      THR  42 -12.755   7.503   0.544
    7   HG23  THR  42          HG23      THR  42 -11.315   7.262  -0.444

  No H/Q in entry =           7
  In of MODEL    7
    1    H    LEU  43           H        LEU  43 -15.743   6.943  -3.565
    2    HA   LEU  43           HA       LEU  43 -16.201   9.694  -4.519
    3    HB2  LEU  43           HB2      LEU  43 -16.389   7.035  -5.923
    4    HB3  LEU  43           HB3      LEU  43 -16.712   8.599  -6.669
    5    HG   LEU  43           HG       LEU  43 -14.025   7.681  -5.678
    6   HD11  LEU  43          HD11      LEU  43 -15.125   6.565  -7.760
    7   HD13  LEU  43          HD12      LEU  43 -13.463   7.145  -7.859
    8   HD12  LEU  43          HD13      LEU  43 -14.773   8.107  -8.542
    9   HD22  LEU  43          HD21      LEU  43 -14.108  10.044  -5.571
   10   HD21  LEU  43          HD22      LEU  43 -15.013  10.158  -7.082
   11   HD23  LEU  43          HD23      LEU  43 -13.318   9.673  -7.104

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ALA  44           H        ALA  44 -17.995   7.726  -2.659
    2    HA   ALA  44           HA       ALA  44 -20.468   7.415  -3.961
    3    HB2  ALA  44           HB1      ALA  44 -20.233   6.302  -1.872
    4    HB3  ALA  44           HB2      ALA  44 -21.430   7.562  -1.583
    5    HB1  ALA  44           HB3      ALA  44 -19.767   7.788  -1.044

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLY  45           H        GLY  45 -19.239  10.303  -2.426
    2    HA3  GLY  45           HA2      GLY  45 -21.780  11.626  -2.760
    3    HA2  GLY  45           HA3      GLY  45 -20.280  12.357  -2.193

  No H/Q in entry =           3
  In of MODEL    7
    1    H    GLU  46           H        GLU  46 -18.705  11.542  -4.501
    2    HA   GLU  46           HA       GLU  46 -19.513  13.714  -6.253
    3    HB2  GLU  46           HB2      GLU  46 -17.149  13.355  -5.635
    4    HB3  GLU  46           HB3      GLU  46 -17.195  11.782  -6.432
    5    HG2  GLU  46           HG2      GLU  46 -17.582  12.862  -8.575
    6    HG3  GLU  46           HG3      GLU  46 -17.583  14.441  -7.791

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LYS  47           H        LYS  47 -19.146  10.215  -6.707
    2    HA   LYS  47           HA       LYS  47 -20.280  10.367  -9.372
    3    HB2  LYS  47           HB2      LYS  47 -19.536   8.010  -7.631
    4    HB3  LYS  47           HB3      LYS  47 -20.099   7.893  -9.298
    5    HG2  LYS  47           HG2      LYS  47 -17.656   9.452  -8.542
    6    HG3  LYS  47           HG3      LYS  47 -17.604   7.727  -8.902
    7    HD2  LYS  47           HD2      LYS  47 -18.622   8.166 -11.093
    8    HD3  LYS  47           HD3      LYS  47 -18.631   9.890 -10.732
    9    HE2  LYS  47           HE2      LYS  47 -16.191   9.859 -10.549
   10    HE3  LYS  47           HE3      LYS  47 -16.189   8.136 -10.921
   11    HZ2  LYS  47           HZ1      LYS  47 -15.941  10.063 -12.739
   12    HZ1  LYS  47           HZ2      LYS  47 -17.617   9.801 -12.798
   13    HZ3  LYS  47           HZ3      LYS  47 -16.545   8.512 -13.076

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLY  48           H        GLY  48 -21.518   9.504  -6.216
    2    HA3  GLY  48           HA2      GLY  48 -23.819   8.154  -6.944
    3    HA2  GLY  48           HA3      GLY  48 -23.653   9.156  -5.502

  No H/Q in entry =           3
  In of MODEL    7
    1    H    GLN  49           H        GLN  49 -23.258  11.620  -7.066
    2    HA   GLN  49           HA       GLN  49 -25.892  12.546  -7.184
    3    HB2  GLN  49           HB2      GLN  49 -23.428  13.596  -8.560
    4    HB3  GLN  49           HB3      GLN  49 -24.954  14.454  -8.460
    5    HG2  GLN  49           HG2      GLN  49 -24.776  14.479  -6.024
    6    HG3  GLN  49           HG3      GLN  49 -23.262  13.599  -6.124
    7   HE21  GLN  49          HE21      GLN  49 -23.293  15.825  -4.841
    8   HE22  GLN  49          HE22      GLN  49 -22.468  17.146  -5.490

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ASN  50           H        ASN  50 -24.103  10.803  -9.593
    2    HA   ASN  50           HA       ASN  50 -26.061  11.547 -11.657
    3    HB2  ASN  50           HB2      ASN  50 -23.380  10.196 -11.919
    4    HB3  ASN  50           HB3      ASN  50 -24.469  10.550 -13.251
    5   HD21  ASN  50          HD21      ASN  50 -21.887  11.575 -11.658
    6   HD22  ASN  50          HD22      ASN  50 -21.773  13.225 -11.995

  No H/Q in entry =           6
  In of MODEL    7
    1    H    ALA  51           H        ALA  51 -25.859   9.188  -9.421
    2    HA   ALA  51           HA       ALA  51 -26.505   7.000 -11.252
    3    HB2  ALA  51           HB1      ALA  51 -25.813   5.688  -9.577
    4    HB3  ALA  51           HB2      ALA  51 -26.981   6.410  -8.471
    5    HB1  ALA  51           HB3      ALA  51 -25.392   7.148  -8.679

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ASP  52           H        ASP  52 -28.430   5.804 -11.101
    2    HA   ASP  52           HA       ASP  52 -30.730   7.476 -10.409
    3    HB2  ASP  52           HB2      ASP  52 -30.376   4.998 -12.092
    4    HB3  ASP  52           HB3      ASP  52 -31.965   5.618 -11.641

  No H/Q in entry =           4
  In of MODEL    7
    1    H    VAL  53           H        VAL  53 -28.921   4.703  -9.419
    2    HA   VAL  53           HA       VAL  53 -30.344   4.719  -6.891
    3    HB   VAL  53           HB       VAL  53 -31.635   2.987  -8.132
    4   HG11  VAL  53          HG11      VAL  53 -29.845   2.259  -9.673
    5   HG13  VAL  53          HG12      VAL  53 -30.578   0.905  -8.813
    6   HG12  VAL  53          HG13      VAL  53 -29.003   1.517  -8.313
    7   HG23  VAL  53          HG21      VAL  53 -30.662   1.066  -6.456
    8   HG22  VAL  53          HG22      VAL  53 -31.877   2.286  -6.074
    9   HG21  VAL  53          HG23      VAL  53 -30.183   2.575  -5.680

  No H/Q in entry =           9
  In of MODEL    7
    1    H    VAL  54           H        VAL  54 -28.991   4.371  -5.249
    2    HA   VAL  54           HA       VAL  54 -26.183   3.720  -5.888
    3    HB   VAL  54           HB       VAL  54 -27.355   5.409  -3.621
    4   HG11  VAL  54          HG11      VAL  54 -24.686   4.175  -3.939
    5   HG13  VAL  54          HG12      VAL  54 -25.472   4.794  -2.488
    6   HG12  VAL  54          HG13      VAL  54 -24.652   5.902  -3.587
    7   HG22  VAL  54          HG21      VAL  54 -26.634   7.283  -4.718
    8   HG21  VAL  54          HG22      VAL  54 -27.123   6.263  -6.070
    9   HG23  VAL  54          HG23      VAL  54 -25.418   6.405  -5.647

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LEU  55           H        LEU  55 -25.453   1.841  -5.259
    2    HA   LEU  55           HA       LEU  55 -26.847   0.419  -3.078
    3    HB2  LEU  55           HB2      LEU  55 -25.233  -0.628  -5.391
    4    HB3  LEU  55           HB3      LEU  55 -25.915  -1.618  -4.101
    5    HG   LEU  55           HG       LEU  55 -27.477  -0.126  -6.198
    6   HD13  LEU  55          HD11      LEU  55 -27.060  -1.947  -7.430
    7   HD12  LEU  55          HD12      LEU  55 -27.943  -2.892  -6.231
    8   HD11  LEU  55          HD13      LEU  55 -26.196  -2.706  -6.094
    9   HD23  LEU  55          HD21      LEU  55 -28.617  -2.165  -4.342
   10   HD22  LEU  55          HD22      LEU  55 -29.415  -0.831  -5.177
   11   HD21  LEU  55          HD23      LEU  55 -28.402  -0.510  -3.769

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LEU  56           H        LEU  56 -25.642  -0.101  -1.284
    2    HA   LEU  56           HA       LEU  56 -22.743   0.497  -1.356
    3    HB2  LEU  56           HB2      LEU  56 -24.506   0.151   1.056
    4    HB3  LEU  56           HB3      LEU  56 -22.831   0.699   1.033
    5    HG   LEU  56           HG       LEU  56 -25.249   2.217   0.096
    6   HD11  LEU  56          HD11      LEU  56 -24.088   1.904   2.605
    7   HD13  LEU  56          HD12      LEU  56 -25.175   3.203   2.113
    8   HD12  LEU  56          HD13      LEU  56 -23.430   3.430   2.013
    9   HD23  LEU  56          HD21      LEU  56 -23.428   4.048  -0.106
   10   HD22  LEU  56          HD22      LEU  56 -23.744   2.933  -1.435
   11   HD21  LEU  56          HD23      LEU  56 -22.361   2.670  -0.375

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLY  57           H        GLY  57 -21.248  -1.036  -0.842
    2    HA3  GLY  57           HA2      GLY  57 -21.983  -3.779  -1.043
    3    HA2  GLY  57           HA3      GLY  57 -20.396  -3.175  -0.574

  No H/Q in entry =           3
  In of MODEL    7
    1    HA   PRO  58           HA       PRO  58 -23.095  -4.421   3.152
    2    HB2  PRO  58           HB2      PRO  58 -22.226  -6.974   3.741
    3    HB3  PRO  58           HB3      PRO  58 -23.645  -6.659   2.742
    4    HG2  PRO  58           HG2      PRO  58 -20.869  -7.345   1.929
    5    HG3  PRO  58           HG3      PRO  58 -22.404  -7.909   1.268
    6    HD2  PRO  58           HD2      PRO  58 -20.935  -5.981   0.041
    7    HD3  PRO  58           HD3      PRO  58 -22.697  -6.015  -0.047

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLN  59           H        GLN  59 -19.704  -4.657   2.516
    2    HA   GLN  59           HA       GLN  59 -18.926  -4.634   5.269
    3    HB2  GLN  59           HB2      GLN  59 -17.342  -3.504   2.965
    4    HB3  GLN  59           HB3      GLN  59 -16.733  -4.045   4.517
    5    HG2  GLN  59           HG2      GLN  59 -16.169  -5.824   3.204
    6    HG3  GLN  59           HG3      GLN  59 -17.752  -6.343   3.760
    7   HE21  GLN  59          HE21      GLN  59 -17.437  -7.502   1.886
    8   HE22  GLN  59          HE22      GLN  59 -17.982  -7.261   0.333

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ILE  60           H        ILE  60 -20.052  -2.144   3.081
    2    HA   ILE  60           HA       ILE  60 -19.320  -0.141   5.129
    3    HB   ILE  60           HB       ILE  60 -19.695   1.575   3.309
    4   HG12  ILE  60          HG12      ILE  60 -19.341  -0.633   1.323
    5   HG13  ILE  60          HG13      ILE  60 -20.960  -0.205   1.876
    6   HG21  ILE  60          HG21      ILE  60 -17.478   0.575   4.044
    7   HG23  ILE  60          HG22      ILE  60 -17.529   1.438   2.507
    8   HG22  ILE  60          HG23      ILE  60 -17.530  -0.324   2.529
    9   HD11  ILE  60          HD11      ILE  60 -20.204   2.235   1.238
   10   HD13  ILE  60          HD12      ILE  60 -20.764   1.123  -0.010
   11   HD12  ILE  60          HD13      ILE  60 -19.036   1.387   0.224

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ALA  61           H        ALA  61 -21.659  -1.892   5.211
    2    HA   ALA  61           HA       ALA  61 -23.999  -0.382   4.778
    3    HB1  ALA  61           HB1      ALA  61 -25.098  -1.958   6.107
    4    HB2  ALA  61           HB2      ALA  61 -23.667  -2.254   7.096
    5    HB3  ALA  61           HB3      ALA  61 -23.735  -2.859   5.441

  No H/Q in entry =           5
  In of MODEL    7
    1    H    TYR  62           H        TYR  62 -21.764  -0.354   7.557
    2    HA   TYR  62           HA       TYR  62 -23.416   1.185   9.248
    3    HB2  TYR  62           HB2      TYR  62 -21.404   1.737  10.473
    4    HB3  TYR  62           HB3      TYR  62 -21.338   0.043   9.987
    5    HD1  TYR  62           HD1      TYR  62 -19.697  -0.722   8.322
    6    HD2  TYR  62           HD2      TYR  62 -19.825   3.373   9.539
    7    HE1  TYR  62           HE1      TYR  62 -17.514  -0.338   7.244
    8    HE2  TYR  62           HE2      TYR  62 -17.628   3.753   8.461
    9    HH   TYR  62           HH       TYR  62 -16.176   1.324   6.445

  No H/Q in entry =           9
  In of MODEL    7
    1    H    MET  63           H        MET  63 -21.860   2.166   6.382
    2    HA   MET  63           HA       MET  63 -21.881   5.001   7.088
    3    HB2  MET  63           HB2      MET  63 -21.191   3.530   4.544
    4    HB3  MET  63           HB3      MET  63 -21.124   5.284   4.724
    5    HG2  MET  63           HG2      MET  63 -19.374   5.068   6.381
    6    HG3  MET  63           HG3      MET  63 -19.464   3.311   6.271
    7    HE2  MET  63           HE1      MET  63 -17.634   6.369   3.708
    8    HE1  MET  63           HE2      MET  63 -19.152   6.493   4.597
    9    HE3  MET  63           HE3      MET  63 -19.161   6.010   2.900

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LEU  64           H        LEU  64 -24.321   2.980   6.136
    2    HA   LEU  64           HA       LEU  64 -25.643   4.321   4.075
    3    HB2  LEU  64           HB2      LEU  64 -26.358   2.158   4.990
    4    HB3  LEU  64           HB3      LEU  64 -26.859   2.961   6.478
    5    HG   LEU  64           HG       LEU  64 -28.646   4.102   5.270
    6   HD13  LEU  64          HD11      LEU  64 -28.399   4.371   3.036
    7   HD12  LEU  64          HD12      LEU  64 -28.933   2.696   2.889
    8   HD11  LEU  64          HD13      LEU  64 -27.212   3.072   2.933
    9   HD23  LEU  64          HD21      LEU  64 -28.979   1.264   4.513
   10   HD22  LEU  64          HD22      LEU  64 -30.033   2.324   5.447
   11   HD21  LEU  64          HD23      LEU  64 -28.601   1.623   6.199

  No H/Q in entry =          11
  In of MODEL    7
    1    HA   PRO  65           HA       PRO  65 -28.007   7.309   6.859
    2    HB2  PRO  65           HB2      PRO  65 -26.002   7.593   9.097
    3    HB3  PRO  65           HB3      PRO  65 -27.755   7.756   9.158
    4    HG2  PRO  65           HG2      PRO  65 -26.668   5.565  10.067
    5    HG3  PRO  65           HG3      PRO  65 -28.091   5.441   9.033
    6    HD2  PRO  65           HD2      PRO  65 -25.191   5.025   8.303
    7    HD3  PRO  65           HD3      PRO  65 -26.589   4.044   7.864

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLU  66           H        GLU  66 -24.455   7.492   6.901
    2    HA   GLU  66           HA       GLU  66 -24.350  10.306   6.506
    3    HB2  GLU  66           HB2      GLU  66 -22.392   8.127   5.829
    4    HB3  GLU  66           HB3      GLU  66 -22.058   9.847   5.624
    5    HG2  GLU  66           HG2      GLU  66 -22.273  10.193   7.995
    6    HG3  GLU  66           HG3      GLU  66 -22.683   8.493   8.225

  No H/Q in entry =           6
  In of MODEL    7
    1    H    ILE  67           H        ILE  67 -24.288   7.569   4.243
    2    HA   ILE  67           HA       ILE  67 -24.007   9.310   1.953
    3    HB   ILE  67           HB       ILE  67 -24.709   6.348   2.127
    4   HG12  ILE  67          HG12      ILE  67 -22.171   7.694   1.188
    5   HG13  ILE  67          HG13      ILE  67 -22.422   7.249   2.875
    6   HG21  ILE  67          HG21      ILE  67 -24.796   8.235  -0.089
    7   HG23  ILE  67          HG22      ILE  67 -25.311   6.549  -0.040
    8   HG22  ILE  67          HG23      ILE  67 -23.627   6.948  -0.383
    9   HD12  ILE  67          HD11      ILE  67 -21.907   5.518   0.514
   10   HD11  ILE  67          HD12      ILE  67 -22.868   4.875   1.842
   11   HD13  ILE  67          HD13      ILE  67 -21.228   5.448   2.139

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLN  68           H        GLN  68 -26.786   8.062   3.607
    2    HA   GLN  68           HA       GLN  68 -28.690   8.879   1.653
    3    HB2  GLN  68           HB2      GLN  68 -28.894   8.493   4.637
    4    HB3  GLN  68           HB3      GLN  68 -30.259   9.005   3.658
    5    HG2  GLN  68           HG2      GLN  68 -30.166   6.982   2.374
    6    HG3  GLN  68           HG3      GLN  68 -28.676   6.498   3.161
    7   HE21  GLN  68          HE21      GLN  68 -30.761   5.001   3.038
    8   HE22  GLN  68          HE22      GLN  68 -31.547   4.487   4.459

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ARG  69           H        ARG  69 -27.172  10.635   4.384
    2    HA   ARG  69           HA       ARG  69 -28.697  13.026   4.002
    3    HB2  ARG  69           HB2      ARG  69 -26.283  12.243   5.566
    4    HB3  ARG  69           HB3      ARG  69 -26.476  13.955   5.215
    5    HG2  ARG  69           HG2      ARG  69 -28.782  13.844   6.208
    6    HG3  ARG  69           HG3      ARG  69 -28.460  12.169   6.672
    7    HD2  ARG  69           HD2      ARG  69 -26.915  14.625   7.582
    8    HD3  ARG  69           HD3      ARG  69 -27.974  13.645   8.582
    9    HE   ARG  69           HE       ARG  69 -25.315  12.886   7.604
   10   HH21  ARG  69          HH11      ARG  69 -24.385  11.174   8.785
   11   HH22  ARG  69          HH12      ARG  69 -25.348  10.288   9.919
   12   HH11  ARG  69          HH21      ARG  69 -28.215  12.143   9.326
   13   HH12  ARG  69          HH22      ARG  69 -27.517  10.836  10.223

  No H/Q in entry =          13
  In of MODEL    7
    1    H    LEU  70           H        LEU  70 -25.754  11.812   2.609
    2    HA   LEU  70           HA       LEU  70 -24.806  14.248   1.443
    3    HB2  LEU  70           HB2      LEU  70 -23.660  11.996   2.017
    4    HB3  LEU  70           HB3      LEU  70 -24.259  11.498   0.435
    5    HG   LEU  70           HG       LEU  70 -22.766  12.975  -0.658
    6   HD11  LEU  70          HD11      LEU  70 -21.974  13.857   2.126
    7   HD13  LEU  70          HD12      LEU  70 -22.745  14.850   0.889
    8   HD12  LEU  70          HD13      LEU  70 -21.095  14.274   0.652
    9   HD22  LEU  70          HD21      LEU  70 -21.225  11.351  -0.446
   10   HD21  LEU  70          HD22      LEU  70 -22.102  10.766   0.967
   11   HD23  LEU  70          HD23      LEU  70 -20.786  11.923   1.163

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LEU  71           H        LEU  71 -26.804  11.579   0.335
    2    HA   LEU  71           HA       LEU  71 -27.446  13.040  -2.169
    3    HB2  LEU  71           HB2      LEU  71 -27.459  10.047  -1.735
    4    HB3  LEU  71           HB3      LEU  71 -27.656  10.904  -3.264
    5    HG   LEU  71           HG       LEU  71 -25.126  11.068  -1.625
    6   HD12  LEU  71          HD11      LEU  71 -25.100   9.450  -4.065
    7   HD11  LEU  71          HD12      LEU  71 -26.057   8.759  -2.755
    8   HD13  LEU  71          HD13      LEU  71 -24.355   9.144  -2.495
    9   HD22  LEU  71          HD21      LEU  71 -25.356  12.880  -3.109
   10   HD21  LEU  71          HD22      LEU  71 -25.801  11.815  -4.442
   11   HD23  LEU  71          HD23      LEU  71 -24.166  11.766  -3.780

  No H/Q in entry =          11
  In of MODEL    7
    1    HA   PRO  72           HA       PRO  72 -31.252  12.341   0.485
    2    HB2  PRO  72           HB2      PRO  72 -32.266  14.844   0.424
    3    HB3  PRO  72           HB3      PRO  72 -30.921  14.469   1.501
    4    HG2  PRO  72           HG2      PRO  72 -30.835  15.685  -1.248
    5    HG3  PRO  72           HG3      PRO  72 -30.089  16.277   0.236
    6    HD2  PRO  72           HD2      PRO  72 -28.676  14.811  -1.550
    7    HD3  PRO  72           HD3      PRO  72 -28.395  14.652   0.184

  No H/Q in entry =           7
  In of MODEL    7
    1    H    ASN  73           H        ASN  73 -30.718  13.345  -2.730
    2    HA   ASN  73           HA       ASN  73 -33.560  12.866  -3.337
    3    HB2  ASN  73           HB2      ASN  73 -33.183  14.007  -5.434
    4    HB3  ASN  73           HB3      ASN  73 -32.707  15.012  -4.073
    5   HD21  ASN  73          HD21      ASN  73 -31.942  15.116  -6.757
    6   HD22  ASN  73          HD22      ASN  73 -30.269  15.057  -6.966

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LYS  74           H        LYS  74 -31.443  10.733  -2.941
    2    HA   LYS  74           HA       LYS  74 -31.949   9.317  -5.491
    3    HB2  LYS  74           HB2      LYS  74 -29.388   9.171  -3.895
    4    HB3  LYS  74           HB3      LYS  74 -29.736   8.344  -5.413
    5    HG2  LYS  74           HG2      LYS  74 -29.649  11.323  -5.200
    6    HG3  LYS  74           HG3      LYS  74 -28.216  10.346  -5.521
    7    HD2  LYS  74           HD2      LYS  74 -29.294   9.362  -7.459
    8    HD3  LYS  74           HD3      LYS  74 -30.768  10.270  -7.121
    9    HE2  LYS  74           HE2      LYS  74 -29.669  12.348  -7.564
   10    HE3  LYS  74           HE3      LYS  74 -28.099  11.551  -7.674
   11    HZ2  LYS  74           HZ1      LYS  74 -29.623  12.073  -9.784
   12    HZ1  LYS  74           HZ2      LYS  74 -30.182  10.513  -9.411
   13    HZ3  LYS  74           HZ3      LYS  74 -28.532  10.774  -9.723

  No H/Q in entry =          13
  In of MODEL    7
    1    HA   PRO  75           HA       PRO  75 -33.134   6.242  -2.521
    2    HB2  PRO  75           HB2      PRO  75 -33.326   4.016  -4.111
    3    HB3  PRO  75           HB3      PRO  75 -34.532   5.301  -4.163
    4    HG2  PRO  75           HG2      PRO  75 -32.180   4.851  -5.958
    5    HG3  PRO  75           HG3      PRO  75 -33.855   5.191  -6.389
    6    HD2  PRO  75           HD2      PRO  75 -32.028   7.168  -6.354
    7    HD3  PRO  75           HD3      PRO  75 -33.675   7.468  -5.799

  No H/Q in entry =           7
  In of MODEL    7
    1    H    VAL  76           H        VAL  76 -31.608   5.269  -1.167
    2    HA   VAL  76           HA       VAL  76 -29.086   4.213  -2.302
    3    HB   VAL  76           HB       VAL  76 -29.436   5.649   0.366
    4   HG11  VAL  76          HG11      VAL  76 -27.021   4.509  -1.053
    5   HG13  VAL  76          HG12      VAL  76 -27.674   4.012   0.508
    6   HG12  VAL  76          HG13      VAL  76 -26.923   5.597   0.332
    7   HG22  VAL  76          HG21      VAL  76 -28.890   7.589  -0.520
    8   HG21  VAL  76          HG22      VAL  76 -29.405   6.869  -2.046
    9   HG23  VAL  76          HG23      VAL  76 -27.697   6.880  -1.606

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLU  77           H        GLU  77 -28.737   2.073  -1.700
    2    HA   GLU  77           HA       GLU  77 -29.450   1.230   0.957
    3    HB2  GLU  77           HB2      GLU  77 -30.962  -0.507   0.434
    4    HB3  GLU  77           HB3      GLU  77 -31.607   0.983  -0.256
    5    HG2  GLU  77           HG2      GLU  77 -30.974   0.270  -2.453
    6    HG3  GLU  77           HG3      GLU  77 -30.238  -1.188  -1.792

  No H/Q in entry =           6
  In of MODEL    7
    1    H    VAL  78           H        VAL  78 -28.994  -0.837   1.606
    2    HA   VAL  78           HA       VAL  78 -26.294  -1.445   0.690
    3    HB   VAL  78           HB       VAL  78 -27.926  -2.437   3.066
    4   HG11  VAL  78          HG11      VAL  78 -25.528  -3.521   1.916
    5   HG13  VAL  78          HG12      VAL  78 -26.393  -4.051   3.359
    6   HG12  VAL  78          HG13      VAL  78 -25.143  -2.812   3.483
    7   HG22  VAL  78          HG21      VAL  78 -26.538  -0.996   4.397
    8   HG21  VAL  78          HG22      VAL  78 -27.342  -0.066   3.133
    9   HG23  VAL  78          HG23      VAL  78 -25.638  -0.493   2.967

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ILE  79           H        ILE  79 -25.653  -3.314  -0.229
    2    HA   ILE  79           HA       ILE  79 -27.635  -4.907  -1.564
    3    HB   ILE  79           HB       ILE  79 -24.616  -5.255  -1.372
    4   HG12  ILE  79          HG12      ILE  79 -26.336  -4.243  -3.641
    5   HG13  ILE  79          HG13      ILE  79 -25.514  -3.187  -2.492
    6   HG22  ILE  79          HG21      ILE  79 -25.667  -6.490  -3.686
    7   HG21  ILE  79          HG22      ILE  79 -26.606  -7.074  -2.312
    8   HG23  ILE  79          HG23      ILE  79 -24.851  -7.249  -2.319
    9   HD13  ILE  79          HD11      ILE  79 -24.112  -3.209  -4.323
   10   HD12  ILE  79          HD12      ILE  79 -24.351  -4.933  -4.608
   11   HD11  ILE  79          HD13      ILE  79 -23.386  -4.392  -3.234

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ASP  80           H        ASP  80 -28.378  -6.880  -0.982
    2    HA   ASP  80           HA       ASP  80 -28.246  -7.785   1.661
    3    HB2  ASP  80           HB2      ASP  80 -29.978  -8.460   0.034
    4    HB3  ASP  80           HB3      ASP  80 -28.769  -9.392  -0.849

  No H/Q in entry =           4
  In of MODEL    7
    1    H    SER  81           H        SER  81 -26.636  -8.831   2.772
    2    HA   SER  81           HA       SER  81 -24.114  -9.358   1.556
    3    HB2  SER  81           HB2      SER  81 -23.483 -10.360   3.716
    4    HB3  SER  81           HB3      SER  81 -24.276  -8.802   3.942
    5    HG   SER  81           HG       SER  81 -24.906 -10.827   5.212

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU  82           H        LEU  82 -26.692 -11.609   1.893
    2    HA   LEU  82           HA       LEU  82 -25.010 -13.879   1.350
    3    HB2  LEU  82           HB2      LEU  82 -27.974 -13.566   0.932
    4    HB3  LEU  82           HB3      LEU  82 -27.076 -15.074   1.086
    5    HG   LEU  82           HG       LEU  82 -27.502 -13.067   3.279
    6   HD13  LEU  82          HD11      LEU  82 -29.580 -14.165   2.816
    7   HD12  LEU  82          HD12      LEU  82 -28.876 -14.981   4.214
    8   HD11  LEU  82          HD13      LEU  82 -28.780 -15.725   2.617
    9   HD21  LEU  82          HD21      LEU  82 -26.068 -15.706   3.052
   10   HD23  LEU  82          HD22      LEU  82 -26.589 -15.051   4.604
   11   HD22  LEU  82          HD23      LEU  82 -25.430 -14.162   3.617

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LEU  83           H        LEU  83 -27.116 -11.767  -0.543
    2    HA   LEU  83           HA       LEU  83 -26.856 -13.103  -3.021
    3    HB2  LEU  83           HB2      LEU  83 -27.433 -10.228  -2.358
    4    HB3  LEU  83           HB3      LEU  83 -27.441 -10.868  -4.001
    5    HG   LEU  83           HG       LEU  83 -29.428 -11.383  -1.808
    6   HD13  LEU  83          HD11      LEU  83 -30.303  -9.579  -2.858
    7   HD12  LEU  83          HD12      LEU  83 -30.710 -10.714  -4.144
    8   HD11  LEU  83          HD13      LEU  83 -29.232  -9.759  -4.247
    9   HD23  LEU  83          HD21      LEU  83 -29.517 -12.638  -4.536
   10   HD22  LEU  83          HD22      LEU  83 -30.451 -13.049  -3.099
   11   HD21  LEU  83          HD23      LEU  83 -28.737 -13.451  -3.181

  No H/Q in entry =          11
  In of MODEL    7
    1    H    TYR  84           H        TYR  84 -25.033 -10.611  -1.353
    2    HA   TYR  84           HA       TYR  84 -23.223 -10.007  -3.498
    3    HB2  TYR  84           HB2      TYR  84 -23.796  -8.539  -1.496
    4    HB3  TYR  84           HB3      TYR  84 -22.757  -9.598  -0.545
    5    HD1  TYR  84           HD1      TYR  84 -20.331  -9.952  -1.559
    6    HD2  TYR  84           HD2      TYR  84 -22.859  -6.619  -2.414
    7    HE1  TYR  84           HE1      TYR  84 -18.352  -8.648  -2.262
    8    HE2  TYR  84           HE2      TYR  84 -20.892  -5.306  -3.129
    9    HH   TYR  84           HH       TYR  84 -17.758  -6.787  -3.519

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLY  85           H        GLY  85 -22.837 -12.001  -0.562
    2    HA3  GLY  85           HA2      GLY  85 -20.213 -12.787  -1.071
    3    HA2  GLY  85           HA3      GLY  85 -21.382 -13.708  -0.126

  No H/Q in entry =           3
  In of MODEL    7
    1    H    LYS  86           H        LYS  86 -23.222 -14.184  -2.171
    2    HA   LYS  86           HA       LYS  86 -22.040 -16.488  -3.448
    3    HB2  LYS  86           HB2      LYS  86 -24.308 -16.389  -2.438
    4    HB3  LYS  86           HB3      LYS  86 -24.776 -15.233  -3.684
    5    HG2  LYS  86           HG2      LYS  86 -24.481 -16.935  -5.377
    6    HG3  LYS  86           HG3      LYS  86 -24.011 -18.092  -4.133
    7    HD2  LYS  86           HD2      LYS  86 -26.586 -16.549  -3.957
    8    HD3  LYS  86           HD3      LYS  86 -26.483 -18.060  -4.859
    9    HE2  LYS  86           HE2      LYS  86 -25.490 -19.056  -2.722
   10    HE3  LYS  86           HE3      LYS  86 -26.085 -17.603  -1.920
   11    HZ2  LYS  86           HZ1      LYS  86 -27.691 -19.438  -1.848
   12    HZ1  LYS  86           HZ2      LYS  86 -27.751 -19.451  -3.547
   13    HZ3  LYS  86           HZ3      LYS  86 -28.303 -18.095  -2.689

  No H/Q in entry =          13
  In of MODEL    7
    1    H    VAL  87           H        VAL  87 -22.229 -13.275  -4.330
    2    HA   VAL  87           HA       VAL  87 -22.019 -12.081  -6.270
    3    HB   VAL  87           HB       VAL  87 -20.810 -14.529  -7.592
    4   HG13  VAL  87          HG11      VAL  87 -19.678 -12.993  -8.931
    5   HG12  VAL  87          HG12      VAL  87 -19.762 -11.718  -7.714
    6   HG11  VAL  87          HG13      VAL  87 -21.196 -12.142  -8.649
    7   HG23  VAL  87          HG21      VAL  87 -18.615 -13.738  -6.607
    8   HG22  VAL  87          HG22      VAL  87 -19.706 -14.588  -5.516
    9   HG21  VAL  87          HG23      VAL  87 -19.578 -12.832  -5.443

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ASP  88           H        ASP  88 -24.488 -12.872  -5.898
    2    HA   ASP  88           HA       ASP  88 -25.558 -14.147  -8.289
    3    HB2  ASP  88           HB2      ASP  88 -26.514 -14.458  -5.956
    4    HB3  ASP  88           HB3      ASP  88 -27.069 -12.786  -6.046

  No H/Q in entry =           4
  In of MODEL    7
    1    H    GLY  89           H        GLY  89 -24.945 -12.844  -9.932
    2    HA3  GLY  89           HA2      GLY  89 -25.295 -10.087 -10.122
    3    HA2  GLY  89           HA3      GLY  89 -25.216 -11.201 -11.487

  No H/Q in entry =           3
  In of MODEL    7
    1    H    LEU  90           H        LEU  90 -27.573 -12.699 -11.020
    2    HA   LEU  90           HA       LEU  90 -29.508 -10.873 -12.109
    3    HB2  LEU  90           HB2      LEU  90 -29.434 -13.266 -12.697
    4    HB3  LEU  90           HB3      LEU  90 -29.900 -13.667 -11.044
    5    HG   LEU  90           HG       LEU  90 -32.087 -12.679 -11.384
    6   HD13  LEU  90          HD11      LEU  90 -32.026 -10.926 -12.854
    7   HD12  LEU  90          HD12      LEU  90 -32.501 -12.190 -13.991
    8   HD11  LEU  90          HD13      LEU  90 -30.813 -11.694 -13.881
    9   HD23  LEU  90          HD21      LEU  90 -31.943 -14.294 -13.825
   10   HD22  LEU  90          HD22      LEU  90 -32.896 -14.522 -12.359
   11   HD21  LEU  90          HD23      LEU  90 -31.208 -15.033 -12.402

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLY  91           H        GLY  91 -29.218 -12.369  -8.932
    2    HA3  GLY  91           HA2      GLY  91 -31.610 -11.402  -7.867
    3    HA2  GLY  91           HA3      GLY  91 -30.179 -11.853  -6.939

  No H/Q in entry =           3
  In of MODEL    7
    1    H    VAL  92           H        VAL  92 -28.383  -9.912  -7.808
    2    HA   VAL  92           HA       VAL  92 -29.296  -7.666  -6.244
    3    HB   VAL  92           HB       VAL  92 -26.742  -7.978  -7.866
    4   HG12  VAL  92          HG11      VAL  92 -26.997  -6.112  -5.532
    5   HG11  VAL  92          HG12      VAL  92 -27.709  -5.605  -7.065
    6   HG13  VAL  92          HG13      VAL  92 -25.987  -5.970  -6.971
    7   HG22  VAL  92          HG21      VAL  92 -26.407  -9.553  -6.281
    8   HG21  VAL  92          HG22      VAL  92 -27.587  -8.846  -5.174
    9   HG23  VAL  92          HG23      VAL  92 -25.974  -8.146  -5.309

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LEU  93           H        LEU  93 -28.884  -8.294  -9.670
    2    HA   LEU  93           HA       LEU  93 -29.397  -5.681 -10.588
    3    HB2  LEU  93           HB2      LEU  93 -28.659  -7.490 -12.061
    4    HB3  LEU  93           HB3      LEU  93 -30.201  -8.314 -11.825
    5    HG   LEU  93           HG       LEU  93 -31.340  -6.412 -12.934
    6   HD11  LEU  93          HD11      LEU  93 -29.584  -4.708 -12.442
    7   HD13  LEU  93          HD12      LEU  93 -30.039  -4.761 -14.146
    8   HD12  LEU  93          HD13      LEU  93 -28.534  -5.508 -13.612
    9   HD23  LEU  93          HD21      LEU  93 -30.292  -6.909 -15.233
   10   HD22  LEU  93          HD22      LEU  93 -31.048  -8.218 -14.322
   11   HD21  LEU  93          HD23      LEU  93 -29.290  -8.055 -14.342

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LYS  94           H        LYS  94 -31.605  -8.369  -9.723
    2    HA   LYS  94           HA       LYS  94 -34.039  -7.070 -10.320
    3    HB2  LYS  94           HB2      LYS  94 -33.373  -9.225  -8.320
    4    HB3  LYS  94           HB3      LYS  94 -35.012  -8.627  -8.570
    5    HG2  LYS  94           HG2      LYS  94 -34.902  -9.390 -10.908
    6    HG3  LYS  94           HG3      LYS  94 -33.296 -10.046 -10.597
    7    HD2  LYS  94           HD2      LYS  94 -34.315 -11.450  -8.765
    8    HD3  LYS  94           HD3      LYS  94 -35.900 -10.896  -9.304
    9    HE2  LYS  94           HE2      LYS  94 -35.352 -11.786 -11.579
   10    HE3  LYS  94           HE3      LYS  94 -33.885 -12.484 -10.891
   11    HZ3  LYS  94           HZ1      LYS  94 -35.642 -14.115 -11.048
   12    HZ2  LYS  94           HZ2      LYS  94 -36.667 -13.152 -10.093
   13    HZ1  LYS  94           HZ3      LYS  94 -35.256 -13.818  -9.421

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ALA  95           H        ALA  95 -32.180  -7.088  -7.290
    2    HA   ALA  95           HA       ALA  95 -34.107  -5.627  -5.787
    3    HB2  ALA  95           HB1      ALA  95 -31.648  -6.857  -5.278
    4    HB3  ALA  95           HB2      ALA  95 -32.667  -6.016  -4.112
    5    HB1  ALA  95           HB3      ALA  95 -31.378  -5.147  -4.944

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA  96           H        ALA  96 -31.543  -4.610  -7.908
    2    HA   ALA  96           HA       ALA  96 -31.605  -1.850  -7.125
    3    HB2  ALA  96           HB1      ALA  96 -30.281  -1.536  -9.248
    4    HB3  ALA  96           HB2      ALA  96 -30.484  -3.258  -9.570
    5    HB1  ALA  96           HB3      ALA  96 -29.586  -2.727  -8.148

  No H/Q in entry =           5
  In of MODEL    7
    1    H    VAL  97           H        VAL  97 -33.058  -3.645  -9.803
    2    HA   VAL  97           HA       VAL  97 -34.277  -1.410 -11.039
    3    HB   VAL  97           HB       VAL  97 -34.911  -4.379 -11.084
    4   HG11  VAL  97          HG11      VAL  97 -36.824  -2.482 -11.545
    5   HG13  VAL  97          HG12      VAL  97 -36.796  -4.073 -12.306
    6   HG12  VAL  97          HG13      VAL  97 -36.133  -2.679 -13.157
    7   HG21  VAL  97          HG21      VAL  97 -33.764  -2.472 -13.126
    8   HG23  VAL  97          HG22      VAL  97 -34.119  -4.176 -13.415
    9   HG22  VAL  97          HG23      VAL  97 -32.883  -3.718 -12.242

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ALA  98           H        ALA  98 -35.303  -3.663  -8.498
    2    HA   ALA  98           HA       ALA  98 -37.923  -2.669  -8.118
    3    HB1  ALA  98           HB1      ALA  98 -36.771  -4.807  -7.104
    4    HB2  ALA  98           HB2      ALA  98 -37.994  -3.957  -6.157
    5    HB3  ALA  98           HB3      ALA  98 -36.282  -3.709  -5.815

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA  99           H        ALA  99 -34.879  -1.695  -6.499
    2    HA   ALA  99           HA       ALA  99 -36.106   0.214  -4.819
    3    HB1  ALA  99           HB1      ALA  99 -33.417  -0.517  -5.595
    4    HB2  ALA  99           HB2      ALA  99 -33.995   0.195  -4.089
    5    HB3  ALA  99           HB3      ALA  99 -33.594   1.233  -5.457

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ILE 100           H        ILE 100 -35.110   0.416  -8.184
    2    HA   ILE 100           HA       ILE 100 -35.455   3.250  -8.390
    3    HB   ILE 100           HB       ILE 100 -35.448   1.101 -10.536
    4   HG12  ILE 100          HG12      ILE 100 -33.396   3.213  -9.879
    5   HG13  ILE 100          HG13      ILE 100 -33.331   1.564  -9.255
    6   HG21  ILE 100          HG21      ILE 100 -36.040   3.991 -10.651
    7   HG23  ILE 100          HG22      ILE 100 -36.483   2.699 -11.767
    8   HG22  ILE 100          HG23      ILE 100 -34.870   3.409 -11.836
    9   HD12  ILE 100          HD11      ILE 100 -32.883   2.560 -12.031
   10   HD11  ILE 100          HD12      ILE 100 -33.447   0.909 -11.776
   11   HD13  ILE 100          HD13      ILE 100 -31.921   1.438 -11.070

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LYS 101           H        LYS 101 -37.601   0.515  -9.104
    2    HA   LYS 101           HA       LYS 101 -39.785   2.045 -10.075
    3    HB2  LYS 101           HB2      LYS 101 -39.498  -0.722  -8.960
    4    HB3  LYS 101           HB3      LYS 101 -41.094  -0.050  -9.287
    5    HG2  LYS 101           HG2      LYS 101 -40.653   0.120 -11.589
    6    HG3  LYS 101           HG3      LYS 101 -38.934  -0.188 -11.353
    7    HD2  LYS 101           HD2      LYS 101 -40.081  -2.161 -12.234
    8    HD3  LYS 101           HD3      LYS 101 -39.418  -2.462 -10.627
    9    HE2  LYS 101           HE2      LYS 101 -41.433  -3.276 -10.103
   10    HE3  LYS 101           HE3      LYS 101 -41.987  -1.601 -10.094
   11    HZ3  LYS 101           HZ1      LYS 101 -42.890  -1.801 -12.203
   12    HZ2  LYS 101           HZ2      LYS 101 -43.258  -3.301 -11.497
   13    HZ1  LYS 101           HZ3      LYS 101 -41.967  -3.174 -12.594

  No H/Q in entry =          13
  In of MODEL    7
    1    H    LYS 102           H        LYS 102 -39.176   0.586  -6.878
    2    HA   LYS 102           HA       LYS 102 -41.476   1.644  -5.653
    3    HB2  LYS 102           HB2      LYS 102 -40.123  -0.151  -4.659
    4    HB3  LYS 102           HB3      LYS 102 -38.793   0.982  -4.424
    5    HG2  LYS 102           HG2      LYS 102 -40.173   2.292  -2.908
    6    HG3  LYS 102           HG3      LYS 102 -41.507   1.163  -3.144
    7    HD2  LYS 102           HD2      LYS 102 -40.164  -0.633  -2.138
    8    HD3  LYS 102           HD3      LYS 102 -38.832   0.497  -1.901
    9    HE2  LYS 102           HE2      LYS 102 -40.255   1.889  -0.471
   10    HE3  LYS 102           HE3      LYS 102 -41.607   0.788  -0.731
   11    HZ1  LYS 102           HZ1      LYS 102 -39.779  -0.868   0.248
   12    HZ3  LYS 102           HZ2      LYS 102 -40.928  -0.052   1.193
   13    HZ2  LYS 102           HZ3      LYS 102 -39.352   0.566   1.053

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ALA 103           H        ALA 103 -38.617   3.208  -6.688
    2    HA   ALA 103           HA       ALA 103 -38.955   5.499  -4.893
    3    HB2  ALA 103           HB1      ALA 103 -37.026   6.353  -6.485
    4    HB3  ALA 103           HB2      ALA 103 -36.895   4.642  -6.891
    5    HB1  ALA 103           HB3      ALA 103 -36.682   5.171  -5.222

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA 104           H        ALA 104 -39.566   4.747  -8.236
    2    HA   ALA 104           HA       ALA 104 -40.317   7.496  -8.839
    3    HB2  ALA 104           HB1      ALA 104 -40.343   6.836 -11.045
    4    HB1  ALA 104           HB2      ALA 104 -40.976   5.233 -10.667
    5    HB3  ALA 104           HB3      ALA 104 -39.269   5.594 -10.403

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA 105           H        ALA 105 -41.784   5.295  -7.029
    2    HA   ALA 105           HA       ALA 105 -44.284   6.547  -6.972
    3    HB2  ALA 105           HB1      ALA 105 -44.998   5.654  -9.008
    4    HB3  ALA 105           HB2      ALA 105 -45.554   4.426  -7.871
    5    HB1  ALA 105           HB3      ALA 105 -44.076   4.166  -8.796

  No H/Q in entry =           5
  In of MODEL    8
    1    H1   ALA   1           H3       ALA   1 -12.272 -15.720  -2.194
    2    H2   ALA   1           H2       ALA   1 -11.337 -16.863  -3.040
    3    H3   ALA   1           H1       ALA   1 -12.487 -15.918  -3.866
    4    HA   ALA   1           HA       ALA   1 -13.884 -17.618  -3.615
    5    HB3  ALA   1           HB1      ALA   1 -12.486 -19.390  -3.161
    6    HB1  ALA   1           HB2      ALA   1 -13.230 -19.276  -1.567
    7    HB2  ALA   1           HB3      ALA   1 -11.656 -18.536  -1.860

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLU   2           H        GLU   2 -15.496 -18.470  -1.948
    2    HA   GLU   2           HA       GLU   2 -17.135 -16.748  -0.879
    3    HB2  GLU   2           HB2      GLU   2 -16.186 -19.173   0.661
    4    HB3  GLU   2           HB3      GLU   2 -17.707 -18.322   0.926
    5    HG2  GLU   2           HG2      GLU   2 -18.700 -19.409  -0.800
    6    HG3  GLU   2           HG3      GLU   2 -17.385 -19.010  -1.895

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLU   3           H        GLU   3 -15.204 -18.100   1.732
    2    HA   GLU   3           HA       GLU   3 -15.413 -15.745   3.289
    3    HB2  GLU   3           HB2      GLU   3 -13.827 -18.293   3.530
    4    HB3  GLU   3           HB3      GLU   3 -13.587 -16.972   4.674
    5    HG2  GLU   3           HG2      GLU   3 -15.774 -17.122   5.508
    6    HG3  GLU   3           HG3      GLU   3 -16.380 -17.923   4.064

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LEU   4           H        LEU   4 -12.469 -17.227   1.877
    2    HA   LEU   4           HA       LEU   4 -10.630 -15.324   2.461
    3    HB2  LEU   4           HB2      LEU   4 -10.881 -16.624  -0.261
    4    HB3  LEU   4           HB3      LEU   4  -9.423 -15.904   0.412
    5    HG   LEU   4           HG       LEU   4 -10.911 -18.299   1.538
    6   HD13  LEU   4          HD11      LEU   4  -9.286 -19.656   0.598
    7   HD12  LEU   4          HD12      LEU   4  -8.076 -18.374   0.562
    8   HD11  LEU   4          HD13      LEU   4  -9.373 -18.397  -0.632
    9   HD23  LEU   4          HD21      LEU   4  -8.650 -18.363   2.904
   10   HD22  LEU   4          HD22      LEU   4  -9.966 -17.322   3.441
   11   HD21  LEU   4          HD23      LEU   4  -8.610 -16.635   2.548

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLU   5           H        GLU   5 -12.983 -15.118  -0.197
    2    HA   GLU   5           HA       GLU   5 -11.986 -12.636  -1.207
    3    HB2  GLU   5           HB2      GLU   5 -13.335 -14.208  -2.569
    4    HB3  GLU   5           HB3      GLU   5 -14.727 -13.876  -1.539
    5    HG2  GLU   5           HG2      GLU   5 -14.642 -11.500  -2.157
    6    HG3  GLU   5           HG3      GLU   5 -13.223 -11.803  -3.159

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLU   6           H        GLU   6 -14.697 -13.511   0.906
    2    HA   GLU   6           HA       GLU   6 -15.596 -10.833   1.309
    3    HB2  GLU   6           HB2      GLU   6 -16.005 -13.375   2.899
    4    HB3  GLU   6           HB3      GLU   6 -16.794 -11.846   3.283
    5    HG2  GLU   6           HG2      GLU   6 -17.860 -11.796   1.093
    6    HG3  GLU   6           HG3      GLU   6 -16.997 -13.252   0.606

  No H/Q in entry =           6
  In of MODEL    8
    1    H    VAL   7           H        VAL   7 -13.279 -12.944   2.866
    2    HA   VAL   7           HA       VAL   7 -12.795 -11.367   5.189
    3    HB   VAL   7           HB       VAL   7 -11.104 -13.413   3.729
    4   HG11  VAL   7          HG11      VAL   7 -10.616 -11.878   6.288
    5   HG13  VAL   7          HG12      VAL   7  -9.526 -12.095   4.920
    6   HG12  VAL   7          HG13      VAL   7  -9.872 -13.450   5.993
    7   HG21  VAL   7          HG21      VAL   7 -13.346 -13.975   4.965
    8   HG23  VAL   7          HG22      VAL   7 -12.408 -13.700   6.434
    9   HG22  VAL   7          HG23      VAL   7 -11.924 -14.961   5.302

  No H/Q in entry =           9
  In of MODEL    8
    1    H    VAL   8           H        VAL   8 -11.307 -11.486   1.968
    2    HA   VAL   8           HA       VAL   8  -9.239  -9.614   2.445
    3    HB   VAL   8           HB       VAL   8 -10.721 -10.308  -0.103
    4   HG11  VAL   8          HG11      VAL   8  -8.321  -8.544   0.423
    5   HG13  VAL   8          HG12      VAL   8  -9.780  -8.156  -0.490
    6   HG12  VAL   8          HG13      VAL   8  -8.603  -9.291  -1.151
    7   HG23  VAL   8          HG21      VAL   8  -7.872 -11.071   0.321
    8   HG22  VAL   8          HG22      VAL   8  -9.192 -12.004  -0.375
    9   HG21  VAL   8          HG23      VAL   8  -9.024 -11.893   1.374

  No H/Q in entry =           9
  In of MODEL    8
    1    H    MET   9           H        MET   9 -12.592  -9.223   1.308
    2    HA   MET   9           HA       MET   9 -12.530  -6.447   0.870
    3    HB2  MET   9           HB2      MET   9 -14.739  -8.320   1.716
    4    HB3  MET   9           HB3      MET   9 -15.020  -6.591   1.500
    5    HG2  MET   9           HG2      MET   9 -14.193  -6.737  -0.815
    6    HG3  MET   9           HG3      MET   9 -13.896  -8.462  -0.604
    7    HE3  MET   9           HE1      MET   9 -17.171  -6.270   0.671
    8    HE2  MET   9           HE2      MET   9 -17.797  -6.173  -0.971
    9    HE1  MET   9           HE3      MET   9 -16.175  -5.585  -0.620

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLY  10           H        GLY  10 -13.174  -8.335   3.804
    2    HA3  GLY  10           HA2      GLY  10 -13.709  -6.148   5.524
    3    HA2  GLY  10           HA3      GLY  10 -13.142  -7.737   6.036

  No H/Q in entry =           3
  In of MODEL    8
    1    H    LEU  11           H        LEU  11 -10.705  -7.863   4.704
    2    HA   LEU  11           HA       LEU  11  -8.992  -6.429   6.447
    3    HB2  LEU  11           HB2      LEU  11  -8.464  -7.855   3.838
    4    HB3  LEU  11           HB3      LEU  11  -7.187  -7.150   4.827
    5    HG   LEU  11           HG       LEU  11  -9.182  -9.181   5.859
    6   HD13  LEU  11          HD11      LEU  11  -7.972 -10.420   4.287
    7   HD12  LEU  11          HD12      LEU  11  -7.027 -10.657   5.756
    8   HD11  LEU  11          HD13      LEU  11  -6.494  -9.494   4.544
    9   HD22  LEU  11          HD21      LEU  11  -8.316  -8.167   7.769
   10   HD21  LEU  11          HD22      LEU  11  -6.783  -7.766   6.995
   11   HD23  LEU  11          HD23      LEU  11  -7.106  -9.422   7.508

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  12           H        ILE  12  -9.917  -5.885   3.064
    2    HA   ILE  12           HA       ILE  12  -8.229  -3.655   2.623
    3    HB   ILE  12           HB       ILE  12 -10.895  -4.312   1.346
    4   HG12  ILE  12          HG12      ILE  12  -8.866  -5.984   1.274
    5   HG13  ILE  12          HG13      ILE  12  -9.752  -5.644  -0.198
    6   HG23  ILE  12          HG21      ILE  12 -10.309  -2.005   0.878
    7   HG22  ILE  12          HG22      ILE  12  -9.941  -2.944  -0.564
    8   HG21  ILE  12          HG23      ILE  12  -8.671  -2.462   0.523
    9   HD11  ILE  12          HD11      ILE  12  -7.215  -4.214   0.639
   10   HD13  ILE  12          HD12      ILE  12  -8.034  -4.107  -0.918
   11   HD12  ILE  12          HD13      ILE  12  -7.248  -5.595  -0.442

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  13           H        ILE  13 -11.582  -3.922   3.740
    2    HA   ILE  13           HA       ILE  13 -12.041  -1.135   4.010
    3    HB   ILE  13           HB       ILE  13 -13.235  -3.554   5.384
    4   HG12  ILE  13          HG12      ILE  13 -13.477  -3.024   2.849
    5   HG13  ILE  13          HG13      ILE  13 -14.901  -3.470   3.765
    6   HG22  ILE  13          HG21      ILE  13 -15.141  -1.859   5.895
    7   HG21  ILE  13          HG22      ILE  13 -13.909  -0.622   5.688
    8   HG23  ILE  13          HG23      ILE  13 -13.723  -1.847   6.940
    9   HD12  ILE  13          HD11      ILE  13 -14.899  -1.317   2.184
   10   HD11  ILE  13          HD12      ILE  13 -14.204  -0.591   3.620
   11   HD13  ILE  13          HD13      ILE  13 -15.781  -1.341   3.714

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ASN  14           H        ASN  14 -10.913  -3.622   6.279
    2    HA   ASN  14           HA       ASN  14 -10.698  -1.982   8.562
    3    HB2  ASN  14           HB2      ASN  14 -10.445  -4.589   8.241
    4    HB3  ASN  14           HB3      ASN  14  -8.737  -4.201   8.072
    5   HD21  ASN  14          HD21      ASN  14  -9.358  -5.724  10.254
    6   HD22  ASN  14          HD22      ASN  14  -9.321  -4.802  11.677

  No H/Q in entry =           6
  In of MODEL    8
    1    H    SER  15           H        SER  15  -8.312  -2.806   6.055
    2    HA   SER  15           HA       SER  15  -6.163  -1.310   7.111
    3    HB2  SER  15           HB2      SER  15  -5.158  -1.525   4.944
    4    HB3  SER  15           HB3      SER  15  -6.107  -2.987   5.180
    5    HG   SER  15           HG       SER  15  -6.341  -1.119   3.286

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLY  16           H        GLY  16  -8.780  -0.448   4.880
    2    HA3  GLY  16           HA2      GLY  16  -7.930   2.193   4.320
    3    HA2  GLY  16           HA3      GLY  16  -9.581   1.595   4.170

  No H/Q in entry =           3
  In of MODEL    8
    1    H    GLN  17           H        GLN  17 -10.104   0.873   6.824
    2    HA   GLN  17           HA       GLN  17 -10.808   3.377   7.967
    3    HB2  GLN  17           HB2      GLN  17 -12.047   1.315   8.474
    4    HB3  GLN  17           HB3      GLN  17 -10.629   0.658   9.292
    5    HG2  GLN  17           HG2      GLN  17 -10.694   2.492  10.921
    6    HG3  GLN  17           HG3      GLN  17 -12.076   3.201  10.088
    7   HE21  GLN  17          HE21      GLN  17 -12.220   2.375  12.842
    8   HE22  GLN  17          HE22      GLN  17 -13.296   1.065  12.939

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ALA  18           H        ALA  18  -8.171   1.102   8.571
    2    HA   ALA  18           HA       ALA  18  -7.061   2.322  10.833
    3    HB2  ALA  18           HB1      ALA  18  -6.455   0.106   9.464
    4    HB3  ALA  18           HB2      ALA  18  -5.287   0.893  10.526
    5    HB1  ALA  18           HB3      ALA  18  -5.222   1.169   8.784

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ARG  19           H        ARG  19  -6.314   2.844   7.378
    2    HA   ARG  19           HA       ARG  19  -4.417   4.896   7.792
    3    HB2  ARG  19           HB2      ARG  19  -4.757   3.752   5.600
    4    HB3  ARG  19           HB3      ARG  19  -6.302   4.588   5.433
    5    HG2  ARG  19           HG2      ARG  19  -5.179   6.763   5.491
    6    HG3  ARG  19           HG3      ARG  19  -3.626   5.982   5.785
    7    HD2  ARG  19           HD2      ARG  19  -3.768   6.569   3.442
    8    HD3  ARG  19           HD3      ARG  19  -3.847   4.809   3.591
    9    HE   ARG  19           HE       ARG  19  -6.483   5.711   3.600
   10   HH21  ARG  19          HH11      ARG  19  -7.691   5.862   1.689
   11   HH22  ARG  19          HH12      ARG  19  -6.880   5.940   0.164
   12   HH11  ARG  19          HH21      ARG  19  -3.722   5.779   1.547
   13   HH12  ARG  19          HH22      ARG  19  -4.631   5.890   0.084

  No H/Q in entry =          13
  In of MODEL    8
    1    H    SER  20           H        SER  20  -7.920   5.001   7.215
    2    HA   SER  20           HA       SER  20  -8.285   7.756   7.165
    3    HB2  SER  20           HB2      SER  20 -10.081   6.143   6.682
    4    HB3  SER  20           HB3      SER  20 -10.116   5.675   8.380
    5    HG   SER  20           HG       SER  20 -10.370   8.376   7.637

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU  21           H        LEU  21  -8.260   5.576   9.972
    2    HA   LEU  21           HA       LEU  21  -8.694   7.573  11.938
    3    HB2  LEU  21           HB2      LEU  21  -7.330   4.878  12.094
    4    HB3  LEU  21           HB3      LEU  21  -7.638   5.895  13.497
    5    HG   LEU  21           HG       LEU  21  -9.815   4.994  11.589
    6   HD13  LEU  21          HD11      LEU  21  -9.013   2.979  12.550
    7   HD12  LEU  21          HD12      LEU  21 -10.387   3.437  13.556
    8   HD11  LEU  21          HD13      LEU  21  -8.742   3.740  14.119
    9   HD21  LEU  21          HD21      LEU  21  -9.735   6.470  14.216
   10   HD23  LEU  21          HD22      LEU  21 -11.146   5.489  13.833
   11   HD22  LEU  21          HD23      LEU  21 -10.698   6.827  12.785

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ALA  22           H        ALA  22  -5.746   6.208  10.513
    2    HA   ALA  22           HA       ALA  22  -3.860   7.530  12.121
    3    HB2  ALA  22           HB1      ALA  22  -3.449   5.675  10.429
    4    HB1  ALA  22           HB2      ALA  22  -2.257   6.975  10.455
    5    HB3  ALA  22           HB3      ALA  22  -3.483   6.926   9.187

  No H/Q in entry =           5
  In of MODEL    8
    1    H    TYR  23           H        TYR  23  -5.201   8.538   8.945
    2    HA   TYR  23           HA       TYR  23  -3.874  11.039   8.863
    3    HB2  TYR  23           HB2      TYR  23  -4.964  10.122   6.879
    4    HB3  TYR  23           HB3      TYR  23  -6.538  10.221   7.670
    5    HD1  TYR  23           HD1      TYR  23  -3.645  12.289   6.529
    6    HD2  TYR  23           HD2      TYR  23  -7.796  12.215   7.630
    7    HE1  TYR  23           HE1      TYR  23  -3.888  14.638   5.769
    8    HE2  TYR  23           HE2      TYR  23  -8.039  14.563   6.869
    9    HH   TYR  23           HH       TYR  23  -5.272  16.343   5.489

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ALA  24           H        ALA  24  -6.982  10.052  10.264
    2    HA   ALA  24           HA       ALA  24  -7.822  12.640  11.037
    3    HB1  ALA  24           HB1      ALA  24  -9.633  11.383  11.517
    4    HB2  ALA  24           HB2      ALA  24  -8.796  10.817  12.961
    5    HB3  ALA  24           HB3      ALA  24  -8.678   9.903  11.458

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA  25           H        ALA  25  -5.802  10.191  12.601
    2    HA   ALA  25           HA       ALA  25  -5.453  11.448  15.100
    3    HB2  ALA  25           HB1      ALA  25  -4.683   9.098  14.277
    4    HB3  ALA  25           HB2      ALA  25  -3.663   9.961  15.430
    5    HB1  ALA  25           HB3      ALA  25  -3.238   9.943  13.718

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU  26           H        LEU  26  -3.682  11.749  12.048
    2    HA   LEU  26           HA       LEU  26  -1.724  13.577  12.949
    3    HB2  LEU  26           HB2      LEU  26  -1.432  12.423  10.845
    4    HB3  LEU  26           HB3      LEU  26  -2.912  13.126  10.198
    5    HG   LEU  26           HG       LEU  26  -1.904  15.379  10.324
    6   HD12  LEU  26          HD11      LEU  26   0.637  15.408  10.722
    7   HD11  LEU  26          HD12      LEU  26   0.424  13.828  11.470
    8   HD13  LEU  26          HD13      LEU  26  -0.384  15.241  12.150
    9   HD21  LEU  26          HD21      LEU  26  -0.163  13.329   8.921
   10   HD23  LEU  26          HD22      LEU  26  -0.214  15.050   8.549
   11   HD22  LEU  26          HD23      LEU  26  -1.636  14.047   8.271

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LYS  27           H        LYS  27  -4.917  14.047  11.491
    2    HA   LYS  27           HA       LYS  27  -4.872  16.836  11.289
    3    HB2  LYS  27           HB2      LYS  27  -6.617  15.352  10.316
    4    HB3  LYS  27           HB3      LYS  27  -7.263  15.095  11.937
    5    HG2  LYS  27           HG2      LYS  27  -7.699  17.500  12.172
    6    HG3  LYS  27           HG3      LYS  27  -7.001  17.797  10.577
    7    HD2  LYS  27           HD2      LYS  27  -8.736  16.356   9.553
    8    HD3  LYS  27           HD3      LYS  27  -9.439  16.076  11.148
    9    HE2  LYS  27           HE2      LYS  27  -9.888  18.487  11.390
   10    HE3  LYS  27           HE3      LYS  27  -9.156  18.788   9.811
   11    HZ3  LYS  27           HZ1      LYS  27 -11.535  18.656   9.584
   12    HZ2  LYS  27           HZ2      LYS  27 -11.574  17.140  10.356
   13    HZ1  LYS  27           HZ3      LYS  27 -10.839  17.304   8.830

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLN  28           H        GLN  28  -5.737  14.751  14.024
    2    HA   GLN  28           HA       GLN  28  -6.627  16.754  15.803
    3    HB2  GLN  28           HB2      GLN  28  -5.214  14.128  16.341
    4    HB3  GLN  28           HB3      GLN  28  -5.950  15.133  17.591
    5    HG2  GLN  28           HG2      GLN  28  -7.431  14.026  15.189
    6    HG3  GLN  28           HG3      GLN  28  -7.459  13.303  16.797
    7   HE21  GLN  28          HE21      GLN  28  -7.694  15.544  18.452
    8   HE22  GLN  28          HE22      GLN  28  -9.142  16.359  18.113

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ALA  29           H        ALA  29  -3.409  15.465  15.095
    2    HA   ALA  29           HA       ALA  29  -1.961  16.868  17.062
    3    HB1  ALA  29           HB1      ALA  29  -0.037  16.179  15.932
    4    HB3  ALA  29           HB2      ALA  29  -0.802  16.300  14.347
    5    HB2  ALA  29           HB3      ALA  29  -1.214  14.968  15.427

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LYS  30           H        LYS  30  -2.842  17.742  13.737
    2    HA   LYS  30           HA       LYS  30  -1.435  20.183  13.625
    3    HB2  LYS  30           HB2      LYS  30  -3.974  19.306  12.234
    4    HB3  LYS  30           HB3      LYS  30  -3.144  20.820  11.882
    5    HG2  LYS  30           HG2      LYS  30  -1.077  19.527  11.357
    6    HG3  LYS  30           HG3      LYS  30  -1.981  18.032  11.609
    7    HD2  LYS  30           HD2      LYS  30  -3.557  18.669   9.824
    8    HD3  LYS  30           HD3      LYS  30  -2.675  20.177   9.574
    9    HE2  LYS  30           HE2      LYS  30  -0.647  18.884   8.982
   10    HE3  LYS  30           HE3      LYS  30  -1.547  17.381   9.202
   11    HZ2  LYS  30           HZ1      LYS  30  -1.386  18.249   6.858
   12    HZ1  LYS  30           HZ2      LYS  30  -2.427  19.513   7.332
   13    HZ3  LYS  30           HZ3      LYS  30  -2.951  17.896   7.408

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLN  31           H        GLN  31  -4.526  19.333  15.058
    2    HA   GLN  31           HA       GLN  31  -5.285  22.091  15.512
    3    HB2  GLN  31           HB2      GLN  31  -6.457  19.647  16.846
    4    HB3  GLN  31           HB3      GLN  31  -7.217  21.219  16.603
    5    HG2  GLN  31           HG2      GLN  31  -6.525  20.438  14.010
    6    HG3  GLN  31           HG3      GLN  31  -7.046  18.935  14.762
    7   HE21  GLN  31          HE21      GLN  31  -8.469  20.508  12.668
    8   HE22  GLN  31          HE22      GLN  31  -9.977  20.901  13.336

  No H/Q in entry =           8
  In of MODEL    8
    1    H    GLY  32           H        GLY  32  -2.965  20.163  16.819
    2    HA3  GLY  32           HA2      GLY  32  -1.552  20.625  18.611
    3    HA2  GLY  32           HA3      GLY  32  -2.676  21.870  19.141

  No H/Q in entry =           3
  In of MODEL    8
    1    H    ASP  33           H        ASP  33  -4.107  18.831  18.492
    2    HA   ASP  33           HA       ASP  33  -4.498  18.377  21.375
    3    HB2  ASP  33           HB2      ASP  33  -5.923  17.365  18.908
    4    HB3  ASP  33           HB3      ASP  33  -6.258  16.756  20.527

  No H/Q in entry =           4
  In of MODEL    8
    1    H    PHE  34           H        PHE  34  -2.329  17.523  21.666
    2    HA   PHE  34           HA       PHE  34  -1.341  15.272  20.261
    3    HB2  PHE  34           HB2      PHE  34  -0.704  16.258  23.050
    4    HB3  PHE  34           HB3      PHE  34   0.217  15.033  22.177
    5    HD1  PHE  34           HD1      PHE  34   0.055  18.459  22.911
    6    HD2  PHE  34           HD2      PHE  34   0.859  15.752  19.672
    7    HE1  PHE  34           HE1      PHE  34   1.345  20.228  21.746
    8    HE2  PHE  34           HE2      PHE  34   2.144  17.524  18.513
    9    HZ   PHE  34           HZ       PHE  34   2.389  19.759  19.554

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ALA  35           H        ALA  35  -3.361  15.554  23.137
    2    HA   ALA  35           HA       ALA  35  -3.146  12.892  24.034
    3    HB3  ALA  35           HB1      ALA  35  -5.597  13.522  24.908
    4    HB1  ALA  35           HB2      ALA  35  -5.065  15.140  24.447
    5    HB2  ALA  35           HB3      ALA  35  -4.144  14.215  25.633

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA  36           H        ALA  36  -5.609  14.411  21.950
    2    HA   ALA  36           HA       ALA  36  -7.031  12.001  21.484
    3    HB1  ALA  36           HB1      ALA  36  -8.491  13.425  20.537
    4    HB3  ALA  36           HB2      ALA  36  -7.327  13.843  19.280
    5    HB2  ALA  36           HB3      ALA  36  -7.339  14.731  20.803

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA  37           H        ALA  37  -4.360  13.583  19.796
    2    HA   ALA  37           HA       ALA  37  -4.343  11.946  17.500
    3    HB3  ALA  37           HB1      ALA  37  -2.338  13.656  18.908
    4    HB2  ALA  37           HB2      ALA  37  -2.880  13.712  17.231
    5    HB1  ALA  37           HB3      ALA  37  -1.725  12.480  17.745

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LYS  38           H        LYS  38  -2.565  11.640  20.566
    2    HA   LYS  38           HA       LYS  38  -1.246   9.238  20.069
    3    HB2  LYS  38           HB2      LYS  38  -1.552  11.002  22.216
    4    HB3  LYS  38           HB3      LYS  38  -2.169   9.474  22.838
    5    HG2  LYS  38           HG2      LYS  38  -0.080   8.350  22.287
    6    HG3  LYS  38           HG3      LYS  38   0.525   9.794  21.469
    7    HD2  LYS  38           HD2      LYS  38   0.710  11.014  23.502
    8    HD3  LYS  38           HD3      LYS  38  -0.305   9.865  24.376
    9    HE2  LYS  38           HE2      LYS  38   2.054   9.547  24.979
   10    HE3  LYS  38           HE3      LYS  38   1.442   8.131  24.120
   11    HZ3  LYS  38           HZ1      LYS  38   2.731   8.546  22.330
   12    HZ2  LYS  38           HZ2      LYS  38   3.695   9.374  23.460
   13    HZ1  LYS  38           HZ3      LYS  38   2.610  10.235  22.475

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ALA  39           H        ALA  39  -4.474   9.738  21.494
    2    HA   ALA  39           HA       ALA  39  -5.035   7.020  22.004
    3    HB3  ALA  39           HB1      ALA  39  -7.196   8.967  21.251
    4    HB2  ALA  39           HB2      ALA  39  -6.288   9.194  22.745
    5    HB1  ALA  39           HB3      ALA  39  -7.208   7.710  22.489

  No H/Q in entry =           5
  In of MODEL    8
    1    H    MET  40           H        MET  40  -5.637   9.032  19.160
    2    HA   MET  40           HA       MET  40  -7.126   7.101  17.711
    3    HB2  MET  40           HB2      MET  40  -5.519   9.493  16.794
    4    HB3  MET  40           HB3      MET  40  -6.554   8.535  15.732
    5    HG2  MET  40           HG2      MET  40  -7.569   9.787  18.296
    6    HG3  MET  40           HG3      MET  40  -7.636  10.621  16.745
    7    HE3  MET  40           HE1      MET  40 -10.236   9.003  14.700
    8    HE2  MET  40           HE2      MET  40  -8.484   9.118  14.540
    9    HE1  MET  40           HE3      MET  40  -9.396  10.485  15.179

  No H/Q in entry =           9
  In of MODEL    8
    1    H    MET  41           H        MET  41  -3.633   7.834  17.809
    2    HA   MET  41           HA       MET  41  -2.891   6.078  15.705
    3    HB2  MET  41           HB2      MET  41  -1.257   6.744  18.167
    4    HB3  MET  41           HB3      MET  41  -0.650   6.095  16.647
    5    HG2  MET  41           HG2      MET  41  -1.812   8.278  15.650
    6    HG3  MET  41           HG3      MET  41  -1.564   8.867  17.292
    7    HE2  MET  41           HE1      MET  41   1.355   6.766  17.635
    8    HE1  MET  41           HE2      MET  41   0.574   8.061  18.538
    9    HE3  MET  41           HE3      MET  41   2.193   8.303  17.884

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ASP  42           H        ASP  42  -3.252   5.607  19.194
    2    HA   ASP  42           HA       ASP  42  -2.217   3.012  19.349
    3    HB2  ASP  42           HB2      ASP  42  -3.077   4.774  21.176
    4    HB3  ASP  42           HB3      ASP  42  -4.505   3.749  21.114

  No H/Q in entry =           4
  In of MODEL    8
    1    H    GLN  43           H        GLN  43  -5.553   4.118  18.870
    2    HA   GLN  43           HA       GLN  43  -6.700   1.531  18.685
    3    HB2  GLN  43           HB2      GLN  43  -7.629   4.184  17.560
    4    HB3  GLN  43           HB3      GLN  43  -8.593   2.705  17.546
    5    HG2  GLN  43           HG2      GLN  43  -8.283   2.585  20.051
    6    HG3  GLN  43           HG3      GLN  43  -7.557   4.190  19.974
    7   HE21  GLN  43          HE21      GLN  43  -9.727   4.272  21.489
    8   HE22  GLN  43          HE22      GLN  43 -11.093   4.847  20.666

  No H/Q in entry =           8
  In of MODEL    8
    1    H    SER  44           H        SER  44  -5.374   3.743  16.263
    2    HA   SER  44           HA       SER  44  -6.092   2.258  13.979
    3    HB2  SER  44           HB2      SER  44  -4.831   4.641  14.413
    4    HB3  SER  44           HB3      SER  44  -3.481   3.644  13.874
    5    HG   SER  44           HG       SER  44  -4.605   4.616  12.118

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ARG  45           H        ARG  45  -3.200   2.145  16.040
    2    HA   ARG  45           HA       ARG  45  -1.731   0.189  14.649
    3    HB2  ARG  45           HB2      ARG  45  -0.876   1.611  16.512
    4    HB3  ARG  45           HB3      ARG  45  -1.860   0.681  17.639
    5    HG2  ARG  45           HG2      ARG  45  -0.634  -1.379  16.989
    6    HG3  ARG  45           HG3      ARG  45   0.375  -0.425  15.904
    7    HD2  ARG  45           HD2      ARG  45   1.123   0.957  17.854
    8    HD3  ARG  45           HD3      ARG  45   0.207  -0.117  18.934
    9    HE   ARG  45           HE       ARG  45   1.895  -1.715  17.343
   10   HH21  ARG  45          HH11      ARG  45   3.801  -2.538  18.168
   11   HH22  ARG  45          HH12      ARG  45   4.583  -1.752  19.494
   12   HH11  ARG  45          HH21      ARG  45   2.216   0.753  19.730
   13   HH12  ARG  45          HH22      ARG  45   3.685   0.114  20.376

  No H/Q in entry =          13
  In of MODEL    8
    1    H    MET  46           H        MET  46  -4.111  -0.129  17.265
    2    HA   MET  46           HA       MET  46  -3.943  -2.928  17.572
    3    HB2  MET  46           HB2      MET  46  -6.105  -0.919  18.187
    4    HB3  MET  46           HB3      MET  46  -6.314  -2.639  18.526
    5    HG2  MET  46           HG2      MET  46  -4.253  -2.616  19.890
    6    HG3  MET  46           HG3      MET  46  -4.058  -0.900  19.568
    7    HE3  MET  46           HE1      MET  46  -4.335   0.383  21.776
    8    HE2  MET  46           HE2      MET  46  -6.001   0.862  22.083
    9    HE1  MET  46           HE3      MET  46  -5.355   0.947  20.447

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ALA  47           H        ALA  47  -5.975  -0.910  15.490
    2    HA   ALA  47           HA       ALA  47  -7.602  -2.960  14.436
    3    HB3  ALA  47           HB1      ALA  47  -8.282  -0.722  14.023
    4    HB1  ALA  47           HB2      ALA  47  -7.804  -1.356  12.449
    5    HB2  ALA  47           HB3      ALA  47  -6.717  -0.289  13.338

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU  48           H        LEU  48  -4.489  -1.656  13.364
    2    HA   LEU  48           HA       LEU  48  -4.225  -3.247  11.022
    3    HB2  LEU  48           HB2      LEU  48  -2.154  -1.971  12.816
    4    HB3  LEU  48           HB3      LEU  48  -1.797  -2.693  11.247
    5    HG   LEU  48           HG       LEU  48  -3.813  -0.472  11.649
    6   HD13  LEU  48          HD11      LEU  48  -1.686   0.401  12.301
    7   HD12  LEU  48          HD12      LEU  48  -1.971   0.954  10.651
    8   HD11  LEU  48          HD13      LEU  48  -0.873  -0.394  10.952
    9   HD22  LEU  48          HD21      LEU  48  -4.300  -1.457   9.577
   10   HD21  LEU  48          HD22      LEU  48  -2.620  -1.895   9.271
   11   HD23  LEU  48          HD23      LEU  48  -3.137  -0.215   9.114

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ASN  49           H        ASN  49  -3.159  -3.645  14.361
    2    HA   ASN  49           HA       ASN  49  -1.563  -5.911  14.021
    3    HB2  ASN  49           HB2      ASN  49  -1.565  -4.584  16.069
    4    HB3  ASN  49           HB3      ASN  49  -3.228  -5.046  16.402
    5   HD21  ASN  49          HD21      ASN  49  -1.484  -5.632  18.395
    6   HD22  ASN  49          HD22      ASN  49  -1.122  -7.290  18.433

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLU  50           H        GLU  50  -5.027  -5.628  14.715
    2    HA   GLU  50           HA       GLU  50  -5.545  -8.426  14.827
    3    HB2  GLU  50           HB2      GLU  50  -7.121  -6.735  15.713
    4    HB3  GLU  50           HB3      GLU  50  -7.424  -6.170  14.068
    5    HG2  GLU  50           HG2      GLU  50  -8.298  -8.364  13.436
    6    HG3  GLU  50           HG3      GLU  50  -7.909  -9.008  15.027

  No H/Q in entry =           6
  In of MODEL    8
    1    H    ALA  51           H        ALA  51  -5.623  -6.028  12.231
    2    HA   ALA  51           HA       ALA  51  -6.626  -7.754  10.216
    3    HB2  ALA  51           HB1      ALA  51  -6.410  -5.942   8.845
    4    HB1  ALA  51           HB2      ALA  51  -4.766  -5.598   9.383
    5    HB3  ALA  51           HB3      ALA  51  -6.142  -5.082  10.360

  No H/Q in entry =           5
  In of MODEL    8
    1    H    HIS  52           H        HIS  52  -3.327  -6.857  11.179
    2    HA   HIS  52           HA       HIS  52  -1.945  -8.351   9.221
    3    HB2  HIS  52           HB2      HIS  52  -0.877  -6.629  10.629
    4    HB3  HIS  52           HB3      HIS  52  -1.077  -7.666  12.041
    5    HD1  HIS  52           HD1      HIS  52   0.263  -9.973  12.006
    6    HD2  HIS  52           HD2      HIS  52   1.329  -7.261   9.025
    7    HE1  HIS  52           HE1      HIS  52   2.478 -10.770  11.072
    8    HE2  HIS  52           HE2      HIS  52   3.142  -9.126   9.253

  No H/Q in entry =           8
  In of MODEL    8
    1    H    LEU  53           H        LEU  53  -3.140  -9.223  12.441
    2    HA   LEU  53           HA       LEU  53  -1.950 -11.772  12.628
    3    HB2  LEU  53           HB2      LEU  53  -4.424 -10.582  13.857
    4    HB3  LEU  53           HB3      LEU  53  -3.967 -12.259  14.147
    5    HG   LEU  53           HG       LEU  53  -2.053  -9.950  14.606
    6   HD13  LEU  53          HD11      LEU  53  -3.937  -9.570  16.070
    7   HD12  LEU  53          HD12      LEU  53  -2.636 -10.264  17.035
    8   HD11  LEU  53          HD13      LEU  53  -3.987 -11.269  16.526
    9   HD21  LEU  53          HD21      LEU  53  -2.105 -12.885  15.337
   10   HD23  LEU  53          HD22      LEU  53  -1.161 -11.739  16.284
   11   HD22  LEU  53          HD23      LEU  53  -0.798 -11.977  14.586

  No H/Q in entry =          11
  In of MODEL    8
    1    H    VAL  54           H        VAL  54  -5.065 -10.731  11.285
    2    HA   VAL  54           HA       VAL  54  -5.994 -13.321  10.604
    3    HB   VAL  54           HB       VAL  54  -6.637 -10.586   9.473
    4   HG12  VAL  54          HG11      VAL  54  -8.749 -11.955   8.674
    5   HG11  VAL  54          HG12      VAL  54  -7.643 -13.326   8.740
    6   HG13  VAL  54          HG13      VAL  54  -7.284 -11.952   7.695
    7   HG22  VAL  54          HG21      VAL  54  -7.530 -10.620  11.630
    8   HG21  VAL  54          HG22      VAL  54  -7.792 -12.362  11.612
    9   HG23  VAL  54          HG23      VAL  54  -8.874 -11.301  10.712

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLN  55           H        GLN  55  -4.123 -10.878   8.803
    2    HA   GLN  55           HA       GLN  55  -4.014 -12.343   6.385
    3    HB2  GLN  55           HB2      GLN  55  -3.402 -10.082   6.191
    4    HB3  GLN  55           HB3      GLN  55  -2.283 -10.163   7.549
    5    HG2  GLN  55           HG2      GLN  55  -0.577 -11.017   6.262
    6    HG3  GLN  55           HG3      GLN  55  -1.661 -11.987   5.275
    7   HE21  GLN  55          HE21      GLN  55  -1.688 -11.297   3.154
    8   HE22  GLN  55          HE22      GLN  55  -1.486  -9.694   2.642

  No H/Q in entry =           8
  In of MODEL    8
    1    H    THR  56           H        THR  56  -1.891 -12.332   9.253
    2    HA   THR  56           HA       THR  56   0.175 -13.940   8.323
    3    HB   THR  56           HB       THR  56  -1.049 -14.192  11.078
    4    HG1  THR  56           HG1      THR  56   0.735 -12.266  10.012
    5   HG22  THR  56          HG21      THR  56   1.866 -14.280  10.337
    6   HG21  THR  56          HG22      THR  56   0.860 -15.722  10.193
    7   HG23  THR  56          HG23      THR  56   1.067 -14.943  11.762

  No H/Q in entry =           7
  In of MODEL    8
    1    H    LYS  57           H        LYS  57  -2.942 -14.961   9.705
    2    HA   LYS  57           HA       LYS  57  -2.511 -17.759   9.457
    3    HB2  LYS  57           HB2      LYS  57  -4.316 -16.658  10.814
    4    HB3  LYS  57           HB3      LYS  57  -5.115 -16.208   9.316
    5    HG2  LYS  57           HG2      LYS  57  -5.379 -18.565   8.710
    6    HG3  LYS  57           HG3      LYS  57  -4.521 -19.055  10.168
    7    HD2  LYS  57           HD2      LYS  57  -6.288 -18.009  11.554
    8    HD3  LYS  57           HD3      LYS  57  -7.158 -17.547  10.092
    9    HE2  LYS  57           HE2      LYS  57  -6.450 -20.414  10.806
   10    HE3  LYS  57           HE3      LYS  57  -8.016 -19.684  11.147
   11    HZ2  LYS  57           HZ1      LYS  57  -7.818 -20.980   9.015
   12    HZ1  LYS  57           HZ2      LYS  57  -6.841 -19.717   8.432
   13    HZ3  LYS  57           HZ3      LYS  57  -8.452 -19.411   8.878

  No H/Q in entry =          13
  In of MODEL    8
    1    H    LEU  58           H        LEU  58  -3.844 -15.311   7.289
    2    HA   LEU  58           HA       LEU  58  -4.667 -17.132   5.288
    3    HB2  LEU  58           HB2      LEU  58  -4.047 -14.187   5.148
    4    HB3  LEU  58           HB3      LEU  58  -4.723 -15.121   3.813
    5    HG   LEU  58           HG       LEU  58  -5.985 -14.934   6.568
    6   HD11  LEU  58          HD11      LEU  58  -6.292 -13.286   4.078
    7   HD13  LEU  58          HD12      LEU  58  -6.269 -12.778   5.766
    8   HD12  LEU  58          HD13      LEU  58  -7.700 -13.565   5.103
    9   HD22  LEU  58          HD21      LEU  58  -6.963 -16.839   5.705
   10   HD21  LEU  58          HD22      LEU  58  -6.631 -16.389   4.032
   11   HD23  LEU  58          HD23      LEU  58  -7.985 -15.656   4.891

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  59           H        ILE  59  -1.520 -15.937   6.130
    2    HA   ILE  59           HA       ILE  59  -0.442 -16.671   3.487
    3    HB   ILE  59           HB       ILE  59   0.346 -14.610   5.053
    4   HG12  ILE  59          HG12      ILE  59   2.421 -16.266   3.605
    5   HG13  ILE  59          HG13      ILE  59   1.222 -15.325   2.758
    6   HG23  ILE  59          HG21      ILE  59   2.198 -15.105   6.430
    7   HG22  ILE  59          HG22      ILE  59   2.430 -16.687   5.724
    8   HG21  ILE  59          HG23      ILE  59   1.078 -16.390   6.815
    9   HD13  ILE  59          HD11      ILE  59   2.008 -13.272   3.704
   10   HD12  ILE  59          HD12      ILE  59   3.431 -14.141   3.138
   11   HD11  ILE  59          HD13      ILE  59   3.027 -14.132   4.855

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLU  60           H        GLU  60  -0.439 -17.776   6.855
    2    HA   GLU  60           HA       GLU  60   1.580 -19.764   6.580
    3    HB2  GLU  60           HB2      GLU  60   0.835 -18.977   8.773
    4    HB3  GLU  60           HB3      GLU  60  -0.777 -19.625   8.479
    5    HG2  GLU  60           HG2      GLU  60   1.649 -21.413   8.337
    6    HG3  GLU  60           HG3      GLU  60   0.882 -21.053   9.884

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLY  61           H        GLY  61  -1.933 -19.844   6.114
    2    HA3  GLY  61           HA2      GLY  61  -1.705 -22.639   5.155
    3    HA2  GLY  61           HA3      GLY  61  -3.183 -21.895   5.757

  No H/Q in entry =           3
  In of MODEL    8
    1    H    ASP  62           H        ASP  62  -0.958 -20.330   3.540
    2    HA   ASP  62           HA       ASP  62  -3.016 -19.667   1.704
    3    HB2  ASP  62           HB2      ASP  62  -1.116 -18.837   0.314
    4    HB3  ASP  62           HB3      ASP  62  -1.083 -18.239   1.970

  No H/Q in entry =           4
  In of MODEL    8
    1    H    ALA  63           H        ALA  63  -1.058 -22.508   2.000
    2    HA   ALA  63           HA       ALA  63  -0.765 -23.409  -0.617
    3    HB3  ALA  63           HB1      ALA  63   0.170 -24.675   1.180
    4    HB2  ALA  63           HB2      ALA  63  -0.991 -25.707   0.345
    5    HB1  ALA  63           HB3      ALA  63  -1.423 -24.962   1.884

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLY  64           H        GLY  64  -2.880 -25.609   0.747
    2    HA3  GLY  64           HA2      GLY  64  -4.991 -26.345   0.234
    3    HA2  GLY  64           HA3      GLY  64  -5.422 -24.667  -0.052

  No H/Q in entry =           3
  In of MODEL    8
    1    H    GLU  65           H        GLU  65  -3.380 -24.368  -2.194
    2    HA   GLU  65           HA       GLU  65  -5.028 -25.457  -4.320
    3    HB2  GLU  65           HB2      GLU  65  -2.641 -23.610  -4.377
    4    HB3  GLU  65           HB3      GLU  65  -3.557 -24.102  -5.803
    5    HG2  GLU  65           HG2      GLU  65  -4.762 -22.732  -3.384
    6    HG3  GLU  65           HG3      GLU  65  -4.315 -21.908  -4.875

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLY  66           H        GLY  66  -4.323 -26.625  -6.055
    2    HA3  GLY  66           HA2      GLY  66  -3.062 -28.973  -5.763
    3    HA2  GLY  66           HA3      GLY  66  -3.078 -28.106  -7.286

  No H/Q in entry =           3
  In of MODEL    8
    1    H    LYS  67           H        LYS  67  -1.322 -26.536  -7.623
    2    HA   LYS  67           HA       LYS  67   1.207 -27.739  -6.847
    3    HB2  LYS  67           HB2      LYS  67   2.138 -26.402  -8.681
    4    HB3  LYS  67           HB3      LYS  67   0.735 -27.339  -9.209
    5    HG2  LYS  67           HG2      LYS  67  -0.707 -25.345  -8.814
    6    HG3  LYS  67           HG3      LYS  67   0.731 -24.415  -8.399
    7    HD2  LYS  67           HD2      LYS  67   0.388 -25.825 -11.056
    8    HD3  LYS  67           HD3      LYS  67  -0.060 -24.138 -10.789
    9    HE2  LYS  67           HE2      LYS  67   2.320 -23.797  -9.906
   10    HE3  LYS  67           HE3      LYS  67   2.688 -25.382 -10.585
   11    HZ3  LYS  67           HZ1      LYS  67   2.895 -24.460 -12.568
   12    HZ2  LYS  67           HZ2      LYS  67   2.579 -22.928 -11.905
   13    HZ1  LYS  67           HZ3      LYS  67   1.304 -23.877 -12.503

  No H/Q in entry =          13
  In of MODEL    8
    1    H    MET  68           H        MET  68   2.847 -25.546  -7.381
    2    HA   MET  68           HA       MET  68   3.278 -24.522  -4.803
    3    HB2  MET  68           HB2      MET  68   4.339 -23.627  -7.484
    4    HB3  MET  68           HB3      MET  68   4.968 -23.086  -5.929
    5    HG2  MET  68           HG2      MET  68   4.814 -25.982  -6.815
    6    HG3  MET  68           HG3      MET  68   6.274 -24.991  -6.866
    7    HE1  MET  68           HE1      MET  68   7.289 -23.871  -5.159
    8    HE3  MET  68           HE2      MET  68   7.415 -24.377  -3.475
    9    HE2  MET  68           HE3      MET  68   6.126 -23.279  -3.964

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LYS  69           H        LYS  69   0.917 -23.533  -6.955
    2    HA   LYS  69           HA       LYS  69   1.060 -20.718  -6.635
    3    HB2  LYS  69           HB2      LYS  69  -1.142 -22.516  -7.589
    4    HB3  LYS  69           HB3      LYS  69  -1.311 -20.758  -7.502
    5    HG2  LYS  69           HG2      LYS  69   0.705 -20.492  -8.901
    6    HG3  LYS  69           HG3      LYS  69   0.862 -22.246  -9.005
    7    HD2  LYS  69           HD2      LYS  69  -1.339 -22.385 -10.103
    8    HD3  LYS  69           HD3      LYS  69  -1.507 -20.632  -9.993
    9    HE2  LYS  69           HE2      LYS  69   0.505 -20.338 -11.380
   10    HE3  LYS  69           HE3      LYS  69   0.706 -22.087 -11.471
   11    HZ2  LYS  69           HZ1      LYS  69  -0.997 -20.393 -12.990
   12    HZ1  LYS  69           HZ2      LYS  69  -1.891 -21.615 -12.221
   13    HZ3  LYS  69           HZ3      LYS  69  -0.598 -22.022 -13.245

  No H/Q in entry =          13
  In of MODEL    8
    1    H    VAL  70           H        VAL  70  -0.334 -19.262  -5.555
    2    HA   VAL  70           HA       VAL  70  -1.683 -20.344  -3.146
    3    HB   VAL  70           HB       VAL  70  -0.879 -18.352  -1.915
    4   HG12  VAL  70          HG11      VAL  70   1.392 -19.855  -3.246
    5   HG11  VAL  70          HG12      VAL  70   0.426 -20.483  -1.909
    6   HG13  VAL  70          HG13      VAL  70   1.439 -19.059  -1.672
    7   HG21  VAL  70          HG21      VAL  70   0.314 -17.708  -4.609
    8   HG23  VAL  70          HG22      VAL  70   1.138 -17.165  -3.148
    9   HG22  VAL  70          HG23      VAL  70  -0.510 -16.636  -3.473

  No H/Q in entry =           9
  In of MODEL    8
    1    H    SER  71           H        SER  71  -3.104 -18.571  -2.165
    2    HA   SER  71           HA       SER  71  -5.128 -17.824  -3.987
    3    HB2  SER  71           HB2      SER  71  -5.425 -18.109  -1.490
    4    HB3  SER  71           HB3      SER  71  -4.573 -16.584  -1.268
    5    HG   SER  71           HG       SER  71  -7.006 -17.047  -2.656

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU  72           H        LEU  72  -5.263 -16.194  -5.331
    2    HA   LEU  72           HA       LEU  72  -3.150 -14.391  -5.827
    3    HB2  LEU  72           HB2      LEU  72  -6.022 -14.433  -6.753
    4    HB3  LEU  72           HB3      LEU  72  -4.824 -13.281  -7.336
    5    HG   LEU  72           HG       LEU  72  -4.424 -16.287  -7.470
    6   HD11  LEU  72          HD11      LEU  72  -5.524 -14.361  -9.538
    7   HD13  LEU  72          HD12      LEU  72  -6.357 -15.748  -8.831
    8   HD12  LEU  72          HD13      LEU  72  -4.979 -15.999  -9.903
    9   HD21  LEU  72          HD21      LEU  72  -2.979 -13.868  -8.540
   10   HD23  LEU  72          HD22      LEU  72  -2.871 -15.387  -9.412
   11   HD22  LEU  72          HD23      LEU  72  -2.307 -15.288  -7.747

  No H/Q in entry =          11
  In of MODEL    8
    1    H    VAL  73           H        VAL  73  -6.231 -14.022  -4.176
    2    HA   VAL  73           HA       VAL  73  -6.262 -11.251  -3.823
    3    HB   VAL  73           HB       VAL  73  -7.968 -11.603  -2.225
    4   HG12  VAL  73          HG11      VAL  73  -8.038 -14.010  -4.064
    5   HG11  VAL  73          HG12      VAL  73  -8.420 -12.369  -4.581
    6   HG13  VAL  73          HG13      VAL  73  -9.421 -13.165  -3.365
    7   HG22  VAL  73          HG21      VAL  73  -7.115 -13.044  -0.602
    8   HG21  VAL  73          HG22      VAL  73  -6.540 -14.209  -1.795
    9   HG23  VAL  73          HG23      VAL  73  -8.262 -14.101  -1.426

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LEU  74           H        LEU  74  -4.323 -13.627  -2.254
    2    HA   LEU  74           HA       LEU  74  -3.890 -12.489   0.266
    3    HB2  LEU  74           HB2      LEU  74  -3.115 -14.706  -0.223
    4    HB3  LEU  74           HB3      LEU  74  -2.084 -14.111  -1.524
    5    HG   LEU  74           HG       LEU  74  -0.737 -12.851   0.121
    6   HD11  LEU  74          HD11      LEU  74  -2.769 -14.024   2.027
    7   HD13  LEU  74          HD12      LEU  74  -2.275 -12.338   1.864
    8   HD12  LEU  74          HD13      LEU  74  -1.171 -13.517   2.574
    9   HD22  LEU  74          HD21      LEU  74   0.477 -14.698   0.745
   10   HD21  LEU  74          HD22      LEU  74  -0.580 -15.407  -0.456
   11   HD23  LEU  74          HD23      LEU  74  -0.952 -15.602   1.241

  No H/Q in entry =          11
  In of MODEL    8
    1    H    VAL  75           H        VAL  75  -2.018 -12.102  -2.704
    2    HA   VAL  75           HA       VAL  75  -0.206 -10.185  -1.705
    3    HB   VAL  75           HB       VAL  75  -1.182 -10.674  -4.521
    4   HG13  VAL  75          HG11      VAL  75  -0.328  -8.368  -4.334
    5   HG12  VAL  75          HG12      VAL  75   0.862  -9.365  -5.156
    6   HG11  VAL  75          HG13      VAL  75   1.089  -8.944  -3.466
    7   HG21  VAL  75          HG21      VAL  75   1.328 -11.453  -2.993
    8   HG23  VAL  75          HG22      VAL  75   1.051 -11.772  -4.705
    9   HG22  VAL  75          HG23      VAL  75   0.037 -12.548  -3.487

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLU  76           H        GLU  76  -3.366  -9.824  -3.341
    2    HA   GLU  76           HA       GLU  76  -3.408  -7.010  -3.441
    3    HB2  GLU  76           HB2      GLU  76  -5.079  -8.456  -4.587
    4    HB3  GLU  76           HB3      GLU  76  -5.732  -8.928  -3.026
    5    HG2  GLU  76           HG2      GLU  76  -7.172  -7.212  -3.913
    6    HG3  GLU  76           HG3      GLU  76  -6.272  -6.486  -2.596

  No H/Q in entry =           6
  In of MODEL    8
    1    H    ALA  77           H        ALA  77  -4.509  -9.234  -0.894
    2    HA   ALA  77           HA       ALA  77  -5.445  -7.229   0.873
    3    HB2  ALA  77           HB1      ALA  77  -5.106  -9.022   2.635
    4    HB1  ALA  77           HB2      ALA  77  -4.454 -10.044   1.355
    5    HB3  ALA  77           HB3      ALA  77  -6.123  -9.485   1.271

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLN  78           H        GLN  78  -2.307  -8.792   0.485
    2    HA   GLN  78           HA       GLN  78  -1.028  -7.638   2.726
    3    HB2  GLN  78           HB2      GLN  78  -0.185  -9.582   1.365
    4    HB3  GLN  78           HB3      GLN  78   0.247  -8.437   0.096
    5    HG2  GLN  78           HG2      GLN  78   1.727  -7.252   1.662
    6    HG3  GLN  78           HG3      GLN  78   1.293  -8.383   2.940
    7   HE21  GLN  78          HE21      GLN  78   4.013  -8.113   2.049
    8   HE22  GLN  78          HE22      GLN  78   4.461  -9.559   1.278

  No H/Q in entry =           8
  In of MODEL    8
    1    H    LEU  79           H        LEU  79  -1.414  -6.574  -0.617
    2    HA   LEU  79           HA       LEU  79   0.283  -4.355  -0.615
    3    HB2  LEU  79           HB2      LEU  79  -0.762  -5.156  -2.662
    4    HB3  LEU  79           HB3      LEU  79  -2.359  -4.757  -2.042
    5    HG   LEU  79           HG       LEU  79  -1.803  -2.372  -2.019
    6   HD13  LEU  79          HD11      LEU  79   0.442  -2.140  -1.522
    7   HD12  LEU  79          HD12      LEU  79   0.480  -1.852  -3.261
    8   HD11  LEU  79          HD13      LEU  79   0.931  -3.432  -2.619
    9   HD23  LEU  79          HD21      LEU  79  -1.186  -2.175  -4.575
   10   HD22  LEU  79          HD22      LEU  79  -2.713  -2.916  -4.106
   11   HD21  LEU  79          HD23      LEU  79  -1.349  -3.931  -4.561

  No H/Q in entry =          11
  In of MODEL    8
    1    H    HIS  80           H        HIS  80  -3.178  -4.500   0.236
    2    HA   HIS  80           HA       HIS  80  -3.351  -1.743   0.902
    3    HB2  HIS  80           HB2      HIS  80  -5.062  -4.143   1.232
    4    HB3  HIS  80           HB3      HIS  80  -5.368  -2.802   2.339
    5    HD1  HIS  80           HD1      HIS  80  -6.983  -1.156   1.444
    6    HD2  HIS  80           HD2      HIS  80  -4.822  -2.979  -1.621
    7    HE1  HIS  80           HE1      HIS  80  -7.833  -0.154  -0.729
    8    HE2  HIS  80           HE2      HIS  80  -6.522  -1.259  -2.606

  No H/Q in entry =           8
  In of MODEL    8
    1    H    LEU  81           H        LEU  81  -2.863  -4.642   2.890
    2    HA   LEU  81           HA       LEU  81  -2.825  -3.296   5.375
    3    HB2  LEU  81           HB2      LEU  81  -1.628  -5.918   4.486
    4    HB3  LEU  81           HB3      LEU  81  -1.587  -5.361   6.159
    5    HG   LEU  81           HG       LEU  81  -4.145  -5.598   4.550
    6   HD12  LEU  81          HD11      LEU  81  -4.448  -7.662   6.098
    7   HD11  LEU  81          HD12      LEU  81  -2.695  -7.602   6.272
    8   HD13  LEU  81          HD13      LEU  81  -3.416  -7.827   4.678
    9   HD23  LEU  81          HD21      LEU  81  -4.972  -5.797   7.057
   10   HD22  LEU  81          HD22      LEU  81  -4.643  -4.210   6.365
   11   HD21  LEU  81          HD23      LEU  81  -3.453  -4.978   7.416

  No H/Q in entry =          11
  In of MODEL    8
    1    H    MET  82           H        MET  82  -0.165  -4.213   3.185
    2    HA   MET  82           HA       MET  82   1.935  -3.332   4.854
    3    HB2  MET  82           HB2      MET  82   1.697  -3.671   1.863
    4    HB3  MET  82           HB3      MET  82   3.187  -3.110   2.616
    5    HG2  MET  82           HG2      MET  82   1.770  -5.691   3.349
    6    HG3  MET  82           HG3      MET  82   3.134  -5.589   2.239
    7    HE3  MET  82           HE1      MET  82   6.169  -4.872   4.202
    8    HE2  MET  82           HE2      MET  82   5.250  -3.499   3.591
    9    HE1  MET  82           HE3      MET  82   5.322  -4.989   2.654

  No H/Q in entry =           9
  In of MODEL    8
    1    H    THR  83           H        THR  83   0.105  -1.678   2.311
    2    HA   THR  83           HA       THR  83   1.532   0.761   2.388
    3    HB   THR  83           HB       THR  83  -0.645   1.700   1.418
    4    HG1  THR  83           HG1      THR  83  -2.304   0.413   1.323
    5   HG22  THR  83          HG21      THR  83  -0.401  -0.118  -0.585
    6   HG21  THR  83          HG22      THR  83   1.104  -0.420   0.281
    7   HG23  THR  83          HG23      THR  83   0.749   1.195  -0.331

  No H/Q in entry =           7
  In of MODEL    8
    1    H    SER  84           H        SER  84  -1.469  -0.253   4.011
    2    HA   SER  84           HA       SER  84  -1.939   2.180   5.360
    3    HB2  SER  84           HB2      SER  84  -2.786  -0.653   5.929
    4    HB3  SER  84           HB3      SER  84  -3.263   0.691   6.966
    5    HG   SER  84           HG       SER  84  -3.744   0.381   4.177

  No H/Q in entry =           5
  In of MODEL    8
    1    H    MET  85           H        MET  85  -0.240  -0.763   6.476
    2    HA   MET  85           HA       MET  85   0.305   0.159   9.076
    3    HB2  MET  85           HB2      MET  85   0.576  -2.187   8.392
    4    HB3  MET  85           HB3      MET  85   1.957  -1.730   7.393
    5    HG2  MET  85           HG2      MET  85   3.149  -0.913   9.385
    6    HG3  MET  85           HG3      MET  85   1.760  -1.317  10.392
    7    HE3  MET  85           HE1      MET  85   3.343  -3.644   7.340
    8    HE2  MET  85           HE2      MET  85   4.757  -4.032   8.318
    9    HE1  MET  85           HE3      MET  85   4.352  -2.349   7.995

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LEU  86           H        LEU  86   2.219   0.403   6.111
    2    HA   LEU  86           HA       LEU  86   4.450   1.698   7.251
    3    HB2  LEU  86           HB2      LEU  86   4.235   0.617   4.943
    4    HB3  LEU  86           HB3      LEU  86   3.433   2.105   4.437
    5    HG   LEU  86           HG       LEU  86   5.477   3.337   5.403
    6   HD11  LEU  86          HD11      LEU  86   6.170   0.720   6.197
    7   HD13  LEU  86          HD12      LEU  86   7.184   2.158   6.287
    8   HD12  LEU  86          HD13      LEU  86   7.276   1.110   4.874
    9   HD23  LEU  86          HD21      LEU  86   6.164   1.569   3.047
   10   HD22  LEU  86          HD22      LEU  86   6.571   3.264   3.306
   11   HD21  LEU  86          HD23      LEU  86   4.912   2.807   2.919

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ALA  87           H        ALA  87   1.535   2.962   5.688
    2    HA   ALA  87           HA       ALA  87   2.149   5.687   5.767
    3    HB1  ALA  87           HB1      ALA  87  -0.176   4.076   5.243
    4    HB3  ALA  87           HB2      ALA  87   0.143   5.734   4.741
    5    HB2  ALA  87           HB3      ALA  87  -0.642   5.418   6.290

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ARG  88           H        ARG  88   0.463   3.697   8.170
    2    HA   ARG  88           HA       ARG  88  -0.021   5.750  10.020
    3    HB2  ARG  88           HB2      ARG  88  -0.975   3.404  10.094
    4    HB3  ARG  88           HB3      ARG  88   0.567   2.893  10.788
    5    HG2  ARG  88           HG2      ARG  88   0.117   4.970  12.412
    6    HG3  ARG  88           HG3      ARG  88  -1.555   4.657  11.968
    7    HD2  ARG  88           HD2      ARG  88  -1.666   2.808  13.215
    8    HD3  ARG  88           HD3      ARG  88  -0.085   2.216  12.672
    9    HE   ARG  88           HE       ARG  88  -0.592   3.483  15.130
   10   HH21  ARG  88          HH11      ARG  88   0.982   4.484  16.357
   11   HH22  ARG  88          HH12      ARG  88   2.499   4.900  15.642
   12   HH11  ARG  88          HH21      ARG  88   1.671   3.649  12.537
   13   HH12  ARG  88          HH22      ARG  88   2.898   4.411  13.490

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLU  89           H        GLU  89   2.758   3.512   9.777
    2    HA   GLU  89           HA       GLU  89   4.043   4.393  12.111
    3    HB2  GLU  89           HB2      GLU  89   4.679   2.370  10.763
    4    HB3  GLU  89           HB3      GLU  89   5.453   3.459   9.610
    5    HG2  GLU  89           HG2      GLU  89   6.956   4.296  11.343
    6    HG3  GLU  89           HG3      GLU  89   6.124   3.345  12.569

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LEU  90           H        LEU  90   4.343   5.548   8.781
    2    HA   LEU  90           HA       LEU  90   6.290   7.537   9.352
    3    HB2  LEU  90           HB2      LEU  90   4.266   7.218   7.140
    4    HB3  LEU  90           HB3      LEU  90   5.505   8.480   7.152
    5    HG   LEU  90           HG       LEU  90   6.162   5.540   7.481
    6   HD12  LEU  90          HD11      LEU  90   6.894   5.769   5.036
    7   HD11  LEU  90          HD12      LEU  90   5.888   7.216   4.995
    8   HD13  LEU  90          HD13      LEU  90   5.161   5.647   5.343
    9   HD22  LEU  90          HD21      LEU  90   8.072   6.678   8.149
   10   HD21  LEU  90          HD22      LEU  90   7.723   8.085   7.144
   11   HD23  LEU  90          HD23      LEU  90   8.368   6.616   6.413

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  91           H        ILE  91   2.750   7.573   9.229
    2    HA   ILE  91           HA       ILE  91   2.428  10.348   9.682
    3    HB   ILE  91           HB       ILE  91   0.627   7.983  10.238
    4   HG12  ILE  91          HG12      ILE  91   0.378  10.266   8.255
    5   HG13  ILE  91          HG13      ILE  91   1.226   8.766   7.877
    6   HG22  ILE  91          HG21      ILE  91  -1.093  10.051  10.314
    7   HG21  ILE  91          HG22      ILE  91   0.318  10.873  10.976
    8   HG23  ILE  91          HG23      ILE  91  -0.321   9.440  11.778
    9   HD13  ILE  91          HD11      ILE  91  -0.725   7.490   7.935
   10   HD12  ILE  91          HD12      ILE  91  -1.311   9.008   7.258
   11   HD11  ILE  91          HD13      ILE  91  -1.571   8.646   8.964

  No H/Q in entry =          11
  In of MODEL    8
    1    H    THR  92           H        THR  92   2.832   7.604  11.881
    2    HA   THR  92           HA       THR  92   2.413   8.981  14.308
    3    HB   THR  92           HB       THR  92   4.204   6.636  13.630
    4    HG1  THR  92           HG1      THR  92   2.231   5.890  13.544
    5   HG22  THR  92          HG21      THR  92   3.838   6.354  16.267
    6   HG21  THR  92          HG22      THR  92   3.782   8.114  16.193
    7   HG23  THR  92          HG23      THR  92   5.207   7.251  15.611

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLU  93           H        GLU  93   5.348   8.516  12.353
    2    HA   GLU  93           HA       GLU  93   7.121   9.935  14.037
    3    HB2  GLU  93           HB2      GLU  93   7.186   9.619  11.022
    4    HB3  GLU  93           HB3      GLU  93   8.537  10.142  12.026
    5    HG2  GLU  93           HG2      GLU  93   7.117   7.513  12.485
    6    HG3  GLU  93           HG3      GLU  93   8.494   7.658  11.399

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LEU  94           H        LEU  94   5.058  10.959  11.339
    2    HA   LEU  94           HA       LEU  94   5.875  13.659  11.232
    3    HB2  LEU  94           HB2      LEU  94   3.273  12.306  10.497
    4    HB3  LEU  94           HB3      LEU  94   3.538  14.032  10.253
    5    HG   LEU  94           HG       LEU  94   5.539  12.034   9.189
    6   HD11  LEU  94          HD11      LEU  94   2.792  12.597   8.146
    7   HD13  LEU  94          HD12      LEU  94   3.768  11.136   8.014
    8   HD12  LEU  94          HD13      LEU  94   4.102  12.515   6.967
    9   HD23  LEU  94          HD21      LEU  94   5.785  13.869   7.464
   10   HD22  LEU  94          HD22      LEU  94   6.213  14.360   9.103
   11   HD21  LEU  94          HD23      LEU  94   4.660  14.835   8.415

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  95           H        ILE  95   3.344  12.054  13.141
    2    HA   ILE  95           HA       ILE  95   2.319  14.408  14.343
    3    HB   ILE  95           HB       ILE  95   2.330  11.527  15.268
    4   HG12  ILE  95          HG12      ILE  95   0.110  13.309  14.234
    5   HG13  ILE  95          HG13      ILE  95   1.055  12.246  13.195
    6   HG21  ILE  95          HG21      ILE  95   1.067  14.005  16.478
    7   HG23  ILE  95          HG22      ILE  95   2.116  12.832  17.275
    8   HG22  ILE  95          HG23      ILE  95   0.475  12.378  16.812
    9   HD13  ILE  95          HD11      ILE  95   0.151  10.311  14.122
   10   HD12  ILE  95          HD12      ILE  95  -1.227  11.406  14.207
   11   HD11  ILE  95          HD13      ILE  95  -0.253  11.105  15.645

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLU  96           H        GLU  96   4.912  12.180  15.321
    2    HA   GLU  96           HA       GLU  96   5.489  13.377  17.809
    3    HB2  GLU  96           HB2      GLU  96   6.424  11.214  17.156
    4    HB3  GLU  96           HB3      GLU  96   7.352  11.984  15.869
    5    HG2  GLU  96           HG2      GLU  96   9.012  12.527  17.320
    6    HG3  GLU  96           HG3      GLU  96   7.876  13.344  18.382

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LEU  97           H        LEU  97   6.544  14.144  14.515
    2    HA   LEU  97           HA       LEU  97   8.442  16.134  15.213
    3    HB2  LEU  97           HB2      LEU  97   6.831  15.589  12.729
    4    HB3  LEU  97           HB3      LEU  97   7.856  17.017  12.844
    5    HG   LEU  97           HG       LEU  97   8.880  14.216  13.398
    6   HD12  LEU  97          HD11      LEU  97   9.861  14.406  11.074
    7   HD11  LEU  97          HD12      LEU  97   8.813  15.800  10.817
    8   HD13  LEU  97          HD13      LEU  97   8.110  14.210  11.117
    9   HD23  LEU  97          HD21      LEU  97  11.048  15.488  12.640
   10   HD22  LEU  97          HD22      LEU  97  10.441  15.760  14.273
   11   HD21  LEU  97          HD23      LEU  97  10.122  16.944  13.006

  No H/Q in entry =          11
  In of MODEL    8
    1    H    HIS  98           H        HIS  98   4.946  16.280  14.583
    2    HA   HIS  98           HA       HIS  98   4.657  19.081  14.719
    3    HB2  HIS  98           HB2      HIS  98   2.765  16.837  15.458
    4    HB3  HIS  98           HB3      HIS  98   2.303  18.538  15.516
    5    HD1  HIS  98           HD1      HIS  98   3.300  15.819  13.106
    6    HD2  HIS  98           HD2      HIS  98   1.935  19.757  12.991
    7    HE1  HIS  98           HE1      HIS  98   2.726  16.309  10.686
    8    HE2  HIS  98           HE2      HIS  98   1.898  18.700  10.595

  No H/Q in entry =           8
  In of MODEL    8
    1    H    GLU  99           H        GLU  99   4.799  16.593  17.218
    2    HA   GLU  99           HA       GLU  99   4.211  18.290  19.419
    3    HB2  GLU  99           HB2      GLU  99   4.115  15.808  19.518
    4    HB3  GLU  99           HB3      GLU  99   5.874  15.758  19.398
    5    HG2  GLU  99           HG2      GLU  99   6.081  17.051  21.470
    6    HG3  GLU  99           HG3      GLU  99   4.330  17.197  21.577

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LYS 100           H        LYS 100   7.251  17.350  17.834
    2    HA   LYS 100           HA       LYS 100   8.923  18.746  19.679
    3    HB2  LYS 100           HB2      LYS 100   9.400  17.819  16.837
    4    HB3  LYS 100           HB3      LYS 100  10.639  18.585  17.836
    5    HG2  LYS 100           HG2      LYS 100  10.269  16.836  19.581
    6    HG3  LYS 100           HG3      LYS 100   9.127  16.036  18.498
    7    HD2  LYS 100           HD2      LYS 100  10.909  15.747  16.818
    8    HD3  LYS 100           HD3      LYS 100  12.056  16.560  17.887
    9    HE2  LYS 100           HE2      LYS 100  11.666  14.806  19.608
   10    HE3  LYS 100           HE3      LYS 100  10.581  13.973  18.490
   11    HZ1  LYS 100           HZ1      LYS 100  13.399  14.634  17.816
   12    HZ3  LYS 100           HZ2      LYS 100  12.346  13.582  16.995
   13    HZ2  LYS 100           HZ3      LYS 100  12.944  13.161  18.530

  No H/Q in entry =          13
  In of MODEL    8
    1    H    LEU 101           H        LEU 101   7.212  19.677  16.734
    2    HA   LEU 101           HA       LEU 101   8.432  22.230  16.390
    3    HB2  LEU 101           HB2      LEU 101   5.827  21.004  15.522
    4    HB3  LEU 101           HB3      LEU 101   6.082  22.734  15.312
    5    HG   LEU 101           HG       LEU 101   8.105  20.711  14.333
    6   HD12  LEU 101          HD11      LEU 101   6.938  21.220  12.056
    7   HD11  LEU 101          HD12      LEU 101   5.546  21.655  13.046
    8   HD13  LEU 101          HD13      LEU 101   6.206  20.022  13.123
    9   HD21  LEU 101          HD21      LEU 101   7.482  23.626  13.781
   10   HD23  LEU 101          HD22      LEU 101   8.452  22.662  12.668
   11   HD22  LEU 101          HD23      LEU 101   9.006  22.919  14.322

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LYS 102           H        LYS 102   6.909  21.098  19.017
    2    HA   LYS 102           HA       LYS 102   6.293  22.192  20.953
    3    HB2  LYS 102           HB2      LYS 102   7.575  24.178  19.819
    4    HB3  LYS 102           HB3      LYS 102   5.975  24.788  19.454
    5    HG2  LYS 102           HG2      LYS 102   7.370  24.528  22.097
    6    HG3  LYS 102           HG3      LYS 102   6.417  25.860  21.474
    7    HD2  LYS 102           HD2      LYS 102   5.171  23.228  22.362
    8    HD3  LYS 102           HD3      LYS 102   5.431  24.588  23.443
    9    HE2  LYS 102           HE2      LYS 102   3.140  24.192  21.970
   10    HE3  LYS 102           HE3      LYS 102   3.653  25.737  22.648
   11    HZ2  LYS 102           HZ1      LYS 102   3.107  25.846  20.272
   12    HZ1  LYS 102           HZ2      LYS 102   4.362  24.759  19.941
   13    HZ3  LYS 102           HZ3      LYS 102   4.715  26.289  20.581

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ALA 103           H        ALA 103   4.642  23.740  18.196
    2    HA   ALA 103           HA       ALA 103   2.196  24.325  19.098
    3    HB1  ALA 103           HB1      ALA 103   1.279  23.486  16.862
    4    HB2  ALA 103           HB2      ALA 103   2.922  22.943  16.521
    5    HB3  ALA 103           HB3      ALA 103   2.595  24.656  16.789

  No H/Q in entry =           5
  In of MODEL    8
    1    H1   ALA   1           H3       ALA   1  10.466 -20.210  -6.224
    2    H2   ALA   1           H2       ALA   1   9.491 -20.413  -7.604
    3    H3   ALA   1           H1       ALA   1   9.061 -21.157  -6.137
    4    HA   ALA   1           HA       ALA   1  10.089 -22.970  -6.884
    5    HB1  ALA   1           HB1      ALA   1  10.169 -22.612  -9.160
    6    HB2  ALA   1           HB2      ALA   1  11.900 -22.468  -8.843
    7    HB3  ALA   1           HB3      ALA   1  10.906 -21.017  -8.987

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLU   2           H        GLU   2  12.368 -23.930  -6.958
    2    HA   GLU   2           HA       GLU   2  13.765 -23.854  -4.756
    3    HB2  GLU   2           HB2      GLU   2  15.103 -23.728  -7.464
    4    HB3  GLU   2           HB3      GLU   2  15.839 -24.342  -5.984
    5    HG2  GLU   2           HG2      GLU   2  14.812 -26.355  -6.218
    6    HG3  GLU   2           HG3      GLU   2  13.242 -25.603  -6.465

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLU   3           H        GLU   3  15.527 -21.997  -7.170
    2    HA   GLU   3           HA       GLU   3  16.702 -20.315  -5.219
    3    HB2  GLU   3           HB2      GLU   3  16.624 -20.313  -8.228
    4    HB3  GLU   3           HB3      GLU   3  17.382 -18.987  -7.347
    5    HG2  GLU   3           HG2      GLU   3  19.045 -20.368  -6.436
    6    HG3  GLU   3           HG3      GLU   3  18.091 -21.831  -6.650

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LEU   4           H        LEU   4  14.404 -19.457  -7.833
    2    HA   LEU   4           HA       LEU   4  13.954 -16.846  -7.219
    3    HB2  LEU   4           HB2      LEU   4  11.765 -18.812  -7.933
    4    HB3  LEU   4           HB3      LEU   4  11.696 -17.062  -8.132
    5    HG   LEU   4           HG       LEU   4  13.642 -18.934  -9.518
    6   HD13  LEU   4          HD11      LEU   4  12.328 -18.780 -11.419
    7   HD12  LEU   4          HD12      LEU   4  11.630 -17.232 -10.947
    8   HD11  LEU   4          HD13      LEU   4  11.075 -18.720 -10.181
    9   HD23  LEU   4          HD21      LEU   4  13.979 -16.691 -10.873
   10   HD22  LEU   4          HD22      LEU   4  14.849 -16.937  -9.359
   11   HD21  LEU   4          HD23      LEU   4  13.400 -15.934  -9.388

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLU   5           H        GLU   5  12.469 -19.624  -5.566
    2    HA   GLU   5           HA       GLU   5  10.811 -18.045  -3.851
    3    HB2  GLU   5           HB2      GLU   5  10.358 -20.414  -4.361
    4    HB3  GLU   5           HB3      GLU   5  11.809 -20.867  -3.465
    5    HG2  GLU   5           HG2      GLU   5  10.893 -19.842  -1.430
    6    HG3  GLU   5           HG3      GLU   5   9.452 -19.348  -2.318

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLU   6           H        GLU   6  13.953 -19.638  -3.431
    2    HA   GLU   6           HA       GLU   6  14.329 -18.783  -0.735
    3    HB2  GLU   6           HB2      GLU   6  16.276 -19.721  -2.855
    4    HB3  GLU   6           HB3      GLU   6  16.728 -19.393  -1.181
    5    HG2  GLU   6           HG2      GLU   6  15.153 -21.080  -0.386
    6    HG3  GLU   6           HG3      GLU   6  14.587 -21.363  -2.031

  No H/Q in entry =           6
  In of MODEL    8
    1    H    VAL   7           H        VAL   7  15.077 -17.460  -3.891
    2    HA   VAL   7           HA       VAL   7  16.778 -15.340  -3.039
    3    HB   VAL   7           HB       VAL   7  15.053 -15.697  -5.503
    4   HG11  VAL   7          HG11      VAL   7  16.961 -13.491  -4.705
    5   HG13  VAL   7          HG12      VAL   7  15.315 -13.342  -5.317
    6   HG12  VAL   7          HG13      VAL   7  16.614 -13.850  -6.396
    7   HG21  VAL   7          HG21      VAL   7  17.158 -17.162  -4.950
    8   HG23  VAL   7          HG22      VAL   7  18.066 -15.704  -5.355
    9   HG22  VAL   7          HG23      VAL   7  17.018 -16.450  -6.558

  No H/Q in entry =           9
  In of MODEL    8
    1    H    VAL   8           H        VAL   8  13.281 -15.596  -3.570
    2    HA   VAL   8           HA       VAL   8  12.629 -12.885  -3.094
    3    HB   VAL   8           HB       VAL   8  11.014 -15.411  -2.656
    4   HG11  VAL   8          HG11      VAL   8  10.290 -12.485  -2.430
    5   HG13  VAL   8          HG12      VAL   8   9.981 -13.781  -1.273
    6   HG12  VAL   8          HG13      VAL   8   9.075 -13.714  -2.784
    7   HG23  VAL   8          HG21      VAL   8  10.343 -13.475  -4.819
    8   HG22  VAL   8          HG22      VAL   8  10.378 -15.235  -4.857
    9   HG21  VAL   8          HG23      VAL   8  11.874 -14.323  -5.031

  No H/Q in entry =           9
  In of MODEL    8
    1    H    MET   9           H        MET   9  12.901 -15.692  -0.916
    2    HA   MET   9           HA       MET   9  12.107 -14.417   1.460
    3    HB2  MET   9           HB2      MET   9  14.018 -16.691   0.917
    4    HB3  MET   9           HB3      MET   9  13.697 -16.117   2.555
    5    HG2  MET   9           HG2      MET   9  11.292 -16.531   2.244
    6    HG3  MET   9           HG3      MET   9  11.591 -17.071   0.592
    7    HE3  MET   9           HE1      MET   9  13.769 -17.949   3.993
    8    HE2  MET   9           HE2      MET   9  12.536 -19.074   4.554
    9    HE1  MET   9           HE3      MET   9  12.103 -17.400   4.211

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLY  10           H        GLY  10  15.276 -14.652  -0.119
    2    HA3  GLY  10           HA2      GLY  10  16.754 -13.236   1.840
    3    HA2  GLY  10           HA3      GLY  10  17.204 -13.403   0.144

  No H/Q in entry =           3
  In of MODEL    8
    1    H    LEU  11           H        LEU  11  15.031 -12.175  -1.080
    2    HA   LEU  11           HA       LEU  11  15.725  -9.432  -0.922
    3    HB2  LEU  11           HB2      LEU  11  13.345 -10.835  -2.140
    4    HB3  LEU  11           HB3      LEU  11  13.629  -9.101  -2.302
    5    HG   LEU  11           HG       LEU  11  15.645 -11.216  -3.104
    6   HD13  LEU  11          HD11      LEU  11  13.887 -11.578  -4.612
    7   HD12  LEU  11          HD12      LEU  11  14.887 -10.400  -5.459
    8   HD11  LEU  11          HD13      LEU  11  13.421  -9.877  -4.630
    9   HD22  LEU  11          HD21      LEU  11  16.883  -9.256  -2.888
   10   HD21  LEU  11          HD22      LEU  11  15.509  -8.215  -3.257
   11   HD23  LEU  11          HD23      LEU  11  16.328  -9.086  -4.551

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  12           H        ILE  12  12.961 -11.250   0.365
    2    HA   ILE  12           HA       ILE  12  11.581  -9.023   1.434
    3    HB   ILE  12           HB       ILE  12  11.616 -11.903   2.392
    4   HG12  ILE  12          HG12      ILE  12  10.923 -11.265  -0.060
    5   HG13  ILE  12          HG13      ILE  12   9.917 -12.373   0.852
    6   HG23  ILE  12          HG21      ILE  12  10.661 -10.535   4.129
    7   HG22  ILE  12          HG22      ILE  12   9.312 -11.288   3.279
    8   HG21  ILE  12          HG23      ILE  12   9.726  -9.603   2.962
    9   HD11  ILE  12          HD11      ILE  12   9.450  -9.387   0.628
   10   HD13  ILE  12          HD12      ILE  12   8.380 -10.567   1.384
   11   HD12  ILE  12          HD13      ILE  12   8.635 -10.598  -0.348

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  13           H        ILE  13  13.979 -11.233   2.823
    2    HA   ILE  13           HA       ILE  13  14.035 -10.053   5.403
    3    HB   ILE  13           HB       ILE  13  16.085 -11.625   3.824
    4   HG12  ILE  13          HG12      ILE  13  13.815 -12.599   4.658
    5   HG13  ILE  13          HG13      ILE  13  15.290 -13.519   4.940
    6   HG22  ILE  13          HG21      ILE  13  17.082 -11.993   6.202
    7   HG21  ILE  13          HG22      ILE  13  16.232 -10.514   6.630
    8   HG23  ILE  13          HG23      ILE  13  17.462 -10.490   5.365
    9   HD12  ILE  13          HD11      ILE  13  13.521 -13.032   6.916
   10   HD11  ILE  13          HD12      ILE  13  14.485 -11.565   7.044
   11   HD13  ILE  13          HD13      ILE  13  15.254 -13.138   7.215

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ASN  14           H        ASN  14  15.969  -9.526   2.471
    2    HA   ASN  14           HA       ASN  14  17.723  -7.586   3.520
    3    HB2  ASN  14           HB2      ASN  14  17.683  -8.853   1.205
    4    HB3  ASN  14           HB3      ASN  14  16.787  -7.435   0.674
    5   HD21  ASN  14          HD21      ASN  14  19.219  -7.777  -0.529
    6   HD22  ASN  14          HD22      ASN  14  20.367  -6.694   0.090

  No H/Q in entry =           6
  In of MODEL    8
    1    H    SER  15           H        SER  15  14.601  -7.236   1.849
    2    HA   SER  15           HA       SER  15  14.490  -4.416   1.906
    3    HB2  SER  15           HB2      SER  15  12.149  -4.663   1.438
    4    HB3  SER  15           HB3      SER  15  12.945  -6.015   0.645
    5    HG   SER  15           HG       SER  15  11.080  -6.051   2.557

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLY  16           H        GLY  16  13.412  -6.875   4.218
    2    HA3  GLY  16           HA2      GLY  16  12.204  -5.125   6.083
    3    HA2  GLY  16           HA3      GLY  16  12.821  -6.734   6.441

  No H/Q in entry =           3
  In of MODEL    8
    1    H    GLN  17           H        GLN  17  15.528  -6.402   5.830
    2    HA   GLN  17           HA       GLN  17  16.501  -5.180   8.204
    3    HB2  GLN  17           HB2      GLN  17  17.737  -6.966   7.034
    4    HB3  GLN  17           HB3      GLN  17  18.000  -5.888   5.663
    5    HG2  GLN  17           HG2      GLN  17  19.256  -4.341   7.093
    6    HG3  GLN  17           HG3      GLN  17  18.962  -5.373   8.492
    7   HE21  GLN  17          HE21      GLN  17  21.628  -4.793   7.635
    8   HE22  GLN  17          HE22      GLN  17  22.321  -6.224   7.039

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ALA  18           H        ALA  18  16.290  -4.103   4.845
    2    HA   ALA  18           HA       ALA  18  17.727  -1.710   5.062
    3    HB2  ALA  18           HB1      ALA  18  16.595  -2.926   3.002
    4    HB3  ALA  18           HB2      ALA  18  16.859  -1.182   2.985
    5    HB1  ALA  18           HB3      ALA  18  15.262  -1.828   3.365

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ARG  19           H        ARG  19  14.230  -2.299   5.482
    2    HA   ARG  19           HA       ARG  19  13.566   0.351   6.201
    3    HB2  ARG  19           HB2      ARG  19  11.881  -1.401   5.626
    4    HB3  ARG  19           HB3      ARG  19  12.234  -2.198   7.161
    5    HG2  ARG  19           HG2      ARG  19  11.531  -0.207   8.405
    6    HG3  ARG  19           HG3      ARG  19  11.271   0.669   6.898
    7    HD2  ARG  19           HD2      ARG  19   9.135  -0.128   7.733
    8    HD3  ARG  19           HD3      ARG  19   9.544  -1.007   6.254
    9    HE   ARG  19           HE       ARG  19  10.517  -2.549   8.353
   10   HH21  ARG  19          HH11      ARG  19   9.275  -4.189   9.300
   11   HH22  ARG  19          HH12      ARG  19   7.554  -4.162   9.141
   12   HH11  ARG  19          HH21      ARG  19   7.515  -1.258   7.277
   13   HH12  ARG  19          HH22      ARG  19   6.558  -2.503   7.992

  No H/Q in entry =          13
  In of MODEL    8
    1    H    SER  20           H        SER  20  14.438  -2.478   8.155
    2    HA   SER  20           HA       SER  20  14.171  -1.379  10.694
    3    HB2  SER  20           HB2      SER  20  14.675  -3.761  10.302
    4    HB3  SER  20           HB3      SER  20  16.289  -3.327   9.746
    5    HG   SER  20           HG       SER  20  15.340  -2.481  12.261

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU  21           H        LEU  21  17.000  -1.317   8.539
    2    HA   LEU  21           HA       LEU  21  18.685   0.170  10.266
    3    HB2  LEU  21           HB2      LEU  21  18.645  -0.097   7.251
    4    HB3  LEU  21           HB3      LEU  21  19.907   0.756   8.137
    5    HG   LEU  21           HG       LEU  21  19.161  -2.132   8.680
    6   HD13  LEU  21          HD11      LEU  21  19.982  -2.146   6.451
    7   HD12  LEU  21          HD12      LEU  21  21.381  -2.554   7.445
    8   HD11  LEU  21          HD13      LEU  21  21.200  -0.920   6.808
    9   HD21  LEU  21          HD21      LEU  21  21.321  -0.253   9.627
   10   HD23  LEU  21          HD22      LEU  21  21.660  -1.979   9.561
   11   HD22  LEU  21          HD23      LEU  21  20.355  -1.380  10.574

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ALA  22           H        ALA  22  16.405   1.138   7.725
    2    HA   ALA  22           HA       ALA  22  16.943   3.897   7.735
    3    HB3  ALA  22           HB1      ALA  22  15.529   2.654   6.066
    4    HB2  ALA  22           HB2      ALA  22  14.826   4.167   6.637
    5    HB1  ALA  22           HB3      ALA  22  14.240   2.627   7.269

  No H/Q in entry =           5
  In of MODEL    8
    1    H    TYR  23           H        TYR  23  14.458   2.081   9.587
    2    HA   TYR  23           HA       TYR  23  13.505   4.318  11.042
    3    HB2  TYR  23           HB2      TYR  23  12.268   2.206  11.031
    4    HB3  TYR  23           HB3      TYR  23  13.606   1.393  11.843
    5    HD1  TYR  23           HD1      TYR  23  11.115   4.144  12.234
    6    HD2  TYR  23           HD2      TYR  23  13.816   1.443  14.197
    7    HE1  TYR  23           HE1      TYR  23  10.206   4.836  14.437
    8    HE2  TYR  23           HE2      TYR  23  12.907   2.133  16.398
    9    HH   TYR  23           HH       TYR  23  10.304   4.564  16.631

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ALA  24           H        ALA  24  16.154   2.042  11.662
    2    HA   ALA  24           HA       ALA  24  16.841   3.038  14.221
    3    HB1  ALA  24           HB1      ALA  24  18.196   1.244  14.048
    4    HB3  ALA  24           HB2      ALA  24  19.217   2.165  12.942
    5    HB2  ALA  24           HB3      ALA  24  17.918   1.157  12.309

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA  25           H        ALA  25  17.777   3.966  10.936
    2    HA   ALA  25           HA       ALA  25  19.727   5.900  11.569
    3    HB1  ALA  25           HB1      ALA  25  18.995   4.952   9.258
    4    HB3  ALA  25           HB2      ALA  25  19.498   6.639   9.348
    5    HB2  ALA  25           HB3      ALA  25  17.783   6.233   9.290

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU  26           H        LEU  26  16.210   6.130  11.230
    2    HA   LEU  26           HA       LEU  26  15.991   8.912  11.683
    3    HB2  LEU  26           HB2      LEU  26  14.122   7.678  10.767
    4    HB3  LEU  26           HB3      LEU  26  14.040   6.650  12.193
    5    HG   LEU  26           HG       LEU  26  13.444   8.608  13.577
    6   HD12  LEU  26          HD11      LEU  26  12.776  10.710  12.256
    7   HD11  LEU  26          HD12      LEU  26  13.748  10.056  10.940
    8   HD13  LEU  26          HD13      LEU  26  14.503  10.440  12.487
    9   HD21  LEU  26          HD21      LEU  26  11.752   8.296  11.078
   10   HD23  LEU  26          HD22      LEU  26  11.202   8.995  12.598
   11   HD22  LEU  26          HD23      LEU  26  11.652   7.293  12.525

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LYS  27           H        LYS  27  15.894   6.133  13.876
    2    HA   LYS  27           HA       LYS  27  15.318   7.500  16.248
    3    HB2  LYS  27           HB2      LYS  27  15.342   5.024  15.983
    4    HB3  LYS  27           HB3      LYS  27  17.105   5.075  15.929
    5    HG2  LYS  27           HG2      LYS  27  17.171   6.061  18.178
    6    HG3  LYS  27           HG3      LYS  27  15.404   6.081  18.235
    7    HD2  LYS  27           HD2      LYS  27  15.374   3.614  17.998
    8    HD3  LYS  27           HD3      LYS  27  17.139   3.601  17.975
    9    HE2  LYS  27           HE2      LYS  27  17.189   4.590  20.231
   10    HE3  LYS  27           HE3      LYS  27  15.423   4.633  20.257
   11    HZ3  LYS  27           HZ1      LYS  27  16.216   2.679  21.403
   12    HZ2  LYS  27           HZ2      LYS  27  17.123   2.199  20.046
   13    HZ1  LYS  27           HZ3      LYS  27  15.425   2.207  19.978

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLN  28           H        GLN  28  18.423   6.913  14.636
    2    HA   GLN  28           HA       GLN  28  20.122   7.994  16.616
    3    HB2  GLN  28           HB2      GLN  28  20.388   7.943  13.599
    4    HB3  GLN  28           HB3      GLN  28  21.683   8.420  14.698
    5    HG2  GLN  28           HG2      GLN  28  20.267   5.741  14.770
    6    HG3  GLN  28           HG3      GLN  28  21.836   6.024  14.018
    7   HE21  GLN  28          HE21      GLN  28  23.120   7.662  15.875
    8   HE22  GLN  28          HE22      GLN  28  23.266   6.851  17.358

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ALA  29           H        ALA  29  18.356   9.480  13.935
    2    HA   ALA  29           HA       ALA  29  19.362  12.098  14.181
    3    HB2  ALA  29           HB1      ALA  29  17.655  12.739  12.721
    4    HB1  ALA  29           HB2      ALA  29  16.513  11.568  13.380
    5    HB3  ALA  29           HB3      ALA  29  17.835  11.023  12.348

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LYS  30           H        LYS  30  16.591  10.505  15.720
    2    HA   LYS  30           HA       LYS  30  15.591  12.761  17.084
    3    HB2  LYS  30           HB2      LYS  30  15.477   9.820  17.789
    4    HB3  LYS  30           HB3      LYS  30  14.620  11.073  18.688
    5    HG2  LYS  30           HG2      LYS  30  13.483  11.762  16.577
    6    HG3  LYS  30           HG3      LYS  30  14.279  10.423  15.745
    7    HD2  LYS  30           HD2      LYS  30  13.213   8.819  17.280
    8    HD3  LYS  30           HD3      LYS  30  12.427  10.146  18.136
    9    HE2  LYS  30           HE2      LYS  30  11.247  10.782  16.051
   10    HE3  LYS  30           HE3      LYS  30  12.013   9.426  15.215
   11    HZ2  LYS  30           HZ1      LYS  30   9.709   9.023  16.111
   12    HZ1  LYS  30           HZ2      LYS  30  10.387   9.074  17.673
   13    HZ3  LYS  30           HZ3      LYS  30  10.885   7.888  16.560

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLN  31           H        GLN  31  18.251  10.584  17.804
    2    HA   GLN  31           HA       GLN  31  18.599  11.597  20.496
    3    HB2  GLN  31           HB2      GLN  31  20.607  10.020  18.878
    4    HB3  GLN  31           HB3      GLN  31  20.484  10.145  20.633
    5    HG2  GLN  31           HG2      GLN  31  17.963   9.200  19.881
    6    HG3  GLN  31           HG3      GLN  31  19.055   8.353  18.793
    7   HE21  GLN  31          HE21      GLN  31  17.524   7.211  21.080
    8   HE22  GLN  31          HE22      GLN  31  18.685   6.547  22.122

  No H/Q in entry =           8
  In of MODEL    8
    1    H    GLY  32           H        GLY  32  19.103  12.913  17.526
    2    HA3  GLY  32           HA2      GLY  32  20.090  14.956  17.006
    3    HA2  GLY  32           HA3      GLY  32  20.857  14.958  18.589

  No H/Q in entry =           3
  In of MODEL    8
    1    H    ASP  33           H        ASP  33  21.259  12.064  16.808
    2    HA   ASP  33           HA       ASP  33  24.083  12.732  16.324
    3    HB2  ASP  33           HB2      ASP  33  22.568  10.120  16.450
    4    HB3  ASP  33           HB3      ASP  33  24.251  10.232  15.944

  No H/Q in entry =           4
  In of MODEL    8
    1    H    PHE  34           H        PHE  34  23.593  14.056  14.446
    2    HA   PHE  34           HA       PHE  34  22.227  13.076  12.167
    3    HB2  PHE  34           HB2      PHE  34  24.365  15.205  12.384
    4    HB3  PHE  34           HB3      PHE  34  23.369  14.917  10.958
    5    HD1  PHE  34           HD1      PHE  34  23.645  16.850  13.870
    6    HD2  PHE  34           HD2      PHE  34  20.746  14.743  11.503
    7    HE1  PHE  34           HE1      PHE  34  21.839  18.253  14.830
    8    HE2  PHE  34           HE2      PHE  34  18.944  16.145  12.466
    9    HZ   PHE  34           HZ       PHE  34  19.493  17.901  14.124

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ALA  35           H        ALA  35  25.607  12.880  13.153
    2    HA   ALA  35           HA       ALA  35  26.694  12.056  10.689
    3    HB3  ALA  35           HB1      ALA  35  28.383  10.882  12.397
    4    HB2  ALA  35           HB2      ALA  35  27.529  11.910  13.549
    5    HB1  ALA  35           HB3      ALA  35  28.359  12.631  12.170

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA  36           H        ALA  36  25.592  10.103  13.461
    2    HA   ALA  36           HA       ALA  36  26.062   7.614  12.182
    3    HB2  ALA  36           HB1      ALA  36  25.643   6.868  14.260
    4    HB3  ALA  36           HB2      ALA  36  23.955   7.367  14.121
    5    HB1  ALA  36           HB3      ALA  36  25.163   8.496  14.736

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA  37           H        ALA  37  23.246   9.746  12.335
    2    HA   ALA  37           HA       ALA  37  21.378   7.980  11.171
    3    HB3  ALA  37           HB1      ALA  37  21.612  10.943  11.462
    4    HB1  ALA  37           HB2      ALA  37  20.301   9.867  11.943
    5    HB2  ALA  37           HB3      ALA  37  20.479  10.339  10.252

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LYS  38           H        LYS  38  23.472  10.438   9.679
    2    HA   LYS  38           HA       LYS  38  22.814  10.012   7.005
    3    HB2  LYS  38           HB2      LYS  38  24.636  11.566   8.439
    4    HB3  LYS  38           HB3      LYS  38  25.661  10.574   7.406
    5    HG2  LYS  38           HG2      LYS  38  24.484  11.347   5.418
    6    HG3  LYS  38           HG3      LYS  38  23.298  12.204   6.407
    7    HD2  LYS  38           HD2      LYS  38  24.900  13.799   7.149
    8    HD3  LYS  38           HD3      LYS  38  26.255  12.811   6.604
    9    HE2  LYS  38           HE2      LYS  38  25.891  14.683   5.055
   10    HE3  LYS  38           HE3      LYS  38  25.549  13.146   4.253
   11    HZ3  LYS  38           HZ1      LYS  38  23.352  13.594   4.137
   12    HZ2  LYS  38           HZ2      LYS  38  23.877  15.209   4.222
   13    HZ1  LYS  38           HZ3      LYS  38  23.311  14.425   5.618

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ALA  39           H        ALA  39  25.339   8.410   8.945
    2    HA   ALA  39           HA       ALA  39  26.393   6.820   6.868
    3    HB2  ALA  39           HB1      ALA  39  26.322   5.857   9.712
    4    HB1  ALA  39           HB2      ALA  39  27.273   7.281   9.290
    5    HB3  ALA  39           HB3      ALA  39  27.618   5.730   8.524

  No H/Q in entry =           5
  In of MODEL    8
    1    H    MET  40           H        MET  40  23.794   6.207   9.183
    2    HA   MET  40           HA       MET  40  23.343   3.503   8.452
    3    HB2  MET  40           HB2      MET  40  21.538   5.548   9.756
    4    HB3  MET  40           HB3      MET  40  21.128   3.840   9.584
    5    HG2  MET  40           HG2      MET  40  23.687   4.778  10.908
    6    HG3  MET  40           HG3      MET  40  22.199   4.504  11.811
    7    HE3  MET  40           HE1      MET  40  21.633   0.871  11.990
    8    HE2  MET  40           HE2      MET  40  20.760   2.174  11.188
    9    HE1  MET  40           HE3      MET  40  21.512   2.461  12.756

  No H/Q in entry =           9
  In of MODEL    8
    1    H    MET  41           H        MET  41  21.924   6.557   7.274
    2    HA   MET  41           HA       MET  41  19.955   5.364   5.615
    3    HB2  MET  41           HB2      MET  41  21.435   7.953   5.092
    4    HB3  MET  41           HB3      MET  41  19.902   7.461   4.384
    5    HG2  MET  41           HG2      MET  41  19.173   7.273   6.940
    6    HG3  MET  41           HG3      MET  41  20.484   8.429   7.153
    7    HE2  MET  41           HE1      MET  41  19.900   9.718   3.821
    8    HE1  MET  41           HE2      MET  41  20.866  10.157   5.226
    9    HE3  MET  41           HE3      MET  41  19.590  11.237   4.670

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ASP  42           H        ASP  42  23.325   6.285   5.040
    2    HA   ASP  42           HA       ASP  42  23.398   5.811   2.281
    3    HB2  ASP  42           HB2      ASP  42  25.161   6.808   4.039
    4    HB3  ASP  42           HB3      ASP  42  25.817   5.182   3.907

  No H/Q in entry =           4
  In of MODEL    8
    1    H    GLN  43           H        GLN  43  24.139   3.656   4.997
    2    HA   GLN  43           HA       GLN  43  24.791   1.398   3.409
    3    HB2  GLN  43           HB2      GLN  43  23.788   1.582   6.260
    4    HB3  GLN  43           HB3      GLN  43  24.361   0.092   5.501
    5    HG2  GLN  43           HG2      GLN  43  26.521   1.302   4.975
    6    HG3  GLN  43           HG3      GLN  43  25.946   2.629   5.979
    7   HE21  GLN  43          HE21      GLN  43  28.186   1.655   7.000
    8   HE22  GLN  43          HE22      GLN  43  27.919   0.572   8.278

  No H/Q in entry =           8
  In of MODEL    8
    1    H    SER  44           H        SER  44  21.745   2.533   4.815
    2    HA   SER  44           HA       SER  44  20.171   0.291   4.152
    3    HB2  SER  44           HB2      SER  44  19.738   2.820   5.301
    4    HB3  SER  44           HB3      SER  44  18.694   2.778   3.883
    5    HG   SER  44           HG       SER  44  17.612   1.835   5.613

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ARG  45           H        ARG  45  20.903   3.256   2.343
    2    HA   ARG  45           HA       ARG  45  19.362   2.771   0.049
    3    HB2  ARG  45           HB2      ARG  45  20.511   4.906   0.626
    4    HB3  ARG  45           HB3      ARG  45  22.053   4.150   0.229
    5    HG2  ARG  45           HG2      ARG  45  21.254   3.746  -2.080
    6    HG3  ARG  45           HG3      ARG  45  19.724   4.525  -1.683
    7    HD2  ARG  45           HD2      ARG  45  20.980   6.620  -1.107
    8    HD3  ARG  45           HD3      ARG  45  22.472   5.845  -1.685
    9    HE   ARG  45           HE       ARG  45  20.528   5.609  -3.708
   10   HH21  ARG  45          HH11      ARG  45  20.510   6.979  -5.471
   11   HH22  ARG  45          HH12      ARG  45  21.269   8.528  -5.372
   12   HH11  ARG  45          HH21      ARG  45  22.271   8.106  -2.093
   13   HH12  ARG  45          HH22      ARG  45  22.265   9.166  -3.456

  No H/Q in entry =          13
  In of MODEL    8
    1    H    MET  46           H        MET  46  22.731   1.893   0.773
    2    HA   MET  46           HA       MET  46  23.318   0.700  -1.715
    3    HB2  MET  46           HB2      MET  46  24.445   0.380   1.066
    4    HB3  MET  46           HB3      MET  46  25.087  -0.526  -0.309
    5    HG2  MET  46           HG2      MET  46  25.470   1.608  -1.517
    6    HG3  MET  46           HG3      MET  46  24.874   2.496  -0.121
    7    HE3  MET  46           HE1      MET  46  26.834   3.855   0.876
    8    HE2  MET  46           HE2      MET  46  27.672   2.948   2.132
    9    HE1  MET  46           HE3      MET  46  25.918   2.834   1.994

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ALA  47           H        ALA  47  21.954  -0.632   1.270
    2    HA   ALA  47           HA       ALA  47  21.891  -3.345   0.468
    3    HB2  ALA  47           HB1      ALA  47  21.530  -2.883   2.775
    4    HB3  ALA  47           HB2      ALA  47  19.988  -3.484   2.167
    5    HB1  ALA  47           HB3      ALA  47  20.222  -1.753   2.424

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU  48           H        LEU  48  19.540  -0.714   0.128
    2    HA   LEU  48           HA       LEU  48  17.483  -2.244  -1.108
    3    HB2  LEU  48           HB2      LEU  48  18.142   0.709  -1.227
    4    HB3  LEU  48           HB3      LEU  48  16.665   0.001  -1.883
    5    HG   LEU  48           HG       LEU  48  17.540  -0.302   0.999
    6   HD13  LEU  48          HD11      LEU  48  17.124   2.000   0.815
    7   HD12  LEU  48          HD12      LEU  48  15.569   1.355   1.336
    8   HD11  LEU  48          HD13      LEU  48  15.828   1.777  -0.357
    9   HD22  LEU  48          HD21      LEU  48  16.005  -2.013   0.630
   10   HD21  LEU  48          HD22      LEU  48  15.123  -1.109  -0.602
   11   HD23  LEU  48          HD23      LEU  48  14.924  -0.704   1.103

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ASN  49           H        ASN  49  20.166  -0.321  -2.359
    2    HA   ASN  49           HA       ASN  49  19.494  -0.404  -5.078
    3    HB2  ASN  49           HB2      ASN  49  21.183   1.109  -4.169
    4    HB3  ASN  49           HB3      ASN  49  22.213  -0.253  -3.743
    5   HD21  ASN  49          HD21      ASN  49  23.392   1.578  -5.358
    6   HD22  ASN  49          HD22      ASN  49  23.480   1.034  -6.963

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLU  50           H        GLU  50  21.489  -2.602  -3.130
    2    HA   GLU  50           HA       GLU  50  22.170  -4.360  -5.261
    3    HB2  GLU  50           HB2      GLU  50  23.384  -4.337  -3.104
    4    HB3  GLU  50           HB3      GLU  50  21.947  -4.961  -2.296
    5    HG2  GLU  50           HG2      GLU  50  22.021  -6.995  -3.655
    6    HG3  GLU  50           HG3      GLU  50  23.391  -6.366  -4.567

  No H/Q in entry =           6
  In of MODEL    8
    1    H    ALA  51           H        ALA  51  19.532  -4.288  -2.914
    2    HA   ALA  51           HA       ALA  51  18.354  -6.759  -3.661
    3    HB3  ALA  51           HB1      ALA  51  16.775  -6.249  -2.093
    4    HB1  ALA  51           HB2      ALA  51  16.561  -4.602  -2.691
    5    HB2  ALA  51           HB3      ALA  51  17.928  -4.991  -1.645

  No H/Q in entry =           5
  In of MODEL    8
    1    H    HIS  52           H        HIS  52  17.768  -3.410  -4.693
    2    HA   HIS  52           HA       HIS  52  15.639  -3.933  -6.475
    3    HB2  HIS  52           HB2      HIS  52  16.250  -1.669  -5.705
    4    HB3  HIS  52           HB3      HIS  52  17.749  -1.766  -6.629
    5    HD1  HIS  52           HD1      HIS  52  17.488  -1.946  -9.281
    6    HD2  HIS  52           HD2      HIS  52  13.996  -0.984  -7.218
    7    HE1  HIS  52           HE1      HIS  52  15.857  -1.062 -11.006
    8    HE2  HIS  52           HE2      HIS  52  13.723  -0.471  -9.763

  No H/Q in entry =           8
  In of MODEL    8
    1    H    LEU  53           H        LEU  53  19.154  -3.946  -6.936
    2    HA   LEU  53           HA       LEU  53  19.188  -4.264  -9.737
    3    HB2  LEU  53           HB2      LEU  53  21.137  -5.025  -7.576
    4    HB3  LEU  53           HB3      LEU  53  21.438  -5.418  -9.267
    5    HG   LEU  53           HG       LEU  53  20.778  -2.603  -8.347
    6   HD13  LEU  53          HD11      LEU  53  22.814  -3.225  -7.203
    7   HD12  LEU  53          HD12      LEU  53  23.259  -2.214  -8.578
    8   HD11  LEU  53          HD13      LEU  53  23.467  -3.959  -8.665
    9   HD21  LEU  53          HD21      LEU  53  21.838  -3.851 -10.889
   10   HD23  LEU  53          HD22      LEU  53  22.188  -2.169 -10.505
   11   HD22  LEU  53          HD23      LEU  53  20.527  -2.691 -10.713

  No H/Q in entry =          11
  In of MODEL    8
    1    H    VAL  54           H        VAL  54  19.092  -6.649  -7.108
    2    HA   VAL  54           HA       VAL  54  19.198  -8.944  -8.767
    3    HB   VAL  54           HB       VAL  54  18.066  -8.517  -5.991
    4   HG12  VAL  54          HG11      VAL  54  18.386 -11.135  -5.987
    5   HG11  VAL  54          HG12      VAL  54  18.187 -10.967  -7.732
    6   HG13  VAL  54          HG13      VAL  54  16.908 -10.434  -6.643
    7   HG22  VAL  54          HG21      VAL  54  20.384  -8.310  -5.787
    8   HG21  VAL  54          HG22      VAL  54  20.709  -9.403  -7.130
    9   HG23  VAL  54          HG23      VAL  54  20.190 -10.048  -5.573

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLN  55           H        GLN  55  16.483  -7.036  -7.464
    2    HA   GLN  55           HA       GLN  55  14.451  -8.698  -8.520
    3    HB2  GLN  55           HB2      GLN  55  13.718  -7.170  -6.889
    4    HB3  GLN  55           HB3      GLN  55  14.506  -5.803  -7.672
    5    HG2  GLN  55           HG2      GLN  55  12.771  -5.478  -9.149
    6    HG3  GLN  55           HG3      GLN  55  12.445  -7.198  -9.314
    7   HE21  GLN  55          HE21      GLN  55  10.444  -7.744  -8.493
    8   HE22  GLN  55          HE22      GLN  55   9.682  -6.987  -7.179

  No H/Q in entry =           8
  In of MODEL    8
    1    H    THR  56           H        THR  56  16.183  -5.901  -9.896
    2    HA   THR  56           HA       THR  56  14.726  -5.540 -12.233
    3    HB   THR  56           HB       THR  56  17.747  -5.455 -12.097
    4    HG1  THR  56           HG1      THR  56  15.800  -3.566 -11.281
    5   HG22  THR  56          HG21      THR  56  15.922  -3.605 -13.609
    6   HG21  THR  56          HG22      THR  56  16.378  -5.164 -14.292
    7   HG23  THR  56          HG23      THR  56  17.621  -3.973 -13.907

  No H/Q in entry =           7
  In of MODEL    8
    1    H    LYS  57           H        LYS  57  17.378  -7.839 -11.641
    2    HA   LYS  57           HA       LYS  57  17.357  -9.036 -14.218
    3    HB2  LYS  57           HB2      LYS  57  19.161  -9.289 -12.488
    4    HB3  LYS  57           HB3      LYS  57  18.063 -10.281 -11.540
    5    HG2  LYS  57           HG2      LYS  57  17.942 -11.928 -13.348
    6    HG3  LYS  57           HG3      LYS  57  18.982 -10.929 -14.357
    7    HD2  LYS  57           HD2      LYS  57  20.807 -11.159 -12.703
    8    HD3  LYS  57           HD3      LYS  57  19.772 -12.181 -11.706
    9    HE2  LYS  57           HE2      LYS  57  20.523 -12.820 -14.580
   10    HE3  LYS  57           HE3      LYS  57  21.352 -13.495 -13.179
   11    HZ2  LYS  57           HZ1      LYS  57  19.507 -14.867 -14.177
   12    HZ1  LYS  57           HZ2      LYS  57  18.427 -13.725 -13.534
   13    HZ3  LYS  57           HZ3      LYS  57  19.436 -14.618 -12.501

  No H/Q in entry =          13
  In of MODEL    8
    1    H    LEU  58           H        LEU  58  15.600  -9.699 -11.228
    2    HA   LEU  58           HA       LEU  58  14.369 -12.073 -12.150
    3    HB2  LEU  58           HB2      LEU  58  13.593 -10.164  -9.950
    4    HB3  LEU  58           HB3      LEU  58  12.783 -11.702 -10.258
    5    HG   LEU  58           HG       LEU  58  15.761 -11.425  -9.728
    6   HD11  LEU  58          HD11      LEU  58  13.404 -11.839  -7.915
    7   HD13  LEU  58          HD12      LEU  58  14.860 -10.877  -7.666
    8   HD12  LEU  58          HD13      LEU  58  14.932 -12.633  -7.530
    9   HD22  LEU  58          HD21      LEU  58  15.633 -13.488 -10.752
   10   HD21  LEU  58          HD22      LEU  58  13.922 -13.696 -10.378
   11   HD23  LEU  58          HD23      LEU  58  15.141 -13.996  -9.138

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  59           H        ILE  59  13.694  -8.736 -12.830
    2    HA   ILE  59           HA       ILE  59  10.971  -9.384 -13.747
    3    HB   ILE  59           HB       ILE  59  11.791  -7.099 -12.553
    4   HG12  ILE  59          HG12      ILE  59   9.858  -6.974 -14.877
    5   HG13  ILE  59          HG13      ILE  59   9.456  -7.753 -13.368
    6   HG23  ILE  59          HG21      ILE  59  12.337  -5.377 -14.075
    7   HG22  ILE  59          HG22      ILE  59  11.840  -6.312 -15.467
    8   HG21  ILE  59          HG23      ILE  59  13.328  -6.711 -14.615
    9   HD13  ILE  59          HD11      ILE  59   9.721  -5.726 -12.124
   10   HD12  ILE  59          HD12      ILE  59   8.742  -5.326 -13.534
   11   HD11  ILE  59          HD13      ILE  59  10.457  -4.914 -13.505

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLU  60           H        GLU  60  14.165  -8.535 -15.033
    2    HA   GLU  60           HA       GLU  60  13.363  -8.137 -17.735
    3    HB2  GLU  60           HB2      GLU  60  15.548  -7.403 -16.906
    4    HB3  GLU  60           HB3      GLU  60  16.012  -9.074 -16.599
    5    HG2  GLU  60           HG2      GLU  60  15.146  -8.215 -19.355
    6    HG3  GLU  60           HG3      GLU  60  16.806  -7.964 -18.818

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLY  61           H        GLY  61  14.353 -11.017 -15.925
    2    HA3  GLY  61           HA2      GLY  61  13.791 -12.667 -18.320
    3    HA2  GLY  61           HA3      GLY  61  14.834 -13.148 -16.986

  No H/Q in entry =           3
  In of MODEL    8
    1    H    ASP  62           H        ASP  62  11.718 -11.600 -16.592
    2    HA   ASP  62           HA       ASP  62  10.802 -13.559 -14.762
    3    HB2  ASP  62           HB2      ASP  62   8.658 -12.304 -14.909
    4    HB3  ASP  62           HB3      ASP  62  10.050 -11.274 -14.591

  No H/Q in entry =           4
  In of MODEL    8
    1    H    ALA  63           H        ALA  63  10.617 -13.410 -18.238
    2    HA   ALA  63           HA       ALA  63   8.275 -14.776 -18.852
    3    HB3  ALA  63           HB1      ALA  63   9.728 -13.949 -20.602
    4    HB2  ALA  63           HB2      ALA  63   9.549 -15.690 -20.814
    5    HB1  ALA  63           HB3      ALA  63  11.024 -15.037 -20.101

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLY  64           H        GLY  64  10.634 -16.906 -19.822
    2    HA3  GLY  64           HA2      GLY  64  11.172 -19.076 -19.303
    3    HA2  GLY  64           HA3      GLY  64  10.840 -18.683 -17.623

  No H/Q in entry =           3
  In of MODEL    8
    1    H    GLU  65           H        GLU  65   8.058 -17.886 -18.141
    2    HA   GLU  65           HA       GLU  65   6.936 -20.551 -18.043
    3    HB2  GLU  65           HB2      GLU  65   5.669 -17.833 -17.709
    4    HB3  GLU  65           HB3      GLU  65   4.817 -19.363 -17.508
    5    HG2  GLU  65           HG2      GLU  65   7.291 -18.554 -15.958
    6    HG3  GLU  65           HG3      GLU  65   5.644 -18.442 -15.343

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLY  66           H        GLY  66   5.245 -21.325 -19.232
    2    HA3  GLY  66           HA2      GLY  66   5.333 -21.433 -21.914
    3    HA2  GLY  66           HA3      GLY  66   3.843 -21.648 -21.017

  No H/Q in entry =           3
  In of MODEL    8
    1    H    LYS  67           H        LYS  67   2.595 -19.680 -20.551
    2    HA   LYS  67           HA       LYS  67   2.444 -18.043 -22.945
    3    HB2  LYS  67           HB2      LYS  67   0.222 -17.434 -22.114
    4    HB3  LYS  67           HB3      LYS  67   0.447 -19.188 -22.111
    5    HG2  LYS  67           HG2      LYS  67   1.102 -19.070 -19.710
    6    HG3  LYS  67           HG3      LYS  67   0.768 -17.340 -19.725
    7    HD2  LYS  67           HD2      LYS  67  -1.303 -19.417 -20.470
    8    HD3  LYS  67           HD3      LYS  67  -1.112 -18.790 -18.830
    9    HE2  LYS  67           HE2      LYS  67  -1.312 -16.453 -19.861
   10    HE3  LYS  67           HE3      LYS  67  -1.866 -17.261 -21.326
   11    HZ3  LYS  67           HZ1      LYS  67  -3.869 -17.416 -20.436
   12    HZ2  LYS  67           HZ2      LYS  67  -3.330 -16.654 -19.019
   13    HZ1  LYS  67           HZ3      LYS  67  -3.254 -18.345 -19.159

  No H/Q in entry =          13
  In of MODEL    8
    1    H    MET  68           H        MET  68   1.010 -15.914 -21.895
    2    HA   MET  68           HA       MET  68   3.004 -13.996 -21.479
    3    HB2  MET  68           HB2      MET  68   0.028 -13.875 -20.988
    4    HB3  MET  68           HB3      MET  68   1.099 -12.473 -20.997
    5    HG2  MET  68           HG2      MET  68   0.751 -14.399 -23.312
    6    HG3  MET  68           HG3      MET  68  -0.010 -12.812 -23.196
    7    HE1  MET  68           HE1      MET  68   0.971 -10.785 -22.917
    8    HE3  MET  68           HE2      MET  68   2.494 -10.241 -23.617
    9    HE2  MET  68           HE3      MET  68   2.462 -10.858 -21.966

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LYS  69           H        LYS  69   1.892 -16.176 -19.166
    2    HA   LYS  69           HA       LYS  69   1.739 -14.468 -16.897
    3    HB2  LYS  69           HB2      LYS  69   2.002 -17.452 -17.197
    4    HB3  LYS  69           HB3      LYS  69   1.902 -16.662 -15.621
    5    HG2  LYS  69           HG2      LYS  69  -0.215 -15.580 -16.298
    6    HG3  LYS  69           HG3      LYS  69  -0.123 -16.389 -17.862
    7    HD2  LYS  69           HD2      LYS  69  -0.215 -18.580 -16.742
    8    HD3  LYS  69           HD3      LYS  69  -0.297 -17.778 -15.171
    9    HE2  LYS  69           HE2      LYS  69  -2.397 -16.671 -15.842
   10    HE3  LYS  69           HE3      LYS  69  -2.317 -17.469 -17.412
   11    HZ2  LYS  69           HZ1      LYS  69  -3.246 -18.487 -14.927
   12    HZ1  LYS  69           HZ2      LYS  69  -2.022 -19.476 -15.565
   13    HZ3  LYS  69           HZ3      LYS  69  -3.412 -19.141 -16.482

  No H/Q in entry =          13
  In of MODEL    8
    1    H    VAL  70           H        VAL  70   3.094 -14.325 -15.026
    2    HA   VAL  70           HA       VAL  70   5.962 -14.905 -15.507
    3    HB   VAL  70           HB       VAL  70   6.481 -12.779 -14.359
    4   HG12  VAL  70          HG11      VAL  70   4.565 -12.409 -16.682
    5   HG11  VAL  70          HG12      VAL  70   6.256 -12.885 -16.844
    6   HG13  VAL  70          HG13      VAL  70   5.845 -11.297 -16.199
    7   HG21  VAL  70          HG21      VAL  70   3.472 -12.664 -14.173
    8   HG23  VAL  70          HG22      VAL  70   4.399 -11.166 -14.259
    9   HG22  VAL  70          HG23      VAL  70   4.672 -12.295 -12.932

  No H/Q in entry =           9
  In of MODEL    8
    1    H    SER  71           H        SER  71   7.202 -14.708 -13.370
    2    HA   SER  71           HA       SER  71   6.280 -16.621 -11.514
    3    HB2  SER  71           HB2      SER  71   8.676 -15.965 -11.858
    4    HB3  SER  71           HB3      SER  71   8.335 -14.451 -11.025
    5    HG   SER  71           HG       SER  71   8.105 -17.099 -10.025

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU  72           H        LEU  72   4.886 -16.463  -9.908
    2    HA   LEU  72           HA       LEU  72   3.341 -14.148  -9.454
    3    HB2  LEU  72           HB2      LEU  72   3.639 -16.704  -7.884
    4    HB3  LEU  72           HB3      LEU  72   2.474 -15.447  -7.476
    5    HG   LEU  72           HG       LEU  72   2.611 -16.734 -10.222
    6   HD11  LEU  72          HD11      LEU  72   0.905 -17.446  -7.817
    7   HD13  LEU  72          HD12      LEU  72   2.091 -18.481  -8.613
    8   HD12  LEU  72          HD13      LEU  72   0.608 -18.031  -9.455
    9   HD21  LEU  72          HD21      LEU  72   0.734 -14.852  -8.805
   10   HD23  LEU  72          HD22      LEU  72   0.096 -15.916 -10.048
   11   HD22  LEU  72          HD23      LEU  72   1.358 -14.755 -10.447

  No H/Q in entry =          11
  In of MODEL    8
    1    H    VAL  73           H        VAL  73   6.009 -15.586  -7.700
    2    HA   VAL  73           HA       VAL  73   5.967 -14.052  -5.368
    3    HB   VAL  73           HB       VAL  73   8.150 -14.866  -4.954
    4   HG12  VAL  73          HG11      VAL  73   6.838 -16.901  -6.776
    5   HG11  VAL  73          HG12      VAL  73   6.304 -16.569  -5.127
    6   HG13  VAL  73          HG13      VAL  73   7.915 -17.226  -5.420
    7   HG22  VAL  73          HG21      VAL  73   9.472 -14.287  -6.782
    8   HG21  VAL  73          HG22      VAL  73   8.316 -14.924  -7.950
    9   HG23  VAL  73          HG23      VAL  73   9.322 -16.030  -7.014

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LEU  74           H        LEU  74   6.935 -13.160  -8.551
    2    HA   LEU  74           HA       LEU  74   8.885 -11.213  -8.074
    3    HB2  LEU  74           HB2      LEU  74   8.426 -11.950 -10.308
    4    HB3  LEU  74           HB3      LEU  74   6.752 -11.411 -10.197
    5    HG   LEU  74           HG       LEU  74   7.516  -9.071  -9.988
    6   HD11  LEU  74          HD11      LEU  74  10.227 -10.402 -10.139
    7   HD13  LEU  74          HD12      LEU  74   9.645  -9.254  -8.935
    8   HD12  LEU  74          HD13      LEU  74   9.998  -8.709 -10.573
    9   HD22  LEU  74          HD21      LEU  74   7.854  -8.830 -12.248
   10   HD21  LEU  74          HD22      LEU  74   7.276 -10.479 -12.186
   11   HD23  LEU  74          HD23      LEU  74   8.992 -10.173 -12.331

  No H/Q in entry =          11
  In of MODEL    8
    1    H    VAL  75           H        VAL  75   5.387 -10.826  -8.403
    2    HA   VAL  75           HA       VAL  75   5.297  -8.069  -7.816
    3    HB   VAL  75           HB       VAL  75   3.213 -10.216  -7.426
    4   HG13  VAL  75          HG11      VAL  75   2.729  -8.325  -5.922
    5   HG12  VAL  75          HG12      VAL  75   1.638  -8.263  -7.298
    6   HG11  VAL  75          HG13      VAL  75   3.023  -7.184  -7.232
    7   HG21  VAL  75          HG21      VAL  75   3.686  -8.086  -9.540
    8   HG23  VAL  75          HG22      VAL  75   2.286  -9.154  -9.487
    9   HG22  VAL  75          HG23      VAL  75   3.895  -9.823  -9.756

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLU  76           H        GLU  76   5.056 -10.945  -5.704
    2    HA   GLU  76           HA       GLU  76   4.603  -9.582  -3.280
    3    HB2  GLU  76           HB2      GLU  76   4.429 -12.052  -3.521
    4    HB3  GLU  76           HB3      GLU  76   6.166 -12.147  -3.754
    5    HG2  GLU  76           HG2      GLU  76   5.723 -12.727  -1.459
    6    HG3  GLU  76           HG3      GLU  76   6.455 -11.133  -1.444

  No H/Q in entry =           6
  In of MODEL    8
    1    H    ALA  77           H        ALA  77   7.651 -10.493  -4.863
    2    HA   ALA  77           HA       ALA  77   9.355  -9.450  -2.858
    3    HB2  ALA  77           HB1      ALA  77  11.059  -9.388  -4.733
    4    HB3  ALA  77           HB2      ALA  77   9.774  -9.930  -5.812
    5    HB1  ALA  77           HB3      ALA  77  10.286 -10.952  -4.469

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLN  78           H        GLN  78   7.945  -8.033  -5.764
    2    HA   GLN  78           HA       GLN  78   9.301  -5.555  -5.669
    3    HB2  GLN  78           HB2      GLN  78   7.993  -6.467  -7.619
    4    HB3  GLN  78           HB3      GLN  78   6.516  -6.091  -6.734
    5    HG2  GLN  78           HG2      GLN  78   7.167  -3.720  -6.642
    6    HG3  GLN  78           HG3      GLN  78   8.648  -4.088  -7.524
    7   HE21  GLN  78          HE21      GLN  78   6.736  -2.264  -8.611
    8   HE22  GLN  78          HE22      GLN  78   6.031  -2.978  -9.980

  No H/Q in entry =           8
  In of MODEL    8
    1    H    LEU  79           H        LEU  79   6.290  -6.688  -4.220
    2    HA   LEU  79           HA       LEU  79   5.305  -4.279  -3.206
    3    HB2  LEU  79           HB2      LEU  79   3.988  -6.329  -3.141
    4    HB3  LEU  79           HB3      LEU  79   5.139  -7.069  -2.032
    5    HG   LEU  79           HG       LEU  79   4.599  -5.426  -0.303
    6   HD13  LEU  79          HD11      LEU  79   4.131  -3.411  -1.352
    7   HD12  LEU  79          HD12      LEU  79   2.507  -3.934  -0.902
    8   HD11  LEU  79          HD13      LEU  79   3.077  -4.158  -2.554
    9   HD23  LEU  79          HD21      LEU  79   2.013  -5.914  -0.197
   10   HD22  LEU  79          HD22      LEU  79   3.151  -7.255  -0.095
   11   HD21  LEU  79          HD23      LEU  79   2.329  -6.917  -1.615

  No H/Q in entry =          11
  In of MODEL    8
    1    H    HIS  80           H        HIS  80   7.494  -6.617  -1.635
    2    HA   HIS  80           HA       HIS  80   7.798  -5.074   0.732
    3    HB2  HIS  80           HB2      HIS  80   9.125  -7.441  -0.474
    4    HB3  HIS  80           HB3      HIS  80  10.044  -6.545   0.737
    5    HD1  HIS  80           HD1      HIS  80   9.566  -7.179   3.083
    6    HD2  HIS  80           HD2      HIS  80   6.333  -8.025   0.590
    7    HE1  HIS  80           HE1      HIS  80   7.801  -8.279   4.542
    8    HE2  HIS  80           HE2      HIS  80   5.824  -8.799   3.031

  No H/Q in entry =           8
  In of MODEL    8
    1    H    LEU  81           H        LEU  81   9.786  -5.355  -2.192
    2    HA   LEU  81           HA       LEU  81  11.839  -3.618  -1.325
    3    HB2  LEU  81           HB2      LEU  81  10.901  -4.410  -4.083
    4    HB3  LEU  81           HB3      LEU  81  12.324  -3.406  -3.801
    5    HG   LEU  81           HG       LEU  81  11.933  -6.126  -2.524
    6   HD12  LEU  81          HD11      LEU  81  13.738  -6.757  -4.283
    7   HD11  LEU  81          HD12      LEU  81  13.171  -5.332  -5.153
    8   HD13  LEU  81          HD13      LEU  81  12.058  -6.654  -4.808
    9   HD23  LEU  81          HD21      LEU  81  14.562  -5.817  -2.525
   10   HD22  LEU  81          HD22      LEU  81  13.589  -5.054  -1.269
   11   HD21  LEU  81          HD23      LEU  81  14.162  -4.104  -2.640

  No H/Q in entry =          11
  In of MODEL    8
    1    H    MET  82           H        MET  82   8.907  -2.976  -3.246
    2    HA   MET  82           HA       MET  82   9.450  -0.251  -3.751
    3    HB2  MET  82           HB2      MET  82   6.888  -1.839  -3.612
    4    HB3  MET  82           HB3      MET  82   6.890  -0.115  -3.977
    5    HG2  MET  82           HG2      MET  82   8.477  -2.193  -5.520
    6    HG3  MET  82           HG3      MET  82   6.908  -1.567  -6.024
    7    HE3  MET  82           HE1      MET  82   7.359   1.887  -7.200
    8    HE2  MET  82           HE2      MET  82   6.993   1.662  -5.491
    9    HE1  MET  82           HE3      MET  82   6.319   0.554  -6.681

  No H/Q in entry =           9
  In of MODEL    8
    1    H    THR  83           H        THR  83   7.668  -1.844  -1.136
    2    HA   THR  83           HA       THR  83   6.831   0.507   0.194
    3    HB   THR  83           HB       THR  83   6.703  -1.066   2.214
    4    HG1  THR  83           HG1      THR  83   7.454  -3.018   1.980
    5   HG22  THR  83          HG21      THR  83   5.038  -2.628   0.755
    6   HG21  THR  83          HG22      THR  83   5.262  -1.301  -0.379
    7   HG23  THR  83          HG23      THR  83   4.631  -0.983   1.238

  No H/Q in entry =           7
  In of MODEL    8
    1    H    SER  84           H        SER  84   9.652  -1.598   0.701
    2    HA   SER  84           HA       SER  84  10.727  -0.170   2.883
    3    HB2  SER  84           HB2      SER  84  11.964  -2.017   0.852
    4    HB3  SER  84           HB3      SER  84  12.920  -1.266   2.128
    5    HG   SER  84           HG       SER  84  10.641  -2.949   2.400

  No H/Q in entry =           5
  In of MODEL    8
    1    H    MET  85           H        MET  85  11.462   0.087  -0.610
    2    HA   MET  85           HA       MET  85  13.468   2.046  -0.370
    3    HB2  MET  85           HB2      MET  85  13.050   0.761  -2.433
    4    HB3  MET  85           HB3      MET  85  11.531   1.629  -2.656
    5    HG2  MET  85           HG2      MET  85  12.744   3.762  -2.794
    6    HG3  MET  85           HG3      MET  85  14.269   2.923  -2.518
    7    HE3  MET  85           HE1      MET  85  11.181   1.677  -5.001
    8    HE2  MET  85           HE2      MET  85  11.558   2.942  -6.166
    9    HE1  MET  85           HE3      MET  85  11.202   3.374  -4.499

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LEU  86           H        LEU  86   9.976   2.392  -0.860
    2    HA   LEU  86           HA       LEU  86   9.921   5.205  -1.043
    3    HB2  LEU  86           HB2      LEU  86   8.068   3.551  -1.608
    4    HB3  LEU  86           HB3      LEU  86   7.747   3.463   0.124
    5    HG   LEU  86           HG       LEU  86   7.594   6.025   0.071
    6   HD11  LEU  86          HD11      LEU  86   8.354   5.585  -2.635
    7   HD13  LEU  86          HD12      LEU  86   7.927   7.114  -1.873
    8   HD12  LEU  86          HD13      LEU  86   6.684   6.155  -2.671
    9   HD23  LEU  86          HD21      LEU  86   5.447   4.679  -1.580
   10   HD22  LEU  86          HD22      LEU  86   5.268   5.939  -0.363
   11   HD21  LEU  86          HD23      LEU  86   5.664   4.294   0.129

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ALA  87           H        ALA  87   9.462   3.029   1.706
    2    HA   ALA  87           HA       ALA  87   8.931   4.946   3.678
    3    HB1  ALA  87           HB1      ALA  87   9.728   2.123   3.589
    4    HB3  ALA  87           HB2      ALA  87   8.611   2.940   4.680
    5    HB2  ALA  87           HB3      ALA  87  10.342   2.965   5.014

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ARG  88           H        ARG  88  12.004   3.510   2.681
    2    HA   ARG  88           HA       ARG  88  13.628   4.883   4.504
    3    HB2  ARG  88           HB2      ARG  88  14.282   2.907   3.098
    4    HB3  ARG  88           HB3      ARG  88  14.431   3.998   1.723
    5    HG2  ARG  88           HG2      ARG  88  15.919   5.308   3.661
    6    HG3  ARG  88           HG3      ARG  88  16.236   3.617   4.039
    7    HD2  ARG  88           HD2      ARG  88  17.491   3.316   2.185
    8    HD3  ARG  88           HD3      ARG  88  16.352   4.191   1.158
    9    HE   ARG  88           HE       ARG  88  18.756   5.246   2.192
   10   HH21  ARG  88          HH11      ARG  88  19.108   7.464   1.994
   11   HH22  ARG  88          HH12      ARG  88  17.761   8.540   1.858
   12   HH11  ARG  88          HH21      ARG  88  15.418   6.011   1.932
   13   HH12  ARG  88          HH22      ARG  88  15.670   7.715   1.798

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLU  89           H        GLU  89  12.640   5.783   1.186
    2    HA   GLU  89           HA       GLU  89  14.194   8.138   1.020
    3    HB2  GLU  89           HB2      GLU  89  13.035   7.100  -0.921
    4    HB3  GLU  89           HB3      GLU  89  11.496   7.647  -0.255
    5    HG2  GLU  89           HG2      GLU  89  12.205   9.982  -0.422
    6    HG3  GLU  89           HG3      GLU  89  13.805   9.485  -0.968

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LEU  90           H        LEU  90  10.869   7.641   2.168
    2    HA   LEU  90           HA       LEU  90  10.367  10.376   2.746
    3    HB2  LEU  90           HB2      LEU  90   9.169   7.807   3.781
    4    HB3  LEU  90           HB3      LEU  90   8.547   9.405   4.206
    5    HG   LEU  90           HG       LEU  90   8.946   8.522   1.336
    6   HD12  LEU  90          HD11      LEU  90   6.411   8.203   1.413
    7   HD11  LEU  90          HD12      LEU  90   6.576   8.192   3.168
    8   HD13  LEU  90          HD13      LEU  90   7.384   6.959   2.200
    9   HD22  LEU  90          HD21      LEU  90   8.659  10.831   1.263
   10   HD21  LEU  90          HD22      LEU  90   7.681  10.868   2.728
   11   HD23  LEU  90          HD23      LEU  90   6.973  10.315   1.211

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  91           H        ILE  91  11.632   7.691   4.662
    2    HA   ILE  91           HA       ILE  91  11.791   9.056   7.128
    3    HB   ILE  91           HB       ILE  91  13.330   6.712   5.997
    4   HG12  ILE  91          HG12      ILE  91  11.328   6.887   8.268
    5   HG13  ILE  91          HG13      ILE  91  10.847   6.607   6.595
    6   HG22  ILE  91          HG21      ILE  91  13.815   6.497   8.635
    7   HG21  ILE  91          HG22      ILE  91  13.745   8.256   8.533
    8   HG23  ILE  91          HG23      ILE  91  14.914   7.364   7.562
    9   HD13  ILE  91          HD11      ILE  91  11.841   4.502   6.520
   10   HD12  ILE  91          HD12      ILE  91  11.258   4.563   8.183
   11   HD11  ILE  91          HD13      ILE  91  12.959   4.870   7.835

  No H/Q in entry =          11
  In of MODEL    8
    1    H    THR  92           H        THR  92  13.992   8.878   4.364
    2    HA   THR  92           HA       THR  92  16.169  10.264   5.510
    3    HB   THR  92           HB       THR  92  15.165  10.142   2.655
    4    HG1  THR  92           HG1      THR  92  15.993   8.242   3.056
    5   HG22  THR  92          HG21      THR  92  17.736  10.823   2.346
    6   HG21  THR  92          HG22      THR  92  17.440  11.645   3.877
    7   HG23  THR  92          HG23      THR  92  16.463  12.036   2.462

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLU  93           H        GLU  93  13.276  11.427   3.798
    2    HA   GLU  93           HA       GLU  93  13.880  14.186   3.907
    3    HB2  GLU  93           HB2      GLU  93  11.172  12.822   3.938
    4    HB3  GLU  93           HB3      GLU  93  11.463  14.521   3.564
    5    HG2  GLU  93           HG2      GLU  93  12.784  12.274   2.029
    6    HG3  GLU  93           HG3      GLU  93  11.237  12.961   1.551

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LEU  94           H        LEU  94  12.143  12.036   6.130
    2    HA   LEU  94           HA       LEU  94  11.352  13.986   8.010
    3    HB2  LEU  94           HB2      LEU  94  11.919  11.029   8.282
    4    HB3  LEU  94           HB3      LEU  94  11.359  12.007   9.635
    5    HG   LEU  94           HG       LEU  94   9.859  12.063   7.015
    6   HD11  LEU  94          HD11      LEU  94   9.946   9.843   9.020
    7   HD13  LEU  94          HD12      LEU  94   9.634   9.782   7.287
    8   HD12  LEU  94          HD13      LEU  94   8.364  10.303   8.392
    9   HD23  LEU  94          HD21      LEU  94   7.951  12.470   8.627
   10   HD22  LEU  94          HD22      LEU  94   9.194  13.720   8.656
   11   HD21  LEU  94          HD23      LEU  94   9.135  12.504   9.931

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  95           H        ILE  95  14.317  12.046   7.756
    2    HA   ILE  95           HA       ILE  95  15.503  12.965  10.162
    3    HB   ILE  95           HB       ILE  95  16.723  11.891   7.607
    4   HG12  ILE  95          HG12      ILE  95  16.439  10.692  10.377
    5   HG13  ILE  95          HG13      ILE  95  15.264  10.437   9.089
    6   HG21  ILE  95          HG21      ILE  95  17.997  12.694  10.242
    7   HG23  ILE  95          HG22      ILE  95  18.451  13.220   8.619
    8   HG22  ILE  95          HG23      ILE  95  18.755  11.559   9.126
    9   HD13  ILE  95          HD11      ILE  95  16.732   9.153   7.817
   10   HD12  ILE  95          HD12      ILE  95  17.213   8.703   9.451
   11   HD11  ILE  95          HD13      ILE  95  18.165   9.879   8.545

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLU  96           H        GLU  96  15.641  14.197   6.827
    2    HA   GLU  96           HA       GLU  96  17.498  16.269   7.292
    3    HB2  GLU  96           HB2      GLU  96  16.818  15.608   5.037
    4    HB3  GLU  96           HB3      GLU  96  15.178  16.171   5.347
    5    HG2  GLU  96           HG2      GLU  96  15.749  18.298   4.801
    6    HG3  GLU  96           HG3      GLU  96  17.055  18.295   5.975

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LEU  97           H        LEU  97  13.989  16.095   7.743
    2    HA   LEU  97           HA       LEU  97  13.586  18.830   8.386
    3    HB2  LEU  97           HB2      LEU  97  12.063  16.310   9.010
    4    HB3  LEU  97           HB3      LEU  97  11.560  17.859   9.684
    5    HG   LEU  97           HG       LEU  97  12.023  17.440   6.717
    6   HD12  LEU  97          HD11      LEU  97   9.498  17.321   6.614
    7   HD11  LEU  97          HD12      LEU  97   9.502  17.122   8.365
    8   HD13  LEU  97          HD13      LEU  97  10.272  15.912   7.338
    9   HD23  LEU  97          HD21      LEU  97  10.292  19.411   6.759
   10   HD22  LEU  97          HD22      LEU  97  11.977  19.764   7.141
   11   HD21  LEU  97          HD23      LEU  97  10.796  19.598   8.439

  No H/Q in entry =          11
  In of MODEL    8
    1    H    HIS  98           H        HIS  98  14.410  16.001  10.378
    2    HA   HIS  98           HA       HIS  98  14.273  17.264  12.894
    3    HB2  HIS  98           HB2      HIS  98  16.008  15.000  11.882
    4    HB3  HIS  98           HB3      HIS  98  16.019  15.539  13.563
    5    HD1  HIS  98           HD1      HIS  98  13.798  13.916  10.985
    6    HD2  HIS  98           HD2      HIS  98  13.719  14.838  15.050
    7    HE1  HIS  98           HE1      HIS  98  11.774  12.729  11.951
    8    HE2  HIS  98           HE2      HIS  98  11.707  13.282  14.422

  No H/Q in entry =           8
  In of MODEL    8
    1    H    GLU  99           H        GLU  99  16.810  17.138  10.443
    2    HA   GLU  99           HA       GLU  99  18.810  18.463  11.960
    3    HB2  GLU  99           HB2      GLU  99  19.272  17.173   9.888
    4    HB3  GLU  99           HB3      GLU  99  18.461  18.431   8.952
    5    HG2  GLU  99           HG2      GLU  99  20.080  20.095   9.732
    6    HG3  GLU  99           HG3      GLU  99  20.861  18.891  10.750

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LYS 100           H        LYS 100  16.277  19.634   9.759
    2    HA   LYS 100           HA       LYS 100  17.086  22.369   9.897
    3    HB2  LYS 100           HB2      LYS 100  14.444  21.090   9.159
    4    HB3  LYS 100           HB3      LYS 100  14.749  22.827   9.067
    5    HG2  LYS 100           HG2      LYS 100  16.710  22.370   7.588
    6    HG3  LYS 100           HG3      LYS 100  16.290  20.655   7.608
    7    HD2  LYS 100           HD2      LYS 100  14.091  21.173   6.622
    8    HD3  LYS 100           HD3      LYS 100  14.494  22.890   6.608
    9    HE2  LYS 100           HE2      LYS 100  16.442  22.402   5.137
   10    HE3  LYS 100           HE3      LYS 100  15.970  20.699   5.107
   11    HZ1  LYS 100           HZ1      LYS 100  14.148  22.899   4.283
   12    HZ3  LYS 100           HZ2      LYS 100  13.956  21.230   4.022
   13    HZ2  LYS 100           HZ3      LYS 100  15.165  22.087   3.193

  No H/Q in entry =          13
  In of MODEL    8
    1    H    LEU 101           H        LEU 101  14.993  20.331  11.876
    2    HA   LEU 101           HA       LEU 101  13.845  22.405  13.461
    3    HB2  LEU 101           HB2      LEU 101  14.277  19.453  13.843
    4    HB3  LEU 101           HB3      LEU 101  13.754  20.436  15.207
    5    HG   LEU 101           HG       LEU 101  12.320  20.530  12.547
    6   HD12  LEU 101          HD11      LEU 101  10.662  18.973  13.827
    7   HD11  LEU 101          HD12      LEU 101  12.061  18.554  14.813
    8   HD13  LEU 101          HD13      LEU 101  12.082  18.247  13.075
    9   HD21  LEU 101          HD21      LEU 101  11.684  21.326  15.403
   10   HD23  LEU 101          HD22      LEU 101  10.415  21.106  14.201
   11   HD22  LEU 101          HD23      LEU 101  11.653  22.335  13.955

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LYS 102           H        LYS 102  16.987  21.783  13.005
    2    HA   LYS 102           HA       LYS 102  18.844  22.646  14.065
    3    HB2  LYS 102           HB2      LYS 102  17.044  24.169  15.210
    4    HB3  LYS 102           HB3      LYS 102  17.255  23.106  16.586
    5    HG2  LYS 102           HG2      LYS 102  19.150  25.109  15.404
    6    HG3  LYS 102           HG3      LYS 102  18.777  24.796  17.086
    7    HD2  LYS 102           HD2      LYS 102  20.425  22.876  15.390
    8    HD3  LYS 102           HD3      LYS 102  21.126  24.195  16.318
    9    HE2  LYS 102           HE2      LYS 102  20.723  21.649  17.289
   10    HE3  LYS 102           HE3      LYS 102  20.954  23.090  18.279
   11    HZ2  LYS 102           HZ1      LYS 102  18.984  21.814  18.910
   12    HZ1  LYS 102           HZ2      LYS 102  18.331  22.047  17.365
   13    HZ3  LYS 102           HZ3      LYS 102  18.573  23.376  18.389

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ALA 103           H        ALA 103  16.781  21.050  16.501
    2    HA   ALA 103           HA       ALA 103  18.513  19.832  18.145
    3    HB2  ALA 103           HB1      ALA 103  16.920  17.832  18.149
    4    HB1  ALA 103           HB2      ALA 103  16.020  18.689  16.897
    5    HB3  ALA 103           HB3      ALA 103  16.212  19.409  18.495

  No H/Q in entry =           5
  In of MODEL    8
    1    H1   ALA   1           H3       ALA   1  -1.788  -6.935 -21.345
    2    H2   ALA   1           H2       ALA   1  -2.587  -8.367 -20.886
    3    H3   ALA   1           H1       ALA   1  -0.983  -8.424 -21.452
    4    HA   ALA   1           HA       ALA   1  -1.831  -8.890 -23.443
    5    HB1  ALA   1           HB1      ALA   1  -3.969  -9.597 -22.956
    6    HB2  ALA   1           HB2      ALA   1  -4.405  -8.085 -23.750
    7    HB3  ALA   1           HB3      ALA   1  -4.334  -8.165 -21.992

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLU   2           H        GLU   2  -2.668  -7.695 -25.427
    2    HA   GLU   2           HA       GLU   2  -1.265  -5.688 -26.313
    3    HB2  GLU   2           HB2      GLU   2  -4.274  -5.740 -26.612
    4    HB3  GLU   2           HB3      GLU   2  -3.156  -4.883 -27.668
    5    HG2  GLU   2           HG2      GLU   2  -2.669  -6.775 -28.826
    6    HG3  GLU   2           HG3      GLU   2  -2.367  -7.682 -27.351

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLU   3           H        GLU   3  -4.413  -4.416 -25.393
    2    HA   GLU   3           HA       GLU   3  -3.350  -1.865 -24.771
    3    HB2  GLU   3           HB2      GLU   3  -6.043  -3.166 -24.423
    4    HB3  GLU   3           HB3      GLU   3  -5.733  -1.553 -23.778
    5    HG2  GLU   3           HG2      GLU   3  -5.385  -0.627 -25.906
    6    HG3  GLU   3           HG3      GLU   3  -5.002  -2.184 -26.633

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LEU   4           H        LEU   4  -4.939  -4.216 -22.582
    2    HA   LEU   4           HA       LEU   4  -4.554  -2.990 -20.193
    3    HB2  LEU   4           HB2      LEU   4  -4.028  -5.934 -20.666
    4    HB3  LEU   4           HB3      LEU   4  -4.421  -5.186 -19.120
    5    HG   LEU   4           HG       LEU   4  -6.209  -5.250 -21.573
    6   HD13  LEU   4          HD11      LEU   4  -7.405  -6.962 -20.568
    7   HD12  LEU   4          HD12      LEU   4  -6.907  -6.505 -18.940
    8   HD11  LEU   4          HD13      LEU   4  -5.782  -7.354 -19.998
    9   HD23  LEU   4          HD21      LEU   4  -7.878  -4.431 -19.695
   10   HD22  LEU   4          HD22      LEU   4  -6.839  -3.265 -20.512
   11   HD21  LEU   4          HD23      LEU   4  -6.406  -3.857 -18.909

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLU   5           H        GLU   5  -2.076  -4.845 -21.939
    2    HA   GLU   5           HA       GLU   5  -0.078  -4.572 -19.915
    3    HB2  GLU   5           HB2      GLU   5  -0.031  -6.343 -21.665
    4    HB3  GLU   5           HB3      GLU   5   0.276  -5.102 -22.879
    5    HG2  GLU   5           HG2      GLU   5   2.351  -4.463 -21.732
    6    HG3  GLU   5           HG3      GLU   5   2.046  -5.668 -20.481

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLU   6           H        GLU   6  -0.723  -2.855 -22.955
    2    HA   GLU   6           HA       GLU   6   1.457  -1.034 -22.701
    3    HB2  GLU   6           HB2      GLU   6  -1.115  -0.915 -24.291
    4    HB3  GLU   6           HB3      GLU   6   0.165   0.293 -24.411
    5    HG2  GLU   6           HG2      GLU   6   1.762  -1.412 -25.115
    6    HG3  GLU   6           HG3      GLU   6   0.550  -2.673 -24.898

  No H/Q in entry =           6
  In of MODEL    8
    1    H    VAL   7           H        VAL   7  -1.875  -1.089 -21.635
    2    HA   VAL   7           HA       VAL   7  -2.077   1.625 -20.797
    3    HB   VAL   7           HB       VAL   7  -3.547  -0.886 -19.952
    4   HG11  VAL   7          HG11      VAL   7  -3.903   2.005 -19.136
    5   HG13  VAL   7          HG12      VAL   7  -3.804   0.580 -18.101
    6   HG12  VAL   7          HG13      VAL   7  -5.241   0.857 -19.085
    7   HG21  VAL   7          HG21      VAL   7  -3.713   0.192 -22.339
    8   HG23  VAL   7          HG22      VAL   7  -4.648   1.445 -21.522
    9   HG22  VAL   7          HG23      VAL   7  -5.201  -0.229 -21.492

  No H/Q in entry =           9
  In of MODEL    8
    1    H    VAL   8           H        VAL   8  -1.095  -1.366 -19.161
    2    HA   VAL   8           HA       VAL   8  -0.755  -0.288 -16.567
    3    HB   VAL   8           HB       VAL   8   0.624  -2.612 -17.934
    4   HG11  VAL   8          HG11      VAL   8   0.718  -1.588 -15.091
    5   HG13  VAL   8          HG12      VAL   8   2.068  -1.993 -16.153
    6   HG12  VAL   8          HG13      VAL   8   1.060  -3.274 -15.481
    7   HG23  VAL   8          HG21      VAL   8  -1.327  -3.032 -15.721
    8   HG22  VAL   8          HG22      VAL   8  -1.146  -3.905 -17.239
    9   HG21  VAL   8          HG23      VAL   8  -2.023  -2.380 -17.203

  No H/Q in entry =           9
  In of MODEL    8
    1    H    MET   9           H        MET   9   1.475  -0.600 -19.328
    2    HA   MET   9           HA       MET   9   3.775   0.431 -18.081
    3    HB2  MET   9           HB2      MET   9   2.810   0.476 -20.940
    4    HB3  MET   9           HB3      MET   9   4.340   1.214 -20.466
    5    HG2  MET   9           HG2      MET   9   5.103  -0.930 -19.534
    6    HG3  MET   9           HG3      MET   9   3.564  -1.675 -19.967
    7    HE3  MET   9           HE1      MET   9   5.873   0.923 -22.204
    8    HE2  MET   9           HE2      MET   9   7.032  -0.351 -22.573
    9    HE1  MET   9           HE3      MET   9   6.665   0.037 -20.895

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLY  10           H        GLY  10   1.089   2.048 -19.741
    2    HA3  GLY  10           HA2      GLY  10   2.069   4.696 -19.502
    3    HA2  GLY  10           HA3      GLY  10   0.376   4.246 -19.696

  No H/Q in entry =           3
  In of MODEL    8
    1    H    LEU  11           H        LEU  11  -0.018   2.720 -17.408
    2    HA   LEU  11           HA       LEU  11  -0.524   4.700 -15.445
    3    HB2  LEU  11           HB2      LEU  11  -0.474   1.684 -15.290
    4    HB3  LEU  11           HB3      LEU  11  -0.968   2.709 -13.944
    5    HG   LEU  11           HG       LEU  11  -2.224   2.831 -16.699
    6   HD13  LEU  11          HD11      LEU  11  -2.816   0.692 -15.940
    7   HD12  LEU  11          HD12      LEU  11  -4.156   1.692 -15.386
    8   HD11  LEU  11          HD13      LEU  11  -2.896   1.203 -14.254
    9   HD22  LEU  11          HD21      LEU  11  -2.795   4.851 -15.688
   10   HD21  LEU  11          HD22      LEU  11  -2.714   4.183 -14.058
   11   HD23  LEU  11          HD23      LEU  11  -4.098   3.826 -15.091

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  12           H        ILE  12   2.002   2.218 -15.705
    2    HA   ILE  12           HA       ILE  12   3.228   2.747 -13.209
    3    HB   ILE  12           HB       ILE  12   4.465   1.704 -15.779
    4   HG12  ILE  12          HG12      ILE  12   2.441   0.487 -14.627
    5   HG13  ILE  12          HG13      ILE  12   3.826  -0.457 -15.136
    6   HG23  ILE  12          HG21      ILE  12   6.238   2.398 -14.304
    7   HG22  ILE  12          HG22      ILE  12   6.119   0.643 -14.169
    8   HG21  ILE  12          HG23      ILE  12   5.441   1.674 -12.909
    9   HD11  ILE  12          HD11      ILE  12   3.392   0.620 -12.338
   10   HD13  ILE  12          HD12      ILE  12   4.676  -0.470 -12.857
   11   HD12  ILE  12          HD13      ILE  12   3.013  -1.017 -12.846

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  13           H        ILE  13   3.815   4.008 -16.469
    2    HA   ILE  13           HA       ILE  13   5.968   5.714 -15.759
    3    HB   ILE  13           HB       ILE  13   3.924   5.804 -17.991
    4   HG12  ILE  13          HG12      ILE  13   5.732   3.951 -17.744
    5   HG13  ILE  13          HG13      ILE  13   5.525   4.725 -19.311
    6   HG22  ILE  13          HG21      ILE  13   5.730   7.360 -19.057
    7   HG21  ILE  13          HG22      ILE  13   6.227   7.665 -17.397
    8   HG23  ILE  13          HG23      ILE  13   4.587   8.061 -17.910
    9   HD12  ILE  13          HD11      ILE  13   7.955   4.449 -18.186
   10   HD11  ILE  13          HD12      ILE  13   7.477   5.962 -17.423
   11   HD13  ILE  13          HD13      ILE  13   7.537   5.846 -19.178

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ASN  14           H        ASN  14   2.463   6.231 -16.002
    2    HA   ASN  14           HA       ASN  14   2.442   8.977 -15.364
    3    HB2  ASN  14           HB2      ASN  14   0.533   7.347 -16.182
    4    HB3  ASN  14           HB3      ASN  14   0.222   7.170 -14.460
    5   HD21  ASN  14          HD21      ASN  14  -1.800   8.340 -15.878
    6   HD22  ASN  14          HD22      ASN  14  -1.850  10.013 -15.610

  No H/Q in entry =           6
  In of MODEL    8
    1    H    SER  15           H        SER  15   2.143   6.102 -13.287
    2    HA   SER  15           HA       SER  15   1.862   7.473 -10.836
    3    HB2  SER  15           HB2      SER  15   2.407   5.384  -9.791
    4    HB3  SER  15           HB3      SER  15   1.562   4.970 -11.279
    5    HG   SER  15           HG       SER  15   4.044   4.336 -10.526

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLY  16           H        GLY  16   4.719   6.359 -12.615
    2    HA3  GLY  16           HA2      GLY  16   6.662   7.104 -10.697
    3    HA2  GLY  16           HA3      GLY  16   6.952   6.900 -12.423

  No H/Q in entry =           3
  In of MODEL    8
    1    H    GLN  17           H        GLN  17   5.266   8.868 -13.474
    2    HA   GLN  17           HA       GLN  17   6.859  11.200 -13.176
    3    HB2  GLN  17           HB2      GLN  17   5.539  10.751 -15.213
    4    HB3  GLN  17           HB3      GLN  17   4.048  10.930 -14.287
    5    HG2  GLN  17           HG2      GLN  17   4.612  13.256 -13.771
    6    HG3  GLN  17           HG3      GLN  17   6.146  13.091 -14.623
    7   HE21  GLN  17          HE21      GLN  17   4.202  15.038 -15.430
    8   HE22  GLN  17          HE22      GLN  17   3.603  14.588 -16.953

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ALA  18           H        ALA  18   3.762  10.199 -11.806
    2    HA   ALA  18           HA       ALA  18   3.059  12.591 -10.535
    3    HB1  ALA  18           HB1      ALA  18   1.915  10.140 -10.750
    4    HB2  ALA  18           HB2      ALA  18   1.381  11.363  -9.599
    5    HB3  ALA  18           HB3      ALA  18   2.468  10.075  -9.077

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ARG  19           H        ARG  19   4.927   9.818  -9.269
    2    HA   ARG  19           HA       ARG  19   5.483  10.973  -6.751
    3    HB2  ARG  19           HB2      ARG  19   5.881   8.568  -7.281
    4    HB3  ARG  19           HB3      ARG  19   7.233   9.048  -8.311
    5    HG2  ARG  19           HG2      ARG  19   8.370  10.081  -6.396
    6    HG3  ARG  19           HG3      ARG  19   7.000   9.700  -5.355
    7    HD2  ARG  19           HD2      ARG  19   8.756   8.056  -5.010
    8    HD3  ARG  19           HD3      ARG  19   7.373   7.281  -5.786
    9    HE   ARG  19           HE       ARG  19   9.068   8.092  -7.845
   10   HH21  ARG  19          HH11      ARG  19  10.615   6.680  -8.707
   11   HH22  ARG  19          HH12      ARG  19  11.161   5.329  -7.775
   12   HH11  ARG  19          HH21      ARG  19   9.149   6.060  -5.068
   13   HH12  ARG  19          HH22      ARG  19  10.328   4.978  -5.714

  No H/Q in entry =          13
  In of MODEL    8
    1    H    SER  20           H        SER  20   7.279  10.995  -9.812
    2    HA   SER  20           HA       SER  20   9.536  12.400  -9.003
    3    HB2  SER  20           HB2      SER  20   9.297  11.412 -11.249
    4    HB3  SER  20           HB3      SER  20   8.086  12.625 -11.649
    5    HG   SER  20           HG       SER  20  10.624  13.380 -10.696

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU  21           H        LEU  21   6.434  13.683 -10.178
    2    HA   LEU  21           HA       LEU  21   7.118  16.425  -9.958
    3    HB2  LEU  21           HB2      LEU  21   4.443  15.014  -9.858
    4    HB3  LEU  21           HB3      LEU  21   4.620  16.766  -9.867
    5    HG   LEU  21           HG       LEU  21   5.804  14.969 -12.003
    6   HD13  LEU  21          HD11      LEU  21   3.457  14.658 -12.207
    7   HD12  LEU  21          HD12      LEU  21   3.847  15.922 -13.375
    8   HD11  LEU  21          HD13      LEU  21   3.120  16.347 -11.827
    9   HD21  LEU  21          HD21      LEU  21   5.517  17.948 -11.612
   10   HD23  LEU  21          HD22      LEU  21   5.577  17.297 -13.247
   11   HD22  LEU  21          HD23      LEU  21   6.928  17.045 -12.154

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ALA  22           H        ALA  22   5.612  14.141  -7.700
    2    HA   ALA  22           HA       ALA  22   5.030  15.951  -5.629
    3    HB3  ALA  22           HB1      ALA  22   4.259  13.561  -5.787
    4    HB2  ALA  22           HB2      ALA  22   4.860  14.031  -4.196
    5    HB1  ALA  22           HB3      ALA  22   5.873  13.069  -5.275

  No H/Q in entry =           5
  In of MODEL    8
    1    H    TYR  23           H        TYR  23   7.954  13.915  -6.088
    2    HA   TYR  23           HA       TYR  23   9.356  14.929  -3.845
    3    HB2  TYR  23           HB2      TYR  23  10.129  12.919  -5.008
    4    HB3  TYR  23           HB3      TYR  23  10.434  13.856  -6.470
    5    HD1  TYR  23           HD1      TYR  23  11.415  13.541  -2.878
    6    HD2  TYR  23           HD2      TYR  23  12.478  14.998  -6.778
    7    HE1  TYR  23           HE1      TYR  23  13.682  14.112  -2.049
    8    HE2  TYR  23           HE2      TYR  23  14.744  15.570  -5.948
    9    HH   TYR  23           HH       TYR  23  15.679  14.918  -2.565

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ALA  24           H        ALA  24   9.153  16.037  -7.209
    2    HA   ALA  24           HA       ALA  24  11.057  18.117  -6.976
    3    HB2  ALA  24           HB1      ALA  24  10.599  18.181  -9.181
    4    HB3  ALA  24           HB2      ALA  24   9.048  18.935  -8.811
    5    HB1  ALA  24           HB3      ALA  24   9.168  17.181  -8.942

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA  25           H        ALA  25   7.582  17.942  -6.331
    2    HA   ALA  25           HA       ALA  25   7.112  20.661  -5.758
    3    HB1  ALA  25           HB1      ALA  25   5.445  18.666  -5.948
    4    HB2  ALA  25           HB2      ALA  25   5.088  19.956  -4.797
    5    HB3  ALA  25           HB3      ALA  25   5.778  18.433  -4.231

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU  26           H        LEU  26   8.189  17.978  -3.716
    2    HA   LEU  26           HA       LEU  26   8.313  19.409  -1.279
    3    HB2  LEU  26           HB2      LEU  26   8.404  16.992  -1.275
    4    HB3  LEU  26           HB3      LEU  26   9.867  16.997  -2.256
    5    HG   LEU  26           HG       LEU  26  11.097  18.112  -0.424
    6   HD12  LEU  26          HD11      LEU  26   9.886  18.122   1.844
    7   HD11  LEU  26          HD12      LEU  26   8.392  17.988   0.920
    8   HD13  LEU  26          HD13      LEU  26   9.438  19.392   0.704
    9   HD21  LEU  26          HD21      LEU  26   9.565  15.647   0.460
   10   HD23  LEU  26          HD22      LEU  26  11.086  16.207   1.146
   11   HD22  LEU  26          HD23      LEU  26  11.028  15.648  -0.523

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LYS  27           H        LYS  27  10.712  18.832  -3.821
    2    HA   LYS  27           HA       LYS  27  12.906  20.069  -2.608
    3    HB2  LYS  27           HB2      LYS  27  12.991  18.722  -4.699
    4    HB3  LYS  27           HB3      LYS  27  12.222  20.055  -5.559
    5    HG2  LYS  27           HG2      LYS  27  14.094  21.538  -4.994
    6    HG3  LYS  27           HG3      LYS  27  14.858  20.244  -4.063
    7    HD2  LYS  27           HD2      LYS  27  14.985  18.857  -6.118
    8    HD3  LYS  27           HD3      LYS  27  14.266  20.176  -7.041
    9    HE2  LYS  27           HE2      LYS  27  16.160  21.639  -6.442
   10    HE3  LYS  27           HE3      LYS  27  16.883  20.324  -5.509
   11    HZ3  LYS  27           HZ1      LYS  27  17.858  20.422  -7.702
   12    HZ2  LYS  27           HZ2      LYS  27  16.326  20.306  -8.433
   13    HZ1  LYS  27           HZ3      LYS  27  16.954  18.995  -7.552

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLN  28           H        GLN  28  10.272  21.455  -4.538
    2    HA   GLN  28           HA       GLN  28  11.233  24.106  -4.699
    3    HB2  GLN  28           HB2      GLN  28   8.401  23.036  -4.568
    4    HB3  GLN  28           HB3      GLN  28   8.811  24.710  -4.942
    5    HG2  GLN  28           HG2      GLN  28   9.803  22.305  -6.498
    6    HG3  GLN  28           HG3      GLN  28   8.458  23.331  -6.991
    7   HE21  GLN  28          HE21      GLN  28   9.423  25.894  -6.434
    8   HE22  GLN  28          HE22      GLN  28  10.815  26.199  -7.356

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ALA  29           H        ALA  29   9.317  22.416  -2.249
    2    HA   ALA  29           HA       ALA  29   8.782  24.608  -0.563
    3    HB2  ALA  29           HB1      ALA  29   8.062  23.041   1.010
    4    HB1  ALA  29           HB2      ALA  29   9.279  21.855   0.537
    5    HB3  ALA  29           HB3      ALA  29   7.886  22.150  -0.502

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LYS  30           H        LYS  30  11.509  22.339  -0.652
    2    HA   LYS  30           HA       LYS  30  12.844  23.292   1.642
    3    HB2  LYS  30           HB2      LYS  30  13.922  22.005  -0.876
    4    HB3  LYS  30           HB3      LYS  30  14.915  22.363   0.539
    5    HG2  LYS  30           HG2      LYS  30  13.370  20.981   1.929
    6    HG3  LYS  30           HG3      LYS  30  12.474  20.560   0.466
    7    HD2  LYS  30           HD2      LYS  30  14.511  19.572  -0.510
    8    HD3  LYS  30           HD3      LYS  30  15.426  20.007   0.936
    9    HE2  LYS  30           HE2      LYS  30  13.930  18.577   2.301
   10    HE3  LYS  30           HE3      LYS  30  13.045  18.122   0.839
   11    HZ2  LYS  30           HZ1      LYS  30  14.840  16.543   1.587
   12    HZ1  LYS  30           HZ2      LYS  30  15.975  17.729   1.128
   13    HZ3  LYS  30           HZ3      LYS  30  14.931  17.046  -0.030

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLN  31           H        GLN  31  12.713  24.496  -1.654
    2    HA   GLN  31           HA       GLN  31  14.870  26.388  -1.248
    3    HB2  GLN  31           HB2      GLN  31  12.811  26.436  -3.458
    4    HB3  GLN  31           HB3      GLN  31  14.432  27.130  -3.470
    5    HG2  GLN  31           HG2      GLN  31  14.896  24.434  -2.898
    6    HG3  GLN  31           HG3      GLN  31  13.584  24.381  -4.067
    7   HE21  GLN  31          HE21      GLN  31  16.424  23.586  -4.491
    8   HE22  GLN  31          HE22      GLN  31  16.987  24.559  -5.762

  No H/Q in entry =           8
  In of MODEL    8
    1    H    GLY  32           H        GLY  32  11.804  26.208  -0.081
    2    HA3  GLY  32           HA2      GLY  32  10.657  27.777   1.201
    3    HA2  GLY  32           HA3      GLY  32  11.780  29.012   0.642

  No H/Q in entry =           3
  In of MODEL    8
    1    H    ASP  33           H        ASP  33  10.396  27.108  -1.840
    2    HA   ASP  33           HA       ASP  33   8.728  29.382  -2.684
    3    HB2  ASP  33           HB2      ASP  33   9.809  26.962  -4.134
    4    HB3  ASP  33           HB3      ASP  33   8.653  28.079  -4.856

  No H/Q in entry =           4
  In of MODEL    8
    1    H    PHE  34           H        PHE  34   7.050  28.908  -1.108
    2    HA   PHE  34           HA       PHE  34   5.670  26.437  -1.003
    3    HB2  PHE  34           HB2      PHE  34   4.715  29.225  -0.316
    4    HB3  PHE  34           HB3      PHE  34   3.868  27.735   0.101
    5    HD1  PHE  34           HD1      PHE  34   6.128  30.132   1.300
    6    HD2  PHE  34           HD2      PHE  34   5.445  25.891   1.251
    7    HE1  PHE  34           HE1      PHE  34   7.534  29.880   3.326
    8    HE2  PHE  34           HE2      PHE  34   6.852  25.644   3.276
    9    HZ   PHE  34           HZ       PHE  34   7.891  27.639   4.313

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ALA  35           H        ALA  35   5.227  29.301  -3.010
    2    HA   ALA  35           HA       ALA  35   2.668  28.688  -4.017
    3    HB1  ALA  35           HB1      ALA  35   3.706  30.080  -6.062
    4    HB3  ALA  35           HB2      ALA  35   4.933  30.440  -4.847
    5    HB2  ALA  35           HB3      ALA  35   3.244  30.850  -4.545

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA  36           H        ALA  36   5.886  28.013  -5.395
    2    HA   ALA  36           HA       ALA  36   4.881  26.584  -7.631
    3    HB3  ALA  36           HB1      ALA  36   7.035  26.707  -8.262
    4    HB2  ALA  36           HB2      ALA  36   7.526  25.678  -6.915
    5    HB1  ALA  36           HB3      ALA  36   7.423  27.426  -6.699

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA  37           H        ALA  37   5.859  25.589  -4.383
    2    HA   ALA  37           HA       ALA  37   5.796  22.801  -4.811
    3    HB2  ALA  37           HB1      ALA  37   5.553  24.592  -2.431
    4    HB1  ALA  37           HB2      ALA  37   6.683  23.274  -2.732
    5    HB3  ALA  37           HB3      ALA  37   5.025  22.921  -2.249

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LYS  38           H        LYS  38   3.272  25.011  -3.626
    2    HA   LYS  38           HA       LYS  38   1.174  23.199  -3.388
    3    HB2  LYS  38           HB2      LYS  38   1.529  25.954  -3.139
    4    HB3  LYS  38           HB3      LYS  38   0.320  25.808  -4.410
    5    HG2  LYS  38           HG2      LYS  38  -1.120  24.485  -2.957
    6    HG3  LYS  38           HG3      LYS  38   0.133  24.425  -1.709
    7    HD2  LYS  38           HD2      LYS  38  -0.048  26.761  -1.261
    8    HD3  LYS  38           HD3      LYS  38  -0.970  27.051  -2.737
    9    HE2  LYS  38           HE2      LYS  38  -2.460  27.086  -0.786
   10    HE3  LYS  38           HE3      LYS  38  -2.842  25.710  -1.826
   11    HZ3  LYS  38           HZ1      LYS  38  -2.107  24.238  -0.298
   12    HZ2  LYS  38           HZ2      LYS  38  -2.449  25.496   0.794
   13    HZ1  LYS  38           HZ3      LYS  38  -0.858  25.244   0.257

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ALA  39           H        ALA  39   2.134  25.100  -6.244
    2    HA   ALA  39           HA       ALA  39   0.046  24.234  -7.932
    3    HB2  ALA  39           HB1      ALA  39   2.775  24.881  -9.005
    4    HB1  ALA  39           HB2      ALA  39   1.814  26.143  -8.233
    5    HB3  ALA  39           HB3      ALA  39   1.191  25.306  -9.655

  No H/Q in entry =           5
  In of MODEL    8
    1    H    MET  40           H        MET  40   3.287  22.934  -7.375
    2    HA   MET  40           HA       MET  40   3.174  20.913  -9.366
    3    HB2  MET  40           HB2      MET  40   4.804  21.137  -6.829
    4    HB3  MET  40           HB3      MET  40   5.046  19.880  -8.045
    5    HG2  MET  40           HG2      MET  40   5.100  22.836  -8.711
    6    HG3  MET  40           HG3      MET  40   6.549  21.933  -8.272
    7    HE3  MET  40           HE1      MET  40   7.400  19.718 -11.086
    8    HE2  MET  40           HE2      MET  40   6.848  19.398  -9.445
    9    HE1  MET  40           HE3      MET  40   7.942  20.745  -9.752

  No H/Q in entry =           9
  In of MODEL    8
    1    H    MET  41           H        MET  41   2.284  20.956  -5.935
    2    HA   MET  41           HA       MET  41   1.753  18.192  -5.654
    3    HB2  MET  41           HB2      MET  41   0.430  20.550  -4.293
    4    HB3  MET  41           HB3      MET  41   0.278  18.872  -3.784
    5    HG2  MET  41           HG2      MET  41   2.988  19.094  -3.841
    6    HG3  MET  41           HG3      MET  41   2.550  20.753  -3.442
    7    HE2  MET  41           HE1      MET  41  -0.477  19.500  -1.695
    8    HE1  MET  41           HE2      MET  41   0.337  21.013  -2.078
    9    HE3  MET  41           HE3      MET  41   0.290  20.443  -0.410

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ASP  42           H        ASP  42  -0.292  20.917  -6.613
    2    HA   ASP  42           HA       ASP  42  -2.734  19.556  -6.733
    3    HB2  ASP  42           HB2      ASP  42  -2.029  22.126  -6.994
    4    HB3  ASP  42           HB3      ASP  42  -2.192  21.732  -8.701

  No H/Q in entry =           4
  In of MODEL    8
    1    H    GLN  43           H        GLN  43  -0.311  20.147  -9.252
    2    HA   GLN  43           HA       GLN  43  -1.713  18.828 -11.331
    3    HB2  GLN  43           HB2      GLN  43   1.248  19.344 -10.970
    4    HB3  GLN  43           HB3      GLN  43   0.524  18.704 -12.448
    5    HG2  GLN  43           HG2      GLN  43  -0.988  20.731 -12.478
    6    HG3  GLN  43           HG3      GLN  43  -0.026  21.387 -11.157
    7   HE21  GLN  43          HE21      GLN  43   0.121  23.007 -13.245
    8   HE22  GLN  43          HE22      GLN  43   1.529  22.786 -14.162

  No H/Q in entry =           8
  In of MODEL    8
    1    H    SER  44           H        SER  44   0.655  17.688  -8.957
    2    HA   SER  44           HA       SER  44   0.983  15.081  -9.985
    3    HB2  SER  44           HB2      SER  44   1.893  16.520  -7.755
    4    HB3  SER  44           HB3      SER  44   1.036  15.136  -7.078
    5    HG   SER  44           HG       SER  44   3.144  14.517  -7.519

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ARG  45           H        ARG  45  -1.321  16.399  -7.630
    2    HA   ARG  45           HA       ARG  45  -2.702  14.038  -6.985
    3    HB2  ARG  45           HB2      ARG  45  -2.893  16.206  -5.792
    4    HB3  ARG  45           HB3      ARG  45  -3.759  16.872  -7.173
    5    HG2  ARG  45           HG2      ARG  45  -5.522  15.146  -6.877
    6    HG3  ARG  45           HG3      ARG  45  -4.668  14.534  -5.460
    7    HD2  ARG  45           HD2      ARG  45  -4.867  16.801  -4.403
    8    HD3  ARG  45           HD3      ARG  45  -5.864  17.320  -5.778
    9    HE   ARG  45           HE       ARG  45  -6.966  14.944  -4.730
   10   HH21  ARG  45          HH11      ARG  45  -8.793  15.018  -3.447
   11   HH22  ARG  45          HH12      ARG  45  -9.182  16.458  -2.575
   12   HH11  ARG  45          HH21      ARG  45  -6.415  18.191  -3.710
   13   HH12  ARG  45          HH22      ARG  45  -7.831  18.255  -2.723

  No H/Q in entry =          13
  In of MODEL    8
    1    H    MET  46           H        MET  46  -3.305  16.442  -9.532
    2    HA   MET  46           HA       MET  46  -5.651  15.268 -10.577
    3    HB2  MET  46           HB2      MET  46  -3.560  17.098 -11.764
    4    HB3  MET  46           HB3      MET  46  -4.944  16.538 -12.707
    5    HG2  MET  46           HG2      MET  46  -6.475  17.442 -10.994
    6    HG3  MET  46           HG3      MET  46  -5.097  18.008 -10.057
    7    HE3  MET  46           HE1      MET  46  -5.132  20.567 -10.002
    8    HE2  MET  46           HE2      MET  46  -4.254  21.302 -11.338
    9    HE1  MET  46           HE3      MET  46  -3.608  19.860 -10.557

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ALA  47           H        ALA  47  -2.228  14.791 -11.359
    2    HA   ALA  47           HA       ALA  47  -2.587  13.063 -13.567
    3    HB3  ALA  47           HB1      ALA  47  -0.408  13.954 -13.230
    4    HB2  ALA  47           HB2      ALA  47  -0.263  12.226 -12.898
    5    HB1  ALA  47           HB3      ALA  47  -0.347  13.378 -11.564

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU  48           H        LEU  48  -2.293  12.428 -10.095
    2    HA   LEU  48           HA       LEU  48  -2.385   9.588 -10.253
    3    HB2  LEU  48           HB2      LEU  48  -3.136  11.505  -8.034
    4    HB3  LEU  48           HB3      LEU  48  -3.039   9.755  -7.833
    5    HG   LEU  48           HG       LEU  48  -0.749  11.456  -8.847
    6   HD13  LEU  48          HD11      LEU  48  -1.017  12.226  -6.654
    7   HD12  LEU  48          HD12      LEU  48   0.149  10.920  -6.464
    8   HD11  LEU  48          HD13      LEU  48  -1.546  10.656  -6.054
    9   HD22  LEU  48          HD21      LEU  48  -0.252   9.271  -9.491
   10   HD21  LEU  48          HD22      LEU  48  -1.112   8.555  -8.129
   11   HD23  LEU  48          HD23      LEU  48   0.462   9.310  -7.880

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ASN  49           H        ASN  49  -4.848  12.078  -9.834
    2    HA   ASN  49           HA       ASN  49  -7.029  10.411  -9.279
    3    HB2  ASN  49           HB2      ASN  49  -7.099  12.827  -8.949
    4    HB3  ASN  49           HB3      ASN  49  -6.925  13.100 -10.678
    5   HD21  ASN  49          HD21      ASN  49  -9.121  14.250  -9.562
    6   HD22  ASN  49          HD22      ASN  49 -10.531  13.388  -9.942

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLU  50           H        GLU  50  -5.772  11.609 -12.376
    2    HA   GLU  50           HA       GLU  50  -7.736  10.352 -14.008
    3    HB2  GLU  50           HB2      GLU  50  -6.278  12.172 -14.832
    4    HB3  GLU  50           HB3      GLU  50  -4.882  11.101 -14.703
    5    HG2  GLU  50           HG2      GLU  50  -5.865   9.564 -16.333
    6    HG3  GLU  50           HG3      GLU  50  -7.327  10.541 -16.411

  No H/Q in entry =           6
  In of MODEL    8
    1    H    ALA  51           H        ALA  51  -4.556   9.362 -12.824
    2    HA   ALA  51           HA       ALA  51  -4.424   6.909 -14.242
    3    HB2  ALA  51           HB1      ALA  51  -2.436   6.623 -13.156
    4    HB1  ALA  51           HB2      ALA  51  -3.113   7.045 -11.584
    5    HB3  ALA  51           HB3      ALA  51  -2.667   8.316 -12.721

  No H/Q in entry =           5
  In of MODEL    8
    1    H    HIS  52           H        HIS  52  -5.576   7.741 -10.986
    2    HA   HIS  52           HA       HIS  52  -6.253   5.130 -10.149
    3    HB2  HIS  52           HB2      HIS  52  -6.108   7.054  -8.617
    4    HB3  HIS  52           HB3      HIS  52  -7.530   7.765  -9.380
    5    HD1  HIS  52           HD1      HIS  52  -9.801   6.358  -9.156
    6    HD2  HIS  52           HD2      HIS  52  -6.678   5.113  -6.692
    7    HE1  HIS  52           HE1      HIS  52 -10.835   4.875  -7.383
    8    HE2  HIS  52           HE2      HIS  52  -8.944   4.108  -5.873

  No H/Q in entry =           8
  In of MODEL    8
    1    H    LEU  53           H        LEU  53  -8.087   7.586 -11.925
    2    HA   LEU  53           HA       LEU  53 -10.592   6.293 -11.921
    3    HB2  LEU  53           HB2      LEU  53  -9.321   8.275 -13.796
    4    HB3  LEU  53           HB3      LEU  53 -10.921   7.608 -14.112
    5    HG   LEU  53           HG       LEU  53 -10.197   8.921 -11.473
    6   HD13  LEU  53          HD11      LEU  53  -9.906  10.604 -13.193
    7   HD12  LEU  53          HD12      LEU  53 -11.445  10.904 -12.383
    8   HD11  LEU  53          HD13      LEU  53 -11.414  10.135 -13.968
    9   HD21  LEU  53          HD21      LEU  53 -12.765   8.055 -12.816
   10   HD23  LEU  53          HD22      LEU  53 -12.772   9.309 -11.581
   11   HD22  LEU  53          HD23      LEU  53 -12.223   7.692 -11.183

  No H/Q in entry =          11
  In of MODEL    8
    1    H    VAL  54           H        VAL  54  -7.856   6.097 -14.176
    2    HA   VAL  54           HA       VAL  54  -9.090   4.325 -16.011
    3    HB   VAL  54           HB       VAL  54  -6.178   4.833 -15.348
    4   HG12  VAL  54          HG11      VAL  54  -5.947   3.748 -17.739
    5   HG11  VAL  54          HG12      VAL  54  -7.472   2.966 -17.325
    6   HG13  VAL  54          HG13      VAL  54  -6.050   2.712 -16.315
    7   HG22  VAL  54          HG21      VAL  54  -6.956   6.776 -16.388
    8   HG21  VAL  54          HG22      VAL  54  -8.155   5.912 -17.348
    9   HG23  VAL  54          HG23      VAL  54  -6.451   5.832 -17.790

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLN  55           H        GLN  55  -7.072   3.780 -13.125
    2    HA   GLN  55           HA       GLN  55  -6.984   0.963 -13.381
    3    HB2  GLN  55           HB2      GLN  55  -5.418   1.859 -11.873
    4    HB3  GLN  55           HB3      GLN  55  -6.629   2.826 -11.035
    5    HG2  GLN  55           HG2      GLN  55  -7.309   1.068  -9.713
    6    HG3  GLN  55           HG3      GLN  55  -7.093  -0.119 -10.992
    7   HE21  GLN  55          HE21      GLN  55  -5.466  -1.568 -10.508
    8   HE22  GLN  55          HE22      GLN  55  -4.075  -1.216  -9.606

  No H/Q in entry =           8
  In of MODEL    8
    1    H    THR  56           H        THR  56  -9.304   3.126 -11.752
    2    HA   THR  56           HA       THR  56 -10.880   1.243 -10.452
    3    HB   THR  56           HB       THR  56 -11.984   3.631 -11.951
    4    HG1  THR  56           HG1      THR  56 -10.685   3.442  -9.442
    5   HG22  THR  56          HG21      THR  56 -12.871   2.583  -9.279
    6   HG21  THR  56          HG22      THR  56 -13.454   1.831 -10.763
    7   HG23  THR  56          HG23      THR  56 -13.778   3.537 -10.452

  No H/Q in entry =           7
  In of MODEL    8
    1    H    LYS  57           H        LYS  57 -11.104   2.325 -13.837
    2    HA   LYS  57           HA       LYS  57 -13.265   0.638 -14.576
    3    HB2  LYS  57           HB2      LYS  57 -12.397   2.589 -15.899
    4    HB3  LYS  57           HB3      LYS  57 -10.961   1.649 -16.276
    5    HG2  LYS  57           HG2      LYS  57 -12.322  -0.025 -17.432
    6    HG3  LYS  57           HG3      LYS  57 -13.791   0.845 -17.008
    7    HD2  LYS  57           HD2      LYS  57 -13.002   2.800 -18.312
    8    HD3  LYS  57           HD3      LYS  57 -11.549   1.910 -18.759
    9    HE2  LYS  57           HE2      LYS  57 -14.368   0.960 -19.378
   10    HE3  LYS  57           HE3      LYS  57 -13.364   1.841 -20.527
   11    HZ2  LYS  57           HZ1      LYS  57 -13.315  -0.656 -20.674
   12    HZ1  LYS  57           HZ2      LYS  57 -12.452  -0.645 -19.209
   13    HZ3  LYS  57           HZ3      LYS  57 -11.806   0.113 -20.587

  No H/Q in entry =          13
  In of MODEL    8
    1    H    LEU  58           H        LEU  58  -9.761   0.207 -14.541
    2    HA   LEU  58           HA       LEU  58  -9.777  -2.311 -15.829
    3    HB2  LEU  58           HB2      LEU  58  -7.731  -1.019 -14.034
    4    HB3  LEU  58           HB3      LEU  58  -7.476  -2.540 -14.890
    5    HG   LEU  58           HG       LEU  58  -8.238   0.063 -16.249
    6   HD11  LEU  58          HD11      LEU  58  -5.587  -1.173 -15.574
    7   HD13  LEU  58          HD12      LEU  58  -6.082   0.518 -15.523
    8   HD12  LEU  58          HD13      LEU  58  -5.753  -0.254 -17.071
    9   HD22  LEU  58          HD21      LEU  58  -8.824  -1.499 -17.836
   10   HD21  LEU  58          HD22      LEU  58  -7.779  -2.746 -17.160
   11   HD23  LEU  58          HD23      LEU  58  -7.094  -1.473 -18.170

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  59           H        ILE  59 -10.578  -1.407 -12.573
    2    HA   ILE  59           HA       ILE  59 -10.221  -4.174 -11.627
    3    HB   ILE  59           HB       ILE  59  -9.775  -1.898 -10.235
    4   HG12  ILE  59          HG12      ILE  59 -11.104  -4.268  -8.901
    5   HG13  ILE  59          HG13      ILE  59  -9.465  -4.323  -9.500
    6   HG23  ILE  59          HG21      ILE  59 -11.600  -1.230  -8.898
    7   HG22  ILE  59          HG22      ILE  59 -12.528  -2.666  -9.267
    8   HG21  ILE  59          HG23      ILE  59 -12.322  -1.404 -10.480
    9   HD13  ILE  59          HD11      ILE  59  -8.761  -2.570  -8.041
   10   HD12  ILE  59          HD12      ILE  59  -9.666  -3.712  -7.057
   11   HD11  ILE  59          HD13      ILE  59 -10.421  -2.206  -7.581

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLU  60           H        GLU  60 -12.784  -1.859 -12.420
    2    HA   GLU  60           HA       GLU  60 -14.962  -3.375 -11.393
    3    HB2  GLU  60           HB2      GLU  60 -15.187  -1.007 -11.984
    4    HB3  GLU  60           HB3      GLU  60 -14.862  -1.380 -13.674
    5    HG2  GLU  60           HG2      GLU  60 -17.142  -2.710 -12.220
    6    HG3  GLU  60           HG3      GLU  60 -17.340  -1.126 -12.941

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLY  61           H        GLY  61 -13.308  -3.361 -14.518
    2    HA3  GLY  61           HA2      GLY  61 -15.026  -5.607 -15.397
    3    HA2  GLY  61           HA3      GLY  61 -14.188  -4.503 -16.480

  No H/Q in entry =           3
  In of MODEL    8
    1    H    ASP  62           H        ASP  62 -12.798  -5.952 -13.604
    2    HA   ASP  62           HA       ASP  62 -10.496  -6.847 -15.006
    3    HB2  ASP  62           HB2      ASP  62  -9.938  -7.899 -12.802
    4    HB3  ASP  62           HB3      ASP  62 -10.342  -6.188 -12.689

  No H/Q in entry =           4
  In of MODEL    8
    1    H    ALA  63           H        ALA  63 -13.573  -8.381 -14.379
    2    HA   ALA  63           HA       ALA  63 -13.005 -11.097 -14.327
    3    HB2  ALA  63           HB1      ALA  63 -15.292 -10.268 -14.195
    4    HB3  ALA  63           HB2      ALA  63 -15.183 -11.360 -15.575
    5    HB1  ALA  63           HB3      ALA  63 -15.189  -9.613 -15.829

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLY  64           H        GLY  64 -14.561 -10.770 -17.228
    2    HA3  GLY  64           HA2      GLY  64 -14.046 -11.235 -19.413
    3    HA2  GLY  64           HA3      GLY  64 -12.440 -10.593 -19.101

  No H/Q in entry =           3
  In of MODEL    8
    1    H    GLU  65           H        GLU  65 -11.888 -12.491 -16.927
    2    HA   GLU  65           HA       GLU  65 -10.976 -14.662 -18.608
    3    HB2  GLU  65           HB2      GLU  65 -10.547 -14.081 -15.677
    4    HB3  GLU  65           HB3      GLU  65  -9.811 -15.429 -16.545
    5    HG2  GLU  65           HG2      GLU  65  -9.504 -12.510 -17.305
    6    HG3  GLU  65           HG3      GLU  65  -8.304 -13.453 -16.423

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLY  66           H        GLY  66 -11.272 -16.819 -18.272
    2    HA3  GLY  66           HA2      GLY  66 -13.719 -17.914 -18.133
    3    HA2  GLY  66           HA3      GLY  66 -12.278 -18.780 -17.641

  No H/Q in entry =           3
  In of MODEL    8
    1    H    LYS  67           H        LYS  67 -11.617 -18.538 -15.375
    2    HA   LYS  67           HA       LYS  67 -13.940 -18.795 -13.650
    3    HB2  LYS  67           HB2      LYS  67 -12.373 -19.822 -12.075
    4    HB3  LYS  67           HB3      LYS  67 -12.237 -20.552 -13.680
    5    HG2  LYS  67           HG2      LYS  67 -10.337 -19.021 -14.184
    6    HG3  LYS  67           HG3      LYS  67 -10.440 -18.389 -12.543
    7    HD2  LYS  67           HD2      LYS  67 -10.021 -21.326 -13.139
    8    HD3  LYS  67           HD3      LYS  67  -8.687 -20.194 -12.906
    9    HE2  LYS  67           HE2      LYS  67  -9.818 -19.545 -10.699
   10    HE3  LYS  67           HE3      LYS  67 -10.832 -20.972 -10.920
   11    HZ3  LYS  67           HZ1      LYS  67  -9.197 -22.230 -10.161
   12    HZ2  LYS  67           HZ2      LYS  67  -8.249 -20.849  -9.888
   13    HZ1  LYS  67           HZ3      LYS  67  -8.148 -21.672 -11.371

  No H/Q in entry =          13
  In of MODEL    8
    1    H    MET  68           H        MET  68 -12.730 -18.364 -11.211
    2    HA   MET  68           HA       MET  68 -13.397 -15.712 -10.655
    3    HB2  MET  68           HB2      MET  68 -11.751 -17.680  -9.066
    4    HB3  MET  68           HB3      MET  68 -12.398 -16.168  -8.430
    5    HG2  MET  68           HG2      MET  68 -14.071 -18.383  -9.650
    6    HG3  MET  68           HG3      MET  68 -13.869 -18.111  -7.919
    7    HE1  MET  68           HE1      MET  68 -14.297 -16.217  -6.722
    8    HE3  MET  68           HE2      MET  68 -15.613 -15.073  -6.975
    9    HE2  MET  68           HE3      MET  68 -14.025 -14.744  -7.665

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LYS  69           H        LYS  69 -10.551 -16.715 -12.168
    2    HA   LYS  69           HA       LYS  69  -8.680 -15.008 -10.885
    3    HB2  LYS  69           HB2      LYS  69  -8.657 -16.464 -13.521
    4    HB3  LYS  69           HB3      LYS  69  -7.294 -15.486 -12.973
    5    HG2  LYS  69           HG2      LYS  69  -7.181 -16.814 -10.888
    6    HG3  LYS  69           HG3      LYS  69  -8.532 -17.797 -11.447
    7    HD2  LYS  69           HD2      LYS  69  -7.207 -18.533 -13.389
    8    HD3  LYS  69           HD3      LYS  69  -5.853 -17.543 -12.844
    9    HE2  LYS  69           HE2      LYS  69  -5.743 -18.838 -10.746
   10    HE3  LYS  69           HE3      LYS  69  -7.097 -19.828 -11.286
   11    HZ2  LYS  69           HZ1      LYS  69  -4.338 -20.012 -11.975
   12    HZ1  LYS  69           HZ2      LYS  69  -5.315 -19.895 -13.359
   13    HZ3  LYS  69           HZ3      LYS  69  -5.586 -21.132 -12.225

  No H/Q in entry =          13
  In of MODEL    8
    1    H    VAL  70           H        VAL  70  -7.546 -13.154 -11.659
    2    HA   VAL  70           HA       VAL  70  -9.055 -11.463 -13.571
    3    HB   VAL  70           HB       VAL  70  -8.500  -9.533 -12.135
    4   HG12  VAL  70          HG11      VAL  70  -9.893 -11.757 -10.615
    5   HG11  VAL  70          HG12      VAL  70 -10.650 -10.773 -11.868
    6   HG13  VAL  70          HG13      VAL  70 -10.114 -10.026 -10.364
    7   HG21  VAL  70          HG21      VAL  70  -7.128 -11.685 -10.537
    8   HG23  VAL  70          HG22      VAL  70  -7.803 -10.290  -9.699
    9   HG22  VAL  70          HG23      VAL  70  -6.559 -10.062 -10.926

  No H/Q in entry =           9
  In of MODEL    8
    1    H    SER  71           H        SER  71  -7.639  -9.551 -14.251
    2    HA   SER  71           HA       SER  71  -5.335 -10.472 -15.595
    3    HB2  SER  71           HB2      SER  71  -6.703  -8.465 -16.248
    4    HB3  SER  71           HB3      SER  71  -6.007  -7.609 -14.874
    5    HG   SER  71           HG       SER  71  -4.671  -8.713 -17.121

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU  72           H        LEU  72  -3.352 -10.792 -14.909
    2    HA   LEU  72           HA       LEU  72  -2.615 -10.575 -12.202
    3    HB2  LEU  72           HB2      LEU  72  -0.976 -11.006 -14.695
    4    HB3  LEU  72           HB3      LEU  72  -0.306 -11.079 -13.068
    5    HG   LEU  72           HG       LEU  72  -2.668 -12.767 -13.950
    6   HD11  LEU  72          HD11      LEU  72   0.293 -13.424 -13.914
    7   HD13  LEU  72          HD12      LEU  72  -0.759 -13.380 -15.329
    8   HD12  LEU  72          HD13      LEU  72  -0.990 -14.621 -14.097
    9   HD21  LEU  72          HD21      LEU  72  -0.884 -12.645 -11.526
   10   HD23  LEU  72          HD22      LEU  72  -1.618 -14.178 -11.972
   11   HD22  LEU  72          HD23      LEU  72  -2.637 -12.791 -11.596

  No H/Q in entry =          11
  In of MODEL    8
    1    H    VAL  73           H        VAL  73  -1.915  -8.562 -14.989
    2    HA   VAL  73           HA       VAL  73   0.014  -6.864 -13.898
    3    HB   VAL  73           HB       VAL  73  -0.382  -5.453 -15.756
    4   HG12  VAL  73          HG11      VAL  73  -1.234  -8.230 -16.621
    5   HG11  VAL  73          HG12      VAL  73   0.430  -7.786 -16.241
    6   HG13  VAL  73          HG13      VAL  73  -0.398  -7.023 -17.597
    7   HG22  VAL  73          HG21      VAL  73  -2.649  -4.910 -15.752
    8   HG21  VAL  73          HG22      VAL  73  -3.153  -6.591 -15.579
    9   HG23  VAL  73          HG23      VAL  73  -2.566  -6.002 -17.135

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LEU  74           H        LEU  74  -3.380  -6.976 -13.320
    2    HA   LEU  74           HA       LEU  74  -3.993  -4.319 -12.706
    3    HB2  LEU  74           HB2      LEU  74  -5.731  -5.969 -12.865
    4    HB3  LEU  74           HB3      LEU  74  -5.026  -6.912 -11.556
    5    HG   LEU  74           HG       LEU  74  -5.466  -5.064  -9.979
    6   HD11  LEU  74          HD11      LEU  74  -6.492  -3.745 -12.495
    7   HD13  LEU  74          HD12      LEU  74  -5.339  -3.108 -11.324
    8   HD12  LEU  74          HD13      LEU  74  -7.047  -3.244 -10.898
    9   HD22  LEU  74          HD21      LEU  74  -7.677  -5.619  -9.718
   10   HD21  LEU  74          HD22      LEU  74  -7.176  -6.856 -10.851
   11   HD23  LEU  74          HD23      LEU  74  -8.033  -5.449 -11.434

  No H/Q in entry =          11
  In of MODEL    8
    1    H    VAL  75           H        VAL  75  -2.941  -6.905 -10.549
    2    HA   VAL  75           HA       VAL  75  -2.727  -5.351  -8.207
    3    HB   VAL  75           HB       VAL  75  -1.251  -7.854  -9.009
    4   HG13  VAL  75          HG11      VAL  75   0.049  -6.625  -7.306
    5   HG12  VAL  75          HG12      VAL  75  -0.751  -7.997  -6.556
    6   HG11  VAL  75          HG13      VAL  75  -1.408  -6.383  -6.348
    7   HG21  VAL  75          HG21      VAL  75  -3.640  -7.276  -7.222
    8   HG23  VAL  75          HG22      VAL  75  -2.886  -8.859  -7.407
    9   HG22  VAL  75          HG23      VAL  75  -3.689  -8.099  -8.782

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLU  76           H        GLU  76  -0.334  -6.116 -10.757
    2    HA   GLU  76           HA       GLU  76   1.860  -4.770  -9.614
    3    HB2  GLU  76           HB2      GLU  76   2.036  -6.251 -11.602
    4    HB3  GLU  76           HB3      GLU  76   1.140  -5.077 -12.553
    5    HG2  GLU  76           HG2      GLU  76   3.479  -4.767 -13.048
    6    HG3  GLU  76           HG3      GLU  76   2.980  -3.394 -12.078

  No H/Q in entry =           6
  In of MODEL    8
    1    H    ALA  77           H        ALA  77  -0.684  -3.568 -11.789
    2    HA   ALA  77           HA       ALA  77   0.307  -0.923 -11.973
    3    HB2  ALA  77           HB1      ALA  77  -2.062  -0.368 -12.637
    4    HB3  ALA  77           HB2      ALA  77  -2.490  -2.042 -12.278
    5    HB1  ALA  77           HB3      ALA  77  -1.335  -1.684 -13.562

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLN  78           H        GLN  78  -1.949  -2.475  -9.747
    2    HA   GLN  78           HA       GLN  78  -2.747  -0.155  -8.344
    3    HB2  GLN  78           HB2      GLN  78  -3.856  -2.416  -8.251
    4    HB3  GLN  78           HB3      GLN  78  -2.515  -2.972  -7.253
    5    HG2  GLN  78           HG2      GLN  78  -3.025  -1.238  -5.588
    6    HG3  GLN  78           HG3      GLN  78  -4.361  -0.664  -6.585
    7   HE21  GLN  78          HE21      GLN  78  -4.818  -1.645  -3.928
    8   HE22  GLN  78          HE22      GLN  78  -5.692  -3.095  -4.041

  No H/Q in entry =           8
  In of MODEL    8
    1    H    LEU  79           H        LEU  79  -0.066  -2.411  -7.907
    2    HA   LEU  79           HA       LEU  79   0.924  -1.512  -5.456
    3    HB2  LEU  79           HB2      LEU  79   1.788  -3.522  -6.527
    4    HB3  LEU  79           HB3      LEU  79   2.426  -2.572  -7.865
    5    HG   LEU  79           HG       LEU  79   3.991  -1.431  -6.372
    6   HD13  LEU  79          HD11      LEU  79   2.998  -1.184  -4.299
    7   HD12  LEU  79          HD12      LEU  79   4.079  -2.533  -3.960
    8   HD11  LEU  79          HD13      LEU  79   2.371  -2.833  -4.280
    9   HD23  LEU  79          HD21      LEU  79   5.207  -3.578  -5.474
   10   HD22  LEU  79          HD22      LEU  79   4.993  -3.381  -7.210
   11   HD21  LEU  79          HD23      LEU  79   3.920  -4.450  -6.311

  No H/Q in entry =          11
  In of MODEL    8
    1    H    HIS  80           H        HIS  80   1.775  -0.398  -8.735
    2    HA   HIS  80           HA       HIS  80   3.588   1.591  -7.825
    3    HB2  HIS  80           HB2      HIS  80   2.284   0.893 -10.400
    4    HB3  HIS  80           HB3      HIS  80   2.879   2.546 -10.234
    5    HD1  HIS  80           HD1      HIS  80   5.277   2.847 -10.770
    6    HD2  HIS  80           HD2      HIS  80   4.466  -1.063  -9.571
    7    HE1  HIS  80           HE1      HIS  80   7.466   1.571 -10.948
    8    HE2  HIS  80           HE2      HIS  80   6.984  -0.815 -10.220

  No H/Q in entry =           8
  In of MODEL    8
    1    H    LEU  81           H        LEU  81   0.178   1.748  -8.786
    2    HA   LEU  81           HA       LEU  81  -0.097   4.540  -8.456
    3    HB2  LEU  81           HB2      LEU  81  -2.110   2.293  -8.363
    4    HB3  LEU  81           HB3      LEU  81  -2.563   3.996  -8.270
    5    HG   LEU  81           HG       LEU  81  -0.882   2.846 -10.515
    6   HD12  LEU  81          HD11      LEU  81  -3.121   3.162 -11.801
    7   HD11  LEU  81          HD12      LEU  81  -3.868   3.094 -10.206
    8   HD13  LEU  81          HD13      LEU  81  -2.927   1.727 -10.797
    9   HD23  LEU  81          HD21      LEU  81  -1.987   4.988 -11.608
   10   HD22  LEU  81          HD22      LEU  81  -0.565   5.161 -10.583
   11   HD21  LEU  81          HD23      LEU  81  -2.166   5.508  -9.934

  No H/Q in entry =          11
  In of MODEL    8
    1    H    MET  82           H        MET  82  -0.741   1.855  -6.201
    2    HA   MET  82           HA       MET  82  -1.783   3.441  -4.109
    3    HB2  MET  82           HB2      MET  82  -0.406   0.756  -4.154
    4    HB3  MET  82           HB3      MET  82  -0.977   1.482  -2.654
    5    HG2  MET  82           HG2      MET  82  -2.723   0.984  -5.085
    6    HG3  MET  82           HG3      MET  82  -2.636  -0.089  -3.689
    7    HE3  MET  82           HE1      MET  82  -4.345   1.561  -0.866
    8    HE2  MET  82           HE2      MET  82  -2.616   1.841  -1.060
    9    HE1  MET  82           HE3      MET  82  -3.305   0.282  -1.509

  No H/Q in entry =           9
  In of MODEL    8
    1    H    THR  83           H        THR  83   1.515   2.360  -4.816
    2    HA   THR  83           HA       THR  83   2.744   3.468  -2.524
    3    HB   THR  83           HB       THR  83   4.831   3.414  -4.009
    4    HG1  THR  83           HG1      THR  83   4.580   2.886  -6.031
    5   HG22  THR  83          HG21      THR  83   4.389   0.755  -4.337
    6   HG21  THR  83          HG22      THR  83   3.105   1.134  -3.190
    7   HG23  THR  83          HG23      THR  83   4.786   1.480  -2.780

  No H/Q in entry =           7
  In of MODEL    8
    1    H    SER  84           H        SER  84   2.353   4.744  -5.823
    2    HA   SER  84           HA       SER  84   3.691   7.187  -5.377
    3    HB2  SER  84           HB2      SER  84   1.611   6.349  -7.384
    4    HB3  SER  84           HB3      SER  84   2.287   7.978  -7.364
    5    HG   SER  84           HG       SER  84   3.661   5.505  -7.661

  No H/Q in entry =           5
  In of MODEL    8
    1    H    MET  85           H        MET  85   0.199   6.425  -5.185
    2    HA   MET  85           HA       MET  85  -0.663   9.035  -4.581
    3    HB2  MET  85           HB2      MET  85  -2.187   7.224  -5.240
    4    HB3  MET  85           HB3      MET  85  -1.888   6.418  -3.701
    5    HG2  MET  85           HG2      MET  85  -2.783   8.360  -2.488
    6    HG3  MET  85           HG3      MET  85  -3.039   9.206  -4.014
    7    HE3  MET  85           HE1      MET  85  -3.875   5.210  -3.246
    8    HE2  MET  85           HE2      MET  85  -5.248   5.654  -2.235
    9    HE1  MET  85           HE3      MET  85  -3.647   6.286  -1.861

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LEU  86           H        LEU  86   0.272   6.375  -2.441
    2    HA   LEU  86           HA       LEU  86  -0.248   7.679   0.004
    3    HB2  LEU  86           HB2      LEU  86   0.216   5.208  -0.391
    4    HB3  LEU  86           HB3      LEU  86   1.922   5.639  -0.496
    5    HG   LEU  86           HG       LEU  86   1.609   6.801   1.773
    6   HD11  LEU  86          HD11      LEU  86  -1.087   6.033   1.317
    7   HD13  LEU  86          HD12      LEU  86  -0.414   6.781   2.764
    8   HD12  LEU  86          HD13      LEU  86  -0.504   5.025   2.646
    9   HD23  LEU  86          HD21      LEU  86   1.183   3.808   1.899
   10   HD22  LEU  86          HD22      LEU  86   2.191   4.819   2.933
   11   HD21  LEU  86          HD23      LEU  86   2.682   4.494   1.271

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ALA  87           H        ALA  87   2.722   7.385  -1.903
    2    HA   ALA  87           HA       ALA  87   4.437   8.796  -0.188
    3    HB3  ALA  87           HB1      ALA  87   4.517   7.782  -2.895
    4    HB2  ALA  87           HB2      ALA  87   5.857   8.114  -1.802
    5    HB1  ALA  87           HB3      ALA  87   5.237   9.393  -2.843

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ARG  88           H        ARG  88   2.474   9.931  -2.898
    2    HA   ARG  88           HA       ARG  88   3.249  12.621  -2.787
    3    HB2  ARG  88           HB2      ARG  88   1.984  11.467  -4.636
    4    HB3  ARG  88           HB3      ARG  88   0.533  11.611  -3.645
    5    HG2  ARG  88           HG2      ARG  88   1.553  14.192  -3.568
    6    HG3  ARG  88           HG3      ARG  88   1.968  13.677  -5.201
    7    HD2  ARG  88           HD2      ARG  88  -0.177  13.757  -5.886
    8    HD3  ARG  88           HD3      ARG  88  -0.756  12.905  -4.455
    9    HE   ARG  88           HE       ARG  88  -0.947  15.683  -4.872
   10   HH21  ARG  88          HH11      ARG  88  -1.463  17.013  -3.132
   11   HH22  ARG  88          HH12      ARG  88  -1.158  16.476  -1.516
   12   HH11  ARG  88          HH21      ARG  88   0.081  13.420  -2.503
   13   HH12  ARG  88          HH22      ARG  88  -0.301  14.436  -1.160

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLU  89           H        GLU  89   0.554  10.948  -1.130
    2    HA   GLU  89           HA       GLU  89  -0.544  13.262   0.080
    3    HB2  GLU  89           HB2      GLU  89  -1.664  11.023   0.001
    4    HB3  GLU  89           HB3      GLU  89  -0.534  10.467   1.235
    5    HG2  GLU  89           HG2      GLU  89  -1.343  12.167   2.799
    6    HG3  GLU  89           HG3      GLU  89  -2.402  12.839   1.562

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LEU  90           H        LEU  90   1.912  10.967   1.241
    2    HA   LEU  90           HA       LEU  90   2.284  12.212   3.768
    3    HB2  LEU  90           HB2      LEU  90   4.045  10.435   2.080
    4    HB3  LEU  90           HB3      LEU  90   4.474  10.951   3.716
    5    HG   LEU  90           HG       LEU  90   1.834   9.609   3.071
    6   HD12  LEU  90          HD11      LEU  90   2.978   7.562   4.073
    7   HD11  LEU  90          HD12      LEU  90   4.499   8.416   3.822
    8   HD13  LEU  90          HD13      LEU  90   3.478   8.009   2.442
    9   HD22  LEU  90          HD21      LEU  90   1.584  10.533   5.195
   10   HD21  LEU  90          HD22      LEU  90   3.303  10.424   5.567
   11   HD23  LEU  90          HD23      LEU  90   2.295   8.978   5.621

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  91           H        ILE  91   3.869  12.591   0.631
    2    HA   ILE  91           HA       ILE  91   5.854  14.419   1.458
    3    HB   ILE  91           HB       ILE  91   4.526  13.931  -1.213
    4   HG12  ILE  91          HG12      ILE  91   7.363  13.438  -0.256
    5   HG13  ILE  91          HG13      ILE  91   6.080  12.243  -0.086
    6   HG22  ILE  91          HG21      ILE  91   6.747  15.273  -1.916
    7   HG21  ILE  91          HG22      ILE  91   6.448  16.075  -0.373
    8   HG23  ILE  91          HG23      ILE  91   5.217  16.106  -1.634
    9   HD13  ILE  91          HD11      ILE  91   5.893  11.920  -2.392
   10   HD12  ILE  91          HD12      ILE  91   7.629  12.159  -2.189
   11   HD11  ILE  91          HD13      ILE  91   6.617  13.484  -2.769

  No H/Q in entry =          11
  In of MODEL    8
    1    H    THR  92           H        THR  92   2.487  14.858   0.471
    2    HA   THR  92           HA       THR  92   2.466  17.682   0.410
    3    HB   THR  92           HB       THR  92   0.299  15.691   1.122
    4    HG1  THR  92           HG1      THR  92   0.591  15.512  -0.964
    5   HG22  THR  92          HG21      THR  92  -1.102  17.856   0.409
    6   HG21  THR  92          HG22      THR  92   0.296  18.679   1.097
    7   HG23  THR  92          HG23      THR  92  -0.641  17.559   2.084

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLU  93           H        GLU  93   1.929  15.383   3.067
    2    HA   GLU  93           HA       GLU  93   1.413  17.288   5.089
    3    HB2  GLU  93           HB2      GLU  93   2.722  14.561   5.317
    4    HB3  GLU  93           HB3      GLU  93   2.041  15.489   6.654
    5    HG2  GLU  93           HG2      GLU  93   0.413  14.715   4.225
    6    HG3  GLU  93           HG3      GLU  93   0.520  13.692   5.653

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LEU  94           H        LEU  94   4.410  15.799   3.921
    2    HA   LEU  94           HA       LEU  94   6.174  16.943   5.798
    3    HB2  LEU  94           HB2      LEU  94   6.557  15.974   2.965
    4    HB3  LEU  94           HB3      LEU  94   7.893  16.629   3.907
    5    HG   LEU  94           HG       LEU  94   6.156  14.438   5.053
    6   HD11  LEU  94          HD11      LEU  94   8.238  14.207   2.909
    7   HD13  LEU  94          HD12      LEU  94   6.791  13.236   3.179
    8   HD12  LEU  94          HD13      LEU  94   8.222  12.980   4.177
    9   HD23  LEU  94          HD21      LEU  94   8.351  13.896   6.192
   10   HD22  LEU  94          HD22      LEU  94   7.690  15.476   6.612
   11   HD21  LEU  94          HD23      LEU  94   9.021  15.352   5.461

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  95           H        ILE  95   5.018  18.117   2.655
    2    HA   ILE  95           HA       ILE  95   6.596  20.471   2.586
    3    HB   ILE  95           HB       ILE  95   3.942  19.793   1.296
    4   HG12  ILE  95          HG12      ILE  95   6.725  20.123   0.143
    5   HG13  ILE  95          HG13      ILE  95   6.075  18.572   0.662
    6   HG21  ILE  95          HG21      ILE  95   5.696  22.256   1.065
    7   HG23  ILE  95          HG22      ILE  95   3.973  22.192   1.432
    8   HG22  ILE  95          HG23      ILE  95   4.545  21.790  -0.188
    9   HD13  ILE  95          HD11      ILE  95   4.505  18.499  -1.058
   10   HD12  ILE  95          HD12      ILE  95   5.851  19.314  -1.854
   11   HD11  ILE  95          HD13      ILE  95   4.484  20.252  -1.254

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLU  96           H        GLU  96   3.353  19.826   3.901
    2    HA   GLU  96           HA       GLU  96   2.744  22.475   4.655
    3    HB2  GLU  96           HB2      GLU  96   1.065  20.696   4.677
    4    HB3  GLU  96           HB3      GLU  96   1.932  19.867   5.967
    5    HG2  GLU  96           HG2      GLU  96   0.924  21.153   7.543
    6    HG3  GLU  96           HG3      GLU  96   1.459  22.625   6.743

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LEU  97           H        LEU  97   4.590  19.920   6.270
    2    HA   LEU  97           HA       LEU  97   4.965  21.268   8.738
    3    HB2  LEU  97           HB2      LEU  97   6.489  19.095   7.315
    4    HB3  LEU  97           HB3      LEU  97   7.089  19.778   8.823
    5    HG   LEU  97           HG       LEU  97   4.275  18.692   8.530
    6   HD12  LEU  97          HD11      LEU  97   5.217  16.678   9.737
    7   HD11  LEU  97          HD12      LEU  97   6.828  17.304   9.383
    8   HD13  LEU  97          HD13      LEU  97   5.749  16.849   8.064
    9   HD23  LEU  97          HD21      LEU  97   4.742  18.397  11.091
   10   HD22  LEU  97          HD22      LEU  97   4.363  20.010  10.489
   11   HD21  LEU  97          HD23      LEU  97   6.035  19.565  10.824

  No H/Q in entry =          11
  In of MODEL    8
    1    H    HIS  98           H        HIS  98   6.818  21.278   5.702
    2    HA   HIS  98           HA       HIS  98   8.981  22.852   6.588
    3    HB2  HIS  98           HB2      HIS  98   7.671  22.600   3.869
    4    HB3  HIS  98           HB3      HIS  98   9.116  23.575   4.151
    5    HD1  HIS  98           HD1      HIS  98   7.894  20.007   4.179
    6    HD2  HIS  98           HD2      HIS  98  11.484  22.093   4.582
    7    HE1  HIS  98           HE1      HIS  98   9.744  18.272   4.111
    8    HE2  HIS  98           HE2      HIS  98  11.934  19.522   4.357

  No H/Q in entry =           8
  In of MODEL    8
    1    H    GLU  99           H        GLU  99   5.756  23.696   5.431
    2    HA   GLU  99           HA       GLU  99   6.143  26.510   5.371
    3    HB2  GLU  99           HB2      GLU  99   4.254  25.346   4.251
    4    HB3  GLU  99           HB3      GLU  99   3.566  24.987   5.835
    5    HG2  GLU  99           HG2      GLU  99   3.396  27.380   6.336
    6    HG3  GLU  99           HG3      GLU  99   4.165  27.777   4.803

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LYS 100           H        LYS 100   5.021  24.279   7.899
    2    HA   LYS 100           HA       LYS 100   4.452  26.335   9.797
    3    HB2  LYS 100           HB2      LYS 100   5.020  23.382  10.139
    4    HB3  LYS 100           HB3      LYS 100   4.584  24.456  11.474
    5    HG2  LYS 100           HG2      LYS 100   2.513  25.100  10.238
    6    HG3  LYS 100           HG3      LYS 100   2.929  23.930   8.983
    7    HD2  LYS 100           HD2      LYS 100   2.855  22.109  10.645
    8    HD3  LYS 100           HD3      LYS 100   2.456  23.273  11.911
    9    HE2  LYS 100           HE2      LYS 100   0.398  23.901  10.660
   10    HE3  LYS 100           HE3      LYS 100   0.786  22.680   9.442
   11    HZ1  LYS 100           HZ1      LYS 100   0.535  22.015  12.325
   12    HZ3  LYS 100           HZ2      LYS 100   0.508  20.960  10.990
   13    HZ2  LYS 100           HZ3      LYS 100  -0.802  22.004  11.278

  No H/Q in entry =          13
  In of MODEL    8
    1    H    LEU 101           H        LEU 101   7.364  24.529   8.946
    2    HA   LEU 101           HA       LEU 101   8.979  25.364  11.140
    3    HB2  LEU 101           HB2      LEU 101   9.554  24.375   8.358
    4    HB3  LEU 101           HB3      LEU 101  10.864  25.036   9.332
    5    HG   LEU 101           HG       LEU 101   9.031  22.886  10.406
    6   HD12  LEU 101          HD11      LEU 101  11.076  21.384   9.786
    7   HD11  LEU 101          HD12      LEU 101  11.440  22.646   8.611
    8   HD13  LEU 101          HD13      LEU 101   9.908  21.778   8.527
    9   HD21  LEU 101          HD21      LEU 101  11.763  23.985  11.118
   10   HD23  LEU 101          HD22      LEU 101  11.217  22.414  11.701
   11   HD22  LEU 101          HD23      LEU 101  10.333  23.873  12.144

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LYS 102           H        LYS 102   7.390  27.233   9.008
    2    HA   LYS 102           HA       LYS 102   7.474  29.526   8.716
    3    HB2  LYS 102           HB2      LYS 102   9.050  29.405  10.805
    4    HB3  LYS 102           HB3      LYS 102  10.344  29.594   9.637
    5    HG2  LYS 102           HG2      LYS 102   8.250  31.555  10.512
    6    HG3  LYS 102           HG3      LYS 102   9.962  31.809  10.250
    7    HD2  LYS 102           HD2      LYS 102   7.996  31.393   7.962
    8    HD3  LYS 102           HD3      LYS 102   8.389  32.971   8.628
    9    HE2  LYS 102           HE2      LYS 102   9.745  31.781   6.546
   10    HE3  LYS 102           HE3      LYS 102  10.372  33.086   7.554
   11    HZ2  LYS 102           HZ1      LYS 102  11.885  31.175   7.370
   12    HZ1  LYS 102           HZ2      LYS 102  10.723  30.197   8.119
   13    HZ3  LYS 102           HZ3      LYS 102  11.426  31.482   8.974

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ALA 103           H        ALA 103  10.722  28.174   8.132
    2    HA   ALA 103           HA       ALA 103  11.679  29.547   6.050
    3    HB2  ALA 103           HB1      ALA 103  12.550  27.330   5.117
    4    HB1  ALA 103           HB2      ALA 103  11.660  26.559   6.429
    5    HB3  ALA 103           HB3      ALA 103  12.956  27.698   6.794

  No H/Q in entry =           5
  In of MODEL    8
    1    H1   LYS   3           H1       LYS   3 -31.101   5.970 -19.988
    2    H2   LYS   3           H3       LYS   3 -30.088   5.690 -21.321
    3    H3   LYS   3           H2       LYS   3 -31.477   4.740 -21.097
    4    HA   LYS   3           HA       LYS   3 -30.486   3.362 -19.675
    5    HB2  LYS   3           HB2      LYS   3 -28.196   4.794 -20.971
    6    HB3  LYS   3           HB3      LYS   3 -27.880   3.590 -19.721
    7    HG2  LYS   3           HG2      LYS   3 -29.265   1.990 -21.094
    8    HG3  LYS   3           HG3      LYS   3 -29.209   3.190 -22.385
    9    HD2  LYS   3           HD2      LYS   3 -26.727   3.099 -22.293
   10    HD3  LYS   3           HD3      LYS   3 -26.853   1.800 -21.107
   11    HE2  LYS   3           HE2      LYS   3 -28.312   0.610 -22.848
   12    HE3  LYS   3           HE3      LYS   3 -27.684   1.793 -23.994
   13    HZ3  LYS   3           HZ1      LYS   3 -25.871   0.581 -24.232
   14    HZ2  LYS   3           HZ2      LYS   3 -26.507  -0.592 -23.182
   15    HZ1  LYS   3           HZ3      LYS   3 -25.539   0.661 -22.569

  No H/Q in entry =          15
  In of MODEL    8
    1    H    LYS   4           H        LYS   4 -30.572   3.220 -17.615
    2    HA   LYS   4           HA       LYS   4 -29.888   5.514 -15.955
    3    HB2  LYS   4           HB2      LYS   4 -31.078   2.811 -15.273
    4    HB3  LYS   4           HB3      LYS   4 -30.887   4.152 -14.144
    5    HG2  LYS   4           HG2      LYS   4 -32.654   4.073 -16.595
    6    HG3  LYS   4           HG3      LYS   4 -33.172   4.121 -14.911
    7    HD2  LYS   4           HD2      LYS   4 -32.500   6.348 -14.635
    8    HD3  LYS   4           HD3      LYS   4 -31.437   6.298 -16.040
    9    HE2  LYS   4           HE2      LYS   4 -33.365   7.656 -16.535
   10    HE3  LYS   4           HE3      LYS   4 -33.417   6.182 -17.504
   11    HZ3  LYS   4           HZ1      LYS   4 -35.011   5.259 -15.983
   12    HZ2  LYS   4           HZ2      LYS   4 -35.568   6.749 -16.577
   13    HZ1  LYS   4           HZ3      LYS   4 -34.936   6.645 -15.003

  No H/Q in entry =          13
  In of MODEL    8
    1    H    HIS   5           H        HIS   5 -28.447   5.610 -14.339
    2    HA   HIS   5           HA       HIS   5 -26.146   3.798 -14.631
    3    HB2  HIS   5           HB2      HIS   5 -26.441   6.552 -13.431
    4    HB3  HIS   5           HB3      HIS   5 -24.953   5.608 -13.389
    5    HD1  HIS   5           HD1      HIS   5 -23.464   6.818 -14.955
    6    HD2  HIS   5           HD2      HIS   5 -27.236   6.169 -16.571
    7    HE1  HIS   5           HE1      HIS   5 -23.261   7.398 -17.403
    8    HE2  HIS   5           HE2      HIS   5 -25.560   6.991 -18.357

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ILE   6           H        ILE   6 -25.928   2.228 -13.310
    2    HA   ILE   6           HA       ILE   6 -26.950   2.491 -10.563
    3    HB   ILE   6           HB       ILE   6 -26.085   0.029 -12.085
    4   HG12  ILE   6          HG12      ILE   6 -28.847   0.948 -11.280
    5   HG13  ILE   6          HG13      ILE   6 -28.179   1.114 -12.903
    6   HG23  ILE   6          HG21      ILE   6 -26.481  -1.225 -10.229
    7   HG22  ILE   6          HG22      ILE   6 -27.656  -0.086  -9.570
    8   HG21  ILE   6          HG23      ILE   6 -25.930   0.260  -9.453
    9   HD13  ILE   6          HD11      ILE   6 -28.617  -1.009 -13.409
   10   HD12  ILE   6          HD12      ILE   6 -29.656  -0.998 -11.984
   11   HD11  ILE   6          HD13      ILE   6 -28.000  -1.595 -11.865

  No H/Q in entry =          11
  In of MODEL    8
    1    H    TYR   7           H        TYR   7 -25.217   3.143  -9.247
    2    HA   TYR   7           HA       TYR   7 -22.489   2.202  -9.881
    3    HB2  TYR   7           HB2      TYR   7 -23.492   4.632  -8.418
    4    HB3  TYR   7           HB3      TYR   7 -21.804   4.127  -8.428
    5    HD1  TYR   7           HD1      TYR   7 -22.787   3.176 -11.535
    6    HD2  TYR   7           HD2      TYR   7 -22.176   6.754  -9.300
    7    HE1  TYR   7           HE1      TYR   7 -22.328   4.407 -13.619
    8    HE2  TYR   7           HE2      TYR   7 -21.758   7.990 -11.377
    9    HH   TYR   7           HH       TYR   7 -21.939   7.901 -13.613

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LEU   8           H        LEU   8 -21.538   0.857  -8.535
    2    HA   LEU   8           HA       LEU   8 -22.709   0.358  -5.871
    3    HB2  LEU   8           HB2      LEU   8 -20.967  -1.297  -7.676
    4    HB3  LEU   8           HB3      LEU   8 -21.178  -1.679  -5.968
    5    HG   LEU   8           HG       LEU   8 -23.650  -1.866  -6.431
    6   HD13  LEU   8          HD11      LEU   8 -23.753  -0.652  -8.543
    7   HD12  LEU   8          HD12      LEU   8 -24.269  -2.319  -8.790
    8   HD11  LEU   8          HD13      LEU   8 -22.656  -1.812  -9.289
    9   HD23  LEU   8          HD21      LEU   8 -22.337  -3.901  -8.101
   10   HD22  LEU   8          HD22      LEU   8 -23.446  -4.074  -6.741
   11   HD21  LEU   8          HD23      LEU   8 -21.745  -3.711  -6.451

  No H/Q in entry =          11
  In of MODEL    8
    1    H    PHE   9           H        PHE   9 -21.479   0.759  -4.069
    2    HA   PHE   9           HA       PHE   9 -18.689   1.715  -4.516
    3    HB2  PHE   9           HB2      PHE   9 -20.768   2.762  -2.602
    4    HB3  PHE   9           HB3      PHE   9 -19.062   3.174  -2.506
    5    HD1  PHE   9           HD1      PHE   9 -17.977   4.481  -4.276
    6    HD2  PHE   9           HD2      PHE   9 -22.184   3.641  -4.383
    7    HE1  PHE   9           HE1      PHE   9 -18.278   6.203  -6.030
    8    HE2  PHE   9           HE2      PHE   9 -22.485   5.376  -6.132
    9    HZ   PHE   9           HZ       PHE   9 -20.529   6.653  -6.960

  No H/Q in entry =           9
  In of MODEL    8
    1    H    SER  10           H        SER  10 -17.117   0.791  -3.367
    2    HA   SER  10           HA       SER  10 -17.372  -0.149  -0.697
    3    HB2  SER  10           HB2      SER  10 -18.552  -2.009  -1.844
    4    HB3  SER  10           HB3      SER  10 -17.126  -2.264  -2.838
    5    HG   SER  10           HG       SER  10 -16.487  -3.478  -1.268

  No H/Q in entry =           5
  In of MODEL    8
    1    H    SER  11           H        SER  11 -15.374   0.004   0.178
    2    HA   SER  11           HA       SER  11 -13.177   0.887  -1.320
    3    HB2  SER  11           HB2      SER  11 -13.798   0.646   1.364
    4    HB3  SER  11           HB3      SER  11 -12.409  -0.421   1.154
    5    HG   SER  11           HG       SER  11 -11.213   1.284   0.907

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA  12           H        ALA  12 -14.315  -1.805  -2.155
    2    HA   ALA  12           HA       ALA  12 -11.720  -3.023  -2.651
    3    HB2  ALA  12           HB1      ALA  12 -12.608  -5.310  -2.010
    4    HB1  ALA  12           HB2      ALA  12 -13.921  -4.477  -1.179
    5    HB3  ALA  12           HB3      ALA  12 -12.254  -4.225  -0.664

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLY  13           H        GLY  13 -12.491  -2.031  -4.684
    2    HA3  GLY  13           HA2      GLY  13 -14.700  -2.748  -6.182
    3    HA2  GLY  13           HA3      GLY  13 -13.137  -2.306  -6.886

  No H/Q in entry =           3
  In of MODEL    8
    1    H    MET  14           H        MET  14 -11.703  -4.613  -5.795
    2    HA   MET  14           HA       MET  14 -12.017  -6.391  -7.923
    3    HB2  MET  14           HB2      MET  14 -10.004  -6.355  -6.447
    4    HB3  MET  14           HB3      MET  14 -10.926  -7.205  -5.209
    5    HG2  MET  14           HG2      MET  14  -9.813  -8.946  -6.332
    6    HG3  MET  14           HG3      MET  14 -11.393  -8.942  -7.119
    7    HE2  MET  14           HE1      MET  14  -7.711  -9.050  -7.659
    8    HE1  MET  14           HE2      MET  14  -7.891  -7.385  -7.106
    9    HE3  MET  14           HE3      MET  14  -7.326  -7.704  -8.744

  No H/Q in entry =           9
  In of MODEL    8
    1    H    SER  15           H        SER  15 -13.340  -6.777  -4.646
    2    HA   SER  15           HA       SER  15 -14.647  -9.263  -5.308
    3    HB2  SER  15           HB2      SER  15 -15.029  -7.418  -2.942
    4    HB3  SER  15           HB3      SER  15 -15.976  -8.884  -3.189
    5    HG   SER  15           HG       SER  15 -13.423  -8.595  -2.294

  No H/Q in entry =           5
  In of MODEL    8
    1    H    THR  16           H        THR  16 -15.732  -5.880  -5.087
    2    HA   THR  16           HA       THR  16 -18.507  -6.412  -5.692
    3    HB   THR  16           HB       THR  16 -16.954  -3.845  -6.169
    4    HG1  THR  16           HG1      THR  16 -16.828  -3.623  -4.109
    5   HG23  THR  16          HG21      THR  16 -19.035  -2.773  -6.099
    6   HG22  THR  16          HG22      THR  16 -19.817  -4.135  -5.277
    7   HG21  THR  16          HG23      THR  16 -19.390  -4.250  -6.989

  No H/Q in entry =           7
  In of MODEL    8
    1    H    SER  17           H        SER  17 -15.601  -5.858  -7.477
    2    HA   SER  17           HA       SER  17 -16.689  -5.127  -9.998
    3    HB2  SER  17           HB2      SER  17 -14.066  -6.434  -9.253
    4    HB3  SER  17           HB3      SER  17 -14.481  -5.992 -10.908
    5    HG   SER  17           HG       SER  17 -13.253  -4.409  -9.650

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU  18           H        LEU  18 -16.126  -8.267  -8.537
    2    HA   LEU  18           HA       LEU  18 -16.660  -9.772 -10.901
    3    HB2  LEU  18           HB2      LEU  18 -15.468 -10.719  -8.971
    4    HB3  LEU  18           HB3      LEU  18 -16.922 -10.542  -7.989
    5    HG   LEU  18           HG       LEU  18 -18.103 -12.133  -9.410
    6   HD13  LEU  18          HD11      LEU  18 -17.238 -11.895 -11.563
    7   HD12  LEU  18          HD12      LEU  18 -16.529 -13.425 -11.046
    8   HD11  LEU  18          HD13      LEU  18 -15.568 -11.948 -11.003
    9   HD22  LEU  18          HD21      LEU  18 -17.093 -13.137  -7.583
   10   HD21  LEU  18          HD22      LEU  18 -15.473 -12.958  -8.260
   11   HD23  LEU  18          HD23      LEU  18 -16.594 -14.128  -8.955

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LEU  19           H        LEU  19 -18.685  -8.576  -8.226
    2    HA   LEU  19           HA       LEU  19 -21.125  -9.777  -9.101
    3    HB2  LEU  19           HB2      LEU  19 -20.906  -8.942  -6.846
    4    HB3  LEU  19           HB3      LEU  19 -20.614  -7.310  -7.447
    5    HG   LEU  19           HG       LEU  19 -22.923  -7.134  -8.177
    6   HD12  LEU  19          HD11      LEU  19 -24.475  -9.015  -7.285
    7   HD11  LEU  19          HD12      LEU  19 -23.016 -10.006  -7.313
    8   HD13  LEU  19          HD13      LEU  19 -23.613  -9.274  -8.801
    9   HD22  LEU  19          HD21      LEU  19 -22.350  -6.453  -5.928
   10   HD21  LEU  19          HD22      LEU  19 -22.620  -8.092  -5.338
   11   HD23  LEU  19          HD23      LEU  19 -23.972  -7.146  -5.960

  No H/Q in entry =          11
  In of MODEL    8
    1    H    VAL  20           H        VAL  20 -19.639  -6.606  -9.773
    2    HA   VAL  20           HA       VAL  20 -21.730  -5.581 -11.380
    3    HB   VAL  20           HB       VAL  20 -18.742  -4.971 -11.500
    4   HG13  VAL  20          HG11      VAL  20 -19.366  -2.943 -12.746
    5   HG12  VAL  20          HG12      VAL  20 -21.050  -3.464 -12.761
    6   HG11  VAL  20          HG13      VAL  20 -19.833  -4.392 -13.636
    7   HG23  VAL  20          HG21      VAL  20 -19.645  -2.802 -10.438
    8   HG22  VAL  20          HG22      VAL  20 -19.472  -4.236  -9.430
    9   HG21  VAL  20          HG23      VAL  20 -21.061  -3.776 -10.040

  No H/Q in entry =           9
  In of MODEL    8
    1    H    SER  21           H        SER  21 -18.940  -7.613 -12.356
    2    HA   SER  21           HA       SER  21 -19.677  -7.509 -15.121
    3    HB2  SER  21           HB2      SER  21 -18.222  -9.469 -15.426
    4    HB3  SER  21           HB3      SER  21 -17.417  -8.213 -14.486
    5    HG   SER  21           HG       SER  21 -17.231  -9.566 -12.937

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LYS  22           H        LYS  22 -20.772  -9.700 -12.566
    2    HA   LYS  22           HA       LYS  22 -22.267 -11.332 -14.413
    3    HB2  LYS  22           HB2      LYS  22 -22.631 -10.979 -11.434
    4    HB3  LYS  22           HB3      LYS  22 -23.388 -12.225 -12.425
    5    HG2  LYS  22           HG2      LYS  22 -20.412 -11.944 -12.032
    6    HG3  LYS  22           HG3      LYS  22 -21.446 -13.019 -11.090
    7    HD2  LYS  22           HD2      LYS  22 -22.081 -14.198 -13.154
    8    HD3  LYS  22           HD3      LYS  22 -21.014 -13.137 -14.077
    9    HE2  LYS  22           HE2      LYS  22 -19.082 -13.981 -12.804
   10    HE3  LYS  22           HE3      LYS  22 -20.151 -15.050 -11.893
   11    HZ1  LYS  22           HZ1      LYS  22 -20.575 -15.525 -14.604
   12    HZ3  LYS  22           HZ2      LYS  22 -19.881 -16.562 -13.451
   13    HZ2  LYS  22           HZ3      LYS  22 -18.895 -15.514 -14.352

  No H/Q in entry =          13
  In of MODEL    8
    1    H    MET  23           H        MET  23 -23.042  -8.412 -12.560
    2    HA   MET  23           HA       MET  23 -25.839  -8.507 -13.116
    3    HB2  MET  23           HB2      MET  23 -24.017  -6.189 -12.513
    4    HB3  MET  23           HB3      MET  23 -25.759  -6.029 -12.721
    5    HG2  MET  23           HG2      MET  23 -26.177  -7.334 -10.759
    6    HG3  MET  23           HG3      MET  23 -24.468  -7.735 -10.602
    7    HE2  MET  23           HE1      MET  23 -26.807  -4.096  -9.457
    8    HE1  MET  23           HE2      MET  23 -27.031  -5.067 -10.911
    9    HE3  MET  23           HE3      MET  23 -26.002  -3.634 -10.958

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ARG  24           H        ARG  24 -23.062  -7.066 -14.852
    2    HA   ARG  24           HA       ARG  24 -24.530  -5.775 -16.878
    3    HB2  ARG  24           HB2      ARG  24 -21.709  -6.896 -16.867
    4    HB3  ARG  24           HB3      ARG  24 -22.365  -5.989 -18.208
    5    HG2  ARG  24           HG2      ARG  24 -22.620  -3.976 -16.780
    6    HG3  ARG  24           HG3      ARG  24 -22.008  -4.906 -15.388
    7    HD2  ARG  24           HD2      ARG  24 -19.906  -5.375 -16.654
    8    HD3  ARG  24           HD3      ARG  24 -20.526  -4.398 -17.978
    9    HE   ARG  24           HE       ARG  24 -20.536  -2.715 -15.841
   10   HH21  ARG  24          HH11      ARG  24 -19.436  -0.905 -16.593
   11   HH22  ARG  24          HH12      ARG  24 -17.857  -1.084 -17.273
   12   HH11  ARG  24          HH21      ARG  24 -18.154  -4.610 -17.318
   13   HH12  ARG  24          HH22      ARG  24 -17.103  -3.280 -17.689

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ALA  25           H        ALA  25 -23.398  -9.106 -16.581
    2    HA   ALA  25           HA       ALA  25 -23.976  -9.941 -19.229
    3    HB1  ALA  25           HB1      ALA  25 -23.283 -11.970 -18.521
    4    HB3  ALA  25           HB2      ALA  25 -24.366 -11.954 -17.128
    5    HB2  ALA  25           HB3      ALA  25 -22.816 -11.120 -17.049

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLN  26           H        GLN  26 -25.856  -9.987 -16.238
    2    HA   GLN  26           HA       GLN  26 -28.176 -11.200 -17.297
    3    HB2  GLN  26           HB2      GLN  26 -27.713  -9.451 -14.901
    4    HB3  GLN  26           HB3      GLN  26 -29.267 -10.180 -15.279
    5    HG2  GLN  26           HG2      GLN  26 -26.684 -11.626 -14.764
    6    HG3  GLN  26           HG3      GLN  26 -28.065 -11.529 -13.679
    7   HE21  GLN  26          HE21      GLN  26 -26.817 -13.689 -14.933
    8   HE22  GLN  26          HE22      GLN  26 -27.840 -14.740 -15.749

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ALA  27           H        ALA  27 -27.263  -7.799 -16.888
    2    HA   ALA  27           HA       ALA  27 -29.743  -6.715 -17.716
    3    HB1  ALA  27           HB1      ALA  27 -27.958  -5.394 -16.568
    4    HB3  ALA  27           HB2      ALA  27 -28.524  -4.630 -18.055
    5    HB2  ALA  27           HB3      ALA  27 -26.986  -5.490 -18.038

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLU  28           H        GLU  28 -27.003  -7.927 -19.537
    2    HA   GLU  28           HA       GLU  28 -27.896  -6.889 -22.072
    3    HB2  GLU  28           HB2      GLU  28 -25.527  -7.564 -21.406
    4    HB3  GLU  28           HB3      GLU  28 -26.061  -9.230 -21.618
    5    HG2  GLU  28           HG2      GLU  28 -24.883  -8.448 -23.565
    6    HG3  GLU  28           HG3      GLU  28 -26.573  -8.778 -23.945

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LYS  29           H        LYS  29 -28.081  -9.997 -20.421
    2    HA   LYS  29           HA       LYS  29 -29.342 -11.471 -22.450
    3    HB2  LYS  29           HB2      LYS  29 -28.326 -12.452 -20.428
    4    HB3  LYS  29           HB3      LYS  29 -29.618 -11.751 -19.455
    5    HG2  LYS  29           HG2      LYS  29 -31.253 -13.129 -20.554
    6    HG3  LYS  29           HG3      LYS  29 -30.032 -13.758 -21.657
    7    HD2  LYS  29           HD2      LYS  29 -28.916 -14.922 -19.905
    8    HD3  LYS  29           HD3      LYS  29 -29.849 -14.086 -18.665
    9    HE2  LYS  29           HE2      LYS  29 -30.586 -16.436 -19.042
   10    HE3  LYS  29           HE3      LYS  29 -31.864 -15.249 -19.308
   11    HZ1  LYS  29           HZ1      LYS  29 -31.255 -15.379 -21.725
   12    HZ3  LYS  29           HZ2      LYS  29 -31.982 -16.769 -21.074
   13    HZ2  LYS  29           HZ3      LYS  29 -30.306 -16.733 -21.342

  No H/Q in entry =          13
  In of MODEL    8
    1    H    TYR  30           H        TYR  30 -30.786  -9.374 -19.969
    2    HA   TYR  30           HA       TYR  30 -33.425  -9.832 -21.259
    3    HB2  TYR  30           HB2      TYR  30 -32.825  -8.678 -18.525
    4    HB3  TYR  30           HB3      TYR  30 -34.431  -8.941 -19.208
    5    HD1  TYR  30           HD1      TYR  30 -35.327 -11.237 -19.440
    6    HD2  TYR  30           HD2      TYR  30 -31.527 -10.502 -17.667
    7    HE1  TYR  30           HE1      TYR  30 -35.243 -13.565 -18.643
    8    HE2  TYR  30           HE2      TYR  30 -31.443 -12.815 -16.874
    9    HH   TYR  30           HH       TYR  30 -33.053 -15.182 -17.999

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLU  31           H        GLU  31 -31.253  -7.830 -22.018
    2    HA   GLU  31           HA       GLU  31 -31.173  -5.672 -22.837
    3    HB2  GLU  31           HB2      GLU  31 -34.056  -6.399 -23.402
    4    HB3  GLU  31           HB3      GLU  31 -33.208  -5.027 -24.115
    5    HG2  GLU  31           HG2      GLU  31 -31.708  -6.458 -25.281
    6    HG3  GLU  31           HG3      GLU  31 -32.283  -7.875 -24.405

  No H/Q in entry =           6
  In of MODEL    8
    1    H    VAL  32           H        VAL  32 -31.422  -5.575 -20.109
    2    HA   VAL  32           HA       VAL  32 -33.305  -3.471 -19.482
    3    HB   VAL  32           HB       VAL  32 -30.938  -4.455 -17.859
    4   HG12  VAL  32          HG11      VAL  32 -32.511  -3.641 -15.990
    5   HG11  VAL  32          HG12      VAL  32 -33.326  -2.739 -17.268
    6   HG13  VAL  32          HG13      VAL  32 -31.626  -2.428 -16.917
    7   HG21  VAL  32          HG21      VAL  32 -32.685  -6.183 -18.580
    8   HG23  VAL  32          HG22      VAL  32 -33.749  -5.362 -17.438
    9   HG22  VAL  32          HG23      VAL  32 -32.239  -6.079 -16.877

  No H/Q in entry =           9
  In of MODEL    8
    1    HA   PRO  33           HA       PRO  33 -30.259  -0.525 -21.097
    2    HB2  PRO  33           HB2      PRO  33 -31.784   1.689 -20.998
    3    HB3  PRO  33           HB3      PRO  33 -32.226   0.387 -22.101
    4    HG2  PRO  33           HG2      PRO  33 -33.247   0.894 -19.305
    5    HG3  PRO  33           HG3      PRO  33 -34.184   0.682 -20.785
    6    HD2  PRO  33           HD2      PRO  33 -33.747  -1.390 -19.114
    7    HD3  PRO  33           HD3      PRO  33 -33.777  -1.630 -20.861

  No H/Q in entry =           7
  In of MODEL    8
    1    H    VAL  34           H        VAL  34 -29.027  -1.065 -19.126
    2    HA   VAL  34           HA       VAL  34 -28.787   1.360 -17.471
    3    HB   VAL  34           HB       VAL  34 -28.232  -0.102 -15.525
    4   HG12  VAL  34          HG11      VAL  34 -30.644  -0.989 -15.262
    5   HG11  VAL  34          HG12      VAL  34 -30.937  -0.228 -16.824
    6   HG13  VAL  34          HG13      VAL  34 -30.414   0.749 -15.452
    7   HG21  VAL  34          HG21      VAL  34 -28.370  -2.126 -17.538
    8   HG23  VAL  34          HG22      VAL  34 -29.449  -2.496 -16.192
    9   HG22  VAL  34          HG23      VAL  34 -27.737  -2.199 -15.894

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ILE  35           H        ILE  35 -26.829   1.805 -16.594
    2    HA   ILE  35           HA       ILE  35 -24.494   0.490 -17.818
    3    HB   ILE  35           HB       ILE  35 -24.925   3.377 -17.011
    4   HG12  ILE  35          HG12      ILE  35 -23.890   2.080 -19.538
    5   HG13  ILE  35          HG13      ILE  35 -25.528   2.690 -19.307
    6   HG21  ILE  35          HG21      ILE  35 -22.349   1.860 -17.275
    7   HG23  ILE  35          HG22      ILE  35 -22.832   3.034 -16.053
    8   HG22  ILE  35          HG23      ILE  35 -22.424   3.573 -17.682
    9   HD11  ILE  35          HD11      ILE  35 -24.150   4.892 -18.679
   10   HD13  ILE  35          HD12      ILE  35 -24.656   4.508 -20.325
   11   HD12  ILE  35          HD13      ILE  35 -23.011   4.148 -19.800

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ILE  36           H        ILE  36 -23.285  -0.527 -16.199
    2    HA   ILE  36           HA       ILE  36 -23.781   0.080 -13.335
    3    HB   ILE  36           HB       ILE  36 -22.917  -2.616 -14.433
    4   HG12  ILE  36          HG12      ILE  36 -25.742  -1.829 -13.718
    5   HG13  ILE  36          HG13      ILE  36 -25.141  -1.802 -15.376
    6   HG23  ILE  36          HG21      ILE  36 -23.300  -3.450 -12.327
    7   HG22  ILE  36          HG22      ILE  36 -24.443  -2.174 -11.906
    8   HG21  ILE  36          HG23      ILE  36 -22.713  -1.831 -11.945
    9   HD13  ILE  36          HD11      ILE  36 -25.289  -4.016 -15.588
   10   HD12  ILE  36          HD12      ILE  36 -26.380  -3.903 -14.208
   11   HD11  ILE  36          HD13      ILE  36 -24.683  -4.313 -13.959

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLU  37           H        GLU  37 -22.023   0.719 -12.199
    2    HA   GLU  37           HA       GLU  37 -19.312  -0.059 -13.068
    3    HB2  GLU  37           HB2      GLU  37 -20.241   2.724 -12.381
    4    HB3  GLU  37           HB3      GLU  37 -18.548   2.243 -12.481
    5    HG2  GLU  37           HG2      GLU  37 -18.802   1.781 -14.845
    6    HG3  GLU  37           HG3      GLU  37 -20.508   2.213 -14.757

  No H/Q in entry =           6
  In of MODEL    8
    1    H    ALA  38           H        ALA  38 -17.854  -0.289 -11.359
    2    HA   ALA  38           HA       ALA  38 -18.935  -0.122  -8.607
    3    HB1  ALA  38           HB1      ALA  38 -17.183  -2.046 -10.005
    4    HB3  ALA  38           HB2      ALA  38 -18.255  -2.292  -8.627
    5    HB2  ALA  38           HB3      ALA  38 -16.652  -1.599  -8.384

  No H/Q in entry =           5
  In of MODEL    8
    1    H    PHE  39           H        PHE  39 -17.730   1.094  -7.110
    2    HA   PHE  39           HA       PHE  39 -15.198   2.316  -7.960
    3    HB2  PHE  39           HB2      PHE  39 -17.443   3.888  -6.694
    4    HB3  PHE  39           HB3      PHE  39 -15.871   4.503  -7.202
    5    HD1  PHE  39           HD1      PHE  39 -15.371   4.887  -9.527
    6    HD2  PHE  39           HD2      PHE  39 -19.184   3.437  -8.286
    7    HE1  PHE  39           HE1      PHE  39 -16.300   5.464 -11.750
    8    HE2  PHE  39           HE2      PHE  39 -20.124   4.001 -10.499
    9    HZ   PHE  39           HZ       PHE  39 -18.682   4.986 -12.248

  No H/Q in entry =           9
  In of MODEL    8
    1    HA   PRO  40           HA       PRO  40 -14.329   1.563  -3.658
    2    HB2  PRO  40           HB2      PRO  40 -12.590   3.592  -3.019
    3    HB3  PRO  40           HB3      PRO  40 -12.116   2.265  -4.081
    4    HG2  PRO  40           HG2      PRO  40 -13.152   4.993  -4.841
    5    HG3  PRO  40           HG3      PRO  40 -11.707   4.166  -5.422
    6    HD2  PRO  40           HD2      PRO  40 -13.902   4.061  -6.870
    7    HD3  PRO  40           HD3      PRO  40 -12.941   2.599  -6.666

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLU  41           H        GLU  41 -14.996   2.533  -1.539
    2    HA   GLU  41           HA       GLU  41 -17.256   4.216  -1.560
    3    HB2  GLU  41           HB2      GLU  41 -17.158   4.135   0.818
    4    HB3  GLU  41           HB3      GLU  41 -16.635   2.558   0.227
    5    HG2  GLU  41           HG2      GLU  41 -14.295   3.196   0.620
    6    HG3  GLU  41           HG3      GLU  41 -14.836   4.757   1.241

  No H/Q in entry =           6
  In of MODEL    8
    1    H    THR  42           H        THR  42 -13.933   5.164  -1.551
    2    HA   THR  42           HA       THR  42 -14.330   7.719  -0.343
    3    HB   THR  42           HB       THR  42 -12.158   8.313  -1.381
    4    HG1  THR  42           HG1      THR  42 -11.225   6.300  -2.482
    5   HG23  THR  42          HG21      THR  42 -11.874   7.185   0.658
    6   HG22  THR  42          HG22      THR  42 -10.878   6.251  -0.460
    7   HG21  THR  42          HG23      THR  42 -12.473   5.661   0.003

  No H/Q in entry =           7
  In of MODEL    8
    1    H    LEU  43           H        LEU  43 -15.170   6.620  -3.460
    2    HA   LEU  43           HA       LEU  43 -15.430   9.392  -4.431
    3    HB2  LEU  43           HB2      LEU  43 -15.743   6.743  -5.832
    4    HB3  LEU  43           HB3      LEU  43 -15.959   8.320  -6.591
    5    HG   LEU  43           HG       LEU  43 -13.356   7.227  -5.548
    6   HD13  LEU  43          HD11      LEU  43 -12.750   6.837  -7.793
    7   HD12  LEU  43          HD12      LEU  43 -14.143   7.726  -8.408
    8   HD11  LEU  43          HD13      LEU  43 -14.371   6.160  -7.632
    9   HD23  LEU  43          HD21      LEU  43 -12.556   9.221  -7.016
   10   HD22  LEU  43          HD22      LEU  43 -13.164   9.543  -5.391
   11   HD21  LEU  43          HD23      LEU  43 -14.197   9.826  -6.791

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ALA  44           H        ALA  44 -17.392   7.547  -2.615
    2    HA   ALA  44           HA       ALA  44 -19.844   7.385  -3.980
    3    HB3  ALA  44           HB1      ALA  44 -19.732   6.267  -1.883
    4    HB2  ALA  44           HB2      ALA  44 -20.857   7.602  -1.629
    5    HB1  ALA  44           HB3      ALA  44 -19.197   7.725  -1.047

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLY  45           H        GLY  45 -18.478  10.197  -2.420
    2    HA3  GLY  45           HA2      GLY  45 -20.921  11.674  -2.823
    3    HA2  GLY  45           HA3      GLY  45 -19.394  12.313  -2.218

  No H/Q in entry =           3
  In of MODEL    8
    1    H    GLU  46           H        GLU  46 -17.813  11.393  -4.482
    2    HA   GLU  46           HA       GLU  46 -18.440  13.604  -6.260
    3    HB2  GLU  46           HB2      GLU  46 -16.119  13.111  -5.586
    4    HB3  GLU  46           HB3      GLU  46 -16.241  11.532  -6.363
    5    HG2  GLU  46           HG2      GLU  46 -15.030  12.956  -7.820
    6    HG3  GLU  46           HG3      GLU  46 -16.628  12.710  -8.525

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LYS  47           H        LYS  47 -18.280  10.087  -6.696
    2    HA   LYS  47           HA       LYS  47 -19.333  10.300  -9.391
    3    HB2  LYS  47           HB2      LYS  47 -18.205   8.193  -7.678
    4    HB3  LYS  47           HB3      LYS  47 -19.524   7.658  -8.719
    5    HG2  LYS  47           HG2      LYS  47 -17.373   7.293  -9.772
    6    HG3  LYS  47           HG3      LYS  47 -18.320   8.481 -10.667
    7    HD2  LYS  47           HD2      LYS  47 -17.092  10.287  -9.537
    8    HD3  LYS  47           HD3      LYS  47 -16.118   9.080  -8.699
    9    HE2  LYS  47           HE2      LYS  47 -15.244   8.275 -10.806
   10    HE3  LYS  47           HE3      LYS  47 -16.281   9.394 -11.689
   11    HZ2  LYS  47           HZ1      LYS  47 -13.983  10.015  -9.945
   12    HZ1  LYS  47           HZ2      LYS  47 -15.126  11.192 -10.382
   13    HZ3  LYS  47           HZ3      LYS  47 -14.207  10.415 -11.581

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLY  48           H        GLY  48 -20.705   9.528  -6.267
    2    HA3  GLY  48           HA2      GLY  48 -23.065   8.321  -7.051
    3    HA2  GLY  48           HA3      GLY  48 -22.874   9.316  -5.607

  No H/Q in entry =           3
  In of MODEL    8
    1    H    GLN  49           H        GLN  49 -22.286  11.746  -7.165
    2    HA   GLN  49           HA       GLN  49 -24.852  12.833  -7.354
    3    HB2  GLN  49           HB2      GLN  49 -22.293  13.722  -8.668
    4    HB3  GLN  49           HB3      GLN  49 -23.765  14.675  -8.609
    5    HG2  GLN  49           HG2      GLN  49 -23.649  14.697  -6.170
    6    HG3  GLN  49           HG3      GLN  49 -22.190  13.724  -6.227
    7   HE21  GLN  49          HE21      GLN  49 -22.116  15.952  -4.951
    8   HE22  GLN  49          HE22      GLN  49 -21.192  17.217  -5.581

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ASN  50           H        ASN  50 -23.115  10.972  -9.713
    2    HA   ASN  50           HA       ASN  50 -24.968  11.829 -11.827
    3    HB2  ASN  50           HB2      ASN  50 -22.371  10.312 -12.016
    4    HB3  ASN  50           HB3      ASN  50 -23.401  10.730 -13.378
    5   HD21  ASN  50          HD21      ASN  50 -20.801  11.598 -11.720
    6   HD22  ASN  50          HD22      ASN  50 -20.576  13.236 -12.057

  No H/Q in entry =           6
  In of MODEL    8
    1    H    ALA  51           H        ALA  51 -24.973   9.471  -9.582
    2    HA   ALA  51           HA       ALA  51 -25.705   7.321 -11.425
    3    HB2  ALA  51           HB1      ALA  51 -25.141   5.975  -9.730
    4    HB3  ALA  51           HB2      ALA  51 -26.289   6.772  -8.656
    5    HB1  ALA  51           HB3      ALA  51 -24.652   7.408  -8.824

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ASP  52           H        ASP  52 -27.704   6.248 -11.322
    2    HA   ASP  52           HA       ASP  52 -29.912   8.062 -10.693
    3    HB2  ASP  52           HB2      ASP  52 -29.670   5.561 -12.362
    4    HB3  ASP  52           HB3      ASP  52 -31.229   6.280 -11.954

  No H/Q in entry =           4
  In of MODEL    8
    1    H    VAL  53           H        VAL  53 -28.306   5.186  -9.651
    2    HA   VAL  53           HA       VAL  53 -29.791   5.299  -7.161
    3    HB   VAL  53           HB       VAL  53 -31.154   3.647  -8.430
    4   HG11  VAL  53          HG11      VAL  53 -29.374   2.803  -9.922
    5   HG13  VAL  53          HG12      VAL  53 -30.212   1.500  -9.079
    6   HG12  VAL  53          HG13      VAL  53 -28.616   2.015  -8.540
    7   HG23  VAL  53          HG21      VAL  53 -30.347   1.675  -6.726
    8   HG22  VAL  53          HG22      VAL  53 -31.493   2.970  -6.378
    9   HG21  VAL  53          HG23      VAL  53 -29.795   3.155  -5.940

  No H/Q in entry =           9
  In of MODEL    8
    1    H    VAL  54           H        VAL  54 -28.504   4.875  -5.483
    2    HA   VAL  54           HA       VAL  54 -25.727   4.047  -6.047
    3    HB   VAL  54           HB       VAL  54 -26.850   5.814  -3.815
    4   HG11  VAL  54          HG11      VAL  54 -24.257   4.415  -4.061
    5   HG13  VAL  54          HG12      VAL  54 -25.039   5.087  -2.632
    6   HG12  VAL  54          HG13      VAL  54 -24.123   6.138  -3.711
    7   HG22  VAL  54          HG21      VAL  54 -25.985   7.636  -4.897
    8   HG21  VAL  54          HG22      VAL  54 -26.502   6.643  -6.260
    9   HG23  VAL  54          HG23      VAL  54 -24.802   6.680  -5.791

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LEU  55           H        LEU  55 -25.133   2.129  -5.395
    2    HA   LEU  55           HA       LEU  55 -26.669   0.805  -3.248
    3    HB2  LEU  55           HB2      LEU  55 -25.064  -0.349  -5.517
    4    HB3  LEU  55           HB3      LEU  55 -25.839  -1.291  -4.243
    5    HG   LEU  55           HG       LEU  55 -27.251   0.288  -6.384
    6   HD13  LEU  55          HD11      LEU  55 -26.916  -1.561  -7.599
    7   HD12  LEU  55          HD12      LEU  55 -27.888  -2.443  -6.422
    8   HD11  LEU  55          HD13      LEU  55 -26.136  -2.367  -6.240
    9   HD23  LEU  55          HD21      LEU  55 -28.563  -1.668  -4.553
   10   HD22  LEU  55          HD22      LEU  55 -29.254  -0.291  -5.411
   11   HD21  LEU  55          HD23      LEU  55 -28.260  -0.029  -3.978

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LEU  56           H        LEU  56 -25.544   0.218  -1.423
    2    HA   LEU  56           HA       LEU  56 -22.612   0.633  -1.421
    3    HB2  LEU  56           HB2      LEU  56 -24.456   0.407   0.945
    4    HB3  LEU  56           HB3      LEU  56 -22.750   0.849   0.965
    5    HG   LEU  56           HG       LEU  56 -25.043   2.512  -0.038
    6   HD11  LEU  56          HD11      LEU  56 -23.970   2.135   2.501
    7   HD13  LEU  56          HD12      LEU  56 -24.961   3.498   1.980
    8   HD12  LEU  56          HD13      LEU  56 -23.203   3.615   1.923
    9   HD23  LEU  56          HD21      LEU  56 -23.107   4.224  -0.196
   10   HD22  LEU  56          HD22      LEU  56 -23.459   3.126  -1.531
   11   HD21  LEU  56          HD23      LEU  56 -22.122   2.782  -0.434

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLY  57           H        GLY  57 -21.231  -0.988  -0.864
    2    HA3  GLY  57           HA2      GLY  57 -22.132  -3.680  -1.079
    3    HA2  GLY  57           HA3      GLY  57 -20.521  -3.176  -0.573

  No H/Q in entry =           3
  In of MODEL    8
    1    HA   PRO  58           HA       PRO  58 -23.388  -4.237   3.087
    2    HB2  PRO  58           HB2      PRO  58 -22.696  -6.837   3.703
    3    HB3  PRO  58           HB3      PRO  58 -24.065  -6.438   2.667
    4    HG2  PRO  58           HG2      PRO  58 -21.319  -7.299   1.927
    5    HG3  PRO  58           HG3      PRO  58 -22.868  -7.769   1.228
    6    HD2  PRO  58           HD2      PRO  58 -21.250  -5.940   0.036
    7    HD3  PRO  58           HD3      PRO  58 -23.007  -5.865  -0.097

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLN  59           H        GLN  59 -20.004  -4.686   2.540
    2    HA   GLN  59           HA       GLN  59 -19.297  -4.701   5.313
    3    HB2  GLN  59           HB2      GLN  59 -17.804  -4.187   2.773
    4    HB3  GLN  59           HB3      GLN  59 -17.078  -3.725   4.299
    5    HG2  GLN  59           HG2      GLN  59 -16.311  -5.916   3.583
    6    HG3  GLN  59           HG3      GLN  59 -17.223  -6.029   5.078
    7   HE21  GLN  59          HE21      GLN  59 -17.883  -7.890   4.814
    8   HE22  GLN  59          HE22      GLN  59 -18.924  -8.758   3.849

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ILE  60           H        ILE  60 -20.208  -2.155   3.090
    2    HA   ILE  60           HA       ILE  60 -19.405  -0.194   5.152
    3    HB   ILE  60           HB       ILE  60 -19.622   1.536   3.321
    4   HG12  ILE  60          HG12      ILE  60 -19.370  -0.700   1.351
    5   HG13  ILE  60          HG13      ILE  60 -20.968  -0.154   1.859
    6   HG23  ILE  60          HG21      ILE  60 -17.451   1.253   2.565
    7   HG22  ILE  60          HG22      ILE  60 -17.567  -0.505   2.602
    8   HG21  ILE  60          HG23      ILE  60 -17.494   0.405   4.110
    9   HD12  ILE  60          HD11      ILE  60 -18.888   1.298   0.266
   10   HD11  ILE  60          HD12      ILE  60 -20.043   2.219   1.228
   11   HD13  ILE  60          HD13      ILE  60 -20.617   1.135  -0.038

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ALA  61           H        ALA  61 -21.851  -1.795   5.177
    2    HA   ALA  61           HA       ALA  61 -24.079  -0.145   4.681
    3    HB1  ALA  61           HB1      ALA  61 -25.308  -1.643   5.984
    4    HB2  ALA  61           HB2      ALA  61 -23.926  -2.024   7.010
    5    HB3  ALA  61           HB3      ALA  61 -23.988  -2.630   5.355

  No H/Q in entry =           5
  In of MODEL    8
    1    H    TYR  62           H        TYR  62 -21.921  -0.245   7.517
    2    HA   TYR  62           HA       TYR  62 -23.516   1.401   9.161
    3    HB2  TYR  62           HB2      TYR  62 -21.508   1.828  10.438
    4    HB3  TYR  62           HB3      TYR  62 -21.530   0.133   9.953
    5    HD1  TYR  62           HD1      TYR  62 -19.885  -0.737   8.355
    6    HD2  TYR  62           HD2      TYR  62 -19.820   3.372   9.525
    7    HE1  TYR  62           HE1      TYR  62 -17.654  -0.486   7.335
    8    HE2  TYR  62           HE2      TYR  62 -17.575   3.618   8.506
    9    HH   TYR  62           HH       TYR  62 -16.357   2.227   6.488

  No H/Q in entry =           9
  In of MODEL    8
    1    H    MET  63           H        MET  63 -21.828   2.273   6.334
    2    HA   MET  63           HA       MET  63 -21.691   5.106   7.033
    3    HB2  MET  63           HB2      MET  63 -21.027   3.583   4.512
    4    HB3  MET  63           HB3      MET  63 -20.856   5.331   4.688
    5    HG2  MET  63           HG2      MET  63 -19.162   5.025   6.379
    6    HG3  MET  63           HG3      MET  63 -19.366   3.276   6.297
    7    HE3  MET  63           HE1      MET  63 -18.769   5.871   2.859
    8    HE2  MET  63           HE2      MET  63 -17.288   6.175   3.765
    9    HE1  MET  63           HE3      MET  63 -18.857   6.388   4.545

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LEU  64           H        LEU  64 -24.227   3.237   6.023
    2    HA   LEU  64           HA       LEU  64 -25.408   4.650   3.925
    3    HB2  LEU  64           HB2      LEU  64 -26.281   2.539   4.826
    4    HB3  LEU  64           HB3      LEU  64 -26.768   3.378   6.298
    5    HG   LEU  64           HG       LEU  64 -28.448   4.623   5.042
    6   HD13  LEU  64          HD11      LEU  64 -28.128   4.868   2.815
    7   HD12  LEU  64          HD12      LEU  64 -28.762   3.229   2.657
    8   HD11  LEU  64          HD13      LEU  64 -27.022   3.498   2.745
    9   HD23  LEU  64          HD21      LEU  64 -28.938   1.808   4.283
   10   HD22  LEU  64          HD22      LEU  64 -29.948   2.937   5.187
   11   HD21  LEU  64          HD23      LEU  64 -28.583   2.150   5.976

  No H/Q in entry =          11
  In of MODEL    8
    1    HA   PRO  65           HA       PRO  65 -27.652   7.790   6.640
    2    HB2  PRO  65           HB2      PRO  65 -25.691   7.957   8.929
    3    HB3  PRO  65           HB3      PRO  65 -27.432   8.229   8.944
    4    HG2  PRO  65           HG2      PRO  65 -26.508   5.978   9.886
    5    HG3  PRO  65           HG3      PRO  65 -27.908   5.939   8.816
    6    HD2  PRO  65           HD2      PRO  65 -25.023   5.340   8.162
    7    HD3  PRO  65           HD3      PRO  65 -26.468   4.447   7.689

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLU  66           H        GLU  66 -24.097   7.751   6.774
    2    HA   GLU  66           HA       GLU  66 -23.806  10.552   6.376
    3    HB2  GLU  66           HB2      GLU  66 -21.972   8.253   5.754
    4    HB3  GLU  66           HB3      GLU  66 -21.527   9.948   5.555
    5    HG2  GLU  66           HG2      GLU  66 -21.780  10.315   7.920
    6    HG3  GLU  66           HG3      GLU  66 -22.302   8.646   8.141

  No H/Q in entry =           6
  In of MODEL    8
    1    H    ILE  67           H        ILE  67 -23.858   7.807   4.121
    2    HA   ILE  67           HA       ILE  67 -23.410   9.519   1.837
    3    HB   ILE  67           HB       ILE  67 -24.299   6.609   1.998
    4   HG12  ILE  67          HG12      ILE  67 -21.659   7.789   1.123
    5   HG13  ILE  67          HG13      ILE  67 -21.980   7.367   2.803
    6   HG21  ILE  67          HG21      ILE  67 -24.212   8.489  -0.224
    7   HG23  ILE  67          HG22      ILE  67 -24.830   6.839  -0.184
    8   HG22  ILE  67          HG23      ILE  67 -23.118   7.130  -0.484
    9   HD12  ILE  67          HD11      ILE  67 -21.514   5.600   0.460
   10   HD11  ILE  67          HD12      ILE  67 -22.548   5.022   1.765
   11   HD13  ILE  67          HD13      ILE  67 -20.883   5.493   2.102

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLN  68           H        GLN  68 -26.303   8.454   3.419
    2    HA   GLN  68           HA       GLN  68 -28.102   9.380   1.416
    3    HB2  GLN  68           HB2      GLN  68 -28.407   9.019   4.394
    4    HB3  GLN  68           HB3      GLN  68 -29.711   9.611   3.378
    5    HG2  GLN  68           HG2      GLN  68 -29.711   7.582   2.101
    6    HG3  GLN  68           HG3      GLN  68 -28.274   7.009   2.927
    7   HE21  GLN  68          HE21      GLN  68 -30.447   5.644   2.754
    8   HE22  GLN  68          HE22      GLN  68 -31.298   5.185   4.154

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ARG  69           H        ARG  69 -26.547  11.049   4.181
    2    HA   ARG  69           HA       ARG  69 -27.910  13.528   3.754
    3    HB2  ARG  69           HB2      ARG  69 -25.591  12.602   5.381
    4    HB3  ARG  69           HB3      ARG  69 -25.667  14.322   5.023
    5    HG2  ARG  69           HG2      ARG  69 -27.999  14.359   5.956
    6    HG3  ARG  69           HG3      ARG  69 -27.796  12.669   6.432
    7    HD2  ARG  69           HD2      ARG  69 -26.123  15.027   7.376
    8    HD3  ARG  69           HD3      ARG  69 -27.268  14.117   8.350
    9    HE   ARG  69           HE       ARG  69 -24.638  13.192   7.444
   10   HH21  ARG  69          HH11      ARG  69 -23.846  11.429   8.651
   11   HH22  ARG  69          HH12      ARG  69 -24.892  10.609   9.763
   12   HH11  ARG  69          HH21      ARG  69 -27.622  12.638   9.091
   13   HH12  ARG  69          HH22      ARG  69 -27.030  11.292  10.009

  No H/Q in entry =          13
  In of MODEL    8
    1    H    LEU  70           H        LEU  70 -25.014  12.128   2.442
    2    HA   LEU  70           HA       LEU  70 -23.885  14.497   1.294
    3    HB2  LEU  70           HB2      LEU  70 -22.897  12.180   1.904
    4    HB3  LEU  70           HB3      LEU  70 -23.485  11.714   0.308
    5    HG   LEU  70           HG       LEU  70 -21.876  13.090  -0.749
    6   HD11  LEU  70          HD11      LEU  70 -21.101  13.931   2.053
    7   HD13  LEU  70          HD12      LEU  70 -21.777  14.966   0.794
    8   HD12  LEU  70          HD13      LEU  70 -20.161  14.287   0.601
    9   HD22  LEU  70          HD21      LEU  70 -20.444  11.375  -0.495
   10   HD21  LEU  70          HD22      LEU  70 -21.392  10.850   0.897
   11   HD23  LEU  70          HD23      LEU  70 -20.013  11.923   1.124

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LEU  71           H        LEU  71 -26.017  11.952   0.141
    2    HA   LEU  71           HA       LEU  71 -26.501  13.442  -2.383
    3    HB2  LEU  71           HB2      LEU  71 -26.713  10.456  -1.943
    4    HB3  LEU  71           HB3      LEU  71 -26.816  11.319  -3.477
    5    HG   LEU  71           HG       LEU  71 -24.324  11.331  -1.774
    6   HD12  LEU  71          HD11      LEU  71 -24.336   9.705  -4.209
    7   HD11  LEU  71          HD12      LEU  71 -25.368   9.080  -2.923
    8   HD13  LEU  71          HD13      LEU  71 -23.653   9.360  -2.620
    9   HD22  LEU  71          HD21      LEU  71 -24.402  13.149  -3.267
   10   HD21  LEU  71          HD22      LEU  71 -24.878  12.107  -4.609
   11   HD23  LEU  71          HD23      LEU  71 -23.268  11.960  -3.904

  No H/Q in entry =          11
  In of MODEL    8
    1    HA   PRO  72           HA       PRO  72 -30.411  12.992   0.174
    2    HB2  PRO  72           HB2      PRO  72 -31.264  15.553   0.081
    3    HB3  PRO  72           HB3      PRO  72 -29.974  15.099   1.194
    4    HG2  PRO  72           HG2      PRO  72 -29.742  16.296  -1.556
    5    HG3  PRO  72           HG3      PRO  72 -28.999  16.845  -0.053
    6    HD2  PRO  72           HD2      PRO  72 -27.634  15.287  -1.798
    7    HD3  PRO  72           HD3      PRO  72 -27.408  15.119  -0.059

  No H/Q in entry =           7
  In of MODEL    8
    1    H    ASN  73           H        ASN  73 -29.733  13.948  -3.029
    2    HA   ASN  73           HA       ASN  73 -32.582  13.645  -3.708
    3    HB2  ASN  73           HB2      ASN  73 -32.081  14.753  -5.796
    4    HB3  ASN  73           HB3      ASN  73 -31.579  15.731  -4.425
    5   HD21  ASN  73          HD21      ASN  73 -30.740  15.776  -7.090
    6   HD22  ASN  73          HD22      ASN  73 -29.069  15.613  -7.255

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LYS  74           H        LYS  74 -30.612  11.385  -3.253
    2    HA   LYS  74           HA       LYS  74 -31.141   9.994  -5.812
    3    HB2  LYS  74           HB2      LYS  74 -28.637   9.695  -4.150
    4    HB3  LYS  74           HB3      LYS  74 -28.996   8.885  -5.674
    5    HG2  LYS  74           HG2      LYS  74 -28.728  11.854  -5.464
    6    HG3  LYS  74           HG3      LYS  74 -27.352  10.789  -5.748
    7    HD2  LYS  74           HD2      LYS  74 -28.439   9.865  -7.710
    8    HD3  LYS  74           HD3      LYS  74 -29.861  10.866  -7.412
    9    HE2  LYS  74           HE2      LYS  74 -28.624  12.870  -7.832
   10    HE3  LYS  74           HE3      LYS  74 -27.103  11.976  -7.899
   11    HZ2  LYS  74           HZ1      LYS  74 -28.537  12.584 -10.048
   12    HZ1  LYS  74           HZ2      LYS  74 -29.202  11.063  -9.688
   13    HZ3  LYS  74           HZ3      LYS  74 -27.532  11.219  -9.957

  No H/Q in entry =          13
  In of MODEL    8
    1    HA   PRO  75           HA       PRO  75 -32.593   7.010  -2.868
    2    HB2  PRO  75           HB2      PRO  75 -32.882   4.794  -4.457
    3    HB3  PRO  75           HB3      PRO  75 -34.003   6.152  -4.543
    4    HG2  PRO  75           HG2      PRO  75 -31.638   5.550  -6.275
    5    HG3  PRO  75           HG3      PRO  75 -33.278   5.993  -6.750
    6    HD2  PRO  75           HD2      PRO  75 -31.331   7.852  -6.672
    7    HD3  PRO  75           HD3      PRO  75 -32.971   8.256  -6.162

  No H/Q in entry =           7
  In of MODEL    8
    1    H    VAL  76           H        VAL  76 -31.165   5.949  -1.471
    2    HA   VAL  76           HA       VAL  76 -28.686   4.733  -2.538
    3    HB   VAL  76           HB       VAL  76 -29.014   6.198   0.115
    4   HG11  VAL  76          HG11      VAL  76 -26.638   4.904  -1.238
    5   HG13  VAL  76          HG12      VAL  76 -27.363   4.456   0.307
    6   HG12  VAL  76          HG13      VAL  76 -26.509   5.990   0.147
    7   HG22  VAL  76          HG21      VAL  76 -28.325   8.098  -0.758
    8   HG21  VAL  76          HG22      VAL  76 -28.844   7.405  -2.296
    9   HG23  VAL  76          HG23      VAL  76 -27.150   7.311  -1.813

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLU  77           H        GLU  77 -28.486   2.578  -1.924
    2    HA   GLU  77           HA       GLU  77 -29.320   1.791   0.716
    3    HB2  GLU  77           HB2      GLU  77 -30.922   0.149   0.158
    4    HB3  GLU  77           HB3      GLU  77 -31.455   1.674  -0.552
    5    HG2  GLU  77           HG2      GLU  77 -30.812   0.916  -2.730
    6    HG3  GLU  77           HG3      GLU  77 -30.186  -0.583  -2.048

  No H/Q in entry =           6
  In of MODEL    8
    1    H    VAL  78           H        VAL  78 -29.010  -0.297   1.379
    2    HA   VAL  78           HA       VAL  78 -26.332  -1.076   0.535
    3    HB   VAL  78           HB       VAL  78 -28.082  -1.957   2.871
    4   HG11  VAL  78          HG11      VAL  78 -25.727  -3.192   1.786
    5   HG13  VAL  78          HG12      VAL  78 -26.661  -3.660   3.209
    6   HG12  VAL  78          HG13      VAL  78 -25.340  -2.503   3.362
    7   HG22  VAL  78          HG21      VAL  78 -26.641  -0.599   4.235
    8   HG21  VAL  78          HG22      VAL  78 -27.353   0.374   2.949
    9   HG23  VAL  78          HG23      VAL  78 -25.676  -0.158   2.827

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ILE  79           H        ILE  79 -25.784  -2.985  -0.361
    2    HA   ILE  79           HA       ILE  79 -27.826  -4.456  -1.745
    3    HB   ILE  79           HB       ILE  79 -24.841  -4.991  -1.474
    4   HG12  ILE  79          HG12      ILE  79 -26.435  -3.881  -3.788
    5   HG13  ILE  79          HG13      ILE  79 -25.578  -2.875  -2.620
    6   HG22  ILE  79          HG21      ILE  79 -25.907  -6.167  -3.812
    7   HG21  ILE  79          HG22      ILE  79 -26.916  -6.687  -2.461
    8   HG23  ILE  79          HG23      ILE  79 -25.175  -6.969  -2.421
    9   HD13  ILE  79          HD11      ILE  79 -24.134  -2.991  -4.414
   10   HD12  ILE  79          HD12      ILE  79 -24.474  -4.698  -4.702
   11   HD11  ILE  79          HD13      ILE  79 -23.511  -4.213  -3.305

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ASP  80           H        ASP  80 -28.705  -6.378  -1.177
    2    HA   ASP  80           HA       ASP  80 -28.699  -7.279   1.469
    3    HB2  ASP  80           HB2      ASP  80 -30.426  -7.850  -0.200
    4    HB3  ASP  80           HB3      ASP  80 -29.257  -8.859  -1.050

  No H/Q in entry =           4
  In of MODEL    8
    1    H    SER  81           H        SER  81 -27.186  -8.419   2.625
    2    HA   SER  81           HA       SER  81 -24.672  -9.107   1.476
    3    HB2  SER  81           HB2      SER  81 -24.094 -10.028   3.636
    4    HB3  SER  81           HB3      SER  81 -24.984  -8.527   3.890
    5    HG   SER  81           HG       SER  81 -26.426 -10.891   3.784

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU  82           H        LEU  82 -27.393 -11.191   1.751
    2    HA   LEU  82           HA       LEU  82 -25.843 -13.563   1.256
    3    HB2  LEU  82           HB2      LEU  82 -28.773 -12.937   0.956
    4    HB3  LEU  82           HB3      LEU  82 -28.073 -14.541   0.747
    5    HG   LEU  82           HG       LEU  82 -28.036 -12.976   3.310
    6   HD13  LEU  82          HD11      LEU  82 -30.302 -13.570   2.911
    7   HD12  LEU  82          HD12      LEU  82 -29.668 -14.833   3.969
    8   HD11  LEU  82          HD13      LEU  82 -29.849 -15.139   2.242
    9   HD23  LEU  82          HD21      LEU  82 -27.474 -15.376   4.095
   10   HD22  LEU  82          HD22      LEU  82 -26.206 -14.439   3.306
   11   HD21  LEU  82          HD23      LEU  82 -27.080 -15.675   2.401

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LEU  83           H        LEU  83 -27.763 -11.332  -0.695
    2    HA   LEU  83           HA       LEU  83 -27.523 -12.691  -3.163
    3    HB2  LEU  83           HB2      LEU  83 -27.937  -9.782  -2.522
    4    HB3  LEU  83           HB3      LEU  83 -27.942 -10.426  -4.163
    5    HG   LEU  83           HG       LEU  83 -30.013 -10.808  -2.021
    6   HD13  LEU  83          HD11      LEU  83 -30.746  -8.958  -3.098
    7   HD12  LEU  83          HD12      LEU  83 -31.190 -10.070  -4.391
    8   HD11  LEU  83          HD13      LEU  83 -29.653  -9.209  -4.457
    9   HD23  LEU  83          HD21      LEU  83 -30.110 -12.066  -4.748
   10   HD22  LEU  83          HD22      LEU  83 -31.105 -12.412  -3.335
   11   HD21  LEU  83          HD23      LEU  83 -29.417 -12.921  -3.371

  No H/Q in entry =          11
  In of MODEL    8
    1    H    TYR  84           H        TYR  84 -25.592 -10.311  -1.454
    2    HA   TYR  84           HA       TYR  84 -23.693  -9.828  -3.553
    3    HB2  TYR  84           HB2      TYR  84 -24.233  -8.333  -1.553
    4    HB3  TYR  84           HB3      TYR  84 -23.257  -9.442  -0.593
    5    HD1  TYR  84           HD1      TYR  84 -20.877  -9.364  -0.653
    6    HD2  TYR  84           HD2      TYR  84 -23.158  -7.007  -3.389
    7    HE1  TYR  84           HE1      TYR  84 -18.820  -8.165  -1.317
    8    HE2  TYR  84           HE2      TYR  84 -21.108  -5.809  -4.069
    9    HH   TYR  84           HH       TYR  84 -18.870  -5.727  -3.873

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLY  85           H        GLY  85 -23.509 -11.832  -0.603
    2    HA3  GLY  85           HA2      GLY  85 -20.926 -12.783  -1.042
    3    HA2  GLY  85           HA3      GLY  85 -22.175 -13.626  -0.125

  No H/Q in entry =           3
  In of MODEL    8
    1    H    LYS  86           H        LYS  86 -23.987 -13.993  -2.217
    2    HA   LYS  86           HA       LYS  86 -22.919 -16.371  -3.458
    3    HB2  LYS  86           HB2      LYS  86 -25.504 -15.002  -3.064
    4    HB3  LYS  86           HB3      LYS  86 -25.374 -15.968  -4.533
    5    HG2  LYS  86           HG2      LYS  86 -26.422 -17.230  -2.793
    6    HG3  LYS  86           HG3      LYS  86 -24.843 -17.920  -3.166
    7    HD2  LYS  86           HD2      LYS  86 -23.848 -16.745  -1.282
    8    HD3  LYS  86           HD3      LYS  86 -25.386 -15.955  -0.935
    9    HE2  LYS  86           HE2      LYS  86 -25.168 -17.763   0.596
   10    HE3  LYS  86           HE3      LYS  86 -26.367 -18.245  -0.604
   11    HZ3  LYS  86           HZ1      LYS  86 -24.932 -19.716  -1.591
   12    HZ2  LYS  86           HZ2      LYS  86 -24.441 -19.849   0.031
   13    HZ1  LYS  86           HZ3      LYS  86 -23.538 -18.906  -1.054

  No H/Q in entry =          13
  In of MODEL    8
    1    H    VAL  87           H        VAL  87 -22.884 -13.156  -4.352
    2    HA   VAL  87           HA       VAL  87 -22.550 -11.983  -6.287
    3    HB   VAL  87           HB       VAL  87 -21.461 -14.509  -7.573
    4   HG13  VAL  87          HG11      VAL  87 -20.132 -13.031  -8.834
    5   HG12  VAL  87          HG12      VAL  87 -20.316 -11.722  -7.666
    6   HG11  VAL  87          HG13      VAL  87 -21.666 -12.174  -8.707
    7   HG22  VAL  87          HG21      VAL  87 -19.315 -14.137  -6.514
    8   HG21  VAL  87          HG22      VAL  87 -20.552 -14.429  -5.293
    9   HG23  VAL  87          HG23      VAL  87 -19.978 -12.790  -5.591

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ASP  88           H        ASP  88 -25.072 -12.619  -5.978
    2    HA   ASP  88           HA       ASP  88 -26.157 -13.832  -8.393
    3    HB2  ASP  88           HB2      ASP  88 -27.191 -14.074  -6.086
    4    HB3  ASP  88           HB3      ASP  88 -27.639 -12.372  -6.193

  No H/Q in entry =           4
  In of MODEL    8
    1    H    GLY  89           H        GLY  89 -25.422 -12.577 -10.023
    2    HA3  GLY  89           HA2      GLY  89 -25.594  -9.804 -10.228
    3    HA2  GLY  89           HA3      GLY  89 -25.550 -10.925 -11.587

  No H/Q in entry =           3
  In of MODEL    8
    1    H    LEU  90           H        LEU  90 -28.007 -12.271 -11.179
    2    HA   LEU  90           HA       LEU  90 -29.795 -10.332 -12.323
    3    HB2  LEU  90           HB2      LEU  90 -29.856 -12.729 -12.903
    4    HB3  LEU  90           HB3      LEU  90 -30.389 -13.093 -11.262
    5    HG   LEU  90           HG       LEU  90 -32.499 -11.972 -11.660
    6   HD13  LEU  90          HD11      LEU  90 -32.292 -10.232 -13.132
    7   HD12  LEU  90          HD12      LEU  90 -32.816 -11.468 -14.278
    8   HD11  LEU  90          HD13      LEU  90 -31.103 -11.077 -14.126
    9   HD23  LEU  90          HD21      LEU  90 -32.394 -13.603 -14.093
   10   HD22  LEU  90          HD22      LEU  90 -33.397 -13.764 -12.652
   11   HD21  LEU  90          HD23      LEU  90 -31.744 -14.380 -12.650

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLY  91           H        GLY  91 -29.681 -11.833  -9.136
    2    HA3  GLY  91           HA2      GLY  91 -32.035 -10.715  -8.134
    3    HA2  GLY  91           HA3      GLY  91 -30.659 -11.251  -7.169

  No H/Q in entry =           3
  In of MODEL    8
    1    H    VAL  92           H        VAL  92 -28.724  -9.427  -7.994
    2    HA   VAL  92           HA       VAL  92 -29.535  -7.124  -6.460
    3    HB   VAL  92           HB       VAL  92 -26.965  -7.600  -8.014
    4   HG12  VAL  92          HG11      VAL  92 -27.162  -5.713  -5.692
    5   HG11  VAL  92          HG12      VAL  92 -27.801  -5.169  -7.244
    6   HG13  VAL  92          HG13      VAL  92 -26.109  -5.641  -7.105
    7   HG22  VAL  92          HG21      VAL  92 -26.770  -9.187  -6.418
    8   HG21  VAL  92          HG22      VAL  92 -27.931  -8.404  -5.344
    9   HG23  VAL  92          HG23      VAL  92 -26.274  -7.807  -5.438

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LEU  93           H        LEU  93 -29.074  -7.788  -9.873
    2    HA   LEU  93           HA       LEU  93 -29.399  -5.153 -10.810
    3    HB2  LEU  93           HB2      LEU  93 -28.738  -7.009 -12.259
    4    HB3  LEU  93           HB3      LEU  93 -30.334  -7.734 -12.062
    5    HG   LEU  93           HG       LEU  93 -31.324  -5.770 -13.203
    6   HD11  LEU  93          HD11      LEU  93 -29.479  -4.177 -12.670
    7   HD13  LEU  93          HD12      LEU  93 -29.891  -4.207 -14.385
    8   HD12  LEU  93          HD13      LEU  93 -28.449  -5.045 -13.811
    9   HD23  LEU  93          HD21      LEU  93 -30.250  -6.340 -15.473
   10   HD22  LEU  93          HD22      LEU  93 -31.108  -7.594 -14.580
   11   HD21  LEU  93          HD23      LEU  93 -29.345  -7.542 -14.554

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LYS  94           H        LYS  94 -31.793  -7.694  -9.997
    2    HA   LYS  94           HA       LYS  94 -34.125  -6.248 -10.660
    3    HB2  LYS  94           HB2      LYS  94 -33.647  -8.434  -8.639
    4    HB3  LYS  94           HB3      LYS  94 -35.238  -7.735  -8.932
    5    HG2  LYS  94           HG2      LYS  94 -35.116  -8.512 -11.264
    6    HG3  LYS  94           HG3      LYS  94 -33.562  -9.266 -10.911
    7    HD2  LYS  94           HD2      LYS  94 -34.714 -10.597  -9.103
    8    HD3  LYS  94           HD3      LYS  94 -36.247  -9.947  -9.684
    9    HE2  LYS  94           HE2      LYS  94 -35.697 -10.878 -11.942
   10    HE3  LYS  94           HE3      LYS  94 -34.295 -11.663 -11.215
   11    HZ3  LYS  94           HZ1      LYS  94 -36.145 -13.181 -11.414
   12    HZ2  LYS  94           HZ2      LYS  94 -37.132 -12.153 -10.488
   13    HZ1  LYS  94           HZ3      LYS  94 -35.784 -12.904  -9.778

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ALA  95           H        ALA  95 -32.350  -6.371  -7.582
    2    HA   ALA  95           HA       ALA  95 -34.220  -4.788  -6.133
    3    HB2  ALA  95           HB1      ALA  95 -31.856  -6.166  -5.558
    4    HB3  ALA  95           HB2      ALA  95 -32.850  -5.259  -4.420
    5    HB1  ALA  95           HB3      ALA  95 -31.488  -4.475  -5.220

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA  96           H        ALA  96 -31.543  -3.939  -8.188
    2    HA   ALA  96           HA       ALA  96 -31.453  -1.178  -7.414
    3    HB2  ALA  96           HB1      ALA  96 -30.057  -0.955  -9.501
    4    HB3  ALA  96           HB2      ALA  96 -30.359  -2.662  -9.825
    5    HB1  ALA  96           HB3      ALA  96 -29.466  -2.183  -8.382

  No H/Q in entry =           5
  In of MODEL    8
    1    H    VAL  97           H        VAL  97 -32.946  -2.890 -10.124
    2    HA   VAL  97           HA       VAL  97 -33.991  -0.587 -11.396
    3    HB   VAL  97           HB       VAL  97 -34.807  -3.511 -11.451
    4   HG11  VAL  97          HG11      VAL  97 -36.586  -1.499 -11.965
    5   HG13  VAL  97          HG12      VAL  97 -36.637  -3.092 -12.723
    6   HG12  VAL  97          HG13      VAL  97 -35.867  -1.745 -13.558
    7   HG21  VAL  97          HG21      VAL  97 -33.491  -1.686 -13.466
    8   HG23  VAL  97          HG22      VAL  97 -33.944  -3.365 -13.762
    9   HG22  VAL  97          HG23      VAL  97 -32.713  -2.982 -12.558

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ALA  98           H        ALA  98 -35.220  -2.762  -8.879
    2    HA   ALA  98           HA       ALA  98 -37.781  -1.605  -8.568
    3    HB1  ALA  98           HB1      ALA  98 -36.792  -3.808  -7.520
    4    HB3  ALA  98           HB2      ALA  98 -37.983  -2.880  -6.607
    5    HB2  ALA  98           HB3      ALA  98 -36.269  -2.737  -6.221

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA  99           H        ALA  99 -34.727  -0.818  -6.872
    2    HA   ALA  99           HA       ALA  99 -35.874   1.170  -5.229
    3    HB1  ALA  99           HB1      ALA  99 -33.218   0.270  -5.934
    4    HB2  ALA  99           HB2      ALA  99 -33.789   1.023  -4.444
    5    HB3  ALA  99           HB3      ALA  99 -33.287   2.028  -5.804

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ILE 100           H        ILE 100 -34.780   1.298  -8.567
    2    HA   ILE 100           HA       ILE 100 -34.943   4.147  -8.788
    3    HB   ILE 100           HB       ILE 100 -35.014   1.993 -10.929
    4   HG12  ILE 100          HG12      ILE 100 -32.853   3.976 -10.224
    5   HG13  ILE 100          HG13      ILE 100 -32.906   2.328  -9.594
    6   HG21  ILE 100          HG21      ILE 100 -35.422   4.915 -11.065
    7   HG23  ILE 100          HG22      ILE 100 -35.916   3.649 -12.189
    8   HG22  ILE 100          HG23      ILE 100 -34.260   4.257 -12.218
    9   HD12  ILE 100          HD11      ILE 100 -32.327   3.284 -12.360
   10   HD11  ILE 100          HD12      ILE 100 -32.999   1.673 -12.116
   11   HD13  ILE 100          HD13      ILE 100 -31.462   2.108 -11.372

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LYS 101           H        LYS 101 -37.237   1.549  -9.552
    2    HA   LYS 101           HA       LYS 101 -39.295   3.208 -10.583
    3    HB2  LYS 101           HB2      LYS 101 -39.210   0.432  -9.456
    4    HB3  LYS 101           HB3      LYS 101 -40.752   1.202  -9.825
    5    HG2  LYS 101           HG2      LYS 101 -40.241   1.335 -12.114
    6    HG3  LYS 101           HG3      LYS 101 -38.552   0.922 -11.833
    7    HD2  LYS 101           HD2      LYS 101 -39.797  -0.979 -12.740
    8    HD3  LYS 101           HD3      LYS 101 -39.197  -1.314 -11.116
    9    HE2  LYS 101           HE2      LYS 101 -41.270  -1.999 -10.642
   10    HE3  LYS 101           HE3      LYS 101 -41.719  -0.293 -10.651
   11    HZ3  LYS 101           HZ1      LYS 101 -42.577  -0.445 -12.783
   12    HZ2  LYS 101           HZ2      LYS 101 -43.056  -1.916 -12.084
   13    HZ1  LYS 101           HZ3      LYS 101 -41.733  -1.873 -13.147

  No H/Q in entry =          13
  In of MODEL    8
    1    H    LYS 102           H        LYS 102 -38.861   1.726  -7.368
    2    HA   LYS 102           HA       LYS 102 -41.122   2.931  -6.205
    3    HB2  LYS 102           HB2      LYS 102 -39.910   1.058  -5.172
    4    HB3  LYS 102           HB3      LYS 102 -38.518   2.107  -4.905
    5    HG2  LYS 102           HG2      LYS 102 -39.852   3.505  -3.428
    6    HG3  LYS 102           HG3      LYS 102 -41.247   2.461  -3.697
    7    HD2  LYS 102           HD2      LYS 102 -40.046   0.588  -2.653
    8    HD3  LYS 102           HD3      LYS 102 -38.652   1.635  -2.383
    9    HE2  LYS 102           HE2      LYS 102 -40.021   3.117  -0.994
   10    HE3  LYS 102           HE3      LYS 102 -41.433   2.102  -1.286
   11    HZ1  LYS 102           HZ1      LYS 102 -39.736   0.339  -0.257
   12    HZ3  LYS 102           HZ2      LYS 102 -40.857   1.229   0.656
   13    HZ2  LYS 102           HZ3      LYS 102 -39.243   1.745   0.555

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ALA 103           H        ALA 103 -38.145   4.309  -7.169
    2    HA   ALA 103           HA       ALA 103 -38.385   6.623  -5.388
    3    HB2  ALA 103           HB1      ALA 103 -36.365   7.349  -6.931
    4    HB3  ALA 103           HB2      ALA 103 -36.331   5.632  -7.330
    5    HB1  ALA 103           HB3      ALA 103 -36.128   6.153  -5.658

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA 104           H        ALA 104 -38.955   5.898  -8.745
    2    HA   ALA 104           HA       ALA 104 -39.517   8.686  -9.373
    3    HB2  ALA 104           HB1      ALA 104 -39.528   8.021 -11.576
    4    HB1  ALA 104           HB2      ALA 104 -40.269   6.463 -11.212
    5    HB3  ALA 104           HB3      ALA 104 -38.550   6.717 -10.905

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA 105           H        ALA 105 -41.165   6.588  -7.597
    2    HA   ALA 105           HA       ALA 105 -43.583   7.993  -7.608
    3    HB2  ALA 105           HB1      ALA 105 -44.298   7.139  -9.659
    4    HB3  ALA 105           HB2      ALA 105 -44.959   5.952  -8.534
    5    HB1  ALA 105           HB3      ALA 105 -43.476   5.597  -9.420

  No H/Q in entry =           5
  In of MODEL    9
    1    H1   ALA   1           H3       ALA   1 -12.318 -15.623  -2.416
    2    H2   ALA   1           H2       ALA   1 -11.383 -16.772  -3.253
    3    H3   ALA   1           H1       ALA   1 -12.518 -15.821  -4.090
    4    HA   ALA   1           HA       ALA   1 -13.929 -17.511  -3.851
    5    HB3  ALA   1           HB1      ALA   1 -12.546 -19.292  -3.384
    6    HB1  ALA   1           HB2      ALA   1 -13.305 -19.172  -1.797
    7    HB2  ALA   1           HB3      ALA   1 -11.723 -18.443  -2.075

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLU   2           H        GLU   2 -15.561 -18.353  -2.199
    2    HA   GLU   2           HA       GLU   2 -17.200 -16.620  -1.146
    3    HB2  GLU   2           HB2      GLU   2 -16.280 -19.050   0.404
    4    HB3  GLU   2           HB3      GLU   2 -17.799 -18.189   0.654
    5    HG2  GLU   2           HG2      GLU   2 -18.782 -19.271  -1.081
    6    HG3  GLU   2           HG3      GLU   2 -17.454 -18.880  -2.164

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLU   3           H        GLU   3 -15.302 -17.983   1.483
    2    HA   GLU   3           HA       GLU   3 -15.510 -15.626   3.037
    3    HB2  GLU   3           HB2      GLU   3 -13.943 -18.183   3.294
    4    HB3  GLU   3           HB3      GLU   3 -13.705 -16.864   4.440
    5    HG2  GLU   3           HG2      GLU   3 -15.901 -16.999   5.254
    6    HG3  GLU   3           HG3      GLU   3 -16.499 -17.797   3.804

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LEU   4           H        LEU   4 -12.563 -17.127   1.654
    2    HA   LEU   4           HA       LEU   4 -10.717 -15.235   2.254
    3    HB2  LEU   4           HB2      LEU   4 -10.951 -16.535  -0.470
    4    HB3  LEU   4           HB3      LEU   4  -9.495 -15.824   0.217
    5    HG   LEU   4           HG       LEU   4 -11.008 -18.209   1.329
    6   HD13  LEU   4          HD11      LEU   4  -9.383 -19.577   0.405
    7   HD12  LEU   4          HD12      LEU   4  -8.165 -18.303   0.380
    8   HD11  LEU   4          HD13      LEU   4  -9.451 -18.317  -0.826
    9   HD23  LEU   4          HD21      LEU   4  -8.760 -18.286   2.716
   10   HD22  LEU   4          HD22      LEU   4 -10.075 -17.237   3.241
   11   HD21  LEU   4          HD23      LEU   4  -8.706 -16.559   2.361

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLU   5           H        GLU   5 -13.044 -15.016  -0.426
    2    HA   GLU   5           HA       GLU   5 -12.022 -12.540  -1.427
    3    HB2  GLU   5           HB2      GLU   5 -13.372 -14.112  -2.796
    4    HB3  GLU   5           HB3      GLU   5 -14.772 -13.754  -1.784
    5    HG2  GLU   5           HG2      GLU   5 -14.642 -11.382  -2.415
    6    HG3  GLU   5           HG3      GLU   5 -13.221 -11.715  -3.404

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLU   6           H        GLU   6 -14.757 -13.397   0.660
    2    HA   GLU   6           HA       GLU   6 -15.644 -10.713   1.054
    3    HB2  GLU   6           HB2      GLU   6 -17.077 -12.707   1.452
    4    HB3  GLU   6           HB3      GLU   6 -16.059 -13.136   2.826
    5    HG2  GLU   6           HG2      GLU   6 -17.960 -11.928   3.687
    6    HG3  GLU   6           HG3      GLU   6 -16.563 -10.861   3.798

  No H/Q in entry =           6
  In of MODEL    9
    1    H    VAL   7           H        VAL   7 -13.355 -12.838   2.633
    2    HA   VAL   7           HA       VAL   7 -12.883 -11.263   4.959
    3    HB   VAL   7           HB       VAL   7 -11.190 -13.321   3.516
    4   HG11  VAL   7          HG11      VAL   7 -10.717 -11.788   6.079
    5   HG13  VAL   7          HG12      VAL   7  -9.615 -12.012   4.722
    6   HG12  VAL   7          HG13      VAL   7  -9.981 -13.365   5.792
    7   HG21  VAL   7          HG21      VAL   7 -13.448 -13.868   4.732
    8   HG23  VAL   7          HG22      VAL   7 -12.522 -13.598   6.209
    9   HG22  VAL   7          HG23      VAL   7 -12.036 -14.863   5.082

  No H/Q in entry =           9
  In of MODEL    9
    1    H    VAL   8           H        VAL   8 -11.365 -11.393   1.753
    2    HA   VAL   8           HA       VAL   8  -9.290  -9.534   2.248
    3    HB   VAL   8           HB       VAL   8 -10.752 -10.216  -0.314
    4   HG12  VAL   8          HG11      VAL   8  -8.593  -9.224  -1.326
    5   HG11  VAL   8          HG12      VAL   8  -8.359  -8.458   0.247
    6   HG13  VAL   8          HG13      VAL   8  -9.793  -8.086  -0.710
    7   HG22  VAL   8          HG21      VAL   8  -9.244 -11.943  -0.560
    8   HG21  VAL   8          HG22      VAL   8  -9.081 -11.801   1.187
    9   HG23  VAL   8          HG23      VAL   8  -7.916 -11.009   0.130

  No H/Q in entry =           9
  In of MODEL    9
    1    H    MET   9           H        MET   9 -12.630  -9.122   1.080
    2    HA   MET   9           HA       MET   9 -12.546  -6.347   0.642
    3    HB2  MET   9           HB2      MET   9 -14.768  -8.217   1.452
    4    HB3  MET   9           HB3      MET   9 -15.045  -6.483   1.267
    5    HG2  MET   9           HG2      MET   9 -14.175  -6.600  -1.047
    6    HG3  MET   9           HG3      MET   9 -13.938  -8.338  -0.861
    7    HE3  MET   9           HE1      MET   9 -17.847  -5.976  -0.908
    8    HE2  MET   9           HE2      MET   9 -16.552  -5.644  -2.056
    9    HE1  MET   9           HE3      MET   9 -16.252  -5.475  -0.328

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLY  10           H        GLY  10 -13.229  -8.229   3.570
    2    HA3  GLY  10           HA2      GLY  10 -13.766  -6.039   5.285
    3    HA2  GLY  10           HA3      GLY  10 -13.214  -7.631   5.802

  No H/Q in entry =           3
  In of MODEL    9
    1    H    LEU  11           H        LEU  11 -10.766  -7.773   4.493
    2    HA   LEU  11           HA       LEU  11  -9.060  -6.349   6.252
    3    HB2  LEU  11           HB2      LEU  11  -8.517  -7.779   3.648
    4    HB3  LEU  11           HB3      LEU  11  -7.244  -7.082   4.648
    5    HG   LEU  11           HG       LEU  11  -9.262  -9.100   5.663
    6   HD13  LEU  11          HD11      LEU  11  -8.045 -10.347   4.103
    7   HD12  LEU  11          HD12      LEU  11  -7.115 -10.590   5.581
    8   HD11  LEU  11          HD13      LEU  11  -6.564  -9.430   4.373
    9   HD22  LEU  11          HD21      LEU  11  -8.407  -8.090   7.580
   10   HD21  LEU  11          HD22      LEU  11  -6.865  -7.700   6.820
   11   HD23  LEU  11          HD23      LEU  11  -7.202  -9.353   7.331

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  12           H        ILE  12  -9.950  -5.800   2.859
    2    HA   ILE  12           HA       ILE  12  -8.243  -3.582   2.434
    3    HB   ILE  12           HB       ILE  12 -10.899  -4.237   1.133
    4   HG12  ILE  12          HG12      ILE  12  -8.869  -5.901   1.066
    5   HG13  ILE  12          HG13      ILE  12  -9.729  -5.545  -0.417
    6   HG21  ILE  12          HG21      ILE  12  -8.654  -2.373   0.292
    7   HG23  ILE  12          HG22      ILE  12 -10.305  -1.913   0.688
    8   HG22  ILE  12          HG23      ILE  12  -9.969  -2.863  -0.731
    9   HD12  ILE  12          HD11      ILE  12  -7.228  -5.506  -0.633
   10   HD11  ILE  12          HD12      ILE  12  -7.201  -4.144   0.485
   11   HD13  ILE  12          HD13      ILE  12  -7.987  -3.986  -1.068

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  13           H        ILE  13 -11.608  -3.827   3.519
    2    HA   ILE  13           HA       ILE  13 -12.052  -1.037   3.784
    3    HB   ILE  13           HB       ILE  13 -13.275  -3.449   5.143
    4   HG12  ILE  13          HG12      ILE  13 -13.489  -2.883   2.603
    5   HG13  ILE  13          HG13      ILE  13 -14.911  -3.365   3.503
    6   HG22  ILE  13          HG21      ILE  13 -15.160  -1.806   5.713
    7   HG21  ILE  13          HG22      ILE  13 -14.004  -0.517   5.401
    8   HG23  ILE  13          HG23      ILE  13 -13.699  -1.681   6.689
    9   HD12  ILE  13          HD11      ILE  13 -15.250  -1.332   2.031
   10   HD11  ILE  13          HD12      ILE  13 -14.119  -0.496   3.078
   11   HD13  ILE  13          HD13      ILE  13 -15.630  -1.079   3.738

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ASN  14           H        ASN  14 -10.961  -3.530   6.065
    2    HA   ASN  14           HA       ASN  14 -10.757  -1.890   8.348
    3    HB2  ASN  14           HB2      ASN  14 -10.518  -4.499   8.031
    4    HB3  ASN  14           HB3      ASN  14  -8.806  -4.122   7.878
    5   HD21  ASN  14          HD21      ASN  14  -9.457  -5.640  10.054
    6   HD22  ASN  14          HD22      ASN  14  -9.427  -4.717  11.477

  No H/Q in entry =           6
  In of MODEL    9
    1    H    SER  15           H        SER  15  -8.353  -2.730   5.864
    2    HA   SER  15           HA       SER  15  -6.204  -1.247   6.939
    3    HB2  SER  15           HB2      SER  15  -5.182  -1.467   4.780
    4    HB3  SER  15           HB3      SER  15  -6.137  -2.926   5.011
    5    HG   SER  15           HG       SER  15  -7.367  -2.348   3.417

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLY  16           H        GLY  16  -8.795  -0.371   4.684
    2    HA3  GLY  16           HA2      GLY  16  -7.923   2.265   4.131
    3    HA2  GLY  16           HA3      GLY  16  -9.576   1.678   3.966

  No H/Q in entry =           3
  In of MODEL    9
    1    H    GLN  17           H        GLN  17 -10.129   0.960   6.615
    2    HA   GLN  17           HA       GLN  17 -10.828   3.469   7.750
    3    HB2  GLN  17           HB2      GLN  17 -10.744   0.688   8.937
    4    HB3  GLN  17           HB3      GLN  17 -11.367   2.094   9.801
    5    HG2  GLN  17           HG2      GLN  17 -12.383   1.146   7.106
    6    HG3  GLN  17           HG3      GLN  17 -13.163   0.797   8.648
    7   HE21  GLN  17          HE21      GLN  17 -13.606   2.755   6.102
    8   HE22  GLN  17          HE22      GLN  17 -14.182   4.154   6.872

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ALA  18           H        ALA  18  -8.211   1.177   8.380
    2    HA   ALA  18           HA       ALA  18  -7.114   2.392  10.651
    3    HB2  ALA  18           HB1      ALA  18  -6.510   0.171   9.289
    4    HB3  ALA  18           HB2      ALA  18  -5.347   0.951  10.362
    5    HB1  ALA  18           HB3      ALA  18  -5.264   1.226   8.621

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ARG  19           H        ARG  19  -6.331   2.907   7.204
    2    HA   ARG  19           HA       ARG  19  -4.426   4.947   7.634
    3    HB2  ARG  19           HB2      ARG  19  -4.752   3.804   5.440
    4    HB3  ARG  19           HB3      ARG  19  -6.291   4.651   5.258
    5    HG2  ARG  19           HG2      ARG  19  -5.154   6.818   5.325
    6    HG3  ARG  19           HG3      ARG  19  -3.609   6.027   5.635
    7    HD2  ARG  19           HD2      ARG  19  -3.725   6.614   3.291
    8    HD3  ARG  19           HD3      ARG  19  -3.817   4.854   3.439
    9    HE   ARG  19           HE       ARG  19  -6.447   5.774   3.423
   10   HH21  ARG  19          HH11      ARG  19  -7.637   5.931   1.501
   11   HH22  ARG  19          HH12      ARG  19  -6.811   6.003  -0.016
   12   HH11  ARG  19          HH21      ARG  19  -3.666   5.823   1.396
   13   HH12  ARG  19          HH22      ARG  19  -4.561   5.939  -0.076

  No H/Q in entry =          13
  In of MODEL    9
    1    H    SER  20           H        SER  20  -7.922   5.074   7.025
    2    HA   SER  20           HA       SER  20  -8.269   7.831   6.971
    3    HB2  SER  20           HB2      SER  20 -10.149   6.494   6.431
    4    HB3  SER  20           HB3      SER  20 -10.049   5.606   7.950
    5    HG   SER  20           HG       SER  20 -10.466   8.402   7.841

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU  21           H        LEU  21  -8.284   5.653   9.779
    2    HA   LEU  21           HA       LEU  21  -8.724   7.654  11.739
    3    HB2  LEU  21           HB2      LEU  21  -7.380   4.949  11.908
    4    HB3  LEU  21           HB3      LEU  21  -7.692   5.969  13.309
    5    HG   LEU  21           HG       LEU  21  -9.859   5.083  11.382
    6   HD11  LEU  21          HD11      LEU  21  -8.958   3.859  14.004
    7   HD13  LEU  21          HD12      LEU  21  -8.927   3.095  12.415
    8   HD12  LEU  21          HD13      LEU  21 -10.471   3.456  13.191
    9   HD22  LEU  21          HD21      LEU  21 -10.800   6.865  12.545
   10   HD21  LEU  21          HD22      LEU  21  -9.791   6.624  13.968
   11   HD23  LEU  21          HD23      LEU  21 -11.163   5.566  13.678

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ALA  22           H        ALA  22  -5.772   6.269  10.342
    2    HA   ALA  22           HA       ALA  22  -3.893   7.580  11.967
    3    HB2  ALA  22           HB1      ALA  22  -3.477   5.721  10.280
    4    HB1  ALA  22           HB2      ALA  22  -2.278   7.014  10.317
    5    HB3  ALA  22           HB3      ALA  22  -3.492   6.972   9.037

  No H/Q in entry =           5
  In of MODEL    9
    1    H    TYR  23           H        TYR  23  -5.198   8.595   8.779
    2    HA   TYR  23           HA       TYR  23  -3.854  11.087   8.708
    3    HB2  TYR  23           HB2      TYR  23  -4.931  10.176   6.715
    4    HB3  TYR  23           HB3      TYR  23  -6.511  10.286   7.491
    5    HD1  TYR  23           HD1      TYR  23  -3.598  12.332   6.367
    6    HD2  TYR  23           HD2      TYR  23  -7.754  12.290   7.446
    7    HE1  TYR  23           HE1      TYR  23  -3.817  14.681   5.605
    8    HE2  TYR  23           HE2      TYR  23  -7.975  14.640   6.683
    9    HH   TYR  23           HH       TYR  23  -5.672  16.688   6.349

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ALA  24           H        ALA  24  -6.980  10.121  10.080
    2    HA   ALA  24           HA       ALA  24  -7.812  12.714  10.844
    3    HB1  ALA  24           HB1      ALA  24  -9.635  11.469  11.308
    4    HB2  ALA  24           HB2      ALA  24  -8.815  10.898  12.760
    5    HB3  ALA  24           HB3      ALA  24  -8.688   9.983  11.258

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA  25           H        ALA  25  -5.821  10.253  12.429
    2    HA   ALA  25           HA       ALA  25  -5.488  11.509  14.929
    3    HB2  ALA  25           HB1      ALA  25  -4.725   9.154  14.115
    4    HB3  ALA  25           HB2      ALA  25  -3.711  10.011  15.277
    5    HB1  ALA  25           HB3      ALA  25  -3.270   9.990  13.569

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU  26           H        LEU  26  -3.687  11.798  11.894
    2    HA   LEU  26           HA       LEU  26  -1.726  13.613  12.813
    3    HB2  LEU  26           HB2      LEU  26  -1.421  12.457  10.712
    4    HB3  LEU  26           HB3      LEU  26  -2.890  13.168  10.051
    5    HG   LEU  26           HG       LEU  26  -1.869  15.416  10.186
    6   HD12  LEU  26          HD11      LEU  26   0.668  15.429  10.608
    7   HD11  LEU  26          HD12      LEU  26   0.437  13.850  11.354
    8   HD13  LEU  26          HD13      LEU  26  -0.368  15.268  12.026
    9   HD21  LEU  26          HD21      LEU  26  -0.128  13.353   8.800
   10   HD23  LEU  26          HD22      LEU  26  -0.165  15.074   8.426
   11   HD22  LEU  26          HD23      LEU  26  -1.591  14.081   8.136

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LYS  27           H        LYS  27  -4.902  14.103  11.325
    2    HA   LYS  27           HA       LYS  27  -4.837  16.891  11.122
    3    HB2  LYS  27           HB2      LYS  27  -6.583  15.418  10.134
    4    HB3  LYS  27           HB3      LYS  27  -7.245  15.166  11.748
    5    HG2  LYS  27           HG2      LYS  27  -7.668  17.574  11.979
    6    HG3  LYS  27           HG3      LYS  27  -6.954  17.866  10.390
    7    HD2  LYS  27           HD2      LYS  27  -8.688  16.436   9.351
    8    HD3  LYS  27           HD3      LYS  27  -9.407  16.161  10.939
    9    HE2  LYS  27           HE2      LYS  27  -9.843  18.574  11.176
   10    HE3  LYS  27           HE3      LYS  27  -9.095  18.870   9.603
   11    HZ3  LYS  27           HZ1      LYS  27 -11.472  18.753   9.355
   12    HZ2  LYS  27           HZ2      LYS  27 -11.528  17.238  10.127
   13    HZ1  LYS  27           HZ3      LYS  27 -10.778  17.396   8.607

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLN  28           H        GLN  28  -5.741  14.813  13.850
    2    HA   GLN  28           HA       GLN  28  -6.635  16.823  15.620
    3    HB2  GLN  28           HB2      GLN  28  -5.244  14.188  16.172
    4    HB3  GLN  28           HB3      GLN  28  -5.984  15.197  17.415
    5    HG2  GLN  28           HG2      GLN  28  -7.446  14.083  15.003
    6    HG3  GLN  28           HG3      GLN  28  -7.506  13.388  16.622
    7   HE21  GLN  28          HE21      GLN  28  -9.351  15.230  14.650
    8   HE22  GLN  28          HE22      GLN  28 -10.106  16.236  15.790

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ALA  29           H        ALA  29  -3.419  15.513  14.942
    2    HA   ALA  29           HA       ALA  29  -1.980  16.908  16.923
    3    HB1  ALA  29           HB1      ALA  29  -0.050  16.206  15.810
    4    HB3  ALA  29           HB2      ALA  29  -0.799  16.331  14.219
    5    HB2  ALA  29           HB3      ALA  29  -1.230  15.002  15.295

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LYS  30           H        LYS  30  -2.825  17.785  13.589
    2    HA   LYS  30           HA       LYS  30  -1.401  20.218  13.488
    3    HB2  LYS  30           HB2      LYS  30  -3.932  19.356  12.074
    4    HB3  LYS  30           HB3      LYS  30  -3.089  20.865  11.730
    5    HG2  LYS  30           HG2      LYS  30  -1.025  19.559  11.224
    6    HG3  LYS  30           HG3      LYS  30  -1.941  18.069  11.469
    7    HD2  LYS  30           HD2      LYS  30  -3.497  18.716   9.669
    8    HD3  LYS  30           HD3      LYS  30  -2.603  20.218   9.426
    9    HE2  LYS  30           HE2      LYS  30  -0.578  18.912   8.854
   10    HE3  LYS  30           HE3      LYS  30  -1.490  17.415   9.066
   11    HZ2  LYS  30           HZ1      LYS  30  -1.301  18.281   6.724
   12    HZ1  LYS  30           HZ2      LYS  30  -2.338  19.551   7.187
   13    HZ3  LYS  30           HZ3      LYS  30  -2.873  17.937   7.259

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLN  31           H        GLN  31  -4.510  19.388  14.894
    2    HA   GLN  31           HA       GLN  31  -5.256  22.151  15.340
    3    HB2  GLN  31           HB2      GLN  31  -6.456  19.715  16.663
    4    HB3  GLN  31           HB3      GLN  31  -7.204  21.292  16.413
    5    HG2  GLN  31           HG2      GLN  31  -6.492  20.505  13.826
    6    HG3  GLN  31           HG3      GLN  31  -7.030  19.006  14.574
    7   HE21  GLN  31          HE21      GLN  31  -8.423  20.587  12.466
    8   HE22  GLN  31          HE22      GLN  31  -9.936  20.990  13.120

  No H/Q in entry =           8
  In of MODEL    9
    1    H    GLY  32           H        GLY  32  -2.961  20.209  16.668
    2    HA3  GLY  32           HA2      GLY  32  -1.562  20.663  18.473
    3    HA2  GLY  32           HA3      GLY  32  -2.683  21.915  18.993

  No H/Q in entry =           3
  In of MODEL    9
    1    H    ASP  33           H        ASP  33  -4.127  18.885  18.331
    2    HA   ASP  33           HA       ASP  33  -4.548  18.435  21.211
    3    HB2  ASP  33           HB2      ASP  33  -5.956  17.431  18.731
    4    HB3  ASP  33           HB3      ASP  33  -6.310  16.825  20.347

  No H/Q in entry =           4
  In of MODEL    9
    1    H    PHE  34           H        PHE  34  -2.387  17.568  21.523
    2    HA   PHE  34           HA       PHE  34  -1.400  15.309  20.127
    3    HB2  PHE  34           HB2      PHE  34  -0.783  16.292  22.922
    4    HB3  PHE  34           HB3      PHE  34   0.139  15.061  22.058
    5    HD1  PHE  34           HD1      PHE  34  -0.009  18.489  22.789
    6    HD2  PHE  34           HD2      PHE  34   0.808  15.775  19.559
    7    HE1  PHE  34           HE1      PHE  34   1.303  20.249  21.636
    8    HE2  PHE  34           HE2      PHE  34   2.115  17.538  18.411
    9    HZ   PHE  34           HZ       PHE  34   2.365  19.772  19.454

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ALA  35           H        ALA  35  -3.445  15.605  22.985
    2    HA   ALA  35           HA       ALA  35  -3.256  12.943  23.885
    3    HB3  ALA  35           HB1      ALA  35  -5.711  13.589  24.735
    4    HB1  ALA  35           HB2      ALA  35  -5.164  15.203  24.279
    5    HB2  ALA  35           HB3      ALA  35  -4.260  14.273  25.473

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA  36           H        ALA  36  -5.689  14.476  21.777
    2    HA   ALA  36           HA       ALA  36  -7.122  12.075  21.299
    3    HB1  ALA  36           HB1      ALA  36  -8.564  13.508  20.338
    4    HB3  ALA  36           HB2      ALA  36  -7.385  13.918  19.091
    5    HB2  ALA  36           HB3      ALA  36  -7.407  14.807  20.614

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA  37           H        ALA  37  -4.425  13.640  19.635
    2    HA   ALA  37           HA       ALA  37  -4.397  12.001  17.340
    3    HB3  ALA  37           HB1      ALA  37  -2.395  13.699  18.765
    4    HB2  ALA  37           HB2      ALA  37  -2.921  13.757  17.084
    5    HB1  ALA  37           HB3      ALA  37  -1.778  12.519  17.609

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LYS  38           H        LYS  38  -2.650  11.685  20.422
    2    HA   LYS  38           HA       LYS  38  -1.342   9.274  19.939
    3    HB2  LYS  38           HB2      LYS  38  -1.657  11.042  22.082
    4    HB3  LYS  38           HB3      LYS  38  -2.289   9.518  22.699
    5    HG2  LYS  38           HG2      LYS  38  -0.202   8.380  22.168
    6    HG3  LYS  38           HG3      LYS  38   0.420   9.820  21.355
    7    HD2  LYS  38           HD2      LYS  38   0.593  11.039  23.389
    8    HD3  LYS  38           HD3      LYS  38  -0.437   9.898  24.255
    9    HE2  LYS  38           HE2      LYS  38   1.914   9.565  24.880
   10    HE3  LYS  38           HE3      LYS  38   1.301   8.152  24.016
   11    HZ3  LYS  38           HZ1      LYS  38   2.609   8.559  22.237
   12    HZ2  LYS  38           HZ2      LYS  38   3.568   9.381  23.375
   13    HZ1  LYS  38           HZ3      LYS  38   2.498  10.248  22.380

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ALA  39           H        ALA  39  -4.580   9.796  21.333
    2    HA   ALA  39           HA       ALA  39  -5.163   7.082  21.839
    3    HB3  ALA  39           HB1      ALA  39  -7.304   9.042  21.065
    4    HB2  ALA  39           HB2      ALA  39  -6.408   9.264  22.568
    5    HB1  ALA  39           HB3      ALA  39  -7.336   7.786  22.304

  No H/Q in entry =           5
  In of MODEL    9
    1    H    MET  40           H        MET  40  -5.725   9.096  18.989
    2    HA   MET  40           HA       MET  40  -7.213   7.174  17.527
    3    HB2  MET  40           HB2      MET  40  -5.582   9.556  16.624
    4    HB3  MET  40           HB3      MET  40  -6.613   8.603  15.552
    5    HG2  MET  40           HG2      MET  40  -7.644   9.863  18.107
    6    HG3  MET  40           HG3      MET  40  -7.691  10.696  16.555
    7    HE3  MET  40           HE1      MET  40 -10.282   9.094  14.486
    8    HE2  MET  40           HE2      MET  40  -8.528   9.198  14.342
    9    HE1  MET  40           HE3      MET  40  -9.437  10.571  14.972

  No H/Q in entry =           9
  In of MODEL    9
    1    H    MET  41           H        MET  41  -3.716   7.885  17.658
    2    HA   MET  41           HA       MET  41  -2.966   6.123  15.561
    3    HB2  MET  41           HB2      MET  41  -1.350   6.780  18.037
    4    HB3  MET  41           HB3      MET  41  -0.734   6.126  16.524
    5    HG2  MET  41           HG2      MET  41  -1.872   8.316  15.515
    6    HG3  MET  41           HG3      MET  41  -1.636   8.904  17.159
    7    HE2  MET  41           HE1      MET  41   1.266   6.785  17.530
    8    HE1  MET  41           HE2      MET  41   0.485   8.085  18.425
    9    HE3  MET  41           HE3      MET  41   2.111   8.316  17.786

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ASP  42           H        ASP  42  -3.363   5.656  19.047
    2    HA   ASP  42           HA       ASP  42  -2.346   3.055  19.212
    3    HB2  ASP  42           HB2      ASP  42  -3.212   4.823  21.030
    4    HB3  ASP  42           HB3      ASP  42  -4.646   3.807  20.955

  No H/Q in entry =           4
  In of MODEL    9
    1    H    GLN  43           H        GLN  43  -5.670   4.182  18.702
    2    HA   GLN  43           HA       GLN  43  -6.831   1.602  18.507
    3    HB2  GLN  43           HB2      GLN  43  -7.733   4.260  17.373
    4    HB3  GLN  43           HB3      GLN  43  -8.706   2.787  17.350
    5    HG2  GLN  43           HG2      GLN  43  -8.420   2.667  19.858
    6    HG3  GLN  43           HG3      GLN  43  -7.684   4.266  19.787
    7   HE21  GLN  43          HE21      GLN  43  -9.867   4.363  21.282
    8   HE22  GLN  43          HE22      GLN  43 -11.221   4.947  20.446

  No H/Q in entry =           8
  In of MODEL    9
    1    H    SER  44           H        SER  44  -5.469   3.805  16.096
    2    HA   SER  44           HA       SER  44  -6.175   2.323  13.807
    3    HB2  SER  44           HB2      SER  44  -4.903   4.698  14.252
    4    HB3  SER  44           HB3      SER  44  -3.555   3.692  13.726
    5    HG   SER  44           HG       SER  44  -4.655   4.670  11.959

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ARG  45           H        ARG  45  -3.304   2.192  15.895
    2    HA   ARG  45           HA       ARG  45  -1.833   0.226  14.518
    3    HB2  ARG  45           HB2      ARG  45  -0.987   1.643  16.388
    4    HB3  ARG  45           HB3      ARG  45  -1.988   0.721  17.507
    5    HG2  ARG  45           HG2      ARG  45  -0.769  -1.347  16.869
    6    HG3  ARG  45           HG3      ARG  45   0.256  -0.400  15.793
    7    HD2  ARG  45           HD2      ARG  45   0.995   0.977  17.749
    8    HD3  ARG  45           HD3      ARG  45   0.063  -0.090  18.821
    9    HE   ARG  45           HE       ARG  45   1.755  -1.699  17.247
   10   HH21  ARG  45          HH11      ARG  45   3.647  -2.534  18.090
   11   HH22  ARG  45          HH12      ARG  45   4.422  -1.753  19.423
   12   HH11  ARG  45          HH21      ARG  45   2.069   0.767  19.635
   13   HH12  ARG  45          HH22      ARG  45   3.528   0.119  20.295

  No H/Q in entry =          13
  In of MODEL    9
    1    H    MET  46           H        MET  46  -4.240  -0.075  17.112
    2    HA   MET  46           HA       MET  46  -4.093  -2.875  17.422
    3    HB2  MET  46           HB2      MET  46  -6.249  -0.852  18.016
    4    HB3  MET  46           HB3      MET  46  -6.471  -2.570  18.355
    5    HG2  MET  46           HG2      MET  46  -4.481  -2.581  19.777
    6    HG3  MET  46           HG3      MET  46  -4.165  -0.896  19.391
    7    HE3  MET  46           HE1      MET  46  -7.843  -2.617  20.402
    8    HE2  MET  46           HE2      MET  46  -7.293  -2.781  22.066
    9    HE1  MET  46           HE3      MET  46  -6.353  -3.499  20.761

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ALA  47           H        ALA  47  -6.093  -0.845  15.320
    2    HA   ALA  47           HA       ALA  47  -7.723  -2.885  14.251
    3    HB3  ALA  47           HB1      ALA  47  -8.384  -0.643  13.832
    4    HB1  ALA  47           HB2      ALA  47  -7.896  -1.281  12.262
    5    HB2  ALA  47           HB3      ALA  47  -6.810  -0.220  13.161

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU  48           H        LEU  48  -4.591  -1.601  13.209
    2    HA   LEU  48           HA       LEU  48  -4.316  -3.195  10.869
    3    HB2  LEU  48           HB2      LEU  48  -2.254  -1.932  12.683
    4    HB3  LEU  48           HB3      LEU  48  -1.886  -2.657  11.117
    5    HG   LEU  48           HG       LEU  48  -3.892  -0.423  11.499
    6   HD13  LEU  48          HD11      LEU  48  -1.766   0.437  12.170
    7   HD12  LEU  48          HD12      LEU  48  -2.031   0.991  10.517
    8   HD11  LEU  48          HD13      LEU  48  -0.945  -0.364  10.830
    9   HD22  LEU  48          HD21      LEU  48  -4.366  -1.405   9.423
   10   HD21  LEU  48          HD22      LEU  48  -2.686  -1.854   9.133
   11   HD23  LEU  48          HD23      LEU  48  -3.190  -0.171   8.971

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ASN  49           H        ASN  49  -3.283  -3.598  14.219
    2    HA   ASN  49           HA       ASN  49  -1.699  -5.875  13.895
    3    HB2  ASN  49           HB2      ASN  49  -1.722  -4.537  15.941
    4    HB3  ASN  49           HB3      ASN  49  -3.384  -5.011  16.262
    5   HD21  ASN  49          HD21      ASN  49  -1.415  -5.545  18.180
    6   HD22  ASN  49          HD22      ASN  49  -1.139  -7.218  18.254

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLU  50           H        GLU  50  -5.167  -5.569  14.556
    2    HA   GLU  50           HA       GLU  50  -5.704  -8.364  14.664
    3    HB2  GLU  50           HB2      GLU  50  -7.278  -6.662  15.535
    4    HB3  GLU  50           HB3      GLU  50  -7.561  -6.096  13.887
    5    HG2  GLU  50           HG2      GLU  50  -8.444  -8.285  13.247
    6    HG3  GLU  50           HG3      GLU  50  -8.073  -8.931  14.842

  No H/Q in entry =           6
  In of MODEL    9
    1    H    ALA  51           H        ALA  51  -5.743  -5.967  12.067
    2    HA   ALA  51           HA       ALA  51  -6.738  -7.687  10.043
    3    HB2  ALA  51           HB1      ALA  51  -6.497  -5.877   8.673
    4    HB1  ALA  51           HB2      ALA  51  -4.856  -5.543   9.226
    5    HB3  ALA  51           HB3      ALA  51  -6.238  -5.019  10.190

  No H/Q in entry =           5
  In of MODEL    9
    1    H    HIS  52           H        HIS  52  -3.442  -6.811  11.036
    2    HA   HIS  52           HA       HIS  52  -2.051  -8.315   9.092
    3    HB2  HIS  52           HB2      HIS  52  -1.018  -6.584  10.550
    4    HB3  HIS  52           HB3      HIS  52  -1.179  -7.681  11.921
    5    HD1  HIS  52           HD1      HIS  52   0.270  -9.883  11.866
    6    HD2  HIS  52           HD2      HIS  52   1.105  -7.188   8.796
    7    HE1  HIS  52           HE1      HIS  52   2.466 -10.620  10.844
    8    HE2  HIS  52           HE2      HIS  52   2.989  -8.987   8.970

  No H/Q in entry =           8
  In of MODEL    9
    1    H    LEU  53           H        LEU  53  -3.282  -9.178  12.301
    2    HA   LEU  53           HA       LEU  53  -2.110 -11.734  12.500
    3    HB2  LEU  53           HB2      LEU  53  -4.587 -10.527  13.705
    4    HB3  LEU  53           HB3      LEU  53  -4.145 -12.206  14.000
    5    HG   LEU  53           HG       LEU  53  -2.216  -9.914  14.476
    6   HD12  LEU  53          HD11      LEU  53  -2.835 -10.302  16.922
    7   HD11  LEU  53          HD12      LEU  53  -4.243 -11.181  16.328
    8   HD13  LEU  53          HD13      LEU  53  -4.047  -9.474  15.951
    9   HD21  LEU  53          HD21      LEU  53  -2.305 -12.845  15.216
   10   HD23  LEU  53          HD22      LEU  53  -1.356 -11.705  16.164
   11   HD22  LEU  53          HD23      LEU  53  -0.983 -11.955  14.469

  No H/Q in entry =          11
  In of MODEL    9
    1    H    VAL  54           H        VAL  54  -5.206 -10.673  11.127
    2    HA   VAL  54           HA       VAL  54  -6.145 -13.258  10.439
    3    HB   VAL  54           HB       VAL  54  -6.760 -10.519   9.301
    4   HG12  VAL  54          HG11      VAL  54  -8.873 -11.876   8.483
    5   HG11  VAL  54          HG12      VAL  54  -7.776 -13.253   8.560
    6   HG13  VAL  54          HG13      VAL  54  -7.399 -11.883   7.518
    7   HG22  VAL  54          HG21      VAL  54  -7.674 -10.546  11.449
    8   HG21  VAL  54          HG22      VAL  54  -7.946 -12.287  11.430
    9   HG23  VAL  54          HG23      VAL  54  -9.013 -11.219  10.520

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLN  55           H        GLN  55  -4.242 -10.828   8.654
    2    HA   GLN  55           HA       GLN  55  -4.120 -12.295   6.238
    3    HB2  GLN  55           HB2      GLN  55  -3.491 -10.037   6.049
    4    HB3  GLN  55           HB3      GLN  55  -2.385 -10.125   7.417
    5    HG2  GLN  55           HG2      GLN  55  -0.673 -10.990   6.147
    6    HG3  GLN  55           HG3      GLN  55  -1.754 -11.954   5.150
    7   HE21  GLN  55          HE21      GLN  55  -1.757 -11.265   3.028
    8   HE22  GLN  55          HE22      GLN  55  -1.540  -9.663   2.518

  No H/Q in entry =           8
  In of MODEL    9
    1    H    THR  56           H        THR  56  -2.023 -12.295   9.126
    2    HA   THR  56           HA       THR  56   0.041 -13.917   8.216
    3    HB   THR  56           HB       THR  56  -1.214 -14.150  10.960
    4    HG1  THR  56           HG1      THR  56  -0.156 -12.028   9.733
    5   HG22  THR  56          HG21      THR  56   1.696 -14.330  10.177
    6   HG21  THR  56          HG22      THR  56   0.639 -15.742  10.170
    7   HG23  THR  56          HG23      THR  56   0.932 -14.866  11.672

  No H/Q in entry =           7
  In of MODEL    9
    1    H    LYS  57           H        LYS  57  -3.095 -14.918   9.570
    2    HA   LYS  57           HA       LYS  57  -2.680 -17.719   9.327
    3    HB2  LYS  57           HB2      LYS  57  -4.491 -16.600  10.664
    4    HB3  LYS  57           HB3      LYS  57  -5.275 -16.155   9.156
    5    HG2  LYS  57           HG2      LYS  57  -5.533 -18.519   8.561
    6    HG3  LYS  57           HG3      LYS  57  -4.701 -18.998  10.038
    7    HD2  LYS  57           HD2      LYS  57  -6.487 -17.936  11.385
    8    HD3  LYS  57           HD3      LYS  57  -7.328 -17.479   9.905
    9    HE2  LYS  57           HE2      LYS  57  -8.313 -19.539  10.799
   10    HE3  LYS  57           HE3      LYS  57  -7.485 -19.908   9.288
   11    HZ1  LYS  57           HZ1      LYS  57  -6.354 -20.282  12.007
   12    HZ3  LYS  57           HZ2      LYS  57  -5.579 -20.661  10.544
   13    HZ2  LYS  57           HZ3      LYS  57  -6.970 -21.515  11.016

  No H/Q in entry =          13
  In of MODEL    9
    1    H    LEU  58           H        LEU  58  -3.976 -15.263   7.145
    2    HA   LEU  58           HA       LEU  58  -4.793 -17.080   5.137
    3    HB2  LEU  58           HB2      LEU  58  -4.152 -14.139   5.002
    4    HB3  LEU  58           HB3      LEU  58  -4.822 -15.069   3.660
    5    HG   LEU  58           HG       LEU  58  -6.109 -14.873   6.404
    6   HD11  LEU  58          HD11      LEU  58  -6.382 -13.224   3.910
    7   HD13  LEU  58          HD12      LEU  58  -6.372 -12.716   5.599
    8   HD12  LEU  58          HD13      LEU  58  -7.801 -13.493   4.923
    9   HD22  LEU  58          HD21      LEU  58  -7.090 -16.772   5.532
   10   HD21  LEU  58          HD22      LEU  58  -6.740 -16.325   3.863
   11   HD23  LEU  58          HD23      LEU  58  -8.098 -15.583   4.708

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  59           H        ILE  59  -1.646 -15.905   6.008
    2    HA   ILE  59           HA       ILE  59  -0.548 -16.647   3.376
    3    HB   ILE  59           HB       ILE  59   0.238 -14.589   4.946
    4   HG12  ILE  59          HG12      ILE  59   2.319 -16.262   3.524
    5   HG13  ILE  59          HG13      ILE  59   1.134 -15.316   2.662
    6   HG22  ILE  59          HG21      ILE  59   2.301 -16.658   5.652
    7   HG21  ILE  59          HG22      ILE  59   0.944 -16.373   6.718
    8   HG23  ILE  59          HG23      ILE  59   2.073 -15.071   6.347
    9   HD12  ILE  59          HD11      ILE  59   3.183 -14.285   4.618
   10   HD11  ILE  59          HD12      ILE  59   1.888 -13.293   3.952
   11   HD13  ILE  59          HD13      ILE  59   3.123 -13.963   2.887

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLU  60           H        GLU  60  -0.583 -17.750   6.744
    2    HA   GLU  60           HA       GLU  60   1.426 -19.751   6.488
    3    HB2  GLU  60           HB2      GLU  60   0.673 -18.964   8.676
    4    HB3  GLU  60           HB3      GLU  60  -0.946 -19.587   8.366
    5    HG2  GLU  60           HG2      GLU  60  -0.050 -21.881   8.235
    6    HG3  GLU  60           HG3      GLU  60   1.577 -21.265   8.519

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLY  61           H        GLY  61  -2.084 -19.809   5.990
    2    HA3  GLY  61           HA2      GLY  61  -1.865 -22.605   5.034
    3    HA2  GLY  61           HA3      GLY  61  -3.344 -21.852   5.622

  No H/Q in entry =           3
  In of MODEL    9
    1    H    ASP  62           H        ASP  62  -1.089 -20.299   3.427
    2    HA   ASP  62           HA       ASP  62  -3.171 -19.749   1.535
    3    HB2  ASP  62           HB2      ASP  62  -1.341 -18.653   0.268
    4    HB3  ASP  62           HB3      ASP  62  -1.401 -18.133   1.950

  No H/Q in entry =           4
  In of MODEL    9
    1    H    ALA  63           H        ALA  63  -3.613 -22.206   1.244
    2    HA   ALA  63           HA       ALA  63  -1.803 -23.790  -0.303
    3    HB1  ALA  63           HB1      ALA  63  -3.417 -25.030   0.828
    4    HB3  ALA  63           HB2      ALA  63  -3.980 -25.062  -0.843
    5    HB2  ALA  63           HB3      ALA  63  -4.733 -23.970   0.320

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLY  64           H        GLY  64  -4.475 -21.614  -1.069
    2    HA3  GLY  64           HA2      GLY  64  -4.952 -20.458  -3.010
    3    HA2  GLY  64           HA3      GLY  64  -3.492 -21.122  -3.724

  No H/Q in entry =           3
  In of MODEL    9
    1    H    GLU  65           H        GLU  65  -5.466 -20.961  -5.455
    2    HA   GLU  65           HA       GLU  65  -7.346 -23.071  -5.429
    3    HB2  GLU  65           HB2      GLU  65  -6.264 -21.404  -7.698
    4    HB3  GLU  65           HB3      GLU  65  -7.589 -22.556  -7.871
    5    HG2  GLU  65           HG2      GLU  65  -8.889 -21.360  -6.177
    6    HG3  GLU  65           HG3      GLU  65  -7.557 -20.235  -5.924

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLY  66           H        GLY  66  -4.155 -22.789  -6.788
    2    HA3  GLY  66           HA2      GLY  66  -4.204 -25.551  -7.782
    3    HA2  GLY  66           HA3      GLY  66  -3.062 -24.311  -8.261

  No H/Q in entry =           3
  In of MODEL    9
    1    H    LYS  67           H        LYS  67  -2.305 -26.871  -7.545
    2    HA   LYS  67           HA       LYS  67  -1.672 -27.638  -5.078
    3    HB2  LYS  67           HB2      LYS  67   0.668 -28.272  -6.170
    4    HB3  LYS  67           HB3      LYS  67  -0.838 -29.063  -6.653
    5    HG2  LYS  67           HG2      LYS  67  -1.107 -27.540  -8.525
    6    HG3  LYS  67           HG3      LYS  67   0.283 -26.590  -8.003
    7    HD2  LYS  67           HD2      LYS  67   1.756 -28.534  -8.386
    8    HD3  LYS  67           HD3      LYS  67   0.364 -29.478  -8.920
    9    HE2  LYS  67           HE2      LYS  67  -0.037 -27.880 -10.748
   10    HE3  LYS  67           HE3      LYS  67   1.331 -26.908 -10.209
   11    HZ3  LYS  67           HZ1      LYS  67   2.620 -28.176 -11.457
   12    HZ2  LYS  67           HZ2      LYS  67   1.324 -29.200 -11.857
   13    HZ1  LYS  67           HZ3      LYS  67   2.255 -29.503 -10.469

  No H/Q in entry =          13
  In of MODEL    9
    1    H    MET  68           H        MET  68   1.179 -26.387  -6.535
    2    HA   MET  68           HA       MET  68   2.315 -25.426  -4.152
    3    HB2  MET  68           HB2      MET  68   3.037 -24.868  -7.030
    4    HB3  MET  68           HB3      MET  68   4.060 -24.496  -5.642
    5    HG2  MET  68           HG2      MET  68   3.026 -27.264  -6.324
    6    HG3  MET  68           HG3      MET  68   4.646 -26.677  -6.709
    7    HE2  MET  68           HE1      MET  68   5.581 -24.992  -3.988
    8    HE1  MET  68           HE2      MET  68   6.264 -25.922  -5.321
    9    HE3  MET  68           HE3      MET  68   6.580 -26.415  -3.659

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LYS  69           H        LYS  69   0.694 -23.660  -6.783
    2    HA   LYS  69           HA       LYS  69   1.370 -21.081  -6.111
    3    HB2  LYS  69           HB2      LYS  69  -1.170 -22.117  -7.332
    4    HB3  LYS  69           HB3      LYS  69  -0.785 -20.397  -7.194
    5    HG2  LYS  69           HG2      LYS  69   1.323 -20.763  -8.416
    6    HG3  LYS  69           HG3      LYS  69   0.943 -22.478  -8.563
    7    HD2  LYS  69           HD2      LYS  69  -1.097 -21.916  -9.836
    8    HD3  LYS  69           HD3      LYS  69  -0.706 -20.201  -9.698
    9    HE2  LYS  69           HE2      LYS  69   1.421 -20.587 -10.894
   10    HE3  LYS  69           HE3      LYS  69   1.027 -22.300 -11.037
   11    HZ3  LYS  69           HZ1      LYS  69   0.395 -21.265 -13.049
   12    HZ2  LYS  69           HZ2      LYS  69  -0.413 -20.007 -12.243
   13    HZ1  LYS  69           HZ3      LYS  69  -1.042 -21.584 -12.206

  No H/Q in entry =          13
  In of MODEL    9
    1    H    VAL  70           H        VAL  70  -0.287 -19.328  -5.432
    2    HA   VAL  70           HA       VAL  70  -1.629 -20.125  -2.911
    3    HB   VAL  70           HB       VAL  70  -0.845 -17.975  -1.936
    4   HG11  VAL  70          HG11      VAL  70   0.440 -20.237  -1.844
    5   HG13  VAL  70          HG12      VAL  70   1.288 -18.772  -1.348
    6   HG12  VAL  70          HG13      VAL  70   1.574 -19.457  -2.948
    7   HG22  VAL  70          HG21      VAL  70  -0.513 -16.647  -3.953
    8   HG21  VAL  70          HG22      VAL  70   0.688 -17.786  -4.554
    9   HG23  VAL  70          HG23      VAL  70   1.050 -16.792  -3.147

  No H/Q in entry =           9
  In of MODEL    9
    1    H    SER  71           H        SER  71  -3.175 -18.434  -2.175
    2    HA   SER  71           HA       SER  71  -5.094 -17.806  -4.148
    3    HB2  SER  71           HB2      SER  71  -5.588 -18.027  -1.695
    4    HB3  SER  71           HB3      SER  71  -4.740 -16.508  -1.422
    5    HG   SER  71           HG       SER  71  -7.020 -16.922  -3.071

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU  72           H        LEU  72  -5.283 -16.143  -5.487
    2    HA   LEU  72           HA       LEU  72  -3.155 -14.354  -5.964
    3    HB2  LEU  72           HB2      LEU  72  -6.018 -14.375  -6.917
    4    HB3  LEU  72           HB3      LEU  72  -4.804 -13.235  -7.492
    5    HG   LEU  72           HG       LEU  72  -4.447 -16.247  -7.619
    6   HD11  LEU  72          HD11      LEU  72  -5.411 -14.309  -9.745
    7   HD13  LEU  72          HD12      LEU  72  -6.360 -15.598  -9.004
    8   HD12  LEU  72          HD13      LEU  72  -4.985 -15.995 -10.034
    9   HD23  LEU  72          HD21      LEU  72  -2.846 -15.413  -9.517
   10   HD22  LEU  72          HD22      LEU  72  -2.297 -15.271  -7.855
   11   HD21  LEU  72          HD23      LEU  72  -2.937 -13.860  -8.691

  No H/Q in entry =          11
  In of MODEL    9
    1    H    VAL  73           H        VAL  73  -6.248 -13.964  -4.342
    2    HA   VAL  73           HA       VAL  73  -6.265 -11.193  -3.991
    3    HB   VAL  73           HB       VAL  73  -7.984 -11.536  -2.400
    4   HG13  VAL  73          HG11      VAL  73  -9.463 -12.944  -3.609
    5   HG12  VAL  73          HG12      VAL  73  -8.152 -13.983  -4.161
    6   HG11  VAL  73          HG13      VAL  73  -8.320 -12.354  -4.816
    7   HG23  VAL  73          HG21      VAL  73  -8.300 -14.052  -1.641
    8   HG22  VAL  73          HG22      VAL  73  -7.179 -12.999  -0.780
    9   HG21  VAL  73          HG23      VAL  73  -6.571 -14.149  -1.971

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LEU  74           H        LEU  74  -4.356 -13.581  -2.403
    2    HA   LEU  74           HA       LEU  74  -3.939 -12.444   0.121
    3    HB2  LEU  74           HB2      LEU  74  -3.175 -14.668  -0.366
    4    HB3  LEU  74           HB3      LEU  74  -2.122 -14.076  -1.650
    5    HG   LEU  74           HG       LEU  74  -0.787 -12.832   0.014
    6   HD11  LEU  74          HD11      LEU  74  -2.869 -13.971   1.885
    7   HD13  LEU  74          HD12      LEU  74  -2.332 -12.296   1.738
    8   HD12  LEU  74          HD13      LEU  74  -1.270 -13.502   2.464
    9   HD22  LEU  74          HD21      LEU  74   0.402 -14.689   0.641
   10   HD21  LEU  74          HD22      LEU  74  -0.663 -15.402  -0.550
   11   HD23  LEU  74          HD23      LEU  74  -1.037 -15.571   1.150

  No H/Q in entry =          11
  In of MODEL    9
    1    H    VAL  75           H        VAL  75  -2.037 -12.070  -2.832
    2    HA   VAL  75           HA       VAL  75  -0.222 -10.165  -1.817
    3    HB   VAL  75           HB       VAL  75  -1.177 -10.624  -4.645
    4   HG12  VAL  75          HG11      VAL  75   0.914  -9.358  -5.252
    5   HG11  VAL  75          HG12      VAL  75   1.128  -8.975  -3.551
    6   HG13  VAL  75          HG13      VAL  75  -0.266  -8.353  -4.420
    7   HG22  VAL  75          HG21      VAL  75   0.778 -11.978  -4.860
    8   HG21  VAL  75          HG22      VAL  75   0.055 -12.460  -3.326
    9   HG23  VAL  75          HG23      VAL  75   1.451 -11.381  -3.343

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLU  76           H        GLU  76  -3.365  -9.785  -3.482
    2    HA   GLU  76           HA       GLU  76  -3.387  -6.970  -3.583
    3    HB2  GLU  76           HB2      GLU  76  -5.056  -8.427  -4.737
    4    HB3  GLU  76           HB3      GLU  76  -5.737  -8.857  -3.177
    5    HG2  GLU  76           HG2      GLU  76  -6.376  -6.521  -2.775
    6    HG3  GLU  76           HG3      GLU  76  -5.662  -6.029  -4.298

  No H/Q in entry =           6
  In of MODEL    9
    1    H    ALA  77           H        ALA  77  -4.527  -9.186  -1.046
    2    HA   ALA  77           HA       ALA  77  -5.466  -7.175   0.711
    3    HB1  ALA  77           HB1      ALA  77  -4.363  -9.896   1.447
    4    HB2  ALA  77           HB2      ALA  77  -6.017  -9.596   0.915
    5    HB3  ALA  77           HB3      ALA  77  -5.437  -8.896   2.423

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLN  78           H        GLN  78  -2.334  -8.757   0.353
    2    HA   GLN  78           HA       GLN  78  -1.069  -7.611   2.606
    3    HB2  GLN  78           HB2      GLN  78  -0.226  -9.560   1.252
    4    HB3  GLN  78           HB3      GLN  78   0.225  -8.419  -0.011
    5    HG2  GLN  78           HG2      GLN  78   1.689  -7.237   1.580
    6    HG3  GLN  78           HG3      GLN  78   1.248  -8.385   2.840
    7   HE21  GLN  78          HE21      GLN  78   3.186  -9.574   3.107
    8   HE22  GLN  78          HE22      GLN  78   3.976 -10.384   1.840

  No H/Q in entry =           8
  In of MODEL    9
    1    H    LEU  79           H        LEU  79  -1.417  -6.545  -0.742
    2    HA   LEU  79           HA       LEU  79   0.294  -4.337  -0.724
    3    HB2  LEU  79           HB2      LEU  79  -0.737  -5.133  -2.781
    4    HB3  LEU  79           HB3      LEU  79  -2.338  -4.723  -2.176
    5    HG   LEU  79           HG       LEU  79  -1.767  -2.342  -2.149
    6   HD13  LEU  79          HD11      LEU  79   0.475  -2.124  -1.631
    7   HD12  LEU  79          HD12      LEU  79   0.531  -1.837  -3.370
    8   HD11  LEU  79          HD13      LEU  79   0.966  -3.420  -2.723
    9   HD23  LEU  79          HD21      LEU  79  -1.125  -2.150  -4.699
   10   HD22  LEU  79          HD22      LEU  79  -2.661  -2.881  -4.244
   11   HD21  LEU  79          HD23      LEU  79  -1.299  -3.905  -4.685

  No H/Q in entry =          11
  In of MODEL    9
    1    H    HIS  80           H        HIS  80  -3.176  -4.460   0.094
    2    HA   HIS  80           HA       HIS  80  -3.337  -1.702   0.757
    3    HB2  HIS  80           HB2      HIS  80  -5.067  -4.091   1.072
    4    HB3  HIS  80           HB3      HIS  80  -5.375  -2.747   2.176
    5    HD1  HIS  80           HD1      HIS  80  -6.971  -1.091   1.265
    6    HD2  HIS  80           HD2      HIS  80  -4.793  -2.929  -1.778
    7    HE1  HIS  80           HE1      HIS  80  -7.794  -0.085  -0.916
    8    HE2  HIS  80           HE2      HIS  80  -6.473  -1.199  -2.780

  No H/Q in entry =           8
  In of MODEL    9
    1    H    LEU  81           H        LEU  81  -2.887  -4.602   2.751
    2    HA   LEU  81           HA       LEU  81  -2.864  -3.255   5.236
    3    HB2  LEU  81           HB2      LEU  81  -1.674  -5.886   4.359
    4    HB3  LEU  81           HB3      LEU  81  -1.646  -5.328   6.032
    5    HG   LEU  81           HG       LEU  81  -4.190  -5.550   4.399
    6   HD12  LEU  81          HD11      LEU  81  -4.521  -7.612   5.946
    7   HD11  LEU  81          HD12      LEU  81  -2.769  -7.562   6.135
    8   HD13  LEU  81          HD13      LEU  81  -3.477  -7.784   4.535
    9   HD23  LEU  81          HD21      LEU  81  -5.041  -5.743   6.898
   10   HD22  LEU  81          HD22      LEU  81  -4.696  -4.158   6.209
   11   HD21  LEU  81          HD23      LEU  81  -3.521  -4.932   7.272

  No H/Q in entry =          11
  In of MODEL    9
    1    H    MET  82           H        MET  82  -0.189  -4.191   3.071
    2    HA   MET  82           HA       MET  82   1.901  -3.322   4.759
    3    HB2  MET  82           HB2      MET  82   1.688  -3.661   1.766
    4    HB3  MET  82           HB3      MET  82   3.176  -3.109   2.533
    5    HG2  MET  82           HG2      MET  82   1.735  -5.681   3.254
    6    HG3  MET  82           HG3      MET  82   3.110  -5.588   2.157
    7    HE3  MET  82           HE1      MET  82   6.131  -4.889   4.147
    8    HE2  MET  82           HE2      MET  82   5.226  -3.511   3.527
    9    HE1  MET  82           HE3      MET  82   5.298  -5.002   2.592

  No H/Q in entry =           9
  In of MODEL    9
    1    H    THR  83           H        THR  83   0.105  -1.658   2.198
    2    HA   THR  83           HA       THR  83   1.547   0.772   2.288
    3    HB   THR  83           HB       THR  83  -0.615   1.725   1.297
    4    HG1  THR  83           HG1      THR  83  -2.281   0.448   1.187
    5   HG22  THR  83          HG21      THR  83  -0.363  -0.097  -0.703
    6   HG21  THR  83          HG22      THR  83   1.131  -0.408   0.177
    7   HG23  THR  83          HG23      THR  83   0.792   1.210  -0.439

  No H/Q in entry =           7
  In of MODEL    9
    1    H    SER  84           H        SER  84  -1.475  -0.222   3.883
    2    HA   SER  84           HA       SER  84  -1.943   2.214   5.226
    3    HB2  SER  84           HB2      SER  84  -2.813  -0.613   5.789
    4    HB3  SER  84           HB3      SER  84  -3.291   0.735   6.821
    5    HG   SER  84           HG       SER  84  -3.748   0.426   4.028

  No H/Q in entry =           5
  In of MODEL    9
    1    H    MET  85           H        MET  85  -0.273  -0.739   6.359
    2    HA   MET  85           HA       MET  85   0.253   0.181   8.965
    3    HB2  MET  85           HB2      MET  85   0.518  -2.165   8.303
    4    HB3  MET  85           HB3      MET  85   1.893  -1.726   7.290
    5    HG2  MET  85           HG2      MET  85   3.106  -0.901   9.268
    6    HG3  MET  85           HG3      MET  85   1.723  -1.295  10.288
    7    HE2  MET  85           HE1      MET  85   4.275  -3.990  11.370
    8    HE1  MET  85           HE2      MET  85   3.286  -2.607  11.833
    9    HE3  MET  85           HE3      MET  85   4.702  -2.368  10.814

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LEU  86           H        LEU  86   2.197   0.411   6.017
    2    HA   LEU  86           HA       LEU  86   4.426   1.693   7.177
    3    HB2  LEU  86           HB2      LEU  86   4.225   0.612   4.868
    4    HB3  LEU  86           HB3      LEU  86   3.438   2.104   4.354
    5    HG   LEU  86           HG       LEU  86   5.480   3.324   5.338
    6   HD11  LEU  86          HD11      LEU  86   6.149   0.703   6.140
    7   HD13  LEU  86          HD12      LEU  86   7.171   2.135   6.239
    8   HD12  LEU  86          HD13      LEU  86   7.269   1.085   4.828
    9   HD23  LEU  86          HD21      LEU  86   6.178   1.551   2.989
   10   HD22  LEU  86          HD22      LEU  86   6.593   3.243   3.252
   11   HD21  LEU  86          HD23      LEU  86   4.935   2.797   2.850

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ALA  87           H        ALA  87   1.533   2.974   5.587
    2    HA   ALA  87           HA       ALA  87   2.164   5.696   5.671
    3    HB1  ALA  87           HB1      ALA  87  -0.166   4.099   5.126
    4    HB3  ALA  87           HB2      ALA  87   0.168   5.755   4.626
    5    HB2  ALA  87           HB3      ALA  87  -0.633   5.445   6.168

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ARG  88           H        ARG  88   0.443   3.718   8.058
    2    HA   ARG  88           HA       ARG  88  -0.046   5.774   9.904
    3    HB2  ARG  88           HB2      ARG  88  -1.015   3.434   9.969
    4    HB3  ARG  88           HB3      ARG  88   0.518   2.914  10.678
    5    HG2  ARG  88           HG2      ARG  88   0.065   4.995  12.296
    6    HG3  ARG  88           HG3      ARG  88  -1.605   4.692  11.837
    7    HD2  ARG  88           HD2      ARG  88  -1.739   2.845  13.084
    8    HD3  ARG  88           HD3      ARG  88  -0.156   2.242  12.556
    9    HE   ARG  88           HE       ARG  88  -0.678   3.513  15.009
   10   HH21  ARG  88          HH11      ARG  88   0.891   4.505  16.250
   11   HH22  ARG  88          HH12      ARG  88   2.417   4.911  15.548
   12   HH11  ARG  88          HH21      ARG  88   1.610   3.663  12.436
   13   HH12  ARG  88          HH22      ARG  88   2.832   4.419  13.401

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLU  89           H        GLU  89   2.722   3.519   9.687
    2    HA   GLU  89           HA       GLU  89   3.990   4.392  12.033
    3    HB2  GLU  89           HB2      GLU  89   4.626   2.365  10.691
    4    HB3  GLU  89           HB3      GLU  89   5.418   3.448   9.545
    5    HG2  GLU  89           HG2      GLU  89   6.910   4.277  11.292
    6    HG3  GLU  89           HG3      GLU  89   6.061   3.332  12.511

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LEU  90           H        LEU  90   4.329   5.544   8.705
    2    HA   LEU  90           HA       LEU  90   6.283   7.520   9.294
    3    HB2  LEU  90           HB2      LEU  90   4.278   7.213   7.062
    4    HB3  LEU  90           HB3      LEU  90   5.524   8.468   7.086
    5    HG   LEU  90           HG       LEU  90   6.160   5.524   7.422
    6   HD12  LEU  90          HD11      LEU  90   6.916   5.747   4.984
    7   HD11  LEU  90          HD12      LEU  90   5.919   7.200   4.933
    8   HD13  LEU  90          HD13      LEU  90   5.179   5.636   5.275
    9   HD22  LEU  90          HD21      LEU  90   8.070   6.650   8.107
   10   HD21  LEU  90          HD22      LEU  90   7.740   8.058   7.099
   11   HD23  LEU  90          HD23      LEU  90   8.383   6.585   6.374

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  91           H        ILE  91   2.745   7.580   9.137
    2    HA   ILE  91           HA       ILE  91   2.436  10.356   9.586
    3    HB   ILE  91           HB       ILE  91   0.615   8.003  10.126
    4   HG12  ILE  91          HG12      ILE  91   0.399  10.286   8.140
    5   HG13  ILE  91          HG13      ILE  91   1.241   8.782   7.770
    6   HG22  ILE  91          HG21      ILE  91  -1.093  10.082  10.185
    7   HG21  ILE  91          HG22      ILE  91   0.317  10.896  10.861
    8   HG23  ILE  91          HG23      ILE  91  -0.338   9.467  11.656
    9   HD13  ILE  91          HD11      ILE  91  -0.719   7.518   7.811
   10   HD12  ILE  91          HD12      ILE  91  -1.288   9.039   7.128
   11   HD11  ILE  91          HD13      ILE  91  -1.567   8.680   8.832

  No H/Q in entry =          11
  In of MODEL    9
    1    H    THR  92           H        THR  92   2.802   7.611  11.790
    2    HA   THR  92           HA       THR  92   2.369   8.991  14.212
    3    HB   THR  92           HB       THR  92   4.152   6.635  13.552
    4    HG1  THR  92           HG1      THR  92   2.174   5.901  13.448
    5   HG22  THR  92          HG21      THR  92   3.759   6.357  16.185
    6   HG21  THR  92          HG22      THR  92   3.715   8.117  16.111
    7   HG23  THR  92          HG23      THR  92   5.140   7.244  15.542

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLU  93           H        GLU  93   5.319   8.507  12.285
    2    HA   GLU  93           HA       GLU  93   7.085   9.915  13.985
    3    HB2  GLU  93           HB2      GLU  93   7.177   9.598  10.970
    4    HB3  GLU  93           HB3      GLU  93   8.521  10.113  11.988
    5    HG2  GLU  93           HG2      GLU  93   7.081   7.493  12.434
    6    HG3  GLU  93           HG3      GLU  93   8.469   7.628  11.361

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LEU  94           H        LEU  94   5.055  10.951  11.267
    2    HA   LEU  94           HA       LEU  94   5.890  13.646  11.167
    3    HB2  LEU  94           HB2      LEU  94   3.286  12.309  10.408
    4    HB3  LEU  94           HB3      LEU  94   3.564  14.033  10.166
    5    HG   LEU  94           HG       LEU  94   5.562  12.023   9.122
    6   HD11  LEU  94          HD11      LEU  94   2.829  12.602   8.053
    7   HD13  LEU  94          HD12      LEU  94   3.796  11.135   7.930
    8   HD12  LEU  94          HD13      LEU  94   4.149  12.511   6.886
    9   HD23  LEU  94          HD21      LEU  94   5.836  13.855   7.398
   10   HD22  LEU  94          HD22      LEU  94   6.252  14.344   9.041
   11   HD21  LEU  94          HD23      LEU  94   4.708  14.828   8.338

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  95           H        ILE  95   3.330  12.058  13.053
    2    HA   ILE  95           HA       ILE  95   2.310  14.420  14.244
    3    HB   ILE  95           HB       ILE  95   2.294  11.539  15.171
    4   HG12  ILE  95          HG12      ILE  95   0.095  13.335  14.115
    5   HG13  ILE  95          HG13      ILE  95   1.042  12.265  13.086
    6   HG21  ILE  95          HG21      ILE  95   1.035  14.025  16.367
    7   HG23  ILE  95          HG22      ILE  95   2.069  12.846  17.175
    8   HG22  ILE  95          HG23      ILE  95   0.430  12.402  16.697
    9   HD13  ILE  95          HD11      ILE  95   0.117  10.336  14.004
   10   HD12  ILE  95          HD12      ILE  95  -1.254  11.440  14.076
   11   HD11  ILE  95          HD13      ILE  95  -0.296  11.133  15.524

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLU  96           H        GLU  96   4.879  12.175  15.248
    2    HA   GLU  96           HA       GLU  96   5.440  13.370  17.740
    3    HB2  GLU  96           HB2      GLU  96   6.368  11.201  17.096
    4    HB3  GLU  96           HB3      GLU  96   7.312  11.964  15.818
    5    HG2  GLU  96           HG2      GLU  96   8.962  12.497  17.284
    6    HG3  GLU  96           HG3      GLU  96   7.821  13.322  18.336

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LEU  97           H        LEU  97   6.531  14.128  14.456
    2    HA   LEU  97           HA       LEU  97   8.435  16.107  15.171
    3    HB2  LEU  97           HB2      LEU  97   6.844  15.571  12.672
    4    HB3  LEU  97           HB3      LEU  97   7.877  16.992  12.796
    5    HG   LEU  97           HG       LEU  97   8.877  14.185  13.360
    6   HD12  LEU  97          HD11      LEU  97   9.882  14.368  11.045
    7   HD11  LEU  97          HD12      LEU  97   8.844  15.768  10.778
    8   HD13  LEU  97          HD13      LEU  97   8.129  14.183  11.072
    9   HD23  LEU  97          HD21      LEU  97  11.061  15.443  12.622
   10   HD22  LEU  97          HD22      LEU  97  10.440  15.719  14.249
   11   HD21  LEU  97          HD23      LEU  97  10.141  16.905  12.979

  No H/Q in entry =          11
  In of MODEL    9
    1    H    HIS  98           H        HIS  98   4.946  16.275  14.508
    2    HA   HIS  98           HA       HIS  98   4.673  19.077  14.640
    3    HB2  HIS  98           HB2      HIS  98   2.760  16.845  15.363
    4    HB3  HIS  98           HB3      HIS  98   2.309  18.550  15.416
    5    HD1  HIS  98           HD1      HIS  98   3.311  15.824  13.016
    6    HD2  HIS  98           HD2      HIS  98   1.972  19.770  12.887
    7    HE1  HIS  98           HE1      HIS  98   2.763  16.316  10.590
    8    HE2  HIS  98           HE2      HIS  98   1.951  18.713  10.490

  No H/Q in entry =           8
  In of MODEL    9
    1    H    GLU  99           H        GLU  99   4.776  16.590  17.141
    2    HA   GLU  99           HA       GLU  99   4.179  18.292  19.336
    3    HB2  GLU  99           HB2      GLU  99   4.066  15.811  19.435
    4    HB3  GLU  99           HB3      GLU  99   5.826  15.749  19.331
    5    HG2  GLU  99           HG2      GLU  99   6.021  17.041  21.405
    6    HG3  GLU  99           HG3      GLU  99   4.270  17.198  21.496

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LYS 100           H        LYS 100   7.228  17.331  17.780
    2    HA   LYS 100           HA       LYS 100   8.891  18.718  19.640
    3    HB2  LYS 100           HB2      LYS 100   9.388  17.786  16.803
    4    HB3  LYS 100           HB3      LYS 100  10.623  18.545  17.814
    5    HG2  LYS 100           HG2      LYS 100  10.225  16.799  19.555
    6    HG3  LYS 100           HG3      LYS 100   9.089  16.006  18.462
    7    HD2  LYS 100           HD2      LYS 100  10.884  15.705  16.799
    8    HD3  LYS 100           HD3      LYS 100  12.026  16.510  17.878
    9    HE2  LYS 100           HE2      LYS 100  11.609  14.760  19.596
   10    HE3  LYS 100           HE3      LYS 100  10.529  13.934  18.469
   11    HZ1  LYS 100           HZ1      LYS 100  13.357  14.576  17.820
   12    HZ3  LYS 100           HZ2      LYS 100  12.306  13.530  16.990
   13    HZ2  LYS 100           HZ3      LYS 100  12.886  13.107  18.530

  No H/Q in entry =          13
  In of MODEL    9
    1    H    LEU 101           H        LEU 101   7.214  19.658  16.679
    2    HA   LEU 101           HA       LEU 101   8.453  22.203  16.345
    3    HB2  LEU 101           HB2      LEU 101   5.848  20.994  15.453
    4    HB3  LEU 101           HB3      LEU 101   6.116  22.722  15.245
    5    HG   LEU 101           HG       LEU 101   8.135  20.686  14.286
    6   HD12  LEU 101          HD11      LEU 101   6.993  21.201  11.997
    7   HD11  LEU 101          HD12      LEU 101   5.595  21.645  12.974
    8   HD13  LEU 101          HD13      LEU 101   6.243  20.008  13.059
    9   HD21  LEU 101          HD21      LEU 101   7.536  23.603  13.726
   10   HD23  LEU 101          HD22      LEU 101   8.511  22.633  12.623
   11   HD22  LEU 101          HD23      LEU 101   9.051  22.887  14.282

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LYS 102           H        LYS 102   6.898  21.082  18.958
    2    HA   LYS 102           HA       LYS 102   6.271  22.181  20.888
    3    HB2  LYS 102           HB2      LYS 102   7.576  24.158  19.765
    4    HB3  LYS 102           HB3      LYS 102   5.984  24.778  19.385
    5    HG2  LYS 102           HG2      LYS 102   7.352  24.510  22.041
    6    HG3  LYS 102           HG3      LYS 102   6.414  25.848  21.409
    7    HD2  LYS 102           HD2      LYS 102   5.142  23.224  22.286
    8    HD3  LYS 102           HD3      LYS 102   5.401  24.584  23.369
    9    HE2  LYS 102           HE2      LYS 102   3.122  24.202  21.875
   10    HE3  LYS 102           HE3      LYS 102   3.638  25.743  22.557
   11    HZ2  LYS 102           HZ1      LYS 102   3.115  25.854  20.176
   12    HZ1  LYS 102           HZ2      LYS 102   4.366  24.760  19.857
   13    HZ3  LYS 102           HZ3      LYS 102   4.722  26.288  20.500

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ALA 103           H        ALA 103   4.656  23.738  18.115
    2    HA   ALA 103           HA       ALA 103   2.205  24.339  18.994
    3    HB1  ALA 103           HB1      ALA 103   1.304  23.505  16.750
    4    HB2  ALA 103           HB2      ALA 103   2.947  22.951  16.424
    5    HB3  ALA 103           HB3      ALA 103   2.628  24.667  16.689

  No H/Q in entry =           5
  In of MODEL    9
    1    H1   ALA   1           H3       ALA   1  10.428 -20.259  -6.232
    2    H2   ALA   1           H2       ALA   1   9.465 -20.457  -7.620
    3    H3   ALA   1           H1       ALA   1   9.016 -21.197  -6.158
    4    HA   ALA   1           HA       ALA   1  10.039 -23.018  -6.894
    5    HB1  ALA   1           HB1      ALA   1  10.143 -22.661  -9.169
    6    HB2  ALA   1           HB2      ALA   1  11.871 -22.528  -8.837
    7    HB3  ALA   1           HB3      ALA   1  10.888 -21.071  -8.991

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLU   2           H        GLU   2  12.312 -23.992  -6.946
    2    HA   GLU   2           HA       GLU   2  13.690 -23.924  -4.731
    3    HB2  GLU   2           HB2      GLU   2  15.053 -23.808  -7.427
    4    HB3  GLU   2           HB3      GLU   2  15.771 -24.426  -5.940
    5    HG2  GLU   2           HG2      GLU   2  14.734 -26.432  -6.182
    6    HG3  GLU   2           HG3      GLU   2  13.171 -25.670  -6.445

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLU   3           H        GLU   3  15.486 -22.079  -7.130
    2    HA   GLU   3           HA       GLU   3  16.653 -20.403  -5.168
    3    HB2  GLU   3           HB2      GLU   3  16.603 -20.402  -8.179
    4    HB3  GLU   3           HB3      GLU   3  17.361 -19.081  -7.290
    5    HG2  GLU   3           HG2      GLU   3  19.007 -20.472  -6.363
    6    HG3  GLU   3           HG3      GLU   3  18.046 -21.929  -6.586

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LEU   4           H        LEU   4  14.385 -19.533  -7.805
    2    HA   LEU   4           HA       LEU   4  13.946 -16.919  -7.195
    3    HB2  LEU   4           HB2      LEU   4  11.751 -18.870  -7.929
    4    HB3  LEU   4           HB3      LEU   4  11.695 -17.121  -8.129
    5    HG   LEU   4           HG       LEU   4  13.643 -19.006  -9.497
    6   HD13  LEU   4          HD11      LEU   4  12.346 -18.844 -11.410
    7   HD12  LEU   4          HD12      LEU   4  11.654 -17.291 -10.945
    8   HD11  LEU   4          HD13      LEU   4  11.083 -18.775 -10.184
    9   HD23  LEU   4          HD21      LEU   4  14.006 -16.765 -10.849
   10   HD22  LEU   4          HD22      LEU   4  14.860 -17.016  -9.327
   11   HD21  LEU   4          HD23      LEU   4  13.418 -16.004  -9.370

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLU   5           H        GLU   5  12.427 -19.685  -5.555
    2    HA   GLU   5           HA       GLU   5  10.764 -18.095  -3.856
    3    HB2  GLU   5           HB2      GLU   5  10.307 -20.466  -4.373
    4    HB3  GLU   5           HB3      GLU   5  11.741 -20.921  -3.452
    5    HG2  GLU   5           HG2      GLU   5  10.797 -19.890  -1.435
    6    HG3  GLU   5           HG3      GLU   5   9.376 -19.384  -2.347

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLU   6           H        GLU   6  13.892 -19.708  -3.406
    2    HA   GLU   6           HA       GLU   6  14.248 -18.854  -0.708
    3    HB2  GLU   6           HB2      GLU   6  15.453 -20.783  -1.719
    4    HB3  GLU   6           HB3      GLU   6  16.347 -19.655  -2.739
    5    HG2  GLU   6           HG2      GLU   6  17.726 -20.136  -0.823
    6    HG3  GLU   6           HG3      GLU   6  17.114 -18.494  -0.631

  No H/Q in entry =           6
  In of MODEL    9
    1    H    VAL   7           H        VAL   7  15.034 -17.537  -3.857
    2    HA   VAL   7           HA       VAL   7  16.740 -15.428  -2.989
    3    HB   VAL   7           HB       VAL   7  15.036 -15.775  -5.470
    4   HG11  VAL   7          HG11      VAL   7  16.951 -13.581  -4.655
    5   HG13  VAL   7          HG12      VAL   7  15.311 -13.422  -5.282
    6   HG12  VAL   7          HG13      VAL   7  16.617 -13.939  -6.349
    7   HG21  VAL   7          HG21      VAL   7  17.127 -17.253  -4.896
    8   HG23  VAL   7          HG22      VAL   7  18.048 -15.802  -5.293
    9   HG22  VAL   7          HG23      VAL   7  17.006 -16.541  -6.506

  No H/Q in entry =           9
  In of MODEL    9
    1    H    VAL   8           H        VAL   8  13.247 -15.662  -3.553
    2    HA   VAL   8           HA       VAL   8  12.607 -12.947  -3.084
    3    HB   VAL   8           HB       VAL   8  10.971 -15.460  -2.657
    4   HG12  VAL   8          HG11      VAL   8   9.043 -13.759  -2.804
    5   HG11  VAL   8          HG12      VAL   8  10.258 -12.528  -2.461
    6   HG13  VAL   8          HG13      VAL   8   9.947 -13.808  -1.291
    7   HG22  VAL   8          HG21      VAL   8  10.382 -15.301  -4.880
    8   HG21  VAL   8          HG22      VAL   8  11.866 -14.363  -5.018
    9   HG23  VAL   8          HG23      VAL   8  10.322 -13.540  -4.831

  No H/Q in entry =           9
  In of MODEL    9
    1    H    MET   9           H        MET   9  12.841 -15.754  -0.903
    2    HA   MET   9           HA       MET   9  12.034 -14.473   1.465
    3    HB2  MET   9           HB2      MET   9  13.920 -16.767   0.930
    4    HB3  MET   9           HB3      MET   9  13.621 -16.182   2.567
    5    HG2  MET   9           HG2      MET   9  11.199 -16.551   2.262
    6    HG3  MET   9           HG3      MET   9  11.499 -17.138   0.625
    7    HE3  MET   9           HE1      MET   9  12.727 -18.992   4.604
    8    HE2  MET   9           HE2      MET   9  11.098 -18.373   4.353
    9    HE1  MET   9           HE3      MET   9  12.478 -17.291   4.191

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLY  10           H        GLY  10  15.216 -14.729  -0.084
    2    HA3  GLY  10           HA2      GLY  10  16.684 -13.322   1.888
    3    HA2  GLY  10           HA3      GLY  10  17.149 -13.492   0.196

  No H/Q in entry =           3
  In of MODEL    9
    1    H    LEU  11           H        LEU  11  14.995 -12.251  -1.049
    2    HA   LEU  11           HA       LEU  11  15.706  -9.513  -0.886
    3    HB2  LEU  11           HB2      LEU  11  13.328 -10.901  -2.125
    4    HB3  LEU  11           HB3      LEU  11  13.624  -9.169  -2.285
    5    HG   LEU  11           HG       LEU  11  15.634 -11.297  -3.067
    6   HD13  LEU  11          HD11      LEU  11  13.888 -11.649  -4.591
    7   HD12  LEU  11          HD12      LEU  11  14.904 -10.477  -5.430
    8   HD11  LEU  11          HD13      LEU  11  13.433  -9.945  -4.615
    9   HD22  LEU  11          HD21      LEU  11  16.883  -9.345  -2.840
   10   HD21  LEU  11          HD22      LEU  11  15.518  -8.296  -3.222
   11   HD23  LEU  11          HD23      LEU  11  16.344  -9.173  -4.509

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  12           H        ILE  12  12.918 -11.313   0.377
    2    HA   ILE  12           HA       ILE  12  11.542  -9.076   1.432
    3    HB   ILE  12           HB       ILE  12  11.551 -11.958   2.385
    4   HG12  ILE  12          HG12      ILE  12  10.876 -11.311  -0.068
    5   HG13  ILE  12          HG13      ILE  12   9.851 -12.408   0.837
    6   HG21  ILE  12          HG21      ILE  12   9.649  -9.659   2.942
    7   HG23  ILE  12          HG22      ILE  12  10.603 -10.561   4.120
    8   HG22  ILE  12          HG23      ILE  12   9.267 -11.347   3.279
    9   HD12  ILE  12          HD11      ILE  12   8.600 -10.621  -0.384
   10   HD11  ILE  12          HD12      ILE  12   9.421  -9.418   0.609
   11   HD13  ILE  12          HD13      ILE  12   8.337 -10.575   1.351

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  13           H        ILE  13  13.913 -11.301   2.844
    2    HA   ILE  13           HA       ILE  13  13.952 -10.120   5.424
    3    HB   ILE  13           HB       ILE  13  16.006 -11.708   3.864
    4   HG12  ILE  13          HG12      ILE  13  13.712 -12.651   4.700
    5   HG13  ILE  13          HG13      ILE  13  15.179 -13.594   4.954
    6   HG22  ILE  13          HG21      ILE  13  17.056 -12.072   6.173
    7   HG21  ILE  13          HG22      ILE  13  16.119 -10.687   6.717
    8   HG23  ILE  13          HG23      ILE  13  17.323 -10.490   5.444
    9   HD12  ILE  13          HD11      ILE  13  13.666 -13.419   6.997
   10   HD11  ILE  13          HD12      ILE  13  14.041 -11.700   7.026
   11   HD13  ILE  13          HD13      ILE  13  15.324 -12.881   7.257

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ASN  14           H        ASN  14  15.917  -9.606   2.510
    2    HA   ASN  14           HA       ASN  14  17.673  -7.677   3.574
    3    HB2  ASN  14           HB2      ASN  14  17.647  -8.945   1.259
    4    HB3  ASN  14           HB3      ASN  14  16.765  -7.521   0.719
    5   HD21  ASN  14          HD21      ASN  14  19.206  -7.879  -0.460
    6   HD22  ASN  14          HD22      ASN  14  20.355  -6.804   0.169

  No H/Q in entry =           6
  In of MODEL    9
    1    H    SER  15           H        SER  15  14.569  -7.309   1.874
    2    HA   SER  15           HA       SER  15  14.476  -4.487   1.929
    3    HB2  SER  15           HB2      SER  15  12.143  -4.719   1.429
    4    HB3  SER  15           HB3      SER  15  12.933  -6.089   0.659
    5    HG   SER  15           HG       SER  15  11.908  -7.381   1.952

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLY  16           H        GLY  16  13.361  -6.938   4.231
    2    HA3  GLY  16           HA2      GLY  16  12.146  -5.181   6.085
    3    HA2  GLY  16           HA3      GLY  16  12.750  -6.793   6.449

  No H/Q in entry =           3
  In of MODEL    9
    1    H    GLN  17           H        GLN  17  15.465  -6.478   5.863
    2    HA   GLN  17           HA       GLN  17  16.423  -5.262   8.246
    3    HB2  GLN  17           HB2      GLN  17  17.843  -6.124   5.712
    4    HB3  GLN  17           HB3      GLN  17  18.690  -5.528   7.139
    5    HG2  GLN  17           HG2      GLN  17  16.781  -7.880   7.143
    6    HG3  GLN  17           HG3      GLN  17  18.536  -8.023   7.074
    7   HE21  GLN  17          HE21      GLN  17  16.128  -8.346   9.250
    8   HE22  GLN  17          HE22      GLN  17  16.900  -7.784  10.652

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ALA  18           H        ALA  18  16.250  -4.185   4.885
    2    HA   ALA  18           HA       ALA  18  17.700  -1.801   5.114
    3    HB1  ALA  18           HB1      ALA  18  16.580  -3.010   3.044
    4    HB3  ALA  18           HB2      ALA  18  16.855  -1.268   3.028
    5    HB2  ALA  18           HB3      ALA  18  15.251  -1.904   3.394

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ARG  19           H        ARG  19  14.196  -2.367   5.502
    2    HA   ARG  19           HA       ARG  19  13.542   0.287   6.214
    3    HB2  ARG  19           HB2      ARG  19  11.852  -1.454   5.624
    4    HB3  ARG  19           HB3      ARG  19  12.185  -2.253   7.162
    5    HG2  ARG  19           HG2      ARG  19  11.483  -0.257   8.399
    6    HG3  ARG  19           HG3      ARG  19  11.242   0.620   6.889
    7    HD2  ARG  19           HD2      ARG  19   9.094  -0.163   7.704
    8    HD3  ARG  19           HD3      ARG  19   9.511  -1.045   6.229
    9    HE   ARG  19           HE       ARG  19  10.455  -2.593   8.338
   10   HH21  ARG  19          HH11      ARG  19   9.193  -4.224   9.274
   11   HH22  ARG  19          HH12      ARG  19   7.474  -4.187   9.099
   12   HH11  ARG  19          HH21      ARG  19   7.472  -1.282   7.234
   13   HH12  ARG  19          HH22      ARG  19   6.500  -2.521   7.940

  No H/Q in entry =          13
  In of MODEL    9
    1    H    SER  20           H        SER  20  14.377  -2.547   8.177
    2    HA   SER  20           HA       SER  20  14.094  -1.444  10.713
    3    HB2  SER  20           HB2      SER  20  14.546  -3.772  10.595
    4    HB3  SER  20           HB3      SER  20  16.002  -3.519   9.634
    5    HG   SER  20           HG       SER  20  15.694  -2.471  12.245

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU  21           H        LEU  21  16.943  -1.401   8.584
    2    HA   LEU  21           HA       LEU  21  18.622   0.076  10.326
    3    HB2  LEU  21           HB2      LEU  21  18.607  -0.198   7.312
    4    HB3  LEU  21           HB3      LEU  21  19.864   0.655   8.204
    5    HG   LEU  21           HG       LEU  21  19.105  -2.231   8.745
    6   HD11  LEU  21          HD11      LEU  21  21.293  -1.073   6.993
    7   HD13  LEU  21          HD12      LEU  21  19.953  -2.097   6.477
    8   HD12  LEU  21          HD13      LEU  21  21.223  -2.760   7.504
    9   HD22  LEU  21          HD21      LEU  21  20.286  -1.580  10.640
   10   HD21  LEU  21          HD22      LEU  21  21.195  -0.335   9.793
   11   HD23  LEU  21          HD23      LEU  21  21.642  -2.023   9.610

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ALA  22           H        ALA  22  16.371   1.057   7.764
    2    HA   ALA  22           HA       ALA  22  16.927   3.812   7.778
    3    HB3  ALA  22           HB1      ALA  22  15.521   2.577   6.096
    4    HB2  ALA  22           HB2      ALA  22  14.822   4.095   6.660
    5    HB1  ALA  22           HB3      ALA  22  14.221   2.560   7.287

  No H/Q in entry =           5
  In of MODEL    9
    1    H    TYR  23           H        TYR  23  14.414   2.013   9.606
    2    HA   TYR  23           HA       TYR  23  13.461   4.257  11.052
    3    HB2  TYR  23           HB2      TYR  23  12.213   2.151  11.028
    4    HB3  TYR  23           HB3      TYR  23  13.536   1.332  11.857
    5    HD1  TYR  23           HD1      TYR  23  11.055   4.097  12.214
    6    HD2  TYR  23           HD2      TYR  23  13.722   1.388  14.214
    7    HE1  TYR  23           HE1      TYR  23  10.125   4.797  14.406
    8    HE2  TYR  23           HE2      TYR  23  12.792   2.087  16.403
    9    HH   TYR  23           HH       TYR  23  11.288   4.713  17.006

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ALA  24           H        ALA  24  16.090   1.964  11.698
    2    HA   ALA  24           HA       ALA  24  16.759   2.957  14.263
    3    HB1  ALA  24           HB1      ALA  24  18.104   1.154  14.102
    4    HB3  ALA  24           HB2      ALA  24  19.141   2.069  13.006
    5    HB2  ALA  24           HB3      ALA  24  17.842   1.068  12.361

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA  25           H        ALA  25  17.732   3.877  10.986
    2    HA   ALA  25           HA       ALA  25  19.688   5.799  11.636
    3    HB1  ALA  25           HB1      ALA  25  18.972   4.855   9.319
    4    HB3  ALA  25           HB2      ALA  25  19.484   6.539   9.413
    5    HB2  ALA  25           HB3      ALA  25  17.767   6.143   9.339

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU  26           H        LEU  26  16.176   6.052  11.265
    2    HA   LEU  26           HA       LEU  26  15.970   8.835  11.714
    3    HB2  LEU  26           HB2      LEU  26  14.102   7.612  10.781
    4    HB3  LEU  26           HB3      LEU  26  14.000   6.586  12.207
    5    HG   LEU  26           HG       LEU  26  13.404   8.549  13.584
    6   HD12  LEU  26          HD11      LEU  26  12.762  10.653  12.256
    7   HD11  LEU  26          HD12      LEU  26  13.742   9.993  10.950
    8   HD13  LEU  26          HD13      LEU  26  14.485  10.373  12.504
    9   HD21  LEU  26          HD21      LEU  26  11.734   8.246  11.070
   10   HD23  LEU  26          HD22      LEU  26  11.174   8.949  12.585
   11   HD22  LEU  26          HD23      LEU  26  11.614   7.244  12.517

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LYS  27           H        LYS  27  15.835   6.058  13.908
    2    HA   LYS  27           HA       LYS  27  15.246   7.429  16.274
    3    HB2  LYS  27           HB2      LYS  27  15.257   4.954  16.010
    4    HB3  LYS  27           HB3      LYS  27  17.020   4.993  15.972
    5    HG2  LYS  27           HG2      LYS  27  17.071   5.979  18.221
    6    HG3  LYS  27           HG3      LYS  27  15.304   6.011  18.261
    7    HD2  LYS  27           HD2      LYS  27  15.261   3.544  18.026
    8    HD3  LYS  27           HD3      LYS  27  17.026   3.520  18.019
    9    HE2  LYS  27           HE2      LYS  27  17.061   4.510  20.275
   10    HE3  LYS  27           HE3      LYS  27  15.296   4.563  20.285
   11    HZ3  LYS  27           HZ1      LYS  27  16.065   2.606  21.439
   12    HZ2  LYS  27           HZ2      LYS  27  16.981   2.119  20.091
   13    HZ1  LYS  27           HZ3      LYS  27  15.284   2.137  20.006

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLN  28           H        GLN  28  18.362   6.822  14.691
    2    HA   GLN  28           HA       GLN  28  20.049   7.893  16.686
    3    HB2  GLN  28           HB2      GLN  28  20.344   7.843  13.671
    4    HB3  GLN  28           HB3      GLN  28  21.633   8.305  14.785
    5    HG2  GLN  28           HG2      GLN  28  20.192   5.639  14.825
    6    HG3  GLN  28           HG3      GLN  28  21.777   5.912  14.107
    7   HE21  GLN  28          HE21      GLN  28  20.487   4.615  16.811
    8   HE22  GLN  28          HE22      GLN  28  21.678   5.027  17.947

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ALA  29           H        ALA  29  18.317   9.389  13.988
    2    HA   ALA  29           HA       ALA  29  19.338  12.001  14.243
    3    HB2  ALA  29           HB1      ALA  29  17.649  12.652  12.766
    4    HB1  ALA  29           HB2      ALA  29  16.493  11.488  13.415
    5    HB3  ALA  29           HB3      ALA  29  17.822  10.934  12.395

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LYS  30           H        LYS  30  16.543  10.426  15.756
    2    HA   LYS  30           HA       LYS  30  15.545  12.689  17.110
    3    HB2  LYS  30           HB2      LYS  30  15.405   9.749  17.814
    4    HB3  LYS  30           HB3      LYS  30  14.548  11.008  18.705
    5    HG2  LYS  30           HG2      LYS  30  13.435  11.703  16.583
    6    HG3  LYS  30           HG3      LYS  30  14.230  10.359  15.759
    7    HD2  LYS  30           HD2      LYS  30  13.139   8.762  17.285
    8    HD3  LYS  30           HD3      LYS  30  12.354  10.095  18.134
    9    HE2  LYS  30           HE2      LYS  30  11.198  10.738  16.038
   10    HE3  LYS  30           HE3      LYS  30  11.963   9.376  15.209
   11    HZ2  LYS  30           HZ1      LYS  30   9.648   8.988  16.083
   12    HZ1  LYS  30           HZ2      LYS  30  10.312   9.036  17.652
   13    HZ3  LYS  30           HZ3      LYS  30  10.812   7.846  16.543

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLN  31           H        GLN  31  18.184  10.495  17.855
    2    HA   GLN  31           HA       GLN  31  18.513  11.508  20.550
    3    HB2  GLN  31           HB2      GLN  31  20.526   9.917  18.951
    4    HB3  GLN  31           HB3      GLN  31  20.388  10.044  20.705
    5    HG2  GLN  31           HG2      GLN  31  17.868   9.115  19.930
    6    HG3  GLN  31           HG3      GLN  31  18.964   8.260  18.853
    7   HE21  GLN  31          HE21      GLN  31  17.405   7.129  21.125
    8   HE22  GLN  31          HE22      GLN  31  18.551   6.457  22.179

  No H/Q in entry =           8
  In of MODEL    9
    1    H    GLY  32           H        GLY  32  19.053  12.819  17.585
    2    HA3  GLY  32           HA2      GLY  32  20.057  14.855  17.073
    3    HA2  GLY  32           HA3      GLY  32  20.810  14.853  18.663

  No H/Q in entry =           3
  In of MODEL    9
    1    H    ASP  33           H        ASP  33  21.211  11.956  16.887
    2    HA   ASP  33           HA       ASP  33  24.043  12.605  16.429
    3    HB2  ASP  33           HB2      ASP  33  22.510  10.003  16.542
    4    HB3  ASP  33           HB3      ASP  33  24.199  10.104  16.051

  No H/Q in entry =           4
  In of MODEL    9
    1    H    PHE  34           H        PHE  34  23.579  13.932  14.546
    2    HA   PHE  34           HA       PHE  34  22.227  12.960  12.255
    3    HB2  PHE  34           HB2      PHE  34  24.377  15.075  12.491
    4    HB3  PHE  34           HB3      PHE  34  23.393  14.793  11.056
    5    HD1  PHE  34           HD1      PHE  34  23.654  16.725  13.970
    6    HD2  PHE  34           HD2      PHE  34  20.764  14.635  11.577
    7    HE1  PHE  34           HE1      PHE  34  21.848  18.140  14.912
    8    HE2  PHE  34           HE2      PHE  34  18.962  16.050  12.521
    9    HZ   PHE  34           HZ       PHE  34  19.507  17.802  14.184

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ALA  35           H        ALA  35  25.597  12.742  13.272
    2    HA   ALA  35           HA       ALA  35  26.702  11.911  10.819
    3    HB3  ALA  35           HB1      ALA  35  28.367  10.726  12.543
    4    HB2  ALA  35           HB2      ALA  35  27.510  11.760  13.686
    5    HB1  ALA  35           HB3      ALA  35  28.357  12.475  12.316

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA  36           H        ALA  36  25.562   9.965  13.582
    2    HA   ALA  36           HA       ALA  36  26.028   7.473  12.308
    3    HB2  ALA  36           HB1      ALA  36  25.585   6.731  14.382
    4    HB3  ALA  36           HB2      ALA  36  23.901   7.241  14.228
    5    HB1  ALA  36           HB3      ALA  36  25.111   8.362  14.853

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA  37           H        ALA  37  23.224   9.623  12.433
    2    HA   ALA  37           HA       ALA  37  21.356   7.869  11.253
    3    HB3  ALA  37           HB1      ALA  37  21.606  10.830  11.545
    4    HB1  ALA  37           HB2      ALA  37  20.284   9.763  12.014
    5    HB2  ALA  37           HB3      ALA  37  20.481  10.232  10.325

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LYS  38           H        LYS  38  23.480  10.312   9.779
    2    HA   LYS  38           HA       LYS  38  22.844   9.889   7.100
    3    HB2  LYS  38           HB2      LYS  38  24.662  11.432   8.550
    4    HB3  LYS  38           HB3      LYS  38  25.690  10.434   7.527
    5    HG2  LYS  38           HG2      LYS  38  24.537  11.213   5.528
    6    HG3  LYS  38           HG3      LYS  38  23.347  12.078   6.505
    7    HD2  LYS  38           HD2      LYS  38  24.953  13.664   7.262
    8    HD3  LYS  38           HD3      LYS  38  26.306  12.667   6.730
    9    HE2  LYS  38           HE2      LYS  38  25.968  14.540   5.177
   10    HE3  LYS  38           HE3      LYS  38  25.624  13.005   4.372
   11    HZ3  LYS  38           HZ1      LYS  38  23.431  13.467   4.236
   12    HZ2  LYS  38           HZ2      LYS  38  23.965  15.078   4.324
   13    HZ1  LYS  38           HZ3      LYS  38  23.382  14.299   5.715

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ALA  39           H        ALA  39  25.340   8.272   9.064
    2    HA   ALA  39           HA       ALA  39  26.403   6.675   6.997
    3    HB2  ALA  39           HB1      ALA  39  26.299   5.713   9.841
    4    HB1  ALA  39           HB2      ALA  39  27.264   7.131   9.427
    5    HB3  ALA  39           HB3      ALA  39  27.606   5.578   8.665

  No H/Q in entry =           5
  In of MODEL    9
    1    H    MET  40           H        MET  40  23.779   6.080   9.289
    2    HA   MET  40           HA       MET  40  23.318   3.378   8.554
    3    HB2  MET  40           HB2      MET  40  21.513   5.435   9.841
    4    HB3  MET  40           HB3      MET  40  21.094   3.729   9.665
    5    HG2  MET  40           HG2      MET  40  23.647   4.652  11.013
    6    HG3  MET  40           HG3      MET  40  22.148   4.387  11.902
    7    HE3  MET  40           HE1      MET  40  21.558   0.758  12.077
    8    HE2  MET  40           HE2      MET  40  20.701   2.067  11.267
    9    HE1  MET  40           HE3      MET  40  21.439   2.349  12.842

  No H/Q in entry =           9
  In of MODEL    9
    1    H    MET  41           H        MET  41  21.930   6.441   7.362
    2    HA   MET  41           HA       MET  41  19.968   5.259   5.685
    3    HB2  MET  41           HB2      MET  41  21.469   7.839   5.175
    4    HB3  MET  41           HB3      MET  41  19.940   7.356   4.453
    5    HG2  MET  41           HG2      MET  41  19.186   7.174   7.002
    6    HG3  MET  41           HG3      MET  41  20.502   8.322   7.227
    7    HE2  MET  41           HE1      MET  41  19.957   9.613   3.889
    8    HE1  MET  41           HE2      MET  41  20.913  10.046   5.303
    9    HE3  MET  41           HE3      MET  41  19.650  11.134   4.735

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ASP  42           H        ASP  42  23.349   6.158   5.141
    2    HA   ASP  42           HA       ASP  42  23.445   5.683   2.383
    3    HB2  ASP  42           HB2      ASP  42  25.198   6.669   4.157
    4    HB3  ASP  42           HB3      ASP  42  25.844   5.039   4.032

  No H/Q in entry =           4
  In of MODEL    9
    1    H    GLN  43           H        GLN  43  24.147   3.524   5.107
    2    HA   GLN  43           HA       GLN  43  24.800   1.261   3.526
    3    HB2  GLN  43           HB2      GLN  43  23.771   1.453   6.367
    4    HB3  GLN  43           HB3      GLN  43  24.341  -0.040   5.614
    5    HG2  GLN  43           HG2      GLN  43  26.514   1.155   5.108
    6    HG3  GLN  43           HG3      GLN  43  25.938   2.487   6.106
    7   HE21  GLN  43          HE21      GLN  43  28.162   1.498   7.149
    8   HE22  GLN  43          HE22      GLN  43  27.876   0.418   8.425

  No H/Q in entry =           8
  In of MODEL    9
    1    H    SER  44           H        SER  44  21.748   2.417   4.903
    2    HA   SER  44           HA       SER  44  20.165   0.184   4.227
    3    HB2  SER  44           HB2      SER  44  19.738   2.716   5.370
    4    HB3  SER  44           HB3      SER  44  18.707   2.680   3.943
    5    HG   SER  44           HG       SER  44  17.603   1.745   5.663

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ARG  45           H        ARG  45  20.933   3.143   2.423
    2    HA   ARG  45           HA       ARG  45  19.411   2.667   0.114
    3    HB2  ARG  45           HB2      ARG  45  20.568   4.795   0.701
    4    HB3  ARG  45           HB3      ARG  45  22.108   4.030   0.320
    5    HG2  ARG  45           HG2      ARG  45  21.328   3.629  -1.997
    6    HG3  ARG  45           HG3      ARG  45  19.800   4.418  -1.614
    7    HD2  ARG  45           HD2      ARG  45  21.064   6.506  -1.027
    8    HD3  ARG  45           HD3      ARG  45  22.556   5.721  -1.592
    9    HE   ARG  45           HE       ARG  45  20.629   5.497  -3.633
   10   HH21  ARG  45          HH11      ARG  45  20.637   6.865  -5.396
   11   HH22  ARG  45          HH12      ARG  45  21.405   8.410  -5.290
   12   HH11  ARG  45          HH21      ARG  45  22.374   7.983  -2.002
   13   HH12  ARG  45          HH22      ARG  45  22.387   9.042  -3.366

  No H/Q in entry =          13
  In of MODEL    9
    1    H    MET  46           H        MET  46  22.767   1.768   0.870
    2    HA   MET  46           HA       MET  46  23.370   0.570  -1.612
    3    HB2  MET  46           HB2      MET  46  24.468   0.246   1.180
    4    HB3  MET  46           HB3      MET  46  25.116  -0.666  -0.186
    5    HG2  MET  46           HG2      MET  46  25.590   1.422  -1.386
    6    HG3  MET  46           HG3      MET  46  24.887   2.357  -0.073
    7    HE3  MET  46           HE1      MET  46  27.547  -0.872   0.285
    8    HE2  MET  46           HE2      MET  46  28.821   0.157  -0.361
    9    HE1  MET  46           HE3      MET  46  27.336  -0.077  -1.282

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ALA  47           H        ALA  47  21.970  -0.751   1.361
    2    HA   ALA  47           HA       ALA  47  21.897  -3.464   0.560
    3    HB2  ALA  47           HB1      ALA  47  21.517  -2.999   2.863
    4    HB3  ALA  47           HB2      ALA  47  19.977  -3.591   2.241
    5    HB1  ALA  47           HB3      ALA  47  20.219  -1.861   2.499

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU  48           H        LEU  48  19.566  -0.818   0.197
    2    HA   LEU  48           HA       LEU  48  17.511  -2.336  -1.057
    3    HB2  LEU  48           HB2      LEU  48  18.190   0.613  -1.172
    4    HB3  LEU  48           HB3      LEU  48  16.714  -0.086  -1.841
    5    HG   LEU  48           HG       LEU  48  17.560  -0.393   1.049
    6   HD13  LEU  48          HD11      LEU  48  17.161   1.911   0.860
    7   HD12  LEU  48          HD12      LEU  48  15.597   1.276   1.367
    8   HD11  LEU  48          HD13      LEU  48  15.874   1.695  -0.324
    9   HD22  LEU  48          HD21      LEU  48  16.018  -2.095   0.667
   10   HD21  LEU  48          HD22      LEU  48  15.154  -1.186  -0.574
   11   HD23  LEU  48          HD23      LEU  48  14.941  -0.779   1.129

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ASN  49           H        ASN  49  20.217  -0.431  -2.284
    2    HA   ASN  49           HA       ASN  49  19.570  -0.511  -5.009
    3    HB2  ASN  49           HB2      ASN  49  21.262   0.989  -4.074
    4    HB3  ASN  49           HB3      ASN  49  22.282  -0.382  -3.658
    5   HD21  ASN  49          HD21      ASN  49  23.280   1.636  -5.337
    6   HD22  ASN  49          HD22      ASN  49  23.453   1.025  -6.909

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLU  50           H        GLU  50  21.533  -2.721  -3.042
    2    HA   GLU  50           HA       GLU  50  22.222  -4.484  -5.166
    3    HB2  GLU  50           HB2      GLU  50  23.417  -4.467  -2.998
    4    HB3  GLU  50           HB3      GLU  50  21.968  -5.082  -2.203
    5    HG2  GLU  50           HG2      GLU  50  22.042  -7.117  -3.561
    6    HG3  GLU  50           HG3      GLU  50  23.424  -6.497  -4.460

  No H/Q in entry =           6
  In of MODEL    9
    1    H    ALA  51           H        ALA  51  19.563  -4.394  -2.843
    2    HA   ALA  51           HA       ALA  51  18.377  -6.858  -3.600
    3    HB3  ALA  51           HB1      ALA  51  16.787  -6.337  -2.048
    4    HB1  ALA  51           HB2      ALA  51  16.589  -4.689  -2.648
    5    HB2  ALA  51           HB3      ALA  51  17.943  -5.086  -1.590

  No H/Q in entry =           5
  In of MODEL    9
    1    H    HIS  52           H        HIS  52  17.821  -3.506  -4.639
    2    HA   HIS  52           HA       HIS  52  15.706  -4.016  -6.441
    3    HB2  HIS  52           HB2      HIS  52  16.375  -1.756  -5.640
    4    HB3  HIS  52           HB3      HIS  52  17.829  -1.865  -6.633
    5    HD1  HIS  52           HD1      HIS  52  17.489  -1.908  -9.249
    6    HD2  HIS  52           HD2      HIS  52  14.013  -1.177  -7.066
    7    HE1  HIS  52           HE1      HIS  52  15.775  -1.039 -10.900
    8    HE2  HIS  52           HE2      HIS  52  13.650  -0.589  -9.584

  No H/Q in entry =           8
  In of MODEL    9
    1    H    LEU  53           H        LEU  53  19.225  -4.052  -6.869
    2    HA   LEU  53           HA       LEU  53  19.283  -4.371  -9.669
    3    HB2  LEU  53           HB2      LEU  53  21.207  -5.147  -7.492
    4    HB3  LEU  53           HB3      LEU  53  21.522  -5.537  -9.180
    5    HG   LEU  53           HG       LEU  53  20.868  -2.721  -8.263
    6   HD12  LEU  53          HD11      LEU  53  23.382  -2.376  -8.520
    7   HD11  LEU  53          HD12      LEU  53  23.532  -4.133  -8.494
    8   HD13  LEU  53          HD13      LEU  53  22.881  -3.285  -7.097
    9   HD21  LEU  53          HD21      LEU  53  21.972  -3.964 -10.790
   10   HD23  LEU  53          HD22      LEU  53  22.290  -2.277 -10.402
   11   HD22  LEU  53          HD23      LEU  53  20.641  -2.824 -10.637

  No H/Q in entry =          11
  In of MODEL    9
    1    H    VAL  54           H        VAL  54  19.147  -6.754  -7.041
    2    HA   VAL  54           HA       VAL  54  19.254  -9.051  -8.698
    3    HB   VAL  54           HB       VAL  54  18.099  -8.615  -5.933
    4   HG12  VAL  54          HG11      VAL  54  18.402 -11.235  -5.925
    5   HG11  VAL  54          HG12      VAL  54  18.221 -11.067  -7.671
    6   HG13  VAL  54          HG13      VAL  54  16.935 -10.525  -6.595
    7   HG22  VAL  54          HG21      VAL  54  20.416  -8.422  -5.707
    8   HG21  VAL  54          HG22      VAL  54  20.747  -9.518  -7.046
    9   HG23  VAL  54          HG23      VAL  54  20.209 -10.160  -5.494

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLN  55           H        GLN  55  16.539  -7.125  -7.421
    2    HA   GLN  55           HA       GLN  55  14.507  -8.774  -8.495
    3    HB2  GLN  55           HB2      GLN  55  13.768  -7.241  -6.872
    4    HB3  GLN  55           HB3      GLN  55  14.573  -5.879  -7.648
    5    HG2  GLN  55           HG2      GLN  55  12.853  -5.543  -9.141
    6    HG3  GLN  55           HG3      GLN  55  12.518  -7.262  -9.309
    7   HE21  GLN  55          HE21      GLN  55  10.506  -7.794  -8.506
    8   HE22  GLN  55          HE22      GLN  55   9.736  -7.032  -7.199

  No H/Q in entry =           8
  In of MODEL    9
    1    H    THR  56           H        THR  56  16.269  -5.989  -9.856
    2    HA   THR  56           HA       THR  56  14.837  -5.619 -12.207
    3    HB   THR  56           HB       THR  56  17.857  -5.553 -12.038
    4    HG1  THR  56           HG1      THR  56  16.030  -4.189 -10.648
    5   HG22  THR  56          HG21      THR  56  15.990  -3.772 -13.605
    6   HG21  THR  56          HG22      THR  56  16.620  -5.280 -14.266
    7   HG23  THR  56          HG23      THR  56  17.729  -3.983 -13.814

  No H/Q in entry =           7
  In of MODEL    9
    1    H    LYS  57           H        LYS  57  17.469  -7.935 -11.589
    2    HA   LYS  57           HA       LYS  57  17.464  -9.133 -14.166
    3    HB2  LYS  57           HB2      LYS  57  19.249  -9.396 -12.415
    4    HB3  LYS  57           HB3      LYS  57  18.136 -10.386 -11.482
    5    HG2  LYS  57           HG2      LYS  57  18.022 -12.021 -13.307
    6    HG3  LYS  57           HG3      LYS  57  19.097 -11.028 -14.287
    7    HD2  LYS  57           HD2      LYS  57  20.879 -11.289 -12.588
    8    HD3  LYS  57           HD3      LYS  57  19.810 -12.312 -11.629
    9    HE2  LYS  57           HE2      LYS  57  21.315 -13.715 -12.972
   10    HE3  LYS  57           HE3      LYS  57  19.660 -13.912 -13.548
   11    HZ2  LYS  57           HZ1      LYS  57  21.713 -12.133 -14.740
   12    HZ1  LYS  57           HZ2      LYS  57  20.114 -12.300 -15.287
   13    HZ3  LYS  57           HZ3      LYS  57  21.187 -13.613 -15.378

  No H/Q in entry =          13
  In of MODEL    9
    1    H    LEU  58           H        LEU  58  15.674  -9.784 -11.192
    2    HA   LEU  58           HA       LEU  58  14.437 -12.150 -12.124
    3    HB2  LEU  58           HB2      LEU  58  13.653 -10.236  -9.932
    4    HB3  LEU  58           HB3      LEU  58  12.836 -11.768 -10.247
    5    HG   LEU  58           HG       LEU  58  15.810 -11.510  -9.690
    6   HD11  LEU  58          HD11      LEU  58  13.434 -11.908  -7.899
    7   HD13  LEU  58          HD12      LEU  58  14.894 -10.955  -7.636
    8   HD12  LEU  58          HD13      LEU  58  14.954 -12.711  -7.499
    9   HD22  LEU  58          HD21      LEU  58  15.679 -13.573 -10.714
   10   HD21  LEU  58          HD22      LEU  58  13.964 -13.770 -10.356
   11   HD23  LEU  58          HD23      LEU  58  15.168 -14.077  -9.104

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  59           H        ILE  59  13.790  -8.809 -12.812
    2    HA   ILE  59           HA       ILE  59  11.071  -9.440 -13.755
    3    HB   ILE  59           HB       ILE  59  11.891  -7.162 -12.551
    4   HG12  ILE  59          HG12      ILE  59   9.990  -7.023 -14.903
    5   HG13  ILE  59          HG13      ILE  59   9.562  -7.796 -13.398
    6   HG22  ILE  59          HG21      ILE  59  11.994  -6.366 -15.450
    7   HG21  ILE  59          HG22      ILE  59  13.460  -6.775 -14.587
    8   HG23  ILE  59          HG23      ILE  59  12.460  -5.427 -14.052
    9   HD12  ILE  59          HD11      ILE  59  10.369  -4.914 -13.769
   10   HD11  ILE  59          HD12      ILE  59  10.138  -5.670 -12.194
   11   HD13  ILE  59          HD13      ILE  59   8.775  -5.510 -13.303

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLU  60           H        GLU  60  14.282  -8.612 -15.011
    2    HA   GLU  60           HA       GLU  60  13.508  -8.211 -17.720
    3    HB2  GLU  60           HB2      GLU  60  15.692  -7.493 -16.862
    4    HB3  GLU  60           HB3      GLU  60  16.142  -9.170 -16.566
    5    HG2  GLU  60           HG2      GLU  60  15.953  -9.656 -18.979
    6    HG3  GLU  60           HG3      GLU  60  15.487  -7.983 -19.281

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLY  61           H        GLY  61  14.463 -11.096 -15.900
    2    HA3  GLY  61           HA2      GLY  61  13.913 -12.744 -18.300
    3    HA2  GLY  61           HA3      GLY  61  14.941 -13.230 -16.955

  No H/Q in entry =           3
  In of MODEL    9
    1    H    ASP  62           H        ASP  62  11.831 -11.662 -16.591
    2    HA   ASP  62           HA       ASP  62  10.893 -13.737 -14.853
    3    HB2  ASP  62           HB2      ASP  62   8.864 -12.337 -14.712
    4    HB3  ASP  62           HB3      ASP  62  10.335 -11.416 -14.415

  No H/Q in entry =           4
  In of MODEL    9
    1    H    ALA  63           H        ALA  63  11.146 -15.435 -16.706
    2    HA   ALA  63           HA       ALA  63   9.221 -15.517 -18.819
    3    HB1  ALA  63           HB1      ALA  63  11.090 -16.916 -19.116
    4    HB3  ALA  63           HB2      ALA  63   9.796 -18.043 -18.714
    5    HB2  ALA  63           HB3      ALA  63  10.972 -17.576 -17.485

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLY  64           H        GLY  64   9.302 -16.776 -15.528
    2    HA3  GLY  64           HA2      GLY  64   7.568 -17.325 -14.102
    3    HA2  GLY  64           HA3      GLY  64   6.431 -16.865 -15.363

  No H/Q in entry =           3
  In of MODEL    9
    1    H    GLU  65           H        GLU  65   5.634 -18.992 -14.046
    2    HA   GLU  65           HA       GLU  65   6.733 -21.469 -14.857
    3    HB2  GLU  65           HB2      GLU  65   4.012 -20.755 -13.775
    4    HB3  GLU  65           HB3      GLU  65   4.543 -22.412 -14.064
    5    HG2  GLU  65           HG2      GLU  65   6.432 -22.108 -12.541
    6    HG3  GLU  65           HG3      GLU  65   5.985 -20.421 -12.289

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLY  66           H        GLY  66   4.167 -19.502 -16.141
    2    HA3  GLY  66           HA2      GLY  66   3.704 -21.361 -18.368
    3    HA2  GLY  66           HA3      GLY  66   2.608 -20.096 -17.851

  No H/Q in entry =           3
  In of MODEL    9
    1    H    LYS  67           H        LYS  67   3.331 -20.505 -20.493
    2    HA   LYS  67           HA       LYS  67   5.377 -19.355 -21.720
    3    HB2  LYS  67           HB2      LYS  67   3.528 -18.359 -23.341
    4    HB3  LYS  67           HB3      LYS  67   3.795 -20.101 -23.191
    5    HG2  LYS  67           HG2      LYS  67   2.003 -20.293 -21.563
    6    HG3  LYS  67           HG3      LYS  67   1.797 -18.543 -21.524
    7    HD2  LYS  67           HD2      LYS  67   1.108 -18.564 -23.889
    8    HD3  LYS  67           HD3      LYS  67   1.320 -20.315 -23.937
    9    HE2  LYS  67           HE2      LYS  67  -0.385 -20.584 -22.183
   10    HE3  LYS  67           HE3      LYS  67  -0.589 -18.834 -22.103
   11    HZ3  LYS  67           HZ1      LYS  67  -2.082 -19.032 -23.706
   12    HZ2  LYS  67           HZ2      LYS  67  -1.738 -20.682 -23.913
   13    HZ1  LYS  67           HZ3      LYS  67  -0.846 -19.512 -24.763

  No H/Q in entry =          13
  In of MODEL    9
    1    H    MET  68           H        MET  68   2.745 -17.178 -21.993
    2    HA   MET  68           HA       MET  68   4.290 -14.840 -21.967
    3    HB2  MET  68           HB2      MET  68   1.318 -15.219 -21.580
    4    HB3  MET  68           HB3      MET  68   2.105 -13.678 -21.921
    5    HG2  MET  68           HG2      MET  68   2.290 -16.129 -23.694
    6    HG3  MET  68           HG3      MET  68   1.211 -14.764 -23.979
    7    HE2  MET  68           HE1      MET  68   3.059 -12.084 -23.279
    8    HE1  MET  68           HE2      MET  68   1.712 -12.579 -24.300
    9    HE3  MET  68           HE3      MET  68   3.160 -11.897 -25.035

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LYS  69           H        LYS  69   2.347 -16.283 -19.334
    2    HA   LYS  69           HA       LYS  69   2.317 -14.152 -17.575
    3    HB2  LYS  69           HB2      LYS  69   2.371 -17.119 -17.048
    4    HB3  LYS  69           HB3      LYS  69   2.107 -15.920 -15.779
    5    HG2  LYS  69           HG2      LYS  69   0.199 -14.995 -17.049
    6    HG3  LYS  69           HG3      LYS  69   0.452 -16.210 -18.304
    7    HD2  LYS  69           HD2      LYS  69   0.034 -18.000 -16.663
    8    HD3  LYS  69           HD3      LYS  69  -0.215 -16.790 -15.402
    9    HE2  LYS  69           HE2      LYS  69  -2.106 -15.846 -16.673
   10    HE3  LYS  69           HE3      LYS  69  -1.858 -17.049 -17.938
   11    HZ3  LYS  69           HZ1      LYS  69  -3.556 -17.860 -16.539
   12    HZ2  LYS  69           HZ2      LYS  69  -2.675 -17.516 -15.129
   13    HZ1  LYS  69           HZ3      LYS  69  -2.173 -18.765 -16.165

  No H/Q in entry =          13
  In of MODEL    9
    1    H    VAL  70           H        VAL  70   3.370 -14.242 -15.267
    2    HA   VAL  70           HA       VAL  70   6.300 -14.614 -15.526
    3    HB   VAL  70           HB       VAL  70   6.569 -12.537 -14.188
    4   HG11  VAL  70          HG11      VAL  70   6.452 -12.678 -16.787
    5   HG13  VAL  70          HG12      VAL  70   6.353 -11.087 -16.031
    6   HG12  VAL  70          HG13      VAL  70   4.888 -11.883 -16.602
    7   HG22  VAL  70          HG21      VAL  70   4.430 -12.450 -13.032
    8   HG21  VAL  70          HG22      VAL  70   3.560 -12.386 -14.564
    9   HG23  VAL  70          HG23      VAL  70   4.538 -11.013 -14.049

  No H/Q in entry =           9
  In of MODEL    9
    1    H    SER  71           H        SER  71   7.371 -14.624 -13.348
    2    HA   SER  71           HA       SER  71   6.291 -16.611 -11.654
    3    HB2  SER  71           HB2      SER  71   8.720 -16.079 -11.837
    4    HB3  SER  71           HB3      SER  71   8.421 -14.560 -10.996
    5    HG   SER  71           HG       SER  71   7.862 -17.174 -10.024

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU  72           H        LEU  72   4.906 -16.479  -9.970
    2    HA   LEU  72           HA       LEU  72   3.372 -14.154  -9.530
    3    HB2  LEU  72           HB2      LEU  72   3.638 -16.710  -7.954
    4    HB3  LEU  72           HB3      LEU  72   2.476 -15.445  -7.563
    5    HG   LEU  72           HG       LEU  72   2.639 -16.755 -10.296
    6   HD11  LEU  72          HD11      LEU  72   0.834 -17.394  -7.943
    7   HD13  LEU  72          HD12      LEU  72   2.068 -18.451  -8.622
    8   HD12  LEU  72          HD13      LEU  72   0.640 -18.043  -9.572
    9   HD23  LEU  72          HD21      LEU  72   0.156 -15.912 -10.211
   10   HD22  LEU  72          HD22      LEU  72   1.418 -14.741 -10.554
   11   HD21  LEU  72          HD23      LEU  72   0.734 -14.848  -8.935

  No H/Q in entry =          11
  In of MODEL    9
    1    H    VAL  73           H        VAL  73   6.014 -15.608  -7.751
    2    HA   VAL  73           HA       VAL  73   5.960 -14.073  -5.420
    3    HB   VAL  73           HB       VAL  73   8.139 -14.895  -4.989
    4   HG13  VAL  73          HG11      VAL  73   7.823 -17.222  -5.293
    5   HG12  VAL  73          HG12      VAL  73   6.970 -16.992  -6.819
    6   HG11  VAL  73          HG13      VAL  73   6.191 -16.558  -5.298
    7   HG23  VAL  73          HG21      VAL  73   9.300 -16.088  -7.046
    8   HG22  VAL  73          HG22      VAL  73   9.484 -14.352  -6.808
    9   HG21  VAL  73          HG23      VAL  73   8.319 -14.961  -7.983

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LEU  74           H        LEU  74   6.963 -13.188  -8.595
    2    HA   LEU  74           HA       LEU  74   8.921 -11.253  -8.100
    3    HB2  LEU  74           HB2      LEU  74   8.472 -11.994 -10.338
    4    HB3  LEU  74           HB3      LEU  74   6.805 -11.431 -10.243
    5    HG   LEU  74           HG       LEU  74   7.596  -9.104 -10.037
    6   HD11  LEU  74          HD11      LEU  74  10.287 -10.473 -10.106
    7   HD13  LEU  74          HD12      LEU  74   9.699  -9.280  -8.950
    8   HD12  LEU  74          HD13      LEU  74  10.102  -8.789 -10.594
    9   HD22  LEU  74          HD21      LEU  74   7.958  -8.879 -12.291
   10   HD21  LEU  74          HD22      LEU  74   7.396 -10.533 -12.236
   11   HD23  LEU  74          HD23      LEU  74   9.111 -10.211 -12.347

  No H/Q in entry =          11
  In of MODEL    9
    1    H    VAL  75           H        VAL  75   5.429 -10.844  -8.462
    2    HA   VAL  75           HA       VAL  75   5.351  -8.086  -7.877
    3    HB   VAL  75           HB       VAL  75   3.241 -10.210  -7.481
    4   HG12  VAL  75          HG11      VAL  75   1.681  -8.229  -7.421
    5   HG11  VAL  75          HG12      VAL  75   3.087  -7.177  -7.367
    6   HG13  VAL  75          HG13      VAL  75   2.770  -8.280  -6.037
    7   HG22  VAL  75          HG21      VAL  75   2.440  -9.503  -9.615
    8   HG21  VAL  75          HG22      VAL  75   4.184  -9.660  -9.814
    9   HG23  VAL  75          HG23      VAL  75   3.460  -8.065  -9.609

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLU  76           H        GLU  76   5.071 -10.960  -5.766
    2    HA   GLU  76           HA       GLU  76   4.605  -9.593  -3.347
    3    HB2  GLU  76           HB2      GLU  76   4.431 -12.072  -3.619
    4    HB3  GLU  76           HB3      GLU  76   6.177 -12.159  -3.779
    5    HG2  GLU  76           HG2      GLU  76   6.462 -11.297  -1.497
    6    HG3  GLU  76           HG3      GLU  76   4.726 -11.132  -1.307

  No H/Q in entry =           6
  In of MODEL    9
    1    H    ALA  77           H        ALA  77   7.662 -10.524  -4.901
    2    HA   ALA  77           HA       ALA  77   9.353  -9.491  -2.881
    3    HB3  ALA  77           HB1      ALA  77   9.946  -9.731  -5.839
    4    HB1  ALA  77           HB2      ALA  77  10.089 -11.049  -4.678
    5    HB2  ALA  77           HB3      ALA  77  11.128  -9.632  -4.534

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLN  78           H        GLN  78   7.980  -8.066  -5.800
    2    HA   GLN  78           HA       GLN  78   9.351  -5.597  -5.694
    3    HB2  GLN  78           HB2      GLN  78   8.051  -6.506  -7.654
    4    HB3  GLN  78           HB3      GLN  78   6.571  -6.110  -6.784
    5    HG2  GLN  78           HG2      GLN  78   7.252  -3.745  -6.693
    6    HG3  GLN  78           HG3      GLN  78   8.734  -4.136  -7.565
    7   HE21  GLN  78          HE21      GLN  78   8.353  -3.147  -9.595
    8   HE22  GLN  78          HE22      GLN  78   7.008  -3.491 -10.571

  No H/Q in entry =           8
  In of MODEL    9
    1    H    LEU  79           H        LEU  79   6.319  -6.710  -4.272
    2    HA   LEU  79           HA       LEU  79   5.340  -4.295  -3.268
    3    HB2  LEU  79           HB2      LEU  79   4.010  -6.336  -3.215
    4    HB3  LEU  79           HB3      LEU  79   5.145  -7.083  -2.095
    5    HG   LEU  79           HG       LEU  79   4.600  -5.435  -0.372
    6   HD13  LEU  79          HD11      LEU  79   4.154  -3.418  -1.426
    7   HD12  LEU  79          HD12      LEU  79   2.523  -3.930  -0.991
    8   HD11  LEU  79          HD13      LEU  79   3.107  -4.159  -2.638
    9   HD23  LEU  79          HD21      LEU  79   2.010  -5.907  -0.290
   10   HD22  LEU  79          HD22      LEU  79   3.138  -7.255  -0.176
   11   HD21  LEU  79          HD23      LEU  79   2.332  -6.913  -1.704

  No H/Q in entry =          11
  In of MODEL    9
    1    H    HIS  80           H        HIS  80   7.499  -6.646  -1.676
    2    HA   HIS  80           HA       HIS  80   7.791  -5.104   0.693
    3    HB2  HIS  80           HB2      HIS  80   9.114  -7.480  -0.499
    4    HB3  HIS  80           HB3      HIS  80  10.028  -6.589   0.720
    5    HD1  HIS  80           HD1      HIS  80   9.524  -7.219   3.062
    6    HD2  HIS  80           HD2      HIS  80   6.309  -8.046   0.539
    7    HE1  HIS  80           HE1      HIS  80   7.738  -8.307   4.505
    8    HE2  HIS  80           HE2      HIS  80   5.772  -8.814   2.975

  No H/Q in entry =           8
  In of MODEL    9
    1    H    LEU  81           H        LEU  81   9.805  -5.399  -2.212
    2    HA   LEU  81           HA       LEU  81  11.860  -3.674  -1.327
    3    HB2  LEU  81           HB2      LEU  81  10.943  -4.462  -4.093
    4    HB3  LEU  81           HB3      LEU  81  12.370  -3.467  -3.798
    5    HG   LEU  81           HG       LEU  81  11.950  -6.184  -2.524
    6   HD12  LEU  81          HD11      LEU  81  13.767  -6.827  -4.266
    7   HD11  LEU  81          HD12      LEU  81  13.217  -5.399  -5.141
    8   HD13  LEU  81          HD13      LEU  81  12.093  -6.713  -4.806
    9   HD23  LEU  81          HD21      LEU  81  14.581  -5.891  -2.500
   10   HD22  LEU  81          HD22      LEU  81  13.600  -5.121  -1.254
   11   HD21  LEU  81          HD23      LEU  81  14.192  -4.175  -2.620

  No H/Q in entry =          11
  In of MODEL    9
    1    H    MET  82           H        MET  82   8.950  -3.014  -3.276
    2    HA   MET  82           HA       MET  82   9.516  -0.294  -3.777
    3    HB2  MET  82           HB2      MET  82   6.942  -1.865  -3.660
    4    HB3  MET  82           HB3      MET  82   6.958  -0.141  -4.026
    5    HG2  MET  82           HG2      MET  82   8.546  -2.230  -5.553
    6    HG3  MET  82           HG3      MET  82   6.987  -1.594  -6.072
    7    HE3  MET  82           HE1      MET  82   7.470   1.856  -7.245
    8    HE2  MET  82           HE2      MET  82   7.087   1.635  -5.540
    9    HE1  MET  82           HE3      MET  82   6.417   0.530  -6.736

  No H/Q in entry =           9
  In of MODEL    9
    1    H    THR  83           H        THR  83   7.700  -1.874  -1.177
    2    HA   THR  83           HA       THR  83   6.865   0.483   0.144
    3    HB   THR  83           HB       THR  83   6.708  -1.088   2.163
    4    HG1  THR  83           HG1      THR  83   7.448  -3.045   1.937
    5   HG22  THR  83          HG21      THR  83   5.047  -2.640   0.689
    6   HG21  THR  83          HG22      THR  83   5.290  -1.315  -0.443
    7   HG23  THR  83          HG23      THR  83   4.646  -0.992   1.167

  No H/Q in entry =           7
  In of MODEL    9
    1    H    SER  84           H        SER  84   9.667  -1.640   0.677
    2    HA   SER  84           HA       SER  84  10.731  -0.218   2.869
    3    HB2  SER  84           HB2      SER  84  11.975  -2.073   0.850
    4    HB3  SER  84           HB3      SER  84  12.924  -1.328   2.135
    5    HG   SER  84           HG       SER  84  10.632  -2.996   2.387

  No H/Q in entry =           5
  In of MODEL    9
    1    H    MET  85           H        MET  85  11.500   0.034  -0.616
    2    HA   MET  85           HA       MET  85  13.516   1.980  -0.359
    3    HB2  MET  85           HB2      MET  85  13.126   0.706  -2.426
    4    HB3  MET  85           HB3      MET  85  11.598   1.556  -2.659
    5    HG2  MET  85           HG2      MET  85  12.783   3.700  -2.801
    6    HG3  MET  85           HG3      MET  85  14.316   2.887  -2.501
    7    HE2  MET  85           HE1      MET  85  14.651   3.877  -6.232
    8    HE1  MET  85           HE2      MET  85  15.259   4.057  -4.589
    9    HE3  MET  85           HE3      MET  85  13.723   4.790  -5.033

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LEU  86           H        LEU  86  10.032   2.348  -0.882
    2    HA   LEU  86           HA       LEU  86   9.996   5.161  -1.066
    3    HB2  LEU  86           HB2      LEU  86   8.138   3.519  -1.648
    4    HB3  LEU  86           HB3      LEU  86   7.800   3.434   0.081
    5    HG   LEU  86           HG       LEU  86   7.664   5.996   0.025
    6   HD11  LEU  86          HD11      LEU  86   8.447   5.550  -2.673
    7   HD13  LEU  86          HD12      LEU  86   8.022   7.082  -1.915
    8   HD12  LEU  86          HD13      LEU  86   6.780   6.131  -2.725
    9   HD23  LEU  86          HD21      LEU  86   5.524   4.663  -1.645
   10   HD22  LEU  86          HD22      LEU  86   5.341   5.925  -0.430
   11   HD21  LEU  86          HD23      LEU  86   5.723   4.278   0.066

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ALA  87           H        ALA  87   9.497   2.990   1.680
    2    HA   ALA  87           HA       ALA  87   8.960   4.910   3.645
    3    HB1  ALA  87           HB1      ALA  87   9.740   2.082   3.564
    4    HB3  ALA  87           HB2      ALA  87   8.619   2.906   4.645
    5    HB2  ALA  87           HB3      ALA  87  10.346   2.921   4.996

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ARG  88           H        ARG  88  12.033   3.455   2.678
    2    HA   ARG  88           HA       ARG  88  13.649   4.818   4.515
    3    HB2  ARG  88           HB2      ARG  88  14.303   2.837   3.116
    4    HB3  ARG  88           HB3      ARG  88  14.472   3.927   1.743
    5    HG2  ARG  88           HG2      ARG  88  15.951   5.228   3.693
    6    HG3  ARG  88           HG3      ARG  88  16.253   3.535   4.075
    7    HD2  ARG  88           HD2      ARG  88  17.524   3.225   2.233
    8    HD3  ARG  88           HD3      ARG  88  16.400   4.107   1.195
    9    HE   ARG  88           HE       ARG  88  18.801   5.147   2.251
   10   HH21  ARG  88          HH11      ARG  88  19.169   7.363   2.056
   11   HH22  ARG  88          HH12      ARG  88  17.829   8.447   1.907
   12   HH11  ARG  88          HH21      ARG  88  15.470   5.934   1.959
   13   HH12  ARG  88          HH22      ARG  88  15.734   7.636   1.827

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLU  89           H        GLU  89  12.697   5.723   1.188
    2    HA   GLU  89           HA       GLU  89  14.268   8.067   1.035
    3    HB2  GLU  89           HB2      GLU  89  13.121   7.036  -0.916
    4    HB3  GLU  89           HB3      GLU  89  11.579   7.593  -0.265
    5    HG2  GLU  89           HG2      GLU  89  12.305   9.923  -0.426
    6    HG3  GLU  89           HG3      GLU  89  13.906   9.416  -0.957

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LEU  90           H        LEU  90  10.930   7.592   2.153
    2    HA   LEU  90           HA       LEU  90  10.440  10.331   2.724
    3    HB2  LEU  90           HB2      LEU  90   9.216   7.770   3.749
    4    HB3  LEU  90           HB3      LEU  90   8.600   9.372   4.168
    5    HG   LEU  90           HG       LEU  90   9.019   8.485   1.302
    6   HD12  LEU  90          HD11      LEU  90   6.482   8.182   1.355
    7   HD11  LEU  90          HD12      LEU  90   6.631   8.172   3.112
    8   HD13  LEU  90          HD13      LEU  90   7.440   6.933   2.152
    9   HD22  LEU  90          HD21      LEU  90   8.749  10.796   1.225
   10   HD21  LEU  90          HD22      LEU  90   7.757  10.840   2.682
   11   HD23  LEU  90          HD23      LEU  90   7.060  10.290   1.158

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  91           H        ILE  91  11.669   7.638   4.653
    2    HA   ILE  91           HA       ILE  91  11.815   9.004   7.121
    3    HB   ILE  91           HB       ILE  91  13.349   6.649   6.004
    4   HG12  ILE  91          HG12      ILE  91  11.327   6.838   8.257
    5   HG13  ILE  91          HG13      ILE  91  10.859   6.561   6.579
    6   HG22  ILE  91          HG21      ILE  91  13.807   6.433   8.647
    7   HG21  ILE  91          HG22      ILE  91  13.750   8.192   8.544
    8   HG23  ILE  91          HG23      ILE  91  14.922   7.292   7.584
    9   HD13  ILE  91          HD11      ILE  91  11.841   4.449   6.514
   10   HD12  ILE  91          HD12      ILE  91  11.243   4.514   8.172
   11   HD11  ILE  91          HD13      ILE  91  12.948   4.810   7.839

  No H/Q in entry =          11
  In of MODEL    9
    1    H    THR  92           H        THR  92  14.039   8.811   4.377
    2    HA   THR  92           HA       THR  92  16.214  10.183   5.543
    3    HB   THR  92           HB       THR  92  15.237  10.066   2.679
    4    HG1  THR  92           HG1      THR  92  16.048   8.161   3.088
    5   HG22  THR  92          HG21      THR  92  17.815  10.730   2.394
    6   HG21  THR  92          HG22      THR  92  17.509  11.555   3.921
    7   HG23  THR  92          HG23      THR  92  16.548  11.951   2.497

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLU  93           H        GLU  93  13.345  11.364   3.803
    2    HA   GLU  93           HA       GLU  93  13.966  14.119   3.917
    3    HB2  GLU  93           HB2      GLU  93  11.248  12.773   3.923
    4    HB3  GLU  93           HB3      GLU  93  11.554  14.469   3.551
    5    HG2  GLU  93           HG2      GLU  93  12.875  12.212   2.029
    6    HG3  GLU  93           HG3      GLU  93  11.337  12.910   1.537

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LEU  94           H        LEU  94  12.195  11.981   6.124
    2    HA   LEU  94           HA       LEU  94  11.398  13.937   7.996
    3    HB2  LEU  94           HB2      LEU  94  11.944  10.977   8.274
    4    HB3  LEU  94           HB3      LEU  94  11.377  11.959   9.622
    5    HG   LEU  94           HG       LEU  94   9.903  12.023   6.988
    6   HD11  LEU  94          HD11      LEU  94   9.957   9.803   8.994
    7   HD13  LEU  94          HD12      LEU  94   9.661   9.743   7.258
    8   HD12  LEU  94          HD13      LEU  94   8.383  10.273   8.352
    9   HD23  LEU  94          HD21      LEU  94   7.982  12.443   8.581
   10   HD22  LEU  94          HD22      LEU  94   9.233  13.685   8.622
   11   HD21  LEU  94          HD23      LEU  94   9.154  12.470   9.897

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  95           H        ILE  95  14.354  11.978   7.771
    2    HA   ILE  95           HA       ILE  95  15.522  12.890  10.188
    3    HB   ILE  95           HB       ILE  95  16.759  11.807   7.644
    4   HG12  ILE  95          HG12      ILE  95  16.442  10.612  10.412
    5   HG13  ILE  95          HG13      ILE  95  15.277  10.364   9.113
    6   HG21  ILE  95          HG21      ILE  95  18.014  12.604  10.290
    7   HG23  ILE  95          HG22      ILE  95  18.487  13.126   8.672
    8   HG22  ILE  95          HG23      ILE  95  18.775  11.463   9.183
    9   HD13  ILE  95          HD11      ILE  95  16.749   9.070   7.856
   10   HD12  ILE  95          HD12      ILE  95  17.212   8.617   9.493
   11   HD11  ILE  95          HD13      ILE  95  18.179   9.787   8.597

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLU  96           H        GLU  96  15.700  14.120   6.853
    2    HA   GLU  96           HA       GLU  96  17.565  16.180   7.334
    3    HB2  GLU  96           HB2      GLU  96  16.902  15.523   5.073
    4    HB3  GLU  96           HB3      GLU  96  15.263  16.096   5.368
    5    HG2  GLU  96           HG2      GLU  96  15.852  18.220   4.826
    6    HG3  GLU  96           HG3      GLU  96  17.147  18.208   6.012

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LEU  97           H        LEU  97  14.051  16.028   7.753
    2    HA   LEU  97           HA       LEU  97  13.660  18.767   8.391
    3    HB2  LEU  97           HB2      LEU  97  12.115  16.257   9.002
    4    HB3  LEU  97           HB3      LEU  97  11.615  17.809   9.671
    5    HG   LEU  97           HG       LEU  97  12.103  17.386   6.708
    6   HD12  LEU  97          HD11      LEU  97   9.579  17.283   6.582
    7   HD11  LEU  97          HD12      LEU  97   9.565  17.085   8.332
    8   HD13  LEU  97          HD13      LEU  97  10.337  15.869   7.313
    9   HD23  LEU  97          HD21      LEU  97  10.385  19.367   6.733
   10   HD22  LEU  97          HD22      LEU  97  12.068  19.710   7.131
   11   HD21  LEU  97          HD23      LEU  97  10.874  19.553   8.417

  No H/Q in entry =          11
  In of MODEL    9
    1    H    HIS  98           H        HIS  98  14.447  15.934  10.391
    2    HA   HIS  98           HA       HIS  98  14.294  17.198  12.906
    3    HB2  HIS  98           HB2      HIS  98  16.024  14.923  11.911
    4    HB3  HIS  98           HB3      HIS  98  16.023  15.462  13.592
    5    HD1  HIS  98           HD1      HIS  98  13.816  13.853  10.994
    6    HD2  HIS  98           HD2      HIS  98  13.705  14.777  15.058
    7    HE1  HIS  98           HE1      HIS  98  11.776  12.679  11.941
    8    HE2  HIS  98           HE2      HIS  98  11.689  13.234  14.412

  No H/Q in entry =           8
  In of MODEL    9
    1    H    GLU  99           H        GLU  99  16.854  17.056  10.479
    2    HA   GLU  99           HA       GLU  99  18.848  18.368  12.013
    3    HB2  GLU  99           HB2      GLU  99  19.320  17.074   9.947
    4    HB3  GLU  99           HB3      GLU  99  18.526  18.337   9.002
    5    HG2  GLU  99           HG2      GLU  99  20.149  19.991   9.797
    6    HG3  GLU  99           HG3      GLU  99  20.912  18.782  10.823

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LYS 100           H        LYS 100  16.343  19.555   9.789
    2    HA   LYS 100           HA       LYS 100  17.168  22.284   9.933
    3    HB2  LYS 100           HB2      LYS 100  14.524  21.021   9.171
    4    HB3  LYS 100           HB3      LYS 100  14.842  22.757   9.081
    5    HG2  LYS 100           HG2      LYS 100  16.814  22.287   7.620
    6    HG3  LYS 100           HG3      LYS 100  16.382  20.574   7.638
    7    HD2  LYS 100           HD2      LYS 100  14.196  21.106   6.631
    8    HD3  LYS 100           HD3      LYS 100  14.610  22.820   6.620
    9    HE2  LYS 100           HE2      LYS 100  16.568  22.319   5.167
   10    HE3  LYS 100           HE3      LYS 100  16.085  20.619   5.133
   11    HZ1  LYS 100           HZ1      LYS 100  14.286  22.830   4.292
   12    HZ3  LYS 100           HZ2      LYS 100  14.085  21.162   4.030
   13    HZ2  LYS 100           HZ3      LYS 100  15.307  22.011   3.212

  No H/Q in entry =          13
  In of MODEL    9
    1    H    LEU 101           H        LEU 101  15.043  20.261  11.893
    2    HA   LEU 101           HA       LEU 101  13.894  22.342  13.467
    3    HB2  LEU 101           HB2      LEU 101  14.304  19.388  13.854
    4    HB3  LEU 101           HB3      LEU 101  13.774  20.375  15.213
    5    HG   LEU 101           HG       LEU 101  12.365  20.476  12.539
    6   HD12  LEU 101          HD11      LEU 101  10.686  18.931  13.804
    7   HD11  LEU 101          HD12      LEU 101  12.073  18.504  14.803
    8   HD13  LEU 101          HD13      LEU 101  12.108  18.196  13.066
    9   HD21  LEU 101          HD21      LEU 101  11.708  21.278  15.389
   10   HD23  LEU 101          HD22      LEU 101  10.449  21.065  14.175
   11   HD22  LEU 101          HD23      LEU 101  11.697  22.287  13.940

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LYS 102           H        LYS 102  17.036  21.700  13.040
    2    HA   LYS 102           HA       LYS 102  18.889  22.552  14.118
    3    HB2  LYS 102           HB2      LYS 102  17.087  24.087  15.245
    4    HB3  LYS 102           HB3      LYS 102  17.279  23.023  16.623
    5    HG2  LYS 102           HG2      LYS 102  19.197  25.013  15.458
    6    HG3  LYS 102           HG3      LYS 102  18.807  24.704  17.136
    7    HD2  LYS 102           HD2      LYS 102  20.458  22.773  15.457
    8    HD3  LYS 102           HD3      LYS 102  21.159  24.088  16.391
    9    HE2  LYS 102           HE2      LYS 102  20.730  21.544  17.359
   10    HE3  LYS 102           HE3      LYS 102  20.962  22.984  18.351
   11    HZ2  LYS 102           HZ1      LYS 102  18.977  21.722  18.963
   12    HZ1  LYS 102           HZ2      LYS 102  18.340  21.958  17.412
   13    HZ3  LYS 102           HZ3      LYS 102  18.582  23.285  18.438

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ALA 103           H        ALA 103  16.793  20.970  16.534
    2    HA   ALA 103           HA       ALA 103  18.502  19.742  18.195
    3    HB2  ALA 103           HB1      ALA 103  16.896  17.752  18.185
    4    HB1  ALA 103           HB2      ALA 103  16.013  18.614  16.925
    5    HB3  ALA 103           HB3      ALA 103  16.194  19.334  18.524

  No H/Q in entry =           5
  In of MODEL    9
    1    H1   ALA   1           H3       ALA   1  -1.600  -6.914 -21.472
    2    H2   ALA   1           H2       ALA   1  -2.412  -8.340 -21.020
    3    H3   ALA   1           H1       ALA   1  -0.803  -8.408 -21.570
    4    HA   ALA   1           HA       ALA   1  -1.636  -8.869 -23.569
    5    HB1  ALA   1           HB1      ALA   1  -3.783  -9.563 -23.102
    6    HB2  ALA   1           HB2      ALA   1  -4.202  -8.048 -23.901
    7    HB3  ALA   1           HB3      ALA   1  -4.148  -8.128 -22.142

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLU   2           H        GLU   2  -2.447  -7.670 -25.561
    2    HA   GLU   2           HA       GLU   2  -1.023  -5.673 -26.435
    3    HB2  GLU   2           HB2      GLU   2  -4.029  -5.706 -26.762
    4    HB3  GLU   2           HB3      GLU   2  -2.896  -4.856 -27.809
    5    HG2  GLU   2           HG2      GLU   2  -2.410  -6.752 -28.961
    6    HG3  GLU   2           HG3      GLU   2  -2.128  -7.660 -27.482

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLU   3           H        GLU   3  -4.171  -4.380 -25.545
    2    HA   GLU   3           HA       GLU   3  -3.098  -1.835 -24.915
    3    HB2  GLU   3           HB2      GLU   3  -5.802  -3.119 -24.591
    4    HB3  GLU   3           HB3      GLU   3  -5.487  -1.507 -23.944
    5    HG2  GLU   3           HG2      GLU   3  -5.114  -0.585 -26.069
    6    HG3  GLU   3           HG3      GLU   3  -4.734  -2.145 -26.792

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LEU   4           H        LEU   4  -4.722  -4.175 -22.739
    2    HA   LEU   4           HA       LEU   4  -4.351  -2.951 -20.347
    3    HB2  LEU   4           HB2      LEU   4  -3.840  -5.898 -20.814
    4    HB3  LEU   4           HB3      LEU   4  -4.242  -5.147 -19.272
    5    HG   LEU   4           HG       LEU   4  -6.008  -5.201 -21.742
    6   HD13  LEU   4          HD11      LEU   4  -7.224  -6.905 -20.747
    7   HD12  LEU   4          HD12      LEU   4  -6.739  -6.450 -19.115
    8   HD11  LEU   4          HD13      LEU   4  -5.609  -7.306 -20.162
    9   HD23  LEU   4          HD21      LEU   4  -7.689  -4.370 -19.880
   10   HD22  LEU   4          HD22      LEU   4  -6.635  -3.211 -20.687
   11   HD21  LEU   4          HD23      LEU   4  -6.221  -3.806 -19.080

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLU   5           H        GLU   5  -1.869  -4.823 -22.070
    2    HA   GLU   5           HA       GLU   5   0.111  -4.561 -20.027
    3    HB2  GLU   5           HB2      GLU   5   0.163  -6.332 -21.776
    4    HB3  GLU   5           HB3      GLU   5   0.492  -5.093 -22.988
    5    HG2  GLU   5           HG2      GLU   5   2.562  -4.476 -21.830
    6    HG3  GLU   5           HG3      GLU   5   2.231  -5.659 -20.568

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLU   6           H        GLU   6  -0.494  -2.841 -23.074
    2    HA   GLU   6           HA       GLU   6   1.695  -1.034 -22.800
    3    HB2  GLU   6           HB2      GLU   6   0.567  -1.506 -24.963
    4    HB3  GLU   6           HB3      GLU   6  -0.875  -0.687 -24.362
    5    HG2  GLU   6           HG2      GLU   6   0.368   0.911 -25.671
    6    HG3  GLU   6           HG3      GLU   6   0.554   1.358 -23.976

  No H/Q in entry =           6
  In of MODEL    9
    1    H    VAL   7           H        VAL   7  -1.647  -1.067 -21.765
    2    HA   VAL   7           HA       VAL   7  -1.840   1.648 -20.930
    3    HB   VAL   7           HB       VAL   7  -3.334  -0.852 -20.098
    4   HG11  VAL   7          HG11      VAL   7  -3.678   2.041 -19.286
    5   HG13  VAL   7          HG12      VAL   7  -3.598   0.615 -18.250
    6   HG12  VAL   7          HG13      VAL   7  -5.024   0.901 -19.247
    7   HG21  VAL   7          HG21      VAL   7  -3.471   0.225 -22.487
    8   HG23  VAL   7          HG22      VAL   7  -4.404   1.485 -21.679
    9   HG22  VAL   7          HG23      VAL   7  -4.969  -0.186 -21.653

  No H/Q in entry =           9
  In of MODEL    9
    1    H    VAL   8           H        VAL   8  -0.892  -1.348 -19.283
    2    HA   VAL   8           HA       VAL   8  -0.570  -0.271 -16.687
    3    HB   VAL   8           HB       VAL   8   0.812  -2.604 -18.039
    4   HG12  VAL   8          HG11      VAL   8   1.225  -3.274 -15.593
    5   HG11  VAL   8          HG12      VAL   8   0.859  -1.597 -15.186
    6   HG13  VAL   8          HG13      VAL   8   2.228  -1.973 -16.231
    7   HG22  VAL   8          HG21      VAL   8  -0.984  -3.892 -17.370
    8   HG21  VAL   8          HG22      VAL   8  -1.835  -2.351 -17.344
    9   HG23  VAL   8          HG23      VAL   8  -1.172  -3.012 -15.853

  No H/Q in entry =           9
  In of MODEL    9
    1    H    MET   9           H        MET   9   1.684  -0.599 -19.427
    2    HA   MET   9           HA       MET   9   3.979   0.418 -18.159
    3    HB2  MET   9           HB2      MET   9   3.039   0.452 -21.025
    4    HB3  MET   9           HB3      MET   9   4.559   1.206 -20.546
    5    HG2  MET   9           HG2      MET   9   5.316  -0.936 -19.575
    6    HG3  MET   9           HG3      MET   9   3.797  -1.690 -20.061
    7    HE3  MET   9           HE1      MET   9   7.155  -0.060 -22.678
    8    HE2  MET   9           HE2      MET   9   7.493  -1.056 -21.266
    9    HE1  MET   9           HE3      MET   9   6.633   0.469 -21.074

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLY  10           H        GLY  10   1.319   2.052 -19.845
    2    HA3  GLY  10           HA2      GLY  10   2.313   4.693 -19.598
    3    HA2  GLY  10           HA3      GLY  10   0.619   4.254 -19.808

  No H/Q in entry =           3
  In of MODEL    9
    1    H    LEU  11           H        LEU  11   0.195   2.732 -17.523
    2    HA   LEU  11           HA       LEU  11  -0.317   4.716 -15.565
    3    HB2  LEU  11           HB2      LEU  11  -0.287   1.699 -15.408
    4    HB3  LEU  11           HB3      LEU  11  -0.787   2.729 -14.067
    5    HG   LEU  11           HG       LEU  11  -2.017   2.857 -16.834
    6   HD13  LEU  11          HD11      LEU  11  -2.629   0.722 -16.080
    7   HD12  LEU  11          HD12      LEU  11  -3.969   1.730 -15.539
    8   HD11  LEU  11          HD13      LEU  11  -2.722   1.235 -14.395
    9   HD22  LEU  11          HD21      LEU  11  -2.585   4.881 -15.829
   10   HD21  LEU  11          HD22      LEU  11  -2.523   4.214 -14.198
   11   HD23  LEU  11          HD23      LEU  11  -3.900   3.865 -15.244

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  12           H        ILE  12   2.196   2.218 -15.800
    2    HA   ILE  12           HA       ILE  12   3.401   2.740 -13.293
    3    HB   ILE  12           HB       ILE  12   4.648   1.684 -15.852
    4   HG12  ILE  12          HG12      ILE  12   2.617   0.478 -14.711
    5   HG13  ILE  12          HG13      ILE  12   4.005  -0.475 -15.196
    6   HG21  ILE  12          HG21      ILE  12   5.616   1.661 -12.978
    7   HG23  ILE  12          HG22      ILE  12   6.422   2.375 -14.374
    8   HG22  ILE  12          HG23      ILE  12   6.288   0.623 -14.233
    9   HD12  ILE  12          HD11      ILE  12   3.139  -1.006 -12.908
   10   HD11  ILE  12          HD12      ILE  12   3.555   0.634 -12.413
   11   HD13  ILE  12          HD13      ILE  12   4.812  -0.479 -12.906

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  13           H        ILE  13   4.027   3.995 -16.549
    2    HA   ILE  13           HA       ILE  13   6.184   5.688 -15.819
    3    HB   ILE  13           HB       ILE  13   4.160   5.794 -18.070
    4   HG12  ILE  13          HG12      ILE  13   5.980   3.934 -17.782
    5   HG13  ILE  13          HG13      ILE  13   5.739   4.671 -19.362
    6   HG22  ILE  13          HG21      ILE  13   5.878   7.363 -19.150
    7   HG21  ILE  13          HG22      ILE  13   6.546   7.587 -17.538
    8   HG23  ILE  13          HG23      ILE  13   4.882   8.061 -17.873
    9   HD12  ILE  13          HD11      ILE  13   8.177   4.473 -18.657
   10   HD11  ILE  13          HD12      ILE  13   7.818   5.627 -17.378
   11   HD13  ILE  13          HD13      ILE  13   7.657   6.109 -19.063

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ASN  14           H        ASN  14   2.684   6.227 -16.095
    2    HA   ASN  14           HA       ASN  14   2.675   8.974 -15.459
    3    HB2  ASN  14           HB2      ASN  14   0.763   7.356 -16.294
    4    HB3  ASN  14           HB3      ASN  14   0.436   7.182 -14.574
    5   HD21  ASN  14          HD21      ASN  14  -1.566   8.363 -16.011
    6   HD22  ASN  14          HD22      ASN  14  -1.608  10.037 -15.744

  No H/Q in entry =           6
  In of MODEL    9
    1    H    SER  15           H        SER  15   2.339   6.101 -13.382
    2    HA   SER  15           HA       SER  15   2.043   7.476 -10.935
    3    HB2  SER  15           HB2      SER  15   2.571   5.383  -9.884
    4    HB3  SER  15           HB3      SER  15   1.729   4.977 -11.375
    5    HG   SER  15           HG       SER  15   3.478   4.076 -12.094

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLY  16           H        GLY  16   4.909   6.343 -12.687
    2    HA3  GLY  16           HA2      GLY  16   6.839   7.076 -10.752
    3    HA2  GLY  16           HA3      GLY  16   7.144   6.869 -12.474

  No H/Q in entry =           3
  In of MODEL    9
    1    H    GLN  17           H        GLN  17   5.481   8.847 -13.542
    2    HA   GLN  17           HA       GLN  17   7.085  11.170 -13.230
    3    HB2  GLN  17           HB2      GLN  17   4.336  10.768 -14.440
    4    HB3  GLN  17           HB3      GLN  17   5.205  12.302 -14.503
    5    HG2  GLN  17           HG2      GLN  17   6.279   9.671 -15.557
    6    HG3  GLN  17           HG3      GLN  17   5.551  10.928 -16.554
    7   HE21  GLN  17          HE21      GLN  17   8.512   9.782 -15.859
    8   HE22  GLN  17          HE22      GLN  17   9.416  11.219 -15.875

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ALA  18           H        ALA  18   3.970  10.189 -11.888
    2    HA   ALA  18           HA       ALA  18   3.270  12.586 -10.625
    3    HB1  ALA  18           HB1      ALA  18   2.113  10.143 -10.849
    4    HB2  ALA  18           HB2      ALA  18   1.575  11.369  -9.704
    5    HB3  ALA  18           HB3      ALA  18   2.649  10.074  -9.171

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ARG  19           H        ARG  19   5.109   9.802  -9.341
    2    HA   ARG  19           HA       ARG  19   5.648  10.954  -6.817
    3    HB2  ARG  19           HB2      ARG  19   6.036   8.546  -7.343
    4    HB3  ARG  19           HB3      ARG  19   7.400   9.017  -8.361
    5    HG2  ARG  19           HG2      ARG  19   8.527  10.045  -6.436
    6    HG3  ARG  19           HG3      ARG  19   7.144   9.672  -5.408
    7    HD2  ARG  19           HD2      ARG  19   8.887   8.017  -5.045
    8    HD3  ARG  19           HD3      ARG  19   7.506   7.251  -5.834
    9    HE   ARG  19           HE       ARG  19   9.224   8.050  -7.877
   10   HH21  ARG  19          HH11      ARG  19  10.771   6.627  -8.724
   11   HH22  ARG  19          HH12      ARG  19  11.299   5.273  -7.787
   12   HH11  ARG  19          HH21      ARG  19   9.267   6.019  -5.099
   13   HH12  ARG  19          HH22      ARG  19  10.445   4.929  -5.733

  No H/Q in entry =          13
  In of MODEL    9
    1    H    SER  20           H        SER  20   7.473  10.963  -9.862
    2    HA   SER  20           HA       SER  20   9.731  12.354  -9.032
    3    HB2  SER  20           HB2      SER  20   9.766  11.482 -11.235
    4    HB3  SER  20           HB3      SER  20   8.269  12.302 -11.666
    5    HG   SER  20           HG       SER  20  10.614  13.685 -10.891

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU  21           H        LEU  21   6.649  13.656 -10.237
    2    HA   LEU  21           HA       LEU  21   7.348  16.395 -10.012
    3    HB2  LEU  21           HB2      LEU  21   4.667  14.995  -9.944
    4    HB3  LEU  21           HB3      LEU  21   4.846  16.748  -9.936
    5    HG   LEU  21           HG       LEU  21   6.043  14.962 -12.075
    6   HD11  LEU  21          HD11      LEU  21   3.419  16.483 -12.048
    7   HD13  LEU  21          HD12      LEU  21   3.619  14.734 -12.147
    8   HD12  LEU  21          HD13      LEU  21   4.137  15.757 -13.485
    9   HD22  LEU  21          HD21      LEU  21   7.183  16.977 -12.294
   10   HD21  LEU  21          HD22      LEU  21   5.868  17.932 -11.617
   11   HD23  LEU  21          HD23      LEU  21   5.766  17.351 -13.271

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ALA  22           H        ALA  22   5.806  14.121  -7.767
    2    HA   ALA  22           HA       ALA  22   5.217  15.936  -5.702
    3    HB3  ALA  22           HB1      ALA  22   4.432  13.551  -5.866
    4    HB2  ALA  22           HB2      ALA  22   5.021  14.017  -4.270
    5    HB1  ALA  22           HB3      ALA  22   6.037  13.049  -5.339

  No H/Q in entry =           5
  In of MODEL    9
    1    H    TYR  23           H        TYR  23   8.131  13.881  -6.133
    2    HA   TYR  23           HA       TYR  23   9.519  14.887  -3.877
    3    HB2  TYR  23           HB2      TYR  23  10.289  12.871  -5.033
    4    HB3  TYR  23           HB3      TYR  23  10.616  13.807  -6.492
    5    HD1  TYR  23           HD1      TYR  23  11.557  13.484  -2.891
    6    HD2  TYR  23           HD2      TYR  23  12.671  14.934  -6.779
    7    HE1  TYR  23           HE1      TYR  23  13.819  14.040  -2.037
    8    HE2  TYR  23           HE2      TYR  23  14.931  15.490  -5.924
    9    HH   TYR  23           HH       TYR  23  15.719  15.934  -2.963

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ALA  24           H        ALA  24   9.355  15.995  -7.244
    2    HA   ALA  24           HA       ALA  24  11.269  18.062  -6.993
    3    HB2  ALA  24           HB1      ALA  24  10.833  18.128  -9.203
    4    HB3  ALA  24           HB2      ALA  24   9.283  18.892  -8.848
    5    HB1  ALA  24           HB3      ALA  24   9.393  17.138  -8.977

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA  25           H        ALA  25   7.787  17.910  -6.381
    2    HA   ALA  25           HA       ALA  25   7.330  20.632  -5.814
    3    HB1  ALA  25           HB1      ALA  25   5.652  18.648  -6.018
    4    HB2  ALA  25           HB2      ALA  25   5.292  19.940  -4.871
    5    HB3  ALA  25           HB3      ALA  25   5.967  18.414  -4.298

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU  26           H        LEU  26   8.370  17.944  -3.760
    2    HA   LEU  26           HA       LEU  26   8.481  19.375  -1.324
    3    HB2  LEU  26           HB2      LEU  26   8.556  16.957  -1.317
    4    HB3  LEU  26           HB3      LEU  26  10.028  16.952  -2.284
    5    HG   LEU  26           HG       LEU  26  11.248  18.061  -0.441
    6   HD12  LEU  26          HD11      LEU  26  10.017  18.080   1.815
    7   HD11  LEU  26          HD12      LEU  26   8.530  17.954   0.877
    8   HD13  LEU  26          HD13      LEU  26   9.587  19.351   0.670
    9   HD21  LEU  26          HD21      LEU  26   9.692  15.606   0.429
   10   HD23  LEU  26          HD22      LEU  26  11.210  16.156   1.129
   11   HD22  LEU  26          HD23      LEU  26  11.165  15.597  -0.540

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LYS  27           H        LYS  27  10.899  18.781  -3.842
    2    HA   LYS  27           HA       LYS  27  13.090  20.005  -2.610
    3    HB2  LYS  27           HB2      LYS  27  13.186  18.656  -4.699
    4    HB3  LYS  27           HB3      LYS  27  12.434  19.994  -5.566
    5    HG2  LYS  27           HG2      LYS  27  14.309  21.465  -4.985
    6    HG3  LYS  27           HG3      LYS  27  15.057  20.167  -4.046
    7    HD2  LYS  27           HD2      LYS  27  15.194  18.778  -6.099
    8    HD3  LYS  27           HD3      LYS  27  14.492  20.101  -7.030
    9    HE2  LYS  27           HE2      LYS  27  16.389  21.553  -6.413
   10    HE3  LYS  27           HE3      LYS  27  17.096  20.233  -5.473
   11    HZ3  LYS  27           HZ1      LYS  27  18.092  20.324  -7.658
   12    HZ2  LYS  27           HZ2      LYS  27  16.566  20.218  -8.402
   13    HZ1  LYS  27           HZ3      LYS  27  17.177  18.903  -7.515

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLN  28           H        GLN  28  10.483  21.406  -4.565
    2    HA   GLN  28           HA       GLN  28  11.463  24.051  -4.717
    3    HB2  GLN  28           HB2      GLN  28   8.621  23.003  -4.611
    4    HB3  GLN  28           HB3      GLN  28   9.048  24.671  -4.987
    5    HG2  GLN  28           HG2      GLN  28  10.034  22.251  -6.525
    6    HG3  GLN  28           HG3      GLN  28   8.702  23.288  -7.034
    7   HE21  GLN  28          HE21      GLN  28  11.853  22.786  -7.740
    8   HE22  GLN  28          HE22      GLN  28  12.337  24.368  -8.121

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ALA  29           H        ALA  29   9.513  22.375  -2.284
    2    HA   ALA  29           HA       ALA  29   8.976  24.571  -0.605
    3    HB2  ALA  29           HB1      ALA  29   8.231  23.009   0.962
    4    HB1  ALA  29           HB2      ALA  29   9.445  21.816   0.501
    5    HB3  ALA  29           HB3      ALA  29   8.064  22.119  -0.551

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LYS  30           H        LYS  30  11.690  22.284  -0.667
    2    HA   LYS  30           HA       LYS  30  13.009  23.230   1.638
    3    HB2  LYS  30           HB2      LYS  30  14.102  21.935  -0.869
    4    HB3  LYS  30           HB3      LYS  30  15.084  22.287   0.555
    5    HG2  LYS  30           HG2      LYS  30  13.517  20.916   1.931
    6    HG3  LYS  30           HG3      LYS  30  12.633  20.500   0.460
    7    HD2  LYS  30           HD2      LYS  30  14.672  19.499  -0.496
    8    HD3  LYS  30           HD3      LYS  30  15.576  19.929   0.958
    9    HE2  LYS  30           HE2      LYS  30  14.058  18.509   2.309
   10    HE3  LYS  30           HE3      LYS  30  13.184  18.059   0.840
   11    HZ2  LYS  30           HZ1      LYS  30  14.963  16.468   1.605
   12    HZ1  LYS  30           HZ2      LYS  30  16.109  17.647   1.156
   13    HZ3  LYS  30           HZ3      LYS  30  15.071  16.970  -0.011

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLN  31           H        GLN  31  12.916  24.434  -1.659
    2    HA   GLN  31           HA       GLN  31  15.081  26.312  -1.234
    3    HB2  GLN  31           HB2      GLN  31  13.044  26.372  -3.463
    4    HB3  GLN  31           HB3      GLN  31  14.669  27.056  -3.460
    5    HG2  GLN  31           HG2      GLN  31  15.110  24.357  -2.883
    6    HG3  GLN  31           HG3      GLN  31  13.809  24.312  -4.064
    7   HE21  GLN  31          HE21      GLN  31  16.647  23.498  -4.461
    8   HE22  GLN  31          HE22      GLN  31  17.229  24.467  -5.727

  No H/Q in entry =           8
  In of MODEL    9
    1    H    GLY  32           H        GLY  32  12.003  26.152  -0.095
    2    HA3  GLY  32           HA2      GLY  32  10.855  27.729   1.175
    3    HA2  GLY  32           HA3      GLY  32  11.991  28.956   0.627

  No H/Q in entry =           3
  In of MODEL    9
    1    H    ASP  33           H        ASP  33  10.618  27.060  -1.868
    2    HA   ASP  33           HA       ASP  33   8.972  29.345  -2.728
    3    HB2  ASP  33           HB2      ASP  33  10.051  26.917  -4.167
    4    HB3  ASP  33           HB3      ASP  33   8.910  28.040  -4.900

  No H/Q in entry =           4
  In of MODEL    9
    1    H    PHE  34           H        PHE  34   7.277  28.882  -1.168
    2    HA   PHE  34           HA       PHE  34   5.880  26.419  -1.074
    3    HB2  PHE  34           HB2      PHE  34   4.937  29.213  -0.398
    4    HB3  PHE  34           HB3      PHE  34   4.077  27.729   0.012
    5    HD1  PHE  34           HD1      PHE  34   6.341  30.112   1.231
    6    HD2  PHE  34           HD2      PHE  34   5.631  25.876   1.178
    7    HE1  PHE  34           HE1      PHE  34   7.725  29.853   3.270
    8    HE2  PHE  34           HE2      PHE  34   7.017  25.621   3.215
    9    HZ   PHE  34           HZ       PHE  34   8.059  27.610   4.261

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ALA  35           H        ALA  35   5.474  29.285  -3.087
    2    HA   ALA  35           HA       ALA  35   2.921  28.688  -4.118
    3    HB1  ALA  35           HB1      ALA  35   3.987  30.072  -6.154
    4    HB3  ALA  35           HB2      ALA  35   5.204  30.426  -4.927
    5    HB2  ALA  35           HB3      ALA  35   3.516  30.847  -4.640

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA  36           H        ALA  36   6.147  27.992  -5.465
    2    HA   ALA  36           HA       ALA  36   5.154  26.569  -7.710
    3    HB3  ALA  36           HB1      ALA  36   7.315  26.678  -8.321
    4    HB2  ALA  36           HB2      ALA  36   7.786  25.646  -6.969
    5    HB1  ALA  36           HB3      ALA  36   7.692  27.395  -6.754

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA  37           H        ALA  37   6.095  25.569  -4.452
    2    HA   ALA  37           HA       ALA  37   6.018  22.781  -4.880
    3    HB2  ALA  37           HB1      ALA  37   5.764  24.575  -2.503
    4    HB1  ALA  37           HB2      ALA  37   6.889  23.249  -2.793
    5    HB3  ALA  37           HB3      ALA  37   5.224  22.907  -2.325

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LYS  38           H        LYS  38   3.498  25.007  -3.719
    2    HA   LYS  38           HA       LYS  38   1.386  23.209  -3.500
    3    HB2  LYS  38           HB2      LYS  38   1.756  25.962  -3.249
    4    HB3  LYS  38           HB3      LYS  38   0.558  25.823  -4.531
    5    HG2  LYS  38           HG2      LYS  38  -0.904  24.510  -3.091
    6    HG3  LYS  38           HG3      LYS  38   0.337  24.442  -1.832
    7    HD2  LYS  38           HD2      LYS  38   0.167  26.780  -1.386
    8    HD3  LYS  38           HD3      LYS  38  -0.740  27.075  -2.870
    9    HE2  LYS  38           HE2      LYS  38  -2.247  27.120  -0.934
   10    HE3  LYS  38           HE3      LYS  38  -2.629  25.746  -1.976
   11    HZ3  LYS  38           HZ1      LYS  38  -1.917  24.271  -0.441
   12    HZ2  LYS  38           HZ2      LYS  38  -2.261  25.531   0.647
   13    HZ1  LYS  38           HZ3      LYS  38  -0.667  25.269   0.125

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ALA  39           H        ALA  39   2.385  25.103  -6.347
    2    HA   ALA  39           HA       ALA  39   0.307  24.249  -8.055
    3    HB2  ALA  39           HB1      ALA  39   3.050  24.878  -9.102
    4    HB1  ALA  39           HB2      ALA  39   2.090  26.146  -8.340
    5    HB3  ALA  39           HB3      ALA  39   1.475  25.313  -9.767

  No H/Q in entry =           5
  In of MODEL    9
    1    H    MET  40           H        MET  40   3.535  22.929  -7.467
    2    HA   MET  40           HA       MET  40   3.428  20.908  -9.458
    3    HB2  MET  40           HB2      MET  40   5.035  21.122  -6.906
    4    HB3  MET  40           HB3      MET  40   5.280  19.864  -8.119
    5    HG2  MET  40           HG2      MET  40   5.359  22.819  -8.786
    6    HG3  MET  40           HG3      MET  40   6.798  21.907  -8.333
    7    HE3  MET  40           HE1      MET  40   7.661  19.685 -11.139
    8    HE2  MET  40           HE2      MET  40   7.092  19.370  -9.502
    9    HE1  MET  40           HE3      MET  40   8.197  20.709  -9.800

  No H/Q in entry =           9
  In of MODEL    9
    1    H    MET  41           H        MET  41   2.505  20.958  -6.036
    2    HA   MET  41           HA       MET  41   1.954  18.197  -5.758
    3    HB2  MET  41           HB2      MET  41   0.634  20.564  -4.411
    4    HB3  MET  41           HB3      MET  41   0.466  18.888  -3.903
    5    HG2  MET  41           HG2      MET  41   3.178  19.093  -3.934
    6    HG3  MET  41           HG3      MET  41   2.747  20.754  -3.540
    7    HE2  MET  41           HE1      MET  41  -0.304  19.522  -1.821
    8    HE1  MET  41           HE2      MET  41   0.523  21.030  -2.197
    9    HE3  MET  41           HE3      MET  41   0.457  20.460  -0.529

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ASP  42           H        ASP  42  -0.064  20.935  -6.738
    2    HA   ASP  42           HA       ASP  42  -2.514  19.590  -6.880
    3    HB2  ASP  42           HB2      ASP  42  -1.790  22.155  -7.136
    4    HB3  ASP  42           HB3      ASP  42  -1.939  21.761  -8.844

  No H/Q in entry =           4
  In of MODEL    9
    1    H    GLN  43           H        GLN  43  -0.064  20.164  -9.376
    2    HA   GLN  43           HA       GLN  43  -1.454  18.852 -11.468
    3    HB2  GLN  43           HB2      GLN  43   1.506  19.350 -11.080
    4    HB3  GLN  43           HB3      GLN  43   0.792  18.714 -12.564
    5    HG2  GLN  43           HG2      GLN  43  -0.707  20.751 -12.609
    6    HG3  GLN  43           HG3      GLN  43   0.247  21.401 -11.280
    7   HE21  GLN  43          HE21      GLN  43   0.424  23.020 -13.366
    8   HE22  GLN  43          HE22      GLN  43   1.839  22.789 -14.270

  No H/Q in entry =           8
  In of MODEL    9
    1    H    SER  44           H        SER  44   0.884  17.699  -9.072
    2    HA   SER  44           HA       SER  44   1.205  15.089 -10.095
    3    HB2  SER  44           HB2      SER  44   2.104  16.524  -7.857
    4    HB3  SER  44           HB3      SER  44   1.231  15.146  -7.188
    5    HG   SER  44           HG       SER  44   3.339  14.513  -7.609

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ARG  45           H        ARG  45  -1.112  16.423  -7.763
    2    HA   ARG  45           HA       ARG  45  -2.515  14.071  -7.130
    3    HB2  ARG  45           HB2      ARG  45  -2.702  16.241  -5.940
    4    HB3  ARG  45           HB3      ARG  45  -3.551  16.912  -7.329
    5    HG2  ARG  45           HG2      ARG  45  -5.328  15.197  -7.049
    6    HG3  ARG  45           HG3      ARG  45  -4.491  14.581  -5.623
    7    HD2  ARG  45           HD2      ARG  45  -4.686  16.849  -4.569
    8    HD3  ARG  45           HD3      ARG  45  -5.667  17.374  -5.954
    9    HE   ARG  45           HE       ARG  45  -6.793  15.005  -4.915
   10   HH21  ARG  45          HH11      ARG  45  -8.632  15.092  -3.649
   11   HH22  ARG  45          HH12      ARG  45  -9.020  16.535  -2.781
   12   HH11  ARG  45          HH21      ARG  45  -6.231  18.249  -3.891
   13   HH12  ARG  45          HH22      ARG  45  -7.656  18.323  -2.917

  No H/Q in entry =          13
  In of MODEL    9
    1    H    MET  46           H        MET  46  -3.079  16.478  -9.683
    2    HA   MET  46           HA       MET  46  -5.422  15.318 -10.750
    3    HB2  MET  46           HB2      MET  46  -3.308  17.131 -11.921
    4    HB3  MET  46           HB3      MET  46  -4.692  16.584 -12.871
    5    HG2  MET  46           HG2      MET  46  -6.233  17.529 -11.223
    6    HG3  MET  46           HG3      MET  46  -4.884  18.012 -10.202
    7    HE3  MET  46           HE1      MET  46  -5.221  18.533 -14.367
    8    HE2  MET  46           HE2      MET  46  -6.468  19.738 -14.059
    9    HE1  MET  46           HE3      MET  46  -6.641  18.112 -13.402

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ALA  47           H        ALA  47  -1.995  14.819 -11.499
    2    HA   ALA  47           HA       ALA  47  -2.344  13.093 -13.710
    3    HB3  ALA  47           HB1      ALA  47  -0.163  13.970 -13.353
    4    HB2  ALA  47           HB2      ALA  47  -0.032  12.241 -13.018
    5    HB1  ALA  47           HB3      ALA  47  -0.121  13.394 -11.686

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU  48           H        LEU  48  -2.086  12.457 -10.235
    2    HA   LEU  48           HA       LEU  48  -2.196   9.618 -10.392
    3    HB2  LEU  48           HB2      LEU  48  -2.955  11.541  -8.181
    4    HB3  LEU  48           HB3      LEU  48  -2.871   9.790  -7.979
    5    HG   LEU  48           HG       LEU  48  -0.560  11.476  -8.972
    6   HD13  LEU  48          HD11      LEU  48  -0.844  12.249  -6.782
    7   HD12  LEU  48          HD12      LEU  48   0.312  10.935  -6.580
    8   HD11  LEU  48          HD13      LEU  48  -1.389  10.682  -6.187
    9   HD22  LEU  48          HD21      LEU  48  -0.072   9.288  -9.611
   10   HD21  LEU  48          HD22      LEU  48  -0.949   8.578  -8.256
   11   HD23  LEU  48          HD23      LEU  48   0.627   9.323  -7.993

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ASN  49           H        ASN  49  -4.647  12.124  -9.998
    2    HA   ASN  49           HA       ASN  49  -6.843  10.471  -9.463
    3    HB2  ASN  49           HB2      ASN  49  -6.881  12.897  -9.143
    4    HB3  ASN  49           HB3      ASN  49  -6.726  13.151 -10.877
    5   HD21  ASN  49          HD21      ASN  49  -8.922  14.248  -9.527
    6   HD22  ASN  49          HD22      ASN  49 -10.332  13.417  -9.972

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLU  50           H        GLU  50  -5.549  11.659 -12.547
    2    HA   GLU  50           HA       GLU  50  -7.506  10.414 -14.198
    3    HB2  GLU  50           HB2      GLU  50  -6.029  12.224 -15.009
    4    HB3  GLU  50           HB3      GLU  50  -4.641  11.145 -14.867
    5    HG2  GLU  50           HG2      GLU  50  -5.618   9.614 -16.505
    6    HG3  GLU  50           HG3      GLU  50  -7.074  10.600 -16.597

  No H/Q in entry =           6
  In of MODEL    9
    1    H    ALA  51           H        ALA  51  -4.344   9.405 -12.983
    2    HA   ALA  51           HA       ALA  51  -4.214   6.950 -14.400
    3    HB2  ALA  51           HB1      ALA  51  -2.238   6.652 -13.295
    4    HB1  ALA  51           HB2      ALA  51  -2.927   7.079 -11.729
    5    HB3  ALA  51           HB3      ALA  51  -2.462   8.347 -12.863

  No H/Q in entry =           5
  In of MODEL    9
    1    H    HIS  52           H        HIS  52  -5.391   7.790 -11.154
    2    HA   HIS  52           HA       HIS  52  -6.093   5.185 -10.323
    3    HB2  HIS  52           HB2      HIS  52  -5.946   7.159  -8.821
    4    HB3  HIS  52           HB3      HIS  52  -7.412   7.801  -9.562
    5    HD1  HIS  52           HD1      HIS  52  -9.640   6.440  -9.172
    6    HD2  HIS  52           HD2      HIS  52  -6.373   5.083  -6.967
    7    HE1  HIS  52           HE1      HIS  52 -10.568   4.900  -7.388
    8    HE2  HIS  52           HE2      HIS  52  -8.588   4.064  -6.034

  No H/Q in entry =           8
  In of MODEL    9
    1    H    LEU  53           H        LEU  53  -7.894   7.652 -12.117
    2    HA   LEU  53           HA       LEU  53 -10.407   6.374 -12.136
    3    HB2  LEU  53           HB2      LEU  53  -9.107   8.350 -13.999
    4    HB3  LEU  53           HB3      LEU  53 -10.705   7.690 -14.332
    5    HG   LEU  53           HG       LEU  53 -10.011   8.991 -11.681
    6   HD12  LEU  53          HD11      LEU  53 -11.293  10.969 -12.653
    7   HD11  LEU  53          HD12      LEU  53 -11.086  10.210 -14.233
    8   HD13  LEU  53          HD13      LEU  53  -9.679  10.719 -13.303
    9   HD21  LEU  53          HD21      LEU  53 -12.563   8.156 -13.072
   10   HD23  LEU  53          HD22      LEU  53 -12.579   9.411 -11.839
   11   HD22  LEU  53          HD23      LEU  53 -12.055   7.790 -11.429

  No H/Q in entry =          11
  In of MODEL    9
    1    H    VAL  54           H        VAL  54  -7.652   6.160 -14.365
    2    HA   VAL  54           HA       VAL  54  -8.880   4.395 -16.211
    3    HB   VAL  54           HB       VAL  54  -5.971   4.885 -15.521
    4   HG12  VAL  54          HG11      VAL  54  -5.724   3.797 -17.909
    5   HG11  VAL  54          HG12      VAL  54  -7.258   3.025 -17.509
    6   HG13  VAL  54          HG13      VAL  54  -5.847   2.763 -16.486
    7   HG22  VAL  54          HG21      VAL  54  -6.726   6.832 -16.569
    8   HG21  VAL  54          HG22      VAL  54  -7.922   5.975 -17.540
    9   HG23  VAL  54          HG23      VAL  54  -6.215   5.885 -17.965

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLN  55           H        GLN  55  -6.893   3.838 -13.306
    2    HA   GLN  55           HA       GLN  55  -6.819   1.021 -13.560
    3    HB2  GLN  55           HB2      GLN  55  -5.263   1.908 -12.037
    4    HB3  GLN  55           HB3      GLN  55  -6.475   2.882 -11.211
    5    HG2  GLN  55           HG2      GLN  55  -7.178   1.130  -9.895
    6    HG3  GLN  55           HG3      GLN  55  -6.958  -0.059 -11.172
    7   HE21  GLN  55          HE21      GLN  55  -5.345  -1.518 -10.672
    8   HE22  GLN  55          HE22      GLN  55  -3.960  -1.175  -9.757

  No H/Q in entry =           8
  In of MODEL    9
    1    H    THR  56           H        THR  56  -9.142   3.199 -11.953
    2    HA   THR  56           HA       THR  56 -10.741   1.327 -10.668
    3    HB   THR  56           HB       THR  56 -11.814   3.723 -12.178
    4    HG1  THR  56           HG1      THR  56  -9.998   3.609 -10.229
    5   HG22  THR  56          HG21      THR  56 -12.721   2.573  -9.540
    6   HG21  THR  56          HG22      THR  56 -13.365   1.996 -11.078
    7   HG23  THR  56          HG23      THR  56 -13.587   3.680 -10.603

  No H/Q in entry =           7
  In of MODEL    9
    1    H    LYS  57           H        LYS  57 -10.927   2.409 -14.055
    2    HA   LYS  57           HA       LYS  57 -13.091   0.735 -14.814
    3    HB2  LYS  57           HB2      LYS  57 -12.187   2.684 -16.125
    4    HB3  LYS  57           HB3      LYS  57 -10.766   1.719 -16.500
    5    HG2  LYS  57           HG2      LYS  57 -12.161   0.067 -17.654
    6    HG3  LYS  57           HG3      LYS  57 -13.610   0.977 -17.243
    7    HD2  LYS  57           HD2      LYS  57 -12.776   2.901 -18.554
    8    HD3  LYS  57           HD3      LYS  57 -11.328   1.989 -18.975
    9    HE2  LYS  57           HE2      LYS  57 -12.957   1.854 -20.811
   10    HE3  LYS  57           HE3      LYS  57 -12.772   0.262 -20.077
   11    HZ1  LYS  57           HZ1      LYS  57 -14.929   2.201 -19.451
   12    HZ3  LYS  57           HZ2      LYS  57 -14.757   0.648 -18.782
   13    HZ2  LYS  57           HZ3      LYS  57 -15.094   0.832 -20.439

  No H/Q in entry =          13
  In of MODEL    9
    1    H    LEU  58           H        LEU  58  -9.590   0.282 -14.746
    2    HA   LEU  58           HA       LEU  58  -9.611  -2.236 -16.033
    3    HB2  LEU  58           HB2      LEU  58  -7.573  -0.956 -14.219
    4    HB3  LEU  58           HB3      LEU  58  -7.320  -2.480 -15.072
    5    HG   LEU  58           HG       LEU  58  -8.053   0.128 -16.439
    6   HD11  LEU  58          HD11      LEU  58  -5.417  -1.125 -15.739
    7   HD13  LEU  58          HD12      LEU  58  -5.901   0.569 -15.693
    8   HD12  LEU  58          HD13      LEU  58  -5.562  -0.206 -17.238
    9   HD22  LEU  58          HD21      LEU  58  -8.634  -1.432 -18.031
   10   HD21  LEU  58          HD22      LEU  58  -7.603  -2.685 -17.345
   11   HD23  LEU  58          HD23      LEU  58  -6.901  -1.417 -18.349

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  59           H        ILE  59 -10.436  -1.326 -12.785
    2    HA   ILE  59           HA       ILE  59 -10.105  -4.094 -11.834
    3    HB   ILE  59           HB       ILE  59  -9.657  -1.823 -10.438
    4   HG12  ILE  59          HG12      ILE  59 -11.023  -4.172  -9.110
    5   HG13  ILE  59          HG13      ILE  59  -9.384  -4.258  -9.703
    6   HG22  ILE  59          HG21      ILE  59 -12.415  -2.547  -9.493
    7   HG21  ILE  59          HG22      ILE  59 -12.198  -1.309 -10.708
    8   HG23  ILE  59          HG23      ILE  59 -11.475  -1.124  -9.112
    9   HD12  ILE  59          HD11      ILE  59 -10.440  -2.342  -7.637
   10   HD11  ILE  59          HD12      ILE  59  -8.817  -2.254  -8.309
   11   HD13  ILE  59          HD13      ILE  59  -9.303  -3.657  -7.355

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLU  60           H        GLU  60 -12.646  -1.764 -12.652
    2    HA   GLU  60           HA       GLU  60 -14.844  -3.266 -11.645
    3    HB2  GLU  60           HB2      GLU  60 -15.071  -0.906 -12.228
    4    HB3  GLU  60           HB3      GLU  60 -14.693  -1.257 -13.911
    5    HG2  GLU  60           HG2      GLU  60 -16.719  -2.675 -14.063
    6    HG3  GLU  60           HG3      GLU  60 -17.107  -2.285 -12.399

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLY  61           H        GLY  61 -13.160  -3.263 -14.754
    2    HA3  GLY  61           HA2      GLY  61 -14.884  -5.499 -15.648
    3    HA2  GLY  61           HA3      GLY  61 -14.029  -4.400 -16.724

  No H/Q in entry =           3
  In of MODEL    9
    1    H    ASP  62           H        ASP  62 -12.672  -5.854 -13.834
    2    HA   ASP  62           HA       ASP  62 -10.433  -6.870 -15.323
    3    HB2  ASP  62           HB2      ASP  62  -9.664  -7.621 -13.086
    4    HB3  ASP  62           HB3      ASP  62 -10.124  -5.922 -13.101

  No H/Q in entry =           4
  In of MODEL    9
    1    H    ALA  63           H        ALA  63 -11.996  -8.305 -16.695
    2    HA   ALA  63           HA       ALA  63 -13.116 -10.685 -15.580
    3    HB1  ALA  63           HB1      ALA  63 -13.916 -10.094 -17.726
    4    HB3  ALA  63           HB2      ALA  63 -12.848 -11.456 -18.062
    5    HB2  ALA  63           HB3      ALA  63 -12.292  -9.806 -18.348

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLY  64           H        GLY  64  -9.998  -9.883 -16.999
    2    HA3  GLY  64           HA2      GLY  64  -7.928 -10.870 -16.716
    3    HA2  GLY  64           HA3      GLY  64  -8.667 -12.029 -15.618

  No H/Q in entry =           3
  In of MODEL    9
    1    H    GLU  65           H        GLU  65  -6.866 -13.147 -17.167
    2    HA   GLU  65           HA       GLU  65  -7.708 -13.902 -19.759
    3    HB2  GLU  65           HB2      GLU  65  -5.726 -15.153 -17.861
    4    HB3  GLU  65           HB3      GLU  65  -5.982 -15.715 -19.514
    5    HG2  GLU  65           HG2      GLU  65  -5.404 -13.509 -20.390
    6    HG3  GLU  65           HG3      GLU  65  -5.226 -12.881 -18.753

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLY  66           H        GLY  66  -8.107 -15.380 -16.634
    2    HA3  GLY  66           HA2      GLY  66  -9.674 -17.596 -17.752
    3    HA2  GLY  66           HA3      GLY  66  -8.948 -17.562 -16.157

  No H/Q in entry =           3
  In of MODEL    9
    1    H    LYS  67           H        LYS  67 -11.560 -18.331 -16.599
    2    HA   LYS  67           HA       LYS  67 -13.659 -16.705 -16.567
    3    HB2  LYS  67           HB2      LYS  67 -14.512 -18.275 -14.600
    4    HB3  LYS  67           HB3      LYS  67 -14.261 -18.885 -16.241
    5    HG2  LYS  67           HG2      LYS  67 -12.039 -19.677 -15.671
    6    HG3  LYS  67           HG3      LYS  67 -12.138 -18.930 -14.077
    7    HD2  LYS  67           HD2      LYS  67 -14.005 -20.435 -13.486
    8    HD3  LYS  67           HD3      LYS  67 -13.900 -21.184 -15.082
    9    HE2  LYS  67           HE2      LYS  67 -11.584 -21.884 -14.616
   10    HE3  LYS  67           HE3      LYS  67 -11.664 -21.114 -13.031
   11    HZ3  LYS  67           HZ1      LYS  67 -12.494 -23.000 -12.258
   12    HZ2  LYS  67           HZ2      LYS  67 -12.580 -23.672 -13.815
   13    HZ1  LYS  67           HZ3      LYS  67 -13.877 -22.759 -13.208

  No H/Q in entry =          13
  In of MODEL    9
    1    H    MET  68           H        MET  68 -13.119 -17.712 -13.333
    2    HA   MET  68           HA       MET  68 -14.051 -15.353 -12.136
    3    HB2  MET  68           HB2      MET  68 -12.441 -17.627 -10.973
    4    HB3  MET  68           HB3      MET  68 -13.280 -16.396 -10.029
    5    HG2  MET  68           HG2      MET  68 -14.616 -18.244 -12.027
    6    HG3  MET  68           HG3      MET  68 -14.628 -18.474 -10.278
    7    HE2  MET  68           HE1      MET  68 -15.121 -15.447  -9.026
    8    HE1  MET  68           HE2      MET  68 -15.455 -17.138  -8.656
    9    HE3  MET  68           HE3      MET  68 -16.786 -15.988  -8.760

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LYS  69           H        LYS  69 -10.680 -16.452 -12.626
    2    HA   LYS  69           HA       LYS  69  -9.387 -14.654 -10.978
    3    HB2  LYS  69           HB2      LYS  69  -8.513 -15.899 -13.582
    4    HB3  LYS  69           HB3      LYS  69  -7.423 -14.969 -12.549
    5    HG2  LYS  69           HG2      LYS  69  -7.933 -16.483 -10.657
    6    HG3  LYS  69           HG3      LYS  69  -8.999 -17.420 -11.702
    7    HD2  LYS  69           HD2      LYS  69  -7.095 -17.953 -13.177
    8    HD3  LYS  69           HD3      LYS  69  -6.024 -17.018 -12.132
    9    HE2  LYS  69           HE2      LYS  69  -6.548 -18.516 -10.244
   10    HE3  LYS  69           HE3      LYS  69  -7.627 -19.449 -11.279
   11    HZ3  LYS  69           HZ1      LYS  69  -5.554 -20.562 -11.225
   12    HZ2  LYS  69           HZ2      LYS  69  -4.692 -19.136 -11.550
   13    HZ1  LYS  69           HZ3      LYS  69  -5.672 -19.833 -12.751

  No H/Q in entry =          13
  In of MODEL    9
    1    H    VAL  70           H        VAL  70  -7.708 -12.957 -11.827
    2    HA   VAL  70           HA       VAL  70  -9.061 -11.024 -13.621
    3    HB   VAL  70           HB       VAL  70  -8.257  -9.230 -12.109
    4   HG11  VAL  70          HG11      VAL  70 -10.537 -10.464 -11.923
    5   HG13  VAL  70          HG12      VAL  70 -10.034  -9.451 -10.569
    6   HG12  VAL  70          HG13      VAL  70  -9.850 -11.202 -10.476
    7   HG22  VAL  70          HG21      VAL  70  -6.357 -10.335 -11.059
    8   HG21  VAL  70          HG22      VAL  70  -7.405 -11.589 -10.399
    9   HG23  VAL  70          HG23      VAL  70  -7.514  -9.939  -9.789

  No H/Q in entry =           9
  In of MODEL    9
    1    H    SER  71           H        SER  71  -7.525  -9.337 -14.404
    2    HA   SER  71           HA       SER  71  -5.280 -10.463 -15.692
    3    HB2  SER  71           HB2      SER  71  -6.498  -8.432 -16.484
    4    HB3  SER  71           HB3      SER  71  -5.826  -7.539 -15.123
    5    HG   SER  71           HG       SER  71  -4.375  -8.872 -17.172

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU  72           H        LEU  72  -3.249 -10.758 -15.049
    2    HA   LEU  72           HA       LEU  72  -2.536 -10.544 -12.335
    3    HB2  LEU  72           HB2      LEU  72  -0.877 -10.987 -14.813
    4    HB3  LEU  72           HB3      LEU  72  -0.221 -11.063 -13.180
    5    HG   LEU  72           HG       LEU  72  -2.585 -12.737 -14.084
    6   HD11  LEU  72          HD11      LEU  72   0.362 -13.455 -13.972
    7   HD13  LEU  72          HD12      LEU  72  -0.620 -13.324 -15.431
    8   HD12  LEU  72          HD13      LEU  72  -0.951 -14.599 -14.259
    9   HD23  LEU  72          HD21      LEU  72  -1.596 -14.158 -12.115
   10   HD22  LEU  72          HD22      LEU  72  -2.567 -12.750 -11.713
   11   HD21  LEU  72          HD23      LEU  72  -0.809 -12.656 -11.644

  No H/Q in entry =          11
  In of MODEL    9
    1    H    VAL  73           H        VAL  73  -1.797  -8.537 -15.116
    2    HA   VAL  73           HA       VAL  73   0.132  -6.850 -14.009
    3    HB   VAL  73           HB       VAL  73  -0.249  -5.428 -15.867
    4   HG13  VAL  73          HG11      VAL  73  -0.080  -6.968 -17.663
    5   HG12  VAL  73          HG12      VAL  73  -1.126  -8.141 -16.863
    6   HG11  VAL  73          HG13      VAL  73   0.506  -7.859 -16.260
    7   HG23  VAL  73          HG21      VAL  73  -2.412  -6.009 -17.275
    8   HG22  VAL  73          HG22      VAL  73  -2.515  -4.901 -15.909
    9   HG21  VAL  73          HG23      VAL  73  -3.016  -6.582 -15.720

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LEU  74           H        LEU  74  -3.268  -6.941 -13.462
    2    HA   LEU  74           HA       LEU  74  -3.869  -4.280 -12.855
    3    HB2  LEU  74           HB2      LEU  74  -5.612  -5.927 -13.031
    4    HB3  LEU  74           HB3      LEU  74  -4.929  -6.863 -11.704
    5    HG   LEU  74           HG       LEU  74  -5.383  -5.003 -10.148
    6   HD11  LEU  74          HD11      LEU  74  -6.349  -3.690 -12.691
    7   HD13  LEU  74          HD12      LEU  74  -5.223  -3.053 -11.494
    8   HD12  LEU  74          HD13      LEU  74  -6.940  -3.180 -11.110
    9   HD22  LEU  74          HD21      LEU  74  -7.582  -5.574  -9.905
   10   HD21  LEU  74          HD22      LEU  74  -7.103  -6.781 -11.078
   11   HD23  LEU  74          HD23      LEU  74  -7.941  -5.345 -11.614

  No H/Q in entry =          11
  In of MODEL    9
    1    H    VAL  75           H        VAL  75  -2.854  -6.871 -10.687
    2    HA   VAL  75           HA       VAL  75  -2.652  -5.318  -8.344
    3    HB   VAL  75           HB       VAL  75  -1.160  -7.821  -9.122
    4   HG12  VAL  75          HG11      VAL  75  -0.743  -7.976  -6.639
    5   HG11  VAL  75          HG12      VAL  75  -1.404  -6.356  -6.469
    6   HG13  VAL  75          HG13      VAL  75   0.077  -6.606  -7.380
    7   HG22  VAL  75          HG21      VAL  75  -2.863  -8.949  -7.883
    8   HG21  VAL  75          HG22      VAL  75  -3.726  -7.796  -8.900
    9   HG23  VAL  75          HG23      VAL  75  -3.466  -7.443  -7.191

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLU  76           H        GLU  76  -0.240  -6.099 -10.871
    2    HA   GLU  76           HA       GLU  76   1.951  -4.766  -9.709
    3    HB2  GLU  76           HB2      GLU  76   2.109  -6.255 -11.706
    4    HB3  GLU  76           HB3      GLU  76   1.269  -5.042 -12.658
    5    HG2  GLU  76           HG2      GLU  76   3.101  -3.444 -12.288
    6    HG3  GLU  76           HG3      GLU  76   3.955  -4.605 -11.291

  No H/Q in entry =           6
  In of MODEL    9
    1    H    ALA  77           H        ALA  77  -0.564  -3.550 -11.907
    2    HA   ALA  77           HA       ALA  77   0.445  -0.911 -12.083
    3    HB3  ALA  77           HB1      ALA  77  -2.439  -1.816 -12.305
    4    HB1  ALA  77           HB2      ALA  77  -1.263  -1.878 -13.619
    5    HB2  ALA  77           HB3      ALA  77  -1.753  -0.323 -12.947

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLN  78           H        GLN  78  -1.841  -2.447  -9.878
    2    HA   GLN  78           HA       GLN  78  -2.637  -0.121  -8.483
    3    HB2  GLN  78           HB2      GLN  78  -3.758  -2.378  -8.401
    4    HB3  GLN  78           HB3      GLN  78  -2.433  -2.938  -7.384
    5    HG2  GLN  78           HG2      GLN  78  -2.956  -1.186  -5.736
    6    HG3  GLN  78           HG3      GLN  78  -4.285  -0.626  -6.749
    7   HE21  GLN  78          HE21      GLN  78  -6.117  -1.259  -5.533
    8   HE22  GLN  78          HE22      GLN  78  -6.406  -2.854  -5.025

  No H/Q in entry =           8
  In of MODEL    9
    1    H    LEU  79           H        LEU  79   0.025  -2.395  -8.020
    2    HA   LEU  79           HA       LEU  79   0.998  -1.501  -5.561
    3    HB2  LEU  79           HB2      LEU  79   1.859  -3.517  -6.623
    4    HB3  LEU  79           HB3      LEU  79   2.515  -2.571  -7.955
    5    HG   LEU  79           HG       LEU  79   4.073  -1.440  -6.448
    6   HD13  LEU  79          HD11      LEU  79   3.063  -1.185  -4.384
    7   HD12  LEU  79          HD12      LEU  79   4.132  -2.541  -4.035
    8   HD11  LEU  79          HD13      LEU  79   2.426  -2.830  -4.370
    9   HD23  LEU  79          HD21      LEU  79   5.267  -3.594  -5.537
   10   HD22  LEU  79          HD22      LEU  79   5.071  -3.396  -7.276
   11   HD21  LEU  79          HD23      LEU  79   3.983  -4.458  -6.386

  No H/Q in entry =          11
  In of MODEL    9
    1    H    HIS  80           H        HIS  80   1.887  -0.394  -8.832
    2    HA   HIS  80           HA       HIS  80   3.703   1.584  -7.906
    3    HB2  HIS  80           HB2      HIS  80   2.419   0.894 -10.493
    4    HB3  HIS  80           HB3      HIS  80   3.023   2.542 -10.322
    5    HD1  HIS  80           HD1      HIS  80   5.428   2.828 -10.836
    6    HD2  HIS  80           HD2      HIS  80   4.581  -1.076  -9.642
    7    HE1  HIS  80           HE1      HIS  80   7.611   1.538 -10.992
    8    HE2  HIS  80           HE2      HIS  80   7.106  -0.845 -10.268

  No H/Q in entry =           8
  In of MODEL    9
    1    H    LEU  81           H        LEU  81   0.304   1.762  -8.898
    2    HA   LEU  81           HA       LEU  81   0.043   4.557  -8.572
    3    HB2  LEU  81           HB2      LEU  81  -1.984   2.322  -8.498
    4    HB3  LEU  81           HB3      LEU  81  -2.427   4.028  -8.409
    5    HG   LEU  81           HG       LEU  81  -0.732   2.866 -10.638
    6   HD12  LEU  81          HD11      LEU  81  -2.958   3.196 -11.945
    7   HD11  LEU  81          HD12      LEU  81  -3.720   3.134 -10.357
    8   HD13  LEU  81          HD13      LEU  81  -2.782   1.760 -10.938
    9   HD23  LEU  81          HD21      LEU  81  -1.814   5.015 -11.742
   10   HD22  LEU  81          HD22      LEU  81  -0.400   5.179 -10.703
   11   HD21  LEU  81          HD23      LEU  81  -2.005   5.537 -10.069

  No H/Q in entry =          11
  In of MODEL    9
    1    H    MET  82           H        MET  82  -0.638   1.876  -6.322
    2    HA   MET  82           HA       MET  82  -1.690   3.470  -4.241
    3    HB2  MET  82           HB2      MET  82  -0.330   0.776  -4.272
    4    HB3  MET  82           HB3      MET  82  -0.910   1.506  -2.777
    5    HG2  MET  82           HG2      MET  82  -2.636   1.018  -5.224
    6    HG3  MET  82           HG3      MET  82  -2.569  -0.054  -3.827
    7    HE3  MET  82           HE1      MET  82  -4.294   1.608  -1.021
    8    HE2  MET  82           HE2      MET  82  -2.562   1.877  -1.199
    9    HE1  MET  82           HE3      MET  82  -3.256   0.322  -1.654

  No H/Q in entry =           9
  In of MODEL    9
    1    H    THR  83           H        THR  83   1.608   2.368  -4.917
    2    HA   THR  83           HA       THR  83   2.822   3.469  -2.613
    3    HB   THR  83           HB       THR  83   4.922   3.401  -4.079
    4    HG1  THR  83           HG1      THR  83   4.687   2.874  -6.103
    5   HG22  THR  83          HG21      THR  83   4.466   0.745  -4.410
    6   HG21  THR  83          HG22      THR  83   3.174   1.132  -3.275
    7   HG23  THR  83          HG23      THR  83   4.854   1.468  -2.849

  No H/Q in entry =           7
  In of MODEL    9
    1    H    SER  84           H        SER  84   2.470   4.746  -5.916
    2    HA   SER  84           HA       SER  84   3.819   7.180  -5.459
    3    HB2  SER  84           HB2      SER  84   1.753   6.355  -7.485
    4    HB3  SER  84           HB3      SER  84   2.439   7.979  -7.459
    5    HG   SER  84           HG       SER  84   3.801   5.497  -7.742

  No H/Q in entry =           5
  In of MODEL    9
    1    H    MET  85           H        MET  85   0.321   6.441  -5.300
    2    HA   MET  85           HA       MET  85  -0.530   9.056  -4.705
    3    HB2  MET  85           HB2      MET  85  -2.065   7.268  -5.377
    4    HB3  MET  85           HB3      MET  85  -1.776   6.441  -3.847
    5    HG2  MET  85           HG2      MET  85  -2.664   8.374  -2.614
    6    HG3  MET  85           HG3      MET  85  -2.910   9.239  -4.129
    7    HE2  MET  85           HE1      MET  85  -6.552   8.464  -3.088
    8    HE1  MET  85           HE2      MET  85  -5.324   9.686  -3.408
    9    HE3  MET  85           HE3      MET  85  -5.228   8.714  -1.943

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LEU  86           H        LEU  86   0.369   6.391  -2.555
    2    HA   LEU  86           HA       LEU  86  -0.167   7.700  -0.116
    3    HB2  LEU  86           HB2      LEU  86   0.285   5.226  -0.505
    4    HB3  LEU  86           HB3      LEU  86   1.995   5.646  -0.595
    5    HG   LEU  86           HG       LEU  86   1.668   6.811   1.671
    6   HD11  LEU  86          HD11      LEU  86  -1.029   6.060   1.191
    7   HD13  LEU  86          HD12      LEU  86  -0.364   6.804   2.643
    8   HD12  LEU  86          HD13      LEU  86  -0.464   5.049   2.525
    9   HD23  LEU  86          HD21      LEU  86   1.222   3.821   1.795
   10   HD22  LEU  86          HD22      LEU  86   2.227   4.826   2.837
   11   HD21  LEU  86          HD23      LEU  86   2.732   4.497   1.181

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ALA  87           H        ALA  87   2.819   7.386  -1.994
    2    HA   ALA  87           HA       ALA  87   4.527   8.788  -0.264
    3    HB3  ALA  87           HB1      ALA  87   4.626   7.772  -2.970
    4    HB2  ALA  87           HB2      ALA  87   5.958   8.095  -1.865
    5    HB1  ALA  87           HB3      ALA  87   5.356   9.378  -2.912

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ARG  88           H        ARG  88   2.597   9.933  -2.993
    2    HA   ARG  88           HA       ARG  88   3.388  12.618  -2.875
    3    HB2  ARG  88           HB2      ARG  88   2.133  11.472  -4.736
    4    HB3  ARG  88           HB3      ARG  88   0.673  11.626  -3.758
    5    HG2  ARG  88           HG2      ARG  88   1.710  14.199  -3.673
    6    HG3  ARG  88           HG3      ARG  88   2.136  13.681  -5.302
    7    HD2  ARG  88           HD2      ARG  88  -0.002  13.775  -6.007
    8    HD3  ARG  88           HD3      ARG  88  -0.600  12.927  -4.581
    9    HE   ARG  88           HE       ARG  88  -0.769  15.706  -5.001
   10   HH21  ARG  88          HH11      ARG  88  -1.293  17.040  -3.266
   11   HH22  ARG  88          HH12      ARG  88  -1.006  16.502  -1.647
   12   HH11  ARG  88          HH21      ARG  88   0.223  13.438  -2.622
   13   HH12  ARG  88          HH22      ARG  88  -0.165  14.457  -1.283

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLU  89           H        GLU  89   0.667  10.964  -1.243
    2    HA   GLU  89           HA       GLU  89  -0.428  13.284  -0.044
    3    HB2  GLU  89           HB2      GLU  89  -1.561  11.053  -0.133
    4    HB3  GLU  89           HB3      GLU  89  -0.446  10.491   1.112
    5    HG2  GLU  89           HG2      GLU  89  -1.259  12.196   2.668
    6    HG3  GLU  89           HG3      GLU  89  -2.302  12.874   1.420

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LEU  90           H        LEU  90   2.003  10.975   1.140
    2    HA   LEU  90           HA       LEU  90   2.359  12.218   3.670
    3    HB2  LEU  90           HB2      LEU  90   4.124  10.430   2.000
    4    HB3  LEU  90           HB3      LEU  90   4.542  10.944   3.640
    5    HG   LEU  90           HG       LEU  90   1.899   9.618   2.971
    6   HD12  LEU  90          HD11      LEU  90   3.020   7.564   3.984
    7   HD11  LEU  90          HD12      LEU  90   4.550   8.408   3.747
    8   HD13  LEU  90          HD13      LEU  90   3.539   8.008   2.357
    9   HD22  LEU  90          HD21      LEU  90   1.635  10.545   5.091
   10   HD21  LEU  90          HD22      LEU  90   3.350  10.425   5.479
   11   HD23  LEU  90          HD23      LEU  90   2.333   8.986   5.525

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  91           H        ILE  91   3.976  12.586   0.548
    2    HA   ILE  91           HA       ILE  91   5.965  14.402   1.393
    3    HB   ILE  91           HB       ILE  91   4.658  13.921  -1.291
    4   HG12  ILE  91          HG12      ILE  91   7.483  13.411  -0.307
    5   HG13  ILE  91          HG13      ILE  91   6.191  12.224  -0.148
    6   HG22  ILE  91          HG21      ILE  91   6.894  15.249  -1.973
    7   HG21  ILE  91          HG22      ILE  91   6.586  16.053  -0.433
    8   HG23  ILE  91          HG23      ILE  91   5.367  16.091  -1.706
    9   HD13  ILE  91          HD11      ILE  91   6.023  11.900  -2.455
   10   HD12  ILE  91          HD12      ILE  91   7.759  12.129  -2.236
   11   HD11  ILE  91          HD13      ILE  91   6.761  13.460  -2.827

  No H/Q in entry =          11
  In of MODEL    9
    1    H    THR  92           H        THR  92   2.610  14.862   0.374
    2    HA   THR  92           HA       THR  92   2.608  17.685   0.312
    3    HB   THR  92           HB       THR  92   0.421  15.709   1.005
    4    HG1  THR  92           HG1      THR  92   0.731  15.527  -1.079
    5   HG22  THR  92          HG21      THR  92  -0.959  17.883   0.277
    6   HG21  THR  92          HG22      THR  92   0.438  18.696   0.978
    7   HG23  THR  92          HG23      THR  92  -0.516  17.584   1.957

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLU  93           H        GLU  93   2.031  15.391   2.965
    2    HA   GLU  93           HA       GLU  93   1.509  17.301   4.981
    3    HB2  GLU  93           HB2      GLU  93   2.798  14.565   5.223
    4    HB3  GLU  93           HB3      GLU  93   2.110  15.499   6.553
    5    HG2  GLU  93           HG2      GLU  93   0.499  14.733   4.109
    6    HG3  GLU  93           HG3      GLU  93   0.588  13.711   5.538

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LEU  94           H        LEU  94   4.506  15.792   3.842
    2    HA   LEU  94           HA       LEU  94   6.260  16.926   5.735
    3    HB2  LEU  94           HB2      LEU  94   6.663  15.953   2.906
    4    HB3  LEU  94           HB3      LEU  94   7.995  16.600   3.860
    5    HG   LEU  94           HG       LEU  94   6.233  14.420   4.990
    6   HD11  LEU  94          HD11      LEU  94   8.333  14.175   2.866
    7   HD13  LEU  94          HD12      LEU  94   6.878  13.214   3.123
    8   HD12  LEU  94          HD13      LEU  94   8.298  12.949   4.135
    9   HD23  LEU  94          HD21      LEU  94   8.414  13.865   6.150
   10   HD22  LEU  94          HD22      LEU  94   7.759  15.450   6.563
   11   HD21  LEU  94          HD23      LEU  94   9.100  15.317   5.425

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  95           H        ILE  95   5.141  18.105   2.581
    2    HA   ILE  95           HA       ILE  95   6.734  20.449   2.525
    3    HB   ILE  95           HB       ILE  95   4.089  19.788   1.211
    4   HG12  ILE  95          HG12      ILE  95   6.884  20.100   0.084
    5   HG13  ILE  95          HG13      ILE  95   6.219  18.553   0.597
    6   HG21  ILE  95          HG21      ILE  95   5.860  22.239   0.996
    7   HG23  ILE  95          HG22      ILE  95   4.133  22.187   1.346
    8   HG22  ILE  95          HG23      ILE  95   4.718  21.780  -0.268
    9   HD13  ILE  95          HD11      ILE  95   4.665  18.489  -1.137
   10   HD12  ILE  95          HD12      ILE  95   6.024  19.295  -1.921
   11   HD11  ILE  95          HD13      ILE  95   4.657  20.242  -1.334

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLU  96           H        GLU  96   3.475  19.826   3.810
    2    HA   GLU  96           HA       GLU  96   2.876  22.479   4.558
    3    HB2  GLU  96           HB2      GLU  96   1.186  20.711   4.565
    4    HB3  GLU  96           HB3      GLU  96   2.036  19.876   5.863
    5    HG2  GLU  96           HG2      GLU  96   1.021  21.170   7.429
    6    HG3  GLU  96           HG3      GLU  96   1.572  22.638   6.633

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LEU  97           H        LEU  97   4.691  19.913   6.190
    2    HA   LEU  97           HA       LEU  97   5.052  21.259   8.662
    3    HB2  LEU  97           HB2      LEU  97   6.574  19.076   7.254
    4    HB3  LEU  97           HB3      LEU  97   7.165  19.757   8.767
    5    HG   LEU  97           HG       LEU  97   4.347  18.688   8.448
    6   HD12  LEU  97          HD11      LEU  97   5.265  16.668   9.665
    7   HD11  LEU  97          HD12      LEU  97   6.883  17.284   9.326
    8   HD13  LEU  97          HD13      LEU  97   5.813  16.835   7.997
    9   HD23  LEU  97          HD21      LEU  97   4.789  18.391  11.014
   10   HD22  LEU  97          HD22      LEU  97   4.425  20.006  10.407
   11   HD21  LEU  97          HD23      LEU  97   6.091  19.551  10.758

  No H/Q in entry =          11
  In of MODEL    9
    1    H    HIS  98           H        HIS  98   6.933  21.257   5.642
    2    HA   HIS  98           HA       HIS  98   9.098  22.817   6.548
    3    HB2  HIS  98           HB2      HIS  98   7.811  22.572   3.818
    4    HB3  HIS  98           HB3      HIS  98   9.259  23.538   4.113
    5    HD1  HIS  98           HD1      HIS  98   8.015  19.978   4.130
    6    HD2  HIS  98           HD2      HIS  98  11.614  22.042   4.566
    7    HE1  HIS  98           HE1      HIS  98   9.854  18.232   4.080
    8    HE2  HIS  98           HE2      HIS  98  12.049  19.467   4.346

  No H/Q in entry =           8
  In of MODEL    9
    1    H    GLU  99           H        GLU  99   5.889  23.681   5.361
    2    HA   GLU  99           HA       GLU  99   6.294  26.493   5.303
    3    HB2  GLU  99           HB2      GLU  99   4.408  25.340   4.167
    4    HB3  GLU  99           HB3      GLU  99   3.703  24.987   5.744
    5    HG2  GLU  99           HG2      GLU  99   3.544  27.380   6.243
    6    HG3  GLU  99           HG3      GLU  99   4.329  27.772   4.716

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LYS 100           H        LYS 100   5.134  24.269   7.822
    2    HA   LYS 100           HA       LYS 100   4.561  26.330   9.713
    3    HB2  LYS 100           HB2      LYS 100   5.107  23.374  10.062
    4    HB3  LYS 100           HB3      LYS 100   4.665  24.451  11.393
    5    HG2  LYS 100           HG2      LYS 100   2.610  25.108  10.137
    6    HG3  LYS 100           HG3      LYS 100   3.030  23.934   8.887
    7    HD2  LYS 100           HD2      LYS 100   2.929  22.115  10.549
    8    HD3  LYS 100           HD3      LYS 100   2.526  23.282  11.810
    9    HE2  LYS 100           HE2      LYS 100   0.483  23.923  10.540
   10    HE3  LYS 100           HE3      LYS 100   0.875  22.699   9.326
   11    HZ1  LYS 100           HZ1      LYS 100   0.593  22.036  12.206
   12    HZ3  LYS 100           HZ2      LYS 100   0.572  20.981  10.872
   13    HZ2  LYS 100           HZ3      LYS 100  -0.734  22.034  11.147

  No H/Q in entry =          13
  In of MODEL    9
    1    H    LEU 101           H        LEU 101   7.469  24.506   8.890
    2    HA   LEU 101           HA       LEU 101   9.069  25.331  11.099
    3    HB2  LEU 101           HB2      LEU 101   9.663  24.337   8.323
    4    HB3  LEU 101           HB3      LEU 101  10.968  24.990   9.309
    5    HG   LEU 101           HG       LEU 101   9.111  22.853  10.367
    6   HD12  LEU 101          HD11      LEU 101  11.152  21.337   9.767
    7   HD11  LEU 101          HD12      LEU 101  11.536  22.596   8.595
    8   HD13  LEU 101          HD13      LEU 101   9.999  21.738   8.496
    9   HD21  LEU 101          HD21      LEU 101  11.844  23.934  11.104
   10   HD23  LEU 101          HD22      LEU 101  11.283  22.367  11.682
   11   HD22  LEU 101          HD23      LEU 101  10.404  23.832  12.117

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LYS 102           H        LYS 102   7.511  27.209   8.952
    2    HA   LYS 102           HA       LYS 102   7.613  29.501   8.659
    3    HB2  LYS 102           HB2      LYS 102   9.169  29.371  10.763
    4    HB3  LYS 102           HB3      LYS 102  10.474  29.552   9.608
    5    HG2  LYS 102           HG2      LYS 102   8.385  31.527  10.462
    6    HG3  LYS 102           HG3      LYS 102  10.101  31.769  10.216
    7    HD2  LYS 102           HD2      LYS 102   8.154  31.365   7.909
    8    HD3  LYS 102           HD3      LYS 102   8.551  32.940   8.578
    9    HE2  LYS 102           HE2      LYS 102   9.918  31.741   6.510
   10    HE3  LYS 102           HE3      LYS 102  10.545  33.042   7.523
   11    HZ2  LYS 102           HZ1      LYS 102  12.046  31.122   7.354
   12    HZ1  LYS 102           HZ2      LYS 102  10.872  30.152   8.093
   13    HZ3  LYS 102           HZ3      LYS 102  11.574  31.432   8.954

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ALA 103           H        ALA 103  10.858  28.129   8.106
    2    HA   ALA 103           HA       ALA 103  11.843  29.495   6.033
    3    HB2  ALA 103           HB1      ALA 103  12.708  27.271   5.109
    4    HB1  ALA 103           HB2      ALA 103  11.801  26.507   6.413
    5    HB3  ALA 103           HB3      ALA 103  13.101  27.638   6.790

  No H/Q in entry =           5
  In of MODEL    9
    1    H1   LYS   3           H1       LYS   3 -31.719   5.837 -19.634
    2    H2   LYS   3           H3       LYS   3 -30.720   5.609 -20.988
    3    H3   LYS   3           H2       LYS   3 -32.070   4.608 -20.750
    4    HA   LYS   3           HA       LYS   3 -31.003   3.251 -19.363
    5    HB2  LYS   3           HB2      LYS   3 -28.790   4.780 -20.682
    6    HB3  LYS   3           HB3      LYS   3 -28.409   3.574 -19.453
    7    HG2  LYS   3           HG2      LYS   3 -29.759   1.940 -20.820
    8    HG3  LYS   3           HG3      LYS   3 -29.770   3.156 -22.096
    9    HD2  LYS   3           HD2      LYS   3 -27.285   3.155 -22.050
   10    HD3  LYS   3           HD3      LYS   3 -27.343   1.839 -20.878
   11    HE2  LYS   3           HE2      LYS   3 -28.788   0.616 -22.607
   12    HE3  LYS   3           HE3      LYS   3 -28.225   1.835 -23.750
   13    HZ3  LYS   3           HZ1      LYS   3 -26.372   0.692 -24.034
   14    HZ2  LYS   3           HZ2      LYS   3 -26.947  -0.515 -22.988
   15    HZ1  LYS   3           HZ3      LYS   3 -26.015   0.766 -22.376

  No H/Q in entry =          15
  In of MODEL    9
    1    H    LYS   4           H        LYS   4 -31.046   3.083 -17.304
    2    HA   LYS   4           HA       LYS   4 -30.418   5.380 -15.628
    3    HB2  LYS   4           HB2      LYS   4 -31.495   2.628 -14.959
    4    HB3  LYS   4           HB3      LYS   4 -31.333   3.962 -13.817
    5    HG2  LYS   4           HG2      LYS   4 -33.139   3.847 -16.237
    6    HG3  LYS   4           HG3      LYS   4 -33.630   3.856 -14.544
    7    HD2  LYS   4           HD2      LYS   4 -33.033   6.104 -14.253
    8    HD3  LYS   4           HD3      LYS   4 -31.994   6.108 -15.677
    9    HE2  LYS   4           HE2      LYS   4 -33.980   7.400 -16.122
   10    HE3  LYS   4           HE3      LYS   4 -33.996   5.938 -17.107
   11    HZ3  LYS   4           HZ1      LYS   4 -35.527   4.938 -15.569
   12    HZ2  LYS   4           HZ2      LYS   4 -36.149   6.413 -16.136
   13    HZ1  LYS   4           HZ3      LYS   4 -35.486   6.314 -14.575

  No H/Q in entry =          13
  In of MODEL    9
    1    H    HIS   5           H        HIS   5 -28.952   5.512 -14.037
    2    HA   HIS   5           HA       HIS   5 -26.591   3.789 -14.392
    3    HB2  HIS   5           HB2      HIS   5 -26.965   6.516 -13.154
    4    HB3  HIS   5           HB3      HIS   5 -25.442   5.627 -13.149
    5    HD1  HIS   5           HD1      HIS   5 -24.029   6.907 -14.727
    6    HD2  HIS   5           HD2      HIS   5 -27.802   6.140 -16.284
    7    HE1  HIS   5           HE1      HIS   5 -23.890   7.523 -17.170
    8    HE2  HIS   5           HE2      HIS   5 -26.190   7.042 -18.088

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ILE   6           H        ILE   6 -26.293   2.213 -13.093
    2    HA   ILE   6           HA       ILE   6 -27.275   2.407 -10.326
    3    HB   ILE   6           HB       ILE   6 -26.347  -0.005 -11.892
    4   HG12  ILE   6          HG12      ILE   6 -29.126   0.804 -11.027
    5   HG13  ILE   6          HG13      ILE   6 -28.494   1.011 -12.661
    6   HG23  ILE   6          HG21      ILE   6 -26.663  -1.293 -10.046
    7   HG22  ILE   6          HG22      ILE   6 -27.867  -0.206  -9.352
    8   HG21  ILE   6          HG23      ILE   6 -26.154   0.203  -9.261
    9   HD13  ILE   6          HD11      ILE   6 -28.863  -1.120 -13.184
   10   HD12  ILE   6          HD12      ILE   6 -29.876  -1.163 -11.741
   11   HD11  ILE   6          HD13      ILE   6 -28.197  -1.701 -11.658

  No H/Q in entry =          11
  In of MODEL    9
    1    H    TYR   7           H        TYR   7 -25.543   3.107  -9.034
    2    HA   TYR   7           HA       TYR   7 -22.793   2.274  -9.727
    3    HB2  TYR   7           HB2      TYR   7 -23.858   4.648  -8.217
    4    HB3  TYR   7           HB3      TYR   7 -22.153   4.206  -8.263
    5    HD1  TYR   7           HD1      TYR   7 -23.157   3.256 -11.363
    6    HD2  TYR   7           HD2      TYR   7 -22.635   6.827  -9.096
    7    HE1  TYR   7           HE1      TYR   7 -22.781   4.526 -13.440
    8    HE2  TYR   7           HE2      TYR   7 -22.301   8.101 -11.165
    9    HH   TYR   7           HH       TYR   7 -22.519   8.031 -13.398

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LEU   8           H        LEU   8 -21.770   0.949  -8.414
    2    HA   LEU   8           HA       LEU   8 -22.874   0.377  -5.736
    3    HB2  LEU   8           HB2      LEU   8 -21.106  -1.192  -7.590
    4    HB3  LEU   8           HB3      LEU   8 -21.272  -1.601  -5.883
    5    HG   LEU   8           HG       LEU   8 -23.743  -1.873  -6.305
    6   HD13  LEU   8          HD11      LEU   8 -23.929  -0.640  -8.401
    7   HD12  LEU   8          HD12      LEU   8 -24.388  -2.321  -8.660
    8   HD11  LEU   8          HD13      LEU   8 -22.803  -1.750  -9.180
    9   HD23  LEU   8          HD21      LEU   8 -22.386  -3.840  -8.023
   10   HD22  LEU   8          HD22      LEU   8 -23.464  -4.068  -6.646
   11   HD21  LEU   8          HD23      LEU   8 -21.773  -3.647  -6.382

  No H/Q in entry =          11
  In of MODEL    9
    1    H    PHE   9           H        PHE   9 -21.620   0.802  -3.952
    2    HA   PHE   9           HA       PHE   9 -18.875   1.859  -4.442
    3    HB2  PHE   9           HB2      PHE   9 -20.936   2.819  -2.459
    4    HB3  PHE   9           HB3      PHE   9 -19.248   3.312  -2.444
    5    HD1  PHE   9           HD1      PHE   9 -18.325   4.715  -4.210
    6    HD2  PHE   9           HD2      PHE   9 -22.460   3.567  -4.233
    7    HE1  PHE   9           HE1      PHE   9 -18.787   6.413  -5.950
    8    HE2  PHE   9           HE2      PHE   9 -22.923   5.279  -5.969
    9    HZ   PHE   9           HZ       PHE   9 -21.084   6.697  -6.835

  No H/Q in entry =           9
  In of MODEL    9
    1    H    SER  10           H        SER  10 -17.253   0.963  -3.342
    2    HA   SER  10           HA       SER  10 -17.416   0.021  -0.665
    3    HB2  SER  10           HB2      SER  10 -18.579  -1.872  -1.755
    4    HB3  SER  10           HB3      SER  10 -17.198  -2.083  -2.820
    5    HG   SER  10           HG       SER  10 -15.929  -2.425  -0.941

  No H/Q in entry =           5
  In of MODEL    9
    1    H    SER  11           H        SER  11 -15.396   0.169   0.167
    2    HA   SER  11           HA       SER  11 -13.254   1.110  -1.394
    3    HB2  SER  11           HB2      SER  11 -13.747   1.206   1.195
    4    HB3  SER  11           HB3      SER  11 -12.718  -0.228   1.210
    5    HG   SER  11           HG       SER  11 -12.106   2.326   0.111

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA  12           H        ALA  12 -14.355  -1.613  -2.174
    2    HA   ALA  12           HA       ALA  12 -11.743  -2.807  -2.671
    3    HB3  ALA  12           HB1      ALA  12 -12.280  -4.010  -0.688
    4    HB2  ALA  12           HB2      ALA  12 -12.633  -5.097  -2.031
    5    HB1  ALA  12           HB3      ALA  12 -13.949  -4.260  -1.209

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLY  13           H        GLY  13 -12.652  -1.725  -4.684
    2    HA3  GLY  13           HA2      GLY  13 -14.808  -2.580  -6.179
    3    HA2  GLY  13           HA3      GLY  13 -13.287  -2.021  -6.889

  No H/Q in entry =           3
  In of MODEL    9
    1    H    MET  14           H        MET  14 -11.723  -4.260  -5.778
    2    HA   MET  14           HA       MET  14 -11.835  -6.012  -7.932
    3    HB2  MET  14           HB2      MET  14  -9.905  -5.954  -6.393
    4    HB3  MET  14           HB3      MET  14 -10.859  -6.774  -5.157
    5    HG2  MET  14           HG2      MET  14  -9.563  -8.470  -6.250
    6    HG3  MET  14           HG3      MET  14 -11.202  -8.646  -6.877
    7    HE1  MET  14           HE1      MET  14  -7.780  -8.862  -7.704
    8    HE3  MET  14           HE2      MET  14  -7.658  -7.121  -7.462
    9    HE2  MET  14           HE3      MET  14  -7.387  -7.801  -9.064

  No H/Q in entry =           9
  In of MODEL    9
    1    H    SER  15           H        SER  15 -13.277  -6.608  -4.729
    2    HA   SER  15           HA       SER  15 -14.497  -9.074  -5.642
    3    HB2  SER  15           HB2      SER  15 -14.760  -7.526  -3.070
    4    HB3  SER  15           HB3      SER  15 -15.866  -8.840  -3.463
    5    HG   SER  15           HG       SER  15 -13.088  -9.218  -3.752

  No H/Q in entry =           5
  In of MODEL    9
    1    H    THR  16           H        THR  16 -15.612  -5.731  -5.154
    2    HA   THR  16           HA       THR  16 -18.403  -6.223  -5.685
    3    HB   THR  16           HB       THR  16 -16.844  -3.662  -6.178
    4    HG1  THR  16           HG1      THR  16 -16.501  -3.667  -4.131
    5   HG22  THR  16          HG21      THR  16 -19.007  -2.614  -5.658
    6   HG21  THR  16          HG22      THR  16 -19.732  -4.213  -5.420
    7   HG23  THR  16          HG23      THR  16 -19.160  -3.718  -7.019

  No H/Q in entry =           7
  In of MODEL    9
    1    H    SER  17           H        SER  17 -15.574  -5.554  -7.542
    2    HA   SER  17           HA       SER  17 -16.733  -4.836 -10.035
    3    HB2  SER  17           HB2      SER  17 -14.052  -6.067  -9.365
    4    HB3  SER  17           HB3      SER  17 -14.515  -5.589 -10.998
    5    HG   SER  17           HG       SER  17 -15.028  -3.483  -9.831

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU  18           H        LEU  18 -16.029  -7.969  -8.622
    2    HA   LEU  18           HA       LEU  18 -16.551  -9.466 -10.994
    3    HB2  LEU  18           HB2      LEU  18 -15.291 -10.408  -9.117
    4    HB3  LEU  18           HB3      LEU  18 -16.710 -10.262  -8.082
    5    HG   LEU  18           HG       LEU  18 -17.914 -11.829  -9.597
    6   HD13  LEU  18          HD11      LEU  18 -16.852 -11.695 -11.671
    7   HD12  LEU  18          HD12      LEU  18 -16.235 -13.220 -11.035
    8   HD11  LEU  18          HD13      LEU  18 -15.241 -11.766 -10.960
    9   HD21  LEU  18          HD21      LEU  18 -16.614 -12.450  -7.510
   10   HD23  LEU  18          HD22      LEU  18 -15.382 -13.073  -8.609
   11   HD22  LEU  18          HD23      LEU  18 -17.012 -13.745  -8.641

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LEU  19           H        LEU  19 -18.569  -8.376  -8.269
    2    HA   LEU  19           HA       LEU  19 -20.979  -9.655  -9.115
    3    HB2  LEU  19           HB2      LEU  19 -20.730  -8.827  -6.852
    4    HB3  LEU  19           HB3      LEU  19 -20.546  -7.179  -7.450
    5    HG   LEU  19           HG       LEU  19 -22.921  -7.293  -8.247
    6   HD13  LEU  19          HD11      LEU  19 -24.364  -9.016  -7.299
    7   HD12  LEU  19          HD12      LEU  19 -22.972  -9.786  -6.539
    8   HD11  LEU  19          HD13      LEU  19 -23.112  -9.756  -8.297
    9   HD22  LEU  19          HD21      LEU  19 -22.341  -6.113  -6.245
   10   HD21  LEU  19          HD22      LEU  19 -22.322  -7.611  -5.314
   11   HD23  LEU  19          HD23      LEU  19 -23.842  -6.996  -5.966

  No H/Q in entry =          11
  In of MODEL    9
    1    H    VAL  20           H        VAL  20 -19.622  -6.425  -9.775
    2    HA   VAL  20           HA       VAL  20 -21.777  -5.459 -11.333
    3    HB   VAL  20           HB       VAL  20 -18.817  -4.737 -11.445
    4   HG11  VAL  20          HG11      VAL  20 -21.175  -3.520 -12.897
    5   HG13  VAL  20          HG12      VAL  20 -19.686  -4.152 -13.599
    6   HG12  VAL  20          HG13      VAL  20 -19.653  -2.665 -12.652
    7   HG21  VAL  20          HG21      VAL  20 -21.215  -3.583 -10.077
    8   HG23  VAL  20          HG22      VAL  20 -19.803  -2.591 -10.436
    9   HG22  VAL  20          HG23      VAL  20 -19.643  -4.010  -9.401

  No H/Q in entry =           9
  In of MODEL    9
    1    H    SER  21           H        SER  21 -18.934  -7.376 -12.382
    2    HA   SER  21           HA       SER  21 -19.724  -7.268 -15.132
    3    HB2  SER  21           HB2      SER  21 -18.204  -9.168 -15.486
    4    HB3  SER  21           HB3      SER  21 -17.429  -7.896 -14.544
    5    HG   SER  21           HG       SER  21 -18.508 -10.334 -13.627

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LYS  22           H        LYS  22 -20.693  -9.525 -12.585
    2    HA   LYS  22           HA       LYS  22 -22.161 -11.190 -14.424
    3    HB2  LYS  22           HB2      LYS  22 -21.368 -11.906 -12.133
    4    HB3  LYS  22           HB3      LYS  22 -22.659 -10.909 -11.465
    5    HG2  LYS  22           HG2      LYS  22 -23.540 -13.065 -11.457
    6    HG3  LYS  22           HG3      LYS  22 -24.244 -12.319 -12.890
    7    HD2  LYS  22           HD2      LYS  22 -22.621 -13.438 -14.310
    8    HD3  LYS  22           HD3      LYS  22 -21.829 -14.130 -12.893
    9    HE2  LYS  22           HE2      LYS  22 -23.869 -15.395 -12.366
   10    HE3  LYS  22           HE3      LYS  22 -24.670 -14.698 -13.774
   11    HZ3  LYS  22           HZ1      LYS  22 -23.997 -16.624 -14.680
   12    HZ2  LYS  22           HZ2      LYS  22 -22.683 -16.815 -13.620
   13    HZ1  LYS  22           HZ3      LYS  22 -22.560 -15.755 -14.940

  No H/Q in entry =          13
  In of MODEL    9
    1    H    MET  23           H        MET  23 -23.008  -8.323 -12.523
    2    HA   MET  23           HA       MET  23 -25.809  -8.515 -13.031
    3    HB2  MET  23           HB2      MET  23 -24.061  -6.137 -12.432
    4    HB3  MET  23           HB3      MET  23 -25.812  -6.040 -12.608
    5    HG2  MET  23           HG2      MET  23 -26.147  -7.381 -10.654
    6    HG3  MET  23           HG3      MET  23 -24.421  -7.721 -10.532
    7    HE2  MET  23           HE1      MET  23 -26.871  -4.182  -9.302
    8    HE1  MET  23           HE2      MET  23 -27.084  -5.145 -10.763
    9    HE3  MET  23           HE3      MET  23 -26.110  -3.674 -10.811

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ARG  24           H        ARG  24 -23.118  -6.952 -14.798
    2    HA   ARG  24           HA       ARG  24 -24.669  -5.692 -16.782
    3    HB2  ARG  24           HB2      ARG  24 -22.246  -5.197 -16.395
    4    HB3  ARG  24           HB3      ARG  24 -21.843  -6.769 -17.038
    5    HG2  ARG  24           HG2      ARG  24 -22.778  -6.107 -19.268
    6    HG3  ARG  24           HG3      ARG  24 -23.125  -4.492 -18.594
    7    HD2  ARG  24           HD2      ARG  24 -20.379  -5.829 -18.650
    8    HD3  ARG  24           HD3      ARG  24 -20.931  -4.599 -19.780
    9    HE   ARG  24           HE       ARG  24 -21.234  -3.298 -17.499
   10   HH21  ARG  24          HH11      ARG  24 -19.857  -1.527 -17.645
   11   HH22  ARG  24          HH12      ARG  24 -18.161  -1.778 -17.872
   12   HH11  ARG  24          HH21      ARG  24 -18.640  -5.227 -18.502
   13   HH12  ARG  24          HH22      ARG  24 -17.450  -3.972 -18.368

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ALA  25           H        ALA  25 -23.411  -8.985 -16.545
    2    HA   ALA  25           HA       ALA  25 -24.006  -9.810 -19.192
    3    HB1  ALA  25           HB1      ALA  25 -23.226 -11.819 -18.520
    4    HB3  ALA  25           HB2      ALA  25 -24.284 -11.859 -17.109
    5    HB2  ALA  25           HB3      ALA  25 -22.763 -10.970 -17.047

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLN  26           H        GLN  26 -25.829  -9.959 -16.169
    2    HA   GLN  26           HA       GLN  26 -28.122 -11.243 -17.201
    3    HB2  GLN  26           HB2      GLN  26 -27.679  -9.505 -14.793
    4    HB3  GLN  26           HB3      GLN  26 -29.212 -10.287 -15.152
    5    HG2  GLN  26           HG2      GLN  26 -26.569 -11.643 -14.701
    6    HG3  GLN  26           HG3      GLN  26 -27.933 -11.609 -13.590
    7   HE21  GLN  26          HE21      GLN  26 -26.629 -13.707 -14.892
    8   HE22  GLN  26          HE22      GLN  26 -27.628 -14.785 -15.701

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ALA  27           H        ALA  27 -27.325  -7.815 -16.768
    2    HA   ALA  27           HA       ALA  27 -29.857  -6.815 -17.539
    3    HB1  ALA  27           HB1      ALA  27 -28.102  -5.441 -16.407
    4    HB3  ALA  27           HB2      ALA  27 -28.723  -4.681 -17.873
    5    HB2  ALA  27           HB3      ALA  27 -27.153  -5.486 -17.895

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLU  28           H        GLU  28 -27.109  -7.904 -19.422
    2    HA   GLU  28           HA       GLU  28 -28.086  -6.871 -21.929
    3    HB2  GLU  28           HB2      GLU  28 -25.681  -7.466 -21.312
    4    HB3  GLU  28           HB3      GLU  28 -26.158  -9.148 -21.536
    5    HG2  GLU  28           HG2      GLU  28 -25.044  -8.301 -23.493
    6    HG3  GLU  28           HG3      GLU  28 -26.729  -8.687 -23.847

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LYS  29           H        LYS  29 -28.127 -10.002 -20.312
    2    HA   LYS  29           HA       LYS  29 -29.370 -11.498 -22.336
    3    HB2  LYS  29           HB2      LYS  29 -28.282 -12.465 -20.344
    4    HB3  LYS  29           HB3      LYS  29 -29.580 -11.822 -19.340
    5    HG2  LYS  29           HG2      LYS  29 -31.185 -13.246 -20.427
    6    HG3  LYS  29           HG3      LYS  29 -29.961 -13.818 -21.558
    7    HD2  LYS  29           HD2      LYS  29 -28.772 -14.960 -19.840
    8    HD3  LYS  29           HD3      LYS  29 -29.712 -14.172 -18.574
    9    HE2  LYS  29           HE2      LYS  29 -30.369 -16.544 -18.967
   10    HE3  LYS  29           HE3      LYS  29 -31.694 -15.402 -19.196
   11    HZ1  LYS  29           HZ1      LYS  29 -31.125 -15.481 -21.625
   12    HZ3  LYS  29           HZ2      LYS  29 -31.789 -16.905 -20.978
   13    HZ2  LYS  29           HZ3      LYS  29 -30.121 -16.804 -21.274

  No H/Q in entry =          13
  In of MODEL    9
    1    H    TYR  30           H        TYR  30 -30.845  -9.483 -19.805
    2    HA   TYR  30           HA       TYR  30 -33.488 -10.023 -21.054
    3    HB2  TYR  30           HB2      TYR  30 -32.881  -8.879 -18.317
    4    HB3  TYR  30           HB3      TYR  30 -34.487  -9.194 -18.975
    5    HD1  TYR  30           HD1      TYR  30 -35.304 -11.517 -19.218
    6    HD2  TYR  30           HD2      TYR  30 -31.502 -10.664 -17.503
    7    HE1  TYR  30           HE1      TYR  30 -35.121 -13.850 -18.452
    8    HE2  TYR  30           HE2      TYR  30 -31.319 -12.982 -16.741
    9    HH   TYR  30           HH       TYR  30 -32.862 -15.393 -17.865

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLU  31           H        GLU  31 -31.404  -7.935 -21.827
    2    HA   GLU  31           HA       GLU  31 -31.418  -5.766 -22.621
    3    HB2  GLU  31           HB2      GLU  31 -34.282  -6.592 -23.144
    4    HB3  GLU  31           HB3      GLU  31 -33.498  -5.181 -23.854
    5    HG2  GLU  31           HG2      GLU  31 -31.968  -6.543 -25.065
    6    HG3  GLU  31           HG3      GLU  31 -32.474  -7.990 -24.195

  No H/Q in entry =           6
  In of MODEL    9
    1    H    VAL  32           H        VAL  32 -31.621  -5.708 -19.887
    2    HA   VAL  32           HA       VAL  32 -33.568  -3.683 -19.202
    3    HB   VAL  32           HB       VAL  32 -31.136  -4.598 -17.633
    4   HG12  VAL  32          HG11      VAL  32 -32.704  -3.863 -15.727
    5   HG11  VAL  32          HG12      VAL  32 -33.574  -2.977 -16.980
    6   HG13  VAL  32          HG13      VAL  32 -31.881  -2.608 -16.655
    7   HG21  VAL  32          HG21      VAL  32 -32.832  -6.381 -18.344
    8   HG23  VAL  32          HG22      VAL  32 -33.905  -5.612 -17.174
    9   HG22  VAL  32          HG23      VAL  32 -32.360  -6.279 -16.649

  No H/Q in entry =           9
  In of MODEL    9
    1    HA   PRO  33           HA       PRO  33 -30.660  -0.609 -20.835
    2    HB2  PRO  33           HB2      PRO  33 -32.263   1.546 -20.682
    3    HB3  PRO  33           HB3      PRO  33 -32.677   0.241 -21.793
    4    HG2  PRO  33           HG2      PRO  33 -33.665   0.679 -18.975
    5    HG3  PRO  33           HG3      PRO  33 -34.621   0.450 -20.440
    6    HD2  PRO  33           HD2      PRO  33 -34.078  -1.624 -18.802
    7    HD3  PRO  33           HD3      PRO  33 -34.130  -1.844 -20.551

  No H/Q in entry =           7
  In of MODEL    9
    1    H    VAL  34           H        VAL  34 -29.375  -1.126 -18.893
    2    HA   VAL  34           HA       VAL  34 -29.193   1.286 -17.213
    3    HB   VAL  34           HB       VAL  34 -28.549  -0.175 -15.295
    4   HG12  VAL  34          HG11      VAL  34 -30.923  -1.153 -15.000
    5   HG11  VAL  34          HG12      VAL  34 -31.271  -0.386 -16.548
    6   HG13  VAL  34          HG13      VAL  34 -30.760   0.594 -15.174
    7   HG21  VAL  34          HG21      VAL  34 -28.650  -2.181 -17.330
    8   HG23  VAL  34          HG22      VAL  34 -29.690  -2.604 -15.969
    9   HG22  VAL  34          HG23      VAL  34 -27.986  -2.248 -15.698

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ILE  35           H        ILE  35 -27.236   1.793 -16.367
    2    HA   ILE  35           HA       ILE  35 -24.877   0.581 -17.647
    3    HB   ILE  35           HB       ILE  35 -25.399   3.439 -16.797
    4   HG12  ILE  35          HG12      ILE  35 -24.363   2.210 -19.359
    5   HG13  ILE  35          HG13      ILE  35 -26.018   2.757 -19.091
    6   HG21  ILE  35          HG21      ILE  35 -22.775   2.021 -17.126
    7   HG23  ILE  35          HG22      ILE  35 -23.278   3.164 -15.881
    8   HG22  ILE  35          HG23      ILE  35 -22.920   3.735 -17.511
    9   HD11  ILE  35          HD11      ILE  35 -24.711   5.001 -18.460
   10   HD13  ILE  35          HD12      ILE  35 -25.232   4.617 -20.102
   11   HD12  ILE  35          HD13      ILE  35 -23.566   4.311 -19.611

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ILE  36           H        ILE  36 -23.604  -0.412 -16.062
    2    HA   ILE  36           HA       ILE  36 -24.069   0.145 -13.183
    3    HB   ILE  36           HB       ILE  36 -23.128  -2.505 -14.327
    4   HG12  ILE  36          HG12      ILE  36 -25.966  -1.829 -13.553
    5   HG13  ILE  36          HG13      ILE  36 -25.397  -1.762 -15.220
    6   HG23  ILE  36          HG21      ILE  36 -23.442  -3.376 -12.225
    7   HG22  ILE  36          HG22      ILE  36 -24.623  -2.147 -11.769
    8   HG21  ILE  36          HG23      ILE  36 -22.908  -1.741 -11.835
    9   HD13  ILE  36          HD11      ILE  36 -25.468  -3.978 -15.457
   10   HD12  ILE  36          HD12      ILE  36 -26.537  -3.921 -14.056
   11   HD11  ILE  36          HD13      ILE  36 -24.822  -4.271 -13.843

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLU  37           H        GLU  37 -22.316   0.835 -12.069
    2    HA   GLU  37           HA       GLU  37 -19.594   0.168 -12.996
    3    HB2  GLU  37           HB2      GLU  37 -20.484   2.911 -12.120
    4    HB3  GLU  37           HB3      GLU  37 -18.846   2.435 -12.566
    5    HG2  GLU  37           HG2      GLU  37 -21.190   2.484 -14.443
    6    HG3  GLU  37           HG3      GLU  37 -20.001   3.775 -14.276

  No H/Q in entry =           6
  In of MODEL    9
    1    H    ALA  38           H        ALA  38 -18.098  -0.029 -11.316
    2    HA   ALA  38           HA       ALA  38 -19.135   0.067  -8.543
    3    HB1  ALA  38           HB1      ALA  38 -17.339  -1.776  -9.995
    4    HB3  ALA  38           HB2      ALA  38 -18.376  -2.076  -8.601
    5    HB2  ALA  38           HB3      ALA  38 -16.796  -1.328  -8.379

  No H/Q in entry =           5
  In of MODEL    9
    1    H    PHE  39           H        PHE  39 -17.947   1.310  -7.054
    2    HA   PHE  39           HA       PHE  39 -15.478   2.633  -7.934
    3    HB2  PHE  39           HB2      PHE  39 -17.949   4.003  -6.889
    4    HB3  PHE  39           HB3      PHE  39 -16.350   4.740  -6.809
    5    HD1  PHE  39           HD1      PHE  39 -15.056   4.828  -9.077
    6    HD2  PHE  39           HD2      PHE  39 -19.284   4.422  -8.700
    7    HE1  PHE  39           HE1      PHE  39 -15.334   5.713 -11.375
    8    HE2  PHE  39           HE2      PHE  39 -19.578   5.296 -10.990
    9    HZ   PHE  39           HZ       PHE  39 -17.606   5.915 -12.347

  No H/Q in entry =           9
  In of MODEL    9
    1    HA   PRO  40           HA       PRO  40 -14.505   1.864  -3.658
    2    HB2  PRO  40           HB2      PRO  40 -12.830   3.949  -3.025
    3    HB3  PRO  40           HB3      PRO  40 -12.327   2.651  -4.108
    4    HG2  PRO  40           HG2      PRO  40 -13.470   5.348  -4.822
    5    HG3  PRO  40           HG3      PRO  40 -12.011   4.577  -5.439
    6    HD2  PRO  40           HD2      PRO  40 -14.227   4.411  -6.847
    7    HD3  PRO  40           HD3      PRO  40 -13.208   2.984  -6.675

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLU  41           H        GLU  41 -15.168   2.785  -1.514
    2    HA   GLU  41           HA       GLU  41 -17.488   4.384  -1.475
    3    HB2  GLU  41           HB2      GLU  41 -17.297   4.326   0.920
    4    HB3  GLU  41           HB3      GLU  41 -16.841   2.746   0.283
    5    HG2  GLU  41           HG2      GLU  41 -14.465   3.341   0.572
    6    HG3  GLU  41           HG3      GLU  41 -14.957   4.883   1.274

  No H/Q in entry =           6
  In of MODEL    9
    1    H    THR  42           H        THR  42 -14.202   5.452  -1.514
    2    HA   THR  42           HA       THR  42 -14.670   7.977  -0.269
    3    HB   THR  42           HB       THR  42 -12.540   8.663  -1.334
    4    HG1  THR  42           HG1      THR  42 -13.059   6.307  -2.773
    5   HG22  THR  42          HG21      THR  42 -11.111   6.938  -0.306
    6   HG21  THR  42          HG22      THR  42 -12.499   5.853  -0.206
    7   HG23  THR  42          HG23      THR  42 -12.474   7.339   0.740

  No H/Q in entry =           7
  In of MODEL    9
    1    H    LEU  43           H        LEU  43 -15.524   6.885  -3.383
    2    HA   LEU  43           HA       LEU  43 -15.904   9.655  -4.317
    3    HB2  LEU  43           HB2      LEU  43 -16.155   7.016  -5.748
    4    HB3  LEU  43           HB3      LEU  43 -16.424   8.596  -6.480
    5    HG   LEU  43           HG       LEU  43 -13.774   7.588  -5.474
    6   HD13  LEU  43          HD11      LEU  43 -13.202   7.084  -7.670
    7   HD12  LEU  43          HD12      LEU  43 -14.510   8.058  -8.338
    8   HD11  LEU  43          HD13      LEU  43 -14.866   6.513  -7.569
    9   HD22  LEU  43          HD21      LEU  43 -13.736   9.935  -5.347
   10   HD21  LEU  43          HD22      LEU  43 -14.699  10.119  -6.814
   11   HD23  LEU  43          HD23      LEU  43 -13.024   9.579  -6.920

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ALA  44           H        ALA  44 -17.764   7.719  -2.488
    2    HA   ALA  44           HA       ALA  44 -20.233   7.483  -3.812
    3    HB2  ALA  44           HB1      ALA  44 -20.043   6.346  -1.731
    4    HB3  ALA  44           HB2      ALA  44 -21.210   7.635  -1.441
    5    HB1  ALA  44           HB3      ALA  44 -19.546   7.813  -0.887

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLY  45           H        GLY  45 -18.942  10.325  -2.243
    2    HA3  GLY  45           HA2      GLY  45 -21.445  11.716  -2.584
    3    HA2  GLY  45           HA3      GLY  45 -19.931  12.404  -1.999

  No H/Q in entry =           3
  In of MODEL    9
    1    H    GLU  46           H        GLU  46 -18.360  11.568  -4.301
    2    HA   GLU  46           HA       GLU  46 -19.098  13.775  -6.041
    3    HB2  GLU  46           HB2      GLU  46 -16.811  11.801  -6.085
    4    HB3  GLU  46           HB3      GLU  46 -17.002  13.120  -7.241
    5    HG2  GLU  46           HG2      GLU  46 -15.496  13.995  -5.739
    6    HG3  GLU  46           HG3      GLU  46 -17.030  14.630  -5.144

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LYS  47           H        LYS  47 -18.818  10.272  -6.522
    2    HA   LYS  47           HA       LYS  47 -19.926  10.476  -9.195
    3    HB2  LYS  47           HB2      LYS  47 -18.653   8.416  -7.548
    4    HB3  LYS  47           HB3      LYS  47 -20.010   7.815  -8.503
    5    HG2  LYS  47           HG2      LYS  47 -17.971   7.505  -9.723
    6    HG3  LYS  47           HG3      LYS  47 -18.945   8.738 -10.522
    7    HD2  LYS  47           HD2      LYS  47 -17.622  10.490  -9.467
    8    HD3  LYS  47           HD3      LYS  47 -16.666   9.274  -8.623
    9    HE2  LYS  47           HE2      LYS  47 -15.878   8.401 -10.761
   10    HE3  LYS  47           HE3      LYS  47 -16.848   9.600 -11.612
   11    HZ1  LYS  47           HZ1      LYS  47 -15.447  11.110  -9.897
   12    HZ3  LYS  47           HZ2      LYS  47 -15.010  10.819 -11.512
   13    HZ2  LYS  47           HZ3      LYS  47 -14.324   9.891 -10.265

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLY  48           H        GLY  48 -21.212   9.618  -6.057
    2    HA3  GLY  48           HA2      GLY  48 -23.540   8.335  -6.814
    3    HA2  GLY  48           HA3      GLY  48 -23.360   9.320  -5.361

  No H/Q in entry =           3
  In of MODEL    9
    1    H    GLN  49           H        GLN  49 -22.889  11.787  -6.900
    2    HA   GLN  49           HA       GLN  49 -25.496  12.782  -7.031
    3    HB2  GLN  49           HB2      GLN  49 -22.996  13.779  -8.379
    4    HB3  GLN  49           HB3      GLN  49 -24.501  14.675  -8.282
    5    HG2  GLN  49           HG2      GLN  49 -24.341  14.675  -5.845
    6    HG3  GLN  49           HG3      GLN  49 -22.848  13.756  -5.941
    7   HE21  GLN  49          HE21      GLN  49 -22.832  15.971  -4.639
    8   HE22  GLN  49          HE22      GLN  49 -21.967  17.276  -5.271

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ASN  50           H        ASN  50 -23.735  11.012  -9.442
    2    HA   ASN  50           HA       ASN  50 -25.657  11.825 -11.512
    3    HB2  ASN  50           HB2      ASN  50 -23.010  10.407 -11.766
    4    HB3  ASN  50           HB3      ASN  50 -24.078  10.802 -13.104
    5   HD21  ASN  50          HD21      ASN  50 -21.483  11.745 -11.482
    6   HD22  ASN  50          HD22      ASN  50 -21.324  13.394 -11.803

  No H/Q in entry =           6
  In of MODEL    9
    1    H    ALA  51           H        ALA  51 -25.535   9.442  -9.298
    2    HA   ALA  51           HA       ALA  51 -26.222   7.288 -11.152
    3    HB2  ALA  51           HB1      ALA  51 -25.578   5.945  -9.483
    4    HB3  ALA  51           HB2      ALA  51 -26.735   6.688  -8.379
    5    HB1  ALA  51           HB3      ALA  51 -25.125   7.385  -8.569

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ASP  52           H        ASP  52 -28.177   6.142 -11.026
    2    HA   ASP  52           HA       ASP  52 -30.439   7.867 -10.337
    3    HB2  ASP  52           HB2      ASP  52 -30.137   5.395 -12.039
    4    HB3  ASP  52           HB3      ASP  52 -31.712   6.052 -11.595

  No H/Q in entry =           4
  In of MODEL    9
    1    H    VAL  53           H        VAL  53 -28.710   5.039  -9.359
    2    HA   VAL  53           HA       VAL  53 -30.153   5.070  -6.841
    3    HB   VAL  53           HB       VAL  53 -31.479   3.383  -8.106
    4   HG11  VAL  53          HG11      VAL  53 -29.696   2.622  -9.639
    5   HG13  VAL  53          HG12      VAL  53 -30.470   1.280  -8.797
    6   HG12  VAL  53          HG13      VAL  53 -28.883   1.847  -8.280
    7   HG23  VAL  53          HG21      VAL  53 -30.569   1.423  -6.440
    8   HG22  VAL  53          HG22      VAL  53 -31.754   2.671  -6.056
    9   HG21  VAL  53          HG23      VAL  53 -30.056   2.913  -5.647

  No H/Q in entry =           9
  In of MODEL    9
    1    H    VAL  54           H        VAL  54 -28.822   4.674  -5.191
    2    HA   VAL  54           HA       VAL  54 -26.027   3.954  -5.814
    3    HB   VAL  54           HB       VAL  54 -27.173   5.654  -3.542
    4   HG11  VAL  54          HG11      VAL  54 -24.535   4.354  -3.851
    5   HG13  VAL  54          HG12      VAL  54 -25.315   4.980  -2.400
    6   HG12  VAL  54          HG13      VAL  54 -24.457   6.077  -3.482
    7   HG22  VAL  54          HG21      VAL  54 -26.395   7.519  -4.617
    8   HG21  VAL  54          HG22      VAL  54 -26.899   6.523  -5.982
    9   HG23  VAL  54          HG23      VAL  54 -25.195   6.618  -5.544

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LEU  55           H        LEU  55 -25.351   2.052  -5.196
    2    HA   LEU  55           HA       LEU  55 -26.799   0.649  -3.038
    3    HB2  LEU  55           HB2      LEU  55 -25.194  -0.420  -5.349
    4    HB3  LEU  55           HB3      LEU  55 -25.912  -1.403  -4.072
    5    HG   LEU  55           HG       LEU  55 -27.418   0.147  -6.169
    6   HD13  LEU  55          HD11      LEU  55 -27.039  -1.674  -7.412
    7   HD12  LEU  55          HD12      LEU  55 -27.956  -2.606  -6.229
    8   HD11  LEU  55          HD13      LEU  55 -26.205  -2.466  -6.077
    9   HD23  LEU  55          HD21      LEU  55 -28.626  -1.877  -4.339
   10   HD22  LEU  55          HD22      LEU  55 -29.381  -0.516  -5.168
   11   HD21  LEU  55          HD23      LEU  55 -28.372  -0.234  -3.749

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LEU  56           H        LEU  56 -25.621   0.082  -1.241
    2    HA   LEU  56           HA       LEU  56 -22.707   0.606  -1.285
    3    HB2  LEU  56           HB2      LEU  56 -24.497   0.285   1.110
    4    HB3  LEU  56           HB3      LEU  56 -22.808   0.788   1.105
    5    HG   LEU  56           HG       LEU  56 -25.179   2.378   0.163
    6   HD11  LEU  56          HD11      LEU  56 -24.047   2.012   2.678
    7   HD13  LEU  56          HD12      LEU  56 -25.095   3.344   2.190
    8   HD12  LEU  56          HD13      LEU  56 -23.345   3.525   2.104
    9   HD23  LEU  56          HD21      LEU  56 -23.309   4.162  -0.008
   10   HD22  LEU  56          HD22      LEU  56 -23.645   3.066  -1.350
   11   HD21  LEU  56          HD23      LEU  56 -22.277   2.759  -0.282

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLY  57           H        GLY  57 -21.257  -0.971  -0.772
    2    HA3  GLY  57           HA2      GLY  57 -22.061  -3.691  -1.006
    3    HA2  GLY  57           HA3      GLY  57 -20.462  -3.133  -0.519

  No H/Q in entry =           3
  In of MODEL    9
    1    HA   PRO  58           HA       PRO  58 -23.222  -4.340   3.177
    2    HB2  PRO  58           HB2      PRO  58 -22.425  -6.921   3.750
    3    HB3  PRO  58           HB3      PRO  58 -23.826  -6.559   2.743
    4    HG2  PRO  58           HG2      PRO  58 -21.063  -7.312   1.944
    5    HG3  PRO  58           HG3      PRO  58 -22.608  -7.830   1.268
    6    HD2  PRO  58           HD2      PRO  58 -21.079  -5.929   0.069
    7    HD3  PRO  58           HD3      PRO  58 -22.840  -5.917  -0.033

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLN  59           H        GLN  59 -19.835  -4.659   2.564
    2    HA   GLN  59           HA       GLN  59 -19.078  -4.680   5.325
    3    HB2  GLN  59           HB2      GLN  59 -17.533  -3.738   2.904
    4    HB3  GLN  59           HB3      GLN  59 -16.865  -3.923   4.512
    5    HG2  GLN  59           HG2      GLN  59 -18.020  -6.142   2.831
    6    HG3  GLN  59           HG3      GLN  59 -16.309  -5.796   3.025
    7   HE21  GLN  59          HE21      GLN  59 -15.473  -6.822   4.440
    8   HE22  GLN  59          HE22      GLN  59 -15.793  -7.698   5.817

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ILE  60           H        ILE  60 -20.121  -2.143   3.149
    2    HA   ILE  60           HA       ILE  60 -19.352  -0.178   5.220
    3    HB   ILE  60           HB       ILE  60 -19.674   1.562   3.408
    4   HG12  ILE  60          HG12      ILE  60 -19.349  -0.645   1.416
    5   HG13  ILE  60          HG13      ILE  60 -20.963  -0.174   1.948
    6   HG21  ILE  60          HG21      ILE  60 -17.488   0.579   4.161
    7   HG23  ILE  60          HG22      ILE  60 -17.506   1.349   2.575
    8   HG22  ILE  60          HG23      ILE  60 -17.542  -0.409   2.700
    9   HD13  ILE  60          HD11      ILE  60 -20.717   1.164   0.080
   10   HD12  ILE  60          HD12      ILE  60 -18.982   1.361   0.319
   11   HD11  ILE  60          HD13      ILE  60 -20.118   2.249   1.334

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ALA  61           H        ALA  61 -21.737  -1.868   5.269
    2    HA   ALA  61           HA       ALA  61 -24.033  -0.295   4.832
    3    HB1  ALA  61           HB1      ALA  61 -25.183  -1.852   6.138
    4    HB2  ALA  61           HB2      ALA  61 -23.769  -2.194   7.136
    5    HB3  ALA  61           HB3      ALA  61 -23.840  -2.782   5.475

  No H/Q in entry =           5
  In of MODEL    9
    1    H    TYR  62           H        TYR  62 -21.822  -0.347   7.627
    2    HA   TYR  62           HA       TYR  62 -23.445   1.220   9.319
    3    HB2  TYR  62           HB2      TYR  62 -21.415   1.726  10.550
    4    HB3  TYR  62           HB3      TYR  62 -21.418   0.026  10.085
    5    HD1  TYR  62           HD1      TYR  62 -19.809  -0.825   8.430
    6    HD2  TYR  62           HD2      TYR  62 -19.762   3.281   9.610
    7    HE1  TYR  62           HE1      TYR  62 -17.608  -0.546   7.355
    8    HE2  TYR  62           HE2      TYR  62 -17.546   3.556   8.536
    9    HH   TYR  62           HH       TYR  62 -16.350   1.493   6.344

  No H/Q in entry =           9
  In of MODEL    9
    1    H    MET  63           H        MET  63 -21.842   2.184   6.474
    2    HA   MET  63           HA       MET  63 -21.795   5.012   7.204
    3    HB2  MET  63           HB2      MET  63 -21.122   3.544   4.655
    4    HB3  MET  63           HB3      MET  63 -21.013   5.296   4.848
    5    HG2  MET  63           HG2      MET  63 -19.288   5.014   6.531
    6    HG3  MET  63           HG3      MET  63 -19.412   3.262   6.378
    7    HE2  MET  63           HE1      MET  63 -17.505   6.354   3.929
    8    HE1  MET  63           HE2      MET  63 -19.054   6.470   4.764
    9    HE3  MET  63           HE3      MET  63 -19.004   6.027   3.057

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LEU  64           H        LEU  64 -24.279   3.063   6.217
    2    HA   LEU  64           HA       LEU  64 -25.550   4.455   4.157
    3    HB2  LEU  64           HB2      LEU  64 -26.328   2.304   5.048
    4    HB3  LEU  64           HB3      LEU  64 -26.819   3.107   6.538
    5    HG   LEU  64           HG       LEU  64 -28.566   4.305   5.327
    6   HD13  LEU  64          HD11      LEU  64 -28.296   4.586   3.098
    7   HD12  LEU  64          HD12      LEU  64 -28.872   2.927   2.931
    8   HD11  LEU  64          HD13      LEU  64 -27.141   3.259   2.993
    9   HD23  LEU  64          HD21      LEU  64 -28.967   1.483   4.544
   10   HD22  LEU  64          HD22      LEU  64 -30.000   2.563   5.478
   11   HD21  LEU  64          HD23      LEU  64 -28.593   1.818   6.235

  No H/Q in entry =          11
  In of MODEL    9
    1    HA   PRO  65           HA       PRO  65 -27.857   7.481   6.949
    2    HB2  PRO  65           HB2      PRO  65 -25.862   7.694   9.204
    3    HB3  PRO  65           HB3      PRO  65 -27.612   7.901   9.254
    4    HG2  PRO  65           HG2      PRO  65 -26.589   5.676  10.152
    5    HG3  PRO  65           HG3      PRO  65 -28.007   5.598   9.107
    6    HD2  PRO  65           HD2      PRO  65 -25.112   5.111   8.395
    7    HD3  PRO  65           HD3      PRO  65 -26.533   4.171   7.936

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLU  66           H        GLU  66 -24.302   7.571   7.020
    2    HA   GLU  66           HA       GLU  66 -24.121  10.385   6.650
    3    HB2  GLU  66           HB2      GLU  66 -22.214   8.162   5.968
    4    HB3  GLU  66           HB3      GLU  66 -21.835   9.874   5.783
    5    HG2  GLU  66           HG2      GLU  66 -22.060  10.205   8.155
    6    HG3  GLU  66           HG3      GLU  66 -22.516   8.515   8.366

  No H/Q in entry =           6
  In of MODEL    9
    1    H    ILE  67           H        ILE  67 -24.112   7.665   4.364
    2    HA   ILE  67           HA       ILE  67 -23.768   9.419   2.092
    3    HB   ILE  67           HB       ILE  67 -24.548   6.476   2.235
    4   HG12  ILE  67          HG12      ILE  67 -21.969   7.762   1.327
    5   HG13  ILE  67          HG13      ILE  67 -22.245   7.311   3.007
    6   HG21  ILE  67          HG21      ILE  67 -24.570   8.383   0.034
    7   HG23  ILE  67          HG22      ILE  67 -25.127   6.710   0.064
    8   HG22  ILE  67          HG23      ILE  67 -23.432   7.068  -0.261
    9   HD12  ILE  67          HD11      ILE  67 -21.756   5.587   0.635
   10   HD11  ILE  67          HD12      ILE  67 -22.745   4.957   1.951
   11   HD13  ILE  67          HD13      ILE  67 -21.091   5.485   2.266

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLN  68           H        GLN  68 -26.592   8.231   3.713
    2    HA   GLN  68           HA       GLN  68 -28.459   9.112   1.753
    3    HB2  GLN  68           HB2      GLN  68 -28.697   8.707   4.731
    4    HB3  GLN  68           HB3      GLN  68 -30.040   9.261   3.746
    5    HG2  GLN  68           HG2      GLN  68 -29.989   7.249   2.445
    6    HG3  GLN  68           HG3      GLN  68 -28.518   6.720   3.238
    7   HE21  GLN  68          HE21      GLN  68 -30.641   5.279   3.087
    8   HE22  GLN  68          HE22      GLN  68 -31.450   4.773   4.497

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ARG  69           H        ARG  69 -26.916  10.806   4.510
    2    HA   ARG  69           HA       ARG  69 -28.376  13.238   4.137
    3    HB2  ARG  69           HB2      ARG  69 -25.995  12.379   5.713
    4    HB3  ARG  69           HB3      ARG  69 -26.141  14.099   5.376
    5    HG2  ARG  69           HG2      ARG  69 -28.457  14.040   6.349
    6    HG3  ARG  69           HG3      ARG  69 -28.183  12.353   6.802
    7    HD2  ARG  69           HD2      ARG  69 -26.581  14.759   7.745
    8    HD3  ARG  69           HD3      ARG  69 -27.673  13.798   8.728
    9    HE   ARG  69           HE       ARG  69 -25.028  12.980   7.764
   10   HH21  ARG  69          HH11      ARG  69 -24.151  11.234   8.937
   11   HH22  ARG  69          HH12      ARG  69 -25.146  10.364  10.056
   12   HH11  ARG  69          HH21      ARG  69 -27.959  12.298   9.457
   13   HH12  ARG  69          HH22      ARG  69 -27.303  10.964  10.348

  No H/Q in entry =          13
  In of MODEL    9
    1    H    LEU  70           H        LEU  70 -25.455  11.959   2.757
    2    HA   LEU  70           HA       LEU  70 -24.435  14.381   1.619
    3    HB2  LEU  70           HB2      LEU  70 -23.352  12.095   2.183
    4    HB3  LEU  70           HB3      LEU  70 -23.951  11.627   0.592
    5    HG   LEU  70           HG       LEU  70 -22.412  13.072  -0.477
    6   HD11  LEU  70          HD11      LEU  70 -21.619  13.910   2.321
    7   HD13  LEU  70          HD12      LEU  70 -22.354  14.934   1.087
    8   HD12  LEU  70          HD13      LEU  70 -20.718  14.316   0.856
    9   HD22  LEU  70          HD21      LEU  70 -20.915  11.408  -0.268
   10   HD21  LEU  70          HD22      LEU  70 -21.818  10.833   1.133
   11   HD23  LEU  70          HD23      LEU  70 -20.475  11.954   1.350

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LEU  71           H        LEU  71 -26.493  11.773   0.472
    2    HA   LEU  71           HA       LEU  71 -27.076  13.273  -2.023
    3    HB2  LEU  71           HB2      LEU  71 -27.171  10.277  -1.616
    4    HB3  LEU  71           HB3      LEU  71 -27.334  11.152  -3.138
    5    HG   LEU  71           HG       LEU  71 -24.813  11.236  -1.480
    6   HD12  LEU  71          HD11      LEU  71 -24.810   9.639  -3.933
    7   HD11  LEU  71          HD12      LEU  71 -25.794   8.962  -2.637
    8   HD13  LEU  71          HD13      LEU  71 -24.086   9.301  -2.360
    9   HD22  LEU  71          HD21      LEU  71 -24.984  13.067  -2.950
   10   HD21  LEU  71          HD22      LEU  71 -25.445  12.024  -4.294
   11   HD23  LEU  71          HD23      LEU  71 -23.819  11.927  -3.620

  No H/Q in entry =          11
  In of MODEL    9
    1    HA   PRO  72           HA       PRO  72 -30.919  12.650   0.596
    2    HB2  PRO  72           HB2      PRO  72 -31.868  15.180   0.549
    3    HB3  PRO  72           HB3      PRO  72 -30.543  14.761   1.633
    4    HG2  PRO  72           HG2      PRO  72 -30.403  15.997  -1.106
    5    HG3  PRO  72           HG3      PRO  72 -29.654  16.556   0.390
    6    HD2  PRO  72           HD2      PRO  72 -28.266  15.069  -1.398
    7    HD3  PRO  72           HD3      PRO  72 -28.002  14.888   0.335

  No H/Q in entry =           7
  In of MODEL    9
    1    H    ASN  73           H        ASN  73 -30.336  13.669  -2.607
    2    HA   ASN  73           HA       ASN  73 -33.184  13.268  -3.239
    3    HB2  ASN  73           HB2      ASN  73 -32.761  14.417  -5.323
    4    HB3  ASN  73           HB3      ASN  73 -32.270  15.396  -3.949
    5   HD21  ASN  73          HD21      ASN  73 -31.482  15.504  -6.627
    6   HD22  ASN  73          HD22      ASN  73 -29.809  15.403  -6.824

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LYS  74           H        LYS  74 -31.126  11.078  -2.847
    2    HA   LYS  74           HA       LYS  74 -31.649   9.696  -5.412
    3    HB2  LYS  74           HB2      LYS  74 -29.105   9.471  -3.798
    4    HB3  LYS  74           HB3      LYS  74 -29.463   8.666  -5.325
    5    HG2  LYS  74           HG2      LYS  74 -29.300  11.640  -5.085
    6    HG3  LYS  74           HG3      LYS  74 -27.891  10.629  -5.405
    7    HD2  LYS  74           HD2      LYS  74 -28.979   9.689  -7.359
    8    HD3  LYS  74           HD3      LYS  74 -30.431  10.633  -7.025
    9    HE2  LYS  74           HE2      LYS  74 -29.275  12.685  -7.442
   10    HE3  LYS  74           HE3      LYS  74 -27.724  11.848  -7.547
   11    HZ2  LYS  74           HZ1      LYS  74 -29.219  12.429  -9.662
   12    HZ1  LYS  74           HZ2      LYS  74 -29.821  10.880  -9.308
   13    HZ3  LYS  74           HZ3      LYS  74 -28.163  11.100  -9.605

  No H/Q in entry =          13
  In of MODEL    9
    1    HA   PRO  75           HA       PRO  75 -32.937   6.627  -2.478
    2    HB2  PRO  75           HB2      PRO  75 -33.174   4.421  -4.088
    3    HB3  PRO  75           HB3      PRO  75 -34.345   5.738  -4.139
    4    HG2  PRO  75           HG2      PRO  75 -31.992   5.243  -5.921
    5    HG3  PRO  75           HG3      PRO  75 -33.655   5.630  -6.360
    6    HD2  PRO  75           HD2      PRO  75 -31.777   7.559  -6.295
    7    HD3  PRO  75           HD3      PRO  75 -33.421   7.896  -5.750

  No H/Q in entry =           7
  In of MODEL    9
    1    H    VAL  76           H        VAL  76 -31.447   5.605  -1.121
    2    HA   VAL  76           HA       VAL  76 -28.944   4.492  -2.246
    3    HB   VAL  76           HB       VAL  76 -29.278   5.914   0.431
    4   HG11  VAL  76          HG11      VAL  76 -26.882   4.724  -0.980
    5   HG13  VAL  76          HG12      VAL  76 -27.561   4.231   0.573
    6   HG12  VAL  76          HG13      VAL  76 -26.767   5.797   0.416
    7   HG22  VAL  76          HG21      VAL  76 -28.675   7.848  -0.433
    8   HG21  VAL  76          HG22      VAL  76 -29.196   7.153  -1.968
    9   HG23  VAL  76          HG23      VAL  76 -27.491   7.117  -1.517

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLU  77           H        GLU  77 -28.655   2.339  -1.661
    2    HA   GLU  77           HA       GLU  77 -29.412   1.492   0.983
    3    HB2  GLU  77           HB2      GLU  77 -30.963  -0.201   0.434
    4    HB3  GLU  77           HB3      GLU  77 -31.564   1.311  -0.248
    5    HG2  GLU  77           HG2      GLU  77 -30.933   0.602  -2.445
    6    HG3  GLU  77           HG3      GLU  77 -30.240  -0.881  -1.792

  No H/Q in entry =           6
  In of MODEL    9
    1    H    VAL  78           H        VAL  78 -29.013  -0.591   1.617
    2    HA   VAL  78           HA       VAL  78 -26.324  -1.261   0.717
    3    HB   VAL  78           HB       VAL  78 -27.999  -2.232   3.072
    4   HG11  VAL  78          HG11      VAL  78 -25.621  -3.367   1.930
    5   HG13  VAL  78          HG12      VAL  78 -26.510  -3.886   3.363
    6   HG12  VAL  78          HG13      VAL  78 -25.231  -2.682   3.507
    7   HG22  VAL  78          HG21      VAL  78 -26.584  -0.837   4.426
    8   HG21  VAL  78          HG22      VAL  78 -27.355   0.123   3.163
    9   HG23  VAL  78          HG23      VAL  78 -25.661  -0.346   3.006

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ILE  79           H        ILE  79 -25.724  -3.138  -0.214
    2    HA   ILE  79           HA       ILE  79 -27.736  -4.668  -1.578
    3    HB   ILE  79           HB       ILE  79 -24.729  -5.096  -1.366
    4   HG12  ILE  79          HG12      ILE  79 -26.405  -4.019  -3.638
    5   HG13  ILE  79          HG13      ILE  79 -25.564  -2.995  -2.474
    6   HG22  ILE  79          HG21      ILE  79 -25.793  -6.283  -3.699
    7   HG21  ILE  79          HG22      ILE  79 -26.758  -6.855  -2.337
    8   HG23  ILE  79          HG23      ILE  79 -25.009  -7.075  -2.331
    9   HD13  ILE  79          HD11      ILE  79 -24.149  -3.038  -4.294
   10   HD12  ILE  79          HD12      ILE  79 -24.431  -4.753  -4.596
   11   HD11  ILE  79          HD13      ILE  79 -23.463  -4.249  -3.210

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ASP  80           H        ASP  80 -28.535  -6.626  -1.018
    2    HA   ASP  80           HA       ASP  80 -28.447  -7.557   1.617
    3    HB2  ASP  80           HB2      ASP  80 -30.183  -8.171  -0.028
    4    HB3  ASP  80           HB3      ASP  80 -28.992  -9.128  -0.910

  No H/Q in entry =           4
  In of MODEL    9
    1    H    SER  81           H        SER  81 -26.873  -8.653   2.732
    2    HA   SER  81           HA       SER  81 -24.357  -9.236   1.530
    3    HB2  SER  81           HB2      SER  81 -23.711 -10.168   3.670
    4    HB3  SER  81           HB3      SER  81 -24.637  -8.695   3.954
    5    HG   SER  81           HG       SER  81 -26.480 -10.255   4.086

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU  82           H        LEU  82 -26.995 -11.422   1.828
    2    HA   LEU  82           HA       LEU  82 -25.368 -13.729   1.277
    3    HB2  LEU  82           HB2      LEU  82 -28.324 -13.209   1.033
    4    HB3  LEU  82           HB3      LEU  82 -27.568 -14.783   0.800
    5    HG   LEU  82           HG       LEU  82 -27.560 -13.238   3.374
    6   HD11  LEU  82          HD11      LEU  82 -29.256 -15.520   2.349
    7   HD13  LEU  82          HD12      LEU  82 -29.803 -13.951   2.948
    8   HD12  LEU  82          HD13      LEU  82 -29.107 -15.128   4.063
    9   HD21  LEU  82          HD21      LEU  82 -26.486 -15.882   2.433
   10   HD23  LEU  82          HD22      LEU  82 -26.867 -15.610   4.133
   11   HD22  LEU  82          HD23      LEU  82 -25.658 -14.608   3.331

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LEU  83           H        LEU  83 -27.403 -11.548  -0.612
    2    HA   LEU  83           HA       LEU  83 -27.159 -12.869  -3.101
    3    HB2  LEU  83           HB2      LEU  83 -27.666  -9.986  -2.417
    4    HB3  LEU  83           HB3      LEU  83 -27.678 -10.610  -4.065
    5    HG   LEU  83           HG       LEU  83 -29.695 -11.092  -1.892
    6   HD13  LEU  83          HD11      LEU  83 -30.514  -9.258  -2.933
    7   HD12  LEU  83          HD12      LEU  83 -30.941 -10.371  -4.232
    8   HD11  LEU  83          HD13      LEU  83 -29.437  -9.453  -4.314
    9   HD23  LEU  83          HD21      LEU  83 -29.795 -12.321  -4.632
   10   HD22  LEU  83          HD22      LEU  83 -30.750 -12.720  -3.205
   11   HD21  LEU  83          HD23      LEU  83 -29.047 -13.166  -3.278

  No H/Q in entry =          11
  In of MODEL    9
    1    H    TYR  84           H        TYR  84 -25.285 -10.440  -1.397
    2    HA   TYR  84           HA       TYR  84 -23.443  -9.864  -3.523
    3    HB2  TYR  84           HB2      TYR  84 -23.993  -8.399  -1.515
    4    HB3  TYR  84           HB3      TYR  84 -22.992  -9.493  -0.561
    5    HD1  TYR  84           HD1      TYR  84 -20.563  -9.893  -1.520
    6    HD2  TYR  84           HD2      TYR  84 -22.998  -6.509  -2.444
    7    HE1  TYR  84           HE1      TYR  84 -18.542  -8.638  -2.193
    8    HE2  TYR  84           HE2      TYR  84 -20.988  -5.246  -3.129
    9    HH   TYR  84           HH       TYR  84 -18.745  -5.255  -3.198

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLY  85           H        GLY  85 -23.132 -11.892  -0.601
    2    HA3  GLY  85           HA2      GLY  85 -20.525 -12.742  -1.097
    3    HA2  GLY  85           HA3      GLY  85 -21.725 -13.641  -0.169

  No H/Q in entry =           3
  In of MODEL    9
    1    H    LYS  86           H        LYS  86 -23.561 -14.052  -2.232
    2    HA   LYS  86           HA       LYS  86 -22.430 -16.373  -3.521
    3    HB2  LYS  86           HB2      LYS  86 -25.122 -15.015  -3.590
    4    HB3  LYS  86           HB3      LYS  86 -24.768 -16.543  -4.394
    5    HG2  LYS  86           HG2      LYS  86 -24.417 -17.612  -2.279
    6    HG3  LYS  86           HG3      LYS  86 -24.663 -16.080  -1.438
    7    HD2  LYS  86           HD2      LYS  86 -26.768 -17.145  -1.362
    8    HD3  LYS  86           HD3      LYS  86 -26.907 -15.961  -2.661
    9    HE2  LYS  86           HE2      LYS  86 -26.739 -17.605  -4.327
   10    HE3  LYS  86           HE3      LYS  86 -26.107 -18.803  -3.199
   11    HZ3  LYS  86           HZ1      LYS  86 -28.150 -19.370  -2.552
   12    HZ2  LYS  86           HZ2      LYS  86 -28.709 -18.538  -3.925
   13    HZ1  LYS  86           HZ3      LYS  86 -28.665 -17.756  -2.418

  No H/Q in entry =          13
  In of MODEL    9
    1    H    VAL  87           H        VAL  87 -22.528 -13.150  -4.376
    2    HA   VAL  87           HA       VAL  87 -22.271 -11.944  -6.303
    3    HB   VAL  87           HB       VAL  87 -21.126 -14.392  -7.674
    4   HG13  VAL  87          HG11      VAL  87 -19.925 -12.854  -8.936
    5   HG12  VAL  87          HG12      VAL  87 -19.931 -11.643  -7.653
    6   HG11  VAL  87          HG13      VAL  87 -21.387 -11.926  -8.607
    7   HG21  VAL  87          HG21      VAL  87 -20.218 -14.385  -5.381
    8   HG23  VAL  87          HG22      VAL  87 -19.643 -12.740  -5.640
    9   HG22  VAL  87          HG23      VAL  87 -18.993 -14.063  -6.605

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ASP  88           H        ASP  88 -24.763 -12.675  -5.957
    2    HA   ASP  88           HA       ASP  88 -25.847 -13.901  -8.367
    3    HB2  ASP  88           HB2      ASP  88 -26.830 -14.206  -6.044
    4    HB3  ASP  88           HB3      ASP  88 -27.340 -12.520  -6.123

  No H/Q in entry =           4
  In of MODEL    9
    1    H    GLY  89           H        GLY  89 -25.188 -12.601  -9.994
    2    HA3  GLY  89           HA2      GLY  89 -25.464  -9.833 -10.162
    3    HA2  GLY  89           HA3      GLY  89 -25.404 -10.937 -11.536

  No H/Q in entry =           3
  In of MODEL    9
    1    H    LEU  90           H        LEU  90 -27.802 -12.376 -11.100
    2    HA   LEU  90           HA       LEU  90 -29.680 -10.492 -12.189
    3    HB2  LEU  90           HB2      LEU  90 -29.664 -12.882 -12.797
    4    HB3  LEU  90           HB3      LEU  90 -30.154 -13.285 -11.151
    5    HG   LEU  90           HG       LEU  90 -32.311 -12.237 -11.498
    6   HD13  LEU  90          HD11      LEU  90 -32.193 -10.473 -12.954
    7   HD12  LEU  90          HD12      LEU  90 -32.692 -11.715 -14.104
    8   HD11  LEU  90          HD13      LEU  90 -30.993 -11.264 -13.978
    9   HD23  LEU  90          HD21      LEU  90 -32.190 -13.835 -13.952
   10   HD22  LEU  90          HD22      LEU  90 -33.161 -14.050 -12.496
   11   HD21  LEU  90          HD23      LEU  90 -31.487 -14.605 -12.530

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLY  91           H        GLY  91 -29.455 -12.024  -9.022
    2    HA3  GLY  91           HA2      GLY  91 -31.829 -11.004  -7.966
    3    HA2  GLY  91           HA3      GLY  91 -30.417 -11.499  -7.032

  No H/Q in entry =           3
  In of MODEL    9
    1    H    VAL  92           H        VAL  92 -28.564  -9.598  -7.870
    2    HA   VAL  92           HA       VAL  92 -29.431  -7.343  -6.293
    3    HB   VAL  92           HB       VAL  92 -26.874  -7.706  -7.899
    4   HG12  VAL  92          HG11      VAL  92 -27.099  -5.855  -5.550
    5   HG11  VAL  92          HG12      VAL  92 -27.785  -5.317  -7.085
    6   HG13  VAL  92          HG13      VAL  92 -26.074  -5.727  -6.981
    7   HG22  VAL  92          HG21      VAL  92 -26.593  -9.303  -6.325
    8   HG21  VAL  92          HG22      VAL  92 -27.762  -8.576  -5.221
    9   HG23  VAL  92          HG23      VAL  92 -26.130  -7.917  -5.339

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LEU  93           H        LEU  93 -29.008  -7.951  -9.722
    2    HA   LEU  93           HA       LEU  93 -29.447  -5.319 -10.621
    3    HB2  LEU  93           HB2      LEU  93 -28.745  -7.134 -12.104
    4    HB3  LEU  93           HB3      LEU  93 -30.310  -7.918 -11.888
    5    HG   LEU  93           HG       LEU  93 -31.391  -5.978 -12.987
    6   HD11  LEU  93          HD11      LEU  93 -29.594  -4.326 -12.468
    7   HD13  LEU  93          HD12      LEU  93 -30.036  -4.352 -14.177
    8   HD12  LEU  93          HD13      LEU  93 -28.556  -5.141 -13.637
    9   HD23  LEU  93          HD21      LEU  93 -30.337  -6.483 -15.283
   10   HD22  LEU  93          HD22      LEU  93 -31.133  -7.778 -14.390
   11   HD21  LEU  93          HD23      LEU  93 -29.373  -7.662 -14.394

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LYS  94           H        LYS  94 -31.731  -7.955  -9.796
    2    HA   LYS  94           HA       LYS  94 -34.125  -6.588 -10.400
    3    HB2  LYS  94           HB2      LYS  94 -33.531  -8.777  -8.415
    4    HB3  LYS  94           HB3      LYS  94 -35.152  -8.135  -8.672
    5    HG2  LYS  94           HG2      LYS  94 -35.045  -8.880 -11.015
    6    HG3  LYS  94           HG3      LYS  94 -33.457  -9.580 -10.699
    7    HD2  LYS  94           HD2      LYS  94 -34.527 -10.973  -8.887
    8    HD3  LYS  94           HD3      LYS  94 -36.093 -10.373  -9.432
    9    HE2  LYS  94           HE2      LYS  94 -35.551 -11.257 -11.710
   10    HE3  LYS  94           HE3      LYS  94 -34.108 -11.999 -11.018
   11    HZ3  LYS  94           HZ1      LYS  94 -35.904 -13.582 -11.203
   12    HZ2  LYS  94           HZ2      LYS  94 -36.911 -12.601 -10.248
   13    HZ1  LYS  94           HZ3      LYS  94 -35.525 -13.309  -9.570

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ALA  95           H        ALA  95 -32.291  -6.681  -7.357
    2    HA   ALA  95           HA       ALA  95 -34.191  -5.184  -5.856
    3    HB2  ALA  95           HB1      ALA  95 -31.769  -6.481  -5.339
    4    HB3  ALA  95           HB2      ALA  95 -32.775  -5.623  -4.174
    5    HB1  ALA  95           HB3      ALA  95 -31.458  -4.782  -4.988

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA  96           H        ALA  96 -31.586  -4.215  -7.948
    2    HA   ALA  96           HA       ALA  96 -31.582  -1.460  -7.142
    3    HB2  ALA  96           HB1      ALA  96 -30.234  -1.163  -9.251
    4    HB3  ALA  96           HB2      ALA  96 -30.479  -2.877  -9.590
    5    HB1  ALA  96           HB3      ALA  96 -29.578  -2.382  -8.157

  No H/Q in entry =           5
  In of MODEL    9
    1    H    VAL  97           H        VAL  97 -33.061  -3.194  -9.846
    2    HA   VAL  97           HA       VAL  97 -34.211  -0.918 -11.072
    3    HB   VAL  97           HB       VAL  97 -34.921  -3.869 -11.148
    4   HG11  VAL  97          HG11      VAL  97 -36.781  -1.919 -11.607
    5   HG13  VAL  97          HG12      VAL  97 -36.788  -3.503 -12.381
    6   HG12  VAL  97          HG13      VAL  97 -36.083  -2.120 -13.214
    7   HG21  VAL  97          HG21      VAL  97 -33.709  -1.975 -13.163
    8   HG23  VAL  97          HG22      VAL  97 -34.106  -3.666 -13.471
    9   HG22  VAL  97          HG23      VAL  97 -32.868  -3.251 -12.284

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ALA  98           H        ALA  98 -35.314  -3.165  -8.560
    2    HA   ALA  98           HA       ALA  98 -37.910  -2.107  -8.190
    3    HB1  ALA  98           HB1      ALA  98 -36.823  -4.283  -7.185
    4    HB3  ALA  98           HB2      ALA  98 -38.030  -3.410  -6.241
    5    HB2  ALA  98           HB3      ALA  98 -36.315  -3.208  -5.882

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA  99           H        ALA  99 -34.856  -1.227  -6.539
    2    HA   ALA  99           HA       ALA  99 -36.046   0.699  -4.851
    3    HB1  ALA  99           HB1      ALA  99 -33.372  -0.095  -5.615
    4    HB2  ALA  99           HB2      ALA  99 -33.942   0.619  -4.106
    5    HB3  ALA  99           HB3      ALA  99 -33.502   1.658  -5.461

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ILE 100           H        ILE 100 -35.018   0.904  -8.207
    2    HA   ILE 100           HA       ILE 100 -35.289   3.747  -8.391
    3    HB   ILE 100           HB       ILE 100 -35.320   1.617 -10.556
    4   HG12  ILE 100          HG12      ILE 100 -33.220   3.669  -9.865
    5   HG13  ILE 100          HG13      ILE 100 -33.202   2.015  -9.255
    6   HG21  ILE 100          HG21      ILE 100 -35.836   4.524 -10.650
    7   HG23  ILE 100          HG22      ILE 100 -36.304   3.253 -11.780
    8   HG22  ILE 100          HG23      ILE 100 -34.673   3.922 -11.831
    9   HD12  ILE 100          HD11      ILE 100 -32.707   3.022 -12.017
   10   HD11  ILE 100          HD12      ILE 100 -33.315   1.384 -11.782
   11   HD13  ILE 100          HD13      ILE 100 -31.782   1.868 -11.060

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LYS 101           H        LYS 101 -37.500   1.076  -9.145
    2    HA   LYS 101           HA       LYS 101 -39.635   2.670 -10.120
    3    HB2  LYS 101           HB2      LYS 101 -39.428  -0.113  -9.027
    4    HB3  LYS 101           HB3      LYS 101 -41.005   0.603  -9.360
    5    HG2  LYS 101           HG2      LYS 101 -40.540   0.781 -11.656
    6    HG3  LYS 101           HG3      LYS 101 -38.831   0.428 -11.411
    7    HD2  LYS 101           HD2      LYS 101 -40.022  -1.508 -12.318
    8    HD3  LYS 101           HD3      LYS 101 -39.381  -1.839 -10.708
    9    HE2  LYS 101           HE2      LYS 101 -41.420  -2.605 -10.206
   10    HE3  LYS 101           HE3      LYS 101 -41.930  -0.916 -10.187
   11    HZ3  LYS 101           HZ1      LYS 101 -42.822  -1.075 -12.305
   12    HZ2  LYS 101           HZ2      LYS 101 -43.234  -2.571 -11.615
   13    HZ1  LYS 101           HZ3      LYS 101 -41.932  -2.467 -12.700

  No H/Q in entry =          13
  In of MODEL    9
    1    H    LYS 102           H        LYS 102 -39.089   1.169  -6.931
    2    HA   LYS 102           HA       LYS 102 -41.370   2.276  -5.713
    3    HB2  LYS 102           HB2      LYS 102 -40.073   0.437  -4.725
    4    HB3  LYS 102           HB3      LYS 102 -38.716   1.533  -4.470
    5    HG2  LYS 102           HG2      LYS 102 -40.073   2.866  -2.953
    6    HG3  LYS 102           HG3      LYS 102 -41.433   1.774  -3.209
    7    HD2  LYS 102           HD2      LYS 102 -40.147  -0.065  -2.210
    8    HD3  LYS 102           HD3      LYS 102 -38.786   1.029  -1.952
    9    HE2  LYS 102           HE2      LYS 102 -40.183   2.445  -0.522
   10    HE3  LYS 102           HE3      LYS 102 -41.563   1.382  -0.801
   11    HZ1  LYS 102           HZ1      LYS 102 -39.785  -0.330   0.178
   12    HZ3  LYS 102           HZ2      LYS 102 -40.921   0.508   1.120
   13    HZ2  LYS 102           HZ3      LYS 102 -39.328   1.085   0.997

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ALA 103           H        ALA 103 -38.464   3.774  -6.713
    2    HA   ALA 103           HA       ALA 103 -38.756   6.057  -4.901
    3    HB2  ALA 103           HB1      ALA 103 -36.792   6.874  -6.470
    4    HB3  ALA 103           HB2      ALA 103 -36.703   5.164  -6.891
    5    HB1  ALA 103           HB3      ALA 103 -36.489   5.673  -5.216

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA 104           H        ALA 104 -39.361   5.350  -8.255
    2    HA   ALA 104           HA       ALA 104 -40.035   8.123  -8.841
    3    HB2  ALA 104           HB1      ALA 104 -40.061   7.483 -11.051
    4    HB1  ALA 104           HB2      ALA 104 -40.738   5.893 -10.692
    5    HB3  ALA 104           HB3      ALA 104 -39.024   6.207 -10.412

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA 105           H        ALA 105 -41.572   5.945  -7.060
    2    HA   ALA 105           HA       ALA 105 -44.040   7.261  -7.012
    3    HB2  ALA 105           HB1      ALA 105 -44.761   6.404  -9.060
    4    HB3  ALA 105           HB2      ALA 105 -45.357   5.181  -7.939
    5    HB1  ALA 105           HB3      ALA 105 -43.879   4.891  -8.854

  No H/Q in entry =           5
  In of MODEL   10
    1    H1   ALA   1           H3       ALA   1 -12.087 -16.068  -2.287
    2    H2   ALA   1           H2       ALA   1 -11.134 -17.197  -3.132
    3    H3   ALA   1           H1       ALA   1 -12.295 -16.269  -3.960
    4    HA   ALA   1           HA       ALA   1 -13.668 -17.989  -3.712
    5    HB3  ALA   1           HB1      ALA   1 -12.245 -19.740  -3.256
    6    HB1  ALA   1           HB2      ALA   1 -12.995 -19.637  -1.663
    7    HB2  ALA   1           HB3      ALA   1 -11.431 -18.875  -1.953

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLU   2           H        GLU   2 -15.271 -18.865  -2.048
    2    HA   GLU   2           HA       GLU   2 -16.937 -17.167  -0.982
    3    HB2  GLU   2           HB2      GLU   2 -15.956 -19.578   0.559
    4    HB3  GLU   2           HB3      GLU   2 -17.490 -18.749   0.821
    5    HG2  GLU   2           HG2      GLU   2 -18.464 -19.850  -0.908
    6    HG3  GLU   2           HG3      GLU   2 -17.152 -19.432  -2.000

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLU   3           H        GLU   3 -14.992 -18.491   1.632
    2    HA   GLU   3           HA       GLU   3 -15.239 -16.140   3.189
    3    HB2  GLU   3           HB2      GLU   3 -13.617 -18.664   3.433
    4    HB3  GLU   3           HB3      GLU   3 -13.398 -17.341   4.578
    5    HG2  GLU   3           HG2      GLU   3 -15.584 -17.522   5.407
    6    HG3  GLU   3           HG3      GLU   3 -16.176 -18.331   3.962

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LEU   4           H        LEU   4 -12.271 -17.578   1.783
    2    HA   LEU   4           HA       LEU   4 -10.460 -15.649   2.371
    3    HB2  LEU   4           HB2      LEU   4 -10.687 -16.952  -0.352
    4    HB3  LEU   4           HB3      LEU   4  -9.241 -16.211   0.325
    5    HG   LEU   4           HG       LEU   4 -10.696 -18.628   1.447
    6   HD13  LEU   4          HD11      LEU   4  -9.050 -19.961   0.510
    7   HD12  LEU   4          HD12      LEU   4  -7.858 -18.662   0.476
    8   HD11  LEU   4          HD13      LEU   4  -9.153 -18.702  -0.720
    9   HD23  LEU   4          HD21      LEU   4  -8.437 -18.659   2.817
   10   HD22  LEU   4          HD22      LEU   4  -9.770 -17.637   3.352
   11   HD21  LEU   4          HD23      LEU   4  -8.422 -16.930   2.463

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLU   5           H        GLU   5 -12.811 -15.477  -0.291
    2    HA   GLU   5           HA       GLU   5 -11.848 -12.980  -1.299
    3    HB2  GLU   5           HB2      GLU   5 -13.174 -14.577  -2.660
    4    HB3  GLU   5           HB3      GLU   5 -14.573 -14.254  -1.636
    5    HG2  GLU   5           HG2      GLU   5 -14.511 -11.882  -2.265
    6    HG3  GLU   5           HG3      GLU   5 -13.081 -12.170  -3.256

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLU   6           H        GLU   6 -14.550 -13.895   0.808
    2    HA   GLU   6           HA       GLU   6 -15.489 -11.230   1.210
    3    HB2  GLU   6           HB2      GLU   6 -16.848 -13.299   1.617
    4    HB3  GLU   6           HB3      GLU   6 -15.839 -13.629   3.026
    5    HG2  GLU   6           HG2      GLU   6 -17.720 -12.474   3.895
    6    HG3  GLU   6           HG3      GLU   6 -16.451 -11.256   3.806

  No H/Q in entry =           6
  In of MODEL   10
    1    H    VAL   7           H        VAL   7 -13.145 -13.308   2.771
    2    HA   VAL   7           HA       VAL   7 -12.689 -11.725   5.095
    3    HB   VAL   7           HB       VAL   7 -10.964 -13.746   3.638
    4   HG11  VAL   7          HG11      VAL   7 -10.505 -12.205   6.199
    5   HG13  VAL   7          HG12      VAL   7  -9.408 -12.405   4.833
    6   HG12  VAL   7          HG13      VAL   7  -9.738 -13.766   5.906
    7   HG21  VAL   7          HG21      VAL   7 -13.201 -14.340   4.870
    8   HG23  VAL   7          HG22      VAL   7 -12.270 -14.052   6.341
    9   HG22  VAL   7          HG23      VAL   7 -11.766 -15.306   5.209

  No H/Q in entry =           9
  In of MODEL   10
    1    H    VAL   8           H        VAL   8 -11.192 -11.821   1.878
    2    HA   VAL   8           HA       VAL   8  -9.153  -9.920   2.359
    3    HB   VAL   8           HB       VAL   8 -10.619 -10.627  -0.194
    4   HG12  VAL   8          HG11      VAL   8  -8.425  -9.609  -1.177
    5   HG11  VAL   8          HG12      VAL   8  -8.302  -8.784   0.378
    6   HG13  VAL   8          HG13      VAL   8  -9.705  -8.512  -0.655
    7   HG22  VAL   8          HG21      VAL   8  -9.082 -12.326  -0.454
    8   HG21  VAL   8          HG22      VAL   8  -8.914 -12.187   1.293
    9   HG23  VAL   8          HG23      VAL   8  -7.766 -11.373   0.234

  No H/Q in entry =           9
  In of MODEL   10
    1    H    MET   9           H        MET   9 -12.509  -9.577   1.215
    2    HA   MET   9           HA       MET   9 -12.486  -6.800   0.778
    3    HB2  MET   9           HB2      MET   9 -14.636  -8.760   1.533
    4    HB3  MET   9           HB3      MET   9 -14.989  -7.030   1.497
    5    HG2  MET   9           HG2      MET   9 -13.937  -7.044  -0.854
    6    HG3  MET   9           HG3      MET   9 -14.081  -8.801  -0.774
    7    HE2  MET   9           HE1      MET   9 -16.783  -9.451   0.736
    8    HE1  MET   9           HE2      MET   9 -15.994 -10.124  -0.687
    9    HE3  MET   9           HE3      MET   9 -17.688  -9.649  -0.772

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLY  10           H        GLY  10 -13.108  -8.698   3.710
    2    HA3  GLY  10           HA2      GLY  10 -13.678  -6.520   5.430
    3    HA2  GLY  10           HA3      GLY  10 -13.089  -8.100   5.943

  No H/Q in entry =           3
  In of MODEL   10
    1    H    LEU  11           H        LEU  11 -10.649  -8.191   4.616
    2    HA   LEU  11           HA       LEU  11  -8.960  -6.732   6.363
    3    HB2  LEU  11           HB2      LEU  11  -8.406  -8.150   3.754
    4    HB3  LEU  11           HB3      LEU  11  -7.141  -7.427   4.746
    5    HG   LEU  11           HG       LEU  11  -9.109  -9.487   5.774
    6   HD13  LEU  11          HD11      LEU  11  -7.878 -10.707   4.204
    7   HD12  LEU  11          HD12      LEU  11  -6.932 -10.932   5.675
    8   HD11  LEU  11          HD13      LEU  11  -6.414  -9.760   4.464
    9   HD22  LEU  11          HD21      LEU  11  -8.261  -8.460   7.685
   10   HD21  LEU  11          HD22      LEU  11  -6.733  -8.037   6.915
   11   HD23  LEU  11          HD23      LEU  11  -7.033  -9.698   7.427

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  12           H        ILE  12  -9.886  -6.201   2.977
    2    HA   ILE  12           HA       ILE  12  -8.229  -3.947   2.541
    3    HB   ILE  12           HB       ILE  12 -10.876  -4.670   1.259
    4   HG12  ILE  12          HG12      ILE  12  -8.816  -6.277   1.160
    5   HG13  ILE  12          HG13      ILE  12  -9.668  -5.911  -0.326
    6   HG23  ILE  12          HG21      ILE  12 -10.371  -2.331   0.824
    7   HG22  ILE  12          HG22      ILE  12  -9.996  -3.241  -0.634
    8   HG21  ILE  12          HG23      ILE  12  -8.725  -2.732   0.440
    9   HD13  ILE  12          HD11      ILE  12  -7.964  -4.293  -0.934
   10   HD12  ILE  12          HD12      ILE  12  -7.176  -5.815  -0.525
   11   HD11  ILE  12          HD13      ILE  12  -7.171  -4.492   0.618

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  13           H        ILE  13 -11.581  -4.262   3.651
    2    HA   ILE  13           HA       ILE  13 -12.080  -1.482   3.920
    3    HB   ILE  13           HB       ILE  13 -13.242  -3.919   5.291
    4   HG12  ILE  13          HG12      ILE  13 -13.480  -3.349   2.746
    5   HG13  ILE  13          HG13      ILE  13 -14.877  -3.887   3.655
    6   HG23  ILE  13          HG21      ILE  13 -13.841  -2.316   6.853
    7   HG22  ILE  13          HG22      ILE  13 -15.183  -2.154   5.729
    8   HG21  ILE  13          HG23      ILE  13 -13.849  -1.004   5.678
    9   HD12  ILE  13          HD11      ILE  13 -15.291  -1.855   2.192
   10   HD11  ILE  13          HD12      ILE  13 -14.198  -0.988   3.254
   11   HD13  ILE  13          HD13      ILE  13 -15.687  -1.640   3.901

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ASN  14           H        ASN  14 -10.921  -3.954   6.192
    2    HA   ASN  14           HA       ASN  14 -10.734  -2.311   8.475
    3    HB2  ASN  14           HB2      ASN  14 -10.443  -4.914   8.154
    4    HB3  ASN  14           HB3      ASN  14  -8.741  -4.501   7.988
    5   HD21  ASN  14          HD21      ASN  14  -9.344  -6.033  10.169
    6   HD22  ASN  14          HD22      ASN  14  -9.323  -5.111  11.592

  No H/Q in entry =           6
  In of MODEL   10
    1    H    SER  15           H        SER  15  -8.332  -3.099   5.973
    2    HA   SER  15           HA       SER  15  -6.207  -1.573   7.033
    3    HB2  SER  15           HB2      SER  15  -5.193  -1.772   4.870
    4    HB3  SER  15           HB3      SER  15  -6.124  -3.249   5.102
    5    HG   SER  15           HG       SER  15  -6.921  -2.650   3.234

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLY  16           H        GLY  16  -8.832  -0.749   4.798
    2    HA3  GLY  16           HA2      GLY  16  -8.019   1.905   4.240
    3    HA2  GLY  16           HA3      GLY  16  -9.660   1.283   4.086

  No H/Q in entry =           3
  In of MODEL   10
    1    H    GLN  17           H        GLN  17 -10.179   0.552   6.739
    2    HA   GLN  17           HA       GLN  17 -10.922   3.046   7.881
    3    HB2  GLN  17           HB2      GLN  17 -12.119   0.944   8.375
    4    HB3  GLN  17           HB3      GLN  17 -10.697   0.342   9.229
    5    HG2  GLN  17           HG2      GLN  17 -10.844   2.249  10.800
    6    HG3  GLN  17           HG3      GLN  17 -12.281   2.824   9.956
    7   HE21  GLN  17          HE21      GLN  17 -14.187   2.177  10.951
    8   HE22  GLN  17          HE22      GLN  17 -14.381   0.752  11.854

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ALA  18           H        ALA  18  -8.253   0.809   8.490
    2    HA   ALA  18           HA       ALA  18  -7.165   2.045  10.754
    3    HB2  ALA  18           HB1      ALA  18  -6.525  -0.162   9.386
    4    HB3  ALA  18           HB2      ALA  18  -5.370   0.641  10.451
    5    HB1  ALA  18           HB3      ALA  18  -5.306   0.919   8.709

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ARG  19           H        ARG  19  -6.418   2.578   7.302
    2    HA   ARG  19           HA       ARG  19  -4.553   4.657   7.720
    3    HB2  ARG  19           HB2      ARG  19  -4.871   3.509   5.527
    4    HB3  ARG  19           HB3      ARG  19  -6.428   4.323   5.356
    5    HG2  ARG  19           HG2      ARG  19  -5.336   6.514   5.417
    6    HG3  ARG  19           HG3      ARG  19  -3.773   5.755   5.715
    7    HD2  ARG  19           HD2      ARG  19  -3.919   6.341   3.372
    8    HD3  ARG  19           HD3      ARG  19  -3.973   4.580   3.520
    9    HE   ARG  19           HE       ARG  19  -6.622   5.444   3.523
   10   HH21  ARG  19          HH11      ARG  19  -7.828   5.577   1.610
   11   HH22  ARG  19          HH12      ARG  19  -7.015   5.667   0.087
   12   HH11  ARG  19          HH21      ARG  19  -3.857   5.552   1.477
   13   HH12  ARG  19          HH22      ARG  19  -4.765   5.651   0.011

  No H/Q in entry =          13
  In of MODEL   10
    1    H    SER  20           H        SER  20  -8.055   4.712   7.135
    2    HA   SER  20           HA       SER  20  -8.460   7.461   7.086
    3    HB2  SER  20           HB2      SER  20 -10.319   6.095   6.559
    4    HB3  SER  20           HB3      SER  20 -10.184   5.194   8.067
    5    HG   SER  20           HG       SER  20 -10.514   7.450   9.000

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU  21           H        LEU  21  -8.410   5.282   9.892
    2    HA   LEU  21           HA       LEU  21  -8.876   7.272  11.857
    3    HB2  LEU  21           HB2      LEU  21  -7.472   4.597  12.017
    4    HB3  LEU  21           HB3      LEU  21  -7.802   5.609  13.420
    5    HG   LEU  21           HG       LEU  21  -9.946   4.650  11.500
    6   HD12  LEU  21          HD11      LEU  21  -9.322   3.548  14.249
    7   HD11  LEU  21          HD12      LEU  21  -8.738   2.807  12.760
    8   HD13  LEU  21          HD13      LEU  21 -10.471   2.913  13.071
    9   HD22  LEU  21          HD21      LEU  21 -10.884   6.476  12.628
   10   HD21  LEU  21          HD22      LEU  21  -9.943   6.202  14.092
   11   HD23  LEU  21          HD23      LEU  21 -11.311   5.162  13.723

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ALA  22           H        ALA  22  -5.906   5.949  10.438
    2    HA   ALA  22           HA       ALA  22  -4.043   7.298  12.050
    3    HB2  ALA  22           HB1      ALA  22  -3.602   5.450  10.359
    4    HB1  ALA  22           HB2      ALA  22  -2.429   6.767  10.388
    5    HB3  ALA  22           HB3      ALA  22  -3.651   6.700   9.117

  No H/Q in entry =           5
  In of MODEL   10
    1    H    TYR  23           H        TYR  23  -5.392   8.287   8.872
    2    HA   TYR  23           HA       TYR  23  -4.102  10.807   8.793
    3    HB2  TYR  23           HB2      TYR  23  -5.174   9.874   6.807
    4    HB3  TYR  23           HB3      TYR  23  -6.751   9.953   7.595
    5    HD1  TYR  23           HD1      TYR  23  -3.882  12.063   6.467
    6    HD2  TYR  23           HD2      TYR  23  -8.037  11.926   7.543
    7    HE1  TYR  23           HE1      TYR  23  -4.156  14.407   5.707
    8    HE2  TYR  23           HE2      TYR  23  -8.312  14.270   6.781
    9    HH   TYR  23           HH       TYR  23  -5.917  15.897   4.951

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ALA  24           H        ALA  24  -7.197   9.775  10.187
    2    HA   ALA  24           HA       ALA  24  -8.077  12.350  10.959
    3    HB1  ALA  24           HB1      ALA  24  -9.870  11.067  11.436
    4    HB2  ALA  24           HB2      ALA  24  -9.028  10.513  12.881
    5    HB3  ALA  24           HB3      ALA  24  -8.893   9.601  11.378

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA  25           H        ALA  25  -6.024   9.931  12.527
    2    HA   ALA  25           HA       ALA  25  -5.698  11.192  15.027
    3    HB2  ALA  25           HB1      ALA  25  -4.893   8.853  14.205
    4    HB3  ALA  25           HB2      ALA  25  -3.888   9.731  15.361
    5    HB1  ALA  25           HB3      ALA  25  -3.459   9.720  13.649

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU  26           H        LEU  26  -3.926  11.519  11.978
    2    HA   LEU  26           HA       LEU  26  -1.997  13.375  12.884
    3    HB2  LEU  26           HB2      LEU  26  -1.683  12.227  10.780
    4    HB3  LEU  26           HB3      LEU  26  -3.172  12.907  10.131
    5    HG   LEU  26           HG       LEU  26  -2.197  15.176  10.260
    6   HD12  LEU  26          HD11      LEU  26   0.342  15.241  10.663
    7   HD11  LEU  26          HD12      LEU  26   0.150  13.658  11.410
    8   HD13  LEU  26          HD13      LEU  26  -0.680  15.059  12.088
    9   HD21  LEU  26          HD21      LEU  26  -0.424  13.151   8.860
   10   HD23  LEU  26          HD22      LEU  26  -0.499  14.871   8.488
   11   HD22  LEU  26          HD23      LEU  26  -1.905  13.848   8.206

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LYS  27           H        LYS  27  -5.193  13.800  11.420
    2    HA   LYS  27           HA       LYS  27  -5.188  16.589  11.218
    3    HB2  LYS  27           HB2      LYS  27  -6.910  15.079  10.242
    4    HB3  LYS  27           HB3      LYS  27  -7.555  14.813  11.861
    5    HG2  LYS  27           HG2      LYS  27  -8.026  17.212  12.096
    6    HG3  LYS  27           HG3      LYS  27  -7.330  17.519  10.502
    7    HD2  LYS  27           HD2      LYS  27  -9.041  16.054   9.474
    8    HD3  LYS  27           HD3      LYS  27  -9.743  15.763  11.068
    9    HE2  LYS  27           HE2      LYS  27 -10.227  18.166  11.310
   10    HE3  LYS  27           HE3      LYS  27  -9.497  18.479   9.732
   11    HZ3  LYS  27           HZ1      LYS  27 -11.873  18.312   9.500
   12    HZ2  LYS  27           HZ2      LYS  27 -11.891  16.796  10.272
   13    HZ1  LYS  27           HZ3      LYS  27 -11.156  16.971   8.747

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLN  28           H        GLN  28  -6.029  14.491  13.951
    2    HA   GLN  28           HA       GLN  28  -6.951  16.481  15.729
    3    HB2  GLN  28           HB2      GLN  28  -5.504  13.874  16.266
    4    HB3  GLN  28           HB3      GLN  28  -6.251  14.867  17.518
    5    HG2  GLN  28           HG2      GLN  28  -7.711  13.722  15.121
    6    HG3  GLN  28           HG3      GLN  28  -7.748  13.034  16.744
    7   HE21  GLN  28          HE21      GLN  28  -9.691  14.760  14.806
    8   HE22  GLN  28          HE22      GLN  28 -10.434  15.789  15.933

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ALA  29           H        ALA  29  -3.713  15.238  15.027
    2    HA   ALA  29           HA       ALA  29  -2.290  16.662  16.998
    3    HB1  ALA  29           HB1      ALA  29  -0.353  16.001  15.871
    4    HB3  ALA  29           HB2      ALA  29  -1.117  16.111  14.285
    5    HB2  ALA  29           HB3      ALA  29  -1.512  14.773  15.363

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LYS  30           H        LYS  30  -3.177  17.523  13.671
    2    HA   LYS  30           HA       LYS  30  -1.805  19.985  13.562
    3    HB2  LYS  30           HB2      LYS  30  -4.328  19.071  12.165
    4    HB3  LYS  30           HB3      LYS  30  -3.519  20.598  11.816
    5    HG2  LYS  30           HG2      LYS  30  -1.432  19.335  11.295
    6    HG3  LYS  30           HG3      LYS  30  -2.315  17.826  11.545
    7    HD2  LYS  30           HD2      LYS  30  -3.897  18.441   9.757
    8    HD3  LYS  30           HD3      LYS  30  -3.037  19.962   9.509
    9    HE2  LYS  30           HE2      LYS  30  -0.988  18.698   8.921
   10    HE3  LYS  30           HE3      LYS  30  -1.867  17.183   9.139
   11    HZ2  LYS  30           HZ1      LYS  30  -1.714  18.054   6.795
   12    HZ1  LYS  30           HZ2      LYS  30  -2.774  19.302   7.267
   13    HZ3  LYS  30           HZ3      LYS  30  -3.275  17.677   7.342

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLN  31           H        GLN  31  -4.886  19.090  14.989
    2    HA   GLN  31           HA       GLN  31  -5.686  21.836  15.442
    3    HB2  GLN  31           HB2      GLN  31  -6.825  19.375  16.772
    4    HB3  GLN  31           HB3      GLN  31  -7.608  20.936  16.529
    5    HG2  GLN  31           HG2      GLN  31  -6.899  20.166  13.937
    6    HG3  GLN  31           HG3      GLN  31  -7.399  18.655  14.687
    7   HE21  GLN  31          HE21      GLN  31  -8.840  20.208  12.591
    8   HE22  GLN  31          HE22      GLN  31 -10.356  20.579  13.255

  No H/Q in entry =           8
  In of MODEL   10
    1    H    GLY  32           H        GLY  32  -3.342  19.941  16.753
    2    HA3  GLY  32           HA2      GLY  32  -1.939  20.424  18.548
    3    HA2  GLY  32           HA3      GLY  32  -3.082  21.652  19.076

  No H/Q in entry =           3
  In of MODEL   10
    1    H    ASP  33           H        ASP  33  -4.467  18.593  18.423
    2    HA   ASP  33           HA       ASP  33  -4.858  18.132  21.306
    3    HB2  ASP  33           HB2      ASP  33  -6.262  17.100  18.835
    4    HB3  ASP  33           HB3      ASP  33  -6.592  16.487  20.454

  No H/Q in entry =           4
  In of MODEL   10
    1    H    PHE  34           H        PHE  34  -2.677  17.310  21.601
    2    HA   PHE  34           HA       PHE  34  -1.654  15.074  20.197
    3    HB2  PHE  34           HB2      PHE  34  -1.037  16.068  22.988
    4    HB3  PHE  34           HB3      PHE  34  -0.096  14.857  22.117
    5    HD1  PHE  34           HD1      PHE  34  -0.310  18.280  22.851
    6    HD2  PHE  34           HD2      PHE  34   0.541  15.586  19.614
    7    HE1  PHE  34           HE1      PHE  34   0.957  20.068  21.689
    8    HE2  PHE  34           HE2      PHE  34   1.802  17.377  18.457
    9    HZ   PHE  34           HZ       PHE  34   2.012  19.614  19.500

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ALA  35           H        ALA  35  -3.683  15.326  23.070
    2    HA   ALA  35           HA       ALA  35  -3.432  12.667  23.967
    3    HB3  ALA  35           HB1      ALA  35  -5.894  13.262  24.835
    4    HB1  ALA  35           HB2      ALA  35  -5.384  14.886  24.376
    5    HB2  ALA  35           HB3      ALA  35  -4.452  13.975  25.563

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA  36           H        ALA  36  -5.912  14.151  21.878
    2    HA   ALA  36           HA       ALA  36  -7.298  11.720  21.408
    3    HB1  ALA  36           HB1      ALA  36  -8.776  13.123  20.458
    4    HB3  ALA  36           HB2      ALA  36  -7.616  13.558  19.203
    5    HB2  ALA  36           HB3      ALA  36  -7.645  14.446  20.727

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA  37           H        ALA  37  -4.646  13.342  19.726
    2    HA   ALA  37           HA       ALA  37  -4.601  11.706  17.429
    3    HB3  ALA  37           HB1      ALA  37  -2.624  13.444  18.841
    4    HB2  ALA  37           HB2      ALA  37  -3.164  13.492  17.164
    5    HB1  ALA  37           HB3      ALA  37  -1.991  12.277  17.680

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LYS  38           H        LYS  38  -2.825  11.424  20.499
    2    HA   LYS  38           HA       LYS  38  -1.471   9.042  20.005
    3    HB2  LYS  38           HB2      LYS  38  -1.807  10.801  22.151
    4    HB3  LYS  38           HB3      LYS  38  -2.403   9.264  22.771
    5    HG2  LYS  38           HG2      LYS  38  -0.296   8.171  22.225
    6    HG3  LYS  38           HG3      LYS  38   0.289   9.623  21.408
    7    HD2  LYS  38           HD2      LYS  38   0.452  10.845  23.441
    8    HD3  LYS  38           HD3      LYS  38  -0.548   9.682  24.314
    9    HE2  LYS  38           HE2      LYS  38   1.815   9.397  24.922
   10    HE3  LYS  38           HE3      LYS  38   1.225   7.973  24.061
   11    HZ3  LYS  38           HZ1      LYS  38   2.511   8.408  22.274
   12    HZ2  LYS  38           HZ2      LYS  38   3.461   9.249  23.405
   13    HZ1  LYS  38           HZ3      LYS  38   2.365  10.094  22.419

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ALA  39           H        ALA  39  -4.709   9.495  21.423
    2    HA   ALA  39           HA       ALA  39  -5.231   6.769  21.931
    3    HB3  ALA  39           HB1      ALA  39  -7.419   8.684  21.173
    4    HB2  ALA  39           HB2      ALA  39  -6.517   8.924  22.670
    5    HB1  ALA  39           HB3      ALA  39  -7.415   7.427  22.412

  No H/Q in entry =           5
  In of MODEL   10
    1    H    MET  40           H        MET  40  -5.856   8.772  19.086
    2    HA   MET  40           HA       MET  40  -7.314   6.820  17.634
    3    HB2  MET  40           HB2      MET  40  -5.740   9.236  16.721
    4    HB3  MET  40           HB3      MET  40  -6.758   8.263  15.656
    5    HG2  MET  40           HG2      MET  40  -7.797   9.499  18.218
    6    HG3  MET  40           HG3      MET  40  -7.873  10.333  16.668
    7    HE3  MET  40           HE1      MET  40 -10.445   8.678  14.617
    8    HE2  MET  40           HE2      MET  40  -8.694   8.818  14.460
    9    HE1  MET  40           HE3      MET  40  -9.627  10.172  15.097

  No H/Q in entry =           9
  In of MODEL   10
    1    H    MET  41           H        MET  41  -3.832   7.604  17.739
    2    HA   MET  41           HA       MET  41  -3.060   5.859  15.636
    3    HB2  MET  41           HB2      MET  41  -1.441   6.549  18.101
    4    HB3  MET  41           HB3      MET  41  -0.822   5.908  16.583
    5    HG2  MET  41           HG2      MET  41  -2.013   8.075  15.584
    6    HG3  MET  41           HG3      MET  41  -1.777   8.667  17.227
    7    HE2  MET  41           HE1      MET  41   1.171   6.609  17.575
    8    HE1  MET  41           HE2      MET  41   0.369   7.892  18.477
    9    HE3  MET  41           HE3      MET  41   1.986   8.157  17.826

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ASP  42           H        ASP  42  -3.422   5.382  19.124
    2    HA   ASP  42           HA       ASP  42  -2.350   2.803  19.281
    3    HB2  ASP  42           HB2      ASP  42  -3.239   4.551  21.106
    4    HB3  ASP  42           HB3      ASP  42  -4.652   3.506  21.041

  No H/Q in entry =           4
  In of MODEL   10
    1    H    GLN  43           H        GLN  43  -5.701   3.860  18.795
    2    HA   GLN  43           HA       GLN  43  -6.809   1.257  18.607
    3    HB2  GLN  43           HB2      GLN  43  -7.774   3.896  17.481
    4    HB3  GLN  43           HB3      GLN  43  -8.716   2.404  17.464
    5    HG2  GLN  43           HG2      GLN  43  -8.410   2.288  19.970
    6    HG3  GLN  43           HG3      GLN  43  -7.708   3.902  19.895
    7   HE21  GLN  43          HE21      GLN  43  -9.881   3.953  21.406
    8   HE22  GLN  43          HE22      GLN  43 -11.254   4.509  20.580

  No H/Q in entry =           8
  In of MODEL   10
    1    H    SER  44           H        SER  44  -5.511   3.489  16.188
    2    HA   SER  44           HA       SER  44  -6.202   1.994  13.903
    3    HB2  SER  44           HB2      SER  44  -4.977   4.395  14.340
    4    HB3  SER  44           HB3      SER  44  -3.611   3.418  13.804
    5    HG   SER  44           HG       SER  44  -4.745   4.373  12.046

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ARG  45           H        ARG  45  -3.313   1.922  15.970
    2    HA   ARG  45           HA       ARG  45  -1.813  -0.012  14.582
    3    HB2  ARG  45           HB2      ARG  45  -0.982   1.422  16.446
    4    HB3  ARG  45           HB3      ARG  45  -1.955   0.478  17.571
    5    HG2  ARG  45           HG2      ARG  45  -0.698  -1.564  16.924
    6    HG3  ARG  45           HG3      ARG  45   0.299  -0.595  15.840
    7    HD2  ARG  45           HD2      ARG  45   1.023   0.796  17.792
    8    HD3  ARG  45           HD3      ARG  45   0.121  -0.291  18.870
    9    HE   ARG  45           HE       ARG  45   1.835  -1.863  17.282
   10   HH21  ARG  45          HH11      ARG  45   3.750  -2.659  18.111
   11   HH22  ARG  45          HH12      ARG  45   4.518  -1.862  19.439
   12   HH11  ARG  45          HH21      ARG  45   2.115   0.608  19.670
   13   HH12  ARG  45          HH22      ARG  45   3.592  -0.010  20.319

  No H/Q in entry =          13
  In of MODEL   10
    1    H    MET  46           H        MET  46  -4.194  -0.365  17.193
    2    HA   MET  46           HA       MET  46  -3.986  -3.161  17.499
    3    HB2  MET  46           HB2      MET  46  -6.190  -1.192  18.103
    4    HB3  MET  46           HB3      MET  46  -6.354  -2.914  18.458
    5    HG2  MET  46           HG2      MET  46  -4.314  -2.834  19.835
    6    HG3  MET  46           HG3      MET  46  -4.122  -1.126  19.471
    7    HE2  MET  46           HE1      MET  46  -4.198  -0.111  21.850
    8    HE1  MET  46           HE2      MET  46  -3.952  -1.800  22.283
    9    HE3  MET  46           HE3      MET  46  -5.146  -0.841  23.152

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ALA  47           H        ALA  47  -6.043  -1.173  15.413
    2    HA   ALA  47           HA       ALA  47  -7.637  -3.245  14.355
    3    HB3  ALA  47           HB1      ALA  47  -8.349  -1.017  13.942
    4    HB1  ALA  47           HB2      ALA  47  -7.858  -1.645  12.368
    5    HB2  ALA  47           HB3      ALA  47  -6.789  -0.561  13.260

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU  48           H        LEU  48  -4.541  -1.896  13.290
    2    HA   LEU  48           HA       LEU  48  -4.249  -3.483  10.948
    3    HB2  LEU  48           HB2      LEU  48  -2.201  -2.177  12.747
    4    HB3  LEU  48           HB3      LEU  48  -1.830  -2.894  11.179
    5    HG   LEU  48           HG       LEU  48  -3.879  -0.702  11.577
    6   HD13  LEU  48          HD11      LEU  48  -1.766   0.201  12.233
    7   HD12  LEU  48          HD12      LEU  48  -2.055   0.751  10.582
    8   HD11  LEU  48          HD13      LEU  48  -0.939  -0.581  10.886
    9   HD22  LEU  48          HD21      LEU  48  -4.347  -1.693   9.503
   10   HD21  LEU  48          HD22      LEU  48  -2.660  -2.107   9.201
   11   HD23  LEU  48          HD23      LEU  48  -3.201  -0.434   9.043

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ASN  49           H        ASN  49  -3.184  -3.866  14.290
    2    HA   ASN  49           HA       ASN  49  -1.555  -6.109  13.953
    3    HB2  ASN  49           HB2      ASN  49  -1.575  -4.787  16.001
    4    HB3  ASN  49           HB3      ASN  49  -3.236  -5.260  16.328
    5   HD21  ASN  49          HD21      ASN  49   0.085  -6.518  16.122
    6   HD22  ASN  49          HD22      ASN  49  -0.200  -7.887  17.084

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLU  50           H        GLU  50  -5.024  -5.876  14.639
    2    HA   GLU  50           HA       GLU  50  -5.502  -8.681  14.750
    3    HB2  GLU  50           HB2      GLU  50  -7.104  -7.013  15.632
    4    HB3  GLU  50           HB3      GLU  50  -7.412  -6.452  13.987
    5    HG2  GLU  50           HG2      GLU  50  -8.253  -8.659  13.353
    6    HG3  GLU  50           HG3      GLU  50  -7.858  -9.298  14.945

  No H/Q in entry =           6
  In of MODEL   10
    1    H    ALA  51           H        ALA  51  -5.609  -6.284  12.154
    2    HA   ALA  51           HA       ALA  51  -6.583  -8.023  10.136
    3    HB2  ALA  51           HB1      ALA  51  -6.390  -6.209   8.766
    4    HB1  ALA  51           HB2      ALA  51  -4.752  -5.841   9.308
    5    HB3  ALA  51           HB3      ALA  51  -6.138  -5.345  10.282

  No H/Q in entry =           5
  In of MODEL   10
    1    H    HIS  52           H        HIS  52  -3.299  -7.079  11.106
    2    HA   HIS  52           HA       HIS  52  -1.891  -8.553   9.151
    3    HB2  HIS  52           HB2      HIS  52  -0.832  -6.824  10.538
    4    HB3  HIS  52           HB3      HIS  52  -1.055  -7.829  11.971
    5    HD1  HIS  52           HD1      HIS  52   0.199 -10.236  11.879
    6    HD2  HIS  52           HD2      HIS  52   1.486  -7.391   9.116
    7    HE1  HIS  52           HE1      HIS  52   2.453 -11.025  11.035
    8    HE2  HIS  52           HE2      HIS  52   3.251  -9.302   9.350

  No H/Q in entry =           8
  In of MODEL   10
    1    H    LEU  53           H        LEU  53  -3.080  -9.443  12.368
    2    HA   LEU  53           HA       LEU  53  -1.854 -11.974  12.557
    3    HB2  LEU  53           HB2      LEU  53  -4.342 -10.813  13.784
    4    HB3  LEU  53           HB3      LEU  53  -3.876 -12.489  14.068
    5    HG   LEU  53           HG       LEU  53  -1.990 -10.158  14.550
    6   HD11  LEU  53          HD11      LEU  53  -4.085 -10.050  15.957
    7   HD13  LEU  53          HD12      LEU  53  -2.596 -10.241  16.880
    8   HD12  LEU  53          HD13      LEU  53  -3.650 -11.625  16.614
    9   HD22  LEU  53          HD21      LEU  53  -0.684 -12.119  14.496
   10   HD21  LEU  53          HD22      LEU  53  -1.974 -13.108  15.173
   11   HD23  LEU  53          HD23      LEU  53  -1.082 -12.008  16.206

  No H/Q in entry =          11
  In of MODEL   10
    1    H    VAL  54           H        VAL  54  -4.982 -10.978  11.208
    2    HA   VAL  54           HA       VAL  54  -5.871 -13.581  10.524
    3    HB   VAL  54           HB       VAL  54  -6.551 -10.855   9.392
    4   HG12  VAL  54          HG11      VAL  54  -8.642 -12.255   8.589
    5   HG11  VAL  54          HG12      VAL  54  -7.516 -13.609   8.657
    6   HG13  VAL  54          HG13      VAL  54  -7.175 -12.231   7.613
    7   HG22  VAL  54          HG21      VAL  54  -7.449 -10.903  11.548
    8   HG21  VAL  54          HG22      VAL  54  -7.685 -12.649  11.529
    9   HG23  VAL  54          HG23      VAL  54  -8.781 -11.603  10.627

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLN  55           H        GLN  55  -4.032 -11.111   8.728
    2    HA   GLN  55           HA       GLN  55  -3.897 -12.574   6.309
    3    HB2  GLN  55           HB2      GLN  55  -3.317 -10.304   6.117
    4    HB3  GLN  55           HB3      GLN  55  -2.200 -10.369   7.478
    5    HG2  GLN  55           HG2      GLN  55  -0.479 -11.197   6.194
    6    HG3  GLN  55           HG3      GLN  55  -1.547 -12.183   5.205
    7   HE21  GLN  55          HE21      GLN  55  -1.579 -11.493   3.084
    8   HE22  GLN  55          HE22      GLN  55  -1.400  -9.887   2.573

  No H/Q in entry =           8
  In of MODEL   10
    1    H    THR  56           H        THR  56  -1.780 -12.532   9.182
    2    HA   THR  56           HA       THR  56   0.311 -14.110   8.256
    3    HB   THR  56           HB       THR  56  -0.920 -14.368  11.009
    4    HG1  THR  56           HG1      THR  56   0.561 -12.341   9.780
    5   HG21  THR  56          HG21      THR  56   1.801 -14.878   9.812
    6   HG23  THR  56          HG22      THR  56   0.795 -15.975  10.761
    7   HG22  THR  56          HG23      THR  56   1.594 -14.609  11.542

  No H/Q in entry =           7
  In of MODEL   10
    1    H    LYS  57           H        LYS  57  -2.794 -15.177   9.632
    2    HA   LYS  57           HA       LYS  57  -2.322 -17.968   9.384
    3    HB2  LYS  57           HB2      LYS  57  -4.145 -16.901  10.739
    4    HB3  LYS  57           HB3      LYS  57  -4.945 -16.449   9.241
    5    HG2  LYS  57           HG2      LYS  57  -5.147 -18.823   8.618
    6    HG3  LYS  57           HG3      LYS  57  -4.337 -19.289  10.113
    7    HD2  LYS  57           HD2      LYS  57  -6.163 -18.249  11.422
    8    HD3  LYS  57           HD3      LYS  57  -6.982 -17.806   9.926
    9    HE2  LYS  57           HE2      LYS  57  -7.168 -20.189   9.308
   10    HE3  LYS  57           HE3      LYS  57  -6.328 -20.656  10.785
   11    HZ1  LYS  57           HZ1      LYS  57  -8.638 -18.922  11.110
   12    HZ3  LYS  57           HZ2      LYS  57  -8.121 -20.241  12.048
   13    HZ2  LYS  57           HZ3      LYS  57  -8.961 -20.506  10.595

  No H/Q in entry =          13
  In of MODEL   10
    1    H    LEU  58           H        LEU  58  -3.685 -15.539   7.213
    2    HA   LEU  58           HA       LEU  58  -4.478 -17.372   5.210
    3    HB2  LEU  58           HB2      LEU  58  -3.900 -14.417   5.073
    4    HB3  LEU  58           HB3      LEU  58  -4.560 -15.361   3.735
    5    HG   LEU  58           HG       LEU  58  -5.830 -15.193   6.488
    6   HD11  LEU  58          HD11      LEU  58  -6.156 -13.549   3.997
    7   HD13  LEU  58          HD12      LEU  58  -6.144 -13.041   5.686
    8   HD12  LEU  58          HD13      LEU  58  -7.562 -13.848   5.020
    9   HD22  LEU  58          HD21      LEU  58  -6.778 -17.111   5.622
   10   HD21  LEU  58          HD22      LEU  58  -6.450 -16.656   3.950
   11   HD23  LEU  58          HD23      LEU  58  -7.816 -15.943   4.806

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  59           H        ILE  59  -1.351 -16.131   6.059
    2    HA   ILE  59           HA       ILE  59  -0.256 -16.848   3.418
    3    HB   ILE  59           HB       ILE  59   0.499 -14.775   4.986
    4   HG12  ILE  59          HG12      ILE  59   2.598 -16.407   3.542
    5   HG13  ILE  59          HG13      ILE  59   1.390 -15.475   2.694
    6   HG23  ILE  59          HG21      ILE  59   2.353 -15.243   6.368
    7   HG22  ILE  59          HG22      ILE  59   2.610 -16.823   5.663
    8   HG21  ILE  59          HG23      ILE  59   1.251 -16.544   6.750
    9   HD11  ILE  59          HD11      ILE  59   2.123 -13.433   3.894
   10   HD13  ILE  59          HD12      ILE  59   3.427 -14.142   2.945
   11   HD12  ILE  59          HD13      ILE  59   3.374 -14.382   4.691

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLU  60           H        GLU  60  -0.244 -17.954   6.786
    2    HA   GLU  60           HA       GLU  60   1.804 -19.913   6.514
    3    HB2  GLU  60           HB2      GLU  60   1.086 -19.172   8.712
    4    HB3  GLU  60           HB3      GLU  60  -0.550 -19.754   8.413
    5    HG2  GLU  60           HG2      GLU  60   1.794 -21.642   8.243
    6    HG3  GLU  60           HG3      GLU  60   1.068 -21.255   9.801

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLY  61           H        GLY  61  -1.707 -20.044   6.041
    2    HA3  GLY  61           HA2      GLY  61  -1.436 -22.834   5.083
    3    HA2  GLY  61           HA3      GLY  61  -2.926 -22.112   5.681

  No H/Q in entry =           3
  In of MODEL   10
    1    H    ASP  62           H        ASP  62  -0.720 -20.512   3.470
    2    HA   ASP  62           HA       ASP  62  -2.751 -19.823   1.640
    3    HB2  ASP  62           HB2      ASP  62  -0.880 -19.047   0.230
    4    HB3  ASP  62           HB3      ASP  62  -0.698 -18.522   1.901

  No H/Q in entry =           4
  In of MODEL   10
    1    H    ALA  63           H        ALA  63  -0.484 -22.558   1.677
    2    HA   ALA  63           HA       ALA  63  -1.252 -23.419  -1.006
    3    HB1  ALA  63           HB1      ALA  63   0.555 -24.565   1.105
    4    HB3  ALA  63           HB2      ALA  63   0.990 -23.882  -0.461
    5    HB2  ALA  63           HB3      ALA  63   0.161 -25.436  -0.378

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLY  64           H        GLY  64  -1.681 -25.990  -0.976
    2    HA3  GLY  64           HA2      GLY  64  -2.906 -27.665   0.493
    3    HA2  GLY  64           HA3      GLY  64  -4.056 -26.362   0.741

  No H/Q in entry =           3
  In of MODEL   10
    1    H    GLU  65           H        GLU  65  -4.324 -25.347  -1.834
    2    HA   GLU  65           HA       GLU  65  -6.114 -27.227  -2.957
    3    HB2  GLU  65           HB2      GLU  65  -4.980 -24.672  -4.095
    4    HB3  GLU  65           HB3      GLU  65  -6.285 -25.599  -4.834
    5    HG2  GLU  65           HG2      GLU  65  -6.348 -24.496  -2.012
    6    HG3  GLU  65           HG3      GLU  65  -7.129 -23.739  -3.399

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLY  66           H        GLY  66  -2.852 -26.332  -3.735
    2    HA3  GLY  66           HA2      GLY  66  -2.313 -28.760  -5.128
    3    HA2  GLY  66           HA3      GLY  66  -2.420 -27.400  -6.228

  No H/Q in entry =           3
  In of MODEL   10
    1    H    LYS  67           H        LYS  67  -0.279 -27.633  -6.836
    2    HA   LYS  67           HA       LYS  67   1.964 -27.952  -5.326
    3    HB2  LYS  67           HB2      LYS  67   3.201 -26.943  -7.165
    4    HB3  LYS  67           HB3      LYS  67   1.888 -27.954  -7.783
    5    HG2  LYS  67           HG2      LYS  67   0.454 -25.948  -8.002
    6    HG3  LYS  67           HG3      LYS  67   1.778 -24.943  -7.419
    7    HD2  LYS  67           HD2      LYS  67   3.151 -25.618  -9.350
    8    HD3  LYS  67           HD3      LYS  67   1.834 -26.637  -9.932
    9    HE2  LYS  67           HE2      LYS  67   0.374 -24.666 -10.125
   10    HE3  LYS  67           HE3      LYS  67   1.669 -23.637  -9.514
   11    HZ3  LYS  67           HZ1      LYS  67   1.607 -23.538 -11.900
   12    HZ2  LYS  67           HZ2      LYS  67   1.715 -25.229 -12.019
   13    HZ1  LYS  67           HZ3      LYS  67   3.024 -24.332 -11.416

  No H/Q in entry =          13
  In of MODEL   10
    1    H    MET  68           H        MET  68   3.701 -25.911  -5.777
    2    HA   MET  68           HA       MET  68   3.700 -24.464  -3.438
    3    HB2  MET  68           HB2      MET  68   5.009 -23.892  -6.092
    4    HB3  MET  68           HB3      MET  68   5.360 -22.978  -4.624
    5    HG2  MET  68           HG2      MET  68   5.997 -25.074  -3.478
    6    HG3  MET  68           HG3      MET  68   5.670 -25.977  -4.958
    7    HE3  MET  68           HE1      MET  68   9.480 -26.128  -4.680
    8    HE2  MET  68           HE2      MET  68   8.178 -26.957  -5.532
    9    HE1  MET  68           HE3      MET  68   8.011 -26.602  -3.815

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LYS  69           H        LYS  69   1.531 -23.937  -5.929
    2    HA   LYS  69           HA       LYS  69   1.420 -21.137  -6.066
    3    HB2  LYS  69           HB2      LYS  69   0.324 -22.891  -7.593
    4    HB3  LYS  69           HB3      LYS  69  -1.030 -22.799  -6.459
    5    HG2  LYS  69           HG2      LYS  69  -1.188 -20.391  -6.770
    6    HG3  LYS  69           HG3      LYS  69   0.239 -20.398  -7.804
    7    HD2  LYS  69           HD2      LYS  69  -0.942 -21.822  -9.433
    8    HD3  LYS  69           HD3      LYS  69  -2.373 -21.817  -8.398
    9    HE2  LYS  69           HE2      LYS  69  -2.525 -19.366  -8.603
   10    HE3  LYS  69           HE3      LYS  69  -1.087 -19.358  -9.622
   11    HZ3  LYS  69           HZ1      LYS  69  -2.301 -19.885 -11.379
   12    HZ2  LYS  69           HZ2      LYS  69  -3.699 -19.681 -10.435
   13    HZ1  LYS  69           HZ3      LYS  69  -2.993 -21.219 -10.589

  No H/Q in entry =          13
  In of MODEL   10
    1    H    VAL  70           H        VAL  70   0.142 -19.556  -5.162
    2    HA   VAL  70           HA       VAL  70  -1.286 -20.272  -2.660
    3    HB   VAL  70           HB       VAL  70  -0.563 -18.048  -1.794
    4   HG12  VAL  70          HG11      VAL  70   1.742 -19.795  -2.705
    5   HG11  VAL  70          HG12      VAL  70   0.727 -20.120  -1.299
    6   HG13  VAL  70          HG13      VAL  70   1.752 -18.685  -1.334
    7   HG22  VAL  70          HG21      VAL  70  -0.214 -16.838  -3.882
    8   HG21  VAL  70          HG22      VAL  70   1.022 -17.988  -4.386
    9   HG23  VAL  70          HG23      VAL  70   1.333 -16.904  -3.033

  No H/Q in entry =           9
  In of MODEL   10
    1    H    SER  71           H        SER  71  -2.906 -18.633  -2.034
    2    HA   SER  71           HA       SER  71  -4.786 -18.119  -4.081
    3    HB2  SER  71           HB2      SER  71  -5.359 -18.314  -1.646
    4    HB3  SER  71           HB3      SER  71  -4.565 -16.769  -1.366
    5    HG   SER  71           HG       SER  71  -7.037 -17.145  -2.065

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU  72           H        LEU  72  -5.065 -16.439  -5.410
    2    HA   LEU  72           HA       LEU  72  -2.978 -14.606  -5.901
    3    HB2  LEU  72           HB2      LEU  72  -5.846 -14.690  -6.832
    4    HB3  LEU  72           HB3      LEU  72  -4.666 -13.519  -7.413
    5    HG   LEU  72           HG       LEU  72  -4.228 -16.521  -7.550
    6   HD13  LEU  72          HD11      LEU  72  -6.186 -15.886  -8.906
    7   HD12  LEU  72          HD12      LEU  72  -4.823 -16.310  -9.942
    8   HD11  LEU  72          HD13      LEU  72  -5.240 -14.617  -9.685
    9   HD21  LEU  72          HD21      LEU  72  -2.794 -14.083  -8.593
   10   HD23  LEU  72          HD22      LEU  72  -2.672 -15.593  -9.481
   11   HD22  LEU  72          HD23      LEU  72  -2.118 -15.509  -7.811

  No H/Q in entry =          11
  In of MODEL   10
    1    H    VAL  73           H        VAL  73  -6.067 -14.281  -4.256
    2    HA   VAL  73           HA       VAL  73  -6.139 -11.511  -3.903
    3    HB   VAL  73           HB       VAL  73  -7.836 -11.893  -2.294
    4   HG11  VAL  73          HG11      VAL  73  -8.206 -12.681  -4.699
    5   HG13  VAL  73          HG12      VAL  73  -9.297 -13.349  -3.486
    6   HG12  VAL  73          HG13      VAL  73  -7.954 -14.319  -4.094
    7   HG23  VAL  73          HG21      VAL  73  -8.099 -14.420  -1.551
    8   HG22  VAL  73          HG22      VAL  73  -6.991 -13.351  -0.691
    9   HG21  VAL  73          HG23      VAL  73  -6.371 -14.481  -1.895

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LEU  74           H        LEU  74  -4.169 -13.860  -2.330
    2    HA   LEU  74           HA       LEU  74  -3.757 -12.716   0.191
    3    HB2  LEU  74           HB2      LEU  74  -2.954 -14.927  -0.317
    4    HB3  LEU  74           HB3      LEU  74  -1.908 -14.300  -1.590
    5    HG   LEU  74           HG       LEU  74  -0.605 -13.046   0.088
    6   HD13  LEU  74          HD11      LEU  74  -2.159 -12.543   1.809
    7   HD12  LEU  74          HD12      LEU  74  -1.094 -13.750   2.533
    8   HD11  LEU  74          HD13      LEU  74  -2.685 -14.222   1.936
    9   HD23  LEU  74          HD21      LEU  74  -0.796 -15.782   1.224
   10   HD22  LEU  74          HD22      LEU  74   0.598 -14.869   0.692
   11   HD21  LEU  74          HD23      LEU  74  -0.432 -15.637  -0.494

  No H/Q in entry =          11
  In of MODEL   10
    1    H    VAL  75           H        VAL  75  -1.886 -12.301  -2.775
    2    HA   VAL  75           HA       VAL  75  -0.103 -10.359  -1.772
    3    HB   VAL  75           HB       VAL  75  -1.068 -10.852  -4.591
    4   HG11  VAL  75          HG11      VAL  75   1.201  -9.110  -3.529
    5   HG13  VAL  75          HG12      VAL  75  -0.231  -8.552  -4.382
    6   HG12  VAL  75          HG13      VAL  75   0.965  -9.524  -5.222
    7   HG21  VAL  75          HG21      VAL  75   0.194 -12.680  -3.392
    8   HG23  VAL  75          HG22      VAL  75   1.534 -11.552  -3.189
    9   HG22  VAL  75          HG23      VAL  75   1.040 -12.051  -4.807

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLU  76           H        GLU  76  -3.266 -10.043  -3.414
    2    HA   GLU  76           HA       GLU  76  -3.347  -7.229  -3.513
    3    HB2  GLU  76           HB2      GLU  76  -4.996  -8.683  -4.669
    4    HB3  GLU  76           HB3      GLU  76  -5.636  -9.192  -3.114
    5    HG2  GLU  76           HG2      GLU  76  -7.115  -7.495  -3.977
    6    HG3  GLU  76           HG3      GLU  76  -6.230  -6.772  -2.647

  No H/Q in entry =           6
  In of MODEL   10
    1    H    ALA  77           H        ALA  77  -4.422  -9.471  -0.970
    2    HA   ALA  77           HA       ALA  77  -5.390  -7.480   0.795
    3    HB1  ALA  77           HB1      ALA  77  -4.241 -10.196   1.483
    4    HB2  ALA  77           HB2      ALA  77  -5.916  -9.887   1.028
    5    HB3  ALA  77           HB3      ALA  77  -5.269  -9.207   2.519

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLN  78           H        GLN  78  -2.229  -8.996   0.414
    2    HA   GLN  78           HA       GLN  78  -0.972  -7.825   2.658
    3    HB2  GLN  78           HB2      GLN  78  -0.139  -9.758   1.205
    4    HB3  GLN  78           HB3      GLN  78   0.390  -8.534   0.053
    5    HG2  GLN  78           HG2      GLN  78   1.857  -7.537   1.688
    6    HG3  GLN  78           HG3      GLN  78   1.222  -8.574   2.964
    7   HE21  GLN  78          HE21      GLN  78   1.316 -11.099   2.083
    8   HE22  GLN  78          HE22      GLN  78   2.854 -11.531   1.506

  No H/Q in entry =           8
  In of MODEL   10
    1    H    LEU  79           H        LEU  79  -1.366  -6.765  -0.686
    2    HA   LEU  79           HA       LEU  79   0.299  -4.522  -0.679
    3    HB2  LEU  79           HB2      LEU  79  -0.731  -5.338  -2.729
    4    HB3  LEU  79           HB3      LEU  79  -2.335  -4.962  -2.112
    5    HG   LEU  79           HG       LEU  79  -1.813  -2.570  -2.087
    6   HD13  LEU  79          HD11      LEU  79   0.427  -2.305  -1.586
    7   HD12  LEU  79          HD12      LEU  79   0.464  -2.016  -3.325
    8   HD11  LEU  79          HD13      LEU  79   0.937  -3.590  -2.682
    9   HD23  LEU  79          HD21      LEU  79  -1.194  -2.363  -4.642
   10   HD22  LEU  79          HD22      LEU  79  -2.711  -3.126  -4.176
   11   HD21  LEU  79          HD23      LEU  79  -1.331  -4.121  -4.628

  No H/Q in entry =          11
  In of MODEL   10
    1    H    HIS  80           H        HIS  80  -3.162  -4.718   0.164
    2    HA   HIS  80           HA       HIS  80  -3.376  -1.964   0.830
    3    HB2  HIS  80           HB2      HIS  80  -5.053  -4.388   1.156
    4    HB3  HIS  80           HB3      HIS  80  -5.380  -3.052   2.263
    5    HD1  HIS  80           HD1      HIS  80  -7.018  -1.430   1.365
    6    HD2  HIS  80           HD2      HIS  80  -4.824  -3.220  -1.695
    7    HE1  HIS  80           HE1      HIS  80  -7.878  -0.439  -0.810
    8    HE2  HIS  80           HE2      HIS  80  -6.547  -1.525  -2.684

  No H/Q in entry =           8
  In of MODEL   10
    1    H    LEU  81           H        LEU  81  -2.850  -4.855   2.819
    2    HA   LEU  81           HA       LEU  81  -2.837  -3.509   5.304
    3    HB2  LEU  81           HB2      LEU  81  -1.600  -6.114   4.417
    4    HB3  LEU  81           HB3      LEU  81  -1.570  -5.556   6.091
    5    HG   LEU  81           HG       LEU  81  -4.122  -5.831   4.476
    6   HD12  LEU  81          HD11      LEU  81  -4.398  -7.900   6.023
    7   HD11  LEU  81          HD12      LEU  81  -2.646  -7.813   6.200
    8   HD13  LEU  81          HD13      LEU  81  -3.361  -8.049   4.605
    9   HD23  LEU  81          HD21      LEU  81  -4.951  -6.043   6.981
   10   HD22  LEU  81          HD22      LEU  81  -4.643  -4.450   6.290
   11   HD21  LEU  81          HD23      LEU  81  -3.444  -5.201   7.344

  No H/Q in entry =          11
  In of MODEL   10
    1    H    MET  82           H        MET  82  -0.160  -4.388   3.119
    2    HA   MET  82           HA       MET  82   1.924  -3.477   4.793
    3    HB2  MET  82           HB2      MET  82   1.697  -3.818   1.802
    4    HB3  MET  82           HB3      MET  82   3.178  -3.236   2.558
    5    HG2  MET  82           HG2      MET  82   1.797  -5.837   3.288
    6    HG3  MET  82           HG3      MET  82   3.162  -5.715   2.181
    7    HE3  MET  82           HE1      MET  82   6.181  -4.955   4.149
    8    HE2  MET  82           HE2      MET  82   5.243  -3.595   3.537
    9    HE1  MET  82           HE3      MET  82   5.340  -5.084   2.600

  No H/Q in entry =           9
  In of MODEL   10
    1    H    THR  83           H        THR  83   0.075  -1.849   2.247
    2    HA   THR  83           HA       THR  83   1.467   0.611   2.327
    3    HB   THR  83           HB       THR  83  -0.722   1.518   1.353
    4    HG1  THR  83           HG1      THR  83  -2.362   0.208   1.254
    5   HG22  THR  83          HG21      THR  83  -0.447  -0.296  -0.650
    6   HG21  THR  83          HG22      THR  83   1.061  -0.576   0.219
    7   HG23  THR  83          HG23      THR  83   0.683   1.034  -0.394

  No H/Q in entry =           7
  In of MODEL   10
    1    H    SER  84           H        SER  84  -1.522  -0.447   3.943
    2    HA   SER  84           HA       SER  84  -2.031   1.978   5.292
    3    HB2  SER  84           HB2      SER  84  -2.838  -0.866   5.859
    4    HB3  SER  84           HB3      SER  84  -3.336   0.470   6.895
    5    HG   SER  84           HG       SER  84  -3.807   0.154   4.105

  No H/Q in entry =           5
  In of MODEL   10
    1    H    MET  85           H        MET  85  -0.291  -0.940   6.411
    2    HA   MET  85           HA       MET  85   0.234  -0.011   9.013
    3    HB2  MET  85           HB2      MET  85   0.542  -2.352   8.334
    4    HB3  MET  85           HB3      MET  85   1.913  -1.877   7.331
    5    HG2  MET  85           HG2      MET  85   3.086  -1.023   9.330
    6    HG3  MET  85           HG3      MET  85   1.711  -1.486  10.332
    7    HE2  MET  85           HE1      MET  85   4.944  -4.120   8.491
    8    HE1  MET  85           HE2      MET  85   4.961  -2.387   8.808
    9    HE3  MET  85           HE3      MET  85   4.001  -3.023   7.476

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LEU  86           H        LEU  86   2.151   0.261   6.052
    2    HA   LEU  86           HA       LEU  86   4.361   1.589   7.196
    3    HB2  LEU  86           HB2      LEU  86   4.166   0.506   4.888
    4    HB3  LEU  86           HB3      LEU  86   3.344   1.981   4.380
    5    HG   LEU  86           HG       LEU  86   5.368   3.243   5.351
    6   HD11  LEU  86          HD11      LEU  86   6.097   0.636   6.145
    7   HD13  LEU  86          HD12      LEU  86   7.090   2.089   6.238
    8   HD12  LEU  86          HD13      LEU  86   7.200   1.042   4.826
    9   HD23  LEU  86          HD21      LEU  86   6.086   1.486   2.996
   10   HD22  LEU  86          HD22      LEU  86   6.467   3.186   3.256
   11   HD21  LEU  86          HD23      LEU  86   4.816   2.705   2.866

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ALA  87           H        ALA  87   1.431   2.810   5.628
    2    HA   ALA  87           HA       ALA  87   2.005   5.545   5.709
    3    HB1  ALA  87           HB1      ALA  87  -0.295   3.899   5.180
    4    HB3  ALA  87           HB2      ALA  87   0.001   5.563   4.679
    5    HB2  ALA  87           HB3      ALA  87  -0.782   5.235   6.226

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ARG  88           H        ARG  88   0.343   3.529   8.107
    2    HA   ARG  88           HA       ARG  88  -0.174   5.574   9.957
    3    HB2  ARG  88           HB2      ARG  88  -1.094   3.215  10.028
    4    HB3  ARG  88           HB3      ARG  88   0.454   2.726  10.726
    5    HG2  ARG  88           HG2      ARG  88  -0.030   4.797  12.349
    6    HG3  ARG  88           HG3      ARG  88  -1.697   4.459  11.902
    7    HD2  ARG  88           HD2      ARG  88  -1.783   2.609  13.148
    8    HD3  ARG  88           HD3      ARG  88  -0.192   2.039  12.608
    9    HE   ARG  88           HE       ARG  88  -0.722   3.298  15.066
   10   HH21  ARG  88          HH11      ARG  88   0.834   4.322  16.296
   11   HH22  ARG  88          HH12      ARG  88   2.347   4.760  15.584
   12   HH11  ARG  88          HH21      ARG  88   1.543   3.498  12.477
   13   HH12  ARG  88          HH22      ARG  88   2.756   4.278  13.433

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLU  89           H        GLU  89   2.638   3.378   9.719
    2    HA   GLU  89           HA       GLU  89   3.905   4.276  12.056
    3    HB2  GLU  89           HB2      GLU  89   4.573   2.263  10.709
    4    HB3  GLU  89           HB3      GLU  89   5.333   3.363   9.558
    5    HG2  GLU  89           HG2      GLU  89   6.821   4.222  11.294
    6    HG3  GLU  89           HG3      GLU  89   6.000   3.259  12.519

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LEU  90           H        LEU  90   4.195   5.437   8.727
    2    HA   LEU  90           HA       LEU  90   6.112   7.453   9.303
    3    HB2  LEU  90           HB2      LEU  90   4.097   7.105   7.086
    4    HB3  LEU  90           HB3      LEU  90   5.317   8.386   7.101
    5    HG   LEU  90           HG       LEU  90   6.017   5.455   7.431
    6   HD12  LEU  90          HD11      LEU  90   6.751   5.695   4.987
    7   HD11  LEU  90          HD12      LEU  90   5.723   7.127   4.944
    8   HD13  LEU  90          HD13      LEU  90   5.018   5.548   5.291
    9   HD22  LEU  90          HD21      LEU  90   7.908   6.620   8.103
   10   HD21  LEU  90          HD22      LEU  90   7.541   8.022   7.098
   11   HD23  LEU  90          HD23      LEU  90   8.209   6.563   6.368

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  91           H        ILE  91   2.572   7.438   9.172
    2    HA   ILE  91           HA       ILE  91   2.208  10.208   9.625
    3    HB   ILE  91           HB       ILE  91   0.441   7.817  10.177
    4   HG12  ILE  91          HG12      ILE  91   0.162  10.096   8.194
    5   HG13  ILE  91          HG13      ILE  91   1.034   8.609   7.817
    6   HG22  ILE  91          HG21      ILE  91  -1.309   9.860  10.250
    7   HG21  ILE  91          HG22      ILE  91   0.088  10.702  10.915
    8   HG23  ILE  91          HG23      ILE  91  -0.531   9.259  11.715
    9   HD13  ILE  91          HD11      ILE  91  -0.899   7.305   7.871
   10   HD12  ILE  91          HD12      ILE  91  -1.505   8.814   7.193
   11   HD11  ILE  91          HD13      ILE  91  -1.764   8.448   8.899

  No H/Q in entry =          11
  In of MODEL   10
    1    H    THR  92           H        THR  92   2.647   7.470  11.824
    2    HA   THR  92           HA       THR  92   2.204   8.839  14.250
    3    HB   THR  92           HB       THR  92   4.030   6.521  13.576
    4    HG1  THR  92           HG1      THR  92   2.068   5.746  13.486
    5   HG22  THR  92          HG21      THR  92   3.663   6.233  16.212
    6   HG21  THR  92          HG22      THR  92   3.582   7.992  16.139
    7   HG23  THR  92          HG23      THR  92   5.020   7.150  15.559

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLU  93           H        GLU  93   5.149   8.418  12.302
    2    HA   GLU  93           HA       GLU  93   6.898   9.861  13.990
    3    HB2  GLU  93           HB2      GLU  93   6.974   9.547  10.975
    4    HB3  GLU  93           HB3      GLU  93   8.315  10.090  11.982
    5    HG2  GLU  93           HG2      GLU  93   6.933   7.440  12.437
    6    HG3  GLU  93           HG3      GLU  93   8.309   7.605  11.354

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LEU  94           H        LEU  94   4.826  10.856  11.288
    2    HA   LEU  94           HA       LEU  94   5.604  13.568  11.183
    3    HB2  LEU  94           HB2      LEU  94   3.024  12.177  10.442
    4    HB3  LEU  94           HB3      LEU  94   3.264  13.907  10.199
    5    HG   LEU  94           HG       LEU  94   5.295  11.939   9.139
    6   HD11  LEU  94          HD11      LEU  94   2.543  12.462   8.090
    7   HD13  LEU  94          HD12      LEU  94   3.540  11.016   7.960
    8   HD12  LEU  94          HD13      LEU  94   3.856  12.399   6.914
    9   HD23  LEU  94          HD21      LEU  94   5.519  13.777   7.415
   10   HD22  LEU  94          HD22      LEU  94   5.937  14.275   9.055
   11   HD21  LEU  94          HD23      LEU  94   4.378  14.727   8.364

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  95           H        ILE  95   3.092  11.926  13.087
    2    HA   ILE  95           HA       ILE  95   2.031  14.265  14.286
    3    HB   ILE  95           HB       ILE  95   2.082  11.384  15.212
    4   HG12  ILE  95          HG12      ILE  95  -0.162  13.134  14.173
    5   HG13  ILE  95          HG13      ILE  95   0.801  12.084  13.136
    6   HG21  ILE  95          HG21      ILE  95   0.780  13.843  16.419
    7   HG23  ILE  95          HG22      ILE  95   1.844  12.685  17.219
    8   HG22  ILE  95          HG23      ILE  95   0.212  12.207  16.751
    9   HD13  ILE  95          HD11      ILE  95  -0.077  10.137  14.060
   10   HD12  ILE  95          HD12      ILE  95  -1.471  11.212  14.143
   11   HD11  ILE  95          HD13      ILE  95  -0.495  10.924  15.583

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLU  96           H        GLU  96   4.654  12.074  15.270
    2    HA   GLU  96           HA       GLU  96   5.208  13.279  17.759
    3    HB2  GLU  96           HB2      GLU  96   6.176  11.130  17.107
    4    HB3  GLU  96           HB3      GLU  96   7.095  11.913  15.823
    5    HG2  GLU  96           HG2      GLU  96   8.745  12.480  17.277
    6    HG3  GLU  96           HG3      GLU  96   7.594  13.281  18.338

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LEU  97           H        LEU  97   6.259  14.062  14.468
    2    HA   LEU  97           HA       LEU  97   8.126  16.079  15.170
    3    HB2  LEU  97           HB2      LEU  97   6.529  15.512  12.683
    4    HB3  LEU  97           HB3      LEU  97   7.533  16.954  12.799
    5    HG   LEU  97           HG       LEU  97   8.596  14.168  13.355
    6   HD12  LEU  97          HD11      LEU  97   9.579  14.373  11.033
    7   HD11  LEU  97          HD12      LEU  97   8.511  15.751  10.774
    8   HD13  LEU  97          HD13      LEU  97   7.831  14.152  11.073
    9   HD23  LEU  97          HD21      LEU  97  10.747  15.471  12.602
   10   HD22  LEU  97          HD22      LEU  97  10.133  15.734  14.234
   11   HD21  LEU  97          HD23      LEU  97   9.799  16.913  12.967

  No H/Q in entry =          11
  In of MODEL   10
    1    H    HIS  98           H        HIS  98   4.630  16.175  14.532
    2    HA   HIS  98           HA       HIS  98   4.300  18.971  14.668
    3    HB2  HIS  98           HB2      HIS  98   2.439  16.699  15.404
    4    HB3  HIS  98           HB3      HIS  98   1.953  18.394  15.461
    5    HD1  HIS  98           HD1      HIS  98   2.994  15.690  13.052
    6    HD2  HIS  98           HD2      HIS  98   1.572  19.608  12.936
    7    HE1  HIS  98           HE1      HIS  98   2.418  16.172  10.631
    8    HE2  HIS  98           HE2      HIS  98   1.555  18.551  10.539

  No H/Q in entry =           8
  In of MODEL   10
    1    H    GLU  99           H        GLU  99   4.473  16.485  17.167
    2    HA   GLU  99           HA       GLU  99   3.856  18.172  19.367
    3    HB2  GLU  99           HB2      GLU  99   3.796  15.690  19.466
    4    HB3  GLU  99           HB3      GLU  99   5.556  15.665  19.349
    5    HG2  GLU  99           HG2      GLU  99   5.739  16.960  21.422
    6    HG3  GLU  99           HG3      GLU  99   3.986  17.080  21.526

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LYS 100           H        LYS 100   6.913  17.277  17.789
    2    HA   LYS 100           HA       LYS 100   8.560  18.697  19.637
    3    HB2  LYS 100           HB2      LYS 100   9.056  17.777  16.796
    4    HB3  LYS 100           HB3      LYS 100  10.282  18.561  17.799
    5    HG2  LYS 100           HG2      LYS 100   9.934  16.807  19.542
    6    HG3  LYS 100           HG3      LYS 100   8.806  15.990  18.456
    7    HD2  LYS 100           HD2      LYS 100  10.596  15.727  16.781
    8    HD3  LYS 100           HD3      LYS 100  11.728  16.556  17.851
    9    HE2  LYS 100           HE2      LYS 100  11.360  14.797  19.572
   10    HE3  LYS 100           HE3      LYS 100  10.289  13.949  18.451
   11    HZ1  LYS 100           HZ1      LYS 100  13.099  14.650  17.783
   12    HZ3  LYS 100           HZ2      LYS 100  12.063  13.583  16.960
   13    HZ2  LYS 100           HZ3      LYS 100  12.664  13.171  18.495

  No H/Q in entry =          13
  In of MODEL   10
    1    H    LEU 101           H        LEU 101   6.842  19.603  16.690
    2    HA   LEU 101           HA       LEU 101   8.025  22.174  16.349
    3    HB2  LEU 101           HB2      LEU 101   5.440  20.911  15.474
    4    HB3  LEU 101           HB3      LEU 101   5.670  22.644  15.265
    5    HG   LEU 101           HG       LEU 101   7.725  20.651  14.290
    6   HD12  LEU 101          HD11      LEU 101   6.555  21.144  12.011
    7   HD11  LEU 101          HD12      LEU 101   5.155  21.558  12.998
    8   HD13  LEU 101          HD13      LEU 101   5.839  19.935  13.077
    9   HD21  LEU 101          HD21      LEU 101   7.061  23.556  13.737
   10   HD23  LEU 101          HD22      LEU 101   8.047  22.607  12.626
   11   HD22  LEU 101          HD23      LEU 101   8.594  22.871  14.282

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LYS 102           H        LYS 102   6.514  21.019  18.972
    2    HA   LYS 102           HA       LYS 102   5.878  22.104  20.907
    3    HB2  LYS 102           HB2      LYS 102   7.133  24.108  19.776
    4    HB3  LYS 102           HB3      LYS 102   5.526  24.695  19.408
    5    HG2  LYS 102           HG2      LYS 102   6.918  24.455  22.053
    6    HG3  LYS 102           HG3      LYS 102   5.948  25.773  21.429
    7    HD2  LYS 102           HD2      LYS 102   4.738  23.123  22.314
    8    HD3  LYS 102           HD3      LYS 102   4.976  24.486  23.396
    9    HE2  LYS 102           HE2      LYS 102   2.694  24.058  21.918
   10    HE3  LYS 102           HE3      LYS 102   3.183  25.609  22.597
   11    HZ2  LYS 102           HZ1      LYS 102   2.640  25.711  20.220
   12    HZ1  LYS 102           HZ2      LYS 102   3.912  24.643  19.891
   13    HZ3  LYS 102           HZ3      LYS 102   4.241  26.177  20.532

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ALA 103           H        ALA 103   4.210  23.628  18.147
    2    HA   ALA 103           HA       ALA 103   1.754  24.177  19.044
    3    HB1  ALA 103           HB1      ALA 103   0.854  23.326  16.806
    4    HB2  ALA 103           HB2      ALA 103   2.506  22.807  16.468
    5    HB3  ALA 103           HB3      ALA 103   2.153  24.515  16.736

  No H/Q in entry =           5
  In of MODEL   10
    1    H1   ALA   1           H3       ALA   1  10.722 -20.226  -6.271
    2    H2   ALA   1           H2       ALA   1   9.754 -20.443  -7.653
    3    H3   ALA   1           H1       ALA   1   9.331 -21.194  -6.187
    4    HA   ALA   1           HA       ALA   1  10.386 -22.992  -6.932
    5    HB1  ALA   1           HB1      ALA   1  10.467 -22.631  -9.208
    6    HB2  ALA   1           HB2      ALA   1  12.194 -22.463  -8.888
    7    HB3  ALA   1           HB3      ALA   1  11.180 -21.026  -9.033

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLU   2           H        GLU   2  12.679 -23.918  -7.001
    2    HA   GLU   2           HA       GLU   2  14.071 -23.823  -4.796
    3    HB2  GLU   2           HB2      GLU   2  15.412 -23.677  -7.502
    4    HB3  GLU   2           HB3      GLU   2  16.154 -24.281  -6.021
    5    HG2  GLU   2           HG2      GLU   2  15.157 -26.308  -6.257
    6    HG3  GLU   2           HG3      GLU   2  13.577 -25.578  -6.508

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLU   3           H        GLU   3  15.811 -21.940  -7.207
    2    HA   GLU   3           HA       GLU   3  16.957 -20.241  -5.253
    3    HB2  GLU   3           HB2      GLU   3  16.885 -20.239  -8.262
    4    HB3  GLU   3           HB3      GLU   3  17.622 -18.903  -7.379
    5    HG2  GLU   3           HG2      GLU   3  19.303 -20.260  -6.465
    6    HG3  GLU   3           HG3      GLU   3  18.371 -21.736  -6.681

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LEU   4           H        LEU   4  14.653 -19.416  -7.872
    2    HA   LEU   4           HA       LEU   4  14.163 -16.812  -7.258
    3    HB2  LEU   4           HB2      LEU   4  12.004 -18.809  -7.977
    4    HB3  LEU   4           HB3      LEU   4  11.910 -17.061  -8.175
    5    HG   LEU   4           HG       LEU   4  13.887 -18.904  -9.558
    6   HD13  LEU   4          HD11      LEU   4  12.574 -18.768 -11.462
    7   HD12  LEU   4          HD12      LEU   4  11.853 -17.231 -10.991
    8   HD11  LEU   4          HD13      LEU   4  11.318 -18.727 -10.227
    9   HD23  LEU   4          HD21      LEU   4  14.193 -16.655 -10.911
   10   HD22  LEU   4          HD22      LEU   4  15.063 -16.889  -9.396
   11   HD21  LEU   4          HD23      LEU   4  13.600 -15.908  -9.428

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLU   5           H        GLU   5  12.715 -19.611  -5.608
    2    HA   GLU   5           HA       GLU   5  11.030 -18.057  -3.897
    3    HB2  GLU   5           HB2      GLU   5  10.625 -20.438  -4.415
    4    HB3  GLU   5           HB3      GLU   5  12.069 -20.861  -3.495
    5    HG2  GLU   5           HG2      GLU   5  11.105 -19.837  -1.480
    6    HG3  GLU   5           HG3      GLU   5   9.667 -19.382  -2.393

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLU   6           H        GLU   6  14.195 -19.604  -3.470
    2    HA   GLU   6           HA       GLU   6  14.553 -18.745  -0.774
    3    HB2  GLU   6           HB2      GLU   6  15.785 -20.648  -1.845
    4    HB3  GLU   6           HB3      GLU   6  16.684 -19.466  -2.800
    5    HG2  GLU   6           HG2      GLU   6  18.067 -19.902  -0.921
    6    HG3  GLU   6           HG3      GLU   6  17.288 -18.363  -0.559

  No H/Q in entry =           6
  In of MODEL   10
    1    H    VAL   7           H        VAL   7  15.288 -17.410  -3.927
    2    HA   VAL   7           HA       VAL   7  16.956 -15.266  -3.071
    3    HB   VAL   7           HB       VAL   7  15.242 -15.647  -5.540
    4   HG11  VAL   7          HG11      VAL   7  17.116 -13.414  -4.737
    5   HG13  VAL   7          HG12      VAL   7  15.469 -13.289  -5.352
    6   HG12  VAL   7          HG13      VAL   7  16.778 -13.778  -6.429
    7   HG21  VAL   7          HG21      VAL   7  17.367 -17.082  -4.982
    8   HG23  VAL   7          HG22      VAL   7  18.254 -15.611  -5.385
    9   HG22  VAL   7          HG23      VAL   7  17.220 -16.372  -6.591

  No H/Q in entry =           9
  In of MODEL   10
    1    H    VAL   8           H        VAL   8  13.464 -15.573  -3.610
    2    HA   VAL   8           HA       VAL   8  12.772 -12.872  -3.135
    3    HB   VAL   8           HB       VAL   8  11.190 -15.418  -2.692
    4   HG12  VAL   8          HG11      VAL   8   9.253 -13.662  -2.912
    5   HG11  VAL   8          HG12      VAL   8  10.480 -12.508  -2.392
    6   HG13  VAL   8          HG13      VAL   8  10.056 -13.868  -1.355
    7   HG22  VAL   8          HG21      VAL   8  10.588 -15.277  -4.913
    8   HG21  VAL   8          HG22      VAL   8  12.049 -14.305  -5.062
    9   HG23  VAL   8          HG23      VAL   8  10.486 -13.518  -4.869

  No H/Q in entry =           9
  In of MODEL   10
    1    H    MET   9           H        MET   9  13.080 -15.675  -0.956
    2    HA   MET   9           HA       MET   9  12.263 -14.412   1.418
    3    HB2  MET   9           HB2      MET   9  14.140 -16.691   0.833
    4    HB3  MET   9           HB3      MET   9  13.956 -16.086   2.479
    5    HG2  MET   9           HG2      MET   9  11.413 -16.327   2.078
    6    HG3  MET   9           HG3      MET   9  11.864 -17.322   0.693
    7    HE2  MET   9           HE1      MET   9  14.389 -18.974   1.477
    8    HE1  MET   9           HE2      MET   9  12.899 -19.421   0.652
    9    HE3  MET   9           HE3      MET   9  13.483 -20.403   1.992

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLY  10           H        GLY  10  15.439 -14.601  -0.154
    2    HA3  GLY  10           HA2      GLY  10  16.892 -13.164   1.808
    3    HA2  GLY  10           HA3      GLY  10  17.348 -13.324   0.112

  No H/Q in entry =           3
  In of MODEL   10
    1    H    LEU  11           H        LEU  11  15.160 -12.127  -1.116
    2    HA   LEU  11           HA       LEU  11  15.813  -9.375  -0.956
    3    HB2  LEU  11           HB2      LEU  11  13.456 -10.812  -2.179
    4    HB3  LEU  11           HB3      LEU  11  13.716  -9.074  -2.340
    5    HG   LEU  11           HG       LEU  11  15.763 -11.159  -3.138
    6   HD13  LEU  11          HD11      LEU  11  14.014 -11.546  -4.649
    7   HD12  LEU  11          HD12      LEU  11  14.999 -10.353  -5.495
    8   HD11  LEU  11          HD13      LEU  11  13.524  -9.852  -4.669
    9   HD22  LEU  11          HD21      LEU  11  16.973  -9.181  -2.919
   10   HD21  LEU  11          HD22      LEU  11  15.584  -8.161  -3.290
   11   HD23  LEU  11          HD23      LEU  11  16.419  -9.019  -4.583

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  12           H        ILE  12  13.073 -11.233   0.325
    2    HA   ILE  12           HA       ILE  12  11.659  -9.026   1.392
    3    HB   ILE  12           HB       ILE  12  11.737 -11.920   2.301
    4   HG12  ILE  12          HG12      ILE  12  10.973 -11.277  -0.099
    5   HG13  ILE  12          HG13      ILE  12   9.927 -12.324   0.839
    6   HG23  ILE  12          HG21      ILE  12  10.847 -10.569   4.105
    7   HG22  ILE  12          HG22      ILE  12   9.490 -11.374   3.318
    8   HG21  ILE  12          HG23      ILE  12   9.819  -9.673   2.987
    9   HD13  ILE  12          HD11      ILE  12   8.504 -10.429   1.395
   10   HD12  ILE  12          HD12      ILE  12   8.712 -10.503  -0.353
   11   HD11  ILE  12          HD13      ILE  12   9.608  -9.330   0.588

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  13           H        ILE  13  14.085 -11.201   2.786
    2    HA   ILE  13           HA       ILE  13  14.119 -10.022   5.366
    3    HB   ILE  13           HB       ILE  13  16.194 -11.566   3.790
    4   HG12  ILE  13          HG12      ILE  13  13.925 -12.555   4.646
    5   HG13  ILE  13          HG13      ILE  13  15.412 -13.469   4.882
    6   HG23  ILE  13          HG21      ILE  13  17.594 -10.491   5.303
    7   HG22  ILE  13          HG22      ILE  13  17.138 -11.907   6.240
    8   HG21  ILE  13          HG23      ILE  13  16.348 -10.361   6.541
    9   HD12  ILE  13          HD11      ILE  13  13.894 -13.307   6.937
   10   HD11  ILE  13          HD12      ILE  13  14.292 -11.593   6.975
   11   HD13  ILE  13          HD13      ILE  13  15.561 -12.792   7.184

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ASN  14           H        ASN  14  16.051  -9.466   2.438
    2    HA   ASN  14           HA       ASN  14  17.775  -7.501   3.491
    3    HB2  ASN  14           HB2      ASN  14  17.758  -8.767   1.175
    4    HB3  ASN  14           HB3      ASN  14  16.843  -7.362   0.643
    5   HD21  ASN  14          HD21      ASN  14  19.282  -7.669  -0.555
    6   HD22  ASN  14          HD22      ASN  14  20.413  -6.570   0.067

  No H/Q in entry =           6
  In of MODEL   10
    1    H    SER  15           H        SER  15  14.651  -7.196   1.814
    2    HA   SER  15           HA       SER  15  14.500  -4.377   1.871
    3    HB2  SER  15           HB2      SER  15  12.168  -4.657   1.389
    4    HB3  SER  15           HB3      SER  15  12.981  -6.009   0.611
    5    HG   SER  15           HG       SER  15  11.562  -7.104   1.733

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLY  16           H        GLY  16  13.453  -6.853   4.180
    2    HA3  GLY  16           HA2      GLY  16  12.215  -5.121   6.043
    3    HA2  GLY  16           HA3      GLY  16  12.855  -6.721   6.402

  No H/Q in entry =           3
  In of MODEL   10
    1    H    GLN  17           H        GLN  17  15.558  -6.349   5.797
    2    HA   GLN  17           HA       GLN  17  16.509  -5.114   8.173
    3    HB2  GLN  17           HB2      GLN  17  17.764  -6.886   6.988
    4    HB3  GLN  17           HB3      GLN  17  18.034  -5.785   5.637
    5    HG2  GLN  17           HG2      GLN  17  19.232  -4.234   7.140
    6    HG3  GLN  17           HG3      GLN  17  18.975  -5.343   8.485
    7   HE21  GLN  17          HE21      GLN  17  20.750  -6.667   8.864
    8   HE22  GLN  17          HE22      GLN  17  21.849  -7.187   7.681

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ALA  18           H        ALA  18  16.288  -4.039   4.814
    2    HA   ALA  18           HA       ALA  18  17.690  -1.626   5.034
    3    HB2  ALA  18           HB1      ALA  18  16.580  -2.857   2.972
    4    HB3  ALA  18           HB2      ALA  18  16.819  -1.110   2.955
    5    HB1  ALA  18           HB3      ALA  18  15.231  -1.779   3.332

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ARG  19           H        ARG  19  14.201  -2.265   5.447
    2    HA   ARG  19           HA       ARG  19  13.498   0.375   6.166
    3    HB2  ARG  19           HB2      ARG  19  11.840  -1.401   5.587
    4    HB3  ARG  19           HB3      ARG  19  12.200  -2.194   7.122
    5    HG2  ARG  19           HG2      ARG  19  11.466  -0.214   8.365
    6    HG3  ARG  19           HG3      ARG  19  11.196   0.659   6.857
    7    HD2  ARG  19           HD2      ARG  19   9.071  -0.169   7.687
    8    HD3  ARG  19           HD3      ARG  19   9.496  -1.042   6.209
    9    HE   ARG  19           HE       ARG  19  10.487  -2.570   8.310
   10   HH21  ARG  19          HH11      ARG  19   9.266  -4.229   9.254
   11   HH22  ARG  19          HH12      ARG  19   7.545  -4.227   9.092
   12   HH11  ARG  19          HH21      ARG  19   7.469  -1.322   7.229
   13   HH12  ARG  19          HH22      ARG  19   6.528  -2.581   7.940

  No H/Q in entry =          13
  In of MODEL   10
    1    H    SER  20           H        SER  20  14.406  -2.443   8.121
    2    HA   SER  20           HA       SER  20  14.118  -1.347  10.659
    3    HB2  SER  20           HB2      SER  20  14.618  -3.664  10.538
    4    HB3  SER  20           HB3      SER  20  16.059  -3.382   9.566
    5    HG   SER  20           HG       SER  20  16.694  -2.075  11.549

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU  21           H        LEU  21  16.951  -1.244   8.510
    2    HA   LEU  21           HA       LEU  21  18.611   0.267  10.241
    3    HB2  LEU  21           HB2      LEU  21  18.580  -0.001   7.227
    4    HB3  LEU  21           HB3      LEU  21  19.828   0.871   8.114
    5    HG   LEU  21           HG       LEU  21  19.123  -2.032   8.636
    6   HD12  LEU  21          HD11      LEU  21  21.501  -0.973   7.088
    7   HD11  LEU  21          HD12      LEU  21  20.029  -1.552   6.312
    8   HD13  LEU  21          HD13      LEU  21  21.004  -2.654   7.281
    9   HD22  LEU  21          HD21      LEU  21  20.261  -1.304  10.550
   10   HD21  LEU  21          HD22      LEU  21  21.226  -0.125   9.669
   11   HD23  LEU  21          HD23      LEU  21  21.612  -1.834   9.553

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ALA  22           H        ALA  22  16.321   1.202   7.695
    2    HA   ALA  22           HA       ALA  22  16.819   3.968   7.707
    3    HB3  ALA  22           HB1      ALA  22  15.428   2.705   6.035
    4    HB2  ALA  22           HB2      ALA  22  14.701   4.208   6.605
    5    HB1  ALA  22           HB3      ALA  22  14.136   2.660   7.235

  No H/Q in entry =           5
  In of MODEL   10
    1    H    TYR  23           H        TYR  23  14.358   2.116   9.553
    2    HA   TYR  23           HA       TYR  23  13.369   4.339  11.007
    3    HB2  TYR  23           HB2      TYR  23  12.164   2.208  10.992
    4    HB3  TYR  23           HB3      TYR  23  13.511   1.416  11.808
    5    HD1  TYR  23           HD1      TYR  23  10.995   4.148  12.191
    6    HD2  TYR  23           HD2      TYR  23  13.696   1.452  14.162
    7    HE1  TYR  23           HE1      TYR  23  10.069   4.827  14.391
    8    HE2  TYR  23           HE2      TYR  23  12.769   2.130  16.360
    9    HH   TYR  23           HH       TYR  23   9.888   3.949  16.658

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ALA  24           H        ALA  24  16.050   2.101  11.632
    2    HA   ALA  24           HA       ALA  24  16.717   3.106  14.193
    3    HB1  ALA  24           HB1      ALA  24  18.098   1.333  14.021
    4    HB3  ALA  24           HB2      ALA  24  19.107   2.269  12.918
    5    HB2  ALA  24           HB3      ALA  24  17.825   1.242  12.282

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA  25           H        ALA  25  17.646   4.049  10.910
    2    HA   ALA  25           HA       ALA  25  19.566   6.011  11.547
    3    HB1  ALA  25           HB1      ALA  25  18.853   5.053   9.235
    4    HB3  ALA  25           HB2      ALA  25  19.331   6.747   9.326
    5    HB2  ALA  25           HB3      ALA  25  17.622   6.316   9.264

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU  26           H        LEU  26  16.047   6.190  11.201
    2    HA   LEU  26           HA       LEU  26  15.786   8.968  11.654
    3    HB2  LEU  26           HB2      LEU  26  13.938   7.707  10.734
    4    HB3  LEU  26           HB3      LEU  26  13.868   6.678  12.159
    5    HG   LEU  26           HG       LEU  26  13.241   8.627  13.543
    6   HD12  LEU  26          HD11      LEU  26  12.545  10.719  12.221
    7   HD11  LEU  26          HD12      LEU  26  13.529  10.079  10.907
    8   HD13  LEU  26          HD13      LEU  26  14.275  10.475  12.456
    9   HD21  LEU  26          HD21      LEU  26  11.559   8.291  11.040
   10   HD23  LEU  26          HD22      LEU  26  10.995   8.981  12.559
   11   HD22  LEU  26          HD23      LEU  26  11.470   7.286  12.487

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LYS  27           H        LYS  27  15.726   6.188  13.847
    2    HA   LYS  27           HA       LYS  27  15.125   7.545  16.218
    3    HB2  LYS  27           HB2      LYS  27  15.185   5.070  15.952
    4    HB3  LYS  27           HB3      LYS  27  16.948   5.147  15.901
    5    HG2  LYS  27           HG2      LYS  27  16.994   6.132  18.151
    6    HG3  LYS  27           HG3      LYS  27  15.228   6.127  18.204
    7    HD2  LYS  27           HD2      LYS  27  15.234   3.660  17.967
    8    HD3  LYS  27           HD3      LYS  27  16.999   3.673  17.947
    9    HE2  LYS  27           HE2      LYS  27  17.030   4.662  20.204
   10    HE3  LYS  27           HE3      LYS  27  15.263   4.679  20.226
   11    HZ3  LYS  27           HZ1      LYS  27  16.082   2.737  21.373
   12    HZ2  LYS  27           HZ2      LYS  27  16.999   2.270  20.018
   13    HZ1  LYS  27           HZ3      LYS  27  15.300   2.253  19.946

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLN  28           H        GLN  28  18.242   7.004  14.612
    2    HA   GLN  28           HA       GLN  28  19.920   8.109  16.595
    3    HB2  GLN  28           HB2      GLN  28  20.195   8.065  13.579
    4    HB3  GLN  28           HB3      GLN  28  21.480   8.557  14.681
    5    HG2  GLN  28           HG2      GLN  28  20.101   5.858  14.733
    6    HG3  GLN  28           HG3      GLN  28  21.676   6.168  14.007
    7   HE21  GLN  28          HE21      GLN  28  20.456   4.813  16.699
    8   HE22  GLN  28          HE22      GLN  28  21.631   5.264  17.838

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ALA  29           H        ALA  29  18.138   9.570  13.911
    2    HA   ALA  29           HA       ALA  29  19.106  12.202  14.160
    3    HB2  ALA  29           HB1      ALA  29  17.393  12.818  12.697
    4    HB1  ALA  29           HB2      ALA  29  16.266  11.631  13.352
    5    HB3  ALA  29           HB3      ALA  29  17.599  11.105  12.323

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LYS  30           H        LYS  30  16.356  10.569  15.693
    2    HA   LYS  30           HA       LYS  30  15.320  12.810  17.055
    3    HB2  LYS  30           HB2      LYS  30  15.247   9.867  17.759
    4    HB3  LYS  30           HB3      LYS  30  14.370  11.107  18.657
    5    HG2  LYS  30           HG2      LYS  30  13.228  11.780  16.543
    6    HG3  LYS  30           HG3      LYS  30  14.044  10.453  15.713
    7    HD2  LYS  30           HD2      LYS  30  12.998   8.833  17.246
    8    HD3  LYS  30           HD3      LYS  30  12.192  10.149  18.100
    9    HE2  LYS  30           HE2      LYS  30  11.007  10.768  16.013
   10    HE3  LYS  30           HE3      LYS  30  11.794   9.424  15.178
   11    HZ2  LYS  30           HZ1      LYS  30   9.495   8.987  16.069
   12    HZ1  LYS  30           HZ2      LYS  30  10.168   9.048  17.633
   13    HZ3  LYS  30           HZ3      LYS  30  10.686   7.869  16.520

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLN  31           H        GLN  31  18.010  10.671  17.780
    2    HA   GLN  31           HA       GLN  31  18.337  11.689  20.473
    3    HB2  GLN  31           HB2      GLN  31  20.371  10.142  18.859
    4    HB3  GLN  31           HB3      GLN  31  20.243  10.264  20.614
    5    HG2  GLN  31           HG2      GLN  31  17.737   9.283  19.856
    6    HG3  GLN  31           HG3      GLN  31  18.844   8.452  18.771
    7   HE21  GLN  31          HE21      GLN  31  17.325   7.287  21.053
    8   HE22  GLN  31          HE22      GLN  31  18.493   6.640  22.099

  No H/Q in entry =           8
  In of MODEL   10
    1    H    GLY  32           H        GLY  32  18.828  13.013  17.505
    2    HA3  GLY  32           HA2      GLY  32  19.786  15.069  16.987
    3    HA2  GLY  32           HA3      GLY  32  20.550  15.082  18.571

  No H/Q in entry =           3
  In of MODEL   10
    1    H    ASP  33           H        ASP  33  20.998  12.195  16.791
    2    HA   ASP  33           HA       ASP  33  23.813  12.904  16.313
    3    HB2  ASP  33           HB2      ASP  33  22.336  10.270  16.435
    4    HB3  ASP  33           HB3      ASP  33  24.018  10.407  15.932

  No H/Q in entry =           4
  In of MODEL   10
    1    H    PHE  34           H        PHE  34  23.308  14.222  14.434
    2    HA   PHE  34           HA       PHE  34  21.960  13.223  12.152
    3    HB2  PHE  34           HB2      PHE  34  24.067  15.381  12.374
    4    HB3  PHE  34           HB3      PHE  34  23.079  15.080  10.946
    5    HD1  PHE  34           HD1      PHE  34  23.320  17.016  13.859
    6    HD2  PHE  34           HD2      PHE  34  20.457  14.867  11.486
    7    HE1  PHE  34           HE1      PHE  34  21.492  18.392  14.815
    8    HE2  PHE  34           HE2      PHE  34  18.632  16.243  12.444
    9    HZ   PHE  34           HZ       PHE  34  19.153  18.006  14.105

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ALA  35           H        ALA  35  25.341  13.075  13.145
    2    HA   ALA  35           HA       ALA  35  26.445  12.268  10.683
    3    HB3  ALA  35           HB1      ALA  35  28.147  11.117  12.394
    4    HB2  ALA  35           HB2      ALA  35  27.277  12.132  13.544
    5    HB1  ALA  35           HB3      ALA  35  28.098  12.866  12.168

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA  36           H        ALA  36  25.366  10.297  13.453
    2    HA   ALA  36           HA       ALA  36  25.874   7.816  12.174
    3    HB2  ALA  36           HB1      ALA  36  25.462   7.064  14.251
    4    HB3  ALA  36           HB2      ALA  36  23.767   7.538  14.109
    5    HB1  ALA  36           HB3      ALA  36  24.957   8.684  14.726

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA  37           H        ALA  37  23.027   9.907  12.321
    2    HA   ALA  37           HA       ALA  37  21.188   8.115  11.153
    3    HB3  ALA  37           HB1      ALA  37  21.378  11.081  11.445
    4    HB1  ALA  37           HB2      ALA  37  20.082   9.985  11.923
    5    HB2  ALA  37           HB3      ALA  37  20.257  10.460  10.233

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LYS  38           H        LYS  38  23.249  10.603   9.666
    2    HA   LYS  38           HA       LYS  38  22.603  10.168   6.991
    3    HB2  LYS  38           HB2      LYS  38  24.399  11.748   8.428
    4    HB3  LYS  38           HB3      LYS  38  25.440  10.772   7.398
    5    HG2  LYS  38           HG2      LYS  38  24.257  11.528   5.407
    6    HG3  LYS  38           HG3      LYS  38  23.056  12.367   6.394
    7    HD2  LYS  38           HD2      LYS  38  24.634  13.986   7.140
    8    HD3  LYS  38           HD3      LYS  38  26.004  13.017   6.598
    9    HE2  LYS  38           HE2      LYS  38  25.616  14.884   5.048
   10    HE3  LYS  38           HE3      LYS  38  25.297  13.343   4.245
   11    HZ3  LYS  38           HZ1      LYS  38  23.094  13.759   4.125
   12    HZ2  LYS  38           HZ2      LYS  38  23.596  15.380   4.211
   13    HZ1  LYS  38           HZ3      LYS  38  23.039  14.589   5.605

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ALA  39           H        ALA  39  25.147   8.603   8.935
    2    HA   ALA  39           HA       ALA  39  26.228   7.029   6.860
    3    HB2  ALA  39           HB1      ALA  39  26.165   6.064   9.704
    4    HB1  ALA  39           HB2      ALA  39  27.096   7.502   9.284
    5    HB3  ALA  39           HB3      ALA  39  27.465   5.956   8.518

  No H/Q in entry =           5
  In of MODEL   10
    1    H    MET  40           H        MET  40  23.633   6.378   9.170
    2    HA   MET  40           HA       MET  40  23.224   3.667   8.437
    3    HB2  MET  40           HB2      MET  40  21.386   5.686   9.738
    4    HB3  MET  40           HB3      MET  40  21.001   3.971   9.565
    5    HG2  MET  40           HG2      MET  40  23.544   4.946  10.894
    6    HG3  MET  40           HG3      MET  40  22.057   4.650  11.794
    7    HE3  MET  40           HE1      MET  40  21.544   1.009  11.971
    8    HE2  MET  40           HE2      MET  40  20.654   2.301  11.168
    9    HE1  MET  40           HE3      MET  40  21.398   2.598  12.738

  No H/Q in entry =           9
  In of MODEL   10
    1    H    MET  41           H        MET  41  21.763   6.701   7.257
    2    HA   MET  41           HA       MET  41  19.815   5.480   5.594
    3    HB2  MET  41           HB2      MET  41  21.258   8.090   5.075
    4    HB3  MET  41           HB3      MET  41  19.733   7.576   4.363
    5    HG2  MET  41           HG2      MET  41  19.002   7.377   6.918
    6    HG3  MET  41           HG3      MET  41  20.296   8.552   7.134
    7    HE2  MET  41           HE1      MET  41  19.700   9.833   3.800
    8    HE1  MET  41           HE2      MET  41  20.657  10.285   5.208
    9    HE3  MET  41           HE3      MET  41  19.367  11.347   4.650

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ASP  42           H        ASP  42  23.171   6.450   5.025
    2    HA   ASP  42           HA       ASP  42  23.257   5.978   2.267
    3    HB2  ASP  42           HB2      ASP  42  25.003   6.999   4.029
    4    HB3  ASP  42           HB3      ASP  42  25.682   5.383   3.898

  No H/Q in entry =           4
  In of MODEL   10
    1    H    GLN  43           H        GLN  43  24.024   3.832   4.984
    2    HA   GLN  43           HA       GLN  43  24.712   1.585   3.397
    3    HB2  GLN  43           HB2      GLN  43  23.700   1.753   6.245
    4    HB3  GLN  43           HB3      GLN  43  24.297   0.273   5.487
    5    HG2  GLN  43           HG2      GLN  43  26.440   1.514   4.967
    6    HG3  GLN  43           HG3      GLN  43  25.844   2.832   5.969
    7   HE21  GLN  43          HE21      GLN  43  28.095   1.890   6.995
    8   HE22  GLN  43          HE22      GLN  43  27.842   0.803   8.272

  No H/Q in entry =           8
  In of MODEL   10
    1    H    SER  44           H        SER  44  21.647   2.675   4.797
    2    HA   SER  44           HA       SER  44  20.107   0.411   4.130
    3    HB2  SER  44           HB2      SER  44  19.635   2.933   5.279
    4    HB3  SER  44           HB3      SER  44  18.595   2.876   3.859
    5    HG   SER  44           HG       SER  44  17.523   1.917   5.586

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ARG  45           H        ARG  45  20.800   3.386   2.323
    2    HA   ARG  45           HA       ARG  45  19.271   2.879   0.025
    3    HB2  ARG  45           HB2      ARG  45  20.388   5.031   0.605
    4    HB3  ARG  45           HB3      ARG  45  21.941   4.298   0.212
    5    HG2  ARG  45           HG2      ARG  45  21.152   3.882  -2.099
    6    HG3  ARG  45           HG3      ARG  45  19.611   4.639  -1.705
    7    HD2  ARG  45           HD2      ARG  45  20.835   6.752  -1.126
    8    HD3  ARG  45           HD3      ARG  45  22.339   5.999  -1.701
    9    HE   ARG  45           HE       ARG  45  20.403   5.736  -3.728
   10   HH21  ARG  45          HH11      ARG  45  20.369   7.105  -5.491
   11   HH22  ARG  45          HH12      ARG  45  21.105   8.666  -5.390
   12   HH11  ARG  45          HH21      ARG  45  22.107   8.257  -2.109
   13   HH12  ARG  45          HH22      ARG  45  22.088   9.317  -3.472

  No H/Q in entry =          13
  In of MODEL   10
    1    H    MET  46           H        MET  46  22.650   2.050   0.756
    2    HA   MET  46           HA       MET  46  23.260   0.867  -1.731
    3    HB2  MET  46           HB2      MET  46  24.385   0.536   1.053
    4    HB3  MET  46           HB3      MET  46  25.053  -0.321  -0.341
    5    HG2  MET  46           HG2      MET  46  25.418   1.831  -1.494
    6    HG3  MET  46           HG3      MET  46  24.743   2.690  -0.117
    7    HE2  MET  46           HE1      MET  46  26.760   4.191   0.551
    8    HE1  MET  46           HE2      MET  46  27.272   3.688  -1.056
    9    HE3  MET  46           HE3      MET  46  28.427   3.668   0.274

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ALA  47           H        ALA  47  21.910  -0.485   1.252
    2    HA   ALA  47           HA       ALA  47  21.887  -3.199   0.449
    3    HB2  ALA  47           HB1      ALA  47  21.515  -2.743   2.755
    4    HB3  ALA  47           HB2      ALA  47  19.983  -3.366   2.144
    5    HB1  ALA  47           HB3      ALA  47  20.191  -1.632   2.401

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU  48           H        LEU  48  19.499  -0.602   0.104
    2    HA   LEU  48           HA       LEU  48  17.468  -2.162  -1.136
    3    HB2  LEU  48           HB2      LEU  48  18.084   0.801  -1.254
    4    HB3  LEU  48           HB3      LEU  48  16.618   0.072  -1.912
    5    HG   LEU  48           HG       LEU  48  17.491  -0.219   0.971
    6   HD13  LEU  48          HD11      LEU  48  17.043   2.076   0.787
    7   HD12  LEU  48          HD12      LEU  48  15.496   1.409   1.305
    8   HD11  LEU  48          HD13      LEU  48  15.752   1.834  -0.388
    9   HD22  LEU  48          HD21      LEU  48  15.982  -1.953   0.599
   10   HD21  LEU  48          HD22      LEU  48  15.090  -1.061  -0.634
   11   HD23  LEU  48          HD23      LEU  48  14.882  -0.659   1.070

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ASN  49           H        ASN  49  20.124  -0.200  -2.381
    2    HA   ASN  49           HA       ASN  49  19.459  -0.292  -5.101
    3    HB2  ASN  49           HB2      ASN  49  21.120   1.251  -4.213
    4    HB3  ASN  49           HB3      ASN  49  22.162  -0.087  -3.743
    5   HD21  ASN  49          HD21      ASN  49  20.827   1.619  -6.564
    6   HD22  ASN  49          HD22      ASN  49  22.007   1.077  -7.655

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLU  50           H        GLU  50  21.482  -2.461  -3.150
    2    HA   GLU  50           HA       GLU  50  22.193  -4.209  -5.280
    3    HB2  GLU  50           HB2      GLU  50  23.402  -4.168  -3.120
    4    HB3  GLU  50           HB3      GLU  50  21.972  -4.814  -2.316
    5    HG2  GLU  50           HG2      GLU  50  22.079  -6.846  -3.675
    6    HG3  GLU  50           HG3      GLU  50  23.442  -6.197  -4.584

  No H/Q in entry =           6
  In of MODEL   10
    1    H    ALA  51           H        ALA  51  19.549  -4.175  -2.938
    2    HA   ALA  51           HA       ALA  51  18.409  -6.663  -3.688
    3    HB3  ALA  51           HB1      ALA  51  16.820  -6.176  -2.124
    4    HB1  ALA  51           HB2      ALA  51  16.583  -4.533  -2.721
    5    HB2  ALA  51           HB3      ALA  51  17.953  -4.902  -1.673

  No H/Q in entry =           5
  In of MODEL   10
    1    H    HIS  52           H        HIS  52  17.776  -3.323  -4.721
    2    HA   HIS  52           HA       HIS  52  15.659  -3.876  -6.508
    3    HB2  HIS  52           HB2      HIS  52  16.209  -1.603  -5.751
    4    HB3  HIS  52           HB3      HIS  52  17.738  -1.677  -6.627
    5    HD1  HIS  52           HD1      HIS  52  17.507  -2.005  -9.308
    6    HD2  HIS  52           HD2      HIS  52  14.047  -0.812  -7.310
    7    HE1  HIS  52           HE1      HIS  52  15.930  -1.111 -11.077
    8    HE2  HIS  52           HE2      HIS  52  13.816  -0.380  -9.874

  No H/Q in entry =           8
  In of MODEL   10
    1    H    LEU  53           H        LEU  53  19.175  -3.838  -6.961
    2    HA   LEU  53           HA       LEU  53  19.219  -4.154  -9.762
    3    HB2  LEU  53           HB2      LEU  53  21.173  -4.885  -7.597
    4    HB3  LEU  53           HB3      LEU  53  21.485  -5.279  -9.285
    5    HG   LEU  53           HG       LEU  53  20.795  -2.471  -8.358
    6   HD11  LEU  53          HD11      LEU  53  22.911  -3.370  -7.311
    7   HD13  LEU  53          HD12      LEU  53  23.156  -1.973  -8.358
    8   HD12  LEU  53          HD13      LEU  53  23.549  -3.586  -8.939
    9   HD22  LEU  53          HD21      LEU  53  20.497  -2.525 -10.693
   10   HD21  LEU  53          HD22      LEU  53  21.769  -3.719 -10.922
   11   HD23  LEU  53          HD23      LEU  53  22.187  -2.052 -10.574

  No H/Q in entry =          11
  In of MODEL   10
    1    H    VAL  54           H        VAL  54  19.152  -6.541  -7.134
    2    HA   VAL  54           HA       VAL  54  19.295  -8.835  -8.793
    3    HB   VAL  54           HB       VAL  54  18.151  -8.424  -6.019
    4   HG12  VAL  54          HG11      VAL  54  18.509 -11.037  -6.016
    5   HG11  VAL  54          HG12      VAL  54  18.312 -10.872  -7.760
    6   HG13  VAL  54          HG13      VAL  54  17.023 -10.358  -6.674
    7   HG22  VAL  54          HG21      VAL  54  20.465  -8.184  -5.810
    8   HG21  VAL  54          HG22      VAL  54  20.809  -9.272  -7.153
    9   HG23  VAL  54          HG23      VAL  54  20.296  -9.925  -5.597

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLN  55           H        GLN  55  16.550  -6.966  -7.495
    2    HA   GLN  55           HA       GLN  55  14.544  -8.657  -8.556
    3    HB2  GLN  55           HB2      GLN  55  13.786  -7.140  -6.926
    4    HB3  GLN  55           HB3      GLN  55  14.556  -5.762  -7.708
    5    HG2  GLN  55           HG2      GLN  55  12.819  -5.461  -9.187
    6    HG3  GLN  55           HG3      GLN  55  12.519  -7.186  -9.354
    7   HE21  GLN  55          HE21      GLN  55  10.524  -7.761  -8.537
    8   HE22  GLN  55          HE22      GLN  55   9.748  -7.016  -7.225

  No H/Q in entry =           8
  In of MODEL   10
    1    H    THR  56           H        THR  56  16.238  -5.835  -9.928
    2    HA   THR  56           HA       THR  56  14.782  -5.494 -12.268
    3    HB   THR  56           HB       THR  56  17.800  -5.367 -12.128
    4    HG1  THR  56           HG1      THR  56  15.788  -3.720 -11.083
    5   HG21  THR  56          HG21      THR  56  15.667  -4.107 -13.847
    6   HG23  THR  56          HG22      THR  56  17.092  -5.013 -14.353
    7   HG22  THR  56          HG23      THR  56  17.271  -3.387 -13.694

  No H/Q in entry =           7
  In of MODEL   10
    1    H    LYS  57           H        LYS  57  17.465  -7.755 -11.671
    2    HA   LYS  57           HA       LYS  57  17.467  -8.952 -14.248
    3    HB2  LYS  57           HB2      LYS  57  19.271  -9.179 -12.513
    4    HB3  LYS  57           HB3      LYS  57  18.185 -10.189 -11.569
    5    HG2  LYS  57           HG2      LYS  57  18.081 -11.818 -13.412
    6    HG3  LYS  57           HG3      LYS  57  19.157 -10.813 -14.374
    7    HD2  LYS  57           HD2      LYS  57  20.923 -11.069 -12.655
    8    HD3  LYS  57           HD3      LYS  57  19.851 -12.106 -11.716
    9    HE2  LYS  57           HE2      LYS  57  19.743 -13.706 -13.607
   10    HE3  LYS  57           HE3      LYS  57  20.832 -12.684 -14.541
   11    HZ1  LYS  57           HZ1      LYS  57  21.733 -13.420 -11.881
   12    HZ3  LYS  57           HZ2      LYS  57  22.602 -13.306 -13.335
   13    HZ2  LYS  57           HZ3      LYS  57  21.659 -14.680 -13.013

  No H/Q in entry =          13
  In of MODEL   10
    1    H    LEU  58           H        LEU  58  15.713  -9.641 -11.262
    2    HA   LEU  58           HA       LEU  58  14.519 -12.032 -12.187
    3    HB2  LEU  58           HB2      LEU  58  13.711 -10.135  -9.988
    4    HB3  LEU  58           HB3      LEU  58  12.924 -11.685 -10.298
    5    HG   LEU  58           HG       LEU  58  15.896 -11.365  -9.762
    6   HD11  LEU  58          HD11      LEU  58  13.542 -11.813  -7.954
    7   HD13  LEU  58          HD12      LEU  58  14.983 -10.830  -7.701
    8   HD12  LEU  58          HD13      LEU  58  15.081 -12.585  -7.565
    9   HD22  LEU  58          HD21      LEU  58  15.800 -13.429 -10.787
   10   HD21  LEU  58          HD22      LEU  58  14.092 -13.662 -10.416
   11   HD23  LEU  58          HD23      LEU  58  15.312 -13.945  -9.174

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  59           H        ILE  59  13.797  -8.705 -12.868
    2    HA   ILE  59           HA       ILE  59  11.085  -9.392 -13.791
    3    HB   ILE  59           HB       ILE  59  11.870  -7.097 -12.593
    4   HG12  ILE  59          HG12      ILE  59   9.939  -7.008 -14.923
    5   HG13  ILE  59          HG13      ILE  59   9.546  -7.778 -13.408
    6   HG23  ILE  59          HG21      ILE  59  12.405  -5.368 -14.109
    7   HG22  ILE  59          HG22      ILE  59  11.907  -6.299 -15.504
    8   HG21  ILE  59          HG23      ILE  59  13.403  -6.692 -14.662
    9   HD11  ILE  59          HD11      ILE  59  10.006  -5.670 -12.201
   10   HD13  ILE  59          HD12      ILE  59   8.729  -5.469 -13.398
   11   HD12  ILE  59          HD13      ILE  59  10.359  -4.890 -13.743

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLU  60           H        GLU  60  14.269  -8.497 -15.070
    2    HA   GLU  60           HA       GLU  60  13.467  -8.110 -17.773
    3    HB2  GLU  60           HB2      GLU  60  15.633  -7.330 -16.987
    4    HB3  GLU  60           HB3      GLU  60  16.121  -8.975 -16.595
    5    HG2  GLU  60           HG2      GLU  60  15.275  -8.282 -19.401
    6    HG3  GLU  60           HG3      GLU  60  16.916  -7.940 -18.858

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLY  61           H        GLY  61  14.496 -10.976 -15.962
    2    HA3  GLY  61           HA2      GLY  61  13.963 -12.633 -18.359
    3    HA2  GLY  61           HA3      GLY  61  15.010 -13.099 -17.022

  No H/Q in entry =           3
  In of MODEL   10
    1    H    ASP  62           H        ASP  62  11.870 -11.596 -16.633
    2    HA   ASP  62           HA       ASP  62  10.968 -13.512 -14.778
    3    HB2  ASP  62           HB2      ASP  62   8.803 -12.356 -14.986
    4    HB3  ASP  62           HB3      ASP  62  10.140 -11.225 -14.797

  No H/Q in entry =           4
  In of MODEL   10
    1    H    ALA  63           H        ALA  63  10.453 -13.266 -18.294
    2    HA   ALA  63           HA       ALA  63   8.526 -15.469 -18.299
    3    HB3  ALA  63           HB1      ALA  63   9.818 -13.829 -20.486
    4    HB2  ALA  63           HB2      ALA  63   8.146 -13.763 -19.935
    5    HB1  ALA  63           HB3      ALA  63   8.728 -15.176 -20.814

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLY  64           H        GLY  64   9.084 -17.077 -20.254
    2    HA3  GLY  64           HA2      GLY  64  11.160 -18.192 -21.222
    3    HA2  GLY  64           HA3      GLY  64  11.681 -18.287 -19.545

  No H/Q in entry =           3
  In of MODEL   10
    1    H    GLU  65           H        GLU  65   9.323 -19.042 -18.275
    2    HA   GLU  65           HA       GLU  65   9.323 -21.822 -18.785
    3    HB2  GLU  65           HB2      GLU  65   7.455 -20.131 -17.125
    4    HB3  GLU  65           HB3      GLU  65   7.460 -21.895 -17.132
    5    HG2  GLU  65           HG2      GLU  65   9.869 -20.181 -16.473
    6    HG3  GLU  65           HG3      GLU  65   8.819 -20.925 -15.269

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLY  66           H        GLY  66   7.151 -19.272 -19.691
    2    HA3  GLY  66           HA2      GLY  66   6.047 -20.720 -21.879
    3    HA2  GLY  66           HA3      GLY  66   4.895 -20.578 -20.567

  No H/Q in entry =           3
  In of MODEL   10
    1    H    LYS  67           H        LYS  67   3.503 -19.374 -21.851
    2    HA   LYS  67           HA       LYS  67   3.971 -17.223 -23.441
    3    HB2  LYS  67           HB2      LYS  67   1.656 -16.573 -23.050
    4    HB3  LYS  67           HB3      LYS  67   1.794 -18.334 -23.138
    5    HG2  LYS  67           HG2      LYS  67   1.903 -18.436 -20.663
    6    HG3  LYS  67           HG3      LYS  67   1.712 -16.686 -20.591
    7    HD2  LYS  67           HD2      LYS  67  -0.487 -16.875 -21.688
    8    HD3  LYS  67           HD3      LYS  67  -0.297 -18.628 -21.769
    9    HE2  LYS  67           HE2      LYS  67  -0.155 -18.735 -19.311
   10    HE3  LYS  67           HE3      LYS  67  -0.329 -16.983 -19.220
   11    HZ3  LYS  67           HZ1      LYS  67  -2.441 -18.048 -18.848
   12    HZ2  LYS  67           HZ2      LYS  67  -2.322 -18.888 -20.319
   13    HZ1  LYS  67           HZ3      LYS  67  -2.488 -17.196 -20.313

  No H/Q in entry =          13
  In of MODEL   10
    1    H    MET  68           H        MET  68   2.555 -15.073 -22.599
    2    HA   MET  68           HA       MET  68   4.421 -13.325 -21.599
    3    HB2  MET  68           HB2      MET  68   1.410 -13.204 -21.536
    4    HB3  MET  68           HB3      MET  68   2.445 -11.844 -21.104
    5    HG2  MET  68           HG2      MET  68   3.516 -11.954 -23.329
    6    HG3  MET  68           HG3      MET  68   2.461 -13.299 -23.764
    7    HE3  MET  68           HE1      MET  68   1.181 -10.391 -25.908
    8    HE2  MET  68           HE2      MET  68   1.080 -12.149 -25.871
    9    HE1  MET  68           HE3      MET  68   2.634 -11.357 -25.621

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LYS  69           H        LYS  69   3.020 -15.734 -19.718
    2    HA   LYS  69           HA       LYS  69   2.517 -14.378 -17.301
    3    HB2  LYS  69           HB2      LYS  69   1.845 -16.758 -18.049
    4    HB3  LYS  69           HB3      LYS  69   3.401 -17.240 -17.368
    5    HG2  LYS  69           HG2      LYS  69   2.815 -16.257 -15.215
    6    HG3  LYS  69           HG3      LYS  69   1.301 -15.642 -15.879
    7    HD2  LYS  69           HD2      LYS  69   0.534 -17.941 -16.294
    8    HD3  LYS  69           HD3      LYS  69   2.055 -18.571 -15.658
    9    HE2  LYS  69           HE2      LYS  69   1.583 -17.520 -13.476
   10    HE3  LYS  69           HE3      LYS  69   0.064 -16.888 -14.109
   11    HZ3  LYS  69           HZ1      LYS  69  -0.924 -18.826 -13.773
   12    HZ2  LYS  69           HZ2      LYS  69   0.458 -19.332 -12.926
   13    HZ1  LYS  69           HZ3      LYS  69   0.297 -19.682 -14.580

  No H/Q in entry =          13
  In of MODEL   10
    1    H    VAL  70           H        VAL  70   3.629 -14.148 -15.347
    2    HA   VAL  70           HA       VAL  70   6.572 -14.514 -15.471
    3    HB   VAL  70           HB       VAL  70   6.723 -12.464 -14.062
    4   HG12  VAL  70          HG11      VAL  70   5.241 -12.081 -16.681
    5   HG11  VAL  70          HG12      VAL  70   6.976 -12.361 -16.529
    6   HG13  VAL  70          HG13      VAL  70   6.262 -10.882 -15.888
    7   HG22  VAL  70          HG21      VAL  70   4.517 -12.464 -13.026
    8   HG21  VAL  70          HG22      VAL  70   3.738 -12.366 -14.604
    9   HG23  VAL  70          HG23      VAL  70   4.657 -10.992 -13.989

  No H/Q in entry =           9
  In of MODEL   10
    1    H    SER  71           H        SER  71   7.571 -14.614 -13.287
    2    HA   SER  71           HA       SER  71   6.443 -16.641 -11.672
    3    HB2  SER  71           HB2      SER  71   8.874 -16.140 -11.775
    4    HB3  SER  71           HB3      SER  71   8.579 -14.622 -10.932
    5    HG   SER  71           HG       SER  71   9.010 -16.943  -9.854

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU  72           H        LEU  72   5.096 -16.560  -9.966
    2    HA   LEU  72           HA       LEU  72   3.517 -14.268  -9.514
    3    HB2  LEU  72           HB2      LEU  72   3.848 -16.821  -7.948
    4    HB3  LEU  72           HB3      LEU  72   2.667 -15.580  -7.536
    5    HG   LEU  72           HG       LEU  72   2.820 -16.867 -10.281
    6   HD11  LEU  72          HD11      LEU  72   2.321 -18.564  -8.546
    7   HD13  LEU  72          HD12      LEU  72   0.915 -18.250  -9.562
    8   HD12  LEU  72          HD13      LEU  72   1.008 -17.551  -7.946
    9   HD21  LEU  72          HD21      LEU  72   0.931 -14.989  -8.878
   10   HD23  LEU  72          HD22      LEU  72   0.298 -16.065 -10.112
   11   HD22  LEU  72          HD23      LEU  72   1.554 -14.901 -10.521

  No H/Q in entry =          11
  In of MODEL   10
    1    H    VAL  73           H        VAL  73   6.202 -15.667  -7.755
    2    HA   VAL  73           HA       VAL  73   6.133 -14.135  -5.423
    3    HB   VAL  73           HB       VAL  73   8.335 -14.908  -5.011
    4   HG11  VAL  73          HG11      VAL  73   6.443 -16.619  -5.247
    5   HG13  VAL  73          HG12      VAL  73   8.086 -17.254  -5.348
    6   HG12  VAL  73          HG13      VAL  73   7.140 -17.016  -6.816
    7   HG23  VAL  73          HG21      VAL  73   9.492 -16.089  -7.080
    8   HG22  VAL  73          HG22      VAL  73   9.652 -14.349  -6.844
    9   HG21  VAL  73          HG23      VAL  73   8.483 -14.977  -8.006

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LEU  74           H        LEU  74   7.094 -13.228  -8.604
    2    HA   LEU  74           HA       LEU  74   9.014 -11.253  -8.122
    3    HB2  LEU  74           HB2      LEU  74   8.555 -12.011 -10.358
    4    HB3  LEU  74           HB3      LEU  74   6.884 -11.460 -10.249
    5    HG   LEU  74           HG       LEU  74   7.665  -9.126 -10.044
    6   HD13  LEU  74          HD11      LEU  74   9.782  -9.287  -8.989
    7   HD12  LEU  74          HD12      LEU  74  10.162  -8.805 -10.641
    8   HD11  LEU  74          HD13      LEU  74  10.360 -10.485 -10.145
    9   HD23  LEU  74          HD21      LEU  74   9.161 -10.180 -12.379
   10   HD22  LEU  74          HD22      LEU  74   7.962  -8.910 -12.279
   11   HD21  LEU  74          HD23      LEU  74   7.450 -10.582 -12.263

  No H/Q in entry =          11
  In of MODEL   10
    1    H    VAL  75           H        VAL  75   5.512 -10.916  -8.458
    2    HA   VAL  75           HA       VAL  75   5.381  -8.161  -7.871
    3    HB   VAL  75           HB       VAL  75   3.323 -10.333  -7.474
    4   HG11  VAL  75          HG11      VAL  75   3.099  -7.295  -7.307
    5   HG13  VAL  75          HG12      VAL  75   2.808  -8.441  -6.006
    6   HG12  VAL  75          HG13      VAL  75   1.723  -8.391  -7.386
    7   HG21  VAL  75          HG21      VAL  75   4.142  -9.845  -9.807
    8   HG23  VAL  75          HG22      VAL  75   3.617  -8.177  -9.591
    9   HG22  VAL  75          HG23      VAL  75   2.432  -9.483  -9.575

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLU  76           H        GLU  76   5.177 -11.041  -5.760
    2    HA   GLU  76           HA       GLU  76   4.699  -9.686  -3.337
    3    HB2  GLU  76           HB2      GLU  76   4.557 -12.154  -3.568
    4    HB3  GLU  76           HB3      GLU  76   6.292 -12.230  -3.818
    5    HG2  GLU  76           HG2      GLU  76   5.871 -12.816  -1.517
    6    HG3  GLU  76           HG3      GLU  76   6.597 -11.220  -1.511

  No H/Q in entry =           6
  In of MODEL   10
    1    H    ALA  77           H        ALA  77   7.764 -10.551  -4.913
    2    HA   ALA  77           HA       ALA  77   9.448  -9.485  -2.905
    3    HB3  ALA  77           HB1      ALA  77   9.985  -9.768  -5.872
    4    HB1  ALA  77           HB2      ALA  77  10.251 -11.019  -4.658
    5    HB2  ALA  77           HB3      ALA  77  11.204  -9.536  -4.619

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLN  78           H        GLN  78   8.024  -8.087  -5.813
    2    HA   GLN  78           HA       GLN  78   9.344  -5.590  -5.715
    3    HB2  GLN  78           HB2      GLN  78   7.987  -6.593  -7.638
    4    HB3  GLN  78           HB3      GLN  78   6.549  -6.067  -6.766
    5    HG2  GLN  78           HG2      GLN  78   7.251  -3.762  -6.863
    6    HG3  GLN  78           HG3      GLN  78   8.816  -4.215  -7.536
    7   HE21  GLN  78          HE21      GLN  78   8.376  -5.816  -9.628
    8   HE22  GLN  78          HE22      GLN  78   7.281  -5.152 -10.742

  No H/Q in entry =           8
  In of MODEL   10
    1    H    LEU  79           H        LEU  79   6.346  -6.767  -4.272
    2    HA   LEU  79           HA       LEU  79   5.325  -4.373  -3.260
    3    HB2  LEU  79           HB2      LEU  79   4.037  -6.441  -3.198
    4    HB3  LEU  79           HB3      LEU  79   5.196  -7.165  -2.087
    5    HG   LEU  79           HG       LEU  79   4.629  -5.530  -0.359
    6   HD13  LEU  79          HD11      LEU  79   4.133  -3.522  -1.408
    7   HD12  LEU  79          HD12      LEU  79   2.517  -4.069  -0.962
    8   HD11  LEU  79          HD13      LEU  79   3.094  -4.284  -2.613
    9   HD23  LEU  79          HD21      LEU  79   2.050  -6.056  -0.258
   10   HD22  LEU  79          HD22      LEU  79   3.207  -7.380  -0.154
   11   HD21  LEU  79          HD23      LEU  79   2.383  -7.054  -1.676

  No H/Q in entry =          11
  In of MODEL   10
    1    H    HIS  80           H        HIS  80   7.543  -6.679  -1.685
    2    HA   HIS  80           HA       HIS  80   7.820  -5.133   0.683
    3    HB2  HIS  80           HB2      HIS  80   9.184  -7.480  -0.520
    4    HB3  HIS  80           HB3      HIS  80  10.088  -6.571   0.693
    5    HD1  HIS  80           HD1      HIS  80   9.614  -7.213   3.038
    6    HD2  HIS  80           HD2      HIS  80   6.399  -8.105   0.537
    7    HE1  HIS  80           HE1      HIS  80   7.862  -8.338   4.493
    8    HE2  HIS  80           HE2      HIS  80   5.896  -8.886   2.977

  No H/Q in entry =           8
  In of MODEL   10
    1    H    LEU  81           H        LEU  81   9.819  -5.384  -2.237
    2    HA   LEU  81           HA       LEU  81  11.844  -3.617  -1.366
    3    HB2  LEU  81           HB2      LEU  81  10.923  -4.422  -4.125
    4    HB3  LEU  81           HB3      LEU  81  12.331  -3.398  -3.840
    5    HG   LEU  81           HG       LEU  81  11.977  -6.124  -2.565
    6   HD12  LEU  81          HD11      LEU  81  13.795  -6.728  -4.320
    7   HD11  LEU  81          HD12      LEU  81  13.208  -5.311  -5.190
    8   HD13  LEU  81          HD13      LEU  81  12.114  -6.649  -4.848
    9   HD23  LEU  81          HD21      LEU  81  14.601  -5.776  -2.560
   10   HD22  LEU  81          HD22      LEU  81  13.614  -5.028  -1.306
   11   HD21  LEU  81          HD23      LEU  81  14.176  -4.069  -2.675

  No H/Q in entry =          11
  In of MODEL   10
    1    H    MET  82           H        MET  82   8.907  -3.017  -3.293
    2    HA   MET  82           HA       MET  82   9.412  -0.285  -3.796
    3    HB2  MET  82           HB2      MET  82   6.872  -1.910  -3.662
    4    HB3  MET  82           HB3      MET  82   6.850  -0.186  -4.026
    5    HG2  MET  82           HG2      MET  82   8.470  -2.240  -5.567
    6    HG3  MET  82           HG3      MET  82   6.894  -1.637  -6.074
    7    HE3  MET  82           HE1      MET  82   7.297   1.823  -7.248
    8    HE2  MET  82           HE2      MET  82   6.931   1.593  -5.540
    9    HE1  MET  82           HE3      MET  82   6.275   0.475  -6.732

  No H/Q in entry =           9
  In of MODEL   10
    1    H    THR  83           H        THR  83   7.648  -1.904  -1.184
    2    HA   THR  83           HA       THR  83   6.774   0.434   0.144
    3    HB   THR  83           HB       THR  83   6.664  -1.141   2.163
    4    HG1  THR  83           HG1      THR  83   7.444  -3.082   1.931
    5   HG22  THR  83          HG21      THR  83   5.025  -2.727   0.701
    6   HG21  THR  83          HG22      THR  83   5.232  -1.396  -0.432
    7   HG23  THR  83          HG23      THR  83   4.593  -1.088   1.183

  No H/Q in entry =           7
  In of MODEL   10
    1    H    SER  84           H        SER  84   9.623  -1.630   0.656
    2    HA   SER  84           HA       SER  84  10.673  -0.187   2.841
    3    HB2  SER  84           HB2      SER  84  11.941  -2.016   0.812
    4    HB3  SER  84           HB3      SER  84  12.883  -1.251   2.090
    5    HG   SER  84           HG       SER  84  10.629  -2.967   2.358

  No H/Q in entry =           5
  In of MODEL   10
    1    H    MET  85           H        MET  85  11.412   0.082  -0.650
    2    HA   MET  85           HA       MET  85  13.388   2.070  -0.406
    3    HB2  MET  85           HB2      MET  85  13.001   0.783  -2.470
    4    HB3  MET  85           HB3      MET  85  11.463   1.618  -2.694
    5    HG2  MET  85           HG2      MET  85  12.641   3.780  -2.814
    6    HG3  MET  85           HG3      MET  85  14.179   2.958  -2.569
    7    HE2  MET  85           HE1      MET  85  11.596   3.162  -6.323
    8    HE1  MET  85           HE2      MET  85  11.610   4.229  -4.921
    9    HE3  MET  85           HE3      MET  85  10.908   2.621  -4.784

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LEU  86           H        LEU  86   9.893   2.365  -0.903
    2    HA   LEU  86           HA       LEU  86   9.797   5.177  -1.085
    3    HB2  LEU  86           HB2      LEU  86   7.970   3.496  -1.655
    4    HB3  LEU  86           HB3      LEU  86   7.647   3.403   0.076
    5    HG   LEU  86           HG       LEU  86   7.457   5.962   0.024
    6   HD11  LEU  86          HD11      LEU  86   8.229   5.534  -2.681
    7   HD13  LEU  86          HD12      LEU  86   7.778   7.057  -1.919
    8   HD12  LEU  86          HD13      LEU  86   6.550   6.080  -2.720
    9   HD23  LEU  86          HD21      LEU  86   5.333   4.586  -1.631
   10   HD22  LEU  86          HD22      LEU  86   5.133   5.843  -0.415
   11   HD21  LEU  86          HD23      LEU  86   5.552   4.204   0.077

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ALA  87           H        ALA  87   9.364   2.994   1.663
    2    HA   ALA  87           HA       ALA  87   8.802   4.902   3.633
    3    HB1  ALA  87           HB1      ALA  87   9.639   2.091   3.545
    4    HB3  ALA  87           HB2      ALA  87   8.509   2.891   4.634
    5    HB2  ALA  87           HB3      ALA  87  10.238   2.941   4.972

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ARG  88           H        ARG  88  11.897   3.511   2.643
    2    HA   ARG  88           HA       ARG  88  13.498   4.907   4.469
    3    HB2  ARG  88           HB2      ARG  88  14.183   2.941   3.064
    4    HB3  ARG  88           HB3      ARG  88  14.319   4.035   1.690
    5    HG2  ARG  88           HG2      ARG  88  15.784   5.365   3.631
    6    HG3  ARG  88           HG3      ARG  88  16.124   3.680   4.009
    7    HD2  ARG  88           HD2      ARG  88  17.388   3.397   2.158
    8    HD3  ARG  88           HD3      ARG  88  16.238   4.255   1.129
    9    HE   ARG  88           HE       ARG  88  18.625   5.345   2.168
   10   HH21  ARG  88          HH11      ARG  88  18.945   7.568   1.971
   11   HH22  ARG  88          HH12      ARG  88  17.582   8.625   1.833
   12   HH11  ARG  88          HH21      ARG  88  15.277   6.062   1.901
   13   HH12  ARG  88          HH22      ARG  88  15.503   7.769   1.768

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLU  89           H        GLU  89  12.503   5.794   1.149
    2    HA   GLU  89           HA       GLU  89  14.023   8.171   0.987
    3    HB2  GLU  89           HB2      GLU  89  12.884   7.117  -0.957
    4    HB3  GLU  89           HB3      GLU  89  11.336   7.641  -0.293
    5    HG2  GLU  89           HG2      GLU  89  12.011   9.986  -0.459
    6    HG3  GLU  89           HG3      GLU  89  13.618   9.513  -1.001

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LEU  90           H        LEU  90  10.704   7.625   2.129
    2    HA   LEU  90           HA       LEU  90  10.161  10.353   2.705
    3    HB2  LEU  90           HB2      LEU  90   8.998   7.766   3.737
    4    HB3  LEU  90           HB3      LEU  90   8.352   9.355   4.162
    5    HG   LEU  90           HG       LEU  90   8.769   8.479   1.292
    6   HD12  LEU  90          HD11      LEU  90   6.239   8.123   1.364
    7   HD11  LEU  90          HD12      LEU  90   6.401   8.114   3.120
    8   HD13  LEU  90          HD13      LEU  90   7.229   6.893   2.152
    9   HD22  LEU  90          HD21      LEU  90   8.450  10.784   1.219
   10   HD21  LEU  90          HD22      LEU  90   7.468  10.805   2.683
   11   HD23  LEU  90          HD23      LEU  90   6.772  10.243   1.164

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  91           H        ILE  91  11.460   7.686   4.623
    2    HA   ILE  91           HA       ILE  91  11.595   9.052   7.091
    3    HB   ILE  91           HB       ILE  91  13.170   6.731   5.962
    4   HG12  ILE  91          HG12      ILE  91  11.161   6.877   8.229
    5   HG13  ILE  91          HG13      ILE  91  10.687   6.590   6.555
    6   HG22  ILE  91          HG21      ILE  91  13.652   6.523   8.601
    7   HG21  ILE  91          HG22      ILE  91  13.557   8.281   8.500
    8   HG23  ILE  91          HG23      ILE  91  14.741   7.406   7.531
    9   HD13  ILE  91          HD11      ILE  91  11.712   4.499   6.481
   10   HD12  ILE  91          HD12      ILE  91  11.125   4.552   8.143
   11   HD11  ILE  91          HD13      ILE  91  12.821   4.883   7.799

  No H/Q in entry =          11
  In of MODEL   10
    1    H    THR  92           H        THR  92  13.803   8.907   4.331
    2    HA   THR  92           HA       THR  92  15.958  10.324   5.482
    3    HB   THR  92           HB       THR  92  14.962  10.188   2.625
    4    HG1  THR  92           HG1      THR  92  15.816   8.300   3.027
    5   HG22  THR  92          HG21      THR  92  17.523  10.906   2.322
    6   HG21  THR  92          HG22      THR  92  17.212  11.724   3.852
    7   HG23  THR  92          HG23      THR  92  16.232  12.101   2.435

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLU  93           H        GLU  93  13.052  11.446   3.764
    2    HA   GLU  93           HA       GLU  93  13.616  14.213   3.875
    3    HB2  GLU  93           HB2      GLU  93  10.927  12.810   3.900
    4    HB3  GLU  93           HB3      GLU  93  11.195  14.513   3.527
    5    HG2  GLU  93           HG2      GLU  93  12.552  12.285   1.994
    6    HG3  GLU  93           HG3      GLU  93  10.996  12.951   1.513

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LEU  94           H        LEU  94  11.906  12.038   6.093
    2    HA   LEU  94           HA       LEU  94  11.082  13.975   7.973
    3    HB2  LEU  94           HB2      LEU  94  11.692  11.027   8.245
    4    HB3  LEU  94           HB3      LEU  94  11.114  11.996   9.597
    5    HG   LEU  94           HG       LEU  94   9.620  12.031   6.974
    6   HD11  LEU  94          HD11      LEU  94   9.735   9.812   8.978
    7   HD13  LEU  94          HD12      LEU  94   9.427   9.747   7.245
    8   HD12  LEU  94          HD13      LEU  94   8.147  10.250   8.348
    9   HD23  LEU  94          HD21      LEU  94   7.702  12.410   8.582
   10   HD22  LEU  94          HD22      LEU  94   8.927  13.678   8.614
   11   HD21  LEU  94          HD23      LEU  94   8.883  12.461   9.888

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  95           H        ILE  95  14.076  12.079   7.724
    2    HA   ILE  95           HA       ILE  95  15.243  13.014  10.133
    3    HB   ILE  95           HB       ILE  95  16.484  11.958   7.581
    4   HG12  ILE  95          HG12      ILE  95  16.212  10.755  10.349
    5   HG13  ILE  95          HG13      ILE  95  15.043  10.483   9.059
    6   HG21  ILE  95          HG21      ILE  95  17.740  12.779  10.218
    7   HG23  ILE  95          HG22      ILE  95  18.191  13.312   8.597
    8   HG22  ILE  95          HG23      ILE  95  18.517  11.656   9.104
    9   HD13  ILE  95          HD11      ILE  95  16.532   9.221   7.790
   10   HD12  ILE  95          HD12      ILE  95  17.016   8.778   9.424
   11   HD11  ILE  95          HD13      ILE  95  17.953   9.967   8.521

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLU  96           H        GLU  96  15.371  14.249   6.798
    2    HA   GLU  96           HA       GLU  96  17.196  16.347   7.267
    3    HB2  GLU  96           HB2      GLU  96  16.530  15.678   5.011
    4    HB3  GLU  96           HB3      GLU  96  14.882  16.216   5.318
    5    HG2  GLU  96           HG2      GLU  96  15.423  18.352   4.773
    6    HG3  GLU  96           HG3      GLU  96  16.726  18.367   5.950

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LEU  97           H        LEU  97  13.689  16.122   7.711
    2    HA   LEU  97           HA       LEU  97  13.245  18.851   8.354
    3    HB2  LEU  97           HB2      LEU  97  11.757  16.309   8.975
    4    HB3  LEU  97           HB3      LEU  97  11.230  17.850   9.648
    5    HG   LEU  97           HG       LEU  97  11.706  17.439   6.681
    6   HD12  LEU  97          HD11      LEU  97   9.183  17.284   6.574
    7   HD11  LEU  97          HD12      LEU  97   9.186  17.084   8.324
    8   HD13  LEU  97          HD13      LEU  97   9.976  15.885   7.299
    9   HD23  LEU  97          HD21      LEU  97   9.946  19.384   6.721
   10   HD22  LEU  97          HD22      LEU  97  11.625  19.762   7.107
   11   HD21  LEU  97          HD23      LEU  97  10.444  19.579   8.401

  No H/Q in entry =          11
  In of MODEL   10
    1    H    HIS  98           H        HIS  98  14.106  16.034  10.347
    2    HA   HIS  98           HA       HIS  98  13.945  17.294  12.863
    3    HB2  HIS  98           HB2      HIS  98  15.715  15.055  11.855
    4    HB3  HIS  98           HB3      HIS  98  15.715  15.594  13.536
    5    HD1  HIS  98           HD1      HIS  98  13.522  13.940  10.953
    6    HD2  HIS  98           HD2      HIS  98  13.422  14.859  15.018
    7    HE1  HIS  98           HE1      HIS  98  11.515  12.724  11.914
    8    HE2  HIS  98           HE2      HIS  98  11.434  13.275  14.385

  No H/Q in entry =           8
  In of MODEL   10
    1    H    GLU  99           H        GLU  99  16.489  17.206  10.418
    2    HA   GLU  99           HA       GLU  99  18.467  18.559  11.939
    3    HB2  GLU  99           HB2      GLU  99  18.951  17.276   9.868
    4    HB3  GLU  99           HB3      GLU  99  18.124  18.523   8.930
    5    HG2  GLU  99           HG2      GLU  99  19.717  20.210   9.714
    6    HG3  GLU  99           HG3      GLU  99  20.514  19.017  10.734

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LYS 100           H        LYS 100  15.921  19.694   9.733
    2    HA   LYS 100           HA       LYS 100  16.690  22.440   9.874
    3    HB2  LYS 100           HB2      LYS 100  14.068  21.123   9.130
    4    HB3  LYS 100           HB3      LYS 100  14.349  22.864   9.038
    5    HG2  LYS 100           HG2      LYS 100  16.319  22.437   7.563
    6    HG3  LYS 100           HG3      LYS 100  15.924  20.715   7.583
    7    HD2  LYS 100           HD2      LYS 100  13.719  21.202   6.592
    8    HD3  LYS 100           HD3      LYS 100  14.098  22.925   6.580
    9    HE2  LYS 100           HE2      LYS 100  16.056  22.465   5.112
   10    HE3  LYS 100           HE3      LYS 100  15.608  20.755   5.080
   11    HZ1  LYS 100           HZ1      LYS 100  13.757  22.929   4.253
   12    HZ3  LYS 100           HZ2      LYS 100  13.589  21.257   3.992
   13    HZ2  LYS 100           HZ3      LYS 100  14.787  22.132   3.165

  No H/Q in entry =          13
  In of MODEL   10
    1    H    LEU 101           H        LEU 101  14.623  20.372  11.848
    2    HA   LEU 101           HA       LEU 101  13.442  22.428  13.431
    3    HB2  LEU 101           HB2      LEU 101  13.916  19.483  13.813
    4    HB3  LEU 101           HB3      LEU 101  13.376  20.458  15.176
    5    HG   LEU 101           HG       LEU 101  11.946  20.531  12.513
    6   HD12  LEU 101          HD11      LEU 101  10.308  18.950  13.789
    7   HD11  LEU 101          HD12      LEU 101  11.711  18.552  14.778
    8   HD13  LEU 101          HD13      LEU 101  11.740  18.246  13.040
    9   HD21  LEU 101          HD21      LEU 101  11.293  21.317  15.368
   10   HD23  LEU 101          HD22      LEU 101  10.029  21.079  14.163
   11   HD22  LEU 101          HD23      LEU 101  11.250  22.327  13.920

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LYS 102           H        LYS 102  16.593  21.852  12.981
    2    HA   LYS 102           HA       LYS 102  18.435  22.742  14.046
    3    HB2  LYS 102           HB2      LYS 102  16.611  24.238  15.187
    4    HB3  LYS 102           HB3      LYS 102  16.835  23.178  16.563
    5    HG2  LYS 102           HG2      LYS 102  18.702  25.208  15.385
    6    HG3  LYS 102           HG3      LYS 102  18.331  24.890  17.066
    7    HD2  LYS 102           HD2      LYS 102  20.010  22.994  15.373
    8    HD3  LYS 102           HD3      LYS 102  20.690  24.323  16.303
    9    HE2  LYS 102           HE2      LYS 102  20.321  21.771  17.273
   10    HE3  LYS 102           HE3      LYS 102  20.530  23.215  18.263
   11    HZ2  LYS 102           HZ1      LYS 102  18.577  21.911  18.890
   12    HZ1  LYS 102           HZ2      LYS 102  17.924  22.134  17.344
   13    HZ3  LYS 102           HZ3      LYS 102  18.145  23.466  18.369

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ALA 103           H        ALA 103  16.391  21.116  16.476
    2    HA   ALA 103           HA       ALA 103  18.137  19.922  18.124
    3    HB2  ALA 103           HB1      ALA 103  16.573  17.899  18.124
    4    HB1  ALA 103           HB2      ALA 103  15.663  18.743  16.871
    5    HB3  ALA 103           HB3      ALA 103  15.841  19.466  18.469

  No H/Q in entry =           5
  In of MODEL   10
    1    H1   ALA   1           H3       ALA   1  -1.692  -7.127 -21.414
    2    H2   ALA   1           H2       ALA   1  -2.471  -8.570 -20.958
    3    H3   ALA   1           H1       ALA   1  -0.865  -8.604 -21.520
    4    HA   ALA   1           HA       ALA   1  -1.702  -9.081 -23.512
    5    HB1  ALA   1           HB1      ALA   1  -3.830  -9.820 -23.030
    6    HB2  ALA   1           HB2      ALA   1  -4.287  -8.314 -23.825
    7    HB3  ALA   1           HB3      ALA   1  -4.218  -8.394 -22.067

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLU   2           H        GLU   2  -2.552  -7.899 -25.498
    2    HA   GLU   2           HA       GLU   2  -1.176  -5.871 -26.381
    3    HB2  GLU   2           HB2      GLU   2  -4.184  -5.967 -26.686
    4    HB3  GLU   2           HB3      GLU   2  -3.076  -5.093 -27.740
    5    HG2  GLU   2           HG2      GLU   2  -2.559  -6.978 -28.898
    6    HG3  GLU   2           HG3      GLU   2  -2.247  -7.881 -27.421

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLU   3           H        GLU   3  -4.345  -4.645 -25.467
    2    HA   GLU   3           HA       GLU   3  -3.320  -2.079 -24.843
    3    HB2  GLU   3           HB2      GLU   3  -5.994  -3.419 -24.500
    4    HB3  GLU   3           HB3      GLU   3  -5.709  -1.802 -23.854
    5    HG2  GLU   3           HG2      GLU   3  -5.370  -0.871 -25.982
    6    HG3  GLU   3           HG3      GLU   3  -4.963  -2.422 -26.708

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LEU   4           H        LEU   4  -4.879  -4.454 -22.657
    2    HA   LEU   4           HA       LEU   4  -4.517  -3.223 -20.267
    3    HB2  LEU   4           HB2      LEU   4  -3.948  -6.158 -20.740
    4    HB3  LEU   4           HB3      LEU   4  -4.354  -5.416 -19.194
    5    HG   LEU   4           HG       LEU   4  -6.136  -5.506 -21.651
    6   HD13  LEU   4          HD11      LEU   4  -7.309  -7.235 -20.649
    7   HD12  LEU   4          HD12      LEU   4  -6.822  -6.772 -19.020
    8   HD11  LEU   4          HD13      LEU   4  -5.682  -7.604 -20.076
    9   HD23  LEU   4          HD21      LEU   4  -7.821  -4.712 -19.776
   10   HD22  LEU   4          HD22      LEU   4  -6.797  -3.530 -20.591
   11   HD21  LEU   4          HD23      LEU   4  -6.359  -4.117 -18.987

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLU   5           H        GLU   5  -2.008  -5.041 -22.009
    2    HA   GLU   5           HA       GLU   5  -0.019  -4.739 -19.980
    3    HB2  GLU   5           HB2      GLU   5   0.058  -6.509 -21.730
    4    HB3  GLU   5           HB3      GLU   5   0.349  -5.263 -22.944
    5    HG2  GLU   5           HG2      GLU   5   2.410  -4.593 -21.782
    6    HG3  GLU   5           HG3      GLU   5   2.121  -5.814 -20.544

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLU   6           H        GLU   6  -0.683  -3.031 -23.022
    2    HA   GLU   6           HA       GLU   6   1.471  -1.179 -22.762
    3    HB2  GLU   6           HB2      GLU   6   0.288  -1.702 -24.909
    4    HB3  GLU   6           HB3      GLU   6  -1.115  -0.829 -24.295
    5    HG2  GLU   6           HG2      GLU   6   0.071   0.770 -25.586
    6    HG3  GLU   6           HG3      GLU   6   0.487   1.144 -23.916

  No H/Q in entry =           6
  In of MODEL   10
    1    H    VAL   7           H        VAL   7  -1.863  -1.282 -21.704
    2    HA   VAL   7           HA       VAL   7  -2.106   1.428 -20.865
    3    HB   VAL   7           HB       VAL   7  -3.541  -1.104 -20.024
    4   HG11  VAL   7          HG11      VAL   7  -3.940   1.781 -19.207
    5   HG13  VAL   7          HG12      VAL   7  -3.823   0.357 -18.173
    6   HG12  VAL   7          HG13      VAL   7  -5.262   0.613 -19.159
    7   HG21  VAL   7          HG21      VAL   7  -3.718  -0.028 -22.411
    8   HG23  VAL   7          HG22      VAL   7  -4.672   1.211 -21.595
    9   HG22  VAL   7          HG23      VAL   7  -5.202  -0.471 -21.567

  No H/Q in entry =           9
  In of MODEL   10
    1    H    VAL   8           H        VAL   8  -1.084  -1.548 -19.227
    2    HA   VAL   8           HA       VAL   8  -0.765  -0.467 -16.633
    3    HB   VAL   8           HB       VAL   8   0.657  -2.768 -17.995
    4   HG12  VAL   8          HG11      VAL   8   1.011  -3.405 -15.486
    5   HG11  VAL   8          HG12      VAL   8   0.762  -1.685 -15.184
    6   HG13  VAL   8          HG13      VAL   8   2.090  -2.216 -16.217
    7   HG22  VAL   8          HG21      VAL   8  -1.110  -4.094 -17.324
    8   HG21  VAL   8          HG22      VAL   8  -1.993  -2.571 -17.282
    9   HG23  VAL   8          HG23      VAL   8  -1.305  -3.226 -15.800

  No H/Q in entry =           9
  In of MODEL   10
    1    H    MET   9           H        MET   9   1.475  -0.745 -19.389
    2    HA   MET   9           HA       MET   9   3.757   0.318 -18.137
    3    HB2  MET   9           HB2      MET   9   2.790   0.273 -20.987
    4    HB3  MET   9           HB3      MET   9   4.257   1.150 -20.552
    5    HG2  MET   9           HG2      MET   9   4.985  -1.027 -19.370
    6    HG3  MET   9           HG3      MET   9   3.694  -1.804 -20.289
    7    HE2  MET   9           HE1      MET   9   3.577  -0.429 -23.078
    8    HE1  MET   9           HE2      MET   9   3.520  -2.129 -22.620
    9    HE3  MET   9           HE3      MET   9   4.615  -1.604 -23.895

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLY  10           H        GLY  10   1.051   1.897 -19.803
    2    HA3  GLY  10           HA2      GLY  10   1.992   4.558 -19.561
    3    HA2  GLY  10           HA3      GLY  10   0.306   4.084 -19.759

  No H/Q in entry =           3
  In of MODEL   10
    1    H    LEU  11           H        LEU  11  -0.070   2.552 -17.472
    2    HA   LEU  11           HA       LEU  11  -0.609   4.524 -15.509
    3    HB2  LEU  11           HB2      LEU  11  -0.515   1.509 -15.354
    4    HB3  LEU  11           HB3      LEU  11  -1.027   2.527 -14.009
    5    HG   LEU  11           HG       LEU  11  -2.279   2.631 -16.767
    6   HD13  LEU  11          HD11      LEU  11  -2.841   0.483 -16.010
    7   HD12  LEU  11          HD12      LEU  11  -4.197   1.463 -15.458
    8   HD11  LEU  11          HD13      LEU  11  -2.932   0.993 -14.324
    9   HD22  LEU  11          HD21      LEU  11  -2.882   4.642 -15.757
   10   HD21  LEU  11          HD22      LEU  11  -2.794   3.975 -14.127
   11   HD23  LEU  11          HD23      LEU  11  -4.171   3.598 -15.162

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  12           H        ILE  12   1.954   2.079 -15.764
    2    HA   ILE  12           HA       ILE  12   3.166   2.625 -13.266
    3    HB   ILE  12           HB       ILE  12   4.382   1.575 -15.842
    4   HG12  ILE  12          HG12      ILE  12   2.443   0.317 -14.640
    5   HG13  ILE  12          HG13      ILE  12   3.868  -0.599 -15.086
    6   HG23  ILE  12          HG21      ILE  12   6.167   2.386 -14.413
    7   HG22  ILE  12          HG22      ILE  12   6.142   0.625 -14.306
    8   HG21  ILE  12          HG23      ILE  12   5.458   1.597 -13.004
    9   HD13  ILE  12          HD11      ILE  12   4.694  -0.452 -12.799
   10   HD12  ILE  12          HD12      ILE  12   3.049  -1.084 -12.784
   11   HD11  ILE  12          HD13      ILE  12   3.351   0.585 -12.355

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  13           H        ILE  13   3.742   3.895 -16.525
    2    HA   ILE  13           HA       ILE  13   5.868   5.632 -15.809
    3    HB   ILE  13           HB       ILE  13   3.826   5.698 -18.044
    4   HG12  ILE  13          HG12      ILE  13   5.685   3.874 -17.770
    5   HG13  ILE  13          HG13      ILE  13   5.413   4.604 -19.349
    6   HG23  ILE  13          HG21      ILE  13   4.439   7.936 -18.042
    7   HG22  ILE  13          HG22      ILE  13   5.693   7.270 -19.080
    8   HG21  ILE  13          HG23      ILE  13   6.045   7.616 -17.389
    9   HD12  ILE  13          HD11      ILE  13   7.866   4.444 -18.621
   10   HD11  ILE  13          HD12      ILE  13   7.478   5.651 -17.401
   11   HD13  ILE  13          HD13      ILE  13   7.315   6.046 -19.108

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ASN  14           H        ASN  14   2.356   6.098 -16.060
    2    HA   ASN  14           HA       ASN  14   2.295   8.843 -15.421
    3    HB2  ASN  14           HB2      ASN  14   0.411   7.187 -16.244
    4    HB3  ASN  14           HB3      ASN  14   0.099   7.005 -14.522
    5   HD21  ASN  14          HD21      ASN  14  -1.936   8.145 -15.944
    6   HD22  ASN  14          HD22      ASN  14  -2.011   9.817 -15.676

  No H/Q in entry =           6
  In of MODEL   10
    1    H    SER  15           H        SER  15   2.033   5.963 -13.345
    2    HA   SER  15           HA       SER  15   1.727   7.330 -10.894
    3    HB2  SER  15           HB2      SER  15   2.288   5.249  -9.850
    4    HB3  SER  15           HB3      SER  15   1.472   4.820 -11.348
    5    HG   SER  15           HG       SER  15   3.237   3.681 -11.605

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLY  16           H        GLY  16   4.603   6.258 -12.668
    2    HA3  GLY  16           HA2      GLY  16   6.531   7.030 -10.746
    3    HA2  GLY  16           HA3      GLY  16   6.828   6.831 -12.471

  No H/Q in entry =           3
  In of MODEL   10
    1    H    GLN  17           H        GLN  17   5.116   8.775 -13.525
    2    HA   GLN  17           HA       GLN  17   6.674  11.130 -13.224
    3    HB2  GLN  17           HB2      GLN  17   5.356  10.650 -15.261
    4    HB3  GLN  17           HB3      GLN  17   3.866  10.833 -14.334
    5    HG2  GLN  17           HG2      GLN  17   4.484  13.167 -13.804
    6    HG3  GLN  17           HG3      GLN  17   5.958  12.986 -14.754
    7   HE21  GLN  17          HE21      GLN  17   5.747  13.771 -16.849
    8   HE22  GLN  17          HE22      GLN  17   4.297  13.815 -17.731

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ALA  18           H        ALA  18   3.590  10.083 -11.860
    2    HA   ALA  18           HA       ALA  18   2.849  12.465 -10.590
    3    HB1  ALA  18           HB1      ALA  18   1.741   9.998 -10.807
    4    HB2  ALA  18           HB2      ALA  18   1.187  11.212  -9.657
    5    HB3  ALA  18           HB3      ALA  18   2.291   9.940  -9.133

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ARG  19           H        ARG  19   4.754   9.719  -9.321
    2    HA   ARG  19           HA       ARG  19   5.288  10.881  -6.801
    3    HB2  ARG  19           HB2      ARG  19   5.723   8.482  -7.331
    4    HB3  ARG  19           HB3      ARG  19   7.069   8.982  -8.358
    5    HG2  ARG  19           HG2      ARG  19   8.188  10.031  -6.441
    6    HG3  ARG  19           HG3      ARG  19   6.821   9.630  -5.403
    7    HD2  ARG  19           HD2      ARG  19   8.600   8.011  -5.054
    8    HD3  ARG  19           HD3      ARG  19   7.230   7.216  -5.834
    9    HE   ARG  19           HE       ARG  19   8.917   8.053  -7.889
   10   HH21  ARG  19          HH11      ARG  19  10.487   6.663  -8.747
   11   HH22  ARG  19          HH12      ARG  19  11.050   5.320  -7.815
   12   HH11  ARG  19          HH21      ARG  19   9.022   6.022  -5.112
   13   HH12  ARG  19          HH22      ARG  19  10.217   4.957  -5.755

  No H/Q in entry =          13
  In of MODEL   10
    1    H    SER  20           H        SER  20   7.090  10.930  -9.858
    2    HA   SER  20           HA       SER  20   9.325  12.367  -9.044
    3    HB2  SER  20           HB2      SER  20   9.353  11.491 -11.249
    4    HB3  SER  20           HB3      SER  20   7.845  12.296 -11.669
    5    HG   SER  20           HG       SER  20   9.164  14.286 -11.114

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU  21           H        LEU  21   6.207  13.605 -10.226
    2    HA   LEU  21           HA       LEU  21   6.851  16.357 -10.004
    3    HB2  LEU  21           HB2      LEU  21   4.197  14.908  -9.909
    4    HB3  LEU  21           HB3      LEU  21   4.348  16.663  -9.919
    5    HG   LEU  21           HG       LEU  21   5.546  14.871 -12.051
    6   HD12  LEU  21          HD11      LEU  21   3.012  16.516 -12.263
    7   HD11  LEU  21          HD12      LEU  21   3.009  14.794 -11.880
    8   HD13  LEU  21          HD13      LEU  21   3.642  15.351 -13.428
    9   HD22  LEU  21          HD21      LEU  21   6.678  16.915 -12.228
   10   HD21  LEU  21          HD22      LEU  21   5.303  17.856 -11.657
   11   HD23  LEU  21          HD23      LEU  21   5.304  17.211 -13.291

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ALA  22           H        ALA  22   5.374  14.051  -7.749
    2    HA   ALA  22           HA       ALA  22   4.761  15.852  -5.679
    3    HB3  ALA  22           HB1      ALA  22   4.025  13.451  -5.839
    4    HB2  ALA  22           HB2      ALA  22   4.616  13.929  -4.247
    5    HB1  ALA  22           HB3      ALA  22   5.644  12.982  -5.324

  No H/Q in entry =           5
  In of MODEL   10
    1    H    TYR  23           H        TYR  23   7.715  13.859  -6.132
    2    HA   TYR  23           HA       TYR  23   9.097  14.892  -3.886
    3    HB2  TYR  23           HB2      TYR  23   9.902  12.894  -5.047
    4    HB3  TYR  23           HB3      TYR  23  10.196  13.836  -6.509
    5    HD1  TYR  23           HD1      TYR  23  11.174  13.539  -2.915
    6    HD2  TYR  23           HD2      TYR  23  12.226  15.002  -6.815
    7    HE1  TYR  23           HE1      TYR  23  13.429  14.144  -2.080
    8    HE2  TYR  23           HE2      TYR  23  14.481  15.608  -5.980
    9    HH   TYR  23           HH       TYR  23  15.659  14.544  -2.935

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ALA  24           H        ALA  24   8.886  15.998  -7.251
    2    HA   ALA  24           HA       ALA  24  10.758  18.105  -7.013
    3    HB2  ALA  24           HB1      ALA  24  10.304  18.163  -9.220
    4    HB3  ALA  24           HB2      ALA  24   8.742  18.894  -8.852
    5    HB1  ALA  24           HB3      ALA  24   8.887  17.143  -8.984

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA  25           H        ALA  25   7.285  17.879  -6.375
    2    HA   ALA  25           HA       ALA  25   6.775  20.591  -5.803
    3    HB1  ALA  25           HB1      ALA  25   5.137  18.573  -5.997
    4    HB2  ALA  25           HB2      ALA  25   4.759  19.857  -4.846
    5    HB3  ALA  25           HB3      ALA  25   5.470  18.344  -4.279

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU  26           H        LEU  26   7.886  17.924  -3.759
    2    HA   LEU  26           HA       LEU  26   7.985  19.356  -1.322
    3    HB2  LEU  26           HB2      LEU  26   8.110  16.941  -1.318
    4    HB3  LEU  26           HB3      LEU  26   9.575  16.967  -2.295
    5    HG   LEU  26           HG       LEU  26  10.785  18.100  -0.461
    6   HD12  LEU  26          HD11      LEU  26   9.569  18.092   1.805
    7   HD11  LEU  26          HD12      LEU  26   8.079  17.935   0.877
    8   HD13  LEU  26          HD13      LEU  26   9.105  19.354   0.664
    9   HD21  LEU  26          HD21      LEU  26   9.287  15.613   0.419
   10   HD23  LEU  26          HD22      LEU  26  10.798  16.194   1.109
   11   HD22  LEU  26          HD23      LEU  26  10.752  15.635  -0.561

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LYS  27           H        LYS  27  10.396  18.814  -3.858
    2    HA   LYS  27           HA       LYS  27  12.570  20.083  -2.641
    3    HB2  LYS  27           HB2      LYS  27  12.679  18.738  -4.731
    4    HB3  LYS  27           HB3      LYS  27  11.892  20.060  -5.593
    5    HG2  LYS  27           HG2      LYS  27  13.741  21.569  -5.024
    6    HG3  LYS  27           HG3      LYS  27  14.523  20.287  -4.091
    7    HD2  LYS  27           HD2      LYS  27  14.674  18.902  -6.146
    8    HD3  LYS  27           HD3      LYS  27  13.937  20.211  -7.071
    9    HE2  LYS  27           HE2      LYS  27  15.808  21.701  -6.467
   10    HE3  LYS  27           HE3      LYS  27  16.549  20.396  -5.534
   11    HZ3  LYS  27           HZ1      LYS  27  17.527  20.509  -7.725
   12    HZ2  LYS  27           HZ2      LYS  27  15.999  20.371  -8.458
   13    HZ1  LYS  27           HZ3      LYS  27  16.643  19.069  -7.577

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLN  28           H        GLN  28   9.920  21.431  -4.576
    2    HA   GLN  28           HA       GLN  28  10.843  24.096  -4.734
    3    HB2  GLN  28           HB2      GLN  28   8.026  22.988  -4.608
    4    HB3  GLN  28           HB3      GLN  28   8.414  24.665  -4.985
    5    HG2  GLN  28           HG2      GLN  28   9.435  22.267  -6.534
    6    HG3  GLN  28           HG3      GLN  28   8.083  23.282  -7.032
    7   HE21  GLN  28          HE21      GLN  28  11.191  22.831  -7.836
    8   HE22  GLN  28          HE22      GLN  28  11.666  24.423  -8.185

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ALA  29           H        ALA  29   8.946  22.377  -2.288
    2    HA   ALA  29           HA       ALA  29   8.376  24.561  -0.603
    3    HB2  ALA  29           HB1      ALA  29   7.676  22.983   0.968
    4    HB1  ALA  29           HB2      ALA  29   8.911  21.815   0.497
    5    HB3  ALA  29           HB3      ALA  29   7.516  22.090  -0.545

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LYS  30           H        LYS  30  11.136  22.332  -0.687
    2    HA   LYS  30           HA       LYS  30  12.452  23.303   1.610
    3    HB2  LYS  30           HB2      LYS  30  13.554  22.032  -0.906
    4    HB3  LYS  30           HB3      LYS  30  14.538  22.405   0.510
    5    HG2  LYS  30           HG2      LYS  30  13.011  21.001   1.897
    6    HG3  LYS  30           HG3      LYS  30  12.125  20.567   0.432
    7    HD2  LYS  30           HD2      LYS  30  14.178  19.609  -0.539
    8    HD3  LYS  30           HD3      LYS  30  15.083  20.057   0.908
    9    HE2  LYS  30           HE2      LYS  30  13.605  18.605   2.270
   10    HE3  LYS  30           HE3      LYS  30  12.730  18.137   0.806
   11    HZ2  LYS  30           HZ1      LYS  30  14.546  16.584   1.558
   12    HZ1  LYS  30           HZ2      LYS  30  15.665  17.786   1.101
   13    HZ3  LYS  30           HZ3      LYS  30  14.633  17.089  -0.059

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLN  31           H        GLN  31  12.310  24.507  -1.686
    2    HA   GLN  31           HA       GLN  31  14.439  26.429  -1.275
    3    HB2  GLN  31           HB2      GLN  31  12.385  26.448  -3.489
    4    HB3  GLN  31           HB3      GLN  31  13.995  27.166  -3.498
    5    HG2  GLN  31           HG2      GLN  31  14.497  24.477  -2.926
    6    HG3  GLN  31           HG3      GLN  31  13.188  24.405  -4.098
    7   HE21  GLN  31          HE21      GLN  31  16.040  23.651  -4.516
    8   HE22  GLN  31          HE22      GLN  31  16.592  24.632  -5.785

  No H/Q in entry =           8
  In of MODEL   10
    1    H    GLY  32           H        GLY  32  11.373  26.204  -0.114
    2    HA3  GLY  32           HA2      GLY  32  10.202  27.756   1.165
    3    HA2  GLY  32           HA3      GLY  32  11.307  29.007   0.609

  No H/Q in entry =           3
  In of MODEL   10
    1    H    ASP  33           H        ASP  33   9.957  27.085  -1.877
    2    HA   ASP  33           HA       ASP  33   8.257  29.335  -2.723
    3    HB2  ASP  33           HB2      ASP  33   9.376  26.931  -4.171
    4    HB3  ASP  33           HB3      ASP  33   8.206  28.030  -4.896

  No H/Q in entry =           4
  In of MODEL   10
    1    H    PHE  34           H        PHE  34   6.583  28.836  -1.151
    2    HA   PHE  34           HA       PHE  34   5.239  26.344  -1.049
    3    HB2  PHE  34           HB2      PHE  34   4.243  29.118  -0.364
    4    HB3  PHE  34           HB3      PHE  34   3.417  27.616   0.051
    5    HD1  PHE  34           HD1      PHE  34   5.639  30.045   1.255
    6    HD2  PHE  34           HD2      PHE  34   5.017  25.795   1.204
    7    HE1  PHE  34           HE1      PHE  34   7.043  29.814   3.284
    8    HE2  PHE  34           HE2      PHE  34   6.424  25.568   3.232
    9    HZ   PHE  34           HZ       PHE  34   7.431  27.578   4.271

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ALA  35           H        ALA  35   4.758  29.202  -3.057
    2    HA   ALA  35           HA       ALA  35   2.211  28.553  -4.070
    3    HB3  ALA  35           HB1      ALA  35   3.233  29.960  -6.112
    4    HB2  ALA  35           HB2      ALA  35   4.452  30.338  -4.894
    5    HB1  ALA  35           HB3      ALA  35   2.757  30.723  -4.595

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA  36           H        ALA  36   5.441  27.925  -5.440
    2    HA   ALA  36           HA       ALA  36   4.461  26.482  -7.679
    3    HB3  ALA  36           HB1      ALA  36   6.615  26.637  -8.306
    4    HB2  ALA  36           HB2      ALA  36   7.118  25.614  -6.958
    5    HB1  ALA  36           HB3      ALA  36   6.989  27.361  -6.742

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA  37           H        ALA  37   5.447  25.501  -4.429
    2    HA   ALA  37           HA       ALA  37   5.425  22.712  -4.858
    3    HB2  ALA  37           HB1      ALA  37   5.151  24.499  -2.478
    4    HB1  ALA  37           HB2      ALA  37   6.301  23.197  -2.777
    5    HB3  ALA  37           HB3      ALA  37   4.648  22.820  -2.297

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LYS  38           H        LYS  38   2.868  24.884  -3.677
    2    HA   LYS  38           HA       LYS  38   0.795  23.042  -3.444
    3    HB2  LYS  38           HB2      LYS  38   1.110  25.803  -3.195
    4    HB3  LYS  38           HB3      LYS  38  -0.094  25.639  -4.468
    5    HG2  LYS  38           HG2      LYS  38  -1.518  24.295  -3.018
    6    HG3  LYS  38           HG3      LYS  38  -0.267  24.253  -1.768
    7    HD2  LYS  38           HD2      LYS  38  -0.483  26.586  -1.319
    8    HD3  LYS  38           HD3      LYS  38  -1.406  26.862  -2.797
    9    HE2  LYS  38           HE2      LYS  38  -2.900  26.875  -0.850
   10    HE3  LYS  38           HE3      LYS  38  -3.260  25.494  -1.890
   11    HZ3  LYS  38           HZ1      LYS  38  -2.506  24.034  -0.361
   12    HZ2  LYS  38           HZ2      LYS  38  -2.869  25.286   0.730
   13    HZ1  LYS  38           HZ3      LYS  38  -1.274  25.057   0.197

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ALA  39           H        ALA  39   1.734  24.958  -6.298
    2    HA   ALA  39           HA       ALA  39  -0.338  24.062  -7.990
    3    HB2  ALA  39           HB1      ALA  39   2.383  24.749  -9.058
    4    HB1  ALA  39           HB2      ALA  39   1.403  25.996  -8.287
    5    HB3  ALA  39           HB3      ALA  39   0.795  25.151  -9.711

  No H/Q in entry =           5
  In of MODEL   10
    1    H    MET  40           H        MET  40   2.921  22.809  -7.427
    2    HA   MET  40           HA       MET  40   2.841  20.788  -9.419
    3    HB2  MET  40           HB2      MET  40   4.462  21.034  -6.878
    4    HB3  MET  40           HB3      MET  40   4.724  19.782  -8.094
    5    HG2  MET  40           HG2      MET  40   4.737  22.738  -8.759
    6    HG3  MET  40           HG3      MET  40   6.198  21.856  -8.317
    7    HE3  MET  40           HE1      MET  40   7.087  19.654 -11.131
    8    HE2  MET  40           HE2      MET  40   6.537  19.326  -9.490
    9    HE1  MET  40           HE3      MET  40   7.611  20.689  -9.795

  No H/Q in entry =           9
  In of MODEL   10
    1    H    MET  41           H        MET  41   1.943  20.817  -5.990
    2    HA   MET  41           HA       MET  41   1.451  18.045  -5.710
    3    HB2  MET  41           HB2      MET  41   0.092  20.383  -4.352
    4    HB3  MET  41           HB3      MET  41  -0.037  18.703  -3.844
    5    HG2  MET  41           HG2      MET  41   2.670  18.965  -3.894
    6    HG3  MET  41           HG3      MET  41   2.207  20.616  -3.496
    7    HE2  MET  41           HE1      MET  41  -0.805  19.320  -1.756
    8    HE1  MET  41           HE2      MET  41  -0.012  20.845  -2.137
    9    HE3  MET  41           HE3      MET  41  -0.055  20.273  -0.469

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ASP  42           H        ASP  42  -0.631  20.740  -6.673
    2    HA   ASP  42           HA       ASP  42  -3.052  19.344  -6.798
    3    HB2  ASP  42           HB2      ASP  42  -2.384  21.925  -7.058
    4    HB3  ASP  42           HB3      ASP  42  -2.538  21.528  -8.765

  No H/Q in entry =           4
  In of MODEL   10
    1    H    GLN  43           H        GLN  43  -0.633  19.971  -9.312
    2    HA   GLN  43           HA       GLN  43  -2.011  18.632 -11.395
    3    HB2  GLN  43           HB2      GLN  43   0.941  19.191 -11.027
    4    HB3  GLN  43           HB3      GLN  43   0.229  18.541 -12.507
    5    HG2  GLN  43           HG2      GLN  43  -1.312  20.546 -12.540
    6    HG3  GLN  43           HG3      GLN  43  -0.362  21.215 -11.217
    7   HE21  GLN  43          HE21      GLN  43  -0.234  22.838 -13.303
    8   HE22  GLN  43          HE22      GLN  43   1.179  22.638 -14.218

  No H/Q in entry =           8
  In of MODEL   10
    1    H    SER  44           H        SER  44   0.368  17.526  -9.016
    2    HA   SER  44           HA       SER  44   0.736  14.924 -10.043
    3    HB2  SER  44           HB2      SER  44   1.621  16.376  -7.811
    4    HB3  SER  44           HB3      SER  44   0.782  14.980  -7.136
    5    HG   SER  44           HG       SER  44   2.900  14.391  -7.574

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ARG  45           H        ARG  45  -1.592  16.208  -7.694
    2    HA   ARG  45           HA       ARG  45  -2.940  13.827  -7.052
    3    HB2  ARG  45           HB2      ARG  45  -3.164  15.992  -5.859
    4    HB3  ARG  45           HB3      ARG  45  -4.037  16.646  -7.241
    5    HG2  ARG  45           HG2      ARG  45  -5.776  14.894  -6.950
    6    HG3  ARG  45           HG3      ARG  45  -4.915  14.295  -5.531
    7    HD2  ARG  45           HD2      ARG  45  -5.150  16.558  -4.473
    8    HD3  ARG  45           HD3      ARG  45  -6.152  17.063  -5.851
    9    HE   ARG  45           HE       ARG  45  -7.221  14.671  -4.806
   10   HH21  ARG  45          HH11      ARG  45  -9.052  14.718  -3.526
   11   HH22  ARG  45          HH12      ARG  45  -9.464  16.152  -2.655
   12   HH11  ARG  45          HH21      ARG  45  -6.719  17.925  -3.784
   13   HH12  ARG  45          HH22      ARG  45  -8.138  17.968  -2.799

  No H/Q in entry =          13
  In of MODEL   10
    1    H    MET  46           H        MET  46  -3.573  16.222  -9.599
    2    HA   MET  46           HA       MET  46  -5.899  15.015 -10.650
    3    HB2  MET  46           HB2      MET  46  -3.828  16.861 -11.853
    4    HB3  MET  46           HB3      MET  46  -5.230  16.301 -12.769
    5    HG2  MET  46           HG2      MET  46  -6.735  17.218 -11.060
    6    HG3  MET  46           HG3      MET  46  -5.354  17.743 -10.103
    7    HE2  MET  46           HE1      MET  46  -5.816  20.326  -9.993
    8    HE1  MET  46           HE2      MET  46  -7.386  19.734 -10.523
    9    HE3  MET  46           HE3      MET  46  -6.676  21.147 -11.303

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ALA  47           H        ALA  47  -2.467  14.588 -11.425
    2    HA   ALA  47           HA       ALA  47  -2.797  12.856 -13.633
    3    HB3  ALA  47           HB1      ALA  47  -0.632  13.779 -13.292
    4    HB2  ALA  47           HB2      ALA  47  -0.462  12.053 -12.959
    5    HB1  ALA  47           HB3      ALA  47  -0.566  13.203 -11.626

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU  48           H        LEU  48  -2.501  12.224 -10.161
    2    HA   LEU  48           HA       LEU  48  -2.552   9.383 -10.319
    3    HB2  LEU  48           HB2      LEU  48  -3.335  11.289  -8.102
    4    HB3  LEU  48           HB3      LEU  48  -3.213   9.540  -7.902
    5    HG   LEU  48           HG       LEU  48  -0.945  11.274  -8.910
    6   HD13  LEU  48          HD11      LEU  48  -1.229  12.040  -6.718
    7   HD12  LEU  48          HD12      LEU  48  -0.045  10.751  -6.525
    8   HD11  LEU  48          HD13      LEU  48  -1.737  10.462  -6.119
    9   HD22  LEU  48          HD21      LEU  48  -0.416   9.097  -9.554
   10   HD21  LEU  48          HD22      LEU  48  -1.268   8.368  -8.193
   11   HD23  LEU  48          HD23      LEU  48   0.294   9.146  -7.941

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ASN  49           H        ASN  49  -5.052  11.837  -9.906
    2    HA   ASN  49           HA       ASN  49  -7.209  10.139  -9.356
    3    HB2  ASN  49           HB2      ASN  49  -7.319  12.551  -9.023
    4    HB3  ASN  49           HB3      ASN  49  -7.137  12.829 -10.751
    5   HD21  ASN  49          HD21      ASN  49  -9.353  11.481  -8.311
    6   HD22  ASN  49          HD22      ASN  49 -10.750  11.633  -9.260

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLU  50           H        GLU  50  -5.963  11.355 -12.449
    2    HA   GLU  50           HA       GLU  50  -7.905  10.070 -14.086
    3    HB2  GLU  50           HB2      GLU  50  -6.472  11.911 -14.907
    4    HB3  GLU  50           HB3      GLU  50  -5.061  10.861 -14.775
    5    HG2  GLU  50           HG2      GLU  50  -6.018   9.310 -16.407
    6    HG3  GLU  50           HG3      GLU  50  -7.494  10.266 -16.488

  No H/Q in entry =           6
  In of MODEL   10
    1    H    ALA  51           H        ALA  51  -4.714   9.127 -12.895
    2    HA   ALA  51           HA       ALA  51  -4.543   6.676 -14.314
    3    HB2  ALA  51           HB1      ALA  51  -2.553   6.419 -13.224
    4    HB1  ALA  51           HB2      ALA  51  -3.240   6.830 -11.653
    5    HB3  ALA  51           HB3      ALA  51  -2.809   8.108 -12.789

  No H/Q in entry =           5
  In of MODEL   10
    1    H    HIS  52           H        HIS  52  -5.713   7.490 -11.060
    2    HA   HIS  52           HA       HIS  52  -6.355   4.869 -10.225
    3    HB2  HIS  52           HB2      HIS  52  -6.245   6.761  -8.673
    4    HB3  HIS  52           HB3      HIS  52  -7.636   7.503  -9.460
    5    HD1  HIS  52           HD1      HIS  52  -9.910   6.010  -9.386
    6    HD2  HIS  52           HD2      HIS  52  -6.918   4.941  -6.688
    7    HE1  HIS  52           HE1      HIS  52 -11.016   4.565  -7.625
    8    HE2  HIS  52           HE2      HIS  52  -9.205   3.905  -5.972

  No H/Q in entry =           8
  In of MODEL   10
    1    H    LEU  53           H        LEU  53  -8.221   7.299 -12.004
    2    HA   LEU  53           HA       LEU  53 -10.706   5.970 -12.006
    3    HB2  LEU  53           HB2      LEU  53  -9.461   7.972 -13.877
    4    HB3  LEU  53           HB3      LEU  53 -11.048   7.280 -14.198
    5    HG   LEU  53           HG       LEU  53 -10.345   8.616 -11.564
    6   HD11  LEU  53          HD11      LEU  53 -10.142  10.176 -13.531
    7   HD13  LEU  53          HD12      LEU  53 -11.412  10.624 -12.391
    8   HD12  LEU  53          HD13      LEU  53 -11.826   9.833 -13.909
    9   HD22  LEU  53          HD21      LEU  53 -12.311   7.354 -11.225
   10   HD21  LEU  53          HD22      LEU  53 -12.875   7.626 -12.869
   11   HD23  LEU  53          HD23      LEU  53 -12.963   8.920 -11.690

  No H/Q in entry =          11
  In of MODEL   10
    1    H    VAL  54           H        VAL  54  -7.963   5.814 -14.255
    2    HA   VAL  54           HA       VAL  54  -9.168   4.025 -16.093
    3    HB   VAL  54           HB       VAL  54  -6.265   4.575 -15.424
    4   HG12  VAL  54          HG11      VAL  54  -6.013   3.494 -17.814
    5   HG11  VAL  54          HG12      VAL  54  -7.527   2.690 -17.404
    6   HG13  VAL  54          HG13      VAL  54  -6.104   2.456 -16.392
    7   HG22  VAL  54          HG21      VAL  54  -7.068   6.506 -16.465
    8   HG21  VAL  54          HG22      VAL  54  -8.253   5.625 -17.428
    9   HG23  VAL  54          HG23      VAL  54  -6.547   5.571 -17.866

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLN  55           H        GLN  55  -7.148   3.508 -13.203
    2    HA   GLN  55           HA       GLN  55  -7.018   0.693 -13.460
    3    HB2  GLN  55           HB2      GLN  55  -5.469   1.612 -11.948
    4    HB3  GLN  55           HB3      GLN  55  -6.696   2.560 -11.112
    5    HG2  GLN  55           HG2      GLN  55  -7.353   0.793  -9.792
    6    HG3  GLN  55           HG3      GLN  55  -7.116  -0.391 -11.071
    7   HE21  GLN  55          HE21      GLN  55  -5.469  -1.817 -10.584
    8   HE22  GLN  55          HE22      GLN  55  -4.086  -1.445  -9.679

  No H/Q in entry =           8
  In of MODEL   10
    1    H    THR  56           H        THR  56  -9.373   2.822 -11.835
    2    HA   THR  56           HA       THR  56 -10.924   0.915 -10.538
    3    HB   THR  56           HB       THR  56 -12.064   3.285 -12.040
    4    HG1  THR  56           HG1      THR  56 -10.521   3.090  -9.712
    5   HG21  THR  56          HG21      THR  56 -12.921   1.594  -9.702
    6   HG23  THR  56          HG22      THR  56 -13.839   2.030 -11.144
    7   HG22  THR  56          HG23      THR  56 -13.527   3.237  -9.897

  No H/Q in entry =           7
  In of MODEL   10
    1    H    LYS  57           H        LYS  57 -11.157   1.995 -13.923
    2    HA   LYS  57           HA       LYS  57 -13.292   0.277 -14.668
    3    HB2  LYS  57           HB2      LYS  57 -12.447   2.242 -15.987
    4    HB3  LYS  57           HB3      LYS  57 -10.999   1.320 -16.364
    5    HG2  LYS  57           HG2      LYS  57 -12.367  -0.388 -17.495
    6    HG3  LYS  57           HG3      LYS  57 -13.825   0.520 -17.116
    7    HD2  LYS  57           HD2      LYS  57 -12.979   2.430 -18.445
    8    HD3  LYS  57           HD3      LYS  57 -11.529   1.512 -18.840
    9    HE2  LYS  57           HE2      LYS  57 -12.916  -0.213 -19.951
   10    HE3  LYS  57           HE3      LYS  57 -14.375   0.701 -19.567
   11    HZ1  LYS  57           HZ1      LYS  57 -12.246   2.136 -20.942
   12    HZ3  LYS  57           HZ2      LYS  57 -13.933   2.250 -21.121
   13    HZ2  LYS  57           HZ3      LYS  57 -13.082   0.969 -21.845

  No H/Q in entry =          13
  In of MODEL   10
    1    H    LEU  58           H        LEU  58  -9.781  -0.103 -14.626
    2    HA   LEU  58           HA       LEU  58  -9.758  -2.620 -15.914
    3    HB2  LEU  58           HB2      LEU  58  -7.735  -1.299 -14.115
    4    HB3  LEU  58           HB3      LEU  58  -7.456  -2.817 -14.970
    5    HG   LEU  58           HG       LEU  58  -8.253  -0.224 -16.330
    6   HD11  LEU  58          HD11      LEU  58  -5.586  -1.422 -15.650
    7   HD13  LEU  58          HD12      LEU  58  -6.106   0.261 -15.600
    8   HD12  LEU  58          HD13      LEU  58  -5.762  -0.505 -17.147
    9   HD22  LEU  58          HD21      LEU  58  -8.813  -1.794 -17.919
   10   HD21  LEU  58          HD22      LEU  58  -7.751  -3.027 -17.241
   11   HD23  LEU  58          HD23      LEU  58  -7.083  -1.743 -18.250

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  59           H        ILE  59 -10.579  -1.729 -12.660
    2    HA   ILE  59           HA       ILE  59 -10.184  -4.491 -11.713
    3    HB   ILE  59           HB       ILE  59  -9.767  -2.217 -10.317
    4   HG12  ILE  59          HG12      ILE  59 -11.094  -4.588  -8.987
    5   HG13  ILE  59          HG13      ILE  59  -9.454  -4.642  -9.578
    6   HG23  ILE  59          HG21      ILE  59 -11.603  -1.551  -8.997
    7   HG22  ILE  59          HG22      ILE  59 -12.520  -2.995  -9.360
    8   HG21  ILE  59          HG23      ILE  59 -12.318  -1.741 -10.581
    9   HD11  ILE  59          HD11      ILE  59  -8.888  -2.683  -8.180
   10   HD13  ILE  59          HD12      ILE  59  -9.432  -4.048  -7.214
   11   HD12  ILE  59          HD13      ILE  59 -10.525  -2.700  -7.533

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLU  60           H        GLU  60 -12.779  -2.213 -12.511
    2    HA   GLU  60           HA       GLU  60 -14.937  -3.761 -11.489
    3    HB2  GLU  60           HB2      GLU  60 -15.222  -1.408 -12.066
    4    HB3  GLU  60           HB3      GLU  60 -14.840  -1.745 -13.751
    5    HG2  GLU  60           HG2      GLU  60 -17.124  -3.168 -12.399
    6    HG3  GLU  60           HG3      GLU  60 -17.347  -1.564 -13.069

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLY  61           H        GLY  61 -13.277  -3.722 -14.611
    2    HA3  GLY  61           HA2      GLY  61 -14.960  -5.992 -15.493
    3    HA2  GLY  61           HA3      GLY  61 -14.136  -4.876 -16.575

  No H/Q in entry =           3
  In of MODEL   10
    1    H    ASP  62           H        ASP  62 -12.727  -6.300 -13.696
    2    HA   ASP  62           HA       ASP  62 -10.393  -7.144 -15.046
    3    HB2  ASP  62           HB2      ASP  62  -9.856  -8.233 -12.890
    4    HB3  ASP  62           HB3      ASP  62 -10.415  -6.578 -12.671

  No H/Q in entry =           4
  In of MODEL   10
    1    H    ALA  63           H        ALA  63 -13.374  -8.909 -14.200
    2    HA   ALA  63           HA       ALA  63 -12.268 -11.477 -15.081
    3    HB3  ALA  63           HB1      ALA  63 -15.012 -10.573 -14.145
    4    HB2  ALA  63           HB2      ALA  63 -13.847 -11.545 -13.247
    5    HB1  ALA  63           HB3      ALA  63 -14.666 -12.225 -14.654

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLY  64           H        GLY  64 -13.997 -12.714 -16.520
    2    HA3  GLY  64           HA2      GLY  64 -15.598 -12.160 -18.426
    3    HA2  GLY  64           HA3      GLY  64 -14.302 -11.103 -18.971

  No H/Q in entry =           3
  In of MODEL   10
    1    H    GLU  65           H        GLU  65 -12.067 -12.680 -18.487
    2    HA   GLU  65           HA       GLU  65 -12.087 -14.342 -20.771
    3    HB2  GLU  65           HB2      GLU  65 -10.087 -14.122 -18.521
    4    HB3  GLU  65           HB3      GLU  65  -9.820 -15.040 -20.004
    5    HG2  GLU  65           HG2      GLU  65 -10.491 -12.086 -19.911
    6    HG3  GLU  65           HG3      GLU  65  -8.866 -12.738 -20.115

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLY  66           H        GLY  66 -12.377 -15.020 -17.378
    2    HA3  GLY  66           HA2      GLY  66 -13.655 -17.533 -17.786
    3    HA2  GLY  66           HA3      GLY  66 -12.019 -17.739 -17.193

  No H/Q in entry =           3
  In of MODEL   10
    1    H    LYS  67           H        LYS  67 -12.793 -18.711 -15.319
    2    HA   LYS  67           HA       LYS  67 -14.728 -17.929 -13.584
    3    HB2  LYS  67           HB2      LYS  67 -13.523 -19.149 -11.859
    4    HB3  LYS  67           HB3      LYS  67 -13.393 -19.992 -13.408
    5    HG2  LYS  67           HG2      LYS  67 -11.197 -18.911 -13.801
    6    HG3  LYS  67           HG3      LYS  67 -11.320 -18.113 -12.234
    7    HD2  LYS  67           HD2      LYS  67 -11.368 -20.306 -11.111
    8    HD3  LYS  67           HD3      LYS  67 -11.260 -21.112 -12.678
    9    HE2  LYS  67           HE2      LYS  67  -9.092 -20.018 -13.105
   10    HE3  LYS  67           HE3      LYS  67  -9.198 -19.192 -11.549
   11    HZ3  LYS  67           HZ1      LYS  67  -7.837 -21.148 -11.348
   12    HZ2  LYS  67           HZ2      LYS  67  -9.073 -22.128 -11.978
   13    HZ1  LYS  67           HZ3      LYS  67  -9.268 -21.374 -10.468

  No H/Q in entry =          13
  In of MODEL   10
    1    H    MET  68           H        MET  68 -13.741 -17.504 -11.117
    2    HA   MET  68           HA       MET  68 -13.864 -14.796 -10.727
    3    HB2  MET  68           HB2      MET  68 -12.571 -16.936  -9.045
    4    HB3  MET  68           HB3      MET  68 -12.814 -15.281  -8.488
    5    HG2  MET  68           HG2      MET  68 -15.240 -15.499  -8.909
    6    HG3  MET  68           HG3      MET  68 -14.991 -17.161  -9.450
    7    HE3  MET  68           HE1      MET  68 -16.824 -17.517  -6.101
    8    HE2  MET  68           HE2      MET  68 -16.474 -18.516  -7.509
    9    HE1  MET  68           HE3      MET  68 -17.013 -16.853  -7.731

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LYS  69           H        LYS  69 -11.217 -16.288 -12.192
    2    HA   LYS  69           HA       LYS  69  -9.056 -14.905 -11.045
    3    HB2  LYS  69           HB2      LYS  69  -9.087 -16.956 -12.614
    4    HB3  LYS  69           HB3      LYS  69  -9.054 -15.769 -13.918
    5    HG2  LYS  69           HG2      LYS  69  -7.013 -14.776 -13.020
    6    HG3  LYS  69           HG3      LYS  69  -7.071 -15.851 -11.625
    7    HD2  LYS  69           HD2      LYS  69  -6.796 -17.801 -13.100
    8    HD3  LYS  69           HD3      LYS  69  -6.760 -16.739 -14.507
    9    HE2  LYS  69           HE2      LYS  69  -4.752 -15.615 -13.614
   10    HE3  LYS  69           HE3      LYS  69  -4.786 -16.672 -12.204
   11    HZ3  LYS  69           HZ1      LYS  69  -3.793 -18.275 -13.343
   12    HZ2  LYS  69           HZ2      LYS  69  -3.538 -17.162 -14.599
   13    HZ1  LYS  69           HZ3      LYS  69  -4.907 -18.169 -14.617

  No H/Q in entry =          13
  In of MODEL   10
    1    H    VAL  70           H        VAL  70  -7.787 -13.140 -11.649
    2    HA   VAL  70           HA       VAL  70  -9.055 -11.183 -13.483
    3    HB   VAL  70           HB       VAL  70  -8.166  -9.426 -11.964
    4   HG12  VAL  70          HG11      VAL  70  -9.950 -11.461 -10.595
    5   HG11  VAL  70          HG12      VAL  70 -10.500 -10.266 -11.770
    6   HG13  VAL  70          HG13      VAL  70  -9.858  -9.742 -10.214
    7   HG22  VAL  70          HG21      VAL  70  -6.321 -10.628 -10.917
    8   HG21  VAL  70          HG22      VAL  70  -7.431 -11.831 -10.264
    9   HG23  VAL  70          HG23      VAL  70  -7.461 -10.180  -9.648

  No H/Q in entry =           9
  In of MODEL   10
    1    H    SER  71           H        SER  71  -7.498  -9.576 -14.324
    2    HA   SER  71           HA       SER  71  -5.272 -10.771 -15.589
    3    HB2  SER  71           HB2      SER  71  -6.445  -8.757 -16.456
    4    HB3  SER  71           HB3      SER  71  -5.807  -7.829 -15.100
    5    HG   SER  71           HG       SER  71  -4.648  -8.272 -17.395

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU  72           H        LEU  72  -3.213 -11.007 -14.982
    2    HA   LEU  72           HA       LEU  72  -2.485 -10.781 -12.274
    3    HB2  LEU  72           HB2      LEU  72  -0.840 -11.193 -14.765
    4    HB3  LEU  72           HB3      LEU  72  -0.164 -11.245 -13.141
    5    HG   LEU  72           HG       LEU  72  -2.496 -12.980 -14.016
    6   HD13  LEU  72          HD11      LEU  72  -0.501 -13.510 -15.365
    7   HD12  LEU  72          HD12      LEU  72  -0.832 -14.800 -14.211
    8   HD11  LEU  72          HD13      LEU  72   0.462 -13.645 -13.893
    9   HD21  LEU  72          HD21      LEU  72  -0.730 -12.808 -11.583
   10   HD23  LEU  72          HD22      LEU  72  -1.434 -14.357 -12.021
   11   HD22  LEU  72          HD23      LEU  72  -2.479 -12.985 -11.662

  No H/Q in entry =          11
  In of MODEL   10
    1    H    VAL  73           H        VAL  73  -1.808  -8.757 -15.059
    2    HA   VAL  73           HA       VAL  73   0.093  -7.031 -13.964
    3    HB   VAL  73           HB       VAL  73  -0.331  -5.617 -15.819
    4   HG11  VAL  73          HG11      VAL  73   0.488  -8.010 -16.237
    5   HG13  VAL  73          HG12      VAL  73  -0.179  -7.158 -17.628
    6   HG12  VAL  73          HG13      VAL  73  -1.151  -8.362 -16.783
    7   HG23  VAL  73          HG21      VAL  73  -2.493  -6.245 -17.210
    8   HG22  VAL  73          HG22      VAL  73  -2.604  -5.132 -15.848
    9   HG21  VAL  73          HG23      VAL  73  -3.073  -6.821 -15.646

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LEU  74           H        LEU  74  -3.300  -7.193 -13.393
    2    HA   LEU  74           HA       LEU  74  -3.952  -4.545 -12.780
    3    HB2  LEU  74           HB2      LEU  74  -5.657  -6.238 -12.946
    4    HB3  LEU  74           HB3      LEU  74  -4.950  -7.146 -11.613
    5    HG   LEU  74           HG       LEU  74  -5.442  -5.279 -10.073
    6   HD13  LEU  74          HD11      LEU  74  -5.339  -3.338 -11.426
    7   HD12  LEU  74          HD12      LEU  74  -7.053  -3.510 -11.055
    8   HD11  LEU  74          HD13      LEU  74  -6.437  -4.016 -12.629
    9   HD23  LEU  74          HD21      LEU  74  -7.992  -5.711 -11.536
   10   HD22  LEU  74          HD22      LEU  74  -7.617  -5.877  -9.834
   11   HD21  LEU  74          HD23      LEU  74  -7.130  -7.130 -10.949

  No H/Q in entry =          11
  In of MODEL   10
    1    H    VAL  75           H        VAL  75  -2.868  -7.116 -10.620
    2    HA   VAL  75           HA       VAL  75  -2.681  -5.560  -8.278
    3    HB   VAL  75           HB       VAL  75  -1.159  -8.037  -9.075
    4   HG11  VAL  75          HG11      VAL  75  -1.357  -6.563  -6.410
    5   HG13  VAL  75          HG12      VAL  75   0.098  -6.809  -7.364
    6   HG12  VAL  75          HG13      VAL  75  -0.692  -8.181  -6.607
    7   HG21  VAL  75          HG21      VAL  75  -3.669  -8.160  -8.840
    8   HG23  VAL  75          HG22      VAL  75  -3.492  -7.601  -7.177
    9   HG22  VAL  75          HG23      VAL  75  -2.804  -9.151  -7.665

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLU  76           H        GLU  76  -0.272  -6.290 -10.824
    2    HA   GLU  76           HA       GLU  76   1.900  -4.912  -9.676
    3    HB2  GLU  76           HB2      GLU  76   2.119  -6.385 -11.656
    4    HB3  GLU  76           HB3      GLU  76   1.183  -5.245 -12.612
    5    HG2  GLU  76           HG2      GLU  76   3.512  -4.873 -13.119
    6    HG3  GLU  76           HG3      GLU  76   2.973  -3.506 -12.163

  No H/Q in entry =           6
  In of MODEL   10
    1    H    ALA  77           H        ALA  77  -0.657  -3.747 -11.855
    2    HA   ALA  77           HA       ALA  77   0.296  -1.087 -12.037
    3    HB3  ALA  77           HB1      ALA  77  -2.558  -2.086 -12.254
    4    HB1  ALA  77           HB2      ALA  77  -1.389  -2.055 -13.575
    5    HB2  ALA  77           HB3      ALA  77  -1.946  -0.545 -12.855

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLN  78           H        GLN  78  -1.942  -2.673  -9.816
    2    HA   GLN  78           HA       GLN  78  -2.776  -0.364  -8.414
    3    HB2  GLN  78           HB2      GLN  78  -3.786  -2.716  -8.354
    4    HB3  GLN  78           HB3      GLN  78  -2.494  -3.133  -7.230
    5    HG2  GLN  78           HG2      GLN  78  -3.230  -1.456  -5.660
    6    HG3  GLN  78           HG3      GLN  78  -4.407  -0.824  -6.811
    7   HE21  GLN  78          HE21      GLN  78  -5.863  -2.870  -7.709
    8   HE22  GLN  78          HE22      GLN  78  -6.511  -3.816  -6.457

  No H/Q in entry =           8
  In of MODEL   10
    1    H    LEU  79           H        LEU  79  -0.064  -2.582  -7.972
    2    HA   LEU  79           HA       LEU  79   0.908  -1.669  -5.519
    3    HB2  LEU  79           HB2      LEU  79   1.803  -3.666  -6.589
    4    HB3  LEU  79           HB3      LEU  79   2.430  -2.706  -7.925
    5    HG   LEU  79           HG       LEU  79   3.975  -1.543  -6.428
    6   HD13  LEU  79          HD11      LEU  79   2.975  -1.311  -4.357
    7   HD12  LEU  79          HD12      LEU  79   4.074  -2.645  -4.016
    8   HD11  LEU  79          HD13      LEU  79   2.372  -2.969  -4.340
    9   HD23  LEU  79          HD21      LEU  79   5.220  -3.673  -5.528
   10   HD22  LEU  79          HD22      LEU  79   5.008  -3.478  -7.265
   11   HD21  LEU  79          HD23      LEU  79   3.948  -4.563  -6.368

  No H/Q in entry =          11
  In of MODEL   10
    1    H    HIS  80           H        HIS  80   1.750  -0.542  -8.796
    2    HA   HIS  80           HA       HIS  80   3.532   1.473  -7.882
    3    HB2  HIS  80           HB2      HIS  80   2.243   0.757 -10.459
    4    HB3  HIS  80           HB3      HIS  80   2.814   2.418 -10.292
    5    HD1  HIS  80           HD1      HIS  80   5.209   2.754 -10.823
    6    HD2  HIS  80           HD2      HIS  80   4.452  -1.168  -9.626
    7    HE1  HIS  80           HE1      HIS  80   7.417   1.510 -10.996
    8    HE2  HIS  80           HE2      HIS  80   6.967  -0.883 -10.270

  No H/Q in entry =           8
  In of MODEL   10
    1    H    LEU  81           H        LEU  81   0.122   1.580  -8.849
    2    HA   LEU  81           HA       LEU  81  -0.195   4.369  -8.519
    3    HB2  LEU  81           HB2      LEU  81  -2.174   2.093  -8.431
    4    HB3  LEU  81           HB3      LEU  81  -2.652   3.789  -8.339
    5    HG   LEU  81           HG       LEU  81  -0.950   2.663 -10.580
    6   HD12  LEU  81          HD11      LEU  81  -3.191   2.948 -11.871
    7   HD11  LEU  81          HD12      LEU  81  -3.940   2.869 -10.277
    8   HD13  LEU  81          HD13      LEU  81  -2.978   1.515 -10.867
    9   HD23  LEU  81          HD21      LEU  81  -2.084   4.790 -11.675
   10   HD22  LEU  81          HD22      LEU  81  -0.666   4.983 -10.647
   11   HD21  LEU  81          HD23      LEU  81  -2.274   5.307 -10.001

  No H/Q in entry =          11
  In of MODEL   10
    1    H    MET  82           H        MET  82  -0.804   1.673  -6.266
    2    HA   MET  82           HA       MET  82  -1.873   3.244  -4.176
    3    HB2  MET  82           HB2      MET  82  -0.457   0.579  -4.219
    4    HB3  MET  82           HB3      MET  82  -1.042   1.296  -2.720
    5    HG2  MET  82           HG2      MET  82  -2.775   0.773  -5.154
    6    HG3  MET  82           HG3      MET  82  -2.675  -0.298  -3.759
    7    HE3  MET  82           HE1      MET  82  -4.414   1.326  -0.938
    8    HE2  MET  82           HE2      MET  82  -2.689   1.631  -1.130
    9    HE1  MET  82           HE3      MET  82  -3.354   0.062  -1.580

  No H/Q in entry =           9
  In of MODEL   10
    1    H    THR  83           H        THR  83   1.442   2.211  -4.877
    2    HA   THR  83           HA       THR  83   2.650   3.336  -2.581
    3    HB   THR  83           HB       THR  83   4.740   3.313  -4.062
    4    HG1  THR  83           HG1      THR  83   4.502   2.782  -6.085
    5   HG22  THR  83          HG21      THR  83   4.337   0.648  -4.391
    6   HG21  THR  83          HG22      THR  83   3.046   1.007  -3.247
    7   HG23  THR  83          HG23      THR  83   4.721   1.378  -2.833

  No H/Q in entry =           7
  In of MODEL   10
    1    H    SER  84           H        SER  84   2.247   4.607  -5.881
    2    HA   SER  84           HA       SER  84   3.549   7.069  -5.432
    3    HB2  SER  84           HB2      SER  84   1.485   6.202  -7.443
    4    HB3  SER  84           HB3      SER  84   2.137   7.840  -7.421
    5    HG   SER  84           HG       SER  84   3.548   5.387  -7.716

  No H/Q in entry =           5
  In of MODEL   10
    1    H    MET  85           H        MET  85   0.068   6.257  -5.247
    2    HA   MET  85           HA       MET  85  -0.833   8.853  -4.644
    3    HB2  MET  85           HB2      MET  85  -2.331   7.023  -5.307
    4    HB3  MET  85           HB3      MET  85  -2.021   6.218  -3.770
    5    HG2  MET  85           HG2      MET  85  -2.930   8.171  -2.561
    6    HG3  MET  85           HG3      MET  85  -3.234   8.978  -4.098
    7    HE2  MET  85           HE1      MET  85  -5.540   5.562  -2.141
    8    HE1  MET  85           HE2      MET  85  -4.412   6.705  -1.415
    9    HE3  MET  85           HE3      MET  85  -3.804   5.407  -2.439

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LEU  86           H        LEU  86   0.136   6.207  -2.503
    2    HA   LEU  86           HA       LEU  86  -0.409   7.502  -0.059
    3    HB2  LEU  86           HB2      LEU  86   0.092   5.039  -0.454
    4    HB3  LEU  86           HB3      LEU  86   1.792   5.495  -0.555
    5    HG   LEU  86           HG       LEU  86   1.457   6.651   1.714
    6   HD11  LEU  86          HD11      LEU  86  -1.226   5.844   1.252
    7   HD13  LEU  86          HD12      LEU  86  -0.567   6.602   2.700
    8   HD12  LEU  86          HD13      LEU  86  -0.631   4.845   2.582
    9   HD23  LEU  86          HD21      LEU  86   1.075   3.653   1.838
   10   HD22  LEU  86          HD22      LEU  86   2.066   4.678   2.874
   11   HD21  LEU  86          HD23      LEU  86   2.565   4.360   1.214

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ALA  87           H        ALA  87   2.569   7.252  -1.959
    2    HA   ALA  87           HA       ALA  87   4.260   8.688  -0.241
    3    HB3  ALA  87           HB1      ALA  87   4.361   7.676  -2.948
    4    HB2  ALA  87           HB2      ALA  87   5.694   8.026  -1.852
    5    HB1  ALA  87           HB3      ALA  87   5.057   9.297  -2.895

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ARG  88           H        ARG  88   2.287   9.795  -2.955
    2    HA   ARG  88           HA       ARG  88   3.023  12.495  -2.841
    3    HB2  ARG  88           HB2      ARG  88   1.778  11.324  -4.694
    4    HB3  ARG  88           HB3      ARG  88   0.323  11.447  -3.705
    5    HG2  ARG  88           HG2      ARG  88   1.306  14.042  -3.626
    6    HG3  ARG  88           HG3      ARG  88   1.731  13.533  -5.258
    7    HD2  ARG  88           HD2      ARG  88  -0.414  13.583  -5.948
    8    HD3  ARG  88           HD3      ARG  88  -0.983  12.722  -4.517
    9    HE   ARG  88           HE       ARG  88  -1.213  15.497  -4.935
   10   HH21  ARG  88          HH11      ARG  88  -1.752  16.819  -3.195
   11   HH22  ARG  88          HH12      ARG  88  -1.443  16.286  -1.579
   12   HH11  ARG  88          HH21      ARG  88  -0.157  13.249  -2.564
   13   HH12  ARG  88          HH22      ARG  88  -0.557  14.259  -1.222

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLU  89           H        GLU  89   0.349  10.784  -1.191
    2    HA   GLU  89           HA       GLU  89  -0.786  13.080   0.018
    3    HB2  GLU  89           HB2      GLU  89  -1.873  10.826  -0.064
    4    HB3  GLU  89           HB3      GLU  89  -0.737  10.286   1.173
    5    HG2  GLU  89           HG2      GLU  89  -1.574  11.974   2.735
    6    HG3  GLU  89           HG3      GLU  89  -2.640  12.630   1.495

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LEU  90           H        LEU  90   1.701  10.821   1.183
    2    HA   LEU  90           HA       LEU  90   2.050  12.071   3.711
    3    HB2  LEU  90           HB2      LEU  90   3.840  10.320   2.027
    4    HB3  LEU  90           HB3      LEU  90   4.258  10.842   3.664
    5    HG   LEU  90           HG       LEU  90   1.639   9.462   3.013
    6   HD12  LEU  90          HD11      LEU  90   2.810   7.431   4.017
    7   HD11  LEU  90          HD12      LEU  90   4.320   8.307   3.769
    8   HD13  LEU  90          HD13      LEU  90   3.308   7.887   2.387
    9   HD22  LEU  90          HD21      LEU  90   1.371  10.382   5.136
   10   HD21  LEU  90          HD22      LEU  90   3.091  10.297   5.512
   11   HD23  LEU  90          HD23      LEU  90   2.104   8.837   5.564

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  91           H        ILE  91   3.636  12.474   0.578
    2    HA   ILE  91           HA       ILE  91   5.592  14.331   1.410
    3    HB   ILE  91           HB       ILE  91   4.277  13.823  -1.265
    4   HG12  ILE  91          HG12      ILE  91   7.119  13.372  -0.302
    5   HG13  ILE  91          HG13      ILE  91   5.853  12.158  -0.135
    6   HG22  ILE  91          HG21      ILE  91   6.480  15.198  -1.962
    7   HG21  ILE  91          HG22      ILE  91   6.166  15.995  -0.420
    8   HG23  ILE  91          HG23      ILE  91   4.937  16.008  -1.684
    9   HD13  ILE  91          HD11      ILE  91   5.675  11.833  -2.441
   10   HD12  ILE  91          HD12      ILE  91   7.407  12.097  -2.234
   11   HD11  ILE  91          HD13      ILE  91   6.378  13.408  -2.817

  No H/Q in entry =          11
  In of MODEL   10
    1    H    THR  92           H        THR  92   2.221  14.721   0.415
    2    HA   THR  92           HA       THR  92   2.160  17.543   0.355
    3    HB   THR  92           HB       THR  92   0.020  15.522   1.062
    4    HG1  THR  92           HG1      THR  92   0.319  15.347  -1.024
    5   HG22  THR  92          HG21      THR  92  -1.410  17.666   0.346
    6   HG21  THR  92          HG22      THR  92  -0.026  18.509   1.038
    7   HG23  THR  92          HG23      THR  92  -0.949  17.376   2.023

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLU  93           H        GLU  93   1.650  15.236   3.011
    2    HA   GLU  93           HA       GLU  93   1.103  17.134   5.031
    3    HB2  GLU  93           HB2      GLU  93   2.450  14.425   5.262
    4    HB3  GLU  93           HB3      GLU  93   1.753  15.344   6.598
    5    HG2  GLU  93           HG2      GLU  93   0.141  14.546   4.165
    6    HG3  GLU  93           HG3      GLU  93   0.261  13.525   5.593

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LEU  94           H        LEU  94   4.123  15.689   3.870
    2    HA   LEU  94           HA       LEU  94   5.867  16.857   5.751
    3    HB2  LEU  94           HB2      LEU  94   6.269  15.895   2.918
    4    HB3  LEU  94           HB3      LEU  94   7.594  16.569   3.863
    5    HG   LEU  94           HG       LEU  94   5.886  14.352   5.004
    6   HD11  LEU  94          HD11      LEU  94   7.976  14.152   2.865
    7   HD13  LEU  94          HD12      LEU  94   6.543  13.161   3.132
    8   HD12  LEU  94          HD13      LEU  94   7.975  12.925   4.133
    9   HD23  LEU  94          HD21      LEU  94   8.086  13.842   6.148
   10   HD22  LEU  94          HD22      LEU  94   7.402  15.412   6.567
   11   HD21  LEU  94          HD23      LEU  94   8.737  15.308   5.420

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  95           H        ILE  95   4.701  18.015   2.606
    2    HA   ILE  95           HA       ILE  95   6.244  20.392   2.540
    3    HB   ILE  95           HB       ILE  95   3.603  19.676   1.245
    4   HG12  ILE  95          HG12      ILE  95   6.383  20.047   0.097
    5   HG13  ILE  95          HG13      ILE  95   5.755  18.486   0.614
    6   HG21  ILE  95          HG21      ILE  95   5.321  22.164   1.018
    7   HG23  ILE  95          HG22      ILE  95   3.599  22.075   1.381
    8   HG22  ILE  95          HG23      ILE  95   4.180  21.682  -0.237
    9   HD13  ILE  95          HD11      ILE  95   4.189  18.391  -1.109
   10   HD12  ILE  95          HD12      ILE  95   5.525  19.226  -1.902
   11   HD11  ILE  95          HD13      ILE  95   4.143  20.143  -1.304

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLU  96           H        GLU  96   3.008  19.700   3.848
    2    HA   GLU  96           HA       GLU  96   2.359  22.339   4.602
    3    HB2  GLU  96           HB2      GLU  96   0.706  20.536   4.620
    4    HB3  GLU  96           HB3      GLU  96   1.583  19.719   5.912
    5    HG2  GLU  96           HG2      GLU  96   0.553  20.990   7.485
    6    HG3  GLU  96           HG3      GLU  96   1.067  22.470   6.686

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LEU  97           H        LEU  97   4.238  19.811   6.220
    2    HA   LEU  97           HA       LEU  97   4.589  21.164   8.689
    3    HB2  LEU  97           HB2      LEU  97   6.147  19.013   7.269
    4    HB3  LEU  97           HB3      LEU  97   6.734  19.705   8.778
    5    HG   LEU  97           HG       LEU  97   3.937  18.578   8.478
    6   HD12  LEU  97          HD11      LEU  97   4.905  16.577   9.687
    7   HD11  LEU  97          HD12      LEU  97   6.508  17.227   9.337
    8   HD13  LEU  97          HD13      LEU  97   5.438  16.757   8.016
    9   HD23  LEU  97          HD21      LEU  97   4.403  18.289  11.041
   10   HD22  LEU  97          HD22      LEU  97   4.001  19.896  10.438
   11   HD21  LEU  97          HD23      LEU  97   5.679  19.476  10.777

  No H/Q in entry =          11
  In of MODEL   10
    1    H    HIS  98           H        HIS  98   6.448  21.202   5.656
    2    HA   HIS  98           HA       HIS  98   8.586  22.806   6.547
    3    HB2  HIS  98           HB2      HIS  98   7.286  22.536   3.826
    4    HB3  HIS  98           HB3      HIS  98   8.715  23.531   4.111
    5    HD1  HIS  98           HD1      HIS  98   7.546  19.947   4.135
    6    HD2  HIS  98           HD2      HIS  98  11.104  22.085   4.547
    7    HE1  HIS  98           HE1      HIS  98   9.420  18.239   4.071
    8    HE2  HIS  98           HE2      HIS  98  11.591  19.520   4.322

  No H/Q in entry =           8
  In of MODEL   10
    1    H    GLU  99           H        GLU  99   5.351  23.604   5.384
    2    HA   GLU  99           HA       GLU  99   5.698  26.423   5.325
    3    HB2  GLU  99           HB2      GLU  99   3.828  25.232   4.202
    4    HB3  GLU  99           HB3      GLU  99   3.142  24.863   5.784
    5    HG2  GLU  99           HG2      GLU  99   2.937  27.253   6.285
    6    HG3  GLU  99           HG3      GLU  99   3.702  27.662   4.753

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LYS 100           H        LYS 100   4.602  24.175   7.851
    2    HA   LYS 100           HA       LYS 100   4.000  26.222   9.748
    3    HB2  LYS 100           HB2      LYS 100   4.610  23.277  10.091
    4    HB3  LYS 100           HB3      LYS 100   4.156  24.345  11.425
    5    HG2  LYS 100           HG2      LYS 100   2.078  24.959  10.185
    6    HG3  LYS 100           HG3      LYS 100   2.513  23.795   8.931
    7    HD2  LYS 100           HD2      LYS 100   2.463  21.974  10.592
    8    HD3  LYS 100           HD3      LYS 100   2.044  23.132  11.857
    9    HE2  LYS 100           HE2      LYS 100  -0.020  23.730  10.602
   10    HE3  LYS 100           HE3      LYS 100   0.389  22.515   9.385
   11    HZ1  LYS 100           HZ1      LYS 100   0.141  21.845  12.267
   12    HZ3  LYS 100           HZ2      LYS 100   0.133  20.791  10.932
   13    HZ2  LYS 100           HZ3      LYS 100  -1.193  21.815  11.217

  No H/Q in entry =          13
  In of MODEL   10
    1    H    LEU 101           H        LEU 101   6.940  24.459   8.902
    2    HA   LEU 101           HA       LEU 101   8.538  25.317  11.100
    3    HB2  LEU 101           HB2      LEU 101   9.133  24.337   8.319
    4    HB3  LEU 101           HB3      LEU 101  10.431  25.017   9.296
    5    HG   LEU 101           HG       LEU 101   8.627  22.840  10.366
    6   HD12  LEU 101          HD11      LEU 101  10.695  21.368   9.750
    7   HD11  LEU 101          HD12      LEU 101  11.043  22.635   8.576
    8   HD13  LEU 101          HD13      LEU 101   9.524  21.745   8.488
    9   HD21  LEU 101          HD21      LEU 101  11.341  23.978  11.084
   10   HD23  LEU 101          HD22      LEU 101  10.818  22.400  11.665
   11   HD22  LEU 101          HD23      LEU 101   9.911  23.846  12.107

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LYS 102           H        LYS 102   6.926  27.163   8.965
    2    HA   LYS 102           HA       LYS 102   6.978  29.457   8.674
    3    HB2  LYS 102           HB2      LYS 102   8.551  29.358  10.766
    4    HB3  LYS 102           HB3      LYS 102   9.844  29.567   9.601
    5    HG2  LYS 102           HG2      LYS 102   7.721  31.497  10.472
    6    HG3  LYS 102           HG3      LYS 102   9.429  31.775  10.214
    7    HD2  LYS 102           HD2      LYS 102   7.474  31.332   7.921
    8    HD3  LYS 102           HD3      LYS 102   7.843  32.915   8.588
    9    HE2  LYS 102           HE2      LYS 102   9.220  31.746   6.509
   10    HE3  LYS 102           HE3      LYS 102   9.827  33.059   7.518
   11    HZ2  LYS 102           HZ1      LYS 102  11.367  31.171   7.337
   12    HZ1  LYS 102           HZ2      LYS 102  10.218  30.176   8.084
   13    HZ3  LYS 102           HZ3      LYS 102  10.900  31.470   8.941

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ALA 103           H        ALA 103  10.246  28.153   8.096
    2    HA   ALA 103           HA       ALA 103  11.188  29.540   6.017
    3    HB2  ALA 103           HB1      ALA 103  12.093  27.336   5.085
    4    HB1  ALA 103           HB2      ALA 103  11.211  26.552   6.395
    5    HB3  ALA 103           HB3      ALA 103  12.490  27.709   6.763

  No H/Q in entry =           5
  In of MODEL   10
    1    H1   LYS   3           H1       LYS   3 -30.794   6.251 -19.888
    2    H2   LYS   3           H3       LYS   3 -29.806   5.913 -21.227
    3    H3   LYS   3           H2       LYS   3 -31.226   5.018 -20.973
    4    HA   LYS   3           HA       LYS   3 -30.268   3.628 -19.538
    5    HB2  LYS   3           HB2      LYS   3 -27.942   4.958 -20.880
    6    HB3  LYS   3           HB3      LYS   3 -27.656   3.763 -19.614
    7    HG2  LYS   3           HG2      LYS   3 -29.112   2.192 -20.946
    8    HG3  LYS   3           HG3      LYS   3 -29.027   3.367 -22.257
    9    HD2  LYS   3           HD2      LYS   3 -26.549   3.190 -22.188
   10    HD3  LYS   3           HD3      LYS   3 -26.709   1.916 -20.980
   11    HE2  LYS   3           HE2      LYS   3 -28.228   0.749 -22.686
   12    HE3  LYS   3           HE3      LYS   3 -27.570   1.891 -23.858
   13    HZ3  LYS   3           HZ1      LYS   3 -25.803   0.612 -24.095
   14    HZ2  LYS   3           HZ2      LYS   3 -26.469  -0.522 -23.019
   15    HZ1  LYS   3           HZ3      LYS   3 -25.451   0.706 -22.436

  No H/Q in entry =          15
  In of MODEL   10
    1    H    LYS   4           H        LYS   4 -30.336   3.524 -17.475
    2    HA   LYS   4           HA       LYS   4 -29.555   5.819 -15.860
    3    HB2  LYS   4           HB2      LYS   4 -30.832   3.172 -15.121
    4    HB3  LYS   4           HB3      LYS   4 -30.582   4.523 -14.017
    5    HG2  LYS   4           HG2      LYS   4 -32.376   4.468 -16.449
    6    HG3  LYS   4           HG3      LYS   4 -32.875   4.561 -14.761
    7    HD2  LYS   4           HD2      LYS   4 -32.120   6.768 -14.529
    8    HD3  LYS   4           HD3      LYS   4 -31.075   6.656 -15.944
    9    HE2  LYS   4           HE2      LYS   4 -32.960   8.073 -16.442
   10    HE3  LYS   4           HE3      LYS   4 -33.074   6.587 -17.385
   11    HZ3  LYS   4           HZ1      LYS   4 -34.683   5.745 -15.832
   12    HZ2  LYS   4           HZ2      LYS   4 -35.193   7.246 -16.446
   13    HZ1  LYS   4           HZ3      LYS   4 -34.550   7.144 -14.878

  No H/Q in entry =          13
  In of MODEL   10
    1    H    HIS   5           H        HIS   5 -28.094   5.892 -14.261
    2    HA   HIS   5           HA       HIS   5 -25.861   3.994 -14.547
    3    HB2  HIS   5           HB2      HIS   5 -26.046   6.776 -13.389
    4    HB3  HIS   5           HB3      HIS   5 -24.591   5.781 -13.347
    5    HD1  HIS   5           HD1      HIS   5 -23.079   6.910 -14.948
    6    HD2  HIS   5           HD2      HIS   5 -26.887   6.370 -16.515
    7    HE1  HIS   5           HE1      HIS   5 -22.881   7.442 -17.407
    8    HE2  HIS   5           HE2      HIS   5 -25.203   7.101 -18.330

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ILE   6           H        ILE   6 -25.685   2.439 -13.201
    2    HA   ILE   6           HA       ILE   6 -26.668   2.783 -10.448
    3    HB   ILE   6           HB       ILE   6 -25.906   0.267 -11.937
    4   HG12  ILE   6          HG12      ILE   6 -28.626   1.297 -11.120
    5   HG13  ILE   6          HG13      ILE   6 -27.970   1.411 -12.753
    6   HG23  ILE   6          HG21      ILE   6 -26.326  -0.941 -10.058
    7   HG22  ILE   6          HG22      ILE   6 -27.453   0.249  -9.406
    8   HG21  ILE   6          HG23      ILE   6 -25.716   0.537  -9.312
    9   HD13  ILE   6          HD11      ILE   6 -28.488  -0.702 -13.219
   10   HD12  ILE   6          HD12      ILE   6 -29.511  -0.631 -11.783
   11   HD11  ILE   6          HD13      ILE   6 -27.876  -1.284 -11.671

  No H/Q in entry =          11
  In of MODEL   10
    1    H    TYR   7           H        TYR   7 -24.899   3.395  -9.162
    2    HA   TYR   7           HA       TYR   7 -22.213   2.347  -9.808
    3    HB2  TYR   7           HB2      TYR   7 -23.114   4.834  -8.375
    4    HB3  TYR   7           HB3      TYR   7 -21.444   4.269  -8.394
    5    HD1  TYR   7           HD1      TYR   7 -22.493   3.303 -11.474
    6    HD2  TYR   7           HD2      TYR   7 -21.731   6.893  -9.306
    7    HE1  TYR   7           HE1      TYR   7 -22.013   4.483 -13.584
    8    HE2  TYR   7           HE2      TYR   7 -21.293   8.080 -11.408
    9    HH   TYR   7           HH       TYR   7 -21.502   7.961 -13.639

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LEU   8           H        LEU   8 -21.295   0.991  -8.449
    2    HA   LEU   8           HA       LEU   8 -22.456   0.577  -5.765
    3    HB2  LEU   8           HB2      LEU   8 -20.792  -1.167  -7.559
    4    HB3  LEU   8           HB3      LEU   8 -20.998  -1.513  -5.843
    5    HG   LEU   8           HG       LEU   8 -23.480  -1.620  -6.278
    6   HD13  LEU   8          HD11      LEU   8 -23.562  -0.438  -8.409
    7   HD12  LEU   8          HD12      LEU   8 -24.140  -2.090  -8.623
    8   HD11  LEU   8          HD13      LEU   8 -22.515  -1.649  -9.146
    9   HD23  LEU   8          HD21      LEU   8 -22.257  -3.727  -7.927
   10   HD22  LEU   8          HD22      LEU   8 -23.356  -3.839  -6.553
   11   HD21  LEU   8          HD23      LEU   8 -21.641  -3.532  -6.286

  No H/Q in entry =          11
  In of MODEL   10
    1    H    PHE   9           H        PHE   9 -21.190   0.979  -3.986
    2    HA   PHE   9           HA       PHE   9 -18.371   1.814  -4.483
    3    HB2  PHE   9           HB2      PHE   9 -20.336   2.980  -2.511
    4    HB3  PHE   9           HB3      PHE   9 -18.630   3.393  -2.595
    5    HD1  PHE   9           HD1      PHE   9 -17.736   4.715  -4.412
    6    HD2  PHE   9           HD2      PHE   9 -21.891   3.653  -4.311
    7    HE1  PHE   9           HE1      PHE   9 -18.196   6.345  -6.219
    8    HE2  PHE   9           HE2      PHE   9 -22.354   5.296  -6.113
    9    HZ   PHE   9           HZ       PHE   9 -20.504   6.638  -7.073

  No H/Q in entry =           9
  In of MODEL   10
    1    H    SER  10           H        SER  10 -16.833   0.835  -3.341
    2    HA   SER  10           HA       SER  10 -17.094   0.001  -0.631
    3    HB2  SER  10           HB2      SER  10 -18.354  -1.850  -1.663
    4    HB3  SER  10           HB3      SER  10 -16.993  -2.170  -2.726
    5    HG   SER  10           HG       SER  10 -15.741  -2.582  -0.872

  No H/Q in entry =           5
  In of MODEL   10
    1    H    SER  11           H        SER  11 -15.082   0.082   0.223
    2    HA   SER  11           HA       SER  11 -12.865   0.865  -1.288
    3    HB2  SER  11           HB2      SER  11 -13.386   0.920   1.303
    4    HB3  SER  11           HB3      SER  11 -12.424  -0.560   1.283
    5    HG   SER  11           HG       SER  11 -11.300   1.566   1.521

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA  12           H        ALA  12 -14.139  -1.823  -2.089
    2    HA   ALA  12           HA       ALA  12 -11.580  -3.095  -2.640
    3    HB2  ALA  12           HB1      ALA  12 -12.211  -5.290  -1.852
    4    HB1  ALA  12           HB2      ALA  12 -13.803  -4.706  -1.366
    5    HB3  ALA  12           HB3      ALA  12 -12.363  -4.147  -0.514

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLY  13           H        GLY  13 -12.315  -2.135  -4.679
    2    HA3  GLY  13           HA2      GLY  13 -14.593  -2.796  -6.123
    3    HA2  GLY  13           HA3      GLY  13 -13.038  -2.384  -6.859

  No H/Q in entry =           3
  In of MODEL   10
    1    H    MET  14           H        MET  14 -11.562  -4.670  -5.917
    2    HA   MET  14           HA       MET  14 -11.995  -6.446  -7.999
    3    HB2  MET  14           HB2      MET  14  -9.920  -6.534  -6.720
    4    HB3  MET  14           HB3      MET  14 -10.773  -7.159  -5.309
    5    HG2  MET  14           HG2      MET  14 -11.404  -9.178  -6.602
    6    HG3  MET  14           HG3      MET  14 -10.548  -8.543  -8.007
    7    HE3  MET  14           HE1      MET  14  -7.050  -8.710  -7.526
    8    HE2  MET  14           HE2      MET  14  -7.586  -7.345  -6.550
    9    HE1  MET  14           HE3      MET  14  -8.429  -7.732  -8.048

  No H/Q in entry =           9
  In of MODEL   10
    1    H    SER  15           H        SER  15 -13.202  -6.898  -4.667
    2    HA   SER  15           HA       SER  15 -14.583  -9.330  -5.380
    3    HB2  SER  15           HB2      SER  15 -14.096  -9.191  -3.062
    4    HB3  SER  15           HB3      SER  15 -14.750  -7.560  -2.944
    5    HG   SER  15           HG       SER  15 -16.249  -9.907  -3.561

  No H/Q in entry =           5
  In of MODEL   10
    1    H    THR  16           H        THR  16 -15.606  -5.933  -4.968
    2    HA   THR  16           HA       THR  16 -18.408  -6.378  -5.469
    3    HB   THR  16           HB       THR  16 -16.798  -3.861  -6.027
    4    HG1  THR  16           HG1      THR  16 -16.346  -4.228  -3.965
    5   HG22  THR  16          HG21      THR  16 -19.012  -2.829  -5.333
    6   HG21  THR  16          HG22      THR  16 -19.708  -4.457  -5.427
    7   HG23  THR  16          HG23      THR  16 -19.029  -3.688  -6.869

  No H/Q in entry =           7
  In of MODEL   10
    1    H    SER  17           H        SER  17 -15.589  -5.912  -7.338
    2    HA   SER  17           HA       SER  17 -16.678  -5.185  -9.861
    3    HB2  SER  17           HB2      SER  17 -14.092  -6.565  -9.113
    4    HB3  SER  17           HB3      SER  17 -14.509  -6.149 -10.776
    5    HG   SER  17           HG       SER  17 -14.874  -4.063  -9.088

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU  18           H        LEU  18 -16.210  -8.318  -8.353
    2    HA   LEU  18           HA       LEU  18 -16.822  -9.842 -10.685
    3    HB2  LEU  18           HB2      LEU  18 -15.644 -10.806  -8.760
    4    HB3  LEU  18           HB3      LEU  18 -17.070 -10.548  -7.756
    5    HG   LEU  18           HG       LEU  18 -18.345 -12.110  -9.137
    6   HD12  LEU  18          HD11      LEU  18 -16.828 -13.515 -10.744
    7   HD11  LEU  18          HD12      LEU  18 -15.817 -12.070 -10.750
    8   HD13  LEU  18          HD13      LEU  18 -17.490 -11.978 -11.297
    9   HD22  LEU  18          HD21      LEU  18 -17.283 -14.123  -8.422
   10   HD21  LEU  18          HD22      LEU  18 -17.043 -12.878  -7.194
   11   HD23  LEU  18          HD23      LEU  18 -15.726 -13.304  -8.286

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LEU  19           H        LEU  19 -18.775  -8.531  -8.010
    2    HA   LEU  19           HA       LEU  19 -21.265  -9.658  -8.840
    3    HB2  LEU  19           HB2      LEU  19 -20.950  -8.774  -6.598
    4    HB3  LEU  19           HB3      LEU  19 -20.683  -7.161  -7.254
    5    HG   LEU  19           HG       LEU  19 -22.999  -6.972  -7.883
    6   HD12  LEU  19          HD11      LEU  19 -24.484  -8.941  -6.910
    7   HD11  LEU  19          HD12      LEU  19 -23.025  -9.879  -7.225
    8   HD13  LEU  19          HD13      LEU  19 -23.819  -9.017  -8.541
    9   HD23  LEU  19          HD21      LEU  19 -24.021  -7.271  -5.572
   10   HD22  LEU  19          HD22      LEU  19 -22.589  -6.247  -5.697
   11   HD21  LEU  19          HD23      LEU  19 -22.444  -7.895  -5.084

  No H/Q in entry =          11
  In of MODEL   10
    1    H    VAL  20           H        VAL  20 -19.675  -6.555  -9.580
    2    HA   VAL  20           HA       VAL  20 -21.745  -5.482 -11.183
    3    HB   VAL  20           HB       VAL  20 -18.739  -4.979 -11.314
    4   HG11  VAL  20          HG11      VAL  20 -21.007  -3.538 -12.713
    5   HG13  VAL  20          HG12      VAL  20 -19.672  -4.399 -13.477
    6   HG12  VAL  20          HG13      VAL  20 -19.365  -2.912 -12.582
    7   HG23  VAL  20          HG21      VAL  20 -19.525  -2.763 -10.315
    8   HG22  VAL  20          HG22      VAL  20 -19.516  -4.180  -9.267
    9   HG21  VAL  20          HG23      VAL  20 -21.033  -3.608  -9.961

  No H/Q in entry =           9
  In of MODEL   10
    1    H    SER  21           H        SER  21 -19.039  -7.628 -12.153
    2    HA   SER  21           HA       SER  21 -19.802  -7.543 -14.911
    3    HB2  SER  21           HB2      SER  21 -18.418  -9.554 -15.200
    4    HB3  SER  21           HB3      SER  21 -17.562  -8.317 -14.283
    5    HG   SER  21           HG       SER  21 -17.592  -9.532 -12.575

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LYS  22           H        LYS  22 -20.946  -9.651 -12.309
    2    HA   LYS  22           HA       LYS  22 -22.519 -11.258 -14.113
    3    HB2  LYS  22           HB2      LYS  22 -21.771 -11.875 -11.732
    4    HB3  LYS  22           HB3      LYS  22 -23.120 -10.876 -11.194
    5    HG2  LYS  22           HG2      LYS  22 -24.063 -12.972 -11.174
    6    HG3  LYS  22           HG3      LYS  22 -24.525 -12.394 -12.775
    7    HD2  LYS  22           HD2      LYS  22 -23.751 -14.467 -13.337
    8    HD3  LYS  22           HD3      LYS  22 -22.246 -13.555 -13.462
    9    HE2  LYS  22           HE2      LYS  22 -21.448 -15.221 -12.148
   10    HE3  LYS  22           HE3      LYS  22 -22.146 -14.245 -10.855
   11    HZ3  LYS  22           HZ1      LYS  22 -23.363 -15.979 -10.310
   12    HZ2  LYS  22           HZ2      LYS  22 -22.795 -16.868 -11.642
   13    HZ1  LYS  22           HZ3      LYS  22 -24.168 -15.880 -11.802

  No H/Q in entry =          13
  In of MODEL   10
    1    H    MET  23           H        MET  23 -23.169  -8.284 -12.302
    2    HA   MET  23           HA       MET  23 -25.975  -8.288 -12.828
    3    HB2  MET  23           HB2      MET  23 -24.064  -6.026 -12.282
    4    HB3  MET  23           HB3      MET  23 -25.803  -5.809 -12.476
    5    HG2  MET  23           HG2      MET  23 -26.245  -7.065 -10.487
    6    HG3  MET  23           HG3      MET  23 -24.549  -7.525 -10.342
    7    HE2  MET  23           HE1      MET  23 -26.745  -3.786  -9.234
    8    HE1  MET  23           HE2      MET  23 -27.018  -4.772 -10.669
    9    HE3  MET  23           HE3      MET  23 -25.941  -3.378 -10.751

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ARG  24           H        ARG  24 -23.166  -6.974 -14.616
    2    HA   ARG  24           HA       ARG  24 -24.610  -5.666 -16.648
    3    HB2  ARG  24           HB2      ARG  24 -22.157  -5.339 -16.251
    4    HB3  ARG  24           HB3      ARG  24 -21.869  -6.952 -16.856
    5    HG2  ARG  24           HG2      ARG  24 -22.716  -6.283 -19.108
    6    HG3  ARG  24           HG3      ARG  24 -22.996  -4.638 -18.478
    7    HD2  ARG  24           HD2      ARG  24 -20.547  -4.611 -17.765
    8    HD3  ARG  24           HD3      ARG  24 -20.361  -6.109 -18.668
    9    HE   ARG  24           HE       ARG  24 -21.391  -4.349 -20.474
   10   HH21  ARG  24          HH11      ARG  24 -19.994  -4.524 -22.227
   11   HH22  ARG  24          HH12      ARG  24 -18.295  -4.306 -21.993
   12   HH11  ARG  24          HH21      ARG  24 -18.661  -4.339 -18.473
   13   HH12  ARG  24          HH22      ARG  24 -17.517  -4.188 -19.769

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ALA  25           H        ALA  25 -23.593  -9.032 -16.307
    2    HA   ALA  25           HA       ALA  25 -24.228  -9.889 -18.934
    3    HB1  ALA  25           HB1      ALA  25 -23.601 -11.929 -18.199
    4    HB3  ALA  25           HB2      ALA  25 -24.667 -11.851 -16.796
    5    HB2  ALA  25           HB3      ALA  25 -23.087 -11.071 -16.746

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLN  26           H        GLN  26 -26.077  -9.819 -15.924
    2    HA   GLN  26           HA       GLN  26 -28.450 -10.965 -16.939
    3    HB2  GLN  26           HB2      GLN  26 -27.900  -9.194 -14.577
    4    HB3  GLN  26           HB3      GLN  26 -29.482  -9.873 -14.927
    5    HG2  GLN  26           HG2      GLN  26 -26.946 -11.402 -14.415
    6    HG3  GLN  26           HG3      GLN  26 -28.311 -11.238 -13.317
    7   HE21  GLN  26          HE21      GLN  26 -27.153 -13.462 -14.547
    8   HE22  GLN  26          HE22      GLN  26 -28.222 -14.489 -15.334

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ALA  27           H        ALA  27 -27.412  -7.592 -16.596
    2    HA   ALA  27           HA       ALA  27 -29.860  -6.435 -17.417
    3    HB1  ALA  27           HB1      ALA  27 -28.018  -5.159 -16.310
    4    HB3  ALA  27           HB2      ALA  27 -28.573  -4.400 -17.803
    5    HB2  ALA  27           HB3      ALA  27 -27.065  -5.314 -17.788

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLU  28           H        GLU  28 -27.186  -7.773 -19.245
    2    HA   GLU  28           HA       GLU  28 -28.069  -6.746 -21.788
    3    HB2  GLU  28           HB2      GLU  28 -25.718  -7.493 -21.135
    4    HB3  GLU  28           HB3      GLU  28 -26.314  -9.142 -21.314
    5    HG2  GLU  28           HG2      GLU  28 -25.128  -8.435 -23.285
    6    HG3  GLU  28           HG3      GLU  28 -26.833  -8.711 -23.642

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LYS  29           H        LYS  29 -28.346  -9.818 -20.083
    2    HA   LYS  29           HA       LYS  29 -29.679 -11.279 -22.074
    3    HB2  LYS  29           HB2      LYS  29 -28.676 -12.263 -20.047
    4    HB3  LYS  29           HB3      LYS  29 -29.932 -11.499 -19.073
    5    HG2  LYS  29           HG2      LYS  29 -31.628 -12.836 -20.132
    6    HG3  LYS  29           HG3      LYS  29 -30.441 -13.526 -21.236
    7    HD2  LYS  29           HD2      LYS  29 -29.349 -14.700 -19.476
    8    HD3  LYS  29           HD3      LYS  29 -30.237 -13.811 -18.241
    9    HE2  LYS  29           HE2      LYS  29 -31.062 -16.140 -18.572
   10    HE3  LYS  29           HE3      LYS  29 -32.299 -14.913 -18.845
   11    HZ1  LYS  29           HZ1      LYS  29 -31.721 -15.103 -21.265
   12    HZ3  LYS  29           HZ2      LYS  29 -32.490 -16.456 -20.583
   13    HZ2  LYS  29           HZ3      LYS  29 -30.818 -16.485 -20.868

  No H/Q in entry =          13
  In of MODEL   10
    1    H    TYR  30           H        TYR  30 -31.022  -9.091 -19.615
    2    HA   TYR  30           HA       TYR  30 -33.689  -9.476 -20.870
    3    HB2  TYR  30           HB2      TYR  30 -33.020  -8.300 -18.163
    4    HB3  TYR  30           HB3      TYR  30 -34.639  -8.516 -18.824
    5    HD1  TYR  30           HD1      TYR  30 -35.620 -10.783 -19.009
    6    HD2  TYR  30           HD2      TYR  30 -31.777 -10.154 -17.286
    7    HE1  TYR  30           HE1      TYR  30 -35.610 -13.099 -18.174
    8    HE2  TYR  30           HE2      TYR  30 -31.767 -12.456 -16.456
    9    HH   TYR  30           HH       TYR  30 -33.472 -14.781 -17.524

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLU  31           H        GLU  31 -31.456  -7.567 -21.684
    2    HA   GLU  31           HA       GLU  31 -31.308  -5.426 -22.540
    3    HB2  GLU  31           HB2      GLU  31 -34.221  -6.059 -23.065
    4    HB3  GLU  31           HB3      GLU  31 -33.333  -4.730 -23.809
    5    HG2  GLU  31           HG2      GLU  31 -31.897  -6.232 -24.966
    6    HG3  GLU  31           HG3      GLU  31 -32.512  -7.613 -24.059

  No H/Q in entry =           6
  In of MODEL   10
    1    H    VAL  32           H        VAL  32 -31.524  -5.275 -19.811
    2    HA   VAL  32           HA       VAL  32 -33.325  -3.095 -19.201
    3    HB   VAL  32           HB       VAL  32 -30.976  -4.136 -17.586
    4   HG12  VAL  32          HG11      VAL  32 -32.499  -3.236 -15.715
    5   HG11  VAL  32          HG12      VAL  32 -33.296  -2.327 -17.000
    6   HG13  VAL  32          HG13      VAL  32 -31.582  -2.070 -16.671
    7   HG21  VAL  32          HG21      VAL  32 -32.791  -5.813 -18.260
    8   HG23  VAL  32          HG22      VAL  32 -33.814  -4.935 -17.122
    9   HG22  VAL  32          HG23      VAL  32 -32.324  -5.697 -16.564

  No H/Q in entry =           9
  In of MODEL   10
    1    HA   PRO  33           HA       PRO  33 -30.193  -0.287 -20.896
    2    HB2  PRO  33           HB2      PRO  33 -31.638   1.982 -20.819
    3    HB3  PRO  33           HB3      PRO  33 -32.137   0.677 -21.895
    4    HG2  PRO  33           HG2      PRO  33 -33.111   1.267 -19.100
    5    HG3  PRO  33           HG3      PRO  33 -34.070   1.064 -20.565
    6    HD2  PRO  33           HD2      PRO  33 -33.689  -0.995 -18.864
    7    HD3  PRO  33           HD3      PRO  33 -33.745  -1.261 -20.606

  No H/Q in entry =           7
  In of MODEL   10
    1    H    VAL  34           H        VAL  34 -28.960  -0.838 -18.929
    2    HA   VAL  34           HA       VAL  34 -28.617   1.604 -17.317
    3    HB   VAL  34           HB       VAL  34 -28.093   0.156 -15.352
    4   HG12  VAL  34          HG11      VAL  34 -30.533  -0.640 -15.051
    5   HG11  VAL  34          HG12      VAL  34 -30.815   0.104 -16.623
    6   HG13  VAL  34          HG13      VAL  34 -30.244   1.085 -15.273
    7   HG21  VAL  34          HG21      VAL  34 -28.325  -1.895 -17.331
    8   HG23  VAL  34          HG22      VAL  34 -29.402  -2.204 -15.968
    9   HG22  VAL  34          HG23      VAL  34 -27.677  -1.963 -15.691

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ILE  35           H        ILE  35 -26.635   1.993 -16.469
    2    HA   ILE  35           HA       ILE  35 -24.361   0.578 -17.693
    3    HB   ILE  35           HB       ILE  35 -24.682   3.490 -16.930
    4   HG12  ILE  35          HG12      ILE  35 -23.720   2.116 -19.447
    5   HG13  ILE  35          HG13      ILE  35 -25.333   2.787 -19.210
    6   HG21  ILE  35          HG21      ILE  35 -22.164   1.878 -17.196
    7   HG23  ILE  35          HG22      ILE  35 -22.592   3.090 -15.989
    8   HG22  ILE  35          HG23      ILE  35 -22.183   3.587 -17.630
    9   HD11  ILE  35          HD11      ILE  35 -23.873   4.949 -18.631
   10   HD13  ILE  35          HD12      ILE  35 -24.408   4.556 -20.265
   11   HD12  ILE  35          HD13      ILE  35 -22.773   4.146 -19.752

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ILE  36           H        ILE  36 -23.173  -0.457 -16.070
    2    HA   ILE  36           HA       ILE  36 -23.616   0.216 -13.212
    3    HB   ILE  36           HB       ILE  36 -22.860  -2.527 -14.273
    4   HG12  ILE  36          HG12      ILE  36 -25.648  -1.628 -13.542
    5   HG13  ILE  36          HG13      ILE  36 -25.063  -1.650 -15.206
    6   HG23  ILE  36          HG21      ILE  36 -23.250  -3.312 -12.149
    7   HG22  ILE  36          HG22      ILE  36 -24.341  -1.989 -11.739
    8   HG21  ILE  36          HG23      ILE  36 -22.602  -1.709 -11.801
    9   HD13  ILE  36          HD11      ILE  36 -25.292  -3.861 -15.379
   10   HD12  ILE  36          HD12      ILE  36 -26.364  -3.687 -13.991
   11   HD11  ILE  36          HD13      ILE  36 -24.680  -4.153 -13.752

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLU  37           H        GLU  37 -21.824   0.810 -12.104
    2    HA   GLU  37           HA       GLU  37 -19.152  -0.078 -12.987
    3    HB2  GLU  37           HB2      GLU  37 -19.992   2.747 -12.361
    4    HB3  GLU  37           HB3      GLU  37 -18.311   2.215 -12.424
    5    HG2  GLU  37           HG2      GLU  37 -18.471   1.777 -14.762
    6    HG3  GLU  37           HG3      GLU  37 -20.207   2.089 -14.747

  No H/Q in entry =           6
  In of MODEL   10
    1    H    ALA  38           H        ALA  38 -17.684  -0.331 -11.290
    2    HA   ALA  38           HA       ALA  38 -18.729  -0.081  -8.530
    3    HB1  ALA  38           HB1      ALA  38 -17.062  -2.090  -9.914
    4    HB3  ALA  38           HB2      ALA  38 -18.128  -2.273  -8.520
    5    HB2  ALA  38           HB3      ALA  38 -16.498  -1.634  -8.306

  No H/Q in entry =           5
  In of MODEL   10
    1    H    PHE  39           H        PHE  39 -17.466   1.117  -7.067
    2    HA   PHE  39           HA       PHE  39 -14.902   2.233  -7.963
    3    HB2  PHE  39           HB2      PHE  39 -17.056   3.912  -6.682
    4    HB3  PHE  39           HB3      PHE  39 -15.482   4.455  -7.261
    5    HD1  PHE  39           HD1      PHE  39 -15.075   4.858  -9.577
    6    HD2  PHE  39           HD2      PHE  39 -18.846   3.388  -8.235
    7    HE1  PHE  39           HE1      PHE  39 -16.063   5.413 -11.782
    8    HE2  PHE  39           HE2      PHE  39 -19.844   3.929 -10.427
    9    HZ   PHE  39           HZ       PHE  39 -18.452   4.913 -12.218

  No H/Q in entry =           9
  In of MODEL   10
    1    HA   PRO  40           HA       PRO  40 -14.015   1.521  -3.658
    2    HB2  PRO  40           HB2      PRO  40 -12.198   3.495  -3.070
    3    HB3  PRO  40           HB3      PRO  40 -11.783   2.137  -4.115
    4    HG2  PRO  40           HG2      PRO  40 -12.730   4.887  -4.908
    5    HG3  PRO  40           HG3      PRO  40 -11.320   4.002  -5.490
    6    HD2  PRO  40           HD2      PRO  40 -13.534   3.948  -6.916
    7    HD3  PRO  40           HD3      PRO  40 -12.621   2.456  -6.696

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLU  41           H        GLU  41 -14.624   2.548  -1.549
    2    HA   GLU  41           HA       GLU  41 -16.822   4.310  -1.575
    3    HB2  GLU  41           HB2      GLU  41 -16.666   4.297   0.817
    4    HB3  GLU  41           HB3      GLU  41 -16.289   2.675   0.235
    5    HG2  GLU  41           HG2      GLU  41 -13.933   3.035   0.618
    6    HG3  GLU  41           HG3      GLU  41 -14.230   4.714   1.069

  No H/Q in entry =           6
  In of MODEL   10
    1    H    THR  42           H        THR  42 -13.468   5.139  -1.616
    2    HA   THR  42           HA       THR  42 -13.761   7.726  -0.447
    3    HB   THR  42           HB       THR  42 -11.584   8.226  -1.545
    4    HG1  THR  42           HG1      THR  42 -11.650   5.574  -2.513
    5   HG23  THR  42          HG21      THR  42 -11.454   7.125   0.578
    6   HG22  THR  42          HG22      THR  42 -10.315   6.301  -0.488
    7   HG21  THR  42          HG23      THR  42 -11.879   5.569  -0.135

  No H/Q in entry =           7
  In of MODEL   10
    1    H    LEU  43           H        LEU  43 -14.673   6.608  -3.536
    2    HA   LEU  43           HA       LEU  43 -14.846   9.370  -4.551
    3    HB2  LEU  43           HB2      LEU  43 -15.291   6.720  -5.915
    4    HB3  LEU  43           HB3      LEU  43 -15.413   8.299  -6.690
    5    HG   LEU  43           HG       LEU  43 -12.884   7.050  -5.642
    6   HD12  LEU  43          HD11      LEU  43 -13.458   7.661  -8.508
    7   HD11  LEU  43          HD12      LEU  43 -14.090   6.175  -7.800
    8   HD13  LEU  43          HD13      LEU  43 -12.353   6.475  -7.813
    9   HD23  LEU  43          HD21      LEU  43 -11.962   8.999  -7.105
   10   HD22  LEU  43          HD22      LEU  43 -12.532   9.342  -5.471
   11   HD21  LEU  43          HD23      LEU  43 -13.558   9.707  -6.857

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ALA  44           H        ALA  44 -16.852   7.626  -2.684
    2    HA   ALA  44           HA       ALA  44 -19.323   7.530  -4.022
    3    HB2  ALA  44           HB1      ALA  44 -19.229   6.442  -1.908
    4    HB3  ALA  44           HB2      ALA  44 -20.302   7.820  -1.664
    5    HB1  ALA  44           HB3      ALA  44 -18.633   7.894  -1.102

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLY  45           H        GLY  45 -17.841  10.316  -2.524
    2    HA3  GLY  45           HA2      GLY  45 -20.236  11.872  -2.926
    3    HA2  GLY  45           HA3      GLY  45 -18.680  12.466  -2.348

  No H/Q in entry =           3
  In of MODEL   10
    1    H    GLU  46           H        GLU  46 -17.157  11.453  -4.612
    2    HA   GLU  46           HA       GLU  46 -17.723  13.657  -6.420
    3    HB2  GLU  46           HB2      GLU  46 -15.583  11.523  -6.382
    4    HB3  GLU  46           HB3      GLU  46 -15.674  12.811  -7.584
    5    HG2  GLU  46           HG2      GLU  46 -14.116  13.625  -6.098
    6    HG3  GLU  46           HG3      GLU  46 -15.603  14.396  -5.548

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LYS  47           H        LYS  47 -17.693  10.129  -6.799
    2    HA   LYS  47           HA       LYS  47 -18.767  10.335  -9.485
    3    HB2  LYS  47           HB2      LYS  47 -17.193   8.495  -8.413
    4    HB3  LYS  47           HB3      LYS  47 -18.735   7.778  -7.947
    5    HG2  LYS  47           HG2      LYS  47 -18.293   6.737  -9.945
    6    HG3  LYS  47           HG3      LYS  47 -19.333   8.070 -10.444
    7    HD2  LYS  47           HD2      LYS  47 -17.185   9.391 -10.814
    8    HD3  LYS  47           HD3      LYS  47 -16.348   7.845 -10.678
    9    HE2  LYS  47           HE2      LYS  47 -17.540   6.962 -12.555
   10    HE3  LYS  47           HE3      LYS  47 -18.583   8.381 -12.621
   11    HZ1  LYS  47           HZ1      LYS  47 -15.809   9.047 -12.722
   12    HZ3  LYS  47           HZ2      LYS  47 -17.076   9.505 -13.757
   13    HZ2  LYS  47           HZ3      LYS  47 -16.273   8.028 -13.999

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLY  48           H        GLY  48 -20.131   9.663  -6.335
    2    HA3  GLY  48           HA2      GLY  48 -22.541   8.529  -7.075
    3    HA2  GLY  48           HA3      GLY  48 -22.300   9.539  -5.651

  No H/Q in entry =           3
  In of MODEL   10
    1    H    GLN  49           H        GLN  49 -21.642  11.921  -7.255
    2    HA   GLN  49           HA       GLN  49 -24.171  13.095  -7.436
    3    HB2  GLN  49           HB2      GLN  49 -21.596  13.871  -8.791
    4    HB3  GLN  49           HB3      GLN  49 -23.033  14.875  -8.732
    5    HG2  GLN  49           HG2      GLN  49 -22.890  14.934  -6.295
    6    HG3  GLN  49           HG3      GLN  49 -21.466  13.909  -6.351
    7   HE21  GLN  49          HE21      GLN  49 -21.300  16.154  -5.114
    8   HE22  GLN  49          HE22      GLN  49 -20.340  17.375  -5.774

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ASN  50           H        ASN  50 -22.525  11.135  -9.780
    2    HA   ASN  50           HA       ASN  50 -24.370  12.022 -11.890
    3    HB2  ASN  50           HB2      ASN  50 -21.830  10.411 -12.080
    4    HB3  ASN  50           HB3      ASN  50 -22.860  10.843 -13.437
    5   HD21  ASN  50          HD21      ASN  50 -20.214  11.645 -11.821
    6   HD22  ASN  50          HD22      ASN  50 -19.934  13.269 -12.188

  No H/Q in entry =           6
  In of MODEL   10
    1    H    ALA  51           H        ALA  51 -24.434   9.703  -9.606
    2    HA   ALA  51           HA       ALA  51 -25.262   7.550 -11.404
    3    HB2  ALA  51           HB1      ALA  51 -24.727   6.214  -9.693
    4    HB3  ALA  51           HB2      ALA  51 -25.835   7.068  -8.621
    5    HB1  ALA  51           HB3      ALA  51 -24.179   7.643  -8.816

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ASP  52           H        ASP  52 -27.296   6.552 -11.262
    2    HA   ASP  52           HA       ASP  52 -29.432   8.454 -10.642
    3    HB2  ASP  52           HB2      ASP  52 -29.297   5.918 -12.271
    4    HB3  ASP  52           HB3      ASP  52 -30.824   6.699 -11.859

  No H/Q in entry =           4
  In of MODEL   10
    1    H    VAL  53           H        VAL  53 -27.917   5.538  -9.569
    2    HA   VAL  53           HA       VAL  53 -29.371   5.746  -7.065
    3    HB   VAL  53           HB       VAL  53 -30.806   4.123  -8.294
    4   HG11  VAL  53          HG11      VAL  53 -29.072   3.191  -9.789
    5   HG13  VAL  53          HG12      VAL  53 -29.946   1.934  -8.916
    6   HG12  VAL  53          HG13      VAL  53 -28.327   2.400  -8.402
    7   HG23  VAL  53          HG21      VAL  53 -30.050   2.151  -6.564
    8   HG22  VAL  53          HG22      VAL  53 -31.145   3.492  -6.226
    9   HG21  VAL  53          HG23      VAL  53 -29.437   3.623  -5.810

  No H/Q in entry =           9
  In of MODEL   10
    1    H    VAL  54           H        VAL  54 -28.082   5.303  -5.394
    2    HA   VAL  54           HA       VAL  54 -25.342   4.368  -5.972
    3    HB   VAL  54           HB       VAL  54 -26.378   6.211  -3.759
    4   HG11  VAL  54          HG11      VAL  54 -23.838   4.716  -4.008
    5   HG13  VAL  54          HG12      VAL  54 -24.581   5.440  -2.583
    6   HG12  VAL  54          HG13      VAL  54 -23.639   6.439  -3.689
    7   HG22  VAL  54          HG21      VAL  54 -25.460   7.983  -4.880
    8   HG21  VAL  54          HG22      VAL  54 -26.027   6.987  -6.220
    9   HG23  VAL  54          HG23      VAL  54 -24.322   6.972  -5.771

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LEU  55           H        LEU  55 -24.808   2.442  -5.295
    2    HA   LEU  55           HA       LEU  55 -26.367   1.208  -3.110
    3    HB2  LEU  55           HB2      LEU  55 -24.829  -0.039  -5.375
    4    HB3  LEU  55           HB3      LEU  55 -25.624  -0.931  -4.077
    5    HG   LEU  55           HG       LEU  55 -27.001   0.662  -6.230
    6   HD13  LEU  55          HD11      LEU  55 -26.745  -1.218  -7.418
    7   HD12  LEU  55          HD12      LEU  55 -27.735  -2.046  -6.216
    8   HD11  LEU  55          HD13      LEU  55 -25.979  -2.029  -6.053
    9   HD23  LEU  55          HD21      LEU  55 -28.363  -1.217  -4.354
   10   HD22  LEU  55          HD22      LEU  55 -29.013   0.170  -5.228
   11   HD21  LEU  55          HD23      LEU  55 -27.995   0.420  -3.810

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LEU  56           H        LEU  56 -25.246   0.611  -1.287
    2    HA   LEU  56           HA       LEU  56 -22.301   0.923  -1.322
    3    HB2  LEU  56           HB2      LEU  56 -24.125   0.801   1.067
    4    HB3  LEU  56           HB3      LEU  56 -22.404   1.182   1.062
    5    HG   LEU  56           HG       LEU  56 -24.649   2.909   0.054
    6   HD11  LEU  56          HD11      LEU  56 -23.562   2.537   2.589
    7   HD13  LEU  56          HD12      LEU  56 -24.509   3.925   2.054
    8   HD12  LEU  56          HD13      LEU  56 -22.749   3.979   1.977
    9   HD23  LEU  56          HD21      LEU  56 -22.655   4.549  -0.152
   10   HD22  LEU  56          HD22      LEU  56 -23.059   3.442  -1.465
   11   HD21  LEU  56          HD23      LEU  56 -21.724   3.068  -0.376

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLY  57           H        GLY  57 -20.972  -0.738  -0.752
    2    HA3  GLY  57           HA2      GLY  57 -21.968  -3.399  -0.911
    3    HA2  GLY  57           HA3      GLY  57 -20.336  -2.943  -0.429

  No H/Q in entry =           3
  In of MODEL   10
    1    HA   PRO  58           HA       PRO  58 -23.199  -3.842   3.276
    2    HB2  PRO  58           HB2      PRO  58 -22.593  -6.455   3.929
    3    HB3  PRO  58           HB3      PRO  58 -23.959  -6.024   2.900
    4    HG2  PRO  58           HG2      PRO  58 -21.252  -6.994   2.147
    5    HG3  PRO  58           HG3      PRO  58 -22.824  -7.420   1.472
    6    HD2  PRO  58           HD2      PRO  58 -21.156  -5.669   0.232
    7    HD3  PRO  58           HD3      PRO  58 -22.912  -5.535   0.115

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLN  59           H        GLN  59 -19.839  -4.420   2.701
    2    HA   GLN  59           HA       GLN  59 -19.104  -4.415   5.468
    3    HB2  GLN  59           HB2      GLN  59 -17.475  -3.645   3.042
    4    HB3  GLN  59           HB3      GLN  59 -16.837  -3.856   4.660
    5    HG2  GLN  59           HG2      GLN  59 -18.143  -6.004   2.998
    6    HG3  GLN  59           HG3      GLN  59 -16.414  -5.791   3.211
    7   HE21  GLN  59          HE21      GLN  59 -18.714  -7.478   4.103
    8   HE22  GLN  59          HE22      GLN  59 -18.515  -8.181   5.598

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ILE  60           H        ILE  60 -19.949  -1.874   3.212
    2    HA   ILE  60           HA       ILE  60 -19.054   0.091   5.232
    3    HB   ILE  60           HB       ILE  60 -19.224   1.796   3.377
    4   HG12  ILE  60          HG12      ILE  60 -19.085  -0.471   1.434
    5   HG13  ILE  60          HG13      ILE  60 -20.656   0.136   1.959
    6   HG22  ILE  60          HG21      ILE  60 -17.267  -0.417   2.865
    7   HG21  ILE  60          HG22      ILE  60 -17.110   0.809   4.123
    8   HG23  ILE  60          HG23      ILE  60 -17.097   1.282   2.423
    9   HD11  ILE  60          HD11      ILE  60 -19.645   2.470   1.288
   10   HD13  ILE  60          HD12      ILE  60 -20.295   1.396   0.049
   11   HD12  ILE  60          HD13      ILE  60 -18.553   1.489   0.310

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ALA  61           H        ALA  61 -21.555  -1.422   5.308
    2    HA   ALA  61           HA       ALA  61 -23.729   0.298   4.807
    3    HB1  ALA  61           HB1      ALA  61 -24.995  -1.134   6.148
    4    HB2  ALA  61           HB2      ALA  61 -23.616  -1.547   7.167
    5    HB3  ALA  61           HB3      ALA  61 -23.719  -2.177   5.523

  No H/Q in entry =           5
  In of MODEL   10
    1    H    TYR  62           H        TYR  62 -21.544   0.168   7.622
    2    HA   TYR  62           HA       TYR  62 -23.063   1.897   9.255
    3    HB2  TYR  62           HB2      TYR  62 -20.998   2.303  10.479
    4    HB3  TYR  62           HB3      TYR  62 -21.141   0.590  10.085
    5    HD1  TYR  62           HD1      TYR  62 -19.542  -0.494   8.613
    6    HD2  TYR  62           HD2      TYR  62 -19.281   3.708   9.347
    7    HE1  TYR  62           HE1      TYR  62 -17.324  -0.449   7.541
    8    HE2  TYR  62           HE2      TYR  62 -17.048   3.746   8.276
    9    HH   TYR  62           HH       TYR  62 -15.539   2.578   7.206

  No H/Q in entry =           9
  In of MODEL   10
    1    H    MET  63           H        MET  63 -21.376   2.661   6.397
    2    HA   MET  63           HA       MET  63 -21.130   5.498   7.047
    3    HB2  MET  63           HB2      MET  63 -20.540   3.904   4.553
    4    HB3  MET  63           HB3      MET  63 -20.323   5.650   4.681
    5    HG2  MET  63           HG2      MET  63 -18.645   5.309   6.417
    6    HG3  MET  63           HG3      MET  63 -18.853   3.565   6.270
    7    HE3  MET  63           HE1      MET  63 -15.461   4.902   4.555
    8    HE2  MET  63           HE2      MET  63 -15.966   3.487   5.479
    9    HE1  MET  63           HE3      MET  63 -16.316   5.106   6.086

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LEU  64           H        LEU  64 -23.742   3.705   6.094
    2    HA   LEU  64           HA       LEU  64 -24.895   5.123   3.984
    3    HB2  LEU  64           HB2      LEU  64 -25.831   3.060   4.929
    4    HB3  LEU  64           HB3      LEU  64 -26.273   3.939   6.393
    5    HG   LEU  64           HG       LEU  64 -27.921   5.223   5.132
    6   HD13  LEU  64          HD11      LEU  64 -27.618   5.420   2.898
    7   HD12  LEU  64          HD12      LEU  64 -28.310   3.803   2.775
    8   HD11  LEU  64          HD13      LEU  64 -26.561   4.010   2.841
    9   HD23  LEU  64          HD21      LEU  64 -28.520   2.416   4.425
   10   HD22  LEU  64          HD22      LEU  64 -29.479   3.593   5.321
   11   HD21  LEU  64          HD23      LEU  64 -28.133   2.772   6.110

  No H/Q in entry =          11
  In of MODEL   10
    1    HA   PRO  65           HA       PRO  65 -26.997   8.387   6.669
    2    HB2  PRO  65           HB2      PRO  65 -25.007   8.521   8.934
    3    HB3  PRO  65           HB3      PRO  65 -26.737   8.855   8.963
    4    HG2  PRO  65           HG2      PRO  65 -25.883   6.588   9.933
    5    HG3  PRO  65           HG3      PRO  65 -27.296   6.582   8.878
    6    HD2  PRO  65           HD2      PRO  65 -24.439   5.869   8.205
    7    HD3  PRO  65           HD3      PRO  65 -25.920   5.020   7.762

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLU  66           H        GLU  66 -23.445   8.224   6.767
    2    HA   GLU  66           HA       GLU  66 -23.060  11.004   6.320
    3    HB2  GLU  66           HB2      GLU  66 -21.314   8.632   5.718
    4    HB3  GLU  66           HB3      GLU  66 -20.811  10.306   5.486
    5    HG2  GLU  66           HG2      GLU  66 -21.026  10.722   7.846
    6    HG3  GLU  66           HG3      GLU  66 -21.605   9.075   8.101

  No H/Q in entry =           6
  In of MODEL   10
    1    H    ILE  67           H        ILE  67 -23.232   8.227   4.111
    2    HA   ILE  67           HA       ILE  67 -22.748   9.884   1.794
    3    HB   ILE  67           HB       ILE  67 -23.738   7.010   2.014
    4   HG12  ILE  67          HG12      ILE  67 -21.067   8.082   1.091
    5   HG13  ILE  67          HG13      ILE  67 -21.386   7.699   2.781
    6   HG21  ILE  67          HG21      ILE  67 -23.608   8.849  -0.241
    7   HG23  ILE  67          HG22      ILE  67 -24.285   7.222  -0.168
    8   HG22  ILE  67          HG23      ILE  67 -22.566   7.448  -0.489
    9   HD12  ILE  67          HD11      ILE  67 -21.006   5.876   0.464
   10   HD11  ILE  67          HD12      ILE  67 -22.047   5.358   1.789
   11   HD13  ILE  67          HD13      ILE  67 -20.363   5.775   2.102

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLN  68           H        GLN  68 -25.660   8.949   3.424
    2    HA   GLN  68           HA       GLN  68 -27.446   9.905   1.423
    3    HB2  GLN  68           HB2      GLN  68 -27.732   9.605   4.410
    4    HB3  GLN  68           HB3      GLN  68 -29.025  10.225   3.398
    5    HG2  GLN  68           HG2      GLN  68 -29.111   8.176   2.155
    6    HG3  GLN  68           HG3      GLN  68 -27.686   7.566   2.976
    7   HE21  GLN  68          HE21      GLN  68 -29.907   6.278   2.848
    8   HE22  GLN  68          HE22      GLN  68 -30.759   5.872   4.265

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ARG  69           H        ARG  69 -25.803  11.562   4.145
    2    HA   ARG  69           HA       ARG  69 -27.082  14.082   3.690
    3    HB2  ARG  69           HB2      ARG  69 -24.780  13.101   5.309
    4    HB3  ARG  69           HB3      ARG  69 -24.799  14.816   4.922
    5    HG2  ARG  69           HG2      ARG  69 -27.119  14.951   5.878
    6    HG3  ARG  69           HG3      ARG  69 -26.970  13.263   6.380
    7    HD2  ARG  69           HD2      ARG  69 -25.205  15.575   7.267
    8    HD3  ARG  69           HD3      ARG  69 -26.371  14.723   8.268
    9    HE   ARG  69           HE       ARG  69 -23.786  13.690   7.351
   10   HH21  ARG  69          HH11      ARG  69 -23.044  11.920   8.580
   11   HH22  ARG  69          HH12      ARG  69 -24.106  11.156   9.715
   12   HH11  ARG  69          HH21      ARG  69 -26.770  13.269   9.038
   13   HH12  ARG  69          HH22      ARG  69 -26.216  11.919   9.972

  No H/Q in entry =          13
  In of MODEL   10
    1    H    LEU  70           H        LEU  70 -24.252  12.558   2.371
    2    HA   LEU  70           HA       LEU  70 -23.053  14.865   1.173
    3    HB2  LEU  70           HB2      LEU  70 -22.142  12.525   1.812
    4    HB3  LEU  70           HB3      LEU  70 -22.761  12.055   0.229
    5    HG   LEU  70           HG       LEU  70 -21.116  13.355  -0.867
    6   HD11  LEU  70          HD11      LEU  70 -20.283  14.215   1.912
    7   HD13  LEU  70          HD12      LEU  70 -20.935  15.252   0.643
    8   HD12  LEU  70          HD13      LEU  70 -19.346  14.513   0.445
    9   HD22  LEU  70          HD21      LEU  70 -19.744  11.595  -0.598
   10   HD21  LEU  70          HD22      LEU  70 -20.695  11.127   0.811
   11   HD23  LEU  70          HD23      LEU  70 -19.276  12.154   1.007

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LEU  71           H        LEU  71 -25.286  12.379   0.084
    2    HA   LEU  71           HA       LEU  71 -25.743  13.844  -2.458
    3    HB2  LEU  71           HB2      LEU  71 -26.056  10.876  -1.967
    4    HB3  LEU  71           HB3      LEU  71 -26.145  11.716  -3.514
    5    HG   LEU  71           HG       LEU  71 -23.636  11.667  -1.837
    6   HD12  LEU  71          HD11      LEU  71 -23.732  10.003  -4.244
    7   HD11  LEU  71          HD12      LEU  71 -24.772   9.437  -2.937
    8   HD13  LEU  71          HD13      LEU  71 -23.044   9.660  -2.657
    9   HD22  LEU  71          HD21      LEU  71 -23.666  13.462  -3.359
   10   HD21  LEU  71          HD22      LEU  71 -24.192  12.416  -4.679
   11   HD23  LEU  71          HD23      LEU  71 -22.582  12.223  -3.988

  No H/Q in entry =          11
  In of MODEL   10
    1    HA   PRO  72           HA       PRO  72 -29.639  13.575   0.144
    2    HB2  PRO  72           HB2      PRO  72 -30.402  16.163   0.017
    3    HB3  PRO  72           HB3      PRO  72 -29.117  15.682   1.125
    4    HG2  PRO  72           HG2      PRO  72 -28.872  16.825  -1.647
    5    HG3  PRO  72           HG3      PRO  72 -28.095  17.372  -0.162
    6    HD2  PRO  72           HD2      PRO  72 -26.805  15.738  -1.894
    7    HD3  PRO  72           HD3      PRO  72 -26.566  15.590  -0.154

  No H/Q in entry =           7
  In of MODEL   10
    1    H    ASN  73           H        ASN  73 -28.962  14.455  -3.081
    2    HA   ASN  73           HA       ASN  73 -31.828  14.241  -3.726
    3    HB2  ASN  73           HB2      ASN  73 -31.310  15.296  -5.838
    4    HB3  ASN  73           HB3      ASN  73 -30.759  16.277  -4.489
    5   HD21  ASN  73          HD21      ASN  73 -29.947  16.250  -7.162
    6   HD22  ASN  73          HD22      ASN  73 -28.285  16.025  -7.340

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LYS  74           H        LYS  74 -29.935  11.921  -3.253
    2    HA   LYS  74           HA       LYS  74 -30.540  10.508  -5.782
    3    HB2  LYS  74           HB2      LYS  74 -28.029  10.147  -4.140
    4    HB3  LYS  74           HB3      LYS  74 -28.434   9.325  -5.647
    5    HG2  LYS  74           HG2      LYS  74 -28.058  12.286  -5.491
    6    HG3  LYS  74           HG3      LYS  74 -26.724  11.168  -5.770
    7    HD2  LYS  74           HD2      LYS  74 -27.864  10.252  -7.706
    8    HD3  LYS  74           HD3      LYS  74 -29.247  11.307  -7.410
    9    HE2  LYS  74           HE2      LYS  74 -27.943  13.258  -7.876
   10    HE3  LYS  74           HE3      LYS  74 -26.457  12.310  -7.944
   11    HZ2  LYS  74           HZ1      LYS  74 -27.891  12.933 -10.088
   12    HZ1  LYS  74           HZ2      LYS  74 -28.605  11.443  -9.695
   13    HZ3  LYS  74           HZ3      LYS  74 -26.934  11.535  -9.984

  No H/Q in entry =          13
  In of MODEL   10
    1    HA   PRO  75           HA       PRO  75 -32.064   7.625  -2.774
    2    HB2  PRO  75           HB2      PRO  75 -32.448   5.396  -4.322
    3    HB3  PRO  75           HB3      PRO  75 -33.522   6.791  -4.421
    4    HG2  PRO  75           HG2      PRO  75 -31.198   6.077  -6.166
    5    HG3  PRO  75           HG3      PRO  75 -32.826   6.569  -6.631
    6    HD2  PRO  75           HD2      PRO  75 -30.815   8.360  -6.605
    7    HD3  PRO  75           HD3      PRO  75 -32.433   8.830  -6.084

  No H/Q in entry =           7
  In of MODEL   10
    1    H    VAL  76           H        VAL  76 -30.661   6.538  -1.374
    2    HA   VAL  76           HA       VAL  76 -28.237   5.217  -2.446
    3    HB   VAL  76           HB       VAL  76 -28.485   6.736   0.186
    4   HG11  VAL  76          HG11      VAL  76 -26.171   5.337  -1.170
    5   HG13  VAL  76          HG12      VAL  76 -26.893   4.939   0.391
    6   HG12  VAL  76          HG13      VAL  76 -25.988   6.440   0.196
    7   HG22  VAL  76          HG21      VAL  76 -27.739   8.596  -0.727
    8   HG21  VAL  76          HG22      VAL  76 -28.298   7.896  -2.247
    9   HG23  VAL  76          HG23      VAL  76 -26.604   7.751  -1.780

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLU  77           H        GLU  77 -28.107   3.067  -1.797
    2    HA   GLU  77           HA       GLU  77 -28.939   2.353   0.864
    3    HB2  GLU  77           HB2      GLU  77 -30.606   0.761   0.349
    4    HB3  GLU  77           HB3      GLU  77 -31.091   2.292  -0.381
    5    HG2  GLU  77           HG2      GLU  77 -30.498   1.476  -2.552
    6    HG3  GLU  77           HG3      GLU  77 -29.919  -0.034  -1.851

  No H/Q in entry =           6
  In of MODEL   10
    1    H    VAL  78           H        VAL  78 -28.696   0.266   1.559
    2    HA   VAL  78           HA       VAL  78 -26.056  -0.621   0.701
    3    HB   VAL  78           HB       VAL  78 -27.812  -1.399   3.070
    4   HG11  VAL  78          HG11      VAL  78 -25.514  -2.735   1.980
    5   HG13  VAL  78          HG12      VAL  78 -26.448  -3.148   3.420
    6   HG12  VAL  78          HG13      VAL  78 -25.085  -2.036   3.541
    7   HG22  VAL  78          HG21      VAL  78 -26.310  -0.073   4.396
    8   HG21  VAL  78          HG22      VAL  78 -27.001   0.904   3.100
    9   HG23  VAL  78          HG23      VAL  78 -25.345   0.310   2.970

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ILE  79           H        ILE  79 -25.587  -2.563  -0.169
    2    HA   ILE  79           HA       ILE  79 -27.694  -3.982  -1.506
    3    HB   ILE  79           HB       ILE  79 -24.727  -4.619  -1.257
    4   HG12  ILE  79          HG12      ILE  79 -26.306  -3.492  -3.573
    5   HG13  ILE  79          HG13      ILE  79 -25.402  -2.497  -2.431
    6   HG22  ILE  79          HG21      ILE  79 -25.859  -5.794  -3.564
    7   HG21  ILE  79          HG22      ILE  79 -26.871  -6.255  -2.195
    8   HG23  ILE  79          HG23      ILE  79 -25.142  -6.600  -2.168
    9   HD13  ILE  79          HD11      ILE  79 -23.982  -2.694  -4.238
   10   HD12  ILE  79          HD12      ILE  79 -24.384  -4.392  -4.493
   11   HD11  ILE  79          HD13      ILE  79 -23.391  -3.919  -3.113

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ASP  80           H        ASP  80 -28.635  -5.862  -0.898
    2    HA   ASP  80           HA       ASP  80 -28.632  -6.719   1.763
    3    HB2  ASP  80           HB2      ASP  80 -30.396  -7.256   0.121
    4    HB3  ASP  80           HB3      ASP  80 -29.273  -8.321  -0.723

  No H/Q in entry =           4
  In of MODEL   10
    1    H    SER  81           H        SER  81 -27.148  -7.893   2.923
    2    HA   SER  81           HA       SER  81 -24.672  -8.689   1.759
    3    HB2  SER  81           HB2      SER  81 -24.173  -9.700   3.949
    4    HB3  SER  81           HB3      SER  81 -24.816  -8.069   4.131
    5    HG   SER  81           HG       SER  81 -26.332  -8.873   5.271

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU  82           H        LEU  82 -27.463 -10.670   2.097
    2    HA   LEU  82           HA       LEU  82 -26.003 -13.104   1.626
    3    HB2  LEU  82           HB2      LEU  82 -28.915 -12.516   1.148
    4    HB3  LEU  82           HB3      LEU  82 -28.169 -14.099   1.355
    5    HG   LEU  82           HG       LEU  82 -28.443 -12.003   3.489
    6   HD12  LEU  82          HD11      LEU  82 -29.837 -14.673   3.204
    7   HD11  LEU  82          HD12      LEU  82 -30.562 -13.138   2.718
    8   HD13  LEU  82          HD13      LEU  82 -30.149 -13.422   4.409
    9   HD23  LEU  82          HD21      LEU  82 -27.726 -14.006   4.891
   10   HD22  LEU  82          HD22      LEU  82 -26.480 -13.280   3.876
   11   HD21  LEU  82          HD23      LEU  82 -27.266 -14.776   3.371

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LEU  83           H        LEU  83 -27.863 -10.838  -0.343
    2    HA   LEU  83           HA       LEU  83 -27.698 -12.245  -2.789
    3    HB2  LEU  83           HB2      LEU  83 -28.002  -9.314  -2.193
    4    HB3  LEU  83           HB3      LEU  83 -28.047  -9.984  -3.823
    5    HG   LEU  83           HG       LEU  83 -30.108 -10.256  -1.654
    6   HD13  LEU  83          HD11      LEU  83 -30.787  -8.399  -2.754
    7   HD12  LEU  83          HD12      LEU  83 -31.284  -9.517  -4.024
    8   HD11  LEU  83          HD13      LEU  83 -29.717  -8.711  -4.120
    9   HD23  LEU  83          HD21      LEU  83 -30.278 -11.554  -4.358
   10   HD22  LEU  83          HD22      LEU  83 -31.269 -11.843  -2.930
   11   HD21  LEU  83          HD23      LEU  83 -29.601 -12.411  -2.975

  No H/Q in entry =          11
  In of MODEL   10
    1    H    TYR  84           H        TYR  84 -25.666  -9.908  -1.140
    2    HA   TYR  84           HA       TYR  84 -23.774  -9.528  -3.265
    3    HB2  TYR  84           HB2      TYR  84 -24.257  -8.002  -1.250
    4    HB3  TYR  84           HB3      TYR  84 -23.249  -9.115  -0.328
    5    HD1  TYR  84           HD1      TYR  84 -20.896  -8.958  -0.391
    6    HD2  TYR  84           HD2      TYR  84 -23.228  -6.796  -3.240
    7    HE1  TYR  84           HE1      TYR  84 -18.859  -7.781  -1.147
    8    HE2  TYR  84           HE2      TYR  84 -21.199  -5.619  -4.013
    9    HH   TYR  84           HH       TYR  84 -18.216  -5.811  -2.258

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLY  85           H        GLY  85 -23.628 -11.487  -0.284
    2    HA3  GLY  85           HA2      GLY  85 -21.086 -12.536  -0.734
    3    HA2  GLY  85           HA3      GLY  85 -22.353 -13.319   0.210

  No H/Q in entry =           3
  In of MODEL   10
    1    H    LYS  86           H        LYS  86 -24.200 -13.657  -1.857
    2    HA   LYS  86           HA       LYS  86 -23.231 -16.091  -3.068
    3    HB2  LYS  86           HB2      LYS  86 -25.823 -14.559  -3.295
    4    HB3  LYS  86           HB3      LYS  86 -25.550 -16.191  -3.902
    5    HG2  LYS  86           HG2      LYS  86 -25.346 -15.480  -1.007
    6    HG3  LYS  86           HG3      LYS  86 -26.844 -16.003  -1.777
    7    HD2  LYS  86           HD2      LYS  86 -25.676 -18.029  -2.599
    8    HD3  LYS  86           HD3      LYS  86 -24.226 -17.516  -1.738
    9    HE2  LYS  86           HE2      LYS  86 -26.880 -17.991  -0.396
   10    HE3  LYS  86           HE3      LYS  86 -25.621 -19.216  -0.536
   11    HZ1  LYS  86           HZ1      LYS  86 -25.154 -16.539   0.655
   12    HZ3  LYS  86           HZ2      LYS  86 -24.131 -17.894   0.716
   13    HZ2  LYS  86           HZ3      LYS  86 -25.596 -17.898   1.574

  No H/Q in entry =          13
  In of MODEL   10
    1    H    VAL  87           H        VAL  87 -23.092 -12.894  -4.017
    2    HA   VAL  87           HA       VAL  87 -22.736 -11.767  -5.976
    3    HB   VAL  87           HB       VAL  87 -21.750 -14.353  -7.221
    4   HG13  VAL  87          HG11      VAL  87 -20.439 -12.963  -8.568
    5   HG12  VAL  87          HG12      VAL  87 -20.468 -11.640  -7.401
    6   HG11  VAL  87          HG13      VAL  87 -21.898 -11.995  -8.369
    7   HG23  VAL  87          HG21      VAL  87 -20.062 -12.632  -5.429
    8   HG22  VAL  87          HG22      VAL  87 -19.652 -14.184  -6.154
    9   HG21  VAL  87          HG23      VAL  87 -20.860 -14.101  -4.873

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ASP  88           H        ASP  88 -25.276 -12.306  -5.630
    2    HA   ASP  88           HA       ASP  88 -26.430 -13.520  -8.013
    3    HB2  ASP  88           HB2      ASP  88 -27.446 -13.687  -5.692
    4    HB3  ASP  88           HB3      ASP  88 -27.835 -11.973  -5.823

  No H/Q in entry =           4
  In of MODEL   10
    1    H    GLY  89           H        GLY  89 -25.668 -12.319  -9.671
    2    HA3  GLY  89           HA2      GLY  89 -25.744  -9.546  -9.920
    3    HA2  GLY  89           HA3      GLY  89 -25.754 -10.690 -11.262

  No H/Q in entry =           3
  In of MODEL   10
    1    H    LEU  90           H        LEU  90 -28.252 -11.940 -10.805
    2    HA   LEU  90           HA       LEU  90 -29.983  -9.958 -11.963
    3    HB2  LEU  90           HB2      LEU  90 -30.135 -12.360 -12.502
    4    HB3  LEU  90           HB3      LEU  90 -30.664 -12.679 -10.851
    5    HG   LEU  90           HG       LEU  90 -32.736 -11.489 -11.247
    6   HD13  LEU  90          HD11      LEU  90 -32.484  -9.782 -12.749
    7   HD12  LEU  90          HD12      LEU  90 -33.063 -11.018 -13.868
    8   HD11  LEU  90          HD13      LEU  90 -31.336 -10.686 -13.740
    9   HD23  LEU  90          HD21      LEU  90 -32.715 -13.163 -13.652
   10   HD22  LEU  90          HD22      LEU  90 -33.708 -13.265 -12.199
   11   HD21  LEU  90          HD23      LEU  90 -32.078 -13.939 -12.203

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLY  91           H        GLY  91 -29.889 -11.409  -8.753
    2    HA3  GLY  91           HA2      GLY  91 -32.190 -10.192  -7.746
    3    HA2  GLY  91           HA3      GLY  91 -30.824 -10.761  -6.787

  No H/Q in entry =           3
  In of MODEL   10
    1    H    VAL  92           H        VAL  92 -28.834  -9.022  -7.663
    2    HA   VAL  92           HA       VAL  92 -29.547  -6.666  -6.159
    3    HB   VAL  92           HB       VAL  92 -27.012  -7.258  -7.731
    4   HG12  VAL  92          HG11      VAL  92 -27.118  -5.327  -5.438
    5   HG11  VAL  92          HG12      VAL  92 -27.754  -4.786  -6.993
    6   HG13  VAL  92          HG13      VAL  92 -26.077  -5.316  -6.863
    7   HG22  VAL  92          HG21      VAL  92 -26.857  -8.825  -6.109
    8   HG21  VAL  92          HG22      VAL  92 -27.978  -7.983  -5.037
    9   HG23  VAL  92          HG23      VAL  92 -26.301  -7.447  -5.159

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LEU  93           H        LEU  93 -29.146  -7.402  -9.564
    2    HA   LEU  93           HA       LEU  93 -29.389  -4.772 -10.541
    3    HB2  LEU  93           HB2      LEU  93 -28.809  -6.675 -11.967
    4    HB3  LEU  93           HB3      LEU  93 -30.427  -7.339 -11.741
    5    HG   LEU  93           HG       LEU  93 -31.359  -5.360 -12.905
    6   HD11  LEU  93          HD11      LEU  93 -29.452  -3.825 -12.418
    7   HD13  LEU  93          HD12      LEU  93 -29.884  -3.869 -14.128
    8   HD12  LEU  93          HD13      LEU  93 -28.467  -4.746 -13.554
    9   HD23  LEU  93          HD21      LEU  93 -30.330  -6.005 -15.177
   10   HD22  LEU  93          HD22      LEU  93 -31.223  -7.214 -14.253
   11   HD21  LEU  93          HD23      LEU  93 -29.458  -7.223 -14.246

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LYS  94           H        LYS  94 -31.862  -7.213  -9.662
    2    HA   LYS  94           HA       LYS  94 -34.148  -5.696 -10.325
    3    HB2  LYS  94           HB2      LYS  94 -33.725  -7.864  -8.273
    4    HB3  LYS  94           HB3      LYS  94 -35.294  -7.114  -8.562
    5    HG2  LYS  94           HG2      LYS  94 -35.225  -7.933 -10.883
    6    HG3  LYS  94           HG3      LYS  94 -33.695  -8.735 -10.532
    7    HD2  LYS  94           HD2      LYS  94 -34.873  -9.994  -8.691
    8    HD3  LYS  94           HD3      LYS  94 -36.388  -9.300  -9.266
    9    HE2  LYS  94           HE2      LYS  94 -35.896 -10.287 -11.513
   10    HE3  LYS  94           HE3      LYS  94 -34.515 -11.110 -10.789
   11    HZ3  LYS  94           HZ1      LYS  94 -36.419 -12.564 -10.943
   12    HZ2  LYS  94           HZ2      LYS  94 -37.360 -11.487 -10.025
   13    HZ1  LYS  94           HZ3      LYS  94 -36.032 -12.272  -9.316

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ALA  95           H        ALA  95 -32.345  -5.832  -7.264
    2    HA   ALA  95           HA       ALA  95 -34.142  -4.158  -5.824
    3    HB2  ALA  95           HB1      ALA  95 -31.823  -5.611  -5.249
    4    HB3  ALA  95           HB2      ALA  95 -32.772  -4.650  -4.117
    5    HB1  ALA  95           HB3      ALA  95 -31.391  -3.929  -4.944

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA  96           H        ALA  96 -31.459  -3.440  -7.920
    2    HA   ALA  96           HA       ALA  96 -31.264  -0.671  -7.192
    3    HB2  ALA  96           HB1      ALA  96 -29.884  -0.532  -9.298
    4    HB3  ALA  96           HB2      ALA  96 -30.250  -2.233  -9.590
    5    HB1  ALA  96           HB3      ALA  96 -29.325  -1.762  -8.163

  No H/Q in entry =           5
  In of MODEL   10
    1    H    VAL  97           H        VAL  97 -32.845  -2.373  -9.858
    2    HA   VAL  97           HA       VAL  97 -33.820  -0.056 -11.159
    3    HB   VAL  97           HB       VAL  97 -34.740  -2.950 -11.156
    4   HG11  VAL  97          HG11      VAL  97 -36.452  -0.885 -11.687
    5   HG13  VAL  97          HG12      VAL  97 -36.569  -2.488 -12.416
    6   HG12  VAL  97          HG13      VAL  97 -35.760  -1.182 -13.282
    7   HG21  VAL  97          HG21      VAL  97 -33.383  -1.207 -13.214
    8   HG23  VAL  97          HG22      VAL  97 -33.898  -2.873 -13.478
    9   HG22  VAL  97          HG23      VAL  97 -32.641  -2.514 -12.293

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ALA  98           H        ALA  98 -35.099  -2.144  -8.593
    2    HA   ALA  98           HA       ALA  98 -37.615  -0.892  -8.276
    3    HB1  ALA  98           HB1      ALA  98 -36.693  -3.111  -7.201
    4    HB3  ALA  98           HB2      ALA  98 -37.841  -2.126  -6.292
    5    HB2  ALA  98           HB3      ALA  98 -36.118  -2.037  -5.924

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA  99           H        ALA  99 -34.516  -0.186  -6.625
    2    HA   ALA  99           HA       ALA  99 -35.575   1.869  -5.003
    3    HB1  ALA  99           HB1      ALA  99 -32.960   0.863  -5.720
    4    HB2  ALA  99           HB2      ALA  99 -33.487   1.659  -4.237
    5    HB3  ALA  99           HB3      ALA  99 -32.966   2.624  -5.618

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ILE 100           H        ILE 100 -34.514   1.902  -8.354
    2    HA   ILE 100           HA       ILE 100 -34.578   4.750  -8.621
    3    HB   ILE 100           HB       ILE 100 -34.748   2.566 -10.725
    4   HG12  ILE 100          HG12      ILE 100 -32.510   4.482 -10.074
    5   HG13  ILE 100          HG13      ILE 100 -32.615   2.849  -9.418
    6   HG21  ILE 100          HG21      ILE 100 -35.053   5.498 -10.905
    7   HG23  ILE 100          HG22      ILE 100 -35.604   4.232 -12.004
    8   HG22  ILE 100          HG23      ILE 100 -33.929   4.780 -12.059
    9   HD12  ILE 100          HD11      ILE 100 -32.031   3.738 -12.204
   10   HD11  ILE 100          HD12      ILE 100 -32.757   2.154 -11.927
   11   HD13  ILE 100          HD13      ILE 100 -31.198   2.548 -11.206

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LYS 101           H        LYS 101 -36.970   2.224  -9.318
    2    HA   LYS 101           HA       LYS 101 -38.978   3.938 -10.356
    3    HB2  LYS 101           HB2      LYS 101 -38.980   1.180  -9.183
    4    HB3  LYS 101           HB3      LYS 101 -40.498   1.997  -9.550
    5    HG2  LYS 101           HG2      LYS 101 -40.008   2.075 -11.846
    6    HG3  LYS 101           HG3      LYS 101 -38.331   1.606 -11.575
    7    HD2  LYS 101           HD2      LYS 101 -39.651  -0.265 -12.437
    8    HD3  LYS 101           HD3      LYS 101 -39.046  -0.593 -10.813
    9    HE2  LYS 101           HE2      LYS 101 -41.138  -1.197 -10.308
   10    HE3  LYS 101           HE3      LYS 101 -41.525   0.525 -10.340
   11    HZ3  LYS 101           HZ1      LYS 101 -42.412   0.368 -12.461
   12    HZ2  LYS 101           HZ2      LYS 101 -42.935  -1.073 -11.732
   13    HZ1  LYS 101           HZ3      LYS 101 -41.622  -1.095 -12.809

  No H/Q in entry =          13
  In of MODEL   10
    1    H    LYS 102           H        LYS 102 -38.563   2.494  -7.121
    2    HA   LYS 102           HA       LYS 102 -40.767   3.798  -5.956
    3    HB2  LYS 102           HB2      LYS 102 -39.612   1.900  -4.903
    4    HB3  LYS 102           HB3      LYS 102 -38.181   2.903  -4.669
    5    HG2  LYS 102           HG2      LYS 102 -39.448   4.372  -3.202
    6    HG3  LYS 102           HG3      LYS 102 -40.882   3.375  -3.439
    7    HD2  LYS 102           HD2      LYS 102 -39.737   1.478  -2.376
    8    HD3  LYS 102           HD3      LYS 102 -38.303   2.478  -2.137
    9    HE2  LYS 102           HE2      LYS 102 -39.605   4.031  -0.760
   10    HE3  LYS 102           HE3      LYS 102 -41.055   3.062  -1.021
   11    HZ1  LYS 102           HZ1      LYS 102 -39.412   1.256   0.021
   12    HZ3  LYS 102           HZ2      LYS 102 -40.490   2.200   0.930
   13    HZ2  LYS 102           HZ3      LYS 102 -38.859   2.658   0.804

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ALA 103           H        ALA 103 -37.753   5.054  -6.972
    2    HA   ALA 103           HA       ALA 103 -37.893   7.403  -5.229
    3    HB2  ALA 103           HB1      ALA 103 -35.865   8.031  -6.804
    4    HB3  ALA 103           HB2      ALA 103 -35.897   6.308  -7.174
    5    HB1  ALA 103           HB3      ALA 103 -35.658   6.848  -5.513

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA 104           H        ALA 104 -38.524   6.644  -8.567
    2    HA   ALA 104           HA       ALA 104 -38.995   9.440  -9.236
    3    HB2  ALA 104           HB1      ALA 104 -39.053   8.739 -11.428
    4    HB1  ALA 104           HB2      ALA 104 -39.844   7.214 -11.029
    5    HB3  ALA 104           HB3      ALA 104 -38.114   7.412 -10.744

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA 105           H        ALA 105 -40.695   7.430  -7.409
    2    HA   ALA 105           HA       ALA 105 -43.062   8.920  -7.418
    3    HB2  ALA 105           HB1      ALA 105 -43.830   8.058  -9.447
    4    HB3  ALA 105           HB2      ALA 105 -44.520   6.914  -8.296
    5    HB1  ALA 105           HB3      ALA 105 -43.060   6.493  -9.191

  No H/Q in entry =           5
  In of MODEL   11
    1    H1   ALA   1           H3       ALA   1 -12.117 -15.835  -2.449
    2    H2   ALA   1           H2       ALA   1 -11.168 -16.972  -3.289
    3    H3   ALA   1           H1       ALA   1 -12.315 -16.031  -4.124
    4    HA   ALA   1           HA       ALA   1 -13.706 -17.739  -3.889
    5    HB3  ALA   1           HB1      ALA   1 -12.303 -19.504  -3.426
    6    HB1  ALA   1           HB2      ALA   1 -13.062 -19.397  -1.838
    7    HB2  ALA   1           HB3      ALA   1 -11.489 -18.649  -2.115

  No H/Q in entry =           7
  In of MODEL   11
    1    H    GLU   2           H        GLU   2 -15.328 -18.603  -2.238
    2    HA   GLU   2           HA       GLU   2 -16.986 -16.891  -1.180
    3    HB2  GLU   2           HB2      GLU   2 -16.038 -19.314   0.363
    4    HB3  GLU   2           HB3      GLU   2 -17.567 -18.471   0.616
    5    HG2  GLU   2           HG2      GLU   2 -18.538 -19.560  -1.122
    6    HG3  GLU   2           HG3      GLU   2 -17.215 -19.152  -2.203

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLU   3           H        GLU   3 -15.072 -18.238   1.445
    2    HA   GLU   3           HA       GLU   3 -15.308 -15.887   3.004
    3    HB2  GLU   3           HB2      GLU   3 -13.711 -18.427   3.255
    4    HB3  GLU   3           HB3      GLU   3 -13.488 -17.108   4.404
    5    HG2  GLU   3           HG2      GLU   3 -15.682 -17.270   5.218
    6    HG3  GLU   3           HG3      GLU   3 -16.270 -18.071   3.767

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LEU   4           H        LEU   4 -12.343 -17.351   1.617
    2    HA   LEU   4           HA       LEU   4 -10.519 -15.440   2.221
    3    HB2  LEU   4           HB2      LEU   4 -10.739 -16.736  -0.506
    4    HB3  LEU   4           HB3      LEU   4  -9.291 -16.009   0.182
    5    HG   LEU   4           HG       LEU   4 -10.776 -18.414   1.290
    6   HD13  LEU   4          HD11      LEU   4  -9.136 -19.762   0.362
    7   HD12  LEU   4          HD12      LEU   4  -7.932 -18.473   0.339
    8   HD11  LEU   4          HD13      LEU   4  -9.218 -18.500  -0.866
    9   HD23  LEU   4          HD21      LEU   4  -8.527 -18.469   2.676
   10   HD22  LEU   4          HD22      LEU   4  -9.854 -17.436   3.203
   11   HD21  LEU   4          HD23      LEU   4  -8.493 -16.740   2.324

  No H/Q in entry =          11
  In of MODEL   11
    1    H    GLU   5           H        GLU   5 -12.850 -15.241  -0.458
    2    HA   GLU   5           HA       GLU   5 -11.856 -12.752  -1.454
    3    HB2  GLU   5           HB2      GLU   5 -13.192 -14.342  -2.820
    4    HB3  GLU   5           HB3      GLU   5 -14.596 -13.987  -1.813
    5    HG2  GLU   5           HG2      GLU   5 -14.474 -11.617  -2.452
    6    HG3  GLU   5           HG3      GLU   5 -13.049 -11.947  -3.437

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLU   6           H        GLU   6 -14.581 -13.644   0.632
    2    HA   GLU   6           HA       GLU   6 -15.498 -10.972   1.033
    3    HB2  GLU   6           HB2      GLU   6 -16.927 -12.953   1.427
    4    HB3  GLU   6           HB3      GLU   6 -15.887 -13.424   2.770
    5    HG2  GLU   6           HG2      GLU   6 -16.403 -11.333   3.937
    6    HG3  GLU   6           HG3      GLU   6 -17.396 -10.802   2.582

  No H/Q in entry =           6
  In of MODEL   11
    1    H    VAL   7           H        VAL   7 -13.185 -13.074   2.606
    2    HA   VAL   7           HA       VAL   7 -12.730 -11.500   4.936
    3    HB   VAL   7           HB       VAL   7 -11.014 -13.534   3.488
    4   HG11  VAL   7          HG11      VAL   7 -10.558 -12.002   6.055
    5   HG13  VAL   7          HG12      VAL   7  -9.454 -12.210   4.696
    6   HG12  VAL   7          HG13      VAL   7  -9.804 -13.569   5.764
    7   HG21  VAL   7          HG21      VAL   7 -13.265 -14.110   4.703
    8   HG23  VAL   7          HG22      VAL   7 -12.342 -13.833   6.180
    9   HG22  VAL   7          HG23      VAL   7 -11.841 -15.090   5.051

  No H/Q in entry =           9
  In of MODEL   11
    1    H    VAL   8           H        VAL   8 -11.212 -11.604   1.729
    2    HA   VAL   8           HA       VAL   8  -9.158  -9.723   2.228
    3    HB   VAL   8           HB       VAL   8 -10.613 -10.413  -0.336
    4   HG11  VAL   8          HG11      VAL   8  -8.210  -8.660   0.218
    5   HG13  VAL   8          HG12      VAL   8  -9.664  -8.257  -0.695
    6   HG12  VAL   8          HG13      VAL   8  -8.491  -9.392  -1.362
    7   HG23  VAL   8          HG21      VAL   8  -7.772 -11.182   0.095
    8   HG22  VAL   8          HG22      VAL   8  -9.098 -12.120  -0.585
    9   HG21  VAL   8          HG23      VAL   8  -8.920 -11.993   1.162

  No H/Q in entry =           9
  In of MODEL   11
    1    H    MET   9           H        MET   9 -12.503  -9.347   1.061
    2    HA   MET   9           HA       MET   9 -12.451  -6.569   0.630
    3    HB2  MET   9           HB2      MET   9 -14.629  -8.501   1.381
    4    HB3  MET   9           HB3      MET   9 -14.959  -6.769   1.315
    5    HG2  MET   9           HG2      MET   9 -13.887  -6.829  -1.024
    6    HG3  MET   9           HG3      MET   9 -14.047  -8.583  -0.919
    7    HE1  MET   9           HE1      MET   9 -15.896  -9.888  -0.896
    8    HE3  MET   9           HE2      MET   9 -17.589  -9.456  -1.113
    9    HE2  MET   9           HE3      MET   9 -16.834  -9.262   0.466

  No H/Q in entry =           9
  In of MODEL   11
    1    H    GLY  10           H        GLY  10 -13.111  -8.466   3.554
    2    HA3  GLY  10           HA2      GLY  10 -13.673  -6.286   5.274
    3    HA2  GLY  10           HA3      GLY  10 -13.103  -7.873   5.787

  No H/Q in entry =           3
  In of MODEL   11
    1    H    LEU  11           H        LEU  11 -10.654  -7.984   4.477
    2    HA   LEU  11           HA       LEU  11  -8.964  -6.544   6.239
    3    HB2  LEU  11           HB2      LEU  11  -8.405  -7.962   3.632
    4    HB3  LEU  11           HB3      LEU  11  -7.140  -7.253   4.634
    5    HG   LEU  11           HG       LEU  11  -9.134  -9.296   5.644
    6   HD13  LEU  11          HD11      LEU  11  -7.903 -10.526   4.081
    7   HD12  LEU  11          HD12      LEU  11  -6.970 -10.761   5.558
    8   HD11  LEU  11          HD13      LEU  11  -6.433  -9.592   4.352
    9   HD22  LEU  11          HD21      LEU  11  -8.290  -8.281   7.563
   10   HD21  LEU  11          HD22      LEU  11  -6.753  -7.871   6.804
   11   HD23  LEU  11          HD23      LEU  11  -7.072  -9.529   7.311

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  12           H        ILE  12  -9.861  -5.998   2.848
    2    HA   ILE  12           HA       ILE  12  -8.180  -3.759   2.427
    3    HB   ILE  12           HB       ILE  12 -10.823  -4.461   1.126
    4   HG12  ILE  12          HG12      ILE  12  -8.773  -6.079   1.032
    5   HG13  ILE  12          HG13      ILE  12  -9.607  -5.697  -0.460
    6   HG21  ILE  12          HG21      ILE  12  -8.638  -2.520   0.303
    7   HG23  ILE  12          HG22      ILE  12 -10.305  -2.119   0.697
    8   HG22  ILE  12          HG23      ILE  12  -9.934  -3.044  -0.728
    9   HD13  ILE  12          HD11      ILE  12  -7.886  -4.084  -1.039
   10   HD12  ILE  12          HD12      ILE  12  -7.114  -5.615  -0.634
   11   HD11  ILE  12          HD13      ILE  12  -7.110  -4.301   0.519

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  13           H        ILE  13 -11.542  -4.045   3.513
    2    HA   ILE  13           HA       ILE  13 -12.018  -1.261   3.784
    3    HB   ILE  13           HB       ILE  13 -13.212  -3.693   5.134
    4   HG12  ILE  13          HG12      ILE  13 -13.448  -3.168   2.609
    5   HG13  ILE  13          HG13      ILE  13 -14.888  -3.576   3.516
    6   HG23  ILE  13          HG21      ILE  13 -13.698  -2.006   6.700
    7   HG22  ILE  13          HG22      ILE  13 -15.127  -2.009   5.676
    8   HG21  ILE  13          HG23      ILE  13 -13.895  -0.768   5.461
    9   HD11  ILE  13          HD11      ILE  13 -14.185  -0.690   3.428
   10   HD13  ILE  13          HD12      ILE  13 -15.749  -1.481   3.368
   11   HD12  ILE  13          HD13      ILE  13 -14.762  -1.420   1.926

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ASN  14           H        ASN  14 -10.898  -3.747   6.059
    2    HA   ASN  14           HA       ASN  14 -10.712  -2.110   8.347
    3    HB2  ASN  14           HB2      ASN  14 -10.443  -4.716   8.023
    4    HB3  ASN  14           HB3      ASN  14  -8.736  -4.318   7.870
    5   HD21  ASN  14          HD21      ASN  14  -9.368  -5.848  10.043
    6   HD22  ASN  14          HD22      ASN  14  -9.349  -4.929  11.468

  No H/Q in entry =           6
  In of MODEL   11
    1    H    SER  15           H        SER  15  -8.299  -2.917   5.860
    2    HA   SER  15           HA       SER  15  -6.167  -1.412   6.938
    3    HB2  SER  15           HB2      SER  15  -5.140  -1.620   4.784
    4    HB3  SER  15           HB3      SER  15  -6.089  -3.086   5.002
    5    HG   SER  15           HG       SER  15  -6.361  -1.086   3.183

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLY  16           H        GLY  16  -8.769  -0.560   4.686
    2    HA3  GLY  16           HA2      GLY  16  -7.927   2.087   4.138
    3    HA2  GLY  16           HA3      GLY  16  -9.573   1.482   3.972

  No H/Q in entry =           3
  In of MODEL   11
    1    H    GLN  17           H        GLN  17 -10.118   0.751   6.620
    2    HA   GLN  17           HA       GLN  17 -10.845   3.249   7.761
    3    HB2  GLN  17           HB2      GLN  17 -12.041   1.120   8.227
    4    HB3  GLN  17           HB3      GLN  17 -10.642   0.563   9.145
    5    HG2  GLN  17           HG2      GLN  17 -12.281   1.500  10.687
    6    HG3  GLN  17           HG3      GLN  17 -10.873   2.560  10.627
    7   HE21  GLN  17          HE21      GLN  17 -13.732   2.224   8.443
    8   HE22  GLN  17          HE22      GLN  17 -14.153   3.867   8.515

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ALA  18           H        ALA  18  -8.201   0.986   8.384
    2    HA   ALA  18           HA       ALA  18  -7.118   2.208  10.659
    3    HB2  ALA  18           HB1      ALA  18  -6.489  -0.002   9.291
    4    HB3  ALA  18           HB2      ALA  18  -5.334   0.788  10.365
    5    HB1  ALA  18           HB3      ALA  18  -5.255   1.069   8.625

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ARG  19           H        ARG  19  -6.342   2.740   7.212
    2    HA   ARG  19           HA       ARG  19  -4.460   4.801   7.647
    3    HB2  ARG  19           HB2      ARG  19  -4.774   3.660   5.450
    4    HB3  ARG  19           HB3      ARG  19  -6.322   4.489   5.270
    5    HG2  ARG  19           HG2      ARG  19  -5.210   6.669   5.343
    6    HG3  ARG  19           HG3      ARG  19  -3.656   5.895   5.650
    7    HD2  ARG  19           HD2      ARG  19  -3.780   6.486   3.307
    8    HD3  ARG  19           HD3      ARG  19  -3.852   4.725   3.451
    9    HE   ARG  19           HE       ARG  19  -6.492   5.614   3.438
   10   HH21  ARG  19          HH11      ARG  19  -7.684   5.762   1.517
   11   HH22  ARG  19          HH12      ARG  19  -6.859   5.848  -0.001
   12   HH11  ARG  19          HH21      ARG  19  -3.712   5.700   1.411
   13   HH12  ARG  19          HH22      ARG  19  -4.609   5.810  -0.061

  No H/Q in entry =          13
  In of MODEL   11
    1    H    SER  20           H        SER  20  -7.958   4.889   7.038
    2    HA   SER  20           HA       SER  20  -8.337   7.642   6.991
    3    HB2  SER  20           HB2      SER  20 -10.201   6.287   6.449
    4    HB3  SER  20           HB3      SER  20 -10.090   5.393   7.963
    5    HG   SER  20           HG       SER  20 -10.486   7.530   8.964

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU  21           H        LEU  21  -8.326   5.458   9.794
    2    HA   LEU  21           HA       LEU  21  -8.788   7.449  11.759
    3    HB2  LEU  21           HB2      LEU  21  -7.415   4.758  11.919
    4    HB3  LEU  21           HB3      LEU  21  -7.733   5.772  13.324
    5    HG   LEU  21           HG       LEU  21  -9.895   4.861  11.401
    6   HD13  LEU  21          HD11      LEU  21  -8.921   2.896  12.460
    7   HD12  LEU  21          HD12      LEU  21 -10.488   3.228  13.198
    8   HD11  LEU  21          HD13      LEU  21  -9.004   3.669  14.044
    9   HD22  LEU  21          HD21      LEU  21 -10.806   6.677  12.565
   10   HD21  LEU  21          HD22      LEU  21  -9.855   6.374  14.014
   11   HD23  LEU  21          HD23      LEU  21 -11.236   5.355  13.644

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ALA  22           H        ALA  22  -5.821   6.101  10.358
    2    HA   ALA  22           HA       ALA  22  -3.957   7.430  11.986
    3    HB2  ALA  22           HB1      ALA  22  -3.520   5.580  10.295
    4    HB1  ALA  22           HB2      ALA  22  -2.336   6.887  10.334
    5    HB3  ALA  22           HB3      ALA  22  -3.550   6.833   9.054

  No H/Q in entry =           5
  In of MODEL   11
    1    H    TYR  23           H        TYR  23  -5.274   8.437   8.800
    2    HA   TYR  23           HA       TYR  23  -3.959  10.945   8.735
    3    HB2  TYR  23           HB2      TYR  23  -5.027  10.024   6.740
    4    HB3  TYR  23           HB3      TYR  23  -6.608  10.118   7.517
    5    HD1  TYR  23           HD1      TYR  23  -3.716  12.188   6.383
    6    HD2  TYR  23           HD2      TYR  23  -7.867  12.116   7.485
    7    HE1  TYR  23           HE1      TYR  23  -3.958  14.536   5.624
    8    HE2  TYR  23           HE2      TYR  23  -8.108  14.465   6.724
    9    HH   TYR  23           HH       TYR  23  -5.374  16.210   5.256

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ALA  24           H        ALA  24  -7.074   9.939  10.105
    2    HA   ALA  24           HA       ALA  24  -7.935  12.521  10.875
    3    HB1  ALA  24           HB1      ALA  24  -9.744  11.254  11.337
    4    HB2  ALA  24           HB2      ALA  24  -8.917  10.689  12.787
    5    HB3  ALA  24           HB3      ALA  24  -8.780   9.779  11.283

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA  25           H        ALA  25  -5.916  10.080  12.454
    2    HA   ALA  25           HA       ALA  25  -5.596  11.334  14.957
    3    HB2  ALA  25           HB1      ALA  25  -4.806   8.989  14.137
    4    HB3  ALA  25           HB2      ALA  25  -3.802   9.855  15.302
    5    HB1  ALA  25           HB3      ALA  25  -3.361   9.843  13.593

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU  26           H        LEU  26  -3.800  11.650  11.922
    2    HA   LEU  26           HA       LEU  26  -1.859  13.486  12.845
    3    HB2  LEU  26           HB2      LEU  26  -1.542  12.338  10.741
    4    HB3  LEU  26           HB3      LEU  26  -3.019  13.034  10.083
    5    HG   LEU  26           HG       LEU  26  -2.024  15.293  10.222
    6   HD12  LEU  26          HD11      LEU  26   0.513  15.334  10.644
    7   HD11  LEU  26          HD12      LEU  26   0.301  13.751  11.386
    8   HD13  LEU  26          HD13      LEU  26  -0.521  15.159  12.061
    9   HD21  LEU  26          HD21      LEU  26  -0.260  13.254   8.831
   10   HD23  LEU  26          HD22      LEU  26  -0.317  14.975   8.462
   11   HD22  LEU  26          HD23      LEU  26  -1.731  13.966   8.169

  No H/Q in entry =          11
  In of MODEL   11
    1    H    LYS  27           H        LYS  27  -5.041  13.943  11.359
    2    HA   LYS  27           HA       LYS  27  -5.009  16.732  11.162
    3    HB2  LYS  27           HB2      LYS  27  -6.737  15.241  10.171
    4    HB3  LYS  27           HB3      LYS  27  -7.397  14.978  11.785
    5    HG2  LYS  27           HG2      LYS  27  -7.847  17.380  12.021
    6    HG3  LYS  27           HG3      LYS  27  -7.137  17.684  10.433
    7    HD2  LYS  27           HD2      LYS  27  -8.854  16.236   9.391
    8    HD3  LYS  27           HD3      LYS  27  -9.570  15.949  10.978
    9    HE2  LYS  27           HE2      LYS  27 -10.034  18.357  11.222
   10    HE3  LYS  27           HE3      LYS  27  -9.289  18.665   9.649
   11    HZ3  LYS  27           HZ1      LYS  27 -11.665  18.521   9.401
   12    HZ2  LYS  27           HZ2      LYS  27 -11.703  17.004  10.169
   13    HZ1  LYS  27           HZ3      LYS  27 -10.955  17.174   8.650

  No H/Q in entry =          13
  In of MODEL   11
    1    H    GLN  28           H        GLN  28  -5.888  14.637  13.886
    2    HA   GLN  28           HA       GLN  28  -6.804  16.633  15.661
    3    HB2  GLN  28           HB2      GLN  28  -5.379  14.015  16.210
    4    HB3  GLN  28           HB3      GLN  28  -6.141  15.011  17.451
    5    HG2  GLN  28           HG2      GLN  28  -7.575  13.880  15.032
    6    HG3  GLN  28           HG3      GLN  28  -7.631  13.180  16.648
    7   HE21  GLN  28          HE21      GLN  28  -9.504  14.988  14.677
    8   HE22  GLN  28          HE22      GLN  28 -10.276  15.983  15.815

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ALA  29           H        ALA  29  -3.573  15.361  14.979
    2    HA   ALA  29           HA       ALA  29  -2.151  16.768  16.962
    3    HB1  ALA  29           HB1      ALA  29  -0.212  16.091  15.848
    4    HB3  ALA  29           HB2      ALA  29  -0.964  16.211  14.257
    5    HB2  ALA  29           HB3      ALA  29  -1.379  14.875  15.330

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LYS  30           H        LYS  30  -3.006  17.644  13.631
    2    HA   LYS  30           HA       LYS  30  -1.610  20.092  13.536
    3    HB2  LYS  30           HB2      LYS  30  -4.132  19.204  12.120
    4    HB3  LYS  30           HB3      LYS  30  -3.306  20.724  11.779
    5    HG2  LYS  30           HG2      LYS  30  -1.228  19.443  11.270
    6    HG3  LYS  30           HG3      LYS  30  -2.127  17.942  11.512
    7    HD2  LYS  30           HD2      LYS  30  -3.690  18.575   9.714
    8    HD3  LYS  30           HD3      LYS  30  -2.814  20.088   9.474
    9    HE2  LYS  30           HE2      LYS  30  -0.773  18.806   8.899
   10    HE3  LYS  30           HE3      LYS  30  -1.668  17.299   9.107
   11    HZ2  LYS  30           HZ1      LYS  30  -1.490  18.172   6.766
   12    HZ1  LYS  30           HZ2      LYS  30  -2.542  19.429   7.233
   13    HZ3  LYS  30           HZ3      LYS  30  -3.058  17.809   7.302

  No H/Q in entry =          13
  In of MODEL   11
    1    H    GLN  31           H        GLN  31  -4.710  19.224  14.940
    2    HA   GLN  31           HA       GLN  31  -5.487  21.976  15.392
    3    HB2  GLN  31           HB2      GLN  31  -6.659  19.524  16.710
    4    HB3  GLN  31           HB3      GLN  31  -7.425  21.092  16.464
    5    HG2  GLN  31           HG2      GLN  31  -6.705  20.320  13.875
    6    HG3  GLN  31           HG3      GLN  31  -7.225  18.813  14.620
    7   HE21  GLN  31          HE21      GLN  31  -8.637  20.383  12.516
    8   HE22  GLN  31          HE22      GLN  31 -10.154  20.767  13.171

  No H/Q in entry =           8
  In of MODEL   11
    1    H    GLY  32           H        GLY  32  -3.170  20.058  16.716
    2    HA3  GLY  32           HA2      GLY  32  -1.775  20.524  18.522
    3    HA2  GLY  32           HA3      GLY  32  -2.911  21.762  19.044

  No H/Q in entry =           3
  In of MODEL   11
    1    H    ASP  33           H        ASP  33  -4.320  18.717  18.376
    2    HA   ASP  33           HA       ASP  33  -4.735  18.255  21.255
    3    HB2  ASP  33           HB2      ASP  33  -6.132  17.241  18.773
    4    HB3  ASP  33           HB3      ASP  33  -6.478  16.627  20.388

  No H/Q in entry =           4
  In of MODEL   11
    1    H    PHE  34           H        PHE  34  -2.564  17.412  21.564
    2    HA   PHE  34           HA       PHE  34  -1.552  15.169  20.163
    3    HB2  PHE  34           HB2      PHE  34  -0.945  16.152  22.960
    4    HB3  PHE  34           HB3      PHE  34  -0.010  14.934  22.093
    5    HD1  PHE  34           HD1      PHE  34  -0.197  18.358  22.832
    6    HD2  PHE  34           HD2      PHE  34   0.651  15.662  19.596
    7    HE1  PHE  34           HE1      PHE  34   1.095  20.136  21.683
    8    HE2  PHE  34           HE2      PHE  34   1.937  17.442  18.452
    9    HZ   PHE  34           HZ       PHE  34   2.161  19.676  19.499

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ALA  35           H        ALA  35  -3.599  15.435  23.022
    2    HA   ALA  35           HA       ALA  35  -3.379  12.772  23.916
    3    HB3  ALA  35           HB1      ALA  35  -5.841  13.388  24.768
    4    HB1  ALA  35           HB2      ALA  35  -5.313  15.009  24.315
    5    HB2  ALA  35           HB3      ALA  35  -4.398  14.087  25.508

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA  36           H        ALA  36  -5.830  14.282  21.812
    2    HA   ALA  36           HA       ALA  36  -7.235  11.866  21.329
    3    HB1  ALA  36           HB1      ALA  36  -8.694  13.284  20.371
    4    HB3  ALA  36           HB2      ALA  36  -7.520  13.711  19.125
    5    HB2  ALA  36           HB3      ALA  36  -7.552  14.596  20.650

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA  37           H        ALA  37  -4.557  13.465  19.668
    2    HA   ALA  37           HA       ALA  37  -4.511  11.833  17.369
    3    HB3  ALA  37           HB1      ALA  37  -2.528  13.550  18.798
    4    HB2  ALA  37           HB2      ALA  37  -3.055  13.606  17.117
    5    HB1  ALA  37           HB3      ALA  37  -1.898  12.380  17.639

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LYS  38           H        LYS  38  -2.760  11.530  20.450
    2    HA   LYS  38           HA       LYS  38  -1.424   9.135  19.961
    3    HB2  LYS  38           HB2      LYS  38  -1.758  10.894  22.108
    4    HB3  LYS  38           HB3      LYS  38  -2.373   9.362  22.721
    5    HG2  LYS  38           HG2      LYS  38  -0.273   8.250  22.188
    6    HG3  LYS  38           HG3      LYS  38   0.332   9.698  21.377
    7    HD2  LYS  38           HD2      LYS  38   0.492  10.915  23.415
    8    HD3  LYS  38           HD3      LYS  38  -0.525   9.759  24.278
    9    HE2  LYS  38           HE2      LYS  38   1.830   9.452  24.902
   10    HE3  LYS  38           HE3      LYS  38   1.233   8.034  24.034
   11    HZ3  LYS  38           HZ1      LYS  38   2.536   8.460  22.257
   12    HZ2  LYS  38           HZ2      LYS  38   3.485   9.291  23.397
   13    HZ1  LYS  38           HZ3      LYS  38   2.405  10.148  22.404

  No H/Q in entry =          13
  In of MODEL   11
    1    H    ALA  39           H        ALA  39  -4.667   9.616  21.357
    2    HA   ALA  39           HA       ALA  39  -5.218   6.894  21.857
    3    HB3  ALA  39           HB1      ALA  39  -7.383   8.832  21.088
    4    HB2  ALA  39           HB2      ALA  39  -6.489   9.060  22.591
    5    HB1  ALA  39           HB3      ALA  39  -7.400   7.573  22.324

  No H/Q in entry =           5
  In of MODEL   11
    1    H    MET  40           H        MET  40  -5.805   8.909  19.012
    2    HA   MET  40           HA       MET  40  -7.270   6.973  17.546
    3    HB2  MET  40           HB2      MET  40  -5.668   9.376  16.648
    4    HB3  MET  40           HB3      MET  40  -6.688   8.414  15.574
    5    HG2  MET  40           HG2      MET  40  -7.733   9.655  18.131
    6    HG3  MET  40           HG3      MET  40  -7.790  10.492  16.582
    7    HE3  MET  40           HE1      MET  40 -10.363   8.865  14.510
    8    HE2  MET  40           HE2      MET  40  -8.610   8.989  14.365
    9    HE1  MET  40           HE3      MET  40  -9.535  10.350  14.999

  No H/Q in entry =           9
  In of MODEL   11
    1    H    MET  41           H        MET  41  -3.782   7.724  17.677
    2    HA   MET  41           HA       MET  41  -3.012   5.976  15.576
    3    HB2  MET  41           HB2      MET  41  -1.404   6.646  18.054
    4    HB3  MET  41           HB3      MET  41  -0.780   6.002  16.538
    5    HG2  MET  41           HG2      MET  41  -1.944   8.181  15.535
    6    HG3  MET  41           HG3      MET  41  -1.714   8.768  17.180
    7    HE2  MET  41           HE1      MET  41   1.212   6.682  17.546
    8    HE1  MET  41           HE2      MET  41   0.416   7.971  18.444
    9    HE3  MET  41           HE3      MET  41   2.040   8.222  17.805

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ASP  42           H        ASP  42  -3.403   5.496  19.061
    2    HA   ASP  42           HA       ASP  42  -2.356   2.907  19.220
    3    HB2  ASP  42           HB2      ASP  42  -3.242   4.660  21.042
    4    HB3  ASP  42           HB3      ASP  42  -4.664   3.628  20.965

  No H/Q in entry =           4
  In of MODEL   11
    1    H    GLN  43           H        GLN  43  -5.693   3.996  18.713
    2    HA   GLN  43           HA       GLN  43  -6.824   1.404  18.512
    3    HB2  GLN  43           HB2      GLN  43  -7.757   4.053  17.384
    4    HB3  GLN  43           HB3      GLN  43  -8.713   2.570  17.358
    5    HG2  GLN  43           HG2      GLN  43  -8.425   2.447  19.866
    6    HG3  GLN  43           HG3      GLN  43  -7.708   4.055  19.799
    7   HE21  GLN  43          HE21      GLN  43  -9.891   4.123  21.294
    8   HE22  GLN  43          HE22      GLN  43 -11.252   4.693  20.460

  No H/Q in entry =           8
  In of MODEL   11
    1    H    SER  44           H        SER  44  -5.489   3.627  16.106
    2    HA   SER  44           HA       SER  44  -6.177   2.143  13.814
    3    HB2  SER  44           HB2      SER  44  -4.933   4.532  14.264
    4    HB3  SER  44           HB3      SER  44  -3.573   3.543  13.735
    5    HG   SER  44           HG       SER  44  -4.686   4.512  11.971

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ARG  45           H        ARG  45  -3.304   2.040  15.901
    2    HA   ARG  45           HA       ARG  45  -1.812   0.095  14.520
    3    HB2  ARG  45           HB2      ARG  45  -0.981   1.517  16.392
    4    HB3  ARG  45           HB3      ARG  45  -1.971   0.581  17.509
    5    HG2  ARG  45           HG2      ARG  45  -0.729  -1.472  16.867
    6    HG3  ARG  45           HG3      ARG  45   0.285  -0.510  15.792
    7    HD2  ARG  45           HD2      ARG  45   1.009   0.871  17.751
    8    HD3  ARG  45           HD3      ARG  45   0.089  -0.210  18.821
    9    HE   ARG  45           HE       ARG  45   1.799  -1.795  17.243
   10   HH21  ARG  45          HH11      ARG  45   3.701  -2.611  18.084
   11   HH22  ARG  45          HH12      ARG  45   4.467  -1.823  19.418
   12   HH11  ARG  45          HH21      ARG  45   2.085   0.669  19.637
   13   HH12  ARG  45          HH22      ARG  45   3.552   0.037  20.295

  No H/Q in entry =          13
  In of MODEL   11
    1    H    MET  46           H        MET  46  -4.214  -0.240  17.113
    2    HA   MET  46           HA       MET  46  -4.035  -3.039  17.416
    3    HB2  MET  46           HB2      MET  46  -6.210  -1.039  18.018
    4    HB3  MET  46           HB3      MET  46  -6.419  -2.761  18.346
    5    HG2  MET  46           HG2      MET  46  -4.432  -2.765  19.772
    6    HG3  MET  46           HG3      MET  46  -4.126  -1.077  19.394
    7    HE1  MET  46           HE1      MET  46  -6.334  -3.680  20.631
    8    HE3  MET  46           HE2      MET  46  -7.847  -2.791  20.489
    9    HE2  MET  46           HE3      MET  46  -7.140  -3.061  22.078

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ALA  47           H        ALA  47  -6.058  -1.028  15.319
    2    HA   ALA  47           HA       ALA  47  -7.665  -3.084  14.246
    3    HB3  ALA  47           HB1      ALA  47  -8.353  -0.848  13.832
    4    HB1  ALA  47           HB2      ALA  47  -7.857  -1.477  12.261
    5    HB2  ALA  47           HB3      ALA  47  -6.783  -0.406  13.162

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU  48           H        LEU  48  -4.548  -1.761  13.206
    2    HA   LEU  48           HA       LEU  48  -4.255  -3.347  10.863
    3    HB2  LEU  48           HB2      LEU  48  -2.208  -2.064  12.679
    4    HB3  LEU  48           HB3      LEU  48  -1.832  -2.781  11.112
    5    HG   LEU  48           HG       LEU  48  -3.864  -0.571  11.499
    6   HD13  LEU  48          HD11      LEU  48  -1.747   0.312  12.172
    7   HD12  LEU  48          HD12      LEU  48  -2.019   0.867  10.520
    8   HD11  LEU  48          HD13      LEU  48  -0.918  -0.476  10.829
    9   HD22  LEU  48          HD21      LEU  48  -4.326  -1.554   9.421
   10   HD21  LEU  48          HD22      LEU  48  -2.641  -1.983   9.129
   11   HD23  LEU  48          HD23      LEU  48  -3.165  -0.305   8.971

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ASN  49           H        ASN  49  -3.218  -3.746  14.211
    2    HA   ASN  49           HA       ASN  49  -1.607  -6.003  13.882
    3    HB2  ASN  49           HB2      ASN  49  -1.622  -4.691  15.933
    4    HB3  ASN  49           HB3      ASN  49  -3.294  -5.134  16.244
    5   HD21  ASN  49          HD21      ASN  49   0.021  -6.225  16.443
    6   HD22  ASN  49          HD22      ASN  49  -0.307  -7.682  17.245

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLU  50           H        GLU  50  -5.078  -5.739  14.544
    2    HA   GLU  50           HA       GLU  50  -5.583  -8.540  14.646
    3    HB2  GLU  50           HB2      GLU  50  -7.176  -6.858  15.521
    4    HB3  GLU  50           HB3      GLU  50  -7.466  -6.292  13.874
    5    HG2  GLU  50           HG2      GLU  50  -8.324  -8.489  13.230
    6    HG3  GLU  50           HG3      GLU  50  -7.946  -9.135  14.824

  No H/Q in entry =           6
  In of MODEL   11
    1    H    ALA  51           H        ALA  51  -5.650  -6.137  12.054
    2    HA   ALA  51           HA       ALA  51  -6.626  -7.864  10.027
    3    HB2  ALA  51           HB1      ALA  51  -6.406  -6.049   8.661
    4    HB1  ALA  51           HB2      ALA  51  -4.769  -5.697   9.215
    5    HB3  ALA  51           HB3      ALA  51  -6.156  -5.190  10.180

  No H/Q in entry =           5
  In of MODEL   11
    1    H    HIS  52           H        HIS  52  -3.340  -6.952  11.021
    2    HA   HIS  52           HA       HIS  52  -1.932  -8.435   9.073
    3    HB2  HIS  52           HB2      HIS  52  -0.908  -6.701  10.521
    4    HB3  HIS  52           HB3      HIS  52  -1.076  -7.782  11.904
    5    HD1  HIS  52           HD1      HIS  52   0.259 -10.118  11.713
    6    HD2  HIS  52           HD2      HIS  52   1.351  -7.180   8.963
    7    HE1  HIS  52           HE1      HIS  52   2.498 -10.824  10.762
    8    HE2  HIS  52           HE2      HIS  52   3.177  -9.044   9.083

  No H/Q in entry =           8
  In of MODEL   11
    1    H    LEU  53           H        LEU  53  -3.152  -9.320  12.281
    2    HA   LEU  53           HA       LEU  53  -1.951 -11.863  12.474
    3    HB2  LEU  53           HB2      LEU  53  -4.441 -10.687  13.682
    4    HB3  LEU  53           HB3      LEU  53  -3.980 -12.362  13.973
    5    HG   LEU  53           HG       LEU  53  -2.102 -10.029  14.467
    6   HD13  LEU  53          HD11      LEU  53  -4.095  -9.818  15.903
    7   HD12  LEU  53          HD12      LEU  53  -2.684 -10.281  16.852
    8   HD11  LEU  53          HD13      LEU  53  -3.896 -11.485  16.430
    9   HD22  LEU  53          HD21      LEU  53  -0.772 -11.965  14.423
   10   HD21  LEU  53          HD22      LEU  53  -2.063 -12.983  15.050
   11   HD23  LEU  53          HD23      LEU  53  -1.205 -11.897  16.127

  No H/Q in entry =          11
  In of MODEL   11
    1    H    VAL  54           H        VAL  54  -5.059 -10.835  11.104
    2    HA   VAL  54           HA       VAL  54  -5.968 -13.429  10.409
    3    HB   VAL  54           HB       VAL  54  -6.615 -10.695   9.278
    4   HG12  VAL  54          HG11      VAL  54  -8.713 -12.074   8.457
    5   HG11  VAL  54          HG12      VAL  54  -7.600 -13.439   8.531
    6   HG13  VAL  54          HG13      VAL  54  -7.239 -12.061   7.492
    7   HG22  VAL  54          HG21      VAL  54  -7.528 -10.737  11.427
    8   HG21  VAL  54          HG22      VAL  54  -7.780 -12.481  11.403
    9   HG23  VAL  54          HG23      VAL  54  -8.860 -11.424  10.496

  No H/Q in entry =           9
  In of MODEL   11
    1    H    GLN  55           H        GLN  55  -4.094 -10.973   8.630
    2    HA   GLN  55           HA       GLN  55  -3.955 -12.433   6.211
    3    HB2  GLN  55           HB2      GLN  55  -3.352 -10.168   6.026
    4    HB3  GLN  55           HB3      GLN  55  -2.246 -10.246   7.395
    5    HG2  GLN  55           HG2      GLN  55  -0.524 -11.088   6.122
    6    HG3  GLN  55           HG3      GLN  55  -1.594 -12.062   5.123
    7   HE21  GLN  55          HE21      GLN  55  -1.605 -11.368   3.003
    8   HE22  GLN  55          HE22      GLN  55  -1.407  -9.763   2.496

  No H/Q in entry =           8
  In of MODEL   11
    1    H    THR  56           H        THR  56  -1.858 -12.416   9.098
    2    HA   THR  56           HA       THR  56   0.224 -14.012   8.184
    3    HB   THR  56           HB       THR  56  -1.082 -14.042  10.919
    4    HG1  THR  56           HG1      THR  56  -0.016 -12.087   9.849
    5   HG21  THR  56          HG21      THR  56   1.455 -15.247   9.837
    6   HG23  THR  56          HG22      THR  56   0.235 -15.986  10.875
    7   HG22  THR  56          HG23      THR  56   1.336 -14.774  11.531

  No H/Q in entry =           7
  In of MODEL   11
    1    H    LYS  57           H        LYS  57  -2.900 -15.052   9.536
    2    HA   LYS  57           HA       LYS  57  -2.452 -17.847   9.286
    3    HB2  LYS  57           HB2      LYS  57  -4.274 -16.759  10.628
    4    HB3  LYS  57           HB3      LYS  57  -5.062 -16.307   9.124
    5    HG2  LYS  57           HG2      LYS  57  -4.363 -19.176   9.410
    6    HG3  LYS  57           HG3      LYS  57  -5.640 -18.584  10.470
    7    HD2  LYS  57           HD2      LYS  57  -6.820 -17.659   8.467
    8    HD3  LYS  57           HD3      LYS  57  -5.583 -18.384   7.440
    9    HE2  LYS  57           HE2      LYS  57  -7.358 -19.928   9.367
   10    HE3  LYS  57           HE3      LYS  57  -7.619 -19.836   7.626
   11    HZ2  LYS  57           HZ1      LYS  57  -5.677 -21.360   9.126
   12    HZ1  LYS  57           HZ2      LYS  57  -5.049 -20.572   7.757
   13    HZ3  LYS  57           HZ3      LYS  57  -6.349 -21.653   7.594

  No H/Q in entry =          13
  In of MODEL   11
    1    H    LEU  58           H        LEU  58  -3.777 -15.401   7.111
    2    HA   LEU  58           HA       LEU  58  -4.573 -17.223   5.099
    3    HB2  LEU  58           HB2      LEU  58  -3.967 -14.274   4.970
    4    HB3  LEU  58           HB3      LEU  58  -4.626 -15.209   3.627
    5    HG   LEU  58           HG       LEU  58  -5.914 -15.034   6.371
    6   HD11  LEU  58          HD11      LEU  58  -6.207 -13.383   3.881
    7   HD13  LEU  58          HD12      LEU  58  -6.202 -12.878   5.571
    8   HD12  LEU  58          HD13      LEU  58  -7.623 -13.671   4.893
    9   HD22  LEU  58          HD21      LEU  58  -6.874 -16.942   5.495
   10   HD21  LEU  58          HD22      LEU  58  -6.529 -16.487   3.826
   11   HD23  LEU  58          HD23      LEU  58  -7.895 -15.763   4.674

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  59           H        ILE  59  -1.441 -16.013   5.972
    2    HA   ILE  59           HA       ILE  59  -0.334 -16.736   3.337
    3    HB   ILE  59           HB       ILE  59   0.430 -14.671   4.905
    4   HG12  ILE  59          HG12      ILE  59   2.538 -16.326   3.504
    5   HG13  ILE  59          HG13      ILE  59   1.345 -15.404   2.627
    6   HG21  ILE  59          HG21      ILE  59   1.158 -16.439   6.678
    7   HG23  ILE  59          HG22      ILE  59   2.266 -15.134   6.314
    8   HG22  ILE  59          HG23      ILE  59   2.515 -16.734   5.615
    9   HD13  ILE  59          HD11      ILE  59   2.066 -13.340   3.737
   10   HD12  ILE  59          HD12      ILE  59   3.430 -14.110   2.929
   11   HD11  ILE  59          HD13      ILE  59   3.242 -14.255   4.676

  No H/Q in entry =          11
  In of MODEL   11
    1    H    GLU  60           H        GLU  60  -0.356 -17.848   6.703
    2    HA   GLU  60           HA       GLU  60   1.676 -19.825   6.442
    3    HB2  GLU  60           HB2      GLU  60   1.126 -19.282   8.655
    4    HB3  GLU  60           HB3      GLU  60  -0.607 -19.394   8.353
    5    HG2  GLU  60           HG2      GLU  60   0.370 -21.331   9.670
    6    HG3  GLU  60           HG3      GLU  60  -0.503 -21.798   8.212

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLY  61           H        GLY  61  -1.833 -19.922   5.944
    2    HA3  GLY  61           HA2      GLY  61  -1.582 -22.714   4.983
    3    HA2  GLY  61           HA3      GLY  61  -3.069 -21.979   5.572

  No H/Q in entry =           3
  In of MODEL   11
    1    H    ASP  62           H        ASP  62  -0.835 -20.393   3.380
    2    HA   ASP  62           HA       ASP  62  -2.927 -19.890   1.480
    3    HB2  ASP  62           HB2      ASP  62  -1.293 -18.179   1.823
    4    HB3  ASP  62           HB3      ASP  62   0.034 -19.298   1.534

  No H/Q in entry =           4
  In of MODEL   11
    1    H    ALA  63           H        ALA  63  -3.632 -21.444   0.098
    2    HA   ALA  63           HA       ALA  63  -1.591 -23.014  -1.376
    3    HB3  ALA  63           HB1      ALA  63  -2.949 -25.006  -1.230
    4    HB2  ALA  63           HB2      ALA  63  -4.179 -24.138  -0.312
    5    HB1  ALA  63           HB3      ALA  63  -2.590 -24.428   0.399

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLY  64           H        GLY  64  -4.856 -21.700  -1.172
    2    HA3  GLY  64           HA2      GLY  64  -6.360 -21.019  -2.760
    3    HA2  GLY  64           HA3      GLY  64  -4.987 -20.824  -3.835

  No H/Q in entry =           3
  In of MODEL   11
    1    H    GLU  65           H        GLU  65  -5.438 -21.826  -5.720
    2    HA   GLU  65           HA       GLU  65  -7.345 -23.825  -6.067
    3    HB2  GLU  65           HB2      GLU  65  -4.952 -23.107  -7.756
    4    HB3  GLU  65           HB3      GLU  65  -6.201 -24.243  -8.263
    5    HG2  GLU  65           HG2      GLU  65  -7.915 -22.515  -8.026
    6    HG3  GLU  65           HG3      GLU  65  -6.713 -21.375  -7.430

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLY  66           H        GLY  66  -6.477 -25.841  -7.456
    2    HA3  GLY  66           HA2      GLY  66  -5.655 -27.780  -5.590
    3    HA2  GLY  66           HA3      GLY  66  -5.812 -28.012  -7.320

  No H/Q in entry =           3
  In of MODEL   11
    1    H    LYS  67           H        LYS  67  -3.873 -26.037  -8.053
    2    HA   LYS  67           HA       LYS  67  -1.520 -27.658  -7.859
    3    HB2  LYS  67           HB2      LYS  67  -2.111 -25.056  -9.256
    4    HB3  LYS  67           HB3      LYS  67  -0.560 -25.897  -9.371
    5    HG2  LYS  67           HG2      LYS  67  -1.707 -27.922 -10.181
    6    HG3  LYS  67           HG3      LYS  67  -3.260 -27.101 -10.057
    7    HD2  LYS  67           HD2      LYS  67  -2.518 -25.440 -11.726
    8    HD3  LYS  67           HD3      LYS  67  -0.964 -26.269 -11.854
    9    HE2  LYS  67           HE2      LYS  67  -2.119 -28.325 -12.589
   10    HE3  LYS  67           HE3      LYS  67  -3.670 -27.496 -12.467
   11    HZ1  LYS  67           HZ1      LYS  67  -2.245 -25.814 -14.001
   12    HZ3  LYS  67           HZ2      LYS  67  -3.307 -26.998 -14.597
   13    HZ2  LYS  67           HZ3      LYS  67  -1.641 -27.314 -14.508

  No H/Q in entry =          13
  In of MODEL   11
    1    H    MET  68           H        MET  68   0.561 -26.991  -7.302
    2    HA   MET  68           HA       MET  68   0.991 -26.188  -4.744
    3    HB2  MET  68           HB2      MET  68   2.799 -25.863  -7.138
    4    HB3  MET  68           HB3      MET  68   3.332 -25.682  -5.466
    5    HG2  MET  68           HG2      MET  68   2.001 -28.164  -6.588
    6    HG3  MET  68           HG3      MET  68   3.740 -27.979  -6.355
    7    HE2  MET  68           HE1      MET  68   4.090 -26.470  -3.484
    8    HE1  MET  68           HE2      MET  68   4.926 -27.689  -4.444
    9    HE3  MET  68           HE3      MET  68   4.465 -28.050  -2.783

  No H/Q in entry =           9
  In of MODEL   11
    1    H    LYS  69           H        LYS  69  -0.180 -24.100  -7.085
    2    HA   LYS  69           HA       LYS  69   1.195 -21.724  -6.600
    3    HB2  LYS  69           HB2      LYS  69  -1.613 -22.191  -7.550
    4    HB3  LYS  69           HB3      LYS  69  -0.872 -20.588  -7.464
    5    HG2  LYS  69           HG2      LYS  69   0.986 -21.359  -8.884
    6    HG3  LYS  69           HG3      LYS  69   0.255 -22.961  -8.976
    7    HD2  LYS  69           HD2      LYS  69  -1.715 -22.037 -10.088
    8    HD3  LYS  69           HD3      LYS  69  -1.060 -20.404  -9.934
    9    HE2  LYS  69           HE2      LYS  69  -0.605 -21.257 -12.183
   10    HE3  LYS  69           HE3      LYS  69   0.907 -21.094 -11.292
   11    HZ3  LYS  69           HZ1      LYS  69   1.211 -23.197 -11.955
   12    HZ2  LYS  69           HZ2      LYS  69  -0.442 -23.477 -12.228
   13    HZ1  LYS  69           HZ3      LYS  69   0.192 -23.583 -10.655

  No H/Q in entry =          13
  In of MODEL   11
    1    H    VAL  70           H        VAL  70  -0.460 -19.704  -5.952
    2    HA   VAL  70           HA       VAL  70  -1.333 -20.204  -3.167
    3    HB   VAL  70           HB       VAL  70  -0.337 -17.990  -2.567
    4   HG13  VAL  70          HG11      VAL  70   1.764 -18.882  -2.133
    5   HG12  VAL  70          HG12      VAL  70   1.886 -19.632  -3.725
    6   HG11  VAL  70          HG13      VAL  70   0.850 -20.348  -2.490
    7   HG21  VAL  70          HG21      VAL  70   0.774 -18.175  -5.394
    8   HG23  VAL  70          HG22      VAL  70   1.406 -17.077  -4.169
    9   HG22  VAL  70          HG23      VAL  70  -0.253 -16.898  -4.735

  No H/Q in entry =           9
  In of MODEL   11
    1    H    SER  71           H        SER  71  -2.798 -18.561  -2.360
    2    HA   SER  71           HA       SER  71  -4.898 -17.900  -4.143
    3    HB2  SER  71           HB2      SER  71  -5.135 -18.176  -1.641
    4    HB3  SER  71           HB3      SER  71  -4.308 -16.633  -1.443
    5    HG   SER  71           HG       SER  71  -6.829 -17.203  -2.558

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU  72           H        LEU  72  -5.077 -16.267  -5.523
    2    HA   LEU  72           HA       LEU  72  -2.970 -14.452  -5.996
    3    HB2  LEU  72           HB2      LEU  72  -5.802 -14.657  -6.978
    4    HB3  LEU  72           HB3      LEU  72  -4.766 -13.310  -7.442
    5    HG   LEU  72           HG       LEU  72  -3.960 -16.216  -7.794
    6   HD11  LEU  72          HD11      LEU  72  -6.022 -15.535  -9.111
    7   HD13  LEU  72          HD12      LEU  72  -4.649 -16.048 -10.092
    8   HD12  LEU  72          HD13      LEU  72  -5.015 -14.332  -9.918
    9   HD21  LEU  72          HD21      LEU  72  -2.800 -13.551  -8.545
   10   HD23  LEU  72          HD22      LEU  72  -2.545 -14.895  -9.645
   11   HD22  LEU  72          HD23      LEU  72  -1.976 -15.001  -7.981

  No H/Q in entry =          11
  In of MODEL   11
    1    H    VAL  73           H        VAL  73  -6.067 -14.102  -4.373
    2    HA   VAL  73           HA       VAL  73  -6.116 -11.332  -4.016
    3    HB   VAL  73           HB       VAL  73  -7.828 -11.699  -2.423
    4   HG12  VAL  73          HG11      VAL  73  -7.931 -14.113  -4.241
    5   HG11  VAL  73          HG12      VAL  73  -8.207 -12.471  -4.819
    6   HG13  VAL  73          HG13      VAL  73  -9.287 -13.175  -3.615
    7   HG21  VAL  73          HG21      VAL  73  -6.390 -14.300  -2.011
    8   HG23  VAL  73          HG22      VAL  73  -8.119 -14.218  -1.672
    9   HG22  VAL  73          HG23      VAL  73  -7.000 -13.162  -0.810

  No H/Q in entry =           9
  In of MODEL   11
    1    H    LEU  74           H        LEU  74  -4.179 -13.701  -2.433
    2    HA   LEU  74           HA       LEU  74  -3.774 -12.565   0.093
    3    HB2  LEU  74           HB2      LEU  74  -2.987 -14.782  -0.409
    4    HB3  LEU  74           HB3      LEU  74  -1.931 -14.165  -1.679
    5    HG   LEU  74           HG       LEU  74  -0.645 -12.898   0.024
    6   HD13  LEU  74          HD11      LEU  74  -2.210 -12.474   1.759
    7   HD12  LEU  74          HD12      LEU  74  -1.115 -13.674   2.448
    8   HD11  LEU  74          HD13      LEU  74  -2.696 -14.167   1.844
    9   HD21  LEU  74          HD21      LEU  74  -0.395 -15.444  -0.643
   10   HD23  LEU  74          HD22      LEU  74  -0.822 -15.668   1.039
   11   HD22  LEU  74          HD23      LEU  74   0.601 -14.737   0.627

  No H/Q in entry =          11
  In of MODEL   11
    1    H    VAL  75           H        VAL  75  -1.878 -12.163  -2.859
    2    HA   VAL  75           HA       VAL  75  -0.084 -10.239  -1.840
    3    HB   VAL  75           HB       VAL  75  -1.034 -10.709  -4.668
    4   HG11  VAL  75          HG11      VAL  75   1.248  -9.006  -3.572
    5   HG13  VAL  75          HG12      VAL  75  -0.160  -8.428  -4.452
    6   HG12  VAL  75          HG13      VAL  75   1.038  -9.419  -5.269
    7   HG23  VAL  75          HG21      VAL  75   1.307 -11.731  -4.776
    8   HG22  VAL  75          HG22      VAL  75   0.133 -12.625  -3.813
    9   HG21  VAL  75          HG23      VAL  75   1.342 -11.618  -3.016

  No H/Q in entry =           9
  In of MODEL   11
    1    H    GLU  76           H        GLU  76  -3.232  -9.891  -3.504
    2    HA   GLU  76           HA       GLU  76  -3.287  -7.077  -3.599
    3    HB2  GLU  76           HB2      GLU  76  -4.942  -8.505  -4.770
    4    HB3  GLU  76           HB3      GLU  76  -5.592  -9.024  -3.224
    5    HG2  GLU  76           HG2      GLU  76  -7.056  -7.310  -4.082
    6    HG3  GLU  76           HG3      GLU  76  -6.177  -6.604  -2.739

  No H/Q in entry =           6
  In of MODEL   11
    1    H    ALA  77           H        ALA  77  -4.400  -9.312  -1.066
    2    HA   ALA  77           HA       ALA  77  -5.362  -7.315   0.695
    3    HB1  ALA  77           HB1      ALA  77  -4.320 -10.104   1.240
    4    HB3  ALA  77           HB2      ALA  77  -6.002  -9.617   1.032
    5    HB2  ALA  77           HB3      ALA  77  -5.102  -9.088   2.451

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLN  78           H        GLN  78  -2.212  -8.861   0.333
    2    HA   GLN  78           HA       GLN  78  -0.960  -7.705   2.588
    3    HB2  GLN  78           HB2      GLN  78  -0.095  -9.642   1.231
    4    HB3  GLN  78           HB3      GLN  78   0.343  -8.492  -0.032
    5    HG2  GLN  78           HG2      GLN  78   1.803  -7.302   1.548
    6    HG3  GLN  78           HG3      GLN  78   1.362  -8.436   2.822
    7   HE21  GLN  78          HE21      GLN  78   4.089  -8.160   1.965
    8   HE22  GLN  78          HE22      GLN  78   4.550  -9.602   1.197

  No H/Q in entry =           8
  In of MODEL   11
    1    H    LEU  79           H        LEU  79  -1.321  -6.636  -0.757
    2    HA   LEU  79           HA       LEU  79   0.364  -4.409  -0.734
    3    HB2  LEU  79           HB2      LEU  79  -0.658  -5.211  -2.792
    4    HB3  LEU  79           HB3      LEU  79  -2.263  -4.821  -2.186
    5    HG   LEU  79           HG       LEU  79  -1.720  -2.434  -2.153
    6   HD13  LEU  79          HD11      LEU  79   0.520  -2.191  -1.636
    7   HD12  LEU  79          HD12      LEU  79   0.572  -1.899  -3.374
    8   HD11  LEU  79          HD13      LEU  79   1.025  -3.478  -2.731
    9   HD23  LEU  79          HD21      LEU  79  -1.080  -2.229  -4.704
   10   HD22  LEU  79          HD22      LEU  79  -2.607  -2.978  -4.250
   11   HD21  LEU  79          HD23      LEU  79  -1.234  -3.986  -4.694

  No H/Q in entry =          11
  In of MODEL   11
    1    H    HIS  80           H        HIS  80  -3.104  -4.573   0.085
    2    HA   HIS  80           HA       HIS  80  -3.296  -1.819   0.754
    3    HB2  HIS  80           HB2      HIS  80  -4.999  -4.228   1.064
    4    HB3  HIS  80           HB3      HIS  80  -5.321  -2.891   2.171
    5    HD1  HIS  80           HD1      HIS  80  -6.937  -1.251   1.264
    6    HD2  HIS  80           HD2      HIS  80  -4.738  -3.057  -1.784
    7    HE1  HIS  80           HE1      HIS  80  -7.772  -0.249  -0.915
    8    HE2  HIS  80           HE2      HIS  80  -6.439  -1.344  -2.781

  No H/Q in entry =           8
  In of MODEL   11
    1    H    LEU  81           H        LEU  81  -2.812  -4.718   2.742
    2    HA   LEU  81           HA       LEU  81  -2.804  -3.377   5.229
    3    HB2  LEU  81           HB2      LEU  81  -1.585  -5.992   4.345
    4    HB3  LEU  81           HB3      LEU  81  -1.562  -5.437   6.021
    5    HG   LEU  81           HG       LEU  81  -4.104  -5.685   4.387
    6   HD12  LEU  81          HD11      LEU  81  -4.411  -7.754   5.929
    7   HD11  LEU  81          HD12      LEU  81  -2.659  -7.684   6.119
    8   HD13  LEU  81          HD13      LEU  81  -3.365  -7.910   4.518
    9   HD23  LEU  81          HD21      LEU  81  -4.952  -5.893   6.886
   10   HD22  LEU  81          HD22      LEU  81  -4.626  -4.303   6.201
   11   HD21  LEU  81          HD23      LEU  81  -3.441  -5.066   7.261

  No H/Q in entry =          11
  In of MODEL   11
    1    H    MET  82           H        MET  82  -0.119  -4.277   3.061
    2    HA   MET  82           HA       MET  82   1.961  -3.388   4.751
    3    HB2  MET  82           HB2      MET  82   1.752  -3.722   1.758
    4    HB3  MET  82           HB3      MET  82   3.233  -3.154   2.525
    5    HG2  MET  82           HG2      MET  82   1.822  -5.744   3.241
    6    HG3  MET  82           HG3      MET  82   3.196  -5.633   2.144
    7    HE3  MET  82           HE1      MET  82   6.208  -4.904   4.135
    8    HE2  MET  82           HE2      MET  82   5.288  -3.535   3.518
    9    HE1  MET  82           HE3      MET  82   5.377  -5.023   2.579

  No H/Q in entry =           9
  In of MODEL   11
    1    H    THR  83           H        THR  83   0.145  -1.738   2.195
    2    HA   THR  83           HA       THR  83   1.560   0.708   2.290
    3    HB   THR  83           HB       THR  83  -0.614   1.638   1.302
    4    HG1  THR  83           HG1      THR  83  -2.265   0.343   1.189
    5   HG22  THR  83          HG21      THR  83  -0.342  -0.176  -0.703
    6   HG21  THR  83          HG22      THR  83   1.157  -0.472   0.176
    7   HG23  THR  83          HG23      THR  83   0.798   1.143  -0.436

  No H/Q in entry =           7
  In of MODEL   11
    1    H    SER  84           H        SER  84  -1.451  -0.324   3.883
    2    HA   SER  84           HA       SER  84  -1.946   2.103   5.232
    3    HB2  SER  84           HB2      SER  84  -2.784  -0.735   5.789
    4    HB3  SER  84           HB3      SER  84  -3.277   0.604   6.824
    5    HG   SER  84           HG       SER  84  -3.731   0.297   4.030

  No H/Q in entry =           5
  In of MODEL   11
    1    H    MET  85           H        MET  85  -0.242  -0.834   6.358
    2    HA   MET  85           HA       MET  85   0.274   0.086   8.965
    3    HB2  MET  85           HB2      MET  85   0.564  -2.256   8.280
    4    HB3  MET  85           HB3      MET  85   1.951  -1.791   7.294
    5    HG2  MET  85           HG2      MET  85   3.130  -0.982   9.290
    6    HG3  MET  85           HG3      MET  85   1.730  -1.369  10.290
    7    HE1  MET  85           HE1      MET  85   4.399  -2.458   7.969
    8    HE3  MET  85           HE2      MET  85   3.321  -3.656   7.254
    9    HE2  MET  85           HE3      MET  85   4.679  -4.182   8.243

  No H/Q in entry =           9
  In of MODEL   11
    1    H    LEU  86           H        LEU  86   2.214   0.346   6.018
    2    HA   LEU  86           HA       LEU  86   4.428   1.650   7.181
    3    HB2  LEU  86           HB2      LEU  86   4.239   0.573   4.869
    4    HB3  LEU  86           HB3      LEU  86   3.435   2.057   4.358
    5    HG   LEU  86           HG       LEU  86   5.463   3.298   5.345
    6   HD11  LEU  86          HD11      LEU  86   6.163   0.684   6.140
    7   HD13  LEU  86          HD12      LEU  86   7.168   2.127   6.243
    8   HD12  LEU  86          HD13      LEU  86   7.278   1.081   4.829
    9   HD23  LEU  86          HD21      LEU  86   6.181   1.539   2.992
   10   HD22  LEU  86          HD22      LEU  86   6.577   3.235   3.258
   11   HD21  LEU  86          HD23      LEU  86   4.924   2.770   2.856

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ALA  87           H        ALA  87   1.521   2.902   5.594
    2    HA   ALA  87           HA       ALA  87   2.120   5.631   5.684
    3    HB1  ALA  87           HB1      ALA  87  -0.191   4.008   5.136
    4    HB3  ALA  87           HB2      ALA  87   0.123   5.669   4.640
    5    HB2  ALA  87           HB3      ALA  87  -0.674   5.346   6.181

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ARG  88           H        ARG  88   0.422   3.627   8.067
    2    HA   ARG  88           HA       ARG  88  -0.089   5.674   9.917
    3    HB2  ARG  88           HB2      ARG  88  -1.032   3.323   9.977
    4    HB3  ARG  88           HB3      ARG  88   0.507   2.819  10.685
    5    HG2  ARG  88           HG2      ARG  88   0.031   4.890  12.308
    6    HG3  ARG  88           HG3      ARG  88  -1.635   4.569  11.848
    7    HD2  ARG  88           HD2      ARG  88  -1.748   2.718  13.091
    8    HD3  ARG  88           HD3      ARG  88  -0.158   2.134  12.562
    9    HE   ARG  88           HE       ARG  88  -0.694   3.393  15.017
   10   HH21  ARG  88          HH11      ARG  88   0.863   4.400  16.260
   11   HH22  ARG  88          HH12      ARG  88   2.384   4.826  15.559
   12   HH11  ARG  88          HH21      ARG  88   1.591   3.576  12.445
   13   HH12  ARG  88          HH22      ARG  88   2.805   4.343  13.411

  No H/Q in entry =          13
  In of MODEL   11
    1    H    GLU  89           H        GLU  89   2.704   3.451   9.694
    2    HA   GLU  89           HA       GLU  89   3.963   4.333  12.042
    3    HB2  GLU  89           HB2      GLU  89   4.621   2.317  10.696
    4    HB3  GLU  89           HB3      GLU  89   5.400   3.412   9.553
    5    HG2  GLU  89           HG2      GLU  89   6.884   4.253  11.301
    6    HG3  GLU  89           HG3      GLU  89   6.045   3.296  12.517

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LEU  90           H        LEU  90   4.287   5.497   8.717
    2    HA   LEU  90           HA       LEU  90   6.219   7.494   9.310
    3    HB2  LEU  90           HB2      LEU  90   4.216   7.169   7.078
    4    HB3  LEU  90           HB3      LEU  90   5.448   8.438   7.104
    5    HG   LEU  90           HG       LEU  90   6.118   5.501   7.434
    6   HD12  LEU  90          HD11      LEU  90   6.871   5.738   4.996
    7   HD11  LEU  90          HD12      LEU  90   5.857   7.180   4.948
    8   HD13  LEU  90          HD13      LEU  90   5.135   5.607   5.287
    9   HD22  LEU  90          HD21      LEU  90   8.015   6.647   8.121
   10   HD21  LEU  90          HD22      LEU  90   7.669   8.054   7.116
   11   HD23  LEU  90          HD23      LEU  90   8.328   6.590   6.388

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  91           H        ILE  91   2.680   7.513   9.155
    2    HA   ILE  91           HA       ILE  91   2.339  10.285   9.610
    3    HB   ILE  91           HB       ILE  91   0.545   7.910  10.145
    4   HG12  ILE  91          HG12      ILE  91   0.302  10.195   8.164
    5   HG13  ILE  91          HG13      ILE  91   1.162   8.701   7.791
    6   HG22  ILE  91          HG21      ILE  91  -1.186   9.969  10.209
    7   HG21  ILE  91          HG22      ILE  91   0.215  10.797  10.886
    8   HG23  ILE  91          HG23      ILE  91  -0.424   9.359  11.679
    9   HD13  ILE  91          HD11      ILE  91  -0.783   7.414   7.829
   10   HD12  ILE  91          HD12      ILE  91  -1.370   8.931   7.149
   11   HD11  ILE  91          HD13      ILE  91  -1.645   8.564   8.852

  No H/Q in entry =          11
  In of MODEL   11
    1    H    THR  92           H        THR  92   2.737   7.539  11.807
    2    HA   THR  92           HA       THR  92   2.289   8.909  14.233
    3    HB   THR  92           HB       THR  92   4.099   6.575  13.567
    4    HG1  THR  92           HG1      THR  92   2.130   5.818  13.461
    5   HG22  THR  92          HG21      THR  92   3.710   6.286  16.199
    6   HG21  THR  92          HG22      THR  92   3.646   8.045  16.129
    7   HG23  THR  92          HG23      THR  92   5.080   7.191  15.558

  No H/Q in entry =           7
  In of MODEL   11
    1    H    GLU  93           H        GLU  93   5.244   8.463  12.304
    2    HA   GLU  93           HA       GLU  93   6.994   9.887  14.007
    3    HB2  GLU  93           HB2      GLU  93   7.089   9.578  10.991
    4    HB3  GLU  93           HB3      GLU  93   8.427  10.106  12.009
    5    HG2  GLU  93           HG2      GLU  93   7.017   7.469  12.450
    6    HG3  GLU  93           HG3      GLU  93   8.403   7.623  11.377

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LEU  94           H        LEU  94   4.951  10.906  11.292
    2    HA   LEU  94           HA       LEU  94   5.755  13.611  11.197
    3    HB2  LEU  94           HB2      LEU  94   3.167  12.245  10.436
    4    HB3  LEU  94           HB3      LEU  94   3.425  13.973  10.198
    5    HG   LEU  94           HG       LEU  94   5.445  11.988   9.149
    6   HD11  LEU  94          HD11      LEU  94   2.706  12.539   8.081
    7   HD13  LEU  94          HD12      LEU  94   3.690  11.083   7.956
    8   HD12  LEU  94          HD13      LEU  94   4.026  12.466   6.914
    9   HD23  LEU  94          HD21      LEU  94   5.698  13.827   7.429
   10   HD22  LEU  94          HD22      LEU  94   6.109  14.318   9.073
   11   HD21  LEU  94          HD23      LEU  94   4.559  14.786   8.372

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  95           H        ILE  95   3.214  11.989  13.081
    2    HA   ILE  95           HA       ILE  95   2.167  14.336  14.277
    3    HB   ILE  95           HB       ILE  95   2.185  11.453  15.197
    4   HG12  ILE  95          HG12      ILE  95  -0.035  13.226  14.146
    5   HG13  ILE  95          HG13      ILE  95   0.924  12.169  13.114
    6   HG21  ILE  95          HG21      ILE  95   0.897  13.922  16.400
    7   HG23  ILE  95          HG22      ILE  95   1.945  12.753  17.205
    8   HG22  ILE  95          HG23      ILE  95   0.311  12.291  16.726
    9   HD13  ILE  95          HD11      ILE  95   0.022  10.228  14.028
   10   HD12  ILE  95          HD12      ILE  95  -1.362  11.316  14.103
   11   HD11  ILE  95          HD13      ILE  95  -0.400  11.016  15.550

  No H/Q in entry =          11
  In of MODEL   11
    1    H    GLU  96           H        GLU  96   4.762  12.119  15.275
    2    HA   GLU  96           HA       GLU  96   5.310  13.314  17.770
    3    HB2  GLU  96           HB2      GLU  96   6.263  11.157  17.121
    4    HB3  GLU  96           HB3      GLU  96   7.198  11.934  15.845
    5    HG2  GLU  96           HG2      GLU  96   8.842  12.483  17.312
    6    HG3  GLU  96           HG3      GLU  96   7.692  13.293  18.365

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LEU  97           H        LEU  97   6.391  14.093  14.488
    2    HA   LEU  97           HA       LEU  97   8.272  16.091  15.207
    3    HB2  LEU  97           HB2      LEU  97   6.687  15.543  12.707
    4    HB3  LEU  97           HB3      LEU  97   7.704  16.976  12.833
    5    HG   LEU  97           HG       LEU  97   8.737  14.179  13.392
    6   HD12  LEU  97          HD11      LEU  97   9.738  14.379  11.077
    7   HD11  LEU  97          HD12      LEU  97   8.685  15.768  10.813
    8   HD13  LEU  97          HD13      LEU  97   7.988  14.174  11.104
    9   HD23  LEU  97          HD21      LEU  97  10.905  15.463  12.656
   10   HD22  LEU  97          HD22      LEU  97  10.282  15.729  14.284
   11   HD21  LEU  97          HD23      LEU  97   9.968  16.914  13.016

  No H/Q in entry =          11
  In of MODEL   11
    1    H    HIS  98           H        HIS  98   4.782  16.221  14.545
    2    HA   HIS  98           HA       HIS  98   4.476  19.019  14.683
    3    HB2  HIS  98           HB2      HIS  98   2.590  16.764  15.401
    4    HB3  HIS  98           HB3      HIS  98   2.119  18.463  15.459
    5    HD1  HIS  98           HD1      HIS  98   3.152  15.754  13.052
    6    HD2  HIS  98           HD2      HIS  98   1.767  19.685  12.932
    7    HE1  HIS  98           HE1      HIS  98   2.597  16.245  10.627
    8    HE2  HIS  98           HE2      HIS  98   1.758  18.633  10.534

  No H/Q in entry =           8
  In of MODEL   11
    1    H    GLU  99           H        GLU  99   4.609  16.527  17.179
    2    HA   GLU  99           HA       GLU  99   3.992  18.217  19.378
    3    HB2  GLU  99           HB2      GLU  99   3.909  15.735  19.471
    4    HB3  GLU  99           HB3      GLU  99   5.669  15.694  19.367
    5    HG2  GLU  99           HG2      GLU  99   5.850  16.983  21.443
    6    HG3  GLU  99           HG3      GLU  99   4.097  17.120  21.535

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LYS 100           H        LYS 100   7.052  17.296  17.819
    2    HA   LYS 100           HA       LYS 100   8.699  18.697  19.681
    3    HB2  LYS 100           HB2      LYS 100   9.207  17.778  16.842
    4    HB3  LYS 100           HB3      LYS 100  10.432  18.549  17.855
    5    HG2  LYS 100           HG2      LYS 100  10.056  16.795  19.592
    6    HG3  LYS 100           HG3      LYS 100   8.928  15.990  18.497
    7    HD2  LYS 100           HD2      LYS 100  10.727  15.714  16.834
    8    HD3  LYS 100           HD3      LYS 100  11.859  16.530  17.914
    9    HE2  LYS 100           HE2      LYS 100  11.463  14.771  19.628
   10    HE3  LYS 100           HE3      LYS 100  10.392  13.935  18.499
   11    HZ1  LYS 100           HZ1      LYS 100  13.213  14.612  17.851
   12    HZ3  LYS 100           HZ2      LYS 100  12.173  13.556  17.019
   13    HZ2  LYS 100           HZ3      LYS 100  12.759  13.135  18.558

  No H/Q in entry =          13
  In of MODEL   11
    1    H    LEU 101           H        LEU 101   7.011  19.625  16.723
    2    HA   LEU 101           HA       LEU 101   8.220  22.185  16.395
    3    HB2  LEU 101           HB2      LEU 101   5.629  20.947  15.500
    4    HB3  LEU 101           HB3      LEU 101   5.877  22.679  15.297
    5    HG   LEU 101           HG       LEU 101   7.920  20.669  14.332
    6   HD12  LEU 101          HD11      LEU 101   6.771  21.176  12.045
    7   HD11  LEU 101          HD12      LEU 101   5.368  21.601  13.023
    8   HD13  LEU 101          HD13      LEU 101   6.035  19.972  13.104
    9   HD21  LEU 101          HD21      LEU 101   7.287  23.580  13.780
   10   HD23  LEU 101          HD22      LEU 101   8.272  22.624  12.674
   11   HD22  LEU 101          HD23      LEU 101   8.810  22.880  14.334

  No H/Q in entry =          11
  In of MODEL   11
    1    H    LYS 102           H        LYS 102   6.679  21.040  19.005
    2    HA   LYS 102           HA       LYS 102   6.040  22.127  20.938
    3    HB2  LYS 102           HB2      LYS 102   7.322  24.121  19.820
    4    HB3  LYS 102           HB3      LYS 102   5.722  24.724  19.442
    5    HG2  LYS 102           HG2      LYS 102   7.094  24.466  22.096
    6    HG3  LYS 102           HG3      LYS 102   6.140  25.794  21.467
    7    HD2  LYS 102           HD2      LYS 102   4.899  23.154  22.339
    8    HD3  LYS 102           HD3      LYS 102   5.143  24.513  23.425
    9    HE2  LYS 102           HE2      LYS 102   2.868  24.109  21.930
   10    HE3  LYS 102           HE3      LYS 102   3.366  25.654  22.616
   11    HZ2  LYS 102           HZ1      LYS 102   2.841  25.765  20.236
   12    HZ1  LYS 102           HZ2      LYS 102   4.105  24.686  19.914
   13    HZ3  LYS 102           HZ3      LYS 102   4.444  26.216  20.560

  No H/Q in entry =          13
  In of MODEL   11
    1    H    ALA 103           H        ALA 103   4.406  23.671  18.170
    2    HA   ALA 103           HA       ALA 103   1.949  24.242  19.050
    3    HB1  ALA 103           HB1      ALA 103   1.057  23.403  16.804
    4    HB2  ALA 103           HB2      ALA 103   2.706  22.869  16.477
    5    HB3  ALA 103           HB3      ALA 103   2.367  24.580  16.746

  No H/Q in entry =           5
  In of MODEL   11
    1    H1   ALA   1           H3       ALA   1  10.680 -20.200  -6.281
    2    H2   ALA   1           H2       ALA   1   9.719 -20.405  -7.669
    3    H3   ALA   1           H1       ALA   1   9.280 -21.154  -6.209
    4    HA   ALA   1           HA       ALA   1  10.323 -22.961  -6.949
    5    HB1  ALA   1           HB1      ALA   1  10.423 -22.597  -9.224
    6    HB2  ALA   1           HB2      ALA   1  12.149 -22.445  -8.891
    7    HB3  ALA   1           HB3      ALA   1  11.149 -20.999  -9.041

  No H/Q in entry =           7
  In of MODEL   11
    1    H    GLU   2           H        GLU   2  12.608 -23.908  -7.004
    2    HA   GLU   2           HA       GLU   2  13.985 -23.830  -4.789
    3    HB2  GLU   2           HB2      GLU   2  15.346 -23.692  -7.485
    4    HB3  GLU   2           HB3      GLU   2  16.072 -24.305  -6.000
    5    HG2  GLU   2           HG2      GLU   2  15.057 -26.322  -6.246
    6    HG3  GLU   2           HG3      GLU   2  13.486 -25.577  -6.507

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLU   3           H        GLU   3  15.759 -21.959  -7.184
    2    HA   GLU   3           HA       GLU   3  16.907 -20.274  -5.219
    3    HB2  GLU   3           HB2      GLU   3  16.857 -20.267  -8.229
    4    HB3  GLU   3           HB3      GLU   3  17.599 -18.939  -7.338
    5    HG2  GLU   3           HG2      GLU   3  19.261 -20.313  -6.415
    6    HG3  GLU   3           HG3      GLU   3  18.317 -21.780  -6.640

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LEU   4           H        LEU   4  14.629 -19.424  -7.853
    2    HA   LEU   4           HA       LEU   4  14.159 -16.816  -7.237
    3    HB2  LEU   4           HB2      LEU   4  11.987 -18.791  -7.975
    4    HB3  LEU   4           HB3      LEU   4  11.911 -17.042  -8.171
    5    HG   LEU   4           HG       LEU   4  13.880 -18.901  -9.544
    6   HD13  LEU   4          HD11      LEU   4  12.581 -18.750 -11.456
    7   HD12  LEU   4          HD12      LEU   4  11.871 -17.206 -10.987
    8   HD11  LEU   4          HD13      LEU   4  11.317 -18.699 -10.229
    9   HD23  LEU   4          HD21      LEU   4  14.217 -16.653 -10.890
   10   HD22  LEU   4          HD22      LEU   4  15.074 -16.898  -9.370
   11   HD21  LEU   4          HD23      LEU   4  13.620 -15.903  -9.410

  No H/Q in entry =          11
  In of MODEL   11
    1    H    GLU   5           H        GLU   5  12.673 -19.604  -5.603
    2    HA   GLU   5           HA       GLU   5  10.992 -18.037  -3.900
    3    HB2  GLU   5           HB2      GLU   5  10.569 -20.416  -4.428
    4    HB3  GLU   5           HB3      GLU   5  12.002 -20.852  -3.494
    5    HG2  GLU   5           HG2      GLU   5  11.031 -19.843  -1.483
    6    HG3  GLU   5           HG3      GLU   5   9.616 -19.336  -2.405

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLU   6           H        GLU   6  14.138 -19.615  -3.455
    2    HA   GLU   6           HA       GLU   6  14.485 -18.763  -0.754
    3    HB2  GLU   6           HB2      GLU   6  15.718 -20.674  -1.728
    4    HB3  GLU   6           HB3      GLU   6  16.567 -19.564  -2.805
    5    HG2  GLU   6           HG2      GLU   6  17.515 -18.385  -0.872
    6    HG3  GLU   6           HG3      GLU   6  16.636 -19.449   0.225

  No H/Q in entry =           6
  In of MODEL   11
    1    H    VAL   7           H        VAL   7  15.255 -17.430  -3.900
    2    HA   VAL   7           HA       VAL   7  16.937 -15.303  -3.029
    3    HB   VAL   7           HB       VAL   7  15.237 -15.664  -5.510
    4   HG11  VAL   7          HG11      VAL   7  17.126 -13.450  -4.690
    5   HG13  VAL   7          HG12      VAL   7  15.485 -13.309  -5.316
    6   HG12  VAL   7          HG13      VAL   7  16.796 -13.808  -6.385
    7   HG21  VAL   7          HG21      VAL   7  17.344 -17.119  -4.940
    8   HG23  VAL   7          HG22      VAL   7  18.248 -15.656  -5.333
    9   HG22  VAL   7          HG23      VAL   7  17.215 -16.405  -6.548

  No H/Q in entry =           9
  In of MODEL   11
    1    H    VAL   8           H        VAL   8  13.446 -15.576  -3.592
    2    HA   VAL   8           HA       VAL   8  12.776 -12.870  -3.117
    3    HB   VAL   8           HB       VAL   8  11.169 -15.403  -2.694
    4   HG11  VAL   8          HG11      VAL   8  10.411 -12.478  -2.517
    5   HG13  VAL   8          HG12      VAL   8  10.139 -13.745  -1.321
    6   HG12  VAL   8          HG13      VAL   8   9.218 -13.740  -2.824
    7   HG23  VAL   8          HG21      VAL   8  10.511 -13.479  -4.871
    8   HG22  VAL   8          HG22      VAL   8  10.560 -15.239  -4.902
    9   HG21  VAL   8          HG23      VAL   8  12.051 -14.317  -5.063

  No H/Q in entry =           9
  In of MODEL   11
    1    H    MET   9           H        MET   9  13.043 -15.679  -0.942
    2    HA   MET   9           HA       MET   9  12.221 -14.413   1.429
    3    HB2  MET   9           HB2      MET   9  14.089 -16.705   0.858
    4    HB3  MET   9           HB3      MET   9  13.880 -16.105   2.504
    5    HG2  MET   9           HG2      MET   9  11.346 -16.334   2.071
    6    HG3  MET   9           HG3      MET   9  11.806 -17.312   0.676
    7    HE1  MET   9           HE1      MET   9  12.757 -19.366   0.577
    8    HE3  MET   9           HE2      MET   9  13.204 -20.474   1.871
    9    HE2  MET   9           HE3      MET   9  14.268 -19.131   1.465

  No H/Q in entry =           9
  In of MODEL   11
    1    H    GLY  10           H        GLY  10  15.406 -14.629  -0.121
    2    HA3  GLY  10           HA2      GLY  10  16.858 -13.209   1.854
    3    HA2  GLY  10           HA3      GLY  10  17.325 -13.370   0.161

  No H/Q in entry =           3
  In of MODEL   11
    1    H    LEU  11           H        LEU  11  15.156 -12.151  -1.080
    2    HA   LEU  11           HA       LEU  11  15.835  -9.405  -0.911
    3    HB2  LEU  11           HB2      LEU  11  13.473 -10.818  -2.153
    4    HB3  LEU  11           HB3      LEU  11  13.750  -9.083  -2.309
    5    HG   LEU  11           HG       LEU  11  15.783 -11.185  -3.097
    6   HD13  LEU  11          HD11      LEU  11  14.041 -11.553  -4.621
    7   HD12  LEU  11          HD12      LEU  11  15.043 -10.368  -5.457
    8   HD11  LEU  11          HD13      LEU  11  13.567  -9.855  -4.640
    9   HD22  LEU  11          HD21      LEU  11  17.010  -9.219  -2.865
   10   HD21  LEU  11          HD22      LEU  11  15.633  -8.185  -3.244
   11   HD23  LEU  11          HD23      LEU  11  16.469  -9.049  -4.533

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  12           H        ILE  12  13.068 -11.240   0.348
    2    HA   ILE  12           HA       ILE  12  11.667  -9.022   1.409
    3    HB   ILE  12           HB       ILE  12  11.712 -11.919   2.311
    4   HG12  ILE  12          HG12      ILE  12  10.968 -11.258  -0.092
    5   HG13  ILE  12          HG13      ILE  12   9.910 -12.302   0.837
    6   HG21  ILE  12          HG21      ILE  12   9.790  -9.666   2.985
    7   HG23  ILE  12          HG22      ILE  12  10.825 -10.542   4.112
    8   HG22  ILE  12          HG23      ILE  12   9.481 -11.368   3.326
    9   HD13  ILE  12          HD11      ILE  12   8.498 -10.400   1.394
   10   HD12  ILE  12          HD12      ILE  12   8.713 -10.468  -0.354
   11   HD11  ILE  12          HD13      ILE  12   9.613  -9.305   0.595

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  13           H        ILE  13  14.064 -11.222   2.815
    2    HA   ILE  13           HA       ILE  13  14.090 -10.047   5.398
    3    HB   ILE  13           HB       ILE  13  16.161 -11.608   3.834
    4   HG12  ILE  13          HG12      ILE  13  13.912 -12.622   4.615
    5   HG13  ILE  13          HG13      ILE  13  15.389 -13.503   4.993
    6   HG23  ILE  13          HG21      ILE  13  17.509 -10.452   5.379
    7   HG22  ILE  13          HG22      ILE  13  17.166 -11.964   6.209
    8   HG21  ILE  13          HG23      ILE  13  16.282 -10.500   6.643
    9   HD11  ILE  13          HD11      ILE  13  14.546 -11.524   7.045
   10   HD13  ILE  13          HD12      ILE  13  15.173 -13.158   7.236
   11   HD12  ILE  13          HD13      ILE  13  13.478 -12.911   6.838

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ASN  14           H        ASN  14  16.048  -9.504   2.484
    2    HA   ASN  14           HA       ASN  14  17.782  -7.557   3.553
    3    HB2  ASN  14           HB2      ASN  14  17.770  -8.820   1.235
    4    HB3  ASN  14           HB3      ASN  14  16.872  -7.405   0.699
    5   HD21  ASN  14          HD21      ASN  14  19.316  -7.732  -0.482
    6   HD22  ASN  14          HD22      ASN  14  20.453  -6.645   0.149

  No H/Q in entry =           6
  In of MODEL   11
    1    H    SER  15           H        SER  15  14.673  -7.221   1.855
    2    HA   SER  15           HA       SER  15  14.548  -4.401   1.916
    3    HB2  SER  15           HB2      SER  15  12.222  -4.656   1.407
    4    HB3  SER  15           HB3      SER  15  13.023  -6.026   0.647
    5    HG   SER  15           HG       SER  15  11.204  -5.965   2.672

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLY  16           H        GLY  16  13.461  -6.870   4.213
    2    HA3  GLY  16           HA2      GLY  16  12.228  -5.131   6.071
    3    HA2  GLY  16           HA3      GLY  16  12.849  -6.736   6.431

  No H/Q in entry =           3
  In of MODEL   11
    1    H    GLN  17           H        GLN  17  15.560  -6.389   5.845
    2    HA   GLN  17           HA       GLN  17  16.505  -5.167   8.230
    3    HB2  GLN  17           HB2      GLN  17  17.732  -6.957   7.003
    4    HB3  GLN  17           HB3      GLN  17  18.072  -5.805   5.712
    5    HG2  GLN  17           HG2      GLN  17  19.991  -5.903   7.206
    6    HG3  GLN  17           HG3      GLN  17  19.208  -4.333   7.383
    7   HE21  GLN  17          HE21      GLN  17  18.491  -7.582   8.801
    8   HE22  GLN  17          HE22      GLN  17  18.477  -7.030  10.405

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ALA  18           H        ALA  18  16.319  -4.085   4.872
    2    HA   ALA  18           HA       ALA  18  17.742  -1.685   5.106
    3    HB2  ALA  18           HB1      ALA  18  16.635  -2.902   3.034
    4    HB3  ALA  18           HB2      ALA  18  16.890  -1.157   3.022
    5    HB1  ALA  18           HB3      ALA  18  15.293  -1.812   3.387

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ARG  19           H        ARG  19  14.244  -2.292   5.494
    2    HA   ARG  19           HA       ARG  19  13.560   0.353   6.212
    3    HB2  ARG  19           HB2      ARG  19  11.890  -1.406   5.618
    4    HB3  ARG  19           HB3      ARG  19  12.232  -2.205   7.155
    5    HG2  ARG  19           HG2      ARG  19  11.508  -0.220   8.396
    6    HG3  ARG  19           HG3      ARG  19  11.257   0.657   6.888
    7    HD2  ARG  19           HD2      ARG  19   9.118  -0.152   7.702
    8    HD3  ARG  19           HD3      ARG  19   9.545  -1.027   6.225
    9    HE   ARG  19           HE       ARG  19  10.507  -2.567   8.330
   10   HH21  ARG  19          HH11      ARG  19   9.264  -4.216   9.263
   11   HH22  ARG  19          HH12      ARG  19   7.545  -4.198   9.088
   12   HH11  ARG  19          HH21      ARG  19   7.508  -1.289   7.230
   13   HH12  ARG  19          HH22      ARG  19   6.551  -2.541   7.932

  No H/Q in entry =          13
  In of MODEL   11
    1    H    SER  20           H        SER  20  14.428  -2.476   8.168
    2    HA   SER  20           HA       SER  20  14.133  -1.383  10.707
    3    HB2  SER  20           HB2      SER  20  14.612  -3.704  10.584
    4    HB3  SER  20           HB3      SER  20  16.064  -3.432   9.623
    5    HG   SER  20           HG       SER  20  16.828  -2.235  11.536

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU  21           H        LEU  21  16.981  -1.302   8.578
    2    HA   LEU  21           HA       LEU  21  18.643   0.190  10.323
    3    HB2  LEU  21           HB2      LEU  21  18.630  -0.081   7.309
    4    HB3  LEU  21           HB3      LEU  21  19.875   0.791   8.199
    5    HG   LEU  21           HG       LEU  21  19.161  -2.105   8.745
    6   HD13  LEU  21          HD11      LEU  21  20.003  -1.919   6.461
    7   HD12  LEU  21          HD12      LEU  21  21.252  -2.628   7.484
    8   HD11  LEU  21          HD13      LEU  21  21.359  -0.933   7.013
    9   HD22  LEU  21          HD21      LEU  21  20.319  -1.369  10.641
   10   HD21  LEU  21          HD22      LEU  21  21.276  -0.195   9.744
   11   HD23  LEU  21          HD23      LEU  21  21.662  -1.904   9.635

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ALA  22           H        ALA  22  16.380   1.152   7.763
    2    HA   ALA  22           HA       ALA  22  16.904   3.913   7.783
    3    HB3  ALA  22           HB1      ALA  22  15.512   2.666   6.099
    4    HB2  ALA  22           HB2      ALA  22  14.796   4.174   6.667
    5    HB1  ALA  22           HB3      ALA  22  14.213   2.630   7.290

  No H/Q in entry =           5
  In of MODEL   11
    1    H    TYR  23           H        TYR  23  14.412   2.080   9.608
    2    HA   TYR  23           HA       TYR  23  13.434   4.310  11.059
    3    HB2  TYR  23           HB2      TYR  23  12.210   2.188  11.031
    4    HB3  TYR  23           HB3      TYR  23  13.544   1.385  11.859
    5    HD1  TYR  23           HD1      TYR  23  11.011   4.101  12.216
    6    HD2  TYR  23           HD2      TYR  23  13.744   1.458  14.217
    7    HE1  TYR  23           HE1      TYR  23  10.072   4.787  14.408
    8    HE2  TYR  23           HE2      TYR  23  12.804   2.143  16.407
    9    HH   TYR  23           HH       TYR  23  10.094   4.454  16.601

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ALA  24           H        ALA  24  16.090   2.046  11.699
    2    HA   ALA  24           HA       ALA  24  16.748   3.040  14.266
    3    HB1  ALA  24           HB1      ALA  24  18.114   1.254  14.101
    4    HB3  ALA  24           HB2      ALA  24  19.140   2.183  13.007
    5    HB2  ALA  24           HB3      ALA  24  17.852   1.169  12.360

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA  25           H        ALA  25  17.709   3.980  10.991
    2    HA   ALA  25           HA       ALA  25  19.643   5.923  11.646
    3    HB1  ALA  25           HB1      ALA  25  18.937   4.975   9.327
    4    HB3  ALA  25           HB2      ALA  25  19.430   6.665   9.424
    5    HB2  ALA  25           HB3      ALA  25  17.718   6.250   9.350

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU  26           H        LEU  26  16.128   6.136  11.276
    2    HA   LEU  26           HA       LEU  26  15.890   8.916  11.731
    3    HB2  LEU  26           HB2      LEU  26  14.037   7.673  10.796
    4    HB3  LEU  26           HB3      LEU  26  13.947   6.643  12.219
    5    HG   LEU  26           HG       LEU  26  13.328   8.595  13.602
    6   HD12  LEU  26          HD11      LEU  26  12.661  10.695  12.279
    7   HD11  LEU  26          HD12      LEU  26  13.648  10.049  10.970
    8   HD13  LEU  26          HD13      LEU  26  14.387  10.434  12.525
    9   HD21  LEU  26          HD21      LEU  26  11.661   8.279  11.087
   10   HD23  LEU  26          HD22      LEU  26  11.093   8.971  12.603
   11   HD22  LEU  26          HD23      LEU  26  11.553   7.272  12.531

  No H/Q in entry =          11
  In of MODEL   11
    1    H    LYS  27           H        LYS  27  15.788   6.132  13.919
    2    HA   LYS  27           HA       LYS  27  15.184   7.490  16.288
    3    HB2  LYS  27           HB2      LYS  27  15.223   5.016  16.018
    4    HB3  LYS  27           HB3      LYS  27  16.986   5.076  15.980
    5    HG2  LYS  27           HG2      LYS  27  17.026   6.057  18.231
    6    HG3  LYS  27           HG3      LYS  27  15.259   6.068  18.272
    7    HD2  LYS  27           HD2      LYS  27  15.244   3.602  18.031
    8    HD3  LYS  27           HD3      LYS  27  17.009   3.598  18.024
    9    HE2  LYS  27           HE2      LYS  27  17.033   4.583  20.282
   10    HE3  LYS  27           HE3      LYS  27  15.267   4.616  20.292
   11    HZ3  LYS  27           HZ1      LYS  27  16.060   2.665  21.442
   12    HZ2  LYS  27           HZ2      LYS  27  16.981   2.192  20.092
   13    HZ1  LYS  27           HZ3      LYS  27  15.283   2.191  20.008

  No H/Q in entry =          13
  In of MODEL   11
    1    H    GLN  28           H        GLN  28  18.306   6.923  14.703
    2    HA   GLN  28           HA       GLN  28  19.981   8.008  16.700
    3    HB2  GLN  28           HB2      GLN  28  20.276   7.970  13.685
    4    HB3  GLN  28           HB3      GLN  28  21.558   8.445  14.799
    5    HG2  GLN  28           HG2      GLN  28  20.150   5.760  14.833
    6    HG3  GLN  28           HG3      GLN  28  21.734   6.055  14.117
    7   HE21  GLN  28          HE21      GLN  28  20.461   4.727  16.811
    8   HE22  GLN  28          HE22      GLN  28  21.642   5.153  17.952

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ALA  29           H        ALA  29  18.232   9.491  14.006
    2    HA   ALA  29           HA       ALA  29  19.222  12.114  14.267
    3    HB2  ALA  29           HB1      ALA  29  17.525  12.748  12.792
    4    HB1  ALA  29           HB2      ALA  29  16.383  11.570  13.438
    5    HB3  ALA  29           HB3      ALA  29  17.718  11.034  12.417

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LYS  30           H        LYS  30  16.446  10.504  15.777
    2    HA   LYS  30           HA       LYS  30  15.422  12.752  17.136
    3    HB2  LYS  30           HB2      LYS  30  15.316   9.809  17.834
    4    HB3  LYS  30           HB3      LYS  30  14.445  11.055  18.728
    5    HG2  LYS  30           HG2      LYS  30  13.324  11.742  16.608
    6    HG3  LYS  30           HG3      LYS  30  14.134  10.410  15.780
    7    HD2  LYS  30           HD2      LYS  30  13.062   8.797  17.303
    8    HD3  LYS  30           HD3      LYS  30  12.262  10.118  18.155
    9    HE2  LYS  30           HE2      LYS  30  11.098  10.752  16.060
   10    HE3  LYS  30           HE3      LYS  30  11.878   9.402  15.229
   11    HZ2  LYS  30           HZ1      LYS  30   9.568   8.985  16.102
   12    HZ1  LYS  30           HZ2      LYS  30  10.231   9.037  17.671
   13    HZ3  LYS  30           HZ3      LYS  30  10.745   7.855  16.560

  No H/Q in entry =          13
  In of MODEL   11
    1    H    GLN  31           H        GLN  31  18.086  10.587  17.876
    2    HA   GLN  31           HA       GLN  31  18.404  11.596  20.573
    3    HB2  GLN  31           HB2      GLN  31  20.435  10.033  18.970
    4    HB3  GLN  31           HB3      GLN  31  20.296  10.154  20.725
    5    HG2  GLN  31           HG2      GLN  31  17.786   9.198  19.947
    6    HG3  GLN  31           HG3      GLN  31  18.893   8.358  18.868
    7   HE21  GLN  31          HE21      GLN  31  17.347   7.204  21.138
    8   HE22  GLN  31          HE22      GLN  31  18.501   6.543  22.191

  No H/Q in entry =           8
  In of MODEL   11
    1    H    GLY  32           H        GLY  32  18.928  12.921  17.611
    2    HA3  GLY  32           HA2      GLY  32  19.909  14.969  17.103
    3    HA2  GLY  32           HA3      GLY  32  20.662  14.973  18.693

  No H/Q in entry =           3
  In of MODEL   11
    1    H    ASP  33           H        ASP  33  21.096  12.085  16.911
    2    HA   ASP  33           HA       ASP  33  23.921  12.767  16.453
    3    HB2  ASP  33           HB2      ASP  33  22.418  10.148  16.560
    4    HB3  ASP  33           HB3      ASP  33  24.105  10.269  16.070

  No H/Q in entry =           4
  In of MODEL   11
    1    H    PHE  34           H        PHE  34  23.441  14.093  14.573
    2    HA   PHE  34           HA       PHE  34  22.100  13.111  12.281
    3    HB2  PHE  34           HB2      PHE  34  24.225  15.250  12.521
    4    HB3  PHE  34           HB3      PHE  34  23.244  14.960  11.086
    5    HD1  PHE  34           HD1      PHE  34  23.483  16.889  14.004
    6    HD2  PHE  34           HD2      PHE  34  20.617  14.771  11.607
    7    HE1  PHE  34           HE1      PHE  34  21.661  18.280  14.949
    8    HE2  PHE  34           HE2      PHE  34  18.798  16.162  12.555
    9    HZ   PHE  34           HZ       PHE  34  19.324  17.917  14.222

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ALA  35           H        ALA  35  25.472  12.930  13.297
    2    HA   ALA  35           HA       ALA  35  26.586  12.117  10.841
    3    HB3  ALA  35           HB1      ALA  35  28.265  10.948  12.562
    4    HB2  ALA  35           HB2      ALA  35  27.396  11.969  13.708
    5    HB1  ALA  35           HB3      ALA  35  28.234  12.697  12.339

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA  36           H        ALA  36  25.469  10.152  13.600
    2    HA   ALA  36           HA       ALA  36  25.963   7.668  12.320
    3    HB2  ALA  36           HB1      ALA  36  25.529   6.916  14.393
    4    HB3  ALA  36           HB2      ALA  36  23.840   7.407  14.240
    5    HB1  ALA  36           HB3      ALA  36  25.036   8.541  14.868

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA  37           H        ALA  37  23.135   9.785  12.451
    2    HA   ALA  37           HA       ALA  37  21.287   8.013  11.267
    3    HB3  ALA  37           HB1      ALA  37  21.502  10.976  11.566
    4    HB1  ALA  37           HB2      ALA  37  20.193   9.892  12.033
    5    HB2  ALA  37           HB3      ALA  37  20.384  10.368  10.345

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LYS  38           H        LYS  38  23.382  10.484   9.798
    2    HA   LYS  38           HA       LYS  38  22.751  10.059   7.119
    3    HB2  LYS  38           HB2      LYS  38  24.551  11.620   8.571
    4    HB3  LYS  38           HB3      LYS  38  25.590  10.636   7.546
    5    HG2  LYS  38           HG2      LYS  38  24.428  11.407   5.549
    6    HG3  LYS  38           HG3      LYS  38  23.228  12.255   6.529
    7    HD2  LYS  38           HD2      LYS  38  24.815  13.858   7.288
    8    HD3  LYS  38           HD3      LYS  38  26.180  12.878   6.754
    9    HE2  LYS  38           HE2      LYS  38  25.821  14.751   5.205
   10    HE3  LYS  38           HE3      LYS  38  25.493  13.214   4.397
   11    HZ3  LYS  38           HZ1      LYS  38  23.295  13.650   4.262
   12    HZ2  LYS  38           HZ2      LYS  38  23.811  15.267   4.355
   13    HZ1  LYS  38           HZ3      LYS  38  23.237  14.478   5.744

  No H/Q in entry =          13
  In of MODEL   11
    1    H    ALA  39           H        ALA  39  25.266   8.467   9.078
    2    HA   ALA  39           HA       ALA  39  26.346   6.887   7.008
    3    HB2  ALA  39           HB1      ALA  39  26.254   5.917   9.849
    4    HB1  ALA  39           HB2      ALA  39  27.202   7.347   9.438
    5    HB3  ALA  39           HB3      ALA  39  27.562   5.800   8.672

  No H/Q in entry =           5
  In of MODEL   11
    1    H    MET  40           H        MET  40  23.730   6.256   9.298
    2    HA   MET  40           HA       MET  40  23.300   3.551   8.557
    3    HB2  MET  40           HB2      MET  40  21.472   5.584   9.849
    4    HB3  MET  40           HB3      MET  40  21.073   3.874   9.670
    5    HG2  MET  40           HG2      MET  40  23.615   4.823  11.019
    6    HG3  MET  40           HG3      MET  40  22.120   4.539  11.908
    7    HE3  MET  40           HE1      MET  40  21.571   0.903  12.075
    8    HE2  MET  40           HE2      MET  40  20.699   2.203  11.268
    9    HE1  MET  40           HE3      MET  40  21.435   2.491  12.843

  No H/Q in entry =           9
  In of MODEL   11
    1    H    MET  41           H        MET  41  21.876   6.600   7.373
    2    HA   MET  41           HA       MET  41  19.928   5.400   5.693
    3    HB2  MET  41           HB2      MET  41  21.399   7.998   5.189
    4    HB3  MET  41           HB3      MET  41  19.875   7.499   4.466
    5    HG2  MET  41           HG2      MET  41  19.124   7.302   7.015
    6    HG3  MET  41           HG3      MET  41  20.427   8.465   7.242
    7    HE2  MET  41           HE1      MET  41  19.867   9.757   3.907
    8    HE1  MET  41           HE2      MET  41  20.818  10.198   5.322
    9    HE3  MET  41           HE3      MET  41  19.542  11.273   4.757

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ASP  42           H        ASP  42  23.298   6.339   5.150
    2    HA   ASP  42           HA       ASP  42  23.399   5.871   2.392
    3    HB2  ASP  42           HB2      ASP  42  25.141   6.873   4.168
    4    HB3  ASP  42           HB3      ASP  42  25.806   5.251   4.038

  No H/Q in entry =           4
  In of MODEL   11
    1    H    GLN  43           H        GLN  43  24.126   3.714   5.110
    2    HA   GLN  43           HA       GLN  43  24.805   1.463   3.524
    3    HB2  GLN  43           HB2      GLN  43  23.774   1.636   6.366
    4    HB3  GLN  43           HB3      GLN  43  24.362   0.151   5.609
    5    HG2  GLN  43           HG2      GLN  43  26.521   1.373   5.106
    6    HG3  GLN  43           HG3      GLN  43  25.930   2.695   6.107
    7   HE21  GLN  43          HE21      GLN  43  28.165   1.730   7.146
    8   HE22  GLN  43          HE22      GLN  43  27.892   0.644   8.420

  No H/Q in entry =           8
  In of MODEL   11
    1    H    SER  44           H        SER  44  21.740   2.580   4.904
    2    HA   SER  44           HA       SER  44  20.184   0.331   4.223
    3    HB2  SER  44           HB2      SER  44  19.727   2.855   5.373
    4    HB3  SER  44           HB3      SER  44  18.697   2.810   3.945
    5    HG   SER  44           HG       SER  44  17.603   1.858   5.663

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ARG  45           H        ARG  45  20.917   3.303   2.426
    2    HA   ARG  45           HA       ARG  45  19.400   2.814   0.117
    3    HB2  ARG  45           HB2      ARG  45  20.532   4.955   0.708
    4    HB3  ARG  45           HB3      ARG  45  22.081   4.207   0.325
    5    HG2  ARG  45           HG2      ARG  45  21.305   3.803  -1.992
    6    HG3  ARG  45           HG3      ARG  45  19.768   4.573  -1.608
    7    HD2  ARG  45           HD2      ARG  45  21.008   6.674  -1.016
    8    HD3  ARG  45           HD3      ARG  45  22.509   5.908  -1.583
    9    HE   ARG  45           HE       ARG  45  20.584   5.666  -3.624
   10   HH21  ARG  45          HH11      ARG  45  20.575   7.039  -5.384
   11   HH22  ARG  45          HH12      ARG  45  21.325   8.592  -5.275
   12   HH11  ARG  45          HH21      ARG  45  22.300   8.169  -1.988
   13   HH12  ARG  45          HH22      ARG  45  22.301   9.231  -3.349

  No H/Q in entry =          13
  In of MODEL   11
    1    H    MET  46           H        MET  46  22.766   1.953   0.870
    2    HA   MET  46           HA       MET  46  23.382   0.767  -1.615
    3    HB2  MET  46           HB2      MET  46  24.484   0.440   1.176
    4    HB3  MET  46           HB3      MET  46  25.147  -0.448  -0.200
    5    HG2  MET  46           HG2      MET  46  25.591   1.657  -1.379
    6    HG3  MET  46           HG3      MET  46  24.870   2.570  -0.061
    7    HE1  MET  46           HE1      MET  46  27.270   0.110  -1.223
    8    HE3  MET  46           HE2      MET  46  27.677  -0.597   0.337
    9    HE2  MET  46           HE3      MET  46  28.821   0.481  -0.458

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ALA  47           H        ALA  47  21.998  -0.577   1.355
    2    HA   ALA  47           HA       ALA  47  21.956  -3.289   0.547
    3    HB2  ALA  47           HB1      ALA  47  21.571  -2.834   2.852
    4    HB3  ALA  47           HB2      ALA  47  20.038  -3.441   2.229
    5    HB1  ALA  47           HB3      ALA  47  20.261  -1.710   2.491

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU  48           H        LEU  48  19.595  -0.669   0.191
    2    HA   LEU  48           HA       LEU  48  17.557  -2.208  -1.066
    3    HB2  LEU  48           HB2      LEU  48  18.202   0.749  -1.174
    4    HB3  LEU  48           HB3      LEU  48  16.734   0.035  -1.845
    5    HG   LEU  48           HG       LEU  48  17.584  -0.269   1.045
    6   HD13  LEU  48          HD11      LEU  48  17.159   2.030   0.861
    7   HD12  LEU  48          HD12      LEU  48  15.602   1.377   1.367
    8   HD11  LEU  48          HD13      LEU  48  15.874   1.803  -0.323
    9   HD22  LEU  48          HD21      LEU  48  16.062  -1.988   0.659
   10   HD21  LEU  48          HD22      LEU  48  15.187  -1.086  -0.579
   11   HD23  LEU  48          HD23      LEU  48  14.970  -0.685   1.124

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ASN  49           H        ASN  49  20.241  -0.269  -2.289
    2    HA   ASN  49           HA       ASN  49  19.594  -0.350  -5.014
    3    HB2  ASN  49           HB2      ASN  49  21.262   1.176  -4.115
    4    HB3  ASN  49           HB3      ASN  49  22.287  -0.170  -3.635
    5   HD21  ASN  49          HD21      ASN  49  21.267   1.810  -6.331
    6   HD22  ASN  49          HD22      ASN  49  22.338   1.149  -7.470

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLU  50           H        GLU  50  21.582  -2.541  -3.053
    2    HA   GLU  50           HA       GLU  50  22.292  -4.292  -5.181
    3    HB2  GLU  50           HB2      GLU  50  23.487  -4.266  -3.013
    4    HB3  GLU  50           HB3      GLU  50  22.045  -4.900  -2.219
    5    HG2  GLU  50           HG2      GLU  50  22.143  -6.930  -3.581
    6    HG3  GLU  50           HG3      GLU  50  23.518  -6.292  -4.480

  No H/Q in entry =           6
  In of MODEL   11
    1    H    ALA  51           H        ALA  51  19.633  -4.238  -2.857
    2    HA   ALA  51           HA       ALA  51  18.475  -6.713  -3.620
    3    HB3  ALA  51           HB1      ALA  51  16.879  -6.214  -2.066
    4    HB1  ALA  51           HB2      ALA  51  16.662  -4.568  -2.662
    5    HB2  ALA  51           HB3      ALA  51  18.021  -4.951  -1.605

  No H/Q in entry =           5
  In of MODEL   11
    1    H    HIS  52           H        HIS  52  17.880  -3.365  -4.651
    2    HA   HIS  52           HA       HIS  52  15.770  -3.896  -6.454
    3    HB2  HIS  52           HB2      HIS  52  16.395  -1.630  -5.657
    4    HB3  HIS  52           HB3      HIS  52  17.869  -1.720  -6.620
    5    HD1  HIS  52           HD1      HIS  52  17.493  -2.007  -9.280
    6    HD2  HIS  52           HD2      HIS  52  14.145  -0.834  -7.092
    7    HE1  HIS  52           HE1      HIS  52  15.826  -1.095 -10.954
    8    HE2  HIS  52           HE2      HIS  52  13.780  -0.373  -9.635

  No H/Q in entry =           8
  In of MODEL   11
    1    H    LEU  53           H        LEU  53  19.289  -3.890  -6.882
    2    HA   LEU  53           HA       LEU  53  19.351  -4.202  -9.683
    3    HB2  LEU  53           HB2      LEU  53  21.283  -4.961  -7.508
    4    HB3  LEU  53           HB3      LEU  53  21.603  -5.344  -9.197
    5    HG   LEU  53           HG       LEU  53  20.934  -2.539  -8.247
    6   HD13  LEU  53          HD11      LEU  53  23.006  -3.293  -7.159
    7   HD12  LEU  53          HD12      LEU  53  23.366  -2.098  -8.405
    8   HD11  LEU  53          HD13      LEU  53  23.647  -3.807  -8.717
    9   HD22  LEU  53          HD21      LEU  53  20.641  -2.553 -10.579
   10   HD21  LEU  53          HD22      LEU  53  21.887  -3.772 -10.823
   11   HD23  LEU  53          HD23      LEU  53  22.341  -2.119 -10.459

  No H/Q in entry =          11
  In of MODEL   11
    1    H    VAL  54           H        VAL  54  19.243  -6.592  -7.060
    2    HA   VAL  54           HA       VAL  54  19.376  -8.884  -8.723
    3    HB   VAL  54           HB       VAL  54  18.217  -8.468  -5.956
    4   HG12  VAL  54          HG11      VAL  54  18.550 -11.084  -5.955
    5   HG11  VAL  54          HG12      VAL  54  18.367 -10.914  -7.700
    6   HG13  VAL  54          HG13      VAL  54  17.075 -10.390  -6.622
    7   HG22  VAL  54          HG21      VAL  54  20.532  -8.249  -5.730
    8   HG21  VAL  54          HG22      VAL  54  20.874  -9.338  -7.073
    9   HG23  VAL  54          HG23      VAL  54  20.345  -9.989  -5.521

  No H/Q in entry =           9
  In of MODEL   11
    1    H    GLN  55           H        GLN  55  16.639  -6.992  -7.441
    2    HA   GLN  55           HA       GLN  55  14.626  -8.663  -8.519
    3    HB2  GLN  55           HB2      GLN  55  13.870  -7.142  -6.891
    4    HB3  GLN  55           HB3      GLN  55  14.659  -5.769  -7.665
    5    HG2  GLN  55           HG2      GLN  55  12.935  -5.450  -9.156
    6    HG3  GLN  55           HG3      GLN  55  12.620  -7.171  -9.328
    7   HE21  GLN  55          HE21      GLN  55  10.614  -7.729  -8.526
    8   HE22  GLN  55          HE22      GLN  55   9.836  -6.979  -7.217

  No H/Q in entry =           8
  In of MODEL   11
    1    H    THR  56           H        THR  56  16.356  -5.855  -9.873
    2    HA   THR  56           HA       THR  56  14.919  -5.496 -12.223
    3    HB   THR  56           HB       THR  56  17.919  -5.327 -11.835
    4    HG1  THR  56           HG1      THR  56  16.252  -3.993 -10.614
    5   HG21  THR  56          HG21      THR  56  16.085  -4.517 -14.076
    6   HG23  THR  56          HG22      THR  56  17.641  -5.341 -14.161
    7   HG22  THR  56          HG23      THR  56  17.575  -3.621 -13.773

  No H/Q in entry =           7
  In of MODEL   11
    1    H    LYS  57           H        LYS  57  17.577  -7.783 -11.611
    2    HA   LYS  57           HA       LYS  57  17.585  -8.975 -14.190
    3    HB2  LYS  57           HB2      LYS  57  19.374  -9.221 -12.441
    4    HB3  LYS  57           HB3      LYS  57  18.272 -10.225 -11.510
    5    HG2  LYS  57           HG2      LYS  57  18.681 -11.030 -14.334
    6    HG3  LYS  57           HG3      LYS  57  20.066 -11.236 -13.269
    7    HD2  LYS  57           HD2      LYS  57  18.614 -12.506 -11.682
    8    HD3  LYS  57           HD3      LYS  57  17.287 -12.380 -12.838
    9    HE2  LYS  57           HE2      LYS  57  19.974 -13.675 -13.422
   10    HE3  LYS  57           HE3      LYS  57  18.500 -14.562 -13.039
   11    HZ2  LYS  57           HZ1      LYS  57  19.265 -13.220 -15.481
   12    HZ1  LYS  57           HZ2      LYS  57  17.657 -12.968 -15.002
   13    HZ3  LYS  57           HZ3      LYS  57  18.236 -14.546 -15.244

  No H/Q in entry =          13
  In of MODEL   11
    1    H    LEU  58           H        LEU  58  15.804  -9.653 -11.217
    2    HA   LEU  58           HA       LEU  58  14.594 -12.031 -12.155
    3    HB2  LEU  58           HB2      LEU  58  13.789 -10.131  -9.959
    4    HB3  LEU  58           HB3      LEU  58  12.989 -11.672 -10.277
    5    HG   LEU  58           HG       LEU  58  15.961 -11.381  -9.719
    6   HD11  LEU  58          HD11      LEU  58  13.590 -11.811  -7.929
    7   HD13  LEU  58          HD12      LEU  58  15.039 -10.841  -7.665
    8   HD12  LEU  58          HD13      LEU  58  15.119 -12.597  -7.531
    9   HD22  LEU  58          HD21      LEU  58  15.853 -13.442 -10.749
   10   HD21  LEU  58          HD22      LEU  58  14.140 -13.660 -10.390
   11   HD23  LEU  58          HD23      LEU  58  15.349 -13.956  -9.140

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  59           H        ILE  59  13.909  -8.696 -12.835
    2    HA   ILE  59           HA       ILE  59  11.197  -9.356 -13.778
    3    HB   ILE  59           HB       ILE  59  11.983  -7.074 -12.568
    4   HG12  ILE  59          HG12      ILE  59  10.098  -6.942 -14.932
    5   HG13  ILE  59          HG13      ILE  59   9.667  -7.729 -13.436
    6   HG21  ILE  59          HG21      ILE  59  13.545  -6.660 -14.604
    7   HG23  ILE  59          HG22      ILE  59  12.547  -5.328 -14.063
    8   HG22  ILE  59          HG23      ILE  59  12.081  -6.270 -15.477
    9   HD13  ILE  59          HD11      ILE  59  10.078  -5.657 -12.185
   10   HD12  ILE  59          HD12      ILE  59   8.886  -5.389 -13.454
   11   HD11  ILE  59          HD13      ILE  59  10.550  -4.852 -13.682

  No H/Q in entry =          11
  In of MODEL   11
    1    H    GLU  60           H        GLU  60  14.398  -8.489 -15.033
    2    HA   GLU  60           HA       GLU  60  13.619  -8.090 -17.742
    3    HB2  GLU  60           HB2      GLU  60  15.761  -7.291 -17.208
    4    HB3  GLU  60           HB3      GLU  60  16.210  -8.776 -16.375
    5    HG2  GLU  60           HG2      GLU  60  17.276  -8.464 -18.661
    6    HG3  GLU  60           HG3      GLU  60  16.403  -9.980 -18.447

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLY  61           H        GLY  61  14.608 -10.968 -15.928
    2    HA3  GLY  61           HA2      GLY  61  14.076 -12.616 -18.332
    3    HA2  GLY  61           HA3      GLY  61  15.109 -13.094 -16.989

  No H/Q in entry =           3
  In of MODEL   11
    1    H    ASP  62           H        ASP  62  11.983 -11.562 -16.615
    2    HA   ASP  62           HA       ASP  62  11.062 -13.676 -14.908
    3    HB2  ASP  62           HB2      ASP  62  10.441 -11.457 -14.321
    4    HB3  ASP  62           HB3      ASP  62   9.809 -11.132 -15.931

  No H/Q in entry =           4
  In of MODEL   11
    1    H    ALA  63           H        ALA  63  10.338 -15.591 -15.719
    2    HA   ALA  63           HA       ALA  63   8.399 -15.493 -17.967
    3    HB1  ALA  63           HB1      ALA  63   9.400 -17.492 -18.939
    4    HB3  ALA  63           HB2      ALA  63  10.595 -17.555 -17.646
    5    HB2  ALA  63           HB3      ALA  63  10.625 -16.229 -18.809

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLY  64           H        GLY  64   9.718 -17.197 -15.188
    2    HA3  GLY  64           HA2      GLY  64   8.788 -18.629 -13.659
    3    HA2  GLY  64           HA3      GLY  64   7.229 -17.964 -14.128

  No H/Q in entry =           3
  In of MODEL   11
    1    H    GLU  65           H        GLU  65   5.884 -19.625 -14.554
    2    HA   GLU  65           HA       GLU  65   6.670 -22.210 -15.223
    3    HB2  GLU  65           HB2      GLU  65   4.051 -20.795 -15.694
    4    HB3  GLU  65           HB3      GLU  65   4.290 -22.522 -15.956
    5    HG2  GLU  65           HG2      GLU  65   4.943 -22.825 -13.625
    6    HG3  GLU  65           HG3      GLU  65   4.826 -21.090 -13.338

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLY  66           H        GLY  66   5.365 -23.183 -17.248
    2    HA3  GLY  66           HA2      GLY  66   6.987 -22.752 -19.506
    3    HA2  GLY  66           HA3      GLY  66   5.530 -23.723 -19.453

  No H/Q in entry =           3
  In of MODEL   11
    1    H    LYS  67           H        LYS  67   3.757 -21.617 -18.730
    2    HA   LYS  67           HA       LYS  67   3.224 -20.572 -21.339
    3    HB2  LYS  67           HB2      LYS  67   1.809 -20.285 -18.692
    4    HB3  LYS  67           HB3      LYS  67   1.197 -19.619 -20.211
    5    HG2  LYS  67           HG2      LYS  67   1.260 -21.861 -21.232
    6    HG3  LYS  67           HG3      LYS  67   1.882 -22.535 -19.728
    7    HD2  LYS  67           HD2      LYS  67  -0.180 -21.849 -18.562
    8    HD3  LYS  67           HD3      LYS  67  -0.806 -21.176 -20.069
    9    HE2  LYS  67           HE2      LYS  67  -0.677 -23.402 -21.123
   10    HE3  LYS  67           HE3      LYS  67  -0.052 -24.080 -19.620
   11    HZ1  LYS  67           HZ1      LYS  67  -2.272 -22.823 -18.787
   12    HZ3  LYS  67           HZ2      LYS  67  -2.194 -24.471 -19.188
   13    HZ2  LYS  67           HZ3      LYS  67  -2.752 -23.342 -20.329

  No H/Q in entry =          13
  In of MODEL   11
    1    H    MET  68           H        MET  68   2.787 -18.449 -21.912
    2    HA   MET  68           HA       MET  68   4.769 -16.615 -21.680
    3    HB2  MET  68           HB2      MET  68   1.826 -16.121 -22.127
    4    HB3  MET  68           HB3      MET  68   3.088 -14.923 -22.417
    5    HG2  MET  68           HG2      MET  68   2.990 -17.662 -23.712
    6    HG3  MET  68           HG3      MET  68   2.460 -16.168 -24.485
    7    HE2  MET  68           HE1      MET  68   4.727 -13.920 -23.657
    8    HE1  MET  68           HE2      MET  68   3.641 -14.303 -24.988
    9    HE3  MET  68           HE3      MET  68   5.369 -14.146 -25.290

  No H/Q in entry =           9
  In of MODEL   11
    1    H    LYS  69           H        LYS  69   2.846 -17.419 -19.043
    2    HA   LYS  69           HA       LYS  69   2.350 -14.944 -17.832
    3    HB2  LYS  69           HB2      LYS  69   2.719 -17.699 -16.669
    4    HB3  LYS  69           HB3      LYS  69   2.243 -16.303 -15.699
    5    HG2  LYS  69           HG2      LYS  69   0.316 -15.916 -17.189
    6    HG3  LYS  69           HG3      LYS  69   0.787 -17.312 -18.161
    7    HD2  LYS  69           HD2      LYS  69   0.457 -18.796 -16.245
    8    HD3  LYS  69           HD3      LYS  69   0.069 -17.416 -15.217
    9    HE2  LYS  69           HE2      LYS  69  -2.001 -18.485 -15.971
   10    HE3  LYS  69           HE3      LYS  69  -1.856 -16.885 -16.697
   11    HZ3  LYS  69           HZ1      LYS  69  -2.228 -17.986 -18.592
   12    HZ2  LYS  69           HZ2      LYS  69  -1.785 -19.490 -17.943
   13    HZ1  LYS  69           HZ3      LYS  69  -0.591 -18.416 -18.494

  No H/Q in entry =          13
  In of MODEL   11
    1    H    VAL  70           H        VAL  70   3.333 -14.921 -15.270
    2    HA   VAL  70           HA       VAL  70   6.267 -14.625 -15.536
    3    HB   VAL  70           HB       VAL  70   6.075 -12.499 -14.242
    4   HG13  VAL  70          HG11      VAL  70   5.712 -11.202 -16.146
    5   HG12  VAL  70          HG12      VAL  70   4.355 -12.194 -16.681
    6   HG11  VAL  70          HG13      VAL  70   6.004 -12.785 -16.866
    7   HG21  VAL  70          HG21      VAL  70   3.108 -12.995 -14.679
    8   HG23  VAL  70          HG22      VAL  70   3.772 -11.423 -14.234
    9   HG22  VAL  70          HG23      VAL  70   3.937 -12.793 -13.135

  No H/Q in entry =           9
  In of MODEL   11
    1    H    SER  71           H        SER  71   7.368 -14.548 -13.453
    2    HA   SER  71           HA       SER  71   6.551 -16.563 -11.638
    3    HB2  SER  71           HB2      SER  71   8.916 -15.809 -11.993
    4    HB3  SER  71           HB3      SER  71   8.524 -14.322 -11.131
    5    HG   SER  71           HG       SER  71   8.658 -16.974 -10.203

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU  72           H        LEU  72   5.114 -16.474 -10.009
    2    HA   LEU  72           HA       LEU  72   3.553 -14.169  -9.564
    3    HB2  LEU  72           HB2      LEU  72   3.832 -16.795  -8.139
    4    HB3  LEU  72           HB3      LEU  72   2.794 -15.522  -7.501
    5    HG   LEU  72           HG       LEU  72   2.588 -16.561 -10.347
    6   HD11  LEU  72          HD11      LEU  72   2.123 -18.310  -8.579
    7   HD13  LEU  72          HD12      LEU  72   0.746 -17.938  -9.614
    8   HD12  LEU  72          HD13      LEU  72   0.828 -17.270  -7.984
    9   HD21  LEU  72          HD21      LEU  72   1.023 -14.653  -8.629
   10   HD23  LEU  72          HD22      LEU  72   0.159 -15.589  -9.837
   11   HD22  LEU  72          HD23      LEU  72   1.459 -14.508 -10.328

  No H/Q in entry =          11
  In of MODEL   11
    1    H    VAL  73           H        VAL  73   6.213 -15.596  -7.788
    2    HA   VAL  73           HA       VAL  73   6.142 -14.067  -5.454
    3    HB   VAL  73           HB       VAL  73   8.330 -14.865  -5.025
    4   HG12  VAL  73          HG11      VAL  73   7.077 -16.930  -6.852
    5   HG11  VAL  73          HG12      VAL  73   6.463 -16.568  -5.238
    6   HG13  VAL  73          HG13      VAL  73   8.089 -17.219  -5.439
    7   HG21  VAL  73          HG21      VAL  73   8.506 -14.936  -8.021
    8   HG23  VAL  73          HG22      VAL  73   9.513 -16.033  -7.078
    9   HG22  VAL  73          HG23      VAL  73   9.658 -14.290  -6.852

  No H/Q in entry =           9
  In of MODEL   11
    1    H    LEU  74           H        LEU  74   7.133 -13.164  -8.627
    2    HA   LEU  74           HA       LEU  74   9.069 -11.207  -8.128
    3    HB2  LEU  74           HB2      LEU  74   8.621 -11.954 -10.368
    4    HB3  LEU  74           HB3      LEU  74   6.953 -11.395 -10.270
    5    HG   LEU  74           HG       LEU  74   7.757  -9.063 -10.036
    6   HD13  LEU  74          HD11      LEU  74   9.887  -9.264  -9.012
    7   HD12  LEU  74          HD12      LEU  74  10.248  -8.764 -10.662
    8   HD11  LEU  74          HD13      LEU  74  10.435 -10.453 -10.192
    9   HD21  LEU  74          HD21      LEU  74   7.456 -10.453 -12.259
   10   HD23  LEU  74          HD22      LEU  74   9.178 -10.176 -12.379
   11   HD22  LEU  74          HD23      LEU  74   8.089  -8.809 -12.300

  No H/Q in entry =          11
  In of MODEL   11
    1    H    VAL  75           H        VAL  75   5.572 -10.837  -8.488
    2    HA   VAL  75           HA       VAL  75   5.463  -8.082  -7.897
    3    HB   VAL  75           HB       VAL  75   3.380 -10.234  -7.512
    4   HG11  VAL  75          HG11      VAL  75   3.188  -7.193  -7.358
    5   HG13  VAL  75          HG12      VAL  75   2.874  -8.331  -6.055
    6   HG12  VAL  75          HG13      VAL  75   1.801  -8.275  -7.444
    7   HG23  VAL  75          HG21      VAL  75   2.470  -9.054  -9.586
    8   HG22  VAL  75          HG22      VAL  75   3.958  -9.968  -9.831
    9   HG21  VAL  75          HG23      VAL  75   4.016  -8.212  -9.682

  No H/Q in entry =           9
  In of MODEL   11
    1    H    GLU  76           H        GLU  76   5.217 -10.964  -5.792
    2    HA   GLU  76           HA       GLU  76   4.735  -9.608  -3.370
    3    HB2  GLU  76           HB2      GLU  76   4.566 -12.071  -3.595
    4    HB3  GLU  76           HB3      GLU  76   6.299 -12.170  -3.854
    5    HG2  GLU  76           HG2      GLU  76   5.891 -12.754  -1.553
    6    HG3  GLU  76           HG3      GLU  76   6.627 -11.162  -1.547

  No H/Q in entry =           6
  In of MODEL   11
    1    H    ALA  77           H        ALA  77   7.803 -10.500  -4.927
    2    HA   ALA  77           HA       ALA  77   9.482  -9.452  -2.905
    3    HB3  ALA  77           HB1      ALA  77   9.956  -9.875  -5.862
    4    HB1  ALA  77           HB2      ALA  77  10.397 -10.960  -4.544
    5    HB2  ALA  77           HB3      ALA  77  11.219  -9.410  -4.722

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLN  78           H        GLN  78   8.092  -8.036  -5.820
    2    HA   GLN  78           HA       GLN  78   9.434  -5.552  -5.709
    3    HB2  GLN  78           HB2      GLN  78   8.146  -6.470  -7.671
    4    HB3  GLN  78           HB3      GLN  78   6.660  -6.095  -6.799
    5    HG2  GLN  78           HG2      GLN  78   7.302  -3.724  -6.707
    6    HG3  GLN  78           HG3      GLN  78   8.799  -4.089  -7.564
    7   HE21  GLN  78          HE21      GLN  78   6.867  -2.276  -8.667
    8   HE22  GLN  78          HE22      GLN  78   6.199  -2.991 -10.054

  No H/Q in entry =           8
  In of MODEL   11
    1    H    LEU  79           H        LEU  79   6.415  -6.703  -4.289
    2    HA   LEU  79           HA       LEU  79   5.409  -4.302  -3.279
    3    HB2  LEU  79           HB2      LEU  79   4.102  -6.358  -3.230
    4    HB3  LEU  79           HB3      LEU  79   5.247  -7.095  -2.113
    5    HG   LEU  79           HG       LEU  79   4.683  -5.458  -0.385
    6   HD13  LEU  79          HD11      LEU  79   4.213  -3.443  -1.434
    7   HD12  LEU  79          HD12      LEU  79   2.589  -3.975  -1.001
    8   HD11  LEU  79          HD13      LEU  79   3.175  -4.193  -2.648
    9   HD23  LEU  79          HD21      LEU  79   2.098  -5.959  -0.304
   10   HD22  LEU  79          HD22      LEU  79   3.242  -7.295  -0.193
   11   HD21  LEU  79          HD23      LEU  79   2.432  -6.958  -1.721

  No H/Q in entry =          11
  In of MODEL   11
    1    H    HIS  80           H        HIS  80   7.595  -6.631  -1.693
    2    HA   HIS  80           HA       HIS  80   7.870  -5.092   0.679
    3    HB2  HIS  80           HB2      HIS  80   9.221  -7.449  -0.518
    4    HB3  HIS  80           HB3      HIS  80  10.124  -6.551   0.703
    5    HD1  HIS  80           HD1      HIS  80   9.628  -7.192   3.043
    6    HD2  HIS  80           HD2      HIS  80   6.422  -8.050   0.519
    7    HE1  HIS  80           HE1      HIS  80   7.855  -8.304   4.484
    8    HE2  HIS  80           HE2      HIS  80   5.895  -8.831   2.953

  No H/Q in entry =           8
  In of MODEL   11
    1    H    LEU  81           H        LEU  81   9.887  -5.357  -2.226
    2    HA   LEU  81           HA       LEU  81  11.922  -3.610  -1.338
    3    HB2  LEU  81           HB2      LEU  81  11.013  -4.402  -4.106
    4    HB3  LEU  81           HB3      LEU  81  12.429  -3.391  -3.809
    5    HG   LEU  81           HG       LEU  81  12.040  -6.116  -2.540
    6   HD12  LEU  81          HD11      LEU  81  13.864  -6.734  -4.285
    7   HD11  LEU  81          HD12      LEU  81  13.297  -5.310  -5.156
    8   HD13  LEU  81          HD13      LEU  81  12.189  -6.639  -4.824
    9   HD23  LEU  81          HD21      LEU  81  14.668  -5.793  -2.517
   10   HD22  LEU  81          HD22      LEU  81  13.679  -5.037  -1.269
   11   HD21  LEU  81          HD23      LEU  81  14.259  -4.081  -2.632

  No H/Q in entry =          11
  In of MODEL   11
    1    H    MET  82           H        MET  82   9.004  -2.980  -3.284
    2    HA   MET  82           HA       MET  82   9.538  -0.252  -3.779
    3    HB2  MET  82           HB2      MET  82   6.983  -1.853  -3.666
    4    HB3  MET  82           HB3      MET  82   6.979  -0.128  -4.027
    5    HG2  MET  82           HG2      MET  82   8.591  -2.194  -5.560
    6    HG3  MET  82           HG3      MET  82   7.024  -1.575  -6.077
    7    HE3  MET  82           HE1      MET  82   7.467   1.882  -7.242
    8    HE2  MET  82           HE2      MET  82   7.087   1.653  -5.537
    9    HE1  MET  82           HE3      MET  82   6.429   0.543  -6.736

  No H/Q in entry =           9
  In of MODEL   11
    1    H    THR  83           H        THR  83   7.741  -1.858  -1.183
    2    HA   THR  83           HA       THR  83   6.879   0.486   0.144
    3    HB   THR  83           HB       THR  83   6.741  -1.092   2.159
    4    HG1  THR  83           HG1      THR  83   7.504  -3.040   1.929
    5   HG22  THR  83          HG21      THR  83   5.098  -2.660   0.682
    6   HG21  THR  83          HG22      THR  83   5.325  -1.329  -0.447
    7   HG23  THR  83          HG23      THR  83   4.678  -1.018   1.164

  No H/Q in entry =           7
  In of MODEL   11
    1    H    SER  84           H        SER  84   9.706  -1.606   0.672
    2    HA   SER  84           HA       SER  84  10.754  -0.177   2.866
    3    HB2  SER  84           HB2      SER  84  12.019  -2.013   0.843
    4    HB3  SER  84           HB3      SER  84  12.959  -1.260   2.129
    5    HG   SER  84           HG       SER  84  10.687  -2.955   2.378

  No H/Q in entry =           5
  In of MODEL   11
    1    H    MET  85           H        MET  85  11.519   0.091  -0.619
    2    HA   MET  85           HA       MET  85  13.513   2.060  -0.357
    3    HB2  MET  85           HB2      MET  85  13.128   0.781  -2.426
    4    HB3  MET  85           HB3      MET  85  11.599   1.630  -2.660
    5    HG2  MET  85           HG2      MET  85  12.787   3.778  -2.786
    6    HG3  MET  85           HG3      MET  85  14.319   2.959  -2.498
    7    HE1  MET  85           HE1      MET  85  11.274   3.409  -4.547
    8    HE3  MET  85           HE2      MET  85  11.253   1.696  -4.952
    9    HE2  MET  85           HE3      MET  85  11.650   2.877  -6.193

  No H/Q in entry =           9
  In of MODEL   11
    1    H    LEU  86           H        LEU  86  10.024   2.389  -0.878
    2    HA   LEU  86           HA       LEU  86   9.956   5.202  -1.056
    3    HB2  LEU  86           HB2      LEU  86   8.117   3.540  -1.642
    4    HB3  LEU  86           HB3      LEU  86   7.781   3.447   0.087
    5    HG   LEU  86           HG       LEU  86   7.615   6.007   0.038
    6   HD11  LEU  86          HD11      LEU  86   8.402   5.577  -2.662
    7   HD13  LEU  86          HD12      LEU  86   7.960   7.102  -1.900
    8   HD12  LEU  86          HD13      LEU  86   6.729   6.139  -2.712
    9   HD23  LEU  86          HD21      LEU  86   5.490   4.653  -1.635
   10   HD22  LEU  86          HD22      LEU  86   5.293   5.911  -0.417
   11   HD21  LEU  86          HD23      LEU  86   5.694   4.267   0.075

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ALA  87           H        ALA  87   9.483   3.019   1.685
    2    HA   ALA  87           HA       ALA  87   8.924   4.929   3.655
    3    HB1  ALA  87           HB1      ALA  87   9.737   2.110   3.567
    4    HB3  ALA  87           HB2      ALA  87   8.606   2.918   4.650
    5    HB2  ALA  87           HB3      ALA  87  10.333   2.952   5.000

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ARG  88           H        ARG  88  12.014   3.511   2.683
    2    HA   ARG  88           HA       ARG  88  13.614   4.888   4.524
    3    HB2  ARG  88           HB2      ARG  88  14.291   2.918   3.119
    4    HB3  ARG  88           HB3      ARG  88  14.446   4.013   1.749
    5    HG2  ARG  88           HG2      ARG  88  15.911   5.327   3.703
    6    HG3  ARG  88           HG3      ARG  88  16.233   3.637   4.080
    7    HD2  ARG  88           HD2      ARG  88  17.506   3.345   2.237
    8    HD3  ARG  88           HD3      ARG  88  16.372   4.217   1.201
    9    HE   ARG  88           HE       ARG  88  18.761   5.283   2.259
   10   HH21  ARG  88          HH11      ARG  88  19.104   7.502   2.069
   11   HH22  ARG  88          HH12      ARG  88  17.751   8.572   1.923
   12   HH11  ARG  88          HH21      ARG  88  15.422   6.031   1.970
   13   HH12  ARG  88          HH22      ARG  88  15.666   7.736   1.842

  No H/Q in entry =          13
  In of MODEL   11
    1    H    GLU  89           H        GLU  89  12.651   5.790   1.198
    2    HA   GLU  89           HA       GLU  89  14.195   8.153   1.051
    3    HB2  GLU  89           HB2      GLU  89  13.059   7.113  -0.902
    4    HB3  GLU  89           HB3      GLU  89  11.511   7.650  -0.249
    5    HG2  GLU  89           HG2      GLU  89  12.210   9.989  -0.406
    6    HG3  GLU  89           HG3      GLU  89  13.816   9.502  -0.938

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LEU  90           H        LEU  90  10.863   7.636   2.168
    2    HA   LEU  90           HA       LEU  90  10.341  10.368   2.746
    3    HB2  LEU  90           HB2      LEU  90   9.147   7.791   3.765
    4    HB3  LEU  90           HB3      LEU  90   8.512   9.384   4.189
    5    HG   LEU  90           HG       LEU  90   8.942   8.509   1.320
    6   HD12  LEU  90          HD11      LEU  90   6.408   8.177   1.373
    7   HD11  LEU  90          HD12      LEU  90   6.557   8.164   3.130
    8   HD13  LEU  90          HD13      LEU  90   7.381   6.937   2.166
    9   HD22  LEU  90          HD21      LEU  90   8.644  10.817   1.249
   10   HD21  LEU  90          HD22      LEU  90   7.653  10.846   2.705
   11   HD23  LEU  90          HD23      LEU  90   6.962  10.292   1.181

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  91           H        ILE  91  11.602   7.685   4.668
    2    HA   ILE  91           HA       ILE  91  11.732   9.047   7.139
    3    HB   ILE  91           HB       ILE  91  13.293   6.712   6.017
    4   HG12  ILE  91          HG12      ILE  91  11.269   6.873   8.270
    5   HG13  ILE  91          HG13      ILE  91  10.805   6.594   6.593
    6   HG22  ILE  91          HG21      ILE  91  13.755   6.495   8.659
    7   HG21  ILE  91          HG22      ILE  91  13.677   8.254   8.560
    8   HG23  ILE  91          HG23      ILE  91  14.860   7.370   7.598
    9   HD13  ILE  91          HD11      ILE  91  11.811   4.494   6.522
   10   HD12  ILE  91          HD12      ILE  91  11.212   4.548   8.180
   11   HD11  ILE  91          HD13      ILE  91  12.914   4.865   7.848

  No H/Q in entry =          11
  In of MODEL   11
    1    H    THR  92           H        THR  92  13.958   8.886   4.395
    2    HA   THR  92           HA       THR  92  16.117  10.280   5.563
    3    HB   THR  92           HB       THR  92  15.141  10.158   2.699
    4    HG1  THR  92           HG1      THR  92  15.974   8.262   3.104
    5   HG22  THR  92          HG21      THR  92  17.711  10.853   2.415
    6   HG21  THR  92          HG22      THR  92  17.396  11.671   3.945
    7   HG23  THR  92          HG23      THR  92  16.430  12.059   2.522

  No H/Q in entry =           7
  In of MODEL   11
    1    H    GLU  93           H        GLU  93  13.234  11.432   3.827
    2    HA   GLU  93           HA       GLU  93  13.824  14.193   3.947
    3    HB2  GLU  93           HB2      GLU  93  11.122  12.816   3.950
    4    HB3  GLU  93           HB3      GLU  93  11.408  14.517   3.582
    5    HG2  GLU  93           HG2      GLU  93  12.754  12.279   2.055
    6    HG3  GLU  93           HG3      GLU  93  11.208  12.960   1.564

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LEU  94           H        LEU  94  12.077  12.031   6.149
    2    HA   LEU  94           HA       LEU  94  11.259  13.972   8.026
    3    HB2  LEU  94           HB2      LEU  94  11.839  11.018   8.297
    4    HB3  LEU  94           HB3      LEU  94  11.261  11.990   9.647
    5    HG   LEU  94           HG       LEU  94   9.785  12.044   7.014
    6   HD11  LEU  94          HD11      LEU  94   9.866   9.820   9.015
    7   HD13  LEU  94          HD12      LEU  94   9.570   9.761   7.279
    8   HD12  LEU  94          HD13      LEU  94   8.287  10.274   8.374
    9   HD23  LEU  94          HD21      LEU  94   7.860  12.438   8.609
   10   HD22  LEU  94          HD22      LEU  94   9.097  13.694   8.652
   11   HD21  LEU  94          HD23      LEU  94   9.032  12.475   9.924

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  95           H        ILE  95  14.237  12.048   7.796
    2    HA   ILE  95           HA       ILE  95  15.395  12.969  10.214
    3    HB   ILE  95           HB       ILE  95  16.644  11.906   7.668
    4   HG12  ILE  95          HG12      ILE  95  16.342  10.700  10.433
    5   HG13  ILE  95          HG13      ILE  95  15.179  10.442   9.134
    6   HG21  ILE  95          HG21      ILE  95  17.890  12.711  10.316
    7   HG23  ILE  95          HG22      ILE  95  18.356  13.242   8.699
    8   HG22  ILE  95          HG23      ILE  95  18.664  11.582   9.205
    9   HD13  ILE  95          HD11      ILE  95  16.665   9.168   7.873
   10   HD12  ILE  95          HD12      ILE  95  17.134   8.717   9.510
   11   HD11  ILE  95          HD13      ILE  95  18.088   9.900   8.616

  No H/Q in entry =          11
  In of MODEL   11
    1    H    GLU  96           H        GLU  96  15.558  14.208   6.883
    2    HA   GLU  96           HA       GLU  96  17.400  16.289   7.368
    3    HB2  GLU  96           HB2      GLU  96  16.743  15.629   5.106
    4    HB3  GLU  96           HB3      GLU  96  15.098  16.183   5.402
    5    HG2  GLU  96           HG2      GLU  96  15.662  18.314   4.865
    6    HG3  GLU  96           HG3      GLU  96  16.958  18.314   6.051

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LEU  97           H        LEU  97  13.887  16.095   7.787
    2    HA   LEU  97           HA       LEU  97  13.465  18.827   8.432
    3    HB2  LEU  97           HB2      LEU  97  11.949  16.298   9.038
    4    HB3  LEU  97           HB3      LEU  97  11.431  17.843   9.710
    5    HG   LEU  97           HG       LEU  97  11.924  17.433   6.746
    6   HD12  LEU  97          HD11      LEU  97   9.401  17.301   6.620
    7   HD11  LEU  97          HD12      LEU  97   9.389  17.098   8.370
    8   HD13  LEU  97          HD13      LEU  97  10.175  15.894   7.348
    9   HD23  LEU  97          HD21      LEU  97  10.182  19.394   6.776
   10   HD22  LEU  97          HD22      LEU  97  11.862  19.755   7.174
   11   HD21  LEU  97          HD23      LEU  97  10.670  19.581   8.461

  No H/Q in entry =          11
  In of MODEL   11
    1    H    HIS  98           H        HIS  98  14.285  15.999  10.425
    2    HA   HIS  98           HA       HIS  98  14.118  17.255  12.943
    3    HB2  HIS  98           HB2      HIS  98  15.874  15.002  11.943
    4    HB3  HIS  98           HB3      HIS  98  15.867  15.538  13.625
    5    HD1  HIS  98           HD1      HIS  98  13.678  13.910  11.024
    6    HD2  HIS  98           HD2      HIS  98  13.558  14.822  15.089
    7    HE1  HIS  98           HE1      HIS  98  11.652  12.710  11.968
    8    HE2  HIS  98           HE2      HIS  98  11.559  13.258  14.440

  No H/Q in entry =           8
  In of MODEL   11
    1    H    GLU  99           H        GLU  99  16.679  17.148  10.515
    2    HA   GLU  99           HA       GLU  99  18.658  18.480  12.052
    3    HB2  GLU  99           HB2      GLU  99  19.145  17.197   9.982
    4    HB3  GLU  99           HB3      GLU  99  18.336  18.452   9.041
    5    HG2  GLU  99           HG2      GLU  99  19.939  20.123   9.839
    6    HG3  GLU  99           HG3      GLU  99  20.717  18.921  10.863

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LYS 100           H        LYS 100  16.139  19.643   9.831
    2    HA   LYS 100           HA       LYS 100  16.932  22.381   9.982
    3    HB2  LYS 100           HB2      LYS 100  14.303  21.090   9.217
    4    HB3  LYS 100           HB3      LYS 100  14.601  22.829   9.131
    5    HG2  LYS 100           HG2      LYS 100  16.578  22.385   7.669
    6    HG3  LYS 100           HG3      LYS 100  16.166  20.668   7.682
    7    HD2  LYS 100           HD2      LYS 100  13.973  21.176   6.677
    8    HD3  LYS 100           HD3      LYS 100  14.368  22.896   6.670
    9    HE2  LYS 100           HE2      LYS 100  16.331  22.420   5.215
   10    HE3  LYS 100           HE3      LYS 100  15.868  20.715   5.178
   11    HZ1  LYS 100           HZ1      LYS 100  14.043  22.907   4.342
   12    HZ3  LYS 100           HZ2      LYS 100  13.861  21.238   4.076
   13    HZ2  LYS 100           HZ3      LYS 100  15.073  22.102   3.260

  No H/Q in entry =          13
  In of MODEL   11
    1    H    LEU 101           H        LEU 101  14.832  20.329  11.938
    2    HA   LEU 101           HA       LEU 101  13.659  22.393  13.516
    3    HB2  LEU 101           HB2      LEU 101  14.103  19.443  13.896
    4    HB3  LEU 101           HB3      LEU 101  13.562  20.421  15.257
    5    HG   LEU 101           HG       LEU 101  12.151  20.512  12.584
    6   HD12  LEU 101          HD11      LEU 101  10.490  18.945  13.846
    7   HD11  LEU 101          HD12      LEU 101  11.882  18.531  14.844
    8   HD13  LEU 101          HD13      LEU 101  11.921  18.228  13.106
    9   HD21  LEU 101          HD21      LEU 101  11.486  21.299  15.436
   10   HD23  LEU 101          HD22      LEU 101  10.228  21.075  14.222
   11   HD22  LEU 101          HD23      LEU 101  11.463  22.311  13.990

  No H/Q in entry =          11
  In of MODEL   11
    1    H    LYS 102           H        LYS 102  16.808  21.789  13.087
    2    HA   LYS 102           HA       LYS 102  18.651  22.660  14.166
    3    HB2  LYS 102           HB2      LYS 102  16.832  24.171  15.297
    4    HB3  LYS 102           HB3      LYS 102  17.037  23.106  16.673
    5    HG2  LYS 102           HG2      LYS 102  18.931  25.121  15.512
    6    HG3  LYS 102           HG3      LYS 102  18.545  24.803  17.190
    7    HD2  LYS 102           HD2      LYS 102  20.218  22.895  15.505
    8    HD3  LYS 102           HD3      LYS 102  20.904  24.216  16.442
    9    HE2  LYS 102           HE2      LYS 102  20.505  21.665  17.405
   10    HE3  LYS 102           HE3      LYS 102  20.720  23.105  18.400
   11    HZ2  LYS 102           HZ1      LYS 102  18.750  21.819  19.010
   12    HZ1  LYS 102           HZ2      LYS 102  18.110  22.051  17.460
   13    HZ3  LYS 102           HZ3      LYS 102  18.337  23.379  18.489

  No H/Q in entry =          13
  In of MODEL   11
    1    H    ALA 103           H        ALA 103  16.574  21.048  16.580
    2    HA   ALA 103           HA       ALA 103  18.297  19.836  18.237
    3    HB2  ALA 103           HB1      ALA 103  16.715  17.827  18.223
    4    HB1  ALA 103           HB2      ALA 103  15.822  18.682  16.965
    5    HB3  ALA 103           HB3      ALA 103  15.995  19.400  18.565

  No H/Q in entry =           5
  In of MODEL   11
    1    H1   ALA   1           H3       ALA   1  -1.505  -6.959 -21.487
    2    H2   ALA   1           H2       ALA   1  -2.300  -8.395 -21.039
    3    H3   ALA   1           H1       ALA   1  -0.691  -8.444 -21.589
    4    HA   ALA   1           HA       ALA   1  -1.519  -8.909 -23.589
    5    HB1  ALA   1           HB1      ALA   1  -3.657  -9.629 -23.123
    6    HB2  ALA   1           HB2      ALA   1  -4.094  -8.117 -23.919
    7    HB3  ALA   1           HB3      ALA   1  -4.038  -8.201 -22.160

  No H/Q in entry =           7
  In of MODEL   11
    1    H    GLU   2           H        GLU   2  -2.343  -7.715 -25.578
    2    HA   GLU   2           HA       GLU   2  -0.943  -5.699 -26.448
    3    HB2  GLU   2           HB2      GLU   2  -3.949  -5.766 -26.774
    4    HB3  GLU   2           HB3      GLU   2  -2.825  -4.901 -27.819
    5    HG2  GLU   2           HG2      GLU   2  -2.318  -6.789 -28.976
    6    HG3  GLU   2           HG3      GLU   2  -2.025  -7.697 -27.499

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLU   3           H        GLU   3  -4.106  -4.445 -25.554
    2    HA   GLU   3           HA       GLU   3  -3.062  -1.890 -24.918
    3    HB2  GLU   3           HB2      GLU   3  -5.750  -3.206 -24.596
    4    HB3  GLU   3           HB3      GLU   3  -5.455  -1.592 -23.946
    5    HG2  GLU   3           HG2      GLU   3  -5.092  -0.661 -26.069
    6    HG3  GLU   3           HG3      GLU   3  -4.695  -2.214 -26.796

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LEU   4           H        LEU   4  -4.658  -4.254 -22.748
    2    HA   LEU   4           HA       LEU   4  -4.301  -3.030 -20.353
    3    HB2  LEU   4           HB2      LEU   4  -3.756  -5.970 -20.827
    4    HB3  LEU   4           HB3      LEU   4  -4.167  -5.227 -19.283
    5    HG   LEU   4           HG       LEU   4  -5.932  -5.296 -21.752
    6   HD13  LEU   4          HD11      LEU   4  -7.128  -7.016 -20.762
    7   HD12  LEU   4          HD12      LEU   4  -6.648  -6.560 -19.128
    8   HD11  LEU   4          HD13      LEU   4  -5.509  -7.401 -20.178
    9   HD23  LEU   4          HD21      LEU   4  -7.622  -4.489 -19.888
   10   HD22  LEU   4          HD22      LEU   4  -6.582  -3.316 -20.693
   11   HD21  LEU   4          HD23      LEU   4  -6.160  -3.910 -19.087

  No H/Q in entry =          11
  In of MODEL   11
    1    H    GLU   5           H        GLU   5  -1.798  -4.869 -22.080
    2    HA   GLU   5           HA       GLU   5   0.180  -4.589 -20.037
    3    HB2  GLU   5           HB2      GLU   5   0.255  -6.357 -21.788
    4    HB3  GLU   5           HB3      GLU   5   0.562  -5.112 -22.999
    5    HG2  GLU   5           HG2      GLU   5   2.622  -4.460 -21.830
    6    HG3  GLU   5           HG3      GLU   5   2.318  -5.675 -20.590

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLU   6           H        GLU   6  -0.446  -2.870 -23.080
    2    HA   GLU   6           HA       GLU   6   1.723  -1.038 -22.802
    3    HB2  GLU   6           HB2      GLU   6   0.619  -1.505 -24.970
    4    HB3  GLU   6           HB3      GLU   6  -0.852  -0.740 -24.368
    5    HG2  GLU   6           HG2      GLU   6   0.346   1.378 -24.066
    6    HG3  GLU   6           HG3      GLU   6   1.844   0.624 -24.606

  No H/Q in entry =           6
  In of MODEL   11
    1    H    VAL   7           H        VAL   7  -1.619  -1.112 -21.767
    2    HA   VAL   7           HA       VAL   7  -1.843   1.599 -20.926
    3    HB   VAL   7           HB       VAL   7  -3.308  -0.921 -20.099
    4   HG11  VAL   7          HG11      VAL   7  -3.685   1.966 -19.280
    5   HG13  VAL   7          HG12      VAL   7  -3.589   0.539 -18.248
    6   HG12  VAL   7          HG13      VAL   7  -5.018   0.811 -19.244
    7   HG21  VAL   7          HG21      VAL   7  -3.458   0.160 -22.486
    8   HG23  VAL   7          HG22      VAL   7  -4.406   1.407 -21.674
    9   HG22  VAL   7          HG23      VAL   7  -4.951  -0.270 -21.652

  No H/Q in entry =           9
  In of MODEL   11
    1    H    VAL   8           H        VAL   8  -0.860  -1.390 -19.286
    2    HA   VAL   8           HA       VAL   8  -0.550  -0.316 -16.687
    3    HB   VAL   8           HB       VAL   8   0.859  -2.629 -18.044
    4   HG11  VAL   8          HG11      VAL   8   0.888  -1.636 -15.186
    5   HG13  VAL   8          HG12      VAL   8   2.266  -1.976 -16.233
    6   HG12  VAL   8          HG13      VAL   8   1.288  -3.301 -15.605
    7   HG23  VAL   8          HG21      VAL   8  -1.119  -3.070 -15.861
    8   HG22  VAL   8          HG22      VAL   8  -0.913  -3.933 -17.382
    9   HG21  VAL   8          HG23      VAL   8  -1.800  -2.414 -17.348

  No H/Q in entry =           9
  In of MODEL   11
    1    H    MET   9           H        MET   9   1.707  -0.611 -19.429
    2    HA   MET   9           HA       MET   9   3.990   0.429 -18.159
    3    HB2  MET   9           HB2      MET   9   3.044   0.410 -21.017
    4    HB3  MET   9           HB3      MET   9   4.524   1.255 -20.564
    5    HG2  MET   9           HG2      MET   9   5.206  -0.939 -19.393
    6    HG3  MET   9           HG3      MET   9   3.900  -1.688 -20.315
    7    HE1  MET   9           HE1      MET   9   3.711  -2.057 -22.556
    8    HE3  MET   9           HE2      MET   9   4.840  -1.709 -23.861
    9    HE2  MET   9           HE3      MET   9   3.847  -0.416 -23.197

  No H/Q in entry =           9
  In of MODEL   11
    1    H    GLY  10           H        GLY  10   1.311   2.036 -19.840
    2    HA3  GLY  10           HA2      GLY  10   2.275   4.689 -19.587
    3    HA2  GLY  10           HA3      GLY  10   0.586   4.230 -19.798

  No H/Q in entry =           3
  In of MODEL   11
    1    H    LEU  11           H        LEU  11   0.179   2.698 -17.516
    2    HA   LEU  11           HA       LEU  11  -0.354   4.671 -15.553
    3    HB2  LEU  11           HB2      LEU  11  -0.290   1.655 -15.404
    4    HB3  LEU  11           HB3      LEU  11  -0.802   2.675 -14.060
    5    HG   LEU  11           HG       LEU  11  -2.033   2.796 -16.827
    6   HD13  LEU  11          HD11      LEU  11  -2.621   0.652 -16.078
    7   HD12  LEU  11          HD12      LEU  11  -3.972   1.644 -15.534
    8   HD11  LEU  11          HD13      LEU  11  -2.719   1.160 -14.391
    9   HD22  LEU  11          HD21      LEU  11  -2.625   4.811 -15.817
   10   HD21  LEU  11          HD22      LEU  11  -2.554   4.141 -14.187
   11   HD23  LEU  11          HD23      LEU  11  -3.927   3.778 -15.234

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  12           H        ILE  12   2.187   2.203 -15.795
    2    HA   ILE  12           HA       ILE  12   3.387   2.733 -13.287
    3    HB   ILE  12           HB       ILE  12   4.607   1.674 -15.857
    4   HG12  ILE  12          HG12      ILE  12   2.655   0.429 -14.671
    5   HG13  ILE  12          HG13      ILE  12   4.080  -0.497 -15.094
    6   HG21  ILE  12          HG21      ILE  12   5.675   1.681 -13.015
    7   HG23  ILE  12          HG22      ILE  12   6.392   2.473 -14.417
    8   HG22  ILE  12          HG23      ILE  12   6.353   0.714 -14.322
    9   HD13  ILE  12          HD11      ILE  12   4.882  -0.329 -12.796
   10   HD12  ILE  12          HD12      ILE  12   3.241  -0.973 -12.803
   11   HD11  ILE  12          HD13      ILE  12   3.524   0.700 -12.376

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  13           H        ILE  13   3.997   4.003 -16.540
    2    HA   ILE  13           HA       ILE  13   6.135   5.719 -15.807
    3    HB   ILE  13           HB       ILE  13   4.109   5.810 -18.056
    4   HG12  ILE  13          HG12      ILE  13   5.885   3.944 -17.822
    5   HG13  ILE  13          HG13      ILE  13   5.746   4.760 -19.375
    6   HG23  ILE  13          HG21      ILE  13   4.776   8.063 -17.923
    7   HG22  ILE  13          HG22      ILE  13   5.882   7.392 -19.116
    8   HG21  ILE  13          HG23      ILE  13   6.428   7.653 -17.461
    9   HD11  ILE  13          HD11      ILE  13   7.653   5.998 -17.455
   10   HD13  ILE  13          HD12      ILE  13   7.800   5.740 -19.191
   11   HD12  ILE  13          HD13      ILE  13   8.105   4.412 -18.077

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ASN  14           H        ASN  14   2.629   6.219 -16.081
    2    HA   ASN  14           HA       ASN  14   2.588   8.963 -15.438
    3    HB2  ASN  14           HB2      ASN  14   0.695   7.326 -16.276
    4    HB3  ASN  14           HB3      ASN  14   0.370   7.144 -14.557
    5   HD21  ASN  14          HD21      ASN  14  -1.645   8.305 -15.992
    6   HD22  ASN  14          HD22      ASN  14  -1.706   9.978 -15.720

  No H/Q in entry =           6
  In of MODEL   11
    1    H    SER  15           H        SER  15   2.286   6.082 -13.368
    2    HA   SER  15           HA       SER  15   1.975   7.447 -10.918
    3    HB2  SER  15           HB2      SER  15   2.512   5.360  -9.872
    4    HB3  SER  15           HB3      SER  15   1.697   4.941 -11.375
    5    HG   SER  15           HG       SER  15   4.263   4.477 -10.586

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLY  16           H        GLY  16   4.853   6.352 -12.673
    2    HA3  GLY  16           HA2      GLY  16   6.775   7.103 -10.736
    3    HA2  GLY  16           HA3      GLY  16   7.082   6.904 -12.460

  No H/Q in entry =           3
  In of MODEL   11
    1    H    GLN  17           H        GLN  17   5.396   8.865 -13.522
    2    HA   GLN  17           HA       GLN  17   6.973  11.205 -13.205
    3    HB2  GLN  17           HB2      GLN  17   5.631  10.699 -15.244
    4    HB3  GLN  17           HB3      GLN  17   4.159  10.985 -14.316
    5    HG2  GLN  17           HG2      GLN  17   4.720  13.011 -15.541
    6    HG3  GLN  17           HG3      GLN  17   4.970  13.294 -13.819
    7   HE21  GLN  17          HE21      GLN  17   7.033  11.708 -16.327
    8   HE22  GLN  17          HE22      GLN  17   8.393  12.675 -16.014

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ALA  18           H        ALA  18   3.870  10.185 -11.865
    2    HA   ALA  18           HA       ALA  18   3.142  12.571 -10.596
    3    HB1  ALA  18           HB1      ALA  18   2.013  10.115 -10.826
    4    HB2  ALA  18           HB2      ALA  18   1.462  11.332  -9.678
    5    HB3  ALA  18           HB3      ALA  18   2.551  10.049  -9.148

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ARG  19           H        ARG  19   5.013   9.805  -9.319
    2    HA   ARG  19           HA       ARG  19   5.540  10.958  -6.793
    3    HB2  ARG  19           HB2      ARG  19   5.956   8.556  -7.324
    4    HB3  ARG  19           HB3      ARG  19   7.314   9.045  -8.341
    5    HG2  ARG  19           HG2      ARG  19   8.429  10.081  -6.414
    6    HG3  ARG  19           HG3      ARG  19   7.051   9.690  -5.386
    7    HD2  ARG  19           HD2      ARG  19   8.813   8.054  -5.028
    8    HD3  ARG  19           HD3      ARG  19   7.441   7.274  -5.819
    9    HE   ARG  19           HE       ARG  19   9.150   8.098  -7.860
   10   HH21  ARG  19          HH11      ARG  19  10.713   6.695  -8.710
   11   HH22  ARG  19          HH12      ARG  19  11.257   5.345  -7.776
   12   HH11  ARG  19          HH21      ARG  19   9.216   6.061  -5.086
   13   HH12  ARG  19          HH22      ARG  19  10.406   4.986  -5.723

  No H/Q in entry =          13
  In of MODEL   11
    1    H    SER  20           H        SER  20   7.364  10.995  -9.838
    2    HA   SER  20           HA       SER  20   9.606  12.410  -9.006
    3    HB2  SER  20           HB2      SER  20   9.643  11.538 -11.211
    4    HB3  SER  20           HB3      SER  20   8.144  12.356 -11.640
    5    HG   SER  20           HG       SER  20   9.364  14.350 -11.223

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU  21           H        LEU  21   6.509  13.679 -10.207
    2    HA   LEU  21           HA       LEU  21   7.176  16.425  -9.975
    3    HB2  LEU  21           HB2      LEU  21   4.510  14.997  -9.906
    4    HB3  LEU  21           HB3      LEU  21   4.672  16.751  -9.902
    5    HG   LEU  21           HG       LEU  21   5.884  14.971 -12.038
    6   HD13  LEU  21          HD11      LEU  21   3.465  14.720 -12.114
    7   HD12  LEU  21          HD12      LEU  21   3.970  15.759 -13.448
    8   HD11  LEU  21          HD13      LEU  21   3.245  16.467 -12.005
    9   HD22  LEU  21          HD21      LEU  21   7.009  17.022 -12.188
   10   HD21  LEU  21          HD22      LEU  21   5.624  17.955 -11.630
   11   HD23  LEU  21          HD23      LEU  21   5.648  17.315 -13.266

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ALA  22           H        ALA  22   5.662  14.129  -7.735
    2    HA   ALA  22           HA       ALA  22   5.051  15.931  -5.666
    3    HB3  ALA  22           HB1      ALA  22   4.295  13.538  -5.836
    4    HB2  ALA  22           HB2      ALA  22   4.878  14.008  -4.239
    5    HB1  ALA  22           HB3      ALA  22   5.906  13.053  -5.310

  No H/Q in entry =           5
  In of MODEL   11
    1    H    TYR  23           H        TYR  23   7.990  13.912  -6.102
    2    HA   TYR  23           HA       TYR  23   9.366  14.928  -3.844
    3    HB2  TYR  23           HB2      TYR  23  10.159  12.925  -5.005
    4    HB3  TYR  23           HB3      TYR  23  10.474  13.867  -6.461
    5    HD1  TYR  23           HD1      TYR  23  11.428  13.527  -2.867
    6    HD2  TYR  23           HD2      TYR  23  12.510  15.038  -6.741
    7    HE1  TYR  23           HE1      TYR  23  13.682  14.106  -2.013
    8    HE2  TYR  23           HE2      TYR  23  14.764  15.619  -5.885
    9    HH   TYR  23           HH       TYR  23  15.709  14.857  -2.534

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ALA  24           H        ALA  24   9.188  16.042  -7.209
    2    HA   ALA  24           HA       ALA  24  11.079  18.131  -6.954
    3    HB2  ALA  24           HB1      ALA  24  10.641  18.197  -9.163
    4    HB3  ALA  24           HB2      ALA  24   9.083  18.942  -8.806
    5    HB1  ALA  24           HB3      ALA  24   9.213  17.190  -8.939

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA  25           H        ALA  25   7.599  17.937  -6.341
    2    HA   ALA  25           HA       ALA  25   7.110  20.652  -5.767
    3    HB1  ALA  25           HB1      ALA  25   5.455  18.650  -5.976
    4    HB2  ALA  25           HB2      ALA  25   5.081  19.935  -4.826
    5    HB3  ALA  25           HB3      ALA  25   5.774  18.415  -4.256

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU  26           H        LEU  26   8.182  17.971  -3.720
    2    HA   LEU  26           HA       LEU  26   8.277  19.398  -1.280
    3    HB2  LEU  26           HB2      LEU  26   8.380  16.982  -1.279
    4    HB3  LEU  26           HB3      LEU  26   9.852  16.996  -2.247
    5    HG   LEU  26           HG       LEU  26  11.059  18.114  -0.402
    6   HD12  LEU  26          HD11      LEU  26   9.828  18.113   1.855
    7   HD11  LEU  26          HD12      LEU  26   8.343  17.973   0.917
    8   HD13  LEU  26          HD13      LEU  26   9.383  19.382   0.713
    9   HD21  LEU  26          HD21      LEU  26   9.532  15.639   0.463
   10   HD23  LEU  26          HD22      LEU  26  11.044  16.205   1.165
   11   HD22  LEU  26          HD23      LEU  26  11.004  15.650  -0.506

  No H/Q in entry =          11
  In of MODEL   11
    1    H    LYS  27           H        LYS  27  10.701  18.838  -3.801
    2    HA   LYS  27           HA       LYS  27  12.878  20.084  -2.566
    3    HB2  LYS  27           HB2      LYS  27  12.989  18.742  -4.658
    4    HB3  LYS  27           HB3      LYS  27  12.221  20.073  -5.522
    5    HG2  LYS  27           HG2      LYS  27  14.080  21.564  -4.938
    6    HG3  LYS  27           HG3      LYS  27  14.843  20.273  -4.002
    7    HD2  LYS  27           HD2      LYS  27  14.996  18.890  -6.058
    8    HD3  LYS  27           HD3      LYS  27  14.278  20.207  -6.986
    9    HE2  LYS  27           HE2      LYS  27  16.158  21.679  -6.366
   10    HE3  LYS  27           HE3      LYS  27  16.880  20.366  -5.430
   11    HZ3  LYS  27           HZ1      LYS  27  17.874  20.473  -7.614
   12    HZ2  LYS  27           HZ2      LYS  27  16.350  20.350  -8.358
   13    HZ1  LYS  27           HZ3      LYS  27  16.976  19.041  -7.475

  No H/Q in entry =          13
  In of MODEL   11
    1    H    GLN  28           H        GLN  28  10.255  21.460  -4.517
    2    HA   GLN  28           HA       GLN  28  11.204  24.116  -4.663
    3    HB2  GLN  28           HB2      GLN  28   8.375  23.035  -4.559
    4    HB3  GLN  28           HB3      GLN  28   8.782  24.709  -4.931
    5    HG2  GLN  28           HG2      GLN  28   9.786  22.301  -6.477
    6    HG3  GLN  28           HG3      GLN  28   8.453  23.337  -6.983
    7   HE21  GLN  28          HE21      GLN  28  11.617  22.846  -7.666
    8   HE22  GLN  28          HE22      GLN  28  12.094  24.430  -8.048

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ALA  29           H        ALA  29   9.274  22.412  -2.234
    2    HA   ALA  29           HA       ALA  29   8.712  24.598  -0.550
    3    HB2  ALA  29           HB1      ALA  29   7.986  23.024   1.014
    4    HB1  ALA  29           HB2      ALA  29   9.213  21.845   0.550
    5    HB3  ALA  29           HB3      ALA  29   7.828  22.135  -0.501

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LYS  30           H        LYS  30  11.452  22.343  -0.618
    2    HA   LYS  30           HA       LYS  30  12.761  23.298   1.690
    3    HB2  LYS  30           HB2      LYS  30  13.868  22.022  -0.821
    4    HB3  LYS  30           HB3      LYS  30  14.846  22.382   0.604
    5    HG2  LYS  30           HG2      LYS  30  13.296  20.990   1.977
    6    HG3  LYS  30           HG3      LYS  30  12.416  20.567   0.505
    7    HD2  LYS  30           HD2      LYS  30  14.467  19.592  -0.454
    8    HD3  LYS  30           HD3      LYS  30  15.366  20.028   1.001
    9    HE2  LYS  30           HE2      LYS  30  13.865  18.588   2.350
   10    HE3  LYS  30           HE3      LYS  30  12.995  18.131   0.879
   11    HZ2  LYS  30           HZ1      LYS  30  14.792  16.560   1.641
   12    HZ1  LYS  30           HZ2      LYS  30  15.925  17.753   1.194
   13    HZ3  LYS  30           HZ3      LYS  30  14.895  17.066   0.026

  No H/Q in entry =          13
  In of MODEL   11
    1    H    GLN  31           H        GLN  31  12.653  24.509  -1.605
    2    HA   GLN  31           HA       GLN  31  14.797  26.410  -1.175
    3    HB2  GLN  31           HB2      GLN  31  12.758  26.452  -3.404
    4    HB3  GLN  31           HB3      GLN  31  14.375  27.155  -3.400
    5    HG2  GLN  31           HG2      GLN  31  14.848  24.460  -2.829
    6    HG3  GLN  31           HG3      GLN  31  13.547  24.403  -4.010
    7   HE21  GLN  31          HE21      GLN  31  16.394  23.623  -4.410
    8   HE22  GLN  31          HE22      GLN  31  16.965  24.601  -5.673

  No H/Q in entry =           8
  In of MODEL   11
    1    H    GLY  32           H        GLY  32  11.721  26.212  -0.037
    2    HA3  GLY  32           HA2      GLY  32  10.555  27.773   1.237
    3    HA2  GLY  32           HA3      GLY  32  11.676  29.014   0.692

  No H/Q in entry =           3
  In of MODEL   11
    1    H    ASP  33           H        ASP  33  10.325  27.109  -1.807
    2    HA   ASP  33           HA       ASP  33   8.652  29.376  -2.661
    3    HB2  ASP  33           HB2      ASP  33   9.759  26.964  -4.106
    4    HB3  ASP  33           HB3      ASP  33   8.605  28.076  -4.837

  No H/Q in entry =           4
  In of MODEL   11
    1    H    PHE  34           H        PHE  34   6.963  28.890  -1.102
    2    HA   PHE  34           HA       PHE  34   5.594  26.411  -1.014
    3    HB2  PHE  34           HB2      PHE  34   4.620  29.193  -0.331
    4    HB3  PHE  34           HB3      PHE  34   3.777  27.698   0.076
    5    HD1  PHE  34           HD1      PHE  34   6.013  30.104   1.299
    6    HD2  PHE  34           HD2      PHE  34   5.352  25.860   1.237
    7    HE1  PHE  34           HE1      PHE  34   7.401  29.856   3.338
    8    HE2  PHE  34           HE2      PHE  34   6.742  25.616   3.273
    9    HZ   PHE  34           HZ       PHE  34   7.761  27.615   4.324

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ALA  35           H        ALA  35   5.155  29.277  -3.020
    2    HA   ALA  35           HA       ALA  35   2.609  28.653  -4.052
    3    HB3  ALA  35           HB1      ALA  35   3.658  30.054  -6.085
    4    HB2  ALA  35           HB2      ALA  35   4.872  30.418  -4.858
    5    HB1  ALA  35           HB3      ALA  35   3.179  30.819  -4.569

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA  36           H        ALA  36   5.843  27.997  -5.401
    2    HA   ALA  36           HA       ALA  36   4.865  26.568  -7.649
    3    HB3  ALA  36           HB1      ALA  36   7.025  26.703  -8.260
    4    HB2  ALA  36           HB2      ALA  36   7.508  25.674  -6.911
    5    HB1  ALA  36           HB3      ALA  36   7.394  27.421  -6.692

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA  37           H        ALA  37   5.819  25.571  -4.394
    2    HA   ALA  37           HA       ALA  37   5.774  22.784  -4.828
    3    HB2  ALA  37           HB1      ALA  37   5.500  24.569  -2.447
    4    HB1  ALA  37           HB2      ALA  37   6.640  23.257  -2.740
    5    HB3  ALA  37           HB3      ALA  37   4.979  22.895  -2.273

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LYS  38           H        LYS  38   3.229  24.978  -3.661
    2    HA   LYS  38           HA       LYS  38   1.137  23.155  -3.446
    3    HB2  LYS  38           HB2      LYS  38   1.476  25.912  -3.189
    4    HB3  LYS  38           HB3      LYS  38   0.280  25.762  -4.471
    5    HG2  LYS  38           HG2      LYS  38  -1.167  24.429  -3.034
    6    HG3  LYS  38           HG3      LYS  38   0.075  24.372  -1.775
    7    HD2  LYS  38           HD2      LYS  38  -0.123  26.707  -1.324
    8    HD3  LYS  38           HD3      LYS  38  -1.033  26.994  -2.807
    9    HE2  LYS  38           HE2      LYS  38  -2.540  27.018  -0.871
   10    HE3  LYS  38           HE3      LYS  38  -2.906  25.642  -1.916
   11    HZ3  LYS  38           HZ1      LYS  38  -2.176  24.172  -0.384
   12    HZ2  LYS  38           HZ2      LYS  38  -2.535  25.425   0.707
   13    HZ1  LYS  38           HZ3      LYS  38  -0.938  25.183   0.184

  No H/Q in entry =          13
  In of MODEL   11
    1    H    ALA  39           H        ALA  39   2.114  25.067  -6.290
    2    HA   ALA  39           HA       ALA  39   0.046  24.193  -7.998
    3    HB2  ALA  39           HB1      ALA  39   2.781  24.856  -9.045
    4    HB1  ALA  39           HB2      ALA  39   1.807  26.111  -8.280
    5    HB3  ALA  39           HB3      ALA  39   1.201  25.274  -9.709

  No H/Q in entry =           5
  In of MODEL   11
    1    H    MET  40           H        MET  40   3.288  22.909  -7.415
    2    HA   MET  40           HA       MET  40   3.204  20.892  -9.410
    3    HB2  MET  40           HB2      MET  40   4.810  21.118  -6.858
    4    HB3  MET  40           HB3      MET  40   5.069  19.866  -8.074
    5    HG2  MET  40           HG2      MET  40   5.113  22.823  -8.734
    6    HG3  MET  40           HG3      MET  40   6.563  21.927  -8.283
    7    HE3  MET  40           HE1      MET  40   7.451  19.721 -11.094
    8    HE2  MET  40           HE2      MET  40   6.886  19.396  -9.459
    9    HE1  MET  40           HE3      MET  40   7.976  20.749  -9.754

  No H/Q in entry =           9
  In of MODEL   11
    1    H    MET  41           H        MET  41   2.282  20.923  -5.988
    2    HA   MET  41           HA       MET  41   1.763  18.155  -5.716
    3    HB2  MET  41           HB2      MET  41   0.416  20.504  -4.363
    4    HB3  MET  41           HB3      MET  41   0.267  18.824  -3.859
    5    HG2  MET  41           HG2      MET  41   2.977  19.061  -3.890
    6    HG3  MET  41           HG3      MET  41   2.527  20.716  -3.492
    7    HE2  MET  41           HE1      MET  41  -0.510  19.445  -1.775
    8    HE1  MET  41           HE2      MET  41   0.300  20.963  -2.148
    9    HE3  MET  41           HE3      MET  41   0.241  20.389  -0.481

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ASP  42           H        ASP  42  -0.287  20.871  -6.689
    2    HA   ASP  42           HA       ASP  42  -2.721  19.499  -6.833
    3    HB2  ASP  42           HB2      ASP  42  -2.027  22.073  -7.084
    4    HB3  ASP  42           HB3      ASP  42  -2.172  21.681  -8.793

  No H/Q in entry =           4
  In of MODEL   11
    1    H    GLN  43           H        GLN  43  -0.278  20.107  -9.329
    2    HA   GLN  43           HA       GLN  43  -1.654  18.784 -11.424
    3    HB2  GLN  43           HB2      GLN  43   1.301  19.315 -11.035
    4    HB3  GLN  43           HB3      GLN  43   0.593  18.674 -12.520
    5    HG2  GLN  43           HG2      GLN  43  -0.929  20.694 -12.561
    6    HG3  GLN  43           HG3      GLN  43   0.018  21.352 -11.230
    7   HE21  GLN  43          HE21      GLN  43   0.175  22.977 -13.313
    8   HE22  GLN  43          HE22      GLN  43   1.593  22.765 -14.218

  No H/Q in entry =           8
  In of MODEL   11
    1    H    SER  44           H        SER  44   0.698  17.652  -9.031
    2    HA   SER  44           HA       SER  44   1.048  15.049 -10.060
    3    HB2  SER  44           HB2      SER  44   1.931  16.489  -7.819
    4    HB3  SER  44           HB3      SER  44   1.075  15.099  -7.153
    5    HG   SER  44           HG       SER  44   3.190  14.491  -7.576

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ARG  45           H        ARG  45  -1.283  16.350  -7.724
    2    HA   ARG  45           HA       ARG  45  -2.658  13.981  -7.097
    3    HB2  ARG  45           HB2      ARG  45  -2.871  16.146  -5.901
    4    HB3  ARG  45           HB3      ARG  45  -3.728  16.810  -7.289
    5    HG2  ARG  45           HG2      ARG  45  -5.485  15.074  -7.012
    6    HG3  ARG  45           HG3      ARG  45  -4.640  14.464  -5.589
    7    HD2  ARG  45           HD2      ARG  45  -4.861  16.728  -4.529
    8    HD3  ARG  45           HD3      ARG  45  -5.848  17.245  -5.912
    9    HE   ARG  45           HE       ARG  45  -6.947  14.861  -4.879
   10   HH21  ARG  45          HH11      ARG  45  -8.786  14.923  -3.612
   11   HH22  ARG  45          HH12      ARG  45  -9.191  16.359  -2.741
   12   HH11  ARG  45          HH21      ARG  45  -6.422  18.108  -3.848
   13   HH12  ARG  45          HH22      ARG  45  -7.847  18.163  -2.873

  No H/Q in entry =          13
  In of MODEL   11
    1    H    MET  46           H        MET  46  -3.251  16.387  -9.644
    2    HA   MET  46           HA       MET  46  -5.581  15.203 -10.713
    3    HB2  MET  46           HB2      MET  46  -3.488  17.044 -11.880
    4    HB3  MET  46           HB3      MET  46  -4.864  16.482 -12.832
    5    HG2  MET  46           HG2      MET  46  -6.420  17.406 -11.190
    6    HG3  MET  46           HG3      MET  46  -5.081  17.896 -10.158
    7    HE1  MET  46           HE1      MET  46  -6.766  17.950 -13.379
    8    HE3  MET  46           HE2      MET  46  -5.399  18.496 -14.344
    9    HE2  MET  46           HE3      MET  46  -6.713  19.612 -13.981

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ALA  47           H        ALA  47  -2.148  14.745 -11.464
    2    HA   ALA  47           HA       ALA  47  -2.478  13.020 -13.679
    3    HB3  ALA  47           HB1      ALA  47  -0.307  13.922 -13.320
    4    HB2  ALA  47           HB2      ALA  47  -0.156  12.194 -12.990
    5    HB1  ALA  47           HB3      ALA  47  -0.258  13.343 -11.655

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU  48           H        LEU  48  -2.212  12.379 -10.205
    2    HA   LEU  48           HA       LEU  48  -2.289   9.539 -10.369
    3    HB2  LEU  48           HB2      LEU  48  -3.069  11.448  -8.153
    4    HB3  LEU  48           HB3      LEU  48  -2.965   9.698  -7.956
    5    HG   LEU  48           HG       LEU  48  -0.674  11.413  -8.945
    6   HD13  LEU  48          HD11      LEU  48  -0.966  12.178  -6.754
    7   HD12  LEU  48          HD12      LEU  48   0.204  10.877  -6.555
    8   HD11  LEU  48          HD13      LEU  48  -1.493  10.603  -6.161
    9   HD22  LEU  48          HD21      LEU  48  -0.161   9.232  -9.589
   10   HD21  LEU  48          HD22      LEU  48  -1.029   8.509  -8.236
   11   HD23  LEU  48          HD23      LEU  48   0.538   9.271  -7.971

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ASN  49           H        ASN  49  -4.768  12.016  -9.968
    2    HA   ASN  49           HA       ASN  49  -6.945  10.337  -9.437
    3    HB2  ASN  49           HB2      ASN  49  -7.043  12.745  -9.098
    4    HB3  ASN  49           HB3      ASN  49  -6.832  13.032 -10.820
    5   HD21  ASN  49          HD21      ASN  49  -9.134  12.142  -8.343
    6   HD22  ASN  49          HD22      ASN  49 -10.498  12.124  -9.349

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLU  50           H        GLU  50  -5.666  11.547 -12.519
    2    HA   GLU  50           HA       GLU  50  -7.609  10.283 -14.172
    3    HB2  GLU  50           HB2      GLU  50  -6.152  12.112 -14.979
    4    HB3  GLU  50           HB3      GLU  50  -4.752  11.048 -14.840
    5    HG2  GLU  50           HG2      GLU  50  -5.712   9.510 -16.481
    6    HG3  GLU  50           HG3      GLU  50  -7.179  10.479 -16.571

  No H/Q in entry =           6
  In of MODEL   11
    1    H    ALA  51           H        ALA  51  -4.435   9.308 -12.960
    2    HA   ALA  51           HA       ALA  51  -4.277   6.858 -14.383
    3    HB2  ALA  51           HB1      ALA  51  -2.297   6.580 -13.278
    4    HB1  ALA  51           HB2      ALA  51  -2.991   6.996 -11.712
    5    HB3  ALA  51           HB3      ALA  51  -2.541   8.271 -12.843

  No H/Q in entry =           5
  In of MODEL   11
    1    H    HIS  52           H        HIS  52  -5.462   7.677 -11.135
    2    HA   HIS  52           HA       HIS  52  -6.134   5.061 -10.310
    3    HB2  HIS  52           HB2      HIS  52  -6.010   7.020  -8.795
    4    HB3  HIS  52           HB3      HIS  52  -7.469   7.668  -9.545
    5    HD1  HIS  52           HD1      HIS  52  -9.661   6.097  -9.337
    6    HD2  HIS  52           HD2      HIS  52  -6.497   5.145  -6.797
    7    HE1  HIS  52           HE1      HIS  52 -10.618   4.605  -7.529
    8    HE2  HIS  52           HE2      HIS  52  -8.701   4.016  -5.971

  No H/Q in entry =           8
  In of MODEL   11
    1    H    LEU  53           H        LEU  53  -7.964   7.512 -12.098
    2    HA   LEU  53           HA       LEU  53 -10.462   6.205 -12.119
    3    HB2  LEU  53           HB2      LEU  53  -9.186   8.195 -13.984
    4    HB3  LEU  53           HB3      LEU  53 -10.782   7.524 -14.307
    5    HG   LEU  53           HG       LEU  53 -10.059   8.860 -11.677
    6   HD13  LEU  53          HD11      LEU  53  -9.837  10.479 -13.520
    7   HD12  LEU  53          HD12      LEU  53 -11.267  10.834 -12.549
    8   HD11  LEU  53          HD13      LEU  53 -11.434  10.036 -14.110
    9   HD22  LEU  53          HD21      LEU  53 -12.029   7.636 -11.294
   10   HD21  LEU  53          HD22      LEU  53 -12.590   7.842 -12.950
   11   HD23  LEU  53          HD23      LEU  53 -12.688   9.179 -11.819

  No H/Q in entry =          11
  In of MODEL   11
    1    H    VAL  54           H        VAL  54  -7.705   6.028 -14.349
    2    HA   VAL  54           HA       VAL  54  -8.913   4.253 -16.199
    3    HB   VAL  54           HB       VAL  54  -6.010   4.775 -15.508
    4   HG12  VAL  54          HG11      VAL  54  -5.751   3.695 -17.898
    5   HG11  VAL  54          HG12      VAL  54  -7.276   2.905 -17.500
    6   HG13  VAL  54          HG13      VAL  54  -5.862   2.657 -16.478
    7   HG22  VAL  54          HG21      VAL  54  -6.788   6.716 -16.551
    8   HG21  VAL  54          HG22      VAL  54  -7.974   5.847 -17.524
    9   HG23  VAL  54          HG23      VAL  54  -6.266   5.777 -17.950

  No H/Q in entry =           9
  In of MODEL   11
    1    H    GLN  55           H        GLN  55  -6.919   3.713 -13.295
    2    HA   GLN  55           HA       GLN  55  -6.813   0.897 -13.556
    3    HB2  GLN  55           HB2      GLN  55  -5.267   1.798 -12.032
    4    HB3  GLN  55           HB3      GLN  55  -6.490   2.757 -11.203
    5    HG2  GLN  55           HG2      GLN  55  -7.173   0.993  -9.890
    6    HG3  GLN  55           HG3      GLN  55  -6.938  -0.190 -11.170
    7   HE21  GLN  55          HE21      GLN  55  -5.309  -1.632 -10.675
    8   HE22  GLN  55          HE22      GLN  55  -3.928  -1.275  -9.758

  No H/Q in entry =           8
  In of MODEL   11
    1    H    THR  56           H        THR  56  -9.160   3.044 -11.944
    2    HA   THR  56           HA       THR  56 -10.738   1.151 -10.662
    3    HB   THR  56           HB       THR  56 -11.635   3.656 -12.117
    4    HG1  THR  56           HG1      THR  56 -10.063   3.632 -10.252
    5   HG21  THR  56          HG21      THR  56 -13.038   1.742 -10.270
    6   HG23  THR  56          HG22      THR  56 -13.617   2.448 -11.779
    7   HG22  THR  56          HG23      THR  56 -13.509   3.440 -10.323

  No H/Q in entry =           7
  In of MODEL   11
    1    H    LYS  57           H        LYS  57 -10.936   2.238 -14.047
    2    HA   LYS  57           HA       LYS  57 -13.082   0.542 -14.809
    3    HB2  LYS  57           HB2      LYS  57 -12.209   2.501 -16.119
    4    HB3  LYS  57           HB3      LYS  57 -10.768   1.565 -16.488
    5    HG2  LYS  57           HG2      LYS  57 -13.363   0.265 -17.111
    6    HG3  LYS  57           HG3      LYS  57 -12.925   1.644 -18.115
    7    HD2  LYS  57           HD2      LYS  57 -10.711   0.557 -18.559
    8    HD3  LYS  57           HD3      LYS  57 -11.261  -0.856 -17.663
    9    HE2  LYS  57           HE2      LYS  57 -12.669   0.280 -20.105
   10    HE3  LYS  57           HE3      LYS  57 -11.579  -1.105 -20.147
   11    HZ2  LYS  57           HZ1      LYS  57 -14.301  -0.931 -19.222
   12    HZ1  LYS  57           HZ2      LYS  57 -13.265  -1.766 -18.163
   13    HZ3  LYS  57           HZ3      LYS  57 -13.424  -2.273 -19.778

  No H/Q in entry =          13
  In of MODEL   11
    1    H    LEU  58           H        LEU  58  -9.576   0.128 -14.743
    2    HA   LEU  58           HA       LEU  58  -9.567  -2.387 -16.036
    3    HB2  LEU  58           HB2      LEU  58  -7.545  -1.087 -14.220
    4    HB3  LEU  58           HB3      LEU  58  -7.274  -2.606 -15.076
    5    HG   LEU  58           HG       LEU  58  -8.037  -0.003 -16.437
    6   HD11  LEU  58          HD11      LEU  58  -5.386  -1.228 -15.741
    7   HD13  LEU  58          HD12      LEU  58  -5.890   0.460 -15.691
    8   HD12  LEU  58          HD13      LEU  58  -5.542  -0.307 -17.237
    9   HD22  LEU  58          HD21      LEU  58  -8.600  -1.566 -18.032
   10   HD21  LEU  58          HD22      LEU  58  -7.555  -2.809 -17.349
   11   HD23  LEU  58          HD23      LEU  58  -6.868  -1.531 -18.351

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  59           H        ILE  59 -10.402  -1.493 -12.786
    2    HA   ILE  59           HA       ILE  59 -10.040  -4.260 -11.841
    3    HB   ILE  59           HB       ILE  59  -9.614  -1.990 -10.439
    4   HG12  ILE  59          HG12      ILE  59 -10.965  -4.356  -9.123
    5   HG13  ILE  59          HG13      ILE  59  -9.320  -4.420  -9.703
    6   HG21  ILE  59          HG21      ILE  59 -12.166  -1.515 -10.700
    7   HG23  ILE  59          HG22      ILE  59 -11.441  -1.299  -9.124
    8   HG22  ILE  59          HG23      ILE  59 -12.368  -2.753  -9.482
    9   HD13  ILE  59          HD11      ILE  59  -8.707  -2.527  -8.280
   10   HD12  ILE  59          HD12      ILE  59  -9.384  -3.829  -7.311
   11   HD11  ILE  59          HD13      ILE  59 -10.367  -2.416  -7.702

  No H/Q in entry =          11
  In of MODEL   11
    1    H    GLU  60           H        GLU  60 -12.607  -1.957 -12.653
    2    HA   GLU  60           HA       GLU  60 -14.787  -3.486 -11.649
    3    HB2  GLU  60           HB2      GLU  60 -15.305  -1.252 -12.144
    4    HB3  GLU  60           HB3      GLU  60 -14.500  -1.312 -13.708
    5    HG2  GLU  60           HG2      GLU  60 -17.058  -1.330 -13.763
    6    HG3  GLU  60           HG3      GLU  60 -16.264  -2.600 -14.672

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLY  61           H        GLY  61 -13.105  -3.458 -14.759
    2    HA3  GLY  61           HA2      GLY  61 -14.803  -5.710 -15.657
    3    HA2  GLY  61           HA3      GLY  61 -13.961  -4.600 -16.731

  No H/Q in entry =           3
  In of MODEL   11
    1    H    ASP  62           H        ASP  62 -12.584  -6.040 -13.845
    2    HA   ASP  62           HA       ASP  62 -10.348  -7.053 -15.348
    3    HB2  ASP  62           HB2      ASP  62  -9.892  -6.124 -13.198
    4    HB3  ASP  62           HB3      ASP  62 -11.125  -7.117 -12.431

  No H/Q in entry =           4
  In of MODEL   11
    1    H    ALA  63           H        ALA  63 -10.492  -8.923 -16.508
    2    HA   ALA  63           HA       ALA  63 -11.738 -11.284 -15.201
    3    HB2  ALA  63           HB1      ALA  63 -12.711 -11.944 -17.354
    4    HB1  ALA  63           HB2      ALA  63 -12.000 -10.532 -18.134
    5    HB3  ALA  63           HB3      ALA  63 -13.275 -10.328 -16.932

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLY  64           H        GLY  64  -9.522  -9.968 -17.585
    2    HA3  GLY  64           HA2      GLY  64  -7.549 -10.727 -18.467
    3    HA2  GLY  64           HA3      GLY  64  -7.424 -11.761 -17.049

  No H/Q in entry =           3
  In of MODEL   11
    1    H    GLU  65           H        GLU  65  -7.016 -13.788 -17.715
    2    HA   GLU  65           HA       GLU  65  -7.556 -14.805 -20.249
    3    HB2  GLU  65           HB2      GLU  65  -7.124 -16.245 -17.634
    4    HB3  GLU  65           HB3      GLU  65  -7.195 -17.056 -19.200
    5    HG2  GLU  65           HG2      GLU  65  -5.320 -15.718 -20.015
    6    HG3  GLU  65           HG3      GLU  65  -5.272 -14.822 -18.498

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLY  66           H        GLY  66  -8.705 -17.134 -20.197
    2    HA3  GLY  66           HA2      GLY  66 -11.463 -16.653 -20.462
    3    HA2  GLY  66           HA3      GLY  66 -10.677 -18.218 -20.529

  No H/Q in entry =           3
  In of MODEL   11
    1    H    LYS  67           H        LYS  67  -9.615 -18.159 -17.885
    2    HA   LYS  67           HA       LYS  67 -11.902 -19.140 -16.473
    3    HB2  LYS  67           HB2      LYS  67  -8.985 -18.927 -15.746
    4    HB3  LYS  67           HB3      LYS  67 -10.203 -19.691 -14.715
    5    HG2  LYS  67           HG2      LYS  67 -10.809 -21.221 -16.548
    6    HG3  LYS  67           HG3      LYS  67  -9.611 -20.458 -17.590
    7    HD2  LYS  67           HD2      LYS  67  -7.818 -21.156 -16.048
    8    HD3  LYS  67           HD3      LYS  67  -9.017 -21.919 -15.002
    9    HE2  LYS  67           HE2      LYS  67  -9.690 -23.412 -16.849
   10    HE3  LYS  67           HE3      LYS  67  -8.497 -22.648 -17.901
   11    HZ1  LYS  67           HZ1      LYS  67  -7.011 -23.307 -15.771
   12    HZ3  LYS  67           HZ2      LYS  67  -7.173 -24.272 -17.159
   13    HZ2  LYS  67           HZ3      LYS  67  -8.126 -24.584 -15.787

  No H/Q in entry =          13
  In of MODEL   11
    1    H    MET  68           H        MET  68 -12.551 -18.635 -14.386
    2    HA   MET  68           HA       MET  68 -13.438 -16.121 -13.893
    3    HB2  MET  68           HB2      MET  68 -12.701 -18.262 -11.899
    4    HB3  MET  68           HB3      MET  68 -13.645 -16.826 -11.503
    5    HG2  MET  68           HG2      MET  68 -14.394 -18.830 -13.650
    6    HG3  MET  68           HG3      MET  68 -15.078 -18.802 -12.024
    7    HE2  MET  68           HE1      MET  68 -15.591 -15.646 -11.331
    8    HE1  MET  68           HE2      MET  68 -16.318 -17.217 -11.001
    9    HE3  MET  68           HE3      MET  68 -17.293 -15.936 -11.717

  No H/Q in entry =           9
  In of MODEL   11
    1    H    LYS  69           H        LYS  69 -10.150 -16.844 -13.814
    2    HA   LYS  69           HA       LYS  69  -9.239 -15.429 -11.584
    3    HB2  LYS  69           HB2      LYS  69  -7.930 -16.066 -14.222
    4    HB3  LYS  69           HB3      LYS  69  -7.066 -15.293 -12.891
    5    HG2  LYS  69           HG2      LYS  69  -7.663 -17.176 -11.406
    6    HG3  LYS  69           HG3      LYS  69  -8.523 -17.949 -12.737
    7    HD2  LYS  69           HD2      LYS  69  -6.444 -18.127 -14.018
    8    HD3  LYS  69           HD3      LYS  69  -5.565 -17.282 -12.742
    9    HE2  LYS  69           HE2      LYS  69  -5.227 -19.691 -12.501
   10    HE3  LYS  69           HE3      LYS  69  -6.190 -19.094 -11.152
   11    HZ3  LYS  69           HZ1      LYS  69  -7.560 -20.749 -11.727
   12    HZ2  LYS  69           HZ2      LYS  69  -6.924 -20.887 -13.295
   13    HZ1  LYS  69           HZ3      LYS  69  -8.084 -19.694 -12.946

  No H/Q in entry =          13
  In of MODEL   11
    1    H    VAL  70           H        VAL  70  -7.334 -13.602 -12.336
    2    HA   VAL  70           HA       VAL  70  -8.813 -11.353 -13.566
    3    HB   VAL  70           HB       VAL  70  -7.878  -9.888 -11.781
    4   HG13  VAL  70          HG11      VAL  70  -9.638 -10.319 -10.310
    5   HG12  VAL  70          HG12      VAL  70  -9.422 -12.067 -10.411
    6   HG11  VAL  70          HG13      VAL  70 -10.171 -11.192 -11.746
    7   HG21  VAL  70          HG21      VAL  70  -6.974 -12.560 -10.653
    8   HG23  VAL  70          HG22      VAL  70  -7.104 -11.102  -9.673
    9   HG22  VAL  70          HG23      VAL  70  -5.969 -11.158 -11.019

  No H/Q in entry =           9
  In of MODEL   11
    1    H    SER  71           H        SER  71  -7.398  -9.617 -14.276
    2    HA   SER  71           HA       SER  71  -5.135 -10.498 -15.736
    3    HB2  SER  71           HB2      SER  71  -6.535  -8.496 -16.314
    4    HB3  SER  71           HB3      SER  71  -5.832  -7.662 -14.931
    5    HG   SER  71           HG       SER  71  -4.621  -8.543 -17.318

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU  72           H        LEU  72  -3.107 -10.836 -15.073
    2    HA   LEU  72           HA       LEU  72  -2.396 -10.621 -12.359
    3    HB2  LEU  72           HB2      LEU  72  -0.843 -11.146 -14.872
    4    HB3  LEU  72           HB3      LEU  72  -0.032 -11.007 -13.316
    5    HG   LEU  72           HG       LEU  72  -2.353 -12.900 -13.809
    6   HD11  LEU  72          HD11      LEU  72  -0.290 -13.365 -15.224
    7   HD13  LEU  72          HD12      LEU  72  -0.752 -14.663 -14.123
    8   HD12  LEU  72          HD13      LEU  72   0.593 -13.596 -13.715
    9   HD21  LEU  72          HD21      LEU  72  -0.453 -12.360 -11.546
   10   HD23  LEU  72          HD22      LEU  72  -1.016 -14.008 -11.778
   11   HD22  LEU  72          HD23      LEU  72  -2.176 -12.714 -11.484

  No H/Q in entry =          11
  In of MODEL   11
    1    H    VAL  73           H        VAL  73  -1.681  -8.599 -15.135
    2    HA   VAL  73           HA       VAL  73   0.229  -6.892 -14.025
    3    HB   VAL  73           HB       VAL  73  -0.166  -5.474 -15.881
    4   HG12  VAL  73          HG11      VAL  73  -0.991  -8.234 -16.809
    5   HG11  VAL  73          HG12      VAL  73   0.657  -7.835 -16.328
    6   HG13  VAL  73          HG13      VAL  73  -0.079  -7.026 -17.710
    7   HG21  VAL  73          HG21      VAL  73  -2.924  -6.643 -15.729
    8   HG23  VAL  73          HG22      VAL  73  -2.326  -6.070 -17.285
    9   HG22  VAL  73          HG23      VAL  73  -2.435  -4.958 -15.919

  No H/Q in entry =           9
  In of MODEL   11
    1    H    LEU  74           H        LEU  74  -3.170  -7.024 -13.477
    2    HA   LEU  74           HA       LEU  74  -3.801  -4.371 -12.864
    3    HB2  LEU  74           HB2      LEU  74  -5.523  -6.043 -13.044
    4    HB3  LEU  74           HB3      LEU  74  -4.832  -6.967 -11.714
    5    HG   LEU  74           HG       LEU  74  -5.295  -5.076 -10.175
    6   HD13  LEU  74          HD11      LEU  74  -5.242  -3.146 -11.542
    7   HD12  LEU  74          HD12      LEU  74  -6.952  -3.345 -11.164
    8   HD11  LEU  74          HD13      LEU  74  -6.330  -3.855 -12.734
    9   HD21  LEU  74          HD21      LEU  74  -6.965  -6.962 -10.983
   10   HD23  LEU  74          HD22      LEU  74  -7.828  -5.574 -11.610
   11   HD22  LEU  74          HD23      LEU  74  -7.494  -5.679  -9.899

  No H/Q in entry =          11
  In of MODEL   11
    1    H    VAL  75           H        VAL  75  -2.756  -6.955 -10.702
    2    HA   VAL  75           HA       VAL  75  -2.571  -5.406  -8.356
    3    HB   VAL  75           HB       VAL  75  -1.061  -7.893  -9.144
    4   HG11  VAL  75          HG11      VAL  75  -1.288  -6.434  -6.472
    5   HG13  VAL  75          HG12      VAL  75   0.178  -6.669  -7.412
    6   HG12  VAL  75          HG13      VAL  75  -0.618  -8.049  -6.676
    7   HG23  VAL  75          HG21      VAL  75  -2.723  -8.847  -7.455
    8   HG22  VAL  75          HG22      VAL  75  -3.427  -8.306  -8.980
    9   HG21  VAL  75          HG23      VAL  75  -3.566  -7.300  -7.537

  No H/Q in entry =           9
  In of MODEL   11
    1    H    GLU  76           H        GLU  76  -0.151  -6.153 -10.885
    2    HA   GLU  76           HA       GLU  76   2.025  -4.798  -9.720
    3    HB2  GLU  76           HB2      GLU  76   2.252  -6.267 -11.699
    4    HB3  GLU  76           HB3      GLU  76   1.322  -5.127 -12.659
    5    HG2  GLU  76           HG2      GLU  76   3.649  -4.753 -13.163
    6    HG3  GLU  76           HG3      GLU  76   3.118  -3.390 -12.195

  No H/Q in entry =           6
  In of MODEL   11
    1    H    ALA  77           H        ALA  77  -0.505  -3.605 -11.915
    2    HA   ALA  77           HA       ALA  77   0.474  -0.954 -12.085
    3    HB3  ALA  77           HB1      ALA  77  -2.331  -2.057 -12.397
    4    HB1  ALA  77           HB2      ALA  77  -1.160  -1.758 -13.682
    5    HB2  ALA  77           HB3      ALA  77  -1.865  -0.404 -12.801

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLN  78           H        GLN  78  -1.795  -2.522  -9.883
    2    HA   GLN  78           HA       GLN  78  -2.617  -0.209  -8.482
    3    HB2  GLN  78           HB2      GLN  78  -3.714  -2.477  -8.404
    4    HB3  GLN  78           HB3      GLN  78  -2.380  -3.026  -7.392
    5    HG2  GLN  78           HG2      GLN  78  -2.919  -1.295  -5.733
    6    HG3  GLN  78           HG3      GLN  78  -4.248  -0.730  -6.743
    7   HE21  GLN  78          HE21      GLN  78  -4.727  -1.713  -4.092
    8   HE22  GLN  78          HE22      GLN  78  -5.590  -3.170  -4.215

  No H/Q in entry =           8
  In of MODEL   11
    1    H    LEU  79           H        LEU  79   0.071  -2.452  -8.025
    2    HA   LEU  79           HA       LEU  79   1.035  -1.553  -5.564
    3    HB2  LEU  79           HB2      LEU  79   1.918  -3.556  -6.631
    4    HB3  LEU  79           HB3      LEU  79   2.564  -2.600  -7.961
    5    HG   LEU  79           HG       LEU  79   4.109  -1.454  -6.452
    6   HD13  LEU  79          HD11      LEU  79   3.096  -1.216  -4.388
    7   HD12  LEU  79          HD12      LEU  79   4.181  -2.561  -4.041
    8   HD11  LEU  79          HD13      LEU  79   2.478  -2.868  -4.377
    9   HD23  LEU  79          HD21      LEU  79   5.328  -3.597  -5.546
   10   HD22  LEU  79          HD22      LEU  79   5.129  -3.397  -7.285
   11   HD21  LEU  79          HD23      LEU  79   4.053  -4.474  -6.397

  No H/Q in entry =          11
  In of MODEL   11
    1    H    HIS  80           H        HIS  80   1.910  -0.428  -8.833
    2    HA   HIS  80           HA       HIS  80   3.703   1.568  -7.903
    3    HB2  HIS  80           HB2      HIS  80   2.427   0.869 -10.491
    4    HB3  HIS  80           HB3      HIS  80   3.011   2.525 -10.316
    5    HD1  HIS  80           HD1      HIS  80   5.413   2.839 -10.830
    6    HD2  HIS  80           HD2      HIS  80   4.612  -1.077  -9.645
    7    HE1  HIS  80           HE1      HIS  80   7.611   1.575 -10.990
    8    HE2  HIS  80           HE2      HIS  80   7.134  -0.816 -10.271

  No H/Q in entry =           8
  In of MODEL   11
    1    H    LEU  81           H        LEU  81   0.302   1.709  -8.894
    2    HA   LEU  81           HA       LEU  81   0.009   4.500  -8.561
    3    HB2  LEU  81           HB2      LEU  81  -1.992   2.242  -8.491
    4    HB3  LEU  81           HB3      LEU  81  -2.455   3.943  -8.399
    5    HG   LEU  81           HG       LEU  81  -0.747   2.805 -10.631
    6   HD12  LEU  81          HD11      LEU  81  -2.977   3.113 -11.937
    7   HD11  LEU  81          HD12      LEU  81  -3.738   3.038 -10.348
    8   HD13  LEU  81          HD13      LEU  81  -2.784   1.677 -10.933
    9   HD23  LEU  81          HD21      LEU  81  -1.854   4.944 -11.729
   10   HD22  LEU  81          HD22      LEU  81  -0.442   5.122 -10.691
   11   HD21  LEU  81          HD23      LEU  81  -2.051   5.460 -10.056

  No H/Q in entry =          11
  In of MODEL   11
    1    H    MET  82           H        MET  82  -0.641   1.807  -6.318
    2    HA   MET  82           HA       MET  82  -1.711   3.384  -4.232
    3    HB2  MET  82           HB2      MET  82  -0.319   0.706  -4.270
    4    HB3  MET  82           HB3      MET  82  -0.908   1.426  -2.773
    5    HG2  MET  82           HG2      MET  82  -2.629   0.923  -5.221
    6    HG3  MET  82           HG3      MET  82  -2.548  -0.151  -3.827
    7    HE3  MET  82           HE1      MET  82  -4.292   1.484  -1.016
    8    HE2  MET  82           HE2      MET  82  -2.563   1.773  -1.194
    9    HE1  MET  82           HE3      MET  82  -3.239   0.212  -1.652

  No H/Q in entry =           9
  In of MODEL   11
    1    H    THR  83           H        THR  83   1.600   2.321  -4.912
    2    HA   THR  83           HA       THR  83   2.802   3.430  -2.606
    3    HB   THR  83           HB       THR  83   4.902   3.391  -4.072
    4    HG1  THR  83           HG1      THR  83   4.673   2.865  -6.097
    5   HG22  THR  83          HG21      THR  83   4.477   0.730  -4.409
    6   HG21  THR  83          HG22      THR  83   3.181   1.100  -3.273
    7   HG23  THR  83          HG23      THR  83   4.857   1.454  -2.847

  No H/Q in entry =           7
  In of MODEL   11
    1    H    SER  84           H        SER  84   2.434   4.711  -5.906
    2    HA   SER  84           HA       SER  84   3.756   7.160  -5.443
    3    HB2  SER  84           HB2      SER  84   1.698   6.316  -7.470
    4    HB3  SER  84           HB3      SER  84   2.365   7.948  -7.441
    5    HG   SER  84           HG       SER  84   3.756   5.482  -7.730

  No H/Q in entry =           5
  In of MODEL   11
    1    H    MET  85           H        MET  85   0.266   6.380  -5.284
    2    HA   MET  85           HA       MET  85  -0.615   8.984  -4.683
    3    HB2  MET  85           HB2      MET  85  -2.123   7.167  -5.360
    4    HB3  MET  85           HB3      MET  85  -1.834   6.360  -3.819
    5    HG2  MET  85           HG2      MET  85  -2.753   8.291  -2.611
    6    HG3  MET  85           HG3      MET  85  -2.993   9.143  -4.135
    7    HE1  MET  85           HE1      MET  85  -3.681   6.227  -1.960
    8    HE3  MET  85           HE2      MET  85  -3.761   5.168  -3.366
    9    HE2  MET  85           HE3      MET  85  -5.229   5.537  -2.466

  No H/Q in entry =           9
  In of MODEL   11
    1    H    LEU  86           H        LEU  86   0.315   6.325  -2.540
    2    HA   LEU  86           HA       LEU  86  -0.235   7.621  -0.098
    3    HB2  LEU  86           HB2      LEU  86   0.245   5.153  -0.493
    4    HB3  LEU  86           HB3      LEU  86   1.950   5.594  -0.582
    5    HG   LEU  86           HG       LEU  86   1.610   6.750   1.687
    6   HD11  LEU  86          HD11      LEU  86  -1.078   5.968   1.205
    7   HD13  LEU  86          HD12      LEU  86  -0.421   6.717   2.659
    8   HD12  LEU  86          HD13      LEU  86  -0.501   4.961   2.537
    9   HD23  LEU  86          HD21      LEU  86   1.199   3.754   1.803
   10   HD22  LEU  86          HD22      LEU  86   2.192   4.768   2.848
   11   HD21  LEU  86          HD23      LEU  86   2.700   4.449   1.191

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ALA  87           H        ALA  87   2.754   7.346  -1.977
    2    HA   ALA  87           HA       ALA  87   4.446   8.763  -0.244
    3    HB3  ALA  87           HB1      ALA  87   4.556   7.755  -2.953
    4    HB2  ALA  87           HB2      ALA  87   5.885   8.091  -1.847
    5    HB1  ALA  87           HB3      ALA  87   5.267   9.370  -2.891

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ARG  88           H        ARG  88   2.502   9.893  -2.970
    2    HA   ARG  88           HA       ARG  88   3.262  12.586  -2.846
    3    HB2  ARG  88           HB2      ARG  88   2.020  11.430  -4.710
    4    HB3  ARG  88           HB3      ARG  88   0.559  11.565  -3.731
    5    HG2  ARG  88           HG2      ARG  88   1.565  14.150  -3.641
    6    HG3  ARG  88           HG3      ARG  88   1.997  13.640  -5.271
    7    HD2  ARG  88           HD2      ARG  88  -0.142  13.711  -5.975
    8    HD3  ARG  88           HD3      ARG  88  -0.729  12.853  -4.550
    9    HE   ARG  88           HE       ARG  88  -0.931  15.631  -4.964
   10   HH21  ARG  88          HH11      ARG  88  -1.470  16.955  -3.226
   11   HH22  ARG  88          HH12      ARG  88  -1.176  16.417  -1.609
   12   HH11  ARG  88          HH21      ARG  88   0.088  13.369  -2.590
   13   HH12  ARG  88          HH22      ARG  88  -0.312  14.381  -1.249

  No H/Q in entry =          13
  In of MODEL   11
    1    H    GLU  89           H        GLU  89   0.561  10.897  -1.218
    2    HA   GLU  89           HA       GLU  89  -0.561  13.202  -0.013
    3    HB2  GLU  89           HB2      GLU  89  -1.668  10.958  -0.107
    4    HB3  GLU  89           HB3      GLU  89  -0.546  10.406   1.137
    5    HG2  GLU  89           HG2      GLU  89  -1.378  12.098   2.696
    6    HG3  GLU  89           HG3      GLU  89  -2.430  12.767   1.450

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LEU  90           H        LEU  90   1.897  10.918   1.165
    2    HA   LEU  90           HA       LEU  90   2.239  12.160   3.698
    3    HB2  LEU  90           HB2      LEU  90   4.025  10.395   2.024
    4    HB3  LEU  90           HB3      LEU  90   4.437  10.911   3.664
    5    HG   LEU  90           HG       LEU  90   1.809   9.556   2.993
    6   HD12  LEU  90          HD11      LEU  90   2.954   7.513   4.001
    7   HD11  LEU  90          HD12      LEU  90   4.474   8.375   3.766
    8   HD13  LEU  90          HD13      LEU  90   3.468   7.966   2.375
    9   HD22  LEU  90          HD21      LEU  90   1.535  10.475   5.115
   10   HD21  LEU  90          HD22      LEU  90   3.252  10.373   5.503
   11   HD23  LEU  90          HD23      LEU  90   2.250   8.923   5.545

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  91           H        ILE  91   3.851  12.554   0.577
    2    HA   ILE  91           HA       ILE  91   5.819  14.390   1.426
    3    HB   ILE  91           HB       ILE  91   4.517  13.900  -1.259
    4   HG12  ILE  91          HG12      ILE  91   7.348  13.420  -0.277
    5   HG13  ILE  91          HG13      ILE  91   6.070  12.218  -0.121
    6   HG22  ILE  91          HG21      ILE  91   6.738  15.255  -1.939
    7   HG21  ILE  91          HG22      ILE  91   6.420  16.052  -0.397
    8   HG23  ILE  91          HG23      ILE  91   5.201  16.079  -1.670
    9   HD13  ILE  91          HD11      ILE  91   5.905  11.898  -2.429
   10   HD12  ILE  91          HD12      ILE  91   7.638  12.147  -2.209
   11   HD11  ILE  91          HD13      ILE  91   6.625  13.467  -2.797

  No H/Q in entry =          11
  In of MODEL   11
    1    H    THR  92           H        THR  92   2.459  14.814   0.408
    2    HA   THR  92           HA       THR  92   2.424  17.637   0.353
    3    HB   THR  92           HB       THR  92   0.260  15.634   1.041
    4    HG1  THR  92           HG1      THR  92   0.572  15.460  -1.043
    5   HG22  THR  92          HG21      THR  92  -1.145  17.793   0.319
    6   HG21  THR  92          HG22      THR  92   0.243  18.621   1.022
    7   HG23  THR  92          HG23      THR  92  -0.698  17.495   1.998

  No H/Q in entry =           7
  In of MODEL   11
    1    H    GLU  93           H        GLU  93   1.874  15.330   3.001
    2    HA   GLU  93           HA       GLU  93   1.330  17.229   5.021
    3    HB2  GLU  93           HB2      GLU  93   2.651  14.508   5.256
    4    HB3  GLU  93           HB3      GLU  93   1.953  15.430   6.588
    5    HG2  GLU  93           HG2      GLU  93   0.351  14.652   4.143
    6    HG3  GLU  93           HG3      GLU  93   0.451  13.627   5.570

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LEU  94           H        LEU  94   4.345  15.758   3.878
    2    HA   LEU  94           HA       LEU  94   6.086  16.907   5.773
    3    HB2  LEU  94           HB2      LEU  94   6.499  15.946   2.942
    4    HB3  LEU  94           HB3      LEU  94   7.824  16.606   3.897
    5    HG   LEU  94           HG       LEU  94   6.087  14.403   5.022
    6   HD11  LEU  94          HD11      LEU  94   8.190  14.187   2.897
    7   HD13  LEU  94          HD12      LEU  94   6.746  13.208   3.152
    8   HD12  LEU  94          HD13      LEU  94   8.169  12.958   4.163
    9   HD23  LEU  94          HD21      LEU  94   8.275  13.871   6.181
   10   HD22  LEU  94          HD22      LEU  94   7.602  15.446   6.598
   11   HD21  LEU  94          HD23      LEU  94   8.945  15.332   5.459

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  95           H        ILE  95   4.953  18.081   2.622
    2    HA   ILE  95           HA       ILE  95   6.519  20.443   2.572
    3    HB   ILE  95           HB       ILE  95   3.881  19.754   1.257
    4   HG12  ILE  95          HG12      ILE  95   6.672  20.101   0.129
    5   HG13  ILE  95          HG13      ILE  95   6.025  18.545   0.639
    6   HG21  ILE  95          HG21      ILE  95   5.624  22.227   1.046
    7   HG23  ILE  95          HG22      ILE  95   3.898  22.153   1.397
    8   HG22  ILE  95          HG23      ILE  95   4.487  21.757  -0.218
    9   HD13  ILE  95          HD11      ILE  95   4.471  18.468  -1.095
   10   HD12  ILE  95          HD12      ILE  95   5.820  19.291  -1.877
   11   HD11  ILE  95          HD13      ILE  95   4.443  20.221  -1.288

  No H/Q in entry =          11
  In of MODEL   11
    1    H    GLU  96           H        GLU  96   3.268  19.780   3.855
    2    HA   GLU  96           HA       GLU  96   2.638  22.423   4.609
    3    HB2  GLU  96           HB2      GLU  96   0.968  20.636   4.613
    4    HB3  GLU  96           HB3      GLU  96   1.828  19.808   5.909
    5    HG2  GLU  96           HG2      GLU  96   0.799  21.086   7.478
    6    HG3  GLU  96           HG3      GLU  96   1.333  22.563   6.685

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LEU  97           H        LEU  97   4.482  19.875   6.236
    2    HA   LEU  97           HA       LEU  97   4.828  21.220   8.710
    3    HB2  LEU  97           HB2      LEU  97   6.376  19.057   7.297
    4    HB3  LEU  97           HB3      LEU  97   6.959  19.741   8.812
    5    HG   LEU  97           HG       LEU  97   4.153  18.641   8.490
    6   HD12  LEU  97          HD11      LEU  97   5.095  16.629   9.702
    7   HD11  LEU  97          HD12      LEU  97   6.705  17.264   9.365
    8   HD13  LEU  97          HD13      LEU  97   5.641  16.806   8.035
    9   HD23  LEU  97          HD21      LEU  97   4.599  18.343  11.056
   10   HD22  LEU  97          HD22      LEU  97   4.217  19.955  10.453
   11   HD21  LEU  97          HD23      LEU  97   5.888  19.519  10.802

  No H/Q in entry =          11
  In of MODEL   11
    1    H    HIS  98           H        HIS  98   6.709  21.246   5.690
    2    HA   HIS  98           HA       HIS  98   8.856  22.829   6.599
    3    HB2  HIS  98           HB2      HIS  98   7.572  22.576   3.869
    4    HB3  HIS  98           HB3      HIS  98   9.008  23.557   4.166
    5    HD1  HIS  98           HD1      HIS  98   7.805  19.983   4.175
    6    HD2  HIS  98           HD2      HIS  98  11.380  22.087   4.615
    7    HE1  HIS  98           HE1      HIS  98   9.664  18.258   4.121
    8    HE2  HIS  98           HE2      HIS  98  11.845  19.519   4.389

  No H/Q in entry =           8
  In of MODEL   11
    1    H    GLU  99           H        GLU  99   5.637  23.659   5.415
    2    HA   GLU  99           HA       GLU  99   6.010  26.475   5.364
    3    HB2  GLU  99           HB2      GLU  99   4.137  25.303   4.225
    4    HB3  GLU  99           HB3      GLU  99   3.436  24.938   5.801
    5    HG2  GLU  99           HG2      GLU  99   3.250  27.328   6.306
    6    HG3  GLU  99           HG3      GLU  99   4.030  27.733   4.780

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LYS 100           H        LYS 100   4.876  24.232   7.878
    2    HA   LYS 100           HA       LYS 100   4.279  26.282   9.774
    3    HB2  LYS 100           HB2      LYS 100   4.859  23.331  10.116
    4    HB3  LYS 100           HB3      LYS 100   4.406  24.400  11.449
    5    HG2  LYS 100           HG2      LYS 100   2.342  25.036  10.195
    6    HG3  LYS 100           HG3      LYS 100   2.776  23.870   8.942
    7    HD2  LYS 100           HD2      LYS 100   2.696  22.046  10.600
    8    HD3  LYS 100           HD3      LYS 100   2.280  23.206  11.864
    9    HE2  LYS 100           HE2      LYS 100   0.230  23.826  10.596
   10    HE3  LYS 100           HE3      LYS 100   0.636  22.609   9.379
   11    HZ1  LYS 100           HZ1      LYS 100   0.362  21.936  12.258
   12    HZ3  LYS 100           HZ2      LYS 100   0.353  20.885  10.921
   13    HZ2  LYS 100           HZ3      LYS 100  -0.965  21.921  11.198

  No H/Q in entry =          13
  In of MODEL   11
    1    H    LEU 101           H        LEU 101   7.208  24.493   8.946
    2    HA   LEU 101           HA       LEU 101   8.799  25.332  11.156
    3    HB2  LEU 101           HB2      LEU 101   9.404  24.351   8.378
    4    HB3  LEU 101           HB3      LEU 101  10.701  25.017   9.365
    5    HG   LEU 101           HG       LEU 101   8.870  22.856  10.418
    6   HD12  LEU 101          HD11      LEU 101  10.928  21.365   9.814
    7   HD11  LEU 101          HD12      LEU 101  11.297  22.631   8.645
    8   HD13  LEU 101          HD13      LEU 101   9.770  21.756   8.544
    9   HD21  LEU 101          HD21      LEU 101  11.590  23.967  11.157
   10   HD23  LEU 101          HD22      LEU 101  11.047  22.392  11.732
   11   HD22  LEU 101          HD23      LEU 101  10.151  23.846  12.170

  No H/Q in entry =          11
  In of MODEL   11
    1    H    LYS 102           H        LYS 102   7.219  27.197   9.013
    2    HA   LYS 102           HA       LYS 102   7.294  29.490   8.726
    3    HB2  LYS 102           HB2      LYS 102   8.852  29.374  10.829
    4    HB3  LYS 102           HB3      LYS 102  10.155  29.572   9.674
    5    HG2  LYS 102           HG2      LYS 102   8.044  31.520  10.533
    6    HG3  LYS 102           HG3      LYS 102   9.757  31.783  10.288
    7    HD2  LYS 102           HD2      LYS 102   7.813  31.362   7.981
    8    HD3  LYS 102           HD3      LYS 102   8.192  32.941   8.653
    9    HE2  LYS 102           HE2      LYS 102   9.573  31.762   6.582
   10    HE3  LYS 102           HE3      LYS 102  10.185  33.068   7.598
   11    HZ2  LYS 102           HZ1      LYS 102  11.708  31.165   7.424
   12    HZ1  LYS 102           HZ2      LYS 102  10.545  30.180   8.161
   13    HZ3  LYS 102           HZ3      LYS 102  11.233  31.466   9.024

  No H/Q in entry =          13
  In of MODEL   11
    1    H    ALA 103           H        ALA 103  10.554  28.157   8.169
    2    HA   ALA 103           HA       ALA 103  11.523  29.539   6.099
    3    HB2  ALA 103           HB1      ALA 103  12.414  27.328   5.170
    4    HB1  ALA 103           HB2      ALA 103  11.516  26.550   6.472
    5    HB3  ALA 103           HB3      ALA 103  12.803  27.695   6.851

  No H/Q in entry =           5
  In of MODEL   11
    1    H1   LYS   3           H1       LYS   3 -31.691   5.839 -19.655
    2    H2   LYS   3           H3       LYS   3 -30.712   5.555 -21.014
    3    H3   LYS   3           H2       LYS   3 -32.080   4.587 -20.735
    4    HA   LYS   3           HA       LYS   3 -31.024   3.246 -19.323
    5    HB2  LYS   3           HB2      LYS   3 -28.796   4.696 -20.706
    6    HB3  LYS   3           HB3      LYS   3 -28.425   3.516 -19.448
    7    HG2  LYS   3           HG2      LYS   3 -29.822   1.873 -20.757
    8    HG3  LYS   3           HG3      LYS   3 -29.824   3.054 -22.066
    9    HD2  LYS   3           HD2      LYS   3 -27.339   3.005 -22.046
   10    HD3  LYS   3           HD3      LYS   3 -27.409   1.723 -20.838
   11    HE2  LYS   3           HE2      LYS   3 -28.898   0.482 -22.517
   12    HE3  LYS   3           HE3      LYS   3 -28.323   1.658 -23.699
   13    HZ3  LYS   3           HZ1      LYS   3 -26.497   0.473 -23.973
   14    HZ2  LYS   3           HZ2      LYS   3 -27.084  -0.696 -22.888
   15    HZ1  LYS   3           HZ3      LYS   3 -26.119   0.582 -22.320

  No H/Q in entry =          15
  In of MODEL   11
    1    H    LYS   4           H        LYS   4 -31.048   3.134 -17.260
    2    HA   LYS   4           HA       LYS   4 -30.355   5.463 -15.653
    3    HB2  LYS   4           HB2      LYS   4 -31.480   2.753 -14.898
    4    HB3  LYS   4           HB3      LYS   4 -31.277   4.113 -13.795
    5    HG2  LYS   4           HG2      LYS   4 -33.113   3.969 -16.192
    6    HG3  LYS   4           HG3      LYS   4 -33.584   4.034 -14.495
    7    HD2  LYS   4           HD2      LYS   4 -32.940   6.276 -14.271
    8    HD3  LYS   4           HD3      LYS   4 -31.917   6.222 -15.706
    9    HE2  LYS   4           HE2      LYS   4 -33.882   7.540 -16.164
   10    HE3  LYS   4           HE3      LYS   4 -33.938   6.051 -17.108
   11    HZ3  LYS   4           HZ1      LYS   4 -35.471   5.125 -15.528
   12    HZ2  LYS   4           HZ2      LYS   4 -36.070   6.597 -16.127
   13    HZ1  LYS   4           HZ3      LYS   4 -35.392   6.526 -14.572

  No H/Q in entry =          13
  In of MODEL   11
    1    H    HIS   5           H        HIS   5 -28.870   5.609 -14.082
    2    HA   HIS   5           HA       HIS   5 -26.547   3.830 -14.415
    3    HB2  HIS   5           HB2      HIS   5 -26.853   6.596 -13.248
    4    HB3  HIS   5           HB3      HIS   5 -25.349   5.677 -13.235
    5    HD1  HIS   5           HD1      HIS   5 -23.928   6.886 -14.861
    6    HD2  HIS   5           HD2      HIS   5 -27.732   6.153 -16.357
    7    HE1  HIS   5           HE1      HIS   5 -23.804   7.433 -17.322
    8    HE2  HIS   5           HE2      HIS   5 -26.123   6.975 -18.202

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ILE   6           H        ILE   6 -26.266   2.283 -13.078
    2    HA   ILE   6           HA       ILE   6 -27.212   2.571 -10.306
    3    HB   ILE   6           HB       ILE   6 -26.350   0.101 -11.816
    4   HG12  ILE   6          HG12      ILE   6 -29.102   0.987 -10.945
    5   HG13  ILE   6          HG13      ILE   6 -28.484   1.138 -12.590
    6   HG23  ILE   6          HG21      ILE   6 -26.671  -1.131  -9.933
    7   HG22  ILE   6          HG22      ILE   6 -27.845  -0.001  -9.256
    8   HG21  ILE   6          HG23      ILE   6 -26.123   0.375  -9.194
    9   HD13  ILE   6          HD11      ILE   6 -28.901  -0.998 -13.051
   10   HD12  ILE   6          HD12      ILE   6 -29.899  -0.983 -11.596
   11   HD11  ILE   6          HD13      ILE   6 -28.231  -1.550 -11.517

  No H/Q in entry =          11
  In of MODEL   11
    1    H    TYR   7           H        TYR   7 -25.453   3.271  -9.052
    2    HA   TYR   7           HA       TYR   7 -22.728   2.365  -9.751
    3    HB2  TYR   7           HB2      TYR   7 -23.729   4.800  -8.295
    4    HB3  TYR   7           HB3      TYR   7 -22.034   4.323  -8.348
    5    HD1  TYR   7           HD1      TYR   7 -23.090   3.309 -11.410
    6    HD2  TYR   7           HD2      TYR   7 -22.474   6.929  -9.247
    7    HE1  TYR   7           HE1      TYR   7 -22.712   4.516 -13.525
    8    HE2  TYR   7           HE2      TYR   7 -22.137   8.140 -11.353
    9    HH   TYR   7           HH       TYR   7 -22.382   8.015 -13.581

  No H/Q in entry =           9
  In of MODEL   11
    1    H    LEU   8           H        LEU   8 -21.716   1.057  -8.415
    2    HA   LEU   8           HA       LEU   8 -22.801   0.578  -5.710
    3    HB2  LEU   8           HB2      LEU   8 -21.085  -1.075  -7.540
    4    HB3  LEU   8           HB3      LEU   8 -21.241  -1.434  -5.821
    5    HG   LEU   8           HG       LEU   8 -23.721  -1.669  -6.209
    6   HD13  LEU   8          HD11      LEU   8 -23.906  -0.489  -8.335
    7   HD12  LEU   8          HD12      LEU   8 -24.400  -2.167  -8.543
    8   HD11  LEU   8          HD13      LEU   8 -22.811  -1.642  -9.095
    9   HD23  LEU   8          HD21      LEU   8 -22.422  -3.706  -7.887
   10   HD22  LEU   8          HD22      LEU   8 -23.489  -3.878  -6.493
   11   HD21  LEU   8          HD23      LEU   8 -21.787  -3.482  -6.258

  No H/Q in entry =          11
  In of MODEL   11
    1    H    PHE   9           H        PHE   9 -21.512   1.014  -3.945
    2    HA   PHE   9           HA       PHE   9 -18.750   1.994  -4.495
    3    HB2  PHE   9           HB2      PHE   9 -20.767   3.061  -2.525
    4    HB3  PHE   9           HB3      PHE   9 -19.064   3.498  -2.519
    5    HD1  PHE   9           HD1      PHE   9 -18.094   4.822  -4.323
    6    HD2  PHE   9           HD2      PHE   9 -22.269   3.831  -4.303
    7    HE1  PHE   9           HE1      PHE   9 -18.501   6.497  -6.102
    8    HE2  PHE   9           HE2      PHE   9 -22.677   5.518  -6.077
    9    HZ   PHE   9           HZ       PHE   9 -20.790   6.847  -6.981

  No H/Q in entry =           9
  In of MODEL   11
    1    H    SER  10           H        SER  10 -17.127   1.083  -3.378
    2    HA   SER  10           HA       SER  10 -17.304   0.212  -0.679
    3    HB2  SER  10           HB2      SER  10 -18.528  -1.669  -1.762
    4    HB3  SER  10           HB3      SER  10 -17.118  -1.963  -2.765
    5    HG   SER  10           HG       SER  10 -16.367  -1.770  -0.217

  No H/Q in entry =           5
  In of MODEL   11
    1    H    SER  11           H        SER  11 -15.270   0.210   0.156
    2    HA   SER  11           HA       SER  11 -13.101   1.103  -1.415
    3    HB2  SER  11           HB2      SER  11 -11.869   1.131   0.566
    4    HB3  SER  11           HB3      SER  11 -13.533   1.356   1.110
    5    HG   SER  11           HG       SER  11 -12.002  -1.040   1.077

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA  12           H        ALA  12 -14.291  -1.568  -2.193
    2    HA   ALA  12           HA       ALA  12 -11.726  -2.851  -2.700
    3    HB1  ALA  12           HB1      ALA  12 -13.912  -4.640  -1.694
    4    HB3  ALA  12           HB2      ALA  12 -12.852  -3.823  -0.546
    5    HB2  ALA  12           HB3      ALA  12 -12.169  -4.920  -1.745

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLY  13           H        GLY  13 -12.451  -1.859  -4.758
    2    HA3  GLY  13           HA2      GLY  13 -14.707  -2.569  -6.220
    3    HA2  GLY  13           HA3      GLY  13 -13.160  -2.103  -6.941

  No H/Q in entry =           3
  In of MODEL   11
    1    H    MET  14           H        MET  14 -11.610  -4.359  -6.038
    2    HA   MET  14           HA       MET  14 -11.999  -6.117  -8.138
    3    HB2  MET  14           HB2      MET  14  -9.931  -6.185  -6.849
    4    HB3  MET  14           HB3      MET  14 -10.779  -6.844  -5.451
    5    HG2  MET  14           HG2      MET  14 -11.346  -8.864  -6.743
    6    HG3  MET  14           HG3      MET  14 -10.549  -8.193  -8.166
    7    HE2  MET  14           HE1      MET  14  -6.971  -8.603  -7.799
    8    HE1  MET  14           HE2      MET  14  -8.294  -7.636  -8.446
    9    HE3  MET  14           HE3      MET  14  -8.264  -9.376  -8.727

  No H/Q in entry =           9
  In of MODEL   11
    1    H    SER  15           H        SER  15 -13.184  -6.663  -4.816
    2    HA   SER  15           HA       SER  15 -14.551  -9.088  -5.585
    3    HB2  SER  15           HB2      SER  15 -14.042  -9.048  -3.279
    4    HB3  SER  15           HB3      SER  15 -14.657  -7.408  -3.087
    5    HG   SER  15           HG       SER  15 -16.612  -8.937  -4.067

  No H/Q in entry =           5
  In of MODEL   11
    1    H    THR  16           H        THR  16 -15.592  -5.710  -5.064
    2    HA   THR  16           HA       THR  16 -18.402  -6.154  -5.506
    3    HB   THR  16           HB       THR  16 -16.818  -3.627  -6.083
    4    HG1  THR  16           HG1      THR  16 -16.373  -3.671  -4.053
    5   HG21  THR  16          HG21      THR  16 -19.242  -3.805  -6.795
    6   HG23  THR  16          HG22      THR  16 -18.901  -2.498  -5.648
    7   HG22  THR  16          HG23      THR  16 -19.649  -4.003  -5.095

  No H/Q in entry =           7
  In of MODEL   11
    1    H    SER  17           H        SER  17 -15.640  -5.544  -7.432
    2    HA   SER  17           HA       SER  17 -16.813  -4.870  -9.931
    3    HB2  SER  17           HB2      SER  17 -14.150  -6.151  -9.273
    4    HB3  SER  17           HB3      SER  17 -14.625  -5.672 -10.903
    5    HG   SER  17           HG       SER  17 -13.556  -4.179  -9.006

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU  18           H        LEU  18 -16.155  -7.977  -8.442
    2    HA   LEU  18           HA       LEU  18 -16.733  -9.528 -10.766
    3    HB2  LEU  18           HB2      LEU  18 -15.469 -10.412  -8.840
    4    HB3  LEU  18           HB3      LEU  18 -16.914 -10.269  -7.840
    5    HG   LEU  18           HG       LEU  18 -18.070 -11.897  -9.251
    6   HD11  LEU  18          HD11      LEU  18 -15.552 -11.640 -10.852
    7   HD13  LEU  18          HD12      LEU  18 -17.226 -11.709 -11.403
    8   HD12  LEU  18          HD13      LEU  18 -16.419 -13.175 -10.850
    9   HD21  LEU  18          HD21      LEU  18 -15.383 -12.777  -8.240
   10   HD23  LEU  18          HD22      LEU  18 -16.710 -13.860  -8.665
   11   HD22  LEU  18          HD23      LEU  18 -16.899 -12.713  -7.339

  No H/Q in entry =          11
  In of MODEL   11
    1    H    LEU  19           H        LEU  19 -18.698  -8.323  -8.051
    2    HA   LEU  19           HA       LEU  19 -21.142  -9.577  -8.836
    3    HB2  LEU  19           HB2      LEU  19 -20.840  -8.687  -6.599
    4    HB3  LEU  19           HB3      LEU  19 -20.652  -7.060  -7.250
    5    HG   LEU  19           HG       LEU  19 -22.984  -6.969  -7.844
    6   HD11  LEU  19          HD11      LEU  19 -22.889  -9.876  -7.159
    7   HD13  LEU  19          HD12      LEU  19 -23.690  -9.066  -8.505
    8   HD12  LEU  19          HD13      LEU  19 -24.386  -8.982  -6.887
    9   HD21  LEU  19          HD21      LEU  19 -22.260  -7.800  -5.069
   10   HD23  LEU  19          HD22      LEU  19 -23.934  -7.426  -5.479
   11   HD22  LEU  19          HD23      LEU  19 -22.680  -6.204  -5.690

  No H/Q in entry =          11
  In of MODEL   11
    1    H    VAL  20           H        VAL  20 -19.730  -6.393  -9.597
    2    HA   VAL  20           HA       VAL  20 -21.883  -5.426 -11.157
    3    HB   VAL  20           HB       VAL  20 -18.912  -4.770 -11.414
    4   HG13  VAL  20          HG11      VAL  20 -20.120  -4.187 -13.475
    5   HG12  VAL  20          HG12      VAL  20 -19.656  -2.733 -12.591
    6   HG11  VAL  20          HG13      VAL  20 -21.321  -3.308 -12.531
    7   HG21  VAL  20          HG21      VAL  20 -21.154  -3.621  -9.806
    8   HG23  VAL  20          HG22      VAL  20 -19.782  -2.624 -10.281
    9   HG22  VAL  20          HG23      VAL  20 -19.525  -4.065  -9.296

  No H/Q in entry =           9
  In of MODEL   11
    1    H    SER  21           H        SER  21 -19.089  -7.428 -12.186
    2    HA   SER  21           HA       SER  21 -19.907  -7.377 -14.928
    3    HB2  SER  21           HB2      SER  21 -18.429  -9.316 -15.248
    4    HB3  SER  21           HB3      SER  21 -17.619  -8.036 -14.347
    5    HG   SER  21           HG       SER  21 -17.599  -9.231 -12.611

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LYS  22           H        LYS  22 -20.892  -9.546 -12.310
    2    HA   LYS  22           HA       LYS  22 -22.413 -11.231 -14.089
    3    HB2  LYS  22           HB2      LYS  22 -22.674 -10.838 -11.105
    4    HB3  LYS  22           HB3      LYS  22 -23.471 -12.096 -12.046
    5    HG2  LYS  22           HG2      LYS  22 -20.480 -11.819 -11.812
    6    HG3  LYS  22           HG3      LYS  22 -21.460 -12.850 -10.770
    7    HD2  LYS  22           HD2      LYS  22 -22.233 -14.090 -12.760
    8    HD3  LYS  22           HD3      LYS  22 -21.192 -13.085 -13.769
    9    HE2  LYS  22           HE2      LYS  22 -19.214 -13.936 -12.623
   10    HE3  LYS  22           HE3      LYS  22 -20.226 -14.883 -11.532
   11    HZ3  LYS  22           HZ1      LYS  22 -20.693 -16.409 -13.137
   12    HZ2  LYS  22           HZ2      LYS  22 -19.113 -15.974 -13.587
   13    HZ1  LYS  22           HZ3      LYS  22 -20.442 -15.327 -14.422

  No H/Q in entry =          13
  In of MODEL   11
    1    H    MET  23           H        MET  23 -23.181  -8.296 -12.257
    2    HA   MET  23           HA       MET  23 -25.992  -8.445 -12.729
    3    HB2  MET  23           HB2      MET  23 -24.191  -6.088 -12.214
    4    HB3  MET  23           HB3      MET  23 -25.942  -5.961 -12.374
    5    HG2  MET  23           HG2      MET  23 -26.281  -7.241 -10.380
    6    HG3  MET  23           HG3      MET  23 -24.561  -7.613 -10.268
    7    HE2  MET  23           HE1      MET  23 -26.927  -3.996  -9.109
    8    HE1  MET  23           HE2      MET  23 -27.176  -4.991 -10.541
    9    HE3  MET  23           HE3      MET  23 -26.173  -3.543 -10.639

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ARG  24           H        ARG  24 -23.291  -6.985 -14.567
    2    HA   ARG  24           HA       ARG  24 -24.839  -5.748 -16.568
    3    HB2  ARG  24           HB2      ARG  24 -21.998  -6.819 -16.615
    4    HB3  ARG  24           HB3      ARG  24 -22.706  -5.958 -17.958
    5    HG2  ARG  24           HG2      ARG  24 -22.930  -3.906 -16.613
    6    HG3  ARG  24           HG3      ARG  24 -22.348  -4.784 -15.175
    7    HD2  ARG  24           HD2      ARG  24 -20.451  -3.601 -16.129
    8    HD3  ARG  24           HD3      ARG  24 -20.259  -5.318 -16.454
    9    HE   ARG  24           HE       ARG  24 -21.436  -4.430 -18.703
   10   HH21  ARG  24          HH11      ARG  24 -20.032  -5.062 -20.340
   11   HH22  ARG  24          HH12      ARG  24 -18.378  -4.558 -20.293
   12   HH11  ARG  24          HH21      ARG  24 -18.731  -3.328 -16.993
   13   HH12  ARG  24          HH22      ARG  24 -17.622  -3.524 -18.314

  No H/Q in entry =          13
  In of MODEL   11
    1    H    ALA  25           H        ALA  25 -23.643  -9.057 -16.255
    2    HA   ALA  25           HA       ALA  25 -24.283  -9.942 -18.873
    3    HB1  ALA  25           HB1      ALA  25 -23.537 -11.948 -18.155
    4    HB3  ALA  25           HB2      ALA  25 -24.578 -11.928 -16.732
    5    HB2  ALA  25           HB3      ALA  25 -23.041 -11.067 -16.710

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLN  26           H        GLN  26 -26.074  -9.973 -15.828
    2    HA   GLN  26           HA       GLN  26 -28.404 -11.238 -16.800
    3    HB2  GLN  26           HB2      GLN  26 -27.901  -9.446 -14.444
    4    HB3  GLN  26           HB3      GLN  26 -29.452 -10.206 -14.766
    5    HG2  GLN  26           HG2      GLN  26 -26.832 -11.602 -14.306
    6    HG3  GLN  26           HG3      GLN  26 -28.182 -11.510 -13.182
    7   HE21  GLN  26          HE21      GLN  26 -26.935 -13.668 -14.441
    8   HE22  GLN  26          HE22      GLN  26 -27.964 -14.749 -15.211

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ALA  27           H        ALA  27 -27.536  -7.817 -16.469
    2    HA   ALA  27           HA       ALA  27 -30.056  -6.787 -17.239
    3    HB1  ALA  27           HB1      ALA  27 -28.261  -5.419 -16.164
    4    HB3  ALA  27           HB2      ALA  27 -28.884  -4.687 -17.644
    5    HB2  ALA  27           HB3      ALA  27 -27.331  -5.522 -17.660

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLU  28           H        GLU  28 -27.351  -7.981 -19.122
    2    HA   GLU  28           HA       GLU  28 -28.335  -6.997 -21.644
    3    HB2  GLU  28           HB2      GLU  28 -25.936  -7.622 -21.038
    4    HB3  GLU  28           HB3      GLU  28 -26.449  -9.300 -21.210
    5    HG2  GLU  28           HG2      GLU  28 -25.340  -8.528 -23.202
    6    HG3  GLU  28           HG3      GLU  28 -27.035  -8.891 -23.527

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LYS  29           H        LYS  29 -28.420 -10.082 -19.943
    2    HA   LYS  29           HA       LYS  29 -29.715 -11.606 -21.913
    3    HB2  LYS  29           HB2      LYS  29 -28.624 -12.540 -19.907
    4    HB3  LYS  29           HB3      LYS  29 -29.898 -11.846 -18.907
    5    HG2  LYS  29           HG2      LYS  29 -31.541 -13.266 -19.937
    6    HG3  LYS  29           HG3      LYS  29 -30.343 -13.892 -21.066
    7    HD2  LYS  29           HD2      LYS  29 -29.157 -15.011 -19.330
    8    HD3  LYS  29           HD3      LYS  29 -30.067 -14.171 -18.076
    9    HE2  LYS  29           HE2      LYS  29 -30.776 -16.539 -18.398
   10    HE3  LYS  29           HE3      LYS  29 -32.079 -15.377 -18.643
   11    HZ1  LYS  29           HZ1      LYS  29 -31.539 -15.533 -21.074
   12    HZ3  LYS  29           HZ2      LYS  29 -32.224 -16.924 -20.383
   13    HZ2  LYS  29           HZ3      LYS  29 -30.558 -16.866 -20.699

  No H/Q in entry =          13
  In of MODEL   11
    1    H    TYR  30           H        TYR  30 -31.121  -9.495 -19.421
    2    HA   TYR  30           HA       TYR  30 -33.787 -10.016 -20.626
    3    HB2  TYR  30           HB2      TYR  30 -33.129  -8.811 -17.929
    4    HB3  TYR  30           HB3      TYR  30 -34.748  -9.111 -18.561
    5    HD1  TYR  30           HD1      TYR  30 -35.613 -11.424 -18.732
    6    HD2  TYR  30           HD2      TYR  30 -31.775 -10.600 -17.082
    7    HE1  TYR  30           HE1      TYR  30 -35.467 -13.737 -17.905
    8    HE2  TYR  30           HE2      TYR  30 -31.631 -12.900 -16.259
    9    HH   TYR  30           HH       TYR  30 -33.232 -15.309 -17.301

  No H/Q in entry =           9
  In of MODEL   11
    1    H    GLU  31           H        GLU  31 -31.672  -7.991 -21.478
    2    HA   GLU  31           HA       GLU  31 -31.652  -5.844 -22.330
    3    HB2  GLU  31           HB2      GLU  31 -34.537  -6.627 -22.801
    4    HB3  GLU  31           HB3      GLU  31 -33.734  -5.252 -23.558
    5    HG2  GLU  31           HG2      GLU  31 -32.245  -6.675 -24.746
    6    HG3  GLU  31           HG3      GLU  31 -32.770  -8.089 -23.832

  No H/Q in entry =           6
  In of MODEL   11
    1    H    VAL  32           H        VAL  32 -31.824  -5.710 -19.598
    2    HA   VAL  32           HA       VAL  32 -33.722  -3.627 -18.946
    3    HB   VAL  32           HB       VAL  32 -31.292  -4.548 -17.379
    4   HG12  VAL  32          HG11      VAL  32 -32.824  -3.731 -15.478
    5   HG11  VAL  32          HG12      VAL  32 -33.690  -2.863 -16.745
    6   HG13  VAL  32          HG13      VAL  32 -31.986  -2.519 -16.448
    7   HG21  VAL  32          HG21      VAL  32 -33.031  -6.315 -18.024
    8   HG23  VAL  32          HG22      VAL  32 -34.076  -5.495 -16.864
    9   HG22  VAL  32          HG23      VAL  32 -32.538  -6.178 -16.337

  No H/Q in entry =           9
  In of MODEL   11
    1    HA   PRO  33           HA       PRO  33 -30.773  -0.657 -20.693
    2    HB2  PRO  33           HB2      PRO  33 -32.331   1.533 -20.583
    3    HB3  PRO  33           HB3      PRO  33 -32.784   0.207 -21.653
    4    HG2  PRO  33           HG2      PRO  33 -33.732   0.740 -18.837
    5    HG3  PRO  33           HG3      PRO  33 -34.707   0.491 -20.285
    6    HD2  PRO  33           HD2      PRO  33 -34.188  -1.549 -18.597
    7    HD3  PRO  33           HD3      PRO  33 -34.263  -1.816 -20.338

  No H/Q in entry =           7
  In of MODEL   11
    1    H    VAL  34           H        VAL  34 -29.476  -1.148 -18.752
    2    HA   VAL  34           HA       VAL  34 -29.228   1.305 -17.140
    3    HB   VAL  34           HB       VAL  34 -28.593  -0.117 -15.190
    4   HG12  VAL  34          HG11      VAL  34 -30.982  -1.039 -14.843
    5   HG11  VAL  34          HG12      VAL  34 -31.332  -0.307 -16.408
    6   HG13  VAL  34          HG13      VAL  34 -30.786   0.700 -15.066
    7   HG21  VAL  34          HG21      VAL  34 -28.755  -2.174 -17.168
    8   HG23  VAL  34          HG22      VAL  34 -29.789  -2.540 -15.786
    9   HG22  VAL  34          HG23      VAL  34 -28.075  -2.212 -15.542

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ILE  35           H        ILE  35 -27.254   1.796 -16.328
    2    HA   ILE  35           HA       ILE  35 -24.934   0.501 -17.600
    3    HB   ILE  35           HB       ILE  35 -25.389   3.392 -16.823
    4   HG12  ILE  35          HG12      ILE  35 -24.406   2.073 -19.361
    5   HG13  ILE  35          HG13      ILE  35 -26.047   2.661 -19.091
    6   HG21  ILE  35          HG21      ILE  35 -22.797   1.913 -17.141
    7   HG23  ILE  35          HG22      ILE  35 -23.264   3.099 -15.923
    8   HG22  ILE  35          HG23      ILE  35 -22.912   3.620 -17.570
    9   HD11  ILE  35          HD11      ILE  35 -24.689   4.894 -18.535
   10   HD13  ILE  35          HD12      ILE  35 -25.236   4.477 -20.160
   11   HD12  ILE  35          HD13      ILE  35 -23.571   4.152 -19.678

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ILE  36           H        ILE  36 -23.662  -0.472 -16.002
    2    HA   ILE  36           HA       ILE  36 -24.083   0.171 -13.135
    3    HB   ILE  36           HB       ILE  36 -23.208  -2.528 -14.217
    4   HG12  ILE  36          HG12      ILE  36 -26.023  -1.775 -13.431
    5   HG13  ILE  36          HG13      ILE  36 -25.472  -1.765 -15.106
    6   HG23  ILE  36          HG21      ILE  36 -23.516  -3.336 -12.089
    7   HG22  ILE  36          HG22      ILE  36 -24.667  -2.073 -11.653
    8   HG21  ILE  36          HG23      ILE  36 -22.945  -1.703 -11.748
    9   HD13  ILE  36          HD11      ILE  36 -25.588  -3.983 -15.282
   10   HD12  ILE  36          HD12      ILE  36 -26.640  -3.868 -13.872
   11   HD11  ILE  36          HD13      ILE  36 -24.931  -4.246 -13.667

  No H/Q in entry =          11
  In of MODEL   11
    1    H    GLU  37           H        GLU  37 -22.305   0.855 -12.060
    2    HA   GLU  37           HA       GLU  37 -19.608   0.108 -12.996
    3    HB2  GLU  37           HB2      GLU  37 -20.545   2.887 -12.300
    4    HB3  GLU  37           HB3      GLU  37 -18.854   2.421 -12.491
    5    HG2  GLU  37           HG2      GLU  37 -20.937   2.350 -14.656
    6    HG3  GLU  37           HG3      GLU  37 -19.739   3.623 -14.425

  No H/Q in entry =           6
  In of MODEL   11
    1    H    ALA  38           H        ALA  38 -18.097  -0.073 -11.328
    2    HA   ALA  38           HA       ALA  38 -19.100   0.119  -8.548
    3    HB1  ALA  38           HB1      ALA  38 -17.358  -1.798  -9.968
    4    HB3  ALA  38           HB2      ALA  38 -18.386  -2.040  -8.555
    5    HB2  ALA  38           HB3      ALA  38 -16.788  -1.318  -8.370

  No H/Q in entry =           5
  In of MODEL   11
    1    H    PHE  39           H        PHE  39 -17.873   1.377  -7.105
    2    HA   PHE  39           HA       PHE  39 -15.388   2.627  -8.047
    3    HB2  PHE  39           HB2      PHE  39 -17.813   4.076  -6.998
    4    HB3  PHE  39           HB3      PHE  39 -16.198   4.783  -6.984
    5    HD1  PHE  39           HD1      PHE  39 -14.962   4.805  -9.271
    6    HD2  PHE  39           HD2      PHE  39 -19.183   4.427  -8.803
    7    HE1  PHE  39           HE1      PHE  39 -15.279   5.619 -11.590
    8    HE2  PHE  39           HE2      PHE  39 -19.516   5.231 -11.113
    9    HZ   PHE  39           HZ       PHE  39 -17.569   5.800 -12.525

  No H/Q in entry =           9
  In of MODEL   11
    1    HA   PRO  40           HA       PRO  40 -14.383   1.954  -3.762
    2    HB2  PRO  40           HB2      PRO  40 -12.659   4.018  -3.203
    3    HB3  PRO  40           HB3      PRO  40 -12.194   2.685  -4.259
    4    HG2  PRO  40           HG2      PRO  40 -13.296   5.384  -5.027
    5    HG3  PRO  40           HG3      PRO  40 -11.856   4.572  -5.639
    6    HD2  PRO  40           HD2      PRO  40 -14.091   4.406  -7.023
    7    HD3  PRO  40           HD3      PRO  40 -13.096   2.965  -6.820

  No H/Q in entry =           7
  In of MODEL   11
    1    H    GLU  41           H        GLU  41 -15.003   2.944  -1.638
    2    HA   GLU  41           HA       GLU  41 -17.290   4.590  -1.617
    3    HB2  GLU  41           HB2      GLU  41 -17.091   4.578   0.770
    4    HB3  GLU  41           HB3      GLU  41 -16.634   2.980   0.176
    5    HG2  GLU  41           HG2      GLU  41 -14.260   3.578   0.449
    6    HG3  GLU  41           HG3      GLU  41 -14.746   5.147   1.094

  No H/Q in entry =           6
  In of MODEL   11
    1    H    THR  42           H        THR  42 -13.984   5.591  -1.720
    2    HA   THR  42           HA       THR  42 -14.388   8.157  -0.538
    3    HB   THR  42           HB       THR  42 -12.260   8.771  -1.664
    4    HG1  THR  42           HG1      THR  42 -11.351   7.402  -3.102
    5   HG22  THR  42          HG21      THR  42 -10.858   6.990  -0.615
    6   HG21  THR  42          HG22      THR  42 -12.325   6.043  -0.354
    7   HG23  THR  42          HG23      THR  42 -12.122   7.593   0.458

  No H/Q in entry =           7
  In of MODEL   11
    1    H    LEU  43           H        LEU  43 -15.300   6.999  -3.612
    2    HA   LEU  43           HA       LEU  43 -15.636   9.750  -4.616
    3    HB2  LEU  43           HB2      LEU  43 -15.945   7.076  -5.970
    4    HB3  LEU  43           HB3      LEU  43 -16.206   8.638  -6.745
    5    HG   LEU  43           HG       LEU  43 -13.552   7.640  -5.740
    6   HD12  LEU  43          HD11      LEU  43 -14.310   7.997  -8.613
    7   HD11  LEU  43          HD12      LEU  43 -14.698   6.494  -7.777
    8   HD13  LEU  43          HD13      LEU  43 -13.021   7.021  -7.910
    9   HD23  LEU  43          HD21      LEU  43 -12.755   9.554  -7.192
   10   HD22  LEU  43          HD22      LEU  43 -13.594  10.021  -5.712
   11   HD21  LEU  43          HD23      LEU  43 -14.432  10.095  -7.260

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ALA  44           H        ALA  44 -17.512   7.901  -2.717
    2    HA   ALA  44           HA       ALA  44 -20.000   7.679  -4.008
    3    HB2  ALA  44           HB1      ALA  44 -19.810   6.595  -1.898
    4    HB3  ALA  44           HB2      ALA  44 -20.947   7.915  -1.631
    5    HB1  ALA  44           HB3      ALA  44 -19.274   8.074  -1.100

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLY  45           H        GLY  45 -18.636  10.536  -2.530
    2    HA3  GLY  45           HA2      GLY  45 -21.115  11.967  -2.882
    3    HA2  GLY  45           HA3      GLY  45 -19.581  12.639  -2.331

  No H/Q in entry =           3
  In of MODEL   11
    1    H    GLU  46           H        GLU  46 -18.052  11.712  -4.627
    2    HA   GLU  46           HA       GLU  46 -18.766  13.886  -6.418
    3    HB2  GLU  46           HB2      GLU  46 -16.518  11.867  -6.426
    4    HB3  GLU  46           HB3      GLU  46 -16.698  13.149  -7.623
    5    HG2  GLU  46           HG2      GLU  46 -16.413  14.833  -5.917
    6    HG3  GLU  46           HG3      GLU  46 -16.339  13.591  -4.667

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LYS  47           H        LYS  47 -18.561  10.365  -6.807
    2    HA   LYS  47           HA       LYS  47 -19.694  10.520  -9.472
    3    HB2  LYS  47           HB2      LYS  47 -19.060   8.162  -7.691
    4    HB3  LYS  47           HB3      LYS  47 -19.623   8.044  -9.358
    5    HG2  LYS  47           HG2      LYS  47 -17.111   9.496  -8.614
    6    HG3  LYS  47           HG3      LYS  47 -17.140   7.767  -8.957
    7    HD2  LYS  47           HD2      LYS  47 -18.141   8.236 -11.153
    8    HD3  LYS  47           HD3      LYS  47 -18.051   9.963 -10.811
    9    HE2  LYS  47           HE2      LYS  47 -15.622   9.806 -10.638
   10    HE3  LYS  47           HE3      LYS  47 -15.707   8.076 -10.964
   11    HZ2  LYS  47           HZ1      LYS  47 -15.928  10.310 -12.770
   12    HZ1  LYS  47           HZ2      LYS  47 -17.089   9.095 -13.013
   13    HZ3  LYS  47           HZ3      LYS  47 -15.436   8.711 -13.065

  No H/Q in entry =          13
  In of MODEL   11
    1    H    GLY  48           H        GLY  48 -20.962   9.773  -6.298
    2    HA3  GLY  48           HA2      GLY  48 -23.324   8.516  -6.996
    3    HA2  GLY  48           HA3      GLY  48 -23.108   9.535  -5.573

  No H/Q in entry =           3
  In of MODEL   11
    1    H    GLN  49           H        GLN  49 -22.606  11.950  -7.183
    2    HA   GLN  49           HA       GLN  49 -25.194  12.993  -7.313
    3    HB2  GLN  49           HB2      GLN  49 -22.689  13.904  -8.714
    4    HB3  GLN  49           HB3      GLN  49 -24.174  14.832  -8.625
    5    HG2  GLN  49           HG2      GLN  49 -23.988  14.895  -6.191
    6    HG3  GLN  49           HG3      GLN  49 -22.515  13.944  -6.277
    7   HE21  GLN  49          HE21      GLN  49 -22.441  16.192  -5.037
    8   HE22  GLN  49          HE22      GLN  49 -21.557  17.463  -5.712

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ASN  50           H        ASN  50 -23.494  11.125  -9.693
    2    HA   ASN  50           HA       ASN  50 -25.423  11.920 -11.765
    3    HB2  ASN  50           HB2      ASN  50 -22.808  10.443 -12.007
    4    HB3  ASN  50           HB3      ASN  50 -23.883  10.824 -13.345
    5   HD21  ASN  50          HD21      ASN  50 -21.251  11.759 -11.776
    6   HD22  ASN  50          HD22      ASN  50 -21.064  13.394 -12.144

  No H/Q in entry =           6
  In of MODEL   11
    1    H    ALA  51           H        ALA  51 -25.323   9.597  -9.487
    2    HA   ALA  51           HA       ALA  51 -26.074   7.407 -11.275
    3    HB2  ALA  51           HB1      ALA  51 -25.436   6.096  -9.578
    4    HB3  ALA  51           HB2      ALA  51 -26.567   6.891  -8.482
    5    HB1  ALA  51           HB3      ALA  51 -24.946   7.551  -8.708

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ASP  52           H        ASP  52 -28.050   6.304 -11.097
    2    HA   ASP  52           HA       ASP  52 -30.269   8.092 -10.431
    3    HB2  ASP  52           HB2      ASP  52 -30.034   5.569 -12.070
    4    HB3  ASP  52           HB3      ASP  52 -31.591   6.269 -11.627

  No H/Q in entry =           4
  In of MODEL   11
    1    H    VAL  53           H        VAL  53 -28.585   5.258  -9.395
    2    HA   VAL  53           HA       VAL  53 -29.999   5.384  -6.865
    3    HB   VAL  53           HB       VAL  53 -31.371   3.691  -8.069
    4   HG11  VAL  53          HG11      VAL  53 -29.621   2.853  -9.600
    5   HG13  VAL  53          HG12      VAL  53 -30.412   1.550  -8.714
    6   HG12  VAL  53          HG13      VAL  53 -28.809   2.099  -8.229
    7   HG23  VAL  53          HG21      VAL  53 -30.481   1.758  -6.360
    8   HG22  VAL  53          HG22      VAL  53 -31.638   3.040  -5.998
    9   HG21  VAL  53          HG23      VAL  53 -29.932   3.259  -5.613

  No H/Q in entry =           9
  In of MODEL   11
    1    H    VAL  54           H        VAL  54 -28.657   5.006  -5.219
    2    HA   VAL  54           HA       VAL  54 -25.884   4.215  -5.851
    3    HB   VAL  54           HB       VAL  54 -26.971   5.998  -3.613
    4   HG11  VAL  54          HG11      VAL  54 -24.363   4.637  -3.916
    5   HG13  VAL  54          HG12      VAL  54 -25.115   5.318  -2.475
    6   HG12  VAL  54          HG13      VAL  54 -24.248   6.368  -3.595
    7   HG22  VAL  54          HG21      VAL  54 -26.168   7.817  -4.747
    8   HG21  VAL  54          HG22      VAL  54 -26.708   6.795  -6.079
    9   HG23  VAL  54          HG23      VAL  54 -24.996   6.867  -5.662

  No H/Q in entry =           9
  In of MODEL   11
    1    H    LEU  55           H        LEU  55 -25.239   2.317  -5.189
    2    HA   LEU  55           HA       LEU  55 -26.690   1.001  -2.979
    3    HB2  LEU  55           HB2      LEU  55 -25.132  -0.162  -5.277
    4    HB3  LEU  55           HB3      LEU  55 -25.856  -1.096  -3.967
    5    HG   LEU  55           HG       LEU  55 -27.353   0.428  -6.088
    6   HD13  LEU  55          HD11      LEU  55 -27.024  -1.434  -7.286
    7   HD12  LEU  55          HD12      LEU  55 -27.946  -2.315  -6.068
    8   HD11  LEU  55          HD13      LEU  55 -26.192  -2.206  -5.938
    9   HD23  LEU  55          HD21      LEU  55 -28.581  -1.522  -4.191
   10   HD22  LEU  55          HD22      LEU  55 -29.318  -0.169  -5.050
   11   HD21  LEU  55          HD23      LEU  55 -28.289   0.130  -3.649

  No H/Q in entry =          11
  In of MODEL   11
    1    H    LEU  56           H        LEU  56 -25.504   0.459  -1.179
    2    HA   LEU  56           HA       LEU  56 -22.580   0.922  -1.270
    3    HB2  LEU  56           HB2      LEU  56 -24.350   0.703   1.153
    4    HB3  LEU  56           HB3      LEU  56 -22.651   1.172   1.117
    5    HG   LEU  56           HG       LEU  56 -25.001   2.782   0.157
    6   HD11  LEU  56          HD11      LEU  56 -23.848   2.463   2.669
    7   HD13  LEU  56          HD12      LEU  56 -24.876   3.800   2.156
    8   HD12  LEU  56          HD13      LEU  56 -23.122   3.945   2.047
    9   HD23  LEU  56          HD21      LEU  56 -23.099   4.524  -0.083
   10   HD22  LEU  56          HD22      LEU  56 -23.470   3.399  -1.390
   11   HD21  LEU  56          HD23      LEU  56 -22.097   3.094  -0.329

  No H/Q in entry =          11
  In of MODEL   11
    1    H    GLY  57           H        GLY  57 -21.156  -0.668  -0.729
    2    HA3  GLY  57           HA2      GLY  57 -22.017  -3.377  -0.879
    3    HA2  GLY  57           HA3      GLY  57 -20.401  -2.837  -0.425

  No H/Q in entry =           3
  In of MODEL   11
    1    HA   PRO  58           HA       PRO  58 -23.142  -3.890   3.331
    2    HB2  PRO  58           HB2      PRO  58 -22.391  -6.470   3.965
    3    HB3  PRO  58           HB3      PRO  58 -23.796  -6.108   2.963
    4    HG2  PRO  58           HG2      PRO  58 -21.057  -6.936   2.157
    5    HG3  PRO  58           HG3      PRO  58 -22.618  -7.441   1.510
    6    HD2  PRO  58           HD2      PRO  58 -21.067  -5.604   0.243
    7    HD3  PRO  58           HD3      PRO  58 -22.828  -5.560   0.161

  No H/Q in entry =           7
  In of MODEL   11
    1    H    GLN  59           H        GLN  59 -19.769  -4.292   2.691
    2    HA   GLN  59           HA       GLN  59 -18.982  -4.255   5.442
    3    HB2  GLN  59           HB2      GLN  59 -17.292  -3.155   3.217
    4    HB3  GLN  59           HB3      GLN  59 -16.781  -3.927   4.704
    5    HG2  GLN  59           HG2      GLN  59 -16.362  -5.572   3.162
    6    HG3  GLN  59           HG3      GLN  59 -17.970  -6.018   3.707
    7   HE21  GLN  59          HE21      GLN  59 -18.494  -6.881   1.968
    8   HE22  GLN  59          HE22      GLN  59 -18.910  -6.452   0.415

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ILE  60           H        ILE  60 -20.000  -1.757   3.211
    2    HA   ILE  60           HA       ILE  60 -19.170   0.248   5.219
    3    HB   ILE  60           HB       ILE  60 -19.480   1.944   3.363
    4   HG12  ILE  60          HG12      ILE  60 -19.215  -0.325   1.432
    5   HG13  ILE  60          HG13      ILE  60 -20.815   0.195   1.963
    6   HG23  ILE  60          HG21      ILE  60 -17.321   1.687   2.543
    7   HG22  ILE  60          HG22      ILE  60 -17.390  -0.070   2.661
    8   HG21  ILE  60          HG23      ILE  60 -17.306   0.909   4.125
    9   HD12  ILE  60          HD11      ILE  60 -18.816   1.633   0.268
   10   HD11  ILE  60          HD12      ILE  60 -19.915   2.579   1.271
   11   HD13  ILE  60          HD13      ILE  60 -20.559   1.474   0.057

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ALA  61           H        ALA  61 -21.587  -1.392   5.339
    2    HA   ALA  61           HA       ALA  61 -23.856   0.214   4.884
    3    HB1  ALA  61           HB1      ALA  61 -25.022  -1.284   6.244
    4    HB2  ALA  61           HB2      ALA  61 -23.603  -1.628   7.235
    5    HB3  ALA  61           HB3      ALA  61 -23.704  -2.259   5.591

  No H/Q in entry =           5
  In of MODEL   11
    1    H    TYR  62           H        TYR  62 -21.615   0.192   7.657
    2    HA   TYR  62           HA       TYR  62 -23.188   1.836   9.322
    3    HB2  TYR  62           HB2      TYR  62 -21.135   2.335  10.518
    4    HB3  TYR  62           HB3      TYR  62 -21.176   0.623  10.097
    5    HD1  TYR  62           HD1      TYR  62 -19.684  -0.250   8.287
    6    HD2  TYR  62           HD2      TYR  62 -19.381   3.778   9.681
    7    HE1  TYR  62           HE1      TYR  62 -17.490  -0.037   7.182
    8    HE2  TYR  62           HE2      TYR  62 -17.174   3.985   8.577
    9    HH   TYR  62           HH       TYR  62 -16.132   1.951   6.257

  No H/Q in entry =           9
  In of MODEL   11
    1    H    MET  63           H        MET  63 -21.598   2.692   6.435
    2    HA   MET  63           HA       MET  63 -21.488   5.537   7.088
    3    HB2  MET  63           HB2      MET  63 -20.879   3.996   4.564
    4    HB3  MET  63           HB3      MET  63 -20.717   5.746   4.725
    5    HG2  MET  63           HG2      MET  63 -18.987   5.437   6.404
    6    HG3  MET  63           HG3      MET  63 -19.156   3.688   6.263
    7    HE2  MET  63           HE1      MET  63 -17.186   6.623   3.508
    8    HE1  MET  63           HE2      MET  63 -18.358   6.917   4.793
    9    HE3  MET  63           HE3      MET  63 -18.915   6.518   3.168

  No H/Q in entry =           9
  In of MODEL   11
    1    H    LEU  64           H        LEU  64 -24.021   3.613   6.180
    2    HA   LEU  64           HA       LEU  64 -25.286   4.974   4.096
    3    HB2  LEU  64           HB2      LEU  64 -26.096   2.863   5.054
    4    HB3  LEU  64           HB3      LEU  64 -26.555   3.715   6.527
    5    HG   LEU  64           HG       LEU  64 -28.292   4.915   5.303
    6   HD13  LEU  64          HD11      LEU  64 -28.040   5.131   3.064
    7   HD12  LEU  64          HD12      LEU  64 -28.651   3.480   2.948
    8   HD11  LEU  64          HD13      LEU  64 -26.914   3.778   2.982
    9   HD23  LEU  64          HD21      LEU  64 -28.756   2.082   4.599
   10   HD22  LEU  64          HD22      LEU  64 -29.759   3.206   5.516
   11   HD21  LEU  64          HD23      LEU  64 -28.357   2.454   6.277

  No H/Q in entry =          11
  In of MODEL   11
    1    HA   PRO  65           HA       PRO  65 -27.503   8.119   6.830
    2    HB2  PRO  65           HB2      PRO  65 -25.479   8.352   9.057
    3    HB3  PRO  65           HB3      PRO  65 -27.223   8.596   9.121
    4    HG2  PRO  65           HG2      PRO  65 -26.234   6.375  10.067
    5    HG3  PRO  65           HG3      PRO  65 -27.664   6.297   9.040
    6    HD2  PRO  65           HD2      PRO  65 -24.789   5.734   8.311
    7    HD3  PRO  65           HD3      PRO  65 -26.232   4.811   7.893

  No H/Q in entry =           7
  In of MODEL   11
    1    H    GLU  66           H        GLU  66 -23.945   8.140   6.861
    2    HA   GLU  66           HA       GLU  66 -23.713  10.938   6.414
    3    HB2  GLU  66           HB2      GLU  66 -21.858   8.660   5.772
    4    HB3  GLU  66           HB3      GLU  66 -21.448  10.358   5.536
    5    HG2  GLU  66           HG2      GLU  66 -21.638  10.758   7.900
    6    HG3  GLU  66           HG3      GLU  66 -22.125   9.083   8.161

  No H/Q in entry =           6
  In of MODEL   11
    1    H    ILE  67           H        ILE  67 -23.784   8.159   4.201
    2    HA   ILE  67           HA       ILE  67 -23.430   9.843   1.879
    3    HB   ILE  67           HB       ILE  67 -24.266   6.921   2.110
    4   HG12  ILE  67          HG12      ILE  67 -21.672   8.131   1.140
    5   HG13  ILE  67          HG13      ILE  67 -21.938   7.730   2.835
    6   HG21  ILE  67          HG21      ILE  67 -24.275   8.769  -0.142
    7   HG23  ILE  67          HG22      ILE  67 -24.865   7.109  -0.060
    8   HG22  ILE  67          HG23      ILE  67 -23.167   7.424  -0.413
    9   HD12  ILE  67          HD11      ILE  67 -21.510   5.934   0.505
   10   HD11  ILE  67          HD12      ILE  67 -22.496   5.359   1.848
   11   HD13  ILE  67          HD13      ILE  67 -20.830   5.862   2.131

  No H/Q in entry =          11
  In of MODEL   11
    1    H    GLN  68           H        GLN  68 -26.258   8.755   3.562
    2    HA   GLN  68           HA       GLN  68 -28.129   9.622   1.598
    3    HB2  GLN  68           HB2      GLN  68 -28.342   9.300   4.589
    4    HB3  GLN  68           HB3      GLN  68 -29.685   9.856   3.604
    5    HG2  GLN  68           HG2      GLN  68 -29.689   7.808   2.357
    6    HG3  GLN  68           HG3      GLN  68 -28.218   7.271   3.149
    7   HE21  GLN  68          HE21      GLN  68 -30.372   5.870   3.059
    8   HE22  GLN  68          HE22      GLN  68 -31.175   5.418   4.491

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ARG  69           H        ARG  69 -26.523  11.357   4.292
    2    HA   ARG  69           HA       ARG  69 -27.939  13.807   3.870
    3    HB2  ARG  69           HB2      ARG  69 -25.559  12.943   5.441
    4    HB3  ARG  69           HB3      ARG  69 -25.673  14.656   5.061
    5    HG2  ARG  69           HG2      ARG  69 -27.979  14.670   6.060
    6    HG3  ARG  69           HG3      ARG  69 -27.733  12.991   6.555
    7    HD2  ARG  69           HD2      ARG  69 -26.074  15.389   7.415
    8    HD3  ARG  69           HD3      ARG  69 -27.174  14.476   8.435
    9    HE   ARG  69           HE       ARG  69 -24.557  13.579   7.466
   10   HH21  ARG  69          HH11      ARG  69 -23.701  11.849   8.676
   11   HH22  ARG  69          HH12      ARG  69 -24.701  11.030   9.828
   12   HH11  ARG  69          HH21      ARG  69 -27.482  13.002   9.208
   13   HH12  ARG  69          HH22      ARG  69 -26.841  11.680  10.128

  No H/Q in entry =          13
  In of MODEL   11
    1    H    LEU  70           H        LEU  70 -25.060  12.434   2.493
    2    HA   LEU  70           HA       LEU  70 -24.004  14.803   1.279
    3    HB2  LEU  70           HB2      LEU  70 -22.961  12.512   1.893
    4    HB3  LEU  70           HB3      LEU  70 -23.586  12.013   0.322
    5    HG   LEU  70           HG       LEU  70 -22.032  13.398  -0.802
    6   HD11  LEU  70          HD11      LEU  70 -21.191  14.295   1.963
    7   HD13  LEU  70          HD12      LEU  70 -21.919  15.300   0.710
    8   HD12  LEU  70          HD13      LEU  70 -20.299  14.644   0.479
    9   HD22  LEU  70          HD21      LEU  70 -20.565  11.711  -0.565
   10   HD21  LEU  70          HD22      LEU  70 -21.464  11.192   0.861
   11   HD23  LEU  70          HD23      LEU  70 -20.096  12.292   1.034

  No H/Q in entry =          11
  In of MODEL   11
    1    H    LEU  71           H        LEU  71 -26.126  12.207   0.226
    2    HA   LEU  71           HA       LEU  71 -26.708  13.650  -2.304
    3    HB2  LEU  71           HB2      LEU  71 -26.857  10.670  -1.814
    4    HB3  LEU  71           HB3      LEU  71 -27.019  11.506  -3.358
    5    HG   LEU  71           HG       LEU  71 -24.479  11.585  -1.729
    6   HD12  LEU  71          HD11      LEU  71 -24.535   9.922  -4.138
    7   HD11  LEU  71          HD12      LEU  71 -25.518   9.300  -2.814
    8   HD13  LEU  71          HD13      LEU  71 -23.800   9.612  -2.565
    9   HD22  LEU  71          HD21      LEU  71 -24.631  13.378  -3.246
   10   HD21  LEU  71          HD22      LEU  71 -25.127  12.309  -4.557
   11   HD23  LEU  71          HD23      LEU  71 -23.496  12.198  -3.898

  No H/Q in entry =          11
  In of MODEL   11
    1    HA   PRO  72           HA       PRO  72 -30.533  13.175   0.372
    2    HB2  PRO  72           HB2      PRO  72 -31.432  15.721   0.267
    3    HB3  PRO  72           HB3      PRO  72 -30.103  15.305   1.348
    4    HG2  PRO  72           HG2      PRO  72 -29.970  16.464  -1.425
    5    HG3  PRO  72           HG3      PRO  72 -29.193  17.048   0.047
    6    HD2  PRO  72           HD2      PRO  72 -27.854  15.486  -1.714
    7    HD3  PRO  72           HD3      PRO  72 -27.575  15.348   0.021

  No H/Q in entry =           7
  In of MODEL   11
    1    H    ASN  73           H        ASN  73 -29.965  14.095  -2.863
    2    HA   ASN  73           HA       ASN  73 -32.827  13.734  -3.454
    3    HB2  ASN  73           HB2      ASN  73 -32.405  14.818  -5.572
    4    HB3  ASN  73           HB3      ASN  73 -31.880  15.825  -4.232
    5   HD21  ASN  73          HD21      ASN  73 -31.119  15.845  -6.919
    6   HD22  ASN  73          HD22      ASN  73 -29.452  15.705  -7.131

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LYS  74           H        LYS  74 -30.808  11.515  -3.024
    2    HA   LYS  74           HA       LYS  74 -31.387  10.076  -5.545
    3    HB2  LYS  74           HB2      LYS  74 -28.830   9.843  -3.952
    4    HB3  LYS  74           HB3      LYS  74 -29.221   9.005  -5.454
    5    HG2  LYS  74           HG2      LYS  74 -28.997  11.981  -5.296
    6    HG3  LYS  74           HG3      LYS  74 -27.612  10.933  -5.604
    7    HD2  LYS  74           HD2      LYS  74 -28.740   9.963  -7.520
    8    HD3  LYS  74           HD3      LYS  74 -30.169  10.945  -7.196
    9    HE2  LYS  74           HE2      LYS  74 -28.977  12.962  -7.681
   10    HE3  LYS  74           HE3      LYS  74 -27.445  12.092  -7.779
   11    HZ2  LYS  74           HZ1      LYS  74 -28.950  12.644  -9.893
   12    HZ1  LYS  74           HZ2      LYS  74 -29.580  11.119  -9.491
   13    HZ3  LYS  74           HZ3      LYS  74 -27.921  11.297  -9.811

  No H/Q in entry =          13
  In of MODEL   11
    1    HA   PRO  75           HA       PRO  75 -32.702   7.114  -2.516
    2    HB2  PRO  75           HB2      PRO  75 -33.001   4.870  -4.063
    3    HB3  PRO  75           HB3      PRO  75 -34.147   6.208  -4.137
    4    HG2  PRO  75           HG2      PRO  75 -31.824   5.618  -5.930
    5    HG3  PRO  75           HG3      PRO  75 -33.483   6.027  -6.361
    6    HD2  PRO  75           HD2      PRO  75 -31.566   7.918  -6.368
    7    HD3  PRO  75           HD3      PRO  75 -33.197   8.303  -5.815

  No H/Q in entry =           7
  In of MODEL   11
    1    H    VAL  76           H        VAL  76 -31.218   6.098  -1.147
    2    HA   VAL  76           HA       VAL  76 -28.751   4.906  -2.268
    3    HB   VAL  76           HB       VAL  76 -29.026   6.405   0.372
    4   HG11  VAL  76          HG11      VAL  76 -26.670   5.131  -1.031
    5   HG13  VAL  76          HG12      VAL  76 -27.341   4.693   0.542
    6   HG12  VAL  76          HG13      VAL  76 -26.518   6.238   0.333
    7   HG22  VAL  76          HG21      VAL  76 -28.394   8.303  -0.550
    8   HG21  VAL  76          HG22      VAL  76 -28.947   7.579  -2.061
    9   HG23  VAL  76          HG23      VAL  76 -27.238   7.519  -1.626

  No H/Q in entry =           9
  In of MODEL   11
    1    H    GLU  77           H        GLU  77 -28.498   2.764  -1.628
    2    HA   GLU  77           HA       GLU  77 -29.241   2.004   1.046
    3    HB2  GLU  77           HB2      GLU  77 -30.832   0.328   0.559
    4    HB3  GLU  77           HB3      GLU  77 -31.410   1.833  -0.157
    5    HG2  GLU  77           HG2      GLU  77 -30.817   1.053  -2.341
    6    HG3  GLU  77           HG3      GLU  77 -30.147  -0.426  -1.656

  No H/Q in entry =           6
  In of MODEL   11
    1    H    VAL  78           H        VAL  78 -28.876  -0.069   1.731
    2    HA   VAL  78           HA       VAL  78 -26.211  -0.817   0.820
    3    HB   VAL  78           HB       VAL  78 -27.878  -1.690   3.220
    4   HG11  VAL  78          HG11      VAL  78 -25.536  -2.903   2.082
    5   HG13  VAL  78          HG12      VAL  78 -26.419  -3.366   3.539
    6   HG12  VAL  78          HG13      VAL  78 -25.115  -2.184   3.637
    7   HG22  VAL  78          HG21      VAL  78 -26.422  -0.289   4.520
    8   HG21  VAL  78          HG22      VAL  78 -27.187   0.653   3.240
    9   HG23  VAL  78          HG23      VAL  78 -25.505   0.146   3.077

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ILE  79           H        ILE  79 -25.659  -2.730  -0.064
    2    HA   ILE  79           HA       ILE  79 -27.715  -4.255  -1.365
    3    HB   ILE  79           HB       ILE  79 -24.715  -4.737  -1.174
    4   HG12  ILE  79          HG12      ILE  79 -26.394  -3.688  -3.457
    5   HG13  ILE  79          HG13      ILE  79 -25.521  -2.651  -2.329
    6   HG22  ILE  79          HG21      ILE  79 -25.829  -5.965  -3.462
    7   HG21  ILE  79          HG22      ILE  79 -26.789  -6.480  -2.075
    8   HG23  ILE  79          HG23      ILE  79 -25.044  -6.735  -2.083
    9   HD13  ILE  79          HD11      ILE  79 -24.127  -2.771  -4.164
   10   HD12  ILE  79          HD12      ILE  79 -24.446  -4.488  -4.416
   11   HD11  ILE  79          HD13      ILE  79 -23.453  -3.966  -3.054

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ASP  80           H        ASP  80 -28.545  -6.181  -0.744
    2    HA   ASP  80           HA       ASP  80 -28.448  -7.042   1.914
    3    HB2  ASP  80           HB2      ASP  80 -30.213  -7.667   0.304
    4    HB3  ASP  80           HB3      ASP  80 -29.051  -8.671  -0.565

  No H/Q in entry =           4
  In of MODEL   11
    1    H    SER  81           H        SER  81 -26.883  -8.139   3.042
    2    HA   SER  81           HA       SER  81 -24.392  -8.804   1.829
    3    HB2  SER  81           HB2      SER  81 -23.800  -9.794   4.006
    4    HB3  SER  81           HB3      SER  81 -24.521  -8.197   4.205
    5    HG   SER  81           HG       SER  81 -25.989  -9.070   5.355

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU  82           H        LEU  82 -27.069 -10.929   2.214
    2    HA   LEU  82           HA       LEU  82 -25.495 -13.282   1.708
    3    HB2  LEU  82           HB2      LEU  82 -28.442 -12.712   1.478
    4    HB3  LEU  82           HB3      LEU  82 -27.717 -14.307   1.287
    5    HG   LEU  82           HG       LEU  82 -27.650 -12.684   3.812
    6   HD13  LEU  82          HD11      LEU  82 -29.364 -14.156   4.626
    7   HD12  LEU  82          HD12      LEU  82 -29.278 -15.149   3.168
    8   HD11  LEU  82          HD13      LEU  82 -29.925 -13.510   3.082
    9   HD21  LEU  82          HD21      LEU  82 -26.647 -15.376   2.937
   10   HD23  LEU  82          HD22      LEU  82 -27.015 -15.057   4.631
   11   HD22  LEU  82          HD23      LEU  82 -25.787 -14.102   3.802

  No H/Q in entry =          11
  In of MODEL   11
    1    H    LEU  83           H        LEU  83 -27.506 -11.112  -0.218
    2    HA   LEU  83           HA       LEU  83 -27.317 -12.503  -2.672
    3    HB2  LEU  83           HB2      LEU  83 -27.759  -9.593  -2.061
    4    HB3  LEU  83           HB3      LEU  83 -27.802 -10.262  -3.691
    5    HG   LEU  83           HG       LEU  83 -29.804 -10.644  -1.485
    6   HD13  LEU  83          HD11      LEU  83 -30.599  -8.823  -2.566
    7   HD12  LEU  83          HD12      LEU  83 -31.061  -9.962  -3.829
    8   HD11  LEU  83          HD13      LEU  83 -29.540  -9.077  -3.953
    9   HD23  LEU  83          HD21      LEU  83 -29.958 -11.945  -4.190
   10   HD22  LEU  83          HD22      LEU  83 -30.905 -12.287  -2.742
   11   HD21  LEU  83          HD23      LEU  83 -29.212 -12.768  -2.820

  No H/Q in entry =          11
  In of MODEL   11
    1    H    TYR  84           H        TYR  84 -25.376 -10.068  -1.055
    2    HA   TYR  84           HA       TYR  84 -23.547  -9.587  -3.215
    3    HB2  TYR  84           HB2      TYR  84 -24.078  -8.103  -1.169
    4    HB3  TYR  84           HB3      TYR  84 -22.967  -9.155  -0.293
    5    HD1  TYR  84           HD1      TYR  84 -20.642  -8.814  -0.407
    6    HD2  TYR  84           HD2      TYR  84 -23.192  -6.850  -3.212
    7    HE1  TYR  84           HE1      TYR  84 -18.713  -7.501  -1.223
    8    HE2  TYR  84           HE2      TYR  84 -21.272  -5.539  -4.045
    9    HH   TYR  84           HH       TYR  84 -19.109  -4.851  -3.413

  No H/Q in entry =           9
  In of MODEL   11
    1    H    GLY  85           H        GLY  85 -23.244 -11.541  -0.242
    2    HA3  GLY  85           HA2      GLY  85 -20.660 -12.456  -0.743
    3    HA2  GLY  85           HA3      GLY  85 -21.866 -13.306   0.222

  No H/Q in entry =           3
  In of MODEL   11
    1    H    LYS  86           H        LYS  86 -23.733 -13.734  -1.810
    2    HA   LYS  86           HA       LYS  86 -22.663 -16.113  -3.047
    3    HB2  LYS  86           HB2      LYS  86 -24.887 -16.040  -2.081
    4    HB3  LYS  86           HB3      LYS  86 -25.331 -14.706  -3.143
    5    HG2  LYS  86           HG2      LYS  86 -26.354 -16.761  -3.855
    6    HG3  LYS  86           HG3      LYS  86 -25.191 -16.196  -5.055
    7    HD2  LYS  86           HD2      LYS  86 -23.546 -17.754  -4.335
    8    HD3  LYS  86           HD3      LYS  86 -24.455 -18.141  -2.874
    9    HE2  LYS  86           HE2      LYS  86 -24.740 -19.949  -4.411
   10    HE3  LYS  86           HE3      LYS  86 -26.261 -19.059  -4.343
   11    HZ3  LYS  86           HZ1      LYS  86 -26.031 -18.319  -6.445
   12    HZ2  LYS  86           HZ2      LYS  86 -25.033 -19.683  -6.616
   13    HZ1  LYS  86           HZ3      LYS  86 -24.343 -18.158  -6.335

  No H/Q in entry =          13
  In of MODEL   11
    1    H    VAL  87           H        VAL  87 -22.706 -12.912  -3.988
    2    HA   VAL  87           HA       VAL  87 -22.448 -11.763  -5.950
    3    HB   VAL  87           HB       VAL  87 -21.380 -14.241  -7.312
    4   HG13  VAL  87          HG11      VAL  87 -20.122 -12.735  -8.548
    5   HG12  VAL  87          HG12      VAL  87 -20.050 -11.560  -7.234
    6   HG11  VAL  87          HG13      VAL  87 -21.526 -11.734  -8.182
    7   HG21  VAL  87          HG21      VAL  87 -20.109 -12.831  -4.995
    8   HG23  VAL  87          HG22      VAL  87 -19.146 -13.652  -6.220
    9   HG22  VAL  87          HG23      VAL  87 -20.313 -14.561  -5.263

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ASP  88           H        ASP  88 -24.950 -12.435  -5.558
    2    HA   ASP  88           HA       ASP  88 -26.084 -13.702  -7.922
    3    HB2  ASP  88           HB2      ASP  88 -27.047 -13.926  -5.582
    4    HB3  ASP  88           HB3      ASP  88 -27.524 -12.234  -5.701

  No H/Q in entry =           4
  In of MODEL   11
    1    H    GLY  89           H        GLY  89 -25.417 -12.460  -9.591
    2    HA3  GLY  89           HA2      GLY  89 -25.641  -9.693  -9.830
    3    HA2  GLY  89           HA3      GLY  89 -25.618 -10.835 -11.175

  No H/Q in entry =           3
  In of MODEL   11
    1    H    LEU  90           H        LEU  90 -28.040 -12.213 -10.675
    2    HA   LEU  90           HA       LEU  90 -29.892 -10.322 -11.794
    3    HB2  LEU  90           HB2      LEU  90 -29.929 -12.728 -12.337
    4    HB3  LEU  90           HB3      LEU  90 -30.409 -13.076 -10.676
    5    HG   LEU  90           HG       LEU  90 -32.548 -11.994 -11.028
    6   HD13  LEU  90          HD11      LEU  90 -32.413 -10.273 -12.531
    7   HD12  LEU  90          HD12      LEU  90 -32.949 -11.535 -13.643
    8   HD11  LEU  90          HD13      LEU  90 -31.239 -11.115 -13.547
    9   HD23  LEU  90          HD21      LEU  90 -32.486 -13.660 -13.439
   10   HD22  LEU  90          HD22      LEU  90 -33.445 -13.817 -11.967
   11   HD21  LEU  90          HD23      LEU  90 -31.783 -14.406 -12.005

  No H/Q in entry =          11
  In of MODEL   11
    1    H    GLY  91           H        GLY  91 -29.661 -11.772  -8.590
    2    HA3  GLY  91           HA2      GLY  91 -32.003 -10.677  -7.537
    3    HA2  GLY  91           HA3      GLY  91 -30.592 -11.175  -6.604

  No H/Q in entry =           3
  In of MODEL   11
    1    H    VAL  92           H        VAL  92 -28.711  -9.335  -7.514
    2    HA   VAL  92           HA       VAL  92 -29.515  -7.022  -5.989
    3    HB   VAL  92           HB       VAL  92 -26.984  -7.479  -7.610
    4   HG12  VAL  92          HG11      VAL  92 -27.146  -5.560  -5.311
    5   HG11  VAL  92          HG12      VAL  92 -27.838  -5.051  -6.852
    6   HG13  VAL  92          HG13      VAL  92 -26.135  -5.493  -6.755
    7   HG22  VAL  92          HG21      VAL  92 -26.717  -9.038  -5.997
    8   HG21  VAL  92          HG22      VAL  92 -27.858  -8.258  -4.902
    9   HG23  VAL  92          HG23      VAL  92 -26.216  -7.635  -5.053

  No H/Q in entry =           9
  In of MODEL   11
    1    H    LEU  93           H        LEU  93 -29.143  -7.730  -9.404
    2    HA   LEU  93           HA       LEU  93 -29.539  -5.114 -10.369
    3    HB2  LEU  93           HB2      LEU  93 -28.890  -6.982 -11.810
    4    HB3  LEU  93           HB3      LEU  93 -30.467  -7.729 -11.555
    5    HG   LEU  93           HG       LEU  93 -31.522  -5.798 -12.696
    6   HD11  LEU  93          HD11      LEU  93 -29.689  -4.168 -12.241
    7   HD13  LEU  93          HD12      LEU  93 -30.150  -4.231 -13.943
    8   HD12  LEU  93          HD13      LEU  93 -28.678  -5.036 -13.398
    9   HD23  LEU  93          HD21      LEU  93 -30.504  -6.385 -14.988
   10   HD22  LEU  93          HD22      LEU  93 -31.316  -7.640 -14.051
   11   HD21  LEU  93          HD23      LEU  93 -29.553  -7.559 -14.078

  No H/Q in entry =          11
  In of MODEL   11
    1    H    LYS  94           H        LYS  94 -31.865  -7.682  -9.450
    2    HA   LYS  94           HA       LYS  94 -34.239  -6.284 -10.065
    3    HB2  LYS  94           HB2      LYS  94 -33.666  -8.430  -8.027
    4    HB3  LYS  94           HB3      LYS  94 -35.277  -7.762  -8.284
    5    HG2  LYS  94           HG2      LYS  94 -35.210  -8.572 -10.608
    6    HG3  LYS  94           HG3      LYS  94 -33.633  -9.296 -10.289
    7    HD2  LYS  94           HD2      LYS  94 -34.711 -10.617  -8.429
    8    HD3  LYS  94           HD3      LYS  94 -36.270 -10.001  -8.973
    9    HE2  LYS  94           HE2      LYS  94 -35.771 -10.957 -11.232
   10    HE3  LYS  94           HE3      LYS  94 -34.335 -11.708 -10.536
   11    HZ3  LYS  94           HZ1      LYS  94 -36.164 -13.259 -10.659
   12    HZ2  LYS  94           HZ2      LYS  94 -37.141 -12.233  -9.719
   13    HZ1  LYS  94           HZ3      LYS  94 -35.761 -12.951  -9.038

  No H/Q in entry =          13
  In of MODEL   11
    1    H    ALA  95           H        ALA  95 -32.374  -6.331  -7.040
    2    HA   ALA  95           HA       ALA  95 -34.227  -4.756  -5.559
    3    HB2  ALA  95           HB1      ALA  95 -31.824  -6.088  -5.034
    4    HB3  ALA  95           HB2      ALA  95 -32.801  -5.179  -3.880
    5    HB1  ALA  95           HB3      ALA  95 -31.475  -4.386  -4.732

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA  96           H        ALA  96 -31.626  -3.897  -7.704
    2    HA   ALA  96           HA       ALA  96 -31.560  -1.122  -6.973
    3    HB2  ALA  96           HB1      ALA  96 -30.228  -0.909  -9.104
    4    HB3  ALA  96           HB2      ALA  96 -30.512  -2.625  -9.394
    5    HB1  ALA  96           HB3      ALA  96 -29.586  -2.110  -7.984

  No H/Q in entry =           5
  In of MODEL   11
    1    H    VAL  97           H        VAL  97 -33.102  -2.899  -9.613
    2    HA   VAL  97           HA       VAL  97 -34.221  -0.634 -10.889
    3    HB   VAL  97           HB       VAL  97 -34.990  -3.571 -10.877
    4   HG11  VAL  97          HG11      VAL  97 -36.816  -1.596 -11.368
    5   HG13  VAL  97          HG12      VAL  97 -36.863  -3.201 -12.100
    6   HG12  VAL  97          HG13      VAL  97 -36.140  -1.854 -12.977
    7   HG21  VAL  97          HG21      VAL  97 -33.763  -1.756 -12.956
    8   HG23  VAL  97          HG22      VAL  97 -34.196  -3.446 -13.213
    9   HG22  VAL  97          HG23      VAL  97 -32.937  -3.025 -12.051

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ALA  98           H        ALA  98 -35.340  -2.789  -8.304
    2    HA   ALA  98           HA       ALA  98 -37.911  -1.670  -7.936
    3    HB1  ALA  98           HB1      ALA  98 -36.855  -3.840  -6.884
    4    HB3  ALA  98           HB2      ALA  98 -38.035  -2.917  -5.951
    5    HB2  ALA  98           HB3      ALA  98 -36.312  -2.741  -5.617

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA  99           H        ALA  99 -34.821  -0.807  -6.342
    2    HA   ALA  99           HA       ALA  99 -35.954   1.187  -4.695
    3    HB1  ALA  99           HB1      ALA  99 -33.304   0.319  -5.464
    4    HB2  ALA  99           HB2      ALA  99 -33.843   1.085  -3.969
    5    HB3  ALA  99           HB3      ALA  99 -33.399   2.077  -5.358

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ILE 100           H        ILE 100 -34.960   1.281  -8.066
    2    HA   ILE 100           HA       ILE 100 -35.176   4.124  -8.323
    3    HB   ILE 100           HB       ILE 100 -35.274   1.936 -10.429
    4   HG12  ILE 100          HG12      ILE 100 -33.126   3.965  -9.817
    5   HG13  ILE 100          HG13      ILE 100 -33.134   2.327  -9.162
    6   HG21  ILE 100          HG21      ILE 100 -35.734   4.849 -10.596
    7   HG23  ILE 100          HG22      ILE 100 -36.239   3.559 -11.687
    8   HG22  ILE 100          HG23      ILE 100 -34.595   4.193 -11.773
    9   HD12  ILE 100          HD11      ILE 100 -32.650   3.250 -11.957
   10   HD11  ILE 100          HD12      ILE 100 -33.288   1.631 -11.670
   11   HD13  ILE 100          HD13      ILE 100 -31.737   2.104 -10.977

  No H/Q in entry =          11
  In of MODEL   11
    1    H    LYS 101           H        LYS 101 -37.447   1.478  -8.981
    2    HA   LYS 101           HA       LYS 101 -39.562   3.087  -9.976
    3    HB2  LYS 101           HB2      LYS 101 -39.397   0.330  -8.810
    4    HB3  LYS 101           HB3      LYS 101 -40.963   1.069  -9.146
    5    HG2  LYS 101           HG2      LYS 101 -40.521   1.176 -11.451
    6    HG3  LYS 101           HG3      LYS 101 -38.817   0.795 -11.214
    7    HD2  LYS 101           HD2      LYS 101 -40.056  -1.140 -12.056
    8    HD3  LYS 101           HD3      LYS 101 -39.403  -1.440 -10.445
    9    HE2  LYS 101           HE2      LYS 101 -41.451  -2.152  -9.901
   10    HE3  LYS 101           HE3      LYS 101 -41.928  -0.453  -9.922
   11    HZ3  LYS 101           HZ1      LYS 101 -42.846  -0.651 -12.025
   12    HZ2  LYS 101           HZ2      LYS 101 -43.280  -2.120 -11.290
   13    HZ1  LYS 101           HZ3      LYS 101 -41.988  -2.071 -12.392

  No H/Q in entry =          13
  In of MODEL   11
    1    H    LYS 102           H        LYS 102 -39.010   1.660  -6.753
    2    HA   LYS 102           HA       LYS 102 -41.255   2.847  -5.543
    3    HB2  LYS 102           HB2      LYS 102 -39.983   1.010  -4.518
    4    HB3  LYS 102           HB3      LYS 102 -38.602   2.084  -4.308
    5    HG2  LYS 102           HG2      LYS 102 -39.916   3.484  -2.813
    6    HG3  LYS 102           HG3      LYS 102 -41.300   2.413  -3.025
    7    HD2  LYS 102           HD2      LYS 102 -40.039   0.576  -1.990
    8    HD3  LYS 102           HD3      LYS 102 -38.655   1.649  -1.776
    9    HE2  LYS 102           HE2      LYS 102 -40.008   3.130  -0.369
   10    HE3  LYS 102           HE3      LYS 102 -41.410   2.088  -0.605
   11    HZ1  LYS 102           HZ1      LYS 102 -39.656   0.368   0.399
   12    HZ3  LYS 102           HZ2      LYS 102 -40.765   1.253   1.332
   13    HZ2  LYS 102           HZ3      LYS 102 -39.162   1.795   1.176

  No H/Q in entry =          13
  In of MODEL   11
    1    H    ALA 103           H        ALA 103 -38.332   4.259  -6.613
    2    HA   ALA 103           HA       ALA 103 -38.559   6.595  -4.861
    3    HB2  ALA 103           HB1      ALA 103 -36.597   7.331  -6.472
    4    HB3  ALA 103           HB2      ALA 103 -36.546   5.608  -6.848
    5    HB1  ALA 103           HB3      ALA 103 -36.304   6.157  -5.189

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA 104           H        ALA 104 -39.214   5.810  -8.188
    2    HA   ALA 104           HA       ALA 104 -39.841   8.579  -8.840
    3    HB2  ALA 104           HB1      ALA 104 -39.905   7.880 -11.032
    4    HB1  ALA 104           HB2      ALA 104 -40.608   6.315 -10.624
    5    HB3  ALA 104           HB3      ALA 104 -38.885   6.602 -10.371

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA 105           H        ALA 105 -41.400   6.481  -6.986
    2    HA   ALA 105           HA       ALA 105 -43.840   7.846  -6.946
    3    HB2  ALA 105           HB1      ALA 105 -44.602   6.950  -8.963
    4    HB3  ALA 105           HB2      ALA 105 -45.209   5.770  -7.803
    5    HB1  ALA 105           HB3      ALA 105 -43.747   5.426  -8.726

  No H/Q in entry =           5
  In of MODEL   12
    1    H1   ALA   1           H3       ALA   1 -12.324 -15.571  -2.399
    2    H2   ALA   1           H2       ALA   1 -11.389 -16.722  -3.233
    3    H3   ALA   1           H1       ALA   1 -12.521 -15.770  -4.073
    4    HA   ALA   1           HA       ALA   1 -13.935 -17.458  -3.836
    5    HB3  ALA   1           HB1      ALA   1 -12.555 -19.240  -3.365
    6    HB1  ALA   1           HB2      ALA   1 -13.317 -19.118  -1.779
    7    HB2  ALA   1           HB3      ALA   1 -11.734 -18.391  -2.055

  No H/Q in entry =           7
  In of MODEL   12
    1    H    GLU   2           H        GLU   2 -15.571 -18.296  -2.186
    2    HA   GLU   2           HA       GLU   2 -17.209 -16.560  -1.137
    3    HB2  GLU   2           HB2      GLU   2 -16.296 -18.990   0.416
    4    HB3  GLU   2           HB3      GLU   2 -17.814 -18.127   0.663
    5    HG2  GLU   2           HG2      GLU   2 -18.796 -19.208  -1.073
    6    HG3  GLU   2           HG3      GLU   2 -17.465 -18.821  -2.154

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLU   3           H        GLU   3 -15.318 -17.924   1.496
    2    HA   GLU   3           HA       GLU   3 -15.526 -15.566   3.048
    3    HB2  GLU   3           HB2      GLU   3 -13.963 -18.125   3.310
    4    HB3  GLU   3           HB3      GLU   3 -13.725 -16.805   4.455
    5    HG2  GLU   3           HG2      GLU   3 -15.922 -16.937   5.265
    6    HG3  GLU   3           HG3      GLU   3 -16.519 -17.735   3.815

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LEU   4           H        LEU   4 -12.578 -17.072   1.671
    2    HA   LEU   4           HA       LEU   4 -10.730 -15.183   2.273
    3    HB2  LEU   4           HB2      LEU   4 -10.961 -16.483  -0.450
    4    HB3  LEU   4           HB3      LEU   4  -9.506 -15.774   0.239
    5    HG   LEU   4           HG       LEU   4 -11.024 -18.156   1.351
    6   HD13  LEU   4          HD11      LEU   4  -9.400 -19.528   0.430
    7   HD12  LEU   4          HD12      LEU   4  -8.179 -18.255   0.406
    8   HD11  LEU   4          HD13      LEU   4  -9.463 -18.268  -0.802
    9   HD23  LEU   4          HD21      LEU   4  -8.779 -18.236   2.741
   10   HD22  LEU   4          HD22      LEU   4 -10.094 -17.185   3.263
   11   HD21  LEU   4          HD23      LEU   4  -8.722 -16.509   2.385

  No H/Q in entry =          11
  In of MODEL   12
    1    H    GLU   5           H        GLU   5 -13.053 -14.961  -0.410
    2    HA   GLU   5           HA       GLU   5 -12.025 -12.488  -1.412
    3    HB2  GLU   5           HB2      GLU   5 -13.376 -14.062  -2.779
    4    HB3  GLU   5           HB3      GLU   5 -14.778 -13.693  -1.773
    5    HG2  GLU   5           HG2      GLU   5 -14.644 -11.329  -2.416
    6    HG3  GLU   5           HG3      GLU   5 -13.208 -11.661  -3.385

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLU   6           H        GLU   6 -14.765 -13.339   0.671
    2    HA   GLU   6           HA       GLU   6 -15.648 -10.654   1.062
    3    HB2  GLU   6           HB2      GLU   6 -16.093 -13.187   2.657
    4    HB3  GLU   6           HB3      GLU   6 -16.880 -11.652   3.017
    5    HG2  GLU   6           HG2      GLU   6 -17.041 -13.050   0.334
    6    HG3  GLU   6           HG3      GLU   6 -18.272 -13.176   1.587

  No H/Q in entry =           6
  In of MODEL   12
    1    H    VAL   7           H        VAL   7 -13.366 -12.781   2.647
    2    HA   VAL   7           HA       VAL   7 -12.895 -11.206   4.973
    3    HB   VAL   7           HB       VAL   7 -11.203 -13.267   3.534
    4   HG11  VAL   7          HG11      VAL   7 -10.732 -11.733   6.097
    5   HG13  VAL   7          HG12      VAL   7  -9.629 -11.960   4.741
    6   HG12  VAL   7          HG13      VAL   7  -9.998 -13.311   5.812
    7   HG21  VAL   7          HG21      VAL   7 -13.464 -13.810   4.746
    8   HG23  VAL   7          HG22      VAL   7 -12.540 -13.541   6.225
    9   HG22  VAL   7          HG23      VAL   7 -12.054 -14.807   5.100

  No H/Q in entry =           9
  In of MODEL   12
    1    H    VAL   8           H        VAL   8 -11.372 -11.340   1.769
    2    HA   VAL   8           HA       VAL   8  -9.295  -9.484   2.267
    3    HB   VAL   8           HB       VAL   8 -10.754 -10.168  -0.296
    4   HG13  VAL   8          HG11      VAL   8  -9.799  -8.056  -0.733
    5   HG12  VAL   8          HG12      VAL   8  -8.557  -9.181  -1.283
    6   HG11  VAL   8          HG13      VAL   8  -8.392  -8.381   0.281
    7   HG22  VAL   8          HG21      VAL   8  -9.248 -11.896  -0.535
    8   HG21  VAL   8          HG22      VAL   8  -9.076 -11.744   1.211
    9   HG23  VAL   8          HG23      VAL   8  -7.917 -10.957   0.145

  No H/Q in entry =           9
  In of MODEL   12
    1    H    MET   9           H        MET   9 -12.632  -9.068   1.092
    2    HA   MET   9           HA       MET   9 -12.543  -6.292   0.653
    3    HB2  MET   9           HB2      MET   9 -14.774  -8.151   1.471
    4    HB3  MET   9           HB3      MET   9 -15.042  -6.419   1.261
    5    HG2  MET   9           HG2      MET   9 -14.209  -6.554  -1.047
    6    HG3  MET   9           HG3      MET   9 -13.897  -8.277  -0.842
    7    HE1  MET   9           HE1      MET   9 -16.176  -5.472  -0.499
    8    HE3  MET   9           HE2      MET   9 -17.405  -6.295   0.456
    9    HE2  MET   9           HE3      MET   9 -17.712  -5.939  -1.241

  No H/Q in entry =           9
  In of MODEL   12
    1    H    GLY  10           H        GLY  10 -13.234  -8.172   3.581
    2    HA3  GLY  10           HA2      GLY  10 -13.771  -5.980   5.293
    3    HA2  GLY  10           HA3      GLY  10 -13.223  -7.572   5.813

  No H/Q in entry =           3
  In of MODEL   12
    1    H    LEU  11           H        LEU  11 -10.773  -7.719   4.508
    2    HA   LEU  11           HA       LEU  11  -9.068  -6.296   6.269
    3    HB2  LEU  11           HB2      LEU  11  -8.522  -7.729   3.667
    4    HB3  LEU  11           HB3      LEU  11  -7.250  -7.033   4.669
    5    HG   LEU  11           HG       LEU  11  -9.273  -9.048   5.681
    6   HD13  LEU  11          HD11      LEU  11  -8.055 -10.297   4.125
    7   HD12  LEU  11          HD12      LEU  11  -7.128 -10.541   5.604
    8   HD11  LEU  11          HD13      LEU  11  -6.573  -9.382   4.396
    9   HD22  LEU  11          HD21      LEU  11  -8.420  -8.038   7.600
   10   HD21  LEU  11          HD22      LEU  11  -6.875  -7.650   6.842
   11   HD23  LEU  11          HD23      LEU  11  -7.217  -9.303   7.354

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  12           H        ILE  12  -9.951  -5.748   2.875
    2    HA   ILE  12           HA       ILE  12  -8.240  -3.533   2.451
    3    HB   ILE  12           HB       ILE  12 -10.894  -4.185   1.145
    4   HG12  ILE  12          HG12      ILE  12  -8.871  -5.853   1.082
    5   HG13  ILE  12          HG13      ILE  12  -9.722  -5.492  -0.406
    6   HG21  ILE  12          HG21      ILE  12  -8.644  -2.326   0.305
    7   HG23  ILE  12          HG22      ILE  12 -10.294  -1.860   0.703
    8   HG22  ILE  12          HG23      ILE  12  -9.963  -2.812  -0.716
    9   HD13  ILE  12          HD11      ILE  12  -7.982  -3.941  -1.061
   10   HD12  ILE  12          HD12      ILE  12  -7.219  -5.462  -0.600
   11   HD11  ILE  12          HD13      ILE  12  -7.194  -4.102   0.497

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  13           H        ILE  13 -11.608  -3.772   3.530
    2    HA   ILE  13           HA       ILE  13 -12.048  -0.981   3.792
    3    HB   ILE  13           HB       ILE  13 -13.276  -3.393   5.147
    4   HG12  ILE  13          HG12      ILE  13 -13.491  -2.831   2.611
    5   HG13  ILE  13          HG13      ILE  13 -14.921  -3.288   3.512
    6   HG21  ILE  13          HG21      ILE  13 -14.009  -0.467   5.389
    7   HG23  ILE  13          HG22      ILE  13 -13.671  -1.597   6.693
    8   HG22  ILE  13          HG23      ILE  13 -15.154  -1.756   5.753
    9   HD12  ILE  13          HD11      ILE  13 -15.001  -1.159   1.969
   10   HD11  ILE  13          HD12      ILE  13 -14.174  -0.408   3.321
   11   HD13  ILE  13          HD13      ILE  13 -15.756  -1.113   3.566

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ASN  14           H        ASN  14 -10.964  -3.475   6.077
    2    HA   ASN  14           HA       ASN  14 -10.762  -1.834   8.360
    3    HB2  ASN  14           HB2      ASN  14 -10.526  -4.443   8.044
    4    HB3  ASN  14           HB3      ASN  14  -8.814  -4.069   7.894
    5   HD21  ASN  14          HD21      ASN  14  -9.470  -5.584  10.070
    6   HD22  ASN  14          HD22      ASN  14  -9.442  -4.661  11.493

  No H/Q in entry =           6
  In of MODEL   12
    1    H    SER  15           H        SER  15  -8.355  -2.679   5.880
    2    HA   SER  15           HA       SER  15  -6.206  -1.198   6.959
    3    HB2  SER  15           HB2      SER  15  -5.178  -1.425   4.806
    4    HB3  SER  15           HB3      SER  15  -6.143  -2.879   5.030
    5    HG   SER  15           HG       SER  15  -6.658  -0.613   3.441

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLY  16           H        GLY  16  -8.792  -0.319   4.699
    2    HA3  GLY  16           HA2      GLY  16  -7.914   2.315   4.145
    3    HA2  GLY  16           HA3      GLY  16  -9.568   1.730   3.977

  No H/Q in entry =           3
  In of MODEL   12
    1    H    GLN  17           H        GLN  17 -10.127   1.014   6.626
    2    HA   GLN  17           HA       GLN  17 -10.824   3.525   7.758
    3    HB2  GLN  17           HB2      GLN  17 -12.084   1.471   8.253
    4    HB3  GLN  17           HB3      GLN  17 -10.681   0.808   9.090
    5    HG2  GLN  17           HG2      GLN  17 -10.760   2.603  10.736
    6    HG3  GLN  17           HG3      GLN  17 -12.077   3.384   9.863
    7   HE21  GLN  17          HE21      GLN  17 -12.387   2.566  12.591
    8   HE22  GLN  17          HE22      GLN  17 -13.514   1.296  12.640

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ALA  18           H        ALA  18  -8.211   1.230   8.394
    2    HA   ALA  18           HA       ALA  18  -7.117   2.444  10.667
    3    HB2  ALA  18           HB1      ALA  18  -6.514   0.222   9.307
    4    HB3  ALA  18           HB2      ALA  18  -5.351   1.001  10.381
    5    HB1  ALA  18           HB3      ALA  18  -5.265   1.275   8.640

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ARG  19           H        ARG  19  -6.327   2.956   7.221
    2    HA   ARG  19           HA       ARG  19  -4.420   4.994   7.653
    3    HB2  ARG  19           HB2      ARG  19  -4.743   3.850   5.459
    4    HB3  ARG  19           HB3      ARG  19  -6.281   4.699   5.273
    5    HG2  ARG  19           HG2      ARG  19  -5.141   6.864   5.342
    6    HG3  ARG  19           HG3      ARG  19  -3.597   6.071   5.655
    7    HD2  ARG  19           HD2      ARG  19  -3.709   6.657   3.310
    8    HD3  ARG  19           HD3      ARG  19  -3.804   4.898   3.459
    9    HE   ARG  19           HE       ARG  19  -6.432   5.821   3.437
   10   HH21  ARG  19          HH11      ARG  19  -7.618   5.979   1.514
   11   HH22  ARG  19          HH12      ARG  19  -6.789   6.049  -0.003
   12   HH11  ARG  19          HH21      ARG  19  -3.648   5.865   1.416
   13   HH12  ARG  19          HH22      ARG  19  -4.540   5.981  -0.058

  No H/Q in entry =          13
  In of MODEL   12
    1    H    SER  20           H        SER  20  -7.914   5.126   7.037
    2    HA   SER  20           HA       SER  20  -8.257   7.883   6.981
    3    HB2  SER  20           HB2      SER  20 -10.139   6.551   6.439
    4    HB3  SER  20           HB3      SER  20 -10.042   5.660   7.955
    5    HG   SER  20           HG       SER  20 -10.552   7.633   9.023

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU  21           H        LEU  21  -8.281   5.707   9.790
    2    HA   LEU  21           HA       LEU  21  -8.721   7.709  11.748
    3    HB2  LEU  21           HB2      LEU  21  -7.378   5.004  11.924
    4    HB3  LEU  21           HB3      LEU  21  -7.698   6.025  13.322
    5    HG   LEU  21           HG       LEU  21  -9.851   5.124  11.385
    6   HD12  LEU  21          HD11      LEU  21 -10.473   3.498  13.170
    7   HD11  LEU  21          HD12      LEU  21  -9.011   3.944  14.050
    8   HD13  LEU  21          HD13      LEU  21  -8.887   3.162  12.473
    9   HD23  LEU  21          HD21      LEU  21 -11.207   5.633  13.601
   10   HD22  LEU  21          HD22      LEU  21 -10.754   6.970  12.548
   11   HD21  LEU  21          HD23      LEU  21  -9.818   6.641  13.999

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ALA  22           H        ALA  22  -5.768   6.319  10.358
    2    HA   ALA  22           HA       ALA  22  -3.891   7.628  11.985
    3    HB2  ALA  22           HB1      ALA  22  -3.475   5.768  10.300
    4    HB1  ALA  22           HB2      ALA  22  -2.273   7.059  10.338
    5    HB3  ALA  22           HB3      ALA  22  -3.485   7.018   9.057

  No H/Q in entry =           5
  In of MODEL   12
    1    H    TYR  23           H        TYR  23  -5.188   8.643   8.794
    2    HA   TYR  23           HA       TYR  23  -3.841  11.133   8.724
    3    HB2  TYR  23           HB2      TYR  23  -4.915  10.223   6.729
    4    HB3  TYR  23           HB3      TYR  23  -6.497  10.336   7.503
    5    HD1  TYR  23           HD1      TYR  23  -3.581  12.373   6.373
    6    HD2  TYR  23           HD2      TYR  23  -7.734  12.346   7.465
    7    HE1  TYR  23           HE1      TYR  23  -3.796  14.722   5.608
    8    HE2  TYR  23           HE2      TYR  23  -7.950  14.695   6.699
    9    HH   TYR  23           HH       TYR  23  -6.127  16.722   6.450

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ALA  24           H        ALA  24  -6.971  10.173  10.091
    2    HA   ALA  24           HA       ALA  24  -7.800  12.768  10.852
    3    HB1  ALA  24           HB1      ALA  24  -9.626  11.526  11.314
    4    HB2  ALA  24           HB2      ALA  24  -8.810  10.954  12.767
    5    HB3  ALA  24           HB3      ALA  24  -8.681  10.038  11.266

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA  25           H        ALA  25  -5.816  10.305  12.442
    2    HA   ALA  25           HA       ALA  25  -5.485  11.562  14.942
    3    HB2  ALA  25           HB1      ALA  25  -4.724   9.205  14.131
    4    HB3  ALA  25           HB2      ALA  25  -3.711  10.061  15.294
    5    HB1  ALA  25           HB3      ALA  25  -3.267  10.038  13.587

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU  26           H        LEU  26  -3.678  11.846  11.910
    2    HA   LEU  26           HA       LEU  26  -1.716  13.659  12.831
    3    HB2  LEU  26           HB2      LEU  26  -1.410  12.501  10.732
    4    HB3  LEU  26           HB3      LEU  26  -2.877  13.214  10.068
    5    HG   LEU  26           HG       LEU  26  -1.853  15.460  10.203
    6   HD12  LEU  26          HD11      LEU  26   0.684  15.470  10.629
    7   HD11  LEU  26          HD12      LEU  26   0.450  13.892  11.376
    8   HD13  LEU  26          HD13      LEU  26  -0.355  15.312  12.045
    9   HD21  LEU  26          HD21      LEU  26  -0.112  13.395   8.822
   10   HD23  LEU  26          HD22      LEU  26  -0.146  15.115   8.447
   11   HD22  LEU  26          HD23      LEU  26  -1.572  14.123   8.154

  No H/Q in entry =          11
  In of MODEL   12
    1    H    LYS  27           H        LYS  27  -4.889  14.153  11.337
    2    HA   LYS  27           HA       LYS  27  -4.820  16.941  11.133
    3    HB2  LYS  27           HB2      LYS  27  -6.566  15.469  10.142
    4    HB3  LYS  27           HB3      LYS  27  -7.232  15.220  11.756
    5    HG2  LYS  27           HG2      LYS  27  -7.651  17.628  11.984
    6    HG3  LYS  27           HG3      LYS  27  -6.934  17.918  10.396
    7    HD2  LYS  27           HD2      LYS  27  -8.668  16.490   9.355
    8    HD3  LYS  27           HD3      LYS  27  -9.391  16.217  10.942
    9    HE2  LYS  27           HE2      LYS  27  -9.823  18.631  11.177
   10    HE3  LYS  27           HE3      LYS  27  -9.072  18.925   9.605
   11    HZ3  LYS  27           HZ1      LYS  27 -11.449  18.811   9.352
   12    HZ2  LYS  27           HZ2      LYS  27 -11.508  17.297  10.125
   13    HZ1  LYS  27           HZ3      LYS  27 -10.755  17.453   8.607

  No H/Q in entry =          13
  In of MODEL   12
    1    H    GLN  28           H        GLN  28  -5.732  14.866  13.860
    2    HA   GLN  28           HA       GLN  28  -6.625  16.878  15.628
    3    HB2  GLN  28           HB2      GLN  28  -5.243  14.238  16.178
    4    HB3  GLN  28           HB3      GLN  28  -5.975  15.251  17.424
    5    HG2  GLN  28           HG2      GLN  28  -7.448  14.144  15.017
    6    HG3  GLN  28           HG3      GLN  28  -7.508  13.450  16.637
    7   HE21  GLN  28          HE21      GLN  28  -9.375  15.267  14.682
    8   HE22  GLN  28          HE22      GLN  28 -10.111  16.291  15.818

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ALA  29           H        ALA  29  -3.410  15.562  14.957
    2    HA   ALA  29           HA       ALA  29  -1.974  16.957  16.938
    3    HB1  ALA  29           HB1      ALA  29  -0.042  16.252  15.830
    4    HB3  ALA  29           HB2      ALA  29  -0.788  16.377  14.237
    5    HB2  ALA  29           HB3      ALA  29  -1.223  15.049  15.313

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LYS  30           H        LYS  30  -2.810  17.833  13.603
    2    HA   LYS  30           HA       LYS  30  -1.383  20.263  13.503
    3    HB2  LYS  30           HB2      LYS  30  -3.913  19.404  12.085
    4    HB3  LYS  30           HB3      LYS  30  -3.067  20.912  11.741
    5    HG2  LYS  30           HG2      LYS  30  -1.004  19.603  11.240
    6    HG3  LYS  30           HG3      LYS  30  -1.923  18.114  11.484
    7    HD2  LYS  30           HD2      LYS  30  -3.474  18.762   9.681
    8    HD3  LYS  30           HD3      LYS  30  -2.578  20.263   9.439
    9    HE2  LYS  30           HE2      LYS  30  -0.553  18.953   8.872
   10    HE3  LYS  30           HE3      LYS  30  -1.468  17.458   9.083
   11    HZ2  LYS  30           HZ1      LYS  30  -1.274  18.322   6.740
   12    HZ1  LYS  30           HZ2      LYS  30  -2.310  19.594   7.200
   13    HZ3  LYS  30           HZ3      LYS  30  -2.848  17.981   7.273

  No H/Q in entry =          13
  In of MODEL   12
    1    H    GLN  31           H        GLN  31  -4.496  19.440  14.904
    2    HA   GLN  31           HA       GLN  31  -5.238  22.203  15.346
    3    HB2  GLN  31           HB2      GLN  31  -6.444  19.770  16.669
    4    HB3  GLN  31           HB3      GLN  31  -7.190  21.348  16.416
    5    HG2  GLN  31           HG2      GLN  31  -6.475  20.559  13.832
    6    HG3  GLN  31           HG3      GLN  31  -7.016  19.061  14.579
    7   HE21  GLN  31          HE21      GLN  31  -8.403  20.642  12.468
    8   HE22  GLN  31          HE22      GLN  31  -9.916  21.048  13.119

  No H/Q in entry =           8
  In of MODEL   12
    1    H    GLY  32           H        GLY  32  -2.949  20.259  16.680
    2    HA3  GLY  32           HA2      GLY  32  -1.552  20.712  18.488
    3    HA2  GLY  32           HA3      GLY  32  -2.673  21.966  19.004

  No H/Q in entry =           3
  In of MODEL   12
    1    H    ASP  33           H        ASP  33  -4.119  18.938  18.342
    2    HA   ASP  33           HA       ASP  33  -4.547  18.490  21.221
    3    HB2  ASP  33           HB2      ASP  33  -5.951  17.486  18.739
    4    HB3  ASP  33           HB3      ASP  33  -6.309  16.882  20.355

  No H/Q in entry =           4
  In of MODEL   12
    1    H    PHE  34           H        PHE  34  -2.387  17.620  21.537
    2    HA   PHE  34           HA       PHE  34  -1.402  15.359  20.145
    3    HB2  PHE  34           HB2      PHE  34  -0.788  16.343  22.940
    4    HB3  PHE  34           HB3      PHE  34   0.134  15.110  22.079
    5    HD1  PHE  34           HD1      PHE  34  -0.010  18.538  22.807
    6    HD2  PHE  34           HD2      PHE  34   0.809  15.822  19.581
    7    HE1  PHE  34           HE1      PHE  34   1.306  20.296  21.655
    8    HE2  PHE  34           HE2      PHE  34   2.120  17.582  18.434
    9    HZ   PHE  34           HZ       PHE  34   2.371  19.816  19.476

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ALA  35           H        ALA  35  -3.451  15.660  22.999
    2    HA   ALA  35           HA       ALA  35  -3.267  12.998  23.901
    3    HB3  ALA  35           HB1      ALA  35  -5.723  13.648  24.747
    4    HB1  ALA  35           HB2      ALA  35  -5.173  15.261  24.290
    5    HB2  ALA  35           HB3      ALA  35  -4.272  14.330  25.487

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA  36           H        ALA  36  -5.694  14.533  21.788
    2    HA   ALA  36           HA       ALA  36  -7.130  12.134  21.309
    3    HB1  ALA  36           HB1      ALA  36  -8.568  13.568  20.344
    4    HB3  ALA  36           HB2      ALA  36  -7.387  13.976  19.099
    5    HB2  ALA  36           HB3      ALA  36  -7.409  14.866  20.621

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA  37           H        ALA  37  -4.428  13.694  19.648
    2    HA   ALA  37           HA       ALA  37  -4.398  12.054  17.354
    3    HB3  ALA  37           HB1      ALA  37  -2.396  13.750  18.782
    4    HB2  ALA  37           HB2      ALA  37  -2.919  13.808  17.100
    5    HB1  ALA  37           HB3      ALA  37  -1.779  12.568  17.628

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LYS  38           H        LYS  38  -2.657  11.737  20.440
    2    HA   LYS  38           HA       LYS  38  -1.352   9.324  19.961
    3    HB2  LYS  38           HB2      LYS  38  -1.668  11.093  22.102
    4    HB3  LYS  38           HB3      LYS  38  -2.303   9.571  22.718
    5    HG2  LYS  38           HG2      LYS  38  -0.217   8.430  22.193
    6    HG3  LYS  38           HG3      LYS  38   0.408   9.868  21.379
    7    HD2  LYS  38           HD2      LYS  38   0.580  11.089  23.413
    8    HD3  LYS  38           HD3      LYS  38  -0.453   9.949  24.277
    9    HE2  LYS  38           HE2      LYS  38   1.896   9.613  24.907
   10    HE3  LYS  38           HE3      LYS  38   1.283   8.201  24.043
   11    HZ3  LYS  38           HZ1      LYS  38   2.594   8.604  22.267
   12    HZ2  LYS  38           HZ2      LYS  38   3.552   9.426  23.406
   13    HZ1  LYS  38           HZ3      LYS  38   2.485  10.294  22.408

  No H/Q in entry =          13
  In of MODEL   12
    1    H    ALA  39           H        ALA  39  -4.592   9.851  21.349
    2    HA   ALA  39           HA       ALA  39  -5.179   7.138  21.856
    3    HB3  ALA  39           HB1      ALA  39  -7.316   9.101  21.076
    4    HB2  ALA  39           HB2      ALA  39  -6.423   9.322  22.581
    5    HB1  ALA  39           HB3      ALA  39  -7.352   7.846  22.316

  No H/Q in entry =           5
  In of MODEL   12
    1    H    MET  40           H        MET  40  -5.733   9.152  19.003
    2    HA   MET  40           HA       MET  40  -7.221   7.231  17.540
    3    HB2  MET  40           HB2      MET  40  -5.586   9.610  16.638
    4    HB3  MET  40           HB3      MET  40  -6.616   8.658  15.565
    5    HG2  MET  40           HG2      MET  40  -7.650   9.921  18.117
    6    HG3  MET  40           HG3      MET  40  -7.693  10.753  16.564
    7    HE3  MET  40           HE1      MET  40 -10.282   9.154  14.492
    8    HE2  MET  40           HE2      MET  40  -8.528   9.255  14.351
    9    HE1  MET  40           HE3      MET  40  -9.436  10.630  14.978

  No H/Q in entry =           9
  In of MODEL   12
    1    H    MET  41           H        MET  41  -3.724   7.937  17.676
    2    HA   MET  41           HA       MET  41  -2.972   6.172  15.582
    3    HB2  MET  41           HB2      MET  41  -1.360   6.829  18.061
    4    HB3  MET  41           HB3      MET  41  -0.742   6.173  16.549
    5    HG2  MET  41           HG2      MET  41  -1.875   8.364  15.536
    6    HG3  MET  41           HG3      MET  41  -1.641   8.952  17.181
    7    HE2  MET  41           HE1      MET  41   1.257   6.830  17.558
    8    HE1  MET  41           HE2      MET  41   0.476   8.132  18.451
    9    HE3  MET  41           HE3      MET  41   2.104   8.360  17.815

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ASP  42           H        ASP  42  -3.376   5.708  19.067
    2    HA   ASP  42           HA       ASP  42  -2.363   3.106  19.236
    3    HB2  ASP  42           HB2      ASP  42  -3.230   4.876  21.051
    4    HB3  ASP  42           HB3      ASP  42  -4.665   3.863  20.974

  No H/Q in entry =           4
  In of MODEL   12
    1    H    GLN  43           H        GLN  43  -5.685   4.237  18.719
    2    HA   GLN  43           HA       GLN  43  -6.849   1.659  18.523
    3    HB2  GLN  43           HB2      GLN  43  -7.745   4.317  17.386
    4    HB3  GLN  43           HB3      GLN  43  -8.720   2.846  17.362
    5    HG2  GLN  43           HG2      GLN  43  -8.439   2.727  19.871
    6    HG3  GLN  43           HG3      GLN  43  -7.701   4.325  19.800
    7   HE21  GLN  43          HE21      GLN  43  -9.886   4.426  21.291
    8   HE22  GLN  43          HE22      GLN  43 -11.238   5.012  20.452

  No H/Q in entry =           8
  In of MODEL   12
    1    H    SER  44           H        SER  44  -5.480   3.858  16.114
    2    HA   SER  44           HA       SER  44  -6.183   2.376  13.824
    3    HB2  SER  44           HB2      SER  44  -4.909   4.750  14.270
    4    HB3  SER  44           HB3      SER  44  -3.561   3.741  13.747
    5    HG   SER  44           HG       SER  44  -4.657   4.720  11.978

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ARG  45           H        ARG  45  -3.316   2.242  15.917
    2    HA   ARG  45           HA       ARG  45  -1.846   0.273  14.545
    3    HB2  ARG  45           HB2      ARG  45  -1.001   1.690  16.415
    4    HB3  ARG  45           HB3      ARG  45  -2.005   0.770  17.532
    5    HG2  ARG  45           HG2      ARG  45  -0.788  -1.300  16.899
    6    HG3  ARG  45           HG3      ARG  45   0.240  -0.355  15.823
    7    HD2  ARG  45           HD2      ARG  45   0.978   1.022  17.780
    8    HD3  ARG  45           HD3      ARG  45   0.041  -0.043  18.851
    9    HE   ARG  45           HE       ARG  45   1.734  -1.656  17.281
   10   HH21  ARG  45          HH11      ARG  45   3.624  -2.493  18.128
   11   HH22  ARG  45          HH12      ARG  45   4.397  -1.712  19.461
   12   HH11  ARG  45          HH21      ARG  45   2.047   0.812  19.668
   13   HH12  ARG  45          HH22      ARG  45   3.504   0.162  20.331

  No H/Q in entry =          13
  In of MODEL   12
    1    H    MET  46           H        MET  46  -4.258  -0.023  17.134
    2    HA   MET  46           HA       MET  46  -4.116  -2.823  17.446
    3    HB2  MET  46           HB2      MET  46  -6.285  -0.807  18.026
    4    HB3  MET  46           HB3      MET  46  -6.482  -2.523  18.387
    5    HG2  MET  46           HG2      MET  46  -4.452  -2.474  19.779
    6    HG3  MET  46           HG3      MET  46  -4.227  -0.772  19.409
    7    HE1  MET  46           HE1      MET  46  -3.866  -1.105  21.854
    8    HE3  MET  46           HE2      MET  46  -5.104  -1.005  23.103
    9    HE2  MET  46           HE3      MET  46  -4.702   0.424  22.157

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ALA  47           H        ALA  47  -6.109  -0.792  15.339
    2    HA   ALA  47           HA       ALA  47  -7.740  -2.829  14.269
    3    HB3  ALA  47           HB1      ALA  47  -8.398  -0.587  13.847
    4    HB1  ALA  47           HB2      ALA  47  -7.907  -1.227  12.278
    5    HB2  ALA  47           HB3      ALA  47  -6.821  -0.167  13.179

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU  48           H        LEU  48  -4.604  -1.551  13.231
    2    HA   LEU  48           HA       LEU  48  -4.327  -3.147  10.893
    3    HB2  LEU  48           HB2      LEU  48  -2.267  -1.885  12.709
    4    HB3  LEU  48           HB3      LEU  48  -1.897  -2.611  11.145
    5    HG   LEU  48           HG       LEU  48  -3.901  -0.374  11.522
    6   HD13  LEU  48          HD11      LEU  48  -1.774   0.482  12.197
    7   HD12  LEU  48          HD12      LEU  48  -2.036   1.036  10.543
    8   HD11  LEU  48          HD13      LEU  48  -0.953  -0.320  10.858
    9   HD22  LEU  48          HD21      LEU  48  -4.372  -1.357   9.445
   10   HD21  LEU  48          HD22      LEU  48  -2.692  -1.809   9.159
   11   HD23  LEU  48          HD23      LEU  48  -3.194  -0.125   8.995

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ASN  49           H        ASN  49  -3.301  -3.549  14.245
    2    HA   ASN  49           HA       ASN  49  -1.720  -5.829  13.925
    3    HB2  ASN  49           HB2      ASN  49  -1.726  -4.506  15.971
    4    HB3  ASN  49           HB3      ASN  49  -3.401  -4.937  16.283
    5   HD21  ASN  49          HD21      ASN  49  -0.145  -6.381  15.961
    6   HD22  ASN  49          HD22      ASN  49  -0.459  -7.695  16.989

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLU  50           H        GLU  50  -5.188  -5.517  14.579
    2    HA   GLU  50           HA       GLU  50  -5.730  -8.311  14.689
    3    HB2  GLU  50           HB2      GLU  50  -7.303  -6.607  15.555
    4    HB3  GLU  50           HB3      GLU  50  -7.582  -6.041  13.907
    5    HG2  GLU  50           HG2      GLU  50  -8.467  -8.229  13.267
    6    HG3  GLU  50           HG3      GLU  50  -8.100  -8.874  14.863

  No H/Q in entry =           6
  In of MODEL   12
    1    H    ALA  51           H        ALA  51  -5.760  -5.916  12.090
    2    HA   ALA  51           HA       ALA  51  -6.754  -7.635  10.065
    3    HB2  ALA  51           HB1      ALA  51  -6.508  -5.827   8.695
    4    HB1  ALA  51           HB2      ALA  51  -4.868  -5.495   9.251
    5    HB3  ALA  51           HB3      ALA  51  -6.250  -4.968  10.212

  No H/Q in entry =           5
  In of MODEL   12
    1    H    HIS  52           H        HIS  52  -3.459  -6.763  11.064
    2    HA   HIS  52           HA       HIS  52  -2.067  -8.270   9.123
    3    HB2  HIS  52           HB2      HIS  52  -1.042  -6.538  10.592
    4    HB3  HIS  52           HB3      HIS  52  -1.191  -7.648  11.954
    5    HD1  HIS  52           HD1      HIS  52   0.258  -9.854  11.857
    6    HD2  HIS  52           HD2      HIS  52   1.086  -7.103   8.836
    7    HE1  HIS  52           HE1      HIS  52   2.455 -10.567  10.822
    8    HE2  HIS  52           HE2      HIS  52   2.973  -8.901   8.978

  No H/Q in entry =           8
  In of MODEL   12
    1    H    LEU  53           H        LEU  53  -3.304  -9.130  12.331
    2    HA   LEU  53           HA       LEU  53  -2.137 -11.688  12.533
    3    HB2  LEU  53           HB2      LEU  53  -4.613 -10.474  13.734
    4    HB3  LEU  53           HB3      LEU  53  -4.178 -12.156  14.029
    5    HG   LEU  53           HG       LEU  53  -2.240  -9.871  14.509
    6   HD13  LEU  53          HD11      LEU  53  -4.035  -9.396  15.993
    7   HD12  LEU  53          HD12      LEU  53  -2.870 -10.299  16.961
    8   HD11  LEU  53          HD13      LEU  53  -4.306 -11.101  16.335
    9   HD23  LEU  53          HD21      LEU  53  -1.401 -11.680  16.206
   10   HD22  LEU  53          HD22      LEU  53  -1.011 -11.882  14.502
   11   HD21  LEU  53          HD23      LEU  53  -2.314 -12.813  15.217

  No H/Q in entry =          11
  In of MODEL   12
    1    H    VAL  54           H        VAL  54  -5.229 -10.623  11.154
    2    HA   VAL  54           HA       VAL  54  -6.170 -13.207  10.466
    3    HB   VAL  54           HB       VAL  54  -6.779 -10.468   9.325
    4   HG12  VAL  54          HG11      VAL  54  -8.893 -11.822   8.504
    5   HG11  VAL  54          HG12      VAL  54  -7.798 -13.201   8.583
    6   HG13  VAL  54          HG13      VAL  54  -7.417 -11.832   7.542
    7   HG22  VAL  54          HG21      VAL  54  -7.697 -10.493  11.472
    8   HG21  VAL  54          HG22      VAL  54  -7.972 -12.233  11.453
    9   HG23  VAL  54          HG23      VAL  54  -9.035 -11.164  10.540

  No H/Q in entry =           9
  In of MODEL   12
    1    H    GLN  55           H        GLN  55  -4.260 -10.781   8.683
    2    HA   GLN  55           HA       GLN  55  -4.136 -12.250   6.268
    3    HB2  GLN  55           HB2      GLN  55  -3.503  -9.993   6.078
    4    HB3  GLN  55           HB3      GLN  55  -2.401 -10.081   7.449
    5    HG2  GLN  55           HG2      GLN  55  -0.687 -10.950   6.182
    6    HG3  GLN  55           HG3      GLN  55  -1.768 -11.913   5.184
    7   HE21  GLN  55          HE21      GLN  55  -1.766 -11.225   3.062
    8   HE22  GLN  55          HE22      GLN  55  -1.546  -9.624   2.551

  No H/Q in entry =           8
  In of MODEL   12
    1    H    THR  56           H        THR  56  -2.044 -12.251   9.159
    2    HA   THR  56           HA       THR  56   0.018 -13.877   8.254
    3    HB   THR  56           HB       THR  56  -1.238 -14.117  10.996
    4    HG1  THR  56           HG1      THR  56   0.537 -12.190   9.920
    5   HG21  THR  56          HG21      THR  56   0.688 -15.647  10.102
    6   HG23  THR  56          HG22      THR  56   0.845 -14.915  11.698
    7   HG22  THR  56          HG23      THR  56   1.688 -14.212  10.318

  No H/Q in entry =           7
  In of MODEL   12
    1    H    LYS  57           H        LYS  57  -3.121 -14.872   9.603
    2    HA   LYS  57           HA       LYS  57  -2.709 -17.674   9.363
    3    HB2  LYS  57           HB2      LYS  57  -4.521 -16.553  10.696
    4    HB3  LYS  57           HB3      LYS  57  -5.301 -16.105   9.187
    5    HG2  LYS  57           HG2      LYS  57  -5.584 -18.457   8.590
    6    HG3  LYS  57           HG3      LYS  57  -4.728 -18.954  10.047
    7    HD2  LYS  57           HD2      LYS  57  -6.489 -17.898  11.435
    8    HD3  LYS  57           HD3      LYS  57  -7.356 -17.432   9.973
    9    HE2  LYS  57           HE2      LYS  57  -7.597 -19.808   9.345
   10    HE3  LYS  57           HE3      LYS  57  -6.709 -20.297  10.785
   11    HZ3  LYS  57           HZ1      LYS  57  -8.666 -20.336  11.795
   12    HZ2  LYS  57           HZ2      LYS  57  -9.445 -19.543  10.508
   13    HZ1  LYS  57           HZ3      LYS  57  -8.665 -18.639  11.718

  No H/Q in entry =          13
  In of MODEL   12
    1    H    LEU  58           H        LEU  58  -3.999 -15.217   7.177
    2    HA   LEU  58           HA       LEU  58  -4.814 -17.035   5.169
    3    HB2  LEU  58           HB2      LEU  58  -4.169 -14.094   5.033
    4    HB3  LEU  58           HB3      LEU  58  -4.838 -15.024   3.691
    5    HG   LEU  58           HG       LEU  58  -6.129 -14.825   6.432
    6   HD11  LEU  58          HD11      LEU  58  -6.395 -13.177   3.937
    7   HD13  LEU  58          HD12      LEU  58  -6.387 -12.668   5.625
    8   HD12  LEU  58          HD13      LEU  58  -7.817 -13.443   4.947
    9   HD22  LEU  58          HD21      LEU  58  -7.112 -16.722   5.560
   10   HD21  LEU  58          HD22      LEU  58  -6.758 -16.277   3.890
   11   HD23  LEU  58          HD23      LEU  58  -8.116 -15.533   4.733

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  59           H        ILE  59  -1.668 -15.863   6.045
    2    HA   ILE  59           HA       ILE  59  -0.566 -16.608   3.415
    3    HB   ILE  59           HB       ILE  59   0.221 -14.551   4.988
    4   HG12  ILE  59          HG12      ILE  59   2.286 -16.232   3.552
    5   HG13  ILE  59          HG13      ILE  59   1.114 -15.257   2.704
    6   HG23  ILE  59          HG21      ILE  59   2.052 -15.059   6.387
    7   HG22  ILE  59          HG22      ILE  59   2.285 -16.642   5.680
    8   HG21  ILE  59          HG23      ILE  59   0.923 -16.340   6.757
    9   HD12  ILE  59          HD11      ILE  59   3.136 -14.257   4.707
   10   HD11  ILE  59          HD12      ILE  59   1.899 -13.251   3.955
   11   HD13  ILE  59          HD13      ILE  59   3.171 -13.973   2.968

  No H/Q in entry =          11
  In of MODEL   12
    1    H    GLU  60           H        GLU  60  -0.608 -17.709   6.784
    2    HA   GLU  60           HA       GLU  60   1.398 -19.714   6.533
    3    HB2  GLU  60           HB2      GLU  60   0.656 -18.935   8.720
    4    HB3  GLU  60           HB3      GLU  60  -0.975 -19.528   8.408
    5    HG2  GLU  60           HG2      GLU  60  -0.112 -21.838   8.266
    6    HG3  GLU  60           HG3      GLU  60   1.521 -21.247   8.565

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLY  61           H        GLY  61  -2.111 -19.767   6.028
    2    HA3  GLY  61           HA2      GLY  61  -1.894 -22.564   5.075
    3    HA2  GLY  61           HA3      GLY  61  -3.373 -21.808   5.659

  No H/Q in entry =           3
  In of MODEL   12
    1    H    ASP  62           H        ASP  62  -1.115 -20.255   3.469
    2    HA   ASP  62           HA       ASP  62  -3.204 -19.778   1.546
    3    HB2  ASP  62           HB2      ASP  62  -1.384 -18.592   0.319
    4    HB3  ASP  62           HB3      ASP  62  -1.572 -18.047   1.983

  No H/Q in entry =           4
  In of MODEL   12
    1    H    ALA  63           H        ALA  63  -1.404 -22.503   2.067
    2    HA   ALA  63           HA       ALA  63  -0.355 -23.270  -0.413
    3    HB1  ALA  63           HB1      ALA  63  -1.733 -25.009   1.632
    4    HB2  ALA  63           HB2      ALA  63  -0.026 -24.571   1.622
    5    HB3  ALA  63           HB3      ALA  63  -0.684 -25.579   0.333

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLY  64           H        GLY  64  -3.634 -23.712   0.895
    2    HA3  GLY  64           HA2      GLY  64  -5.644 -24.191  -0.097
    3    HA2  GLY  64           HA3      GLY  64  -5.050 -23.245  -1.452

  No H/Q in entry =           3
  In of MODEL   12
    1    H    GLU  65           H        GLU  65  -5.100 -24.318  -3.341
    2    HA   GLU  65           HA       GLU  65  -5.756 -26.990  -3.621
    3    HB2  GLU  65           HB2      GLU  65  -4.272 -25.171  -5.514
    4    HB3  GLU  65           HB3      GLU  65  -4.866 -26.772  -5.957
    5    HG2  GLU  65           HG2      GLU  65  -7.154 -26.118  -5.410
    6    HG3  GLU  65           HG3      GLU  65  -6.596 -24.542  -4.856

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLY  66           H        GLY  66  -4.292 -28.403  -5.135
    2    HA3  GLY  66           HA2      GLY  66  -2.322 -29.605  -3.528
    3    HA2  GLY  66           HA3      GLY  66  -2.653 -29.979  -5.207

  No H/Q in entry =           3
  In of MODEL   12
    1    H    LYS  67           H        LYS  67  -2.054 -27.413  -6.259
    2    HA   LYS  67           HA       LYS  67   0.784 -27.686  -6.517
    3    HB2  LYS  67           HB2      LYS  67  -1.209 -25.788  -7.747
    4    HB3  LYS  67           HB3      LYS  67   0.508 -25.820  -8.166
    5    HG2  LYS  67           HG2      LYS  67   0.333 -28.200  -8.770
    6    HG3  LYS  67           HG3      LYS  67  -1.375 -28.192  -8.333
    7    HD2  LYS  67           HD2      LYS  67  -1.824 -26.525 -10.092
    8    HD3  LYS  67           HD3      LYS  67  -0.113 -26.524 -10.528
    9    HE2  LYS  67           HE2      LYS  67  -0.247 -28.939 -11.049
   10    HE3  LYS  67           HE3      LYS  67  -1.961 -28.927 -10.637
   11    HZ2  LYS  67           HZ1      LYS  67  -0.707 -28.169 -13.057
   12    HZ1  LYS  67           HZ2      LYS  67  -1.583 -26.858 -12.425
   13    HZ3  LYS  67           HZ3      LYS  67  -2.360 -28.340 -12.718

  No H/Q in entry =          13
  In of MODEL   12
    1    H    MET  68           H        MET  68   2.366 -26.144  -6.266
    2    HA   MET  68           HA       MET  68   2.592 -24.927  -3.803
    3    HB2  MET  68           HB2      MET  68   4.024 -24.372  -6.398
    4    HB3  MET  68           HB3      MET  68   4.516 -23.687  -4.848
    5    HG2  MET  68           HG2      MET  68   4.749 -25.958  -3.915
    6    HG3  MET  68           HG3      MET  68   4.258 -26.646  -5.463
    7    HE1  MET  68           HE1      MET  68   6.164 -28.078  -5.752
    8    HE3  MET  68           HE2      MET  68   6.939 -27.635  -4.232
    9    HE2  MET  68           HE3      MET  68   7.876 -27.634  -5.724

  No H/Q in entry =           9
  In of MODEL   12
    1    H    LYS  69           H        LYS  69   0.671 -23.786  -6.329
    2    HA   LYS  69           HA       LYS  69   1.054 -21.008  -6.121
    3    HB2  LYS  69           HB2      LYS  69  -0.067 -22.071  -8.021
    4    HB3  LYS  69           HB3      LYS  69  -1.458 -22.420  -6.987
    5    HG2  LYS  69           HG2      LYS  69  -1.773 -20.044  -6.537
    6    HG3  LYS  69           HG3      LYS  69  -0.330 -19.650  -7.472
    7    HD2  LYS  69           HD2      LYS  69  -1.390 -20.588  -9.498
    8    HD3  LYS  69           HD3      LYS  69  -2.838 -20.959  -8.562
    9    HE2  LYS  69           HE2      LYS  69  -3.112 -18.564  -8.030
   10    HE3  LYS  69           HE3      LYS  69  -1.665 -18.191  -8.963
   11    HZ2  LYS  69           HZ1      LYS  69  -4.218 -18.315  -9.922
   12    HZ1  LYS  69           HZ2      LYS  69  -3.521 -19.773 -10.444
   13    HZ3  LYS  69           HZ3      LYS  69  -2.800 -18.290 -10.852

  No H/Q in entry =          13
  In of MODEL   12
    1    H    VAL  70           H        VAL  70  -0.113 -19.335  -5.173
    2    HA   VAL  70           HA       VAL  70  -1.679 -20.087  -2.766
    3    HB   VAL  70           HB       VAL  70  -0.892 -17.933  -1.808
    4   HG11  VAL  70          HG11      VAL  70   1.064 -20.027  -2.712
    5   HG13  VAL  70          HG12      VAL  70   0.438 -19.714  -1.092
    6   HG12  VAL  70          HG13      VAL  70   1.635 -18.630  -1.799
    7   HG21  VAL  70          HG21      VAL  70   0.694 -17.780  -4.403
    8   HG23  VAL  70          HG22      VAL  70   1.022 -16.777  -2.992
    9   HG22  VAL  70          HG23      VAL  70  -0.518 -16.630  -3.832

  No H/Q in entry =           9
  In of MODEL   12
    1    H    SER  71           H        SER  71  -3.233 -18.383  -2.095
    2    HA   SER  71           HA       SER  71  -5.097 -17.770  -4.125
    3    HB2  SER  71           HB2      SER  71  -5.646 -17.963  -1.676
    4    HB3  SER  71           HB3      SER  71  -4.815 -16.434  -1.409
    5    HG   SER  71           HG       SER  71  -7.198 -16.976  -2.805

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU  72           H        LEU  72  -5.284 -16.103  -5.457
    2    HA   LEU  72           HA       LEU  72  -3.152 -14.317  -5.931
    3    HB2  LEU  72           HB2      LEU  72  -6.014 -14.335  -6.889
    4    HB3  LEU  72           HB3      LEU  72  -4.799 -13.197  -7.462
    5    HG   LEU  72           HG       LEU  72  -4.435 -16.208  -7.586
    6   HD13  LEU  72          HD11      LEU  72  -6.362 -15.549  -8.962
    7   HD12  LEU  72          HD12      LEU  72  -4.996 -15.980  -9.990
    8   HD11  LEU  72          HD13      LEU  72  -5.397 -14.283  -9.724
    9   HD23  LEU  72          HD21      LEU  72  -2.842 -15.381  -9.485
   10   HD22  LEU  72          HD22      LEU  72  -2.291 -15.213  -7.828
   11   HD21  LEU  72          HD23      LEU  72  -2.944 -13.818  -8.682

  No H/Q in entry =          11
  In of MODEL   12
    1    H    VAL  73           H        VAL  73  -6.248 -13.922  -4.315
    2    HA   VAL  73           HA       VAL  73  -6.262 -11.150  -3.966
    3    HB   VAL  73           HB       VAL  73  -7.984 -11.490  -2.379
    4   HG12  VAL  73          HG11      VAL  73  -8.163 -13.946  -4.123
    5   HG11  VAL  73          HG12      VAL  73  -8.300 -12.324  -4.799
    6   HG13  VAL  73          HG13      VAL  73  -9.465 -12.877  -3.596
    7   HG21  VAL  73          HG21      VAL  73  -6.575 -14.102  -1.944
    8   HG23  VAL  73          HG22      VAL  73  -8.304 -14.001  -1.614
    9   HG22  VAL  73          HG23      VAL  73  -7.180 -12.951  -0.753

  No H/Q in entry =           9
  In of MODEL   12
    1    H    LEU  74           H        LEU  74  -4.359 -13.540  -2.372
    2    HA   LEU  74           HA       LEU  74  -3.944 -12.403   0.151
    3    HB2  LEU  74           HB2      LEU  74  -3.184 -14.630  -0.338
    4    HB3  LEU  74           HB3      LEU  74  -2.123 -14.034  -1.614
    5    HG   LEU  74           HG       LEU  74  -0.801 -12.792   0.065
    6   HD11  LEU  74          HD11      LEU  74  -2.887 -13.956   1.916
    7   HD13  LEU  74          HD12      LEU  74  -2.358 -12.278   1.786
    8   HD12  LEU  74          HD13      LEU  74  -1.294 -13.485   2.506
    9   HD22  LEU  74          HD21      LEU  74   0.390 -14.650   0.694
   10   HD21  LEU  74          HD22      LEU  74  -0.653 -15.349  -0.523
   11   HD23  LEU  74          HD23      LEU  74  -1.051 -15.545   1.168

  No H/Q in entry =          11
  In of MODEL   12
    1    H    VAL  75           H        VAL  75  -2.037 -12.033  -2.798
    2    HA   VAL  75           HA       VAL  75  -0.221 -10.130  -1.782
    3    HB   VAL  75           HB       VAL  75  -1.171 -10.599  -4.610
    4   HG13  VAL  75          HG11      VAL  75  -0.270  -8.314  -4.404
    5   HG12  VAL  75          HG12      VAL  75   0.914  -9.333  -5.209
    6   HG11  VAL  75          HG13      VAL  75   1.120  -8.923  -3.514
    7   HG21  VAL  75          HG21      VAL  75   0.045 -12.445  -3.344
    8   HG23  VAL  75          HG22      VAL  75   1.426 -11.353  -3.234
    9   HG22  VAL  75          HG23      VAL  75   0.854 -11.897  -4.813

  No H/Q in entry =           9
  In of MODEL   12
    1    H    GLU  76           H        GLU  76  -3.360  -9.746  -3.452
    2    HA   GLU  76           HA       GLU  76  -3.378  -6.932  -3.555
    3    HB2  GLU  76           HB2      GLU  76  -5.049  -8.350  -4.724
    4    HB3  GLU  76           HB3      GLU  76  -5.714  -8.842  -3.175
    5    HG2  GLU  76           HG2      GLU  76  -7.146  -7.113  -4.052
    6    HG3  GLU  76           HG3      GLU  76  -6.257  -6.407  -2.717

  No H/Q in entry =           6
  In of MODEL   12
    1    H    ALA  77           H        ALA  77  -4.525  -9.145  -1.019
    2    HA   ALA  77           HA       ALA  77  -5.465  -7.131   0.735
    3    HB3  ALA  77           HB1      ALA  77  -5.695  -8.825   2.333
    4    HB1  ALA  77           HB2      ALA  77  -4.311  -9.727   1.718
    5    HB2  ALA  77           HB3      ALA  77  -5.821  -9.706   0.811

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLN  78           H        GLN  78  -2.335  -8.718   0.384
    2    HA   GLN  78           HA       GLN  78  -1.072  -7.572   2.638
    3    HB2  GLN  78           HB2      GLN  78  -0.228  -9.524   1.289
    4    HB3  GLN  78           HB3      GLN  78   0.225  -8.385   0.023
    5    HG2  GLN  78           HG2      GLN  78   1.690  -7.203   1.613
    6    HG3  GLN  78           HG3      GLN  78   1.245  -8.347   2.876
    7   HE21  GLN  78          HE21      GLN  78   3.969  -8.100   2.059
    8   HE22  GLN  78          HE22      GLN  78   4.422  -9.527   1.258

  No H/Q in entry =           8
  In of MODEL   12
    1    H    LEU  79           H        LEU  79  -1.412  -6.508  -0.711
    2    HA   LEU  79           HA       LEU  79   0.302  -4.303  -0.692
    3    HB2  LEU  79           HB2      LEU  79  -0.727  -5.098  -2.749
    4    HB3  LEU  79           HB3      LEU  79  -2.328  -4.685  -2.147
    5    HG   LEU  79           HG       LEU  79  -1.754  -2.305  -2.121
    6   HD13  LEU  79          HD11      LEU  79   0.487  -2.090  -1.599
    7   HD12  LEU  79          HD12      LEU  79   0.547  -1.804  -3.338
    8   HD11  LEU  79          HD13      LEU  79   0.979  -3.387  -2.689
    9   HD23  LEU  79          HD21      LEU  79  -1.107  -2.116  -4.670
   10   HD22  LEU  79          HD22      LEU  79  -2.644  -2.844  -4.217
   11   HD21  LEU  79          HD23      LEU  79  -1.283  -3.871  -4.655

  No H/Q in entry =          11
  In of MODEL   12
    1    H    HIS  80           H        HIS  80  -3.170  -4.420   0.121
    2    HA   HIS  80           HA       HIS  80  -3.328  -1.661   0.782
    3    HB2  HIS  80           HB2      HIS  80  -5.062  -4.047   1.096
    4    HB3  HIS  80           HB3      HIS  80  -5.370  -2.702   2.198
    5    HD1  HIS  80           HD1      HIS  80  -6.962  -1.045   1.283
    6    HD2  HIS  80           HD2      HIS  80  -4.781  -2.888  -1.755
    7    HE1  HIS  80           HE1      HIS  80  -7.780  -0.038  -0.900
    8    HE2  HIS  80           HE2      HIS  80  -6.457  -1.156  -2.761

  No H/Q in entry =           8
  In of MODEL   12
    1    H    LEU  81           H        LEU  81  -2.886  -4.561   2.779
    2    HA   LEU  81           HA       LEU  81  -2.865  -3.212   5.262
    3    HB2  LEU  81           HB2      LEU  81  -1.678  -5.845   4.389
    4    HB3  LEU  81           HB3      LEU  81  -1.651  -5.286   6.062
    5    HG   LEU  81           HG       LEU  81  -4.194  -5.505   4.425
    6   HD12  LEU  81          HD11      LEU  81  -4.530  -7.566   5.972
    7   HD11  LEU  81          HD12      LEU  81  -2.778  -7.518   6.165
    8   HD13  LEU  81          HD13      LEU  81  -3.483  -7.740   4.563
    9   HD23  LEU  81          HD21      LEU  81  -5.049  -5.695   6.922
   10   HD22  LEU  81          HD22      LEU  81  -4.701  -4.112   6.233
   11   HD21  LEU  81          HD23      LEU  81  -3.528  -4.887   7.298

  No H/Q in entry =          11
  In of MODEL   12
    1    H    MET  82           H        MET  82  -0.188  -4.153   3.103
    2    HA   MET  82           HA       MET  82   1.900  -3.287   4.794
    3    HB2  MET  82           HB2      MET  82   1.693  -3.627   1.801
    4    HB3  MET  82           HB3      MET  82   3.179  -3.076   2.570
    5    HG2  MET  82           HG2      MET  82   1.734  -5.646   3.290
    6    HG3  MET  82           HG3      MET  82   3.111  -5.556   2.196
    7    HE3  MET  82           HE1      MET  82   6.129  -4.860   4.191
    8    HE2  MET  82           HE2      MET  82   5.227  -3.481   3.568
    9    HE1  MET  82           HE3      MET  82   5.299  -4.972   2.634

  No H/Q in entry =           9
  In of MODEL   12
    1    H    THR  83           H        THR  83   0.111  -1.621   2.229
    2    HA   THR  83           HA       THR  83   1.557   0.807   2.320
    3    HB   THR  83           HB       THR  83  -0.602   1.762   1.325
    4    HG1  THR  83           HG1      THR  83  -2.270   0.488   1.212
    5   HG22  THR  83          HG21      THR  83  -0.349  -0.061  -0.674
    6   HG21  THR  83          HG22      THR  83   1.143  -0.374   0.209
    7   HG23  THR  83          HG23      THR  83   0.807   1.244  -0.408

  No H/Q in entry =           7
  In of MODEL   12
    1    H    SER  84           H        SER  84  -1.469  -0.182   3.910
    2    HA   SER  84           HA       SER  84  -1.936   2.256   5.251
    3    HB2  SER  84           HB2      SER  84  -2.811  -0.569   5.814
    4    HB3  SER  84           HB3      SER  84  -3.290   0.779   6.845
    5    HG   SER  84           HG       SER  84  -3.742   0.470   4.051

  No H/Q in entry =           5
  In of MODEL   12
    1    H    MET  85           H        MET  85  -0.273  -0.699   6.389
    2    HA   MET  85           HA       MET  85   0.250   0.221   8.995
    3    HB2  MET  85           HB2      MET  85   0.512  -2.127   8.316
    4    HB3  MET  85           HB3      MET  85   1.906  -1.682   7.332
    5    HG2  MET  85           HG2      MET  85   3.080  -0.869   9.339
    6    HG3  MET  85           HG3      MET  85   1.678  -1.269  10.329
    7    HE3  MET  85           HE1      MET  85   3.376  -3.764   7.343
    8    HE2  MET  85           HE2      MET  85   4.802  -3.834   8.375
    9    HE1  MET  85           HE3      MET  85   4.161  -2.272   7.874

  No H/Q in entry =           9
  In of MODEL   12
    1    H    LEU  86           H        LEU  86   2.200   0.447   6.051
    2    HA   LEU  86           HA       LEU  86   4.428   1.726   7.214
    3    HB2  LEU  86           HB2      LEU  86   4.230   0.645   4.905
    4    HB3  LEU  86           HB3      LEU  86   3.445   2.138   4.389
    5    HG   LEU  86           HG       LEU  86   5.488   3.355   5.376
    6   HD11  LEU  86          HD11      LEU  86   6.152   0.734   6.180
    7   HD13  LEU  86          HD12      LEU  86   7.176   2.164   6.280
    8   HD12  LEU  86          HD13      LEU  86   7.275   1.113   4.870
    9   HD23  LEU  86          HD21      LEU  86   6.188   1.580   3.029
   10   HD22  LEU  86          HD22      LEU  86   6.605   3.271   3.291
   11   HD21  LEU  86          HD23      LEU  86   4.947   2.827   2.887

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ALA  87           H        ALA  87   1.540   3.011   5.618
    2    HA   ALA  87           HA       ALA  87   2.174   5.732   5.701
    3    HB1  ALA  87           HB1      ALA  87  -0.156   4.138   5.153
    4    HB3  ALA  87           HB2      ALA  87   0.181   5.793   4.653
    5    HB2  ALA  87           HB3      ALA  87  -0.624   5.485   6.193

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ARG  88           H        ARG  88   0.446   3.757   8.087
    2    HA   ARG  88           HA       ARG  88  -0.042   5.816   9.930
    3    HB2  ARG  88           HB2      ARG  88  -1.015   3.477   9.994
    4    HB3  ARG  88           HB3      ARG  88   0.515   2.956  10.707
    5    HG2  ARG  88           HG2      ARG  88   0.063   5.038  12.323
    6    HG3  ARG  88           HG3      ARG  88  -1.606   4.737  11.861
    7    HD2  ARG  88           HD2      ARG  88  -1.745   2.891  13.109
    8    HD3  ARG  88           HD3      ARG  88  -0.163   2.285  12.584
    9    HE   ARG  88           HE       ARG  88  -0.687   3.559  15.035
   10   HH21  ARG  88          HH11      ARG  88   0.881   4.549  16.279
   11   HH22  ARG  88          HH12      ARG  88   2.409   4.953  15.579
   12   HH11  ARG  88          HH21      ARG  88   1.605   3.704  12.467
   13   HH12  ARG  88          HH22      ARG  88   2.827   4.458  13.433

  No H/Q in entry =          13
  In of MODEL   12
    1    H    GLU  89           H        GLU  89   2.722   3.556   9.719
    2    HA   GLU  89           HA       GLU  89   3.988   4.429  12.067
    3    HB2  GLU  89           HB2      GLU  89   4.623   2.400  10.728
    4    HB3  GLU  89           HB3      GLU  89   5.418   3.482   9.583
    5    HG2  GLU  89           HG2      GLU  89   6.909   4.309  11.332
    6    HG3  GLU  89           HG3      GLU  89   6.056   3.366  12.549

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LEU  90           H        LEU  90   4.334   5.579   8.739
    2    HA   LEU  90           HA       LEU  90   6.290   7.552   9.330
    3    HB2  LEU  90           HB2      LEU  90   4.288   7.247   7.095
    4    HB3  LEU  90           HB3      LEU  90   5.536   8.500   7.120
    5    HG   LEU  90           HG       LEU  90   6.168   5.555   7.459
    6   HD12  LEU  90          HD11      LEU  90   6.928   5.775   5.022
    7   HD11  LEU  90          HD12      LEU  90   5.934   7.230   4.969
    8   HD13  LEU  90          HD13      LEU  90   5.190   5.667   5.310
    9   HD22  LEU  90          HD21      LEU  90   8.078   6.679   8.148
   10   HD21  LEU  90          HD22      LEU  90   7.752   8.087   7.138
   11   HD23  LEU  90          HD23      LEU  90   8.394   6.613   6.415

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  91           H        ILE  91   2.752   7.617   9.168
    2    HA   ILE  91           HA       ILE  91   2.446  10.394   9.614
    3    HB   ILE  91           HB       ILE  91   0.621   8.044  10.152
    4   HG12  ILE  91          HG12      ILE  91   0.412  10.326   8.164
    5   HG13  ILE  91          HG13      ILE  91   1.253   8.820   7.797
    6   HG22  ILE  91          HG21      ILE  91  -1.083  10.126  10.207
    7   HG21  ILE  91          HG22      ILE  91   0.326  10.938  10.884
    8   HG23  ILE  91          HG23      ILE  91  -0.333   9.510  11.680
    9   HD13  ILE  91          HD11      ILE  91  -0.709   7.559   7.835
   10   HD12  ILE  91          HD12      ILE  91  -1.275   9.081   7.149
   11   HD11  ILE  91          HD13      ILE  91  -1.558   8.723   8.853

  No H/Q in entry =          11
  In of MODEL   12
    1    H    THR  92           H        THR  92   2.804   7.650  11.820
    2    HA   THR  92           HA       THR  92   2.370   9.032  14.240
    3    HB   THR  92           HB       THR  92   4.150   6.673  13.585
    4    HG1  THR  92           HG1      THR  92   2.171   5.942  13.478
    5   HG22  THR  92          HG21      THR  92   3.752   6.397  16.218
    6   HG21  THR  92          HG22      THR  92   3.711   8.157  16.142
    7   HG23  THR  92          HG23      THR  92   5.135   7.282  15.576

  No H/Q in entry =           7
  In of MODEL   12
    1    H    GLU  93           H        GLU  93   5.322   8.543  12.319
    2    HA   GLU  93           HA       GLU  93   7.087   9.949  14.022
    3    HB2  GLU  93           HB2      GLU  93   7.184   9.629  11.007
    4    HB3  GLU  93           HB3      GLU  93   8.527  10.144  12.026
    5    HG2  GLU  93           HG2      GLU  93   7.082   7.526  12.471
    6    HG3  GLU  93           HG3      GLU  93   8.472   7.659  11.401

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LEU  94           H        LEU  94   5.063  10.986  11.299
    2    HA   LEU  94           HA       LEU  94   5.902  13.680  11.199
    3    HB2  LEU  94           HB2      LEU  94   3.298  12.346  10.436
    4    HB3  LEU  94           HB3      LEU  94   3.579  14.070  10.194
    5    HG   LEU  94           HG       LEU  94   5.576  12.056   9.154
    6   HD11  LEU  94          HD11      LEU  94   2.846  12.639   8.080
    7   HD13  LEU  94          HD12      LEU  94   3.811  11.170   7.960
    8   HD12  LEU  94          HD13      LEU  94   4.167  12.545   6.915
    9   HD23  LEU  94          HD21      LEU  94   5.856  13.886   7.430
   10   HD22  LEU  94          HD22      LEU  94   6.270  14.376   9.073
   11   HD21  LEU  94          HD23      LEU  94   4.728  14.862   8.368

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  95           H        ILE  95   3.337  12.097  13.081
    2    HA   ILE  95           HA       ILE  95   2.318  14.461  14.269
    3    HB   ILE  95           HB       ILE  95   2.296  11.580  15.198
    4   HG12  ILE  95          HG12      ILE  95   0.101  13.379  14.136
    5   HG13  ILE  95          HG13      ILE  95   1.050  12.307  13.110
    6   HG21  ILE  95          HG21      ILE  95   1.039  14.069  16.390
    7   HG23  ILE  95          HG22      ILE  95   2.069  12.889  17.201
    8   HG22  ILE  95          HG23      ILE  95   0.431  12.447  16.720
    9   HD13  ILE  95          HD11      ILE  95   0.120  10.380  14.028
   10   HD12  ILE  95          HD12      ILE  95  -1.250  11.486  14.097
   11   HD11  ILE  95          HD13      ILE  95  -0.295  11.179  15.546

  No H/Q in entry =          11
  In of MODEL   12
    1    H    GLU  96           H        GLU  96   4.882  12.213  15.279
    2    HA   GLU  96           HA       GLU  96   5.441  13.408  17.771
    3    HB2  GLU  96           HB2      GLU  96   6.366  11.238  17.131
    4    HB3  GLU  96           HB3      GLU  96   7.314  11.998  15.854
    5    HG2  GLU  96           HG2      GLU  96   8.962  12.530  17.322
    6    HG3  GLU  96           HG3      GLU  96   7.820  13.358  18.372

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LEU  97           H        LEU  97   6.538  14.163  14.489
    2    HA   LEU  97           HA       LEU  97   8.443  16.139  15.206
    3    HB2  LEU  97           HB2      LEU  97   6.856  15.604  12.705
    4    HB3  LEU  97           HB3      LEU  97   7.891  17.024  12.829
    5    HG   LEU  97           HG       LEU  97   8.887  14.216  13.397
    6   HD12  LEU  97          HD11      LEU  97   9.895  14.396  11.084
    7   HD11  LEU  97          HD12      LEU  97   8.861  15.797  10.814
    8   HD13  LEU  97          HD13      LEU  97   8.143  14.214  11.108
    9   HD23  LEU  97          HD21      LEU  97  11.073  15.470  12.662
   10   HD22  LEU  97          HD22      LEU  97  10.450  15.749  14.288
   11   HD21  LEU  97          HD23      LEU  97  10.155  16.933  13.017

  No H/Q in entry =          11
  In of MODEL   12
    1    H    HIS  98           H        HIS  98   4.956  16.312  14.536
    2    HA   HIS  98           HA       HIS  98   4.687  19.115  14.666
    3    HB2  HIS  98           HB2      HIS  98   2.770  16.886  15.387
    4    HB3  HIS  98           HB3      HIS  98   2.321  18.592  15.438
    5    HD1  HIS  98           HD1      HIS  98   3.323  15.862  13.042
    6    HD2  HIS  98           HD2      HIS  98   1.991  19.810  12.908
    7    HE1  HIS  98           HE1      HIS  98   2.780  16.354  10.615
    8    HE2  HIS  98           HE2      HIS  98   1.972  18.752  10.512

  No H/Q in entry =           8
  In of MODEL   12
    1    H    GLU  99           H        GLU  99   4.782  16.629  17.169
    2    HA   GLU  99           HA       GLU  99   4.183  18.333  19.362
    3    HB2  GLU  99           HB2      GLU  99   4.067  15.852  19.462
    4    HB3  GLU  99           HB3      GLU  99   5.827  15.788  19.362
    5    HG2  GLU  99           HG2      GLU  99   6.020  17.081  21.435
    6    HG3  GLU  99           HG3      GLU  99   4.269  17.241  21.523

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LYS 100           H        LYS 100   7.234  17.367  17.812
    2    HA   LYS 100           HA       LYS 100   8.896  18.752  19.674
    3    HB2  LYS 100           HB2      LYS 100   9.397  17.818  16.839
    4    HB3  LYS 100           HB3      LYS 100  10.630  18.576  17.851
    5    HG2  LYS 100           HG2      LYS 100  10.227  16.832  19.593
    6    HG3  LYS 100           HG3      LYS 100   9.092  16.039  18.498
    7    HD2  LYS 100           HD2      LYS 100  10.890  15.735  16.839
    8    HD3  LYS 100           HD3      LYS 100  12.031  16.540  17.919
    9    HE2  LYS 100           HE2      LYS 100  11.608  14.791  19.638
   10    HE3  LYS 100           HE3      LYS 100  10.529  13.965  18.509
   11    HZ1  LYS 100           HZ1      LYS 100  13.359  14.603  17.865
   12    HZ3  LYS 100           HZ2      LYS 100  12.308  13.559  17.034
   13    HZ2  LYS 100           HZ3      LYS 100  12.885  13.135  18.575

  No H/Q in entry =          13
  In of MODEL   12
    1    H    LEU 101           H        LEU 101   7.225  19.693  16.710
    2    HA   LEU 101           HA       LEU 101   8.468  22.236  16.377
    3    HB2  LEU 101           HB2      LEU 101   5.863  21.030  15.480
    4    HB3  LEU 101           HB3      LEU 101   6.134  22.758  15.272
    5    HG   LEU 101           HG       LEU 101   8.152  20.718  14.318
    6   HD12  LEU 101          HD11      LEU 101   7.015  21.234  12.027
    7   HD11  LEU 101          HD12      LEU 101   5.616  21.680  13.001
    8   HD13  LEU 101          HD13      LEU 101   6.262  20.042  13.087
    9   HD21  LEU 101          HD21      LEU 101   7.559  23.636  13.755
   10   HD23  LEU 101          HD22      LEU 101   8.534  22.664  12.654
   11   HD22  LEU 101          HD23      LEU 101   9.071  22.918  14.314

  No H/Q in entry =          11
  In of MODEL   12
    1    H    LYS 102           H        LYS 102   6.907  21.119  18.987
    2    HA   LYS 102           HA       LYS 102   6.279  22.220  20.915
    3    HB2  LYS 102           HB2      LYS 102   7.588  24.194  19.794
    4    HB3  LYS 102           HB3      LYS 102   5.998  24.816  19.410
    5    HG2  LYS 102           HG2      LYS 102   7.360  24.549  22.069
    6    HG3  LYS 102           HG3      LYS 102   6.425  25.887  21.434
    7    HD2  LYS 102           HD2      LYS 102   5.149  23.266  22.311
    8    HD3  LYS 102           HD3      LYS 102   5.408  24.626  23.393
    9    HE2  LYS 102           HE2      LYS 102   3.130  24.246  21.895
   10    HE3  LYS 102           HE3      LYS 102   3.648  25.787  22.578
   11    HZ2  LYS 102           HZ1      LYS 102   3.129  25.898  20.196
   12    HZ1  LYS 102           HZ2      LYS 102   4.379  24.801  19.879
   13    HZ3  LYS 102           HZ3      LYS 102   4.737  26.329  20.522

  No H/Q in entry =          13
  In of MODEL   12
    1    H    ALA 103           H        ALA 103   4.670  23.778  18.139
    2    HA   ALA 103           HA       ALA 103   2.219  24.383  19.013
    3    HB1  ALA 103           HB1      ALA 103   1.321  23.548  16.768
    4    HB2  ALA 103           HB2      ALA 103   2.963  22.993  16.445
    5    HB3  ALA 103           HB3      ALA 103   2.647  24.709  16.708

  No H/Q in entry =           5
  In of MODEL   12
    1    H1   ALA   1           H3       ALA   1  10.422 -20.243  -6.171
    2    H2   ALA   1           H2       ALA   1   9.461 -20.439  -7.561
    3    H3   ALA   1           H1       ALA   1   9.009 -21.179  -6.099
    4    HA   ALA   1           HA       ALA   1  10.030 -23.001  -6.832
    5    HB1  ALA   1           HB1      ALA   1  10.139 -22.645  -9.108
    6    HB2  ALA   1           HB2      ALA   1  11.867 -22.515  -8.772
    7    HB3  ALA   1           HB3      ALA   1  10.886 -21.056  -8.928

  No H/Q in entry =           7
  In of MODEL   12
    1    H    GLU   2           H        GLU   2  12.303 -23.978  -6.879
    2    HA   GLU   2           HA       GLU   2  13.676 -23.911  -4.662
    3    HB2  GLU   2           HB2      GLU   2  15.045 -23.799  -7.356
    4    HB3  GLU   2           HB3      GLU   2  15.759 -24.417  -5.867
    5    HG2  GLU   2           HG2      GLU   2  14.719 -26.422  -6.110
    6    HG3  GLU   2           HG3      GLU   2  13.158 -25.657  -6.376

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLU   3           H        GLU   3  15.479 -22.071  -7.059
    2    HA   GLU   3           HA       GLU   3  16.645 -20.395  -5.096
    3    HB2  GLU   3           HB2      GLU   3  16.601 -20.396  -8.106
    4    HB3  GLU   3           HB3      GLU   3  17.359 -19.075  -7.218
    5    HG2  GLU   3           HG2      GLU   3  19.001 -20.468  -6.287
    6    HG3  GLU   3           HG3      GLU   3  18.038 -21.924  -6.510

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LEU   4           H        LEU   4  14.384 -19.523  -7.737
    2    HA   LEU   4           HA       LEU   4  13.947 -16.908  -7.130
    3    HB2  LEU   4           HB2      LEU   4  11.751 -18.856  -7.867
    4    HB3  LEU   4           HB3      LEU   4  11.698 -17.107  -8.068
    5    HG   LEU   4           HG       LEU   4  13.645 -18.996  -9.431
    6   HD13  LEU   4          HD11      LEU   4  12.352 -18.833 -11.346
    7   HD12  LEU   4          HD12      LEU   4  11.661 -17.279 -10.883
    8   HD11  LEU   4          HD13      LEU   4  11.087 -18.762 -10.123
    9   HD23  LEU   4          HD21      LEU   4  14.014 -16.756 -10.784
   10   HD22  LEU   4          HD22      LEU   4  14.865 -17.007  -9.260
   11   HD21  LEU   4          HD23      LEU   4  13.424 -15.994  -9.306

  No H/Q in entry =          11
  In of MODEL   12
    1    H    GLU   5           H        GLU   5  12.422 -19.671  -5.491
    2    HA   GLU   5           HA       GLU   5  10.757 -18.078  -3.796
    3    HB2  GLU   5           HB2      GLU   5  10.303 -20.450  -4.315
    4    HB3  GLU   5           HB3      GLU   5  11.729 -20.904  -3.381
    5    HG2  GLU   5           HG2      GLU   5  10.771 -19.865  -1.376
    6    HG3  GLU   5           HG3      GLU   5   9.357 -19.362  -2.301

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLU   6           H        GLU   6  13.882 -19.695  -3.340
    2    HA   GLU   6           HA       GLU   6  14.234 -18.840  -0.641
    3    HB2  GLU   6           HB2      GLU   6  16.189 -19.804  -2.741
    4    HB3  GLU   6           HB3      GLU   6  16.639 -19.462  -1.068
    5    HG2  GLU   6           HG2      GLU   6  14.478 -21.420  -1.897
    6    HG3  GLU   6           HG3      GLU   6  16.125 -21.876  -1.459

  No H/Q in entry =           6
  In of MODEL   12
    1    H    VAL   7           H        VAL   7  15.028 -17.526  -3.789
    2    HA   VAL   7           HA       VAL   7  16.736 -15.419  -2.920
    3    HB   VAL   7           HB       VAL   7  15.036 -15.765  -5.404
    4   HG11  VAL   7          HG11      VAL   7  16.952 -13.573  -4.587
    5   HG13  VAL   7          HG12      VAL   7  15.314 -13.412  -5.216
    6   HG12  VAL   7          HG13      VAL   7  16.621 -13.931  -6.281
    7   HG21  VAL   7          HG21      VAL   7  17.123 -17.245  -4.825
    8   HG23  VAL   7          HG22      VAL   7  18.047 -15.796  -5.221
    9   HG22  VAL   7          HG23      VAL   7  17.006 -16.535  -6.436

  No H/Q in entry =           9
  In of MODEL   12
    1    H    VAL   8           H        VAL   8  13.243 -15.648  -3.490
    2    HA   VAL   8           HA       VAL   8  12.607 -12.932  -3.024
    3    HB   VAL   8           HB       VAL   8  10.969 -15.445  -2.604
    4   HG13  VAL   8          HG11      VAL   8   9.903 -13.840  -1.241
    5   HG12  VAL   8          HG12      VAL   8   9.051 -13.695  -2.779
    6   HG11  VAL   8          HG13      VAL   8  10.288 -12.517  -2.341
    7   HG22  VAL   8          HG21      VAL   8  10.358 -15.262  -4.823
    8   HG21  VAL   8          HG22      VAL   8  11.863 -14.358  -4.960
    9   HG23  VAL   8          HG23      VAL   8  10.338 -13.500  -4.770

  No H/Q in entry =           9
  In of MODEL   12
    1    H    MET   9           H        MET   9  12.833 -15.738  -0.840
    2    HA   MET   9           HA       MET   9  12.023 -14.454   1.526
    3    HB2  MET   9           HB2      MET   9  13.912 -16.748   1.000
    4    HB3  MET   9           HB3      MET   9  13.598 -16.166   2.635
    5    HG2  MET   9           HG2      MET   9  11.191 -16.555   2.332
    6    HG3  MET   9           HG3      MET   9  11.478 -17.094   0.676
    7    HE1  MET   9           HE1      MET   9  12.296 -17.296   4.204
    8    HE3  MET   9           HE2      MET   9  13.781 -18.230   4.036
    9    HE2  MET   9           HE3      MET   9  12.324 -19.006   4.652

  No H/Q in entry =           9
  In of MODEL   12
    1    H    GLY  10           H        GLY  10  15.207 -14.716  -0.018
    2    HA3  GLY  10           HA2      GLY  10  16.674 -13.309   1.956
    3    HA2  GLY  10           HA3      GLY  10  17.142 -13.482   0.265

  No H/Q in entry =           3
  In of MODEL   12
    1    H    LEU  11           H        LEU  11  14.992 -12.238  -0.985
    2    HA   LEU  11           HA       LEU  11  15.706  -9.501  -0.822
    3    HB2  LEU  11           HB2      LEU  11  13.328 -10.886  -2.065
    4    HB3  LEU  11           HB3      LEU  11  13.628  -9.155  -2.225
    5    HG   LEU  11           HG       LEU  11  15.636 -11.286  -3.003
    6   HD13  LEU  11          HD11      LEU  11  13.892 -11.636  -4.529
    7   HD12  LEU  11          HD12      LEU  11  14.911 -10.467  -5.367
    8   HD11  LEU  11          HD13      LEU  11  13.440  -9.931  -4.555
    9   HD22  LEU  11          HD21      LEU  11  16.887  -9.336  -2.774
   10   HD21  LEU  11          HD22      LEU  11  15.525  -8.285  -3.159
   11   HD23  LEU  11          HD23      LEU  11  16.352  -9.164  -4.444

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  12           H        ILE  12  12.913 -11.296   0.436
    2    HA   ILE  12           HA       ILE  12  11.539  -9.057   1.488
    3    HB   ILE  12           HB       ILE  12  11.542 -11.938   2.440
    4   HG12  ILE  12          HG12      ILE  12  10.870 -11.303  -0.011
    5   HG13  ILE  12          HG13      ILE  12   9.825 -12.376   0.900
    6   HG21  ILE  12          HG21      ILE  12   9.629  -9.647   2.992
    7   HG23  ILE  12          HG22      ILE  12  10.603 -10.522   4.173
    8   HG22  ILE  12          HG23      ILE  12   9.273 -11.336   3.351
    9   HD13  ILE  12          HD11      ILE  12   8.327 -10.535   1.398
   10   HD12  ILE  12          HD12      ILE  12   8.614 -10.572  -0.341
   11   HD11  ILE  12          HD13      ILE  12   9.432  -9.390   0.658

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  13           H        ILE  13  13.904 -11.284   2.906
    2    HA   ILE  13           HA       ILE  13  13.941 -10.102   5.485
    3    HB   ILE  13           HB       ILE  13  15.988 -11.698   3.928
    4   HG12  ILE  13          HG12      ILE  13  13.702 -12.639   4.772
    5   HG13  ILE  13          HG13      ILE  13  15.167 -13.575   5.047
    6   HG21  ILE  13          HG21      ILE  13  16.106 -10.672   6.773
    7   HG23  ILE  13          HG22      ILE  13  17.302 -10.453   5.503
    8   HG22  ILE  13          HG23      ILE  13  17.068 -12.044   6.227
    9   HD12  ILE  13          HD11      ILE  13  13.442 -13.118   7.037
   10   HD11  ILE  13          HD12      ILE  13  14.340 -11.606   7.141
   11   HD13  ILE  13          HD13      ILE  13  15.181 -13.140   7.326

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ASN  14           H        ASN  14  15.911  -9.592   2.574
    2    HA   ASN  14           HA       ASN  14  17.668  -7.665   3.641
    3    HB2  ASN  14           HB2      ASN  14  17.644  -8.934   1.326
    4    HB3  ASN  14           HB3      ASN  14  16.766  -7.510   0.784
    5   HD21  ASN  14          HD21      ASN  14  19.208  -7.872  -0.391
    6   HD22  ASN  14          HD22      ASN  14  20.358  -6.798   0.240

  No H/Q in entry =           6
  In of MODEL   12
    1    H    SER  15           H        SER  15  14.568  -7.293   1.935
    2    HA   SER  15           HA       SER  15  14.479  -4.472   1.988
    3    HB2  SER  15           HB2      SER  15  12.145  -4.700   1.487
    4    HB3  SER  15           HB3      SER  15  12.935  -6.068   0.715
    5    HG   SER  15           HG       SER  15  11.398  -5.982   3.071

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLY  16           H        GLY  16  13.356  -6.920   4.290
    2    HA3  GLY  16           HA2      GLY  16  12.141  -5.159   6.140
    3    HA2  GLY  16           HA3      GLY  16  12.741  -6.772   6.506

  No H/Q in entry =           3
  In of MODEL   12
    1    H    GLN  17           H        GLN  17  15.457  -6.461   5.925
    2    HA   GLN  17           HA       GLN  17  16.413  -5.245   8.308
    3    HB2  GLN  17           HB2      GLN  17  17.650  -7.041   7.158
    4    HB3  GLN  17           HB3      GLN  17  17.933  -5.971   5.784
    5    HG2  GLN  17           HG2      GLN  17  19.213  -4.441   7.186
    6    HG3  GLN  17           HG3      GLN  17  18.855  -5.407   8.616
    7   HE21  GLN  17          HE21      GLN  17  21.557  -4.920   7.766
    8   HE22  GLN  17          HE22      GLN  17  22.225  -6.397   7.264

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ALA  18           H        ALA  18  16.248  -4.170   4.946
    2    HA   ALA  18           HA       ALA  18  17.701  -1.788   5.177
    3    HB1  ALA  18           HB1      ALA  18  16.583  -2.997   3.106
    4    HB3  ALA  18           HB2      ALA  18  16.861  -1.255   3.089
    5    HB2  ALA  18           HB3      ALA  18  15.255  -1.888   3.453

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ARG  19           H        ARG  19  14.195  -2.349   5.559
    2    HA   ARG  19           HA       ARG  19  13.544   0.307   6.268
    3    HB2  ARG  19           HB2      ARG  19  11.852  -1.432   5.676
    4    HB3  ARG  19           HB3      ARG  19  12.181  -2.231   7.215
    5    HG2  ARG  19           HG2      ARG  19  11.480  -0.233   8.449
    6    HG3  ARG  19           HG3      ARG  19  11.244   0.644   6.938
    7    HD2  ARG  19           HD2      ARG  19   9.093  -0.136   7.750
    8    HD3  ARG  19           HD3      ARG  19   9.511  -1.020   6.277
    9    HE   ARG  19           HE       ARG  19  10.449  -2.567   8.388
   10   HH21  ARG  19          HH11      ARG  19   9.183  -4.196   9.323
   11   HH22  ARG  19          HH12      ARG  19   7.464  -4.156   9.145
   12   HH11  ARG  19          HH21      ARG  19   7.469  -1.253   7.278
   13   HH12  ARG  19          HH22      ARG  19   6.494  -2.490   7.983

  No H/Q in entry =          13
  In of MODEL   12
    1    H    SER  20           H        SER  20  14.372  -2.527   8.234
    2    HA   SER  20           HA       SER  20  14.085  -1.422  10.769
    3    HB2  SER  20           HB2      SER  20  14.534  -3.748  10.661
    4    HB3  SER  20           HB3      SER  20  15.985  -3.503   9.692
    5    HG   SER  20           HG       SER  20  16.920  -2.482  11.513

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU  21           H        LEU  21  16.939  -1.385   8.645
    2    HA   LEU  21           HA       LEU  21  18.616   0.090  10.390
    3    HB2  LEU  21           HB2      LEU  21  18.607  -0.181   7.375
    4    HB3  LEU  21           HB3      LEU  21  19.866   0.664   8.272
    5    HG   LEU  21           HG       LEU  21  19.092  -2.220   8.799
    6   HD12  LEU  21          HD11      LEU  21  21.195  -2.767   7.560
    7   HD11  LEU  21          HD12      LEU  21  21.319  -1.072   7.088
    8   HD13  LEU  21          HD13      LEU  21  19.959  -2.043   6.528
    9   HD23  LEU  21          HD21      LEU  21  21.575  -2.081   9.709
   10   HD22  LEU  21          HD22      LEU  21  20.259  -1.498  10.721
   11   HD21  LEU  21          HD23      LEU  21  21.241  -0.356   9.819

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ALA  22           H        ALA  22  16.372   1.074   7.822
    2    HA   ALA  22           HA       ALA  22  16.931   3.828   7.836
    3    HB3  ALA  22           HB1      ALA  22  15.527   2.594   6.152
    4    HB2  ALA  22           HB2      ALA  22  14.829   4.113   6.714
    5    HB1  ALA  22           HB3      ALA  22  14.224   2.579   7.340

  No H/Q in entry =           5
  In of MODEL   12
    1    H    TYR  23           H        TYR  23  14.412   2.033   9.661
    2    HA   TYR  23           HA       TYR  23  13.460   4.279  11.103
    3    HB2  TYR  23           HB2      TYR  23  12.208   2.176  11.080
    4    HB3  TYR  23           HB3      TYR  23  13.529   1.355  11.909
    5    HD1  TYR  23           HD1      TYR  23  11.044   4.115  12.263
    6    HD2  TYR  23           HD2      TYR  23  13.721   1.419  14.266
    7    HE1  TYR  23           HE1      TYR  23  10.113   4.817  14.454
    8    HE2  TYR  23           HE2      TYR  23  12.790   2.120  16.455
    9    HH   TYR  23           HH       TYR  23  11.562   4.374  17.292

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ALA  24           H        ALA  24  16.084   1.984  11.755
    2    HA   ALA  24           HA       ALA  24  16.751   2.976  14.321
    3    HB1  ALA  24           HB1      ALA  24  18.093   1.172  14.164
    4    HB3  ALA  24           HB2      ALA  24  19.133   2.084  13.069
    5    HB2  ALA  24           HB3      ALA  24  17.834   1.086  12.423

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA  25           H        ALA  25  17.730   3.894  11.045
    2    HA   ALA  25           HA       ALA  25  19.688   5.813  11.698
    3    HB1  ALA  25           HB1      ALA  25  18.975   4.868   9.380
    4    HB3  ALA  25           HB2      ALA  25  19.490   6.552   9.474
    5    HB2  ALA  25           HB3      ALA  25  17.772   6.159   9.397

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU  26           H        LEU  26  16.177   6.071  11.320
    2    HA   LEU  26           HA       LEU  26  15.974   8.855  11.767
    3    HB2  LEU  26           HB2      LEU  26  14.107   7.634  10.832
    4    HB3  LEU  26           HB3      LEU  26  14.001   6.609  12.258
    5    HG   LEU  26           HG       LEU  26  13.405   8.573  13.633
    6   HD12  LEU  26          HD11      LEU  26  12.768  10.678  12.303
    7   HD11  LEU  26          HD12      LEU  26  13.749  10.015  10.998
    8   HD13  LEU  26          HD13      LEU  26  14.490  10.395  12.553
    9   HD21  LEU  26          HD21      LEU  26  11.738   8.271  11.116
   10   HD23  LEU  26          HD22      LEU  26  11.177   8.976  12.629
   11   HD22  LEU  26          HD23      LEU  26  11.615   7.270  12.563

  No H/Q in entry =          11
  In of MODEL   12
    1    H    LYS  27           H        LYS  27  15.832   6.079  13.962
    2    HA   LYS  27           HA       LYS  27  15.240   7.452  16.326
    3    HB2  LYS  27           HB2      LYS  27  15.248   4.977  16.064
    4    HB3  LYS  27           HB3      LYS  27  17.012   5.014  16.029
    5    HG2  LYS  27           HG2      LYS  27  17.060   6.001  18.278
    6    HG3  LYS  27           HG3      LYS  27  15.293   6.035  18.315
    7    HD2  LYS  27           HD2      LYS  27  15.247   3.568  18.081
    8    HD3  LYS  27           HD3      LYS  27  17.011   3.542  18.077
    9    HE2  LYS  27           HE2      LYS  27  17.044   4.533  20.333
   10    HE3  LYS  27           HE3      LYS  27  15.278   4.589  20.339
   11    HZ3  LYS  27           HZ1      LYS  27  16.043   2.631  21.496
   12    HZ2  LYS  27           HZ2      LYS  27  16.961   2.142  20.150
   13    HZ1  LYS  27           HZ3      LYS  27  15.264   2.163  20.062

  No H/Q in entry =          13
  In of MODEL   12
    1    H    GLN  28           H        GLN  28  18.359   6.840  14.750
    2    HA   GLN  28           HA       GLN  28  20.043   7.909  16.747
    3    HB2  GLN  28           HB2      GLN  28  20.343   7.855  13.733
    4    HB3  GLN  28           HB3      GLN  28  21.629   8.320  14.847
    5    HG2  GLN  28           HG2      GLN  28  20.191   5.653  14.888
    6    HG3  GLN  28           HG3      GLN  28  21.780   5.928  14.177
    7   HE21  GLN  28          HE21      GLN  28  20.487   4.619  16.868
    8   HE22  GLN  28          HE22      GLN  28  21.666   5.039  18.014

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ALA  29           H        ALA  29  18.319   9.406  14.045
    2    HA   ALA  29           HA       ALA  29  19.342  12.017  14.300
    3    HB2  ALA  29           HB1      ALA  29  17.657  12.669  12.820
    4    HB1  ALA  29           HB2      ALA  29  16.498  11.508  13.467
    5    HB3  ALA  29           HB3      ALA  29  17.828  10.952  12.451

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LYS  30           H        LYS  30  16.543  10.447  15.810
    2    HA   LYS  30           HA       LYS  30  15.545  12.713  17.160
    3    HB2  LYS  30           HB2      LYS  30  15.400   9.773  17.866
    4    HB3  LYS  30           HB3      LYS  30  14.543  11.034  18.754
    5    HG2  LYS  30           HG2      LYS  30  13.435  11.729  16.630
    6    HG3  LYS  30           HG3      LYS  30  14.230  10.384  15.808
    7    HD2  LYS  30           HD2      LYS  30  13.134   8.789  17.333
    8    HD3  LYS  30           HD3      LYS  30  12.349  10.124  18.179
    9    HE2  LYS  30           HE2      LYS  30  11.198  10.767  16.081
   10    HE3  LYS  30           HE3      LYS  30  11.962   9.404  15.255
   11    HZ2  LYS  30           HZ1      LYS  30   9.645   9.020  16.125
   12    HZ1  LYS  30           HZ2      LYS  30  10.306   9.067  17.695
   13    HZ3  LYS  30           HZ3      LYS  30  10.807   7.876  16.588

  No H/Q in entry =          13
  In of MODEL   12
    1    H    GLN  31           H        GLN  31  18.180  10.515  17.911
    2    HA   GLN  31           HA       GLN  31  18.506  11.529  20.606
    3    HB2  GLN  31           HB2      GLN  31  20.519   9.935  19.012
    4    HB3  GLN  31           HB3      GLN  31  20.378  10.062  20.766
    5    HG2  GLN  31           HG2      GLN  31  17.858   9.137  19.986
    6    HG3  GLN  31           HG3      GLN  31  18.955   8.279  18.912
    7   HE21  GLN  31          HE21      GLN  31  17.390   7.152  21.182
    8   HE22  GLN  31          HE22      GLN  31  18.534   6.480  22.238

  No H/Q in entry =           8
  In of MODEL   12
    1    H    GLY  32           H        GLY  32  19.052  12.838  17.641
    2    HA3  GLY  32           HA2      GLY  32  20.061  14.872  17.129
    3    HA2  GLY  32           HA3      GLY  32  20.811  14.870  18.721

  No H/Q in entry =           3
  In of MODEL   12
    1    H    ASP  33           H        ASP  33  21.210  11.971  16.948
    2    HA   ASP  33           HA       ASP  33  24.045  12.616  16.494
    3    HB2  ASP  33           HB2      ASP  33  22.508  10.016  16.606
    4    HB3  ASP  33           HB3      ASP  33  24.197  10.114  16.119

  No H/Q in entry =           4
  In of MODEL   12
    1    H    PHE  34           H        PHE  34  23.586  13.942  14.610
    2    HA   PHE  34           HA       PHE  34  22.237  12.971  12.317
    3    HB2  PHE  34           HB2      PHE  34  24.390  15.082  12.555
    4    HB3  PHE  34           HB3      PHE  34  23.408  14.801  11.119
    5    HD1  PHE  34           HD1      PHE  34  23.666  16.735  14.032
    6    HD2  PHE  34           HD2      PHE  34  20.777  14.648  11.635
    7    HE1  PHE  34           HE1      PHE  34  21.860  18.153  14.970
    8    HE2  PHE  34           HE2      PHE  34  18.975  16.065  12.575
    9    HZ   PHE  34           HZ       PHE  34  19.520  17.818  14.238

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ALA  35           H        ALA  35  25.605  12.749  13.340
    2    HA   ALA  35           HA       ALA  35  26.712  11.914  10.889
    3    HB3  ALA  35           HB1      ALA  35  28.373  10.728  12.617
    4    HB2  ALA  35           HB2      ALA  35  27.515  11.764  13.758
    5    HB1  ALA  35           HB3      ALA  35  28.365  12.477  12.389

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA  36           H        ALA  36  25.564   9.972  13.651
    2    HA   ALA  36           HA       ALA  36  26.029   7.478  12.380
    3    HB2  ALA  36           HB1      ALA  36  25.581   6.738  14.454
    4    HB3  ALA  36           HB2      ALA  36  23.899   7.250  14.296
    5    HB1  ALA  36           HB3      ALA  36  25.109   8.370  14.923

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA  37           H        ALA  37  23.228   9.633  12.499
    2    HA   ALA  37           HA       ALA  37  21.360   7.880  11.316
    3    HB3  ALA  37           HB1      ALA  37  21.613  10.841  11.607
    4    HB1  ALA  37           HB2      ALA  37  20.289   9.776  12.074
    5    HB2  ALA  37           HB3      ALA  37  20.490  10.245  10.385

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LYS  38           H        LYS  38  23.490  10.320   9.845
    2    HA   LYS  38           HA       LYS  38  22.858   9.896   7.165
    3    HB2  LYS  38           HB2      LYS  38  24.676  11.437   8.617
    4    HB3  LYS  38           HB3      LYS  38  25.705  10.437   7.597
    5    HG2  LYS  38           HG2      LYS  38  24.556  11.217   5.595
    6    HG3  LYS  38           HG3      LYS  38  23.365  12.083   6.570
    7    HD2  LYS  38           HD2      LYS  38  24.972  13.667   7.328
    8    HD3  LYS  38           HD3      LYS  38  26.325  12.668   6.799
    9    HE2  LYS  38           HE2      LYS  38  25.993  14.541   5.245
   10    HE3  LYS  38           HE3      LYS  38  25.647  13.006   4.440
   11    HZ3  LYS  38           HZ1      LYS  38  23.455  13.471   4.300
   12    HZ2  LYS  38           HZ2      LYS  38  23.992  15.081   4.388
   13    HZ1  LYS  38           HZ3      LYS  38  23.405  14.304   5.779

  No H/Q in entry =          13
  In of MODEL   12
    1    H    ALA  39           H        ALA  39  25.349   8.277   9.134
    2    HA   ALA  39           HA       ALA  39  26.413   6.677   7.071
    3    HB2  ALA  39           HB1      ALA  39  26.302   5.717   9.915
    4    HB1  ALA  39           HB2      ALA  39  27.270   7.133   9.501
    5    HB3  ALA  39           HB3      ALA  39  27.611   5.579   8.741

  No H/Q in entry =           5
  In of MODEL   12
    1    H    MET  40           H        MET  40  23.784   6.086   9.357
    2    HA   MET  40           HA       MET  40  23.320   3.385   8.624
    3    HB2  MET  40           HB2      MET  40  21.516   5.446   9.906
    4    HB3  MET  40           HB3      MET  40  21.095   3.740   9.731
    5    HG2  MET  40           HG2      MET  40  23.647   4.660  11.082
    6    HG3  MET  40           HG3      MET  40  22.146   4.398  11.969
    7    HE3  MET  40           HE1      MET  40  21.550   0.770  12.145
    8    HE2  MET  40           HE2      MET  40  20.696   2.079  11.333
    9    HE1  MET  40           HE3      MET  40  21.432   2.362  12.909

  No H/Q in entry =           9
  In of MODEL   12
    1    H    MET  41           H        MET  41  21.938   6.449   7.427
    2    HA   MET  41           HA       MET  41  19.979   5.269   5.748
    3    HB2  MET  41           HB2      MET  41  21.484   7.846   5.239
    4    HB3  MET  41           HB3      MET  41  19.955   7.365   4.514
    5    HG2  MET  41           HG2      MET  41  19.196   7.186   7.062
    6    HG3  MET  41           HG3      MET  41  20.514   8.332   7.289
    7    HE2  MET  41           HE1      MET  41  19.977   9.622   3.949
    8    HE1  MET  41           HE2      MET  41  20.931  10.054   5.364
    9    HE3  MET  41           HE3      MET  41  19.670  11.144   4.793

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ASP  42           H        ASP  42  23.361   6.163   5.209
    2    HA   ASP  42           HA       ASP  42  23.461   5.686   2.452
    3    HB2  ASP  42           HB2      ASP  42  25.213   6.670   4.228
    4    HB3  ASP  42           HB3      ASP  42  25.857   5.039   4.105

  No H/Q in entry =           4
  In of MODEL   12
    1    H    GLN  43           H        GLN  43  24.155   3.528   5.178
    2    HA   GLN  43           HA       GLN  43  24.808   1.263   3.600
    3    HB2  GLN  43           HB2      GLN  43  23.774   1.458   6.439
    4    HB3  GLN  43           HB3      GLN  43  24.344  -0.037   5.687
    5    HG2  GLN  43           HG2      GLN  43  26.519   1.155   5.185
    6    HG3  GLN  43           HG3      GLN  43  25.943   2.488   6.181
    7   HE21  GLN  43          HE21      GLN  43  28.164   1.497   7.228
    8   HE22  GLN  43          HE22      GLN  43  27.874   0.418   8.504

  No H/Q in entry =           8
  In of MODEL   12
    1    H    SER  44           H        SER  44  21.755   2.424   4.970
    2    HA   SER  44           HA       SER  44  20.171   0.193   4.293
    3    HB2  SER  44           HB2      SER  44  19.745   2.726   5.434
    4    HB3  SER  44           HB3      SER  44  18.717   2.691   4.004
    5    HG   SER  44           HG       SER  44  17.608   1.758   5.723

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ARG  45           H        ARG  45  20.946   3.150   2.488
    2    HA   ARG  45           HA       ARG  45  19.427   2.675   0.178
    3    HB2  ARG  45           HB2      ARG  45  20.587   4.802   0.765
    4    HB3  ARG  45           HB3      ARG  45  22.126   4.033   0.387
    5    HG2  ARG  45           HG2      ARG  45  21.350   3.632  -1.931
    6    HG3  ARG  45           HG3      ARG  45  19.822   4.424  -1.551
    7    HD2  ARG  45           HD2      ARG  45  21.088   6.510  -0.963
    8    HD3  ARG  45           HD3      ARG  45  22.580   5.723  -1.525
    9    HE   ARG  45           HE       ARG  45  20.657   5.500  -3.569
   10   HH21  ARG  45          HH11      ARG  45  20.669   6.867  -5.333
   11   HH22  ARG  45          HH12      ARG  45  21.439   8.411  -5.227
   12   HH11  ARG  45          HH21      ARG  45  22.402   7.985  -1.937
   13   HH12  ARG  45          HH22      ARG  45  22.419   9.043  -3.301

  No H/Q in entry =          13
  In of MODEL   12
    1    H    MET  46           H        MET  46  22.780   1.771   0.940
    2    HA   MET  46           HA       MET  46  23.386   0.571  -1.540
    3    HB2  MET  46           HB2      MET  46  24.478   0.221   1.254
    4    HB3  MET  46           HB3      MET  46  25.139  -0.654  -0.131
    5    HG2  MET  46           HG2      MET  46  25.578   1.475  -1.285
    6    HG3  MET  46           HG3      MET  46  24.888   2.363   0.067
    7    HE1  MET  46           HE1      MET  46  26.986   3.487  -0.627
    8    HE3  MET  46           HE2      MET  46  28.607   3.121  -0.045
    9    HE2  MET  46           HE3      MET  46  27.406   3.774   1.066

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ALA  47           H        ALA  47  21.979  -0.747   1.431
    2    HA   ALA  47           HA       ALA  47  21.903  -3.460   0.631
    3    HB2  ALA  47           HB1      ALA  47  21.520  -2.993   2.933
    4    HB3  ALA  47           HB2      ALA  47  19.980  -3.583   2.309
    5    HB1  ALA  47           HB3      ALA  47  20.225  -1.854   2.567

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU  48           H        LEU  48  19.577  -0.811   0.262
    2    HA   LEU  48           HA       LEU  48  17.522  -2.327  -0.995
    3    HB2  LEU  48           HB2      LEU  48  18.205   0.621  -1.110
    4    HB3  LEU  48           HB3      LEU  48  16.730  -0.076  -1.781
    5    HG   LEU  48           HG       LEU  48  17.570  -0.382   1.111
    6   HD13  LEU  48          HD11      LEU  48  17.175   1.922   0.920
    7   HD12  LEU  48          HD12      LEU  48  15.609   1.290   1.424
    8   HD11  LEU  48          HD13      LEU  48  15.890   1.707  -0.267
    9   HD22  LEU  48          HD21      LEU  48  16.026  -2.082   0.726
   10   HD21  LEU  48          HD22      LEU  48  15.166  -1.173  -0.516
   11   HD23  LEU  48          HD23      LEU  48  14.951  -0.764   1.186

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ASN  49           H        ASN  49  20.233  -0.426  -2.218
    2    HA   ASN  49           HA       ASN  49  19.591  -0.507  -4.944
    3    HB2  ASN  49           HB2      ASN  49  21.278   0.999  -4.039
    4    HB3  ASN  49           HB3      ASN  49  22.286  -0.362  -3.564
    5   HD21  ASN  49          HD21      ASN  49  20.886   1.219  -6.451
    6   HD22  ASN  49          HD22      ASN  49  22.113   0.719  -7.510

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLU  50           H        GLU  50  21.547  -2.718  -2.972
    2    HA   GLU  50           HA       GLU  50  22.238  -4.484  -5.093
    3    HB2  GLU  50           HB2      GLU  50  23.429  -4.468  -2.923
    4    HB3  GLU  50           HB3      GLU  50  21.977  -5.080  -2.131
    5    HG2  GLU  50           HG2      GLU  50  22.051  -7.116  -3.487
    6    HG3  GLU  50           HG3      GLU  50  23.436  -6.498  -4.384

  No H/Q in entry =           6
  In of MODEL   12
    1    H    ALA  51           H        ALA  51  19.575  -4.389  -2.776
    2    HA   ALA  51           HA       ALA  51  18.386  -6.851  -3.533
    3    HB3  ALA  51           HB1      ALA  51  16.794  -6.327  -1.984
    4    HB1  ALA  51           HB2      ALA  51  16.599  -4.679  -2.586
    5    HB2  ALA  51           HB3      ALA  51  17.951  -5.078  -1.525

  No H/Q in entry =           5
  In of MODEL   12
    1    H    HIS  52           H        HIS  52  17.837  -3.499  -4.575
    2    HA   HIS  52           HA       HIS  52  15.724  -4.007  -6.381
    3    HB2  HIS  52           HB2      HIS  52  16.405  -1.748  -5.576
    4    HB3  HIS  52           HB3      HIS  52  17.849  -1.861  -6.580
    5    HD1  HIS  52           HD1      HIS  52  17.486  -1.911  -9.195
    6    HD2  HIS  52           HD2      HIS  52  14.035  -1.157  -6.981
    7    HE1  HIS  52           HE1      HIS  52  15.761  -1.038 -10.831
    8    HE2  HIS  52           HE2      HIS  52  13.651  -0.572  -9.496

  No H/Q in entry =           8
  In of MODEL   12
    1    H    LEU  53           H        LEU  53  19.244  -4.048  -6.802
    2    HA   LEU  53           HA       LEU  53  19.307  -4.369  -9.602
    3    HB2  LEU  53           HB2      LEU  53  21.225  -5.146  -7.420
    4    HB3  LEU  53           HB3      LEU  53  21.543  -5.540  -9.107
    5    HG   LEU  53           HG       LEU  53  20.893  -2.720  -8.193
    6   HD13  LEU  53          HD11      LEU  53  22.900  -3.235  -7.026
    7   HD12  LEU  53          HD12      LEU  53  23.425  -2.406  -8.491
    8   HD11  LEU  53          HD13      LEU  53  23.541  -4.158  -8.382
    9   HD23  LEU  53          HD21      LEU  53  22.338  -2.302 -10.341
   10   HD22  LEU  53          HD22      LEU  53  20.657  -2.787 -10.532
   11   HD21  LEU  53          HD23      LEU  53  21.936  -3.967 -10.743

  No H/Q in entry =          11
  In of MODEL   12
    1    H    VAL  54           H        VAL  54  19.163  -6.750  -6.973
    2    HA   VAL  54           HA       VAL  54  19.269  -9.049  -8.628
    3    HB   VAL  54           HB       VAL  54  18.110  -8.609  -5.865
    4   HG12  VAL  54          HG11      VAL  54  18.409 -11.230  -5.855
    5   HG11  VAL  54          HG12      VAL  54  18.231 -11.063  -7.602
    6   HG13  VAL  54          HG13      VAL  54  16.944 -10.518  -6.528
    7   HG22  VAL  54          HG21      VAL  54  20.427  -8.420  -5.635
    8   HG21  VAL  54          HG22      VAL  54  20.758  -9.517  -6.974
    9   HG23  VAL  54          HG23      VAL  54  20.217 -10.157  -5.421

  No H/Q in entry =           9
  In of MODEL   12
    1    H    GLN  55           H        GLN  55  16.555  -7.118  -7.357
    2    HA   GLN  55           HA       GLN  55  14.522  -8.765  -8.434
    3    HB2  GLN  55           HB2      GLN  55  13.783  -7.229  -6.813
    4    HB3  GLN  55           HB3      GLN  55  14.591  -5.870  -7.589
    5    HG2  GLN  55           HG2      GLN  55  12.874  -5.532  -9.084
    6    HG3  GLN  55           HG3      GLN  55  12.537  -7.250  -9.252
    7   HE21  GLN  55          HE21      GLN  55  10.523  -7.779  -8.452
    8   HE22  GLN  55          HE22      GLN  55   9.752  -7.015  -7.148

  No H/Q in entry =           8
  In of MODEL   12
    1    H    THR  56           H        THR  56  16.291  -5.983  -9.793
    2    HA   THR  56           HA       THR  56  14.863  -5.613 -12.147
    3    HB   THR  56           HB       THR  56  17.883  -5.552 -11.977
    4    HG1  THR  56           HG1      THR  56  15.928  -3.680 -11.148
    5   HG21  THR  56          HG21      THR  56  16.507  -5.241 -14.184
    6   HG23  THR  56          HG22      THR  56  17.795  -4.099 -13.803
    7   HG22  THR  56          HG23      THR  56  16.112  -3.663 -13.499

  No H/Q in entry =           7
  In of MODEL   12
    1    H    LYS  57           H        LYS  57  17.491  -7.932 -11.523
    2    HA   LYS  57           HA       LYS  57  17.489  -9.132 -14.099
    3    HB2  LYS  57           HB2      LYS  57  19.271  -9.397 -12.348
    4    HB3  LYS  57           HB3      LYS  57  18.155 -10.381 -11.412
    5    HG2  LYS  57           HG2      LYS  57  18.043 -12.027 -13.219
    6    HG3  LYS  57           HG3      LYS  57  19.099 -11.037 -14.219
    7    HD2  LYS  57           HD2      LYS  57  20.903 -11.274 -12.537
    8    HD3  LYS  57           HD3      LYS  57  19.853 -12.300 -11.562
    9    HE2  LYS  57           HE2      LYS  57  19.715 -13.939 -13.395
   10    HE3  LYS  57           HE3      LYS  57  20.728 -12.917 -14.414
   11    HZ3  LYS  57           HZ1      LYS  57  22.438 -13.993 -13.543
   12    HZ2  LYS  57           HZ2      LYS  57  21.483 -14.723 -12.344
   13    HZ1  LYS  57           HZ3      LYS  57  22.134 -13.175 -12.090

  No H/Q in entry =          13
  In of MODEL   12
    1    H    LEU  58           H        LEU  58  15.693  -9.778 -11.128
    2    HA   LEU  58           HA       LEU  58  14.454 -12.143 -12.061
    3    HB2  LEU  58           HB2      LEU  58  13.669 -10.226  -9.872
    4    HB3  LEU  58           HB3      LEU  58  12.850 -11.758 -10.187
    5    HG   LEU  58           HG       LEU  58  15.824 -11.504  -9.624
    6   HD11  LEU  58          HD11      LEU  58  13.444 -11.897  -7.838
    7   HD13  LEU  58          HD12      LEU  58  14.905 -10.946  -7.573
    8   HD12  LEU  58          HD13      LEU  58  14.962 -12.702  -7.434
    9   HD22  LEU  58          HD21      LEU  58  15.691 -13.566 -10.648
   10   HD21  LEU  58          HD22      LEU  58  13.975 -13.761 -10.292
   11   HD23  LEU  58          HD23      LEU  58  15.177 -14.069  -9.039

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  59           H        ILE  59  13.813  -8.801 -12.752
    2    HA   ILE  59           HA       ILE  59  11.095  -9.429 -13.699
    3    HB   ILE  59           HB       ILE  59  11.917  -7.151 -12.497
    4   HG12  ILE  59          HG12      ILE  59  10.015  -7.017 -14.847
    5   HG13  ILE  59          HG13      ILE  59   9.588  -7.782 -13.337
    6   HG23  ILE  59          HG21      ILE  59  12.503  -5.435 -14.011
    7   HG22  ILE  59          HG22      ILE  59  12.009  -6.362 -15.409
    8   HG21  ILE  59          HG23      ILE  59  13.484  -6.779 -14.543
    9   HD12  ILE  59          HD11      ILE  59  10.447  -4.910 -13.684
   10   HD11  ILE  59          HD12      ILE  59  10.111  -5.670 -12.130
   11   HD13  ILE  59          HD13      ILE  59   8.815  -5.467 -13.309

  No H/Q in entry =          11
  In of MODEL   12
    1    H    GLU  60           H        GLU  60  14.310  -8.607 -14.950
    2    HA   GLU  60           HA       GLU  60  13.541  -8.206 -17.661
    3    HB2  GLU  60           HB2      GLU  60  15.723  -7.486 -16.811
    4    HB3  GLU  60           HB3      GLU  60  16.171  -9.160 -16.493
    5    HG2  GLU  60           HG2      GLU  60  15.993  -9.675 -18.899
    6    HG3  GLU  60           HG3      GLU  60  15.528  -8.007 -19.225

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLY  61           H        GLY  61  14.489 -11.091 -15.837
    2    HA3  GLY  61           HA2      GLY  61  13.940 -12.739 -18.237
    3    HA2  GLY  61           HA3      GLY  61  14.965 -13.227 -16.891

  No H/Q in entry =           3
  In of MODEL   12
    1    H    ASP  62           H        ASP  62  11.860 -11.652 -16.523
    2    HA   ASP  62           HA       ASP  62  10.901 -13.782 -14.845
    3    HB2  ASP  62           HB2      ASP  62   8.888 -12.329 -14.654
    4    HB3  ASP  62           HB3      ASP  62  10.389 -11.505 -14.244

  No H/Q in entry =           4
  In of MODEL   12
    1    H    ALA  63           H        ALA  63  11.010 -13.586 -18.156
    2    HA   ALA  63           HA       ALA  63   8.452 -14.223 -19.096
    3    HB1  ALA  63           HB1      ALA  63  11.108 -15.329 -20.051
    4    HB3  ALA  63           HB2      ALA  63  10.386 -13.806 -20.569
    5    HB2  ALA  63           HB3      ALA  63   9.600 -15.334 -20.969

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLY  64           H        GLY  64  11.010 -16.384 -17.920
    2    HA3  GLY  64           HA2      GLY  64  10.988 -18.559 -17.196
    3    HA2  GLY  64           HA3      GLY  64   9.390 -18.187 -16.562

  No H/Q in entry =           3
  In of MODEL   12
    1    H    GLU  65           H        GLU  65   7.869 -19.571 -17.248
    2    HA   GLU  65           HA       GLU  65   8.229 -21.518 -19.169
    3    HB2  GLU  65           HB2      GLU  65   5.672 -20.256 -18.190
    4    HB3  GLU  65           HB3      GLU  65   5.727 -21.696 -19.207
    5    HG2  GLU  65           HG2      GLU  65   7.067 -22.867 -17.529
    6    HG3  GLU  65           HG3      GLU  65   7.105 -21.423 -16.520

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLY  66           H        GLY  66   6.465 -21.746 -20.974
    2    HA3  GLY  66           HA2      GLY  66   7.295 -20.193 -23.168
    3    HA2  GLY  66           HA3      GLY  66   5.961 -21.330 -23.154

  No H/Q in entry =           3
  In of MODEL   12
    1    H    LYS  67           H        LYS  67   4.397 -20.030 -21.184
    2    HA   LYS  67           HA       LYS  67   3.067 -18.125 -22.850
    3    HB2  LYS  67           HB2      LYS  67   2.489 -19.187 -20.088
    4    HB3  LYS  67           HB3      LYS  67   1.426 -18.069 -20.953
    5    HG2  LYS  67           HG2      LYS  67   1.270 -19.648 -22.833
    6    HG3  LYS  67           HG3      LYS  67   2.353 -20.761 -22.001
    7    HD2  LYS  67           HD2      LYS  67   0.718 -20.990 -20.170
    8    HD3  LYS  67           HD3      LYS  67  -0.368 -19.875 -21.002
    9    HE2  LYS  67           HE2      LYS  67  -0.468 -21.408 -22.934
   10    HE3  LYS  67           HE3      LYS  67   0.613 -22.526 -22.103
   11    HZ2  LYS  67           HZ1      LYS  67  -2.190 -22.194 -21.808
   12    HZ1  LYS  67           HZ2      LYS  67  -1.405 -21.981 -20.317
   13    HZ3  LYS  67           HZ3      LYS  67  -1.185 -23.417 -21.200

  No H/Q in entry =          13
  In of MODEL   12
    1    H    MET  68           H        MET  68   2.443 -16.050 -22.384
    2    HA   MET  68           HA       MET  68   4.389 -14.227 -21.703
    3    HB2  MET  68           HB2      MET  68   1.385 -13.972 -21.706
    4    HB3  MET  68           HB3      MET  68   2.474 -12.599 -21.510
    5    HG2  MET  68           HG2      MET  68   3.551 -13.139 -23.663
    6    HG3  MET  68           HG3      MET  68   2.462 -14.512 -23.863
    7    HE1  MET  68           HE1      MET  68   1.606 -13.895 -26.032
    8    HE3  MET  68           HE2      MET  68   2.614 -12.457 -26.174
    9    HE2  MET  68           HE3      MET  68   0.889 -12.352 -26.517

  No H/Q in entry =           9
  In of MODEL   12
    1    H    LYS  69           H        LYS  69   2.748 -16.153 -19.442
    2    HA   LYS  69           HA       LYS  69   2.405 -14.320 -17.323
    3    HB2  LYS  69           HB2      LYS  69   1.256 -16.486 -17.444
    4    HB3  LYS  69           HB3      LYS  69   2.791 -17.310 -17.155
    5    HG2  LYS  69           HG2      LYS  69   3.029 -16.182 -14.997
    6    HG3  LYS  69           HG3      LYS  69   1.545 -15.274 -15.286
    7    HD2  LYS  69           HD2      LYS  69   0.268 -17.388 -15.352
    8    HD3  LYS  69           HD3      LYS  69   1.753 -18.289 -15.038
    9    HE2  LYS  69           HE2      LYS  69   2.034 -17.090 -12.899
   10    HE3  LYS  69           HE3      LYS  69   0.551 -16.188 -13.211
   11    HZ2  LYS  69           HZ1      LYS  69   0.741 -18.599 -11.940
   12    HZ1  LYS  69           HZ2      LYS  69   0.167 -18.999 -13.486
   13    HZ3  LYS  69           HZ3      LYS  69  -0.680 -17.884 -12.524

  No H/Q in entry =          13
  In of MODEL   12
    1    H    VAL  70           H        VAL  70   3.506 -14.026 -15.325
    2    HA   VAL  70           HA       VAL  70   6.419 -14.583 -15.438
    3    HB   VAL  70           HB       VAL  70   6.676 -12.504 -14.097
    4   HG11  VAL  70          HG11      VAL  70   5.399 -12.491 -16.815
    5   HG13  VAL  70          HG12      VAL  70   7.059 -12.100 -16.365
    6   HG12  VAL  70          HG13      VAL  70   5.760 -10.957 -16.024
    7   HG21  VAL  70          HG21      VAL  70   3.675 -12.299 -14.560
    8   HG23  VAL  70          HG22      VAL  70   4.678 -10.960 -14.005
    9   HG22  VAL  70          HG23      VAL  70   4.498 -12.400 -13.003

  No H/Q in entry =           9
  In of MODEL   12
    1    H    SER  71           H        SER  71   7.439 -14.637 -13.251
    2    HA   SER  71           HA       SER  71   6.287 -16.596 -11.577
    3    HB2  SER  71           HB2      SER  71   8.731 -16.093 -11.715
    4    HB3  SER  71           HB3      SER  71   8.433 -14.583 -10.855
    5    HG   SER  71           HG       SER  71   8.148 -17.250  -9.976

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU  72           H        LEU  72   4.912 -16.456  -9.921
    2    HA   LEU  72           HA       LEU  72   3.381 -14.129  -9.486
    3    HB2  LEU  72           HB2      LEU  72   3.641 -16.687  -7.913
    4    HB3  LEU  72           HB3      LEU  72   2.484 -15.420  -7.515
    5    HG   LEU  72           HG       LEU  72   2.634 -16.712 -10.258
    6   HD13  LEU  72          HD11      LEU  72   2.084 -18.409  -8.554
    7   HD12  LEU  72          HD12      LEU  72   0.673 -18.039  -9.545
    8   HD11  LEU  72          HD13      LEU  72   0.812 -17.365  -7.921
    9   HD23  LEU  72          HD21      LEU  72   0.151 -15.877 -10.153
   10   HD22  LEU  72          HD22      LEU  72   1.408 -14.695 -10.484
   11   HD21  LEU  72          HD23      LEU  72   0.729 -14.827  -8.864

  No H/Q in entry =          11
  In of MODEL   12
    1    H    VAL  73           H        VAL  73   6.018 -15.586  -7.701
    2    HA   VAL  73           HA       VAL  73   5.962 -14.049  -5.371
    3    HB   VAL  73           HB       VAL  73   8.137 -14.876  -4.935
    4   HG12  VAL  73          HG11      VAL  73   6.979 -16.974  -6.768
    5   HG11  VAL  73          HG12      VAL  73   6.185 -16.537  -5.256
    6   HG13  VAL  73          HG13      VAL  73   7.819 -17.198  -5.235
    7   HG21  VAL  73          HG21      VAL  73   8.325 -14.936  -7.927
    8   HG23  VAL  73          HG22      VAL  73   9.301 -16.067  -6.994
    9   HG22  VAL  73          HG23      VAL  73   9.489 -14.330  -6.748

  No H/Q in entry =           9
  In of MODEL   12
    1    H    LEU  74           H        LEU  74   6.972 -13.168  -8.545
    2    HA   LEU  74           HA       LEU  74   8.932 -11.236  -8.047
    3    HB2  LEU  74           HB2      LEU  74   8.482 -11.981 -10.286
    4    HB3  LEU  74           HB3      LEU  74   6.819 -11.407 -10.193
    5    HG   LEU  74           HG       LEU  74   7.630  -9.083  -9.980
    6   HD11  LEU  74          HD11      LEU  74  10.310 -10.476 -10.085
    7   HD13  LEU  74          HD12      LEU  74   9.742  -9.294  -8.907
    8   HD12  LEU  74          HD13      LEU  74  10.131  -8.784 -10.549
    9   HD22  LEU  74          HD21      LEU  74   7.970  -8.858 -12.235
   10   HD21  LEU  74          HD22      LEU  74   7.402 -10.511 -12.180
   11   HD23  LEU  74          HD23      LEU  74   9.117 -10.194 -12.305

  No H/Q in entry =          11
  In of MODEL   12
    1    H    VAL  75           H        VAL  75   5.441 -10.821  -8.415
    2    HA   VAL  75           HA       VAL  75   5.366  -8.063  -7.833
    3    HB   VAL  75           HB       VAL  75   3.255 -10.186  -7.445
    4   HG13  VAL  75          HG11      VAL  75   2.787  -8.248  -5.987
    5   HG12  VAL  75          HG12      VAL  75   1.701  -8.221  -7.368
    6   HG11  VAL  75          HG13      VAL  75   3.092  -7.149  -7.328
    7   HG21  VAL  75          HG21      VAL  75   4.178  -9.654  -9.774
    8   HG23  VAL  75          HG22      VAL  75   3.518  -8.033  -9.563
    9   HG22  VAL  75          HG23      VAL  75   2.440  -9.430  -9.575

  No H/Q in entry =           9
  In of MODEL   12
    1    H    GLU  76           H        GLU  76   5.079 -10.935  -5.720
    2    HA   GLU  76           HA       GLU  76   4.610  -9.566  -3.303
    3    HB2  GLU  76           HB2      GLU  76   4.412 -12.030  -3.530
    4    HB3  GLU  76           HB3      GLU  76   6.148 -12.148  -3.769
    5    HG2  GLU  76           HG2      GLU  76   5.709 -12.719  -1.472
    6    HG3  GLU  76           HG3      GLU  76   6.456 -11.133  -1.461

  No H/Q in entry =           6
  In of MODEL   12
    1    H    ALA  77           H        ALA  77   7.668 -10.503  -4.851
    2    HA   ALA  77           HA       ALA  77   9.357  -9.471  -2.829
    3    HB2  ALA  77           HB1      ALA  77  11.131  -9.812  -4.332
    4    HB3  ALA  77           HB2      ALA  77  10.110  -9.530  -5.742
    5    HB1  ALA  77           HB3      ALA  77   9.940 -11.019  -4.814

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLN  78           H        GLN  78   7.992  -8.046  -5.751
    2    HA   GLN  78           HA       GLN  78   9.366  -5.578  -5.644
    3    HB2  GLN  78           HB2      GLN  78   8.071  -6.484  -7.607
    4    HB3  GLN  78           HB3      GLN  78   6.588  -6.093  -6.739
    5    HG2  GLN  78           HG2      GLN  78   7.263  -3.727  -6.643
    6    HG3  GLN  78           HG3      GLN  78   8.748  -4.112  -7.512
    7   HE21  GLN  78          HE21      GLN  78   6.839  -2.273  -8.605
    8   HE22  GLN  78          HE22      GLN  78   6.148  -2.982  -9.984

  No H/Q in entry =           8
  In of MODEL   12
    1    H    LEU  79           H        LEU  79   6.329  -6.687  -4.227
    2    HA   LEU  79           HA       LEU  79   5.353  -4.269  -3.226
    3    HB2  LEU  79           HB2      LEU  79   4.019  -6.308  -3.174
    4    HB3  LEU  79           HB3      LEU  79   5.151  -7.056  -2.052
    5    HG   LEU  79           HG       LEU  79   4.606  -5.407  -0.330
    6   HD13  LEU  79          HD11      LEU  79   4.164  -3.389  -1.386
    7   HD12  LEU  79          HD12      LEU  79   2.532  -3.899  -0.955
    8   HD11  LEU  79          HD13      LEU  79   3.119  -4.129  -2.600
    9   HD23  LEU  79          HD21      LEU  79   2.014  -5.875  -0.253
   10   HD22  LEU  79          HD22      LEU  79   3.140  -7.224  -0.136
   11   HD21  LEU  79          HD23      LEU  79   2.338  -6.882  -1.666

  No H/Q in entry =          11
  In of MODEL   12
    1    H    HIS  80           H        HIS  80   7.505  -6.622  -1.629
    2    HA   HIS  80           HA       HIS  80   7.795  -5.079   0.740
    3    HB2  HIS  80           HB2      HIS  80   9.117  -7.458  -0.449
    4    HB3  HIS  80           HB3      HIS  80  10.030  -6.568   0.772
    5    HD1  HIS  80           HD1      HIS  80   9.520  -7.196   3.113
    6    HD2  HIS  80           HD2      HIS  80   6.309  -8.019   0.585
    7    HE1  HIS  80           HE1      HIS  80   7.730  -8.280   4.553
    8    HE2  HIS  80           HE2      HIS  80   5.766  -8.785   3.020

  No H/Q in entry =           8
  In of MODEL   12
    1    H    LEU  81           H        LEU  81   9.814  -5.379  -2.161
    2    HA   LEU  81           HA       LEU  81  11.870  -3.657  -1.274
    3    HB2  LEU  81           HB2      LEU  81  10.956  -4.444  -4.041
    4    HB3  LEU  81           HB3      LEU  81  12.385  -3.452  -3.744
    5    HG   LEU  81           HG       LEU  81  11.958  -6.167  -2.469
    6   HD12  LEU  81          HD11      LEU  81  13.777  -6.814  -4.207
    7   HD11  LEU  81          HD12      LEU  81  13.231  -5.386  -5.084
    8   HD13  LEU  81          HD13      LEU  81  12.104  -6.698  -4.751
    9   HD23  LEU  81          HD21      LEU  81  14.589  -5.878  -2.440
   10   HD22  LEU  81          HD22      LEU  81  13.608  -5.106  -1.197
   11   HD21  LEU  81          HD23      LEU  81  14.203  -4.162  -2.562

  No H/Q in entry =          11
  In of MODEL   12
    1    H    MET  82           H        MET  82   8.964  -2.994  -3.228
    2    HA   MET  82           HA       MET  82   9.535  -0.274  -3.730
    3    HB2  MET  82           HB2      MET  82   6.959  -1.842  -3.617
    4    HB3  MET  82           HB3      MET  82   6.978  -0.118  -3.984
    5    HG2  MET  82           HG2      MET  82   8.566  -2.210  -5.507
    6    HG3  MET  82           HG3      MET  82   7.008  -1.572  -6.029
    7    HE3  MET  82           HE1      MET  82   7.499   1.876  -7.203
    8    HE2  MET  82           HE2      MET  82   7.112   1.656  -5.498
    9    HE1  MET  82           HE3      MET  82   6.442   0.552  -6.695

  No H/Q in entry =           9
  In of MODEL   12
    1    H    THR  83           H        THR  83   7.712  -1.850  -1.133
    2    HA   THR  83           HA       THR  83   6.878   0.509   0.186
    3    HB   THR  83           HB       THR  83   6.715  -1.061   2.205
    4    HG1  THR  83           HG1      THR  83   7.453  -3.019   1.982
    5   HG22  THR  83          HG21      THR  83   5.054  -2.612   0.730
    6   HG21  THR  83          HG22      THR  83   5.301  -1.287  -0.403
    7   HG23  THR  83          HG23      THR  83   4.655  -0.963   1.206

  No H/Q in entry =           7
  In of MODEL   12
    1    H    SER  84           H        SER  84   9.676  -1.618   0.726
    2    HA   SER  84           HA       SER  84  10.738  -0.196   2.918
    3    HB2  SER  84           HB2      SER  84  11.983  -2.055   0.903
    4    HB3  SER  84           HB3      SER  84  12.930  -1.310   2.189
    5    HG   SER  84           HG       SER  84  10.636  -2.974   2.437

  No H/Q in entry =           5
  In of MODEL   12
    1    H    MET  85           H        MET  85  11.514   0.052  -0.566
    2    HA   MET  85           HA       MET  85  13.532   1.996  -0.306
    3    HB2  MET  85           HB2      MET  85  13.128   0.712  -2.372
    4    HB3  MET  85           HB3      MET  85  11.618   1.591  -2.613
    5    HG2  MET  85           HG2      MET  85  12.855   3.716  -2.731
    6    HG3  MET  85           HG3      MET  85  14.368   2.857  -2.453
    7    HE3  MET  85           HE1      MET  85  11.312   1.655  -5.160
    8    HE2  MET  85           HE2      MET  85  11.682   3.138  -6.036
    9    HE1  MET  85           HE3      MET  85  11.278   3.216  -4.326

  No H/Q in entry =           9
  In of MODEL   12
    1    H    LEU  86           H        LEU  86  10.049   2.368  -0.836
    2    HA   LEU  86           HA       LEU  86  10.018   5.181  -1.022
    3    HB2  LEU  86           HB2      LEU  86   8.158   3.541  -1.606
    4    HB3  LEU  86           HB3      LEU  86   7.818   3.458   0.122
    5    HG   LEU  86           HG       LEU  86   7.686   6.020   0.065
    6   HD11  LEU  86          HD11      LEU  86   8.472   5.572  -2.632
    7   HD13  LEU  86          HD12      LEU  86   8.049   7.105  -1.876
    8   HD12  LEU  86          HD13      LEU  86   6.807   6.155  -2.686
    9   HD23  LEU  86          HD21      LEU  86   5.547   4.689  -1.608
   10   HD22  LEU  86          HD22      LEU  86   5.364   5.953  -0.394
   11   HD21  LEU  86          HD23      LEU  86   5.742   4.305   0.103

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ALA  87           H        ALA  87   9.511   3.012   1.725
    2    HA   ALA  87           HA       ALA  87   8.973   4.935   3.688
    3    HB1  ALA  87           HB1      ALA  87   9.749   2.106   3.610
    4    HB3  ALA  87           HB2      ALA  87   8.627   2.932   4.689
    5    HB2  ALA  87           HB3      ALA  87  10.354   2.945   5.042

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ARG  88           H        ARG  88  12.046   3.474   2.727
    2    HA   ARG  88           HA       ARG  88  13.661   4.836   4.567
    3    HB2  ARG  88           HB2      ARG  88  14.314   2.853   3.169
    4    HB3  ARG  88           HB3      ARG  88  14.487   3.943   1.796
    5    HG2  ARG  88           HG2      ARG  88  15.964   5.242   3.749
    6    HG3  ARG  88           HG3      ARG  88  16.263   3.550   4.132
    7    HD2  ARG  88           HD2      ARG  88  17.537   3.236   2.293
    8    HD3  ARG  88           HD3      ARG  88  16.416   4.119   1.252
    9    HE   ARG  88           HE       ARG  88  18.817   5.157   2.311
   10   HH21  ARG  88          HH11      ARG  88  19.189   7.371   2.115
   11   HH22  ARG  88          HH12      ARG  88  17.851   8.458   1.963
   12   HH11  ARG  88          HH21      ARG  88  15.488   5.948   2.013
   13   HH12  ARG  88          HH22      ARG  88  15.754   7.650   1.881

  No H/Q in entry =          13
  In of MODEL   12
    1    H    GLU  89           H        GLU  89  12.716   5.741   1.237
    2    HA   GLU  89           HA       GLU  89  14.291   8.083   1.086
    3    HB2  GLU  89           HB2      GLU  89  13.145   7.052  -0.867
    4    HB3  GLU  89           HB3      GLU  89  11.603   7.612  -0.219
    5    HG2  GLU  89           HG2      GLU  89  12.333   9.941  -0.380
    6    HG3  GLU  89           HG3      GLU  89  13.934   9.431  -0.908

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LEU  90           H        LEU  90  10.950   7.613   2.198
    2    HA   LEU  90           HA       LEU  90  10.463  10.353   2.766
    3    HB2  LEU  90           HB2      LEU  90   9.233   7.794   3.791
    4    HB3  LEU  90           HB3      LEU  90   8.618   9.397   4.208
    5    HG   LEU  90           HG       LEU  90   9.042   8.509   1.342
    6   HD12  LEU  90          HD11      LEU  90   6.504   8.209   1.391
    7   HD11  LEU  90          HD12      LEU  90   6.650   8.199   3.149
    8   HD13  LEU  90          HD13      LEU  90   7.459   6.959   2.191
    9   HD22  LEU  90          HD21      LEU  90   8.775  10.820   1.264
   10   HD21  LEU  90          HD22      LEU  90   7.781  10.865   2.719
   11   HD23  LEU  90          HD23      LEU  90   7.086  10.316   1.194

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  91           H        ILE  91  11.685   7.660   4.699
    2    HA   ILE  91           HA       ILE  91  11.828   9.027   7.166
    3    HB   ILE  91           HB       ILE  91  13.361   6.669   6.054
    4   HG12  ILE  91          HG12      ILE  91  11.334   6.862   8.302
    5   HG13  ILE  91          HG13      ILE  91  10.870   6.584   6.625
    6   HG22  ILE  91          HG21      ILE  91  13.814   6.454   8.697
    7   HG21  ILE  91          HG22      ILE  91  13.759   8.213   8.594
    8   HG23  ILE  91          HG23      ILE  91  14.932   7.310   7.636
    9   HD13  ILE  91          HD11      ILE  91  11.849   4.471   6.563
   10   HD12  ILE  91          HD12      ILE  91  11.247   4.539   8.219
   11   HD11  ILE  91          HD13      ILE  91  12.954   4.832   7.890

  No H/Q in entry =          11
  In of MODEL   12
    1    H    THR  92           H        THR  92  14.057   8.828   4.426
    2    HA   THR  92           HA       THR  92  16.232  10.198   5.595
    3    HB   THR  92           HB       THR  92  15.259  10.081   2.730
    4    HG1  THR  92           HG1      THR  92  16.067   8.175   3.142
    5   HG22  THR  92          HG21      THR  92  17.839  10.741   2.449
    6   HG21  THR  92          HG22      THR  92  17.532  11.568   3.976
    7   HG23  THR  92          HG23      THR  92  16.574  11.964   2.549

  No H/Q in entry =           7
  In of MODEL   12
    1    H    GLU  93           H        GLU  93  13.367  11.382   3.850
    2    HA   GLU  93           HA       GLU  93  13.992  14.136   3.964
    3    HB2  GLU  93           HB2      GLU  93  11.273  12.794   3.965
    4    HB3  GLU  93           HB3      GLU  93  11.582  14.490   3.593
    5    HG2  GLU  93           HG2      GLU  93  12.902  12.231   2.075
    6    HG3  GLU  93           HG3      GLU  93  11.366  12.930   1.579

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LEU  94           H        LEU  94  12.214  12.003   6.168
    2    HA   LEU  94           HA       LEU  94  11.417  13.961   8.038
    3    HB2  LEU  94           HB2      LEU  94  11.958  11.000   8.319
    4    HB3  LEU  94           HB3      LEU  94  11.390  11.984   9.665
    5    HG   LEU  94           HG       LEU  94   9.920  12.049   7.028
    6   HD11  LEU  94          HD11      LEU  94   9.968   9.830   9.036
    7   HD13  LEU  94          HD12      LEU  94   9.674   9.769   7.299
    8   HD12  LEU  94          HD13      LEU  94   8.396  10.302   8.390
    9   HD23  LEU  94          HD21      LEU  94   7.997  12.472   8.618
   10   HD22  LEU  94          HD22      LEU  94   9.250  13.712   8.660
   11   HD21  LEU  94          HD23      LEU  94   9.167  12.498   9.935

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  95           H        ILE  95  14.370  11.998   7.819
    2    HA   ILE  95           HA       ILE  95  15.535  12.910  10.237
    3    HB   ILE  95           HB       ILE  95  16.775  11.823   7.697
    4   HG12  ILE  95          HG12      ILE  95  16.452  10.630  10.465
    5   HG13  ILE  95          HG13      ILE  95  15.289  10.383   9.164
    6   HG21  ILE  95          HG21      ILE  95  18.026  12.619  10.345
    7   HG23  ILE  95          HG22      ILE  95  18.503  13.140   8.727
    8   HG22  ILE  95          HG23      ILE  95  18.788  11.477   9.239
    9   HD13  ILE  95          HD11      ILE  95  16.761   9.086   7.910
   10   HD12  ILE  95          HD12      ILE  95  17.220   8.634   9.549
   11   HD11  ILE  95          HD13      ILE  95  18.191   9.801   8.653

  No H/Q in entry =          11
  In of MODEL   12
    1    H    GLU  96           H        GLU  96  15.721  14.137   6.902
    2    HA   GLU  96           HA       GLU  96  17.588  16.195   7.386
    3    HB2  GLU  96           HB2      GLU  96  16.928  15.537   5.124
    4    HB3  GLU  96           HB3      GLU  96  15.290  16.113   5.415
    5    HG2  GLU  96           HG2      GLU  96  15.883  18.235   4.873
    6    HG3  GLU  96           HG3      GLU  96  17.175  18.222   6.062

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LEU  97           H        LEU  97  14.073  16.048   7.798
    2    HA   LEU  97           HA       LEU  97  13.685  18.788   8.434
    3    HB2  LEU  97           HB2      LEU  97  12.135  16.280   9.044
    4    HB3  LEU  97           HB3      LEU  97  11.636  17.834   9.711
    5    HG   LEU  97           HG       LEU  97  12.129  17.408   6.749
    6   HD12  LEU  97          HD11      LEU  97   9.605  17.309   6.618
    7   HD11  LEU  97          HD12      LEU  97   9.587  17.112   8.369
    8   HD13  LEU  97          HD13      LEU  97  10.359  15.894   7.352
    9   HD23  LEU  97          HD21      LEU  97  10.413  19.392   6.770
   10   HD22  LEU  97          HD22      LEU  97  12.097  19.733   7.170
   11   HD21  LEU  97          HD23      LEU  97  10.900  19.578   8.455

  No H/Q in entry =          11
  In of MODEL   12
    1    H    HIS  98           H        HIS  98  14.464  15.955  10.437
    2    HA   HIS  98           HA       HIS  98  14.309  17.221  12.951
    3    HB2  HIS  98           HB2      HIS  98  16.037  14.942  11.961
    4    HB3  HIS  98           HB3      HIS  98  16.034  15.483  13.641
    5    HD1  HIS  98           HD1      HIS  98  13.829  13.875  11.040
    6    HD2  HIS  98           HD2      HIS  98  13.712  14.801  15.103
    7    HE1  HIS  98           HE1      HIS  98  11.785  12.705  11.984
    8    HE2  HIS  98           HE2      HIS  98  11.695  13.261  14.454

  No H/Q in entry =           8
  In of MODEL   12
    1    H    GLU  99           H        GLU  99  16.872  17.073  10.529
    2    HA   GLU  99           HA       GLU  99  18.866  18.384  12.066
    3    HB2  GLU  99           HB2      GLU  99  19.340  17.088  10.001
    4    HB3  GLU  99           HB3      GLU  99  18.549  18.351   9.054
    5    HG2  GLU  99           HG2      GLU  99  20.173  20.004   9.851
    6    HG3  GLU  99           HG3      GLU  99  20.933  18.794  10.879

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LYS 100           H        LYS 100  16.366  19.572   9.836
    2    HA   LYS 100           HA       LYS 100  17.195  22.300   9.980
    3    HB2  LYS 100           HB2      LYS 100  14.551  21.041   9.215
    4    HB3  LYS 100           HB3      LYS 100  14.871  22.776   9.123
    5    HG2  LYS 100           HG2      LYS 100  16.845  22.302   7.667
    6    HG3  LYS 100           HG3      LYS 100  16.411  20.590   7.685
    7    HD2  LYS 100           HD2      LYS 100  14.227  21.125   6.673
    8    HD3  LYS 100           HD3      LYS 100  14.644  22.839   6.662
    9    HE2  LYS 100           HE2      LYS 100  16.604  22.333   5.213
   10    HE3  LYS 100           HE3      LYS 100  16.119  20.634   5.179
   11    HZ1  LYS 100           HZ1      LYS 100  14.324  22.847   4.333
   12    HZ3  LYS 100           HZ2      LYS 100  14.121  21.180   4.072
   13    HZ2  LYS 100           HZ3      LYS 100  15.346  22.026   3.255

  No H/Q in entry =          13
  In of MODEL   12
    1    H    LEU 101           H        LEU 101  15.064  20.282  11.938
    2    HA   LEU 101           HA       LEU 101  13.915  22.365  13.508
    3    HB2  LEU 101           HB2      LEU 101  14.320  19.411  13.897
    4    HB3  LEU 101           HB3      LEU 101  13.789  20.400  15.255
    5    HG   LEU 101           HG       LEU 101  12.385  20.502  12.579
    6   HD12  LEU 101          HD11      LEU 101  10.701  18.959  13.841
    7   HD11  LEU 101          HD12      LEU 101  12.086  18.531  14.843
    8   HD13  LEU 101          HD13      LEU 101  12.124  18.222  13.107
    9   HD21  LEU 101          HD21      LEU 101  11.724  21.306  15.427
   10   HD23  LEU 101          HD22      LEU 101  10.466  21.094  14.211
   11   HD22  LEU 101          HD23      LEU 101  11.717  22.314  13.977

  No H/Q in entry =          11
  In of MODEL   12
    1    H    LYS 102           H        LYS 102  17.057  21.719  13.087
    2    HA   LYS 102           HA       LYS 102  18.909  22.569  14.168
    3    HB2  LYS 102           HB2      LYS 102  17.108  24.107  15.291
    4    HB3  LYS 102           HB3      LYS 102  17.295  23.044  16.670
    5    HG2  LYS 102           HG2      LYS 102  19.218  25.030  15.507
    6    HG3  LYS 102           HG3      LYS 102  18.825  24.723  17.185
    7    HD2  LYS 102           HD2      LYS 102  20.476  22.788  15.509
    8    HD3  LYS 102           HD3      LYS 102  21.177  24.103  16.444
    9    HE2  LYS 102           HE2      LYS 102  20.743  21.560  17.413
   10    HE3  LYS 102           HE3      LYS 102  20.975  23.000  18.404
   11    HZ2  LYS 102           HZ1      LYS 102  18.988  21.741  19.014
   12    HZ1  LYS 102           HZ2      LYS 102  18.354  21.977  17.462
   13    HZ3  LYS 102           HZ3      LYS 102  18.595  23.305  18.487

  No H/Q in entry =          13
  In of MODEL   12
    1    H    ALA 103           H        ALA 103  16.806  20.992  16.581
    2    HA   ALA 103           HA       ALA 103  18.510  19.762  18.246
    3    HB2  ALA 103           HB1      ALA 103  16.902  17.774  18.235
    4    HB1  ALA 103           HB2      ALA 103  16.023  18.637  16.972
    5    HB3  ALA 103           HB3      ALA 103  16.202  19.357  18.571

  No H/Q in entry =           5
  In of MODEL   12
    1    H1   ALA   1           H3       ALA   1  -1.559  -6.889 -21.441
    2    H2   ALA   1           H2       ALA   1  -2.374  -8.314 -20.990
    3    H3   ALA   1           H1       ALA   1  -0.764  -8.385 -21.537
    4    HA   ALA   1           HA       ALA   1  -1.594  -8.846 -23.537
    5    HB1  ALA   1           HB1      ALA   1  -3.742  -9.536 -23.073
    6    HB2  ALA   1           HB2      ALA   1  -4.158  -8.021 -23.874
    7    HB3  ALA   1           HB3      ALA   1  -4.107  -8.100 -22.115

  No H/Q in entry =           7
  In of MODEL   12
    1    H    GLU   2           H        GLU   2  -2.399  -7.647 -25.531
    2    HA   GLU   2           HA       GLU   2  -0.971  -5.652 -26.404
    3    HB2  GLU   2           HB2      GLU   2  -3.977  -5.681 -26.736
    4    HB3  GLU   2           HB3      GLU   2  -2.840  -4.833 -27.781
    5    HG2  GLU   2           HG2      GLU   2  -2.355  -6.731 -28.932
    6    HG3  GLU   2           HG3      GLU   2  -2.077  -7.638 -27.452

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLU   3           H        GLU   3  -4.119  -4.354 -25.520
    2    HA   GLU   3           HA       GLU   3  -3.043  -1.811 -24.889
    3    HB2  GLU   3           HB2      GLU   3  -5.749  -3.091 -24.569
    4    HB3  GLU   3           HB3      GLU   3  -5.434  -1.479 -23.923
    5    HG2  GLU   3           HG2      GLU   3  -5.055  -0.558 -26.048
    6    HG3  GLU   3           HG3      GLU   3  -4.676  -2.119 -26.769

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LEU   4           H        LEU   4  -4.674  -4.147 -22.715
    2    HA   LEU   4           HA       LEU   4  -4.306  -2.921 -20.324
    3    HB2  LEU   4           HB2      LEU   4  -3.799  -5.870 -20.788
    4    HB3  LEU   4           HB3      LEU   4  -4.203  -5.117 -19.247
    5    HG   LEU   4           HG       LEU   4  -5.964  -5.170 -21.720
    6   HD13  LEU   4          HD11      LEU   4  -7.184  -6.871 -20.726
    7   HD12  LEU   4          HD12      LEU   4  -6.701  -6.416 -19.093
    8   HD11  LEU   4          HD13      LEU   4  -5.571  -7.275 -20.138
    9   HD23  LEU   4          HD21      LEU   4  -7.647  -4.336 -19.861
   10   HD22  LEU   4          HD22      LEU   4  -6.590  -3.179 -20.667
   11   HD21  LEU   4          HD23      LEU   4  -6.179  -3.773 -19.059

  No H/Q in entry =          11
  In of MODEL   12
    1    H    GLU   5           H        GLU   5  -1.823  -4.798 -22.040
    2    HA   GLU   5           HA       GLU   5   0.154  -4.538 -19.994
    3    HB2  GLU   5           HB2      GLU   5   0.205  -6.310 -21.743
    4    HB3  GLU   5           HB3      GLU   5   0.540  -5.072 -22.954
    5    HG2  GLU   5           HG2      GLU   5   2.603  -4.450 -21.765
    6    HG3  GLU   5           HG3      GLU   5   2.271  -5.670 -20.536

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLU   6           H        GLU   6  -0.444  -2.819 -23.043
    2    HA   GLU   6           HA       GLU   6   1.748  -1.015 -22.766
    3    HB2  GLU   6           HB2      GLU   6  -0.807  -0.866 -24.381
    4    HB3  GLU   6           HB3      GLU   6   0.495   0.317 -24.496
    5    HG2  GLU   6           HG2      GLU   6   0.865  -2.658 -24.936
    6    HG3  GLU   6           HG3      GLU   6   0.621  -1.495 -26.236

  No H/Q in entry =           6
  In of MODEL   12
    1    H    VAL   7           H        VAL   7  -1.597  -1.042 -21.738
    2    HA   VAL   7           HA       VAL   7  -1.787   1.673 -20.905
    3    HB   VAL   7           HB       VAL   7  -3.286  -0.824 -20.074
    4   HG11  VAL   7          HG11      VAL   7  -3.628   2.070 -19.264
    5   HG13  VAL   7          HG12      VAL   7  -3.552   0.645 -18.227
    6   HG12  VAL   7          HG13      VAL   7  -4.976   0.932 -19.227
    7   HG21  VAL   7          HG21      VAL   7  -3.417   0.252 -22.464
    8   HG23  VAL   7          HG22      VAL   7  -4.350   1.513 -21.658
    9   HG22  VAL   7          HG23      VAL   7  -4.918  -0.157 -21.632

  No H/Q in entry =           9
  In of MODEL   12
    1    H    VAL   8           H        VAL   8  -0.846  -1.323 -19.254
    2    HA   VAL   8           HA       VAL   8  -0.527  -0.245 -16.658
    3    HB   VAL   8           HB       VAL   8   0.850  -2.581 -18.007
    4   HG13  VAL   8          HG11      VAL   8   2.283  -2.013 -16.217
    5   HG12  VAL   8          HG12      VAL   8   1.216  -3.233 -15.522
    6   HG11  VAL   8          HG13      VAL   8   0.942  -1.525 -15.181
    7   HG22  VAL   8          HG21      VAL   8  -0.949  -3.862 -17.340
    8   HG21  VAL   8          HG22      VAL   8  -1.796  -2.319 -17.304
    9   HG23  VAL   8          HG23      VAL   8  -1.129  -2.989 -15.820

  No H/Q in entry =           9
  In of MODEL   12
    1    H    MET   9           H        MET   9   1.731  -0.577 -19.394
    2    HA   MET   9           HA       MET   9   4.024   0.436 -18.122
    3    HB2  MET   9           HB2      MET   9   3.092   0.479 -20.991
    4    HB3  MET   9           HB3      MET   9   4.617   1.217 -20.505
    5    HG2  MET   9           HG2      MET   9   5.375  -0.921 -19.566
    6    HG3  MET   9           HG3      MET   9   3.835  -1.668 -19.993
    7    HE1  MET   9           HE1      MET   9   6.717   0.305 -20.968
    8    HE3  MET   9           HE2      MET   9   6.074   0.889 -22.499
    9    HE2  MET   9           HE3      MET   9   7.329  -0.347 -22.493

  No H/Q in entry =           9
  In of MODEL   12
    1    H    GLY  10           H        GLY  10   1.370   2.073 -19.814
    2    HA3  GLY  10           HA2      GLY  10   2.368   4.713 -19.567
    3    HA2  GLY  10           HA3      GLY  10   0.674   4.276 -19.779

  No H/Q in entry =           3
  In of MODEL   12
    1    H    LEU  11           H        LEU  11   0.243   2.756 -17.494
    2    HA   LEU  11           HA       LEU  11  -0.269   4.742 -15.538
    3    HB2  LEU  11           HB2      LEU  11  -0.244   1.726 -15.380
    4    HB3  LEU  11           HB3      LEU  11  -0.745   2.757 -14.040
    5    HG   LEU  11           HG       LEU  11  -1.970   2.886 -16.810
    6   HD13  LEU  11          HD11      LEU  11  -2.587   0.751 -16.056
    7   HD12  LEU  11          HD12      LEU  11  -3.926   1.762 -15.517
    8   HD11  LEU  11          HD13      LEU  11  -2.682   1.265 -14.371
    9   HD22  LEU  11          HD21      LEU  11  -2.537   4.910 -15.807
   10   HD21  LEU  11          HD22      LEU  11  -2.479   4.244 -14.175
   11   HD23  LEU  11          HD23      LEU  11  -3.854   3.897 -15.223

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  12           H        ILE  12   2.240   2.240 -15.768
    2    HA   ILE  12           HA       ILE  12   3.442   2.762 -13.259
    3    HB   ILE  12           HB       ILE  12   4.693   1.703 -15.815
    4   HG12  ILE  12          HG12      ILE  12   2.657   0.501 -14.680
    5   HG13  ILE  12          HG13      ILE  12   4.047  -0.455 -15.156
    6   HG21  ILE  12          HG21      ILE  12   5.652   1.646 -12.936
    7   HG23  ILE  12          HG22      ILE  12   6.451   2.412 -14.309
    8   HG22  ILE  12          HG23      ILE  12   6.343   0.655 -14.220
    9   HD13  ILE  12          HD11      ILE  12   4.856  -0.468 -12.872
   10   HD12  ILE  12          HD12      ILE  12   3.168  -0.979 -12.872
   11   HD11  ILE  12          HD13      ILE  12   3.592   0.647 -12.382

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  13           H        ILE  13   4.075   4.015 -16.514
    2    HA   ILE  13           HA       ILE  13   6.233   5.705 -15.781
    3    HB   ILE  13           HB       ILE  13   4.215   5.807 -18.036
    4   HG12  ILE  13          HG12      ILE  13   6.026   3.948 -17.756
    5   HG13  ILE  13          HG13      ILE  13   5.813   4.703 -19.331
    6   HG21  ILE  13          HG21      ILE  13   6.606   7.588 -17.509
    7   HG23  ILE  13          HG22      ILE  13   4.943   8.082 -17.804
    8   HG22  ILE  13          HG23      ILE  13   5.902   7.403 -19.116
    9   HD12  ILE  13          HD11      ILE  13   8.247   4.444 -18.275
   10   HD11  ILE  13          HD12      ILE  13   7.781   5.913 -17.424
   11   HD13  ILE  13          HD13      ILE  13   7.805   5.889 -19.184

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ASN  14           H        ASN  14   2.735   6.249 -16.064
    2    HA   ASN  14           HA       ASN  14   2.729   8.996 -15.429
    3    HB2  ASN  14           HB2      ASN  14   0.816   7.381 -16.267
    4    HB3  ASN  14           HB3      ASN  14   0.485   7.208 -14.548
    5   HD21  ASN  14          HD21      ASN  14  -1.512   8.391 -15.990
    6   HD22  ASN  14          HD22      ASN  14  -1.552  10.065 -15.724

  No H/Q in entry =           6
  In of MODEL   12
    1    H    SER  15           H        SER  15   2.384   6.125 -13.352
    2    HA   SER  15           HA       SER  15   2.086   7.501 -10.906
    3    HB2  SER  15           HB2      SER  15   2.612   5.409  -9.853
    4    HB3  SER  15           HB3      SER  15   1.768   5.003 -11.344
    5    HG   SER  15           HG       SER  15   4.516   4.860 -10.745

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLY  16           H        GLY  16   4.954   6.363 -12.652
    2    HA3  GLY  16           HA2      GLY  16   6.881   7.095 -10.714
    3    HA2  GLY  16           HA3      GLY  16   7.189   6.887 -12.436

  No H/Q in entry =           3
  In of MODEL   12
    1    H    GLN  17           H        GLN  17   5.531   8.867 -13.507
    2    HA   GLN  17           HA       GLN  17   7.138  11.187 -13.194
    3    HB2  GLN  17           HB2      GLN  17   5.843  10.752 -15.246
    4    HB3  GLN  17           HB3      GLN  17   4.340  10.931 -14.339
    5    HG2  GLN  17           HG2      GLN  17   4.873  13.252 -13.826
    6    HG3  GLN  17           HG3      GLN  17   6.445  13.094 -14.611
    7   HE21  GLN  17          HE21      GLN  17   4.534  15.037 -15.500
    8   HE22  GLN  17          HE22      GLN  17   4.004  14.587 -17.049

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ALA  18           H        ALA  18   4.019  10.211 -11.858
    2    HA   ALA  18           HA       ALA  18   3.320  12.610 -10.597
    3    HB1  ALA  18           HB1      ALA  18   2.160  10.168 -10.822
    4    HB2  ALA  18           HB2      ALA  18   1.622  11.396  -9.678
    5    HB3  ALA  18           HB3      ALA  18   2.693  10.100  -9.143

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ARG  19           H        ARG  19   5.152   9.824  -9.308
    2    HA   ARG  19           HA       ARG  19   5.689  10.977  -6.784
    3    HB2  ARG  19           HB2      ARG  19   6.075   8.569  -7.308
    4    HB3  ARG  19           HB3      ARG  19   7.441   9.037  -8.323
    5    HG2  ARG  19           HG2      ARG  19   8.565  10.064  -6.397
    6    HG3  ARG  19           HG3      ARG  19   7.180   9.694  -5.371
    7    HD2  ARG  19           HD2      ARG  19   8.920   8.037  -5.004
    8    HD3  ARG  19           HD3      ARG  19   7.539   7.272  -5.795
    9    HE   ARG  19           HE       ARG  19   9.263   8.067  -7.836
   10   HH21  ARG  19          HH11      ARG  19  10.809   6.642  -8.679
   11   HH22  ARG  19          HH12      ARG  19  11.334   5.288  -7.740
   12   HH11  ARG  19          HH21      ARG  19   9.298   6.038  -5.056
   13   HH12  ARG  19          HH22      ARG  19  10.475   4.946  -5.687

  No H/Q in entry =          13
  In of MODEL   12
    1    H    SER  20           H        SER  20   7.520  10.982  -9.825
    2    HA   SER  20           HA       SER  20   9.778  12.370  -8.993
    3    HB2  SER  20           HB2      SER  20   9.805  11.490 -11.197
    4    HB3  SER  20           HB3      SER  20   8.321  12.330 -11.631
    5    HG   SER  20           HG       SER  20   9.480  14.296 -11.397

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU  21           H        LEU  21   6.700  13.676 -10.204
    2    HA   LEU  21           HA       LEU  21   7.402  16.413  -9.979
    3    HB2  LEU  21           HB2      LEU  21   4.717  15.022  -9.909
    4    HB3  LEU  21           HB3      LEU  21   4.904  16.773  -9.914
    5    HG   LEU  21           HG       LEU  21   6.092  14.965 -12.038
    6   HD12  LEU  21          HD11      LEU  21   4.198  15.728 -13.459
    7   HD11  LEU  21          HD12      LEU  21   3.494  16.530 -12.055
    8   HD13  LEU  21          HD13      LEU  21   3.651  14.775 -12.080
    9   HD23  LEU  21          HD21      LEU  21   5.876  17.302 -13.272
   10   HD22  LEU  21          HD22      LEU  21   7.250  17.016 -12.208
   11   HD21  LEU  21          HD23      LEU  21   5.878  17.954 -11.637

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ALA  22           H        ALA  22   5.854  14.144  -7.736
    2    HA   ALA  22           HA       ALA  22   5.263  15.960  -5.672
    3    HB3  ALA  22           HB1      ALA  22   4.475  13.576  -5.837
    4    HB2  ALA  22           HB2      ALA  22   5.062  14.043  -4.240
    5    HB1  ALA  22           HB3      ALA  22   6.079  13.072  -5.306

  No H/Q in entry =           5
  In of MODEL   12
    1    H    TYR  23           H        TYR  23   8.175  13.901  -6.097
    2    HA   TYR  23           HA       TYR  23   9.560  14.906  -3.839
    3    HB2  TYR  23           HB2      TYR  23  10.329  12.889  -4.993
    4    HB3  TYR  23           HB3      TYR  23  10.660  13.823  -6.451
    5    HD1  TYR  23           HD1      TYR  23  11.608  13.458  -2.860
    6    HD2  TYR  23           HD2      TYR  23  12.704  14.989  -6.722
    7    HE1  TYR  23           HE1      TYR  23  13.869  14.009  -2.000
    8    HE2  TYR  23           HE2      TYR  23  14.964  15.542  -5.862
    9    HH   TYR  23           HH       TYR  23  15.908  16.073  -3.387

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ALA  24           H        ALA  24   9.404  16.012  -7.207
    2    HA   ALA  24           HA       ALA  24  11.321  18.077  -6.954
    3    HB2  ALA  24           HB1      ALA  24  10.888  18.142  -9.165
    4    HB3  ALA  24           HB2      ALA  24   9.339  18.909  -8.813
    5    HB1  ALA  24           HB3      ALA  24   9.447  17.154  -8.941

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA  25           H        ALA  25   7.837  17.930  -6.348
    2    HA   ALA  25           HA       ALA  25   7.383  20.653  -5.783
    3    HB1  ALA  25           HB1      ALA  25   5.702  18.672  -5.990
    4    HB2  ALA  25           HB2      ALA  25   5.343  19.965  -4.844
    5    HB3  ALA  25           HB3      ALA  25   6.014  18.438  -4.269

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU  26           H        LEU  26   8.416  17.965  -3.726
    2    HA   LEU  26           HA       LEU  26   8.525  19.397  -1.290
    3    HB2  LEU  26           HB2      LEU  26   8.596  16.980  -1.282
    4    HB3  LEU  26           HB3      LEU  26  10.070  16.972  -2.247
    5    HG   LEU  26           HG       LEU  26  11.288  18.080  -0.402
    6   HD12  LEU  26          HD11      LEU  26  10.052  18.102   1.852
    7   HD11  LEU  26          HD12      LEU  26   8.567  17.978   0.911
    8   HD13  LEU  26          HD13      LEU  26   9.627  19.373   0.705
    9   HD21  LEU  26          HD21      LEU  26   9.727  15.628   0.466
   10   HD23  LEU  26          HD22      LEU  26  11.245  16.176   1.170
   11   HD22  LEU  26          HD23      LEU  26  11.201  15.616  -0.500

  No H/Q in entry =          11
  In of MODEL   12
    1    H    LYS  27           H        LYS  27  10.946  18.799  -3.804
    2    HA   LYS  27           HA       LYS  27  13.137  20.020  -2.568
    3    HB2  LYS  27           HB2      LYS  27  13.234  18.670  -4.656
    4    HB3  LYS  27           HB3      LYS  27  12.485  20.008  -5.526
    5    HG2  LYS  27           HG2      LYS  27  14.362  21.477  -4.942
    6    HG3  LYS  27           HG3      LYS  27  15.106  20.178  -4.001
    7    HD2  LYS  27           HD2      LYS  27  15.245  18.788  -6.053
    8    HD3  LYS  27           HD3      LYS  27  14.546  20.111  -6.986
    9    HE2  LYS  27           HE2      LYS  27  16.445  21.560  -6.367
   10    HE3  LYS  27           HE3      LYS  27  17.148  20.241  -5.425
   11    HZ3  LYS  27           HZ1      LYS  27  18.148  20.329  -7.608
   12    HZ2  LYS  27           HZ2      LYS  27  16.623  20.224  -8.355
   13    HZ1  LYS  27           HZ3      LYS  27  17.230  18.909  -7.466

  No H/Q in entry =          13
  In of MODEL   12
    1    H    GLN  28           H        GLN  28  10.535  21.424  -4.529
    2    HA   GLN  28           HA       GLN  28  11.519  24.067  -4.681
    3    HB2  GLN  28           HB2      GLN  28   8.677  23.020  -4.582
    4    HB3  GLN  28           HB3      GLN  28   9.104  24.691  -4.952
    5    HG2  GLN  28           HG2      GLN  28  10.088  22.272  -6.495
    6    HG3  GLN  28           HG3      GLN  28   8.764  23.319  -7.005
    7   HE21  GLN  28          HE21      GLN  28  11.880  22.799  -7.760
    8   HE22  GLN  28          HE22      GLN  28  12.390  24.381  -8.109

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ALA  29           H        ALA  29   9.562  22.395  -2.251
    2    HA   ALA  29           HA       ALA  29   9.025  24.594  -0.574
    3    HB2  ALA  29           HB1      ALA  29   8.276  23.033   0.993
    4    HB1  ALA  29           HB2      ALA  29   9.489  21.838   0.534
    5    HB3  ALA  29           HB3      ALA  29   8.110  22.142  -0.520

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LYS  30           H        LYS  30  11.736  22.302  -0.630
    2    HA   LYS  30           HA       LYS  30  13.053  23.248   1.677
    3    HB2  LYS  30           HB2      LYS  30  14.148  21.949  -0.827
    4    HB3  LYS  30           HB3      LYS  30  15.128  22.301   0.598
    5    HG2  LYS  30           HG2      LYS  30  13.557  20.933   1.973
    6    HG3  LYS  30           HG3      LYS  30  12.674  20.518   0.500
    7    HD2  LYS  30           HD2      LYS  30  14.714  19.513  -0.452
    8    HD3  LYS  30           HD3      LYS  30  15.616  19.942   1.003
    9    HE2  LYS  30           HE2      LYS  30  14.094  18.525   2.353
   10    HE3  LYS  30           HE3      LYS  30  13.222  18.076   0.882
   11    HZ2  LYS  30           HZ1      LYS  30  14.996  16.483   1.652
   12    HZ1  LYS  30           HZ2      LYS  30  16.145  17.660   1.204
   13    HZ3  LYS  30           HZ3      LYS  30  15.109  16.984   0.036

  No H/Q in entry =          13
  In of MODEL   12
    1    H    GLN  31           H        GLN  31  12.967  24.450  -1.621
    2    HA   GLN  31           HA       GLN  31  15.135  26.324  -1.193
    3    HB2  GLN  31           HB2      GLN  31  13.101  26.386  -3.426
    4    HB3  GLN  31           HB3      GLN  31  14.727  27.068  -3.421
    5    HG2  GLN  31           HG2      GLN  31  15.164  24.369  -2.841
    6    HG3  GLN  31           HG3      GLN  31  13.864  24.325  -4.024
    7   HE21  GLN  31          HE21      GLN  31  16.702  23.507  -4.416
    8   HE22  GLN  31          HE22      GLN  31  17.288  24.474  -5.681

  No H/Q in entry =           8
  In of MODEL   12
    1    H    GLY  32           H        GLY  32  12.054  26.170  -0.060
    2    HA3  GLY  32           HA2      GLY  32  10.906  27.749   1.207
    3    HA2  GLY  32           HA3      GLY  32  12.044  28.974   0.660

  No H/Q in entry =           3
  In of MODEL   12
    1    H    ASP  33           H        ASP  33  10.674  27.079  -1.835
    2    HA   ASP  33           HA       ASP  33   9.032  29.365  -2.700
    3    HB2  ASP  33           HB2      ASP  33  10.111  26.935  -4.135
    4    HB3  ASP  33           HB3      ASP  33   8.972  28.060  -4.872

  No H/Q in entry =           4
  In of MODEL   12
    1    H    PHE  34           H        PHE  34   7.334  28.906  -1.143
    2    HA   PHE  34           HA       PHE  34   5.933  26.445  -1.050
    3    HB2  PHE  34           HB2      PHE  34   4.993  29.242  -0.377
    4    HB3  PHE  34           HB3      PHE  34   4.130  27.759   0.032
    5    HD1  PHE  34           HD1      PHE  34   6.395  30.139   1.253
    6    HD2  PHE  34           HD2      PHE  34   5.679  25.904   1.202
    7    HE1  PHE  34           HE1      PHE  34   7.775  29.879   3.296
    8    HE2  PHE  34           HE2      PHE  34   7.062  25.648   3.242
    9    HZ   PHE  34           HZ       PHE  34   8.104  27.637   4.289

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ALA  35           H        ALA  35   5.535  29.311  -3.066
    2    HA   ALA  35           HA       ALA  35   2.982  28.717  -4.100
    3    HB3  ALA  35           HB1      ALA  35   4.054  30.098  -6.135
    4    HB2  ALA  35           HB2      ALA  35   5.270  30.450  -4.907
    5    HB1  ALA  35           HB3      ALA  35   3.582  30.874  -4.623

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA  36           H        ALA  36   6.211  28.015  -5.441
    2    HA   ALA  36           HA       ALA  36   5.219  26.592  -7.687
    3    HB3  ALA  36           HB1      ALA  36   7.381  26.697  -8.294
    4    HB2  ALA  36           HB2      ALA  36   7.848  25.666  -6.941
    5    HB1  ALA  36           HB3      ALA  36   7.757  27.415  -6.728

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA  37           H        ALA  37   6.153  25.593  -4.427
    2    HA   ALA  37           HA       ALA  37   6.073  22.805  -4.854
    3    HB2  ALA  37           HB1      ALA  37   5.817  24.601  -2.478
    4    HB1  ALA  37           HB2      ALA  37   6.941  23.273  -2.765
    5    HB3  ALA  37           HB3      ALA  37   5.275  22.934  -2.300

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LYS  38           H        LYS  38   3.554  25.035  -3.698
    2    HA   LYS  38           HA       LYS  38   1.439  23.240  -3.482
    3    HB2  LYS  38           HB2      LYS  38   1.812  25.993  -3.232
    4    HB3  LYS  38           HB3      LYS  38   0.617  25.855  -4.516
    5    HG2  LYS  38           HG2      LYS  38  -0.850  24.545  -3.078
    6    HG3  LYS  38           HG3      LYS  38   0.389  24.476  -1.816
    7    HD2  LYS  38           HD2      LYS  38   0.221  26.815  -1.372
    8    HD3  LYS  38           HD3      LYS  38  -0.683  27.109  -2.859
    9    HE2  LYS  38           HE2      LYS  38  -2.193  27.158  -0.925
   10    HE3  LYS  38           HE3      LYS  38  -2.575  25.784  -1.967
   11    HZ3  LYS  38           HZ1      LYS  38  -1.868  24.309  -0.430
   12    HZ2  LYS  38           HZ2      LYS  38  -2.212  25.570   0.657
   13    HZ1  LYS  38           HZ3      LYS  38  -0.618  25.306   0.138

  No H/Q in entry =          13
  In of MODEL   12
    1    H    ALA  39           H        ALA  39   2.445  25.131  -6.329
    2    HA   ALA  39           HA       ALA  39   0.369  24.279  -8.039
    3    HB2  ALA  39           HB1      ALA  39   3.115  24.904  -9.082
    4    HB1  ALA  39           HB2      ALA  39   2.156  26.174  -8.322
    5    HB3  ALA  39           HB3      ALA  39   1.542  25.340  -9.750

  No H/Q in entry =           5
  In of MODEL   12
    1    H    MET  40           H        MET  40   3.594  22.954  -7.445
    2    HA   MET  40           HA       MET  40   3.488  20.933  -9.435
    3    HB2  MET  40           HB2      MET  40   5.091  21.146  -6.880
    4    HB3  MET  40           HB3      MET  40   5.336  19.887  -8.092
    5    HG2  MET  40           HG2      MET  40   5.420  22.841  -8.760
    6    HG3  MET  40           HG3      MET  40   6.857  21.927  -8.304
    7    HE3  MET  40           HE1      MET  40   7.723  19.702 -11.107
    8    HE2  MET  40           HE2      MET  40   7.150  19.389  -9.472
    9    HE1  MET  40           HE3      MET  40   8.258  20.727  -9.768

  No H/Q in entry =           9
  In of MODEL   12
    1    H    MET  41           H        MET  41   2.559  20.986  -6.015
    2    HA   MET  41           HA       MET  41   2.003  18.226  -5.736
    3    HB2  MET  41           HB2      MET  41   0.684  20.596  -4.393
    4    HB3  MET  41           HB3      MET  41   0.513  18.920  -3.884
    5    HG2  MET  41           HG2      MET  41   3.225  19.121  -3.910
    6    HG3  MET  41           HG3      MET  41   2.797  20.783  -3.518
    7    HE2  MET  41           HE1      MET  41  -0.260  19.557  -1.804
    8    HE1  MET  41           HE2      MET  41   0.571  21.063  -2.179
    9    HE3  MET  41           HE3      MET  41   0.500  20.495  -0.511

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ASP  42           H        ASP  42  -0.009  20.966  -6.721
    2    HA   ASP  42           HA       ASP  42  -2.460  19.625  -6.866
    3    HB2  ASP  42           HB2      ASP  42  -1.732  22.189  -7.123
    4    HB3  ASP  42           HB3      ASP  42  -1.879  21.794  -8.831

  No H/Q in entry =           4
  In of MODEL   12
    1    H    GLN  43           H        GLN  43  -0.005  20.194  -9.359
    2    HA   GLN  43           HA       GLN  43  -1.394  18.883 -11.453
    3    HB2  GLN  43           HB2      GLN  43   1.567  19.376 -11.059
    4    HB3  GLN  43           HB3      GLN  43   0.854  18.741 -12.544
    5    HG2  GLN  43           HG2      GLN  43  -0.641  20.779 -12.593
    6    HG3  GLN  43           HG3      GLN  43   0.311  21.429 -11.263
    7   HE21  GLN  43          HE21      GLN  43   0.494  23.046 -13.350
    8   HE22  GLN  43          HE22      GLN  43   1.911  22.813 -14.251

  No H/Q in entry =           8
  In of MODEL   12
    1    H    SER  44           H        SER  44   0.939  17.727  -9.051
    2    HA   SER  44           HA       SER  44   1.257  15.117 -10.072
    3    HB2  SER  44           HB2      SER  44   2.154  16.551  -7.834
    4    HB3  SER  44           HB3      SER  44   1.279  15.175  -7.165
    5    HG   SER  44           HG       SER  44   3.386  14.539  -7.582

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ARG  45           H        ARG  45  -1.062  16.455  -7.745
    2    HA   ARG  45           HA       ARG  45  -2.468  14.106  -7.113
    3    HB2  ARG  45           HB2      ARG  45  -2.655  16.277  -5.925
    4    HB3  ARG  45           HB3      ARG  45  -3.501  16.948  -7.316
    5    HG2  ARG  45           HG2      ARG  45  -5.281  15.236  -7.038
    6    HG3  ARG  45           HG3      ARG  45  -4.447  14.619  -5.611
    7    HD2  ARG  45           HD2      ARG  45  -4.641  16.889  -4.558
    8    HD3  ARG  45           HD3      ARG  45  -5.618  17.414  -5.945
    9    HE   ARG  45           HE       ARG  45  -6.750  15.048  -4.907
   10   HH21  ARG  45          HH11      ARG  45  -8.590  15.138  -3.644
   11   HH22  ARG  45          HH12      ARG  45  -8.979  16.582  -2.778
   12   HH11  ARG  45          HH21      ARG  45  -6.185  18.291  -3.884
   13   HH12  ARG  45          HH22      ARG  45  -7.611  18.367  -2.912

  No H/Q in entry =          13
  In of MODEL   12
    1    H    MET  46           H        MET  46  -3.025  16.512  -9.669
    2    HA   MET  46           HA       MET  46  -5.368  15.355 -10.739
    3    HB2  MET  46           HB2      MET  46  -3.245  17.150 -11.930
    4    HB3  MET  46           HB3      MET  46  -4.656  16.624 -12.853
    5    HG2  MET  46           HG2      MET  46  -6.144  17.580 -11.148
    6    HG3  MET  46           HG3      MET  46  -4.755  18.074 -10.188
    7    HE1  MET  46           HE1      MET  46  -6.430  19.953 -10.279
    8    HE3  MET  46           HE2      MET  46  -6.449  21.242 -11.477
    9    HE2  MET  46           HE3      MET  46  -5.072  21.081 -10.389

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ALA  47           H        ALA  47  -1.940  14.851 -11.482
    2    HA   ALA  47           HA       ALA  47  -2.288  13.123 -13.692
    3    HB3  ALA  47           HB1      ALA  47  -0.106  13.998 -13.332
    4    HB2  ALA  47           HB2      ALA  47   0.022  12.269 -12.996
    5    HB1  ALA  47           HB3      ALA  47  -0.068  13.423 -11.664

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU  48           H        LEU  48  -2.037  12.489 -10.217
    2    HA   LEU  48           HA       LEU  48  -2.150   9.650 -10.372
    3    HB2  LEU  48           HB2      LEU  48  -2.910  11.576  -8.164
    4    HB3  LEU  48           HB3      LEU  48  -2.829   9.825  -7.961
    5    HG   LEU  48           HG       LEU  48  -0.515  11.507  -8.950
    6   HD13  LEU  48          HD11      LEU  48  -0.801  12.282  -6.762
    7   HD12  LEU  48          HD12      LEU  48   0.352  10.966  -6.557
    8   HD11  LEU  48          HD13      LEU  48  -1.349  10.716  -6.166
    9   HD22  LEU  48          HD21      LEU  48  -0.028   9.318  -9.587
   10   HD21  LEU  48          HD22      LEU  48  -0.909   8.610  -8.233
   11   HD23  LEU  48          HD23      LEU  48   0.668   9.352  -7.967

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ASN  49           H        ASN  49  -4.598  12.160  -9.984
    2    HA   ASN  49           HA       ASN  49  -6.798  10.511  -9.452
    3    HB2  ASN  49           HB2      ASN  49  -6.856  12.925  -9.123
    4    HB3  ASN  49           HB3      ASN  49  -6.655  13.198 -10.849
    5   HD21  ASN  49          HD21      ASN  49  -8.910  11.768  -8.472
    6   HD22  ASN  49          HD22      ASN  49 -10.299  12.005  -9.415

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLU  50           H        GLU  50  -5.497  11.695 -12.535
    2    HA   GLU  50           HA       GLU  50  -7.453  10.451 -14.188
    3    HB2  GLU  50           HB2      GLU  50  -5.971  12.259 -14.998
    4    HB3  GLU  50           HB3      GLU  50  -4.585  11.178 -14.852
    5    HG2  GLU  50           HG2      GLU  50  -5.562   9.647 -16.491
    6    HG3  GLU  50           HG3      GLU  50  -7.016  10.635 -16.586

  No H/Q in entry =           6
  In of MODEL   12
    1    H    ALA  51           H        ALA  51  -4.294   9.439 -12.967
    2    HA   ALA  51           HA       ALA  51  -4.165   6.983 -14.382
    3    HB2  ALA  51           HB1      ALA  51  -2.191   6.683 -13.273
    4    HB1  ALA  51           HB2      ALA  51  -2.883   7.112 -11.709
    5    HB3  ALA  51           HB3      ALA  51  -2.414   8.378 -12.843

  No H/Q in entry =           5
  In of MODEL   12
    1    H    HIS  52           H        HIS  52  -5.347   7.827 -11.139
    2    HA   HIS  52           HA       HIS  52  -6.054   5.223 -10.308
    3    HB2  HIS  52           HB2      HIS  52  -5.907   7.209  -8.813
    4    HB3  HIS  52           HB3      HIS  52  -7.382   7.834  -9.550
    5    HD1  HIS  52           HD1      HIS  52  -9.596   6.460  -9.138
    6    HD2  HIS  52           HD2      HIS  52  -6.304   5.130  -6.955
    7    HE1  HIS  52           HE1      HIS  52 -10.501   4.915  -7.346
    8    HE2  HIS  52           HE2      HIS  52  -8.505   4.096  -6.006

  No H/Q in entry =           8
  In of MODEL   12
    1    H    LEU  53           H        LEU  53  -7.849   7.691 -12.106
    2    HA   LEU  53           HA       LEU  53 -10.363   6.418 -12.129
    3    HB2  LEU  53           HB2      LEU  53  -9.057   8.388 -13.993
    4    HB3  LEU  53           HB3      LEU  53 -10.658   7.733 -14.325
    5    HG   LEU  53           HG       LEU  53  -9.953   9.040 -11.678
    6   HD13  LEU  53          HD11      LEU  53  -9.638  10.790 -13.251
    7   HD12  LEU  53          HD12      LEU  53 -11.297  10.991 -12.684
    8   HD11  LEU  53          HD13      LEU  53 -10.982  10.244 -14.248
    9   HD23  LEU  53          HD21      LEU  53 -12.533   9.454 -11.835
   10   HD22  LEU  53          HD22      LEU  53 -11.965   7.849 -11.392
   11   HD21  LEU  53          HD23      LEU  53 -12.516   8.162 -13.027

  No H/Q in entry =          11
  In of MODEL   12
    1    H    VAL  54           H        VAL  54  -7.604   6.198 -14.353
    2    HA   VAL  54           HA       VAL  54  -8.832   4.434 -16.200
    3    HB   VAL  54           HB       VAL  54  -5.924   4.919 -15.505
    4   HG12  VAL  54          HG11      VAL  54  -5.674   3.830 -17.892
    5   HG11  VAL  54          HG12      VAL  54  -7.210   3.061 -17.494
    6   HG13  VAL  54          HG13      VAL  54  -5.801   2.797 -16.469
    7   HG22  VAL  54          HG21      VAL  54  -6.674   6.867 -16.555
    8   HG21  VAL  54          HG22      VAL  54  -7.869   6.012 -17.528
    9   HG23  VAL  54          HG23      VAL  54  -6.161   5.918 -17.950

  No H/Q in entry =           9
  In of MODEL   12
    1    H    GLN  55           H        GLN  55  -6.850   3.876 -13.291
    2    HA   GLN  55           HA       GLN  55  -6.781   1.058 -13.543
    3    HB2  GLN  55           HB2      GLN  55  -5.226   1.944 -12.018
    4    HB3  GLN  55           HB3      GLN  55  -6.438   2.920 -11.195
    5    HG2  GLN  55           HG2      GLN  55  -7.146   1.170  -9.879
    6    HG3  GLN  55           HG3      GLN  55  -6.925  -0.020 -11.155
    7   HE21  GLN  55          HE21      GLN  55  -5.315  -1.482 -10.651
    8   HE22  GLN  55          HE22      GLN  55  -3.932  -1.140  -9.733

  No H/Q in entry =           8
  In of MODEL   12
    1    H    THR  56           H        THR  56  -9.103   3.241 -11.942
    2    HA   THR  56           HA       THR  56 -10.707   1.371 -10.658
    3    HB   THR  56           HB       THR  56 -11.779   3.765 -12.173
    4    HG1  THR  56           HG1      THR  56 -10.472   3.565  -9.670
    5   HG21  THR  56          HG21      THR  56 -13.264   1.971 -10.982
    6   HG23  THR  56          HG22      THR  56 -13.591   3.681 -10.698
    7   HG22  THR  56          HG23      THR  56 -12.698   2.742  -9.501

  No H/Q in entry =           7
  In of MODEL   12
    1    H    LYS  57           H        LYS  57 -10.885   2.452 -14.046
    2    HA   LYS  57           HA       LYS  57 -13.051   0.781 -14.808
    3    HB2  LYS  57           HB2      LYS  57 -12.155   2.722 -16.124
    4    HB3  LYS  57           HB3      LYS  57 -10.720   1.774 -16.482
    5    HG2  LYS  57           HG2      LYS  57 -12.064   0.113 -17.663
    6    HG3  LYS  57           HG3      LYS  57 -13.543   0.970 -17.241
    7    HD2  LYS  57           HD2      LYS  57 -12.755   2.941 -18.526
    8    HD3  LYS  57           HD3      LYS  57 -11.299   2.057 -18.977
    9    HE2  LYS  57           HE2      LYS  57 -12.676   0.348 -20.114
   10    HE3  LYS  57           HE3      LYS  57 -14.146   1.210 -19.661
   11    HZ3  LYS  57           HZ1      LYS  57 -13.898   2.310 -21.552
   12    HZ2  LYS  57           HZ2      LYS  57 -12.319   1.729 -21.790
   13    HZ1  LYS  57           HZ3      LYS  57 -12.585   3.111 -20.835

  No H/Q in entry =          13
  In of MODEL   12
    1    H    LEU  58           H        LEU  58  -9.551   0.322 -14.733
    2    HA   LEU  58           HA       LEU  58  -9.572  -2.197 -16.019
    3    HB2  LEU  58           HB2      LEU  58  -7.536  -0.918 -14.203
    4    HB3  LEU  58           HB3      LEU  58  -7.284  -2.443 -15.053
    5    HG   LEU  58           HG       LEU  58  -8.010   0.165 -16.424
    6   HD11  LEU  58          HD11      LEU  58  -5.377  -1.092 -15.719
    7   HD13  LEU  58          HD12      LEU  58  -5.859   0.603 -15.674
    8   HD12  LEU  58          HD13      LEU  58  -5.518  -0.173 -17.218
    9   HD22  LEU  58          HD21      LEU  58  -8.591  -1.394 -18.016
   10   HD21  LEU  58          HD22      LEU  58  -7.563  -2.649 -17.327
   11   HD23  LEU  58          HD23      LEU  58  -6.857  -1.383 -18.331

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  59           H        ILE  59 -10.402  -1.283 -12.773
    2    HA   ILE  59           HA       ILE  59 -10.077  -4.051 -11.820
    3    HB   ILE  59           HB       ILE  59  -9.624  -1.784 -10.423
    4   HG12  ILE  59          HG12      ILE  59 -11.011  -4.123  -9.098
    5   HG13  ILE  59          HG13      ILE  59  -9.369  -4.218  -9.682
    6   HG23  ILE  59          HG21      ILE  59 -11.459  -1.090  -9.109
    7   HG22  ILE  59          HG22      ILE  59 -12.405  -2.507  -9.501
    8   HG21  ILE  59          HG23      ILE  59 -12.155  -1.245 -10.705
    9   HD12  ILE  59          HD11      ILE  59 -10.414  -2.262  -7.648
   10   HD11  ILE  59          HD12      ILE  59  -8.773  -2.248  -8.280
   11   HD13  ILE  59          HD13      ILE  59  -9.338  -3.617  -7.320

  No H/Q in entry =          11
  In of MODEL   12
    1    H    GLU  60           H        GLU  60 -12.613  -1.718 -12.644
    2    HA   GLU  60           HA       GLU  60 -14.815  -3.216 -11.640
    3    HB2  GLU  60           HB2      GLU  60 -15.049  -0.860 -12.219
    4    HB3  GLU  60           HB3      GLU  60 -14.648  -1.201 -13.899
    5    HG2  GLU  60           HG2      GLU  60 -16.669  -2.646 -14.062
    6    HG3  GLU  60           HG3      GLU  60 -17.087  -2.213 -12.418

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLY  61           H        GLY  61 -13.126  -3.218 -14.746
    2    HA3  GLY  61           HA2      GLY  61 -14.851  -5.451 -15.641
    3    HA2  GLY  61           HA3      GLY  61 -13.993  -4.354 -16.717

  No H/Q in entry =           3
  In of MODEL   12
    1    H    ASP  62           H        ASP  62 -12.639  -5.804 -13.825
    2    HA   ASP  62           HA       ASP  62 -10.433  -6.876 -15.340
    3    HB2  ASP  62           HB2      ASP  62  -9.630  -7.571 -13.078
    4    HB3  ASP  62           HB3      ASP  62 -10.003  -5.855 -13.189

  No H/Q in entry =           4
  In of MODEL   12
    1    H    ALA  63           H        ALA  63 -13.494  -8.080 -14.870
    2    HA   ALA  63           HA       ALA  63 -13.224 -10.740 -14.037
    3    HB1  ALA  63           HB1      ALA  63 -14.985  -9.621 -16.252
    4    HB2  ALA  63           HB2      ALA  63 -15.398  -9.655 -14.538
    5    HB3  ALA  63           HB3      ALA  63 -15.232 -11.165 -15.438

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLY  64           H        GLY  64 -12.930  -9.378 -17.297
    2    HA3  GLY  64           HA2      GLY  64 -11.986 -10.165 -19.230
    3    HA2  GLY  64           HA3      GLY  64 -10.798 -10.928 -18.180

  No H/Q in entry =           3
  In of MODEL   12
    1    H    GLU  65           H        GLU  65 -10.622 -13.062 -18.485
    2    HA   GLU  65           HA       GLU  65 -12.237 -14.585 -20.120
    3    HB2  GLU  65           HB2      GLU  65 -10.487 -15.451 -17.822
    4    HB3  GLU  65           HB3      GLU  65 -11.238 -16.576 -18.957
    5    HG2  GLU  65           HG2      GLU  65 -10.104 -15.497 -20.832
    6    HG3  GLU  65           HG3      GLU  65  -9.410 -14.292 -19.749

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLY  66           H        GLY  66 -13.138 -16.768 -19.222
    2    HA3  GLY  66           HA2      GLY  66 -15.662 -16.253 -18.092
    3    HA2  GLY  66           HA3      GLY  66 -14.964 -17.834 -18.382

  No H/Q in entry =           3
  In of MODEL   12
    1    H    LYS  67           H        LYS  67 -12.723 -17.576 -16.685
    2    HA   LYS  67           HA       LYS  67 -13.937 -18.302 -14.203
    3    HB2  LYS  67           HB2      LYS  67 -11.065 -18.126 -15.099
    4    HB3  LYS  67           HB3      LYS  67 -11.566 -18.733 -13.514
    5    HG2  LYS  67           HG2      LYS  67 -13.005 -20.415 -14.609
    6    HG3  LYS  67           HG3      LYS  67 -12.506 -19.815 -16.189
    7    HD2  LYS  67           HD2      LYS  67 -10.171 -20.434 -15.696
    8    HD3  LYS  67           HD3      LYS  67 -10.664 -21.023 -14.105
    9    HE2  LYS  67           HE2      LYS  67 -12.148 -22.679 -15.161
   10    HE3  LYS  67           HE3      LYS  67 -11.694 -22.080 -16.757
   11    HZ2  LYS  67           HZ1      LYS  67 -10.342 -23.934 -15.106
   12    HZ1  LYS  67           HZ2      LYS  67  -9.334 -22.603 -15.412
   13    HZ3  LYS  67           HZ3      LYS  67  -9.999 -23.483 -16.704

  No H/Q in entry =          13
  In of MODEL   12
    1    H    MET  68           H        MET  68 -13.548 -17.531 -12.165
    2    HA   MET  68           HA       MET  68 -13.965 -14.855 -11.685
    3    HB2  MET  68           HB2      MET  68 -12.790 -16.995  -9.917
    4    HB3  MET  68           HB3      MET  68 -13.245 -15.394  -9.332
    5    HG2  MET  68           HG2      MET  68 -15.550 -15.753 -10.131
    6    HG3  MET  68           HG3      MET  68 -15.096 -17.353 -10.723
    7    HE1  MET  68           HE1      MET  68 -16.807 -18.584  -9.544
    8    HE3  MET  68           HE2      MET  68 -17.538 -17.154  -8.818
    9    HE2  MET  68           HE3      MET  68 -17.169 -18.552  -7.812

  No H/Q in entry =           9
  In of MODEL   12
    1    H    LYS  69           H        LYS  69 -10.989 -16.139 -12.700
    2    HA   LYS  69           HA       LYS  69  -9.194 -14.579 -11.185
    3    HB2  LYS  69           HB2      LYS  69  -8.542 -16.600 -12.422
    4    HB3  LYS  69           HB3      LYS  69  -8.784 -15.741 -13.945
    5    HG2  LYS  69           HG2      LYS  69  -7.069 -14.101 -13.322
    6    HG3  LYS  69           HG3      LYS  69  -6.857 -14.891 -11.761
    7    HD2  LYS  69           HD2      LYS  69  -6.128 -16.957 -12.909
    8    HD3  LYS  69           HD3      LYS  69  -6.315 -16.149 -14.467
    9    HE2  LYS  69           HE2      LYS  69  -4.638 -14.469 -13.809
   10    HE3  LYS  69           HE3      LYS  69  -4.459 -15.253 -12.240
   11    HZ2  LYS  69           HZ1      LYS  69  -3.036 -15.824 -14.493
   12    HZ1  LYS  69           HZ2      LYS  69  -4.174 -17.083 -14.419
   13    HZ3  LYS  69           HZ3      LYS  69  -3.135 -16.794 -13.105

  No H/Q in entry =          13
  In of MODEL   12
    1    H    VAL  70           H        VAL  70  -7.868 -12.781 -11.701
    2    HA   VAL  70           HA       VAL  70  -9.062 -10.890 -13.652
    3    HB   VAL  70           HB       VAL  70  -8.235  -9.108 -12.133
    4   HG11  VAL  70          HG11      VAL  70 -10.170 -11.203 -11.178
    5   HG13  VAL  70          HG12      VAL  70 -10.506  -9.585 -11.795
    6   HG12  VAL  70          HG13      VAL  70  -9.837  -9.790 -10.177
    7   HG21  VAL  70          HG21      VAL  70  -7.488 -11.477 -10.379
    8   HG23  VAL  70          HG22      VAL  70  -7.557  -9.812  -9.809
    9   HG22  VAL  70          HG23      VAL  70  -6.386 -10.272 -11.043

  No H/Q in entry =           9
  In of MODEL   12
    1    H    SER  71           H        SER  71  -7.485  -9.248 -14.432
    2    HA   SER  71           HA       SER  71  -5.242 -10.432 -15.675
    3    HB2  SER  71           HB2      SER  71  -6.418  -8.385 -16.505
    4    HB3  SER  71           HB3      SER  71  -5.737  -7.489 -15.149
    5    HG   SER  71           HG       SER  71  -4.455  -8.659 -17.368

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU  72           H        LEU  72  -3.225 -10.726 -15.018
    2    HA   LEU  72           HA       LEU  72  -2.516 -10.513 -12.304
    3    HB2  LEU  72           HB2      LEU  72  -0.857 -10.963 -14.780
    4    HB3  LEU  72           HB3      LEU  72  -0.199 -11.032 -13.148
    5    HG   LEU  72           HG       LEU  72  -2.562 -12.712 -14.046
    6   HD13  LEU  72          HD11      LEU  72  -0.565 -13.284 -15.377
    7   HD12  LEU  72          HD12      LEU  72  -0.941 -14.569 -14.230
    8   HD11  LEU  72          HD13      LEU  72   0.378 -13.448 -13.894
    9   HD23  LEU  72          HD21      LEU  72  -1.579 -14.120 -12.066
   10   HD22  LEU  72          HD22      LEU  72  -2.551 -12.709 -11.673
   11   HD21  LEU  72          HD23      LEU  72  -0.794 -12.616 -11.599

  No H/Q in entry =          11
  In of MODEL   12
    1    H    VAL  73           H        VAL  73  -1.769  -8.508 -15.084
    2    HA   VAL  73           HA       VAL  73   0.160  -6.824 -13.975
    3    HB   VAL  73           HB       VAL  73  -0.218  -5.401 -15.835
    4   HG12  VAL  73          HG11      VAL  73  -1.103  -8.093 -16.864
    5   HG11  VAL  73          HG12      VAL  73   0.515  -7.858 -16.208
    6   HG13  VAL  73          HG13      VAL  73  -0.007  -6.935 -17.615
    7   HG21  VAL  73          HG21      VAL  73  -2.983  -6.557 -15.697
    8   HG23  VAL  73          HG22      VAL  73  -2.375  -5.981 -17.247
    9   HG22  VAL  73          HG23      VAL  73  -2.486  -4.874 -15.878

  No H/Q in entry =           9
  In of MODEL   12
    1    H    LEU  74           H        LEU  74  -3.241  -6.909 -13.434
    2    HA   LEU  74           HA       LEU  74  -3.839  -4.247 -12.830
    3    HB2  LEU  74           HB2      LEU  74  -5.585  -5.889 -13.008
    4    HB3  LEU  74           HB3      LEU  74  -4.905  -6.828 -11.681
    5    HG   LEU  74           HG       LEU  74  -5.350  -4.956 -10.128
    6   HD11  LEU  74          HD11      LEU  74  -6.353  -3.670 -12.671
    7   HD13  LEU  74          HD12      LEU  74  -5.214  -3.016 -11.496
    8   HD12  LEU  74          HD13      LEU  74  -6.925  -3.150 -11.087
    9   HD22  LEU  74          HD21      LEU  74  -7.565  -5.508  -9.879
   10   HD21  LEU  74          HD22      LEU  74  -7.053  -6.759 -10.990
   11   HD23  LEU  74          HD23      LEU  74  -7.904  -5.362 -11.601

  No H/Q in entry =          11
  In of MODEL   12
    1    H    VAL  75           H        VAL  75  -2.832  -6.838 -10.658
    2    HA   VAL  75           HA       VAL  75  -2.632  -5.284  -8.316
    3    HB   VAL  75           HB       VAL  75  -1.144  -7.789  -9.090
    4   HG13  VAL  75          HG11      VAL  75   0.105  -6.590  -7.340
    5   HG12  VAL  75          HG12      VAL  75  -0.751  -7.938  -6.606
    6   HG11  VAL  75          HG13      VAL  75  -1.382  -6.309  -6.440
    7   HG21  VAL  75          HG21      VAL  75  -3.697  -7.785  -8.884
    8   HG23  VAL  75          HG22      VAL  75  -3.466  -7.380  -7.183
    9   HG22  VAL  75          HG23      VAL  75  -2.850  -8.906  -7.817

  No H/Q in entry =           9
  In of MODEL   12
    1    H    GLU  76           H        GLU  76  -0.217  -6.070 -10.838
    2    HA   GLU  76           HA       GLU  76   1.975  -4.740  -9.672
    3    HB2  GLU  76           HB2      GLU  76   2.173  -6.221 -11.652
    4    HB3  GLU  76           HB3      GLU  76   1.280  -5.054 -12.615
    5    HG2  GLU  76           HG2      GLU  76   3.625  -4.746 -13.096
    6    HG3  GLU  76           HG3      GLU  76   3.113  -3.366 -12.141

  No H/Q in entry =           6
  In of MODEL   12
    1    H    ALA  77           H        ALA  77  -0.535  -3.521 -11.876
    2    HA   ALA  77           HA       ALA  77   0.479  -0.883 -12.052
    3    HB2  ALA  77           HB1      ALA  77  -1.528  -0.344 -13.135
    4    HB3  ALA  77           HB2      ALA  77  -2.461  -1.510 -12.197
    5    HB1  ALA  77           HB3      ALA  77  -1.365  -2.070 -13.458

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLN  78           H        GLN  78  -1.814  -2.415  -9.850
    2    HA   GLN  78           HA       GLN  78  -2.609  -0.087  -8.458
    3    HB2  GLN  78           HB2      GLN  78  -3.736  -2.340  -8.375
    4    HB3  GLN  78           HB3      GLN  78  -2.411  -2.904  -7.359
    5    HG2  GLN  78           HG2      GLN  78  -2.930  -1.152  -5.710
    6    HG3  GLN  78           HG3      GLN  78  -4.259  -0.589  -6.722
    7   HE21  GLN  78          HE21      GLN  78  -4.742  -1.547  -4.064
    8   HE22  GLN  78          HE22      GLN  78  -5.609  -3.002  -4.172

  No H/Q in entry =           8
  In of MODEL   12
    1    H    LEU  79           H        LEU  79   0.048  -2.364  -7.989
    2    HA   LEU  79           HA       LEU  79   1.019  -1.470  -5.528
    3    HB2  LEU  79           HB2      LEU  79   1.878  -3.488  -6.588
    4    HB3  LEU  79           HB3      LEU  79   2.539  -2.544  -7.919
    5    HG   LEU  79           HG       LEU  79   4.096  -1.414  -6.410
    6   HD13  LEU  79          HD11      LEU  79   3.082  -1.157  -4.348
    7   HD12  LEU  79          HD12      LEU  79   4.148  -2.514  -3.996
    8   HD11  LEU  79          HD13      LEU  79   2.442  -2.801  -4.334
    9   HD23  LEU  79          HD21      LEU  79   5.285  -3.570  -5.496
   10   HD22  LEU  79          HD22      LEU  79   5.092  -3.373  -7.235
   11   HD21  LEU  79          HD23      LEU  79   4.001  -4.432  -6.347

  No H/Q in entry =          11
  In of MODEL   12
    1    H    HIS  80           H        HIS  80   1.915  -0.366  -8.799
    2    HA   HIS  80           HA       HIS  80   3.733   1.609  -7.871
    3    HB2  HIS  80           HB2      HIS  80   2.452   0.919 -10.459
    4    HB3  HIS  80           HB3      HIS  80   3.058   2.567 -10.288
    5    HD1  HIS  80           HD1      HIS  80   5.464   2.849 -10.798
    6    HD2  HIS  80           HD2      HIS  80   4.610  -1.053  -9.603
    7    HE1  HIS  80           HE1      HIS  80   7.646   1.556 -10.949
    8    HE2  HIS  80           HE2      HIS  80   7.136  -0.826 -10.225

  No H/Q in entry =           8
  In of MODEL   12
    1    H    LEU  81           H        LEU  81   0.335   1.792  -8.869
    2    HA   LEU  81           HA       LEU  81   0.078   4.587  -8.545
    3    HB2  LEU  81           HB2      LEU  81  -1.953   2.356  -8.473
    4    HB3  LEU  81           HB3      LEU  81  -2.394   4.062  -8.386
    5    HG   LEU  81           HG       LEU  81  -0.696   2.896 -10.611
    6   HD12  LEU  81          HD11      LEU  81  -2.919   3.229 -11.923
    7   HD11  LEU  81          HD12      LEU  81  -3.684   3.168 -10.335
    8   HD13  LEU  81          HD13      LEU  81  -2.747   1.793 -10.915
    9   HD23  LEU  81          HD21      LEU  81  -1.773   5.046 -11.718
   10   HD22  LEU  81          HD22      LEU  81  -0.361   5.209 -10.678
   11   HD21  LEU  81          HD23      LEU  81  -1.967   5.569 -10.047

  No H/Q in entry =          11
  In of MODEL   12
    1    H    MET  82           H        MET  82  -0.612   1.909  -6.295
    2    HA   MET  82           HA       MET  82  -1.665   3.506  -4.216
    3    HB2  MET  82           HB2      MET  82  -0.308   0.810  -4.243
    4    HB3  MET  82           HB3      MET  82  -0.890   1.541  -2.750
    5    HG2  MET  82           HG2      MET  82  -2.613   1.055  -5.200
    6    HG3  MET  82           HG3      MET  82  -2.549  -0.017  -3.802
    7    HE3  MET  82           HE1      MET  82  -4.277   1.649  -1.000
    8    HE2  MET  82           HE2      MET  82  -2.544   1.915  -1.175
    9    HE1  MET  82           HE3      MET  82  -3.240   0.361  -1.630

  No H/Q in entry =           9
  In of MODEL   12
    1    H    THR  83           H        THR  83   1.633   2.398  -4.886
    2    HA   THR  83           HA       THR  83   2.844   3.498  -2.581
    3    HB   THR  83           HB       THR  83   4.947   3.427  -4.043
    4    HG1  THR  83           HG1      THR  83   4.715   2.898  -6.067
    5   HG22  THR  83          HG21      THR  83   4.488   0.771  -4.372
    6   HG21  THR  83          HG22      THR  83   3.195   1.161  -3.240
    7   HG23  THR  83          HG23      THR  83   4.874   1.495  -2.812

  No H/Q in entry =           7
  In of MODEL   12
    1    H    SER  84           H        SER  84   2.500   4.774  -5.885
    2    HA   SER  84           HA       SER  84   3.852   7.207  -5.427
    3    HB2  SER  84           HB2      SER  84   1.788   6.384  -7.456
    4    HB3  SER  84           HB3      SER  84   2.477   8.007  -7.430
    5    HG   SER  84           HG       SER  84   3.835   5.523  -7.709

  No H/Q in entry =           5
  In of MODEL   12
    1    H    MET  85           H        MET  85   0.353   6.473  -5.273
    2    HA   MET  85           HA       MET  85  -0.495   9.090  -4.681
    3    HB2  MET  85           HB2      MET  85  -2.025   7.289  -5.356
    4    HB3  MET  85           HB3      MET  85  -1.751   6.484  -3.811
    5    HG2  MET  85           HG2      MET  85  -2.637   8.446  -2.615
    6    HG3  MET  85           HG3      MET  85  -2.884   9.276  -4.151
    7    HE3  MET  85           HE1      MET  85  -3.919   5.238  -3.338
    8    HE2  MET  85           HE2      MET  85  -5.082   5.886  -2.184
    9    HE1  MET  85           HE3      MET  85  -3.385   6.342  -2.064

  No H/Q in entry =           9
  In of MODEL   12
    1    H    LEU  86           H        LEU  86   0.395   6.425  -2.528
    2    HA   LEU  86           HA       LEU  86  -0.143   7.735  -0.091
    3    HB2  LEU  86           HB2      LEU  86   0.306   5.261  -0.478
    4    HB3  LEU  86           HB3      LEU  86   2.017   5.678  -0.565
    5    HG   LEU  86           HG       LEU  86   1.688   6.845   1.700
    6   HD11  LEU  86          HD11      LEU  86  -1.009   6.097   1.215
    7   HD13  LEU  86          HD12      LEU  86  -0.346   6.842   2.668
    8   HD12  LEU  86          HD13      LEU  86  -0.448   5.087   2.551
    9   HD23  LEU  86          HD21      LEU  86   1.237   3.856   1.824
   10   HD22  LEU  86          HD22      LEU  86   2.241   4.860   2.868
   11   HD21  LEU  86          HD23      LEU  86   2.749   4.529   1.213

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ALA  87           H        ALA  87   2.846   7.416  -1.964
    2    HA   ALA  87           HA       ALA  87   4.553   8.816  -0.232
    3    HB3  ALA  87           HB1      ALA  87   4.655   7.799  -2.937
    4    HB2  ALA  87           HB2      ALA  87   5.986   8.121  -1.829
    5    HB1  ALA  87           HB3      ALA  87   5.387   9.404  -2.878

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ARG  88           H        ARG  88   2.629   9.963  -2.964
    2    HA   ARG  88           HA       ARG  88   3.425  12.647  -2.847
    3    HB2  ARG  88           HB2      ARG  88   2.171  11.502  -4.709
    4    HB3  ARG  88           HB3      ARG  88   0.710  11.658  -3.734
    5    HG2  ARG  88           HG2      ARG  88   1.750  14.230  -3.649
    6    HG3  ARG  88           HG3      ARG  88   2.178  13.710  -5.277
    7    HD2  ARG  88           HD2      ARG  88   0.042  13.807  -5.986
    8    HD3  ARG  88           HD3      ARG  88  -0.560  12.961  -4.560
    9    HE   ARG  88           HE       ARG  88  -0.724  15.739  -4.982
   10   HH21  ARG  88          HH11      ARG  88  -1.249  17.076  -3.249
   11   HH22  ARG  88          HH12      ARG  88  -0.966  16.538  -1.629
   12   HH11  ARG  88          HH21      ARG  88   0.260  13.472  -2.600
   13   HH12  ARG  88          HH22      ARG  88  -0.129  14.492  -1.262

  No H/Q in entry =          13
  In of MODEL   12
    1    H    GLU  89           H        GLU  89   0.698  10.998  -1.219
    2    HA   GLU  89           HA       GLU  89  -0.396  13.321  -0.023
    3    HB2  GLU  89           HB2      GLU  89  -1.532  11.091  -0.113
    4    HB3  GLU  89           HB3      GLU  89  -0.420  10.528   1.135
    5    HG2  GLU  89           HG2      GLU  89  -1.233  12.235   2.688
    6    HG3  GLU  89           HG3      GLU  89  -2.273  12.914   1.438

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LEU  90           H        LEU  90   2.029  11.008   1.167
    2    HA   LEU  90           HA       LEU  90   2.383  12.253   3.697
    3    HB2  LEU  90           HB2      LEU  90   4.149  10.460   2.031
    4    HB3  LEU  90           HB3      LEU  90   4.564  10.975   3.671
    5    HG   LEU  90           HG       LEU  90   1.921   9.653   2.998
    6   HD12  LEU  90          HD11      LEU  90   3.037   7.598   4.015
    7   HD11  LEU  90          HD12      LEU  90   4.568   8.440   3.780
    8   HD13  LEU  90          HD13      LEU  90   3.559   8.040   2.388
    9   HD22  LEU  90          HD21      LEU  90   1.654  10.581   5.117
   10   HD21  LEU  90          HD22      LEU  90   3.368  10.459   5.508
   11   HD23  LEU  90          HD23      LEU  90   2.348   9.021   5.553

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  91           H        ILE  91   4.006  12.617   0.578
    2    HA   ILE  91           HA       ILE  91   5.996  14.430   1.425
    3    HB   ILE  91           HB       ILE  91   4.693  13.949  -1.261
    4   HG12  ILE  91          HG12      ILE  91   7.516  13.435  -0.272
    5   HG13  ILE  91          HG13      ILE  91   6.222  12.250  -0.115
    6   HG22  ILE  91          HG21      ILE  91   6.933  15.273  -1.940
    7   HG21  ILE  91          HG22      ILE  91   6.623  16.079  -0.401
    8   HG23  ILE  91          HG23      ILE  91   5.407  16.118  -1.676
    9   HD13  ILE  91          HD11      ILE  91   6.058  11.926  -2.422
   10   HD12  ILE  91          HD12      ILE  91   7.793  12.152  -2.200
   11   HD11  ILE  91          HD13      ILE  91   6.799  13.484  -2.793

  No H/Q in entry =          11
  In of MODEL   12
    1    H    THR  92           H        THR  92   2.644  14.894   0.399
    2    HA   THR  92           HA       THR  92   2.646  17.717   0.335
    3    HB   THR  92           HB       THR  92   0.455  15.745   1.026
    4    HG1  THR  92           HG1      THR  92   0.768  15.561  -1.057
    5   HG22  THR  92          HG21      THR  92  -0.921  17.920   0.294
    6   HG21  THR  92          HG22      THR  92   0.476  18.732   0.997
    7   HG23  THR  92          HG23      THR  92  -0.481  17.621   1.975

  No H/Q in entry =           7
  In of MODEL   12
    1    H    GLU  93           H        GLU  93   2.061  15.426   2.989
    2    HA   GLU  93           HA       GLU  93   1.538  17.337   5.003
    3    HB2  GLU  93           HB2      GLU  93   2.822  14.600   5.248
    4    HB3  GLU  93           HB3      GLU  93   2.134  15.535   6.577
    5    HG2  GLU  93           HG2      GLU  93   0.526  14.771   4.131
    6    HG3  GLU  93           HG3      GLU  93   0.610  13.749   5.561

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LEU  94           H        LEU  94   4.535  15.824   3.870
    2    HA   LEU  94           HA       LEU  94   6.287  16.956   5.766
    3    HB2  LEU  94           HB2      LEU  94   6.694  15.981   2.938
    4    HB3  LEU  94           HB3      LEU  94   8.025  16.627   3.893
    5    HG   LEU  94           HG       LEU  94   6.257  14.450   5.022
    6   HD11  LEU  94          HD11      LEU  94   8.361  14.200   2.902
    7   HD13  LEU  94          HD12      LEU  94   6.904  13.241   3.157
    8   HD12  LEU  94          HD13      LEU  94   8.322  12.975   4.172
    9   HD23  LEU  94          HD21      LEU  94   8.436  13.892   6.186
   10   HD22  LEU  94          HD22      LEU  94   7.782  15.478   6.598
   11   HD21  LEU  94          HD23      LEU  94   9.126  15.342   5.462

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  95           H        ILE  95   5.176  18.135   2.609
    2    HA   ILE  95           HA       ILE  95   6.772  20.476   2.555
    3    HB   ILE  95           HB       ILE  95   4.128  19.818   1.236
    4   HG12  ILE  95          HG12      ILE  95   6.926  20.126   0.113
    5   HG13  ILE  95          HG13      ILE  95   6.258  18.580   0.627
    6   HG21  ILE  95          HG21      ILE  95   5.903  22.267   1.022
    7   HG23  ILE  95          HG22      ILE  95   4.176  22.217   1.370
    8   HG22  ILE  95          HG23      ILE  95   4.763  21.809  -0.243
    9   HD13  ILE  95          HD11      ILE  95   4.707  18.517  -1.110
   10   HD12  ILE  95          HD12      ILE  95   6.068  19.321  -1.892
   11   HD11  ILE  95          HD13      ILE  95   4.702  20.270  -1.308

  No H/Q in entry =          11
  In of MODEL   12
    1    H    GLU  96           H        GLU  96   3.510  19.859   3.834
    2    HA   GLU  96           HA       GLU  96   2.913  22.513   4.579
    3    HB2  GLU  96           HB2      GLU  96   1.220  20.747   4.584
    4    HB3  GLU  96           HB3      GLU  96   2.067  19.912   5.885
    5    HG2  GLU  96           HG2      GLU  96   1.052  21.208   7.447
    6    HG3  GLU  96           HG3      GLU  96   1.606  22.675   6.651

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LEU  97           H        LEU  97   4.721  19.945   6.216
    2    HA   LEU  97           HA       LEU  97   5.080  21.293   8.687
    3    HB2  LEU  97           HB2      LEU  97   6.602  19.107   7.284
    4    HB3  LEU  97           HB3      LEU  97   7.191  19.787   8.798
    5    HG   LEU  97           HG       LEU  97   4.372  18.722   8.474
    6   HD12  LEU  97          HD11      LEU  97   5.284  16.702   9.694
    7   HD11  LEU  97          HD12      LEU  97   6.904  17.316   9.357
    8   HD13  LEU  97          HD13      LEU  97   5.836  16.867   8.027
    9   HD23  LEU  97          HD21      LEU  97   4.808  18.427  11.041
   10   HD22  LEU  97          HD22      LEU  97   4.448  20.041  10.432
   11   HD21  LEU  97          HD23      LEU  97   6.113  19.585  10.787

  No H/Q in entry =          11
  In of MODEL   12
    1    H    HIS  98           H        HIS  98   6.966  21.286   5.672
    2    HA   HIS  98           HA       HIS  98   9.132  22.843   6.580
    3    HB2  HIS  98           HB2      HIS  98   7.850  22.599   3.848
    4    HB3  HIS  98           HB3      HIS  98   9.299  23.562   4.145
    5    HD1  HIS  98           HD1      HIS  98   8.049  20.005   4.162
    6    HD2  HIS  98           HD2      HIS  98  11.650  22.063   4.603
    7    HE1  HIS  98           HE1      HIS  98   9.886  18.255   4.117
    8    HE2  HIS  98           HE2      HIS  98  12.082  19.488   4.386

  No H/Q in entry =           8
  In of MODEL   12
    1    H    GLU  99           H        GLU  99   5.926  23.712   5.387
    2    HA   GLU  99           HA       GLU  99   6.336  26.522   5.328
    3    HB2  GLU  99           HB2      GLU  99   4.450  25.372   4.189
    4    HB3  GLU  99           HB3      GLU  99   3.742  25.020   5.765
    5    HG2  GLU  99           HG2      GLU  99   3.585  27.414   6.262
    6    HG3  GLU  99           HG3      GLU  99   4.374  27.804   4.737

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LYS 100           H        LYS 100   5.168  24.302   7.846
    2    HA   LYS 100           HA       LYS 100   4.594  26.365   9.735
    3    HB2  LYS 100           HB2      LYS 100   5.135  23.408  10.087
    4    HB3  LYS 100           HB3      LYS 100   4.693  24.487  11.416
    5    HG2  LYS 100           HG2      LYS 100   2.641  25.146  10.156
    6    HG3  LYS 100           HG3      LYS 100   3.061  23.971   8.907
    7    HD2  LYS 100           HD2      LYS 100   2.955  22.153  10.570
    8    HD3  LYS 100           HD3      LYS 100   2.551  23.321  11.830
    9    HE2  LYS 100           HE2      LYS 100   0.512  23.964  10.556
   10    HE3  LYS 100           HE3      LYS 100   0.904  22.739   9.344
   11    HZ1  LYS 100           HZ1      LYS 100   0.616  22.078  12.224
   12    HZ3  LYS 100           HZ2      LYS 100   0.596  21.023  10.890
   13    HZ2  LYS 100           HZ3      LYS 100  -0.709  22.077  11.162

  No H/Q in entry =          13
  In of MODEL   12
    1    H    LEU 101           H        LEU 101   7.502  24.536   8.918
    2    HA   LEU 101           HA       LEU 101   9.098  25.360  11.129
    3    HB2  LEU 101           HB2      LEU 101   9.696  24.364   8.355
    4    HB3  LEU 101           HB3      LEU 101  11.000  25.015   9.343
    5    HG   LEU 101           HG       LEU 101   9.139  22.881  10.399
    6   HD12  LEU 101          HD11      LEU 101  11.179  21.362   9.803
    7   HD11  LEU 101          HD12      LEU 101  11.566  22.620   8.631
    8   HD13  LEU 101          HD13      LEU 101  10.028  21.764   8.530
    9   HD21  LEU 101          HD21      LEU 101  11.871  23.959  11.140
   10   HD23  LEU 101          HD22      LEU 101  11.307  22.394  11.719
   11   HD22  LEU 101          HD23      LEU 101  10.429  23.860  12.150

  No H/Q in entry =          11
  In of MODEL   12
    1    H    LYS 102           H        LYS 102   7.547  27.239   8.978
    2    HA   LYS 102           HA       LYS 102   7.653  29.531   8.685
    3    HB2  LYS 102           HB2      LYS 102   9.205  29.400  10.791
    4    HB3  LYS 102           HB3      LYS 102  10.513  29.578   9.638
    5    HG2  LYS 102           HG2      LYS 102   8.425  31.556  10.487
    6    HG3  LYS 102           HG3      LYS 102  10.142  31.796  10.244
    7    HD2  LYS 102           HD2      LYS 102   8.198  31.393   7.935
    8    HD3  LYS 102           HD3      LYS 102   8.596  32.969   8.603
    9    HE2  LYS 102           HE2      LYS 102   9.966  31.766   6.538
   10    HE3  LYS 102           HE3      LYS 102  10.592  33.067   7.551
   11    HZ2  LYS 102           HZ1      LYS 102  12.091  31.145   7.386
   12    HZ1  LYS 102           HZ2      LYS 102  10.914  30.176   8.124
   13    HZ3  LYS 102           HZ3      LYS 102  11.617  31.456   8.985

  No H/Q in entry =          13
  In of MODEL   12
    1    H    ALA 103           H        ALA 103  10.897  28.153   8.138
    2    HA   ALA 103           HA       ALA 103  11.888  29.517   6.066
    3    HB2  ALA 103           HB1      ALA 103  12.752  27.291   5.145
    4    HB1  ALA 103           HB2      ALA 103  11.841  26.529   6.447
    5    HB3  ALA 103           HB3      ALA 103  13.142  27.658   6.826

  No H/Q in entry =           5
  In of MODEL   12
    1    H1   LYS   3           H1       LYS   3 -31.689   5.819 -19.717
    2    H2   LYS   3           H3       LYS   3 -30.695   5.574 -21.072
    3    H3   LYS   3           H2       LYS   3 -32.055   4.588 -20.828
    4    HA   LYS   3           HA       LYS   3 -31.002   3.225 -19.436
    5    HB2  LYS   3           HB2      LYS   3 -28.773   4.726 -20.763
    6    HB3  LYS   3           HB3      LYS   3 -28.404   3.521 -19.530
    7    HG2  LYS   3           HG2      LYS   3 -29.773   1.895 -20.888
    8    HG3  LYS   3           HG3      LYS   3 -29.772   3.106 -22.170
    9    HD2  LYS   3           HD2      LYS   3 -27.287   3.078 -22.126
   10    HD3  LYS   3           HD3      LYS   3 -27.358   1.768 -20.947
   11    HE2  LYS   3           HE2      LYS   3 -28.819   0.552 -22.669
   12    HE3  LYS   3           HE3      LYS   3 -28.243   1.759 -23.817
   13    HZ3  LYS   3           HZ1      LYS   3 -26.404   0.596 -24.099
   14    HZ2  LYS   3           HZ2      LYS   3 -26.990  -0.601 -23.047
   15    HZ1  LYS   3           HZ3      LYS   3 -26.044   0.672 -22.442

  No H/Q in entry =          15
  In of MODEL   12
    1    H    LYS   4           H        LYS   4 -31.044   3.068 -17.375
    2    HA   LYS   4           HA       LYS   4 -30.388   5.367 -15.712
    3    HB2  LYS   4           HB2      LYS   4 -31.495   2.630 -15.027
    4    HB3  LYS   4           HB3      LYS   4 -31.317   3.968 -13.892
    5    HG2  LYS   4           HG2      LYS   4 -33.127   3.861 -16.311
    6    HG3  LYS   4           HG3      LYS   4 -33.615   3.883 -14.617
    7    HD2  LYS   4           HD2      LYS   4 -32.994   6.126 -14.337
    8    HD3  LYS   4           HD3      LYS   4 -31.957   6.112 -15.763
    9    HE2  LYS   4           HE2      LYS   4 -33.929   7.424 -16.211
   10    HE3  LYS   4           HE3      LYS   4 -33.961   5.955 -17.189
   11    HZ3  LYS   4           HZ1      LYS   4 -35.502   4.980 -15.645
   12    HZ2  LYS   4           HZ2      LYS   4 -36.109   6.461 -16.218
   13    HZ1  LYS   4           HZ3      LYS   4 -35.445   6.361 -14.657

  No H/Q in entry =          13
  In of MODEL   12
    1    H    HIS   5           H        HIS   5 -28.919   5.490 -14.123
    2    HA   HIS   5           HA       HIS   5 -26.578   3.740 -14.472
    3    HB2  HIS   5           HB2      HIS   5 -26.920   6.476 -13.246
    4    HB3  HIS   5           HB3      HIS   5 -25.408   5.571 -13.239
    5    HD1  HIS   5           HD1      HIS   5 -23.982   6.829 -14.824
    6    HD2  HIS   5           HD2      HIS   5 -27.765   6.095 -16.373
    7    HE1  HIS   5           HE1      HIS   5 -23.840   7.430 -17.271
    8    HE2  HIS   5           HE2      HIS   5 -26.146   6.971 -18.184

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ILE   6           H        ILE   6 -26.296   2.166 -13.166
    2    HA   ILE   6           HA       ILE   6 -27.272   2.384 -10.398
    3    HB   ILE   6           HB       ILE   6 -26.373  -0.045 -11.954
    4   HG12  ILE   6          HG12      ILE   6 -29.142   0.798 -11.091
    5   HG13  ILE   6          HG13      ILE   6 -28.510   0.991 -12.725
    6   HG23  ILE   6          HG21      ILE   6 -26.700  -1.320 -10.101
    7   HG22  ILE   6          HG22      ILE   6 -27.893  -0.217  -9.412
    8   HG21  ILE   6          HG23      ILE   6 -26.174   0.173  -9.324
    9   HD13  ILE   6          HD11      ILE   6 -28.902  -1.138 -13.239
   10   HD12  ILE   6          HD12      ILE   6 -29.914  -1.164 -11.794
   11   HD11  ILE   6          HD13      ILE   6 -28.242  -1.718 -11.710

  No H/Q in entry =          11
  In of MODEL   12
    1    H    TYR   7           H        TYR   7 -25.531   3.072  -9.111
    2    HA   TYR   7           HA       TYR   7 -22.792   2.206  -9.803
    3    HB2  TYR   7           HB2      TYR   7 -23.829   4.598  -8.304
    4    HB3  TYR   7           HB3      TYR   7 -22.129   4.137  -8.349
    5    HD1  TYR   7           HD1      TYR   7 -23.146   3.183 -11.443
    6    HD2  TYR   7           HD2      TYR   7 -22.583   6.759  -9.195
    7    HE1  TYR   7           HE1      TYR   7 -22.759   4.439 -13.527
    8    HE2  TYR   7           HE2      TYR   7 -22.238   8.021 -11.270
    9    HH   TYR   7           HH       TYR   7 -22.460   7.941 -13.502

  No H/Q in entry =           9
  In of MODEL   12
    1    H    LEU   8           H        LEU   8 -21.782   0.876  -8.486
    2    HA   LEU   8           HA       LEU   8 -22.889   0.328  -5.803
    3    HB2  LEU   8           HB2      LEU   8 -21.140  -1.269  -7.653
    4    HB3  LEU   8           HB3      LEU   8 -21.309  -1.668  -5.943
    5    HG   LEU   8           HG       LEU   8 -23.784  -1.915  -6.361
    6   HD13  LEU   8          HD11      LEU   8 -23.957  -0.690  -8.461
    7   HD12  LEU   8          HD12      LEU   8 -24.435  -2.368  -8.712
    8   HD11  LEU   8          HD13      LEU   8 -22.846  -1.816  -9.237
    9   HD23  LEU   8          HD21      LEU   8 -22.450  -3.904  -8.071
   10   HD22  LEU   8          HD22      LEU   8 -23.528  -4.114  -6.691
   11   HD21  LEU   8          HD23      LEU   8 -21.832  -3.710  -6.431

  No H/Q in entry =          11
  In of MODEL   12
    1    H    PHE   9           H        PHE   9 -21.630   0.765  -4.018
    2    HA   PHE   9           HA       PHE   9 -18.876   1.789  -4.528
    3    HB2  PHE   9           HB2      PHE   9 -20.935   2.786  -2.564
    4    HB3  PHE   9           HB3      PHE   9 -19.239   3.247  -2.520
    5    HD1  PHE   9           HD1      PHE   9 -18.252   4.612  -4.288
    6    HD2  PHE   9           HD2      PHE   9 -22.416   3.580  -4.346
    7    HE1  PHE   9           HE1      PHE   9 -18.651   6.317  -6.038
    8    HE2  PHE   9           HE2      PHE   9 -22.816   5.297  -6.091
    9    HZ   PHE   9           HZ       PHE   9 -20.932   6.661  -6.944

  No H/Q in entry =           9
  In of MODEL   12
    1    H    SER  10           H        SER  10 -17.242   0.923  -3.389
    2    HA   SER  10           HA       SER  10 -17.422   0.002  -0.714
    3    HB2  SER  10           HB2      SER  10 -17.154  -2.375  -1.042
    4    HB3  SER  10           HB3      SER  10 -18.616  -1.859  -1.868
    5    HG   SER  10           HG       SER  10 -16.365  -2.973  -2.859

  No H/Q in entry =           5
  In of MODEL   12
    1    H    SER  11           H        SER  11 -15.404   0.142   0.116
    2    HA   SER  11           HA       SER  11 -13.245   1.045  -1.436
    3    HB2  SER  11           HB2      SER  11 -12.019   1.084   0.550
    4    HB3  SER  11           HB3      SER  11 -13.689   1.270   1.090
    5    HG   SER  11           HG       SER  11 -13.018  -1.338   0.829

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA  12           H        ALA  12 -14.378  -1.661  -2.220
    2    HA   ALA  12           HA       ALA  12 -11.786  -2.888  -2.731
    3    HB2  ALA  12           HB1      ALA  12 -12.280  -4.107  -0.767
    4    HB3  ALA  12           HB2      ALA  12 -12.740  -5.173  -2.092
    5    HB1  ALA  12           HB3      ALA  12 -13.980  -4.286  -1.208

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLY  13           H        GLY  13 -12.680  -1.810  -4.742
    2    HA3  GLY  13           HA2      GLY  13 -14.873  -2.637  -6.209
    3    HA2  GLY  13           HA3      GLY  13 -13.355  -2.090  -6.935

  No H/Q in entry =           3
  In of MODEL   12
    1    H    MET  14           H        MET  14 -11.770  -4.317  -5.901
    2    HA   MET  14           HA       MET  14 -11.959  -6.079  -8.043
    3    HB2  MET  14           HB2      MET  14  -9.984  -5.997  -6.537
    4    HB3  MET  14           HB3      MET  14 -10.899  -6.868  -5.307
    5    HG2  MET  14           HG2      MET  14  -9.713  -8.581  -6.399
    6    HG3  MET  14           HG3      MET  14 -11.278  -8.632  -7.213
    7    HE2  MET  14           HE1      MET  14  -7.686  -8.840  -7.716
    8    HE1  MET  14           HE2      MET  14  -7.723  -7.157  -7.196
    9    HE3  MET  14           HE3      MET  14  -7.196  -7.554  -8.829

  No H/Q in entry =           9
  In of MODEL   12
    1    H    SER  15           H        SER  15 -13.318  -6.612  -4.805
    2    HA   SER  15           HA       SER  15 -14.539  -9.118  -5.586
    3    HB2  SER  15           HB2      SER  15 -14.815  -7.436  -3.100
    4    HB3  SER  15           HB3      SER  15 -15.894  -8.792  -3.417
    5    HG   SER  15           HG       SER  15 -13.741  -9.917  -3.873

  No H/Q in entry =           5
  In of MODEL   12
    1    H    THR  16           H        THR  16 -15.711  -5.774  -5.196
    2    HA   THR  16           HA       THR  16 -18.488  -6.344  -5.738
    3    HB   THR  16           HB       THR  16 -16.990  -3.746  -6.229
    4    HG1  THR  16           HG1      THR  16 -18.076  -3.502  -3.967
    5   HG23  THR  16          HG21      THR  16 -19.164  -2.733  -5.809
    6   HG22  THR  16          HG22      THR  16 -19.868  -4.320  -5.454
    7   HG21  THR  16          HG23      THR  16 -19.319  -3.931  -7.089

  No H/Q in entry =           7
  In of MODEL   12
    1    H    SER  17           H        SER  17 -15.656  -5.691  -7.588
    2    HA   SER  17           HA       SER  17 -16.811  -4.972 -10.084
    3    HB2  SER  17           HB2      SER  17 -14.143  -6.237  -9.419
    4    HB3  SER  17           HB3      SER  17 -14.605  -5.742 -11.048
    5    HG   SER  17           HG       SER  17 -14.896  -3.883  -8.998

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU  18           H        LEU  18 -16.139  -8.106  -8.656
    2    HA   LEU  18           HA       LEU  18 -16.681  -9.608 -11.020
    3    HB2  LEU  18           HB2      LEU  18 -15.427 -10.551  -9.137
    4    HB3  LEU  18           HB3      LEU  18 -16.848 -10.392  -8.105
    5    HG   LEU  18           HG       LEU  18 -18.059 -11.997  -9.483
    6   HD13  LEU  18          HD11      LEU  18 -17.268 -11.745 -11.666
    7   HD12  LEU  18          HD12      LEU  18 -16.534 -13.272 -11.175
    8   HD11  LEU  18          HD13      LEU  18 -15.579 -11.791 -11.162
    9   HD23  LEU  18          HD21      LEU  18 -15.345 -13.011  -8.693
   10   HD22  LEU  18          HD22      LEU  18 -16.812 -13.970  -8.897
   11   HD21  LEU  18          HD23      LEU  18 -16.714 -12.773  -7.606

  No H/Q in entry =          11
  In of MODEL   12
    1    H    LEU  19           H        LEU  19 -18.684  -8.482  -8.299
    2    HA   LEU  19           HA       LEU  19 -21.108  -9.739  -9.137
    3    HB2  LEU  19           HB2      LEU  19 -20.847  -8.904  -6.877
    4    HB3  LEU  19           HB3      LEU  19 -20.647  -7.260  -7.484
    5    HG   LEU  19           HG       LEU  19 -22.972  -7.156  -8.115
    6   HD11  LEU  19          HD11      LEU  19 -22.911 -10.072  -7.431
    7   HD13  LEU  19          HD12      LEU  19 -23.623  -9.269  -8.829
    8   HD12  LEU  19          HD13      LEU  19 -24.410  -9.159  -7.256
    9   HD21  LEU  19          HD21      LEU  19 -22.414  -8.144  -5.334
   10   HD23  LEU  19          HD22      LEU  19 -23.979  -7.495  -5.828
   11   HD22  LEU  19          HD23      LEU  19 -22.540  -6.479  -5.901

  No H/Q in entry =          11
  In of MODEL   12
    1    H    VAL  20           H        VAL  20 -19.717  -6.528  -9.813
    2    HA   VAL  20           HA       VAL  20 -21.863  -5.545 -11.373
    3    HB   VAL  20           HB       VAL  20 -18.895  -4.856 -11.494
    4   HG13  VAL  20          HG11      VAL  20 -19.728  -4.252 -13.642
    5   HG12  VAL  20          HG12      VAL  20 -19.742  -2.767 -12.691
    6   HG11  VAL  20          HG13      VAL  20 -21.242  -3.652 -12.967
    7   HG23  VAL  20          HG21      VAL  20 -19.789  -2.717 -10.460
    8   HG22  VAL  20          HG22      VAL  20 -19.771  -4.151  -9.438
    9   HG21  VAL  20          HG23      VAL  20 -21.281  -3.610 -10.169

  No H/Q in entry =           9
  In of MODEL   12
    1    H    SER  21           H        SER  21 -19.041  -7.498 -12.416
    2    HA   SER  21           HA       SER  21 -19.833  -7.395 -15.165
    3    HB2  SER  21           HB2      SER  21 -18.335  -9.314 -15.513
    4    HB3  SER  21           HB3      SER  21 -17.545  -8.045 -14.577
    5    HG   SER  21           HG       SER  21 -17.665  -9.242 -12.801

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LYS  22           H        LYS  22 -20.823  -9.630 -12.606
    2    HA   LYS  22           HA       LYS  22 -22.312 -11.287 -14.437
    3    HB2  LYS  22           HB2      LYS  22 -21.510 -11.939 -12.096
    4    HB3  LYS  22           HB3      LYS  22 -22.878 -11.004 -11.497
    5    HG2  LYS  22           HG2      LYS  22 -23.661 -13.194 -11.507
    6    HG3  LYS  22           HG3      LYS  22 -24.320 -12.506 -12.990
    7    HD2  LYS  22           HD2      LYS  22 -22.523 -13.551 -14.282
    8    HD3  LYS  22           HD3      LYS  22 -21.844 -14.227 -12.799
    9    HE2  LYS  22           HE2      LYS  22 -24.613 -14.846 -13.849
   10    HE3  LYS  22           HE3      LYS  22 -23.195 -15.857 -14.125
   11    HZ3  LYS  22           HZ1      LYS  22 -24.336 -16.801 -12.337
   12    HZ2  LYS  22           HZ2      LYS  22 -24.574 -15.305 -11.568
   13    HZ1  LYS  22           HZ3      LYS  22 -23.021 -15.987 -11.636

  No H/Q in entry =          13
  In of MODEL   12
    1    H    MET  23           H        MET  23 -23.125  -8.401 -12.548
    2    HA   MET  23           HA       MET  23 -25.930  -8.565 -13.052
    3    HB2  MET  23           HB2      MET  23 -24.155  -6.203 -12.466
    4    HB3  MET  23           HB3      MET  23 -25.905  -6.088 -12.642
    5    HG2  MET  23           HG2      MET  23 -26.253  -7.416 -10.681
    6    HG3  MET  23           HG3      MET  23 -24.530  -7.775 -10.559
    7    HE2  MET  23           HE1      MET  23 -26.939  -4.204  -9.344
    8    HE1  MET  23           HE2      MET  23 -27.165  -5.170 -10.800
    9    HE3  MET  23           HE3      MET  23 -26.175  -3.712 -10.856

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ARG  24           H        ARG  24 -23.224  -7.040 -14.830
    2    HA   ARG  24           HA       ARG  24 -24.763  -5.773 -16.818
    3    HB2  ARG  24           HB2      ARG  24 -22.335  -5.300 -16.438
    4    HB3  ARG  24           HB3      ARG  24 -21.948  -6.882 -17.069
    5    HG2  ARG  24           HG2      ARG  24 -22.811  -6.245 -19.310
    6    HG3  ARG  24           HG3      ARG  24 -23.259  -4.645 -18.663
    7    HD2  ARG  24           HD2      ARG  24 -20.445  -5.836 -18.636
    8    HD3  ARG  24           HD3      ARG  24 -21.033  -4.644 -19.789
    9    HE   ARG  24           HE       ARG  24 -21.268  -3.034 -18.040
   10   HH21  ARG  24          HH11      ARG  24 -19.427  -1.854 -17.519
   11   HH22  ARG  24          HH12      ARG  24 -18.121  -2.625 -16.687
   12   HH11  ARG  24          HH21      ARG  24 -19.567  -5.821 -17.151
   13   HH12  ARG  24          HH22      ARG  24 -18.218  -4.970 -16.465

  No H/Q in entry =          13
  In of MODEL   12
    1    H    ALA  25           H        ALA  25 -23.540  -9.078 -16.567
    2    HA   ALA  25           HA       ALA  25 -24.147  -9.908 -19.210
    3    HB1  ALA  25           HB1      ALA  25 -23.389 -11.924 -18.528
    4    HB3  ALA  25           HB2      ALA  25 -24.445 -11.945 -17.116
    5    HB2  ALA  25           HB3      ALA  25 -22.915 -11.072 -17.059

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLN  26           H        GLN  26 -25.968 -10.023 -16.184
    2    HA   GLN  26           HA       GLN  26 -28.276 -11.287 -17.207
    3    HB2  GLN  26           HB2      GLN  26 -27.812  -9.543 -14.808
    4    HB3  GLN  26           HB3      GLN  26 -29.354 -10.310 -15.163
    5    HG2  GLN  26           HG2      GLN  26 -26.726 -11.693 -14.707
    6    HG3  GLN  26           HG3      GLN  26 -28.087 -11.638 -13.594
    7   HE21  GLN  26          HE21      GLN  26 -26.808 -13.757 -14.888
    8   HE22  GLN  26          HE22      GLN  26 -27.820 -14.828 -15.691

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ALA  27           H        ALA  27 -27.442  -7.867 -16.791
    2    HA   ALA  27           HA       ALA  27 -29.964  -6.843 -17.565
    3    HB1  ALA  27           HB1      ALA  27 -28.192  -5.483 -16.441
    4    HB3  ALA  27           HB2      ALA  27 -28.806  -4.723 -17.911
    5    HB2  ALA  27           HB3      ALA  27 -27.246  -5.545 -17.929

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLU  28           H        GLU  28 -27.229  -7.970 -19.445
    2    HA   GLU  28           HA       GLU  28 -28.198  -6.940 -21.956
    3    HB2  GLU  28           HB2      GLU  28 -25.799  -7.557 -21.339
    4    HB3  GLU  28           HB3      GLU  28 -26.295  -9.234 -21.554
    5    HG2  GLU  28           HG2      GLU  28 -25.174  -8.409 -23.518
    6    HG3  GLU  28           HG3      GLU  28 -26.862  -8.779 -23.867

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LYS  29           H        LYS  29 -28.271 -10.061 -20.324
    2    HA   LYS  29           HA       LYS  29 -29.533 -11.553 -22.340
    3    HB2  LYS  29           HB2      LYS  29 -28.452 -12.522 -20.344
    4    HB3  LYS  29           HB3      LYS  29 -29.743 -11.861 -19.342
    5    HG2  LYS  29           HG2      LYS  29 -31.364 -13.272 -20.420
    6    HG3  LYS  29           HG3      LYS  29 -30.148 -13.863 -21.550
    7    HD2  LYS  29           HD2      LYS  29 -28.970 -15.010 -19.828
    8    HD3  LYS  29           HD3      LYS  29 -29.900 -14.206 -18.565
    9    HE2  LYS  29           HE2      LYS  29 -30.584 -16.573 -18.946
   10    HE3  LYS  29           HE3      LYS  29 -31.896 -15.416 -19.179
   11    HZ1  LYS  29           HZ1      LYS  29 -31.330 -15.513 -21.608
   12    HZ3  LYS  29           HZ2      LYS  29 -32.008 -16.926 -20.953
   13    HZ2  LYS  29           HZ3      LYS  29 -30.341 -16.847 -21.253

  No H/Q in entry =          13
  In of MODEL   12
    1    H    TYR  30           H        TYR  30 -30.982  -9.510 -19.817
    2    HA   TYR  30           HA       TYR  30 -33.633 -10.027 -21.060
    3    HB2  TYR  30           HB2      TYR  30 -33.011  -8.878 -18.330
    4    HB3  TYR  30           HB3      TYR  30 -34.621  -9.177 -18.984
    5    HD1  TYR  30           HD1      TYR  30 -35.463 -11.493 -19.216
    6    HD2  TYR  30           HD2      TYR  30 -31.649 -10.673 -17.509
    7    HE1  TYR  30           HE1      TYR  30 -35.305 -13.824 -18.439
    8    HE2  TYR  30           HE2      TYR  30 -31.492 -12.989 -16.736
    9    HH   TYR  30           HH       TYR  30 -33.063 -15.388 -17.847

  No H/Q in entry =           9
  In of MODEL   12
    1    H    GLU  31           H        GLU  31 -31.527  -7.966 -21.845
    2    HA   GLU  31           HA       GLU  31 -31.519  -5.801 -22.650
    3    HB2  GLU  31           HB2      GLU  31 -34.391  -6.597 -23.166
    4    HB3  GLU  31           HB3      GLU  31 -33.593  -5.200 -23.885
    5    HG2  GLU  31           HG2      GLU  31 -32.079  -6.584 -25.089
    6    HG3  GLU  31           HG3      GLU  31 -32.601  -8.021 -24.212

  No H/Q in entry =           6
  In of MODEL   12
    1    H    VAL  32           H        VAL  32 -31.717  -5.728 -19.917
    2    HA   VAL  32           HA       VAL  32 -33.641  -3.678 -19.239
    3    HB   VAL  32           HB       VAL  32 -31.218  -4.612 -17.668
    4   HG12  VAL  32          HG11      VAL  32 -32.777  -3.851 -15.764
    5   HG11  VAL  32          HG12      VAL  32 -33.638  -2.963 -17.020
    6   HG13  VAL  32          HG13      VAL  32 -31.941  -2.610 -16.699
    7   HG21  VAL  32          HG21      VAL  32 -32.935  -6.380 -18.370
    8   HG23  VAL  32          HG22      VAL  32 -33.998  -5.594 -17.201
    9   HG22  VAL  32          HG23      VAL  32 -32.460  -6.276 -16.674

  No H/Q in entry =           9
  In of MODEL   12
    1    HA   PRO  33           HA       PRO  33 -30.702  -0.645 -20.889
    2    HB2  PRO  33           HB2      PRO  33 -32.281   1.530 -20.746
    3    HB3  PRO  33           HB3      PRO  33 -32.710   0.223 -21.850
    4    HG2  PRO  33           HG2      PRO  33 -33.691   0.686 -19.032
    5    HG3  PRO  33           HG3      PRO  33 -34.650   0.460 -20.495
    6    HD2  PRO  33           HD2      PRO  33 -34.129  -1.612 -18.848
    7    HD3  PRO  33           HD3      PRO  33 -34.185  -1.840 -20.596

  No H/Q in entry =           7
  In of MODEL   12
    1    H    VAL  34           H        VAL  34 -29.420  -1.166 -18.947
    2    HA   VAL  34           HA       VAL  34 -29.209   1.253 -17.278
    3    HB   VAL  34           HB       VAL  34 -28.582  -0.207 -15.354
    4   HG12  VAL  34          HG11      VAL  34 -30.965  -1.157 -15.052
    5   HG11  VAL  34          HG12      VAL  34 -31.306  -0.394 -16.603
    6   HG13  VAL  34          HG13      VAL  34 -30.783   0.587 -15.234
    7   HG21  VAL  34          HG21      VAL  34 -28.706  -2.221 -17.379
    8   HG23  VAL  34          HG22      VAL  34 -29.750  -2.626 -16.016
    9   HG22  VAL  34          HG23      VAL  34 -28.041  -2.288 -15.747

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ILE  35           H        ILE  35 -27.248   1.742 -16.436
    2    HA   ILE  35           HA       ILE  35 -24.903   0.497 -17.713
    3    HB   ILE  35           HB       ILE  35 -25.393   3.366 -16.877
    4   HG12  ILE  35          HG12      ILE  35 -24.373   2.113 -19.433
    5   HG13  ILE  35          HG13      ILE  35 -26.022   2.679 -19.166
    6   HG21  ILE  35          HG21      ILE  35 -22.784   1.917 -17.201
    7   HG23  ILE  35          HG22      ILE  35 -23.274   3.071 -15.961
    8   HG22  ILE  35          HG23      ILE  35 -22.911   3.631 -17.594
    9   HD11  ILE  35          HD11      ILE  35 -24.689   4.911 -18.548
   10   HD13  ILE  35          HD12      ILE  35 -25.216   4.526 -20.187
   11   HD12  ILE  35          HD13      ILE  35 -23.553   4.205 -19.695

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ILE  36           H        ILE  36 -23.639  -0.501 -16.124
    2    HA   ILE  36           HA       ILE  36 -24.095   0.075 -13.247
    3    HB   ILE  36           HB       ILE  36 -23.184  -2.591 -14.381
    4   HG12  ILE  36          HG12      ILE  36 -26.014  -1.881 -13.607
    5   HG13  ILE  36          HG13      ILE  36 -25.446  -1.828 -15.275
    6   HG23  ILE  36          HG21      ILE  36 -23.505  -3.449 -12.274
    7   HG22  ILE  36          HG22      ILE  36 -24.672  -2.205 -11.823
    8   HG21  ILE  36          HG23      ILE  36 -22.953  -1.819 -11.892
    9   HD13  ILE  36          HD11      ILE  36 -25.541  -4.044 -15.501
   10   HD12  ILE  36          HD12      ILE  36 -26.608  -3.969 -14.100
   11   HD11  ILE  36          HD13      ILE  36 -24.897  -4.336 -13.886

  No H/Q in entry =          11
  In of MODEL   12
    1    H    GLU  37           H        GLU  37 -22.333   0.750 -12.140
    2    HA   GLU  37           HA       GLU  37 -19.620   0.049 -13.066
    3    HB2  GLU  37           HB2      GLU  37 -20.609   2.801 -12.343
    4    HB3  GLU  37           HB3      GLU  37 -18.904   2.366 -12.474
    5    HG2  GLU  37           HG2      GLU  37 -19.174   1.922 -14.834
    6    HG3  GLU  37           HG3      GLU  37 -20.896   2.284 -14.722

  No H/Q in entry =           6
  In of MODEL   12
    1    H    ALA  38           H        ALA  38 -18.124  -0.156 -11.386
    2    HA   ALA  38           HA       ALA  38 -19.157  -0.036  -8.614
    3    HB1  ALA  38           HB1      ALA  38 -17.383  -1.906 -10.058
    4    HB3  ALA  38           HB2      ALA  38 -18.422  -2.187  -8.661
    5    HB2  ALA  38           HB3      ALA  38 -16.833  -1.455  -8.444

  No H/Q in entry =           5
  In of MODEL   12
    1    H    PHE  39           H        PHE  39 -17.954   1.201  -7.130
    2    HA   PHE  39           HA       PHE  39 -15.471   2.493  -8.019
    3    HB2  PHE  39           HB2      PHE  39 -17.941   3.886  -7.010
    4    HB3  PHE  39           HB3      PHE  39 -16.340   4.608  -6.873
    5    HD1  PHE  39           HD1      PHE  39 -14.973   4.699  -9.101
    6    HD2  PHE  39           HD2      PHE  39 -19.215   4.342  -8.856
    7    HE1  PHE  39           HE1      PHE  39 -15.170   5.609 -11.398
    8    HE2  PHE  39           HE2      PHE  39 -19.428   5.242 -11.146
    9    HZ   PHE  39           HZ       PHE  39 -17.409   5.849 -12.435

  No H/Q in entry =           9
  In of MODEL   12
    1    HA   PRO  40           HA       PRO  40 -14.503   1.734  -3.741
    2    HB2  PRO  40           HB2      PRO  40 -12.804   3.801  -3.118
    3    HB3  PRO  40           HB3      PRO  40 -12.317   2.496  -4.199
    4    HG2  PRO  40           HG2      PRO  40 -13.435   5.201  -4.919
    5    HG3  PRO  40           HG3      PRO  40 -11.981   4.416  -5.534
    6    HD2  PRO  40           HD2      PRO  40 -14.200   4.262  -6.942
    7    HD3  PRO  40           HD3      PRO  40 -13.197   2.825  -6.764

  No H/Q in entry =           7
  In of MODEL   12
    1    H    GLU  41           H        GLU  41 -15.154   2.672  -1.601
    2    HA   GLU  41           HA       GLU  41 -17.455   4.296  -1.567
    3    HB2  GLU  41           HB2      GLU  41 -17.312   4.200   0.806
    4    HB3  GLU  41           HB3      GLU  41 -16.755   2.641   0.195
    5    HG2  GLU  41           HG2      GLU  41 -14.424   3.361   0.543
    6    HG3  GLU  41           HG3      GLU  41 -15.011   4.885   1.208

  No H/Q in entry =           6
  In of MODEL   12
    1    H    THR  42           H        THR  42 -14.157   5.328  -1.615
    2    HA   THR  42           HA       THR  42 -14.596   7.864  -0.380
    3    HB   THR  42           HB       THR  42 -12.464   8.523  -1.480
    4    HG1  THR  42           HG1      THR  42 -12.513   5.899  -2.564
    5   HG22  THR  42          HG21      THR  42 -11.057   6.724  -0.449
    6   HG21  THR  42          HG22      THR  42 -12.528   5.783  -0.195
    7   HG23  THR  42          HG23      THR  42 -12.319   7.329   0.625

  No H/Q in entry =           7
  In of MODEL   12
    1    H    LEU  43           H        LEU  43 -15.467   6.767  -3.489
    2    HA   LEU  43           HA       LEU  43 -15.818   9.537  -4.435
    3    HB2  LEU  43           HB2      LEU  43 -16.084   6.889  -5.848
    4    HB3  LEU  43           HB3      LEU  43 -16.363   8.462  -6.592
    5    HG   LEU  43           HG       LEU  43 -13.730   7.326  -5.688
    6   HD11  LEU  43          HD11      LEU  43 -15.028   7.857  -8.342
    7   HD13  LEU  43          HD12      LEU  43 -14.251   6.383  -7.765
    8   HD12  LEU  43          HD13      LEU  43 -13.273   7.790  -8.177
    9   HD22  LEU  43          HD21      LEU  43 -13.536   9.608  -5.211
   10   HD21  LEU  43          HD22      LEU  43 -14.551  10.077  -6.576
   11   HD23  LEU  43          HD23      LEU  43 -12.915   9.486  -6.858

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ALA  44           H        ALA  44 -17.696   7.630  -2.596
    2    HA   ALA  44           HA       ALA  44 -20.169   7.415  -3.916
    3    HB2  ALA  44           HB1      ALA  44 -19.989   6.285  -1.829
    4    HB3  ALA  44           HB2      ALA  44 -21.142   7.588  -1.544
    5    HB1  ALA  44           HB3      ALA  44 -19.475   7.750  -0.993

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLY  45           H        GLY  45 -18.845  10.249  -2.361
    2    HA3  GLY  45           HA2      GLY  45 -21.333  11.667  -2.707
    3    HA2  GLY  45           HA3      GLY  45 -19.811  12.339  -2.126

  No H/Q in entry =           3
  In of MODEL   12
    1    H    GLU  46           H        GLU  46 -18.251  11.476  -4.427
    2    HA   GLU  46           HA       GLU  46 -18.968  13.683  -6.176
    3    HB2  GLU  46           HB2      GLU  46 -16.626  13.271  -5.567
    4    HB3  GLU  46           HB3      GLU  46 -16.714  11.671  -6.304
    5    HG2  GLU  46           HG2      GLU  46 -15.572  13.100  -7.815
    6    HG3  GLU  46           HG3      GLU  46 -17.172  12.782  -8.486

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LYS  47           H        LYS  47 -18.726  10.174  -6.641
    2    HA   LYS  47           HA       LYS  47 -19.836  10.378  -9.313
    3    HB2  LYS  47           HB2      LYS  47 -19.190   7.989  -7.577
    4    HB3  LYS  47           HB3      LYS  47 -19.747   7.898  -9.248
    5    HG2  LYS  47           HG2      LYS  47 -17.252   9.360  -8.466
    6    HG3  LYS  47           HG3      LYS  47 -17.263   7.638  -8.842
    7    HD2  LYS  47           HD2      LYS  47 -18.317   8.178 -11.026
    8    HD3  LYS  47           HD3      LYS  47 -18.125   9.890 -10.648
    9    HE2  LYS  47           HE2      LYS  47 -15.876   7.894 -10.824
   10    HE3  LYS  47           HE3      LYS  47 -16.328   9.028 -12.095
   11    HZ1  LYS  47           HZ1      LYS  47 -16.086  10.628  -9.957
   12    HZ3  LYS  47           HZ2      LYS  47 -14.867  10.357 -11.109
   13    HZ2  LYS  47           HZ3      LYS  47 -14.873   9.477  -9.655

  No H/Q in entry =          13
  In of MODEL   12
    1    H    GLY  48           H        GLY  48 -21.126   9.549  -6.170
    2    HA3  GLY  48           HA2      GLY  48 -23.471   8.288  -6.918
    3    HA2  GLY  48           HA3      GLY  48 -23.278   9.278  -5.471

  No H/Q in entry =           3
  In of MODEL   12
    1    H    GLN  49           H        GLN  49 -22.781  11.732  -7.022
    2    HA   GLN  49           HA       GLN  49 -25.377  12.756  -7.154
    3    HB2  GLN  49           HB2      GLN  49 -22.867  13.718  -8.510
    4    HB3  GLN  49           HB3      GLN  49 -24.362  14.631  -8.417
    5    HG2  GLN  49           HG2      GLN  49 -24.200  14.641  -5.979
    6    HG3  GLN  49           HG3      GLN  49 -22.717  13.706  -6.072
    7   HE21  GLN  49          HE21      GLN  49 -22.676  15.927  -4.781
    8   HE22  GLN  49          HE22      GLN  49 -21.798  17.219  -5.419

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ASN  50           H        ASN  50 -23.638  10.955  -9.559
    2    HA   ASN  50           HA       ASN  50 -25.553  11.779 -11.631
    3    HB2  ASN  50           HB2      ASN  50 -22.922  10.330 -11.881
    4    HB3  ASN  50           HB3      ASN  50 -23.988  10.731 -13.220
    5   HD21  ASN  50          HD21      ASN  50 -21.380  11.653 -11.605
    6   HD22  ASN  50          HD22      ASN  50 -21.204  13.299 -11.934

  No H/Q in entry =           6
  In of MODEL   12
    1    H    ALA  51           H        ALA  51 -25.455   9.405  -9.405
    2    HA   ALA  51           HA       ALA  51 -26.168   7.250 -11.248
    3    HB2  ALA  51           HB1      ALA  51 -25.536   5.908  -9.574
    4    HB3  ALA  51           HB2      ALA  51 -26.683   6.668  -8.473
    5    HB1  ALA  51           HB3      ALA  51 -25.068   7.346  -8.667

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ASP  52           H        ASP  52 -28.136   6.126 -11.115
    2    HA   ASP  52           HA       ASP  52 -30.377   7.878 -10.432
    3    HB2  ASP  52           HB2      ASP  52 -30.103   5.396 -12.123
    4    HB3  ASP  52           HB3      ASP  52 -31.672   6.072 -11.680

  No H/Q in entry =           4
  In of MODEL   12
    1    H    VAL  53           H        VAL  53 -28.678   5.037  -9.442
    2    HA   VAL  53           HA       VAL  53 -30.118   5.095  -6.923
    3    HB   VAL  53           HB       VAL  53 -31.463   3.418  -8.178
    4   HG11  VAL  53          HG11      VAL  53 -29.691   2.629  -9.710
    5   HG13  VAL  53          HG12      VAL  53 -30.478   1.300  -8.860
    6   HG12  VAL  53          HG13      VAL  53 -28.886   1.852  -8.348
    7   HG23  VAL  53          HG21      VAL  53 -30.573   1.455  -6.504
    8   HG22  VAL  53          HG22      VAL  53 -31.744   2.718  -6.125
    9   HG21  VAL  53          HG23      VAL  53 -30.044   2.944  -5.718

  No H/Q in entry =           9
  In of MODEL   12
    1    H    VAL  54           H        VAL  54 -28.789   4.692  -5.273
    2    HA   VAL  54           HA       VAL  54 -26.003   3.940  -5.895
    3    HB   VAL  54           HB       VAL  54 -27.128   5.663  -3.629
    4   HG11  VAL  54          HG11      VAL  54 -24.505   4.332  -3.935
    5   HG13  VAL  54          HG12      VAL  54 -25.277   4.974  -2.487
    6   HG12  VAL  54          HG13      VAL  54 -24.408   6.056  -3.575
    7   HG22  VAL  54          HG21      VAL  54 -26.331   7.513  -4.714
    8   HG21  VAL  54          HG22      VAL  54 -26.847   6.517  -6.074
    9   HG23  VAL  54          HG23      VAL  54 -25.142   6.595  -5.638

  No H/Q in entry =           9
  In of MODEL   12
    1    H    LEU  55           H        LEU  55 -25.347   2.034  -5.269
    2    HA   LEU  55           HA       LEU  55 -26.808   0.656  -3.103
    3    HB2  LEU  55           HB2      LEU  55 -25.217  -0.442  -5.409
    4    HB3  LEU  55           HB3      LEU  55 -25.945  -1.411  -4.128
    5    HG   LEU  55           HG       LEU  55 -27.436   0.146  -6.230
    6   HD13  LEU  55          HD11      LEU  55 -27.078  -1.685  -7.466
    7   HD12  LEU  55          HD12      LEU  55 -28.004  -2.601  -6.276
    8   HD11  LEU  55          HD13      LEU  55 -26.251  -2.480  -6.127
    9   HD23  LEU  55          HD21      LEU  55 -28.663  -1.856  -4.389
   10   HD22  LEU  55          HD22      LEU  55 -29.405  -0.491  -5.225
   11   HD21  LEU  55          HD23      LEU  55 -28.392  -0.213  -3.809

  No H/Q in entry =          11
  In of MODEL   12
    1    H    LEU  56           H        LEU  56 -25.635   0.085  -1.304
    2    HA   LEU  56           HA       LEU  56 -22.715   0.576  -1.354
    3    HB2  LEU  56           HB2      LEU  56 -24.507   0.286   1.046
    4    HB3  LEU  56           HB3      LEU  56 -22.812   0.772   1.035
    5    HG   LEU  56           HG       LEU  56 -25.165   2.383   0.088
    6   HD11  LEU  56          HD11      LEU  56 -24.035   2.017   2.604
    7   HD13  LEU  56          HD12      LEU  56 -25.070   3.357   2.111
    8   HD12  LEU  56          HD13      LEU  56 -23.317   3.519   2.022
    9   HD23  LEU  56          HD21      LEU  56 -23.277   4.145  -0.093
   10   HD22  LEU  56          HD22      LEU  56 -23.626   3.047  -1.429
   11   HD21  LEU  56          HD23      LEU  56 -22.260   2.730  -0.361

  No H/Q in entry =          11
  In of MODEL   12
    1    H    GLY  57           H        GLY  57 -21.282  -1.013  -0.835
    2    HA3  GLY  57           HA2      GLY  57 -22.115  -3.726  -1.054
    3    HA2  GLY  57           HA3      GLY  57 -20.510  -3.182  -0.570

  No H/Q in entry =           3
  In of MODEL   12
    1    HA   PRO  58           HA       PRO  58 -23.279  -4.342   3.132
    2    HB2  PRO  58           HB2      PRO  58 -22.510  -6.929   3.717
    3    HB3  PRO  58           HB3      PRO  58 -23.909  -6.557   2.709
    4    HG2  PRO  58           HG2      PRO  58 -21.155  -7.343   1.912
    5    HG3  PRO  58           HG3      PRO  58 -22.705  -7.848   1.239
    6    HD2  PRO  58           HD2      PRO  58 -21.157  -5.970   0.030
    7    HD3  PRO  58           HD3      PRO  58 -22.918  -5.939  -0.070

  No H/Q in entry =           7
  In of MODEL   12
    1    H    GLN  59           H        GLN  59 -19.896  -4.701   2.517
    2    HA   GLN  59           HA       GLN  59 -19.137  -4.717   5.278
    3    HB2  GLN  59           HB2      GLN  59 -17.613  -3.867   2.814
    4    HB3  GLN  59           HB3      GLN  59 -16.920  -3.920   4.423
    5    HG2  GLN  59           HG2      GLN  59 -18.041  -6.272   2.908
    6    HG3  GLN  59           HG3      GLN  59 -16.337  -5.888   3.088
    7   HE21  GLN  59          HE21      GLN  59 -18.474  -7.721   4.103
    8   HE22  GLN  59          HE22      GLN  59 -18.197  -8.322   5.630

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ILE  60           H        ILE  60 -20.155  -2.180   3.092
    2    HA   ILE  60           HA       ILE  60 -19.362  -0.213   5.152
    3    HB   ILE  60           HB       ILE  60 -19.649   1.524   3.342
    4   HG12  ILE  60          HG12      ILE  60 -19.389  -0.667   1.329
    5   HG13  ILE  60          HG13      ILE  60 -20.992  -0.202   1.899
    6   HG22  ILE  60          HG21      ILE  60 -17.577  -0.404   2.445
    7   HG21  ILE  60          HG22      ILE  60 -17.489   0.298   4.060
    8   HG23  ILE  60          HG23      ILE  60 -17.488   1.346   2.642
    9   HD12  ILE  60          HD11      ILE  60 -19.016   1.400   0.307
   10   HD11  ILE  60          HD12      ILE  60 -20.235   2.216   1.285
   11   HD13  ILE  60          HD13      ILE  60 -20.728   1.119  -0.005

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ALA  61           H        ALA  61 -21.766  -1.876   5.211
    2    HA   ALA  61           HA       ALA  61 -24.045  -0.280   4.768
    3    HB1  ALA  61           HB1      ALA  61 -25.210  -1.819   6.083
    4    HB2  ALA  61           HB2      ALA  61 -23.798  -2.172   7.082
    5    HB3  ALA  61           HB3      ALA  61 -23.878  -2.767   5.424

  No H/Q in entry =           5
  In of MODEL   12
    1    H    TYR  62           H        TYR  62 -21.831  -0.344   7.563
    2    HA   TYR  62           HA       TYR  62 -23.436   1.249   9.248
    3    HB2  TYR  62           HB2      TYR  62 -21.419   1.715  10.493
    4    HB3  TYR  62           HB3      TYR  62 -21.400   0.025   9.989
    5    HD1  TYR  62           HD1      TYR  62 -19.765  -0.776   8.341
    6    HD2  TYR  62           HD2      TYR  62 -19.787   3.314   9.579
    7    HE1  TYR  62           HE1      TYR  62 -17.563  -0.450   7.285
    8    HE2  TYR  62           HE2      TYR  62 -17.569   3.636   8.524
    9    HH   TYR  62           HH       TYR  62 -16.247   2.612   6.767

  No H/Q in entry =           9
  In of MODEL   12
    1    H    MET  63           H        MET  63 -21.826   2.182   6.397
    2    HA   MET  63           HA       MET  63 -21.746   5.012   7.114
    3    HB2  MET  63           HB2      MET  63 -21.095   3.530   4.567
    4    HB3  MET  63           HB3      MET  63 -20.960   5.278   4.759
    5    HG2  MET  63           HG2      MET  63 -19.229   4.986   6.421
    6    HG3  MET  63           HG3      MET  63 -19.393   3.235   6.310
    7    HE2  MET  63           HE1      MET  63 -17.421   6.223   3.794
    8    HE1  MET  63           HE2      MET  63 -18.971   6.393   4.618
    9    HE3  MET  63           HE3      MET  63 -18.923   5.912   2.921

  No H/Q in entry =           9
  In of MODEL   12
    1    H    LEU  64           H        LEU  64 -24.253   3.087   6.138
    2    HA   LEU  64           HA       LEU  64 -25.510   4.483   4.073
    3    HB2  LEU  64           HB2      LEU  64 -26.310   2.344   4.975
    4    HB3  LEU  64           HB3      LEU  64 -26.791   3.161   6.462
    5    HG   LEU  64           HG       LEU  64 -28.526   4.371   5.247
    6   HD13  LEU  64          HD11      LEU  64 -28.255   4.639   3.016
    7   HD12  LEU  64          HD12      LEU  64 -28.850   2.986   2.858
    8   HD11  LEU  64          HD13      LEU  64 -27.116   3.297   2.916
    9   HD23  LEU  64          HD21      LEU  64 -28.959   1.550   4.477
   10   HD22  LEU  64          HD22      LEU  64 -29.979   2.645   5.409
   11   HD21  LEU  64          HD23      LEU  64 -28.580   1.889   6.166

  No H/Q in entry =          11
  In of MODEL   12
    1    HA   PRO  65           HA       PRO  65 -27.781   7.546   6.853
    2    HB2  PRO  65           HB2      PRO  65 -25.782   7.748   9.105
    3    HB3  PRO  65           HB3      PRO  65 -27.529   7.976   9.156
    4    HG2  PRO  65           HG2      PRO  65 -26.529   5.743  10.063
    5    HG3  PRO  65           HG3      PRO  65 -27.949   5.675   9.020
    6    HD2  PRO  65           HD2      PRO  65 -25.060   5.154   8.307
    7    HD3  PRO  65           HD3      PRO  65 -26.492   4.228   7.855

  No H/Q in entry =           7
  In of MODEL   12
    1    H    GLU  66           H        GLU  66 -24.225   7.598   6.919
    2    HA   GLU  66           HA       GLU  66 -24.013  10.407   6.536
    3    HB2  GLU  66           HB2      GLU  66 -22.132   8.161   5.863
    4    HB3  GLU  66           HB3      GLU  66 -21.734   9.868   5.669
    5    HG2  GLU  66           HG2      GLU  66 -21.952  10.213   8.040
    6    HG3  GLU  66           HG3      GLU  66 -22.427   8.529   8.259

  No H/Q in entry =           6
  In of MODEL   12
    1    H    ILE  67           H        ILE  67 -24.037   7.678   4.262
    2    HA   ILE  67           HA       ILE  67 -23.676   9.417   1.982
    3    HB   ILE  67           HB       ILE  67 -24.488   6.483   2.140
    4   HG12  ILE  67          HG12      ILE  67 -21.896   7.737   1.223
    5   HG13  ILE  67          HG13      ILE  67 -22.175   7.296   2.907
    6   HG21  ILE  67          HG21      ILE  67 -24.490   8.380  -0.070
    7   HG23  ILE  67          HG22      ILE  67 -25.067   6.714  -0.031
    8   HG22  ILE  67          HG23      ILE  67 -23.368   7.051  -0.360
    9   HD12  ILE  67          HD11      ILE  67 -21.707   5.556   0.541
   10   HD11  ILE  67          HD12      ILE  67 -22.702   4.943   1.861
   11   HD13  ILE  67          HD13      ILE  67 -21.043   5.454   2.172

  No H/Q in entry =          11
  In of MODEL   12
    1    H    GLN  68           H        GLN  68 -26.511   8.267   3.612
    2    HA   GLN  68           HA       GLN  68 -28.370   9.160   1.650
    3    HB2  GLN  68           HB2      GLN  68 -28.610   8.771   4.630
    4    HB3  GLN  68           HB3      GLN  68 -29.947   9.336   3.645
    5    HG2  GLN  68           HG2      GLN  68 -29.921   7.316   2.352
    6    HG3  GLN  68           HG3      GLN  68 -28.454   6.775   3.147
    7   HE21  GLN  68          HE21      GLN  68 -30.593   5.357   3.005
    8   HE22  GLN  68          HE22      GLN  68 -31.405   4.867   4.418

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ARG  69           H        ARG  69 -26.807  10.849   4.397
    2    HA   ARG  69           HA       ARG  69 -28.240  13.296   4.014
    3    HB2  ARG  69           HB2      ARG  69 -25.867  12.418   5.591
    4    HB3  ARG  69           HB3      ARG  69 -25.995  14.137   5.246
    5    HG2  ARG  69           HG2      ARG  69 -28.310  14.108   6.223
    6    HG3  ARG  69           HG3      ARG  69 -28.054  12.421   6.683
    7    HD2  ARG  69           HD2      ARG  69 -26.424  14.815   7.612
    8    HD3  ARG  69           HD3      ARG  69 -27.525  13.870   8.602
    9    HE   ARG  69           HE       ARG  69 -24.891  13.018   7.639
   10   HH21  ARG  69          HH11      ARG  69 -24.033  11.268   8.819
   11   HH22  ARG  69          HH12      ARG  69 -25.035  10.414   9.943
   12   HH11  ARG  69          HH21      ARG  69 -27.828  12.376   9.339
   13   HH12  ARG  69          HH22      ARG  69 -27.184  11.040  10.235

  No H/Q in entry =          13
  In of MODEL   12
    1    H    LEU  70           H        LEU  70 -25.335  11.979   2.637
    2    HA   LEU  70           HA       LEU  70 -24.289  14.383   1.486
    3    HB2  LEU  70           HB2      LEU  70 -23.231  12.089   2.060
    4    HB3  LEU  70           HB3      LEU  70 -23.837  11.619   0.472
    5    HG   LEU  70           HG       LEU  70 -22.284  13.043  -0.605
    6   HD11  LEU  70          HD11      LEU  70 -21.477  13.885   2.187
    7   HD13  LEU  70          HD12      LEU  70 -22.203  14.910   0.950
    8   HD12  LEU  70          HD13      LEU  70 -20.574  14.275   0.720
    9   HD22  LEU  70          HD21      LEU  70 -20.804  11.364  -0.390
   10   HD21  LEU  70          HD22      LEU  70 -21.713  10.805   1.015
   11   HD23  LEU  70          HD23      LEU  70 -20.357  11.912   1.224

  No H/Q in entry =          11
  In of MODEL   12
    1    H    LEU  71           H        LEU  71 -26.376  11.793   0.354
    2    HA   LEU  71           HA       LEU  71 -26.947  13.287  -2.148
    3    HB2  LEU  71           HB2      LEU  71 -27.074  10.295  -1.726
    4    HB3  LEU  71           HB3      LEU  71 -27.228  11.164  -3.252
    5    HG   LEU  71           HG       LEU  71 -24.705  11.228  -1.597
    6   HD12  LEU  71          HD11      LEU  71 -24.722   9.620  -4.042
    7   HD11  LEU  71          HD12      LEU  71 -25.712   8.960  -2.742
    8   HD13  LEU  71          HD13      LEU  71 -24.000   9.281  -2.469
    9   HD22  LEU  71          HD21      LEU  71 -24.858  13.054  -3.075
   10   HD21  LEU  71          HD22      LEU  71 -25.332  12.010  -4.414
   11   HD23  LEU  71          HD23      LEU  71 -23.705  11.899  -3.742

  No H/Q in entry =          11
  In of MODEL   12
    1    HA   PRO  72           HA       PRO  72 -30.794  12.719   0.478
    2    HB2  PRO  72           HB2      PRO  72 -31.714  15.258   0.420
    3    HB3  PRO  72           HB3      PRO  72 -30.392  14.830   1.504
    4    HG2  PRO  72           HG2      PRO  72 -30.242  16.052  -1.240
    5    HG3  PRO  72           HG3      PRO  72 -29.486  16.609   0.253
    6    HD2  PRO  72           HD2      PRO  72 -28.116  15.099  -1.530
    7    HD3  PRO  72           HD3      PRO  72 -27.852  14.924   0.205

  No H/Q in entry =           7
  In of MODEL   12
    1    H    ASN  73           H        ASN  73 -30.201  13.716  -2.730
    2    HA   ASN  73           HA       ASN  73 -33.055  13.342  -3.358
    3    HB2  ASN  73           HB2      ASN  73 -32.622  14.478  -5.447
    4    HB3  ASN  73           HB3      ASN  73 -32.120  15.458  -4.079
    5   HD21  ASN  73          HD21      ASN  73 -31.332  15.545  -6.758
    6   HD22  ASN  73          HD22      ASN  73 -29.661  15.425  -6.955

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LYS  74           H        LYS  74 -31.021  11.132  -2.956
    2    HA   LYS  74           HA       LYS  74 -31.562   9.745  -5.515
    3    HB2  LYS  74           HB2      LYS  74 -29.019   9.499  -3.902
    4    HB3  LYS  74           HB3      LYS  74 -29.387   8.690  -5.426
    5    HG2  LYS  74           HG2      LYS  74 -29.191  11.664  -5.199
    6    HG3  LYS  74           HG3      LYS  74 -27.793  10.636  -5.516
    7    HD2  LYS  74           HD2      LYS  74 -28.893   9.699  -7.464
    8    HD3  LYS  74           HD3      LYS  74 -30.335  10.660  -7.133
    9    HE2  LYS  74           HE2      LYS  74 -29.157  12.698  -7.561
   10    HE3  LYS  74           HE3      LYS  74 -27.617  11.844  -7.663
   11    HZ2  LYS  74           HZ1      LYS  74 -29.106  12.430  -9.780
   12    HZ1  LYS  74           HZ2      LYS  74 -29.724  10.890  -9.419
   13    HZ3  LYS  74           HZ3      LYS  74 -28.064  11.091  -9.718

  No H/Q in entry =          13
  In of MODEL   12
    1    HA   PRO  75           HA       PRO  75 -32.879   6.704  -2.565
    2    HB2  PRO  75           HB2      PRO  75 -33.143   4.493  -4.165
    3    HB3  PRO  75           HB3      PRO  75 -34.300   5.822  -4.221
    4    HG2  PRO  75           HG2      PRO  75 -31.954   5.292  -6.002
    5    HG3  PRO  75           HG3      PRO  75 -33.612   5.695  -6.441
    6    HD2  PRO  75           HD2      PRO  75 -31.714   7.604  -6.388
    7    HD3  PRO  75           HD3      PRO  75 -33.353   7.962  -5.842

  No H/Q in entry =           7
  In of MODEL   12
    1    H    VAL  76           H        VAL  76 -31.400   5.671  -1.204
    2    HA   VAL  76           HA       VAL  76 -28.911   4.526  -2.326
    3    HB   VAL  76           HB       VAL  76 -29.225   5.965   0.343
    4   HG11  VAL  76          HG11      VAL  76 -26.845   4.741  -1.063
    5   HG13  VAL  76          HG12      VAL  76 -27.527   4.264   0.492
    6   HG12  VAL  76          HG13      VAL  76 -26.716   5.821   0.327
    7   HG22  VAL  76          HG21      VAL  76 -28.603   7.887  -0.529
    8   HG21  VAL  76          HG22      VAL  76 -29.133   7.192  -2.061
    9   HG23  VAL  76          HG23      VAL  76 -27.429   7.138  -1.612

  No H/Q in entry =           9
  In of MODEL   12
    1    H    GLU  77           H        GLU  77 -28.644   2.372  -1.731
    2    HA   GLU  77           HA       GLU  77 -29.408   1.546   0.918
    3    HB2  GLU  77           HB2      GLU  77 -30.979  -0.132   0.377
    4    HB3  GLU  77           HB3      GLU  77 -31.563   1.384  -0.311
    5    HG2  GLU  77           HG2      GLU  77 -30.942   0.657  -2.506
    6    HG3  GLU  77           HG3      GLU  77 -30.265  -0.830  -1.847

  No H/Q in entry =           6
  In of MODEL   12
    1    H    VAL  78           H        VAL  78 -29.031  -0.537   1.561
    2    HA   VAL  78           HA       VAL  78 -26.350  -1.241   0.661
    3    HB   VAL  78           HB       VAL  78 -28.033  -2.182   3.022
    4   HG11  VAL  78          HG11      VAL  78 -25.669  -3.348   1.883
    5   HG13  VAL  78          HG12      VAL  78 -26.563  -3.851   3.319
    6   HG12  VAL  78          HG13      VAL  78 -25.269  -2.661   3.457
    7   HG22  VAL  78          HG21      VAL  78 -26.602  -0.797   4.369
    8   HG21  VAL  78          HG22      VAL  78 -27.363   0.165   3.102
    9   HG23  VAL  78          HG23      VAL  78 -25.675  -0.323   2.945

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ILE  79           H        ILE  79 -25.772  -3.129  -0.261
    2    HA   ILE  79           HA       ILE  79 -27.801  -4.643  -1.616
    3    HB   ILE  79           HB       ILE  79 -24.800  -5.104  -1.405
    4   HG12  ILE  79          HG12      ILE  79 -26.465  -4.019  -3.681
    5   HG13  ILE  79          HG13      ILE  79 -25.613  -2.999  -2.523
    6   HG22  ILE  79          HG21      ILE  79 -25.879  -6.290  -3.731
    7   HG21  ILE  79          HG22      ILE  79 -26.849  -6.844  -2.366
    8   HG23  ILE  79          HG23      ILE  79 -25.102  -7.083  -2.361
    9   HD13  ILE  79          HD11      ILE  79 -24.200  -3.065  -4.345
   10   HD12  ILE  79          HD12      ILE  79 -24.501  -4.778  -4.637
   11   HD11  ILE  79          HD13      ILE  79 -23.526  -4.279  -3.256

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ASP  80           H        ASP  80 -28.621  -6.591  -1.046
    2    HA   ASP  80           HA       ASP  80 -28.541  -7.509   1.593
    3    HB2  ASP  80           HB2      ASP  80 -30.286  -8.112  -0.047
    4    HB3  ASP  80           HB3      ASP  80 -29.107  -9.086  -0.926

  No H/Q in entry =           4
  In of MODEL   12
    1    H    SER  81           H        SER  81 -26.978  -8.617   2.711
    2    HA   SER  81           HA       SER  81 -24.469  -9.233   1.510
    3    HB2  SER  81           HB2      SER  81 -23.890 -10.265   3.671
    4    HB3  SER  81           HB3      SER  81 -24.626  -8.680   3.898
    5    HG   SER  81           HG       SER  81 -26.579  -9.734   4.348

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU  82           H        LEU  82 -27.131 -11.388   1.821
    2    HA   LEU  82           HA       LEU  82 -25.531 -13.717   1.280
    3    HB2  LEU  82           HB2      LEU  82 -28.481 -13.173   1.021
    4    HB3  LEU  82           HB3      LEU  82 -27.734 -14.756   0.821
    5    HG   LEU  82           HG       LEU  82 -27.743 -13.160   3.365
    6   HD13  LEU  82          HD11      LEU  82 -29.968 -13.871   3.051
    7   HD12  LEU  82          HD12      LEU  82 -29.251 -15.148   4.036
    8   HD11  LEU  82          HD13      LEU  82 -29.468 -15.388   2.301
    9   HD23  LEU  82          HD21      LEU  82 -27.049 -15.520   4.178
   10   HD22  LEU  82          HD22      LEU  82 -25.837 -14.521   3.374
   11   HD21  LEU  82          HD23      LEU  82 -26.644 -15.813   2.485

  No H/Q in entry =          11
  In of MODEL   12
    1    H    LEU  83           H        LEU  83 -27.543 -11.522  -0.619
    2    HA   LEU  83           HA       LEU  83 -27.316 -12.857  -3.100
    3    HB2  LEU  83           HB2      LEU  83 -27.792  -9.964  -2.430
    4    HB3  LEU  83           HB3      LEU  83 -27.812 -10.598  -4.075
    5    HG   LEU  83           HG       LEU  83 -29.832 -11.046  -1.897
    6   HD13  LEU  83          HD11      LEU  83 -30.632  -9.209  -2.946
    7   HD12  LEU  83          HD12      LEU  83 -31.071 -10.324  -4.239
    8   HD11  LEU  83          HD13      LEU  83 -29.558  -9.422  -4.328
    9   HD23  LEU  83          HD21      LEU  83 -29.948 -12.288  -4.632
   10   HD22  LEU  83          HD22      LEU  83 -30.907 -12.670  -3.202
   11   HD21  LEU  83          HD23      LEU  83 -29.207 -13.134  -3.274

  No H/Q in entry =          11
  In of MODEL   12
    1    H    TYR  84           H        TYR  84 -25.414 -10.440  -1.410
    2    HA   TYR  84           HA       TYR  84 -23.568  -9.895  -3.541
    3    HB2  TYR  84           HB2      TYR  84 -24.122  -8.447  -1.491
    4    HB3  TYR  84           HB3      TYR  84 -23.050  -9.521  -0.597
    5    HD1  TYR  84           HD1      TYR  84 -20.700  -9.257  -0.691
    6    HD2  TYR  84           HD2      TYR  84 -23.180  -7.113  -3.427
    7    HE1  TYR  84           HE1      TYR  84 -18.737  -7.950  -1.427
    8    HE2  TYR  84           HE2      TYR  84 -21.223  -5.806  -4.179
    9    HH   TYR  84           HH       TYR  84 -18.028  -6.682  -3.386

  No H/Q in entry =           9
  In of MODEL   12
    1    H    GLY  85           H        GLY  85 -23.276 -11.913  -0.610
    2    HA3  GLY  85           HA2      GLY  85 -20.679 -12.794  -1.105
    3    HA2  GLY  85           HA3      GLY  85 -21.888 -13.675  -0.171

  No H/Q in entry =           3
  In of MODEL   12
    1    H    LYS  86           H        LYS  86 -23.730 -14.075  -2.230
    2    HA   LYS  86           HA       LYS  86 -22.626 -16.416  -3.508
    3    HB2  LYS  86           HB2      LYS  86 -25.304 -15.028  -3.585
    4    HB3  LYS  86           HB3      LYS  86 -24.967 -16.565  -4.378
    5    HG2  LYS  86           HG2      LYS  86 -24.583 -17.598  -2.226
    6    HG3  LYS  86           HG3      LYS  86 -24.905 -16.058  -1.427
    7    HD2  LYS  86           HD2      LYS  86 -27.140 -15.998  -2.445
    8    HD3  LYS  86           HD3      LYS  86 -26.818 -17.536  -3.244
    9    HE2  LYS  86           HE2      LYS  86 -26.592 -18.627  -1.072
   10    HE3  LYS  86           HE3      LYS  86 -26.885 -17.089  -0.263
   11    HZ3  LYS  86           HZ1      LYS  86 -29.075 -17.156  -0.722
   12    HZ2  LYS  86           HZ2      LYS  86 -28.810 -18.830  -0.844
   13    HZ1  LYS  86           HZ3      LYS  86 -28.858 -17.874  -2.245

  No H/Q in entry =          13
  In of MODEL   12
    1    H    VAL  87           H        VAL  87 -22.690 -13.195  -4.379
    2    HA   VAL  87           HA       VAL  87 -22.422 -12.002  -6.312
    3    HB   VAL  87           HB       VAL  87 -21.306 -14.468  -7.673
    4   HG13  VAL  87          HG11      VAL  87 -20.075 -12.948  -8.934
    5   HG12  VAL  87          HG12      VAL  87 -20.096 -11.723  -7.664
    6   HG11  VAL  87          HG13      VAL  87 -21.540 -12.017  -8.631
    7   HG22  VAL  87          HG21      VAL  87 -20.233 -14.682  -5.599
    8   HG21  VAL  87          HG22      VAL  87 -20.044 -12.940  -5.420
    9   HG23  VAL  87          HG23      VAL  87 -19.087 -13.813  -6.617

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ASP  88           H        ASP  88 -24.921 -12.703  -5.960
    2    HA   ASP  88           HA       ASP  88 -26.021 -13.928  -8.363
    3    HB2  ASP  88           HB2      ASP  88 -27.005 -14.212  -6.038
    4    HB3  ASP  88           HB3      ASP  88 -27.496 -12.521  -6.125

  No H/Q in entry =           4
  In of MODEL   12
    1    H    GLY  89           H        GLY  89 -25.350 -12.643  -9.998
    2    HA3  GLY  89           HA2      GLY  89 -25.596  -9.874 -10.178
    3    HA2  GLY  89           HA3      GLY  89 -25.549 -10.984 -11.547

  No H/Q in entry =           3
  In of MODEL   12
    1    H    LEU  90           H        LEU  90 -27.963 -12.396 -11.102
    2    HA   LEU  90           HA       LEU  90 -29.821 -10.496 -12.197
    3    HB2  LEU  90           HB2      LEU  90 -29.832 -12.888 -12.794
    4    HB3  LEU  90           HB3      LEU  90 -30.324 -13.278 -11.146
    5    HG   LEU  90           HG       LEU  90 -32.470 -12.208 -11.496
    6   HD13  LEU  90          HD11      LEU  90 -32.335 -10.454 -12.959
    7   HD12  LEU  90          HD12      LEU  90 -32.849 -11.696 -14.104
    8   HD11  LEU  90          HD13      LEU  90 -31.144 -11.261 -13.981
    9   HD23  LEU  90          HD21      LEU  90 -32.369 -13.819 -13.943
   10   HD22  LEU  90          HD22      LEU  90 -33.340 -14.017 -12.484
   11   HD21  LEU  90          HD23      LEU  90 -31.673 -14.590 -12.518

  No H/Q in entry =          11
  In of MODEL   12
    1    H    GLY  91           H        GLY  91 -29.608 -12.014  -9.024
    2    HA3  GLY  91           HA2      GLY  91 -31.970 -10.964  -7.971
    3    HA2  GLY  91           HA3      GLY  91 -30.563 -11.471  -7.036

  No H/Q in entry =           3
  In of MODEL   12
    1    H    VAL  92           H        VAL  92 -28.690  -9.593  -7.885
    2    HA   VAL  92           HA       VAL  92 -29.532  -7.322  -6.318
    3    HB   VAL  92           HB       VAL  92 -26.980  -7.721  -7.924
    4   HG12  VAL  92          HG11      VAL  92 -27.182  -5.856  -5.584
    5   HG11  VAL  92          HG12      VAL  92 -27.864  -5.318  -7.120
    6   HG13  VAL  92          HG13      VAL  92 -26.158  -5.747  -7.016
    7   HG22  VAL  92          HG21      VAL  92 -26.715  -9.314  -6.342
    8   HG21  VAL  92          HG22      VAL  92 -27.874  -8.568  -5.241
    9   HG23  VAL  92          HG23      VAL  92 -26.236  -7.927  -5.363

  No H/Q in entry =           9
  In of MODEL   12
    1    H    LEU  93           H        LEU  93 -29.120  -7.951  -9.744
    2    HA   LEU  93           HA       LEU  93 -29.530  -5.319 -10.655
    3    HB2  LEU  93           HB2      LEU  93 -28.849  -7.148 -12.130
    4    HB3  LEU  93           HB3      LEU  93 -30.422  -7.914 -11.907
    5    HG   LEU  93           HG       LEU  93 -31.482  -5.967 -13.016
    6   HD11  LEU  93          HD11      LEU  93 -29.669  -4.333 -12.506
    7   HD13  LEU  93          HD12      LEU  93 -30.113  -4.362 -14.214
    8   HD12  LEU  93          HD13      LEU  93 -28.639  -5.165 -13.673
    9   HD23  LEU  93          HD21      LEU  93 -30.438  -6.495 -15.310
   10   HD22  LEU  93          HD22      LEU  93 -31.247  -7.777 -14.410
   11   HD21  LEU  93          HD23      LEU  93 -29.484  -7.680 -14.417

  No H/Q in entry =          11
  In of MODEL   12
    1    H    LYS  94           H        LYS  94 -31.841  -7.926  -9.816
    2    HA   LYS  94           HA       LYS  94 -34.221  -6.536 -10.424
    3    HB2  LYS  94           HB2      LYS  94 -33.649  -8.721  -8.428
    4    HB3  LYS  94           HB3      LYS  94 -35.264  -8.062  -8.686
    5    HG2  LYS  94           HG2      LYS  94 -35.166  -8.819 -11.026
    6    HG3  LYS  94           HG3      LYS  94 -33.587  -9.535 -10.707
    7    HD2  LYS  94           HD2      LYS  94 -34.670 -10.908  -8.889
    8    HD3  LYS  94           HD3      LYS  94 -36.230 -10.294  -9.435
    9    HE2  LYS  94           HE2      LYS  94 -35.700 -11.195 -11.709
   10    HE3  LYS  94           HE3      LYS  94 -34.264 -11.949 -11.015
   11    HZ3  LYS  94           HZ1      LYS  94 -36.077 -13.513 -11.190
   12    HZ2  LYS  94           HZ2      LYS  94 -37.072 -12.517 -10.238
   13    HZ1  LYS  94           HZ3      LYS  94 -35.693 -13.237  -9.559

  No H/Q in entry =          13
  In of MODEL   12
    1    H    ALA  95           H        ALA  95 -32.385  -6.634  -7.381
    2    HA   ALA  95           HA       ALA  95 -34.267  -5.109  -5.885
    3    HB2  ALA  95           HB1      ALA  95 -31.858  -6.430  -5.365
    4    HB3  ALA  95           HB2      ALA  95 -32.854  -5.556  -4.202
    5    HB1  ALA  95           HB3      ALA  95 -31.528  -4.732  -5.022

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA  96           H        ALA  96 -31.653  -4.178  -7.984
    2    HA   ALA  96           HA       ALA  96 -31.619  -1.420  -7.191
    3    HB2  ALA  96           HB1      ALA  96 -30.269  -1.148  -9.304
    4    HB3  ALA  96           HB2      ALA  96 -30.534  -2.859  -9.634
    5    HB1  ALA  96           HB3      ALA  96 -29.626  -2.368  -8.205

  No H/Q in entry =           5
  In of MODEL   12
    1    H    VAL  97           H        VAL  97 -33.118  -3.152  -9.885
    2    HA   VAL  97           HA       VAL  97 -34.245  -0.868 -11.121
    3    HB   VAL  97           HB       VAL  97 -34.988  -3.811 -11.182
    4   HG11  VAL  97          HG11      VAL  97 -36.827  -1.843 -11.648
    5   HG13  VAL  97          HG12      VAL  97 -36.852  -3.431 -12.415
    6   HG12  VAL  97          HG13      VAL  97 -36.132  -2.059 -13.256
    7   HG21  VAL  97          HG21      VAL  97 -33.758  -1.941 -13.208
    8   HG23  VAL  97          HG22      VAL  97 -34.173  -3.628 -13.508
    9   HG22  VAL  97          HG23      VAL  97 -32.930  -3.221 -12.324

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ALA  98           H        ALA  98 -35.370  -3.091  -8.597
    2    HA   ALA  98           HA       ALA  98 -37.955  -2.002  -8.230
    3    HB1  ALA  98           HB1      ALA  98 -36.889  -4.185  -7.216
    4    HB3  ALA  98           HB2      ALA  98 -38.087  -3.295  -6.274
    5    HB2  ALA  98           HB3      ALA  98 -36.370  -3.110  -5.919

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA  99           H        ALA  99 -34.889  -1.147  -6.587
    2    HA   ALA  99           HA       ALA  99 -36.056   0.799  -4.907
    3    HB1  ALA  99           HB1      ALA  99 -33.391  -0.027  -5.668
    4    HB2  ALA  99           HB2      ALA  99 -33.952   0.699  -4.163
    5    HB3  ALA  99           HB3      ALA  99 -33.503   1.726  -5.523

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ILE 100           H        ILE 100 -35.029   0.977  -8.264
    2    HA   ILE 100           HA       ILE 100 -35.269   3.822  -8.461
    3    HB   ILE 100           HB       ILE 100 -35.327   1.682 -10.617
    4   HG12  ILE 100          HG12      ILE 100 -33.202   3.714  -9.937
    5   HG13  ILE 100          HG13      ILE 100 -33.203   2.063  -9.319
    6   HG21  ILE 100          HG21      ILE 100 -35.811   4.593 -10.723
    7   HG23  ILE 100          HG22      ILE 100 -36.294   3.323 -11.848
    8   HG22  ILE 100          HG23      ILE 100 -34.655   3.973 -11.903
    9   HD12  ILE 100          HD11      ILE 100 -32.699   3.052 -12.088
   10   HD11  ILE 100          HD12      ILE 100 -33.325   1.421 -11.844
   11   HD13  ILE 100          HD13      ILE 100 -31.786   1.891 -11.125

  No H/Q in entry =          11
  In of MODEL   12
    1    H    LYS 101           H        LYS 101 -37.511   1.171  -9.201
    2    HA   LYS 101           HA       LYS 101 -39.629   2.784 -10.181
    3    HB2  LYS 101           HB2      LYS 101 -39.451   0.004  -9.075
    4    HB3  LYS 101           HB3      LYS 101 -41.020   0.736  -9.410
    5    HG2  LYS 101           HG2      LYS 101 -40.556   0.899 -11.707
    6    HG3  LYS 101           HG3      LYS 101 -38.851   0.526 -11.461
    7    HD2  LYS 101           HD2      LYS 101 -40.064  -1.400 -12.358
    8    HD3  LYS 101           HD3      LYS 101 -39.425  -1.730 -10.748
    9    HE2  LYS 101           HE2      LYS 101 -41.471  -2.471 -10.240
   10    HE3  LYS 101           HE3      LYS 101 -41.964  -0.777 -10.229
   11    HZ3  LYS 101           HZ1      LYS 101 -42.859  -0.936 -12.345
   12    HZ2  LYS 101           HZ2      LYS 101 -43.286  -2.425 -11.647
   13    HZ1  LYS 101           HZ3      LYS 101 -41.985  -2.341 -12.734

  No H/Q in entry =          13
  In of MODEL   12
    1    H    LYS 102           H        LYS 102 -39.096   1.291  -6.985
    2    HA   LYS 102           HA       LYS 102 -41.364   2.430  -5.771
    3    HB2  LYS 102           HB2      LYS 102 -40.086   0.582  -4.774
    4    HB3  LYS 102           HB3      LYS 102 -38.716   1.665  -4.527
    5    HG2  LYS 102           HG2      LYS 102 -40.056   3.019  -3.015
    6    HG3  LYS 102           HG3      LYS 102 -41.429   1.940  -3.265
    7    HD2  LYS 102           HD2      LYS 102 -40.162   0.092  -2.258
    8    HD3  LYS 102           HD3      LYS 102 -38.789   1.172  -2.006
    9    HE2  LYS 102           HE2      LYS 102 -40.170   2.609  -0.581
   10    HE3  LYS 102           HE3      LYS 102 -41.560   1.561  -0.853
   11    HZ1  LYS 102           HZ1      LYS 102 -39.801  -0.165   0.130
   12    HZ3  LYS 102           HZ2      LYS 102 -40.926   0.689   1.071
   13    HZ2  LYS 102           HZ3      LYS 102 -39.327   1.248   0.944

  No H/Q in entry =          13
  In of MODEL   12
    1    H    ALA 103           H        ALA 103 -38.442   3.892  -6.781
    2    HA   ALA 103           HA       ALA 103 -38.707   6.186  -4.979
    3    HB2  ALA 103           HB1      ALA 103 -36.737   6.974  -6.554
    4    HB3  ALA 103           HB2      ALA 103 -36.666   5.261  -6.967
    5    HB1  ALA 103           HB3      ALA 103 -36.445   5.775  -5.295

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA 104           H        ALA 104 -39.324   5.470  -8.330
    2    HA   ALA 104           HA       ALA 104 -39.968   8.247  -8.927
    3    HB2  ALA 104           HB1      ALA 104 -40.004   7.597 -11.134
    4    HB1  ALA 104           HB2      ALA 104 -40.697   6.017 -10.767
    5    HB3  ALA 104           HB3      ALA 104 -38.980   6.313 -10.491

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA 105           H        ALA 105 -41.527   6.094  -7.136
    2    HA   ALA 105           HA       ALA 105 -43.979   7.437  -7.090
    3    HB2  ALA 105           HB1      ALA 105 -44.713   6.578  -9.134
    4    HB3  ALA 105           HB2      ALA 105 -45.321   5.368  -8.005
    5    HB1  ALA 105           HB3      ALA 105 -43.847   5.057  -8.922

  No H/Q in entry =           5
  In of MODEL   13
    1    H1   ALA   1           H3       ALA   1 -12.385 -15.464  -2.395
    2    H2   ALA   1           H2       ALA   1 -11.455 -16.618  -3.233
    3    H3   ALA   1           H1       ALA   1 -12.586 -15.661  -4.070
    4    HA   ALA   1           HA       ALA   1 -14.005 -17.345  -3.831
    5    HB3  ALA   1           HB1      ALA   1 -12.630 -19.133  -3.364
    6    HB1  ALA   1           HB2      ALA   1 -13.388 -19.009  -1.777
    7    HB2  ALA   1           HB3      ALA   1 -11.804 -18.287  -2.055

  No H/Q in entry =           7
  In of MODEL   13
    1    H    GLU   2           H        GLU   2 -15.641 -18.179  -2.179
    2    HA   GLU   2           HA       GLU   2 -17.271 -16.439  -1.126
    3    HB2  GLU   2           HB2      GLU   2 -16.363 -18.873   0.424
    4    HB3  GLU   2           HB3      GLU   2 -17.878 -18.005   0.674
    5    HG2  GLU   2           HG2      GLU   2 -18.866 -19.082  -1.061
    6    HG3  GLU   2           HG3      GLU   2 -17.537 -18.698  -2.144

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLU   3           H        GLU   3 -15.380 -17.811   1.503
    2    HA   GLU   3           HA       GLU   3 -15.577 -15.453   3.057
    3    HB2  GLU   3           HB2      GLU   3 -14.022 -18.018   3.314
    4    HB3  GLU   3           HB3      GLU   3 -13.778 -16.700   4.460
    5    HG2  GLU   3           HG2      GLU   3 -15.974 -16.825   5.274
    6    HG3  GLU   3           HG3      GLU   3 -16.576 -17.619   3.825

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LEU   4           H        LEU   4 -12.637 -16.968   1.674
    2    HA   LEU   4           HA       LEU   4 -10.782 -15.085   2.274
    3    HB2  LEU   4           HB2      LEU   4 -11.022 -16.383  -0.450
    4    HB3  LEU   4           HB3      LEU   4  -9.563 -15.679   0.237
    5    HG   LEU   4           HG       LEU   4 -11.087 -18.057   1.350
    6   HD13  LEU   4          HD11      LEU   4  -9.469 -19.433   0.425
    7   HD12  LEU   4          HD12      LEU   4  -8.244 -18.164   0.400
    8   HD11  LEU   4          HD13      LEU   4  -9.530 -18.173  -0.806
    9   HD23  LEU   4          HD21      LEU   4  -8.840 -18.145   2.736
   10   HD22  LEU   4          HD22      LEU   4 -10.150 -17.090   3.261
   11   HD21  LEU   4          HD23      LEU   4  -8.778 -16.418   2.381

  No H/Q in entry =          11
  In of MODEL   13
    1    H    GLU   5           H        GLU   5 -13.109 -14.854  -0.405
    2    HA   GLU   5           HA       GLU   5 -12.074 -12.384  -1.407
    3    HB2  GLU   5           HB2      GLU   5 -13.436 -13.956  -2.769
    4    HB3  GLU   5           HB3      GLU   5 -14.834 -13.574  -1.764
    5    HG2  GLU   5           HG2      GLU   5 -14.678 -11.210  -2.411
    6    HG3  GLU   5           HG3      GLU   5 -13.252 -11.561  -3.386

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLU   6           H        GLU   6 -14.814 -13.227   0.680
    2    HA   GLU   6           HA       GLU   6 -15.688 -10.540   1.075
    3    HB2  GLU   6           HB2      GLU   6 -16.140 -13.079   2.657
    4    HB3  GLU   6           HB3      GLU   6 -16.912 -11.540   3.040
    5    HG2  GLU   6           HG2      GLU   6 -17.955 -11.470   0.836
    6    HG3  GLU   6           HG3      GLU   6 -17.115 -12.946   0.362

  No H/Q in entry =           6
  In of MODEL   13
    1    H    VAL   7           H        VAL   7 -13.409 -12.676   2.654
    2    HA   VAL   7           HA       VAL   7 -12.929 -11.103   4.980
    3    HB   VAL   7           HB       VAL   7 -11.247 -13.169   3.537
    4   HG11  VAL   7          HG11      VAL   7 -10.766 -11.638   6.100
    5   HG13  VAL   7          HG12      VAL   7  -9.666 -11.867   4.743
    6   HG12  VAL   7          HG13      VAL   7 -10.037 -13.219   5.813
    7   HG21  VAL   7          HG21      VAL   7 -13.507 -13.705   4.752
    8   HG23  VAL   7          HG22      VAL   7 -12.580 -13.440   6.230
    9   HG22  VAL   7          HG23      VAL   7 -12.099 -14.707   5.103

  No H/Q in entry =           9
  In of MODEL   13
    1    H    VAL   8           H        VAL   8 -11.412 -11.240   1.774
    2    HA   VAL   8           HA       VAL   8  -9.328  -9.391   2.269
    3    HB   VAL   8           HB       VAL   8 -10.794 -10.060  -0.295
    4   HG13  VAL   8          HG11      VAL   8  -9.819  -7.975  -0.758
    5   HG12  VAL   8          HG12      VAL   8  -8.556  -9.103  -1.255
    6   HG11  VAL   8          HG13      VAL   8  -8.439  -8.278   0.299
    7   HG21  VAL   8          HG21      VAL   8  -9.129 -11.665   1.211
    8   HG23  VAL   8          HG22      VAL   8  -7.973 -10.874   0.143
    9   HG22  VAL   8          HG23      VAL   8  -9.303 -11.803  -0.540

  No H/Q in entry =           9
  In of MODEL   13
    1    H    MET   9           H        MET   9 -12.666  -8.963   1.101
    2    HA   MET   9           HA       MET   9 -12.569  -6.188   0.663
    3    HB2  MET   9           HB2      MET   9 -14.797  -8.053   1.464
    4    HB3  MET   9           HB3      MET   9 -15.072  -6.318   1.298
    5    HG2  MET   9           HG2      MET   9 -14.188  -6.420  -1.019
    6    HG3  MET   9           HG3      MET   9 -13.986  -8.163  -0.849
    7    HE3  MET   9           HE1      MET   9 -17.844  -5.718  -0.911
    8    HE2  MET   9           HE2      MET   9 -16.523  -5.411  -2.036
    9    HE1  MET   9           HE3      MET   9 -16.249  -5.255  -0.302

  No H/Q in entry =           9
  In of MODEL   13
    1    H    GLY  10           H        GLY  10 -13.261  -8.068   3.591
    2    HA3  GLY  10           HA2      GLY  10 -13.788  -5.875   5.306
    3    HA2  GLY  10           HA3      GLY  10 -13.243  -7.469   5.823

  No H/Q in entry =           3
  In of MODEL   13
    1    H    LEU  11           H        LEU  11 -10.796  -7.623   4.514
    2    HA   LEU  11           HA       LEU  11  -9.084  -6.207   6.273
    3    HB2  LEU  11           HB2      LEU  11  -8.547  -7.640   3.669
    4    HB3  LEU  11           HB3      LEU  11  -7.271  -6.949   4.670
    5    HG   LEU  11           HG       LEU  11  -9.299  -8.958   5.684
    6   HD13  LEU  11          HD11      LEU  11  -8.087 -10.210   4.124
    7   HD12  LEU  11          HD12      LEU  11  -7.158 -10.457   5.602
    8   HD11  LEU  11          HD13      LEU  11  -6.602  -9.300   4.394
    9   HD22  LEU  11          HD21      LEU  11  -8.439  -7.952   7.602
   10   HD21  LEU  11          HD22      LEU  11  -6.895  -7.569   6.842
   11   HD23  LEU  11          HD23      LEU  11  -7.240  -9.220   7.353

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  12           H        ILE  12  -9.971  -5.654   2.881
    2    HA   ILE  12           HA       ILE  12  -8.254  -3.443   2.456
    3    HB   ILE  12           HB       ILE  12 -10.911  -4.087   1.155
    4   HG12  ILE  12          HG12      ILE  12  -8.890  -5.759   1.086
    5   HG13  ILE  12          HG13      ILE  12  -9.746  -5.396  -0.399
    6   HG21  ILE  12          HG21      ILE  12  -8.662  -2.229   0.317
    7   HG23  ILE  12          HG22      ILE  12 -10.313  -1.766   0.710
    8   HG22  ILE  12          HG23      ILE  12  -9.976  -2.715  -0.709
    9   HD11  ILE  12          HD11      ILE  12  -7.222  -3.984   0.505
   10   HD13  ILE  12          HD12      ILE  12  -8.009  -3.859  -1.067
   11   HD12  ILE  12          HD13      ILE  12  -7.236  -5.353  -0.591

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  13           H        ILE  13 -11.620  -3.673   3.541
    2    HA   ILE  13           HA       ILE  13 -12.051  -0.880   3.806
    3    HB   ILE  13           HB       ILE  13 -13.285  -3.290   5.161
    4   HG12  ILE  13          HG12      ILE  13 -13.501  -2.723   2.625
    5   HG13  ILE  13          HG13      ILE  13 -14.930  -3.182   3.528
    6   HG22  ILE  13          HG21      ILE  13 -15.152  -1.666   5.772
    7   HG21  ILE  13          HG22      ILE  13 -14.035  -0.358   5.408
    8   HG23  ILE  13          HG23      ILE  13 -13.668  -1.493   6.706
    9   HD12  ILE  13          HD11      ILE  13 -15.257  -1.152   2.061
   10   HD11  ILE  13          HD12      ILE  13 -14.093  -0.329   3.079
   11   HD13  ILE  13          HD13      ILE  13 -15.603  -0.877   3.771

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ASN  14           H        ASN  14 -10.971  -3.379   6.087
    2    HA   ASN  14           HA       ASN  14 -10.759  -1.740   8.371
    3    HB2  ASN  14           HB2      ASN  14 -10.533  -4.351   8.053
    4    HB3  ASN  14           HB3      ASN  14  -8.819  -3.981   7.899
    5   HD21  ASN  14          HD21      ASN  14  -9.477  -5.496  10.076
    6   HD22  ASN  14          HD22      ASN  14  -9.443  -4.574  11.499

  No H/Q in entry =           6
  In of MODEL   13
    1    H    SER  15           H        SER  15  -8.360  -2.592   5.886
    2    HA   SER  15           HA       SER  15  -6.204  -1.119   6.962
    3    HB2  SER  15           HB2      SER  15  -5.180  -1.347   4.807
    4    HB3  SER  15           HB3      SER  15  -6.151  -2.798   5.031
    5    HG   SER  15           HG       SER  15  -6.405  -0.784   3.215

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLY  16           H        GLY  16  -8.791  -0.230   4.707
    2    HA3  GLY  16           HA2      GLY  16  -7.906   2.402   4.154
    3    HA2  GLY  16           HA3      GLY  16  -9.562   1.822   3.988

  No H/Q in entry =           3
  In of MODEL   13
    1    H    GLN  17           H        GLN  17 -10.119   1.106   6.638
    2    HA   GLN  17           HA       GLN  17 -10.805   3.619   7.773
    3    HB2  GLN  17           HB2      GLN  17 -10.734   0.839   8.959
    4    HB3  GLN  17           HB3      GLN  17 -11.351   2.246   9.824
    5    HG2  GLN  17           HG2      GLN  17 -13.029   2.623   8.093
    6    HG3  GLN  17           HG3      GLN  17 -12.371   1.302   7.130
    7   HE21  GLN  17          HE21      GLN  17 -15.099   1.669   8.520
    8   HE22  GLN  17          HE22      GLN  17 -15.281   0.251   9.435

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ALA  18           H        ALA  18  -8.199   1.315   8.402
    2    HA   ALA  18           HA       ALA  18  -7.096   2.524  10.674
    3    HB2  ALA  18           HB1      ALA  18  -6.503   0.301   9.312
    4    HB3  ALA  18           HB2      ALA  18  -5.336   1.075  10.384
    5    HB1  ALA  18           HB3      ALA  18  -5.252   1.350   8.643

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ARG  19           H        ARG  19  -6.311   3.036   7.227
    2    HA   ARG  19           HA       ARG  19  -4.396   5.067   7.658
    3    HB2  ARG  19           HB2      ARG  19  -4.728   3.926   5.463
    4    HB3  ARG  19           HB3      ARG  19  -6.263   4.779   5.281
    5    HG2  ARG  19           HG2      ARG  19  -5.115   6.941   5.349
    6    HG3  ARG  19           HG3      ARG  19  -3.574   6.143   5.658
    7    HD2  ARG  19           HD2      ARG  19  -3.688   6.731   3.314
    8    HD3  ARG  19           HD3      ARG  19  -3.788   4.972   3.462
    9    HE   ARG  19           HE       ARG  19  -6.414   5.903   3.446
   10   HH21  ARG  19          HH11      ARG  19  -7.602   6.067   1.524
   11   HH22  ARG  19          HH12      ARG  19  -6.776   6.135   0.007
   12   HH11  ARG  19          HH21      ARG  19  -3.633   5.940   1.419
   13   HH12  ARG  19          HH22      ARG  19  -4.527   6.061  -0.053

  No H/Q in entry =          13
  In of MODEL   13
    1    H    SER  20           H        SER  20  -7.892   5.210   7.048
    2    HA   SER  20           HA       SER  20  -8.226   7.969   6.994
    3    HB2  SER  20           HB2      SER  20 -10.111   6.640   6.455
    4    HB3  SER  20           HB3      SER  20 -10.017   5.752   7.974
    5    HG   SER  20           HG       SER  20 -10.898   8.373   7.461

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU  21           H        LEU  21  -8.252   5.791   9.802
    2    HA   LEU  21           HA       LEU  21  -8.682   7.793  11.762
    3    HB2  LEU  21           HB2      LEU  21  -7.348   5.084  11.933
    4    HB3  LEU  21           HB3      LEU  21  -7.661   6.105  13.333
    5    HG   LEU  21           HG       LEU  21  -9.821   5.212  11.400
    6   HD11  LEU  21          HD11      LEU  21  -8.961   4.022  14.052
    7   HD13  LEU  21          HD12      LEU  21  -8.883   3.240  12.474
    8   HD12  LEU  21          HD13      LEU  21 -10.449   3.598  13.203
    9   HD21  LEU  21          HD21      LEU  21  -9.761   6.736  13.996
   10   HD23  LEU  21          HD22      LEU  21 -11.168   5.741  13.638
   11   HD22  LEU  21          HD23      LEU  21 -10.725   7.053  12.556

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ALA  22           H        ALA  22  -5.736   6.395  10.365
    2    HA   ALA  22           HA       ALA  22  -3.851   7.696  11.991
    3    HB2  ALA  22           HB1      ALA  22  -3.444   5.836  10.304
    4    HB1  ALA  22           HB2      ALA  22  -2.239   7.123  10.340
    5    HB3  ALA  22           HB3      ALA  22  -3.453   7.087   9.061

  No H/Q in entry =           5
  In of MODEL   13
    1    H    TYR  23           H        TYR  23  -5.151   8.718   8.802
    2    HA   TYR  23           HA       TYR  23  -3.796  11.204   8.732
    3    HB2  TYR  23           HB2      TYR  23  -4.878  10.296   6.739
    4    HB3  TYR  23           HB3      TYR  23  -6.458  10.417   7.515
    5    HD1  TYR  23           HD1      TYR  23  -3.540  12.428   6.350
    6    HD2  TYR  23           HD2      TYR  23  -7.676  12.444   7.507
    7    HE1  TYR  23           HE1      TYR  23  -3.743  14.779   5.585
    8    HE2  TYR  23           HE2      TYR  23  -7.881  14.795   6.741
    9    HH   TYR  23           HH       TYR  23  -6.422  16.735   6.356

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ALA  24           H        ALA  24  -6.927  10.252  10.104
    2    HA   ALA  24           HA       ALA  24  -7.746  12.849  10.868
    3    HB1  ALA  24           HB1      ALA  24  -9.575  11.613  11.332
    4    HB2  ALA  24           HB2      ALA  24  -8.758  11.038  12.783
    5    HB3  ALA  24           HB3      ALA  24  -8.635  10.122  11.282

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA  25           H        ALA  25  -5.767  10.379  12.452
    2    HA   ALA  25           HA       ALA  25  -5.427  11.633  14.953
    3    HB2  ALA  25           HB1      ALA  25  -4.676   9.274  14.139
    4    HB3  ALA  25           HB2      ALA  25  -3.658  10.126  15.301
    5    HB1  ALA  25           HB3      ALA  25  -3.217  10.103  13.593

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU  26           H        LEU  26  -3.625  11.913  11.918
    2    HA   LEU  26           HA       LEU  26  -1.656  13.720  12.837
    3    HB2  LEU  26           HB2      LEU  26  -1.356  12.562  10.736
    4    HB3  LEU  26           HB3      LEU  26  -2.822  13.280  10.075
    5    HG   LEU  26           HG       LEU  26  -1.791  15.523  10.210
    6   HD12  LEU  26          HD11      LEU  26   0.746  15.524  10.632
    7   HD11  LEU  26          HD12      LEU  26   0.509  13.946  11.378
    8   HD13  LEU  26          HD13      LEU  26  -0.290  15.368  12.050
    9   HD21  LEU  26          HD21      LEU  26  -0.060  13.453   8.824
   10   HD23  LEU  26          HD22      LEU  26  -0.088  15.174   8.451
   11   HD22  LEU  26          HD23      LEU  26  -1.518  14.187   8.160

  No H/Q in entry =          11
  In of MODEL   13
    1    H    LYS  27           H        LYS  27  -4.829  14.225  11.349
    2    HA   LYS  27           HA       LYS  27  -4.752  17.012  11.147
    3    HB2  LYS  27           HB2      LYS  27  -6.504  15.547  10.158
    4    HB3  LYS  27           HB3      LYS  27  -7.168  15.299  11.773
    5    HG2  LYS  27           HG2      LYS  27  -7.579  17.709  12.003
    6    HG3  LYS  27           HG3      LYS  27  -6.864  17.997  10.414
    7    HD2  LYS  27           HD2      LYS  27  -8.604  16.575   9.375
    8    HD3  LYS  27           HD3      LYS  27  -9.325  16.304  10.963
    9    HE2  LYS  27           HE2      LYS  27  -9.749  18.719  11.201
   10    HE3  LYS  27           HE3      LYS  27  -9.000  19.012   9.628
   11    HZ3  LYS  27           HZ1      LYS  27 -11.378  18.905   9.379
   12    HZ2  LYS  27           HZ2      LYS  27 -11.440  17.391  10.151
   13    HZ1  LYS  27           HZ3      LYS  27 -10.690  17.546   8.632

  No H/Q in entry =          13
  In of MODEL   13
    1    H    GLN  28           H        GLN  28  -5.665  14.938  13.874
    2    HA   GLN  28           HA       GLN  28  -6.550  16.952  15.645
    3    HB2  GLN  28           HB2      GLN  28  -5.172  14.310  16.194
    4    HB3  GLN  28           HB3      GLN  28  -5.906  15.323  17.439
    5    HG2  GLN  28           HG2      GLN  28  -7.373  14.213  15.031
    6    HG3  GLN  28           HG3      GLN  28  -7.441  13.525  16.652
    7   HE21  GLN  28          HE21      GLN  28  -9.279  15.361  14.673
    8   HE22  GLN  28          HE22      GLN  28 -10.025  16.381  15.806

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ALA  29           H        ALA  29  -3.340  15.627  14.967
    2    HA   ALA  29           HA       ALA  29  -1.895  17.015  16.947
    3    HB1  ALA  29           HB1      ALA  29   0.033  16.304  15.835
    4    HB3  ALA  29           HB2      ALA  29  -0.716  16.433  14.243
    5    HB2  ALA  29           HB3      ALA  29  -1.153  15.106  15.319

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LYS  30           H        LYS  30  -2.735  17.897  13.614
    2    HA   LYS  30           HA       LYS  30  -1.300  20.322  13.513
    3    HB2  LYS  30           HB2      LYS  30  -3.835  19.473  12.099
    4    HB3  LYS  30           HB3      LYS  30  -2.985  20.978  11.755
    5    HG2  LYS  30           HG2      LYS  30  -0.927  19.662  11.249
    6    HG3  LYS  30           HG3      LYS  30  -1.850  18.176  11.494
    7    HD2  LYS  30           HD2      LYS  30  -3.402  18.831   9.694
    8    HD3  LYS  30           HD3      LYS  30  -2.502  20.329   9.451
    9    HE2  LYS  30           HE2      LYS  30  -0.483  19.013   8.879
   10    HE3  LYS  30           HE3      LYS  30  -1.402  17.520   9.091
   11    HZ2  LYS  30           HZ1      LYS  30  -1.209  18.386   6.748
   12    HZ1  LYS  30           HZ2      LYS  30  -2.240  19.661   7.212
   13    HZ3  LYS  30           HZ3      LYS  30  -2.783  18.050   7.284

  No H/Q in entry =          13
  In of MODEL   13
    1    H    GLN  31           H        GLN  31  -4.413  19.507  14.919
    2    HA   GLN  31           HA       GLN  31  -5.146  22.273  15.365
    3    HB2  GLN  31           HB2      GLN  31  -6.357  19.843  16.688
    4    HB3  GLN  31           HB3      GLN  31  -7.098  21.423  16.438
    5    HG2  GLN  31           HG2      GLN  31  -6.390  20.634  13.851
    6    HG3  GLN  31           HG3      GLN  31  -6.934  19.137  14.599
    7   HE21  GLN  31          HE21      GLN  31  -8.320  20.725  12.491
    8   HE22  GLN  31          HE22      GLN  31  -9.831  21.135  13.144

  No H/Q in entry =           8
  In of MODEL   13
    1    H    GLY  32           H        GLY  32  -2.860  20.320  16.693
    2    HA3  GLY  32           HA2      GLY  32  -1.459  20.768  18.499
    3    HA2  GLY  32           HA3      GLY  32  -2.574  22.025  19.018

  No H/Q in entry =           3
  In of MODEL   13
    1    H    ASP  33           H        ASP  33  -4.032  19.002  18.356
    2    HA   ASP  33           HA       ASP  33  -4.455  18.553  21.235
    3    HB2  ASP  33           HB2      ASP  33  -5.868  17.556  18.755
    4    HB3  ASP  33           HB3      ASP  33  -6.225  16.952  20.371

  No H/Q in entry =           4
  In of MODEL   13
    1    H    PHE  34           H        PHE  34  -2.298  17.676  21.547
    2    HA   PHE  34           HA       PHE  34  -1.323  15.413  20.151
    3    HB2  PHE  34           HB2      PHE  34  -0.700  16.393  22.946
    4    HB3  PHE  34           HB3      PHE  34   0.215  15.157  22.083
    5    HD1  PHE  34           HD1      PHE  34   0.084  18.586  22.814
    6    HD2  PHE  34           HD2      PHE  34   0.888  15.869  19.584
    7    HE1  PHE  34           HE1      PHE  34   1.404  20.340  21.661
    8    HE2  PHE  34           HE2      PHE  34   2.204  17.626  18.436
    9    HZ   PHE  34           HZ       PHE  34   2.463  19.858  19.479

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ALA  35           H        ALA  35  -3.366  15.719  23.009
    2    HA   ALA  35           HA       ALA  35  -3.189  13.055  23.909
    3    HB3  ALA  35           HB1      ALA  35  -5.641  13.713  24.760
    4    HB1  ALA  35           HB2      ALA  35  -5.086  15.324  24.303
    5    HB2  ALA  35           HB3      ALA  35  -4.187  14.390  25.498

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA  36           H        ALA  36  -5.615  14.600  21.801
    2    HA   ALA  36           HA       ALA  36  -7.059  12.206  21.323
    3    HB1  ALA  36           HB1      ALA  36  -8.494  13.646  20.362
    4    HB3  ALA  36           HB2      ALA  36  -7.314  14.050  19.115
    5    HB2  ALA  36           HB3      ALA  36  -7.331  14.939  20.638

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA  37           H        ALA  37  -4.355  13.758  19.659
    2    HA   ALA  37           HA       ALA  37  -4.335  12.120  17.364
    3    HB3  ALA  37           HB1      ALA  37  -2.325  13.808  18.790
    4    HB2  ALA  37           HB2      ALA  37  -2.850  13.869  17.108
    5    HB1  ALA  37           HB3      ALA  37  -1.713  12.625  17.633

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LYS  38           H        LYS  38  -2.589  11.795  20.446
    2    HA   LYS  38           HA       LYS  38  -1.293   9.378  19.963
    3    HB2  LYS  38           HB2      LYS  38  -1.599  11.147  22.106
    4    HB3  LYS  38           HB3      LYS  38  -2.239   9.626  22.722
    5    HG2  LYS  38           HG2      LYS  38  -0.157   8.479  22.192
    6    HG3  LYS  38           HG3      LYS  38   0.472   9.915  21.378
    7    HD2  LYS  38           HD2      LYS  38   0.651  11.134  23.413
    8    HD3  LYS  38           HD3      LYS  38  -0.385   9.997  24.278
    9    HE2  LYS  38           HE2      LYS  38   1.965   9.652  24.903
   10    HE3  LYS  38           HE3      LYS  38   1.345   8.243  24.039
   11    HZ3  LYS  38           HZ1      LYS  38   2.655   8.644  22.261
   12    HZ2  LYS  38           HZ2      LYS  38   3.618   9.461  23.399
   13    HZ1  LYS  38           HZ3      LYS  38   2.552  10.333  22.404

  No H/Q in entry =          13
  In of MODEL   13
    1    H    ALA  39           H        ALA  39  -4.528   9.915  21.357
    2    HA   ALA  39           HA       ALA  39  -5.124   7.203  21.863
    3    HB3  ALA  39           HB1      ALA  39  -7.256   9.174  21.088
    4    HB2  ALA  39           HB2      ALA  39  -6.359   9.391  22.592
    5    HB1  ALA  39           HB3      ALA  39  -7.293   7.918  22.327

  No H/Q in entry =           5
  In of MODEL   13
    1    H    MET  40           H        MET  40  -5.677   9.221  19.013
    2    HA   MET  40           HA       MET  40  -7.173   7.305  17.551
    3    HB2  MET  40           HB2      MET  40  -5.531   9.680  16.648
    4    HB3  MET  40           HB3      MET  40  -6.566   8.732  15.576
    5    HG2  MET  40           HG2      MET  40  -7.592   9.996  18.130
    6    HG3  MET  40           HG3      MET  40  -7.635  10.830  16.579
    7    HE3  MET  40           HE1      MET  40 -10.233   9.241  14.510
    8    HE2  MET  40           HE2      MET  40  -8.479   9.336  14.366
    9    HE1  MET  40           HE3      MET  40  -9.381  10.713  14.996

  No H/Q in entry =           9
  In of MODEL   13
    1    H    MET  41           H        MET  41  -3.673   8.000  17.681
    2    HA   MET  41           HA       MET  41  -2.931   6.235  15.584
    3    HB2  MET  41           HB2      MET  41  -1.313   6.884  18.061
    4    HB3  MET  41           HB3      MET  41  -0.699   6.227  16.547
    5    HG2  MET  41           HG2      MET  41  -1.827   8.423  15.538
    6    HG3  MET  41           HG3      MET  41  -1.588   9.009  17.183
    7    HE2  MET  41           HE1      MET  41   1.304   6.877  17.554
    8    HE1  MET  41           HE2      MET  41   0.528   8.181  18.449
    9    HE3  MET  41           HE3      MET  41   2.156   8.404  17.810

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ASP  42           H        ASP  42  -3.330   5.769  19.070
    2    HA   ASP  42           HA       ASP  42  -2.326   3.164  19.235
    3    HB2  ASP  42           HB2      ASP  42  -3.183   4.935  21.053
    4    HB3  ASP  42           HB3      ASP  42  -4.622   3.927  20.978

  No H/Q in entry =           4
  In of MODEL   13
    1    H    GLN  43           H        GLN  43  -5.645   4.306  18.725
    2    HA   GLN  43           HA       GLN  43  -6.818   1.732  18.529
    3    HB2  GLN  43           HB2      GLN  43  -7.707   4.394  17.396
    4    HB3  GLN  43           HB3      GLN  43  -8.687   2.926  17.372
    5    HG2  GLN  43           HG2      GLN  43  -8.402   2.804  19.881
    6    HG3  GLN  43           HG3      GLN  43  -7.658   4.400  19.810
    7   HE21  GLN  43          HE21      GLN  43  -9.840   4.507  21.304
    8   HE22  GLN  43          HE22      GLN  43 -11.192   5.097  20.469

  No H/Q in entry =           8
  In of MODEL   13
    1    H    SER  44           H        SER  44  -5.446   3.928  16.119
    2    HA   SER  44           HA       SER  44  -6.158   2.450  13.829
    3    HB2  SER  44           HB2      SER  44  -4.875   4.819  14.275
    4    HB3  SER  44           HB3      SER  44  -3.531   3.807  13.749
    5    HG   SER  44           HG       SER  44  -4.627   4.790  11.982

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ARG  45           H        ARG  45  -3.287   2.305  15.918
    2    HA   ARG  45           HA       ARG  45  -1.826   0.333  14.541
    3    HB2  ARG  45           HB2      ARG  45  -0.973   1.746  16.411
    4    HB3  ARG  45           HB3      ARG  45  -1.978   0.828  17.529
    5    HG2  ARG  45           HG2      ARG  45  -0.769  -1.246  16.892
    6    HG3  ARG  45           HG3      ARG  45   0.260  -0.303  15.816
    7    HD2  ARG  45           HD2      ARG  45   1.006   1.070  17.772
    8    HD3  ARG  45           HD3      ARG  45   0.068   0.007  18.844
    9    HE   ARG  45           HE       ARG  45   1.753  -1.610  17.269
   10   HH21  ARG  45          HH11      ARG  45   3.641  -2.454  18.112
   11   HH22  ARG  45          HH12      ARG  45   4.420  -1.676  19.445
   12   HH11  ARG  45          HH21      ARG  45   2.078   0.855  19.658
   13   HH12  ARG  45          HH22      ARG  45   3.534   0.200  20.318

  No H/Q in entry =          13
  In of MODEL   13
    1    H    MET  46           H        MET  46  -4.235   0.043  17.135
    2    HA   MET  46           HA       MET  46  -4.101  -2.758  17.444
    3    HB2  MET  46           HB2      MET  46  -6.252  -0.729  18.035
    4    HB3  MET  46           HB3      MET  46  -6.472  -2.445  18.382
    5    HG2  MET  46           HG2      MET  46  -4.456  -2.438  19.784
    6    HG3  MET  46           HG3      MET  46  -4.185  -0.743  19.415
    7    HE2  MET  46           HE1      MET  46  -5.228  -0.055  22.945
    8    HE1  MET  46           HE2      MET  46  -4.025   0.023  21.663
    9    HE3  MET  46           HE3      MET  46  -4.304  -1.497  22.507

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ALA  47           H        ALA  47  -6.091  -0.719  15.342
    2    HA   ALA  47           HA       ALA  47  -7.730  -2.751  14.273
    3    HB3  ALA  47           HB1      ALA  47  -8.381  -0.505  13.854
    4    HB1  ALA  47           HB2      ALA  47  -7.896  -1.146  12.284
    5    HB2  ALA  47           HB3      ALA  47  -6.805  -0.090  13.183

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU  48           H        LEU  48  -4.592  -1.481  13.231
    2    HA   LEU  48           HA       LEU  48  -4.324  -3.077  10.891
    3    HB2  LEU  48           HB2      LEU  48  -2.257  -1.823  12.705
    4    HB3  LEU  48           HB3      LEU  48  -1.892  -2.549  11.139
    5    HG   LEU  48           HG       LEU  48  -3.888  -0.306  11.521
    6   HD13  LEU  48          HD11      LEU  48  -1.758   0.543  12.193
    7   HD12  LEU  48          HD12      LEU  48  -2.020   1.100  10.540
    8   HD11  LEU  48          HD13      LEU  48  -0.941  -0.261  10.852
    9   HD22  LEU  48          HD21      LEU  48  -4.366  -1.286   9.445
   10   HD21  LEU  48          HD22      LEU  48  -2.688  -1.742   9.155
   11   HD23  LEU  48          HD23      LEU  48  -3.185  -0.057   8.993

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ASN  49           H        ASN  49  -3.294  -3.485  14.241
    2    HA   ASN  49           HA       ASN  49  -1.720  -5.769  13.916
    3    HB2  ASN  49           HB2      ASN  49  -1.713  -4.454  15.965
    4    HB3  ASN  49           HB3      ASN  49  -3.393  -4.866  16.277
    5   HD21  ASN  49          HD21      ASN  49  -0.095  -6.036  16.437
    6   HD22  ASN  49          HD22      ASN  49  -0.448  -7.476  17.262

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLU  50           H        GLU  50  -5.187  -5.447  14.577
    2    HA   GLU  50           HA       GLU  50  -5.738  -8.239  14.686
    3    HB2  GLU  50           HB2      GLU  50  -7.303  -6.530  15.556
    4    HB3  GLU  50           HB3      GLU  50  -7.584  -5.962  13.908
    5    HG2  GLU  50           HG2      GLU  50  -8.477  -8.147  13.269
    6    HG3  GLU  50           HG3      GLU  50  -8.109  -8.795  14.864

  No H/Q in entry =           6
  In of MODEL   13
    1    H    ALA  51           H        ALA  51  -5.765  -5.842  12.089
    2    HA   ALA  51           HA       ALA  51  -6.768  -7.556  10.064
    3    HB2  ALA  51           HB1      ALA  51  -6.518  -5.748   8.695
    4    HB1  ALA  51           HB2      ALA  51  -4.876  -5.422   9.248
    5    HB3  ALA  51           HB3      ALA  51  -6.255  -4.891  10.212

  No H/Q in entry =           5
  In of MODEL   13
    1    H    HIS  52           H        HIS  52  -3.468  -6.696  11.058
    2    HA   HIS  52           HA       HIS  52  -2.084  -8.206   9.114
    3    HB2  HIS  52           HB2      HIS  52  -1.052  -6.477  10.584
    4    HB3  HIS  52           HB3      HIS  52  -1.200  -7.591  11.943
    5    HD1  HIS  52           HD1      HIS  52   0.277  -9.760  11.880
    6    HD2  HIS  52           HD2      HIS  52   1.035  -7.081   8.777
    7    HE1  HIS  52           HE1      HIS  52   2.462 -10.486  10.824
    8    HE2  HIS  52           HE2      HIS  52   2.938  -8.862   8.931

  No H/Q in entry =           8
  In of MODEL   13
    1    H    LEU  53           H        LEU  53  -3.319  -9.064  12.323
    2    HA   LEU  53           HA       LEU  53  -2.159 -11.625  12.521
    3    HB2  LEU  53           HB2      LEU  53  -4.626 -10.402  13.729
    4    HB3  LEU  53           HB3      LEU  53  -4.204 -12.087  14.018
    5    HG   LEU  53           HG       LEU  53  -2.262  -9.806  14.510
    6   HD11  LEU  53          HD11      LEU  53  -4.267  -9.529  15.928
    7   HD13  LEU  53          HD12      LEU  53  -2.865  -9.999  16.887
    8   HD12  LEU  53          HD13      LEU  53  -4.096 -11.190  16.487
    9   HD22  LEU  53          HD21      LEU  53  -0.993 -11.782  14.494
   10   HD21  LEU  53          HD22      LEU  53  -2.323 -12.755  15.110
   11   HD23  LEU  53          HD23      LEU  53  -1.443 -11.692  16.193

  No H/Q in entry =          11
  In of MODEL   13
    1    H    VAL  54           H        VAL  54  -5.250 -10.550  11.149
    2    HA   VAL  54           HA       VAL  54  -6.201 -13.131  10.460
    3    HB   VAL  54           HB       VAL  54  -6.803 -10.389   9.322
    4   HG12  VAL  54          HG11      VAL  54  -8.923 -11.735   8.504
    5   HG11  VAL  54          HG12      VAL  54  -7.832 -13.118   8.580
    6   HG13  VAL  54          HG13      VAL  54  -7.448 -11.749   7.539
    7   HG22  VAL  54          HG21      VAL  54  -7.717 -10.412  11.470
    8   HG21  VAL  54          HG22      VAL  54  -7.998 -12.151  11.451
    9   HG23  VAL  54          HG23      VAL  54  -9.060 -11.078  10.541

  No H/Q in entry =           9
  In of MODEL   13
    1    H    GLN  55           H        GLN  55  -4.286 -10.709   8.676
    2    HA   GLN  55           HA       GLN  55  -4.171 -12.176   6.259
    3    HB2  GLN  55           HB2      GLN  55  -3.532  -9.922   6.070
    4    HB3  GLN  55           HB3      GLN  55  -2.427 -10.015   7.439
    5    HG2  GLN  55           HG2      GLN  55  -0.719 -10.888   6.168
    6    HG3  GLN  55           HG3      GLN  55  -1.804 -11.847   5.171
    7   HE21  GLN  55          HE21      GLN  55  -1.803 -11.157   3.050
    8   HE22  GLN  55          HE22      GLN  55  -1.579  -9.556   2.539

  No H/Q in entry =           8
  In of MODEL   13
    1    H    THR  56           H        THR  56  -2.074 -12.187   9.147
    2    HA   THR  56           HA       THR  56  -0.019 -13.818   8.237
    3    HB   THR  56           HB       THR  56  -1.276 -14.042  10.981
    4    HG1  THR  56           HG1      THR  56   0.700 -12.409  11.111
    5   HG21  THR  56          HG21      THR  56   1.548 -14.435   9.951
    6   HG23  THR  56          HG22      THR  56   0.451 -15.707  10.489
    7   HG22  THR  56          HG23      THR  56   1.067 -14.525  11.643

  No H/Q in entry =           7
  In of MODEL   13
    1    H    LYS  57           H        LYS  57  -3.159 -14.805   9.590
    2    HA   LYS  57           HA       LYS  57  -2.757 -17.607   9.347
    3    HB2  LYS  57           HB2      LYS  57  -4.563 -16.471  10.682
    4    HB3  LYS  57           HB3      LYS  57  -5.348 -16.038   9.170
    5    HG2  LYS  57           HG2      LYS  57  -5.613 -18.403   8.595
    6    HG3  LYS  57           HG3      LYS  57  -4.773 -18.875  10.070
    7    HD2  LYS  57           HD2      LYS  57  -6.549 -17.812  11.424
    8    HD3  LYS  57           HD3      LYS  57  -7.398 -17.350   9.949
    9    HE2  LYS  57           HE2      LYS  57  -7.634 -19.734   9.331
   10    HE3  LYS  57           HE3      LYS  57  -6.775 -20.213  10.793
   11    HZ3  LYS  57           HZ1      LYS  57  -8.495 -19.334  12.137
   12    HZ2  LYS  57           HZ2      LYS  57  -9.241 -20.291  10.946
   13    HZ1  LYS  57           HZ3      LYS  57  -9.259 -18.597  10.812

  No H/Q in entry =          13
  In of MODEL   13
    1    H    LEU  58           H        LEU  58  -4.042 -15.145   7.166
    2    HA   LEU  58           HA       LEU  58  -4.867 -16.958   5.158
    3    HB2  LEU  58           HB2      LEU  58  -4.212 -14.020   5.023
    4    HB3  LEU  58           HB3      LEU  58  -4.886 -14.947   3.681
    5    HG   LEU  58           HG       LEU  58  -6.172 -14.745   6.424
    6   HD11  LEU  58          HD11      LEU  58  -6.438 -13.095   3.931
    7   HD13  LEU  58          HD12      LEU  58  -6.425 -12.587   5.620
    8   HD12  LEU  58          HD13      LEU  58  -7.858 -13.357   4.943
    9   HD22  LEU  58          HD21      LEU  58  -7.162 -16.639   5.553
   10   HD21  LEU  58          HD22      LEU  58  -6.810 -16.194   3.883
   11   HD23  LEU  58          HD23      LEU  58  -8.164 -15.445   4.729

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  59           H        ILE  59  -1.715 -15.798   6.029
    2    HA   ILE  59           HA       ILE  59  -0.620 -16.544   3.396
    3    HB   ILE  59           HB       ILE  59   0.176 -14.490   4.964
    4   HG12  ILE  59          HG12      ILE  59   2.252 -16.175   3.552
    5   HG13  ILE  59          HG13      ILE  59   1.072 -15.229   2.683
    6   HG21  ILE  59          HG21      ILE  59   0.887 -16.280   6.728
    7   HG23  ILE  59          HG22      ILE  59   2.004 -14.982   6.372
    8   HG22  ILE  59          HG23      ILE  59   2.239 -16.578   5.662
    9   HD11  ILE  59          HD11      ILE  59   1.829 -13.187   3.848
   10   HD13  ILE  59          HD12      ILE  59   3.145 -13.945   2.954
   11   HD12  ILE  59          HD13      ILE  59   3.036 -14.144   4.704

  No H/Q in entry =          11
  In of MODEL   13
    1    H    GLU  60           H        GLU  60  -0.660 -17.648   6.765
    2    HA   GLU  60           HA       GLU  60   1.339 -19.659   6.508
    3    HB2  GLU  60           HB2      GLU  60   0.585 -18.864   8.696
    4    HB3  GLU  60           HB3      GLU  60  -1.033 -19.489   8.386
    5    HG2  GLU  60           HG2      GLU  60  -0.136 -21.782   8.259
    6    HG3  GLU  60           HG3      GLU  60   1.491 -21.165   8.538

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLY  61           H        GLY  61  -2.171 -19.700   6.010
    2    HA3  GLY  61           HA2      GLY  61  -1.965 -22.497   5.054
    3    HA2  GLY  61           HA3      GLY  61  -3.440 -21.737   5.642

  No H/Q in entry =           3
  In of MODEL   13
    1    H    ASP  62           H        ASP  62  -1.177 -20.197   3.445
    2    HA   ASP  62           HA       ASP  62  -3.197 -19.485   1.597
    3    HB2  ASP  62           HB2      ASP  62  -1.320 -18.665   0.233
    4    HB3  ASP  62           HB3      ASP  62  -1.151 -18.175   1.916

  No H/Q in entry =           4
  In of MODEL   13
    1    H    ALA  63           H        ALA  63  -3.398 -22.291   1.874
    2    HA   ALA  63           HA       ALA  63  -2.085 -23.764  -0.170
    3    HB2  ALA  63           HB1      ALA  63  -3.390 -24.692   1.792
    4    HB1  ALA  63           HB2      ALA  63  -3.660 -25.474   0.234
    5    HB3  ALA  63           HB3      ALA  63  -4.852 -24.339   0.869

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLY  64           H        GLY  64  -5.081 -21.896  -0.069
    2    HA3  GLY  64           HA2      GLY  64  -6.486 -21.120  -1.705
    3    HA2  GLY  64           HA3      GLY  64  -5.093 -21.174  -2.773

  No H/Q in entry =           3
  In of MODEL   13
    1    H    GLU  65           H        GLU  65  -5.841 -22.098  -4.621
    2    HA   GLU  65           HA       GLU  65  -7.893 -24.052  -4.665
    3    HB2  GLU  65           HB2      GLU  65  -5.895 -23.255  -6.785
    4    HB3  GLU  65           HB3      GLU  65  -7.280 -24.312  -7.061
    5    HG2  GLU  65           HG2      GLU  65  -7.459 -21.486  -5.979
    6    HG3  GLU  65           HG3      GLU  65  -7.764 -21.939  -7.654

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLY  66           H        GLY  66  -7.165 -25.914  -6.435
    2    HA3  GLY  66           HA2      GLY  66  -6.100 -27.999  -4.891
    3    HA2  GLY  66           HA3      GLY  66  -6.399 -28.047  -6.617

  No H/Q in entry =           3
  In of MODEL   13
    1    H    LYS  67           H        LYS  67  -4.586 -25.894  -7.240
    2    HA   LYS  67           HA       LYS  67  -2.188 -27.435  -7.481
    3    HB2  LYS  67           HB2      LYS  67  -2.949 -24.670  -8.404
    4    HB3  LYS  67           HB3      LYS  67  -1.402 -25.437  -8.781
    5    HG2  LYS  67           HG2      LYS  67  -2.543 -27.318  -9.837
    6    HG3  LYS  67           HG3      LYS  67  -4.112 -26.656  -9.384
    7    HD2  LYS  67           HD2      LYS  67  -3.840 -26.017 -11.646
    8    HD3  LYS  67           HD3      LYS  67  -3.406 -24.570 -10.734
    9    HE2  LYS  67           HE2      LYS  67  -1.055 -25.021 -10.980
   10    HE3  LYS  67           HE3      LYS  67  -1.374 -26.624 -11.639
   11    HZ1  LYS  67           HZ1      LYS  67  -2.637 -25.378 -13.446
   12    HZ3  LYS  67           HZ2      LYS  67  -0.939 -25.317 -13.490
   13    HZ2  LYS  67           HZ3      LYS  67  -1.825 -23.993 -12.899

  No H/Q in entry =          13
  In of MODEL   13
    1    H    MET  68           H        MET  68  -0.047 -26.325  -7.275
    2    HA   MET  68           HA       MET  68   0.594 -25.991  -4.566
    3    HB2  MET  68           HB2      MET  68   2.177 -25.311  -7.047
    4    HB3  MET  68           HB3      MET  68   2.844 -25.402  -5.416
    5    HG2  MET  68           HG2      MET  68   1.431 -27.676  -6.840
    6    HG3  MET  68           HG3      MET  68   3.181 -27.517  -6.682
    7    HE1  MET  68           HE1      MET  68   4.465 -27.473  -4.812
    8    HE3  MET  68           HE2      MET  68   4.120 -28.149  -3.221
    9    HE2  MET  68           HE3      MET  68   3.656 -26.487  -3.584

  No H/Q in entry =           9
  In of MODEL   13
    1    H    LYS  69           H        LYS  69   0.151 -23.550  -7.114
    2    HA   LYS  69           HA       LYS  69   1.238 -21.328  -6.038
    3    HB2  LYS  69           HB2      LYS  69  -1.228 -21.699  -7.657
    4    HB3  LYS  69           HB3      LYS  69  -0.825 -20.091  -7.046
    5    HG2  LYS  69           HG2      LYS  69   0.233 -20.301  -9.196
    6    HG3  LYS  69           HG3      LYS  69   1.502 -20.422  -7.976
    7    HD2  LYS  69           HD2      LYS  69   1.516 -22.846  -8.159
    8    HD3  LYS  69           HD3      LYS  69   0.141 -22.803  -9.265
    9    HE2  LYS  69           HE2      LYS  69   1.487 -21.518 -10.890
   10    HE3  LYS  69           HE3      LYS  69   2.862 -21.569  -9.787
   11    HZ3  LYS  69           HZ1      LYS  69   3.196 -23.321 -11.274
   12    HZ2  LYS  69           HZ2      LYS  69   1.572 -23.817 -11.212
   13    HZ1  LYS  69           HZ3      LYS  69   2.591 -24.067  -9.876

  No H/Q in entry =          13
  In of MODEL   13
    1    H    VAL  70           H        VAL  70  -0.438 -19.312  -5.463
    2    HA   VAL  70           HA       VAL  70  -1.772 -20.066  -2.924
    3    HB   VAL  70           HB       VAL  70  -0.915 -17.945  -1.963
    4   HG13  VAL  70          HG11      VAL  70   0.334 -20.018  -1.575
    5   HG12  VAL  70          HG12      VAL  70   1.450 -18.662  -1.739
    6   HG11  VAL  70          HG13      VAL  70   1.221 -19.784  -3.080
    7   HG23  VAL  70          HG21      VAL  70   1.072 -16.902  -3.288
    8   HG22  VAL  70          HG22      VAL  70  -0.562 -16.518  -3.822
    9   HG21  VAL  70          HG23      VAL  70   0.383 -17.724  -4.690

  No H/Q in entry =           9
  In of MODEL   13
    1    H    SER  71           H        SER  71  -3.268 -18.340  -2.174
    2    HA   SER  71           HA       SER  71  -5.195 -17.674  -4.130
    3    HB2  SER  71           HB2      SER  71  -5.648 -17.898  -1.657
    4    HB3  SER  71           HB3      SER  71  -4.807 -16.371  -1.412
    5    HG   SER  71           HG       SER  71  -7.036 -16.750  -3.133

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU  72           H        LEU  72  -5.353 -16.018  -5.467
    2    HA   LEU  72           HA       LEU  72  -3.216 -14.238  -5.943
    3    HB2  LEU  72           HB2      LEU  72  -6.078 -14.253  -6.897
    4    HB3  LEU  72           HB3      LEU  72  -4.866 -13.108  -7.467
    5    HG   LEU  72           HG       LEU  72  -4.497 -16.120  -7.603
    6   HD12  LEU  72          HD11      LEU  72  -5.237 -14.311  -9.908
    7   HD11  LEU  72          HD12      LEU  72  -6.461 -15.150  -8.955
    8   HD13  LEU  72          HD13      LEU  72  -5.256 -16.074  -9.852
    9   HD21  LEU  72          HD21      LEU  72  -2.998 -13.715  -8.624
   10   HD23  LEU  72          HD22      LEU  72  -2.910 -15.218  -9.527
   11   HD22  LEU  72          HD23      LEU  72  -2.362 -15.165  -7.854

  No H/Q in entry =          11
  In of MODEL   13
    1    H    VAL  73           H        VAL  73  -6.307 -13.834  -4.321
    2    HA   VAL  73           HA       VAL  73  -6.311 -11.063  -3.970
    3    HB   VAL  73           HB       VAL  73  -8.028 -11.400  -2.372
    4   HG13  VAL  73          HG11      VAL  73  -9.517 -12.821  -3.575
    5   HG12  VAL  73          HG12      VAL  73  -8.195 -13.820  -4.175
    6   HG11  VAL  73          HG13      VAL  73  -8.401 -12.176  -4.781
    7   HG22  VAL  73          HG21      VAL  73  -7.227 -12.879  -0.763
    8   HG21  VAL  73          HG22      VAL  73  -6.638 -14.027  -1.967
    9   HG23  VAL  73          HG23      VAL  73  -8.365 -13.916  -1.626

  No H/Q in entry =           9
  In of MODEL   13
    1    H    LEU  74           H        LEU  74  -4.413 -13.460  -2.382
    2    HA   LEU  74           HA       LEU  74  -3.991 -12.325   0.142
    3    HB2  LEU  74           HB2      LEU  74  -3.239 -14.554  -0.353
    4    HB3  LEU  74           HB3      LEU  74  -2.176 -13.961  -1.627
    5    HG   LEU  74           HG       LEU  74  -0.853 -12.723   0.057
    6   HD13  LEU  74          HD11      LEU  74  -2.406 -12.215   1.782
    7   HD12  LEU  74          HD12      LEU  74  -1.348 -13.434   2.496
    8   HD11  LEU  74          HD13      LEU  74  -2.944 -13.890   1.900
    9   HD21  LEU  74          HD21      LEU  74  -0.699 -15.299  -0.553
   10   HD23  LEU  74          HD22      LEU  74  -1.105 -15.456   1.141
   11   HD22  LEU  74          HD23      LEU  74   0.339 -14.585   0.680

  No H/Q in entry =          11
  In of MODEL   13
    1    H    VAL  75           H        VAL  75  -2.087 -11.960  -2.811
    2    HA   VAL  75           HA       VAL  75  -0.263 -10.063  -1.796
    3    HB   VAL  75           HB       VAL  75  -1.220 -10.527  -4.623
    4   HG12  VAL  75          HG11      VAL  75   0.870  -9.258  -5.234
    5   HG11  VAL  75          HG12      VAL  75   1.080  -8.864  -3.534
    6   HG13  VAL  75          HG13      VAL  75  -0.316  -8.253  -4.409
    7   HG22  VAL  75          HG21      VAL  75  -0.066 -12.436  -3.592
    8   HG21  VAL  75          HG22      VAL  75   1.247 -11.383  -3.066
    9   HG23  VAL  75          HG23      VAL  75   0.989 -11.682  -4.786

  No H/Q in entry =           9
  In of MODEL   13
    1    H    GLU  76           H        GLU  76  -3.405  -9.668  -3.461
    2    HA   GLU  76           HA       GLU  76  -3.414  -6.854  -3.562
    3    HB2  GLU  76           HB2      GLU  76  -5.091  -8.275  -4.726
    4    HB3  GLU  76           HB3      GLU  76  -5.759  -8.750  -3.172
    5    HG2  GLU  76           HG2      GLU  76  -7.177  -7.016  -4.067
    6    HG3  GLU  76           HG3      GLU  76  -6.287  -6.308  -2.734

  No H/Q in entry =           6
  In of MODEL   13
    1    H    ALA  77           H        ALA  77  -4.563  -9.065  -1.025
    2    HA   ALA  77           HA       ALA  77  -5.493  -7.049   0.732
    3    HB2  ALA  77           HB1      ALA  77  -5.941  -9.563   0.851
    4    HB3  ALA  77           HB2      ALA  77  -5.627  -8.748   2.382
    5    HB1  ALA  77           HB3      ALA  77  -4.359  -9.703   1.617

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLN  78           H        GLN  78  -2.369  -8.646   0.374
    2    HA   GLN  78           HA       GLN  78  -1.099  -7.506   2.627
    3    HB2  GLN  78           HB2      GLN  78  -0.264  -9.459   1.275
    4    HB3  GLN  78           HB3      GLN  78   0.191  -8.321   0.009
    5    HG2  GLN  78           HG2      GLN  78   1.664  -7.145   1.595
    6    HG3  GLN  78           HG3      GLN  78   1.216  -8.286   2.861
    7   HE21  GLN  78          HE21      GLN  78   3.150  -9.481   3.132
    8   HE22  GLN  78          HE22      GLN  78   3.933 -10.303   1.869

  No H/Q in entry =           8
  In of MODEL   13
    1    H    LEU  79           H        LEU  79  -1.441  -6.439  -0.720
    2    HA   LEU  79           HA       LEU  79   0.280  -4.239  -0.702
    3    HB2  LEU  79           HB2      LEU  79  -0.755  -5.029  -2.759
    4    HB3  LEU  79           HB3      LEU  79  -2.353  -4.612  -2.154
    5    HG   LEU  79           HG       LEU  79  -1.771  -2.233  -2.126
    6   HD13  LEU  79          HD11      LEU  79   0.471  -2.026  -1.609
    7   HD12  LEU  79          HD12      LEU  79   0.529  -1.739  -3.348
    8   HD11  LEU  79          HD13      LEU  79   0.956  -3.324  -2.701
    9   HD23  LEU  79          HD21      LEU  79  -1.128  -2.044  -4.677
   10   HD22  LEU  79          HD22      LEU  79  -2.668  -2.768  -4.221
   11   HD21  LEU  79          HD23      LEU  79  -1.310  -3.799  -4.663

  No H/Q in entry =          11
  In of MODEL   13
    1    H    HIS  80           H        HIS  80  -3.191  -4.345   0.116
    2    HA   HIS  80           HA       HIS  80  -3.339  -1.586   0.780
    3    HB2  HIS  80           HB2      HIS  80  -5.080  -3.967   1.094
    4    HB3  HIS  80           HB3      HIS  80  -5.381  -2.622   2.198
    5    HD1  HIS  80           HD1      HIS  80  -6.970  -0.959   1.287
    6    HD2  HIS  80           HD2      HIS  80  -4.800  -2.806  -1.756
    7    HE1  HIS  80           HE1      HIS  80  -7.788   0.052  -0.894
    8    HE2  HIS  80           HE2      HIS  80  -6.472  -1.068  -2.758

  No H/Q in entry =           8
  In of MODEL   13
    1    H    LEU  81           H        LEU  81  -2.902  -4.489   2.773
    2    HA   LEU  81           HA       LEU  81  -2.873  -3.143   5.258
    3    HB2  LEU  81           HB2      LEU  81  -1.696  -5.779   4.380
    4    HB3  LEU  81           HB3      LEU  81  -1.664  -5.221   6.054
    5    HG   LEU  81           HG       LEU  81  -4.210  -5.431   4.421
    6   HD12  LEU  81          HD11      LEU  81  -4.551  -7.491   5.967
    7   HD11  LEU  81          HD12      LEU  81  -2.798  -7.450   6.157
    8   HD13  LEU  81          HD13      LEU  81  -3.507  -7.668   4.556
    9   HD23  LEU  81          HD21      LEU  81  -5.062  -5.620   6.920
   10   HD22  LEU  81          HD22      LEU  81  -4.709  -4.037   6.231
   11   HD21  LEU  81          HD23      LEU  81  -3.538  -4.817   7.294

  No H/Q in entry =          11
  In of MODEL   13
    1    H    MET  82           H        MET  82  -0.202  -4.091   3.093
    2    HA   MET  82           HA       MET  82   1.892  -3.232   4.781
    3    HB2  MET  82           HB2      MET  82   1.677  -3.569   1.789
    4    HB3  MET  82           HB3      MET  82   3.167  -3.024   2.555
    5    HG2  MET  82           HG2      MET  82   1.715  -5.589   3.276
    6    HG3  MET  82           HG3      MET  82   3.090  -5.503   2.179
    7    HE3  MET  82           HE1      MET  82   6.114  -4.819   4.169
    8    HE2  MET  82           HE2      MET  82   5.216  -3.436   3.549
    9    HE1  MET  82           HE3      MET  82   5.281  -4.927   2.614

  No H/Q in entry =           9
  In of MODEL   13
    1    H    THR  83           H        THR  83   0.104  -1.559   2.221
    2    HA   THR  83           HA       THR  83   1.557   0.865   2.311
    3    HB   THR  83           HB       THR  83  -0.601   1.827   1.320
    4    HG1  THR  83           HG1      THR  83  -2.273   0.559   1.209
    5   HG22  THR  83          HG21      THR  83  -0.357   0.005  -0.680
    6   HG21  THR  83          HG22      THR  83   1.136  -0.313   0.200
    7   HG23  THR  83          HG23      THR  83   0.804   1.306  -0.416

  No H/Q in entry =           7
  In of MODEL   13
    1    H    SER  84           H        SER  84  -1.470  -0.115   3.905
    2    HA   SER  84           HA       SER  84  -1.926   2.323   5.249
    3    HB2  SER  84           HB2      SER  84  -2.810  -0.500   5.812
    4    HB3  SER  84           HB3      SER  84  -3.281   0.849   6.844
    5    HG   SER  84           HG       SER  84  -3.740   0.543   4.051

  No H/Q in entry =           5
  In of MODEL   13
    1    H    MET  85           H        MET  85  -0.270  -0.639   6.382
    2    HA   MET  85           HA       MET  85   0.260   0.278   8.987
    3    HB2  MET  85           HB2      MET  85   0.513  -2.069   8.315
    4    HB3  MET  85           HB3      MET  85   1.900  -1.632   7.316
    5    HG2  MET  85           HG2      MET  85   3.106  -0.832   9.301
    6    HG3  MET  85           HG3      MET  85   1.708  -1.195  10.312
    7    HE2  MET  85           HE1      MET  85   4.674  -3.988   8.309
    8    HE1  MET  85           HE2      MET  85   4.305  -2.302   7.952
    9    HE3  MET  85           HE3      MET  85   3.286  -3.579   7.294

  No H/Q in entry =           9
  In of MODEL   13
    1    H    LEU  86           H        LEU  86   2.205   0.500   6.040
    2    HA   LEU  86           HA       LEU  86   4.440   1.771   7.200
    3    HB2  LEU  86           HB2      LEU  86   4.234   0.692   4.891
    4    HB3  LEU  86           HB3      LEU  86   3.454   2.188   4.377
    5    HG   LEU  86           HG       LEU  86   5.502   3.397   5.361
    6   HD11  LEU  86          HD11      LEU  86   6.158   0.774   6.163
    7   HD13  LEU  86          HD12      LEU  86   7.188   2.200   6.262
    8   HD12  LEU  86          HD13      LEU  86   7.281   1.150   4.851
    9   HD23  LEU  86          HD21      LEU  86   6.192   1.622   3.012
   10   HD22  LEU  86          HD22      LEU  86   6.615   3.312   3.275
   11   HD21  LEU  86          HD23      LEU  86   4.955   2.873   2.873

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ALA  87           H        ALA  87   1.554   3.066   5.610
    2    HA   ALA  87           HA       ALA  87   2.196   5.785   5.694
    3    HB1  ALA  87           HB1      ALA  87  -0.140   4.199   5.149
    4    HB3  ALA  87           HB2      ALA  87   0.201   5.854   4.649
    5    HB2  ALA  87           HB3      ALA  87  -0.601   5.547   6.191

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ARG  88           H        ARG  88   0.466   3.814   8.081
    2    HA   ARG  88           HA       ARG  88  -0.012   5.873   9.927
    3    HB2  ARG  88           HB2      ARG  88  -0.993   3.538   9.992
    4    HB3  ARG  88           HB3      ARG  88   0.537   3.010  10.701
    5    HG2  ARG  88           HG2      ARG  88   0.095   5.093  12.320
    6    HG3  ARG  88           HG3      ARG  88  -1.577   4.798  11.860
    7    HD2  ARG  88           HD2      ARG  88  -1.719   2.951  13.107
    8    HD3  ARG  88           HD3      ARG  88  -0.140   2.341  12.579
    9    HE   ARG  88           HE       ARG  88  -0.655   3.614  15.032
   10   HH21  ARG  88          HH11      ARG  88   0.918   4.598  16.273
   11   HH22  ARG  88          HH12      ARG  88   2.446   4.998  15.572
   12   HH11  ARG  88          HH21      ARG  88   1.633   3.754  12.459
   13   HH12  ARG  88          HH22      ARG  88   2.859   4.504  13.424

  No H/Q in entry =          13
  In of MODEL   13
    1    H    GLU  89           H        GLU  89   2.745   3.605   9.710
    2    HA   GLU  89           HA       GLU  89   4.017   4.472  12.056
    3    HB2  GLU  89           HB2      GLU  89   4.643   2.442  10.714
    4    HB3  GLU  89           HB3      GLU  89   5.440   3.522   9.569
    5    HG2  GLU  89           HG2      GLU  89   6.936   4.343  11.315
    6    HG3  GLU  89           HG3      GLU  89   6.082   3.401  12.534

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LEU  90           H        LEU  90   4.361   5.623   8.729
    2    HA   LEU  90           HA       LEU  90   6.325   7.589   9.317
    3    HB2  LEU  90           HB2      LEU  90   4.318   7.292   7.086
    4    HB3  LEU  90           HB3      LEU  90   5.570   8.541   7.109
    5    HG   LEU  90           HG       LEU  90   6.192   5.594   7.445
    6   HD12  LEU  90          HD11      LEU  90   6.950   5.813   5.007
    7   HD11  LEU  90          HD12      LEU  90   5.959   7.271   4.956
    8   HD13  LEU  90          HD13      LEU  90   5.212   5.711   5.298
    9   HD22  LEU  90          HD21      LEU  90   8.107   6.711   8.131
   10   HD21  LEU  90          HD22      LEU  90   7.784   8.121   7.123
   11   HD23  LEU  90          HD23      LEU  90   8.420   6.645   6.398

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  91           H        ILE  91   2.787   7.665   9.161
    2    HA   ILE  91           HA       ILE  91   2.491  10.444   9.610
    3    HB   ILE  91           HB       ILE  91   0.659   8.099  10.150
    4   HG12  ILE  91          HG12      ILE  91   0.453  10.383   8.164
    5   HG13  ILE  91          HG13      ILE  91   1.288   8.875   7.794
    6   HG22  ILE  91          HG21      ILE  91  -1.039  10.186  10.209
    7   HG21  ILE  91          HG22      ILE  91   0.375  10.993  10.885
    8   HG23  ILE  91          HG23      ILE  91  -0.288   9.567  11.680
    9   HD13  ILE  91          HD11      ILE  91  -0.677   7.620   7.835
   10   HD12  ILE  91          HD12      ILE  91  -1.240   9.144   7.151
   11   HD11  ILE  91          HD13      ILE  91  -1.520   8.786   8.855

  No H/Q in entry =          11
  In of MODEL   13
    1    H    THR  92           H        THR  92   2.843   7.697  11.813
    2    HA   THR  92           HA       THR  92   2.418   9.078  14.236
    3    HB   THR  92           HB       THR  92   4.189   6.714  13.576
    4    HG1  THR  92           HG1      THR  92   2.208   5.989  13.471
    5   HG22  THR  92          HG21      THR  92   3.795   6.437  16.209
    6   HG21  THR  92          HG22      THR  92   3.759   8.197  16.134
    7   HG23  THR  92          HG23      THR  92   5.179   7.318  15.565

  No H/Q in entry =           7
  In of MODEL   13
    1    H    GLU  93           H        GLU  93   5.365   8.581  12.309
    2    HA   GLU  93           HA       GLU  93   7.138   9.980  14.009
    3    HB2  GLU  93           HB2      GLU  93   7.228   9.662  10.994
    4    HB3  GLU  93           HB3      GLU  93   8.575  10.171  12.012
    5    HG2  GLU  93           HG2      GLU  93   7.122   7.558  12.457
    6    HG3  GLU  93           HG3      GLU  93   8.510   7.687  11.384

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LEU  94           H        LEU  94   5.112  11.026  11.291
    2    HA   LEU  94           HA       LEU  94   5.960  13.717  11.191
    3    HB2  LEU  94           HB2      LEU  94   3.350  12.392  10.432
    4    HB3  LEU  94           HB3      LEU  94   3.636  14.115  10.190
    5    HG   LEU  94           HG       LEU  94   5.624  12.095   9.146
    6   HD11  LEU  94          HD11      LEU  94   2.894  12.688   8.077
    7   HD13  LEU  94          HD12      LEU  94   3.855  11.216   7.954
    8   HD12  LEU  94          HD13      LEU  94   4.214  12.590   6.910
    9   HD23  LEU  94          HD21      LEU  94   5.907  13.926   7.423
   10   HD22  LEU  94          HD22      LEU  94   6.326  14.413   9.065
   11   HD21  LEU  94          HD23      LEU  94   4.784  14.905   8.363

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  95           H        ILE  95   3.393  12.141  13.077
    2    HA   ILE  95           HA       ILE  95   2.383  14.507  14.268
    3    HB   ILE  95           HB       ILE  95   2.354  11.626  15.195
    4   HG12  ILE  95          HG12      ILE  95   0.163  13.432  14.139
    5   HG13  ILE  95          HG13      ILE  95   1.106  12.358  13.110
    6   HG21  ILE  95          HG21      ILE  95   1.107  14.118  16.392
    7   HG23  ILE  95          HG22      ILE  95   2.135  12.934  17.200
    8   HG22  ILE  95          HG23      ILE  95   0.494  12.498  16.721
    9   HD13  ILE  95          HD11      ILE  95   0.172  10.434  14.028
   10   HD12  ILE  95          HD12      ILE  95  -1.194  11.544  14.100
   11   HD11  ILE  95          HD13      ILE  95  -0.237  11.232  15.548

  No H/Q in entry =          11
  In of MODEL   13
    1    H    GLU  96           H        GLU  96   4.942  12.250  15.272
    2    HA   GLU  96           HA       GLU  96   5.509  13.442  17.764
    3    HB2  GLU  96           HB2      GLU  96   6.426  11.269  17.120
    4    HB3  GLU  96           HB3      GLU  96   7.374  12.027  15.842
    5    HG2  GLU  96           HG2      GLU  96   9.027  12.552  17.309
    6    HG3  GLU  96           HG3      GLU  96   7.890  13.383  18.360

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LEU  97           H        LEU  97   6.603  14.196  14.480
    2    HA   LEU  97           HA       LEU  97   8.516  16.165  15.196
    3    HB2  LEU  97           HB2      LEU  97   6.923  15.637  12.697
    4    HB3  LEU  97           HB3      LEU  97   7.963  17.054  12.820
    5    HG   LEU  97           HG       LEU  97   8.950  14.242  13.385
    6   HD12  LEU  97          HD11      LEU  97   9.955  14.420  11.070
    7   HD11  LEU  97          HD12      LEU  97   8.925  15.825  10.803
    8   HD13  LEU  97          HD13      LEU  97   8.202  14.244  11.097
    9   HD23  LEU  97          HD21      LEU  97  11.139  15.489  12.647
   10   HD22  LEU  97          HD22      LEU  97  10.520  15.768  14.274
   11   HD21  LEU  97          HD23      LEU  97  10.226  16.955  13.004

  No H/Q in entry =          11
  In of MODEL   13
    1    H    HIS  98           H        HIS  98   5.029  16.350  14.532
    2    HA   HIS  98           HA       HIS  98   4.769  19.153  14.665
    3    HB2  HIS  98           HB2      HIS  98   2.845  16.930  15.387
    4    HB3  HIS  98           HB3      HIS  98   2.402  18.637  15.441
    5    HD1  HIS  98           HD1      HIS  98   3.391  15.906  13.040
    6    HD2  HIS  98           HD2      HIS  98   2.071  19.859  12.912
    7    HE1  HIS  98           HE1      HIS  98   2.845  16.401  10.615
    8    HE2  HIS  98           HE2      HIS  98   2.045  18.802  10.515

  No H/Q in entry =           8
  In of MODEL   13
    1    H    GLU  99           H        GLU  99   4.860  16.665  17.166
    2    HA   GLU  99           HA       GLU  99   4.271  18.369  19.361
    3    HB2  GLU  99           HB2      GLU  99   4.147  15.889  19.459
    4    HB3  GLU  99           HB3      GLU  99   5.906  15.819  19.356
    5    HG2  GLU  99           HG2      GLU  99   6.107  17.110  21.430
    6    HG3  GLU  99           HG3      GLU  99   4.357  17.276  21.521

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LYS 100           H        LYS 100   7.315  17.395  17.805
    2    HA   LYS 100           HA       LYS 100   8.985  18.773  19.665
    3    HB2  LYS 100           HB2      LYS 100   9.478  17.840  16.828
    4    HB3  LYS 100           HB3      LYS 100  10.715  18.593  17.839
    5    HG2  LYS 100           HG2      LYS 100  10.310  16.849  19.580
    6    HG3  LYS 100           HG3      LYS 100   9.170  16.060  18.486
    7    HD2  LYS 100           HD2      LYS 100  10.964  15.751  16.824
    8    HD3  LYS 100           HD3      LYS 100  12.110  16.552  17.903
    9    HE2  LYS 100           HE2      LYS 100  11.684  14.803  19.621
   10    HE3  LYS 100           HE3      LYS 100  10.600  13.982  18.493
   11    HZ1  LYS 100           HZ1      LYS 100  13.432  14.611  17.845
   12    HZ3  LYS 100           HZ2      LYS 100  12.375  13.570  17.015
   13    HZ2  LYS 100           HZ3      LYS 100  12.954  13.144  18.555

  No H/Q in entry =          13
  In of MODEL   13
    1    H    LEU 101           H        LEU 101   7.312  19.722  16.704
    2    HA   LEU 101           HA       LEU 101   8.563  22.261  16.371
    3    HB2  LEU 101           HB2      LEU 101   5.952  21.064  15.478
    4    HB3  LEU 101           HB3      LEU 101   6.229  22.791  15.270
    5    HG   LEU 101           HG       LEU 101   8.238  20.745  14.311
    6   HD12  LEU 101          HD11      LEU 101   7.098  21.266  12.023
    7   HD11  LEU 101          HD12      LEU 101   5.702  21.717  12.999
    8   HD13  LEU 101          HD13      LEU 101   6.343  20.077  13.084
    9   HD21  LEU 101          HD21      LEU 101   7.653  23.666  13.752
   10   HD23  LEU 101          HD22      LEU 101   8.623  22.691  12.648
   11   HD22  LEU 101          HD23      LEU 101   9.164  22.942  14.308

  No H/Q in entry =          11
  In of MODEL   13
    1    H    LYS 102           H        LYS 102   7.003  21.147  18.983
    2    HA   LYS 102           HA       LYS 102   6.381  22.249  20.913
    3    HB2  LYS 102           HB2      LYS 102   7.695  24.219  19.791
    4    HB3  LYS 102           HB3      LYS 102   6.106  24.847  19.411
    5    HG2  LYS 102           HG2      LYS 102   7.473  24.573  22.067
    6    HG3  LYS 102           HG3      LYS 102   6.541  25.915  21.434
    7    HD2  LYS 102           HD2      LYS 102   5.257  23.297  22.312
    8    HD3  LYS 102           HD3      LYS 102   5.522  24.655  23.395
    9    HE2  LYS 102           HE2      LYS 102   3.241  24.284  21.900
   10    HE3  LYS 102           HE3      LYS 102   3.765  25.823  22.583
   11    HZ2  LYS 102           HZ1      LYS 102   3.242  25.937  20.202
   12    HZ1  LYS 102           HZ2      LYS 102   4.488  24.837  19.882
   13    HZ3  LYS 102           HZ3      LYS 102   4.852  26.363  20.525

  No H/Q in entry =          13
  In of MODEL   13
    1    H    ALA 103           H        ALA 103   4.773  23.813  18.141
    2    HA   ALA 103           HA       ALA 103   2.325  24.426  19.019
    3    HB1  ALA 103           HB1      ALA 103   1.420  23.596  16.775
    4    HB2  ALA 103           HB2      ALA 103   3.060  23.035  16.450
    5    HB3  ALA 103           HB3      ALA 103   2.750  24.752  16.715

  No H/Q in entry =           5
  In of MODEL   13
    1    H1   ALA   1           H3       ALA   1  10.339 -20.208  -6.212
    2    H2   ALA   1           H2       ALA   1   9.375 -20.400  -7.600
    3    H3   ALA   1           H1       ALA   1   8.923 -21.139  -6.138
    4    HA   ALA   1           HA       ALA   1   9.937 -22.964  -6.874
    5    HB1  ALA   1           HB1      ALA   1  10.043 -22.607  -9.149
    6    HB2  ALA   1           HB2      ALA   1  11.772 -22.483  -8.816
    7    HB3  ALA   1           HB3      ALA   1  10.796 -21.021  -8.970

  No H/Q in entry =           7
  In of MODEL   13
    1    H    GLU   2           H        GLU   2  12.206 -23.949  -6.926
    2    HA   GLU   2           HA       GLU   2  13.583 -23.887  -4.711
    3    HB2  GLU   2           HB2      GLU   2  14.948 -23.778  -7.407
    4    HB3  GLU   2           HB3      GLU   2  15.663 -24.399  -5.920
    5    HG2  GLU   2           HG2      GLU   2  14.616 -26.400  -6.163
    6    HG3  GLU   2           HG3      GLU   2  13.057 -25.631  -6.425

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLU   3           H        GLU   3  15.388 -22.051  -7.109
    2    HA   GLU   3           HA       GLU   3  16.563 -20.381  -5.148
    3    HB2  GLU   3           HB2      GLU   3  16.514 -20.379  -8.158
    4    HB3  GLU   3           HB3      GLU   3  17.278 -19.061  -7.270
    5    HG2  GLU   3           HG2      GLU   3  18.917 -20.461  -6.343
    6    HG3  GLU   3           HG3      GLU   3  17.949 -21.913  -6.565

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LEU   4           H        LEU   4  14.300 -19.499  -7.784
    2    HA   LEU   4           HA       LEU   4  13.873 -16.883  -7.175
    3    HB2  LEU   4           HB2      LEU   4  11.669 -18.824  -7.909
    4    HB3  LEU   4           HB3      LEU   4  11.621 -17.074  -8.108
    5    HG   LEU   4           HG       LEU   4  13.560 -18.968  -9.476
    6   HD13  LEU   4          HD11      LEU   4  12.264 -18.800 -11.389
    7   HD12  LEU   4          HD12      LEU   4  11.579 -17.244 -10.924
    8   HD11  LEU   4          HD13      LEU   4  11.001 -18.726 -10.163
    9   HD23  LEU   4          HD21      LEU   4  13.934 -16.729 -10.828
   10   HD22  LEU   4          HD22      LEU   4  14.786 -16.984  -9.306
   11   HD21  LEU   4          HD23      LEU   4  13.349 -15.966  -9.349

  No H/Q in entry =          11
  In of MODEL   13
    1    H    GLU   5           H        GLU   5  12.341 -19.643  -5.535
    2    HA   GLU   5           HA       GLU   5  10.685 -18.045  -3.836
    3    HB2  GLU   5           HB2      GLU   5  10.226 -20.419  -4.359
    4    HB3  GLU   5           HB3      GLU   5  11.649 -20.874  -3.419
    5    HG2  GLU   5           HG2      GLU   5  10.686 -19.825  -1.419
    6    HG3  GLU   5           HG3      GLU   5   9.273 -19.329  -2.350

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLU   6           H        GLU   6  13.805 -19.673  -3.386
    2    HA   GLU   6           HA       GLU   6  14.166 -18.821  -0.687
    3    HB2  GLU   6           HB2      GLU   6  16.107 -19.797  -2.792
    4    HB3  GLU   6           HB3      GLU   6  16.571 -19.446  -1.126
    5    HG2  GLU   6           HG2      GLU   6  14.990 -21.107  -0.295
    6    HG3  GLU   6           HG3      GLU   6  14.402 -21.407  -1.930

  No H/Q in entry =           6
  In of MODEL   13
    1    H    VAL   7           H        VAL   7  14.958 -17.508  -3.836
    2    HA   VAL   7           HA       VAL   7  16.674 -15.406  -2.968
    3    HB   VAL   7           HB       VAL   7  14.968 -15.745  -5.449
    4   HG11  VAL   7          HG11      VAL   7  16.893 -13.560  -4.634
    5   HG13  VAL   7          HG12      VAL   7  15.254 -13.393  -5.261
    6   HG12  VAL   7          HG13      VAL   7  16.558 -13.916  -6.328
    7   HG21  VAL   7          HG21      VAL   7  17.052 -17.233  -4.875
    8   HG23  VAL   7          HG22      VAL   7  17.980 -15.786  -5.272
    9   HG22  VAL   7          HG23      VAL   7  16.935 -16.520  -6.485

  No H/Q in entry =           9
  In of MODEL   13
    1    H    VAL   8           H        VAL   8  13.179 -15.624  -3.532
    2    HA   VAL   8           HA       VAL   8  12.553 -12.906  -3.063
    3    HB   VAL   8           HB       VAL   8  10.902 -15.410  -2.631
    4   HG13  VAL   8          HG11      VAL   8   9.818 -13.809  -1.297
    5   HG12  VAL   8          HG12      VAL   8   9.006 -13.622  -2.852
    6   HG11  VAL   8          HG13      VAL   8  10.257 -12.479  -2.368
    7   HG21  VAL   8          HG21      VAL   8  11.805 -14.351  -5.007
    8   HG23  VAL   8          HG22      VAL   8  10.284 -13.486  -4.809
    9   HG22  VAL   8          HG23      VAL   8  10.296 -15.247  -4.850

  No H/Q in entry =           9
  In of MODEL   13
    1    H    MET   9           H        MET   9  12.774 -15.714  -0.882
    2    HA   MET   9           HA       MET   9  11.972 -14.430   1.486
    3    HB2  MET   9           HB2      MET   9  13.839 -16.736   0.945
    4    HB3  MET   9           HB3      MET   9  13.560 -16.147   2.584
    5    HG2  MET   9           HG2      MET   9  11.128 -16.486   2.288
    6    HG3  MET   9           HG3      MET   9  11.421 -17.102   0.660
    7    HE3  MET   9           HE1      MET   9  12.609 -18.908   4.675
    8    HE2  MET   9           HE2      MET   9  10.990 -18.272   4.396
    9    HE1  MET   9           HE3      MET   9  12.386 -17.211   4.235

  No H/Q in entry =           9
  In of MODEL   13
    1    H    GLY  10           H        GLY  10  15.153 -14.701  -0.063
    2    HA3  GLY  10           HA2      GLY  10  16.628 -13.300   1.909
    3    HA2  GLY  10           HA3      GLY  10  17.092 -13.473   0.217

  No H/Q in entry =           3
  In of MODEL   13
    1    H    LEU  11           H        LEU  11  14.944 -12.222  -1.028
    2    HA   LEU  11           HA       LEU  11  15.667  -9.487  -0.864
    3    HB2  LEU  11           HB2      LEU  11  13.283 -10.864  -2.104
    4    HB3  LEU  11           HB3      LEU  11  13.588  -9.133  -2.263
    5    HG   LEU  11           HG       LEU  11  15.587 -11.270  -3.046
    6   HD13  LEU  11          HD11      LEU  11  13.840 -11.613  -4.569
    7   HD12  LEU  11          HD12      LEU  11  14.861 -10.446  -5.408
    8   HD11  LEU  11          HD13      LEU  11  13.393  -9.907  -4.593
    9   HD22  LEU  11          HD21      LEU  11  16.845  -9.324  -2.818
   10   HD21  LEU  11          HD22      LEU  11  15.486  -8.268  -3.200
   11   HD23  LEU  11          HD23      LEU  11  16.307  -9.149  -4.487

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  12           H        ILE  12  12.871 -11.274   0.398
    2    HA   ILE  12           HA       ILE  12  11.505  -9.031   1.454
    3    HB   ILE  12           HB       ILE  12  11.501 -11.912   2.405
    4   HG12  ILE  12          HG12      ILE  12  10.830 -11.275  -0.045
    5   HG13  ILE  12          HG13      ILE  12   9.784 -12.347   0.865
    6   HG21  ILE  12          HG21      ILE  12   9.611  -9.605   2.967
    7   HG23  ILE  12          HG22      ILE  12  10.562 -10.514   4.142
    8   HG22  ILE  12          HG23      ILE  12   9.220 -11.291   3.302
    9   HD11  ILE  12          HD11      ILE  12   9.403  -9.350   0.642
   10   HD13  ILE  12          HD12      ILE  12   8.287 -10.508   1.364
   11   HD12  ILE  12          HD13      ILE  12   8.577 -10.529  -0.362

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  13           H        ILE  13  13.866 -11.266   2.866
    2    HA   ILE  13           HA       ILE  13  13.911 -10.086   5.446
    3    HB   ILE  13           HB       ILE  13  15.952 -11.688   3.884
    4   HG12  ILE  13          HG12      ILE  13  13.657 -12.614   4.738
    5   HG13  ILE  13          HG13      ILE  13  15.118 -13.565   4.984
    6   HG22  ILE  13          HG21      ILE  13  17.019 -12.048   6.181
    7   HG21  ILE  13          HG22      ILE  13  16.084 -10.666   6.737
    8   HG23  ILE  13          HG23      ILE  13  17.279 -10.463   5.455
    9   HD12  ILE  13          HD11      ILE  13  13.607 -13.361   7.034
   10   HD11  ILE  13          HD12      ILE  13  14.027 -11.652   7.062
   11   HD13  ILE  13          HD13      ILE  13  15.280 -12.866   7.283

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ASN  14           H        ASN  14  15.878  -9.581   2.532
    2    HA   ASN  14           HA       ASN  14  17.643  -7.661   3.596
    3    HB2  ASN  14           HB2      ASN  14  17.611  -8.928   1.281
    4    HB3  ASN  14           HB3      ASN  14  16.736  -7.500   0.742
    5   HD21  ASN  14          HD21      ASN  14  19.175  -7.870  -0.438
    6   HD22  ASN  14          HD22      ASN  14  20.329  -6.800   0.191

  No H/Q in entry =           6
  In of MODEL   13
    1    H    SER  15           H        SER  15  14.541  -7.277   1.897
    2    HA   SER  15           HA       SER  15  14.461  -4.456   1.951
    3    HB2  SER  15           HB2      SER  15  12.124  -4.676   1.456
    4    HB3  SER  15           HB3      SER  15  12.910  -6.045   0.679
    5    HG   SER  15           HG       SER  15  11.084  -5.997   2.686

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLY  16           H        GLY  16  13.334  -6.902   4.254
    2    HA3  GLY  16           HA2      GLY  16  12.128  -5.138   6.107
    3    HA2  GLY  16           HA3      GLY  16  12.724  -6.753   6.471

  No H/Q in entry =           3
  In of MODEL   13
    1    H    GLN  17           H        GLN  17  15.440  -6.451   5.886
    2    HA   GLN  17           HA       GLN  17  16.404  -5.240   8.268
    3    HB2  GLN  17           HB2      GLN  17  17.812  -6.122   5.735
    4    HB3  GLN  17           HB3      GLN  17  18.671  -5.508   7.149
    5    HG2  GLN  17           HG2      GLN  17  17.765  -7.287   8.534
    6    HG3  GLN  17           HG3      GLN  17  16.753  -7.854   7.208
    7   HE21  GLN  17          HE21      GLN  17  19.058  -9.221   8.696
    8   HE22  GLN  17          HE22      GLN  17  20.118  -9.706   7.463

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ALA  18           H        ALA  18  16.236  -4.162   4.907
    2    HA   ALA  18           HA       ALA  18  17.698  -1.785   5.137
    3    HB1  ALA  18           HB1      ALA  18  16.572  -2.988   3.067
    4    HB3  ALA  18           HB2      ALA  18  16.856  -1.248   3.051
    5    HB2  ALA  18           HB3      ALA  18  15.248  -1.876   3.417

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ARG  19           H        ARG  19  14.191  -2.334   5.525
    2    HA   ARG  19           HA       ARG  19  13.549   0.323   6.237
    3    HB2  ARG  19           HB2      ARG  19  11.851  -1.410   5.647
    4    HB3  ARG  19           HB3      ARG  19  12.180  -2.211   7.185
    5    HG2  ARG  19           HG2      ARG  19  11.488  -0.212   8.421
    6    HG3  ARG  19           HG3      ARG  19  11.251   0.666   6.912
    7    HD2  ARG  19           HD2      ARG  19   9.099  -0.106   7.726
    8    HD3  ARG  19           HD3      ARG  19   9.513  -0.991   6.252
    9    HE   ARG  19           HE       ARG  19  10.449  -2.543   8.360
   10   HH21  ARG  19          HH11      ARG  19   9.180  -4.169   9.296
   11   HH22  ARG  19          HH12      ARG  19   7.461  -4.123   9.121
   12   HH11  ARG  19          HH21      ARG  19   7.472  -1.218   7.257
   13   HH12  ARG  19          HH22      ARG  19   6.494  -2.453   7.962

  No H/Q in entry =          13
  In of MODEL   13
    1    H    SER  20           H        SER  20  14.371  -2.515   8.200
    2    HA   SER  20           HA       SER  20  14.093  -1.412  10.735
    3    HB2  SER  20           HB2      SER  20  14.535  -3.740  10.620
    4    HB3  SER  20           HB3      SER  20  15.989  -3.496   9.656
    5    HG   SER  20           HG       SER  20  15.546  -3.089  12.398

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU  21           H        LEU  21  16.943  -1.382   8.607
    2    HA   LEU  21           HA       LEU  21  18.628   0.087  10.349
    3    HB2  LEU  21           HB2      LEU  21  18.612  -0.185   7.335
    4    HB3  LEU  21           HB3      LEU  21  19.874   0.660   8.228
    5    HG   LEU  21           HG       LEU  21  19.099  -2.223   8.761
    6   HD11  LEU  21          HD11      LEU  21  21.308  -1.075   7.031
    7   HD13  LEU  21          HD12      LEU  21  19.959  -2.074   6.494
    8   HD12  LEU  21          HD13      LEU  21  21.210  -2.766   7.524
    9   HD21  LEU  21          HD21      LEU  21  21.215  -0.344   9.783
   10   HD23  LEU  21          HD22      LEU  21  21.608  -2.055   9.666
   11   HD22  LEU  21          HD23      LEU  21  20.271  -1.532  10.677

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ALA  22           H        ALA  22  16.382   1.079   7.787
    2    HA   ALA  22           HA       ALA  22  16.951   3.831   7.801
    3    HB3  ALA  22           HB1      ALA  22  15.539   2.604   6.119
    4    HB2  ALA  22           HB2      ALA  22  14.848   4.124   6.683
    5    HB1  ALA  22           HB3      ALA  22  14.239   2.592   7.310

  No H/Q in entry =           5
  In of MODEL   13
    1    H    TYR  23           H        TYR  23  14.429   2.044   9.630
    2    HA   TYR  23           HA       TYR  23  13.487   4.292  11.075
    3    HB2  TYR  23           HB2      TYR  23  12.230   2.191  11.051
    4    HB3  TYR  23           HB3      TYR  23  13.549   1.368  11.882
    5    HD1  TYR  23           HD1      TYR  23  11.076   4.140  12.234
    6    HD2  TYR  23           HD2      TYR  23  13.734   1.427  14.239
    7    HE1  TYR  23           HE1      TYR  23  10.147   4.847  14.423
    8    HE2  TYR  23           HE2      TYR  23  12.805   2.132  16.427
    9    HH   TYR  23           HH       TYR  23  11.631   4.041  17.394

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ALA  24           H        ALA  24  16.105   1.987  11.721
    2    HA   ALA  24           HA       ALA  24  16.779   2.976  14.286
    3    HB1  ALA  24           HB1      ALA  24  18.116   1.168  14.126
    4    HB3  ALA  24           HB2      ALA  24  19.157   2.077  13.029
    5    HB2  ALA  24           HB3      ALA  24  17.853   1.083  12.385

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA  25           H        ALA  25  17.756   3.893  11.009
    2    HA   ALA  25           HA       ALA  25  19.721   5.805  11.660
    3    HB1  ALA  25           HB1      ALA  25  19.000   4.864   9.343
    4    HB3  ALA  25           HB2      ALA  25  19.521   6.546   9.437
    5    HB2  ALA  25           HB3      ALA  25  17.802   6.159   9.363

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU  26           H        LEU  26  16.210   6.074  11.288
    2    HA   LEU  26           HA       LEU  26  16.017   8.859  11.738
    3    HB2  LEU  26           HB2      LEU  26  14.144   7.645  10.805
    4    HB3  LEU  26           HB3      LEU  26  14.037   6.619  12.230
    5    HG   LEU  26           HG       LEU  26  13.450   8.584  13.608
    6   HD12  LEU  26          HD11      LEU  26  12.818  10.692  12.280
    7   HD11  LEU  26          HD12      LEU  26  13.795  10.027  10.974
    8   HD13  LEU  26          HD13      LEU  26  14.539  10.403  12.528
    9   HD21  LEU  26          HD21      LEU  26  11.778   8.290  11.094
   10   HD23  LEU  26          HD22      LEU  26  11.222   8.994  12.609
   11   HD22  LEU  26          HD23      LEU  26  11.654   7.288  12.540

  No H/Q in entry =          11
  In of MODEL   13
    1    H    LYS  27           H        LYS  27  15.870   6.082  13.932
    2    HA   LYS  27           HA       LYS  27  15.287   7.455  16.298
    3    HB2  LYS  27           HB2      LYS  27  15.286   4.980  16.033
    4    HB3  LYS  27           HB3      LYS  27  17.050   5.011  15.995
    5    HG2  LYS  27           HG2      LYS  27  17.105   5.997  18.245
    6    HG3  LYS  27           HG3      LYS  27  15.338   6.037  18.285
    7    HD2  LYS  27           HD2      LYS  27  15.283   3.570  18.049
    8    HD3  LYS  27           HD3      LYS  27  17.048   3.538  18.042
    9    HE2  LYS  27           HE2      LYS  27  17.088   4.527  20.299
   10    HE3  LYS  27           HE3      LYS  27  15.323   4.589  20.308
   11    HZ3  LYS  27           HZ1      LYS  27  16.083   2.627  21.462
   12    HZ2  LYS  27           HZ2      LYS  27  16.997   2.137  20.114
   13    HZ1  LYS  27           HZ3      LYS  27  15.300   2.163  20.029

  No H/Q in entry =          13
  In of MODEL   13
    1    H    GLN  28           H        GLN  28  18.400   6.834  14.715
    2    HA   GLN  28           HA       GLN  28  20.092   7.896  16.710
    3    HB2  GLN  28           HB2      GLN  28  20.390   7.852  13.695
    4    HB3  GLN  28           HB3      GLN  28  21.679   8.298  14.813
    5    HG2  GLN  28           HG2      GLN  28  20.215   5.644  14.842
    6    HG3  GLN  28           HG3      GLN  28  21.803   5.906  14.124
    7   HE21  GLN  28          HE21      GLN  28  20.511   4.601  16.818
    8   HE22  GLN  28          HE22      GLN  28  21.703   5.001  17.957

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ALA  29           H        ALA  29  18.367   9.401  14.012
    2    HA   ALA  29           HA       ALA  29  19.400  12.008  14.267
    3    HB2  ALA  29           HB1      ALA  29  17.714  12.667  12.791
    4    HB1  ALA  29           HB2      ALA  29  16.553  11.509  13.439
    5    HB3  ALA  29           HB3      ALA  29  17.879  10.949  12.420

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LYS  30           H        LYS  30  16.598  10.446  15.781
    2    HA   LYS  30           HA       LYS  30  15.610  12.714  17.134
    3    HB2  LYS  30           HB2      LYS  30  15.457   9.775  17.839
    4    HB3  LYS  30           HB3      LYS  30  14.605  11.037  18.729
    5    HG2  LYS  30           HG2      LYS  30  13.496  11.738  16.608
    6    HG3  LYS  30           HG3      LYS  30  14.285  10.390  15.783
    7    HD2  LYS  30           HD2      LYS  30  13.186   8.798  17.309
    8    HD3  LYS  30           HD3      LYS  30  12.408  10.134  18.158
    9    HE2  LYS  30           HE2      LYS  30  11.254  10.783  16.062
   10    HE3  LYS  30           HE3      LYS  30  12.012   9.418  15.233
   11    HZ2  LYS  30           HZ1      LYS  30   9.696   9.041  16.107
   12    HZ1  LYS  30           HZ2      LYS  30  10.360   9.085  17.676
   13    HZ3  LYS  30           HZ3      LYS  30  10.855   7.893  16.567

  No H/Q in entry =          13
  In of MODEL   13
    1    H    GLN  31           H        GLN  31  18.239  10.508  17.879
    2    HA   GLN  31           HA       GLN  31  18.573  11.518  20.574
    3    HB2  GLN  31           HB2      GLN  31  20.578   9.919  18.976
    4    HB3  GLN  31           HB3      GLN  31  20.441  10.045  20.730
    5    HG2  GLN  31           HG2      GLN  31  17.916   9.128  19.954
    6    HG3  GLN  31           HG3      GLN  31  19.009   8.268  18.877
    7   HE21  GLN  31          HE21      GLN  31  17.444   7.144  21.149
    8   HE22  GLN  31          HE22      GLN  31  18.587   6.467  22.203

  No H/Q in entry =           8
  In of MODEL   13
    1    H    GLY  32           H        GLY  32  19.119  12.827  17.609
    2    HA3  GLY  32           HA2      GLY  32  20.133  14.858  17.097
    3    HA2  GLY  32           HA3      GLY  32  20.886  14.853  18.687

  No H/Q in entry =           3
  In of MODEL   13
    1    H    ASP  33           H        ASP  33  21.272  11.954  16.912
    2    HA   ASP  33           HA       ASP  33  24.108  12.590  16.454
    3    HB2  ASP  33           HB2      ASP  33  22.563   9.995  16.566
    4    HB3  ASP  33           HB3      ASP  33  24.252  10.088  16.076

  No H/Q in entry =           4
  In of MODEL   13
    1    H    PHE  34           H        PHE  34  23.651  13.919  14.571
    2    HA   PHE  34           HA       PHE  34  22.294  12.954  12.280
    3    HB2  PHE  34           HB2      PHE  34  24.454  15.058  12.515
    4    HB3  PHE  34           HB3      PHE  34  23.469  14.781  11.081
    5    HD1  PHE  34           HD1      PHE  34  23.738  16.712  13.995
    6    HD2  PHE  34           HD2      PHE  34  20.838  14.636  11.602
    7    HE1  PHE  34           HE1      PHE  34  21.939  18.135  14.937
    8    HE2  PHE  34           HE2      PHE  34  19.043  16.059  12.546
    9    HZ   PHE  34           HZ       PHE  34  19.596  17.809  14.210

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ALA  35           H        ALA  35  25.663  12.720  13.297
    2    HA   ALA  35           HA       ALA  35  26.764  11.884  10.843
    3    HB3  ALA  35           HB1      ALA  35  28.423  10.691  12.568
    4    HB2  ALA  35           HB2      ALA  35  27.571  11.729  13.711
    5    HB1  ALA  35           HB3      ALA  35  28.421  12.440  12.340

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA  36           H        ALA  36  25.614   9.943  13.606
    2    HA   ALA  36           HA       ALA  36  26.068   7.449  12.332
    3    HB2  ALA  36           HB1      ALA  36  25.622   6.709  14.406
    4    HB3  ALA  36           HB2      ALA  36  23.941   7.226  14.252
    5    HB1  ALA  36           HB3      ALA  36  25.156   8.342  14.878

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA  37           H        ALA  37  23.275   9.612  12.458
    2    HA   ALA  37           HA       ALA  37  21.399   7.867  11.277
    3    HB3  ALA  37           HB1      ALA  37  21.662  10.827  11.569
    4    HB1  ALA  37           HB2      ALA  37  20.335   9.766  12.038
    5    HB2  ALA  37           HB3      ALA  37  20.535  10.235  10.349

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LYS  38           H        LYS  38  23.534  10.301   9.804
    2    HA   LYS  38           HA       LYS  38  22.896   9.881   7.124
    3    HB2  LYS  38           HB2      LYS  38  24.722  11.415   8.574
    4    HB3  LYS  38           HB3      LYS  38  25.745  10.412   7.552
    5    HG2  LYS  38           HG2      LYS  38  24.596  11.197   5.552
    6    HG3  LYS  38           HG3      LYS  38  23.410  12.067   6.530
    7    HD2  LYS  38           HD2      LYS  38  25.023  13.645   7.286
    8    HD3  LYS  38           HD3      LYS  38  26.372  12.642   6.755
    9    HE2  LYS  38           HE2      LYS  38  26.043  14.517   5.202
   10    HE3  LYS  38           HE3      LYS  38  25.691  12.984   4.397
   11    HZ3  LYS  38           HZ1      LYS  38  23.500  13.456   4.261
   12    HZ2  LYS  38           HZ2      LYS  38  24.042  15.064   4.349
   13    HZ1  LYS  38           HZ3      LYS  38  23.455  14.288   5.740

  No H/Q in entry =          13
  In of MODEL   13
    1    H    ALA  39           H        ALA  39  25.385   8.252   9.088
    2    HA   ALA  39           HA       ALA  39  26.440   6.650   7.021
    3    HB2  ALA  39           HB1      ALA  39  26.332   5.688   9.865
    4    HB1  ALA  39           HB2      ALA  39  27.303   7.102   9.451
    5    HB3  ALA  39           HB3      ALA  39  27.638   5.547   8.689

  No H/Q in entry =           5
  In of MODEL   13
    1    H    MET  40           H        MET  40  23.814   6.067   9.313
    2    HA   MET  40           HA       MET  40  23.340   3.367   8.577
    3    HB2  MET  40           HB2      MET  40  21.545   5.433   9.864
    4    HB3  MET  40           HB3      MET  40  21.118   3.729   9.689
    5    HG2  MET  40           HG2      MET  40  23.675   4.639  11.037
    6    HG3  MET  40           HG3      MET  40  22.175   4.382  11.926
    7    HE3  MET  40           HE1      MET  40  21.567   0.755  12.100
    8    HE2  MET  40           HE2      MET  40  20.716   2.068  11.290
    9    HE1  MET  40           HE3      MET  40  21.456   2.347  12.865

  No H/Q in entry =           9
  In of MODEL   13
    1    H    MET  41           H        MET  41  21.966   6.437   7.386
    2    HA   MET  41           HA       MET  41  19.999   5.265   5.709
    3    HB2  MET  41           HB2      MET  41  21.512   7.837   5.199
    4    HB3  MET  41           HB3      MET  41  19.980   7.361   4.477
    5    HG2  MET  41           HG2      MET  41  19.225   7.182   7.026
    6    HG3  MET  41           HG3      MET  41  20.547   8.324   7.251
    7    HE2  MET  41           HE1      MET  41  20.009   9.618   3.913
    8    HE1  MET  41           HE2      MET  41  20.967  10.047   5.327
    9    HE3  MET  41           HE3      MET  41  19.708  11.141   4.759

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ASP  42           H        ASP  42  23.384   6.148   5.165
    2    HA   ASP  42           HA       ASP  42  23.477   5.672   2.407
    3    HB2  ASP  42           HB2      ASP  42  25.235   6.650   4.181
    4    HB3  ASP  42           HB3      ASP  42  25.874   5.016   4.056

  No H/Q in entry =           4
  In of MODEL   13
    1    H    GLN  43           H        GLN  43  24.169   3.510   5.130
    2    HA   GLN  43           HA       GLN  43  24.811   1.244   3.549
    3    HB2  GLN  43           HB2      GLN  43  23.783   1.440   6.390
    4    HB3  GLN  43           HB3      GLN  43  24.347  -0.056   5.637
    5    HG2  GLN  43           HG2      GLN  43  26.526   1.130   5.132
    6    HG3  GLN  43           HG3      GLN  43  25.956   2.464   6.129
    7   HE21  GLN  43          HE21      GLN  43  28.175   1.465   7.172
    8   HE22  GLN  43          HE22      GLN  43  27.884   0.386   8.448

  No H/Q in entry =           8
  In of MODEL   13
    1    H    SER  44           H        SER  44  21.765   2.414   4.926
    2    HA   SER  44           HA       SER  44  20.172   0.189   4.250
    3    HB2  SER  44           HB2      SER  44  19.757   2.723   5.394
    4    HB3  SER  44           HB3      SER  44  18.726   2.692   3.966
    5    HG   SER  44           HG       SER  44  17.617   1.761   5.686

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ARG  45           H        ARG  45  20.954   3.144   2.446
    2    HA   ARG  45           HA       ARG  45  19.430   2.676   0.138
    3    HB2  ARG  45           HB2      ARG  45  20.597   4.799   0.725
    4    HB3  ARG  45           HB3      ARG  45  22.133   4.026   0.343
    5    HG2  ARG  45           HG2      ARG  45  21.351   3.629  -1.973
    6    HG3  ARG  45           HG3      ARG  45  19.827   4.425  -1.590
    7    HD2  ARG  45           HD2      ARG  45  21.101   6.507  -1.003
    8    HD3  ARG  45           HD3      ARG  45  22.589   5.715  -1.568
    9    HE   ARG  45           HE       ARG  45  20.661   5.500  -3.609
   10   HH21  ARG  45          HH11      ARG  45  20.675   6.869  -5.372
   11   HH22  ARG  45          HH12      ARG  45  21.450   8.410  -5.266
   12   HH11  ARG  45          HH21      ARG  45  22.417   7.978  -1.978
   13   HH12  ARG  45          HH22      ARG  45  22.436   9.037  -3.342

  No H/Q in entry =          13
  In of MODEL   13
    1    H    MET  46           H        MET  46  22.781   1.761   0.894
    2    HA   MET  46           HA       MET  46  23.378   0.560  -1.589
    3    HB2  MET  46           HB2      MET  46  24.474   0.208   1.203
    4    HB3  MET  46           HB3      MET  46  25.128  -0.673  -0.181
    5    HG2  MET  46           HG2      MET  46  25.564   1.458  -1.343
    6    HG3  MET  46           HG3      MET  46  24.899   2.346   0.022
    7    HE2  MET  46           HE1      MET  46  28.412   3.360   0.774
    8    HE1  MET  46           HE2      MET  46  26.764   3.775   0.315
    9    HE3  MET  46           HE3      MET  46  27.873   3.134  -0.896

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ALA  47           H        ALA  47  21.972  -0.755   1.384
    2    HA   ALA  47           HA       ALA  47  21.887  -3.467   0.582
    3    HB2  ALA  47           HB1      ALA  47  21.509  -3.001   2.886
    4    HB3  ALA  47           HB2      ALA  47  19.966  -3.585   2.264
    5    HB1  ALA  47           HB3      ALA  47  20.217  -1.857   2.522

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU  48           H        LEU  48  19.568  -0.811   0.220
    2    HA   LEU  48           HA       LEU  48  17.506  -2.318  -1.035
    3    HB2  LEU  48           HB2      LEU  48  18.199   0.627  -1.149
    4    HB3  LEU  48           HB3      LEU  48  16.720  -0.064  -1.818
    5    HG   LEU  48           HG       LEU  48  17.564  -0.376   1.072
    6   HD13  LEU  48          HD11      LEU  48  17.176   1.930   0.883
    7   HD12  LEU  48          HD12      LEU  48  15.609   1.303   1.390
    8   HD11  LEU  48          HD13      LEU  48  15.888   1.721  -0.301
    9   HD22  LEU  48          HD21      LEU  48  16.014  -2.071   0.689
   10   HD21  LEU  48          HD22      LEU  48  15.154  -1.157  -0.551
   11   HD23  LEU  48          HD23      LEU  48  14.944  -0.749   1.152

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ASN  49           H        ASN  49  20.221  -0.426  -2.261
    2    HA   ASN  49           HA       ASN  49  19.574  -0.502  -4.986
    3    HB2  ASN  49           HB2      ASN  49  21.267   0.998  -4.087
    4    HB3  ASN  49           HB3      ASN  49  22.271  -0.366  -3.609
    5   HD21  ASN  49          HD21      ASN  49  21.274   1.628  -6.305
    6   HD22  ASN  49          HD22      ASN  49  22.334   0.951  -7.444

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLU  50           H        GLU  50  21.526  -2.722  -3.019
    2    HA   GLU  50           HA       GLU  50  22.207  -4.488  -5.143
    3    HB2  GLU  50           HB2      GLU  50  23.402  -4.477  -2.975
    4    HB3  GLU  50           HB3      GLU  50  21.950  -5.085  -2.181
    5    HG2  GLU  50           HG2      GLU  50  22.015  -7.120  -3.538
    6    HG3  GLU  50           HG3      GLU  50  23.400  -6.507  -4.438

  No H/Q in entry =           6
  In of MODEL   13
    1    H    ALA  51           H        ALA  51  19.549  -4.386  -2.821
    2    HA   ALA  51           HA       ALA  51  18.351  -6.844  -3.578
    3    HB3  ALA  51           HB1      ALA  51  16.763  -6.316  -2.026
    4    HB1  ALA  51           HB2      ALA  51  16.573  -4.667  -2.626
    5    HB2  ALA  51           HB3      ALA  51  17.925  -5.070  -1.567

  No H/Q in entry =           5
  In of MODEL   13
    1    H    HIS  52           H        HIS  52  17.811  -3.489  -4.617
    2    HA   HIS  52           HA       HIS  52  15.693  -3.989  -6.419
    3    HB2  HIS  52           HB2      HIS  52  16.379  -1.732  -5.615
    4    HB3  HIS  52           HB3      HIS  52  17.825  -1.848  -6.617
    5    HD1  HIS  52           HD1      HIS  52  17.480  -1.851  -9.224
    6    HD2  HIS  52           HD2      HIS  52  13.998  -1.178  -7.030
    7    HE1  HIS  52           HE1      HIS  52  15.755  -0.983 -10.864
    8    HE2  HIS  52           HE2      HIS  52  13.628  -0.567  -9.541

  No H/Q in entry =           8
  In of MODEL   13
    1    H    LEU  53           H        LEU  53  19.212  -4.041  -6.847
    2    HA   LEU  53           HA       LEU  53  19.269  -4.360  -9.647
    3    HB2  LEU  53           HB2      LEU  53  21.188  -5.139  -7.467
    4    HB3  LEU  53           HB3      LEU  53  21.502  -5.542  -9.154
    5    HG   LEU  53           HG       LEU  53  20.872  -2.717  -8.237
    6   HD11  LEU  53          HD11      LEU  53  22.924  -3.522  -7.119
    7   HD13  LEU  53          HD12      LEU  53  23.300  -2.305  -8.338
    8   HD12  LEU  53          HD13      LEU  53  23.579  -4.009  -8.679
    9   HD22  LEU  53          HD21      LEU  53  20.603  -2.781 -10.579
   10   HD21  LEU  53          HD22      LEU  53  21.866  -3.991 -10.783
   11   HD23  LEU  53          HD23      LEU  53  22.297  -2.329 -10.431

  No H/Q in entry =          11
  In of MODEL   13
    1    H    VAL  54           H        VAL  54  19.122  -6.743  -7.019
    2    HA   VAL  54           HA       VAL  54  19.218  -9.040  -8.676
    3    HB   VAL  54           HB       VAL  54  18.065  -8.599  -5.911
    4   HG12  VAL  54          HG11      VAL  54  18.356 -11.221  -5.903
    5   HG11  VAL  54          HG12      VAL  54  18.175 -11.052  -7.649
    6   HG13  VAL  54          HG13      VAL  54  16.892 -10.503  -6.573
    7   HG22  VAL  54          HG21      VAL  54  20.383  -8.418  -5.685
    8   HG21  VAL  54          HG22      VAL  54  20.708  -9.515  -7.025
    9   HG23  VAL  54          HG23      VAL  54  20.168 -10.154  -5.472

  No H/Q in entry =           9
  In of MODEL   13
    1    H    GLN  55           H        GLN  55  16.512  -7.102  -7.399
    2    HA   GLN  55           HA       GLN  55  14.472  -8.741  -8.474
    3    HB2  GLN  55           HB2      GLN  55  13.740  -7.204  -6.849
    4    HB3  GLN  55           HB3      GLN  55  14.552  -5.847  -7.626
    5    HG2  GLN  55           HG2      GLN  55  12.833  -5.503  -9.118
    6    HG3  GLN  55           HG3      GLN  55  12.490  -7.219  -9.287
    7   HE21  GLN  55          HE21      GLN  55  10.476  -7.743  -8.484
    8   HE22  GLN  55          HE22      GLN  55   9.710  -6.977  -7.177

  No H/Q in entry =           8
  In of MODEL   13
    1    H    THR  56           H        THR  56  16.248  -5.965  -9.834
    2    HA   THR  56           HA       THR  56  14.817  -5.588 -12.184
    3    HB   THR  56           HB       THR  56  17.837  -5.536 -12.017
    4    HG1  THR  56           HG1      THR  56  16.993  -3.165 -11.613
    5   HG21  THR  56          HG21      THR  56  15.818  -3.997 -13.673
    6   HG23  THR  56          HG22      THR  56  16.913  -5.248 -14.264
    7   HG22  THR  56          HG23      THR  56  17.560  -3.715 -13.678

  No H/Q in entry =           7
  In of MODEL   13
    1    H    LYS  57           H        LYS  57  17.438  -7.916 -11.567
    2    HA   LYS  57           HA       LYS  57  17.427  -9.114 -14.144
    3    HB2  LYS  57           HB2      LYS  57  19.210  -9.384 -12.390
    4    HB3  LYS  57           HB3      LYS  57  18.092 -10.373 -11.461
    5    HG2  LYS  57           HG2      LYS  57  17.980 -12.008 -13.279
    6    HG3  LYS  57           HG3      LYS  57  19.041 -11.013 -14.270
    7    HD2  LYS  57           HD2      LYS  57  20.840 -11.263 -12.585
    8    HD3  LYS  57           HD3      LYS  57  19.785 -12.294 -11.619
    9    HE2  LYS  57           HE2      LYS  57  19.641 -13.912 -13.483
   10    HE3  LYS  57           HE3      LYS  57  20.690 -12.891 -14.466
   11    HZ3  LYS  57           HZ1      LYS  57  22.473 -13.210 -12.964
   12    HZ2  LYS  57           HZ2      LYS  57  21.829 -14.745 -13.301
   13    HZ1  LYS  57           HZ3      LYS  57  21.478 -13.981 -11.826

  No H/Q in entry =          13
  In of MODEL   13
    1    H    LEU  58           H        LEU  58  15.635  -9.756 -11.170
    2    HA   LEU  58           HA       LEU  58  14.386 -12.116 -12.103
    3    HB2  LEU  58           HB2      LEU  58  13.612 -10.199  -9.911
    4    HB3  LEU  58           HB3      LEU  58  12.787 -11.727 -10.226
    5    HG   LEU  58           HG       LEU  58  15.763 -11.483  -9.668
    6   HD11  LEU  58          HD11      LEU  58  13.385 -11.871  -7.878
    7   HD13  LEU  58          HD12      LEU  58  14.849 -10.924  -7.615
    8   HD12  LEU  58          HD13      LEU  58  14.901 -12.681  -7.477
    9   HD22  LEU  58          HD21      LEU  58  15.622 -13.545 -10.693
   10   HD21  LEU  58          HD22      LEU  58  13.905 -13.734 -10.334
   11   HD23  LEU  58          HD23      LEU  58  15.109 -14.047  -9.083

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  59           H        ILE  59  13.755  -8.772 -12.791
    2    HA   ILE  59           HA       ILE  59  11.033  -9.390 -13.733
    3    HB   ILE  59           HB       ILE  59  11.858  -7.117 -12.528
    4   HG12  ILE  59          HG12      ILE  59   9.972  -6.961 -14.889
    5   HG13  ILE  59          HG13      ILE  59   9.530  -7.740 -13.391
    6   HG21  ILE  59          HG21      ILE  59  13.421  -6.735 -14.571
    7   HG23  ILE  59          HG22      ILE  59  12.450  -5.387 -14.027
    8   HG22  ILE  59          HG23      ILE  59  11.962  -6.321 -15.438
    9   HD13  ILE  59          HD11      ILE  59   9.992  -5.669 -12.145
   10   HD12  ILE  59          HD12      ILE  59   8.781  -5.395 -13.397
   11   HD11  ILE  59          HD13      ILE  59  10.447  -4.873 -13.654

  No H/Q in entry =          11
  In of MODEL   13
    1    H    GLU  60           H        GLU  60  14.248  -8.578 -14.989
    2    HA   GLU  60           HA       GLU  60  13.476  -8.172 -17.698
    3    HB2  GLU  60           HB2      GLU  60  15.661  -7.460 -16.853
    4    HB3  GLU  60           HB3      GLU  60  16.104  -9.134 -16.535
    5    HG2  GLU  60           HG2      GLU  60  15.937  -9.655 -18.935
    6    HG3  GLU  60           HG3      GLU  60  15.452  -7.994 -19.269

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLY  61           H        GLY  61  14.418 -11.062 -15.878
    2    HA3  GLY  61           HA2      GLY  61  13.860 -12.707 -18.278
    3    HA2  GLY  61           HA3      GLY  61  14.885 -13.198 -16.934

  No H/Q in entry =           3
  In of MODEL   13
    1    H    ASP  62           H        ASP  62  11.782 -11.616 -16.568
    2    HA   ASP  62           HA       ASP  62  10.824 -13.550 -14.742
    3    HB2  ASP  62           HB2      ASP  62   8.727 -12.282 -14.855
    4    HB3  ASP  62           HB3      ASP  62  10.114 -11.212 -14.686

  No H/Q in entry =           4
  In of MODEL   13
    1    H    ALA  63           H        ALA  63  11.532 -15.014 -17.057
    2    HA   ALA  63           HA       ALA  63   9.349 -15.596 -18.786
    3    HB2  ALA  63           HB1      ALA  63  11.792 -16.257 -19.085
    4    HB1  ALA  63           HB2      ALA  63  10.608 -17.506 -19.463
    5    HB3  ALA  63           HB3      ALA  63  11.485 -17.559 -17.935

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLY  64           H        GLY  64  10.378 -16.903 -15.681
    2    HA3  GLY  64           HA2      GLY  64   9.352 -18.260 -14.146
    3    HA2  GLY  64           HA3      GLY  64   7.835 -17.649 -14.793

  No H/Q in entry =           3
  In of MODEL   13
    1    H    GLU  65           H        GLU  65   6.594 -19.461 -14.974
    2    HA   GLU  65           HA       GLU  65   7.609 -22.010 -15.638
    3    HB2  GLU  65           HB2      GLU  65   4.791 -20.938 -15.766
    4    HB3  GLU  65           HB3      GLU  65   5.224 -22.638 -15.946
    5    HG2  GLU  65           HG2      GLU  65   5.900 -20.932 -13.535
    6    HG3  GLU  65           HG3      GLU  65   4.556 -22.070 -13.612

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLY  66           H        GLY  66   5.988 -23.106 -17.435
    2    HA3  GLY  66           HA2      GLY  66   7.233 -22.684 -19.910
    3    HA2  GLY  66           HA3      GLY  66   5.797 -23.649 -19.635

  No H/Q in entry =           3
  In of MODEL   13
    1    H    LYS  67           H        LYS  67   4.189 -21.484 -18.655
    2    HA   LYS  67           HA       LYS  67   3.227 -20.501 -21.157
    3    HB2  LYS  67           HB2      LYS  67   2.327 -20.086 -18.311
    4    HB3  LYS  67           HB3      LYS  67   1.470 -19.436 -19.714
    5    HG2  LYS  67           HG2      LYS  67   1.221 -21.680 -20.649
    6    HG3  LYS  67           HG3      LYS  67   2.162 -22.363 -19.326
    7    HD2  LYS  67           HD2      LYS  67  -0.088 -22.759 -18.707
    8    HD3  LYS  67           HD3      LYS  67   0.377 -21.335 -17.772
    9    HE2  LYS  67           HE2      LYS  67  -0.720 -19.857 -19.316
   10    HE3  LYS  67           HE3      LYS  67  -0.970 -21.160 -20.477
   11    HZ1  LYS  67           HZ1      LYS  67  -2.267 -22.257 -18.577
   12    HZ3  LYS  67           HZ2      LYS  67  -3.002 -20.982 -19.425
   13    HZ2  LYS  67           HZ3      LYS  67  -2.316 -20.705 -17.894

  No H/Q in entry =          13
  In of MODEL   13
    1    H    MET  68           H        MET  68   2.419 -18.239 -21.324
    2    HA   MET  68           HA       MET  68   4.565 -16.463 -21.618
    3    HB2  MET  68           HB2      MET  68   1.591 -15.942 -21.603
    4    HB3  MET  68           HB3      MET  68   2.812 -14.806 -22.174
    5    HG2  MET  68           HG2      MET  68   2.400 -17.601 -23.273
    6    HG3  MET  68           HG3      MET  68   1.819 -16.120 -24.036
    7    HE1  MET  68           HE1      MET  68   2.984 -14.357 -24.856
    8    HE3  MET  68           HE2      MET  68   4.660 -14.292 -25.394
    9    HE2  MET  68           HE3      MET  68   4.270 -13.962 -23.708

  No H/Q in entry =           9
  In of MODEL   13
    1    H    LYS  69           H        LYS  69   2.097 -16.598 -19.034
    2    HA   LYS  69           HA       LYS  69   2.361 -14.194 -17.822
    3    HB2  LYS  69           HB2      LYS  69   1.911 -16.935 -16.729
    4    HB3  LYS  69           HB3      LYS  69   2.080 -15.579 -15.612
    5    HG2  LYS  69           HG2      LYS  69  -0.258 -15.747 -16.125
    6    HG3  LYS  69           HG3      LYS  69   0.356 -14.349 -17.008
    7    HD2  LYS  69           HD2      LYS  69   0.500 -15.639 -19.058
    8    HD3  LYS  69           HD3      LYS  69   0.059 -17.118 -18.203
    9    HE2  LYS  69           HE2      LYS  69  -2.132 -16.146 -17.635
   10    HE3  LYS  69           HE3      LYS  69  -1.694 -14.658 -18.473
   11    HZ3  LYS  69           HZ1      LYS  69  -2.937 -15.902 -19.997
   12    HZ2  LYS  69           HZ2      LYS  69  -2.124 -17.347 -19.629
   13    HZ1  LYS  69           HZ3      LYS  69  -1.327 -16.113 -20.482

  No H/Q in entry =          13
  In of MODEL   13
    1    H    VAL  70           H        VAL  70   3.295 -14.288 -15.248
    2    HA   VAL  70           HA       VAL  70   6.229 -14.627 -15.496
    3    HB   VAL  70           HB       VAL  70   6.485 -12.518 -14.217
    4   HG13  VAL  70          HG11      VAL  70   6.607 -12.471 -16.673
    5   HG12  VAL  70          HG12      VAL  70   5.850 -10.995 -16.072
    6   HG11  VAL  70          HG13      VAL  70   4.857 -12.275 -16.767
    7   HG23  VAL  70          HG21      VAL  70   4.341 -11.027 -14.232
    8   HG22  VAL  70          HG22      VAL  70   4.471 -12.278 -12.998
    9   HG21  VAL  70          HG23      VAL  70   3.463 -12.545 -14.419

  No H/Q in entry =           9
  In of MODEL   13
    1    H    SER  71           H        SER  71   7.297 -14.603 -13.327
    2    HA   SER  71           HA       SER  71   6.218 -16.558 -11.593
    3    HB2  SER  71           HB2      SER  71   8.651 -16.013 -11.806
    4    HB3  SER  71           HB3      SER  71   8.347 -14.500 -10.953
    5    HG   SER  71           HG       SER  71   7.708 -17.090  -9.972

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU  72           H        LEU  72   4.835 -16.401  -9.949
    2    HA   LEU  72           HA       LEU  72   3.312 -14.069  -9.509
    3    HB2  LEU  72           HB2      LEU  72   3.566 -16.630  -7.942
    4    HB3  LEU  72           HB3      LEU  72   2.417 -15.359  -7.536
    5    HG   LEU  72           HG       LEU  72   2.551 -16.652 -10.279
    6   HD12  LEU  72          HD11      LEU  72   0.511 -17.244  -8.129
    7   HD11  LEU  72          HD12      LEU  72   1.972 -18.213  -8.316
    8   HD13  LEU  72          HD13      LEU  72   0.802 -18.122  -9.632
    9   HD21  LEU  72          HD21      LEU  72   0.693 -14.728  -8.890
   10   HD23  LEU  72          HD22      LEU  72   0.062 -15.772 -10.154
   11   HD22  LEU  72          HD23      LEU  72   1.356 -14.635 -10.517

  No H/Q in entry =          11
  In of MODEL   13
    1    H    VAL  73           H        VAL  73   5.947 -15.535  -7.730
    2    HA   VAL  73           HA       VAL  73   5.901 -14.000  -5.399
    3    HB   VAL  73           HB       VAL  73   8.080 -14.829  -4.972
    4   HG13  VAL  73          HG11      VAL  73   7.775 -17.171  -5.319
    5   HG12  VAL  73          HG12      VAL  73   6.830 -16.902  -6.784
    6   HG11  VAL  73          HG13      VAL  73   6.153 -16.490  -5.209
    7   HG22  VAL  73          HG21      VAL  73   9.425 -14.308  -6.792
    8   HG21  VAL  73          HG22      VAL  73   8.248 -14.897  -7.963
    9   HG23  VAL  73          HG23      VAL  73   9.217 -16.041  -7.036

  No H/Q in entry =           9
  In of MODEL   13
    1    H    LEU  74           H        LEU  74   6.907 -13.120  -8.574
    2    HA   LEU  74           HA       LEU  74   8.874 -11.194  -8.078
    3    HB2  LEU  74           HB2      LEU  74   8.415 -11.940 -10.317
    4    HB3  LEU  74           HB3      LEU  74   6.756 -11.353 -10.220
    5    HG   LEU  74           HG       LEU  74   7.591  -9.034 -10.001
    6   HD13  LEU  74          HD11      LEU  74   9.708  -9.263  -8.951
    7   HD12  LEU  74          HD12      LEU  74  10.092  -8.768 -10.598
    8   HD11  LEU  74          HD13      LEU  74  10.254 -10.459 -10.125
    9   HD21  LEU  74          HD21      LEU  74   7.317 -10.457 -12.222
   10   HD23  LEU  74          HD22      LEU  74   9.036 -10.152 -12.322
   11   HD22  LEU  74          HD23      LEU  74   7.923  -8.802 -12.260

  No H/Q in entry =          11
  In of MODEL   13
    1    H    VAL  75           H        VAL  75   5.384 -10.768  -8.440
    2    HA   VAL  75           HA       VAL  75   5.320  -8.011  -7.855
    3    HB   VAL  75           HB       VAL  75   3.201 -10.125  -7.463
    4   HG12  VAL  75          HG11      VAL  75   1.649  -8.136  -7.398
    5   HG11  VAL  75          HG12      VAL  75   3.061  -7.092  -7.336
    6   HG13  VAL  75          HG13      VAL  75   2.734  -8.201  -6.013
    7   HG22  VAL  75          HG21      VAL  75   3.932  -9.791  -9.790
    8   HG21  VAL  75          HG22      VAL  75   3.726  -8.050  -9.619
    9   HG23  VAL  75          HG23      VAL  75   2.321  -9.113  -9.564

  No H/Q in entry =           9
  In of MODEL   13
    1    H    GLU  76           H        GLU  76   5.026 -10.883  -5.744
    2    HA   GLU  76           HA       GLU  76   4.566  -9.515  -3.325
    3    HB2  GLU  76           HB2      GLU  76   4.368 -11.984  -3.571
    4    HB3  GLU  76           HB3      GLU  76   6.107 -12.096  -3.782
    5    HG2  GLU  76           HG2      GLU  76   5.629 -12.670  -1.492
    6    HG3  GLU  76           HG3      GLU  76   6.379 -11.085  -1.469

  No H/Q in entry =           6
  In of MODEL   13
    1    H    ALA  77           H        ALA  77   7.619 -10.459  -4.879
    2    HA   ALA  77           HA       ALA  77   9.315  -9.435  -2.859
    3    HB1  ALA  77           HB1      ALA  77   9.950 -10.995  -4.768
    4    HB2  ALA  77           HB2      ALA  77  11.092  -9.697  -4.423
    5    HB3  ALA  77           HB3      ALA  77   9.997  -9.564  -5.798

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLN  78           H        GLN  78   7.949  -8.003  -5.778
    2    HA   GLN  78           HA       GLN  78   9.331  -5.540  -5.672
    3    HB2  GLN  78           HB2      GLN  78   8.030  -6.439  -7.633
    4    HB3  GLN  78           HB3      GLN  78   6.550  -6.045  -6.763
    5    HG2  GLN  78           HG2      GLN  78   7.226  -3.683  -6.668
    6    HG3  GLN  78           HG3      GLN  78   8.714  -4.068  -7.532
    7   HE21  GLN  78          HE21      GLN  78   8.346  -3.077  -9.562
    8   HE22  GLN  78          HE22      GLN  78   7.007  -3.420 -10.549

  No H/Q in entry =           8
  In of MODEL   13
    1    H    LEU  79           H        LEU  79   6.294  -6.640  -4.250
    2    HA   LEU  79           HA       LEU  79   5.327  -4.219  -3.246
    3    HB2  LEU  79           HB2      LEU  79   3.986  -6.254  -3.193
    4    HB3  LEU  79           HB3      LEU  79   5.118  -7.007  -2.074
    5    HG   LEU  79           HG       LEU  79   4.581  -5.357  -0.350
    6   HD13  LEU  79          HD11      LEU  79   4.144  -3.337  -1.403
    7   HD12  LEU  79          HD12      LEU  79   2.511  -3.842  -0.969
    8   HD11  LEU  79          HD13      LEU  79   3.094  -4.073  -2.615
    9   HD23  LEU  79          HD21      LEU  79   1.988  -5.817  -0.268
   10   HD22  LEU  79          HD22      LEU  79   3.110  -7.170  -0.154
   11   HD21  LEU  79          HD23      LEU  79   2.306  -6.824  -1.682

  No H/Q in entry =          11
  In of MODEL   13
    1    H    HIS  80           H        HIS  80   7.474  -6.581  -1.654
    2    HA   HIS  80           HA       HIS  80   7.773  -5.041   0.715
    3    HB2  HIS  80           HB2      HIS  80   9.085  -7.422  -0.477
    4    HB3  HIS  80           HB3      HIS  80  10.003  -6.536   0.742
    5    HD1  HIS  80           HD1      HIS  80   9.496  -7.164   3.084
    6    HD2  HIS  80           HD2      HIS  80   6.278  -7.975   0.560
    7    HE1  HIS  80           HE1      HIS  80   7.705  -8.244   4.526
    8    HE2  HIS  80           HE2      HIS  80   5.737  -8.742   2.996

  No H/Q in entry =           8
  In of MODEL   13
    1    H    LEU  81           H        LEU  81   9.786  -5.345  -2.190
    2    HA   LEU  81           HA       LEU  81  11.849  -3.630  -1.305
    3    HB2  LEU  81           HB2      LEU  81  10.928  -4.413  -4.071
    4    HB3  LEU  81           HB3      LEU  81  12.360  -3.425  -3.776
    5    HG   LEU  81           HG       LEU  81  11.927  -6.140  -2.502
    6   HD12  LEU  81          HD11      LEU  81  13.741  -6.791  -4.244
    7   HD11  LEU  81          HD12      LEU  81  13.197  -5.360  -5.119
    8   HD13  LEU  81          HD13      LEU  81  12.067  -6.670  -4.784
    9   HD23  LEU  81          HD21      LEU  81  14.559  -5.859  -2.478
   10   HD22  LEU  81          HD22      LEU  81  13.582  -5.085  -1.232
   11   HD21  LEU  81          HD23      LEU  81  14.179  -4.142  -2.597

  No H/Q in entry =          11
  In of MODEL   13
    1    H    MET  82           H        MET  82   8.942  -2.956  -3.253
    2    HA   MET  82           HA       MET  82   9.521  -0.238  -3.754
    3    HB2  MET  82           HB2      MET  82   6.940  -1.797  -3.638
    4    HB3  MET  82           HB3      MET  82   6.964  -0.073  -4.003
    5    HG2  MET  82           HG2      MET  82   8.542  -2.169  -5.531
    6    HG3  MET  82           HG3      MET  82   6.986  -1.526  -6.050
    7    HE3  MET  82           HE1      MET  82   7.486   1.922  -7.222
    8    HE2  MET  82           HE2      MET  82   7.101   1.702  -5.517
    9    HE1  MET  82           HE3      MET  82   6.426   0.600  -6.713

  No H/Q in entry =           9
  In of MODEL   13
    1    H    THR  83           H        THR  83   7.697  -1.810  -1.155
    2    HA   THR  83           HA       THR  83   6.873   0.551   0.167
    3    HB   THR  83           HB       THR  83   6.709  -1.020   2.185
    4    HG1  THR  83           HG1      THR  83   7.440  -2.981   1.960
    5   HG22  THR  83          HG21      THR  83   5.040  -2.564   0.712
    6   HG21  THR  83          HG22      THR  83   5.290  -1.240  -0.420
    7   HG23  THR  83          HG23      THR  83   4.647  -0.914   1.190

  No H/Q in entry =           7
  In of MODEL   13
    1    H    SER  84           H        SER  84   9.665  -1.586   0.700
    2    HA   SER  84           HA       SER  84  10.736  -0.168   2.892
    3    HB2  SER  84           HB2      SER  84  11.972  -2.030   0.873
    4    HB3  SER  84           HB3      SER  84  12.923  -1.289   2.158
    5    HG   SER  84           HG       SER  84  10.624  -2.946   2.409

  No H/Q in entry =           5
  In of MODEL   13
    1    H    MET  85           H        MET  85  11.507   0.080  -0.594
    2    HA   MET  85           HA       MET  85  13.531   2.016  -0.336
    3    HB2  MET  85           HB2      MET  85  13.123   0.737  -2.402
    4    HB3  MET  85           HB3      MET  85  11.612   1.616  -2.638
    5    HG2  MET  85           HG2      MET  85  12.842   3.740  -2.767
    6    HG3  MET  85           HG3      MET  85  14.357   2.890  -2.480
    7    HE2  MET  85           HE1      MET  85  11.690   2.962  -6.150
    8    HE1  MET  85           HE2      MET  85  11.300   3.347  -4.476
    9    HE3  MET  85           HE3      MET  85  11.284   1.670  -5.008

  No H/Q in entry =           9
  In of MODEL   13
    1    H    LEU  86           H        LEU  86  10.049   2.401  -0.859
    2    HA   LEU  86           HA       LEU  86  10.026   5.214  -1.043
    3    HB2  LEU  86           HB2      LEU  86   8.160   3.581  -1.625
    4    HB3  LEU  86           HB3      LEU  86   7.822   3.497   0.104
    5    HG   LEU  86           HG       LEU  86   7.699   6.060   0.049
    6   HD11  LEU  86          HD11      LEU  86   8.479   5.611  -2.650
    7   HD13  LEU  86          HD12      LEU  86   8.062   7.145  -1.892
    8   HD12  LEU  86          HD13      LEU  86   6.815   6.199  -2.701
    9   HD23  LEU  86          HD21      LEU  86   5.552   4.737  -1.621
   10   HD22  LEU  86          HD22      LEU  86   5.376   6.000  -0.407
   11   HD21  LEU  86          HD23      LEU  86   5.749   4.351   0.089

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ALA  87           H        ALA  87   9.518   3.045   1.703
    2    HA   ALA  87           HA       ALA  87   8.989   4.968   3.669
    3    HB1  ALA  87           HB1      ALA  87   9.756   2.136   3.587
    4    HB3  ALA  87           HB2      ALA  87   8.638   2.965   4.668
    5    HB2  ALA  87           HB3      ALA  87  10.366   2.972   5.019

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ARG  88           H        ARG  88  12.055   3.498   2.701
    2    HA   ARG  88           HA       ARG  88  13.678   4.853   4.539
    3    HB2  ARG  88           HB2      ARG  88  14.323   2.869   3.139
    4    HB3  ARG  88           HB3      ARG  88  14.496   3.959   1.766
    5    HG2  ARG  88           HG2      ARG  88  15.981   5.252   3.717
    6    HG3  ARG  88           HG3      ARG  88  16.276   3.558   4.098
    7    HD2  ARG  88           HD2      ARG  88  17.545   3.242   2.257
    8    HD3  ARG  88           HD3      ARG  88  16.425   4.129   1.219
    9    HE   ARG  88           HE       ARG  88  18.831   5.159   2.274
   10   HH21  ARG  88          HH11      ARG  88  19.210   7.372   2.080
   11   HH22  ARG  88          HH12      ARG  88  17.875   8.463   1.931
   12   HH11  ARG  88          HH21      ARG  88  15.504   5.960   1.983
   13   HH12  ARG  88          HH22      ARG  88  15.776   7.661   1.851

  No H/Q in entry =          13
  In of MODEL   13
    1    H    GLU  89           H        GLU  89  12.730   5.763   1.211
    2    HA   GLU  89           HA       GLU  89  14.312   8.100   1.059
    3    HB2  GLU  89           HB2      GLU  89  13.160   7.074  -0.892
    4    HB3  GLU  89           HB3      GLU  89  11.621   7.639  -0.241
    5    HG2  GLU  89           HG2      GLU  89  12.358   9.965  -0.402
    6    HG3  GLU  89           HG3      GLU  89  13.956   9.451  -0.933

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LEU  90           H        LEU  90  10.972   7.640   2.177
    2    HA   LEU  90           HA       LEU  90  10.495  10.381   2.748
    3    HB2  LEU  90           HB2      LEU  90   9.259   7.826   3.773
    4    HB3  LEU  90           HB3      LEU  90   8.650   9.431   4.192
    5    HG   LEU  90           HG       LEU  90   9.066   8.543   1.325
    6   HD12  LEU  90          HD11      LEU  90   6.527   8.251   1.379
    7   HD11  LEU  90          HD12      LEU  90   6.675   8.240   3.136
    8   HD13  LEU  90          HD13      LEU  90   7.479   6.998   2.175
    9   HD22  LEU  90          HD21      LEU  90   8.806  10.855   1.249
   10   HD21  LEU  90          HD22      LEU  90   7.814  10.903   2.706
   11   HD23  LEU  90          HD23      LEU  90   7.115  10.357   1.182

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  91           H        ILE  91  11.711   7.683   4.677
    2    HA   ILE  91           HA       ILE  91  11.863   9.047   7.145
    3    HB   ILE  91           HB       ILE  91  13.386   6.686   6.028
    4   HG12  ILE  91          HG12      ILE  91  11.365   6.884   8.280
    5   HG13  ILE  91          HG13      ILE  91  10.896   6.609   6.603
    6   HG22  ILE  91          HG21      ILE  91  13.844   6.467   8.670
    7   HG21  ILE  91          HG22      ILE  91  13.794   8.226   8.568
    8   HG23  ILE  91          HG23      ILE  91  14.963   7.321   7.608
    9   HD13  ILE  91          HD11      ILE  91  11.868   4.492   6.538
   10   HD12  ILE  91          HD12      ILE  91  11.270   4.560   8.195
   11   HD11  ILE  91          HD13      ILE  91  12.977   4.848   7.863

  No H/Q in entry =          11
  In of MODEL   13
    1    H    THR  92           H        THR  92  14.087   8.844   4.401
    2    HA   THR  92           HA       THR  92  16.268  10.206   5.567
    3    HB   THR  92           HB       THR  92  15.290  10.094   2.703
    4    HG1  THR  92           HG1      THR  92  16.093   8.185   3.112
    5   HG22  THR  92          HG21      THR  92  17.871  10.746   2.418
    6   HG21  THR  92          HG22      THR  92  17.570  11.572   3.946
    7   HG23  THR  92          HG23      THR  92  16.610  11.973   2.522

  No H/Q in entry =           7
  In of MODEL   13
    1    H    GLU  93           H        GLU  93  13.404  11.400   3.827
    2    HA   GLU  93           HA       GLU  93  14.039  14.152   3.942
    3    HB2  GLU  93           HB2      GLU  93  11.315  12.819   3.947
    4    HB3  GLU  93           HB3      GLU  93  11.629  14.514   3.576
    5    HG2  GLU  93           HG2      GLU  93  12.939  12.251   2.054
    6    HG3  GLU  93           HG3      GLU  93  11.404  12.956   1.561

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LEU  94           H        LEU  94  12.257  12.023   6.148
    2    HA   LEU  94           HA       LEU  94  11.470  13.982   8.021
    3    HB2  LEU  94           HB2      LEU  94  12.002  11.019   8.298
    4    HB3  LEU  94           HB3      LEU  94  11.440  12.004   9.646
    5    HG   LEU  94           HG       LEU  94   9.965  12.076   7.012
    6   HD11  LEU  94          HD11      LEU  94  10.009   9.855   9.018
    7   HD13  LEU  94          HD12      LEU  94   9.712   9.797   7.282
    8   HD12  LEU  94          HD13      LEU  94   8.438  10.333   8.376
    9   HD23  LEU  94          HD21      LEU  94   8.046  12.504   8.606
   10   HD22  LEU  94          HD22      LEU  94   9.303  13.740   8.646
   11   HD21  LEU  94          HD23      LEU  94   9.219  12.525   9.921

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  95           H        ILE  95  14.416  12.009   7.795
    2    HA   ILE  95           HA       ILE  95  15.589  12.916  10.212
    3    HB   ILE  95           HB       ILE  95  16.820  11.827   7.669
    4   HG12  ILE  95          HG12      ILE  95  16.498  10.633  10.436
    5   HG13  ILE  95          HG13      ILE  95  15.332  10.391   9.137
    6   HG21  ILE  95          HG21      ILE  95  18.079  12.618  10.315
    7   HG23  ILE  95          HG22      ILE  95  18.554  13.138   8.697
    8   HG22  ILE  95          HG23      ILE  95  18.834  11.474   9.207
    9   HD13  ILE  95          HD11      ILE  95  16.797   9.090   7.880
   10   HD12  ILE  95          HD12      ILE  95  17.258   8.635   9.518
   11   HD11  ILE  95          HD13      ILE  95  18.231   9.800   8.621

  No H/Q in entry =          11
  In of MODEL   13
    1    H    GLU  96           H        GLU  96  15.772  14.145   6.877
    2    HA   GLU  96           HA       GLU  96  17.647  16.197   7.359
    3    HB2  GLU  96           HB2      GLU  96  16.981  15.543   5.098
    4    HB3  GLU  96           HB3      GLU  96  15.345  16.124   5.393
    5    HG2  GLU  96           HG2      GLU  96  15.944  18.244   4.851
    6    HG3  GLU  96           HG3      GLU  96  17.239  18.226   6.038

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LEU  97           H        LEU  97  14.132  16.061   7.777
    2    HA   LEU  97           HA       LEU  97  13.754  18.801   8.416
    3    HB2  LEU  97           HB2      LEU  97  12.197  16.298   9.027
    4    HB3  LEU  97           HB3      LEU  97  11.705  17.853   9.696
    5    HG   LEU  97           HG       LEU  97  12.191  17.428   6.733
    6   HD12  LEU  97          HD11      LEU  97   9.666  17.337   6.607
    7   HD11  LEU  97          HD12      LEU  97   9.651  17.139   8.357
    8   HD13  LEU  97          HD13      LEU  97  10.417  15.919   7.338
    9   HD23  LEU  97          HD21      LEU  97  10.482  19.417   6.759
   10   HD22  LEU  97          HD22      LEU  97  12.167  19.752   7.156
   11   HD21  LEU  97          HD23      LEU  97  10.972  19.600   8.443

  No H/Q in entry =          11
  In of MODEL   13
    1    H    HIS  98           H        HIS  98  14.528  15.964  10.416
    2    HA   HIS  98           HA       HIS  98  14.381  17.229  12.931
    3    HB2  HIS  98           HB2      HIS  98  16.100  14.946  11.936
    4    HB3  HIS  98           HB3      HIS  98  16.101  15.485  13.617
    5    HD1  HIS  98           HD1      HIS  98  13.887  13.886  11.019
    6    HD2  HIS  98           HD2      HIS  98  13.780  14.810  15.082
    7    HE1  HIS  98           HE1      HIS  98  11.841  12.722  11.965
    8    HE2  HIS  98           HE2      HIS  98  11.757  13.277  14.436

  No H/Q in entry =           8
  In of MODEL   13
    1    H    GLU  99           H        GLU  99  16.940  17.075  10.504
    2    HA   GLU  99           HA       GLU  99  18.940  18.378  12.039
    3    HB2  GLU  99           HB2      GLU  99  19.407  17.082   9.972
    4    HB3  GLU  99           HB3      GLU  99  18.618  18.348   9.028
    5    HG2  GLU  99           HG2      GLU  99  20.249  19.995   9.822
    6    HG3  GLU  99           HG3      GLU  99  21.007  18.782  10.848

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LYS 100           H        LYS 100  16.441  19.576   9.814
    2    HA   LYS 100           HA       LYS 100  17.278  22.301   9.959
    3    HB2  LYS 100           HB2      LYS 100  14.629  21.052   9.197
    4    HB3  LYS 100           HB3      LYS 100  14.955  22.785   9.106
    5    HG2  LYS 100           HG2      LYS 100  16.924  22.306   7.646
    6    HG3  LYS 100           HG3      LYS 100  16.485  20.596   7.663
    7    HD2  LYS 100           HD2      LYS 100  14.301  21.138   6.656
    8    HD3  LYS 100           HD3      LYS 100  14.723  22.851   6.646
    9    HE2  LYS 100           HE2      LYS 100  16.679  22.340   5.193
   10    HE3  LYS 100           HE3      LYS 100  16.188  20.642   5.159
   11    HZ1  LYS 100           HZ1      LYS 100  14.399  22.862   4.317
   12    HZ3  LYS 100           HZ2      LYS 100  14.191  21.195   4.055
   13    HZ2  LYS 100           HZ3      LYS 100  15.417  22.038   3.237

  No H/Q in entry =          13
  In of MODEL   13
    1    H    LEU 101           H        LEU 101  15.144  20.288  11.919
    2    HA   LEU 101           HA       LEU 101  14.005  22.375  13.493
    3    HB2  LEU 101           HB2      LEU 101  14.401  19.419  13.879
    4    HB3  LEU 101           HB3      LEU 101  13.876  20.408  15.238
    5    HG   LEU 101           HG       LEU 101  12.467  20.516  12.564
    6   HD12  LEU 101          HD11      LEU 101  10.781  18.979  13.829
    7   HD11  LEU 101          HD12      LEU 101  12.166  18.545  14.828
    8   HD13  LEU 101          HD13      LEU 101  12.200  18.237  13.091
    9   HD21  LEU 101          HD21      LEU 101  11.814  21.321  15.414
   10   HD23  LEU 101          HD22      LEU 101  10.553  21.114  14.200
   11   HD22  LEU 101          HD23      LEU 101  11.808  22.330  13.966

  No H/Q in entry =          11
  In of MODEL   13
    1    H    LYS 102           H        LYS 102  17.144  21.719  13.066
    2    HA   LYS 102           HA       LYS 102  19.000  22.561  14.143
    3    HB2  LYS 102           HB2      LYS 102  17.206  24.105  15.271
    4    HB3  LYS 102           HB3      LYS 102  17.393  23.040  16.649
    5    HG2  LYS 102           HG2      LYS 102  19.320  25.021  15.484
    6    HG3  LYS 102           HG3      LYS 102  18.929  24.713  17.162
    7    HD2  LYS 102           HD2      LYS 102  20.571  22.774  15.482
    8    HD3  LYS 102           HD3      LYS 102  21.278  24.086  16.416
    9    HE2  LYS 102           HE2      LYS 102  20.837  21.544  17.385
   10    HE3  LYS 102           HE3      LYS 102  21.075  22.983  18.376
   11    HZ2  LYS 102           HZ1      LYS 102  19.085  21.730  18.989
   12    HZ1  LYS 102           HZ2      LYS 102  18.449  21.969  17.438
   13    HZ3  LYS 102           HZ3      LYS 102  18.697  23.296  18.464

  No H/Q in entry =          13
  In of MODEL   13
    1    H    ALA 103           H        ALA 103  16.897  20.989  16.560
    2    HA   ALA 103           HA       ALA 103  18.600  19.752  18.220
    3    HB2  ALA 103           HB1      ALA 103  16.985  17.770  18.211
    4    HB1  ALA 103           HB2      ALA 103  16.106  18.637  16.950
    5    HB3  ALA 103           HB3      ALA 103  16.291  19.355  18.549

  No H/Q in entry =           5
  In of MODEL   13
    1    H1   ALA   1           H3       ALA   1  -1.626  -6.804 -21.450
    2    H2   ALA   1           H2       ALA   1  -2.444  -8.226 -20.999
    3    H3   ALA   1           H1       ALA   1  -0.836  -8.302 -21.549
    4    HA   ALA   1           HA       ALA   1  -1.671  -8.759 -23.547
    5    HB1  ALA   1           HB1      ALA   1  -3.821  -9.442 -23.080
    6    HB2  ALA   1           HB2      ALA   1  -4.233  -7.925 -23.880
    7    HB3  ALA   1           HB3      ALA   1  -4.179  -8.006 -22.121

  No H/Q in entry =           7
  In of MODEL   13
    1    H    GLU   2           H        GLU   2  -2.476  -7.556 -25.540
    2    HA   GLU   2           HA       GLU   2  -1.042  -5.565 -26.413
    3    HB2  GLU   2           HB2      GLU   2  -4.049  -5.584 -26.740
    4    HB3  GLU   2           HB3      GLU   2  -2.911  -4.739 -27.787
    5    HG2  GLU   2           HG2      GLU   2  -2.435  -6.637 -28.940
    6    HG3  GLU   2           HG3      GLU   2  -2.157  -7.547 -27.461

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLU   3           H        GLU   3  -4.185  -4.257 -25.523
    2    HA   GLU   3           HA       GLU   3  -3.100  -1.718 -24.892
    3    HB2  GLU   3           HB2      GLU   3  -5.809  -2.989 -24.569
    4    HB3  GLU   3           HB3      GLU   3  -5.488  -1.379 -23.922
    5    HG2  GLU   3           HG2      GLU   3  -5.110  -0.458 -26.047
    6    HG3  GLU   3           HG3      GLU   3  -4.737  -2.020 -26.770

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LEU   4           H        LEU   4  -4.735  -4.051 -22.717
    2    HA   LEU   4           HA       LEU   4  -4.358  -2.828 -20.325
    3    HB2  LEU   4           HB2      LEU   4  -3.861  -5.778 -20.793
    4    HB3  LEU   4           HB3      LEU   4  -4.260  -5.025 -19.250
    5    HG   LEU   4           HG       LEU   4  -6.025  -5.070 -21.720
    6   HD13  LEU   4          HD11      LEU   4  -7.249  -6.768 -20.726
    7   HD12  LEU   4          HD12      LEU   4  -6.762  -6.316 -19.093
    8   HD11  LEU   4          HD13      LEU   4  -5.637  -7.178 -20.141
    9   HD23  LEU   4          HD21      LEU   4  -7.703  -4.232 -19.858
   10   HD22  LEU   4          HD22      LEU   4  -6.643  -3.078 -20.665
   11   HD21  LEU   4          HD23      LEU   4  -6.232  -3.674 -19.058

  No H/Q in entry =          11
  In of MODEL   13
    1    H    GLU   5           H        GLU   5  -1.885  -4.711 -22.048
    2    HA   GLU   5           HA       GLU   5   0.097  -4.459 -20.005
    3    HB2  GLU   5           HB2      GLU   5   0.153  -6.233 -21.740
    4    HB3  GLU   5           HB3      GLU   5   0.458  -5.003 -22.966
    5    HG2  GLU   5           HG2      GLU   5   2.543  -4.368 -21.856
    6    HG3  GLU   5           HG3      GLU   5   2.233  -5.523 -20.562

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLU   6           H        GLU   6  -0.501  -2.736 -23.052
    2    HA   GLU   6           HA       GLU   6   1.697  -0.939 -22.777
    3    HB2  GLU   6           HB2      GLU   6  -0.857  -0.800 -24.393
    4    HB3  GLU   6           HB3      GLU   6   0.429   0.403 -24.498
    5    HG2  GLU   6           HG2      GLU   6   2.026  -1.311 -25.184
    6    HG3  GLU   6           HG3      GLU   6   0.803  -2.565 -24.988

  No H/Q in entry =           6
  In of MODEL   13
    1    H    VAL   7           H        VAL   7  -1.645  -0.957 -21.743
    2    HA   VAL   7           HA       VAL   7  -1.825   1.759 -20.908
    3    HB   VAL   7           HB       VAL   7  -3.331  -0.735 -20.076
    4   HG11  VAL   7          HG11      VAL   7  -3.662   2.160 -19.263
    5   HG13  VAL   7          HG12      VAL   7  -3.589   0.734 -18.228
    6   HG12  VAL   7          HG13      VAL   7  -5.013   1.027 -19.224
    7   HG21  VAL   7          HG21      VAL   7  -3.463   0.344 -22.465
    8   HG23  VAL   7          HG22      VAL   7  -4.390   1.608 -21.656
    9   HG22  VAL   7          HG23      VAL   7  -4.963  -0.061 -21.631

  No H/Q in entry =           9
  In of MODEL   13
    1    H    VAL   8           H        VAL   8  -0.891  -1.241 -19.261
    2    HA   VAL   8           HA       VAL   8  -0.564  -0.167 -16.665
    3    HB   VAL   8           HB       VAL   8   0.809  -2.505 -18.014
    4   HG13  VAL   8          HG11      VAL   8   2.243  -2.007 -16.229
    5   HG12  VAL   8          HG12      VAL   8   1.113  -3.141 -15.492
    6   HG11  VAL   8          HG13      VAL   8   0.930  -1.411 -15.213
    7   HG21  VAL   8          HG21      VAL   8  -1.849  -2.244 -17.324
    8   HG23  VAL   8          HG22      VAL   8  -1.172  -2.907 -15.839
    9   HG22  VAL   8          HG23      VAL   8  -0.993  -3.785 -17.354

  No H/Q in entry =           9
  In of MODEL   13
    1    H    MET   9           H        MET   9   1.688  -0.504 -19.405
    2    HA   MET   9           HA       MET   9   3.987   0.501 -18.136
    3    HB2  MET   9           HB2      MET   9   3.047   0.537 -21.002
    4    HB3  MET   9           HB3      MET   9   4.569   1.288 -20.524
    5    HG2  MET   9           HG2      MET   9   5.312  -0.859 -19.540
    6    HG3  MET   9           HG3      MET   9   3.798  -1.608 -20.052
    7    HE3  MET   9           HE1      MET   9   7.199   0.031 -22.602
    8    HE2  MET   9           HE2      MET   9   7.517  -1.001 -21.212
    9    HE1  MET   9           HE3      MET   9   6.669   0.526 -20.990

  No H/Q in entry =           9
  In of MODEL   13
    1    H    GLY  10           H        GLY  10   1.335   2.148 -19.822
    2    HA3  GLY  10           HA2      GLY  10   2.342   4.785 -19.575
    3    HA2  GLY  10           HA3      GLY  10   0.646   4.353 -19.785

  No H/Q in entry =           3
  In of MODEL   13
    1    H    LEU  11           H        LEU  11   0.214   2.833 -17.500
    2    HA   LEU  11           HA       LEU  11  -0.288   4.819 -15.542
    3    HB2  LEU  11           HB2      LEU  11  -0.273   1.802 -15.385
    4    HB3  LEU  11           HB3      LEU  11  -0.768   2.834 -14.044
    5    HG   LEU  11           HG       LEU  11  -1.997   2.969 -16.811
    6   HD13  LEU  11          HD11      LEU  11  -2.619   0.836 -16.058
    7   HD12  LEU  11          HD12      LEU  11  -3.954   1.851 -15.516
    8   HD11  LEU  11          HD13      LEU  11  -2.710   1.349 -14.372
    9   HD22  LEU  11          HD21      LEU  11  -2.556   4.995 -15.806
   10   HD21  LEU  11          HD22      LEU  11  -2.497   4.327 -14.175
   11   HD23  LEU  11          HD23      LEU  11  -3.875   3.985 -15.221

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  12           H        ILE  12   2.213   2.309 -15.777
    2    HA   ILE  12           HA       ILE  12   3.421   2.825 -13.270
    3    HB   ILE  12           HB       ILE  12   4.664   1.764 -15.829
    4   HG12  ILE  12          HG12      ILE  12   2.625   0.570 -14.683
    5   HG13  ILE  12          HG13      ILE  12   4.005  -0.390 -15.178
    6   HG21  ILE  12          HG21      ILE  12   5.628   1.709 -12.952
    7   HG23  ILE  12          HG22      ILE  12   6.429   2.461 -14.331
    8   HG22  ILE  12          HG23      ILE  12   6.309   0.705 -14.230
    9   HD11  ILE  12          HD11      ILE  12   3.571   0.710 -12.390
   10   HD13  ILE  12          HD12      ILE  12   4.838  -0.405 -12.897
   11   HD12  ILE  12          HD13      ILE  12   3.166  -0.923 -12.888

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  13           H        ILE  13   4.052   4.078 -16.525
    2    HA   ILE  13           HA       ILE  13   6.217   5.761 -15.795
    3    HB   ILE  13           HB       ILE  13   4.194   5.876 -18.046
    4   HG12  ILE  13          HG12      ILE  13   6.001   4.007 -17.761
    5   HG13  ILE  13          HG13      ILE  13   5.769   4.748 -19.340
    6   HG22  ILE  13          HG21      ILE  13   5.891   7.445 -19.133
    7   HG21  ILE  13          HG22      ILE  13   6.607   7.645 -17.537
    8   HG23  ILE  13          HG23      ILE  13   4.940   8.144 -17.820
    9   HD12  ILE  13          HD11      ILE  13   8.203   4.532 -18.626
   10   HD11  ILE  13          HD12      ILE  13   7.849   5.691 -17.350
   11   HD13  ILE  13          HD13      ILE  13   7.696   6.170 -19.037

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ASN  14           H        ASN  14   2.720   6.317 -16.072
    2    HA   ASN  14           HA       ASN  14   2.724   9.063 -15.435
    3    HB2  ASN  14           HB2      ASN  14   0.805   7.454 -16.270
    4    HB3  ASN  14           HB3      ASN  14   0.476   7.281 -14.551
    5   HD21  ASN  14          HD21      ASN  14  -1.520   8.472 -15.988
    6   HD22  ASN  14          HD22      ASN  14  -1.554  10.146 -15.721

  No H/Q in entry =           6
  In of MODEL   13
    1    H    SER  15           H        SER  15   2.374   6.192 -13.359
    2    HA   SER  15           HA       SER  15   2.085   7.567 -10.911
    3    HB2  SER  15           HB2      SER  15   2.594   5.472  -9.861
    4    HB3  SER  15           HB3      SER  15   1.764   5.067 -11.358
    5    HG   SER  15           HG       SER  15   4.321   4.552 -10.581

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLY  16           H        GLY  16   4.946   6.421 -12.663
    2    HA3  GLY  16           HA2      GLY  16   6.879   7.145 -10.728
    3    HA2  GLY  16           HA3      GLY  16   7.183   6.937 -12.451

  No H/Q in entry =           3
  In of MODEL   13
    1    H    GLN  17           H        GLN  17   5.529   8.923 -13.518
    2    HA   GLN  17           HA       GLN  17   7.144  11.238 -13.206
    3    HB2  GLN  17           HB2      GLN  17   4.392  10.851 -14.415
    4    HB3  GLN  17           HB3      GLN  17   5.273  12.379 -14.480
    5    HG2  GLN  17           HG2      GLN  17   7.111  11.323 -15.677
    6    HG3  GLN  17           HG3      GLN  17   6.343   9.743 -15.522
    7   HE21  GLN  17          HE21      GLN  17   6.992  11.454 -17.997
    8   HE22  GLN  17          HE22      GLN  17   5.513  11.543 -18.827

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ALA  18           H        ALA  18   4.024  10.271 -11.864
    2    HA   ALA  18           HA       ALA  18   3.335  12.672 -10.600
    3    HB1  ALA  18           HB1      ALA  18   2.167  10.234 -10.825
    4    HB2  ALA  18           HB2      ALA  18   1.635  11.463  -9.680
    5    HB3  ALA  18           HB3      ALA  18   2.703  10.163  -9.147

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ARG  19           H        ARG  19   5.161   9.879  -9.317
    2    HA   ARG  19           HA       ARG  19   5.706  11.028  -6.793
    3    HB2  ARG  19           HB2      ARG  19   6.083   8.619  -7.319
    4    HB3  ARG  19           HB3      ARG  19   7.449   9.083  -8.337
    5    HG2  ARG  19           HG2      ARG  19   8.580  10.105  -6.412
    6    HG3  ARG  19           HG3      ARG  19   7.196   9.739  -5.384
    7    HD2  ARG  19           HD2      ARG  19   8.931   8.076  -5.021
    8    HD3  ARG  19           HD3      ARG  19   7.546   7.316  -5.811
    9    HE   ARG  19           HE       ARG  19   9.269   8.107  -7.854
   10   HH21  ARG  19          HH11      ARG  19  10.809   6.678  -8.700
   11   HH22  ARG  19          HH12      ARG  19  11.331   5.321  -7.763
   12   HH11  ARG  19          HH21      ARG  19   9.302   6.076  -5.075
   13   HH12  ARG  19          HH22      ARG  19  10.474   4.980  -5.709

  No H/Q in entry =          13
  In of MODEL   13
    1    H    SER  20           H        SER  20   7.531  11.029  -9.838
    2    HA   SER  20           HA       SER  20   9.796  12.409  -9.008
    3    HB2  SER  20           HB2      SER  20   9.821  11.534 -11.212
    4    HB3  SER  20           HB3      SER  20   8.334  12.371 -11.643
    5    HG   SER  20           HG       SER  20  10.943  13.363 -11.334

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU  21           H        LEU  21   6.720  13.726 -10.213
    2    HA   LEU  21           HA       LEU  21   7.431  16.461  -9.987
    3    HB2  LEU  21           HB2      LEU  21   4.741  15.079  -9.913
    4    HB3  LEU  21           HB3      LEU  21   4.935  16.830  -9.919
    5    HG   LEU  21           HG       LEU  21   6.115  15.019 -12.044
    6   HD11  LEU  21          HD11      LEU  21   3.502  16.559 -12.022
    7   HD13  LEU  21          HD12      LEU  21   3.692  14.808 -12.118
    8   HD12  LEU  21          HD13      LEU  21   4.215  15.825 -13.459
    9   HD21  LEU  21          HD21      LEU  21   5.921  17.990 -11.615
   10   HD23  LEU  21          HD22      LEU  21   5.892  17.384 -13.268
   11   HD22  LEU  21          HD23      LEU  21   7.277  17.054 -12.239

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ALA  22           H        ALA  22   5.879  14.195  -7.743
    2    HA   ALA  22           HA       ALA  22   5.298  16.011  -5.677
    3    HB3  ALA  22           HB1      ALA  22   4.502  13.631  -5.842
    4    HB2  ALA  22           HB2      ALA  22   5.093  14.094  -4.246
    5    HB1  ALA  22           HB3      ALA  22   6.105  13.121  -5.315

  No H/Q in entry =           5
  In of MODEL   13
    1    H    TYR  23           H        TYR  23   8.203  13.943  -6.108
    2    HA   TYR  23           HA       TYR  23   9.595  14.942  -3.852
    3    HB2  TYR  23           HB2      TYR  23  10.356  12.923  -5.009
    4    HB3  TYR  23           HB3      TYR  23  10.687  13.858  -6.467
    5    HD1  TYR  23           HD1      TYR  23  11.636  13.504  -2.874
    6    HD2  TYR  23           HD2      TYR  23  12.738  15.002  -6.747
    7    HE1  TYR  23           HE1      TYR  23  13.900  14.048  -2.020
    8    HE2  TYR  23           HE2      TYR  23  15.001  15.548  -5.892
    9    HH   TYR  23           HH       TYR  23  16.100  16.003  -3.760

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ALA  24           H        ALA  24   9.436  16.051  -7.219
    2    HA   ALA  24           HA       ALA  24  11.360  18.110  -6.968
    3    HB2  ALA  24           HB1      ALA  24  10.924  18.178  -9.178
    4    HB3  ALA  24           HB2      ALA  24   9.379  18.949  -8.823
    5    HB1  ALA  24           HB3      ALA  24   9.480  17.195  -8.952

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA  25           H        ALA  25   7.878  17.973  -6.356
    2    HA   ALA  25           HA       ALA  25   7.433  20.698  -5.788
    3    HB1  ALA  25           HB1      ALA  25   5.746  18.722  -5.993
    4    HB2  ALA  25           HB2      ALA  25   5.392  20.016  -4.846
    5    HB3  ALA  25           HB3      ALA  25   6.060  18.486  -4.273

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU  26           H        LEU  26   8.461  18.005  -3.735
    2    HA   LEU  26           HA       LEU  26   8.579  19.435  -1.298
    3    HB2  LEU  26           HB2      LEU  26   8.642  17.017  -1.292
    4    HB3  LEU  26           HB3      LEU  26  10.114  17.005  -2.259
    5    HG   LEU  26           HG       LEU  26  11.339  18.108  -0.416
    6   HD12  LEU  26          HD11      LEU  26  10.108  18.132   1.840
    7   HD11  LEU  26          HD12      LEU  26   8.621  18.013   0.902
    8   HD13  LEU  26          HD13      LEU  26   9.684  19.406   0.695
    9   HD21  LEU  26          HD21      LEU  26   9.772  15.660   0.453
   10   HD23  LEU  26          HD22      LEU  26  11.293  16.203   1.154
   11   HD22  LEU  26          HD23      LEU  26  11.244  15.644  -0.516

  No H/Q in entry =          11
  In of MODEL   13
    1    H    LYS  27           H        LYS  27  10.994  18.830  -3.817
    2    HA   LYS  27           HA       LYS  27  13.190  20.044  -2.584
    3    HB2  LYS  27           HB2      LYS  27  13.280  18.695  -4.673
    4    HB3  LYS  27           HB3      LYS  27  12.534  20.036  -5.541
    5    HG2  LYS  27           HG2      LYS  27  14.416  21.498  -4.959
    6    HG3  LYS  27           HG3      LYS  27  15.158  20.197  -4.021
    7    HD2  LYS  27           HD2      LYS  27  15.289  18.807  -6.074
    8    HD3  LYS  27           HD3      LYS  27  14.593  20.133  -7.004
    9    HE2  LYS  27           HE2      LYS  27  16.497  21.576  -6.388
   10    HE3  LYS  27           HE3      LYS  27  17.197  20.253  -5.448
   11    HZ3  LYS  27           HZ1      LYS  27  18.193  20.340  -7.632
   12    HZ2  LYS  27           HZ2      LYS  27  16.667  20.240  -8.376
   13    HZ1  LYS  27           HZ3      LYS  27  17.272  18.923  -7.490

  No H/Q in entry =          13
  In of MODEL   13
    1    H    GLN  28           H        GLN  28  10.590  21.457  -4.540
    2    HA   GLN  28           HA       GLN  28  11.582  24.098  -4.691
    3    HB2  GLN  28           HB2      GLN  28   8.736  23.061  -4.586
    4    HB3  GLN  28           HB3      GLN  28   9.170  24.729  -4.959
    5    HG2  GLN  28           HG2      GLN  28  10.140  22.306  -6.503
    6    HG3  GLN  28           HG3      GLN  28   8.821  23.359  -7.011
    7   HE21  GLN  28          HE21      GLN  28  11.949  22.823  -7.743
    8   HE22  GLN  28          HE22      GLN  28  12.458  24.401  -8.104

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ALA  29           H        ALA  29   9.624  22.430  -2.259
    2    HA   ALA  29           HA       ALA  29   9.097  24.629  -0.579
    3    HB2  ALA  29           HB1      ALA  29   8.346  23.070   0.988
    4    HB1  ALA  29           HB2      ALA  29   9.554  21.871   0.526
    5    HB3  ALA  29           HB3      ALA  29   8.174  22.181  -0.526

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LYS  30           H        LYS  30  11.800  22.329  -0.641
    2    HA   LYS  30           HA       LYS  30  13.124  23.268   1.664
    3    HB2  LYS  30           HB2      LYS  30  14.211  21.968  -0.843
    4    HB3  LYS  30           HB3      LYS  30  15.195  22.316   0.580
    5    HG2  LYS  30           HG2      LYS  30  13.622  20.952   1.957
    6    HG3  LYS  30           HG3      LYS  30  12.735  20.541   0.485
    7    HD2  LYS  30           HD2      LYS  30  14.770  19.530  -0.471
    8    HD3  LYS  30           HD3      LYS  30  15.676  19.955   0.983
    9    HE2  LYS  30           HE2      LYS  30  14.151  18.542   2.334
   10    HE3  LYS  30           HE3      LYS  30  13.275  18.096   0.865
   11    HZ2  LYS  30           HZ1      LYS  30  15.046  16.497   1.630
   12    HZ1  LYS  30           HZ2      LYS  30  16.198  17.671   1.181
   13    HZ3  LYS  30           HZ3      LYS  30  15.157  16.999   0.014

  No H/Q in entry =          13
  In of MODEL   13
    1    H    GLN  31           H        GLN  31  13.037  24.473  -1.633
    2    HA   GLN  31           HA       GLN  31  15.211  26.340  -1.207
    3    HB2  GLN  31           HB2      GLN  31  13.174  26.411  -3.437
    4    HB3  GLN  31           HB3      GLN  31  14.802  27.087  -3.434
    5    HG2  GLN  31           HG2      GLN  31  15.231  24.386  -2.857
    6    HG3  GLN  31           HG3      GLN  31  13.929  24.347  -4.038
    7   HE21  GLN  31          HE21      GLN  31  16.764  23.520  -4.436
    8   HE22  GLN  31          HE22      GLN  31  17.351  24.486  -5.701

  No H/Q in entry =           8
  In of MODEL   13
    1    H    GLY  32           H        GLY  32  12.132  26.195  -0.069
    2    HA3  GLY  32           HA2      GLY  32  10.992  27.777   1.201
    3    HA2  GLY  32           HA3      GLY  32  12.133  28.999   0.653

  No H/Q in entry =           3
  In of MODEL   13
    1    H    ASP  33           H        ASP  33  10.752  27.110  -1.842
    2    HA   ASP  33           HA       ASP  33   9.116  29.402  -2.702
    3    HB2  ASP  33           HB2      ASP  33  10.184  26.970  -4.141
    4    HB3  ASP  33           HB3      ASP  33   9.048  28.099  -4.874

  No H/Q in entry =           4
  In of MODEL   13
    1    H    PHE  34           H        PHE  34   7.419  28.947  -1.142
    2    HA   PHE  34           HA       PHE  34   6.010  26.491  -1.048
    3    HB2  PHE  34           HB2      PHE  34   5.081  29.290  -0.372
    4    HB3  PHE  34           HB3      PHE  34   4.213  27.810   0.038
    5    HD1  PHE  34           HD1      PHE  34   6.488  30.182   1.257
    6    HD2  PHE  34           HD2      PHE  34   5.759  25.949   1.203
    7    HE1  PHE  34           HE1      PHE  34   7.872  29.916   3.297
    8    HE2  PHE  34           HE2      PHE  34   7.144  25.687   3.241
    9    HZ   PHE  34           HZ       PHE  34   8.194  27.671   4.287

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ALA  35           H        ALA  35   5.618  29.359  -3.061
    2    HA   ALA  35           HA       ALA  35   3.062  28.775  -4.092
    3    HB1  ALA  35           HB1      ALA  35   4.135  30.154  -6.127
    4    HB3  ALA  35           HB2      ALA  35   5.354  30.501  -4.901
    5    HB2  ALA  35           HB3      ALA  35   3.667  30.930  -4.614

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA  36           H        ALA  36   6.285  28.063  -5.438
    2    HA   ALA  36           HA       ALA  36   5.285  26.645  -7.684
    3    HB3  ALA  36           HB1      ALA  36   7.447  26.744  -8.295
    4    HB2  ALA  36           HB2      ALA  36   7.913  25.710  -6.943
    5    HB1  ALA  36           HB3      ALA  36   7.827  27.459  -6.728

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA  37           H        ALA  37   6.222  25.641  -4.427
    2    HA   ALA  37           HA       ALA  37   6.132  22.853  -4.855
    3    HB2  ALA  37           HB1      ALA  37   5.886  24.648  -2.478
    4    HB1  ALA  37           HB2      ALA  37   7.005  23.317  -2.767
    5    HB3  ALA  37           HB3      ALA  37   5.338  22.983  -2.299

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LYS  38           H        LYS  38   3.622  25.091  -3.693
    2    HA   LYS  38           HA       LYS  38   1.501  23.302  -3.475
    3    HB2  LYS  38           HB2      LYS  38   1.884  26.054  -3.224
    4    HB3  LYS  38           HB3      LYS  38   0.686  25.921  -4.505
    5    HG2  LYS  38           HG2      LYS  38  -0.782  24.614  -3.065
    6    HG3  LYS  38           HG3      LYS  38   0.459  24.540  -1.806
    7    HD2  LYS  38           HD2      LYS  38   0.299  26.879  -1.360
    8    HD3  LYS  38           HD3      LYS  38  -0.606  27.178  -2.845
    9    HE2  LYS  38           HE2      LYS  38  -2.114  27.230  -0.908
   10    HE3  LYS  38           HE3      LYS  38  -2.501  25.858  -1.951
   11    HZ3  LYS  38           HZ1      LYS  38  -1.796  24.380  -0.416
   12    HZ2  LYS  38           HZ2      LYS  38  -2.135  25.641   0.672
   13    HZ1  LYS  38           HZ3      LYS  38  -0.542  25.372   0.151

  No H/Q in entry =          13
  In of MODEL   13
    1    H    ALA  39           H        ALA  39   2.509  25.192  -6.322
    2    HA   ALA  39           HA       ALA  39   0.427  24.348  -8.029
    3    HB2  ALA  39           HB1      ALA  39   3.173  24.965  -9.077
    4    HB1  ALA  39           HB2      ALA  39   2.220  26.237  -8.314
    5    HB3  ALA  39           HB3      ALA  39   1.601  25.407  -9.742

  No H/Q in entry =           5
  In of MODEL   13
    1    H    MET  40           H        MET  40   3.649  23.012  -7.442
    2    HA   MET  40           HA       MET  40   3.532  20.993  -9.433
    3    HB2  MET  40           HB2      MET  40   5.141  21.199  -6.881
    4    HB3  MET  40           HB3      MET  40   5.380  19.940  -8.094
    5    HG2  MET  40           HG2      MET  40   5.472  22.895  -8.760
    6    HG3  MET  40           HG3      MET  40   6.907  21.976  -8.308
    7    HE3  MET  40           HE1      MET  40   7.760  19.749 -11.114
    8    HE2  MET  40           HE2      MET  40   7.190  19.437  -9.477
    9    HE1  MET  40           HE3      MET  40   8.301  20.772  -9.775

  No H/Q in entry =           9
  In of MODEL   13
    1    H    MET  41           H        MET  41   2.610  21.047  -6.011
    2    HA   MET  41           HA       MET  41   2.046  18.288  -5.733
    3    HB2  MET  41           HB2      MET  41   0.737  20.661  -4.386
    4    HB3  MET  41           HB3      MET  41   0.561  18.986  -3.878
    5    HG2  MET  41           HG2      MET  41   3.274  19.178  -3.909
    6    HG3  MET  41           HG3      MET  41   2.851  20.841  -3.515
    7    HE2  MET  41           HE1      MET  41  -0.206  19.623  -1.796
    8    HE1  MET  41           HE2      MET  41   0.628  21.127  -2.172
    9    HE3  MET  41           HE3      MET  41   0.559  20.558  -0.504

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ASP  42           H        ASP  42   0.040  21.035  -6.713
    2    HA   ASP  42           HA       ASP  42  -2.415  19.702  -6.855
    3    HB2  ASP  42           HB2      ASP  42  -1.679  22.264  -7.110
    4    HB3  ASP  42           HB3      ASP  42  -1.831  21.871  -8.819

  No H/Q in entry =           4
  In of MODEL   13
    1    H    GLN  43           H        GLN  43   0.038  20.265  -9.351
    2    HA   GLN  43           HA       GLN  43  -1.359  18.960 -11.443
    3    HB2  GLN  43           HB2      GLN  43   1.604  19.444 -11.055
    4    HB3  GLN  43           HB3      GLN  43   0.886  18.811 -12.539
    5    HG2  GLN  43           HG2      GLN  43  -0.603  20.855 -12.584
    6    HG3  GLN  43           HG3      GLN  43   0.355  21.501 -11.255
    7   HE21  GLN  43          HE21      GLN  43   0.539  23.119 -13.341
    8   HE22  GLN  43          HE22      GLN  43   1.953  22.882 -14.245

  No H/Q in entry =           8
  In of MODEL   13
    1    H    SER  44           H        SER  44   0.973  17.795  -9.047
    2    HA   SER  44           HA       SER  44   1.282  15.185 -10.071
    3    HB2  SER  44           HB2      SER  44   2.188  16.614  -7.833
    4    HB3  SER  44           HB3      SER  44   1.309  15.241  -7.163
    5    HG   SER  44           HG       SER  44   3.414  14.598  -7.585

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ARG  45           H        ARG  45  -1.029  16.529  -7.738
    2    HA   ARG  45           HA       ARG  45  -2.442  14.183  -7.106
    3    HB2  ARG  45           HB2      ARG  45  -2.620  16.354  -5.915
    4    HB3  ARG  45           HB3      ARG  45  -3.465  17.030  -7.304
    5    HG2  ARG  45           HG2      ARG  45  -5.250  15.323  -7.024
    6    HG3  ARG  45           HG3      ARG  45  -4.416  14.702  -5.599
    7    HD2  ARG  45           HD2      ARG  45  -4.601  16.971  -4.544
    8    HD3  ARG  45           HD3      ARG  45  -5.579  17.501  -5.929
    9    HE   ARG  45           HE       ARG  45  -6.716  15.138  -4.891
   10   HH21  ARG  45          HH11      ARG  45  -8.554  15.233  -3.624
   11   HH22  ARG  45          HH12      ARG  45  -8.936  16.677  -2.757
   12   HH11  ARG  45          HH21      ARG  45  -6.139  18.379  -3.867
   13   HH12  ARG  45          HH22      ARG  45  -7.563  18.459  -2.892

  No H/Q in entry =          13
  In of MODEL   13
    1    H    MET  46           H        MET  46  -2.995  16.593  -9.658
    2    HA   MET  46           HA       MET  46  -5.344  15.445 -10.725
    3    HB2  MET  46           HB2      MET  46  -3.219  17.246 -11.899
    4    HB3  MET  46           HB3      MET  46  -4.610  16.708 -12.846
    5    HG2  MET  46           HG2      MET  46  -6.136  17.646 -11.160
    6    HG3  MET  46           HG3      MET  46  -4.764  18.163 -10.188
    7    HE2  MET  46           HE1      MET  46  -5.592  21.649 -11.217
    8    HE1  MET  46           HE2      MET  46  -5.405  20.424  -9.967
    9    HE3  MET  46           HE3      MET  46  -6.869  20.454 -10.948

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ALA  47           H        ALA  47  -1.918  14.930 -11.475
    2    HA   ALA  47           HA       ALA  47  -2.276  13.205 -13.686
    3    HB3  ALA  47           HB1      ALA  47  -0.090  14.072 -13.329
    4    HB2  ALA  47           HB2      ALA  47   0.032  12.343 -12.994
    5    HB1  ALA  47           HB3      ALA  47  -0.052  13.496 -11.662

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU  48           H        LEU  48  -2.021  12.568 -10.211
    2    HA   LEU  48           HA       LEU  48  -2.144   9.729 -10.368
    3    HB2  LEU  48           HB2      LEU  48  -2.894  11.655  -8.157
    4    HB3  LEU  48           HB3      LEU  48  -2.818   9.904  -7.956
    5    HG   LEU  48           HG       LEU  48  -0.500  11.580  -8.948
    6   HD13  LEU  48          HD11      LEU  48  -0.780  12.354  -6.758
    7   HD12  LEU  48          HD12      LEU  48   0.370  11.034  -6.557
    8   HD11  LEU  48          HD13      LEU  48  -1.332  10.789  -6.163
    9   HD22  LEU  48          HD21      LEU  48  -0.022   9.389  -9.587
   10   HD21  LEU  48          HD22      LEU  48  -0.902   8.683  -8.233
   11   HD23  LEU  48          HD23      LEU  48   0.678   9.420  -7.969

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ASN  49           H        ASN  49  -4.583  12.246  -9.974
    2    HA   ASN  49           HA       ASN  49  -6.787  10.604  -9.439
    3    HB2  ASN  49           HB2      ASN  49  -6.840  13.017  -9.107
    4    HB3  ASN  49           HB3      ASN  49  -6.636  13.293 -10.833
    5   HD21  ASN  49          HD21      ASN  49  -8.935  12.465  -8.336
    6   HD22  ASN  49          HD22      ASN  49 -10.306  12.453  -9.333

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLU  50           H        GLU  50  -5.488  11.787 -12.524
    2    HA   GLU  50           HA       GLU  50  -7.450  10.550 -14.174
    3    HB2  GLU  50           HB2      GLU  50  -5.964  12.354 -14.985
    4    HB3  GLU  50           HB3      GLU  50  -4.582  11.268 -14.843
    5    HG2  GLU  50           HG2      GLU  50  -5.566   9.742 -16.482
    6    HG3  GLU  50           HG3      GLU  50  -7.017  10.735 -16.573

  No H/Q in entry =           6
  In of MODEL   13
    1    H    ALA  51           H        ALA  51  -4.293   9.527 -12.960
    2    HA   ALA  51           HA       ALA  51  -4.175   7.072 -14.377
    3    HB2  ALA  51           HB1      ALA  51  -2.200   6.764 -13.271
    4    HB1  ALA  51           HB2      ALA  51  -2.887   7.194 -11.706
    5    HB3  ALA  51           HB3      ALA  51  -2.416   8.460 -12.839

  No H/Q in entry =           5
  In of MODEL   13
    1    H    HIS  52           H        HIS  52  -5.348   7.917 -11.131
    2    HA   HIS  52           HA       HIS  52  -6.062   5.314 -10.300
    3    HB2  HIS  52           HB2      HIS  52  -5.906   7.300  -8.805
    4    HB3  HIS  52           HB3      HIS  52  -7.381   7.929  -9.538
    5    HD1  HIS  52           HD1      HIS  52  -9.601   6.600  -9.089
    6    HD2  HIS  52           HD2      HIS  52  -6.299   5.180  -6.980
    7    HE1  HIS  52           HE1      HIS  52 -10.505   5.047  -7.305
    8    HE2  HIS  52           HE2      HIS  52  -8.503   4.172  -6.009

  No H/Q in entry =           8
  In of MODEL   13
    1    H    LEU  53           H        LEU  53  -7.852   7.790 -12.094
    2    HA   LEU  53           HA       LEU  53 -10.370   6.525 -12.113
    3    HB2  LEU  53           HB2      LEU  53  -9.060   8.494 -13.975
    4    HB3  LEU  53           HB3      LEU  53 -10.661   7.841 -14.310
    5    HG   LEU  53           HG       LEU  53  -9.950   9.158 -11.668
    6   HD11  LEU  53          HD11      LEU  53  -9.665  10.770 -13.521
    7   HD13  LEU  53          HD12      LEU  53 -11.074  11.169 -12.539
    8   HD12  LEU  53          HD13      LEU  53 -11.279  10.384 -14.103
    9   HD22  LEU  53          HD21      LEU  53 -11.952   7.966 -11.334
   10   HD21  LEU  53          HD22      LEU  53 -12.484   8.212 -12.993
   11   HD23  LEU  53          HD23      LEU  53 -12.565   9.534 -11.844

  No H/Q in entry =          11
  In of MODEL   13
    1    H    VAL  54           H        VAL  54  -7.616   6.297 -14.342
    2    HA   VAL  54           HA       VAL  54  -8.853   4.539 -16.188
    3    HB   VAL  54           HB       VAL  54  -5.942   5.014 -15.498
    4   HG12  VAL  54          HG11      VAL  54  -5.700   3.926 -17.886
    5   HG11  VAL  54          HG12      VAL  54  -7.237   3.161 -17.486
    6   HG13  VAL  54          HG13      VAL  54  -5.827   2.892 -16.463
    7   HG22  VAL  54          HG21      VAL  54  -6.688   6.965 -16.546
    8   HG21  VAL  54          HG22      VAL  54  -7.887   6.115 -17.516
    9   HG23  VAL  54          HG23      VAL  54  -6.181   6.016 -17.942

  No H/Q in entry =           9
  In of MODEL   13
    1    H    GLN  55           H        GLN  55  -6.868   3.972 -13.283
    2    HA   GLN  55           HA       GLN  55  -6.808   1.155 -13.538
    3    HB2  GLN  55           HB2      GLN  55  -5.247   2.034 -12.015
    4    HB3  GLN  55           HB3      GLN  55  -6.455   3.014 -11.189
    5    HG2  GLN  55           HG2      GLN  55  -7.166   1.265  -9.872
    6    HG3  GLN  55           HG3      GLN  55  -6.951   0.075 -11.150
    7   HE21  GLN  55          HE21      GLN  55  -5.345  -1.392 -10.650
    8   HE22  GLN  55          HE22      GLN  55  -3.959  -1.056  -9.734

  No H/Q in entry =           8
  In of MODEL   13
    1    H    THR  56           H        THR  56  -9.120   3.343 -11.931
    2    HA   THR  56           HA       THR  56 -10.728   1.478 -10.645
    3    HB   THR  56           HB       THR  56 -11.791   3.878 -12.155
    4    HG1  THR  56           HG1      THR  56 -11.398   4.576  -9.727
    5   HG21  THR  56          HG21      THR  56 -12.685   2.451  -9.637
    6   HG23  THR  56          HG22      THR  56 -13.491   2.387 -11.205
    7   HG22  THR  56          HG23      THR  56 -13.434   3.901 -10.303

  No H/Q in entry =           7
  In of MODEL   13
    1    H    LYS  57           H        LYS  57 -10.908   2.562 -14.032
    2    HA   LYS  57           HA       LYS  57 -13.081   0.898 -14.791
    3    HB2  LYS  57           HB2      LYS  57 -12.171   2.842 -16.103
    4    HB3  LYS  57           HB3      LYS  57 -10.750   1.875 -16.475
    5    HG2  LYS  57           HG2      LYS  57 -12.132   0.230 -17.642
    6    HG3  LYS  57           HG3      LYS  57 -13.591   1.119 -17.219
    7    HD2  LYS  57           HD2      LYS  57 -12.780   3.065 -18.517
    8    HD3  LYS  57           HD3      LYS  57 -11.329   2.167 -18.955
    9    HE2  LYS  57           HE2      LYS  57 -12.725   0.455 -20.081
   10    HE3  LYS  57           HE3      LYS  57 -14.181   1.357 -19.660
   11    HZ3  LYS  57           HZ1      LYS  57 -13.499   3.164 -20.997
   12    HZ2  LYS  57           HZ2      LYS  57 -13.306   1.762 -21.938
   13    HZ1  LYS  57           HZ3      LYS  57 -11.952   2.510 -21.234

  No H/Q in entry =          13
  In of MODEL   13
    1    H    LEU  58           H        LEU  58  -9.582   0.428 -14.723
    2    HA   LEU  58           HA       LEU  58  -9.614  -2.089 -16.011
    3    HB2  LEU  58           HB2      LEU  58  -7.571  -0.819 -14.197
    4    HB3  LEU  58           HB3      LEU  58  -7.325  -2.344 -15.049
    5    HG   LEU  58           HG       LEU  58  -8.045   0.268 -16.417
    6   HD11  LEU  58          HD11      LEU  58  -5.415  -0.998 -15.717
    7   HD13  LEU  58          HD12      LEU  58  -5.891   0.698 -15.671
    8   HD12  LEU  58          HD13      LEU  58  -5.556  -0.078 -17.215
    9   HD22  LEU  58          HD21      LEU  58  -8.634  -1.289 -18.009
   10   HD21  LEU  58          HD22      LEU  58  -7.609  -2.547 -17.323
   11   HD23  LEU  58          HD23      LEU  58  -6.901  -1.282 -18.327

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  59           H        ILE  59 -10.436  -1.175 -12.763
    2    HA   ILE  59           HA       ILE  59 -10.118  -3.946 -11.812
    3    HB   ILE  59           HB       ILE  59  -9.654  -1.683 -10.413
    4   HG12  ILE  59          HG12      ILE  59 -11.054  -4.011  -9.086
    5   HG13  ILE  59          HG13      ILE  59  -9.414  -4.121  -9.676
    6   HG21  ILE  59          HG21      ILE  59 -12.179  -1.133 -10.673
    7   HG23  ILE  59          HG22      ILE  59 -11.474  -0.977  -9.081
    8   HG22  ILE  59          HG23      ILE  59 -12.437  -2.393  -9.491
    9   HD13  ILE  59          HD11      ILE  59  -8.757  -2.218  -8.271
   10   HD12  ILE  59          HD12      ILE  59  -9.426  -3.519  -7.294
   11   HD11  ILE  59          HD13      ILE  59 -10.406  -2.100  -7.664

  No H/Q in entry =          11
  In of MODEL   13
    1    H    GLU  60           H        GLU  60 -12.648  -1.603 -12.630
    2    HA   GLU  60           HA       GLU  60 -14.852  -3.095 -11.623
    3    HB2  GLU  60           HB2      GLU  60 -15.084  -0.739 -12.198
    4    HB3  GLU  60           HB3      GLU  60 -14.680  -1.076 -13.878
    5    HG2  GLU  60           HG2      GLU  60 -16.703  -2.510 -14.059
    6    HG3  GLU  60           HG3      GLU  60 -17.123  -2.097 -12.410

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLY  61           H        GLY  61 -13.169  -3.100 -14.732
    2    HA3  GLY  61           HA2      GLY  61 -14.903  -5.327 -15.626
    3    HA2  GLY  61           HA3      GLY  61 -14.043  -4.232 -16.702

  No H/Q in entry =           3
  In of MODEL   13
    1    H    ASP  62           H        ASP  62 -12.694  -5.694 -13.813
    2    HA   ASP  62           HA       ASP  62 -10.390  -6.618 -15.188
    3    HB2  ASP  62           HB2      ASP  62  -9.807  -7.610 -13.007
    4    HB3  ASP  62           HB3      ASP  62 -10.355  -5.946 -12.832

  No H/Q in entry =           4
  In of MODEL   13
    1    H    ALA  63           H        ALA  63 -12.587  -7.769 -16.547
    2    HA   ALA  63           HA       ALA  63 -13.202 -10.437 -15.774
    3    HB3  ALA  63           HB1      ALA  63 -14.332  -8.993 -17.571
    4    HB1  ALA  63           HB2      ALA  63 -14.049 -10.677 -18.009
    5    HB2  ALA  63           HB3      ALA  63 -12.978  -9.415 -18.619

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLY  64           H        GLY  64 -10.617  -9.018 -17.690
    2    HA3  GLY  64           HA2      GLY  64  -8.631  -9.837 -18.485
    3    HA2  GLY  64           HA3      GLY  64  -8.693 -10.970 -17.142

  No H/Q in entry =           3
  In of MODEL   13
    1    H    GLU  65           H        GLU  65  -8.155 -12.897 -18.042
    2    HA   GLU  65           HA       GLU  65  -8.832 -13.643 -20.686
    3    HB2  GLU  65           HB2      GLU  65  -7.940 -15.336 -18.351
    4    HB3  GLU  65           HB3      GLU  65  -8.050 -15.902 -20.019
    5    HG2  GLU  65           HG2      GLU  65  -6.380 -13.538 -19.117
    6    HG3  GLU  65           HG3      GLU  65  -5.748 -15.159 -19.399

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLY  66           H        GLY  66  -9.654 -16.176 -20.619
    2    HA3  GLY  66           HA2      GLY  66 -12.452 -16.033 -20.644
    3    HA2  GLY  66           HA3      GLY  66 -11.497 -17.498 -20.764

  No H/Q in entry =           3
  In of MODEL   13
    1    H    LYS  67           H        LYS  67 -10.253 -17.217 -18.188
    2    HA   LYS  67           HA       LYS  67 -12.266 -18.495 -16.611
    3    HB2  LYS  67           HB2      LYS  67  -9.379 -17.810 -16.086
    4    HB3  LYS  67           HB3      LYS  67 -10.393 -18.711 -14.953
    5    HG2  LYS  67           HG2      LYS  67 -10.849 -20.409 -16.649
    6    HG3  LYS  67           HG3      LYS  67  -9.941 -19.491 -17.848
    7    HD2  LYS  67           HD2      LYS  67  -8.425 -21.155 -17.108
    8    HD3  LYS  67           HD3      LYS  67  -7.945 -19.702 -16.226
    9    HE2  LYS  67           HE2      LYS  67  -9.108 -20.424 -14.243
   10    HE3  LYS  67           HE3      LYS  67  -9.873 -21.756 -15.111
   11    HZ1  LYS  67           HZ1      LYS  67  -7.482 -22.498 -15.568
   12    HZ3  LYS  67           HZ2      LYS  67  -8.114 -22.752 -14.013
   13    HZ2  LYS  67           HZ3      LYS  67  -7.052 -21.457 -14.300

  No H/Q in entry =          13
  In of MODEL   13
    1    H    MET  68           H        MET  68 -12.404 -18.050 -14.255
    2    HA   MET  68           HA       MET  68 -13.753 -15.644 -13.791
    3    HB2  MET  68           HB2      MET  68 -12.615 -17.645 -11.836
    4    HB3  MET  68           HB3      MET  68 -13.770 -16.375 -11.426
    5    HG2  MET  68           HG2      MET  68 -14.237 -18.549 -13.489
    6    HG3  MET  68           HG3      MET  68 -14.897 -18.545 -11.853
    7    HE1  MET  68           HE1      MET  68 -16.355 -17.101 -10.879
    8    HE3  MET  68           HE2      MET  68 -17.494 -15.990 -11.636
    9    HE2  MET  68           HE3      MET  68 -15.845 -15.460 -11.309

  No H/Q in entry =           9
  In of MODEL   13
    1    H    LYS  69           H        LYS  69 -10.399 -16.530 -12.921
    2    HA   LYS  69           HA       LYS  69  -9.730 -14.628 -11.119
    3    HB2  LYS  69           HB2      LYS  69  -8.201 -15.903 -13.342
    4    HB3  LYS  69           HB3      LYS  69  -7.425 -14.630 -12.397
    5    HG2  LYS  69           HG2      LYS  69  -6.923 -16.708 -11.295
    6    HG3  LYS  69           HG3      LYS  69  -8.136 -15.892 -10.311
    7    HD2  LYS  69           HD2      LYS  69  -9.902 -17.271 -11.246
    8    HD3  LYS  69           HD3      LYS  69  -8.774 -18.007 -12.386
    9    HE2  LYS  69           HE2      LYS  69  -7.480 -18.947 -10.508
   10    HE3  LYS  69           HE3      LYS  69  -8.603 -18.213  -9.365
   11    HZ3  LYS  69           HZ1      LYS  69  -9.338 -20.398  -9.623
   12    HZ2  LYS  69           HZ2      LYS  69  -9.117 -20.382 -11.307
   13    HZ1  LYS  69           HZ3      LYS  69 -10.385 -19.492 -10.604

  No H/Q in entry =          13
  In of MODEL   13
    1    H    VAL  70           H        VAL  70  -7.752 -12.919 -11.932
    2    HA   VAL  70           HA       VAL  70  -9.095 -10.934 -13.673
    3    HB   VAL  70           HB       VAL  70  -8.328  -9.179 -12.109
    4   HG11  VAL  70          HG11      VAL  70 -10.606 -10.117 -11.906
    5   HG13  VAL  70          HG12      VAL  70  -9.969  -9.662 -10.325
    6   HG12  VAL  70          HG13      VAL  70  -9.995 -11.356 -10.812
    7   HG23  VAL  70          HG21      VAL  70  -7.669 -10.080  -9.754
    8   HG22  VAL  70          HG22      VAL  70  -6.440 -10.105 -11.017
    9   HG21  VAL  70          HG23      VAL  70  -7.296 -11.587 -10.591

  No H/Q in entry =           9
  In of MODEL   13
    1    H    SER  71           H        SER  71  -7.557  -9.234 -14.408
    2    HA   SER  71           HA       SER  71  -5.297 -10.341 -15.695
    3    HB2  SER  71           HB2      SER  71  -6.533  -8.300 -16.464
    4    HB3  SER  71           HB3      SER  71  -5.844  -7.422 -15.101
    5    HG   SER  71           HG       SER  71  -4.363  -8.793 -17.102

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU  72           H        LEU  72  -3.293 -10.640 -15.028
    2    HA   LEU  72           HA       LEU  72  -2.579 -10.431 -12.314
    3    HB2  LEU  72           HB2      LEU  72  -0.923 -10.883 -14.792
    4    HB3  LEU  72           HB3      LEU  72  -0.266 -10.959 -13.161
    5    HG   LEU  72           HG       LEU  72  -2.631 -12.629 -14.072
    6   HD12  LEU  72          HD11      LEU  72   0.223 -13.575 -13.750
    7   HD11  LEU  72          HD12      LEU  72  -0.427 -13.059 -15.305
    8   HD13  LEU  72          HD13      LEU  72  -1.136 -14.441 -14.469
    9   HD21  LEU  72          HD21      LEU  72  -0.903 -12.506 -11.607
   10   HD23  LEU  72          HD22      LEU  72  -1.645 -14.033 -12.059
   11   HD22  LEU  72          HD23      LEU  72  -2.655 -12.631 -11.718

  No H/Q in entry =          11
  In of MODEL   13
    1    H    VAL  73           H        VAL  73  -1.830  -8.427 -15.095
    2    HA   VAL  73           HA       VAL  73   0.107  -6.749 -13.987
    3    HB   VAL  73           HB       VAL  73  -0.275  -5.320 -15.843
    4   HG13  VAL  73          HG11      VAL  73  -0.161  -6.872 -17.661
    5   HG12  VAL  73          HG12      VAL  73  -1.114  -8.070 -16.787
    6   HG11  VAL  73          HG13      VAL  73   0.529  -7.701 -16.268
    7   HG22  VAL  73          HG21      VAL  73  -2.547  -4.804 -15.883
    8   HG21  VAL  73          HG22      VAL  73  -3.036  -6.488 -15.712
    9   HG23  VAL  73          HG23      VAL  73  -2.429  -5.900 -17.259

  No H/Q in entry =           9
  In of MODEL   13
    1    H    LEU  74           H        LEU  74  -3.293  -6.824 -13.440
    2    HA   LEU  74           HA       LEU  74  -3.882  -4.160 -12.833
    3    HB2  LEU  74           HB2      LEU  74  -5.634  -5.798 -13.009
    4    HB3  LEU  74           HB3      LEU  74  -4.955  -6.739 -11.683
    5    HG   LEU  74           HG       LEU  74  -5.390  -4.861 -10.131
    6   HD13  LEU  74          HD11      LEU  74  -5.259  -2.925 -11.498
    7   HD12  LEU  74          HD12      LEU  74  -6.968  -3.057 -11.088
    8   HD11  LEU  74          HD13      LEU  74  -6.398  -3.578 -12.675
    9   HD21  LEU  74          HD21      LEU  74  -7.110  -6.686 -10.979
   10   HD23  LEU  74          HD22      LEU  74  -7.926  -5.263 -11.591
   11   HD22  LEU  74          HD23      LEU  74  -7.608  -5.404  -9.879

  No H/Q in entry =          11
  In of MODEL   13
    1    H    VAL  75           H        VAL  75  -2.879  -6.757 -10.665
    2    HA   VAL  75           HA       VAL  75  -2.670  -5.205  -8.322
    3    HB   VAL  75           HB       VAL  75  -1.193  -7.715  -9.102
    4   HG12  VAL  75          HG11      VAL  75  -0.772  -7.871  -6.617
    5   HG11  VAL  75          HG12      VAL  75  -1.420  -6.247  -6.449
    6   HG13  VAL  75          HG13      VAL  75   0.056  -6.508  -7.362
    7   HG22  VAL  75          HG21      VAL  75  -3.639  -7.943  -8.953
    8   HG21  VAL  75          HG22      VAL  75  -3.634  -7.150  -7.377
    9   HG23  VAL  75          HG23      VAL  75  -2.880  -8.734  -7.570

  No H/Q in entry =           9
  In of MODEL   13
    1    H    GLU  76           H        GLU  76  -0.262  -5.997 -10.850
    2    HA   GLU  76           HA       GLU  76   1.936  -4.674  -9.686
    3    HB2  GLU  76           HB2      GLU  76   2.120  -6.156 -11.670
    4    HB3  GLU  76           HB3      GLU  76   1.237  -4.979 -12.629
    5    HG2  GLU  76           HG2      GLU  76   3.582  -4.685 -13.110
    6    HG3  GLU  76           HG3      GLU  76   3.084  -3.308 -12.146

  No H/Q in entry =           6
  In of MODEL   13
    1    H    ALA  77           H        ALA  77  -0.574  -3.446 -11.885
    2    HA   ALA  77           HA       ALA  77   0.448  -0.812 -12.061
    3    HB1  ALA  77           HB1      ALA  77  -1.337  -1.903 -13.528
    4    HB2  ALA  77           HB2      ALA  77  -1.639  -0.232 -13.049
    5    HB3  ALA  77           HB3      ALA  77  -2.477  -1.550 -12.229

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLN  78           H        GLN  78  -1.846  -2.338  -9.856
    2    HA   GLN  78           HA       GLN  78  -2.631  -0.008  -8.460
    3    HB2  GLN  78           HB2      GLN  78  -3.769  -2.253  -8.376
    4    HB3  GLN  78           HB3      GLN  78  -2.441  -2.829  -7.371
    5    HG2  GLN  78           HG2      GLN  78  -2.939  -1.086  -5.708
    6    HG3  GLN  78           HG3      GLN  78  -4.268  -0.504  -6.710
    7   HE21  GLN  78          HE21      GLN  78  -6.090  -1.119  -5.464
    8   HE22  GLN  78          HE22      GLN  78  -6.399  -2.716  -4.978

  No H/Q in entry =           8
  In of MODEL   13
    1    H    LEU  79           H        LEU  79   0.020  -2.294  -7.998
    2    HA   LEU  79           HA       LEU  79   0.997  -1.405  -5.538
    3    HB2  LEU  79           HB2      LEU  79   1.849  -3.425  -6.601
    4    HB3  LEU  79           HB3      LEU  79   2.510  -2.482  -7.933
    5    HG   LEU  79           HG       LEU  79   4.073  -1.358  -6.425
    6   HD13  LEU  79          HD11      LEU  79   3.064  -1.099  -4.362
    7   HD12  LEU  79          HD12      LEU  79   4.126  -2.460  -4.012
    8   HD11  LEU  79          HD13      LEU  79   2.419  -2.741  -4.348
    9   HD23  LEU  79          HD21      LEU  79   5.257  -3.519  -5.515
   10   HD22  LEU  79          HD22      LEU  79   5.062  -3.319  -7.254
   11   HD21  LEU  79          HD23      LEU  79   3.969  -4.376  -6.364

  No H/Q in entry =          11
  In of MODEL   13
    1    H    HIS  80           H        HIS  80   1.892  -0.302  -8.809
    2    HA   HIS  80           HA       HIS  80   3.717   1.667  -7.883
    3    HB2  HIS  80           HB2      HIS  80   2.430   0.983 -10.470
    4    HB3  HIS  80           HB3      HIS  80   3.041   2.629 -10.299
    5    HD1  HIS  80           HD1      HIS  80   5.448   2.904 -10.813
    6    HD2  HIS  80           HD2      HIS  80   4.583  -0.997  -9.620
    7    HE1  HIS  80           HE1      HIS  80   7.625   1.603 -10.969
    8    HE2  HIS  80           HE2      HIS  80   7.109  -0.777 -10.245

  No H/Q in entry =           8
  In of MODEL   13
    1    H    LEU  81           H        LEU  81   0.319   1.862  -8.876
    2    HA   LEU  81           HA       LEU  81   0.071   4.657  -8.549
    3    HB2  LEU  81           HB2      LEU  81  -1.967   2.433  -8.475
    4    HB3  LEU  81           HB3      LEU  81  -2.402   4.140  -8.386
    5    HG   LEU  81           HG       LEU  81  -0.712   2.971 -10.615
    6   HD12  LEU  81          HD11      LEU  81  -2.936   3.311 -11.922
    7   HD11  LEU  81          HD12      LEU  81  -3.699   3.252 -10.334
    8   HD13  LEU  81          HD13      LEU  81  -2.767   1.875 -10.916
    9   HD23  LEU  81          HD21      LEU  81  -1.784   5.125 -11.718
   10   HD22  LEU  81          HD22      LEU  81  -0.369   5.282 -10.680
   11   HD21  LEU  81          HD23      LEU  81  -1.973   5.647 -10.046

  No H/Q in entry =          11
  In of MODEL   13
    1    H    MET  82           H        MET  82  -0.623   1.980  -6.300
    2    HA   MET  82           HA       MET  82  -1.667   3.579  -4.218
    3    HB2  MET  82           HB2      MET  82  -0.320   0.878  -4.249
    4    HB3  MET  82           HB3      MET  82  -0.897   1.611  -2.754
    5    HG2  MET  82           HG2      MET  82  -2.625   1.131  -5.202
    6    HG3  MET  82           HG3      MET  82  -2.563   0.058  -3.805
    7    HE3  MET  82           HE1      MET  82  -4.280   1.728  -0.998
    8    HE2  MET  82           HE2      MET  82  -2.546   1.989  -1.177
    9    HE1  MET  82           HE3      MET  82  -3.248   0.437  -1.632

  No H/Q in entry =           9
  In of MODEL   13
    1    H    THR  83           H        THR  83   1.625   2.460  -4.894
    2    HA   THR  83           HA       THR  83   2.845   3.556  -2.590
    3    HB   THR  83           HB       THR  83   4.944   3.478  -4.056
    4    HG1  THR  83           HG1      THR  83   4.707   2.952  -6.080
    5   HG22  THR  83          HG21      THR  83   4.476   0.824  -4.387
    6   HG21  THR  83          HG22      THR  83   3.186   1.217  -3.252
    7   HG23  THR  83          HG23      THR  83   4.867   1.545  -2.826

  No H/Q in entry =           7
  In of MODEL   13
    1    H    SER  84           H        SER  84   2.499   4.835  -5.893
    2    HA   SER  84           HA       SER  84   3.860   7.263  -5.436
    3    HB2  SER  84           HB2      SER  84   1.789   6.448  -7.462
    4    HB3  SER  84           HB3      SER  84   2.483   8.069  -7.436
    5    HG   SER  84           HG       SER  84   3.833   5.580  -7.719

  No H/Q in entry =           5
  In of MODEL   13
    1    H    MET  85           H        MET  85   0.358   6.540  -5.276
    2    HA   MET  85           HA       MET  85  -0.481   9.159  -4.681
    3    HB2  MET  85           HB2      MET  85  -2.017   7.362  -5.354
    4    HB3  MET  85           HB3      MET  85  -1.744   6.558  -3.809
    5    HG2  MET  85           HG2      MET  85  -2.628   8.518  -2.614
    6    HG3  MET  85           HG3      MET  85  -2.862   9.356  -4.147
    7    HE2  MET  85           HE1      MET  85  -5.129   5.858  -2.348
    8    HE1  MET  85           HE2      MET  85  -3.508   6.445  -1.986
    9    HE3  MET  85           HE3      MET  85  -3.761   5.371  -3.358

  No H/Q in entry =           9
  In of MODEL   13
    1    H    LEU  86           H        LEU  86   0.405   6.490  -2.531
    2    HA   LEU  86           HA       LEU  86  -0.124   7.800  -0.092
    3    HB2  LEU  86           HB2      LEU  86   0.316   5.324  -0.482
    4    HB3  LEU  86           HB3      LEU  86   2.028   5.737  -0.571
    5    HG   LEU  86           HG       LEU  86   1.706   6.903   1.695
    6   HD11  LEU  86          HD11      LEU  86  -0.994   6.164   1.214
    7   HD13  LEU  86          HD12      LEU  86  -0.325   6.906   2.666
    8   HD12  LEU  86          HD13      LEU  86  -0.434   5.151   2.548
    9   HD23  LEU  86          HD21      LEU  86   1.246   3.915   1.818
   10   HD22  LEU  86          HD22      LEU  86   2.255   4.915   2.861
   11   HD21  LEU  86          HD23      LEU  86   2.759   4.584   1.204

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ALA  87           H        ALA  87   2.860   7.473  -1.970
    2    HA   ALA  87           HA       ALA  87   4.575   8.866  -0.240
    3    HB3  ALA  87           HB1      ALA  87   4.669   7.850  -2.946
    4    HB2  ALA  87           HB2      ALA  87   6.003   8.167  -1.841
    5    HB1  ALA  87           HB3      ALA  87   5.406   9.453  -2.888

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ARG  88           H        ARG  88   2.650  10.021  -2.969
    2    HA   ARG  88           HA       ARG  88   3.454  12.702  -2.851
    3    HB2  ARG  88           HB2      ARG  88   2.193  11.562  -4.712
    4    HB3  ARG  88           HB3      ARG  88   0.734  11.723  -3.734
    5    HG2  ARG  88           HG2      ARG  88   1.783  14.291  -3.649
    6    HG3  ARG  88           HG3      ARG  88   2.207  13.771  -5.278
    7    HD2  ARG  88           HD2      ARG  88   0.069  13.875  -5.983
    8    HD3  ARG  88           HD3      ARG  88  -0.533  13.030  -4.556
    9    HE   ARG  88           HE       ARG  88  -0.688  15.810  -4.977
   10   HH21  ARG  88          HH11      ARG  88  -1.206  17.146  -3.242
   11   HH22  ARG  88          HH12      ARG  88  -0.922  16.607  -1.623
   12   HH11  ARG  88          HH21      ARG  88   0.293  13.537  -2.598
   13   HH12  ARG  88          HH22      ARG  88  -0.091  14.558  -1.258

  No H/Q in entry =          13
  In of MODEL   13
    1    H    GLU  89           H        GLU  89   0.725  11.061  -1.219
    2    HA   GLU  89           HA       GLU  89  -0.359  13.386  -0.020
    3    HB2  GLU  89           HB2      GLU  89  -1.503  11.160  -0.109
    4    HB3  GLU  89           HB3      GLU  89  -0.390  10.592   1.136
    5    HG2  GLU  89           HG2      GLU  89  -1.195  12.302   2.692
    6    HG3  GLU  89           HG3      GLU  89  -2.235  12.984   1.444

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LEU  90           H        LEU  90   2.060  11.065   1.164
    2    HA   LEU  90           HA       LEU  90   2.423  12.307   3.694
    3    HB2  LEU  90           HB2      LEU  90   4.180  10.510   2.024
    4    HB3  LEU  90           HB3      LEU  90   4.600  11.022   3.664
    5    HG   LEU  90           HG       LEU  90   1.951   9.709   2.994
    6   HD12  LEU  90          HD11      LEU  90   3.062   7.650   4.008
    7   HD11  LEU  90          HD12      LEU  90   4.596   8.486   3.770
    8   HD13  LEU  90          HD13      LEU  90   3.583   8.091   2.380
    9   HD22  LEU  90          HD21      LEU  90   1.691  10.637   5.115
   10   HD21  LEU  90          HD22      LEU  90   3.406  10.508   5.503
   11   HD23  LEU  90          HD23      LEU  90   2.381   9.074   5.549

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  91           H        ILE  91   4.042  12.667   0.573
    2    HA   ILE  91           HA       ILE  91   6.039  14.474   1.418
    3    HB   ILE  91           HB       ILE  91   4.730  13.999  -1.266
    4   HG12  ILE  91          HG12      ILE  91   7.553  13.475  -0.283
    5   HG13  ILE  91          HG13      ILE  91   6.255  12.295  -0.124
    6   HG22  ILE  91          HG21      ILE  91   6.972  15.316  -1.948
    7   HG21  ILE  91          HG22      ILE  91   6.667  16.122  -0.408
    8   HG23  ILE  91          HG23      ILE  91   5.449  16.166  -1.681
    9   HD13  ILE  91          HD11      ILE  91   6.085  11.972  -2.431
   10   HD12  ILE  91          HD12      ILE  91   7.822  12.193  -2.212
   11   HD11  ILE  91          HD13      ILE  91   6.831  13.528  -2.802

  No H/Q in entry =          11
  In of MODEL   13
    1    H    THR  92           H        THR  92   2.686  14.949   0.398
    2    HA   THR  92           HA       THR  92   2.697  17.773   0.337
    3    HB   THR  92           HB       THR  92   0.501  15.807   1.029
    4    HG1  THR  92           HG1      THR  92   0.810  15.623  -1.054
    5   HG22  THR  92          HG21      THR  92  -0.869  17.987   0.302
    6   HG21  THR  92          HG22      THR  92   0.532  18.794   1.003
    7   HG23  THR  92          HG23      THR  92  -0.427  17.685   1.982

  No H/Q in entry =           7
  In of MODEL   13
    1    H    GLU  93           H        GLU  93   2.110  15.481   2.990
    2    HA   GLU  93           HA       GLU  93   1.596  17.393   5.005
    3    HB2  GLU  93           HB2      GLU  93   2.872  14.651   5.247
    4    HB3  GLU  93           HB3      GLU  93   2.189  15.588   6.577
    5    HG2  GLU  93           HG2      GLU  93   0.575  14.830   4.133
    6    HG3  GLU  93           HG3      GLU  93   0.658  13.807   5.562

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LEU  94           H        LEU  94   4.587  15.870   3.866
    2    HA   LEU  94           HA       LEU  94   6.346  16.995   5.760
    3    HB2  LEU  94           HB2      LEU  94   6.744  16.022   2.931
    4    HB3  LEU  94           HB3      LEU  94   8.079  16.662   3.884
    5    HG   LEU  94           HG       LEU  94   6.307  14.490   5.015
    6   HD11  LEU  94          HD11      LEU  94   8.406  14.235   2.890
    7   HD13  LEU  94          HD12      LEU  94   6.946  13.281   3.147
    8   HD12  LEU  94          HD13      LEU  94   8.365  13.009   4.159
    9   HD23  LEU  94          HD21      LEU  94   8.485  13.925   6.174
   10   HD22  LEU  94          HD22      LEU  94   7.838  15.512   6.588
   11   HD21  LEU  94          HD23      LEU  94   9.178  15.373   5.450

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  95           H        ILE  95   5.233  18.181   2.606
    2    HA   ILE  95           HA       ILE  95   6.836  20.517   2.551
    3    HB   ILE  95           HB       ILE  95   4.188  19.868   1.236
    4   HG12  ILE  95          HG12      ILE  95   6.985  20.167   0.109
    5   HG13  ILE  95          HG13      ILE  95   6.313  18.623   0.622
    6   HG21  ILE  95          HG21      ILE  95   5.971  22.311   1.021
    7   HG23  ILE  95          HG22      ILE  95   4.244  22.267   1.371
    8   HG22  ILE  95          HG23      ILE  95   4.827  21.858  -0.242
    9   HD13  ILE  95          HD11      ILE  95   4.758  18.567  -1.112
   10   HD12  ILE  95          HD12      ILE  95   6.121  19.367  -1.896
   11   HD11  ILE  95          HD13      ILE  95   4.759  20.320  -1.309

  No H/Q in entry =          11
  In of MODEL   13
    1    H    GLU  96           H        GLU  96   3.575  19.909   3.835
    2    HA   GLU  96           HA       GLU  96   2.988  22.564   4.583
    3    HB2  GLU  96           HB2      GLU  96   1.289  20.804   4.590
    4    HB3  GLU  96           HB3      GLU  96   2.135  19.966   5.888
    5    HG2  GLU  96           HG2      GLU  96   1.127  21.264   7.454
    6    HG3  GLU  96           HG3      GLU  96   1.685  22.730   6.658

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LEU  97           H        LEU  97   4.790  19.990   6.215
    2    HA   LEU  97           HA       LEU  97   5.158  21.334   8.687
    3    HB2  LEU  97           HB2      LEU  97   6.670  19.144   7.279
    4    HB3  LEU  97           HB3      LEU  97   7.264  19.822   8.792
    5    HG   LEU  97           HG       LEU  97   4.441  18.766   8.473
    6   HD12  LEU  97          HD11      LEU  97   5.349  16.742   9.689
    7   HD11  LEU  97          HD12      LEU  97   6.970  17.351   9.351
    8   HD13  LEU  97          HD13      LEU  97   5.898  16.907   8.021
    9   HD23  LEU  97          HD21      LEU  97   4.881  18.467  11.039
   10   HD22  LEU  97          HD22      LEU  97   4.525  20.084  10.432
   11   HD21  LEU  97          HD23      LEU  97   6.189  19.621  10.783

  No H/Q in entry =          11
  In of MODEL   13
    1    H    HIS  98           H        HIS  98   7.039  21.323   5.668
    2    HA   HIS  98           HA       HIS  98   9.211  22.873   6.573
    3    HB2  HIS  98           HB2      HIS  98   7.924  22.635   3.843
    4    HB3  HIS  98           HB3      HIS  98   9.376  23.593   4.138
    5    HD1  HIS  98           HD1      HIS  98   8.115  20.040   4.155
    6    HD2  HIS  98           HD2      HIS  98  11.724  22.086   4.592
    7    HE1  HIS  98           HE1      HIS  98   9.945  18.285   4.105
    8    HE2  HIS  98           HE2      HIS  98  12.147  19.510   4.371

  No H/Q in entry =           8
  In of MODEL   13
    1    H    GLU  99           H        GLU  99   6.006  23.753   5.387
    2    HA   GLU  99           HA       GLU  99   6.425  26.562   5.329
    3    HB2  GLU  99           HB2      GLU  99   4.533  25.419   4.192
    4    HB3  GLU  99           HB3      GLU  99   3.827  25.068   5.769
    5    HG2  GLU  99           HG2      GLU  99   3.679  27.462   6.269
    6    HG3  GLU  99           HG3      GLU  99   4.466  27.851   4.742

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LYS 100           H        LYS 100   5.254  24.344   7.848
    2    HA   LYS 100           HA       LYS 100   4.690  26.407   9.739
    3    HB2  LYS 100           HB2      LYS 100   5.222  23.448  10.088
    4    HB3  LYS 100           HB3      LYS 100   4.786  24.527  11.418
    5    HG2  LYS 100           HG2      LYS 100   2.734  25.194  10.163
    6    HG3  LYS 100           HG3      LYS 100   3.148  24.019   8.912
    7    HD2  LYS 100           HD2      LYS 100   3.039  22.200  10.574
    8    HD3  LYS 100           HD3      LYS 100   2.641  23.369  11.836
    9    HE2  LYS 100           HE2      LYS 100   0.602  24.019  10.565
   10    HE3  LYS 100           HE3      LYS 100   0.988  22.793   9.351
   11    HZ1  LYS 100           HZ1      LYS 100   0.703  22.131  12.232
   12    HZ3  LYS 100           HZ2      LYS 100   0.677  21.077  10.897
   13    HZ2  LYS 100           HZ3      LYS 100  -0.625  22.135  11.172

  No H/Q in entry =          13
  In of MODEL   13
    1    H    LEU 101           H        LEU 101   7.591  24.569   8.916
    2    HA   LEU 101           HA       LEU 101   9.194  25.387  11.125
    3    HB2  LEU 101           HB2      LEU 101   9.783  24.390   8.349
    4    HB3  LEU 101           HB3      LEU 101  11.091  25.037   9.335
    5    HG   LEU 101           HG       LEU 101   9.225  22.908  10.393
    6   HD12  LEU 101          HD11      LEU 101  11.259  21.383   9.792
    7   HD11  LEU 101          HD12      LEU 101  11.648  22.640   8.620
    8   HD13  LEU 101          HD13      LEU 101  10.107  21.790   8.521
    9   HD21  LEU 101          HD21      LEU 101  11.962  23.977  11.129
   10   HD23  LEU 101          HD22      LEU 101  11.394  22.413  11.708
   11   HD22  LEU 101          HD23      LEU 101  10.522  23.882  12.142

  No H/Q in entry =          11
  In of MODEL   13
    1    H    LYS 102           H        LYS 102   7.645  27.272   8.978
    2    HA   LYS 102           HA       LYS 102   7.757  29.564   8.685
    3    HB2  LYS 102           HB2      LYS 102   9.313  29.426  10.789
    4    HB3  LYS 102           HB3      LYS 102  10.619  29.601   9.634
    5    HG2  LYS 102           HG2      LYS 102   8.540  31.585  10.488
    6    HG3  LYS 102           HG3      LYS 102  10.257  31.820  10.242
    7    HD2  LYS 102           HD2      LYS 102   8.307  31.425   7.936
    8    HD3  LYS 102           HD3      LYS 102   8.711  32.999   8.605
    9    HE2  LYS 102           HE2      LYS 102  10.074  31.793   6.537
   10    HE3  LYS 102           HE3      LYS 102  10.706  33.091   7.550
   11    HZ2  LYS 102           HZ1      LYS 102  12.199  31.164   7.380
   12    HZ1  LYS 102           HZ2      LYS 102  11.020  30.199   8.119
   13    HZ3  LYS 102           HZ3      LYS 102  11.728  31.476   8.980

  No H/Q in entry =          13
  In of MODEL   13
    1    H    ALA 103           H        ALA 103  10.996  28.176   8.132
    2    HA   ALA 103           HA       ALA 103  11.987  29.538   6.060
    3    HB2  ALA 103           HB1      ALA 103  12.843  27.310   5.136
    4    HB1  ALA 103           HB2      ALA 103  11.932  26.550   6.439
    5    HB3  ALA 103           HB3      ALA 103  13.237  27.675   6.816

  No H/Q in entry =           5
  In of MODEL   13
    1    H1   LYS   3           H1       LYS   3 -31.829   5.772 -19.556
    2    H2   LYS   3           H3       LYS   3 -30.834   5.565 -20.915
    3    H3   LYS   3           H2       LYS   3 -32.175   4.549 -20.682
    4    HA   LYS   3           HA       LYS   3 -31.092   3.188 -19.311
    5    HB2  LYS   3           HB2      LYS   3 -28.897   4.748 -20.624
    6    HB3  LYS   3           HB3      LYS   3 -28.500   3.534 -19.407
    7    HG2  LYS   3           HG2      LYS   3 -29.843   1.902 -20.785
    8    HG3  LYS   3           HG3      LYS   3 -29.869   3.129 -22.050
    9    HD2  LYS   3           HD2      LYS   3 -27.383   3.148 -22.013
   10    HD3  LYS   3           HD3      LYS   3 -27.425   1.821 -20.853
   11    HE2  LYS   3           HE2      LYS   3 -28.869   0.602 -22.587
   12    HE3  LYS   3           HE3      LYS   3 -28.319   1.835 -23.721
   13    HZ3  LYS   3           HZ1      LYS   3 -26.459   0.711 -24.023
   14    HZ2  LYS   3           HZ2      LYS   3 -27.019  -0.511 -22.986
   15    HZ1  LYS   3           HZ3      LYS   3 -26.095   0.772 -22.366

  No H/Q in entry =          15
  In of MODEL   13
    1    H    LYS   4           H        LYS   4 -31.126   3.000 -17.254
    2    HA   LYS   4           HA       LYS   4 -30.509   5.288 -15.559
    3    HB2  LYS   4           HB2      LYS   4 -31.562   2.521 -14.911
    4    HB3  LYS   4           HB3      LYS   4 -31.407   3.846 -13.758
    5    HG2  LYS   4           HG2      LYS   4 -33.222   3.739 -16.172
    6    HG3  LYS   4           HG3      LYS   4 -33.704   3.729 -14.478
    7    HD2  LYS   4           HD2      LYS   4 -33.125   5.978 -14.168
    8    HD3  LYS   4           HD3      LYS   4 -32.092   6.004 -15.596
    9    HE2  LYS   4           HE2      LYS   4 -34.090   7.284 -16.021
   10    HE3  LYS   4           HE3      LYS   4 -34.098   5.829 -17.020
   11    HZ3  LYS   4           HZ1      LYS   4 -35.615   4.804 -15.485
   12    HZ2  LYS   4           HZ2      LYS   4 -36.251   6.280 -16.036
   13    HZ1  LYS   4           HZ3      LYS   4 -35.580   6.171 -14.479

  No H/Q in entry =          13
  In of MODEL   13
    1    H    HIS   5           H        HIS   5 -29.038   5.417 -13.973
    2    HA   HIS   5           HA       HIS   5 -26.666   3.716 -14.352
    3    HB2  HIS   5           HB2      HIS   5 -27.056   6.428 -13.087
    4    HB3  HIS   5           HB3      HIS   5 -25.527   5.552 -13.097
    5    HD1  HIS   5           HD1      HIS   5 -24.129   6.859 -14.667
    6    HD2  HIS   5           HD2      HIS   5 -27.902   6.074 -16.218
    7    HE1  HIS   5           HE1      HIS   5 -24.005   7.497 -17.106
    8    HE2  HIS   5           HE2      HIS   5 -26.304   7.006 -18.019

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ILE   6           H        ILE   6 -26.350   2.130 -13.069
    2    HA   ILE   6           HA       ILE   6 -27.322   2.291 -10.296
    3    HB   ILE   6           HB       ILE   6 -26.381  -0.098 -11.889
    4   HG12  ILE   6          HG12      ILE   6 -29.163   0.680 -11.005
    5   HG13  ILE   6          HG13      ILE   6 -28.539   0.908 -12.639
    6   HG23  ILE   6          HG21      ILE   6 -26.680  -1.406 -10.053
    7   HG22  ILE   6          HG22      ILE   6 -27.890  -0.335  -9.344
    8   HG21  ILE   6          HG23      ILE   6 -26.180   0.087  -9.256
    9   HD13  ILE   6          HD11      ILE   6 -28.893  -1.221 -13.182
   10   HD12  ILE   6          HD12      ILE   6 -29.900  -1.286 -11.735
   11   HD11  ILE   6          HD13      ILE   6 -28.217  -1.810 -11.663

  No H/Q in entry =          11
  In of MODEL   13
    1    H    TYR   7           H        TYR   7 -25.591   2.994  -9.004
    2    HA   TYR   7           HA       TYR   7 -22.839   2.190  -9.715
    3    HB2  TYR   7           HB2      TYR   7 -23.916   4.540  -8.180
    4    HB3  TYR   7           HB3      TYR   7 -22.208   4.112  -8.236
    5    HD1  TYR   7           HD1      TYR   7 -23.215   3.182 -11.341
    6    HD2  TYR   7           HD2      TYR   7 -22.715   6.737  -9.044
    7    HE1  TYR   7           HE1      TYR   7 -22.857   4.475 -13.407
    8    HE2  TYR   7           HE2      TYR   7 -22.398   8.034 -11.102
    9    HH   TYR   7           HH       TYR   7 -22.624   7.982 -13.334

  No H/Q in entry =           9
  In of MODEL   13
    1    H    LEU   8           H        LEU   8 -21.799   0.861  -8.418
    2    HA   LEU   8           HA       LEU   8 -22.889   0.254  -5.741
    3    HB2  LEU   8           HB2      LEU   8 -21.115  -1.282  -7.617
    4    HB3  LEU   8           HB3      LEU   8 -21.271  -1.709  -5.913
    5    HG   LEU   8           HG       LEU   8 -23.742  -1.997  -6.328
    6   HD13  LEU   8          HD11      LEU   8 -23.944  -0.745  -8.411
    7   HD12  LEU   8          HD12      LEU   8 -24.392  -2.429  -8.684
    8   HD11  LEU   8          HD13      LEU   8 -22.814  -1.840  -9.206
    9   HD23  LEU   8          HD21      LEU   8 -22.375  -3.936  -8.069
   10   HD22  LEU   8          HD22      LEU   8 -23.446  -4.186  -6.690
   11   HD21  LEU   8          HD23      LEU   8 -21.757  -3.753  -6.428

  No H/Q in entry =          11
  In of MODEL   13
    1    H    PHE   9           H        PHE   9 -21.636   0.694  -3.955
    2    HA   PHE   9           HA       PHE   9 -18.901   1.773  -4.454
    3    HB2  PHE   9           HB2      PHE   9 -20.970   2.711  -2.471
    4    HB3  PHE   9           HB3      PHE   9 -19.285   3.211  -2.441
    5    HD1  PHE   9           HD1      PHE   9 -18.357   4.631  -4.188
    6    HD2  PHE   9           HD2      PHE   9 -22.484   3.460  -4.255
    7    HE1  PHE   9           HE1      PHE   9 -18.813   6.338  -5.923
    8    HE2  PHE   9           HE2      PHE   9 -22.942   5.178  -5.985
    9    HZ   PHE   9           HZ       PHE   9 -21.104   6.614  -6.825

  No H/Q in entry =           9
  In of MODEL   13
    1    H    SER  10           H        SER  10 -17.261   0.895  -3.350
    2    HA   SER  10           HA       SER  10 -17.418  -0.056  -0.677
    3    HB2  SER  10           HB2      SER  10 -18.552  -1.965  -1.746
    4    HB3  SER  10           HB3      SER  10 -17.194  -2.144  -2.846
    5    HG   SER  10           HG       SER  10 -17.052  -2.273  -0.019

  No H/Q in entry =           5
  In of MODEL   13
    1    H    SER  11           H        SER  11 -15.404   0.147   0.156
    2    HA   SER  11           HA       SER  11 -13.269   1.110  -1.391
    3    HB2  SER  11           HB2      SER  11 -13.758   1.182   1.195
    4    HB3  SER  11           HB3      SER  11 -12.731  -0.254   1.201
    5    HG   SER  11           HG       SER  11 -11.202   1.213   1.213

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA  12           H        ALA  12 -14.346  -1.637  -2.187
    2    HA   ALA  12           HA       ALA  12 -11.714  -2.759  -2.734
    3    HB1  ALA  12           HB1      ALA  12 -13.794  -4.180  -1.097
    4    HB2  ALA  12           HB2      ALA  12 -12.058  -4.054  -0.819
    5    HB3  ALA  12           HB3      ALA  12 -12.669  -5.093  -2.106

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLY  13           H        GLY  13 -12.651  -1.739  -4.729
    2    HA3  GLY  13           HA2      GLY  13 -14.829  -2.637  -6.184
    3    HA2  GLY  13           HA3      GLY  13 -13.336  -2.030  -6.915

  No H/Q in entry =           3
  In of MODEL   13
    1    H    MET  14           H        MET  14 -11.760  -4.277  -5.738
    2    HA   MET  14           HA       MET  14 -11.786  -6.006  -7.928
    3    HB2  MET  14           HB2      MET  14  -9.878  -5.929  -6.378
    4    HB3  MET  14           HB3      MET  14 -10.833  -6.739  -5.137
    5    HG2  MET  14           HG2      MET  14  -9.493  -8.426  -6.209
    6    HG3  MET  14           HG3      MET  14 -11.138  -8.650  -6.805
    7    HE1  MET  14           HE1      MET  14  -7.787  -8.954  -7.731
    8    HE3  MET  14           HE2      MET  14  -7.593  -7.220  -7.481
    9    HE2  MET  14           HE3      MET  14  -7.386  -7.897  -9.094

  No H/Q in entry =           9
  In of MODEL   13
    1    H    SER  15           H        SER  15 -13.296  -6.608  -4.765
    2    HA   SER  15           HA       SER  15 -14.458  -9.102  -5.701
    3    HB2  SER  15           HB2      SER  15 -14.901  -7.560  -3.136
    4    HB3  SER  15           HB3      SER  15 -15.800  -9.016  -3.557
    5    HG   SER  15           HG       SER  15 -12.987  -8.718  -3.220

  No H/Q in entry =           5
  In of MODEL   13
    1    H    THR  16           H        THR  16 -15.600  -5.772  -5.234
    2    HA   THR  16           HA       THR  16 -18.385  -6.288  -5.778
    3    HB   THR  16           HB       THR  16 -16.847  -3.710  -6.251
    4    HG1  THR  16           HG1      THR  16 -16.422  -4.358  -4.172
    5   HG22  THR  16          HG21      THR  16 -19.664  -3.982  -5.253
    6   HG21  THR  16          HG22      THR  16 -19.332  -4.128  -6.988
    7   HG23  THR  16          HG23      THR  16 -18.916  -2.645  -6.119

  No H/Q in entry =           7
  In of MODEL   13
    1    H    SER  17           H        SER  17 -15.548  -5.601  -7.629
    2    HA   SER  17           HA       SER  17 -16.723  -4.869 -10.112
    3    HB2  SER  17           HB2      SER  17 -14.028  -6.088  -9.466
    4    HB3  SER  17           HB3      SER  17 -14.504  -5.590 -11.091
    5    HG   SER  17           HG       SER  17 -14.857  -3.738  -9.056

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU  18           H        LEU  18 -15.988  -8.009  -8.730
    2    HA   LEU  18           HA       LEU  18 -16.507  -9.488 -11.113
    3    HB2  LEU  18           HB2      LEU  18 -15.235 -10.377  -9.171
    4    HB3  LEU  18           HB3      LEU  18 -16.727 -10.369  -8.230
    5    HG   LEU  18           HG       LEU  18 -17.726 -11.952  -9.848
    6   HD11  LEU  18          HD11      LEU  18 -15.038 -11.591 -11.132
    7   HD13  LEU  18          HD12      LEU  18 -16.634 -11.632 -11.880
    8   HD12  LEU  18          HD13      LEU  18 -15.893 -13.123 -11.302
    9   HD21  LEU  18          HD21      LEU  18 -15.237 -12.628  -8.355
   10   HD23  LEU  18          HD22      LEU  18 -16.111 -13.863  -9.264
   11   HD22  LEU  18          HD23      LEU  18 -16.919 -12.988  -7.964

  No H/Q in entry =          11
  In of MODEL   13
    1    H    LEU  19           H        LEU  19 -18.523  -8.438  -8.372
    2    HA   LEU  19           HA       LEU  19 -20.925  -9.730  -9.220
    3    HB2  LEU  19           HB2      LEU  19 -20.676  -8.921  -6.951
    4    HB3  LEU  19           HB3      LEU  19 -20.506  -7.267  -7.534
    5    HG   LEU  19           HG       LEU  19 -22.840  -7.218  -8.184
    6   HD11  LEU  19          HD11      LEU  19 -22.676 -10.121  -7.520
    7   HD13  LEU  19          HD12      LEU  19 -23.525  -9.316  -8.839
    8   HD12  LEU  19          HD13      LEU  19 -24.189  -9.271  -7.208
    9   HD23  LEU  19          HD21      LEU  19 -22.596  -8.310  -5.392
   10   HD22  LEU  19          HD22      LEU  19 -23.784  -7.159  -6.004
   11   HD21  LEU  19          HD23      LEU  19 -22.092  -6.686  -5.861

  No H/Q in entry =          11
  In of MODEL   13
    1    H    VAL  20           H        VAL  20 -19.597  -6.483  -9.855
    2    HA   VAL  20           HA       VAL  20 -21.767  -5.520 -11.395
    3    HB   VAL  20           HB       VAL  20 -18.813  -4.773 -11.533
    4   HG12  VAL  20          HG11      VAL  20 -19.781  -2.651 -12.635
    5   HG11  VAL  20          HG12      VAL  20 -21.204  -3.636 -12.973
    6   HG13  VAL  20          HG13      VAL  20 -19.636  -4.094 -13.639
    7   HG22  VAL  20          HG21      VAL  20 -19.593  -4.086  -9.461
    8   HG21  VAL  20          HG22      VAL  20 -21.188  -3.677 -10.087
    9   HG23  VAL  20          HG23      VAL  20 -19.804  -2.652 -10.465

  No H/Q in entry =           9
  In of MODEL   13
    1    H    SER  21           H        SER  21 -18.912  -7.404 -12.474
    2    HA   SER  21           HA       SER  21 -19.712  -7.278 -15.219
    3    HB2  SER  21           HB2      SER  21 -18.181  -9.165 -15.594
    4    HB3  SER  21           HB3      SER  21 -17.411  -7.892 -14.649
    5    HG   SER  21           HG       SER  21 -17.251  -9.185 -13.025

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LYS  22           H        LYS  22 -20.654  -9.567 -12.689
    2    HA   LYS  22           HA       LYS  22 -22.115 -11.225 -14.538
    3    HB2  LYS  22           HB2      LYS  22 -22.012 -10.991 -11.555
    4    HB3  LYS  22           HB3      LYS  22 -23.315 -11.899 -12.319
    5    HG2  LYS  22           HG2      LYS  22 -21.783 -13.555 -11.852
    6    HG3  LYS  22           HG3      LYS  22 -21.394 -13.158 -13.526
    7    HD2  LYS  22           HD2      LYS  22 -19.542 -11.759 -12.786
    8    HD3  LYS  22           HD3      LYS  22 -19.948 -12.086 -11.101
    9    HE2  LYS  22           HE2      LYS  22 -19.192 -14.243 -13.078
   10    HE3  LYS  22           HE3      LYS  22 -18.024 -13.433 -12.032
   11    HZ1  LYS  22           HZ1      LYS  22 -20.287 -14.480 -10.615
   12    HZ3  LYS  22           HZ2      LYS  22 -18.625 -14.660 -10.303
   13    HZ2  LYS  22           HZ3      LYS  22 -19.396 -15.679 -11.423

  No H/Q in entry =          13
  In of MODEL   13
    1    H    MET  23           H        MET  23 -22.977  -8.383 -12.609
    2    HA   MET  23           HA       MET  23 -25.779  -8.592 -13.107
    3    HB2  MET  23           HB2      MET  23 -24.048  -6.206 -12.492
    4    HB3  MET  23           HB3      MET  23 -25.801  -6.121 -12.662
    5    HG2  MET  23           HG2      MET  23 -26.118  -7.483 -10.719
    6    HG3  MET  23           HG3      MET  23 -24.389  -7.810 -10.606
    7    HE2  MET  23           HE1      MET  23 -26.861  -4.303  -9.336
    8    HE1  MET  23           HE2      MET  23 -27.073  -5.254 -10.804
    9    HE3  MET  23           HE3      MET  23 -26.111  -3.776 -10.842

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ARG  24           H        ARG  24 -23.108  -6.992 -14.870
    2    HA   ARG  24           HA       ARG  24 -24.677  -5.726 -16.836
    3    HB2  ARG  24           HB2      ARG  24 -21.808  -6.717 -16.902
    4    HB3  ARG  24           HB3      ARG  24 -22.530  -5.824 -18.217
    5    HG2  ARG  24           HG2      ARG  24 -22.811  -3.830 -16.806
    6    HG3  ARG  24           HG3      ARG  24 -22.234  -4.744 -15.389
    7    HD2  ARG  24           HD2      ARG  24 -20.353  -3.477 -16.280
    8    HD3  ARG  24           HD3      ARG  24 -20.109  -5.183 -16.634
    9    HE   ARG  24           HE       ARG  24 -21.253  -4.315 -18.893
   10   HH21  ARG  24          HH11      ARG  24 -19.769  -4.829 -20.501
   11   HH22  ARG  24          HH12      ARG  24 -18.154  -4.217 -20.403
   12   HH11  ARG  24          HH21      ARG  24 -18.671  -3.062 -17.098
   13   HH12  ARG  24          HH22      ARG  24 -17.517  -3.165 -18.390

  No H/Q in entry =          13
  In of MODEL   13
    1    H    ALA  25           H        ALA  25 -23.391  -9.010 -16.635
    2    HA   ALA  25           HA       ALA  25 -23.988  -9.816 -19.287
    3    HB1  ALA  25           HB1      ALA  25 -23.191 -11.826 -18.636
    4    HB3  ALA  25           HB2      ALA  25 -24.243 -11.886 -17.222
    5    HB2  ALA  25           HB3      ALA  25 -22.729 -10.986 -17.156

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLN  26           H        GLN  26 -25.799 -10.007 -16.259
    2    HA   GLN  26           HA       GLN  26 -28.085 -11.301 -17.295
    3    HB2  GLN  26           HB2      GLN  26 -27.648  -9.582 -14.872
    4    HB3  GLN  26           HB3      GLN  26 -29.177 -10.372 -15.232
    5    HG2  GLN  26           HG2      GLN  26 -26.521 -11.712 -14.803
    6    HG3  GLN  26           HG3      GLN  26 -27.880 -11.698 -13.687
    7   HE21  GLN  26          HE21      GLN  26 -26.565 -13.773 -15.014
    8   HE22  GLN  26          HE22      GLN  26 -27.558 -14.853 -15.829

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ALA  27           H        ALA  27 -27.315  -7.871 -16.832
    2    HA   ALA  27           HA       ALA  27 -29.858  -6.884 -17.585
    3    HB1  ALA  27           HB1      ALA  27 -28.109  -5.507 -16.447
    4    HB3  ALA  27           HB2      ALA  27 -28.742  -4.739 -17.904
    5    HB2  ALA  27           HB3      ALA  27 -27.167  -5.530 -17.938

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLU  28           H        GLU  28 -27.109  -7.933 -19.488
    2    HA   GLU  28           HA       GLU  28 -28.102  -6.886 -21.981
    3    HB2  GLU  28           HB2      GLU  28 -25.692  -7.467 -21.380
    4    HB3  GLU  28           HB3      GLU  28 -26.156  -9.150 -21.617
    5    HG2  GLU  28           HG2      GLU  28 -25.056  -8.277 -23.571
    6    HG3  GLU  28           HG3      GLU  28 -26.738  -8.673 -23.922

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LYS  29           H        LYS  29 -28.112 -10.032 -20.393
    2    HA   LYS  29           HA       LYS  29 -29.351 -11.518 -22.426
    3    HB2  LYS  29           HB2      LYS  29 -28.247 -12.495 -20.447
    4    HB3  LYS  29           HB3      LYS  29 -29.547 -11.872 -19.433
    5    HG2  LYS  29           HG2      LYS  29 -31.145 -13.298 -20.526
    6    HG3  LYS  29           HG3      LYS  29 -29.920 -13.850 -21.668
    7    HD2  LYS  29           HD2      LYS  29 -28.717 -14.998 -19.964
    8    HD3  LYS  29           HD3      LYS  29 -29.658 -14.230 -18.688
    9    HE2  LYS  29           HE2      LYS  29 -30.298 -16.604 -19.101
   10    HE3  LYS  29           HE3      LYS  29 -31.632 -15.469 -19.314
   11    HZ1  LYS  29           HZ1      LYS  29 -31.072 -15.522 -21.745
   12    HZ3  LYS  29           HZ2      LYS  29 -31.721 -16.957 -21.109
   13    HZ2  LYS  29           HZ3      LYS  29 -30.056 -16.840 -21.411

  No H/Q in entry =          13
  In of MODEL   13
    1    H    TYR  30           H        TYR  30 -30.833  -9.539 -19.871
    2    HA   TYR  30           HA       TYR  30 -33.476 -10.089 -21.115
    3    HB2  TYR  30           HB2      TYR  30 -32.868  -8.965 -18.371
    4    HB3  TYR  30           HB3      TYR  30 -34.474  -9.287 -19.025
    5    HD1  TYR  30           HD1      TYR  30 -35.274 -11.614 -19.287
    6    HD2  TYR  30           HD2      TYR  30 -31.471 -10.746 -17.579
    7    HE1  TYR  30           HE1      TYR  30 -35.068 -13.953 -18.543
    8    HE2  TYR  30           HE2      TYR  30 -31.267 -13.069 -16.838
    9    HH   TYR  30           HH       TYR  30 -32.795 -15.482 -17.979

  No H/Q in entry =           9
  In of MODEL   13
    1    H    GLU  31           H        GLU  31 -31.412  -7.977 -21.877
    2    HA   GLU  31           HA       GLU  31 -31.446  -5.801 -22.651
    3    HB2  GLU  31           HB2      GLU  31 -34.305  -6.645 -23.171
    4    HB3  GLU  31           HB3      GLU  31 -33.535  -5.223 -23.871
    5    HG2  GLU  31           HG2      GLU  31 -31.999  -6.560 -25.100
    6    HG3  GLU  31           HG3      GLU  31 -32.491  -8.018 -24.242

  No H/Q in entry =           6
  In of MODEL   13
    1    H    VAL  32           H        VAL  32 -31.639  -5.770 -19.916
    2    HA   VAL  32           HA       VAL  32 -33.600  -3.767 -19.205
    3    HB   VAL  32           HB       VAL  32 -31.155  -4.676 -17.653
    4   HG12  VAL  32          HG11      VAL  32 -32.722  -3.972 -15.735
    5   HG11  VAL  32          HG12      VAL  32 -33.604  -3.082 -16.976
    6   HG13  VAL  32          HG13      VAL  32 -31.913  -2.702 -16.655
    7   HG21  VAL  32          HG21      VAL  32 -32.840  -6.466 -18.375
    8   HG23  VAL  32          HG22      VAL  32 -33.914  -5.717 -17.194
    9   HG22  VAL  32          HG23      VAL  32 -32.362  -6.376 -16.680

  No H/Q in entry =           9
  In of MODEL   13
    1    HA   PRO  33           HA       PRO  33 -30.724  -0.655 -20.820
    2    HB2  PRO  33           HB2      PRO  33 -32.343   1.487 -20.641
    3    HB3  PRO  33           HB3      PRO  33 -32.751   0.187 -21.764
    4    HG2  PRO  33           HG2      PRO  33 -33.732   0.591 -18.937
    5    HG3  PRO  33           HG3      PRO  33 -34.690   0.368 -20.400
    6    HD2  PRO  33           HD2      PRO  33 -34.125  -1.716 -18.783
    7    HD3  PRO  33           HD3      PRO  33 -34.182  -1.921 -20.534

  No H/Q in entry =           7
  In of MODEL   13
    1    H    VAL  34           H        VAL  34 -29.426  -1.179 -18.888
    2    HA   VAL  34           HA       VAL  34 -29.257   1.220 -17.187
    3    HB   VAL  34           HB       VAL  34 -28.596  -0.254 -15.284
    4   HG12  VAL  34          HG11      VAL  34 -30.961  -1.255 -14.989
    5   HG11  VAL  34          HG12      VAL  34 -31.321  -0.476 -16.529
    6   HG13  VAL  34          HG13      VAL  34 -30.811   0.495 -15.148
    7   HG21  VAL  34          HG21      VAL  34 -28.688  -2.242 -17.338
    8   HG23  VAL  34          HG22      VAL  34 -29.719  -2.687 -15.977
    9   HG22  VAL  34          HG23      VAL  34 -28.017  -2.320 -15.708

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ILE  35           H        ILE  35 -27.302   1.733 -16.343
    2    HA   ILE  35           HA       ILE  35 -24.938   0.552 -17.643
    3    HB   ILE  35           HB       ILE  35 -25.480   3.398 -16.765
    4   HG12  ILE  35          HG12      ILE  35 -24.443   2.201 -19.341
    5   HG13  ILE  35          HG13      ILE  35 -26.102   2.732 -19.063
    6   HG21  ILE  35          HG21      ILE  35 -22.845   2.004 -17.116
    7   HG23  ILE  35          HG22      ILE  35 -23.354   3.131 -15.859
    8   HG22  ILE  35          HG23      ILE  35 -23.006   3.721 -17.484
    9   HD11  ILE  35          HD11      ILE  35 -24.811   4.981 -18.416
   10   HD13  ILE  35          HD12      ILE  35 -25.335   4.609 -20.059
   11   HD12  ILE  35          HD13      ILE  35 -23.664   4.311 -19.577

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ILE  36           H        ILE  36 -23.651  -0.444 -16.071
    2    HA   ILE  36           HA       ILE  36 -24.109   0.082 -13.186
    3    HB   ILE  36           HB       ILE  36 -23.152  -2.549 -14.358
    4   HG12  ILE  36          HG12      ILE  36 -25.993  -1.904 -13.567
    5   HG13  ILE  36          HG13      ILE  36 -25.430  -1.817 -15.237
    6   HG23  ILE  36          HG21      ILE  36 -23.451  -3.443 -12.263
    7   HG22  ILE  36          HG22      ILE  36 -24.640  -2.228 -11.791
    8   HG21  ILE  36          HG23      ILE  36 -22.928  -1.807 -11.859
    9   HD13  ILE  36          HD11      ILE  36 -25.483  -4.031 -15.493
   10   HD12  ILE  36          HD12      ILE  36 -26.549  -3.995 -14.088
   11   HD11  ILE  36          HD13      ILE  36 -24.830  -4.333 -13.883

  No H/Q in entry =          11
  In of MODEL   13
    1    H    GLU  37           H        GLU  37 -22.358   0.776 -12.073
    2    HA   GLU  37           HA       GLU  37 -19.635   0.138 -13.015
    3    HB2  GLU  37           HB2      GLU  37 -20.666   2.863 -12.244
    4    HB3  GLU  37           HB3      GLU  37 -18.958   2.458 -12.402
    5    HG2  GLU  37           HG2      GLU  37 -19.240   2.058 -14.764
    6    HG3  GLU  37           HG3      GLU  37 -20.971   2.367 -14.629

  No H/Q in entry =           6
  In of MODEL   13
    1    H    ALA  38           H        ALA  38 -18.130  -0.061 -11.344
    2    HA   ALA  38           HA       ALA  38 -19.157   0.002  -8.566
    3    HB1  ALA  38           HB1      ALA  38 -17.353  -1.814 -10.041
    4    HB3  ALA  38           HB2      ALA  38 -18.382  -2.135  -8.646
    5    HB2  ALA  38           HB3      ALA  38 -16.806  -1.375  -8.422

  No H/Q in entry =           5
  In of MODEL   13
    1    H    PHE  39           H        PHE  39 -17.975   1.240  -7.069
    2    HA   PHE  39           HA       PHE  39 -15.519   2.591  -7.946
    3    HB2  PHE  39           HB2      PHE  39 -18.001   3.930  -6.885
    4    HB3  PHE  39           HB3      PHE  39 -16.409   4.679  -6.793
    5    HD1  PHE  39           HD1      PHE  39 -15.108   4.793  -9.060
    6    HD2  PHE  39           HD2      PHE  39 -19.335   4.372  -8.690
    7    HE1  PHE  39           HE1      PHE  39 -15.386   5.703 -11.348
    8    HE2  PHE  39           HE2      PHE  39 -19.628   5.273 -10.970
    9    HZ   PHE  39           HZ       PHE  39 -17.658   5.912 -12.319

  No H/Q in entry =           9
  In of MODEL   13
    1    HA   PRO  40           HA       PRO  40 -14.524   1.790  -3.680
    2    HB2  PRO  40           HB2      PRO  40 -12.863   3.882  -3.034
    3    HB3  PRO  40           HB3      PRO  40 -12.354   2.600  -4.133
    4    HG2  PRO  40           HG2      PRO  40 -13.523   5.293  -4.814
    5    HG3  PRO  40           HG3      PRO  40 -12.058   4.542  -5.445
    6    HD2  PRO  40           HD2      PRO  40 -14.280   4.369  -6.847
    7    HD3  PRO  40           HD3      PRO  40 -13.248   2.948  -6.692

  No H/Q in entry =           7
  In of MODEL   13
    1    H    GLU  41           H        GLU  41 -15.187   2.686  -1.527
    2    HA   GLU  41           HA       GLU  41 -17.519   4.266  -1.464
    3    HB2  GLU  41           HB2      GLU  41 -17.357   4.150   0.912
    4    HB3  GLU  41           HB3      GLU  41 -16.798   2.603   0.274
    5    HG2  GLU  41           HG2      GLU  41 -14.471   3.315   0.620
    6    HG3  GLU  41           HG3      GLU  41 -15.049   4.841   1.292

  No H/Q in entry =           6
  In of MODEL   13
    1    H    THR  42           H        THR  42 -14.241   5.361  -1.506
    2    HA   THR  42           HA       THR  42 -14.725   7.870  -0.235
    3    HB   THR  42           HB       THR  42 -12.606   8.584  -1.317
    4    HG1  THR  42           HG1      THR  42 -11.548   6.942  -2.594
    5   HG22  THR  42          HG21      THR  42 -11.163   6.798  -0.331
    6   HG21  THR  42          HG22      THR  42 -12.605   5.805  -0.116
    7   HG23  THR  42          HG23      THR  42 -12.447   7.328   0.757

  No H/Q in entry =           7
  In of MODEL   13
    1    H    LEU  43           H        LEU  43 -15.583   6.800  -3.356
    2    HA   LEU  43           HA       LEU  43 -15.989   9.576  -4.263
    3    HB2  LEU  43           HB2      LEU  43 -16.214   6.945  -5.714
    4    HB3  LEU  43           HB3      LEU  43 -16.515   8.526  -6.433
    5    HG   LEU  43           HG       LEU  43 -13.840   7.567  -5.446
    6   HD11  LEU  43          HD11      LEU  43 -14.946   6.470  -7.536
    7   HD13  LEU  43          HD12      LEU  43 -13.277   7.033  -7.628
    8   HD12  LEU  43          HD13      LEU  43 -14.576   8.011  -8.310
    9   HD21  LEU  43          HD21      LEU  43 -14.842  10.080  -6.751
   10   HD23  LEU  43          HD22      LEU  43 -13.166   9.566  -6.947
   11   HD22  LEU  43          HD23      LEU  43 -13.803   9.901  -5.338

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ALA  44           H        ALA  44 -17.825   7.607  -2.445
    2    HA   ALA  44           HA       ALA  44 -20.298   7.364  -3.762
    3    HB2  ALA  44           HB1      ALA  44 -20.090   6.210  -1.692
    4    HB3  ALA  44           HB2      ALA  44 -21.267   7.488  -1.385
    5    HB1  ALA  44           HB3      ALA  44 -19.602   7.672  -0.836

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLY  45           H        GLY  45 -19.024  10.202  -2.172
    2    HA3  GLY  45           HA2      GLY  45 -21.539  11.577  -2.491
    3    HA2  GLY  45           HA3      GLY  45 -20.028  12.270  -1.904

  No H/Q in entry =           3
  In of MODEL   13
    1    H    GLU  46           H        GLU  46 -18.459  11.468  -4.220
    2    HA   GLU  46           HA       GLU  46 -19.221  13.686  -5.937
    3    HB2  GLU  46           HB2      GLU  46 -16.917  11.732  -5.999
    4    HB3  GLU  46           HB3      GLU  46 -17.125  13.049  -7.153
    5    HG2  GLU  46           HG2      GLU  46 -16.907  14.678  -5.379
    6    HG3  GLU  46           HG3      GLU  46 -16.790  13.390  -4.180

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LYS  47           H        LYS  47 -18.916  10.189  -6.451
    2    HA   LYS  47           HA       LYS  47 -20.035  10.409  -9.118
    3    HB2  LYS  47           HB2      LYS  47 -19.332   8.013  -7.415
    4    HB3  LYS  47           HB3      LYS  47 -19.905   7.927  -9.080
    5    HG2  LYS  47           HG2      LYS  47 -17.430   9.430  -8.312
    6    HG3  LYS  47           HG3      LYS  47 -17.412   7.712  -8.705
    7    HD2  LYS  47           HD2      LYS  47 -18.492   8.248 -10.874
    8    HD3  LYS  47           HD3      LYS  47 -18.348   9.961 -10.480
    9    HE2  LYS  47           HE2      LYS  47 -16.033   8.045 -10.669
   10    HE3  LYS  47           HE3      LYS  47 -16.542   9.137 -11.956
   11    HZ1  LYS  47           HZ1      LYS  47 -16.296  10.606  -9.596
   12    HZ3  LYS  47           HZ2      LYS  47 -15.377  10.730 -11.018
   13    HZ2  LYS  47           HZ3      LYS  47 -14.885   9.678  -9.778

  No H/Q in entry =          13
  In of MODEL   13
    1    H    GLY  48           H        GLY  48 -21.302   9.512  -5.983
    2    HA3  GLY  48           HA2      GLY  48 -23.623   8.217  -6.743
    3    HA2  GLY  48           HA3      GLY  48 -23.445   9.189  -5.283

  No H/Q in entry =           3
  In of MODEL   13
    1    H    GLN  49           H        GLN  49 -23.000  11.675  -6.801
    2    HA   GLN  49           HA       GLN  49 -25.616  12.650  -6.912
    3    HB2  GLN  49           HB2      GLN  49 -23.128  13.679  -8.260
    4    HB3  GLN  49           HB3      GLN  49 -24.639  14.563  -8.150
    5    HG2  GLN  49           HG2      GLN  49 -24.471  14.541  -5.714
    6    HG3  GLN  49           HG3      GLN  49 -22.971  13.635  -5.823
    7   HE21  GLN  49          HE21      GLN  49 -22.968  15.838  -4.502
    8   HE22  GLN  49          HE22      GLN  49 -22.117  17.156  -5.123

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ASN  50           H        ASN  50 -23.849  10.917  -9.346
    2    HA   ASN  50           HA       ASN  50 -25.786  11.733 -11.402
    3    HB2  ASN  50           HB2      ASN  50 -23.128  10.339 -11.678
    4    HB3  ASN  50           HB3      ASN  50 -24.205  10.737 -13.009
    5   HD21  ASN  50          HD21      ASN  50 -21.611  11.687 -11.388
    6   HD22  ASN  50          HD22      ASN  50 -21.466  13.340 -11.694

  No H/Q in entry =           6
  In of MODEL   13
    1    H    ALA  51           H        ALA  51 -25.635   9.332  -9.209
    2    HA   ALA  51           HA       ALA  51 -26.313   7.189 -11.081
    3    HB2  ALA  51           HB1      ALA  51 -25.651   5.835  -9.427
    4    HB3  ALA  51           HB2      ALA  51 -26.809   6.558  -8.313
    5    HB1  ALA  51           HB3      ALA  51 -25.207   7.270  -8.501

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ASP  52           H        ASP  52 -28.258   6.025 -10.959
    2    HA   ASP  52           HA       ASP  52 -30.530   7.725 -10.245
    3    HB2  ASP  52           HB2      ASP  52 -30.215   5.272 -11.971
    4    HB3  ASP  52           HB3      ASP  52 -31.794   5.913 -11.515

  No H/Q in entry =           4
  In of MODEL   13
    1    H    VAL  53           H        VAL  53 -28.775   4.904  -9.299
    2    HA   VAL  53           HA       VAL  53 -30.209   4.899  -6.776
    3    HB   VAL  53           HB       VAL  53 -31.526   3.214  -8.052
    4   HG11  VAL  53          HG11      VAL  53 -29.743   2.480  -9.599
    5   HG13  VAL  53          HG12      VAL  53 -30.504   1.125  -8.765
    6   HG12  VAL  53          HG13      VAL  53 -28.919   1.699  -8.249
    7   HG23  VAL  53          HG21      VAL  53 -30.594   1.245  -6.407
    8   HG22  VAL  53          HG22      VAL  53 -31.788   2.481  -6.007
    9   HG21  VAL  53          HG23      VAL  53 -30.090   2.732  -5.602

  No H/Q in entry =           9
  In of MODEL   13
    1    H    VAL  54           H        VAL  54 -28.868   4.499  -5.135
    2    HA   VAL  54           HA       VAL  54 -26.070   3.808  -5.775
    3    HB   VAL  54           HB       VAL  54 -27.222   5.477  -3.483
    4   HG11  VAL  54          HG11      VAL  54 -24.574   4.200  -3.814
    5   HG13  VAL  54          HG12      VAL  54 -25.354   4.807  -2.354
    6   HG12  VAL  54          HG13      VAL  54 -24.510   5.921  -3.429
    7   HG22  VAL  54          HG21      VAL  54 -26.463   7.358  -4.543
    8   HG21  VAL  54          HG22      VAL  54 -26.964   6.371  -5.916
    9   HG23  VAL  54          HG23      VAL  54 -25.259   6.474  -5.483

  No H/Q in entry =           9
  In of MODEL   13
    1    H    LEU  55           H        LEU  55 -25.376   1.906  -5.177
    2    HA   LEU  55           HA       LEU  55 -26.805   0.471  -3.027
    3    HB2  LEU  55           HB2      LEU  55 -25.200  -0.564  -5.353
    4    HB3  LEU  55           HB3      LEU  55 -25.905  -1.565  -4.083
    5    HG   LEU  55           HG       LEU  55 -27.432  -0.007  -6.160
    6   HD13  LEU  55          HD11      LEU  55 -27.042  -1.814  -7.421
    7   HD12  LEU  55          HD12      LEU  55 -27.948  -2.764  -6.243
    8   HD11  LEU  55          HD13      LEU  55 -26.198  -2.611  -6.096
    9   HD23  LEU  55          HD21      LEU  55 -28.617  -2.058  -4.344
   10   HD22  LEU  55          HD22      LEU  55 -29.386  -0.696  -5.158
   11   HD21  LEU  55          HD23      LEU  55 -28.374  -0.418  -3.741

  No H/Q in entry =          11
  In of MODEL   13
    1    H    LEU  56           H        LEU  56 -25.616  -0.103  -1.239
    2    HA   LEU  56           HA       LEU  56 -22.707   0.444  -1.290
    3    HB2  LEU  56           HB2      LEU  56 -24.485   0.087   1.110
    4    HB3  LEU  56           HB3      LEU  56 -22.800   0.604   1.102
    5    HG   LEU  56           HG       LEU  56 -25.187   2.183   0.184
    6   HD11  LEU  56          HD11      LEU  56 -24.042   1.803   2.692
    7   HD13  LEU  56          HD12      LEU  56 -25.104   3.131   2.219
    8   HD12  LEU  56          HD13      LEU  56 -23.355   3.327   2.129
    9   HD23  LEU  56          HD21      LEU  56 -23.333   3.983   0.022
   10   HD22  LEU  56          HD22      LEU  56 -23.664   2.898  -1.329
   11   HD21  LEU  56          HD23      LEU  56 -22.290   2.591  -0.268

  No H/Q in entry =          11
  In of MODEL   13
    1    H    GLY  57           H        GLY  57 -21.242  -1.125  -0.797
    2    HA3  GLY  57           HA2      GLY  57 -22.023  -3.850  -1.052
    3    HA2  GLY  57           HA3      GLY  57 -20.428  -3.283  -0.562

  No H/Q in entry =           3
  In of MODEL   13
    1    HA   PRO  58           HA       PRO  58 -23.165  -4.547   3.130
    2    HB2  PRO  58           HB2      PRO  58 -22.345  -7.125   3.675
    3    HB3  PRO  58           HB3      PRO  58 -23.753  -6.767   2.676
    4    HG2  PRO  58           HG2      PRO  58 -20.988  -7.489   1.861
    5    HG3  PRO  58           HG3      PRO  58 -22.529  -8.013   1.185
    6    HD2  PRO  58           HD2      PRO  58 -21.021  -6.089  -0.003
    7    HD3  PRO  58           HD3      PRO  58 -22.783  -6.091  -0.096

  No H/Q in entry =           7
  In of MODEL   13
    1    H    GLN  59           H        GLN  59 -19.777  -4.832   2.501
    2    HA   GLN  59           HA       GLN  59 -19.010  -4.873   5.258
    3    HB2  GLN  59           HB2      GLN  59 -17.484  -3.899   2.838
    4    HB3  GLN  59           HB3      GLN  59 -16.807  -4.087   4.443
    5    HG2  GLN  59           HG2      GLN  59 -16.132  -6.005   3.320
    6    HG3  GLN  59           HG3      GLN  59 -17.523  -6.540   4.249
    7   HE21  GLN  59          HE21      GLN  59 -17.433  -8.069   2.681
    8   HE22  GLN  59          HE22      GLN  59 -18.220  -8.243   1.227

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ILE  60           H        ILE  60 -20.083  -2.325   3.110
    2    HA   ILE  60           HA       ILE  60 -19.321  -0.372   5.195
    3    HB   ILE  60           HB       ILE  60 -19.658   1.382   3.405
    4   HG12  ILE  60          HG12      ILE  60 -19.334  -0.790   1.378
    5   HG13  ILE  60          HG13      ILE  60 -20.949  -0.354   1.937
    6   HG23  ILE  60          HG21      ILE  60 -17.493   1.202   2.577
    7   HG22  ILE  60          HG22      ILE  60 -17.526  -0.560   2.629
    8   HG21  ILE  60          HG23      ILE  60 -17.463   0.365   4.129
    9   HD12  ILE  60          HD11      ILE  60 -19.004   1.247   0.320
   10   HD11  ILE  60          HD12      ILE  60 -20.161   2.088   1.351
   11   HD13  ILE  60          HD13      ILE  60 -20.735   1.010   0.079

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ALA  61           H        ALA  61 -21.693  -2.081   5.238
    2    HA   ALA  61           HA       ALA  61 -24.003  -0.523   4.823
    3    HB1  ALA  61           HB1      ALA  61 -25.135  -2.101   6.119
    4    HB2  ALA  61           HB2      ALA  61 -23.715  -2.441   7.109
    5    HB3  ALA  61           HB3      ALA  61 -23.786  -3.015   5.443

  No H/Q in entry =           5
  In of MODEL   13
    1    H    TYR  62           H        TYR  62 -21.780  -0.584   7.611
    2    HA   TYR  62           HA       TYR  62 -23.410   0.955   9.323
    3    HB2  TYR  62           HB2      TYR  62 -21.411   1.425  10.579
    4    HB3  TYR  62           HB3      TYR  62 -21.337  -0.247  10.023
    5    HD1  TYR  62           HD1      TYR  62 -19.715  -0.916   8.278
    6    HD2  TYR  62           HD2      TYR  62 -19.791   3.077   9.795
    7    HE1  TYR  62           HE1      TYR  62 -17.523  -0.483   7.235
    8    HE2  TYR  62           HE2      TYR  62 -17.586   3.506   8.755
    9    HH   TYR  62           HH       TYR  62 -16.379   2.077   6.455

  No H/Q in entry =           9
  In of MODEL   13
    1    H    MET  63           H        MET  63 -21.826   1.959   6.481
    2    HA   MET  63           HA       MET  63 -21.798   4.779   7.237
    3    HB2  MET  63           HB2      MET  63 -21.127   3.345   4.668
    4    HB3  MET  63           HB3      MET  63 -21.022   5.093   4.885
    5    HG2  MET  63           HG2      MET  63 -19.279   4.815   6.528
    6    HG3  MET  63           HG3      MET  63 -19.417   3.062   6.411
    7    HE3  MET  63           HE1      MET  63 -19.019   5.757   3.034
    8    HE2  MET  63           HE2      MET  63 -17.508   6.089   3.879
    9    HE1  MET  63           HE3      MET  63 -19.044   6.234   4.734

  No H/Q in entry =           9
  In of MODEL   13
    1    H    LEU  64           H        LEU  64 -24.270   2.820   6.241
    2    HA   LEU  64           HA       LEU  64 -25.560   4.221   4.199
    3    HB2  LEU  64           HB2      LEU  64 -26.317   2.055   5.073
    4    HB3  LEU  64           HB3      LEU  64 -26.808   2.840   6.572
    5    HG   LEU  64           HG       LEU  64 -28.570   4.036   5.378
    6   HD13  LEU  64          HD11      LEU  64 -28.310   4.339   3.151
    7   HD12  LEU  64          HD12      LEU  64 -28.874   2.678   2.971
    8   HD11  LEU  64          HD13      LEU  64 -27.146   3.022   3.029
    9   HD23  LEU  64          HD21      LEU  64 -28.951   1.218   4.570
   10   HD22  LEU  64          HD22      LEU  64 -29.990   2.280   5.519
   11   HD21  LEU  64          HD23      LEU  64 -28.574   1.539   6.263

  No H/Q in entry =          11
  In of MODEL   13
    1    HA   PRO  65           HA       PRO  65 -27.881   7.202   7.027
    2    HB2  PRO  65           HB2      PRO  65 -25.880   7.410   9.276
    3    HB3  PRO  65           HB3      PRO  65 -27.631   7.603   9.335
    4    HG2  PRO  65           HG2      PRO  65 -26.586   5.377  10.208
    5    HG3  PRO  65           HG3      PRO  65 -28.007   5.297   9.168
    6    HD2  PRO  65           HD2      PRO  65 -25.112   4.841   8.440
    7    HD3  PRO  65           HD3      PRO  65 -26.526   3.894   7.979

  No H/Q in entry =           7
  In of MODEL   13
    1    H    GLU  66           H        GLU  66 -24.326   7.320   7.085
    2    HA   GLU  66           HA       GLU  66 -24.169  10.137   6.741
    3    HB2  GLU  66           HB2      GLU  66 -22.247   7.937   6.032
    4    HB3  GLU  66           HB3      GLU  66 -21.882   9.653   5.860
    5    HG2  GLU  66           HG2      GLU  66 -22.100   9.961   8.236
    6    HG3  GLU  66           HG3      GLU  66 -22.543   8.265   8.433

  No H/Q in entry =           6
  In of MODEL   13
    1    H    ILE  67           H        ILE  67 -24.147   7.440   4.429
    2    HA   ILE  67           HA       ILE  67 -23.826   9.217   2.173
    3    HB   ILE  67           HB       ILE  67 -24.581   6.267   2.292
    4   HG12  ILE  67          HG12      ILE  67 -22.015   7.583   1.385
    5   HG13  ILE  67          HG13      ILE  67 -22.282   7.113   3.063
    6   HG21  ILE  67          HG21      ILE  67 -24.626   8.194   0.108
    7   HG23  ILE  67          HG22      ILE  67 -25.171   6.516   0.125
    8   HG22  ILE  67          HG23      ILE  67 -23.480   6.891  -0.203
    9   HD12  ILE  67          HD11      ILE  67 -21.788   5.415   0.673
   10   HD11  ILE  67          HD12      ILE  67 -22.767   4.765   1.987
   11   HD13  ILE  67          HD13      ILE  67 -21.117   5.303   2.300

  No H/Q in entry =          11
  In of MODEL   13
    1    H    GLN  68           H        GLN  68 -26.633   7.991   3.793
    2    HA   GLN  68           HA       GLN  68 -28.515   8.876   1.848
    3    HB2  GLN  68           HB2      GLN  68 -28.738   8.441   4.824
    4    HB3  GLN  68           HB3      GLN  68 -30.090   8.994   3.849
    5    HG2  GLN  68           HG2      GLN  68 -30.028   6.993   2.529
    6    HG3  GLN  68           HG3      GLN  68 -28.549   6.469   3.312
    7   HE21  GLN  68          HE21      GLN  68 -30.661   5.012   3.156
    8   HE22  GLN  68          HE22      GLN  68 -31.461   4.487   4.563

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ARG  69           H        ARG  69 -26.976  10.556   4.616
    2    HA   ARG  69           HA       ARG  69 -28.457  12.980   4.271
    3    HB2  ARG  69           HB2      ARG  69 -26.063  12.125   5.828
    4    HB3  ARG  69           HB3      ARG  69 -26.224  13.847   5.508
    5    HG2  ARG  69           HG2      ARG  69 -28.535  13.761   6.490
    6    HG3  ARG  69           HG3      ARG  69 -28.247  12.072   6.925
    7    HD2  ARG  69           HD2      ARG  69 -26.659  14.482   7.884
    8    HD3  ARG  69           HD3      ARG  69 -27.740  13.503   8.863
    9    HE   ARG  69           HE       ARG  69 -25.093  12.715   7.883
   10   HH21  ARG  69          HH11      ARG  69 -24.198  10.966   9.035
   11   HH22  ARG  69          HH12      ARG  69 -25.182  10.078  10.150
   12   HH11  ARG  69          HH21      ARG  69 -28.013  11.994   9.580
   13   HH12  ARG  69          HH22      ARG  69 -27.342  10.658  10.456

  No H/Q in entry =          13
  In of MODEL   13
    1    H    LEU  70           H        LEU  70 -25.532  11.738   2.867
    2    HA   LEU  70           HA       LEU  70 -24.533  14.177   1.748
    3    HB2  LEU  70           HB2      LEU  70 -23.431  11.895   2.286
    4    HB3  LEU  70           HB3      LEU  70 -24.032  11.437   0.693
    5    HG   LEU  70           HG       LEU  70 -22.509  12.905  -0.368
    6   HD11  LEU  70          HD11      LEU  70 -21.712  13.724   2.435
    7   HD13  LEU  70          HD12      LEU  70 -22.461  14.752   1.213
    8   HD12  LEU  70          HD13      LEU  70 -20.820  14.150   0.972
    9   HD22  LEU  70          HD21      LEU  70 -20.997  11.251  -0.179
   10   HD21  LEU  70          HD22      LEU  70 -21.892  10.656   1.219
   11   HD23  LEU  70          HD23      LEU  70 -20.556  11.785   1.442

  No H/Q in entry =          11
  In of MODEL   13
    1    H    LEU  71           H        LEU  71 -26.575  11.564   0.585
    2    HA   LEU  71           HA       LEU  71 -27.181  13.082  -1.895
    3    HB2  LEU  71           HB2      LEU  71 -27.250  10.082  -1.515
    4    HB3  LEU  71           HB3      LEU  71 -27.424  10.969  -3.028
    5    HG   LEU  71           HG       LEU  71 -24.898  11.058  -1.378
    6   HD12  LEU  71          HD11      LEU  71 -24.892   9.484  -3.845
    7   HD11  LEU  71          HD12      LEU  71 -25.867   8.788  -2.552
    8   HD13  LEU  71          HD13      LEU  71 -24.160   9.138  -2.280
    9   HD22  LEU  71          HD21      LEU  71 -25.090  12.902  -2.830
   10   HD21  LEU  71          HD22      LEU  71 -25.548  11.867  -4.183
   11   HD23  LEU  71          HD23      LEU  71 -23.918  11.778  -3.516

  No H/Q in entry =          11
  In of MODEL   13
    1    HA   PRO  72           HA       PRO  72 -31.008  12.404   0.733
    2    HB2  PRO  72           HB2      PRO  72 -31.978  14.926   0.713
    3    HB3  PRO  72           HB3      PRO  72 -30.644  14.508   1.788
    4    HG2  PRO  72           HG2      PRO  72 -30.525  15.770  -0.939
    5    HG3  PRO  72           HG3      PRO  72 -29.775  16.322   0.559
    6    HD2  PRO  72           HD2      PRO  72 -28.381  14.863  -1.248
    7    HD3  PRO  72           HD3      PRO  72 -28.110  14.668   0.483

  No H/Q in entry =           7
  In of MODEL   13
    1    H    ASN  73           H        ASN  73 -30.445  13.456  -2.462
    2    HA   ASN  73           HA       ASN  73 -33.292  13.038  -3.088
    3    HB2  ASN  73           HB2      ASN  73 -32.886  14.210  -5.162
    4    HB3  ASN  73           HB3      ASN  73 -32.399  15.181  -3.782
    5   HD21  ASN  73          HD21      ASN  73 -31.620  15.319  -6.461
    6   HD22  ASN  73          HD22      ASN  73 -29.949  15.234  -6.665

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LYS  74           H        LYS  74 -31.215  10.861  -2.723
    2    HA   LYS  74           HA       LYS  74 -31.737   9.501  -5.299
    3    HB2  LYS  74           HB2      LYS  74 -29.185   9.280  -3.696
    4    HB3  LYS  74           HB3      LYS  74 -29.543   8.485  -5.230
    5    HG2  LYS  74           HG2      LYS  74 -29.402  11.460  -4.963
    6    HG3  LYS  74           HG3      LYS  74 -27.986  10.463  -5.297
    7    HD2  LYS  74           HD2      LYS  74 -29.074   9.532  -7.255
    8    HD3  LYS  74           HD3      LYS  74 -30.533  10.461  -6.907
    9    HE2  LYS  74           HE2      LYS  74 -29.394  12.526  -7.310
   10    HE3  LYS  74           HE3      LYS  74 -27.838  11.703  -7.428
   11    HZ2  LYS  74           HZ1      LYS  74 -29.344  12.291  -9.533
   12    HZ1  LYS  74           HZ2      LYS  74 -29.933  10.734  -9.192
   13    HZ3  LYS  74           HZ3      LYS  74 -28.278  10.971  -9.492

  No H/Q in entry =          13
  In of MODEL   13
    1    HA   PRO  75           HA       PRO  75 -32.988   6.395  -2.389
    2    HB2  PRO  75           HB2      PRO  75 -33.215   4.201  -4.019
    3    HB3  PRO  75           HB3      PRO  75 -34.397   5.508  -4.053
    4    HG2  PRO  75           HG2      PRO  75 -32.046   5.048  -5.848
    5    HG3  PRO  75           HG3      PRO  75 -33.714   5.426  -6.277
    6    HD2  PRO  75           HD2      PRO  75 -31.850   7.369  -6.202
    7    HD3  PRO  75           HD3      PRO  75 -33.495   7.688  -5.647

  No H/Q in entry =           7
  In of MODEL   13
    1    H    VAL  76           H        VAL  76 -31.486   5.370  -1.046
    2    HA   VAL  76           HA       VAL  76 -28.979   4.289  -2.191
    3    HB   VAL  76           HB       VAL  76 -29.313   5.683   0.500
    4   HG11  VAL  76          HG11      VAL  76 -26.913   4.525  -0.931
    5   HG13  VAL  76          HG12      VAL  76 -27.582   4.013   0.620
    6   HG12  VAL  76          HG13      VAL  76 -26.801   5.587   0.475
    7   HG22  VAL  76          HG21      VAL  76 -28.729   7.629  -0.348
    8   HG21  VAL  76          HG22      VAL  76 -29.250   6.945  -1.888
    9   HG23  VAL  76          HG23      VAL  76 -27.544   6.917  -1.444

  No H/Q in entry =           9
  In of MODEL   13
    1    H    GLU  77           H        GLU  77 -28.670   2.133  -1.627
    2    HA   GLU  77           HA       GLU  77 -29.409   1.255   1.012
    3    HB2  GLU  77           HB2      GLU  77 -30.950  -0.445   0.452
    4    HB3  GLU  77           HB3      GLU  77 -31.565   1.068  -0.213
    5    HG2  GLU  77           HG2      GLU  77 -30.937   0.385  -2.420
    6    HG3  GLU  77           HG3      GLU  77 -30.230  -1.098  -1.783

  No H/Q in entry =           6
  In of MODEL   13
    1    H    VAL  78           H        VAL  78 -28.993  -0.830   1.624
    2    HA   VAL  78           HA       VAL  78 -26.301  -1.470   0.708
    3    HB   VAL  78           HB       VAL  78 -27.959  -2.476   3.061
    4   HG11  VAL  78          HG11      VAL  78 -25.576  -3.581   1.899
    5   HG13  VAL  78          HG12      VAL  78 -26.456  -4.121   3.331
    6   HG12  VAL  78          HG13      VAL  78 -25.186  -2.908   3.482
    7   HG22  VAL  78          HG21      VAL  78 -26.551  -1.083   4.423
    8   HG21  VAL  78          HG22      VAL  78 -27.334  -0.118   3.172
    9   HG23  VAL  78          HG23      VAL  78 -25.637  -0.571   3.004

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ILE  79           H        ILE  79 -25.690  -3.334  -0.241
    2    HA   ILE  79           HA       ILE  79 -27.694  -4.867  -1.612
    3    HB   ILE  79           HB       ILE  79 -24.683  -5.273  -1.415
    4   HG12  ILE  79          HG12      ILE  79 -26.376  -4.189  -3.672
    5   HG13  ILE  79          HG13      ILE  79 -25.539  -3.168  -2.500
    6   HG22  ILE  79          HG21      ILE  79 -25.746  -6.447  -3.754
    7   HG21  ILE  79          HG22      ILE  79 -26.702  -7.039  -2.395
    8   HG23  ILE  79          HG23      ILE  79 -24.950  -7.244  -2.398
    9   HD13  ILE  79          HD11      ILE  79 -24.130  -3.183  -4.328
   10   HD12  ILE  79          HD12      ILE  79 -24.400  -4.897  -4.644
   11   HD11  ILE  79          HD13      ILE  79 -23.430  -4.399  -3.257

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ASP  80           H        ASP  80 -28.475  -6.838  -1.067
    2    HA   ASP  80           HA       ASP  80 -28.370  -7.791   1.558
    3    HB2  ASP  80           HB2      ASP  80 -30.107  -8.404  -0.085
    4    HB3  ASP  80           HB3      ASP  80 -28.912  -9.344  -0.981

  No H/Q in entry =           4
  In of MODEL   13
    1    H    SER  81           H        SER  81 -26.783  -8.885   2.657
    2    HA   SER  81           HA       SER  81 -24.266  -9.436   1.441
    3    HB2  SER  81           HB2      SER  81 -23.661 -10.486   3.585
    4    HB3  SER  81           HB3      SER  81 -24.429  -8.919   3.836
    5    HG   SER  81           HG       SER  81 -26.223  -9.882   4.534

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU  82           H        LEU  82 -26.886 -11.646   1.729
    2    HA   LEU  82           HA       LEU  82 -25.243 -13.935   1.151
    3    HB2  LEU  82           HB2      LEU  82 -28.203 -13.436   0.922
    4    HB3  LEU  82           HB3      LEU  82 -27.436 -15.003   0.671
    5    HG   LEU  82           HG       LEU  82 -27.435 -13.480   3.259
    6   HD12  LEU  82          HD11      LEU  82 -28.975 -15.966   2.482
    7   HD11  LEU  82          HD12      LEU  82 -29.674 -14.345   2.505
    8   HD13  LEU  82          HD13      LEU  82 -29.084 -15.074   4.000
    9   HD23  LEU  82          HD21      LEU  82 -26.715 -15.857   3.993
   10   HD22  LEU  82          HD22      LEU  82 -25.519 -14.826   3.208
   11   HD21  LEU  82          HD23      LEU  82 -26.326 -16.097   2.289

  No H/Q in entry =          11
  In of MODEL   13
    1    H    LEU  83           H        LEU  83 -27.302 -11.753  -0.712
    2    HA   LEU  83           HA       LEU  83 -27.057 -13.049  -3.212
    3    HB2  LEU  83           HB2      LEU  83 -27.585 -10.175  -2.500
    4    HB3  LEU  83           HB3      LEU  83 -27.598 -10.785  -4.154
    5    HG   LEU  83           HG       LEU  83 -29.602 -11.303  -1.978
    6   HD13  LEU  83          HD11      LEU  83 -30.440  -9.467  -3.000
    7   HD12  LEU  83          HD12      LEU  83 -30.863 -10.571  -4.306
    8   HD11  LEU  83          HD13      LEU  83 -29.367  -9.640  -4.386
    9   HD23  LEU  83          HD21      LEU  83 -29.703 -12.508  -4.730
   10   HD22  LEU  83          HD22      LEU  83 -30.650 -12.929  -3.303
   11   HD21  LEU  83          HD23      LEU  83 -28.943 -13.360  -3.385

  No H/Q in entry =          11
  In of MODEL   13
    1    H    TYR  84           H        TYR  84 -25.196 -10.620  -1.494
    2    HA   TYR  84           HA       TYR  84 -23.367 -10.010  -3.621
    3    HB2  TYR  84           HB2      TYR  84 -23.902  -8.543  -1.632
    4    HB3  TYR  84           HB3      TYR  84 -22.954  -9.657  -0.649
    5    HD1  TYR  84           HD1      TYR  84 -20.495  -9.975  -1.213
    6    HD2  TYR  84           HD2      TYR  84 -22.848  -6.810  -2.851
    7    HE1  TYR  84           HE1      TYR  84 -18.426  -8.768  -1.820
    8    HE2  TYR  84           HE2      TYR  84 -20.787  -5.597  -3.472
    9    HH   TYR  84           HH       TYR  84 -18.525  -5.509  -3.100

  No H/Q in entry =           9
  In of MODEL   13
    1    H    GLY  85           H        GLY  85 -23.029 -12.063  -0.719
    2    HA3  GLY  85           HA2      GLY  85 -20.417 -12.887  -1.233
    3    HA2  GLY  85           HA3      GLY  85 -21.607 -13.804  -0.308

  No H/Q in entry =           3
  In of MODEL   13
    1    H    LYS  86           H        LYS  86 -23.447 -14.210  -2.369
    2    HA   LYS  86           HA       LYS  86 -22.302 -16.511  -3.682
    3    HB2  LYS  86           HB2      LYS  86 -24.515 -16.612  -2.770
    4    HB3  LYS  86           HB3      LYS  86 -25.002 -15.172  -3.661
    5    HG2  LYS  86           HG2      LYS  86 -26.000 -17.137  -4.604
    6    HG3  LYS  86           HG3      LYS  86 -24.849 -16.431  -5.740
    7    HD2  LYS  86           HD2      LYS  86 -23.153 -18.023  -5.097
    8    HD3  LYS  86           HD3      LYS  86 -24.180 -18.658  -3.813
    9    HE2  LYS  86           HE2      LYS  86 -25.783 -19.450  -5.476
   10    HE3  LYS  86           HE3      LYS  86 -24.773 -18.797  -6.766
   11    HZ2  LYS  86           HZ1      LYS  86 -24.319 -21.124  -5.043
   12    HZ1  LYS  86           HZ2      LYS  86 -22.963 -20.244  -5.564
   13    HZ3  LYS  86           HZ3      LYS  86 -24.017 -20.931  -6.704

  No H/Q in entry =          13
  In of MODEL   13
    1    H    VAL  87           H        VAL  87 -22.429 -13.281  -4.508
    2    HA   VAL  87           HA       VAL  87 -22.189 -12.056  -6.424
    3    HB   VAL  87           HB       VAL  87 -21.020 -14.497  -7.794
    4   HG13  VAL  87          HG11      VAL  87 -19.635 -12.866  -8.910
    5   HG12  VAL  87          HG12      VAL  87 -20.175 -11.588  -7.819
    6   HG11  VAL  87          HG13      VAL  87 -21.298 -12.286  -8.986
    7   HG22  VAL  87          HG21      VAL  87 -19.987 -14.574  -5.644
    8   HG21  VAL  87          HG22      VAL  87 -19.697 -12.836  -5.662
    9   HG23  VAL  87          HG23      VAL  87 -18.829 -13.886  -6.780

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ASP  88           H        ASP  88 -24.674 -12.809  -6.076
    2    HA   ASP  88           HA       ASP  88 -25.757 -14.021  -8.493
    3    HB2  ASP  88           HB2      ASP  88 -26.728 -14.356  -6.171
    4    HB3  ASP  88           HB3      ASP  88 -27.252 -12.674  -6.232

  No H/Q in entry =           4
  In of MODEL   13
    1    H    GLY  89           H        GLY  89 -25.114 -12.701 -10.111
    2    HA3  GLY  89           HA2      GLY  89 -25.413  -9.935 -10.252
    3    HA2  GLY  89           HA3      GLY  89 -25.350 -11.025 -11.636

  No H/Q in entry =           3
  In of MODEL   13
    1    H    LEU  90           H        LEU  90 -27.734 -12.488 -11.205
    2    HA   LEU  90           HA       LEU  90 -29.631 -10.609 -12.269
    3    HB2  LEU  90           HB2      LEU  90 -29.599 -12.993 -12.899
    4    HB3  LEU  90           HB3      LEU  90 -30.079 -13.415 -11.256
    5    HG   LEU  90           HG       LEU  90 -32.245 -12.380 -11.585
    6   HD13  LEU  90          HD11      LEU  90 -32.148 -10.603 -13.024
    7   HD12  LEU  90          HD12      LEU  90 -32.641 -11.839 -14.184
    8   HD11  LEU  90          HD13      LEU  90 -30.945 -11.374 -14.060
    9   HD23  LEU  90          HD21      LEU  90 -32.120 -13.956 -14.055
   10   HD22  LEU  90          HD22      LEU  90 -33.084 -14.191 -12.596
   11   HD21  LEU  90          HD23      LEU  90 -31.406 -14.733 -12.641

  No H/Q in entry =          11
  In of MODEL   13
    1    H    GLY  91           H        GLY  91 -29.382 -12.167  -9.118
    2    HA3  GLY  91           HA2      GLY  91 -31.760 -11.176  -8.044
    3    HA2  GLY  91           HA3      GLY  91 -30.342 -11.669  -7.120

  No H/Q in entry =           3
  In of MODEL   13
    1    H    VAL  92           H        VAL  92 -28.506  -9.745  -7.947
    2    HA   VAL  92           HA       VAL  92 -29.386  -7.512  -6.347
    3    HB   VAL  92           HB       VAL  92 -26.831  -7.840  -7.964
    4   HG12  VAL  92          HG11      VAL  92 -27.062  -6.011  -5.598
    5   HG11  VAL  92          HG12      VAL  92 -27.759  -5.465  -7.125
    6   HG13  VAL  92          HG13      VAL  92 -26.045  -5.863  -7.030
    7   HG22  VAL  92          HG21      VAL  92 -26.532  -9.449  -6.406
    8   HG21  VAL  92          HG22      VAL  92 -27.702  -8.742  -5.292
    9   HG23  VAL  92          HG23      VAL  92 -26.077  -8.068  -5.409

  No H/Q in entry =           9
  In of MODEL   13
    1    H    LEU  93           H        LEU  93 -28.971  -8.085  -9.781
    2    HA   LEU  93           HA       LEU  93 -29.435  -5.449 -10.655
    3    HB2  LEU  93           HB2      LEU  93 -28.722  -7.244 -12.157
    4    HB3  LEU  93           HB3      LEU  93 -30.280  -8.043 -11.942
    5    HG   LEU  93           HG       LEU  93 -31.381  -6.102 -13.020
    6   HD11  LEU  93          HD11      LEU  93 -29.597  -4.440 -12.492
    7   HD13  LEU  93          HD12      LEU  93 -30.045  -4.453 -14.198
    8   HD12  LEU  93          HD13      LEU  93 -28.556  -5.236 -13.672
    9   HD23  LEU  93          HD21      LEU  93 -30.332  -6.577 -15.324
   10   HD22  LEU  93          HD22      LEU  93 -31.115  -7.887 -14.439
   11   HD21  LEU  93          HD23      LEU  93 -29.354  -7.756 -14.449

  No H/Q in entry =          11
  In of MODEL   13
    1    H    LYS  94           H        LYS  94 -31.694  -8.111  -9.847
    2    HA   LYS  94           HA       LYS  94 -34.101  -6.758 -10.429
    3    HB2  LYS  94           HB2      LYS  94 -33.482  -8.960  -8.466
    4    HB3  LYS  94           HB3      LYS  94 -35.109  -8.329  -8.710
    5    HG2  LYS  94           HG2      LYS  94 -35.004  -9.051 -11.062
    6    HG3  LYS  94           HG3      LYS  94 -33.411  -9.741 -10.757
    7    HD2  LYS  94           HD2      LYS  94 -34.462 -11.159  -8.954
    8    HD3  LYS  94           HD3      LYS  94 -36.035 -10.567  -9.488
    9    HE2  LYS  94           HE2      LYS  94 -35.494 -11.426 -11.777
   10    HE3  LYS  94           HE3      LYS  94 -34.043 -12.162 -11.096
   11    HZ3  LYS  94           HZ1      LYS  94 -35.827 -13.758 -11.289
   12    HZ2  LYS  94           HZ2      LYS  94 -36.838 -12.793 -10.321
   13    HZ1  LYS  94           HZ3      LYS  94 -35.443 -13.497  -9.655

  No H/Q in entry =          13
  In of MODEL   13
    1    H    ALA  95           H        ALA  95 -32.255  -6.863  -7.393
    2    HA   ALA  95           HA       ALA  95 -34.161  -5.395  -5.871
    3    HB2  ALA  95           HB1      ALA  95 -31.726  -6.678  -5.375
    4    HB3  ALA  95           HB2      ALA  95 -32.736  -5.840  -4.198
    5    HB1  ALA  95           HB3      ALA  95 -31.427  -4.979  -5.010

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA  96           H        ALA  96 -31.571  -4.386  -7.963
    2    HA   ALA  96           HA       ALA  96 -31.587  -1.640  -7.132
    3    HB2  ALA  96           HB1      ALA  96 -30.248  -1.311  -9.244
    4    HB3  ALA  96           HB2      ALA  96 -30.482  -3.023  -9.597
    5    HB1  ALA  96           HB3      ALA  96 -29.580  -2.535  -8.163

  No H/Q in entry =           5
  In of MODEL   13
    1    H    VAL  97           H        VAL  97 -33.061  -3.361  -9.846
    2    HA   VAL  97           HA       VAL  97 -34.234  -1.082 -11.048
    3    HB   VAL  97           HB       VAL  97 -34.921  -4.038 -11.148
    4   HG11  VAL  97          HG11      VAL  97 -36.799  -2.098 -11.582
    5   HG13  VAL  97          HG12      VAL  97 -36.796  -3.676 -12.371
    6   HG12  VAL  97          HG13      VAL  97 -36.105  -2.279 -13.193
    7   HG21  VAL  97          HG21      VAL  97 -33.732  -2.116 -13.150
    8   HG23  VAL  97          HG22      VAL  97 -34.117  -3.808 -13.472
    9   HG22  VAL  97          HG23      VAL  97 -32.878  -3.393 -12.286

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ALA  98           H        ALA  98 -35.311  -3.362  -8.552
    2    HA   ALA  98           HA       ALA  98 -37.914  -2.327  -8.162
    3    HB1  ALA  98           HB1      ALA  98 -36.805  -4.504  -7.182
    4    HB3  ALA  98           HB2      ALA  98 -38.017  -3.649  -6.225
    5    HB2  ALA  98           HB3      ALA  98 -36.301  -3.437  -5.872

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA  99           H        ALA  99 -34.860  -1.438  -6.515
    2    HA   ALA  99           HA       ALA  99 -36.059   0.463  -4.805
    3    HB1  ALA  99           HB1      ALA  99 -33.381  -0.302  -5.586
    4    HB2  ALA  99           HB2      ALA  99 -33.952   0.393  -4.068
    5    HB3  ALA  99           HB3      ALA  99 -33.526   1.447  -5.415

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ILE 100           H        ILE 100 -35.045   0.707  -8.163
    2    HA   ILE 100           HA       ILE 100 -35.340   3.550  -8.319
    3    HB   ILE 100           HB       ILE 100 -35.362   1.439 -10.503
    4   HG12  ILE 100          HG12      ILE 100 -33.275   3.502  -9.801
    5   HG13  ILE 100          HG13      ILE 100 -33.242   1.842  -9.207
    6   HG21  ILE 100          HG21      ILE 100 -35.902   4.342 -10.568
    7   HG23  ILE 100          HG22      ILE 100 -36.363   3.078 -11.710
    8   HG22  ILE 100          HG23      ILE 100 -34.738   3.761 -11.760
    9   HD12  ILE 100          HD11      ILE 100 -32.766   2.879 -11.963
   10   HD11  ILE 100          HD12      ILE 100 -33.360   1.233 -11.739
   11   HD13  ILE 100          HD13      ILE 100 -31.828   1.723 -11.018

  No H/Q in entry =          11
  In of MODEL   13
    1    H    LYS 101           H        LYS 101 -37.532   0.867  -9.090
    2    HA   LYS 101           HA       LYS 101 -39.683   2.453 -10.041
    3    HB2  LYS 101           HB2      LYS 101 -39.450  -0.338  -8.976
    4    HB3  LYS 101           HB3      LYS 101 -41.033   0.368  -9.296
    5    HG2  LYS 101           HG2      LYS 101 -40.580   0.572 -11.592
    6    HG3  LYS 101           HG3      LYS 101 -38.867   0.229 -11.357
    7    HD2  LYS 101           HD2      LYS 101 -40.046  -1.708 -12.277
    8    HD3  LYS 101           HD3      LYS 101 -39.396  -2.047 -10.673
    9    HE2  LYS 101           HE2      LYS 101 -41.427  -2.835 -10.170
   10    HE3  LYS 101           HE3      LYS 101 -41.950  -1.151 -10.134
   11    HZ3  LYS 101           HZ1      LYS 101 -42.848  -1.297 -12.249
   12    HZ2  LYS 101           HZ2      LYS 101 -43.246  -2.803 -11.572
   13    HZ1  LYS 101           HZ3      LYS 101 -41.949  -2.679 -12.661

  No H/Q in entry =          13
  In of MODEL   13
    1    H    LYS 102           H        LYS 102 -39.113   0.927  -6.869
    2    HA   LYS 102           HA       LYS 102 -41.399   2.005  -5.633
    3    HB2  LYS 102           HB2      LYS 102 -40.084   0.167  -4.666
    4    HB3  LYS 102           HB3      LYS 102 -38.735   1.272  -4.407
    5    HG2  LYS 102           HG2      LYS 102 -40.096   2.580  -2.872
    6    HG3  LYS 102           HG3      LYS 102 -41.449   1.480  -3.134
    7    HD2  LYS 102           HD2      LYS 102 -40.143  -0.359  -2.156
    8    HD3  LYS 102           HD3      LYS 102 -38.791   0.743  -1.893
    9    HE2  LYS 102           HE2      LYS 102 -40.194   2.135  -0.444
   10    HE3  LYS 102           HE3      LYS 102 -41.565   1.064  -0.728
   11    HZ1  LYS 102           HZ1      LYS 102 -39.771  -0.643   0.227
   12    HZ3  LYS 102           HZ2      LYS 102 -40.910   0.177   1.183
   13    HZ2  LYS 102           HZ3      LYS 102 -39.322   0.768   1.059

  No H/Q in entry =          13
  In of MODEL   13
    1    H    ALA 103           H        ALA 103 -38.509   3.535  -6.630
    2    HA   ALA 103           HA       ALA 103 -38.813   5.799  -4.795
    3    HB2  ALA 103           HB1      ALA 103 -36.861   6.646  -6.364
    4    HB3  ALA 103           HB2      ALA 103 -36.760   4.941  -6.802
    5    HB1  ALA 103           HB3      ALA 103 -36.544   5.436  -5.122

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA 104           H        ALA 104 -39.424   5.118  -8.154
    2    HA   ALA 104           HA       ALA 104 -40.123   7.891  -8.711
    3    HB2  ALA 104           HB1      ALA 104 -40.153   7.270 -10.927
    4    HB1  ALA 104           HB2      ALA 104 -40.815   5.673 -10.581
    5    HB3  ALA 104           HB3      ALA 104 -39.103   5.998 -10.304

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA 105           H        ALA 105 -41.636   5.684  -6.946
    2    HA   ALA 105           HA       ALA 105 -44.113   6.979  -6.875
    3    HB2  ALA 105           HB1      ALA 105 -44.835   6.136  -8.929
    4    HB3  ALA 105           HB2      ALA 105 -45.418   4.898  -7.817
    5    HB1  ALA 105           HB3      ALA 105 -43.941   4.628  -8.741

  No H/Q in entry =           5
  In of MODEL   14
    1    H1   ALA   1           H3       ALA   1 -12.506 -15.345  -2.269
    2    H2   ALA   1           H2       ALA   1 -11.590 -16.500  -3.121
    3    H3   ALA   1           H1       ALA   1 -12.725 -15.533  -3.942
    4    HA   ALA   1           HA       ALA   1 -14.149 -17.212  -3.697
    5    HB3  ALA   1           HB1      ALA   1 -12.779 -19.008  -3.253
    6    HB1  ALA   1           HB2      ALA   1 -13.521 -18.888  -1.657
    7    HB2  ALA   1           HB3      ALA   1 -11.935 -18.173  -1.948

  No H/Q in entry =           7
  In of MODEL   14
    1    H    GLU   2           H        GLU   2 -15.773 -18.045  -2.033
    2    HA   GLU   2           HA       GLU   2 -17.385 -16.302  -0.956
    3    HB2  GLU   2           HB2      GLU   2 -16.473 -18.748   0.573
    4    HB3  GLU   2           HB3      GLU   2 -17.981 -17.874   0.842
    5    HG2  GLU   2           HG2      GLU   2 -18.992 -18.938  -0.888
    6    HG3  GLU   2           HG3      GLU   2 -17.671 -18.555  -1.982

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLU   3           H        GLU   3 -15.474 -17.696   1.648
    2    HA   GLU   3           HA       GLU   3 -15.645 -15.345   3.215
    3    HB2  GLU   3           HB2      GLU   3 -14.099 -17.918   3.444
    4    HB3  GLU   3           HB3      GLU   3 -13.837 -16.607   4.594
    5    HG2  GLU   3           HG2      GLU   3 -16.026 -16.725   5.429
    6    HG3  GLU   3           HG3      GLU   3 -16.646 -17.510   3.982

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LEU   4           H        LEU   4 -12.726 -16.867   1.795
    2    HA   LEU   4           HA       LEU   4 -10.856 -14.996   2.386
    3    HB2  LEU   4           HB2      LEU   4 -11.129 -16.280  -0.342
    4    HB3  LEU   4           HB3      LEU   4  -9.660 -15.586   0.334
    5    HG   LEU   4           HG       LEU   4 -11.184 -17.962   1.450
    6   HD13  LEU   4          HD11      LEU   4  -9.582 -19.341   0.504
    7   HD12  LEU   4          HD12      LEU   4  -8.351 -18.079   0.472
    8   HD11  LEU   4          HD13      LEU   4  -9.650 -18.075  -0.721
    9   HD23  LEU   4          HD21      LEU   4  -8.924 -18.068   2.814
   10   HD22  LEU   4          HD22      LEU   4 -10.224 -17.009   3.357
   11   HD21  LEU   4          HD23      LEU   4  -8.857 -16.339   2.467

  No H/Q in entry =          11
  In of MODEL   14
    1    H    GLU   5           H        GLU   5 -13.207 -14.741  -0.269
    2    HA   GLU   5           HA       GLU   5 -12.171 -12.271  -1.269
    3    HB2  GLU   5           HB2      GLU   5 -13.572 -13.860  -2.601
    4    HB3  GLU   5           HB3      GLU   5 -14.954 -13.407  -1.605
    5    HG2  GLU   5           HG2      GLU   5 -15.037 -12.054  -3.597
    6    HG3  GLU   5           HG3      GLU   5 -14.539 -11.008  -2.267

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLU   6           H        GLU   6 -14.894 -13.111   0.841
    2    HA   GLU   6           HA       GLU   6 -15.750 -10.422   1.257
    3    HB2  GLU   6           HB2      GLU   6 -17.209 -12.386   1.660
    4    HB3  GLU   6           HB3      GLU   6 -16.172 -12.860   3.005
    5    HG2  GLU   6           HG2      GLU   6 -16.650 -10.739   4.145
    6    HG3  GLU   6           HG3      GLU   6 -17.658 -10.227   2.793

  No H/Q in entry =           6
  In of MODEL   14
    1    H    VAL   7           H        VAL   7 -13.467 -12.576   2.803
    2    HA   VAL   7           HA       VAL   7 -12.956 -11.017   5.132
    3    HB   VAL   7           HB       VAL   7 -11.298 -13.084   3.663
    4   HG11  VAL   7          HG11      VAL   7 -10.785 -11.568   6.228
    5   HG13  VAL   7          HG12      VAL   7  -9.699 -11.796   4.858
    6   HG12  VAL   7          HG13      VAL   7 -10.067 -13.150   5.926
    7   HG21  VAL   7          HG21      VAL   7 -13.549 -13.615   4.898
    8   HG23  VAL   7          HG22      VAL   7 -12.606 -13.362   6.367
    9   HG22  VAL   7          HG23      VAL   7 -12.143 -14.625   5.229

  No H/Q in entry =           9
  In of MODEL   14
    1    H    VAL   8           H        VAL   8 -11.472 -11.145   1.910
    2    HA   VAL   8           HA       VAL   8  -9.374  -9.309   2.394
    3    HB   VAL   8           HB       VAL   8 -10.868  -9.966  -0.157
    4   HG12  VAL   8          HG11      VAL   8  -8.787  -8.964  -1.233
    5   HG11  VAL   8          HG12      VAL   8  -8.393  -8.292   0.351
    6   HG13  VAL   8          HG13      VAL   8  -9.876  -7.804  -0.468
    7   HG21  VAL   8          HG21      VAL   8  -9.198 -11.584   1.315
    8   HG23  VAL   8          HG22      VAL   8  -8.038 -10.775   0.266
    9   HG22  VAL   8          HG23      VAL   8  -9.363 -11.697  -0.438

  No H/Q in entry =           9
  In of MODEL   14
    1    H    MET   9           H        MET   9 -12.721  -8.860   1.261
    2    HA   MET   9           HA       MET   9 -12.615  -6.083   0.835
    3    HB2  MET   9           HB2      MET   9 -14.851  -7.927   1.670
    4    HB3  MET   9           HB3      MET   9 -15.107  -6.193   1.472
    5    HG2  MET   9           HG2      MET   9 -14.271  -6.333  -0.847
    6    HG3  MET   9           HG3      MET   9 -14.027  -8.069  -0.651
    7    HE2  MET   9           HE1      MET   9 -16.574  -5.398  -1.873
    8    HE1  MET   9           HE2      MET   9 -16.391  -5.209  -0.132
    9    HE3  MET   9           HE3      MET   9 -17.941  -5.717  -0.797

  No H/Q in entry =           9
  In of MODEL   14
    1    H    GLY  10           H        GLY  10 -13.287  -7.973   3.761
    2    HA3  GLY  10           HA2      GLY  10 -13.786  -5.786   5.491
    3    HA2  GLY  10           HA3      GLY  10 -13.244  -7.386   5.996

  No H/Q in entry =           3
  In of MODEL   14
    1    H    LEU  11           H        LEU  11 -10.811  -7.545   4.662
    2    HA   LEU  11           HA       LEU  11  -9.074  -6.146   6.410
    3    HB2  LEU  11           HB2      LEU  11  -8.570  -7.569   3.794
    4    HB3  LEU  11           HB3      LEU  11  -7.281  -6.889   4.785
    5    HG   LEU  11           HG       LEU  11  -9.308  -8.892   5.810
    6   HD13  LEU  11          HD11      LEU  11  -8.119 -10.143   4.232
    7   HD12  LEU  11          HD12      LEU  11  -7.177 -10.402   5.699
    8   HD11  LEU  11          HD13      LEU  11  -6.626  -9.242   4.492
    9   HD22  LEU  11          HD21      LEU  11  -8.425  -7.900   7.724
   10   HD21  LEU  11          HD22      LEU  11  -6.886  -7.521   6.951
   11   HD23  LEU  11          HD23      LEU  11  -7.235  -9.173   7.457

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  12           H        ILE  12  -9.992  -5.572   3.030
    2    HA   ILE  12           HA       ILE  12  -8.268  -3.368   2.598
    3    HB   ILE  12           HB       ILE  12 -10.942  -3.993   1.320
    4   HG12  ILE  12          HG12      ILE  12  -8.929  -5.673   1.224
    5   HG13  ILE  12          HG13      ILE  12  -9.798  -5.301  -0.250
    6   HG21  ILE  12          HG21      ILE  12  -8.701  -2.116   0.507
    7   HG23  ILE  12          HG22      ILE  12 -10.370  -1.684   0.853
    8   HG22  ILE  12          HG23      ILE  12  -9.977  -2.627  -0.555
    9   HD12  ILE  12          HD11      ILE  12  -7.300  -5.282  -0.489
   10   HD11  ILE  12          HD12      ILE  12  -7.249  -3.930   0.641
   11   HD13  ILE  12          HD13      ILE  12  -8.047  -3.751  -0.904

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  13           H        ILE  13 -11.625  -3.586   3.715
    2    HA   ILE  13           HA       ILE  13 -12.039  -0.793   3.998
    3    HB   ILE  13           HB       ILE  13 -13.272  -3.204   5.350
    4   HG12  ILE  13          HG12      ILE  13 -13.515  -2.623   2.824
    5   HG13  ILE  13          HG13      ILE  13 -14.940  -3.067   3.738
    6   HG22  ILE  13          HG21      ILE  13 -15.148  -1.395   5.817
    7   HG21  ILE  13          HG22      ILE  13 -13.795  -0.273   5.777
    8   HG23  ILE  13          HG23      ILE  13 -13.809  -1.593   6.944
    9   HD11  ILE  13          HD11      ILE  13 -14.096  -0.189   3.341
   10   HD13  ILE  13          HD12      ILE  13 -15.617  -0.798   3.963
   11   HD12  ILE  13          HD13      ILE  13 -15.224  -1.032   2.275

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ASN  14           H        ASN  14 -10.950  -3.308   6.256
    2    HA   ASN  14           HA       ASN  14 -10.707  -1.681   8.545
    3    HB2  ASN  14           HB2      ASN  14 -10.496  -4.291   8.213
    4    HB3  ASN  14           HB3      ASN  14  -8.783  -3.929   8.044
    5   HD21  ASN  14          HD21      ASN  14  -9.426  -5.451  10.220
    6   HD22  ASN  14          HD22      ASN  14  -9.374  -4.537  11.647

  No H/Q in entry =           6
  In of MODEL   14
    1    H    SER  15           H        SER  15  -8.336  -2.532   6.033
    2    HA   SER  15           HA       SER  15  -6.163  -1.075   7.094
    3    HB2  SER  15           HB2      SER  15  -5.162  -1.298   4.928
    4    HB3  SER  15           HB3      SER  15  -6.137  -2.745   5.154
    5    HG   SER  15           HG       SER  15  -6.630  -0.479   3.568

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLY  16           H        GLY  16  -8.768  -0.163   4.869
    2    HA3  GLY  16           HA2      GLY  16  -7.875   2.467   4.320
    3    HA2  GLY  16           HA3      GLY  16  -9.536   1.897   4.168

  No H/Q in entry =           3
  In of MODEL   14
    1    H    GLN  17           H        GLN  17 -10.069   1.171   6.819
    2    HA   GLN  17           HA       GLN  17 -10.733   3.681   7.973
    3    HB2  GLN  17           HB2      GLN  17 -10.663   0.895   9.146
    4    HB3  GLN  17           HB3      GLN  17 -11.266   2.301  10.023
    5    HG2  GLN  17           HG2      GLN  17 -12.314   1.389   7.328
    6    HG3  GLN  17           HG3      GLN  17 -13.079   1.014   8.872
    7   HE21  GLN  17          HE21      GLN  17 -14.208   2.731   9.982
    8   HE22  GLN  17          HE22      GLN  17 -14.494   4.237   9.254

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ALA  18           H        ALA  18  -8.132   1.361   8.566
    2    HA   ALA  18           HA       ALA  18  -7.001   2.554  10.833
    3    HB2  ALA  18           HB1      ALA  18  -6.432   0.335   9.454
    4    HB3  ALA  18           HB2      ALA  18  -5.250   1.098  10.518
    5    HB1  ALA  18           HB3      ALA  18  -5.182   1.381   8.778

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ARG  19           H        ARG  19  -6.247   3.079   7.380
    2    HA   ARG  19           HA       ARG  19  -4.318   5.098   7.802
    3    HB2  ARG  19           HB2      ARG  19  -4.677   3.969   5.605
    4    HB3  ARG  19           HB3      ARG  19  -6.209   4.831   5.442
    5    HG2  ARG  19           HG2      ARG  19  -5.051   6.987   5.509
    6    HG3  ARG  19           HG3      ARG  19  -3.510   6.180   5.799
    7    HD2  ARG  19           HD2      ARG  19  -3.644   6.780   3.459
    8    HD3  ARG  19           HD3      ARG  19  -3.752   5.021   3.600
    9    HE   ARG  19           HE       ARG  19  -6.373   5.965   3.614
   10   HH21  ARG  19          HH11      ARG  19  -7.580   6.143   1.705
   11   HH22  ARG  19          HH12      ARG  19  -6.768   6.215   0.180
   12   HH11  ARG  19          HH21      ARG  19  -3.612   5.998   1.560
   13   HH12  ARG  19          HH22      ARG  19  -4.520   6.130   0.098

  No H/Q in entry =          13
  In of MODEL   14
    1    H    SER  20           H        SER  20  -7.819   5.262   7.227
    2    HA   SER  20           HA       SER  20  -8.140   8.022   7.190
    3    HB2  SER  20           HB2      SER  20 -10.040   6.713   6.663
    4    HB3  SER  20           HB3      SER  20  -9.930   5.806   8.169
    5    HG   SER  20           HG       SER  20 -10.544   8.563   7.862

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU  21           H        LEU  21  -8.148   5.831   9.987
    2    HA   LEU  21           HA       LEU  21  -8.549   7.826  11.961
    3    HB2  LEU  21           HB2      LEU  21  -7.230   5.107  12.104
    4    HB3  LEU  21           HB3      LEU  21  -7.518   6.124  13.513
    5    HG   LEU  21           HG       LEU  21  -9.713   5.265  11.604
    6   HD11  LEU  21          HD11      LEU  21  -8.647   3.982  14.120
    7   HD13  LEU  21          HD12      LEU  21  -8.960   3.232  12.555
    8   HD12  LEU  21          HD13      LEU  21 -10.307   3.722  13.584
    9   HD23  LEU  21          HD21      LEU  21 -11.025   5.759  13.846
   10   HD22  LEU  21          HD22      LEU  21 -10.566   7.108  12.812
   11   HD21  LEU  21          HD23      LEU  21  -9.617   6.739  14.242

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ALA  22           H        ALA  22  -5.624   6.420  10.529
    2    HA   ALA  22           HA       ALA  22  -3.717   7.704  12.141
    3    HB2  ALA  22           HB1      ALA  22  -3.336   5.851  10.442
    4    HB1  ALA  22           HB2      ALA  22  -2.124   7.131  10.472
    5    HB3  ALA  22           HB3      ALA  22  -3.351   7.107   9.205

  No H/Q in entry =           5
  In of MODEL   14
    1    H    TYR  23           H        TYR  23  -5.043   8.747   8.971
    2    HA   TYR  23           HA       TYR  23  -3.677  11.227   8.899
    3    HB2  TYR  23           HB2      TYR  23  -4.782  10.336   6.912
    4    HB3  TYR  23           HB3      TYR  23  -6.354  10.458   7.704
    5    HD1  TYR  23           HD1      TYR  23  -3.444  12.463   6.514
    6    HD2  TYR  23           HD2      TYR  23  -7.563  12.491   7.727
    7    HE1  TYR  23           HE1      TYR  23  -3.647  14.818   5.765
    8    HE2  TYR  23           HE2      TYR  23  -7.768  14.846   6.977
    9    HH   TYR  23           HH       TYR  23  -5.100  16.483   5.316

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ALA  24           H        ALA  24  -6.799  10.284  10.297
    2    HA   ALA  24           HA       ALA  24  -7.597  12.882  11.082
    3    HB1  ALA  24           HB1      ALA  24  -9.428  11.652  11.558
    4    HB2  ALA  24           HB2      ALA  24  -8.599  11.066  12.999
    5    HB3  ALA  24           HB3      ALA  24  -8.496  10.157  11.492

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA  25           H        ALA  25  -5.615  10.394  12.635
    2    HA   ALA  25           HA       ALA  25  -5.245  11.634  15.138
    3    HB2  ALA  25           HB1      ALA  25  -4.513   9.276  14.305
    4    HB3  ALA  25           HB2      ALA  25  -3.479  10.117  15.461
    5    HB1  ALA  25           HB3      ALA  25  -3.055  10.100  13.749

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU  26           H        LEU  26  -3.471  11.920  12.086
    2    HA   LEU  26           HA       LEU  26  -1.484  13.713  12.995
    3    HB2  LEU  26           HB2      LEU  26  -1.211  12.564  10.885
    4    HB3  LEU  26           HB3      LEU  26  -2.680  13.292  10.243
    5    HG   LEU  26           HG       LEU  26  -1.636  15.529  10.378
    6   HD12  LEU  26          HD11      LEU  26   0.905  15.516  10.775
    7   HD11  LEU  26          HD12      LEU  26   0.667  13.936  11.516
    8   HD13  LEU  26          HD13      LEU  26  -0.118  15.359  12.202
    9   HD21  LEU  26          HD21      LEU  26   0.071  13.457   8.965
   10   HD23  LEU  26          HD22      LEU  26   0.047  15.180   8.600
   11   HD22  LEU  26          HD23      LEU  26  -1.390  14.202   8.319

  No H/Q in entry =          11
  In of MODEL   14
    1    H    LYS  27           H        LYS  27  -4.670  14.240  11.541
    2    HA   LYS  27           HA       LYS  27  -4.580  17.029  11.350
    3    HB2  LYS  27           HB2      LYS  27  -6.350  15.577  10.373
    4    HB3  LYS  27           HB3      LYS  27  -6.999  15.324  11.992
    5    HG2  LYS  27           HG2      LYS  27  -7.396  17.734  12.239
    6    HG3  LYS  27           HG3      LYS  27  -6.695  18.027  10.644
    7    HD2  LYS  27           HD2      LYS  27  -8.452  16.619   9.615
    8    HD3  LYS  27           HD3      LYS  27  -9.159  16.343  11.209
    9    HE2  LYS  27           HE2      LYS  27  -9.569  18.759  11.462
   10    HE3  LYS  27           HE3      LYS  27  -8.834  19.056   9.883
   11    HZ3  LYS  27           HZ1      LYS  27 -11.214  18.962   9.658
   12    HZ2  LYS  27           HZ2      LYS  27 -11.277  17.444  10.423
   13    HZ1  LYS  27           HZ3      LYS  27 -10.540  17.603   8.897

  No H/Q in entry =          13
  In of MODEL   14
    1    H    GLN  28           H        GLN  28  -5.477  14.946  14.077
    2    HA   GLN  28           HA       GLN  28  -6.334  16.956  15.866
    3    HB2  GLN  28           HB2      GLN  28  -4.960  14.307  16.394
    4    HB3  GLN  28           HB3      GLN  28  -5.686  15.316  17.646
    5    HG2  GLN  28           HG2      GLN  28  -7.168  14.217  15.241
    6    HG3  GLN  28           HG3      GLN  28  -7.228  13.524  16.861
    7   HE21  GLN  28          HE21      GLN  28  -9.087  15.350  14.905
    8   HE22  GLN  28          HE22      GLN  28  -9.821  16.375  16.041

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ALA  29           H        ALA  29  -3.137  15.618  15.150
    2    HA   ALA  29           HA       ALA  29  -1.667  16.989  17.122
    3    HB1  ALA  29           HB1      ALA  29   0.247  16.275  15.988
    4    HB3  ALA  29           HB2      ALA  29  -0.517  16.415  14.404
    5    HB2  ALA  29           HB3      ALA  29  -0.950  15.085  15.478

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LYS  30           H        LYS  30  -2.535  17.891  13.802
    2    HA   LYS  30           HA       LYS  30  -1.089  20.310  13.699
    3    HB2  LYS  30           HB2      LYS  30  -3.643  19.480  12.305
    4    HB3  LYS  30           HB3      LYS  30  -2.788  20.983  11.960
    5    HG2  LYS  30           HG2      LYS  30  -0.742  19.659  11.428
    6    HG3  LYS  30           HG3      LYS  30  -1.670  18.177  11.675
    7    HD2  LYS  30           HD2      LYS  30  -3.237  18.847   9.893
    8    HD3  LYS  30           HD3      LYS  30  -2.332  20.342   9.649
    9    HE2  LYS  30           HE2      LYS  30  -0.324  19.019   9.051
   10    HE3  LYS  30           HE3      LYS  30  -1.248  17.530   9.264
   11    HZ2  LYS  30           HZ1      LYS  30  -1.075  18.406   6.924
   12    HZ1  LYS  30           HZ2      LYS  30  -2.095  19.683   7.404
   13    HZ3  LYS  30           HZ3      LYS  30  -2.645  18.075   7.474

  No H/Q in entry =          13
  In of MODEL   14
    1    H    GLN  31           H        GLN  31  -4.192  19.504  15.131
    2    HA   GLN  31           HA       GLN  31  -4.907  22.271  15.597
    3    HB2  GLN  31           HB2      GLN  31  -6.117  19.840  16.920
    4    HB3  GLN  31           HB3      GLN  31  -6.852  21.425  16.686
    5    HG2  GLN  31           HG2      GLN  31  -6.174  20.645  14.088
    6    HG3  GLN  31           HG3      GLN  31  -6.718  19.147  14.834
    7   HE21  GLN  31          HE21      GLN  31  -8.117  20.752  12.748
    8   HE22  GLN  31          HE22      GLN  31  -9.619  21.166  13.418

  No H/Q in entry =           8
  In of MODEL   14
    1    H    GLY  32           H        GLY  32  -2.618  20.301  16.894
    2    HA3  GLY  32           HA2      GLY  32  -1.196  20.733  18.687
    3    HA2  GLY  32           HA3      GLY  32  -2.300  21.993  19.223

  No H/Q in entry =           3
  In of MODEL   14
    1    H    ASP  33           H        ASP  33  -3.780  18.980  18.562
    2    HA   ASP  33           HA       ASP  33  -4.177  18.520  21.443
    3    HB2  ASP  33           HB2      ASP  33  -5.618  17.541  18.973
    4    HB3  ASP  33           HB3      ASP  33  -5.962  16.931  20.589

  No H/Q in entry =           4
  In of MODEL   14
    1    H    PHE  34           H        PHE  34  -2.021  17.630  21.729
    2    HA   PHE  34           HA       PHE  34  -1.070  15.369  20.313
    3    HB2  PHE  34           HB2      PHE  34  -0.416  16.333  23.106
    4    HB3  PHE  34           HB3      PHE  34   0.485  15.097  22.228
    5    HD1  PHE  34           HD1      PHE  34   0.378  18.523  22.976
    6    HD2  PHE  34           HD2      PHE  34   1.137  15.817  19.726
    7    HE1  PHE  34           HE1      PHE  34   1.695  20.276  21.819
    8    HE2  PHE  34           HE2      PHE  34   2.450  17.573  18.573
    9    HZ   PHE  34           HZ       PHE  34   2.731  19.799  19.624

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ALA  35           H        ALA  35  -3.084  15.671  23.192
    2    HA   ALA  35           HA       ALA  35  -2.911  13.003  24.078
    3    HB3  ALA  35           HB1      ALA  35  -5.351  13.668  24.956
    4    HB1  ALA  35           HB2      ALA  35  -4.793  15.278  24.502
    5    HB2  ALA  35           HB3      ALA  35  -3.887  14.334  25.683

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA  36           H        ALA  36  -5.350  14.570  22.002
    2    HA   ALA  36           HA       ALA  36  -6.811  12.185  21.526
    3    HB1  ALA  36           HB1      ALA  36  -8.248  13.636  20.586
    4    HB3  ALA  36           HB2      ALA  36  -7.078  14.040  19.330
    5    HB2  ALA  36           HB3      ALA  36  -7.076  14.923  20.857

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA  37           H        ALA  37  -4.115  13.731  19.843
    2    HA   ALA  37           HA       ALA  37  -4.126  12.104  17.540
    3    HB3  ALA  37           HB1      ALA  37  -2.093  13.776  18.954
    4    HB2  ALA  37           HB2      ALA  37  -2.635  13.847  17.278
    5    HB1  ALA  37           HB3      ALA  37  -1.500  12.595  17.786

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LYS  38           H        LYS  38  -2.352  11.756  20.604
    2    HA   LYS  38           HA       LYS  38  -1.072   9.335  20.096
    3    HB2  LYS  38           HB2      LYS  38  -1.348  11.095  22.250
    4    HB3  LYS  38           HB3      LYS  38  -1.989   9.574  22.866
    5    HG2  LYS  38           HG2      LYS  38   0.081   8.420  22.309
    6    HG3  LYS  38           HG3      LYS  38   0.709   9.857  21.496
    7    HD2  LYS  38           HD2      LYS  38   0.914  11.065  23.535
    8    HD3  LYS  38           HD3      LYS  38  -0.118   9.929  24.405
    9    HE2  LYS  38           HE2      LYS  38   2.236   9.570  25.005
   10    HE3  LYS  38           HE3      LYS  38   1.601   8.168  24.140
   11    HZ3  LYS  38           HZ1      LYS  38   2.895   8.571  22.351
   12    HZ2  LYS  38           HZ2      LYS  38   3.873   9.378  23.484
   13    HZ1  LYS  38           HZ3      LYS  38   2.801  10.260  22.503

  No H/Q in entry =          13
  In of MODEL   14
    1    H    ALA  39           H        ALA  39  -4.291   9.881  21.525
    2    HA   ALA  39           HA       ALA  39  -4.894   7.170  22.023
    3    HB3  ALA  39           HB1      ALA  39  -7.025   9.154  21.279
    4    HB2  ALA  39           HB2      ALA  39  -6.112   9.360  22.775
    5    HB1  ALA  39           HB3      ALA  39  -7.056   7.893  22.513

  No H/Q in entry =           5
  In of MODEL   14
    1    H    MET  40           H        MET  40  -5.466   9.204  19.188
    2    HA   MET  40           HA       MET  40  -6.986   7.303  17.732
    3    HB2  MET  40           HB2      MET  40  -5.342   9.674  16.824
    4    HB3  MET  40           HB3      MET  40  -6.392   8.737  15.758
    5    HG2  MET  40           HG2      MET  40  -7.386   9.993  18.329
    6    HG3  MET  40           HG3      MET  40  -7.440  10.835  16.782
    7    HE3  MET  40           HE1      MET  40 -10.066   9.268  14.731
    8    HE2  MET  40           HE2      MET  40  -8.313   9.355  14.570
    9    HE1  MET  40           HE3      MET  40  -9.203  10.734  15.216

  No H/Q in entry =           9
  In of MODEL   14
    1    H    MET  41           H        MET  41  -3.482   7.980  17.831
    2    HA   MET  41           HA       MET  41  -2.769   6.221  15.719
    3    HB2  MET  41           HB2      MET  41  -1.123   6.851  18.182
    4    HB3  MET  41           HB3      MET  41  -0.528   6.198  16.659
    5    HG2  MET  41           HG2      MET  41  -1.655   8.404  15.672
    6    HG3  MET  41           HG3      MET  41  -1.396   8.982  17.317
    7    HE2  MET  41           HE1      MET  41   1.489   6.833  17.649
    8    HE1  MET  41           HE2      MET  41   0.728   8.137  18.558
    9    HE3  MET  41           HE3      MET  41   2.351   8.355  17.904

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ASP  42           H        ASP  42  -3.136   5.741  19.206
    2    HA   ASP  42           HA       ASP  42  -2.142   3.130  19.349
    3    HB2  ASP  42           HB2      ASP  42  -2.973   4.897  21.184
    4    HB3  ASP  42           HB3      ASP  42  -4.418   3.895  21.118

  No H/Q in entry =           4
  In of MODEL   14
    1    H    GLN  43           H        GLN  43  -5.461   4.291  18.877
    2    HA   GLN  43           HA       GLN  43  -6.648   1.723  18.681
    3    HB2  GLN  43           HB2      GLN  43  -7.535   4.395  17.569
    4    HB3  GLN  43           HB3      GLN  43  -8.523   2.932  17.548
    5    HG2  GLN  43           HG2      GLN  43  -8.213   2.796  20.053
    6    HG3  GLN  43           HG3      GLN  43  -7.463   4.389  19.982
    7   HE21  GLN  43          HE21      GLN  43  -9.630   4.499  21.499
    8   HE22  GLN  43          HE22      GLN  43 -10.987   5.100  20.679

  No H/Q in entry =           8
  In of MODEL   14
    1    H    SER  44           H        SER  44  -5.289   3.924  16.268
    2    HA   SER  44           HA       SER  44  -6.031   2.461  13.978
    3    HB2  SER  44           HB2      SER  44  -4.732   4.821  14.422
    4    HB3  SER  44           HB3      SER  44  -3.399   3.805  13.878
    5    HG   SER  44           HG       SER  44  -4.508   4.802  12.127

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ARG  45           H        ARG  45  -3.141   2.292  16.037
    2    HA   ARG  45           HA       ARG  45  -1.703   0.319  14.637
    3    HB2  ARG  45           HB2      ARG  45  -0.825   1.719  16.505
    4    HB3  ARG  45           HB3      ARG  45  -1.823   0.800  17.629
    5    HG2  ARG  45           HG2      ARG  45  -0.631  -1.276  16.969
    6    HG3  ARG  45           HG3      ARG  45   0.393  -0.333  15.887
    7    HD2  ARG  45           HD2      ARG  45   1.164   1.027  17.843
    8    HD3  ARG  45           HD3      ARG  45   0.232  -0.036  18.919
    9    HE   ARG  45           HE       ARG  45   1.893  -1.654  17.320
   10   HH21  ARG  45          HH11      ARG  45   3.785  -2.511  18.140
   11   HH22  ARG  45          HH12      ARG  45   4.581  -1.743  19.469
   12   HH11  ARG  45          HH21      ARG  45   2.254   0.798  19.717
   13   HH12  ARG  45          HH22      ARG  45   3.713   0.133  20.359

  No H/Q in entry =          13
  In of MODEL   14
    1    H    MET  46           H        MET  46  -4.087   0.028  17.253
    2    HA   MET  46           HA       MET  46  -3.964  -2.775  17.547
    3    HB2  MET  46           HB2      MET  46  -6.124  -0.755  18.154
    4    HB3  MET  46           HB3      MET  46  -6.305  -2.470  18.531
    5    HG2  MET  46           HG2      MET  46  -3.915  -2.140  19.632
    6    HG3  MET  46           HG3      MET  46  -4.423  -0.460  19.713
    7    HE1  MET  46           HE1      MET  46  -7.176  -0.333  19.900
    8    HE3  MET  46           HE2      MET  46  -7.986  -0.943  21.338
    9    HE2  MET  46           HE3      MET  46  -7.858  -1.963  19.909

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ALA  47           H        ALA  47  -5.965  -0.716  15.475
    2    HA   ALA  47           HA       ALA  47  -7.624  -2.734  14.413
    3    HB3  ALA  47           HB1      ALA  47  -8.269  -0.484  14.011
    4    HB1  ALA  47           HB2      ALA  47  -7.802  -1.119  12.433
    5    HB2  ALA  47           HB3      ALA  47  -6.697  -0.073  13.326

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU  48           H        LEU  48  -4.491  -1.475  13.345
    2    HA   LEU  48           HA       LEU  48  -4.254  -3.061  10.996
    3    HB2  LEU  48           HB2      LEU  48  -2.162  -1.826  12.795
    4    HB3  LEU  48           HB3      LEU  48  -1.817  -2.546  11.222
    5    HG   LEU  48           HG       LEU  48  -3.798  -0.295  11.635
    6   HD13  LEU  48          HD11      LEU  48  -1.657   0.541  12.289
    7   HD12  LEU  48          HD12      LEU  48  -1.933   1.106  10.641
    8   HD11  LEU  48          HD13      LEU  48  -0.858  -0.261  10.937
    9   HD22  LEU  48          HD21      LEU  48  -4.301  -1.263   9.558
   10   HD21  LEU  48          HD22      LEU  48  -2.629  -1.726   9.250
   11   HD23  LEU  48          HD23      LEU  48  -3.119  -0.038   9.101

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ASN  49           H        ASN  49  -3.193  -3.490  14.333
    2    HA   ASN  49           HA       ASN  49  -1.634  -5.780  13.982
    3    HB2  ASN  49           HB2      ASN  49  -1.636  -4.440  16.035
    4    HB3  ASN  49           HB3      ASN  49  -3.290  -4.927  16.373
    5   HD21  ASN  49          HD21      ASN  49  -2.641  -5.951  18.387
    6   HD22  ASN  49          HD22      ASN  49  -1.786  -7.416  18.393

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLU  50           H        GLU  50  -5.092  -5.444  14.679
    2    HA   GLU  50           HA       GLU  50  -5.655  -8.234  14.779
    3    HB2  GLU  50           HB2      GLU  50  -7.203  -6.522  15.673
    4    HB3  GLU  50           HB3      GLU  50  -7.498  -5.945  14.031
    5    HG2  GLU  50           HG2      GLU  50  -8.408  -8.122  13.390
    6    HG3  GLU  50           HG3      GLU  50  -8.027  -8.779  14.978

  No H/Q in entry =           6
  In of MODEL   14
    1    H    ALA  51           H        ALA  51  -5.696  -5.824  12.194
    2    HA   ALA  51           HA       ALA  51  -6.727  -7.525  10.172
    3    HB2  ALA  51           HB1      ALA  51  -6.483  -5.711   8.808
    4    HB1  ALA  51           HB2      ALA  51  -4.833  -5.395   9.347
    5    HB3  ALA  51           HB3      ALA  51  -6.200  -4.862  10.327

  No H/Q in entry =           5
  In of MODEL   14
    1    H    HIS  52           H        HIS  52  -3.413  -6.685  11.136
    2    HA   HIS  52           HA       HIS  52  -2.057  -8.192   9.171
    3    HB2  HIS  52           HB2      HIS  52  -0.985  -6.482  10.618
    4    HB3  HIS  52           HB3      HIS  52  -1.156  -7.570  11.995
    5    HD1  HIS  52           HD1      HIS  52   0.204  -9.853  11.875
    6    HD2  HIS  52           HD2      HIS  52   1.174  -7.069   8.927
    7    HE1  HIS  52           HE1      HIS  52   2.399 -10.613  10.866
    8    HE2  HIS  52           HE2      HIS  52   3.003  -8.927   9.066

  No H/Q in entry =           8
  In of MODEL   14
    1    H    LEU  53           H        LEU  53  -3.264  -9.060  12.388
    2    HA   LEU  53           HA       LEU  53  -2.115 -11.628  12.563
    3    HB2  LEU  53           HB2      LEU  53  -4.569 -10.404  13.799
    4    HB3  LEU  53           HB3      LEU  53  -4.140 -12.089  14.081
    5    HG   LEU  53           HG       LEU  53  -2.189  -9.811  14.552
    6   HD13  LEU  53          HD11      LEU  53  -4.048  -9.403  16.030
    7   HD12  LEU  53          HD12      LEU  53  -2.774 -10.159  16.984
    8   HD11  LEU  53          HD13      LEU  53  -4.157 -11.108  16.452
    9   HD21  LEU  53          HD21      LEU  53  -2.282 -12.749  15.270
   10   HD23  LEU  53          HD22      LEU  53  -1.313 -11.620  16.211
   11   HD22  LEU  53          HD23      LEU  53  -0.967 -11.860  14.508

  No H/Q in entry =          11
  In of MODEL   14
    1    H    VAL  54           H        VAL  54  -5.214 -10.531  11.227
    2    HA   VAL  54           HA       VAL  54  -6.184 -13.103  10.535
    3    HB   VAL  54           HB       VAL  54  -6.784 -10.353   9.416
    4   HG12  VAL  54          HG11      VAL  54  -8.918 -11.685   8.613
    5   HG11  VAL  54          HG12      VAL  54  -7.834 -13.073   8.672
    6   HG13  VAL  54          HG13      VAL  54  -7.454 -11.701   7.633
    7   HG22  VAL  54          HG21      VAL  54  -7.677 -10.382  11.574
    8   HG21  VAL  54          HG22      VAL  54  -7.966 -12.120  11.549
    9   HG23  VAL  54          HG23      VAL  54  -9.032 -11.037  10.654

  No H/Q in entry =           9
  In of MODEL   14
    1    H    GLN  55           H        GLN  55  -4.275 -10.683   8.743
    2    HA   GLN  55           HA       GLN  55  -4.191 -12.139   6.319
    3    HB2  GLN  55           HB2      GLN  55  -3.543  -9.886   6.134
    4    HB3  GLN  55           HB3      GLN  55  -2.425  -9.991   7.492
    5    HG2  GLN  55           HG2      GLN  55  -0.733 -10.867   6.200
    6    HG3  GLN  55           HG3      GLN  55  -1.833 -11.815   5.209
    7   HE21  GLN  55          HE21      GLN  55  -1.850 -11.116   3.091
    8   HE22  GLN  55          HE22      GLN  55  -1.623  -9.514   2.586

  No H/Q in entry =           8
  In of MODEL   14
    1    H    THR  56           H        THR  56  -2.066 -12.173   9.186
    2    HA   THR  56           HA       THR  56  -0.027 -13.811   8.248
    3    HB   THR  56           HB       THR  56  -1.257 -14.047  11.003
    4    HG1  THR  56           HG1      THR  56   0.315 -12.066   9.793
    5   HG23  THR  56          HG21      THR  56   0.417 -15.701  10.716
    6   HG22  THR  56          HG22      THR  56   1.239 -14.372  11.538
    7   HG21  THR  56          HG23      THR  56   1.455 -14.606   9.803

  No H/Q in entry =           7
  In of MODEL   14
    1    H    LYS  57           H        LYS  57  -3.159 -14.788   9.627
    2    HA   LYS  57           HA       LYS  57  -2.773 -17.591   9.367
    3    HB2  LYS  57           HB2      LYS  57  -4.560 -16.464  10.728
    4    HB3  LYS  57           HB3      LYS  57  -5.353 -16.000   9.232
    5    HG2  LYS  57           HG2      LYS  57  -5.671 -18.342   8.624
    6    HG3  LYS  57           HG3      LYS  57  -4.791 -18.861  10.060
    7    HD2  LYS  57           HD2      LYS  57  -7.088 -19.066  10.642
    8    HD3  LYS  57           HD3      LYS  57  -6.562 -17.571  11.414
    9    HE2  LYS  57           HE2      LYS  57  -7.596 -16.223   9.723
   10    HE3  LYS  57           HE3      LYS  57  -7.848 -17.605   8.661
   11    HZ2  LYS  57           HZ1      LYS  57  -9.842 -16.832   9.932
   12    HZ1  LYS  57           HZ2      LYS  57  -9.081 -17.393  11.344
   13    HZ3  LYS  57           HZ3      LYS  57  -9.472 -18.480  10.098

  No H/Q in entry =          13
  In of MODEL   14
    1    H    LEU  58           H        LEU  58  -4.068 -15.113   7.210
    2    HA   LEU  58           HA       LEU  58  -4.921 -16.912   5.202
    3    HB2  LEU  58           HB2      LEU  58  -4.254 -13.976   5.075
    4    HB3  LEU  58           HB3      LEU  58  -4.946 -14.893   3.735
    5    HG   LEU  58           HG       LEU  58  -6.203 -14.699   6.492
    6   HD11  LEU  58          HD11      LEU  58  -6.485 -13.035   4.009
    7   HD13  LEU  58          HD12      LEU  58  -6.453 -12.535   5.700
    8   HD12  LEU  58          HD13      LEU  58  -7.897 -13.295   5.034
    9   HD22  LEU  58          HD21      LEU  58  -7.211 -16.583   5.621
   10   HD21  LEU  58          HD22      LEU  58  -6.873 -16.132   3.950
   11   HD23  LEU  58          HD23      LEU  58  -8.216 -15.381   4.813

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  59           H        ILE  59  -1.755 -15.771   6.047
    2    HA   ILE  59           HA       ILE  59  -0.690 -16.510   3.400
    3    HB   ILE  59           HB       ILE  59   0.132 -14.466   4.966
    4   HG12  ILE  59          HG12      ILE  59   2.182 -16.165   3.530
    5   HG13  ILE  59          HG13      ILE  59   1.007 -15.197   2.678
    6   HG21  ILE  59          HG21      ILE  59   0.843 -16.256   6.725
    7   HG23  ILE  59          HG22      ILE  59   1.972 -14.972   6.356
    8   HG22  ILE  59          HG23      ILE  59   2.183 -16.573   5.647
    9   HD13  ILE  59          HD11      ILE  59   1.807 -13.166   3.765
   10   HD12  ILE  59          HD12      ILE  59   3.156 -13.990   2.987
   11   HD11  ILE  59          HD13      ILE  59   2.936 -14.113   4.733

  No H/Q in entry =          11
  In of MODEL   14
    1    H    GLU  60           H        GLU  60  -0.703 -17.630   6.764
    2    HA   GLU  60           HA       GLU  60   1.284 -19.649   6.478
    3    HB2  GLU  60           HB2      GLU  60   0.612 -18.911   8.683
    4    HB3  GLU  60           HB3      GLU  60  -1.054 -19.404   8.386
    5    HG2  GLU  60           HG2      GLU  60   1.186 -21.411   8.192
    6    HG3  GLU  60           HG3      GLU  60   0.487 -20.999   9.755

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLY  61           H        GLY  61  -2.231 -19.671   6.014
    2    HA3  GLY  61           HA2      GLY  61  -2.048 -22.464   5.043
    3    HA2  GLY  61           HA3      GLY  61  -3.513 -21.700   5.649

  No H/Q in entry =           3
  In of MODEL   14
    1    H    ASP  62           H        ASP  62  -1.264 -20.160   3.438
    2    HA   ASP  62           HA       ASP  62  -3.358 -19.562   1.578
    3    HB2  ASP  62           HB2      ASP  62  -1.527 -18.496   0.290
    4    HB3  ASP  62           HB3      ASP  62  -1.546 -17.988   1.976

  No H/Q in entry =           4
  In of MODEL   14
    1    H    ALA  63           H        ALA  63  -3.865 -22.001   1.272
    2    HA   ALA  63           HA       ALA  63  -2.114 -23.630  -0.294
    3    HB3  ALA  63           HB1      ALA  63  -4.357 -24.810  -0.841
    4    HB2  ALA  63           HB2      ALA  63  -5.033 -23.711   0.361
    5    HB1  ALA  63           HB3      ALA  63  -3.757 -24.840   0.818

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLY  64           H        GLY  64  -4.697 -21.345  -1.039
    2    HA3  GLY  64           HA2      GLY  64  -4.988 -20.092  -2.984
    3    HA2  GLY  64           HA3      GLY  64  -3.729 -21.037  -3.759

  No H/Q in entry =           3
  In of MODEL   14
    1    H    GLU  65           H        GLU  65  -5.891 -20.481  -5.269
    2    HA   GLU  65           HA       GLU  65  -8.036 -22.302  -5.039
    3    HB2  GLU  65           HB2      GLU  65  -6.989 -20.758  -7.409
    4    HB3  GLU  65           HB3      GLU  65  -8.475 -21.710  -7.437
    5    HG2  GLU  65           HG2      GLU  65  -9.405 -20.378  -5.612
    6    HG3  GLU  65           HG3      GLU  65  -7.902 -19.467  -5.480

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLY  66           H        GLY  66  -5.033 -22.444  -6.799
    2    HA3  GLY  66           HA2      GLY  66  -5.594 -25.150  -7.780
    3    HA2  GLY  66           HA3      GLY  66  -4.350 -24.077  -8.389

  No H/Q in entry =           3
  In of MODEL   14
    1    H    LYS  67           H        LYS  67  -3.390 -26.386  -8.093
    2    HA   LYS  67           HA       LYS  67  -2.723 -27.658  -5.840
    3    HB2  LYS  67           HB2      LYS  67  -0.442 -28.082  -6.970
    4    HB3  LYS  67           HB3      LYS  67  -1.910 -28.558  -7.832
    5    HG2  LYS  67           HG2      LYS  67  -1.888 -26.441  -9.080
    6    HG3  LYS  67           HG3      LYS  67  -0.449 -25.924  -8.203
    7    HD2  LYS  67           HD2      LYS  67   0.815 -27.819  -9.148
    8    HD3  LYS  67           HD3      LYS  67  -0.626 -28.342 -10.024
    9    HE2  LYS  67           HE2      LYS  67  -0.683 -26.195 -11.232
   10    HE3  LYS  67           HE3      LYS  67   0.746 -25.657 -10.352
   11    HZ3  LYS  67           HZ1      LYS  67   1.826 -26.522 -12.094
   12    HZ2  LYS  67           HZ2      LYS  67   0.523 -27.504 -12.567
   13    HZ1  LYS  67           HZ3      LYS  67   1.566 -28.010 -11.324

  No H/Q in entry =          13
  In of MODEL   14
    1    H    MET  68           H        MET  68   0.243 -26.455  -6.735
    2    HA   MET  68           HA       MET  68   1.053 -25.718  -4.149
    3    HB2  MET  68           HB2      MET  68   2.247 -25.338  -6.880
    4    HB3  MET  68           HB3      MET  68   3.058 -24.760  -5.424
    5    HG2  MET  68           HG2      MET  68   3.044 -27.011  -4.479
    6    HG3  MET  68           HG3      MET  68   2.135 -27.615  -5.866
    7    HE1  MET  68           HE1      MET  68   5.087 -26.012  -4.444
    8    HE3  MET  68           HE2      MET  68   5.368 -25.027  -5.879
    9    HE2  MET  68           HE3      MET  68   6.467 -26.351  -5.498

  No H/Q in entry =           9
  In of MODEL   14
    1    H    LYS  69           H        LYS  69   0.081 -23.683  -6.902
    2    HA   LYS  69           HA       LYS  69   0.887 -21.221  -6.204
    3    HB2  LYS  69           HB2      LYS  69  -1.793 -21.989  -7.314
    4    HB3  LYS  69           HB3      LYS  69  -1.232 -20.317  -7.197
    5    HG2  LYS  69           HG2      LYS  69   0.773 -20.887  -8.506
    6    HG3  LYS  69           HG3      LYS  69   0.226 -22.560  -8.625
    7    HD2  LYS  69           HD2      LYS  69  -1.792 -21.825  -9.827
    8    HD3  LYS  69           HD3      LYS  69  -1.261 -20.146  -9.699
    9    HE2  LYS  69           HE2      LYS  69   0.764 -20.669 -10.990
   10    HE3  LYS  69           HE3      LYS  69   0.275 -22.360 -11.091
   11    HZ1  LYS  69           HZ1      LYS  69  -1.540 -20.240 -12.027
   12    HZ3  LYS  69           HZ2      LYS  69  -1.460 -21.870 -12.498
   13    HZ2  LYS  69           HZ3      LYS  69  -0.276 -20.772 -13.026

  No H/Q in entry =          13
  In of MODEL   14
    1    H    VAL  70           H        VAL  70  -0.699 -19.320  -5.535
    2    HA   VAL  70           HA       VAL  70  -1.906 -19.966  -2.906
    3    HB   VAL  70           HB       VAL  70  -0.971 -17.833  -2.052
    4   HG13  VAL  70          HG11      VAL  70   1.368 -18.587  -1.873
    5   HG12  VAL  70          HG12      VAL  70   1.113 -19.702  -3.217
    6   HG11  VAL  70          HG13      VAL  70   0.257 -19.945  -1.694
    7   HG21  VAL  70          HG21      VAL  70   0.287 -17.735  -4.816
    8   HG23  VAL  70          HG22      VAL  70   0.924 -16.814  -3.455
    9   HG22  VAL  70          HG23      VAL  70  -0.710 -16.504  -4.036

  No H/Q in entry =           9
  In of MODEL   14
    1    H    SER  71           H        SER  71  -3.385 -18.259  -2.156
    2    HA   SER  71           HA       SER  71  -5.346 -17.577  -4.075
    3    HB2  SER  71           HB2      SER  71  -5.772 -17.808  -1.606
    4    HB3  SER  71           HB3      SER  71  -4.892 -16.305  -1.351
    5    HG   SER  71           HG       SER  71  -7.376 -16.431  -1.757

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU  72           H        LEU  72  -5.508 -15.918  -5.413
    2    HA   LEU  72           HA       LEU  72  -3.367 -14.147  -5.902
    3    HB2  LEU  72           HB2      LEU  72  -6.240 -14.130  -6.825
    4    HB3  LEU  72           HB3      LEU  72  -5.017 -13.005  -7.410
    5    HG   LEU  72           HG       LEU  72  -4.709 -16.024  -7.550
    6   HD11  LEU  72          HD11      LEU  72  -6.644 -15.180  -8.903
    7   HD13  LEU  72          HD12      LEU  72  -5.348 -15.853  -9.892
    8   HD12  LEU  72          HD13      LEU  72  -5.531 -14.105  -9.749
    9   HD21  LEU  72          HD21      LEU  72  -3.148 -13.654  -8.554
   10   HD23  LEU  72          HD22      LEU  72  -3.107 -15.146  -9.479
   11   HD22  LEU  72          HD23      LEU  72  -2.551 -15.133  -7.808

  No H/Q in entry =          11
  In of MODEL   14
    1    H    VAL  73           H        VAL  73  -6.440 -13.735  -4.247
    2    HA   VAL  73           HA       VAL  73  -6.427 -10.966  -3.883
    3    HB   VAL  73           HB       VAL  73  -8.143 -11.296  -2.298
    4   HG11  VAL  73          HG11      VAL  73  -8.463 -12.178  -4.708
    5   HG13  VAL  73          HG12      VAL  73  -9.633 -12.684  -3.492
    6   HG12  VAL  73          HG13      VAL  73  -8.348 -13.784  -3.990
    7   HG22  VAL  73          HG21      VAL  73  -7.320 -12.730  -0.659
    8   HG21  VAL  73          HG22      VAL  73  -6.738 -13.907  -1.837
    9   HG23  VAL  73          HG23      VAL  73  -8.462 -13.789  -1.486

  No H/Q in entry =           9
  In of MODEL   14
    1    H    LEU  74           H        LEU  74  -4.525 -13.380  -2.325
    2    HA   LEU  74           HA       LEU  74  -4.072 -12.259   0.200
    3    HB2  LEU  74           HB2      LEU  74  -3.336 -14.490  -0.311
    4    HB3  LEU  74           HB3      LEU  74  -2.284 -13.896  -1.595
    5    HG   LEU  74           HG       LEU  74  -0.935 -12.673   0.078
    6   HD13  LEU  74          HD11      LEU  74  -2.464 -12.157   1.819
    7   HD12  LEU  74          HD12      LEU  74  -1.409 -13.385   2.521
    8   HD11  LEU  74          HD13      LEU  74  -3.014 -13.828   1.940
    9   HD22  LEU  74          HD21      LEU  74   0.246 -14.545   0.694
   10   HD21  LEU  74          HD22      LEU  74  -0.801 -15.220  -0.533
   11   HD23  LEU  74          HD23      LEU  74  -1.201 -15.438   1.156

  No H/Q in entry =          11
  In of MODEL   14
    1    H    VAL  75           H        VAL  75  -2.196 -11.889  -2.770
    2    HA   VAL  75           HA       VAL  75  -0.353 -10.006  -1.764
    3    HB   VAL  75           HB       VAL  75  -1.340 -10.451  -4.584
    4   HG11  VAL  75          HG11      VAL  75   0.994  -8.802  -3.514
    5   HG13  VAL  75          HG12      VAL  75  -0.418  -8.185  -4.359
    6   HG12  VAL  75          HG13      VAL  75   0.738  -9.195  -5.211
    7   HG22  VAL  75          HG21      VAL  75   0.687 -11.747  -4.820
    8   HG21  VAL  75          HG22      VAL  75  -0.132 -12.322  -3.366
    9   HG23  VAL  75          HG23      VAL  75   1.259 -11.245  -3.228

  No H/Q in entry =           9
  In of MODEL   14
    1    H    GLU  76           H        GLU  76  -3.509  -9.588  -3.396
    2    HA   GLU  76           HA       GLU  76  -3.505  -6.773  -3.483
    3    HB2  GLU  76           HB2      GLU  76  -5.201  -8.160  -4.644
    4    HB3  GLU  76           HB3      GLU  76  -5.845  -8.674  -3.093
    5    HG2  GLU  76           HG2      GLU  76  -7.276  -6.920  -3.956
    6    HG3  GLU  76           HG3      GLU  76  -6.404  -6.266  -2.583

  No H/Q in entry =           6
  In of MODEL   14
    1    H    ALA  77           H        ALA  77  -4.640  -8.991  -0.946
    2    HA   ALA  77           HA       ALA  77  -5.543  -6.979   0.830
    3    HB3  ALA  77           HB1      ALA  77  -5.824  -8.679   2.385
    4    HB1  ALA  77           HB2      ALA  77  -4.394  -9.556   1.843
    5    HB2  ALA  77           HB3      ALA  77  -5.867  -9.585   0.873

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLN  78           H        GLN  78  -2.430  -8.589   0.433
    2    HA   GLN  78           HA       GLN  78  -1.132  -7.466   2.679
    3    HB2  GLN  78           HB2      GLN  78  -0.324  -9.417   1.301
    4    HB3  GLN  78           HB3      GLN  78   0.135  -8.268   0.046
    5    HG2  GLN  78           HG2      GLN  78   1.629  -7.126   1.631
    6    HG3  GLN  78           HG3      GLN  78   1.167  -8.262   2.895
    7   HE21  GLN  78          HE21      GLN  78   3.896  -8.040   2.028
    8   HE22  GLN  78          HE22      GLN  78   4.320  -9.484   1.243

  No H/Q in entry =           8
  In of MODEL   14
    1    H    LEU  79           H        LEU  79  -1.502  -6.381  -0.660
    2    HA   LEU  79           HA       LEU  79   0.229  -4.190  -0.648
    3    HB2  LEU  79           HB2      LEU  79  -0.829  -4.965  -2.698
    4    HB3  LEU  79           HB3      LEU  79  -2.420  -4.543  -2.075
    5    HG   LEU  79           HG       LEU  79  -1.826  -2.168  -2.042
    6   HD13  LEU  79          HD11      LEU  79   0.423  -1.973  -1.546
    7   HD12  LEU  79          HD12      LEU  79   0.465  -1.678  -3.284
    8   HD11  LEU  79          HD13      LEU  79   0.891  -3.268  -2.649
    9   HD23  LEU  79          HD21      LEU  79  -1.207  -1.969  -4.598
   10   HD22  LEU  79          HD22      LEU  79  -2.745  -2.688  -4.131
   11   HD21  LEU  79          HD23      LEU  79  -1.398  -3.723  -4.591

  No H/Q in entry =          11
  In of MODEL   14
    1    H    HIS  80           H        HIS  80  -3.233  -4.283   0.204
    2    HA   HIS  80           HA       HIS  80  -3.361  -1.527   0.882
    3    HB2  HIS  80           HB2      HIS  80  -5.111  -3.900   1.203
    4    HB3  HIS  80           HB3      HIS  80  -5.394  -2.559   2.315
    5    HD1  HIS  80           HD1      HIS  80  -6.984  -0.884   1.428
    6    HD2  HIS  80           HD2      HIS  80  -4.853  -2.728  -1.645
    7    HE1  HIS  80           HE1      HIS  80  -7.819   0.141  -0.740
    8    HE2  HIS  80           HE2      HIS  80  -6.527  -0.977  -2.622

  No H/Q in entry =           8
  In of MODEL   14
    1    H    LEU  81           H        LEU  81  -2.919  -4.441   2.857
    2    HA   LEU  81           HA       LEU  81  -2.859  -3.107   5.348
    3    HB2  LEU  81           HB2      LEU  81  -1.703  -5.744   4.446
    4    HB3  LEU  81           HB3      LEU  81  -1.653  -5.195   6.122
    5    HG   LEU  81           HG       LEU  81  -4.215  -5.384   4.513
    6   HD12  LEU  81          HD11      LEU  81  -4.551  -7.450   6.053
    7   HD11  LEU  81          HD12      LEU  81  -2.796  -7.418   6.226
    8   HD13  LEU  81          HD13      LEU  81  -3.522  -7.625   4.631
    9   HD23  LEU  81          HD21      LEU  81  -5.044  -5.581   7.020
   10   HD22  LEU  81          HD22      LEU  81  -4.690  -3.996   6.335
   11   HD21  LEU  81          HD23      LEU  81  -3.512  -4.787   7.382

  No H/Q in entry =          11
  In of MODEL   14
    1    H    MET  82           H        MET  82  -0.215  -4.057   3.152
    2    HA   MET  82           HA       MET  82   1.900  -3.217   4.824
    3    HB2  MET  82           HB2      MET  82   1.655  -3.539   1.832
    4    HB3  MET  82           HB3      MET  82   3.155  -3.005   2.586
    5    HG2  MET  82           HG2      MET  82   1.697  -5.566   3.309
    6    HG3  MET  82           HG3      MET  82   3.062  -5.481   2.199
    7    HE3  MET  82           HE1      MET  82   6.109  -4.821   4.162
    8    HE2  MET  82           HE2      MET  82   5.211  -3.431   3.558
    9    HE1  MET  82           HE3      MET  82   5.260  -4.918   2.615

  No H/Q in entry =           9
  In of MODEL   14
    1    H    THR  83           H        THR  83   0.095  -1.523   2.289
    2    HA   THR  83           HA       THR  83   1.562   0.893   2.376
    3    HB   THR  83           HB       THR  83  -0.601   1.871   1.411
    4    HG1  THR  83           HG1      THR  83  -2.281   0.611   1.311
    5   HG22  THR  83          HG21      THR  83  -0.387   0.057  -0.600
    6   HG21  THR  83          HG22      THR  83   1.114  -0.273   0.264
    7   HG23  THR  83          HG23      THR  83   0.784   1.351  -0.341

  No H/Q in entry =           7
  In of MODEL   14
    1    H    SER  84           H        SER  84  -1.454  -0.080   3.996
    2    HA   SER  84           HA       SER  84  -1.885   2.354   5.356
    3    HB2  SER  84           HB2      SER  84  -2.777  -0.467   5.914
    4    HB3  SER  84           HB3      SER  84  -3.232   0.879   6.957
    5    HG   SER  84           HG       SER  84  -3.719   0.589   4.167

  No H/Q in entry =           5
  In of MODEL   14
    1    H    MET  85           H        MET  85  -0.233  -0.621   6.458
    2    HA   MET  85           HA       MET  85   0.328   0.281   9.062
    3    HB2  MET  85           HB2      MET  85   0.562  -2.065   8.374
    4    HB3  MET  85           HB3      MET  85   1.944  -1.629   7.367
    5    HG2  MET  85           HG2      MET  85   3.167  -0.843   9.350
    6    HG3  MET  85           HG3      MET  85   1.775  -1.211  10.368
    7    HE1  MET  85           HE1      MET  85   4.328  -2.312   7.956
    8    HE3  MET  85           HE2      MET  85   3.292  -3.583   7.311
    9    HE2  MET  85           HE3      MET  85   4.691  -4.010   8.290

  No H/Q in entry =           9
  In of MODEL   14
    1    H    LEU  86           H        LEU  86   2.245   0.507   6.097
    2    HA   LEU  86           HA       LEU  86   4.497   1.762   7.241
    3    HB2  LEU  86           HB2      LEU  86   4.263   0.695   4.929
    4    HB3  LEU  86           HB3      LEU  86   3.485   2.197   4.430
    5    HG   LEU  86           HG       LEU  86   5.548   3.392   5.399
    6   HD11  LEU  86          HD11      LEU  86   6.200   0.761   6.182
    7   HD13  LEU  86          HD12      LEU  86   7.237   2.183   6.277
    8   HD12  LEU  86          HD13      LEU  86   7.311   1.139   4.860
    9   HD23  LEU  86          HD21      LEU  86   6.206   1.624   3.035
   10   HD22  LEU  86          HD22      LEU  86   6.640   3.311   3.302
   11   HD21  LEU  86          HD23      LEU  86   4.974   2.882   2.914

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ALA  87           H        ALA  87   1.601   3.079   5.685
    2    HA   ALA  87           HA       ALA  87   2.258   5.794   5.776
    3    HB1  ALA  87           HB1      ALA  87  -0.092   4.222   5.247
    4    HB3  ALA  87           HB2      ALA  87   0.253   5.877   4.752
    5    HB2  ALA  87           HB3      ALA  87  -0.536   5.567   6.300

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ARG  88           H        ARG  88   0.542   3.820   8.171
    2    HA   ARG  88           HA       ARG  88   0.092   5.872  10.031
    3    HB2  ARG  88           HB2      ARG  88  -0.899   3.542  10.094
    4    HB3  ARG  88           HB3      ARG  88   0.635   3.003  10.786
    5    HG2  ARG  88           HG2      ARG  88   0.219   5.080  12.419
    6    HG3  ARG  88           HG3      ARG  88  -1.458   4.796  11.975
    7    HD2  ARG  88           HD2      ARG  88  -1.598   2.944  13.214
    8    HD3  ARG  88           HD3      ARG  88  -0.026   2.328  12.668
    9    HE   ARG  88           HE       ARG  88  -0.512   3.592  15.131
   10   HH21  ARG  88          HH11      ARG  88   1.079   4.563  16.362
   11   HH22  ARG  88          HH12      ARG  88   2.602   4.958  15.647
   12   HH11  ARG  88          HH21      ARG  88   1.752   3.734  12.537
   13   HH12  ARG  88          HH22      ARG  88   2.991   4.472  13.493

  No H/Q in entry =          13
  In of MODEL   14
    1    H    GLU  89           H        GLU  89   2.836   3.592   9.776
    2    HA   GLU  89           HA       GLU  89   4.135   4.441  12.113
    3    HB2  GLU  89           HB2      GLU  89   4.738   2.415  10.756
    4    HB3  GLU  89           HB3      GLU  89   5.529   3.496   9.608
    5    HG2  GLU  89           HG2      GLU  89   7.046   4.302  11.343
    6    HG3  GLU  89           HG3      GLU  89   6.200   3.359  12.566

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LEU  90           H        LEU  90   4.452   5.607   8.788
    2    HA   LEU  90           HA       LEU  90   6.431   7.561   9.367
    3    HB2  LEU  90           HB2      LEU  90   4.401   7.284   7.154
    4    HB3  LEU  90           HB3      LEU  90   5.659   8.527   7.171
    5    HG   LEU  90           HG       LEU  90   6.270   5.575   7.487
    6   HD12  LEU  90          HD11      LEU  90   7.005   5.803   5.042
    7   HD11  LEU  90          HD12      LEU  90   6.021   7.265   5.008
    8   HD13  LEU  90          HD13      LEU  90   5.269   5.707   5.350
    9   HD22  LEU  90          HD21      LEU  90   8.198   6.679   8.159
   10   HD21  LEU  90          HD22      LEU  90   7.871   8.096   7.160
   11   HD23  LEU  90          HD23      LEU  90   8.493   6.620   6.422

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  91           H        ILE  91   2.892   7.655   9.246
    2    HA   ILE  91           HA       ILE  91   2.614  10.432   9.711
    3    HB   ILE  91           HB       ILE  91   0.776   8.094  10.258
    4   HG12  ILE  91          HG12      ILE  91   0.562  10.389   8.285
    5   HG13  ILE  91          HG13      ILE  91   1.386   8.878   7.900
    6   HG22  ILE  91          HG21      ILE  91  -0.911  10.189  10.344
    7   HG21  ILE  91          HG22      ILE  91   0.514  10.986  11.009
    8   HG23  ILE  91          HG23      ILE  91  -0.148   9.559  11.804
    9   HD13  ILE  91          HD11      ILE  91  -0.585   7.633   7.954
   10   HD12  ILE  91          HD12      ILE  91  -1.146   9.163   7.283
   11   HD11  ILE  91          HD13      ILE  91  -1.412   8.797   8.988

  No H/Q in entry =          11
  In of MODEL   14
    1    H    THR  92           H        THR  92   2.975   7.673  11.898
    2    HA   THR  92           HA       THR  92   2.580   9.045  14.331
    3    HB   THR  92           HB       THR  92   4.333   6.675  13.642
    4    HG1  THR  92           HG1      THR  92   2.348   5.961  13.554
    5   HG22  THR  92          HG21      THR  92   3.964   6.388  16.278
    6   HG21  THR  92          HG22      THR  92   3.936   8.149  16.212
    7   HG23  THR  92          HG23      THR  92   5.346   7.265  15.625

  No H/Q in entry =           7
  In of MODEL   14
    1    H    GLU  93           H        GLU  93   5.506   8.542  12.372
    2    HA   GLU  93           HA       GLU  93   7.302   9.925  14.062
    3    HB2  GLU  93           HB2      GLU  93   7.361   9.621  11.045
    4    HB3  GLU  93           HB3      GLU  93   8.720  10.119  12.051
    5    HG2  GLU  93           HG2      GLU  93   7.259   7.511  12.498
    6    HG3  GLU  93           HG3      GLU  93   8.638   7.638  11.412

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LEU  94           H        LEU  94   5.255  10.994  11.369
    2    HA   LEU  94           HA       LEU  94   6.115  13.681  11.273
    3    HB2  LEU  94           HB2      LEU  94   3.491  12.373  10.534
    4    HB3  LEU  94           HB3      LEU  94   3.783  14.095  10.297
    5    HG   LEU  94           HG       LEU  94   5.751  12.071   9.224
    6   HD11  LEU  94          HD11      LEU  94   3.014  12.682   8.184
    7   HD13  LEU  94          HD12      LEU  94   3.966  11.206   8.046
    8   HD12  LEU  94          HD13      LEU  94   4.321  12.584   7.004
    9   HD23  LEU  94          HD21      LEU  94   6.026  13.909   7.507
   10   HD22  LEU  94          HD22      LEU  94   6.463  14.386   9.147
   11   HD21  LEU  94          HD23      LEU  94   4.917  14.888   8.462

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  95           H        ILE  95   3.559  12.108  13.177
    2    HA   ILE  95           HA       ILE  95   2.573  14.474  14.389
    3    HB   ILE  95           HB       ILE  95   2.539  11.588  15.303
    4   HG12  ILE  95          HG12      ILE  95   0.346  13.410  14.277
    5   HG13  ILE  95          HG13      ILE  95   1.274  12.336  13.234
    6   HG21  ILE  95          HG21      ILE  95   1.315  14.081  16.523
    7   HG23  ILE  95          HG22      ILE  95   2.346  12.888  17.315
    8   HG22  ILE  95          HG23      ILE  95   0.698  12.462  16.851
    9   HD13  ILE  95          HD11      ILE  95   0.339  10.413  14.152
   10   HD12  ILE  95          HD12      ILE  95  -1.021  11.529  14.243
   11   HD11  ILE  95          HD13      ILE  95  -0.051  11.206  15.679

  No H/Q in entry =          11
  In of MODEL   14
    1    H    GLU  96           H        GLU  96   5.130  12.200  15.357
    2    HA   GLU  96           HA       GLU  96   5.728  13.377  17.849
    3    HB2  GLU  96           HB2      GLU  96   6.628  11.202  17.186
    4    HB3  GLU  96           HB3      GLU  96   7.567  11.962  15.902
    5    HG2  GLU  96           HG2      GLU  96   9.237  12.472  17.354
    6    HG3  GLU  96           HG3      GLU  96   8.114  13.303  18.421

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LEU  97           H        LEU  97   6.793  14.141  14.558
    2    HA   LEU  97           HA       LEU  97   8.723  16.097  15.264
    3    HB2  LEU  97           HB2      LEU  97   7.102  15.589  12.779
    4    HB3  LEU  97           HB3      LEU  97   8.150  17.000  12.898
    5    HG   LEU  97           HG       LEU  97   9.129  14.181  13.440
    6   HD12  LEU  97          HD11      LEU  97  10.112  14.365  11.116
    7   HD11  LEU  97          HD12      LEU  97   9.086  15.777  10.866
    8   HD13  LEU  97          HD13      LEU  97   8.358  14.197  11.159
    9   HD23  LEU  97          HD21      LEU  97  11.317  15.421  12.686
   10   HD22  LEU  97          HD22      LEU  97  10.715  15.696  14.320
   11   HD21  LEU  97          HD23      LEU  97  10.415  16.890  13.059

  No H/Q in entry =          11
  In of MODEL   14
    1    H    HIS  98           H        HIS  98   5.230  16.302  14.636
    2    HA   HIS  98           HA       HIS  98   4.985  19.106  14.784
    3    HB2  HIS  98           HB2      HIS  98   3.058  16.889  15.515
    4    HB3  HIS  98           HB3      HIS  98   2.624  18.598  15.581
    5    HD1  HIS  98           HD1      HIS  98   3.575  15.874  13.158
    6    HD2  HIS  98           HD2      HIS  98   2.274  19.833  13.062
    7    HE1  HIS  98           HE1      HIS  98   3.008  16.383  10.740
    8    HE2  HIS  98           HE2      HIS  98   2.218  18.788  10.660

  No H/Q in entry =           8
  In of MODEL   14
    1    H    GLU  99           H        GLU  99   5.089  16.606  17.273
    2    HA   GLU  99           HA       GLU  99   4.529  18.302  19.481
    3    HB2  GLU  99           HB2      GLU  99   4.394  15.822  19.569
    4    HB3  GLU  99           HB3      GLU  99   6.152  15.744  19.448
    5    HG2  GLU  99           HG2      GLU  99   6.380  17.024  21.526
    6    HG3  GLU  99           HG3      GLU  99   4.631  17.198  21.635

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LYS 100           H        LYS 100   7.553  17.320  17.891
    2    HA   LYS 100           HA       LYS 100   9.248  18.682  19.740
    3    HB2  LYS 100           HB2      LYS 100   9.708  17.760  16.894
    4    HB3  LYS 100           HB3      LYS 100  10.960  18.502  17.896
    5    HG2  LYS 100           HG2      LYS 100  10.563  16.751  19.633
    6    HG3  LYS 100           HG3      LYS 100   9.408  15.974  18.547
    7    HD2  LYS 100           HD2      LYS 100  11.184  15.664  16.866
    8    HD3  LYS 100           HD3      LYS 100  12.344  16.454  17.937
    9    HE2  LYS 100           HE2      LYS 100  11.927  14.699  19.651
   10    HE3  LYS 100           HE3      LYS 100  10.829  13.888  18.530
   11    HZ1  LYS 100           HZ1      LYS 100  13.656  14.507  17.857
   12    HZ3  LYS 100           HZ2      LYS 100  12.587  13.475  17.032
   13    HZ2  LYS 100           HZ3      LYS 100  13.178  13.039  18.564

  No H/Q in entry =          13
  In of MODEL   14
    1    H    LEU 101           H        LEU 101   7.551  19.653  16.801
    2    HA   LEU 101           HA       LEU 101   8.811  22.188  16.467
    3    HB2  LEU 101           HB2      LEU 101   6.186  21.007  15.595
    4    HB3  LEU 101           HB3      LEU 101   6.468  22.734  15.393
    5    HG   LEU 101           HG       LEU 101   8.458  20.683  14.404
    6   HD12  LEU 101          HD11      LEU 101   7.298  21.221  12.129
    7   HD11  LEU 101          HD12      LEU 101   5.914  21.673  13.122
    8   HD13  LEU 101          HD13      LEU 101   6.548  20.030  13.192
    9   HD21  LEU 101          HD21      LEU 101   7.882  23.609  13.864
   10   HD23  LEU 101          HD22      LEU 101   8.836  22.635  12.747
   11   HD22  LEU 101          HD23      LEU 101   9.395  22.876  14.402

  No H/Q in entry =          11
  In of MODEL   14
    1    H    LYS 102           H        LYS 102   7.271  21.068  19.090
    2    HA   LYS 102           HA       LYS 102   6.674  22.164  21.031
    3    HB2  LYS 102           HB2      LYS 102   7.987  24.134  19.905
    4    HB3  LYS 102           HB3      LYS 102   6.397  24.771  19.544
    5    HG2  LYS 102           HG2      LYS 102   7.788  24.477  22.185
    6    HG3  LYS 102           HG3      LYS 102   6.857  25.827  21.568
    7    HD2  LYS 102           HD2      LYS 102   5.569  23.211  22.445
    8    HD3  LYS 102           HD3      LYS 102   5.852  24.562  23.532
    9    HE2  LYS 102           HE2      LYS 102   3.554  24.210  22.059
   10    HE3  LYS 102           HE3      LYS 102   4.092  25.743  22.743
   11    HZ2  LYS 102           HZ1      LYS 102   3.546  25.871  20.368
   12    HZ1  LYS 102           HZ2      LYS 102   4.784  24.766  20.031
   13    HZ3  LYS 102           HZ3      LYS 102   5.161  26.287  20.678

  No H/Q in entry =          13
  In of MODEL   14
    1    H    ALA 103           H        ALA 103   5.046  23.750  18.282
    2    HA   ALA 103           HA       ALA 103   2.610  24.370  19.188
    3    HB1  ALA 103           HB1      ALA 103   1.679  23.555  16.949
    4    HB2  ALA 103           HB2      ALA 103   3.313  22.988  16.605
    5    HB3  ALA 103           HB3      ALA 103   3.014  24.705  16.881

  No H/Q in entry =           5
  In of MODEL   14
    1    H1   ALA   1           H3       ALA   1  10.155 -20.180  -6.333
    2    H2   ALA   1           H2       ALA   1   9.176 -20.362  -7.712
    3    H3   ALA   1           H1       ALA   1   8.735 -21.105  -6.249
    4    HA   ALA   1           HA       ALA   1   9.733 -22.931  -7.004
    5    HB1  ALA   1           HB1      ALA   1   9.818 -22.564  -9.279
    6    HB2  ALA   1           HB2      ALA   1  11.551 -22.450  -8.963
    7    HB3  ALA   1           HB3      ALA   1  10.581 -20.983  -9.100

  No H/Q in entry =           7
  In of MODEL   14
    1    H    GLU   2           H        GLU   2  11.997 -23.927  -7.083
    2    HA   GLU   2           HA       GLU   2  13.396 -23.883  -4.882
    3    HB2  GLU   2           HB2      GLU   2  14.734 -23.767  -7.591
    4    HB3  GLU   2           HB3      GLU   2  15.461 -24.399  -6.114
    5    HG2  GLU   2           HG2      GLU   2  14.402 -26.394  -6.356
    6    HG3  GLU   2           HG3      GLU   2  12.844 -25.616  -6.599

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLU   3           H        GLU   3  15.186 -22.044  -7.289
    2    HA   GLU   3           HA       GLU   3  16.388 -20.389  -5.332
    3    HB2  GLU   3           HB2      GLU   3  16.310 -20.373  -8.341
    4    HB3  GLU   3           HB3      GLU   3  17.089 -19.063  -7.454
    5    HG2  GLU   3           HG2      GLU   3  18.730 -20.474  -6.550
    6    HG3  GLU   3           HG3      GLU   3  17.753 -21.921  -6.770

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LEU   4           H        LEU   4  14.104 -19.484  -7.941
    2    HA   LEU   4           HA       LEU   4  13.695 -16.869  -7.315
    3    HB2  LEU   4           HB2      LEU   4  11.475 -18.795  -8.037
    4    HB3  LEU   4           HB3      LEU   4  11.434 -17.045  -8.227
    5    HG   LEU   4           HG       LEU   4  13.349 -18.941  -9.623
    6   HD13  LEU   4          HD11      LEU   4  12.036 -18.758 -11.522
    7   HD12  LEU   4          HD12      LEU   4  11.364 -17.201 -11.043
    8   HD11  LEU   4          HD13      LEU   4  10.786 -18.683 -10.284
    9   HD23  LEU   4          HD21      LEU   4  13.721 -16.698 -10.968
   10   HD22  LEU   4          HD22      LEU   4  14.588 -16.964  -9.456
   11   HD21  LEU   4          HD23      LEU   4  13.155 -15.938  -9.480

  No H/Q in entry =          11
  In of MODEL   14
    1    H    GLU   5           H        GLU   5  12.167 -19.629  -5.673
    2    HA   GLU   5           HA       GLU   5  10.535 -18.031  -3.950
    3    HB2  GLU   5           HB2      GLU   5  10.084 -20.413  -4.494
    4    HB3  GLU   5           HB3      GLU   5  11.491 -20.861  -3.526
    5    HG2  GLU   5           HG2      GLU   5   9.562 -21.059  -2.101
    6    HG3  GLU   5           HG3      GLU   5  10.444 -19.617  -1.595

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLU   6           H        GLU   6  13.652 -19.676  -3.539
    2    HA   GLU   6           HA       GLU   6  14.043 -18.839  -0.840
    3    HB2  GLU   6           HB2      GLU   6  15.224 -20.774  -1.834
    4    HB3  GLU   6           HB3      GLU   6  16.090 -19.675  -2.912
    5    HG2  GLU   6           HG2      GLU   6  17.071 -18.524  -0.975
    6    HG3  GLU   6           HG3      GLU   6  16.185 -19.586   0.119

  No H/Q in entry =           6
  In of MODEL   14
    1    H    VAL   7           H        VAL   7  14.811 -17.514  -3.990
    2    HA   VAL   7           HA       VAL   7  16.546 -15.426  -3.130
    3    HB   VAL   7           HB       VAL   7  14.814 -15.744  -5.595
    4   HG11  VAL   7          HG11      VAL   7  16.757 -13.573  -4.789
    5   HG13  VAL   7          HG12      VAL   7  15.113 -13.395  -5.398
    6   HG12  VAL   7          HG13      VAL   7  16.404 -13.919  -6.481
    7   HG21  VAL   7          HG21      VAL   7  16.896 -17.245  -5.049
    8   HG23  VAL   7          HG22      VAL   7  17.826 -15.800  -5.448
    9   HG22  VAL   7          HG23      VAL   7  16.766 -16.524  -6.654

  No H/Q in entry =           9
  In of MODEL   14
    1    H    VAL   8           H        VAL   8  13.044 -15.623  -3.660
    2    HA   VAL   8           HA       VAL   8  12.436 -12.905  -3.172
    3    HB   VAL   8           HB       VAL   8  10.781 -15.407  -2.744
    4   HG12  VAL   8          HG11      VAL   8   8.857 -13.730  -2.814
    5   HG11  VAL   8          HG12      VAL   8  10.065 -12.468  -2.563
    6   HG13  VAL   8          HG13      VAL   8   9.828 -13.717  -1.341
    7   HG21  VAL   8          HG21      VAL   8  11.655 -14.306  -5.117
    8   HG23  VAL   8          HG22      VAL   8  10.130 -13.455  -4.886
    9   HG22  VAL   8          HG23      VAL   8  10.153 -15.214  -4.953

  No H/Q in entry =           9
  In of MODEL   14
    1    H    MET   9           H        MET   9  12.665 -15.725  -1.006
    2    HA   MET   9           HA       MET   9  11.893 -14.448   1.376
    3    HB2  MET   9           HB2      MET   9  13.765 -16.749   0.822
    4    HB3  MET   9           HB3      MET   9  13.455 -16.178   2.462
    5    HG2  MET   9           HG2      MET   9  11.037 -16.539   2.136
    6    HG3  MET   9           HG3      MET   9  11.344 -17.108   0.494
    7    HE2  MET   9           HE1      MET   9  10.896 -18.313   4.183
    8    HE1  MET   9           HE2      MET   9  12.359 -17.338   4.077
    9    HE3  MET   9           HE3      MET   9  12.477 -19.051   4.469

  No H/Q in entry =           9
  In of MODEL   14
    1    H    GLY  10           H        GLY  10  15.057 -14.727  -0.206
    2    HA3  GLY  10           HA2      GLY  10  16.558 -13.343   1.758
    3    HA2  GLY  10           HA3      GLY  10  17.005 -13.510   0.060

  No H/Q in entry =           3
  In of MODEL   14
    1    H    LEU  11           H        LEU  11  14.850 -12.242  -1.157
    2    HA   LEU  11           HA       LEU  11  15.588  -9.511  -0.987
    3    HB2  LEU  11           HB2      LEU  11  13.185 -10.871  -2.210
    4    HB3  LEU  11           HB3      LEU  11  13.497  -9.141  -2.364
    5    HG   LEU  11           HG       LEU  11  15.478 -11.284  -3.177
    6   HD13  LEU  11          HD11      LEU  11  13.714 -11.611  -4.685
    7   HD12  LEU  11          HD12      LEU  11  14.733 -10.445  -5.528
    8   HD11  LEU  11          HD13      LEU  11  13.275  -9.903  -4.696
    9   HD22  LEU  11          HD21      LEU  11  16.748  -9.345  -2.952
   10   HD21  LEU  11          HD22      LEU  11  15.390  -8.281  -3.316
   11   HD23  LEU  11          HD23      LEU  11  16.195  -9.159  -4.615

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  12           H        ILE  12  12.796 -11.291   0.294
    2    HA   ILE  12           HA       ILE  12  11.452  -9.046   1.374
    3    HB   ILE  12           HB       ILE  12  11.443 -11.933   2.310
    4   HG12  ILE  12          HG12      ILE  12  10.747 -11.271  -0.130
    5   HG13  ILE  12          HG13      ILE  12   9.714 -12.352   0.783
    6   HG21  ILE  12          HG21      ILE  12   9.590  -9.610   2.917
    7   HG23  ILE  12          HG22      ILE  12  10.524 -10.562   4.069
    8   HG22  ILE  12          HG23      ILE  12   9.163 -11.293   3.219
    9   HD12  ILE  12          HD11      ILE  12   8.491 -10.531  -0.427
   10   HD11  ILE  12          HD12      ILE  12   9.330  -9.355   0.583
   11   HD13  ILE  12          HD13      ILE  12   8.229 -10.507   1.308

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  13           H        ILE  13  13.815 -11.300   2.751
    2    HA   ILE  13           HA       ILE  13  13.892 -10.133   5.336
    3    HB   ILE  13           HB       ILE  13  15.913 -11.733   3.748
    4   HG12  ILE  13          HG12      ILE  13  13.623 -12.663   4.601
    5   HG13  ILE  13          HG13      ILE  13  15.083 -13.615   4.850
    6   HG22  ILE  13          HG21      ILE  13  16.817 -12.113   6.216
    7   HG21  ILE  13          HG22      ILE  13  16.124 -10.520   6.487
    8   HG23  ILE  13          HG23      ILE  13  17.372 -10.741   5.261
    9   HD11  ILE  13          HD11      ILE  13  14.000 -11.706   6.950
   10   HD13  ILE  13          HD12      ILE  13  15.236 -12.944   7.145
   11   HD12  ILE  13          HD13      ILE  13  13.562 -13.412   6.878

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ASN  14           H        ASN  14  15.832  -9.623   2.405
    2    HA   ASN  14           HA       ASN  14  17.617  -7.717   3.462
    3    HB2  ASN  14           HB2      ASN  14  17.556  -8.972   1.141
    4    HB3  ASN  14           HB3      ASN  14  16.683  -7.538   0.617
    5   HD21  ASN  14          HD21      ASN  14  19.108  -7.913  -0.589
    6   HD22  ASN  14          HD22      ASN  14  20.274  -6.852   0.034

  No H/Q in entry =           6
  In of MODEL   14
    1    H    SER  15           H        SER  15  14.500  -7.310   1.794
    2    HA   SER  15           HA       SER  15  14.435  -4.488   1.864
    3    HB2  SER  15           HB2      SER  15  12.093  -4.695   1.391
    4    HB3  SER  15           HB3      SER  15  12.864  -6.063   0.599
    5    HG   SER  15           HG       SER  15  11.324  -5.978   2.946

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLY  16           H        GLY  16  13.319  -6.940   4.165
    2    HA3  GLY  16           HA2      GLY  16  12.140  -5.179   6.039
    3    HA2  GLY  16           HA3      GLY  16  12.731  -6.799   6.390

  No H/Q in entry =           3
  In of MODEL   14
    1    H    GLN  17           H        GLN  17  15.443  -6.507   5.778
    2    HA   GLN  17           HA       GLN  17  16.437  -5.312   8.157
    3    HB2  GLN  17           HB2      GLN  17  17.826  -6.171   5.605
    4    HB3  GLN  17           HB3      GLN  17  18.690  -5.597   7.032
    5    HG2  GLN  17           HG2      GLN  17  16.749  -7.924   7.037
    6    HG3  GLN  17           HG3      GLN  17  18.501  -8.093   6.934
    7   HE21  GLN  17          HE21      GLN  17  19.755  -7.692   8.864
    8   HE22  GLN  17          HE22      GLN  17  19.026  -7.459  10.378

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ALA  18           H        ALA  18  16.241  -4.217   4.803
    2    HA   ALA  18           HA       ALA  18  17.716  -1.848   5.029
    3    HB1  ALA  18           HB1      ALA  18  16.564  -3.036   2.965
    4    HB3  ALA  18           HB2      ALA  18  16.856  -1.297   2.955
    5    HB2  ALA  18           HB3      ALA  18  15.249  -1.919   3.333

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ARG  19           H        ARG  19  14.210  -2.383   5.449
    2    HA   ARG  19           HA       ARG  19  13.589   0.274   6.180
    3    HB2  ARG  19           HB2      ARG  19  11.877  -1.448   5.599
    4    HB3  ARG  19           HB3      ARG  19  12.217  -2.258   7.130
    5    HG2  ARG  19           HG2      ARG  19  11.547  -0.261   8.383
    6    HG3  ARG  19           HG3      ARG  19  11.300   0.626   6.880
    7    HD2  ARG  19           HD2      ARG  19   9.152  -0.141   7.712
    8    HD3  ARG  19           HD3      ARG  19   9.546  -1.020   6.229
    9    HE   ARG  19           HE       ARG  19  10.496  -2.586   8.321
   10   HH21  ARG  19          HH11      ARG  19   9.228  -4.211   9.262
   11   HH22  ARG  19          HH12      ARG  19   7.507  -4.156   9.104
   12   HH11  ARG  19          HH21      ARG  19   7.514  -1.242   7.253
   13   HH12  ARG  19          HH22      ARG  19   6.538  -2.475   7.962

  No H/Q in entry =          13
  In of MODEL   14
    1    H    SER  20           H        SER  20  14.417  -2.577   8.121
    2    HA   SER  20           HA       SER  20  14.169  -1.485  10.665
    3    HB2  SER  20           HB2      SER  20  14.598  -3.815  10.534
    4    HB3  SER  20           HB3      SER  20  16.043  -3.573   9.557
    5    HG   SER  20           HG       SER  20  15.656  -2.824  12.271

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU  21           H        LEU  21  16.997  -1.458   8.509
    2    HA   LEU  21           HA       LEU  21  18.708  -0.006  10.241
    3    HB2  LEU  21           HB2      LEU  21  18.659  -0.270   7.227
    4    HB3  LEU  21           HB3      LEU  21  19.932   0.574   8.107
    5    HG   LEU  21           HG       LEU  21  19.160  -2.308   8.651
    6   HD11  LEU  21          HD11      LEU  21  21.194  -1.106   6.770
    7   HD13  LEU  21          HD12      LEU  21  19.990  -2.350   6.435
    8   HD12  LEU  21          HD13      LEU  21  21.394  -2.731   7.429
    9   HD23  LEU  21          HD21      LEU  21  21.655  -2.182   9.519
   10   HD22  LEU  21          HD22      LEU  21  20.366  -1.569  10.549
   11   HD21  LEU  21          HD23      LEU  21  21.346  -0.451   9.614

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ALA  22           H        ALA  22  16.441   1.009   7.706
    2    HA   ALA  22           HA       ALA  22  17.023   3.759   7.728
    3    HB3  ALA  22           HB1      ALA  22  15.589   2.546   6.054
    4    HB2  ALA  22           HB2      ALA  22  14.910   4.067   6.632
    5    HB1  ALA  22           HB3      ALA  22  14.300   2.534   7.257

  No H/Q in entry =           5
  In of MODEL   14
    1    H    TYR  23           H        TYR  23  14.511   1.974   9.572
    2    HA   TYR  23           HA       TYR  23  13.594   4.220  11.038
    3    HB2  TYR  23           HB2      TYR  23  12.323   2.129  11.019
    4    HB3  TYR  23           HB3      TYR  23  13.648   1.290  11.824
    5    HD1  TYR  23           HD1      TYR  23  11.179   4.054  12.232
    6    HD2  TYR  23           HD2      TYR  23  13.888   1.351  14.181
    7    HE1  TYR  23           HE1      TYR  23  10.284   4.749  14.441
    8    HE2  TYR  23           HE2      TYR  23  12.994   2.044  16.387
    9    HH   TYR  23           HH       TYR  23  10.263   4.302  16.635

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ALA  24           H        ALA  24  16.207   1.900  11.647
    2    HA   ALA  24           HA       ALA  24  16.911   2.873  14.210
    3    HB3  ALA  24           HB1      ALA  24  18.237   1.059  14.027
    4    HB2  ALA  24           HB2      ALA  24  19.272   1.968  12.925
    5    HB1  ALA  24           HB3      ALA  24  17.957   0.984  12.289

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA  25           H        ALA  25  17.860   3.801  10.928
    2    HA   ALA  25           HA       ALA  25  19.841   5.700  11.568
    3    HB1  ALA  25           HB1      ALA  25  19.093   4.774   9.254
    4    HB3  ALA  25           HB2      ALA  25  19.623   6.453   9.350
    5    HB2  ALA  25           HB3      ALA  25  17.901   6.074   9.292

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU  26           H        LEU  26  16.328   5.988  11.233
    2    HA   LEU  26           HA       LEU  26  16.153   8.771  11.697
    3    HB2  LEU  26           HB2      LEU  26  14.265   7.571  10.777
    4    HB3  LEU  26           HB3      LEU  26  14.167   6.539  12.199
    5    HG   LEU  26           HG       LEU  26  13.603   8.500  13.592
    6   HD12  LEU  26          HD11      LEU  26  12.968  10.617  12.280
    7   HD11  LEU  26          HD12      LEU  26  13.929   9.954  10.961
    8   HD13  LEU  26          HD13      LEU  26  14.691  10.320  12.509
    9   HD21  LEU  26          HD21      LEU  26  11.905   8.226  11.093
   10   HD23  LEU  26          HD22      LEU  26  11.367   8.926  12.616
   11   HD22  LEU  26          HD23      LEU  26  11.790   7.218  12.535

  No H/Q in entry =          11
  In of MODEL   14
    1    H    LYS  27           H        LYS  27  16.014   5.985  13.879
    2    HA   LYS  27           HA       LYS  27  15.461   7.350  16.257
    3    HB2  LYS  27           HB2      LYS  27  15.445   4.876  15.981
    4    HB3  LYS  27           HB3      LYS  27  17.209   4.898  15.926
    5    HG2  LYS  27           HG2      LYS  27  17.291   5.873  18.179
    6    HG3  LYS  27           HG3      LYS  27  15.525   5.921  18.237
    7    HD2  LYS  27           HD2      LYS  27  15.456   3.456  17.990
    8    HD3  LYS  27           HD3      LYS  27  17.220   3.415  17.966
    9    HE2  LYS  27           HE2      LYS  27  17.287   4.393  20.226
   10    HE3  LYS  27           HE3      LYS  27  15.522   4.464  20.254
   11    HZ3  LYS  27           HZ1      LYS  27  16.285   2.493  21.390
   12    HZ2  LYS  27           HZ2      LYS  27  17.183   2.005  20.031
   13    HZ1  LYS  27           HZ3      LYS  27  15.485   2.040  19.964

  No H/Q in entry =          13
  In of MODEL   14
    1    H    GLN  28           H        GLN  28  18.556   6.720  14.641
    2    HA   GLN  28           HA       GLN  28  20.272   7.765  16.624
    3    HB2  GLN  28           HB2      GLN  28  20.539   7.732  13.606
    4    HB3  GLN  28           HB3      GLN  28  21.842   8.169  14.712
    5    HG2  GLN  28           HG2      GLN  28  20.369   5.520  14.744
    6    HG3  GLN  28           HG3      GLN  28  21.952   5.780  14.014
    7   HE21  GLN  28          HE21      GLN  28  20.681   4.463  16.710
    8   HE22  GLN  28          HE22      GLN  28  21.881   4.857  17.843

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ALA  29           H        ALA  29  18.528   9.291  13.950
    2    HA   ALA  29           HA       ALA  29  19.576  11.892  14.208
    3    HB2  ALA  29           HB1      ALA  29  17.879  12.566  12.751
    4    HB1  ALA  29           HB2      ALA  29  16.718  11.411  13.406
    5    HB3  ALA  29           HB3      ALA  29  18.032  10.849  12.370

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LYS  30           H        LYS  30  16.782  10.337  15.742
    2    HA   LYS  30           HA       LYS  30  15.819  12.602  17.116
    3    HB2  LYS  30           HB2      LYS  30  15.657   9.661  17.807
    4    HB3  LYS  30           HB3      LYS  30  14.821  10.923  18.713
    5    HG2  LYS  30           HG2      LYS  30  13.694  11.639  16.605
    6    HG3  LYS  30           HG3      LYS  30  14.468  10.292  15.767
    7    HD2  LYS  30           HD2      LYS  30  13.377   8.698  17.296
    8    HD3  LYS  30           HD3      LYS  30  12.614  10.034  18.158
    9    HE2  LYS  30           HE2      LYS  30  11.443  10.698  16.077
   10    HE3  LYS  30           HE3      LYS  30  12.186   9.333  15.235
   11    HZ2  LYS  30           HZ1      LYS  30   9.877   8.963  16.129
   12    HZ1  LYS  30           HZ2      LYS  30  10.556   8.997  17.692
   13    HZ3  LYS  30           HZ3      LYS  30  11.034   7.807  16.573

  No H/Q in entry =          13
  In of MODEL   14
    1    H    GLN  31           H        GLN  31  18.443  10.380  17.824
    2    HA   GLN  31           HA       GLN  31  18.809  11.376  20.521
    3    HB2  GLN  31           HB2      GLN  31  20.790   9.774  18.894
    4    HB3  GLN  31           HB3      GLN  31  20.671   9.893  20.650
    5    HG2  GLN  31           HG2      GLN  31  18.134   8.992  19.895
    6    HG3  GLN  31           HG3      GLN  31  19.212   8.132  18.803
    7   HE21  GLN  31          HE21      GLN  31  17.664   7.005  21.086
    8   HE22  GLN  31          HE22      GLN  31  18.815   6.318  22.125

  No H/Q in entry =           8
  In of MODEL   14
    1    H    GLY  32           H        GLY  32  19.332  12.697  17.556
    2    HA3  GLY  32           HA2      GLY  32  20.351  14.725  17.044
    3    HA2  GLY  32           HA3      GLY  32  21.120  14.708  18.627

  No H/Q in entry =           3
  In of MODEL   14
    1    H    ASP  33           H        ASP  33  21.474  11.817  16.834
    2    HA   ASP  33           HA       ASP  33  24.309  12.441  16.350
    3    HB2  ASP  33           HB2      ASP  33  22.752   9.853  16.466
    4    HB3  ASP  33           HB3      ASP  33  24.436   9.940  15.959

  No H/Q in entry =           4
  In of MODEL   14
    1    H    PHE  34           H        PHE  34  23.839  13.781  14.478
    2    HA   PHE  34           HA       PHE  34  22.455  12.833  12.196
    3    HB2  PHE  34           HB2      PHE  34  24.628  14.926  12.421
    4    HB3  PHE  34           HB3      PHE  34  23.627  14.661  10.995
    5    HD1  PHE  34           HD1      PHE  34  23.935  16.577  13.915
    6    HD2  PHE  34           HD2      PHE  34  21.001  14.526  11.540
    7    HE1  PHE  34           HE1      PHE  34  22.151  18.004  14.881
    8    HE2  PHE  34           HE2      PHE  34  19.222  15.953  12.510
    9    HZ   PHE  34           HZ       PHE  34  19.801  17.692  14.176

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ALA  35           H        ALA  35  25.833  12.578  13.179
    2    HA   ALA  35           HA       ALA  35  26.905  11.748  10.710
    3    HB3  ALA  35           HB1      ALA  35  28.576  10.540  12.413
    4    HB2  ALA  35           HB2      ALA  35  27.740  11.576  13.569
    5    HB1  ALA  35           HB3      ALA  35  28.580  12.290  12.194

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA  36           H        ALA  36  25.773   9.801  13.475
    2    HA   ALA  36           HA       ALA  36  26.203   7.310  12.185
    3    HB2  ALA  36           HB1      ALA  36  25.773   6.562  14.260
    4    HB3  ALA  36           HB2      ALA  36  24.094   7.089  14.125
    5    HB1  ALA  36           HB3      ALA  36  25.319   8.195  14.744

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA  37           H        ALA  37  23.421   9.486  12.349
    2    HA   ALA  37           HA       ALA  37  21.525   7.756  11.178
    3    HB3  ALA  37           HB1      ALA  37  21.806  10.713  11.482
    4    HB1  ALA  37           HB2      ALA  37  20.478   9.656  11.959
    5    HB2  ALA  37           HB3      ALA  37  20.664  10.132  10.271

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LYS  38           H        LYS  38  23.657  10.186   9.695
    2    HA   LYS  38           HA       LYS  38  22.991   9.782   7.021
    3    HB2  LYS  38           HB2      LYS  38  24.839  11.301   8.460
    4    HB3  LYS  38           HB3      LYS  38  25.847  10.298   7.422
    5    HG2  LYS  38           HG2      LYS  38  24.682  11.098   5.438
    6    HG3  LYS  38           HG3      LYS  38  23.509  11.969   6.432
    7    HD2  LYS  38           HD2      LYS  38  25.138  13.536   7.179
    8    HD3  LYS  38           HD3      LYS  38  26.476  12.528   6.630
    9    HE2  LYS  38           HE2      LYS  38  26.141  14.413   5.089
   10    HE3  LYS  38           HE3      LYS  38  25.774  12.885   4.280
   11    HZ3  LYS  38           HZ1      LYS  38  23.584  13.368   4.168
   12    HZ2  LYS  38           HZ2      LYS  38  24.135  14.974   4.259
   13    HZ1  LYS  38           HZ3      LYS  38  23.558  14.193   5.652

  No H/Q in entry =          13
  In of MODEL   14
    1    H    ALA  39           H        ALA  39  25.491   8.132   8.952
    2    HA   ALA  39           HA       ALA  39  26.518   6.535   6.867
    3    HB2  ALA  39           HB1      ALA  39  26.433   5.560   9.707
    4    HB1  ALA  39           HB2      ALA  39  27.407   6.971   9.290
    5    HB3  ALA  39           HB3      ALA  39  27.726   5.418   8.518

  No H/Q in entry =           5
  In of MODEL   14
    1    H    MET  40           H        MET  40  23.911   5.953   9.181
    2    HA   MET  40           HA       MET  40  23.417   3.260   8.438
    3    HB2  MET  40           HB2      MET  40  21.645   5.328   9.753
    4    HB3  MET  40           HB3      MET  40  21.208   3.627   9.573
    5    HG2  MET  40           HG2      MET  40  23.783   4.518  10.900
    6    HG3  MET  40           HG3      MET  40  22.290   4.264  11.803
    7    HE3  MET  40           HE1      MET  40  21.667   0.640  11.966
    8    HE2  MET  40           HE2      MET  40  20.814   1.960  11.171
    9    HE1  MET  40           HE3      MET  40  21.571   2.228  12.740

  No H/Q in entry =           9
  In of MODEL   14
    1    H    MET  41           H        MET  41  22.046   6.342   7.275
    2    HA   MET  41           HA       MET  41  20.058   5.187   5.612
    3    HB2  MET  41           HB2      MET  41  21.578   7.755   5.100
    4    HB3  MET  41           HB3      MET  41  20.037   7.290   4.390
    5    HG2  MET  41           HG2      MET  41  19.306   7.102   6.946
    6    HG3  MET  41           HG3      MET  41  20.636   8.237   7.163
    7    HE2  MET  41           HE1      MET  41  20.071   9.549   3.837
    8    HE1  MET  41           HE2      MET  41  21.045   9.966   5.243
    9    HE3  MET  41           HE3      MET  41  19.786  11.069   4.693

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ASP  42           H        ASP  42  23.441   6.057   5.038
    2    HA   ASP  42           HA       ASP  42  23.505   5.594   2.278
    3    HB2  ASP  42           HB2      ASP  42  25.285   6.554   4.039
    4    HB3  ASP  42           HB3      ASP  42  25.914   4.918   3.899

  No H/Q in entry =           4
  In of MODEL   14
    1    H    GLN  43           H        GLN  43  24.213   3.415   4.984
    2    HA   GLN  43           HA       GLN  43  24.829   1.154   3.386
    3    HB2  GLN  43           HB2      GLN  43  23.830   1.341   6.238
    4    HB3  GLN  43           HB3      GLN  43  24.378  -0.154   5.472
    5    HG2  GLN  43           HG2      GLN  43  26.558   1.023   4.950
    6    HG3  GLN  43           HG3      GLN  43  26.004   2.355   5.960
    7   HE21  GLN  43          HE21      GLN  43  28.228   1.341   6.976
    8   HE22  GLN  43          HE22      GLN  43  27.945   0.257   8.249

  No H/Q in entry =           8
  In of MODEL   14
    1    H    SER  44           H        SER  44  21.802   2.331   4.798
    2    HA   SER  44           HA       SER  44  20.191   0.117   4.127
    3    HB2  SER  44           HB2      SER  44  19.800   2.648   5.287
    4    HB3  SER  44           HB3      SER  44  18.755   2.629   3.870
    5    HG   SER  44           HG       SER  44  17.658   1.695   5.596

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ARG  45           H        ARG  45  20.970   3.078   2.330
    2    HA   ARG  45           HA       ARG  45  19.420   2.628   0.035
    3    HB2  ARG  45           HB2      ARG  45  20.604   4.742   0.620
    4    HB3  ARG  45           HB3      ARG  45  22.133   3.963   0.220
    5    HG2  ARG  45           HG2      ARG  45  21.326   3.582  -2.091
    6    HG3  ARG  45           HG3      ARG  45  19.809   4.383  -1.689
    7    HD2  ARG  45           HD2      ARG  45  21.099   6.456  -1.105
    8    HD3  ARG  45           HD3      ARG  45  22.578   5.660  -1.688
    9    HE   ARG  45           HE       ARG  45  20.629   5.464  -3.711
   10   HH21  ARG  45          HH11      ARG  45  20.632   6.841  -5.468
   11   HH22  ARG  45          HH12      ARG  45  21.416   8.378  -5.362
   12   HH11  ARG  45          HH21      ARG  45  22.413   7.925  -2.086
   13   HH12  ARG  45          HH22      ARG  45  22.423   8.991  -3.444

  No H/Q in entry =          13
  In of MODEL   14
    1    H    MET  46           H        MET  46  22.775   1.693   0.753
    2    HA   MET  46           HA       MET  46  23.341   0.502  -1.741
    3    HB2  MET  46           HB2      MET  46  24.466   0.185   1.038
    4    HB3  MET  46           HB3      MET  46  25.077  -0.774  -0.314
    5    HG2  MET  46           HG2      MET  46  25.782   1.158  -1.508
    6    HG3  MET  46           HG3      MET  46  24.834   2.232  -0.488
    7    HE3  MET  46           HE1      MET  46  26.485  -0.656   1.472
    8    HE2  MET  46           HE2      MET  46  28.203  -0.292   1.340
    9    HE1  MET  46           HE3      MET  46  27.284  -0.706  -0.106

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ALA  47           H        ALA  47  21.958  -0.821   1.240
    2    HA   ALA  47           HA       ALA  47  21.851  -3.529   0.426
    3    HB2  ALA  47           HB1      ALA  47  21.499  -3.072   2.735
    4    HB3  ALA  47           HB2      ALA  47  19.947  -3.645   2.126
    5    HB1  ALA  47           HB3      ALA  47  20.209  -1.920   2.390

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU  48           H        LEU  48  19.542  -0.860   0.099
    2    HA   LEU  48           HA       LEU  48  17.461  -2.351  -1.142
    3    HB2  LEU  48           HB2      LEU  48  18.167   0.592  -1.250
    4    HB3  LEU  48           HB3      LEU  48  16.678  -0.090  -1.907
    5    HG   LEU  48           HG       LEU  48  17.549  -0.419   0.973
    6   HD13  LEU  48          HD11      LEU  48  17.171   1.889   0.799
    7   HD12  LEU  48          HD12      LEU  48  15.605   1.267   1.318
    8   HD11  LEU  48          HD13      LEU  48  15.870   1.692  -0.373
    9   HD22  LEU  48          HD21      LEU  48  15.987  -2.105   0.597
   10   HD21  LEU  48          HD22      LEU  48  15.120  -1.181  -0.630
   11   HD23  LEU  48          HD23      LEU  48  14.928  -0.780   1.077

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ASN  49           H        ASN  49  20.173  -0.466  -2.387
    2    HA   ASN  49           HA       ASN  49  19.498  -0.526  -5.106
    3    HB2  ASN  49           HB2      ASN  49  21.214   0.953  -4.180
    4    HB3  ASN  49           HB3      ASN  49  22.224  -0.430  -3.780
    5   HD21  ASN  49          HD21      ASN  49  23.940   0.341  -5.190
    6   HD22  ASN  49          HD22      ASN  49  23.797   0.254  -6.877

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLU  50           H        GLU  50  21.459  -2.765  -3.169
    2    HA   GLU  50           HA       GLU  50  22.111  -4.524  -5.308
    3    HB2  GLU  50           HB2      GLU  50  23.327  -4.529  -3.151
    4    HB3  GLU  50           HB3      GLU  50  21.880  -5.134  -2.346
    5    HG2  GLU  50           HG2      GLU  50  21.921  -7.163  -3.713
    6    HG3  GLU  50           HG3      GLU  50  23.300  -6.552  -4.623

  No H/Q in entry =           6
  In of MODEL   14
    1    H    ALA  51           H        ALA  51  19.476  -4.420  -2.959
    2    HA   ALA  51           HA       ALA  51  18.258  -6.868  -3.715
    3    HB3  ALA  51           HB1      ALA  51  16.689  -6.340  -2.145
    4    HB1  ALA  51           HB2      ALA  51  16.500  -4.688  -2.735
    5    HB2  ALA  51           HB3      ALA  51  17.861  -5.103  -1.692

  No H/Q in entry =           5
  In of MODEL   14
    1    H    HIS  52           H        HIS  52  17.725  -3.506  -4.733
    2    HA   HIS  52           HA       HIS  52  15.587  -3.987  -6.516
    3    HB2  HIS  52           HB2      HIS  52  16.274  -1.737  -5.717
    4    HB3  HIS  52           HB3      HIS  52  17.729  -1.855  -6.706
    5    HD1  HIS  52           HD1      HIS  52  17.364  -1.970  -9.338
    6    HD2  HIS  52           HD2      HIS  52  13.952  -1.044  -7.130
    7    HE1  HIS  52           HE1      HIS  52  15.671  -1.058 -10.986
    8    HE2  HIS  52           HE2      HIS  52  13.585  -0.487  -9.654

  No H/Q in entry =           8
  In of MODEL   14
    1    H    LEU  53           H        LEU  53  19.101  -4.055  -6.979
    2    HA   LEU  53           HA       LEU  53  19.128  -4.360  -9.781
    3    HB2  LEU  53           HB2      LEU  53  21.066  -5.165  -7.626
    4    HB3  LEU  53           HB3      LEU  53  21.361  -5.551  -9.320
    5    HG   LEU  53           HG       LEU  53  20.746  -2.733  -8.375
    6   HD13  LEU  53          HD11      LEU  53  22.775  -3.390  -7.243
    7   HD12  LEU  53          HD12      LEU  53  23.234  -2.383  -8.617
    8   HD11  LEU  53          HD13      LEU  53  23.411  -4.131  -8.710
    9   HD21  LEU  53          HD21      LEU  53  21.780  -3.974 -10.931
   10   HD23  LEU  53          HD22      LEU  53  22.153  -2.299 -10.535
   11   HD22  LEU  53          HD23      LEU  53  20.485  -2.799 -10.742

  No H/Q in entry =          11
  In of MODEL   14
    1    H    VAL  54           H        VAL  54  18.996  -6.755  -7.163
    2    HA   VAL  54           HA       VAL  54  19.064  -9.045  -8.832
    3    HB   VAL  54           HB       VAL  54  17.941  -8.611  -6.053
    4   HG12  VAL  54          HG11      VAL  54  18.219 -11.234  -6.061
    5   HG11  VAL  54          HG12      VAL  54  18.022 -11.056  -7.805
    6   HG13  VAL  54          HG13      VAL  54  16.752 -10.507  -6.713
    7   HG22  VAL  54          HG21      VAL  54  20.262  -8.442  -5.850
    8   HG21  VAL  54          HG22      VAL  54  20.568  -9.535  -7.198
    9   HG23  VAL  54          HG23      VAL  54  20.040 -10.178  -5.643

  No H/Q in entry =           9
  In of MODEL   14
    1    H    GLN  55           H        GLN  55  16.381  -7.099  -7.519
    2    HA   GLN  55           HA       GLN  55  14.322  -8.724  -8.581
    3    HB2  GLN  55           HB2      GLN  55  13.614  -7.191  -6.943
    4    HB3  GLN  55           HB3      GLN  55  14.424  -5.834  -7.721
    5    HG2  GLN  55           HG2      GLN  55  12.693  -5.474  -9.194
    6    HG3  GLN  55           HG3      GLN  55  12.340  -7.188  -9.368
    7   HE21  GLN  55          HE21      GLN  55  10.331  -7.705  -8.547
    8   HE22  GLN  55          HE22      GLN  55   9.581  -6.943  -7.230

  No H/Q in entry =           8
  In of MODEL   14
    1    H    THR  56           H        THR  56  16.097  -5.949  -9.946
    2    HA   THR  56           HA       THR  56  14.646  -5.554 -12.280
    3    HB   THR  56           HB       THR  56  17.667  -5.517 -12.142
    4    HG1  THR  56           HG1      THR  56  15.704  -3.815 -11.097
    5   HG23  THR  56          HG21      THR  56  16.940  -5.156 -14.373
    6   HG22  THR  56          HG22      THR  56  17.225  -3.543 -13.720
    7   HG21  THR  56          HG23      THR  56  15.578  -4.163 -13.848

  No H/Q in entry =           7
  In of MODEL   14
    1    H    LYS  57           H        LYS  57  17.261  -7.898 -11.700
    2    HA   LYS  57           HA       LYS  57  17.219  -9.083 -14.282
    3    HB2  LYS  57           HB2      LYS  57  19.019  -9.372 -12.551
    4    HB3  LYS  57           HB3      LYS  57  17.905 -10.354 -11.611
    5    HG2  LYS  57           HG2      LYS  57  17.770 -11.995 -13.413
    6    HG3  LYS  57           HG3      LYS  57  18.797 -10.999 -14.437
    7    HD2  LYS  57           HD2      LYS  57  20.262 -12.632 -13.531
    8    HD3  LYS  57           HD3      LYS  57  20.558 -11.189 -12.562
    9    HE2  LYS  57           HE2      LYS  57  19.250 -12.022 -10.738
   10    HE3  LYS  57           HE3      LYS  57  18.566 -13.319 -11.717
   11    HZ2  LYS  57           HZ1      LYS  57  20.424 -13.944 -10.163
   12    HZ1  LYS  57           HZ2      LYS  57  21.468 -13.094 -11.198
   13    HZ3  LYS  57           HZ3      LYS  57  20.604 -14.437 -11.776

  No H/Q in entry =          13
  In of MODEL   14
    1    H    LEU  58           H        LEU  58  15.453  -9.731 -11.294
    2    HA   LEU  58           HA       LEU  58  14.184 -12.081 -12.225
    3    HB2  LEU  58           HB2      LEU  58  13.440 -10.170 -10.017
    4    HB3  LEU  58           HB3      LEU  58  12.605 -11.693 -10.331
    5    HG   LEU  58           HG       LEU  58  15.587 -11.466  -9.801
    6   HD11  LEU  58          HD11      LEU  58  13.225 -11.850  -7.989
    7   HD13  LEU  58          HD12      LEU  58  14.697 -10.912  -7.736
    8   HD12  LEU  58          HD13      LEU  58  14.741 -12.670  -7.608
    9   HD22  LEU  58          HD21      LEU  58  15.426 -13.522 -10.835
   10   HD21  LEU  58          HD22      LEU  58  13.712 -13.704 -10.460
   11   HD23  LEU  58          HD23      LEU  58  14.926 -14.030  -9.222

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  59           H        ILE  59  13.562  -8.731 -12.891
    2    HA   ILE  59           HA       ILE  59  10.828  -9.331 -13.809
    3    HB   ILE  59           HB       ILE  59  11.680  -7.067 -12.603
    4   HG12  ILE  59          HG12      ILE  59   9.759  -6.903 -14.937
    5   HG13  ILE  59          HG13      ILE  59   9.338  -7.671 -13.428
    6   HG21  ILE  59          HG21      ILE  59  13.210  -6.694 -14.683
    7   HG23  ILE  59          HG22      ILE  59  12.276  -5.337 -14.093
    8   HG22  ILE  59          HG23      ILE  59  11.735  -6.242 -15.504
    9   HD13  ILE  59          HD11      ILE  59   9.771  -5.613 -12.193
   10   HD12  ILE  59          HD12      ILE  59   8.619  -5.294 -13.488
   11   HD11  ILE  59          HD13      ILE  59  10.309  -4.822 -13.676

  No H/Q in entry =          11
  In of MODEL   14
    1    H    GLU  60           H        GLU  60  14.035  -8.528 -15.093
    2    HA   GLU  60           HA       GLU  60  13.238  -8.105 -17.793
    3    HB2  GLU  60           HB2      GLU  60  15.424  -7.386 -17.043
    4    HB3  GLU  60           HB3      GLU  60  15.863  -9.032 -16.600
    5    HG2  GLU  60           HG2      GLU  60  15.048  -8.409 -19.430
    6    HG3  GLU  60           HG3      GLU  60  16.693  -8.077 -18.891

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLY  61           H        GLY  61  14.183 -11.009 -15.996
    2    HA3  GLY  61           HA2      GLY  61  13.593 -12.639 -18.398
    3    HA2  GLY  61           HA3      GLY  61  14.629 -13.142 -17.066

  No H/Q in entry =           3
  In of MODEL   14
    1    H    ASP  62           H        ASP  62  11.538 -11.546 -16.663
    2    HA   ASP  62           HA       ASP  62  10.598 -13.612 -14.919
    3    HB2  ASP  62           HB2      ASP  62   8.579 -12.200 -14.768
    4    HB3  ASP  62           HB3      ASP  62  10.056 -11.285 -14.489

  No H/Q in entry =           4
  In of MODEL   14
    1    H    ALA  63           H        ALA  63  10.808 -15.340 -16.727
    2    HA   ALA  63           HA       ALA  63   8.894 -15.418 -18.851
    3    HB3  ALA  63           HB1      ALA  63   9.423 -17.962 -18.679
    4    HB2  ALA  63           HB2      ALA  63  10.630 -17.466 -17.493
    5    HB1  ALA  63           HB3      ALA  63  10.719 -16.859 -19.147

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLY  64           H        GLY  64   8.931 -16.586 -15.533
    2    HA3  GLY  64           HA2      GLY  64   7.109 -16.957 -14.124
    3    HA2  GLY  64           HA3      GLY  64   6.032 -16.771 -15.500

  No H/Q in entry =           3
  In of MODEL   14
    1    H    GLU  65           H        GLU  65   5.444 -18.776 -13.795
    2    HA   GLU  65           HA       GLU  65   6.742 -21.229 -14.310
    3    HB2  GLU  65           HB2      GLU  65   3.973 -20.630 -13.281
    4    HB3  GLU  65           HB3      GLU  65   4.662 -22.252 -13.352
    5    HG2  GLU  65           HG2      GLU  65   6.512 -21.569 -11.914
    6    HG3  GLU  65           HG3      GLU  65   5.921 -19.909 -11.897

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLY  66           H        GLY  66   3.958 -19.714 -15.759
    2    HA3  GLY  66           HA2      GLY  66   3.650 -21.879 -17.716
    3    HA2  GLY  66           HA3      GLY  66   2.457 -20.649 -17.352

  No H/Q in entry =           3
  In of MODEL   14
    1    H    LYS  67           H        LYS  67   2.636 -20.918 -19.847
    2    HA   LYS  67           HA       LYS  67   4.566 -20.117 -21.501
    3    HB2  LYS  67           HB2      LYS  67   2.680 -18.997 -22.873
    4    HB3  LYS  67           HB3      LYS  67   2.540 -20.717 -22.483
    5    HG2  LYS  67           HG2      LYS  67   1.143 -20.179 -20.534
    6    HG3  LYS  67           HG3      LYS  67   1.302 -18.459 -20.879
    7    HD2  LYS  67           HD2      LYS  67   0.174 -18.791 -23.051
    8    HD3  LYS  67           HD3      LYS  67   0.004 -20.512 -22.693
    9    HE2  LYS  67           HE2      LYS  67  -1.334 -19.978 -20.697
   10    HE3  LYS  67           HE3      LYS  67  -1.152 -18.256 -21.026
   11    HZ3  LYS  67           HZ1      LYS  67  -3.075 -18.547 -22.115
   12    HZ2  LYS  67           HZ2      LYS  67  -2.849 -20.218 -22.315
   13    HZ1  LYS  67           HZ3      LYS  67  -2.082 -19.122 -23.364

  No H/Q in entry =          13
  In of MODEL   14
    1    H    MET  68           H        MET  68   2.446 -17.588 -21.847
    2    HA   MET  68           HA       MET  68   4.390 -15.563 -21.856
    3    HB2  MET  68           HB2      MET  68   1.384 -15.543 -21.862
    4    HB3  MET  68           HB3      MET  68   2.326 -14.053 -21.912
    5    HG2  MET  68           HG2      MET  68   3.463 -14.792 -23.940
    6    HG3  MET  68           HG3      MET  68   2.635 -16.349 -23.869
    7    HE1  MET  68           HE1      MET  68   2.543 -12.704 -24.050
    8    HE3  MET  68           HE2      MET  68   0.987 -12.598 -23.231
    9    HE2  MET  68           HE3      MET  68   1.096 -12.230 -24.950

  No H/Q in entry =           9
  In of MODEL   14
    1    H    LYS  69           H        LYS  69   2.010 -16.408 -19.323
    2    HA   LYS  69           HA       LYS  69   2.031 -14.260 -17.697
    3    HB2  LYS  69           HB2      LYS  69   2.147 -17.172 -16.935
    4    HB3  LYS  69           HB3      LYS  69   1.842 -15.886 -15.765
    5    HG2  LYS  69           HG2      LYS  69  -0.076 -15.109 -17.101
    6    HG3  LYS  69           HG3      LYS  69   0.228 -16.382 -18.283
    7    HD2  LYS  69           HD2      LYS  69  -0.155 -18.090 -16.542
    8    HD3  LYS  69           HD3      LYS  69  -0.473 -16.814 -15.365
    9    HE2  LYS  69           HE2      LYS  69  -2.367 -16.019 -16.730
   10    HE3  LYS  69           HE3      LYS  69  -2.049 -17.286 -17.913
   11    HZ1  LYS  69           HZ1      LYS  69  -2.463 -17.996 -15.092
   12    HZ3  LYS  69           HZ2      LYS  69  -2.736 -18.927 -16.485
   13    HZ2  LYS  69           HZ3      LYS  69  -3.805 -17.672 -16.077

  No H/Q in entry =          13
  In of MODEL   14
    1    H    VAL  70           H        VAL  70   3.042 -14.298 -15.302
    2    HA   VAL  70           HA       VAL  70   5.990 -14.499 -15.534
    3    HB   VAL  70           HB       VAL  70   6.143 -12.386 -14.248
    4   HG13  VAL  70          HG11      VAL  70   5.489 -10.890 -16.098
    5   HG12  VAL  70          HG12      VAL  70   4.495 -12.175 -16.787
    6   HG11  VAL  70          HG13      VAL  70   6.248 -12.354 -16.722
    7   HG21  VAL  70          HG21      VAL  70   3.121 -12.460 -14.549
    8   HG23  VAL  70          HG22      VAL  70   4.005 -10.982 -14.172
    9   HG22  VAL  70          HG23      VAL  70   4.048 -12.344 -13.052

  No H/Q in entry =           9
  In of MODEL   14
    1    H    SER  71           H        SER  71   7.058 -14.503 -13.390
    2    HA   SER  71           HA       SER  71   6.016 -16.473 -11.651
    3    HB2  SER  71           HB2      SER  71   8.442 -15.913 -11.887
    4    HB3  SER  71           HB3      SER  71   8.138 -14.399 -11.036
    5    HG   SER  71           HG       SER  71   8.781 -16.526  -9.877

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU  72           H        LEU  72   4.633 -16.329  -9.997
    2    HA   LEU  72           HA       LEU  72   3.126 -13.992  -9.532
    3    HB2  LEU  72           HB2      LEU  72   3.384 -16.558  -7.970
    4    HB3  LEU  72           HB3      LEU  72   2.237 -15.284  -7.562
    5    HG   LEU  72           HG       LEU  72   2.361 -16.590 -10.300
    6   HD11  LEU  72          HD11      LEU  72   1.786 -18.220  -8.490
    7   HD13  LEU  72          HD12      LEU  72   0.450 -17.933  -9.603
    8   HD12  LEU  72          HD13      LEU  72   0.453 -17.166  -8.015
    9   HD21  LEU  72          HD21      LEU  72   0.525 -14.635  -8.928
   10   HD23  LEU  72          HD22      LEU  72  -0.124 -15.689 -10.174
   11   HD22  LEU  72          HD23      LEU  72   1.180 -14.570 -10.559

  No H/Q in entry =          11
  In of MODEL   14
    1    H    VAL  73           H        VAL  73   5.772 -15.480  -7.786
    2    HA   VAL  73           HA       VAL  73   5.756 -13.955  -5.447
    3    HB   VAL  73           HB       VAL  73   7.921 -14.809  -5.036
    4   HG11  VAL  73          HG11      VAL  73   5.954 -16.455  -5.381
    5   HG13  VAL  73          HG12      VAL  73   7.585 -17.124  -5.359
    6   HG12  VAL  73          HG13      VAL  73   6.753 -16.876  -6.894
    7   HG22  VAL  73          HG21      VAL  73   9.256 -14.232  -6.856
    8   HG21  VAL  73          HG22      VAL  73   8.096 -14.847  -8.031
    9   HG23  VAL  73          HG23      VAL  73   9.086 -15.970  -7.100

  No H/Q in entry =           9
  In of MODEL   14
    1    H    LEU  74           H        LEU  74   6.735 -13.065  -8.627
    2    HA   LEU  74           HA       LEU  74   8.717 -11.151  -8.142
    3    HB2  LEU  74           HB2      LEU  74   8.235 -11.880 -10.380
    4    HB3  LEU  74           HB3      LEU  74   6.577 -11.294 -10.264
    5    HG   LEU  74           HG       LEU  74   7.412  -8.977 -10.044
    6   HD13  LEU  74          HD11      LEU  74   9.533  -9.191  -9.012
    7   HD12  LEU  74          HD12      LEU  74   9.913  -8.716 -10.666
    8   HD11  LEU  74          HD13      LEU  74  10.073 -10.402 -10.175
    9   HD22  LEU  74          HD21      LEU  74   7.718  -8.739 -12.303
   10   HD21  LEU  74          HD22      LEU  74   7.135 -10.388 -12.250
   11   HD23  LEU  74          HD23      LEU  74   8.851 -10.085 -12.400

  No H/Q in entry =          11
  In of MODEL   14
    1    H    VAL  75           H        VAL  75   5.225 -10.707  -8.467
    2    HA   VAL  75           HA       VAL  75   5.180  -7.952  -7.869
    3    HB   VAL  75           HB       VAL  75   3.058 -10.062  -7.478
    4   HG11  VAL  75          HG11      VAL  75   2.922  -7.021  -7.291
    5   HG13  VAL  75          HG12      VAL  75   2.609  -8.164  -5.994
    6   HG12  VAL  75          HG13      VAL  75   1.515  -8.079  -7.366
    7   HG22  VAL  75          HG21      VAL  75   2.191  -9.191  -9.569
    8   HG21  VAL  75          HG22      VAL  75   3.897  -9.568  -9.810
    9   HG23  VAL  75          HG23      VAL  75   3.387  -7.895  -9.580

  No H/Q in entry =           9
  In of MODEL   14
    1    H    GLU  76           H        GLU  76   4.893 -10.832  -5.769
    2    HA   GLU  76           HA       GLU  76   4.464  -9.474  -3.339
    3    HB2  GLU  76           HB2      GLU  76   4.243 -11.933  -3.574
    4    HB3  GLU  76           HB3      GLU  76   5.972 -12.065  -3.839
    5    HG2  GLU  76           HG2      GLU  76   5.524 -12.649  -1.533
    6    HG3  GLU  76           HG3      GLU  76   6.347 -11.100  -1.536

  No H/Q in entry =           6
  In of MODEL   14
    1    H    ALA  77           H        ALA  77   7.496 -10.426  -4.927
    2    HA   ALA  77           HA       ALA  77   9.217  -9.419  -2.920
    3    HB2  ALA  77           HB1      ALA  77  10.958  -9.847  -4.399
    4    HB3  ALA  77           HB2      ALA  77  10.001  -9.407  -5.813
    5    HB1  ALA  77           HB3      ALA  77   9.711 -10.941  -4.996

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLN  78           H        GLN  78   7.829  -7.967  -5.818
    2    HA   GLN  78           HA       GLN  78   9.225  -5.511  -5.713
    3    HB2  GLN  78           HB2      GLN  78   7.896  -6.399  -7.664
    4    HB3  GLN  78           HB3      GLN  78   6.428  -5.991  -6.777
    5    HG2  GLN  78           HG2      GLN  78   7.117  -3.636  -6.694
    6    HG3  GLN  78           HG3      GLN  78   8.606  -4.030  -7.551
    7   HE21  GLN  78          HE21      GLN  78   6.698  -2.180  -8.647
    8   HE22  GLN  78          HE22      GLN  78   6.023  -2.881 -10.037

  No H/Q in entry =           8
  In of MODEL   14
    1    H    LEU  79           H        LEU  79   6.196  -6.602  -4.267
    2    HA   LEU  79           HA       LEU  79   5.251  -4.183  -3.242
    3    HB2  LEU  79           HB2      LEU  79   3.901  -6.211  -3.185
    4    HB3  LEU  79           HB3      LEU  79   5.040  -6.975  -2.081
    5    HG   LEU  79           HG       LEU  79   4.528  -5.330  -0.344
    6   HD13  LEU  79          HD11      LEU  79   4.091  -3.304  -1.383
    7   HD12  LEU  79          HD12      LEU  79   2.460  -3.803  -0.936
    8   HD11  LEU  79          HD13      LEU  79   3.025  -4.028  -2.589
    9   HD23  LEU  79          HD21      LEU  79   1.934  -5.778  -0.239
   10   HD22  LEU  79          HD22      LEU  79   3.051  -7.137  -0.143
   11   HD21  LEU  79          HD23      LEU  79   2.233  -6.780  -1.661

  No H/Q in entry =          11
  In of MODEL   14
    1    H    HIS  80           H        HIS  80   7.402  -6.562  -1.682
    2    HA   HIS  80           HA       HIS  80   7.732  -5.035   0.691
    3    HB2  HIS  80           HB2      HIS  80   9.021  -7.417  -0.526
    4    HB3  HIS  80           HB3      HIS  80   9.955  -6.541   0.688
    5    HD1  HIS  80           HD1      HIS  80   9.468  -7.178   3.032
    6    HD2  HIS  80           HD2      HIS  80   6.221  -7.961   0.537
    7    HE1  HIS  80           HE1      HIS  80   7.686  -8.255   4.487
    8    HE2  HIS  80           HE2      HIS  80   5.700  -8.737   2.975

  No H/Q in entry =           8
  In of MODEL   14
    1    H    LEU  81           H        LEU  81   9.715  -5.335  -2.235
    2    HA   LEU  81           HA       LEU  81  11.795  -3.634  -1.363
    3    HB2  LEU  81           HB2      LEU  81  10.843  -4.399  -4.123
    4    HB3  LEU  81           HB3      LEU  81  12.283  -3.419  -3.838
    5    HG   LEU  81           HG       LEU  81  11.849  -6.138  -2.572
    6   HD12  LEU  81          HD11      LEU  81  13.642  -6.790  -4.336
    7   HD11  LEU  81          HD12      LEU  81  13.097  -5.353  -5.198
    8   HD13  LEU  81          HD13      LEU  81  11.964  -6.658  -4.858
    9   HD23  LEU  81          HD21      LEU  81  14.482  -5.871  -2.573
   10   HD22  LEU  81          HD22      LEU  81  13.522  -5.098  -1.314
   11   HD21  LEU  81          HD23      LEU  81  14.109  -4.151  -2.681

  No H/Q in entry =          11
  In of MODEL   14
    1    H    MET  82           H        MET  82   8.873  -2.937  -3.279
    2    HA   MET  82           HA       MET  82   9.459  -0.219  -3.772
    3    HB2  MET  82           HB2      MET  82   6.872  -1.766  -3.638
    4    HB3  MET  82           HB3      MET  82   6.901  -0.041  -3.996
    5    HG2  MET  82           HG2      MET  82   8.454  -2.137  -5.549
    6    HG3  MET  82           HG3      MET  82   6.895  -1.484  -6.049
    7    HE3  MET  82           HE1      MET  82   7.401   1.967  -7.210
    8    HE2  MET  82           HE2      MET  82   7.032   1.741  -5.502
    9    HE1  MET  82           HE3      MET  82   6.339   0.648  -6.697

  No H/Q in entry =           9
  In of MODEL   14
    1    H    THR  83           H        THR  83   7.654  -1.794  -1.163
    2    HA   THR  83           HA       THR  83   6.854   0.564   0.178
    3    HB   THR  83           HB       THR  83   6.703  -1.016   2.190
    4    HG1  THR  83           HG1      THR  83   7.422  -2.979   1.948
    5   HG22  THR  83          HG21      THR  83   5.012  -2.545   0.726
    6   HG21  THR  83          HG22      THR  83   5.257  -1.216  -0.402
    7   HG23  THR  83          HG23      THR  83   4.632  -0.896   1.216

  No H/Q in entry =           7
  In of MODEL   14
    1    H    SER  84           H        SER  84   9.641  -1.589   0.673
    2    HA   SER  84           HA       SER  84  10.741  -0.187   2.861
    3    HB2  SER  84           HB2      SER  84  11.947  -2.045   0.821
    4    HB3  SER  84           HB3      SER  84  12.915  -1.315   2.100
    5    HG   SER  84           HG       SER  84  10.610  -2.962   2.367

  No H/Q in entry =           5
  In of MODEL   14
    1    H    MET  85           H        MET  85  11.478   0.074  -0.631
    2    HA   MET  85           HA       MET  85  13.515   1.999  -0.384
    3    HB2  MET  85           HB2      MET  85  13.088   0.737  -2.452
    4    HB3  MET  85           HB3      MET  85  11.570   1.610  -2.668
    5    HG2  MET  85           HG2      MET  85  12.781   3.736  -2.816
    6    HG3  MET  85           HG3      MET  85  14.306   2.906  -2.522
    7    HE1  MET  85           HE1      MET  85  11.258   3.340  -4.522
    8    HE3  MET  85           HE2      MET  85  11.239   1.661  -5.055
    9    HE2  MET  85           HE3      MET  85  11.649   2.932  -6.200

  No H/Q in entry =           9
  In of MODEL   14
    1    H    LEU  86           H        LEU  86  10.029   2.403  -0.870
    2    HA   LEU  86           HA       LEU  86  10.018   5.217  -1.041
    3    HB2  LEU  86           HB2      LEU  86   8.139   3.596  -1.612
    4    HB3  LEU  86           HB3      LEU  86   7.818   3.505   0.120
    5    HG   LEU  86           HG       LEU  86   7.706   6.069   0.078
    6   HD11  LEU  86          HD11      LEU  86   8.457   5.629  -2.630
    7   HD13  LEU  86          HD12      LEU  86   8.055   7.162  -1.861
    8   HD12  LEU  86          HD13      LEU  86   6.796   6.226  -2.662
    9   HD23  LEU  86          HD21      LEU  86   5.537   4.764  -1.577
   10   HD22  LEU  86          HD22      LEU  86   5.378   6.023  -0.355
   11   HD21  LEU  86          HD23      LEU  86   5.749   4.369   0.129

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ALA  87           H        ALA  87   9.526   3.037   1.700
    2    HA   ALA  87           HA       ALA  87   9.027   4.953   3.680
    3    HB1  ALA  87           HB1      ALA  87   9.778   2.118   3.577
    4    HB3  ALA  87           HB2      ALA  87   8.676   2.948   4.673
    5    HB2  ALA  87           HB3      ALA  87  10.407   2.944   5.007

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ARG  88           H        ARG  88  12.076   3.473   2.675
    2    HA   ARG  88           HA       ARG  88  13.723   4.812   4.503
    3    HB2  ARG  88           HB2      ARG  88  14.344   2.831   3.087
    4    HB3  ARG  88           HB3      ARG  88  14.510   3.927   1.718
    5    HG2  ARG  88           HG2      ARG  88  16.020   5.204   3.660
    6    HG3  ARG  88           HG3      ARG  88  16.310   3.507   4.030
    7    HD2  ARG  88           HD2      ARG  88  17.559   3.193   2.175
    8    HD3  ARG  88           HD3      ARG  88  16.434   4.091   1.152
    9    HE   ARG  88           HE       ARG  88  18.855   5.103   2.189
   10   HH21  ARG  88          HH11      ARG  88  19.243   7.316   2.001
   11   HH22  ARG  88          HH12      ARG  88  17.912   8.414   1.870
   12   HH11  ARG  88          HH21      ARG  88  15.530   5.923   1.934
   13   HH12  ARG  88          HH22      ARG  88  15.808   7.623   1.808

  No H/Q in entry =          13
  In of MODEL   14
    1    H    GLU  89           H        GLU  89  12.747   5.742   1.189
    2    HA   GLU  89           HA       GLU  89  14.339   8.072   1.032
    3    HB2  GLU  89           HB2      GLU  89  13.163   7.062  -0.913
    4    HB3  GLU  89           HB3      GLU  89  11.633   7.630  -0.243
    5    HG2  GLU  89           HG2      GLU  89  12.379   9.954  -0.401
    6    HG3  GLU  89           HG3      GLU  89  13.970   9.434  -0.949

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LEU  90           H        LEU  90  11.007   7.623   2.181
    2    HA   LEU  90           HA       LEU  90  10.549  10.364   2.770
    3    HB2  LEU  90           HB2      LEU  90   9.311   7.810   3.795
    4    HB3  LEU  90           HB3      LEU  90   8.714   9.415   4.228
    5    HG   LEU  90           HG       LEU  90   9.097   8.539   1.353
    6   HD12  LEU  90          HD11      LEU  90   6.558   8.260   1.430
    7   HD11  LEU  90          HD12      LEU  90   6.724   8.239   3.186
    8   HD13  LEU  90          HD13      LEU  90   7.512   6.998   2.211
    9   HD22  LEU  90          HD21      LEU  90   8.848  10.853   1.290
   10   HD21  LEU  90          HD22      LEU  90   7.872  10.898   2.757
   11   HD23  LEU  90          HD23      LEU  90   7.154  10.363   1.238

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  91           H        ILE  91  11.772   7.650   4.674
    2    HA   ILE  91           HA       ILE  91  11.955   9.002   7.146
    3    HB   ILE  91           HB       ILE  91  13.455   6.639   6.003
    4   HG12  ILE  91          HG12      ILE  91  11.457   6.836   8.276
    5   HG13  ILE  91          HG13      ILE  91  10.971   6.571   6.603
    6   HG22  ILE  91          HG21      ILE  91  13.938   6.405   8.640
    7   HG21  ILE  91          HG22      ILE  91  13.896   8.165   8.547
    8   HG23  ILE  91          HG23      ILE  91  15.050   7.258   7.571
    9   HD13  ILE  91          HD11      ILE  91  11.931   4.450   6.518
   10   HD12  ILE  91          HD12      ILE  91  11.350   4.513   8.182
   11   HD11  ILE  91          HD13      ILE  91  13.055   4.795   7.834

  No H/Q in entry =          11
  In of MODEL   14
    1    H    THR  92           H        THR  92  14.150   8.801   4.380
    2    HA   THR  92           HA       THR  92  16.350  10.147   5.531
    3    HB   THR  92           HB       THR  92  15.343  10.053   2.676
    4    HG1  THR  92           HG1      THR  92  16.140   8.138   3.068
    5   HG22  THR  92          HG21      THR  92  17.924  10.694   2.368
    6   HG21  THR  92          HG22      THR  92  17.642  11.515   3.903
    7   HG23  THR  92          HG23      THR  92  16.670  11.927   2.490

  No H/Q in entry =           7
  In of MODEL   14
    1    H    GLU  93           H        GLU  93  13.475  11.364   3.825
    2    HA   GLU  93           HA       GLU  93  14.124  14.112   3.946
    3    HB2  GLU  93           HB2      GLU  93  11.393  12.792   3.973
    4    HB3  GLU  93           HB3      GLU  93  11.712  14.487   3.606
    5    HG2  GLU  93           HG2      GLU  93  12.996  12.226   2.060
    6    HG3  GLU  93           HG3      GLU  93  11.460  12.940   1.586

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LEU  94           H        LEU  94  12.353  11.981   6.160
    2    HA   LEU  94           HA       LEU  94  11.594  13.935   8.050
    3    HB2  LEU  94           HB2      LEU  94  12.114  10.968   8.308
    4    HB3  LEU  94           HB3      LEU  94  11.570  11.949   9.666
    5    HG   LEU  94           HG       LEU  94  10.071  12.040   7.047
    6   HD11  LEU  94          HD11      LEU  94  10.123   9.810   9.042
    7   HD13  LEU  94          HD12      LEU  94   9.809   9.762   7.309
    8   HD12  LEU  94          HD13      LEU  94   8.548  10.298   8.417
    9   HD23  LEU  94          HD21      LEU  94   8.170  12.471   8.662
   10   HD22  LEU  94          HD22      LEU  94   9.433  13.700   8.695
   11   HD21  LEU  94          HD23      LEU  94   9.355  12.480   9.965

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  95           H        ILE  95  14.528  11.949   7.785
    2    HA   ILE  95           HA       ILE  95  15.730  12.838  10.195
    3    HB   ILE  95           HB       ILE  95  16.931  11.756   7.634
    4   HG12  ILE  95          HG12      ILE  95  16.630  10.549  10.399
    5   HG13  ILE  95          HG13      ILE  95  15.450  10.319   9.111
    6   HG21  ILE  95          HG21      ILE  95  18.219  12.527  10.271
    7   HG23  ILE  95          HG22      ILE  95  18.681  13.053   8.651
    8   HG22  ILE  95          HG23      ILE  95  18.958  11.385   9.151
    9   HD13  ILE  95          HD11      ILE  95  16.896   9.017   7.833
   10   HD12  ILE  95          HD12      ILE  95  17.371   8.552   9.464
   11   HD11  ILE  95          HD13      ILE  95  18.341   9.717   8.563

  No H/Q in entry =          11
  In of MODEL   14
    1    H    GLU  96           H        GLU  96  15.886  14.082   6.865
    2    HA   GLU  96           HA       GLU  96  17.776  16.122   7.337
    3    HB2  GLU  96           HB2      GLU  96  17.084  15.482   5.080
    4    HB3  GLU  96           HB3      GLU  96  15.454  16.070   5.394
    5    HG2  GLU  96           HG2      GLU  96  16.058  18.190   4.856
    6    HG3  GLU  96           HG3      GLU  96  17.364  18.160   6.030

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LEU  97           H        LEU  97  14.265  16.002   7.790
    2    HA   LEU  97           HA       LEU  97  13.906  18.741   8.445
    3    HB2  LEU  97           HB2      LEU  97  12.343  16.242   9.060
    4    HB3  LEU  97           HB3      LEU  97  11.865  17.796   9.741
    5    HG   LEU  97           HG       LEU  97  12.320  17.383   6.771
    6   HD12  LEU  97          HD11      LEU  97   9.793  17.305   6.670
    7   HD11  LEU  97          HD12      LEU  97   9.795  17.098   8.419
    8   HD13  LEU  97          HD13      LEU  97  10.545  15.880   7.387
    9   HD23  LEU  97          HD21      LEU  97  10.621  19.381   6.823
   10   HD22  LEU  97          HD22      LEU  97  12.311  19.706   7.206
   11   HD21  LEU  97          HD23      LEU  97  11.128  19.553   8.503

  No H/Q in entry =          11
  In of MODEL   14
    1    H    HIS  98           H        HIS  98  14.686  15.891  10.424
    2    HA   HIS  98           HA       HIS  98  14.570  17.144  12.946
    3    HB2  HIS  98           HB2      HIS  98  16.268  14.857  11.923
    4    HB3  HIS  98           HB3      HIS  98  16.288  15.388  13.607
    5    HD1  HIS  98           HD1      HIS  98  14.040  13.813  11.023
    6    HD2  HIS  98           HD2      HIS  98  13.979  14.718  15.092
    7    HE1  HIS  98           HE1      HIS  98  11.999  12.654  11.985
    8    HE2  HIS  98           HE2      HIS  98  11.941  13.197  14.458

  No H/Q in entry =           8
  In of MODEL   14
    1    H    GLU  99           H        GLU  99  17.104  16.989  10.493
    2    HA   GLU  99           HA       GLU  99  19.125  18.275  12.014
    3    HB2  GLU  99           HB2      GLU  99  19.565  16.987   9.937
    4    HB3  GLU  99           HB3      GLU  99  18.774  18.261   9.006
    5    HG2  GLU  99           HG2      GLU  99  20.420  19.896   9.793
    6    HG3  GLU  99           HG3      GLU  99  21.182  18.675  10.805

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LYS 100           H        LYS 100  16.610  19.496   9.820
    2    HA   LYS 100           HA       LYS 100  17.463  22.216   9.970
    3    HB2  LYS 100           HB2      LYS 100  14.800  20.983   9.228
    4    HB3  LYS 100           HB3      LYS 100  15.133  22.716   9.143
    5    HG2  LYS 100           HG2      LYS 100  17.086  22.234   7.660
    6    HG3  LYS 100           HG3      LYS 100  16.638  20.526   7.674
    7    HD2  LYS 100           HD2      LYS 100  14.447  21.083   6.691
    8    HD3  LYS 100           HD3      LYS 100  14.878  22.794   6.685
    9    HE2  LYS 100           HE2      LYS 100  16.817  22.280   5.210
   10    HE3  LYS 100           HE3      LYS 100  16.317  20.585   5.173
   11    HZ1  LYS 100           HZ1      LYS 100  14.531  22.818   4.359
   12    HZ3  LYS 100           HZ2      LYS 100  14.311  21.153   4.092
   13    HZ2  LYS 100           HZ3      LYS 100  15.533  21.995   3.266

  No H/Q in entry =          13
  In of MODEL   14
    1    H    LEU 101           H        LEU 101  15.338  20.204  11.941
    2    HA   LEU 101           HA       LEU 101  14.225  22.288  13.536
    3    HB2  LEU 101           HB2      LEU 101  14.610  19.329  13.904
    4    HB3  LEU 101           HB3      LEU 101  14.103  20.314  15.273
    5    HG   LEU 101           HG       LEU 101  12.669  20.442  12.614
    6   HD12  LEU 101          HD11      LEU 101  10.987  18.907  13.888
    7   HD11  LEU 101          HD12      LEU 101  12.380  18.461  14.872
    8   HD13  LEU 101          HD13      LEU 101  12.395  18.162  13.133
    9   HD21  LEU 101          HD21      LEU 101  12.048  21.236  15.474
   10   HD23  LEU 101          HD22      LEU 101  10.774  21.041  14.272
   11   HD22  LEU 101          HD23      LEU 101  12.032  22.252  14.031

  No H/Q in entry =          11
  In of MODEL   14
    1    H    LYS 102           H        LYS 102  17.356  21.619  13.075
    2    HA   LYS 102           HA       LYS 102  19.227  22.448  14.138
    3    HB2  LYS 102           HB2      LYS 102  17.452  23.994  15.290
    4    HB3  LYS 102           HB3      LYS 102  17.647  22.922  16.661
    5    HG2  LYS 102           HG2      LYS 102  19.572  24.899  15.487
    6    HG3  LYS 102           HG3      LYS 102  19.196  24.585  17.168
    7    HD2  LYS 102           HD2      LYS 102  20.812  22.647  15.462
    8    HD3  LYS 102           HD3      LYS 102  21.534  23.950  16.396
    9    HE2  LYS 102           HE2      LYS 102  21.091  21.406  17.356
   10    HE3  LYS 102           HE3      LYS 102  21.346  22.839  18.352
   11    HZ2  LYS 102           HZ1      LYS 102  19.356  21.593  18.979
   12    HZ1  LYS 102           HZ2      LYS 102  18.706  21.842  17.435
   13    HZ3  LYS 102           HZ3      LYS 102  18.970  23.163  18.465

  No H/Q in entry =          13
  In of MODEL   14
    1    H    ALA 103           H        ALA 103  17.140  20.874  16.568
    2    HA   ALA 103           HA       ALA 103  18.854  19.621  18.205
    3    HB2  ALA 103           HB1      ALA 103  17.229  17.647  18.202
    4    HB1  ALA 103           HB2      ALA 103  16.342  18.524  16.955
    5    HB3  ALA 103           HB3      ALA 103  16.546  19.234  18.555

  No H/Q in entry =           5
  In of MODEL   14
    1    H1   ALA   1           H3       ALA   1  -1.894  -6.646 -21.388
    2    H2   ALA   1           H2       ALA   1  -2.715  -8.067 -20.936
    3    H3   ALA   1           H1       ALA   1  -1.113  -8.147 -21.502
    4    HA   ALA   1           HA       ALA   1  -1.969  -8.590 -23.494
    5    HB1  ALA   1           HB1      ALA   1  -4.118  -9.266 -23.009
    6    HB2  ALA   1           HB2      ALA   1  -4.530  -7.743 -23.797
    7    HB3  ALA   1           HB3      ALA   1  -4.459  -7.832 -22.039

  No H/Q in entry =           7
  In of MODEL   14
    1    H    GLU   2           H        GLU   2  -2.788  -7.374 -25.473
    2    HA   GLU   2           HA       GLU   2  -1.353  -5.386 -26.351
    3    HB2  GLU   2           HB2      GLU   2  -4.363  -5.389 -26.648
    4    HB3  GLU   2           HB3      GLU   2  -3.232  -4.545 -27.702
    5    HG2  GLU   2           HG2      GLU   2  -2.776  -6.439 -28.868
    6    HG3  GLU   2           HG3      GLU   2  -2.488  -7.358 -27.397

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLU   3           H        GLU   3  -4.481  -4.067 -25.424
    2    HA   GLU   3           HA       GLU   3  -3.377  -1.536 -24.792
    3    HB2  GLU   3           HB2      GLU   3  -6.089  -2.796 -24.447
    4    HB3  GLU   3           HB3      GLU   3  -5.753  -1.190 -23.795
    5    HG2  GLU   3           HG2      GLU   3  -5.392  -0.262 -25.920
    6    HG3  GLU   3           HG3      GLU   3  -5.034  -1.821 -26.654

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LEU   4           H        LEU   4  -5.002  -3.872 -22.611
    2    HA   LEU   4           HA       LEU   4  -4.595  -2.662 -20.217
    3    HB2  LEU   4           HB2      LEU   4  -4.117  -5.612 -20.704
    4    HB3  LEU   4           HB3      LEU   4  -4.497  -4.864 -19.154
    5    HG   LEU   4           HG       LEU   4  -6.287  -4.890 -21.606
    6   HD13  LEU   4          HD11      LEU   4  -7.510  -6.586 -20.608
    7   HD12  LEU   4          HD12      LEU   4  -7.004  -6.145 -18.978
    8   HD11  LEU   4          HD13      LEU   4  -5.893  -7.007 -20.041
    9   HD23  LEU   4          HD21      LEU   4  -7.942  -4.052 -19.723
   10   HD22  LEU   4          HD22      LEU   4  -6.885  -2.899 -20.536
   11   HD21  LEU   4          HD23      LEU   4  -6.460  -3.505 -18.936

  No H/Q in entry =          11
  In of MODEL   14
    1    H    GLU   5           H        GLU   5  -2.148  -4.549 -21.973
    2    HA   GLU   5           HA       GLU   5  -0.145  -4.316 -19.949
    3    HB2  GLU   5           HB2      GLU   5  -0.151  -6.073 -21.732
    4    HB3  GLU   5           HB3      GLU   5   0.230  -4.821 -22.914
    5    HG2  GLU   5           HG2      GLU   5   2.308  -5.851 -22.266
    6    HG3  GLU   5           HG3      GLU   5   2.265  -4.252 -21.525

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLU   6           H        GLU   6  -0.765  -2.576 -22.982
    2    HA   GLU   6           HA       GLU   6   1.445  -0.791 -22.720
    3    HB2  GLU   6           HB2      GLU   6   0.312  -1.229 -24.879
    4    HB3  GLU   6           HB3      GLU   6  -1.138  -0.437 -24.262
    5    HG2  GLU   6           HG2      GLU   6   0.120   1.654 -23.951
    6    HG3  GLU   6           HG3      GLU   6   1.584   0.868 -24.538

  No H/Q in entry =           6
  In of MODEL   14
    1    H    VAL   7           H        VAL   7  -1.887  -0.797 -21.653
    2    HA   VAL   7           HA       VAL   7  -2.046   1.915 -20.803
    3    HB   VAL   7           HB       VAL   7  -3.555  -0.575 -19.968
    4   HG11  VAL   7          HG11      VAL   7  -3.864   2.317 -19.139
    5   HG13  VAL   7          HG12      VAL   7  -3.788   0.886 -18.111
    6   HG12  VAL   7          HG13      VAL   7  -5.221   1.190 -19.092
    7   HG21  VAL   7          HG21      VAL   7  -3.705   0.515 -22.351
    8   HG23  VAL   7          HG22      VAL   7  -4.619   1.780 -21.527
    9   HG22  VAL   7          HG23      VAL   7  -5.200   0.114 -21.504

  No H/Q in entry =           9
  In of MODEL   14
    1    H    VAL   8           H        VAL   8  -1.111  -1.098 -19.180
    2    HA   VAL   8           HA       VAL   8  -0.752  -0.037 -16.582
    3    HB   VAL   8           HB       VAL   8   0.587  -2.377 -17.961
    4   HG12  VAL   8          HG11      VAL   8   1.073  -3.072 -15.556
    5   HG11  VAL   8          HG12      VAL   8   0.663  -1.422 -15.087
    6   HG13  VAL   8          HG13      VAL   8   2.029  -1.718 -16.162
    7   HG21  VAL   8          HG21      VAL   8  -2.053  -2.113 -17.236
    8   HG23  VAL   8          HG22      VAL   8  -1.364  -2.753 -15.747
    9   HG22  VAL   8          HG23      VAL   8  -1.203  -3.656 -17.249

  No H/Q in entry =           9
  In of MODEL   14
    1    H    MET   9           H        MET   9   1.471  -0.372 -19.346
    2    HA   MET   9           HA       MET   9   3.787   0.616 -18.096
    3    HB2  MET   9           HB2      MET   9   2.821   0.682 -20.953
    4    HB3  MET   9           HB3      MET   9   4.359   1.404 -20.481
    5    HG2  MET   9           HG2      MET   9   5.089  -0.756 -19.538
    6    HG3  MET   9           HG3      MET   9   3.550  -1.480 -20.007
    7    HE2  MET   9           HE1      MET   9   7.221  -0.935 -21.194
    8    HE1  MET   9           HE2      MET   9   6.428   0.635 -21.084
    9    HE3  MET   9           HE3      MET   9   6.949   0.027 -22.652

  No H/Q in entry =           9
  In of MODEL   14
    1    H    GLY  10           H        GLY  10   1.127   2.283 -19.747
    2    HA3  GLY  10           HA2      GLY  10   2.149   4.914 -19.497
    3    HA2  GLY  10           HA3      GLY  10   0.449   4.492 -19.692

  No H/Q in entry =           3
  In of MODEL   14
    1    H    LEU  11           H        LEU  11   0.032   2.963 -17.411
    2    HA   LEU  11           HA       LEU  11  -0.441   4.942 -15.438
    3    HB2  LEU  11           HB2      LEU  11  -0.439   1.925 -15.296
    4    HB3  LEU  11           HB3      LEU  11  -0.916   2.952 -13.946
    5    HG   LEU  11           HG       LEU  11  -2.171   3.106 -16.699
    6   HD13  LEU  11          HD11      LEU  11  -2.796   0.973 -15.950
    7   HD12  LEU  11          HD12      LEU  11  -4.121   1.991 -15.390
    8   HD11  LEU  11          HD13      LEU  11  -2.868   1.478 -14.261
    9   HD22  LEU  11          HD21      LEU  11  -2.710   5.130 -15.679
   10   HD21  LEU  11          HD22      LEU  11  -2.638   4.454 -14.052
   11   HD23  LEU  11          HD23      LEU  11  -4.028   4.124 -15.086

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  12           H        ILE  12   2.045   2.421 -15.710
    2    HA   ILE  12           HA       ILE  12   3.280   2.919 -13.213
    3    HB   ILE  12           HB       ILE  12   4.496   1.866 -15.789
    4   HG12  ILE  12          HG12      ILE  12   2.458   0.678 -14.633
    5   HG13  ILE  12          HG13      ILE  12   3.827  -0.287 -15.151
    6   HG21  ILE  12          HG21      ILE  12   5.481   1.788 -12.918
    7   HG23  ILE  12          HG22      ILE  12   6.278   2.541 -14.300
    8   HG22  ILE  12          HG23      ILE  12   6.145   0.786 -14.206
    9   HD12  ILE  12          HD11      ILE  12   2.999  -0.847 -12.862
   10   HD11  ILE  12          HD12      ILE  12   3.416   0.787 -12.348
   11   HD13  ILE  12          HD13      ILE  12   4.671  -0.316 -12.869

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  13           H        ILE  13   3.886   4.185 -16.469
    2    HA   ILE  13           HA       ILE  13   6.066   5.853 -15.752
    3    HB   ILE  13           HB       ILE  13   4.023   5.982 -17.982
    4   HG12  ILE  13          HG12      ILE  13   5.835   4.114 -17.725
    5   HG13  ILE  13          HG13      ILE  13   5.591   4.867 -19.298
    6   HG22  ILE  13          HG21      ILE  13   5.940   7.499 -19.008
    7   HG21  ILE  13          HG22      ILE  13   6.280   7.853 -17.318
    8   HG23  ILE  13          HG23      ILE  13   4.690   8.212 -17.988
    9   HD11  ILE  13          HD11      ILE  13   7.689   5.852 -17.335
   10   HD13  ILE  13          HD12      ILE  13   7.530   6.242 -19.043
   11   HD12  ILE  13          HD13      ILE  13   8.017   4.624 -18.556

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ASN  14           H        ASN  14   2.570   6.427 -15.991
    2    HA   ASN  14           HA       ASN  14   2.593   9.171 -15.341
    3    HB2  ASN  14           HB2      ASN  14   0.658   7.575 -16.165
    4    HB3  ASN  14           HB3      ASN  14   0.345   7.396 -14.443
    5   HD21  ASN  14          HD21      ASN  14  -1.659   8.603 -15.855
    6   HD22  ASN  14          HD22      ASN  14  -1.682  10.276 -15.579

  No H/Q in entry =           6
  In of MODEL   14
    1    H    SER  15           H        SER  15   2.250   6.291 -13.276
    2    HA   SER  15           HA       SER  15   1.991   7.656 -10.819
    3    HB2  SER  15           HB2      SER  15   2.501   5.554  -9.783
    4    HB3  SER  15           HB3      SER  15   1.654   5.160 -11.275
    5    HG   SER  15           HG       SER  15   4.382   4.954 -10.650

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLY  16           H        GLY  16   4.829   6.505 -12.604
    2    HA3  GLY  16           HA2      GLY  16   6.785   7.210 -10.685
    3    HA2  GLY  16           HA3      GLY  16   7.070   7.009 -12.412

  No H/Q in entry =           3
  In of MODEL   14
    1    H    GLN  17           H        GLN  17   5.416   9.008 -13.453
    2    HA   GLN  17           HA       GLN  17   7.046  11.313 -13.146
    3    HB2  GLN  17           HB2      GLN  17   4.280  10.945 -14.329
    4    HB3  GLN  17           HB3      GLN  17   5.166  12.470 -14.396
    5    HG2  GLN  17           HG2      GLN  17   6.220   9.835 -15.459
    6    HG3  GLN  17           HG3      GLN  17   5.464  11.079 -16.453
    7   HE21  GLN  17          HE21      GLN  17   6.698  12.990 -16.940
    8   HE22  GLN  17          HE22      GLN  17   8.332  13.150 -16.504

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ALA  18           H        ALA  18   3.935  10.356 -11.778
    2    HA   ALA  18           HA       ALA  18   3.270  12.753 -10.496
    3    HB1  ALA  18           HB1      ALA  18   2.087  10.322 -10.721
    4    HB2  ALA  18           HB2      ALA  18   1.573  11.548  -9.564
    5    HB3  ALA  18           HB3      ALA  18   2.640  10.240  -9.048

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ARG  19           H        ARG  19   5.094   9.945  -9.244
    2    HA   ARG  19           HA       ARG  19   5.670  11.080  -6.720
    3    HB2  ARG  19           HB2      ARG  19   6.030   8.671  -7.261
    4    HB3  ARG  19           HB3      ARG  19   7.388   9.134  -8.291
    5    HG2  ARG  19           HG2      ARG  19   8.543  10.141  -6.372
    6    HG3  ARG  19           HG3      ARG  19   7.167   9.777  -5.332
    7    HD2  ARG  19           HD2      ARG  19   8.898   8.103  -4.995
    8    HD3  ARG  19           HD3      ARG  19   7.501   7.354  -5.774
    9    HE   ARG  19           HE       ARG  19   9.208   8.147  -7.830
   10   HH21  ARG  19          HH11      ARG  19  10.732   6.714  -8.698
   11   HH22  ARG  19          HH12      ARG  19  11.257   5.350  -7.773
   12   HH11  ARG  19          HH21      ARG  19   9.258   6.102  -5.061
   13   HH12  ARG  19          HH22      ARG  19  10.419   5.004  -5.713

  No H/Q in entry =          13
  In of MODEL   14
    1    H    SER  20           H        SER  20   7.465  11.086  -9.783
    2    HA   SER  20           HA       SER  20   9.744  12.452  -8.969
    3    HB2  SER  20           HB2      SER  20   9.741  11.585 -11.177
    4    HB3  SER  20           HB3      SER  20   8.256  12.436 -11.590
    5    HG   SER  20           HG       SER  20  10.795  13.577 -11.021

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU  21           H        LEU  21   6.663  13.789 -10.137
    2    HA   LEU  21           HA       LEU  21   7.390  16.520  -9.905
    3    HB2  LEU  21           HB2      LEU  21   4.694  15.149  -9.812
    4    HB3  LEU  21           HB3      LEU  21   4.896  16.899  -9.809
    5    HG   LEU  21           HG       LEU  21   6.044  15.093 -11.957
    6   HD11  LEU  21          HD11      LEU  21   3.391  16.524 -11.759
    7   HD13  LEU  21          HD12      LEU  21   3.700  14.839 -12.180
    8   HD12  LEU  21          HD13      LEU  21   4.109  16.121 -13.318
    9   HD23  LEU  21          HD21      LEU  21   5.860  17.420 -13.187
   10   HD22  LEU  21          HD22      LEU  21   7.217  17.147 -12.099
   11   HD21  LEU  21          HD23      LEU  21   5.836  18.086 -11.557

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ALA  22           H        ALA  22   5.849  14.250  -7.656
    2    HA   ALA  22           HA       ALA  22   5.297  16.060  -5.577
    3    HB3  ALA  22           HB1      ALA  22   4.488  13.683  -5.745
    4    HB2  ALA  22           HB2      ALA  22   5.098  14.136  -4.153
    5    HB1  ALA  22           HB3      ALA  22   6.094  13.163  -5.236

  No H/Q in entry =           5
  In of MODEL   14
    1    H    TYR  23           H        TYR  23   8.188  13.979  -6.046
    2    HA   TYR  23           HA       TYR  23   9.607  14.961  -3.800
    3    HB2  TYR  23           HB2      TYR  23  10.346  12.944  -4.972
    4    HB3  TYR  23           HB3      TYR  23  10.668  13.883  -6.430
    5    HD1  TYR  23           HD1      TYR  23  11.660  13.483  -2.856
    6    HD2  TYR  23           HD2      TYR  23  12.713  15.044  -6.718
    7    HE1  TYR  23           HE1      TYR  23  13.935  14.013  -2.022
    8    HE2  TYR  23           HE2      TYR  23  14.987  15.575  -5.883
    9    HH   TYR  23           HH       TYR  23  15.998  14.665  -2.600

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ALA  24           H        ALA  24   9.420  16.087  -7.159
    2    HA   ALA  24           HA       ALA  24  11.357  18.135  -6.918
    3    HB2  ALA  24           HB1      ALA  24  10.899  18.216  -9.123
    4    HB3  ALA  24           HB2      ALA  24   9.361  18.993  -8.749
    5    HB1  ALA  24           HB3      ALA  24   9.453  17.238  -8.887

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA  25           H        ALA  25   7.880  18.012  -6.272
    2    HA   ALA  25           HA       ALA  25   7.454  20.736  -5.687
    3    HB1  ALA  25           HB1      ALA  25   5.755  18.769  -5.884
    4    HB2  ALA  25           HB2      ALA  25   5.420  20.059  -4.727
    5    HB3  ALA  25           HB3      ALA  25   6.086  18.523  -4.169

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU  26           H        LEU  26   8.489  18.028  -3.657
    2    HA   LEU  26           HA       LEU  26   8.638  19.446  -1.214
    3    HB2  LEU  26           HB2      LEU  26   8.689  17.028  -1.220
    4    HB3  LEU  26           HB3      LEU  26  10.152  17.014  -2.202
    5    HG   LEU  26           HG       LEU  26  11.401  18.101  -0.366
    6   HD12  LEU  26          HD11      LEU  26  10.192  18.121   1.903
    7   HD11  LEU  26          HD12      LEU  26   8.695  18.014   0.979
    8   HD13  LEU  26          HD13      LEU  26   9.763  19.402   0.768
    9   HD21  LEU  26          HD21      LEU  26   9.830  15.657   0.508
   10   HD23  LEU  26          HD22      LEU  26  11.360  16.189   1.196
   11   HD22  LEU  26          HD23      LEU  26  11.292  15.639  -0.476

  No H/Q in entry =          11
  In of MODEL   14
    1    H    LYS  27           H        LYS  27  11.025  18.842  -3.760
    2    HA   LYS  27           HA       LYS  27  13.240  20.039  -2.543
    3    HB2  LYS  27           HB2      LYS  27  13.302  18.699  -4.639
    4    HB3  LYS  27           HB3      LYS  27  12.554  20.048  -5.493
    5    HG2  LYS  27           HG2      LYS  27  14.449  21.498  -4.923
    6    HG3  LYS  27           HG3      LYS  27  15.194  20.189  -3.998
    7    HD2  LYS  27           HD2      LYS  27  15.298  18.808  -6.059
    8    HD3  LYS  27           HD3      LYS  27  14.599  20.143  -6.976
    9    HE2  LYS  27           HE2      LYS  27  16.516  21.573  -6.372
   10    HE3  LYS  27           HE3      LYS  27  17.219  20.243  -5.445
   11    HZ3  LYS  27           HZ1      LYS  27  18.194  20.335  -7.639
   12    HZ2  LYS  27           HZ2      LYS  27  16.660  20.246  -8.368
   13    HZ1  LYS  27           HZ3      LYS  27  17.267  18.921  -7.494

  No H/Q in entry =          13
  In of MODEL   14
    1    H    GLN  28           H        GLN  28  10.627  21.474  -4.466
    2    HA   GLN  28           HA       GLN  28  11.631  24.110  -4.615
    3    HB2  GLN  28           HB2      GLN  28   8.780  23.091  -4.483
    4    HB3  GLN  28           HB3      GLN  28   9.222  24.756  -4.860
    5    HG2  GLN  28           HG2      GLN  28  10.160  22.327  -6.415
    6    HG3  GLN  28           HG3      GLN  28   8.840  23.386  -6.907
    7   HE21  GLN  28          HE21      GLN  28  11.966  22.835  -7.659
    8   HE22  GLN  28          HE22      GLN  28  12.476  24.410  -8.033

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ALA  29           H        ALA  29   9.689  22.440  -2.171
    2    HA   ALA  29           HA       ALA  29   9.189  24.634  -0.476
    3    HB2  ALA  29           HB1      ALA  29   8.446  23.071   1.091
    4    HB1  ALA  29           HB2      ALA  29   9.643  21.868   0.612
    5    HB3  ALA  29           HB3      ALA  29   8.254  22.190  -0.425

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LYS  30           H        LYS  30  11.880  22.321  -0.576
    2    HA   LYS  30           HA       LYS  30  13.231  23.243   1.721
    3    HB2  LYS  30           HB2      LYS  30  14.287  21.950  -0.803
    4    HB3  LYS  30           HB3      LYS  30  15.286  22.286   0.613
    5    HG2  LYS  30           HG2      LYS  30  13.720  20.923   1.998
    6    HG3  LYS  30           HG3      LYS  30  12.817  20.523   0.533
    7    HD2  LYS  30           HD2      LYS  30  14.838  19.507  -0.448
    8    HD3  LYS  30           HD3      LYS  30  15.760  19.921   0.999
    9    HE2  LYS  30           HE2      LYS  30  14.242  18.509   2.359
   10    HE3  LYS  30           HE3      LYS  30  13.349  18.074   0.896
   11    HZ2  LYS  30           HZ1      LYS  30  15.120  16.463   1.636
   12    HZ1  LYS  30           HZ2      LYS  30  16.273  17.633   1.181
   13    HZ3  LYS  30           HZ3      LYS  30  15.217  16.972   0.021

  No H/Q in entry =          13
  In of MODEL   14
    1    H    GLN  31           H        GLN  31  13.118  24.464  -1.569
    2    HA   GLN  31           HA       GLN  31  15.305  26.319  -1.156
    3    HB2  GLN  31           HB2      GLN  31  13.246  26.410  -3.365
    4    HB3  GLN  31           HB3      GLN  31  14.878  27.078  -3.375
    5    HG2  GLN  31           HG2      GLN  31  15.299  24.372  -2.815
    6    HG3  GLN  31           HG3      GLN  31  13.985  24.345  -3.984
    7   HE21  GLN  31          HE21      GLN  31  16.812  23.507  -4.413
    8   HE22  GLN  31          HE22      GLN  31  17.391  24.476  -5.679

  No H/Q in entry =           8
  In of MODEL   14
    1    H    GLY  32           H        GLY  32  12.237  26.183   0.012
    2    HA3  GLY  32           HA2      GLY  32  11.117  27.764   1.301
    3    HA2  GLY  32           HA3      GLY  32  12.258  28.983   0.747

  No H/Q in entry =           3
  In of MODEL   14
    1    H    ASP  33           H        ASP  33  10.843  27.113  -1.743
    2    HA   ASP  33           HA       ASP  33   9.211  29.417  -2.575
    3    HB2  ASP  33           HB2      ASP  33  10.252  26.987  -4.037
    4    HB3  ASP  33           HB3      ASP  33   9.114  28.124  -4.753

  No H/Q in entry =           4
  In of MODEL   14
    1    H    PHE  34           H        PHE  34   7.526  28.963  -1.001
    2    HA   PHE  34           HA       PHE  34   6.107  26.514  -0.905
    3    HB2  PHE  34           HB2      PHE  34   5.198  29.313  -0.206
    4    HB3  PHE  34           HB3      PHE  34   4.327  27.835   0.205
    5    HD1  PHE  34           HD1      PHE  34   6.626  30.191   1.413
    6    HD2  PHE  34           HD2      PHE  34   5.875  25.962   1.346
    7    HE1  PHE  34           HE1      PHE  34   8.028  29.908   3.437
    8    HE2  PHE  34           HE2      PHE  34   7.279  25.683   3.369
    9    HZ   PHE  34           HZ       PHE  34   8.349  27.657   4.414

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ALA  35           H        ALA  35   5.709  29.393  -2.900
    2    HA   ALA  35           HA       ALA  35   3.140  28.826  -3.908
    3    HB1  ALA  35           HB1      ALA  35   4.199  30.209  -5.948
    4    HB3  ALA  35           HB2      ALA  35   5.432  30.545  -4.732
    5    HB2  ALA  35           HB3      ALA  35   3.750  30.981  -4.427

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA  36           H        ALA  36   6.346  28.105  -5.290
    2    HA   ALA  36           HA       ALA  36   5.317  26.703  -7.532
    3    HB3  ALA  36           HB1      ALA  36   7.473  26.794  -8.164
    4    HB2  ALA  36           HB2      ALA  36   7.947  25.751  -6.822
    5    HB1  ALA  36           HB3      ALA  36   7.872  27.500  -6.598

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA  37           H        ALA  37   6.281  25.678  -4.289
    2    HA   ALA  37           HA       ALA  37   6.173  22.893  -4.730
    3    HB2  ALA  37           HB1      ALA  37   5.960  24.678  -2.342
    4    HB1  ALA  37           HB2      ALA  37   7.069  23.343  -2.649
    5    HB3  ALA  37           HB3      ALA  37   5.405  23.014  -2.166

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LYS  38           H        LYS  38   3.686  25.137  -3.533
    2    HA   LYS  38           HA       LYS  38   1.559  23.358  -3.302
    3    HB2  LYS  38           HB2      LYS  38   1.957  26.107  -3.042
    4    HB3  LYS  38           HB3      LYS  38   0.746  25.985  -4.312
    5    HG2  LYS  38           HG2      LYS  38  -0.714  24.679  -2.864
    6    HG3  LYS  38           HG3      LYS  38   0.539  24.593  -1.617
    7    HD2  LYS  38           HD2      LYS  38   0.395  26.931  -1.159
    8    HD3  LYS  38           HD3      LYS  38  -0.524  27.241  -2.633
    9    HE2  LYS  38           HE2      LYS  38  -2.011  27.291  -0.681
   10    HE3  LYS  38           HE3      LYS  38  -2.416  25.926  -1.726
   11    HZ3  LYS  38           HZ1      LYS  38  -1.703  24.437  -0.205
   12    HZ2  LYS  38           HZ2      LYS  38  -2.025  25.695   0.892
   13    HZ1  LYS  38           HZ3      LYS  38  -0.439  25.420   0.353

  No H/Q in entry =          13
  In of MODEL   14
    1    H    ALA  39           H        ALA  39   2.547  25.257  -6.150
    2    HA   ALA  39           HA       ALA  39   0.445  24.431  -7.840
    3    HB2  ALA  39           HB1      ALA  39   3.183  25.039  -8.912
    4    HB1  ALA  39           HB2      ALA  39   2.243  26.313  -8.134
    5    HB3  ALA  39           HB3      ALA  39   1.606  25.492  -9.559

  No H/Q in entry =           5
  In of MODEL   14
    1    H    MET  40           H        MET  40   3.665  23.077  -7.292
    2    HA   MET  40           HA       MET  40   3.519  21.067  -9.291
    3    HB2  MET  40           HB2      MET  40   5.154  21.254  -6.754
    4    HB3  MET  40           HB3      MET  40   5.374  19.999  -7.976
    5    HG2  MET  40           HG2      MET  40   5.475  22.957  -8.629
    6    HG3  MET  40           HG3      MET  40   6.910  22.028  -8.195
    7    HE3  MET  40           HE1      MET  40   7.724  19.812 -11.019
    8    HE2  MET  40           HE2      MET  40   7.168  19.494  -9.379
    9    HE1  MET  40           HE3      MET  40   8.283  20.825  -9.681

  No H/Q in entry =           9
  In of MODEL   14
    1    H    MET  41           H        MET  41   2.631  21.109  -5.860
    2    HA   MET  41           HA       MET  41   2.056  18.353  -5.590
    3    HB2  MET  41           HB2      MET  41   0.772  20.725  -4.218
    4    HB3  MET  41           HB3      MET  41   0.593  19.048  -3.717
    5    HG2  MET  41           HG2      MET  41   3.307  19.227  -3.774
    6    HG3  MET  41           HG3      MET  41   2.896  20.891  -3.367
    7    HE2  MET  41           HE1      MET  41  -0.150  19.680  -1.624
    8    HE1  MET  41           HE2      MET  41   0.688  21.181  -2.001
    9    HE3  MET  41           HE3      MET  41   0.632  20.604  -0.335

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ASP  42           H        ASP  42   0.055  21.114  -6.536
    2    HA   ASP  42           HA       ASP  42  -2.409  19.793  -6.660
    3    HB2  ASP  42           HB2      ASP  42  -1.663  22.353  -6.911
    4    HB3  ASP  42           HB3      ASP  42  -1.833  21.968  -8.620

  No H/Q in entry =           4
  In of MODEL   14
    1    H    GLN  43           H        GLN  43   0.022  20.356  -9.178
    2    HA   GLN  43           HA       GLN  43  -1.402  19.068 -11.262
    3    HB2  GLN  43           HB2      GLN  43   1.567  19.536 -10.901
    4    HB3  GLN  43           HB3      GLN  43   0.832  18.914 -12.381
    5    HG2  GLN  43           HG2      GLN  43  -0.647  20.965 -12.402
    6    HG3  GLN  43           HG3      GLN  43   0.326  21.600 -11.079
    7   HE21  GLN  43          HE21      GLN  43   0.497  23.227 -13.159
    8   HE22  GLN  43          HE22      GLN  43   1.901  22.987 -14.078

  No H/Q in entry =           8
  In of MODEL   14
    1    H    SER  44           H        SER  44   0.949  17.880  -8.895
    2    HA   SER  44           HA       SER  44   1.234  15.273  -9.934
    3    HB2  SER  44           HB2      SER  44   2.169  16.688  -7.698
    4    HB3  SER  44           HB3      SER  44   1.290  15.315  -7.027
    5    HG   SER  44           HG       SER  44   3.387  14.664  -7.472

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ARG  45           H        ARG  45  -1.047  16.618  -7.572
    2    HA   ARG  45           HA       ARG  45  -2.465  14.276  -6.937
    3    HB2  ARG  45           HB2      ARG  45  -2.620  16.442  -5.734
    4    HB3  ARG  45           HB3      ARG  45  -3.476  17.128  -7.112
    5    HG2  ARG  45           HG2      ARG  45  -5.267  15.429  -6.822
    6    HG3  ARG  45           HG3      ARG  45  -4.422  14.797  -5.409
    7    HD2  ARG  45           HD2      ARG  45  -4.585  17.062  -4.341
    8    HD3  ARG  45           HD3      ARG  45  -5.574  17.604  -5.714
    9    HE   ARG  45           HE       ARG  45  -6.713  15.240  -4.675
   10   HH21  ARG  45          HH11      ARG  45  -8.538  15.339  -3.390
   11   HH22  ARG  45          HH12      ARG  45  -8.904  16.780  -2.512
   12   HH11  ARG  45          HH21      ARG  45  -6.109  18.474  -3.642
   13   HH12  ARG  45          HH22      ARG  45  -7.523  18.556  -2.653

  No H/Q in entry =          13
  In of MODEL   14
    1    H    MET  46           H        MET  46  -3.031  16.700  -9.473
    2    HA   MET  46           HA       MET  46  -5.396  15.569 -10.522
    3    HB2  MET  46           HB2      MET  46  -3.283  17.393 -11.667
    4    HB3  MET  46           HB3      MET  46  -4.633  16.827 -12.657
    5    HG2  MET  46           HG2      MET  46  -6.238  17.855 -11.246
    6    HG3  MET  46           HG3      MET  46  -5.074  18.087  -9.948
    7    HE3  MET  46           HE1      MET  46  -3.589  18.680 -13.463
    8    HE2  MET  46           HE2      MET  46  -4.433  20.122 -14.015
    9    HE1  MET  46           HE3      MET  46  -5.333  18.630 -13.749

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ALA  47           H        ALA  47  -1.981  15.041 -11.308
    2    HA   ALA  47           HA       ALA  47  -2.369  13.328 -13.523
    3    HB3  ALA  47           HB1      ALA  47  -0.176  14.183 -13.184
    4    HB2  ALA  47           HB2      ALA  47  -0.058  12.452 -12.858
    5    HB1  ALA  47           HB3      ALA  47  -0.124  13.599 -11.520

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU  48           H        LEU  48  -2.083  12.673 -10.054
    2    HA   LEU  48           HA       LEU  48  -2.221   9.836 -10.224
    3    HB2  LEU  48           HB2      LEU  48  -2.940  11.755  -7.996
    4    HB3  LEU  48           HB3      LEU  48  -2.871  10.003  -7.803
    5    HG   LEU  48           HG       LEU  48  -0.554  11.672  -8.811
    6   HD13  LEU  48          HD11      LEU  48  -0.809  12.437  -6.615
    7   HD12  LEU  48          HD12      LEU  48   0.336  11.111  -6.431
    8   HD11  LEU  48          HD13      LEU  48  -1.363  10.872  -6.021
    9   HD22  LEU  48          HD21      LEU  48  -0.093   9.482  -9.465
   10   HD21  LEU  48          HD22      LEU  48  -0.963   8.774  -8.105
   11   HD23  LEU  48          HD23      LEU  48   0.623   9.502  -7.854

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ASN  49           H        ASN  49  -4.644  12.363  -9.793
    2    HA   ASN  49           HA       ASN  49  -6.850  10.729  -9.244
    3    HB2  ASN  49           HB2      ASN  49  -6.854  13.157  -8.915
    4    HB3  ASN  49           HB3      ASN  49  -6.729  13.412 -10.652
    5   HD21  ASN  49          HD21      ASN  49  -8.784  14.558 -10.683
    6   HD22  ASN  49          HD22      ASN  49 -10.254  13.732 -10.506

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLU  50           H        GLU  50  -5.576  11.920 -12.336
    2    HA   GLU  50           HA       GLU  50  -7.561  10.701 -13.972
    3    HB2  GLU  50           HB2      GLU  50  -6.074  12.502 -14.790
    4    HB3  GLU  50           HB3      GLU  50  -4.695  11.408 -14.666
    5    HG2  GLU  50           HG2      GLU  50  -5.704   9.895 -16.302
    6    HG3  GLU  50           HG3      GLU  50  -7.150  10.895 -16.375

  No H/Q in entry =           6
  In of MODEL   14
    1    H    ALA  51           H        ALA  51  -4.397   9.656 -12.794
    2    HA   ALA  51           HA       ALA  51  -4.305   7.208 -14.224
    3    HB2  ALA  51           HB1      ALA  51  -2.320   6.885 -13.140
    4    HB1  ALA  51           HB2      ALA  51  -2.990   7.311 -11.565
    5    HB3  ALA  51           HB3      ALA  51  -2.524   8.580 -12.698

  No H/Q in entry =           5
  In of MODEL   14
    1    H    HIS  52           H        HIS  52  -5.441   8.043 -10.963
    2    HA   HIS  52           HA       HIS  52  -6.160   5.440 -10.137
    3    HB2  HIS  52           HB2      HIS  52  -5.979   7.397  -8.622
    4    HB3  HIS  52           HB3      HIS  52  -7.437   8.070  -9.352
    5    HD1  HIS  52           HD1      HIS  52  -9.681   6.698  -8.997
    6    HD2  HIS  52           HD2      HIS  52  -6.439   5.363  -6.743
    7    HE1  HIS  52           HE1      HIS  52 -10.630   5.176  -7.208
    8    HE2  HIS  52           HE2      HIS  52  -8.665   4.353  -5.826

  No H/Q in entry =           8
  In of MODEL   14
    1    H    LEU  53           H        LEU  53  -7.955   7.933 -11.902
    2    HA   LEU  53           HA       LEU  53 -10.480   6.680 -11.901
    3    HB2  LEU  53           HB2      LEU  53  -9.180   8.648 -13.774
    4    HB3  LEU  53           HB3      LEU  53 -10.792   8.011 -14.084
    5    HG   LEU  53           HG       LEU  53 -10.038   9.295 -11.441
    6   HD13  LEU  53          HD11      LEU  53  -9.708  10.995 -13.124
    7   HD12  LEU  53          HD12      LEU  53 -11.264  11.305 -12.352
    8   HD11  LEU  53          HD13      LEU  53 -11.200  10.547 -13.940
    9   HD21  LEU  53          HD21      LEU  53 -12.623   8.494 -12.787
   10   HD23  LEU  53          HD22      LEU  53 -12.603   9.744 -11.550
   11   HD22  LEU  53          HD23      LEU  53 -12.090   8.115 -11.155

  No H/Q in entry =          11
  In of MODEL   14
    1    H    VAL  54           H        VAL  54  -7.749   6.450 -14.159
    2    HA   VAL  54           HA       VAL  54  -9.013   4.706 -16.001
    3    HB   VAL  54           HB       VAL  54  -6.092   5.164 -15.337
    4   HG12  VAL  54          HG11      VAL  54  -5.879   4.086 -17.733
    5   HG11  VAL  54          HG12      VAL  54  -7.417   3.327 -17.322
    6   HG13  VAL  54          HG13      VAL  54  -5.998   3.046 -16.314
    7   HG22  VAL  54          HG21      VAL  54  -6.839   7.124 -16.368
    8   HG21  VAL  54          HG22      VAL  54  -8.053   6.284 -17.331
    9   HG23  VAL  54          HG23      VAL  54  -6.351   6.179 -17.775

  No H/Q in entry =           9
  In of MODEL   14
    1    H    GLN  55           H        GLN  55  -7.002   4.116 -13.118
    2    HA   GLN  55           HA       GLN  55  -6.958   1.300 -13.387
    3    HB2  GLN  55           HB2      GLN  55  -5.378   2.164 -11.876
    4    HB3  GLN  55           HB3      GLN  55  -6.573   3.146 -11.033
    5    HG2  GLN  55           HG2      GLN  55  -7.280   1.394  -9.718
    6    HG3  GLN  55           HG3      GLN  55  -7.083   0.209 -11.003
    7   HE21  GLN  55          HE21      GLN  55  -5.480  -1.268 -10.526
    8   HE22  GLN  55          HE22      GLN  55  -4.083  -0.943  -9.623

  No H/Q in entry =           8
  In of MODEL   14
    1    H    THR  56           H        THR  56  -9.243   3.492 -11.747
    2    HA   THR  56           HA       THR  56 -10.848   1.628 -10.454
    3    HB   THR  56           HB       THR  56 -11.916   4.040 -11.942
    4    HG1  THR  56           HG1      THR  56 -10.437   3.786  -9.567
    5   HG23  THR  56          HG21      THR  56 -13.707   2.774 -11.044
    6   HG22  THR  56          HG22      THR  56 -13.414   4.041  -9.853
    7   HG21  THR  56          HG23      THR  56 -12.814   2.406  -9.570

  No H/Q in entry =           7
  In of MODEL   14
    1    H    LYS  57           H        LYS  57 -11.057   2.729 -13.834
    2    HA   LYS  57           HA       LYS  57 -13.245   1.080 -14.580
    3    HB2  LYS  57           HB2      LYS  57 -12.343   3.023 -15.894
    4    HB3  LYS  57           HB3      LYS  57 -10.926   2.057 -16.279
    5    HG2  LYS  57           HG2      LYS  57 -12.309   0.424 -17.452
    6    HG3  LYS  57           HG3      LYS  57 -13.770   1.294 -16.999
    7    HD2  LYS  57           HD2      LYS  57 -13.321   1.988 -19.227
    8    HD3  LYS  57           HD3      LYS  57 -12.743   3.318 -18.225
    9    HE2  LYS  57           HE2      LYS  57 -10.459   2.642 -18.468
   10    HE3  LYS  57           HE3      LYS  57 -10.909   1.078 -19.147
   11    HZ2  LYS  57           HZ1      LYS  57 -10.156   2.804 -20.775
   12    HZ1  LYS  57           HZ2      LYS  57 -11.595   3.647 -20.447
   13    HZ3  LYS  57           HZ3      LYS  57 -11.654   2.087 -21.117

  No H/Q in entry =          13
  In of MODEL   14
    1    H    LEU  58           H        LEU  58  -9.748   0.592 -14.549
    2    HA   LEU  58           HA       LEU  58  -9.805  -1.919 -15.848
    3    HB2  LEU  58           HB2      LEU  58  -7.738  -0.667 -14.048
    4    HB3  LEU  58           HB3      LEU  58  -7.507  -2.189 -14.910
    5    HG   LEU  58           HG       LEU  58  -8.228   0.433 -16.258
    6   HD11  LEU  58          HD11      LEU  58  -5.598  -0.849 -15.590
    7   HD13  LEU  58          HD12      LEU  58  -6.065   0.849 -15.531
    8   HD12  LEU  58          HD13      LEU  58  -5.749   0.079 -17.083
    9   HD22  LEU  58          HD21      LEU  58  -8.840  -1.114 -17.851
   10   HD21  LEU  58          HD22      LEU  58  -7.815  -2.380 -17.182
   11   HD23  LEU  58          HD23      LEU  58  -7.110  -1.114 -18.187

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  59           H        ILE  59 -10.590  -1.016 -12.587
    2    HA   ILE  59           HA       ILE  59 -10.276  -3.793 -11.653
    3    HB   ILE  59           HB       ILE  59  -9.783  -1.542 -10.247
    4   HG12  ILE  59          HG12      ILE  59 -11.195  -3.866  -8.921
    5   HG13  ILE  59          HG13      ILE  59  -9.559  -3.983  -9.519
    6   HG21  ILE  59          HG21      ILE  59 -12.312  -0.978 -10.488
    7   HG23  ILE  59          HG22      ILE  59 -11.585  -0.816  -8.906
    8   HG22  ILE  59          HG23      ILE  59 -12.561  -2.230  -9.294
    9   HD13  ILE  59          HD11      ILE  59  -8.849  -2.145  -8.094
   10   HD12  ILE  59          HD12      ILE  59  -9.615  -3.387  -7.113
   11   HD11  ILE  59          HD13      ILE  59 -10.501  -1.918  -7.529

  No H/Q in entry =          11
  In of MODEL   14
    1    H    GLU  60           H        GLU  60 -12.802  -1.434 -12.435
    2    HA   GLU  60           HA       GLU  60 -15.004  -2.920 -11.413
    3    HB2  GLU  60           HB2      GLU  60 -15.248  -0.568 -11.966
    4    HB3  GLU  60           HB3      GLU  60 -14.831  -0.880 -13.648
    5    HG2  GLU  60           HG2      GLU  60 -17.175  -2.285 -12.386
    6    HG3  GLU  60           HG3      GLU  60 -17.351  -0.660 -13.017

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLY  61           H        GLY  61 -13.352  -2.918 -14.539
    2    HA3  GLY  61           HA2      GLY  61 -15.106  -5.132 -15.426
    3    HA2  GLY  61           HA3      GLY  61 -14.251  -4.037 -16.506

  No H/Q in entry =           3
  In of MODEL   14
    1    H    ASP  62           H        ASP  62 -12.879  -5.517 -13.636
    2    HA   ASP  62           HA       ASP  62 -10.661  -6.543 -15.145
    3    HB2  ASP  62           HB2      ASP  62  -9.899  -7.339 -12.915
    4    HB3  ASP  62           HB3      ASP  62 -10.324  -5.631 -12.917

  No H/Q in entry =           4
  In of MODEL   14
    1    H    ALA  63           H        ALA  63 -12.194  -7.956 -16.544
    2    HA   ALA  63           HA       ALA  63 -13.364 -10.330 -15.459
    3    HB3  ALA  63           HB1      ALA  63 -13.061 -11.087 -17.946
    4    HB2  ALA  63           HB2      ALA  63 -12.500  -9.436 -18.212
    5    HB1  ALA  63           HB3      ALA  63 -14.133  -9.728 -17.610

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLY  64           H        GLY  64 -10.208  -9.531 -16.777
    2    HA3  GLY  64           HA2      GLY  64  -8.159 -10.547 -16.334
    3    HA2  GLY  64           HA3      GLY  64  -9.005 -11.847 -15.505

  No H/Q in entry =           3
  In of MODEL   14
    1    H    GLU  65           H        GLU  65  -6.979 -12.588 -17.125
    2    HA   GLU  65           HA       GLU  65  -7.665 -12.992 -19.832
    3    HB2  GLU  65           HB2      GLU  65  -5.706 -14.435 -18.050
    4    HB3  GLU  65           HB3      GLU  65  -5.846 -14.717 -19.785
    5    HG2  GLU  65           HG2      GLU  65  -5.345 -12.375 -20.247
    6    HG3  GLU  65           HG3      GLU  65  -5.304 -12.017 -18.521

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLY  66           H        GLY  66  -8.080 -14.977 -17.000
    2    HA3  GLY  66           HA2      GLY  66  -9.476 -17.062 -18.520
    3    HA2  GLY  66           HA3      GLY  66  -8.821 -17.238 -16.904

  No H/Q in entry =           3
  In of MODEL   14
    1    H    LYS  67           H        LYS  67 -11.141 -18.226 -16.995
    2    HA   LYS  67           HA       LYS  67 -13.502 -17.000 -17.077
    3    HB2  LYS  67           HB2      LYS  67 -14.147 -18.460 -15.049
    4    HB3  LYS  67           HB3      LYS  67 -13.515 -19.260 -16.494
    5    HG2  LYS  67           HG2      LYS  67 -11.262 -19.293 -15.518
    6    HG3  LYS  67           HG3      LYS  67 -11.854 -18.450 -14.089
    7    HD2  LYS  67           HD2      LYS  67 -13.343 -20.347 -13.577
    8    HD3  LYS  67           HD3      LYS  67 -12.757 -21.192 -15.012
    9    HE2  LYS  67           HE2      LYS  67 -10.465 -21.168 -14.103
   10    HE3  LYS  67           HE3      LYS  67 -11.039 -20.309 -12.672
   11    HZ3  LYS  67           HZ1      LYS  67 -11.248 -22.373 -11.857
   12    HZ2  LYS  67           HZ2      LYS  67 -11.305 -23.103 -13.390
   13    HZ1  LYS  67           HZ3      LYS  67 -12.702 -22.395 -12.730

  No H/Q in entry =          13
  In of MODEL   14
    1    H    MET  68           H        MET  68 -13.298 -17.542 -13.817
    2    HA   MET  68           HA       MET  68 -14.308 -15.046 -13.030
    3    HB2  MET  68           HB2      MET  68 -13.136 -17.368 -11.524
    4    HB3  MET  68           HB3      MET  68 -13.726 -15.926 -10.699
    5    HG2  MET  68           HG2      MET  68 -15.935 -16.212 -11.695
    6    HG3  MET  68           HG3      MET  68 -15.358 -17.587 -12.640
    7    HE1  MET  68           HE1      MET  68 -15.951 -15.953  -9.432
    8    HE3  MET  68           HE2      MET  68 -14.602 -16.769  -8.644
    9    HE2  MET  68           HE3      MET  68 -16.256 -17.204  -8.218

  No H/Q in entry =           9
  In of MODEL   14
    1    H    LYS  69           H        LYS  69 -10.956 -16.289 -12.826
    2    HA   LYS  69           HA       LYS  69  -9.754 -14.554 -11.156
    3    HB2  LYS  69           HB2      LYS  69  -8.747 -15.603 -13.797
    4    HB3  LYS  69           HB3      LYS  69  -7.713 -14.737 -12.658
    5    HG2  LYS  69           HG2      LYS  69  -8.264 -16.378 -10.900
    6    HG3  LYS  69           HG3      LYS  69  -9.310 -17.239 -12.027
    7    HD2  LYS  69           HD2      LYS  69  -7.375 -17.691 -13.487
    8    HD3  LYS  69           HD3      LYS  69  -6.325 -16.827 -12.362
    9    HE2  LYS  69           HE2      LYS  69  -6.901 -18.435 -10.581
   10    HE3  LYS  69           HE3      LYS  69  -7.952 -19.300 -11.701
   11    HZ1  LYS  69           HZ1      LYS  69  -5.118 -18.830 -12.361
   12    HZ3  LYS  69           HZ2      LYS  69  -6.168 -20.027 -12.951
   13    HZ2  LYS  69           HZ3      LYS  69  -5.564 -20.129 -11.365

  No H/Q in entry =          13
  In of MODEL   14
    1    H    VAL  70           H        VAL  70  -7.965 -12.842 -11.922
    2    HA   VAL  70           HA       VAL  70  -9.302 -10.744 -13.533
    3    HB   VAL  70           HB       VAL  70  -8.470  -9.087 -11.904
    4   HG13  VAL  70          HG11      VAL  70 -10.061  -9.643 -10.092
    5   HG12  VAL  70          HG12      VAL  70 -10.132 -11.308 -10.674
    6   HG11  VAL  70          HG13      VAL  70 -10.754  -9.996 -11.675
    7   HG21  VAL  70          HG21      VAL  70  -7.511 -11.575 -10.449
    8   HG23  VAL  70          HG22      VAL  70  -7.700 -10.014  -9.652
    9   HG22  VAL  70          HG23      VAL  70  -6.541 -10.195 -10.967

  No H/Q in entry =           9
  In of MODEL   14
    1    H    SER  71           H        SER  71  -7.765  -9.069 -14.268
    2    HA   SER  71           HA       SER  71  -5.530 -10.160 -15.615
    3    HB2  SER  71           HB2      SER  71  -6.771  -8.100 -16.323
    4    HB3  SER  71           HB3      SER  71  -6.055  -7.252 -14.956
    5    HG   SER  71           HG       SER  71  -4.999  -7.359 -17.233

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU  72           H        LEU  72  -3.516 -10.505 -14.968
    2    HA   LEU  72           HA       LEU  72  -2.774 -10.312 -12.261
    3    HB2  LEU  72           HB2      LEU  72  -1.141 -10.756 -14.755
    4    HB3  LEU  72           HB3      LEU  72  -0.474 -10.851 -13.129
    5    HG   LEU  72           HG       LEU  72  -2.857 -12.497 -14.041
    6   HD11  LEU  72          HD11      LEU  72  -0.761 -12.999 -15.338
    7   HD13  LEU  72          HD12      LEU  72  -1.319 -14.349 -14.350
    8   HD12  LEU  72          HD13      LEU  72   0.039 -13.362 -13.808
    9   HD21  LEU  72          HD21      LEU  72  -1.129 -12.386 -11.580
   10   HD23  LEU  72          HD22      LEU  72  -1.839 -13.924 -12.045
   11   HD22  LEU  72          HD23      LEU  72  -2.878 -12.546 -11.694

  No H/Q in entry =          11
  In of MODEL   14
    1    H    VAL  73           H        VAL  73  -2.043  -8.298 -15.039
    2    HA   VAL  73           HA       VAL  73  -0.087  -6.635 -13.943
    3    HB   VAL  73           HB       VAL  73  -0.454  -5.216 -15.796
    4   HG11  VAL  73          HG11      VAL  73   0.176  -7.707 -16.189
    5   HG13  VAL  73          HG12      VAL  73  -0.317  -6.745 -17.582
    6   HG12  VAL  73          HG13      VAL  73  -1.457  -7.861 -16.834
    7   HG22  VAL  73          HG21      VAL  73  -2.706  -4.617 -15.786
    8   HG21  VAL  73          HG22      VAL  73  -3.252  -6.283 -15.610
    9   HG23  VAL  73          HG23      VAL  73  -2.657  -5.710 -17.169

  No H/Q in entry =           9
  In of MODEL   14
    1    H    LEU  74           H        LEU  74  -3.482  -6.696 -13.363
    2    HA   LEU  74           HA       LEU  74  -4.052  -4.033 -12.737
    3    HB2  LEU  74           HB2      LEU  74  -5.811  -5.664 -12.904
    4    HB3  LEU  74           HB3      LEU  74  -5.126  -6.610 -11.587
    5    HG   LEU  74           HG       LEU  74  -5.541  -4.739 -10.025
    6   HD13  LEU  74          HD11      LEU  74  -5.420  -2.783 -11.340
    7   HD12  LEU  74          HD12      LEU  74  -7.141  -2.936 -10.994
    8   HD11  LEU  74          HD13      LEU  74  -6.511  -3.432 -12.565
    9   HD22  LEU  74          HD21      LEU  74  -7.762  -5.263  -9.759
   10   HD21  LEU  74          HD22      LEU  74  -7.262  -6.529 -10.860
   11   HD23  LEU  74          HD23      LEU  74  -8.108  -5.132 -11.481

  No H/Q in entry =          11
  In of MODEL   14
    1    H    VAL  75           H        VAL  75  -3.040  -6.644 -10.591
    2    HA   VAL  75           HA       VAL  75  -2.800  -5.105  -8.243
    3    HB   VAL  75           HB       VAL  75  -1.353  -7.622  -9.052
    4   HG11  VAL  75          HG11      VAL  75  -1.514  -6.159  -6.379
    5   HG13  VAL  75          HG12      VAL  75  -0.065  -6.435  -7.334
    6   HG12  VAL  75          HG13      VAL  75  -0.890  -7.793  -6.587
    7   HG22  VAL  75          HG21      VAL  75  -3.028  -8.703  -7.677
    8   HG21  VAL  75          HG22      VAL  75  -3.876  -7.654  -8.813
    9   HG23  VAL  75          HG23      VAL  75  -3.662  -7.147  -7.136

  No H/Q in entry =           9
  In of MODEL   14
    1    H    GLU  76           H        GLU  76  -0.421  -5.896 -10.798
    2    HA   GLU  76           HA       GLU  76   1.794  -4.590  -9.651
    3    HB2  GLU  76           HB2      GLU  76   1.967  -6.060 -11.637
    4    HB3  GLU  76           HB3      GLU  76   1.058  -4.894 -12.585
    5    HG2  GLU  76           HG2      GLU  76   3.417  -4.612 -13.084
    6    HG3  GLU  76           HG3      GLU  76   2.888  -3.207 -12.178

  No H/Q in entry =           6
  In of MODEL   14
    1    H    ALA  77           H        ALA  77  -0.731  -3.339 -11.818
    2    HA   ALA  77           HA       ALA  77   0.302  -0.709 -11.992
    3    HB3  ALA  77           HB1      ALA  77  -1.675  -0.169 -13.094
    4    HB2  ALA  77           HB2      ALA  77  -2.648  -1.248 -12.095
    5    HB1  ALA  77           HB3      ALA  77  -1.602  -1.914 -13.348

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLN  78           H        GLN  78  -1.978  -2.234  -9.771
    2    HA   GLN  78           HA       GLN  78  -2.737   0.092  -8.357
    3    HB2  GLN  78           HB2      GLN  78  -3.882  -2.151  -8.274
    4    HB3  GLN  78           HB3      GLN  78  -2.550  -2.733  -7.278
    5    HG2  GLN  78           HG2      GLN  78  -3.032  -0.999  -5.606
    6    HG3  GLN  78           HG3      GLN  78  -4.359  -0.398  -6.600
    7   HE21  GLN  78          HE21      GLN  78  -4.840  -1.377  -3.950
    8   HE22  GLN  78          HE22      GLN  78  -5.735  -2.816  -4.070

  No H/Q in entry =           8
  In of MODEL   14
    1    H    LEU  79           H        LEU  79  -0.093  -2.208  -7.932
    2    HA   LEU  79           HA       LEU  79   0.913  -1.336  -5.478
    3    HB2  LEU  79           HB2      LEU  79   1.744  -3.355  -6.558
    4    HB3  LEU  79           HB3      LEU  79   2.397  -2.409  -7.892
    5    HG   LEU  79           HG       LEU  79   3.980  -1.300  -6.395
    6   HD13  LEU  79          HD11      LEU  79   2.993  -1.046  -4.320
    7   HD12  LEU  79          HD12      LEU  79   4.052  -2.414  -3.988
    8   HD11  LEU  79          HD13      LEU  79   2.340  -2.685  -4.308
    9   HD23  LEU  79          HD21      LEU  79   5.162  -3.470  -5.507
   10   HD22  LEU  79          HD22      LEU  79   4.951  -3.262  -7.243
   11   HD21  LEU  79          HD23      LEU  79   3.861  -4.318  -6.347

  No H/Q in entry =          11
  In of MODEL   14
    1    H    HIS  80           H        HIS  80   1.780  -0.222  -8.752
    2    HA   HIS  80           HA       HIS  80   3.625   1.734  -7.835
    3    HB2  HIS  80           HB2      HIS  80   2.308   1.069 -10.412
    4    HB3  HIS  80           HB3      HIS  80   2.930   2.711 -10.239
    5    HD1  HIS  80           HD1      HIS  80   5.332   2.976 -10.775
    6    HD2  HIS  80           HD2      HIS  80   4.460  -0.926  -9.592
    7    HE1  HIS  80           HE1      HIS  80   7.501   1.666 -10.960
    8    HE2  HIS  80           HE2      HIS  80   6.981  -0.715 -10.242

  No H/Q in entry =           8
  In of MODEL   14
    1    H    LEU  81           H        LEU  81   0.217   1.950  -8.793
    2    HA   LEU  81           HA       LEU  81  -0.013   4.745  -8.450
    3    HB2  LEU  81           HB2      LEU  81  -2.061   2.530  -8.366
    4    HB3  LEU  81           HB3      LEU  81  -2.487   4.239  -8.266
    5    HG   LEU  81           HG       LEU  81  -0.825   3.072 -10.516
    6   HD12  LEU  81          HD11      LEU  81  -3.060   3.430 -11.800
    7   HD11  LEU  81          HD12      LEU  81  -3.807   3.367 -10.204
    8   HD13  LEU  81          HD13      LEU  81  -2.889   1.988 -10.802
    9   HD23  LEU  81          HD21      LEU  81  -1.897   5.236 -11.599
   10   HD22  LEU  81          HD22      LEU  81  -0.472   5.382 -10.574
   11   HD21  LEU  81          HD23      LEU  81  -2.067   5.752  -9.923

  No H/Q in entry =          11
  In of MODEL   14
    1    H    MET  82           H        MET  82  -0.698   2.060  -6.207
    2    HA   MET  82           HA       MET  82  -1.714   3.654  -4.108
    3    HB2  MET  82           HB2      MET  82  -0.380   0.947  -4.165
    4    HB3  MET  82           HB3      MET  82  -0.939   1.675  -2.661
    5    HG2  MET  82           HG2      MET  82  -2.694   1.216  -5.093
    6    HG3  MET  82           HG3      MET  82  -2.623   0.136  -3.702
    7    HE3  MET  82           HE1      MET  82  -4.304   1.800  -0.871
    8    HE2  MET  82           HE2      MET  82  -2.571   2.054  -1.065
    9    HE1  MET  82           HE3      MET  82  -3.284   0.508  -1.520

  No H/Q in entry =           9
  In of MODEL   14
    1    H    THR  83           H        THR  83   1.566   2.523  -4.821
    2    HA   THR  83           HA       THR  83   2.814   3.601  -2.525
    3    HB   THR  83           HB       THR  83   4.898   3.521  -4.011
    4    HG1  THR  83           HG1      THR  83   4.639   3.005  -6.036
    5   HG22  THR  83          HG21      THR  83   4.414   0.871  -4.350
    6   HG21  THR  83          HG22      THR  83   3.137   1.264  -3.201
    7   HG23  THR  83          HG23      THR  83   4.824   1.582  -2.790

  No H/Q in entry =           7
  In of MODEL   14
    1    H    SER  84           H        SER  84   2.441   4.898  -5.818
    2    HA   SER  84           HA       SER  84   3.819   7.317  -5.362
    3    HB2  SER  84           HB2      SER  84   1.724   6.522  -7.372
    4    HB3  SER  84           HB3      SER  84   2.426   8.139  -7.345
    5    HG   SER  84           HG       SER  84   3.761   5.646  -7.653

  No H/Q in entry =           5
  In of MODEL   14
    1    H    MET  85           H        MET  85   0.315   6.610  -5.172
    2    HA   MET  85           HA       MET  85  -0.504   9.231  -4.556
    3    HB2  MET  85           HB2      MET  85  -2.058   7.448  -5.222
    4    HB3  MET  85           HB3      MET  85  -1.771   6.630  -3.687
    5    HG2  MET  85           HG2      MET  85  -2.635   8.576  -2.462
    6    HG3  MET  85           HG3      MET  85  -2.874   9.439  -3.981
    7    HE1  MET  85           HE1      MET  85  -3.538   6.509  -1.852
    8    HE3  MET  85           HE2      MET  85  -3.784   5.450  -3.239
    9    HE2  MET  85           HE3      MET  85  -5.157   5.915  -2.241

  No H/Q in entry =           9
  In of MODEL   14
    1    H    LEU  86           H        LEU  86   0.389   6.547  -2.427
    2    HA   LEU  86           HA       LEU  86  -0.110   7.848   0.023
    3    HB2  LEU  86           HB2      LEU  86   0.315   5.372  -0.383
    4    HB3  LEU  86           HB3      LEU  86   2.028   5.776  -0.487
    5    HG   LEU  86           HG       LEU  86   1.734   6.933   1.787
    6   HD11  LEU  86          HD11      LEU  86  -0.974   6.210   1.330
    7   HD13  LEU  86          HD12      LEU  86  -0.288   6.941   2.779
    8   HD12  LEU  86          HD13      LEU  86  -0.406   5.187   2.654
    9   HD23  LEU  86          HD21      LEU  86   1.261   3.947   1.901
   10   HD22  LEU  86          HD22      LEU  86   2.285   4.937   2.938
   11   HD21  LEU  86          HD23      LEU  86   2.771   4.611   1.275

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ALA  87           H        ALA  87   2.855   7.515  -1.886
    2    HA   ALA  87           HA       ALA  87   4.593   8.892  -0.167
    3    HB3  ALA  87           HB1      ALA  87   4.655   7.889  -2.879
    4    HB2  ALA  87           HB2      ALA  87   6.002   8.194  -1.785
    5    HB1  ALA  87           HB3      ALA  87   5.401   9.488  -2.820

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ARG  88           H        ARG  88   2.647  10.069  -2.871
    2    HA   ARG  88           HA       ARG  88   3.465  12.746  -2.748
    3    HB2  ARG  88           HB2      ARG  88   2.181  11.621  -4.602
    4    HB3  ARG  88           HB3      ARG  88   0.732  11.784  -3.609
    5    HG2  ARG  88           HG2      ARG  88   1.794  14.347  -3.522
    6    HG3  ARG  88           HG3      ARG  88   2.199  13.833  -5.157
    7    HD2  ARG  88           HD2      ARG  88   0.055  13.950  -5.841
    8    HD3  ARG  88           HD3      ARG  88  -0.536  13.101  -4.412
    9    HE   ARG  88           HE       ARG  88  -0.683  15.884  -4.818
   10   HH21  ARG  88          HH11      ARG  88  -1.177  17.214  -3.071
   11   HH22  ARG  88          HH12      ARG  88  -0.879  16.666  -1.458
   12   HH11  ARG  88          HH21      ARG  88   0.311  13.595  -2.459
   13   HH12  ARG  88          HH22      ARG  88  -0.055  14.611  -1.111

  No H/Q in entry =          13
  In of MODEL   14
    1    H    GLU  89           H        GLU  89   0.745  11.110  -1.097
    2    HA   GLU  89           HA       GLU  89  -0.316  13.435   0.124
    3    HB2  GLU  89           HB2      GLU  89  -1.472  11.215   0.036
    4    HB3  GLU  89           HB3      GLU  89  -0.350  10.636   1.267
    5    HG2  GLU  89           HG2      GLU  89  -1.131  12.341   2.838
    6    HG3  GLU  89           HG3      GLU  89  -2.180  13.035   1.604

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LEU  90           H        LEU  90   2.103  11.096   1.273
    2    HA   LEU  90           HA       LEU  90   2.497  12.324   3.805
    3    HB2  LEU  90           HB2      LEU  90   4.228  10.527   2.109
    4    HB3  LEU  90           HB3      LEU  90   4.667  11.029   3.747
    5    HG   LEU  90           HG       LEU  90   2.005   9.732   3.098
    6   HD12  LEU  90          HD11      LEU  90   3.116   7.662   4.090
    7   HD11  LEU  90          HD12      LEU  90   4.652   8.493   3.842
    8   HD13  LEU  90          HD13      LEU  90   3.623   8.109   2.460
    9   HD22  LEU  90          HD21      LEU  90   1.771  10.651   5.225
   10   HD21  LEU  90          HD22      LEU  90   3.489  10.512   5.595
   11   HD23  LEU  90          HD23      LEU  90   2.458   9.082   5.644

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  91           H        ILE  91   4.086  12.692   0.669
    2    HA   ILE  91           HA       ILE  91   6.101  14.484   1.503
    3    HB   ILE  91           HB       ILE  91   4.763  14.028  -1.170
    4   HG12  ILE  91          HG12      ILE  91   7.593  13.487  -0.217
    5   HG13  ILE  91          HG13      ILE  91   6.291  12.312  -0.051
    6   HG22  ILE  91          HG21      ILE  91   7.005  15.339  -1.868
    7   HG21  ILE  91          HG22      ILE  91   6.719  16.138  -0.321
    8   HG23  ILE  91          HG23      ILE  91   5.489  16.194  -1.582
    9   HD13  ILE  91          HD11      ILE  91   6.097  12.001  -2.358
   10   HD12  ILE  91          HD12      ILE  91   7.837  12.212  -2.155
   11   HD11  ILE  91          HD13      ILE  91   6.847  13.555  -2.729

  No H/Q in entry =          11
  In of MODEL   14
    1    H    THR  92           H        THR  92   2.741  14.981   0.519
    2    HA   THR  92           HA       THR  92   2.765  17.805   0.471
    3    HB   THR  92           HB       THR  92   0.566  15.846   1.176
    4    HG1  THR  92           HG1      THR  92   0.854  15.671  -0.911
    5   HG22  THR  92          HG21      THR  92  -0.800  18.036   0.473
    6   HG21  THR  92          HG22      THR  92   0.611  18.833   1.164
    7   HG23  THR  92          HG23      THR  92  -0.343  17.725   2.147

  No H/Q in entry =           7
  In of MODEL   14
    1    H    GLU  93           H        GLU  93   2.192  15.503   3.119
    2    HA   GLU  93           HA       GLU  93   1.708  17.408   5.149
    3    HB2  GLU  93           HB2      GLU  93   2.973  14.659   5.364
    4    HB3  GLU  93           HB3      GLU  93   2.308  15.592   6.706
    5    HG2  GLU  93           HG2      GLU  93   0.666  14.854   4.275
    6    HG3  GLU  93           HG3      GLU  93   0.758  13.824   5.698

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LEU  94           H        LEU  94   4.680  15.876   3.973
    2    HA   LEU  94           HA       LEU  94   6.463  16.984   5.854
    3    HB2  LEU  94           HB2      LEU  94   6.829  16.021   3.016
    4    HB3  LEU  94           HB3      LEU  94   8.176  16.651   3.960
    5    HG   LEU  94           HG       LEU  94   6.404  14.482   5.097
    6   HD11  LEU  94          HD11      LEU  94   8.481  14.227   2.951
    7   HD13  LEU  94          HD12      LEU  94   7.019  13.279   3.218
    8   HD12  LEU  94          HD13      LEU  94   8.447  12.996   4.215
    9   HD23  LEU  94          HD21      LEU  94   8.591  13.901   6.233
   10   HD22  LEU  94          HD22      LEU  94   7.956  15.489   6.660
   11   HD21  LEU  94          HD23      LEU  94   9.285  15.349   5.508

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  95           H        ILE  95   5.325  18.189   2.717
    2    HA   ILE  95           HA       ILE  95   6.939  20.518   2.657
    3    HB   ILE  95           HB       ILE  95   4.275  19.888   1.366
    4   HG12  ILE  95          HG12      ILE  95   7.062  20.179   0.212
    5   HG13  ILE  95          HG13      ILE  95   6.387  18.636   0.725
    6   HG21  ILE  95          HG21      ILE  95   6.067  22.324   1.144
    7   HG23  ILE  95          HG22      ILE  95   4.344  22.286   1.512
    8   HG22  ILE  95          HG23      ILE  95   4.909  21.882  -0.110
    9   HD13  ILE  95          HD11      ILE  95   4.815  18.596  -0.995
   10   HD12  ILE  95          HD12      ILE  95   6.174  19.393  -1.788
   11   HD11  ILE  95          HD13      ILE  95   4.822  20.350  -1.183

  No H/Q in entry =          11
  In of MODEL   14
    1    H    GLU  96           H        GLU  96   3.688  19.920   3.971
    2    HA   GLU  96           HA       GLU  96   3.121  22.574   4.737
    3    HB2  GLU  96           HB2      GLU  96   1.414  20.822   4.752
    4    HB3  GLU  96           HB3      GLU  96   2.269  19.974   6.038
    5    HG2  GLU  96           HG2      GLU  96   1.282  21.269   7.620
    6    HG3  GLU  96           HG3      GLU  96   1.840  22.736   6.826

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LEU  97           H        LEU  97   4.927  19.983   6.339
    2    HA   LEU  97           HA       LEU  97   5.325  21.314   8.813
    3    HB2  LEU  97           HB2      LEU  97   6.813  19.123   7.380
    4    HB3  LEU  97           HB3      LEU  97   7.425  19.791   8.891
    5    HG   LEU  97           HG       LEU  97   4.594  18.751   8.594
    6   HD12  LEU  97          HD11      LEU  97   5.504  16.716   9.792
    7   HD11  LEU  97          HD12      LEU  97   7.124  17.319   9.440
    8   HD13  LEU  97          HD13      LEU  97   6.038  16.886   8.119
    9   HD23  LEU  97          HD21      LEU  97   5.058  18.437  11.154
   10   HD22  LEU  97          HD22      LEU  97   4.704  20.058  10.559
   11   HD21  LEU  97          HD23      LEU  97   6.369  19.586  10.891

  No H/Q in entry =          11
  In of MODEL   14
    1    H    HIS  98           H        HIS  98   7.176  21.308   5.776
    2    HA   HIS  98           HA       HIS  98   9.365  22.843   6.667
    3    HB2  HIS  98           HB2      HIS  98   8.050  22.624   3.949
    4    HB3  HIS  98           HB3      HIS  98   9.509  23.574   4.234
    5    HD1  HIS  98           HD1      HIS  98   8.231  20.027   4.247
    6    HD2  HIS  98           HD2      HIS  98  11.854  22.054   4.657
    7    HE1  HIS  98           HE1      HIS  98  10.053  18.263   4.170
    8    HE2  HIS  98           HE2      HIS  98  12.262  19.477   4.420

  No H/Q in entry =           8
  In of MODEL   14
    1    H    GLU  99           H        GLU  99   6.153  23.744   5.517
    2    HA   GLU  99           HA       GLU  99   6.585  26.552   5.468
    3    HB2  GLU  99           HB2      GLU  99   4.677  25.423   4.345
    4    HB3  GLU  99           HB3      GLU  99   3.984  25.068   5.927
    5    HG2  GLU  99           HG2      GLU  99   3.853  27.461   6.439
    6    HG3  GLU  99           HG3      GLU  99   4.626  27.853   4.907

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LYS 100           H        LYS 100   5.428  24.327   7.988
    2    HA   LYS 100           HA       LYS 100   4.893  26.384   9.894
    3    HB2  LYS 100           HB2      LYS 100   5.414  23.421  10.224
    4    HB3  LYS 100           HB3      LYS 100   4.996  24.496  11.563
    5    HG2  LYS 100           HG2      LYS 100   2.935  25.178  10.332
    6    HG3  LYS 100           HG3      LYS 100   3.331  24.007   9.071
    7    HD2  LYS 100           HD2      LYS 100   3.229  22.181  10.725
    8    HD3  LYS 100           HD3      LYS 100   2.850  23.346  11.997
    9    HE2  LYS 100           HE2      LYS 100   0.801  24.012  10.750
   10    HE3  LYS 100           HE3      LYS 100   1.170  22.790   9.526
   11    HZ1  LYS 100           HZ1      LYS 100   0.910  22.116  12.406
   12    HZ3  LYS 100           HZ2      LYS 100   0.865  21.068  11.067
   13    HZ2  LYS 100           HZ3      LYS 100  -0.428  22.131  11.359

  No H/Q in entry =          13
  In of MODEL   14
    1    H    LEU 101           H        LEU 101   7.776  24.536   9.033
    2    HA   LEU 101           HA       LEU 101   9.405  25.335  11.230
    3    HB2  LEU 101           HB2      LEU 101   9.962  24.349   8.444
    4    HB3  LEU 101           HB3      LEU 101  11.283  24.985   9.420
    5    HG   LEU 101           HG       LEU 101   9.417  22.860  10.486
    6   HD12  LEU 101          HD11      LEU 101  11.437  21.328   9.858
    7   HD11  LEU 101          HD12      LEU 101  11.821  22.589   8.688
    8   HD13  LEU 101          HD13      LEU 101  10.275  21.746   8.601
    9   HD21  LEU 101          HD21      LEU 101  12.166  23.912  11.201
   10   HD23  LEU 101          HD22      LEU 101  11.596  22.348  11.777
   11   HD22  LEU 101          HD23      LEU 101  10.736  23.819  12.227

  No H/Q in entry =          11
  In of MODEL   14
    1    H    LYS 102           H        LYS 102   7.845  27.239   9.108
    2    HA   LYS 102           HA       LYS 102   7.965  29.531   8.825
    3    HB2  LYS 102           HB2      LYS 102   9.541  29.376  10.913
    4    HB3  LYS 102           HB3      LYS 102  10.836  29.550   9.746
    5    HG2  LYS 102           HG2      LYS 102   8.775  31.540  10.630
    6    HG3  LYS 102           HG3      LYS 102  10.491  31.767  10.368
    7    HD2  LYS 102           HD2      LYS 102   8.517  31.393   8.079
    8    HD3  LYS 102           HD3      LYS 102   8.935  32.962   8.752
    9    HE2  LYS 102           HE2      LYS 102  10.271  31.759   6.664
   10    HE3  LYS 102           HE3      LYS 102  10.920  33.049   7.677
   11    HZ2  LYS 102           HZ1      LYS 102  12.401  31.116   7.484
   12    HZ1  LYS 102           HZ2      LYS 102  11.225  30.153   8.230
   13    HZ3  LYS 102           HZ3      LYS 102  11.948  31.422   9.090

  No H/Q in entry =          13
  In of MODEL   14
    1    H    ALA 103           H        ALA 103  11.191  28.130   8.234
    2    HA   ALA 103           HA       ALA 103  12.169  29.497   6.157
    3    HB2  ALA 103           HB1      ALA 103  13.004  27.270   5.214
    4    HB1  ALA 103           HB2      ALA 103  12.102  26.508   6.523
    5    HB3  ALA 103           HB3      ALA 103  13.416  27.624   6.892

  No H/Q in entry =           5
  In of MODEL   14
    1    H1   LYS   3           H1       LYS   3 -31.666   5.239 -19.997
    2    H2   LYS   3           H3       LYS   3 -30.652   4.999 -21.338
    3    H3   LYS   3           H2       LYS   3 -31.992   3.985 -21.095
    4    HA   LYS   3           HA       LYS   3 -30.924   2.665 -19.675
    5    HB2  LYS   3           HB2      LYS   3 -28.716   4.198 -20.998
    6    HB3  LYS   3           HB3      LYS   3 -28.333   3.018 -19.745
    7    HG2  LYS   3           HG2      LYS   3 -29.651   1.345 -21.096
    8    HG3  LYS   3           HG3      LYS   3 -29.664   2.537 -22.394
    9    HD2  LYS   3           HD2      LYS   3 -27.179   2.566 -22.323
   10    HD3  LYS   3           HD3      LYS   3 -27.233   1.270 -21.129
   11    HE2  LYS   3           HE2      LYS   3 -28.648   0.000 -22.849
   12    HE3  LYS   3           HE3      LYS   3 -28.086   1.205 -24.009
   13    HZ3  LYS   3           HZ1      LYS   3 -26.219   0.081 -24.255
   14    HZ2  LYS   3           HZ2      LYS   3 -26.790  -1.116 -23.194
   15    HZ1  LYS   3           HZ3      LYS   3 -25.878   0.186 -22.596

  No H/Q in entry =          15
  In of MODEL   14
    1    H    LYS   4           H        LYS   4 -30.985   2.533 -17.613
    2    HA   LYS   4           HA       LYS   4 -30.399   4.866 -15.972
    3    HB2  LYS   4           HB2      LYS   4 -31.452   2.114 -15.265
    4    HB3  LYS   4           HB3      LYS   4 -31.316   3.469 -14.145
    5    HG2  LYS   4           HG2      LYS   4 -33.097   3.291 -16.580
    6    HG3  LYS   4           HG3      LYS   4 -33.603   3.324 -14.892
    7    HD2  LYS   4           HD2      LYS   4 -33.036   5.583 -14.634
    8    HD3  LYS   4           HD3      LYS   4 -31.983   5.575 -16.049
    9    HE2  LYS   4           HE2      LYS   4 -33.980   6.836 -16.536
   10    HE3  LYS   4           HE3      LYS   4 -33.969   5.356 -17.495
   11    HZ3  LYS   4           HZ1      LYS   4 -35.503   4.366 -15.954
   12    HZ2  LYS   4           HZ2      LYS   4 -36.136   5.825 -16.552
   13    HZ1  LYS   4           HZ3      LYS   4 -35.488   5.760 -14.984

  No H/Q in entry =          13
  In of MODEL   14
    1    H    HIS   5           H        HIS   5 -28.950   5.043 -14.369
    2    HA   HIS   5           HA       HIS   5 -26.567   3.341 -14.671
    3    HB2  HIS   5           HB2      HIS   5 -26.984   6.085 -13.485
    4    HB3  HIS   5           HB3      HIS   5 -25.452   5.214 -13.450
    5    HD1  HIS   5           HD1      HIS   5 -24.038   6.483 -15.036
    6    HD2  HIS   5           HD2      HIS   5 -27.786   5.644 -16.616
    7    HE1  HIS   5           HE1      HIS   5 -23.882   7.057 -17.489
    8    HE2  HIS   5           HE2      HIS   5 -26.167   6.533 -18.421

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ILE   6           H        ILE   6 -26.263   1.791 -13.343
    2    HA   ILE   6           HA       ILE   6 -27.274   2.021 -10.588
    3    HB   ILE   6           HB       ILE   6 -26.304  -0.405 -12.103
    4   HG12  ILE   6          HG12      ILE   6 -29.100   0.386 -11.279
    5   HG13  ILE   6          HG13      ILE   6 -28.455   0.572 -12.910
    6   HG23  ILE   6          HG21      ILE   6 -26.623  -1.665 -10.238
    7   HG22  ILE   6          HG22      ILE   6 -27.847  -0.579  -9.575
    8   HG21  ILE   6          HG23      ILE   6 -26.139  -0.150  -9.475
    9   HD13  ILE   6          HD11      ILE   6 -28.794  -1.572 -13.400
   10   HD12  ILE   6          HD12      ILE   6 -29.821  -1.601 -11.966
   11   HD11  ILE   6          HD13      ILE   6 -28.138  -2.118 -11.857

  No H/Q in entry =          11
  In of MODEL   14
    1    H    TYR   7           H        TYR   7 -25.563   2.765  -9.292
    2    HA   TYR   7           HA       TYR   7 -22.799   1.952  -9.944
    3    HB2  TYR   7           HB2      TYR   7 -23.904   4.339  -8.487
    4    HB3  TYR   7           HB3      TYR   7 -22.195   3.916  -8.509
    5    HD1  TYR   7           HD1      TYR   7 -23.157   2.900 -11.601
    6    HD2  TYR   7           HD2      TYR   7 -22.699   6.517  -9.392
    7    HE1  TYR   7           HE1      TYR   7 -22.775   4.138 -13.696
    8    HE2  TYR   7           HE2      TYR   7 -22.359   7.758 -11.480
    9    HH   TYR   7           HH       TYR   7 -22.554   7.646 -13.713

  No H/Q in entry =           9
  In of MODEL   14
    1    H    LEU   8           H        LEU   8 -21.772   0.662  -8.599
    2    HA   LEU   8           HA       LEU   8 -22.896   0.123  -5.922
    3    HB2  LEU   8           HB2      LEU   8 -21.091  -1.457  -7.732
    4    HB3  LEU   8           HB3      LEU   8 -21.270  -1.838  -6.020
    5    HG   LEU   8           HG       LEU   8 -23.734  -2.146  -6.459
    6   HD13  LEU   8          HD11      LEU   8 -23.913  -0.951  -8.578
    7   HD12  LEU   8          HD12      LEU   8 -24.350  -2.643  -8.812
    8   HD11  LEU   8          HD13      LEU   8 -22.767  -2.062  -9.327
    9   HD23  LEU   8          HD21      LEU   8 -22.338  -4.126  -8.130
   10   HD22  LEU   8          HD22      LEU   8 -23.426  -4.343  -6.759
   11   HD21  LEU   8          HD23      LEU   8 -21.742  -3.897  -6.486

  No H/Q in entry =          11
  In of MODEL   14
    1    H    PHE   9           H        PHE   9 -21.668   0.596  -4.133
    2    HA   PHE   9           HA       PHE   9 -18.927   1.672  -4.606
    3    HB2  PHE   9           HB2      PHE   9 -21.036   2.652  -2.687
    4    HB3  PHE   9           HB3      PHE   9 -19.349   3.146  -2.624
    5    HD1  PHE   9           HD1      PHE   9 -18.367   4.517  -4.385
    6    HD2  PHE   9           HD2      PHE   9 -22.504   3.385  -4.508
    7    HE1  PHE   9           HE1      PHE   9 -18.774   6.194  -6.162
    8    HE2  PHE   9           HE2      PHE   9 -22.913   5.074  -6.280
    9    HZ   PHE   9           HZ       PHE   9 -21.045   6.475  -7.112

  No H/Q in entry =           9
  In of MODEL   14
    1    H    SER  10           H        SER  10 -17.296   0.853  -3.424
    2    HA   SER  10           HA       SER  10 -17.522  -0.054  -0.744
    3    HB2  SER  10           HB2      SER  10 -17.186  -2.421  -1.048
    4    HB3  SER  10           HB3      SER  10 -18.625  -1.953  -1.938
    5    HG   SER  10           HG       SER  10 -16.615  -1.604  -3.565

  No H/Q in entry =           5
  In of MODEL   14
    1    H    SER  11           H        SER  11 -15.517   0.148   0.145
    2    HA   SER  11           HA       SER  11 -13.355   1.114  -1.357
    3    HB2  SER  11           HB2      SER  11 -13.880   1.221   1.203
    4    HB3  SER  11           HB3      SER  11 -12.906  -0.250   1.260
    5    HG   SER  11           HG       SER  11 -11.763   1.621  -0.318

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA  12           H        ALA  12 -14.400  -1.622  -2.177
    2    HA   ALA  12           HA       ALA  12 -11.761  -2.736  -2.686
    3    HB3  ALA  12           HB1      ALA  12 -12.806  -5.079  -2.066
    4    HB1  ALA  12           HB2      ALA  12 -13.803  -4.108  -0.983
    5    HB2  ALA  12           HB3      ALA  12 -12.048  -4.075  -0.828

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLY  13           H        GLY  13 -12.658  -1.754  -4.704
    2    HA3  GLY  13           HA2      GLY  13 -14.825  -2.630  -6.174
    3    HA2  GLY  13           HA3      GLY  13 -13.307  -2.080  -6.900

  No H/Q in entry =           3
  In of MODEL   14
    1    H    MET  14           H        MET  14 -11.807  -4.363  -5.656
    2    HA   MET  14           HA       MET  14 -11.936  -6.137  -7.830
    3    HB2  MET  14           HB2      MET  14  -9.985  -6.004  -6.271
    4    HB3  MET  14           HB3      MET  14 -10.914  -6.909  -5.076
    5    HG2  MET  14           HG2      MET  14  -9.615  -8.549  -6.198
    6    HG3  MET  14           HG3      MET  14 -11.206  -8.682  -6.947
    7    HE3  MET  14           HE1      MET  14  -8.163  -5.944  -7.606
    8    HE2  MET  14           HE2      MET  14  -7.279  -7.137  -8.555
    9    HE1  MET  14           HE3      MET  14  -7.767  -7.522  -6.908

  No H/Q in entry =           9
  In of MODEL   14
    1    H    SER  15           H        SER  15 -13.305  -6.613  -4.585
    2    HA   SER  15           HA       SER  15 -14.511  -9.134  -5.287
    3    HB2  SER  15           HB2      SER  15 -14.185  -8.869  -2.950
    4    HB3  SER  15           HB3      SER  15 -14.949  -7.283  -2.947
    5    HG   SER  15           HG       SER  15 -16.072  -9.725  -2.663

  No H/Q in entry =           5
  In of MODEL   14
    1    H    THR  16           H        THR  16 -15.684  -5.794  -5.137
    2    HA   THR  16           HA       THR  16 -18.442  -6.391  -5.772
    3    HB   THR  16           HB       THR  16 -16.942  -3.796  -6.262
    4    HG1  THR  16           HG1      THR  16 -17.919  -4.974  -3.905
    5   HG21  THR  16          HG21      THR  16 -19.417  -4.352  -7.028
    6   HG23  THR  16          HG22      THR  16 -19.027  -2.778  -6.312
    7   HG22  THR  16          HG23      THR  16 -19.771  -4.049  -5.332

  No H/Q in entry =           7
  In of MODEL   14
    1    H    SER  17           H        SER  17 -15.511  -5.753  -7.553
    2    HA   SER  17           HA       SER  17 -16.655  -5.091 -10.069
    3    HB2  SER  17           HB2      SER  17 -13.965  -6.263  -9.335
    4    HB3  SER  17           HB3      SER  17 -14.414  -5.859 -10.993
    5    HG   SER  17           HG       SER  17 -13.309  -4.254  -9.395

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU  18           H        LEU  18 -15.929  -8.191  -8.594
    2    HA   LEU  18           HA       LEU  18 -16.410  -9.736 -10.944
    3    HB2  LEU  18           HB2      LEU  18 -15.157 -10.631  -9.041
    4    HB3  LEU  18           HB3      LEU  18 -16.588 -10.483  -8.021
    5    HG   LEU  18           HG       LEU  18 -17.758 -12.135  -9.373
    6   HD11  LEU  18          HD11      LEU  18 -15.277 -11.915 -11.055
    7   HD13  LEU  18          HD12      LEU  18 -16.967 -11.869 -11.559
    8   HD12  LEU  18          HD13      LEU  18 -16.236 -13.393 -11.062
    9   HD22  LEU  18          HD21      LEU  18 -16.695 -13.991  -8.533
   10   HD21  LEU  18          HD22      LEU  18 -16.091 -12.695  -7.499
   11   HD23  LEU  18          HD23      LEU  18 -15.085 -13.322  -8.804

  No H/Q in entry =          11
  In of MODEL   14
    1    H    LEU  19           H        LEU  19 -18.467  -8.621  -8.259
    2    HA   LEU  19           HA       LEU  19 -20.854  -9.943  -9.106
    3    HB2  LEU  19           HB2      LEU  19 -20.651  -9.081  -6.857
    4    HB3  LEU  19           HB3      LEU  19 -20.454  -7.441  -7.474
    5    HG   LEU  19           HG       LEU  19 -22.778  -7.401  -8.183
    6   HD13  LEU  19          HD11      LEU  19 -23.442  -9.535  -8.765
    7   HD12  LEU  19          HD12      LEU  19 -24.173  -9.390  -7.166
    8   HD11  LEU  19          HD13      LEU  19 -22.659 -10.271  -7.366
    9   HD23  LEU  19          HD21      LEU  19 -23.802  -7.485  -5.936
   10   HD22  LEU  19          HD22      LEU  19 -22.258  -6.633  -5.969
   11   HD21  LEU  19          HD23      LEU  19 -22.344  -8.276  -5.335

  No H/Q in entry =          11
  In of MODEL   14
    1    H    VAL  20           H        VAL  20 -19.528  -6.709  -9.809
    2    HA   VAL  20           HA       VAL  20 -21.679  -5.796 -11.404
    3    HB   VAL  20           HB       VAL  20 -18.726  -5.041 -11.501
    4   HG11  VAL  20          HG11      VAL  20 -21.082  -3.853 -12.982
    5   HG13  VAL  20          HG12      VAL  20 -19.605  -4.518 -13.677
    6   HG12  VAL  20          HG13      VAL  20 -19.548  -3.011 -12.763
    7   HG21  VAL  20          HG21      VAL  20 -21.151  -3.879 -10.187
    8   HG23  VAL  20          HG22      VAL  20 -19.731  -2.894 -10.532
    9   HG22  VAL  20          HG23      VAL  20 -19.593  -4.298  -9.475

  No H/Q in entry =           9
  In of MODEL   14
    1    H    SER  21           H        SER  21 -18.803  -7.697 -12.393
    2    HA   SER  21           HA       SER  21 -19.567  -7.646 -15.151
    3    HB2  SER  21           HB2      SER  21 -18.022  -9.533 -15.458
    4    HB3  SER  21           HB3      SER  21 -17.271  -8.238 -14.528
    5    HG   SER  21           HG       SER  21 -17.079  -9.526 -12.916

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LYS  22           H        LYS  22 -20.535  -9.872 -12.574
    2    HA   LYS  22           HA       LYS  22 -21.966 -11.584 -14.398
    3    HB2  LYS  22           HB2      LYS  22 -21.200 -12.295 -12.119
    4    HB3  LYS  22           HB3      LYS  22 -22.442 -11.247 -11.439
    5    HG2  LYS  22           HG2      LYS  22 -23.527 -13.253 -11.377
    6    HG3  LYS  22           HG3      LYS  22 -24.035 -12.674 -12.963
    7    HD2  LYS  22           HD2      LYS  22 -23.418 -14.858 -13.416
    8    HD3  LYS  22           HD3      LYS  22 -21.954 -13.965 -13.827
    9    HE2  LYS  22           HE2      LYS  22 -20.962 -14.540 -11.678
   10    HE3  LYS  22           HE3      LYS  22 -22.445 -15.359 -11.186
   11    HZ3  LYS  22           HZ1      LYS  22 -22.101 -16.983 -12.913
   12    HZ2  LYS  22           HZ2      LYS  22 -20.735 -16.906 -11.904
   13    HZ1  LYS  22           HZ3      LYS  22 -20.699 -16.181 -13.438

  No H/Q in entry =          13
  In of MODEL   14
    1    H    MET  23           H        MET  23 -22.864  -8.694 -12.556
    2    HA   MET  23           HA       MET  23 -25.658  -8.927 -13.087
    3    HB2  MET  23           HB2      MET  23 -23.943  -6.519 -12.513
    4    HB3  MET  23           HB3      MET  23 -25.694  -6.445 -12.708
    5    HG2  MET  23           HG2      MET  23 -26.033  -7.755 -10.734
    6    HG3  MET  23           HG3      MET  23 -24.304  -8.074 -10.590
    7    HE2  MET  23           HE1      MET  23 -26.805  -4.544  -9.445
    8    HE1  MET  23           HE2      MET  23 -26.994  -5.533 -10.892
    9    HE3  MET  23           HE3      MET  23 -26.036  -4.053 -10.956

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ARG  24           H        ARG  24 -22.968  -7.364 -14.856
    2    HA   ARG  24           HA       ARG  24 -24.514  -6.158 -16.876
    3    HB2  ARG  24           HB2      ARG  24 -21.644  -7.152 -16.904
    4    HB3  ARG  24           HB3      ARG  24 -22.359  -6.256 -18.221
    5    HG2  ARG  24           HG2      ARG  24 -22.652  -4.266 -16.791
    6    HG3  ARG  24           HG3      ARG  24 -22.039  -5.186 -15.390
    7    HD2  ARG  24           HD2      ARG  24 -20.181  -3.909 -16.298
    8    HD3  ARG  24           HD3      ARG  24 -19.941  -5.605 -16.698
    9    HE   ARG  24           HE       ARG  24 -21.135  -4.702 -18.909
   10   HH21  ARG  24          HH11      ARG  24 -19.674  -5.150 -20.559
   11   HH22  ARG  24          HH12      ARG  24 -18.071  -4.507 -20.481
   12   HH11  ARG  24          HH21      ARG  24 -18.542  -3.435 -17.141
   13   HH12  ARG  24          HH22      ARG  24 -17.414  -3.486 -18.459

  No H/Q in entry =          13
  In of MODEL   14
    1    H    ALA  25           H        ALA  25 -23.220  -9.430 -16.570
    2    HA   ALA  25           HA       ALA  25 -23.780 -10.308 -19.207
    3    HB1  ALA  25           HB1      ALA  25 -22.985 -12.296 -18.493
    4    HB3  ALA  25           HB2      ALA  25 -24.055 -12.323 -17.091
    5    HB2  ALA  25           HB3      ALA  25 -22.546 -11.415 -17.030

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLN  26           H        GLN  26 -25.630 -10.425 -16.201
    2    HA   GLN  26           HA       GLN  26 -27.899 -11.754 -17.231
    3    HB2  GLN  26           HB2      GLN  26 -27.500  -9.969 -14.849
    4    HB3  GLN  26           HB3      GLN  26 -29.020 -10.775 -15.210
    5    HG2  GLN  26           HG2      GLN  26 -26.366 -12.093 -14.709
    6    HG3  GLN  26           HG3      GLN  26 -27.741 -12.055 -13.612
    7   HE21  GLN  26          HE21      GLN  26 -26.400 -14.160 -14.865
    8   HE22  GLN  26          HE22      GLN  26 -27.379 -15.264 -15.665

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ALA  27           H        ALA  27 -27.145  -8.310 -16.851
    2    HA   ALA  27           HA       ALA  27 -29.681  -7.353 -17.664
    3    HB1  ALA  27           HB1      ALA  27 -27.953  -5.940 -16.539
    4    HB3  ALA  27           HB2      ALA  27 -28.567  -5.213 -18.025
    5    HB2  ALA  27           HB3      ALA  27 -26.990  -5.999 -18.016

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLU  28           H        GLU  28 -26.903  -8.443 -19.501
    2    HA   GLU  28           HA       GLU  28 -27.866  -7.466 -22.034
    3    HB2  GLU  28           HB2      GLU  28 -25.462  -8.021 -21.385
    4    HB3  GLU  28           HB3      GLU  28 -25.917  -9.712 -21.583
    5    HG2  GLU  28           HG2      GLU  28 -24.794  -8.887 -23.545
    6    HG3  GLU  28           HG3      GLU  28 -26.469  -9.299 -23.907

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LYS  29           H        LYS  29 -27.887 -10.567 -20.363
    2    HA   LYS  29           HA       LYS  29 -29.093 -12.113 -22.372
    3    HB2  LYS  29           HB2      LYS  29 -28.014 -13.032 -20.354
    4    HB3  LYS  29           HB3      LYS  29 -29.329 -12.387 -19.374
    5    HG2  LYS  29           HG2      LYS  29 -30.906 -13.848 -20.450
    6    HG3  LYS  29           HG3      LYS  29 -29.665 -14.426 -21.560
    7    HD2  LYS  29           HD2      LYS  29 -28.481 -15.524 -19.810
    8    HD3  LYS  29           HD3      LYS  29 -29.442 -14.725 -18.568
    9    HE2  LYS  29           HE2      LYS  29 -30.068 -17.111 -18.925
   10    HE3  LYS  29           HE3      LYS  29 -31.403 -15.988 -19.187
   11    HZ1  LYS  29           HZ1      LYS  29 -30.810 -16.103 -21.608
   12    HZ3  LYS  29           HZ2      LYS  29 -31.463 -17.523 -20.943
   13    HZ2  LYS  29           HZ3      LYS  29 -29.794 -17.409 -21.225

  No H/Q in entry =          13
  In of MODEL   14
    1    H    TYR  30           H        TYR  30 -30.616 -10.071 -19.891
    2    HA   TYR  30           HA       TYR  30 -33.240 -10.663 -21.155
    3    HB2  TYR  30           HB2      TYR  30 -32.673  -9.466 -18.434
    4    HB3  TYR  30           HB3      TYR  30 -34.269  -9.810 -19.101
    5    HD1  TYR  30           HD1      TYR  30 -35.057 -12.147 -19.311
    6    HD2  TYR  30           HD2      TYR  30 -31.281 -11.219 -17.576
    7    HE1  TYR  30           HE1      TYR  30 -34.855 -14.464 -18.503
    8    HE2  TYR  30           HE2      TYR  30 -31.080 -13.521 -16.771
    9    HH   TYR  30           HH       TYR  30 -32.585 -15.970 -17.868

  No H/Q in entry =           9
  In of MODEL   14
    1    H    GLU  31           H        GLU  31 -31.173  -8.566 -21.945
    2    HA   GLU  31           HA       GLU  31 -31.203  -6.411 -22.777
    3    HB2  GLU  31           HB2      GLU  31 -34.053  -7.279 -23.314
    4    HB3  GLU  31           HB3      GLU  31 -33.277  -5.872 -24.041
    5    HG2  GLU  31           HG2      GLU  31 -31.721  -7.237 -25.212
    6    HG3  GLU  31           HG3      GLU  31 -32.219  -8.674 -24.322

  No H/Q in entry =           6
  In of MODEL   14
    1    H    VAL  32           H        VAL  32 -31.434  -6.309 -20.048
    2    HA   VAL  32           HA       VAL  32 -33.410  -4.293 -19.416
    3    HB   VAL  32           HB       VAL  32 -30.984  -5.153 -17.809
    4   HG12  VAL  32          HG11      VAL  32 -32.579  -4.404 -15.931
    5   HG11  VAL  32          HG12      VAL  32 -33.447  -3.550 -17.207
    6   HG13  VAL  32          HG13      VAL  32 -31.761  -3.155 -16.873
    7   HG21  VAL  32          HG21      VAL  32 -32.653  -6.967 -18.505
    8   HG23  VAL  32          HG22      VAL  32 -33.746  -6.192 -17.358
    9   HG22  VAL  32          HG23      VAL  32 -32.198  -6.831 -16.806

  No H/Q in entry =           9
  In of MODEL   14
    1    HA   PRO  33           HA       PRO  33 -30.523  -1.216 -21.076
    2    HB2  PRO  33           HB2      PRO  33 -32.151   0.924 -20.976
    3    HB3  PRO  33           HB3      PRO  33 -32.539  -0.406 -22.068
    4    HG2  PRO  33           HG2      PRO  33 -33.560   0.070 -19.267
    5    HG3  PRO  33           HG3      PRO  33 -34.498  -0.196 -20.737
    6    HD2  PRO  33           HD2      PRO  33 -33.948  -2.234 -19.057
    7    HD3  PRO  33           HD3      PRO  33 -33.981  -2.486 -20.803

  No H/Q in entry =           7
  In of MODEL   14
    1    H    VAL  34           H        VAL  34 -29.250  -1.684 -19.112
    2    HA   VAL  34           HA       VAL  34 -29.112   0.760 -17.474
    3    HB   VAL  34           HB       VAL  34 -28.471  -0.660 -15.524
    4   HG12  VAL  34          HG11      VAL  34 -30.836  -1.661 -15.234
    5   HG11  VAL  34          HG12      VAL  34 -31.178  -0.924 -16.799
    6   HG13  VAL  34          HG13      VAL  34 -30.692   0.085 -15.438
    7   HG21  VAL  34          HG21      VAL  34 -28.529  -2.702 -17.525
    8   HG23  VAL  34          HG22      VAL  34 -29.578  -3.114 -16.166
    9   HG22  VAL  34          HG23      VAL  34 -27.880  -2.734 -15.885

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ILE  35           H        ILE  35 -27.170   1.304 -16.617
    2    HA   ILE  35           HA       ILE  35 -24.785   0.096 -17.853
    3    HB   ILE  35           HB       ILE  35 -25.348   2.963 -17.059
    4   HG12  ILE  35          HG12      ILE  35 -24.272   1.701 -19.588
    5   HG13  ILE  35          HG13      ILE  35 -25.937   2.234 -19.346
    6   HG21  ILE  35          HG21      ILE  35 -22.704   1.570 -17.337
    7   HG23  ILE  35          HG22      ILE  35 -23.233   2.728 -16.118
    8   HG22  ILE  35          HG23      ILE  35 -22.865   3.276 -17.754
    9   HD11  ILE  35          HD11      ILE  35 -24.662   4.503 -18.742
   10   HD13  ILE  35          HD12      ILE  35 -25.161   4.085 -20.382
   11   HD12  ILE  35          HD13      ILE  35 -23.496   3.808 -19.869

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ILE  36           H        ILE  36 -23.516  -0.853 -16.238
    2    HA   ILE  36           HA       ILE  36 -24.016  -0.252 -13.374
    3    HB   ILE  36           HB       ILE  36 -23.033  -2.910 -14.463
    4   HG12  ILE  36          HG12      ILE  36 -25.887  -2.254 -13.728
    5   HG13  ILE  36          HG13      ILE  36 -25.301  -2.210 -15.391
    6   HG23  ILE  36          HG21      ILE  36 -23.358  -3.748 -12.349
    7   HG22  ILE  36          HG22      ILE  36 -24.557  -2.526 -11.926
    8   HG21  ILE  36          HG23      ILE  36 -22.846  -2.101 -11.983
    9   HD13  ILE  36          HD11      ILE  36 -25.345  -4.430 -15.589
   10   HD12  ILE  36          HD12      ILE  36 -26.428  -4.360 -14.200
   11   HD11  ILE  36          HD13      ILE  36 -24.711  -4.687 -13.964

  No H/Q in entry =          11
  In of MODEL   14
    1    H    GLU  37           H        GLU  37 -22.282   0.478 -12.257
    2    HA   GLU  37           HA       GLU  37 -19.543  -0.175 -13.145
    3    HB2  GLU  37           HB2      GLU  37 -20.568   2.569 -12.428
    4    HB3  GLU  37           HB3      GLU  37 -18.866   2.150 -12.622
    5    HG2  GLU  37           HG2      GLU  37 -20.944   2.055 -14.790
    6    HG3  GLU  37           HG3      GLU  37 -19.778   3.354 -14.540

  No H/Q in entry =           6
  In of MODEL   14
    1    H    ALA  38           H        ALA  38 -18.062  -0.324 -11.448
    2    HA   ALA  38           HA       ALA  38 -19.126  -0.191  -8.688
    3    HB1  ALA  38           HB1      ALA  38 -17.296  -2.039 -10.089
    4    HB3  ALA  38           HB2      ALA  38 -18.343  -2.326  -8.700
    5    HB2  ALA  38           HB3      ALA  38 -16.773  -1.555  -8.476

  No H/Q in entry =           5
  In of MODEL   14
    1    H    PHE  39           H        PHE  39 -17.968   1.090  -7.208
    2    HA   PHE  39           HA       PHE  39 -15.505   2.427  -8.087
    3    HB2  PHE  39           HB2      PHE  39 -17.909   3.842  -6.928
    4    HB3  PHE  39           HB3      PHE  39 -16.325   4.572  -7.181
    5    HD1  PHE  39           HD1      PHE  39 -15.471   4.893  -9.479
    6    HD2  PHE  39           HD2      PHE  39 -19.464   3.630  -8.680
    7    HE1  PHE  39           HE1      PHE  39 -16.126   5.554 -11.775
    8    HE2  PHE  39           HE2      PHE  39 -20.132   4.278 -10.967
    9    HZ   PHE  39           HZ       PHE  39 -18.463   5.213 -12.532

  No H/Q in entry =           9
  In of MODEL   14
    1    HA   PRO  40           HA       PRO  40 -14.565   1.744  -3.789
    2    HB2  PRO  40           HB2      PRO  40 -12.920   3.858  -3.176
    3    HB3  PRO  40           HB3      PRO  40 -12.392   2.549  -4.234
    4    HG2  PRO  40           HG2      PRO  40 -13.562   5.219  -5.002
    5    HG3  PRO  40           HG3      PRO  40 -12.085   4.456  -5.592
    6    HD2  PRO  40           HD2      PRO  40 -14.286   4.239  -7.019
    7    HD3  PRO  40           HD3      PRO  40 -13.252   2.825  -6.814

  No H/Q in entry =           7
  In of MODEL   14
    1    H    GLU  41           H        GLU  41 -15.260   2.693  -1.669
    2    HA   GLU  41           HA       GLU  41 -17.598   4.266  -1.681
    3    HB2  GLU  41           HB2      GLU  41 -17.442   4.241   0.712
    4    HB3  GLU  41           HB3      GLU  41 -16.933   2.662   0.112
    5    HG2  GLU  41           HG2      GLU  41 -14.600   3.253   0.473
    6    HG3  GLU  41           HG3      GLU  41 -15.077   4.861   1.016

  No H/Q in entry =           6
  In of MODEL   14
    1    H    THR  42           H        THR  42 -14.324   5.371  -1.707
    2    HA   THR  42           HA       THR  42 -14.833   7.913  -0.509
    3    HB   THR  42           HB       THR  42 -12.702   8.604  -1.575
    4    HG1  THR  42           HG1      THR  42 -12.264   7.621  -3.376
    5   HG21  THR  42          HG21      THR  42 -12.651   5.827  -0.366
    6   HG23  THR  42          HG22      THR  42 -12.628   7.347   0.532
    7   HG22  THR  42          HG23      THR  42 -11.264   6.910  -0.496

  No H/Q in entry =           7
  In of MODEL   14
    1    H    LEU  43           H        LEU  43 -15.645   6.756  -3.613
    2    HA   LEU  43           HA       LEU  43 -16.047   9.506  -4.598
    3    HB2  LEU  43           HB2      LEU  43 -16.254   6.839  -5.986
    4    HB3  LEU  43           HB3      LEU  43 -16.533   8.404  -6.749
    5    HG   LEU  43           HG       LEU  43 -13.883   7.436  -5.700
    6   HD13  LEU  43          HD11      LEU  43 -13.278   6.942  -7.900
    7   HD12  LEU  43          HD12      LEU  43 -14.628   7.853  -8.576
    8   HD11  LEU  43          HD13      LEU  43 -14.919   6.308  -7.780
    9   HD23  LEU  43          HD21      LEU  43 -13.154   9.419  -7.190
   10   HD22  LEU  43          HD22      LEU  43 -13.837   9.774  -5.602
   11   HD21  LEU  43          HD23      LEU  43 -14.830   9.951  -7.048

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ALA  44           H        ALA  44 -17.902   7.580  -2.754
    2    HA   ALA  44           HA       ALA  44 -20.355   7.293  -4.098
    3    HB2  ALA  44           HB1      ALA  44 -20.173   6.195  -1.995
    4    HB3  ALA  44           HB2      ALA  44 -21.358   7.475  -1.739
    5    HB1  ALA  44           HB3      ALA  44 -19.701   7.681  -1.172

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLY  45           H        GLY  45 -19.113  10.176  -2.566
    2    HA3  GLY  45           HA2      GLY  45 -21.628  11.533  -2.955
    3    HA2  GLY  45           HA3      GLY  45 -20.127  12.247  -2.367

  No H/Q in entry =           3
  In of MODEL   14
    1    H    GLU  46           H        GLU  46 -18.524  11.390  -4.640
    2    HA   GLU  46           HA       GLU  46 -19.270  13.557  -6.425
    3    HB2  GLU  46           HB2      GLU  46 -16.959  11.610  -6.406
    4    HB3  GLU  46           HB3      GLU  46 -17.156  12.898  -7.595
    5    HG2  GLU  46           HG2      GLU  46 -16.964  14.572  -5.863
    6    HG3  GLU  46           HG3      GLU  46 -16.865  13.317  -4.628

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LYS  47           H        LYS  47 -18.946  10.049  -6.843
    2    HA   LYS  47           HA       LYS  47 -20.030  10.194  -9.529
    3    HB2  LYS  47           HB2      LYS  47 -19.342   7.848  -7.752
    4    HB3  LYS  47           HB3      LYS  47 -19.893   7.714  -9.422
    5    HG2  LYS  47           HG2      LYS  47 -17.436   9.251  -8.670
    6    HG3  LYS  47           HG3      LYS  47 -17.403   7.521  -9.004
    7    HD2  LYS  47           HD2      LYS  47 -18.449   7.971 -11.204
    8    HD3  LYS  47           HD3      LYS  47 -18.338   9.697 -10.867
    9    HE2  LYS  47           HE2      LYS  47 -15.967   7.846 -10.891
   10    HE3  LYS  47           HE3      LYS  47 -16.498   8.775 -12.292
   11    HZ3  LYS  47           HZ1      LYS  47 -15.150  10.324 -11.473
   12    HZ2  LYS  47           HZ2      LYS  47 -15.114   9.639  -9.921
   13    HZ1  LYS  47           HZ3      LYS  47 -16.406  10.645 -10.376

  No H/Q in entry =          13
  In of MODEL   14
    1    H    GLY  48           H        GLY  48 -21.337   9.376  -6.389
    2    HA3  GLY  48           HA2      GLY  48 -23.644   8.054  -7.145
    3    HA2  GLY  48           HA3      GLY  48 -23.488   9.066  -5.709

  No H/Q in entry =           3
  In of MODEL   14
    1    H    GLN  49           H        GLN  49 -23.031  11.510  -7.287
    2    HA   GLN  49           HA       GLN  49 -25.647  12.473  -7.459
    3    HB2  GLN  49           HB2      GLN  49 -23.145  13.475  -8.800
    4    HB3  GLN  49           HB3      GLN  49 -24.661  14.355  -8.734
    5    HG2  GLN  49           HG2      GLN  49 -24.525  14.399  -6.296
    6    HG3  GLN  49           HG3      GLN  49 -23.021  13.497  -6.361
    7   HE21  GLN  49          HE21      GLN  49 -23.043  15.735  -5.098
    8   HE22  GLN  49          HE22      GLN  49 -22.188  17.038  -5.743

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ASN  50           H        ASN  50 -23.842  10.682  -9.822
    2    HA   ASN  50           HA       ASN  50 -25.752  11.436 -11.925
    3    HB2  ASN  50           HB2      ASN  50 -23.088  10.044 -12.127
    4    HB3  ASN  50           HB3      ASN  50 -24.148  10.404 -13.483
    5   HD21  ASN  50          HD21      ASN  50 -21.578  11.405 -11.852
    6   HD22  ASN  50          HD22      ASN  50 -21.436  13.050 -12.201

  No H/Q in entry =           6
  In of MODEL   14
    1    H    ALA  51           H        ALA  51 -25.625   9.095  -9.667
    2    HA   ALA  51           HA       ALA  51 -26.270   6.900 -11.489
    3    HB2  ALA  51           HB1      ALA  51 -25.626   5.594  -9.792
    4    HB3  ALA  51           HB2      ALA  51 -26.803   6.342  -8.713
    5    HB1  ALA  51           HB3      ALA  51 -25.200   7.055  -8.899

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ASP  52           H        ASP  52 -28.213   5.734 -11.363
    2    HA   ASP  52           HA       ASP  52 -30.501   7.444 -10.725
    3    HB2  ASP  52           HB2      ASP  52 -30.153   4.946 -12.381
    4    HB3  ASP  52           HB3      ASP  52 -31.741   5.593 -11.964

  No H/Q in entry =           4
  In of MODEL   14
    1    H    VAL  53           H        VAL  53 -28.749   4.654  -9.682
    2    HA   VAL  53           HA       VAL  53 -30.217   4.712  -7.178
    3    HB   VAL  53           HB       VAL  53 -31.510   2.988  -8.427
    4   HG11  VAL  53          HG11      VAL  53 -29.704   2.221  -9.929
    5   HG13  VAL  53          HG12      VAL  53 -30.472   0.885  -9.070
    6   HG12  VAL  53          HG13      VAL  53 -28.898   1.479  -8.549
    7   HG23  VAL  53          HG21      VAL  53 -30.595   1.068  -6.718
    8   HG22  VAL  53          HG22      VAL  53 -31.799   2.308  -6.367
    9   HG21  VAL  53          HG23      VAL  53 -30.108   2.578  -5.946

  No H/Q in entry =           9
  In of MODEL   14
    1    H    VAL  54           H        VAL  54 -28.897   4.360  -5.510
    2    HA   VAL  54           HA       VAL  54 -26.088   3.663  -6.092
    3    HB   VAL  54           HB       VAL  54 -27.276   5.388  -3.861
    4   HG11  VAL  54          HG11      VAL  54 -24.620   4.113  -4.122
    5   HG13  VAL  54          HG12      VAL  54 -25.423   4.756  -2.690
    6   HG12  VAL  54          HG13      VAL  54 -24.567   5.844  -3.784
    7   HG22  VAL  54          HG21      VAL  54 -26.510   7.242  -4.962
    8   HG21  VAL  54          HG22      VAL  54 -26.989   6.218  -6.314
    9   HG23  VAL  54          HG23      VAL  54 -25.290   6.340  -5.861

  No H/Q in entry =           9
  In of MODEL   14
    1    H    LEU  55           H        LEU  55 -25.398   1.779  -5.436
    2    HA   LEU  55           HA       LEU  55 -26.850   0.397  -3.267
    3    HB2  LEU  55           HB2      LEU  55 -25.210  -0.694  -5.543
    4    HB3  LEU  55           HB3      LEU  55 -25.930  -1.663  -4.256
    5    HG   LEU  55           HG       LEU  55 -27.433  -0.166  -6.394
    6   HD13  LEU  55          HD11      LEU  55 -27.021  -2.005  -7.601
    7   HD12  LEU  55          HD12      LEU  55 -27.939  -2.926  -6.411
    8   HD11  LEU  55          HD13      LEU  55 -26.191  -2.764  -6.244
    9   HD23  LEU  55          HD21      LEU  55 -28.635  -2.173  -4.541
   10   HD22  LEU  55          HD22      LEU  55 -29.398  -0.834  -5.401
   11   HD21  LEU  55          HD23      LEU  55 -28.407  -0.517  -3.978

  No H/Q in entry =          11
  In of MODEL   14
    1    H    LEU  56           H        LEU  56 -25.684  -0.124  -1.449
    2    HA   LEU  56           HA       LEU  56 -22.775   0.432  -1.474
    3    HB2  LEU  56           HB2      LEU  56 -24.586   0.133   0.910
    4    HB3  LEU  56           HB3      LEU  56 -22.902   0.655   0.912
    5    HG   LEU  56           HG       LEU  56 -25.282   2.200  -0.082
    6   HD11  LEU  56          HD11      LEU  56 -24.170   1.892   2.451
    7   HD13  LEU  56          HD12      LEU  56 -25.229   3.202   1.929
    8   HD12  LEU  56          HD13      LEU  56 -23.480   3.403   1.857
    9   HD23  LEU  56          HD21      LEU  56 -23.431   4.002  -0.266
   10   HD22  LEU  56          HD22      LEU  56 -23.741   2.880  -1.591
   11   HD21  LEU  56          HD23      LEU  56 -22.380   2.607  -0.504

  No H/Q in entry =          11
  In of MODEL   14
    1    H    GLY  57           H        GLY  57 -21.312  -1.118  -0.920
    2    HA3  GLY  57           HA2      GLY  57 -22.084  -3.852  -1.114
    3    HA2  GLY  57           HA3      GLY  57 -20.496  -3.267  -0.620

  No H/Q in entry =           3
  In of MODEL   14
    1    HA   PRO  58           HA       PRO  58 -23.277  -4.441   3.070
    2    HB2  PRO  58           HB2      PRO  58 -22.457  -7.002   3.695
    3    HB3  PRO  58           HB3      PRO  58 -23.853  -6.675   2.668
    4    HG2  PRO  58           HG2      PRO  58 -21.074  -7.409   1.910
    5    HG3  PRO  58           HG3      PRO  58 -22.605  -7.956   1.226
    6    HD2  PRO  58           HD2      PRO  58 -21.087  -6.059   0.010
    7    HD3  PRO  58           HD3      PRO  58 -22.847  -6.069  -0.109

  No H/Q in entry =           7
  In of MODEL   14
    1    H    GLN  59           H        GLN  59 -19.881  -4.731   2.495
    2    HA   GLN  59           HA       GLN  59 -19.151  -4.696   5.262
    3    HB2  GLN  59           HB2      GLN  59 -17.615  -3.830   2.810
    4    HB3  GLN  59           HB3      GLN  59 -16.944  -3.872   4.426
    5    HG2  GLN  59           HG2      GLN  59 -16.211  -5.878   3.634
    6    HG3  GLN  59           HG3      GLN  59 -17.740  -6.377   4.339
    7   HE21  GLN  59          HE21      GLN  59 -16.772  -7.799   2.596
    8   HE22  GLN  59          HE22      GLN  59 -17.435  -8.064   1.093

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ILE  60           H        ILE  60 -20.202  -2.210   3.032
    2    HA   ILE  60           HA       ILE  60 -19.477  -0.200   5.075
    3    HB   ILE  60           HB       ILE  60 -19.799   1.505   3.231
    4   HG12  ILE  60          HG12      ILE  60 -19.417  -0.713   1.268
    5   HG13  ILE  60          HG13      ILE  60 -21.047  -0.294   1.794
    6   HG21  ILE  60          HG21      ILE  60 -17.636  -0.542   2.871
    7   HG23  ILE  60          HG22      ILE  60 -17.607   0.855   3.946
    8   HG22  ILE  60          HG23      ILE  60 -17.626   1.089   2.199
    9   HD12  ILE  60          HD11      ILE  60 -19.107   1.311   0.175
   10   HD11  ILE  60          HD12      ILE  60 -20.308   2.146   1.158
   11   HD13  ILE  60          HD13      ILE  60 -20.824   1.023  -0.100

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ALA  61           H        ALA  61 -21.843  -1.916   5.132
    2    HA   ALA  61           HA       ALA  61 -24.151  -0.377   4.645
    3    HB1  ALA  61           HB1      ALA  61 -25.296  -1.925   5.967
    4    HB2  ALA  61           HB2      ALA  61 -23.888  -2.233   6.984
    5    HB3  ALA  61           HB3      ALA  61 -23.936  -2.851   5.333

  No H/Q in entry =           5
  In of MODEL   14
    1    H    TYR  62           H        TYR  62 -21.966  -0.356   7.462
    2    HA   TYR  62           HA       TYR  62 -23.625   1.222   9.110
    3    HB2  TYR  62           HB2      TYR  62 -21.620   1.764  10.359
    4    HB3  TYR  62           HB3      TYR  62 -21.584   0.060   9.905
    5    HD1  TYR  62           HD1      TYR  62 -19.930  -0.775   8.294
    6    HD2  TYR  62           HD2      TYR  62 -19.996   3.350   9.409
    7    HE1  TYR  62           HE1      TYR  62 -17.722  -0.459   7.244
    8    HE2  TYR  62           HE2      TYR  62 -17.774   3.660   8.359
    9    HH   TYR  62           HH       TYR  62 -16.465   1.459   6.250

  No H/Q in entry =           9
  In of MODEL   14
    1    H    MET  63           H        MET  63 -22.006   2.156   6.265
    2    HA   MET  63           HA       MET  63 -21.998   4.996   6.945
    3    HB2  MET  63           HB2      MET  63 -21.286   3.495   4.425
    4    HB3  MET  63           HB3      MET  63 -21.192   5.249   4.595
    5    HG2  MET  63           HG2      MET  63 -19.487   4.998   6.308
    6    HG3  MET  63           HG3      MET  63 -19.585   3.244   6.157
    7    HE1  MET  63           HE1      MET  63 -17.180   4.804   6.048
    8    HE3  MET  63           HE2      MET  63 -16.333   4.934   4.507
    9    HE2  MET  63           HE3      MET  63 -16.623   3.348   5.221

  No H/Q in entry =           9
  In of MODEL   14
    1    H    LEU  64           H        LEU  64 -24.450   3.002   5.968
    2    HA   LEU  64           HA       LEU  64 -25.715   4.343   3.872
    3    HB2  LEU  64           HB2      LEU  64 -26.478   2.198   4.793
    4    HB3  LEU  64           HB3      LEU  64 -26.993   3.022   6.265
    5    HG   LEU  64           HG       LEU  64 -28.741   4.178   5.015
    6   HD13  LEU  64          HD11      LEU  64 -28.452   4.423   2.784
    7   HD12  LEU  64          HD12      LEU  64 -29.008   2.756   2.642
    8   HD11  LEU  64          HD13      LEU  64 -27.281   3.107   2.713
    9   HD23  LEU  64          HD21      LEU  64 -29.102   1.339   4.277
   10   HD22  LEU  64          HD22      LEU  64 -30.157   2.422   5.184
   11   HD21  LEU  64          HD23      LEU  64 -28.749   1.707   5.966

  No H/Q in entry =          11
  In of MODEL   14
    1    HA   PRO  65           HA       PRO  65 -28.084   7.390   6.589
    2    HB2  PRO  65           HB2      PRO  65 -26.115   7.665   8.859
    3    HB3  PRO  65           HB3      PRO  65 -27.867   7.853   8.888
    4    HG2  PRO  65           HG2      PRO  65 -26.827   5.656   9.835
    5    HG3  PRO  65           HG3      PRO  65 -28.234   5.543   8.778
    6    HD2  PRO  65           HD2      PRO  65 -25.327   5.077   8.101
    7    HD3  PRO  65           HD3      PRO  65 -26.732   4.113   7.647

  No H/Q in entry =           7
  In of MODEL   14
    1    H    GLU  66           H        GLU  66 -24.531   7.522   6.692
    2    HA   GLU  66           HA       GLU  66 -24.378  10.331   6.274
    3    HB2  GLU  66           HB2      GLU  66 -22.441   8.118   5.651
    4    HB3  GLU  66           HB3      GLU  66 -22.078   9.831   5.438
    5    HG2  GLU  66           HG2      GLU  66 -22.330  10.201   7.802
    6    HG3  GLU  66           HG3      GLU  66 -22.769   8.510   8.037

  No H/Q in entry =           6
  In of MODEL   14
    1    H    ILE  67           H        ILE  67 -24.317   7.573   4.036
    2    HA   ILE  67           HA       ILE  67 -23.970   9.290   1.738
    3    HB   ILE  67           HB       ILE  67 -24.718   6.340   1.925
    4   HG12  ILE  67          HG12      ILE  67 -22.144   7.641   1.018
    5   HG13  ILE  67          HG13      ILE  67 -22.431   7.215   2.704
    6   HG21  ILE  67          HG21      ILE  67 -24.739   8.209  -0.309
    7   HG23  ILE  67          HG22      ILE  67 -25.278   6.531  -0.255
    8   HG22  ILE  67          HG23      ILE  67 -23.584   6.903  -0.571
    9   HD12  ILE  67          HD11      ILE  67 -21.900   5.456   0.367
   10   HD11  ILE  67          HD12      ILE  67 -22.894   4.838   1.684
   11   HD13  ILE  67          HD13      ILE  67 -21.251   5.390   2.006

  No H/Q in entry =          11
  In of MODEL   14
    1    H    GLN  68           H        GLN  68 -26.796   8.097   3.353
    2    HA   GLN  68           HA       GLN  68 -28.653   8.924   1.359
    3    HB2  GLN  68           HB2      GLN  68 -28.916   8.567   4.342
    4    HB3  GLN  68           HB3      GLN  68 -30.256   9.089   3.335
    5    HG2  GLN  68           HG2      GLN  68 -30.170   7.054   2.069
    6    HG3  GLN  68           HG3      GLN  68 -28.700   6.556   2.885
    7   HE21  GLN  68          HE21      GLN  68 -30.805   5.088   2.740
    8   HE22  GLN  68          HE22      GLN  68 -31.622   4.597   4.150

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ARG  69           H        ARG  69 -27.157  10.682   4.101
    2    HA   ARG  69           HA       ARG  69 -28.642  13.090   3.671
    3    HB2  ARG  69           HB2      ARG  69 -26.267  12.287   5.284
    4    HB3  ARG  69           HB3      ARG  69 -26.428  13.999   4.916
    5    HG2  ARG  69           HG2      ARG  69 -28.752  13.930   5.868
    6    HG3  ARG  69           HG3      ARG  69 -28.464  12.255   6.352
    7    HD2  ARG  69           HD2      ARG  69 -26.898  14.695   7.268
    8    HD3  ARG  69           HD3      ARG  69 -27.990  13.739   8.258
    9    HE   ARG  69           HE       ARG  69 -25.326  12.935   7.334
   10   HH21  ARG  69          HH11      ARG  69 -24.441  11.219   8.545
   11   HH22  ARG  69          HH12      ARG  69 -25.437  10.358   9.670
   12   HH11  ARG  69          HH21      ARG  69 -28.267  12.248   9.010
   13   HH12  ARG  69          HH22      ARG  69 -27.602  10.938   9.931

  No H/Q in entry =          13
  In of MODEL   14
    1    H    LEU  70           H        LEU  70 -25.693  11.822   2.342
    2    HA   LEU  70           HA       LEU  70 -24.688  14.234   1.171
    3    HB2  LEU  70           HB2      LEU  70 -23.585  11.972   1.785
    4    HB3  LEU  70           HB3      LEU  70 -24.164  11.469   0.197
    5    HG   LEU  70           HG       LEU  70 -22.631  12.913  -0.882
    6   HD11  LEU  70          HD11      LEU  70 -21.874  13.810   1.908
    7   HD13  LEU  70          HD12      LEU  70 -22.610  14.802   0.649
    8   HD12  LEU  70          HD13      LEU  70 -20.964  14.201   0.446
    9   HD22  LEU  70          HD21      LEU  70 -21.117  11.271  -0.630
   10   HD21  LEU  70          HD22      LEU  70 -22.028  10.710   0.772
   11   HD23  LEU  70          HD23      LEU  70 -20.699  11.850   0.983

  No H/Q in entry =          11
  In of MODEL   14
    1    H    LEU  71           H        LEU  71 -26.706  11.584   0.051
    2    HA   LEU  71           HA       LEU  71 -27.282  13.033  -2.476
    3    HB2  LEU  71           HB2      LEU  71 -27.346  10.044  -2.018
    4    HB3  LEU  71           HB3      LEU  71 -27.503  10.891  -3.556
    5    HG   LEU  71           HG       LEU  71 -25.001  11.032  -1.875
    6   HD12  LEU  71          HD11      LEU  71 -24.955   9.393  -4.300
    7   HD11  LEU  71          HD12      LEU  71 -25.945   8.728  -3.002
    8   HD13  LEU  71          HD13      LEU  71 -24.243   9.091  -2.715
    9   HD22  LEU  71          HD21      LEU  71 -25.179  12.834  -3.378
   10   HD21  LEU  71          HD22      LEU  71 -25.615  11.763  -4.710
   11   HD23  LEU  71          HD23      LEU  71 -23.994  11.698  -4.018

  No H/Q in entry =          11
  In of MODEL   14
    1    HA   PRO  72           HA       PRO  72 -31.143  12.412   0.116
    2    HB2  PRO  72           HB2      PRO  72 -32.120  14.928   0.016
    3    HB3  PRO  72           HB3      PRO  72 -30.800  14.543   1.119
    4    HG2  PRO  72           HG2      PRO  72 -30.648  15.733  -1.638
    5    HG3  PRO  72           HG3      PRO  72 -29.920  16.327  -0.146
    6    HD2  PRO  72           HD2      PRO  72 -28.498  14.825  -1.894
    7    HD3  PRO  72           HD3      PRO  72 -28.249  14.679  -0.155

  No H/Q in entry =           7
  In of MODEL   14
    1    H    ASN  73           H        ASN  73 -30.540  13.380  -3.098
    2    HA   ASN  73           HA       ASN  73 -33.376  12.936  -3.751
    3    HB2  ASN  73           HB2      ASN  73 -32.947  14.053  -5.850
    4    HB3  ASN  73           HB3      ASN  73 -32.481  15.063  -4.490
    5   HD21  ASN  73          HD21      ASN  73 -31.667  15.132  -7.161
    6   HD22  ASN  73          HD22      ASN  73 -29.991  15.048  -7.339

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LYS  74           H        LYS  74 -31.297  10.776  -3.300
    2    HA   LYS  74           HA       LYS  74 -31.779   9.345  -5.846
    3    HB2  LYS  74           HB2      LYS  74 -29.249   9.177  -4.203
    4    HB3  LYS  74           HB3      LYS  74 -29.583   8.341  -5.720
    5    HG2  LYS  74           HG2      LYS  74 -29.456  11.322  -5.531
    6    HG3  LYS  74           HG3      LYS  74 -28.032  10.321  -5.819
    7    HD2  LYS  74           HD2      LYS  74 -29.091   9.334  -7.766
    8    HD3  LYS  74           HD3      LYS  74 -30.556  10.267  -7.462
    9    HE2  LYS  74           HE2      LYS  74 -29.420  12.326  -7.905
   10    HE3  LYS  74           HE3      LYS  74 -27.859  11.506  -7.980
   11    HZ2  LYS  74           HZ1      LYS  74 -29.339  12.030 -10.119
   12    HZ1  LYS  74           HZ2      LYS  74 -29.927  10.482  -9.744
   13    HZ3  LYS  74           HZ3      LYS  74 -28.268  10.716 -10.029

  No H/Q in entry =          13
  In of MODEL   14
    1    HA   PRO  75           HA       PRO  75 -33.061   6.314  -2.871
    2    HB2  PRO  75           HB2      PRO  75 -33.258   4.077  -4.444
    3    HB3  PRO  75           HB3      PRO  75 -34.444   5.379  -4.529
    4    HG2  PRO  75           HG2      PRO  75 -32.067   4.880  -6.279
    5    HG3  PRO  75           HG3      PRO  75 -33.730   5.240  -6.742
    6    HD2  PRO  75           HD2      PRO  75 -31.874   7.191  -6.692
    7    HD3  PRO  75           HD3      PRO  75 -33.527   7.518  -6.169

  No H/Q in entry =           7
  In of MODEL   14
    1    H    VAL  76           H        VAL  76 -31.573   5.331  -1.481
    2    HA   VAL  76           HA       VAL  76 -29.047   4.229  -2.562
    3    HB   VAL  76           HB       VAL  76 -29.423   5.693   0.085
    4   HG11  VAL  76          HG11      VAL  76 -27.000   4.507  -1.281
    5   HG13  VAL  76          HG12      VAL  76 -27.688   4.033   0.273
    6   HG12  VAL  76          HG13      VAL  76 -26.911   5.605   0.096
    7   HG22  VAL  76          HG21      VAL  76 -28.834   7.618  -0.806
    8   HG21  VAL  76          HG22      VAL  76 -29.332   6.891  -2.335
    9   HG23  VAL  76          HG23      VAL  76 -27.632   6.882  -1.866

  No H/Q in entry =           9
  In of MODEL   14
    1    H    GLU  77           H        GLU  77 -28.739   2.089  -1.937
    2    HA   GLU  77           HA       GLU  77 -29.512   1.280   0.714
    3    HB2  GLU  77           HB2      GLU  77 -31.039  -0.440   0.180
    4    HB3  GLU  77           HB3      GLU  77 -31.650   1.053  -0.535
    5    HG2  GLU  77           HG2      GLU  77 -30.989   0.313  -2.714
    6    HG3  GLU  77           HG3      GLU  77 -30.287  -1.151  -2.028

  No H/Q in entry =           6
  In of MODEL   14
    1    H    VAL  78           H        VAL  78 -29.096  -0.786   1.388
    2    HA   VAL  78           HA       VAL  78 -26.391  -1.441   0.525
    3    HB   VAL  78           HB       VAL  78 -28.077  -2.390   2.881
    4   HG11  VAL  78          HG11      VAL  78 -25.676  -3.518   1.781
    5   HG13  VAL  78          HG12      VAL  78 -26.573  -4.022   3.215
    6   HG12  VAL  78          HG13      VAL  78 -25.308  -2.801   3.350
    7   HG22  VAL  78          HG21      VAL  78 -26.692  -0.956   4.224
    8   HG21  VAL  78          HG22      VAL  78 -27.461  -0.027   2.937
    9   HG23  VAL  78          HG23      VAL  78 -25.761  -0.479   2.804

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ILE  79           H        ILE  79 -25.760  -3.328  -0.366
    2    HA   ILE  79           HA       ILE  79 -27.740  -4.904  -1.722
    3    HB   ILE  79           HB       ILE  79 -24.732  -5.294  -1.474
    4   HG12  ILE  79          HG12      ILE  79 -26.397  -4.276  -3.782
    5   HG13  ILE  79          HG13      ILE  79 -25.579  -3.222  -2.626
    6   HG22  ILE  79          HG21      ILE  79 -25.759  -6.534  -3.796
    7   HG21  ILE  79          HG22      ILE  79 -26.731  -7.093  -2.434
    8   HG23  ILE  79          HG23      ILE  79 -24.979  -7.291  -2.407
    9   HD13  ILE  79          HD11      ILE  79 -24.146  -3.280  -4.433
   10   HD12  ILE  79          HD12      ILE  79 -24.406  -5.004  -4.707
   11   HD11  ILE  79          HD13      ILE  79 -23.456  -4.464  -3.322

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ASP  80           H        ASP  80 -28.522  -6.861  -1.136
    2    HA   ASP  80           HA       ASP  80 -28.451  -7.745   1.515
    3    HB2  ASP  80           HB2      ASP  80 -30.162  -8.409  -0.135
    4    HB3  ASP  80           HB3      ASP  80 -28.953  -9.366  -0.989

  No H/Q in entry =           4
  In of MODEL   14
    1    H    SER  81           H        SER  81 -26.876  -8.803   2.665
    2    HA   SER  81           HA       SER  81 -24.340  -9.377   1.498
    3    HB2  SER  81           HB2      SER  81 -23.761 -10.370   3.677
    4    HB3  SER  81           HB3      SER  81 -24.535  -8.798   3.875
    5    HG   SER  81           HG       SER  81 -26.525 -10.109   4.097

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU  82           H        LEU  82 -26.956 -11.588   1.808
    2    HA   LEU  82           HA       LEU  82 -25.299 -13.886   1.313
    3    HB2  LEU  82           HB2      LEU  82 -28.257 -13.407   1.026
    4    HB3  LEU  82           HB3      LEU  82 -27.477 -14.977   0.838
    5    HG   LEU  82           HG       LEU  82 -27.509 -13.375   3.377
    6   HD13  LEU  82          HD11      LEU  82 -29.753 -14.116   2.880
    7   HD12  LEU  82          HD12      LEU  82 -29.083 -15.189   4.110
    8   HD11  LEU  82          HD13      LEU  82 -29.170 -15.720   2.431
    9   HD21  LEU  82          HD21      LEU  82 -26.425 -16.037   2.503
   10   HD23  LEU  82          HD22      LEU  82 -26.826 -15.733   4.193
   11   HD22  LEU  82          HD23      LEU  82 -25.608 -14.745   3.387

  No H/Q in entry =          11
  In of MODEL   14
    1    H    LEU  83           H        LEU  83 -27.339 -11.761  -0.634
    2    HA   LEU  83           HA       LEU  83 -27.056 -13.123  -3.095
    3    HB2  LEU  83           HB2      LEU  83 -27.602 -10.234  -2.467
    4    HB3  LEU  83           HB3      LEU  83 -27.591 -10.888  -4.104
    5    HG   LEU  83           HG       LEU  83 -29.624 -11.354  -1.943
    6   HD13  LEU  83          HD11      LEU  83 -30.453  -9.549  -3.024
    7   HD12  LEU  83          HD12      LEU  83 -30.855 -10.689  -4.306
    8   HD11  LEU  83          HD13      LEU  83 -29.360  -9.756  -4.391
    9   HD23  LEU  83          HD21      LEU  83 -29.683 -12.633  -4.661
   10   HD22  LEU  83          HD22      LEU  83 -30.647 -13.019  -3.237
   11   HD21  LEU  83          HD23      LEU  83 -28.938 -13.445  -3.285

  No H/Q in entry =          11
  In of MODEL   14
    1    H    TYR  84           H        TYR  84 -25.227 -10.643  -1.416
    2    HA   TYR  84           HA       TYR  84 -23.370 -10.083  -3.534
    3    HB2  TYR  84           HB2      TYR  84 -23.930  -8.558  -1.605
    4    HB3  TYR  84           HB3      TYR  84 -23.013  -9.647  -0.565
    5    HD1  TYR  84           HD1      TYR  84 -20.547  -9.964  -1.002
    6    HD2  TYR  84           HD2      TYR  84 -22.833  -6.900  -2.906
    7    HE1  TYR  84           HE1      TYR  84 -18.455  -8.787  -1.590
    8    HE2  TYR  84           HE2      TYR  84 -20.750  -5.718  -3.510
    9    HH   TYR  84           HH       TYR  84 -18.404  -5.603  -2.676

  No H/Q in entry =           9
  In of MODEL   14
    1    H    GLY  85           H        GLY  85 -23.066 -12.056  -0.575
    2    HA3  GLY  85           HA2      GLY  85 -20.443 -12.885  -1.031
    3    HA2  GLY  85           HA3      GLY  85 -21.643 -13.781  -0.098

  No H/Q in entry =           3
  In of MODEL   14
    1    H    LYS  86           H        LYS  86 -23.453 -14.249  -2.172
    2    HA   LYS  86           HA       LYS  86 -22.283 -16.580  -3.408
    3    HB2  LYS  86           HB2      LYS  86 -24.558 -16.467  -2.447
    4    HB3  LYS  86           HB3      LYS  86 -24.995 -15.279  -3.674
    5    HG2  LYS  86           HG2      LYS  86 -24.714 -16.955  -5.398
    6    HG3  LYS  86           HG3      LYS  86 -24.273 -18.143  -4.172
    7    HD2  LYS  86           HD2      LYS  86 -26.431 -17.792  -3.054
    8    HD3  LYS  86           HD3      LYS  86 -26.873 -16.603  -4.279
    9    HE2  LYS  86           HE2      LYS  86 -27.911 -18.732  -4.786
   10    HE3  LYS  86           HE3      LYS  86 -26.691 -18.358  -6.004
   11    HZ3  LYS  86           HZ1      LYS  86 -25.808 -20.328  -5.534
   12    HZ2  LYS  86           HZ2      LYS  86 -26.799 -20.539  -4.170
   13    HZ1  LYS  86           HZ3      LYS  86 -25.334 -19.694  -4.031

  No H/Q in entry =          13
  In of MODEL   14
    1    H    VAL  87           H        VAL  87 -22.409 -13.372  -4.322
    2    HA   VAL  87           HA       VAL  87 -22.148 -12.198  -6.267
    3    HB   VAL  87           HB       VAL  87 -20.950 -14.676  -7.546
    4   HG13  VAL  87          HG11      VAL  87 -19.784 -13.171  -8.885
    5   HG12  VAL  87          HG12      VAL  87 -19.853 -11.887  -7.678
    6   HG11  VAL  87          HG13      VAL  87 -21.286 -12.286  -8.624
    7   HG21  VAL  87          HG21      VAL  87 -19.758 -12.996  -5.367
    8   HG23  VAL  87          HG22      VAL  87 -18.759 -13.865  -6.529
    9   HG22  VAL  87          HG23      VAL  87 -19.861 -14.752  -5.476

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ASP  88           H        ASP  88 -24.634 -12.951  -5.931
    2    HA   ASP  88           HA       ASP  88 -25.680 -14.231  -8.330
    3    HB2  ASP  88           HB2      ASP  88 -26.682 -14.508  -6.012
    4    HB3  ASP  88           HB3      ASP  88 -27.211 -12.829  -6.126

  No H/Q in entry =           4
  In of MODEL   14
    1    H    GLY  89           H        GLY  89 -25.020 -12.953  -9.974
    2    HA3  GLY  89           HA2      GLY  89 -25.327 -10.192 -10.193
    3    HA2  GLY  89           HA3      GLY  89 -25.240 -11.318 -11.546

  No H/Q in entry =           3
  In of MODEL   14
    1    H    LEU  90           H        LEU  90 -27.626 -12.778 -11.109
    2    HA   LEU  90           HA       LEU  90 -29.515 -10.934 -12.247
    3    HB2  LEU  90           HB2      LEU  90 -29.466 -13.334 -12.814
    4    HB3  LEU  90           HB3      LEU  90 -29.966 -13.714 -11.166
    5    HG   LEU  90           HG       LEU  90 -32.132 -12.697 -11.553
    6   HD13  LEU  90          HD11      LEU  90 -32.021 -10.958 -13.037
    7   HD12  LEU  90          HD12      LEU  90 -32.494 -12.226 -14.170
    8   HD11  LEU  90          HD13      LEU  90 -30.801 -11.752 -14.036
    9   HD23  LEU  90          HD21      LEU  90 -31.969 -14.336 -13.977
   10   HD22  LEU  90          HD22      LEU  90 -32.951 -14.537 -12.527
   11   HD21  LEU  90          HD23      LEU  90 -31.271 -15.073 -12.535

  No H/Q in entry =          11
  In of MODEL   14
    1    H    GLY  91           H        GLY  91 -29.302 -12.407  -9.054
    2    HA3  GLY  91           HA2      GLY  91 -31.699 -11.397  -8.038
    3    HA2  GLY  91           HA3      GLY  91 -30.291 -11.860  -7.082

  No H/Q in entry =           3
  In of MODEL   14
    1    H    VAL  92           H        VAL  92 -28.451  -9.952  -7.936
    2    HA   VAL  92           HA       VAL  92 -29.360  -7.680  -6.407
    3    HB   VAL  92           HB       VAL  92 -26.782  -8.042  -7.981
    4   HG12  VAL  92          HG11      VAL  92 -27.052  -6.152  -5.667
    5   HG11  VAL  92          HG12      VAL  92 -27.729  -5.649  -7.218
    6   HG13  VAL  92          HG13      VAL  92 -26.014  -6.038  -7.090
    7   HG22  VAL  92          HG21      VAL  92 -26.498  -9.608  -6.376
    8   HG21  VAL  92          HG22      VAL  92 -27.686  -8.875  -5.298
    9   HG23  VAL  92          HG23      VAL  92 -26.061  -8.199  -5.410

  No H/Q in entry =           9
  In of MODEL   14
    1    H    LEU  93           H        LEU  93 -28.896  -8.343  -9.820
    2    HA   LEU  93           HA       LEU  93 -29.356  -5.732 -10.769
    3    HB2  LEU  93           HB2      LEU  93 -28.618  -7.564 -12.214
    4    HB3  LEU  93           HB3      LEU  93 -30.176  -8.363 -11.998
    5    HG   LEU  93           HG       LEU  93 -31.268  -6.456 -13.142
    6   HD11  LEU  93          HD11      LEU  93 -29.497  -4.773 -12.635
    7   HD13  LEU  93          HD12      LEU  93 -29.921  -4.834 -14.347
    8   HD12  LEU  93          HD13      LEU  93 -28.438  -5.597 -13.779
    9   HD23  LEU  93          HD21      LEU  93 -30.187  -6.987 -15.418
   10   HD22  LEU  93          HD22      LEU  93 -30.977  -8.276 -14.511
   11   HD21  LEU  93          HD23      LEU  93 -29.217  -8.139 -14.500

  No H/Q in entry =          11
  In of MODEL   14
    1    H    LYS  94           H        LYS  94 -31.618  -8.380  -9.921
    2    HA   LYS  94           HA       LYS  94 -34.021  -7.052 -10.572
    3    HB2  LYS  94           HB2      LYS  94 -33.422  -9.199  -8.542
    4    HB3  LYS  94           HB3      LYS  94 -35.048  -8.580  -8.826
    5    HG2  LYS  94           HG2      LYS  94 -34.908  -9.364 -11.155
    6    HG3  LYS  94           HG3      LYS  94 -33.317 -10.040 -10.811
    7    HD2  LYS  94           HD2      LYS  94 -34.388 -11.413  -8.985
    8    HD3  LYS  94           HD3      LYS  94 -35.955 -10.841  -9.556
    9    HE2  LYS  94           HE2      LYS  94 -35.381 -11.759 -11.813
   10    HE3  LYS  94           HE3      LYS  94 -33.936 -12.472 -11.094
   11    HZ3  LYS  94           HZ1      LYS  94 -35.713 -14.078 -11.268
   12    HZ2  LYS  94           HZ2      LYS  94 -36.740 -13.092 -10.339
   13    HZ1  LYS  94           HZ3      LYS  94 -35.352 -13.773  -9.637

  No H/Q in entry =          13
  In of MODEL   14
    1    H    ALA  95           H        ALA  95 -32.216  -7.070  -7.509
    2    HA   ALA  95           HA       ALA  95 -34.147  -5.568  -6.052
    3    HB2  ALA  95           HB1      ALA  95 -31.716  -6.829  -5.490
    4    HB3  ALA  95           HB2      ALA  95 -32.743  -5.963  -4.350
    5    HB1  ALA  95           HB3      ALA  95 -31.427  -5.120  -5.166

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA  96           H        ALA  96 -31.532  -4.607  -8.137
    2    HA   ALA  96           HA       ALA  96 -31.568  -1.839  -7.378
    3    HB2  ALA  96           HB1      ALA  96 -30.203  -1.562  -9.480
    4    HB3  ALA  96           HB2      ALA  96 -30.425  -3.284  -9.791
    5    HB1  ALA  96           HB3      ALA  96 -29.545  -2.754  -8.358

  No H/Q in entry =           5
  In of MODEL   14
    1    H    VAL  97           H        VAL  97 -33.000  -3.637 -10.065
    2    HA   VAL  97           HA       VAL  97 -34.165  -1.396 -11.343
    3    HB   VAL  97           HB       VAL  97 -34.841  -4.355 -11.373
    4   HG11  VAL  97          HG11      VAL  97 -36.718  -2.434 -11.884
    5   HG13  VAL  97          HG12      VAL  97 -36.699  -4.032 -12.631
    6   HG12  VAL  97          HG13      VAL  97 -36.001  -2.656 -13.481
    7   HG21  VAL  97          HG21      VAL  97 -33.630  -2.483 -13.410
    8   HG23  VAL  97          HG22      VAL  97 -34.005  -4.183 -13.693
    9   HG22  VAL  97          HG23      VAL  97 -32.783  -3.734 -12.501

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ALA  98           H        ALA  98 -35.267  -3.611  -8.802
    2    HA   ALA  98           HA       ALA  98 -37.879  -2.576  -8.476
    3    HB1  ALA  98           HB1      ALA  98 -36.776  -4.722  -7.423
    4    HB3  ALA  98           HB2      ALA  98 -38.003  -3.846  -6.506
    5    HB2  ALA  98           HB3      ALA  98 -36.294  -3.619  -6.134

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA  99           H        ALA  99 -34.850  -1.632  -6.812
    2    HA   ALA  99           HA       ALA  99 -36.079   0.308  -5.169
    3    HB1  ALA  99           HB1      ALA  99 -33.388  -0.467  -5.893
    4    HB2  ALA  99           HB2      ALA  99 -33.982   0.266  -4.403
    5    HB3  ALA  99           HB3      ALA  99 -33.541   1.286  -5.772

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ILE 100           H        ILE 100 -35.021   0.467  -8.518
    2    HA   ILE 100           HA       ILE 100 -35.322   3.304  -8.755
    3    HB   ILE 100           HB       ILE 100 -35.308   1.136 -10.882
    4   HG12  ILE 100          HG12      ILE 100 -33.238   3.224 -10.207
    5   HG13  ILE 100          HG13      ILE 100 -33.207   1.580  -9.568
    6   HG21  ILE 100          HG21      ILE 100 -35.856   4.034 -11.031
    7   HG23  ILE 100          HG22      ILE 100 -36.298   2.739 -12.144
    8   HG22  ILE 100          HG23      ILE 100 -34.674   3.426 -12.191
    9   HD12  ILE 100          HD11      ILE 100 -32.697   2.546 -12.343
   10   HD11  ILE 100          HD12      ILE 100 -33.288   0.905 -12.084
   11   HD13  ILE 100          HD13      ILE 100 -31.768   1.419 -11.356

  No H/Q in entry =          11
  In of MODEL   14
    1    H    LYS 101           H        LYS 101 -37.495   0.594  -9.483
    2    HA   LYS 101           HA       LYS 101 -39.638   2.146 -10.505
    3    HB2  LYS 101           HB2      LYS 101 -39.411  -0.615  -9.363
    4    HB3  LYS 101           HB3      LYS 101 -40.991   0.077  -9.723
    5    HG2  LYS 101           HG2      LYS 101 -40.507   0.221 -12.017
    6    HG3  LYS 101           HG3      LYS 101 -38.797  -0.110 -11.749
    7    HD2  LYS 101           HD2      LYS 101 -39.957  -2.074 -12.634
    8    HD3  LYS 101           HD3      LYS 101 -39.327  -2.369 -11.013
    9    HE2  LYS 101           HE2      LYS 101 -41.362  -3.151 -10.517
   10    HE3  LYS 101           HE3      LYS 101 -41.892  -1.467 -10.532
   11    HZ3  LYS 101           HZ1      LYS 101 -42.761  -1.673 -12.655
   12    HZ2  LYS 101           HZ2      LYS 101 -43.162  -3.162 -11.943
   13    HZ1  LYS 101           HZ3      LYS 101 -41.852  -3.062 -13.018

  No H/Q in entry =          13
  In of MODEL   14
    1    H    LYS 102           H        LYS 102 -39.107   0.706  -7.286
    2    HA   LYS 102           HA       LYS 102 -41.413   1.809  -6.111
    3    HB2  LYS 102           HB2      LYS 102 -40.104   0.003  -5.077
    4    HB3  LYS 102           HB3      LYS 102 -38.762   1.118  -4.828
    5    HG2  LYS 102           HG2      LYS 102 -40.148   2.461  -3.348
    6    HG3  LYS 102           HG3      LYS 102 -41.494   1.350  -3.599
    7    HD2  LYS 102           HD2      LYS 102 -40.196  -0.457  -2.554
    8    HD3  LYS 102           HD3      LYS 102 -38.852   0.657  -2.302
    9    HE2  LYS 102           HE2      LYS 102 -40.279   2.081  -0.910
   10    HE3  LYS 102           HE3      LYS 102 -41.642   0.999  -1.184
   11    HZ1  LYS 102           HZ1      LYS 102 -39.855  -0.675  -0.160
   12    HZ3  LYS 102           HZ2      LYS 102 -41.010   0.165   0.758
   13    HZ2  LYS 102           HZ3      LYS 102 -39.422   0.758   0.640

  No H/Q in entry =          13
  In of MODEL   14
    1    H    ALA 103           H        ALA 103 -38.513   3.323  -7.108
    2    HA   ALA 103           HA       ALA 103 -38.849   5.633  -5.339
    3    HB2  ALA 103           HB1      ALA 103 -36.880   6.446  -6.903
    4    HB3  ALA 103           HB2      ALA 103 -36.767   4.730  -7.293
    5    HB1  ALA 103           HB3      ALA 103 -36.576   5.270  -5.626

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA 104           H        ALA 104 -39.413   4.861  -8.686
    2    HA   ALA 104           HA       ALA 104 -40.113   7.615  -9.326
    3    HB2  ALA 104           HB1      ALA 104 -40.111   6.936 -11.525
    4    HB1  ALA 104           HB2      ALA 104 -40.773   5.347 -11.145
    5    HB3  ALA 104           HB3      ALA 104 -39.066   5.685 -10.855

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA 105           H        ALA 105 -41.643   5.451  -7.524
    2    HA   ALA 105           HA       ALA 105 -44.126   6.738  -7.522
    3    HB2  ALA 105           HB1      ALA 105 -44.816   5.839  -9.561
    4    HB3  ALA 105           HB2      ALA 105 -45.410   4.629  -8.424
    5    HB1  ALA 105           HB3      ALA 105 -43.920   4.340  -9.320

  No H/Q in entry =           5
  In of MODEL   15
    1    H1   ALA   1           H3       ALA   1 -11.977 -16.155  -2.372
    2    H2   ALA   1           H2       ALA   1 -11.016 -17.280  -3.214
    3    H3   ALA   1           H1       ALA   1 -12.180 -16.358  -4.045
    4    HA   ALA   1           HA       ALA   1 -13.546 -18.084  -3.800
    5    HB3  ALA   1           HB1      ALA   1 -12.116 -19.828  -3.340
    6    HB1  ALA   1           HB2      ALA   1 -12.870 -19.728  -1.749
    7    HB2  ALA   1           HB3      ALA   1 -11.309 -18.959  -2.035

  No H/Q in entry =           7
  In of MODEL   15
    1    H    GLU   2           H        GLU   2 -15.148 -18.966  -2.140
    2    HA   GLU   2           HA       GLU   2 -16.825 -17.276  -1.079
    3    HB2  GLU   2           HB2      GLU   2 -15.837 -19.682   0.466
    4    HB3  GLU   2           HB3      GLU   2 -17.376 -18.860   0.723
    5    HG2  GLU   2           HG2      GLU   2 -18.339 -19.966  -1.008
    6    HG3  GLU   2           HG3      GLU   2 -17.027 -19.542  -2.096

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLU   3           H        GLU   3 -14.881 -18.590   1.541
    2    HA   GLU   3           HA       GLU   3 -15.142 -16.240   3.096
    3    HB2  GLU   3           HB2      GLU   3 -13.509 -18.756   3.345
    4    HB3  GLU   3           HB3      GLU   3 -13.299 -17.431   4.490
    5    HG2  GLU   3           HG2      GLU   3 -15.487 -17.623   5.314
    6    HG3  GLU   3           HG3      GLU   3 -16.071 -18.435   3.868

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LEU   4           H        LEU   4 -12.164 -17.665   1.699
    2    HA   LEU   4           HA       LEU   4 -10.364 -15.727   2.290
    3    HB2  LEU   4           HB2      LEU   4 -10.577 -17.032  -0.433
    4    HB3  LEU   4           HB3      LEU   4  -9.137 -16.284   0.248
    5    HG   LEU   4           HG       LEU   4 -10.584 -18.707   1.367
    6   HD13  LEU   4          HD11      LEU   4  -8.929 -20.033   0.435
    7   HD12  LEU   4          HD12      LEU   4  -7.743 -18.728   0.403
    8   HD11  LEU   4          HD13      LEU   4  -9.034 -18.775  -0.796
    9   HD23  LEU   4          HD21      LEU   4  -8.328 -18.727   2.743
   10   HD22  LEU   4          HD22      LEU   4  -9.667 -17.712   3.274
   11   HD21  LEU   4          HD23      LEU   4  -8.320 -16.999   2.387

  No H/Q in entry =          11
  In of MODEL   15
    1    H    GLU   5           H        GLU   5 -12.709 -15.566  -0.378
    2    HA   GLU   5           HA       GLU   5 -11.754 -13.066  -1.384
    3    HB2  GLU   5           HB2      GLU   5 -13.073 -14.677  -2.741
    4    HB3  GLU   5           HB3      GLU   5 -14.477 -14.341  -1.728
    5    HG2  GLU   5           HG2      GLU   5 -14.393 -11.969  -2.370
    6    HG3  GLU   5           HG3      GLU   5 -12.970 -12.282  -3.364

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLU   6           H        GLU   6 -14.458 -13.992   0.716
    2    HA   GLU   6           HA       GLU   6 -15.410 -11.332   1.115
    3    HB2  GLU   6           HB2      GLU   6 -15.778 -13.883   2.699
    4    HB3  GLU   6           HB3      GLU   6 -16.594 -12.369   3.086
    5    HG2  GLU   6           HG2      GLU   6 -17.644 -12.330   0.881
    6    HG3  GLU   6           HG3      GLU   6 -16.770 -13.786   0.412

  No H/Q in entry =           6
  In of MODEL   15
    1    H    VAL   7           H        VAL   7 -13.061 -13.398   2.683
    2    HA   VAL   7           HA       VAL   7 -12.618 -11.812   5.007
    3    HB   VAL   7           HB       VAL   7 -10.880 -13.826   3.556
    4   HG11  VAL   7          HG11      VAL   7 -10.434 -12.281   6.117
    5   HG13  VAL   7          HG12      VAL   7  -9.333 -12.477   4.754
    6   HG12  VAL   7          HG13      VAL   7  -9.659 -13.839   5.826
    7   HG21  VAL   7          HG21      VAL   7 -13.117 -14.430   4.782
    8   HG23  VAL   7          HG22      VAL   7 -12.192 -14.137   6.255
    9   HG22  VAL   7          HG23      VAL   7 -11.678 -15.389   5.125

  No H/Q in entry =           9
  In of MODEL   15
    1    H    VAL   8           H        VAL   8 -11.112 -11.902   1.794
    2    HA   VAL   8           HA       VAL   8  -9.083  -9.991   2.280
    3    HB   VAL   8           HB       VAL   8 -10.540 -10.706  -0.277
    4   HG11  VAL   8          HG11      VAL   8  -8.101  -8.977   0.228
    5   HG13  VAL   8          HG12      VAL   8  -9.604  -8.504  -0.565
    6   HG12  VAL   8          HG13      VAL   8  -8.510  -9.639  -1.357
    7   HG21  VAL   8          HG21      VAL   8  -8.842 -12.276   1.205
    8   HG23  VAL   8          HG22      VAL   8  -7.688 -11.427   0.181
    9   HG22  VAL   8          HG23      VAL   8  -8.972 -12.385  -0.551

  No H/Q in entry =           9
  In of MODEL   15
    1    H    MET   9           H        MET   9 -12.438  -9.665   1.127
    2    HA   MET   9           HA       MET   9 -12.427  -6.888   0.689
    3    HB2  MET   9           HB2      MET   9 -14.572  -8.853   1.445
    4    HB3  MET   9           HB3      MET   9 -14.929  -7.127   1.395
    5    HG2  MET   9           HG2      MET   9 -13.864  -7.156  -0.952
    6    HG3  MET   9           HG3      MET   9 -14.012  -8.912  -0.858
    7    HE1  MET   9           HE1      MET   9 -15.877 -10.232  -0.825
    8    HE3  MET   9           HE2      MET   9 -17.575  -9.789  -0.977
    9    HE2  MET   9           HE3      MET   9 -16.759  -9.601   0.573

  No H/Q in entry =           9
  In of MODEL   15
    1    H    GLY  10           H        GLY  10 -13.048  -8.788   3.620
    2    HA3  GLY  10           HA2      GLY  10 -13.632  -6.612   5.338
    3    HA2  GLY  10           HA3      GLY  10 -13.037  -8.189   5.852

  No H/Q in entry =           3
  In of MODEL   15
    1    H    LEU  11           H        LEU  11 -10.593  -8.269   4.532
    2    HA   LEU  11           HA       LEU  11  -8.915  -6.801   6.283
    3    HB2  LEU  11           HB2      LEU  11  -8.348  -8.218   3.676
    4    HB3  LEU  11           HB3      LEU  11  -7.089  -7.488   4.670
    5    HG   LEU  11           HG       LEU  11  -9.050  -9.557   5.694
    6   HD13  LEU  11          HD11      LEU  11  -7.809 -10.773   4.128
    7   HD12  LEU  11          HD12      LEU  11  -6.866 -10.992   5.601
    8   HD11  LEU  11          HD13      LEU  11  -6.350  -9.818   4.391
    9   HD22  LEU  11          HD21      LEU  11  -8.212  -8.526   7.608
   10   HD21  LEU  11          HD22      LEU  11  -6.684  -8.096   6.841
   11   HD23  LEU  11          HD23      LEU  11  -6.977  -9.758   7.353

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  12           H        ILE  12  -9.835  -6.276   2.895
    2    HA   ILE  12           HA       ILE  12  -8.188  -4.014   2.461
    3    HB   ILE  12           HB       ILE  12 -10.829  -4.743   1.173
    4   HG12  ILE  12          HG12      ILE  12  -8.768  -6.352   1.087
    5   HG13  ILE  12          HG13      ILE  12  -9.621  -5.996  -0.401
    6   HG21  ILE  12          HG21      ILE  12  -8.648  -2.811   0.319
    7   HG23  ILE  12          HG22      ILE  12 -10.306  -2.398   0.735
    8   HG22  ILE  12          HG23      ILE  12  -9.961  -3.335  -0.689
    9   HD13  ILE  12          HD11      ILE  12  -7.917  -4.390  -1.028
   10   HD12  ILE  12          HD12      ILE  12  -7.122  -5.900  -0.588
   11   HD11  ILE  12          HD13      ILE  12  -7.130  -4.557   0.530

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  13           H        ILE  13 -11.540  -4.345   3.563
    2    HA   ILE  13           HA       ILE  13 -12.054  -1.567   3.830
    3    HB   ILE  13           HB       ILE  13 -13.207  -4.007   5.203
    4   HG12  ILE  13          HG12      ILE  13 -13.445  -3.490   2.664
    5   HG13  ILE  13          HG13      ILE  13 -14.865  -3.961   3.572
    6   HG22  ILE  13          HG21      ILE  13 -15.117  -2.462   5.825
    7   HG21  ILE  13          HG22      ILE  13 -14.084  -1.105   5.399
    8   HG23  ILE  13          HG23      ILE  13 -13.627  -2.179   6.719
    9   HD11  ILE  13          HD11      ILE  13 -14.257  -1.046   3.447
   10   HD13  ILE  13          HD12      ILE  13 -15.797  -1.882   3.478
   11   HD12  ILE  13          HD13      ILE  13 -14.883  -1.823   1.988

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ASN  14           H        ASN  14 -10.889  -4.032   6.105
    2    HA   ASN  14           HA       ASN  14 -10.716  -2.388   8.388
    3    HB2  ASN  14           HB2      ASN  14 -10.412  -4.990   8.069
    4    HB3  ASN  14           HB3      ASN  14  -8.711  -4.569   7.908
    5   HD21  ASN  14          HD21      ASN  14  -9.312  -6.103  10.087
    6   HD22  ASN  14          HD22      ASN  14  -9.300  -5.181  11.510

  No H/Q in entry =           6
  In of MODEL   15
    1    H    SER  15           H        SER  15  -8.303  -3.166   5.893
    2    HA   SER  15           HA       SER  15  -6.188  -1.629   6.958
    3    HB2  SER  15           HB2      SER  15  -5.168  -1.826   4.798
    4    HB3  SER  15           HB3      SER  15  -6.093  -3.306   5.027
    5    HG   SER  15           HG       SER  15  -6.934  -2.728   3.182

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLY  16           H        GLY  16  -8.811  -0.818   4.716
    2    HA3  GLY  16           HA2      GLY  16  -8.009   1.839   4.159
    3    HA2  GLY  16           HA3      GLY  16  -9.647   1.210   4.001

  No H/Q in entry =           3
  In of MODEL   15
    1    H    GLN  17           H        GLN  17 -10.169   0.477   6.653
    2    HA   GLN  17           HA       GLN  17 -10.926   2.968   7.792
    3    HB2  GLN  17           HB2      GLN  17 -12.105   0.844   8.277
    4    HB3  GLN  17           HB3      GLN  17 -10.687   0.274   9.158
    5    HG2  GLN  17           HG2      GLN  17 -10.884   2.204  10.700
    6    HG3  GLN  17           HG3      GLN  17 -12.326   2.735   9.834
    7   HE21  GLN  17          HE21      GLN  17 -14.008   2.295  11.298
    8   HE22  GLN  17          HE22      GLN  17 -14.273   0.780  12.016

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ALA  18           H        ALA  18  -8.249   0.743   8.409
    2    HA   ALA  18           HA       ALA  18  -7.172   1.985  10.675
    3    HB2  ALA  18           HB1      ALA  18  -6.518  -0.219   9.310
    4    HB3  ALA  18           HB2      ALA  18  -5.370   0.590  10.377
    5    HB1  ALA  18           HB3      ALA  18  -5.302   0.868   8.635

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ARG  19           H        ARG  19  -6.419   2.520   7.224
    2    HA   ARG  19           HA       ARG  19  -4.565   4.609   7.646
    3    HB2  ARG  19           HB2      ARG  19  -4.872   3.458   5.453
    4    HB3  ARG  19           HB3      ARG  19  -6.432   4.265   5.278
    5    HG2  ARG  19           HG2      ARG  19  -5.351   6.461   5.341
    6    HG3  ARG  19           HG3      ARG  19  -3.785   5.709   5.643
    7    HD2  ARG  19           HD2      ARG  19  -3.927   6.293   3.300
    8    HD3  ARG  19           HD3      ARG  19  -3.974   4.532   3.448
    9    HE   ARG  19           HE       ARG  19  -6.627   5.384   3.444
   10   HH21  ARG  19          HH11      ARG  19  -7.828   5.511   1.528
   11   HH22  ARG  19          HH12      ARG  19  -7.012   5.605   0.007
   12   HH11  ARG  19          HH21      ARG  19  -3.857   5.504   1.405
   13   HH12  ARG  19          HH22      ARG  19  -4.762   5.598  -0.063

  No H/Q in entry =          13
  In of MODEL   15
    1    H    SER  20           H        SER  20  -8.066   4.647   7.053
    2    HA   SER  20           HA       SER  20  -8.483   7.394   7.001
    3    HB2  SER  20           HB2      SER  20 -10.245   5.744   6.511
    4    HB3  SER  20           HB3      SER  20 -10.281   5.281   8.210
    5    HG   SER  20           HG       SER  20 -10.501   7.987   7.676

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU  21           H        LEU  21  -8.430   5.216   9.809
    2    HA   LEU  21           HA       LEU  21  -8.911   7.204  11.772
    3    HB2  LEU  21           HB2      LEU  21  -7.492   4.537  11.939
    4    HB3  LEU  21           HB3      LEU  21  -7.836   5.548  13.339
    5    HG   LEU  21           HG       LEU  21  -9.970   4.588  11.408
    6   HD11  LEU  21          HD11      LEU  21  -8.860   3.364  13.929
    7   HD13  LEU  21          HD12      LEU  21  -9.186   2.590  12.379
    8   HD12  LEU  21          HD13      LEU  21 -10.524   3.059  13.429
    9   HD22  LEU  21          HD21      LEU  21 -10.962   6.358  12.552
   10   HD21  LEU  21          HD22      LEU  21  -9.964   6.145  13.986
   11   HD23  LEU  21          HD23      LEU  21 -11.305   5.052  13.684

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ALA  22           H        ALA  22  -5.931   5.895  10.361
    2    HA   ALA  22           HA       ALA  22  -4.078   7.253  11.977
    3    HB2  ALA  22           HB1      ALA  22  -3.624   5.407  10.288
    4    HB1  ALA  22           HB2      ALA  22  -2.457   6.729  10.319
    5    HB3  ALA  22           HB3      ALA  22  -3.676   6.656   9.045

  No H/Q in entry =           5
  In of MODEL   15
    1    H    TYR  23           H        TYR  23  -5.424   8.235   8.795
    2    HA   TYR  23           HA       TYR  23  -4.145  10.761   8.719
    3    HB2  TYR  23           HB2      TYR  23  -5.206   9.824   6.730
    4    HB3  TYR  23           HB3      TYR  23  -6.785   9.892   7.514
    5    HD1  TYR  23           HD1      TYR  23  -3.938  12.008   6.358
    6    HD2  TYR  23           HD2      TYR  23  -8.076  11.870   7.496
    7    HE1  TYR  23           HE1      TYR  23  -4.224  14.352   5.598
    8    HE2  TYR  23           HE2      TYR  23  -8.364  14.213   6.736
    9    HH   TYR  23           HH       TYR  23  -7.007  15.725   4.897

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ALA  24           H        ALA  24  -7.239   9.715  10.105
    2    HA   ALA  24           HA       ALA  24  -8.132  12.287  10.874
    3    HB1  ALA  24           HB1      ALA  24  -9.921  10.995  11.346
    4    HB2  ALA  24           HB2      ALA  24  -9.080  10.445  12.794
    5    HB3  ALA  24           HB3      ALA  24  -8.937   9.534  11.291

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA  25           H        ALA  25  -6.073   9.877  12.448
    2    HA   ALA  25           HA       ALA  25  -5.759  11.141  14.948
    3    HB2  ALA  25           HB1      ALA  25  -4.940   8.805  14.129
    4    HB3  ALA  25           HB2      ALA  25  -3.943   9.688  15.287
    5    HB1  ALA  25           HB3      ALA  25  -3.509   9.678  13.577

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU  26           H        LEU  26  -3.981  11.475  11.904
    2    HA   LEU  26           HA       LEU  26  -2.062  13.340  12.814
    3    HB2  LEU  26           HB2      LEU  26  -1.738  12.192  10.711
    4    HB3  LEU  26           HB3      LEU  26  -3.228  12.866  10.058
    5    HG   LEU  26           HG       LEU  26  -2.264  15.139  10.188
    6   HD12  LEU  26          HD11      LEU  26   0.274  15.216  10.598
    7   HD11  LEU  26          HD12      LEU  26   0.087  13.632  11.345
    8   HD13  LEU  26          HD13      LEU  26  -0.751  15.030  12.021
    9   HD21  LEU  26          HD21      LEU  26  -0.478  13.122   8.794
   10   HD23  LEU  26          HD22      LEU  26  -0.560  14.841   8.421
   11   HD22  LEU  26          HD23      LEU  26  -1.961  13.811   8.136

  No H/Q in entry =          11
  In of MODEL   15
    1    H    LYS  27           H        LYS  27  -5.257  13.749  11.341
    2    HA   LYS  27           HA       LYS  27  -5.264  16.538  11.139
    3    HB2  LYS  27           HB2      LYS  27  -6.976  15.021  10.158
    4    HB3  LYS  27           HB3      LYS  27  -7.624  14.752  11.776
    5    HG2  LYS  27           HG2      LYS  27  -8.107  17.148  12.009
    6    HG3  LYS  27           HG3      LYS  27  -7.408  17.459  10.416
    7    HD2  LYS  27           HD2      LYS  27  -9.110  15.985   9.385
    8    HD3  LYS  27           HD3      LYS  27  -9.815  15.691  10.977
    9    HE2  LYS  27           HE2      LYS  27 -10.311  18.092  11.217
   10    HE3  LYS  27           HE3      LYS  27  -9.578  18.408   9.640
   11    HZ3  LYS  27           HZ1      LYS  27 -11.953  18.230   9.403
   12    HZ2  LYS  27           HZ2      LYS  27 -11.966  16.714  10.175
   13    HZ1  LYS  27           HZ3      LYS  27 -11.227  16.892   8.652

  No H/Q in entry =          13
  In of MODEL   15
    1    H    GLN  28           H        GLN  28  -6.102  14.437  13.871
    2    HA   GLN  28           HA       GLN  28  -7.038  16.424  15.645
    3    HB2  GLN  28           HB2      GLN  28  -5.575  13.827  16.192
    4    HB3  GLN  28           HB3      GLN  28  -6.343  14.815  17.436
    5    HG2  GLN  28           HG2      GLN  28  -7.773  13.655  15.028
    6    HG3  GLN  28           HG3      GLN  28  -7.816  12.966  16.649
    7   HE21  GLN  28          HE21      GLN  28  -9.713  14.741  14.669
    8   HE22  GLN  28          HE22      GLN  28 -10.494  15.734  15.804

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ALA  29           H        ALA  29  -3.793  15.196  14.952
    2    HA   ALA  29           HA       ALA  29  -2.381  16.627  16.926
    3    HB1  ALA  29           HB1      ALA  29  -0.439  15.975  15.804
    4    HB3  ALA  29           HB2      ALA  29  -1.198  16.081  14.216
    5    HB2  ALA  29           HB3      ALA  29  -1.590  14.741  15.294

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LYS  30           H        LYS  30  -3.263  17.483  13.596
    2    HA   LYS  30           HA       LYS  30  -1.903  19.951  13.490
    3    HB2  LYS  30           HB2      LYS  30  -4.418  19.025  12.087
    4    HB3  LYS  30           HB3      LYS  30  -3.615  20.555  11.739
    5    HG2  LYS  30           HG2      LYS  30  -1.521  19.302  11.224
    6    HG3  LYS  30           HG3      LYS  30  -2.398  17.789  11.473
    7    HD2  LYS  30           HD2      LYS  30  -3.977  18.396   9.680
    8    HD3  LYS  30           HD3      LYS  30  -3.124  19.921   9.433
    9    HE2  LYS  30           HE2      LYS  30  -1.068  18.667   8.852
   10    HE3  LYS  30           HE3      LYS  30  -1.941  17.147   9.067
   11    HZ2  LYS  30           HZ1      LYS  30  -1.786  18.018   6.724
   12    HZ1  LYS  30           HZ2      LYS  30  -2.853  19.261   7.192
   13    HZ3  LYS  30           HZ3      LYS  30  -3.346  17.634   7.267

  No H/Q in entry =          13
  In of MODEL   15
    1    H    GLN  31           H        GLN  31  -4.983  19.042  14.909
    2    HA   GLN  31           HA       GLN  31  -5.797  21.785  15.359
    3    HB2  GLN  31           HB2      GLN  31  -6.928  19.319  16.688
    4    HB3  GLN  31           HB3      GLN  31  -7.717  20.876  16.442
    5    HG2  GLN  31           HG2      GLN  31  -6.998  20.108  13.851
    6    HG3  GLN  31           HG3      GLN  31  -7.494  18.596  14.601
    7   HE21  GLN  31          HE21      GLN  31  -8.937  20.141  12.501
    8   HE22  GLN  31          HE22      GLN  31 -10.456  20.505  13.161

  No H/Q in entry =           8
  In of MODEL   15
    1    H    GLY  32           H        GLY  32  -3.447  19.901  16.677
    2    HA3  GLY  32           HA2      GLY  32  -2.051  20.391  18.476
    3    HA2  GLY  32           HA3      GLY  32  -3.202  21.614  19.000

  No H/Q in entry =           3
  In of MODEL   15
    1    H    ASP  33           H        ASP  33  -4.571  18.549  18.345
    2    HA   ASP  33           HA       ASP  33  -4.967  18.087  21.226
    3    HB2  ASP  33           HB2      ASP  33  -6.360  17.048  18.753
    4    HB3  ASP  33           HB3      ASP  33  -6.691  16.433  20.371

  No H/Q in entry =           4
  In of MODEL   15
    1    H    PHE  34           H        PHE  34  -2.783  17.275  21.528
    2    HA   PHE  34           HA       PHE  34  -1.746  15.043  20.127
    3    HB2  PHE  34           HB2      PHE  34  -1.140  16.041  22.919
    4    HB3  PHE  34           HB3      PHE  34  -0.192  14.834  22.051
    5    HD1  PHE  34           HD1      PHE  34  -0.423  18.257  22.783
    6    HD2  PHE  34           HD2      PHE  34   0.448  15.565  19.549
    7    HE1  PHE  34           HE1      PHE  34   0.838  20.050  21.624
    8    HE2  PHE  34           HE2      PHE  34   1.704  17.361  18.395
    9    HZ   PHE  34           HZ       PHE  34   1.901  19.600  19.437

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ALA  35           H        ALA  35  -3.784  15.287  22.994
    2    HA   ALA  35           HA       ALA  35  -3.522  12.630  23.893
    3    HB3  ALA  35           HB1      ALA  35  -5.989  13.213  24.755
    4    HB1  ALA  35           HB2      ALA  35  -5.485  14.840  24.297
    5    HB2  ALA  35           HB3      ALA  35  -4.552  13.933  25.487

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA  36           H        ALA  36  -6.004  14.101  21.797
    2    HA   ALA  36           HA       ALA  36  -7.377  11.664  21.325
    3    HB1  ALA  36           HB1      ALA  36  -8.860  13.060  20.371
    4    HB3  ALA  36           HB2      ALA  36  -7.698  13.499  19.119
    5    HB2  ALA  36           HB3      ALA  36  -7.735  14.388  20.642

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA  37           H        ALA  37  -4.729  13.297  19.649
    2    HA   ALA  37           HA       ALA  37  -4.670  11.660  17.353
    3    HB3  ALA  37           HB1      ALA  37  -2.705  13.408  18.770
    4    HB2  ALA  37           HB2      ALA  37  -3.240  13.453  17.091
    5    HB1  ALA  37           HB3      ALA  37  -2.064  12.244  17.610

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LYS  38           H        LYS  38  -2.901  11.388  20.427
    2    HA   LYS  38           HA       LYS  38  -1.534   9.012  19.937
    3    HB2  LYS  38           HB2      LYS  38  -1.884  10.770  22.082
    4    HB3  LYS  38           HB3      LYS  38  -2.474   9.231  22.701
    5    HG2  LYS  38           HG2      LYS  38  -0.361   8.147  22.161
    6    HG3  LYS  38           HG3      LYS  38   0.220   9.602  21.345
    7    HD2  LYS  38           HD2      LYS  38   0.372  10.825  23.378
    8    HD3  LYS  38           HD3      LYS  38  -0.625   9.658  24.249
    9    HE2  LYS  38           HE2      LYS  38   1.737   9.384  24.863
   10    HE3  LYS  38           HE3      LYS  38   1.156   7.957  24.001
   11    HZ3  LYS  38           HZ1      LYS  38   2.445   8.397  22.217
   12    HZ2  LYS  38           HZ2      LYS  38   3.388   9.243  23.350
   13    HZ1  LYS  38           HZ3      LYS  38   2.291  10.083  22.361

  No H/Q in entry =          13
  In of MODEL   15
    1    H    ALA  39           H        ALA  39  -4.778   9.450  21.347
    2    HA   ALA  39           HA       ALA  39  -5.289   6.722  21.855
    3    HB3  ALA  39           HB1      ALA  39  -7.483   8.627  21.091
    4    HB2  ALA  39           HB2      ALA  39  -6.586   8.871  22.590
    5    HB1  ALA  39           HB3      ALA  39  -7.477   7.371  22.330

  No H/Q in entry =           5
  In of MODEL   15
    1    H    MET  40           H        MET  40  -5.916   8.722  19.008
    2    HA   MET  40           HA       MET  40  -7.361   6.762  17.553
    3    HB2  MET  40           HB2      MET  40  -5.796   9.185  16.642
    4    HB3  MET  40           HB3      MET  40  -6.807   8.207  15.575
    5    HG2  MET  40           HG2      MET  40  -7.858   9.439  18.135
    6    HG3  MET  40           HG3      MET  40  -7.934  10.272  16.584
    7    HE3  MET  40           HE1      MET  40 -10.492   8.604  14.527
    8    HE2  MET  40           HE2      MET  40  -8.743   8.753  14.374
    9    HE1  MET  40           HE3      MET  40  -9.683  10.102  15.009

  No H/Q in entry =           9
  In of MODEL   15
    1    H    MET  41           H        MET  41  -3.883   7.563  17.667
    2    HA   MET  41           HA       MET  41  -3.098   5.820  15.566
    3    HB2  MET  41           HB2      MET  41  -1.488   6.518  18.035
    4    HB3  MET  41           HB3      MET  41  -0.862   5.880  16.519
    5    HG2  MET  41           HG2      MET  41  -2.061   8.041  15.515
    6    HG3  MET  41           HG3      MET  41  -1.831   8.634  17.159
    7    HE2  MET  41           HE1      MET  41   1.125   6.590  17.516
    8    HE1  MET  41           HE2      MET  41   0.315   7.870  18.415
    9    HE3  MET  41           HE3      MET  41   1.932   8.142  17.768

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ASP  42           H        ASP  42  -3.466   5.343  19.053
    2    HA   ASP  42           HA       ASP  42  -2.382   2.769  19.214
    3    HB2  ASP  42           HB2      ASP  42  -3.284   4.514  21.036
    4    HB3  ASP  42           HB3      ASP  42  -4.693   3.462  20.968

  No H/Q in entry =           4
  In of MODEL   15
    1    H    GLN  43           H        GLN  43  -5.737   3.811  18.719
    2    HA   GLN  43           HA       GLN  43  -6.833   1.202  18.529
    3    HB2  GLN  43           HB2      GLN  43  -7.807   3.836  17.400
    4    HB3  GLN  43           HB3      GLN  43  -8.742   2.339  17.381
    5    HG2  GLN  43           HG2      GLN  43  -8.442   2.225  19.888
    6    HG3  GLN  43           HG3      GLN  43  -7.747   3.844  19.814
    7   HE21  GLN  43          HE21      GLN  43  -9.925   3.884  21.319
    8   HE22  GLN  43          HE22      GLN  43 -11.297   4.434  20.490

  No H/Q in entry =           8
  In of MODEL   15
    1    H    SER  44           H        SER  44  -5.539   3.439  16.113
    2    HA   SER  44           HA       SER  44  -6.217   1.940  13.826
    3    HB2  SER  44           HB2      SER  44  -5.004   4.347  14.265
    4    HB3  SER  44           HB3      SER  44  -3.633   3.376  13.733
    5    HG   SER  44           HG       SER  44  -4.767   4.325  11.972

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ARG  45           H        ARG  45  -3.333   1.882  15.901
    2    HA   ARG  45           HA       ARG  45  -1.820  -0.045  14.517
    3    HB2  ARG  45           HB2      ARG  45  -1.001   1.393  16.383
    4    HB3  ARG  45           HB3      ARG  45  -1.973   0.445  17.506
    5    HG2  ARG  45           HG2      ARG  45  -0.705  -1.591  16.862
    6    HG3  ARG  45           HG3      ARG  45   0.291  -0.618  15.781
    7    HD2  ARG  45           HD2      ARG  45   1.004   0.777  17.734
    8    HD3  ARG  45           HD3      ARG  45   0.104  -0.314  18.811
    9    HE   ARG  45           HE       ARG  45   1.829  -1.879  17.228
   10   HH21  ARG  45          HH11      ARG  45   3.746  -2.666  18.062
   11   HH22  ARG  45          HH12      ARG  45   4.507  -1.865  19.391
   12   HH11  ARG  45          HH21      ARG  45   2.091   0.595  19.615
   13   HH12  ARG  45          HH22      ARG  45   3.569  -0.016  20.268

  No H/Q in entry =          13
  In of MODEL   15
    1    H    MET  46           H        MET  46  -4.206  -0.408  17.122
    2    HA   MET  46           HA       MET  46  -3.986  -3.204  17.430
    3    HB2  MET  46           HB2      MET  46  -6.197  -1.241  18.030
    4    HB3  MET  46           HB3      MET  46  -6.360  -2.964  18.380
    5    HG2  MET  46           HG2      MET  46  -4.337  -2.892  19.772
    6    HG3  MET  46           HG3      MET  46  -4.124  -1.188  19.401
    7    HE2  MET  46           HE1      MET  46  -4.405  -0.048  21.957
    8    HE1  MET  46           HE2      MET  46  -3.839  -1.714  22.010
    9    HE3  MET  46           HE3      MET  46  -5.098  -1.183  23.121

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ALA  47           H        ALA  47  -6.047  -1.225  15.338
    2    HA   ALA  47           HA       ALA  47  -7.629  -3.306  14.277
    3    HB3  ALA  47           HB1      ALA  47  -8.350  -1.081  13.861
    4    HB1  ALA  47           HB2      ALA  47  -7.852  -1.707  12.289
    5    HB2  ALA  47           HB3      ALA  47  -6.790  -0.618  13.183

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU  48           H        LEU  48  -4.536  -1.942  13.219
    2    HA   LEU  48           HA       LEU  48  -4.231  -3.529  10.878
    3    HB2  LEU  48           HB2      LEU  48  -2.194  -2.213  12.682
    4    HB3  LEU  48           HB3      LEU  48  -1.815  -2.928  11.115
    5    HG   LEU  48           HG       LEU  48  -3.876  -0.746  11.507
    6   HD13  LEU  48          HD11      LEU  48  -1.769   0.167  12.168
    7   HD12  LEU  48          HD12      LEU  48  -2.056   0.715  10.517
    8   HD11  LEU  48          HD13      LEU  48  -0.935  -0.612  10.824
    9   HD22  LEU  48          HD21      LEU  48  -4.334  -1.740   9.433
   10   HD21  LEU  48          HD22      LEU  48  -2.644  -2.146   9.135
   11   HD23  LEU  48          HD23      LEU  48  -3.193  -0.476   8.975

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ASN  49           H        ASN  49  -3.173  -3.906  14.223
    2    HA   ASN  49           HA       ASN  49  -1.533  -6.141  13.891
    3    HB2  ASN  49           HB2      ASN  49  -1.588  -4.797  15.938
    4    HB3  ASN  49           HB3      ASN  49  -3.230  -5.331  16.268
    5   HD21  ASN  49          HD21      ASN  49  -2.539  -6.309  18.299
    6   HD22  ASN  49          HD22      ASN  49  -1.652  -7.756  18.315

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLU  50           H        GLU  50  -5.004  -5.924  14.568
    2    HA   GLU  50           HA       GLU  50  -5.470  -8.732  14.679
    3    HB2  GLU  50           HB2      GLU  50  -7.082  -7.071  15.557
    4    HB3  GLU  50           HB3      GLU  50  -7.388  -6.512  13.910
    5    HG2  GLU  50           HG2      GLU  50  -8.217  -8.722  13.275
    6    HG3  GLU  50           HG3      GLU  50  -7.823  -9.359  14.868

  No H/Q in entry =           6
  In of MODEL   15
    1    H    ALA  51           H        ALA  51  -5.582  -6.336  12.082
    2    HA   ALA  51           HA       ALA  51  -6.542  -8.080  10.062
    3    HB2  ALA  51           HB1      ALA  51  -6.354  -6.265   8.692
    4    HB1  ALA  51           HB2      ALA  51  -4.719  -5.890   9.238
    5    HB3  ALA  51           HB3      ALA  51  -6.109  -5.400  10.208

  No H/Q in entry =           5
  In of MODEL   15
    1    H    HIS  52           H        HIS  52  -3.265  -7.121  11.040
    2    HA   HIS  52           HA       HIS  52  -1.845  -8.588   9.089
    3    HB2  HIS  52           HB2      HIS  52  -0.809  -6.849  10.493
    4    HB3  HIS  52           HB3      HIS  52  -1.010  -7.875  11.912
    5    HD1  HIS  52           HD1      HIS  52   0.297 -10.240  11.815
    6    HD2  HIS  52           HD2      HIS  52   1.486  -7.391   9.013
    7    HE1  HIS  52           HE1      HIS  52   2.549 -10.995  10.938
    8    HE2  HIS  52           HE2      HIS  52   3.287  -9.268   9.228

  No H/Q in entry =           8
  In of MODEL   15
    1    H    LEU  53           H        LEU  53  -3.038  -9.483  12.304
    2    HA   LEU  53           HA       LEU  53  -1.801 -12.008  12.497
    3    HB2  LEU  53           HB2      LEU  53  -4.306 -10.870  13.713
    4    HB3  LEU  53           HB3      LEU  53  -3.811 -12.535  14.010
    5    HG   LEU  53           HG       LEU  53  -1.953 -10.181  14.470
    6   HD11  LEU  53          HD11      LEU  53  -3.848 -11.554  16.398
    7   HD13  LEU  53          HD12      LEU  53  -3.877  -9.860  15.914
    8   HD12  LEU  53          HD13      LEU  53  -2.548 -10.473  16.890
    9   HD21  LEU  53          HD21      LEU  53  -1.944 -13.112  15.219
   10   HD23  LEU  53          HD22      LEU  53  -1.023 -11.940  16.155
   11   HD22  LEU  53          HD23      LEU  53  -0.657 -12.184  14.458

  No H/Q in entry =          11
  In of MODEL   15
    1    H    VAL  54           H        VAL  54  -4.930 -11.027  11.139
    2    HA   VAL  54           HA       VAL  54  -5.805 -13.635  10.454
    3    HB   VAL  54           HB       VAL  54  -6.495 -10.913   9.320
    4   HG12  VAL  54          HG11      VAL  54  -8.577 -12.322   8.512
    5   HG11  VAL  54          HG12      VAL  54  -7.445 -13.671   8.583
    6   HG13  VAL  54          HG13      VAL  54  -7.108 -12.291   7.540
    7   HG22  VAL  54          HG21      VAL  54  -7.398 -10.963  11.473
    8   HG21  VAL  54          HG22      VAL  54  -7.626 -12.710  11.454
    9   HG23  VAL  54          HG23      VAL  54  -8.724 -11.670  10.549

  No H/Q in entry =           9
  In of MODEL   15
    1    H    GLN  55           H        GLN  55  -3.973 -11.157   8.661
    2    HA   GLN  55           HA       GLN  55  -3.825 -12.620   6.244
    3    HB2  GLN  55           HB2      GLN  55  -3.255 -10.347   6.053
    4    HB3  GLN  55           HB3      GLN  55  -2.141 -10.407   7.416
    5    HG2  GLN  55           HG2      GLN  55  -0.413 -11.228   6.137
    6    HG3  GLN  55           HG3      GLN  55  -1.474 -12.219   5.145
    7   HE21  GLN  55          HE21      GLN  55  -1.504 -11.530   3.024
    8   HE22  GLN  55          HE22      GLN  55  -1.331  -9.923   2.513

  No H/Q in entry =           8
  In of MODEL   15
    1    H    THR  56           H        THR  56  -1.715 -12.567   9.122
    2    HA   THR  56           HA       THR  56   0.385 -14.136   8.202
    3    HB   THR  56           HB       THR  56  -0.850 -14.403  10.952
    4    HG1  THR  56           HG1      THR  56  -0.158 -12.207   9.863
    5   HG23  THR  56          HG21      THR  56   1.237 -15.180  11.643
    6   HG22  THR  56          HG22      THR  56   2.074 -14.439  10.278
    7   HG21  THR  56          HG23      THR  56   1.105 -15.892  10.036

  No H/Q in entry =           7
  In of MODEL   15
    1    H    LYS  57           H        LYS  57  -2.718 -15.216   9.570
    2    HA   LYS  57           HA       LYS  57  -2.233 -18.006   9.325
    3    HB2  LYS  57           HB2      LYS  57  -4.065 -16.937  10.671
    4    HB3  LYS  57           HB3      LYS  57  -4.866 -16.506   9.169
    5    HG2  LYS  57           HG2      LYS  57  -5.100 -18.859   8.569
    6    HG3  LYS  57           HG3      LYS  57  -4.209 -19.342  10.010
    7    HD2  LYS  57           HD2      LYS  57  -5.976 -18.342  11.431
    8    HD3  LYS  57           HD3      LYS  57  -6.878 -17.891   9.984
    9    HE2  LYS  57           HE2      LYS  57  -6.096 -20.746  10.668
   10    HE3  LYS  57           HE3      LYS  57  -7.672 -20.053  11.042
   11    HZ3  LYS  57           HZ1      LYS  57  -7.993 -21.076   9.011
   12    HZ2  LYS  57           HZ2      LYS  57  -6.473 -20.612   8.408
   13    HZ1  LYS  57           HZ3      LYS  57  -7.713 -19.461   8.567

  No H/Q in entry =          13
  In of MODEL   15
    1    H    LEU  58           H        LEU  58  -3.602 -15.583   7.150
    2    HA   LEU  58           HA       LEU  58  -4.381 -17.421   5.145
    3    HB2  LEU  58           HB2      LEU  58  -3.817 -14.464   5.008
    4    HB3  LEU  58           HB3      LEU  58  -4.469 -15.411   3.669
    5    HG   LEU  58           HG       LEU  58  -5.747 -15.248   6.419
    6   HD11  LEU  58          HD11      LEU  58  -6.074 -13.606   3.927
    7   HD13  LEU  58          HD12      LEU  58  -6.069 -13.098   5.616
    8   HD12  LEU  58          HD13      LEU  58  -7.481 -13.912   4.946
    9   HD22  LEU  58          HD21      LEU  58  -6.684 -17.171   5.551
   10   HD21  LEU  58          HD22      LEU  58  -6.353 -16.715   3.880
   11   HD23  LEU  58          HD23      LEU  58  -7.725 -16.008   4.732

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  59           H        ILE  59  -1.262 -16.165   6.002
    2    HA   ILE  59           HA       ILE  59  -0.157 -16.879   3.364
    3    HB   ILE  59           HB       ILE  59   0.584 -14.800   4.925
    4   HG12  ILE  59          HG12      ILE  59   2.709 -16.423   3.514
    5   HG13  ILE  59          HG13      ILE  59   1.496 -15.523   2.643
    6   HG22  ILE  59          HG21      ILE  59   2.700 -16.812   5.637
    7   HG21  ILE  59          HG22      ILE  59   1.335 -16.565   6.702
    8   HG23  ILE  59          HG23      ILE  59   2.425 -15.231   6.331
    9   HD13  ILE  59          HD11      ILE  59   3.463 -14.126   2.865
   10   HD12  ILE  59          HD12      ILE  59   3.492 -14.398   4.606
   11   HD11  ILE  59          HD13      ILE  59   2.187 -13.459   3.880

  No H/Q in entry =          11
  In of MODEL   15
    1    H    GLU  60           H        GLU  60  -0.148 -17.983   6.732
    2    HA   GLU  60           HA       GLU  60   1.910 -19.932   6.466
    3    HB2  GLU  60           HB2      GLU  60   1.142 -19.161   8.657
    4    HB3  GLU  60           HB3      GLU  60  -0.458 -19.835   8.355
    5    HG2  GLU  60           HG2      GLU  60   0.528 -22.101   8.206
    6    HG3  GLU  60           HG3      GLU  60   2.124 -21.422   8.517

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLY  61           H        GLY  61  -1.600 -20.080   5.984
    2    HA3  GLY  61           HA2      GLY  61  -1.314 -22.869   5.028
    3    HA2  GLY  61           HA3      GLY  61  -2.808 -22.154   5.622

  No H/Q in entry =           3
  In of MODEL   15
    1    H    ASP  62           H        ASP  62  -0.606 -20.542   3.418
    2    HA   ASP  62           HA       ASP  62  -2.677 -19.967   1.552
    3    HB2  ASP  62           HB2      ASP  62  -0.728 -18.498   1.953
    4    HB3  ASP  62           HB3      ASP  62   0.326 -19.725   1.256

  No H/Q in entry =           4
  In of MODEL   15
    1    H    ALA  63           H        ALA  63  -2.945 -22.634   1.617
    2    HA   ALA  63           HA       ALA  63  -1.345 -24.149  -0.178
    3    HB1  ALA  63           HB1      ALA  63  -3.491 -25.571  -0.322
    4    HB3  ALA  63           HB2      ALA  63  -4.124 -24.464   0.896
    5    HB2  ALA  63           HB3      ALA  63  -2.685 -25.425   1.243

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLY  64           H        GLY  64  -4.201 -22.125  -0.588
    2    HA3  GLY  64           HA2      GLY  64  -4.955 -21.029  -2.490
    3    HA2  GLY  64           HA3      GLY  64  -3.691 -21.820  -3.419

  No H/Q in entry =           3
  In of MODEL   15
    1    H    GLU  65           H        GLU  65  -5.788 -21.791  -4.867
    2    HA   GLU  65           HA       GLU  65  -7.843 -23.642  -4.302
    3    HB2  GLU  65           HB2      GLU  65  -6.882 -22.473  -6.911
    4    HB3  GLU  65           HB3      GLU  65  -8.317 -23.490  -6.764
    5    HG2  GLU  65           HG2      GLU  65  -9.307 -21.918  -5.173
    6    HG3  GLU  65           HG3      GLU  65  -7.856 -20.922  -5.222

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLY  66           H        GLY  66  -4.873 -23.937  -6.114
    2    HA3  GLY  66           HA2      GLY  66  -5.287 -26.826  -6.482
    3    HA2  GLY  66           HA3      GLY  66  -4.228 -25.825  -7.455

  No H/Q in entry =           3
  In of MODEL   15
    1    H    LYS  67           H        LYS  67  -3.064 -27.976  -6.740
    2    HA   LYS  67           HA       LYS  67  -2.033 -28.628  -4.377
    3    HB2  LYS  67           HB2      LYS  67   0.168 -29.107  -5.672
    4    HB3  LYS  67           HB3      LYS  67  -1.323 -29.914  -6.176
    5    HG2  LYS  67           HG2      LYS  67  -1.703 -28.228  -7.899
    6    HG3  LYS  67           HG3      LYS  67  -0.293 -27.318  -7.360
    7    HD2  LYS  67           HD2      LYS  67   1.142 -29.276  -7.929
    8    HD3  LYS  67           HD3      LYS  67  -0.284 -30.098  -8.567
    9    HE2  LYS  67           HE2      LYS  67   0.784 -27.431  -9.542
   10    HE3  LYS  67           HE3      LYS  67   0.977 -28.973 -10.374
   11    HZ1  LYS  67           HZ1      LYS  67  -1.700 -28.799  -9.869
   12    HZ3  LYS  67           HZ2      LYS  67  -0.940 -28.514 -11.360
   13    HZ2  LYS  67           HZ3      LYS  67  -1.273 -27.219 -10.311

  No H/Q in entry =          13
  In of MODEL   15
    1    H    MET  68           H        MET  68   0.673 -27.407  -5.909
    2    HA   MET  68           HA       MET  68   1.708 -26.079  -3.665
    3    HB2  MET  68           HB2      MET  68   2.523 -25.936  -6.569
    4    HB3  MET  68           HB3      MET  68   3.492 -25.348  -5.217
    5    HG2  MET  68           HG2      MET  68   2.524 -28.203  -5.535
    6    HG3  MET  68           HG3      MET  68   4.153 -27.644  -5.919
    7    HE2  MET  68           HE1      MET  68   4.932 -25.575  -3.461
    8    HE1  MET  68           HE2      MET  68   5.713 -26.707  -4.565
    9    HE3  MET  68           HE3      MET  68   5.913 -26.902  -2.825

  No H/Q in entry =           9
  In of MODEL   15
    1    H    LYS  69           H        LYS  69   0.129 -24.755  -6.565
    2    HA   LYS  69           HA       LYS  69   0.704 -22.139  -6.499
    3    HB2  LYS  69           HB2      LYS  69  -0.860 -23.161  -8.083
    4    HB3  LYS  69           HB3      LYS  69  -2.111 -23.154  -6.833
    5    HG2  LYS  69           HG2      LYS  69  -1.989 -20.737  -6.646
    6    HG3  LYS  69           HG3      LYS  69  -0.630 -20.682  -7.769
    7    HD2  LYS  69           HD2      LYS  69  -2.067 -21.596  -9.555
    8    HD3  LYS  69           HD3      LYS  69  -3.429 -21.637  -8.433
    9    HE2  LYS  69           HE2      LYS  69  -3.566 -19.601  -9.771
   10    HE3  LYS  69           HE3      LYS  69  -3.183 -19.176  -8.103
   11    HZ2  LYS  69           HZ1      LYS  69  -1.737 -18.549 -10.385
   12    HZ1  LYS  69           HZ2      LYS  69  -0.804 -19.678  -9.524
   13    HZ3  LYS  69           HZ3      LYS  69  -1.310 -18.240  -8.773

  No H/Q in entry =          13
  In of MODEL   15
    1    H    VAL  70           H        VAL  70  -0.209 -20.183  -5.695
    2    HA   VAL  70           HA       VAL  70  -1.271 -20.422  -2.934
    3    HB   VAL  70           HB       VAL  70  -0.264 -18.029  -2.773
    4   HG11  VAL  70          HG11      VAL  70   0.614 -20.104  -1.664
    5   HG13  VAL  70          HG12      VAL  70   1.872 -18.937  -2.073
    6   HG12  VAL  70          HG13      VAL  70   1.638 -20.369  -3.076
    7   HG21  VAL  70          HG21      VAL  70   0.137 -17.818  -5.249
    8   HG23  VAL  70          HG22      VAL  70   1.336 -19.103  -5.126
    9   HG22  VAL  70          HG23      VAL  70   1.605 -17.570  -4.302

  No H/Q in entry =           9
  In of MODEL   15
    1    H    SER  71           H        SER  71  -2.696 -18.704  -2.252
    2    HA   SER  71           HA       SER  71  -4.772 -18.121  -4.122
    3    HB2  SER  71           HB2      SER  71  -5.099 -18.381  -1.625
    4    HB3  SER  71           HB3      SER  71  -4.291 -16.830  -1.415
    5    HG   SER  71           HG       SER  71  -6.835 -17.365  -2.144

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU  72           H        LEU  72  -4.946 -16.495  -5.476
    2    HA   LEU  72           HA       LEU  72  -2.866 -14.652  -5.963
    3    HB2  LEU  72           HB2      LEU  72  -5.731 -14.752  -6.903
    4    HB3  LEU  72           HB3      LEU  72  -4.556 -13.573  -7.479
    5    HG   LEU  72           HG       LEU  72  -4.099 -16.571  -7.616
    6   HD12  LEU  72          HD11      LEU  72  -5.108 -14.680  -9.765
    7   HD11  LEU  72          HD12      LEU  72  -6.061 -15.936  -8.973
    8   HD13  LEU  72          HD13      LEU  72  -4.699 -16.381 -10.001
    9   HD22  LEU  72          HD21      LEU  72  -2.000 -15.540  -7.862
   10   HD21  LEU  72          HD22      LEU  72  -2.662 -14.132  -8.674
   11   HD23  LEU  72          HD23      LEU  72  -2.545 -15.667  -9.531

  No H/Q in entry =          11
  In of MODEL   15
    1    H    VAL  73           H        VAL  73  -5.960 -14.341  -4.326
    2    HA   VAL  73           HA       VAL  73  -6.046 -11.571  -3.974
    3    HB   VAL  73           HB       VAL  73  -7.749 -11.957  -2.379
    4   HG12  VAL  73          HG11      VAL  73  -7.885 -14.427  -4.104
    5   HG11  VAL  73          HG12      VAL  73  -8.041 -12.817  -4.802
    6   HG13  VAL  73          HG13      VAL  73  -9.201 -13.369  -3.595
    7   HG22  VAL  73          HG21      VAL  73  -6.887 -13.392  -0.759
    8   HG21  VAL  73          HG22      VAL  73  -6.274 -14.536  -1.953
    9   HG23  VAL  73          HG23      VAL  73  -8.001 -14.469  -1.599

  No H/Q in entry =           9
  In of MODEL   15
    1    H    LEU  74           H        LEU  74  -4.069 -13.910  -2.396
    2    HA   LEU  74           HA       LEU  74  -3.669 -12.763   0.126
    3    HB2  LEU  74           HB2      LEU  74  -2.853 -14.969  -0.373
    4    HB3  LEU  74           HB3      LEU  74  -1.813 -14.343  -1.652
    5    HG   LEU  74           HG       LEU  74  -0.559 -13.029   0.060
    6   HD11  LEU  74          HD11      LEU  74  -2.547 -14.411   1.865
    7   HD13  LEU  74          HD12      LEU  74  -2.101 -12.704   1.829
    8   HD12  LEU  74          HD13      LEU  74  -0.971 -13.897   2.470
    9   HD21  LEU  74          HD21      LEU  74  -0.162 -15.506  -0.686
   10   HD23  LEU  74          HD22      LEU  74  -0.651 -15.854   0.956
   11   HD22  LEU  74          HD23      LEU  74   0.747 -14.845   0.671

  No H/Q in entry =          11
  In of MODEL   15
    1    H    VAL  75           H        VAL  75  -1.792 -12.341  -2.835
    2    HA   VAL  75           HA       VAL  75  -0.021 -10.390  -1.829
    3    HB   VAL  75           HB       VAL  75  -0.976 -10.894  -4.648
    4   HG13  VAL  75          HG11      VAL  75  -0.161  -8.575  -4.451
    5   HG12  VAL  75          HG12      VAL  75   1.046  -9.550  -5.275
    6   HG11  VAL  75          HG13      VAL  75   1.265  -9.132  -3.583
    7   HG21  VAL  75          HG21      VAL  75   0.280 -12.730  -3.527
    8   HG23  VAL  75          HG22      VAL  75   1.585 -11.599  -3.170
    9   HG22  VAL  75          HG23      VAL  75   1.212 -12.015  -4.844

  No H/Q in entry =           9
  In of MODEL   15
    1    H    GLU  76           H        GLU  76  -3.181 -10.090  -3.479
    2    HA   GLU  76           HA       GLU  76  -3.275  -7.277  -3.579
    3    HB2  GLU  76           HB2      GLU  76  -4.917  -8.724  -4.742
    4    HB3  GLU  76           HB3      GLU  76  -5.549  -9.259  -3.194
    5    HG2  GLU  76           HG2      GLU  76  -7.042  -7.563  -4.051
    6    HG3  GLU  76           HG3      GLU  76  -6.181  -6.860  -2.695

  No H/Q in entry =           6
  In of MODEL   15
    1    H    ALA  77           H        ALA  77  -4.346  -9.522  -1.037
    2    HA   ALA  77           HA       ALA  77  -5.328  -7.535   0.724
    3    HB3  ALA  77           HB1      ALA  77  -5.065  -9.292   2.478
    4    HB1  ALA  77           HB2      ALA  77  -4.229 -10.298   1.296
    5    HB2  ALA  77           HB3      ALA  77  -5.919  -9.865   1.046

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLN  78           H        GLN  78  -2.159  -9.037   0.351
    2    HA   GLN  78           HA       GLN  78  -0.912  -7.859   2.599
    3    HB2  GLN  78           HB2      GLN  78  -0.024  -9.786   1.243
    4    HB3  GLN  78           HB3      GLN  78   0.388  -8.636  -0.026
    5    HG2  GLN  78           HG2      GLN  78   1.832  -7.413   1.553
    6    HG3  GLN  78           HG3      GLN  78   1.428  -8.568   2.820
    7   HE21  GLN  78          HE21      GLN  78   4.139  -8.225   1.944
    8   HE22  GLN  78          HE22      GLN  78   4.625  -9.648   1.156

  No H/Q in entry =           8
  In of MODEL   15
    1    H    LEU  79           H        LEU  79  -1.303  -6.802  -0.747
    2    HA   LEU  79           HA       LEU  79   0.351  -4.551  -0.737
    3    HB2  LEU  79           HB2      LEU  79  -0.669  -5.372  -2.789
    4    HB3  LEU  79           HB3      LEU  79  -2.277  -5.004  -2.176
    5    HG   LEU  79           HG       LEU  79  -1.767  -2.609  -2.151
    6   HD13  LEU  79          HD11      LEU  79   0.471  -2.334  -1.644
    7   HD12  LEU  79          HD12      LEU  79   0.512  -2.045  -3.383
    8   HD11  LEU  79          HD13      LEU  79   0.990  -3.616  -2.738
    9   HD23  LEU  79          HD21      LEU  79  -1.142  -2.401  -4.705
   10   HD22  LEU  79          HD22      LEU  79  -2.656  -3.170  -4.242
   11   HD21  LEU  79          HD23      LEU  79  -1.271  -4.159  -4.690

  No H/Q in entry =          11
  In of MODEL   15
    1    H    HIS  80           H        HIS  80  -3.111  -4.763   0.098
    2    HA   HIS  80           HA       HIS  80  -3.339  -2.009   0.763
    3    HB2  HIS  80           HB2      HIS  80  -5.006  -4.442   1.085
    4    HB3  HIS  80           HB3      HIS  80  -5.342  -3.107   2.190
    5    HD1  HIS  80           HD1      HIS  80  -6.985  -1.492   1.287
    6    HD2  HIS  80           HD2      HIS  80  -4.775  -3.273  -1.767
    7    HE1  HIS  80           HE1      HIS  80  -7.844  -0.506  -0.890
    8    HE2  HIS  80           HE2      HIS  80  -6.503  -1.586  -2.760

  No H/Q in entry =           8
  In of MODEL   15
    1    H    LEU  81           H        LEU  81  -2.805  -4.898   2.754
    2    HA   LEU  81           HA       LEU  81  -2.805  -3.551   5.238
    3    HB2  LEU  81           HB2      LEU  81  -1.553  -6.150   4.355
    4    HB3  LEU  81           HB3      LEU  81  -1.531  -5.592   6.029
    5    HG   LEU  81           HG       LEU  81  -4.077  -5.878   4.407
    6   HD12  LEU  81          HD11      LEU  81  -4.347  -7.948   5.955
    7   HD11  LEU  81          HD12      LEU  81  -2.596  -7.854   6.136
    8   HD13  LEU  81          HD13      LEU  81  -3.306  -8.093   4.539
    9   HD23  LEU  81          HD21      LEU  81  -4.911  -6.093   6.910
   10   HD22  LEU  81          HD22      LEU  81  -4.609  -4.500   6.220
   11   HD21  LEU  81          HD23      LEU  81  -3.409  -5.245   7.277

  No H/Q in entry =          11
  In of MODEL   15
    1    H    MET  82           H        MET  82  -0.118  -4.418   3.060
    2    HA   MET  82           HA       MET  82   1.958  -3.496   4.739
    3    HB2  MET  82           HB2      MET  82   1.739  -3.840   1.747
    4    HB3  MET  82           HB3      MET  82   3.216  -3.250   2.507
    5    HG2  MET  82           HG2      MET  82   1.845  -5.858   3.234
    6    HG3  MET  82           HG3      MET  82   3.212  -5.730   2.131
    7    HE3  MET  82           HE1      MET  82   6.223  -4.955   4.107
    8    HE2  MET  82           HE2      MET  82   5.280  -3.600   3.491
    9    HE1  MET  82           HE3      MET  82   5.386  -5.088   2.555

  No H/Q in entry =           9
  In of MODEL   15
    1    H    THR  83           H        THR  83   0.108  -1.878   2.187
    2    HA   THR  83           HA       THR  83   1.488   0.588   2.271
    3    HB   THR  83           HB       THR  83  -0.703   1.485   1.290
    4    HG1  THR  83           HG1      THR  83  -2.336   0.167   1.188
    5   HG22  THR  83          HG21      THR  83  -0.414  -0.329  -0.711
    6   HG21  THR  83          HG22      THR  83   1.092  -0.602   0.161
    7   HG23  THR  83          HG23      THR  83   0.709   1.007  -0.452

  No H/Q in entry =           7
  In of MODEL   15
    1    H    SER  84           H        SER  84  -1.500  -0.483   3.880
    2    HA   SER  84           HA       SER  84  -2.024   1.940   5.226
    3    HB2  SER  84           HB2      SER  84  -2.819  -0.908   5.792
    4    HB3  SER  84           HB3      SER  84  -3.327   0.426   6.827
    5    HG   SER  84           HG       SER  84  -3.789   0.107   4.036

  No H/Q in entry =           5
  In of MODEL   15
    1    H    MET  85           H        MET  85  -0.274  -0.970   6.350
    2    HA   MET  85           HA       MET  85   0.241  -0.037   8.953
    3    HB2  MET  85           HB2      MET  85   0.561  -2.377   8.277
    4    HB3  MET  85           HB3      MET  85   1.933  -1.896   7.276
    5    HG2  MET  85           HG2      MET  85   3.113  -1.056   9.264
    6    HG3  MET  85           HG3      MET  85   1.730  -1.477  10.273
    7    HE1  MET  85           HE1      MET  85   4.298  -2.453   7.863
    8    HE3  MET  85           HE2      MET  85   3.423  -3.856   7.255
    9    HE2  MET  85           HE3      MET  85   4.835  -4.084   8.280

  No H/Q in entry =           9
  In of MODEL   15
    1    H    LEU  86           H        LEU  86   2.164   0.243   5.997
    2    HA   LEU  86           HA       LEU  86   4.365   1.581   7.147
    3    HB2  LEU  86           HB2      LEU  86   4.181   0.496   4.838
    4    HB3  LEU  86           HB3      LEU  86   3.353   1.968   4.328
    5    HG   LEU  86           HG       LEU  86   5.368   3.239   5.303
    6   HD11  LEU  86          HD11      LEU  86   6.108   0.636   6.101
    7   HD13  LEU  86          HD12      LEU  86   7.094   2.094   6.195
    8   HD12  LEU  86          HD13      LEU  86   7.212   1.047   4.784
    9   HD23  LEU  86          HD21      LEU  86   6.100   1.485   2.950
   10   HD22  LEU  86          HD22      LEU  86   6.474   3.187   3.211
   11   HD21  LEU  86          HD23      LEU  86   4.826   2.699   2.817

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ALA  87           H        ALA  87   1.433   2.789   5.570
    2    HA   ALA  87           HA       ALA  87   1.994   5.526   5.652
    3    HB1  ALA  87           HB1      ALA  87  -0.296   3.870   5.117
    4    HB3  ALA  87           HB2      ALA  87  -0.007   5.534   4.616
    5    HB2  ALA  87           HB3      ALA  87  -0.793   5.203   6.162

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ARG  88           H        ARG  88   0.336   3.504   8.047
    2    HA   ARG  88           HA       ARG  88  -0.196   5.547   9.895
    3    HB2  ARG  88           HB2      ARG  88  -1.105   3.183   9.964
    4    HB3  ARG  88           HB3      ARG  88   0.443   2.702  10.666
    5    HG2  ARG  88           HG2      ARG  88  -0.054   4.771  12.287
    6    HG3  ARG  88           HG3      ARG  88  -1.718   4.425  11.836
    7    HD2  ARG  88           HD2      ARG  88  -1.799   2.575  13.083
    8    HD3  ARG  88           HD3      ARG  88  -0.204   2.013  12.547
    9    HE   ARG  88           HE       ARG  88  -0.747   3.270  15.003
   10   HH21  ARG  88          HH11      ARG  88   0.802   4.301  16.237
   11   HH22  ARG  88          HH12      ARG  88   2.314   4.746  15.528
   12   HH11  ARG  88          HH21      ARG  88   1.524   3.479  12.419
   13   HH12  ARG  88          HH22      ARG  88   2.732   4.265  13.378

  No H/Q in entry =          13
  In of MODEL   15
    1    H    GLU  89           H        GLU  89   2.627   3.363   9.664
    2    HA   GLU  89           HA       GLU  89   3.884   4.268  12.005
    3    HB2  GLU  89           HB2      GLU  89   4.564   2.258  10.660
    4    HB3  GLU  89           HB3      GLU  89   5.323   3.361   9.511
    5    HG2  GLU  89           HG2      GLU  89   6.802   4.227  11.250
    6    HG3  GLU  89           HG3      GLU  89   5.983   3.261  12.473

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LEU  90           H        LEU  90   4.177   5.429   8.676
    2    HA   LEU  90           HA       LEU  90   6.083   7.454   9.255
    3    HB2  LEU  90           HB2      LEU  90   4.076   7.096   7.034
    4    HB3  LEU  90           HB3      LEU  90   5.290   8.383   7.051
    5    HG   LEU  90           HG       LEU  90   6.002   5.455   7.384
    6   HD12  LEU  90          HD11      LEU  90   6.741   5.698   4.942
    7   HD11  LEU  90          HD12      LEU  90   5.707   7.125   4.896
    8   HD13  LEU  90          HD13      LEU  90   5.008   5.543   5.241
    9   HD22  LEU  90          HD21      LEU  90   7.886   6.630   8.061
   10   HD21  LEU  90          HD22      LEU  90   7.515   8.030   7.054
   11   HD23  LEU  90          HD23      LEU  90   8.192   6.573   6.326

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  91           H        ILE  91   2.544   7.423   9.116
    2    HA   ILE  91           HA       ILE  91   2.166  10.191   9.567
    3    HB   ILE  91           HB       ILE  91   0.408   7.792  10.115
    4   HG12  ILE  91          HG12      ILE  91   0.124  10.069   8.130
    5   HG13  ILE  91          HG13      ILE  91   1.003   8.586   7.756
    6   HG22  ILE  91          HG21      ILE  91  -1.351   9.827  10.183
    7   HG21  ILE  91          HG22      ILE  91   0.040  10.676  10.852
    8   HG23  ILE  91          HG23      ILE  91  -0.575   9.231  11.650
    9   HD13  ILE  91          HD11      ILE  91  -0.923   7.273   7.806
   10   HD12  ILE  91          HD12      ILE  91  -1.535   8.780   7.126
   11   HD11  ILE  91          HD13      ILE  91  -1.797   8.413   8.831

  No H/Q in entry =          11
  In of MODEL   15
    1    H    THR  92           H        THR  92   2.612   7.456  11.768
    2    HA   THR  92           HA       THR  92   2.156   8.824  14.193
    3    HB   THR  92           HB       THR  92   3.995   6.514  13.524
    4    HG1  THR  92           HG1      THR  92   2.036   5.730  13.429
    5   HG22  THR  92          HG21      THR  92   3.622   6.226  16.159
    6   HG21  THR  92          HG22      THR  92   3.533   7.984  16.085
    7   HG23  THR  92          HG23      THR  92   4.976   7.148  15.509

  No H/Q in entry =           7
  In of MODEL   15
    1    H    GLU  93           H        GLU  93   5.108   8.416  12.252
    2    HA   GLU  93           HA       GLU  93   6.846   9.868  13.944
    3    HB2  GLU  93           HB2      GLU  93   6.931   9.553  10.929
    4    HB3  GLU  93           HB3      GLU  93   8.267  10.103  11.940
    5    HG2  GLU  93           HG2      GLU  93   6.896   7.447  12.392
    6    HG3  GLU  93           HG3      GLU  93   8.275   7.618  11.312

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LEU  94           H        LEU  94   4.776  10.852  11.236
    2    HA   LEU  94           HA       LEU  94   5.542  13.568  11.132
    3    HB2  LEU  94           HB2      LEU  94   2.970  12.165  10.385
    4    HB3  LEU  94           HB3      LEU  94   3.203  13.895  10.142
    5    HG   LEU  94           HG       LEU  94   5.246  11.937   9.088
    6   HD11  LEU  94          HD11      LEU  94   2.494  12.447   8.032
    7   HD13  LEU  94          HD12      LEU  94   3.498  11.004   7.905
    8   HD12  LEU  94          HD13      LEU  94   3.811  12.389   6.859
    9   HD23  LEU  94          HD21      LEU  94   5.465  13.775   7.364
   10   HD22  LEU  94          HD22      LEU  94   5.877  14.275   9.005
   11   HD21  LEU  94          HD23      LEU  94   4.318  14.720   8.310

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  95           H        ILE  95   3.033  11.914  13.030
    2    HA   ILE  95           HA       ILE  95   1.958  14.249  14.226
    3    HB   ILE  95           HB       ILE  95   2.020  11.369  15.153
    4   HG12  ILE  95          HG12      ILE  95  -0.229  13.108  14.107
    5   HG13  ILE  95          HG13      ILE  95   0.741  12.063  13.074
    6   HG21  ILE  95          HG21      ILE  95   0.704  13.822  16.356
    7   HG23  ILE  95          HG22      ILE  95   1.771  12.670  17.158
    8   HG22  ILE  95          HG23      ILE  95   0.142  12.184  16.687
    9   HD13  ILE  95          HD11      ILE  95  -0.131  10.111  13.996
   10   HD12  ILE  95          HD12      ILE  95  -1.529  11.180  14.075
   11   HD11  ILE  95          HD13      ILE  95  -0.556  10.897  15.518

  No H/Q in entry =          11
  In of MODEL   15
    1    H    GLU  96           H        GLU  96   4.589  12.071  15.217
    2    HA   GLU  96           HA       GLU  96   5.131  13.279  17.707
    3    HB2  GLU  96           HB2      GLU  96   6.111  11.135  17.059
    4    HB3  GLU  96           HB3      GLU  96   7.029  11.921  15.776
    5    HG2  GLU  96           HG2      GLU  96   8.672  12.496  17.235
    6    HG3  GLU  96           HG3      GLU  96   7.515  13.292  18.292

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LEU  97           H        LEU  97   6.186  14.066  14.418
    2    HA   LEU  97           HA       LEU  97   8.042  16.092  15.125
    3    HB2  LEU  97           HB2      LEU  97   6.454  15.516  12.634
    4    HB3  LEU  97           HB3      LEU  97   7.451  16.963  12.752
    5    HG   LEU  97           HG       LEU  97   8.525  14.183  13.312
    6   HD12  LEU  97          HD11      LEU  97   9.514  14.391  10.992
    7   HD11  LEU  97          HD12      LEU  97   8.440  15.764  10.730
    8   HD13  LEU  97          HD13      LEU  97   7.767  14.162  11.027
    9   HD23  LEU  97          HD21      LEU  97  10.672  15.495  12.563
   10   HD22  LEU  97          HD22      LEU  97  10.053  15.756  14.194
   11   HD21  LEU  97          HD23      LEU  97   9.717  16.933  12.925

  No H/Q in entry =          11
  In of MODEL   15
    1    H    HIS  98           H        HIS  98   4.548  16.171  14.478
    2    HA   HIS  98           HA       HIS  98   4.204  18.965  14.612
    3    HB2  HIS  98           HB2      HIS  98   2.352  16.686  15.344
    4    HB3  HIS  98           HB3      HIS  98   1.858  18.378  15.399
    5    HD1  HIS  98           HD1      HIS  98   2.917  15.678  12.994
    6    HD2  HIS  98           HD2      HIS  98   1.478  19.589  12.872
    7    HE1  HIS  98           HE1      HIS  98   2.345  16.156  10.571
    8    HE2  HIS  98           HE2      HIS  98   1.472  18.532  10.476

  No H/Q in entry =           8
  In of MODEL   15
    1    H    GLU  99           H        GLU  99   4.382  16.481  17.112
    2    HA   GLU  99           HA       GLU  99   3.752  18.167  19.310
    3    HB2  GLU  99           HB2      GLU  99   3.703  15.684  19.409
    4    HB3  GLU  99           HB3      GLU  99   5.463  15.667  19.297
    5    HG2  GLU  99           HG2      GLU  99   5.636  16.964  21.370
    6    HG3  GLU  99           HG3      GLU  99   3.881  17.076  21.470

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LYS 100           H        LYS 100   6.817  17.285  17.740
    2    HA   LYS 100           HA       LYS 100   8.453  18.713  19.592
    3    HB2  LYS 100           HB2      LYS 100   8.960  17.795  16.753
    4    HB3  LYS 100           HB3      LYS 100  10.180  18.585  17.758
    5    HG2  LYS 100           HG2      LYS 100   9.836  16.830  19.501
    6    HG3  LYS 100           HG3      LYS 100   8.714  16.007  18.412
    7    HD2  LYS 100           HD2      LYS 100  10.509  15.752  16.742
    8    HD3  LYS 100           HD3      LYS 100  11.635  16.587  17.815
    9    HE2  LYS 100           HE2      LYS 100  11.271  14.826  19.535
   10    HE3  LYS 100           HE3      LYS 100  10.207  13.973  18.412
   11    HZ1  LYS 100           HZ1      LYS 100  13.015  14.687  17.750
   12    HZ3  LYS 100           HZ2      LYS 100  11.987  13.615  16.925
   13    HZ2  LYS 100           HZ3      LYS 100  12.585  13.206  18.463

  No H/Q in entry =          13
  In of MODEL   15
    1    H    LEU 101           H        LEU 101   6.738  19.611  16.640
    2    HA   LEU 101           HA       LEU 101   7.910  22.187  16.301
    3    HB2  LEU 101           HB2      LEU 101   5.333  20.911  15.420
    4    HB3  LEU 101           HB3      LEU 101   5.556  22.646  15.211
    5    HG   LEU 101           HG       LEU 101   7.622  20.662  14.242
    6   HD12  LEU 101          HD11      LEU 101   6.456  21.148  11.959
    7   HD11  LEU 101          HD12      LEU 101   5.052  21.556  12.943
    8   HD13  LEU 101          HD13      LEU 101   5.742  19.936  13.024
    9   HD21  LEU 101          HD21      LEU 101   6.946  23.563  13.686
   10   HD23  LEU 101          HD22      LEU 101   7.940  22.619  12.578
   11   HD22  LEU 101          HD23      LEU 101   8.481  22.886  14.235

  No H/Q in entry =          11
  In of MODEL   15
    1    H    LYS 102           H        LYS 102   6.397  21.026  18.920
    2    HA   LYS 102           HA       LYS 102   5.752  22.108  20.853
    3    HB2  LYS 102           HB2      LYS 102   7.000  24.118  19.725
    4    HB3  LYS 102           HB3      LYS 102   5.391  24.697  19.353
    5    HG2  LYS 102           HG2      LYS 102   6.778  24.464  22.002
    6    HG3  LYS 102           HG3      LYS 102   5.803  25.777  21.374
    7    HD2  LYS 102           HD2      LYS 102   4.603  23.122  22.257
    8    HD3  LYS 102           HD3      LYS 102   4.832  24.487  23.339
    9    HE2  LYS 102           HE2      LYS 102   2.556  24.048  21.856
   10    HE3  LYS 102           HE3      LYS 102   3.036  25.602  22.536
   11    HZ2  LYS 102           HZ1      LYS 102   2.499  25.700  20.157
   12    HZ1  LYS 102           HZ2      LYS 102   3.777  24.638  19.832
   13    HZ3  LYS 102           HZ3      LYS 102   4.097  26.174  20.473

  No H/Q in entry =          13
  In of MODEL   15
    1    H    ALA 103           H        ALA 103   4.084  23.624  18.089
    2    HA   ALA 103           HA       ALA 103   1.623  24.162  18.979
    3    HB1  ALA 103           HB1      ALA 103   0.732  23.305  16.739
    4    HB2  ALA 103           HB2      ALA 103   2.387  22.794  16.406
    5    HB3  ALA 103           HB3      ALA 103   2.026  24.501  16.672

  No H/Q in entry =           5
  In of MODEL   15
    1    H1   ALA   1           H3       ALA   1  10.862 -20.209  -6.296
    2    H2   ALA   1           H2       ALA   1   9.897 -20.430  -7.680
    3    H3   ALA   1           H1       ALA   1   9.475 -21.183  -6.216
    4    HA   ALA   1           HA       ALA   1  10.540 -22.976  -6.957
    5    HB1  ALA   1           HB1      ALA   1  10.624 -22.616  -9.233
    6    HB2  ALA   1           HB2      ALA   1  12.350 -22.440  -8.908
    7    HB3  ALA   1           HB3      ALA   1  11.330 -21.008  -9.057

  No H/Q in entry =           7
  In of MODEL   15
    1    H    GLU   2           H        GLU   2  12.837 -23.892  -7.020
    2    HA   GLU   2           HA       GLU   2  14.223 -23.789  -4.812
    3    HB2  GLU   2           HB2      GLU   2  15.570 -23.638  -7.514
    4    HB3  GLU   2           HB3      GLU   2  16.311 -24.238  -6.031
    5    HG2  GLU   2           HG2      GLU   2  15.324 -26.269  -6.268
    6    HG3  GLU   2           HG3      GLU   2  13.741 -25.547  -6.524

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLU   3           H        GLU   3  15.960 -21.899  -7.218
    2    HA   GLU   3           HA       GLU   3  17.093 -20.194  -5.262
    3    HB2  GLU   3           HB2      GLU   3  17.030 -20.194  -8.272
    4    HB3  GLU   3           HB3      GLU   3  17.758 -18.854  -7.387
    5    HG2  GLU   3           HG2      GLU   3  19.443 -20.203  -6.468
    6    HG3  GLU   3           HG3      GLU   3  18.518 -21.684  -6.686

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LEU   4           H        LEU   4  14.792 -19.381  -7.887
    2    HA   LEU   4           HA       LEU   4  14.289 -16.779  -7.275
    3    HB2  LEU   4           HB2      LEU   4  12.141 -18.786  -7.999
    4    HB3  LEU   4           HB3      LEU   4  12.040 -17.038  -8.198
    5    HG   LEU   4           HG       LEU   4  14.028 -18.873  -9.576
    6   HD13  LEU   4          HD11      LEU   4  12.719 -18.744 -11.483
    7   HD12  LEU   4          HD12      LEU   4  11.990 -17.210 -11.014
    8   HD11  LEU   4          HD13      LEU   4  11.460 -18.708 -10.251
    9   HD23  LEU   4          HD21      LEU   4  14.328 -16.624 -10.929
   10   HD22  LEU   4          HD22      LEU   4  15.195 -16.853  -9.412
   11   HD21  LEU   4          HD23      LEU   4  13.728 -15.878  -9.447

  No H/Q in entry =          11
  In of MODEL   15
    1    H    GLU   5           H        GLU   5  12.849 -19.584  -5.629
    2    HA   GLU   5           HA       GLU   5  11.153 -18.037  -3.922
    3    HB2  GLU   5           HB2      GLU   5  10.759 -20.420  -4.440
    4    HB3  GLU   5           HB3      GLU   5  12.205 -20.837  -3.517
    5    HG2  GLU   5           HG2      GLU   5  11.235 -19.827  -1.502
    6    HG3  GLU   5           HG3      GLU   5   9.800 -19.361  -2.415

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLU   6           H        GLU   6  14.324 -19.570  -3.487
    2    HA   GLU   6           HA       GLU   6  14.671 -18.707  -0.790
    3    HB2  GLU   6           HB2      GLU   6  16.631 -19.625  -2.905
    4    HB3  GLU   6           HB3      GLU   6  17.092 -19.260  -1.241
    5    HG2  GLU   6           HG2      GLU   6  15.561 -20.966  -0.402
    6    HG3  GLU   6           HG3      GLU   6  14.984 -21.288  -2.037

  No H/Q in entry =           6
  In of MODEL   15
    1    H    VAL   7           H        VAL   7  15.408 -17.370  -3.942
    2    HA   VAL   7           HA       VAL   7  17.064 -15.218  -3.082
    3    HB   VAL   7           HB       VAL   7  15.358 -15.609  -5.555
    4   HG11  VAL   7          HG11      VAL   7  17.219 -13.367  -4.748
    5   HG13  VAL   7          HG12      VAL   7  15.573 -13.249  -5.367
    6   HG12  VAL   7          HG13      VAL   7  16.887 -13.732  -6.441
    7   HG21  VAL   7          HG21      VAL   7  17.488 -17.033  -4.991
    8   HG23  VAL   7          HG22      VAL   7  18.370 -15.558  -5.392
    9   HG22  VAL   7          HG23      VAL   7  17.342 -16.324  -6.601

  No H/Q in entry =           9
  In of MODEL   15
    1    H    VAL   8           H        VAL   8  13.575 -15.541  -3.630
    2    HA   VAL   8           HA       VAL   8  12.869 -12.844  -3.157
    3    HB   VAL   8           HB       VAL   8  11.295 -15.394  -2.712
    4   HG11  VAL   8          HG11      VAL   8  10.471 -12.480  -2.620
    5   HG13  VAL   8          HG12      VAL   8  10.288 -13.688  -1.349
    6   HG12  VAL   8          HG13      VAL   8   9.318 -13.798  -2.817
    7   HG21  VAL   8          HG21      VAL   8  12.160 -14.303  -5.097
    8   HG23  VAL   8          HG22      VAL   8  10.599 -13.510  -4.896
    9   HG22  VAL   8          HG23      VAL   8  10.693 -15.268  -4.933

  No H/Q in entry =           9
  In of MODEL   15
    1    H    MET   9           H        MET   9  13.185 -15.644  -0.977
    2    HA   MET   9           HA       MET   9  12.356 -14.385   1.395
    3    HB2  MET   9           HB2      MET   9  14.253 -16.651   0.821
    4    HB3  MET   9           HB3      MET   9  14.042 -16.051   2.466
    5    HG2  MET   9           HG2      MET   9  11.511 -16.316   2.042
    6    HG3  MET   9           HG3      MET   9  11.979 -17.292   0.649
    7    HE1  MET   9           HE1      MET   9  12.984 -19.345   0.562
    8    HE3  MET   9           HE2      MET   9  13.486 -20.412   1.870
    9    HE2  MET   9           HE3      MET   9  14.487 -19.029   1.437

  No H/Q in entry =           9
  In of MODEL   15
    1    H    GLY  10           H        GLY  10  15.536 -14.559  -0.170
    2    HA3  GLY  10           HA2      GLY  10  16.977 -13.115   1.796
    3    HA2  GLY  10           HA3      GLY  10  17.439 -13.273   0.101

  No H/Q in entry =           3
  In of MODEL   15
    1    H    LEU  11           H        LEU  11  15.248 -12.088  -1.133
    2    HA   LEU  11           HA       LEU  11  15.889  -9.332  -0.972
    3    HB2  LEU  11           HB2      LEU  11  13.541 -10.780  -2.201
    4    HB3  LEU  11           HB3      LEU  11  13.793  -9.041  -2.362
    5    HG   LEU  11           HG       LEU  11  15.852 -11.117  -3.154
    6   HD13  LEU  11          HD11      LEU  11  14.109 -11.513  -4.669
    7   HD12  LEU  11          HD12      LEU  11  15.090 -10.316  -5.513
    8   HD11  LEU  11          HD13      LEU  11  13.611  -9.821  -4.691
    9   HD22  LEU  11          HD21      LEU  11  17.052  -9.134  -2.932
   10   HD21  LEU  11          HD22      LEU  11  15.659  -8.120  -3.308
   11   HD23  LEU  11          HD23      LEU  11  16.502  -8.975  -4.598

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  12           H        ILE  12  13.154 -11.203   0.303
    2    HA   ILE  12           HA       ILE  12  11.726  -9.002   1.365
    3    HB   ILE  12           HB       ILE  12  11.814 -11.883   2.314
    4   HG12  ILE  12          HG12      ILE  12  11.110 -11.271  -0.130
    5   HG13  ILE  12          HG13      ILE  12  10.093 -12.364   0.789
    6   HG21  ILE  12          HG21      ILE  12   9.869  -9.628   2.898
    7   HG23  ILE  12          HG22      ILE  12  10.841 -10.528   4.062
    8   HG22  ILE  12          HG23      ILE  12   9.514 -11.325   3.217
    9   HD13  ILE  12          HD11      ILE  12   8.562 -10.548   1.296
   10   HD12  ILE  12          HD12      ILE  12   8.830 -10.596  -0.446
   11   HD11  ILE  12          HD13      ILE  12   9.635  -9.388   0.532

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  13           H        ILE  13  14.160 -11.165   2.766
    2    HA   ILE  13           HA       ILE  13  14.181  -9.985   5.346
    3    HB   ILE  13           HB       ILE  13  16.265 -11.520   3.775
    4   HG12  ILE  13          HG12      ILE  13  14.023 -12.547   4.591
    5   HG13  ILE  13          HG13      ILE  13  15.515 -13.424   4.918
    6   HG22  ILE  13          HG21      ILE  13  17.384 -11.845   6.028
    7   HG21  ILE  13          HG22      ILE  13  16.366 -10.554   6.652
    8   HG23  ILE  13          HG23      ILE  13  17.525 -10.218   5.365
    9   HD11  ILE  13          HD11      ILE  13  14.650 -11.467   7.003
   10   HD13  ILE  13          HD12      ILE  13  15.398 -13.051   7.178
   11   HD12  ILE  13          HD13      ILE  13  13.679 -12.927   6.829

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ASN  14           H        ASN  14  16.118  -9.420   2.422
    2    HA   ASN  14           HA       ASN  14  17.830  -7.447   3.479
    3    HB2  ASN  14           HB2      ASN  14  17.825  -8.715   1.164
    4    HB3  ASN  14           HB3      ASN  14  16.905  -7.314   0.628
    5   HD21  ASN  14          HD21      ASN  14  19.348  -7.610  -0.563
    6   HD22  ASN  14          HD22      ASN  14  20.473  -6.505   0.061

  No H/Q in entry =           6
  In of MODEL   15
    1    H    SER  15           H        SER  15  14.709  -7.158   1.794
    2    HA   SER  15           HA       SER  15  14.545  -4.340   1.850
    3    HB2  SER  15           HB2      SER  15  12.215  -4.630   1.363
    4    HB3  SER  15           HB3      SER  15  13.037  -5.978   0.585
    5    HG   SER  15           HG       SER  15  11.644  -7.098   1.707

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLY  16           H        GLY  16  13.503  -6.819   4.157
    2    HA3  GLY  16           HA2      GLY  16  12.253  -5.093   6.016
    3    HA2  GLY  16           HA3      GLY  16  12.899  -6.689   6.377

  No H/Q in entry =           3
  In of MODEL   15
    1    H    GLN  17           H        GLN  17  15.602  -6.305   5.779
    2    HA   GLN  17           HA       GLN  17  16.541  -5.065   8.157
    3    HB2  GLN  17           HB2      GLN  17  17.791  -6.838   6.937
    4    HB3  GLN  17           HB3      GLN  17  18.099  -5.694   5.631
    5    HG2  GLN  17           HG2      GLN  17  19.252  -4.197   7.239
    6    HG3  GLN  17           HG3      GLN  17  18.987  -5.383   8.514
    7   HE21  GLN  17          HE21      GLN  17  21.088  -6.190   8.880
    8   HE22  GLN  17          HE22      GLN  17  22.071  -6.855   7.667

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ALA  18           H        ALA  18  16.324  -3.992   4.797
    2    HA   ALA  18           HA       ALA  18  17.714  -1.572   5.020
    3    HB2  ALA  18           HB1      ALA  18  16.615  -2.809   2.955
    4    HB3  ALA  18           HB2      ALA  18  16.846  -1.061   2.938
    5    HB1  ALA  18           HB3      ALA  18  15.260  -1.737   3.312

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ARG  19           H        ARG  19  14.227  -2.228   5.424
    2    HA   ARG  19           HA       ARG  19  13.509   0.409   6.140
    3    HB2  ARG  19           HB2      ARG  19  11.861  -1.375   5.557
    4    HB3  ARG  19           HB3      ARG  19  12.222  -2.165   7.094
    5    HG2  ARG  19           HG2      ARG  19  11.475  -0.188   8.334
    6    HG3  ARG  19           HG3      ARG  19  11.205   0.683   6.826
    7    HD2  ARG  19           HD2      ARG  19   9.081  -0.154   7.651
    8    HD3  ARG  19           HD3      ARG  19   9.514  -1.026   6.174
    9    HE   ARG  19           HE       ARG  19  10.507  -2.549   8.277
   10   HH21  ARG  19          HH11      ARG  19   9.292  -4.212   9.220
   11   HH22  ARG  19          HH12      ARG  19   7.571  -4.219   9.052
   12   HH11  ARG  19          HH21      ARG  19   7.486  -1.315   7.188
   13   HH12  ARG  19          HH22      ARG  19   6.549  -2.578   7.898

  No H/Q in entry =          13
  In of MODEL   15
    1    H    SER  20           H        SER  20  14.426  -2.403   8.098
    2    HA   SER  20           HA       SER  20  14.127  -1.308  10.636
    3    HB2  SER  20           HB2      SER  20  14.679  -3.681  10.242
    4    HB3  SER  20           HB3      SER  20  16.289  -3.214   9.701
    5    HG   SER  20           HG       SER  20  15.480  -2.204  12.149

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU  21           H        LEU  21  16.964  -1.192   8.494
    2    HA   LEU  21           HA       LEU  21  18.613   0.327  10.228
    3    HB2  LEU  21           HB2      LEU  21  18.591   0.054   7.214
    4    HB3  LEU  21           HB3      LEU  21  19.831   0.937   8.102
    5    HG   LEU  21           HG       LEU  21  19.146  -1.968   8.639
    6   HD11  LEU  21          HD11      LEU  21  21.136  -0.694   6.764
    7   HD13  LEU  21          HD12      LEU  21  20.003  -2.006   6.442
    8   HD12  LEU  21          HD13      LEU  21  21.423  -2.296   7.445
    9   HD22  LEU  21          HD21      LEU  21  20.300  -1.254  10.538
   10   HD21  LEU  21          HD22      LEU  21  21.218  -0.032   9.665
   11   HD23  LEU  21          HD23      LEU  21  21.658  -1.726   9.521

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ALA  22           H        ALA  22  16.325   1.251   7.676
    2    HA   ALA  22           HA       ALA  22  16.811   4.019   7.689
    3    HB3  ALA  22           HB1      ALA  22  15.429   2.749   6.013
    4    HB2  ALA  22           HB2      ALA  22  14.694   4.248   6.581
    5    HB1  ALA  22           HB3      ALA  22  14.135   2.698   7.210

  No H/Q in entry =           5
  In of MODEL   15
    1    H    TYR  23           H        TYR  23  14.353   2.156   9.529
    2    HA   TYR  23           HA       TYR  23  13.350   4.374  10.979
    3    HB2  TYR  23           HB2      TYR  23  12.154   2.240  10.963
    4    HB3  TYR  23           HB3      TYR  23  13.502   1.451  11.780
    5    HD1  TYR  23           HD1      TYR  23  10.949   4.145  12.162
    6    HD2  TYR  23           HD2      TYR  23  13.714   1.516  14.136
    7    HE1  TYR  23           HE1      TYR  23  10.018   4.817  14.362
    8    HE2  TYR  23           HE2      TYR  23  12.783   2.187  16.334
    9    HH   TYR  23           HH       TYR  23  10.334   3.174  17.068

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ALA  24           H        ALA  24  16.040   2.150  11.612
    2    HA   ALA  24           HA       ALA  24  16.695   3.158  14.174
    3    HB1  ALA  24           HB1      ALA  24  18.085   1.391  14.007
    4    HB3  ALA  24           HB2      ALA  24  19.093   2.332  12.906
    5    HB2  ALA  24           HB3      ALA  24  17.817   1.299  12.267

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA  25           H        ALA  25  17.629   4.104  10.893
    2    HA   ALA  25           HA       ALA  25  19.538   6.075  11.534
    3    HB1  ALA  25           HB1      ALA  25  18.835   5.113   9.221
    4    HB3  ALA  25           HB2      ALA  25  19.305   6.810   9.312
    5    HB2  ALA  25           HB3      ALA  25  17.599   6.371   9.247

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU  26           H        LEU  26  16.019   6.238  11.180
    2    HA   LEU  26           HA       LEU  26  15.744   9.016  11.631
    3    HB2  LEU  26           HB2      LEU  26  13.904   7.745  10.706
    4    HB3  LEU  26           HB3      LEU  26  13.835   6.717  12.132
    5    HG   LEU  26           HG       LEU  26  13.196   8.663  13.513
    6   HD12  LEU  26          HD11      LEU  26  12.493  10.751  12.188
    7   HD11  LEU  26          HD12      LEU  26  13.484  10.116  10.877
    8   HD13  LEU  26          HD13      LEU  26  14.224  10.515  12.428
    9   HD21  LEU  26          HD21      LEU  26  11.521   8.319  11.006
   10   HD23  LEU  26          HD22      LEU  26  10.951   9.006  12.524
   11   HD22  LEU  26          HD23      LEU  26  11.434   7.314  12.453

  No H/Q in entry =          11
  In of MODEL   15
    1    H    LYS  27           H        LYS  27  15.691   6.235  13.824
    2    HA   LYS  27           HA       LYS  27  15.078   7.591  16.193
    3    HB2  LYS  27           HB2      LYS  27  15.150   5.116  15.929
    4    HB3  LYS  27           HB3      LYS  27  16.912   5.201  15.882
    5    HG2  LYS  27           HG2      LYS  27  16.949   6.188  18.132
    6    HG3  LYS  27           HG3      LYS  27  15.182   6.174  18.180
    7    HD2  LYS  27           HD2      LYS  27  15.201   3.707  17.944
    8    HD3  LYS  27           HD3      LYS  27  16.965   3.728  17.929
    9    HE2  LYS  27           HE2      LYS  27  16.986   4.718  20.186
   10    HE3  LYS  27           HE3      LYS  27  15.220   4.727  20.203
   11    HZ3  LYS  27           HZ1      LYS  27  16.044   2.789  21.353
   12    HZ2  LYS  27           HZ2      LYS  27  16.966   2.326  20.001
   13    HZ1  LYS  27           HZ3      LYS  27  15.268   2.301  19.924

  No H/Q in entry =          13
  In of MODEL   15
    1    H    GLN  28           H        GLN  28  18.201   7.063  14.596
    2    HA   GLN  28           HA       GLN  28  19.870   8.177  16.583
    3    HB2  GLN  28           HB2      GLN  28  20.153   8.135  13.567
    4    HB3  GLN  28           HB3      GLN  28  21.433   8.630  14.675
    5    HG2  GLN  28           HG2      GLN  28  20.063   5.925  14.707
    6    HG3  GLN  28           HG3      GLN  28  21.647   6.245  14.003
    7   HE21  GLN  28          HE21      GLN  28  20.362   4.909  16.695
    8   HE22  GLN  28          HE22      GLN  28  21.534   5.346  17.841

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ALA  29           H        ALA  29  18.088   9.628  13.893
    2    HA   ALA  29           HA       ALA  29  19.042  12.266  14.144
    3    HB2  ALA  29           HB1      ALA  29  17.330  12.873  12.676
    4    HB1  ALA  29           HB2      ALA  29  16.207  11.681  13.329
    5    HB3  ALA  29           HB3      ALA  29  17.545  11.161  12.304

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LYS  30           H        LYS  30  16.296  10.620  15.671
    2    HA   LYS  30           HA       LYS  30  15.247  12.856  17.029
    3    HB2  LYS  30           HB2      LYS  30  15.185   9.914  17.734
    4    HB3  LYS  30           HB3      LYS  30  14.300  11.150  18.629
    5    HG2  LYS  30           HG2      LYS  30  13.160  11.817  16.513
    6    HG3  LYS  30           HG3      LYS  30  13.985  10.494  15.684
    7    HD2  LYS  30           HD2      LYS  30  12.943   8.870  17.215
    8    HD3  LYS  30           HD3      LYS  30  12.128  10.182  18.067
    9    HE2  LYS  30           HE2      LYS  30  10.946  10.795  15.977
   10    HE3  LYS  30           HE3      LYS  30  11.741   9.454  15.145
   11    HZ2  LYS  30           HZ1      LYS  30   9.441   9.007  16.029
   12    HZ1  LYS  30           HZ2      LYS  30  10.111   9.071  17.595
   13    HZ3  LYS  30           HZ3      LYS  30  10.636   7.894  16.484

  No H/Q in entry =          13
  In of MODEL   15
    1    H    GLN  31           H        GLN  31  17.944  10.731  17.761
    2    HA   GLN  31           HA       GLN  31  18.260  11.751  20.455
    3    HB2  GLN  31           HB2      GLN  31  20.305  10.213  18.847
    4    HB3  GLN  31           HB3      GLN  31  20.172  10.335  20.601
    5    HG2  GLN  31           HG2      GLN  31  17.673   9.342  19.837
    6    HG3  GLN  31           HG3      GLN  31  18.786   8.516  18.755
    7   HE21  GLN  31          HE21      GLN  31  17.267   7.345  21.035
    8   HE22  GLN  31          HE22      GLN  31  18.435   6.703  22.083

  No H/Q in entry =           8
  In of MODEL   15
    1    H    GLY  32           H        GLY  32  18.752  13.076  17.488
    2    HA3  GLY  32           HA2      GLY  32  19.702  15.137  16.971
    3    HA2  GLY  32           HA3      GLY  32  20.462  15.154  18.558

  No H/Q in entry =           3
  In of MODEL   15
    1    H    ASP  33           H        ASP  33  20.928  12.269  16.780
    2    HA   ASP  33           HA       ASP  33  23.741  12.990  16.308
    3    HB2  ASP  33           HB2      ASP  33  22.275  10.350  16.428
    4    HB3  ASP  33           HB3      ASP  33  23.959  10.493  15.929

  No H/Q in entry =           4
  In of MODEL   15
    1    H    PHE  34           H        PHE  34  23.234  14.305  14.428
    2    HA   PHE  34           HA       PHE  34  21.897  13.298  12.143
    3    HB2  PHE  34           HB2      PHE  34  23.993  15.467  12.369
    4    HB3  PHE  34           HB3      PHE  34  23.010  15.161  10.939
    5    HD1  PHE  34           HD1      PHE  34  23.235  17.099  13.852
    6    HD2  PHE  34           HD2      PHE  34  20.388  14.936  11.472
    7    HE1  PHE  34           HE1      PHE  34  21.398  18.467  14.803
    8    HE2  PHE  34           HE2      PHE  34  18.555  16.304  12.426
    9    HZ   PHE  34           HZ       PHE  34  19.063  18.070  14.086

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ALA  35           H        ALA  35  25.276  13.167  13.145
    2    HA   ALA  35           HA       ALA  35  26.390  12.364  10.685
    3    HB3  ALA  35           HB1      ALA  35  28.093  11.222  12.402
    4    HB2  ALA  35           HB2      ALA  35  27.215  12.233  13.549
    5    HB1  ALA  35           HB3      ALA  35  28.037  12.970  12.175

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA  36           H        ALA  36  25.313  10.390  13.453
    2    HA   ALA  36           HA       ALA  36  25.836   7.910  12.177
    3    HB2  ALA  36           HB1      ALA  36  25.422   7.157  14.253
    4    HB3  ALA  36           HB2      ALA  36  23.726   7.623  14.106
    5    HB1  ALA  36           HB3      ALA  36  24.909   8.775  14.727

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA  37           H        ALA  37  22.979   9.988  12.316
    2    HA   ALA  37           HA       ALA  37  21.151   8.187  11.144
    3    HB3  ALA  37           HB1      ALA  37  21.326  11.154  11.435
    4    HB1  ALA  37           HB2      ALA  37  20.034  10.053  11.911
    5    HB2  ALA  37           HB3      ALA  37  20.212  10.528  10.221

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LYS  38           H        LYS  38  23.205  10.684   9.661
    2    HA   LYS  38           HA       LYS  38  22.567  10.245   6.985
    3    HB2  LYS  38           HB2      LYS  38  24.353  11.834   8.426
    4    HB3  LYS  38           HB3      LYS  38  25.401  10.862   7.398
    5    HG2  LYS  38           HG2      LYS  38  24.219  11.612   5.405
    6    HG3  LYS  38           HG3      LYS  38  23.011  12.446   6.388
    7    HD2  LYS  38           HD2      LYS  38  24.580  14.072   7.137
    8    HD3  LYS  38           HD3      LYS  38  25.956  13.110   6.599
    9    HE2  LYS  38           HE2      LYS  38  25.563  14.975   5.048
   10    HE3  LYS  38           HE3      LYS  38  25.254  13.431   4.244
   11    HZ3  LYS  38           HZ1      LYS  38  23.049  13.837   4.119
   12    HZ2  LYS  38           HZ2      LYS  38  23.543  15.461   4.205
   13    HZ1  LYS  38           HZ3      LYS  38  22.986  14.667   5.598

  No H/Q in entry =          13
  In of MODEL   15
    1    H    ALA  39           H        ALA  39  25.113   8.692   8.936
    2    HA   ALA  39           HA       ALA  39  26.207   7.123   6.864
    3    HB2  ALA  39           HB1      ALA  39  26.141   6.158   9.708
    4    HB1  ALA  39           HB2      ALA  39  27.067   7.601   9.290
    5    HB3  ALA  39           HB3      ALA  39  27.445   6.057   8.526

  No H/Q in entry =           5
  In of MODEL   15
    1    H    MET  40           H        MET  40  23.610   6.460   9.168
    2    HA   MET  40           HA       MET  40  23.214   3.748   8.435
    3    HB2  MET  40           HB2      MET  40  21.364   5.758   9.730
    4    HB3  MET  40           HB3      MET  40  20.988   4.042   9.556
    5    HG2  MET  40           HG2      MET  40  23.522   5.029  10.892
    6    HG3  MET  40           HG3      MET  40  22.035   4.727  11.788
    7    HE3  MET  40           HE1      MET  40  21.538   1.084  11.965
    8    HE2  MET  40           HE2      MET  40  20.644   2.370  11.160
    9    HE1  MET  40           HE3      MET  40  21.383   2.671  12.731

  No H/Q in entry =           9
  In of MODEL   15
    1    H    MET  41           H        MET  41  21.742   6.774   7.250
    2    HA   MET  41           HA       MET  41  19.804   5.544   5.582
    3    HB2  MET  41           HB2      MET  41  21.236   8.161   5.066
    4    HB3  MET  41           HB3      MET  41  19.716   7.639   4.350
    5    HG2  MET  41           HG2      MET  41  18.979   7.437   6.903
    6    HG3  MET  41           HG3      MET  41  20.267   8.619   7.122
    7    HE2  MET  41           HE1      MET  41  19.674   9.895   3.787
    8    HE1  MET  41           HE2      MET  41  20.625  10.353   5.196
    9    HE3  MET  41           HE3      MET  41  19.331  11.408   4.635

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ASP  42           H        ASP  42  23.158   6.529   5.022
    2    HA   ASP  42           HA       ASP  42  23.253   6.056   2.264
    3    HB2  ASP  42           HB2      ASP  42  24.989   7.086   4.030
    4    HB3  ASP  42           HB3      ASP  42  25.676   5.473   3.901

  No H/Q in entry =           4
  In of MODEL   15
    1    H    GLN  43           H        GLN  43  24.023   3.915   4.983
    2    HA   GLN  43           HA       GLN  43  24.726   1.670   3.399
    3    HB2  GLN  43           HB2      GLN  43  23.706   1.835   6.245
    4    HB3  GLN  43           HB3      GLN  43  24.311   0.357   5.489
    5    HG2  GLN  43           HG2      GLN  43  26.450   1.608   4.973
    6    HG3  GLN  43           HG3      GLN  43  25.844   2.924   5.974
    7   HE21  GLN  43          HE21      GLN  43  28.098   1.993   7.006
    8   HE22  GLN  43          HE22      GLN  43  27.846   0.905   8.283

  No H/Q in entry =           8
  In of MODEL   15
    1    H    SER  44           H        SER  44  21.652   2.747   4.791
    2    HA   SER  44           HA       SER  44  20.124   0.475   4.121
    3    HB2  SER  44           HB2      SER  44  19.638   2.995   5.268
    4    HB3  SER  44           HB3      SER  44  18.601   2.933   3.845
    5    HG   SER  44           HG       SER  44  17.529   1.970   5.570

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ARG  45           H        ARG  45  20.808   3.453   2.315
    2    HA   ARG  45           HA       ARG  45  19.287   2.939   0.013
    3    HB2  ARG  45           HB2      ARG  45  20.392   5.096   0.595
    4    HB3  ARG  45           HB3      ARG  45  21.950   4.370   0.206
    5    HG2  ARG  45           HG2      ARG  45  21.169   3.949  -2.106
    6    HG3  ARG  45           HG3      ARG  45  19.623   4.699  -1.716
    7    HD2  ARG  45           HD2      ARG  45  20.836   6.818  -1.135
    8    HD3  ARG  45           HD3      ARG  45  22.345   6.072  -1.707
    9    HE   ARG  45           HE       ARG  45  20.415   5.799  -3.739
   10   HH21  ARG  45          HH11      ARG  45  20.379   7.167  -5.502
   11   HH22  ARG  45          HH12      ARG  45  21.108   8.731  -5.399
   12   HH11  ARG  45          HH21      ARG  45  22.103   8.329  -2.116
   13   HH12  ARG  45          HH22      ARG  45  22.083   9.388  -3.479

  No H/Q in entry =          13
  In of MODEL   15
    1    H    MET  46           H        MET  46  22.668   2.126   0.753
    2    HA   MET  46           HA       MET  46  23.290   0.944  -1.732
    3    HB2  MET  46           HB2      MET  46  24.409   0.635   1.055
    4    HB3  MET  46           HB3      MET  46  25.079  -0.242  -0.325
    5    HG2  MET  46           HG2      MET  46  25.458   1.886  -1.508
    6    HG3  MET  46           HG3      MET  46  24.770   2.772  -0.153
    7    HE2  MET  46           HE1      MET  46  26.935   4.276   0.689
    8    HE1  MET  46           HE2      MET  46  27.088   3.840  -1.011
    9    HE3  MET  46           HE3      MET  46  28.485   3.704   0.055

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ALA  47           H        ALA  47  21.938  -0.414   1.247
    2    HA   ALA  47           HA       ALA  47  21.930  -3.127   0.445
    3    HB2  ALA  47           HB1      ALA  47  21.550  -2.673   2.751
    4    HB3  ALA  47           HB2      ALA  47  20.022  -3.303   2.136
    5    HB1  ALA  47           HB3      ALA  47  20.222  -1.568   2.393

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU  48           H        LEU  48  19.531  -0.542   0.094
    2    HA   LEU  48           HA       LEU  48  17.510  -2.111  -1.151
    3    HB2  LEU  48           HB2      LEU  48  18.112   0.854  -1.268
    4    HB3  LEU  48           HB3      LEU  48  16.652   0.118  -1.930
    5    HG   LEU  48           HG       LEU  48  17.519  -0.168   0.956
    6   HD13  LEU  48          HD11      LEU  48  17.061   2.125   0.770
    7   HD12  LEU  48          HD12      LEU  48  15.515   1.451   1.284
    8   HD11  LEU  48          HD13      LEU  48  15.774   1.877  -0.408
    9   HD22  LEU  48          HD21      LEU  48  16.019  -1.909   0.580
   10   HD21  LEU  48          HD22      LEU  48  15.126  -1.022  -0.656
   11   HD23  LEU  48          HD23      LEU  48  14.912  -0.620   1.048

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ASN  49           H        ASN  49  20.160  -0.138  -2.390
    2    HA   ASN  49           HA       ASN  49  19.503  -0.234  -5.112
    3    HB2  ASN  49           HB2      ASN  49  21.162   1.308  -4.179
    4    HB3  ASN  49           HB3      ASN  49  22.218  -0.040  -3.777
    5   HD21  ASN  49          HD21      ASN  49  23.907   0.800  -5.183
    6   HD22  ASN  49          HD22      ASN  49  23.772   0.707  -6.872

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLU  50           H        GLU  50  21.530  -2.393  -3.154
    2    HA   GLU  50           HA       GLU  50  22.255  -4.138  -5.282
    3    HB2  GLU  50           HB2      GLU  50  23.459  -4.091  -3.119
    4    HB3  GLU  50           HB3      GLU  50  22.030  -4.743  -2.318
    5    HG2  GLU  50           HG2      GLU  50  22.149  -6.775  -3.676
    6    HG3  GLU  50           HG3      GLU  50  23.511  -6.120  -4.582

  No H/Q in entry =           6
  In of MODEL   15
    1    H    ALA  51           H        ALA  51  19.605  -4.116  -2.947
    2    HA   ALA  51           HA       ALA  51  18.479  -6.609  -3.699
    3    HB3  ALA  51           HB1      ALA  51  16.883  -6.129  -2.139
    4    HB1  ALA  51           HB2      ALA  51  16.640  -4.487  -2.738
    5    HB2  ALA  51           HB3      ALA  51  18.009  -4.849  -1.686

  No H/Q in entry =           5
  In of MODEL   15
    1    H    HIS  52           H        HIS  52  17.833  -3.272  -4.734
    2    HA   HIS  52           HA       HIS  52  15.723  -3.836  -6.526
    3    HB2  HIS  52           HB2      HIS  52  16.276  -1.560  -5.760
    4    HB3  HIS  52           HB3      HIS  52  17.792  -1.628  -6.658
    5    HD1  HIS  52           HD1      HIS  52  17.524  -1.958  -9.335
    6    HD2  HIS  52           HD2      HIS  52  14.089  -0.776  -7.291
    7    HE1  HIS  52           HE1      HIS  52  15.920  -1.071 -11.083
    8    HE2  HIS  52           HE2      HIS  52  13.822  -0.345  -9.852

  No H/Q in entry =           8
  In of MODEL   15
    1    H    LEU  53           H        LEU  53  19.239  -3.782  -6.971
    2    HA   LEU  53           HA       LEU  53  19.292  -4.099  -9.771
    3    HB2  LEU  53           HB2      LEU  53  21.245  -4.828  -7.604
    4    HB3  LEU  53           HB3      LEU  53  21.562  -5.206  -9.295
    5    HG   LEU  53           HG       LEU  53  20.837  -2.409  -8.371
    6   HD11  LEU  53          HD11      LEU  53  23.562  -3.705  -8.666
    7   HD13  LEU  53          HD12      LEU  53  22.871  -3.002  -7.204
    8   HD12  LEU  53          HD13      LEU  53  23.309  -1.965  -8.558
    9   HD21  LEU  53          HD21      LEU  53  21.981  -3.618 -10.898
   10   HD23  LEU  53          HD22      LEU  53  22.242  -1.921 -10.507
   11   HD22  LEU  53          HD23      LEU  53  20.613  -2.523 -10.746

  No H/Q in entry =          11
  In of MODEL   15
    1    H    VAL  54           H        VAL  54  19.230  -6.485  -7.143
    2    HA   VAL  54           HA       VAL  54  19.387  -8.778  -8.801
    3    HB   VAL  54           HB       VAL  54  18.235  -8.372  -6.030
    4   HG12  VAL  54          HG11      VAL  54  18.605 -10.984  -6.025
    5   HG11  VAL  54          HG12      VAL  54  18.411 -10.820  -7.770
    6   HG13  VAL  54          HG13      VAL  54  17.117 -10.311  -6.687
    7   HG22  VAL  54          HG21      VAL  54  20.547  -8.121  -5.815
    8   HG21  VAL  54          HG22      VAL  54  20.899  -9.208  -7.157
    9   HG23  VAL  54          HG23      VAL  54  20.386  -9.863  -5.602

  No H/Q in entry =           9
  In of MODEL   15
    1    H    GLN  55           H        GLN  55  16.630  -6.922  -7.511
    2    HA   GLN  55           HA       GLN  55  14.635  -8.623  -8.576
    3    HB2  GLN  55           HB2      GLN  55  13.866  -7.109  -6.948
    4    HB3  GLN  55           HB3      GLN  55  14.632  -5.728  -7.728
    5    HG2  GLN  55           HG2      GLN  55  12.897  -5.435  -9.213
    6    HG3  GLN  55           HG3      GLN  55  12.605  -7.162  -9.380
    7   HE21  GLN  55          HE21      GLN  55  10.611  -7.745  -8.567
    8   HE22  GLN  55          HE22      GLN  55   9.828  -7.004  -7.257

  No H/Q in entry =           8
  In of MODEL   15
    1    H    THR  56           H        THR  56  16.320  -5.794  -9.944
    2    HA   THR  56           HA       THR  56  14.868  -5.460 -12.288
    3    HB   THR  56           HB       THR  56  17.885  -5.318 -12.137
    4    HG1  THR  56           HG1      THR  56  16.281  -4.142 -10.546
    5   HG23  THR  56          HG21      THR  56  17.753  -3.893 -13.975
    6   HG22  THR  56          HG22      THR  56  16.075  -3.462 -13.645
    7   HG21  THR  56          HG23      THR  56  16.461  -5.042 -14.329

  No H/Q in entry =           7
  In of MODEL   15
    1    H    LYS  57           H        LYS  57  17.560  -7.709 -11.683
    2    HA   LYS  57           HA       LYS  57  17.574  -8.906 -14.260
    3    HB2  LYS  57           HB2      LYS  57  19.375  -9.124 -12.521
    4    HB3  LYS  57           HB3      LYS  57  18.291 -10.138 -11.579
    5    HG2  LYS  57           HG2      LYS  57  18.218 -11.794 -13.370
    6    HG3  LYS  57           HG3      LYS  57  19.216 -10.770 -14.397
    7    HD2  LYS  57           HD2      LYS  57  21.064 -10.933 -12.753
    8    HD3  LYS  57           HD3      LYS  57  20.071 -11.992 -11.752
    9    HE2  LYS  57           HE2      LYS  57  20.809 -12.601 -14.635
   10    HE3  LYS  57           HE3      LYS  57  21.689 -13.241 -13.248
   11    HZ3  LYS  57           HZ1      LYS  57  20.167 -14.888 -13.725
   12    HZ2  LYS  57           HZ2      LYS  57  18.924 -13.794 -14.096
   13    HZ1  LYS  57           HZ3      LYS  57  19.394 -14.032 -12.482

  No H/Q in entry =          13
  In of MODEL   15
    1    H    LEU  58           H        LEU  58  15.816  -9.602 -11.278
    2    HA   LEU  58           HA       LEU  58  14.635 -11.999 -12.205
    3    HB2  LEU  58           HB2      LEU  58  13.813 -10.106 -10.009
    4    HB3  LEU  58           HB3      LEU  58  13.034 -11.658 -10.321
    5    HG   LEU  58           HG       LEU  58  16.003 -11.325  -9.777
    6   HD11  LEU  58          HD11      LEU  58  13.646 -11.784  -7.975
    7   HD13  LEU  58          HD12      LEU  58  15.083 -10.793  -7.719
    8   HD12  LEU  58          HD13      LEU  58  15.188 -12.548  -7.582
    9   HD22  LEU  58          HD21      LEU  58  15.920 -13.390 -10.802
   10   HD21  LEU  58          HD22      LEU  58  14.211 -13.630 -10.435
   11   HD23  LEU  58          HD23      LEU  58  15.430 -13.907  -9.189

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  59           H        ILE  59  13.900  -8.676 -12.890
    2    HA   ILE  59           HA       ILE  59  11.193  -9.376 -13.819
    3    HB   ILE  59           HB       ILE  59  11.950  -7.081 -12.616
    4   HG12  ILE  59          HG12      ILE  59  10.061  -6.972 -14.978
    5   HG13  ILE  59          HG13      ILE  59   9.642  -7.771 -13.485
    6   HG22  ILE  59          HG21      ILE  59  12.041  -6.262 -15.507
    7   HG21  ILE  59          HG22      ILE  59  13.517  -6.661 -14.657
    8   HG23  ILE  59          HG23      ILE  59  12.502  -5.333 -14.101
    9   HD13  ILE  59          HD11      ILE  59   8.801  -5.498 -13.399
   10   HD12  ILE  59          HD12      ILE  59  10.399  -4.866 -13.798
   11   HD11  ILE  59          HD13      ILE  59  10.127  -5.657 -12.244

  No H/Q in entry =          11
  In of MODEL   15
    1    H    GLU  60           H        GLU  60  14.376  -8.466 -15.090
    2    HA   GLU  60           HA       GLU  60  13.580  -8.084 -17.796
    3    HB2  GLU  60           HB2      GLU  60  15.747  -7.308 -16.958
    4    HB3  GLU  60           HB3      GLU  60  16.242  -8.969 -16.647
    5    HG2  GLU  60           HG2      GLU  60  16.058  -9.484 -19.054
    6    HG3  GLU  60           HG3      GLU  60  15.552  -7.825 -19.371

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLY  61           H        GLY  61  14.617 -10.944 -15.981
    2    HA3  GLY  61           HA2      GLY  61  14.097 -12.605 -18.378
    3    HA2  GLY  61           HA3      GLY  61  15.143 -13.065 -17.039

  No H/Q in entry =           3
  In of MODEL   15
    1    H    ASP  62           H        ASP  62  11.998 -11.576 -16.655
    2    HA   ASP  62           HA       ASP  62  11.109 -13.606 -14.871
    3    HB2  ASP  62           HB2      ASP  62  10.422 -11.253 -14.688
    4    HB3  ASP  62           HB3      ASP  62   9.557 -11.388 -16.215

  No H/Q in entry =           4
  In of MODEL   15
    1    H    ALA  63           H        ALA  63  11.686 -15.175 -16.969
    2    HA   ALA  63           HA       ALA  63   9.647 -15.567 -18.912
    3    HB3  ALA  63           HB1      ALA  63  10.641 -17.971 -18.903
    4    HB2  ALA  63           HB2      ALA  63  11.818 -17.310 -17.769
    5    HB1  ALA  63           HB3      ALA  63  11.683 -16.634 -19.391

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLY  64           H        GLY  64  10.142 -16.808 -15.659
    2    HA3  GLY  64           HA2      GLY  64   8.566 -17.599 -14.146
    3    HA2  GLY  64           HA3      GLY  64   7.339 -17.486 -15.401

  No H/Q in entry =           3
  In of MODEL   15
    1    H    GLU  65           H        GLU  65   6.915 -19.647 -14.116
    2    HA   GLU  65           HA       GLU  65   8.581 -21.869 -14.636
    3    HB2  GLU  65           HB2      GLU  65   5.668 -21.698 -13.882
    4    HB3  GLU  65           HB3      GLU  65   6.557 -23.215 -13.998
    5    HG2  GLU  65           HG2      GLU  65   8.154 -22.455 -12.317
    6    HG3  GLU  65           HG3      GLU  65   7.367 -20.879 -12.245

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLY  66           H        GLY  66   5.760 -20.628 -16.272
    2    HA3  GLY  66           HA2      GLY  66   6.047 -22.599 -18.438
    3    HA2  GLY  66           HA3      GLY  66   4.578 -21.724 -18.057

  No H/Q in entry =           3
  In of MODEL   15
    1    H    LYS  67           H        LYS  67   5.093 -21.696 -20.567
    2    HA   LYS  67           HA       LYS  67   6.857 -20.246 -21.909
    3    HB2  LYS  67           HB2      LYS  67   4.864 -19.439 -23.354
    4    HB3  LYS  67           HB3      LYS  67   5.136 -21.175 -23.166
    5    HG2  LYS  67           HG2      LYS  67   3.489 -21.276 -21.362
    6    HG3  LYS  67           HG3      LYS  67   3.258 -19.531 -21.443
    7    HD2  LYS  67           HD2      LYS  67   2.437 -19.769 -23.774
    8    HD3  LYS  67           HD3      LYS  67   2.610 -21.520 -23.636
    9    HE2  LYS  67           HE2      LYS  67   0.857 -19.785 -21.868
   10    HE3  LYS  67           HE3      LYS  67   0.282 -20.816 -23.178
   11    HZ1  LYS  67           HZ1      LYS  67   1.866 -22.433 -21.624
   12    HZ3  LYS  67           HZ2      LYS  67   0.170 -22.437 -21.695
   13    HZ2  LYS  67           HZ3      LYS  67   0.972 -21.517 -20.512

  No H/Q in entry =          13
  In of MODEL   15
    1    H    MET  68           H        MET  68   4.176 -18.280 -22.168
    2    HA   MET  68           HA       MET  68   5.540 -15.855 -21.828
    3    HB2  MET  68           HB2      MET  68   2.577 -16.441 -21.847
    4    HB3  MET  68           HB3      MET  68   3.293 -14.837 -22.006
    5    HG2  MET  68           HG2      MET  68   3.853 -17.167 -23.862
    6    HG3  MET  68           HG3      MET  68   2.742 -15.841 -24.215
    7    HE2  MET  68           HE1      MET  68   4.305 -13.133 -23.134
    8    HE1  MET  68           HE2      MET  68   3.161 -13.614 -24.384
    9    HE3  MET  68           HE3      MET  68   4.665 -12.815 -24.836

  No H/Q in entry =           9
  In of MODEL   15
    1    H    LYS  69           H        LYS  69   3.390 -17.575 -19.545
    2    HA   LYS  69           HA       LYS  69   2.797 -15.727 -17.688
    3    HB2  LYS  69           HB2      LYS  69   2.193 -18.107 -17.544
    4    HB3  LYS  69           HB3      LYS  69   3.835 -18.481 -17.012
    5    HG2  LYS  69           HG2      LYS  69   3.576 -17.074 -15.046
    6    HG3  LYS  69           HG3      LYS  69   1.990 -16.536 -15.600
    7    HD2  LYS  69           HD2      LYS  69   1.149 -18.851 -15.438
    8    HD3  LYS  69           HD3      LYS  69   2.733 -19.384 -14.869
    9    HE2  LYS  69           HE2      LYS  69   1.268 -19.032 -12.946
   10    HE3  LYS  69           HE3      LYS  69   2.534 -17.806 -12.949
   11    HZ2  LYS  69           HZ1      LYS  69  -0.206 -17.400 -12.948
   12    HZ1  LYS  69           HZ2      LYS  69   0.341 -16.921 -14.483
   13    HZ3  LYS  69           HZ3      LYS  69   1.010 -16.225 -13.086

  No H/Q in entry =          13
  In of MODEL   15
    1    H    VAL  70           H        VAL  70   3.602 -15.058 -15.585
    2    HA   VAL  70           HA       VAL  70   6.554 -14.751 -15.529
    3    HB   VAL  70           HB       VAL  70   5.898 -12.703 -14.066
    4   HG11  VAL  70          HG11      VAL  70   6.869 -12.670 -16.392
    5   HG13  VAL  70          HG12      VAL  70   5.811 -11.303 -16.043
    6   HG12  VAL  70          HG13      VAL  70   5.222 -12.646 -17.021
    7   HG21  VAL  70          HG21      VAL  70   3.489 -13.359 -13.861
    8   HG23  VAL  70          HG22      VAL  70   3.312 -13.137 -15.601
    9   HG22  VAL  70          HG23      VAL  70   3.678 -11.755 -14.569

  No H/Q in entry =           9
  In of MODEL   15
    1    H    SER  71           H        SER  71   7.516 -14.637 -13.398
    2    HA   SER  71           HA       SER  71   6.638 -16.686 -11.617
    3    HB2  SER  71           HB2      SER  71   9.026 -15.970 -11.924
    4    HB3  SER  71           HB3      SER  71   8.638 -14.480 -11.067
    5    HG   SER  71           HG       SER  71   9.141 -16.947 -10.098

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU  72           H        LEU  72   5.227 -16.570 -10.007
    2    HA   LEU  72           HA       LEU  72   3.637 -14.285  -9.560
    3    HB2  LEU  72           HB2      LEU  72   3.976 -16.833  -7.985
    4    HB3  LEU  72           HB3      LEU  72   2.783 -15.599  -7.588
    5    HG   LEU  72           HG       LEU  72   2.966 -16.897 -10.327
    6   HD12  LEU  72          HD11      LEU  72   1.153 -17.591  -7.994
    7   HD11  LEU  72          HD12      LEU  72   2.467 -18.596  -8.604
    8   HD13  LEU  72          HD13      LEU  72   1.056 -18.283  -9.614
    9   HD22  LEU  72          HD21      LEU  72   1.700 -14.932 -10.571
   10   HD21  LEU  72          HD22      LEU  72   1.022 -15.035  -8.955
   11   HD23  LEU  72          HD23      LEU  72   0.456 -16.124 -10.217

  No H/Q in entry =          11
  In of MODEL   15
    1    H    VAL  73           H        VAL  73   6.324 -15.671  -7.793
    2    HA   VAL  73           HA       VAL  73   6.242 -14.138  -5.462
    3    HB   VAL  73           HB       VAL  73   8.441 -14.906  -5.041
    4   HG12  VAL  73          HG11      VAL  73   7.374 -17.053  -6.864
    5   HG11  VAL  73          HG12      VAL  73   6.508 -16.612  -5.393
    6   HG13  VAL  73          HG13      VAL  73   8.159 -17.223  -5.295
    7   HG22  VAL  73          HG21      VAL  73   9.748 -14.306  -6.878
    8   HG21  VAL  73          HG22      VAL  73   8.609 -14.989  -8.038
    9   HG23  VAL  73          HG23      VAL  73   9.644 -16.055  -7.087

  No H/Q in entry =           9
  In of MODEL   15
    1    H    LEU  74           H        LEU  74   7.207 -13.228  -8.641
    2    HA   LEU  74           HA       LEU  74   9.117 -11.244  -8.155
    3    HB2  LEU  74           HB2      LEU  74   8.669 -12.002 -10.391
    4    HB3  LEU  74           HB3      LEU  74   6.994 -11.466 -10.287
    5    HG   LEU  74           HG       LEU  74   7.801  -9.118 -10.021
    6   HD11  LEU  74          HD11      LEU  74  10.455 -10.523 -10.306
    7   HD13  LEU  74          HD12      LEU  74   9.978  -9.309  -9.121
    8   HD12  LEU  74          HD13      LEU  74  10.266  -8.839 -10.796
    9   HD21  LEU  74          HD21      LEU  74   7.338 -10.424 -12.236
   10   HD23  LEU  74          HD22      LEU  74   9.067 -10.269 -12.445
   11   HD22  LEU  74          HD23      LEU  74   8.084  -8.829 -12.304

  No H/Q in entry =          11
  In of MODEL   15
    1    H    VAL  75           H        VAL  75   5.614 -10.924  -8.500
    2    HA   VAL  75           HA       VAL  75   5.468  -8.169  -7.914
    3    HB   VAL  75           HB       VAL  75   3.420 -10.352  -7.526
    4   HG13  VAL  75          HG11      VAL  75   2.895  -8.460  -6.040
    5   HG12  VAL  75          HG12      VAL  75   1.812  -8.425  -7.424
    6   HG11  VAL  75          HG13      VAL  75   3.180  -7.324  -7.355
    7   HG21  VAL  75          HG21      VAL  75   4.157  -9.929  -9.853
    8   HG23  VAL  75          HG22      VAL  75   3.818  -8.212  -9.647
    9   HG22  VAL  75          HG23      VAL  75   2.499  -9.383  -9.611

  No H/Q in entry =           9
  In of MODEL   15
    1    H    GLU  76           H        GLU  76   5.272 -11.049  -5.803
    2    HA   GLU  76           HA       GLU  76   4.782  -9.695  -3.381
    3    HB2  GLU  76           HB2      GLU  76   4.648 -12.161  -3.603
    4    HB3  GLU  76           HB3      GLU  76   6.381 -12.235  -3.864
    5    HG2  GLU  76           HG2      GLU  76   5.972 -12.822  -1.560
    6    HG3  GLU  76           HG3      GLU  76   6.705 -11.228  -1.561

  No H/Q in entry =           6
  In of MODEL   15
    1    H    ALA  77           H        ALA  77   7.855 -10.547  -4.950
    2    HA   ALA  77           HA       ALA  77   9.529  -9.472  -2.938
    3    HB2  ALA  77           HB1      ALA  77  11.274  -9.461  -4.703
    4    HB3  ALA  77           HB2      ALA  77  10.033  -9.824  -5.902
    5    HB1  ALA  77           HB3      ALA  77  10.399 -10.991  -4.632

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLN  78           H        GLN  78   8.106  -8.082  -5.850
    2    HA   GLN  78           HA       GLN  78   9.414  -5.579  -5.749
    3    HB2  GLN  78           HB2      GLN  78   8.133  -6.515  -7.706
    4    HB3  GLN  78           HB3      GLN  78   6.644  -6.170  -6.827
    5    HG2  GLN  78           HG2      GLN  78   7.246  -3.785  -6.732
    6    HG3  GLN  78           HG3      GLN  78   8.739  -4.123  -7.605
    7   HE21  GLN  78          HE21      GLN  78   6.777  -2.341  -8.692
    8   HE22  GLN  78          HE22      GLN  78   6.102  -3.068 -10.070

  No H/Q in entry =           8
  In of MODEL   15
    1    H    LEU  79           H        LEU  79   6.418  -6.769  -4.314
    2    HA   LEU  79           HA       LEU  79   5.383  -4.379  -3.305
    3    HB2  LEU  79           HB2      LEU  79   4.105  -6.454  -3.246
    4    HB3  LEU  79           HB3      LEU  79   5.264  -7.172  -2.132
    5    HG   LEU  79           HG       LEU  79   4.685  -5.539  -0.405
    6   HD13  LEU  79          HD11      LEU  79   4.183  -3.534  -1.456
    7   HD12  LEU  79          HD12      LEU  79   2.568  -4.087  -1.014
    8   HD11  LEU  79          HD13      LEU  79   3.150  -4.301  -2.663
    9   HD23  LEU  79          HD21      LEU  79   2.108  -6.077  -0.311
   10   HD22  LEU  79          HD22      LEU  79   3.271  -7.396  -0.203
   11   HD21  LEU  79          HD23      LEU  79   2.450  -7.074  -1.727

  No H/Q in entry =          11
  In of MODEL   15
    1    H    HIS  80           H        HIS  80   7.608  -6.675  -1.723
    2    HA   HIS  80           HA       HIS  80   7.872  -5.127   0.645
    3    HB2  HIS  80           HB2      HIS  80   9.250  -7.467  -0.554
    4    HB3  HIS  80           HB3      HIS  80  10.146  -6.554   0.661
    5    HD1  HIS  80           HD1      HIS  80   9.669  -7.197   3.005
    6    HD2  HIS  80           HD2      HIS  80   6.465  -8.105   0.497
    7    HE1  HIS  80           HE1      HIS  80   7.918  -8.330   4.456
    8    HE2  HIS  80           HE2      HIS  80   5.959  -8.888   2.935

  No H/Q in entry =           8
  In of MODEL   15
    1    H    LEU  81           H        LEU  81   9.879  -5.370  -2.270
    2    HA   LEU  81           HA       LEU  81  11.893  -3.593  -1.394
    3    HB2  LEU  81           HB2      LEU  81  10.984  -4.403  -4.156
    4    HB3  LEU  81           HB3      LEU  81  12.386  -3.373  -3.868
    5    HG   LEU  81           HG       LEU  81  12.041  -6.099  -2.592
    6   HD12  LEU  81          HD11      LEU  81  13.866  -6.696  -4.343
    7   HD11  LEU  81          HD12      LEU  81  13.276  -5.282  -5.215
    8   HD13  LEU  81          HD13      LEU  81  12.187  -6.625  -4.875
    9   HD23  LEU  81          HD21      LEU  81  14.664  -5.739  -2.580
   10   HD22  LEU  81          HD22      LEU  81  13.670  -4.995  -1.330
   11   HD21  LEU  81          HD23      LEU  81  14.231  -4.034  -2.698

  No H/Q in entry =          11
  In of MODEL   15
    1    H    MET  82           H        MET  82   8.959  -3.007  -3.329
    2    HA   MET  82           HA       MET  82   9.452  -0.273  -3.832
    3    HB2  MET  82           HB2      MET  82   6.920  -1.910  -3.704
    4    HB3  MET  82           HB3      MET  82   6.890  -0.186  -4.069
    5    HG2  MET  82           HG2      MET  82   8.524  -2.233  -5.604
    6    HG3  MET  82           HG3      MET  82   6.946  -1.637  -6.116
    7    HE3  MET  82           HE1      MET  82   7.336   1.824  -7.290
    8    HE2  MET  82           HE2      MET  82   6.967   1.593  -5.583
    9    HE1  MET  82           HE3      MET  82   6.319   0.471  -6.776

  No H/Q in entry =           9
  In of MODEL   15
    1    H    THR  83           H        THR  83   7.689  -1.899  -1.224
    2    HA   THR  83           HA       THR  83   6.801   0.435   0.101
    3    HB   THR  83           HB       THR  83   6.694  -1.140   2.120
    4    HG1  THR  83           HG1      THR  83   7.483  -3.077   1.891
    5   HG22  THR  83          HG21      THR  83   5.065  -2.734   0.655
    6   HG21  THR  83          HG22      THR  83   5.269  -1.402  -0.478
    7   HG23  THR  83          HG23      THR  83   4.625  -1.097   1.135

  No H/Q in entry =           7
  In of MODEL   15
    1    H    SER  84           H        SER  84   9.659  -1.616   0.621
    2    HA   SER  84           HA       SER  84  10.696  -0.167   2.808
    3    HB2  SER  84           HB2      SER  84  11.978  -1.990   0.783
    4    HB3  SER  84           HB3      SER  84  12.913  -1.221   2.064
    5    HG   SER  84           HG       SER  84  10.666  -2.947   2.326

  No H/Q in entry =           5
  In of MODEL   15
    1    H    MET  85           H        MET  85  11.442   0.104  -0.681
    2    HA   MET  85           HA       MET  85  13.409   2.101  -0.432
    3    HB2  MET  85           HB2      MET  85  13.035   0.813  -2.497
    4    HB3  MET  85           HB3      MET  85  11.492   1.637  -2.725
    5    HG2  MET  85           HG2      MET  85  12.641   3.803  -2.865
    6    HG3  MET  85           HG3      MET  85  14.189   3.012  -2.578
    7    HE1  MET  85           HE1      MET  85  11.112   3.322  -4.523
    8    HE3  MET  85           HE2      MET  85  11.160   1.686  -5.173
    9    HE2  MET  85           HE3      MET  85  11.520   3.049  -6.224

  No H/Q in entry =           9
  In of MODEL   15
    1    H    LEU  86           H        LEU  86   9.914   2.380  -0.939
    2    HA   LEU  86           HA       LEU  86   9.805   5.192  -1.122
    3    HB2  LEU  86           HB2      LEU  86   7.987   3.503  -1.696
    4    HB3  LEU  86           HB3      LEU  86   7.660   3.409   0.034
    5    HG   LEU  86           HG       LEU  86   7.459   5.966  -0.020
    6   HD11  LEU  86          HD11      LEU  86   8.239   5.541  -2.722
    7   HD13  LEU  86          HD12      LEU  86   7.780   7.062  -1.962
    8   HD12  LEU  86          HD13      LEU  86   6.558   6.079  -2.765
    9   HD23  LEU  86          HD21      LEU  86   5.346   4.579  -1.680
   10   HD22  LEU  86          HD22      LEU  86   5.136   5.837  -0.464
   11   HD21  LEU  86          HD23      LEU  86   5.562   4.199   0.030

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ALA  87           H        ALA  87   9.376   3.008   1.625
    2    HA   ALA  87           HA       ALA  87   8.799   4.914   3.594
    3    HB1  ALA  87           HB1      ALA  87   9.650   2.107   3.509
    4    HB3  ALA  87           HB2      ALA  87   8.513   2.902   4.595
    5    HB2  ALA  87           HB3      ALA  87  10.242   2.960   4.937

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ARG  88           H        ARG  88  11.903   3.537   2.612
    2    HA   ARG  88           HA       ARG  88  13.493   4.941   4.442
    3    HB2  ARG  88           HB2      ARG  88  14.191   2.977   3.039
    4    HB3  ARG  88           HB3      ARG  88  14.325   4.072   1.665
    5    HG2  ARG  88           HG2      ARG  88  15.779   5.410   3.609
    6    HG3  ARG  88           HG3      ARG  88  16.126   3.726   3.989
    7    HD2  ARG  88           HD2      ARG  88  17.396   3.448   2.141
    8    HD3  ARG  88           HD3      ARG  88  16.245   4.301   1.109
    9    HE   ARG  88           HE       ARG  88  18.624   5.402   2.153
   10   HH21  ARG  88          HH11      ARG  88  18.934   7.626   1.957
   11   HH22  ARG  88          HH12      ARG  88  17.567   8.676   1.814
   12   HH11  ARG  88          HH21      ARG  88  15.273   6.103   1.878
   13   HH12  ARG  88          HH22      ARG  88  15.492   7.812   1.745

  No H/Q in entry =          13
  In of MODEL   15
    1    H    GLU  89           H        GLU  89  12.503   5.822   1.119
    2    HA   GLU  89           HA       GLU  89  14.012   8.206   0.960
    3    HB2  GLU  89           HB2      GLU  89  12.882   7.146  -0.987
    4    HB3  GLU  89           HB3      GLU  89  11.330   7.663  -0.327
    5    HG2  GLU  89           HG2      GLU  89  11.995  10.011  -0.492
    6    HG3  GLU  89           HG3      GLU  89  13.606   9.545  -1.030

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LEU  90           H        LEU  90  10.693   7.645   2.093
    2    HA   LEU  90           HA       LEU  90  10.136  10.370   2.667
    3    HB2  LEU  90           HB2      LEU  90   8.982   7.779   3.697
    4    HB3  LEU  90           HB3      LEU  90   8.327   9.365   4.120
    5    HG   LEU  90           HG       LEU  90   8.756   8.490   1.251
    6   HD12  LEU  90          HD11      LEU  90   6.228   8.122   1.316
    7   HD11  LEU  90          HD12      LEU  90   6.384   8.115   3.073
    8   HD13  LEU  90          HD13      LEU  90   7.221   6.897   2.108
    9   HD22  LEU  90          HD21      LEU  90   8.426  10.793   1.176
   10   HD21  LEU  90          HD22      LEU  90   7.441  10.811   2.638
   11   HD23  LEU  90          HD23      LEU  90   6.750  10.244   1.117

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  91           H        ILE  91  11.442   7.710   4.590
    2    HA   ILE  91           HA       ILE  91  11.564   9.078   7.057
    3    HB   ILE  91           HB       ILE  91  13.153   6.764   5.933
    4   HG12  ILE  91          HG12      ILE  91  11.137   6.901   8.195
    5   HG13  ILE  91          HG13      ILE  91  10.669   6.612   6.520
    6   HG22  ILE  91          HG21      ILE  91  13.629   6.559   8.573
    7   HG21  ILE  91          HG22      ILE  91  13.526   8.316   8.471
    8   HG23  ILE  91          HG23      ILE  91  14.717   7.446   7.506
    9   HD13  ILE  91          HD11      ILE  91  11.704   4.526   6.449
   10   HD12  ILE  91          HD12      ILE  91  11.112   4.576   8.110
   11   HD11  ILE  91          HD13      ILE  91  12.808   4.915   7.769

  No H/Q in entry =          11
  In of MODEL   15
    1    H    THR  92           H        THR  92  13.780   8.943   4.303
    2    HA   THR  92           HA       THR  92  15.925  10.370   5.459
    3    HB   THR  92           HB       THR  92  14.938  10.228   2.599
    4    HG1  THR  92           HG1      THR  92  15.799   8.344   3.004
    5   HG22  THR  92          HG21      THR  92  17.496  10.958   2.302
    6   HG21  THR  92          HG22      THR  92  17.177  11.775   3.832
    7   HG23  THR  92          HG23      THR  92  16.199  12.147   2.412

  No H/Q in entry =           7
  In of MODEL   15
    1    H    GLU  93           H        GLU  93  13.018  11.477   3.733
    2    HA   GLU  93           HA       GLU  93  13.570  14.247   3.845
    3    HB2  GLU  93           HB2      GLU  93  10.887  12.832   3.863
    4    HB3  GLU  93           HB3      GLU  93  11.148  14.536   3.490
    5    HG2  GLU  93           HG2      GLU  93  12.519  12.314   1.962
    6    HG3  GLU  93           HG3      GLU  93  10.961  12.972   1.476

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LEU  94           H        LEU  94  11.864  12.065   6.059
    2    HA   LEU  94           HA       LEU  94  11.026  13.999   7.935
    3    HB2  LEU  94           HB2      LEU  94  11.649  11.054   8.210
    4    HB3  LEU  94           HB3      LEU  94  11.064  12.021   9.561
    5    HG   LEU  94           HG       LEU  94   9.576  12.048   6.934
    6   HD11  LEU  94          HD11      LEU  94   9.696   9.830   8.939
    7   HD13  LEU  94          HD12      LEU  94   9.393   9.763   7.205
    8   HD12  LEU  94          HD13      LEU  94   8.108  10.260   8.304
    9   HD23  LEU  94          HD21      LEU  94   7.652  12.419   8.537
   10   HD22  LEU  94          HD22      LEU  94   8.871  13.692   8.571
   11   HD21  LEU  94          HD23      LEU  94   8.829  12.475   9.846

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  95           H        ILE  95  14.030  12.117   7.696
    2    HA   ILE  95           HA       ILE  95  15.186  13.058  10.107
    3    HB   ILE  95           HB       ILE  95  16.438  12.007   7.558
    4   HG12  ILE  95          HG12      ILE  95  16.165  10.803  10.327
    5   HG13  ILE  95          HG13      ILE  95  15.001  10.526   9.033
    6   HG21  ILE  95          HG21      ILE  95  17.684  12.835  10.198
    7   HG23  ILE  95          HG22      ILE  95  18.136  13.369   8.578
    8   HG22  ILE  95          HG23      ILE  95  18.469  11.715   9.087
    9   HD13  ILE  95          HD11      ILE  95  16.499   9.270   7.769
   10   HD12  ILE  95          HD12      ILE  95  16.981   8.830   9.404
   11   HD11  ILE  95          HD13      ILE  95  17.914  10.023   8.503

  No H/Q in entry =          11
  In of MODEL   15
    1    H    GLU  96           H        GLU  96  15.316  14.292   6.772
    2    HA   GLU  96           HA       GLU  96  17.131  16.399   7.245
    3    HB2  GLU  96           HB2      GLU  96  16.474  15.726   4.987
    4    HB3  GLU  96           HB3      GLU  96  14.823  16.257   5.290
    5    HG2  GLU  96           HG2      GLU  96  15.355  18.395   4.746
    6    HG3  GLU  96           HG3      GLU  96  16.655  18.416   5.926

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LEU  97           H        LEU  97  13.624  16.158   7.680
    2    HA   LEU  97           HA       LEU  97  13.166  18.885   8.321
    3    HB2  LEU  97           HB2      LEU  97  11.688  16.336   8.939
    4    HB3  LEU  97           HB3      LEU  97  11.152  17.875   9.610
    5    HG   LEU  97           HG       LEU  97  11.637  17.465   6.645
    6   HD12  LEU  97          HD11      LEU  97   9.116  17.298   6.531
    7   HD11  LEU  97          HD12      LEU  97   9.115  17.099   8.281
    8   HD13  LEU  97          HD13      LEU  97   9.913  15.904   7.258
    9   HD23  LEU  97          HD21      LEU  97   9.869  19.402   6.679
   10   HD22  LEU  97          HD22      LEU  97  11.545  19.788   7.069
   11   HD21  LEU  97          HD23      LEU  97  10.361  19.600   8.361

  No H/Q in entry =          11
  In of MODEL   15
    1    H    HIS  98           H        HIS  98  14.035  16.073  10.317
    2    HA   HIS  98           HA       HIS  98  13.861  17.333  12.832
    3    HB2  HIS  98           HB2      HIS  98  15.644  15.102  11.829
    4    HB3  HIS  98           HB3      HIS  98  15.637  15.641  13.510
    5    HD1  HIS  98           HD1      HIS  98  13.459  13.977  10.922
    6    HD2  HIS  98           HD2      HIS  98  13.344  14.897  14.986
    7    HE1  HIS  98           HE1      HIS  98  11.455  12.751  11.878
    8    HE2  HIS  98           HE2      HIS  98  11.365  13.303  14.349

  No H/Q in entry =           8
  In of MODEL   15
    1    H    GLU  99           H        GLU  99  16.412  17.256  10.394
    2    HA   GLU  99           HA       GLU  99  18.379  18.619  11.919
    3    HB2  GLU  99           HB2      GLU  99  18.875  17.338   9.849
    4    HB3  GLU  99           HB3      GLU  99  18.044  18.579   8.909
    5    HG2  GLU  99           HG2      GLU  99  19.628  20.275   9.697
    6    HG3  GLU  99           HG3      GLU  99  20.427  19.085  10.719

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LYS 100           H        LYS 100  15.834  19.741   9.706
    2    HA   LYS 100           HA       LYS 100  16.590  22.490   9.848
    3    HB2  LYS 100           HB2      LYS 100  13.976  21.161   9.098
    4    HB3  LYS 100           HB3      LYS 100  14.249  22.904   9.006
    5    HG2  LYS 100           HG2      LYS 100  16.225  22.485   7.536
    6    HG3  LYS 100           HG3      LYS 100  15.838  20.761   7.555
    7    HD2  LYS 100           HD2      LYS 100  13.634  21.237   6.559
    8    HD3  LYS 100           HD3      LYS 100  14.004  22.962   6.547
    9    HE2  LYS 100           HE2      LYS 100  15.968  22.511   5.084
   10    HE3  LYS 100           HE3      LYS 100  15.528  20.799   5.052
   11    HZ1  LYS 100           HZ1      LYS 100  13.669  22.964   4.220
   12    HZ3  LYS 100           HZ2      LYS 100  13.509  21.291   3.958
   13    HZ2  LYS 100           HZ3      LYS 100  14.706  22.171   3.135

  No H/Q in entry =          13
  In of MODEL   15
    1    H    LEU 101           H        LEU 101  14.527  20.414  11.817
    2    HA   LEU 101           HA       LEU 101  13.333  22.464  13.397
    3    HB2  LEU 101           HB2      LEU 101  13.820  19.522  13.781
    4    HB3  LEU 101           HB3      LEU 101  13.271  20.495  15.142
    5    HG   LEU 101           HG       LEU 101  11.848  20.561  12.476
    6   HD12  LEU 101          HD11      LEU 101  10.214  18.973  13.748
    7   HD11  LEU 101          HD12      LEU 101  11.616  18.581  14.741
    8   HD13  LEU 101          HD13      LEU 101  11.652  18.274  13.003
    9   HD21  LEU 101          HD21      LEU 101  11.184  21.345  15.329
   10   HD23  LEU 101          HD22      LEU 101   9.924  21.100  14.121
   11   HD22  LEU 101          HD23      LEU 101  11.140  22.353  13.880

  No H/Q in entry =          11
  In of MODEL   15
    1    H    LYS 102           H        LYS 102  16.488  21.904  12.955
    2    HA   LYS 102           HA       LYS 102  18.323  22.802  14.024
    3    HB2  LYS 102           HB2      LYS 102  16.489  24.290  15.160
    4    HB3  LYS 102           HB3      LYS 102  16.714  23.231  16.537
    5    HG2  LYS 102           HG2      LYS 102  18.575  25.270  15.364
    6    HG3  LYS 102           HG3      LYS 102  18.201  24.951  17.043
    7    HD2  LYS 102           HD2      LYS 102  19.893  23.062  15.355
    8    HD3  LYS 102           HD3      LYS 102  20.564  24.395  16.286
    9    HE2  LYS 102           HE2      LYS 102  20.206  21.841  17.257
   10    HE3  LYS 102           HE3      LYS 102  20.405  23.286  18.247
   11    HZ2  LYS 102           HZ1      LYS 102  18.456  21.973  18.869
   12    HZ1  LYS 102           HZ2      LYS 102  17.806  22.193  17.321
   13    HZ3  LYS 102           HZ3      LYS 102  18.019  23.527  18.346

  No H/Q in entry =          13
  In of MODEL   15
    1    H    ALA 103           H        ALA 103  16.280  21.167  16.450
    2    HA   ALA 103           HA       ALA 103  18.028  19.982  18.102
    3    HB2  ALA 103           HB1      ALA 103  16.473  17.952  18.100
    4    HB1  ALA 103           HB2      ALA 103  15.563  18.792  16.844
    5    HB3  ALA 103           HB3      ALA 103  15.733  19.515  18.442

  No H/Q in entry =           5
  In of MODEL   15
    1    H1   ALA   1           H3       ALA   1  -1.575  -7.173 -21.476
    2    H2   ALA   1           H2       ALA   1  -2.348  -8.619 -21.021
    3    H3   ALA   1           H1       ALA   1  -0.741  -8.646 -21.578
    4    HA   ALA   1           HA       ALA   1  -1.571  -9.128 -23.573
    5    HB1  ALA   1           HB1      ALA   1  -3.697  -9.876 -23.096
    6    HB2  ALA   1           HB2      ALA   1  -4.158  -8.372 -23.893
    7    HB3  ALA   1           HB3      ALA   1  -4.093  -8.451 -22.134

  No H/Q in entry =           7
  In of MODEL   15
    1    H    GLU   2           H        GLU   2  -2.421  -7.950 -25.562
    2    HA   GLU   2           HA       GLU   2  -1.052  -5.917 -26.442
    3    HB2  GLU   2           HB2      GLU   2  -4.059  -6.026 -26.755
    4    HB3  GLU   2           HB3      GLU   2  -2.952  -5.148 -27.806
    5    HG2  GLU   2           HG2      GLU   2  -2.424  -7.030 -28.961
    6    HG3  GLU   2           HG3      GLU   2  -2.111  -7.932 -27.484

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLU   3           H        GLU   3  -4.229  -4.704 -25.537
    2    HA   GLU   3           HA       GLU   3  -3.218  -2.134 -24.910
    3    HB2  GLU   3           HB2      GLU   3  -5.886  -3.486 -24.574
    4    HB3  GLU   3           HB3      GLU   3  -5.610  -1.867 -23.928
    5    HG2  GLU   3           HG2      GLU   3  -5.270  -0.935 -26.055
    6    HG3  GLU   3           HG3      GLU   3  -4.854  -2.485 -26.780

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LEU   4           H        LEU   4  -4.771  -4.515 -22.728
    2    HA   LEU   4           HA       LEU   4  -4.421  -3.281 -20.338
    3    HB2  LEU   4           HB2      LEU   4  -3.837  -6.215 -20.808
    4    HB3  LEU   4           HB3      LEU   4  -4.251  -5.474 -19.263
    5    HG   LEU   4           HG       LEU   4  -6.026  -5.573 -21.725
    6   HD13  LEU   4          HD11      LEU   4  -7.193  -7.307 -20.725
    7   HD12  LEU   4          HD12      LEU   4  -6.712  -6.840 -19.094
    8   HD11  LEU   4          HD13      LEU   4  -5.566  -7.668 -20.148
    9   HD23  LEU   4          HD21      LEU   4  -7.719  -4.785 -19.854
   10   HD22  LEU   4          HD22      LEU   4  -6.698  -3.600 -20.667
   11   HD21  LEU   4          HD23      LEU   4  -6.262  -4.184 -19.061

  No H/Q in entry =          11
  In of MODEL   15
    1    H    GLU   5           H        GLU   5  -1.899  -5.089 -22.072
    2    HA   GLU   5           HA       GLU   5   0.083  -4.777 -20.038
    3    HB2  GLU   5           HB2      GLU   5   0.174  -6.547 -21.786
    4    HB3  GLU   5           HB3      GLU   5   0.460  -5.300 -23.001
    5    HG2  GLU   5           HG2      GLU   5   2.522  -4.626 -21.863
    6    HG3  GLU   5           HG3      GLU   5   2.231  -5.812 -20.592

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLU   6           H        GLU   6  -0.581  -3.073 -23.082
    2    HA   GLU   6           HA       GLU   6   1.564  -1.211 -22.818
    3    HB2  GLU   6           HB2      GLU   6  -1.002  -1.144 -24.420
    4    HB3  GLU   6           HB3      GLU   6   0.251   0.092 -24.534
    5    HG2  GLU   6           HG2      GLU   6   1.887  -1.577 -25.233
    6    HG3  GLU   6           HG3      GLU   6   0.705  -2.865 -25.019

  No H/Q in entry =           6
  In of MODEL   15
    1    H    VAL   7           H        VAL   7  -1.772  -1.329 -21.768
    2    HA   VAL   7           HA       VAL   7  -2.030   1.380 -20.931
    3    HB   VAL   7           HB       VAL   7  -3.456  -1.158 -20.093
    4   HG11  VAL   7          HG11      VAL   7  -3.870   1.726 -19.278
    5   HG13  VAL   7          HG12      VAL   7  -3.749   0.302 -18.243
    6   HG12  VAL   7          HG13      VAL   7  -5.186   0.552 -19.233
    7   HG21  VAL   7          HG21      VAL   7  -3.631  -0.084 -22.481
    8   HG23  VAL   7          HG22      VAL   7  -4.593   1.151 -21.667
    9   HG22  VAL   7          HG23      VAL   7  -5.115  -0.533 -21.640

  No H/Q in entry =           9
  In of MODEL   15
    1    H    VAL   8           H        VAL   8  -0.998  -1.591 -19.289
    2    HA   VAL   8           HA       VAL   8  -0.691  -0.506 -16.694
    3    HB   VAL   8           HB       VAL   8   0.745  -2.802 -18.051
    4   HG11  VAL   8          HG11      VAL   8   0.720  -1.875 -15.166
    5   HG13  VAL   8          HG12      VAL   8   2.122  -2.043 -16.222
    6   HG12  VAL   8          HG13      VAL   8   1.260  -3.477 -15.667
    7   HG21  VAL   8          HG21      VAL   8  -1.917  -2.617 -17.337
    8   HG23  VAL   8          HG22      VAL   8  -1.206  -3.271 -15.865
    9   HG22  VAL   8          HG23      VAL   8  -1.019  -4.133 -17.388

  No H/Q in entry =           9
  In of MODEL   15
    1    H    MET   9           H        MET   9   1.557  -0.776 -19.445
    2    HA   MET   9           HA       MET   9   3.831   0.298 -18.188
    3    HB2  MET   9           HB2      MET   9   2.872   0.258 -21.042
    4    HB3  MET   9           HB3      MET   9   4.340   1.128 -20.598
    5    HG2  MET   9           HG2      MET   9   5.060  -1.053 -19.423
    6    HG3  MET   9           HG3      MET   9   3.766  -1.824 -20.340
    7    HE1  MET   9           HE1      MET   9   3.586  -2.205 -22.593
    8    HE3  MET   9           HE2      MET   9   4.698  -1.807 -23.900
    9    HE2  MET   9           HE3      MET   9   3.676  -0.551 -23.207

  No H/Q in entry =           9
  In of MODEL   15
    1    H    GLY  10           H        GLY  10   1.122   1.864 -19.861
    2    HA3  GLY  10           HA2      GLY  10   2.050   4.530 -19.618
    3    HA2  GLY  10           HA3      GLY  10   0.367   4.048 -19.820

  No H/Q in entry =           3
  In of MODEL   15
    1    H    LEU  11           H        LEU  11  -0.008   2.515 -17.533
    2    HA   LEU  11           HA       LEU  11  -0.561   4.485 -15.572
    3    HB2  LEU  11           HB2      LEU  11  -0.453   1.470 -15.416
    4    HB3  LEU  11           HB3      LEU  11  -0.973   2.487 -14.073
    5    HG   LEU  11           HG       LEU  11  -2.219   2.584 -16.834
    6   HD13  LEU  11          HD11      LEU  11  -2.773   0.433 -16.078
    7   HD12  LEU  11          HD12      LEU  11  -4.135   1.408 -15.529
    8   HD11  LEU  11          HD13      LEU  11  -2.871   0.944 -14.392
    9   HD22  LEU  11          HD21      LEU  11  -2.834   4.592 -15.826
   10   HD21  LEU  11          HD22      LEU  11  -2.747   3.927 -14.195
   11   HD23  LEU  11          HD23      LEU  11  -4.119   3.543 -15.234

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  12           H        ILE  12   2.014   2.052 -15.820
    2    HA   ILE  12           HA       ILE  12   3.217   2.605 -13.319
    3    HB   ILE  12           HB       ILE  12   4.478   1.580 -15.885
    4   HG12  ILE  12          HG12      ILE  12   2.488   0.318 -14.747
    5   HG13  ILE  12          HG13      ILE  12   3.907  -0.599 -15.209
    6   HG21  ILE  12          HG21      ILE  12   5.463   1.560 -13.014
    7   HG23  ILE  12          HG22      ILE  12   6.231   2.333 -14.400
    8   HG22  ILE  12          HG23      ILE  12   6.166   0.575 -14.295
    9   HD13  ILE  12          HD11      ILE  12   4.705  -0.566 -12.918
   10   HD12  ILE  12          HD12      ILE  12   3.036  -1.131 -12.925
   11   HD11  ILE  12          HD13      ILE  12   3.404   0.511 -12.445

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  13           H        ILE  13   3.795   3.876 -16.577
    2    HA   ILE  13           HA       ILE  13   5.912   5.623 -15.856
    3    HB   ILE  13           HB       ILE  13   3.875   5.679 -18.097
    4   HG12  ILE  13          HG12      ILE  13   5.697   3.846 -17.854
    5   HG13  ILE  13          HG13      ILE  13   5.509   4.636 -19.416
    6   HG22  ILE  13          HG21      ILE  13   5.471   7.310 -19.199
    7   HG21  ILE  13          HG22      ILE  13   6.266   7.497 -17.640
    8   HG23  ILE  13          HG23      ILE  13   4.579   7.972 -17.828
    9   HD11  ILE  13          HD11      ILE  13   7.425   5.935 -17.539
   10   HD13  ILE  13          HD12      ILE  13   7.537   5.683 -19.277
   11   HD12  ILE  13          HD13      ILE  13   7.901   4.362 -18.174

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ASN  14           H        ASN  14   2.398   6.073 -16.116
    2    HA   ASN  14           HA       ASN  14   2.322   8.818 -15.479
    3    HB2  ASN  14           HB2      ASN  14   0.448   7.152 -16.305
    4    HB3  ASN  14           HB3      ASN  14   0.133   6.970 -14.584
    5   HD21  ASN  14          HD21      ASN  14  -1.904   8.100 -16.012
    6   HD22  ASN  14          HD22      ASN  14  -1.988   9.772 -15.744

  No H/Q in entry =           6
  In of MODEL   15
    1    H    SER  15           H        SER  15   2.069   5.938 -13.402
    2    HA   SER  15           HA       SER  15   1.750   7.304 -10.953
    3    HB2  SER  15           HB2      SER  15   2.326   5.225  -9.905
    4    HB3  SER  15           HB3      SER  15   1.503   4.795 -11.399
    5    HG   SER  15           HG       SER  15   3.261   3.681 -11.724

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLY  16           H        GLY  16   4.636   6.245 -12.719
    2    HA3  GLY  16           HA2      GLY  16   6.555   7.026 -10.792
    3    HA2  GLY  16           HA3      GLY  16   6.857   6.828 -12.516

  No H/Q in entry =           3
  In of MODEL   15
    1    H    GLN  17           H        GLN  17   5.139   8.763 -13.575
    2    HA   GLN  17           HA       GLN  17   6.685  11.126 -13.271
    3    HB2  GLN  17           HB2      GLN  17   5.356  10.615 -15.307
    4    HB3  GLN  17           HB3      GLN  17   3.874  10.843 -14.377
    5    HG2  GLN  17           HG2      GLN  17   4.562  13.171 -13.875
    6    HG3  GLN  17           HG3      GLN  17   6.007  12.942 -14.859
    7   HE21  GLN  17          HE21      GLN  17   5.587  14.208 -16.704
    8   HE22  GLN  17          HE22      GLN  17   4.192  14.059 -17.659

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ALA  18           H        ALA  18   3.602  10.065 -11.915
    2    HA   ALA  18           HA       ALA  18   2.847  12.444 -10.647
    3    HB1  ALA  18           HB1      ALA  18   1.752   9.972 -10.867
    4    HB2  ALA  18           HB2      ALA  18   1.189  11.184  -9.718
    5    HB3  ALA  18           HB3      ALA  18   2.298   9.917  -9.191

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ARG  19           H        ARG  19   4.763   9.707  -9.372
    2    HA   ARG  19           HA       ARG  19   5.284  10.873  -6.851
    3    HB2  ARG  19           HB2      ARG  19   5.731   8.476  -7.379
    4    HB3  ARG  19           HB3      ARG  19   7.078   8.981  -8.404
    5    HG2  ARG  19           HG2      ARG  19   8.187  10.037  -6.484
    6    HG3  ARG  19           HG3      ARG  19   6.819   9.629  -5.449
    7    HD2  ARG  19           HD2      ARG  19   8.605   8.019  -5.095
    8    HD3  ARG  19           HD3      ARG  19   7.241   7.218  -5.878
    9    HE   ARG  19           HE       ARG  19   8.929   8.061  -7.929
   10   HH21  ARG  19          HH11      ARG  19  10.507   6.678  -8.783
   11   HH22  ARG  19          HH12      ARG  19  11.074   5.338  -7.849
   12   HH11  ARG  19          HH21      ARG  19   9.036   6.032  -5.151
   13   HH12  ARG  19          HH22      ARG  19  10.238   4.972  -5.791

  No H/Q in entry =          13
  In of MODEL   15
    1    H    SER  20           H        SER  20   7.094  10.929  -9.904
    2    HA   SER  20           HA       SER  20   9.320  12.377  -9.085
    3    HB2  SER  20           HB2      SER  20   9.104  11.383 -11.333
    4    HB3  SER  20           HB3      SER  20   7.880  12.580 -11.740
    5    HG   SER  20           HG       SER  20  10.249  13.566 -10.707

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU  21           H        LEU  21   6.200  13.600 -10.275
    2    HA   LEU  21           HA       LEU  21   6.830  16.355 -10.053
    3    HB2  LEU  21           HB2      LEU  21   4.182  14.893  -9.964
    4    HB3  LEU  21           HB3      LEU  21   4.325  16.649  -9.974
    5    HG   LEU  21           HG       LEU  21   5.547  14.869 -12.103
    6   HD11  LEU  21          HD11      LEU  21   2.836  16.184 -11.913
    7   HD13  LEU  21          HD12      LEU  21   3.223  14.520 -12.353
    8   HD12  LEU  21          HD13      LEU  21   3.577  15.833 -13.475
    9   HD22  LEU  21          HD21      LEU  21   6.645  16.917 -12.314
   10   HD21  LEU  21          HD22      LEU  21   5.284  17.845 -11.690
   11   HD23  LEU  21          HD23      LEU  21   5.241  17.222 -13.332

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ALA  22           H        ALA  22   5.357  14.043  -7.801
    2    HA   ALA  22           HA       ALA  22   4.731  15.841  -5.733
    3    HB3  ALA  22           HB1      ALA  22   4.007  13.437  -5.894
    4    HB2  ALA  22           HB2      ALA  22   4.591  13.918  -4.301
    5    HB1  ALA  22           HB3      ALA  22   5.627  12.976  -5.374

  No H/Q in entry =           5
  In of MODEL   15
    1    H    TYR  23           H        TYR  23   7.695  13.862  -6.178
    2    HA   TYR  23           HA       TYR  23   9.067  14.903  -3.928
    3    HB2  TYR  23           HB2      TYR  23   9.884  12.908  -5.087
    4    HB3  TYR  23           HB3      TYR  23  10.177  13.850  -6.548
    5    HD1  TYR  23           HD1      TYR  23  11.155  13.540  -2.957
    6    HD2  TYR  23           HD2      TYR  23  12.195  15.045  -6.845
    7    HE1  TYR  23           HE1      TYR  23  13.406  14.156  -2.117
    8    HE2  TYR  23           HE2      TYR  23  14.446  15.661  -6.004
    9    HH   TYR  23           HH       TYR  23  15.962  14.694  -3.936

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ALA  24           H        ALA  24   8.859  16.006  -7.294
    2    HA   ALA  24           HA       ALA  24  10.721  18.122  -7.052
    3    HB2  ALA  24           HB1      ALA  24  10.273  18.177  -9.260
    4    HB3  ALA  24           HB2      ALA  24   8.706  18.901  -8.897
    5    HB1  ALA  24           HB3      ALA  24   8.860  17.150  -9.027

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA  25           H        ALA  25   7.247  17.880  -6.423
    2    HA   ALA  25           HA       ALA  25   6.723  20.590  -5.853
    3    HB1  ALA  25           HB1      ALA  25   5.095  18.564  -6.050
    4    HB2  ALA  25           HB2      ALA  25   4.709  19.846  -4.901
    5    HB3  ALA  25           HB3      ALA  25   5.425  18.337  -4.332

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU  26           H        LEU  26   7.841  17.929  -3.806
    2    HA   LEU  26           HA       LEU  26   7.928  19.362  -1.369
    3    HB2  LEU  26           HB2      LEU  26   8.064  16.947  -1.363
    4    HB3  LEU  26           HB3      LEU  26   9.532  16.980  -2.337
    5    HG   LEU  26           HG       LEU  26  10.731  18.119  -0.500
    6   HD12  LEU  26          HD11      LEU  26   9.510  18.106   1.762
    7   HD11  LEU  26          HD12      LEU  26   8.023  17.943   0.831
    8   HD13  LEU  26          HD13      LEU  26   9.043  19.366   0.620
    9   HD21  LEU  26          HD21      LEU  26   9.242  15.625   0.377
   10   HD23  LEU  26          HD22      LEU  26  10.750  16.214   1.070
   11   HD22  LEU  26          HD23      LEU  26  10.710  15.654  -0.599

  No H/Q in entry =          11
  In of MODEL   15
    1    H    LYS  27           H        LYS  27  10.348  18.831  -3.899
    2    HA   LYS  27           HA       LYS  27  12.513  20.110  -2.676
    3    HB2  LYS  27           HB2      LYS  27  12.633  18.764  -4.766
    4    HB3  LYS  27           HB3      LYS  27  11.843  20.083  -5.630
    5    HG2  LYS  27           HG2      LYS  27  13.683  21.601  -5.057
    6    HG3  LYS  27           HG3      LYS  27  14.468  20.322  -4.122
    7    HD2  LYS  27           HD2      LYS  27  14.631  18.937  -6.176
    8    HD3  LYS  27           HD3      LYS  27  13.891  20.242  -7.103
    9    HE2  LYS  27           HE2      LYS  27  15.753  21.742  -6.495
   10    HE3  LYS  27           HE3      LYS  27  16.498  20.441  -5.559
   11    HZ3  LYS  27           HZ1      LYS  27  17.481  20.558  -7.748
   12    HZ2  LYS  27           HZ2      LYS  27  15.955  20.412  -8.485
   13    HZ1  LYS  27           HZ3      LYS  27  16.603  19.113  -7.602

  No H/Q in entry =          13
  In of MODEL   15
    1    H    GLN  28           H        GLN  28   9.862  21.444  -4.619
    2    HA   GLN  28           HA       GLN  28  10.773  24.114  -4.775
    3    HB2  GLN  28           HB2      GLN  28   7.959  22.994  -4.655
    4    HB3  GLN  28           HB3      GLN  28   8.342  24.673  -5.034
    5    HG2  GLN  28           HG2      GLN  28   9.372  22.273  -6.576
    6    HG3  GLN  28           HG3      GLN  28   8.023  23.289  -7.081
    7   HE21  GLN  28          HE21      GLN  28  11.180  22.838  -7.794
    8   HE22  GLN  28          HE22      GLN  28  11.639  24.428  -8.175

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ALA  29           H        ALA  29   8.878  22.387  -2.334
    2    HA   ALA  29           HA       ALA  29   8.293  24.570  -0.651
    3    HB2  ALA  29           HB1      ALA  29   7.596  22.988   0.919
    4    HB1  ALA  29           HB2      ALA  29   8.838  21.827   0.451
    5    HB3  ALA  29           HB3      ALA  29   7.444  22.095  -0.594

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LYS  30           H        LYS  30  11.064  22.352  -0.727
    2    HA   LYS  30           HA       LYS  30  12.369  23.331   1.573
    3    HB2  LYS  30           HB2      LYS  30  13.483  22.065  -0.940
    4    HB3  LYS  30           HB3      LYS  30  14.462  22.442   0.479
    5    HG2  LYS  30           HG2      LYS  30  12.938  21.031   1.863
    6    HG3  LYS  30           HG3      LYS  30  12.057  20.593   0.395
    7    HD2  LYS  30           HD2      LYS  30  14.117  19.644  -0.571
    8    HD3  LYS  30           HD3      LYS  30  15.017  20.097   0.879
    9    HE2  LYS  30           HE2      LYS  30  13.542  18.638   2.237
   10    HE3  LYS  30           HE3      LYS  30  12.673  18.166   0.772
   11    HZ2  LYS  30           HZ1      LYS  30  14.495  16.622   1.529
   12    HZ1  LYS  30           HZ2      LYS  30  15.609  17.829   1.074
   13    HZ3  LYS  30           HZ3      LYS  30  14.583  17.126  -0.088

  No H/Q in entry =          13
  In of MODEL   15
    1    H    GLN  31           H        GLN  31  12.230  24.533  -1.724
    2    HA   GLN  31           HA       GLN  31  14.349  26.465  -1.308
    3    HB2  GLN  31           HB2      GLN  31  12.300  26.474  -3.528
    4    HB3  GLN  31           HB3      GLN  31  13.907  27.199  -3.533
    5    HG2  GLN  31           HG2      GLN  31  14.420  24.512  -2.958
    6    HG3  GLN  31           HG3      GLN  31  13.114  24.434  -4.133
    7   HE21  GLN  31          HE21      GLN  31  15.971  23.693  -4.544
    8   HE22  GLN  31          HE22      GLN  31  16.522  24.676  -5.812

  No H/Q in entry =           8
  In of MODEL   15
    1    H    GLY  32           H        GLY  32  11.281  26.227  -0.155
    2    HA3  GLY  32           HA2      GLY  32  10.099  27.774   1.120
    3    HA2  GLY  32           HA3      GLY  32  11.201  29.029   0.567

  No H/Q in entry =           3
  In of MODEL   15
    1    H    ASP  33           H        ASP  33   9.865  27.100  -1.921
    2    HA   ASP  33           HA       ASP  33   8.157  29.341  -2.773
    3    HB2  ASP  33           HB2      ASP  33   9.291  26.942  -4.218
    4    HB3  ASP  33           HB3      ASP  33   8.118  28.036  -4.945

  No H/Q in entry =           4
  In of MODEL   15
    1    H    PHE  34           H        PHE  34   6.482  28.835  -1.205
    2    HA   PHE  34           HA       PHE  34   5.148  26.338  -1.106
    3    HB2  PHE  34           HB2      PHE  34   4.138  29.107  -0.424
    4    HB3  PHE  34           HB3      PHE  34   3.318  27.601  -0.010
    5    HD1  PHE  34           HD1      PHE  34   5.526  30.041   1.198
    6    HD2  PHE  34           HD2      PHE  34   4.924  25.788   1.147
    7    HE1  PHE  34           HE1      PHE  34   6.926  29.817   3.231
    8    HE2  PHE  34           HE2      PHE  34   6.326  25.568   3.178
    9    HZ   PHE  34           HZ       PHE  34   7.321  27.583   4.220

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ALA  35           H        ALA  35   4.660  29.193  -3.116
    2    HA   ALA  35           HA       ALA  35   2.118  28.531  -4.135
    3    HB3  ALA  35           HB1      ALA  35   3.139  29.942  -6.175
    4    HB2  ALA  35           HB2      ALA  35   4.353  30.326  -4.955
    5    HB1  ALA  35           HB3      ALA  35   2.656  30.704  -4.660

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA  36           H        ALA  36   5.355  27.917  -5.497
    2    HA   ALA  36           HA       ALA  36   4.387  26.470  -7.737
    3    HB3  ALA  36           HB1      ALA  36   6.542  26.634  -8.359
    4    HB2  ALA  36           HB2      ALA  36   7.046  25.614  -7.009
    5    HB1  ALA  36           HB3      ALA  36   6.908  27.360  -6.794

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA  37           H        ALA  37   5.370  25.494  -4.485
    2    HA   ALA  37           HA       ALA  37   5.362  22.705  -4.913
    3    HB2  ALA  37           HB1      ALA  37   5.073  24.492  -2.535
    4    HB1  ALA  37           HB2      ALA  37   6.230  23.195  -2.829
    5    HB3  ALA  37           HB3      ALA  37   4.577  22.811  -2.354

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LYS  38           H        LYS  38   2.791  24.866  -3.739
    2    HA   LYS  38           HA       LYS  38   0.727  23.014  -3.511
    3    HB2  LYS  38           HB2      LYS  38   1.027  25.776  -3.261
    4    HB3  LYS  38           HB3      LYS  38  -0.172  25.606  -4.537
    5    HG2  LYS  38           HG2      LYS  38  -1.593  24.257  -3.091
    6    HG3  LYS  38           HG3      LYS  38  -0.345  24.220  -1.838
    7    HD2  LYS  38           HD2      LYS  38  -0.573  26.553  -1.390
    8    HD3  LYS  38           HD3      LYS  38  -1.494  26.824  -2.870
    9    HE2  LYS  38           HE2      LYS  38  -2.993  26.831  -0.927
   10    HE3  LYS  38           HE3      LYS  38  -3.344  25.448  -1.968
   11    HZ3  LYS  38           HZ1      LYS  38  -2.587  23.991  -0.436
   12    HZ2  LYS  38           HZ2      LYS  38  -2.959  25.242   0.654
   13    HZ1  LYS  38           HZ3      LYS  38  -1.361  25.021   0.124

  No H/Q in entry =          13
  In of MODEL   15
    1    H    ALA  39           H        ALA  39   1.663  24.934  -6.363
    2    HA   ALA  39           HA       ALA  39  -0.400  24.027  -8.060
    3    HB2  ALA  39           HB1      ALA  39   2.321  24.726  -9.121
    4    HB1  ALA  39           HB2      ALA  39   1.333  25.969  -8.353
    5    HB3  ALA  39           HB3      ALA  39   0.733  25.120  -9.778

  No H/Q in entry =           5
  In of MODEL   15
    1    H    MET  40           H        MET  40   2.863  22.789  -7.488
    2    HA   MET  40           HA       MET  40   2.798  20.767  -9.479
    3    HB2  MET  40           HB2      MET  40   4.412  21.022  -6.935
    4    HB3  MET  40           HB3      MET  40   4.683  19.770  -8.149
    5    HG2  MET  40           HG2      MET  40   4.683  22.727  -8.816
    6    HG3  MET  40           HG3      MET  40   6.147  21.851  -8.370
    7    HE3  MET  40           HE1      MET  40   7.054  19.652 -11.180
    8    HE2  MET  40           HE2      MET  40   6.500  19.323  -9.541
    9    HE1  MET  40           HE3      MET  40   7.570  20.690  -9.844

  No H/Q in entry =           9
  In of MODEL   15
    1    H    MET  41           H        MET  41   1.891  20.793  -6.053
    2    HA   MET  41           HA       MET  41   1.412  18.019  -5.773
    3    HB2  MET  41           HB2      MET  41   0.038  20.351  -4.419
    4    HB3  MET  41           HB3      MET  41  -0.085  18.671  -3.911
    5    HG2  MET  41           HG2      MET  41   2.621  18.945  -3.955
    6    HG3  MET  41           HG3      MET  41   2.150  20.595  -3.558
    7    HE2  MET  41           HE1      MET  41  -0.861  19.285  -1.825
    8    HE1  MET  41           HE2      MET  41  -0.074  20.813  -2.205
    9    HE3  MET  41           HE3      MET  41  -0.118  20.242  -0.536

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ASP  42           H        ASP  42  -0.680  20.704  -6.743
    2    HA   ASP  42           HA       ASP  42  -3.095  19.297  -6.873
    3    HB2  ASP  42           HB2      ASP  42  -2.438  21.880  -7.132
    4    HB3  ASP  42           HB3      ASP  42  -2.586  21.482  -8.840

  No H/Q in entry =           4
  In of MODEL   15
    1    H    GLN  43           H        GLN  43  -0.672  19.934  -9.381
    2    HA   GLN  43           HA       GLN  43  -2.039  18.588 -11.467
    3    HB2  GLN  43           HB2      GLN  43   0.910  19.161 -11.092
    4    HB3  GLN  43           HB3      GLN  43   0.205  18.507 -12.573
    5    HG2  GLN  43           HG2      GLN  43  -1.346  20.504 -12.611
    6    HG3  GLN  43           HG3      GLN  43  -0.402  21.179 -11.286
    7   HE21  GLN  43          HE21      GLN  43  -0.277  22.802 -13.373
    8   HE22  GLN  43          HE22      GLN  43   1.140  22.607 -14.283

  No H/Q in entry =           8
  In of MODEL   15
    1    H    SER  44           H        SER  44   0.339  17.493  -9.082
    2    HA   SER  44           HA       SER  44   0.721  14.893 -10.107
    3    HB2  SER  44           HB2      SER  44   1.594  16.350  -7.873
    4    HB3  SER  44           HB3      SER  44   0.760  14.950  -7.200
    5    HG   SER  44           HG       SER  44   2.881  14.371  -7.632

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ARG  45           H        ARG  45  -1.618  16.167  -7.764
    2    HA   ARG  45           HA       ARG  45  -2.956  13.780  -7.125
    3    HB2  ARG  45           HB2      ARG  45  -3.194  15.944  -5.933
    4    HB3  ARG  45           HB3      ARG  45  -4.066  16.594  -7.318
    5    HG2  ARG  45           HG2      ARG  45  -5.798  14.834  -7.030
    6    HG3  ARG  45           HG3      ARG  45  -4.938  14.239  -5.609
    7    HD2  ARG  45           HD2      ARG  45  -5.186  16.502  -4.553
    8    HD3  ARG  45           HD3      ARG  45  -6.187  17.002  -5.933
    9    HE   ARG  45           HE       ARG  45  -7.247  14.605  -4.890
   10   HH21  ARG  45          HH11      ARG  45  -9.081  14.645  -3.614
   11   HH22  ARG  45          HH12      ARG  45  -9.502  16.076  -2.745
   12   HH11  ARG  45          HH21      ARG  45  -6.763  17.862  -3.868
   13   HH12  ARG  45          HH22      ARG  45  -8.185  17.899  -2.886

  No H/Q in entry =          13
  In of MODEL   15
    1    H    MET  46           H        MET  46  -3.594  16.172  -9.674
    2    HA   MET  46           HA       MET  46  -5.912  14.953 -10.730
    3    HB2  MET  46           HB2      MET  46  -3.848  16.813 -11.921
    4    HB3  MET  46           HB3      MET  46  -5.235  16.240 -12.852
    5    HG2  MET  46           HG2      MET  46  -6.764  17.138 -11.148
    6    HG3  MET  46           HG3      MET  46  -5.394  17.690 -10.191
    7    HE2  MET  46           HE1      MET  46  -5.799  20.422 -10.195
    8    HE1  MET  46           HE2      MET  46  -7.323  19.585 -10.470
    9    HE3  MET  46           HE3      MET  46  -6.910  20.992 -11.449

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ALA  47           H        ALA  47  -2.476  14.542 -11.496
    2    HA   ALA  47           HA       ALA  47  -2.792  12.807 -13.705
    3    HB3  ALA  47           HB1      ALA  47  -0.632  13.740 -13.359
    4    HB2  ALA  47           HB2      ALA  47  -0.456  12.015 -13.025
    5    HB1  ALA  47           HB3      ALA  47  -0.568  13.165 -11.692

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU  48           H        LEU  48  -2.502  12.178 -10.232
    2    HA   LEU  48           HA       LEU  48  -2.540   9.337 -10.389
    3    HB2  LEU  48           HB2      LEU  48  -3.337  11.240  -8.174
    4    HB3  LEU  48           HB3      LEU  48  -3.207   9.492  -7.973
    5    HG   LEU  48           HG       LEU  48  -0.945  11.236  -8.977
    6   HD13  LEU  48          HD11      LEU  48  -1.238  12.001  -6.785
    7   HD12  LEU  48          HD12      LEU  48  -0.049  10.718  -6.589
    8   HD11  LEU  48          HD13      LEU  48  -1.740  10.421  -6.188
    9   HD22  LEU  48          HD21      LEU  48  -0.404   9.061  -9.618
   10   HD21  LEU  48          HD22      LEU  48  -1.256   8.329  -8.260
   11   HD23  LEU  48          HD23      LEU  48   0.302   9.114  -8.003

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ASN  49           H        ASN  49  -5.052  11.779  -9.983
    2    HA   ASN  49           HA       ASN  49  -7.202  10.071  -9.438
    3    HB2  ASN  49           HB2      ASN  49  -7.295  12.498  -9.120
    4    HB3  ASN  49           HB3      ASN  49  -7.166  12.752 -10.856
    5   HD21  ASN  49          HD21      ASN  49  -9.259  13.822 -10.916
    6   HD22  ASN  49          HD22      ASN  49 -10.700  12.945 -10.745

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLU  50           H        GLU  50  -5.954  11.292 -12.528
    2    HA   GLU  50           HA       GLU  50  -7.886   9.998 -14.170
    3    HB2  GLU  50           HB2      GLU  50  -6.459  11.845 -14.988
    4    HB3  GLU  50           HB3      GLU  50  -5.044  10.802 -14.852
    5    HG2  GLU  50           HG2      GLU  50  -5.990   9.246 -16.486
    6    HG3  GLU  50           HG3      GLU  50  -7.470  10.195 -16.571

  No H/Q in entry =           6
  In of MODEL   15
    1    H    ALA  51           H        ALA  51  -4.694   9.070 -12.971
    2    HA   ALA  51           HA       ALA  51  -4.508   6.620 -14.388
    3    HB2  ALA  51           HB1      ALA  51  -2.520   6.372 -13.292
    4    HB1  ALA  51           HB2      ALA  51  -3.212   6.781 -11.724
    5    HB3  ALA  51           HB3      ALA  51  -2.785   8.060 -12.859

  No H/Q in entry =           5
  In of MODEL   15
    1    H    HIS  52           H        HIS  52  -5.690   7.429 -11.137
    2    HA   HIS  52           HA       HIS  52  -6.322   4.806 -10.303
    3    HB2  HIS  52           HB2      HIS  52  -6.222   6.726  -8.767
    4    HB3  HIS  52           HB3      HIS  52  -7.645   7.420  -9.542
    5    HD1  HIS  52           HD1      HIS  52  -9.879   5.888  -9.406
    6    HD2  HIS  52           HD2      HIS  52  -6.804   4.869  -6.783
    7    HE1  HIS  52           HE1      HIS  52 -10.914   4.414  -7.627
    8    HE2  HIS  52           HE2      HIS  52  -9.053   3.784  -6.019

  No H/Q in entry =           8
  In of MODEL   15
    1    H    LEU  53           H        LEU  53  -8.194   7.227 -12.088
    2    HA   LEU  53           HA       LEU  53 -10.674   5.885 -12.095
    3    HB2  LEU  53           HB2      LEU  53  -9.433   7.890 -13.968
    4    HB3  LEU  53           HB3      LEU  53 -11.019   7.193 -14.287
    5    HG   LEU  53           HG       LEU  53 -10.334   8.511 -11.641
    6   HD11  LEU  53          HD11      LEU  53 -11.548   9.726 -14.139
    7   HD13  LEU  53          HD12      LEU  53 -10.037  10.198 -13.361
    8   HD12  LEU  53          HD13      LEU  53 -11.576  10.491 -12.556
    9   HD21  LEU  53          HD21      LEU  53 -12.881   7.633 -13.017
   10   HD23  LEU  53          HD22      LEU  53 -12.908   8.873 -11.769
   11   HD22  LEU  53          HD23      LEU  53 -12.348   7.257 -11.383

  No H/Q in entry =          11
  In of MODEL   15
    1    H    VAL  54           H        VAL  54  -7.924   5.741 -14.338
    2    HA   VAL  54           HA       VAL  54  -9.116   3.946 -16.178
    3    HB   VAL  54           HB       VAL  54  -6.217   4.510 -15.502
    4   HG12  VAL  54          HG11      VAL  54  -5.954   3.429 -17.891
    5   HG11  VAL  54          HG12      VAL  54  -7.466   2.618 -17.484
    6   HG13  VAL  54          HG13      VAL  54  -6.044   2.392 -16.468
    7   HG22  VAL  54          HG21      VAL  54  -7.027   6.437 -16.545
    8   HG21  VAL  54          HG22      VAL  54  -8.205   5.550 -17.511
    9   HG23  VAL  54          HG23      VAL  54  -6.498   5.503 -17.945

  No H/Q in entry =           9
  In of MODEL   15
    1    H    GLN  55           H        GLN  55  -7.101   3.440 -13.282
    2    HA   GLN  55           HA       GLN  55  -6.957   0.625 -13.538
    3    HB2  GLN  55           HB2      GLN  55  -5.417   1.552 -12.022
    4    HB3  GLN  55           HB3      GLN  55  -6.650   2.495 -11.190
    5    HG2  GLN  55           HG2      GLN  55  -7.302   0.725  -9.871
    6    HG3  GLN  55           HG3      GLN  55  -7.057  -0.458 -11.149
    7   HE21  GLN  55          HE21      GLN  55  -5.405  -1.876 -10.658
    8   HE22  GLN  55          HE22      GLN  55  -4.025  -1.498  -9.748

  No H/Q in entry =           8
  In of MODEL   15
    1    H    THR  56           H        THR  56  -9.327   2.743 -11.920
    2    HA   THR  56           HA       THR  56 -10.872   0.830 -10.627
    3    HB   THR  56           HB       THR  56 -12.009   3.200 -12.131
    4    HG1  THR  56           HG1      THR  56 -10.104   3.343 -10.476
    5   HG23  THR  56          HG21      THR  56 -13.828   3.050 -10.684
    6   HG22  THR  56          HG22      THR  56 -12.912   2.166  -9.463
    7   HG21  THR  56          HG23      THR  56 -13.437   1.349 -10.935

  No H/Q in entry =           7
  In of MODEL   15
    1    H    LYS  57           H        LYS  57 -11.101   1.908 -14.013
    2    HA   LYS  57           HA       LYS  57 -13.226   0.180 -14.762
    3    HB2  LYS  57           HB2      LYS  57 -12.384   2.149 -16.079
    4    HB3  LYS  57           HB3      LYS  57 -10.933   1.229 -16.454
    5    HG2  LYS  57           HG2      LYS  57 -12.255  -0.454 -17.626
    6    HG3  LYS  57           HG3      LYS  57 -13.746   0.367 -17.184
    7    HD2  LYS  57           HD2      LYS  57 -13.023   2.358 -18.473
    8    HD3  LYS  57           HD3      LYS  57 -11.549   1.514 -18.941
    9    HE2  LYS  57           HE2      LYS  57 -14.348   0.498 -19.549
   10    HE3  LYS  57           HE3      LYS  57 -13.368   1.408 -20.697
   11    HZ3  LYS  57           HZ1      LYS  57 -12.926  -0.784 -21.217
   12    HZ2  LYS  57           HZ2      LYS  57 -12.899  -1.283 -19.592
   13    HZ1  LYS  57           HZ3      LYS  57 -11.613  -0.370 -20.226

  No H/Q in entry =          13
  In of MODEL   15
    1    H    LEU  58           H        LEU  58  -9.714  -0.184 -14.711
    2    HA   LEU  58           HA       LEU  58  -9.676  -2.702 -15.998
    3    HB2  LEU  58           HB2      LEU  58  -7.664  -1.370 -14.194
    4    HB3  LEU  58           HB3      LEU  58  -7.375  -2.887 -15.048
    5    HG   LEU  58           HG       LEU  58  -8.181  -0.298 -16.411
    6   HD11  LEU  58          HD11      LEU  58  -5.510  -1.484 -15.724
    7   HD13  LEU  58          HD12      LEU  58  -6.037   0.197 -15.675
    8   HD12  LEU  58          HD13      LEU  58  -5.686  -0.568 -17.222
    9   HD22  LEU  58          HD21      LEU  58  -8.730  -1.872 -18.000
   10   HD21  LEU  58          HD22      LEU  58  -7.664  -3.099 -17.320
   11   HD23  LEU  58          HD23      LEU  58  -6.999  -1.813 -18.327

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  59           H        ILE  59 -10.509  -1.813 -12.746
    2    HA   ILE  59           HA       ILE  59 -10.103  -4.572 -11.797
    3    HB   ILE  59           HB       ILE  59  -9.694  -2.304 -10.399
    4   HG12  ILE  59          HG12      ILE  59 -11.048  -4.650  -9.054
    5   HG13  ILE  59          HG13      ILE  59  -9.414  -4.744  -9.663
    6   HG22  ILE  59          HG21      ILE  59 -12.436  -3.047  -9.432
    7   HG21  ILE  59          HG22      ILE  59 -12.257  -1.839 -10.683
    8   HG23  ILE  59          HG23      ILE  59 -11.519  -1.596  -9.102
    9   HD13  ILE  59          HD11      ILE  59  -9.311  -4.135  -7.332
   10   HD12  ILE  59          HD12      ILE  59 -10.443  -2.814  -7.587
   11   HD11  ILE  59          HD13      ILE  59  -8.824  -2.737  -8.285

  No H/Q in entry =          11
  In of MODEL   15
    1    H    GLU  60           H        GLU  60 -12.707  -2.307 -12.603
    2    HA   GLU  60           HA       GLU  60 -14.860  -3.865 -11.586
    3    HB2  GLU  60           HB2      GLU  60 -15.149  -1.510 -12.167
    4    HB3  GLU  60           HB3      GLU  60 -14.771  -1.853 -13.852
    5    HG2  GLU  60           HG2      GLU  60 -16.762  -3.330 -13.986
    6    HG3  GLU  60           HG3      GLU  60 -17.154  -2.931 -12.325

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLY  61           H        GLY  61 -13.192  -3.819 -14.703
    2    HA3  GLY  61           HA2      GLY  61 -14.863  -6.098 -15.589
    3    HA2  GLY  61           HA3      GLY  61 -14.041  -4.978 -16.669

  No H/Q in entry =           3
  In of MODEL   15
    1    H    ASP  62           H        ASP  62 -12.632  -6.394 -13.786
    2    HA   ASP  62           HA       ASP  62 -10.342  -7.304 -15.224
    3    HB2  ASP  62           HB2      ASP  62 -10.258  -6.491 -12.894
    4    HB3  ASP  62           HB3      ASP  62 -11.231  -7.866 -12.385

  No H/Q in entry =           4
  In of MODEL   15
    1    H    ALA  63           H        ALA  63 -12.228  -8.607 -16.619
    2    HA   ALA  63           HA       ALA  63 -13.053 -11.161 -15.677
    3    HB2  ALA  63           HB1      ALA  63 -13.059 -11.648 -18.243
    4    HB1  ALA  63           HB2      ALA  63 -12.613  -9.950 -18.410
    5    HB3  ALA  63           HB3      ALA  63 -14.136 -10.392 -17.635

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLY  64           H        GLY  64 -10.151 -10.011 -17.284
    2    HA3  GLY  64           HA2      GLY  64  -8.014 -10.911 -17.276
    3    HA2  GLY  64           HA3      GLY  64  -8.630 -12.308 -16.402

  No H/Q in entry =           3
  In of MODEL   15
    1    H    GLU  65           H        GLU  65  -6.983 -13.179 -18.134
    2    HA   GLU  65           HA       GLU  65  -7.812 -13.327 -20.832
    3    HB2  GLU  65           HB2      GLU  65  -5.944 -15.076 -19.234
    4    HB3  GLU  65           HB3      GLU  65  -6.180 -15.224 -20.976
    5    HG2  GLU  65           HG2      GLU  65  -5.462 -12.913 -21.305
    6    HG3  GLU  65           HG3      GLU  65  -5.305 -12.691 -19.563

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLY  66           H        GLY  66  -8.278 -15.471 -18.119
    2    HA3  GLY  66           HA2      GLY  66 -10.031 -17.227 -19.697
    3    HA2  GLY  66           HA3      GLY  66  -9.212 -17.683 -18.216

  No H/Q in entry =           3
  In of MODEL   15
    1    H    LYS  67           H        LYS  67 -11.689 -18.373 -18.225
    2    HA   LYS  67           HA       LYS  67 -13.848 -16.900 -17.802
    3    HB2  LYS  67           HB2      LYS  67 -14.430 -18.573 -15.909
    4    HB3  LYS  67           HB3      LYS  67 -14.119 -19.195 -17.535
    5    HG2  LYS  67           HG2      LYS  67 -11.803 -19.693 -16.948
    6    HG3  LYS  67           HG3      LYS  67 -12.024 -18.977 -15.353
    7    HD2  LYS  67           HD2      LYS  67 -13.748 -20.701 -14.849
    8    HD3  LYS  67           HD3      LYS  67 -13.428 -21.443 -16.419
    9    HE2  LYS  67           HE2      LYS  67 -11.375 -21.043 -14.219
   10    HE3  LYS  67           HE3      LYS  67 -12.153 -22.574 -14.622
   11    HZ1  LYS  67           HZ1      LYS  67 -11.183 -21.616 -17.000
   12    HZ3  LYS  67           HZ2      LYS  67 -10.523 -22.874 -16.070
   13    HZ2  LYS  67           HZ3      LYS  67  -9.951 -21.285 -15.883

  No H/Q in entry =          13
  In of MODEL   15
    1    H    MET  68           H        MET  68 -13.274 -17.967 -14.699
    2    HA   MET  68           HA       MET  68 -13.911 -15.552 -13.428
    3    HB2  MET  68           HB2      MET  68 -12.609 -18.046 -12.335
    4    HB3  MET  68           HB3      MET  68 -13.295 -16.752 -11.353
    5    HG2  MET  68           HG2      MET  68 -14.834 -18.350 -13.419
    6    HG3  MET  68           HG3      MET  68 -14.891 -18.634 -11.678
    7    HE2  MET  68           HE1      MET  68 -15.000 -15.624 -10.327
    8    HE1  MET  68           HE2      MET  68 -15.573 -17.260 -10.014
    9    HE3  MET  68           HE3      MET  68 -16.727 -15.930 -10.090

  No H/Q in entry =           9
  In of MODEL   15
    1    H    LYS  69           H        LYS  69 -10.699 -17.043 -13.942
    2    HA   LYS  69           HA       LYS  69  -9.089 -15.700 -12.269
    3    HB2  LYS  69           HB2      LYS  69  -8.332 -17.327 -13.952
    4    HB3  LYS  69           HB3      LYS  69  -8.477 -16.091 -15.202
    5    HG2  LYS  69           HG2      LYS  69  -6.816 -14.699 -14.083
    6    HG3  LYS  69           HG3      LYS  69  -6.738 -15.827 -12.731
    7    HD2  LYS  69           HD2      LYS  69  -5.891 -17.584 -14.246
    8    HD3  LYS  69           HD3      LYS  69  -5.954 -16.448 -15.594
    9    HE2  LYS  69           HE2      LYS  69  -3.676 -16.532 -14.710
   10    HE3  LYS  69           HE3      LYS  69  -4.382 -14.954 -14.368
   11    HZ2  LYS  69           HZ1      LYS  69  -3.318 -16.755 -12.553
   12    HZ1  LYS  69           HZ2      LYS  69  -4.995 -16.753 -12.284
   13    HZ3  LYS  69           HZ3      LYS  69  -4.118 -15.299 -12.213

  No H/Q in entry =          13
  In of MODEL   15
    1    H    VAL  70           H        VAL  70  -7.640 -13.861 -12.357
    2    HA   VAL  70           HA       VAL  70  -8.857 -11.494 -13.668
    3    HB   VAL  70           HB       VAL  70  -7.601 -10.295 -11.739
    4   HG11  VAL  70          HG11      VAL  70 -10.090 -10.566 -11.996
    5   HG13  VAL  70          HG12      VAL  70  -9.558 -10.512 -10.315
    6   HG12  VAL  70          HG13      VAL  70  -9.974 -12.055 -11.059
    7   HG21  VAL  70          HG21      VAL  70  -6.324 -12.358 -11.057
    8   HG23  VAL  70          HG22      VAL  70  -7.850 -13.080 -10.554
    9   HG22  VAL  70          HG23      VAL  70  -7.238 -11.648  -9.727

  No H/Q in entry =           9
  In of MODEL   15
    1    H    SER  71           H        SER  71  -7.368  -9.815 -14.303
    2    HA   SER  71           HA       SER  71  -5.089 -10.772 -15.729
    3    HB2  SER  71           HB2      SER  71  -6.473  -8.774 -16.386
    4    HB3  SER  71           HB3      SER  71  -5.774  -7.909 -15.020
    5    HG   SER  71           HG       SER  71  -4.728  -8.422 -17.457

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU  72           H        LEU  72  -3.094 -11.058 -15.046
    2    HA   LEU  72           HA       LEU  72  -2.374 -10.827 -12.336
    3    HB2  LEU  72           HB2      LEU  72  -0.718 -11.228 -14.822
    4    HB3  LEU  72           HB3      LEU  72  -0.050 -11.285 -13.193
    5    HG   LEU  72           HG       LEU  72  -2.375 -13.022 -14.084
    6   HD12  LEU  72          HD11      LEU  72   0.578 -13.713 -13.936
    7   HD11  LEU  72          HD12      LEU  72  -0.348 -13.513 -15.425
    8   HD13  LEU  72          HD13      LEU  72  -0.730 -14.834 -14.319
    9   HD22  LEU  72          HD21      LEU  72  -2.359 -13.026 -11.732
   10   HD21  LEU  72          HD22      LEU  72  -0.612 -12.880 -11.633
   11   HD23  LEU  72          HD23      LEU  72  -1.342 -14.411 -12.110

  No H/Q in entry =          11
  In of MODEL   15
    1    H    VAL  73           H        VAL  73  -1.700  -8.801 -15.120
    2    HA   VAL  73           HA       VAL  73   0.191  -7.066 -14.021
    3    HB   VAL  73           HB       VAL  73  -0.229  -5.659 -15.880
    4   HG12  VAL  73          HG11      VAL  73  -1.082  -8.360 -16.910
    5   HG11  VAL  73          HG12      VAL  73   0.536  -8.110 -16.257
    6   HG13  VAL  73          HG13      VAL  73  -0.002  -7.186 -17.659
    7   HG22  VAL  73          HG21      VAL  73  -2.505  -5.171 -15.901
    8   HG21  VAL  73          HG22      VAL  73  -2.972  -6.860 -15.713
    9   HG23  VAL  73          HG23      VAL  73  -2.391  -6.275 -17.272

  No H/Q in entry =           9
  In of MODEL   15
    1    H    LEU  74           H        LEU  74  -3.203  -7.243 -13.458
    2    HA   LEU  74           HA       LEU  74  -3.869  -4.599 -12.848
    3    HB2  LEU  74           HB2      LEU  74  -5.568  -6.294 -13.017
    4    HB3  LEU  74           HB3      LEU  74  -4.858  -7.206 -11.689
    5    HG   LEU  74           HG       LEU  74  -5.322  -5.281 -10.166
    6   HD11  LEU  74          HD11      LEU  74  -6.474  -4.176 -12.726
    7   HD13  LEU  74          HD12      LEU  74  -5.392  -3.386 -11.582
    8   HD12  LEU  74          HD13      LEU  74  -7.083  -3.652 -11.156
    9   HD21  LEU  74          HD21      LEU  74  -6.916  -7.257 -10.809
   10   HD23  LEU  74          HD22      LEU  74  -7.847  -5.976 -11.555
   11   HD22  LEU  74          HD23      LEU  74  -7.523  -5.918  -9.839

  No H/Q in entry =          11
  In of MODEL   15
    1    H    VAL  75           H        VAL  75  -2.778  -7.163 -10.685
    2    HA   VAL  75           HA       VAL  75  -2.604  -5.606  -8.343
    3    HB   VAL  75           HB       VAL  75  -1.069  -8.076  -9.135
    4   HG13  VAL  75          HG11      VAL  75   0.180  -6.819  -7.412
    5   HG12  VAL  75          HG12      VAL  75  -0.595  -8.214  -6.676
    6   HG11  VAL  75          HG13      VAL  75  -1.295  -6.617  -6.471
    7   HG21  VAL  75          HG21      VAL  75  -3.533  -8.308  -8.931
    8   HG23  VAL  75          HG22      VAL  75  -3.461  -7.592  -7.321
    9   HG22  VAL  75          HG23      VAL  75  -2.704  -9.157  -7.626

  No H/Q in entry =           9
  In of MODEL   15
    1    H    GLU  76           H        GLU  76  -0.186  -6.325 -10.882
    2    HA   GLU  76           HA       GLU  76   1.977  -4.937  -9.729
    3    HB2  GLU  76           HB2      GLU  76   2.209  -6.409 -11.708
    4    HB3  GLU  76           HB3      GLU  76   1.268  -5.276 -12.667
    5    HG2  GLU  76           HG2      GLU  76   3.595  -4.887 -13.171
    6    HG3  GLU  76           HG3      GLU  76   3.050  -3.526 -12.209

  No H/Q in entry =           6
  In of MODEL   15
    1    H    ALA  77           H        ALA  77  -0.580  -3.784 -11.916
    2    HA   ALA  77           HA       ALA  77   0.361  -1.121 -12.096
    3    HB2  ALA  77           HB1      ALA  77  -1.961  -0.597 -12.831
    4    HB3  ALA  77           HB2      ALA  77  -2.446  -2.230 -12.372
    5    HB1  ALA  77           HB3      ALA  77  -1.279  -1.990 -13.673

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLN  78           H        GLN  78  -1.875  -2.715  -9.880
    2    HA   GLN  78           HA       GLN  78  -2.723  -0.411  -8.481
    3    HB2  GLN  78           HB2      GLN  78  -3.790  -2.691  -8.392
    4    HB3  GLN  78           HB3      GLN  78  -2.442  -3.223  -7.389
    5    HG2  GLN  78           HG2      GLN  78  -2.992  -1.490  -5.730
    6    HG3  GLN  78           HG3      GLN  78  -4.343  -0.957  -6.729
    7   HE21  GLN  78          HE21      GLN  78  -4.782  -1.933  -4.071
    8   HE22  GLN  78          HE22      GLN  78  -5.613  -3.410  -4.178

  No H/Q in entry =           8
  In of MODEL   15
    1    H    LEU  79           H        LEU  79  -0.002  -2.615  -8.031
    2    HA   LEU  79           HA       LEU  79   0.960  -1.697  -5.576
    3    HB2  LEU  79           HB2      LEU  79   1.867  -3.690  -6.643
    4    HB3  LEU  79           HB3      LEU  79   2.493  -2.728  -7.978
    5    HG   LEU  79           HG       LEU  79   4.028  -1.558  -6.477
    6   HD13  LEU  79          HD11      LEU  79   3.022  -1.329  -4.409
    7   HD12  LEU  79          HD12      LEU  79   4.126  -2.658  -4.065
    8   HD11  LEU  79          HD13      LEU  79   2.427  -2.990  -4.392
    9   HD23  LEU  79          HD21      LEU  79   5.281  -3.681  -5.573
   10   HD22  LEU  79          HD22      LEU  79   5.072  -3.488  -7.311
   11   HD21  LEU  79          HD23      LEU  79   4.015  -4.577  -6.416

  No H/Q in entry =          11
  In of MODEL   15
    1    H    HIS  80           H        HIS  80   1.805  -0.567  -8.851
    2    HA   HIS  80           HA       HIS  80   3.574   1.456  -7.933
    3    HB2  HIS  80           HB2      HIS  80   2.296   0.733 -10.514
    4    HB3  HIS  80           HB3      HIS  80   2.858   2.397 -10.345
    5    HD1  HIS  80           HD1      HIS  80   5.253   2.744 -10.871
    6    HD2  HIS  80           HD2      HIS  80   4.512  -1.181  -9.674
    7    HE1  HIS  80           HE1      HIS  80   7.467   1.510 -11.038
    8    HE2  HIS  80           HE2      HIS  80   7.027  -0.885 -10.312

  No H/Q in entry =           8
  In of MODEL   15
    1    H    LEU  81           H        LEU  81   0.167   1.547  -8.909
    2    HA   LEU  81           HA       LEU  81  -0.164   4.334  -8.581
    3    HB2  LEU  81           HB2      LEU  81  -2.133   2.049  -8.498
    4    HB3  LEU  81           HB3      LEU  81  -2.619   3.743  -8.407
    5    HG   LEU  81           HG       LEU  81  -0.906   2.625 -10.643
    6   HD12  LEU  81          HD11      LEU  81  -3.145   2.898 -11.941
    7   HD11  LEU  81          HD12      LEU  81  -3.898   2.816 -10.348
    8   HD13  LEU  81          HD13      LEU  81  -2.928   1.467 -10.935
    9   HD23  LEU  81          HD21      LEU  81  -2.047   4.745 -11.742
   10   HD22  LEU  81          HD22      LEU  81  -0.633   4.946 -10.710
   11   HD21  LEU  81          HD23      LEU  81  -2.244   5.262 -10.069

  No H/Q in entry =          11
  In of MODEL   15
    1    H    MET  82           H        MET  82  -0.766   1.637  -6.329
    2    HA   MET  82           HA       MET  82  -1.848   3.204  -4.242
    3    HB2  MET  82           HB2      MET  82  -0.420   0.545  -4.280
    4    HB3  MET  82           HB3      MET  82  -1.012   1.260  -2.783
    5    HG2  MET  82           HG2      MET  82  -2.736   0.728  -5.222
    6    HG3  MET  82           HG3      MET  82  -2.635  -0.342  -3.825
    7    HE3  MET  82           HE1      MET  82  -4.388   1.275  -1.010
    8    HE2  MET  82           HE2      MET  82  -2.664   1.588  -1.197
    9    HE1  MET  82           HE3      MET  82  -3.321   0.016  -1.649

  No H/Q in entry =           9
  In of MODEL   15
    1    H    THR  83           H        THR  83   1.473   2.185  -4.934
    2    HA   THR  83           HA       THR  83   2.670   3.317  -2.636
    3    HB   THR  83           HB       THR  83   4.764   3.303  -4.112
    4    HG1  THR  83           HG1      THR  83   4.534   2.770  -6.135
    5   HG22  THR  83          HG21      THR  83   4.375   0.636  -4.441
    6   HG21  THR  83          HG22      THR  83   3.079   0.990  -3.300
    7   HG23  THR  83          HG23      THR  83   4.751   1.369  -2.882

  No H/Q in entry =           7
  In of MODEL   15
    1    H    SER  84           H        SER  84   2.270   4.585  -5.937
    2    HA   SER  84           HA       SER  84   3.559   7.053  -5.485
    3    HB2  SER  84           HB2      SER  84   1.505   6.176  -7.502
    4    HB3  SER  84           HB3      SER  84   2.149   7.817  -7.479
    5    HG   SER  84           HG       SER  84   3.572   5.371  -7.769

  No H/Q in entry =           5
  In of MODEL   15
    1    H    MET  85           H        MET  85   0.082   6.225  -5.310
    2    HA   MET  85           HA       MET  85  -0.833   8.817  -4.710
    3    HB2  MET  85           HB2      MET  85  -2.320   6.981  -5.376
    4    HB3  MET  85           HB3      MET  85  -2.011   6.176  -3.838
    5    HG2  MET  85           HG2      MET  85  -2.948   8.095  -2.622
    6    HG3  MET  85           HG3      MET  85  -3.211   8.944  -4.143
    7    HE1  MET  85           HE1      MET  85  -3.723   5.994  -2.042
    8    HE3  MET  85           HE2      MET  85  -4.068   4.901  -3.380
    9    HE2  MET  85           HE3      MET  85  -5.372   5.419  -2.316

  No H/Q in entry =           9
  In of MODEL   15
    1    H    LEU  86           H        LEU  86   0.143   6.176  -2.565
    2    HA   LEU  86           HA       LEU  86  -0.414   7.470  -0.123
    3    HB2  LEU  86           HB2      LEU  86   0.099   5.009  -0.516
    4    HB3  LEU  86           HB3      LEU  86   1.797   5.472  -0.613
    5    HG   LEU  86           HG       LEU  86   1.452   6.628   1.655
    6   HD11  LEU  86          HD11      LEU  86  -1.227   5.808   1.187
    7   HD13  LEU  86          HD12      LEU  86  -0.575   6.570   2.636
    8   HD12  LEU  86          HD13      LEU  86  -0.631   4.812   2.518
    9   HD23  LEU  86          HD21      LEU  86   1.083   3.628   1.780
   10   HD22  LEU  86          HD22      LEU  86   2.066   4.658   2.818
   11   HD21  LEU  86          HD23      LEU  86   2.571   4.342   1.159

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ALA  87           H        ALA  87   2.570   7.233  -2.016
    2    HA   ALA  87           HA       ALA  87   4.250   8.677  -0.293
    3    HB3  ALA  87           HB1      ALA  87   4.362   7.665  -3.000
    4    HB2  ALA  87           HB2      ALA  87   5.691   8.022  -1.901
    5    HB1  ALA  87           HB3      ALA  87   5.051   9.289  -2.945

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ARG  88           H        ARG  88   2.278   9.774  -3.013
    2    HA   ARG  88           HA       ARG  88   3.001  12.478  -2.898
    3    HB2  ARG  88           HB2      ARG  88   1.767  11.300  -4.753
    4    HB3  ARG  88           HB3      ARG  88   0.309  11.417  -3.769
    5    HG2  ARG  88           HG2      ARG  88   1.279  14.016  -3.688
    6    HG3  ARG  88           HG3      ARG  88   1.711  13.509  -5.319
    7    HD2  ARG  88           HD2      ARG  88  -0.432  13.548  -6.014
    8    HD3  ARG  88           HD3      ARG  88  -1.001  12.685  -4.585
    9    HE   ARG  88           HE       ARG  88  -1.243  15.459  -5.004
   10   HH21  ARG  88          HH11      ARG  88  -1.793  16.779  -3.266
   11   HH22  ARG  88          HH12      ARG  88  -1.485  16.248  -1.649
   12   HH11  ARG  88          HH21      ARG  88  -0.182  13.217  -2.630
   13   HH12  ARG  88          HH22      ARG  88  -0.590  14.225  -1.288

  No H/Q in entry =          13
  In of MODEL   15
    1    H    GLU  89           H        GLU  89   0.331  10.754  -1.254
    2    HA   GLU  89           HA       GLU  89  -0.817  13.046  -0.049
    3    HB2  GLU  89           HB2      GLU  89  -1.894  10.787  -0.133
    4    HB3  GLU  89           HB3      GLU  89  -0.758  10.253   1.107
    5    HG2  GLU  89           HG2      GLU  89  -1.607  11.937   2.666
    6    HG3  GLU  89           HG3      GLU  89  -2.673  12.588   1.424

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LEU  90           H        LEU  90   1.677  10.799   1.123
    2    HA   LEU  90           HA       LEU  90   2.014  12.051   3.652
    3    HB2  LEU  90           HB2      LEU  90   3.816  10.308   1.973
    4    HB3  LEU  90           HB3      LEU  90   4.228  10.833   3.611
    5    HG   LEU  90           HG       LEU  90   1.617   9.440   2.954
    6   HD12  LEU  90          HD11      LEU  90   2.795   7.416   3.962
    7   HD11  LEU  90          HD12      LEU  90   4.301   8.298   3.717
    8   HD13  LEU  90          HD13      LEU  90   3.295   7.872   2.332
    9   HD22  LEU  90          HD21      LEU  90   1.339  10.360   5.076
   10   HD21  LEU  90          HD22      LEU  90   3.059  10.283   5.456
   11   HD23  LEU  90          HD23      LEU  90   2.078   8.819   5.506

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  91           H        ILE  91   3.606  12.461   0.523
    2    HA   ILE  91           HA       ILE  91   5.552  14.327   1.359
    3    HB   ILE  91           HB       ILE  91   4.245  13.812  -1.319
    4   HG12  ILE  91          HG12      ILE  91   7.087  13.375  -0.349
    5   HG13  ILE  91          HG13      ILE  91   5.827  12.155  -0.184
    6   HG22  ILE  91          HG21      ILE  91   6.443  15.197  -2.012
    7   HG21  ILE  91          HG22      ILE  91   6.122  15.993  -0.470
    8   HG23  ILE  91          HG23      ILE  91   4.897  16.000  -1.737
    9   HD13  ILE  91          HD11      ILE  91   5.656  11.828  -2.491
   10   HD12  ILE  91          HD12      ILE  91   7.386  12.101  -2.280
   11   HD11  ILE  91          HD13      ILE  91   6.352  13.406  -2.865

  No H/Q in entry =          11
  In of MODEL   15
    1    H    THR  92           H        THR  92   2.181  14.701   0.355
    2    HA   THR  92           HA       THR  92   2.107  17.523   0.294
    3    HB   THR  92           HB       THR  92  -0.025  15.492   0.997
    4    HG1  THR  92           HG1      THR  92   0.279  15.318  -1.089
    5   HG22  THR  92          HG21      THR  92  -1.464  17.629   0.276
    6   HG21  THR  92          HG22      THR  92  -0.085  18.478   0.971
    7   HG23  THR  92          HG23      THR  92  -1.006  17.341   1.954

  No H/Q in entry =           7
  In of MODEL   15
    1    H    GLU  93           H        GLU  93   1.602  15.215   2.949
    2    HA   GLU  93           HA       GLU  93   1.040  17.110   4.968
    3    HB2  GLU  93           HB2      GLU  93   2.400  14.408   5.203
    4    HB3  GLU  93           HB3      GLU  93   1.695  15.324   6.536
    5    HG2  GLU  93           HG2      GLU  93   0.093  14.518   4.100
    6    HG3  GLU  93           HG3      GLU  93   0.214  13.497   5.528

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LEU  94           H        LEU  94   4.070  15.679   3.814
    2    HA   LEU  94           HA       LEU  94   5.803  16.856   5.699
    3    HB2  LEU  94           HB2      LEU  94   6.217  15.895   2.868
    4    HB3  LEU  94           HB3      LEU  94   7.537  16.575   3.816
    5    HG   LEU  94           HG       LEU  94   5.836  14.351   4.954
    6   HD11  LEU  94          HD11      LEU  94   7.932  14.160   2.820
    7   HD13  LEU  94          HD12      LEU  94   6.503  13.162   3.084
    8   HD12  LEU  94          HD13      LEU  94   7.934  12.933   4.089
    9   HD23  LEU  94          HD21      LEU  94   8.036  13.852   6.104
   10   HD22  LEU  94          HD22      LEU  94   7.343  15.419   6.520
   11   HD21  LEU  94          HD23      LEU  94   8.682  15.320   5.376

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  95           H        ILE  95   4.640  18.007   2.551
    2    HA   ILE  95           HA       ILE  95   6.172  20.391   2.488
    3    HB   ILE  95           HB       ILE  95   3.538  19.662   1.187
    4   HG12  ILE  95          HG12      ILE  95   6.319  20.046   0.046
    5   HG13  ILE  95          HG13      ILE  95   5.697  18.482   0.562
    6   HG21  ILE  95          HG21      ILE  95   5.245  22.159   0.963
    7   HG23  ILE  95          HG22      ILE  95   3.522  22.062   1.322
    8   HG22  ILE  95          HG23      ILE  95   4.110  21.671  -0.295
    9   HD13  ILE  95          HD11      ILE  95   4.136  18.380  -1.165
   10   HD12  ILE  95          HD12      ILE  95   5.470  19.220  -1.955
   11   HD11  ILE  95          HD13      ILE  95   4.083  20.132  -1.361

  No H/Q in entry =          11
  In of MODEL   15
    1    H    GLU  96           H        GLU  96   2.936  19.685   3.788
    2    HA   GLU  96           HA       GLU  96   2.273  22.321   4.539
    3    HB2  GLU  96           HB2      GLU  96   0.628  20.511   4.554
    4    HB3  GLU  96           HB3      GLU  96   1.505  19.698   5.848
    5    HG2  GLU  96           HG2      GLU  96   0.466  20.965   7.419
    6    HG3  GLU  96           HG3      GLU  96   0.975  22.447   6.621

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LEU  97           H        LEU  97   4.160  19.802   6.163
    2    HA   LEU  97           HA       LEU  97   4.498  21.157   8.633
    3    HB2  LEU  97           HB2      LEU  97   6.069  19.014   7.217
    4    HB3  LEU  97           HB3      LEU  97   6.650  19.709   8.728
    5    HG   LEU  97           HG       LEU  97   3.858  18.569   8.421
    6   HD12  LEU  97          HD11      LEU  97   4.833  16.573   9.634
    7   HD11  LEU  97          HD12      LEU  97   6.433  17.230   9.287
    8   HD13  LEU  97          HD13      LEU  97   5.369  16.754   7.963
    9   HD23  LEU  97          HD21      LEU  97   4.319  18.283  10.985
   10   HD22  LEU  97          HD22      LEU  97   3.912  19.888  10.381
   11   HD21  LEU  97          HD23      LEU  97   5.591  19.476  10.724

  No H/Q in entry =          11
  In of MODEL   15
    1    H    HIS  98           H        HIS  98   6.364  21.203   5.605
    2    HA   HIS  98           HA       HIS  98   8.493  22.818   6.500
    3    HB2  HIS  98           HB2      HIS  98   7.201  22.541   3.776
    4    HB3  HIS  98           HB3      HIS  98   8.625  23.543   4.065
    5    HD1  HIS  98           HD1      HIS  98   7.472  19.953   4.087
    6    HD2  HIS  98           HD2      HIS  98  11.019  22.107   4.507
    7    HE1  HIS  98           HE1      HIS  98   9.354  18.254   4.028
    8    HE2  HIS  98           HE2      HIS  98  11.519  19.545   4.284

  No H/Q in entry =           8
  In of MODEL   15
    1    H    GLU  99           H        GLU  99   5.258  23.600   5.329
    2    HA   GLU  99           HA       GLU  99   5.591  26.421   5.270
    3    HB2  GLU  99           HB2      GLU  99   3.730  25.221   4.142
    4    HB3  GLU  99           HB3      GLU  99   3.042  24.849   5.722
    5    HG2  GLU  99           HG2      GLU  99   2.824  27.238   6.223
    6    HG3  GLU  99           HG3      GLU  99   3.591  27.650   4.692

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LYS 100           H        LYS 100   4.500  24.169   7.794
    2    HA   LYS 100           HA       LYS 100   3.883  26.214   9.688
    3    HB2  LYS 100           HB2      LYS 100   4.506  23.272  10.034
    4    HB3  LYS 100           HB3      LYS 100   4.043  24.338  11.366
    5    HG2  LYS 100           HG2      LYS 100   1.966  24.942  10.121
    6    HG3  LYS 100           HG3      LYS 100   2.410  23.780   8.868
    7    HD2  LYS 100           HD2      LYS 100   2.363  21.958  10.530
    8    HD3  LYS 100           HD3      LYS 100   1.936  23.115  11.794
    9    HE2  LYS 100           HE2      LYS 100  -0.128  23.703  10.533
   10    HE3  LYS 100           HE3      LYS 100   0.290  22.489   9.317
   11    HZ1  LYS 100           HZ1      LYS 100   0.038  21.819  12.199
   12    HZ3  LYS 100           HZ2      LYS 100   0.038  20.765  10.864
   13    HZ2  LYS 100           HZ3      LYS 100  -1.294  21.783  11.145

  No H/Q in entry =          13
  In of MODEL   15
    1    H    LEU 101           H        LEU 101   6.833  24.464   8.851
    2    HA   LEU 101           HA       LEU 101   8.421  25.330  11.052
    3    HB2  LEU 101           HB2      LEU 101   9.028  24.352   8.273
    4    HB3  LEU 101           HB3      LEU 101  10.320  25.038   9.253
    5    HG   LEU 101           HG       LEU 101   8.524  22.853  10.320
    6   HD12  LEU 101          HD11      LEU 101  10.600  21.390   9.709
    7   HD11  LEU 101          HD12      LEU 101  10.946  22.659   8.536
    8   HD13  LEU 101          HD13      LEU 101   9.431  21.762   8.444
    9   HD21  LEU 101          HD21      LEU 101  11.231  24.004  11.043
   10   HD23  LEU 101          HD22      LEU 101  10.713  22.424  11.624
   11   HD22  LEU 101          HD23      LEU 101   9.799  23.866  12.063

  No H/Q in entry =          11
  In of MODEL   15
    1    H    LYS 102           H        LYS 102   6.807  27.168   8.913
    2    HA   LYS 102           HA       LYS 102   6.848  29.462   8.620
    3    HB2  LYS 102           HB2      LYS 102   8.417  29.371  10.716
    4    HB3  LYS 102           HB3      LYS 102   9.712  29.586   9.555
    5    HG2  LYS 102           HG2      LYS 102   7.577  31.506  10.419
    6    HG3  LYS 102           HG3      LYS 102   9.285  31.792  10.166
    7    HD2  LYS 102           HD2      LYS 102   7.338  31.339   7.868
    8    HD3  LYS 102           HD3      LYS 102   7.698  32.924   8.536
    9    HE2  LYS 102           HE2      LYS 102   9.086  31.760   6.461
   10    HE3  LYS 102           HE3      LYS 102   9.683  33.076   7.471
   11    HZ2  LYS 102           HZ1      LYS 102  11.233  31.195   7.294
   12    HZ1  LYS 102           HZ2      LYS 102  10.087  30.195   8.039
   13    HZ3  LYS 102           HZ3      LYS 102  10.761  31.493   8.896

  No H/Q in entry =          13
  In of MODEL   15
    1    H    ALA 103           H        ALA 103  10.124  28.173   8.052
    2    HA   ALA 103           HA       ALA 103  11.064  29.564   5.974
    3    HB2  ALA 103           HB1      ALA 103  11.982  27.363   5.046
    4    HB1  ALA 103           HB2      ALA 103  11.101  26.575   6.353
    5    HB3  ALA 103           HB3      ALA 103  12.373  27.739   6.724

  No H/Q in entry =           5
  In of MODEL   15
    1    H1   LYS   3           H1       LYS   3 -31.035   6.474 -19.566
    2    H2   LYS   3           H3       LYS   3 -30.060   6.161 -20.921
    3    H3   LYS   3           H2       LYS   3 -31.472   5.254 -20.663
    4    HA   LYS   3           HA       LYS   3 -30.490   3.849 -19.260
    5    HB2  LYS   3           HB2      LYS   3 -28.188   5.210 -20.609
    6    HB3  LYS   3           HB3      LYS   3 -27.881   3.999 -19.364
    7    HG2  LYS   3           HG2      LYS   3 -29.342   2.438 -20.701
    8    HG3  LYS   3           HG3      LYS   3 -29.279   3.633 -21.996
    9    HD2  LYS   3           HD2      LYS   3 -26.800   3.469 -21.959
   10    HD3  LYS   3           HD3      LYS   3 -26.938   2.177 -20.767
   11    HE2  LYS   3           HE2      LYS   3 -28.470   1.027 -22.471
   12    HE3  LYS   3           HE3      LYS   3 -27.832   2.188 -23.634
   13    HZ3  LYS   3           HZ1      LYS   3 -26.061   0.922 -23.909
   14    HZ2  LYS   3           HZ2      LYS   3 -26.709  -0.229 -22.842
   15    HZ1  LYS   3           HZ3      LYS   3 -25.691   0.996 -22.254

  No H/Q in entry =          15
  In of MODEL   15
    1    H    LYS   4           H        LYS   4 -30.534   3.715 -17.198
    2    HA   LYS   4           HA       LYS   4 -29.747   5.990 -15.559
    3    HB2  LYS   4           HB2      LYS   4 -31.001   3.326 -14.843
    4    HB3  LYS   4           HB3      LYS   4 -30.745   4.664 -13.723
    5    HG2  LYS   4           HG2      LYS   4 -32.567   4.632 -16.134
    6    HG3  LYS   4           HG3      LYS   4 -33.048   4.698 -14.440
    7    HD2  LYS   4           HD2      LYS   4 -32.303   6.906 -14.184
    8    HD3  LYS   4           HD3      LYS   4 -31.273   6.821 -15.613
    9    HE2  LYS   4           HE2      LYS   4 -33.170   8.234 -16.070
   10    HE3  LYS   4           HE3      LYS   4 -33.288   6.761 -17.033
   11    HZ3  LYS   4           HZ1      LYS   4 -34.874   5.888 -15.473
   12    HZ2  LYS   4           HZ2      LYS   4 -35.400   7.393 -16.060
   13    HZ1  LYS   4           HZ3      LYS   4 -34.737   7.273 -14.501

  No H/Q in entry =          13
  In of MODEL   15
    1    H    HIS   5           H        HIS   5 -28.268   6.049 -13.976
    2    HA   HIS   5           HA       HIS   5 -26.028   4.169 -14.314
    3    HB2  HIS   5           HB2      HIS   5 -26.215   6.933 -13.116
    4    HB3  HIS   5           HB3      HIS   5 -24.755   5.945 -13.104
    5    HD1  HIS   5           HD1      HIS   5 -23.267   7.106 -14.706
    6    HD2  HIS   5           HD2      HIS   5 -27.090   6.566 -16.236
    7    HE1  HIS   5           HE1      HIS   5 -23.100   7.674 -17.159
    8    HE2  HIS   5           HE2      HIS   5 -25.431   7.333 -18.061

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ILE   6           H        ILE   6 -25.827   2.596 -12.993
    2    HA   ILE   6           HA       ILE   6 -26.781   2.894 -10.225
    3    HB   ILE   6           HB       ILE   6 -26.022   0.405 -11.758
    4   HG12  ILE   6          HG12      ILE   6 -28.738   1.407 -10.894
    5   HG13  ILE   6          HG13      ILE   6 -28.101   1.549 -12.533
    6   HG23  ILE   6          HG21      ILE   6 -26.414  -0.832  -9.891
    7   HG22  ILE   6          HG22      ILE   6 -27.540   0.342  -9.210
    8   HG21  ILE   6          HG23      ILE   6 -25.803   0.638  -9.131
    9   HD13  ILE   6          HD11      ILE   6 -28.613  -0.560 -13.023
   10   HD12  ILE   6          HD12      ILE   6 -29.620  -0.516 -11.576
   11   HD11  ILE   6          HD13      ILE   6 -27.980  -1.161 -11.491

  No H/Q in entry =          11
  In of MODEL   15
    1    H    TYR   7           H        TYR   7 -25.000   3.499  -8.950
    2    HA   TYR   7           HA       TYR   7 -22.316   2.476  -9.641
    3    HB2  TYR   7           HB2      TYR   7 -23.214   4.937  -8.164
    4    HB3  TYR   7           HB3      TYR   7 -21.542   4.383  -8.209
    5    HD1  TYR   7           HD1      TYR   7 -22.621   3.454 -11.291
    6    HD2  TYR   7           HD2      TYR   7 -21.854   7.017  -9.080
    7    HE1  TYR   7           HE1      TYR   7 -22.173   4.666 -13.388
    8    HE2  TYR   7           HE2      TYR   7 -21.447   8.236 -11.170
    9    HH   TYR   7           HH       TYR   7 -21.681   8.147 -13.401

  No H/Q in entry =           9
  In of MODEL   15
    1    H    LEU   8           H        LEU   8 -21.375   1.106  -8.313
    2    HA   LEU   8           HA       LEU   8 -22.502   0.648  -5.622
    3    HB2  LEU   8           HB2      LEU   8 -20.850  -1.063  -7.459
    4    HB3  LEU   8           HB3      LEU   8 -21.035  -1.434  -5.746
    5    HG   LEU   8           HG       LEU   8 -23.520  -1.549  -6.154
    6   HD13  LEU   8          HD11      LEU   8 -23.634  -0.337  -8.266
    7   HD12  LEU   8          HD12      LEU   8 -24.205  -1.988  -8.498
    8   HD11  LEU   8          HD13      LEU   8 -22.589  -1.531  -9.034
    9   HD23  LEU   8          HD21      LEU   8 -22.305  -3.625  -7.847
   10   HD22  LEU   8          HD22      LEU   8 -23.388  -3.762  -6.462
   11   HD21  LEU   8          HD23      LEU   8 -21.671  -3.449  -6.211

  No H/Q in entry =          11
  In of MODEL   15
    1    H    PHE   9           H        PHE   9 -21.210   1.029  -3.844
    2    HA   PHE   9           HA       PHE   9 -18.407   1.895  -4.383
    3    HB2  PHE   9           HB2      PHE   9 -20.392   3.012  -2.410
    4    HB3  PHE   9           HB3      PHE   9 -18.673   3.375  -2.373
    5    HD1  PHE   9           HD1      PHE   9 -17.613   4.663  -4.161
    6    HD2  PHE   9           HD2      PHE   9 -21.834   3.898  -4.176
    7    HE1  PHE   9           HE1      PHE   9 -17.919   6.385  -5.916
    8    HE2  PHE   9           HE2      PHE   9 -22.142   5.632  -5.925
    9    HZ   PHE   9           HZ       PHE   9 -20.181   6.870  -6.801

  No H/Q in entry =           9
  In of MODEL   15
    1    H    SER  10           H        SER  10 -16.831   0.892  -3.302
    2    HA   SER  10           HA       SER  10 -17.023   0.004  -0.608
    3    HB2  SER  10           HB2      SER  10 -18.315  -1.827  -1.657
    4    HB3  SER  10           HB3      SER  10 -16.962  -2.139  -2.734
    5    HG   SER  10           HG       SER  10 -15.985  -2.065  -0.309

  No H/Q in entry =           5
  In of MODEL   15
    1    H    SER  11           H        SER  11 -14.998   0.058   0.195
    2    HA   SER  11           HA       SER  11 -12.811   0.848  -1.373
    3    HB2  SER  11           HB2      SER  11 -12.737   1.414   0.903
    4    HB3  SER  11           HB3      SER  11 -13.043  -0.247   1.413
    5    HG   SER  11           HG       SER  11 -10.845  -0.005  -0.188

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA  12           H        ALA  12 -14.095  -1.826  -2.136
    2    HA   ALA  12           HA       ALA  12 -11.551  -3.138  -2.683
    3    HB2  ALA  12           HB1      ALA  12 -12.097  -5.259  -1.808
    4    HB1  ALA  12           HB2      ALA  12 -13.786  -4.821  -1.560
    5    HB3  ALA  12           HB3      ALA  12 -12.536  -4.125  -0.530

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLY  13           H        GLY  13 -12.257  -2.158  -4.728
    2    HA3  GLY  13           HA2      GLY  13 -14.536  -2.781  -6.183
    3    HA2  GLY  13           HA3      GLY  13 -12.973  -2.393  -6.912

  No H/Q in entry =           3
  In of MODEL   15
    1    H    MET  14           H        MET  14 -11.527  -4.696  -5.999
    2    HA   MET  14           HA       MET  14 -11.972  -6.458  -8.079
    3    HB2  MET  14           HB2      MET  14  -9.918  -6.583  -6.759
    4    HB3  MET  14           HB3      MET  14 -10.808  -7.228  -5.381
    5    HG2  MET  14           HG2      MET  14 -11.442  -9.206  -6.740
    6    HG3  MET  14           HG3      MET  14 -10.531  -8.554  -8.103
    7    HE1  MET  14           HE1      MET  14  -8.164  -7.854  -8.007
    8    HE3  MET  14           HE2      MET  14  -8.202  -9.522  -8.574
    9    HE2  MET  14           HE3      MET  14  -6.961  -9.017  -7.430

  No H/Q in entry =           9
  In of MODEL   15
    1    H    SER  15           H        SER  15 -13.204  -6.929  -4.766
    2    HA   SER  15           HA       SER  15 -14.643  -9.314  -5.542
    3    HB2  SER  15           HB2      SER  15 -14.682  -7.675  -3.013
    4    HB3  SER  15           HB3      SER  15 -15.876  -8.937  -3.306
    5    HG   SER  15           HG       SER  15 -13.177  -9.129  -2.737

  No H/Q in entry =           5
  In of MODEL   15
    1    H    THR  16           H        THR  16 -15.578  -5.904  -5.004
    2    HA   THR  16           HA       THR  16 -18.397  -6.267  -5.452
    3    HB   THR  16           HB       THR  16 -16.737  -3.786  -6.017
    4    HG1  THR  16           HG1      THR  16 -16.870  -5.062  -3.771
    5   HG22  THR  16          HG21      THR  16 -18.855  -2.655  -5.369
    6   HG21  THR  16          HG22      THR  16 -19.633  -4.241  -5.227
    7   HG23  THR  16          HG23      THR  16 -19.043  -3.668  -6.795

  No H/Q in entry =           7
  In of MODEL   15
    1    H    SER  17           H        SER  17 -15.618  -5.780  -7.366
    2    HA   SER  17           HA       SER  17 -16.740  -5.023  -9.865
    3    HB2  SER  17           HB2      SER  17 -14.139  -6.400  -9.169
    4    HB3  SER  17           HB3      SER  17 -14.577  -5.961 -10.819
    5    HG   SER  17           HG       SER  17 -13.579  -4.190 -10.219

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU  18           H        LEU  18 -16.237  -8.174  -8.408
    2    HA   LEU  18           HA       LEU  18 -16.868  -9.669 -10.754
    3    HB2  LEU  18           HB2      LEU  18 -15.662 -10.654  -8.856
    4    HB3  LEU  18           HB3      LEU  18 -17.078 -10.418  -7.832
    5    HG   LEU  18           HG       LEU  18 -18.360 -11.934  -9.323
    6   HD11  LEU  18          HD11      LEU  18 -15.710 -11.992 -10.726
    7   HD13  LEU  18          HD12      LEU  18 -17.332 -11.877 -11.409
    8   HD12  LEU  18          HD13      LEU  18 -16.752 -13.413 -10.766
    9   HD22  LEU  18          HD21      LEU  18 -17.563 -12.913  -7.377
   10   HD21  LEU  18          HD22      LEU  18 -15.890 -12.889  -7.939
   11   HD23  LEU  18          HD23      LEU  18 -17.048 -14.007  -8.662

  No H/Q in entry =          11
  In of MODEL   15
    1    H    LEU  19           H        LEU  19 -18.797  -8.407  -8.039
    2    HA   LEU  19           HA       LEU  19 -21.290  -9.537  -8.856
    3    HB2  LEU  19           HB2      LEU  19 -20.958  -8.686  -6.605
    4    HB3  LEU  19           HB3      LEU  19 -20.700  -7.061  -7.239
    5    HG   LEU  19           HG       LEU  19 -23.026  -6.876  -7.852
    6   HD12  LEU  19          HD11      LEU  19 -24.491  -8.852  -6.866
    7   HD11  LEU  19          HD12      LEU  19 -23.033  -9.785  -7.202
    8   HD13  LEU  19          HD13      LEU  19 -23.847  -8.921  -8.507
    9   HD21  LEU  19          HD21      LEU  19 -22.552  -7.880  -5.054
   10   HD23  LEU  19          HD22      LEU  19 -24.020  -7.053  -5.576
   11   HD22  LEU  19          HD23      LEU  19 -22.471  -6.214  -5.630

  No H/Q in entry =          11
  In of MODEL   15
    1    H    VAL  20           H        VAL  20 -19.726  -6.414  -9.569
    2    HA   VAL  20           HA       VAL  20 -21.820  -5.330 -11.133
    3    HB   VAL  20           HB       VAL  20 -18.820  -4.807 -11.268
    4   HG13  VAL  20          HG11      VAL  20 -19.717  -4.227 -13.435
    5   HG12  VAL  20          HG12      VAL  20 -19.467  -2.733 -12.531
    6   HG11  VAL  20          HG13      VAL  20 -21.090  -3.402 -12.696
    7   HG23  VAL  20          HG21      VAL  20 -19.567  -2.620 -10.246
    8   HG22  VAL  20          HG22      VAL  20 -19.678  -4.044  -9.215
    9   HG21  VAL  20          HG23      VAL  20 -21.130  -3.393  -9.973

  No H/Q in entry =           9
  In of MODEL   15
    1    H    SER  21           H        SER  21 -19.115  -7.447 -12.165
    2    HA   SER  21           HA       SER  21 -19.909  -7.327 -14.913
    3    HB2  SER  21           HB2      SER  21 -18.522  -9.332 -15.243
    4    HB3  SER  21           HB3      SER  21 -17.658  -8.097 -14.328
    5    HG   SER  21           HG       SER  21 -17.811  -9.267 -12.546

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LYS  22           H        LYS  22 -21.012  -9.478 -12.328
    2    HA   LYS  22           HA       LYS  22 -22.596 -11.069 -14.137
    3    HB2  LYS  22           HB2      LYS  22 -22.877 -10.699 -11.152
    4    HB3  LYS  22           HB3      LYS  22 -23.700 -11.921 -12.119
    5    HG2  LYS  22           HG2      LYS  22 -20.712 -11.735 -11.762
    6    HG3  LYS  22           HG3      LYS  22 -21.774 -12.807 -10.850
    7    HD2  LYS  22           HD2      LYS  22 -22.456 -13.886 -12.969
    8    HD3  LYS  22           HD3      LYS  22 -21.313 -12.857 -13.833
    9    HE2  LYS  22           HE2      LYS  22 -20.505 -14.748 -11.618
   10    HE3  LYS  22           HE3      LYS  22 -20.495 -15.192 -13.326
   11    HZ2  LYS  22           HZ1      LYS  22 -18.317 -14.496 -12.464
   12    HZ1  LYS  22           HZ2      LYS  22 -18.943 -12.944 -12.174
   13    HZ3  LYS  22           HZ3      LYS  22 -18.855 -13.540 -13.761

  No H/Q in entry =          13
  In of MODEL   15
    1    H    MET  23           H        MET  23 -23.242  -8.124 -12.276
    2    HA   MET  23           HA       MET  23 -26.053  -8.138 -12.769
    3    HB2  MET  23           HB2      MET  23 -24.149  -5.873 -12.214
    4    HB3  MET  23           HB3      MET  23 -25.890  -5.662 -12.384
    5    HG2  MET  23           HG2      MET  23 -26.304  -6.949 -10.409
    6    HG3  MET  23           HG3      MET  23 -24.604  -7.401 -10.289
    7    HE2  MET  23           HE1      MET  23 -26.808  -3.691  -9.104
    8    HE1  MET  23           HE2      MET  23 -27.092  -4.658 -10.549
    9    HE3  MET  23           HE3      MET  23 -26.023  -3.256 -10.623

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ARG  24           H        ARG  24 -23.274  -6.783 -14.571
    2    HA   ARG  24           HA       ARG  24 -24.748  -5.453 -16.568
    3    HB2  ARG  24           HB2      ARG  24 -22.289  -5.125 -16.188
    4    HB3  ARG  24           HB3      ARG  24 -22.003  -6.722 -16.833
    5    HG2  ARG  24           HG2      ARG  24 -22.891  -6.004 -19.057
    6    HG3  ARG  24           HG3      ARG  24 -23.154  -4.372 -18.386
    7    HD2  ARG  24           HD2      ARG  24 -20.996  -4.363 -19.501
    8    HD3  ARG  24           HD3      ARG  24 -20.724  -4.335 -17.763
    9    HE   ARG  24           HE       ARG  24 -19.591  -6.228 -17.828
   10   HH21  ARG  24          HH11      ARG  24 -18.103  -7.199 -19.206
   11   HH22  ARG  24          HH12      ARG  24 -18.630  -7.840 -20.723
   12   HH11  ARG  24          HH21      ARG  24 -21.816  -6.337 -20.377
   13   HH12  ARG  24          HH22      ARG  24 -20.831  -7.333 -21.402

  No H/Q in entry =          13
  In of MODEL   15
    1    H    ALA  25           H        ALA  25 -23.708  -8.817 -16.286
    2    HA   ALA  25           HA       ALA  25 -24.368  -9.640 -18.918
    3    HB1  ALA  25           HB1      ALA  25 -23.721 -11.687 -18.219
    4    HB3  ALA  25           HB2      ALA  25 -24.772 -11.635 -16.803
    5    HB2  ALA  25           HB3      ALA  25 -23.195 -10.848 -16.760

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLN  26           H        GLN  26 -26.183  -9.624 -15.886
    2    HA   GLN  26           HA       GLN  26 -28.561 -10.770 -16.890
    3    HB2  GLN  26           HB2      GLN  26 -27.994  -9.029 -14.510
    4    HB3  GLN  26           HB3      GLN  26 -29.576  -9.713 -14.851
    5    HG2  GLN  26           HG2      GLN  26 -27.026 -11.234 -14.389
    6    HG3  GLN  26           HG3      GLN  26 -28.379 -11.094 -13.274
    7   HE21  GLN  26          HE21      GLN  26 -27.222 -13.292 -14.549
    8   HE22  GLN  26          HE22      GLN  26 -28.295 -14.314 -15.339

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ALA  27           H        ALA  27 -27.538  -7.396 -16.512
    2    HA   ALA  27           HA       ALA  27 -30.002  -6.241 -17.287
    3    HB1  ALA  27           HB1      ALA  27 -28.154  -4.970 -16.183
    4    HB3  ALA  27           HB2      ALA  27 -28.730  -4.194 -17.659
    5    HB2  ALA  27           HB3      ALA  27 -27.218  -5.100 -17.674

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLU  28           H        GLU  28 -27.341  -7.537 -19.165
    2    HA   GLU  28           HA       GLU  28 -28.259  -6.480 -21.683
    3    HB2  GLU  28           HB2      GLU  28 -25.896  -7.223 -21.067
    4    HB3  GLU  28           HB3      GLU  28 -26.485  -8.873 -21.263
    5    HG2  GLU  28           HG2      GLU  28 -25.328  -8.130 -23.238
    6    HG3  GLU  28           HG3      GLU  28 -27.034  -8.411 -23.578

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LYS  29           H        LYS  29 -28.499  -9.577 -20.019
    2    HA   LYS  29           HA       LYS  29 -29.848 -11.018 -22.015
    3    HB2  LYS  29           HB2      LYS  29 -28.816 -12.023 -20.013
    4    HB3  LYS  29           HB3      LYS  29 -30.064 -11.282 -19.014
    5    HG2  LYS  29           HG2      LYS  29 -31.765 -12.613 -20.073
    6    HG3  LYS  29           HG3      LYS  29 -30.587 -13.281 -21.201
    7    HD2  LYS  29           HD2      LYS  29 -29.468 -14.474 -19.469
    8    HD3  LYS  29           HD3      LYS  29 -30.347 -13.607 -18.212
    9    HE2  LYS  29           HE2      LYS  29 -31.162 -15.936 -18.566
   10    HE3  LYS  29           HE3      LYS  29 -32.410 -14.712 -18.807
   11    HZ1  LYS  29           HZ1      LYS  29 -31.858 -14.865 -21.236
   12    HZ3  LYS  29           HZ2      LYS  29 -32.612 -16.232 -20.566
   13    HZ2  LYS  29           HZ3      LYS  29 -30.943 -16.247 -20.871

  No H/Q in entry =          13
  In of MODEL   15
    1    H    TYR  30           H        TYR  30 -31.175  -8.872 -19.509
    2    HA   TYR  30           HA       TYR  30 -33.853  -9.255 -20.739
    3    HB2  TYR  30           HB2      TYR  30 -33.159  -8.113 -18.023
    4    HB3  TYR  30           HB3      TYR  30 -34.786  -8.331 -18.669
    5    HD1  TYR  30           HD1      TYR  30 -35.755 -10.598 -18.874
    6    HD2  TYR  30           HD2      TYR  30 -31.896  -9.972 -17.188
    7    HE1  TYR  30           HE1      TYR  30 -35.723 -12.927 -18.073
    8    HE2  TYR  30           HE2      TYR  30 -31.864 -12.286 -16.390
    9    HH   TYR  30           HH       TYR  30 -33.568 -14.606 -17.472

  No H/Q in entry =           9
  In of MODEL   15
    1    H    GLU  31           H        GLU  31 -31.640  -7.321 -21.551
    2    HA   GLU  31           HA       GLU  31 -31.514  -5.168 -22.378
    3    HB2  GLU  31           HB2      GLU  31 -34.429  -5.810 -22.878
    4    HB3  GLU  31           HB3      GLU  31 -33.557  -4.465 -23.614
    5    HG2  GLU  31           HG2      GLU  31 -32.127  -5.942 -24.809
    6    HG3  GLU  31           HG3      GLU  31 -32.724  -7.340 -23.915

  No H/Q in entry =           6
  In of MODEL   15
    1    H    VAL  32           H        VAL  32 -31.700  -5.056 -19.646
    2    HA   VAL  32           HA       VAL  32 -33.506  -2.896 -18.982
    3    HB   VAL  32           HB       VAL  32 -31.132  -3.947 -17.410
    4   HG12  VAL  32          HG11      VAL  32 -32.639  -3.082 -15.510
    5   HG11  VAL  32          HG12      VAL  32 -33.455  -2.160 -16.772
    6   HG13  VAL  32          HG13      VAL  32 -31.740  -1.897 -16.459
    7   HG21  VAL  32          HG21      VAL  32 -32.946  -5.623 -18.088
    8   HG23  VAL  32          HG22      VAL  32 -33.960  -4.769 -16.926
    9   HG22  VAL  32          HG23      VAL  32 -32.459  -5.529 -16.396

  No H/Q in entry =           9
  In of MODEL   15
    1    HA   PRO  33           HA       PRO  33 -30.409  -0.046 -20.674
    2    HB2  PRO  33           HB2      PRO  33 -31.865   2.213 -20.548
    3    HB3  PRO  33           HB3      PRO  33 -32.370   0.921 -21.637
    4    HG2  PRO  33           HG2      PRO  33 -33.314   1.465 -18.822
    5    HG3  PRO  33           HG3      PRO  33 -34.289   1.278 -20.280
    6    HD2  PRO  33           HD2      PRO  33 -33.877  -0.803 -18.613
    7    HD3  PRO  33           HD3      PRO  33 -33.952  -1.045 -20.357

  No H/Q in entry =           7
  In of MODEL   15
    1    H    VAL  34           H        VAL  34 -29.152  -0.618 -18.729
    2    HA   VAL  34           HA       VAL  34 -28.802   1.802 -17.087
    3    HB   VAL  34           HB       VAL  34 -28.248   0.329 -15.149
    4   HG12  VAL  34          HG11      VAL  34 -30.680  -0.484 -14.831
    5   HG11  VAL  34          HG12      VAL  34 -30.984   0.280 -16.388
    6   HG13  VAL  34          HG13      VAL  34 -30.402   1.245 -15.031
    7   HG21  VAL  34          HG21      VAL  34 -28.491  -1.694 -17.153
    8   HG23  VAL  34          HG22      VAL  34 -29.551  -2.028 -15.782
    9   HG22  VAL  34          HG23      VAL  34 -27.824  -1.782 -15.523

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ILE  35           H        ILE  35 -26.812   2.191 -16.256
    2    HA   ILE  35           HA       ILE  35 -24.546   0.806 -17.527
    3    HB   ILE  35           HB       ILE  35 -24.873   3.705 -16.718
    4   HG12  ILE  35          HG12      ILE  35 -23.933   2.372 -19.265
    5   HG13  ILE  35          HG13      ILE  35 -25.548   3.031 -18.999
    6   HG21  ILE  35          HG21      ILE  35 -22.350   2.112 -17.036
    7   HG23  ILE  35          HG22      ILE  35 -22.771   3.304 -15.806
    8   HG22  ILE  35          HG23      ILE  35 -22.383   3.826 -17.445
    9   HD11  ILE  35          HD11      ILE  35 -24.092   5.193 -18.407
   10   HD13  ILE  35          HD12      ILE  35 -24.645   4.820 -20.041
   11   HD12  ILE  35          HD13      ILE  35 -23.000   4.413 -19.551

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ILE  36           H        ILE  36 -23.333  -0.244 -15.931
    2    HA   ILE  36           HA       ILE  36 -23.746   0.385 -13.060
    3    HB   ILE  36           HB       ILE  36 -22.987  -2.338 -14.168
    4   HG12  ILE  36          HG12      ILE  36 -25.771  -1.466 -13.393
    5   HG13  ILE  36          HG13      ILE  36 -25.207  -1.461 -15.064
    6   HG23  ILE  36          HG21      ILE  36 -23.348  -3.156 -12.052
    7   HG22  ILE  36          HG22      ILE  36 -24.443  -1.846 -11.609
    8   HG21  ILE  36          HG23      ILE  36 -22.705  -1.554 -11.688
    9   HD13  ILE  36          HD11      ILE  36 -25.425  -3.670 -15.266
   10   HD12  ILE  36          HD12      ILE  36 -26.481  -3.522 -13.862
   11   HD11  ILE  36          HD13      ILE  36 -24.792  -3.982 -13.649

  No H/Q in entry =          11
  In of MODEL   15
    1    H    GLU  37           H        GLU  37 -21.945   0.974 -11.964
    2    HA   GLU  37           HA       GLU  37 -19.278   0.113 -12.891
    3    HB2  GLU  37           HB2      GLU  37 -20.036   2.926 -12.106
    4    HB3  GLU  37           HB3      GLU  37 -18.398   2.356 -12.428
    5    HG2  GLU  37           HG2      GLU  37 -18.980   1.970 -14.753
    6    HG3  GLU  37           HG3      GLU  37 -20.626   2.515 -14.437

  No H/Q in entry =           6
  In of MODEL   15
    1    H    ALA  38           H        ALA  38 -17.790  -0.156 -11.214
    2    HA   ALA  38           HA       ALA  38 -18.805   0.050  -8.439
    3    HB1  ALA  38           HB1      ALA  38 -17.142  -1.929  -9.869
    4    HB3  ALA  38           HB2      ALA  38 -18.191  -2.139  -8.466
    5    HB2  ALA  38           HB3      ALA  38 -16.562  -1.493  -8.262

  No H/Q in entry =           5
  In of MODEL   15
    1    H    PHE  39           H        PHE  39 -17.531   1.234  -6.973
    2    HA   PHE  39           HA       PHE  39 -14.984   2.378  -7.881
    3    HB2  PHE  39           HB2      PHE  39 -17.361   3.919  -6.862
    4    HB3  PHE  39           HB3      PHE  39 -15.719   4.552  -6.773
    5    HD1  PHE  39           HD1      PHE  39 -14.399   4.523  -9.031
    6    HD2  PHE  39           HD2      PHE  39 -18.648   4.419  -8.687
    7    HE1  PHE  39           HE1      PHE  39 -14.595   5.402 -11.340
    8    HE2  PHE  39           HE2      PHE  39 -18.861   5.290 -10.987
    9    HZ   PHE  39           HZ       PHE  39 -16.840   5.755 -12.333

  No H/Q in entry =           9
  In of MODEL   15
    1    HA   PRO  40           HA       PRO  40 -14.043   1.609  -3.598
    2    HB2  PRO  40           HB2      PRO  40 -12.230   3.586  -3.002
    3    HB3  PRO  40           HB3      PRO  40 -11.820   2.245  -4.072
    4    HG2  PRO  40           HG2      PRO  40 -12.792   5.000  -4.815
    5    HG3  PRO  40           HG3      PRO  40 -11.384   4.132  -5.425
    6    HD2  PRO  40           HD2      PRO  40 -13.614   4.083  -6.830
    7    HD3  PRO  40           HD3      PRO  40 -12.688   2.595  -6.635

  No H/Q in entry =           7
  In of MODEL   15
    1    H    GLU  41           H        GLU  41 -14.634   2.604  -1.467
    2    HA   GLU  41           HA       GLU  41 -16.842   4.353  -1.444
    3    HB2  GLU  41           HB2      GLU  41 -16.613   4.343   0.964
    4    HB3  GLU  41           HB3      GLU  41 -16.335   2.716   0.341
    5    HG2  GLU  41           HG2      GLU  41 -14.681   2.887   1.922
    6    HG3  GLU  41           HG3      GLU  41 -13.824   3.382   0.462

  No H/Q in entry =           6
  In of MODEL   15
    1    H    THR  42           H        THR  42 -13.493   5.200  -1.511
    2    HA   THR  42           HA       THR  42 -13.787   7.770  -0.302
    3    HB   THR  42           HB       THR  42 -11.625   8.298  -1.408
    4    HG1  THR  42           HG1      THR  42 -10.692   6.537  -2.630
    5   HG21  THR  42          HG21      THR  42 -11.983   5.683   0.037
    6   HG23  THR  42          HG22      THR  42 -11.328   7.203   0.649
    7   HG22  THR  42          HG23      THR  42 -10.382   6.223  -0.469

  No H/Q in entry =           7
  In of MODEL   15
    1    H    LEU  43           H        LEU  43 -14.728   6.690  -3.397
    2    HA   LEU  43           HA       LEU  43 -14.928   9.465  -4.370
    3    HB2  LEU  43           HB2      LEU  43 -15.361   6.827  -5.761
    4    HB3  LEU  43           HB3      LEU  43 -15.526   8.412  -6.516
    5    HG   LEU  43           HG       LEU  43 -12.949   7.229  -5.509
    6   HD11  LEU  43          HD11      LEU  43 -14.166   6.268  -7.620
    7   HD13  LEU  43          HD12      LEU  43 -12.441   6.625  -7.676
    8   HD12  LEU  43          HD13      LEU  43 -13.596   7.757  -8.375
    9   HD23  LEU  43          HD21      LEU  43 -12.068   9.159  -6.970
   10   HD22  LEU  43          HD22      LEU  43 -12.734   9.563  -5.386
   11   HD21  LEU  43          HD23      LEU  43 -13.697   9.822  -6.839

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ALA  44           H        ALA  44 -16.903   7.683  -2.505
    2    HA   ALA  44           HA       ALA  44 -19.389   7.591  -3.816
    3    HB2  ALA  44           HB1      ALA  44 -19.264   6.476  -1.718
    4    HB3  ALA  44           HB2      ALA  44 -20.342   7.843  -1.443
    5    HB1  ALA  44           HB3      ALA  44 -18.667   7.918  -0.899

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLY  45           H        GLY  45 -17.905  10.365  -2.294
    2    HA3  GLY  45           HA2      GLY  45 -20.313  11.913  -2.647
    3    HA2  GLY  45           HA3      GLY  45 -18.753  12.508  -2.078

  No H/Q in entry =           3
  In of MODEL   15
    1    H    GLU  46           H        GLU  46 -17.252  11.536  -4.374
    2    HA   GLU  46           HA       GLU  46 -17.851  13.761  -6.144
    3    HB2  GLU  46           HB2      GLU  46 -15.702  11.637  -6.180
    4    HB3  GLU  46           HB3      GLU  46 -15.809  12.963  -7.337
    5    HG2  GLU  46           HG2      GLU  46 -15.428  13.266  -4.366
    6    HG3  GLU  46           HG3      GLU  46 -14.150  13.371  -5.577

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LYS  47           H        LYS  47 -17.806  10.240  -6.573
    2    HA   LYS  47           HA       LYS  47 -18.912  10.478  -9.245
    3    HB2  LYS  47           HB2      LYS  47 -18.386   8.077  -7.483
    4    HB3  LYS  47           HB3      LYS  47 -18.963   7.994  -9.148
    5    HG2  LYS  47           HG2      LYS  47 -16.384   9.327  -8.411
    6    HG3  LYS  47           HG3      LYS  47 -16.494   7.604  -8.764
    7    HD2  LYS  47           HD2      LYS  47 -17.484   8.130 -10.952
    8    HD3  LYS  47           HD3      LYS  47 -17.317   9.849 -10.599
    9    HE2  LYS  47           HE2      LYS  47 -14.899   9.596 -10.452
   10    HE3  LYS  47           HE3      LYS  47 -15.053   7.868 -10.764
   11    HZ1  LYS  47           HZ1      LYS  47 -16.225   9.767 -12.659
   12    HZ3  LYS  47           HZ2      LYS  47 -15.603   8.210 -12.930
   13    HZ2  LYS  47           HZ3      LYS  47 -14.546   9.517 -12.682

  No H/Q in entry =          13
  In of MODEL   15
    1    H    GLY  48           H        GLY  48 -20.235   9.753  -6.089
    2    HA3  GLY  48           HA2      GLY  48 -22.647   8.615  -6.817
    3    HA2  GLY  48           HA3      GLY  48 -22.395   9.607  -5.381

  No H/Q in entry =           3
  In of MODEL   15
    1    H    GLN  49           H        GLN  49 -21.770  12.014  -6.958
    2    HA   GLN  49           HA       GLN  49 -24.307  13.178  -7.094
    3    HB2  GLN  49           HB2      GLN  49 -21.752  13.988  -8.467
    4    HB3  GLN  49           HB3      GLN  49 -23.194  14.982  -8.378
    5    HG2  GLN  49           HG2      GLN  49 -23.023  15.007  -5.942
    6    HG3  GLN  49           HG3      GLN  49 -21.594  13.991  -6.029
    7   HE21  GLN  49          HE21      GLN  49 -21.426  16.219  -4.761
    8   HE22  GLN  49          HE22      GLN  49 -20.480  17.456  -5.415

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ASN  50           H        ASN  50 -22.677  11.260  -9.485
    2    HA   ASN  50           HA       ASN  50 -24.551  12.168 -11.560
    3    HB2  ASN  50           HB2      ASN  50 -22.005  10.573 -11.802
    4    HB3  ASN  50           HB3      ASN  50 -23.052  11.019 -13.142
    5   HD21  ASN  50          HD21      ASN  50 -20.392  11.813 -11.544
    6   HD22  ASN  50          HD22      ASN  50 -20.126  13.443 -11.891

  No H/Q in entry =           6
  In of MODEL   15
    1    H    ALA  51           H        ALA  51 -24.576   9.816  -9.310
    2    HA   ALA  51           HA       ALA  51 -25.413   7.684 -11.129
    3    HB2  ALA  51           HB1      ALA  51 -24.851   6.325  -9.443
    4    HB3  ALA  51           HB2      ALA  51 -25.951   7.159  -8.345
    5    HB1  ALA  51           HB3      ALA  51 -24.300   7.745  -8.552

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ASP  52           H        ASP  52 -27.439   6.671 -10.978
    2    HA   ASP  52           HA       ASP  52 -29.579   8.552 -10.306
    3    HB2  ASP  52           HB2      ASP  52 -29.449   6.040 -11.971
    4    HB3  ASP  52           HB3      ASP  52 -30.975   6.807 -11.532

  No H/Q in entry =           4
  In of MODEL   15
    1    H    VAL  53           H        VAL  53 -28.036   5.631  -9.292
    2    HA   VAL  53           HA       VAL  53 -29.460   5.793  -6.769
    3    HB   VAL  53           HB       VAL  53 -30.901   4.180  -8.003
    4   HG11  VAL  53          HG11      VAL  53 -29.180   3.280  -9.532
    5   HG13  VAL  53          HG12      VAL  53 -30.037   2.005  -8.667
    6   HG12  VAL  53          HG13      VAL  53 -28.414   2.473  -8.165
    7   HG23  VAL  53          HG21      VAL  53 -30.114   2.188  -6.312
    8   HG22  VAL  53          HG22      VAL  53 -31.213   3.518  -5.942
    9   HG21  VAL  53          HG23      VAL  53 -29.501   3.654  -5.543

  No H/Q in entry =           9
  In of MODEL   15
    1    H    VAL  54           H        VAL  54 -28.150   5.335  -5.120
    2    HA   VAL  54           HA       VAL  54 -25.412   4.424  -5.742
    3    HB   VAL  54           HB       VAL  54 -26.433   6.229  -3.490
    4   HG11  VAL  54          HG11      VAL  54 -23.888   4.752  -3.790
    5   HG13  VAL  54          HG12      VAL  54 -24.618   5.451  -2.346
    6   HG12  VAL  54          HG13      VAL  54 -23.695   6.473  -3.449
    7   HG22  VAL  54          HG21      VAL  54 -25.538   8.022  -4.597
    8   HG21  VAL  54          HG22      VAL  54 -26.114   7.042  -5.945
    9   HG23  VAL  54          HG23      VAL  54 -24.405   7.030  -5.515

  No H/Q in entry =           9
  In of MODEL   15
    1    H    LEU  55           H        LEU  55 -24.860   2.491  -5.098
    2    HA   LEU  55           HA       LEU  55 -26.387   1.218  -2.913
    3    HB2  LEU  55           HB2      LEU  55 -24.867   0.011  -5.214
    4    HB3  LEU  55           HB3      LEU  55 -25.643  -0.904  -3.919
    5    HG   LEU  55           HG       LEU  55 -27.054   0.712  -6.033
    6   HD13  LEU  55          HD11      LEU  55 -26.801  -1.149  -7.250
    7   HD12  LEU  55          HD12      LEU  55 -27.772  -2.000  -6.050
    8   HD11  LEU  55          HD13      LEU  55 -26.015  -1.975  -5.907
    9   HD23  LEU  55          HD21      LEU  55 -28.383  -1.201  -4.168
   10   HD22  LEU  55          HD22      LEU  55 -29.050   0.195  -5.016
   11   HD21  LEU  55          HD23      LEU  55 -28.019   0.430  -3.605

  No H/Q in entry =          11
  In of MODEL   15
    1    H    LEU  56           H        LEU  56 -25.241   0.602  -1.112
    2    HA   LEU  56           HA       LEU  56 -22.299   0.930  -1.176
    3    HB2  LEU  56           HB2      LEU  56 -24.095   0.764   1.231
    4    HB3  LEU  56           HB3      LEU  56 -22.376   1.155   1.212
    5    HG   LEU  56           HG       LEU  56 -24.641   2.883   0.255
    6   HD11  LEU  56          HD11      LEU  56 -23.523   2.482   2.771
    7   HD13  LEU  56          HD12      LEU  56 -24.484   3.871   2.268
    8   HD12  LEU  56          HD13      LEU  56 -22.726   3.936   2.172
    9   HD23  LEU  56          HD21      LEU  56 -22.658   4.537   0.050
   10   HD22  LEU  56          HD22      LEU  56 -23.073   3.447  -1.274
   11   HD21  LEU  56          HD23      LEU  56 -21.722   3.065  -0.206

  No H/Q in entry =          11
  In of MODEL   15
    1    H    GLY  57           H        GLY  57 -20.954  -0.730  -0.646
    2    HA3  GLY  57           HA2      GLY  57 -21.935  -3.395  -0.833
    3    HA2  GLY  57           HA3      GLY  57 -20.301  -2.936  -0.357

  No H/Q in entry =           3
  In of MODEL   15
    1    HA   PRO  58           HA       PRO  58 -23.117  -3.904   3.364
    2    HB2  PRO  58           HB2      PRO  58 -22.489  -6.522   3.971
    3    HB3  PRO  58           HB3      PRO  58 -23.869  -6.085   2.964
    4    HG2  PRO  58           HG2      PRO  58 -21.165  -7.030   2.168
    5    HG3  PRO  58           HG3      PRO  58 -22.744  -7.454   1.504
    6    HD2  PRO  58           HD2      PRO  58 -21.100  -5.677   0.270
    7    HD3  PRO  58           HD3      PRO  58 -22.856  -5.550   0.176

  No H/Q in entry =           7
  In of MODEL   15
    1    H    GLN  59           H        GLN  59 -19.760  -4.455   2.742
    2    HA   GLN  59           HA       GLN  59 -18.994  -4.484   5.500
    3    HB2  GLN  59           HB2      GLN  59 -17.372  -3.627   3.098
    4    HB3  GLN  59           HB3      GLN  59 -16.741  -3.956   4.699
    5    HG2  GLN  59           HG2      GLN  59 -18.073  -5.961   2.885
    6    HG3  GLN  59           HG3      GLN  59 -16.342  -5.800   3.137
    7   HE21  GLN  59          HE21      GLN  59 -18.641  -7.536   3.849
    8   HE22  GLN  59          HE22      GLN  59 -18.491  -8.336   5.299

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ILE  60           H        ILE  60 -19.878  -1.917   3.290
    2    HA   ILE  60           HA       ILE  60 -18.972   0.024   5.328
    3    HB   ILE  60           HB       ILE  60 -19.172   1.755   3.500
    4   HG12  ILE  60          HG12      ILE  60 -19.031  -0.469   1.511
    5   HG13  ILE  60          HG13      ILE  60 -20.606   0.086   2.077
    6   HG22  ILE  60          HG21      ILE  60 -17.207  -0.309   2.650
    7   HG21  ILE  60          HG22      ILE  60 -17.074   0.458   4.231
    8   HG23  ILE  60          HG23      ILE  60 -17.026   1.441   2.769
    9   HD12  ILE  60          HD11      ILE  60 -18.552   1.560   0.461
   10   HD11  ILE  60          HD12      ILE  60 -19.716   2.454   1.437
   11   HD13  ILE  60          HD13      ILE  60 -20.280   1.374   0.163

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ALA  61           H        ALA  61 -21.463  -1.504   5.411
    2    HA   ALA  61           HA       ALA  61 -23.652   0.210   4.959
    3    HB1  ALA  61           HB1      ALA  61 -24.896  -1.248   6.293
    4    HB2  ALA  61           HB2      ALA  61 -23.502  -1.668   7.291
    5    HB3  ALA  61           HB3      ALA  61 -23.620  -2.275   5.639

  No H/Q in entry =           5
  In of MODEL   15
    1    H    TYR  62           H        TYR  62 -21.434   0.053   7.747
    2    HA   TYR  62           HA       TYR  62 -22.943   1.749   9.421
    3    HB2  TYR  62           HB2      TYR  62 -20.890   2.126  10.647
    4    HB3  TYR  62           HB3      TYR  62 -20.985   0.428  10.181
    5    HD1  TYR  62           HD1      TYR  62 -19.467  -0.480   8.440
    6    HD2  TYR  62           HD2      TYR  62 -19.115   3.559   9.790
    7    HE1  TYR  62           HE1      TYR  62 -17.255  -0.317   7.364
    8    HE2  TYR  62           HE2      TYR  62 -16.889   3.715   8.715
    9    HH   TYR  62           HH       TYR  62 -15.866   2.015   6.451

  No H/Q in entry =           9
  In of MODEL   15
    1    H    MET  63           H        MET  63 -21.295   2.564   6.555
    2    HA   MET  63           HA       MET  63 -21.057   5.393   7.243
    3    HB2  MET  63           HB2      MET  63 -20.498   3.849   4.710
    4    HB3  MET  63           HB3      MET  63 -20.265   5.591   4.883
    5    HG2  MET  63           HG2      MET  63 -18.547   5.223   6.541
    6    HG3  MET  63           HG3      MET  63 -18.808   3.482   6.453
    7    HE3  MET  63           HE1      MET  63 -18.217   6.074   3.016
    8    HE2  MET  63           HE2      MET  63 -16.701   6.331   3.881
    9    HE1  MET  63           HE3      MET  63 -18.240   6.587   4.706

  No H/Q in entry =           9
  In of MODEL   15
    1    H    LEU  64           H        LEU  64 -23.669   3.598   6.294
    2    HA   LEU  64           HA       LEU  64 -24.855   5.040   4.218
    3    HB2  LEU  64           HB2      LEU  64 -25.769   2.958   5.145
    4    HB3  LEU  64           HB3      LEU  64 -26.199   3.814   6.625
    5    HG   LEU  64           HG       LEU  64 -27.869   5.106   5.403
    6   HD13  LEU  64          HD11      LEU  64 -27.591   5.336   3.168
    7   HD12  LEU  64          HD12      LEU  64 -28.276   3.717   3.029
    8   HD11  LEU  64          HD13      LEU  64 -26.528   3.934   3.078
    9   HD23  LEU  64          HD21      LEU  64 -28.458   2.306   4.663
   10   HD22  LEU  64          HD22      LEU  64 -29.415   3.465   5.586
   11   HD21  LEU  64          HD23      LEU  64 -28.056   2.641   6.347

  No H/Q in entry =          11
  In of MODEL   15
    1    HA   PRO  65           HA       PRO  65 -26.944   8.253   6.974
    2    HB2  PRO  65           HB2      PRO  65 -24.928   8.367   9.218
    3    HB3  PRO  65           HB3      PRO  65 -26.660   8.690   9.271
    4    HG2  PRO  65           HG2      PRO  65 -25.782   6.415  10.198
    5    HG3  PRO  65           HG3      PRO  65 -27.207   6.415   9.160
    6    HD2  PRO  65           HD2      PRO  65 -24.355   5.728   8.444
    7    HD3  PRO  65           HD3      PRO  65 -25.836   4.878   8.006

  No H/Q in entry =           7
  In of MODEL   15
    1    H    GLU  66           H        GLU  66 -23.390   8.108   7.029
    2    HA   GLU  66           HA       GLU  66 -23.025  10.898   6.617
    3    HB2  GLU  66           HB2      GLU  66 -21.274   8.545   5.961
    4    HB3  GLU  66           HB3      GLU  66 -20.783  10.225   5.748
    5    HG2  GLU  66           HG2      GLU  66 -20.973  10.605   8.115
    6    HG3  GLU  66           HG3      GLU  66 -21.539   8.952   8.353

  No H/Q in entry =           6
  In of MODEL   15
    1    H    ILE  67           H        ILE  67 -23.208   8.152   4.371
    2    HA   ILE  67           HA       ILE  67 -22.760   9.844   2.072
    3    HB   ILE  67           HB       ILE  67 -23.731   6.961   2.262
    4   HG12  ILE  67          HG12      ILE  67 -21.077   8.061   1.325
    5   HG13  ILE  67          HG13      ILE  67 -21.374   7.652   3.013
    6   HG21  ILE  67          HG21      ILE  67 -23.637   8.833   0.033
    7   HG23  ILE  67          HG22      ILE  67 -24.304   7.201   0.091
    8   HG22  ILE  67          HG23      ILE  67 -22.591   7.441  -0.247
    9   HD12  ILE  67          HD11      ILE  67 -21.012   5.866   0.666
   10   HD11  ILE  67          HD12      ILE  67 -22.033   5.322   1.994
   11   HD13  ILE  67          HD13      ILE  67 -20.348   5.744   2.295

  No H/Q in entry =          11
  In of MODEL   15
    1    H    GLN  68           H        GLN  68 -25.647   8.868   3.722
    2    HA   GLN  68           HA       GLN  68 -27.462   9.843   1.756
    3    HB2  GLN  68           HB2      GLN  68 -27.711   9.498   4.740
    4    HB3  GLN  68           HB3      GLN  68 -29.020  10.126   3.753
    5    HG2  GLN  68           HG2      GLN  68 -29.108   8.095   2.482
    6    HG3  GLN  68           HG3      GLN  68 -27.671   7.481   3.278
    7   HE21  GLN  68          HE21      GLN  68 -29.886   6.182   3.157
    8   HE22  GLN  68          HE22      GLN  68 -30.720   5.751   4.576

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ARG  69           H        ARG  69 -25.797  11.471   4.482
    2    HA   ARG  69           HA       ARG  69 -27.096  13.988   4.077
    3    HB2  ARG  69           HB2      ARG  69 -24.769  12.998   5.656
    4    HB3  ARG  69           HB3      ARG  69 -24.802  14.718   5.294
    5    HG2  ARG  69           HG2      ARG  69 -27.112  14.827   6.278
    6    HG3  ARG  69           HG3      ARG  69 -26.947  13.133   6.754
    7    HD2  ARG  69           HD2      ARG  69 -25.185  15.441   7.654
    8    HD3  ARG  69           HD3      ARG  69 -26.334  14.570   8.656
    9    HE   ARG  69           HE       ARG  69 -23.755  13.564   7.694
   10   HH21  ARG  69          HH11      ARG  69 -22.989  11.782   8.890
   11   HH22  ARG  69          HH12      ARG  69 -24.033  10.996  10.025
   12   HH11  ARG  69          HH21      ARG  69 -26.716  13.102   9.409
   13   HH12  ARG  69          HH22      ARG  69 -26.144  11.742  10.317

  No H/Q in entry =          13
  In of MODEL   15
    1    H    LEU  70           H        LEU  70 -24.272  12.500   2.705
    2    HA   LEU  70           HA       LEU  70 -23.100  14.831   1.526
    3    HB2  LEU  70           HB2      LEU  70 -22.167  12.488   2.120
    4    HB3  LEU  70           HB3      LEU  70 -22.804  12.036   0.539
    5    HG   LEU  70           HG       LEU  70 -21.178  13.361  -0.557
    6   HD11  LEU  70          HD11      LEU  70 -20.317  14.187   2.225
    7   HD13  LEU  70          HD12      LEU  70 -20.990  15.238   0.978
    8   HD12  LEU  70          HD13      LEU  70 -19.399  14.510   0.751
    9   HD22  LEU  70          HD21      LEU  70 -19.793  11.606  -0.329
   10   HD21  LEU  70          HD22      LEU  70 -20.726  11.112   1.083
   11   HD23  LEU  70          HD23      LEU  70 -19.309  12.144   1.279

  No H/Q in entry =          11
  In of MODEL   15
    1    H    LEU  71           H        LEU  71 -25.330  12.349   0.428
    2    HA   LEU  71           HA       LEU  71 -25.826  13.846  -2.088
    3    HB2  LEU  71           HB2      LEU  71 -26.116  10.871  -1.636
    4    HB3  LEU  71           HB3      LEU  71 -26.228  11.731  -3.169
    5    HG   LEU  71           HG       LEU  71 -23.700  11.673  -1.522
    6   HD12  LEU  71          HD11      LEU  71 -23.813  10.043  -3.951
    7   HD11  LEU  71          HD12      LEU  71 -24.835   9.452  -2.641
    8   HD13  LEU  71          HD13      LEU  71 -23.106   9.681  -2.377
    9   HD22  LEU  71          HD21      LEU  71 -23.757  13.489  -3.019
   10   HD21  LEU  71          HD22      LEU  71 -24.293  12.459  -4.346
   11   HD23  LEU  71          HD23      LEU  71 -22.673  12.266  -3.678

  No H/Q in entry =          11
  In of MODEL   15
    1    HA   PRO  72           HA       PRO  72 -29.689  13.518   0.555
    2    HB2  PRO  72           HB2      PRO  72 -30.470  16.103   0.473
    3    HB3  PRO  72           HB3      PRO  72 -29.168  15.614   1.558
    4    HG2  PRO  72           HG2      PRO  72 -28.962  16.797  -1.199
    5    HG3  PRO  72           HG3      PRO  72 -28.170  17.328   0.285
    6    HD2  PRO  72           HD2      PRO  72 -26.891  15.726  -1.486
    7    HD3  PRO  72           HD3      PRO  72 -26.632  15.554   0.249

  No H/Q in entry =           7
  In of MODEL   15
    1    H    ASN  73           H        ASN  73 -29.055  14.447  -2.665
    2    HA   ASN  73           HA       ASN  73 -31.926  14.226  -3.281
    3    HB2  ASN  73           HB2      ASN  73 -31.438  15.314  -5.383
    4    HB3  ASN  73           HB3      ASN  73 -30.878  16.279  -4.026
    5   HD21  ASN  73          HD21      ASN  73 -30.096  16.295  -6.708
    6   HD22  ASN  73          HD22      ASN  73 -28.436  16.082  -6.909

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LYS  74           H        LYS  74 -30.015  11.911  -2.863
    2    HA   LYS  74           HA       LYS  74 -30.641  10.530  -5.405
    3    HB2  LYS  74           HB2      LYS  74 -28.110  10.161  -3.798
    4    HB3  LYS  74           HB3      LYS  74 -28.527   9.359  -5.311
    5    HG2  LYS  74           HG2      LYS  74 -28.167  12.319  -5.116
    6    HG3  LYS  74           HG3      LYS  74 -26.829  11.212  -5.426
    7    HD2  LYS  74           HD2      LYS  74 -27.986  10.317  -7.361
    8    HD3  LYS  74           HD3      LYS  74 -29.372  11.360  -7.036
    9    HE2  LYS  74           HE2      LYS  74 -28.085  13.325  -7.489
   10    HE3  LYS  74           HE3      LYS  74 -26.594  12.387  -7.587
   11    HZ2  LYS  74           HZ1      LYS  74 -28.057  13.032  -9.705
   12    HZ1  LYS  74           HZ2      LYS  74 -28.757  11.532  -9.326
   13    HZ3  LYS  74           HZ3      LYS  74 -27.090  11.638  -9.632

  No H/Q in entry =          13
  In of MODEL   15
    1    HA   PRO  75           HA       PRO  75 -32.114   7.597  -2.419
    2    HB2  PRO  75           HB2      PRO  75 -32.505   5.387  -3.996
    3    HB3  PRO  75           HB3      PRO  75 -33.586   6.778  -4.062
    4    HG2  PRO  75           HG2      PRO  75 -31.280   6.102  -5.844
    5    HG3  PRO  75           HG3      PRO  75 -32.916   6.591  -6.283
    6    HD2  PRO  75           HD2      PRO  75 -30.914   8.392  -6.254
    7    HD3  PRO  75           HD3      PRO  75 -32.529   8.846  -5.708

  No H/Q in entry =           7
  In of MODEL   15
    1    H    VAL  76           H        VAL  76 -30.689   6.498  -1.053
    2    HA   VAL  76           HA       VAL  76 -28.271   5.206  -2.171
    3    HB   VAL  76           HB       VAL  76 -28.496   6.686   0.486
    4   HG11  VAL  76          HG11      VAL  76 -26.191   5.320  -0.917
    5   HG13  VAL  76          HG12      VAL  76 -26.893   4.896   0.646
    6   HG12  VAL  76          HG13      VAL  76 -25.998   6.404   0.462
    7   HG22  VAL  76          HG21      VAL  76 -27.771   8.562  -0.410
    8   HG21  VAL  76          HG22      VAL  76 -28.345   7.882  -1.933
    9   HG23  VAL  76          HG23      VAL  76 -26.644   7.739  -1.487

  No H/Q in entry =           9
  In of MODEL   15
    1    H    GLU  77           H        GLU  77 -28.122   3.047  -1.554
    2    HA   GLU  77           HA       GLU  77 -28.919   2.291   1.106
    3    HB2  GLU  77           HB2      GLU  77 -30.582   0.696   0.587
    4    HB3  GLU  77           HB3      GLU  77 -31.085   2.235  -0.115
    5    HG2  GLU  77           HG2      GLU  77 -30.512   1.453  -2.304
    6    HG3  GLU  77           HG3      GLU  77 -29.917  -0.062  -1.632

  No H/Q in entry =           6
  In of MODEL   15
    1    H    VAL  78           H        VAL  78 -28.657   0.196   1.768
    2    HA   VAL  78           HA       VAL  78 -26.022  -0.664   0.868
    3    HB   VAL  78           HB       VAL  78 -27.745  -1.486   3.245
    4   HG11  VAL  78          HG11      VAL  78 -25.452  -2.793   2.110
    5   HG13  VAL  78          HG12      VAL  78 -26.368  -3.231   3.554
    6   HG12  VAL  78          HG13      VAL  78 -25.010  -2.112   3.676
    7   HG22  VAL  78          HG21      VAL  78 -26.235  -0.169   4.572
    8   HG21  VAL  78          HG22      VAL  78 -26.946   0.822   3.298
    9   HG23  VAL  78          HG23      VAL  78 -25.288   0.240   3.141

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ILE  79           H        ILE  79 -25.551  -2.590  -0.036
    2    HA   ILE  79           HA       ILE  79 -27.666  -4.003  -1.369
    3    HB   ILE  79           HB       ILE  79 -24.693  -4.625  -1.162
    4   HG12  ILE  79          HG12      ILE  79 -26.305  -3.475  -3.444
    5   HG13  ILE  79          HG13      ILE  79 -25.392  -2.491  -2.299
    6   HG22  ILE  79          HG21      ILE  79 -25.845  -5.774  -3.473
    7   HG21  ILE  79          HG22      ILE  79 -26.839  -6.260  -2.099
    8   HG23  ILE  79          HG23      ILE  79 -25.107  -6.596  -2.097
    9   HD13  ILE  79          HD11      ILE  79 -23.992  -2.654  -4.124
   10   HD12  ILE  79          HD12      ILE  79 -24.388  -4.351  -4.398
   11   HD11  ILE  79          HD13      ILE  79 -23.382  -3.892  -3.025

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ASP  80           H        ASP  80 -28.590  -5.896  -0.776
    2    HA   ASP  80           HA       ASP  80 -28.551  -6.791   1.872
    3    HB2  ASP  80           HB2      ASP  80 -30.331  -7.314   0.243
    4    HB3  ASP  80           HB3      ASP  80 -29.211  -8.360  -0.629

  No H/Q in entry =           4
  In of MODEL   15
    1    H    SER  81           H        SER  81 -27.047  -7.972   2.997
    2    HA   SER  81           HA       SER  81 -24.580  -8.737   1.795
    3    HB2  SER  81           HB2      SER  81 -24.044  -9.769   3.962
    4    HB3  SER  81           HB3      SER  81 -24.709  -8.151   4.180
    5    HG   SER  81           HG       SER  81 -26.340  -8.955   5.181

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU  82           H        LEU  82 -27.355 -10.739   2.136
    2    HA   LEU  82           HA       LEU  82 -25.888 -13.158   1.614
    3    HB2  LEU  82           HB2      LEU  82 -28.804 -12.447   1.373
    4    HB3  LEU  82           HB3      LEU  82 -28.154 -14.071   1.161
    5    HG   LEU  82           HG       LEU  82 -28.021 -12.493   3.712
    6   HD11  LEU  82          HD11      LEU  82 -29.851 -14.736   2.821
    7   HD13  LEU  82          HD12      LEU  82 -30.326 -13.074   3.181
    8   HD12  LEU  82          HD13      LEU  82 -29.738 -14.124   4.472
    9   HD21  LEU  82          HD21      LEU  82 -27.167 -15.229   2.807
   10   HD23  LEU  82          HD22      LEU  82 -27.505 -14.897   4.505
   11   HD22  LEU  82          HD23      LEU  82 -26.230 -14.009   3.671

  No H/Q in entry =          11
  In of MODEL   15
    1    H    LEU  83           H        LEU  83 -27.783 -10.875  -0.301
    2    HA   LEU  83           HA       LEU  83 -27.639 -12.246  -2.769
    3    HB2  LEU  83           HB2      LEU  83 -27.951  -9.325  -2.128
    4    HB3  LEU  83           HB3      LEU  83 -28.013  -9.973  -3.766
    5    HG   LEU  83           HG       LEU  83 -30.046 -10.288  -1.579
    6   HD13  LEU  83          HD11      LEU  83 -30.748  -8.419  -2.644
    7   HD12  LEU  83          HD12      LEU  83 -31.253  -9.521  -3.923
    8   HD11  LEU  83          HD13      LEU  83 -29.692  -8.705  -4.026
    9   HD23  LEU  83          HD21      LEU  83 -30.240 -11.548  -4.299
   10   HD22  LEU  83          HD22      LEU  83 -31.213 -11.862  -2.863
   11   HD21  LEU  83          HD23      LEU  83 -29.542 -12.420  -2.935

  No H/Q in entry =          11
  In of MODEL   15
    1    H    TYR  84           H        TYR  84 -25.601  -9.920  -1.110
    2    HA   TYR  84           HA       TYR  84 -23.735  -9.500  -3.252
    3    HB2  TYR  84           HB2      TYR  84 -24.194  -7.992  -1.232
    4    HB3  TYR  84           HB3      TYR  84 -23.206  -9.122  -0.308
    5    HD1  TYR  84           HD1      TYR  84 -20.842  -9.024  -0.383
    6    HD2  TYR  84           HD2      TYR  84 -23.144  -6.749  -3.170
    7    HE1  TYR  84           HE1      TYR  84 -18.787  -7.863  -1.114
    8    HE2  TYR  84           HE2      TYR  84 -21.096  -5.589  -3.919
    9    HH   TYR  84           HH       TYR  84 -18.081  -6.656  -3.368

  No H/Q in entry =           9
  In of MODEL   15
    1    H    GLY  85           H        GLY  85 -23.545 -11.500  -0.301
    2    HA3  GLY  85           HA2      GLY  85 -21.002 -12.529  -0.794
    3    HA2  GLY  85           HA3      GLY  85 -22.254 -13.332   0.152

  No H/Q in entry =           3
  In of MODEL   15
    1    H    LYS  86           H        LYS  86 -24.123 -13.651  -1.898
    2    HA   LYS  86           HA       LYS  86 -23.154 -16.061  -3.155
    3    HB2  LYS  86           HB2      LYS  86 -25.752 -14.530  -3.243
    4    HB3  LYS  86           HB3      LYS  86 -25.500 -16.096  -4.013
    5    HG2  LYS  86           HG2      LYS  86 -25.217 -17.139  -1.876
    6    HG3  LYS  86           HG3      LYS  86 -25.350 -15.576  -1.067
    7    HD2  LYS  86           HD2      LYS  86 -27.524 -16.505  -0.963
    8    HD3  LYS  86           HD3      LYS  86 -27.588 -15.321  -2.267
    9    HE2  LYS  86           HE2      LYS  86 -27.558 -16.976  -3.924
   10    HE3  LYS  86           HE3      LYS  86 -26.986 -18.211  -2.802
   11    HZ1  LYS  86           HZ1      LYS  86 -29.142 -17.870  -1.581
   12    HZ3  LYS  86           HZ2      LYS  86 -29.277 -18.600  -3.110
   13    HZ2  LYS  86           HZ3      LYS  86 -29.672 -16.960  -2.914

  No H/Q in entry =          13
  In of MODEL   15
    1    H    VAL  87           H        VAL  87 -23.043 -12.851  -4.058
    2    HA   VAL  87           HA       VAL  87 -22.717 -11.694  -6.005
    3    HB   VAL  87           HB       VAL  87 -21.755 -14.201  -7.390
    4   HG12  VAL  87          HG11      VAL  87 -20.338 -11.559  -7.259
    5   HG11  VAL  87          HG12      VAL  87 -21.778 -11.714  -8.267
    6   HG13  VAL  87          HG13      VAL  87 -20.375 -12.738  -8.569
    7   HG22  VAL  87          HG21      VAL  87 -19.618 -14.104  -6.284
    8   HG21  VAL  87          HG22      VAL  87 -20.885 -14.345  -5.084
    9   HG23  VAL  87          HG23      VAL  87 -20.155 -12.754  -5.287

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ASP  88           H        ASP  88 -25.250 -12.253  -5.638
    2    HA   ASP  88           HA       ASP  88 -26.423 -13.440  -8.025
    3    HB2  ASP  88           HB2      ASP  88 -27.413 -13.645  -5.695
    4    HB3  ASP  88           HB3      ASP  88 -27.812 -11.931  -5.797

  No H/Q in entry =           4
  In of MODEL   15
    1    H    GLY  89           H        GLY  89 -25.688 -12.211  -9.675
    2    HA3  GLY  89           HA2      GLY  89 -25.782  -9.434  -9.883
    3    HA2  GLY  89           HA3      GLY  89 -25.801 -10.559 -11.241

  No H/Q in entry =           3
  In of MODEL   15
    1    H    LEU  90           H        LEU  90 -28.288 -11.831 -10.774
    2    HA   LEU  90           HA       LEU  90 -30.042  -9.843 -11.883
    3    HB2  LEU  90           HB2      LEU  90 -30.187 -12.237 -12.455
    4    HB3  LEU  90           HB3      LEU  90 -30.694 -12.582 -10.802
    5    HG   LEU  90           HG       LEU  90 -32.778 -11.399 -11.156
    6   HD13  LEU  90          HD11      LEU  90 -32.552  -9.669 -12.638
    7   HD12  LEU  90          HD12      LEU  90 -33.138 -10.893 -13.768
    8   HD11  LEU  90          HD13      LEU  90 -31.411 -10.552 -13.656
    9   HD23  LEU  90          HD21      LEU  90 -32.775 -13.038 -13.587
   10   HD22  LEU  90          HD22      LEU  90 -33.751 -13.167 -12.123
   11   HD21  LEU  90          HD23      LEU  90 -32.118 -13.831 -12.155

  No H/Q in entry =          11
  In of MODEL   15
    1    H    GLY  91           H        GLY  91 -29.902 -11.338  -8.695
    2    HA3  GLY  91           HA2      GLY  91 -32.199 -10.148  -7.645
    3    HA2  GLY  91           HA3      GLY  91 -30.819 -10.722  -6.709

  No H/Q in entry =           3
  In of MODEL   15
    1    H    VAL  92           H        VAL  92 -28.849  -8.960  -7.583
    2    HA   VAL  92           HA       VAL  92 -29.558  -6.630  -6.037
    3    HB   VAL  92           HB       VAL  92 -27.037  -7.185  -7.647
    4   HG12  VAL  92          HG11      VAL  92 -27.128  -5.288  -5.325
    5   HG11  VAL  92          HG12      VAL  92 -27.785  -4.729  -6.865
    6   HG13  VAL  92          HG13      VAL  92 -26.104  -5.249  -6.761
    7   HG22  VAL  92          HG21      VAL  92 -26.855  -8.773  -6.051
    8   HG21  VAL  92          HG22      VAL  92 -27.968  -7.954  -4.953
    9   HG23  VAL  92          HG23      VAL  92 -26.297  -7.407  -5.086

  No H/Q in entry =           9
  In of MODEL   15
    1    H    LEU  93           H        LEU  93 -29.193  -7.315  -9.458
    2    HA   LEU  93           HA       LEU  93 -29.461  -4.673 -10.394
    3    HB2  LEU  93           HB2      LEU  93 -28.886  -6.552 -11.854
    4    HB3  LEU  93           HB3      LEU  93 -30.498  -7.228 -11.618
    5    HG   LEU  93           HG       LEU  93 -31.455  -5.238 -12.744
    6   HD11  LEU  93          HD11      LEU  93 -29.551  -3.700 -12.256
    7   HD13  LEU  93          HD12      LEU  93 -30.002  -3.722 -13.962
    8   HD12  LEU  93          HD13      LEU  93 -28.574  -4.600 -13.416
    9   HD23  LEU  93          HD21      LEU  93 -30.448  -5.845 -15.035
   10   HD22  LEU  93          HD22      LEU  93 -31.324  -7.072 -14.119
   11   HD21  LEU  93          HD23      LEU  93 -29.559  -7.072 -14.133

  No H/Q in entry =          11
  In of MODEL   15
    1    H    LYS  94           H        LYS  94 -31.909  -7.141  -9.522
    2    HA   LYS  94           HA       LYS  94 -34.211  -5.628 -10.137
    3    HB2  LYS  94           HB2      LYS  94 -33.754  -7.821  -8.121
    4    HB3  LYS  94           HB3      LYS  94 -35.330  -7.077  -8.381
    5    HG2  LYS  94           HG2      LYS  94 -35.282  -7.863 -10.713
    6    HG3  LYS  94           HG3      LYS  94 -33.744  -8.661 -10.392
    7    HD2  LYS  94           HD2      LYS  94 -34.894  -9.953  -8.556
    8    HD3  LYS  94           HD3      LYS  94 -36.420  -9.259  -9.104
    9    HE2  LYS  94           HE2      LYS  94 -35.948 -10.212 -11.370
   10    HE3  LYS  94           HE3      LYS  94 -34.554 -11.037 -10.673
   11    HZ3  LYS  94           HZ1      LYS  94 -36.452 -12.500 -10.826
   12    HZ2  LYS  94           HZ2      LYS  94 -37.387 -11.440  -9.882
   13    HZ1  LYS  94           HZ3      LYS  94 -36.047 -12.229  -9.200

  No H/Q in entry =          13
  In of MODEL   15
    1    H    ALA  95           H        ALA  95 -32.373  -5.796  -7.100
    2    HA   ALA  95           HA       ALA  95 -34.162  -4.154  -5.614
    3    HB2  ALA  95           HB1      ALA  95 -31.828  -5.602  -5.087
    4    HB3  ALA  95           HB2      ALA  95 -32.770  -4.663  -3.931
    5    HB1  ALA  95           HB3      ALA  95 -31.403  -3.921  -4.762

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA  96           H        ALA  96 -31.508  -3.391  -7.730
    2    HA   ALA  96           HA       ALA  96 -31.319  -0.632  -6.966
    3    HB2  ALA  96           HB1      ALA  96 -29.964  -0.455  -9.085
    4    HB3  ALA  96           HB2      ALA  96 -30.324  -2.153  -9.397
    5    HB1  ALA  96           HB3      ALA  96 -29.386  -1.698  -7.975

  No H/Q in entry =           5
  In of MODEL   15
    1    H    VAL  97           H        VAL  97 -32.922  -2.304  -9.638
    2    HA   VAL  97           HA       VAL  97 -33.925   0.025 -10.894
    3    HB   VAL  97           HB       VAL  97 -34.829  -2.873 -10.921
    4   HG11  VAL  97          HG11      VAL  97 -36.559  -0.812 -11.403
    5   HG13  VAL  97          HG12      VAL  97 -36.674  -2.404 -12.154
    6   HG12  VAL  97          HG13      VAL  97 -35.883  -1.082 -13.010
    7   HG21  VAL  97          HG21      VAL  97 -33.505  -1.094 -12.970
    8   HG23  VAL  97          HG22      VAL  97 -34.013  -2.759 -13.252
    9   HG22  VAL  97          HG23      VAL  97 -32.745  -2.410 -12.075

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ALA  98           H        ALA  98 -35.163  -2.107  -8.343
    2    HA   ALA  98           HA       ALA  98 -37.682  -0.873  -7.979
    3    HB1  ALA  98           HB1      ALA  98 -36.735  -3.102  -6.946
    4    HB3  ALA  98           HB2      ALA  98 -37.878  -2.137  -6.010
    5    HB2  ALA  98           HB3      ALA  98 -36.151  -2.044  -5.663

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA  99           H        ALA  99 -34.568  -0.173  -6.354
    2    HA   ALA  99           HA       ALA  99 -35.619   1.852  -4.691
    3    HB1  ALA  99           HB1      ALA  99 -33.007   0.872  -5.453
    4    HB2  ALA  99           HB2      ALA  99 -33.522   1.645  -3.952
    5    HB3  ALA  99           HB3      ALA  99 -33.022   2.631  -5.325

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ILE 100           H        ILE 100 -34.596   1.939  -8.054
    2    HA   ILE 100           HA       ILE 100 -34.680   4.791  -8.279
    3    HB   ILE 100           HB       ILE 100 -34.862   2.636 -10.412
    4   HG12  ILE 100          HG12      ILE 100 -32.628   4.555  -9.759
    5   HG13  ILE 100          HG13      ILE 100 -32.717   2.911  -9.125
    6   HG21  ILE 100          HG21      ILE 100 -35.186   5.568 -10.547
    7   HG23  ILE 100          HG22      ILE 100 -35.742   4.315 -11.656
    8   HG22  ILE 100          HG23      ILE 100 -34.071   4.873 -11.723
    9   HD12  ILE 100          HD11      ILE 100 -32.169   3.844 -11.905
   10   HD11  ILE 100          HD12      ILE 100 -32.883   2.253 -11.642
   11   HD13  ILE 100          HD13      ILE 100 -31.318   2.645 -10.933

  No H/Q in entry =          11
  In of MODEL   15
    1    H    LYS 101           H        LYS 101 -37.066   2.260  -8.984
    2    HA   LYS 101           HA       LYS 101 -39.096   3.978  -9.974
    3    HB2  LYS 101           HB2      LYS 101 -39.068   1.203  -8.841
    4    HB3  LYS 101           HB3      LYS 101 -40.595   2.017  -9.178
    5    HG2  LYS 101           HG2      LYS 101 -40.131   2.131 -11.479
    6    HG3  LYS 101           HG3      LYS 101 -38.449   1.667 -11.234
    7    HD2  LYS 101           HD2      LYS 101 -39.770  -0.199 -12.108
    8    HD3  LYS 101           HD3      LYS 101 -39.144  -0.546 -10.496
    9    HE2  LYS 101           HE2      LYS 101 -41.226  -1.169  -9.975
   10    HE3  LYS 101           HE3      LYS 101 -41.623   0.550  -9.979
   11    HZ3  LYS 101           HZ1      LYS 101 -42.533   0.420 -12.091
   12    HZ2  LYS 101           HZ2      LYS 101 -43.041  -1.036 -11.376
   13    HZ1  LYS 101           HZ3      LYS 101 -41.740  -1.035 -12.468

  No H/Q in entry =          13
  In of MODEL   15
    1    H    LYS 102           H        LYS 102 -38.635   2.491  -6.765
    2    HA   LYS 102           HA       LYS 102 -40.832   3.765  -5.556
    3    HB2  LYS 102           HB2      LYS 102 -39.654   1.859  -4.545
    4    HB3  LYS 102           HB3      LYS 102 -38.227   2.867  -4.313
    5    HG2  LYS 102           HG2      LYS 102 -39.485   4.308  -2.810
    6    HG3  LYS 102           HG3      LYS 102 -40.916   3.305  -3.045
    7    HD2  LYS 102           HD2      LYS 102 -39.748   1.400  -2.022
    8    HD3  LYS 102           HD3      LYS 102 -38.318   2.405  -1.786
    9    HE2  LYS 102           HE2      LYS 102 -39.612   3.931  -0.372
   10    HE3  LYS 102           HE3      LYS 102 -41.059   2.958  -0.629
   11    HZ1  LYS 102           HZ1      LYS 102 -39.394   1.147   0.367
   12    HZ3  LYS 102           HZ2      LYS 102 -40.467   2.072   1.302
   13    HZ2  LYS 102           HZ3      LYS 102 -38.840   2.541   1.164

  No H/Q in entry =          13
  In of MODEL   15
    1    H    ALA 103           H        ALA 103 -37.838   5.053  -6.590
    2    HA   ALA 103           HA       ALA 103 -37.970   7.376  -4.811
    3    HB2  ALA 103           HB1      ALA 103 -35.964   8.039  -6.400
    4    HB3  ALA 103           HB2      ALA 103 -35.991   6.321  -6.795
    5    HB1  ALA 103           HB3      ALA 103 -35.736   6.838  -5.130

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA 104           H        ALA 104 -38.636   6.661  -8.152
    2    HA   ALA 104           HA       ALA 104 -39.130   9.463  -8.777
    3    HB2  ALA 104           HB1      ALA 104 -39.209   8.793 -10.977
    4    HB1  ALA 104           HB2      ALA 104 -39.987   7.258 -10.591
    5    HB3  ALA 104           HB3      ALA 104 -38.255   7.462 -10.323

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA 105           H        ALA 105 -40.798   7.418  -6.958
    2    HA   ALA 105           HA       ALA 105 -43.173   8.894  -6.920
    3    HB2  ALA 105           HB1      ALA 105 -43.959   8.057  -8.952
    4    HB3  ALA 105           HB2      ALA 105 -44.630   6.894  -7.809
    5    HB1  ALA 105           HB3      ALA 105 -43.179   6.493  -8.727

  No H/Q in entry =           5
  In of MODEL   16
    1    H1   ALA   1           H3       ALA   1 -12.115 -15.996  -2.381
    2    H2   ALA   1           H2       ALA   1 -11.162 -17.133  -3.215
    3    H3   ALA   1           H1       ALA   1 -12.313 -16.203  -4.055
    4    HA   ALA   1           HA       ALA   1 -13.696 -17.915  -3.809
    5    HB3  ALA   1           HB1      ALA   1 -12.285 -19.672  -3.337
    6    HB1  ALA   1           HB2      ALA   1 -13.045 -19.559  -1.750
    7    HB2  ALA   1           HB3      ALA   1 -11.476 -18.805  -2.031

  No H/Q in entry =           7
  In of MODEL   16
    1    H    GLU   2           H        GLU   2 -15.314 -18.776  -2.154
    2    HA   GLU   2           HA       GLU   2 -16.980 -17.066  -1.106
    3    HB2  GLU   2           HB2      GLU   2 -16.021 -19.476   0.452
    4    HB3  GLU   2           HB3      GLU   2 -17.553 -18.638   0.699
    5    HG2  GLU   2           HG2      GLU   2 -18.520 -19.741  -1.032
    6    HG3  GLU   2           HG3      GLU   2 -17.199 -19.334  -2.116

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLU   3           H        GLU   3 -15.060 -18.389   1.527
    2    HA   GLU   3           HA       GLU   3 -15.305 -16.031   3.072
    3    HB2  GLU   3           HB2      GLU   3 -13.697 -18.562   3.338
    4    HB3  GLU   3           HB3      GLU   3 -13.480 -17.235   4.479
    5    HG2  GLU   3           HG2      GLU   3 -15.673 -17.402   5.294
    6    HG3  GLU   3           HG3      GLU   3 -16.259 -18.214   3.848

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LEU   4           H        LEU   4 -12.335 -17.489   1.693
    2    HA   LEU   4           HA       LEU   4 -10.519 -15.567   2.286
    3    HB2  LEU   4           HB2      LEU   4 -10.733 -16.879  -0.433
    4    HB3  LEU   4           HB3      LEU   4  -9.288 -16.143   0.251
    5    HG   LEU   4           HG       LEU   4 -10.763 -18.548   1.372
    6   HD13  LEU   4          HD11      LEU   4  -9.117 -19.893   0.452
    7   HD12  LEU   4          HD12      LEU   4  -7.919 -18.600   0.422
    8   HD11  LEU   4          HD13      LEU   4  -9.205 -18.639  -0.783
    9   HD23  LEU   4          HD21      LEU   4  -8.514 -18.585   2.758
   10   HD22  LEU   4          HD22      LEU   4  -9.845 -17.555   3.280
   11   HD21  LEU   4          HD23      LEU   4  -8.487 -16.858   2.397

  No H/Q in entry =          11
  In of MODEL   16
    1    H    GLU   5           H        GLU   5 -12.850 -15.394  -0.393
    2    HA   GLU   5           HA       GLU   5 -11.867 -12.906  -1.404
    3    HB2  GLU   5           HB2      GLU   5 -13.203 -14.521  -2.752
    4    HB3  GLU   5           HB3      GLU   5 -14.608 -14.141  -1.756
    5    HG2  GLU   5           HG2      GLU   5 -14.748 -12.776  -3.734
    6    HG3  GLU   5           HG3      GLU   5 -14.301 -11.720  -2.395

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLU   6           H        GLU   6 -14.588 -13.798   0.687
    2    HA   GLU   6           HA       GLU   6 -15.517 -11.128   1.073
    3    HB2  GLU   6           HB2      GLU   6 -16.932 -13.121   1.479
    4    HB3  GLU   6           HB3      GLU   6 -15.894 -13.565   2.832
    5    HG2  GLU   6           HG2      GLU   6 -16.433 -11.463   3.969
    6    HG3  GLU   6           HG3      GLU   6 -17.427 -10.960   2.602

  No H/Q in entry =           6
  In of MODEL   16
    1    H    VAL   7           H        VAL   7 -13.194 -13.211   2.658
    2    HA   VAL   7           HA       VAL   7 -12.746 -11.621   4.979
    3    HB   VAL   7           HB       VAL   7 -11.022 -13.656   3.542
    4   HG11  VAL   7          HG11      VAL   7 -10.572 -12.107   6.100
    5   HG13  VAL   7          HG12      VAL   7  -9.468 -12.318   4.742
    6   HG12  VAL   7          HG13      VAL   7  -9.811 -13.673   5.818
    7   HG21  VAL   7          HG21      VAL   7 -13.270 -14.234   4.761
    8   HG23  VAL   7          HG22      VAL   7 -12.348 -13.945   6.236
    9   HG22  VAL   7          HG23      VAL   7 -11.842 -15.206   5.114

  No H/Q in entry =           9
  In of MODEL   16
    1    H    VAL   8           H        VAL   8 -11.228 -11.737   1.772
    2    HA   VAL   8           HA       VAL   8  -9.182  -9.844   2.260
    3    HB   VAL   8           HB       VAL   8 -10.635 -10.552  -0.301
    4   HG12  VAL   8          HG11      VAL   8  -8.506  -9.533  -1.326
    5   HG11  VAL   8          HG12      VAL   8  -8.242  -8.785   0.249
    6   HG13  VAL   8          HG13      VAL   8  -9.693  -8.401  -0.675
    7   HG22  VAL   8          HG21      VAL   8  -9.108 -12.264  -0.542
    8   HG21  VAL   8          HG22      VAL   8  -8.948 -12.116   1.206
    9   HG23  VAL   8          HG23      VAL   8  -7.790 -11.315   0.149

  No H/Q in entry =           9
  In of MODEL   16
    1    H    MET   9           H        MET   9 -12.529  -9.489   1.092
    2    HA   MET   9           HA       MET   9 -12.489  -6.714   0.644
    3    HB2  MET   9           HB2      MET   9 -14.673  -8.629   1.443
    4    HB3  MET   9           HB3      MET   9 -14.990  -6.899   1.293
    5    HG2  MET   9           HG2      MET   9 -14.123  -6.953  -1.027
    6    HG3  MET   9           HG3      MET   9 -13.856  -8.690  -0.875
    7    HE3  MET   9           HE1      MET   9 -17.337  -6.677   0.496
    8    HE2  MET   9           HE2      MET   9 -17.592  -6.231  -1.188
    9    HE1  MET   9           HE3      MET   9 -16.062  -5.846  -0.405

  No H/Q in entry =           9
  In of MODEL   16
    1    H    GLY  10           H        GLY  10 -13.141  -8.597   3.579
    2    HA3  GLY  10           HA2      GLY  10 -13.712  -6.409   5.286
    3    HA2  GLY  10           HA3      GLY  10 -13.135  -7.991   5.809

  No H/Q in entry =           3
  In of MODEL   16
    1    H    LEU  11           H        LEU  11 -10.685  -8.099   4.500
    2    HA   LEU  11           HA       LEU  11  -9.002  -6.641   6.253
    3    HB2  LEU  11           HB2      LEU  11  -8.437  -8.072   3.654
    4    HB3  LEU  11           HB3      LEU  11  -7.175  -7.352   4.651
    5    HG   LEU  11           HG       LEU  11  -9.160  -9.398   5.673
    6   HD13  LEU  11          HD11      LEU  11  -7.924 -10.631   4.117
    7   HD12  LEU  11          HD12      LEU  11  -6.990 -10.854   5.596
    8   HD11  LEU  11          HD13      LEU  11  -6.458  -9.690   4.383
    9   HD22  LEU  11          HD21      LEU  11  -8.321  -8.368   7.587
   10   HD21  LEU  11          HD22      LEU  11  -6.785  -7.956   6.825
   11   HD23  LEU  11          HD23      LEU  11  -7.096  -9.613   7.342

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  12           H        ILE  12  -9.902  -6.119   2.859
    2    HA   ILE  12           HA       ILE  12  -8.230  -3.875   2.425
    3    HB   ILE  12           HB       ILE  12 -10.876  -4.571   1.127
    4   HG12  ILE  12          HG12      ILE  12  -8.831  -6.214   1.070
    5   HG13  ILE  12          HG13      ILE  12  -9.692  -5.874  -0.417
    6   HG22  ILE  12          HG21      ILE  12  -9.976  -3.184  -0.765
    7   HG21  ILE  12          HG22      ILE  12  -8.656  -2.677   0.280
    8   HG23  ILE  12          HG23      ILE  12 -10.300  -2.273   0.678
    9   HD11  ILE  12          HD11      ILE  12  -7.187  -4.423   0.477
   10   HD13  ILE  12          HD12      ILE  12  -7.977  -4.314  -1.093
   11   HD12  ILE  12          HD13      ILE  12  -7.186  -5.796  -0.612

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  13           H        ILE  13 -11.591  -4.170   3.512
    2    HA   ILE  13           HA       ILE  13 -12.078  -1.386   3.768
    3    HB   ILE  13           HB       ILE  13 -13.262  -3.813   5.135
    4   HG12  ILE  13          HG12      ILE  13 -13.491  -3.277   2.597
    5   HG13  ILE  13          HG13      ILE  13 -14.915  -3.743   3.502
    6   HG21  ILE  13          HG21      ILE  13 -14.008  -0.895   5.387
    7   HG23  ILE  13          HG22      ILE  13 -13.718  -2.051   6.680
    8   HG22  ILE  13          HG23      ILE  13 -15.176  -2.177   5.699
    9   HD13  ILE  13          HD11      ILE  13 -15.610  -1.422   3.726
   10   HD12  ILE  13          HD12      ILE  13 -15.292  -1.775   2.038
   11   HD11  ILE  13          HD13      ILE  13 -14.109  -0.882   2.967

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ASN  14           H        ASN  14 -10.947  -3.854   6.057
    2    HA   ASN  14           HA       ASN  14 -10.768  -2.203   8.335
    3    HB2  ASN  14           HB2      ASN  14 -10.488  -4.809   8.026
    4    HB3  ASN  14           HB3      ASN  14  -8.783  -4.405   7.871
    5   HD21  ASN  14          HD21      ASN  14  -9.408  -5.925  10.053
    6   HD22  ASN  14          HD22      ASN  14  -9.393  -4.998  11.473

  No H/Q in entry =           6
  In of MODEL   16
    1    H    SER  15           H        SER  15  -8.352  -3.014   5.852
    2    HA   SER  15           HA       SER  15  -6.227  -1.493   6.922
    3    HB2  SER  15           HB2      SER  15  -5.196  -1.716   4.773
    4    HB3  SER  15           HB3      SER  15  -6.149  -3.178   4.992
    5    HG   SER  15           HG       SER  15  -6.917  -2.567   3.116

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLY  16           H        GLY  16  -8.832  -0.665   4.665
    2    HA3  GLY  16           HA2      GLY  16  -8.002   1.982   4.102
    3    HA2  GLY  16           HA3      GLY  16  -9.646   1.368   3.939

  No H/Q in entry =           3
  In of MODEL   16
    1    H    GLN  17           H        GLN  17 -10.187   0.650   6.591
    2    HA   GLN  17           HA       GLN  17 -10.924   3.152   7.718
    3    HB2  GLN  17           HB2      GLN  17 -10.798   0.376   8.909
    4    HB3  GLN  17           HB3      GLN  17 -11.437   1.773   9.776
    5    HG2  GLN  17           HG2      GLN  17 -13.118   2.123   8.032
    6    HG3  GLN  17           HG3      GLN  17 -12.450   0.789   7.093
    7   HE21  GLN  17          HE21      GLN  17 -14.908   1.524   9.248
    8   HE22  GLN  17          HE22      GLN  17 -15.192  -0.032   9.865

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ALA  18           H        ALA  18  -8.271   0.904   8.354
    2    HA   ALA  18           HA       ALA  18  -7.193   2.144  10.622
    3    HB2  ALA  18           HB1      ALA  18  -6.554  -0.071   9.267
    4    HB3  ALA  18           HB2      ALA  18  -5.403   0.730  10.336
    5    HB1  ALA  18           HB3      ALA  18  -5.325   1.001   8.594

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ARG  19           H        ARG  19  -6.420   2.659   7.172
    2    HA   ARG  19           HA       ARG  19  -4.547   4.731   7.595
    3    HB2  ARG  19           HB2      ARG  19  -4.855   3.576   5.404
    4    HB3  ARG  19           HB3      ARG  19  -6.407   4.397   5.220
    5    HG2  ARG  19           HG2      ARG  19  -5.305   6.582   5.279
    6    HG3  ARG  19           HG3      ARG  19  -3.747   5.817   5.591
    7    HD2  ARG  19           HD2      ARG  19  -3.874   6.394   3.245
    8    HD3  ARG  19           HD3      ARG  19  -3.938   4.634   3.399
    9    HE   ARG  19           HE       ARG  19  -6.583   5.511   3.381
   10   HH21  ARG  19          HH11      ARG  19  -7.775   5.643   1.459
   11   HH22  ARG  19          HH12      ARG  19  -6.951   5.723  -0.059
   12   HH11  ARG  19          HH21      ARG  19  -3.803   5.597   1.353
   13   HH12  ARG  19          HH22      ARG  19  -4.700   5.694  -0.119

  No H/Q in entry =          13
  In of MODEL   16
    1    H    SER  20           H        SER  20  -8.045   4.801   6.986
    2    HA   SER  20           HA       SER  20  -8.435   7.552   6.922
    3    HB2  SER  20           HB2      SER  20 -10.294   6.183   6.388
    4    HB3  SER  20           HB3      SER  20 -10.179   5.302   7.910
    5    HG   SER  20           HG       SER  20 -10.597   7.428   8.904

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU  21           H        LEU  21  -8.415   5.383   9.738
    2    HA   LEU  21           HA       LEU  21  -8.886   7.384  11.691
    3    HB2  LEU  21           HB2      LEU  21  -7.504   4.699  11.866
    4    HB3  LEU  21           HB3      LEU  21  -7.820   5.719  13.265
    5    HG   LEU  21           HG       LEU  21  -9.983   4.788  11.353
    6   HD11  LEU  21          HD11      LEU  21  -8.844   2.896  12.543
    7   HD13  LEU  21          HD12      LEU  21 -10.541   3.082  12.987
    8   HD12  LEU  21          HD13      LEU  21  -9.276   3.655  14.075
    9   HD23  LEU  21          HD21      LEU  21 -11.323   5.290  13.580
   10   HD22  LEU  21          HD22      LEU  21 -10.894   6.629  12.520
   11   HD21  LEU  21          HD23      LEU  21  -9.941   6.314  13.961

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ALA  22           H        ALA  22  -5.913   6.041  10.298
    2    HA   ALA  22           HA       ALA  22  -4.054   7.387  11.918
    3    HB2  ALA  22           HB1      ALA  22  -3.610   5.530  10.238
    4    HB1  ALA  22           HB2      ALA  22  -2.431   6.841  10.269
    5    HB3  ALA  22           HB3      ALA  22  -3.645   6.775   8.990

  No H/Q in entry =           5
  In of MODEL   16
    1    H    TYR  23           H        TYR  23  -5.376   8.370   8.727
    2    HA   TYR  23           HA       TYR  23  -4.072  10.883   8.647
    3    HB2  TYR  23           HB2      TYR  23  -5.135   9.947   6.657
    4    HB3  TYR  23           HB3      TYR  23  -6.717  10.037   7.433
    5    HD1  TYR  23           HD1      TYR  23  -3.834  12.122   6.302
    6    HD2  TYR  23           HD2      TYR  23  -7.991  12.021   7.380
    7    HE1  TYR  23           HE1      TYR  23  -4.090  14.465   5.531
    8    HE2  TYR  23           HE2      TYR  23  -8.247  14.364   6.607
    9    HH   TYR  23           HH       TYR  23  -5.597  16.069   5.001

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ALA  24           H        ALA  24  -7.182   9.872  10.023
    2    HA   ALA  24           HA       ALA  24  -8.054  12.455  10.779
    3    HB1  ALA  24           HB1      ALA  24  -9.858  11.183  11.248
    4    HB2  ALA  24           HB2      ALA  24  -9.028  10.629  12.701
    5    HB3  ALA  24           HB3      ALA  24  -8.887   9.711  11.203

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA  25           H        ALA  25  -6.025  10.031  12.371
    2    HA   ALA  25           HA       ALA  25  -5.710  11.301  14.867
    3    HB2  ALA  25           HB1      ALA  25  -4.910   8.955  14.061
    4    HB3  ALA  25           HB2      ALA  25  -3.910   9.832  15.220
    5    HB1  ALA  25           HB3      ALA  25  -3.469   9.812  13.512

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU  26           H        LEU  26  -3.915  11.607  11.830
    2    HA   LEU  26           HA       LEU  26  -1.983  13.457  12.742
    3    HB2  LEU  26           HB2      LEU  26  -1.661  12.298  10.645
    4    HB3  LEU  26           HB3      LEU  26  -3.141  12.984   9.983
    5    HG   LEU  26           HG       LEU  26  -2.156  15.248  10.109
    6   HD12  LEU  26          HD11      LEU  26   0.381  15.302  10.530
    7   HD11  LEU  26          HD12      LEU  26   0.176  13.723  11.282
    8   HD13  LEU  26          HD13      LEU  26  -0.652  15.131  11.948
    9   HD21  LEU  26          HD21      LEU  26  -0.383  13.209   8.730
   10   HD23  LEU  26          HD22      LEU  26  -0.447  14.927   8.350
   11   HD22  LEU  26          HD23      LEU  26  -1.857  13.910   8.063

  No H/Q in entry =          11
  In of MODEL   16
    1    H    LYS  27           H        LYS  27  -5.167  13.891  11.254
    2    HA   LYS  27           HA       LYS  27  -5.146  16.679  11.041
    3    HB2  LYS  27           HB2      LYS  27  -6.869  15.175  10.059
    4    HB3  LYS  27           HB3      LYS  27  -7.527  14.919  11.674
    5    HG2  LYS  27           HG2      LYS  27  -7.987  17.320  11.896
    6    HG3  LYS  27           HG3      LYS  27  -7.278  17.618  10.306
    7    HD2  LYS  27           HD2      LYS  27  -8.990  16.157   9.273
    8    HD3  LYS  27           HD3      LYS  27  -9.705  15.876  10.862
    9    HE2  LYS  27           HE2      LYS  27 -10.178  18.283  11.091
   10    HE3  LYS  27           HE3      LYS  27  -9.435  18.585   9.517
   11    HZ3  LYS  27           HZ1      LYS  27 -11.810  18.429   9.270
   12    HZ2  LYS  27           HZ2      LYS  27 -11.842  16.917  10.047
   13    HZ1  LYS  27           HZ3      LYS  27 -11.095  17.081   8.527

  No H/Q in entry =          13
  In of MODEL   16
    1    H    GLN  28           H        GLN  28  -6.016  14.597  13.777
    2    HA   GLN  28           HA       GLN  28  -6.941  16.598  15.540
    3    HB2  GLN  28           HB2      GLN  28  -5.508  13.989  16.101
    4    HB3  GLN  28           HB3      GLN  28  -6.266  14.990  17.340
    5    HG2  GLN  28           HG2      GLN  28  -7.706  13.841  14.932
    6    HG3  GLN  28           HG3      GLN  28  -7.757  13.153  16.554
    7   HE21  GLN  28          HE21      GLN  28  -9.642  14.936  14.576
    8   HE22  GLN  28          HE22      GLN  28 -10.410  15.942  15.706

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ALA  29           H        ALA  29  -3.705  15.337  14.866
    2    HA   ALA  29           HA       ALA  29  -2.288  16.761  16.840
    3    HB1  ALA  29           HB1      ALA  29  -0.347  16.087  15.730
    4    HB3  ALA  29           HB2      ALA  29  -1.099  16.194  14.138
    5    HB2  ALA  29           HB3      ALA  29  -1.508  14.862  15.219

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LYS  30           H        LYS  30  -3.148  17.614  13.504
    2    HA   LYS  30           HA       LYS  30  -1.762  20.068  13.395
    3    HB2  LYS  30           HB2      LYS  30  -4.281  19.161  11.984
    4    HB3  LYS  30           HB3      LYS  30  -3.461  20.682  11.635
    5    HG2  LYS  30           HG2      LYS  30  -1.377  19.407  11.133
    6    HG3  LYS  30           HG3      LYS  30  -2.270  17.904  11.383
    7    HD2  LYS  30           HD2      LYS  30  -3.835  18.520   9.581
    8    HD3  LYS  30           HD3      LYS  30  -2.966  20.035   9.333
    9    HE2  LYS  30           HE2      LYS  30  -0.920  18.759   8.765
   10    HE3  LYS  30           HE3      LYS  30  -1.808  17.248   8.982
   11    HZ2  LYS  30           HZ1      LYS  30  -1.635  18.109   6.636
   12    HZ1  LYS  30           HZ2      LYS  30  -2.691  19.364   7.096
   13    HZ3  LYS  30           HZ3      LYS  30  -3.201  17.743   7.174

  No H/Q in entry =          13
  In of MODEL   16
    1    H    GLN  31           H        GLN  31  -4.858  19.194  14.804
    2    HA   GLN  31           HA       GLN  31  -5.647  21.946  15.240
    3    HB2  GLN  31           HB2      GLN  31  -6.808  19.496  16.573
    4    HB3  GLN  31           HB3      GLN  31  -7.581  21.060  16.317
    5    HG2  GLN  31           HG2      GLN  31  -6.858  20.276  13.733
    6    HG3  GLN  31           HG3      GLN  31  -7.371  18.771  14.486
    7   HE21  GLN  31          HE21      GLN  31  -8.790  20.322  12.374
    8   HE22  GLN  31          HE22      GLN  31 -10.308  20.704  13.026

  No H/Q in entry =           8
  In of MODEL   16
    1    H    GLY  32           H        GLY  32  -3.321  20.045  16.575
    2    HA3  GLY  32           HA2      GLY  32  -1.929  20.528  18.378
    3    HA2  GLY  32           HA3      GLY  32  -3.070  21.764  18.893

  No H/Q in entry =           3
  In of MODEL   16
    1    H    ASP  33           H        ASP  33  -4.465  18.709  18.243
    2    HA   ASP  33           HA       ASP  33  -4.878  18.262  21.124
    3    HB2  ASP  33           HB2      ASP  33  -6.271  17.227  18.648
    4    HB3  ASP  33           HB3      ASP  33  -6.615  16.622  20.267

  No H/Q in entry =           4
  In of MODEL   16
    1    H    PHE  34           H        PHE  34  -2.704  17.430  21.438
    2    HA   PHE  34           HA       PHE  34  -1.682  15.183  20.050
    3    HB2  PHE  34           HB2      PHE  34  -1.079  16.186  22.841
    4    HB3  PHE  34           HB3      PHE  34  -0.139  14.966  21.982
    5    HD1  PHE  34           HD1      PHE  34  -0.340  18.394  22.700
    6    HD2  PHE  34           HD2      PHE  34   0.519  15.682  19.480
    7    HE1  PHE  34           HE1      PHE  34   0.943  20.170  21.541
    8    HE2  PHE  34           HE2      PHE  34   1.797  17.462  18.325
    9    HZ   PHE  34           HZ       PHE  34   2.011  19.703  19.360

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ALA  35           H        ALA  35  -3.730  15.457  22.908
    2    HA   ALA  35           HA       ALA  35  -3.498  12.801  23.817
    3    HB3  ALA  35           HB1      ALA  35  -5.963  13.411  24.666
    4    HB1  ALA  35           HB2      ALA  35  -5.442  15.031  24.204
    5    HB2  ALA  35           HB3      ALA  35  -4.523  14.120  25.401

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA  36           H        ALA  36  -5.956  14.288  21.705
    2    HA   ALA  36           HA       ALA  36  -7.351  11.863  21.235
    3    HB1  ALA  36           HB1      ALA  36  -8.816  13.269  20.270
    4    HB3  ALA  36           HB2      ALA  36  -7.644  13.693  19.021
    5    HB2  ALA  36           HB3      ALA  36  -7.679  14.588  20.541

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA  37           H        ALA  37  -4.680  13.464  19.565
    2    HA   ALA  37           HA       ALA  37  -4.627  11.819  17.276
    3    HB3  ALA  37           HB1      ALA  37  -2.651  13.553  18.694
    4    HB2  ALA  37           HB2      ALA  37  -3.179  13.597  17.013
    5    HB1  ALA  37           HB3      ALA  37  -2.016  12.378  17.542

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LYS  38           H        LYS  38  -2.874  11.541  20.359
    2    HA   LYS  38           HA       LYS  38  -1.528   9.149  19.883
    3    HB2  LYS  38           HB2      LYS  38  -1.870  10.919  22.020
    4    HB3  LYS  38           HB3      LYS  38  -2.478   9.387  22.642
    5    HG2  LYS  38           HG2      LYS  38  -0.373   8.281  22.115
    6    HG3  LYS  38           HG3      LYS  38   0.225   9.728  21.296
    7    HD2  LYS  38           HD2      LYS  38   0.380  10.957  23.326
    8    HD3  LYS  38           HD3      LYS  38  -0.632   9.802  24.196
    9    HE2  LYS  38           HE2      LYS  38   1.725   9.508  24.821
   10    HE3  LYS  38           HE3      LYS  38   1.134   8.083  23.962
   11    HZ3  LYS  38           HZ1      LYS  38   2.435   8.505  22.182
   12    HZ2  LYS  38           HZ2      LYS  38   3.381   9.346  23.317
   13    HZ1  LYS  38           HZ3      LYS  38   2.297  10.192  22.319

  No H/Q in entry =          13
  In of MODEL   16
    1    H    ALA  39           H        ALA  39  -4.774   9.624  21.277
    2    HA   ALA  39           HA       ALA  39  -5.313   6.903  21.792
    3    HB3  ALA  39           HB1      ALA  39  -7.486   8.826  21.012
    4    HB2  ALA  39           HB2      ALA  39  -6.593   9.067  22.514
    5    HB1  ALA  39           HB3      ALA  39  -7.497   7.575  22.255

  No H/Q in entry =           5
  In of MODEL   16
    1    H    MET  40           H        MET  40  -5.908   8.898  18.936
    2    HA   MET  40           HA       MET  40  -7.365   6.948  17.481
    3    HB2  MET  40           HB2      MET  40  -5.773   9.352  16.569
    4    HB3  MET  40           HB3      MET  40  -6.789   8.380  15.501
    5    HG2  MET  40           HG2      MET  40  -7.839   9.631  18.051
    6    HG3  MET  40           HG3      MET  40  -7.900  10.459  16.497
    7    HE3  MET  40           HE1      MET  40 -10.466   8.809  14.434
    8    HE2  MET  40           HE2      MET  40  -8.714   8.940  14.289
    9    HE1  MET  40           HE3      MET  40  -9.644  10.300  14.915

  No H/Q in entry =           9
  In of MODEL   16
    1    H    MET  41           H        MET  41  -3.881   7.715  17.607
    2    HA   MET  41           HA       MET  41  -3.103   5.958  15.517
    3    HB2  MET  41           HB2      MET  41  -1.498   6.649  17.990
    4    HB3  MET  41           HB3      MET  41  -0.871   5.999  16.479
    5    HG2  MET  41           HG2      MET  41  -2.044   8.168  15.462
    6    HG3  MET  41           HG3      MET  41  -1.817   8.765  17.105
    7    HE2  MET  41           HE1      MET  41   1.119   6.693  17.482
    8    HE1  MET  41           HE2      MET  41   0.317   7.984  18.373
    9    HE3  MET  41           HE3      MET  41   1.939   8.239  17.732

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ASP  42           H        ASP  42  -3.491   5.496  19.004
    2    HA   ASP  42           HA       ASP  42  -2.433   2.913  19.178
    3    HB2  ASP  42           HB2      ASP  42  -3.326   4.672  20.990
    4    HB3  ASP  42           HB3      ASP  42  -4.744   3.634  20.920

  No H/Q in entry =           4
  In of MODEL   16
    1    H    GLN  43           H        GLN  43  -5.775   3.985  18.665
    2    HA   GLN  43           HA       GLN  43  -6.895   1.386  18.479
    3    HB2  GLN  43           HB2      GLN  43  -7.839   4.025  17.337
    4    HB3  GLN  43           HB3      GLN  43  -8.789   2.537  17.319
    5    HG2  GLN  43           HG2      GLN  43  -8.500   2.430  19.828
    6    HG3  GLN  43           HG3      GLN  43  -7.790   4.041  19.751
    7   HE21  GLN  43          HE21      GLN  43  -9.973   4.108  21.246
    8   HE22  GLN  43          HE22      GLN  43 -11.337   4.668  20.409

  No H/Q in entry =           8
  In of MODEL   16
    1    H    SER  44           H        SER  44  -5.569   3.601  16.061
    2    HA   SER  44           HA       SER  44  -6.252   2.101  13.777
    3    HB2  SER  44           HB2      SER  44  -5.018   4.498  14.213
    4    HB3  SER  44           HB3      SER  44  -3.654   3.511  13.690
    5    HG   SER  44           HG       SER  44  -4.771   4.466  11.920

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ARG  45           H        ARG  45  -3.378   2.023  15.864
    2    HA   ARG  45           HA       ARG  45  -1.878   0.076  14.494
    3    HB2  ARG  45           HB2      ARG  45  -1.053   1.513  16.358
    4    HB3  ARG  45           HB3      ARG  45  -2.039   0.578  17.480
    5    HG2  ARG  45           HG2      ARG  45  -0.787  -1.472  16.850
    6    HG3  ARG  45           HG3      ARG  45   0.222  -0.513  15.770
    7    HD2  ARG  45           HD2      ARG  45   0.940   0.883  17.721
    8    HD3  ARG  45           HD3      ARG  45   0.025  -0.195  18.797
    9    HE   ARG  45           HE       ARG  45   1.742  -1.783  17.228
   10   HH21  ARG  45          HH11      ARG  45   3.647  -2.585  18.073
   11   HH22  ARG  45          HH12      ARG  45   4.410  -1.786  19.403
   12   HH11  ARG  45          HH21      ARG  45   2.017   0.697  19.608
   13   HH12  ARG  45          HH22      ARG  45   3.487   0.074  20.269

  No H/Q in entry =          13
  In of MODEL   16
    1    H    MET  46           H        MET  46  -4.278  -0.254  17.090
    2    HA   MET  46           HA       MET  46  -4.087  -3.051  17.409
    3    HB2  MET  46           HB2      MET  46  -6.275  -1.061  17.995
    4    HB3  MET  46           HB3      MET  46  -6.468  -2.782  18.343
    5    HG2  MET  46           HG2      MET  46  -4.489  -2.753  19.771
    6    HG3  MET  46           HG3      MET  46  -4.181  -1.073  19.365
    7    HE3  MET  46           HE1      MET  46  -7.843  -2.810  20.389
    8    HE2  MET  46           HE2      MET  46  -7.306  -2.941  22.061
    9    HE1  MET  46           HE3      MET  46  -6.350  -3.673  20.776

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ALA  47           H        ALA  47  -6.119  -1.060  15.301
    2    HA   ALA  47           HA       ALA  47  -7.717  -3.129  14.240
    3    HB3  ALA  47           HB1      ALA  47  -8.414  -0.899  13.813
    4    HB1  ALA  47           HB2      ALA  47  -7.916  -1.535  12.245
    5    HB2  ALA  47           HB3      ALA  47  -6.847  -0.454  13.140

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU  48           H        LEU  48  -4.606  -1.800  13.191
    2    HA   LEU  48           HA       LEU  48  -4.306  -3.397  10.858
    3    HB2  LEU  48           HB2      LEU  48  -2.264  -2.095  12.666
    4    HB3  LEU  48           HB3      LEU  48  -1.886  -2.819  11.103
    5    HG   LEU  48           HG       LEU  48  -3.927  -0.616  11.478
    6   HD13  LEU  48          HD11      LEU  48  -1.814   0.279  12.145
    7   HD12  LEU  48          HD12      LEU  48  -2.089   0.824  10.490
    8   HD11  LEU  48          HD13      LEU  48  -0.982  -0.513  10.807
    9   HD22  LEU  48          HD21      LEU  48  -4.385  -1.613   9.405
   10   HD21  LEU  48          HD22      LEU  48  -2.698  -2.036   9.116
   11   HD23  LEU  48          HD23      LEU  48  -3.230  -0.362   8.948

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ASN  49           H        ASN  49  -3.267  -3.772  14.208
    2    HA   ASN  49           HA       ASN  49  -1.646  -6.025  13.891
    3    HB2  ASN  49           HB2      ASN  49  -1.685  -4.684  15.934
    4    HB3  ASN  49           HB3      ASN  49  -3.342  -5.172  16.254
    5   HD21  ASN  49          HD21      ASN  49  -1.371  -5.681  18.178
    6   HD22  ASN  49          HD22      ASN  49  -1.081  -7.351  18.260

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLU  50           H        GLU  50  -5.119  -5.772  14.552
    2    HA   GLU  50           HA       GLU  50  -5.612  -8.574  14.671
    3    HB2  GLU  50           HB2      GLU  50  -7.212  -6.895  15.536
    4    HB3  GLU  50           HB3      GLU  50  -7.505  -6.339  13.886
    5    HG2  GLU  50           HG2      GLU  50  -8.353  -8.543  13.255
    6    HG3  GLU  50           HG3      GLU  50  -7.971  -9.178  14.852

  No H/Q in entry =           6
  In of MODEL   16
    1    H    ALA  51           H        ALA  51  -5.689  -6.187  12.065
    2    HA   ALA  51           HA       ALA  51  -6.657  -7.929  10.048
    3    HB2  ALA  51           HB1      ALA  51  -6.445  -6.121   8.671
    4    HB1  ALA  51           HB2      ALA  51  -4.810  -5.759   9.223
    5    HB3  ALA  51           HB3      ALA  51  -6.199  -5.253  10.186

  No H/Q in entry =           5
  In of MODEL   16
    1    H    HIS  52           H        HIS  52  -3.375  -6.998  11.037
    2    HA   HIS  52           HA       HIS  52  -1.962  -8.486   9.097
    3    HB2  HIS  52           HB2      HIS  52  -0.960  -6.733  10.555
    4    HB3  HIS  52           HB3      HIS  52  -1.095  -7.835  11.924
    5    HD1  HIS  52           HD1      HIS  52   0.324 -10.093  11.759
    6    HD2  HIS  52           HD2      HIS  52   1.238  -7.209   8.890
    7    HE1  HIS  52           HE1      HIS  52   2.548 -10.763  10.752
    8    HE2  HIS  52           HE2      HIS  52   3.120  -9.015   9.002

  No H/Q in entry =           8
  In of MODEL   16
    1    H    LEU  53           H        LEU  53  -3.177  -9.358  12.310
    2    HA   LEU  53           HA       LEU  53  -1.965 -11.894  12.517
    3    HB2  LEU  53           HB2      LEU  53  -4.457 -10.718  13.721
    4    HB3  LEU  53           HB3      LEU  53  -3.997 -12.393  14.017
    5    HG   LEU  53           HG       LEU  53  -2.095 -10.077  14.491
    6   HD12  LEU  53          HD11      LEU  53  -2.713 -10.530  16.949
    7   HD11  LEU  53          HD12      LEU  53  -4.141 -11.344  16.313
    8   HD13  LEU  53          HD13      LEU  53  -3.885  -9.634  15.987
    9   HD23  LEU  53          HD21      LEU  53  -1.223 -11.875  16.187
   10   HD22  LEU  53          HD22      LEU  53  -0.830 -12.064  14.482
   11   HD21  LEU  53          HD23      LEU  53  -2.116 -13.021  15.193

  No H/Q in entry =          11
  In of MODEL   16
    1    H    VAL  54           H        VAL  54  -5.078 -10.888  11.142
    2    HA   VAL  54           HA       VAL  54  -5.976 -13.489  10.463
    3    HB   VAL  54           HB       VAL  54  -6.634 -10.765   9.315
    4   HG12  VAL  54          HG11      VAL  54  -8.727 -12.157   8.503
    5   HG11  VAL  54          HG12      VAL  54  -7.608 -13.517   8.584
    6   HG13  VAL  54          HG13      VAL  54  -7.252 -12.144   7.537
    7   HG22  VAL  54          HG21      VAL  54  -7.547 -10.799  11.464
    8   HG21  VAL  54          HG22      VAL  54  -7.792 -12.543  11.451
    9   HG23  VAL  54          HG23      VAL  54  -8.876 -11.496  10.538

  No H/Q in entry =           9
  In of MODEL   16
    1    H    GLN  55           H        GLN  55  -4.112 -11.035   8.669
    2    HA   GLN  55           HA       GLN  55  -3.967 -12.509   6.258
    3    HB2  GLN  55           HB2      GLN  55  -3.375 -10.242   6.060
    4    HB3  GLN  55           HB3      GLN  55  -2.267 -10.307   7.429
    5    HG2  GLN  55           HG2      GLN  55  -0.542 -11.150   6.161
    6    HG3  GLN  55           HG3      GLN  55  -1.608 -12.134   5.168
    7   HE21  GLN  55          HE21      GLN  55  -1.622 -11.453   3.044
    8   HE22  GLN  55          HE22      GLN  55  -1.431  -9.849   2.528

  No H/Q in entry =           8
  In of MODEL   16
    1    H    THR  56           H        THR  56  -1.870 -12.466   9.144
    2    HA   THR  56           HA       THR  56   0.219 -14.058   8.240
    3    HB   THR  56           HB       THR  56  -1.086 -14.081  10.975
    4    HG1  THR  56           HG1      THR  56   0.202 -12.214   9.718
    5   HG21  THR  56          HG21      THR  56   1.595 -15.111  10.012
    6   HG23  THR  56          HG22      THR  56   0.282 -16.063  10.708
    7   HG22  THR  56          HG23      THR  56   1.164 -14.909  11.709

  No H/Q in entry =           7
  In of MODEL   16
    1    H    LYS  57           H        LYS  57  -2.900 -15.104   9.598
    2    HA   LYS  57           HA       LYS  57  -2.441 -17.898   9.365
    3    HB2  LYS  57           HB2      LYS  57  -4.267 -16.820  10.703
    4    HB3  LYS  57           HB3      LYS  57  -5.055 -16.364   9.199
    5    HG2  LYS  57           HG2      LYS  57  -5.311 -18.715   8.580
    6    HG3  LYS  57           HG3      LYS  57  -4.451 -19.215  10.034
    7    HD2  LYS  57           HD2      LYS  57  -6.225 -18.177  11.425
    8    HD3  LYS  57           HD3      LYS  57  -7.101 -17.730   9.960
    9    HE2  LYS  57           HE2      LYS  57  -6.405 -20.568  10.803
   10    HE3  LYS  57           HE3      LYS  57  -8.004 -19.838  10.917
   11    HZ3  LYS  57           HZ1      LYS  57  -8.268 -20.720   8.895
   12    HZ2  LYS  57           HZ2      LYS  57  -6.600 -20.866   8.612
   13    HZ1  LYS  57           HZ3      LYS  57  -7.379 -19.377   8.357

  No H/Q in entry =          13
  In of MODEL   16
    1    H    LEU  58           H        LEU  58  -3.777 -15.471   7.175
    2    HA   LEU  58           HA       LEU  58  -4.565 -17.308   5.174
    3    HB2  LEU  58           HB2      LEU  58  -3.971 -14.357   5.028
    4    HB3  LEU  58           HB3      LEU  58  -4.627 -15.302   3.690
    5    HG   LEU  58           HG       LEU  58  -5.915 -15.117   6.433
    6   HD11  LEU  58          HD11      LEU  58  -6.215 -13.482   3.934
    7   HD13  LEU  58          HD12      LEU  58  -6.213 -12.967   5.621
    8   HD12  LEU  58          HD13      LEU  58  -7.630 -13.770   4.948
    9   HD22  LEU  58          HD21      LEU  58  -6.867 -17.034   5.569
   10   HD21  LEU  58          HD22      LEU  58  -6.524 -16.588   3.897
   11   HD23  LEU  58          HD23      LEU  58  -7.893 -15.865   4.741

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  59           H        ILE  59  -1.438 -16.079   6.039
    2    HA   ILE  59           HA       ILE  59  -0.329 -16.813   3.409
    3    HB   ILE  59           HB       ILE  59   0.426 -14.738   4.975
    4   HG12  ILE  59          HG12      ILE  59   2.515 -16.390   3.537
    5   HG13  ILE  59          HG13      ILE  59   1.327 -15.432   2.692
    6   HG23  ILE  59          HG21      ILE  59   2.269 -15.211   6.370
    7   HG22  ILE  59          HG22      ILE  59   2.525 -16.792   5.669
    8   HG21  ILE  59          HG23      ILE  59   1.161 -16.508   6.748
    9   HD12  ILE  59          HD11      ILE  59   3.436 -14.181   2.999
   10   HD11  ILE  59          HD12      ILE  59   3.263 -14.355   4.743
   11   HD13  ILE  59          HD13      ILE  59   2.095 -13.399   3.832

  No H/Q in entry =          11
  In of MODEL   16
    1    H    GLU  60           H        GLU  60  -0.345 -17.905   6.781
    2    HA   GLU  60           HA       GLU  60   1.695 -19.875   6.532
    3    HB2  GLU  60           HB2      GLU  60   0.904 -19.073   8.714
    4    HB3  GLU  60           HB3      GLU  60  -0.682 -19.775   8.407
    5    HG2  GLU  60           HG2      GLU  60   0.336 -22.025   8.285
    6    HG3  GLU  60           HG3      GLU  60   1.922 -21.320   8.592

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLY  61           H        GLY  61  -1.813 -19.991   6.035
    2    HA3  GLY  61           HA2      GLY  61  -1.550 -22.786   5.089
    3    HA2  GLY  61           HA3      GLY  61  -3.040 -22.054   5.675

  No H/Q in entry =           3
  In of MODEL   16
    1    H    ASP  62           H        ASP  62  -0.810 -20.475   3.472
    2    HA   ASP  62           HA       ASP  62  -2.906 -19.971   1.579
    3    HB2  ASP  62           HB2      ASP  62  -1.125 -18.808   0.327
    4    HB3  ASP  62           HB3      ASP  62  -1.162 -18.319   2.018

  No H/Q in entry =           4
  In of MODEL   16
    1    H    ALA  63           H        ALA  63  -3.109 -22.566   1.464
    2    HA   ALA  63           HA       ALA  63  -1.291 -24.001  -0.190
    3    HB1  ALA  63           HB1      ALA  63  -2.823 -25.233   1.161
    4    HB3  ALA  63           HB2      ALA  63  -3.225 -25.554  -0.526
    5    HB2  ALA  63           HB3      ALA  63  -4.213 -24.436   0.418

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLY  64           H        GLY  64  -4.202 -22.103  -0.840
    2    HA3  GLY  64           HA2      GLY  64  -4.979 -21.111  -2.761
    3    HA2  GLY  64           HA3      GLY  64  -3.421 -21.445  -3.498

  No H/Q in entry =           3
  In of MODEL   16
    1    H    GLU  65           H        GLU  65  -4.778 -21.843  -5.447
    2    HA   GLU  65           HA       GLU  65  -6.628 -23.971  -5.544
    3    HB2  GLU  65           HB2      GLU  65  -5.006 -22.653  -7.719
    4    HB3  GLU  65           HB3      GLU  65  -6.262 -23.853  -8.024
    5    HG2  GLU  65           HG2      GLU  65  -7.924 -22.444  -6.913
    6    HG3  GLU  65           HG3      GLU  65  -6.682 -21.262  -6.508

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLY  66           H        GLY  66  -3.207 -23.832  -6.211
    2    HA3  GLY  66           HA2      GLY  66  -3.083 -26.768  -6.444
    3    HA2  GLY  66           HA3      GLY  66  -1.986 -25.676  -7.265

  No H/Q in entry =           3
  In of MODEL   16
    1    H    LYS  67           H        LYS  67  -0.785 -27.584  -5.996
    2    HA   LYS  67           HA       LYS  67  -0.317 -27.418  -3.265
    3    HB2  LYS  67           HB2      LYS  67   1.423 -28.432  -5.507
    4    HB3  LYS  67           HB3      LYS  67   1.785 -28.677  -3.794
    5    HG2  LYS  67           HG2      LYS  67  -0.408 -29.754  -3.473
    6    HG3  LYS  67           HG3      LYS  67  -0.784 -29.508  -5.177
    7    HD2  LYS  67           HD2      LYS  67   1.128 -30.933  -5.808
    8    HD3  LYS  67           HD3      LYS  67   1.502 -31.183  -4.101
    9    HE2  LYS  67           HE2      LYS  67  -0.716 -32.201  -3.753
   10    HE3  LYS  67           HE3      LYS  67  -1.105 -31.942  -5.453
   11    HZ2  LYS  67           HZ1      LYS  67  -0.207 -34.216  -4.727
   12    HZ1  LYS  67           HZ2      LYS  67   1.308 -33.449  -4.680
   13    HZ3  LYS  67           HZ3      LYS  67   0.429 -33.511  -6.132

  No H/Q in entry =          13
  In of MODEL   16
    1    H    MET  68           H        MET  68   2.074 -26.456  -5.668
    2    HA   MET  68           HA       MET  68   3.689 -24.954  -3.913
    3    HB2  MET  68           HB2      MET  68   3.500 -25.178  -6.902
    4    HB3  MET  68           HB3      MET  68   4.652 -24.086  -6.131
    5    HG2  MET  68           HG2      MET  68   4.435 -27.034  -5.465
    6    HG3  MET  68           HG3      MET  68   5.579 -26.381  -6.640
    7    HE1  MET  68           HE1      MET  68   7.041 -27.723  -5.401
    8    HE3  MET  68           HE2      MET  68   6.717 -27.951  -3.684
    9    HE2  MET  68           HE3      MET  68   8.142 -27.048  -4.192

  No H/Q in entry =           9
  In of MODEL   16
    1    H    LYS  69           H        LYS  69   1.163 -23.914  -6.192
    2    HA   LYS  69           HA       LYS  69   1.698 -21.145  -5.909
    3    HB2  LYS  69           HB2      LYS  69  -0.692 -22.595  -7.004
    4    HB3  LYS  69           HB3      LYS  69  -0.524 -20.836  -7.020
    5    HG2  LYS  69           HG2      LYS  69   1.604 -21.038  -8.238
    6    HG3  LYS  69           HG3      LYS  69   1.452 -22.794  -8.223
    7    HD2  LYS  69           HD2      LYS  69  -0.638 -22.631  -9.518
    8    HD3  LYS  69           HD3      LYS  69  -0.493 -20.871  -9.531
    9    HE2  LYS  69           HE2      LYS  69   1.653 -21.046 -10.726
   10    HE3  LYS  69           HE3      LYS  69   1.529 -22.805 -10.701
   11    HZ1  LYS  69           HZ1      LYS  69  -0.827 -22.127 -11.753
   12    HZ3  LYS  69           HZ2      LYS  69   0.550 -22.497 -12.675
   13    HZ2  LYS  69           HZ3      LYS  69   0.146 -20.877 -12.360

  No H/Q in entry =          13
  In of MODEL   16
    1    H    VAL  70           H        VAL  70   0.090 -19.494  -5.217
    2    HA   VAL  70           HA       VAL  70  -1.322 -20.281  -2.729
    3    HB   VAL  70           HB       VAL  70  -0.626 -18.095  -1.774
    4   HG12  VAL  70          HG11      VAL  70   1.923 -18.683  -1.739
    5   HG11  VAL  70          HG12      VAL  70   1.429 -20.100  -2.666
    6   HG13  VAL  70          HG13      VAL  70   0.771 -19.828  -1.053
    7   HG22  VAL  70          HG21      VAL  70  -0.295 -16.765  -3.775
    8   HG21  VAL  70          HG22      VAL  70   0.921 -17.889  -4.380
    9   HG23  VAL  70          HG23      VAL  70   1.275 -16.885  -2.976

  No H/Q in entry =           9
  In of MODEL   16
    1    H    SER  71           H        SER  71  -2.935 -18.618  -2.075
    2    HA   SER  71           HA       SER  71  -4.813 -18.090  -4.118
    3    HB2  SER  71           HB2      SER  71  -5.390 -18.281  -1.687
    4    HB3  SER  71           HB3      SER  71  -4.576 -16.747  -1.400
    5    HG   SER  71           HG       SER  71  -6.054 -15.902  -3.058

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU  72           H        LEU  72  -5.074 -16.415  -5.454
    2    HA   LEU  72           HA       LEU  72  -2.974 -14.594  -5.937
    3    HB2  LEU  72           HB2      LEU  72  -5.837 -14.663  -6.888
    4    HB3  LEU  72           HB3      LEU  72  -4.642 -13.507  -7.468
    5    HG   LEU  72           HG       LEU  72  -4.250 -16.517  -7.589
    6   HD13  LEU  72          HD11      LEU  72  -4.825 -16.330  -9.969
    7   HD12  LEU  72          HD12      LEU  72  -5.143 -14.607  -9.770
    8   HD11  LEU  72          HD13      LEU  72  -6.177 -15.792  -8.973
    9   HD21  LEU  72          HD21      LEU  72  -2.736 -14.111  -8.580
   10   HD23  LEU  72          HD22      LEU  72  -2.644 -15.604  -9.499
   11   HD22  LEU  72          HD23      LEU  72  -2.112 -15.571  -7.821

  No H/Q in entry =          11
  In of MODEL   16
    1    H    VAL  73           H        VAL  73  -6.073 -14.248  -4.315
    2    HA   VAL  73           HA       VAL  73  -6.134 -11.476  -3.974
    3    HB   VAL  73           HB       VAL  73  -7.845 -11.841  -2.381
    4   HG12  VAL  73          HG11      VAL  73  -7.894 -14.240  -4.229
    5   HG11  VAL  73          HG12      VAL  73  -8.274 -12.598  -4.746
    6   HG13  VAL  73          HG13      VAL  73  -9.284 -13.398  -3.541
    7   HG22  VAL  73          HG21      VAL  73  -7.026 -13.285  -0.754
    8   HG21  VAL  73          HG22      VAL  73  -6.388 -14.423  -1.941
    9   HG23  VAL  73          HG23      VAL  73  -8.120 -14.365  -1.618

  No H/Q in entry =           9
  In of MODEL   16
    1    H    LEU  74           H        LEU  74  -4.186 -13.828  -2.378
    2    HA   LEU  74           HA       LEU  74  -3.786 -12.676   0.141
    3    HB2  LEU  74           HB2      LEU  74  -2.991 -14.893  -0.354
    4    HB3  LEU  74           HB3      LEU  74  -1.932 -14.275  -1.621
    5    HG   LEU  74           HG       LEU  74  -0.647 -13.012   0.074
    6   HD13  LEU  74          HD11      LEU  74  -2.206 -12.533   1.793
    7   HD12  LEU  74          HD12      LEU  74  -1.148 -13.750   2.509
    8   HD11  LEU  74          HD13      LEU  74  -2.736 -14.212   1.894
    9   HD23  LEU  74          HD21      LEU  74  -0.834 -15.765   1.176
   10   HD22  LEU  74          HD22      LEU  74   0.562 -14.835   0.679
   11   HD21  LEU  74          HD23      LEU  74  -0.444 -15.591  -0.533

  No H/Q in entry =          11
  In of MODEL   16
    1    H    VAL  75           H        VAL  75  -1.892 -12.282  -2.814
    2    HA   VAL  75           HA       VAL  75  -0.107 -10.345  -1.806
    3    HB   VAL  75           HB       VAL  75  -1.054 -10.848  -4.629
    4   HG13  VAL  75          HG11      VAL  75  -0.211  -8.537  -4.433
    5   HG12  VAL  75          HG12      VAL  75   0.987  -9.530  -5.249
    6   HG11  VAL  75          HG13      VAL  75   1.204  -9.110  -3.558
    7   HG21  VAL  75          HG21      VAL  75   0.178 -12.690  -3.478
    8   HG23  VAL  75          HG22      VAL  75   1.502 -11.572  -3.151
    9   HG22  VAL  75          HG23      VAL  75   1.106 -12.008  -4.815

  No H/Q in entry =           9
  In of MODEL   16
    1    H    GLU  76           H        GLU  76  -3.256 -10.020  -3.471
    2    HA   GLU  76           HA       GLU  76  -3.323  -7.207  -3.582
    3    HB2  GLU  76           HB2      GLU  76  -4.973  -8.640  -4.749
    4    HB3  GLU  76           HB3      GLU  76  -5.616  -9.167  -3.202
    5    HG2  GLU  76           HG2      GLU  76  -7.094  -7.463  -4.057
    6    HG3  GLU  76           HG3      GLU  76  -6.223  -6.758  -2.709

  No H/Q in entry =           6
  In of MODEL   16
    1    H    ALA  77           H        ALA  77  -4.426  -9.432  -1.037
    2    HA   ALA  77           HA       ALA  77  -5.397  -7.429   0.713
    3    HB3  ALA  77           HB1      ALA  77  -5.330  -9.145   2.434
    4    HB1  ALA  77           HB2      ALA  77  -4.254 -10.136   1.450
    5    HB2  ALA  77           HB3      ALA  77  -5.914  -9.855   0.930

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLN  78           H        GLN  78  -2.241  -8.963   0.360
    2    HA   GLN  78           HA       GLN  78  -0.993  -7.789   2.608
    3    HB2  GLN  78           HB2      GLN  78  -0.119  -9.730   1.261
    4    HB3  GLN  78           HB3      GLN  78   0.313  -8.586  -0.007
    5    HG2  GLN  78           HG2      GLN  78   1.764  -7.378   1.572
    6    HG3  GLN  78           HG3      GLN  78   1.334  -8.517   2.846
    7   HE21  GLN  78          HE21      GLN  78   4.057  -8.222   1.992
    8   HE22  GLN  78          HE22      GLN  78   4.529  -9.657   1.217

  No H/Q in entry =           8
  In of MODEL   16
    1    H    LEU  79           H        LEU  79  -1.359  -6.741  -0.743
    2    HA   LEU  79           HA       LEU  79   0.317  -4.506  -0.734
    3    HB2  LEU  79           HB2      LEU  79  -0.702  -5.325  -2.787
    4    HB3  LEU  79           HB3      LEU  79  -2.309  -4.938  -2.183
    5    HG   LEU  79           HG       LEU  79  -1.776  -2.549  -2.164
    6   HD13  LEU  79          HD11      LEU  79   0.462  -2.293  -1.648
    7   HD12  LEU  79          HD12      LEU  79   0.513  -2.011  -3.388
    8   HD11  LEU  79          HD13      LEU  79   0.974  -3.585  -2.736
    9   HD23  LEU  79          HD21      LEU  79  -1.138  -2.356  -4.716
   10   HD22  LEU  79          HD22      LEU  79  -2.661  -3.109  -4.257
   11   HD21  LEU  79          HD23      LEU  79  -1.283  -4.113  -4.696

  No H/Q in entry =          11
  In of MODEL   16
    1    H    HIS  80           H        HIS  80  -3.151  -4.681   0.086
    2    HA   HIS  80           HA       HIS  80  -3.355  -1.923   0.740
    3    HB2  HIS  80           HB2      HIS  80  -5.047  -4.338   1.064
    4    HB3  HIS  80           HB3      HIS  80  -5.375  -2.996   2.163
    5    HD1  HIS  80           HD1      HIS  80  -6.998  -1.369   1.247
    6    HD2  HIS  80           HD2      HIS  80  -4.792  -3.182  -1.791
    7    HE1  HIS  80           HE1      HIS  80  -7.838  -0.383  -0.937
    8    HE2  HIS  80           HE2      HIS  80  -6.499  -1.483  -2.798

  No H/Q in entry =           8
  In of MODEL   16
    1    H    LEU  81           H        LEU  81  -2.858  -4.809   2.744
    2    HA   LEU  81           HA       LEU  81  -2.856  -3.454   5.224
    3    HB2  LEU  81           HB2      LEU  81  -1.625  -6.068   4.355
    4    HB3  LEU  81           HB3      LEU  81  -1.604  -5.504   6.027
    5    HG   LEU  81           HG       LEU  81  -4.146  -5.772   4.396
    6   HD12  LEU  81          HD11      LEU  81  -4.443  -7.833   5.949
    7   HD11  LEU  81          HD12      LEU  81  -2.692  -7.755   6.138
    8   HD13  LEU  81          HD13      LEU  81  -3.397  -7.994   4.539
    9   HD23  LEU  81          HD21      LEU  81  -4.993  -5.970   6.896
   10   HD22  LEU  81          HD22      LEU  81  -4.673  -4.382   6.201
   11   HD21  LEU  81          HD23      LEU  81  -3.485  -5.134   7.266

  No H/Q in entry =          11
  In of MODEL   16
    1    H    MET  82           H        MET  82  -0.167  -4.355   3.061
    2    HA   MET  82           HA       MET  82   1.910  -3.447   4.745
    3    HB2  MET  82           HB2      MET  82   1.701  -3.799   1.754
    4    HB3  MET  82           HB3      MET  82   3.180  -3.221   2.518
    5    HG2  MET  82           HG2      MET  82   1.781  -5.813   3.249
    6    HG3  MET  82           HG3      MET  82   3.154  -5.702   2.151
    7    HE3  MET  82           HE1      MET  82   6.163  -4.949   4.137
    8    HE2  MET  82           HE2      MET  82   5.237  -3.587   3.513
    9    HE1  MET  82           HE3      MET  82   5.332  -5.080   2.582

  No H/Q in entry =           9
  In of MODEL   16
    1    H    THR  83           H        THR  83   0.086  -1.820   2.180
    2    HA   THR  83           HA       THR  83   1.490   0.633   2.260
    3    HB   THR  83           HB       THR  83  -0.687   1.547   1.267
    4    HG1  THR  83           HG1      THR  83  -2.333   0.245   1.162
    5   HG22  THR  83          HG21      THR  83  -0.408  -0.276  -0.727
    6   HG21  THR  83          HG22      THR  83   1.092  -0.561   0.154
    7   HG23  THR  83          HG23      THR  83   0.727   1.049  -0.468

  No H/Q in entry =           7
  In of MODEL   16
    1    H    SER  84           H        SER  84  -1.515  -0.403   3.860
    2    HA   SER  84           HA       SER  84  -2.021   2.030   5.195
    3    HB2  SER  84           HB2      SER  84  -2.846  -0.809   5.768
    4    HB3  SER  84           HB3      SER  84  -3.346   0.534   6.796
    5    HG   SER  84           HG       SER  84  -3.799   0.209   4.004

  No H/Q in entry =           5
  In of MODEL   16
    1    H    MET  85           H        MET  85  -0.304  -0.893   6.338
    2    HA   MET  85           HA       MET  85   0.208   0.044   8.940
    3    HB2  MET  85           HB2      MET  85   0.508  -2.301   8.273
    4    HB3  MET  85           HB3      MET  85   1.889  -1.837   7.277
    5    HG2  MET  85           HG2      MET  85   3.063  -0.995   9.270
    6    HG3  MET  85           HG3      MET  85   1.674  -1.413  10.272
    7    HE2  MET  85           HE1      MET  85   5.172  -3.071   9.007
    8    HE1  MET  85           HE2      MET  85   4.117  -2.413   7.758
    9    HE3  MET  85           HE3      MET  85   4.362  -4.153   7.868

  No H/Q in entry =           9
  In of MODEL   16
    1    H    LEU  86           H        LEU  86   2.147   0.295   5.991
    2    HA   LEU  86           HA       LEU  86   4.355   1.616   7.145
    3    HB2  LEU  86           HB2      LEU  86   4.171   0.525   4.840
    4    HB3  LEU  86           HB3      LEU  86   3.360   2.002   4.321
    5    HG   LEU  86           HG       LEU  86   5.383   3.257   5.300
    6   HD11  LEU  86          HD11      LEU  86   6.094   0.651   6.111
    7   HD13  LEU  86          HD12      LEU  86   7.093   2.099   6.204
    8   HD12  LEU  86          HD13      LEU  86   7.207   1.046   4.797
    9   HD23  LEU  86          HD21      LEU  86   6.108   1.488   2.957
   10   HD22  LEU  86          HD22      LEU  86   6.497   3.187   3.214
   11   HD21  LEU  86          HD23      LEU  86   4.846   2.713   2.814

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ALA  87           H        ALA  87   1.442   2.846   5.552
    2    HA   ALA  87           HA       ALA  87   2.029   5.578   5.626
    3    HB1  ALA  87           HB1      ALA  87  -0.275   3.942   5.087
    4    HB3  ALA  87           HB2      ALA  87   0.032   5.602   4.582
    5    HB2  ALA  87           HB3      ALA  87  -0.763   5.284   6.125

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ARG  88           H        ARG  88   0.341   3.580   8.021
    2    HA   ARG  88           HA       ARG  88  -0.179   5.635   9.859
    3    HB2  ARG  88           HB2      ARG  88  -1.112   3.281   9.933
    4    HB3  ARG  88           HB3      ARG  88   0.429   2.787  10.643
    5    HG2  ARG  88           HG2      ARG  88  -0.056   4.866  12.255
    6    HG3  ARG  88           HG3      ARG  88  -1.721   4.535  11.797
    7    HD2  ARG  88           HD2      ARG  88  -1.825   2.691  13.050
    8    HD3  ARG  88           HD3      ARG  88  -0.233   2.111  12.524
    9    HE   ARG  88           HE       ARG  88  -0.774   3.382  14.973
   10   HH21  ARG  88          HH11      ARG  88   0.779   4.403  16.210
   11   HH22  ARG  88          HH12      ARG  88   2.298   4.831  15.506
   12   HH11  ARG  88          HH21      ARG  88   1.510   3.560  12.399
   13   HH12  ARG  88          HH22      ARG  88   2.721   4.338  13.360

  No H/Q in entry =          13
  In of MODEL   16
    1    H    GLU  89           H        GLU  89   2.624   3.424   9.649
    2    HA   GLU  89           HA       GLU  89   3.879   4.325  11.992
    3    HB2  GLU  89           HB2      GLU  89   4.546   2.303  10.657
    4    HB3  GLU  89           HB3      GLU  89   5.320   3.395   9.507
    5    HG2  GLU  89           HG2      GLU  89   6.800   4.253  11.250
    6    HG3  GLU  89           HG3      GLU  89   5.966   3.299  12.473

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LEU  90           H        LEU  90   4.198   5.471   8.660
    2    HA   LEU  90           HA       LEU  90   6.121   7.480   9.241
    3    HB2  LEU  90           HB2      LEU  90   4.120   7.133   7.011
    4    HB3  LEU  90           HB3      LEU  90   5.346   8.408   7.030
    5    HG   LEU  90           HG       LEU  90   6.029   5.475   7.376
    6   HD12  LEU  90          HD11      LEU  90   6.780   5.701   4.937
    7   HD11  LEU  90          HD12      LEU  90   5.760   7.138   4.881
    8   HD13  LEU  90          HD13      LEU  90   5.045   5.564   5.229
    9   HD22  LEU  90          HD21      LEU  90   7.921   6.634   8.057
   10   HD21  LEU  90          HD22      LEU  90   7.568   8.033   7.044
   11   HD23  LEU  90          HD23      LEU  90   8.234   6.568   6.324

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  91           H        ILE  91   2.582   7.482   9.086
    2    HA   ILE  91           HA       ILE  91   2.229  10.255   9.525
    3    HB   ILE  91           HB       ILE  91   0.446   7.875  10.074
    4   HG12  ILE  91          HG12      ILE  91   0.192  10.148   8.080
    5   HG13  ILE  91          HG13      ILE  91   1.059   8.655   7.715
    6   HG22  ILE  91          HG21      ILE  91  -1.295   9.927  10.127
    7   HG21  ILE  91          HG22      ILE  91   0.103  10.766  10.798
    8   HG23  ILE  91          HG23      ILE  91  -0.530   9.329  11.599
    9   HD13  ILE  91          HD11      ILE  91  -0.881   7.361   7.761
   10   HD12  ILE  91          HD12      ILE  91  -1.475   8.871   7.072
   11   HD11  ILE  91          HD13      ILE  91  -1.747   8.513   8.778

  No H/Q in entry =          11
  In of MODEL   16
    1    H    THR  92           H        THR  92   2.639   7.524  11.738
    2    HA   THR  92           HA       THR  92   2.185   8.906  14.156
    3    HB   THR  92           HB       THR  92   4.005   6.576  13.503
    4    HG1  THR  92           HG1      THR  92   2.039   5.810  13.402
    5   HG22  THR  92          HG21      THR  92   3.618   6.300  16.137
    6   HG21  THR  92          HG22      THR  92   3.546   8.059  16.057
    7   HG23  THR  92          HG23      THR  92   4.983   7.207  15.490

  No H/Q in entry =           7
  In of MODEL   16
    1    H    GLU  93           H        GLU  93   5.142   8.462  12.229
    2    HA   GLU  93           HA       GLU  93   6.886   9.903  13.924
    3    HB2  GLU  93           HB2      GLU  93   6.982   9.577  10.910
    4    HB3  GLU  93           HB3      GLU  93   8.318  10.117  11.925
    5    HG2  GLU  93           HG2      GLU  93   6.920   7.476  12.381
    6    HG3  GLU  93           HG3      GLU  93   8.305   7.630  11.307

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LEU  94           H        LEU  94   4.838  10.897  11.203
    2    HA   LEU  94           HA       LEU  94   5.631  13.605  11.093
    3    HB2  LEU  94           HB2      LEU  94   3.048  12.224  10.340
    4    HB3  LEU  94           HB3      LEU  94   3.299  13.952  10.092
    5    HG   LEU  94           HG       LEU  94   5.328  11.969   9.054
    6   HD11  LEU  94          HD11      LEU  94   2.586  12.502   7.983
    7   HD13  LEU  94          HD12      LEU  94   3.576  11.050   7.866
    8   HD12  LEU  94          HD13      LEU  94   3.907  12.428   6.816
    9   HD23  LEU  94          HD21      LEU  94   5.572  13.800   7.324
   10   HD22  LEU  94          HD22      LEU  94   5.981  14.301   8.965
   11   HD21  LEU  94          HD23      LEU  94   4.430  14.758   8.261

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  95           H        ILE  95   3.097  11.983  12.986
    2    HA   ILE  95           HA       ILE  95   2.040  14.332  14.169
    3    HB   ILE  95           HB       ILE  95   2.070  11.455  15.106
    4   HG12  ILE  95          HG12      ILE  95  -0.158  13.212  14.044
    5   HG13  ILE  95          HG13      ILE  95   0.807  12.153  13.019
    6   HG21  ILE  95          HG21      ILE  95   0.772  13.925  16.294
    7   HG23  ILE  95          HG22      ILE  95   1.825  12.765  17.106
    8   HG22  ILE  95          HG23      ILE  95   0.193  12.293  16.629
    9   HD13  ILE  95          HD11      ILE  95  -0.088  10.214  13.944
   10   HD12  ILE  95          HD12      ILE  95  -1.476  11.296  14.013
   11   HD11  ILE  95          HD13      ILE  95  -0.513  11.009  15.461

  No H/Q in entry =          11
  In of MODEL   16
    1    H    GLU  96           H        GLU  96   4.645  12.132  15.179
    2    HA   GLU  96           HA       GLU  96   5.188  13.344  17.667
    3    HB2  GLU  96           HB2      GLU  96   6.149  11.188  17.031
    4    HB3  GLU  96           HB3      GLU  96   7.081  11.961  15.750
    5    HG2  GLU  96           HG2      GLU  96   8.723  12.526  17.213
    6    HG3  GLU  96           HG3      GLU  96   7.569  13.336  18.262

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LEU  97           H        LEU  97   6.265  14.109  14.380
    2    HA   LEU  97           HA       LEU  97   8.137  16.119  15.088
    3    HB2  LEU  97           HB2      LEU  97   6.555  15.550  12.591
    4    HB3  LEU  97           HB3      LEU  97   7.565  16.988  12.709
    5    HG   LEU  97           HG       LEU  97   8.610  14.199  13.283
    6   HD12  LEU  97          HD11      LEU  97   9.611  14.389  10.968
    7   HD11  LEU  97          HD12      LEU  97   8.551  15.772  10.696
    8   HD13  LEU  97          HD13      LEU  97   7.861  14.177  10.996
    9   HD23  LEU  97          HD21      LEU  97  10.773  15.488  12.540
   10   HD22  LEU  97          HD22      LEU  97  10.149  15.761  14.166
   11   HD21  LEU  97          HD23      LEU  97   9.830  16.937  12.892

  No H/Q in entry =          11
  In of MODEL   16
    1    H    HIS  98           H        HIS  98   4.647  16.230  14.425
    2    HA   HIS  98           HA       HIS  98   4.329  19.028  14.548
    3    HB2  HIS  98           HB2      HIS  98   2.452  16.769  15.279
    4    HB3  HIS  98           HB3      HIS  98   1.974  18.466  15.326
    5    HD1  HIS  98           HD1      HIS  98   3.018  15.748  12.936
    6    HD2  HIS  98           HD2      HIS  98   1.617  19.672  12.793
    7    HE1  HIS  98           HE1      HIS  98   2.461  16.222  10.508
    8    HE2  HIS  98           HE2      HIS  98   1.612  18.606  10.401

  No H/Q in entry =           8
  In of MODEL   16
    1    H    GLU  99           H        GLU  99   4.473  16.551  17.058
    2    HA   GLU  99           HA       GLU  99   3.849  18.251  19.247
    3    HB2  GLU  99           HB2      GLU  99   3.776  15.769  19.354
    4    HB3  GLU  99           HB3      GLU  99   5.536  15.735  19.250
    5    HG2  GLU  99           HG2      GLU  99   5.712  17.037  21.319
    6    HG3  GLU  99           HG3      GLU  99   3.958  17.167  21.410

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LYS 100           H        LYS 100   6.912  17.333  17.693
    2    HA   LYS 100           HA       LYS 100   8.554  18.753  19.547
    3    HB2  LYS 100           HB2      LYS 100   9.065  17.819  16.713
    4    HB3  LYS 100           HB3      LYS 100  10.287  18.601  17.721
    5    HG2  LYS 100           HG2      LYS 100   9.918  16.856  19.469
    6    HG3  LYS 100           HG3      LYS 100   8.794  16.040  18.378
    7    HD2  LYS 100           HD2      LYS 100  10.594  15.762  16.716
    8    HD3  LYS 100           HD3      LYS 100  11.723  16.589  17.792
    9    HE2  LYS 100           HE2      LYS 100  11.334  14.839  19.516
   10    HE3  LYS 100           HE3      LYS 100  10.267  13.991  18.392
   11    HZ1  LYS 100           HZ1      LYS 100  13.085  14.676  17.740
   12    HZ3  LYS 100           HZ2      LYS 100  12.050  13.611  16.914
   13    HZ2  LYS 100           HZ3      LYS 100  12.637  13.202  18.456

  No H/Q in entry =          13
  In of MODEL   16
    1    H    LEU 101           H        LEU 101   6.861  19.656  16.584
    2    HA   LEU 101           HA       LEU 101   8.059  22.219  16.241
    3    HB2  LEU 101           HB2      LEU 101   5.474  20.966  15.354
    4    HB3  LEU 101           HB3      LEU 101   5.714  22.697  15.140
    5    HG   LEU 101           HG       LEU 101   7.765  20.690  14.187
    6   HD12  LEU 101          HD11      LEU 101   6.614  21.179  11.897
    7   HD11  LEU 101          HD12      LEU 101   5.209  21.604  12.873
    8   HD13  LEU 101          HD13      LEU 101   5.884  19.978  12.963
    9   HD21  LEU 101          HD21      LEU 101   7.120  23.596  13.617
   10   HD23  LEU 101          HD22      LEU 101   8.109  22.637  12.517
   11   HD22  LEU 101          HD23      LEU 101   8.646  22.905  14.175

  No H/Q in entry =          11
  In of MODEL   16
    1    H    LYS 102           H        LYS 102   6.523  21.083  18.858
    2    HA   LYS 102           HA       LYS 102   5.880  22.178  20.784
    3    HB2  LYS 102           HB2      LYS 102   7.153  24.172  19.654
    4    HB3  LYS 102           HB3      LYS 102   5.551  24.765  19.273
    5    HG2  LYS 102           HG2      LYS 102   6.924  24.529  21.929
    6    HG3  LYS 102           HG3      LYS 102   5.964  25.849  21.292
    7    HD2  LYS 102           HD2      LYS 102   4.735  23.208  22.179
    8    HD3  LYS 102           HD3      LYS 102   4.972  24.575  23.257
    9    HE2  LYS 102           HE2      LYS 102   2.699  24.152  21.765
   10    HE3  LYS 102           HE3      LYS 102   3.191  25.704  22.442
   11    HZ2  LYS 102           HZ1      LYS 102   2.665  25.799  20.061
   12    HZ1  LYS 102           HZ2      LYS 102   3.934  24.723  19.745
   13    HZ3  LYS 102           HZ3      LYS 102   4.266  26.258  20.382

  No H/Q in entry =          13
  In of MODEL   16
    1    H    ALA 103           H        ALA 103   4.239  23.700  18.007
    2    HA   ALA 103           HA       ALA 103   1.779  24.265  18.884
    3    HB1  ALA 103           HB1      ALA 103   0.891  23.409  16.644
    4    HB2  ALA 103           HB2      ALA 103   2.542  22.880  16.319
    5    HB3  ALA 103           HB3      ALA 103   2.196  24.591  16.578

  No H/Q in entry =           5
  In of MODEL   16
    1    H1   ALA   1           H3       ALA   1  10.700 -20.285  -6.190
    2    H2   ALA   1           H2       ALA   1   9.740 -20.502  -7.577
    3    H3   ALA   1           H1       ALA   1   9.304 -21.245  -6.112
    4    HA   ALA   1           HA       ALA   1  10.355 -23.051  -6.842
    5    HB1  ALA   1           HB1      ALA   1  10.453 -22.700  -9.119
    6    HB2  ALA   1           HB2      ALA   1  12.179 -22.539  -8.787
    7    HB3  ALA   1           HB3      ALA   1  11.173 -21.098  -8.946

  No H/Q in entry =           7
  In of MODEL   16
    1    H    GLU   2           H        GLU   2  12.644 -23.989  -6.892
    2    HA   GLU   2           HA       GLU   2  14.020 -23.891  -4.678
    3    HB2  GLU   2           HB2      GLU   2  15.381 -23.763  -7.375
    4    HB3  GLU   2           HB3      GLU   2  16.109 -24.365  -5.886
    5    HG2  GLU   2           HG2      GLU   2  15.104 -26.388  -6.121
    6    HG3  GLU   2           HG3      GLU   2  13.529 -25.651  -6.385

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLU   3           H        GLU   3  15.786 -22.027  -7.083
    2    HA   GLU   3           HA       GLU   3  16.927 -20.326  -5.128
    3    HB2  GLU   3           HB2      GLU   3  16.877 -20.336  -8.139
    4    HB3  GLU   3           HB3      GLU   3  17.614 -19.000  -7.255
    5    HG2  GLU   3           HG2      GLU   3  19.282 -20.362  -6.324
    6    HG3  GLU   3           HG3      GLU   3  18.343 -21.834  -6.541

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LEU   4           H        LEU   4  14.645 -19.500  -7.767
    2    HA   LEU   4           HA       LEU   4  14.164 -16.892  -7.167
    3    HB2  LEU   4           HB2      LEU   4  12.001 -18.880  -7.893
    4    HB3  LEU   4           HB3      LEU   4  11.917 -17.133  -8.098
    5    HG   LEU   4           HG       LEU   4  13.894 -18.991  -9.461
    6   HD13  LEU   4          HD11      LEU   4  12.595 -18.856 -11.373
    7   HD12  LEU   4          HD12      LEU   4  11.878 -17.313 -10.914
    8   HD11  LEU   4          HD13      LEU   4  11.331 -18.804 -10.147
    9   HD23  LEU   4          HD21      LEU   4  14.221 -16.750 -10.820
   10   HD22  LEU   4          HD22      LEU   4  15.079 -16.982  -9.298
   11   HD21  LEU   4          HD23      LEU   4  13.622 -15.993  -9.344

  No H/Q in entry =          11
  In of MODEL   16
    1    H    GLU   5           H        GLU   5  12.691 -19.677  -5.516
    2    HA   GLU   5           HA       GLU   5  11.002 -18.107  -3.822
    3    HB2  GLU   5           HB2      GLU   5  10.609 -20.499  -4.345
    4    HB3  GLU   5           HB3      GLU   5  12.025 -20.911  -3.377
    5    HG2  GLU   5           HG2      GLU   5  10.108 -21.148  -1.945
    6    HG3  GLU   5           HG3      GLU   5  10.951 -19.680  -1.450

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLU   6           H        GLU   6  14.156 -19.669  -3.368
    2    HA   GLU   6           HA       GLU   6  14.499 -18.800  -0.672
    3    HB2  GLU   6           HB2      GLU   6  15.738 -20.712  -1.643
    4    HB3  GLU   6           HB3      GLU   6  16.589 -19.597  -2.715
    5    HG2  GLU   6           HG2      GLU   6  17.529 -18.418  -0.782
    6    HG3  GLU   6           HG3      GLU   6  16.641 -19.476   0.314

  No H/Q in entry =           6
  In of MODEL   16
    1    H    VAL   7           H        VAL   7  15.264 -17.482  -3.826
    2    HA   VAL   7           HA       VAL   7  16.937 -15.342  -2.967
    3    HB   VAL   7           HB       VAL   7  15.237 -15.725  -5.445
    4   HG11  VAL   7          HG11      VAL   7  17.117 -13.498  -4.639
    5   HG13  VAL   7          HG12      VAL   7  15.475 -13.367  -5.266
    6   HG12  VAL   7          HG13      VAL   7  16.789 -13.867  -6.332
    7   HG21  VAL   7          HG21      VAL   7  17.351 -17.168  -4.867
    8   HG23  VAL   7          HG22      VAL   7  18.249 -15.703  -5.270
    9   HG22  VAL   7          HG23      VAL   7  17.219 -16.464  -6.480

  No H/Q in entry =           9
  In of MODEL   16
    1    H    VAL   8           H        VAL   8  13.447 -15.634  -3.528
    2    HA   VAL   8           HA       VAL   8  12.765 -12.928  -3.069
    3    HB   VAL   8           HB       VAL   8  11.165 -15.462  -2.624
    4   HG12  VAL   8          HG11      VAL   8   9.214 -13.792  -2.792
    5   HG11  VAL   8          HG12      VAL   8  10.409 -12.537  -2.465
    6   HG13  VAL   8          HG13      VAL   8  10.117 -13.808  -1.278
    7   HG22  VAL   8          HG21      VAL   8  10.590 -15.339  -4.851
    8   HG21  VAL   8          HG22      VAL   8  12.051 -14.367  -4.995
    9   HG23  VAL   8          HG23      VAL   8  10.486 -13.580  -4.821

  No H/Q in entry =           9
  In of MODEL   16
    1    H    MET   9           H        MET   9  13.044 -15.723  -0.877
    2    HA   MET   9           HA       MET   9  12.217 -14.447   1.486
    3    HB2  MET   9           HB2      MET   9  14.129 -16.716   0.951
    4    HB3  MET   9           HB3      MET   9  13.842 -16.127   2.589
    5    HG2  MET   9           HG2      MET   9  11.423 -16.526   2.315
    6    HG3  MET   9           HG3      MET   9  11.708 -17.115   0.677
    7    HE3  MET   9           HE1      MET   9  14.046 -18.171   4.071
    8    HE2  MET   9           HE2      MET   9  12.555 -18.857   4.709
    9    HE1  MET   9           HE3      MET   9  12.590 -17.175   4.189

  No H/Q in entry =           9
  In of MODEL   16
    1    H    GLY  10           H        GLY  10  15.402 -14.658  -0.063
    2    HA3  GLY  10           HA2      GLY  10  16.848 -13.220   1.903
    3    HA2  GLY  10           HA3      GLY  10  17.316 -13.389   0.212

  No H/Q in entry =           3
  In of MODEL   16
    1    H    LEU  11           H        LEU  11  15.142 -12.187  -1.037
    2    HA   LEU  11           HA       LEU  11  15.809  -9.437  -0.883
    3    HB2  LEU  11           HB2      LEU  11  13.453 -10.867  -2.117
    4    HB3  LEU  11           HB3      LEU  11  13.722  -9.132  -2.283
    5    HG   LEU  11           HG       LEU  11  15.765 -11.230  -3.059
    6   HD13  LEU  11          HD11      LEU  11  14.024 -11.614  -4.580
    7   HD12  LEU  11          HD12      LEU  11  15.021 -10.430  -5.423
    8   HD11  LEU  11          HD13      LEU  11  13.542  -9.918  -4.610
    9   HD22  LEU  11          HD21      LEU  11  16.983  -9.257  -2.838
   10   HD21  LEU  11          HD22      LEU  11  15.601  -8.231  -3.224
   11   HD23  LEU  11          HD23      LEU  11  16.441  -9.099  -4.508

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  12           H        ILE  12  13.050 -11.277   0.386
    2    HA   ILE  12           HA       ILE  12  11.639  -9.059   1.435
    3    HB   ILE  12           HB       ILE  12  11.695 -11.935   2.401
    4   HG12  ILE  12          HG12      ILE  12  11.014 -11.320  -0.056
    5   HG13  ILE  12          HG13      ILE  12   9.999 -12.420   0.856
    6   HG22  ILE  12          HG21      ILE  12   9.400 -11.359   3.294
    7   HG21  ILE  12          HG22      ILE  12   9.749  -9.667   2.942
    8   HG23  ILE  12          HG23      ILE  12  10.725 -10.541   4.121
    9   HD11  ILE  12          HD11      ILE  12   9.534  -9.435   0.617
   10   HD13  ILE  12          HD12      ILE  12   8.453 -10.617   1.352
   11   HD12  ILE  12          HD13      ILE  12   8.738 -10.645  -0.374

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  13           H        ILE  13  14.046 -11.240   2.854
    2    HA   ILE  13           HA       ILE  13  14.067 -10.050   5.429
    3    HB   ILE  13           HB       ILE  13  16.146 -11.610   3.874
    4   HG12  ILE  13          HG12      ILE  13  13.869 -12.589   4.710
    5   HG13  ILE  13          HG13      ILE  13  15.349 -13.506   4.972
    6   HG21  ILE  13          HG21      ILE  13  16.232 -10.569   6.714
    7   HG23  ILE  13          HG22      ILE  13  17.441 -10.364   5.454
    8   HG22  ILE  13          HG23      ILE  13  17.202 -11.945   6.197
    9   HD13  ILE  13          HD11      ILE  13  15.473 -12.751   7.288
   10   HD12  ILE  13          HD12      ILE  13  13.856 -13.378   6.993
   11   HD11  ILE  13          HD13      ILE  13  14.129 -11.641   7.029

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ASN  14           H        ASN  14  16.022  -9.515   2.513
    2    HA   ASN  14           HA       ASN  14  17.748  -7.555   3.570
    3    HB2  ASN  14           HB2      ASN  14  17.741  -8.831   1.259
    4    HB3  ASN  14           HB3      ASN  14  16.837  -7.424   0.715
    5   HD21  ASN  14          HD21      ASN  14  19.283  -7.747  -0.465
    6   HD22  ASN  14          HD22      ASN  14  20.415  -6.651   0.161

  No H/Q in entry =           6
  In of MODEL   16
    1    H    SER  15           H        SER  15  14.638  -7.242   1.870
    2    HA   SER  15           HA       SER  15  14.501  -4.422   1.915
    3    HB2  SER  15           HB2      SER  15  12.172  -4.691   1.416
    4    HB3  SER  15           HB3      SER  15  12.982  -6.053   0.652
    5    HG   SER  15           HG       SER  15  11.530  -7.120   1.767

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLY  16           H        GLY  16  13.425  -6.883   4.226
    2    HA3  GLY  16           HA2      GLY  16  12.184  -5.138   6.074
    3    HA2  GLY  16           HA3      GLY  16  12.812  -6.739   6.444

  No H/Q in entry =           3
  In of MODEL   16
    1    H    GLN  17           H        GLN  17  15.522  -6.383   5.856
    2    HA   GLN  17           HA       GLN  17  16.462  -5.144   8.233
    3    HB2  GLN  17           HB2      GLN  17  17.895  -5.991   5.702
    4    HB3  GLN  17           HB3      GLN  17  18.732  -5.377   7.127
    5    HG2  GLN  17           HG2      GLN  17  17.812  -7.181   8.492
    6    HG3  GLN  17           HG3      GLN  17  16.868  -7.768   7.124
    7   HE21  GLN  17          HE21      GLN  17  19.758  -8.275   8.774
    8   HE22  GLN  17          HE22      GLN  17  20.623  -9.057   7.541

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ALA  18           H        ALA  18  16.270  -4.081   4.869
    2    HA   ALA  18           HA       ALA  18  17.683  -1.674   5.089
    3    HB2  ALA  18           HB1      ALA  18  16.581  -2.908   3.024
    4    HB3  ALA  18           HB2      ALA  18  16.829  -1.162   3.002
    5    HB1  ALA  18           HB3      ALA  18  15.235  -1.822   3.371

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ARG  19           H        ARG  19  14.188  -2.294   5.480
    2    HA   ARG  19           HA       ARG  19  13.492   0.352   6.183
    3    HB2  ARG  19           HB2      ARG  19  11.830  -1.418   5.600
    4    HB3  ARG  19           HB3      ARG  19  12.176  -2.206   7.141
    5    HG2  ARG  19           HG2      ARG  19  11.443  -0.217   8.371
    6    HG3  ARG  19           HG3      ARG  19  11.188   0.651   6.858
    7    HD2  ARG  19           HD2      ARG  19   9.052  -0.163   7.676
    8    HD3  ARG  19           HD3      ARG  19   9.483  -1.044   6.205
    9    HE   ARG  19           HE       ARG  19  10.452  -2.569   8.318
   10   HH21  ARG  19          HH11      ARG  19   9.217  -4.217   9.261
   11   HH22  ARG  19          HH12      ARG  19   7.497  -4.207   9.086
   12   HH11  ARG  19          HH21      ARG  19   7.448  -1.310   7.211
   13   HH12  ARG  19          HH22      ARG  19   6.496  -2.562   7.921

  No H/Q in entry =          13
  In of MODEL   16
    1    H    SER  20           H        SER  20  14.373  -2.462   8.156
    2    HA   SER  20           HA       SER  20  14.073  -1.355  10.688
    3    HB2  SER  20           HB2      SER  20  14.562  -3.675  10.578
    4    HB3  SER  20           HB3      SER  20  16.014  -3.402   9.616
    5    HG   SER  20           HG       SER  20  16.783  -2.202  11.517

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU  21           H        LEU  21  16.921  -1.274   8.558
    2    HA   LEU  21           HA       LEU  21  18.577   0.235  10.295
    3    HB2  LEU  21           HB2      LEU  21  18.565  -0.052   7.283
    4    HB3  LEU  21           HB3      LEU  21  19.808   0.828   8.169
    5    HG   LEU  21           HG       LEU  21  19.100  -2.067   8.727
    6   HD11  LEU  21          HD11      LEU  21  19.968  -1.708   6.400
    7   HD13  LEU  21          HD12      LEU  21  21.041  -2.683   7.403
    8   HD12  LEU  21          HD13      LEU  21  21.420  -0.988   7.098
    9   HD23  LEU  21          HD21      LEU  21  21.590  -1.866   9.609
   10   HD22  LEU  21          HD22      LEU  21  20.273  -1.298  10.628
   11   HD21  LEU  21          HD23      LEU  21  21.222  -0.147   9.702

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ALA  22           H        ALA  22  16.309   1.172   7.729
    2    HA   ALA  22           HA       ALA  22  16.821   3.935   7.734
    3    HB3  ALA  22           HB1      ALA  22  15.435   2.673   6.057
    4    HB2  ALA  22           HB2      ALA  22  14.712   4.181   6.616
    5    HB1  ALA  22           HB3      ALA  22  14.135   2.638   7.248

  No H/Q in entry =           5
  In of MODEL   16
    1    H    TYR  23           H        TYR  23  14.338   2.103   9.570
    2    HA   TYR  23           HA       TYR  23  13.350   4.336  11.008
    3    HB2  TYR  23           HB2      TYR  23  12.134   2.211  10.993
    4    HB3  TYR  23           HB3      TYR  23  13.472   1.416  11.823
    5    HD1  TYR  23           HD1      TYR  23  10.959   4.156  12.173
    6    HD2  TYR  23           HD2      TYR  23  13.646   1.470  14.178
    7    HE1  TYR  23           HE1      TYR  23  10.020   4.847  14.364
    8    HE2  TYR  23           HE2      TYR  23  12.707   2.161  16.366
    9    HH   TYR  23           HH       TYR  23   9.933   4.357  16.563

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ALA  24           H        ALA  24  16.015   2.088  11.660
    2    HA   ALA  24           HA       ALA  24  16.669   3.100  14.222
    3    HB1  ALA  24           HB1      ALA  24  18.043   1.319  14.067
    4    HB3  ALA  24           HB2      ALA  24  19.065   2.245  12.967
    5    HB2  ALA  24           HB3      ALA  24  17.781   1.223  12.327

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA  25           H        ALA  25  17.626   4.025  10.941
    2    HA   ALA  25           HA       ALA  25  19.552   5.979  11.584
    3    HB1  ALA  25           HB1      ALA  25  18.850   5.016   9.271
    4    HB3  ALA  25           HB2      ALA  25  19.336   6.708   9.358
    5    HB2  ALA  25           HB3      ALA  25  17.625   6.285   9.287

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU  26           H        LEU  26  16.036   6.175  11.213
    2    HA   LEU  26           HA       LEU  26  15.786   8.957  11.653
    3    HB2  LEU  26           HB2      LEU  26  13.938   7.701  10.725
    4    HB3  LEU  26           HB3      LEU  26  13.853   6.678  12.154
    5    HG   LEU  26           HG       LEU  26  13.226   8.636  13.525
    6   HD12  LEU  26          HD11      LEU  26  12.550  10.725  12.190
    7   HD11  LEU  26          HD12      LEU  26  13.539  10.076  10.886
    8   HD13  LEU  26          HD13      LEU  26  14.277  10.473  12.438
    9   HD21  LEU  26          HD21      LEU  26  11.559   8.298  11.013
   10   HD23  LEU  26          HD22      LEU  26  10.989   8.997  12.525
   11   HD22  LEU  26          HD23      LEU  26  11.456   7.299  12.463

  No H/Q in entry =          11
  In of MODEL   16
    1    H    LYS  27           H        LYS  27  15.696   6.185  13.856
    2    HA   LYS  27           HA       LYS  27  15.086   7.555  16.218
    3    HB2  LYS  27           HB2      LYS  27  15.136   5.079  15.963
    4    HB3  LYS  27           HB3      LYS  27  16.899   5.146  15.923
    5    HG2  LYS  27           HG2      LYS  27  16.935   6.141  18.169
    6    HG3  LYS  27           HG3      LYS  27  15.168   6.145  18.210
    7    HD2  LYS  27           HD2      LYS  27  15.163   3.676  17.983
    8    HD3  LYS  27           HD3      LYS  27  16.928   3.681  17.976
    9    HE2  LYS  27           HE2      LYS  27  16.948   4.678  20.229
   10    HE3  LYS  27           HE3      LYS  27  15.182   4.704  20.239
   11    HZ3  LYS  27           HZ1      LYS  27  15.983   2.763  21.399
   12    HZ2  LYS  27           HZ2      LYS  27  16.907   2.286  20.052
   13    HZ1  LYS  27           HZ3      LYS  27  15.209   2.277  19.969

  No H/Q in entry =          13
  In of MODEL   16
    1    H    GLN  28           H        GLN  28  18.211   6.991  14.636
    2    HA   GLN  28           HA       GLN  28  19.881   8.096  16.626
    3    HB2  GLN  28           HB2      GLN  28  20.175   8.038  13.612
    4    HB3  GLN  28           HB3      GLN  28  21.455   8.529  14.722
    5    HG2  GLN  28           HG2      GLN  28  20.066   5.836  14.765
    6    HG3  GLN  28           HG3      GLN  28  21.654   6.139  14.064
    7   HE21  GLN  28          HE21      GLN  28  20.354   4.828  16.760
    8   HE22  GLN  28          HE22      GLN  28  21.526   5.264  17.907

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ALA  29           H        ALA  29  18.125   9.555  13.924
    2    HA   ALA  29           HA       ALA  29  19.104  12.184  14.169
    3    HB2  ALA  29           HB1      ALA  29  17.404  12.803  12.691
    4    HB1  ALA  29           HB2      ALA  29  16.267  11.623  13.344
    5    HB3  ALA  29           HB3      ALA  29  17.604  11.087  12.326

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LYS  30           H        LYS  30  16.335  10.570  15.690
    2    HA   LYS  30           HA       LYS  30  15.302  12.822  17.036
    3    HB2  LYS  30           HB2      LYS  30  15.209   9.883  17.750
    4    HB3  LYS  30           HB3      LYS  30  14.332  11.130  18.637
    5    HG2  LYS  30           HG2      LYS  30  13.208  11.800  16.513
    6    HG3  LYS  30           HG3      LYS  30  14.024  10.467  15.694
    7    HD2  LYS  30           HD2      LYS  30  12.959   8.858  17.226
    8    HD3  LYS  30           HD3      LYS  30  12.153  10.181  18.069
    9    HE2  LYS  30           HE2      LYS  30  10.986  10.798  15.972
   10    HE3  LYS  30           HE3      LYS  30  11.772   9.446  15.148
   11    HZ2  LYS  30           HZ1      LYS  30   9.464   9.024  16.024
   12    HZ1  LYS  30           HZ2      LYS  30  10.127   9.088  17.592
   13    HZ3  LYS  30           HZ3      LYS  30  10.646   7.902  16.488

  No H/Q in entry =          13
  In of MODEL   16
    1    H    GLN  31           H        GLN  31  17.975  10.673  17.787
    2    HA   GLN  31           HA       GLN  31  18.289  11.699  20.479
    3    HB2  GLN  31           HB2      GLN  31  20.326  10.136  18.885
    4    HB3  GLN  31           HB3      GLN  31  20.187  10.266  20.638
    5    HG2  GLN  31           HG2      GLN  31  17.682   9.294  19.867
    6    HG3  GLN  31           HG3      GLN  31  18.792   8.453  18.793
    7   HE21  GLN  31          HE21      GLN  31  17.251   7.305  21.070
    8   HE22  GLN  31          HE22      GLN  31  18.408   6.656  22.125

  No H/Q in entry =           8
  In of MODEL   16
    1    H    GLY  32           H        GLY  32  18.807  13.009  17.509
    2    HA3  GLY  32           HA2      GLY  32  19.779  15.059  16.989
    3    HA2  GLY  32           HA3      GLY  32  20.533  15.074  18.579

  No H/Q in entry =           3
  In of MODEL   16
    1    H    ASP  33           H        ASP  33  20.978  12.178  16.814
    2    HA   ASP  33           HA       ASP  33  23.800  12.870  16.352
    3    HB2  ASP  33           HB2      ASP  33  22.309  10.245  16.474
    4    HB3  ASP  33           HB3      ASP  33  23.995  10.371  15.983

  No H/Q in entry =           4
  In of MODEL   16
    1    H    PHE  34           H        PHE  34  23.315  14.183  14.464
    2    HA   PHE  34           HA       PHE  34  21.978  13.182  12.178
    3    HB2  PHE  34           HB2      PHE  34  24.094  15.331  12.405
    4    HB3  PHE  34           HB3      PHE  34  23.114  15.029  10.972
    5    HD1  PHE  34           HD1      PHE  34  23.345  16.975  13.879
    6    HD2  PHE  34           HD2      PHE  34  20.487  14.831  11.494
    7    HE1  PHE  34           HE1      PHE  34  21.517  18.364  14.816
    8    HE2  PHE  34           HE2      PHE  34  18.663  16.220  12.434
    9    HZ   PHE  34           HZ       PHE  34  19.181  17.987  14.091

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ALA  35           H        ALA  35  25.351  13.021  13.194
    2    HA   ALA  35           HA       ALA  35  26.468  12.198  10.743
    3    HB3  ALA  35           HB1      ALA  35  28.152  11.047  12.471
    4    HB2  ALA  35           HB2      ALA  35  27.279  12.071  13.611
    5    HB1  ALA  35           HB3      ALA  35  28.114  12.795  12.237

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA  36           H        ALA  36  25.359  10.245  13.513
    2    HA   ALA  36           HA       ALA  36  25.864   7.756  12.248
    3    HB2  ALA  36           HB1      ALA  36  25.434   7.014  14.325
    4    HB3  ALA  36           HB2      ALA  36  23.743   7.496  14.169
    5    HB1  ALA  36           HB3      ALA  36  24.934   8.639  14.790

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA  37           H        ALA  37  23.027   9.862  12.367
    2    HA   ALA  37           HA       ALA  37  21.187   8.074  11.193
    3    HB3  ALA  37           HB1      ALA  37  21.389  11.040  11.475
    4    HB1  ALA  37           HB2      ALA  37  20.084   9.953  11.948
    5    HB2  ALA  37           HB3      ALA  37  20.274  10.420  10.258

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LYS  38           H        LYS  38  23.271  10.546   9.710
    2    HA   LYS  38           HA       LYS  38  22.641  10.103   7.033
    3    HB2  LYS  38           HB2      LYS  38  24.435  11.680   8.476
    4    HB3  LYS  38           HB3      LYS  38  25.478  10.695   7.457
    5    HG2  LYS  38           HG2      LYS  38  24.313  11.449   5.455
    6    HG3  LYS  38           HG3      LYS  38  23.109  12.297   6.430
    7    HD2  LYS  38           HD2      LYS  38  24.690  13.911   7.180
    8    HD3  LYS  38           HD3      LYS  38  26.059  12.934   6.652
    9    HE2  LYS  38           HE2      LYS  38  25.691  14.797   5.092
   10    HE3  LYS  38           HE3      LYS  38  25.370  13.253   4.293
   11    HZ3  LYS  38           HZ1      LYS  38  23.170  13.680   4.156
   12    HZ2  LYS  38           HZ2      LYS  38  23.679  15.299   4.239
   13    HZ1  LYS  38           HZ3      LYS  38  23.108  14.516   5.633

  No H/Q in entry =          13
  In of MODEL   16
    1    H    ALA  39           H        ALA  39  25.163   8.533   9.001
    2    HA   ALA  39           HA       ALA  39  26.250   6.946   6.940
    3    HB2  ALA  39           HB1      ALA  39  26.163   5.992   9.787
    4    HB1  ALA  39           HB2      ALA  39  27.105   7.424   9.368
    5    HB3  ALA  39           HB3      ALA  39  27.471   5.874   8.611

  No H/Q in entry =           5
  In of MODEL   16
    1    H    MET  40           H        MET  40  23.637   6.317   9.234
    2    HA   MET  40           HA       MET  40  23.219   3.605   8.509
    3    HB2  MET  40           HB2      MET  40  21.382   5.638   9.789
    4    HB3  MET  40           HB3      MET  40  20.990   3.925   9.620
    5    HG2  MET  40           HG2      MET  40  23.528   4.893  10.963
    6    HG3  MET  40           HG3      MET  40  22.034   4.608  11.854
    7    HE3  MET  40           HE1      MET  40  21.501   0.970  12.042
    8    HE2  MET  40           HE2      MET  40  20.624   2.262  11.228
    9    HE1  MET  40           HE3      MET  40  21.358   2.562  12.801

  No H/Q in entry =           9
  In of MODEL   16
    1    H    MET  41           H        MET  41  21.782   6.642   7.307
    2    HA   MET  41           HA       MET  41  19.839   5.424   5.635
    3    HB2  MET  41           HB2      MET  41  21.298   8.025   5.115
    4    HB3  MET  41           HB3      MET  41  19.776   7.515   4.395
    5    HG2  MET  41           HG2      MET  41  19.026   7.330   6.946
    6    HG3  MET  41           HG3      MET  41  20.324   8.499   7.166
    7    HE2  MET  41           HE1      MET  41  19.758   9.770   3.824
    8    HE1  MET  41           HE2      MET  41  20.708  10.223   5.236
    9    HE3  MET  41           HE3      MET  41  19.427  11.289   4.664

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ASP  42           H        ASP  42  23.204   6.374   5.086
    2    HA   ASP  42           HA       ASP  42  23.307   5.891   2.331
    3    HB2  ASP  42           HB2      ASP  42  25.045   6.910   4.100
    4    HB3  ASP  42           HB3      ASP  42  25.717   5.290   3.980

  No H/Q in entry =           4
  In of MODEL   16
    1    H    GLN  43           H        GLN  43  24.044   3.753   5.061
    2    HA   GLN  43           HA       GLN  43  24.732   1.495   3.488
    3    HB2  GLN  43           HB2      GLN  43  23.701   1.680   6.329
    4    HB3  GLN  43           HB3      GLN  43  24.295   0.194   5.580
    5    HG2  GLN  43           HG2      GLN  43  26.449   1.422   5.070
    6    HG3  GLN  43           HG3      GLN  43  25.852   2.747   6.063
    7   HE21  GLN  43          HE21      GLN  43  28.091   1.798   7.108
    8   HE22  GLN  43          HE22      GLN  43  27.823   0.718   8.388

  No H/Q in entry =           8
  In of MODEL   16
    1    H    SER  44           H        SER  44  21.663   2.607   4.862
    2    HA   SER  44           HA       SER  44  20.116   0.347   4.194
    3    HB2  SER  44           HB2      SER  44  19.649   2.876   5.329
    4    HB3  SER  44           HB3      SER  44  18.618   2.819   3.902
    5    HG   SER  44           HG       SER  44  17.529   1.872   5.626

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ARG  45           H        ARG  45  20.836   3.312   2.380
    2    HA   ARG  45           HA       ARG  45  19.321   2.803   0.074
    3    HB2  ARG  45           HB2      ARG  45  20.444   4.952   0.652
    4    HB3  ARG  45           HB3      ARG  45  21.996   4.209   0.273
    5    HG2  ARG  45           HG2      ARG  45  21.222   3.788  -2.042
    6    HG3  ARG  45           HG3      ARG  45  19.682   4.554  -1.661
    7    HD2  ARG  45           HD2      ARG  45  20.912   6.664  -1.082
    8    HD3  ARG  45           HD3      ARG  45  22.417   5.901  -1.644
    9    HE   ARG  45           HE       ARG  45  20.493   5.639  -3.684
   10   HH21  ARG  45          HH11      ARG  45  20.478   7.001  -5.452
   11   HH22  ARG  45          HH12      ARG  45  21.221   8.559  -5.352
   12   HH11  ARG  45          HH21      ARG  45  22.198   8.158  -2.063
   13   HH12  ARG  45          HH22      ARG  45  22.194   9.213  -3.430

  No H/Q in entry =          13
  In of MODEL   16
    1    H    MET  46           H        MET  46  22.691   1.961   0.831
    2    HA   MET  46           HA       MET  46  23.312   0.764  -1.647
    3    HB2  MET  46           HB2      MET  46  24.415   0.459   1.146
    4    HB3  MET  46           HB3      MET  46  25.081  -0.437  -0.224
    5    HG2  MET  46           HG2      MET  46  25.528   1.657  -1.415
    6    HG3  MET  46           HG3      MET  46  24.788   2.581  -0.115
    7    HE3  MET  46           HE1      MET  46  27.489  -0.587   0.255
    8    HE2  MET  46           HE2      MET  46  28.783   0.463  -0.318
    9    HE1  MET  46           HE3      MET  46  27.340   0.234  -1.305

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ALA  47           H        ALA  47  21.934  -0.570   1.331
    2    HA   ALA  47           HA       ALA  47  21.904  -3.286   0.539
    3    HB2  ALA  47           HB1      ALA  47  21.517  -2.819   2.841
    4    HB3  ALA  47           HB2      ALA  47  19.986  -3.437   2.222
    5    HB1  ALA  47           HB3      ALA  47  20.202  -1.703   2.474

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU  48           H        LEU  48  19.531  -0.679   0.168
    2    HA   LEU  48           HA       LEU  48  17.500  -2.233  -1.080
    3    HB2  LEU  48           HB2      LEU  48  18.132   0.726  -1.206
    4    HB3  LEU  48           HB3      LEU  48  16.667   0.001  -1.872
    5    HG   LEU  48           HG       LEU  48  17.519  -0.283   1.019
    6   HD13  LEU  48          HD11      LEU  48  17.083   2.014   0.823
    7   HD12  LEU  48          HD12      LEU  48  15.529   1.357   1.332
    8   HD11  LEU  48          HD13      LEU  48  15.800   1.774  -0.360
    9   HD22  LEU  48          HD21      LEU  48  16.004  -2.010   0.643
   10   HD21  LEU  48          HD22      LEU  48  15.125  -1.119  -0.600
   11   HD23  LEU  48          HD23      LEU  48  14.907  -0.709   1.102

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ASN  49           H        ASN  49  20.175  -0.290  -2.315
    2    HA   ASN  49           HA       ASN  49  19.529  -0.389  -5.039
    3    HB2  ASN  49           HB2      ASN  49  21.196   1.143  -4.118
    4    HB3  ASN  49           HB3      ASN  49  22.235  -0.209  -3.683
    5   HD21  ASN  49          HD21      ASN  49  23.224   1.796  -5.372
    6   HD22  ASN  49          HD22      ASN  49  23.411   1.175  -6.939

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLU  50           H        GLU  50  21.527  -2.561  -3.065
    2    HA   GLU  50           HA       GLU  50  22.243  -4.321  -5.183
    3    HB2  GLU  50           HB2      GLU  50  23.438  -4.277  -3.015
    4    HB3  GLU  50           HB3      GLU  50  21.999  -4.912  -2.218
    5    HG2  GLU  50           HG2      GLU  50  22.105  -6.950  -3.569
    6    HG3  GLU  50           HG3      GLU  50  23.478  -6.312  -4.471

  No H/Q in entry =           6
  In of MODEL   16
    1    H    ALA  51           H        ALA  51  19.584  -4.265  -2.860
    2    HA   ALA  51           HA       ALA  51  18.437  -6.749  -3.608
    3    HB3  ALA  51           HB1      ALA  51  16.839  -6.248  -2.057
    4    HB1  ALA  51           HB2      ALA  51  16.615  -4.606  -2.662
    5    HB2  ALA  51           HB3      ALA  51  17.975  -4.978  -1.603

  No H/Q in entry =           5
  In of MODEL   16
    1    H    HIS  52           H        HIS  52  17.828  -3.410  -4.658
    2    HA   HIS  52           HA       HIS  52  15.720  -3.960  -6.458
    3    HB2  HIS  52           HB2      HIS  52  16.356  -1.687  -5.664
    4    HB3  HIS  52           HB3      HIS  52  17.808  -1.777  -6.661
    5    HD1  HIS  52           HD1      HIS  52  17.413  -1.976  -9.297
    6    HD2  HIS  52           HD2      HIS  52  14.029  -1.008  -7.061
    7    HE1  HIS  52           HE1      HIS  52  15.693  -1.103 -10.941
    8    HE2  HIS  52           HE2      HIS  52  13.625  -0.509  -9.592

  No H/Q in entry =           8
  In of MODEL   16
    1    H    LEU  53           H        LEU  53  19.239  -3.942  -6.887
    2    HA   LEU  53           HA       LEU  53  19.301  -4.269  -9.686
    3    HB2  LEU  53           HB2      LEU  53  21.237  -4.998  -7.503
    4    HB3  LEU  53           HB3      LEU  53  21.557  -5.406  -9.187
    5    HG   LEU  53           HG       LEU  53  20.864  -2.586  -8.304
    6   HD12  LEU  53          HD11      LEU  53  23.389  -2.232  -8.600
    7   HD11  LEU  53          HD12      LEU  53  23.536  -3.986  -8.485
    8   HD13  LEU  53          HD13      LEU  53  22.882  -3.067  -7.135
    9   HD23  LEU  53          HD21      LEU  53  22.317  -2.185 -10.459
   10   HD22  LEU  53          HD22      LEU  53  20.633  -2.664 -10.637
   11   HD21  LEU  53          HD23      LEU  53  21.907  -3.851 -10.842

  No H/Q in entry =          11
  In of MODEL   16
    1    H    VAL  54           H        VAL  54  19.204  -6.645  -7.049
    2    HA   VAL  54           HA       VAL  54  19.347  -8.946  -8.698
    3    HB   VAL  54           HB       VAL  54  18.186  -8.519  -5.934
    4   HG12  VAL  54          HG11      VAL  54  18.531 -11.134  -5.917
    5   HG11  VAL  54          HG12      VAL  54  18.346 -10.975  -7.664
    6   HG13  VAL  54          HG13      VAL  54  17.052 -10.449  -6.589
    7   HG22  VAL  54          HG21      VAL  54  20.500  -8.289  -5.710
    8   HG21  VAL  54          HG22      VAL  54  20.847  -9.384  -7.046
    9   HG23  VAL  54          HG23      VAL  54  20.321 -10.028  -5.491

  No H/Q in entry =           9
  In of MODEL   16
    1    H    GLN  55           H        GLN  55  16.602  -7.059  -7.427
    2    HA   GLN  55           HA       GLN  55  14.596  -8.744  -8.495
    3    HB2  GLN  55           HB2      GLN  55  13.834  -7.217  -6.876
    4    HB3  GLN  55           HB3      GLN  55  14.616  -5.845  -7.658
    5    HG2  GLN  55           HG2      GLN  55  12.891  -5.542  -9.151
    6    HG3  GLN  55           HG3      GLN  55  12.583  -7.266  -9.313
    7   HE21  GLN  55          HE21      GLN  55  10.580  -7.828  -8.507
    8   HE22  GLN  55          HE22      GLN  55   9.799  -7.073  -7.203

  No H/Q in entry =           8
  In of MODEL   16
    1    H    THR  56           H        THR  56  16.313  -5.936  -9.866
    2    HA   THR  56           HA       THR  56  14.875  -5.597 -12.217
    3    HB   THR  56           HB       THR  56  17.875  -5.418 -11.842
    4    HG1  THR  56           HG1      THR  56  15.983  -4.045 -10.764
    5   HG21  THR  56          HG21      THR  56  16.042  -4.366 -14.010
    6   HG23  THR  56          HG22      THR  56  17.356  -5.525 -14.202
    7   HG22  THR  56          HG23      THR  56  17.715  -3.847 -13.793

  No H/Q in entry =           7
  In of MODEL   16
    1    H    LYS  57           H        LYS  57  17.543  -7.869 -11.593
    2    HA   LYS  57           HA       LYS  57  17.556  -9.076 -14.165
    3    HB2  LYS  57           HB2      LYS  57  19.348  -9.306 -12.419
    4    HB3  LYS  57           HB3      LYS  57  18.251 -10.303 -11.475
    5    HG2  LYS  57           HG2      LYS  57  18.161 -11.962 -13.270
    6    HG3  LYS  57           HG3      LYS  57  19.191 -10.958 -14.283
    7    HD2  LYS  57           HD2      LYS  57  21.012 -11.152 -12.613
    8    HD3  LYS  57           HD3      LYS  57  19.987 -12.190 -11.624
    9    HE2  LYS  57           HE2      LYS  57  20.883 -12.792 -14.466
   10    HE3  LYS  57           HE3      LYS  57  21.530 -13.553 -13.012
   11    HZ3  LYS  57           HZ1      LYS  57  19.947 -15.059 -13.372
   12    HZ2  LYS  57           HZ2      LYS  57  19.055 -14.042 -14.400
   13    HZ1  LYS  57           HZ3      LYS  57  18.884 -13.912 -12.717

  No H/Q in entry =          13
  In of MODEL   16
    1    H    LEU  58           H        LEU  58  15.779  -9.744 -11.188
    2    HA   LEU  58           HA       LEU  58  14.579 -12.133 -12.112
    3    HB2  LEU  58           HB2      LEU  58  13.765 -10.224  -9.926
    4    HB3  LEU  58           HB3      LEU  58  12.972 -11.770 -10.236
    5    HG   LEU  58           HG       LEU  58  15.942 -11.463  -9.680
    6   HD11  LEU  58          HD11      LEU  58  13.573 -11.893  -7.887
    7   HD13  LEU  58          HD12      LEU  58  15.018 -10.915  -7.628
    8   HD12  LEU  58          HD13      LEU  58  15.106 -12.670  -7.485
    9   HD22  LEU  58          HD21      LEU  58  15.844 -13.531 -10.698
   10   HD21  LEU  58          HD22      LEU  58  14.131 -13.754 -10.337
   11   HD23  LEU  58          HD23      LEU  58  15.341 -14.038  -9.086

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  59           H        ILE  59  13.878  -8.805 -12.811
    2    HA   ILE  59           HA       ILE  59  11.169  -9.482 -13.750
    3    HB   ILE  59           HB       ILE  59  11.958  -7.186 -12.557
    4   HG12  ILE  59          HG12      ILE  59  10.040  -7.107 -14.897
    5   HG13  ILE  59          HG13      ILE  59   9.636  -7.855 -13.374
    6   HG23  ILE  59          HG21      ILE  59  12.509  -5.466 -14.077
    7   HG22  ILE  59          HG22      ILE  59  12.018  -6.402 -15.471
    8   HG21  ILE  59          HG23      ILE  59  13.507  -6.796 -14.616
    9   HD12  ILE  59          HD11      ILE  59   8.847  -5.514 -13.463
   10   HD11  ILE  59          HD12      ILE  59  10.511  -4.983 -13.703
   11   HD13  ILE  59          HD13      ILE  59  10.041  -5.749 -12.184

  No H/Q in entry =          11
  In of MODEL   16
    1    H    GLU  60           H        GLU  60  14.367  -8.608 -15.010
    2    HA   GLU  60           HA       GLU  60  13.586  -8.228 -17.721
    3    HB2  GLU  60           HB2      GLU  60  15.761  -7.480 -16.848
    4    HB3  GLU  60           HB3      GLU  60  16.238  -9.154 -16.581
    5    HG2  GLU  60           HG2      GLU  60  16.031  -9.603 -19.002
    6    HG3  GLU  60           HG3      GLU  60  15.557  -7.926 -19.271

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLY  61           H        GLY  61  14.587 -11.092 -15.891
    2    HA3  GLY  61           HA2      GLY  61  14.062 -12.756 -18.285
    3    HA2  GLY  61           HA3      GLY  61  15.098 -13.222 -16.939

  No H/Q in entry =           3
  In of MODEL   16
    1    H    ASP  62           H        ASP  62  11.964 -11.701 -16.577
    2    HA   ASP  62           HA       ASP  62  11.058 -13.800 -14.844
    3    HB2  ASP  62           HB2      ASP  62   9.026 -12.421 -14.664
    4    HB3  ASP  62           HB3      ASP  62  10.487 -11.473 -14.400

  No H/Q in entry =           4
  In of MODEL   16
    1    H    ALA  63           H        ALA  63  11.407 -15.363 -16.894
    2    HA   ALA  63           HA       ALA  63   9.379 -15.458 -18.898
    3    HB1  ALA  63           HB1      ALA  63  11.407 -16.684 -19.263
    4    HB3  ALA  63           HB2      ALA  63  10.120 -17.877 -19.099
    5    HB2  ALA  63           HB3      ALA  63  11.215 -17.573 -17.751

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLY  64           H        GLY  64   9.700 -16.897 -15.698
    2    HA3  GLY  64           HA2      GLY  64   8.142 -17.766 -14.250
    3    HA2  GLY  64           HA3      GLY  64   6.891 -17.104 -15.294

  No H/Q in entry =           3
  In of MODEL   16
    1    H    GLU  65           H        GLU  65   5.772 -19.157 -14.700
    2    HA   GLU  65           HA       GLU  65   6.777 -21.668 -15.501
    3    HB2  GLU  65           HB2      GLU  65   3.954 -20.722 -15.023
    4    HB3  GLU  65           HB3      GLU  65   4.381 -22.403 -15.343
    5    HG2  GLU  65           HG2      GLU  65   5.845 -22.444 -13.393
    6    HG3  GLU  65           HG3      GLU  65   5.540 -20.734 -13.094

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLY  66           H        GLY  66   4.718 -19.366 -17.126
    2    HA3  GLY  66           HA2      GLY  66   4.913 -20.896 -19.639
    3    HA2  GLY  66           HA3      GLY  66   3.550 -19.880 -19.215

  No H/Q in entry =           3
  In of MODEL   16
    1    H    LYS  67           H        LYS  67   4.506 -19.451 -21.595
    2    HA   LYS  67           HA       LYS  67   6.715 -17.834 -21.989
    3    HB2  LYS  67           HB2      LYS  67   4.127 -18.028 -23.523
    4    HB3  LYS  67           HB3      LYS  67   5.548 -17.148 -24.101
    5    HG2  LYS  67           HG2      LYS  67   6.909 -19.188 -23.907
    6    HG3  LYS  67           HG3      LYS  67   5.515 -20.075 -23.300
    7    HD2  LYS  67           HD2      LYS  67   4.330 -19.670 -25.428
    8    HD3  LYS  67           HD3      LYS  67   5.736 -18.795 -26.039
    9    HE2  LYS  67           HE2      LYS  67   7.120 -20.824 -25.751
   10    HE3  LYS  67           HE3      LYS  67   5.708 -21.700 -25.165
   11    HZ2  LYS  67           HZ1      LYS  67   6.342 -21.879 -27.633
   12    HZ1  LYS  67           HZ2      LYS  67   5.640 -20.340 -27.777
   13    HZ3  LYS  67           HZ3      LYS  67   4.710 -21.652 -27.228

  No H/Q in entry =          13
  In of MODEL   16
    1    H    MET  68           H        MET  68   3.432 -16.586 -22.208
    2    HA   MET  68           HA       MET  68   4.104 -13.867 -21.964
    3    HB2  MET  68           HB2      MET  68   1.538 -15.410 -21.742
    4    HB3  MET  68           HB3      MET  68   1.584 -13.663 -21.500
    5    HG2  MET  68           HG2      MET  68   2.684 -15.054 -23.955
    6    HG3  MET  68           HG3      MET  68   1.075 -14.338 -23.867
    7    HE1  MET  68           HE1      MET  68   1.796 -13.436 -25.899
    8    HE3  MET  68           HE2      MET  68   3.498 -13.040 -26.115
    9    HE2  MET  68           HE3      MET  68   2.305 -11.747 -26.021

  No H/Q in entry =           9
  In of MODEL   16
    1    H    LYS  69           H        LYS  69   2.958 -16.167 -19.476
    2    HA   LYS  69           HA       LYS  69   2.584 -14.176 -17.480
    3    HB2  LYS  69           HB2      LYS  69   2.785 -17.181 -17.329
    4    HB3  LYS  69           HB3      LYS  69   2.438 -16.161 -15.929
    5    HG2  LYS  69           HG2      LYS  69   0.498 -15.193 -17.109
    6    HG3  LYS  69           HG3      LYS  69   0.839 -16.215 -18.504
    7    HD2  LYS  69           HD2      LYS  69   0.503 -18.227 -17.120
    8    HD3  LYS  69           HD3      LYS  69   0.159 -17.207 -15.721
    9    HE2  LYS  69           HE2      LYS  69  -1.762 -16.218 -16.903
   10    HE3  LYS  69           HE3      LYS  69  -1.419 -17.222 -18.310
   11    HZ1  LYS  69           HZ1      LYS  69  -1.517 -19.065 -16.403
   12    HZ3  LYS  69           HZ2      LYS  69  -2.869 -18.597 -17.318
   13    HZ2  LYS  69           HZ3      LYS  69  -2.619 -17.945 -15.769

  No H/Q in entry =          13
  In of MODEL   16
    1    H    VAL  70           H        VAL  70   3.638 -14.211 -15.285
    2    HA   VAL  70           HA       VAL  70   6.569 -14.619 -15.476
    3    HB   VAL  70           HB       VAL  70   6.820 -12.568 -14.100
    4   HG12  VAL  70          HG11      VAL  70   5.858 -10.986 -15.978
    5   HG11  VAL  70          HG12      VAL  70   5.512 -12.508 -16.801
    6   HG13  VAL  70          HG13      VAL  70   7.170 -12.100 -16.361
    7   HG22  VAL  70          HG21      VAL  70   4.676 -12.487 -12.966
    8   HG21  VAL  70          HG22      VAL  70   3.817 -12.417 -14.503
    9   HG23  VAL  70          HG23      VAL  70   4.783 -11.041 -13.971

  No H/Q in entry =           9
  In of MODEL   16
    1    H    SER  71           H        SER  71   7.594 -14.682 -13.281
    2    HA   SER  71           HA       SER  71   6.470 -16.696 -11.649
    3    HB2  SER  71           HB2      SER  71   8.901 -16.190 -11.763
    4    HB3  SER  71           HB3      SER  71   8.603 -14.671 -10.923
    5    HG   SER  71           HG       SER  71   7.572 -16.064  -9.277

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU  72           H        LEU  72   5.118 -16.605  -9.939
    2    HA   LEU  72           HA       LEU  72   3.547 -14.303  -9.507
    3    HB2  LEU  72           HB2      LEU  72   3.855 -16.848  -7.921
    4    HB3  LEU  72           HB3      LEU  72   2.671 -15.601  -7.536
    5    HG   LEU  72           HG       LEU  72   2.858 -16.931 -10.260
    6   HD13  LEU  72          HD11      LEU  72   0.931 -18.280  -9.555
    7   HD12  LEU  72          HD12      LEU  72   0.983 -17.542  -7.955
    8   HD11  LEU  72          HD13      LEU  72   2.306 -18.578  -8.491
    9   HD21  LEU  72          HD21      LEU  72   0.980 -14.990  -8.934
   10   HD23  LEU  72          HD22      LEU  72   0.342 -16.089 -10.146
   11   HD22  LEU  72          HD23      LEU  72   1.622 -14.958 -10.572

  No H/Q in entry =          11
  In of MODEL   16
    1    H    VAL  73           H        VAL  73   6.213 -15.709  -7.724
    2    HA   VAL  73           HA       VAL  73   6.135 -14.167  -5.398
    3    HB   VAL  73           HB       VAL  73   8.334 -14.946  -4.971
    4   HG12  VAL  73          HG11      VAL  73   7.022 -17.018  -6.750
    5   HG11  VAL  73          HG12      VAL  73   6.501 -16.663  -5.103
    6   HG13  VAL  73          HG13      VAL  73   8.113 -17.317  -5.398
    7   HG22  VAL  73          HG21      VAL  73   9.658 -14.405  -6.803
    8   HG21  VAL  73          HG22      VAL  73   8.494 -15.040  -7.964
    9   HG23  VAL  73          HG23      VAL  73   9.495 -16.147  -7.025

  No H/Q in entry =           9
  In of MODEL   16
    1    H    LEU  74           H        LEU  74   7.123 -13.278  -8.576
    2    HA   LEU  74           HA       LEU  74   9.050 -11.310  -8.089
    3    HB2  LEU  74           HB2      LEU  74   8.606 -12.072 -10.324
    4    HB3  LEU  74           HB3      LEU  74   6.935 -11.521 -10.229
    5    HG   LEU  74           HG       LEU  74   7.714  -9.184 -10.024
    6   HD13  LEU  74          HD11      LEU  74   9.826  -9.334  -8.965
    7   HD12  LEU  74          HD12      LEU  74  10.219  -8.875 -10.622
    8   HD11  LEU  74          HD13      LEU  74  10.407 -10.549 -10.103
    9   HD23  LEU  74          HD21      LEU  74   9.208 -10.282 -12.349
   10   HD22  LEU  74          HD22      LEU  74   8.058  -8.968 -12.262
   11   HD21  LEU  74          HD23      LEU  74   7.481 -10.620 -12.239

  No H/Q in entry =          11
  In of MODEL   16
    1    H    VAL  75           H        VAL  75   5.552 -10.957  -8.450
    2    HA   VAL  75           HA       VAL  75   5.431  -8.199  -7.875
    3    HB   VAL  75           HB       VAL  75   3.360 -10.360  -7.486
    4   HG13  VAL  75          HG11      VAL  75   2.857  -8.444  -6.013
    5   HG12  VAL  75          HG12      VAL  75   1.768  -8.426  -7.393
    6   HG11  VAL  75          HG13      VAL  75   3.139  -7.328  -7.346
    7   HG21  VAL  75          HG21      VAL  75   4.145  -9.929  -9.814
    8   HG23  VAL  75          HG22      VAL  75   3.748  -8.224  -9.612
    9   HG22  VAL  75          HG23      VAL  75   2.467  -9.437  -9.586

  No H/Q in entry =           9
  In of MODEL   16
    1    H    GLU  76           H        GLU  76   5.197 -11.069  -5.754
    2    HA   GLU  76           HA       GLU  76   4.710  -9.702  -3.340
    3    HB2  GLU  76           HB2      GLU  76   4.552 -12.168  -3.551
    4    HB3  GLU  76           HB3      GLU  76   6.285 -12.260  -3.807
    5    HG2  GLU  76           HG2      GLU  76   5.852 -12.834  -1.501
    6    HG3  GLU  76           HG3      GLU  76   6.618 -11.257  -1.509

  No H/Q in entry =           6
  In of MODEL   16
    1    H    ALA  77           H        ALA  77   7.781 -10.590  -4.892
    2    HA   ALA  77           HA       ALA  77   9.456  -9.523  -2.876
    3    HB2  ALA  77           HB1      ALA  77  11.231  -9.637  -4.533
    4    HB3  ALA  77           HB2      ALA  77  10.048  -9.768  -5.835
    5    HB1  ALA  77           HB3      ALA  77  10.220 -11.076  -4.664

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLN  78           H        GLN  78   8.060  -8.130  -5.800
    2    HA   GLN  78           HA       GLN  78   9.391  -5.639  -5.702
    3    HB2  GLN  78           HB2      GLN  78   8.109  -6.570  -7.660
    4    HB3  GLN  78           HB3      GLN  78   6.620  -6.207  -6.790
    5    HG2  GLN  78           HG2      GLN  78   7.247  -3.829  -6.701
    6    HG3  GLN  78           HG3      GLN  78   8.740  -4.185  -7.568
    7   HE21  GLN  78          HE21      GLN  78   6.777  -2.390  -8.655
    8   HE22  GLN  78          HE22      GLN  78   6.109  -3.113 -10.038

  No H/Q in entry =           8
  In of MODEL   16
    1    H    LEU  79           H        LEU  79   6.377  -6.796  -4.276
    2    HA   LEU  79           HA       LEU  79   5.361  -4.392  -3.280
    3    HB2  LEU  79           HB2      LEU  79   4.063  -6.454  -3.219
    4    HB3  LEU  79           HB3      LEU  79   5.211  -7.179  -2.097
    5    HG   LEU  79           HG       LEU  79   4.640  -5.534  -0.379
    6   HD13  LEU  79          HD11      LEU  79   4.162  -3.528  -1.440
    7   HD12  LEU  79          HD12      LEU  79   2.539  -4.065  -1.003
    8   HD11  LEU  79          HD13      LEU  79   3.126  -4.290  -2.649
    9   HD23  LEU  79          HD21      LEU  79   2.057  -6.047  -0.295
   10   HD22  LEU  79          HD22      LEU  79   3.207  -7.377  -0.177
   11   HD21  LEU  79          HD23      LEU  79   2.395  -7.052  -1.706

  No H/Q in entry =          11
  In of MODEL   16
    1    H    HIS  80           H        HIS  80   7.557  -6.703  -1.680
    2    HA   HIS  80           HA       HIS  80   7.826  -5.149   0.683
    3    HB2  HIS  80           HB2      HIS  80   9.186  -7.507  -0.501
    4    HB3  HIS  80           HB3      HIS  80  10.086  -6.598   0.715
    5    HD1  HIS  80           HD1      HIS  80   9.592  -7.228   3.059
    6    HD2  HIS  80           HD2      HIS  80   6.391  -8.114   0.540
    7    HE1  HIS  80           HE1      HIS  80   7.824  -8.339   4.506
    8    HE2  HIS  80           HE2      HIS  80   5.866  -8.883   2.979

  No H/Q in entry =           8
  In of MODEL   16
    1    H    LEU  81           H        LEU  81   9.843  -5.422  -2.221
    2    HA   LEU  81           HA       LEU  81  11.871  -3.662  -1.343
    3    HB2  LEU  81           HB2      LEU  81  10.965  -4.473  -4.106
    4    HB3  LEU  81           HB3      LEU  81  12.377  -3.455  -3.815
    5    HG   LEU  81           HG       LEU  81  12.000  -6.174  -2.531
    6   HD12  LEU  81          HD11      LEU  81  13.826  -6.794  -4.272
    7   HD11  LEU  81          HD12      LEU  81  13.253  -5.378  -5.152
    8   HD13  LEU  81          HD13      LEU  81  12.150  -6.709  -4.812
    9   HD23  LEU  81          HD21      LEU  81  14.626  -5.839  -2.510
   10   HD22  LEU  81          HD22      LEU  81  13.634  -5.081  -1.266
   11   HD21  LEU  81          HD23      LEU  81  14.210  -4.130  -2.635

  No H/Q in entry =          11
  In of MODEL   16
    1    H    MET  82           H        MET  82   8.950  -3.055  -3.293
    2    HA   MET  82           HA       MET  82   9.473  -0.327  -3.804
    3    HB2  MET  82           HB2      MET  82   6.924  -1.939  -3.681
    4    HB3  MET  82           HB3      MET  82   6.913  -0.216  -4.052
    5    HG2  MET  82           HG2      MET  82   8.533  -2.285  -5.573
    6    HG3  MET  82           HG3      MET  82   6.964  -1.675  -6.094
    7    HE3  MET  82           HE1      MET  82   7.392   1.778  -7.279
    8    HE2  MET  82           HE2      MET  82   7.013   1.556  -5.573
    9    HE1  MET  82           HE3      MET  82   6.360   0.437  -6.765

  No H/Q in entry =           9
  In of MODEL   16
    1    H    THR  83           H        THR  83   7.682  -1.927  -1.198
    2    HA   THR  83           HA       THR  83   6.811   0.421   0.115
    3    HB   THR  83           HB       THR  83   6.680  -1.146   2.139
    4    HG1  THR  83           HG1      THR  83   7.451  -3.092   1.921
    5   HG22  THR  83          HG21      THR  83   5.043  -2.729   0.672
    6   HG21  THR  83          HG22      THR  83   5.264  -1.404  -0.465
    7   HG23  THR  83          HG23      THR  83   4.616  -1.086   1.145

  No H/Q in entry =           7
  In of MODEL   16
    1    H    SER  84           H        SER  84   9.646  -1.656   0.655
    2    HA   SER  84           HA       SER  84  10.688  -0.209   2.841
    3    HB2  SER  84           HB2      SER  84  11.961  -2.052   0.828
    4    HB3  SER  84           HB3      SER  84  12.898  -1.287   2.110
    5    HG   SER  84           HG       SER  84  10.634  -2.990   2.369

  No H/Q in entry =           5
  In of MODEL   16
    1    H    MET  85           H        MET  85  11.452   0.042  -0.645
    2    HA   MET  85           HA       MET  85  13.437   2.021  -0.395
    3    HB2  MET  85           HB2      MET  85  13.058   0.729  -2.457
    4    HB3  MET  85           HB3      MET  85  11.526   1.569  -2.695
    5    HG2  MET  85           HG2      MET  85  12.706   3.722  -2.830
    6    HG3  MET  85           HG3      MET  85  14.240   2.909  -2.547
    7    HE2  MET  85           HE1      MET  85  11.913   4.094  -5.663
    8    HE1  MET  85           HE2      MET  85  11.122   3.121  -4.427
    9    HE3  MET  85           HE3      MET  85  11.381   2.446  -6.030

  No H/Q in entry =           9
  In of MODEL   16
    1    H    LEU  86           H        LEU  86   9.947   2.332  -0.918
    2    HA   LEU  86           HA       LEU  86   9.867   5.144  -1.112
    3    HB2  LEU  86           HB2      LEU  86   8.035   3.470  -1.688
    4    HB3  LEU  86           HB3      LEU  86   7.699   3.386   0.041
    5    HG   LEU  86           HG       LEU  86   7.523   5.945  -0.023
    6   HD11  LEU  86          HD11      LEU  86   8.311   5.503  -2.720
    7   HD13  LEU  86          HD12      LEU  86   7.863   7.031  -1.967
    8   HD12  LEU  86          HD13      LEU  86   6.636   6.057  -2.773
    9   HD23  LEU  86          HD21      LEU  86   5.404   4.572  -1.687
   10   HD22  LEU  86          HD22      LEU  86   5.201   5.836  -0.477
   11   HD21  LEU  86          HD23      LEU  86   5.609   4.196   0.024

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ALA  87           H        ALA  87   9.404   2.974   1.641
    2    HA   ALA  87           HA       ALA  87   8.837   4.893   3.601
    3    HB1  ALA  87           HB1      ALA  87   9.661   2.077   3.529
    4    HB3  ALA  87           HB2      ALA  87   8.527   2.887   4.607
    5    HB2  ALA  87           HB3      ALA  87  10.255   2.930   4.957

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ARG  88           H        ARG  88  11.932   3.483   2.637
    2    HA   ARG  88           HA       ARG  88  13.527   4.878   4.469
    3    HB2  ARG  88           HB2      ARG  88  14.212   2.902   3.076
    4    HB3  ARG  88           HB3      ARG  88  14.363   3.991   1.699
    5    HG2  ARG  88           HG2      ARG  88  15.821   5.321   3.645
    6    HG3  ARG  88           HG3      ARG  88  16.151   3.635   4.032
    7    HD2  ARG  88           HD2      ARG  88  17.426   3.339   2.191
    8    HD3  ARG  88           HD3      ARG  88  16.287   4.199   1.150
    9    HE   ARG  88           HE       ARG  88  18.672   5.281   2.201
   10   HH21  ARG  88          HH11      ARG  88  19.005   7.501   1.998
   11   HH22  ARG  88          HH12      ARG  88  17.648   8.564   1.846
   12   HH11  ARG  88          HH21      ARG  88  15.329   6.013   1.909
   13   HH12  ARG  88          HH22      ARG  88  15.566   7.719   1.771

  No H/Q in entry =          13
  In of MODEL   16
    1    H    GLU  89           H        GLU  89  12.560   5.756   1.139
    2    HA   GLU  89           HA       GLU  89  14.093   8.125   0.977
    3    HB2  GLU  89           HB2      GLU  89  12.962   7.069  -0.970
    4    HB3  GLU  89           HB3      GLU  89  11.412   7.603  -0.320
    5    HG2  GLU  89           HG2      GLU  89  12.100   9.944  -0.490
    6    HG3  GLU  89           HG3      GLU  89  13.709   9.461  -1.019

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LEU  90           H        LEU  90  10.763   7.600   2.098
    2    HA   LEU  90           HA       LEU  90  10.230  10.333   2.660
    3    HB2  LEU  90           HB2      LEU  90   9.047   7.757   3.694
    4    HB3  LEU  90           HB3      LEU  90   8.406   9.350   4.108
    5    HG   LEU  90           HG       LEU  90   8.839   8.460   1.245
    6   HD12  LEU  90          HD11      LEU  90   6.307   8.117   1.300
    7   HD11  LEU  90          HD12      LEU  90   6.456   8.115   3.057
    8   HD13  LEU  90          HD13      LEU  90   7.284   6.886   2.100
    9   HD22  LEU  90          HD21      LEU  90   8.531  10.766   1.160
   10   HD21  LEU  90          HD22      LEU  90   7.540  10.799   2.617
   11   HD23  LEU  90          HD23      LEU  90   6.851  10.233   1.096

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  91           H        ILE  91  11.502   7.667   4.598
    2    HA   ILE  91           HA       ILE  91  11.627   9.043   7.061
    3    HB   ILE  91           HB       ILE  91  13.198   6.709   5.952
    4   HG12  ILE  91          HG12      ILE  91  11.174   6.874   8.204
    5   HG13  ILE  91          HG13      ILE  91  10.710   6.583   6.528
    6   HG22  ILE  91          HG21      ILE  91  13.661   6.509   8.595
    7   HG21  ILE  91          HG22      ILE  91  13.575   8.267   8.486
    8   HG23  ILE  91          HG23      ILE  91  14.762   7.382   7.529
    9   HD13  ILE  91          HD11      ILE  91  11.726   4.487   6.470
   10   HD12  ILE  91          HD12      ILE  91  11.127   4.549   8.128
   11   HD11  ILE  91          HD13      ILE  91  12.828   4.871   7.793

  No H/Q in entry =          11
  In of MODEL   16
    1    H    THR  92           H        THR  92  13.854   8.876   4.317
    2    HA   THR  92           HA       THR  92  16.007  10.286   5.477
    3    HB   THR  92           HB       THR  92  15.031  10.144   2.614
    4    HG1  THR  92           HG1      THR  92  15.872   8.253   3.029
    5   HG22  THR  92          HG21      THR  92  17.597  10.848   2.325
    6   HG21  THR  92          HG22      THR  92  17.280  11.674   3.850
    7   HG23  THR  92          HG23      THR  92  16.312  12.049   2.425

  No H/Q in entry =           7
  In of MODEL   16
    1    H    GLU  93           H        GLU  93  13.119  11.415   3.734
    2    HA   GLU  93           HA       GLU  93  13.696  14.180   3.839
    3    HB2  GLU  93           HB2      GLU  93  11.000  12.791   3.850
    4    HB3  GLU  93           HB3      GLU  93  11.279  14.491   3.472
    5    HG2  GLU  93           HG2      GLU  93  12.635  12.251   1.958
    6    HG3  GLU  93           HG3      GLU  93  11.086  12.922   1.463

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LEU  94           H        LEU  94  11.960  12.023   6.054
    2    HA   LEU  94           HA       LEU  94  11.133  13.972   7.919
    3    HB2  LEU  94           HB2      LEU  94  11.726  11.022   8.207
    4    HB3  LEU  94           HB3      LEU  94  11.144  11.999   9.552
    5    HG   LEU  94           HG       LEU  94   9.668  12.031   6.918
    6   HD11  LEU  94          HD11      LEU  94   9.758   9.819   8.932
    7   HD13  LEU  94          HD12      LEU  94   9.462   9.749   7.197
    8   HD12  LEU  94          HD13      LEU  94   8.177  10.262   8.289
    9   HD23  LEU  94          HD21      LEU  94   7.741  12.426   8.511
   10   HD22  LEU  94          HD22      LEU  94   8.972  13.688   8.546
   11   HD21  LEU  94          HD23      LEU  94   8.913  12.476   9.826

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  95           H        ILE  95  14.119  12.060   7.699
    2    HA   ILE  95           HA       ILE  95  15.274  12.999  10.113
    3    HB   ILE  95           HB       ILE  95  16.526  11.927   7.573
    4   HG12  ILE  95          HG12      ILE  95  16.230  10.735  10.344
    5   HG13  ILE  95          HG13      ILE  95  15.068  10.465   9.047
    6   HG21  ILE  95          HG21      ILE  95  17.769  12.752  10.215
    7   HG23  ILE  95          HG22      ILE  95  18.233  13.276   8.595
    8   HG22  ILE  95          HG23      ILE  95  18.548  11.620   9.111
    9   HD13  ILE  95          HD11      ILE  95  16.560   9.190   7.794
   10   HD12  ILE  95          HD12      ILE  95  17.031   8.751   9.433
   11   HD11  ILE  95          HD13      ILE  95  17.979   9.932   8.532

  No H/Q in entry =          11
  In of MODEL   16
    1    H    GLU  96           H        GLU  96  15.431  14.219   6.774
    2    HA   GLU  96           HA       GLU  96  17.263  16.311   7.247
    3    HB2  GLU  96           HB2      GLU  96  16.609  15.635   4.989
    4    HB3  GLU  96           HB3      GLU  96  14.962  16.183   5.282
    5    HG2  GLU  96           HG2      GLU  96  15.517  18.314   4.733
    6    HG3  GLU  96           HG3      GLU  96  16.812  18.327   5.919

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LEU  97           H        LEU  97  13.752  16.104   7.667
    2    HA   LEU  97           HA       LEU  97  13.318  18.838   8.297
    3    HB2  LEU  97           HB2      LEU  97  11.813  16.306   8.917
    4    HB3  LEU  97           HB3      LEU  97  11.289  17.853   9.580
    5    HG   LEU  97           HG       LEU  97  11.783  17.427   6.619
    6   HD12  LEU  97          HD11      LEU  97   9.260  17.284   6.494
    7   HD11  LEU  97          HD12      LEU  97   9.250  17.092   8.245
    8   HD13  LEU  97          HD13      LEU  97  10.041  15.885   7.230
    9   HD23  LEU  97          HD21      LEU  97  10.033  19.381   6.638
   10   HD22  LEU  97          HD22      LEU  97  11.711  19.752   7.034
   11   HD21  LEU  97          HD23      LEU  97  10.519  19.580   8.321

  No H/Q in entry =          11
  In of MODEL   16
    1    H    HIS  98           H        HIS  98  14.150  16.025  10.306
    2    HA   HIS  98           HA       HIS  98  13.978  17.296  12.817
    3    HB2  HIS  98           HB2      HIS  98  15.744  15.044  11.829
    4    HB3  HIS  98           HB3      HIS  98  15.735  15.590  13.508
    5    HD1  HIS  98           HD1      HIS  98  13.552  13.937  10.917
    6    HD2  HIS  98           HD2      HIS  98  13.428  14.873  14.977
    7    HE1  HIS  98           HE1      HIS  98  11.531  12.734  11.868
    8    HE2  HIS  98           HE2      HIS  98  11.436  13.296  14.337

  No H/Q in entry =           8
  In of MODEL   16
    1    H    GLU  99           H        GLU  99  16.539  17.185  10.389
    2    HA   GLU  99           HA       GLU  99  18.512  18.535  11.918
    3    HB2  GLU  99           HB2      GLU  99  19.005  17.241   9.856
    4    HB3  GLU  99           HB3      GLU  99  18.190  18.488   8.908
    5    HG2  GLU  99           HG2      GLU  99  19.787  20.171   9.696
    6    HG3  GLU  99           HG3      GLU  99  20.570  18.977  10.726

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LYS 100           H        LYS 100  15.988  19.674   9.690
    2    HA   LYS 100           HA       LYS 100  16.770  22.416   9.825
    3    HB2  LYS 100           HB2      LYS 100  14.146  21.109   9.069
    4    HB3  LYS 100           HB3      LYS 100  14.436  22.849   8.972
    5    HG2  LYS 100           HG2      LYS 100  16.415  22.405   7.513
    6    HG3  LYS 100           HG3      LYS 100  16.011  20.686   7.536
    7    HD2  LYS 100           HD2      LYS 100  13.816  21.179   6.528
    8    HD3  LYS 100           HD3      LYS 100  14.203  22.900   6.511
    9    HE2  LYS 100           HE2      LYS 100  16.168  22.425   5.059
   10    HE3  LYS 100           HE3      LYS 100  15.712  20.717   5.031
   11    HZ1  LYS 100           HZ1      LYS 100  13.878  22.897   4.183
   12    HZ3  LYS 100           HZ2      LYS 100  13.703  21.225   3.927
   13    HZ2  LYS 100           HZ3      LYS 100  14.912  22.091   3.105

  No H/Q in entry =          13
  In of MODEL   16
    1    H    LEU 101           H        LEU 101  14.678  20.366  11.793
    2    HA   LEU 101           HA       LEU 101  13.497  22.434  13.360
    3    HB2  LEU 101           HB2      LEU 101  13.954  19.489  13.757
    4    HB3  LEU 101           HB3      LEU 101  13.409  20.472  15.112
    5    HG   LEU 101           HG       LEU 101  11.997  20.542  12.439
    6   HD12  LEU 101          HD11      LEU 101  10.343  18.974  13.710
    7   HD11  LEU 101          HD12      LEU 101  11.737  18.573  14.710
    8   HD13  LEU 101          HD13      LEU 101  11.777  18.259  12.974
    9   HD21  LEU 101          HD21      LEU 101  11.329  21.343  15.287
   10   HD23  LEU 101          HD22      LEU 101  10.072  21.106  14.074
   11   HD22  LEU 101          HD23      LEU 101  11.301  22.346  13.834

  No H/Q in entry =          11
  In of MODEL   16
    1    H    LYS 102           H        LYS 102  16.649  21.841  12.934
    2    HA   LYS 102           HA       LYS 102  18.488  22.726  14.008
    3    HB2  LYS 102           HB2      LYS 102  16.663  24.236  15.131
    4    HB3  LYS 102           HB3      LYS 102  16.872  23.180  16.512
    5    HG2  LYS 102           HG2      LYS 102  18.757  25.196  15.340
    6    HG3  LYS 102           HG3      LYS 102  18.373  24.887  17.019
    7    HD2  LYS 102           HD2      LYS 102  20.054  22.976  15.346
    8    HD3  LYS 102           HD3      LYS 102  20.734  24.305  16.275
    9    HE2  LYS 102           HE2      LYS 102  20.346  21.758  17.253
   10    HE3  LYS 102           HE3      LYS 102  20.555  23.205  18.239
   11    HZ2  LYS 102           HZ1      LYS 102  18.591  21.914  18.857
   12    HZ1  LYS 102           HZ2      LYS 102  17.950  22.135  17.305
   13    HZ3  LYS 102           HZ3      LYS 102  18.171  23.469  18.326

  No H/Q in entry =          13
  In of MODEL   16
    1    H    ALA 103           H        ALA 103  16.418  21.120  16.431
    2    HA   ALA 103           HA       ALA 103  18.147  19.924  18.095
    3    HB2  ALA 103           HB1      ALA 103  16.573  17.909  18.093
    4    HB1  ALA 103           HB2      ALA 103  15.676  18.753  16.830
    5    HB3  ALA 103           HB3      ALA 103  15.846  19.481  18.426

  No H/Q in entry =           5
  In of MODEL   16
    1    H1   ALA   1           H3       ALA   1  -1.543  -7.185 -21.471
    2    H2   ALA   1           H2       ALA   1  -2.332  -8.622 -21.015
    3    H3   ALA   1           H1       ALA   1  -0.723  -8.666 -21.565
    4    HA   ALA   1           HA       ALA   1  -1.549  -9.147 -23.562
    5    HB1  ALA   1           HB1      ALA   1  -3.684  -9.873 -23.091
    6    HB2  ALA   1           HB2      ALA   1  -4.127  -8.368 -23.896
    7    HB3  ALA   1           HB3      ALA   1  -4.071  -8.441 -22.137

  No H/Q in entry =           7
  In of MODEL   16
    1    H    GLU   2           H        GLU   2  -2.379  -7.968 -25.558
    2    HA   GLU   2           HA       GLU   2  -0.987  -5.951 -26.439
    3    HB2  GLU   2           HB2      GLU   2  -3.993  -6.033 -26.765
    4    HB3  GLU   2           HB3      GLU   2  -2.873  -5.169 -27.815
    5    HG2  GLU   2           HG2      GLU   2  -2.358  -7.061 -28.961
    6    HG3  GLU   2           HG3      GLU   2  -2.060  -7.960 -27.479

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLU   3           H        GLU   3  -4.155  -4.705 -25.553
    2    HA   GLU   3           HA       GLU   3  -3.122  -2.142 -24.931
    3    HB2  GLU   3           HB2      GLU   3  -5.805  -3.468 -24.602
    4    HB3  GLU   3           HB3      GLU   3  -5.516  -1.849 -23.961
    5    HG2  GLU   3           HG2      GLU   3  -5.158  -0.928 -26.089
    6    HG3  GLU   3           HG3      GLU   3  -4.754  -2.484 -26.807

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LEU   4           H        LEU   4  -4.708  -4.500 -22.747
    2    HA   LEU   4           HA       LEU   4  -4.356  -3.261 -20.360
    3    HB2  LEU   4           HB2      LEU   4  -3.798  -6.202 -20.817
    4    HB3  LEU   4           HB3      LEU   4  -4.212  -5.452 -19.277
    5    HG   LEU   4           HG       LEU   4  -5.977  -5.543 -21.746
    6   HD13  LEU   4          HD11      LEU   4  -7.166  -7.262 -20.745
    7   HD12  LEU   4          HD12      LEU   4  -6.688  -6.794 -19.114
    8   HD11  LEU   4          HD13      LEU   4  -5.545  -7.636 -20.159
    9   HD23  LEU   4          HD21      LEU   4  -7.671  -4.732 -19.886
   10   HD22  LEU   4          HD22      LEU   4  -6.635  -3.559 -20.698
   11   HD21  LEU   4          HD23      LEU   4  -6.211  -4.141 -19.089

  No H/Q in entry =          11
  In of MODEL   16
    1    H    GLU   5           H        GLU   5  -1.845  -5.100 -22.077
    2    HA   GLU   5           HA       GLU   5   0.132  -4.799 -20.035
    3    HB2  GLU   5           HB2      GLU   5   0.198  -6.573 -21.793
    4    HB3  GLU   5           HB3      GLU   5   0.536  -5.326 -22.993
    5    HG2  GLU   5           HG2      GLU   5   2.647  -6.276 -22.331
    6    HG3  GLU   5           HG3      GLU   5   2.550  -4.668 -21.616

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLU   6           H        GLU   6  -0.502  -3.100 -23.088
    2    HA   GLU   6           HA       GLU   6   1.659  -1.258 -22.821
    3    HB2  GLU   6           HB2      GLU   6   0.552  -1.745 -24.985
    4    HB3  GLU   6           HB3      GLU   6  -0.918  -0.974 -24.388
    5    HG2  GLU   6           HG2      GLU   6   0.293   1.143 -24.095
    6    HG3  GLU   6           HG3      GLU   6   1.782   0.380 -24.649

  No H/Q in entry =           6
  In of MODEL   16
    1    H    VAL   7           H        VAL   7  -1.682  -1.340 -21.785
    2    HA   VAL   7           HA       VAL   7  -1.918   1.375 -20.960
    3    HB   VAL   7           HB       VAL   7  -3.372  -1.146 -20.118
    4   HG11  VAL   7          HG11      VAL   7  -3.762   1.744 -19.316
    5   HG13  VAL   7          HG12      VAL   7  -3.659   0.323 -18.275
    6   HG12  VAL   7          HG13      VAL   7  -5.090   0.583 -19.272
    7   HG21  VAL   7          HG21      VAL   7  -3.526  -0.080 -22.511
    8   HG23  VAL   7          HG22      VAL   7  -4.480   1.168 -21.706
    9   HG22  VAL   7          HG23      VAL   7  -5.018  -0.512 -21.675

  No H/Q in entry =           9
  In of MODEL   16
    1    H    VAL   8           H        VAL   8  -0.922  -1.600 -19.303
    2    HA   VAL   8           HA       VAL   8  -0.616  -0.509 -16.710
    3    HB   VAL   8           HB       VAL   8   0.810  -2.822 -18.050
    4   HG12  VAL   8          HG11      VAL   8   1.199  -3.477 -15.589
    5   HG11  VAL   8          HG12      VAL   8   0.828  -1.796 -15.208
    6   HG13  VAL   8          HG13      VAL   8   2.205  -2.182 -16.238
    7   HG22  VAL   8          HG21      VAL   8  -0.970  -4.139 -17.398
    8   HG21  VAL   8          HG22      VAL   8  -1.848  -2.613 -17.373
    9   HG23  VAL   8          HG23      VAL   8  -1.182  -3.266 -15.881

  No H/Q in entry =           9
  In of MODEL   16
    1    H    MET   9           H        MET   9   1.642  -0.811 -19.450
    2    HA   MET   9           HA       MET   9   3.920   0.246 -18.186
    3    HB2  MET   9           HB2      MET   9   2.977   0.243 -21.050
    4    HB3  MET   9           HB3      MET   9   4.478   1.042 -20.581
    5    HG2  MET   9           HG2      MET   9   5.301  -1.067 -19.601
    6    HG3  MET   9           HG3      MET   9   3.798  -1.869 -20.063
    7    HE3  MET   9           HE1      MET   9   5.998   0.766 -22.555
    8    HE2  MET   9           HE2      MET   9   7.303  -0.412 -22.445
    9    HE1  MET   9           HE3      MET   9   6.594   0.247 -20.974

  No H/Q in entry =           9
  In of MODEL   16
    1    H    GLY  10           H        GLY  10   1.234   1.832 -19.877
    2    HA3  GLY  10           HA2      GLY  10   2.187   4.490 -19.639
    3    HA2  GLY  10           HA3      GLY  10   0.500   4.023 -19.847

  No H/Q in entry =           3
  In of MODEL   16
    1    H    LEU  11           H        LEU  11   0.100   2.502 -17.556
    2    HA   LEU  11           HA       LEU  11  -0.442   4.484 -15.605
    3    HB2  LEU  11           HB2      LEU  11  -0.365   1.470 -15.438
    4    HB3  LEU  11           HB3      LEU  11  -0.881   2.496 -14.101
    5    HG   LEU  11           HG       LEU  11  -2.113   2.595 -16.867
    6   HD13  LEU  11          HD11      LEU  11  -2.691   0.453 -16.106
    7   HD12  LEU  11          HD12      LEU  11  -4.046   1.442 -15.567
    8   HD11  LEU  11          HD13      LEU  11  -2.792   0.970 -14.422
    9   HD22  LEU  11          HD21      LEU  11  -2.713   4.613 -15.869
   10   HD21  LEU  11          HD22      LEU  11  -2.640   3.952 -14.236
   11   HD23  LEU  11          HD23      LEU  11  -4.011   3.578 -15.280

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  12           H        ILE  12   2.109   2.026 -15.833
    2    HA   ILE  12           HA       ILE  12   3.307   2.576 -13.328
    3    HB   ILE  12           HB       ILE  12   4.576   1.535 -15.883
    4   HG12  ILE  12          HG12      ILE  12   2.556   0.301 -14.749
    5   HG13  ILE  12          HG13      ILE  12   3.958  -0.633 -15.232
    6   HG22  ILE  12          HG21      ILE  12   6.243   0.513 -14.287
    7   HG21  ILE  12          HG22      ILE  12   5.531   1.487 -13.001
    8   HG23  ILE  12          HG23      ILE  12   6.315   2.271 -14.370
    9   HD11  ILE  12          HD11      ILE  12   3.483   0.465 -12.448
   10   HD13  ILE  12          HD12      ILE  12   4.773  -0.629 -12.944
   11   HD12  ILE  12          HD13      ILE  12   3.110  -1.176 -12.947

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  13           H        ILE  13   3.912   3.830 -16.588
    2    HA   ILE  13           HA       ILE  13   6.042   5.559 -15.865
    3    HB   ILE  13           HB       ILE  13   4.017   5.622 -18.116
    4   HG12  ILE  13          HG12      ILE  13   5.865   3.795 -17.827
    5   HG13  ILE  13          HG13      ILE  13   5.621   4.530 -19.407
    6   HG21  ILE  13          HG21      ILE  13   6.370   7.450 -17.581
    7   HG23  ILE  13          HG22      ILE  13   4.702   7.906 -17.913
    8   HG22  ILE  13          HG23      ILE  13   5.702   7.233 -19.200
    9   HD13  ILE  13          HD11      ILE  13   7.530   6.015 -19.071
   10   HD12  ILE  13          HD12      ILE  13   8.035   4.366 -18.723
   11   HD11  ILE  13          HD13      ILE  13   7.690   5.475 -17.400

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ASN  14           H        ASN  14   2.534   6.042 -16.142
    2    HA   ASN  14           HA       ASN  14   2.482   8.790 -15.515
    3    HB2  ASN  14           HB2      ASN  14   0.596   7.139 -16.344
    4    HB3  ASN  14           HB3      ASN  14   0.271   6.966 -14.623
    5   HD21  ASN  14          HD21      ASN  14  -1.749   8.110 -16.064
    6   HD22  ASN  14          HD22      ASN  14  -1.817   9.784 -15.803

  No H/Q in entry =           6
  In of MODEL   16
    1    H    SER  15           H        SER  15   2.192   5.920 -13.429
    2    HA   SER  15           HA       SER  15   1.875   7.297 -10.986
    3    HB2  SER  15           HB2      SER  15   2.419   5.218  -9.929
    4    HB3  SER  15           HB3      SER  15   1.610   4.787 -11.431
    5    HG   SER  15           HG       SER  15   3.373   3.636 -11.666

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLY  16           H        GLY  16   4.758   6.204 -12.735
    2    HA3  GLY  16           HA2      GLY  16   6.677   6.975 -10.803
    3    HA2  GLY  16           HA3      GLY  16   6.984   6.767 -12.525

  No H/Q in entry =           3
  In of MODEL   16
    1    H    GLN  17           H        GLN  17   5.290   8.715 -13.599
    2    HA   GLN  17           HA       GLN  17   6.857  11.063 -13.296
    3    HB2  GLN  17           HB2      GLN  17   4.111  10.620 -14.500
    4    HB3  GLN  17           HB3      GLN  17   4.966  12.161 -14.576
    5    HG2  GLN  17           HG2      GLN  17   6.834  11.108 -15.751
    6    HG3  GLN  17           HG3      GLN  17   6.053   9.532 -15.619
    7   HE21  GLN  17          HE21      GLN  17   6.452  12.145 -17.712
    8   HE22  GLN  17          HE22      GLN  17   5.102  11.880 -18.707

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ALA  18           H        ALA  18   3.758  10.038 -11.949
    2    HA   ALA  18           HA       ALA  18   3.021  12.428 -10.694
    3    HB1  ALA  18           HB1      ALA  18   1.902   9.966 -10.909
    4    HB2  ALA  18           HB2      ALA  18   1.346  11.187  -9.768
    5    HB3  ALA  18           HB3      ALA  18   2.441   9.912  -9.231

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ARG  19           H        ARG  19   4.904   9.678  -9.401
    2    HA   ARG  19           HA       ARG  19   5.426  10.847  -6.882
    3    HB2  ARG  19           HB2      ARG  19   5.852   8.444  -7.399
    4    HB3  ARG  19           HB3      ARG  19   7.208   8.933  -8.419
    5    HG2  ARG  19           HG2      ARG  19   8.318   9.985  -6.498
    6    HG3  ARG  19           HG3      ARG  19   6.942   9.594  -5.468
    7    HD2  ARG  19           HD2      ARG  19   8.711   7.968  -5.101
    8    HD3  ARG  19           HD3      ARG  19   7.342   7.177  -5.886
    9    HE   ARG  19           HE       ARG  19   9.047   7.996  -7.933
   10   HH21  ARG  19          HH11      ARG  19  10.616   6.596  -8.775
   11   HH22  ARG  19          HH12      ARG  19  11.166   5.253  -7.833
   12   HH11  ARG  19          HH21      ARG  19   9.123   5.976  -5.147
   13   HH12  ARG  19          HH22      ARG  19  10.318   4.903  -5.778

  No H/Q in entry =          13
  In of MODEL   16
    1    H    SER  20           H        SER  20   7.250  10.874  -9.927
    2    HA   SER  20           HA       SER  20   9.486  12.304  -9.103
    3    HB2  SER  20           HB2      SER  20   9.527  11.421 -11.304
    4    HB3  SER  20           HB3      SER  20   8.024  12.227 -11.737
    5    HG   SER  20           HG       SER  20   9.253  14.230 -11.302

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU  21           H        LEU  21   6.383  13.553 -10.311
    2    HA   LEU  21           HA       LEU  21   7.038  16.303 -10.096
    3    HB2  LEU  21           HB2      LEU  21   4.379  14.862 -10.020
    4    HB3  LEU  21           HB3      LEU  21   4.532  16.618 -10.022
    5    HG   LEU  21           HG       LEU  21   5.745  14.831 -12.153
    6   HD11  LEU  21          HD11      LEU  21   3.247  14.686 -12.080
    7   HD13  LEU  21          HD12      LEU  21   3.851  15.433 -13.560
    8   HD12  LEU  21          HD13      LEU  21   3.175  16.438 -12.279
    9   HD23  LEU  21          HD21      LEU  21   5.514  17.158 -13.386
   10   HD22  LEU  21          HD22      LEU  21   6.878  16.902 -12.303
   11   HD21  LEU  21          HD23      LEU  21   5.484  17.819 -11.754

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ALA  22           H        ALA  22   5.534  14.013  -7.842
    2    HA   ALA  22           HA       ALA  22   4.916  15.825  -5.783
    3    HB3  ALA  22           HB1      ALA  22   4.169  13.428  -5.939
    4    HB2  ALA  22           HB2      ALA  22   4.751  13.909  -4.345
    5    HB1  ALA  22           HB3      ALA  22   5.782  12.952  -5.411

  No H/Q in entry =           5
  In of MODEL   16
    1    H    TYR  23           H        TYR  23   7.863  13.815  -6.208
    2    HA   TYR  23           HA       TYR  23   9.235  14.851  -3.956
    3    HB2  TYR  23           HB2      TYR  23  10.037  12.844  -5.105
    4    HB3  TYR  23           HB3      TYR  23  10.347  13.778  -6.568
    5    HD1  TYR  23           HD1      TYR  23  11.295  13.493  -2.964
    6    HD2  TYR  23           HD2      TYR  23  12.386  14.930  -6.864
    7    HE1  TYR  23           HE1      TYR  23  13.548  14.089  -2.116
    8    HE2  TYR  23           HE2      TYR  23  14.638  15.527  -6.015
    9    HH   TYR  23           HH       TYR  23  15.632  14.707  -2.713

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ALA  24           H        ALA  24   9.052  15.944  -7.327
    2    HA   ALA  24           HA       ALA  24  10.933  18.043  -7.085
    3    HB2  ALA  24           HB1      ALA  24  10.495  18.094  -9.295
    4    HB3  ALA  24           HB2      ALA  24   8.934  18.835  -8.941
    5    HB1  ALA  24           HB3      ALA  24   9.072  17.082  -9.064

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA  25           H        ALA  25   7.455  17.837  -6.470
    2    HA   ALA  25           HA       ALA  25   6.954  20.554  -5.912
    3    HB1  ALA  25           HB1      ALA  25   5.308  18.543  -6.109
    4    HB2  ALA  25           HB2      ALA  25   4.928  19.833  -4.966
    5    HB3  ALA  25           HB3      ALA  25   5.627  18.319  -4.388

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU  26           H        LEU  26   8.038  17.890  -3.850
    2    HA   LEU  26           HA       LEU  26   8.127  19.330  -1.418
    3    HB2  LEU  26           HB2      LEU  26   8.240  16.915  -1.403
    4    HB3  LEU  26           HB3      LEU  26   9.712  16.930  -2.371
    5    HG   LEU  26           HG       LEU  26  10.915  18.064  -0.533
    6   HD12  LEU  26          HD11      LEU  26   9.684  18.071   1.725
    7   HD11  LEU  26          HD12      LEU  26   8.199  17.918   0.787
    8   HD13  LEU  26          HD13      LEU  26   9.233  19.331   0.575
    9   HD21  LEU  26          HD21      LEU  26   9.398  15.588   0.347
   10   HD23  LEU  26          HD22      LEU  26  10.908  16.164   1.045
   11   HD22  LEU  26          HD23      LEU  26  10.870  15.599  -0.623

  No H/Q in entry =          11
  In of MODEL   16
    1    H    LYS  27           H        LYS  27  10.553  18.767  -3.936
    2    HA   LYS  27           HA       LYS  27  12.725  20.030  -2.708
    3    HB2  LYS  27           HB2      LYS  27  12.841  18.675  -4.792
    4    HB3  LYS  27           HB3      LYS  27  12.067  19.998  -5.665
    5    HG2  LYS  27           HG2      LYS  27  13.920  21.500  -5.089
    6    HG3  LYS  27           HG3      LYS  27  14.688  20.218  -4.146
    7    HD2  LYS  27           HD2      LYS  27  14.847  18.824  -6.194
    8    HD3  LYS  27           HD3      LYS  27  14.123  20.132  -7.129
    9    HE2  LYS  27           HE2      LYS  27  15.998  21.616  -6.518
   10    HE3  LYS  27           HE3      LYS  27  16.725  20.311  -5.574
   11    HZ3  LYS  27           HZ1      LYS  27  17.719  20.411  -7.759
   12    HZ2  LYS  27           HZ2      LYS  27  16.195  20.277  -8.502
   13    HZ1  LYS  27           HZ3      LYS  27  16.827  18.975  -7.612

  No H/Q in entry =          13
  In of MODEL   16
    1    H    GLN  28           H        GLN  28  10.095  21.382  -4.667
    2    HA   GLN  28           HA       GLN  28  11.033  24.042  -4.829
    3    HB2  GLN  28           HB2      GLN  28   8.208  22.950  -4.717
    4    HB3  GLN  28           HB3      GLN  28   8.610  24.624  -5.101
    5    HG2  GLN  28           HG2      GLN  28   9.624  22.209  -6.630
    6    HG3  GLN  28           HG3      GLN  28   8.284  23.233  -7.143
    7   HE21  GLN  28          HE21      GLN  28  11.422  22.752  -7.874
    8   HE22  GLN  28          HE22      GLN  28  11.903  24.338  -8.246

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ALA  29           H        ALA  29   9.110  22.343  -2.390
    2    HA   ALA  29           HA       ALA  29   8.539  24.537  -0.718
    3    HB2  ALA  29           HB1      ALA  29   7.820  22.968   0.855
    4    HB1  ALA  29           HB2      ALA  29   9.053  21.793   0.397
    5    HB3  ALA  29           HB3      ALA  29   7.666  22.070  -0.655

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LYS  30           H        LYS  30  11.289  22.293  -0.773
    2    HA   LYS  30           HA       LYS  30  12.594  23.267   1.529
    3    HB2  LYS  30           HB2      LYS  30  13.706  21.981  -0.974
    4    HB3  LYS  30           HB3      LYS  30  14.683  22.354   0.448
    5    HG2  LYS  30           HG2      LYS  30  13.139  20.963   1.830
    6    HG3  LYS  30           HG3      LYS  30  12.260  20.528   0.360
    7    HD2  LYS  30           HD2      LYS  30  14.315  19.556  -0.593
    8    HD3  LYS  30           HD3      LYS  30  15.213  20.005   0.859
    9    HE2  LYS  30           HE2      LYS  30  13.718  18.566   2.216
   10    HE3  LYS  30           HE3      LYS  30  12.851  18.097   0.748
   11    HZ2  LYS  30           HZ1      LYS  30  14.655  16.537   1.518
   12    HZ1  LYS  30           HZ2      LYS  30  15.782  17.733   1.064
   13    HZ3  LYS  30           HZ3      LYS  30  14.755  17.035  -0.100

  No H/Q in entry =          13
  In of MODEL   16
    1    H    GLN  31           H        GLN  31  12.481  24.458  -1.773
    2    HA   GLN  31           HA       GLN  31  14.616  26.371  -1.355
    3    HB2  GLN  31           HB2      GLN  31  12.577  26.392  -3.583
    4    HB3  GLN  31           HB3      GLN  31  14.191  27.102  -3.584
    5    HG2  GLN  31           HG2      GLN  31  14.676  24.412  -2.997
    6    HG3  GLN  31           HG3      GLN  31  13.374  24.342  -4.178
    7   HE21  GLN  31          HE21      GLN  31  16.226  23.572  -4.573
    8   HE22  GLN  31          HE22      GLN  31  16.792  24.546  -5.842

  No H/Q in entry =           8
  In of MODEL   16
    1    H    GLY  32           H        GLY  32  11.541  26.167  -0.214
    2    HA3  GLY  32           HA2      GLY  32  10.369  27.730   1.051
    3    HA2  GLY  32           HA3      GLY  32  11.484  28.973   0.498

  No H/Q in entry =           3
  In of MODEL   16
    1    H    ASP  33           H        ASP  33  10.142  27.047  -1.990
    2    HA   ASP  33           HA       ASP  33   8.459  29.302  -2.857
    3    HB2  ASP  33           HB2      ASP  33   9.576  26.887  -4.288
    4    HB3  ASP  33           HB3      ASP  33   8.417  27.989  -5.025

  No H/Q in entry =           4
  In of MODEL   16
    1    H    PHE  34           H        PHE  34   6.772  28.818  -1.295
    2    HA   PHE  34           HA       PHE  34   5.414  26.334  -1.192
    3    HB2  PHE  34           HB2      PHE  34   4.427  29.115  -0.525
    4    HB3  PHE  34           HB3      PHE  34   3.591  27.619  -0.110
    5    HD1  PHE  34           HD1      PHE  34   5.817  30.042   1.100
    6    HD2  PHE  34           HD2      PHE  34   5.174  25.795   1.061
    7    HE1  PHE  34           HE1      PHE  34   7.206  29.811   3.140
    8    HE2  PHE  34           HE2      PHE  34   6.566  25.568   3.100
    9    HZ   PHE  34           HZ       PHE  34   7.575  27.578   4.138

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ALA  35           H        ALA  35   4.962  29.186  -3.215
    2    HA   ALA  35           HA       ALA  35   2.418  28.545  -4.242
    3    HB3  ALA  35           HB1      ALA  35   3.462  29.939  -6.284
    4    HB2  ALA  35           HB2      ALA  35   4.674  30.315  -5.059
    5    HB1  ALA  35           HB3      ALA  35   2.979  30.711  -4.773

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA  36           H        ALA  36   5.655  27.895  -5.588
    2    HA   ALA  36           HA       ALA  36   4.683  26.449  -7.828
    3    HB3  ALA  36           HB1      ALA  36   6.842  26.590  -8.440
    4    HB2  ALA  36           HB2      ALA  36   7.330  25.571  -7.085
    5    HB1  ALA  36           HB3      ALA  36   7.209  27.318  -6.876

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA  37           H        ALA  37   5.642  25.475  -4.567
    2    HA   ALA  37           HA       ALA  37   5.609  22.685  -4.986
    3    HB2  ALA  37           HB1      ALA  37   5.327  24.483  -2.615
    4    HB1  ALA  37           HB2      ALA  37   6.473  23.174  -2.900
    5    HB3  ALA  37           HB3      ALA  37   4.814  22.808  -2.430

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LYS  38           H        LYS  38   3.054  24.875  -3.831
    2    HA   LYS  38           HA       LYS  38   0.971  23.044  -3.605
    3    HB2  LYS  38           HB2      LYS  38   1.297  25.804  -3.364
    4    HB3  LYS  38           HB3      LYS  38   0.102  25.641  -4.645
    5    HG2  LYS  38           HG2      LYS  38  -1.339  24.310  -3.200
    6    HG3  LYS  38           HG3      LYS  38  -0.096  24.266  -1.941
    7    HD2  LYS  38           HD2      LYS  38  -0.304  26.603  -1.503
    8    HD3  LYS  38           HD3      LYS  38  -1.216  26.878  -2.988
    9    HE2  LYS  38           HE2      LYS  38  -2.723  26.906  -1.051
   10    HE3  LYS  38           HE3      LYS  38  -3.083  25.523  -2.089
   11    HZ3  LYS  38           HZ1      LYS  38  -2.347  24.064  -0.549
   12    HZ2  LYS  38           HZ2      LYS  38  -2.711  25.322   0.535
   13    HZ1  LYS  38           HZ3      LYS  38  -1.113  25.084   0.014

  No H/Q in entry =          13
  In of MODEL   16
    1    H    ALA  39           H        ALA  39   1.939  24.944  -6.460
    2    HA   ALA  39           HA       ALA  39  -0.126  24.052  -8.163
    3    HB2  ALA  39           HB1      ALA  39   2.607  24.720  -9.214
    4    HB1  ALA  39           HB2      ALA  39   1.627  25.976  -8.456
    5    HB3  ALA  39           HB3      ALA  39   1.025  25.127  -9.880

  No H/Q in entry =           5
  In of MODEL   16
    1    H    MET  40           H        MET  40   3.123  22.784  -7.572
    2    HA   MET  40           HA       MET  40   3.047  20.755  -9.556
    3    HB2  MET  40           HB2      MET  40   4.651  21.004  -7.005
    4    HB3  MET  40           HB3      MET  40   4.916  19.745  -8.214
    5    HG2  MET  40           HG2      MET  40   4.948  22.699  -8.891
    6    HG3  MET  40           HG3      MET  40   6.401  21.811  -8.436
    7    HE3  MET  40           HE1      MET  40   7.299  19.593 -11.234
    8    HE2  MET  40           HE2      MET  40   6.735  19.275  -9.596
    9    HE1  MET  40           HE3      MET  40   7.819  20.631  -9.899

  No H/Q in entry =           9
  In of MODEL   16
    1    H    MET  41           H        MET  41   2.125  20.803  -6.134
    2    HA   MET  41           HA       MET  41   1.617  18.034  -5.846
    3    HB2  MET  41           HB2      MET  41   0.261  20.385  -4.507
    4    HB3  MET  41           HB3      MET  41   0.119  18.707  -3.993
    5    HG2  MET  41           HG2      MET  41   2.828  18.955  -4.026
    6    HG3  MET  41           HG3      MET  41   2.371  20.611  -3.637
    7    HE2  MET  41           HE1      MET  41  -0.660  19.337  -1.913
    8    HE1  MET  41           HE2      MET  41   0.143  20.856  -2.294
    9    HE3  MET  41           HE3      MET  41   0.086  20.291  -0.624

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ASP  42           H        ASP  42  -0.444  20.736  -6.835
    2    HA   ASP  42           HA       ASP  42  -2.872  19.352  -6.971
    3    HB2  ASP  42           HB2      ASP  42  -2.189  21.928  -7.236
    4    HB3  ASP  42           HB3      ASP  42  -2.333  21.525  -8.943

  No H/Q in entry =           4
  In of MODEL   16
    1    H    GLN  43           H        GLN  43  -0.432  19.956  -9.470
    2    HA   GLN  43           HA       GLN  43  -1.802  18.616 -11.557
    3    HB2  GLN  43           HB2      GLN  43   1.150  19.161 -11.172
    4    HB3  GLN  43           HB3      GLN  43   0.445  18.509 -12.653
    5    HG2  GLN  43           HG2      GLN  43  -1.085  20.521 -12.705
    6    HG3  GLN  43           HG3      GLN  43  -0.141  21.192 -11.378
    7   HE21  GLN  43          HE21      GLN  43   0.009  22.805 -13.470
    8   HE22  GLN  43          HE22      GLN  43   1.427  22.594 -14.374

  No H/Q in entry =           8
  In of MODEL   16
    1    H    SER  44           H        SER  44   0.554  17.507  -9.158
    2    HA   SER  44           HA       SER  44   0.916  14.900 -10.172
    3    HB2  SER  44           HB2      SER  44   1.793  16.356  -7.939
    4    HB3  SER  44           HB3      SER  44   0.943  14.967  -7.265
    5    HG   SER  44           HG       SER  44   3.060  14.366  -7.685

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ARG  45           H        ARG  45  -1.421  16.205  -7.844
    2    HA   ARG  45           HA       ARG  45  -2.785  13.833  -7.202
    3    HB2  ARG  45           HB2      ARG  45  -3.007  16.004  -6.019
    4    HB3  ARG  45           HB3      ARG  45  -3.867  16.657  -7.410
    5    HG2  ARG  45           HG2      ARG  45  -5.617  14.915  -7.124
    6    HG3  ARG  45           HG3      ARG  45  -4.769  14.317  -5.697
    7    HD2  ARG  45           HD2      ARG  45  -5.000  16.585  -4.650
    8    HD3  ARG  45           HD3      ARG  45  -5.989  17.090  -6.036
    9    HE   ARG  45           HE       ARG  45  -7.078  14.707  -4.989
   10   HH21  ARG  45          HH11      ARG  45  -8.917  14.769  -3.722
   11   HH22  ARG  45          HH12      ARG  45  -9.328  16.208  -2.859
   12   HH11  ARG  45          HH21      ARG  45  -6.567  17.963  -3.977
   13   HH12  ARG  45          HH22      ARG  45  -7.992  18.017  -3.002

  No H/Q in entry =          13
  In of MODEL   16
    1    H    MET  46           H        MET  46  -3.389  16.221  -9.763
    2    HA   MET  46           HA       MET  46  -5.714  15.021 -10.825
    3    HB2  MET  46           HB2      MET  46  -3.627  16.862 -12.007
    4    HB3  MET  46           HB3      MET  46  -5.008  16.292 -12.951
    5    HG2  MET  46           HG2      MET  46  -6.558  17.226 -11.310
    6    HG3  MET  46           HG3      MET  46  -5.218  17.718 -10.281
    7    HE3  MET  46           HE1      MET  46  -5.552  18.183 -14.419
    8    HE2  MET  46           HE2      MET  46  -6.743  19.456 -14.179
    9    HE1  MET  46           HE3      MET  46  -7.014  17.863 -13.478

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ALA  47           H        ALA  47  -2.279  14.574 -11.574
    2    HA   ALA  47           HA       ALA  47  -2.602  12.835 -13.778
    3    HB3  ALA  47           HB1      ALA  47  -0.434  13.748 -13.426
    4    HB2  ALA  47           HB2      ALA  47  -0.276  12.023 -13.085
    5    HB1  ALA  47           HB3      ALA  47  -0.383  13.179 -11.756

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU  48           H        LEU  48  -2.333  12.215 -10.302
    2    HA   LEU  48           HA       LEU  48  -2.397   9.374 -10.449
    3    HB2  LEU  48           HB2      LEU  48  -3.186  11.293  -8.244
    4    HB3  LEU  48           HB3      LEU  48  -3.074   9.544  -8.036
    5    HG   LEU  48           HG       LEU  48  -0.791  11.263  -9.036
    6   HD13  LEU  48          HD11      LEU  48  -1.086  12.039  -6.849
    7   HD12  LEU  48          HD12      LEU  48   0.091  10.745  -6.643
    8   HD11  LEU  48          HD13      LEU  48  -1.606  10.466  -6.247
    9   HD22  LEU  48          HD21      LEU  48  -0.268   9.081  -9.667
   10   HD21  LEU  48          HD22      LEU  48  -1.133   8.361  -8.310
   11   HD23  LEU  48          HD23      LEU  48   0.431   9.132  -8.049

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ASN  49           H        ASN  49  -4.887  11.842 -10.062
    2    HA   ASN  49           HA       ASN  49  -7.056  10.157  -9.520
    3    HB2  ASN  49           HB2      ASN  49  -7.133  12.583  -9.209
    4    HB3  ASN  49           HB3      ASN  49  -6.983  12.834 -10.944
    5   HD21  ASN  49          HD21      ASN  49  -9.193  13.910  -9.623
    6   HD22  ASN  49          HD22      ASN  49 -10.592  13.051 -10.052

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLU  50           H        GLU  50  -5.783  11.355 -12.610
    2    HA   GLU  50           HA       GLU  50  -7.721  10.073 -14.255
    3    HB2  GLU  50           HB2      GLU  50  -6.272  11.904 -15.073
    4    HB3  GLU  50           HB3      GLU  50  -4.867  10.847 -14.928
    5    HG2  GLU  50           HG2      GLU  50  -5.821   9.294 -16.560
    6    HG3  GLU  50           HG3      GLU  50  -7.292  10.257 -16.655

  No H/Q in entry =           6
  In of MODEL   16
    1    H    ALA  51           H        ALA  51  -4.542   9.118 -13.039
    2    HA   ALA  51           HA       ALA  51  -4.374   6.661 -14.447
    3    HB2  ALA  51           HB1      ALA  51  -2.393   6.398 -13.341
    4    HB1  ALA  51           HB2      ALA  51  -3.089   6.820 -11.777
    5    HB3  ALA  51           HB3      ALA  51  -2.644   8.091 -12.915

  No H/Q in entry =           5
  In of MODEL   16
    1    H    HIS  52           H        HIS  52  -5.563   7.494 -11.203
    2    HA   HIS  52           HA       HIS  52  -6.223   4.880 -10.363
    3    HB2  HIS  52           HB2      HIS  52  -6.107   6.869  -8.872
    4    HB3  HIS  52           HB3      HIS  52  -7.590   7.472  -9.610
    5    HD1  HIS  52           HD1      HIS  52  -9.766   5.958  -9.282
    6    HD2  HIS  52           HD2      HIS  52  -6.496   4.897  -6.926
    7    HE1  HIS  52           HE1      HIS  52 -10.656   4.435  -7.465
    8    HE2  HIS  52           HE2      HIS  52  -8.675   3.779  -6.019

  No H/Q in entry =           8
  In of MODEL   16
    1    H    LEU  53           H        LEU  53  -8.064   7.312 -12.165
    2    HA   LEU  53           HA       LEU  53 -10.556   5.995 -12.178
    3    HB2  LEU  53           HB2      LEU  53  -9.287   7.985 -14.046
    4    HB3  LEU  53           HB3      LEU  53 -10.873   7.297 -14.381
    5    HG   LEU  53           HG       LEU  53 -10.203   8.626 -11.736
    6   HD12  LEU  53          HD11      LEU  53 -11.581  10.547 -12.746
    7   HD11  LEU  53          HD12      LEU  53 -11.269   9.793 -14.311
    8   HD13  LEU  53          HD13      LEU  53  -9.930  10.373 -13.325
    9   HD23  LEU  53          HD21      LEU  53 -12.796   8.982 -11.910
   10   HD22  LEU  53          HD22      LEU  53 -12.187   7.401 -11.436
   11   HD21  LEU  53          HD23      LEU  53 -12.737   7.669 -13.078

  No H/Q in entry =          11
  In of MODEL   16
    1    H    VAL  54           H        VAL  54  -7.799   5.816 -14.408
    2    HA   VAL  54           HA       VAL  54  -8.999   4.026 -16.247
    3    HB   VAL  54           HB       VAL  54  -6.099   4.564 -15.560
    4   HG12  VAL  54          HG11      VAL  54  -5.835   3.472 -17.944
    5   HG11  VAL  54          HG12      VAL  54  -7.357   2.678 -17.541
    6   HG13  VAL  54          HG13      VAL  54  -5.941   2.441 -16.518
    7   HG22  VAL  54          HG21      VAL  54  -6.885   6.495 -16.614
    8   HG21  VAL  54          HG22      VAL  54  -8.067   5.617 -17.581
    9   HG23  VAL  54          HG23      VAL  54  -6.359   5.551 -18.008

  No H/Q in entry =           9
  In of MODEL   16
    1    H    GLN  55           H        GLN  55  -7.002   3.511 -13.341
    2    HA   GLN  55           HA       GLN  55  -6.885   0.694 -13.585
    3    HB2  GLN  55           HB2      GLN  55  -5.342   1.611 -12.066
    4    HB3  GLN  55           HB3      GLN  55  -6.569   2.569 -11.243
    5    HG2  GLN  55           HG2      GLN  55  -7.244   0.810  -9.920
    6    HG3  GLN  55           HG3      GLN  55  -7.005  -0.380 -11.193
    7   HE21  GLN  55          HE21      GLN  55  -5.369  -1.812 -10.689
    8   HE22  GLN  55          HE22      GLN  55  -3.990  -1.443  -9.775

  No H/Q in entry =           8
  In of MODEL   16
    1    H    THR  56           H        THR  56  -9.241   2.841 -11.985
    2    HA   THR  56           HA       THR  56 -10.810   0.948 -10.692
    3    HB   THR  56           HB       THR  56 -11.722   3.438 -12.164
    4    HG1  THR  56           HG1      THR  56 -10.220   3.148 -10.070
    5   HG21  THR  56          HG21      THR  56 -13.102   1.699 -10.106
    6   HG23  THR  56          HG22      THR  56 -13.622   1.985 -11.767
    7   HG22  THR  56          HG23      THR  56 -13.668   3.297 -10.589

  No H/Q in entry =           7
  In of MODEL   16
    1    H    LYS  57           H        LYS  57 -11.013   2.015 -14.083
    2    HA   LYS  57           HA       LYS  57 -13.152   0.305 -14.835
    3    HB2  LYS  57           HB2      LYS  57 -12.289   2.260 -16.157
    4    HB3  LYS  57           HB3      LYS  57 -10.842   1.329 -16.520
    5    HG2  LYS  57           HG2      LYS  57 -12.178  -0.357 -17.683
    6    HG3  LYS  57           HG3      LYS  57 -13.660   0.497 -17.270
    7    HD2  LYS  57           HD2      LYS  57 -12.890   2.457 -18.573
    8    HD3  LYS  57           HD3      LYS  57 -11.419   1.589 -19.006
    9    HE2  LYS  57           HE2      LYS  57 -14.250   0.721 -19.698
   10    HE3  LYS  57           HE3      LYS  57 -13.097   1.426 -20.830
   11    HZ3  LYS  57           HZ1      LYS  57 -12.549  -0.685 -21.220
   12    HZ2  LYS  57           HZ2      LYS  57 -13.249  -1.253 -19.780
   13    HZ1  LYS  57           HZ3      LYS  57 -11.683  -0.593 -19.764

  No H/Q in entry =          13
  In of MODEL   16
    1    H    LEU  58           H        LEU  58  -9.644  -0.093 -14.767
    2    HA   LEU  58           HA       LEU  58  -9.625  -2.616 -16.046
    3    HB2  LEU  58           HB2      LEU  58  -7.607  -1.297 -14.238
    4    HB3  LEU  58           HB3      LEU  58  -7.330  -2.820 -15.084
    5    HG   LEU  58           HG       LEU  58  -8.105  -0.228 -16.461
    6   HD11  LEU  58          HD11      LEU  58  -5.449  -1.437 -15.758
    7   HD13  LEU  58          HD12      LEU  58  -5.960   0.249 -15.717
    8   HD12  LEU  58          HD13      LEU  58  -5.609  -0.525 -17.259
    9   HD22  LEU  58          HD21      LEU  58  -8.661  -1.802 -18.047
   10   HD21  LEU  58          HD22      LEU  58  -7.610  -3.037 -17.357
   11   HD23  LEU  58          HD23      LEU  58  -6.929  -1.761 -18.366

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  59           H        ILE  59 -10.463  -1.707 -12.801
    2    HA   ILE  59           HA       ILE  59 -10.089  -4.467 -11.840
    3    HB   ILE  59           HB       ILE  59  -9.673  -2.186 -10.451
    4   HG12  ILE  59          HG12      ILE  59 -11.008  -4.557  -9.125
    5   HG13  ILE  59          HG13      ILE  59  -9.361  -4.605  -9.700
    6   HG23  ILE  59          HG21      ILE  59 -11.516  -1.519  -9.139
    7   HG22  ILE  59          HG22      ILE  59 -12.434  -2.959  -9.513
    8   HG21  ILE  59          HG23      ILE  59 -12.218  -1.703 -10.729
    9   HD12  ILE  59          HD11      ILE  59  -9.441  -4.010  -7.320
   10   HD11  ILE  59          HD12      ILE  59 -10.442  -2.616  -7.704
   11   HD13  ILE  59          HD13      ILE  59  -8.774  -2.689  -8.275

  No H/Q in entry =          11
  In of MODEL   16
    1    H    GLU  60           H        GLU  60 -12.666  -2.179 -12.666
    2    HA   GLU  60           HA       GLU  60 -14.839  -3.713 -11.652
    3    HB2  GLU  60           HB2      GLU  60 -15.066  -1.342 -12.262
    4    HB3  GLU  60           HB3      GLU  60 -14.750  -1.735 -13.949
    5    HG2  GLU  60           HG2      GLU  60 -16.775  -3.177 -13.973
    6    HG3  GLU  60           HG3      GLU  60 -17.107  -2.710 -12.318

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLY  61           H        GLY  61 -13.157  -3.695 -14.762
    2    HA3  GLY  61           HA2      GLY  61 -14.846  -5.960 -15.647
    3    HA2  GLY  61           HA3      GLY  61 -14.009  -4.852 -16.728

  No H/Q in entry =           3
  In of MODEL   16
    1    H    ASP  62           H        ASP  62 -12.628  -6.274 -13.833
    2    HA   ASP  62           HA       ASP  62 -10.379  -7.267 -15.326
    3    HB2  ASP  62           HB2      ASP  62  -9.570  -7.965 -13.094
    4    HB3  ASP  62           HB3      ASP  62 -10.086  -6.282 -13.111

  No H/Q in entry =           4
  In of MODEL   16
    1    H    ALA  63           H        ALA  63 -12.177  -8.687 -16.586
    2    HA   ALA  63           HA       ALA  63 -13.107 -11.107 -15.410
    3    HB1  ALA  63           HB1      ALA  63 -14.054 -10.364 -17.503
    4    HB3  ALA  63           HB2      ALA  63 -13.199 -11.869 -17.842
    5    HB2  ALA  63           HB3      ALA  63 -12.466 -10.321 -18.269

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLY  64           H        GLY  64 -10.154 -10.237 -17.119
    2    HA3  GLY  64           HA2      GLY  64  -8.075 -11.212 -17.182
    3    HA2  GLY  64           HA3      GLY  64  -8.582 -12.248 -15.854

  No H/Q in entry =           3
  In of MODEL   16
    1    H    GLU  65           H        GLU  65  -7.292 -13.881 -17.070
    2    HA   GLU  65           HA       GLU  65  -8.071 -14.783 -19.623
    3    HB2  GLU  65           HB2      GLU  65  -6.621 -16.194 -17.386
    4    HB3  GLU  65           HB3      GLU  65  -6.837 -16.876 -18.998
    5    HG2  GLU  65           HG2      GLU  65  -5.673 -14.982 -20.000
    6    HG3  GLU  65           HG3      GLU  65  -5.531 -14.203 -18.425

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLY  66           H        GLY  66  -9.004 -15.817 -16.421
    2    HA3  GLY  66           HA2      GLY  66 -11.123 -17.534 -17.537
    3    HA2  GLY  66           HA3      GLY  66 -10.325 -17.828 -16.004

  No H/Q in entry =           3
  In of MODEL   16
    1    H    LYS  67           H        LYS  67 -12.923 -17.916 -15.899
    2    HA   LYS  67           HA       LYS  67 -14.430 -15.606 -15.666
    3    HB2  LYS  67           HB2      LYS  67 -14.710 -18.278 -14.303
    4    HB3  LYS  67           HB3      LYS  67 -15.946 -17.014 -14.249
    5    HG2  LYS  67           HG2      LYS  67 -16.033 -16.974 -16.709
    6    HG3  LYS  67           HG3      LYS  67 -14.784 -18.216 -16.781
    7    HD2  LYS  67           HD2      LYS  67 -16.276 -19.787 -15.597
    8    HD3  LYS  67           HD3      LYS  67 -17.526 -18.543 -15.528
    9    HE2  LYS  67           HE2      LYS  67 -17.561 -18.435 -17.997
   10    HE3  LYS  67           HE3      LYS  67 -16.316 -19.684 -18.066
   11    HZ2  LYS  67           HZ1      LYS  67 -18.772 -20.362 -18.280
   12    HZ1  LYS  67           HZ2      LYS  67 -18.822 -20.162 -16.595
   13    HZ3  LYS  67           HZ3      LYS  67 -17.756 -21.288 -17.288

  No H/Q in entry =          13
  In of MODEL   16
    1    H    MET  68           H        MET  68 -13.448 -17.486 -12.860
    2    HA   MET  68           HA       MET  68 -13.912 -15.474 -10.951
    3    HB2  MET  68           HB2      MET  68 -12.422 -18.079 -10.915
    4    HB3  MET  68           HB3      MET  68 -12.477 -17.034  -9.495
    5    HG2  MET  68           HG2      MET  68 -14.940 -17.981 -10.984
    6    HG3  MET  68           HG3      MET  68 -14.294 -18.775  -9.547
    7    HE1  MET  68           HE1      MET  68 -16.567 -18.627  -8.948
    8    HE3  MET  68           HE2      MET  68 -17.497 -17.249  -9.533
    9    HE2  MET  68           HE3      MET  68 -17.157 -17.405  -7.811

  No H/Q in entry =           9
  In of MODEL   16
    1    H    LYS  69           H        LYS  69 -10.860 -16.443 -12.544
    2    HA   LYS  69           HA       LYS  69  -9.221 -14.826 -10.876
    3    HB2  LYS  69           HB2      LYS  69  -8.718 -16.182 -13.522
    4    HB3  LYS  69           HB3      LYS  69  -7.466 -15.304 -12.639
    5    HG2  LYS  69           HG2      LYS  69  -7.833 -16.743 -10.670
    6    HG3  LYS  69           HG3      LYS  69  -9.100 -17.611 -11.535
    7    HD2  LYS  69           HD2      LYS  69  -7.456 -18.338 -13.224
    8    HD3  LYS  69           HD3      LYS  69  -6.185 -17.469 -12.362
    9    HE2  LYS  69           HE2      LYS  69  -6.568 -18.871 -10.370
   10    HE3  LYS  69           HE3      LYS  69  -7.847 -19.735 -11.220
   11    HZ1  LYS  69           HZ1      LYS  69  -5.817 -19.937 -12.951
   12    HZ3  LYS  69           HZ2      LYS  69  -6.193 -21.109 -11.783
   13    HZ2  LYS  69           HZ3      LYS  69  -4.976 -19.963 -11.478

  No H/Q in entry =          13
  In of MODEL   16
    1    H    VAL  70           H        VAL  70  -7.658 -13.149 -11.713
    2    HA   VAL  70           HA       VAL  70  -8.978 -11.248 -13.568
    3    HB   VAL  70           HB       VAL  70  -8.152  -9.430 -12.100
    4   HG12  VAL  70          HG11      VAL  70  -9.690 -10.111 -10.086
    5   HG11  VAL  70          HG12      VAL  70 -10.033 -11.536 -11.068
    6   HG13  VAL  70          HG13      VAL  70 -10.405  -9.929 -11.687
    7   HG22  VAL  70          HG21      VAL  70  -6.262 -10.485 -11.016
    8   HG21  VAL  70          HG22      VAL  70  -7.287 -11.766 -10.371
    9   HG23  VAL  70          HG23      VAL  70  -7.434 -10.123  -9.749

  No H/Q in entry =           9
  In of MODEL   16
    1    H    SER  71           H        SER  71  -7.418  -9.600 -14.389
    2    HA   SER  71           HA       SER  71  -5.189 -10.793 -15.650
    3    HB2  SER  71           HB2      SER  71  -6.369  -8.777 -16.515
    4    HB3  SER  71           HB3      SER  71  -5.722  -7.849 -15.163
    5    HG   SER  71           HG       SER  71  -3.606  -8.635 -15.953

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU  72           H        LEU  72  -3.128 -11.031 -15.035
    2    HA   LEU  72           HA       LEU  72  -2.418 -10.798 -12.322
    3    HB2  LEU  72           HB2      LEU  72  -0.749 -11.219 -14.797
    4    HB3  LEU  72           HB3      LEU  72  -0.097 -11.285 -13.163
    5    HG   LEU  72           HG       LEU  72  -2.421 -13.001 -14.101
    6   HD13  LEU  72          HD11      LEU  72  -0.777 -14.830 -14.257
    7   HD12  LEU  72          HD12      LEU  72   0.519 -13.706 -13.849
    8   HD11  LEU  72          HD13      LEU  72  -0.359 -13.523 -15.368
    9   HD21  LEU  72          HD21      LEU  72  -0.745 -12.832 -11.603
   10   HD23  LEU  72          HD22      LEU  72  -1.441 -14.378 -12.063
   11   HD22  LEU  72          HD23      LEU  72  -2.491 -13.000 -11.748

  No H/Q in entry =          11
  In of MODEL   16
    1    H    VAL  73           H        VAL  73  -1.712  -8.788 -15.110
    2    HA   VAL  73           HA       VAL  73   0.191  -7.067 -14.009
    3    HB   VAL  73           HB       VAL  73  -0.221  -5.653 -15.871
    4   HG12  VAL  73          HG11      VAL  73  -0.972  -8.455 -16.748
    5   HG11  VAL  73          HG12      VAL  73   0.669  -7.968 -16.326
    6   HG13  VAL  73          HG13      VAL  73  -0.144  -7.225 -17.703
    7   HG22  VAL  73          HG21      VAL  73  -2.494  -5.175 -15.934
    8   HG21  VAL  73          HG22      VAL  73  -2.959  -6.860 -15.713
    9   HG23  VAL  73          HG23      VAL  73  -2.370  -6.307 -17.280

  No H/Q in entry =           9
  In of MODEL   16
    1    H    LEU  74           H        LEU  74  -3.207  -7.210 -13.461
    2    HA   LEU  74           HA       LEU  74  -3.850  -4.557 -12.863
    3    HB2  LEU  74           HB2      LEU  74  -5.562  -6.243 -13.035
    4    HB3  LEU  74           HB3      LEU  74  -4.869  -7.147 -11.692
    5    HG   LEU  74           HG       LEU  74  -5.355  -5.256 -10.170
    6   HD13  LEU  74          HD11      LEU  74  -5.262  -3.339 -11.566
    7   HD12  LEU  74          HD12      LEU  74  -6.970  -3.506 -11.162
    8   HD11  LEU  74          HD13      LEU  74  -6.380  -4.037 -12.738
    9   HD23  LEU  74          HD21      LEU  74  -7.903  -5.730 -11.625
   10   HD22  LEU  74          HD22      LEU  74  -7.528  -5.861  -9.920
   11   HD21  LEU  74          HD23      LEU  74  -7.032  -7.132 -11.011

  No H/Q in entry =          11
  In of MODEL   16
    1    H    VAL  75           H        VAL  75  -2.793  -7.124 -10.686
    2    HA   VAL  75           HA       VAL  75  -2.615  -5.560  -8.349
    3    HB   VAL  75           HB       VAL  75  -1.097  -8.047  -9.124
    4   HG13  VAL  75          HG11      VAL  75   0.158  -6.818  -7.399
    5   HG12  VAL  75          HG12      VAL  75  -0.663  -8.178  -6.649
    6   HG11  VAL  75          HG13      VAL  75  -1.318  -6.558  -6.477
    7   HG21  VAL  75          HG21      VAL  75  -3.581  -8.222  -8.931
    8   HG23  VAL  75          HG22      VAL  75  -3.481  -7.557  -7.301
    9   HG22  VAL  75          HG23      VAL  75  -2.754  -9.124  -7.659

  No H/Q in entry =           9
  In of MODEL   16
    1    H    GLU  76           H        GLU  76  -0.192  -6.312 -10.875
    2    HA   GLU  76           HA       GLU  76   1.978  -4.940  -9.717
    3    HB2  GLU  76           HB2      GLU  76   2.211  -6.420 -11.688
    4    HB3  GLU  76           HB3      GLU  76   1.278  -5.289 -12.655
    5    HG2  GLU  76           HG2      GLU  76   3.609  -4.916 -13.155
    6    HG3  GLU  76           HG3      GLU  76   3.064  -3.543 -12.211

  No H/Q in entry =           6
  In of MODEL   16
    1    H    ALA  77           H        ALA  77  -0.557  -3.771 -11.919
    2    HA   ALA  77           HA       ALA  77   0.410  -1.117 -12.105
    3    HB2  ALA  77           HB1      ALA  77  -1.787  -0.567 -12.981
    4    HB3  ALA  77           HB2      ALA  77  -2.463  -2.055 -12.317
    5    HB1  ALA  77           HB3      ALA  77  -1.289  -2.130 -13.630

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLN  78           H        GLN  78  -1.851  -2.682  -9.893
    2    HA   GLN  78           HA       GLN  78  -2.683  -0.364  -8.506
    3    HB2  GLN  78           HB2      GLN  78  -3.776  -2.630  -8.413
    4    HB3  GLN  78           HB3      GLN  78  -2.435  -3.178  -7.407
    5    HG2  GLN  78           HG2      GLN  78  -2.966  -1.444  -5.747
    6    HG3  GLN  78           HG3      GLN  78  -4.303  -0.884  -6.749
    7   HE21  GLN  78          HE21      GLN  78  -4.753  -1.869  -4.090
    8   HE22  GLN  78          HE22      GLN  78  -5.617  -3.326  -4.205

  No H/Q in entry =           8
  In of MODEL   16
    1    H    LEU  79           H        LEU  79   0.015  -2.593  -8.036
    2    HA   LEU  79           HA       LEU  79   0.974  -1.676  -5.580
    3    HB2  LEU  79           HB2      LEU  79   1.867  -3.681  -6.636
    4    HB3  LEU  79           HB3      LEU  79   2.508  -2.730  -7.972
    5    HG   LEU  79           HG       LEU  79   4.048  -1.569  -6.468
    6   HD13  LEU  79          HD11      LEU  79   3.035  -1.323  -4.406
    7   HD12  LEU  79          HD12      LEU  79   4.125  -2.661  -4.052
    8   HD11  LEU  79          HD13      LEU  79   2.424  -2.978  -4.386
    9   HD23  LEU  79          HD21      LEU  79   5.276  -3.701  -5.551
   10   HD22  LEU  79          HD22      LEU  79   5.077  -3.512  -7.291
   11   HD21  LEU  79          HD23      LEU  79   4.006  -4.588  -6.397

  No H/Q in entry =          11
  In of MODEL   16
    1    H    HIS  80           H        HIS  80   1.844  -0.566  -8.856
    2    HA   HIS  80           HA       HIS  80   3.630   1.443  -7.937
    3    HB2  HIS  80           HB2      HIS  80   2.355   0.724 -10.521
    4    HB3  HIS  80           HB3      HIS  80   2.933   2.383 -10.356
    5    HD1  HIS  80           HD1      HIS  80   5.333   2.705 -10.872
    6    HD2  HIS  80           HD2      HIS  80   4.549  -1.208  -9.664
    7    HE1  HIS  80           HE1      HIS  80   7.536   1.449 -11.024
    8    HE2  HIS  80           HE2      HIS  80   7.070  -0.939 -10.292

  No H/Q in entry =           8
  In of MODEL   16
    1    H    LEU  81           H        LEU  81   0.227   1.564  -8.929
    2    HA   LEU  81           HA       LEU  81  -0.077   4.355  -8.612
    3    HB2  LEU  81           HB2      LEU  81  -2.069   2.090  -8.529
    4    HB3  LEU  81           HB3      LEU  81  -2.539   3.788  -8.447
    5    HG   LEU  81           HG       LEU  81  -0.827   2.646 -10.671
    6   HD12  LEU  81          HD11      LEU  81  -3.058   2.936 -11.980
    7   HD11  LEU  81          HD12      LEU  81  -3.818   2.867 -10.390
    8   HD13  LEU  81          HD13      LEU  81  -2.859   1.507 -10.968
    9   HD23  LEU  81          HD21      LEU  81  -1.943   4.773 -11.783
   10   HD22  LEU  81          HD22      LEU  81  -0.531   4.964 -10.745
   11   HD21  LEU  81          HD23      LEU  81  -2.142   5.298 -10.112

  No H/Q in entry =          11
  In of MODEL   16
    1    H    MET  82           H        MET  82  -0.716   1.672  -6.353
    2    HA   MET  82           HA       MET  82  -1.792   3.257  -4.277
    3    HB2  MET  82           HB2      MET  82  -0.389   0.585  -4.299
    4    HB3  MET  82           HB3      MET  82  -0.981   1.310  -2.806
    5    HG2  MET  82           HG2      MET  82  -2.700   0.787  -5.251
    6    HG3  MET  82           HG3      MET  82  -2.615  -0.280  -3.851
    7    HE3  MET  82           HE1      MET  82  -4.365   1.364  -1.049
    8    HE2  MET  82           HE2      MET  82  -2.637   1.660  -1.229
    9    HE1  MET  82           HE3      MET  82  -3.306   0.093  -1.678

  No H/Q in entry =           9
  In of MODEL   16
    1    H    THR  83           H        THR  83   1.523   2.204  -4.950
    2    HA   THR  83           HA       THR  83   2.720   3.332  -2.651
    3    HB   THR  83           HB       THR  83   4.821   3.293  -4.117
    4    HG1  THR  83           HG1      THR  83   4.594   2.755  -6.139
    5   HG22  THR  83          HG21      THR  83   4.407   0.629  -4.438
    6   HG21  THR  83          HG22      THR  83   3.110   0.999  -3.304
    7   HG23  THR  83          HG23      THR  83   4.784   1.363  -2.881

  No H/Q in entry =           7
  In of MODEL   16
    1    H    SER  84           H        SER  84   2.347   4.592  -5.958
    2    HA   SER  84           HA       SER  84   3.658   7.049  -5.510
    3    HB2  SER  84           HB2      SER  84   1.604   6.185  -7.532
    4    HB3  SER  84           HB3      SER  84   2.264   7.820  -7.512
    5    HG   SER  84           HG       SER  84   3.665   5.359  -7.787

  No H/Q in entry =           5
  In of MODEL   16
    1    H    MET  85           H        MET  85   0.172   6.255  -5.346
    2    HA   MET  85           HA       MET  85  -0.720   8.859  -4.760
    3    HB2  MET  85           HB2      MET  85  -2.223   7.036  -5.426
    4    HB3  MET  85           HB3      MET  85  -1.926   6.231  -3.885
    5    HG2  MET  85           HG2      MET  85  -2.844   8.173  -2.680
    6    HG3  MET  85           HG3      MET  85  -3.110   9.005  -4.210
    7    HE2  MET  85           HE1      MET  85  -5.106   6.571  -1.637
    8    HE1  MET  85           HE2      MET  85  -3.531   6.000  -2.180
    9    HE3  MET  85           HE3      MET  85  -4.989   5.166  -2.704

  No H/Q in entry =           9
  In of MODEL   16
    1    H    LEU  86           H        LEU  86   0.221   6.216  -2.601
    2    HA   LEU  86           HA       LEU  86  -0.335   7.524  -0.167
    3    HB2  LEU  86           HB2      LEU  86   0.157   5.056  -0.548
    4    HB3  LEU  86           HB3      LEU  86   1.859   5.503  -0.639
    5    HG   LEU  86           HG       LEU  86   1.515   6.671   1.623
    6   HD11  LEU  86          HD11      LEU  86  -1.170   5.875   1.146
    7   HD13  LEU  86          HD12      LEU  86  -0.516   6.635   2.595
    8   HD12  LEU  86          HD13      LEU  86  -0.589   4.878   2.483
    9   HD23  LEU  86          HD21      LEU  86   1.116   3.675   1.757
   10   HD22  LEU  86          HD22      LEU  86   2.105   4.699   2.796
   11   HD21  LEU  86          HD23      LEU  86   2.615   4.372   1.140

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ALA  87           H        ALA  87   2.655   7.251  -2.045
    2    HA   ALA  87           HA       ALA  87   4.341   8.686  -0.321
    3    HB3  ALA  87           HB1      ALA  87   4.455   7.662  -3.023
    4    HB2  ALA  87           HB2      ALA  87   5.783   8.010  -1.919
    5    HB1  ALA  87           HB3      ALA  87   5.160   9.280  -2.971

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ARG  88           H        ARG  88   2.392   9.791  -3.052
    2    HA   ARG  88           HA       ARG  88   3.141  12.488  -2.944
    3    HB2  ARG  88           HB2      ARG  88   1.904  11.316  -4.801
    4    HB3  ARG  88           HB3      ARG  88   0.442  11.450  -3.823
    5    HG2  ARG  88           HG2      ARG  88   1.437  14.040  -3.748
    6    HG3  ARG  88           HG3      ARG  88   1.872  13.523  -5.374
    7    HD2  ARG  88           HD2      ARG  88  -0.268  13.581  -6.079
    8    HD3  ARG  88           HD3      ARG  88  -0.852  12.728  -4.649
    9    HE   ARG  88           HE       ARG  88  -1.065  15.503  -5.080
   10   HH21  ARG  88          HH11      ARG  88  -1.610  16.835  -3.349
   11   HH22  ARG  88          HH12      ARG  88  -1.314  16.307  -1.728
   12   HH11  ARG  88          HH21      ARG  88  -0.037  13.259  -2.693
   13   HH12  ARG  88          HH22      ARG  88  -0.441  14.276  -1.357

  No H/Q in entry =          13
  In of MODEL   16
    1    H    GLU  89           H        GLU  89   0.447  10.797  -1.306
    2    HA   GLU  89           HA       GLU  89  -0.684  13.104  -0.114
    3    HB2  GLU  89           HB2      GLU  89  -1.782  10.855  -0.195
    4    HB3  GLU  89           HB3      GLU  89  -0.657  10.315   1.052
    5    HG2  GLU  89           HG2      GLU  89  -1.497  12.013   2.601
    6    HG3  GLU  89           HG3      GLU  89  -2.551  12.669   1.352

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LEU  90           H        LEU  90   1.783  10.838   1.077
    2    HA   LEU  90           HA       LEU  90   2.121  12.095   3.603
    3    HB2  LEU  90           HB2      LEU  90   3.914  10.329   1.938
    4    HB3  LEU  90           HB3      LEU  90   4.323  10.856   3.576
    5    HG   LEU  90           HG       LEU  90   1.702   9.486   2.912
    6   HD12  LEU  90          HD11      LEU  90   2.856   7.454   3.932
    7   HD11  LEU  90          HD12      LEU  90   4.372   8.321   3.692
    8   HD13  LEU  90          HD13      LEU  90   3.367   7.900   2.303
    9   HD22  LEU  90          HD21      LEU  90   1.423  10.416   5.029
   10   HD21  LEU  90          HD22      LEU  90   3.141  10.324   5.417
   11   HD23  LEU  90          HD23      LEU  90   2.146   8.869   5.468

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  91           H        ILE  91   3.731  12.478   0.479
    2    HA   ILE  91           HA       ILE  91   5.690  14.328   1.317
    3    HB   ILE  91           HB       ILE  91   4.391  13.817  -1.365
    4   HG12  ILE  91          HG12      ILE  91   7.224  13.355  -0.380
    5   HG13  ILE  91          HG13      ILE  91   5.951  12.148  -0.217
    6   HG22  ILE  91          HG21      ILE  91   6.605  15.178  -2.052
    7   HG21  ILE  91          HG22      ILE  91   6.285  15.982  -0.515
    8   HG23  ILE  91          HG23      ILE  91   5.065  15.996  -1.788
    9   HD13  ILE  91          HD11      ILE  91   5.787  11.814  -2.523
   10   HD12  ILE  91          HD12      ILE  91   7.519  12.071  -2.305
   11   HD11  ILE  91          HD13      ILE  91   6.501  13.384  -2.900

  No H/Q in entry =          11
  In of MODEL   16
    1    H    THR  92           H        THR  92   2.328  14.731   0.297
    2    HA   THR  92           HA       THR  92   2.281  17.554   0.225
    3    HB   THR  92           HB       THR  92   0.127  15.546   0.926
    4    HG1  THR  92           HG1      THR  92   0.439  15.361  -1.157
    5   HG22  THR  92          HG21      THR  92  -1.288  17.694   0.191
    6   HG21  THR  92          HG22      THR  92   0.096  18.533   0.889
    7   HG23  THR  92          HG23      THR  92  -0.840  17.408   1.872

  No H/Q in entry =           7
  In of MODEL   16
    1    H    GLU  93           H        GLU  93   1.742  15.260   2.887
    2    HA   GLU  93           HA       GLU  93   1.190  17.168   4.896
    3    HB2  GLU  93           HB2      GLU  93   2.522  14.454   5.147
    4    HB3  GLU  93           HB3      GLU  93   1.821  15.381   6.474
    5    HG2  GLU  93           HG2      GLU  93   0.222  14.582   4.034
    6    HG3  GLU  93           HG3      GLU  93   0.326  13.566   5.466

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LEU  94           H        LEU  94   4.211  15.704   3.761
    2    HA   LEU  94           HA       LEU  94   5.947  16.871   5.650
    3    HB2  LEU  94           HB2      LEU  94   6.364  15.896   2.824
    4    HB3  LEU  94           HB3      LEU  94   7.686  16.567   3.775
    5    HG   LEU  94           HG       LEU  94   5.959  14.363   4.913
    6   HD11  LEU  94          HD11      LEU  94   8.063  14.143   2.789
    7   HD13  LEU  94          HD12      LEU  94   6.623  13.160   3.050
    8   HD12  LEU  94          HD13      LEU  94   8.047  12.922   4.063
    9   HD23  LEU  94          HD21      LEU  94   8.149  13.847   6.074
   10   HD22  LEU  94          HD22      LEU  94   7.470  15.422   6.483
   11   HD21  LEU  94          HD23      LEU  94   8.813  15.306   5.345

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  95           H        ILE  95   4.809  18.022   2.492
    2    HA   ILE  95           HA       ILE  95   6.364  20.390   2.428
    3    HB   ILE  95           HB       ILE  95   3.729  19.682   1.117
    4   HG12  ILE  95          HG12      ILE  95   6.519  20.035  -0.013
    5   HG13  ILE  95          HG13      ILE  95   5.879  18.479   0.506
    6   HG21  ILE  95          HG21      ILE  95   5.461  22.161   0.892
    7   HG23  ILE  95          HG22      ILE  95   3.736  22.082   1.243
    8   HG22  ILE  95          HG23      ILE  95   4.327  21.680  -0.369
    9   HD13  ILE  95          HD11      ILE  95   4.325  18.385  -1.227
   10   HD12  ILE  95          HD12      ILE  95   5.671  19.210  -2.015
   11   HD11  ILE  95          HD13      ILE  95   4.290  20.137  -1.430

  No H/Q in entry =          11
  In of MODEL   16
    1    H    GLU  96           H        GLU  96   3.116  19.720   3.716
    2    HA   GLU  96           HA       GLU  96   2.475  22.366   4.454
    3    HB2  GLU  96           HB2      GLU  96   0.813  20.571   4.468
    4    HB3  GLU  96           HB3      GLU  96   1.677  19.755   5.769
    5    HG2  GLU  96           HG2      GLU  96   0.642  21.037   7.331
    6    HG3  GLU  96           HG3      GLU  96   1.170  22.511   6.529

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LEU  97           H        LEU  97   4.331  19.835   6.095
    2    HA   LEU  97           HA       LEU  97   4.671  21.195   8.562
    3    HB2  LEU  97           HB2      LEU  97   6.228  19.031   7.161
    4    HB3  LEU  97           HB3      LEU  97   6.808  19.727   8.672
    5    HG   LEU  97           HG       LEU  97   4.007  18.612   8.357
    6   HD12  LEU  97          HD11      LEU  97   4.957  16.611   9.581
    7   HD11  LEU  97          HD12      LEU  97   6.565  17.252   9.239
    8   HD13  LEU  97          HD13      LEU  97   5.502  16.781   7.912
    9   HD23  LEU  97          HD21      LEU  97   4.454  18.331  10.924
   10   HD22  LEU  97          HD22      LEU  97   4.065  19.938  10.312
   11   HD21  LEU  97          HD23      LEU  97   5.738  19.511  10.664

  No H/Q in entry =          11
  In of MODEL   16
    1    H    HIS  98           H        HIS  98   6.551  21.212   5.542
    2    HA   HIS  98           HA       HIS  98   8.691  22.809   6.441
    3    HB2  HIS  98           HB2      HIS  98   7.408  22.535   3.712
    4    HB3  HIS  98           HB3      HIS  98   8.841  23.524   4.003
    5    HD1  HIS  98           HD1      HIS  98   7.653  19.946   4.034
    6    HD2  HIS  98           HD2      HIS  98  11.219  22.067   4.461
    7    HE1  HIS  98           HE1      HIS  98   9.519  18.228   3.989
    8    HE2  HIS  98           HE2      HIS  98  11.695  19.500   4.250

  No H/Q in entry =           8
  In of MODEL   16
    1    H    GLU  99           H        GLU  99   5.468  23.619   5.253
    2    HA   GLU  99           HA       GLU  99   5.829  26.436   5.185
    3    HB2  GLU  99           HB2      GLU  99   3.961  25.250   4.053
    4    HB3  GLU  99           HB3      GLU  99   3.263  24.890   5.631
    5    HG2  GLU  99           HG2      GLU  99   3.066  27.283   6.122
    6    HG3  GLU  99           HG3      GLU  99   3.844  27.682   4.594

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LYS 100           H        LYS 100   4.705  24.203   7.712
    2    HA   LYS 100           HA       LYS 100   4.100  26.261   9.596
    3    HB2  LYS 100           HB2      LYS 100   4.693  23.315   9.955
    4    HB3  LYS 100           HB3      LYS 100   4.235  24.390  11.282
    5    HG2  LYS 100           HG2      LYS 100   2.169  25.009  10.025
    6    HG3  LYS 100           HG3      LYS 100   2.607  23.838   8.778
    7    HD2  LYS 100           HD2      LYS 100   2.535  22.024  10.447
    8    HD3  LYS 100           HD3      LYS 100   2.114  23.189  11.704
    9    HE2  LYS 100           HE2      LYS 100   0.061  23.792  10.433
   10    HE3  LYS 100           HE3      LYS 100   0.473  22.570   9.223
   11    HZ1  LYS 100           HZ1      LYS 100   0.202  21.913  12.105
   12    HZ3  LYS 100           HZ2      LYS 100   0.197  20.854  10.775
   13    HZ2  LYS 100           HZ3      LYS 100  -1.125  21.886  11.047

  No H/Q in entry =          13
  In of MODEL   16
    1    H    LEU 101           H        LEU 101   7.037  24.480   8.778
    2    HA   LEU 101           HA       LEU 101   8.624  25.339  10.983
    3    HB2  LEU 101           HB2      LEU 101   9.233  24.344   8.211
    4    HB3  LEU 101           HB3      LEU 101  10.528  25.022   9.194
    5    HG   LEU 101           HG       LEU 101   8.706  22.859  10.260
    6   HD12  LEU 101          HD11      LEU 101  10.770  21.373   9.664
    7   HD11  LEU 101          HD12      LEU 101  11.133  22.634   8.488
    8   HD13  LEU 101          HD13      LEU 101   9.610  21.752   8.393
    9   HD21  LEU 101          HD21      LEU 101  11.421  23.986  10.992
   10   HD23  LEU 101          HD22      LEU 101  10.885  22.412  11.576
   11   HD22  LEU 101          HD23      LEU 101   9.983  23.865  12.006

  No H/Q in entry =          11
  In of MODEL   16
    1    H    LYS 102           H        LYS 102   7.036  27.184   8.830
    2    HA   LYS 102           HA       LYS 102   7.101  29.476   8.530
    3    HB2  LYS 102           HB2      LYS 102   8.660  29.379  10.633
    4    HB3  LYS 102           HB3      LYS 102   9.962  29.576   9.477
    5    HG2  LYS 102           HG2      LYS 102   7.842  31.520  10.325
    6    HG3  LYS 102           HG3      LYS 102   9.554  31.789  10.078
    7    HD2  LYS 102           HD2      LYS 102   7.612  31.346   7.773
    8    HD3  LYS 102           HD3      LYS 102   7.984  32.930   8.437
    9    HE2  LYS 102           HE2      LYS 102   9.370  31.745   6.372
   10    HE3  LYS 102           HE3      LYS 102   9.976  33.059   7.380
   11    HZ2  LYS 102           HZ1      LYS 102  11.508  31.163   7.217
   12    HZ1  LYS 102           HZ2      LYS 102  10.349  30.177   7.960
   13    HZ3  LYS 102           HZ3      LYS 102  11.032  31.471   8.816

  No H/Q in entry =          13
  In of MODEL   16
    1    H    ALA 103           H        ALA 103  10.367  28.154   7.980
    2    HA   ALA 103           HA       ALA 103  11.330  29.528   5.902
    3    HB2  ALA 103           HB1      ALA 103  12.230  27.315   4.986
    4    HB1  ALA 103           HB2      ALA 103  11.336  26.541   6.292
    5    HB3  ALA 103           HB3      ALA 103  12.617  27.694   6.665

  No H/Q in entry =           5
  In of MODEL   16
    1    H1   LYS   3           H1       LYS   3 -31.147   6.586 -19.483
    2    H2   LYS   3           H3       LYS   3 -30.161   6.320 -20.840
    3    H3   LYS   3           H2       LYS   3 -31.562   5.389 -20.614
    4    HA   LYS   3           HA       LYS   3 -30.570   3.960 -19.243
    5    HB2  LYS   3           HB2      LYS   3 -28.278   5.387 -20.544
    6    HB3  LYS   3           HB3      LYS   3 -27.962   4.148 -19.329
    7    HG2  LYS   3           HG2      LYS   3 -29.396   2.603 -20.715
    8    HG3  LYS   3           HG3      LYS   3 -29.342   3.833 -21.978
    9    HD2  LYS   3           HD2      LYS   3 -26.860   3.701 -21.930
   10    HD3  LYS   3           HD3      LYS   3 -26.989   2.375 -20.774
   11    HE2  LYS   3           HE2      LYS   3 -28.496   1.252 -22.517
   12    HE3  LYS   3           HE3      LYS   3 -27.868   2.451 -23.645
   13    HZ3  LYS   3           HZ1      LYS   3 -26.078   1.216 -23.943
   14    HZ2  LYS   3           HZ2      LYS   3 -26.716   0.029 -22.911
   15    HZ1  LYS   3           HZ3      LYS   3 -25.718   1.251 -22.284

  No H/Q in entry =          15
  In of MODEL   16
    1    H    LYS   4           H        LYS   4 -30.624   3.772 -17.186
    2    HA   LYS   4           HA       LYS   4 -29.875   6.014 -15.483
    3    HB2  LYS   4           HB2      LYS   4 -31.099   3.315 -14.846
    4    HB3  LYS   4           HB3      LYS   4 -30.866   4.625 -13.689
    5    HG2  LYS   4           HG2      LYS   4 -32.675   4.634 -16.111
    6    HG3  LYS   4           HG3      LYS   4 -33.165   4.649 -14.418
    7    HD2  LYS   4           HD2      LYS   4 -32.450   6.858 -14.100
    8    HD3  LYS   4           HD3      LYS   4 -31.411   6.825 -15.525
    9    HE2  LYS   4           HE2      LYS   4 -33.326   8.225 -15.955
   10    HE3  LYS   4           HE3      LYS   4 -33.418   6.776 -16.956
   11    HZ3  LYS   4           HZ1      LYS   4 -35.001   5.842 -15.431
   12    HZ2  LYS   4           HZ2      LYS   4 -35.543   7.355 -15.980
   13    HZ1  LYS   4           HZ3      LYS   4 -34.888   7.202 -14.421

  No H/Q in entry =          13
  In of MODEL   16
    1    H    HIS   5           H        HIS   5 -28.406   6.048 -13.891
    2    HA   HIS   5           HA       HIS   5 -26.141   4.207 -14.265
    3    HB2  HIS   5           HB2      HIS   5 -26.369   6.936 -12.996
    4    HB3  HIS   5           HB3      HIS   5 -24.897   5.968 -13.001
    5    HD1  HIS   5           HD1      HIS   5 -23.416   7.190 -14.563
    6    HD2  HIS   5           HD2      HIS   5 -27.223   6.641 -16.130
    7    HE1  HIS   5           HE1      HIS   5 -23.243   7.824 -16.999
    8    HE2  HIS   5           HE2      HIS   5 -25.564   7.477 -17.923

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ILE   6           H        ILE   6 -25.927   2.602 -12.986
    2    HA   ILE   6           HA       ILE   6 -26.899   2.816 -10.216
    3    HB   ILE   6           HB       ILE   6 -26.099   0.377 -11.809
    4   HG12  ILE   6          HG12      ILE   6 -28.833   1.321 -10.936
    5   HG13  ILE   6          HG13      ILE   6 -28.189   1.514 -12.566
    6   HG23  ILE   6          HG21      ILE   6 -26.484  -0.914  -9.979
    7   HG22  ILE   6          HG22      ILE   6 -27.630   0.228  -9.273
    8   HG21  ILE   6          HG23      ILE   6 -25.897   0.544  -9.176
    9   HD13  ILE   6          HD11      ILE   6 -28.669  -0.587 -13.116
   10   HD12  ILE   6          HD12      ILE   6 -29.684  -0.594 -11.673
   11   HD11  ILE   6          HD13      ILE   6 -28.038  -1.220 -11.595

  No H/Q in entry =          11
  In of MODEL   16
    1    H    TYR   7           H        TYR   7 -25.133   3.408  -8.915
    2    HA   TYR   7           HA       TYR   7 -22.432   2.439  -9.618
    3    HB2  TYR   7           HB2      TYR   7 -23.370   4.849  -8.080
    4    HB3  TYR   7           HB3      TYR   7 -21.691   4.317  -8.132
    5    HD1  TYR   7           HD1      TYR   7 -22.741   3.458 -11.242
    6    HD2  TYR   7           HD2      TYR   7 -22.032   6.969  -8.934
    7    HE1  TYR   7           HE1      TYR   7 -22.296   4.730 -13.304
    8    HE2  TYR   7           HE2      TYR   7 -21.631   8.248 -10.988
    9    HH   TYR   7           HH       TYR   7 -21.850   8.216 -13.222

  No H/Q in entry =           9
  In of MODEL   16
    1    H    LEU   8           H        LEU   8 -21.481   1.047  -8.320
    2    HA   LEU   8           HA       LEU   8 -22.616   0.503  -5.649
    3    HB2  LEU   8           HB2      LEU   8 -20.931  -1.136  -7.521
    4    HB3  LEU   8           HB3      LEU   8 -21.121  -1.555  -5.819
    5    HG   LEU   8           HG       LEU   8 -23.602  -1.692  -6.244
    6   HD13  LEU   8          HD11      LEU   8 -23.720  -0.425  -8.325
    7   HD12  LEU   8          HD12      LEU   8 -24.268  -2.078  -8.603
    8   HD11  LEU   8          HD13      LEU   8 -22.655  -1.586  -9.117
    9   HD23  LEU   8          HD21      LEU   8 -22.350  -3.706  -7.985
   10   HD22  LEU   8          HD22      LEU   8 -23.439  -3.894  -6.610
   11   HD21  LEU   8          HD23      LEU   8 -21.729  -3.565  -6.341

  No H/Q in entry =          11
  In of MODEL   16
    1    H    PHE   9           H        PHE   9 -21.348   0.860  -3.860
    2    HA   PHE   9           HA       PHE   9 -18.552   1.773  -4.347
    3    HB2  PHE   9           HB2      PHE   9 -20.561   2.824  -2.360
    4    HB3  PHE   9           HB3      PHE   9 -18.850   3.229  -2.338
    5    HD1  PHE   9           HD1      PHE   9 -17.854   4.607  -4.076
    6    HD2  PHE   9           HD2      PHE   9 -22.035   3.650  -4.145
    7    HE1  PHE   9           HE1      PHE   9 -18.223   6.339  -5.806
    8    HE2  PHE   9           HE2      PHE   9 -22.406   5.394  -5.870
    9    HZ   PHE   9           HZ       PHE   9 -20.497   6.735  -6.708

  No H/Q in entry =           9
  In of MODEL   16
    1    H    SER  10           H        SER  10 -16.990   0.754  -3.283
    2    HA   SER  10           HA       SER  10 -17.201  -0.186  -0.600
    3    HB2  SER  10           HB2      SER  10 -18.432  -2.019  -1.715
    4    HB3  SER  10           HB3      SER  10 -17.058  -2.273  -2.778
    5    HG   SER  10           HG       SER  10 -16.398  -2.196  -0.132

  No H/Q in entry =           5
  In of MODEL   16
    1    H    SER  11           H        SER  11 -15.183  -0.074   0.232
    2    HA   SER  11           HA       SER  11 -13.008   0.808  -1.286
    3    HB2  SER  11           HB2      SER  11 -13.460   0.865   1.283
    4    HB3  SER  11           HB3      SER  11 -12.582  -0.665   1.277
    5    HG   SER  11           HG       SER  11 -11.639   1.842   1.078

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA  12           H        ALA  12 -14.223  -1.902  -2.123
    2    HA   ALA  12           HA       ALA  12 -11.634  -3.097  -2.727
    3    HB3  ALA  12           HB1      ALA  12 -12.158  -4.335  -0.742
    4    HB2  ALA  12           HB2      ALA  12 -12.467  -5.394  -2.116
    5    HB1  ALA  12           HB3      ALA  12 -13.814  -4.616  -1.286

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLY  13           H        GLY  13 -12.390  -2.087  -4.732
    2    HA3  GLY  13           HA2      GLY  13 -14.649  -2.726  -6.197
    3    HA2  GLY  13           HA3      GLY  13 -13.094  -2.299  -6.923

  No H/Q in entry =           3
  In of MODEL   16
    1    H    MET  14           H        MET  14 -11.629  -4.625  -6.021
    2    HA   MET  14           HA       MET  14 -12.054  -6.342  -8.152
    3    HB2  MET  14           HB2      MET  14  -9.996  -6.491  -6.860
    4    HB3  MET  14           HB3      MET  14 -10.868  -7.129  -5.467
    5    HG2  MET  14           HG2      MET  14 -11.510  -9.117  -6.791
    6    HG3  MET  14           HG3      MET  14 -10.651  -8.467  -8.188
    7    HE1  MET  14           HE1      MET  14  -8.437  -8.036  -8.449
    8    HE3  MET  14           HE2      MET  14  -7.059  -8.698  -7.572
    9    HE2  MET  14           HE3      MET  14  -7.857  -7.245  -6.976

  No H/Q in entry =           9
  In of MODEL   16
    1    H    SER  15           H        SER  15 -13.259  -6.938  -4.829
    2    HA   SER  15           HA       SER  15 -14.657  -9.313  -5.654
    3    HB2  SER  15           HB2      SER  15 -14.183  -9.246  -3.324
    4    HB3  SER  15           HB3      SER  15 -14.873  -7.634  -3.156
    5    HG   SER  15           HG       SER  15 -16.682  -9.339  -4.218

  No H/Q in entry =           5
  In of MODEL   16
    1    H    THR  16           H        THR  16 -15.675  -5.932  -5.138
    2    HA   THR  16           HA       THR  16 -18.476  -6.355  -5.672
    3    HB   THR  16           HB       THR  16 -16.859  -3.823  -6.126
    4    HG1  THR  16           HG1      THR  16 -16.741  -4.985  -3.978
    5   HG22  THR  16          HG21      THR  16 -19.024  -2.755  -5.536
    6   HG21  THR  16          HG22      THR  16 -19.768  -4.360  -5.446
    7   HG23  THR  16          HG23      THR  16 -19.142  -3.748  -6.983

  No H/Q in entry =           7
  In of MODEL   16
    1    H    SER  17           H        SER  17 -15.638  -5.786  -7.522
    2    HA   SER  17           HA       SER  17 -16.757  -4.978 -10.007
    3    HB2  SER  17           HB2      SER  17 -14.144  -6.354  -9.347
    4    HB3  SER  17           HB3      SER  17 -14.581  -5.843 -10.977
    5    HG   SER  17           HG       SER  17 -14.724  -4.018  -8.851

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU  18           H        LEU  18 -16.221  -8.160  -8.630
    2    HA   LEU  18           HA       LEU  18 -16.819  -9.600 -11.019
    3    HB2  LEU  18           HB2      LEU  18 -15.611 -10.622  -9.146
    4    HB3  LEU  18           HB3      LEU  18 -17.031 -10.426  -8.118
    5    HG   LEU  18           HG       LEU  18 -18.294 -11.964  -9.517
    6   HD12  LEU  18          HD11      LEU  18 -16.827 -13.248 -11.254
    7   HD11  LEU  18          HD12      LEU  18 -15.822 -11.800 -11.212
    8   HD13  LEU  18          HD13      LEU  18 -17.512 -11.686 -11.699
    9   HD22  LEU  18          HD21      LEU  18 -17.128 -13.988  -8.970
   10   HD21  LEU  18          HD22      LEU  18 -16.938 -12.814  -7.668
   11   HD23  LEU  18          HD23      LEU  18 -15.612 -13.104  -8.794

  No H/Q in entry =          11
  In of MODEL   16
    1    H    LEU  19           H        LEU  19 -18.779  -8.435  -8.282
    2    HA   LEU  19           HA       LEU  19 -21.253  -9.576  -9.144
    3    HB2  LEU  19           HB2      LEU  19 -20.981  -8.798  -6.874
    4    HB3  LEU  19           HB3      LEU  19 -20.675  -7.156  -7.441
    5    HG   LEU  19           HG       LEU  19 -22.994  -6.928  -8.123
    6   HD12  LEU  19          HD11      LEU  19 -24.629  -8.692  -7.536
    7   HD11  LEU  19          HD12      LEU  19 -23.293  -9.751  -7.087
    8   HD13  LEU  19          HD13      LEU  19 -23.477  -9.226  -8.761
    9   HD22  LEU  19          HD21      LEU  19 -22.394  -6.300  -5.876
   10   HD21  LEU  19          HD22      LEU  19 -22.632  -7.955  -5.316
   11   HD23  LEU  19          HD23      LEU  19 -24.009  -7.010  -5.882

  No H/Q in entry =          11
  In of MODEL   16
    1    H    VAL  20           H        VAL  20 -19.726  -6.414  -9.765
    2    HA   VAL  20           HA       VAL  20 -21.826  -5.317 -11.312
    3    HB   VAL  20           HB       VAL  20 -18.832  -4.751 -11.392
    4   HG13  VAL  20          HG11      VAL  20 -19.548  -4.085 -13.547
    5   HG12  VAL  20          HG12      VAL  20 -19.609  -2.609 -12.586
    6   HG11  VAL  20          HG13      VAL  20 -21.093  -3.491 -12.941
    7   HG23  VAL  20          HG21      VAL  20 -19.728  -2.551 -10.408
    8   HG22  VAL  20          HG22      VAL  20 -19.654  -3.972  -9.368
    9   HG21  VAL  20          HG23      VAL  20 -21.192  -3.475 -10.070

  No H/Q in entry =           9
  In of MODEL   16
    1    H    SER  21           H        SER  21 -19.087  -7.370 -12.383
    2    HA   SER  21           HA       SER  21 -19.867  -7.188 -15.132
    3    HB2  SER  21           HB2      SER  21 -18.451  -9.162 -15.509
    4    HB3  SER  21           HB3      SER  21 -17.610  -7.944 -14.551
    5    HG   SER  21           HG       SER  21 -18.300  -9.175 -12.690

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LYS  22           H        LYS  22 -20.956  -9.422 -12.611
    2    HA   LYS  22           HA       LYS  22 -22.510 -10.985 -14.471
    3    HB2  LYS  22           HB2      LYS  22 -21.726 -11.529 -12.002
    4    HB3  LYS  22           HB3      LYS  22 -23.274 -10.790 -11.597
    5    HG2  LYS  22           HG2      LYS  22 -24.440 -12.437 -12.959
    6    HG3  LYS  22           HG3      LYS  22 -22.900 -13.162 -13.419
    7    HD2  LYS  22           HD2      LYS  22 -22.490 -13.622 -10.984
    8    HD3  LYS  22           HD3      LYS  22 -24.145 -13.096 -10.674
    9    HE2  LYS  22           HE2      LYS  22 -25.016 -14.885 -12.072
   10    HE3  LYS  22           HE3      LYS  22 -23.380 -15.373 -12.517
   11    HZ1  LYS  22           HZ1      LYS  22 -23.189 -15.600  -9.914
   12    HZ3  LYS  22           HZ2      LYS  22 -23.781 -16.859 -10.890
   13    HZ2  LYS  22           HZ3      LYS  22 -24.863 -15.853 -10.055

  No H/Q in entry =          13
  In of MODEL   16
    1    H    MET  23           H        MET  23 -23.204  -8.098 -12.536
    2    HA   MET  23           HA       MET  23 -26.012  -8.136 -13.047
    3    HB2  MET  23           HB2      MET  23 -24.140  -5.861 -12.420
    4    HB3  MET  23           HB3      MET  23 -25.884  -5.669 -12.595
    5    HG2  MET  23           HG2      MET  23 -26.292  -7.013 -10.657
    6    HG3  MET  23           HG3      MET  23 -24.586  -7.446 -10.539
    7    HE2  MET  23           HE1      MET  23 -26.845  -3.797  -9.269
    8    HE1  MET  23           HE2      MET  23 -27.108  -4.729 -10.741
    9    HE3  MET  23           HE3      MET  23 -26.058  -3.313 -10.771

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ARG  24           H        ARG  24 -23.241  -6.697 -14.795
    2    HA   ARG  24           HA       ARG  24 -24.721  -5.334 -16.765
    3    HB2  ARG  24           HB2      ARG  24 -22.270  -4.982 -16.364
    4    HB3  ARG  24           HB3      ARG  24 -21.959  -6.559 -17.045
    5    HG2  ARG  24           HG2      ARG  24 -22.782  -5.821 -19.262
    6    HG3  ARG  24           HG3      ARG  24 -23.179  -4.226 -18.569
    7    HD2  ARG  24           HD2      ARG  24 -20.408  -5.512 -18.586
    8    HD3  ARG  24           HD3      ARG  24 -20.954  -4.253 -19.686
    9    HE   ARG  24           HE       ARG  24 -21.335  -3.024 -17.387
   10   HH21  ARG  24          HH11      ARG  24 -19.960  -1.246 -17.425
   11   HH22  ARG  24          HH12      ARG  24 -18.254  -1.486 -17.586
   12   HH11  ARG  24          HH21      ARG  24 -18.694  -4.919 -18.329
   13   HH12  ARG  24          HH22      ARG  24 -17.515  -3.664 -18.110

  No H/Q in entry =          13
  In of MODEL   16
    1    H    ALA  25           H        ALA  25 -23.640  -8.691 -16.566
    2    HA   ALA  25           HA       ALA  25 -24.275  -9.452 -19.222
    3    HB1  ALA  25           HB1      ALA  25 -23.604 -11.508 -18.574
    4    HB3  ALA  25           HB2      ALA  25 -24.663 -11.508 -17.164
    5    HB2  ALA  25           HB3      ALA  25 -23.098 -10.701 -17.090

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLN  26           H        GLN  26 -26.105  -9.540 -16.203
    2    HA   GLN  26           HA       GLN  26 -28.462 -10.689 -17.249
    3    HB2  GLN  26           HB2      GLN  26 -27.931  -9.005 -14.821
    4    HB3  GLN  26           HB3      GLN  26 -29.502  -9.700 -15.190
    5    HG2  GLN  26           HG2      GLN  26 -26.936 -11.200 -14.753
    6    HG3  GLN  26           HG3      GLN  26 -28.296 -11.106 -13.642
    7   HE21  GLN  26          HE21      GLN  26 -27.104 -13.255 -14.969
    8   HE22  GLN  26          HE22      GLN  26 -28.158 -14.270 -15.791

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ALA  27           H        ALA  27 -27.486  -7.314 -16.776
    2    HA   ALA  27           HA       ALA  27 -29.961  -6.171 -17.536
    3    HB1  ALA  27           HB1      ALA  27 -28.136  -4.906 -16.388
    4    HB3  ALA  27           HB2      ALA  27 -28.714  -4.098 -17.846
    5    HB2  ALA  27           HB3      ALA  27 -27.191  -4.983 -17.875

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLU  28           H        GLU  28 -27.273  -7.383 -19.432
    2    HA   GLU  28           HA       GLU  28 -28.191  -6.270 -21.926
    3    HB2  GLU  28           HB2      GLU  28 -25.822  -6.999 -21.316
    4    HB3  GLU  28           HB3      GLU  28 -26.388  -8.650 -21.558
    5    HG2  GLU  28           HG2      GLU  28 -25.229  -7.841 -23.506
    6    HG3  GLU  28           HG3      GLU  28 -26.930  -8.134 -23.865

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LYS  29           H        LYS  29 -28.399  -9.414 -20.345
    2    HA   LYS  29           HA       LYS  29 -29.719 -10.818 -22.386
    3    HB2  LYS  29           HB2      LYS  29 -28.684 -11.863 -20.406
    4    HB3  LYS  29           HB3      LYS  29 -29.948 -11.165 -19.396
    5    HG2  LYS  29           HG2      LYS  29 -31.625 -12.489 -20.498
    6    HG3  LYS  29           HG3      LYS  29 -30.433 -13.112 -21.636
    7    HD2  LYS  29           HD2      LYS  29 -29.307 -14.335 -19.931
    8    HD3  LYS  29           HD3      LYS  29 -30.205 -13.513 -18.657
    9    HE2  LYS  29           HE2      LYS  29 -30.986 -15.843 -19.077
   10    HE3  LYS  29           HE3      LYS  29 -32.248 -14.629 -19.293
   11    HZ1  LYS  29           HZ1      LYS  29 -31.683 -14.711 -21.722
   12    HZ3  LYS  29           HZ2      LYS  29 -32.421 -16.104 -21.092
   13    HZ2  LYS  29           HZ3      LYS  29 -30.750 -16.089 -21.387

  No H/Q in entry =          13
  In of MODEL   16
    1    H    TYR  30           H        TYR  30 -31.086  -8.757 -19.833
    2    HA   TYR  30           HA       TYR  30 -33.753  -9.141 -21.088
    3    HB2  TYR  30           HB2      TYR  30 -33.089  -8.064 -18.339
    4    HB3  TYR  30           HB3      TYR  30 -34.709  -8.285 -18.999
    5    HD1  TYR  30           HD1      TYR  30 -35.648 -10.558 -19.271
    6    HD2  TYR  30           HD2      TYR  30 -31.807  -9.928 -17.545
    7    HE1  TYR  30           HE1      TYR  30 -35.589 -12.906 -18.531
    8    HE2  TYR  30           HE2      TYR  30 -31.748 -12.261 -16.809
    9    HH   TYR  30           HH       TYR  30 -33.416 -14.574 -17.962

  No H/Q in entry =           9
  In of MODEL   16
    1    H    GLU  31           H        GLU  31 -31.562  -7.158 -21.836
    2    HA   GLU  31           HA       GLU  31 -31.459  -4.982 -22.606
    3    HB2  GLU  31           HB2      GLU  31 -34.363  -5.649 -23.139
    4    HB3  GLU  31           HB3      GLU  31 -33.505  -4.274 -23.834
    5    HG2  GLU  31           HG2      GLU  31 -32.048  -5.701 -25.059
    6    HG3  GLU  31           HG3      GLU  31 -32.631  -7.129 -24.206

  No H/Q in entry =           6
  In of MODEL   16
    1    H    VAL  32           H        VAL  32 -31.661  -4.946 -19.872
    2    HA   VAL  32           HA       VAL  32 -33.499  -2.828 -19.163
    3    HB   VAL  32           HB       VAL  32 -31.121  -3.889 -17.604
    4   HG12  VAL  32          HG11      VAL  32 -32.649  -3.094 -15.691
    5   HG11  VAL  32          HG12      VAL  32 -33.470  -2.149 -16.933
    6   HG13  VAL  32          HG13      VAL  32 -31.760  -1.873 -16.603
    7   HG21  VAL  32          HG21      VAL  32 -32.908  -5.570 -18.337
    8   HG23  VAL  32          HG22      VAL  32 -33.940  -4.760 -17.157
    9   HG22  VAL  32          HG23      VAL  32 -32.432  -5.514 -16.640

  No H/Q in entry =           9
  In of MODEL   16
    1    HA   PRO  33           HA       PRO  33 -30.431   0.105 -20.760
    2    HB2  PRO  33           HB2      PRO  33 -31.917   2.342 -20.582
    3    HB3  PRO  33           HB3      PRO  33 -32.399   1.072 -21.709
    4    HG2  PRO  33           HG2      PRO  33 -33.365   1.529 -18.886
    5    HG3  PRO  33           HG3      PRO  33 -34.330   1.368 -20.353
    6    HD2  PRO  33           HD2      PRO  33 -33.899  -0.750 -18.738
    7    HD3  PRO  33           HD3      PRO  33 -33.962  -0.947 -20.490

  No H/Q in entry =           7
  In of MODEL   16
    1    H    VAL  34           H        VAL  34 -29.176  -0.501 -18.824
    2    HA   VAL  34           HA       VAL  34 -28.867   1.879 -17.116
    3    HB   VAL  34           HB       VAL  34 -28.305   0.363 -15.214
    4   HG12  VAL  34          HG11      VAL  34 -30.727  -0.491 -14.931
    5   HG11  VAL  34          HG12      VAL  34 -31.033   0.312 -16.470
    6   HG13  VAL  34          HG13      VAL  34 -30.471   1.247 -15.085
    7   HG21  VAL  34          HG21      VAL  34 -28.510  -1.610 -17.273
    8   HG23  VAL  34          HG22      VAL  34 -29.573  -1.994 -15.917
    9   HG22  VAL  34          HG23      VAL  34 -27.851  -1.732 -15.642

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ILE  35           H        ILE  35 -26.888   2.272 -16.264
    2    HA   ILE  35           HA       ILE  35 -24.596   0.950 -17.557
    3    HB   ILE  35           HB       ILE  35 -24.966   3.823 -16.674
    4   HG12  ILE  35          HG12      ILE  35 -23.995   2.570 -19.250
    5   HG13  ILE  35          HG13      ILE  35 -25.619   3.201 -18.976
    6   HG21  ILE  35          HG21      ILE  35 -22.420   2.271 -17.019
    7   HG23  ILE  35          HG22      ILE  35 -22.864   3.424 -15.761
    8   HG22  ILE  35          HG23      ILE  35 -22.474   3.996 -17.383
    9   HD11  ILE  35          HD11      ILE  35 -24.195   5.364 -18.318
   10   HD13  ILE  35          HD12      ILE  35 -24.734   5.028 -19.965
   11   HD12  ILE  35          HD13      ILE  35 -23.087   4.629 -19.477

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ILE  36           H        ILE  36 -23.378  -0.126 -15.982
    2    HA   ILE  36           HA       ILE  36 -23.815   0.421 -13.098
    3    HB   ILE  36           HB       ILE  36 -23.015  -2.261 -14.273
    4   HG12  ILE  36          HG12      ILE  36 -25.815  -1.446 -13.491
    5   HG13  ILE  36          HG13      ILE  36 -25.240  -1.390 -15.158
    6   HG23  ILE  36          HG21      ILE  36 -23.377  -3.140 -12.181
    7   HG22  ILE  36          HG22      ILE  36 -24.492  -1.856 -11.711
    8   HG21  ILE  36          HG23      ILE  36 -22.757  -1.540 -11.771
    9   HD13  ILE  36          HD11      ILE  36 -25.428  -3.595 -15.421
   10   HD12  ILE  36          HD12      ILE  36 -26.495  -3.498 -14.019
   11   HD11  ILE  36          HD13      ILE  36 -24.801  -3.941 -13.809

  No H/Q in entry =          11
  In of MODEL   16
    1    H    GLU  37           H        GLU  37 -22.029   1.004 -11.976
    2    HA   GLU  37           HA       GLU  37 -19.346   0.204 -12.910
    3    HB2  GLU  37           HB2      GLU  37 -20.214   2.985 -12.137
    4    HB3  GLU  37           HB3      GLU  37 -18.532   2.477 -12.287
    5    HG2  GLU  37           HG2      GLU  37 -18.826   2.097 -14.651
    6    HG3  GLU  37           HG3      GLU  37 -20.535   2.514 -14.525

  No H/Q in entry =           6
  In of MODEL   16
    1    H    ALA  38           H        ALA  38 -17.863  -0.091 -11.233
    2    HA   ALA  38           HA       ALA  38 -18.895   0.029  -8.459
    3    HB1  ALA  38           HB1      ALA  38 -17.199  -1.891  -9.932
    4    HB3  ALA  38           HB2      ALA  38 -18.253  -2.152  -8.541
    5    HB2  ALA  38           HB3      ALA  38 -16.634  -1.490  -8.310

  No H/Q in entry =           5
  In of MODEL   16
    1    H    PHE  39           H        PHE  39 -17.646   1.189  -6.955
    2    HA   PHE  39           HA       PHE  39 -15.109   2.390  -7.818
    3    HB2  PHE  39           HB2      PHE  39 -17.504   3.876  -6.757
    4    HB3  PHE  39           HB3      PHE  39 -15.868   4.527  -6.672
    5    HD1  PHE  39           HD1      PHE  39 -14.572   4.586  -8.933
    6    HD2  PHE  39           HD2      PHE  39 -18.816   4.370  -8.568
    7    HE1  PHE  39           HE1      PHE  39 -14.804   5.510 -11.220
    8    HE2  PHE  39           HE2      PHE  39 -19.063   5.284 -10.848
    9    HZ   PHE  39           HZ       PHE  39 -17.063   5.828 -12.194

  No H/Q in entry =           9
  In of MODEL   16
    1    HA   PRO  40           HA       PRO  40 -14.182   1.521  -3.552
    2    HB2  PRO  40           HB2      PRO  40 -12.398   3.504  -2.894
    3    HB3  PRO  40           HB3      PRO  40 -11.965   2.196  -3.994
    4    HG2  PRO  40           HG2      PRO  40 -12.965   4.958  -4.672
    5    HG3  PRO  40           HG3      PRO  40 -11.545   4.120  -5.299
    6    HD2  PRO  40           HD2      PRO  40 -13.767   4.085  -6.712
    7    HD3  PRO  40           HD3      PRO  40 -12.824   2.604  -6.554

  No H/Q in entry =           7
  In of MODEL   16
    1    H    GLU  41           H        GLU  41 -14.797   2.450  -1.399
    2    HA   GLU  41           HA       GLU  41 -17.028   4.169  -1.341
    3    HB2  GLU  41           HB2      GLU  41 -16.702   4.172   1.105
    4    HB3  GLU  41           HB3      GLU  41 -16.634   2.548   0.418
    5    HG2  GLU  41           HG2      GLU  41 -14.912   2.499   1.945
    6    HG3  GLU  41           HG3      GLU  41 -14.070   2.900   0.449

  No H/Q in entry =           6
  In of MODEL   16
    1    H    THR  42           H        THR  42 -13.690   5.062  -1.367
    2    HA   THR  42           HA       THR  42 -14.025   7.594  -0.091
    3    HB   THR  42           HB       THR  42 -11.862   8.178  -1.164
    4    HG1  THR  42           HG1      THR  42 -10.901   6.542  -2.474
    5   HG23  THR  42          HG21      THR  42 -10.524   6.422  -0.105
    6   HG22  THR  42          HG22      THR  42 -11.934   5.362  -0.052
    7   HG21  THR  42          HG23      THR  42 -11.901   6.834   0.917

  No H/Q in entry =           7
  In of MODEL   16
    1    H    LEU  43           H        LEU  43 -14.934   6.585  -3.219
    2    HA   LEU  43           HA       LEU  43 -15.165   9.382  -4.120
    3    HB2  LEU  43           HB2      LEU  43 -15.536   6.769  -5.575
    4    HB3  LEU  43           HB3      LEU  43 -15.753   8.364  -6.295
    5    HG   LEU  43           HG       LEU  43 -13.134   7.259  -5.311
    6   HD13  LEU  43          HD11      LEU  43 -12.595   6.737  -7.509
    7   HD12  LEU  43          HD12      LEU  43 -13.868   7.760  -8.170
    8   HD11  LEU  43          HD13      LEU  43 -14.280   6.228  -7.403
    9   HD21  LEU  43          HD21      LEU  43 -13.933   9.801  -6.732
   10   HD23  LEU  43          HD22      LEU  43 -12.271   9.212  -6.666
   11   HD22  LEU  43          HD23      LEU  43 -13.115   9.639  -5.178

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ALA  44           H        ALA  44 -17.127   7.526  -2.314
    2    HA   ALA  44           HA       ALA  44 -19.604   7.436  -3.642
    3    HB3  ALA  44           HB1      ALA  44 -19.476   6.267  -1.574
    4    HB2  ALA  44           HB2      ALA  44 -20.573   7.613  -1.269
    5    HB1  ALA  44           HB3      ALA  44 -18.902   7.695  -0.712

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLY  45           H        GLY  45 -18.165  10.188  -2.039
    2    HA3  GLY  45           HA2      GLY  45 -20.591  11.713  -2.365
    3    HA2  GLY  45           HA3      GLY  45 -19.042  12.312  -1.771

  No H/Q in entry =           3
  In of MODEL   16
    1    H    GLU  46           H        GLU  46 -17.515  11.422  -4.083
    2    HA   GLU  46           HA       GLU  46 -18.134  13.685  -5.797
    3    HB2  GLU  46           HB2      GLU  46 -15.953  11.595  -5.850
    4    HB3  GLU  46           HB3      GLU  46 -16.077  12.918  -7.008
    5    HG2  GLU  46           HG2      GLU  46 -15.764  14.539  -5.242
    6    HG3  GLU  46           HG3      GLU  46 -15.737  13.252  -4.036

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LYS  47           H        LYS  47 -18.041  10.177  -6.319
    2    HA   LYS  47           HA       LYS  47 -19.135  10.471  -8.990
    3    HB2  LYS  47           HB2      LYS  47 -18.000   8.313  -7.352
    4    HB3  LYS  47           HB3      LYS  47 -19.358   7.814  -8.360
    5    HG2  LYS  47           HG2      LYS  47 -17.264   7.431  -9.500
    6    HG3  LYS  47           HG3      LYS  47 -18.199   8.673 -10.330
    7    HD2  LYS  47           HD2      LYS  47 -16.881  10.405  -9.176
    8    HD3  LYS  47           HD3      LYS  47 -15.917   9.141  -8.416
    9    HE2  LYS  47           HE2      LYS  47 -15.125   8.394 -10.568
   10    HE3  LYS  47           HE3      LYS  47 -16.176   9.545 -11.390
   11    HZ2  LYS  47           HZ1      LYS  47 -13.646  10.035 -10.805
   12    HZ1  LYS  47           HZ2      LYS  47 -14.378  10.648  -9.401
   13    HZ3  LYS  47           HZ3      LYS  47 -14.825  11.252 -10.925

  No H/Q in entry =          13
  In of MODEL   16
    1    H    GLY  48           H        GLY  48 -20.466   9.646  -5.862
    2    HA3  GLY  48           HA2      GLY  48 -22.859   8.498  -6.633
    3    HA2  GLY  48           HA3      GLY  48 -22.628   9.454  -5.170

  No H/Q in entry =           3
  In of MODEL   16
    1    H    GLN  49           H        GLN  49 -22.025  11.910  -6.680
    2    HA   GLN  49           HA       GLN  49 -24.576  13.044  -6.799
    3    HB2  GLN  49           HB2      GLN  49 -22.025  13.923  -8.136
    4    HB3  GLN  49           HB3      GLN  49 -23.480  14.896  -8.029
    5    HG2  GLN  49           HG2      GLN  49 -23.323  14.859  -5.592
    6    HG3  GLN  49           HG3      GLN  49 -21.881  13.864  -5.698
    7   HE21  GLN  49          HE21      GLN  49 -21.748  16.059  -4.371
    8   HE22  GLN  49          HE22      GLN  49 -20.816  17.324  -4.986

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ASN  50           H        ASN  50 -22.909  11.211  -9.231
    2    HA   ASN  50           HA       ASN  50 -24.783  12.149 -11.293
    3    HB2  ASN  50           HB2      ASN  50 -22.215  10.595 -11.561
    4    HB3  ASN  50           HB3      ASN  50 -23.261  11.062 -12.895
    5   HD21  ASN  50          HD21      ASN  50 -20.620  11.848 -11.262
    6   HD22  ASN  50          HD22      ASN  50 -20.374  13.489 -11.564

  No H/Q in entry =           6
  In of MODEL   16
    1    H    ALA  51           H        ALA  51 -24.789   9.737  -9.105
    2    HA   ALA  51           HA       ALA  51 -25.589   7.644 -10.984
    3    HB2  ALA  51           HB1      ALA  51 -25.018   6.249  -9.331
    4    HB3  ALA  51           HB2      ALA  51 -26.134   7.040  -8.219
    5    HB1  ALA  51           HB3      ALA  51 -24.491   7.652  -8.401

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ASP  52           H        ASP  52 -27.602   6.602 -10.872
    2    HA   ASP  52           HA       ASP  52 -29.769   8.436 -10.164
    3    HB2  ASP  52           HB2      ASP  52 -29.597   5.971 -11.895
    4    HB3  ASP  52           HB3      ASP  52 -31.136   6.706 -11.443

  No H/Q in entry =           4
  In of MODEL   16
    1    H    VAL  53           H        VAL  53 -28.194   5.509  -9.217
    2    HA   VAL  53           HA       VAL  53 -29.634   5.588  -6.701
    3    HB   VAL  53           HB       VAL  53 -31.047   3.988  -7.985
    4   HG11  VAL  53          HG11      VAL  53 -29.306   3.151  -9.527
    5   HG13  VAL  53          HG12      VAL  53 -30.151   1.843  -8.701
    6   HG12  VAL  53          HG13      VAL  53 -28.537   2.319  -8.176
    7   HG23  VAL  53          HG21      VAL  53 -30.244   1.963  -6.342
    8   HG22  VAL  53          HG22      VAL  53 -31.361   3.268  -5.944
    9   HG21  VAL  53          HG23      VAL  53 -29.654   3.415  -5.531

  No H/Q in entry =           9
  In of MODEL   16
    1    H    VAL  54           H        VAL  54 -28.328   5.102  -5.056
    2    HA   VAL  54           HA       VAL  54 -25.575   4.243  -5.686
    3    HB   VAL  54           HB       VAL  54 -26.631   5.974  -3.394
    4   HG11  VAL  54          HG11      VAL  54 -24.065   4.540  -3.718
    5   HG13  VAL  54          HG12      VAL  54 -24.813   5.190  -2.260
    6   HG12  VAL  54          HG13      VAL  54 -23.897   6.252  -3.329
    7   HG22  VAL  54          HG21      VAL  54 -25.754   7.808  -4.448
    8   HG21  VAL  54          HG22      VAL  54 -26.309   6.856  -5.825
    9   HG23  VAL  54          HG23      VAL  54 -24.602   6.855  -5.384

  No H/Q in entry =           9
  In of MODEL   16
    1    H    LEU  55           H        LEU  55 -25.000   2.301  -5.090
    2    HA   LEU  55           HA       LEU  55 -26.522   0.951  -2.948
    3    HB2  LEU  55           HB2      LEU  55 -24.975  -0.174  -5.271
    4    HB3  LEU  55           HB3      LEU  55 -25.745  -1.133  -4.006
    5    HG   LEU  55           HG       LEU  55 -27.165   0.519  -6.085
    6   HD13  LEU  55          HD11      LEU  55 -26.882  -1.305  -7.350
    7   HD12  LEU  55          HD12      LEU  55 -27.848  -2.201  -6.177
    8   HD11  LEU  55          HD13      LEU  55 -26.092  -2.156  -6.024
    9   HD23  LEU  55          HD21      LEU  55 -28.479  -1.459  -4.279
   10   HD22  LEU  55          HD22      LEU  55 -29.161  -0.050  -5.093
   11   HD21  LEU  55          HD23      LEU  55 -28.140   0.161  -3.671

  No H/Q in entry =          11
  In of MODEL   16
    1    H    LEU  56           H        LEU  56 -25.378   0.302  -1.158
    2    HA   LEU  56           HA       LEU  56 -22.440   0.670  -1.195
    3    HB2  LEU  56           HB2      LEU  56 -24.247   0.418   1.196
    4    HB3  LEU  56           HB3      LEU  56 -22.534   0.831   1.197
    5    HG   LEU  56           HG       LEU  56 -24.816   2.555   0.272
    6   HD11  LEU  56          HD11      LEU  56 -23.706   2.101   2.784
    7   HD13  LEU  56          HD12      LEU  56 -24.683   3.491   2.311
    8   HD12  LEU  56          HD13      LEU  56 -22.926   3.581   2.227
    9   HD23  LEU  56          HD21      LEU  56 -22.855   4.238   0.122
   10   HD22  LEU  56          HD22      LEU  56 -23.247   3.178  -1.232
   11   HD21  LEU  56          HD23      LEU  56 -21.898   2.786  -0.167

  No H/Q in entry =          11
  In of MODEL   16
    1    H    GLY  57           H        GLY  57 -21.077  -0.986  -0.702
    2    HA3  GLY  57           HA2      GLY  57 -22.024  -3.657  -0.964
    3    HA2  GLY  57           HA3      GLY  57 -20.398  -3.191  -0.472

  No H/Q in entry =           3
  In of MODEL   16
    1    HA   PRO  58           HA       PRO  58 -23.221  -4.293   3.210
    2    HB2  PRO  58           HB2      PRO  58 -22.561  -6.918   3.752
    3    HB3  PRO  58           HB3      PRO  58 -23.941  -6.472   2.748
    4    HG2  PRO  58           HG2      PRO  58 -21.222  -7.359   1.943
    5    HG3  PRO  58           HG3      PRO  58 -22.790  -7.787   1.258
    6    HD2  PRO  58           HD2      PRO  58 -21.162  -5.957   0.083
    7    HD3  PRO  58           HD3      PRO  58 -22.920  -5.851  -0.018

  No H/Q in entry =           7
  In of MODEL   16
    1    H    GLN  59           H        GLN  59 -19.854  -4.783   2.593
    2    HA   GLN  59           HA       GLN  59 -19.102  -4.876   5.353
    3    HB2  GLN  59           HB2      GLN  59 -17.504  -3.982   2.948
    4    HB3  GLN  59           HB3      GLN  59 -16.851  -4.236   4.554
    5    HG2  GLN  59           HG2      GLN  59 -18.125  -6.353   2.827
    6    HG3  GLN  59           HG3      GLN  59 -16.398  -6.110   3.032
    7   HE21  GLN  59          HE21      GLN  59 -18.610  -7.910   3.862
    8   HE22  GLN  59          HE22      GLN  59 -18.390  -8.654   5.333

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ILE  60           H        ILE  60 -20.008  -2.262   3.207
    2    HA   ILE  60           HA       ILE  60 -19.138  -0.365   5.301
    3    HB   ILE  60           HB       ILE  60 -19.355   1.411   3.516
    4   HG12  ILE  60          HG12      ILE  60 -19.173  -0.774   1.484
    5   HG13  ILE  60          HG13      ILE  60 -20.754  -0.226   2.038
    6   HG23  ILE  60          HG21      ILE  60 -17.194   1.176   2.852
    7   HG22  ILE  60          HG22      ILE  60 -17.347  -0.560   2.584
    8   HG21  ILE  60          HG23      ILE  60 -17.247   0.071   4.227
    9   HD13  ILE  60          HD11      ILE  60 -20.448   1.130   0.191
   10   HD12  ILE  60          HD12      ILE  60 -18.703   1.228   0.421
   11   HD11  ILE  60          HD13      ILE  60 -19.782   2.158   1.460

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ALA  61           H        ALA  61 -21.609  -1.926   5.329
    2    HA   ALA  61           HA       ALA  61 -23.817  -0.229   4.910
    3    HB1  ALA  61           HB1      ALA  61 -25.049  -1.738   6.198
    4    HB2  ALA  61           HB2      ALA  61 -23.656  -2.166   7.192
    5    HB3  ALA  61           HB3      ALA  61 -23.756  -2.731   5.524

  No H/Q in entry =           5
  In of MODEL   16
    1    H    TYR  62           H        TYR  62 -21.614  -0.432   7.706
    2    HA   TYR  62           HA       TYR  62 -23.154   1.200   9.415
    3    HB2  TYR  62           HB2      TYR  62 -21.108   1.576  10.659
    4    HB3  TYR  62           HB3      TYR  62 -21.186  -0.113  10.157
    5    HD1  TYR  62           HD1      TYR  62 -19.598  -1.011   8.519
    6    HD2  TYR  62           HD2      TYR  62 -19.397   3.083   9.726
    7    HE1  TYR  62           HE1      TYR  62 -17.383  -0.810   7.455
    8    HE2  TYR  62           HE2      TYR  62 -17.168   3.278   8.664
    9    HH   TYR  62           HH       TYR  62 -15.531   2.173   7.688

  No H/Q in entry =           9
  In of MODEL   16
    1    H    MET  63           H        MET  63 -21.500   2.111   6.582
    2    HA   MET  63           HA       MET  63 -21.304   4.924   7.345
    3    HB2  MET  63           HB2      MET  63 -20.712   3.459   4.773
    4    HB3  MET  63           HB3      MET  63 -20.498   5.196   4.999
    5    HG2  MET  63           HG2      MET  63 -18.798   4.778   6.681
    6    HG3  MET  63           HG3      MET  63 -19.021   3.040   6.485
    7    HE2  MET  63           HE1      MET  63 -17.020   5.946   3.632
    8    HE1  MET  63           HE2      MET  63 -17.846   6.280   5.154
    9    HE3  MET  63           HE3      MET  63 -18.783   6.003   3.684

  No H/Q in entry =           9
  In of MODEL   16
    1    H    LEU  64           H        LEU  64 -23.886   3.121   6.334
    2    HA   LEU  64           HA       LEU  64 -25.079   4.603   4.291
    3    HB2  LEU  64           HB2      LEU  64 -25.972   2.485   5.156
    4    HB3  LEU  64           HB3      LEU  64 -26.421   3.296   6.656
    5    HG   LEU  64           HG       LEU  64 -28.101   4.599   5.458
    6   HD13  LEU  64          HD11      LEU  64 -27.814   4.891   3.233
    7   HD12  LEU  64          HD12      LEU  64 -28.477   3.267   3.047
    8   HD11  LEU  64          HD13      LEU  64 -26.731   3.505   3.111
    9   HD23  LEU  64          HD21      LEU  64 -28.650   1.811   4.642
   10   HD22  LEU  64          HD22      LEU  64 -29.625   2.933   5.589
   11   HD21  LEU  64          HD23      LEU  64 -28.260   2.107   6.336

  No H/Q in entry =          11
  In of MODEL   16
    1    HA   PRO  65           HA       PRO  65 -27.226   7.714   7.117
    2    HB2  PRO  65           HB2      PRO  65 -25.225   7.794   9.375
    3    HB3  PRO  65           HB3      PRO  65 -26.961   8.093   9.428
    4    HG2  PRO  65           HG2      PRO  65 -26.057   5.806  10.299
    5    HG3  PRO  65           HG3      PRO  65 -27.477   5.816   9.253
    6    HD2  PRO  65           HD2      PRO  65 -24.611   5.185   8.536
    7    HD3  PRO  65           HD3      PRO  65 -26.079   4.327   8.067

  No H/Q in entry =           7
  In of MODEL   16
    1    H    GLU  66           H        GLU  66 -23.670   7.614   7.189
    2    HA   GLU  66           HA       GLU  66 -23.340  10.418   6.853
    3    HB2  GLU  66           HB2      GLU  66 -21.554   8.105   6.146
    4    HB3  GLU  66           HB3      GLU  66 -21.084   9.796   5.979
    5    HG2  GLU  66           HG2      GLU  66 -21.292  10.112   8.356
    6    HG3  GLU  66           HG3      GLU  66 -21.838   8.446   8.546

  No H/Q in entry =           6
  In of MODEL   16
    1    H    ILE  67           H        ILE  67 -23.474   7.730   4.535
    2    HA   ILE  67           HA       ILE  67 -23.036   9.488   2.284
    3    HB   ILE  67           HB       ILE  67 -23.971   6.589   2.393
    4   HG12  ILE  67          HG12      ILE  67 -21.326   7.747   1.499
    5   HG13  ILE  67          HG13      ILE  67 -21.626   7.291   3.175
    6   HG21  ILE  67          HG21      ILE  67 -23.888   8.520   0.213
    7   HG23  ILE  67          HG22      ILE  67 -24.535   6.880   0.224
    8   HG22  ILE  67          HG23      ILE  67 -22.823   7.151  -0.097
    9   HD12  ILE  67          HD11      ILE  67 -21.228   5.571   0.782
   10   HD11  ILE  67          HD12      ILE  67 -22.250   4.980   2.091
   11   HD13  ILE  67          HD13      ILE  67 -20.571   5.416   2.412

  No H/Q in entry =          11
  In of MODEL   16
    1    H    GLN  68           H        GLN  68 -25.919   8.432   3.891
    2    HA   GLN  68           HA       GLN  68 -27.736   9.435   1.941
    3    HB2  GLN  68           HB2      GLN  68 -27.997   9.008   4.914
    4    HB3  GLN  68           HB3      GLN  68 -29.308   9.644   3.935
    5    HG2  GLN  68           HG2      GLN  68 -29.363   7.646   2.610
    6    HG3  GLN  68           HG3      GLN  68 -27.922   7.031   3.398
    7   HE21  GLN  68          HE21      GLN  68 -30.119   5.706   3.229
    8   HE22  GLN  68          HE22      GLN  68 -30.955   5.228   4.634

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ARG  69           H        ARG  69 -26.108  11.011   4.718
    2    HA   ARG  69           HA       ARG  69 -27.436  13.521   4.372
    3    HB2  ARG  69           HB2      ARG  69 -25.106  12.520   5.938
    4    HB3  ARG  69           HB3      ARG  69 -25.160  14.248   5.621
    5    HG2  ARG  69           HG2      ARG  69 -27.477  14.301   6.594
    6    HG3  ARG  69           HG3      ARG  69 -27.293  12.598   7.027
    7    HD2  ARG  69           HD2      ARG  69 -25.565  14.904   7.998
    8    HD3  ARG  69           HD3      ARG  69 -26.708  13.991   8.970
    9    HE   ARG  69           HE       ARG  69 -24.110  13.045   7.997
   10   HH21  ARG  69          HH11      ARG  69 -23.327  11.241   9.149
   11   HH22  ARG  69          HH12      ARG  69 -24.368  10.412  10.258
   12   HH11  ARG  69          HH21      ARG  69 -27.075  12.499   9.681
   13   HH12  ARG  69          HH22      ARG  69 -26.490  11.123  10.556

  No H/Q in entry =          13
  In of MODEL   16
    1    H    LEU  70           H        LEU  70 -24.587  12.107   2.978
    2    HA   LEU  70           HA       LEU  70 -23.438  14.483   1.868
    3    HB2  LEU  70           HB2      LEU  70 -22.479  12.137   2.406
    4    HB3  LEU  70           HB3      LEU  70 -23.100  11.720   0.809
    5    HG   LEU  70           HG       LEU  70 -21.486  13.094  -0.242
    6   HD11  LEU  70          HD11      LEU  70 -20.651  13.857   2.565
    7   HD13  LEU  70          HD12      LEU  70 -21.331  14.931   1.342
    8   HD12  LEU  70          HD13      LEU  70 -19.730  14.231   1.106
    9   HD22  LEU  70          HD21      LEU  70 -20.079  11.351  -0.053
   10   HD21  LEU  70          HD22      LEU  70 -21.014  10.808   1.341
   11   HD23  LEU  70          HD23      LEU  70 -19.612  11.853   1.571

  No H/Q in entry =          11
  In of MODEL   16
    1    H    LEU  71           H        LEU  71 -25.631  12.003   0.691
    2    HA   LEU  71           HA       LEU  71 -26.132  13.559  -1.788
    3    HB2  LEU  71           HB2      LEU  71 -26.385  10.569  -1.415
    4    HB3  LEU  71           HB3      LEU  71 -26.500  11.468  -2.926
    5    HG   LEU  71           HG       LEU  71 -23.980  11.400  -1.267
    6   HD12  LEU  71          HD11      LEU  71 -24.059   9.833  -3.738
    7   HD11  LEU  71          HD12      LEU  71 -25.079   9.194  -2.450
    8   HD13  LEU  71          HD13      LEU  71 -23.356   9.438  -2.170
    9   HD22  LEU  71          HD21      LEU  71 -24.053  13.253  -2.715
   10   HD21  LEU  71          HD22      LEU  71 -24.568  12.252  -4.072
   11   HD23  LEU  71          HD23      LEU  71 -22.949  12.062  -3.399

  No H/Q in entry =          11
  In of MODEL   16
    1    HA   PRO  72           HA       PRO  72 -30.005  13.111   0.823
    2    HB2  PRO  72           HB2      PRO  72 -30.818  15.688   0.806
    3    HB3  PRO  72           HB3      PRO  72 -29.517  15.187   1.885
    4    HG2  PRO  72           HG2      PRO  72 -29.310  16.444  -0.838
    5    HG3  PRO  72           HG3      PRO  72 -28.534  16.946   0.664
    6    HD2  PRO  72           HD2      PRO  72 -27.225  15.408  -1.141
    7    HD3  PRO  72           HD3      PRO  72 -26.973  15.195   0.591

  No H/Q in entry =           7
  In of MODEL   16
    1    H    ASN  73           H        ASN  73 -29.365  14.134  -2.366
    2    HA   ASN  73           HA       ASN  73 -32.230  13.892  -3.005
    3    HB2  ASN  73           HB2      ASN  73 -31.745  15.041  -5.074
    4    HB3  ASN  73           HB3      ASN  73 -31.205  15.977  -3.690
    5   HD21  ASN  73          HD21      ASN  73 -30.409  16.074  -6.365
    6   HD22  ASN  73          HD22      ASN  73 -28.744  15.887  -6.563

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LYS  74           H        LYS  74 -30.291  11.591  -2.637
    2    HA   LYS  74           HA       LYS  74 -30.884  10.270  -5.218
    3    HB2  LYS  74           HB2      LYS  74 -28.358   9.891  -3.606
    4    HB3  LYS  74           HB3      LYS  74 -28.756   9.124  -5.144
    5    HG2  LYS  74           HG2      LYS  74 -28.437  12.082  -4.869
    6    HG3  LYS  74           HG3      LYS  74 -27.083  11.002  -5.199
    7    HD2  LYS  74           HD2      LYS  74 -28.217  10.143  -7.165
    8    HD3  LYS  74           HD3      LYS  74 -29.617  11.159  -6.819
    9    HE2  LYS  74           HE2      LYS  74 -28.353  13.151  -7.213
   10    HE3  LYS  74           HE3      LYS  74 -26.850  12.236  -7.326
   11    HZ2  LYS  74           HZ1      LYS  74 -28.310  12.918  -9.436
   12    HZ1  LYS  74           HZ2      LYS  74 -28.993  11.400  -9.100
   13    HZ3  LYS  74           HZ3      LYS  74 -27.326  11.536  -9.394

  No H/Q in entry =          13
  In of MODEL   16
    1    HA   PRO  75           HA       PRO  75 -32.336   7.240  -2.320
    2    HB2  PRO  75           HB2      PRO  75 -32.688   5.068  -3.956
    3    HB3  PRO  75           HB3      PRO  75 -33.788   6.445  -3.992
    4    HG2  PRO  75           HG2      PRO  75 -31.462   5.847  -5.779
    5    HG3  PRO  75           HG3      PRO  75 -33.102   6.327  -6.214
    6    HD2  PRO  75           HD2      PRO  75 -31.124   8.152  -6.126
    7    HD3  PRO  75           HD3      PRO  75 -32.749   8.570  -5.577

  No H/Q in entry =           7
  In of MODEL   16
    1    H    VAL  76           H        VAL  76 -30.904   6.124  -0.975
    2    HA   VAL  76           HA       VAL  76 -28.463   4.894  -2.112
    3    HB   VAL  76           HB       VAL  76 -28.722   6.300   0.580
    4   HG11  VAL  76          HG11      VAL  76 -26.392   5.001  -0.843
    5   HG13  VAL  76          HG12      VAL  76 -27.097   4.526   0.703
    6   HG12  VAL  76          HG13      VAL  76 -26.221   6.050   0.565
    7   HG22  VAL  76          HG21      VAL  76 -28.017   8.208  -0.260
    8   HG21  VAL  76          HG22      VAL  76 -28.573   7.560  -1.804
    9   HG23  VAL  76          HG23      VAL  76 -26.873   7.428  -1.352

  No H/Q in entry =           9
  In of MODEL   16
    1    H    GLU  77           H        GLU  77 -28.288   2.721  -1.552
    2    HA   GLU  77           HA       GLU  77 -29.090   1.885   1.083
    3    HB2  GLU  77           HB2      GLU  77 -30.729   0.283   0.512
    4    HB3  GLU  77           HB3      GLU  77 -31.248   1.833  -0.152
    5    HG2  GLU  77           HG2      GLU  77 -30.654   1.117  -2.358
    6    HG3  GLU  77           HG3      GLU  77 -30.042  -0.408  -1.722

  No H/Q in entry =           6
  In of MODEL   16
    1    H    VAL  78           H        VAL  78 -28.804  -0.223   1.691
    2    HA   VAL  78           HA       VAL  78 -26.154  -1.025   0.784
    3    HB   VAL  78           HB       VAL  78 -27.878  -1.932   3.127
    4   HG11  VAL  78          HG11      VAL  78 -25.563  -3.179   1.972
    5   HG13  VAL  78          HG12      VAL  78 -26.480  -3.667   3.399
    6   HG12  VAL  78          HG13      VAL  78 -25.139  -2.534   3.558
    7   HG22  VAL  78          HG21      VAL  78 -26.394  -0.632   4.498
    8   HG21  VAL  78          HG22      VAL  78 -27.110   0.383   3.247
    9   HG23  VAL  78          HG23      VAL  78 -25.445  -0.173   3.084

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ILE  79           H        ILE  79 -25.653  -2.920  -0.167
    2    HA   ILE  79           HA       ILE  79 -27.742  -4.325  -1.551
    3    HB   ILE  79           HB       ILE  79 -24.762  -4.915  -1.343
    4   HG12  ILE  79          HG12      ILE  79 -26.376  -3.724  -3.604
    5   HG13  ILE  79          HG13      ILE  79 -25.483  -2.760  -2.426
    6   HG22  ILE  79          HG21      ILE  79 -25.885  -6.016  -3.689
    7   HG21  ILE  79          HG22      ILE  79 -26.881  -6.552  -2.335
    8   HG23  ILE  79          HG23      ILE  79 -25.145  -6.864  -2.331
    9   HD13  ILE  79          HD11      ILE  79 -24.071  -2.856  -4.248
   10   HD12  ILE  79          HD12      ILE  79 -24.444  -4.551  -4.569
   11   HD11  ILE  79          HD13      ILE  79 -23.450  -4.114  -3.177

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ASP  80           H        ASP  80 -28.643  -6.245  -1.013
    2    HA   ASP  80           HA       ASP  80 -28.608  -7.209   1.610
    3    HB2  ASP  80           HB2      ASP  80 -30.372  -7.713  -0.042
    4    HB3  ASP  80           HB3      ASP  80 -29.234  -8.720  -0.935

  No H/Q in entry =           4
  In of MODEL   16
    1    H    SER  81           H        SER  81 -27.095  -8.400   2.713
    2    HA   SER  81           HA       SER  81 -24.612  -9.101   1.505
    3    HB2  SER  81           HB2      SER  81 -24.082 -10.193   3.649
    4    HB3  SER  81           HB3      SER  81 -24.750  -8.581   3.900
    5    HG   SER  81           HG       SER  81 -26.497  -9.404   4.739

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU  82           H        LEU  82 -27.362 -11.147   1.777
    2    HA   LEU  82           HA       LEU  82 -25.860 -13.532   1.199
    3    HB2  LEU  82           HB2      LEU  82 -28.783 -12.850   0.967
    4    HB3  LEU  82           HB3      LEU  82 -28.115 -14.460   0.704
    5    HG   LEU  82           HG       LEU  82 -28.008 -12.963   3.305
    6   HD12  LEU  82          HD11      LEU  82 -29.723 -14.589   4.019
    7   HD11  LEU  82          HD12      LEU  82 -29.787 -15.230   2.375
    8   HD13  LEU  82          HD13      LEU  82 -30.307 -13.576   2.698
    9   HD23  LEU  82          HD21      LEU  82 -27.475 -15.401   4.011
   10   HD22  LEU  82          HD22      LEU  82 -26.203 -14.450   3.246
   11   HD21  LEU  82          HD23      LEU  82 -27.099 -15.644   2.305

  No H/Q in entry =          11
  In of MODEL   16
    1    H    LEU  83           H        LEU  83 -27.775 -11.224  -0.665
    2    HA   LEU  83           HA       LEU  83 -27.599 -12.526  -3.168
    3    HB2  LEU  83           HB2      LEU  83 -27.954  -9.628  -2.451
    4    HB3  LEU  83           HB3      LEU  83 -27.997 -10.233  -4.107
    5    HG   LEU  83           HG       LEU  83 -30.038 -10.632  -1.940
    6   HD13  LEU  83          HD11      LEU  83 -30.758  -8.745  -2.959
    7   HD12  LEU  83          HD12      LEU  83 -31.242  -9.819  -4.271
    8   HD11  LEU  83          HD13      LEU  83 -29.691  -8.982  -4.343
    9   HD23  LEU  83          HD21      LEU  83 -30.201 -11.822  -4.694
   10   HD22  LEU  83          HD22      LEU  83 -31.177 -12.188  -3.272
   11   HD21  LEU  83          HD23      LEU  83 -29.500 -12.722  -3.349

  No H/Q in entry =          11
  In of MODEL   16
    1    H    TYR  84           H        TYR  84 -25.600 -10.220  -1.436
    2    HA   TYR  84           HA       TYR  84 -23.729  -9.718  -3.555
    3    HB2  TYR  84           HB2      TYR  84 -24.219  -8.272  -1.497
    4    HB3  TYR  84           HB3      TYR  84 -23.219  -9.413  -0.599
    5    HD1  TYR  84           HD1      TYR  84 -20.846  -9.321  -0.705
    6    HD2  TYR  84           HD2      TYR  84 -23.187  -6.923  -3.352
    7    HE1  TYR  84           HE1      TYR  84 -18.804  -8.113  -1.397
    8    HE2  TYR  84           HE2      TYR  84 -21.152  -5.714  -4.060
    9    HH   TYR  84           HH       TYR  84 -18.832  -5.237  -2.948

  No H/Q in entry =           9
  In of MODEL   16
    1    H    GLY  85           H        GLY  85 -23.528 -11.795  -0.657
    2    HA3  GLY  85           HA2      GLY  85 -20.969 -12.776  -1.162
    3    HA2  GLY  85           HA3      GLY  85 -22.216 -13.621  -0.245

  No H/Q in entry =           3
  In of MODEL   16
    1    H    LYS  86           H        LYS  86 -24.069 -13.909  -2.313
    2    HA   LYS  86           HA       LYS  86 -23.062 -16.272  -3.628
    3    HB2  LYS  86           HB2      LYS  86 -25.312 -16.071  -2.650
    4    HB3  LYS  86           HB3      LYS  86 -25.685 -14.788  -3.801
    5    HG2  LYS  86           HG2      LYS  86 -25.567 -16.363  -5.619
    6    HG3  LYS  86           HG3      LYS  86 -25.145 -17.651  -4.490
    7    HD2  LYS  86           HD2      LYS  86 -27.243 -17.260  -3.269
    8    HD3  LYS  86           HD3      LYS  86 -27.668 -15.988  -4.412
    9    HE2  LYS  86           HE2      LYS  86 -27.678 -17.623  -6.231
   10    HE3  LYS  86           HE3      LYS  86 -27.251 -18.897  -5.088
   11    HZ3  LYS  86           HZ1      LYS  86 -29.559 -19.019  -5.270
   12    HZ2  LYS  86           HZ2      LYS  86 -29.756 -17.330  -5.243
   13    HZ1  LYS  86           HZ3      LYS  86 -29.317 -18.157  -3.826

  No H/Q in entry =          13
  In of MODEL   16
    1    H    VAL  87           H        VAL  87 -22.988 -13.038  -4.447
    2    HA   VAL  87           HA       VAL  87 -22.666 -11.826  -6.359
    3    HB   VAL  87           HB       VAL  87 -21.646 -14.327  -7.737
    4   HG11  VAL  87          HG11      VAL  87 -21.808 -11.863  -8.693
    5   HG13  VAL  87          HG12      VAL  87 -20.384 -12.852  -9.019
    6   HG12  VAL  87          HG13      VAL  87 -20.339 -11.629  -7.749
    7   HG22  VAL  87          HG21      VAL  87 -19.517 -14.137  -6.674
    8   HG21  VAL  87          HG22      VAL  87 -20.743 -14.286  -5.416
    9   HG23  VAL  87          HG23      VAL  87 -20.034 -12.712  -5.774

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ASP  88           H        ASP  88 -25.194 -12.427  -6.022
    2    HA   ASP  88           HA       ASP  88 -26.339 -13.565  -8.446
    3    HB2  ASP  88           HB2      ASP  88 -27.338 -13.845  -6.128
    4    HB3  ASP  88           HB3      ASP  88 -27.759 -12.135  -6.187

  No H/Q in entry =           4
  In of MODEL   16
    1    H    GLY  89           H        GLY  89 -25.611 -12.284 -10.059
    2    HA3  GLY  89           HA2      GLY  89 -25.740  -9.504 -10.194
    3    HA2  GLY  89           HA3      GLY  89 -25.737 -10.593 -11.580

  No H/Q in entry =           3
  In of MODEL   16
    1    H    LEU  90           H        LEU  90 -28.208 -11.908 -11.162
    2    HA   LEU  90           HA       LEU  90 -29.983  -9.915 -12.229
    3    HB2  LEU  90           HB2      LEU  90 -30.094 -12.294 -12.865
    4    HB3  LEU  90           HB3      LEU  90 -30.605 -12.689 -11.224
    5    HG   LEU  90           HG       LEU  90 -32.703 -11.525 -11.560
    6   HD13  LEU  90          HD11      LEU  90 -32.492  -9.753 -12.994
    7   HD12  LEU  90          HD12      LEU  90 -33.055 -10.954 -14.159
    8   HD11  LEU  90          HD13      LEU  90 -31.334 -10.594 -14.027
    9   HD23  LEU  90          HD21      LEU  90 -32.665 -13.099 -14.032
   10   HD22  LEU  90          HD22      LEU  90 -33.646 -13.279 -12.578
   11   HD21  LEU  90          HD23      LEU  90 -32.004 -13.922 -12.618

  No H/Q in entry =          11
  In of MODEL   16
    1    H    GLY  91           H        GLY  91 -29.841 -11.492  -9.080
    2    HA3  GLY  91           HA2      GLY  91 -32.159 -10.360  -8.013
    3    HA2  GLY  91           HA3      GLY  91 -30.777 -10.941  -7.085

  No H/Q in entry =           3
  In of MODEL   16
    1    H    VAL  92           H        VAL  92 -28.825  -9.131  -7.900
    2    HA   VAL  92           HA       VAL  92 -29.573  -6.852  -6.297
    3    HB   VAL  92           HB       VAL  92 -27.037  -7.331  -7.906
    4   HG12  VAL  92          HG11      VAL  92 -27.165  -5.498  -5.536
    5   HG11  VAL  92          HG12      VAL  92 -27.821  -4.906  -7.065
    6   HG13  VAL  92          HG13      VAL  92 -26.134  -5.408  -6.965
    7   HG22  VAL  92          HG21      VAL  92 -26.842  -8.959  -6.351
    8   HG21  VAL  92          HG22      VAL  92 -27.972  -8.184  -5.239
    9   HG23  VAL  92          HG23      VAL  92 -26.307  -7.611  -5.348

  No H/Q in entry =           9
  In of MODEL   16
    1    H    LEU  93           H        LEU  93 -29.180  -7.442  -9.733
    2    HA   LEU  93           HA       LEU  93 -29.478  -4.780 -10.601
    3    HB2  LEU  93           HB2      LEU  93 -28.871  -6.612 -12.106
    4    HB3  LEU  93           HB3      LEU  93 -30.475  -7.314 -11.898
    5    HG   LEU  93           HG       LEU  93 -31.451  -5.307 -12.976
    6   HD11  LEU  93          HD11      LEU  93 -29.570  -3.759 -12.437
    7   HD13  LEU  93          HD12      LEU  93 -30.012  -3.741 -14.145
    8   HD12  LEU  93          HD13      LEU  93 -28.575  -4.614 -13.614
    9   HD23  LEU  93          HD21      LEU  93 -30.425  -5.841 -15.276
   10   HD22  LEU  93          HD22      LEU  93 -31.289  -7.102 -14.399
   11   HD21  LEU  93          HD23      LEU  93 -29.524  -7.079 -14.402

  No H/Q in entry =          11
  In of MODEL   16
    1    H    LYS  94           H        LYS  94 -31.899  -7.301  -9.808
    2    HA   LYS  94           HA       LYS  94 -34.216  -5.802 -10.396
    3    HB2  LYS  94           HB2      LYS  94 -33.741  -8.042  -8.436
    4    HB3  LYS  94           HB3      LYS  94 -35.325  -7.311  -8.686
    5    HG2  LYS  94           HG2      LYS  94 -35.255  -8.034 -11.037
    6    HG3  LYS  94           HG3      LYS  94 -33.708  -8.821 -10.729
    7    HD2  LYS  94           HD2      LYS  94 -34.852 -10.176  -8.934
    8    HD3  LYS  94           HD3      LYS  94 -36.383  -9.488  -9.472
    9    HE2  LYS  94           HE2      LYS  94 -35.887 -10.373 -11.760
   10    HE3  LYS  94           HE3      LYS  94 -34.486 -11.199 -11.077
   11    HZ3  LYS  94           HZ1      LYS  94 -36.363 -12.681 -11.280
   12    HZ2  LYS  94           HZ2      LYS  94 -37.317 -11.660 -10.314
   13    HZ1  LYS  94           HZ3      LYS  94 -35.971 -12.449  -9.645

  No H/Q in entry =          13
  In of MODEL   16
    1    H    ALA  95           H        ALA  95 -32.393  -6.027  -7.354
    2    HA   ALA  95           HA       ALA  95 -34.212  -4.448  -5.835
    3    HB2  ALA  95           HB1      ALA  95 -31.862  -5.878  -5.333
    4    HB3  ALA  95           HB2      ALA  95 -32.822  -4.983  -4.158
    5    HB1  ALA  95           HB3      ALA  95 -31.461  -4.202  -4.963

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA  96           H        ALA  96 -31.557  -3.594  -7.915
    2    HA   ALA  96           HA       ALA  96 -31.408  -0.855  -7.078
    3    HB2  ALA  96           HB1      ALA  96 -30.044  -0.604  -9.183
    4    HB3  ALA  96           HB2      ALA  96 -30.379  -2.297  -9.542
    5    HB1  ALA  96           HB3      ALA  96 -29.455  -1.868  -8.103

  No H/Q in entry =           5
  In of MODEL   16
    1    H    VAL  97           H        VAL  97 -32.974  -2.476  -9.802
    2    HA   VAL  97           HA       VAL  97 -34.001  -0.128 -11.002
    3    HB   VAL  97           HB       VAL  97 -34.867  -3.036 -11.112
    4   HG11  VAL  97          HG11      VAL  97 -36.621  -0.984 -11.547
    5   HG13  VAL  97          HG12      VAL  97 -36.710  -2.558 -12.341
    6   HG12  VAL  97          HG13      VAL  97 -35.932  -1.203 -13.158
    7   HG21  VAL  97          HG21      VAL  97 -33.554  -1.186 -13.104
    8   HG23  VAL  97          HG22      VAL  97 -34.040  -2.849 -13.433
    9   HG22  VAL  97          HG23      VAL  97 -32.783  -2.515 -12.240

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ALA  98           H        ALA  98 -35.224  -2.342  -8.515
    2    HA   ALA  98           HA       ALA  98 -37.761  -1.151  -8.134
    3    HB1  ALA  98           HB1      ALA  98 -36.790  -3.394  -7.155
    4    HB3  ALA  98           HB2      ALA  98 -37.951  -2.469  -6.200
    5    HB2  ALA  98           HB3      ALA  98 -36.228  -2.363  -5.840

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA  99           H        ALA  99 -34.665  -0.454  -6.472
    2    HA   ALA  99           HA       ALA  99 -35.753   1.512  -4.763
    3    HB1  ALA  99           HB1      ALA  99 -33.124   0.587  -5.535
    4    HB2  ALA  99           HB2      ALA  99 -33.657   1.312  -4.017
    5    HB3  ALA  99           HB3      ALA  99 -33.162   2.342  -5.362

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ILE 100           H        ILE 100 -34.713   1.702  -8.116
    2    HA   ILE 100           HA       ILE 100 -34.832   4.557  -8.267
    3    HB   ILE 100           HB       ILE 100 -34.975   2.457 -10.457
    4   HG12  ILE 100          HG12      ILE 100 -32.769   4.387  -9.741
    5   HG13  ILE 100          HG13      ILE 100 -32.840   2.727  -9.150
    6   HG21  ILE 100          HG21      ILE 100 -35.336   5.387 -10.516
    7   HG23  ILE 100          HG22      ILE 100 -35.869   4.157 -11.662
    8   HG22  ILE 100          HG23      ILE 100 -34.205   4.739 -11.704
    9   HD12  ILE 100          HD11      ILE 100 -32.290   3.739 -11.901
   10   HD11  ILE 100          HD12      ILE 100 -32.984   2.132 -11.684
   11   HD13  ILE 100          HD13      ILE 100 -31.428   2.525 -10.957

  No H/Q in entry =          11
  In of MODEL   16
    1    H    LYS 101           H        LYS 101 -37.181   2.015  -9.051
    2    HA   LYS 101           HA       LYS 101 -39.228   3.732 -10.009
    3    HB2  LYS 101           HB2      LYS 101 -39.170   0.929  -8.949
    4    HB3  LYS 101           HB3      LYS 101 -40.706   1.732  -9.273
    5    HG2  LYS 101           HG2      LYS 101 -40.231   1.912 -11.567
    6    HG3  LYS 101           HG3      LYS 101 -38.543   1.464 -11.325
    7    HD2  LYS 101           HD2      LYS 101 -39.835  -0.395 -12.255
    8    HD3  LYS 101           HD3      LYS 101 -39.213  -0.777 -10.649
    9    HE2  LYS 101           HE2      LYS 101 -41.290  -1.440 -10.157
   10    HE3  LYS 101           HE3      LYS 101 -41.710   0.274 -10.118
   11    HZ3  LYS 101           HZ1      LYS 101 -42.606   0.186 -12.237
   12    HZ2  LYS 101           HZ2      LYS 101 -43.099  -1.293 -11.566
   13    HZ1  LYS 101           HZ3      LYS 101 -41.792  -1.246 -12.649

  No H/Q in entry =          13
  In of MODEL   16
    1    H    LYS 102           H        LYS 102 -38.765   2.166  -6.837
    2    HA   LYS 102           HA       LYS 102 -40.986   3.380  -5.607
    3    HB2  LYS 102           HB2      LYS 102 -39.788   1.463  -4.640
    4    HB3  LYS 102           HB3      LYS 102 -38.375   2.483  -4.372
    5    HG2  LYS 102           HG2      LYS 102 -39.660   3.868  -2.841
    6    HG3  LYS 102           HG3      LYS 102 -41.077   2.852  -3.109
    7    HD2  LYS 102           HD2      LYS 102 -39.890   0.936  -2.131
    8    HD3  LYS 102           HD3      LYS 102 -38.475   1.953  -1.860
    9    HE2  LYS 102           HE2      LYS 102 -39.795   3.424  -0.414
   10    HE3  LYS 102           HE3      LYS 102 -41.229   2.440  -0.706
   11    HZ1  LYS 102           HZ1      LYS 102 -39.545   0.625   0.253
   12    HZ3  LYS 102           HZ2      LYS 102 -40.635   1.510   1.206
   13    HZ2  LYS 102           HZ3      LYS 102 -39.014   2.004   1.089

  No H/Q in entry =          13
  In of MODEL   16
    1    H    ALA 103           H        ALA 103 -38.003   4.732  -6.589
    2    HA   ALA 103           HA       ALA 103 -38.175   7.006  -4.751
    3    HB2  ALA 103           HB1      ALA 103 -36.170   7.737  -6.310
    4    HB3  ALA 103           HB2      ALA 103 -36.171   6.030  -6.750
    5    HB1  ALA 103           HB3      ALA 103 -35.932   6.507  -5.070

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA 104           H        ALA 104 -38.814   6.372  -8.113
    2    HA   ALA 104           HA       ALA 104 -39.340   9.183  -8.666
    3    HB2  ALA 104           HB1      ALA 104 -39.398   8.571 -10.884
    4    HB1  ALA 104           HB2      ALA 104 -40.158   7.016 -10.544
    5    HB3  ALA 104           HB3      ALA 104 -38.430   7.235 -10.260

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA 105           H        ALA 105 -40.991   7.069  -6.912
    2    HA   ALA 105           HA       ALA 105 -43.386   8.513  -6.848
    3    HB2  ALA 105           HB1      ALA 105 -44.150   7.720  -8.907
    4    HB3  ALA 105           HB2      ALA 105 -44.811   6.517  -7.800
    5    HB1  ALA 105           HB3      ALA 105 -43.350   6.160  -8.718

  No H/Q in entry =           5
  In of MODEL   17
    1    H1   ALA   1           H3       ALA   1 -12.513 -15.287  -2.488
    2    H2   ALA   1           H2       ALA   1 -11.594 -16.444  -3.333
    3    H3   ALA   1           H1       ALA   1 -12.717 -15.472  -4.163
    4    HA   ALA   1           HA       ALA   1 -14.150 -17.145  -3.934
    5    HB3  ALA   1           HB1      ALA   1 -12.791 -18.947  -3.478
    6    HB1  ALA   1           HB2      ALA   1 -13.547 -18.826  -1.889
    7    HB2  ALA   1           HB3      ALA   1 -11.956 -18.116  -2.165

  No H/Q in entry =           7
  In of MODEL   17
    1    H    GLU   2           H        GLU   2 -15.793 -17.974  -2.285
    2    HA   GLU   2           HA       GLU   2 -17.407 -16.225  -1.221
    3    HB2  GLU   2           HB2      GLU   2 -16.519 -18.677   0.314
    4    HB3  GLU   2           HB3      GLU   2 -18.026 -17.797   0.570
    5    HG2  GLU   2           HG2      GLU   2 -19.025 -18.855  -1.171
    6    HG3  GLU   2           HG3      GLU   2 -17.693 -18.476  -2.252

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLU   3           H        GLU   3 -15.526 -17.629   1.398
    2    HA   GLU   3           HA       GLU   3 -15.702 -15.279   2.966
    3    HB2  GLU   3           HB2      GLU   3 -14.169 -17.859   3.207
    4    HB3  GLU   3           HB3      GLU   3 -13.913 -16.549   4.361
    5    HG2  GLU   3           HG2      GLU   3 -16.110 -16.660   5.175
    6    HG3  GLU   3           HG3      GLU   3 -16.719 -17.441   3.722

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LEU   4           H        LEU   4 -12.776 -16.811   1.573
    2    HA   LEU   4           HA       LEU   4 -10.904 -14.948   2.182
    3    HB2  LEU   4           HB2      LEU   4 -11.157 -16.228  -0.549
    4    HB3  LEU   4           HB3      LEU   4  -9.692 -15.541   0.141
    5    HG   LEU   4           HG       LEU   4 -11.236 -17.912   1.241
    6   HD13  LEU   4          HD11      LEU   4  -9.630 -19.297   0.308
    7   HD12  LEU   4          HD12      LEU   4  -8.395 -18.039   0.288
    8   HD11  LEU   4          HD13      LEU   4  -9.681 -18.029  -0.916
    9   HD23  LEU   4          HD21      LEU   4  -8.989 -18.028   2.625
   10   HD22  LEU   4          HD22      LEU   4 -10.289 -16.964   3.157
   11   HD21  LEU   4          HD23      LEU   4  -8.911 -16.300   2.280

  No H/Q in entry =          11
  In of MODEL   17
    1    H    GLU   5           H        GLU   5 -13.230 -14.682  -0.494
    2    HA   GLU   5           HA       GLU   5 -12.175 -12.215  -1.482
    3    HB2  GLU   5           HB2      GLU   5 -13.544 -13.755  -2.862
    4    HB3  GLU   5           HB3      GLU   5 -14.939 -13.394  -1.844
    5    HG2  GLU   5           HG2      GLU   5 -14.801 -11.023  -2.458
    6    HG3  GLU   5           HG3      GLU   5 -13.369 -11.346  -3.436

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLU   6           H        GLU   6 -14.920 -13.046   0.602
    2    HA   GLU   6           HA       GLU   6 -15.770 -10.353   1.013
    3    HB2  GLU   6           HB2      GLU   6 -16.240 -12.889   2.596
    4    HB3  GLU   6           HB3      GLU   6 -17.012 -11.348   2.961
    5    HG2  GLU   6           HG2      GLU   6 -17.194 -12.762   0.287
    6    HG3  GLU   6           HG3      GLU   6 -18.435 -12.827   1.536

  No H/Q in entry =           6
  In of MODEL   17
    1    H    VAL   7           H        VAL   7 -13.509 -12.518   2.578
    2    HA   VAL   7           HA       VAL   7 -13.014 -10.964   4.913
    3    HB   VAL   7           HB       VAL   7 -11.351 -13.035   3.457
    4   HG11  VAL   7          HG11      VAL   7 -10.856 -11.524   6.028
    5   HG13  VAL   7          HG12      VAL   7  -9.758 -11.755   4.669
    6   HG12  VAL   7          HG13      VAL   7 -10.141 -13.109   5.732
    7   HG21  VAL   7          HG21      VAL   7 -13.615 -13.559   4.670
    8   HG23  VAL   7          HG22      VAL   7 -12.685 -13.311   6.149
    9   HG22  VAL   7          HG23      VAL   7 -12.216 -14.575   5.014

  No H/Q in entry =           9
  In of MODEL   17
    1    H    VAL   8           H        VAL   8 -11.501 -11.095   1.705
    2    HA   VAL   8           HA       VAL   8  -9.400  -9.267   2.210
    3    HB   VAL   8           HB       VAL   8 -10.873  -9.915  -0.354
    4   HG12  VAL   8          HG11      VAL   8  -8.807  -8.911  -1.426
    5   HG11  VAL   8          HG12      VAL   8  -8.377  -8.272   0.162
    6   HG13  VAL   8          HG13      VAL   8  -9.864  -7.746  -0.626
    7   HG22  VAL   8          HG21      VAL   8  -9.390 -11.662  -0.610
    8   HG21  VAL   8          HG22      VAL   8  -9.215 -11.526   1.138
    9   HG23  VAL   8          HG23      VAL   8  -8.046 -10.746   0.077

  No H/Q in entry =           9
  In of MODEL   17
    1    H    MET   9           H        MET   9 -12.735  -8.803   1.046
    2    HA   MET   9           HA       MET   9 -12.614  -6.027   0.624
    3    HB2  MET   9           HB2      MET   9 -14.871  -7.852   1.452
    4    HB3  MET   9           HB3      MET   9 -15.109  -6.118   1.219
    5    HG2  MET   9           HG2      MET   9 -14.261  -6.304  -1.086
    6    HG3  MET   9           HG3      MET   9 -14.006  -8.033  -0.857
    7    HE2  MET   9           HE1      MET   9 -16.645  -5.406  -2.139
    8    HE1  MET   9           HE2      MET   9 -16.345  -5.179  -0.418
    9    HE3  MET   9           HE3      MET   9 -17.932  -5.709  -0.965

  No H/Q in entry =           9
  In of MODEL   17
    1    H    GLY  10           H        GLY  10 -13.320  -7.917   3.542
    2    HA3  GLY  10           HA2      GLY  10 -13.827  -5.730   5.270
    3    HA2  GLY  10           HA3      GLY  10 -13.296  -7.332   5.777

  No H/Q in entry =           3
  In of MODEL   17
    1    H    LEU  11           H        LEU  11 -10.851  -7.500   4.466
    2    HA   LEU  11           HA       LEU  11  -9.125  -6.109   6.232
    3    HB2  LEU  11           HB2      LEU  11  -8.603  -7.531   3.619
    4    HB3  LEU  11           HB3      LEU  11  -7.320  -6.857   4.623
    5    HG   LEU  11           HG       LEU  11  -9.365  -8.854   5.627
    6   HD13  LEU  11          HD11      LEU  11  -8.166 -10.108   4.059
    7   HD12  LEU  11          HD12      LEU  11  -7.238 -10.372   5.534
    8   HD11  LEU  11          HD13      LEU  11  -6.672  -9.213   4.333
    9   HD22  LEU  11          HD21      LEU  11  -8.495  -7.867   7.549
   10   HD21  LEU  11          HD22      LEU  11  -6.948  -7.493   6.791
   11   HD23  LEU  11          HD23      LEU  11  -7.308  -9.145   7.292

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  12           H        ILE  12 -10.010  -5.528   2.843
    2    HA   ILE  12           HA       ILE  12  -8.273  -3.331   2.430
    3    HB   ILE  12           HB       ILE  12 -10.937  -3.946   1.126
    4   HG12  ILE  12          HG12      ILE  12  -8.935  -5.635   1.044
    5   HG13  ILE  12          HG13      ILE  12  -9.779  -5.248  -0.441
    6   HG21  ILE  12          HG21      ILE  12  -8.682  -2.075   0.334
    7   HG23  ILE  12          HG22      ILE  12 -10.352  -1.637   0.671
    8   HG22  ILE  12          HG23      ILE  12  -9.953  -2.579  -0.737
    9   HD13  ILE  12          HD11      ILE  12  -8.020  -3.711  -1.078
   10   HD12  ILE  12          HD12      ILE  12  -7.278  -5.245  -0.634
   11   HD11  ILE  12          HD13      ILE  12  -7.235  -3.898   0.479

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  13           H        ILE  13 -11.641  -3.537   3.516
    2    HA   ILE  13           HA       ILE  13 -12.047  -0.742   3.797
    3    HB   ILE  13           HB       ILE  13 -13.301  -3.150   5.134
    4   HG12  ILE  13          HG12      ILE  13 -13.518  -2.546   2.604
    5   HG13  ILE  13          HG13      ILE  13 -14.944  -3.014   3.504
    6   HG23  ILE  13          HG21      ILE  13 -13.706  -1.432   6.710
    7   HG22  ILE  13          HG22      ILE  13 -15.165  -1.455   5.728
    8   HG21  ILE  13          HG23      ILE  13 -13.945  -0.212   5.462
    9   HD11  ILE  13          HD11      ILE  13 -14.122  -0.125   3.133
   10   HD13  ILE  13          HD12      ILE  13 -15.638  -0.748   3.754
   11   HD12  ILE  13          HD13      ILE  13 -15.247  -0.968   2.063

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ASN  14           H        ASN  14 -10.988  -3.264   6.063
    2    HA   ASN  14           HA       ASN  14 -10.760  -1.640   8.356
    3    HB2  ASN  14           HB2      ASN  14 -10.557  -4.250   8.023
    4    HB3  ASN  14           HB3      ASN  14  -8.840  -3.895   7.871
    5   HD21  ASN  14          HD21      ASN  14  -9.510  -5.417  10.039
    6   HD22  ASN  14          HD22      ASN  14  -9.467  -4.504  11.467

  No H/Q in entry =           6
  In of MODEL   17
    1    H    SER  15           H        SER  15  -8.370  -2.498   5.865
    2    HA   SER  15           HA       SER  15  -6.201  -1.051   6.948
    3    HB2  SER  15           HB2      SER  15  -5.180  -1.275   4.790
    4    HB3  SER  15           HB3      SER  15  -6.162  -2.719   5.008
    5    HG   SER  15           HG       SER  15  -6.860  -2.054   3.104

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLY  16           H        GLY  16  -8.781  -0.126   4.700
    2    HA3  GLY  16           HA2      GLY  16  -7.873   2.501   4.161
    3    HA2  GLY  16           HA3      GLY  16  -9.534   1.937   3.994

  No H/Q in entry =           3
  In of MODEL   17
    1    H    GLN  17           H        GLN  17 -10.096   1.211   6.639
    2    HA   GLN  17           HA       GLN  17 -10.759   3.723   7.789
    3    HB2  GLN  17           HB2      GLN  17 -12.042   1.680   8.273
    4    HB3  GLN  17           HB3      GLN  17 -10.645   0.996   9.104
    5    HG2  GLN  17           HG2      GLN  17 -10.693   2.848  10.727
    6    HG3  GLN  17           HG3      GLN  17 -12.078   3.550   9.892
    7   HE21  GLN  17          HE21      GLN  17 -14.019   3.036  10.895
    8   HE22  GLN  17          HE22      GLN  17 -14.329   1.596  11.739

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ALA  18           H        ALA  18  -8.173   1.392   8.404
    2    HA   ALA  18           HA       ALA  18  -7.059   2.579  10.682
    3    HB2  ALA  18           HB1      ALA  18  -6.486   0.358   9.306
    4    HB3  ALA  18           HB2      ALA  18  -5.311   1.116  10.382
    5    HB1  ALA  18           HB3      ALA  18  -5.225   1.400   8.643

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ARG  19           H        ARG  19  -6.271   3.103   7.237
    2    HA   ARG  19           HA       ARG  19  -4.338   5.115   7.678
    3    HB2  ARG  19           HB2      ARG  19  -4.681   3.990   5.477
    4    HB3  ARG  19           HB3      ARG  19  -6.208   4.858   5.301
    5    HG2  ARG  19           HG2      ARG  19  -5.042   7.009   5.381
    6    HG3  ARG  19           HG3      ARG  19  -3.508   6.195   5.685
    7    HD2  ARG  19           HD2      ARG  19  -3.617   6.798   3.344
    8    HD3  ARG  19           HD3      ARG  19  -3.733   5.039   3.482
    9    HE   ARG  19           HE       ARG  19  -6.351   5.994   3.473
   10   HH21  ARG  19          HH11      ARG  19  -7.539   6.179   1.553
   11   HH22  ARG  19          HH12      ARG  19  -6.713   6.249   0.035
   12   HH11  ARG  19          HH21      ARG  19  -3.571   6.018   1.445
   13   HH12  ARG  19          HH22      ARG  19  -4.465   6.155  -0.026

  No H/Q in entry =          13
  In of MODEL   17
    1    H    SER  20           H        SER  20  -7.833   5.293   7.072
    2    HA   SER  20           HA       SER  20  -8.143   8.054   7.034
    3    HB2  SER  20           HB2      SER  20 -10.042   6.749   6.488
    4    HB3  SER  20           HB3      SER  20  -9.951   5.847   7.998
    5    HG   SER  20           HG       SER  20 -10.856   8.451   7.494

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU  21           H        LEU  21  -8.186   5.860   9.829
    2    HA   LEU  21           HA       LEU  21  -8.597   7.855  11.801
    3    HB2  LEU  21           HB2      LEU  21  -7.293   5.129  11.951
    4    HB3  LEU  21           HB3      LEU  21  -7.582   6.147  13.359
    5    HG   LEU  21           HG       LEU  21  -9.771   5.302  11.438
    6   HD13  LEU  21          HD11      LEU  21  -8.963   3.278  12.423
    7   HD12  LEU  21          HD12      LEU  21 -10.397   3.730  13.344
    8   HD11  LEU  21          HD13      LEU  21  -8.791   4.039  14.007
    9   HD22  LEU  21          HD21      LEU  21 -10.620   7.141  12.619
   10   HD21  LEU  21          HD22      LEU  21  -9.689   6.784  14.069
   11   HD23  LEU  21          HD23      LEU  21 -11.101   5.818  13.676

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ALA  22           H        ALA  22  -5.665   6.439  10.395
    2    HA   ALA  22           HA       ALA  22  -3.767   7.714  12.026
    3    HB2  ALA  22           HB1      ALA  22  -3.378   5.861  10.328
    4    HB1  ALA  22           HB2      ALA  22  -2.161   7.137  10.371
    5    HB3  ALA  22           HB3      ALA  22  -3.376   7.118   9.092

  No H/Q in entry =           5
  In of MODEL   17
    1    H    TYR  23           H        TYR  23  -5.060   8.766   8.845
    2    HA   TYR  23           HA       TYR  23  -3.683  11.240   8.788
    3    HB2  TYR  23           HB2      TYR  23  -4.773  10.355   6.790
    4    HB3  TYR  23           HB3      TYR  23  -6.352  10.483   7.567
    5    HD1  TYR  23           HD1      TYR  23  -3.414  12.487   6.436
    6    HD2  TYR  23           HD2      TYR  23  -7.560  12.512   7.552
    7    HE1  TYR  23           HE1      TYR  23  -3.601  14.843   5.685
    8    HE2  TYR  23           HE2      TYR  23  -7.749  14.869   6.801
    9    HH   TYR  23           HH       TYR  23  -4.910  16.693   5.750

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ALA  24           H        ALA  24  -6.821  10.308  10.156
    2    HA   ALA  24           HA       ALA  24  -7.617  12.908  10.936
    3    HB1  ALA  24           HB1      ALA  24  -9.457  11.685  11.394
    4    HB2  ALA  24           HB2      ALA  24  -8.644  11.094  12.841
    5    HB3  ALA  24           HB3      ALA  24  -8.530  10.187  11.334

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA  25           H        ALA  25  -5.659  10.411  12.504
    2    HA   ALA  25           HA       ALA  25  -5.307  11.648  15.012
    3    HB2  ALA  25           HB1      ALA  25  -4.577   9.287  14.184
    4    HB3  ALA  25           HB2      ALA  25  -3.550  10.123  15.350
    5    HB1  ALA  25           HB3      ALA  25  -3.111  10.106  13.642

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU  26           H        LEU  26  -3.504  11.930  11.978
    2    HA   LEU  26           HA       LEU  26  -1.518  13.713  12.906
    3    HB2  LEU  26           HB2      LEU  26  -1.231  12.565  10.798
    4    HB3  LEU  26           HB3      LEU  26  -2.691  13.300  10.143
    5    HG   LEU  26           HG       LEU  26  -1.639  15.533  10.290
    6   HD12  LEU  26          HD11      LEU  26   0.898  15.509  10.710
    7   HD11  LEU  26          HD12      LEU  26   0.647  13.929  11.447
    8   HD13  LEU  26          HD13      LEU  26  -0.139  15.355  12.128
    9   HD21  LEU  26          HD21      LEU  26   0.073  13.456   8.891
   10   HD23  LEU  26          HD22      LEU  26   0.059  15.179   8.527
   11   HD22  LEU  26          HD23      LEU  26  -1.380  14.206   8.231

  No H/Q in entry =          11
  In of MODEL   17
    1    H    LYS  27           H        LYS  27  -4.688  14.255  11.423
    2    HA   LYS  27           HA       LYS  27  -4.586  17.043  11.237
    3    HB2  LYS  27           HB2      LYS  27  -6.352  15.599  10.241
    4    HB3  LYS  27           HB3      LYS  27  -7.017  15.347  11.854
    5    HG2  LYS  27           HG2      LYS  27  -7.407  17.759  12.099
    6    HG3  LYS  27           HG3      LYS  27  -6.690  18.050  10.511
    7    HD2  LYS  27           HD2      LYS  27  -8.444  16.650   9.465
    8    HD3  LYS  27           HD3      LYS  27  -9.166  16.375  11.052
    9    HE2  LYS  27           HE2      LYS  27  -9.569  18.793  11.304
   10    HE3  LYS  27           HE3      LYS  27  -8.818  19.088   9.732
   11    HZ3  LYS  27           HZ1      LYS  27 -11.196  19.004   9.484
   12    HZ2  LYS  27           HZ2      LYS  27 -11.272  17.486  10.248
   13    HZ1  LYS  27           HZ3      LYS  27 -10.521  17.643   8.729

  No H/Q in entry =          13
  In of MODEL   17
    1    H    GLN  28           H        GLN  28  -5.517  14.961  13.953
    2    HA   GLN  28           HA       GLN  28  -6.382  16.972  15.735
    3    HB2  GLN  28           HB2      GLN  28  -5.021  14.320  16.277
    4    HB3  GLN  28           HB3      GLN  28  -5.762  15.329  17.520
    5    HG2  GLN  28           HG2      GLN  28  -7.208  14.221  15.097
    6    HG3  GLN  28           HG3      GLN  28  -7.301  13.545  16.723
    7   HE21  GLN  28          HE21      GLN  28  -9.123  15.348  14.717
    8   HE22  GLN  28          HE22      GLN  28  -9.871  16.392  15.827

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ALA  29           H        ALA  29  -3.184  15.623  15.048
    2    HA   ALA  29           HA       ALA  29  -1.726  16.987  17.035
    3    HB1  ALA  29           HB1      ALA  29   0.194  16.266  15.918
    4    HB3  ALA  29           HB2      ALA  29  -0.554  16.410  14.327
    5    HB2  ALA  29           HB3      ALA  29  -1.002  15.081  15.395

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LYS  30           H        LYS  30  -2.560  17.895  13.708
    2    HA   LYS  30           HA       LYS  30  -1.104  20.308  13.620
    3    HB2  LYS  30           HB2      LYS  30  -3.648  19.489  12.203
    4    HB3  LYS  30           HB3      LYS  30  -2.784  20.989  11.867
    5    HG2  LYS  30           HG2      LYS  30  -0.739  19.658  11.352
    6    HG3  LYS  30           HG3      LYS  30  -1.675  18.179  11.589
    7    HD2  LYS  30           HD2      LYS  30  -3.222  18.858   9.794
    8    HD3  LYS  30           HD3      LYS  30  -2.309  20.349   9.559
    9    HE2  LYS  30           HE2      LYS  30  -0.301  19.019   8.978
   10    HE3  LYS  30           HE3      LYS  30  -1.233  17.533   9.182
   11    HZ2  LYS  30           HZ1      LYS  30  -1.035  18.410   6.844
   12    HZ1  LYS  30           HZ2      LYS  30  -2.054  19.692   7.315
   13    HZ3  LYS  30           HZ3      LYS  30  -2.611  18.085   7.379

  No H/Q in entry =          13
  In of MODEL   17
    1    H    GLN  31           H        GLN  31  -4.224  19.513  15.023
    2    HA   GLN  31           HA       GLN  31  -4.932  22.282  15.485
    3    HB2  GLN  31           HB2      GLN  31  -6.164  19.855  16.795
    4    HB3  GLN  31           HB3      GLN  31  -6.890  21.443  16.555
    5    HG2  GLN  31           HG2      GLN  31  -6.191  20.663  13.963
    6    HG3  GLN  31           HG3      GLN  31  -6.748  19.166  14.702
    7   HE21  GLN  31          HE21      GLN  31  -8.121  20.778  12.605
    8   HE22  GLN  31          HE22      GLN  31  -9.628  21.198  13.262

  No H/Q in entry =           8
  In of MODEL   17
    1    H    GLY  32           H        GLY  32  -2.663  20.302  16.801
    2    HA3  GLY  32           HA2      GLY  32  -1.256  20.726  18.608
    3    HA2  GLY  32           HA3      GLY  32  -2.360  21.990  19.135

  No H/Q in entry =           3
  In of MODEL   17
    1    H    ASP  33           H        ASP  33  -3.845  18.984  18.457
    2    HA   ASP  33           HA       ASP  33  -4.270  18.522  21.334
    3    HB2  ASP  33           HB2      ASP  33  -5.693  17.552  18.849
    4    HB3  ASP  33           HB3      ASP  33  -6.054  16.942  20.462

  No H/Q in entry =           4
  In of MODEL   17
    1    H    PHE  34           H        PHE  34  -2.121  17.624  21.639
    2    HA   PHE  34           HA       PHE  34  -1.166  15.361  20.230
    3    HB2  PHE  34           HB2      PHE  34  -0.534  16.319  23.030
    4    HB3  PHE  34           HB3      PHE  34   0.371  15.081  22.159
    5    HD1  PHE  34           HD1      PHE  34   0.270  18.506  22.909
    6    HD2  PHE  34           HD2      PHE  34   1.048  15.801  19.663
    7    HE1  PHE  34           HE1      PHE  34   1.605  20.255  21.766
    8    HE2  PHE  34           HE2      PHE  34   2.378  17.553  18.525
    9    HZ   PHE  34           HZ       PHE  34   2.658  19.777  19.581

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ALA  35           H        ALA  35  -3.205  15.668  23.090
    2    HA   ALA  35           HA       ALA  35  -3.051  12.998  23.975
    3    HB3  ALA  35           HB1      ALA  35  -5.497  13.672  24.831
    4    HB1  ALA  35           HB2      ALA  35  -4.928  15.281  24.383
    5    HB2  ALA  35           HB3      ALA  35  -4.036  14.332  25.572

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA  36           H        ALA  36  -5.464  14.576  21.878
    2    HA   ALA  36           HA       ALA  36  -6.930  12.198  21.386
    3    HB1  ALA  36           HB1      ALA  36  -8.353  13.656  20.435
    4    HB3  ALA  36           HB2      ALA  36  -7.170  14.057  19.190
    5    HB2  ALA  36           HB3      ALA  36  -7.178  14.937  20.718

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA  37           H        ALA  37  -4.213  13.736  19.730
    2    HA   ALA  37           HA       ALA  37  -4.209  12.111  17.425
    3    HB3  ALA  37           HB1      ALA  37  -2.183  13.773  18.859
    4    HB2  ALA  37           HB2      ALA  37  -2.709  13.848  17.179
    5    HB1  ALA  37           HB3      ALA  37  -1.583  12.591  17.696

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LYS  38           H        LYS  38  -2.464  11.753  20.505
    2    HA   LYS  38           HA       LYS  38  -1.189   9.327  20.006
    3    HB2  LYS  38           HB2      LYS  38  -1.479  11.086  22.160
    4    HB3  LYS  38           HB3      LYS  38  -2.131   9.567  22.768
    5    HG2  LYS  38           HG2      LYS  38  -0.060   8.405  22.229
    6    HG3  LYS  38           HG3      LYS  38   0.580   9.841  21.424
    7    HD2  LYS  38           HD2      LYS  38   0.772  11.046  23.465
    8    HD3  LYS  38           HD3      LYS  38  -0.273   9.913  24.325
    9    HE2  LYS  38           HE2      LYS  38   2.074   9.544  24.946
   10    HE3  LYS  38           HE3      LYS  38   1.441   8.146  24.074
   11    HZ3  LYS  38           HZ1      LYS  38   2.753   8.545  22.297
   12    HZ2  LYS  38           HZ2      LYS  38   3.724   9.347  23.440
   13    HZ1  LYS  38           HZ3      LYS  38   2.665  10.235  22.451

  No H/Q in entry =          13
  In of MODEL   17
    1    H    ALA  39           H        ALA  39  -4.419   9.884  21.406
    2    HA   ALA  39           HA       ALA  39  -5.038   7.175  21.896
    3    HB3  ALA  39           HB1      ALA  39  -7.154   9.169  21.135
    4    HB2  ALA  39           HB2      ALA  39  -6.254   9.369  22.638
    5    HB1  ALA  39           HB3      ALA  39  -7.201   7.906  22.366

  No H/Q in entry =           5
  In of MODEL   17
    1    H    MET  40           H        MET  40  -5.575   9.214  19.058
    2    HA   MET  40           HA       MET  40  -7.089   7.321  17.586
    3    HB2  MET  40           HB2      MET  40  -5.427   9.686  16.696
    4    HB3  MET  40           HB3      MET  40  -6.471   8.754  15.619
    5    HG2  MET  40           HG2      MET  40  -7.484  10.012  18.181
    6    HG3  MET  40           HG3      MET  40  -7.521  10.855  16.635
    7    HE3  MET  40           HE1      MET  40 -10.134   9.300  14.558
    8    HE2  MET  40           HE2      MET  40  -8.379   9.381  14.414
    9    HE1  MET  40           HE3      MET  40  -9.269  10.763  15.052

  No H/Q in entry =           9
  In of MODEL   17
    1    H    MET  41           H        MET  41  -3.583   7.984  17.718
    2    HA   MET  41           HA       MET  41  -2.858   6.224  15.611
    3    HB2  MET  41           HB2      MET  41  -1.232   6.845  18.090
    4    HB3  MET  41           HB3      MET  41  -0.626   6.191  16.572
    5    HG2  MET  41           HG2      MET  41  -1.735   8.403  15.577
    6    HG3  MET  41           HG3      MET  41  -1.489   8.977  17.224
    7    HE2  MET  41           HE1      MET  41   1.384   6.817  17.581
    8    HE1  MET  41           HE2      MET  41   0.620   8.123  18.484
    9    HE3  MET  41           HE3      MET  41   2.250   8.336  17.845

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ASP  42           H        ASP  42  -3.259   5.742  19.094
    2    HA   ASP  42           HA       ASP  42  -2.277   3.127  19.243
    3    HB2  ASP  42           HB2      ASP  42  -3.118   4.895  21.072
    4    HB3  ASP  42           HB3      ASP  42  -4.566   3.900  20.992

  No H/Q in entry =           4
  In of MODEL   17
    1    H    GLN  43           H        GLN  43  -5.586   4.301  18.742
    2    HA   GLN  43           HA       GLN  43  -6.782   1.739  18.532
    3    HB2  GLN  43           HB2      GLN  43  -7.649   4.415  17.414
    4    HB3  GLN  43           HB3      GLN  43  -8.642   2.956  17.383
    5    HG2  GLN  43           HG2      GLN  43  -8.356   2.816  19.891
    6    HG3  GLN  43           HG3      GLN  43  -7.598   4.407  19.829
    7   HE21  GLN  43          HE21      GLN  43  -9.779   4.524  21.325
    8   HE22  GLN  43          HE22      GLN  43 -11.126   5.131  20.494

  No H/Q in entry =           8
  In of MODEL   17
    1    H    SER  44           H        SER  44  -5.392   3.937  16.134
    2    HA   SER  44           HA       SER  44  -6.119   2.478  13.836
    3    HB2  SER  44           HB2      SER  44  -4.815   4.833  14.294
    4    HB3  SER  44           HB3      SER  44  -3.480   3.813  13.761
    5    HG   SER  44           HG       SER  44  -4.569   4.816  12.001

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ARG  45           H        ARG  45  -3.248   2.296  15.921
    2    HA   ARG  45           HA       ARG  45  -1.806   0.319  14.532
    3    HB2  ARG  45           HB2      ARG  45  -0.939   1.713  16.410
    4    HB3  ARG  45           HB3      ARG  45  -1.952   0.798  17.524
    5    HG2  ARG  45           HG2      ARG  45  -0.761  -1.283  16.873
    6    HG3  ARG  45           HG3      ARG  45   0.276  -0.343  15.802
    7    HD2  ARG  45           HD2      ARG  45   1.035   1.013  17.766
    8    HD3  ARG  45           HD3      ARG  45   0.088  -0.048  18.832
    9    HE   ARG  45           HE       ARG  45   1.758  -1.671  17.247
   10   HH21  ARG  45          HH11      ARG  45   3.639  -2.536  18.084
   11   HH22  ARG  45          HH12      ARG  45   4.425  -1.773  19.421
   12   HH11  ARG  45          HH21      ARG  45   2.106   0.777  19.650
   13   HH12  ARG  45          HH22      ARG  45   3.557   0.106  20.305

  No H/Q in entry =          13
  In of MODEL   17
    1    H    MET  46           H        MET  46  -4.215   0.035  17.126
    2    HA   MET  46           HA       MET  46  -4.105  -2.769  17.419
    3    HB2  MET  46           HB2      MET  46  -6.229  -0.718  18.028
    4    HB3  MET  46           HB3      MET  46  -6.481  -2.435  18.352
    5    HG2  MET  46           HG2      MET  46  -4.499  -2.493  19.779
    6    HG3  MET  46           HG3      MET  46  -4.143  -0.814  19.402
    7    HE1  MET  46           HE1      MET  46  -6.393  -3.365  20.715
    8    HE3  MET  46           HE2      MET  46  -7.872  -2.454  20.433
    9    HE2  MET  46           HE3      MET  46  -7.279  -2.670  22.077

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ALA  47           H        ALA  47  -6.079  -0.700  15.330
    2    HA   ALA  47           HA       ALA  47  -7.736  -2.711  14.251
    3    HB3  ALA  47           HB1      ALA  47  -8.368  -0.458  13.845
    4    HB1  ALA  47           HB2      ALA  47  -7.889  -1.093  12.271
    5    HB2  ALA  47           HB3      ALA  47  -6.789  -0.052  13.176

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU  48           H        LEU  48  -4.588  -1.463  13.214
    2    HA   LEU  48           HA       LEU  48  -4.336  -3.047  10.865
    3    HB2  LEU  48           HB2      LEU  48  -2.256  -1.822  12.684
    4    HB3  LEU  48           HB3      LEU  48  -1.899  -2.543  11.114
    5    HG   LEU  48           HG       LEU  48  -3.875  -0.284  11.511
    6   HD13  LEU  48          HD11      LEU  48  -1.736   0.542  12.186
    7   HD12  LEU  48          HD12      LEU  48  -1.995   1.110  10.536
    8   HD11  LEU  48          HD13      LEU  48  -0.928  -0.261  10.840
    9   HD22  LEU  48          HD21      LEU  48  -4.363  -1.248   9.429
   10   HD21  LEU  48          HD22      LEU  48  -2.689  -1.718   9.135
   11   HD23  LEU  48          HD23      LEU  48  -3.171  -0.027   8.983

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ASN  49           H        ASN  49  -3.307  -3.484  14.211
    2    HA   ASN  49           HA       ASN  49  -1.754  -5.780  13.872
    3    HB2  ASN  49           HB2      ASN  49  -1.742  -4.469  15.927
    4    HB3  ASN  49           HB3      ASN  49  -3.420  -4.886  16.241
    5   HD21  ASN  49          HD21      ASN  49  -0.212  -6.427  15.806
    6   HD22  ASN  49          HD22      ASN  49  -0.522  -7.716  16.865

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLU  50           H        GLU  50  -5.217  -5.431  14.537
    2    HA   GLU  50           HA       GLU  50  -5.792  -8.219  14.630
    3    HB2  GLU  50           HB2      GLU  50  -7.342  -6.501  15.511
    4    HB3  GLU  50           HB3      GLU  50  -7.619  -5.922  13.867
    5    HG2  GLU  50           HG2      GLU  50  -8.531  -8.095  13.216
    6    HG3  GLU  50           HG3      GLU  50  -8.168  -8.755  14.806

  No H/Q in entry =           6
  In of MODEL   17
    1    H    ALA  51           H        ALA  51  -5.800  -5.806  12.047
    2    HA   ALA  51           HA       ALA  51  -6.819  -7.501  10.013
    3    HB3  ALA  51           HB1      ALA  51  -6.554  -5.687   8.654
    4    HB1  ALA  51           HB2      ALA  51  -4.909  -5.378   9.208
    5    HB2  ALA  51           HB3      ALA  51  -6.283  -4.840  10.176

  No H/Q in entry =           5
  In of MODEL   17
    1    H    HIS  52           H        HIS  52  -3.511  -6.675  11.010
    2    HA   HIS  52           HA       HIS  52  -2.142  -8.186   9.056
    3    HB2  HIS  52           HB2      HIS  52  -1.085  -6.478  10.523
    4    HB3  HIS  52           HB3      HIS  52  -1.259  -7.581  11.888
    5    HD1  HIS  52           HD1      HIS  52   0.198  -9.757  11.867
    6    HD2  HIS  52           HD2      HIS  52   0.990  -7.144   8.716
    7    HE1  HIS  52           HE1      HIS  52   2.375 -10.529  10.825
    8    HE2  HIS  52           HE2      HIS  52   2.870  -8.946   8.902

  No H/Q in entry =           8
  In of MODEL   17
    1    H    LEU  53           H        LEU  53  -3.382  -9.051  12.261
    2    HA   LEU  53           HA       LEU  53  -2.245 -11.624  12.444
    3    HB2  LEU  53           HB2      LEU  53  -4.704 -10.391  13.659
    4    HB3  LEU  53           HB3      LEU  53  -4.286 -12.078  13.942
    5    HG   LEU  53           HG       LEU  53  -2.325  -9.815  14.430
    6   HD11  LEU  53          HD11      LEU  53  -4.403 -11.039  16.250
    7   HD13  LEU  53          HD12      LEU  53  -4.110  -9.334  15.920
    8   HD12  LEU  53          HD13      LEU  53  -2.960 -10.254  16.882
    9   HD23  LEU  53          HD21      LEU  53  -1.506 -11.647  16.118
   10   HD22  LEU  53          HD22      LEU  53  -1.110 -11.831  14.413
   11   HD21  LEU  53          HD23      LEU  53  -2.423 -12.761  15.110

  No H/Q in entry =          11
  In of MODEL   17
    1    H    VAL  54           H        VAL  54  -5.327 -10.514  11.079
    2    HA   VAL  54           HA       VAL  54  -6.301 -13.082  10.376
    3    HB   VAL  54           HB       VAL  54  -6.879 -10.328   9.255
    4   HG12  VAL  54          HG11      VAL  54  -9.012 -11.651   8.430
    5   HG11  VAL  54          HG12      VAL  54  -7.933 -13.044   8.498
    6   HG13  VAL  54          HG13      VAL  54  -7.538 -11.672   7.464
    7   HG22  VAL  54          HG21      VAL  54  -7.792 -10.356  11.404
    8   HG21  VAL  54          HG22      VAL  54  -8.088 -12.092  11.374
    9   HG23  VAL  54          HG23      VAL  54  -9.141 -11.005  10.471

  No H/Q in entry =           9
  In of MODEL   17
    1    H    GLN  55           H        GLN  55  -4.366 -10.667   8.605
    2    HA   GLN  55           HA       GLN  55  -4.265 -12.121   6.180
    3    HB2  GLN  55           HB2      GLN  55  -3.606  -9.871   6.003
    4    HB3  GLN  55           HB3      GLN  55  -2.501  -9.982   7.371
    5    HG2  GLN  55           HG2      GLN  55  -0.802 -10.862   6.094
    6    HG3  GLN  55           HG3      GLN  55  -1.896 -11.806   5.092
    7   HE21  GLN  55          HE21      GLN  55  -1.891 -11.104   2.975
    8   HE22  GLN  55          HE22      GLN  55  -1.652  -9.503   2.474

  No H/Q in entry =           8
  In of MODEL   17
    1    H    THR  56           H        THR  56  -2.167 -12.167   9.066
    2    HA   THR  56           HA       THR  56  -0.126 -13.811   8.145
    3    HB   THR  56           HB       THR  56  -1.379 -14.052  10.888
    4    HG1  THR  56           HG1      THR  56  -0.261 -11.937   9.667
    5   HG22  THR  56          HG21      THR  56   1.135 -14.347  11.424
    6   HG21  THR  56          HG22      THR  56   1.325 -14.630   9.694
    7   HG23  THR  56          HG23      THR  56   0.297 -15.693  10.655

  No H/Q in entry =           7
  In of MODEL   17
    1    H    LYS  57           H        LYS  57  -3.274 -14.777   9.495
    2    HA   LYS  57           HA       LYS  57  -2.897 -17.582   9.235
    3    HB2  LYS  57           HB2      LYS  57  -4.692 -16.445  10.580
    4    HB3  LYS  57           HB3      LYS  57  -5.471 -15.983   9.074
    5    HG2  LYS  57           HG2      LYS  57  -5.775 -18.333   8.470
    6    HG3  LYS  57           HG3      LYS  57  -4.928 -18.840   9.929
    7    HD2  LYS  57           HD2      LYS  57  -7.250 -19.035  10.442
    8    HD3  LYS  57           HD3      LYS  57  -6.719 -17.555  11.242
    9    HE2  LYS  57           HE2      LYS  57  -7.677 -16.178   9.517
   10    HE3  LYS  57           HE3      LYS  57  -7.966 -17.563   8.468
   11    HZ3  LYS  57           HZ1      LYS  57  -9.560 -18.412  10.037
   12    HZ2  LYS  57           HZ2      LYS  57  -9.973 -16.819   9.613
   13    HZ1  LYS  57           HZ3      LYS  57  -9.241 -17.137  11.113

  No H/Q in entry =          13
  In of MODEL   17
    1    H    LEU  58           H        LEU  58  -4.162 -15.096   7.069
    2    HA   LEU  58           HA       LEU  58  -5.004 -16.890   5.051
    3    HB2  LEU  58           HB2      LEU  58  -4.324 -13.957   4.933
    4    HB3  LEU  58           HB3      LEU  58  -5.007 -14.870   3.586
    5    HG   LEU  58           HG       LEU  58  -6.289 -14.673   6.331
    6   HD11  LEU  58          HD11      LEU  58  -6.541 -13.006   3.848
    7   HD13  LEU  58          HD12      LEU  58  -6.523 -12.508   5.540
    8   HD12  LEU  58          HD13      LEU  58  -7.963 -13.262   4.860
    9   HD22  LEU  58          HD21      LEU  58  -7.296 -16.553   5.449
   10   HD21  LEU  58          HD22      LEU  58  -6.941 -16.101   3.782
   11   HD23  LEU  58          HD23      LEU  58  -8.288 -15.346   4.633

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  59           H        ILE  59  -1.841 -15.762   5.927
    2    HA   ILE  59           HA       ILE  59  -0.755 -16.503   3.289
    3    HB   ILE  59           HB       ILE  59   0.061 -14.464   4.866
    4   HG12  ILE  59          HG12      ILE  59   2.119 -16.166   3.445
    5   HG13  ILE  59          HG13      ILE  59   0.953 -15.198   2.584
    6   HG21  ILE  59          HG21      ILE  59   0.750 -16.253   6.630
    7   HG23  ILE  59          HG22      ILE  59   1.895 -14.982   6.264
    8   HG22  ILE  59          HG23      ILE  59   2.093 -16.586   5.561
    9   HD11  ILE  59          HD11      ILE  59   2.869 -14.123   4.650
   10   HD13  ILE  59          HD12      ILE  59   1.744 -13.165   3.689
   11   HD12  ILE  59          HD13      ILE  59   3.096 -13.987   2.909

  No H/Q in entry =          11
  In of MODEL   17
    1    H    GLU  60           H        GLU  60  -0.803 -17.626   6.651
    2    HA   GLU  60           HA       GLU  60   1.179 -19.653   6.382
    3    HB2  GLU  60           HB2      GLU  60   0.447 -18.876   8.576
    4    HB3  GLU  60           HB3      GLU  60  -1.187 -19.455   8.263
    5    HG2  GLU  60           HG2      GLU  60  -0.339 -21.771   8.103
    6    HG3  GLU  60           HG3      GLU  60   1.297 -21.191   8.411

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLY  61           H        GLY  61  -2.332 -19.661   5.886
    2    HA3  GLY  61           HA2      GLY  61  -2.151 -22.454   4.914
    3    HA2  GLY  61           HA3      GLY  61  -3.619 -21.684   5.507

  No H/Q in entry =           3
  In of MODEL   17
    1    H    ASP  62           H        ASP  62  -1.342 -20.155   3.316
    2    HA   ASP  62           HA       ASP  62  -3.417 -19.530   1.446
    3    HB2  ASP  62           HB2      ASP  62  -1.544 -18.507   0.160
    4    HB3  ASP  62           HB3      ASP  62  -1.612 -17.966   1.834

  No H/Q in entry =           4
  In of MODEL   17
    1    H    ALA  63           H        ALA  63  -4.213 -20.902  -0.061
    2    HA   ALA  63           HA       ALA  63  -2.335 -22.826  -1.334
    3    HB1  ALA  63           HB1      ALA  63  -3.987 -23.923   0.174
    4    HB3  ALA  63           HB2      ALA  63  -4.111 -24.426  -1.512
    5    HB2  ALA  63           HB3      ALA  63  -5.278 -23.283  -0.846

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLY  64           H        GLY  64  -5.184 -20.766  -1.650
    2    HA3  GLY  64           HA2      GLY  64  -6.058 -19.624  -3.441
    3    HA2  GLY  64           HA3      GLY  64  -4.562 -19.952  -4.300

  No H/Q in entry =           3
  In of MODEL   17
    1    H    GLU  65           H        GLU  65  -6.069 -20.153  -6.175
    2    HA   GLU  65           HA       GLU  65  -7.995 -22.208  -6.303
    3    HB2  GLU  65           HB2      GLU  65  -6.470 -20.782  -8.481
    4    HB3  GLU  65           HB3      GLU  65  -7.788 -21.914  -8.787
    5    HG2  GLU  65           HG2      GLU  65  -9.322 -20.541  -7.470
    6    HG3  GLU  65           HG3      GLU  65  -8.013 -19.438  -7.055

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLY  66           H        GLY  66  -4.604 -22.151  -7.054
    2    HA3  GLY  66           HA2      GLY  66  -4.555 -24.900  -8.018
    3    HA2  GLY  66           HA3      GLY  66  -3.218 -23.767  -8.022

  No H/Q in entry =           3
  In of MODEL   17
    1    H    LYS  67           H        LYS  67  -2.551 -26.167  -7.313
    2    HA   LYS  67           HA       LYS  67  -2.935 -26.931  -4.630
    3    HB2  LYS  67           HB2      LYS  67  -0.849 -27.700  -6.665
    4    HB3  LYS  67           HB3      LYS  67  -1.016 -28.479  -5.088
    5    HG2  LYS  67           HG2      LYS  67  -3.365 -29.028  -5.595
    6    HG3  LYS  67           HG3      LYS  67  -3.214 -28.244  -7.166
    7    HD2  LYS  67           HD2      LYS  67  -1.476 -29.871  -7.815
    8    HD3  LYS  67           HD3      LYS  67  -1.628 -30.657  -6.242
    9    HE2  LYS  67           HE2      LYS  67  -3.996 -31.156  -6.707
   10    HE3  LYS  67           HE3      LYS  67  -3.862 -30.356  -8.272
   11    HZ3  LYS  67           HZ1      LYS  67  -3.615 -32.695  -8.579
   12    HZ2  LYS  67           HZ2      LYS  67  -2.413 -32.788  -7.385
   13    HZ1  LYS  67           HZ3      LYS  67  -2.105 -31.972  -8.842

  No H/Q in entry =          13
  In of MODEL   17
    1    H    MET  68           H        MET  68   0.275 -26.326  -5.866
    2    HA   MET  68           HA       MET  68   1.392 -25.617  -3.377
    3    HB2  MET  68           HB2      MET  68   2.357 -25.404  -6.218
    4    HB3  MET  68           HB3      MET  68   3.349 -24.897  -4.849
    5    HG2  MET  68           HG2      MET  68   3.392 -27.086  -3.930
    6    HG3  MET  68           HG3      MET  68   2.061 -27.628  -4.955
    7    HE1  MET  68           HE1      MET  68   5.359 -25.783  -5.085
    8    HE3  MET  68           HE2      MET  68   4.690 -25.246  -6.625
    9    HE2  MET  68           HE3      MET  68   6.120 -26.275  -6.605

  No H/Q in entry =           9
  In of MODEL   17
    1    H    LYS  69           H        LYS  69   0.347 -23.585  -6.107
    2    HA   LYS  69           HA       LYS  69   1.452 -21.180  -5.310
    3    HB2  LYS  69           HB2      LYS  69  -0.199 -20.073  -6.709
    4    HB3  LYS  69           HB3      LYS  69   0.441 -21.520  -7.498
    5    HG2  LYS  69           HG2      LYS  69  -1.507 -22.810  -6.819
    6    HG3  LYS  69           HG3      LYS  69  -2.135 -21.439  -5.904
    7    HD2  LYS  69           HD2      LYS  69  -3.302 -21.488  -8.010
    8    HD3  LYS  69           HD3      LYS  69  -2.172 -20.133  -8.070
    9    HE2  LYS  69           HE2      LYS  69  -0.648 -21.315  -9.445
   10    HE3  LYS  69           HE3      LYS  69  -1.402 -22.866  -9.087
   11    HZ2  LYS  69           HZ1      LYS  69  -2.651 -20.649 -10.615
   12    HZ1  LYS  69           HZ2      LYS  69  -3.378 -22.143 -10.267
   13    HZ3  LYS  69           HZ3      LYS  69  -2.018 -22.074 -11.282

  No H/Q in entry =          13
  In of MODEL   17
    1    H    VAL  70           H        VAL  70  -0.382 -19.209  -5.086
    2    HA   VAL  70           HA       VAL  70  -1.809 -19.719  -2.540
    3    HB   VAL  70           HB       VAL  70  -1.076 -17.448  -1.800
    4   HG13  VAL  70          HG11      VAL  70   1.177 -18.108  -1.167
    5   HG12  VAL  70          HG12      VAL  70   1.238 -19.280  -2.485
    6   HG11  VAL  70          HG13      VAL  70   0.138 -19.532  -1.130
    7   HG21  VAL  70          HG21      VAL  70   0.636 -17.603  -4.314
    8   HG23  VAL  70          HG22      VAL  70   0.883 -16.430  -3.021
    9   HG22  VAL  70          HG23      VAL  70  -0.609 -16.402  -3.956

  No H/Q in entry =           9
  In of MODEL   17
    1    H    SER  71           H        SER  71  -3.454 -18.078  -2.086
    2    HA   SER  71           HA       SER  71  -5.208 -17.610  -4.257
    3    HB2  SER  71           HB2      SER  71  -5.947 -17.754  -1.872
    4    HB3  SER  71           HB3      SER  71  -5.141 -16.222  -1.551
    5    HG   SER  71           HG       SER  71  -7.430 -16.082  -2.058

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU  72           H        LEU  72  -5.488 -15.884  -5.567
    2    HA   LEU  72           HA       LEU  72  -3.336 -14.121  -6.035
    3    HB2  LEU  72           HB2      LEU  72  -6.200 -14.090  -6.985
    4    HB3  LEU  72           HB3      LEU  72  -4.966 -12.972  -7.558
    5    HG   LEU  72           HG       LEU  72  -4.661 -15.990  -7.694
    6   HD12  LEU  72          HD11      LEU  72  -5.187 -15.695 -10.123
    7   HD11  LEU  72          HD12      LEU  72  -5.635 -14.023  -9.786
    8   HD13  LEU  72          HD13      LEU  72  -6.561 -15.343  -9.074
    9   HD21  LEU  72          HD21      LEU  72  -3.111 -13.621  -8.725
   10   HD23  LEU  72          HD22      LEU  72  -3.049 -15.136  -9.610
   11   HD22  LEU  72          HD23      LEU  72  -2.506 -15.074  -7.936

  No H/Q in entry =          11
  In of MODEL   17
    1    H    VAL  73           H        VAL  73  -6.422 -13.699  -4.408
    2    HA   VAL  73           HA       VAL  73  -6.402 -10.929  -4.041
    3    HB   VAL  73           HB       VAL  73  -8.112 -11.265  -2.427
    4   HG11  VAL  73          HG11      VAL  73  -8.479 -12.003  -4.864
    5   HG13  VAL  73          HG12      VAL  73  -9.634 -12.591  -3.669
    6   HG12  VAL  73          HG13      VAL  73  -8.356 -13.655  -4.257
    7   HG22  VAL  73          HG21      VAL  73  -7.332 -12.795  -0.857
    8   HG21  VAL  73          HG22      VAL  73  -6.760 -13.921  -2.088
    9   HG23  VAL  73          HG23      VAL  73  -8.485 -13.795  -1.741

  No H/Q in entry =           9
  In of MODEL   17
    1    H    LEU  74           H        LEU  74  -4.524 -13.352  -2.468
    2    HA   LEU  74           HA       LEU  74  -4.090 -12.236   0.062
    3    HB2  LEU  74           HB2      LEU  74  -3.359 -14.470  -0.448
    4    HB3  LEU  74           HB3      LEU  74  -2.290 -13.876  -1.718
    5    HG   LEU  74           HG       LEU  74  -0.948 -12.672  -0.033
    6   HD11  LEU  74          HD11      LEU  74  -3.062 -13.792   1.812
    7   HD13  LEU  74          HD12      LEU  74  -2.496 -12.125   1.684
    8   HD12  LEU  74          HD13      LEU  74  -1.460 -13.357   2.407
    9   HD23  LEU  74          HD21      LEU  74  -1.254 -15.418   1.070
   10   HD22  LEU  74          HD22      LEU  74   0.184 -14.540   0.600
   11   HD21  LEU  74          HD23      LEU  74  -0.832 -15.248  -0.633

  No H/Q in entry =          11
  In of MODEL   17
    1    H    VAL  75           H        VAL  75  -2.185 -11.871  -2.890
    2    HA   VAL  75           HA       VAL  75  -0.344  -9.996  -1.865
    3    HB   VAL  75           HB       VAL  75  -1.307 -10.427  -4.695
    4   HG12  VAL  75          HG11      VAL  75   0.817  -9.192  -5.287
    5   HG11  VAL  75          HG12      VAL  75   1.007  -8.802  -3.584
    6   HG13  VAL  75          HG13      VAL  75  -0.368  -8.173  -4.477
    7   HG22  VAL  75          HG21      VAL  75   0.739 -11.721  -4.912
    8   HG21  VAL  75          HG22      VAL  75  -0.144 -12.325  -3.509
    9   HG23  VAL  75          HG23      VAL  75   1.251 -11.267  -3.286

  No H/Q in entry =           9
  In of MODEL   17
    1    H    GLU  76           H        GLU  76  -3.483  -9.564  -3.526
    2    HA   GLU  76           HA       GLU  76  -3.467  -6.748  -3.611
    3    HB2  GLU  76           HB2      GLU  76  -5.157  -8.138  -4.785
    4    HB3  GLU  76           HB3      GLU  76  -5.824  -8.633  -3.236
    5    HG2  GLU  76           HG2      GLU  76  -7.237  -6.880  -4.104
    6    HG3  GLU  76           HG3      GLU  76  -6.342  -6.198  -2.761

  No H/Q in entry =           6
  In of MODEL   17
    1    H    ALA  77           H        ALA  77  -4.635  -8.964  -1.086
    2    HA   ALA  77           HA       ALA  77  -5.546  -6.950   0.683
    3    HB3  ALA  77           HB1      ALA  77  -5.417  -8.709   2.418
    4    HB1  ALA  77           HB2      ALA  77  -4.529  -9.738   1.293
    5    HB2  ALA  77           HB3      ALA  77  -6.200  -9.292   0.949

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLN  78           H        GLN  78  -2.436  -8.573   0.314
    2    HA   GLN  78           HA       GLN  78  -1.154  -7.457   2.573
    3    HB2  GLN  78           HB2      GLN  78  -0.338  -9.410   1.207
    4    HB3  GLN  78           HB3      GLN  78   0.128  -8.267  -0.050
    5    HG2  GLN  78           HG2      GLN  78   1.618  -7.121   1.534
    6    HG3  GLN  78           HG3      GLN  78   1.148  -8.248   2.804
    7   HE21  GLN  78          HE21      GLN  78   3.879  -8.053   1.975
    8   HE22  GLN  78          HE22      GLN  78   4.304  -9.495   1.188

  No H/Q in entry =           8
  In of MODEL   17
    1    H    LEU  79           H        LEU  79  -1.489  -6.367  -0.768
    2    HA   LEU  79           HA       LEU  79   0.251  -4.183  -0.739
    3    HB2  LEU  79           HB2      LEU  79  -0.792  -4.952  -2.799
    4    HB3  LEU  79           HB3      LEU  79  -2.386  -4.524  -2.190
    5    HG   LEU  79           HG       LEU  79  -1.783  -2.151  -2.150
    6   HD13  LEU  79          HD11      LEU  79   0.461  -1.966  -1.632
    7   HD12  LEU  79          HD12      LEU  79   0.520  -1.670  -3.369
    8   HD11  LEU  79          HD13      LEU  79   0.934  -3.262  -2.732
    9   HD23  LEU  79          HD21      LEU  79  -1.140  -1.953  -4.700
   10   HD22  LEU  79          HD22      LEU  79  -2.686  -2.666  -4.247
   11   HD21  LEU  79          HD23      LEU  79  -1.338  -3.705  -4.696

  No H/Q in entry =          11
  In of MODEL   17
    1    H    HIS  80           H        HIS  80  -3.220  -4.263   0.082
    2    HA   HIS  80           HA       HIS  80  -3.343  -1.507   0.761
    3    HB2  HIS  80           HB2      HIS  80  -5.105  -3.874   1.063
    4    HB3  HIS  80           HB3      HIS  80  -5.394  -2.533   2.175
    5    HD1  HIS  80           HD1      HIS  80  -6.968  -0.851   1.275
    6    HD2  HIS  80           HD2      HIS  80  -4.817  -2.700  -1.781
    7    HE1  HIS  80           HE1      HIS  80  -7.779   0.180  -0.900
    8    HE2  HIS  80           HE2      HIS  80  -6.474  -0.941  -2.771

  No H/Q in entry =           8
  In of MODEL   17
    1    H    LEU  81           H        LEU  81  -2.931  -4.425   2.738
    2    HA   LEU  81           HA       LEU  81  -2.888  -3.093   5.230
    3    HB2  LEU  81           HB2      LEU  81  -1.735  -5.735   4.337
    4    HB3  LEU  81           HB3      LEU  81  -1.698  -5.187   6.014
    5    HG   LEU  81           HG       LEU  81  -4.246  -5.365   4.381
    6   HD12  LEU  81          HD11      LEU  81  -4.604  -7.431   5.915
    7   HD11  LEU  81          HD12      LEU  81  -2.851  -7.406   6.104
    8   HD13  LEU  81          HD13      LEU  81  -3.563  -7.609   4.503
    9   HD23  LEU  81          HD21      LEU  81  -5.098  -5.561   6.879
   10   HD22  LEU  81          HD22      LEU  81  -4.732  -3.977   6.199
   11   HD21  LEU  81          HD23      LEU  81  -3.567  -4.773   7.257

  No H/Q in entry =          11
  In of MODEL   17
    1    H    MET  82           H        MET  82  -0.228  -4.052   3.058
    2    HA   MET  82           HA       MET  82   1.875  -3.222   4.750
    3    HB2  MET  82           HB2      MET  82   1.656  -3.540   1.755
    4    HB3  MET  82           HB3      MET  82   3.151  -3.012   2.524
    5    HG2  MET  82           HG2      MET  82   1.677  -5.569   3.231
    6    HG3  MET  82           HG3      MET  82   3.052  -5.488   2.134
    7    HE3  MET  82           HE1      MET  82   6.083  -4.842   4.126
    8    HE2  MET  82           HE2      MET  82   5.196  -3.448   3.514
    9    HE1  MET  82           HE3      MET  82   5.248  -4.934   2.570

  No H/Q in entry =           9
  In of MODEL   17
    1    H    THR  83           H        THR  83   0.100  -1.518   2.200
    2    HA   THR  83           HA       THR  83   1.575   0.892   2.303
    3    HB   THR  83           HB       THR  83  -0.575   1.879   1.320
    4    HG1  THR  83           HG1      THR  83  -2.258   0.626   1.203
    5   HG22  THR  83          HG21      THR  83  -0.349   0.066  -0.691
    6   HG21  THR  83          HG22      THR  83   1.142  -0.270   0.186
    7   HG23  THR  83          HG23      THR  83   0.824   1.356  -0.420

  No H/Q in entry =           7
  In of MODEL   17
    1    H    SER  84           H        SER  84  -1.459  -0.071   3.894
    2    HA   SER  84           HA       SER  84  -1.894   2.363   5.252
    3    HB2  SER  84           HB2      SER  84  -2.801  -0.455   5.799
    4    HB3  SER  84           HB3      SER  84  -3.261   0.892   6.839
    5    HG   SER  84           HG       SER  84  -3.724   0.607   4.045

  No H/Q in entry =           5
  In of MODEL   17
    1    H    MET  85           H        MET  85  -0.263  -0.619   6.367
    2    HA   MET  85           HA       MET  85   0.277   0.278   8.977
    3    HB2  MET  85           HB2      MET  85   0.508  -2.068   8.291
    4    HB3  MET  85           HB3      MET  85   1.899  -1.637   7.295
    5    HG2  MET  85           HG2      MET  85   3.111  -0.856   9.286
    6    HG3  MET  85           HG3      MET  85   1.710  -1.219  10.294
    7    HE1  MET  85           HE1      MET  85   4.182  -2.300   7.840
    8    HE3  MET  85           HE2      MET  85   3.297  -3.717   7.280
    9    HE2  MET  85           HE3      MET  85   4.718  -3.919   8.299

  No H/Q in entry =           9
  In of MODEL   17
    1    H    LEU  86           H        LEU  86   2.222   0.500   6.030
    2    HA   LEU  86           HA       LEU  86   4.469   1.744   7.196
    3    HB2  LEU  86           HB2      LEU  86   4.252   0.681   4.881
    4    HB3  LEU  86           HB3      LEU  86   3.484   2.186   4.376
    5    HG   LEU  86           HG       LEU  86   5.543   3.372   5.366
    6   HD11  LEU  86          HD11      LEU  86   6.178   0.738   6.151
    7   HD13  LEU  86          HD12      LEU  86   7.219   2.155   6.258
    8   HD12  LEU  86          HD13      LEU  86   7.302   1.112   4.841
    9   HD23  LEU  86          HD21      LEU  86   6.216   1.604   3.006
   10   HD22  LEU  86          HD22      LEU  86   6.654   3.289   3.278
   11   HD21  LEU  86          HD23      LEU  86   4.990   2.867   2.875

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ALA  87           H        ALA  87   1.593   3.074   5.615
    2    HA   ALA  87           HA       ALA  87   2.260   5.787   5.715
    3    HB1  ALA  87           HB1      ALA  87  -0.092   4.224   5.162
    4    HB3  ALA  87           HB2      ALA  87   0.264   5.879   4.671
    5    HB2  ALA  87           HB3      ALA  87  -0.540   5.570   6.212

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ARG  88           H        ARG  88   0.513   3.817   8.092
    2    HA   ARG  88           HA       ARG  88   0.054   5.870   9.949
    3    HB2  ARG  88           HB2      ARG  88  -0.947   3.543  10.001
    4    HB3  ARG  88           HB3      ARG  88   0.579   2.998  10.706
    5    HG2  ARG  88           HG2      ARG  88   0.156   5.075  12.337
    6    HG3  ARG  88           HG3      ARG  88  -1.518   4.797  11.877
    7    HD2  ARG  88           HD2      ARG  88  -1.677   2.944  13.113
    8    HD3  ARG  88           HD3      ARG  88  -0.102   2.323  12.581
    9    HE   ARG  88           HE       ARG  88  -0.606   3.587  15.041
   10   HH21  ARG  88          HH11      ARG  88   0.977   4.550  16.287
   11   HH22  ARG  88          HH12      ARG  88   2.508   4.940  15.587
   12   HH11  ARG  88          HH21      ARG  88   1.682   3.722  12.468
   13   HH12  ARG  88          HH22      ARG  88   2.915   4.455  13.437

  No H/Q in entry =          13
  In of MODEL   17
    1    H    GLU  89           H        GLU  89   2.791   3.578   9.717
    2    HA   GLU  89           HA       GLU  89   4.072   4.420  12.068
    3    HB2  GLU  89           HB2      GLU  89   4.679   2.393  10.713
    4    HB3  GLU  89           HB3      GLU  89   5.485   3.472   9.574
    5    HG2  GLU  89           HG2      GLU  89   6.990   4.270  11.324
    6    HG3  GLU  89           HG3      GLU  89   6.128   3.329  12.538

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LEU  90           H        LEU  90   4.424   5.588   8.747
    2    HA   LEU  90           HA       LEU  90   6.406   7.534   9.345
    3    HB2  LEU  90           HB2      LEU  90   4.395   7.267   7.114
    4    HB3  LEU  90           HB3      LEU  90   5.658   8.505   7.143
    5    HG   LEU  90           HG       LEU  90   6.254   5.550   7.462
    6   HD12  LEU  90          HD11      LEU  90   7.012   5.777   5.025
    7   HD11  LEU  90          HD12      LEU  90   6.035   7.244   4.983
    8   HD13  LEU  90          HD13      LEU  90   5.274   5.689   5.316
    9   HD22  LEU  90          HD21      LEU  90   8.180   6.646   8.153
   10   HD21  LEU  90          HD22      LEU  90   7.868   8.065   7.153
   11   HD23  LEU  90          HD23      LEU  90   8.491   6.588   6.419

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  91           H        ILE  91   2.868   7.642   9.192
    2    HA   ILE  91           HA       ILE  91   2.597  10.420   9.658
    3    HB   ILE  91           HB       ILE  91   0.745   8.088  10.185
    4   HG12  ILE  91          HG12      ILE  91   0.558  10.386   8.212
    5   HG13  ILE  91          HG13      ILE  91   1.380   8.872   7.833
    6   HG22  ILE  91          HG21      ILE  91  -0.934  10.190  10.257
    7   HG21  ILE  91          HG22      ILE  91   0.487  10.980  10.936
    8   HG23  ILE  91          HG23      ILE  91  -0.188   9.555  11.724
    9   HD13  ILE  91          HD11      ILE  91  -0.597   7.634   7.868
   10   HD12  ILE  91          HD12      ILE  91  -1.146   9.168   7.193
   11   HD11  ILE  91          HD13      ILE  91  -1.429   8.801   8.896

  No H/Q in entry =          11
  In of MODEL   17
    1    H    THR  92           H        THR  92   2.927   7.657  11.844
    2    HA   THR  92           HA       THR  92   2.515   9.028  14.275
    3    HB   THR  92           HB       THR  92   4.265   6.652  13.600
    4    HG1  THR  92           HG1      THR  92   2.278   5.946  13.493
    5   HG22  THR  92          HG21      THR  92   3.870   6.364  16.232
    6   HG21  THR  92          HG22      THR  92   3.850   8.125  16.168
    7   HG23  THR  92          HG23      THR  92   5.262   7.236  15.593

  No H/Q in entry =           7
  In of MODEL   17
    1    H    GLU  93           H        GLU  93   5.457   8.516  12.343
    2    HA   GLU  93           HA       GLU  93   7.243   9.890  14.051
    3    HB2  GLU  93           HB2      GLU  93   7.328   9.589  11.034
    4    HB3  GLU  93           HB3      GLU  93   8.680  10.080  12.053
    5    HG2  GLU  93           HG2      GLU  93   7.205   7.477  12.485
    6    HG3  GLU  93           HG3      GLU  93   8.593   7.600  11.412

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LEU  94           H        LEU  94   5.224  10.969  11.340
    2    HA   LEU  94           HA       LEU  94   6.096  13.653  11.255
    3    HB2  LEU  94           HB2      LEU  94   3.474  12.356  10.490
    4    HB3  LEU  94           HB3      LEU  94   3.775  14.078  10.258
    5    HG   LEU  94           HG       LEU  94   5.745  12.046   9.201
    6   HD11  LEU  94          HD11      LEU  94   3.019  12.669   8.137
    7   HD13  LEU  94          HD12      LEU  94   3.967  11.190   8.005
    8   HD12  LEU  94          HD13      LEU  94   4.337  12.567   6.968
    9   HD23  LEU  94          HD21      LEU  94   6.043  13.885   7.488
   10   HD22  LEU  94          HD22      LEU  94   6.467  14.359   9.133
   11   HD21  LEU  94          HD23      LEU  94   4.929  14.868   8.434

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  95           H        ILE  95   3.516  12.089  13.134
    2    HA   ILE  95           HA       ILE  95   2.528  14.457  14.339
    3    HB   ILE  95           HB       ILE  95   2.474  11.571  15.249
    4   HG12  ILE  95          HG12      ILE  95   0.299  13.402  14.205
    5   HG13  ILE  95          HG13      ILE  95   1.232  12.326  13.169
    6   HG21  ILE  95          HG21      ILE  95   1.250  14.067  16.461
    7   HG23  ILE  95          HG22      ILE  95   2.268  12.869  17.261
    8   HG22  ILE  95          HG23      ILE  95   0.623  12.450  16.781
    9   HD13  ILE  95          HD11      ILE  95   0.281  10.405  14.077
   10   HD12  ILE  95          HD12      ILE  95  -1.075  11.526  14.156
   11   HD11  ILE  95          HD13      ILE  95  -0.120  11.198  15.601

  No H/Q in entry =          11
  In of MODEL   17
    1    H    GLU  96           H        GLU  96   5.068  12.172  15.328
    2    HA   GLU  96           HA       GLU  96   5.646  13.344  17.827
    3    HB2  GLU  96           HB2      GLU  96   6.544  11.166  17.170
    4    HB3  GLU  96           HB3      GLU  96   7.498  11.924  15.896
    5    HG2  GLU  96           HG2      GLU  96   9.156  12.426  17.364
    6    HG3  GLU  96           HG3      GLU  96   8.027  13.261  18.421

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LEU  97           H        LEU  97   6.745  14.107  14.547
    2    HA   LEU  97           HA       LEU  97   8.676  16.055  15.272
    3    HB2  LEU  97           HB2      LEU  97   7.077  15.556  12.771
    4    HB3  LEU  97           HB3      LEU  97   8.129  16.963  12.902
    5    HG   LEU  97           HG       LEU  97   9.092  14.139  13.450
    6   HD12  LEU  97          HD11      LEU  97  10.097  14.322  11.135
    7   HD11  LEU  97          HD12      LEU  97   9.079  15.737  10.877
    8   HD13  LEU  97          HD13      LEU  97   8.342  14.161  11.162
    9   HD23  LEU  97          HD21      LEU  97  11.291  15.371  12.717
   10   HD22  LEU  97          HD22      LEU  97  10.676  15.647  14.347
   11   HD21  LEU  97          HD23      LEU  97  10.391  16.843  13.084

  No H/Q in entry =          11
  In of MODEL   17
    1    H    HIS  98           H        HIS  98   5.190  16.274  14.612
    2    HA   HIS  98           HA       HIS  98   4.955  19.079  14.761
    3    HB2  HIS  98           HB2      HIS  98   3.012  16.869  15.472
    4    HB3  HIS  98           HB3      HIS  98   2.584  18.580  15.535
    5    HD1  HIS  98           HD1      HIS  98   3.548  15.854  13.119
    6    HD2  HIS  98           HD2      HIS  98   2.262  19.819  13.014
    7    HE1  HIS  98           HE1      HIS  98   3.005  16.368  10.696
    8    HE2  HIS  98           HE2      HIS  98   2.225  18.776  10.611

  No H/Q in entry =           8
  In of MODEL   17
    1    H    GLU  99           H        GLU  99   5.026  16.576  17.247
    2    HA   GLU  99           HA       GLU  99   4.452  18.273  19.453
    3    HB2  GLU  99           HB2      GLU  99   4.307  15.793  19.537
    4    HB3  GLU  99           HB3      GLU  99   6.065  15.708  19.432
    5    HG2  GLU  99           HG2      GLU  99   6.279  16.985  21.513
    6    HG3  GLU  99           HG3      GLU  99   4.530  17.166  21.606

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LYS 100           H        LYS 100   7.487  17.280  17.889
    2    HA   LYS 100           HA       LYS 100   9.170  18.633  19.756
    3    HB2  LYS 100           HB2      LYS 100   9.653  17.712  16.913
    4    HB3  LYS 100           HB3      LYS 100  10.898  18.448  17.928
    5    HG2  LYS 100           HG2      LYS 100  10.479  16.698  19.659
    6    HG3  LYS 100           HG3      LYS 100   9.331  15.926  18.562
    7    HD2  LYS 100           HD2      LYS 100  11.121  15.611  16.896
    8    HD3  LYS 100           HD3      LYS 100  12.274  16.395  17.979
    9    HE2  LYS 100           HE2      LYS 100  11.835  14.640  19.687
   10    HE3  LYS 100           HE3      LYS 100  10.743  13.835  18.556
   11    HZ1  LYS 100           HZ1      LYS 100  13.579  14.443  17.909
   12    HZ3  LYS 100           HZ2      LYS 100  12.513  13.416  17.073
   13    HZ2  LYS 100           HZ3      LYS 100  13.089  12.976  18.611

  No H/Q in entry =          13
  In of MODEL   17
    1    H    LEU 101           H        LEU 101   7.504  19.614  16.802
    2    HA   LEU 101           HA       LEU 101   8.777  22.144  16.482
    3    HB2  LEU 101           HB2      LEU 101   6.156  20.975  15.584
    4    HB3  LEU 101           HB3      LEU 101   6.447  22.701  15.387
    5    HG   LEU 101           HG       LEU 101   8.438  20.643  14.414
    6   HD12  LEU 101          HD11      LEU 101   7.301  21.187  12.130
    7   HD11  LEU 101          HD12      LEU 101   5.910  21.644  13.110
    8   HD13  LEU 101          HD13      LEU 101   6.536  19.998  13.184
    9   HD21  LEU 101          HD21      LEU 101   7.878  23.572  13.872
   10   HD23  LEU 101          HD22      LEU 101   8.839  22.595  12.762
   11   HD22  LEU 101          HD23      LEU 101   9.383  22.832  14.423

  No H/Q in entry =          11
  In of MODEL   17
    1    H    LYS 102           H        LYS 102   7.209  21.028  19.089
    2    HA   LYS 102           HA       LYS 102   6.598  22.124  21.026
    3    HB2  LYS 102           HB2      LYS 102   7.929  24.090  19.914
    4    HB3  LYS 102           HB3      LYS 102   6.345  24.734  19.539
    5    HG2  LYS 102           HG2      LYS 102   7.711  24.432  22.192
    6    HG3  LYS 102           HG3      LYS 102   6.790  25.786  21.568
    7    HD2  LYS 102           HD2      LYS 102   5.484  23.174  22.431
    8    HD3  LYS 102           HD3      LYS 102   5.762  24.524  23.522
    9    HE2  LYS 102           HE2      LYS 102   3.477  24.182  22.027
   10    HE3  LYS 102           HE3      LYS 102   4.014  25.712  22.718
   11    HZ2  LYS 102           HZ1      LYS 102   3.491  25.844  20.338
   12    HZ1  LYS 102           HZ2      LYS 102   4.727  24.735  20.012
   13    HZ3  LYS 102           HZ3      LYS 102   5.105  26.254  20.663

  No H/Q in entry =          13
  In of MODEL   17
    1    H    ALA 103           H        ALA 103   5.002  23.719  18.264
    2    HA   ALA 103           HA       ALA 103   2.560  24.348  19.148
    3    HB1  ALA 103           HB1      ALA 103   1.646  23.539  16.899
    4    HB2  ALA 103           HB2      ALA 103   3.281  22.966  16.569
    5    HB3  ALA 103           HB3      ALA 103   2.986  24.684  16.844

  No H/Q in entry =           5
  In of MODEL   17
    1    H1   ALA   1           H3       ALA   1  10.166 -20.207  -6.347
    2    H2   ALA   1           H2       ALA   1   9.199 -20.383  -7.736
    3    H3   ALA   1           H1       ALA   1   8.742 -21.126  -6.277
    4    HA   ALA   1           HA       ALA   1   9.739 -22.956  -7.025
    5    HB1  ALA   1           HB1      ALA   1   9.847 -22.587  -9.298
    6    HB2  ALA   1           HB2      ALA   1  11.577 -22.479  -8.966
    7    HB3  ALA   1           HB3      ALA   1  10.614 -21.008  -9.110

  No H/Q in entry =           7
  In of MODEL   17
    1    H    GLU   2           H        GLU   2  12.000 -23.960  -7.084
    2    HA   GLU   2           HA       GLU   2  13.379 -23.924  -4.870
    3    HB2  GLU   2           HB2      GLU   2  14.742 -23.810  -7.566
    4    HB3  GLU   2           HB3      GLU   2  15.453 -24.447  -6.083
    5    HG2  GLU   2           HG2      GLU   2  14.388 -26.437  -6.336
    6    HG3  GLU   2           HG3      GLU   2  12.836 -25.653  -6.594

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLU   3           H        GLU   3  15.198 -22.090  -7.259
    2    HA   GLU   3           HA       GLU   3  16.389 -20.441  -5.288
    3    HB2  GLU   3           HB2      GLU   3  16.338 -20.422  -8.298
    4    HB3  GLU   3           HB3      GLU   3  17.114 -19.116  -7.403
    5    HG2  GLU   3           HG2      GLU   3  18.741 -20.535  -6.485
    6    HG3  GLU   3           HG3      GLU   3  17.760 -21.977  -6.715

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LEU   4           H        LEU   4  14.132 -19.524  -7.918
    2    HA   LEU   4           HA       LEU   4  13.728 -16.908  -7.293
    3    HB2  LEU   4           HB2      LEU   4  11.507 -18.826  -8.037
    4    HB3  LEU   4           HB3      LEU   4  11.475 -17.074  -8.226
    5    HG   LEU   4           HG       LEU   4  13.395 -18.977  -9.606
    6   HD13  LEU   4          HD11      LEU   4  12.101 -18.787 -11.517
    7   HD12  LEU   4          HD12      LEU   4  11.430 -17.228 -11.043
    8   HD11  LEU   4          HD13      LEU   4  10.839 -18.708 -10.290
    9   HD23  LEU   4          HD21      LEU   4  13.788 -16.734 -10.945
   10   HD22  LEU   4          HD22      LEU   4  14.640 -17.005  -9.426
   11   HD21  LEU   4          HD23      LEU   4  13.212 -15.974  -9.462

  No H/Q in entry =          11
  In of MODEL   17
    1    H    GLU   5           H        GLU   5  12.174 -19.664  -5.668
    2    HA   GLU   5           HA       GLU   5  10.532 -18.062  -3.959
    3    HB2  GLU   5           HB2      GLU   5  10.050 -20.426  -4.493
    4    HB3  GLU   5           HB3      GLU   5  11.472 -20.902  -3.563
    5    HG2  GLU   5           HG2      GLU   5  10.533 -19.894  -1.546
    6    HG3  GLU   5           HG3      GLU   5   9.139 -19.320  -2.458

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLU   6           H        GLU   6  13.639 -19.719  -3.520
    2    HA   GLU   6           HA       GLU   6  14.008 -18.886  -0.817
    3    HB2  GLU   6           HB2      GLU   6  15.953 -19.853  -2.926
    4    HB3  GLU   6           HB3      GLU   6  16.399 -19.541  -1.247
    5    HG2  GLU   6           HG2      GLU   6  14.219 -21.460  -2.113
    6    HG3  GLU   6           HG3      GLU   6  15.856 -21.942  -1.671

  No H/Q in entry =           6
  In of MODEL   17
    1    H    VAL   7           H        VAL   7  14.810 -17.561  -3.958
    2    HA   VAL   7           HA       VAL   7  16.545 -15.480  -3.080
    3    HB   VAL   7           HB       VAL   7  14.835 -15.790  -5.561
    4   HG11  VAL   7          HG11      VAL   7  16.779 -13.627  -4.735
    5   HG13  VAL   7          HG12      VAL   7  15.142 -13.442  -5.360
    6   HG12  VAL   7          HG13      VAL   7  16.440 -13.970  -6.431
    7   HG21  VAL   7          HG21      VAL   7  16.906 -17.299  -4.998
    8   HG23  VAL   7          HG22      VAL   7  17.846 -15.858  -5.387
    9   HG22  VAL   7          HG23      VAL   7  16.794 -16.577  -6.603

  No H/Q in entry =           9
  In of MODEL   17
    1    H    VAL   8           H        VAL   8  13.048 -15.664  -3.643
    2    HA   VAL   8           HA       VAL   8  12.446 -12.943  -3.158
    3    HB   VAL   8           HB       VAL   8  10.777 -15.438  -2.745
    4   HG12  VAL   8          HG11      VAL   8   8.856 -13.785  -2.804
    5   HG11  VAL   8          HG12      VAL   8  10.046 -12.498  -2.613
    6   HG13  VAL   8          HG13      VAL   8   9.848 -13.709  -1.349
    7   HG22  VAL   8          HG21      VAL   8  10.187 -15.252  -4.966
    8   HG21  VAL   8          HG22      VAL   8  11.683 -14.333  -5.100
    9   HG23  VAL   8          HG23      VAL   8  10.150 -13.491  -4.904

  No H/Q in entry =           9
  In of MODEL   17
    1    H    MET   9           H        MET   9  12.643 -15.766  -0.992
    2    HA   MET   9           HA       MET   9  11.855 -14.489   1.384
    3    HB2  MET   9           HB2      MET   9  13.722 -16.798   0.844
    4    HB3  MET   9           HB3      MET   9  13.402 -16.226   2.481
    5    HG2  MET   9           HG2      MET   9  10.988 -16.582   2.148
    6    HG3  MET   9           HG3      MET   9  11.295 -17.135   0.499
    7    HE2  MET   9           HE1      MET   9  10.841 -18.484   4.191
    8    HE1  MET   9           HE2      MET   9  12.201 -17.372   4.066
    9    HE3  MET   9           HE3      MET   9  12.490 -19.068   4.447

  No H/Q in entry =           9
  In of MODEL   17
    1    H    GLY  10           H        GLY  10  15.032 -14.779  -0.170
    2    HA3  GLY  10           HA2      GLY  10  16.520 -13.402   1.810
    3    HA2  GLY  10           HA3      GLY  10  16.982 -13.569   0.116

  No H/Q in entry =           3
  In of MODEL   17
    1    H    LEU  11           H        LEU  11  14.844 -12.292  -1.120
    2    HA   LEU  11           HA       LEU  11  15.591  -9.564  -0.940
    3    HB2  LEU  11           HB2      LEU  11  13.194 -10.913  -2.187
    4    HB3  LEU  11           HB3      LEU  11  13.514  -9.185  -2.336
    5    HG   LEU  11           HG       LEU  11  15.494 -11.335  -3.133
    6   HD13  LEU  11          HD11      LEU  11  13.743 -11.654  -4.657
    7   HD12  LEU  11          HD12      LEU  11  14.774 -10.491  -5.490
    8   HD11  LEU  11          HD13      LEU  11  13.311  -9.943  -4.671
    9   HD22  LEU  11          HD21      LEU  11  16.770  -9.401  -2.895
   10   HD21  LEU  11          HD22      LEU  11  15.419  -8.331  -3.270
   11   HD23  LEU  11          HD23      LEU  11  16.233  -9.211  -4.562

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  12           H        ILE  12  12.780 -11.334   0.313
    2    HA   ILE  12           HA       ILE  12  11.435  -9.085   1.382
    3    HB   ILE  12           HB       ILE  12  11.406 -11.974   2.312
    4   HG12  ILE  12          HG12      ILE  12  10.732 -11.311  -0.129
    5   HG13  ILE  12          HG13      ILE  12   9.675 -12.376   0.778
    6   HG21  ILE  12          HG21      ILE  12   9.554  -9.647   2.912
    7   HG23  ILE  12          HG22      ILE  12  10.484 -10.598   4.069
    8   HG22  ILE  12          HG23      ILE  12   9.128 -11.331   3.214
    9   HD13  ILE  12          HD11      ILE  12   8.210 -10.512   1.302
   10   HD12  ILE  12          HD12      ILE  12   8.479 -10.551  -0.440
   11   HD11  ILE  12          HD13      ILE  12   9.325  -9.383   0.552

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  13           H        ILE  13  13.777 -11.350   2.780
    2    HA   ILE  13           HA       ILE  13  13.834 -10.185   5.367
    3    HB   ILE  13           HB       ILE  13  15.858 -11.796   3.794
    4   HG12  ILE  13          HG12      ILE  13  13.557 -12.708   4.647
    5   HG13  ILE  13          HG13      ILE  13  15.011 -13.671   4.890
    6   HG23  ILE  13          HG21      ILE  13  17.218 -10.629   5.344
    7   HG22  ILE  13          HG22      ILE  13  16.906 -12.174   6.124
    8   HG21  ILE  13          HG23      ILE  13  16.015 -10.738   6.626
    9   HD11  ILE  13          HD11      ILE  13  13.910 -11.770   6.991
   10   HD13  ILE  13          HD12      ILE  13  15.185 -12.967   7.187
   11   HD12  ILE  13          HD13      ILE  13  13.525 -13.489   6.928

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ASN  14           H        ASN  14  15.803  -9.681   2.454
    2    HA   ASN  14           HA       ASN  14  17.586  -7.782   3.529
    3    HB2  ASN  14           HB2      ASN  14  17.541  -9.035   1.206
    4    HB3  ASN  14           HB3      ASN  14  16.679  -7.597   0.676
    5   HD21  ASN  14          HD21      ASN  14  19.114  -7.981  -0.508
    6   HD22  ASN  14          HD22      ASN  14  20.278  -6.925   0.127

  No H/Q in entry =           6
  In of MODEL   17
    1    H    SER  15           H        SER  15  14.486  -7.361   1.833
    2    HA   SER  15           HA       SER  15  14.432  -4.540   1.905
    3    HB2  SER  15           HB2      SER  15  12.093  -4.736   1.410
    4    HB3  SER  15           HB3      SER  15  12.866  -6.107   0.624
    5    HG   SER  15           HG       SER  15  11.333  -7.105   1.721

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLY  16           H        GLY  16  13.284  -6.989   4.193
    2    HA3  GLY  16           HA2      GLY  16  12.095  -5.226   6.058
    3    HA2  GLY  16           HA3      GLY  16  12.677  -6.848   6.412

  No H/Q in entry =           3
  In of MODEL   17
    1    H    GLN  17           H        GLN  17  15.395  -6.566   5.827
    2    HA   GLN  17           HA       GLN  17  16.372  -5.378   8.215
    3    HB2  GLN  17           HB2      GLN  17  17.580  -7.182   7.045
    4    HB3  GLN  17           HB3      GLN  17  17.880  -6.100   5.684
    5    HG2  GLN  17           HG2      GLN  17  19.141  -4.582   7.154
    6    HG3  GLN  17           HG3      GLN  17  18.832  -5.644   8.526
    7   HE21  GLN  17          HE21      GLN  17  20.584  -6.981   8.958
    8   HE22  GLN  17          HE22      GLN  17  21.653  -7.596   7.792

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ALA  18           H        ALA  18  16.211  -4.278   4.861
    2    HA   ALA  18           HA       ALA  18  17.693  -1.916   5.103
    3    HB1  ALA  18           HB1      ALA  18  16.555  -3.097   3.027
    4    HB3  ALA  18           HB2      ALA  18  16.855  -1.360   3.021
    5    HB2  ALA  18           HB3      ALA  18  15.242  -1.975   3.385

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ARG  19           H        ARG  19  14.182  -2.437   5.490
    2    HA   ARG  19           HA       ARG  19  13.564   0.222   6.218
    3    HB2  ARG  19           HB2      ARG  19  11.851  -1.493   5.619
    4    HB3  ARG  19           HB3      ARG  19  12.173  -2.306   7.152
    5    HG2  ARG  19           HG2      ARG  19  11.500  -0.307   8.401
    6    HG3  ARG  19           HG3      ARG  19  11.270   0.582   6.897
    7    HD2  ARG  19           HD2      ARG  19   9.112  -0.177   7.708
    8    HD3  ARG  19           HD3      ARG  19   9.516  -1.057   6.228
    9    HE   ARG  19           HE       ARG  19  10.440  -2.629   8.327
   10   HH21  ARG  19          HH11      ARG  19   9.157  -4.249   9.255
   11   HH22  ARG  19          HH12      ARG  19   7.438  -4.187   9.081
   12   HH11  ARG  19          HH21      ARG  19   7.474  -1.272   7.233
   13   HH12  ARG  19          HH22      ARG  19   6.486  -2.501   7.932

  No H/Q in entry =          13
  In of MODEL   17
    1    H    SER  20           H        SER  20  14.363  -2.635   8.164
    2    HA   SER  20           HA       SER  20  14.096  -1.543  10.706
    3    HB2  SER  20           HB2      SER  20  14.516  -3.876  10.573
    4    HB3  SER  20           HB3      SER  20  15.975  -3.636   9.615
    5    HG   SER  20           HG       SER  20  15.534  -3.294  12.358

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU  21           H        LEU  21  16.944  -1.526   8.576
    2    HA   LEU  21           HA       LEU  21  18.644  -0.083  10.326
    3    HB2  LEU  21           HB2      LEU  21  18.622  -0.342   7.311
    4    HB3  LEU  21           HB3      LEU  21  19.890   0.495   8.205
    5    HG   LEU  21           HG       LEU  21  19.102  -2.382   8.747
    6   HD13  LEU  21          HD11      LEU  21  19.930  -2.365   6.504
    7   HD12  LEU  21          HD12      LEU  21  21.285  -2.870   7.512
    8   HD11  LEU  21          HD13      LEU  21  21.205  -1.216   6.910
    9   HD22  LEU  21          HD21      LEU  21  20.294  -1.677  10.634
   10   HD21  LEU  21          HD22      LEU  21  21.278  -0.532   9.728
   11   HD23  LEU  21          HD23      LEU  21  21.614  -2.252   9.620

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ALA  22           H        ALA  22  16.405   0.944   7.771
    2    HA   ALA  22           HA       ALA  22  16.997   3.691   7.801
    3    HB3  ALA  22           HB1      ALA  22  15.574   2.486   6.113
    4    HB2  ALA  22           HB2      ALA  22  14.896   4.009   6.686
    5    HB1  ALA  22           HB3      ALA  22  14.274   2.478   7.304

  No H/Q in entry =           5
  In of MODEL   17
    1    H    TYR  23           H        TYR  23  14.461   1.915   9.620
    2    HA   TYR  23           HA       TYR  23  13.540   4.163  11.080
    3    HB2  TYR  23           HB2      TYR  23  12.263   2.073  11.044
    4    HB3  TYR  23           HB3      TYR  23  13.577   1.234  11.868
    5    HD1  TYR  23           HD1      TYR  23  11.114   4.011  12.238
    6    HD2  TYR  23           HD2      TYR  23  13.780   1.293  14.227
    7    HE1  TYR  23           HE1      TYR  23  10.192   4.711  14.433
    8    HE2  TYR  23           HE2      TYR  23  12.858   1.993  16.420
    9    HH   TYR  23           HH       TYR  23  10.544   4.649  16.677

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ALA  24           H        ALA  24  16.138   1.832  11.710
    2    HA   ALA  24           HA       ALA  24  16.822   2.800  14.280
    3    HB3  ALA  24           HB1      ALA  24  18.143   0.981  14.109
    4    HB2  ALA  24           HB2      ALA  24  19.191   1.887  13.017
    5    HB1  ALA  24           HB3      ALA  24  17.878   0.908  12.367

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA  25           H        ALA  25  17.805   3.727  11.009
    2    HA   ALA  25           HA       ALA  25  19.787   5.618  11.669
    3    HB1  ALA  25           HB1      ALA  25  19.057   4.697   9.347
    4    HB3  ALA  25           HB2      ALA  25  19.592   6.374   9.450
    5    HB2  ALA  25           HB3      ALA  25  17.870   6.002   9.375

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU  26           H        LEU  26  16.279   5.920  11.301
    2    HA   LEU  26           HA       LEU  26  16.110   8.704  11.767
    3    HB2  LEU  26           HB2      LEU  26  14.226   7.512  10.828
    4    HB3  LEU  26           HB3      LEU  26  14.111   6.478  12.248
    5    HG   LEU  26           HG       LEU  26  13.542   8.440  13.637
    6   HD12  LEU  26          HD11      LEU  26  12.928  10.561  12.322
    7   HD11  LEU  26          HD12      LEU  26  13.898   9.895  11.011
    8   HD13  LEU  26          HD13      LEU  26  14.647  10.257  12.567
    9   HD21  LEU  26          HD21      LEU  26  11.866   8.176  11.123
   10   HD23  LEU  26          HD22      LEU  26  11.317   8.877  12.642
   11   HD22  LEU  26          HD23      LEU  26  11.734   7.167  12.563

  No H/Q in entry =          11
  In of MODEL   17
    1    H    LYS  27           H        LYS  27  15.940   5.915  13.945
    2    HA   LYS  27           HA       LYS  27  15.370   7.280  16.319
    3    HB2  LYS  27           HB2      LYS  27  15.347   4.807  16.041
    4    HB3  LYS  27           HB3      LYS  27  17.111   4.822  16.001
    5    HG2  LYS  27           HG2      LYS  27  17.177   5.794  18.256
    6    HG3  LYS  27           HG3      LYS  27  15.411   5.850  18.298
    7    HD2  LYS  27           HD2      LYS  27  15.334   3.385  18.048
    8    HD3  LYS  27           HD3      LYS  27  17.098   3.338  18.040
    9    HE2  LYS  27           HE2      LYS  27  17.148   4.313  20.302
   10    HE3  LYS  27           HE3      LYS  27  15.384   4.391  20.313
   11    HZ3  LYS  27           HZ1      LYS  27  16.127   2.416  21.455
   12    HZ2  LYS  27           HZ2      LYS  27  17.036   1.925  20.103
   13    HZ1  LYS  27           HZ3      LYS  27  15.339   1.967  20.020

  No H/Q in entry =          13
  In of MODEL   17
    1    H    GLN  28           H        GLN  28  18.477   6.640  14.731
    2    HA   GLN  28           HA       GLN  28  20.180   7.677  16.730
    3    HB2  GLN  28           HB2      GLN  28  20.476   7.647  13.716
    4    HB3  GLN  28           HB3      GLN  28  21.769   8.075  14.835
    5    HG2  GLN  28           HG2      GLN  28  20.284   5.432  14.827
    6    HG3  GLN  28           HG3      GLN  28  21.887   5.691  14.144
    7   HE21  GLN  28          HE21      GLN  28  20.540   4.356  16.791
    8   HE22  GLN  28          HE22      GLN  28  21.708   4.741  17.961

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ALA  29           H        ALA  29  18.467   9.212  14.043
    2    HA   ALA  29           HA       ALA  29  19.522  11.809  14.312
    3    HB2  ALA  29           HB1      ALA  29  17.841  12.491  12.841
    4    HB1  ALA  29           HB2      ALA  29  16.670  11.339  13.483
    5    HB3  ALA  29           HB3      ALA  29  17.991  10.773  12.460

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LYS  30           H        LYS  30  16.708  10.263  15.819
    2    HA   LYS  30           HA       LYS  30  15.741  12.531  17.186
    3    HB2  LYS  30           HB2      LYS  30  15.562   9.589  17.873
    4    HB3  LYS  30           HB3      LYS  30  14.722  10.854  18.772
    5    HG2  LYS  30           HG2      LYS  30  13.618  11.576  16.655
    6    HG3  LYS  30           HG3      LYS  30  14.394  10.227  15.822
    7    HD2  LYS  30           HD2      LYS  30  13.283   8.636  17.340
    8    HD3  LYS  30           HD3      LYS  30  12.516   9.974  18.196
    9    HE2  LYS  30           HE2      LYS  30  11.367  10.644  16.105
   10    HE3  LYS  30           HE3      LYS  30  12.113   9.278  15.268
   11    HZ2  LYS  30           HZ1      LYS  30   9.794   8.916  16.141
   12    HZ1  LYS  30           HZ2      LYS  30  10.459   8.945  17.710
   13    HZ3  LYS  30           HZ3      LYS  30  10.943   7.755  16.594

  No H/Q in entry =          13
  In of MODEL   17
    1    H    GLN  31           H        GLN  31  18.350  10.297  17.916
    2    HA   GLN  31           HA       GLN  31  18.695  11.289  20.617
    3    HB2  GLN  31           HB2      GLN  31  20.685   9.681  19.008
    4    HB3  GLN  31           HB3      GLN  31  20.550   9.799  20.763
    5    HG2  GLN  31           HG2      GLN  31  18.017   8.909  19.983
    6    HG3  GLN  31           HG3      GLN  31  19.101   8.046  18.901
    7   HE21  GLN  31          HE21      GLN  31  17.528   6.922  21.167
    8   HE22  GLN  31          HE22      GLN  31  18.666   6.229  22.217

  No H/Q in entry =           8
  In of MODEL   17
    1    H    GLY  32           H        GLY  32  19.250  12.611  17.659
    2    HA3  GLY  32           HA2      GLY  32  20.282  14.636  17.159
    3    HA2  GLY  32           HA3      GLY  32  21.036  14.614  18.748

  No H/Q in entry =           3
  In of MODEL   17
    1    H    ASP  33           H        ASP  33  21.396  11.723  16.956
    2    HA   ASP  33           HA       ASP  33  24.237  12.336  16.499
    3    HB2  ASP  33           HB2      ASP  33  22.669   9.755  16.597
    4    HB3  ASP  33           HB3      ASP  33  24.358   9.836  16.107

  No H/Q in entry =           4
  In of MODEL   17
    1    H    PHE  34           H        PHE  34  23.790  13.681  14.624
    2    HA   PHE  34           HA       PHE  34  22.423  12.740  12.329
    3    HB2  PHE  34           HB2      PHE  34  24.602  14.824  12.575
    4    HB3  PHE  34           HB3      PHE  34  23.613  14.564  11.140
    5    HD1  PHE  34           HD1      PHE  34  23.902  16.476  14.064
    6    HD2  PHE  34           HD2      PHE  34  20.982  14.439  11.661
    7    HE1  PHE  34           HE1      PHE  34  22.115  17.909  15.016
    8    HE2  PHE  34           HE2      PHE  34  19.200  15.872  12.615
    9    HZ   PHE  34           HZ       PHE  34  19.770  17.608  14.288

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ALA  35           H        ALA  35  25.791  12.471  13.342
    2    HA   ALA  35           HA       ALA  35  26.883  11.639  10.883
    3    HB3  ALA  35           HB1      ALA  35  28.533  10.422  12.599
    4    HB2  ALA  35           HB2      ALA  35  27.690  11.461  13.749
    5    HB1  ALA  35           HB3      ALA  35  28.546  12.173  12.382

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA  36           H        ALA  36  25.718   9.693  13.635
    2    HA   ALA  36           HA       ALA  36  26.149   7.202  12.346
    3    HB2  ALA  36           HB1      ALA  36  25.698   6.454  14.417
    4    HB3  ALA  36           HB2      ALA  36  24.021   6.987  14.266
    5    HB1  ALA  36           HB3      ALA  36  25.246   8.089  14.898

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA  37           H        ALA  37  23.375   9.389  12.486
    2    HA   ALA  37           HA       ALA  37  21.483   7.668  11.297
    3    HB3  ALA  37           HB1      ALA  37  21.773  10.623  11.606
    4    HB1  ALA  37           HB2      ALA  37  20.436   9.571  12.070
    5    HB2  ALA  37           HB3      ALA  37  20.639  10.048  10.384

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LYS  38           H        LYS  38  23.638  10.091   9.836
    2    HA   LYS  38           HA       LYS  38  22.996   9.692   7.155
    3    HB2  LYS  38           HB2      LYS  38  24.835  11.202   8.613
    4    HB3  LYS  38           HB3      LYS  38  25.849  10.196   7.584
    5    HG2  LYS  38           HG2      LYS  38  24.706  11.002   5.589
    6    HG3  LYS  38           HG3      LYS  38  23.528  11.877   6.573
    7    HD2  LYS  38           HD2      LYS  38  25.155  13.437   7.337
    8    HD3  LYS  38           HD3      LYS  38  26.495  12.425   6.799
    9    HE2  LYS  38           HE2      LYS  38  26.181  14.312   5.257
   10    HE3  LYS  38           HE3      LYS  38  25.815  12.786   4.444
   11    HZ3  LYS  38           HZ1      LYS  38  23.629  13.278   4.312
   12    HZ2  LYS  38           HZ2      LYS  38  24.185  14.881   4.409
   13    HZ1  LYS  38           HZ3      LYS  38  23.592  14.102   5.796

  No H/Q in entry =          13
  In of MODEL   17
    1    H    ALA  39           H        ALA  39  25.471   8.030   9.107
    2    HA   ALA  39           HA       ALA  39  26.511   6.431   7.031
    3    HB2  ALA  39           HB1      ALA  39  26.396   5.454   9.869
    4    HB1  ALA  39           HB2      ALA  39  27.379   6.861   9.463
    5    HB3  ALA  39           HB3      ALA  39  27.699   5.308   8.691

  No H/Q in entry =           5
  In of MODEL   17
    1    H    MET  40           H        MET  40  23.880   5.857   9.320
    2    HA   MET  40           HA       MET  40  23.382   3.166   8.570
    3    HB2  MET  40           HB2      MET  40  21.606   5.240   9.870
    4    HB3  MET  40           HB3      MET  40  21.165   3.541   9.685
    5    HG2  MET  40           HG2      MET  40  23.730   4.421  11.036
    6    HG3  MET  40           HG3      MET  40  22.228   4.172  11.925
    7    HE3  MET  40           HE1      MET  40  21.589   0.550  12.079
    8    HE2  MET  40           HE2      MET  40  20.749   1.875  11.277
    9    HE1  MET  40           HE3      MET  40  21.493   2.138  12.853

  No H/Q in entry =           9
  In of MODEL   17
    1    H    MET  41           H        MET  41  22.035   6.255   7.397
    2    HA   MET  41           HA       MET  41  20.057   5.110   5.715
    3    HB2  MET  41           HB2      MET  41  21.592   7.672   5.219
    4    HB3  MET  41           HB3      MET  41  20.056   7.214   4.495
    5    HG2  MET  41           HG2      MET  41  19.301   7.027   7.043
    6    HG3  MET  41           HG3      MET  41  20.633   8.156   7.274
    7    HE2  MET  41           HE1      MET  41  20.104   9.473   3.944
    8    HE1  MET  41           HE2      MET  41  21.066   9.885   5.360
    9    HE3  MET  41           HE3      MET  41  19.817  10.994   4.799

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ASP  42           H        ASP  42  23.449   5.966   5.173
    2    HA   ASP  42           HA       ASP  42  23.537   5.506   2.413
    3    HB2  ASP  42           HB2      ASP  42  25.304   6.458   4.192
    4    HB3  ASP  42           HB3      ASP  42  25.928   4.820   4.056

  No H/Q in entry =           4
  In of MODEL   17
    1    H    GLN  43           H        GLN  43  24.211   3.322   5.123
    2    HA   GLN  43           HA       GLN  43  24.832   1.060   3.529
    3    HB2  GLN  43           HB2      GLN  43  23.808   1.248   6.372
    4    HB3  GLN  43           HB3      GLN  43  24.358  -0.248   5.609
    5    HG2  GLN  43           HG2      GLN  43  26.546   0.921   5.109
    6    HG3  GLN  43           HG3      GLN  43  25.989   2.254   6.115
    7   HE21  GLN  43          HE21      GLN  43  28.200   1.230   7.150
    8   HE22  GLN  43          HE22      GLN  43  27.900   0.146   8.420

  No H/Q in entry =           8
  In of MODEL   17
    1    H    SER  44           H        SER  44  21.797   2.248   4.914
    2    HA   SER  44           HA       SER  44  20.185   0.041   4.226
    3    HB2  SER  44           HB2      SER  44  19.792   2.572   5.385
    4    HB3  SER  44           HB3      SER  44  18.760   2.558   3.958
    5    HG   SER  44           HG       SER  44  17.644   1.628   5.673

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ARG  45           H        ARG  45  20.991   3.000   2.439
    2    HA   ARG  45           HA       ARG  45  19.461   2.558   0.129
    3    HB2  ARG  45           HB2      ARG  45  20.648   4.667   0.728
    4    HB3  ARG  45           HB3      ARG  45  22.177   3.883   0.341
    5    HG2  ARG  45           HG2      ARG  45  21.390   3.507  -1.977
    6    HG3  ARG  45           HG3      ARG  45  19.873   4.314  -1.589
    7    HD2  ARG  45           HD2      ARG  45  21.165   6.381  -0.991
    8    HD3  ARG  45           HD3      ARG  45  22.647   5.580  -1.561
    9    HE   ARG  45           HE       ARG  45  20.716   5.393  -3.602
   10   HH21  ARG  45          HH11      ARG  45  20.740   6.772  -5.357
   11   HH22  ARG  45          HH12      ARG  45  21.529   8.306  -5.243
   12   HH11  ARG  45          HH21      ARG  45  22.494   7.846  -1.958
   13   HH12  ARG  45          HH22      ARG  45  22.521   8.913  -3.315

  No H/Q in entry =          13
  In of MODEL   17
    1    H    MET  46           H        MET  46  22.805   1.610   0.877
    2    HA   MET  46           HA       MET  46  23.390   0.418  -1.612
    3    HB2  MET  46           HB2      MET  46  24.485   0.057   1.177
    4    HB3  MET  46           HB3      MET  46  25.124  -0.847  -0.200
    5    HG2  MET  46           HG2      MET  46  25.623   1.248  -1.376
    6    HG3  MET  46           HG3      MET  46  24.926   2.177  -0.056
    7    HE1  MET  46           HE1      MET  46  27.356  -0.260  -1.283
    8    HE3  MET  46           HE2      MET  46  27.538  -1.083   0.263
    9    HE2  MET  46           HE3      MET  46  28.844  -0.068  -0.345

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ALA  47           H        ALA  47  21.975  -0.902   1.354
    2    HA   ALA  47           HA       ALA  47  21.864  -3.608   0.536
    3    HB2  ALA  47           HB1      ALA  47  21.492  -3.152   2.843
    4    HB3  ALA  47           HB2      ALA  47  19.944  -3.719   2.218
    5    HB1  ALA  47           HB3      ALA  47  20.210  -1.995   2.487

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU  48           H        LEU  48  19.569  -0.929   0.191
    2    HA   LEU  48           HA       LEU  48  17.493  -2.412  -1.071
    3    HB2  LEU  48           HB2      LEU  48  18.212   0.528  -1.169
    4    HB3  LEU  48           HB3      LEU  48  16.727  -0.147  -1.841
    5    HG   LEU  48           HG       LEU  48  17.570  -0.482   1.047
    6   HD13  LEU  48          HD11      LEU  48  17.202   1.828   0.872
    7   HD12  LEU  48          HD12      LEU  48  15.629   1.212   1.376
    8   HD11  LEU  48          HD13      LEU  48  15.912   1.637  -0.313
    9   HD22  LEU  48          HD21      LEU  48  16.004  -2.161   0.655
   10   HD21  LEU  48          HD22      LEU  48  15.152  -1.233  -0.579
   11   HD23  LEU  48          HD23      LEU  48  14.946  -0.833   1.126

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ASN  49           H        ASN  49  20.224  -0.536  -2.288
    2    HA   ASN  49           HA       ASN  49  19.575  -0.591  -5.013
    3    HB2  ASN  49           HB2      ASN  49  21.283   0.887  -4.100
    4    HB3  ASN  49           HB3      ASN  49  22.276  -0.490  -3.641
    5   HD21  ASN  49          HD21      ASN  49  20.840   1.070  -6.530
    6   HD22  ASN  49          HD22      ASN  49  22.074   0.591  -7.590

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLU  50           H        GLU  50  21.508  -2.839  -3.061
    2    HA   GLU  50           HA       GLU  50  22.173  -4.599  -5.195
    3    HB2  GLU  50           HB2      GLU  50  23.369  -4.611  -3.028
    4    HB3  GLU  50           HB3      GLU  50  21.912  -5.211  -2.236
    5    HG2  GLU  50           HG2      GLU  50  21.958  -7.239  -3.605
    6    HG3  GLU  50           HG3      GLU  50  23.348  -6.632  -4.502

  No H/Q in entry =           6
  In of MODEL   17
    1    H    ALA  51           H        ALA  51  19.517  -4.487  -2.871
    2    HA   ALA  51           HA       ALA  51  18.297  -6.929  -3.641
    3    HB3  ALA  51           HB1      ALA  51  16.715  -6.396  -2.085
    4    HB1  ALA  51           HB2      ALA  51  16.538  -4.743  -2.675
    5    HB2  ALA  51           HB3      ALA  51  17.888  -5.164  -1.620

  No H/Q in entry =           5
  In of MODEL   17
    1    H    HIS  52           H        HIS  52  17.786  -3.564  -4.660
    2    HA   HIS  52           HA       HIS  52  15.663  -4.035  -6.464
    3    HB2  HIS  52           HB2      HIS  52  16.357  -1.789  -5.653
    4    HB3  HIS  52           HB3      HIS  52  17.814  -1.912  -6.638
    5    HD1  HIS  52           HD1      HIS  52  17.510  -1.870  -9.242
    6    HD2  HIS  52           HD2      HIS  52  13.989  -1.236  -7.101
    7    HE1  HIS  52           HE1      HIS  52  15.810  -0.986 -10.901
    8    HE2  HIS  52           HE2      HIS  52  13.659  -0.595  -9.610

  No H/Q in entry =           8
  In of MODEL   17
    1    H    LEU  53           H        LEU  53  19.181  -4.116  -6.894
    2    HA   LEU  53           HA       LEU  53  19.233  -4.419  -9.696
    3    HB2  LEU  53           HB2      LEU  53  21.147  -5.233  -7.524
    4    HB3  LEU  53           HB3      LEU  53  21.456  -5.620  -9.214
    5    HG   LEU  53           HG       LEU  53  20.840  -2.798  -8.284
    6   HD11  LEU  53          HD11      LEU  53  23.475  -4.266  -8.484
    7   HD13  LEU  53          HD12      LEU  53  22.837  -3.354  -7.117
    8   HD12  LEU  53          HD13      LEU  53  23.373  -2.509  -8.564
    9   HD23  LEU  53          HD21      LEU  53  22.283  -2.377 -10.427
   10   HD22  LEU  53          HD22      LEU  53  20.603  -2.864 -10.627
   11   HD21  LEU  53          HD23      LEU  53  21.886  -4.041 -10.838

  No H/Q in entry =          11
  In of MODEL   17
    1    H    VAL  54           H        VAL  54  19.067  -6.815  -7.082
    2    HA   VAL  54           HA       VAL  54  19.141  -9.104  -8.752
    3    HB   VAL  54           HB       VAL  54  17.994  -8.669  -5.984
    4   HG12  VAL  54          HG11      VAL  54  18.262 -11.293  -5.992
    5   HG11  VAL  54          HG12      VAL  54  18.082 -11.112  -7.737
    6   HG13  VAL  54          HG13      VAL  54  16.804 -10.559  -6.656
    7   HG22  VAL  54          HG21      VAL  54  20.314  -8.509  -5.758
    8   HG21  VAL  54          HG22      VAL  54  20.628  -9.602  -7.105
    9   HG23  VAL  54          HG23      VAL  54  20.083 -10.245  -5.555

  No H/Q in entry =           9
  In of MODEL   17
    1    H    GLN  55           H        GLN  55  16.453  -7.149  -7.462
    2    HA   GLN  55           HA       GLN  55  14.398  -8.765  -8.545
    3    HB2  GLN  55           HB2      GLN  55  13.681  -7.231  -6.912
    4    HB3  GLN  55           HB3      GLN  55  14.504  -5.876  -7.681
    5    HG2  GLN  55           HG2      GLN  55  12.788  -5.508  -9.170
    6    HG3  GLN  55           HG3      GLN  55  12.430  -7.221  -9.348
    7   HE21  GLN  55          HE21      GLN  55  10.411  -7.731  -8.547
    8   HE22  GLN  55          HE22      GLN  55   9.653  -6.966  -7.236

  No H/Q in entry =           8
  In of MODEL   17
    1    H    THR  56           H        THR  56  16.197  -5.996  -9.890
    2    HA   THR  56           HA       THR  56  14.769  -5.593 -12.238
    3    HB   THR  56           HB       THR  56  17.789  -5.570 -12.078
    4    HG1  THR  56           HG1      THR  56  15.984  -4.188 -10.669
    5   HG22  THR  56          HG21      THR  56  17.319  -3.554 -13.632
    6   HG21  THR  56          HG22      THR  56  15.708  -4.248 -13.808
    7   HG23  THR  56          HG23      THR  56  17.125  -5.174 -14.304

  No H/Q in entry =           7
  In of MODEL   17
    1    H    LYS  57           H        LYS  57  17.369  -7.948 -11.636
    2    HA   LYS  57           HA       LYS  57  17.347  -9.130 -14.219
    3    HB2  LYS  57           HB2      LYS  57  19.130  -9.428 -12.473
    4    HB3  LYS  57           HB3      LYS  57  18.004 -10.405 -11.543
    5    HG2  LYS  57           HG2      LYS  57  17.872 -12.040 -13.356
    6    HG3  LYS  57           HG3      LYS  57  18.929 -11.052 -14.358
    7    HD2  LYS  57           HD2      LYS  57  20.346 -12.719 -13.423
    8    HD3  LYS  57           HD3      LYS  57  20.662 -11.268 -12.471
    9    HE2  LYS  57           HE2      LYS  57  19.298 -12.051 -10.655
   10    HE3  LYS  57           HE3      LYS  57  18.634 -13.366 -11.622
   11    HZ3  LYS  57           HZ1      LYS  57  20.786 -14.390 -11.709
   12    HZ2  LYS  57           HZ2      LYS  57  20.379 -14.094 -10.087
   13    HZ1  LYS  57           HZ3      LYS  57  21.493 -13.090 -10.881

  No H/Q in entry =          13
  In of MODEL   17
    1    H    LEU  58           H        LEU  58  15.551  -9.774 -11.248
    2    HA   LEU  58           HA       LEU  58  14.281 -12.118 -12.194
    3    HB2  LEU  58           HB2      LEU  58  13.524 -10.206  -9.990
    4    HB3  LEU  58           HB3      LEU  58  12.686 -11.725 -10.313
    5    HG   LEU  58           HG       LEU  58  15.664 -11.511  -9.756
    6   HD11  LEU  58          HD11      LEU  58  13.284 -11.888  -7.966
    7   HD13  LEU  58          HD12      LEU  58  14.757 -10.956  -7.699
    8   HD12  LEU  58          HD13      LEU  58  14.793 -12.713  -7.572
    9   HD22  LEU  58          HD21      LEU  58  15.505 -13.565 -10.793
   10   HD21  LEU  58          HD22      LEU  58  13.787 -13.741 -10.434
   11   HD23  LEU  58          HD23      LEU  58  14.988 -14.072  -9.186

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  59           H        ILE  59  13.679  -8.764 -12.862
    2    HA   ILE  59           HA       ILE  59  10.951  -9.353 -13.806
    3    HB   ILE  59           HB       ILE  59  11.802  -7.093 -12.589
    4   HG12  ILE  59          HG12      ILE  59   9.898  -6.933 -14.938
    5   HG13  ILE  59          HG13      ILE  59   9.464  -7.682 -13.424
    6   HG21  ILE  59          HG21      ILE  59  13.351  -6.723 -14.654
    7   HG23  ILE  59          HG22      ILE  59  12.413  -5.364 -14.076
    8   HG22  ILE  59          HG23      ILE  59  11.885  -6.269 -15.491
    9   HD11  ILE  59          HD11      ILE  59  10.465  -4.847 -13.686
   10   HD13  ILE  59          HD12      ILE  59   9.885  -5.613 -12.208
   11   HD12  ILE  59          HD13      ILE  59   8.764  -5.293 -13.533

  No H/Q in entry =          11
  In of MODEL   17
    1    H    GLU  60           H        GLU  60  14.172  -8.561 -15.059
    2    HA   GLU  60           HA       GLU  60  13.402  -8.133 -17.766
    3    HB2  GLU  60           HB2      GLU  60  15.592  -7.439 -16.936
    4    HB3  GLU  60           HB3      GLU  60  16.020  -9.113 -16.594
    5    HG2  GLU  60           HG2      GLU  60  15.842  -9.659 -18.995
    6    HG3  GLU  60           HG3      GLU  60  15.399  -7.990 -19.343

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLY  61           H        GLY  61  14.319 -11.042 -15.963
    2    HA3  GLY  61           HA2      GLY  61  13.746 -12.668 -18.372
    3    HA2  GLY  61           HA3      GLY  61  14.767 -13.176 -17.031

  No H/Q in entry =           3
  In of MODEL   17
    1    H    ASP  62           H        ASP  62  11.678 -11.569 -16.657
    2    HA   ASP  62           HA       ASP  62  10.718 -13.617 -14.909
    3    HB2  ASP  62           HB2      ASP  62   8.671 -12.207 -14.842
    4    HB3  ASP  62           HB3      ASP  62  10.145 -11.311 -14.486

  No H/Q in entry =           4
  In of MODEL   17
    1    H    ALA  63           H        ALA  63   9.813 -15.517 -15.530
    2    HA   ALA  63           HA       ALA  63   8.166 -15.539 -18.011
    3    HB1  ALA  63           HB1      ALA  63  10.325 -16.754 -18.288
    4    HB3  ALA  63           HB2      ALA  63   8.926 -17.817 -18.429
    5    HB2  ALA  63           HB3      ALA  63   9.876 -17.804 -16.943

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLY  64           H        GLY  64   8.734 -16.865 -14.799
    2    HA3  GLY  64           HA2      GLY  64   7.298 -17.697 -13.211
    3    HA2  GLY  64           HA3      GLY  64   5.969 -17.054 -14.166

  No H/Q in entry =           3
  In of MODEL   17
    1    H    GLU  65           H        GLU  65   4.886 -19.078 -13.435
    2    HA   GLU  65           HA       GLU  65   5.810 -21.618 -14.241
    3    HB2  GLU  65           HB2      GLU  65   3.037 -20.642 -13.573
    4    HB3  GLU  65           HB3      GLU  65   3.438 -22.334 -13.865
    5    HG2  GLU  65           HG2      GLU  65   5.054 -22.305 -12.036
    6    HG3  GLU  65           HG3      GLU  65   4.762 -20.588 -11.770

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLY  66           H        GLY  66   3.778 -19.277 -15.805
    2    HA3  GLY  66           HA2      GLY  66   3.235 -20.972 -18.109
    3    HA2  GLY  66           HA3      GLY  66   2.567 -19.382 -17.801

  No H/Q in entry =           3
  In of MODEL   17
    1    H    LYS  67           H        LYS  67   3.244 -19.732 -20.265
    2    HA   LYS  67           HA       LYS  67   5.941 -19.347 -20.985
    3    HB2  LYS  67           HB2      LYS  67   3.365 -18.914 -22.490
    4    HB3  LYS  67           HB3      LYS  67   4.966 -18.787 -23.230
    5    HG2  LYS  67           HG2      LYS  67   5.496 -21.081 -22.496
    6    HG3  LYS  67           HG3      LYS  67   3.904 -21.216 -21.754
    7    HD2  LYS  67           HD2      LYS  67   2.846 -20.911 -23.962
    8    HD3  LYS  67           HD3      LYS  67   4.442 -20.786 -24.706
    9    HE2  LYS  67           HE2      LYS  67   4.997 -23.055 -23.928
   10    HE3  LYS  67           HE3      LYS  67   3.416 -23.185 -23.158
   11    HZ3  LYS  67           HZ1      LYS  67   3.347 -24.252 -25.283
   12    HZ2  LYS  67           HZ2      LYS  67   3.952 -22.868 -26.059
   13    HZ1  LYS  67           HZ3      LYS  67   2.404 -22.845 -25.359

  No H/Q in entry =          13
  In of MODEL   17
    1    H    MET  68           H        MET  68   3.517 -17.054 -21.982
    2    HA   MET  68           HA       MET  68   5.242 -14.837 -22.105
    3    HB2  MET  68           HB2      MET  68   2.226 -14.978 -22.043
    4    HB3  MET  68           HB3      MET  68   3.162 -13.549 -22.481
    5    HG2  MET  68           HG2      MET  68   4.327 -15.385 -24.100
    6    HG3  MET  68           HG3      MET  68   2.692 -16.041 -24.015
    7    HE2  MET  68           HE1      MET  68   1.502 -12.532 -23.497
    8    HE1  MET  68           HE2      MET  68   0.911 -14.191 -23.517
    9    HE3  MET  68           HE3      MET  68   0.470 -13.092 -24.822

  No H/Q in entry =           9
  In of MODEL   17
    1    H    LYS  69           H        LYS  69   2.883 -15.756 -19.574
    2    HA   LYS  69           HA       LYS  69   2.871 -13.390 -18.131
    3    HB2  LYS  69           HB2      LYS  69   2.065 -14.718 -16.241
    4    HB3  LYS  69           HB3      LYS  69   1.316 -15.245 -17.750
    5    HG2  LYS  69           HG2      LYS  69   2.864 -17.108 -17.935
    6    HG3  LYS  69           HG3      LYS  69   3.764 -16.545 -16.526
    7    HD2  LYS  69           HD2      LYS  69   2.318 -18.327 -15.790
    8    HD3  LYS  69           HD3      LYS  69   1.641 -16.816 -15.178
    9    HE2  LYS  69           HE2      LYS  69  -0.057 -16.776 -16.838
   10    HE3  LYS  69           HE3      LYS  69   0.763 -17.991 -17.817
   11    HZ1  LYS  69           HZ1      LYS  69  -0.403 -18.459 -15.127
   12    HZ3  LYS  69           HZ2      LYS  69   0.358 -19.624 -16.101
   13    HZ2  LYS  69           HZ3      LYS  69  -1.111 -18.926 -16.595

  No H/Q in entry =          13
  In of MODEL   17
    1    H    VAL  70           H        VAL  70   3.541 -13.766 -15.511
    2    HA   VAL  70           HA       VAL  70   6.485 -14.092 -15.485
    3    HB   VAL  70           HB       VAL  70   6.579 -12.121 -13.963
    4   HG13  VAL  70          HG11      VAL  70   6.320 -10.446 -15.721
    5   HG12  VAL  70          HG12      VAL  70   5.270 -11.531 -16.634
    6   HG11  VAL  70          HG13      VAL  70   6.976 -11.924 -16.424
    7   HG21  VAL  70          HG21      VAL  70   3.636 -11.905 -14.706
    8   HG23  VAL  70          HG22      VAL  70   4.560 -10.613 -13.941
    9   HG22  VAL  70          HG23      VAL  70   4.299 -12.133 -13.086

  No H/Q in entry =           9
  In of MODEL   17
    1    H    SER  71           H        SER  71   7.342 -14.385 -13.281
    2    HA   SER  71           HA       SER  71   6.006 -16.417 -11.828
    3    HB2  SER  71           HB2      SER  71   8.461 -16.120 -11.800
    4    HB3  SER  71           HB3      SER  71   8.261 -14.602 -10.928
    5    HG   SER  71           HG       SER  71   8.656 -16.563  -9.637

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU  72           H        LEU  72   4.693 -16.330 -10.058
    2    HA   LEU  72           HA       LEU  72   3.191 -13.988  -9.604
    3    HB2  LEU  72           HB2      LEU  72   3.424 -16.555  -8.041
    4    HB3  LEU  72           HB3      LEU  72   2.277 -15.278  -7.646
    5    HG   LEU  72           HG       LEU  72   2.427 -16.585 -10.382
    6   HD12  LEU  72          HD11      LEU  72   0.363 -17.801  -9.636
    7   HD11  LEU  72          HD12      LEU  72   0.654 -17.205  -8.003
    8   HD13  LEU  72          HD13      LEU  72   1.816 -18.291  -8.765
    9   HD21  LEU  72          HD21      LEU  72   0.578 -14.629  -9.029
   10   HD23  LEU  72          HD22      LEU  72  -0.055 -15.677 -10.287
   11   HD22  LEU  72          HD23      LEU  72   1.255 -14.558 -10.651

  No H/Q in entry =          11
  In of MODEL   17
    1    H    VAL  73           H        VAL  73   5.815 -15.488  -7.835
    2    HA   VAL  73           HA       VAL  73   5.783 -13.965  -5.496
    3    HB   VAL  73           HB       VAL  73   7.974 -14.800  -5.089
    4   HG11  VAL  73          HG11      VAL  73   5.991 -16.431  -5.307
    5   HG13  VAL  73          HG12      VAL  73   7.611 -17.127  -5.350
    6   HG12  VAL  73          HG13      VAL  73   6.708 -16.900  -6.847
    7   HG22  VAL  73          HG21      VAL  73   9.285 -14.317  -6.948
    8   HG21  VAL  73          HG22      VAL  73   8.082 -14.925  -8.083
    9   HG23  VAL  73          HG23      VAL  73   9.063 -16.055  -7.148

  No H/Q in entry =           9
  In of MODEL   17
    1    H    LEU  74           H        LEU  74   6.796 -13.076  -8.666
    2    HA   LEU  74           HA       LEU  74   8.780 -11.170  -8.160
    3    HB2  LEU  74           HB2      LEU  74   8.315 -11.896 -10.403
    4    HB3  LEU  74           HB3      LEU  74   6.659 -11.302 -10.302
    5    HG   LEU  74           HG       LEU  74   7.498  -8.989 -10.077
    6   HD11  LEU  74          HD11      LEU  74  10.161 -10.414 -10.188
    7   HD13  LEU  74          HD12      LEU  74   9.608  -9.226  -9.009
    8   HD12  LEU  74          HD13      LEU  74  10.004  -8.720 -10.651
    9   HD23  LEU  74          HD21      LEU  74   8.969 -10.106 -12.410
   10   HD22  LEU  74          HD22      LEU  74   7.854  -8.762 -12.313
   11   HD21  LEU  74          HD23      LEU  74   7.233 -10.398 -12.305

  No H/Q in entry =          11
  In of MODEL   17
    1    H    VAL  75           H        VAL  75   5.293 -10.712  -8.517
    2    HA   VAL  75           HA       VAL  75   5.253  -7.957  -7.917
    3    HB   VAL  75           HB       VAL  75   3.116 -10.056  -7.536
    4   HG12  VAL  75          HG11      VAL  75   1.575  -8.079  -7.426
    5   HG11  VAL  75          HG12      VAL  75   2.977  -7.021  -7.420
    6   HG13  VAL  75          HG13      VAL  75   2.699  -8.112  -6.072
    7   HG22  VAL  75          HG21      VAL  75   2.281  -9.209  -9.647
    8   HG21  VAL  75          HG22      VAL  75   3.989  -9.586  -9.865
    9   HG23  VAL  75          HG23      VAL  75   3.474  -7.911  -9.656

  No H/Q in entry =           9
  In of MODEL   17
    1    H    GLU  76           H        GLU  76   4.936 -10.839  -5.822
    2    HA   GLU  76           HA       GLU  76   4.489  -9.481  -3.395
    3    HB2  GLU  76           HB2      GLU  76   4.264 -11.943  -3.644
    4    HB3  GLU  76           HB3      GLU  76   6.000 -12.075  -3.875
    5    HG2  GLU  76           HG2      GLU  76   5.530 -12.659  -1.582
    6    HG3  GLU  76           HG3      GLU  76   6.315 -11.090  -1.561

  No H/Q in entry =           6
  In of MODEL   17
    1    H    ALA  77           H        ALA  77   7.533 -10.443  -4.956
    2    HA   ALA  77           HA       ALA  77   9.239  -9.445  -2.932
    3    HB2  ALA  77           HB1      ALA  77  10.990  -9.493  -4.689
    4    HB3  ALA  77           HB2      ALA  77   9.741  -9.799  -5.896
    5    HB1  ALA  77           HB3      ALA  77  10.056 -10.987  -4.632

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLN  78           H        GLN  78   7.883  -7.985  -5.841
    2    HA   GLN  78           HA       GLN  78   9.287  -5.535  -5.721
    3    HB2  GLN  78           HB2      GLN  78   7.979  -6.409  -7.688
    4    HB3  GLN  78           HB3      GLN  78   6.502  -6.012  -6.814
    5    HG2  GLN  78           HG2      GLN  78   7.184  -3.655  -6.706
    6    HG3  GLN  78           HG3      GLN  78   8.677  -4.039  -7.561
    7   HE21  GLN  78          HE21      GLN  78   6.828  -2.181  -8.681
    8   HE22  GLN  78          HE22      GLN  78   6.132  -2.877 -10.065

  No H/Q in entry =           8
  In of MODEL   17
    1    H    LEU  79           H        LEU  79   6.241  -6.616  -4.304
    2    HA   LEU  79           HA       LEU  79   5.296  -4.193  -3.285
    3    HB2  LEU  79           HB2      LEU  79   3.938  -6.216  -3.243
    4    HB3  LEU  79           HB3      LEU  79   5.064  -6.985  -2.129
    5    HG   LEU  79           HG       LEU  79   4.542  -5.341  -0.395
    6   HD13  LEU  79          HD11      LEU  79   4.123  -3.311  -1.437
    7   HD12  LEU  79          HD12      LEU  79   2.485  -3.804  -1.005
    8   HD11  LEU  79          HD13      LEU  79   3.065  -4.031  -2.652
    9   HD23  LEU  79          HD21      LEU  79   1.946  -5.778  -0.314
   10   HD22  LEU  79          HD22      LEU  79   3.056  -7.142  -0.209
   11   HD21  LEU  79          HD23      LEU  79   2.254  -6.780  -1.735

  No H/Q in entry =          11
  In of MODEL   17
    1    H    HIS  80           H        HIS  80   7.424  -6.582  -1.708
    2    HA   HIS  80           HA       HIS  80   7.738  -5.059   0.669
    3    HB2  HIS  80           HB2      HIS  80   9.028  -7.445  -0.538
    4    HB3  HIS  80           HB3      HIS  80   9.954  -6.574   0.686
    5    HD1  HIS  80           HD1      HIS  80   9.443  -7.211   3.024
    6    HD2  HIS  80           HD2      HIS  80   6.216  -7.979   0.499
    7    HE1  HIS  80           HE1      HIS  80   7.644  -8.283   4.462
    8    HE2  HIS  80           HE2      HIS  80   5.670  -8.755   2.931

  No H/Q in entry =           8
  In of MODEL   17
    1    H    LEU  81           H        LEU  81   9.746  -5.363  -2.239
    2    HA   LEU  81           HA       LEU  81  11.825  -3.672  -1.345
    3    HB2  LEU  81           HB2      LEU  81  10.895  -4.430  -4.115
    4    HB3  LEU  81           HB3      LEU  81  12.336  -3.457  -3.815
    5    HG   LEU  81           HG       LEU  81  11.880  -6.175  -2.557
    6   HD12  LEU  81          HD11      LEU  81  13.687  -6.832  -4.304
    7   HD11  LEU  81          HD12      LEU  81  13.156  -5.392  -5.170
    8   HD13  LEU  81          HD13      LEU  81  12.014  -6.693  -4.842
    9   HD23  LEU  81          HD21      LEU  81  14.514  -5.918  -2.533
   10   HD22  LEU  81          HD22      LEU  81  13.545  -5.142  -1.282
   11   HD21  LEU  81          HD23      LEU  81  14.149  -4.197  -2.642

  No H/Q in entry =          11
  In of MODEL   17
    1    H    MET  82           H        MET  82   8.923  -2.961  -3.288
    2    HA   MET  82           HA       MET  82   9.525  -0.246  -3.773
    3    HB2  MET  82           HB2      MET  82   6.930  -1.783  -3.664
    4    HB3  MET  82           HB3      MET  82   6.969  -0.057  -4.020
    5    HG2  MET  82           HG2      MET  82   8.528  -2.158  -5.560
    6    HG3  MET  82           HG3      MET  82   6.977  -1.498  -6.075
    7    HE3  MET  82           HE1      MET  82   7.507   1.952  -7.227
    8    HE2  MET  82           HE2      MET  82   7.121   1.726  -5.523
    9    HE1  MET  82           HE3      MET  82   6.436   0.637  -6.726

  No H/Q in entry =           9
  In of MODEL   17
    1    H    THR  83           H        THR  83   7.689  -1.816  -1.182
    2    HA   THR  83           HA       THR  83   6.887   0.544   0.154
    3    HB   THR  83           HB       THR  83   6.710  -1.037   2.163
    4    HG1  THR  83           HG1      THR  83   7.424  -3.003   1.926
    5   HG22  THR  83          HG21      THR  83   5.027  -2.558   0.682
    6   HG21  THR  83          HG22      THR  83   5.287  -1.229  -0.442
    7   HG23  THR  83          HG23      THR  83   4.649  -0.908   1.170

  No H/Q in entry =           7
  In of MODEL   17
    1    H    SER  84           H        SER  84   9.660  -1.620   0.673
    2    HA   SER  84           HA       SER  84  10.745  -0.225   2.872
    3    HB2  SER  84           HB2      SER  84  11.963  -2.086   0.842
    4    HB3  SER  84           HB3      SER  84  12.922  -1.360   2.130
    5    HG   SER  84           HG       SER  84  10.608  -2.999   2.374

  No H/Q in entry =           5
  In of MODEL   17
    1    H    MET  85           H        MET  85  11.515   0.036  -0.612
    2    HA   MET  85           HA       MET  85  13.557   1.953  -0.345
    3    HB2  MET  85           HB2      MET  85  13.135   0.690  -2.418
    4    HB3  MET  85           HB3      MET  85  11.633   1.585  -2.648
    5    HG2  MET  85           HG2      MET  85  12.884   3.696  -2.766
    6    HG3  MET  85           HG3      MET  85  14.391   2.831  -2.482
    7    HE1  MET  85           HE1      MET  85  11.320   3.246  -4.400
    8    HE3  MET  85           HE2      MET  85  11.326   1.648  -5.141
    9    HE2  MET  85           HE3      MET  85  11.731   3.058  -6.112

  No H/Q in entry =           9
  In of MODEL   17
    1    H    LEU  86           H        LEU  86  10.078   2.371  -0.863
    2    HA   LEU  86           HA       LEU  86  10.080   5.186  -1.031
    3    HB2  LEU  86           HB2      LEU  86   8.199   3.572  -1.621
    4    HB3  LEU  86           HB3      LEU  86   7.862   3.482   0.107
    5    HG   LEU  86           HG       LEU  86   7.761   6.046   0.067
    6   HD11  LEU  86          HD11      LEU  86   8.535   5.605  -2.634
    7   HD13  LEU  86          HD12      LEU  86   8.132   7.139  -1.867
    8   HD12  LEU  86          HD13      LEU  86   6.877   6.209  -2.681
    9   HD23  LEU  86          HD21      LEU  86   5.602   4.751  -1.609
   10   HD22  LEU  86          HD22      LEU  86   5.437   6.009  -0.387
   11   HD21  LEU  86          HD23      LEU  86   5.796   4.354   0.099

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ALA  87           H        ALA  87   9.554   3.005   1.703
    2    HA   ALA  87           HA       ALA  87   9.044   4.921   3.680
    3    HB1  ALA  87           HB1      ALA  87   9.785   2.084   3.582
    4    HB3  ALA  87           HB2      ALA  87   8.676   2.916   4.668
    5    HB2  ALA  87           HB3      ALA  87  10.403   2.906   5.018

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ARG  88           H        ARG  88  12.096   3.430   2.702
    2    HA   ARG  88           HA       ARG  88  13.732   4.761   4.546
    3    HB2  ARG  88           HB2      ARG  88  14.358   2.779   3.135
    4    HB3  ARG  88           HB3      ARG  88  14.541   3.875   1.768
    5    HG2  ARG  88           HG2      ARG  88  16.038   5.144   3.725
    6    HG3  ARG  88           HG3      ARG  88  16.318   3.446   4.097
    7    HD2  ARG  88           HD2      ARG  88  17.583   3.129   2.252
    8    HD3  ARG  88           HD3      ARG  88  16.470   4.032   1.220
    9    HE   ARG  88           HE       ARG  88  18.886   5.034   2.280
   10   HH21  ARG  88          HH11      ARG  88  19.284   7.245   2.098
   11   HH22  ARG  88          HH12      ARG  88  17.959   8.349   1.956
   12   HH11  ARG  88          HH21      ARG  88  15.566   5.867   1.996
   13   HH12  ARG  88          HH22      ARG  88  15.852   7.566   1.874

  No H/Q in entry =          13
  In of MODEL   17
    1    H    GLU  89           H        GLU  89  12.790   5.698   1.225
    2    HA   GLU  89           HA       GLU  89  14.392   8.022   1.085
    3    HB2  GLU  89           HB2      GLU  89  13.230   7.018  -0.872
    4    HB3  GLU  89           HB3      GLU  89  11.696   7.592  -0.216
    5    HG2  GLU  89           HG2      GLU  89  12.453   9.913  -0.364
    6    HG3  GLU  89           HG3      GLU  89  14.047   9.387  -0.899

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LEU  90           H        LEU  90  11.049   7.585   2.202
    2    HA   LEU  90           HA       LEU  90  10.596  10.327   2.790
    3    HB2  LEU  90           HB2      LEU  90   9.338   7.777   3.800
    4    HB3  LEU  90           HB3      LEU  90   8.744   9.384   4.230
    5    HG   LEU  90           HG       LEU  90   9.150   8.509   1.357
    6   HD12  LEU  90          HD11      LEU  90   6.609   8.240   1.411
    7   HD11  LEU  90          HD12      LEU  90   6.758   8.217   3.168
    8   HD13  LEU  90          HD13      LEU  90   7.550   6.973   2.199
    9   HD22  LEU  90          HD21      LEU  90   8.910  10.824   1.295
   10   HD21  LEU  90          HD22      LEU  90   7.920  10.872   2.752
   11   HD23  LEU  90          HD23      LEU  90   7.215  10.341   1.226

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  91           H        ILE  91  11.790   7.607   4.702
    2    HA   ILE  91           HA       ILE  91  11.955   8.955   7.178
    3    HB   ILE  91           HB       ILE  91  13.457   6.587   6.046
    4   HG12  ILE  91          HG12      ILE  91  11.439   6.790   8.301
    5   HG13  ILE  91          HG13      ILE  91  10.967   6.528   6.623
    6   HG22  ILE  91          HG21      ILE  91  13.914   6.349   8.687
    7   HG21  ILE  91          HG22      ILE  91  13.880   8.109   8.595
    8   HG23  ILE  91          HG23      ILE  91  15.040   7.199   7.629
    9   HD13  ILE  91          HD11      ILE  91  11.920   4.404   6.544
   10   HD12  ILE  91          HD12      ILE  91  11.323   4.468   8.203
   11   HD11  ILE  91          HD13      ILE  91  13.033   4.743   7.871

  No H/Q in entry =          11
  In of MODEL   17
    1    H    THR  92           H        THR  92  14.175   8.748   4.431
    2    HA   THR  92           HA       THR  92  16.369  10.084   5.604
    3    HB   THR  92           HB       THR  92  15.389   9.997   2.740
    4    HG1  THR  92           HG1      THR  92  16.175   8.079   3.137
    5   HG22  THR  92          HG21      THR  92  17.975  10.629   2.457
    6   HG21  THR  92          HG22      THR  92  17.682  11.449   3.990
    7   HG23  THR  92          HG23      THR  92  16.725  11.866   2.569

  No H/Q in entry =           7
  In of MODEL   17
    1    H    GLU  93           H        GLU  93  13.515  11.314   3.873
    2    HA   GLU  93           HA       GLU  93  14.174  14.059   4.003
    3    HB2  GLU  93           HB2      GLU  93  11.438  12.750   4.003
    4    HB3  GLU  93           HB3      GLU  93  11.767  14.445   3.641
    5    HG2  GLU  93           HG2      GLU  93  13.056  12.179   2.105
    6    HG3  GLU  93           HG3      GLU  93  11.527  12.901   1.617

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LEU  94           H        LEU  94  12.375  11.933   6.198
    2    HA   LEU  94           HA       LEU  94  11.606  13.888   8.082
    3    HB2  LEU  94           HB2      LEU  94  12.112  10.919   8.343
    4    HB3  LEU  94           HB3      LEU  94  11.559  11.901   9.696
    5    HG   LEU  94           HG       LEU  94  10.084  12.001   7.064
    6   HD11  LEU  94          HD11      LEU  94  10.110   9.768   9.057
    7   HD13  LEU  94          HD12      LEU  94   9.811   9.723   7.321
    8   HD12  LEU  94          HD13      LEU  94   8.542  10.264   8.418
    9   HD23  LEU  94          HD21      LEU  94   8.170  12.437   8.661
   10   HD22  LEU  94          HD22      LEU  94   9.438  13.662   8.708
   11   HD21  LEU  94          HD23      LEU  94   9.343  12.440   9.976

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  95           H        ILE  95  14.534  11.891   7.843
    2    HA   ILE  95           HA       ILE  95  15.717  12.773  10.265
    3    HB   ILE  95           HB       ILE  95  16.937  11.689   7.715
    4   HG12  ILE  95          HG12      ILE  95  16.606  10.481  10.475
    5   HG13  ILE  95          HG13      ILE  95  15.437  10.257   9.176
    6   HG21  ILE  95          HG21      ILE  95  18.204  12.453  10.364
    7   HG23  ILE  95          HG22      ILE  95  18.683  12.978   8.749
    8   HG22  ILE  95          HG23      ILE  95  18.949  11.308   9.249
    9   HD13  ILE  95          HD11      ILE  95  16.890   8.950   7.910
   10   HD12  ILE  95          HD12      ILE  95  17.348   8.482   9.545
   11   HD11  ILE  95          HD13      ILE  95  18.331   9.644   8.654

  No H/Q in entry =          11
  In of MODEL   17
    1    H    GLU  96           H        GLU  96  15.909  14.020   6.937
    2    HA   GLU  96           HA       GLU  96  17.802  16.052   7.430
    3    HB2  GLU  96           HB2      GLU  96  17.129  15.417   5.166
    4    HB3  GLU  96           HB3      GLU  96  15.498  16.011   5.465
    5    HG2  GLU  96           HG2      GLU  96  16.115  18.129   4.935
    6    HG3  GLU  96           HG3      GLU  96  17.411  18.093   6.120

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LEU  97           H        LEU  97  14.287  15.945   7.850
    2    HA   LEU  97           HA       LEU  97  13.933  18.685   8.505
    3    HB2  LEU  97           HB2      LEU  97  12.354  16.192   9.102
    4    HB3  LEU  97           HB3      LEU  97  11.876  17.747   9.780
    5    HG   LEU  97           HG       LEU  97  12.357  17.335   6.814
    6   HD12  LEU  97          HD11      LEU  97   9.831  17.267   6.689
    7   HD11  LEU  97          HD12      LEU  97   9.815  17.059   8.438
    8   HD13  LEU  97          HD13      LEU  97  10.570  15.838   7.412
    9   HD23  LEU  97          HD21      LEU  97  10.665  19.339   6.853
   10   HD22  LEU  97          HD22      LEU  97  12.353  19.657   7.251
   11   HD21  LEU  97          HD23      LEU  97  11.157  19.508   8.537

  No H/Q in entry =          11
  In of MODEL   17
    1    H    HIS  98           H        HIS  98  14.683  15.830  10.487
    2    HA   HIS  98           HA       HIS  98  14.548  17.081  13.010
    3    HB2  HIS  98           HB2      HIS  98  16.247  14.788  12.000
    4    HB3  HIS  98           HB3      HIS  98  16.254  15.318  13.684
    5    HD1  HIS  98           HD1      HIS  98  14.024  13.754  11.078
    6    HD2  HIS  98           HD2      HIS  98  13.928  14.655  15.147
    7    HE1  HIS  98           HE1      HIS  98  11.969  12.602  12.020
    8    HE2  HIS  98           HE2      HIS  98  11.890  13.143  14.494

  No H/Q in entry =           8
  In of MODEL   17
    1    H    GLU  99           H        GLU  99  17.104  16.918  10.580
    2    HA   GLU  99           HA       GLU  99  19.117  18.195  12.121
    3    HB2  GLU  99           HB2      GLU  99  19.571  16.907  10.046
    4    HB3  GLU  99           HB3      GLU  99  18.793  18.186   9.110
    5    HG2  GLU  99           HG2      GLU  99  20.438  19.813   9.913
    6    HG3  GLU  99           HG3      GLU  99  21.186  18.588  10.932

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LYS 100           H        LYS 100  16.627  19.428   9.905
    2    HA   LYS 100           HA       LYS 100  17.489  22.145  10.065
    3    HB2  LYS 100           HB2      LYS 100  14.828  20.923   9.298
    4    HB3  LYS 100           HB3      LYS 100  15.169  22.654   9.217
    5    HG2  LYS 100           HG2      LYS 100  17.133  22.166   7.753
    6    HG3  LYS 100           HG3      LYS 100  16.679  20.460   7.760
    7    HD2  LYS 100           HD2      LYS 100  14.499  21.027   6.758
    8    HD3  LYS 100           HD3      LYS 100  14.936  22.736   6.757
    9    HE2  LYS 100           HE2      LYS 100  16.887  22.216   5.299
   10    HE3  LYS 100           HE3      LYS 100  16.381  20.523   5.256
   11    HZ1  LYS 100           HZ1      LYS 100  14.611  22.763   4.429
   12    HZ3  LYS 100           HZ2      LYS 100  14.388  21.100   4.157
   13    HZ2  LYS 100           HZ3      LYS 100  15.621  21.937   3.343

  No H/Q in entry =          13
  In of MODEL   17
    1    H    LEU 101           H        LEU 101  15.338  20.139  12.015
    2    HA   LEU 101           HA       LEU 101  14.218  22.226  13.601
    3    HB2  LEU 101           HB2      LEU 101  14.588  19.265  13.970
    4    HB3  LEU 101           HB3      LEU 101  14.073  20.251  15.335
    5    HG   LEU 101           HG       LEU 101  12.664  20.387  12.663
    6   HD12  LEU 101          HD11      LEU 101  10.964  18.857  13.920
    7   HD11  LEU 101          HD12      LEU 101  12.346  18.405  14.916
    8   HD13  LEU 101          HD13      LEU 101  12.376  18.107  13.177
    9   HD21  LEU 101          HD21      LEU 101  12.019  21.181  15.518
   10   HD23  LEU 101          HD22      LEU 101  10.756  20.992  14.304
   11   HD22  LEU 101          HD23      LEU 101  12.021  22.198  14.076

  No H/Q in entry =          11
  In of MODEL   17
    1    H    LYS 102           H        LYS 102  17.351  21.545  13.169
    2    HA   LYS 102           HA       LYS 102  19.215  22.365  14.250
    3    HB2  LYS 102           HB2      LYS 102  17.436  23.918  15.387
    4    HB3  LYS 102           HB3      LYS 102  17.614  22.843  16.759
    5    HG2  LYS 102           HG2      LYS 102  19.558  24.814  15.605
    6    HG3  LYS 102           HG3      LYS 102  19.164  24.500  17.281
    7    HD2  LYS 102           HD2      LYS 102  20.789  22.557  15.589
    8    HD3  LYS 102           HD3      LYS 102  21.508  23.857  16.530
    9    HE2  LYS 102           HE2      LYS 102  21.045  21.313  17.484
   10    HE3  LYS 102           HE3      LYS 102  21.296  22.744  18.484
   11    HZ2  LYS 102           HZ1      LYS 102  19.296  21.505  19.091
   12    HZ1  LYS 102           HZ2      LYS 102  18.661  21.759  17.541
   13    HZ3  LYS 102           HZ3      LYS 102  18.921  23.077  18.575

  No H/Q in entry =          13
  In of MODEL   17
    1    H    ALA 103           H        ALA 103  17.100  20.798  16.659
    2    HA   ALA 103           HA       ALA 103  18.793  19.537  18.311
    3    HB2  ALA 103           HB1      ALA 103  17.160  17.568  18.291
    4    HB1  ALA 103           HB2      ALA 103  16.289  18.450  17.036
    5    HB3  ALA 103           HB3      ALA 103  16.481  19.158  18.639

  No H/Q in entry =           5
  In of MODEL   17
    1    H1   ALA   1           H3       ALA   1  -1.690  -6.611 -21.499
    2    H2   ALA   1           H2       ALA   1  -2.521  -8.028 -21.056
    3    H3   ALA   1           H1       ALA   1  -0.913  -8.115 -21.607
    4    HA   ALA   1           HA       ALA   1  -1.753  -8.553 -23.608
    5    HB1  ALA   1           HB1      ALA   1  -3.909  -9.220 -23.144
    6    HB2  ALA   1           HB2      ALA   1  -4.308  -7.695 -23.934
    7    HB3  ALA   1           HB3      ALA   1  -4.254  -7.786 -22.175

  No H/Q in entry =           7
  In of MODEL   17
    1    H    GLU   2           H        GLU   2  -2.549  -7.331 -25.593
    2    HA   GLU   2           HA       GLU   2  -1.098  -5.348 -26.456
    3    HB2  GLU   2           HB2      GLU   2  -4.105  -5.338 -26.781
    4    HB3  GLU   2           HB3      GLU   2  -2.961  -4.498 -27.823
    5    HG2  GLU   2           HG2      GLU   2  -2.502  -6.393 -28.987
    6    HG3  GLU   2           HG3      GLU   2  -2.231  -7.314 -27.514

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLU   3           H        GLU   3  -4.229  -4.018 -25.556
    2    HA   GLU   3           HA       GLU   3  -3.121  -1.492 -24.911
    3    HB2  GLU   3           HB2      GLU   3  -5.841  -2.741 -24.593
    4    HB3  GLU   3           HB3      GLU   3  -5.505  -1.138 -23.937
    5    HG2  GLU   3           HG2      GLU   3  -5.120  -0.208 -26.057
    6    HG3  GLU   3           HG3      GLU   3  -4.762  -1.769 -26.789

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LEU   4           H        LEU   4  -4.775  -3.823 -22.749
    2    HA   LEU   4           HA       LEU   4  -4.386  -2.617 -20.350
    3    HB2  LEU   4           HB2      LEU   4  -3.915  -5.569 -20.835
    4    HB3  LEU   4           HB3      LEU   4  -4.307  -4.821 -19.288
    5    HG   LEU   4           HG       LEU   4  -6.074  -4.837 -21.756
    6   HD13  LEU   4          HD11      LEU   4  -7.312  -6.530 -20.771
    7   HD12  LEU   4          HD12      LEU   4  -6.820  -6.091 -19.136
    8   HD11  LEU   4          HD13      LEU   4  -5.703  -6.957 -20.190
    9   HD23  LEU   4          HD21      LEU   4  -7.743  -3.994 -19.888
   10   HD22  LEU   4          HD22      LEU   4  -6.674  -2.845 -20.690
   11   HD21  LEU   4          HD23      LEU   4  -6.266  -3.454 -19.086

  No H/Q in entry =          11
  In of MODEL   17
    1    H    GLU   5           H        GLU   5  -1.930  -4.512 -22.085
    2    HA   GLU   5           HA       GLU   5   0.054  -4.289 -20.042
    3    HB2  GLU   5           HB2      GLU   5   0.081  -6.051 -21.802
    4    HB3  GLU   5           HB3      GLU   5   0.426  -4.808 -23.006
    5    HG2  GLU   5           HG2      GLU   5   2.502  -4.223 -21.832
    6    HG3  GLU   5           HG3      GLU   5   2.158  -5.428 -20.594

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLU   6           H        GLU   6  -0.530  -2.544 -23.078
    2    HA   GLU   6           HA       GLU   6   1.684  -0.768 -22.795
    3    HB2  GLU   6           HB2      GLU   6  -0.874  -0.572 -24.401
    4    HB3  GLU   6           HB3      GLU   6   0.450   0.588 -24.515
    5    HG2  GLU   6           HG2      GLU   6   0.767  -2.390 -24.969
    6    HG3  GLU   6           HG3      GLU   6   0.534  -1.217 -26.264

  No H/Q in entry =           6
  In of MODEL   17
    1    H    VAL   7           H        VAL   7  -1.658  -0.762 -21.759
    2    HA   VAL   7           HA       VAL   7  -1.814   1.950 -20.907
    3    HB   VAL   7           HB       VAL   7  -3.340  -0.535 -20.089
    4   HG11  VAL   7          HG11      VAL   7  -3.646   2.358 -19.259
    5   HG13  VAL   7          HG12      VAL   7  -3.584   0.926 -18.232
    6   HG12  VAL   7          HG13      VAL   7  -5.007   1.236 -19.226
    7   HG21  VAL   7          HG21      VAL   7  -3.464   0.559 -22.471
    8   HG23  VAL   7          HG22      VAL   7  -4.380   1.826 -21.655
    9   HG22  VAL   7          HG23      VAL   7  -4.968   0.163 -21.639

  No H/Q in entry =           9
  In of MODEL   17
    1    H    VAL   8           H        VAL   8  -0.905  -1.068 -19.279
    2    HA   VAL   8           HA       VAL   8  -0.567  -0.011 -16.676
    3    HB   VAL   8           HB       VAL   8   0.787  -2.352 -18.041
    4   HG12  VAL   8          HG11      VAL   8   1.263  -3.062 -15.660
    5   HG11  VAL   8          HG12      VAL   8   0.778  -1.447 -15.146
    6   HG13  VAL   8          HG13      VAL   8   2.180  -1.654 -16.196
    7   HG22  VAL   8          HG21      VAL   8  -1.029  -3.621 -17.392
    8   HG21  VAL   8          HG22      VAL   8  -1.860  -2.069 -17.351
    9   HG23  VAL   8          HG23      VAL   8  -1.209  -2.755 -15.866

  No H/Q in entry =           9
  In of MODEL   17
    1    H    MET   9           H        MET   9   1.681  -0.352 -19.420
    2    HA   MET   9           HA       MET   9   3.989   0.625 -18.147
    3    HB2  MET   9           HB2      MET   9   3.053   0.713 -21.015
    4    HB3  MET   9           HB3      MET   9   4.597   1.405 -20.520
    5    HG2  MET   9           HG2      MET   9   5.281  -0.772 -19.587
    6    HG3  MET   9           HG3      MET   9   3.732  -1.467 -20.069
    7    HE2  MET   9           HE1      MET   9   7.445  -0.961 -21.318
    8    HE1  MET   9           HE2      MET   9   6.642   0.586 -21.068
    9    HE3  MET   9           HE3      MET   9   7.113   0.099 -22.694

  No H/Q in entry =           9
  In of MODEL   17
    1    H    GLY  10           H        GLY  10   1.351   2.305 -19.822
    2    HA3  GLY  10           HA2      GLY  10   2.381   4.932 -19.560
    3    HA2  GLY  10           HA3      GLY  10   0.681   4.516 -19.771

  No H/Q in entry =           3
  In of MODEL   17
    1    H    LEU  11           H        LEU  11   0.237   2.987 -17.495
    2    HA   LEU  11           HA       LEU  11  -0.246   4.965 -15.525
    3    HB2  LEU  11           HB2      LEU  11  -0.257   1.948 -15.386
    4    HB3  LEU  11           HB3      LEU  11  -0.743   2.976 -14.039
    5    HG   LEU  11           HG       LEU  11  -1.972   3.138 -16.804
    6   HD13  LEU  11          HD11      LEU  11  -2.613   1.006 -16.062
    7   HD12  LEU  11          HD12      LEU  11  -3.938   2.030 -15.514
    8   HD11  LEU  11          HD13      LEU  11  -2.698   1.510 -14.374
    9   HD22  LEU  11          HD21      LEU  11  -2.512   5.163 -15.787
   10   HD21  LEU  11          HD22      LEU  11  -2.458   4.485 -14.160
   11   HD23  LEU  11          HD23      LEU  11  -3.840   4.161 -15.206

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  12           H        ILE  12   2.232   2.435 -15.776
    2    HA   ILE  12           HA       ILE  12   3.446   2.926 -13.267
    3    HB   ILE  12           HB       ILE  12   4.676   1.868 -15.834
    4   HG12  ILE  12          HG12      ILE  12   2.632   0.683 -14.695
    5   HG13  ILE  12          HG13      ILE  12   4.008  -0.286 -15.185
    6   HG21  ILE  12          HG21      ILE  12   5.650   1.820 -12.961
    7   HG23  ILE  12          HG22      ILE  12   6.462   2.527 -14.358
    8   HG22  ILE  12          HG23      ILE  12   6.305   0.778 -14.223
    9   HD13  ILE  12          HD11      ILE  12   4.826  -0.330 -12.906
   10   HD12  ILE  12          HD12      ILE  12   3.129  -0.809 -12.897
   11   HD11  ILE  12          HD13      ILE  12   3.587   0.806 -12.401

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  13           H        ILE  13   4.087   4.192 -16.516
    2    HA   ILE  13           HA       ILE  13   6.267   5.852 -15.777
    3    HB   ILE  13           HB       ILE  13   4.245   5.989 -18.027
    4   HG12  ILE  13          HG12      ILE  13   6.052   4.118 -17.752
    5   HG13  ILE  13          HG13      ILE  13   5.821   4.869 -19.327
    6   HG23  ILE  13          HG21      ILE  13   4.957   8.239 -17.843
    7   HG22  ILE  13          HG22      ILE  13   5.998   7.563 -19.089
    8   HG21  ILE  13          HG23      ILE  13   6.615   7.782 -17.453
    9   HD11  ILE  13          HD11      ILE  13   7.915   5.820 -17.340
   10   HD13  ILE  13          HD12      ILE  13   7.754   6.267 -19.035
   11   HD12  ILE  13          HD13      ILE  13   8.239   4.632 -18.601

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ASN  14           H        ASN  14   2.775   6.440 -16.048
    2    HA   ASN  14           HA       ASN  14   2.803   9.182 -15.395
    3    HB2  ASN  14           HB2      ASN  14   0.869   7.595 -16.239
    4    HB3  ASN  14           HB3      ASN  14   0.540   7.415 -14.520
    5   HD21  ASN  14          HD21      ASN  14  -1.446   8.632 -15.949
    6   HD22  ASN  14          HD22      ASN  14  -1.465  10.305 -15.672

  No H/Q in entry =           6
  In of MODEL   17
    1    H    SER  15           H        SER  15   2.429   6.302 -13.336
    2    HA   SER  15           HA       SER  15   2.154   7.666 -10.880
    3    HB2  SER  15           HB2      SER  15   2.651   5.560  -9.842
    4    HB3  SER  15           HB3      SER  15   1.807   5.173 -11.337
    5    HG   SER  15           HG       SER  15   3.543   3.937 -11.515

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLY  16           H        GLY  16   5.003   6.505 -12.641
    2    HA3  GLY  16           HA2      GLY  16   6.944   7.200 -10.702
    3    HA2  GLY  16           HA3      GLY  16   7.245   7.000 -12.427

  No H/Q in entry =           3
  In of MODEL   17
    1    H    GLN  17           H        GLN  17   5.608   9.007 -13.481
    2    HA   GLN  17           HA       GLN  17   7.244  11.305 -13.157
    3    HB2  GLN  17           HB2      GLN  17   5.942  10.904 -15.209
    4    HB3  GLN  17           HB3      GLN  17   4.441  11.086 -14.299
    5    HG2  GLN  17           HG2      GLN  17   5.045  13.401 -13.734
    6    HG3  GLN  17           HG3      GLN  17   6.563  13.227 -14.612
    7   HE21  GLN  17          HE21      GLN  17   6.449  14.100 -16.679
    8   HE22  GLN  17          HE22      GLN  17   5.050  14.148 -17.641

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ALA  18           H        ALA  18   4.116  10.358 -11.819
    2    HA   ALA  18           HA       ALA  18   3.449  12.757 -10.540
    3    HB1  ALA  18           HB1      ALA  18   2.259  10.331 -10.779
    4    HB2  ALA  18           HB2      ALA  18   1.739  11.558  -9.626
    5    HB3  ALA  18           HB3      ALA  18   2.796  10.246  -9.101

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ARG  19           H        ARG  19   5.251   9.941  -9.274
    2    HA   ARG  19           HA       ARG  19   5.807  11.071  -6.745
    3    HB2  ARG  19           HB2      ARG  19   6.163   8.662  -7.285
    4    HB3  ARG  19           HB3      ARG  19   7.532   9.120  -8.301
    5    HG2  ARG  19           HG2      ARG  19   8.674  10.120  -6.370
    6    HG3  ARG  19           HG3      ARG  19   7.287   9.761  -5.343
    7    HD2  ARG  19           HD2      ARG  19   9.007   8.080  -4.992
    8    HD3  ARG  19           HD3      ARG  19   7.615   7.337  -5.785
    9    HE   ARG  19           HE       ARG  19   9.344   8.125  -7.824
   10   HH21  ARG  19          HH11      ARG  19  10.871   6.687  -8.680
   11   HH22  ARG  19          HH12      ARG  19  11.381   5.321  -7.751
   12   HH11  ARG  19          HH21      ARG  19   9.360   6.078  -5.057
   13   HH12  ARG  19          HH22      ARG  19  10.523   4.975  -5.699

  No H/Q in entry =          13
  In of MODEL   17
    1    H    SER  20           H        SER  20   7.631  11.073  -9.790
    2    HA   SER  20           HA       SER  20   9.908  12.429  -8.954
    3    HB2  SER  20           HB2      SER  20   9.922  11.565 -11.163
    4    HB3  SER  20           HB3      SER  20   8.444  12.421 -11.588
    5    HG   SER  20           HG       SER  20  11.067  13.361 -11.321

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU  21           H        LEU  21   6.843  13.780 -10.149
    2    HA   LEU  21           HA       LEU  21   7.579  16.507  -9.908
    3    HB2  LEU  21           HB2      LEU  21   4.878  15.146  -9.843
    4    HB3  LEU  21           HB3      LEU  21   5.084  16.895  -9.833
    5    HG   LEU  21           HG       LEU  21   6.250  15.093 -11.976
    6   HD13  LEU  21          HD11      LEU  21   3.879  14.857 -12.165
    7   HD12  LEU  21          HD12      LEU  21   4.339  16.066 -13.365
    8   HD11  LEU  21          HD13      LEU  21   3.611  16.570 -11.840
    9   HD22  LEU  21          HD21      LEU  21   7.427  17.110 -12.132
   10   HD21  LEU  21          HD22      LEU  21   6.076  18.078 -11.549
   11   HD23  LEU  21          HD23      LEU  21   6.061  17.454 -13.191

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ALA  22           H        ALA  22   6.008  14.241  -7.676
    2    HA   ALA  22           HA       ALA  22   5.444  16.051  -5.599
    3    HB3  ALA  22           HB1      ALA  22   4.627  13.678  -5.778
    4    HB2  ALA  22           HB2      ALA  22   5.223  14.127  -4.179
    5    HB1  ALA  22           HB3      ALA  22   6.226  13.151  -5.254

  No H/Q in entry =           5
  In of MODEL   17
    1    H    TYR  23           H        TYR  23   8.330  13.960  -6.044
    2    HA   TYR  23           HA       TYR  23   9.733  14.934  -3.784
    3    HB2  TYR  23           HB2      TYR  23  10.475  12.915  -4.951
    4    HB3  TYR  23           HB3      TYR  23  10.812  13.854  -6.405
    5    HD1  TYR  23           HD1      TYR  23  11.768  13.457  -2.820
    6    HD2  TYR  23           HD2      TYR  23  12.869  14.998  -6.676
    7    HE1  TYR  23           HE1      TYR  23  14.037  13.977  -1.965
    8    HE2  TYR  23           HE2      TYR  23  15.137  15.520  -5.820
    9    HH   TYR  23           HH       TYR  23  15.947  15.125  -2.405

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ALA  24           H        ALA  24   9.582  16.064  -7.144
    2    HA   ALA  24           HA       ALA  24  11.524  18.104  -6.882
    3    HB2  ALA  24           HB1      ALA  24  11.087  18.189  -9.092
    4    HB3  ALA  24           HB2      ALA  24   9.548  18.971  -8.731
    5    HB1  ALA  24           HB3      ALA  24   9.634  17.217  -8.870

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA  25           H        ALA  25   8.040  17.994  -6.269
    2    HA   ALA  25           HA       ALA  25   7.620  20.719  -5.685
    3    HB1  ALA  25           HB1      ALA  25   5.915  18.759  -5.900
    4    HB2  ALA  25           HB2      ALA  25   5.574  20.050  -4.745
    5    HB3  ALA  25           HB3      ALA  25   6.229  18.510  -4.182

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU  26           H        LEU  26   8.625  18.005  -3.648
    2    HA   LEU  26           HA       LEU  26   8.757  19.420  -1.203
    3    HB2  LEU  26           HB2      LEU  26   8.799  17.002  -1.211
    4    HB3  LEU  26           HB3      LEU  26  10.271  16.983  -2.179
    5    HG   LEU  26           HG       LEU  26  11.507  18.064  -0.330
    6   HD12  LEU  26          HD11      LEU  26  10.277  18.086   1.927
    7   HD11  LEU  26          HD12      LEU  26   8.788  17.986   0.989
    8   HD13  LEU  26          HD13      LEU  26   9.864  19.370   0.790
    9   HD21  LEU  26          HD21      LEU  26   9.918  15.625   0.526
   10   HD23  LEU  26          HD22      LEU  26  11.444  16.151   1.229
   11   HD22  LEU  26          HD23      LEU  26  11.390  15.602  -0.444

  No H/Q in entry =          11
  In of MODEL   17
    1    H    LYS  27           H        LYS  27  11.165  18.809  -3.727
    2    HA   LYS  27           HA       LYS  27  13.373  19.996  -2.488
    3    HB2  LYS  27           HB2      LYS  27  13.450  18.658  -4.585
    4    HB3  LYS  27           HB3      LYS  27  12.715  20.011  -5.445
    5    HG2  LYS  27           HG2      LYS  27  14.611  21.453  -4.856
    6    HG3  LYS  27           HG3      LYS  27  15.341  20.140  -3.925
    7    HD2  LYS  27           HD2      LYS  27  15.459  18.761  -5.986
    8    HD3  LYS  27           HD3      LYS  27  14.774  20.099  -6.909
    9    HE2  LYS  27           HE2      LYS  27  16.691  21.521  -6.285
   10    HE3  LYS  27           HE3      LYS  27  17.380  20.187  -5.353
   11    HZ3  LYS  27           HZ1      LYS  27  18.376  20.278  -7.538
   12    HZ2  LYS  27           HZ2      LYS  27  16.848  20.196  -8.281
   13    HZ1  LYS  27           HZ3      LYS  27  17.442  18.867  -7.403

  No H/Q in entry =          13
  In of MODEL   17
    1    H    GLN  28           H        GLN  28  10.784  21.444  -4.434
    2    HA   GLN  28           HA       GLN  28  11.800  24.076  -4.571
    3    HB2  GLN  28           HB2      GLN  28   8.943  23.069  -4.466
    4    HB3  GLN  28           HB3      GLN  28   9.397  24.732  -4.840
    5    HG2  GLN  28           HG2      GLN  28  10.319  22.290  -6.384
    6    HG3  GLN  28           HG3      GLN  28   9.029  23.379  -6.893
    7   HE21  GLN  28          HE21      GLN  28  12.145  22.760  -7.617
    8   HE22  GLN  28          HE22      GLN  28  12.698  24.325  -7.976

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ALA  29           H        ALA  29   9.828  22.411  -2.147
    2    HA   ALA  29           HA       ALA  29   9.322  24.605  -0.454
    3    HB2  ALA  29           HB1      ALA  29   8.558  23.044   1.104
    4    HB1  ALA  29           HB2      ALA  29   9.755  21.837   0.635
    5    HB3  ALA  29           HB3      ALA  29   8.377  22.165  -0.414

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LYS  30           H        LYS  30  12.005  22.282  -0.531
    2    HA   LYS  30           HA       LYS  30  13.338  23.196   1.779
    3    HB2  LYS  30           HB2      LYS  30  14.412  21.901  -0.737
    4    HB3  LYS  30           HB3      LYS  30  15.399  22.232   0.688
    5    HG2  LYS  30           HG2      LYS  30  13.815  20.874   2.058
    6    HG3  LYS  30           HG3      LYS  30  12.924  20.479   0.584
    7    HD2  LYS  30           HD2      LYS  30  14.950  19.456  -0.379
    8    HD3  LYS  30           HD3      LYS  30  15.860  19.865   1.077
    9    HE2  LYS  30           HE2      LYS  30  14.324  18.458   2.421
   10    HE3  LYS  30           HE3      LYS  30  13.443  18.028   0.949
   11    HZ2  LYS  30           HZ1      LYS  30  15.200  16.409   1.704
   12    HZ1  LYS  30           HZ2      LYS  30  16.362  17.575   1.261
   13    HZ3  LYS  30           HZ3      LYS  30  15.315  16.919   0.091

  No H/Q in entry =          13
  In of MODEL   17
    1    H    GLN  31           H        GLN  31  13.260  24.421  -1.511
    2    HA   GLN  31           HA       GLN  31  15.450  26.267  -1.076
    3    HB2  GLN  31           HB2      GLN  31  13.412  26.368  -3.304
    4    HB3  GLN  31           HB3      GLN  31  15.046  27.030  -3.298
    5    HG2  GLN  31           HG2      GLN  31  15.452  24.322  -2.737
    6    HG3  GLN  31           HG3      GLN  31  14.149  24.301  -3.918
    7   HE21  GLN  31          HE21      GLN  31  16.976  23.452  -4.322
    8   HE22  GLN  31          HE22      GLN  31  17.571  24.420  -5.582

  No H/Q in entry =           8
  In of MODEL   17
    1    H    GLY  32           H        GLY  32  12.371  26.142   0.063
    2    HA3  GLY  32           HA2      GLY  32  11.245  27.726   1.343
    3    HA2  GLY  32           HA3      GLY  32  12.397  28.941   0.802

  No H/Q in entry =           3
  In of MODEL   17
    1    H    ASP  33           H        ASP  33  10.997  27.079  -1.703
    2    HA   ASP  33           HA       ASP  33   9.382  29.391  -2.549
    3    HB2  ASP  33           HB2      ASP  33  10.427  26.957  -4.003
    4    HB3  ASP  33           HB3      ASP  33   9.300  28.100  -4.729

  No H/Q in entry =           4
  In of MODEL   17
    1    H    PHE  34           H        PHE  34   7.681  28.941  -0.990
    2    HA   PHE  34           HA       PHE  34   6.251  26.497  -0.910
    3    HB2  PHE  34           HB2      PHE  34   5.346  29.300  -0.217
    4    HB3  PHE  34           HB3      PHE  34   4.466  27.825   0.185
    5    HD1  PHE  34           HD1      PHE  34   6.763  30.170   1.416
    6    HD2  PHE  34           HD2      PHE  34   5.996  25.944   1.338
    7    HE1  PHE  34           HE1      PHE  34   8.145  29.880   3.453
    8    HE2  PHE  34           HE2      PHE  34   7.380  25.658   3.374
    9    HZ   PHE  34           HZ       PHE  34   8.449  27.627   4.431

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ALA  35           H        ALA  35   5.883  29.380  -2.906
    2    HA   ALA  35           HA       ALA  35   3.321  28.824  -3.938
    3    HB1  ALA  35           HB1      ALA  35   4.405  30.205  -5.967
    4    HB3  ALA  35           HB2      ALA  35   5.628  30.535  -4.739
    5    HB2  ALA  35           HB3      ALA  35   3.945  30.977  -4.449

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA  36           H        ALA  36   6.537  28.092  -5.291
    2    HA   ALA  36           HA       ALA  36   5.523  26.696  -7.544
    3    HB3  ALA  36           HB1      ALA  36   7.685  26.779  -8.156
    4    HB2  ALA  36           HB2      ALA  36   8.143  25.734  -6.810
    5    HB1  ALA  36           HB3      ALA  36   8.073  27.482  -6.586

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA  37           H        ALA  37   6.453  25.664  -4.293
    2    HA   ALA  37           HA       ALA  37   6.338  22.880  -4.738
    3    HB2  ALA  37           HB1      ALA  37   6.110  24.663  -2.350
    4    HB1  ALA  37           HB2      ALA  37   7.217  23.324  -2.648
    5    HB3  ALA  37           HB3      ALA  37   5.548  23.002  -2.181

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LYS  38           H        LYS  38   3.849  25.133  -3.562
    2    HA   LYS  38           HA       LYS  38   1.713  23.362  -3.352
    3    HB2  LYS  38           HB2      LYS  38   2.120  26.109  -3.085
    4    HB3  LYS  38           HB3      LYS  38   0.920  25.993  -4.367
    5    HG2  LYS  38           HG2      LYS  38  -0.559  24.692  -2.934
    6    HG3  LYS  38           HG3      LYS  38   0.682  24.600  -1.676
    7    HD2  LYS  38           HD2      LYS  38   0.543  26.937  -1.216
    8    HD3  LYS  38           HD3      LYS  38  -0.360  27.253  -2.698
    9    HE2  LYS  38           HE2      LYS  38  -1.866  27.307  -0.761
   10    HE3  LYS  38           HE3      LYS  38  -2.266  25.944  -1.811
   11    HZ3  LYS  38           HZ1      LYS  38  -1.573  24.451  -0.285
   12    HZ2  LYS  38           HZ2      LYS  38  -1.900  25.709   0.811
   13    HZ1  LYS  38           HZ3      LYS  38  -0.310  25.428   0.287

  No H/Q in entry =          13
  In of MODEL   17
    1    H    ALA  39           H        ALA  39   2.736  25.260  -6.189
    2    HA   ALA  39           HA       ALA  39   0.645  24.444  -7.900
    3    HB2  ALA  39           HB1      ALA  39   3.396  25.042  -8.946
    4    HB1  ALA  39           HB2      ALA  39   2.454  26.319  -8.175
    5    HB3  ALA  39           HB3      ALA  39   1.827  25.502  -9.607

  No H/Q in entry =           5
  In of MODEL   17
    1    H    MET  40           H        MET  40   3.855  23.077  -7.322
    2    HA   MET  40           HA       MET  40   3.720  21.070  -9.325
    3    HB2  MET  40           HB2      MET  40   5.331  21.247  -6.773
    4    HB3  MET  40           HB3      MET  40   5.559  19.992  -7.994
    5    HG2  MET  40           HG2      MET  40   5.677  22.950  -8.643
    6    HG3  MET  40           HG3      MET  40   7.104  22.016  -8.196
    7    HE3  MET  40           HE1      MET  40   7.936  19.799 -11.016
    8    HE2  MET  40           HE2      MET  40   7.363  19.482  -9.381
    9    HE1  MET  40           HE3      MET  40   8.486  20.809  -9.671

  No H/Q in entry =           9
  In of MODEL   17
    1    H    MET  41           H        MET  41   2.800  21.112  -5.902
    2    HA   MET  41           HA       MET  41   2.212  18.357  -5.640
    3    HB2  MET  41           HB2      MET  41   0.925  20.733  -4.278
    4    HB3  MET  41           HB3      MET  41   0.734  19.056  -3.780
    5    HG2  MET  41           HG2      MET  41   3.449  19.225  -3.812
    6    HG3  MET  41           HG3      MET  41   3.041  20.890  -3.408
    7    HE2  MET  41           HE1      MET  41  -0.026  19.689  -1.694
    8    HE1  MET  41           HE2      MET  41   0.822  21.187  -2.061
    9    HE3  MET  41           HE3      MET  41   0.748  20.609  -0.397

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ASP  42           H        ASP  42   0.230  21.127  -6.602
    2    HA   ASP  42           HA       ASP  42  -2.237  19.816  -6.750
    3    HB2  ASP  42           HB2      ASP  42  -1.479  22.373  -6.992
    4    HB3  ASP  42           HB3      ASP  42  -1.635  21.991  -8.703

  No H/Q in entry =           4
  In of MODEL   17
    1    H    GLN  43           H        GLN  43   0.219  20.372  -9.245
    2    HA   GLN  43           HA       GLN  43  -1.190  19.092 -11.344
    3    HB2  GLN  43           HB2      GLN  43   1.777  19.547 -10.955
    4    HB3  GLN  43           HB3      GLN  43   1.053  18.929 -12.442
    5    HG2  GLN  43           HG2      GLN  43  -0.418  20.986 -12.474
    6    HG3  GLN  43           HG3      GLN  43   0.546  21.616 -11.142
    7   HE21  GLN  43          HE21      GLN  43   0.742  23.244 -13.219
    8   HE22  GLN  43          HE22      GLN  43   2.154  23.000 -14.125

  No H/Q in entry =           8
  In of MODEL   17
    1    H    SER  44           H        SER  44   1.133  17.892  -8.956
    2    HA   SER  44           HA       SER  44   1.418  15.285  -9.995
    3    HB2  SER  44           HB2      SER  44   2.338  16.694  -7.749
    4    HB3  SER  44           HB3      SER  44   1.447  15.324  -7.087
    5    HG   SER  44           HG       SER  44   3.546  14.665  -7.514

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ARG  45           H        ARG  45  -0.879  16.636  -7.653
    2    HA   ARG  45           HA       ARG  45  -2.313  14.300  -7.033
    3    HB2  ARG  45           HB2      ARG  45  -2.471  16.465  -5.830
    4    HB3  ARG  45           HB3      ARG  45  -3.311  17.156  -7.215
    5    HG2  ARG  45           HG2      ARG  45  -5.111  15.463  -6.944
    6    HG3  ARG  45           HG3      ARG  45  -4.281  14.827  -5.523
    7    HD2  ARG  45           HD2      ARG  45  -4.445  17.092  -4.454
    8    HD3  ARG  45           HD3      ARG  45  -5.420  17.638  -5.836
    9    HE   ARG  45           HE       ARG  45  -6.577  15.278  -4.810
   10   HH21  ARG  45          HH11      ARG  45  -8.413  15.383  -3.542
   11   HH22  ARG  45          HH12      ARG  45  -8.782  16.825  -2.666
   12   HH11  ARG  45          HH21      ARG  45  -5.970  18.508  -3.768
   13   HH12  ARG  45          HH22      ARG  45  -7.393  18.595  -2.792

  No H/Q in entry =          13
  In of MODEL   17
    1    H    MET  46           H        MET  46  -2.846  16.729  -9.572
    2    HA   MET  46           HA       MET  46  -5.205  15.607 -10.644
    3    HB2  MET  46           HB2      MET  46  -3.068  17.403 -11.800
    4    HB3  MET  46           HB3      MET  46  -4.453  16.874 -12.761
    5    HG2  MET  46           HG2      MET  46  -5.994  17.829 -11.125
    6    HG3  MET  46           HG3      MET  46  -4.652  18.281 -10.080
    7    HE1  MET  46           HE1      MET  46  -6.383  18.464 -13.295
    8    HE3  MET  46           HE2      MET  46  -4.934  18.820 -14.229
    9    HE2  MET  46           HE3      MET  46  -6.132  20.084 -13.958

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ALA  47           H        ALA  47  -1.785  15.067 -11.399
    2    HA   ALA  47           HA       ALA  47  -2.159  13.358 -13.619
    3    HB3  ALA  47           HB1      ALA  47   0.034  14.204 -13.259
    4    HB2  ALA  47           HB2      ALA  47   0.142  12.472 -12.934
    5    HB1  ALA  47           HB3      ALA  47   0.069  13.618 -11.595

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU  48           H        LEU  48  -1.908  12.698 -10.148
    2    HA   LEU  48           HA       LEU  48  -2.056   9.862 -10.322
    3    HB2  LEU  48           HB2      LEU  48  -2.787  11.782  -8.099
    4    HB3  LEU  48           HB3      LEU  48  -2.727  10.029  -7.908
    5    HG   LEU  48           HG       LEU  48  -0.394  11.690  -8.892
    6   HD13  LEU  48          HD11      LEU  48  -0.666  12.453  -6.698
    7   HD12  LEU  48          HD12      LEU  48   0.471  11.123  -6.504
    8   HD11  LEU  48          HD13      LEU  48  -1.232  10.890  -6.111
    9   HD22  LEU  48          HD21      LEU  48   0.064   9.499  -9.544
   10   HD21  LEU  48          HD22      LEU  48  -0.822   8.792  -8.193
   11   HD23  LEU  48          HD23      LEU  48   0.765   9.514  -7.926

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ASN  49           H        ASN  49  -4.472  12.398  -9.911
    2    HA   ASN  49           HA       ASN  49  -6.690  10.772  -9.384
    3    HB2  ASN  49           HB2      ASN  49  -6.719  13.186  -9.041
    4    HB3  ASN  49           HB3      ASN  49  -6.518  13.466 -10.766
    5   HD21  ASN  49          HD21      ASN  49  -8.771  11.890  -8.458
    6   HD22  ASN  49          HD22      ASN  49 -10.165  12.214  -9.368

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLU  50           H        GLU  50  -5.383  11.961 -12.463
    2    HA   GLU  50           HA       GLU  50  -7.357  10.752 -14.119
    3    HB2  GLU  50           HB2      GLU  50  -5.856  12.547 -14.921
    4    HB3  GLU  50           HB3      GLU  50  -4.483  11.448 -14.786
    5    HG2  GLU  50           HG2      GLU  50  -5.482   9.940 -16.433
    6    HG3  GLU  50           HG3      GLU  50  -6.923  10.946 -16.518

  No H/Q in entry =           6
  In of MODEL   17
    1    H    ALA  51           H        ALA  51  -4.208   9.693 -12.913
    2    HA   ALA  51           HA       ALA  51  -4.112   7.246 -14.344
    3    HB2  ALA  51           HB1      ALA  51  -2.139   6.914 -13.242
    4    HB1  ALA  51           HB2      ALA  51  -2.822   7.341 -11.673
    5    HB3  ALA  51           HB3      ALA  51  -2.341   8.609 -12.800

  No H/Q in entry =           5
  In of MODEL   17
    1    H    HIS  52           H        HIS  52  -5.276   8.082 -11.093
    2    HA   HIS  52           HA       HIS  52  -6.012   5.481 -10.277
    3    HB2  HIS  52           HB2      HIS  52  -5.838   7.445  -8.763
    4    HB3  HIS  52           HB3      HIS  52  -7.295   8.110  -9.500
    5    HD1  HIS  52           HD1      HIS  52  -9.547   6.854  -9.051
    6    HD2  HIS  52           HD2      HIS  52  -6.284   5.287  -6.985
    7    HE1  HIS  52           HE1      HIS  52 -10.494   5.297  -7.293
    8    HE2  HIS  52           HE2      HIS  52  -8.516   4.332  -6.023

  No H/Q in entry =           8
  In of MODEL   17
    1    H    LEU  53           H        LEU  53  -7.781   7.983 -12.055
    2    HA   LEU  53           HA       LEU  53 -10.311   6.740 -12.079
    3    HB2  LEU  53           HB2      LEU  53  -8.985   8.705 -13.935
    4    HB3  LEU  53           HB3      LEU  53 -10.596   8.073 -14.265
    5    HG   LEU  53           HG       LEU  53  -9.872   9.348 -11.609
    6   HD11  LEU  53          HD11      LEU  53 -10.868  10.594 -14.173
    7   HD13  LEU  53          HD12      LEU  53  -9.517  11.105 -13.160
    8   HD12  LEU  53          HD13      LEU  53 -11.173  11.334 -12.606
    9   HD23  LEU  53          HD21      LEU  53 -12.444   9.814 -11.776
   10   HD22  LEU  53          HD22      LEU  53 -11.906   8.197 -11.335
   11   HD21  LEU  53          HD23      LEU  53 -12.444   8.525 -12.972

  No H/Q in entry =          11
  In of MODEL   17
    1    H    VAL  54           H        VAL  54  -7.560   6.501 -14.312
    2    HA   VAL  54           HA       VAL  54  -8.813   4.765 -16.167
    3    HB   VAL  54           HB       VAL  54  -5.898   5.210 -15.476
    4   HG12  VAL  54          HG11      VAL  54  -5.667   4.134 -17.871
    5   HG11  VAL  54          HG12      VAL  54  -7.211   3.381 -17.474
    6   HG13  VAL  54          HG13      VAL  54  -5.803   3.093 -16.454
    7   HG22  VAL  54          HG21      VAL  54  -6.627   7.174 -16.512
    8   HG21  VAL  54          HG22      VAL  54  -7.835   6.339 -17.487
    9   HG23  VAL  54          HG23      VAL  54  -6.129   6.228 -17.915

  No H/Q in entry =           9
  In of MODEL   17
    1    H    GLN  55           H        GLN  55  -6.832   4.164 -13.266
    2    HA   GLN  55           HA       GLN  55  -6.797   1.347 -13.538
    3    HB2  GLN  55           HB2      GLN  55  -5.227   2.204 -12.011
    4    HB3  GLN  55           HB3      GLN  55  -6.426   3.190 -11.178
    5    HG2  GLN  55           HG2      GLN  55  -7.152   1.439  -9.872
    6    HG3  GLN  55           HG3      GLN  55  -6.948   0.255 -11.156
    7   HE21  GLN  55          HE21      GLN  55  -5.355  -1.229 -10.666
    8   HE22  GLN  55          HE22      GLN  55  -3.965  -0.910  -9.749

  No H/Q in entry =           8
  In of MODEL   17
    1    H    THR  56           H        THR  56  -9.088   3.547 -11.917
    2    HA   THR  56           HA       THR  56 -10.712   1.688 -10.641
    3    HB   THR  56           HB       THR  56 -11.764   4.102 -12.137
    4    HG1  THR  56           HG1      THR  56  -9.952   3.945 -10.165
    5   HG22  THR  56          HG21      THR  56 -13.235   4.097 -10.000
    6   HG21  THR  56          HG22      THR  56 -12.683   2.433  -9.805
    7   HG23  THR  56          HG23      THR  56 -13.581   2.902 -11.249

  No H/Q in entry =           7
  In of MODEL   17
    1    H    LYS  57           H        LYS  57 -10.885   2.793 -14.021
    2    HA   LYS  57           HA       LYS  57 -13.073   1.153 -14.789
    3    HB2  LYS  57           HB2      LYS  57 -12.141   3.098 -16.088
    4    HB3  LYS  57           HB3      LYS  57 -10.736   2.114 -16.472
    5    HG2  LYS  57           HG2      LYS  57 -12.147   0.495 -17.644
    6    HG3  LYS  57           HG3      LYS  57 -13.590   1.405 -17.210
    7    HD2  LYS  57           HD2      LYS  57 -13.079   2.052 -19.449
    8    HD3  LYS  57           HD3      LYS  57 -12.534   3.392 -18.442
    9    HE2  LYS  57           HE2      LYS  57 -10.239   2.703 -18.602
   10    HE3  LYS  57           HE3      LYS  57 -10.677   1.148 -19.309
   11    HZ3  LYS  57           HZ1      LYS  57 -11.463   2.253 -21.266
   12    HZ2  LYS  57           HZ2      LYS  57  -9.874   2.764 -20.949
   13    HZ1  LYS  57           HZ3      LYS  57 -11.187   3.779 -20.580

  No H/Q in entry =          13
  In of MODEL   17
    1    H    LEU  58           H        LEU  58  -9.578   0.652 -14.726
    2    HA   LEU  58           HA       LEU  58  -9.633  -1.858 -16.028
    3    HB2  LEU  58           HB2      LEU  58  -7.578  -0.616 -14.208
    4    HB3  LEU  58           HB3      LEU  58  -7.345  -2.138 -15.069
    5    HG   LEU  58           HG       LEU  58  -8.044   0.488 -16.421
    6   HD11  LEU  58          HD11      LEU  58  -5.424  -0.805 -15.730
    7   HD13  LEU  58          HD12      LEU  58  -5.886   0.895 -15.674
    8   HD12  LEU  58          HD13      LEU  58  -5.558   0.125 -17.223
    9   HD22  LEU  58          HD21      LEU  58  -8.647  -1.054 -18.022
   10   HD21  LEU  58          HD22      LEU  58  -7.632  -2.326 -17.344
   11   HD23  LEU  58          HD23      LEU  58  -6.914  -1.061 -18.341

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  59           H        ILE  59 -10.444  -0.955 -12.774
    2    HA   ILE  59           HA       ILE  59 -10.151  -3.734 -11.840
    3    HB   ILE  59           HB       ILE  59  -9.668  -1.478 -10.430
    4   HG12  ILE  59          HG12      ILE  59 -11.072  -3.818  -9.120
    5   HG13  ILE  59          HG13      ILE  59  -9.429  -3.916  -9.705
    6   HG21  ILE  59          HG21      ILE  59 -12.195  -0.921 -10.678
    7   HG23  ILE  59          HG22      ILE  59 -11.483  -0.773  -9.088
    8   HG22  ILE  59          HG23      ILE  59 -12.452  -2.185  -9.500
    9   HD11  ILE  59          HD11      ILE  59 -10.400  -1.852  -7.743
   10   HD13  ILE  59          HD12      ILE  59  -8.734  -2.094  -8.252
   11   HD12  ILE  59          HD13      ILE  59  -9.550  -3.323  -7.283

  No H/Q in entry =          11
  In of MODEL   17
    1    H    GLU  60           H        GLU  60 -12.660  -1.364 -12.642
    2    HA   GLU  60           HA       GLU  60 -14.877  -2.842 -11.642
    3    HB2  GLU  60           HB2      GLU  60 -15.110  -0.490 -12.194
    4    HB3  GLU  60           HB3      GLU  60 -14.673  -0.800 -13.872
    5    HG2  GLU  60           HG2      GLU  60 -16.695  -2.222 -14.119
    6    HG3  GLU  60           HG3      GLU  60 -17.145  -1.843 -12.469

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLY  61           H        GLY  61 -13.196  -2.844 -14.753
    2    HA3  GLY  61           HA2      GLY  61 -14.950  -5.051 -15.659
    3    HA2  GLY  61           HA3      GLY  61 -14.081  -3.957 -16.729

  No H/Q in entry =           3
  In of MODEL   17
    1    H    ASP  62           H        ASP  62 -12.745  -5.451 -13.848
    2    HA   ASP  62           HA       ASP  62 -10.505  -6.461 -15.330
    3    HB2  ASP  62           HB2      ASP  62  -9.796  -7.298 -13.086
    4    HB3  ASP  62           HB3      ASP  62 -10.181  -5.580 -13.098

  No H/Q in entry =           4
  In of MODEL   17
    1    H    ALA  63           H        ALA  63 -10.482  -8.347 -16.456
    2    HA   ALA  63           HA       ALA  63 -12.073 -10.639 -15.408
    3    HB1  ALA  63           HB1      ALA  63 -12.997  -9.642 -17.526
    4    HB2  ALA  63           HB2      ALA  63 -12.474 -11.313 -17.724
    5    HB3  ALA  63           HB3      ALA  63 -11.461  -9.995 -18.314

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLY  64           H        GLY  64  -9.215  -9.524 -17.118
    2    HA3  GLY  64           HA2      GLY  64  -7.093 -10.382 -17.292
    3    HA2  GLY  64           HA3      GLY  64  -7.503 -11.491 -15.991

  No H/Q in entry =           3
  In of MODEL   17
    1    H    GLU  65           H        GLU  65  -6.166 -13.014 -17.284
    2    HA   GLU  65           HA       GLU  65  -6.944 -13.858 -19.858
    3    HB2  GLU  65           HB2      GLU  65  -5.371 -15.269 -17.705
    4    HB3  GLU  65           HB3      GLU  65  -5.582 -15.900 -19.339
    5    HG2  GLU  65           HG2      GLU  65  -4.549 -13.900 -20.285
    6    HG3  GLU  65           HG3      GLU  65  -4.411 -13.184 -18.680

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLY  66           H        GLY  66  -7.849 -14.949 -16.683
    2    HA3  GLY  66           HA2      GLY  66  -9.526 -17.112 -17.668
    3    HA2  GLY  66           HA3      GLY  66  -9.178 -16.737 -15.992

  No H/Q in entry =           3
  In of MODEL   17
    1    H    LYS  67           H        LYS  67 -11.651 -17.381 -16.434
    2    HA   LYS  67           HA       LYS  67 -13.417 -15.382 -17.331
    3    HB2  LYS  67           HB2      LYS  67 -13.834 -17.781 -15.555
    4    HB3  LYS  67           HB3      LYS  67 -15.148 -16.775 -16.177
    5    HG2  LYS  67           HG2      LYS  67 -14.384 -17.188 -18.485
    6    HG3  LYS  67           HG3      LYS  67 -13.064 -18.183 -17.874
    7    HD2  LYS  67           HD2      LYS  67 -14.695 -19.754 -16.896
    8    HD3  LYS  67           HD3      LYS  67 -16.018 -18.757 -17.505
    9    HE2  LYS  67           HE2      LYS  67 -15.244 -19.107 -19.814
   10    HE3  LYS  67           HE3      LYS  67 -13.893 -20.075 -19.223
   11    HZ3  LYS  67           HZ1      LYS  67 -15.618 -21.545 -19.891
   12    HZ2  LYS  67           HZ2      LYS  67 -16.783 -20.698 -18.993
   13    HZ1  LYS  67           HZ3      LYS  67 -15.565 -21.572 -18.196

  No H/Q in entry =          13
  In of MODEL   17
    1    H    MET  68           H        MET  68 -13.630 -16.576 -14.065
    2    HA   MET  68           HA       MET  68 -14.730 -14.227 -12.975
    3    HB2  MET  68           HB2      MET  68 -13.540 -16.708 -11.760
    4    HB3  MET  68           HB3      MET  68 -14.206 -15.407 -10.773
    5    HG2  MET  68           HG2      MET  68 -16.379 -15.673 -11.702
    6    HG3  MET  68           HG3      MET  68 -15.771 -16.664 -13.030
    7    HE1  MET  68           HE1      MET  68 -15.589 -16.275  -9.269
    8    HE3  MET  68           HE2      MET  68 -14.144 -17.254  -9.513
    9    HE2  MET  68           HE3      MET  68 -15.512 -17.923  -8.625

  No H/Q in entry =           9
  In of MODEL   17
    1    H    LYS  69           H        LYS  69 -11.362 -15.436 -12.856
    2    HA   LYS  69           HA       LYS  69 -10.376 -13.701 -10.931
    3    HB2  LYS  69           HB2      LYS  69  -8.154 -14.186 -11.855
    4    HB3  LYS  69           HB3      LYS  69  -9.150 -15.642 -11.784
    5    HG2  LYS  69           HG2      LYS  69  -9.691 -15.443 -14.152
    6    HG3  LYS  69           HG3      LYS  69  -8.836 -13.906 -14.251
    7    HD2  LYS  69           HD2      LYS  69  -7.359 -15.594 -15.125
    8    HD3  LYS  69           HD3      LYS  69  -6.741 -15.136 -13.537
    9    HE2  LYS  69           HE2      LYS  69  -7.577 -17.104 -12.516
   10    HE3  LYS  69           HE3      LYS  69  -8.647 -17.451 -13.873
   11    HZ1  LYS  69           HZ1      LYS  69  -5.679 -17.492 -13.985
   12    HZ3  LYS  69           HZ2      LYS  69  -6.737 -17.891 -15.252
   13    HZ2  LYS  69           HZ3      LYS  69  -6.668 -18.864 -13.861

  No H/Q in entry =          13
  In of MODEL   17
    1    H    VAL  70           H        VAL  70  -8.206 -12.308 -11.838
    2    HA   VAL  70           HA       VAL  70  -9.301 -10.168 -13.569
    3    HB   VAL  70           HB       VAL  70  -8.208  -8.532 -12.043
    4   HG13  VAL  70          HG11      VAL  70  -9.939  -8.619 -10.334
    5   HG12  VAL  70          HG12      VAL  70 -10.197 -10.338 -10.637
    6   HG11  VAL  70          HG13      VAL  70 -10.634  -9.151 -11.865
    7   HG21  VAL  70          HG21      VAL  70  -7.762 -11.013 -10.341
    8   HG23  VAL  70          HG22      VAL  70  -7.596  -9.364  -9.743
    9   HG22  VAL  70          HG23      VAL  70  -6.517  -9.956 -11.004

  No H/Q in entry =           9
  In of MODEL   17
    1    H    SER  71           H        SER  71  -7.592  -8.755 -14.435
    2    HA   SER  71           HA       SER  71  -5.484 -10.203 -15.660
    3    HB2  SER  71           HB2      SER  71  -6.474  -8.149 -16.636
    4    HB3  SER  71           HB3      SER  71  -5.795  -7.209 -15.310
    5    HG   SER  71           HG       SER  71  -4.511  -7.306 -17.288

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU  72           H        LEU  72  -3.386 -10.470 -15.098
    2    HA   LEU  72           HA       LEU  72  -2.669 -10.282 -12.384
    3    HB2  LEU  72           HB2      LEU  72  -1.012 -10.729 -14.863
    4    HB3  LEU  72           HB3      LEU  72  -0.364 -10.832 -13.229
    5    HG   LEU  72           HG       LEU  72  -2.746 -12.462 -14.172
    6   HD12  LEU  72          HD11      LEU  72  -1.099 -14.349 -14.287
    7   HD11  LEU  72          HD12      LEU  72   0.198 -13.178 -14.057
    8   HD13  LEU  72          HD13      LEU  72  -0.810 -13.103 -15.502
    9   HD21  LEU  72          HD21      LEU  72  -1.027 -12.387 -11.699
   10   HD23  LEU  72          HD22      LEU  72  -1.776 -13.903 -12.174
   11   HD22  LEU  72          HD23      LEU  72  -2.780 -12.500 -11.818

  No H/Q in entry =          11
  In of MODEL   17
    1    H    VAL  73           H        VAL  73  -1.905  -8.268 -15.154
    2    HA   VAL  73           HA       VAL  73   0.048  -6.614 -14.038
    3    HB   VAL  73           HB       VAL  73  -0.341  -5.158 -15.881
    4   HG11  VAL  73          HG11      VAL  73   0.442  -7.591 -16.271
    5   HG13  VAL  73          HG12      VAL  73  -0.107  -6.679 -17.676
    6   HG12  VAL  73          HG13      VAL  73  -1.172  -7.865 -16.921
    7   HG22  VAL  73          HG21      VAL  73  -2.617  -4.668 -15.939
    8   HG21  VAL  73          HG22      VAL  73  -3.087  -6.358 -15.769
    9   HG23  VAL  73          HG23      VAL  73  -2.479  -5.764 -17.314

  No H/Q in entry =           9
  In of MODEL   17
    1    H    LEU  74           H        LEU  74  -3.353  -6.663 -13.489
    2    HA   LEU  74           HA       LEU  74  -3.917  -3.997 -12.866
    3    HB2  LEU  74           HB2      LEU  74  -5.682  -5.623 -13.051
    4    HB3  LEU  74           HB3      LEU  74  -5.012  -6.571 -11.727
    5    HG   LEU  74           HG       LEU  74  -5.438  -4.700 -10.169
    6   HD11  LEU  74          HD11      LEU  74  -6.412  -3.390 -12.711
    7   HD13  LEU  74          HD12      LEU  74  -5.275  -2.756 -11.525
    8   HD12  LEU  74          HD13      LEU  74  -6.990  -2.871 -11.128
    9   HD23  LEU  74          HD21      LEU  74  -7.998  -5.054 -11.640
   10   HD22  LEU  74          HD22      LEU  74  -7.636  -5.222  -9.937
   11   HD21  LEU  74          HD23      LEU  74  -7.179  -6.494 -11.043

  No H/Q in entry =          11
  In of MODEL   17
    1    H    VAL  75           H        VAL  75  -2.936  -6.615 -10.714
    2    HA   VAL  75           HA       VAL  75  -2.712  -5.078  -8.362
    3    HB   VAL  75           HB       VAL  75  -1.260  -7.599  -9.158
    4   HG12  VAL  75          HG11      VAL  75  -0.819  -7.775  -6.685
    5   HG11  VAL  75          HG12      VAL  75  -1.472  -6.155  -6.490
    6   HG13  VAL  75          HG13      VAL  75  -0.001  -6.397  -7.415
    7   HG22  VAL  75          HG21      VAL  75  -2.957  -8.677  -7.800
    8   HG21  VAL  75          HG22      VAL  75  -3.783  -7.638  -8.961
    9   HG23  VAL  75          HG23      VAL  75  -3.604  -7.119  -7.284

  No H/Q in entry =           9
  In of MODEL   17
    1    H    GLU  76           H        GLU  76  -0.312  -5.877 -10.895
    2    HA   GLU  76           HA       GLU  76   1.897  -4.581  -9.726
    3    HB2  GLU  76           HB2      GLU  76   2.070  -6.052 -11.717
    4    HB3  GLU  76           HB3      GLU  76   1.193  -4.865 -12.670
    5    HG2  GLU  76           HG2      GLU  76   3.543  -4.589 -13.150
    6    HG3  GLU  76           HG3      GLU  76   3.051  -3.208 -12.189

  No H/Q in entry =           6
  In of MODEL   17
    1    H    ALA  77           H        ALA  77  -0.603  -3.317 -11.916
    2    HA   ALA  77           HA       ALA  77   0.442  -0.691 -12.077
    3    HB2  ALA  77           HB1      ALA  77  -1.817  -0.068 -12.860
    4    HB3  ALA  77           HB2      ALA  77  -2.424  -1.643 -12.346
    5    HB1  ALA  77           HB3      ALA  77  -1.243  -1.538 -13.650

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLN  78           H        GLN  78  -1.864  -2.210  -9.880
    2    HA   GLN  78           HA       GLN  78  -2.627   0.118  -8.470
    3    HB2  GLN  78           HB2      GLN  78  -3.780  -2.123  -8.401
    4    HB3  GLN  78           HB3      GLN  78  -2.461  -2.708  -7.390
    5    HG2  GLN  78           HG2      GLN  78  -2.957  -0.967  -5.725
    6    HG3  GLN  78           HG3      GLN  78  -4.273  -0.369  -6.735
    7   HE21  GLN  78          HE21      GLN  78  -4.790  -1.336  -4.091
    8   HE22  GLN  78          HE22      GLN  78  -5.680  -2.777  -4.214

  No H/Q in entry =           8
  In of MODEL   17
    1    H    LEU  79           H        LEU  79   0.004  -2.193  -8.022
    2    HA   LEU  79           HA       LEU  79   0.991  -1.327  -5.558
    3    HB2  LEU  79           HB2      LEU  79   1.823  -3.348  -6.633
    4    HB3  LEU  79           HB3      LEU  79   2.492  -2.404  -7.960
    5    HG   LEU  79           HG       LEU  79   4.066  -1.303  -6.447
    6   HD13  LEU  79          HD11      LEU  79   3.061  -1.047  -4.382
    7   HD12  LEU  79          HD12      LEU  79   4.111  -2.419  -4.041
    8   HD11  LEU  79          HD13      LEU  79   2.401  -2.683  -4.377
    9   HD23  LEU  79          HD21      LEU  79   5.231  -3.478  -5.550
   10   HD22  LEU  79          HD22      LEU  79   5.037  -3.267  -7.288
   11   HD21  LEU  79          HD23      LEU  79   3.935  -4.320  -6.403

  No H/Q in entry =          11
  In of MODEL   17
    1    H    HIS  80           H        HIS  80   1.892  -0.213  -8.824
    2    HA   HIS  80           HA       HIS  80   3.736   1.734  -7.887
    3    HB2  HIS  80           HB2      HIS  80   2.441   1.077 -10.477
    4    HB3  HIS  80           HB3      HIS  80   3.067   2.716 -10.297
    5    HD1  HIS  80           HD1      HIS  80   5.475   2.973 -10.811
    6    HD2  HIS  80           HD2      HIS  80   4.577  -0.927  -9.640
    7    HE1  HIS  80           HE1      HIS  80   7.641   1.654 -10.976
    8    HE2  HIS  80           HE2      HIS  80   7.104  -0.726 -10.266

  No H/Q in entry =           8
  In of MODEL   17
    1    H    LEU  81           H        LEU  81   0.338   1.964  -8.876
    2    HA   LEU  81           HA       LEU  81   0.116   4.760  -8.533
    3    HB2  LEU  81           HB2      LEU  81  -1.941   2.553  -8.471
    4    HB3  LEU  81           HB3      LEU  81  -2.362   4.264  -8.372
    5    HG   LEU  81           HG       LEU  81  -0.684   3.093 -10.608
    6   HD12  LEU  81          HD11      LEU  81  -2.906   3.460 -11.913
    7   HD11  LEU  81          HD12      LEU  81  -3.667   3.399 -10.324
    8   HD13  LEU  81          HD13      LEU  81  -2.748   2.016 -10.914
    9   HD23  LEU  81          HD21      LEU  81  -1.737   5.262 -11.699
   10   HD22  LEU  81          HD22      LEU  81  -0.321   5.401 -10.661
   11   HD21  LEU  81          HD23      LEU  81  -1.920   5.777 -10.024

  No H/Q in entry =          11
  In of MODEL   17
    1    H    MET  82           H        MET  82  -0.601   2.076  -6.299
    2    HA   MET  82           HA       MET  82  -1.630   3.672  -4.208
    3    HB2  MET  82           HB2      MET  82  -0.306   0.960  -4.255
    4    HB3  MET  82           HB3      MET  82  -0.875   1.689  -2.756
    5    HG2  MET  82           HG2      MET  82  -2.609   1.239  -5.205
    6    HG3  MET  82           HG3      MET  82  -2.556   0.157  -3.814
    7    HE3  MET  82           HE1      MET  82  -4.256   1.825  -0.997
    8    HE2  MET  82           HE2      MET  82  -2.521   2.072  -1.175
    9    HE1  MET  82           HE3      MET  82  -3.236   0.530  -1.638

  No H/Q in entry =           9
  In of MODEL   17
    1    H    THR  83           H        THR  83   1.653   2.529  -4.892
    2    HA   THR  83           HA       THR  83   2.883   3.600  -2.583
    3    HB   THR  83           HB       THR  83   4.981   3.512  -4.050
    4    HG1  THR  83           HG1      THR  83   4.738   3.000  -6.078
    5   HG22  THR  83          HG21      THR  83   4.490   0.865  -4.396
    6   HG21  THR  83          HG22      THR  83   3.204   1.262  -3.258
    7   HG23  THR  83          HG23      THR  83   4.888   1.573  -2.832

  No H/Q in entry =           7
  In of MODEL   17
    1    H    SER  84           H        SER  84   2.546   4.901  -5.878
    2    HA   SER  84           HA       SER  84   3.929   7.314  -5.407
    3    HB2  SER  84           HB2      SER  84   1.850   6.529  -7.437
    4    HB3  SER  84           HB3      SER  84   2.558   8.144  -7.402
    5    HG   SER  84           HG       SER  84   3.886   5.645  -7.701

  No H/Q in entry =           5
  In of MODEL   17
    1    H    MET  85           H        MET  85   0.421   6.621  -5.250
    2    HA   MET  85           HA       MET  85  -0.394   9.244  -4.639
    3    HB2  MET  85           HB2      MET  85  -1.946   7.465  -5.321
    4    HB3  MET  85           HB3      MET  85  -1.680   6.649  -3.781
    5    HG2  MET  85           HG2      MET  85  -2.549   8.604  -2.572
    6    HG3  MET  85           HG3      MET  85  -2.768   9.461  -4.096
    7    HE1  MET  85           HE1      MET  85  -3.384   6.509  -2.029
    8    HE3  MET  85           HE2      MET  85  -3.800   5.446  -3.371
    9    HE2  MET  85           HE3      MET  85  -5.062   6.017  -2.286

  No H/Q in entry =           9
  In of MODEL   17
    1    H    LEU  86           H        LEU  86   0.469   6.555  -2.505
    2    HA   LEU  86           HA       LEU  86  -0.047   7.856  -0.059
    3    HB2  LEU  86           HB2      LEU  86   0.371   5.378  -0.463
    4    HB3  LEU  86           HB3      LEU  86   2.087   5.776  -0.551
    5    HG   LEU  86           HG       LEU  86   1.777   6.932   1.722
    6   HD11  LEU  86          HD11      LEU  86  -0.930   6.220   1.239
    7   HD13  LEU  86          HD12      LEU  86  -0.254   6.947   2.695
    8   HD12  LEU  86          HD13      LEU  86  -0.378   5.194   2.567
    9   HD23  LEU  86          HD21      LEU  86   1.291   3.948   1.828
   10   HD22  LEU  86          HD22      LEU  86   2.309   4.933   2.876
   11   HD21  LEU  86          HD23      LEU  86   2.809   4.606   1.217

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ALA  87           H        ALA  87   2.933   7.513  -1.941
    2    HA   ALA  87           HA       ALA  87   4.661   8.881  -0.204
    3    HB3  ALA  87           HB1      ALA  87   4.745   7.880  -2.915
    4    HB2  ALA  87           HB2      ALA  87   6.082   8.179  -1.809
    5    HB1  ALA  87           HB3      ALA  87   5.496   9.476  -2.849

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ARG  88           H        ARG  88   2.745  10.069  -2.924
    2    HA   ARG  88           HA       ARG  88   3.573  12.742  -2.791
    3    HB2  ARG  88           HB2      ARG  88   2.301  11.624  -4.658
    4    HB3  ARG  88           HB3      ARG  88   0.844  11.792  -3.678
    5    HG2  ARG  88           HG2      ARG  88   1.915  14.350  -3.579
    6    HG3  ARG  88           HG3      ARG  88   2.334  13.836  -5.211
    7    HD2  ARG  88           HD2      ARG  88   0.196  13.963  -5.914
    8    HD3  ARG  88           HD3      ARG  88  -0.412  13.115  -4.492
    9    HE   ARG  88           HE       ARG  88  -0.544  15.898  -4.896
   10   HH21  ARG  88          HH11      ARG  88  -1.049  17.229  -3.153
   11   HH22  ARG  88          HH12      ARG  88  -0.768  16.678  -1.537
   12   HH11  ARG  88          HH21      ARG  88   0.419  13.603  -2.531
   13   HH12  ARG  88          HH22      ARG  88   0.045  14.619  -1.185

  No H/Q in entry =          13
  In of MODEL   17
    1    H    GLU  89           H        GLU  89   0.831  11.115  -1.167
    2    HA   GLU  89           HA       GLU  89  -0.232  13.443   0.047
    3    HB2  GLU  89           HB2      GLU  89  -1.396  11.228  -0.055
    4    HB3  GLU  89           HB3      GLU  89  -0.288  10.643   1.186
    5    HG2  GLU  89           HG2      GLU  89  -1.077  12.350   2.752
    6    HG3  GLU  89           HG3      GLU  89  -2.111  13.049   1.509

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LEU  90           H        LEU  90   2.167  11.094   1.215
    2    HA   LEU  90           HA       LEU  90   2.542  12.318   3.752
    3    HB2  LEU  90           HB2      LEU  90   4.282  10.515   2.071
    4    HB3  LEU  90           HB3      LEU  90   4.707  11.014   3.713
    5    HG   LEU  90           HG       LEU  90   2.047   9.728   3.038
    6   HD12  LEU  90          HD11      LEU  90   3.140   7.653   4.038
    7   HD11  LEU  90          HD12      LEU  90   4.681   8.478   3.805
    8   HD13  LEU  90          HD13      LEU  90   3.664   8.099   2.413
    9   HD22  LEU  90          HD21      LEU  90   1.796  10.646   5.164
   10   HD21  LEU  90          HD22      LEU  90   3.510  10.500   5.550
   11   HD23  LEU  90          HD23      LEU  90   2.473   9.074   5.588

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  91           H        ILE  91   4.162  12.682   0.632
    2    HA   ILE  91           HA       ILE  91   6.175  14.466   1.486
    3    HB   ILE  91           HB       ILE  91   4.861  14.018  -1.200
    4   HG12  ILE  91          HG12      ILE  91   7.679  13.464  -0.221
    5   HG13  ILE  91          HG13      ILE  91   6.372  12.294  -0.068
    6   HG22  ILE  91          HG21      ILE  91   7.114  15.320  -1.875
    7   HG21  ILE  91          HG22      ILE  91   6.818  16.119  -0.331
    8   HG23  ILE  91          HG23      ILE  91   5.599  16.181  -1.603
    9   HD13  ILE  91          HD11      ILE  91   6.198  11.986  -2.377
   10   HD12  ILE  91          HD12      ILE  91   7.936  12.191  -2.158
   11   HD11  ILE  91          HD13      ILE  91   6.957  13.538  -2.740

  No H/Q in entry =          11
  In of MODEL   17
    1    H    THR  92           H        THR  92   2.826  14.977   0.472
    2    HA   THR  92           HA       THR  92   2.862  17.800   0.426
    3    HB   THR  92           HB       THR  92   0.650  15.850   1.109
    4    HG1  THR  92           HG1      THR  92   0.956  15.676  -0.976
    5   HG22  THR  92          HG21      THR  92  -0.701  18.046   0.395
    6   HG21  THR  92          HG22      THR  92   0.707  18.837   1.100
    7   HG23  THR  92          HG23      THR  92  -0.262  17.731   2.073

  No H/Q in entry =           7
  In of MODEL   17
    1    H    GLU  93           H        GLU  93   2.256  15.499   3.066
    2    HA   GLU  93           HA       GLU  93   1.761  17.403   5.094
    3    HB2  GLU  93           HB2      GLU  93   3.013  14.649   5.318
    4    HB3  GLU  93           HB3      GLU  93   2.339  15.584   6.654
    5    HG2  GLU  93           HG2      GLU  93   0.717  14.855   4.207
    6    HG3  GLU  93           HG3      GLU  93   0.792  13.822   5.630

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LEU  94           H        LEU  94   4.737  15.861   3.944
    2    HA   LEU  94           HA       LEU  94   6.507  16.960   5.842
    3    HB2  LEU  94           HB2      LEU  94   6.895  15.999   3.007
    4    HB3  LEU  94           HB3      LEU  94   8.236  16.622   3.964
    5    HG   LEU  94           HG       LEU  94   6.446  14.459   5.083
    6   HD11  LEU  94          HD11      LEU  94   8.541  14.198   2.956
    7   HD13  LEU  94          HD12      LEU  94   7.073  13.255   3.208
    8   HD12  LEU  94          HD13      LEU  94   8.490  12.965   4.217
    9   HD23  LEU  94          HD21      LEU  94   8.620  13.868   6.238
   10   HD22  LEU  94          HD22      LEU  94   7.987  15.458   6.661
   11   HD21  LEU  94          HD23      LEU  94   9.325  15.314   5.521

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  95           H        ILE  95   5.403  18.173   2.696
    2    HA   ILE  95           HA       ILE  95   7.027  20.495   2.653
    3    HB   ILE  95           HB       ILE  95   4.372  19.877   1.337
    4   HG12  ILE  95          HG12      ILE  95   7.171  20.158   0.209
    5   HG13  ILE  95          HG13      ILE  95   6.486  18.617   0.714
    6   HG21  ILE  95          HG21      ILE  95   6.176  22.306   1.135
    7   HG23  ILE  95          HG22      ILE  95   4.449  22.275   1.486
    8   HG22  ILE  95          HG23      ILE  95   5.028  21.870  -0.131
    9   HD13  ILE  95          HD11      ILE  95   4.929  18.585  -1.019
   10   HD12  ILE  95          HD12      ILE  95   6.298  19.377  -1.799
   11   HD11  ILE  95          HD13      ILE  95   4.945  20.339  -1.206

  No H/Q in entry =          11
  In of MODEL   17
    1    H    GLU  96           H        GLU  96   3.761  19.909   3.936
    2    HA   GLU  96           HA       GLU  96   3.198  22.565   4.700
    3    HB2  GLU  96           HB2      GLU  96   1.484  20.819   4.698
    4    HB3  GLU  96           HB3      GLU  96   2.323  19.966   5.991
    5    HG2  GLU  96           HG2      GLU  96   1.327  21.264   7.565
    6    HG3  GLU  96           HG3      GLU  96   1.898  22.729   6.777

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LEU  97           H        LEU  97   4.978  19.965   6.316
    2    HA   LEU  97           HA       LEU  97   5.359  21.292   8.795
    3    HB2  LEU  97           HB2      LEU  97   6.851  19.096   7.374
    4    HB3  LEU  97           HB3      LEU  97   7.452  19.760   8.891
    5    HG   LEU  97           HG       LEU  97   4.620  18.731   8.567
    6   HD12  LEU  97          HD11      LEU  97   5.511  16.692   9.771
    7   HD11  LEU  97          HD12      LEU  97   7.137  17.288   9.435
    8   HD13  LEU  97          HD13      LEU  97   6.060  16.862   8.104
    9   HD23  LEU  97          HD21      LEU  97   5.059  18.413  11.131
   10   HD22  LEU  97          HD22      LEU  97   4.717  20.036  10.534
   11   HD21  LEU  97          HD23      LEU  97   6.377  19.557  10.881

  No H/Q in entry =          11
  In of MODEL   17
    1    H    HIS  98           H        HIS  98   7.238  21.282   5.775
    2    HA   HIS  98           HA       HIS  98   9.425  22.807   6.688
    3    HB2  HIS  98           HB2      HIS  98   8.133  22.596   3.958
    4    HB3  HIS  98           HB3      HIS  98   9.594  23.540   4.257
    5    HD1  HIS  98           HD1      HIS  98   8.302  19.998   4.255
    6    HD2  HIS  98           HD2      HIS  98  11.929  22.010   4.700
    7    HE1  HIS  98           HE1      HIS  98  10.117  18.227   4.193
    8    HE2  HIS  98           HE2      HIS  98  12.329  19.431   4.465

  No H/Q in entry =           8
  In of MODEL   17
    1    H    GLU  99           H        GLU  99   6.227  23.722   5.509
    2    HA   GLU  99           HA       GLU  99   6.670  26.527   5.467
    3    HB2  GLU  99           HB2      GLU  99   4.768  25.408   4.325
    4    HB3  GLU  99           HB3      GLU  99   4.060  25.054   5.900
    5    HG2  GLU  99           HG2      GLU  99   3.933  27.446   6.414
    6    HG3  GLU  99           HG3      GLU  99   4.722  27.837   4.889

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LYS 100           H        LYS 100   5.481  24.305   7.974
    2    HA   LYS 100           HA       LYS 100   4.937  26.362   9.877
    3    HB2  LYS 100           HB2      LYS 100   5.443  23.397  10.209
    4    HB3  LYS 100           HB3      LYS 100   5.017  24.472  11.545
    5    HG2  LYS 100           HG2      LYS 100   2.970  25.164  10.295
    6    HG3  LYS 100           HG3      LYS 100   3.373  23.992   9.038
    7    HD2  LYS 100           HD2      LYS 100   3.249  22.165  10.689
    8    HD3  LYS 100           HD3      LYS 100   2.862  23.330  11.958
    9    HE2  LYS 100           HE2      LYS 100   0.828  24.005  10.693
   10    HE3  LYS 100           HE3      LYS 100   1.203  22.783   9.471
   11    HZ1  LYS 100           HZ1      LYS 100   0.914  22.107  12.348
   12    HZ3  LYS 100           HZ2      LYS 100   0.877  21.061  11.007
   13    HZ2  LYS 100           HZ3      LYS 100  -0.414  22.129  11.289

  No H/Q in entry =          13
  In of MODEL   17
    1    H    LEU 101           H        LEU 101   7.821  24.504   9.041
    2    HA   LEU 101           HA       LEU 101   9.432  25.294  11.254
    3    HB2  LEU 101           HB2      LEU 101  10.011  24.309   8.472
    4    HB3  LEU 101           HB3      LEU 101  11.325  24.938   9.461
    5    HG   LEU 101           HG       LEU 101   9.441  22.820  10.508
    6   HD12  LEU 101          HD11      LEU 101  11.461  21.280   9.897
    7   HD11  LEU 101          HD12      LEU 101  11.861  22.541   8.732
    8   HD13  LEU 101          HD13      LEU 101  10.312  21.705   8.629
    9   HD21  LEU 101          HD21      LEU 101  12.188  23.860  11.249
   10   HD23  LEU 101          HD22      LEU 101  11.606  22.298  11.818
   11   HD22  LEU 101          HD23      LEU 101  10.747  23.772  12.262

  No H/Q in entry =          11
  In of MODEL   17
    1    H    LYS 102           H        LYS 102   7.899  27.206   9.119
    2    HA   LYS 102           HA       LYS 102   8.031  29.498   8.840
    3    HB2  LYS 102           HB2      LYS 102   9.586  29.335  10.942
    4    HB3  LYS 102           HB3      LYS 102  10.894  29.505   9.787
    5    HG2  LYS 102           HG2      LYS 102   8.832  31.502  10.654
    6    HG3  LYS 102           HG3      LYS 102  10.551  31.723  10.408
    7    HD2  LYS 102           HD2      LYS 102   8.597  31.358   8.101
    8    HD3  LYS 102           HD3      LYS 102   9.015  32.925   8.779
    9    HE2  LYS 102           HE2      LYS 102  10.366  31.719   6.703
   10    HE3  LYS 102           HE3      LYS 102  11.010  33.006   7.723
   11    HZ2  LYS 102           HZ1      LYS 102  12.486  31.067   7.541
   12    HZ1  LYS 102           HZ2      LYS 102  11.298  30.108   8.275
   13    HZ3  LYS 102           HZ3      LYS 102  12.019  31.374   9.143

  No H/Q in entry =          13
  In of MODEL   17
    1    H    ALA 103           H        ALA 103  11.257  28.085   8.277
    2    HA   ALA 103           HA       ALA 103  12.259  29.450   6.211
    3    HB2  ALA 103           HB1      ALA 103  13.094  27.221   5.274
    4    HB1  ALA 103           HB2      ALA 103  12.177  26.461   6.573
    5    HB3  ALA 103           HB3      ALA 103  13.493  27.572   6.956

  No H/Q in entry =           5
  In of MODEL   17
    1    H1   LYS   3           H1       LYS   3 -32.114   4.969 -19.840
    2    H2   LYS   3           H3       LYS   3 -31.125   4.721 -21.197
    3    H3   LYS   3           H2       LYS   3 -32.451   3.700 -20.915
    4    HA   LYS   3           HA       LYS   3 -31.344   2.406 -19.499
    5    HB2  LYS   3           HB2      LYS   3 -29.176   3.940 -20.886
    6    HB3  LYS   3           HB3      LYS   3 -28.758   2.779 -19.625
    7    HG2  LYS   3           HG2      LYS   3 -30.088   1.079 -20.928
    8    HG3  LYS   3           HG3      LYS   3 -30.136   2.254 -22.241
    9    HD2  LYS   3           HD2      LYS   3 -27.651   2.305 -22.220
   10    HD3  LYS   3           HD3      LYS   3 -27.670   1.025 -21.008
   11    HE2  LYS   3           HE2      LYS   3 -29.108  -0.280 -22.684
   12    HE3  LYS   3           HE3      LYS   3 -28.580   0.915 -23.869
   13    HZ3  LYS   3           HZ1      LYS   3 -26.708  -0.198 -24.138
   14    HZ2  LYS   3           HZ2      LYS   3 -27.248  -1.385 -23.050
   15    HZ1  LYS   3           HZ3      LYS   3 -26.335  -0.068 -22.487

  No H/Q in entry =          15
  In of MODEL   17
    1    H    LYS   4           H        LYS   4 -31.363   2.300 -17.435
    2    HA   LYS   4           HA       LYS   4 -30.765   4.661 -15.836
    3    HB2  LYS   4           HB2      LYS   4 -31.781   1.909 -15.073
    4    HB3  LYS   4           HB3      LYS   4 -31.634   3.280 -13.974
    5    HG2  LYS   4           HG2      LYS   4 -33.462   3.055 -16.371
    6    HG3  LYS   4           HG3      LYS   4 -33.935   3.105 -14.673
    7    HD2  LYS   4           HD2      LYS   4 -33.382   5.373 -14.457
    8    HD3  LYS   4           HD3      LYS   4 -32.357   5.355 -15.891
    9    HE2  LYS   4           HE2      LYS   4 -34.373   6.593 -16.354
   10    HE3  LYS   4           HE3      LYS   4 -34.368   5.100 -17.294
   11    HZ3  LYS   4           HZ1      LYS   4 -35.864   4.117 -15.711
   12    HZ2  LYS   4           HZ2      LYS   4 -36.522   5.563 -16.315
   13    HZ1  LYS   4           HZ3      LYS   4 -35.841   5.524 -14.759

  No H/Q in entry =          13
  In of MODEL   17
    1    H    HIS   5           H        HIS   5 -29.287   4.870 -14.265
    2    HA   HIS   5           HA       HIS   5 -26.896   3.185 -14.592
    3    HB2  HIS   5           HB2      HIS   5 -27.313   5.940 -13.433
    4    HB3  HIS   5           HB3      HIS   5 -25.773   5.082 -13.417
    5    HD1  HIS   5           HD1      HIS   5 -24.401   6.342 -15.047
    6    HD2  HIS   5           HD2      HIS   5 -28.172   5.452 -16.541
    7    HE1  HIS   5           HE1      HIS   5 -24.298   6.886 -17.509
    8    HE2  HIS   5           HE2      HIS   5 -26.597   6.331 -18.389

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ILE   6           H        ILE   6 -26.552   1.655 -13.250
    2    HA   ILE   6           HA       ILE   6 -27.511   1.913 -10.479
    3    HB   ILE   6           HB       ILE   6 -26.549  -0.526 -11.982
    4   HG12  ILE   6          HG12      ILE   6 -29.336   0.252 -11.113
    5   HG13  ILE   6          HG13      ILE   6 -28.724   0.423 -12.758
    6   HG23  ILE   6          HG21      ILE   6 -26.821  -1.763 -10.094
    7   HG22  ILE   6          HG22      ILE   6 -28.040  -0.680  -9.421
    8   HG21  ILE   6          HG23      ILE   6 -26.335  -0.234  -9.360
    9   HD13  ILE   6          HD11      ILE   6 -29.055  -1.730 -13.214
   10   HD12  ILE   6          HD12      ILE   6 -30.053  -1.750 -11.759
   11   HD11  ILE   6          HD13      ILE   6 -28.363  -2.250 -11.677

  No H/Q in entry =          11
  In of MODEL   17
    1    H    TYR   7           H        TYR   7 -25.781   2.687  -9.227
    2    HA   TYR   7           HA       TYR   7 -23.023   1.889  -9.922
    3    HB2  TYR   7           HB2      TYR   7 -24.120   4.286  -8.475
    4    HB3  TYR   7           HB3      TYR   7 -22.408   3.876  -8.525
    5    HD1  TYR   7           HD1      TYR   7 -23.421   2.812 -11.584
    6    HD2  TYR   7           HD2      TYR   7 -22.952   6.461  -9.432
    7    HE1  TYR   7           HE1      TYR   7 -23.092   4.026 -13.702
    8    HE2  TYR   7           HE2      TYR   7 -22.664   7.678 -11.542
    9    HH   TYR   7           HH       TYR   7 -22.902   7.535 -13.769

  No H/Q in entry =           9
  In of MODEL   17
    1    H    LEU   8           H        LEU   8 -21.959   0.626  -8.581
    2    HA   LEU   8           HA       LEU   8 -23.025   0.112  -5.876
    3    HB2  LEU   8           HB2      LEU   8 -21.243  -1.476  -7.701
    4    HB3  LEU   8           HB3      LEU   8 -21.385  -1.836  -5.980
    5    HG   LEU   8           HG       LEU   8 -23.854  -2.171  -6.368
    6   HD13  LEU   8          HD11      LEU   8 -24.084  -1.006  -8.498
    7   HD12  LEU   8          HD12      LEU   8 -24.512  -2.704  -8.701
    8   HD11  LEU   8          HD13      LEU   8 -22.945  -2.116  -9.255
    9   HD23  LEU   8          HD21      LEU   8 -22.474  -4.161  -8.040
   10   HD22  LEU   8          HD22      LEU   8 -23.533  -4.369  -6.646
   11   HD21  LEU   8          HD23      LEU   8 -21.848  -3.906  -6.411

  No H/Q in entry =          11
  In of MODEL   17
    1    H    PHE   9           H        PHE   9 -21.760   0.612  -4.113
    2    HA   PHE   9           HA       PHE   9 -19.038   1.698  -4.665
    3    HB2  PHE   9           HB2      PHE   9 -21.088   2.699  -2.692
    4    HB3  PHE   9           HB3      PHE   9 -19.410   3.223  -2.729
    5    HD1  PHE   9           HD1      PHE   9 -18.552   4.590  -4.544
    6    HD2  PHE   9           HD2      PHE   9 -22.653   3.330  -4.483
    7    HE1  PHE   9           HE1      PHE   9 -19.078   6.210  -6.342
    8    HE2  PHE   9           HE2      PHE   9 -23.180   4.962  -6.276
    9    HZ   PHE   9           HZ       PHE   9 -21.391   6.398  -7.211

  No H/Q in entry =           9
  In of MODEL   17
    1    H    SER  10           H        SER  10 -17.380   0.928  -3.495
    2    HA   SER  10           HA       SER  10 -17.528   0.060  -0.801
    3    HB2  SER  10           HB2      SER  10 -17.266  -2.301  -1.036
    4    HB3  SER  10           HB3      SER  10 -18.666  -1.854  -1.998
    5    HG   SER  10           HG       SER  10 -17.488  -2.048  -3.823

  No H/Q in entry =           5
  In of MODEL   17
    1    H    SER  11           H        SER  11 -15.503   0.225   0.031
    2    HA   SER  11           HA       SER  11 -13.372   1.184  -1.524
    3    HB2  SER  11           HB2      SER  11 -13.861   1.249   1.068
    4    HB3  SER  11           HB3      SER  11 -12.812  -0.170   1.065
    5    HG   SER  11           HG       SER  11 -11.541   1.662   1.275

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA  12           H        ALA  12 -14.425  -1.510  -2.387
    2    HA   ALA  12           HA       ALA  12 -11.812  -2.660  -2.914
    3    HB2  ALA  12           HB1      ALA  12 -12.130  -3.950  -1.000
    4    HB3  ALA  12           HB2      ALA  12 -12.779  -4.992  -2.266
    5    HB1  ALA  12           HB3      ALA  12 -13.875  -4.063  -1.245

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLY  13           H        GLY  13 -12.715  -1.677  -4.929
    2    HA3  GLY  13           HA2      GLY  13 -14.922  -2.554  -6.355
    3    HA2  GLY  13           HA3      GLY  13 -13.423  -1.989  -7.106

  No H/Q in entry =           3
  In of MODEL   17
    1    H    MET  14           H        MET  14 -11.798  -4.207  -6.034
    2    HA   MET  14           HA       MET  14 -12.059  -5.987  -8.181
    3    HB2  MET  14           HB2      MET  14  -9.971  -5.866  -6.909
    4    HB3  MET  14           HB3      MET  14 -10.749  -6.599  -5.507
    5    HG2  MET  14           HG2      MET  14 -11.186  -8.645  -6.844
    6    HG3  MET  14           HG3      MET  14 -10.390  -7.901  -8.231
    7    HE3  MET  14           HE1      MET  14  -6.790  -7.788  -7.584
    8    HE2  MET  14           HE2      MET  14  -7.765  -6.407  -7.088
    9    HE1  MET  14           HE3      MET  14  -8.216  -7.322  -8.524

  No H/Q in entry =           9
  In of MODEL   17
    1    H    SER  15           H        SER  15 -13.219  -6.462  -4.856
    2    HA   SER  15           HA       SER  15 -14.374  -9.037  -5.474
    3    HB2  SER  15           HB2      SER  15 -14.802  -7.224  -3.090
    4    HB3  SER  15           HB3      SER  15 -15.635  -8.760  -3.306
    5    HG   SER  15           HG       SER  15 -12.809  -8.364  -3.268

  No H/Q in entry =           5
  In of MODEL   17
    1    H    THR  16           H        THR  16 -15.671  -5.734  -5.180
    2    HA   THR  16           HA       THR  16 -18.427  -6.419  -5.693
    3    HB   THR  16           HB       THR  16 -17.028  -3.780  -6.251
    4    HG1  THR  16           HG1      THR  16 -17.294  -5.078  -3.948
    5   HG23  THR  16          HG21      THR  16 -19.185  -2.815  -6.026
    6   HG22  THR  16          HG22      THR  16 -19.861  -4.296  -5.324
    7   HG21  THR  16          HG23      THR  16 -19.423  -4.235  -7.038

  No H/Q in entry =           7
  In of MODEL   17
    1    H    SER  17           H        SER  17 -15.624  -5.723  -7.578
    2    HA   SER  17           HA       SER  17 -16.822  -5.104 -10.079
    3    HB2  SER  17           HB2      SER  17 -14.104  -6.188  -9.334
    4    HB3  SER  17           HB3      SER  17 -14.576  -5.934 -11.015
    5    HG   SER  17           HG       SER  17 -13.561  -4.172  -9.429

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU  18           H        LEU  18 -16.040  -8.177  -8.579
    2    HA   LEU  18           HA       LEU  18 -16.555  -9.757 -10.899
    3    HB2  LEU  18           HB2      LEU  18 -15.256 -10.612  -9.005
    4    HB3  LEU  18           HB3      LEU  18 -16.671 -10.470  -7.964
    5    HG   LEU  18           HG       LEU  18 -17.847 -12.093  -9.475
    6   HD11  LEU  18          HD11      LEU  18 -15.097 -12.137 -10.702
    7   HD13  LEU  18          HD12      LEU  18 -16.657 -11.971 -11.505
    8   HD12  LEU  18          HD13      LEU  18 -16.177 -13.523 -10.821
    9   HD23  LEU  18          HD21      LEU  18 -15.328 -13.080  -8.170
   10   HD22  LEU  18          HD22      LEU  18 -16.772 -14.028  -8.532
   11   HD21  LEU  18          HD23      LEU  18 -16.847 -12.725  -7.345

  No H/Q in entry =          11
  In of MODEL   17
    1    H    LEU  19           H        LEU  19 -18.568  -8.624  -8.188
    2    HA   LEU  19           HA       LEU  19 -20.960  -9.977  -8.970
    3    HB2  LEU  19           HB2      LEU  19 -20.738  -9.095  -6.740
    4    HB3  LEU  19           HB3      LEU  19 -20.532  -7.461  -7.367
    5    HG   LEU  19           HG       LEU  19 -22.878  -7.452  -8.094
    6   HD13  LEU  19          HD11      LEU  19 -23.210  -9.837  -8.462
    7   HD12  LEU  19          HD12      LEU  19 -24.379  -9.243  -7.284
    8   HD11  LEU  19          HD13      LEU  19 -22.969 -10.154  -6.743
    9   HD21  LEU  19          HD21      LEU  19 -22.186  -6.603  -5.895
   10   HD23  LEU  19          HD22      LEU  19 -22.519  -8.187  -5.195
   11   HD22  LEU  19          HD23      LEU  19 -23.833  -7.233  -5.886

  No H/Q in entry =          11
  In of MODEL   17
    1    H    VAL  20           H        VAL  20 -19.675  -6.742  -9.741
    2    HA   VAL  20           HA       VAL  20 -21.865  -5.867 -11.305
    3    HB   VAL  20           HB       VAL  20 -18.921  -5.091 -11.488
    4   HG13  VAL  20          HG11      VAL  20 -19.977  -4.631 -13.641
    5   HG12  VAL  20          HG12      VAL  20 -19.714  -3.117 -12.776
    6   HG11  VAL  20          HG13      VAL  20 -21.325  -3.830 -12.835
    7   HG21  VAL  20          HG21      VAL  20 -21.302  -3.983 -10.063
    8   HG23  VAL  20          HG22      VAL  20 -19.956  -2.937 -10.511
    9   HG22  VAL  20          HG23      VAL  20 -19.684  -4.318  -9.447

  No H/Q in entry =           9
  In of MODEL   17
    1    H    SER  21           H        SER  21 -18.993  -7.758 -12.325
    2    HA   SER  21           HA       SER  21 -19.811  -7.749 -15.069
    3    HB2  SER  21           HB2      SER  21 -18.254  -9.620 -15.387
    4    HB3  SER  21           HB3      SER  21 -17.498  -8.314 -14.475
    5    HG   SER  21           HG       SER  21 -18.489 -10.776 -13.534

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LYS  22           H        LYS  22 -20.709  -9.948 -12.445
    2    HA   LYS  22           HA       LYS  22 -22.161 -11.697 -14.217
    3    HB2  LYS  22           HB2      LYS  22 -21.333 -12.334 -11.919
    4    HB3  LYS  22           HB3      LYS  22 -22.627 -11.333 -11.262
    5    HG2  LYS  22           HG2      LYS  22 -23.509 -13.477 -11.174
    6    HG3  LYS  22           HG3      LYS  22 -24.201 -12.815 -12.655
    7    HD2  LYS  22           HD2      LYS  22 -22.560 -13.995 -13.994
    8    HD3  LYS  22           HD3      LYS  22 -21.759 -14.588 -12.538
    9    HE2  LYS  22           HE2      LYS  22 -23.793 -15.846 -11.940
   10    HE3  LYS  22           HE3      LYS  22 -24.581 -15.264 -13.407
   11    HZ3  LYS  22           HZ1      LYS  22 -23.440 -16.686 -14.698
   12    HZ2  LYS  22           HZ2      LYS  22 -23.368 -17.591 -13.262
   13    HZ1  LYS  22           HZ3      LYS  22 -22.040 -16.644 -13.737

  No H/Q in entry =          13
  In of MODEL   17
    1    H    MET  23           H        MET  23 -23.048  -8.790 -12.396
    2    HA   MET  23           HA       MET  23 -25.850  -9.053 -12.868
    3    HB2  MET  23           HB2      MET  23 -24.145  -6.624 -12.360
    4    HB3  MET  23           HB3      MET  23 -25.899  -6.567 -12.520
    5    HG2  MET  23           HG2      MET  23 -26.188  -7.854 -10.523
    6    HG3  MET  23           HG3      MET  23 -24.453  -8.156 -10.409
    7    HE2  MET  23           HE1      MET  23 -26.963  -4.633  -9.261
    8    HE1  MET  23           HE2      MET  23 -27.171  -5.643 -10.691
    9    HE3  MET  23           HE3      MET  23 -26.227  -4.155 -10.793

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ARG  24           H        ARG  24 -23.208  -7.491 -14.710
    2    HA   ARG  24           HA       ARG  24 -24.804  -6.324 -16.714
    3    HB2  ARG  24           HB2      ARG  24 -22.381  -5.779 -16.359
    4    HB3  ARG  24           HB3      ARG  24 -21.962  -7.356 -16.983
    5    HG2  ARG  24           HG2      ARG  24 -22.920  -6.750 -19.211
    6    HG3  ARG  24           HG3      ARG  24 -23.323  -5.139 -18.561
    7    HD2  ARG  24           HD2      ARG  24 -20.872  -4.901 -17.910
    8    HD3  ARG  24           HD3      ARG  24 -20.576  -6.381 -18.811
    9    HE   ARG  24           HE       ARG  24 -21.108  -3.853 -20.026
   10   HH21  ARG  24          HH11      ARG  24 -21.850  -3.975 -22.144
   11   HH22  ARG  24          HH12      ARG  24 -21.491  -5.371 -23.099
   12   HH11  ARG  24          HH21      ARG  24 -20.251  -7.117 -20.280
   13   HH12  ARG  24          HH22      ARG  24 -20.536  -7.220 -21.990

  No H/Q in entry =          13
  In of MODEL   17
    1    H    ALA  25           H        ALA  25 -23.477  -9.581 -16.391
    2    HA   ALA  25           HA       ALA  25 -24.080 -10.499 -19.006
    3    HB1  ALA  25           HB1      ALA  25 -23.253 -12.471 -18.282
    4    HB3  ALA  25           HB2      ALA  25 -24.296 -12.489 -16.859
    5    HB2  ALA  25           HB3      ALA  25 -22.794 -11.567 -16.840

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLN  26           H        GLN  26 -25.870 -10.592 -15.961
    2    HA   GLN  26           HA       GLN  26 -28.146 -11.953 -16.930
    3    HB2  GLN  26           HB2      GLN  26 -27.717 -10.135 -14.581
    4    HB3  GLN  26           HB3      GLN  26 -29.236 -10.957 -14.900
    5    HG2  GLN  26           HG2      GLN  26 -26.562 -12.247 -14.434
    6    HG3  GLN  26           HG3      GLN  26 -27.915 -12.206 -13.312
    7   HE21  GLN  26          HE21      GLN  26 -26.581 -14.316 -14.563
    8   HE22  GLN  26          HE22      GLN  26 -27.566 -15.438 -15.329

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ALA  27           H        ALA  27 -27.416  -8.499 -16.608
    2    HA   ALA  27           HA       ALA  27 -29.975  -7.573 -17.383
    3    HB1  ALA  27           HB1      ALA  27 -28.237  -6.131 -16.312
    4    HB3  ALA  27           HB2      ALA  27 -28.888  -5.429 -17.794
    5    HB2  ALA  27           HB3      ALA  27 -27.303  -6.201 -17.808

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLU  28           H        GLU  28 -27.224  -8.664 -19.262
    2    HA   GLU  28           HA       GLU  28 -28.245  -7.728 -21.787
    3    HB2  GLU  28           HB2      GLU  28 -25.824  -8.254 -21.179
    4    HB3  GLU  28           HB3      GLU  28 -26.269  -9.952 -21.346
    5    HG2  GLU  28           HG2      GLU  28 -25.192  -9.143 -23.340
    6    HG3  GLU  28           HG3      GLU  28 -26.870  -9.574 -23.664

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LYS  29           H        LYS  29 -28.207 -10.808 -20.076
    2    HA   LYS  29           HA       LYS  29 -29.439 -12.390 -22.041
    3    HB2  LYS  29           HB2      LYS  29 -28.312 -13.273 -20.033
    4    HB3  LYS  29           HB3      LYS  29 -29.613 -12.626 -19.035
    5    HG2  LYS  29           HG2      LYS  29 -31.199 -14.115 -20.062
    6    HG3  LYS  29           HG3      LYS  29 -29.975 -14.696 -21.188
    7    HD2  LYS  29           HD2      LYS  29 -28.747 -15.761 -19.449
    8    HD3  LYS  29           HD3      LYS  29 -29.691 -14.954 -18.198
    9    HE2  LYS  29           HE2      LYS  29 -30.303 -17.351 -18.511
   10    HE3  LYS  29           HE3      LYS  29 -31.652 -16.241 -18.761
   11    HZ1  LYS  29           HZ1      LYS  29 -31.105 -16.384 -21.193
   12    HZ3  LYS  29           HZ2      LYS  29 -31.733 -17.799 -20.496
   13    HZ2  LYS  29           HZ3      LYS  29 -30.071 -17.675 -20.813

  No H/Q in entry =          13
  In of MODEL   17
    1    H    TYR  30           H        TYR  30 -30.930 -10.329 -19.557
    2    HA   TYR  30           HA       TYR  30 -33.574 -10.959 -20.762
    3    HB2  TYR  30           HB2      TYR  30 -32.964  -9.721 -18.067
    4    HB3  TYR  30           HB3      TYR  30 -34.570 -10.087 -18.699
    5    HD1  TYR  30           HD1      TYR  30 -35.342 -12.433 -18.864
    6    HD2  TYR  30           HD2      TYR  30 -31.540 -11.451 -17.215
    7    HE1  TYR  30           HE1      TYR  30 -35.103 -14.737 -18.029
    8    HE2  TYR  30           HE2      TYR  30 -31.303 -13.741 -16.385
    9    HH   TYR  30           HH       TYR  30 -32.807 -16.216 -17.419

  No H/Q in entry =           9
  In of MODEL   17
    1    H    GLU  31           H        GLU  31 -31.541  -8.854 -21.619
    2    HA   GLU  31           HA       GLU  31 -31.606  -6.711 -22.478
    3    HB2  GLU  31           HB2      GLU  31 -34.457  -7.610 -22.946
    4    HB3  GLU  31           HB3      GLU  31 -33.709  -6.206 -23.708
    5    HG2  GLU  31           HG2      GLU  31 -32.164  -7.573 -24.892
    6    HG3  GLU  31           HG3      GLU  31 -32.633  -9.002 -23.974

  No H/Q in entry =           6
  In of MODEL   17
    1    H    VAL  32           H        VAL  32 -31.784  -6.575 -19.746
    2    HA   VAL  32           HA       VAL  32 -33.765  -4.569 -19.101
    3    HB   VAL  32           HB       VAL  32 -31.300  -5.387 -17.531
    4   HG12  VAL  32          HG11      VAL  32 -32.864  -4.626 -15.633
    5   HG11  VAL  32          HG12      VAL  32 -33.764  -3.797 -16.902
    6   HG13  VAL  32          HG13      VAL  32 -32.076  -3.384 -16.606
    7   HG21  VAL  32          HG21      VAL  32 -32.966  -7.223 -18.171
    8   HG23  VAL  32          HG22      VAL  32 -34.043  -6.442 -17.014
    9   HG22  VAL  32          HG23      VAL  32 -32.480  -7.062 -16.484

  No H/Q in entry =           9
  In of MODEL   17
    1    HA   PRO  33           HA       PRO  33 -30.937  -1.488 -20.857
    2    HB2  PRO  33           HB2      PRO  33 -32.581   0.639 -20.753
    3    HB3  PRO  33           HB3      PRO  33 -32.979  -0.708 -21.820
    4    HG2  PRO  33           HG2      PRO  33 -33.949  -0.205 -19.005
    5    HG3  PRO  33           HG3      PRO  33 -34.914  -0.498 -20.453
    6    HD2  PRO  33           HD2      PRO  33 -34.313  -2.510 -18.759
    7    HD3  PRO  33           HD3      PRO  33 -34.378  -2.783 -20.499

  No H/Q in entry =           7
  In of MODEL   17
    1    H    VAL  34           H        VAL  34 -29.621  -1.920 -18.914
    2    HA   VAL  34           HA       VAL  34 -29.472   0.545 -17.309
    3    HB   VAL  34           HB       VAL  34 -28.781  -0.844 -15.354
    4   HG12  VAL  34          HG11      VAL  34 -31.132  -1.860 -15.006
    5   HG11  VAL  34          HG12      VAL  34 -31.511  -1.147 -16.573
    6   HG13  VAL  34          HG13      VAL  34 -31.006  -0.115 -15.234
    7   HG21  VAL  34          HG21      VAL  34 -28.860  -2.912 -17.327
    8   HG23  VAL  34          HG22      VAL  34 -29.879  -3.314 -15.944
    9   HG22  VAL  34          HG23      VAL  34 -28.179  -2.917 -15.701

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ILE  35           H        ILE  35 -27.519   1.118 -16.499
    2    HA   ILE  35           HA       ILE  35 -25.148  -0.086 -17.766
    3    HB   ILE  35           HB       ILE  35 -25.721   2.786 -16.998
    4   HG12  ILE  35          HG12      ILE  35 -24.684   1.500 -19.532
    5   HG13  ILE  35          HG13      ILE  35 -26.347   2.022 -19.263
    6   HG21  ILE  35          HG21      ILE  35 -23.071   1.412 -17.311
    7   HG23  ILE  35          HG22      ILE  35 -23.585   2.581 -16.097
    8   HG22  ILE  35          HG23      ILE  35 -23.254   3.110 -17.745
    9   HD11  ILE  35          HD11      ILE  35 -25.080   4.310 -18.714
   10   HD13  ILE  35          HD12      ILE  35 -25.609   3.866 -20.338
   11   HD12  ILE  35          HD13      ILE  35 -23.932   3.609 -19.855

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ILE  36           H        ILE  36 -23.840  -1.003 -16.164
    2    HA   ILE  36           HA       ILE  36 -24.288  -0.369 -13.300
    3    HB   ILE  36           HB       ILE  36 -23.304  -3.033 -14.374
    4   HG12  ILE  36          HG12      ILE  36 -26.148  -2.392 -13.591
    5   HG13  ILE  36          HG13      ILE  36 -25.596  -2.364 -15.265
    6   HG23  ILE  36          HG21      ILE  36 -23.580  -3.846 -12.242
    7   HG22  ILE  36          HG22      ILE  36 -24.781  -2.629 -11.812
    8   HG21  ILE  36          HG23      ILE  36 -23.076  -2.190 -11.907
    9   HD13  ILE  36          HD11      ILE  36 -25.624  -4.587 -15.433
   10   HD12  ILE  36          HD12      ILE  36 -26.681  -4.508 -14.025
   11   HD11  ILE  36          HD13      ILE  36 -24.957  -4.818 -13.818

  No H/Q in entry =          11
  In of MODEL   17
    1    H    GLU  37           H        GLU  37 -22.539   0.390 -12.226
    2    HA   GLU  37           HA       GLU  37 -19.813  -0.252 -13.160
    3    HB2  GLU  37           HB2      GLU  37 -20.877   2.488 -12.493
    4    HB3  GLU  37           HB3      GLU  37 -19.163   2.099 -12.640
    5    HG2  GLU  37           HG2      GLU  37 -19.442   1.606 -14.982
    6    HG3  GLU  37           HG3      GLU  37 -21.178   1.886 -14.857

  No H/Q in entry =           6
  In of MODEL   17
    1    H    ALA  38           H        ALA  38 -18.297  -0.366 -11.491
    2    HA   ALA  38           HA       ALA  38 -19.308  -0.207  -8.712
    3    HB1  ALA  38           HB1      ALA  38 -17.490  -2.057 -10.126
    4    HB3  ALA  38           HB2      ALA  38 -18.507  -2.336  -8.712
    5    HB2  ALA  38           HB3      ALA  38 -16.940  -1.548  -8.529

  No H/Q in entry =           5
  In of MODEL   17
    1    H    PHE  39           H        PHE  39 -18.132   1.104  -7.272
    2    HA   PHE  39           HA       PHE  39 -15.699   2.450  -8.217
    3    HB2  PHE  39           HB2      PHE  39 -18.181   3.804  -7.176
    4    HB3  PHE  39           HB3      PHE  39 -16.597   4.574  -7.161
    5    HD1  PHE  39           HD1      PHE  39 -15.358   4.627  -9.451
    6    HD2  PHE  39           HD2      PHE  39 -19.563   4.108  -8.977
    7    HE1  PHE  39           HE1      PHE  39 -15.704   5.421 -11.772
    8    HE2  PHE  39           HE2      PHE  39 -19.925   4.892 -11.290
    9    HZ   PHE  39           HZ       PHE  39 -18.000   5.521 -12.706

  No H/Q in entry =           9
  In of MODEL   17
    1    HA   PRO  40           HA       PRO  40 -14.668   1.830  -3.930
    2    HB2  PRO  40           HB2      PRO  40 -13.030   3.967  -3.378
    3    HB3  PRO  40           HB3      PRO  40 -12.512   2.647  -4.427
    4    HG2  PRO  40           HG2      PRO  40 -13.716   5.297  -5.210
    5    HG3  PRO  40           HG3      PRO  40 -12.248   4.535  -5.819
    6    HD2  PRO  40           HD2      PRO  40 -14.474   4.286  -7.197
    7    HD3  PRO  40           HD3      PRO  40 -13.425   2.883  -6.994

  No H/Q in entry =           7
  In of MODEL   17
    1    H    GLU  41           H        GLU  41 -15.330   2.802  -1.810
    2    HA   GLU  41           HA       GLU  41 -17.681   4.354  -1.795
    3    HB2  GLU  41           HB2      GLU  41 -17.511   4.326   0.581
    4    HB3  GLU  41           HB3      GLU  41 -16.919   2.769   0.003
    5    HG2  GLU  41           HG2      GLU  41 -14.610   3.530   0.323
    6    HG3  GLU  41           HG3      GLU  41 -15.207   5.082   0.911

  No H/Q in entry =           6
  In of MODEL   17
    1    H    THR  42           H        THR  42 -14.417   5.486  -1.900
    2    HA   THR  42           HA       THR  42 -14.925   8.039  -0.726
    3    HB   THR  42           HB       THR  42 -12.820   8.735  -1.824
    4    HG1  THR  42           HG1      THR  42 -11.756   6.997  -3.041
    5   HG22  THR  42          HG21      THR  42 -11.350   6.985  -0.819
    6   HG21  THR  42          HG22      THR  42 -12.775   5.971  -0.587
    7   HG23  THR  42          HG23      THR  42 -12.638   7.507   0.268

  No H/Q in entry =           7
  In of MODEL   17
    1    H    LEU  43           H        LEU  43 -15.789   6.835  -3.797
    2    HA   LEU  43           HA       LEU  43 -16.233   9.568  -4.810
    3    HB2  LEU  43           HB2      LEU  43 -16.436   6.880  -6.155
    4    HB3  LEU  43           HB3      LEU  43 -16.758   8.427  -6.934
    5    HG   LEU  43           HG       LEU  43 -14.070   7.521  -5.934
    6   HD13  LEU  43          HD11      LEU  43 -13.509   6.989  -8.132
    7   HD12  LEU  43          HD12      LEU  43 -14.872   7.886  -8.798
    8   HD11  LEU  43          HD13      LEU  43 -15.147   6.350  -7.977
    9   HD21  LEU  43          HD21      LEU  43 -15.019   9.962  -7.437
   10   HD23  LEU  43          HD22      LEU  43 -13.324   9.481  -7.335
   11   HD22  LEU  43          HD23      LEU  43 -14.211   9.906  -5.871

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ALA  44           H        ALA  44 -18.035   7.651  -2.905
    2    HA   ALA  44           HA       ALA  44 -20.512   7.326  -4.195
    3    HB2  ALA  44           HB1      ALA  44 -20.278   6.257  -2.082
    4    HB3  ALA  44           HB2      ALA  44 -21.469   7.531  -1.819
    5    HB1  ALA  44           HB3      ALA  44 -19.803   7.758  -1.288

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLY  45           H        GLY  45 -19.264  10.239  -2.726
    2    HA3  GLY  45           HA2      GLY  45 -21.798  11.570  -3.082
    3    HA2  GLY  45           HA3      GLY  45 -20.292  12.304  -2.534

  No H/Q in entry =           3
  In of MODEL   17
    1    H    GLU  46           H        GLU  46 -18.726  11.430  -4.826
    2    HA   GLU  46           HA       GLU  46 -19.527  13.569  -6.625
    3    HB2  GLU  46           HB2      GLU  46 -17.203  11.635  -6.655
    4    HB3  GLU  46           HB3      GLU  46 -17.429  12.942  -7.819
    5    HG2  GLU  46           HG2      GLU  46 -17.068  13.301  -4.852
    6    HG3  GLU  46           HG3      GLU  46 -15.799  13.489  -6.062

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LYS  47           H        LYS  47 -19.180  10.058  -7.003
    2    HA   LYS  47           HA       LYS  47 -20.319  10.159  -9.668
    3    HB2  LYS  47           HB2      LYS  47 -18.992   8.173  -7.971
    4    HB3  LYS  47           HB3      LYS  47 -20.341   7.519  -8.901
    5    HG2  LYS  47           HG2      LYS  47 -18.310   7.213 -10.130
    6    HG3  LYS  47           HG3      LYS  47 -19.304   8.416 -10.950
    7    HD2  LYS  47           HD2      LYS  47 -17.996  10.197  -9.836
    8    HD3  LYS  47           HD3      LYS  47 -16.960   8.957  -9.133
    9    HE2  LYS  47           HE2      LYS  47 -17.376   9.382 -12.085
   10    HE3  LYS  47           HE3      LYS  47 -16.000   9.984 -11.162
   11    HZ3  LYS  47           HZ1      LYS  47 -15.046   8.004 -11.185
   12    HZ2  LYS  47           HZ2      LYS  47 -16.172   7.569 -12.380
   13    HZ1  LYS  47           HZ3      LYS  47 -16.477   7.197 -10.750

  No H/Q in entry =          13
  In of MODEL   17
    1    H    GLY  48           H        GLY  48 -21.556   9.371  -6.493
    2    HA3  GLY  48           HA2      GLY  48 -23.865   8.019  -7.187
    3    HA2  GLY  48           HA3      GLY  48 -23.690   9.051  -5.767

  No H/Q in entry =           3
  In of MODEL   17
    1    H    GLN  49           H        GLN  49 -23.285  11.479  -7.384
    2    HA   GLN  49           HA       GLN  49 -25.914  12.417  -7.517
    3    HB2  GLN  49           HB2      GLN  49 -23.447  13.423  -8.921
    4    HB3  GLN  49           HB3      GLN  49 -24.967  14.292  -8.836
    5    HG2  GLN  49           HG2      GLN  49 -24.785  14.368  -6.401
    6    HG3  GLN  49           HG3      GLN  49 -23.275  13.477  -6.485
    7   HE21  GLN  49          HE21      GLN  49 -23.291  15.730  -5.251
    8   HE22  GLN  49          HE22      GLN  49 -22.459  17.033  -5.930

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ASN  50           H        ASN  50 -24.140  10.611  -9.892
    2    HA   ASN  50           HA       ASN  50 -26.098  11.322 -11.967
    3    HB2  ASN  50           HB2      ASN  50 -23.425   9.950 -12.205
    4    HB3  ASN  50           HB3      ASN  50 -24.515  10.283 -13.543
    5   HD21  ASN  50          HD21      ASN  50 -21.923  11.327 -11.977
    6   HD22  ASN  50          HD22      ASN  50 -21.801  12.968 -12.349

  No H/Q in entry =           6
  In of MODEL   17
    1    H    ALA  51           H        ALA  51 -25.905   9.010  -9.682
    2    HA   ALA  51           HA       ALA  51 -26.567   6.788 -11.463
    3    HB2  ALA  51           HB1      ALA  51 -25.878   5.509  -9.762
    4    HB3  ALA  51           HB2      ALA  51 -27.040   6.261  -8.669
    5    HB1  ALA  51           HB3      ALA  51 -25.448   6.984  -8.896

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ASP  52           H        ASP  52 -28.497   5.607 -11.282
    2    HA   ASP  52           HA       ASP  52 -30.786   7.306 -10.623
    3    HB2  ASP  52           HB2      ASP  52 -30.450   4.790 -12.253
    4    HB3  ASP  52           HB3      ASP  52 -32.035   5.428 -11.812

  No H/Q in entry =           4
  In of MODEL   17
    1    H    VAL  53           H        VAL  53 -28.990   4.545  -9.577
    2    HA   VAL  53           HA       VAL  53 -30.409   4.623  -7.047
    3    HB   VAL  53           HB       VAL  53 -31.712   2.872  -8.246
    4   HG11  VAL  53          HG11      VAL  53 -29.930   2.101  -9.775
    5   HG13  VAL  53          HG12      VAL  53 -30.668   0.770  -8.884
    6   HG12  VAL  53          HG13      VAL  53 -29.088   1.384  -8.400
    7   HG23  VAL  53          HG21      VAL  53 -30.747   0.981  -6.531
    8   HG22  VAL  53          HG22      VAL  53 -31.953   2.217  -6.174
    9   HG21  VAL  53          HG23      VAL  53 -30.257   2.505  -5.789

  No H/Q in entry =           9
  In of MODEL   17
    1    H    VAL  54           H        VAL  54 -29.054   4.304  -5.400
    2    HA   VAL  54           HA       VAL  54 -26.251   3.622  -6.029
    3    HB   VAL  54           HB       VAL  54 -27.410   5.367  -3.797
    4   HG11  VAL  54          HG11      VAL  54 -24.748   4.111  -4.095
    5   HG13  VAL  54          HG12      VAL  54 -25.528   4.766  -2.655
    6   HG12  VAL  54          HG13      VAL  54 -24.703   5.846  -3.779
    7   HG22  VAL  54          HG21      VAL  54 -26.680   7.213  -4.937
    8   HG21  VAL  54          HG22      VAL  54 -27.178   6.167  -6.266
    9   HG23  VAL  54          HG23      VAL  54 -25.471   6.309  -5.848

  No H/Q in entry =           9
  In of MODEL   17
    1    H    LEU  55           H        LEU  55 -25.531   1.754  -5.362
    2    HA   LEU  55           HA       LEU  55 -26.928   0.388  -3.147
    3    HB2  LEU  55           HB2      LEU  55 -25.325  -0.718  -5.440
    4    HB3  LEU  55           HB3      LEU  55 -26.010  -1.677  -4.127
    5    HG   LEU  55           HG       LEU  55 -27.568  -0.222  -6.255
    6   HD13  LEU  55          HD11      LEU  55 -27.164  -2.072  -7.447
    7   HD12  LEU  55          HD12      LEU  55 -28.050  -2.985  -6.226
    8   HD11  LEU  55          HD13      LEU  55 -26.301  -2.807  -6.096
    9   HD23  LEU  55          HD21      LEU  55 -28.716  -2.213  -4.352
   10   HD22  LEU  55          HD22      LEU  55 -29.507  -0.893  -5.215
   11   HD21  LEU  55          HD23      LEU  55 -28.490  -0.548  -3.815

  No H/Q in entry =          11
  In of MODEL   17
    1    H    LEU  56           H        LEU  56 -25.722  -0.101  -1.346
    2    HA   LEU  56           HA       LEU  56 -22.820   0.479  -1.436
    3    HB2  LEU  56           HB2      LEU  56 -24.580   0.197   0.987
    4    HB3  LEU  56           HB3      LEU  56 -22.901   0.733   0.948
    5    HG   LEU  56           HG       LEU  56 -25.313   2.245  -0.016
    6   HD11  LEU  56          HD11      LEU  56 -24.150   1.979   2.497
    7   HD13  LEU  56          HD12      LEU  56 -25.230   3.273   1.979
    8   HD12  LEU  56          HD13      LEU  56 -23.484   3.488   1.870
    9   HD23  LEU  56          HD21      LEU  56 -23.482   4.061  -0.261
   10   HD22  LEU  56          HD22      LEU  56 -23.808   2.919  -1.565
   11   HD21  LEU  56          HD23      LEU  56 -22.424   2.671  -0.503

  No H/Q in entry =          11
  In of MODEL   17
    1    H    GLY  57           H        GLY  57 -21.334  -1.050  -0.892
    2    HA3  GLY  57           HA2      GLY  57 -22.083  -3.792  -1.032
    3    HA2  GLY  57           HA3      GLY  57 -20.491  -3.187  -0.578

  No H/Q in entry =           3
  In of MODEL   17
    1    HA   PRO  58           HA       PRO  58 -23.191  -4.338   3.179
    2    HB2  PRO  58           HB2      PRO  58 -22.336  -6.883   3.821
    3    HB3  PRO  58           HB3      PRO  58 -23.753  -6.581   2.817
    4    HG2  PRO  58           HG2      PRO  58 -20.984  -7.300   2.014
    5    HG3  PRO  58           HG3      PRO  58 -22.523  -7.870   1.369
    6    HD2  PRO  58           HD2      PRO  58 -21.046  -5.977   0.097
    7    HD3  PRO  58           HD3      PRO  58 -22.808  -6.004   0.014

  No H/Q in entry =           7
  In of MODEL   17
    1    H    GLN  59           H        GLN  59 -19.803  -4.606   2.540
    2    HA   GLN  59           HA       GLN  59 -19.019  -4.528   5.293
    3    HB2  GLN  59           HB2      GLN  59 -17.526  -3.649   2.818
    4    HB3  GLN  59           HB3      GLN  59 -16.832  -3.732   4.423
    5    HG2  GLN  59           HG2      GLN  59 -17.900  -6.046   2.816
    6    HG3  GLN  59           HG3      GLN  59 -16.208  -5.666   3.093
    7   HE21  GLN  59          HE21      GLN  59 -15.431  -6.582   4.617
    8   HE22  GLN  59          HE22      GLN  59 -15.817  -7.425   5.998

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ILE  60           H        ILE  60 -20.136  -2.080   3.052
    2    HA   ILE  60           HA       ILE  60 -19.387  -0.038   5.054
    3    HB   ILE  60           HB       ILE  60 -19.759   1.640   3.197
    4   HG12  ILE  60          HG12      ILE  60 -19.406  -0.604   1.255
    5   HG13  ILE  60          HG13      ILE  60 -21.026  -0.180   1.807
    6   HG21  ILE  60          HG21      ILE  60 -17.546   0.808   3.936
    7   HG23  ILE  60          HG22      ILE  60 -17.599   1.382   2.270
    8   HG22  ILE  60          HG23      ILE  60 -17.597  -0.349   2.606
    9   HD12  ILE  60          HD11      ILE  60 -19.113   1.419   0.143
   10   HD11  ILE  60          HD12      ILE  60 -20.327   2.248   1.118
   11   HD13  ILE  60          HD13      ILE  60 -20.827   1.100  -0.124

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ALA  61           H        ALA  61 -21.737  -1.773   5.179
    2    HA   ALA  61           HA       ALA  61 -24.068  -0.261   4.719
    3    HB1  ALA  61           HB1      ALA  61 -25.172  -1.801   6.084
    4    HB2  ALA  61           HB2      ALA  61 -23.742  -2.083   7.076
    5    HB3  ALA  61           HB3      ALA  61 -23.817  -2.724   5.434

  No H/Q in entry =           5
  In of MODEL   17
    1    H    TYR  62           H        TYR  62 -21.828  -0.184   7.492
    2    HA   TYR  62           HA       TYR  62 -23.467   1.401   9.152
    3    HB2  TYR  62           HB2      TYR  62 -21.440   1.981  10.350
    4    HB3  TYR  62           HB3      TYR  62 -21.404   0.270   9.926
    5    HD1  TYR  62           HD1      TYR  62 -19.778  -0.590   8.304
    6    HD2  TYR  62           HD2      TYR  62 -19.847   3.558   9.330
    7    HE1  TYR  62           HE1      TYR  62 -17.594  -0.285   7.202
    8    HE2  TYR  62           HE2      TYR  62 -17.648   3.857   8.229
    9    HH   TYR  62           HH       TYR  62 -15.670   1.352   7.445

  No H/Q in entry =           9
  In of MODEL   17
    1    H    MET  63           H        MET  63 -21.912   2.310   6.262
    2    HA   MET  63           HA       MET  63 -21.916   5.160   6.907
    3    HB2  MET  63           HB2      MET  63 -21.242   3.634   4.391
    4    HB3  MET  63           HB3      MET  63 -21.156   5.390   4.541
    5    HG2  MET  63           HG2      MET  63 -19.413   5.173   6.215
    6    HG3  MET  63           HG3      MET  63 -19.510   3.417   6.098
    7    HE1  MET  63           HE1      MET  63 -18.547   6.672   4.606
    8    HE3  MET  63           HE2      MET  63 -19.539   6.269   3.204
    9    HE2  MET  63           HE3      MET  63 -17.781   6.318   3.056

  No H/Q in entry =           9
  In of MODEL   17
    1    H    LEU  64           H        LEU  64 -24.370   3.133   6.004
    2    HA   LEU  64           HA       LEU  64 -25.688   4.436   3.917
    3    HB2  LEU  64           HB2      LEU  64 -26.413   2.297   4.880
    4    HB3  LEU  64           HB3      LEU  64 -26.906   3.135   6.351
    5    HG   LEU  64           HG       LEU  64 -28.689   4.261   5.122
    6   HD13  LEU  64          HD11      LEU  64 -28.446   4.478   2.882
    7   HD12  LEU  64          HD12      LEU  64 -28.990   2.804   2.772
    8   HD11  LEU  64          HD13      LEU  64 -27.266   3.171   2.805
    9   HD23  LEU  64          HD21      LEU  64 -29.039   1.408   4.427
   10   HD22  LEU  64          HD22      LEU  64 -30.085   2.495   5.341
   11   HD21  LEU  64          HD23      LEU  64 -28.655   1.802   6.104

  No H/Q in entry =          11
  In of MODEL   17
    1    HA   PRO  65           HA       PRO  65 -28.030   7.498   6.640
    2    HB2  PRO  65           HB2      PRO  65 -26.017   7.818   8.867
    3    HB3  PRO  65           HB3      PRO  65 -27.770   7.992   8.929
    4    HG2  PRO  65           HG2      PRO  65 -26.692   5.816   9.882
    5    HG3  PRO  65           HG3      PRO  65 -28.119   5.678   8.855
    6    HD2  PRO  65           HD2      PRO  65 -25.222   5.229   8.128
    7    HD3  PRO  65           HD3      PRO  65 -26.628   4.247   7.713

  No H/Q in entry =           7
  In of MODEL   17
    1    H    GLU  66           H        GLU  66 -24.476   7.661   6.670
    2    HA   GLU  66           HA       GLU  66 -24.355  10.465   6.215
    3    HB2  GLU  66           HB2      GLU  66 -22.411   8.261   5.581
    4    HB3  GLU  66           HB3      GLU  66 -22.069   9.974   5.339
    5    HG2  GLU  66           HG2      GLU  66 -22.276  10.373   7.703
    6    HG3  GLU  66           HG3      GLU  66 -22.696   8.681   7.968

  No H/Q in entry =           6
  In of MODEL   17
    1    H    ILE  67           H        ILE  67 -24.314   7.679   4.011
    2    HA   ILE  67           HA       ILE  67 -24.028   9.368   1.685
    3    HB   ILE  67           HB       ILE  67 -24.746   6.416   1.924
    4   HG12  ILE  67          HG12      ILE  67 -22.202   7.726   0.951
    5   HG13  ILE  67          HG13      ILE  67 -22.453   7.319   2.647
    6   HG21  ILE  67          HG21      ILE  67 -24.828   8.255  -0.333
    7   HG23  ILE  67          HG22      ILE  67 -25.350   6.573  -0.246
    8   HG22  ILE  67          HG23      ILE  67 -23.666   6.955  -0.601
    9   HD12  ILE  67          HD11      ILE  67 -21.952   5.535   0.323
   10   HD11  ILE  67          HD12      ILE  67 -22.915   4.925   1.668
   11   HD13  ILE  67          HD13      ILE  67 -21.270   5.496   1.948

  No H/Q in entry =          11
  In of MODEL   17
    1    H    GLN  68           H        GLN  68 -26.810   8.173   3.370
    2    HA   GLN  68           HA       GLN  68 -28.715   8.958   1.403
    3    HB2  GLN  68           HB2      GLN  68 -28.915   8.638   4.395
    4    HB3  GLN  68           HB3      GLN  68 -30.278   9.136   3.408
    5    HG2  GLN  68           HG2      GLN  68 -30.200   7.085   2.167
    6    HG3  GLN  68           HG3      GLN  68 -28.710   6.611   2.961
    7   HE21  GLN  68          HE21      GLN  68 -30.804   5.123   2.875
    8   HE22  GLN  68          HE22      GLN  68 -31.589   4.644   4.308

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ARG  69           H        ARG  69 -27.179  10.764   4.093
    2    HA   ARG  69           HA       ARG  69 -28.693  13.154   3.661
    3    HB2  ARG  69           HB2      ARG  69 -26.280  12.392   5.236
    4    HB3  ARG  69           HB3      ARG  69 -26.463  14.097   4.850
    5    HG2  ARG  69           HG2      ARG  69 -28.768  14.022   5.849
    6    HG3  ARG  69           HG3      ARG  69 -28.456  12.355   6.349
    7    HD2  ARG  69           HD2      ARG  69 -26.893  14.821   7.202
    8    HD3  ARG  69           HD3      ARG  69 -27.956  13.868   8.225
    9    HE   ARG  69           HE       ARG  69 -25.305  13.074   7.260
   10   HH21  ARG  69          HH11      ARG  69 -24.381  11.382   8.474
   11   HH22  ARG  69          HH12      ARG  69 -25.347  10.528   9.630
   12   HH11  ARG  69          HH21      ARG  69 -28.206  12.385   9.002
   13   HH12  ARG  69          HH22      ARG  69 -27.512  11.092   9.926

  No H/Q in entry =          13
  In of MODEL   17
    1    H    LEU  70           H        LEU  70 -25.760  11.894   2.290
    2    HA   LEU  70           HA       LEU  70 -24.800  14.299   1.068
    3    HB2  LEU  70           HB2      LEU  70 -23.665  12.054   1.690
    4    HB3  LEU  70           HB3      LEU  70 -24.270  11.526   0.120
    5    HG   LEU  70           HG       LEU  70 -22.772  12.969  -1.007
    6   HD11  LEU  70          HD11      LEU  70 -21.968  13.907   1.755
    7   HD13  LEU  70          HD12      LEU  70 -22.736  14.877   0.498
    8   HD12  LEU  70          HD13      LEU  70 -21.091  14.287   0.270
    9   HD22  LEU  70          HD21      LEU  70 -21.239  11.343  -0.764
   10   HD21  LEU  70          HD22      LEU  70 -22.117  10.792   0.662
   11   HD23  LEU  70          HD23      LEU  70 -20.795  11.946   0.831

  No H/Q in entry =          11
  In of MODEL   17
    1    H    LEU  71           H        LEU  71 -26.815  11.617   0.023
    2    HA   LEU  71           HA       LEU  71 -27.454  13.029  -2.512
    3    HB2  LEU  71           HB2      LEU  71 -27.483  10.046  -2.013
    4    HB3  LEU  71           HB3      LEU  71 -27.679  10.870  -3.559
    5    HG   LEU  71           HG       LEU  71 -25.144  11.055  -1.930
    6   HD12  LEU  71          HD11      LEU  71 -25.133   9.384  -4.333
    7   HD11  LEU  71          HD12      LEU  71 -26.091   8.727  -3.008
    8   HD13  LEU  71          HD13      LEU  71 -24.386   9.109  -2.759
    9   HD22  LEU  71          HD21      LEU  71 -25.367  12.836  -3.452
   10   HD21  LEU  71          HD22      LEU  71 -25.821  11.744  -4.760
   11   HD23  LEU  71          HD23      LEU  71 -24.185  11.701  -4.100

  No H/Q in entry =          11
  In of MODEL   17
    1    HA   PRO  72           HA       PRO  72 -31.258  12.409   0.165
    2    HB2  PRO  72           HB2      PRO  72 -32.259  14.915   0.052
    3    HB3  PRO  72           HB3      PRO  72 -30.914  14.557   1.134
    4    HG2  PRO  72           HG2      PRO  72 -30.827  15.712  -1.641
    5    HG3  PRO  72           HG3      PRO  72 -30.075  16.331  -0.171
    6    HD2  PRO  72           HD2      PRO  72 -28.673  14.818  -1.928
    7    HD3  PRO  72           HD3      PRO  72 -28.390  14.696  -0.192

  No H/Q in entry =           7
  In of MODEL   17
    1    H    ASN  73           H        ASN  73 -30.726  13.340  -3.073
    2    HA   ASN  73           HA       ASN  73 -33.572  12.864  -3.663
    3    HB2  ASN  73           HB2      ASN  73 -33.193  13.956  -5.784
    4    HB3  ASN  73           HB3      ASN  73 -32.709  14.988  -4.447
    5   HD21  ASN  73          HD21      ASN  73 -31.948  15.029  -7.134
    6   HD22  ASN  73          HD22      ASN  73 -30.276  14.957  -7.344

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LYS  74           H        LYS  74 -31.465  10.727  -3.226
    2    HA   LYS  74           HA       LYS  74 -31.985   9.259  -5.742
    3    HB2  LYS  74           HB2      LYS  74 -29.422   9.134  -4.149
    4    HB3  LYS  74           HB3      LYS  74 -29.778   8.276  -5.648
    5    HG2  LYS  74           HG2      LYS  74 -29.673  11.259  -5.499
    6    HG3  LYS  74           HG3      LYS  74 -28.247  10.267  -5.802
    7    HD2  LYS  74           HD2      LYS  74 -29.334   9.246  -7.716
    8    HD3  LYS  74           HD3      LYS  74 -30.802  10.170  -7.395
    9    HE2  LYS  74           HE2      LYS  74 -29.692  12.232  -7.886
   10    HE3  LYS  74           HE3      LYS  74 -28.127  11.424  -7.982
   11    HZ2  LYS  74           HZ1      LYS  74 -29.653  11.909 -10.099
   12    HZ1  LYS  74           HZ2      LYS  74 -30.220  10.361  -9.692
   13    HZ3  LYS  74           HZ3      LYS  74 -28.569  10.605 -10.012

  No H/Q in entry =          13
  In of MODEL   17
    1    HA   PRO  75           HA       PRO  75 -33.182   6.256  -2.705
    2    HB2  PRO  75           HB2      PRO  75 -33.390   3.997  -4.245
    3    HB3  PRO  75           HB3      PRO  75 -34.588   5.288  -4.323
    4    HG2  PRO  75           HG2      PRO  75 -32.242   4.786  -6.113
    5    HG3  PRO  75           HG3      PRO  75 -33.916   5.126  -6.547
    6    HD2  PRO  75           HD2      PRO  75 -32.077   7.093  -6.559
    7    HD3  PRO  75           HD3      PRO  75 -33.723   7.414  -6.007

  No H/Q in entry =           7
  In of MODEL   17
    1    H    VAL  76           H        VAL  76 -31.658   5.305  -1.332
    2    HA   VAL  76           HA       VAL  76 -29.145   4.209  -2.449
    3    HB   VAL  76           HB       VAL  76 -29.481   5.705   0.187
    4   HG11  VAL  76          HG11      VAL  76 -27.075   4.520  -1.212
    5   HG13  VAL  76          HG12      VAL  76 -27.728   4.061   0.362
    6   HG12  VAL  76          HG13      VAL  76 -26.967   5.639   0.150
    7   HG22  VAL  76          HG21      VAL  76 -28.926   7.622  -0.740
    8   HG21  VAL  76          HG22      VAL  76 -29.447   6.872  -2.249
    9   HG23  VAL  76          HG23      VAL  76 -27.738   6.883  -1.815

  No H/Q in entry =           9
  In of MODEL   17
    1    H    GLU  77           H        GLU  77 -28.806   2.081  -1.802
    2    HA   GLU  77           HA       GLU  77 -29.518   1.300   0.874
    3    HB2  GLU  77           HB2      GLU  77 -31.041  -0.440   0.391
    4    HB3  GLU  77           HB3      GLU  77 -31.679   1.039  -0.330
    5    HG2  GLU  77           HG2      GLU  77 -31.055   0.276  -2.511
    6    HG3  GLU  77           HG3      GLU  77 -30.326  -1.172  -1.821

  No H/Q in entry =           6
  In of MODEL   17
    1    H    VAL  78           H        VAL  78 -29.072  -0.754   1.566
    2    HA   VAL  78           HA       VAL  78 -26.379  -1.397   0.658
    3    HB   VAL  78           HB       VAL  78 -28.010  -2.329   3.060
    4   HG11  VAL  78          HG11      VAL  78 -25.621  -3.451   1.928
    5   HG13  VAL  78          HG12      VAL  78 -26.486  -3.944   3.384
    6   HG12  VAL  78          HG13      VAL  78 -25.229  -2.712   3.479
    7   HG22  VAL  78          HG21      VAL  78 -26.611  -0.867   4.356
    8   HG21  VAL  78          HG22      VAL  78 -27.413   0.039   3.073
    9   HG23  VAL  78          HG23      VAL  78 -25.713  -0.400   2.913

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ILE  79           H        ILE  79 -25.750  -3.290  -0.220
    2    HA   ILE  79           HA       ILE  79 -27.742  -4.900  -1.517
    3    HB   ILE  79           HB       ILE  79 -24.725  -5.261  -1.323
    4   HG12  ILE  79          HG12      ILE  79 -26.445  -4.288  -3.610
    5   HG13  ILE  79          HG13      ILE  79 -25.614  -3.212  -2.485
    6   HG22  ILE  79          HG21      ILE  79 -25.788  -6.540  -3.608
    7   HG21  ILE  79          HG22      ILE  79 -26.728  -7.089  -2.220
    8   HG23  ILE  79          HG23      ILE  79 -24.974  -7.273  -2.226
    9   HD13  ILE  79          HD11      ILE  79 -24.216  -3.282  -4.319
   10   HD12  ILE  79          HD12      ILE  79 -24.467  -5.011  -4.566
   11   HD11  ILE  79          HD13      ILE  79 -23.495  -4.446  -3.206

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ASP  80           H        ASP  80 -28.496  -6.856  -0.890
    2    HA   ASP  80           HA       ASP  80 -28.364  -7.704   1.770
    3    HB2  ASP  80           HB2      ASP  80 -30.102  -8.404   0.163
    4    HB3  ASP  80           HB3      ASP  80 -28.901  -9.363  -0.703

  No H/Q in entry =           4
  In of MODEL   17
    1    H    SER  81           H        SER  81 -26.757  -8.734   2.902
    2    HA   SER  81           HA       SER  81 -24.241  -9.303   1.692
    3    HB2  SER  81           HB2      SER  81 -23.610 -10.260   3.871
    4    HB3  SER  81           HB3      SER  81 -24.396  -8.693   4.066
    5    HG   SER  81           HG       SER  81 -26.361  -9.963   4.391

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU  82           H        LEU  82 -26.831 -11.531   2.083
    2    HA   LEU  82           HA       LEU  82 -25.163 -13.822   1.586
    3    HB2  LEU  82           HB2      LEU  82 -28.131 -13.370   1.353
    4    HB3  LEU  82           HB3      LEU  82 -27.343 -14.936   1.166
    5    HG   LEU  82           HG       LEU  82 -27.338 -13.304   3.687
    6   HD13  LEU  82          HD11      LEU  82 -29.553 -14.024   3.499
    7   HD12  LEU  82          HD12      LEU  82 -28.799 -15.359   4.374
    8   HD11  LEU  82          HD13      LEU  82 -29.101 -15.498   2.642
    9   HD23  LEU  82          HD21      LEU  82 -26.611 -15.643   4.520
   10   HD22  LEU  82          HD22      LEU  82 -25.423 -14.654   3.671
   11   HD21  LEU  82          HD23      LEU  82 -26.244 -15.965   2.823

  No H/Q in entry =          11
  In of MODEL   17
    1    H    LEU  83           H        LEU  83 -27.260 -11.740  -0.349
    2    HA   LEU  83           HA       LEU  83 -27.014 -13.131  -2.798
    3    HB2  LEU  83           HB2      LEU  83 -27.572 -10.238  -2.196
    4    HB3  LEU  83           HB3      LEU  83 -27.588 -10.913  -3.824
    5    HG   LEU  83           HG       LEU  83 -29.573 -11.369  -1.617
    6   HD13  LEU  83          HD11      LEU  83 -30.440  -9.585  -2.705
    7   HD12  LEU  83          HD12      LEU  83 -30.857 -10.745  -3.964
    8   HD11  LEU  83          HD13      LEU  83 -29.372  -9.799  -4.091
    9   HD23  LEU  83          HD21      LEU  83 -29.675 -12.682  -4.317
   10   HD22  LEU  83          HD22      LEU  83 -30.609 -13.058  -2.870
   11   HD21  LEU  83          HD23      LEU  83 -28.896 -13.471  -2.946

  No H/Q in entry =          11
  In of MODEL   17
    1    H    TYR  84           H        TYR  84 -25.173 -10.613  -1.187
    2    HA   TYR  84           HA       TYR  84 -23.364 -10.066  -3.349
    3    HB2  TYR  84           HB2      TYR  84 -23.931  -8.561  -1.364
    4    HB3  TYR  84           HB3      TYR  84 -22.872  -9.597  -0.409
    5    HD1  TYR  84           HD1      TYR  84 -20.478 -10.001  -1.583
    6    HD2  TYR  84           HD2      TYR  84 -22.999  -6.611  -2.203
    7    HE1  TYR  84           HE1      TYR  84 -18.519  -8.699  -2.340
    8    HE2  TYR  84           HE2      TYR  84 -21.051  -5.300  -2.972
    9    HH   TYR  84           HH       TYR  84 -17.881  -6.825  -3.387

  No H/Q in entry =           9
  In of MODEL   17
    1    H    GLY  85           H        GLY  85 -22.984 -11.998  -0.370
    2    HA3  GLY  85           HA2      GLY  85 -20.364 -12.810  -0.868
    3    HA2  GLY  85           HA3      GLY  85 -21.537 -13.704   0.099

  No H/Q in entry =           3
  In of MODEL   17
    1    H    LYS  86           H        LYS  86 -23.385 -14.214  -1.931
    2    HA   LYS  86           HA       LYS  86 -22.219 -16.550  -3.161
    3    HB2  LYS  86           HB2      LYS  86 -24.480 -16.429  -2.151
    4    HB3  LYS  86           HB3      LYS  86 -24.947 -15.282  -3.406
    5    HG2  LYS  86           HG2      LYS  86 -24.638 -17.017  -5.084
    6    HG3  LYS  86           HG3      LYS  86 -24.229 -18.161  -3.805
    7    HD2  LYS  86           HD2      LYS  86 -26.771 -16.545  -3.774
    8    HD3  LYS  86           HD3      LYS  86 -26.670 -18.119  -4.560
    9    HE2  LYS  86           HE2      LYS  86 -25.738 -18.946  -2.308
   10    HE3  LYS  86           HE3      LYS  86 -26.395 -17.447  -1.653
   11    HZ1  LYS  86           HZ1      LYS  86 -28.078 -19.161  -3.357
   12    HZ3  LYS  86           HZ2      LYS  86 -28.543 -18.063  -2.146
   13    HZ2  LYS  86           HZ3      LYS  86 -27.864 -19.559  -1.719

  No H/Q in entry =          13
  In of MODEL   17
    1    H    VAL  87           H        VAL  87 -22.391 -13.357  -4.112
    2    HA   VAL  87           HA       VAL  87 -22.177 -12.205  -6.078
    3    HB   VAL  87           HB       VAL  87 -20.982 -14.691  -7.346
    4   HG12  VAL  87          HG11      VAL  87 -20.024 -11.838  -7.527
    5   HG11  VAL  87          HG12      VAL  87 -21.352 -12.416  -8.536
    6   HG13  VAL  87          HG13      VAL  87 -19.758 -13.160  -8.662
    7   HG23  VAL  87          HG21      VAL  87 -18.819 -14.122  -6.370
    8   HG22  VAL  87          HG22      VAL  87 -19.991 -14.550  -5.126
    9   HG21  VAL  87          HG23      VAL  87 -19.582 -12.859  -5.406

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ASP  88           H        ASP  88 -24.650 -12.975  -5.683
    2    HA   ASP  88           HA       ASP  88 -25.732 -14.295  -8.044
    3    HB2  ASP  88           HB2      ASP  88 -26.686 -14.550  -5.703
    4    HB3  ASP  88           HB3      ASP  88 -27.231 -12.877  -5.828

  No H/Q in entry =           4
  In of MODEL   17
    1    H    GLY  89           H        GLY  89 -25.116 -13.032  -9.716
    2    HA3  GLY  89           HA2      GLY  89 -25.449 -10.278  -9.965
    3    HA2  GLY  89           HA3      GLY  89 -25.380 -11.421 -11.305

  No H/Q in entry =           3
  In of MODEL   17
    1    H    LEU  90           H        LEU  90 -27.745 -12.895 -10.802
    2    HA   LEU  90           HA       LEU  90 -29.672 -11.082 -11.927
    3    HB2  LEU  90           HB2      LEU  90 -29.612 -13.488 -12.463
    4    HB3  LEU  90           HB3      LEU  90 -30.078 -13.850 -10.801
    5    HG   LEU  90           HG       LEU  90 -32.259 -12.857 -11.158
    6   HD13  LEU  90          HD11      LEU  90 -32.192 -11.136 -12.666
    7   HD12  LEU  90          HD12      LEU  90 -32.677 -12.423 -13.774
    8   HD11  LEU  90          HD13      LEU  90 -30.985 -11.933 -13.678
    9   HD23  LEU  90          HD21      LEU  90 -32.129 -14.526 -13.563
   10   HD22  LEU  90          HD22      LEU  90 -33.081 -14.717 -12.090
   11   HD21  LEU  90          HD23      LEU  90 -31.396 -15.239 -12.125

  No H/Q in entry =          11
  In of MODEL   17
    1    H    GLY  91           H        GLY  91 -29.383 -12.511  -8.718
    2    HA3  GLY  91           HA2      GLY  91 -31.767 -11.508  -7.669
    3    HA2  GLY  91           HA3      GLY  91 -30.337 -11.947  -6.735

  No H/Q in entry =           3
  In of MODEL   17
    1    H    VAL  92           H        VAL  92 -28.531 -10.034  -7.649
    2    HA   VAL  92           HA       VAL  92 -29.429  -7.751  -6.132
    3    HB   VAL  92           HB       VAL  92 -26.881  -8.111  -7.753
    4   HG12  VAL  92          HG11      VAL  92 -27.120  -6.194  -5.459
    5   HG11  VAL  92          HG12      VAL  92 -27.833  -5.717  -7.002
    6   HG13  VAL  92          HG13      VAL  92 -26.112  -6.089  -6.903
    7   HG22  VAL  92          HG21      VAL  92 -26.552  -9.654  -6.134
    8   HG21  VAL  92          HG22      VAL  92 -27.724  -8.917  -5.040
    9   HG23  VAL  92          HG23      VAL  92 -26.108  -8.229  -5.195

  No H/Q in entry =           9
  In of MODEL   17
    1    H    LEU  93           H        LEU  93 -29.028  -8.454  -9.545
    2    HA   LEU  93           HA       LEU  93 -29.528  -5.860 -10.519
    3    HB2  LEU  93           HB2      LEU  93 -28.804  -7.704 -11.954
    4    HB3  LEU  93           HB3      LEU  93 -30.349  -8.513 -11.696
    5    HG   LEU  93           HG       LEU  93 -31.481  -6.630 -12.844
    6   HD11  LEU  93          HD11      LEU  93 -29.714  -4.926 -12.393
    7   HD13  LEU  93          HD12      LEU  93 -30.172  -5.013 -14.095
    8   HD12  LEU  93          HD13      LEU  93 -28.670  -5.756 -13.547
    9   HD23  LEU  93          HD21      LEU  93 -30.440  -7.183 -15.134
   10   HD22  LEU  93          HD22      LEU  93 -31.201  -8.467 -14.194
   11   HD21  LEU  93          HD23      LEU  93 -29.442  -8.314 -14.220

  No H/Q in entry =          11
  In of MODEL   17
    1    H    LYS  94           H        LYS  94 -31.750  -8.516  -9.591
    2    HA   LYS  94           HA       LYS  94 -34.177  -7.217 -10.212
    3    HB2  LYS  94           HB2      LYS  94 -33.520  -9.331  -8.167
    4    HB3  LYS  94           HB3      LYS  94 -35.156  -8.730  -8.426
    5    HG2  LYS  94           HG2      LYS  94 -35.055  -9.543 -10.747
    6    HG3  LYS  94           HG3      LYS  94 -33.451 -10.201 -10.426
    7    HD2  LYS  94           HD2      LYS  94 -34.475 -11.559  -8.562
    8    HD3  LYS  94           HD3      LYS  94 -36.058 -11.008  -9.109
    9    HE2  LYS  94           HE2      LYS  94 -35.520 -11.951 -11.365
   10    HE3  LYS  94           HE3      LYS  94 -34.056 -12.642 -10.665
   11    HZ3  LYS  94           HZ1      LYS  94 -35.821 -14.265 -10.784
   12    HZ2  LYS  94           HZ2      LYS  94 -36.838 -13.276  -9.848
   13    HZ1  LYS  94           HZ3      LYS  94 -35.431 -13.936  -9.164

  No H/Q in entry =          13
  In of MODEL   17
    1    H    ALA  95           H        ALA  95 -32.313  -7.179  -7.185
    2    HA   ALA  95           HA       ALA  95 -34.228  -5.675  -5.711
    3    HB2  ALA  95           HB1      ALA  95 -31.774  -6.908  -5.181
    4    HB3  ALA  95           HB2      ALA  95 -32.787  -6.036  -4.031
    5    HB1  ALA  95           HB3      ALA  95 -31.494  -5.192  -4.884

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA  96           H        ALA  96 -31.662  -4.719  -7.858
    2    HA   ALA  96           HA       ALA  96 -31.707  -1.941  -7.136
    3    HB2  ALA  96           HB1      ALA  96 -30.386  -1.681  -9.267
    4    HB3  ALA  96           HB2      ALA  96 -30.600  -3.409  -9.551
    5    HB1  ALA  96           HB3      ALA  96 -29.696  -2.852  -8.143

  No H/Q in entry =           5
  In of MODEL   17
    1    H    VAL  97           H        VAL  97 -33.177  -3.787  -9.771
    2    HA   VAL  97           HA       VAL  97 -34.385  -1.571 -11.053
    3    HB   VAL  97           HB       VAL  97 -35.036  -4.537 -11.032
    4   HG11  VAL  97          HG11      VAL  97 -36.940  -2.640 -11.530
    5   HG13  VAL  97          HG12      VAL  97 -36.922  -4.246 -12.257
    6   HG12  VAL  97          HG13      VAL  97 -36.253  -2.875 -13.138
    7   HG21  VAL  97          HG21      VAL  97 -33.882  -2.681 -13.116
    8   HG23  VAL  97          HG22      VAL  97 -34.247  -4.388 -13.369
    9   HG22  VAL  97          HG23      VAL  97 -33.007  -3.913 -12.207

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ALA  98           H        ALA  98 -35.418  -3.763  -8.462
    2    HA   ALA  98           HA       ALA  98 -38.032  -2.746  -8.098
    3    HB1  ALA  98           HB1      ALA  98 -36.890  -4.869  -7.039
    4    HB2  ALA  98           HB2      ALA  98 -38.106  -3.992  -6.109
    5    HB3  ALA  98           HB3      ALA  98 -36.392  -3.745  -5.776

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA  99           H        ALA  99 -34.980  -1.755  -6.506
    2    HA   ALA  99           HA       ALA  99 -36.191   0.197  -4.866
    3    HB1  ALA  99           HB1      ALA  99 -33.509  -0.566  -5.632
    4    HB2  ALA  99           HB2      ALA  99 -34.080   0.182  -4.139
    5    HB3  ALA  99           HB3      ALA  99 -33.675   1.187  -5.530

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ILE 100           H        ILE 100 -35.201   0.320  -8.236
    2    HA   ILE 100           HA       ILE 100 -35.531   3.151  -8.503
    3    HB   ILE 100           HB       ILE 100 -35.541   0.956 -10.602
    4   HG12  ILE 100          HG12      ILE 100 -33.476   3.070  -9.995
    5   HG13  ILE 100          HG13      ILE 100 -33.419   1.435  -9.336
    6   HG21  ILE 100          HG21      ILE 100 -36.117   3.847 -10.778
    7   HG23  ILE 100          HG22      ILE 100 -36.570   2.533 -11.865
    8   HG22  ILE 100          HG23      ILE 100 -34.953   3.233 -11.952
    9   HD12  ILE 100          HD11      ILE 100 -32.972   2.368 -12.133
   10   HD11  ILE 100          HD12      ILE 100 -33.544   0.725 -11.841
   11   HD13  ILE 100          HD13      ILE 100 -32.013   1.262 -11.150

  No H/Q in entry =          11
  In of MODEL   17
    1    H    LYS 101           H        LYS 101 -37.695   0.414  -9.153
    2    HA   LYS 101           HA       LYS 101 -39.871   1.934 -10.153
    3    HB2  LYS 101           HB2      LYS 101 -39.598  -0.810  -8.979
    4    HB3  LYS 101           HB3      LYS 101 -41.191  -0.136  -9.317
    5    HG2  LYS 101           HG2      LYS 101 -40.753  -0.018 -11.622
    6    HG3  LYS 101           HG3      LYS 101 -39.035  -0.330 -11.384
    7    HD2  LYS 101           HD2      LYS 101 -40.195  -2.316 -12.220
    8    HD3  LYS 101           HD3      LYS 101 -39.532  -2.585 -10.608
    9    HE2  LYS 101           HE2      LYS 101 -41.549  -3.376 -10.062
   10    HE3  LYS 101           HE3      LYS 101 -42.094  -1.698 -10.088
   11    HZ3  LYS 101           HZ1      LYS 101 -43.002  -1.938 -12.190
   12    HZ2  LYS 101           HZ2      LYS 101 -43.378  -3.421 -11.452
   13    HZ1  LYS 101           HZ3      LYS 101 -42.089  -3.325 -12.553

  No H/Q in entry =          13
  In of MODEL   17
    1    H    LYS 102           H        LYS 102 -39.264   0.541  -6.926
    2    HA   LYS 102           HA       LYS 102 -41.556   1.640  -5.720
    3    HB2  LYS 102           HB2      LYS 102 -40.211  -0.142  -4.689
    4    HB3  LYS 102           HB3      LYS 102 -38.874   0.989  -4.482
    5    HG2  LYS 102           HG2      LYS 102 -40.244   2.339  -2.992
    6    HG3  LYS 102           HG3      LYS 102 -41.584   1.213  -3.201
    7    HD2  LYS 102           HD2      LYS 102 -40.250  -0.569  -2.160
    8    HD3  LYS 102           HD3      LYS 102 -38.910   0.559  -1.949
    9    HE2  LYS 102           HE2      LYS 102 -40.322   1.990  -0.547
   10    HE3  LYS 102           HE3      LYS 102 -41.682   0.891  -0.780
   11    HZ1  LYS 102           HZ1      LYS 102 -39.860  -0.754   0.230
   12    HZ3  LYS 102           HZ2      LYS 102 -41.003   0.088   1.161
   13    HZ2  LYS 102           HZ3      LYS 102 -39.424   0.693   1.003

  No H/Q in entry =          13
  In of MODEL   17
    1    H    ALA 103           H        ALA 103 -38.690   3.165  -6.794
    2    HA   ALA 103           HA       ALA 103 -39.011   5.495  -5.049
    3    HB2  ALA 103           HB1      ALA 103 -37.080   6.304  -6.662
    4    HB3  ALA 103           HB2      ALA 103 -36.961   4.584  -7.032
    5    HB1  ALA 103           HB3      ALA 103 -36.741   5.147  -5.375

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA 104           H        ALA 104 -39.634   4.675  -8.374
    2    HA   ALA 104           HA       ALA 104 -40.370   7.414  -9.034
    3    HB2  ALA 104           HB1      ALA 104 -40.405   6.707 -11.225
    4    HB1  ALA 104           HB2      ALA 104 -41.046   5.116 -10.812
    5    HB3  ALA 104           HB3      ALA 104 -39.337   5.473 -10.559

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA 105           H        ALA 105 -41.845   5.260  -7.175
    2    HA   ALA 105           HA       ALA 105 -44.339   6.527  -7.139
    3    HB2  ALA 105           HB1      ALA 105 -45.062   5.594  -9.153
    4    HB3  ALA 105           HB2      ALA 105 -45.622   4.395  -7.989
    5    HB1  ALA 105           HB3      ALA 105 -44.147   4.107  -8.911

  No H/Q in entry =           5
  In of MODEL   18
    1    H1   ALA   1           H3       ALA   1 -12.067 -16.070  -2.376
    2    H2   ALA   1           H2       ALA   1 -11.111 -17.202  -3.213
    3    H3   ALA   1           H1       ALA   1 -12.268 -16.276  -4.049
    4    HA   ALA   1           HA       ALA   1 -13.644 -17.994  -3.803
    5    HB3  ALA   1           HB1      ALA   1 -12.224 -19.745  -3.335
    6    HB1  ALA   1           HB2      ALA   1 -12.981 -19.637  -1.746
    7    HB2  ALA   1           HB3      ALA   1 -11.415 -18.877  -2.031

  No H/Q in entry =           7
  In of MODEL   18
    1    H    GLU   2           H        GLU   2 -15.254 -18.864  -2.144
    2    HA   GLU   2           HA       GLU   2 -16.924 -17.161  -1.090
    3    HB2  GLU   2           HB2      GLU   2 -15.952 -19.569   0.462
    4    HB3  GLU   2           HB3      GLU   2 -17.487 -18.738   0.714
    5    HG2  GLU   2           HG2      GLU   2 -18.453 -19.843  -1.016
    6    HG3  GLU   2           HG3      GLU   2 -17.136 -19.429  -2.102

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLU   3           H        GLU   3 -14.993 -18.480   1.536
    2    HA   GLU   3           HA       GLU   3 -15.244 -16.124   3.085
    3    HB2  GLU   3           HB2      GLU   3 -13.625 -18.649   3.344
    4    HB3  GLU   3           HB3      GLU   3 -13.411 -17.323   4.486
    5    HG2  GLU   3           HG2      GLU   3 -15.601 -17.500   5.306
    6    HG3  GLU   3           HG3      GLU   3 -16.187 -18.313   3.860

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LEU   4           H        LEU   4 -12.271 -17.569   1.698
    2    HA   LEU   4           HA       LEU   4 -10.462 -15.640   2.288
    3    HB2  LEU   4           HB2      LEU   4 -10.677 -16.950  -0.432
    4    HB3  LEU   4           HB3      LEU   4  -9.234 -16.208   0.250
    5    HG   LEU   4           HG       LEU   4 -10.696 -18.621   1.372
    6   HD13  LEU   4          HD11      LEU   4  -9.046 -19.958   0.446
    7   HD12  LEU   4          HD12      LEU   4  -7.853 -18.660   0.414
    8   HD11  LEU   4          HD13      LEU   4  -9.142 -18.703  -0.788
    9   HD23  LEU   4          HD21      LEU   4  -8.443 -18.650   2.752
   10   HD22  LEU   4          HD22      LEU   4  -9.777 -17.626   3.278
   11   HD21  LEU   4          HD23      LEU   4  -8.425 -16.923   2.393

  No H/Q in entry =          11
  In of MODEL   18
    1    H    GLU   5           H        GLU   5 -12.800 -15.473  -0.385
    2    HA   GLU   5           HA       GLU   5 -11.830 -12.980  -1.395
    3    HB2  GLU   5           HB2      GLU   5 -13.149 -14.576  -2.760
    4    HB3  GLU   5           HB3      GLU   5 -14.553 -14.255  -1.742
    5    HG2  GLU   5           HG2      GLU   5 -14.501 -11.887  -2.374
    6    HG3  GLU   5           HG3      GLU   5 -13.059 -12.165  -3.350

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLU   6           H        GLU   6 -14.542 -13.886   0.701
    2    HA   GLU   6           HA       GLU   6 -15.481 -11.220   1.092
    3    HB2  GLU   6           HB2      GLU   6 -16.882 -13.227   1.498
    4    HB3  GLU   6           HB3      GLU   6 -15.844 -13.656   2.857
    5    HG2  GLU   6           HG2      GLU   6 -16.397 -11.536   3.970
    6    HG3  GLU   6           HG3      GLU   6 -17.412 -11.074   2.605

  No H/Q in entry =           6
  In of MODEL   18
    1    H    VAL   7           H        VAL   7 -13.146 -13.295   2.670
    2    HA   VAL   7           HA       VAL   7 -12.699 -11.706   4.991
    3    HB   VAL   7           HB       VAL   7 -10.970 -13.733   3.548
    4   HG11  VAL   7          HG11      VAL   7 -10.521 -12.185   6.107
    5   HG13  VAL   7          HG12      VAL   7  -9.418 -12.390   4.746
    6   HG12  VAL   7          HG13      VAL   7  -9.754 -13.747   5.821
    7   HG21  VAL   7          HG21      VAL   7 -13.213 -14.322   4.771
    8   HG23  VAL   7          HG22      VAL   7 -12.289 -14.030   6.245
    9   HG22  VAL   7          HG23      VAL   7 -11.780 -15.288   5.120

  No H/Q in entry =           9
  In of MODEL   18
    1    H    VAL   8           H        VAL   8 -11.188 -11.812   1.781
    2    HA   VAL   8           HA       VAL   8  -9.149  -9.911   2.266
    3    HB   VAL   8           HB       VAL   8 -10.604 -10.619  -0.292
    4   HG11  VAL   8          HG11      VAL   8  -8.162  -8.902   0.227
    5   HG13  VAL   8          HG12      VAL   8  -9.650  -8.435  -0.599
    6   HG12  VAL   8          HG13      VAL   8  -8.543  -9.580  -1.357
    7   HG21  VAL   8          HG21      VAL   8  -8.910 -12.192   1.207
    8   HG23  VAL   8          HG22      VAL   8  -7.765 -11.371   0.152
    9   HG22  VAL   8          HG23      VAL   8  -9.069 -12.326  -0.546

  No H/Q in entry =           9
  In of MODEL   18
    1    H    MET   9           H        MET   9 -12.500  -9.569   1.106
    2    HA   MET   9           HA       MET   9 -12.472  -6.793   0.662
    3    HB2  MET   9           HB2      MET   9 -14.655  -8.705   1.483
    4    HB3  MET   9           HB3      MET   9 -14.967  -6.978   1.293
    5    HG2  MET   9           HG2      MET   9 -14.064  -7.101  -1.024
    6    HG3  MET   9           HG3      MET   9 -13.858  -8.842  -0.826
    7    HE2  MET   9           HE1      MET   9 -16.540  -6.145  -2.080
    8    HE1  MET   9           HE2      MET   9 -16.035  -5.917  -0.409
    9    HE3  MET   9           HE3      MET   9 -17.692  -6.396  -0.762

  No H/Q in entry =           9
  In of MODEL   18
    1    H    GLY  10           H        GLY  10 -13.110  -8.683   3.596
    2    HA3  GLY  10           HA2      GLY  10 -13.686  -6.499   5.307
    3    HA2  GLY  10           HA3      GLY  10 -13.101  -8.079   5.827

  No H/Q in entry =           3
  In of MODEL   18
    1    H    LEU  11           H        LEU  11 -10.654  -8.175   4.511
    2    HA   LEU  11           HA       LEU  11  -8.972  -6.713   6.262
    3    HB2  LEU  11           HB2      LEU  11  -8.407  -8.138   3.660
    4    HB3  LEU  11           HB3      LEU  11  -7.146  -7.413   4.656
    5    HG   LEU  11           HG       LEU  11  -9.121  -9.469   5.680
    6   HD13  LEU  11          HD11      LEU  11  -7.883 -10.695   4.120
    7   HD12  LEU  11          HD12      LEU  11  -6.945 -10.916   5.595
    8   HD11  LEU  11          HD13      LEU  11  -6.420  -9.748   4.383
    9   HD22  LEU  11          HD21      LEU  11  -8.281  -8.438   7.593
   10   HD21  LEU  11          HD22      LEU  11  -6.749  -8.019   6.828
   11   HD23  LEU  11          HD23      LEU  11  -7.052  -9.677   7.343

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  12           H        ILE  12  -9.882  -6.190   2.871
    2    HA   ILE  12           HA       ILE  12  -8.221  -3.939   2.436
    3    HB   ILE  12           HB       ILE  12 -10.867  -4.646   1.144
    4   HG12  ILE  12          HG12      ILE  12  -8.812  -6.277   1.079
    5   HG13  ILE  12          HG13      ILE  12  -9.680  -5.941  -0.405
    6   HG21  ILE  12          HG21      ILE  12  -8.659  -2.738   0.307
    7   HG23  ILE  12          HG22      ILE  12 -10.327  -2.320   0.678
    8   HG22  ILE  12          HG23      ILE  12  -9.946  -3.268  -0.731
    9   HD12  ILE  12          HD11      ILE  12  -7.173  -5.863  -0.610
   10   HD11  ILE  12          HD12      ILE  12  -7.181  -4.482   0.483
   11   HD13  ILE  12          HD13      ILE  12  -7.965  -4.369  -1.075

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  13           H        ILE  13 -11.578  -4.249   3.531
    2    HA   ILE  13           HA       ILE  13 -12.077  -1.467   3.791
    3    HB   ILE  13           HB       ILE  13 -13.247  -3.900   5.160
    4   HG12  ILE  13          HG12      ILE  13 -13.477  -3.336   2.615
    5   HG13  ILE  13          HG13      ILE  13 -14.880  -3.863   3.520
    6   HG23  ILE  13          HG21      ILE  13 -13.641  -2.080   6.678
    7   HG22  ILE  13          HG22      ILE  13 -15.146  -2.337   5.806
    8   HG21  ILE  13          HG23      ILE  13 -14.095  -0.993   5.369
    9   HD12  ILE  13          HD11      ILE  13 -15.290  -1.839   2.057
   10   HD11  ILE  13          HD12      ILE  13 -14.177  -0.970   3.095
   11   HD13  ILE  13          HD13      ILE  13 -15.666  -1.599   3.767

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ASN  14           H        ASN  14 -10.930  -3.933   6.074
    2    HA   ASN  14           HA       ASN  14 -10.752  -2.284   8.354
    3    HB2  ASN  14           HB2      ASN  14 -10.462  -4.889   8.041
    4    HB3  ASN  14           HB3      ASN  14  -8.759  -4.478   7.882
    5   HD21  ASN  14          HD21      ASN  14  -9.373  -6.003  10.064
    6   HD22  ASN  14          HD22      ASN  14  -9.358  -5.077  11.485

  No H/Q in entry =           6
  In of MODEL   18
    1    H    SER  15           H        SER  15  -8.339  -3.082   5.865
    2    HA   SER  15           HA       SER  15  -6.218  -1.554   6.931
    3    HB2  SER  15           HB2      SER  15  -5.196  -1.759   4.771
    4    HB3  SER  15           HB3      SER  15  -6.123  -3.235   5.006
    5    HG   SER  15           HG       SER  15  -6.833  -2.605   3.089

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLY  16           H        GLY  16  -8.832  -0.734   4.681
    2    HA3  GLY  16           HA2      GLY  16  -8.014   1.917   4.119
    3    HA2  GLY  16           HA3      GLY  16  -9.655   1.297   3.960

  No H/Q in entry =           3
  In of MODEL   18
    1    H    GLN  17           H        GLN  17 -10.187   0.573   6.612
    2    HA   GLN  17           HA       GLN  17 -10.932   3.071   7.744
    3    HB2  GLN  17           HB2      GLN  17 -12.145   0.989   8.246
    4    HB3  GLN  17           HB3      GLN  17 -10.724   0.360   9.081
    5    HG2  GLN  17           HG2      GLN  17 -10.837   2.181  10.711
    6    HG3  GLN  17           HG3      GLN  17 -12.199   2.895   9.850
    7   HE21  GLN  17          HE21      GLN  17 -12.450   2.106  12.584
    8   HE22  GLN  17          HE22      GLN  17 -13.513   0.783  12.664

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ALA  18           H        ALA  18  -8.268   0.833   8.371
    2    HA   ALA  18           HA       ALA  18  -7.190   2.075  10.637
    3    HB2  ALA  18           HB1      ALA  18  -6.545  -0.136   9.278
    4    HB3  ALA  18           HB2      ALA  18  -5.395   0.669  10.346
    5    HB1  ALA  18           HB3      ALA  18  -5.322   0.942   8.604

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ARG  19           H        ARG  19  -6.427   2.598   7.187
    2    HA   ARG  19           HA       ARG  19  -4.562   4.676   7.607
    3    HB2  ARG  19           HB2      ARG  19  -4.871   3.522   5.416
    4    HB3  ARG  19           HB3      ARG  19  -6.426   4.337   5.236
    5    HG2  ARG  19           HG2      ARG  19  -5.333   6.527   5.296
    6    HG3  ARG  19           HG3      ARG  19  -3.771   5.768   5.603
    7    HD2  ARG  19           HD2      ARG  19  -3.906   6.347   3.258
    8    HD3  ARG  19           HD3      ARG  19  -3.962   4.587   3.410
    9    HE   ARG  19           HE       ARG  19  -6.611   5.453   3.399
   10   HH21  ARG  19          HH11      ARG  19  -7.808   5.582   1.481
   11   HH22  ARG  19          HH12      ARG  19  -6.987   5.667  -0.039
   12   HH11  ARG  19          HH21      ARG  19  -3.836   5.553   1.365
   13   HH12  ARG  19          HH22      ARG  19  -4.737   5.648  -0.105

  No H/Q in entry =          13
  In of MODEL   18
    1    H    SER  20           H        SER  20  -8.061   4.732   7.007
    2    HA   SER  20           HA       SER  20  -8.464   7.482   6.947
    3    HB2  SER  20           HB2      SER  20 -10.157   5.566   6.590
    4    HB3  SER  20           HB3      SER  20 -10.376   5.621   8.337
    5    HG   SER  20           HG       SER  20 -10.726   7.732   6.471

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU  21           H        LEU  21  -8.428   5.310   9.760
    2    HA   LEU  21           HA       LEU  21  -8.902   7.306  11.717
    3    HB2  LEU  21           HB2      LEU  21  -7.501   4.630  11.891
    4    HB3  LEU  21           HB3      LEU  21  -7.835   5.647  13.290
    5    HG   LEU  21           HG       LEU  21  -9.991   4.728  11.367
    6   HD13  LEU  21          HD11      LEU  21 -10.526   2.972  12.964
    7   HD12  LEU  21          HD12      LEU  21  -9.240   3.513  14.042
    8   HD11  LEU  21          HD13      LEU  21  -8.838   2.804  12.477
    9   HD23  LEU  21          HD21      LEU  21 -11.327   5.152  13.605
   10   HD22  LEU  21          HD22      LEU  21 -10.896   6.532  12.600
   11   HD21  LEU  21          HD23      LEU  21  -9.947   6.159  14.030

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ALA  22           H        ALA  22  -5.927   5.977  10.316
    2    HA   ALA  22           HA       ALA  22  -4.070   7.329  11.933
    3    HB2  ALA  22           HB1      ALA  22  -3.622   5.476  10.249
    4    HB1  ALA  22           HB2      ALA  22  -2.448   6.792  10.279
    5    HB3  ALA  22           HB3      ALA  22  -3.665   6.723   9.003

  No H/Q in entry =           5
  In of MODEL   18
    1    H    TYR  23           H        TYR  23  -5.403   8.311   8.746
    2    HA   TYR  23           HA       TYR  23  -4.110  10.829   8.666
    3    HB2  TYR  23           HB2      TYR  23  -5.174   9.893   6.677
    4    HB3  TYR  23           HB3      TYR  23  -6.754   9.971   7.458
    5    HD1  TYR  23           HD1      TYR  23  -3.888  12.072   6.312
    6    HD2  TYR  23           HD2      TYR  23  -8.035  11.953   7.422
    7    HE1  TYR  23           HE1      TYR  23  -4.158  14.414   5.545
    8    HE2  TYR  23           HE2      TYR  23  -8.306  14.297   6.654
    9    HH   TYR  23           HH       TYR  23  -7.172  16.177   6.057

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ALA  24           H        ALA  24  -7.213   9.804  10.049
    2    HA   ALA  24           HA       ALA  24  -8.094  12.382  10.809
    3    HB1  ALA  24           HB1      ALA  24  -9.891  11.102  11.281
    4    HB2  ALA  24           HB2      ALA  24  -9.056  10.550  12.731
    5    HB3  ALA  24           HB3      ALA  24  -8.914   9.634  11.232

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA  25           H        ALA  25  -6.051   9.965  12.394
    2    HA   ALA  25           HA       ALA  25  -5.735  11.233  14.891
    3    HB2  ALA  25           HB1      ALA  25  -4.928   8.891  14.079
    4    HB3  ALA  25           HB2      ALA  25  -3.928   9.771  15.237
    5    HB1  ALA  25           HB3      ALA  25  -3.491   9.755  13.528

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU  26           H        LEU  26  -3.949  11.550  11.850
    2    HA   LEU  26           HA       LEU  26  -2.022  13.407  12.759
    3    HB2  LEU  26           HB2      LEU  26  -1.700  12.252  10.660
    4    HB3  LEU  26           HB3      LEU  26  -3.185  12.932  10.002
    5    HG   LEU  26           HG       LEU  26  -2.209  15.200  10.129
    6   HD12  LEU  26          HD11      LEU  26   0.329  15.265  10.544
    7   HD11  LEU  26          HD12      LEU  26   0.132  13.683  11.294
    8   HD13  LEU  26          HD13      LEU  26  -0.700  15.087  11.965
    9   HD21  LEU  26          HD21      LEU  26  -0.430  13.170   8.743
   10   HD23  LEU  26          HD22      LEU  26  -0.503  14.889   8.365
   11   HD22  LEU  26          HD23      LEU  26  -1.908  13.866   8.081

  No H/Q in entry =          11
  In of MODEL   18
    1    H    LYS  27           H        LYS  27  -5.211  13.830  11.279
    2    HA   LYS  27           HA       LYS  27  -5.203  16.618  11.070
    3    HB2  LYS  27           HB2      LYS  27  -6.921  15.108  10.089
    4    HB3  LYS  27           HB3      LYS  27  -7.574  14.847  11.706
    5    HG2  LYS  27           HG2      LYS  27  -8.044  17.246  11.932
    6    HG3  LYS  27           HG3      LYS  27  -7.340  17.549  10.341
    7    HD2  LYS  27           HD2      LYS  27  -9.048  16.081   9.310
    8    HD3  LYS  27           HD3      LYS  27  -9.758  15.796  10.900
    9    HE2  LYS  27           HE2      LYS  27 -10.241  18.200  11.134
   10    HE3  LYS  27           HE3      LYS  27  -9.503  18.508   9.558
   11    HZ3  LYS  27           HZ1      LYS  27 -11.878  18.342   9.316
   12    HZ2  LYS  27           HZ2      LYS  27 -11.901  16.829  10.092
   13    HZ1  LYS  27           HZ3      LYS  27 -11.159  16.998   8.570

  No H/Q in entry =          13
  In of MODEL   18
    1    H    GLN  28           H        GLN  28  -6.058  14.528  13.805
    2    HA   GLN  28           HA       GLN  28  -6.987  16.524  15.573
    3    HB2  GLN  28           HB2      GLN  28  -5.542  13.919  16.125
    4    HB3  GLN  28           HB3      GLN  28  -6.299  14.915  17.369
    5    HG2  GLN  28           HG2      GLN  28  -7.741  13.760  14.966
    6    HG3  GLN  28           HG3      GLN  28  -7.790  13.079  16.591
    7   HE21  GLN  28          HE21      GLN  28  -9.678  14.854  14.607
    8   HE22  GLN  28          HE22      GLN  28 -10.448  15.862  15.735

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ALA  29           H        ALA  29  -3.747  15.277  14.889
    2    HA   ALA  29           HA       ALA  29  -2.332  16.705  16.862
    3    HB1  ALA  29           HB1      ALA  29  -0.390  16.040  15.747
    4    HB3  ALA  29           HB2      ALA  29  -1.146  16.146  14.157
    5    HB2  ALA  29           HB3      ALA  29  -1.547  14.811  15.237

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LYS  30           H        LYS  30  -3.202  17.558  13.529
    2    HA   LYS  30           HA       LYS  30  -1.827  20.018  13.419
    3    HB2  LYS  30           HB2      LYS  30  -4.345  19.102  12.014
    4    HB3  LYS  30           HB3      LYS  30  -3.533  20.627  11.664
    5    HG2  LYS  30           HG2      LYS  30  -1.445  19.362  11.156
    6    HG3  LYS  30           HG3      LYS  30  -2.330  17.854  11.406
    7    HD2  LYS  30           HD2      LYS  30  -3.903  18.466   9.609
    8    HD3  LYS  30           HD3      LYS  30  -3.041  19.985   9.360
    9    HE2  LYS  30           HE2      LYS  30  -0.991  18.718   8.786
   10    HE3  LYS  30           HE3      LYS  30  -1.872  17.203   9.004
   11    HZ2  LYS  30           HZ1      LYS  30  -1.707  18.068   6.659
   12    HZ1  LYS  30           HZ2      LYS  30  -2.768  19.318   7.122
   13    HZ3  LYS  30           HZ3      LYS  30  -3.271  17.694   7.199

  No H/Q in entry =          13
  In of MODEL   18
    1    H    GLN  31           H        GLN  31  -4.916  19.130  14.835
    2    HA   GLN  31           HA       GLN  31  -5.715  21.878  15.277
    3    HB2  GLN  31           HB2      GLN  31  -6.863  19.421  16.608
    4    HB3  GLN  31           HB3      GLN  31  -7.643  20.982  16.357
    5    HG2  GLN  31           HG2      GLN  31  -6.923  20.204  13.770
    6    HG3  GLN  31           HG3      GLN  31  -7.428  18.696  14.523
    7   HE21  GLN  31          HE21      GLN  31  -8.858  20.244  12.415
    8   HE22  GLN  31          HE22      GLN  31 -10.377  20.619  13.072

  No H/Q in entry =           8
  In of MODEL   18
    1    H    GLY  32           H        GLY  32  -3.379  19.985  16.603
    2    HA3  GLY  32           HA2      GLY  32  -1.984  20.471  18.404
    3    HA2  GLY  32           HA3      GLY  32  -3.129  21.702  18.923

  No H/Q in entry =           3
  In of MODEL   18
    1    H    ASP  33           H        ASP  33  -4.513  18.642  18.272
    2    HA   ASP  33           HA       ASP  33  -4.918  18.190  21.154
    3    HB2  ASP  33           HB2      ASP  33  -6.312  17.152  18.680
    4    HB3  ASP  33           HB3      ASP  33  -6.649  16.543  20.299

  No H/Q in entry =           4
  In of MODEL   18
    1    H    PHE  34           H        PHE  34  -2.739  17.367  21.462
    2    HA   PHE  34           HA       PHE  34  -1.711  15.125  20.069
    3    HB2  PHE  34           HB2      PHE  34  -1.106  16.127  22.860
    4    HB3  PHE  34           HB3      PHE  34  -0.162  14.912  21.996
    5    HD1  PHE  34           HD1      PHE  34  -0.377  18.338  22.720
    6    HD2  PHE  34           HD2      PHE  34   0.486  15.634  19.494
    7    HE1  PHE  34           HE1      PHE  34   0.897  20.122  21.559
    8    HE2  PHE  34           HE2      PHE  34   1.755  17.420  18.339
    9    HZ   PHE  34           HZ       PHE  34   1.962  19.661  19.376

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ALA  35           H        ALA  35  -3.754  15.387  22.931
    2    HA   ALA  35           HA       ALA  35  -3.509  12.731  23.837
    3    HB3  ALA  35           HB1      ALA  35  -5.974  13.330  24.693
    4    HB1  ALA  35           HB2      ALA  35  -5.461  14.953  24.231
    5    HB2  ALA  35           HB3      ALA  35  -4.535  14.044  25.425

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA  36           H        ALA  36  -5.978  14.211  21.732
    2    HA   ALA  36           HA       ALA  36  -7.363  11.780  21.263
    3    HB1  ALA  36           HB1      ALA  36  -8.837  13.182  20.303
    4    HB3  ALA  36           HB2      ALA  36  -7.670  13.612  19.052
    5    HB2  ALA  36           HB3      ALA  36  -7.705  14.504  20.573

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA  37           H        ALA  37  -4.703  13.395  19.589
    2    HA   ALA  37           HA       ALA  37  -4.649  11.752  17.297
    3    HB3  ALA  37           HB1      ALA  37  -2.677  13.493  18.713
    4    HB2  ALA  37           HB2      ALA  37  -3.208  13.537  17.034
    5    HB1  ALA  37           HB3      ALA  37  -2.040  12.322  17.558

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LYS  38           H        LYS  38  -2.887  11.478  20.376
    2    HA   LYS  38           HA       LYS  38  -1.532   9.093  19.894
    3    HB2  LYS  38           HB2      LYS  38  -1.877  10.858  22.034
    4    HB3  LYS  38           HB3      LYS  38  -2.477   9.323  22.656
    5    HG2  LYS  38           HG2      LYS  38  -0.369   8.227  22.122
    6    HG3  LYS  38           HG3      LYS  38   0.222   9.677  21.304
    7    HD2  LYS  38           HD2      LYS  38   0.376  10.904  23.335
    8    HD3  LYS  38           HD3      LYS  38  -0.629   9.744  24.206
    9    HE2  LYS  38           HE2      LYS  38   1.731   9.459  24.825
   10    HE3  LYS  38           HE3      LYS  38   1.144   8.033  23.966
   11    HZ3  LYS  38           HZ1      LYS  38   2.438   8.462  22.183
   12    HZ2  LYS  38           HZ2      LYS  38   3.384   9.305  23.317
   13    HZ1  LYS  38           HZ3      LYS  38   2.293  10.148  22.323

  No H/Q in entry =          13
  In of MODEL   18
    1    H    ALA  39           H        ALA  39  -4.777   9.552  21.296
    2    HA   ALA  39           HA       ALA  39  -5.303   6.828  21.810
    3    HB3  ALA  39           HB1      ALA  39  -7.486   8.743  21.037
    4    HB2  ALA  39           HB2      ALA  39  -6.591   8.986  22.537
    5    HB1  ALA  39           HB3      ALA  39  -7.489   7.490  22.278

  No H/Q in entry =           5
  In of MODEL   18
    1    H    MET  40           H        MET  40  -5.914   8.824  18.956
    2    HA   MET  40           HA       MET  40  -7.366   6.870  17.503
    3    HB2  MET  40           HB2      MET  40  -5.786   9.282  16.590
    4    HB3  MET  40           HB3      MET  40  -6.800   8.306  15.523
    5    HG2  MET  40           HG2      MET  40  -7.850   9.551  18.077
    6    HG3  MET  40           HG3      MET  40  -7.918  10.380  16.524
    7    HE3  MET  40           HE1      MET  40 -10.482   8.721  14.466
    8    HE2  MET  40           HE2      MET  40  -8.731   8.860  14.317
    9    HE1  MET  40           HE3      MET  40  -9.665  10.216  14.946

  No H/Q in entry =           9
  In of MODEL   18
    1    H    MET  41           H        MET  41  -3.885   7.651  17.622
    2    HA   MET  41           HA       MET  41  -3.104   5.899  15.527
    3    HB2  MET  41           HB2      MET  41  -1.496   6.595  17.998
    4    HB3  MET  41           HB3      MET  41  -0.871   5.949  16.484
    5    HG2  MET  41           HG2      MET  41  -2.055   8.114  15.473
    6    HG3  MET  41           HG3      MET  41  -1.826   8.710  17.116
    7    HE2  MET  41           HE1      MET  41   1.119   6.651  17.484
    8    HE1  MET  41           HE2      MET  41   0.314   7.937  18.378
    9    HE3  MET  41           HE3      MET  41   1.934   8.199  17.734

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ASP  42           H        ASP  42  -3.483   5.433  19.015
    2    HA   ASP  42           HA       ASP  42  -2.413   2.853  19.184
    3    HB2  ASP  42           HB2      ASP  42  -3.310   4.607  21.000
    4    HB3  ASP  42           HB3      ASP  42  -4.723   3.563  20.931

  No H/Q in entry =           4
  In of MODEL   18
    1    H    GLN  43           H        GLN  43  -5.761   3.912  18.680
    2    HA   GLN  43           HA       GLN  43  -6.871   1.309  18.494
    3    HB2  GLN  43           HB2      GLN  43  -7.828   3.945  17.356
    4    HB3  GLN  43           HB3      GLN  43  -8.772   2.454  17.339
    5    HG2  GLN  43           HG2      GLN  43  -8.477   2.344  19.847
    6    HG3  GLN  43           HG3      GLN  43  -7.773   3.958  19.770
    7   HE21  GLN  43          HE21      GLN  43  -9.954   4.015  21.270
    8   HE22  GLN  43          HE22      GLN  43 -11.322   4.570  20.437

  No H/Q in entry =           8
  In of MODEL   18
    1    H    SER  44           H        SER  44  -5.560   3.533  16.075
    2    HA   SER  44           HA       SER  44  -6.241   2.032  13.790
    3    HB2  SER  44           HB2      SER  44  -5.016   4.433  14.226
    4    HB3  SER  44           HB3      SER  44  -3.649   3.453  13.699
    5    HG   SER  44           HG       SER  44  -4.774   4.405  11.933

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ARG  45           H        ARG  45  -3.363   1.963  15.871
    2    HA   ARG  45           HA       ARG  45  -1.857   0.024  14.495
    3    HB2  ARG  45           HB2      ARG  45  -1.034   1.462  16.359
    4    HB3  ARG  45           HB3      ARG  45  -2.013   0.522  17.482
    5    HG2  ARG  45           HG2      ARG  45  -0.755  -1.522  16.846
    6    HG3  ARG  45           HG3      ARG  45   0.248  -0.557  15.765
    7    HD2  ARG  45           HD2      ARG  45   0.965   0.839  17.716
    8    HD3  ARG  45           HD3      ARG  45   0.056  -0.244  18.793
    9    HE   ARG  45           HE       ARG  45   1.777  -1.823  17.218
   10   HH21  ARG  45          HH11      ARG  45   3.687  -2.618  18.058
   11   HH22  ARG  45          HH12      ARG  45   4.450  -1.818  19.386
   12   HH11  ARG  45          HH21      ARG  45   2.047   0.655  19.600
   13   HH12  ARG  45          HH22      ARG  45   3.521   0.038  20.257

  No H/Q in entry =          13
  In of MODEL   18
    1    H    MET  46           H        MET  46  -4.250  -0.319  17.096
    2    HA   MET  46           HA       MET  46  -4.046  -3.115  17.411
    3    HB2  MET  46           HB2      MET  46  -6.237  -1.132  18.008
    4    HB3  MET  46           HB3      MET  46  -6.429  -2.854  18.347
    5    HG2  MET  46           HG2      MET  46  -4.445  -2.832  19.771
    6    HG3  MET  46           HG3      MET  46  -4.145  -1.147  19.376
    7    HE3  MET  46           HE1      MET  46  -7.784  -2.872  20.258
    8    HE2  MET  46           HE2      MET  46  -7.413  -2.982  21.975
    9    HE1  MET  46           HE3      MET  46  -6.355  -3.759  20.802

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ALA  47           H        ALA  47  -6.092  -1.131  15.310
    2    HA   ALA  47           HA       ALA  47  -7.683  -3.205  14.251
    3    HB3  ALA  47           HB1      ALA  47  -8.391  -0.978  13.828
    4    HB1  ALA  47           HB2      ALA  47  -7.894  -1.610  12.258
    5    HB2  ALA  47           HB3      ALA  47  -6.827  -0.525  13.152

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU  48           H        LEU  48  -4.581  -1.861  13.196
    2    HA   LEU  48           HA       LEU  48  -4.280  -3.455  10.860
    3    HB2  LEU  48           HB2      LEU  48  -2.239  -2.146  12.665
    4    HB3  LEU  48           HB3      LEU  48  -1.861  -2.867  11.100
    5    HG   LEU  48           HG       LEU  48  -3.910  -0.673  11.482
    6   HD13  LEU  48          HD11      LEU  48  -1.800   0.231  12.146
    7   HD12  LEU  48          HD12      LEU  48  -2.081   0.776  10.493
    8   HD11  LEU  48          HD13      LEU  48  -0.967  -0.556  10.805
    9   HD22  LEU  48          HD21      LEU  48  -4.370  -1.669   9.410
   10   HD21  LEU  48          HD22      LEU  48  -2.682  -2.085   9.116
   11   HD23  LEU  48          HD23      LEU  48  -3.220  -0.412   8.952

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ASN  49           H        ASN  49  -3.231  -3.829  14.207
    2    HA   ASN  49           HA       ASN  49  -1.602  -6.075  13.884
    3    HB2  ASN  49           HB2      ASN  49  -1.654  -4.725  15.927
    4    HB3  ASN  49           HB3      ASN  49  -3.299  -5.249  16.256
    5   HD21  ASN  49          HD21      ASN  49  -1.232  -5.710  18.133
    6   HD22  ASN  49          HD22      ASN  49  -0.932  -7.378  18.219

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLU  50           H        GLU  50  -5.074  -5.837  14.554
    2    HA   GLU  50           HA       GLU  50  -5.555  -8.641  14.670
    3    HB2  GLU  50           HB2      GLU  50  -7.160  -6.970  15.541
    4    HB3  GLU  50           HB3      GLU  50  -7.459  -6.413  13.893
    5    HG2  GLU  50           HG2      GLU  50  -8.299  -8.621  13.261
    6    HG3  GLU  50           HG3      GLU  50  -7.911  -9.255  14.856

  No H/Q in entry =           6
  In of MODEL   18
    1    H    ALA  51           H        ALA  51  -5.648  -6.252  12.067
    2    HA   ALA  51           HA       ALA  51  -6.614  -7.996  10.050
    3    HB2  ALA  51           HB1      ALA  51  -6.413  -6.185   8.676
    4    HB1  ALA  51           HB2      ALA  51  -4.777  -5.817   9.224
    5    HB3  ALA  51           HB3      ALA  51  -6.167  -5.318  10.190

  No H/Q in entry =           5
  In of MODEL   18
    1    H    HIS  52           H        HIS  52  -3.333  -7.051  11.032
    2    HA   HIS  52           HA       HIS  52  -1.918  -8.532   9.088
    3    HB2  HIS  52           HB2      HIS  52  -0.906  -6.782  10.527
    4    HB3  HIS  52           HB3      HIS  52  -1.058  -7.861  11.914
    5    HD1  HIS  52           HD1      HIS  52   0.389 -10.080  11.855
    6    HD2  HIS  52           HD2      HIS  52   1.261  -7.346   8.830
    7    HE1  HIS  52           HE1      HIS  52   2.607 -10.792  10.862
    8    HE2  HIS  52           HE2      HIS  52   3.152  -9.137   9.017

  No H/Q in entry =           8
  In of MODEL   18
    1    H    LEU  53           H        LEU  53  -3.122  -9.412  12.302
    2    HA   LEU  53           HA       LEU  53  -1.900 -11.944  12.504
    3    HB2  LEU  53           HB2      LEU  53  -4.400 -10.787  13.712
    4    HB3  LEU  53           HB3      LEU  53  -3.917 -12.454  14.013
    5    HG   LEU  53           HG       LEU  53  -2.052 -10.106  14.479
    6   HD13  LEU  53          HD11      LEU  53  -2.679 -10.138  16.800
    7   HD12  LEU  53          HD12      LEU  53  -3.696 -11.559  16.563
    8   HD11  LEU  53          HD13      LEU  53  -4.170 -10.012  15.872
    9   HD23  LEU  53          HD21      LEU  53  -1.141 -11.898  16.166
   10   HD22  LEU  53          HD22      LEU  53  -0.738 -12.057  14.460
   11   HD21  LEU  53          HD23      LEU  53  -2.003 -13.053  15.156

  No H/Q in entry =          11
  In of MODEL   18
    1    H    VAL  54           H        VAL  54  -5.020 -10.948  11.137
    2    HA   VAL  54           HA       VAL  54  -5.908 -13.553  10.457
    3    HB   VAL  54           HB       VAL  54  -6.581 -10.830   9.314
    4   HG12  VAL  54          HG11      VAL  54  -8.669 -12.230   8.505
    5   HG11  VAL  54          HG12      VAL  54  -7.544 -13.585   8.582
    6   HG13  VAL  54          HG13      VAL  54  -7.197 -12.210   7.536
    7   HG22  VAL  54          HG21      VAL  54  -7.488 -10.870  11.465
    8   HG21  VAL  54          HG22      VAL  54  -7.726 -12.616  11.451
    9   HG23  VAL  54          HG23      VAL  54  -8.817 -11.572  10.541

  No H/Q in entry =           9
  In of MODEL   18
    1    H    GLN  55           H        GLN  55  -4.059 -11.089   8.662
    2    HA   GLN  55           HA       GLN  55  -3.914 -12.559   6.248
    3    HB2  GLN  55           HB2      GLN  55  -3.331 -10.290   6.053
    4    HB3  GLN  55           HB3      GLN  55  -2.220 -10.352   7.418
    5    HG2  GLN  55           HG2      GLN  55  -0.494 -11.186   6.145
    6    HG3  GLN  55           HG3      GLN  55  -1.559 -12.173   5.154
    7   HE21  GLN  55          HE21      GLN  55  -1.581 -11.490   3.030
    8   HE22  GLN  55          HE22      GLN  55  -1.397  -9.885   2.516

  No H/Q in entry =           8
  In of MODEL   18
    1    H    THR  56           H        THR  56  -1.810 -12.511   9.130
    2    HA   THR  56           HA       THR  56   0.283 -14.093   8.219
    3    HB   THR  56           HB       THR  56  -0.959 -14.347  10.966
    4    HG1  THR  56           HG1      THR  56   0.639 -12.352   9.786
    5   HG21  THR  56          HG21      THR  56   0.985 -15.855  10.069
    6   HG23  THR  56          HG22      THR  56   1.135 -15.118  11.665
    7   HG22  THR  56          HG23      THR  56   1.966 -14.406  10.281

  No H/Q in entry =           7
  In of MODEL   18
    1    H    LYS  57           H        LYS  57  -2.828 -15.154   9.583
    2    HA   LYS  57           HA       LYS  57  -2.357 -17.946   9.345
    3    HB2  LYS  57           HB2      LYS  57  -4.186 -16.867  10.687
    4    HB3  LYS  57           HB3      LYS  57  -4.981 -16.430   9.182
    5    HG2  LYS  57           HG2      LYS  57  -5.208 -18.793   8.580
    6    HG3  LYS  57           HG3      LYS  57  -4.356 -19.267  10.047
    7    HD2  LYS  57           HD2      LYS  57  -6.150 -18.232  11.411
    8    HD3  LYS  57           HD3      LYS  57  -7.015 -17.801   9.936
    9    HE2  LYS  57           HE2      LYS  57  -7.209 -20.181   9.333
   10    HE3  LYS  57           HE3      LYS  57  -6.304 -20.644  10.772
   11    HZ3  LYS  57           HZ1      LYS  57  -8.367 -20.825  11.615
   12    HZ2  LYS  57           HZ2      LYS  57  -9.049 -19.724  10.515
   13    HZ1  LYS  57           HZ3      LYS  57  -8.192 -19.156  11.869

  No H/Q in entry =          13
  In of MODEL   18
    1    H    LEU  58           H        LEU  58  -3.709 -15.522   7.162
    2    HA   LEU  58           HA       LEU  58  -4.494 -17.359   5.160
    3    HB2  LEU  58           HB2      LEU  58  -3.913 -14.406   5.017
    4    HB3  LEU  58           HB3      LEU  58  -4.567 -15.352   3.679
    5    HG   LEU  58           HG       LEU  58  -5.850 -15.176   6.425
    6   HD11  LEU  58          HD11      LEU  58  -6.163 -13.539   3.929
    7   HD13  LEU  58          HD12      LEU  58  -6.159 -13.026   5.616
    8   HD12  LEU  58          HD13      LEU  58  -7.574 -13.834   4.946
    9   HD22  LEU  58          HD21      LEU  58  -6.796 -17.096   5.561
   10   HD21  LEU  58          HD22      LEU  58  -6.459 -16.646   3.889
   11   HD23  LEU  58          HD23      LEU  58  -7.829 -15.930   4.737

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  59           H        ILE  59  -1.370 -16.119   6.020
    2    HA   ILE  59           HA       ILE  59  -0.264 -16.845   3.386
    3    HB   ILE  59           HB       ILE  59   0.486 -14.769   4.955
    4   HG12  ILE  59          HG12      ILE  59   2.578 -16.407   3.506
    5   HG13  ILE  59          HG13      ILE  59   1.381 -15.454   2.666
    6   HG22  ILE  59          HG21      ILE  59   2.588 -16.804   5.648
    7   HG21  ILE  59          HG22      ILE  59   1.236 -16.530   6.725
    8   HG23  ILE  59          HG23      ILE  59   2.346 -15.216   6.337
    9   HD12  ILE  59          HD11      ILE  59   3.369 -14.402   4.678
   10   HD11  ILE  59          HD12      ILE  59   2.136 -13.429   3.881
   11   HD13  ILE  59          HD13      ILE  59   3.438 -14.151   2.935

  No H/Q in entry =          11
  In of MODEL   18
    1    H    GLU  60           H        GLU  60  -0.268 -17.941   6.757
    2    HA   GLU  60           HA       GLU  60   1.780 -19.902   6.500
    3    HB2  GLU  60           HB2      GLU  60   0.989 -19.104   8.684
    4    HB3  GLU  60           HB3      GLU  60  -0.594 -19.818   8.381
    5    HG2  GLU  60           HG2      GLU  60   0.440 -22.059   8.257
    6    HG3  GLU  60           HG3      GLU  60   2.022 -21.345   8.559

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLY  61           H        GLY  61  -1.729 -20.032   6.011
    2    HA3  GLY  61           HA2      GLY  61  -1.456 -22.825   5.062
    3    HA2  GLY  61           HA3      GLY  61  -2.948 -22.100   5.652

  No H/Q in entry =           3
  In of MODEL   18
    1    H    ASP  62           H        ASP  62  -0.729 -20.511   3.445
    2    HA   ASP  62           HA       ASP  62  -2.780 -19.865   1.599
    3    HB2  ASP  62           HB2      ASP  62  -0.916 -18.994   0.228
    4    HB3  ASP  62           HB3      ASP  62  -0.807 -18.462   1.904

  No H/Q in entry =           4
  In of MODEL   18
    1    H    ALA  63           H        ALA  63  -3.424 -22.344   1.483
    2    HA   ALA  63           HA       ALA  63  -1.902 -24.105  -0.157
    3    HB1  ALA  63           HB1      ALA  63  -3.851 -25.468  -0.246
    4    HB3  ALA  63           HB2      ALA  63  -4.897 -24.105   0.150
    5    HB2  ALA  63           HB3      ALA  63  -3.799 -24.755   1.368

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLY  64           H        GLY  64  -4.429 -21.723  -0.811
    2    HA3  GLY  64           HA2      GLY  64  -5.060 -20.650  -2.741
    3    HA2  GLY  64           HA3      GLY  64  -3.577 -21.234  -3.477

  No H/Q in entry =           3
  In of MODEL   18
    1    H    GLU  65           H        GLU  65  -5.358 -21.225  -5.294
    2    HA   GLU  65           HA       GLU  65  -7.296 -23.274  -5.307
    3    HB2  GLU  65           HB2      GLU  65  -5.959 -21.790  -7.567
    4    HB3  GLU  65           HB3      GLU  65  -7.293 -22.921  -7.795
    5    HG2  GLU  65           HG2      GLU  65  -8.722 -21.593  -6.328
    6    HG3  GLU  65           HG3      GLU  65  -7.389 -20.495  -5.982

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLY  66           H        GLY  66  -3.996 -23.186  -6.414
    2    HA3  GLY  66           HA2      GLY  66  -4.052 -25.954  -7.343
    3    HA2  GLY  66           HA3      GLY  66  -2.756 -24.800  -7.589

  No H/Q in entry =           3
  In of MODEL   18
    1    H    LYS  67           H        LYS  67  -1.662 -26.920  -6.976
    2    HA   LYS  67           HA       LYS  67  -1.680 -28.006  -4.432
    3    HB2  LYS  67           HB2      LYS  67   0.526 -27.841  -6.479
    4    HB3  LYS  67           HB3      LYS  67   0.612 -28.840  -5.023
    5    HG2  LYS  67           HG2      LYS  67  -1.467 -29.989  -5.673
    6    HG3  LYS  67           HG3      LYS  67  -1.576 -28.989  -7.120
    7    HD2  LYS  67           HD2      LYS  67   0.597 -29.912  -7.894
    8    HD3  LYS  67           HD3      LYS  67   0.635 -30.959  -6.474
    9    HE2  LYS  67           HE2      LYS  67  -1.616 -30.944  -8.503
   10    HE3  LYS  67           HE3      LYS  67  -0.277 -32.089  -8.527
   11    HZ3  LYS  67           HZ1      LYS  67  -2.004 -33.144  -7.373
   12    HZ2  LYS  67           HZ2      LYS  67  -2.361 -31.762  -6.452
   13    HZ1  LYS  67           HZ3      LYS  67  -0.927 -32.627  -6.169

  No H/Q in entry =          13
  In of MODEL   18
    1    H    MET  68           H        MET  68   1.431 -26.859  -5.128
    2    HA   MET  68           HA       MET  68   1.932 -25.863  -2.537
    3    HB2  MET  68           HB2      MET  68   3.482 -25.539  -5.109
    4    HB3  MET  68           HB3      MET  68   4.100 -25.154  -3.502
    5    HG2  MET  68           HG2      MET  68   3.154 -27.679  -3.093
    6    HG3  MET  68           HG3      MET  68   3.672 -27.789  -4.776
    7    HE2  MET  68           HE1      MET  68   6.238 -25.180  -4.019
    8    HE1  MET  68           HE2      MET  68   5.561 -26.108  -5.358
    9    HE3  MET  68           HE3      MET  68   7.189 -26.463  -4.782

  No H/Q in entry =           9
  In of MODEL   18
    1    H    LYS  69           H        LYS  69   1.237 -24.163  -5.583
    2    HA   LYS  69           HA       LYS  69   1.945 -21.619  -5.072
    3    HB2  LYS  69           HB2      LYS  69  -0.567 -22.578  -6.403
    4    HB3  LYS  69           HB3      LYS  69  -0.068 -20.882  -6.388
    5    HG2  LYS  69           HG2      LYS  69   2.090 -21.490  -7.392
    6    HG3  LYS  69           HG3      LYS  69   1.620 -23.191  -7.394
    7    HD2  LYS  69           HD2      LYS  69  -0.267 -22.673  -8.892
    8    HD3  LYS  69           HD3      LYS  69   0.198 -20.969  -8.890
    9    HE2  LYS  69           HE2      LYS  69   2.393 -21.567  -9.853
   10    HE3  LYS  69           HE3      LYS  69   1.924 -23.266  -9.862
   11    HZ3  LYS  69           HZ1      LYS  69   0.103 -22.728 -11.343
   12    HZ2  LYS  69           HZ2      LYS  69   1.582 -22.233 -12.019
   13    HZ1  LYS  69           HZ3      LYS  69   0.536 -21.087 -11.326

  No H/Q in entry =          13
  In of MODEL   18
    1    H    VAL  70           H        VAL  70   0.132 -19.737  -4.875
    2    HA   VAL  70           HA       VAL  70  -1.264 -20.108  -2.287
    3    HB   VAL  70           HB       VAL  70  -0.553 -17.812  -1.670
    4   HG12  VAL  70          HG11      VAL  70   1.932 -19.357  -2.378
    5   HG11  VAL  70          HG12      VAL  70   0.798 -19.980  -1.180
    6   HG13  VAL  70          HG13      VAL  70   1.590 -18.426  -0.921
    7   HG23  VAL  70          HG21      VAL  70   1.441 -16.897  -3.069
    8   HG22  VAL  70          HG22      VAL  70  -0.178 -16.710  -3.738
    9   HG21  VAL  70          HG23      VAL  70   0.876 -17.988  -4.336

  No H/Q in entry =           9
  In of MODEL   18
    1    H    SER  71           H        SER  71  -2.942 -18.486  -1.922
    2    HA   SER  71           HA       SER  71  -4.690 -18.158  -4.140
    3    HB2  SER  71           HB2      SER  71  -5.492 -18.291  -1.786
    4    HB3  SER  71           HB3      SER  71  -4.718 -16.747  -1.445
    5    HG   SER  71           HG       SER  71  -6.048 -15.929  -3.231

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU  72           H        LEU  72  -5.032 -16.456  -5.465
    2    HA   LEU  72           HA       LEU  72  -2.940 -14.626  -5.952
    3    HB2  LEU  72           HB2      LEU  72  -5.806 -14.701  -6.895
    4    HB3  LEU  72           HB3      LEU  72  -4.612 -13.544  -7.479
    5    HG   LEU  72           HG       LEU  72  -4.208 -16.553  -7.595
    6   HD13  LEU  72          HD11      LEU  72  -4.807 -16.379  -9.972
    7   HD12  LEU  72          HD12      LEU  72  -5.143 -14.658  -9.773
    8   HD11  LEU  72          HD13      LEU  72  -6.155 -15.854  -8.963
    9   HD22  LEU  72          HD21      LEU  72  -2.086 -15.588  -7.844
   10   HD21  LEU  72          HD22      LEU  72  -2.707 -14.148  -8.631
   11   HD23  LEU  72          HD23      LEU  72  -2.632 -15.670  -9.515

  No H/Q in entry =          11
  In of MODEL   18
    1    H    VAL  73           H        VAL  73  -6.037 -14.294  -4.322
    2    HA   VAL  73           HA       VAL  73  -6.108 -11.523  -3.977
    3    HB   VAL  73           HB       VAL  73  -7.814 -11.898  -2.377
    4   HG12  VAL  73          HG11      VAL  73  -7.970 -14.359  -4.113
    5   HG11  VAL  73          HG12      VAL  73  -8.110 -12.745  -4.805
    6   HG13  VAL  73          HG13      VAL  73  -9.277 -13.290  -3.601
    7   HG23  VAL  73          HG21      VAL  73  -8.089 -14.405  -1.605
    8   HG22  VAL  73          HG22      VAL  73  -6.953 -13.348  -0.766
    9   HG21  VAL  73          HG23      VAL  73  -6.366 -14.498  -1.968

  No H/Q in entry =           9
  In of MODEL   18
    1    H    LEU  74           H        LEU  74  -4.147 -13.869  -2.389
    2    HA   LEU  74           HA       LEU  74  -3.746 -12.718   0.131
    3    HB2  LEU  74           HB2      LEU  74  -2.941 -14.929  -0.358
    4    HB3  LEU  74           HB3      LEU  74  -1.898 -14.315  -1.639
    5    HG   LEU  74           HG       LEU  74  -0.595 -13.041   0.031
    6   HD11  LEU  74          HD11      LEU  74  -2.643 -14.248   1.897
    7   HD13  LEU  74          HD12      LEU  74  -2.161 -12.557   1.754
    8   HD12  LEU  74          HD13      LEU  74  -1.059 -13.731   2.475
    9   HD21  LEU  74          HD21      LEU  74  -0.384 -15.613  -0.563
   10   HD23  LEU  74          HD22      LEU  74  -0.789 -15.772   1.132
   11   HD22  LEU  74          HD23      LEU  74   0.637 -14.873   0.668

  No H/Q in entry =          11
  In of MODEL   18
    1    H    VAL  75           H        VAL  75  -1.860 -12.313  -2.828
    2    HA   VAL  75           HA       VAL  75  -0.081 -10.370  -1.822
    3    HB   VAL  75           HB       VAL  75  -1.034 -10.862  -4.645
    4   HG12  VAL  75          HG11      VAL  75   1.018  -9.544  -5.268
    5   HG11  VAL  75          HG12      VAL  75   1.234  -9.148  -3.570
    6   HG13  VAL  75          HG13      VAL  75  -0.181  -8.565  -4.431
    7   HG21  VAL  75          HG21      VAL  75   1.442 -11.667  -3.075
    8   HG23  VAL  75          HG22      VAL  75   1.224 -11.942  -4.804
    9   HG22  VAL  75          HG23      VAL  75   0.169 -12.748  -3.642

  No H/Q in entry =           9
  In of MODEL   18
    1    H    GLU  76           H        GLU  76  -3.236 -10.056  -3.479
    2    HA   GLU  76           HA       GLU  76  -3.314  -7.243  -3.587
    3    HB2  GLU  76           HB2      GLU  76  -4.956  -8.752  -4.727
    4    HB3  GLU  76           HB3      GLU  76  -5.634  -9.163  -3.159
    5    HG2  GLU  76           HG2      GLU  76  -6.291  -6.820  -2.801
    6    HG3  GLU  76           HG3      GLU  76  -5.595  -6.358  -4.343

  No H/Q in entry =           6
  In of MODEL   18
    1    H    ALA  77           H        ALA  77  -4.402  -9.476  -1.042
    2    HA   ALA  77           HA       ALA  77  -5.377  -7.479   0.713
    3    HB3  ALA  77           HB1      ALA  77  -6.074  -9.658   1.224
    4    HB2  ALA  77           HB2      ALA  77  -4.887  -9.312   2.482
    5    HB1  ALA  77           HB3      ALA  77  -4.441 -10.313   1.101

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLN  78           H        GLN  78  -2.216  -9.000   0.351
    2    HA   GLN  78           HA       GLN  78  -0.968  -7.823   2.598
    3    HB2  GLN  78           HB2      GLN  78  -0.087  -9.758   1.249
    4    HB3  GLN  78           HB3      GLN  78   0.334  -8.613  -0.022
    5    HG2  GLN  78           HG2      GLN  78   1.785  -7.397   1.549
    6    HG3  GLN  78           HG3      GLN  78   1.366  -8.536   2.826
    7   HE21  GLN  78          HE21      GLN  78   4.083  -8.239   1.978
    8   HE22  GLN  78          HE22      GLN  78   4.558  -9.670   1.197

  No H/Q in entry =           8
  In of MODEL   18
    1    H    LEU  79           H        LEU  79  -1.345  -6.772  -0.751
    2    HA   LEU  79           HA       LEU  79   0.321  -4.531  -0.744
    3    HB2  LEU  79           HB2      LEU  79  -0.700  -5.351  -2.795
    4    HB3  LEU  79           HB3      LEU  79  -2.306  -4.972  -2.187
    5    HG   LEU  79           HG       LEU  79  -1.783  -2.580  -2.167
    6   HD13  LEU  79          HD11      LEU  79   0.455  -2.316  -1.656
    7   HD12  LEU  79          HD12      LEU  79   0.501  -2.032  -3.395
    8   HD11  LEU  79          HD13      LEU  79   0.969  -3.604  -2.746
    9   HD23  LEU  79          HD21      LEU  79  -1.152  -2.381  -4.719
   10   HD22  LEU  79          HD22      LEU  79  -2.671  -3.141  -4.258
   11   HD21  LEU  79          HD23      LEU  79  -1.290  -4.139  -4.701

  No H/Q in entry =          11
  In of MODEL   18
    1    H    HIS  80           H        HIS  80  -3.144  -4.721   0.085
    2    HA   HIS  80           HA       HIS  80  -3.358  -1.965   0.742
    3    HB2  HIS  80           HB2      HIS  80  -5.039  -4.387   1.067
    4    HB3  HIS  80           HB3      HIS  80  -5.371  -3.047   2.168
    5    HD1  HIS  80           HD1      HIS  80  -7.002  -1.426   1.258
    6    HD2  HIS  80           HD2      HIS  80  -4.796  -3.227  -1.787
    7    HE1  HIS  80           HE1      HIS  80  -7.851  -0.441  -0.923
    8    HE2  HIS  80           HE2      HIS  80  -6.513  -1.533  -2.788

  No H/Q in entry =           8
  In of MODEL   18
    1    H    LEU  81           H        LEU  81  -2.845  -4.851   2.741
    2    HA   LEU  81           HA       LEU  81  -2.842  -3.498   5.223
    3    HB2  LEU  81           HB2      LEU  81  -1.603  -6.107   4.348
    4    HB3  LEU  81           HB3      LEU  81  -1.580  -5.544   6.021
    5    HG   LEU  81           HG       LEU  81  -4.125  -5.821   4.395
    6   HD12  LEU  81          HD11      LEU  81  -4.410  -7.885   5.947
    7   HD11  LEU  81          HD12      LEU  81  -2.658  -7.800   6.132
    8   HD13  LEU  81          HD13      LEU  81  -3.366  -8.040   4.534
    9   HD23  LEU  81          HD21      LEU  81  -4.965  -6.025   6.897
   10   HD22  LEU  81          HD22      LEU  81  -4.653  -4.435   6.203
   11   HD21  LEU  81          HD23      LEU  81  -3.460  -5.184   7.264

  No H/Q in entry =          11
  In of MODEL   18
    1    H    MET  82           H        MET  82  -0.155  -4.385   3.053
    2    HA   MET  82           HA       MET  82   1.922  -3.471   4.733
    3    HB2  MET  82           HB2      MET  82   1.708  -3.821   1.742
    4    HB3  MET  82           HB3      MET  82   3.186  -3.237   2.503
    5    HG2  MET  82           HG2      MET  82   1.799  -5.836   3.234
    6    HG3  MET  82           HG3      MET  82   3.170  -5.718   2.133
    7    HE3  MET  82           HE1      MET  82   6.180  -4.955   4.113
    8    HE2  MET  82           HE2      MET  82   5.247  -3.596   3.493
    9    HE1  MET  82           HE3      MET  82   5.346  -5.087   2.560

  No H/Q in entry =           9
  In of MODEL   18
    1    H    THR  83           H        THR  83   0.086  -1.849   2.174
    2    HA   THR  83           HA       THR  83   1.480   0.610   2.254
    3    HB   THR  83           HB       THR  83  -0.704   1.517   1.267
    4    HG1  THR  83           HG1      THR  83  -2.345   0.207   1.164
    5   HG22  THR  83          HG21      THR  83  -0.421  -0.304  -0.730
    6   HG21  THR  83          HG22      THR  83   1.082  -0.583   0.147
    7   HG23  THR  83          HG23      THR  83   0.709   1.026  -0.471

  No H/Q in entry =           7
  In of MODEL   18
    1    H    SER  84           H        SER  84  -1.518  -0.441   3.859
    2    HA   SER  84           HA       SER  84  -2.031   1.988   5.199
    3    HB2  SER  84           HB2      SER  84  -2.843  -0.854   5.770
    4    HB3  SER  84           HB3      SER  84  -3.345   0.486   6.800
    5    HG   SER  84           HG       SER  84  -3.803   0.162   4.009

  No H/Q in entry =           5
  In of MODEL   18
    1    H    MET  85           H        MET  85  -0.299  -0.928   6.334
    2    HA   MET  85           HA       MET  85   0.216   0.008   8.936
    3    HB2  MET  85           HB2      MET  85   0.524  -2.334   8.267
    4    HB3  MET  85           HB3      MET  85   1.899  -1.866   7.266
    5    HG2  MET  85           HG2      MET  85   3.077  -1.016   9.255
    6    HG3  MET  85           HG3      MET  85   1.695  -1.447  10.263
    7    HE1  MET  85           HE1      MET  85   4.921  -2.414   8.726
    8    HE3  MET  85           HE2      MET  85   3.947  -3.073   7.412
    9    HE2  MET  85           HE3      MET  85   4.879  -4.157   8.441

  No H/Q in entry =           9
  In of MODEL   18
    1    H    LEU  86           H        LEU  86   2.147   0.270   5.983
    2    HA   LEU  86           HA       LEU  86   4.352   1.599   7.134
    3    HB2  LEU  86           HB2      LEU  86   4.167   0.510   4.828
    4    HB3  LEU  86           HB3      LEU  86   3.348   1.984   4.312
    5    HG   LEU  86           HG       LEU  86   5.369   3.247   5.288
    6   HD11  LEU  86          HD11      LEU  86   6.092   0.642   6.094
    7   HD13  LEU  86          HD12      LEU  86   7.086   2.094   6.187
    8   HD12  LEU  86          HD13      LEU  86   7.201   1.043   4.778
    9   HD23  LEU  86          HD21      LEU  86   6.096   1.483   2.941
   10   HD22  LEU  86          HD22      LEU  86   6.478   3.184   3.199
   11   HD21  LEU  86          HD23      LEU  86   4.828   2.703   2.803

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ALA  87           H        ALA  87   1.430   2.819   5.548
    2    HA   ALA  87           HA       ALA  87   2.006   5.553   5.625
    3    HB1  ALA  87           HB1      ALA  87  -0.292   3.908   5.089
    4    HB3  ALA  87           HB2      ALA  87   0.007   5.570   4.585
    5    HB2  ALA  87           HB3      ALA  87  -0.784   5.247   6.130

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ARG  88           H        ARG  88   0.332   3.546   8.021
    2    HA   ARG  88           HA       ARG  88  -0.193   5.596   9.863
    3    HB2  ARG  88           HB2      ARG  88  -1.115   3.238   9.936
    4    HB3  ARG  88           HB3      ARG  88   0.429   2.750  10.642
    5    HG2  ARG  88           HG2      ARG  88  -0.060   4.825  12.257
    6    HG3  ARG  88           HG3      ARG  88  -1.725   4.488  11.803
    7    HD2  ARG  88           HD2      ARG  88  -1.819   2.641  13.054
    8    HD3  ARG  88           HD3      ARG  88  -0.226   2.068  12.524
    9    HE   ARG  88           HE       ARG  88  -0.766   3.334  14.975
   10   HH21  ARG  88          HH11      ARG  88   0.786   4.360  16.210
   11   HH22  ARG  88          HH12      ARG  88   2.302   4.796  15.503
   12   HH11  ARG  88          HH21      ARG  88   1.511   3.525  12.396
   13   HH12  ARG  88          HH22      ARG  88   2.721   4.307  13.355

  No H/Q in entry =          13
  In of MODEL   18
    1    H    GLU  89           H        GLU  89   2.619   3.396   9.644
    2    HA   GLU  89           HA       GLU  89   3.876   4.300  11.984
    3    HB2  GLU  89           HB2      GLU  89   4.548   2.283  10.645
    4    HB3  GLU  89           HB3      GLU  89   5.315   3.379   9.495
    5    HG2  GLU  89           HG2      GLU  89   6.795   4.241  11.236
    6    HG3  GLU  89           HG3      GLU  89   5.968   3.282  12.459

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LEU  90           H        LEU  90   4.182   5.451   8.653
    2    HA   LEU  90           HA       LEU  90   6.098   7.467   9.232
    3    HB2  LEU  90           HB2      LEU  90   4.093   7.115   7.007
    4    HB3  LEU  90           HB3      LEU  90   5.314   8.395   7.024
    5    HG   LEU  90           HG       LEU  90   6.010   5.464   7.365
    6   HD12  LEU  90          HD11      LEU  90   6.755   5.697   4.924
    7   HD11  LEU  90          HD12      LEU  90   5.729   7.130   4.873
    8   HD13  LEU  90          HD13      LEU  90   5.021   5.552   5.220
    9   HD22  LEU  90          HD21      LEU  90   7.899   6.630   8.043
   10   HD21  LEU  90          HD22      LEU  90   7.538   8.030   7.032
   11   HD23  LEU  90          HD23      LEU  90   8.208   6.568   6.309

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  91           H        ILE  91   2.559   7.455   9.085
    2    HA   ILE  91           HA       ILE  91   2.196  10.227   9.529
    3    HB   ILE  91           HB       ILE  91   0.423   7.838  10.079
    4   HG12  ILE  91          HG12      ILE  91   0.156  10.112   8.088
    5   HG13  ILE  91          HG13      ILE  91   1.028   8.624   7.720
    6   HG22  ILE  91          HG21      ILE  91  -1.325   9.883  10.138
    7   HG21  ILE  91          HG22      ILE  91   0.070  10.726  10.808
    8   HG23  ILE  91          HG23      ILE  91  -0.555   9.286  11.608
    9   HD13  ILE  91          HD11      ILE  91  -0.906   7.321   7.769
   10   HD12  ILE  91          HD12      ILE  91  -1.508   8.830   7.083
   11   HD11  ILE  91          HD13      ILE  91  -1.775   8.468   8.789

  No H/Q in entry =          11
  In of MODEL   18
    1    H    THR  92           H        THR  92   2.622   7.494  11.737
    2    HA   THR  92           HA       THR  92   2.169   8.871  14.158
    3    HB   THR  92           HB       THR  92   3.996   6.550  13.498
    4    HG1  THR  92           HG1      THR  92   2.033   5.776  13.401
    5   HG22  THR  92          HG21      THR  92   3.616   6.269  16.133
    6   HG21  THR  92          HG22      THR  92   3.537   8.028  16.055
    7   HG23  THR  92          HG23      THR  92   4.977   7.183  15.484

  No H/Q in entry =           7
  In of MODEL   18
    1    H    GLU  93           H        GLU  93   5.123   8.442  12.224
    2    HA   GLU  93           HA       GLU  93   6.865   9.889  13.916
    3    HB2  GLU  93           HB2      GLU  93   6.954   9.566  10.902
    4    HB3  GLU  93           HB3      GLU  93   8.291  10.110  11.914
    5    HG2  GLU  93           HG2      GLU  93   6.904   7.463  12.370
    6    HG3  GLU  93           HG3      GLU  93   8.286   7.624  11.293

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LEU  94           H        LEU  94   4.806  10.877  11.201
    2    HA   LEU  94           HA       LEU  94   5.587  13.588  11.093
    3    HB2  LEU  94           HB2      LEU  94   3.009  12.198  10.344
    4    HB3  LEU  94           HB3      LEU  94   3.251  13.927  10.097
    5    HG   LEU  94           HG       LEU  94   5.286  11.954   9.052
    6   HD11  LEU  94          HD11      LEU  94   2.540  12.476   7.989
    7   HD13  LEU  94          HD12      LEU  94   3.536  11.029   7.867
    8   HD12  LEU  94          HD13      LEU  94   3.858  12.409   6.819
    9   HD23  LEU  94          HD21      LEU  94   5.519  13.787   7.324
   10   HD22  LEU  94          HD22      LEU  94   5.930  14.289   8.964
   11   HD21  LEU  94          HD23      LEU  94   4.375  14.740   8.265

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  95           H        ILE  95   3.065  11.954  12.989
    2    HA   ILE  95           HA       ILE  95   2.000  14.297  14.178
    3    HB   ILE  95           HB       ILE  95   2.045  11.418  15.111
    4   HG12  ILE  95          HG12      ILE  95  -0.193  13.168  14.057
    5   HG13  ILE  95          HG13      ILE  95   0.774  12.114  13.028
    6   HG21  ILE  95          HG21      ILE  95   0.739  13.882  16.305
    7   HG23  ILE  95          HG22      ILE  95   1.799  12.726  17.113
    8   HG22  ILE  95          HG23      ILE  95   0.168  12.248  16.640
    9   HD13  ILE  95          HD11      ILE  95  -0.111  10.170  13.953
   10   HD12  ILE  95          HD12      ILE  95  -1.503  11.246  14.026
   11   HD11  ILE  95          HD13      ILE  95  -0.535  10.962  15.472

  No H/Q in entry =          11
  In of MODEL   18
    1    H    GLU  96           H        GLU  96   4.617  12.107  15.179
    2    HA   GLU  96           HA       GLU  96   5.161  13.318  17.667
    3    HB2  GLU  96           HB2      GLU  96   6.130  11.166  17.026
    4    HB3  GLU  96           HB3      GLU  96   7.055  11.945  15.744
    5    HG2  GLU  96           HG2      GLU  96   8.698  12.514  17.204
    6    HG3  GLU  96           HG3      GLU  96   7.544  13.319  18.257

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LEU  97           H        LEU  97   6.227  14.091  14.379
    2    HA   LEU  97           HA       LEU  97   8.093  16.108  15.085
    3    HB2  LEU  97           HB2      LEU  97   6.506  15.535  12.591
    4    HB3  LEU  97           HB3      LEU  97   7.511  16.977  12.709
    5    HG   LEU  97           HG       LEU  97   8.569  14.192  13.277
    6   HD12  LEU  97          HD11      LEU  97   9.563  14.389  10.959
    7   HD11  LEU  97          HD12      LEU  97   8.498  15.768  10.691
    8   HD13  LEU  97          HD13      LEU  97   7.815  14.170  10.991
    9   HD23  LEU  97          HD21      LEU  97  10.725  15.491  12.530
   10   HD22  LEU  97          HD22      LEU  97  10.103  15.759  14.158
   11   HD21  LEU  97          HD23      LEU  97   9.777  16.935  12.886

  No H/Q in entry =          11
  In of MODEL   18
    1    H    HIS  98           H        HIS  98   4.600  16.205  14.430
    2    HA   HIS  98           HA       HIS  98   4.271  19.002  14.557
    3    HB2  HIS  98           HB2      HIS  98   2.405  16.734  15.290
    4    HB3  HIS  98           HB3      HIS  98   1.920  18.429  15.340
    5    HD1  HIS  98           HD1      HIS  98   2.970  15.718  12.944
    6    HD2  HIS  98           HD2      HIS  98   1.552  19.636  12.810
    7    HE1  HIS  98           HE1      HIS  98   2.405  16.193  10.518
    8    HE2  HIS  98           HE2      HIS  98   1.546  18.573  10.416

  No H/Q in entry =           8
  In of MODEL   18
    1    H    GLU  99           H        GLU  99   4.431  16.523  17.063
    2    HA   GLU  99           HA       GLU  99   3.805  18.217  19.256
    3    HB2  GLU  99           HB2      GLU  99   3.743  15.735  19.361
    4    HB3  GLU  99           HB3      GLU  99   5.503  15.708  19.253
    5    HG2  GLU  99           HG2      GLU  99   5.678  17.008  21.323
    6    HG3  GLU  99           HG3      GLU  99   3.924  17.131  21.418

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LYS 100           H        LYS 100   6.868  17.314  17.694
    2    HA   LYS 100           HA       LYS 100   8.509  18.738  19.546
    3    HB2  LYS 100           HB2      LYS 100   9.017  17.810  16.710
    4    HB3  LYS 100           HB3      LYS 100  10.238  18.596  17.716
    5    HG2  LYS 100           HG2      LYS 100   9.881  16.847  19.462
    6    HG3  LYS 100           HG3      LYS 100   8.758  16.028  18.374
    7    HD2  LYS 100           HD2      LYS 100  10.554  15.759  16.707
    8    HD3  LYS 100           HD3      LYS 100  11.683  16.590  17.781
    9    HE2  LYS 100           HE2      LYS 100  11.305  14.836  19.504
   10    HE3  LYS 100           HE3      LYS 100  10.239  13.985  18.381
   11    HZ1  LYS 100           HZ1      LYS 100  13.052  14.683  17.724
   12    HZ3  LYS 100           HZ2      LYS 100  12.020  13.614  16.899
   13    HZ2  LYS 100           HZ3      LYS 100  12.613  13.206  18.438

  No H/Q in entry =          13
  In of MODEL   18
    1    H    LEU 101           H        LEU 101   6.805  19.638  16.588
    2    HA   LEU 101           HA       LEU 101   7.992  22.207  16.245
    3    HB2  LEU 101           HB2      LEU 101   5.409  20.943  15.362
    4    HB3  LEU 101           HB3      LEU 101   5.642  22.676  15.150
    5    HG   LEU 101           HG       LEU 101   7.699  20.678  14.190
    6   HD12  LEU 101          HD11      LEU 101   6.541  21.165  11.904
    7   HD11  LEU 101          HD12      LEU 101   5.137  21.584  12.883
    8   HD13  LEU 101          HD13      LEU 101   5.818  19.960  12.969
    9   HD21  LEU 101          HD21      LEU 101   7.041  23.582  13.626
   10   HD23  LEU 101          HD22      LEU 101   8.031  22.629  12.522
   11   HD22  LEU 101          HD23      LEU 101   8.571  22.898  14.179

  No H/Q in entry =          11
  In of MODEL   18
    1    H    LYS 102           H        LYS 102   6.467  21.060  18.864
    2    HA   LYS 102           HA       LYS 102   5.824  22.151  20.794
    3    HB2  LYS 102           HB2      LYS 102   7.085  24.151  19.663
    4    HB3  LYS 102           HB3      LYS 102   5.480  24.738  19.286
    5    HG2  LYS 102           HG2      LYS 102   6.860  24.504  21.939
    6    HG3  LYS 102           HG3      LYS 102   5.894  25.821  21.306
    7    HD2  LYS 102           HD2      LYS 102   4.677  23.175  22.193
    8    HD3  LYS 102           HD3      LYS 102   4.912  24.541  23.272
    9    HE2  LYS 102           HE2      LYS 102   2.637  24.111  21.785
   10    HE3  LYS 102           HE3      LYS 102   3.124  25.664  22.462
   11    HZ2  LYS 102           HZ1      LYS 102   2.592  25.759  20.082
   12    HZ1  LYS 102           HZ2      LYS 102   3.864  24.689  19.762
   13    HZ3  LYS 102           HZ3      LYS 102   4.192  26.225  20.400

  No H/Q in entry =          13
  In of MODEL   18
    1    H    ALA 103           H        ALA 103   4.169  23.669  18.022
    2    HA   ALA 103           HA       ALA 103   1.710  24.223  18.906
    3    HB1  ALA 103           HB1      ALA 103   0.819  23.366  16.666
    4    HB2  ALA 103           HB2      ALA 103   2.472  22.845  16.338
    5    HB3  ALA 103           HB3      ALA 103   2.120  24.554  16.599

  No H/Q in entry =           5
  In of MODEL   18
    1    H1   ALA   1           H3       ALA   1  10.757 -20.259  -6.243
    2    H2   ALA   1           H2       ALA   1   9.794 -20.479  -7.628
    3    H3   ALA   1           H1       ALA   1   9.364 -21.225  -6.163
    4    HA   ALA   1           HA       ALA   1  10.421 -23.026  -6.898
    5    HB1  ALA   1           HB1      ALA   1  10.512 -22.672  -9.174
    6    HB2  ALA   1           HB2      ALA   1  12.238 -22.504  -8.846
    7    HB3  ALA   1           HB3      ALA   1  11.226 -21.067  -9.001

  No H/Q in entry =           7
  In of MODEL   18
    1    H    GLU   2           H        GLU   2  12.714 -23.955  -6.954
    2    HA   GLU   2           HA       GLU   2  14.095 -23.854  -4.743
    3    HB2  GLU   2           HB2      GLU   2  15.449 -23.717  -7.443
    4    HB3  GLU   2           HB3      GLU   2  16.184 -24.317  -5.957
    5    HG2  GLU   2           HG2      GLU   2  15.186 -26.344  -6.191
    6    HG3  GLU   2           HG3      GLU   2  13.608 -25.614  -6.452

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLU   3           H        GLU   3  15.848 -21.979  -7.150
    2    HA   GLU   3           HA       GLU   3  16.986 -20.276  -5.196
    3    HB2  GLU   3           HB2      GLU   3  16.929 -20.283  -8.206
    4    HB3  GLU   3           HB3      GLU   3  17.662 -18.944  -7.323
    5    HG2  GLU   3           HG2      GLU   3  19.338 -20.300  -6.397
    6    HG3  GLU   3           HG3      GLU   3  18.406 -21.777  -6.613

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LEU   4           H        LEU   4  14.695 -19.457  -7.828
    2    HA   LEU   4           HA       LEU   4  14.205 -16.851  -7.223
    3    HB2  LEU   4           HB2      LEU   4  12.048 -18.847  -7.947
    4    HB3  LEU   4           HB3      LEU   4  11.956 -17.100  -8.150
    5    HG   LEU   4           HG       LEU   4  13.937 -18.949  -9.519
    6   HD13  LEU   4          HD11      LEU   4  12.633 -18.817 -11.429
    7   HD12  LEU   4          HD12      LEU   4  11.911 -17.277 -10.966
    8   HD11  LEU   4          HD13      LEU   4  11.372 -18.771 -10.200
    9   HD23  LEU   4          HD21      LEU   4  14.252 -16.704 -10.877
   10   HD22  LEU   4          HD22      LEU   4  15.115 -16.934  -9.358
   11   HD21  LEU   4          HD23      LEU   4  13.653 -15.952  -9.399

  No H/Q in entry =          11
  In of MODEL   18
    1    H    GLU   5           H        GLU   5  12.746 -19.644  -5.573
    2    HA   GLU   5           HA       GLU   5  11.056 -18.083  -3.873
    3    HB2  GLU   5           HB2      GLU   5  10.665 -20.474  -4.395
    4    HB3  GLU   5           HB3      GLU   5  12.090 -20.884  -3.440
    5    HG2  GLU   5           HG2      GLU   5  11.082 -19.850  -1.456
    6    HG3  GLU   5           HG3      GLU   5   9.666 -19.394  -2.402

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLU   6           H        GLU   6  14.217 -19.632  -3.428
    2    HA   GLU   6           HA       GLU   6  14.563 -18.765  -0.732
    3    HB2  GLU   6           HB2      GLU   6  15.807 -20.671  -1.711
    4    HB3  GLU   6           HB3      GLU   6  16.653 -19.550  -2.780
    5    HG2  GLU   6           HG2      GLU   6  17.581 -18.370  -0.836
    6    HG3  GLU   6           HG3      GLU   6  16.708 -19.449   0.251

  No H/Q in entry =           6
  In of MODEL   18
    1    H    VAL   7           H        VAL   7  15.314 -17.440  -3.886
    2    HA   VAL   7           HA       VAL   7  16.980 -15.295  -3.028
    3    HB   VAL   7           HB       VAL   7  15.276 -15.682  -5.504
    4   HG11  VAL   7          HG11      VAL   7  17.149 -13.448  -4.699
    5   HG13  VAL   7          HG12      VAL   7  15.505 -13.323  -5.321
    6   HG12  VAL   7          HG13      VAL   7  16.818 -13.816  -6.391
    7   HG21  VAL   7          HG21      VAL   7  17.398 -17.116  -4.932
    8   HG23  VAL   7          HG22      VAL   7  18.288 -15.648  -5.335
    9   HG22  VAL   7          HG23      VAL   7  17.259 -16.411  -6.543

  No H/Q in entry =           9
  In of MODEL   18
    1    H    VAL   8           H        VAL   8  13.490 -15.600  -3.582
    2    HA   VAL   8           HA       VAL   8  12.798 -12.897  -3.118
    3    HB   VAL   8           HB       VAL   8  11.210 -15.439  -2.672
    4   HG11  VAL   8          HG11      VAL   8  10.403 -12.520  -2.578
    5   HG13  VAL   8          HG12      VAL   8  10.206 -13.730  -1.311
    6   HG12  VAL   8          HG13      VAL   8   9.242 -13.830  -2.783
    7   HG21  VAL   8          HG21      VAL   8  12.084 -14.368  -5.056
    8   HG23  VAL   8          HG22      VAL   8  10.539 -13.545  -4.859
    9   HG22  VAL   8          HG23      VAL   8  10.599 -15.304  -4.891

  No H/Q in entry =           9
  In of MODEL   18
    1    H    MET   9           H        MET   9  13.094 -15.694  -0.930
    2    HA   MET   9           HA       MET   9  12.267 -14.424   1.437
    3    HB2  MET   9           HB2      MET   9  14.197 -16.681   0.902
    4    HB3  MET   9           HB3      MET   9  13.891 -16.099   2.538
    5    HG2  MET   9           HG2      MET   9  11.464 -16.499   2.210
    6    HG3  MET   9           HG3      MET   9  11.802 -17.132   0.599
    7    HE2  MET   9           HE1      MET   9  11.412 -18.369   4.405
    8    HE1  MET   9           HE2      MET   9  12.620 -17.110   4.157
    9    HE3  MET   9           HE3      MET   9  13.128 -18.727   4.637

  No H/Q in entry =           9
  In of MODEL   18
    1    H    GLY  10           H        GLY  10  15.450 -14.620  -0.121
    2    HA3  GLY  10           HA2      GLY  10  16.895 -13.179   1.845
    3    HA2  GLY  10           HA3      GLY  10  17.359 -13.344   0.151

  No H/Q in entry =           3
  In of MODEL   18
    1    H    LEU  11           H        LEU  11  15.177 -12.149  -1.090
    2    HA   LEU  11           HA       LEU  11  15.833  -9.397  -0.935
    3    HB2  LEU  11           HB2      LEU  11  13.480 -10.835  -2.165
    4    HB3  LEU  11           HB3      LEU  11  13.741  -9.098  -2.329
    5    HG   LEU  11           HG       LEU  11  15.791 -11.187  -3.112
    6   HD13  LEU  11          HD11      LEU  11  14.049 -11.577  -4.631
    7   HD12  LEU  11          HD12      LEU  11  15.038 -10.387  -5.475
    8   HD11  LEU  11          HD13      LEU  11  13.560  -9.882  -4.657
    9   HD22  LEU  11          HD21      LEU  11  17.001  -9.210  -2.893
   10   HD21  LEU  11          HD22      LEU  11  15.615  -8.189  -3.274
   11   HD23  LEU  11          HD23      LEU  11  16.455  -9.052  -4.561

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  12           H        ILE  12  13.085 -11.249   0.339
    2    HA   ILE  12           HA       ILE  12  11.667  -9.038   1.393
    3    HB   ILE  12           HB       ILE  12  11.737 -11.918   2.350
    4   HG12  ILE  12          HG12      ILE  12  11.040 -11.293  -0.100
    5   HG13  ILE  12          HG13      ILE  12  10.034 -12.400   0.813
    6   HG21  ILE  12          HG21      ILE  12   9.789  -9.659   2.912
    7   HG23  ILE  12          HG22      ILE  12  10.769 -10.533   4.087
    8   HG22  ILE  12          HG23      ILE  12   9.448 -11.353   3.257
    9   HD12  ILE  12          HD11      ILE  12   8.759 -10.630  -0.415
   10   HD11  ILE  12          HD12      ILE  12   9.560  -9.418   0.583
   11   HD13  ILE  12          HD13      ILE  12   8.492 -10.593   1.319

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  13           H        ILE  13  14.086 -11.212   2.804
    2    HA   ILE  13           HA       ILE  13  14.109 -10.025   5.381
    3    HB   ILE  13           HB       ILE  13  16.190 -11.574   3.819
    4   HG12  ILE  13          HG12      ILE  13  13.914 -12.558   4.669
    5   HG13  ILE  13          HG13      ILE  13  15.399 -13.474   4.907
    6   HG23  ILE  13          HG21      ILE  13  17.440 -10.273   5.407
    7   HG22  ILE  13          HG22      ILE  13  17.310 -11.894   6.078
    8   HG21  ILE  13          HG23      ILE  13  16.281 -10.601   6.694
    9   HD12  ILE  13          HD11      ILE  13  13.892 -13.324   6.961
   10   HD11  ILE  13          HD12      ILE  13  14.259 -11.602   6.995
   11   HD13  ILE  13          HD13      ILE  13  15.549 -12.778   7.210

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ASN  14           H        ASN  14  16.054  -9.478   2.460
    2    HA   ASN  14           HA       ASN  14  17.775  -7.512   3.516
    3    HB2  ASN  14           HB2      ASN  14  17.767  -8.785   1.204
    4    HB3  ASN  14           HB3      ASN  14  16.856  -7.381   0.663
    5   HD21  ASN  14          HD21      ASN  14  19.301  -7.693  -0.523
    6   HD22  ASN  14          HD22      ASN  14  20.430  -6.593   0.101

  No H/Q in entry =           6
  In of MODEL   18
    1    H    SER  15           H        SER  15  14.659  -7.210   1.823
    2    HA   SER  15           HA       SER  15  14.510  -4.391   1.872
    3    HB2  SER  15           HB2      SER  15  12.178  -4.670   1.383
    4    HB3  SER  15           HB3      SER  15  12.996  -6.021   0.609
    5    HG   SER  15           HG       SER  15  11.477  -7.042   1.717

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLY  16           H        GLY  16  13.450  -6.858   4.183
    2    HA3  GLY  16           HA2      GLY  16  12.206  -5.121   6.036
    3    HA2  GLY  16           HA3      GLY  16  12.842  -6.720   6.402

  No H/Q in entry =           3
  In of MODEL   18
    1    H    GLN  17           H        GLN  17  15.549  -6.352   5.808
    2    HA   GLN  17           HA       GLN  17  16.489  -5.112   8.185
    3    HB2  GLN  17           HB2      GLN  17  17.760  -6.882   7.036
    4    HB3  GLN  17           HB3      GLN  17  18.010  -5.812   5.655
    5    HG2  GLN  17           HG2      GLN  17  19.246  -4.236   7.064
    6    HG3  GLN  17           HG3      GLN  17  18.951  -5.243   8.481
    7   HE21  GLN  17          HE21      GLN  17  21.617  -4.678   7.690
    8   HE22  GLN  17          HE22      GLN  17  22.328  -6.102   7.103

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ALA  18           H        ALA  18  16.285  -4.046   4.822
    2    HA   ALA  18           HA       ALA  18  17.688  -1.633   5.042
    3    HB2  ALA  18           HB1      ALA  18  16.587  -2.869   2.978
    4    HB3  ALA  18           HB2      ALA  18  16.827  -1.122   2.958
    5    HB1  ALA  18           HB3      ALA  18  15.237  -1.789   3.329

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ARG  19           H        ARG  19  14.197  -2.268   5.441
    2    HA   ARG  19           HA       ARG  19  13.492   0.374   6.149
    3    HB2  ARG  19           HB2      ARG  19  11.836  -1.402   5.567
    4    HB3  ARG  19           HB3      ARG  19  12.188  -2.191   7.106
    5    HG2  ARG  19           HG2      ARG  19  11.450  -0.206   8.340
    6    HG3  ARG  19           HG3      ARG  19  11.188   0.662   6.829
    7    HD2  ARG  19           HD2      ARG  19   9.058  -0.161   7.652
    8    HD3  ARG  19           HD3      ARG  19   9.489  -1.039   6.178
    9    HE   ARG  19           HE       ARG  19  10.469  -2.562   8.287
   10   HH21  ARG  19          HH11      ARG  19   9.243  -4.217   9.231
   11   HH22  ARG  19          HH12      ARG  19   7.523  -4.214   9.060
   12   HH11  ARG  19          HH21      ARG  19   7.457  -1.314   7.189
   13   HH12  ARG  19          HH22      ARG  19   6.512  -2.571   7.900

  No H/Q in entry =          13
  In of MODEL   18
    1    H    SER  20           H        SER  20  14.389  -2.438   8.116
    2    HA   SER  20           HA       SER  20  14.091  -1.336  10.650
    3    HB2  SER  20           HB2      SER  20  14.760  -3.742   9.978
    4    HB3  SER  20           HB3      SER  20  16.411  -3.129   9.961
    5    HG   SER  20           HG       SER  20  14.562  -3.120  12.115

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU  21           H        LEU  21  16.933  -1.241   8.514
    2    HA   LEU  21           HA       LEU  21  18.586   0.274  10.248
    3    HB2  LEU  21           HB2      LEU  21  18.569  -0.008   7.235
    4    HB3  LEU  21           HB3      LEU  21  19.811   0.873   8.121
    5    HG   LEU  21           HG       LEU  21  19.114  -2.018   8.702
    6   HD13  LEU  21          HD11      LEU  21  21.003  -2.661   7.325
    7   HD12  LEU  21          HD12      LEU  21  21.402  -0.974   7.007
    8   HD11  LEU  21          HD13      LEU  21  19.923  -1.667   6.346
    9   HD23  LEU  21          HD21      LEU  21  21.626  -1.815   9.516
   10   HD22  LEU  21          HD22      LEU  21  20.338  -1.230  10.562
   11   HD21  LEU  21          HD23      LEU  21  21.266  -0.094   9.598

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ALA  22           H        ALA  22  16.310   1.204   7.689
    2    HA   ALA  22           HA       ALA  22  16.810   3.969   7.695
    3    HB3  ALA  22           HB1      ALA  22  15.425   2.703   6.020
    4    HB2  ALA  22           HB2      ALA  22  14.697   4.208   6.583
    5    HB1  ALA  22           HB3      ALA  22  14.128   2.662   7.215

  No H/Q in entry =           5
  In of MODEL   18
    1    H    TYR  23           H        TYR  23  14.338   2.124   9.535
    2    HA   TYR  23           HA       TYR  23  13.345   4.352  10.978
    3    HB2  TYR  23           HB2      TYR  23  12.138   2.222  10.963
    4    HB3  TYR  23           HB3      TYR  23  13.480   1.431  11.789
    5    HD1  TYR  23           HD1      TYR  23  10.947   4.148  12.150
    6    HD2  TYR  23           HD2      TYR  23  13.672   1.493  14.145
    7    HE1  TYR  23           HE1      TYR  23  10.010   4.833  14.344
    8    HE2  TYR  23           HE2      TYR  23  12.736   2.178  16.336
    9    HH   TYR  23           HH       TYR  23  11.435   3.710  17.380

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ALA  24           H        ALA  24  16.020   2.114  11.622
    2    HA   ALA  24           HA       ALA  24  16.677   3.125  14.183
    3    HB1  ALA  24           HB1      ALA  24  18.057   1.350  14.023
    4    HB3  ALA  24           HB2      ALA  24  19.072   2.283  12.922
    5    HB2  ALA  24           HB3      ALA  24  17.792   1.255  12.283

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA  25           H        ALA  25  17.622   4.058  10.901
    2    HA   ALA  25           HA       ALA  25  19.541   6.020  11.542
    3    HB1  ALA  25           HB1      ALA  25  18.837   5.056   9.229
    4    HB3  ALA  25           HB2      ALA  25  19.317   6.751   9.318
    5    HB2  ALA  25           HB3      ALA  25  17.608   6.321   9.250

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU  26           H        LEU  26  16.024   6.202  11.180
    2    HA   LEU  26           HA       LEU  26  15.763   8.982  11.623
    3    HB2  LEU  26           HB2      LEU  26  13.918   7.719  10.698
    4    HB3  LEU  26           HB3      LEU  26  13.840   6.694  12.126
    5    HG   LEU  26           HG       LEU  26  13.208   8.648  13.501
    6   HD12  LEU  26          HD11      LEU  26  12.520  10.736  12.170
    7   HD11  LEU  26          HD12      LEU  26  13.510  10.092  10.863
    8   HD13  LEU  26          HD13      LEU  26  14.249  10.491  12.414
    9   HD21  LEU  26          HD21      LEU  26  11.538   8.306  10.992
   10   HD23  LEU  26          HD22      LEU  26  10.968   9.001  12.507
   11   HD22  LEU  26          HD23      LEU  26  11.442   7.305  12.441

  No H/Q in entry =          11
  In of MODEL   18
    1    H    LYS  27           H        LYS  27  15.690   6.207  13.824
    2    HA   LYS  27           HA       LYS  27  15.079   7.571  16.188
    3    HB2  LYS  27           HB2      LYS  27  15.139   5.096  15.930
    4    HB3  LYS  27           HB3      LYS  27  16.901   5.171  15.887
    5    HG2  LYS  27           HG2      LYS  27  16.939   6.163  18.134
    6    HG3  LYS  27           HG3      LYS  27  15.172   6.159  18.179
    7    HD2  LYS  27           HD2      LYS  27  15.177   3.691  17.948
    8    HD3  LYS  27           HD3      LYS  27  16.942   3.703  17.937
    9    HE2  LYS  27           HE2      LYS  27  16.963   4.698  20.191
   10    HE3  LYS  27           HE3      LYS  27  15.197   4.716  20.205
   11    HZ3  LYS  27           HZ1      LYS  27  16.009   2.777  21.361
   12    HZ2  LYS  27           HZ2      LYS  27  16.931   2.306  20.012
   13    HZ1  LYS  27           HZ3      LYS  27  15.233   2.290  19.932

  No H/Q in entry =          13
  In of MODEL   18
    1    H    GLN  28           H        GLN  28  18.203   7.023  14.598
    2    HA   GLN  28           HA       GLN  28  19.874   8.132  16.586
    3    HB2  GLN  28           HB2      GLN  28  20.162   8.081  13.571
    4    HB3  GLN  28           HB3      GLN  28  21.442   8.573  14.679
    5    HG2  GLN  28           HG2      GLN  28  20.059   5.876  14.725
    6    HG3  GLN  28           HG3      GLN  28  21.641   6.184  14.012
    7   HE21  GLN  28          HE21      GLN  28  20.368   4.862  16.713
    8   HE22  GLN  28          HE22      GLN  28  21.546   5.302  17.853

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ALA  29           H        ALA  29  18.105   9.587  13.890
    2    HA   ALA  29           HA       ALA  29  19.073  12.220  14.136
    3    HB2  ALA  29           HB1      ALA  29  17.368  12.833  12.663
    4    HB1  ALA  29           HB2      ALA  29  16.237  11.648  13.317
    5    HB3  ALA  29           HB3      ALA  29  17.574  11.119  12.295

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LYS  30           H        LYS  30  16.315  10.593  15.661
    2    HA   LYS  30           HA       LYS  30  15.275  12.838  17.012
    3    HB2  LYS  30           HB2      LYS  30  15.196   9.898  17.723
    4    HB3  LYS  30           HB3      LYS  30  14.316  11.141  18.613
    5    HG2  LYS  30           HG2      LYS  30  13.184  11.809  16.493
    6    HG3  LYS  30           HG3      LYS  30  14.004  10.479  15.670
    7    HD2  LYS  30           HD2      LYS  30  12.949   8.864  17.202
    8    HD3  LYS  30           HD3      LYS  30  12.140  10.183  18.050
    9    HE2  LYS  30           HE2      LYS  30  10.965  10.798  15.955
   10    HE3  LYS  30           HE3      LYS  30  11.755   9.450  15.128
   11    HZ2  LYS  30           HZ1      LYS  30   9.451   9.018  16.009
   12    HZ1  LYS  30           HZ2      LYS  30  10.118   9.082  17.576
   13    HZ3  LYS  30           HZ3      LYS  30  10.639   7.900  16.469

  No H/Q in entry =          13
  In of MODEL   18
    1    H    GLN  31           H        GLN  31  17.959  10.699  17.755
    2    HA   GLN  31           HA       GLN  31  18.275  11.724  20.447
    3    HB2  GLN  31           HB2      GLN  31  20.315  10.171  18.846
    4    HB3  GLN  31           HB3      GLN  31  20.180  10.298  20.600
    5    HG2  GLN  31           HG2      GLN  31  17.676   9.317  19.833
    6    HG3  GLN  31           HG3      GLN  31  18.787   8.482  18.755
    7   HE21  GLN  31          HE21      GLN  31  17.257   7.325  21.035
    8   HE22  GLN  31          HE22      GLN  31  18.419   6.680  22.087

  No H/Q in entry =           8
  In of MODEL   18
    1    H    GLY  32           H        GLY  32  18.781  13.040  17.477
    2    HA3  GLY  32           HA2      GLY  32  19.743  15.094  16.957
    3    HA2  GLY  32           HA3      GLY  32  20.500  15.111  18.545

  No H/Q in entry =           3
  In of MODEL   18
    1    H    ASP  33           H        ASP  33  20.954  12.219  16.776
    2    HA   ASP  33           HA       ASP  33  23.772  12.923  16.308
    3    HB2  ASP  33           HB2      ASP  33  22.291  10.291  16.431
    4    HB3  ASP  33           HB3      ASP  33  23.976  10.425  15.936

  No H/Q in entry =           4
  In of MODEL   18
    1    H    PHE  34           H        PHE  34  23.276  14.236  14.423
    2    HA   PHE  34           HA       PHE  34  21.938  13.232  12.139
    3    HB2  PHE  34           HB2      PHE  34  24.046  15.390  12.363
    4    HB3  PHE  34           HB3      PHE  34  23.064  15.085  10.932
    5    HD1  PHE  34           HD1      PHE  34  23.293  17.029  13.841
    6    HD2  PHE  34           HD2      PHE  34  20.439  14.876  11.460
    7    HE1  PHE  34           HE1      PHE  34  21.462  18.409  14.784
    8    HE2  PHE  34           HE2      PHE  34  18.612  16.256  12.407
    9    HZ   PHE  34           HZ       PHE  34  19.126  18.023  14.064

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ALA  35           H        ALA  35  25.314  13.084  13.147
    2    HA   ALA  35           HA       ALA  35  26.429  12.269  10.692
    3    HB3  ALA  35           HB1      ALA  35  28.122  11.122  12.415
    4    HB2  ALA  35           HB2      ALA  35  27.247  12.141  13.558
    5    HB1  ALA  35           HB3      ALA  35  28.076  12.870  12.184

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA  36           H        ALA  36  25.335  10.308  13.462
    2    HA   ALA  36           HA       ALA  36  25.847   7.822  12.193
    3    HB2  ALA  36           HB1      ALA  36  25.425   7.076  14.270
    4    HB3  ALA  36           HB2      ALA  36  23.731   7.551  14.119
    5    HB1  ALA  36           HB3      ALA  36  24.919   8.698  14.739

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA  37           H        ALA  37  23.002   9.916  12.321
    2    HA   ALA  37           HA       ALA  37  21.166   8.122  11.150
    3    HB3  ALA  37           HB1      ALA  37  21.357  11.088  11.435
    4    HB1  ALA  37           HB2      ALA  37  20.058   9.996  11.910
    5    HB2  ALA  37           HB3      ALA  37  20.241  10.466  10.219

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LYS  38           H        LYS  38  23.236  10.604   9.665
    2    HA   LYS  38           HA       LYS  38  22.602  10.162   6.989
    3    HB2  LYS  38           HB2      LYS  38  24.393  11.745   8.430
    4    HB3  LYS  38           HB3      LYS  38  25.438  10.765   7.407
    5    HG2  LYS  38           HG2      LYS  38  24.265  11.516   5.409
    6    HG3  LYS  38           HG3      LYS  38  23.060  12.359   6.388
    7    HD2  LYS  38           HD2      LYS  38  24.635  13.979   7.136
    8    HD3  LYS  38           HD3      LYS  38  26.007  13.008   6.603
    9    HE2  LYS  38           HE2      LYS  38  25.628  14.870   5.047
   10    HE3  LYS  38           HE3      LYS  38  25.312  13.327   4.246
   11    HZ3  LYS  38           HZ1      LYS  38  23.110  13.745   4.115
   12    HZ2  LYS  38           HZ2      LYS  38  23.612  15.366   4.198
   13    HZ1  LYS  38           HZ3      LYS  38  23.048  14.579   5.593

  No H/Q in entry =          13
  In of MODEL   18
    1    H    ALA  39           H        ALA  39  25.136   8.600   8.949
    2    HA   ALA  39           HA       ALA  39  26.225   7.020   6.883
    3    HB2  ALA  39           HB1      ALA  39  26.148   6.063   9.729
    4    HB1  ALA  39           HB2      ALA  39  27.082   7.499   9.310
    5    HB3  ALA  39           HB3      ALA  39  27.453   5.951   8.550

  No H/Q in entry =           5
  In of MODEL   18
    1    H    MET  40           H        MET  40  23.619   6.377   9.183
    2    HA   MET  40           HA       MET  40  23.210   3.665   8.456
    3    HB2  MET  40           HB2      MET  40  21.368   5.689   9.743
    4    HB3  MET  40           HB3      MET  40  20.983   3.974   9.572
    5    HG2  MET  40           HG2      MET  40  23.521   4.951  10.911
    6    HG3  MET  40           HG3      MET  40  22.030   4.659  11.805
    7    HE3  MET  40           HE1      MET  40  21.512   1.019  11.989
    8    HE2  MET  40           HE2      MET  40  20.627   2.308  11.179
    9    HE1  MET  40           HE3      MET  40  21.364   2.609  12.751

  No H/Q in entry =           9
  In of MODEL   18
    1    H    MET  41           H        MET  41  21.758   6.697   7.260
    2    HA   MET  41           HA       MET  41  19.816   5.473   5.592
    3    HB2  MET  41           HB2      MET  41  21.264   8.080   5.072
    4    HB3  MET  41           HB3      MET  41  19.742   7.565   4.354
    5    HG2  MET  41           HG2      MET  41  18.999   7.374   6.906
    6    HG3  MET  41           HG3      MET  41  20.293   8.549   7.125
    7    HE2  MET  41           HE1      MET  41  19.713   9.821   3.786
    8    HE1  MET  41           HE2      MET  41  20.664  10.276   5.196
    9    HE3  MET  41           HE3      MET  41  19.378  11.338   4.629

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ASP  42           H        ASP  42  23.176   6.438   5.036
    2    HA   ASP  42           HA       ASP  42  23.275   5.958   2.280
    3    HB2  ASP  42           HB2      ASP  42  25.012   6.983   4.046
    4    HB3  ASP  42           HB3      ASP  42  25.691   5.366   3.923

  No H/Q in entry =           4
  In of MODEL   18
    1    H    GLN  43           H        GLN  43  24.027   3.820   5.006
    2    HA   GLN  43           HA       GLN  43  24.721   1.567   3.428
    3    HB2  GLN  43           HB2      GLN  43  23.696   1.744   6.272
    4    HB3  GLN  43           HB3      GLN  43  24.294   0.261   5.520
    5    HG2  GLN  43           HG2      GLN  43  26.441   1.499   5.006
    6    HG3  GLN  43           HG3      GLN  43  25.841   2.821   6.002
    7   HE21  GLN  43          HE21      GLN  43  28.087   1.880   7.041
    8   HE22  GLN  43          HE22      GLN  43  27.827   0.797   8.320

  No H/Q in entry =           8
  In of MODEL   18
    1    H    SER  44           H        SER  44  21.650   2.664   4.811
    2    HA   SER  44           HA       SER  44  20.111   0.399   4.144
    3    HB2  SER  44           HB2      SER  44  19.636   2.925   5.283
    4    HB3  SER  44           HB3      SER  44  18.602   2.865   3.858
    5    HG   SER  44           HG       SER  44  17.521   1.911   5.584

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ARG  45           H        ARG  45  20.815   3.369   2.332
    2    HA   ARG  45           HA       ARG  45  19.296   2.857   0.028
    3    HB2  ARG  45           HB2      ARG  45  20.412   5.009   0.607
    4    HB3  ARG  45           HB3      ARG  45  21.966   4.274   0.223
    5    HG2  ARG  45           HG2      ARG  45  21.188   3.852  -2.090
    6    HG3  ARG  45           HG3      ARG  45  19.646   4.611  -1.705
    7    HD2  ARG  45           HD2      ARG  45  20.869   6.725  -1.126
    8    HD3  ARG  45           HD3      ARG  45  22.375   5.969  -1.693
    9    HE   ARG  45           HE       ARG  45  20.448   5.702  -3.728
   10   HH21  ARG  45          HH11      ARG  45  20.423   7.066  -5.495
   11   HH22  ARG  45          HH12      ARG  45  21.160   8.626  -5.395
   12   HH11  ARG  45          HH21      ARG  45  22.146   8.226  -2.108
   13   HH12  ARG  45          HH22      ARG  45  22.134   9.283  -3.474

  No H/Q in entry =          13
  In of MODEL   18
    1    H    MET  46           H        MET  46  22.671   2.027   0.777
    2    HA   MET  46           HA       MET  46  23.291   0.836  -1.704
    3    HB2  MET  46           HB2      MET  46  24.404   0.537   1.085
    4    HB3  MET  46           HB3      MET  46  25.068  -0.361  -0.283
    5    HG2  MET  46           HG2      MET  46  25.502   1.732  -1.483
    6    HG3  MET  46           HG3      MET  46  24.770   2.657  -0.178
    7    HE3  MET  46           HE1      MET  46  27.332  -0.540   0.192
    8    HE2  MET  46           HE2      MET  46  28.743   0.419  -0.246
    9    HE1  MET  46           HE3      MET  46  27.382   0.305  -1.361

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ALA  47           H        ALA  47  21.926  -0.507   1.276
    2    HA   ALA  47           HA       ALA  47  21.905  -3.222   0.480
    3    HB2  ALA  47           HB1      ALA  47  21.522  -2.760   2.784
    4    HB3  ALA  47           HB2      ALA  47  19.992  -3.383   2.167
    5    HB1  ALA  47           HB3      ALA  47  20.201  -1.649   2.421

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU  48           H        LEU  48  19.521  -0.625   0.118
    2    HA   LEU  48           HA       LEU  48  17.494  -2.186  -1.127
    3    HB2  LEU  48           HB2      LEU  48  18.113   0.776  -1.251
    4    HB3  LEU  48           HB3      LEU  48  16.650   0.046  -1.914
    5    HG   LEU  48           HG       LEU  48  17.509  -0.238   0.975
    6   HD13  LEU  48          HD11      LEU  48  17.064   2.058   0.782
    7   HD12  LEU  48          HD12      LEU  48  15.513   1.393   1.294
    8   HD11  LEU  48          HD13      LEU  48  15.778   1.814  -0.398
    9   HD22  LEU  48          HD21      LEU  48  16.000  -1.971   0.600
   10   HD21  LEU  48          HD22      LEU  48  15.115  -1.082  -0.640
   11   HD23  LEU  48          HD23      LEU  48  14.899  -0.675   1.062

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ASN  49           H        ASN  49  20.158  -0.230  -2.366
    2    HA   ASN  49           HA       ASN  49  19.505  -0.329  -5.089
    3    HB2  ASN  49           HB2      ASN  49  21.172   1.204  -4.149
    4    HB3  ASN  49           HB3      ASN  49  22.223  -0.151  -3.755
    5   HD21  ASN  49          HD21      ASN  49  23.115   1.937  -5.446
    6   HD22  ASN  49          HD22      ASN  49  23.305   1.326  -7.018

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLU  50           H        GLU  50  21.517  -2.494  -3.122
    2    HA   GLU  50           HA       GLU  50  22.236  -4.248  -5.244
    3    HB2  GLU  50           HB2      GLU  50  23.436  -4.203  -3.079
    4    HB3  GLU  50           HB3      GLU  50  22.001  -4.845  -2.279
    5    HG2  GLU  50           HG2      GLU  50  22.113  -6.881  -3.632
    6    HG3  GLU  50           HG3      GLU  50  23.480  -6.235  -4.537

  No H/Q in entry =           6
  In of MODEL   18
    1    H    ALA  51           H        ALA  51  19.582  -4.206  -2.914
    2    HA   ALA  51           HA       ALA  51  18.443  -6.695  -3.663
    3    HB3  ALA  51           HB1      ALA  51  16.847  -6.203  -2.107
    4    HB1  ALA  51           HB2      ALA  51  16.614  -4.561  -2.710
    5    HB2  ALA  51           HB3      ALA  51  17.979  -4.928  -1.655

  No H/Q in entry =           5
  In of MODEL   18
    1    H    HIS  52           H        HIS  52  17.818  -3.357  -4.707
    2    HA   HIS  52           HA       HIS  52  15.708  -3.913  -6.503
    3    HB2  HIS  52           HB2      HIS  52  16.316  -1.639  -5.718
    4    HB3  HIS  52           HB3      HIS  52  17.788  -1.721  -6.685
    5    HD1  HIS  52           HD1      HIS  52  17.476  -1.832  -9.316
    6    HD2  HIS  52           HD2      HIS  52  13.984  -1.059  -7.175
    7    HE1  HIS  52           HE1      HIS  52  15.778  -0.991 -10.996
    8    HE2  HIS  52           HE2      HIS  52  13.644  -0.514  -9.705

  No H/Q in entry =           8
  In of MODEL   18
    1    H    LEU  53           H        LEU  53  19.226  -3.880  -6.940
    2    HA   LEU  53           HA       LEU  53  19.283  -4.204  -9.739
    3    HB2  LEU  53           HB2      LEU  53  21.227  -4.939  -7.566
    4    HB3  LEU  53           HB3      LEU  53  21.546  -5.323  -9.256
    5    HG   LEU  53           HG       LEU  53  20.847  -2.521  -8.318
    6   HD13  LEU  53          HD11      LEU  53  23.195  -2.014  -8.258
    7   HD12  LEU  53          HD12      LEU  53  23.614  -3.601  -8.900
    8   HD11  LEU  53          HD13      LEU  53  22.965  -3.455  -7.272
    9   HD23  LEU  53          HD21      LEU  53  22.247  -2.062 -10.492
   10   HD22  LEU  53          HD22      LEU  53  20.568  -2.569 -10.651
   11   HD21  LEU  53          HD23      LEU  53  21.860  -3.730 -10.898

  No H/Q in entry =          11
  In of MODEL   18
    1    H    VAL  54           H        VAL  54  19.202  -6.583  -7.106
    2    HA   VAL  54           HA       VAL  54  19.350  -8.882  -8.758
    3    HB   VAL  54           HB       VAL  54  18.194  -8.462  -5.990
    4   HG12  VAL  54          HG11      VAL  54  18.550 -11.076  -5.978
    5   HG11  VAL  54          HG12      VAL  54  18.361 -10.916  -7.723
    6   HG13  VAL  54          HG13      VAL  54  17.067 -10.397  -6.645
    7   HG22  VAL  54          HG21      VAL  54  20.508  -8.223  -5.771
    8   HG21  VAL  54          HG22      VAL  54  20.856  -9.316  -7.109
    9   HG23  VAL  54          HG23      VAL  54  20.336  -9.964  -5.554

  No H/Q in entry =           9
  In of MODEL   18
    1    H    GLN  55           H        GLN  55  16.601  -7.007  -7.478
    2    HA   GLN  55           HA       GLN  55  14.599  -8.700  -8.543
    3    HB2  GLN  55           HB2      GLN  55  13.834  -7.177  -6.920
    4    HB3  GLN  55           HB3      GLN  55  14.609  -5.802  -7.702
    5    HG2  GLN  55           HG2      GLN  55  12.879  -5.504  -9.191
    6    HG3  GLN  55           HG3      GLN  55  12.578  -7.229  -9.354
    7   HE21  GLN  55          HE21      GLN  55  10.579  -7.800  -8.545
    8   HE22  GLN  55          HE22      GLN  55   9.798  -7.051  -7.238

  No H/Q in entry =           8
  In of MODEL   18
    1    H    THR  56           H        THR  56  16.302  -5.883  -9.915
    2    HA   THR  56           HA       THR  56  14.856  -5.547 -12.262
    3    HB   THR  56           HB       THR  56  17.874  -5.420 -12.100
    4    HG1  THR  56           HG1      THR  56  15.851  -3.702 -11.159
    5   HG21  THR  56          HG21      THR  56  16.457  -5.146 -14.301
    6   HG23  THR  56          HG22      THR  56  17.762  -4.013 -13.948
    7   HG22  THR  56          HG23      THR  56  16.088  -3.557 -13.626

  No H/Q in entry =           7
  In of MODEL   18
    1    H    LYS  57           H        LYS  57  17.535  -7.809 -11.646
    2    HA   LYS  57           HA       LYS  57  17.548  -9.012 -14.221
    3    HB2  LYS  57           HB2      LYS  57  19.340  -9.233 -12.468
    4    HB3  LYS  57           HB3      LYS  57  18.250 -10.251 -11.538
    5    HG2  LYS  57           HG2      LYS  57  18.178 -11.888 -13.357
    6    HG3  LYS  57           HG3      LYS  57  19.213 -10.866 -14.347
    7    HD2  LYS  57           HD2      LYS  57  21.020 -11.074 -12.669
    8    HD3  LYS  57           HD3      LYS  57  19.991 -12.122 -11.695
    9    HE2  LYS  57           HE2      LYS  57  19.879 -13.755 -13.545
   10    HE3  LYS  57           HE3      LYS  57  20.896 -12.716 -14.541
   11    HZ3  LYS  57           HZ1      LYS  57  22.509 -13.985 -13.666
   12    HZ2  LYS  57           HZ2      LYS  57  21.608 -14.399 -12.287
   13    HZ1  LYS  57           HZ3      LYS  57  22.394 -12.897 -12.371

  No H/Q in entry =          13
  In of MODEL   18
    1    H    LEU  58           H        LEU  58  15.780  -9.692 -11.240
    2    HA   LEU  58           HA       LEU  58  14.587 -12.084 -12.164
    3    HB2  LEU  58           HB2      LEU  58  13.771 -10.181  -9.974
    4    HB3  LEU  58           HB3      LEU  58  12.984 -11.730 -10.284
    5    HG   LEU  58           HG       LEU  58  15.954 -11.412  -9.735
    6   HD11  LEU  58          HD11      LEU  58  13.591 -11.853  -7.937
    7   HD13  LEU  58          HD12      LEU  58  15.032 -10.870  -7.680
    8   HD12  LEU  58          HD13      LEU  58  15.128 -12.625  -7.539
    9   HD22  LEU  58          HD21      LEU  58  15.861 -13.479 -10.755
   10   HD21  LEU  58          HD22      LEU  58  14.151 -13.709 -10.391
   11   HD23  LEU  58          HD23      LEU  58  15.365 -13.990  -9.142

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  59           H        ILE  59  13.872  -8.759 -12.858
    2    HA   ILE  59           HA       ILE  59  11.163  -9.446 -13.791
    3    HB   ILE  59           HB       ILE  59  11.947  -7.147 -12.597
    4   HG12  ILE  59          HG12      ILE  59  10.017  -7.082 -14.929
    5   HG13  ILE  59          HG13      ILE  59   9.624  -7.822 -13.399
    6   HG22  ILE  59          HG21      ILE  59  11.990  -6.341 -15.493
    7   HG21  ILE  59          HG22      ILE  59  13.480  -6.748 -14.671
    8   HG23  ILE  59          HG23      ILE  59  12.486  -5.412 -14.099
    9   HD12  ILE  59          HD11      ILE  59  10.437  -4.944 -13.805
   10   HD11  ILE  59          HD12      ILE  59  10.104  -5.683 -12.240
   11   HD13  ILE  59          HD13      ILE  59   8.810  -5.515 -13.426

  No H/Q in entry =          11
  In of MODEL   18
    1    H    GLU  60           H        GLU  60  14.354  -8.557 -15.058
    2    HA   GLU  60           HA       GLU  60  13.565  -8.177 -17.766
    3    HB2  GLU  60           HB2      GLU  60  15.738  -7.418 -16.905
    4    HB3  GLU  60           HB3      GLU  60  16.223  -9.088 -16.627
    5    HG2  GLU  60           HG2      GLU  60  16.033  -9.558 -19.040
    6    HG3  GLU  60           HG3      GLU  60  15.526  -7.895 -19.327

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLY  61           H        GLY  61  14.583 -11.039 -15.942
    2    HA3  GLY  61           HA2      GLY  61  14.059 -12.702 -18.337
    3    HA2  GLY  61           HA3      GLY  61  15.100 -13.165 -16.994

  No H/Q in entry =           3
  In of MODEL   18
    1    H    ASP  62           H        ASP  62  11.959 -11.660 -16.626
    2    HA   ASP  62           HA       ASP  62  11.062 -13.631 -14.798
    3    HB2  ASP  62           HB2      ASP  62   8.931 -12.395 -14.891
    4    HB3  ASP  62           HB3      ASP  62  10.310 -11.321 -14.670

  No H/Q in entry =           4
  In of MODEL   18
    1    H    ALA  63           H        ALA  63  11.578 -15.459 -16.514
    2    HA   ALA  63           HA       ALA  63   9.737 -15.945 -18.638
    3    HB3  ALA  63           HB1      ALA  63  10.664 -18.167 -18.694
    4    HB2  ALA  63           HB2      ALA  63  11.265 -18.015 -17.045
    5    HB1  ALA  63           HB3      ALA  63  11.983 -17.053 -18.335

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLY  64           H        GLY  64   9.824 -16.864 -15.237
    2    HA3  GLY  64           HA2      GLY  64   8.175 -17.570 -13.802
    3    HA2  GLY  64           HA3      GLY  64   6.998 -17.116 -15.027

  No H/Q in entry =           3
  In of MODEL   18
    1    H    GLU  65           H        GLU  65   6.115 -19.209 -13.873
    2    HA   GLU  65           HA       GLU  65   7.246 -21.705 -14.543
    3    HB2  GLU  65           HB2      GLU  65   4.431 -20.939 -13.789
    4    HB3  GLU  65           HB3      GLU  65   4.965 -22.606 -13.999
    5    HG2  GLU  65           HG2      GLU  65   6.668 -22.311 -12.271
    6    HG3  GLU  65           HG3      GLU  65   6.226 -20.615 -12.092

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLY  66           H        GLY  66   4.828 -19.750 -16.116
    2    HA3  GLY  66           HA2      GLY  66   4.490 -21.636 -18.319
    3    HA2  GLY  66           HA3      GLY  66   3.529 -20.202 -18.020

  No H/Q in entry =           3
  In of MODEL   18
    1    H    LYS  67           H        LYS  67   3.946 -20.204 -20.437
    2    HA   LYS  67           HA       LYS  67   6.395 -19.664 -21.600
    3    HB2  LYS  67           HB2      LYS  67   3.613 -18.847 -22.425
    4    HB3  LYS  67           HB3      LYS  67   5.037 -18.670 -23.459
    5    HG2  LYS  67           HG2      LYS  67   5.500 -21.080 -23.255
    6    HG3  LYS  67           HG3      LYS  67   4.098 -21.268 -22.204
    7    HD2  LYS  67           HD2      LYS  67   2.635 -20.480 -24.052
    8    HD3  LYS  67           HD3      LYS  67   4.050 -20.385 -25.103
    9    HE2  LYS  67           HE2      LYS  67   3.171 -22.911 -23.676
   10    HE3  LYS  67           HE3      LYS  67   2.758 -22.530 -25.347
   11    HZ3  LYS  67           HZ1      LYS  67   4.675 -23.858 -25.436
   12    HZ2  LYS  67           HZ2      LYS  67   5.445 -22.990 -24.196
   13    HZ1  LYS  67           HZ3      LYS  67   5.216 -22.276 -25.722

  No H/Q in entry =          13
  In of MODEL   18
    1    H    MET  68           H        MET  68   4.294 -17.092 -22.232
    2    HA   MET  68           HA       MET  68   6.232 -15.073 -21.929
    3    HB2  MET  68           HB2      MET  68   3.241 -14.981 -22.287
    4    HB3  MET  68           HB3      MET  68   4.262 -13.544 -22.293
    5    HG2  MET  68           HG2      MET  68   5.453 -14.273 -24.222
    6    HG3  MET  68           HG3      MET  68   4.807 -15.910 -24.093
    7    HE1  MET  68           HE1      MET  68   3.799 -12.277 -24.053
    8    HE3  MET  68           HE2      MET  68   2.348 -12.929 -23.299
    9    HE2  MET  68           HE3      MET  68   2.246 -12.192 -24.895

  No H/Q in entry =           9
  In of MODEL   18
    1    H    LYS  69           H        LYS  69   3.560 -16.029 -19.759
    2    HA   LYS  69           HA       LYS  69   3.348 -13.912 -18.086
    3    HB2  LYS  69           HB2      LYS  69   3.330 -16.849 -17.412
    4    HB3  LYS  69           HB3      LYS  69   2.866 -15.595 -16.258
    5    HG2  LYS  69           HG2      LYS  69   1.172 -14.755 -17.841
    6    HG3  LYS  69           HG3      LYS  69   1.632 -16.005 -18.997
    7    HD2  LYS  69           HD2      LYS  69   0.981 -17.748 -17.378
    8    HD3  LYS  69           HD3      LYS  69   0.515 -16.498 -16.222
    9    HE2  LYS  69           HE2      LYS  69  -1.152 -15.633 -17.825
   10    HE3  LYS  69           HE3      LYS  69  -0.692 -16.885 -18.977
   11    HZ3  LYS  69           HZ1      LYS  69  -1.365 -18.561 -17.388
   12    HZ2  LYS  69           HZ2      LYS  69  -2.656 -17.509 -17.716
   13    HZ1  LYS  69           HZ3      LYS  69  -1.790 -17.369 -16.261

  No H/Q in entry =          13
  In of MODEL   18
    1    H    VAL  70           H        VAL  70   4.008 -14.211 -15.524
    2    HA   VAL  70           HA       VAL  70   6.966 -14.323 -15.393
    3    HB   VAL  70           HB       VAL  70   6.889 -12.339 -13.910
    4   HG12  VAL  70          HG11      VAL  70   5.462 -11.654 -16.477
    5   HG11  VAL  70          HG12      VAL  70   7.115 -12.269 -16.491
    6   HG13  VAL  70          HG13      VAL  70   6.743 -10.758 -15.663
    7   HG23  VAL  70          HG21      VAL  70   4.669 -10.990 -14.070
    8   HG22  VAL  70          HG22      VAL  70   4.711 -12.366 -12.970
    9   HG21  VAL  70          HG23      VAL  70   3.932 -12.520 -14.545

  No H/Q in entry =           9
  In of MODEL   18
    1    H    SER  71           H        SER  71   7.765 -14.561 -13.166
    2    HA   SER  71           HA       SER  71   6.478 -16.654 -11.737
    3    HB2  SER  71           HB2      SER  71   8.919 -16.299 -11.675
    4    HB3  SER  71           HB3      SER  71   8.674 -14.771 -10.832
    5    HG   SER  71           HG       SER  71   7.498 -16.085  -9.243

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU  72           H        LEU  72   5.150 -16.598  -9.974
    2    HA   LEU  72           HA       LEU  72   3.571 -14.304  -9.536
    3    HB2  LEU  72           HB2      LEU  72   3.893 -16.849  -7.952
    4    HB3  LEU  72           HB3      LEU  72   2.704 -15.608  -7.565
    5    HG   LEU  72           HG       LEU  72   2.892 -16.926 -10.293
    6   HD13  LEU  72          HD11      LEU  72   0.980 -18.298  -9.586
    7   HD12  LEU  72          HD12      LEU  72   1.037 -17.571  -7.982
    8   HD11  LEU  72          HD13      LEU  72   2.365 -18.591  -8.534
    9   HD22  LEU  72          HD21      LEU  72   1.649 -14.956 -10.576
   10   HD21  LEU  72          HD22      LEU  72   0.969 -15.020  -8.957
   11   HD23  LEU  72          HD23      LEU  72   0.387 -16.124 -10.199

  No H/Q in entry =          11
  In of MODEL   18
    1    H    VAL  73           H        VAL  73   6.247 -15.700  -7.761
    2    HA   VAL  73           HA       VAL  73   6.169 -14.161  -5.433
    3    HB   VAL  73           HB       VAL  73   8.368 -14.936  -5.009
    4   HG12  VAL  73          HG11      VAL  73   7.233 -17.069  -6.816
    5   HG11  VAL  73          HG12      VAL  73   6.446 -16.636  -5.298
    6   HG13  VAL  73          HG13      VAL  73   8.094 -17.266  -5.290
    7   HG23  VAL  73          HG21      VAL  73   9.551 -16.113  -7.052
    8   HG22  VAL  73          HG22      VAL  73   9.680 -14.366  -6.850
    9   HG21  VAL  73          HG23      VAL  73   8.529 -15.037  -8.006

  No H/Q in entry =           9
  In of MODEL   18
    1    H    LEU  74           H        LEU  74   7.145 -13.264  -8.612
    2    HA   LEU  74           HA       LEU  74   9.065 -11.289  -8.127
    3    HB2  LEU  74           HB2      LEU  74   8.621 -12.047 -10.362
    4    HB3  LEU  74           HB3      LEU  74   6.946 -11.509 -10.263
    5    HG   LEU  74           HG       LEU  74   7.711  -9.168 -10.054
    6   HD11  LEU  74          HD11      LEU  74  10.416 -10.508 -10.176
    7   HD13  LEU  74          HD12      LEU  74   9.834  -9.331  -9.000
    8   HD12  LEU  74          HD13      LEU  74  10.202  -8.822 -10.648
    9   HD21  LEU  74          HD21      LEU  74   7.484 -10.606 -12.270
   10   HD23  LEU  74          HD22      LEU  74   9.192 -10.246 -12.370
   11   HD22  LEU  74          HD23      LEU  74   8.037  -8.933 -12.313

  No H/Q in entry =          11
  In of MODEL   18
    1    H    VAL  75           H        VAL  75   5.565 -10.950  -8.480
    2    HA   VAL  75           HA       VAL  75   5.433  -8.194  -7.902
    3    HB   VAL  75           HB       VAL  75   3.368 -10.359  -7.497
    4   HG12  VAL  75          HG11      VAL  75   1.767  -8.412  -7.431
    5   HG11  VAL  75          HG12      VAL  75   3.150  -7.329  -7.384
    6   HG13  VAL  75          HG13      VAL  75   2.862  -8.439  -6.052
    7   HG21  VAL  75          HG21      VAL  75   3.855  -8.284  -9.663
    8   HG23  VAL  75          HG22      VAL  75   2.454  -9.350  -9.594
    9   HG22  VAL  75          HG23      VAL  75   4.066 -10.027  -9.830

  No H/Q in entry =           9
  In of MODEL   18
    1    H    GLU  76           H        GLU  76   5.217 -11.067  -5.783
    2    HA   GLU  76           HA       GLU  76   4.729  -9.705  -3.366
    3    HB2  GLU  76           HB2      GLU  76   4.606 -12.189  -3.634
    4    HB3  GLU  76           HB3      GLU  76   6.352 -12.239  -3.795
    5    HG2  GLU  76           HG2      GLU  76   6.615 -11.355  -1.515
    6    HG3  GLU  76           HG3      GLU  76   4.874 -11.249  -1.324

  No H/Q in entry =           6
  In of MODEL   18
    1    H    ALA  77           H        ALA  77   7.800 -10.578  -4.926
    2    HA   ALA  77           HA       ALA  77   9.476  -9.507  -2.913
    3    HB1  ALA  77           HB1      ALA  77  10.536 -10.948  -4.436
    4    HB2  ALA  77           HB2      ALA  77  11.146  -9.354  -4.882
    5    HB3  ALA  77           HB3      ALA  77   9.869 -10.109  -5.836

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLN  78           H        GLN  78   8.067  -8.116  -5.832
    2    HA   GLN  78           HA       GLN  78   9.388  -5.620  -5.735
    3    HB2  GLN  78           HB2      GLN  78   8.106  -6.555  -7.690
    4    HB3  GLN  78           HB3      GLN  78   6.617  -6.196  -6.817
    5    HG2  GLN  78           HG2      GLN  78   7.237  -3.816  -6.727
    6    HG3  GLN  78           HG3      GLN  78   8.729  -4.168  -7.599
    7   HE21  GLN  78          HE21      GLN  78   6.770  -2.376  -8.686
    8   HE22  GLN  78          HE22      GLN  78   6.093  -3.100 -10.064

  No H/Q in entry =           8
  In of MODEL   18
    1    H    LEU  79           H        LEU  79   6.383  -6.790  -4.302
    2    HA   LEU  79           HA       LEU  79   5.359  -4.393  -3.301
    3    HB2  LEU  79           HB2      LEU  79   4.069  -6.460  -3.240
    4    HB3  LEU  79           HB3      LEU  79   5.222  -7.182  -2.122
    5    HG   LEU  79           HG       LEU  79   4.649  -5.541  -0.400
    6   HD13  LEU  79          HD11      LEU  79   4.160  -3.536  -1.457
    7   HD12  LEU  79          HD12      LEU  79   2.541  -4.080  -1.017
    8   HD11  LEU  79          HD13      LEU  79   3.125  -4.300  -2.665
    9   HD23  LEU  79          HD21      LEU  79   2.069  -6.065  -0.310
   10   HD22  LEU  79          HD22      LEU  79   3.224  -7.390  -0.197
   11   HD21  LEU  79          HD23      LEU  79   2.408  -7.067  -1.723

  No H/Q in entry =          11
  In of MODEL   18
    1    H    HIS  80           H        HIS  80   7.568  -6.696  -1.709
    2    HA   HIS  80           HA       HIS  80   7.835  -5.144   0.655
    3    HB2  HIS  80           HB2      HIS  80   9.203  -7.495  -0.535
    4    HB3  HIS  80           HB3      HIS  80  10.102  -6.584   0.679
    5    HD1  HIS  80           HD1      HIS  80   9.616  -7.218   3.024
    6    HD2  HIS  80           HD2      HIS  80   6.412  -8.115   0.511
    7    HE1  HIS  80           HE1      HIS  80   7.856  -8.338   4.474
    8    HE2  HIS  80           HE2      HIS  80   5.897  -8.889   2.951

  No H/Q in entry =           8
  In of MODEL   18
    1    H    LEU  81           H        LEU  81   9.847  -5.405  -2.254
    2    HA   LEU  81           HA       LEU  81  11.870  -3.637  -1.379
    3    HB2  LEU  81           HB2      LEU  81  10.961  -4.449  -4.141
    4    HB3  LEU  81           HB3      LEU  81  12.369  -3.425  -3.852
    5    HG   LEU  81           HG       LEU  81  12.006  -6.147  -2.570
    6   HD12  LEU  81          HD11      LEU  81  13.831  -6.758  -4.316
    7   HD11  LEU  81          HD12      LEU  81  13.250  -5.343  -5.193
    8   HD13  LEU  81          HD13      LEU  81  12.154  -6.679  -4.852
    9   HD23  LEU  81          HD21      LEU  81  14.631  -5.802  -2.554
   10   HD22  LEU  81          HD22      LEU  81  13.639  -5.049  -1.307
   11   HD21  LEU  81          HD23      LEU  81  14.208  -4.095  -2.677

  No H/Q in entry =          11
  In of MODEL   18
    1    H    MET  82           H        MET  82   8.942  -3.040  -3.321
    2    HA   MET  82           HA       MET  82   9.452  -0.310  -3.830
    3    HB2  MET  82           HB2      MET  82   6.910  -1.932  -3.703
    4    HB3  MET  82           HB3      MET  82   6.891  -0.209  -4.072
    5    HG2  MET  82           HG2      MET  82   8.516  -2.269  -5.599
    6    HG3  MET  82           HG3      MET  82   6.943  -1.666  -6.116
    7    HE3  MET  82           HE1      MET  82   7.355   1.790  -7.297
    8    HE2  MET  82           HE2      MET  82   6.980   1.565  -5.591
    9    HE1  MET  82           HE3      MET  82   6.329   0.445  -6.783

  No H/Q in entry =           9
  In of MODEL   18
    1    H    THR  83           H        THR  83   7.674  -1.920  -1.222
    2    HA   THR  83           HA       THR  83   6.796   0.423   0.096
    3    HB   THR  83           HB       THR  83   6.676  -1.147   2.119
    4    HG1  THR  83           HG1      THR  83   7.455  -3.090   1.896
    5   HG22  THR  83          HG21      THR  83   5.042  -2.735   0.654
    6   HG21  THR  83          HG22      THR  83   5.256  -1.408  -0.482
    7   HG23  THR  83          HG23      THR  83   4.610  -1.095   1.129

  No H/Q in entry =           7
  In of MODEL   18
    1    H    SER  84           H        SER  84   9.642  -1.643   0.627
    2    HA   SER  84           HA       SER  84  10.683  -0.194   2.812
    3    HB2  SER  84           HB2      SER  84  11.959  -2.030   0.794
    4    HB3  SER  84           HB3      SER  84  12.895  -1.262   2.075
    5    HG   SER  84           HG       SER  84  10.638  -2.975   2.337

  No H/Q in entry =           5
  In of MODEL   18
    1    H    MET  85           H        MET  85  11.438   0.064  -0.676
    2    HA   MET  85           HA       MET  85  13.415   2.051  -0.428
    3    HB2  MET  85           HB2      MET  85  13.040   0.761  -2.490
    4    HB3  MET  85           HB3      MET  85  11.500   1.590  -2.723
    5    HG2  MET  85           HG2      MET  85  12.664   3.753  -2.856
    6    HG3  MET  85           HG3      MET  85  14.206   2.948  -2.583
    7    HE1  MET  85           HE1      MET  85  11.641   4.157  -4.944
    8    HE3  MET  85           HE2      MET  85  10.965   2.532  -4.875
    9    HE2  MET  85           HE3      MET  85  11.680   3.112  -6.373

  No H/Q in entry =           9
  In of MODEL   18
    1    H    LEU  86           H        LEU  86   9.922   2.348  -0.942
    2    HA   LEU  86           HA       LEU  86   9.829   5.159  -1.133
    3    HB2  LEU  86           HB2      LEU  86   8.003   3.479  -1.706
    4    HB3  LEU  86           HB3      LEU  86   7.672   3.391   0.024
    5    HG   LEU  86           HG       LEU  86   7.485   5.950  -0.037
    6   HD11  LEU  86          HD11      LEU  86   8.269   5.514  -2.736
    7   HD13  LEU  86          HD12      LEU  86   7.816   7.039  -1.981
    8   HD12  LEU  86          HD13      LEU  86   6.591   6.061  -2.784
    9   HD23  LEU  86          HD21      LEU  86   5.367   4.570  -1.698
   10   HD22  LEU  86          HD22      LEU  86   5.163   5.832  -0.486
   11   HD21  LEU  86          HD23      LEU  86   5.578   4.193   0.013

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ALA  87           H        ALA  87   9.382   2.985   1.619
    2    HA   ALA  87           HA       ALA  87   8.812   4.899   3.582
    3    HB1  ALA  87           HB1      ALA  87   9.648   2.087   3.506
    4    HB3  ALA  87           HB2      ALA  87   8.513   2.891   4.587
    5    HB2  ALA  87           HB3      ALA  87  10.241   2.941   4.933

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ARG  88           H        ARG  88  11.911   3.502   2.610
    2    HA   ARG  88           HA       ARG  88  13.504   4.902   4.440
    3    HB2  ARG  88           HB2      ARG  88  14.194   2.931   3.043
    4    HB3  ARG  88           HB3      ARG  88  14.337   4.022   1.667
    5    HG2  ARG  88           HG2      ARG  88  15.795   5.356   3.611
    6    HG3  ARG  88           HG3      ARG  88  16.132   3.671   3.995
    7    HD2  ARG  88           HD2      ARG  88  17.404   3.382   2.151
    8    HD3  ARG  88           HD3      ARG  88  16.259   4.239   1.114
    9    HE   ARG  88           HE       ARG  88  18.642   5.330   2.161
   10   HH21  ARG  88          HH11      ARG  88  18.965   7.551   1.960
   11   HH22  ARG  88          HH12      ARG  88  17.604   8.609   1.812
   12   HH11  ARG  88          HH21      ARG  88  15.296   6.048   1.877
   13   HH12  ARG  88          HH22      ARG  88  15.525   7.755   1.740

  No H/Q in entry =          13
  In of MODEL   18
    1    H    GLU  89           H        GLU  89  12.525   5.780   1.113
    2    HA   GLU  89           HA       GLU  89  14.049   8.155   0.951
    3    HB2  GLU  89           HB2      GLU  89  12.917   7.097  -0.995
    4    HB3  GLU  89           HB3      GLU  89  11.366   7.624  -0.341
    5    HG2  GLU  89           HG2      GLU  89  12.045   9.968  -0.509
    6    HG3  GLU  89           HG3      GLU  89  13.654   9.492  -1.043

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LEU  90           H        LEU  90  10.723   7.616   2.079
    2    HA   LEU  90           HA       LEU  90  10.180  10.345   2.645
    3    HB2  LEU  90           HB2      LEU  90   9.011   7.763   3.679
    4    HB3  LEU  90           HB3      LEU  90   8.363   9.353   4.096
    5    HG   LEU  90           HG       LEU  90   8.793   8.469   1.231
    6   HD12  LEU  90          HD11      LEU  90   6.263   8.115   1.291
    7   HD11  LEU  90          HD12      LEU  90   6.416   8.111   3.048
    8   HD13  LEU  90          HD13      LEU  90   7.248   6.887   2.088
    9   HD22  LEU  90          HD21      LEU  90   8.476  10.774   1.150
   10   HD21  LEU  90          HD22      LEU  90   7.488  10.800   2.609
   11   HD23  LEU  90          HD23      LEU  90   6.798  10.234   1.088

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  91           H        ILE  91  11.468   7.683   4.577
    2    HA   ILE  91           HA       ILE  91  11.593   9.056   7.041
    3    HB   ILE  91           HB       ILE  91  13.171   6.730   5.925
    4   HG12  ILE  91          HG12      ILE  91  11.151   6.884   8.183
    5   HG13  ILE  91          HG13      ILE  91  10.685   6.593   6.508
    6   HG22  ILE  91          HG21      ILE  91  13.641   6.529   8.567
    7   HG21  ILE  91          HG22      ILE  91  13.547   8.287   8.461
    8   HG23  ILE  91          HG23      ILE  91  14.736   7.408   7.500
    9   HD13  ILE  91          HD11      ILE  91  11.709   4.502   6.445
   10   HD12  ILE  91          HD12      ILE  91  11.114   4.559   8.104
   11   HD11  ILE  91          HD13      ILE  91  12.812   4.888   7.766

  No H/Q in entry =          11
  In of MODEL   18
    1    H    THR  92           H        THR  92  13.814   8.902   4.291
    2    HA   THR  92           HA       THR  92  15.964  10.320   5.448
    3    HB   THR  92           HB       THR  92  14.982  10.176   2.587
    4    HG1  THR  92           HG1      THR  92  15.832   8.289   2.999
    5   HG22  THR  92          HG21      THR  92  17.544  10.892   2.294
    6   HG21  THR  92          HG22      THR  92  17.227  11.714   3.821
    7   HG23  THR  92          HG23      THR  92  16.254  12.088   2.398

  No H/Q in entry =           7
  In of MODEL   18
    1    H    GLU  93           H        GLU  93  13.067  11.439   3.714
    2    HA   GLU  93           HA       GLU  93  13.633  14.206   3.820
    3    HB2  GLU  93           HB2      GLU  93  10.943  12.806   3.836
    4    HB3  GLU  93           HB3      GLU  93  11.214  14.507   3.460
    5    HG2  GLU  93           HG2      GLU  93  12.576  12.274   1.940
    6    HG3  GLU  93           HG3      GLU  93  11.023  12.940   1.449

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LEU  94           H        LEU  94  11.911  12.039   6.036
    2    HA   LEU  94           HA       LEU  94  11.080  13.982   7.906
    3    HB2  LEU  94           HB2      LEU  94  11.686  11.034   8.190
    4    HB3  LEU  94           HB3      LEU  94  11.103  12.008   9.537
    5    HG   LEU  94           HG       LEU  94   9.621  12.037   6.907
    6   HD11  LEU  94          HD11      LEU  94   9.725   9.822   8.918
    7   HD13  LEU  94          HD12      LEU  94   9.425   9.753   7.183
    8   HD12  LEU  94          HD13      LEU  94   8.140  10.260   8.278
    9   HD23  LEU  94          HD21      LEU  94   7.696  12.421   8.504
   10   HD22  LEU  94          HD22      LEU  94   8.922  13.688   8.538
   11   HD21  LEU  94          HD23      LEU  94   8.871  12.475   9.816

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  95           H        ILE  95  14.074  12.082   7.677
    2    HA   ILE  95           HA       ILE  95  15.230  13.023  10.089
    3    HB   ILE  95           HB       ILE  95  16.481  11.959   7.545
    4   HG12  ILE  95          HG12      ILE  95  16.196  10.764  10.316
    5   HG13  ILE  95          HG13      ILE  95  15.033  10.490   9.021
    6   HG21  ILE  95          HG21      ILE  95  17.727  12.787  10.186
    7   HG23  ILE  95          HG22      ILE  95  18.185  13.315   8.565
    8   HG22  ILE  95          HG23      ILE  95  18.508  11.659   9.078
    9   HD13  ILE  95          HD11      ILE  95  16.527   9.222   7.762
   10   HD12  ILE  95          HD12      ILE  95  17.003   8.783   9.400
   11   HD11  ILE  95          HD13      ILE  95  17.945   9.970   8.498

  No H/Q in entry =          11
  In of MODEL   18
    1    H    GLU  96           H        GLU  96  15.374  14.248   6.751
    2    HA   GLU  96           HA       GLU  96  17.199  16.347   7.223
    3    HB2  GLU  96           HB2      GLU  96  16.543  15.671   4.965
    4    HB3  GLU  96           HB3      GLU  96  14.894  16.212   5.263
    5    HG2  GLU  96           HG2      GLU  96  15.439  18.346   4.715
    6    HG3  GLU  96           HG3      GLU  96  16.737  18.363   5.898

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LEU  97           H        LEU  97  13.690  16.126   7.651
    2    HA   LEU  97           HA       LEU  97  13.246  18.857   8.285
    3    HB2  LEU  97           HB2      LEU  97  11.753  16.318   8.905
    4    HB3  LEU  97           HB3      LEU  97  11.224  17.862   9.572
    5    HG   LEU  97           HG       LEU  97  11.712  17.442   6.609
    6   HD12  LEU  97          HD11      LEU  97   9.191  17.288   6.490
    7   HD11  LEU  97          HD12      LEU  97   9.185  17.093   8.240
    8   HD13  LEU  97          HD13      LEU  97   9.978  15.891   7.222
    9   HD23  LEU  97          HD21      LEU  97   9.955  19.388   6.634
   10   HD22  LEU  97          HD22      LEU  97  11.632  19.766   7.027
   11   HD21  LEU  97          HD23      LEU  97  10.444  19.587   8.317

  No H/Q in entry =          11
  In of MODEL   18
    1    H    HIS  98           H        HIS  98  14.095  16.045  10.289
    2    HA   HIS  98           HA       HIS  98  13.923  17.312  12.801
    3    HB2  HIS  98           HB2      HIS  98  15.696  15.069  11.807
    4    HB3  HIS  98           HB3      HIS  98  15.688  15.612  13.486
    5    HD1  HIS  98           HD1      HIS  98  13.507  13.953  10.898
    6    HD2  HIS  98           HD2      HIS  98  13.388  14.884  14.960
    7    HE1  HIS  98           HE1      HIS  98  11.493  12.741  11.853
    8    HE2  HIS  98           HE2      HIS  98  11.402  13.299  14.323

  No H/Q in entry =           8
  In of MODEL   18
    1    H    GLU  99           H        GLU  99  16.479  17.215  10.368
    2    HA   GLU  99           HA       GLU  99  18.450  18.571  11.894
    3    HB2  GLU  99           HB2      GLU  99  18.943  17.282   9.829
    4    HB3  GLU  99           HB3      GLU  99  18.121  18.526   8.884
    5    HG2  GLU  99           HG2      GLU  99  19.712  20.215   9.670
    6    HG3  GLU  99           HG3      GLU  99  20.503  19.023  10.697

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LYS 100           H        LYS 100  15.916  19.702   9.673
    2    HA   LYS 100           HA       LYS 100  16.687  22.447   9.810
    3    HB2  LYS 100           HB2      LYS 100  14.067  21.130   9.058
    4    HB3  LYS 100           HB3      LYS 100  14.349  22.871   8.962
    5    HG2  LYS 100           HG2      LYS 100  16.326  22.438   7.498
    6    HG3  LYS 100           HG3      LYS 100  15.930  20.717   7.520
    7    HD2  LYS 100           HD2      LYS 100  13.730  21.202   6.518
    8    HD3  LYS 100           HD3      LYS 100  14.110  22.925   6.502
    9    HE2  LYS 100           HE2      LYS 100  16.074  22.459   5.045
   10    HE3  LYS 100           HE3      LYS 100  15.625  20.750   5.016
   11    HZ1  LYS 100           HZ1      LYS 100  13.780  22.923   4.174
   12    HZ3  LYS 100           HZ2      LYS 100  13.611  21.251   3.917
   13    HZ2  LYS 100           HZ3      LYS 100  14.814  22.122   3.093

  No H/Q in entry =          13
  In of MODEL   18
    1    H    LEU 101           H        LEU 101  14.608  20.386  11.780
    2    HA   LEU 101           HA       LEU 101  13.422  22.448  13.352
    3    HB2  LEU 101           HB2      LEU 101  13.892  19.504  13.744
    4    HB3  LEU 101           HB3      LEU 101  13.346  20.482  15.102
    5    HG   LEU 101           HG       LEU 101  11.928  20.550  12.432
    6   HD12  LEU 101          HD11      LEU 101  10.283  18.974  13.705
    7   HD11  LEU 101          HD12      LEU 101  11.681  18.577  14.702
    8   HD13  LEU 101          HD13      LEU 101  11.718  18.266  12.965
    9   HD21  LEU 101          HD21      LEU 101  11.263  21.345  15.282
   10   HD23  LEU 101          HD22      LEU 101  10.004  21.104  14.072
   11   HD22  LEU 101          HD23      LEU 101  11.228  22.350  13.831

  No H/Q in entry =          11
  In of MODEL   18
    1    H    LYS 102           H        LYS 102  16.575  21.868  12.918
    2    HA   LYS 102           HA       LYS 102  18.413  22.759  13.989
    3    HB2  LYS 102           HB2      LYS 102  16.584  24.260  15.117
    4    HB3  LYS 102           HB3      LYS 102  16.801  23.204  16.497
    5    HG2  LYS 102           HG2      LYS 102  18.676  25.229  15.323
    6    HG3  LYS 102           HG3      LYS 102  18.296  24.916  17.003
    7    HD2  LYS 102           HD2      LYS 102  19.981  23.014  15.323
    8    HD3  LYS 102           HD3      LYS 102  20.658  24.345  16.252
    9    HE2  LYS 102           HE2      LYS 102  20.283  21.796  17.228
   10    HE3  LYS 102           HE3      LYS 102  20.488  23.242  18.215
   11    HZ2  LYS 102           HZ1      LYS 102  18.531  21.942  18.836
   12    HZ1  LYS 102           HZ2      LYS 102  17.885  22.162  17.286
   13    HZ3  LYS 102           HZ3      LYS 102  18.103  23.496  18.308

  No H/Q in entry =          13
  In of MODEL   18
    1    H    ALA 103           H        ALA 103  16.355  21.142  16.414
    2    HA   ALA 103           HA       ALA 103  18.093  19.951  18.073
    3    HB2  ALA 103           HB1      ALA 103  16.527  17.929  18.072
    4    HB1  ALA 103           HB2      ALA 103  15.624  18.771  16.812
    5    HB3  ALA 103           HB3      ALA 103  15.795  19.498  18.409

  No H/Q in entry =           5
  In of MODEL   18
    1    H1   ALA   1           H3       ALA   1  -1.577  -7.192 -21.480
    2    H2   ALA   1           H2       ALA   1  -2.358  -8.633 -21.023
    3    H3   ALA   1           H1       ALA   1  -0.750  -8.670 -21.577
    4    HA   ALA   1           HA       ALA   1  -1.579  -9.152 -23.573
    5    HB1  ALA   1           HB1      ALA   1  -3.710  -9.887 -23.098
    6    HB2  ALA   1           HB2      ALA   1  -4.161  -8.383 -23.900
    7    HB3  ALA   1           HB3      ALA   1  -4.101  -8.458 -22.141

  No H/Q in entry =           7
  In of MODEL   18
    1    H    GLU   2           H        GLU   2  -2.418  -7.974 -25.565
    2    HA   GLU   2           HA       GLU   2  -1.037  -5.950 -26.448
    3    HB2  GLU   2           HB2      GLU   2  -4.043  -6.044 -26.767
    4    HB3  GLU   2           HB3      GLU   2  -2.930  -5.174 -27.818
    5    HG2  GLU   2           HG2      GLU   2  -2.409  -7.063 -28.968
    6    HG3  GLU   2           HG3      GLU   2  -2.105  -7.962 -27.487

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLU   3           H        GLU   3  -4.209  -4.719 -25.552
    2    HA   GLU   3           HA       GLU   3  -3.185  -2.152 -24.930
    3    HB2  GLU   3           HB2      GLU   3  -5.861  -3.489 -24.596
    4    HB3  GLU   3           HB3      GLU   3  -5.578  -1.870 -23.953
    5    HG2  GLU   3           HG2      GLU   3  -5.228  -0.945 -26.082
    6    HG3  GLU   3           HG3      GLU   3  -4.819  -2.499 -26.802

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LEU   4           H        LEU   4  -4.756  -4.519 -22.745
    2    HA   LEU   4           HA       LEU   4  -4.403  -3.282 -20.357
    3    HB2  LEU   4           HB2      LEU   4  -3.834  -6.219 -20.819
    4    HB3  LEU   4           HB3      LEU   4  -4.248  -5.473 -19.277
    5    HG   LEU   4           HG       LEU   4  -6.018  -5.568 -21.742
    6   HD13  LEU   4          HD11      LEU   4  -7.197  -7.293 -20.740
    7   HD12  LEU   4          HD12      LEU   4  -6.717  -6.825 -19.110
    8   HD11  LEU   4          HD13      LEU   4  -5.573  -7.661 -20.159
    9   HD23  LEU   4          HD21      LEU   4  -7.711  -4.767 -19.877
   10   HD22  LEU   4          HD22      LEU   4  -6.682  -3.589 -20.690
   11   HD21  LEU   4          HD23      LEU   4  -6.252  -4.171 -19.083

  No H/Q in entry =          11
  In of MODEL   18
    1    H    GLU   5           H        GLU   5  -1.888  -5.107 -22.082
    2    HA   GLU   5           HA       GLU   5   0.092  -4.801 -20.045
    3    HB2  GLU   5           HB2      GLU   5   0.181  -6.577 -21.782
    4    HB3  GLU   5           HB3      GLU   5   0.466  -5.338 -23.005
    5    HG2  GLU   5           HG2      GLU   5   2.532  -4.660 -21.878
    6    HG3  GLU   5           HG3      GLU   5   2.242  -5.838 -20.598

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLU   6           H        GLU   6  -0.557  -3.101 -23.094
    2    HA   GLU   6           HA       GLU   6   1.597  -1.250 -22.830
    3    HB2  GLU   6           HB2      GLU   6   0.493  -1.736 -24.993
    4    HB3  GLU   6           HB3      GLU   6  -0.984  -0.982 -24.391
    5    HG2  GLU   6           HG2      GLU   6   0.204   1.147 -24.094
    6    HG3  GLU   6           HG3      GLU   6   1.702   0.401 -24.650

  No H/Q in entry =           6
  In of MODEL   18
    1    H    VAL   7           H        VAL   7  -1.741  -1.348 -21.786
    2    HA   VAL   7           HA       VAL   7  -1.986   1.365 -20.957
    3    HB   VAL   7           HB       VAL   7  -3.427  -1.163 -20.115
    4   HG11  VAL   7          HG11      VAL   7  -3.827   1.724 -19.308
    5   HG13  VAL   7          HG12      VAL   7  -3.716   0.303 -18.270
    6   HG12  VAL   7          HG13      VAL   7  -5.150   0.558 -19.263
    7   HG21  VAL   7          HG21      VAL   7  -3.592  -0.094 -22.506
    8   HG23  VAL   7          HG22      VAL   7  -4.549   1.149 -21.698
    9   HG22  VAL   7          HG23      VAL   7  -5.080  -0.533 -21.667

  No H/Q in entry =           9
  In of MODEL   18
    1    H    VAL   8           H        VAL   8  -0.974  -1.607 -19.306
    2    HA   VAL   8           HA       VAL   8  -0.666  -0.519 -16.713
    3    HB   VAL   8           HB       VAL   8   0.762  -2.825 -18.061
    4   HG11  VAL   8          HG11      VAL   8   0.751  -1.861 -15.189
    5   HG13  VAL   8          HG12      VAL   8   2.148  -2.104 -16.239
    6   HG12  VAL   8          HG13      VAL   8   1.235  -3.493 -15.650
    7   HG21  VAL   8          HG21      VAL   8  -1.902  -2.625 -17.356
    8   HG23  VAL   8          HG22      VAL   8  -1.200  -3.280 -15.880
    9   HG22  VAL   8          HG23      VAL   8  -1.012  -4.146 -17.401

  No H/Q in entry =           9
  In of MODEL   18
    1    H    MET   9           H        MET   9   1.587  -0.807 -19.458
    2    HA   MET   9           HA       MET   9   3.863   0.258 -18.199
    3    HB2  MET   9           HB2      MET   9   2.917   0.274 -21.063
    4    HB3  MET   9           HB3      MET   9   4.426   1.048 -20.586
    5    HG2  MET   9           HG2      MET   9   5.195  -1.094 -19.596
    6    HG3  MET   9           HG3      MET   9   3.699  -1.862 -20.131
    7    HE2  MET   9           HE1      MET   9   7.451  -1.165 -21.354
    8    HE1  MET   9           HE2      MET   9   6.543   0.290 -20.958
    9    HE3  MET   9           HE3      MET   9   7.017  -0.016 -22.625

  No H/Q in entry =           9
  In of MODEL   18
    1    H    GLY  10           H        GLY  10   1.167   1.834 -19.881
    2    HA3  GLY  10           HA2      GLY  10   2.109   4.496 -19.642
    3    HA2  GLY  10           HA3      GLY  10   0.423   4.022 -19.847

  No H/Q in entry =           3
  In of MODEL   18
    1    H    LEU  11           H        LEU  11   0.035   2.497 -17.557
    2    HA   LEU  11           HA       LEU  11  -0.510   4.475 -15.602
    3    HB2  LEU  11           HB2      LEU  11  -0.420   1.460 -15.439
    4    HB3  LEU  11           HB3      LEU  11  -0.937   2.482 -14.099
    5    HG   LEU  11           HG       LEU  11  -2.176   2.580 -16.863
    6   HD13  LEU  11          HD11      LEU  11  -2.744   0.434 -16.103
    7   HD12  LEU  11          HD12      LEU  11  -4.102   1.417 -15.560
    8   HD11  LEU  11          HD13      LEU  11  -2.842   0.949 -14.418
    9   HD22  LEU  11          HD21      LEU  11  -2.782   4.594 -15.861
   10   HD21  LEU  11          HD22      LEU  11  -2.702   3.932 -14.228
   11   HD23  LEU  11          HD23      LEU  11  -4.075   3.553 -15.270

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  12           H        ILE  12   2.051   2.027 -15.839
    2    HA   ILE  12           HA       ILE  12   3.252   2.579 -13.336
    3    HB   ILE  12           HB       ILE  12   4.518   1.545 -15.895
    4   HG12  ILE  12          HG12      ILE  12   2.508   0.302 -14.755
    5   HG13  ILE  12          HG13      ILE  12   3.913  -0.625 -15.242
    6   HG21  ILE  12          HG21      ILE  12   5.482   1.515 -13.018
    7   HG23  ILE  12          HG22      ILE  12   6.267   2.281 -14.398
    8   HG22  ILE  12          HG23      ILE  12   6.186   0.524 -14.293
    9   HD12  ILE  12          HD11      ILE  12   3.059  -1.178 -12.956
   10   HD11  ILE  12          HD12      ILE  12   3.442   0.469 -12.458
   11   HD13  ILE  12          HD13      ILE  12   4.722  -0.616 -12.953

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  13           H        ILE  13   3.844   3.839 -16.596
    2    HA   ILE  13           HA       ILE  13   5.969   5.577 -15.876
    3    HB   ILE  13           HB       ILE  13   3.937   5.639 -18.121
    4   HG12  ILE  13          HG12      ILE  13   5.793   3.813 -17.831
    5   HG13  ILE  13          HG13      ILE  13   5.526   4.536 -19.414
    6   HG23  ILE  13          HG21      ILE  13   4.642   7.919 -17.861
    7   HG22  ILE  13          HG22      ILE  13   5.551   7.270 -19.220
    8   HG21  ILE  13          HG23      ILE  13   6.330   7.448 -17.649
    9   HD12  ILE  13          HD11      ILE  13   7.973   4.385 -18.712
   10   HD11  ILE  13          HD12      ILE  13   7.597   5.558 -17.455
   11   HD13  ILE  13          HD13      ILE  13   7.422   6.001 -19.149

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ASN  14           H        ASN  14   2.458   6.045 -16.144
    2    HA   ASN  14           HA       ASN  14   2.396   8.792 -15.513
    3    HB2  ASN  14           HB2      ASN  14   0.515   7.135 -16.340
    4    HB3  ASN  14           HB3      ASN  14   0.195   6.958 -14.619
    5   HD21  ASN  14          HD21      ASN  14  -1.833   8.096 -16.054
    6   HD22  ASN  14          HD22      ASN  14  -1.908   9.769 -15.790

  No H/Q in entry =           6
  In of MODEL   18
    1    H    SER  15           H        SER  15   2.123   5.918 -13.430
    2    HA   SER  15           HA       SER  15   1.806   7.292 -10.985
    3    HB2  SER  15           HB2      SER  15   2.370   5.213  -9.931
    4    HB3  SER  15           HB3      SER  15   1.546   4.783 -11.426
    5    HG   SER  15           HG       SER  15   3.318   3.616 -11.617

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLY  16           H        GLY  16   4.690   6.213 -12.742
    2    HA3  GLY  16           HA2      GLY  16   6.609   6.989 -10.814
    3    HA2  GLY  16           HA3      GLY  16   6.914   6.784 -12.537

  No H/Q in entry =           3
  In of MODEL   18
    1    H    GLN  17           H        GLN  17   5.209   8.726 -13.604
    2    HA   GLN  17           HA       GLN  17   6.767  11.081 -13.302
    3    HB2  GLN  17           HB2      GLN  17   5.467  10.609 -15.346
    4    HB3  GLN  17           HB3      GLN  17   3.968  10.769 -14.431
    5    HG2  GLN  17           HG2      GLN  17   4.507  13.105 -13.911
    6    HG3  GLN  17           HG3      GLN  17   6.039  12.957 -14.769
    7   HE21  GLN  17          HE21      GLN  17   4.125  14.891 -15.599
    8   HE22  GLN  17          HE22      GLN  17   3.501  14.425 -17.107

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ALA  18           H        ALA  18   3.676  10.041 -11.949
    2    HA   ALA  18           HA       ALA  18   2.931  12.427 -10.689
    3    HB1  ALA  18           HB1      ALA  18   1.822   9.960 -10.905
    4    HB2  ALA  18           HB2      ALA  18   1.264  11.178  -9.761
    5    HB3  ALA  18           HB3      ALA  18   2.365   9.906  -9.228

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ARG  19           H        ARG  19   4.829   9.683  -9.404
    2    HA   ARG  19           HA       ARG  19   5.352  10.851  -6.885
    3    HB2  ARG  19           HB2      ARG  19   5.786   8.451  -7.406
    4    HB3  ARG  19           HB3      ARG  19   7.138   8.946  -8.429
    5    HG2  ARG  19           HG2      ARG  19   8.249  10.000  -6.509
    6    HG3  ARG  19           HG3      ARG  19   6.877   9.603  -5.476
    7    HD2  ARG  19           HD2      ARG  19   8.653   7.984  -5.115
    8    HD3  ARG  19           HD3      ARG  19   7.286   7.188  -5.898
    9    HE   ARG  19           HE       ARG  19   8.983   8.017  -7.948
   10   HH21  ARG  19          HH11      ARG  19  10.555   6.624  -8.795
   11   HH22  ARG  19          HH12      ARG  19  11.113   5.283  -7.857
   12   HH11  ARG  19          HH21      ARG  19   9.073   5.994  -5.165
   13   HH12  ARG  19          HH22      ARG  19  10.271   4.926  -5.800

  No H/Q in entry =          13
  In of MODEL   18
    1    H    SER  20           H        SER  20   7.168  10.890  -9.934
    2    HA   SER  20           HA       SER  20   9.400  12.328  -9.114
    3    HB2  SER  20           HB2      SER  20   8.881  11.288 -11.423
    4    HB3  SER  20           HB3      SER  20   8.089  12.820 -11.777
    5    HG   SER  20           HG       SER  20  10.786  12.387 -11.004

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU  21           H        LEU  21   6.289  13.565 -10.313
    2    HA   LEU  21           HA       LEU  21   6.934  16.317 -10.096
    3    HB2  LEU  21           HB2      LEU  21   4.279  14.869 -10.010
    4    HB3  LEU  21           HB3      LEU  21   4.429  16.625 -10.022
    5    HG   LEU  21           HG       LEU  21   5.666  14.848 -12.144
    6   HD13  LEU  21          HD11      LEU  21   3.749  15.343 -13.547
    7   HD12  LEU  21          HD12      LEU  21   3.052  16.377 -12.300
    8   HD11  LEU  21          HD13      LEU  21   3.163  14.637 -12.040
    9   HD23  LEU  21          HD21      LEU  21   5.346  17.160 -13.394
   10   HD22  LEU  21          HD22      LEU  21   6.727  16.953 -12.321
   11   HD21  LEU  21          HD23      LEU  21   5.310  17.827 -11.764

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ALA  22           H        ALA  22   5.444  14.019  -7.842
    2    HA   ALA  22           HA       ALA  22   4.823  15.825  -5.779
    3    HB3  ALA  22           HB1      ALA  22   4.086  13.425  -5.936
    4    HB2  ALA  22           HB2      ALA  22   4.670  13.907  -4.343
    5    HB1  ALA  22           HB3      ALA  22   5.703  12.956  -5.412

  No H/Q in entry =           5
  In of MODEL   18
    1    H    TYR  23           H        TYR  23   7.778  13.829  -6.213
    2    HA   TYR  23           HA       TYR  23   9.151  14.867  -3.964
    3    HB2  TYR  23           HB2      TYR  23   9.959  12.865  -5.117
    4    HB3  TYR  23           HB3      TYR  23  10.261  13.803  -6.579
    5    HD1  TYR  23           HD1      TYR  23  11.232  13.483  -2.988
    6    HD2  TYR  23           HD2      TYR  23  12.281  14.998  -6.870
    7    HE1  TYR  23           HE1      TYR  23  13.485  14.087  -2.144
    8    HE2  TYR  23           HE2      TYR  23  14.533  15.603  -6.025
    9    HH   TYR  23           HH       TYR  23  15.787  15.866  -4.160

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ALA  24           H        ALA  24   8.955  15.964  -7.333
    2    HA   ALA  24           HA       ALA  24  10.829  18.070  -7.092
    3    HB2  ALA  24           HB1      ALA  24  10.385  18.122  -9.301
    4    HB3  ALA  24           HB2      ALA  24   8.822  18.856  -8.943
    5    HB1  ALA  24           HB3      ALA  24   8.966  17.104  -9.069

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA  25           H        ALA  25   7.352  17.849  -6.470
    2    HA   ALA  25           HA       ALA  25   6.842  20.563  -5.907
    3    HB1  ALA  25           HB1      ALA  25   5.203  18.546  -6.103
    4    HB2  ALA  25           HB2      ALA  25   4.821  19.833  -4.958
    5    HB3  ALA  25           HB3      ALA  25   5.528  18.321  -4.383

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU  26           H        LEU  26   7.941  17.901  -3.851
    2    HA   LEU  26           HA       LEU  26   8.030  19.339  -1.417
    3    HB2  LEU  26           HB2      LEU  26   8.153  16.924  -1.406
    4    HB3  LEU  26           HB3      LEU  26   9.623  16.946  -2.377
    5    HG   LEU  26           HG       LEU  26  10.825  18.083  -0.540
    6   HD12  LEU  26          HD11      LEU  26   9.599  18.082   1.720
    7   HD11  LEU  26          HD12      LEU  26   8.113  17.925   0.786
    8   HD13  LEU  26          HD13      LEU  26   9.141  19.342   0.574
    9   HD21  LEU  26          HD21      LEU  26   9.321  15.600   0.340
   10   HD23  LEU  26          HD22      LEU  26  10.830  16.182   1.035
   11   HD22  LEU  26          HD23      LEU  26  10.791  15.618  -0.633

  No H/Q in entry =          11
  In of MODEL   18
    1    H    LYS  27           H        LYS  27  10.453  18.789  -3.941
    2    HA   LYS  27           HA       LYS  27  12.622  20.059  -2.717
    3    HB2  LYS  27           HB2      LYS  27  12.739  18.708  -4.803
    4    HB3  LYS  27           HB3      LYS  27  11.958  20.028  -5.672
    5    HG2  LYS  27           HG2      LYS  27  13.805  21.537  -5.099
    6    HG3  LYS  27           HG3      LYS  27  14.582  20.257  -4.159
    7    HD2  LYS  27           HD2      LYS  27  14.741  18.866  -6.210
    8    HD3  LYS  27           HD3      LYS  27  14.010  20.173  -7.141
    9    HE2  LYS  27           HE2      LYS  27  15.879  21.663  -6.533
   10    HE3  LYS  27           HE3      LYS  27  16.615  20.361  -5.592
   11    HZ3  LYS  27           HZ1      LYS  27  17.603  20.467  -7.779
   12    HZ2  LYS  27           HZ2      LYS  27  16.078  20.328  -8.519
   13    HZ1  LYS  27           HZ3      LYS  27  16.717  19.027  -7.632

  No H/Q in entry =          13
  In of MODEL   18
    1    H    GLN  28           H        GLN  28   9.982  21.403  -4.669
    2    HA   GLN  28           HA       GLN  28  10.908  24.067  -4.829
    3    HB2  GLN  28           HB2      GLN  28   8.089  22.962  -4.713
    4    HB3  GLN  28           HB3      GLN  28   8.481  24.638  -5.093
    5    HG2  GLN  28           HG2      GLN  28   9.502  22.232  -6.631
    6    HG3  GLN  28           HG3      GLN  28   8.159  23.254  -7.140
    7   HE21  GLN  28          HE21      GLN  28  11.318  22.786  -7.842
    8   HE22  GLN  28          HE22      GLN  28  11.784  24.373  -8.224

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ALA  29           H        ALA  29   8.999  22.357  -2.388
    2    HA   ALA  29           HA       ALA  29   8.422  24.546  -0.712
    3    HB2  ALA  29           HB1      ALA  29   7.714  22.973   0.861
    4    HB1  ALA  29           HB2      ALA  29   8.950  21.803   0.399
    5    HB3  ALA  29           HB3      ALA  29   7.560  22.076  -0.650

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LYS  30           H        LYS  30  11.181  22.314  -0.776
    2    HA   LYS  30           HA       LYS  30  12.488  23.291   1.524
    3    HB2  LYS  30           HB2      LYS  30  13.599  22.012  -0.983
    4    HB3  LYS  30           HB3      LYS  30  14.578  22.388   0.437
    5    HG2  LYS  30           HG2      LYS  30  13.043  20.989   1.821
    6    HG3  LYS  30           HG3      LYS  30  12.163  20.552   0.352
    7    HD2  LYS  30           HD2      LYS  30  14.220  19.589  -0.607
    8    HD3  LYS  30           HD3      LYS  30  15.119  20.040   0.844
    9    HE2  LYS  30           HE2      LYS  30  13.633  18.593   2.202
   10    HE3  LYS  30           HE3      LYS  30  12.764  18.123   0.736
   11    HZ2  LYS  30           HZ1      LYS  30  14.576  16.570   1.500
   12    HZ1  LYS  30           HZ2      LYS  30  15.698  17.770   1.045
   13    HZ3  LYS  30           HZ3      LYS  30  14.671  17.070  -0.117

  No H/Q in entry =          13
  In of MODEL   18
    1    H    GLN  31           H        GLN  31  12.362  24.485  -1.776
    2    HA   GLN  31           HA       GLN  31  14.490  26.407  -1.361
    3    HB2  GLN  31           HB2      GLN  31  12.446  26.422  -3.584
    4    HB3  GLN  31           HB3      GLN  31  14.057  27.138  -3.588
    5    HG2  GLN  31           HG2      GLN  31  14.554  24.450  -3.005
    6    HG3  GLN  31           HG3      GLN  31  13.250  24.376  -4.183
    7   HE21  GLN  31          HE21      GLN  31  16.104  23.618  -4.586
    8   HE22  GLN  31          HE22      GLN  31  16.663  24.595  -5.855

  No H/Q in entry =           8
  In of MODEL   18
    1    H    GLY  32           H        GLY  32  11.419  26.188  -0.213
    2    HA3  GLY  32           HA2      GLY  32  10.243  27.745   1.056
    3    HA2  GLY  32           HA3      GLY  32  11.352  28.993   0.502

  No H/Q in entry =           3
  In of MODEL   18
    1    H    ASP  33           H        ASP  33  10.012  27.065  -1.984
    2    HA   ASP  33           HA       ASP  33   8.318  29.314  -2.845
    3    HB2  ASP  33           HB2      ASP  33   9.441  26.905  -4.282
    4    HB3  ASP  33           HB3      ASP  33   8.276  28.003  -5.014

  No H/Q in entry =           4
  In of MODEL   18
    1    H    PHE  34           H        PHE  34   6.636  28.820  -1.279
    2    HA   PHE  34           HA       PHE  34   5.289  26.331  -1.177
    3    HB2  PHE  34           HB2      PHE  34   4.292  29.107  -0.504
    4    HB3  PHE  34           HB3      PHE  34   3.463  27.607  -0.088
    5    HD1  PHE  34           HD1      PHE  34   5.682  30.038   1.119
    6    HD2  PHE  34           HD2      PHE  34   5.057  25.788   1.077
    7    HE1  PHE  34           HE1      PHE  34   7.077  29.810   3.155
    8    HE2  PHE  34           HE2      PHE  34   6.454  25.565   3.112
    9    HZ   PHE  34           HZ       PHE  34   7.457  27.577   4.150

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ALA  35           H        ALA  35   4.820  29.183  -3.195
    2    HA   ALA  35           HA       ALA  35   2.277  28.533  -4.217
    3    HB3  ALA  35           HB1      ALA  35   3.310  29.934  -6.259
    4    HB2  ALA  35           HB2      ALA  35   4.523  30.314  -5.037
    5    HB1  ALA  35           HB3      ALA  35   2.827  30.702  -4.746

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA  36           H        ALA  36   5.513  27.898  -5.571
    2    HA   ALA  36           HA       ALA  36   4.542  26.451  -7.810
    3    HB3  ALA  36           HB1      ALA  36   6.699  26.601  -8.427
    4    HB2  ALA  36           HB2      ALA  36   7.194  25.583  -7.074
    5    HB1  ALA  36           HB3      ALA  36   7.066  27.330  -6.864

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA  37           H        ALA  37   5.512  25.477  -4.553
    2    HA   ALA  37           HA       ALA  37   5.490  22.688  -4.975
    3    HB2  ALA  37           HB1      ALA  37   5.207  24.481  -2.601
    4    HB1  ALA  37           HB2      ALA  37   6.357  23.178  -2.891
    5    HB3  ALA  37           HB3      ALA  37   4.700  22.804  -2.418

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LYS  38           H        LYS  38   2.929  24.865  -3.812
    2    HA   LYS  38           HA       LYS  38   0.854  23.026  -3.583
    3    HB2  LYS  38           HB2      LYS  38   1.169  25.787  -3.340
    4    HB3  LYS  38           HB3      LYS  38  -0.029  25.620  -4.618
    5    HG2  LYS  38           HG2      LYS  38  -1.460  24.282  -3.171
    6    HG3  LYS  38           HG3      LYS  38  -0.215  24.241  -1.915
    7    HD2  LYS  38           HD2      LYS  38  -0.431  26.577  -1.474
    8    HD3  LYS  38           HD3      LYS  38  -1.347  26.850  -2.956
    9    HE2  LYS  38           HE2      LYS  38  -2.850  26.869  -1.016
   10    HE3  LYS  38           HE3      LYS  38  -3.207  25.485  -2.054
   11    HZ3  LYS  38           HZ1      LYS  38  -2.461  24.028  -0.518
   12    HZ2  LYS  38           HZ2      LYS  38  -2.828  25.284   0.568
   13    HZ1  LYS  38           HZ3      LYS  38  -1.230  25.053   0.043

  No H/Q in entry =          13
  In of MODEL   18
    1    H    ALA  39           H        ALA  39   1.807  24.933  -6.438
    2    HA   ALA  39           HA       ALA  39  -0.258  24.034  -8.137
    3    HB2  ALA  39           HB1      ALA  39   2.469  24.715  -9.194
    4    HB1  ALA  39           HB2      ALA  39   1.486  25.966  -8.432
    5    HB3  ALA  39           HB3      ALA  39   0.884  25.117  -9.855

  No H/Q in entry =           5
  In of MODEL   18
    1    H    MET  40           H        MET  40   2.997  22.779  -7.556
    2    HA   MET  40           HA       MET  40   2.925  20.753  -9.541
    3    HB2  MET  40           HB2      MET  40   4.535  21.005  -6.994
    4    HB3  MET  40           HB3      MET  40   4.801  19.749  -8.206
    5    HG2  MET  40           HG2      MET  40   4.820  22.703  -8.879
    6    HG3  MET  40           HG3      MET  40   6.278  21.821  -8.428
    7    HE3  MET  40           HE1      MET  40   7.178  19.610 -11.231
    8    HE2  MET  40           HE2      MET  40   6.620  19.288  -9.592
    9    HE1  MET  40           HE3      MET  40   7.697  20.649  -9.896

  No H/Q in entry =           9
  In of MODEL   18
    1    H    MET  41           H        MET  41   2.011  20.792  -6.117
    2    HA   MET  41           HA       MET  41   1.516  18.021  -5.832
    3    HB2  MET  41           HB2      MET  41   0.152  20.364  -4.487
    4    HB3  MET  41           HB3      MET  41   0.019  18.686  -3.974
    5    HG2  MET  41           HG2      MET  41   2.727  18.945  -4.013
    6    HG3  MET  41           HG3      MET  41   2.264  20.598  -3.622
    7    HE2  MET  41           HE1      MET  41  -0.758  19.309  -1.891
    8    HE1  MET  41           HE2      MET  41   0.038  20.833  -2.273
    9    HE3  MET  41           HE3      MET  41  -0.013  20.266  -0.604

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ASP  42           H        ASP  42  -0.559  20.715  -6.812
    2    HA   ASP  42           HA       ASP  42  -2.982  19.321  -6.944
    3    HB2  ASP  42           HB2      ASP  42  -2.310  21.901  -7.208
    4    HB3  ASP  42           HB3      ASP  42  -2.456  21.499  -8.915

  No H/Q in entry =           4
  In of MODEL   18
    1    H    GLN  43           H        GLN  43  -0.550  19.939  -9.449
    2    HA   GLN  43           HA       GLN  43  -1.920  18.595 -11.534
    3    HB2  GLN  43           HB2      GLN  43   1.031  19.153 -11.155
    4    HB3  GLN  43           HB3      GLN  43   0.326  18.499 -12.635
    5    HG2  GLN  43           HG2      GLN  43  -1.213  20.505 -12.681
    6    HG3  GLN  43           HG3      GLN  43  -0.269  21.178 -11.356
    7   HE21  GLN  43          HE21      GLN  43  -0.131  22.795 -13.446
    8   HE22  GLN  43          HE22      GLN  43   1.287  22.591 -14.354

  No H/Q in entry =           8
  In of MODEL   18
    1    H    SER  44           H        SER  44   0.447  17.494  -9.141
    2    HA   SER  44           HA       SER  44   0.818  14.889 -10.160
    3    HB2  SER  44           HB2      SER  44   1.693  16.346  -7.927
    4    HB3  SER  44           HB3      SER  44   0.850  14.953  -7.253
    5    HG   SER  44           HG       SER  44   2.970  14.361  -7.678

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ARG  45           H        ARG  45  -1.519  16.182  -7.824
    2    HA   ARG  45           HA       ARG  45  -2.873  13.803  -7.182
    3    HB2  ARG  45           HB2      ARG  45  -3.101  15.972  -5.996
    4    HB3  ARG  45           HB3      ARG  45  -3.967  16.623  -7.385
    5    HG2  ARG  45           HG2      ARG  45  -5.708  14.873  -7.096
    6    HG3  ARG  45           HG3      ARG  45  -4.855  14.277  -5.672
    7    HD2  ARG  45           HD2      ARG  45  -5.093  16.543  -4.622
    8    HD3  ARG  45           HD3      ARG  45  -6.087  17.046  -6.005
    9    HE   ARG  45           HE       ARG  45  -7.163  14.657  -4.958
   10   HH21  ARG  45          HH11      ARG  45  -9.000  14.710  -3.687
   11   HH22  ARG  45          HH12      ARG  45  -9.415  16.146  -2.821
   12   HH11  ARG  45          HH21      ARG  45  -6.663  17.914  -3.943
   13   HH12  ARG  45          HH22      ARG  45  -8.087  17.961  -2.965

  No H/Q in entry =          13
  In of MODEL   18
    1    H    MET  46           H        MET  46  -3.492  16.192  -9.739
    2    HA   MET  46           HA       MET  46  -5.814  14.984 -10.797
    3    HB2  MET  46           HB2      MET  46  -3.740  16.838 -11.975
    4    HB3  MET  46           HB3      MET  46  -5.113  16.259 -12.924
    5    HG2  MET  46           HG2      MET  46  -6.674  17.176 -11.284
    6    HG3  MET  46           HG3      MET  46  -5.338  17.684 -10.256
    7    HE3  MET  46           HE1      MET  46  -5.575  18.037 -14.353
    8    HE2  MET  46           HE2      MET  46  -6.716  19.375 -14.265
    9    HE1  MET  46           HE3      MET  46  -7.116  17.834 -13.508

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ALA  47           H        ALA  47  -2.379  14.552 -11.555
    2    HA   ALA  47           HA       ALA  47  -2.700  12.814 -13.760
    3    HB3  ALA  47           HB1      ALA  47  -0.536  13.736 -13.412
    4    HB2  ALA  47           HB2      ALA  47  -0.369  12.010 -13.073
    5    HB1  ALA  47           HB3      ALA  47  -0.478  13.164 -11.743

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU  48           H        LEU  48  -2.420  12.191 -10.285
    2    HA   LEU  48           HA       LEU  48  -2.473   9.350 -10.435
    3    HB2  LEU  48           HB2      LEU  48  -3.265  11.262  -8.227
    4    HB3  LEU  48           HB3      LEU  48  -3.145   9.514  -8.021
    5    HG   LEU  48           HG       LEU  48  -0.872  11.244  -9.024
    6   HD13  LEU  48          HD11      LEU  48  -1.165  12.016  -6.835
    7   HD12  LEU  48          HD12      LEU  48   0.017  10.726  -6.633
    8   HD11  LEU  48          HD13      LEU  48  -1.677  10.440  -6.235
    9   HD22  LEU  48          HD21      LEU  48  -0.341   9.064  -9.659
   10   HD21  LEU  48          HD22      LEU  48  -1.200   8.340  -8.301
   11   HD23  LEU  48          HD23      LEU  48   0.362   9.117  -8.043

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ASN  49           H        ASN  49  -4.973  11.807 -10.040
    2    HA   ASN  49           HA       ASN  49  -7.134  10.112  -9.495
    3    HB2  ASN  49           HB2      ASN  49  -7.216  12.539  -9.183
    4    HB3  ASN  49           HB3      ASN  49  -7.079  12.789 -10.919
    5   HD21  ASN  49          HD21      ASN  49  -9.291  13.814  -9.485
    6   HD22  ASN  49          HD22      ASN  49 -10.685  12.968  -9.948

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLU  50           H        GLU  50  -5.873  11.319 -12.586
    2    HA   GLU  50           HA       GLU  50  -7.809  10.031 -14.228
    3    HB2  GLU  50           HB2      GLU  50  -6.370  11.869 -15.048
    4    HB3  GLU  50           HB3      GLU  50  -4.960  10.818 -14.907
    5    HG2  GLU  50           HG2      GLU  50  -5.912   9.263 -16.539
    6    HG3  GLU  50           HG3      GLU  50  -7.386  10.220 -16.629

  No H/Q in entry =           6
  In of MODEL   18
    1    H    ALA  51           H        ALA  51  -4.624   9.088 -13.020
    2    HA   ALA  51           HA       ALA  51  -4.449   6.634 -14.432
    3    HB2  ALA  51           HB1      ALA  51  -2.464   6.378 -13.331
    4    HB1  ALA  51           HB2      ALA  51  -3.157   6.794 -11.765
    5    HB3  ALA  51           HB3      ALA  51  -2.721   8.069 -12.903

  No H/Q in entry =           5
  In of MODEL   18
    1    H    HIS  52           H        HIS  52  -5.633   7.457 -11.185
    2    HA   HIS  52           HA       HIS  52  -6.281   4.840 -10.346
    3    HB2  HIS  52           HB2      HIS  52  -6.170   6.803  -8.838
    4    HB3  HIS  52           HB3      HIS  52  -7.632   7.441  -9.590
    5    HD1  HIS  52           HD1      HIS  52  -9.851   6.025  -9.255
    6    HD2  HIS  52           HD2      HIS  52  -6.610   4.768  -6.954
    7    HE1  HIS  52           HE1      HIS  52 -10.790   4.491  -7.471
    8    HE2  HIS  52           HE2      HIS  52  -8.825   3.717  -6.060

  No H/Q in entry =           8
  In of MODEL   18
    1    H    LEU  53           H        LEU  53  -8.136   7.267 -12.141
    2    HA   LEU  53           HA       LEU  53 -10.623   5.939 -12.150
    3    HB2  LEU  53           HB2      LEU  53  -9.368   7.931 -14.028
    4    HB3  LEU  53           HB3      LEU  53 -10.959   7.245 -14.342
    5    HG   LEU  53           HG       LEU  53 -10.251   8.581 -11.711
    6   HD13  LEU  53          HD11      LEU  53 -11.234  10.612 -12.535
    7   HD12  LEU  53          HD12      LEU  53 -11.749   9.826 -14.028
    8   HD11  LEU  53          HD13      LEU  53 -10.038  10.114 -13.726
    9   HD23  LEU  53          HD21      LEU  53 -12.851   8.933 -11.857
   10   HD22  LEU  53          HD22      LEU  53 -12.227   7.363 -11.365
   11   HD21  LEU  53          HD23      LEU  53 -12.801   7.601 -13.004

  No H/Q in entry =          11
  In of MODEL   18
    1    H    VAL  54           H        VAL  54  -7.870   5.774 -14.386
    2    HA   VAL  54           HA       VAL  54  -9.067   3.982 -16.225
    3    HB   VAL  54           HB       VAL  54  -6.167   4.531 -15.543
    4   HG12  VAL  54          HG11      VAL  54  -5.904   3.443 -17.930
    5   HG11  VAL  54          HG12      VAL  54  -7.422   2.641 -17.524
    6   HG13  VAL  54          HG13      VAL  54  -6.003   2.410 -16.504
    7   HG22  VAL  54          HG21      VAL  54  -6.964   6.460 -16.594
    8   HG21  VAL  54          HG22      VAL  54  -8.145   5.577 -17.559
    9   HG23  VAL  54          HG23      VAL  54  -6.437   5.520 -17.990

  No H/Q in entry =           9
  In of MODEL   18
    1    H    GLN  55           H        GLN  55  -7.061   3.471 -13.323
    2    HA   GLN  55           HA       GLN  55  -6.932   0.655 -13.572
    3    HB2  GLN  55           HB2      GLN  55  -5.390   1.577 -12.055
    4    HB3  GLN  55           HB3      GLN  55  -6.619   2.528 -11.228
    5    HG2  GLN  55           HG2      GLN  55  -7.284   0.765  -9.906
    6    HG3  GLN  55           HG3      GLN  55  -7.043  -0.422 -11.181
    7   HE21  GLN  55          HE21      GLN  55  -5.399  -1.848 -10.682
    8   HE22  GLN  55          HE22      GLN  55  -4.020  -1.475  -9.771

  No H/Q in entry =           8
  In of MODEL   18
    1    H    THR  56           H        THR  56  -9.293   2.790 -11.964
    2    HA   THR  56           HA       THR  56 -10.852   0.889 -10.669
    3    HB   THR  56           HB       THR  56 -11.976   3.260 -12.182
    4    HG1  THR  56           HG1      THR  56 -10.546   3.060  -9.764
    5   HG21  THR  56          HG21      THR  56 -13.420   1.429 -10.990
    6   HG23  THR  56          HG22      THR  56 -13.791   3.132 -10.719
    7   HG22  THR  56          HG23      THR  56 -12.879   2.224  -9.512

  No H/Q in entry =           7
  In of MODEL   18
    1    H    LYS  57           H        LYS  57 -11.068   1.959 -14.058
    2    HA   LYS  57           HA       LYS  57 -13.201   0.241 -14.808
    3    HB2  LYS  57           HB2      LYS  57 -12.343   2.203 -16.127
    4    HB3  LYS  57           HB3      LYS  57 -10.899   1.272 -16.500
    5    HG2  LYS  57           HG2      LYS  57 -12.245  -0.413 -17.657
    6    HG3  LYS  57           HG3      LYS  57 -13.722   0.447 -17.236
    7    HD2  LYS  57           HD2      LYS  57 -12.954   2.404 -18.543
    8    HD3  LYS  57           HD3      LYS  57 -11.485   1.535 -18.981
    9    HE2  LYS  57           HE2      LYS  57 -12.834  -0.201 -20.110
   10    HE3  LYS  57           HE3      LYS  57 -14.318   0.644 -19.667
   11    HZ3  LYS  57           HZ1      LYS  57 -14.032   1.588 -21.664
   12    HZ2  LYS  57           HZ2      LYS  57 -12.363   1.274 -21.711
   13    HZ1  LYS  57           HZ3      LYS  57 -12.957   2.604 -20.837

  No H/Q in entry =          13
  In of MODEL   18
    1    H    LEU  58           H        LEU  58  -9.691  -0.142 -14.748
    2    HA   LEU  58           HA       LEU  58  -9.664  -2.663 -16.030
    3    HB2  LEU  58           HB2      LEU  58  -7.648  -1.338 -14.225
    4    HB3  LEU  58           HB3      LEU  58  -7.367  -2.859 -15.074
    5    HG   LEU  58           HG       LEU  58  -8.155  -0.269 -16.446
    6   HD11  LEU  58          HD11      LEU  58  -5.493  -1.468 -15.750
    7   HD13  LEU  58          HD12      LEU  58  -6.010   0.217 -15.707
    8   HD12  LEU  58          HD13      LEU  58  -5.660  -0.554 -17.250
    9   HD22  LEU  58          HD21      LEU  58  -8.709  -1.843 -18.032
   10   HD21  LEU  58          HD22      LEU  58  -7.651  -3.075 -17.346
   11   HD23  LEU  58          HD23      LEU  58  -6.978  -1.795 -18.355

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  59           H        ILE  59 -10.499  -1.762 -12.782
    2    HA   ILE  59           HA       ILE  59 -10.111  -4.521 -11.825
    3    HB   ILE  59           HB       ILE  59  -9.702  -2.239 -10.435
    4   HG12  ILE  59          HG12      ILE  59 -11.021  -4.621  -9.111
    5   HG13  ILE  59          HG13      ILE  59  -9.372  -4.656  -9.687
    6   HG22  ILE  59          HG21      ILE  59 -12.448  -3.011  -9.489
    7   HG21  ILE  59          HG22      ILE  59 -12.250  -1.766 -10.701
    8   HG23  ILE  59          HG23      ILE  59 -11.531  -1.575  -9.104
    9   HD12  ILE  59          HD11      ILE  59 -10.495  -2.737  -7.658
   10   HD11  ILE  59          HD12      ILE  59  -8.849  -2.676  -8.275
   11   HD13  ILE  59          HD13      ILE  59  -9.383  -4.060  -7.320

  No H/Q in entry =          11
  In of MODEL   18
    1    H    GLU  60           H        GLU  60 -12.700  -2.244 -12.642
    2    HA   GLU  60           HA       GLU  60 -14.864  -3.787 -11.625
    3    HB2  GLU  60           HB2      GLU  60 -15.113  -1.422 -12.226
    4    HB3  GLU  60           HB3      GLU  60 -14.779  -1.798 -13.913
    5    HG2  GLU  60           HG2      GLU  60 -16.792  -3.259 -13.964
    6    HG3  GLU  60           HG3      GLU  60 -17.144  -2.800 -12.310

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLY  61           H        GLY  61 -13.189  -3.758 -14.739
    2    HA3  GLY  61           HA2      GLY  61 -14.871  -6.029 -15.623
    3    HA2  GLY  61           HA3      GLY  61 -14.040  -4.916 -16.704

  No H/Q in entry =           3
  In of MODEL   18
    1    H    ASP  62           H        ASP  62 -12.650  -6.339 -13.815
    2    HA   ASP  62           HA       ASP  62 -10.333  -7.216 -15.213
    3    HB2  ASP  62           HB2      ASP  62  -9.702  -8.163 -13.016
    4    HB3  ASP  62           HB3      ASP  62 -10.253  -6.497 -12.880

  No H/Q in entry =           4
  In of MODEL   18
    1    H    ALA  63           H        ALA  63 -11.834  -8.524 -16.827
    2    HA   ALA  63           HA       ALA  63 -12.887 -11.057 -16.047
    3    HB2  ALA  63           HB1      ALA  63 -12.975 -11.521 -18.420
    4    HB3  ALA  63           HB2      ALA  63 -11.743 -10.306 -18.757
    5    HB1  ALA  63           HB3      ALA  63 -13.346  -9.810 -18.214

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLY  64           H        GLY  64  -9.743  -9.985 -17.206
    2    HA3  GLY  64           HA2      GLY  64  -7.658 -10.938 -17.099
    3    HA2  GLY  64           HA3      GLY  64  -8.315 -12.099 -15.953

  No H/Q in entry =           3
  In of MODEL   18
    1    H    GLU  65           H        GLU  65  -6.622 -13.347 -17.376
    2    HA   GLU  65           HA       GLU  65  -7.330 -14.101 -20.000
    3    HB2  GLU  65           HB2      GLU  65  -5.595 -15.464 -17.943
    4    HB3  GLU  65           HB3      GLU  65  -5.763 -16.026 -19.607
    5    HG2  GLU  65           HG2      GLU  65  -4.952 -13.887 -20.455
    6    HG3  GLU  65           HG3      GLU  65  -4.872 -13.240 -18.816

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLY  66           H        GLY  66  -8.036 -15.527 -16.900
    2    HA3  GLY  66           HA2      GLY  66  -9.582 -17.713 -18.063
    3    HA2  GLY  66           HA3      GLY  66  -9.128 -17.540 -16.380

  No H/Q in entry =           3
  In of MODEL   18
    1    H    LYS  67           H        LYS  67 -11.478 -18.282 -16.373
    2    HA   LYS  67           HA       LYS  67 -13.618 -16.691 -17.087
    3    HB2  LYS  67           HB2      LYS  67 -13.325 -18.671 -14.834
    4    HB3  LYS  67           HB3      LYS  67 -14.870 -17.976 -15.338
    5    HG2  LYS  67           HG2      LYS  67 -14.510 -18.802 -17.630
    6    HG3  LYS  67           HG3      LYS  67 -12.958 -19.482 -17.148
    7    HD2  LYS  67           HD2      LYS  67 -14.132 -20.944 -15.514
    8    HD3  LYS  67           HD3      LYS  67 -15.675 -20.301 -16.082
    9    HE2  LYS  67           HE2      LYS  67 -13.644 -21.653 -17.883
   10    HE3  LYS  67           HE3      LYS  67 -15.031 -22.478 -17.171
   11    HZ3  LYS  67           HZ1      LYS  67 -15.717 -21.794 -19.288
   12    HZ2  LYS  67           HZ2      LYS  67 -15.032 -20.249 -19.117
   13    HZ1  LYS  67           HZ3      LYS  67 -16.415 -20.672 -18.226

  No H/Q in entry =          13
  In of MODEL   18
    1    H    MET  68           H        MET  68 -13.693 -17.176 -13.745
    2    HA   MET  68           HA       MET  68 -14.525 -14.563 -13.107
    3    HB2  MET  68           HB2      MET  68 -13.611 -16.870 -11.396
    4    HB3  MET  68           HB3      MET  68 -14.271 -15.374 -10.739
    5    HG2  MET  68           HG2      MET  68 -16.379 -15.720 -11.800
    6    HG3  MET  68           HG3      MET  68 -15.732 -17.002 -12.825
    7    HE1  MET  68           HE1      MET  68 -15.880 -15.788  -9.260
    8    HE3  MET  68           HE2      MET  68 -14.494 -16.862  -9.074
    9    HE2  MET  68           HE3      MET  68 -16.008 -17.238  -8.253

  No H/Q in entry =           9
  In of MODEL   18
    1    H    LYS  69           H        LYS  69 -11.328 -16.110 -12.692
    2    HA   LYS  69           HA       LYS  69 -10.061 -14.436 -10.997
    3    HB2  LYS  69           HB2      LYS  69  -9.007 -15.695 -13.525
    4    HB3  LYS  69           HB3      LYS  69  -7.962 -14.891 -12.351
    5    HG2  LYS  69           HG2      LYS  69  -8.800 -16.390 -10.575
    6    HG3  LYS  69           HG3      LYS  69  -9.843 -17.195 -11.746
    7    HD2  LYS  69           HD2      LYS  69  -7.866 -17.896 -13.039
    8    HD3  LYS  69           HD3      LYS  69  -6.815 -17.083 -11.878
    9    HE2  LYS  69           HE2      LYS  69  -7.667 -18.544 -10.079
   10    HE3  LYS  69           HE3      LYS  69  -8.714 -19.360 -11.238
   11    HZ3  LYS  69           HZ1      LYS  69  -6.770 -20.057 -12.470
   12    HZ2  LYS  69           HZ2      LYS  69  -6.655 -20.578 -10.858
   13    HZ1  LYS  69           HZ3      LYS  69  -5.749 -19.242 -11.389

  No H/Q in entry =          13
  In of MODEL   18
    1    H    VAL  70           H        VAL  70  -7.993 -13.013 -11.859
    2    HA   VAL  70           HA       VAL  70  -9.071 -10.820 -13.533
    3    HB   VAL  70           HB       VAL  70  -7.999  -9.227 -11.969
    4   HG12  VAL  70          HG11      VAL  70  -9.820 -11.005 -10.355
    5   HG11  VAL  70          HG12      VAL  70 -10.430 -10.158 -11.779
    6   HG13  VAL  70          HG13      VAL  70  -9.774  -9.242 -10.422
    7   HG23  VAL  70          HG21      VAL  70  -7.437 -10.246  -9.644
    8   HG22  VAL  70          HG22      VAL  70  -6.261 -10.472 -10.937
    9   HG21  VAL  70          HG23      VAL  70  -7.344 -11.789 -10.491

  No H/Q in entry =           9
  In of MODEL   18
    1    H    SER  71           H        SER  71  -7.362  -9.406 -14.378
    2    HA   SER  71           HA       SER  71  -5.239 -10.856 -15.600
    3    HB2  SER  71           HB2      SER  71  -6.247  -8.851 -16.633
    4    HB3  SER  71           HB3      SER  71  -5.630  -7.864 -15.311
    5    HG   SER  71           HG       SER  71  -3.511  -8.760 -15.945

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU  72           H        LEU  72  -3.131 -11.053 -15.044
    2    HA   LEU  72           HA       LEU  72  -2.415 -10.819 -12.333
    3    HB2  LEU  72           HB2      LEU  72  -0.751 -11.232 -14.813
    4    HB3  LEU  72           HB3      LEU  72  -0.094 -11.296 -13.181
    5    HG   LEU  72           HG       LEU  72  -2.420 -13.018 -14.096
    6   HD13  LEU  72          HD11      LEU  72  -0.798 -14.835 -14.335
    7   HD12  LEU  72          HD12      LEU  72   0.515 -13.750 -13.877
    8   HD11  LEU  72          HD13      LEU  72  -0.348 -13.497 -15.395
    9   HD22  LEU  72          HD21      LEU  72  -2.451 -13.035 -11.750
   10   HD21  LEU  72          HD22      LEU  72  -0.708 -12.865 -11.613
   11   HD23  LEU  72          HD23      LEU  72  -1.406 -14.406 -12.102

  No H/Q in entry =          11
  In of MODEL   18
    1    H    VAL  73           H        VAL  73  -1.724  -8.804 -15.120
    2    HA   VAL  73           HA       VAL  73   0.174  -7.076 -14.022
    3    HB   VAL  73           HB       VAL  73  -0.248  -5.662 -15.881
    4   HG12  VAL  73          HG11      VAL  73  -1.063  -8.375 -16.910
    5   HG11  VAL  73          HG12      VAL  73   0.548  -8.103 -16.249
    6   HG13  VAL  73          HG13      VAL  73   0.008  -7.190 -17.656
    7   HG23  VAL  73          HG21      VAL  73  -2.391  -6.299 -17.288
    8   HG22  VAL  73          HG22      VAL  73  -2.529  -5.201 -15.917
    9   HG21  VAL  73          HG23      VAL  73  -2.980  -6.896 -15.736

  No H/Q in entry =           9
  In of MODEL   18
    1    H    LEU  74           H        LEU  74  -3.222  -7.234 -13.466
    2    HA   LEU  74           HA       LEU  74  -3.874  -4.584 -12.863
    3    HB2  LEU  74           HB2      LEU  74  -5.583  -6.268 -13.032
    4    HB3  LEU  74           HB3      LEU  74  -4.880  -7.184 -11.701
    5    HG   LEU  74           HG       LEU  74  -5.358  -5.306 -10.161
    6   HD11  LEU  74          HD11      LEU  74  -6.406  -4.075 -12.711
    7   HD13  LEU  74          HD12      LEU  74  -5.291  -3.375 -11.539
    8   HD12  LEU  74          HD13      LEU  74  -6.997  -3.560 -11.132
    9   HD21  LEU  74          HD21      LEU  74  -7.027  -7.186 -10.981
   10   HD23  LEU  74          HD22      LEU  74  -7.887  -5.796 -11.607
   11   HD22  LEU  74          HD23      LEU  74  -7.560  -5.907  -9.895

  No H/Q in entry =          11
  In of MODEL   18
    1    H    VAL  75           H        VAL  75  -2.802  -7.149 -10.692
    2    HA   VAL  75           HA       VAL  75  -2.625  -5.587  -8.353
    3    HB   VAL  75           HB       VAL  75  -1.091  -8.064  -9.132
    4   HG12  VAL  75          HG11      VAL  75  -0.647  -8.203  -6.653
    5   HG11  VAL  75          HG12      VAL  75  -1.339  -6.597  -6.480
    6   HG13  VAL  75          HG13      VAL  75   0.137  -6.817  -7.404
    7   HG21  VAL  75          HG21      VAL  75  -3.547  -7.533  -7.421
    8   HG23  VAL  75          HG22      VAL  75  -2.744  -9.097  -7.551
    9   HG22  VAL  75          HG23      VAL  75  -3.518  -8.382  -8.967

  No H/Q in entry =           9
  In of MODEL   18
    1    H    GLU  76           H        GLU  76  -0.205  -6.326 -10.885
    2    HA   GLU  76           HA       GLU  76   1.963  -4.947  -9.731
    3    HB2  GLU  76           HB2      GLU  76   2.140  -6.438 -11.728
    4    HB3  GLU  76           HB3      GLU  76   1.281  -5.238 -12.679
    5    HG2  GLU  76           HG2      GLU  76   3.089  -3.612 -12.311
    6    HG3  GLU  76           HG3      GLU  76   3.960  -4.760 -11.313

  No H/Q in entry =           6
  In of MODEL   18
    1    H    ALA  77           H        ALA  77  -0.583  -3.786 -11.926
    2    HA   ALA  77           HA       ALA  77   0.374  -1.128 -12.110
    3    HB1  ALA  77           HB1      ALA  77  -1.216  -1.751 -13.733
    4    HB2  ALA  77           HB2      ALA  77  -2.106  -0.657 -12.675
    5    HB3  ALA  77           HB3      ALA  77  -2.328  -2.399 -12.525

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLN  78           H        GLN  78  -1.876  -2.705  -9.896
    2    HA   GLN  78           HA       GLN  78  -2.714  -0.392  -8.503
    3    HB2  GLN  78           HB2      GLN  78  -3.796  -2.664  -8.410
    4    HB3  GLN  78           HB3      GLN  78  -2.452  -3.205  -7.409
    5    HG2  GLN  78           HG2      GLN  78  -2.987  -1.478  -5.744
    6    HG3  GLN  78           HG3      GLN  78  -4.326  -0.919  -6.745
    7   HE21  GLN  78          HE21      GLN  78  -4.766  -1.914  -4.084
    8   HE22  GLN  78          HE22      GLN  78  -5.629  -3.371  -4.203

  No H/Q in entry =           8
  In of MODEL   18
    1    H    LEU  79           H        LEU  79  -0.007  -2.610  -8.043
    2    HA   LEU  79           HA       LEU  79   0.955  -1.692  -5.588
    3    HB2  LEU  79           HB2      LEU  79   1.853  -3.692  -6.648
    4    HB3  LEU  79           HB3      LEU  79   2.487  -2.736  -7.984
    5    HG   LEU  79           HG       LEU  79   4.026  -1.571  -6.483
    6   HD13  LEU  79          HD11      LEU  79   3.017  -1.332  -4.418
    7   HD12  LEU  79          HD12      LEU  79   4.113  -2.666  -4.068
    8   HD11  LEU  79          HD13      LEU  79   2.413  -2.989  -4.398
    9   HD23  LEU  79          HD21      LEU  79   5.266  -3.699  -5.571
   10   HD22  LEU  79          HD22      LEU  79   5.061  -3.509  -7.310
   11   HD21  LEU  79          HD23      LEU  79   3.997  -4.590  -6.415

  No H/Q in entry =          11
  In of MODEL   18
    1    H    HIS  80           H        HIS  80   1.813  -0.574  -8.864
    2    HA   HIS  80           HA       HIS  80   3.592   1.441  -7.947
    3    HB2  HIS  80           HB2      HIS  80   2.315   0.720 -10.529
    4    HB3  HIS  80           HB3      HIS  80   2.886   2.381 -10.363
    5    HD1  HIS  80           HD1      HIS  80   5.284   2.713 -10.884
    6    HD2  HIS  80           HD2      HIS  80   4.518  -1.205  -9.680
    7    HE1  HIS  80           HE1      HIS  80   7.492   1.467 -11.044
    8    HE2  HIS  80           HE2      HIS  80   7.036  -0.924 -10.313

  No H/Q in entry =           8
  In of MODEL   18
    1    H    LEU  81           H        LEU  81   0.187   1.549  -8.931
    2    HA   LEU  81           HA       LEU  81  -0.129   4.339  -8.610
    3    HB2  LEU  81           HB2      LEU  81  -2.111   2.065  -8.525
    4    HB3  LEU  81           HB3      LEU  81  -2.588   3.761  -8.440
    5    HG   LEU  81           HG       LEU  81  -0.876   2.628 -10.670
    6   HD12  LEU  81          HD11      LEU  81  -3.111   2.911 -11.972
    7   HD11  LEU  81          HD12      LEU  81  -3.867   2.837 -10.381
    8   HD13  LEU  81          HD13      LEU  81  -2.904   1.481 -10.963
    9   HD23  LEU  81          HD21      LEU  81  -2.003   4.752 -11.776
   10   HD22  LEU  81          HD22      LEU  81  -0.590   4.948 -10.742
   11   HD21  LEU  81          HD23      LEU  81  -2.201   5.275 -10.104

  No H/Q in entry =          11
  In of MODEL   18
    1    H    MET  82           H        MET  82  -0.751   1.650  -6.353
    2    HA   MET  82           HA       MET  82  -1.828   3.228  -4.272
    3    HB2  MET  82           HB2      MET  82  -0.415   0.562  -4.301
    4    HB3  MET  82           HB3      MET  82  -1.006   1.283  -2.806
    5    HG2  MET  82           HG2      MET  82  -2.728   0.755  -5.247
    6    HG3  MET  82           HG3      MET  82  -2.635  -0.312  -3.848
    7    HE3  MET  82           HE1      MET  82  -4.386   1.321  -1.041
    8    HE2  MET  82           HE2      MET  82  -2.660   1.624  -1.225
    9    HE1  MET  82           HE3      MET  82  -3.324   0.055  -1.674

  No H/Q in entry =           9
  In of MODEL   18
    1    H    THR  83           H        THR  83   1.489   2.190  -4.954
    2    HA   THR  83           HA       THR  83   2.687   3.320  -2.657
    3    HB   THR  83           HB       THR  83   4.784   3.291  -4.128
    4    HG1  THR  83           HG1      THR  83   4.555   2.755  -6.150
    5   HG22  THR  83          HG21      THR  83   4.381   0.626  -4.451
    6   HG21  THR  83          HG22      THR  83   3.085   0.990  -3.314
    7   HG23  THR  83          HG23      THR  83   4.758   1.360  -2.894

  No H/Q in entry =           7
  In of MODEL   18
    1    H    SER  84           H        SER  84   2.301   4.583  -5.961
    2    HA   SER  84           HA       SER  84   3.603   7.044  -5.513
    3    HB2  SER  84           HB2      SER  84   1.547   6.174  -7.532
    4    HB3  SER  84           HB3      SER  84   2.201   7.811  -7.511
    5    HG   SER  84           HG       SER  84   3.611   5.356  -7.793

  No H/Q in entry =           5
  In of MODEL   18
    1    H    MET  85           H        MET  85   0.120   6.236  -5.343
    2    HA   MET  85           HA       MET  85  -0.781   8.835  -4.751
    3    HB2  MET  85           HB2      MET  85  -2.278   7.006  -5.416
    4    HB3  MET  85           HB3      MET  85  -1.975   6.202  -3.876
    5    HG2  MET  85           HG2      MET  85  -2.895   8.143  -2.669
    6    HG3  MET  85           HG3      MET  85  -3.173   8.968  -4.201
    7    HE1  MET  85           HE1      MET  85  -4.387   6.680  -1.561
    8    HE3  MET  85           HE2      MET  85  -3.804   5.371  -2.587
    9    HE2  MET  85           HE3      MET  85  -5.532   5.557  -2.306

  No H/Q in entry =           9
  In of MODEL   18
    1    H    LEU  86           H        LEU  86   0.176   6.193  -2.598
    2    HA   LEU  86           HA       LEU  86  -0.379   7.496  -0.160
    3    HB2  LEU  86           HB2      LEU  86   0.121   5.031  -0.546
    4    HB3  LEU  86           HB3      LEU  86   1.822   5.485  -0.640
    5    HG   LEU  86           HG       LEU  86   1.478   6.649   1.624
    6   HD11  LEU  86          HD11      LEU  86  -1.204   5.842   1.152
    7   HD13  LEU  86          HD12      LEU  86  -0.551   6.603   2.601
    8   HD12  LEU  86          HD13      LEU  86  -0.616   4.846   2.487
    9   HD23  LEU  86          HD21      LEU  86   1.092   3.651   1.755
   10   HD22  LEU  86          HD22      LEU  86   2.079   4.678   2.793
   11   HD21  LEU  86          HD23      LEU  86   2.586   4.355   1.135

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ALA  87           H        ALA  87   2.608   7.238  -2.046
    2    HA   ALA  87           HA       ALA  87   4.292   8.677  -0.324
    3    HB3  ALA  87           HB1      ALA  87   4.403   7.658  -3.028
    4    HB2  ALA  87           HB2      ALA  87   5.732   8.010  -1.927
    5    HB1  ALA  87           HB3      ALA  87   5.101   9.279  -2.975

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ARG  88           H        ARG  88   2.331   9.778  -3.050
    2    HA   ARG  88           HA       ARG  88   3.069  12.478  -2.940
    3    HB2  ARG  88           HB2      ARG  88   1.832  11.303  -4.795
    4    HB3  ARG  88           HB3      ARG  88   0.373  11.430  -3.814
    5    HG2  ARG  88           HG2      ARG  88   1.357  14.024  -3.738
    6    HG3  ARG  88           HG3      ARG  88   1.790  13.511  -5.366
    7    HD2  ARG  88           HD2      ARG  88  -0.352  13.560  -6.066
    8    HD3  ARG  88           HD3      ARG  88  -0.928  12.704  -4.636
    9    HE   ARG  88           HE       ARG  88  -1.154  15.478  -5.062
   10   HH21  ARG  88          HH11      ARG  88  -1.700  16.805  -3.329
   11   HH22  ARG  88          HH12      ARG  88  -1.398  16.277  -1.709
   12   HH11  ARG  88          HH21      ARG  88  -0.111  13.236  -2.680
   13   HH12  ARG  88          HH22      ARG  88  -0.516  14.250  -1.342

  No H/Q in entry =          13
  In of MODEL   18
    1    H    GLU  89           H        GLU  89   0.387  10.774  -1.297
    2    HA   GLU  89           HA       GLU  89  -0.752  13.075  -0.100
    3    HB2  GLU  89           HB2      GLU  89  -1.841  10.821  -0.181
    4    HB3  GLU  89           HB3      GLU  89  -0.711  10.284   1.062
    5    HG2  GLU  89           HG2      GLU  89  -1.554  11.977   2.616
    6    HG3  GLU  89           HG3      GLU  89  -2.613  12.630   1.370

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LEU  90           H        LEU  90   1.728  10.817   1.082
    2    HA   LEU  90           HA       LEU  90   2.066  12.073   3.609
    3    HB2  LEU  90           HB2      LEU  90   3.862  10.316   1.938
    4    HB3  LEU  90           HB3      LEU  90   4.274  10.843   3.575
    5    HG   LEU  90           HG       LEU  90   1.656   9.463   2.916
    6   HD12  LEU  90          HD11      LEU  90   2.821   7.434   3.931
    7   HD11  LEU  90          HD12      LEU  90   4.333   8.308   3.688
    8   HD13  LEU  90          HD13      LEU  90   3.326   7.884   2.302
    9   HD22  LEU  90          HD21      LEU  90   1.379  10.389   5.035
   10   HD21  LEU  90          HD22      LEU  90   3.098  10.304   5.419
   11   HD23  LEU  90          HD23      LEU  90   2.109   8.845   5.471

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  91           H        ILE  91   3.667  12.466   0.482
    2    HA   ILE  91           HA       ILE  91   5.621  14.323   1.317
    3    HB   ILE  91           HB       ILE  91   4.317  13.810  -1.362
    4   HG12  ILE  91          HG12      ILE  91   7.155  13.359  -0.385
    5   HG13  ILE  91          HG13      ILE  91   5.887  12.147  -0.220
    6   HG22  ILE  91          HG21      ILE  91   6.524  15.181  -2.053
    7   HG21  ILE  91          HG22      ILE  91   6.204  15.982  -0.514
    8   HG23  ILE  91          HG23      ILE  91   4.982  15.993  -1.784
    9   HD13  ILE  91          HD11      ILE  91   5.719  11.815  -2.526
   10   HD12  ILE  91          HD12      ILE  91   7.450  12.079  -2.312
   11   HD11  ILE  91          HD13      ILE  91   6.425  13.388  -2.903

  No H/Q in entry =          11
  In of MODEL   18
    1    H    THR  92           H        THR  92   2.255  14.714   0.306
    2    HA   THR  92           HA       THR  92   2.196  17.536   0.238
    3    HB   THR  92           HB       THR  92   0.051  15.518   0.941
    4    HG1  THR  92           HG1      THR  92   0.359  15.338  -1.143
    5   HG22  THR  92          HG21      THR  92  -1.374  17.662   0.212
    6   HG21  THR  92          HG22      THR  92   0.008  18.505   0.908
    7   HG23  THR  92          HG23      THR  92  -0.921  17.376   1.892

  No H/Q in entry =           7
  In of MODEL   18
    1    H    GLU  93           H        GLU  93   1.672  15.237   2.898
    2    HA   GLU  93           HA       GLU  93   1.117  17.140   4.910
    3    HB2  GLU  93           HB2      GLU  93   2.461  14.432   5.155
    4    HB3  GLU  93           HB3      GLU  93   1.759  15.354   6.485
    5    HG2  GLU  93           HG2      GLU  93   0.157  14.551   4.047
    6    HG3  GLU  93           HG3      GLU  93   0.270  13.534   5.478

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LEU  94           H        LEU  94   4.141  15.690   3.767
    2    HA   LEU  94           HA       LEU  94   5.877  16.862   5.653
    3    HB2  LEU  94           HB2      LEU  94   6.292  15.892   2.825
    4    HB3  LEU  94           HB3      LEU  94   7.613  16.567   3.773
    5    HG   LEU  94           HG       LEU  94   5.898  14.355   4.913
    6   HD11  LEU  94          HD11      LEU  94   7.997  14.147   2.784
    7   HD13  LEU  94          HD12      LEU  94   6.562  13.158   3.047
    8   HD12  LEU  94          HD13      LEU  94   7.990  12.924   4.056
    9   HD23  LEU  94          HD21      LEU  94   8.093  13.847   6.069
   10   HD22  LEU  94          HD22      LEU  94   7.408  15.418   6.480
   11   HD21  LEU  94          HD23      LEU  94   8.748  15.310   5.339

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  95           H        ILE  95   4.727  18.012   2.499
    2    HA   ILE  95           HA       ILE  95   6.272  20.387   2.434
    3    HB   ILE  95           HB       ILE  95   3.637  19.670   1.128
    4   HG12  ILE  95          HG12      ILE  95   6.422  20.036  -0.008
    5   HG13  ILE  95          HG13      ILE  95   5.790  18.477   0.511
    6   HG21  ILE  95          HG21      ILE  95   5.358  22.156   0.903
    7   HG23  ILE  95          HG22      ILE  95   3.634  22.070   1.258
    8   HG22  ILE  95          HG23      ILE  95   4.223  21.671  -0.357
    9   HD13  ILE  95          HD11      ILE  95   4.233  18.378  -1.219
   10   HD12  ILE  95          HD12      ILE  95   5.573  19.209  -2.008
   11   HD11  ILE  95          HD13      ILE  95   4.189  20.130  -1.419

  No H/Q in entry =          11
  In of MODEL   18
    1    H    GLU  96           H        GLU  96   3.030  19.702   3.729
    2    HA   GLU  96           HA       GLU  96   2.379  22.344   4.472
    3    HB2  GLU  96           HB2      GLU  96   0.725  20.542   4.488
    4    HB3  GLU  96           HB3      GLU  96   1.595  19.728   5.786
    5    HG2  GLU  96           HG2      GLU  96   0.559  21.004   7.351
    6    HG3  GLU  96           HG3      GLU  96   1.079  22.482   6.550

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LEU  97           H        LEU  97   4.249  19.819   6.106
    2    HA   LEU  97           HA       LEU  97   4.590  21.178   8.573
    3    HB2  LEU  97           HB2      LEU  97   6.152  19.022   7.166
    4    HB3  LEU  97           HB3      LEU  97   6.733  19.718   8.676
    5    HG   LEU  97           HG       LEU  97   3.936  18.592   8.366
    6   HD12  LEU  97          HD11      LEU  97   4.898  16.594   9.585
    7   HD11  LEU  97          HD12      LEU  97   6.502  17.241   9.241
    8   HD13  LEU  97          HD13      LEU  97   5.438  16.768   7.916
    9   HD23  LEU  97          HD21      LEU  97   4.391  18.310  10.932
   10   HD22  LEU  97          HD22      LEU  97   3.993  19.916  10.323
   11   HD21  LEU  97          HD23      LEU  97   5.669  19.495  10.670

  No H/Q in entry =          11
  In of MODEL   18
    1    H    HIS  98           H        HIS  98   6.463  21.206   5.549
    2    HA   HIS  98           HA       HIS  98   8.598  22.811   6.445
    3    HB2  HIS  98           HB2      HIS  98   7.310  22.534   3.719
    4    HB3  HIS  98           HB3      HIS  98   8.739  23.529   4.007
    5    HD1  HIS  98           HD1      HIS  98   7.566  19.946   4.036
    6    HD2  HIS  98           HD2      HIS  98  11.124  22.082   4.458
    7    HE1  HIS  98           HE1      HIS  98   9.440  18.236   3.985
    8    HE2  HIS  98           HE2      HIS  98  11.611  19.516   4.242

  No H/Q in entry =           8
  In of MODEL   18
    1    H    GLU  99           H        GLU  99   5.370  23.608   5.265
    2    HA   GLU  99           HA       GLU  99   5.719  26.427   5.199
    3    HB2  GLU  99           HB2      GLU  99   3.853  25.235   4.071
    4    HB3  GLU  99           HB3      GLU  99   3.160  24.870   5.650
    5    HG2  GLU  99           HG2      GLU  99   2.954  27.261   6.145
    6    HG3  GLU  99           HG3      GLU  99   3.727  27.665   4.615

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LYS 100           H        LYS 100   4.610  24.187   7.727
    2    HA   LYS 100           HA       LYS 100   4.000  26.240   9.614
    3    HB2  LYS 100           HB2      LYS 100   4.606  23.296   9.969
    4    HB3  LYS 100           HB3      LYS 100   4.147  24.367  11.298
    5    HG2  LYS 100           HG2      LYS 100   2.075  24.980  10.047
    6    HG3  LYS 100           HG3      LYS 100   2.515  23.812   8.797
    7    HD2  LYS 100           HD2      LYS 100   2.455  21.995  10.464
    8    HD3  LYS 100           HD3      LYS 100   2.032  23.157  11.724
    9    HE2  LYS 100           HE2      LYS 100  -0.026  23.753  10.458
   10    HE3  LYS 100           HE3      LYS 100   0.387  22.534   9.245
   11    HZ1  LYS 100           HZ1      LYS 100   0.126  21.873  12.128
   12    HZ3  LYS 100           HZ2      LYS 100   0.123  20.815  10.796
   13    HZ2  LYS 100           HZ3      LYS 100  -1.203  21.841  11.072

  No H/Q in entry =          13
  In of MODEL   18
    1    H    LEU 101           H        LEU 101   6.943  24.472   8.788
    2    HA   LEU 101           HA       LEU 101   8.531  25.334  10.990
    3    HB2  LEU 101           HB2      LEU 101   9.138  24.346   8.215
    4    HB3  LEU 101           HB3      LEU 101  10.432  25.027   9.196
    5    HG   LEU 101           HG       LEU 101   8.622  22.856  10.264
    6   HD12  LEU 101          HD11      LEU 101  10.691  21.380   9.661
    7   HD11  LEU 101          HD12      LEU 101  11.046  22.643   8.485
    8   HD13  LEU 101          HD13      LEU 101   9.526  21.755   8.393
    9   HD21  LEU 101          HD21      LEU 101  11.334  23.993  10.991
   10   HD23  LEU 101          HD22      LEU 101  10.806  22.417  11.574
   11   HD22  LEU 101          HD23      LEU 101   9.899  23.865  12.008

  No H/Q in entry =          11
  In of MODEL   18
    1    H    LYS 102           H        LYS 102   6.931  27.176   8.843
    2    HA   LYS 102           HA       LYS 102   6.986  29.469   8.545
    3    HB2  LYS 102           HB2      LYS 102   8.549  29.375  10.645
    4    HB3  LYS 102           HB3      LYS 102   9.848  29.579   9.486
    5    HG2  LYS 102           HG2      LYS 102   7.722  31.513  10.341
    6    HG3  LYS 102           HG3      LYS 102   9.432  31.790  10.090
    7    HD2  LYS 102           HD2      LYS 102   7.487  31.341   7.790
    8    HD3  LYS 102           HD3      LYS 102   7.854  32.926   8.454
    9    HE2  LYS 102           HE2      LYS 102   9.240  31.750   6.385
   10    HE3  LYS 102           HE3      LYS 102   9.843  33.065   7.393
   11    HZ2  LYS 102           HZ1      LYS 102  11.382  31.175   7.224
   12    HZ1  LYS 102           HZ2      LYS 102  10.230  30.183   7.968
   13    HZ3  LYS 102           HZ3      LYS 102  10.908  31.479   8.825

  No H/Q in entry =          13
  In of MODEL   18
    1    H    ALA 103           H        ALA 103  10.256  28.160   7.987
    2    HA   ALA 103           HA       ALA 103  11.208  29.541   5.908
    3    HB2  ALA 103           HB1      ALA 103  12.115  27.333   4.987
    4    HB1  ALA 103           HB2      ALA 103  11.227  26.554   6.294
    5    HB3  ALA 103           HB3      ALA 103  12.505  27.712   6.665

  No H/Q in entry =           5
  In of MODEL   18
    1    H1   LYS   3           H1       LYS   3 -31.075   6.616 -19.456
    2    H2   LYS   3           H3       LYS   3 -30.096   6.337 -20.815
    3    H3   LYS   3           H2       LYS   3 -31.504   5.419 -20.580
    4    HA   LYS   3           HA       LYS   3 -30.520   3.988 -19.206
    5    HB2  LYS   3           HB2      LYS   3 -28.220   5.387 -20.521
    6    HB3  LYS   3           HB3      LYS   3 -27.911   4.151 -19.301
    7    HG2  LYS   3           HG2      LYS   3 -29.364   2.614 -20.677
    8    HG3  LYS   3           HG3      LYS   3 -29.303   3.837 -21.945
    9    HD2  LYS   3           HD2      LYS   3 -26.822   3.681 -21.906
   10    HD3  LYS   3           HD3      LYS   3 -26.959   2.363 -20.743
   11    HE2  LYS   3           HE2      LYS   3 -28.482   1.245 -22.475
   12    HE3  LYS   3           HE3      LYS   3 -27.847   2.434 -23.611
   13    HZ3  LYS   3           HZ1      LYS   3 -26.071   1.181 -23.910
   14    HZ2  LYS   3           HZ2      LYS   3 -26.716   0.004 -22.870
   15    HZ1  LYS   3           HZ3      LYS   3 -25.704   1.221 -22.253

  No H/Q in entry =          15
  In of MODEL   18
    1    H    LYS   4           H        LYS   4 -30.568   3.808 -17.149
    2    HA   LYS   4           HA       LYS   4 -29.793   6.050 -15.459
    3    HB2  LYS   4           HB2      LYS   4 -31.038   3.366 -14.804
    4    HB3  LYS   4           HB3      LYS   4 -30.789   4.679 -13.655
    5    HG2  LYS   4           HG2      LYS   4 -32.607   4.694 -16.069
    6    HG3  LYS   4           HG3      LYS   4 -33.090   4.721 -14.374
    7    HD2  LYS   4           HD2      LYS   4 -32.354   6.925 -14.069
    8    HD3  LYS   4           HD3      LYS   4 -31.321   6.876 -15.498
    9    HE2  LYS   4           HE2      LYS   4 -33.224   8.291 -15.927
   10    HE3  LYS   4           HE3      LYS   4 -33.333   6.839 -16.921
   11    HZ3  LYS   4           HZ1      LYS   4 -34.920   5.926 -15.386
   12    HZ2  LYS   4           HZ2      LYS   4 -35.450   7.441 -15.940
   13    HZ1  LYS   4           HZ3      LYS   4 -34.790   7.289 -14.382

  No H/Q in entry =          13
  In of MODEL   18
    1    H    HIS   5           H        HIS   5 -28.317   6.079 -13.871
    2    HA   HIS   5           HA       HIS   5 -26.070   4.216 -14.246
    3    HB2  HIS   5           HB2      HIS   5 -26.269   6.951 -12.987
    4    HB3  HIS   5           HB3      HIS   5 -24.805   5.969 -12.994
    5    HD1  HIS   5           HD1      HIS   5 -23.319   7.171 -14.566
    6    HD2  HIS   5           HD2      HIS   5 -27.137   6.651 -16.117
    7    HE1  HIS   5           HE1      HIS   5 -23.150   7.794 -17.007
    8    HE2  HIS   5           HE2      HIS   5 -25.477   7.464 -17.921

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ILE   6           H        ILE   6 -25.866   2.614 -12.959
    2    HA   ILE   6           HA       ILE   6 -26.826   2.848 -10.187
    3    HB   ILE   6           HB       ILE   6 -26.054   0.396 -11.773
    4   HG12  ILE   6          HG12      ILE   6 -28.776   1.369 -10.894
    5   HG13  ILE   6          HG13      ILE   6 -28.136   1.549 -12.528
    6   HG23  ILE   6          HG21      ILE   6 -26.445  -0.883  -9.935
    7   HG22  ILE   6          HG22      ILE   6 -27.577   0.271  -9.230
    8   HG21  ILE   6          HG23      ILE   6 -25.841   0.572  -9.142
    9   HD13  ILE   6          HD11      ILE   6 -28.638  -0.551 -13.066
   10   HD12  ILE   6          HD12      ILE   6 -29.648  -0.542 -11.620
   11   HD11  ILE   6          HD13      ILE   6 -28.006  -1.183 -11.545

  No H/Q in entry =          11
  In of MODEL   18
    1    H    TYR   7           H        TYR   7 -25.050   3.432  -8.895
    2    HA   TYR   7           HA       TYR   7 -22.361   2.434  -9.604
    3    HB2  TYR   7           HB2      TYR   7 -23.271   4.859  -8.074
    4    HB3  TYR   7           HB3      TYR   7 -21.597   4.312  -8.129
    5    HD1  TYR   7           HD1      TYR   7 -22.666   3.448 -11.232
    6    HD2  TYR   7           HD2      TYR   7 -21.918   6.964  -8.942
    7    HE1  TYR   7           HE1      TYR   7 -22.217   4.707 -13.302
    8    HE2  TYR   7           HE2      TYR   7 -21.511   8.230 -11.003
    9    HH   TYR   7           HH       TYR   7 -21.739   8.189 -13.235

  No H/Q in entry =           9
  In of MODEL   18
    1    H    LEU   8           H        LEU   8 -21.417   1.039  -8.304
    2    HA   LEU   8           HA       LEU   8 -22.547   0.516  -5.625
    3    HB2  LEU   8           HB2      LEU   8 -20.884  -1.145  -7.497
    4    HB3  LEU   8           HB3      LEU   8 -21.071  -1.555  -5.792
    5    HG   LEU   8           HG       LEU   8 -23.556  -1.670  -6.208
    6   HD13  LEU   8          HD11      LEU   8 -23.670  -0.413  -8.294
    7   HD12  LEU   8          HD12      LEU   8 -24.234  -2.062  -8.564
    8   HD11  LEU   8          HD13      LEU   8 -22.618  -1.586  -9.085
    9   HD23  LEU   8          HD21      LEU   8 -22.328  -3.705  -7.944
   10   HD22  LEU   8          HD22      LEU   8 -23.414  -3.876  -6.565
   11   HD21  LEU   8          HD23      LEU   8 -21.699  -3.562  -6.303

  No H/Q in entry =          11
  In of MODEL   18
    1    H    PHE   9           H        PHE   9 -21.263   0.868  -3.840
    2    HA   PHE   9           HA       PHE   9 -18.461   1.753  -4.351
    3    HB2  PHE   9           HB2      PHE   9 -20.444   2.827  -2.348
    4    HB3  PHE   9           HB3      PHE   9 -18.730   3.217  -2.344
    5    HD1  PHE   9           HD1      PHE   9 -17.737   4.569  -4.110
    6    HD2  PHE   9           HD2      PHE   9 -21.933   3.673  -4.106
    7    HE1  PHE   9           HE1      PHE   9 -18.110   6.300  -5.843
    8    HE2  PHE   9           HE2      PHE   9 -22.307   5.416  -5.832
    9    HZ   PHE   9           HZ       PHE   9 -20.393   6.726  -6.706

  No H/Q in entry =           9
  In of MODEL   18
    1    H    SER  10           H        SER  10 -16.903   0.735  -3.296
    2    HA   SER  10           HA       SER  10 -17.084  -0.203  -0.613
    3    HB2  SER  10           HB2      SER  10 -18.345  -2.030  -1.704
    4    HB3  SER  10           HB3      SER  10 -16.989  -2.297  -2.786
    5    HG   SER  10           HG       SER  10 -16.322  -2.219  -0.132

  No H/Q in entry =           5
  In of MODEL   18
    1    H    SER  11           H        SER  11 -15.059  -0.068   0.182
    2    HA   SER  11           HA       SER  11 -12.898   0.782  -1.368
    3    HB2  SER  11           HB2      SER  11 -13.346   0.815   1.226
    4    HB3  SER  11           HB3      SER  11 -12.389  -0.667   1.182
    5    HG   SER  11           HG       SER  11 -11.659   1.874   0.128

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA  12           H        ALA  12 -14.125  -1.919  -2.185
    2    HA   ALA  12           HA       ALA  12 -11.549  -3.133  -2.799
    3    HB1  ALA  12           HB1      ALA  12 -13.687  -4.972  -1.766
    4    HB3  ALA  12           HB2      ALA  12 -12.564  -4.196  -0.650
    5    HB2  ALA  12           HB3      ALA  12 -11.951  -5.254  -1.920

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLY  13           H        GLY  13 -12.257  -2.163  -4.815
    2    HA3  GLY  13           HA2      GLY  13 -14.539  -2.734  -6.273
    3    HA2  GLY  13           HA3      GLY  13 -12.969  -2.369  -7.004

  No H/Q in entry =           3
  In of MODEL   18
    1    H    MET  14           H        MET  14 -11.543  -4.699  -6.179
    2    HA   MET  14           HA       MET  14 -12.111  -6.415  -8.277
    3    HB2  MET  14           HB2      MET  14  -9.983  -6.571  -7.087
    4    HB3  MET  14           HB3      MET  14 -10.789  -7.234  -5.667
    5    HG2  MET  14           HG2      MET  14 -11.511  -9.190  -7.012
    6    HG3  MET  14           HG3      MET  14 -10.689  -8.518  -8.420
    7    HE1  MET  14           HE1      MET  14  -8.480  -8.033  -8.697
    8    HE3  MET  14           HE2      MET  14  -7.084  -8.765  -7.909
    9    HE2  MET  14           HE3      MET  14  -7.836  -7.338  -7.201

  No H/Q in entry =           9
  In of MODEL   18
    1    H    SER  15           H        SER  15 -13.194  -6.902  -4.903
    2    HA   SER  15           HA       SER  15 -14.612  -9.314  -5.579
    3    HB2  SER  15           HB2      SER  15 -13.939  -8.879  -3.232
    4    HB3  SER  15           HB3      SER  15 -15.063  -7.524  -3.177
    5    HG   SER  15           HG       SER  15 -16.745  -8.882  -3.249

  No H/Q in entry =           5
  In of MODEL   18
    1    H    THR  16           H        THR  16 -15.653  -5.918  -5.125
    2    HA   THR  16           HA       THR  16 -18.451  -6.398  -5.634
    3    HB   THR  16           HB       THR  16 -16.887  -3.836  -6.108
    4    HG1  THR  16           HG1      THR  16 -16.938  -5.126  -3.909
    5   HG21  THR  16          HG21      THR  16 -19.327  -4.116  -6.870
    6   HG23  THR  16          HG22      THR  16 -18.972  -2.734  -5.818
    7   HG22  THR  16          HG23      THR  16 -19.726  -4.193  -5.158

  No H/Q in entry =           7
  In of MODEL   18
    1    H    SER  17           H        SER  17 -15.635  -5.843  -7.497
    2    HA   SER  17           HA       SER  17 -16.754  -5.036  -9.981
    3    HB2  SER  17           HB2      SER  17 -14.150  -6.425  -9.317
    4    HB3  SER  17           HB3      SER  17 -14.588  -5.936 -10.953
    5    HG   SER  17           HG       SER  17 -13.652  -4.449  -8.885

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU  18           H        LEU  18 -16.242  -8.216  -8.592
    2    HA   LEU  18           HA       LEU  18 -16.862  -9.662 -10.972
    3    HB2  LEU  18           HB2      LEU  18 -15.656 -10.675  -9.085
    4    HB3  LEU  18           HB3      LEU  18 -17.086 -10.482  -8.071
    5    HG   LEU  18           HG       LEU  18 -18.327 -11.952  -9.682
    6   HD11  LEU  18          HD11      LEU  18 -15.559 -12.115 -10.853
    7   HD13  LEU  18          HD12      LEU  18 -17.091 -11.831 -11.679
    8   HD12  LEU  18          HD13      LEU  18 -16.712 -13.434 -11.050
    9   HD23  LEU  18          HD21      LEU  18 -15.916 -13.228  -8.431
   10   HD22  LEU  18          HD22      LEU  18 -17.482 -13.973  -8.765
   11   HD21  LEU  18          HD23      LEU  18 -17.351 -12.708  -7.543

  No H/Q in entry =          11
  In of MODEL   18
    1    H    LEU  19           H        LEU  19 -18.802  -8.467  -8.234
    2    HA   LEU  19           HA       LEU  19 -21.289  -9.589  -9.082
    3    HB2  LEU  19           HB2      LEU  19 -21.003  -8.804  -6.816
    4    HB3  LEU  19           HB3      LEU  19 -20.681  -7.169  -7.391
    5    HG   LEU  19           HG       LEU  19 -23.006  -6.936  -8.085
    6   HD11  LEU  19          HD11      LEU  19 -23.318  -9.725  -6.963
    7   HD13  LEU  19          HD12      LEU  19 -23.511  -9.250  -8.649
    8   HD12  LEU  19          HD13      LEU  19 -24.648  -8.668  -7.435
    9   HD21  LEU  19          HD21      LEU  19 -22.560  -7.852  -5.254
   10   HD23  LEU  19          HD22      LEU  19 -24.009  -7.013  -5.808
   11   HD22  LEU  19          HD23      LEU  19 -22.440  -6.211  -5.886

  No H/Q in entry =          11
  In of MODEL   18
    1    H    VAL  20           H        VAL  20 -19.735  -6.444  -9.723
    2    HA   VAL  20           HA       VAL  20 -21.831  -5.334 -11.267
    3    HB   VAL  20           HB       VAL  20 -18.833  -4.795 -11.347
    4   HG11  VAL  20          HG11      VAL  20 -21.073  -3.556 -12.940
    5   HG13  VAL  20          HG12      VAL  20 -19.508  -4.137 -13.510
    6   HG12  VAL  20          HG13      VAL  20 -19.606  -2.652 -12.564
    7   HG23  VAL  20          HG21      VAL  20 -19.563  -2.642 -10.313
    8   HG22  VAL  20          HG22      VAL  20 -19.826  -4.069  -9.312
    9   HG21  VAL  20          HG23      VAL  20 -21.180  -3.331 -10.167

  No H/Q in entry =           9
  In of MODEL   18
    1    H    SER  21           H        SER  21 -19.114  -7.417 -12.339
    2    HA   SER  21           HA       SER  21 -19.904  -7.240 -15.085
    3    HB2  SER  21           HB2      SER  21 -18.506  -9.227 -15.459
    4    HB3  SER  21           HB3      SER  21 -17.651  -8.015 -14.508
    5    HG   SER  21           HG       SER  21 -18.143  -9.203 -12.658

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LYS  22           H        LYS  22 -21.004  -9.452 -12.551
    2    HA   LYS  22           HA       LYS  22 -22.577 -11.009 -14.397
    3    HB2  LYS  22           HB2      LYS  22 -22.856 -10.706 -11.404
    4    HB3  LYS  22           HB3      LYS  22 -23.688 -11.902 -12.397
    5    HG2  LYS  22           HG2      LYS  22 -20.695 -11.742 -12.084
    6    HG3  LYS  22           HG3      LYS  22 -21.742 -12.799 -11.139
    7    HD2  LYS  22           HD2      LYS  22 -22.477 -13.905 -13.209
    8    HD3  LYS  22           HD3      LYS  22 -21.399 -12.863 -14.138
    9    HE2  LYS  22           HE2      LYS  22 -19.461 -13.810 -12.971
   10    HE3  LYS  22           HE3      LYS  22 -20.529 -14.835 -12.011
   11    HZ3  LYS  22           HZ1      LYS  22 -21.069 -16.120 -13.858
   12    HZ2  LYS  22           HZ2      LYS  22 -19.391 -15.885 -13.982
   13    HZ1  LYS  22           HZ3      LYS  22 -20.449 -14.985 -14.960

  No H/Q in entry =          13
  In of MODEL   18
    1    H    MET  23           H        MET  23 -23.240  -8.108 -12.473
    2    HA   MET  23           HA       MET  23 -26.049  -8.122 -12.973
    3    HB2  MET  23           HB2      MET  23 -24.155  -5.862 -12.363
    4    HB3  MET  23           HB3      MET  23 -25.897  -5.655 -12.533
    5    HG2  MET  23           HG2      MET  23 -26.310  -6.987 -10.587
    6    HG3  MET  23           HG3      MET  23 -24.607  -7.434 -10.474
    7    HE2  MET  23           HE1      MET  23 -26.829  -3.760  -9.211
    8    HE1  MET  23           HE2      MET  23 -27.107  -4.696 -10.679
    9    HE3  MET  23           HE3      MET  23 -26.043  -3.290 -10.720

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ARG  24           H        ARG  24 -23.272  -6.716 -14.738
    2    HA   ARG  24           HA       ARG  24 -24.747  -5.349 -16.709
    3    HB2  ARG  24           HB2      ARG  24 -21.955  -6.543 -16.783
    4    HB3  ARG  24           HB3      ARG  24 -22.615  -5.587 -18.086
    5    HG2  ARG  24           HG2      ARG  24 -22.487  -4.427 -15.288
    6    HG3  ARG  24           HG3      ARG  24 -21.068  -4.393 -16.368
    7    HD2  ARG  24           HD2      ARG  24 -22.444  -3.319 -18.137
    8    HD3  ARG  24           HD3      ARG  24 -23.828  -3.353 -17.052
    9    HE   ARG  24           HE       ARG  24 -23.185  -1.500 -16.030
   10   HH21  ARG  24          HH11      ARG  24 -22.310   0.470 -16.665
   11   HH22  ARG  24          HH12      ARG  24 -20.657   0.552 -17.167
   12   HH11  ARG  24          HH21      ARG  24 -20.384  -2.976 -17.227
   13   HH12  ARG  24          HH22      ARG  24 -19.524  -1.491 -17.486

  No H/Q in entry =          13
  In of MODEL   18
    1    H    ALA  25           H        ALA  25 -23.695  -8.714 -16.499
    2    HA   ALA  25           HA       ALA  25 -24.347  -9.482 -19.149
    3    HB1  ALA  25           HB1      ALA  25 -23.692 -11.541 -18.494
    4    HB3  ALA  25           HB2      ALA  25 -24.746 -11.525 -17.080
    5    HB2  ALA  25           HB3      ALA  25 -23.174 -10.732 -17.016

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLN  26           H        GLN  26 -26.167  -9.539 -16.122
    2    HA   GLN  26           HA       GLN  26 -28.538 -10.672 -17.156
    3    HB2  GLN  26           HB2      GLN  26 -27.983  -8.982 -14.737
    4    HB3  GLN  26           HB3      GLN  26 -29.561  -9.665 -15.097
    5    HG2  GLN  26           HG2      GLN  26 -27.006 -11.185 -14.663
    6    HG3  GLN  26           HG3      GLN  26 -28.362 -11.075 -13.548
    7   HE21  GLN  26          HE21      GLN  26 -27.195 -13.240 -14.869
    8   HE22  GLN  26          HE22      GLN  26 -28.262 -14.249 -15.682

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ALA  27           H        ALA  27 -27.529  -7.303 -16.701
    2    HA   ALA  27           HA       ALA  27 -29.996  -6.141 -17.457
    3    HB1  ALA  27           HB1      ALA  27 -28.156  -4.888 -16.321
    4    HB3  ALA  27           HB2      ALA  27 -28.733  -4.081 -17.780
    5    HB2  ALA  27           HB3      ALA  27 -27.216  -4.980 -17.812

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLU  28           H        GLU  28 -27.327  -7.386 -19.356
    2    HA   GLU  28           HA       GLU  28 -28.244  -6.277 -21.852
    3    HB2  GLU  28           HB2      GLU  28 -25.879  -7.024 -21.248
    4    HB3  GLU  28           HB3      GLU  28 -26.461  -8.671 -21.481
    5    HG2  GLU  28           HG2      GLU  28 -25.302  -7.881 -23.437
    6    HG3  GLU  28           HG3      GLU  28 -27.008  -8.160 -23.788

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LYS  29           H        LYS  29 -28.474  -9.410 -20.257
    2    HA   LYS  29           HA       LYS  29 -29.814 -10.812 -22.288
    3    HB2  LYS  29           HB2      LYS  29 -28.782 -11.858 -20.306
    4    HB3  LYS  29           HB3      LYS  29 -30.036 -11.143 -19.294
    5    HG2  LYS  29           HG2      LYS  29 -31.729 -12.457 -20.385
    6    HG3  LYS  29           HG3      LYS  29 -30.547 -13.096 -21.524
    7    HD2  LYS  29           HD2      LYS  29 -29.426 -14.321 -19.818
    8    HD3  LYS  29           HD3      LYS  29 -30.312 -13.486 -18.544
    9    HE2  LYS  29           HE2      LYS  29 -31.116 -15.810 -18.952
   10    HE3  LYS  29           HE3      LYS  29 -32.368 -14.586 -19.167
   11    HZ1  LYS  29           HZ1      LYS  29 -31.811 -14.683 -21.598
   12    HZ3  LYS  29           HZ2      LYS  29 -32.561 -16.067 -20.960
   13    HZ2  LYS  29           HZ3      LYS  29 -30.891 -16.068 -21.261

  No H/Q in entry =          13
  In of MODEL   18
    1    H    TYR  30           H        TYR  30 -31.154  -8.728 -19.738
    2    HA   TYR  30           HA       TYR  30 -33.829  -9.093 -20.981
    3    HB2  TYR  30           HB2      TYR  30 -33.145  -8.009 -18.239
    4    HB3  TYR  30           HB3      TYR  30 -34.769  -8.218 -18.893
    5    HD1  TYR  30           HD1      TYR  30 -35.730 -10.485 -19.151
    6    HD2  TYR  30           HD2      TYR  30 -31.876  -9.881 -17.443
    7    HE1  TYR  30           HE1      TYR  30 -35.689 -12.830 -18.401
    8    HE2  TYR  30           HE2      TYR  30 -31.836 -12.211 -16.697
    9    HH   TYR  30           HH       TYR  30 -33.529 -14.513 -17.833

  No H/Q in entry =           9
  In of MODEL   18
    1    H    GLU  31           H        GLU  31 -31.622  -7.133 -21.747
    2    HA   GLU  31           HA       GLU  31 -31.503  -4.961 -22.526
    3    HB2  GLU  31           HB2      GLU  31 -34.414  -5.604 -23.046
    4    HB3  GLU  31           HB3      GLU  31 -33.545  -4.241 -23.749
    5    HG2  GLU  31           HG2      GLU  31 -32.107  -5.685 -24.973
    6    HG3  GLU  31           HG3      GLU  31 -32.700  -7.104 -24.112

  No H/Q in entry =           6
  In of MODEL   18
    1    H    VAL  32           H        VAL  32 -31.694  -4.911 -19.791
    2    HA   VAL  32           HA       VAL  32 -33.510  -2.774 -19.085
    3    HB   VAL  32           HB       VAL  32 -31.136  -3.849 -17.531
    4   HG12  VAL  32          HG11      VAL  32 -32.650  -3.032 -15.616
    5   HG11  VAL  32          HG12      VAL  32 -33.466  -2.085 -16.859
    6   HG13  VAL  32          HG13      VAL  32 -31.753  -1.825 -16.537
    7   HG21  VAL  32          HG21      VAL  32 -32.941  -5.518 -18.250
    8   HG23  VAL  32          HG22      VAL  32 -33.961  -4.693 -17.070
    9   HG22  VAL  32          HG23      VAL  32 -32.458  -5.459 -16.554

  No H/Q in entry =           9
  In of MODEL   18
    1    HA   PRO  33           HA       PRO  33 -30.422   0.125 -20.706
    2    HB2  PRO  33           HB2      PRO  33 -31.887   2.375 -20.534
    3    HB3  PRO  33           HB3      PRO  33 -32.384   1.106 -21.653
    4    HG2  PRO  33           HG2      PRO  33 -33.336   1.584 -18.827
    5    HG3  PRO  33           HG3      PRO  33 -34.307   1.425 -20.290
    6    HD2  PRO  33           HD2      PRO  33 -33.890  -0.690 -18.669
    7    HD3  PRO  33           HD3      PRO  33 -33.961  -0.895 -20.419

  No H/Q in entry =           7
  In of MODEL   18
    1    H    VAL  34           H        VAL  34 -29.165  -0.484 -18.773
    2    HA   VAL  34           HA       VAL  34 -28.829   1.900 -17.076
    3    HB   VAL  34           HB       VAL  34 -28.273   0.388 -15.170
    4   HG12  VAL  34          HG11      VAL  34 -30.701  -0.444 -14.874
    5   HG11  VAL  34          HG12      VAL  34 -31.006   0.355 -16.416
    6   HG13  VAL  34          HG13      VAL  34 -30.431   1.291 -15.037
    7   HG21  VAL  34          HG21      VAL  34 -28.503  -1.593 -17.219
    8   HG23  VAL  34          HG22      VAL  34 -29.565  -1.961 -15.858
    9   HG22  VAL  34          HG23      VAL  34 -27.840  -1.714 -15.589

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ILE  35           H        ILE  35 -26.843   2.278 -16.232
    2    HA   ILE  35           HA       ILE  35 -24.567   0.930 -17.529
    3    HB   ILE  35           HB       ILE  35 -24.908   3.810 -16.657
    4   HG12  ILE  35          HG12      ILE  35 -23.958   2.537 -19.230
    5   HG13  ILE  35          HG13      ILE  35 -25.575   3.183 -18.954
    6   HG21  ILE  35          HG21      ILE  35 -22.377   2.234 -17.005
    7   HG23  ILE  35          HG22      ILE  35 -22.806   3.396 -15.751
    8   HG22  ILE  35          HG23      ILE  35 -22.416   3.956 -17.376
    9   HD11  ILE  35          HD11      ILE  35 -24.129   5.338 -18.312
   10   HD13  ILE  35          HD12      ILE  35 -24.677   4.999 -19.954
   11   HD12  ILE  35          HD13      ILE  35 -23.032   4.587 -19.471

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ILE  36           H        ILE  36 -23.353  -0.150 -15.954
    2    HA   ILE  36           HA       ILE  36 -23.775   0.414 -13.070
    3    HB   ILE  36           HB       ILE  36 -23.003  -2.281 -14.237
    4   HG12  ILE  36          HG12      ILE  36 -25.792  -1.436 -13.448
    5   HG13  ILE  36          HG13      ILE  36 -25.225  -1.393 -15.118
    6   HG23  ILE  36          HG21      ILE  36 -23.366  -3.146 -12.140
    7   HG22  ILE  36          HG22      ILE  36 -24.466  -1.851 -11.671
    8   HG21  ILE  36          HG23      ILE  36 -22.730  -1.551 -11.739
    9   HD13  ILE  36          HD11      ILE  36 -25.433  -3.598 -15.369
   10   HD12  ILE  36          HD12      ILE  36 -26.493  -3.485 -13.965
   11   HD11  ILE  36          HD13      ILE  36 -24.802  -3.942 -13.758

  No H/Q in entry =          11
  In of MODEL   18
    1    H    GLU  37           H        GLU  37 -21.979   0.985 -11.958
    2    HA   GLU  37           HA       GLU  37 -19.307   0.156 -12.898
    3    HB2  GLU  37           HB2      GLU  37 -20.157   2.948 -12.146
    4    HB3  GLU  37           HB3      GLU  37 -18.475   2.429 -12.274
    5    HG2  GLU  37           HG2      GLU  37 -18.745   2.035 -14.637
    6    HG3  GLU  37           HG3      GLU  37 -20.454   2.456 -14.535

  No H/Q in entry =           6
  In of MODEL   18
    1    H    ALA  38           H        ALA  38 -17.821  -0.144 -11.225
    2    HA   ALA  38           HA       ALA  38 -18.841  -0.004  -8.448
    3    HB1  ALA  38           HB1      ALA  38 -17.169  -1.945  -9.918
    4    HB3  ALA  38           HB2      ALA  38 -18.219  -2.189  -8.522
    5    HB2  ALA  38           HB3      ALA  38 -16.594  -1.542  -8.300

  No H/Q in entry =           5
  In of MODEL   18
    1    H    PHE  39           H        PHE  39 -17.575   1.152  -6.953
    2    HA   PHE  39           HA       PHE  39 -15.032   2.326  -7.832
    3    HB2  PHE  39           HB2      PHE  39 -17.414   3.836  -6.778
    4    HB3  PHE  39           HB3      PHE  39 -15.774   4.473  -6.682
    5    HD1  PHE  39           HD1      PHE  39 -14.462   4.491  -8.946
    6    HD2  PHE  39           HD2      PHE  39 -18.709   4.371  -8.586
    7    HE1  PHE  39           HE1      PHE  39 -14.671   5.414 -11.236
    8    HE2  PHE  39           HE2      PHE  39 -18.934   5.286 -10.867
    9    HZ   PHE  39           HZ       PHE  39 -16.921   5.782 -12.212

  No H/Q in entry =           9
  In of MODEL   18
    1    HA   PRO  40           HA       PRO  40 -14.096   1.467  -3.564
    2    HB2  PRO  40           HB2      PRO  40 -12.293   3.439  -2.922
    3    HB3  PRO  40           HB3      PRO  40 -11.875   2.120  -4.016
    4    HG2  PRO  40           HG2      PRO  40 -12.852   4.887  -4.706
    5    HG3  PRO  40           HG3      PRO  40 -11.443   4.032  -5.334
    6    HD2  PRO  40           HD2      PRO  40 -13.671   4.015  -6.736
    7    HD3  PRO  40           HD3      PRO  40 -12.741   2.526  -6.579

  No H/Q in entry =           7
  In of MODEL   18
    1    H    GLU  41           H        GLU  41 -14.696   2.411  -1.413
    2    HA   GLU  41           HA       GLU  41 -16.910   4.151  -1.355
    3    HB2  GLU  41           HB2      GLU  41 -16.759   4.027   1.021
    4    HB3  GLU  41           HB3      GLU  41 -16.306   2.445   0.387
    5    HG2  GLU  41           HG2      GLU  41 -13.934   3.006   0.730
    6    HG3  GLU  41           HG3      GLU  41 -14.415   4.561   1.409

  No H/Q in entry =           6
  In of MODEL   18
    1    H    THR  42           H        THR  42 -13.564   5.013  -1.397
    2    HA   THR  42           HA       THR  42 -13.871   7.554  -0.132
    3    HB   THR  42           HB       THR  42 -11.708   8.114  -1.219
    4    HG1  THR  42           HG1      THR  42 -12.432   5.858  -2.688
    5   HG23  THR  42          HG21      THR  42 -11.684   6.835   0.868
    6   HG22  THR  42          HG22      THR  42 -10.386   6.286  -0.194
    7   HG21  THR  42          HG23      THR  42 -11.859   5.331  -0.034

  No H/Q in entry =           7
  In of MODEL   18
    1    H    LEU  43           H        LEU  43 -14.801   6.539  -3.252
    2    HA   LEU  43           HA       LEU  43 -15.011   9.335  -4.164
    3    HB2  LEU  43           HB2      LEU  43 -15.427   6.725  -5.612
    4    HB3  LEU  43           HB3      LEU  43 -15.603   8.323  -6.333
    5    HG   LEU  43           HG       LEU  43 -13.015   7.153  -5.342
    6   HD13  LEU  43          HD11      LEU  43 -12.495   6.580  -7.519
    7   HD12  LEU  43          HD12      LEU  43 -13.681   7.691  -8.205
    8   HD11  LEU  43          HD13      LEU  43 -14.213   6.185  -7.457
    9   HD21  LEU  43          HD21      LEU  43 -13.769   9.730  -6.712
   10   HD23  LEU  43          HD22      LEU  43 -12.124   9.092  -6.740
   11   HD22  LEU  43          HD23      LEU  43 -12.882   9.511  -5.204

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ALA  44           H        ALA  44 -16.982   7.504  -2.343
    2    HA   ALA  44           HA       ALA  44 -19.465   7.432  -3.660
    3    HB3  ALA  44           HB1      ALA  44 -19.340   6.271  -1.588
    4    HB2  ALA  44           HB2      ALA  44 -20.424   7.628  -1.285
    5    HB1  ALA  44           HB3      ALA  44 -18.750   7.697  -0.735

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLY  45           H        GLY  45 -17.995  10.177  -2.076
    2    HA3  GLY  45           HA2      GLY  45 -20.408  11.723  -2.399
    3    HA2  GLY  45           HA3      GLY  45 -18.852  12.310  -1.814

  No H/Q in entry =           3
  In of MODEL   18
    1    H    GLU  46           H        GLU  46 -17.343  11.395  -4.127
    2    HA   GLU  46           HA       GLU  46 -17.947  13.657  -5.849
    3    HB2  GLU  46           HB2      GLU  46 -15.625  13.055  -5.212
    4    HB3  GLU  46           HB3      GLU  46 -15.811  11.531  -6.079
    5    HG2  GLU  46           HG2      GLU  46 -16.066  12.724  -8.172
    6    HG3  GLU  46           HG3      GLU  46 -15.960  14.268  -7.325

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LYS  47           H        LYS  47 -17.887  10.146  -6.356
    2    HA   LYS  47           HA       LYS  47 -18.987  10.438  -9.024
    3    HB2  LYS  47           HB2      LYS  47 -17.854   8.283  -7.388
    4    HB3  LYS  47           HB3      LYS  47 -19.234   7.785  -8.366
    5    HG2  LYS  47           HG2      LYS  47 -17.179   7.368  -9.550
    6    HG3  LYS  47           HG3      LYS  47 -18.099   8.633 -10.363
    7    HD2  LYS  47           HD2      LYS  47 -16.721  10.337  -9.275
    8    HD3  LYS  47           HD3      LYS  47 -15.801   9.073  -8.461
    9    HE2  LYS  47           HE2      LYS  47 -16.020   9.347 -11.451
   10    HE3  LYS  47           HE3      LYS  47 -14.692   9.996 -10.489
   11    HZ2  LYS  47           HZ1      LYS  47 -14.587   7.628 -11.573
   12    HZ1  LYS  47           HZ2      LYS  47 -15.383   7.183 -10.141
   13    HZ3  LYS  47           HZ3      LYS  47 -13.869   7.950 -10.067

  No H/Q in entry =          13
  In of MODEL   18
    1    H    GLY  48           H        GLY  48 -20.315   9.640  -5.887
    2    HA3  GLY  48           HA2      GLY  48 -22.722   8.509  -6.645
    3    HA2  GLY  48           HA3      GLY  48 -22.476   9.470  -5.187

  No H/Q in entry =           3
  In of MODEL   18
    1    H    GLN  49           H        GLN  49 -21.857  11.914  -6.710
    2    HA   GLN  49           HA       GLN  49 -24.398  13.070  -6.825
    3    HB2  GLN  49           HB2      GLN  49 -21.844  13.919  -8.174
    4    HB3  GLN  49           HB3      GLN  49 -23.289  14.907  -8.067
    5    HG2  GLN  49           HG2      GLN  49 -23.124  14.879  -5.630
    6    HG3  GLN  49           HG3      GLN  49 -21.691  13.870  -5.737
    7   HE21  GLN  49          HE21      GLN  49 -21.534  16.071  -4.420
    8   HE22  GLN  49          HE22      GLN  49 -20.592  17.324  -5.044

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ASN  50           H        ASN  50 -22.756  11.212  -9.255
    2    HA   ASN  50           HA       ASN  50 -24.630  12.157 -11.313
    3    HB2  ASN  50           HB2      ASN  50 -22.077  10.580 -11.585
    4    HB3  ASN  50           HB3      ASN  50 -23.123  11.049 -12.917
    5   HD21  ASN  50          HD21      ASN  50 -20.469  11.819 -11.296
    6   HD22  ASN  50          HD22      ASN  50 -20.209  13.457 -11.607

  No H/Q in entry =           6
  In of MODEL   18
    1    H    ALA  51           H        ALA  51 -24.650   9.756  -9.115
    2    HA   ALA  51           HA       ALA  51 -25.475   7.662 -10.983
    3    HB2  ALA  51           HB1      ALA  51 -24.910   6.269  -9.325
    4    HB3  ALA  51           HB2      ALA  51 -26.016   7.073  -8.213
    5    HB1  ALA  51           HB3      ALA  51 -24.367   7.671  -8.403

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ASP  52           H        ASP  52 -27.498   6.638 -10.858
    2    HA   ASP  52           HA       ASP  52 -29.645   8.496 -10.149
    3    HB2  ASP  52           HB2      ASP  52 -29.502   6.021 -11.871
    4    HB3  ASP  52           HB3      ASP  52 -31.032   6.772 -11.417

  No H/Q in entry =           4
  In of MODEL   18
    1    H    VAL  53           H        VAL  53 -28.092   5.559  -9.196
    2    HA   VAL  53           HA       VAL  53 -29.524   5.660  -6.674
    3    HB   VAL  53           HB       VAL  53 -30.955   4.069  -7.947
    4   HG11  VAL  53          HG11      VAL  53 -29.228   3.210  -9.491
    5   HG13  VAL  53          HG12      VAL  53 -30.081   1.912  -8.655
    6   HG12  VAL  53          HG13      VAL  53 -28.462   2.376  -8.140
    7   HG23  VAL  53          HG21      VAL  53 -30.164   2.043  -6.297
    8   HG22  VAL  53          HG22      VAL  53 -31.268   3.360  -5.901
    9   HG21  VAL  53          HG23      VAL  53 -29.558   3.494  -5.496

  No H/Q in entry =           9
  In of MODEL   18
    1    H    VAL  54           H        VAL  54 -28.215   5.171  -5.033
    2    HA   VAL  54           HA       VAL  54 -25.472   4.284  -5.669
    3    HB   VAL  54           HB       VAL  54 -26.504   6.036  -3.381
    4   HG11  VAL  54          HG11      VAL  54 -23.953   4.576  -3.708
    5   HG13  VAL  54          HG12      VAL  54 -24.689   5.239  -2.250
    6   HG12  VAL  54          HG13      VAL  54 -23.768   6.288  -3.327
    7   HG22  VAL  54          HG21      VAL  54 -25.615   7.856  -4.445
    8   HG21  VAL  54          HG22      VAL  54 -26.183   6.903  -5.816
    9   HG23  VAL  54          HG23      VAL  54 -24.475   6.888  -5.382

  No H/Q in entry =           9
  In of MODEL   18
    1    H    LEU  55           H        LEU  55 -24.914   2.339  -5.066
    2    HA   LEU  55           HA       LEU  55 -26.439   1.012  -2.914
    3    HB2  LEU  55           HB2      LEU  55 -24.910  -0.137  -5.237
    4    HB3  LEU  55           HB3      LEU  55 -25.686  -1.083  -3.965
    5    HG   LEU  55           HG       LEU  55 -27.098   0.574  -6.046
    6   HD13  LEU  55          HD11      LEU  55 -26.836  -1.259  -7.303
    7   HD12  LEU  55          HD12      LEU  55 -27.805  -2.140  -6.123
    8   HD11  LEU  55          HD13      LEU  55 -26.049  -2.112  -5.976
    9   HD23  LEU  55          HD21      LEU  55 -28.424  -1.385  -4.227
   10   HD22  LEU  55          HD22      LEU  55 -29.096   0.026  -5.043
   11   HD21  LEU  55          HD23      LEU  55 -28.067   0.234  -3.626

  No H/Q in entry =          11
  In of MODEL   18
    1    H    LEU  56           H        LEU  56 -25.294   0.361  -1.124
    2    HA   LEU  56           HA       LEU  56 -22.354   0.703  -1.174
    3    HB2  LEU  56           HB2      LEU  56 -24.154   0.477   1.225
    4    HB3  LEU  56           HB3      LEU  56 -22.437   0.875   1.218
    5    HG   LEU  56           HG       LEU  56 -24.706   2.615   0.294
    6   HD11  LEU  56          HD11      LEU  56 -23.593   2.161   2.803
    7   HD13  LEU  56          HD12      LEU  56 -24.558   3.559   2.328
    8   HD12  LEU  56          HD13      LEU  56 -22.799   3.632   2.237
    9   HD23  LEU  56          HD21      LEU  56 -22.731   4.280   0.129
   10   HD22  LEU  56          HD22      LEU  56 -23.138   3.217  -1.219
   11   HD21  LEU  56          HD23      LEU  56 -21.788   2.818  -0.157

  No H/Q in entry =          11
  In of MODEL   18
    1    H    GLY  57           H        GLY  57 -21.003  -0.963  -0.676
    2    HA3  GLY  57           HA2      GLY  57 -21.977  -3.627  -0.927
    3    HA2  GLY  57           HA3      GLY  57 -20.344  -3.174  -0.446

  No H/Q in entry =           3
  In of MODEL   18
    1    HA   PRO  58           HA       PRO  58 -23.162  -4.234   3.255
    2    HB2  PRO  58           HB2      PRO  58 -22.526  -6.862   3.807
    3    HB3  PRO  58           HB3      PRO  58 -23.905  -6.408   2.806
    4    HG2  PRO  58           HG2      PRO  58 -21.197  -7.324   1.995
    5    HG3  PRO  58           HG3      PRO  58 -22.771  -7.741   1.319
    6    HD2  PRO  58           HD2      PRO  58 -21.131  -5.930   0.128
    7    HD3  PRO  58           HD3      PRO  58 -22.889  -5.808   0.033

  No H/Q in entry =           7
  In of MODEL   18
    1    H    GLN  59           H        GLN  59 -19.803  -4.758   2.628
    2    HA   GLN  59           HA       GLN  59 -19.041  -4.845   5.386
    3    HB2  GLN  59           HB2      GLN  59 -17.430  -3.950   2.992
    4    HB3  GLN  59           HB3      GLN  59 -16.788  -4.262   4.592
    5    HG2  GLN  59           HG2      GLN  59 -18.111  -6.303   2.811
    6    HG3  GLN  59           HG3      GLN  59 -16.378  -6.102   3.013
    7   HE21  GLN  59          HE21      GLN  59 -18.613  -7.885   3.800
    8   HE22  GLN  59          HE22      GLN  59 -18.403  -8.671   5.252

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ILE  60           H        ILE  60 -19.932  -2.233   3.233
    2    HA   ILE  60           HA       ILE  60 -19.037  -0.334   5.314
    3    HB   ILE  60           HB       ILE  60 -19.244   1.435   3.522
    4   HG12  ILE  60          HG12      ILE  60 -19.095  -0.766   1.503
    5   HG13  ILE  60          HG13      ILE  60 -20.666  -0.186   2.056
    6   HG22  ILE  60          HG21      ILE  60 -17.256  -0.553   2.586
    7   HG21  ILE  60          HG22      ILE  60 -17.147   0.072   4.231
    8   HG23  ILE  60          HG23      ILE  60 -17.088   1.180   2.861
    9   HD12  ILE  60          HD11      ILE  60 -18.590   1.222   0.428
   10   HD11  ILE  60          HD12      ILE  60 -19.661   2.173   1.456
   11   HD13  ILE  60          HD13      ILE  60 -20.336   1.145   0.193

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ALA  61           H        ALA  61 -21.522  -1.874   5.359
    2    HA   ALA  61           HA       ALA  61 -23.716  -0.158   4.940
    3    HB1  ALA  61           HB1      ALA  61 -24.958  -1.650   6.240
    4    HB2  ALA  61           HB2      ALA  61 -23.564  -2.086   7.230
    5    HB3  ALA  61           HB3      ALA  61 -23.675  -2.657   5.565

  No H/Q in entry =           5
  In of MODEL   18
    1    H    TYR  62           H        TYR  62 -21.504  -0.368   7.729
    2    HA   TYR  62           HA       TYR  62 -23.023   1.285   9.436
    3    HB2  TYR  62           HB2      TYR  62 -20.977   1.638  10.677
    4    HB3  TYR  62           HB3      TYR  62 -21.058  -0.047  10.167
    5    HD1  TYR  62           HD1      TYR  62 -19.475  -0.936   8.517
    6    HD2  TYR  62           HD2      TYR  62 -19.263   3.147   9.756
    7    HE1  TYR  62           HE1      TYR  62 -17.261  -0.733   7.453
    8    HE2  TYR  62           HE2      TYR  62 -17.034   3.345   8.693
    9    HH   TYR  62           HH       TYR  62 -15.936   1.455   6.465

  No H/Q in entry =           9
  In of MODEL   18
    1    H    MET  63           H        MET  63 -21.371   2.168   6.593
    2    HA   MET  63           HA       MET  63 -21.147   4.982   7.344
    3    HB2  MET  63           HB2      MET  63 -20.573   3.494   4.781
    4    HB3  MET  63           HB3      MET  63 -20.355   5.233   4.986
    5    HG2  MET  63           HG2      MET  63 -18.644   4.840   6.654
    6    HG3  MET  63           HG3      MET  63 -18.880   3.099   6.505
    7    HE1  MET  63           HE1      MET  63 -18.287   6.281   4.905
    8    HE3  MET  63           HE2      MET  63 -18.332   5.839   3.199
    9    HE2  MET  63           HE3      MET  63 -16.781   6.047   4.015

  No H/Q in entry =           9
  In of MODEL   18
    1    H    LEU  64           H        LEU  64 -23.750   3.200   6.349
    2    HA   LEU  64           HA       LEU  64 -24.936   4.682   4.304
    3    HB2  LEU  64           HB2      LEU  64 -25.845   2.577   5.183
    4    HB3  LEU  64           HB3      LEU  64 -26.280   3.399   6.681
    5    HG   LEU  64           HG       LEU  64 -27.954   4.711   5.483
    6   HD13  LEU  64          HD11      LEU  64 -27.672   4.991   3.254
    7   HD12  LEU  64          HD12      LEU  64 -28.351   3.372   3.079
    8   HD11  LEU  64          HD13      LEU  64 -26.603   3.595   3.136
    9   HD23  LEU  64          HD21      LEU  64 -28.531   1.926   4.681
   10   HD22  LEU  64          HD22      LEU  64 -29.493   3.060   5.627
   11   HD21  LEU  64          HD23      LEU  64 -28.132   2.224   6.373

  No H/Q in entry =          11
  In of MODEL   18
    1    HA   PRO  65           HA       PRO  65 -27.044   7.825   7.125
    2    HB2  PRO  65           HB2      PRO  65 -25.034   7.897   9.375
    3    HB3  PRO  65           HB3      PRO  65 -26.767   8.213   9.432
    4    HG2  PRO  65           HG2      PRO  65 -25.882   5.921  10.311
    5    HG3  PRO  65           HG3      PRO  65 -27.305   5.939   9.270
    6    HD2  PRO  65           HD2      PRO  65 -24.448   5.279   8.545
    7    HD3  PRO  65           HD3      PRO  65 -25.925   4.433   8.085

  No H/Q in entry =           7
  In of MODEL   18
    1    H    GLU  66           H        GLU  66 -23.489   7.694   7.184
    2    HA   GLU  66           HA       GLU  66 -23.135  10.493   6.835
    3    HB2  GLU  66           HB2      GLU  66 -21.373   8.161   6.131
    4    HB3  GLU  66           HB3      GLU  66 -20.888   9.848   5.956
    5    HG2  GLU  66           HG2      GLU  66 -21.085  10.175   8.330
    6    HG3  GLU  66           HG3      GLU  66 -21.645   8.515   8.531

  No H/Q in entry =           6
  In of MODEL   18
    1    H    ILE  67           H        ILE  67 -23.302   7.796   4.528
    2    HA   ILE  67           HA       ILE  67 -22.856   9.540   2.268
    3    HB   ILE  67           HB       ILE  67 -23.818   6.650   2.393
    4   HG12  ILE  67          HG12      ILE  67 -21.165   7.781   1.485
    5   HG13  ILE  67          HG13      ILE  67 -21.464   7.334   3.164
    6   HG21  ILE  67          HG21      ILE  67 -23.725   8.571   0.206
    7   HG23  ILE  67          HG22      ILE  67 -24.386   6.936   0.226
    8   HG22  ILE  67          HG23      ILE  67 -22.673   7.191  -0.103
    9   HD12  ILE  67          HD11      ILE  67 -21.089   5.601   0.778
   10   HD11  ILE  67          HD12      ILE  67 -22.112   5.024   2.093
   11   HD13  ILE  67          HD13      ILE  67 -20.429   5.446   2.405

  No H/Q in entry =          11
  In of MODEL   18
    1    H    GLN  68           H        GLN  68 -25.744   8.517   3.890
    2    HA   GLN  68           HA       GLN  68 -27.558   9.528   1.942
    3    HB2  GLN  68           HB2      GLN  68 -27.812   9.117   4.918
    4    HB3  GLN  68           HB3      GLN  68 -29.121   9.761   3.942
    5    HG2  GLN  68           HG2      GLN  68 -29.199   7.758   2.626
    6    HG3  GLN  68           HG3      GLN  68 -27.761   7.132   3.411
    7   HE21  GLN  68          HE21      GLN  68 -29.970   5.828   3.256
    8   HE22  GLN  68          HE22      GLN  68 -30.805   5.363   4.665

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ARG  69           H        ARG  69 -25.905  11.102   4.707
    2    HA   ARG  69           HA       ARG  69 -27.213  13.624   4.355
    3    HB2  ARG  69           HB2      ARG  69 -24.885  12.607   5.916
    4    HB3  ARG  69           HB3      ARG  69 -24.925  14.335   5.593
    5    HG2  ARG  69           HG2      ARG  69 -27.236  14.412   6.574
    6    HG3  ARG  69           HG3      ARG  69 -27.067  12.709   7.012
    7    HD2  ARG  69           HD2      ARG  69 -25.316  15.005   7.967
    8    HD3  ARG  69           HD3      ARG  69 -26.463  14.106   8.948
    9    HE   ARG  69           HE       ARG  69 -23.877  13.132   7.969
   10   HH21  ARG  69          HH11      ARG  69 -23.107  11.326   9.127
   11   HH22  ARG  69          HH12      ARG  69 -24.151  10.512  10.243
   12   HH11  ARG  69          HH21      ARG  69 -26.840  12.620   9.667
   13   HH12  ARG  69          HH22      ARG  69 -26.264  11.242  10.546

  No H/Q in entry =          13
  In of MODEL   18
    1    H    LEU  70           H        LEU  70 -24.381  12.176   2.957
    2    HA   LEU  70           HA       LEU  70 -23.214  14.537   1.832
    3    HB2  LEU  70           HB2      LEU  70 -22.275  12.184   2.376
    4    HB3  LEU  70           HB3      LEU  70 -22.906  11.766   0.784
    5    HG   LEU  70           HG       LEU  70 -21.283  13.121  -0.280
    6   HD11  LEU  70          HD11      LEU  70 -20.431  13.888   2.522
    7   HD13  LEU  70          HD12      LEU  70 -21.105  14.964   1.297
    8   HD12  LEU  70          HD13      LEU  70 -19.511  14.248   1.057
    9   HD22  LEU  70          HD21      LEU  70 -19.892  11.365  -0.088
   10   HD21  LEU  70          HD22      LEU  70 -20.825  10.837   1.313
   11   HD23  LEU  70          HD23      LEU  70 -19.413  11.871   1.533

  No H/Q in entry =          11
  In of MODEL   18
    1    H    LEU  71           H        LEU  71 -25.433  12.072   0.674
    2    HA   LEU  71           HA       LEU  71 -25.930  13.621  -1.810
    3    HB2  LEU  71           HB2      LEU  71 -26.209  10.635  -1.423
    4    HB3  LEU  71           HB3      LEU  71 -26.322  11.530  -2.938
    5    HG   LEU  71           HG       LEU  71 -23.796  11.445  -1.287
    6   HD12  LEU  71          HD11      LEU  71 -23.899   9.868  -3.752
    7   HD11  LEU  71          HD12      LEU  71 -24.920   9.244  -2.457
    8   HD13  LEU  71          HD13      LEU  71 -23.193   9.475  -2.184
    9   HD22  LEU  71          HD21      LEU  71 -23.858  13.293  -2.743
   10   HD21  LEU  71          HD22      LEU  71 -24.386  12.290  -4.094
   11   HD23  LEU  71          HD23      LEU  71 -22.768  12.089  -3.427

  No H/Q in entry =          11
  In of MODEL   18
    1    HA   PRO  72           HA       PRO  72 -29.797  13.220   0.818
    2    HB2  PRO  72           HB2      PRO  72 -30.587  15.804   0.792
    3    HB3  PRO  72           HB3      PRO  72 -29.287  15.295   1.868
    4    HG2  PRO  72           HG2      PRO  72 -29.079  16.540  -0.862
    5    HG3  PRO  72           HG3      PRO  72 -28.292  17.041   0.635
    6    HD2  PRO  72           HD2      PRO  72 -27.003  15.484  -1.167
    7    HD3  PRO  72           HD3      PRO  72 -26.747  15.275   0.564

  No H/Q in entry =           7
  In of MODEL   18
    1    H    ASN  73           H        ASN  73 -29.160  14.223  -2.380
    2    HA   ASN  73           HA       ASN  73 -32.029  14.004  -3.006
    3    HB2  ASN  73           HB2      ASN  73 -31.542  15.140  -5.082
    4    HB3  ASN  73           HB3      ASN  73 -30.988  16.077  -3.704
    5   HD21  ASN  73          HD21      ASN  73 -30.201  16.155  -6.383
    6   HD22  ASN  73          HD22      ASN  73 -28.538  15.953  -6.586

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LYS  74           H        LYS  74 -30.110  11.687  -2.634
    2    HA   LYS  74           HA       LYS  74 -30.726  10.360  -5.208
    3    HB2  LYS  74           HB2      LYS  74 -28.196   9.966  -3.604
    4    HB3  LYS  74           HB3      LYS  74 -28.607   9.195  -5.136
    5    HG2  LYS  74           HG2      LYS  74 -28.259  12.153  -4.875
    6    HG3  LYS  74           HG3      LYS  74 -26.917  11.058  -5.206
    7    HD2  LYS  74           HD2      LYS  74 -28.066  10.201  -7.164
    8    HD3  LYS  74           HD3      LYS  74 -29.456  11.231  -6.818
    9    HE2  LYS  74           HE2      LYS  74 -28.176  13.210  -7.224
   10    HE3  LYS  74           HE3      LYS  74 -26.680  12.281  -7.340
   11    HZ2  LYS  74           HZ1      LYS  74 -28.142  12.967  -9.447
   12    HZ1  LYS  74           HZ2      LYS  74 -28.838  11.456  -9.102
   13    HZ3  LYS  74           HZ3      LYS  74 -27.171  11.576  -9.403

  No H/Q in entry =          13
  In of MODEL   18
    1    HA   PRO  75           HA       PRO  75 -32.193   7.357  -2.292
    2    HB2  PRO  75           HB2      PRO  75 -32.572   5.181  -3.917
    3    HB3  PRO  75           HB3      PRO  75 -33.659   6.569  -3.955
    4    HG2  PRO  75           HG2      PRO  75 -31.346   5.940  -5.746
    5    HG3  PRO  75           HG3      PRO  75 -32.982   6.433  -6.178
    6    HD2  PRO  75           HD2      PRO  75 -30.988   8.241  -6.105
    7    HD3  PRO  75           HD3      PRO  75 -32.606   8.676  -5.553

  No H/Q in entry =           7
  In of MODEL   18
    1    H    VAL  76           H        VAL  76 -30.766   6.233  -0.946
    2    HA   VAL  76           HA       VAL  76 -28.341   4.976  -2.088
    3    HB   VAL  76           HB       VAL  76 -28.577   6.396   0.600
    4   HG11  VAL  76          HG11      VAL  76 -26.264   5.070  -0.827
    5   HG13  VAL  76          HG12      VAL  76 -26.967   4.609   0.725
    6   HG12  VAL  76          HG13      VAL  76 -26.078   6.124   0.576
    7   HG22  VAL  76          HG21      VAL  76 -27.858   8.295  -0.252
    8   HG21  VAL  76          HG22      VAL  76 -28.426   7.646  -1.791
    9   HG23  VAL  76          HG23      VAL  76 -26.725   7.499  -1.345

  No H/Q in entry =           9
  In of MODEL   18
    1    H    GLU  77           H        GLU  77 -28.184   2.805  -1.519
    2    HA   GLU  77           HA       GLU  77 -28.984   1.988   1.123
    3    HB2  GLU  77           HB2      GLU  77 -30.640   0.398   0.565
    4    HB3  GLU  77           HB3      GLU  77 -31.147   1.950  -0.103
    5    HG2  GLU  77           HG2      GLU  77 -30.568   1.219  -2.308
    6    HG3  GLU  77           HG3      GLU  77 -29.967  -0.310  -1.667

  No H/Q in entry =           6
  In of MODEL   18
    1    H    VAL  78           H        VAL  78 -28.715  -0.121   1.740
    2    HA   VAL  78           HA       VAL  78 -26.075  -0.951   0.826
    3    HB   VAL  78           HB       VAL  78 -27.800  -1.832   3.180
    4   HG11  VAL  78          HG11      VAL  78 -25.500  -3.105   2.022
    5   HG13  VAL  78          HG12      VAL  78 -26.416  -3.577   3.454
    6   HG12  VAL  78          HG13      VAL  78 -25.063  -2.457   3.603
    7   HG22  VAL  78          HG21      VAL  78 -26.298  -0.538   4.539
    8   HG21  VAL  78          HG22      VAL  78 -27.010   0.478   3.286
    9   HG23  VAL  78          HG23      VAL  78 -25.350  -0.094   3.120

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ILE  79           H        ILE  79 -25.595  -2.854  -0.119
    2    HA   ILE  79           HA       ILE  79 -27.701  -4.246  -1.487
    3    HB   ILE  79           HB       ILE  79 -24.726  -4.862  -1.288
    4   HG12  ILE  79          HG12      ILE  79 -26.338  -3.666  -3.548
    5   HG13  ILE  79          HG13      ILE  79 -25.432  -2.705  -2.379
    6   HG22  ILE  79          HG21      ILE  79 -25.869  -5.963  -3.626
    7   HG21  ILE  79          HG22      ILE  79 -26.863  -6.484  -2.265
    8   HG23  ILE  79          HG23      ILE  79 -25.131  -6.812  -2.267
    9   HD13  ILE  79          HD11      ILE  79 -24.027  -2.822  -4.204
   10   HD12  ILE  79          HD12      ILE  79 -24.416  -4.515  -4.518
   11   HD11  ILE  79          HD13      ILE  79 -23.414  -4.081  -3.132

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ASP  80           H        ASP  80 -28.618  -6.155  -0.939
    2    HA   ASP  80           HA       ASP  80 -28.582  -7.108   1.689
    3    HB2  ASP  80           HB2      ASP  80 -30.357  -7.602   0.045
    4    HB3  ASP  80           HB3      ASP  80 -29.231  -8.624  -0.847

  No H/Q in entry =           4
  In of MODEL   18
    1    H    SER  81           H        SER  81 -27.076  -8.309   2.791
    2    HA   SER  81           HA       SER  81 -24.604  -9.037   1.577
    3    HB2  SER  81           HB2      SER  81 -24.075 -10.124   3.724
    4    HB3  SER  81           HB3      SER  81 -24.728  -8.505   3.970
    5    HG   SER  81           HG       SER  81 -26.773 -10.100   3.951

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU  82           H        LEU  82 -27.372 -11.057   1.868
    2    HA   LEU  82           HA       LEU  82 -25.894 -13.458   1.296
    3    HB2  LEU  82           HB2      LEU  82 -28.812 -12.752   1.066
    4    HB3  LEU  82           HB3      LEU  82 -28.156 -14.370   0.817
    5    HG   LEU  82           HG       LEU  82 -28.013 -12.855   3.406
    6   HD13  LEU  82          HD11      LEU  82 -30.329 -13.386   2.870
    7   HD12  LEU  82          HD12      LEU  82 -29.752 -14.482   4.127
    8   HD11  LEU  82          HD13      LEU  82 -29.880 -15.042   2.460
    9   HD23  LEU  82          HD21      LEU  82 -27.529 -15.281   4.142
   10   HD22  LEU  82          HD22      LEU  82 -26.246 -14.398   3.316
   11   HD21  LEU  82          HD23      LEU  82 -27.208 -15.583   2.432

  No H/Q in entry =          11
  In of MODEL   18
    1    H    LEU  83           H        LEU  83 -27.794 -11.141  -0.572
    2    HA   LEU  83           HA       LEU  83 -27.639 -12.455  -3.070
    3    HB2  LEU  83           HB2      LEU  83 -27.965  -9.551  -2.364
    4    HB3  LEU  83           HB3      LEU  83 -28.019 -10.163  -4.017
    5    HG   LEU  83           HG       LEU  83 -30.057 -10.533  -1.841
    6   HD13  LEU  83          HD11      LEU  83 -30.763  -8.644  -2.866
    7   HD12  LEU  83          HD12      LEU  83 -31.262  -9.720  -4.171
    8   HD11  LEU  83          HD13      LEU  83 -29.703  -8.897  -4.252
    9   HD23  LEU  83          HD21      LEU  83 -30.240 -11.734  -4.589
   10   HD22  LEU  83          HD22      LEU  83 -31.215 -12.084  -3.162
   11   HD21  LEU  83          HD23      LEU  83 -29.542 -12.635  -3.243

  No H/Q in entry =          11
  In of MODEL   18
    1    H    TYR  84           H        TYR  84 -25.613 -10.159  -1.355
    2    HA   TYR  84           HA       TYR  84 -23.745  -9.684  -3.483
    3    HB2  TYR  84           HB2      TYR  84 -24.202  -8.208  -1.454
    4    HB3  TYR  84           HB3      TYR  84 -23.253  -9.366  -0.523
    5    HD1  TYR  84           HD1      TYR  84 -20.859  -9.424  -0.678
    6    HD2  TYR  84           HD2      TYR  84 -23.114  -6.831  -3.213
    7    HE1  TYR  84           HE1      TYR  84 -18.771  -8.283  -1.347
    8    HE2  TYR  84           HE2      TYR  84 -21.034  -5.689  -3.898
    9    HH   TYR  84           HH       TYR  84 -18.701  -5.963  -3.922

  No H/Q in entry =           9
  In of MODEL   18
    1    H    GLY  85           H        GLY  85 -23.553 -11.750  -0.577
    2    HA3  GLY  85           HA2      GLY  85 -21.005 -12.756  -1.087
    3    HA2  GLY  85           HA3      GLY  85 -22.256 -13.585  -0.161

  No H/Q in entry =           3
  In of MODEL   18
    1    H    LYS  86           H        LYS  86 -24.119 -13.866  -2.222
    2    HA   LYS  86           HA       LYS  86 -23.138 -16.244  -3.530
    3    HB2  LYS  86           HB2      LYS  86 -25.674 -14.826  -3.041
    4    HB3  LYS  86           HB3      LYS  86 -25.607 -15.743  -4.546
    5    HG2  LYS  86           HG2      LYS  86 -26.625 -17.114  -2.943
    6    HG3  LYS  86           HG3      LYS  86 -24.990 -17.733  -3.171
    7    HD2  LYS  86           HD2      LYS  86 -24.238 -16.445  -1.214
    8    HD3  LYS  86           HD3      LYS  86 -25.880 -15.849  -0.980
    9    HE2  LYS  86           HE2      LYS  86 -26.667 -18.124  -0.605
   10    HE3  LYS  86           HE3      LYS  86 -25.038 -18.743  -0.879
   11    HZ2  LYS  86           HZ1      LYS  86 -26.056 -17.134   1.373
   12    HZ1  LYS  86           HZ2      LYS  86 -24.404 -17.087   0.976
   13    HZ3  LYS  86           HZ3      LYS  86 -25.131 -18.559   1.405

  No H/Q in entry =          13
  In of MODEL   18
    1    H    VAL  87           H        VAL  87 -23.038 -13.015  -4.362
    2    HA   VAL  87           HA       VAL  87 -22.712 -11.813  -6.282
    3    HB   VAL  87           HB       VAL  87 -21.722 -14.324  -7.662
    4   HG13  VAL  87          HG11      VAL  87 -20.236 -12.806  -8.777
    5   HG12  VAL  87          HG12      VAL  87 -20.608 -11.509  -7.638
    6   HG11  VAL  87          HG13      VAL  87 -21.827 -12.047  -8.792
    7   HG23  VAL  87          HG21      VAL  87 -19.469 -13.762  -6.617
    8   HG22  VAL  87          HG22      VAL  87 -20.644 -14.595  -5.602
    9   HG21  VAL  87          HG23      VAL  87 -20.385 -12.862  -5.410

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ASP  88           H        ASP  88 -25.244 -12.391  -5.932
    2    HA   ASP  88           HA       ASP  88 -26.408 -13.529  -8.348
    3    HB2  ASP  88           HB2      ASP  88 -27.402 -13.790  -6.024
    4    HB3  ASP  88           HB3      ASP  88 -27.807 -12.075  -6.090

  No H/Q in entry =           4
  In of MODEL   18
    1    H    GLY  89           H        GLY  89 -25.674 -12.261  -9.968
    2    HA3  GLY  89           HA2      GLY  89 -25.779  -9.481 -10.115
    3    HA2  GLY  89           HA3      GLY  89 -25.791 -10.575 -11.497

  No H/Q in entry =           3
  In of MODEL   18
    1    H    LEU  90           H        LEU  90 -28.273 -11.867 -11.064
    2    HA   LEU  90           HA       LEU  90 -30.033  -9.862 -12.133
    3    HB2  LEU  90           HB2      LEU  90 -30.168 -12.243 -12.757
    4    HB3  LEU  90           HB3      LEU  90 -30.677 -12.626 -11.114
    5    HG   LEU  90           HG       LEU  90 -32.765 -11.444 -11.446
    6   HD13  LEU  90          HD11      LEU  90 -32.543  -9.681 -12.890
    7   HD12  LEU  90          HD12      LEU  90 -33.122 -10.882 -14.047
    8   HD11  LEU  90          HD13      LEU  90 -31.396 -10.537 -13.924
    9   HD23  LEU  90          HD21      LEU  90 -32.750 -13.029 -13.912
   10   HD22  LEU  90          HD22      LEU  90 -33.728 -13.194 -12.454
   11   HD21  LEU  90          HD23      LEU  90 -32.092 -13.852 -12.498

  No H/Q in entry =          11
  In of MODEL   18
    1    H    GLY  91           H        GLY  91 -29.894 -11.427  -8.979
    2    HA3  GLY  91           HA2      GLY  91 -32.197 -10.269  -7.907
    3    HA2  GLY  91           HA3      GLY  91 -30.817 -10.858  -6.981

  No H/Q in entry =           3
  In of MODEL   18
    1    H    VAL  92           H        VAL  92 -28.852  -9.069  -7.813
    2    HA   VAL  92           HA       VAL  92 -29.574  -6.777  -6.216
    3    HB   VAL  92           HB       VAL  92 -27.047  -7.287  -7.832
    4   HG12  VAL  92          HG11      VAL  92 -27.150  -5.441  -5.470
    5   HG11  VAL  92          HG12      VAL  92 -27.806  -4.851  -6.999
    6   HG13  VAL  92          HG13      VAL  92 -26.124  -5.368  -6.903
    7   HG22  VAL  92          HG21      VAL  92 -26.862  -8.909  -6.271
    8   HG21  VAL  92          HG22      VAL  92 -27.980  -8.119  -5.159
    9   HG23  VAL  92          HG23      VAL  92 -26.311  -7.562  -5.276

  No H/Q in entry =           9
  In of MODEL   18
    1    H    LEU  93           H        LEU  93 -29.199  -7.385  -9.651
    2    HA   LEU  93           HA       LEU  93 -29.475  -4.724 -10.530
    3    HB2  LEU  93           HB2      LEU  93 -28.891  -6.568 -12.028
    4    HB3  LEU  93           HB3      LEU  93 -30.501  -7.256 -11.812
    5    HG   LEU  93           HG       LEU  93 -31.462  -5.245 -12.895
    6   HD11  LEU  93          HD11      LEU  93 -29.566  -3.710 -12.370
    7   HD13  LEU  93          HD12      LEU  93 -30.013  -3.697 -14.077
    8   HD12  LEU  93          HD13      LEU  93 -28.583  -4.581 -13.547
    9   HD23  LEU  93          HD21      LEU  93 -30.449  -5.798 -15.196
   10   HD22  LEU  93          HD22      LEU  93 -31.322  -7.047 -14.310
   11   HD21  LEU  93          HD23      LEU  93 -29.557  -7.040 -14.320

  No H/Q in entry =          11
  In of MODEL   18
    1    H    LYS  94           H        LYS  94 -31.916  -7.220  -9.717
    2    HA   LYS  94           HA       LYS  94 -34.222  -5.703 -10.303
    3    HB2  LYS  94           HB2      LYS  94 -33.760  -7.939  -8.335
    4    HB3  LYS  94           HB3      LYS  94 -35.339  -7.194  -8.582
    5    HG2  LYS  94           HG2      LYS  94 -35.283  -7.928 -10.931
    6    HG3  LYS  94           HG3      LYS  94 -33.742  -8.727 -10.625
    7    HD2  LYS  94           HD2      LYS  94 -34.892 -10.064  -8.819
    8    HD3  LYS  94           HD3      LYS  94 -36.419  -9.364  -9.355
    9    HE2  LYS  94           HE2      LYS  94 -35.939 -10.264 -11.641
   10    HE3  LYS  94           HE3      LYS  94 -34.543 -11.100 -10.959
   11    HZ3  LYS  94           HZ1      LYS  94 -36.434 -12.566 -11.149
   12    HZ2  LYS  94           HZ2      LYS  94 -37.376 -11.531 -10.183
   13    HZ1  LYS  94           HZ3      LYS  94 -36.034 -12.330  -9.516

  No H/Q in entry =          13
  In of MODEL   18
    1    H    ALA  95           H        ALA  95 -32.390  -5.931  -7.266
    2    HA   ALA  95           HA       ALA  95 -34.188  -4.329  -5.749
    3    HB2  ALA  95           HB1      ALA  95 -31.850  -5.778  -5.249
    4    HB3  ALA  95           HB2      ALA  95 -32.798  -4.869  -4.073
    5    HB1  ALA  95           HB3      ALA  95 -31.432  -4.103  -4.887

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA  96           H        ALA  96 -31.533  -3.509  -7.842
    2    HA   ALA  96           HA       ALA  96 -31.356  -0.766  -7.017
    3    HB2  ALA  96           HB1      ALA  96 -29.998  -0.538  -9.129
    4    HB3  ALA  96           HB2      ALA  96 -30.350  -2.229  -9.478
    5    HB1  ALA  96           HB3      ALA  96 -29.417  -1.802  -8.045

  No H/Q in entry =           5
  In of MODEL   18
    1    H    VAL  97           H        VAL  97 -32.947  -2.385  -9.728
    2    HA   VAL  97           HA       VAL  97 -33.958  -0.033 -10.935
    3    HB   VAL  97           HB       VAL  97 -34.849  -2.934 -11.028
    4   HG11  VAL  97          HG11      VAL  97 -36.586  -0.868 -11.467
    5   HG13  VAL  97          HG12      VAL  97 -36.694  -2.444 -12.254
    6   HG12  VAL  97          HG13      VAL  97 -35.907  -1.100 -13.078
    7   HG21  VAL  97          HG21      VAL  97 -33.528  -1.104 -13.035
    8   HG23  VAL  97          HG22      VAL  97 -34.030  -2.765 -13.353
    9   HG22  VAL  97          HG23      VAL  97 -32.765  -2.437 -12.167

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ALA  98           H        ALA  98 -35.191  -2.225  -8.434
    2    HA   ALA  98           HA       ALA  98 -37.716  -1.011  -8.048
    3    HB1  ALA  98           HB1      ALA  98 -36.763  -3.257  -7.062
    4    HB3  ALA  98           HB2      ALA  98 -37.911  -2.318  -6.108
    5    HB2  ALA  98           HB3      ALA  98 -36.186  -2.225  -5.754

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA  99           H        ALA  99 -34.607  -0.334  -6.402
    2    HA   ALA  99           HA       ALA  99 -35.671   1.650  -4.697
    3    HB1  ALA  99           HB1      ALA  99 -33.053   0.697  -5.474
    4    HB2  ALA  99           HB2      ALA  99 -33.575   1.434  -3.958
    5    HB3  ALA  99           HB3      ALA  99 -33.075   2.453  -5.307

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ILE 100           H        ILE 100 -34.642   1.815  -8.054
    2    HA   ILE 100           HA       ILE 100 -34.736   4.671  -8.217
    3    HB   ILE 100           HB       ILE 100 -34.905   2.563 -10.397
    4   HG12  ILE 100          HG12      ILE 100 -32.680   4.476  -9.698
    5   HG13  ILE 100          HG13      ILE 100 -32.763   2.819  -9.100
    6   HG21  ILE 100          HG21      ILE 100 -35.241   5.496 -10.468
    7   HG23  ILE 100          HG22      ILE 100 -35.789   4.265 -11.607
    8   HG22  ILE 100          HG23      ILE 100 -34.119   4.831 -11.657
    9   HD12  ILE 100          HD11      ILE 100 -32.214   3.813 -11.857
   10   HD11  ILE 100          HD12      ILE 100 -32.923   2.214 -11.631
   11   HD13  ILE 100          HD13      ILE 100 -31.360   2.596 -10.911

  No H/Q in entry =          11
  In of MODEL   18
    1    H    LYS 101           H        LYS 101 -37.110   2.148  -8.982
    2    HA   LYS 101           HA       LYS 101 -39.146   3.878  -9.939
    3    HB2  LYS 101           HB2      LYS 101 -39.109   1.079  -8.867
    4    HB3  LYS 101           HB3      LYS 101 -40.639   1.895  -9.189
    5    HG2  LYS 101           HG2      LYS 101 -40.170   2.060 -11.486
    6    HG3  LYS 101           HG3      LYS 101 -38.487   1.599 -11.248
    7    HD2  LYS 101           HD2      LYS 101 -39.798  -0.252 -12.165
    8    HD3  LYS 101           HD3      LYS 101 -39.174  -0.634 -10.561
    9    HE2  LYS 101           HE2      LYS 101 -41.255  -1.276 -10.057
   10    HE3  LYS 101           HE3      LYS 101 -41.659   0.441 -10.024
   11    HZ3  LYS 101           HZ1      LYS 101 -42.565   0.354 -12.140
   12    HZ2  LYS 101           HZ2      LYS 101 -43.068  -1.118 -11.460
   13    HZ1  LYS 101           HZ3      LYS 101 -41.765  -1.088 -12.549

  No H/Q in entry =          13
  In of MODEL   18
    1    H    LYS 102           H        LYS 102 -38.685   2.322  -6.763
    2    HA   LYS 102           HA       LYS 102 -40.890   3.561  -5.531
    3    HB2  LYS 102           HB2      LYS 102 -39.706   1.638  -4.559
    4    HB3  LYS 102           HB3      LYS 102 -38.283   2.646  -4.301
    5    HG2  LYS 102           HG2      LYS 102 -39.550   4.049  -2.770
    6    HG3  LYS 102           HG3      LYS 102 -40.976   3.046  -3.030
    7    HD2  LYS 102           HD2      LYS 102 -39.803   1.123  -2.047
    8    HD3  LYS 102           HD3      LYS 102 -38.377   2.128  -1.785
    9    HE2  LYS 102           HE2      LYS 102 -39.680   3.618  -0.341
   10    HE3  LYS 102           HE3      LYS 102 -41.123   2.645  -0.623
   11    HZ1  LYS 102           HZ1      LYS 102 -39.453   0.818   0.337
   12    HZ3  LYS 102           HZ2      LYS 102 -40.531   1.718   1.290
   13    HZ2  LYS 102           HZ3      LYS 102 -38.907   2.197   1.166

  No H/Q in entry =          13
  In of MODEL   18
    1    H    ALA 103           H        ALA 103 -37.898   4.883  -6.529
    2    HA   ALA 103           HA       ALA 103 -38.043   7.166  -4.700
    3    HB2  ALA 103           HB1      ALA 103 -36.037   7.871  -6.270
    4    HB3  ALA 103           HB2      ALA 103 -36.055   6.162  -6.703
    5    HB1  ALA 103           HB3      ALA 103 -35.806   6.644  -5.025

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA 104           H        ALA 104 -38.700   6.523  -8.057
    2    HA   ALA 104           HA       ALA 104 -39.203   9.336  -8.620
    3    HB2  ALA 104           HB1      ALA 104 -39.275   8.714 -10.835
    4    HB1  ALA 104           HB2      ALA 104 -40.048   7.168 -10.485
    5    HB3  ALA 104           HB3      ALA 104 -38.317   7.373 -10.209

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA 105           H        ALA 105 -40.867   7.244  -6.851
    2    HA   ALA 105           HA       ALA 105 -43.248   8.710  -6.785
    3    HB2  ALA 105           HB1      ALA 105 -44.026   7.916  -8.837
    4    HB3  ALA 105           HB2      ALA 105 -44.695   6.724  -7.722
    5    HB1  ALA 105           HB3      ALA 105 -43.240   6.349  -8.645

  No H/Q in entry =           5
  In of MODEL   19
    1    H1   ALA   1           H3       ALA   1 -12.091 -15.967  -2.384
    2    H2   ALA   1           H2       ALA   1 -11.137 -17.103  -3.219
    3    H3   ALA   1           H1       ALA   1 -12.288 -16.173  -4.058
    4    HA   ALA   1           HA       ALA   1 -13.671 -17.886  -3.814
    5    HB3  ALA   1           HB1      ALA   1 -12.259 -19.642  -3.343
    6    HB1  ALA   1           HB2      ALA   1 -13.019 -19.530  -1.755
    7    HB2  ALA   1           HB3      ALA   1 -11.450 -18.776  -2.036

  No H/Q in entry =           7
  In of MODEL   19
    1    H    GLU   2           H        GLU   2 -15.289 -18.749  -2.159
    2    HA   GLU   2           HA       GLU   2 -16.955 -17.040  -1.110
    3    HB2  GLU   2           HB2      GLU   2 -15.996 -19.451   0.446
    4    HB3  GLU   2           HB3      GLU   2 -17.528 -18.614   0.694
    5    HG2  GLU   2           HG2      GLU   2 -18.494 -19.717  -1.038
    6    HG3  GLU   2           HG3      GLU   2 -17.173 -19.308  -2.122

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLU   3           H        GLU   3 -15.035 -18.365   1.522
    2    HA   GLU   3           HA       GLU   3 -15.282 -16.008   3.069
    3    HB2  GLU   3           HB2      GLU   3 -13.673 -18.538   3.333
    4    HB3  GLU   3           HB3      GLU   3 -13.456 -17.212   4.475
    5    HG2  GLU   3           HG2      GLU   3 -15.649 -17.381   5.290
    6    HG3  GLU   3           HG3      GLU   3 -16.234 -18.192   3.843

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LEU   4           H        LEU   4 -12.310 -17.464   1.689
    2    HA   LEU   4           HA       LEU   4 -10.496 -15.540   2.284
    3    HB2  LEU   4           HB2      LEU   4 -10.709 -16.851  -0.436
    4    HB3  LEU   4           HB3      LEU   4  -9.265 -16.114   0.248
    5    HG   LEU   4           HG       LEU   4 -10.738 -18.521   1.368
    6   HD13  LEU   4          HD11      LEU   4  -9.091 -19.865   0.447
    7   HD12  LEU   4          HD12      LEU   4  -7.894 -18.570   0.417
    8   HD11  LEU   4          HD13      LEU   4  -9.180 -18.609  -0.788
    9   HD23  LEU   4          HD21      LEU   4  -8.489 -18.558   2.754
   10   HD22  LEU   4          HD22      LEU   4  -9.821 -17.529   3.276
   11   HD21  LEU   4          HD23      LEU   4  -8.463 -16.830   2.394

  No H/Q in entry =          11
  In of MODEL   19
    1    H    GLU   5           H        GLU   5 -12.827 -15.366  -0.396
    2    HA   GLU   5           HA       GLU   5 -11.845 -12.877  -1.404
    3    HB2  GLU   5           HB2      GLU   5 -13.180 -14.495  -2.752
    4    HB3  GLU   5           HB3      GLU   5 -14.586 -14.110  -1.757
    5    HG2  GLU   5           HG2      GLU   5 -14.724 -12.747  -3.737
    6    HG3  GLU   5           HG3      GLU   5 -14.270 -11.690  -2.399

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLU   6           H        GLU   6 -14.566 -13.773   0.686
    2    HA   GLU   6           HA       GLU   6 -15.496 -11.103   1.073
    3    HB2  GLU   6           HB2      GLU   6 -16.904 -13.108   1.477
    4    HB3  GLU   6           HB3      GLU   6 -15.872 -13.537   2.840
    5    HG2  GLU   6           HG2      GLU   6 -16.424 -11.415   3.948
    6    HG3  GLU   6           HG3      GLU   6 -17.429 -10.949   2.579

  No H/Q in entry =           6
  In of MODEL   19
    1    H    VAL   7           H        VAL   7 -13.173 -13.186   2.658
    2    HA   VAL   7           HA       VAL   7 -12.726 -11.598   4.979
    3    HB   VAL   7           HB       VAL   7 -11.000 -13.631   3.541
    4   HG11  VAL   7          HG11      VAL   7 -10.552 -12.083   6.100
    5   HG13  VAL   7          HG12      VAL   7  -9.447 -12.293   4.743
    6   HG12  VAL   7          HG13      VAL   7  -9.790 -13.649   5.817
    7   HG21  VAL   7          HG21      VAL   7 -13.248 -14.211   4.759
    8   HG23  VAL   7          HG22      VAL   7 -12.327 -13.923   6.235
    9   HG22  VAL   7          HG23      VAL   7 -11.820 -15.182   5.112

  No H/Q in entry =           9
  In of MODEL   19
    1    H    VAL   8           H        VAL   8 -11.207 -11.711   1.773
    2    HA   VAL   8           HA       VAL   8  -9.163  -9.817   2.263
    3    HB   VAL   8           HB       VAL   8 -10.613 -10.543  -0.293
    4   HG12  VAL   8          HG11      VAL   8  -8.443  -9.502  -1.289
    5   HG11  VAL   8          HG12      VAL   8  -8.307  -8.679   0.265
    6   HG13  VAL   8          HG13      VAL   8  -9.722  -8.412  -0.752
    7   HG23  VAL   8          HG21      VAL   8  -7.759 -11.254   0.093
    8   HG22  VAL   8          HG22      VAL   8  -9.089 -12.239  -0.508
    9   HG21  VAL   8          HG23      VAL   8  -8.852 -12.053   1.226

  No H/Q in entry =           9
  In of MODEL   19
    1    H    MET   9           H        MET   9 -12.509  -9.463   1.094
    2    HA   MET   9           HA       MET   9 -12.471  -6.688   0.648
    3    HB2  MET   9           HB2      MET   9 -14.664  -8.588   1.470
    4    HB3  MET   9           HB3      MET   9 -14.967  -6.861   1.268
    5    HG2  MET   9           HG2      MET   9 -14.072  -6.994  -1.045
    6    HG3  MET   9           HG3      MET   9 -13.846  -8.732  -0.838
    7    HE1  MET   9           HE1      MET   9 -16.062  -5.828  -0.441
    8    HE3  MET   9           HE2      MET   9 -17.706  -6.326  -0.830
    9    HE2  MET   9           HE3      MET   9 -16.539  -6.077  -2.126

  No H/Q in entry =           9
  In of MODEL   19
    1    H    GLY  10           H        GLY  10 -13.122  -8.573   3.582
    2    HA3  GLY  10           HA2      GLY  10 -13.695  -6.387   5.291
    3    HA2  GLY  10           HA3      GLY  10 -13.117  -7.968   5.812

  No H/Q in entry =           3
  In of MODEL   19
    1    H    LEU  11           H        LEU  11 -10.667  -8.074   4.503
    2    HA   LEU  11           HA       LEU  11  -8.984  -6.617   6.258
    3    HB2  LEU  11           HB2      LEU  11  -8.418  -8.046   3.657
    4    HB3  LEU  11           HB3      LEU  11  -7.157  -7.325   4.656
    5    HG   LEU  11           HG       LEU  11  -9.141  -9.373   5.676
    6   HD13  LEU  11          HD11      LEU  11  -7.904 -10.604   4.119
    7   HD12  LEU  11          HD12      LEU  11  -6.970 -10.828   5.597
    8   HD11  LEU  11          HD13      LEU  11  -6.438  -9.662   4.386
    9   HD22  LEU  11          HD21      LEU  11  -8.302  -8.344   7.590
   10   HD21  LEU  11          HD22      LEU  11  -6.767  -7.931   6.829
   11   HD23  LEU  11          HD23      LEU  11  -7.077  -9.588   7.345

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  12           H        ILE  12  -9.884  -6.093   2.864
    2    HA   ILE  12           HA       ILE  12  -8.214  -3.847   2.432
    3    HB   ILE  12           HB       ILE  12 -10.861  -4.535   1.132
    4   HG12  ILE  12          HG12      ILE  12  -8.823  -6.192   1.083
    5   HG13  ILE  12          HG13      ILE  12  -9.687  -5.854  -0.403
    6   HG22  ILE  12          HG21      ILE  12  -9.941  -3.162  -0.763
    7   HG21  ILE  12          HG22      ILE  12  -8.628  -2.655   0.291
    8   HG23  ILE  12          HG23      ILE  12 -10.274  -2.246   0.674
    9   HD11  ILE  12          HD11      ILE  12  -7.182  -4.392   0.471
   10   HD13  ILE  12          HD12      ILE  12  -7.967  -4.323  -1.106
   11   HD12  ILE  12          HD13      ILE  12  -7.171  -5.790  -0.588

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  13           H        ILE  13 -11.574  -4.145   3.519
    2    HA   ILE  13           HA       ILE  13 -12.064  -1.362   3.776
    3    HB   ILE  13           HB       ILE  13 -13.246  -3.788   5.146
    4   HG12  ILE  13          HG12      ILE  13 -13.470  -3.266   2.607
    5   HG13  ILE  13          HG13      ILE  13 -14.896  -3.727   3.511
    6   HG23  ILE  13          HG21      ILE  13 -13.863  -2.190   6.698
    7   HG22  ILE  13          HG22      ILE  13 -15.182  -1.999   5.551
    8   HG21  ILE  13          HG23      ILE  13 -13.829  -0.872   5.531
    9   HD13  ILE  13          HD11      ILE  13 -15.584  -1.398   3.726
   10   HD12  ILE  13          HD12      ILE  13 -15.281  -1.772   2.040
   11   HD11  ILE  13          HD13      ILE  13 -14.087  -0.872   2.948

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ASN  14           H        ASN  14 -10.932  -3.831   6.063
    2    HA   ASN  14           HA       ASN  14 -10.754  -2.181   8.343
    3    HB2  ASN  14           HB2      ASN  14 -10.472  -4.787   8.032
    4    HB3  ASN  14           HB3      ASN  14  -8.767  -4.382   7.877
    5   HD21  ASN  14          HD21      ASN  14  -9.392  -5.904  10.058
    6   HD22  ASN  14          HD22      ASN  14  -9.377  -4.978  11.479

  No H/Q in entry =           6
  In of MODEL   19
    1    H    SER  15           H        SER  15  -8.337  -2.989   5.860
    2    HA   SER  15           HA       SER  15  -6.213  -1.468   6.931
    3    HB2  SER  15           HB2      SER  15  -5.184  -1.683   4.778
    4    HB3  SER  15           HB3      SER  15  -6.127  -3.151   5.003
    5    HG   SER  15           HG       SER  15  -6.509  -1.023   3.274

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLY  16           H        GLY  16  -8.818  -0.640   4.674
    2    HA3  GLY  16           HA2      GLY  16  -7.989   2.009   4.113
    3    HA2  GLY  16           HA3      GLY  16  -9.633   1.394   3.950

  No H/Q in entry =           3
  In of MODEL   19
    1    H    GLN  17           H        GLN  17 -10.174   0.674   6.601
    2    HA   GLN  17           HA       GLN  17 -10.913   3.175   7.730
    3    HB2  GLN  17           HB2      GLN  17 -12.124   1.081   8.223
    4    HB3  GLN  17           HB3      GLN  17 -10.711   0.473   9.086
    5    HG2  GLN  17           HG2      GLN  17 -10.867   2.265  10.717
    6    HG3  GLN  17           HG3      GLN  17 -12.168   3.030   9.806
    7   HE21  GLN  17          HE21      GLN  17 -12.559   2.248  12.523
    8   HE22  GLN  17          HE22      GLN  17 -13.669   0.964  12.556

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ALA  18           H        ALA  18  -8.259   0.928   8.365
    2    HA   ALA  18           HA       ALA  18  -7.181   2.166  10.633
    3    HB2  ALA  18           HB1      ALA  18  -6.541  -0.048   9.277
    4    HB3  ALA  18           HB2      ALA  18  -5.391   0.754  10.347
    5    HB1  ALA  18           HB3      ALA  18  -5.313   1.026   8.605

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ARG  19           H        ARG  19  -6.408   2.685   7.184
    2    HA   ARG  19           HA       ARG  19  -4.536   4.757   7.609
    3    HB2  ARG  19           HB2      ARG  19  -4.844   3.603   5.417
    4    HB3  ARG  19           HB3      ARG  19  -6.397   4.424   5.233
    5    HG2  ARG  19           HG2      ARG  19  -5.295   6.609   5.295
    6    HG3  ARG  19           HG3      ARG  19  -3.737   5.845   5.606
    7    HD2  ARG  19           HD2      ARG  19  -3.864   6.423   3.260
    8    HD3  ARG  19           HD3      ARG  19  -3.927   4.663   3.413
    9    HE   ARG  19           HE       ARG  19  -6.572   5.539   3.395
   10   HH21  ARG  19          HH11      ARG  19  -7.764   5.672   1.474
   11   HH22  ARG  19          HH12      ARG  19  -6.940   5.753  -0.044
   12   HH11  ARG  19          HH21      ARG  19  -3.793   5.629   1.368
   13   HH12  ARG  19          HH22      ARG  19  -4.689   5.726  -0.104

  No H/Q in entry =          13
  In of MODEL   19
    1    H    SER  20           H        SER  20  -8.034   4.825   7.000
    2    HA   SER  20           HA       SER  20  -8.427   7.576   6.938
    3    HB2  SER  20           HB2      SER  20 -10.285   6.205   6.403
    4    HB3  SER  20           HB3      SER  20 -10.170   5.324   7.924
    5    HG   SER  20           HG       SER  20 -11.078   7.942   7.418

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU  21           H        LEU  21  -8.406   5.405   9.752
    2    HA   LEU  21           HA       LEU  21  -8.877   7.404  11.707
    3    HB2  LEU  21           HB2      LEU  21  -7.488   4.722  11.884
    4    HB3  LEU  21           HB3      LEU  21  -7.818   5.741  13.282
    5    HG   LEU  21           HG       LEU  21  -9.965   4.801  11.356
    6   HD11  LEU  21          HD11      LEU  21  -9.010   3.621  13.978
    7   HD13  LEU  21          HD12      LEU  21  -9.050   2.833  12.400
    8   HD12  LEU  21          HD13      LEU  21 -10.558   3.214  13.233
    9   HD22  LEU  21          HD21      LEU  21 -10.916   6.604  12.494
   10   HD21  LEU  21          HD22      LEU  21  -9.943   6.357  13.940
   11   HD23  LEU  21          HD23      LEU  21 -11.306   5.299  13.611

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ALA  22           H        ALA  22  -5.903   6.064  10.313
    2    HA   ALA  22           HA       ALA  22  -4.046   7.410  11.934
    3    HB2  ALA  22           HB1      ALA  22  -3.600   5.554  10.252
    4    HB1  ALA  22           HB2      ALA  22  -2.422   6.866  10.285
    5    HB3  ALA  22           HB3      ALA  22  -3.636   6.800   9.006

  No H/Q in entry =           5
  In of MODEL   19
    1    H    TYR  23           H        TYR  23  -5.368   8.395   8.744
    2    HA   TYR  23           HA       TYR  23  -4.065  10.908   8.666
    3    HB2  TYR  23           HB2      TYR  23  -5.129   9.971   6.676
    4    HB3  TYR  23           HB3      TYR  23  -6.711  10.063   7.452
    5    HD1  TYR  23           HD1      TYR  23  -3.824  12.142   6.317
    6    HD2  TYR  23           HD2      TYR  23  -7.979  12.052   7.400
    7    HE1  TYR  23           HE1      TYR  23  -4.075  14.486   5.545
    8    HE2  TYR  23           HE2      TYR  23  -8.231  14.396   6.626
    9    HH   TYR  23           HH       TYR  23  -5.440  16.226   5.374

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ALA  24           H        ALA  24  -7.175   9.895  10.041
    2    HA   ALA  24           HA       ALA  24  -8.049  12.476  10.798
    3    HB1  ALA  24           HB1      ALA  24  -9.852  11.203  11.266
    4    HB2  ALA  24           HB2      ALA  24  -9.022  10.649  12.719
    5    HB3  ALA  24           HB3      ALA  24  -8.880   9.732  11.220

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA  25           H        ALA  25  -6.018  10.053  12.389
    2    HA   ALA  25           HA       ALA  25  -5.705  11.320  14.886
    3    HB2  ALA  25           HB1      ALA  25  -4.903   8.976  14.078
    4    HB3  ALA  25           HB2      ALA  25  -3.903   9.853  15.238
    5    HB1  ALA  25           HB3      ALA  25  -3.462   9.834  13.530

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU  26           H        LEU  26  -3.909  11.630  11.850
    2    HA   LEU  26           HA       LEU  26  -1.978  13.481  12.763
    3    HB2  LEU  26           HB2      LEU  26  -1.655  12.324  10.665
    4    HB3  LEU  26           HB3      LEU  26  -3.136  13.009  10.003
    5    HG   LEU  26           HG       LEU  26  -2.152  15.273  10.132
    6   HD12  LEU  26          HD11      LEU  26   0.385  15.329  10.553
    7   HD11  LEU  26          HD12      LEU  26   0.180  13.749  11.303
    8   HD13  LEU  26          HD13      LEU  26  -0.648  15.156  11.971
    9   HD21  LEU  26          HD21      LEU  26  -0.378  13.236   8.751
   10   HD23  LEU  26          HD22      LEU  26  -0.443  14.955   8.373
   11   HD22  LEU  26          HD23      LEU  26  -1.852  13.937   8.085

  No H/Q in entry =          11
  In of MODEL   19
    1    H    LYS  27           H        LYS  27  -5.162  13.914  11.275
    2    HA   LYS  27           HA       LYS  27  -5.143  16.702  11.064
    3    HB2  LYS  27           HB2      LYS  27  -6.865  15.198  10.080
    4    HB3  LYS  27           HB3      LYS  27  -7.523  14.940  11.696
    5    HG2  LYS  27           HG2      LYS  27  -7.985  17.341  11.920
    6    HG3  LYS  27           HG3      LYS  27  -7.276  17.640  10.330
    7    HD2  LYS  27           HD2      LYS  27  -8.986  16.179   9.295
    8    HD3  LYS  27           HD3      LYS  27  -9.701  15.896  10.884
    9    HE2  LYS  27           HE2      LYS  27 -10.176  18.303  11.115
   10    HE3  LYS  27           HE3      LYS  27  -9.433  18.607   9.541
   11    HZ3  LYS  27           HZ1      LYS  27 -11.808  18.450   9.293
   12    HZ2  LYS  27           HZ2      LYS  27 -11.839  16.936  10.070
   13    HZ1  LYS  27           HZ3      LYS  27 -11.092  17.103   8.549

  No H/Q in entry =          13
  In of MODEL   19
    1    H    GLN  28           H        GLN  28  -6.013  14.617  13.798
    2    HA   GLN  28           HA       GLN  28  -6.939  16.617  15.563
    3    HB2  GLN  28           HB2      GLN  28  -5.503  14.008  16.122
    4    HB3  GLN  28           HB3      GLN  28  -6.264  15.007  17.362
    5    HG2  GLN  28           HG2      GLN  28  -7.700  13.858  14.952
    6    HG3  GLN  28           HG3      GLN  28  -7.753  13.169  16.573
    7   HE21  GLN  28          HE21      GLN  28  -9.626  14.967  14.589
    8   HE22  GLN  28          HE22      GLN  28 -10.401  15.966  15.720

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ALA  29           H        ALA  29  -3.702  15.357  14.888
    2    HA   ALA  29           HA       ALA  29  -2.286  16.781  16.864
    3    HB1  ALA  29           HB1      ALA  29  -0.344  16.109  15.753
    4    HB3  ALA  29           HB2      ALA  29  -1.096  16.217  14.162
    5    HB2  ALA  29           HB3      ALA  29  -1.505  14.884  15.241

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LYS  30           H        LYS  30  -3.145  17.636  13.528
    2    HA   LYS  30           HA       LYS  30  -1.762  20.091  13.421
    3    HB2  LYS  30           HB2      LYS  30  -4.279  19.184  12.010
    4    HB3  LYS  30           HB3      LYS  30  -3.461  20.706  11.661
    5    HG2  LYS  30           HG2      LYS  30  -1.376  19.432  11.159
    6    HG3  LYS  30           HG3      LYS  30  -2.267  17.928  11.408
    7    HD2  LYS  30           HD2      LYS  30  -3.833  18.545   9.606
    8    HD3  LYS  30           HD3      LYS  30  -2.965  20.061   9.359
    9    HE2  LYS  30           HE2      LYS  30  -0.918  18.786   8.790
   10    HE3  LYS  30           HE3      LYS  30  -1.805  17.275   9.006
   11    HZ2  LYS  30           HZ1      LYS  30  -1.632  18.138   6.661
   12    HZ1  LYS  30           HZ2      LYS  30  -2.689  19.392   7.121
   13    HZ3  LYS  30           HZ3      LYS  30  -3.198  17.770   7.198

  No H/Q in entry =          13
  In of MODEL   19
    1    H    GLN  31           H        GLN  31  -4.857  19.214  14.829
    2    HA   GLN  31           HA       GLN  31  -5.648  21.965  15.268
    3    HB2  GLN  31           HB2      GLN  31  -6.807  19.514  16.598
    4    HB3  GLN  31           HB3      GLN  31  -7.581  21.077  16.344
    5    HG2  GLN  31           HG2      GLN  31  -6.857  20.296  13.759
    6    HG3  GLN  31           HG3      GLN  31  -7.370  18.790  14.511
    7   HE21  GLN  31          HE21      GLN  31  -8.789  20.342  12.399
    8   HE22  GLN  31          HE22      GLN  31 -10.308  20.722  13.052

  No H/Q in entry =           8
  In of MODEL   19
    1    H    GLY  32           H        GLY  32  -3.321  20.065  16.601
    2    HA3  GLY  32           HA2      GLY  32  -1.929  20.547  18.405
    3    HA2  GLY  32           HA3      GLY  32  -3.071  21.782  18.921

  No H/Q in entry =           3
  In of MODEL   19
    1    H    ASP  33           H        ASP  33  -4.465  18.727  18.268
    2    HA   ASP  33           HA       ASP  33  -4.878  18.277  21.149
    3    HB2  ASP  33           HB2      ASP  33  -6.269  17.244  18.672
    4    HB3  ASP  33           HB3      ASP  33  -6.613  16.637  20.290

  No H/Q in entry =           4
  In of MODEL   19
    1    H    PHE  34           H        PHE  34  -2.703  17.447  21.462
    2    HA   PHE  34           HA       PHE  34  -1.679  15.201  20.073
    3    HB2  PHE  34           HB2      PHE  34  -1.078  16.202  22.865
    4    HB3  PHE  34           HB3      PHE  34  -0.136  14.984  22.004
    5    HD1  PHE  34           HD1      PHE  34  -0.340  18.410  22.725
    6    HD2  PHE  34           HD2      PHE  34   0.521  15.702  19.503
    7    HE1  PHE  34           HE1      PHE  34   0.943  20.189  21.567
    8    HE2  PHE  34           HE2      PHE  34   1.799  17.483  18.350
    9    HZ   PHE  34           HZ       PHE  34   2.011  19.723  19.387

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ALA  35           H        ALA  35  -3.728  15.471  22.930
    2    HA   ALA  35           HA       ALA  35  -3.495  12.815  23.837
    3    HB3  ALA  35           HB1      ALA  35  -5.960  13.423  24.687
    4    HB1  ALA  35           HB2      ALA  35  -5.440  15.044  24.226
    5    HB2  ALA  35           HB3      ALA  35  -4.520  14.132  25.423

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA  36           H        ALA  36  -5.953  14.302  21.726
    2    HA   ALA  36           HA       ALA  36  -7.347  11.877  21.255
    3    HB1  ALA  36           HB1      ALA  36  -8.812  13.283  20.290
    4    HB3  ALA  36           HB2      ALA  36  -7.641  13.709  19.042
    5    HB2  ALA  36           HB3      ALA  36  -7.677  14.602  20.562

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA  37           H        ALA  37  -4.676  13.481  19.586
    2    HA   ALA  37           HA       ALA  37  -4.622  11.837  17.295
    3    HB3  ALA  37           HB1      ALA  37  -2.648  13.571  18.716
    4    HB2  ALA  37           HB2      ALA  37  -3.175  13.616  17.034
    5    HB1  ALA  37           HB3      ALA  37  -2.012  12.398  17.563

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LYS  38           H        LYS  38  -2.869  11.558  20.378
    2    HA   LYS  38           HA       LYS  38  -1.522   9.168  19.901
    3    HB2  LYS  38           HB2      LYS  38  -1.865  10.935  22.039
    4    HB3  LYS  38           HB3      LYS  38  -2.472   9.403  22.660
    5    HG2  LYS  38           HG2      LYS  38  -0.367   8.299  22.132
    6    HG3  LYS  38           HG3      LYS  38   0.231   9.746  21.315
    7    HD2  LYS  38           HD2      LYS  38   0.385  10.974  23.346
    8    HD3  LYS  38           HD3      LYS  38  -0.626   9.818  24.215
    9    HE2  LYS  38           HE2      LYS  38   1.730   9.525  24.840
   10    HE3  LYS  38           HE3      LYS  38   1.140   8.100  23.980
   11    HZ3  LYS  38           HZ1      LYS  38   2.441   8.523  22.200
   12    HZ2  LYS  38           HZ2      LYS  38   3.386   9.364  23.336
   13    HZ1  LYS  38           HZ3      LYS  38   2.302  10.211  22.339

  No H/Q in entry =          13
  In of MODEL   19
    1    H    ALA  39           H        ALA  39  -4.768   9.640  21.295
    2    HA   ALA  39           HA       ALA  39  -5.306   6.917  21.808
    3    HB3  ALA  39           HB1      ALA  39  -7.479   8.840  21.029
    4    HB2  ALA  39           HB2      ALA  39  -6.587   9.081  22.531
    5    HB1  ALA  39           HB3      ALA  39  -7.490   7.588  22.271

  No H/Q in entry =           5
  In of MODEL   19
    1    H    MET  40           H        MET  40  -5.902   8.915  18.953
    2    HA   MET  40           HA       MET  40  -7.358   6.964  17.496
    3    HB2  MET  40           HB2      MET  40  -5.767   9.370  16.586
    4    HB3  MET  40           HB3      MET  40  -6.782   8.398  15.517
    5    HG2  MET  40           HG2      MET  40  -7.833   9.647  18.068
    6    HG3  MET  40           HG3      MET  40  -7.894  10.476  16.515
    7    HE3  MET  40           HE1      MET  40 -10.459   8.826  14.451
    8    HE2  MET  40           HE2      MET  40  -8.707   8.958  14.306
    9    HE1  MET  40           HE3      MET  40  -9.638  10.318  14.932

  No H/Q in entry =           9
  In of MODEL   19
    1    H    MET  41           H        MET  41  -3.873   7.733  17.624
    2    HA   MET  41           HA       MET  41  -3.094   5.978  15.532
    3    HB2  MET  41           HB2      MET  41  -1.490   6.669  18.006
    4    HB3  MET  41           HB3      MET  41  -0.863   6.021  16.494
    5    HG2  MET  41           HG2      MET  41  -2.037   8.189  15.479
    6    HG3  MET  41           HG3      MET  41  -1.810   8.785  17.122
    7    HE2  MET  41           HE1      MET  41   1.126   6.715  17.498
    8    HE1  MET  41           HE2      MET  41   0.324   8.005  18.390
    9    HE3  MET  41           HE3      MET  41   1.946   8.261  17.750

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ASP  42           H        ASP  42  -3.483   5.514  19.019
    2    HA   ASP  42           HA       ASP  42  -2.423   2.931  19.191
    3    HB2  ASP  42           HB2      ASP  42  -3.318   4.689  21.005
    4    HB3  ASP  42           HB3      ASP  42  -4.735   3.650  20.933

  No H/Q in entry =           4
  In of MODEL   19
    1    H    GLN  43           H        GLN  43  -5.766   4.001  18.679
    2    HA   GLN  43           HA       GLN  43  -6.884   1.402  18.491
    3    HB2  GLN  43           HB2      GLN  43  -7.830   4.042  17.350
    4    HB3  GLN  43           HB3      GLN  43  -8.779   2.553  17.331
    5    HG2  GLN  43           HG2      GLN  43  -8.490   2.444  19.839
    6    HG3  GLN  43           HG3      GLN  43  -7.781   4.056  19.764
    7   HE21  GLN  43          HE21      GLN  43  -9.964   4.120  21.259
    8   HE22  GLN  43          HE22      GLN  43 -11.328   4.680  20.422

  No H/Q in entry =           8
  In of MODEL   19
    1    H    SER  44           H        SER  44  -5.559   3.620  16.074
    2    HA   SER  44           HA       SER  44  -6.241   2.121  13.788
    3    HB2  SER  44           HB2      SER  44  -5.008   4.518  14.227
    4    HB3  SER  44           HB3      SER  44  -3.643   3.533  13.703
    5    HG   SER  44           HG       SER  44  -4.761   4.488  11.934

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ARG  45           H        ARG  45  -3.367   2.043  15.876
    2    HA   ARG  45           HA       ARG  45  -1.865   0.098  14.505
    3    HB2  ARG  45           HB2      ARG  45  -1.042   1.534  16.371
    4    HB3  ARG  45           HB3      ARG  45  -2.027   0.598  17.492
    5    HG2  ARG  45           HG2      ARG  45  -0.774  -1.451  16.860
    6    HG3  ARG  45           HG3      ARG  45   0.235  -0.490  15.781
    7    HD2  ARG  45           HD2      ARG  45   0.951   0.904  17.733
    8    HD3  ARG  45           HD3      ARG  45   0.036  -0.175  18.808
    9    HE   ARG  45           HE       ARG  45   1.755  -1.761  17.238
   10   HH21  ARG  45          HH11      ARG  45   3.661  -2.562  18.083
   11   HH22  ARG  45          HH12      ARG  45   4.423  -1.764  19.413
   12   HH11  ARG  45          HH21      ARG  45   2.028   0.717  19.619
   13   HH12  ARG  45          HH22      ARG  45   3.498   0.095  20.281

  No H/Q in entry =          13
  In of MODEL   19
    1    H    MET  46           H        MET  46  -4.266  -0.236  17.100
    2    HA   MET  46           HA       MET  46  -4.073  -3.032  17.417
    3    HB2  MET  46           HB2      MET  46  -6.256  -1.039  18.010
    4    HB3  MET  46           HB3      MET  46  -6.460  -2.760  18.345
    5    HG2  MET  46           HG2      MET  46  -4.470  -2.751  19.767
    6    HG3  MET  46           HG3      MET  46  -4.177  -1.059  19.389
    7    HE3  MET  46           HE1      MET  46  -7.838  -2.838  20.414
    8    HE2  MET  46           HE2      MET  46  -7.250  -3.018  22.064
    9    HE1  MET  46           HE3      MET  46  -6.328  -3.700  20.728

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ALA  47           H        ALA  47  -6.106  -1.041  15.310
    2    HA   ALA  47           HA       ALA  47  -7.702  -3.110  14.247
    3    HB3  ALA  47           HB1      ALA  47  -8.401  -0.881  13.822
    4    HB1  ALA  47           HB2      ALA  47  -7.902  -1.515  12.254
    5    HB2  ALA  47           HB3      ALA  47  -6.834  -0.434  13.150

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU  48           H        LEU  48  -4.593  -1.778  13.200
    2    HA   LEU  48           HA       LEU  48  -4.292  -3.374  10.865
    3    HB2  LEU  48           HB2      LEU  48  -2.250  -2.071  12.675
    4    HB3  LEU  48           HB3      LEU  48  -1.871  -2.794  11.111
    5    HG   LEU  48           HG       LEU  48  -3.914  -0.593  11.488
    6   HD13  LEU  48          HD11      LEU  48  -1.801   0.303  12.156
    7   HD12  LEU  48          HD12      LEU  48  -2.076   0.849  10.502
    8   HD11  LEU  48          HD13      LEU  48  -0.968  -0.487  10.818
    9   HD22  LEU  48          HD21      LEU  48  -4.371  -1.588   9.414
   10   HD21  LEU  48          HD22      LEU  48  -2.684  -2.010   9.125
   11   HD23  LEU  48          HD23      LEU  48  -3.217  -0.336   8.958

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ASN  49           H        ASN  49  -3.252  -3.751  14.216
    2    HA   ASN  49           HA       ASN  49  -1.630  -6.002  13.897
    3    HB2  ASN  49           HB2      ASN  49  -1.679  -4.655  15.940
    4    HB3  ASN  49           HB3      ASN  49  -3.330  -5.164  16.264
    5   HD21  ASN  49          HD21      ASN  49  -1.323  -5.649  18.170
    6   HD22  ASN  49          HD22      ASN  49  -1.020  -7.316  18.251

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLU  50           H        GLU  50  -5.103  -5.751  14.558
    2    HA   GLU  50           HA       GLU  50  -5.594  -8.554  14.675
    3    HB2  GLU  50           HB2      GLU  50  -7.195  -6.876  15.541
    4    HB3  GLU  50           HB3      GLU  50  -7.488  -6.319  13.891
    5    HG2  GLU  50           HG2      GLU  50  -8.335  -8.524  13.258
    6    HG3  GLU  50           HG3      GLU  50  -7.954  -9.160  14.855

  No H/Q in entry =           6
  In of MODEL   19
    1    H    ALA  51           H        ALA  51  -5.673  -6.165  12.071
    2    HA   ALA  51           HA       ALA  51  -6.640  -7.907  10.052
    3    HB2  ALA  51           HB1      ALA  51  -6.429  -6.097   8.677
    4    HB1  ALA  51           HB2      ALA  51  -4.793  -5.735   9.229
    5    HB3  ALA  51           HB3      ALA  51  -6.183  -5.230  10.192

  No H/Q in entry =           5
  In of MODEL   19
    1    H    HIS  52           H        HIS  52  -3.358  -6.974  11.042
    2    HA   HIS  52           HA       HIS  52  -1.943  -8.460   9.101
    3    HB2  HIS  52           HB2      HIS  52  -0.935  -6.710  10.550
    4    HB3  HIS  52           HB3      HIS  52  -1.084  -7.799  11.929
    5    HD1  HIS  52           HD1      HIS  52   0.355 -10.028  11.840
    6    HD2  HIS  52           HD2      HIS  52   1.240  -7.251   8.859
    7    HE1  HIS  52           HE1      HIS  52   2.574 -10.731  10.842
    8    HE2  HIS  52           HE2      HIS  52   3.127  -9.048   9.023

  No H/Q in entry =           8
  In of MODEL   19
    1    H    LEU  53           H        LEU  53  -3.159  -9.335  12.313
    2    HA   LEU  53           HA       LEU  53  -1.946 -11.870  12.519
    3    HB2  LEU  53           HB2      LEU  53  -4.440 -10.699  13.723
    4    HB3  LEU  53           HB3      LEU  53  -3.976 -12.372  14.019
    5    HG   LEU  53           HG       LEU  53  -2.086 -10.046  14.497
    6   HD12  LEU  53          HD11      LEU  53  -2.681 -10.384  16.923
    7   HD11  LEU  53          HD12      LEU  53  -4.017 -11.405  16.393
    8   HD13  LEU  53          HD13      LEU  53  -3.983  -9.701  15.955
    9   HD21  LEU  53          HD21      LEU  53  -2.101 -12.987  15.186
   10   HD23  LEU  53          HD22      LEU  53  -1.204 -11.849  16.184
   11   HD22  LEU  53          HD23      LEU  53  -0.792 -12.038  14.490

  No H/Q in entry =          11
  In of MODEL   19
    1    H    VAL  54           H        VAL  54  -5.059 -10.865  11.144
    2    HA   VAL  54           HA       VAL  54  -5.955 -13.466  10.462
    3    HB   VAL  54           HB       VAL  54  -6.615 -10.741   9.317
    4   HG12  VAL  54          HG11      VAL  54  -8.706 -12.134   8.504
    5   HG11  VAL  54          HG12      VAL  54  -7.587 -13.493   8.584
    6   HG13  VAL  54          HG13      VAL  54  -7.232 -12.120   7.538
    7   HG22  VAL  54          HG21      VAL  54  -7.528 -10.777  11.466
    8   HG21  VAL  54          HG22      VAL  54  -7.772 -12.522  11.452
    9   HG23  VAL  54          HG23      VAL  54  -8.856 -11.475  10.539

  No H/Q in entry =           9
  In of MODEL   19
    1    H    GLN  55           H        GLN  55  -4.093 -11.010   8.671
    2    HA   GLN  55           HA       GLN  55  -3.947 -12.481   6.259
    3    HB2  GLN  55           HB2      GLN  55  -3.355 -10.214   6.063
    4    HB3  GLN  55           HB3      GLN  55  -2.248 -10.280   7.432
    5    HG2  GLN  55           HG2      GLN  55  -0.522 -11.120   6.163
    6    HG3  GLN  55           HG3      GLN  55  -1.587 -12.105   5.169
    7   HE21  GLN  55          HE21      GLN  55  -1.602 -11.422   3.046
    8   HE22  GLN  55          HE22      GLN  55  -1.411  -9.818   2.531

  No H/Q in entry =           8
  In of MODEL   19
    1    H    THR  56           H        THR  56  -1.850 -12.439   9.146
    2    HA   THR  56           HA       THR  56   0.240 -14.030   8.240
    3    HB   THR  56           HB       THR  56  -1.010 -14.277  10.985
    4    HG1  THR  56           HG1      THR  56   0.164 -12.172   9.728
    5   HG22  THR  56          HG21      THR  56   1.913 -14.369  10.264
    6   HG21  THR  56          HG22      THR  56   0.907 -15.812  10.137
    7   HG23  THR  56          HG23      THR  56   1.108 -15.011  11.694

  No H/Q in entry =           7
  In of MODEL   19
    1    H    LYS  57           H        LYS  57  -2.878 -15.078   9.597
    2    HA   LYS  57           HA       LYS  57  -2.417 -17.873   9.362
    3    HB2  LYS  57           HB2      LYS  57  -4.247 -16.771  10.694
    4    HB3  LYS  57           HB3      LYS  57  -5.041 -16.359   9.181
    5    HG2  LYS  57           HG2      LYS  57  -5.263 -18.727   8.613
    6    HG3  LYS  57           HG3      LYS  57  -4.403 -19.182  10.081
    7    HD2  LYS  57           HD2      LYS  57  -6.195 -18.142  11.444
    8    HD3  LYS  57           HD3      LYS  57  -7.067 -17.725   9.968
    9    HE2  LYS  57           HE2      LYS  57  -7.250 -20.116   9.385
   10    HE3  LYS  57           HE3      LYS  57  -6.349 -20.558  10.833
   11    HZ1  LYS  57           HZ1      LYS  57  -8.674 -18.851  11.217
   12    HZ3  LYS  57           HZ2      LYS  57  -8.095 -20.138  12.165
   13    HZ2  LYS  57           HZ3      LYS  57  -8.983 -20.454  10.752

  No H/Q in entry =          13
  In of MODEL   19
    1    H    LEU  58           H        LEU  58  -3.754 -15.444   7.174
    2    HA   LEU  58           HA       LEU  58  -4.541 -17.280   5.171
    3    HB2  LEU  58           HB2      LEU  58  -3.949 -14.329   5.028
    4    HB3  LEU  58           HB3      LEU  58  -4.604 -15.273   3.689
    5    HG   LEU  58           HG       LEU  58  -5.893 -15.091   6.432
    6   HD11  LEU  58          HD11      LEU  58  -6.194 -13.454   3.934
    7   HD13  LEU  58          HD12      LEU  58  -6.192 -12.941   5.621
    8   HD12  LEU  58          HD13      LEU  58  -7.608 -13.744   4.947
    9   HD22  LEU  58          HD21      LEU  58  -6.843 -17.008   5.566
   10   HD21  LEU  58          HD22      LEU  58  -6.501 -16.560   3.895
   11   HD23  LEU  58          HD23      LEU  58  -7.870 -15.838   4.739

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  59           H        ILE  59  -1.415 -16.050   6.038
    2    HA   ILE  59           HA       ILE  59  -0.305 -16.781   3.407
    3    HB   ILE  59           HB       ILE  59   0.448 -14.707   4.975
    4   HG12  ILE  59          HG12      ILE  59   2.544 -16.351   3.542
    5   HG13  ILE  59          HG13      ILE  59   1.350 -15.408   2.691
    6   HG23  ILE  59          HG21      ILE  59   2.314 -15.185   6.352
    7   HG22  ILE  59          HG22      ILE  59   2.531 -16.781   5.674
    8   HG21  ILE  59          HG23      ILE  59   1.181 -16.452   6.758
    9   HD11  ILE  59          HD11      ILE  59   3.243 -14.289   4.756
   10   HD13  ILE  59          HD12      ILE  59   2.102 -13.361   3.787
   11   HD12  ILE  59          HD13      ILE  59   3.475 -14.155   3.013

  No H/Q in entry =          11
  In of MODEL   19
    1    H    GLU  60           H        GLU  60  -0.321 -17.876   6.779
    2    HA   GLU  60           HA       GLU  60   1.721 -19.845   6.528
    3    HB2  GLU  60           HB2      GLU  60   0.928 -19.044   8.710
    4    HB3  GLU  60           HB3      GLU  60  -0.658 -19.749   8.403
    5    HG2  GLU  60           HG2      GLU  60   0.354 -21.996   8.291
    6    HG3  GLU  60           HG3      GLU  60   1.947 -21.296   8.573

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLY  61           H        GLY  61  -1.788 -19.962   6.030
    2    HA3  GLY  61           HA2      GLY  61  -1.523 -22.756   5.082
    3    HA2  GLY  61           HA3      GLY  61  -3.014 -22.026   5.668

  No H/Q in entry =           3
  In of MODEL   19
    1    H    ASP  62           H        ASP  62  -0.784 -20.445   3.466
    2    HA   ASP  62           HA       ASP  62  -2.847 -19.840   1.603
    3    HB2  ASP  62           HB2      ASP  62  -0.947 -18.936   0.249
    4    HB3  ASP  62           HB3      ASP  62  -0.995 -18.324   1.899

  No H/Q in entry =           4
  In of MODEL   19
    1    H    ALA  63           H        ALA  63  -0.672 -22.550   1.885
    2    HA   ALA  63           HA       ALA  63  -0.512 -23.372  -0.818
    3    HB2  ALA  63           HB1      ALA  63  -0.225 -25.679   0.200
    4    HB1  ALA  63           HB2      ALA  63  -0.429 -24.902   1.770
    5    HB3  ALA  63           HB3      ALA  63   0.920 -24.445   0.729

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLY  64           H        GLY  64  -2.900 -23.979   1.724
    2    HA3  GLY  64           HA2      GLY  64  -5.051 -24.766   1.673
    3    HA2  GLY  64           HA3      GLY  64  -5.109 -24.212   0.008

  No H/Q in entry =           3
  In of MODEL   19
    1    H    GLU  65           H        GLU  65  -6.555 -26.414   0.567
    2    HA   GLU  65           HA       GLU  65  -5.128 -28.855   0.366
    3    HB2  GLU  65           HB2      GLU  65  -8.011 -28.179  -0.210
    4    HB3  GLU  65           HB3      GLU  65  -7.364 -29.819  -0.234
    5    HG2  GLU  65           HG2      GLU  65  -6.640 -29.592   2.100
    6    HG3  GLU  65           HG3      GLU  65  -7.229 -27.932   2.134

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLY  66           H        GLY  66  -6.510 -26.720  -1.992
    2    HA3  GLY  66           HA2      GLY  66  -6.394 -28.334  -4.291
    3    HA2  GLY  66           HA3      GLY  66  -6.440 -26.582  -4.261

  No H/Q in entry =           3
  In of MODEL   19
    1    H    LYS  67           H        LYS  67  -4.849 -25.696  -5.321
    2    HA   LYS  67           HA       LYS  67  -2.542 -27.134  -6.153
    3    HB2  LYS  67           HB2      LYS  67  -1.960 -25.098  -7.342
    4    HB3  LYS  67           HB3      LYS  67  -3.688 -25.431  -7.522
    5    HG2  LYS  67           HG2      LYS  67  -4.167 -23.886  -5.639
    6    HG3  LYS  67           HG3      LYS  67  -2.448 -23.519  -5.518
    7    HD2  LYS  67           HD2      LYS  67  -2.475 -22.641  -7.828
    8    HD3  LYS  67           HD3      LYS  67  -4.200 -22.997  -7.938
    9    HE2  LYS  67           HE2      LYS  67  -4.642 -21.483  -6.042
   10    HE3  LYS  67           HE3      LYS  67  -2.919 -21.128  -5.921
   11    HZ3  LYS  67           HZ1      LYS  67  -3.531 -19.423  -7.247
   12    HZ2  LYS  67           HZ2      LYS  67  -4.868 -20.244  -7.899
   13    HZ1  LYS  67           HZ3      LYS  67  -3.302 -20.579  -8.467

  No H/Q in entry =          13
  In of MODEL   19
    1    H    MET  68           H        MET  68  -0.367 -26.550  -5.933
    2    HA   MET  68           HA       MET  68   0.531 -26.363  -3.274
    3    HB2  MET  68           HB2      MET  68   1.908 -26.212  -5.942
    4    HB3  MET  68           HB3      MET  68   2.799 -26.089  -4.425
    5    HG2  MET  68           HG2      MET  68   1.155 -28.267  -3.986
    6    HG3  MET  68           HG3      MET  68   1.586 -28.442  -5.688
    7    HE2  MET  68           HE1      MET  68   3.983 -28.295  -1.940
    8    HE1  MET  68           HE2      MET  68   2.702 -27.213  -2.484
    9    HE3  MET  68           HE3      MET  68   4.380 -26.846  -2.875

  No H/Q in entry =           9
  In of MODEL   19
    1    H    LYS  69           H        LYS  69   0.470 -23.909  -5.852
    2    HA   LYS  69           HA       LYS  69   2.025 -21.968  -4.642
    3    HB2  LYS  69           HB2      LYS  69  -0.349 -21.438  -6.410
    4    HB3  LYS  69           HB3      LYS  69   1.021 -20.361  -6.118
    5    HG2  LYS  69           HG2      LYS  69   1.301 -23.161  -7.241
    6    HG3  LYS  69           HG3      LYS  69   1.206 -21.712  -8.244
    7    HD2  LYS  69           HD2      LYS  69   3.160 -20.823  -6.806
    8    HD3  LYS  69           HD3      LYS  69   3.360 -22.499  -6.285
    9    HE2  LYS  69           HE2      LYS  69   3.602 -23.219  -8.619
   10    HE3  LYS  69           HE3      LYS  69   3.345 -21.564  -9.171
   11    HZ2  LYS  69           HZ1      LYS  69   5.648 -22.698  -7.731
   12    HZ1  LYS  69           HZ2      LYS  69   5.307 -21.038  -7.616
   13    HZ3  LYS  69           HZ3      LYS  69   5.628 -21.739  -9.129

  No H/Q in entry =          13
  In of MODEL   19
    1    H    VAL  70           H        VAL  70   0.089 -19.709  -4.807
    2    HA   VAL  70           HA       VAL  70  -1.296 -20.000  -2.205
    3    HB   VAL  70           HB       VAL  70  -0.563 -17.709  -1.626
    4   HG11  VAL  70          HG11      VAL  70   0.772 -19.802  -1.025
    5   HG13  VAL  70          HG12      VAL  70   1.664 -18.280  -0.981
    6   HG12  VAL  70          HG13      VAL  70   1.855 -19.374  -2.351
    7   HG23  VAL  70          HG21      VAL  70   1.491 -16.914  -3.107
    8   HG22  VAL  70          HG22      VAL  70  -0.157 -16.552  -3.616
    9   HG21  VAL  70          HG23      VAL  70   0.713 -17.897  -4.349

  No H/Q in entry =           9
  In of MODEL   19
    1    H    SER  71           H        SER  71  -2.987 -18.404  -1.888
    2    HA   SER  71           HA       SER  71  -4.706 -18.093  -4.128
    3    HB2  SER  71           HB2      SER  71  -5.533 -18.212  -1.779
    4    HB3  SER  71           HB3      SER  71  -4.772 -16.660  -1.446
    5    HG   SER  71           HG       SER  71  -7.161 -17.066  -2.398

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU  72           H        LEU  72  -5.049 -16.380  -5.456
    2    HA   LEU  72           HA       LEU  72  -2.950 -14.557  -5.938
    3    HB2  LEU  72           HB2      LEU  72  -5.813 -14.629  -6.890
    4    HB3  LEU  72           HB3      LEU  72  -4.620 -13.468  -7.467
    5    HG   LEU  72           HG       LEU  72  -4.212 -16.476  -7.590
    6   HD12  LEU  72          HD11      LEU  72  -4.738 -16.211 -10.019
    7   HD11  LEU  72          HD12      LEU  72  -5.228 -14.547  -9.699
    8   HD13  LEU  72          HD13      LEU  72  -6.126 -15.885  -8.981
    9   HD22  LEU  72          HD21      LEU  72  -2.089 -15.501  -7.822
   10   HD21  LEU  72          HD22      LEU  72  -2.710 -14.067  -8.621
   11   HD23  LEU  72          HD23      LEU  72  -2.625 -15.592  -9.497

  No H/Q in entry =          11
  In of MODEL   19
    1    H    VAL  73           H        VAL  73  -6.050 -14.214  -4.316
    2    HA   VAL  73           HA       VAL  73  -6.112 -11.442  -3.973
    3    HB   VAL  73           HB       VAL  73  -7.812 -11.815  -2.354
    4   HG13  VAL  73          HG11      VAL  73  -9.238 -13.451  -3.515
    5   HG12  VAL  73          HG12      VAL  73  -7.827 -14.099  -4.349
    6   HG11  VAL  73          HG13      VAL  73  -8.366 -12.453  -4.679
    7   HG21  VAL  73          HG21      VAL  73  -6.382 -14.429  -1.999
    8   HG23  VAL  73          HG22      VAL  73  -8.109 -14.347  -1.650
    9   HG22  VAL  73          HG23      VAL  73  -6.982 -13.312  -0.774

  No H/Q in entry =           9
  In of MODEL   19
    1    H    LEU  74           H        LEU  74  -4.164 -13.794  -2.378
    2    HA   LEU  74           HA       LEU  74  -3.765 -12.644   0.142
    3    HB2  LEU  74           HB2      LEU  74  -2.967 -14.859  -0.351
    4    HB3  LEU  74           HB3      LEU  74  -1.912 -14.243  -1.622
    5    HG   LEU  74           HG       LEU  74  -0.610 -12.989   0.055
    6   HD13  LEU  74          HD11      LEU  74  -2.175 -12.467   1.763
    7   HD12  LEU  74          HD12      LEU  74  -1.114 -13.668   2.502
    8   HD11  LEU  74          HD13      LEU  74  -2.704 -14.145   1.903
    9   HD23  LEU  74          HD21      LEU  74  -0.836 -15.725   1.194
   10   HD22  LEU  74          HD22      LEU  74   0.574 -14.818   0.697
   11   HD21  LEU  74          HD23      LEU  74  -0.434 -15.575  -0.515

  No H/Q in entry =          11
  In of MODEL   19
    1    H    VAL  75           H        VAL  75  -1.870 -12.247  -2.812
    2    HA   VAL  75           HA       VAL  75  -0.086 -10.309  -1.803
    3    HB   VAL  75           HB       VAL  75  -1.034 -10.802  -4.628
    4   HG11  VAL  75          HG11      VAL  75   1.234  -9.072  -3.543
    5   HG13  VAL  75          HG12      VAL  75  -0.178  -8.512  -4.427
    6   HG12  VAL  75          HG13      VAL  75   1.028  -9.498  -5.238
    7   HG21  VAL  75          HG21      VAL  75   1.403 -11.633  -3.016
    8   HG23  VAL  75          HG22      VAL  75   1.262 -11.852  -4.761
    9   HG22  VAL  75          HG23      VAL  75   0.158 -12.695  -3.675

  No H/Q in entry =           9
  In of MODEL   19
    1    H    GLU  76           H        GLU  76  -3.235  -9.985  -3.468
    2    HA   GLU  76           HA       GLU  76  -3.304  -7.171  -3.577
    3    HB2  GLU  76           HB2      GLU  76  -4.948  -8.677  -4.721
    4    HB3  GLU  76           HB3      GLU  76  -5.631  -9.083  -3.155
    5    HG2  GLU  76           HG2      GLU  76  -6.275  -6.733  -2.800
    6    HG3  GLU  76           HG3      GLU  76  -5.582  -6.282  -4.345

  No H/Q in entry =           6
  In of MODEL   19
    1    H    ALA  77           H        ALA  77  -4.406  -9.399  -1.034
    2    HA   ALA  77           HA       ALA  77  -5.378  -7.399   0.718
    3    HB1  ALA  77           HB1      ALA  77  -4.407 -10.220   1.162
    4    HB3  ALA  77           HB2      ALA  77  -6.064  -9.616   1.172
    5    HB2  ALA  77           HB3      ALA  77  -4.969  -9.206   2.491

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLN  78           H        GLN  78  -2.221  -8.930   0.364
    2    HA   GLN  78           HA       GLN  78  -0.975  -7.757   2.613
    3    HB2  GLN  78           HB2      GLN  78  -0.101  -9.696   1.262
    4    HB3  GLN  78           HB3      GLN  78   0.334  -8.549  -0.002
    5    HG2  GLN  78           HG2      GLN  78   1.779  -7.345   1.588
    6    HG3  GLN  78           HG3      GLN  78   1.351  -8.494   2.852
    7   HE21  GLN  78          HE21      GLN  78   4.073  -8.200   2.028
    8   HE22  GLN  78          HE22      GLN  78   4.549  -9.623   1.232

  No H/Q in entry =           8
  In of MODEL   19
    1    H    LEU  79           H        LEU  79  -1.340  -6.707  -0.737
    2    HA   LEU  79           HA       LEU  79   0.334  -4.471  -0.726
    3    HB2  LEU  79           HB2      LEU  79  -0.684  -5.289  -2.780
    4    HB3  LEU  79           HB3      LEU  79  -2.291  -4.903  -2.176
    5    HG   LEU  79           HG       LEU  79  -1.760  -2.514  -2.155
    6   HD13  LEU  79          HD11      LEU  79   0.478  -2.257  -1.639
    7   HD12  LEU  79          HD12      LEU  79   0.529  -1.974  -3.379
    8   HD11  LEU  79          HD13      LEU  79   0.990  -3.548  -2.727
    9   HD23  LEU  79          HD21      LEU  79  -1.121  -2.318  -4.707
   10   HD22  LEU  79          HD22      LEU  79  -2.645  -3.073  -4.249
   11   HD21  LEU  79          HD23      LEU  79  -1.266  -4.076  -4.688

  No H/Q in entry =          11
  In of MODEL   19
    1    H    HIS  80           H        HIS  80  -3.134  -4.649   0.093
    2    HA   HIS  80           HA       HIS  80  -3.340  -1.892   0.749
    3    HB2  HIS  80           HB2      HIS  80  -5.030  -4.308   1.071
    4    HB3  HIS  80           HB3      HIS  80  -5.359  -2.966   2.171
    5    HD1  HIS  80           HD1      HIS  80  -6.983  -1.340   1.256
    6    HD2  HIS  80           HD2      HIS  80  -4.775  -3.149  -1.783
    7    HE1  HIS  80           HE1      HIS  80  -7.823  -0.352  -0.928
    8    HE2  HIS  80           HE2      HIS  80  -6.484  -1.450  -2.789

  No H/Q in entry =           8
  In of MODEL   19
    1    H    LEU  81           H        LEU  81  -2.841  -4.779   2.751
    2    HA   LEU  81           HA       LEU  81  -2.840  -3.425   5.232
    3    HB2  LEU  81           HB2      LEU  81  -1.608  -6.038   4.361
    4    HB3  LEU  81           HB3      LEU  81  -1.588  -5.475   6.034
    5    HG   LEU  81           HG       LEU  81  -4.129  -5.743   4.402
    6   HD12  LEU  81          HD11      LEU  81  -4.425  -7.806   5.954
    7   HD11  LEU  81          HD12      LEU  81  -2.674  -7.727   6.143
    8   HD13  LEU  81          HD13      LEU  81  -3.378  -7.965   4.543
    9   HD23  LEU  81          HD21      LEU  81  -4.976  -5.943   6.901
   10   HD22  LEU  81          HD22      LEU  81  -4.657  -4.355   6.208
   11   HD21  LEU  81          HD23      LEU  81  -3.469  -5.107   7.272

  No H/Q in entry =          11
  In of MODEL   19
    1    H    MET  82           H        MET  82  -0.151  -4.322   3.069
    2    HA   MET  82           HA       MET  82   1.925  -3.415   4.754
    3    HB2  MET  82           HB2      MET  82   1.717  -3.765   1.762
    4    HB3  MET  82           HB3      MET  82   3.196  -3.186   2.527
    5    HG2  MET  82           HG2      MET  82   1.798  -5.780   3.256
    6    HG3  MET  82           HG3      MET  82   3.171  -5.667   2.158
    7    HE3  MET  82           HE1      MET  82   6.180  -4.914   4.145
    8    HE2  MET  82           HE2      MET  82   5.253  -3.552   3.522
    9    HE1  MET  82           HE3      MET  82   5.349  -5.044   2.590

  No H/Q in entry =           9
  In of MODEL   19
    1    H    THR  83           H        THR  83   0.102  -1.787   2.190
    2    HA   THR  83           HA       THR  83   1.504   0.667   2.272
    3    HB   THR  83           HB       THR  83  -0.674   1.581   1.279
    4    HG1  THR  83           HG1      THR  83  -2.319   0.277   1.173
    5   HG22  THR  83          HG21      THR  83  -0.393  -0.241  -0.716
    6   HG21  THR  83          HG22      THR  83   1.107  -0.526   0.165
    7   HG23  THR  83          HG23      THR  83   0.741   1.084  -0.456

  No H/Q in entry =           7
  In of MODEL   19
    1    H    SER  84           H        SER  84  -1.501  -0.373   3.870
    2    HA   SER  84           HA       SER  84  -2.009   2.059   5.207
    3    HB2  SER  84           HB2      SER  84  -2.833  -0.780   5.778
    4    HB3  SER  84           HB3      SER  84  -3.333   0.562   6.807
    5    HG   SER  84           HG       SER  84  -3.785   0.238   4.014

  No H/Q in entry =           5
  In of MODEL   19
    1    H    MET  85           H        MET  85  -0.291  -0.864   6.348
    2    HA   MET  85           HA       MET  85   0.221   0.072   8.951
    3    HB2  MET  85           HB2      MET  85   0.523  -2.273   8.284
    4    HB3  MET  85           HB3      MET  85   1.902  -1.808   7.286
    5    HG2  MET  85           HG2      MET  85   3.081  -0.968   9.276
    6    HG3  MET  85           HG3      MET  85   1.693  -1.380  10.282
    7    HE1  MET  85           HE1      MET  85   4.249  -2.376   7.868
    8    HE3  MET  85           HE2      MET  85   3.374  -3.783   7.270
    9    HE2  MET  85           HE3      MET  85   4.788  -4.004   8.296

  No H/Q in entry =           9
  In of MODEL   19
    1    H    LEU  86           H        LEU  86   2.160   0.326   6.002
    2    HA   LEU  86           HA       LEU  86   4.368   1.647   7.158
    3    HB2  LEU  86           HB2      LEU  86   4.184   0.558   4.852
    4    HB3  LEU  86           HB3      LEU  86   3.372   2.035   4.334
    5    HG   LEU  86           HG       LEU  86   5.394   3.291   5.315
    6   HD11  LEU  86          HD11      LEU  86   6.107   0.684   6.123
    7   HD13  LEU  86          HD12      LEU  86   7.105   2.132   6.218
    8   HD12  LEU  86          HD13      LEU  86   7.220   1.081   4.810
    9   HD23  LEU  86          HD21      LEU  86   6.121   1.524   2.970
   10   HD22  LEU  86          HD22      LEU  86   6.509   3.223   3.228
   11   HD21  LEU  86          HD23      LEU  86   4.858   2.748   2.828

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ALA  87           H        ALA  87   1.454   2.877   5.565
    2    HA   ALA  87           HA       ALA  87   2.039   5.609   5.642
    3    HB1  ALA  87           HB1      ALA  87  -0.264   3.972   5.102
    4    HB3  ALA  87           HB2      ALA  87   0.043   5.633   4.597
    5    HB2  ALA  87           HB3      ALA  87  -0.753   5.313   6.140

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ARG  88           H        ARG  88   0.352   3.609   8.035
    2    HA   ARG  88           HA       ARG  88  -0.170   5.662   9.875
    3    HB2  ARG  88           HB2      ARG  88  -1.101   3.307   9.946
    4    HB3  ARG  88           HB3      ARG  88   0.440   2.814  10.657
    5    HG2  ARG  88           HG2      ARG  88  -0.046   4.891  12.270
    6    HG3  ARG  88           HG3      ARG  88  -1.711   4.560  11.811
    7    HD2  ARG  88           HD2      ARG  88  -1.814   2.714  13.063
    8    HD3  ARG  88           HD3      ARG  88  -0.222   2.136  12.537
    9    HE   ARG  88           HE       ARG  88  -0.764   3.405  14.986
   10   HH21  ARG  88          HH11      ARG  88   0.788   4.425  16.224
   11   HH22  ARG  88          HH12      ARG  88   2.308   4.855  15.521
   12   HH11  ARG  88          HH21      ARG  88   1.520   3.586  12.413
   13   HH12  ARG  88          HH22      ARG  88   2.730   4.364  13.375

  No H/Q in entry =          13
  In of MODEL   19
    1    H    GLU  89           H        GLU  89   2.634   3.452   9.663
    2    HA   GLU  89           HA       GLU  89   3.889   4.352  12.007
    3    HB2  GLU  89           HB2      GLU  89   4.557   2.332  10.670
    4    HB3  GLU  89           HB3      GLU  89   5.331   3.426   9.522
    5    HG2  GLU  89           HG2      GLU  89   6.810   4.283  11.265
    6    HG3  GLU  89           HG3      GLU  89   5.976   3.327  12.487

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LEU  90           H        LEU  90   4.208   5.501   8.676
    2    HA   LEU  90           HA       LEU  90   6.129   7.511   9.258
    3    HB2  LEU  90           HB2      LEU  90   4.129   7.165   7.029
    4    HB3  LEU  90           HB3      LEU  90   5.354   8.440   7.048
    5    HG   LEU  90           HG       LEU  90   6.039   5.507   7.392
    6   HD12  LEU  90          HD11      LEU  90   6.791   5.736   4.953
    7   HD11  LEU  90          HD12      LEU  90   5.770   7.172   4.898
    8   HD13  LEU  90          HD13      LEU  90   5.055   5.598   5.245
    9   HD22  LEU  90          HD21      LEU  90   7.930   6.666   8.074
   10   HD21  LEU  90          HD22      LEU  90   7.576   8.067   7.062
   11   HD23  LEU  90          HD23      LEU  90   8.243   6.602   6.341

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  91           H        ILE  91   2.591   7.511   9.103
    2    HA   ILE  91           HA       ILE  91   2.236  10.284   9.545
    3    HB   ILE  91           HB       ILE  91   0.454   7.902  10.091
    4   HG12  ILE  91          HG12      ILE  91   0.200  10.176   8.099
    5   HG13  ILE  91          HG13      ILE  91   1.067   8.685   7.733
    6   HG22  ILE  91          HG21      ILE  91  -1.288   9.953  10.145
    7   HG21  ILE  91          HG22      ILE  91   0.109  10.792  10.818
    8   HG23  ILE  91          HG23      ILE  91  -0.523   9.354  11.618
    9   HD13  ILE  91          HD11      ILE  91  -0.872   7.389   7.778
   10   HD12  ILE  91          HD12      ILE  91  -1.467   8.899   7.090
   11   HD11  ILE  91          HD13      ILE  91  -1.739   8.539   8.795

  No H/Q in entry =          11
  In of MODEL   19
    1    H    THR  92           H        THR  92   2.647   7.551  11.755
    2    HA   THR  92           HA       THR  92   2.193   8.930  14.174
    3    HB   THR  92           HB       THR  92   4.013   6.602  13.520
    4    HG1  THR  92           HG1      THR  92   2.048   5.835  13.418
    5   HG22  THR  92          HG21      THR  92   3.626   6.324  16.154
    6   HG21  THR  92          HG22      THR  92   3.553   8.083  16.075
    7   HG23  THR  92          HG23      THR  92   4.991   7.233  15.508

  No H/Q in entry =           7
  In of MODEL   19
    1    H    GLU  93           H        GLU  93   5.150   8.490  12.248
    2    HA   GLU  93           HA       GLU  93   6.893   9.931  13.943
    3    HB2  GLU  93           HB2      GLU  93   6.989   9.607  10.929
    4    HB3  GLU  93           HB3      GLU  93   8.325  10.147  11.945
    5    HG2  GLU  93           HG2      GLU  93   6.928   7.505  12.398
    6    HG3  GLU  93           HG3      GLU  93   8.313   7.660  11.325

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LEU  94           H        LEU  94   4.845  10.926  11.223
    2    HA   LEU  94           HA       LEU  94   5.635  13.634  11.115
    3    HB2  LEU  94           HB2      LEU  94   3.054  12.252  10.360
    4    HB3  LEU  94           HB3      LEU  94   3.303  13.980  10.114
    5    HG   LEU  94           HG       LEU  94   5.334  12.000   9.075
    6   HD11  LEU  94          HD11      LEU  94   2.592  12.532   8.005
    7   HD13  LEU  94          HD12      LEU  94   3.583  11.080   7.886
    8   HD12  LEU  94          HD13      LEU  94   3.913  12.459   6.838
    9   HD23  LEU  94          HD21      LEU  94   5.578  13.832   7.346
   10   HD22  LEU  94          HD22      LEU  94   5.986  14.332   8.987
   11   HD21  LEU  94          HD23      LEU  94   4.434  14.789   8.284

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  95           H        ILE  95   3.103  12.009  13.006
    2    HA   ILE  95           HA       ILE  95   2.043  14.357  14.191
    3    HB   ILE  95           HB       ILE  95   2.075  11.479  15.126
    4   HG12  ILE  95          HG12      ILE  95  -0.153  13.235  14.065
    5   HG13  ILE  95          HG13      ILE  95   0.812  12.178  13.039
    6   HG21  ILE  95          HG21      ILE  95   0.776  13.947  16.316
    7   HG23  ILE  95          HG22      ILE  95   1.829  12.788  17.127
    8   HG22  ILE  95          HG23      ILE  95   0.198  12.315  16.650
    9   HD13  ILE  95          HD11      ILE  95  -0.082  10.238  13.963
   10   HD12  ILE  95          HD12      ILE  95  -1.471  11.319  14.032
   11   HD11  ILE  95          HD13      ILE  95  -0.507  11.031  15.480

  No H/Q in entry =          11
  In of MODEL   19
    1    H    GLU  96           H        GLU  96   4.650  12.158  15.200
    2    HA   GLU  96           HA       GLU  96   5.192  13.368  17.689
    3    HB2  GLU  96           HB2      GLU  96   6.155  11.213  17.051
    4    HB3  GLU  96           HB3      GLU  96   7.086  11.988  15.771
    5    HG2  GLU  96           HG2      GLU  96   8.728  12.552  17.235
    6    HG3  GLU  96           HG3      GLU  96   7.573  13.361  18.285

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LEU  97           H        LEU  97   6.269  14.136  14.403
    2    HA   LEU  97           HA       LEU  97   8.140  16.147  15.112
    3    HB2  LEU  97           HB2      LEU  97   6.558  15.579  12.615
    4    HB3  LEU  97           HB3      LEU  97   7.568  17.017  12.735
    5    HG   LEU  97           HG       LEU  97   8.614  14.228  13.307
    6   HD12  LEU  97          HD11      LEU  97   9.615  14.421  10.991
    7   HD11  LEU  97          HD12      LEU  97   8.555  15.803  10.720
    8   HD13  LEU  97          HD13      LEU  97   7.866  14.208  11.019
    9   HD23  LEU  97          HD21      LEU  97  10.776  15.519  12.564
   10   HD22  LEU  97          HD22      LEU  97  10.152  15.790  14.191
   11   HD21  LEU  97          HD23      LEU  97   9.832  16.967  12.918

  No H/Q in entry =          11
  In of MODEL   19
    1    H    HIS  98           H        HIS  98   4.649  16.256  14.449
    2    HA   HIS  98           HA       HIS  98   4.330  19.054  14.574
    3    HB2  HIS  98           HB2      HIS  98   2.454  16.793  15.303
    4    HB3  HIS  98           HB3      HIS  98   1.975  18.490  15.352
    5    HD1  HIS  98           HD1      HIS  98   3.021  15.774  12.959
    6    HD2  HIS  98           HD2      HIS  98   1.618  19.697  12.820
    7    HE1  HIS  98           HE1      HIS  98   2.465  16.250  10.532
    8    HE2  HIS  98           HE2      HIS  98   1.613  18.633  10.426

  No H/Q in entry =           8
  In of MODEL   19
    1    H    GLU  99           H        GLU  99   4.475  16.575  17.082
    2    HA   GLU  99           HA       GLU  99   3.850  18.273  19.272
    3    HB2  GLU  99           HB2      GLU  99   3.778  15.791  19.378
    4    HB3  GLU  99           HB3      GLU  99   5.539  15.758  19.274
    5    HG2  GLU  99           HG2      GLU  99   5.713  17.058  21.344
    6    HG3  GLU  99           HG3      GLU  99   3.959  17.187  21.435

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LYS 100           H        LYS 100   6.914  17.358  17.718
    2    HA   LYS 100           HA       LYS 100   8.554  18.777  19.574
    3    HB2  LYS 100           HB2      LYS 100   9.066  17.846  16.739
    4    HB3  LYS 100           HB3      LYS 100  10.288  18.628  17.748
    5    HG2  LYS 100           HG2      LYS 100   9.920  16.881  19.494
    6    HG3  LYS 100           HG3      LYS 100   8.797  16.066  18.403
    7    HD2  LYS 100           HD2      LYS 100  10.597  15.790  16.741
    8    HD3  LYS 100           HD3      LYS 100  11.725  16.617  17.817
    9    HE2  LYS 100           HE2      LYS 100  11.337  14.865  19.540
   10    HE3  LYS 100           HE3      LYS 100  10.271  14.018  18.415
   11    HZ1  LYS 100           HZ1      LYS 100  13.088  14.705  17.764
   12    HZ3  LYS 100           HZ2      LYS 100  12.054  13.640  16.937
   13    HZ2  LYS 100           HZ3      LYS 100  12.641  13.230  18.479

  No H/Q in entry =          13
  In of MODEL   19
    1    H    LEU 101           H        LEU 101   6.861  19.682  16.611
    2    HA   LEU 101           HA       LEU 101   8.058  22.246  16.270
    3    HB2  LEU 101           HB2      LEU 101   5.473  20.991  15.382
    4    HB3  LEU 101           HB3      LEU 101   5.713  22.723  15.169
    5    HG   LEU 101           HG       LEU 101   7.765  20.718  14.215
    6   HD12  LEU 101          HD11      LEU 101   6.614  21.208  11.925
    7   HD11  LEU 101          HD12      LEU 101   5.209  21.632  12.901
    8   HD13  LEU 101          HD13      LEU 101   5.885  20.006  12.990
    9   HD21  LEU 101          HD21      LEU 101   7.118  23.624  13.648
   10   HD23  LEU 101          HD22      LEU 101   8.108  22.667  12.547
   11   HD22  LEU 101          HD23      LEU 101   8.644  22.934  14.205

  No H/Q in entry =          11
  In of MODEL   19
    1    H    LYS 102           H        LYS 102   6.523  21.106  18.886
    2    HA   LYS 102           HA       LYS 102   5.878  22.200  20.813
    3    HB2  LYS 102           HB2      LYS 102   7.150  24.195  19.685
    4    HB3  LYS 102           HB3      LYS 102   5.548  24.788  19.304
    5    HG2  LYS 102           HG2      LYS 102   6.920  24.550  21.960
    6    HG3  LYS 102           HG3      LYS 102   5.960  25.870  21.324
    7    HD2  LYS 102           HD2      LYS 102   4.732  23.229  22.209
    8    HD3  LYS 102           HD3      LYS 102   4.969  24.595  23.288
    9    HE2  LYS 102           HE2      LYS 102   2.696  24.172  21.796
   10    HE3  LYS 102           HE3      LYS 102   3.187  25.723  22.473
   11    HZ2  LYS 102           HZ1      LYS 102   2.661  25.819  20.092
   12    HZ1  LYS 102           HZ2      LYS 102   3.931  24.745  19.776
   13    HZ3  LYS 102           HZ3      LYS 102   4.262  26.280  20.414

  No H/Q in entry =          13
  In of MODEL   19
    1    H    ALA 103           H        ALA 103   4.237  23.723  18.037
    2    HA   ALA 103           HA       ALA 103   1.776  24.286  18.914
    3    HB1  ALA 103           HB1      ALA 103   0.889  23.431  16.673
    4    HB2  ALA 103           HB2      ALA 103   2.540  22.904  16.349
    5    HB3  ALA 103           HB3      ALA 103   2.194  24.614  16.609

  No H/Q in entry =           5
  In of MODEL   19
    1    H1   ALA   1           H3       ALA   1  10.727 -20.239  -6.193
    2    H2   ALA   1           H2       ALA   1   9.767 -20.456  -7.581
    3    H3   ALA   1           H1       ALA   1   9.331 -21.200  -6.116
    4    HA   ALA   1           HA       ALA   1  10.383 -23.005  -6.848
    5    HB1  ALA   1           HB1      ALA   1  10.482 -22.652  -9.124
    6    HB2  ALA   1           HB2      ALA   1  12.207 -22.491  -8.792
    7    HB3  ALA   1           HB3      ALA   1  11.201 -21.050  -8.950

  No H/Q in entry =           7
  In of MODEL   19
    1    H    GLU   2           H        GLU   2  12.673 -23.942  -6.898
    2    HA   GLU   2           HA       GLU   2  14.049 -23.845  -4.683
    3    HB2  GLU   2           HB2      GLU   2  15.410 -23.714  -7.380
    4    HB3  GLU   2           HB3      GLU   2  16.139 -24.316  -5.892
    5    HG2  GLU   2           HG2      GLU   2  15.134 -26.340  -6.128
    6    HG3  GLU   2           HG3      GLU   2  13.559 -25.604  -6.392

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLU   3           H        GLU   3  15.814 -21.978  -7.087
    2    HA   GLU   3           HA       GLU   3  16.954 -20.278  -5.131
    3    HB2  GLU   3           HB2      GLU   3  16.904 -20.285  -8.141
    4    HB3  GLU   3           HB3      GLU   3  17.640 -18.949  -7.256
    5    HG2  GLU   3           HG2      GLU   3  19.309 -20.311  -6.326
    6    HG3  GLU   3           HG3      GLU   3  18.371 -21.784  -6.544

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LEU   4           H        LEU   4  14.672 -19.451  -7.769
    2    HA   LEU   4           HA       LEU   4  14.190 -16.843  -7.167
    3    HB2  LEU   4           HB2      LEU   4  12.027 -18.833  -7.895
    4    HB3  LEU   4           HB3      LEU   4  11.943 -17.085  -8.099
    5    HG   LEU   4           HG       LEU   4  13.920 -18.941  -9.462
    6   HD13  LEU   4          HD11      LEU   4  12.621 -18.806 -11.375
    7   HD12  LEU   4          HD12      LEU   4  11.904 -17.264 -10.914
    8   HD11  LEU   4          HD13      LEU   4  11.357 -18.755 -10.149
    9   HD23  LEU   4          HD21      LEU   4  14.247 -16.698 -10.820
   10   HD22  LEU   4          HD22      LEU   4  15.105 -16.931  -9.298
   11   HD21  LEU   4          HD23      LEU   4  13.647 -15.943  -9.343

  No H/Q in entry =          11
  In of MODEL   19
    1    H    GLU   5           H        GLU   5  12.717 -19.630  -5.518
    2    HA   GLU   5           HA       GLU   5  11.028 -18.063  -3.824
    3    HB2  GLU   5           HB2      GLU   5  10.635 -20.455  -4.348
    4    HB3  GLU   5           HB3      GLU   5  12.052 -20.867  -3.381
    5    HG2  GLU   5           HG2      GLU   5  10.130 -21.106  -1.953
    6    HG3  GLU   5           HG3      GLU   5  10.981 -19.645  -1.450

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLU   6           H        GLU   6  14.182 -19.623  -3.370
    2    HA   GLU   6           HA       GLU   6  14.525 -18.756  -0.674
    3    HB2  GLU   6           HB2      GLU   6  15.764 -20.667  -1.655
    4    HB3  GLU   6           HB3      GLU   6  16.622 -19.545  -2.714
    5    HG2  GLU   6           HG2      GLU   6  17.538 -18.375  -0.757
    6    HG3  GLU   6           HG3      GLU   6  16.658 -19.461   0.318

  No H/Q in entry =           6
  In of MODEL   19
    1    H    VAL   7           H        VAL   7  15.289 -17.435  -3.826
    2    HA   VAL   7           HA       VAL   7  16.960 -15.296  -2.965
    3    HB   VAL   7           HB       VAL   7  15.261 -15.677  -5.444
    4   HG11  VAL   7          HG11      VAL   7  17.140 -13.450  -4.636
    5   HG13  VAL   7          HG12      VAL   7  15.498 -13.320  -5.263
    6   HG12  VAL   7          HG13      VAL   7  16.812 -13.818  -6.329
    7   HG21  VAL   7          HG21      VAL   7  17.376 -17.119  -4.867
    8   HG23  VAL   7          HG22      VAL   7  18.273 -15.654  -5.268
    9   HG22  VAL   7          HG23      VAL   7  17.243 -16.414  -6.479

  No H/Q in entry =           9
  In of MODEL   19
    1    H    VAL   8           H        VAL   8  13.471 -15.589  -3.528
    2    HA   VAL   8           HA       VAL   8  12.787 -12.883  -3.066
    3    HB   VAL   8           HB       VAL   8  11.201 -15.430  -2.652
    4   HG12  VAL   8          HG11      VAL   8   9.251 -13.703  -2.806
    5   HG11  VAL   8          HG12      VAL   8  10.469 -12.525  -2.318
    6   HG13  VAL   8          HG13      VAL   8  10.092 -13.889  -1.268
    7   HG23  VAL   8          HG21      VAL   8  10.473 -13.497  -4.786
    8   HG22  VAL   8          HG22      VAL   8  10.604 -15.251  -4.857
    9   HG21  VAL   8          HG23      VAL   8  12.048 -14.256  -5.007

  No H/Q in entry =           9
  In of MODEL   19
    1    H    MET   9           H        MET   9  13.068 -15.680  -0.877
    2    HA   MET   9           HA       MET   9  12.240 -14.406   1.488
    3    HB2  MET   9           HB2      MET   9  14.171 -16.665   0.965
    4    HB3  MET   9           HB3      MET   9  13.844 -16.087   2.599
    5    HG2  MET   9           HG2      MET   9  11.425 -16.493   2.247
    6    HG3  MET   9           HG3      MET   9  11.775 -17.109   0.632
    7    HE1  MET   9           HE1      MET   9  12.590 -17.125   4.197
    8    HE3  MET   9           HE2      MET   9  13.063 -18.757   4.660
    9    HE2  MET   9           HE3      MET   9  11.360 -18.377   4.423

  No H/Q in entry =           9
  In of MODEL   19
    1    H    GLY  10           H        GLY  10  15.425 -14.614  -0.061
    2    HA3  GLY  10           HA2      GLY  10  16.870 -13.177   1.907
    3    HA2  GLY  10           HA3      GLY  10  17.338 -13.345   0.215

  No H/Q in entry =           3
  In of MODEL   19
    1    H    LEU  11           H        LEU  11  15.164 -12.143  -1.033
    2    HA   LEU  11           HA       LEU  11  15.829  -9.393  -0.877
    3    HB2  LEU  11           HB2      LEU  11  13.474 -10.823  -2.112
    4    HB3  LEU  11           HB3      LEU  11  13.742  -9.087  -2.277
    5    HG   LEU  11           HG       LEU  11  15.786 -11.184  -3.054
    6   HD13  LEU  11          HD11      LEU  11  14.046 -11.568  -4.576
    7   HD12  LEU  11          HD12      LEU  11  15.042 -10.382  -5.418
    8   HD11  LEU  11          HD13      LEU  11  13.563  -9.872  -4.605
    9   HD22  LEU  11          HD21      LEU  11  17.003  -9.211  -2.832
   10   HD21  LEU  11          HD22      LEU  11  15.621  -8.185  -3.217
   11   HD23  LEU  11          HD23      LEU  11  16.461  -9.052  -4.501

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  12           H        ILE  12  13.071 -11.235   0.391
    2    HA   ILE  12           HA       ILE  12  11.659  -9.018   1.440
    3    HB   ILE  12           HB       ILE  12  11.716 -11.896   2.403
    4   HG12  ILE  12          HG12      ILE  12  11.034 -11.279  -0.052
    5   HG13  ILE  12          HG13      ILE  12  10.019 -12.378   0.859
    6   HG22  ILE  12          HG21      ILE  12   9.437 -11.335   3.318
    7   HG21  ILE  12          HG22      ILE  12   9.748  -9.643   2.936
    8   HG23  ILE  12          HG23      ILE  12  10.752 -10.479   4.120
    9   HD11  ILE  12          HD11      ILE  12   9.555  -9.393   0.621
   10   HD13  ILE  12          HD12      ILE  12   8.474 -10.574   1.358
   11   HD12  ILE  12          HD13      ILE  12   8.757 -10.603  -0.368

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  13           H        ILE  13  14.066 -11.200   2.858
    2    HA   ILE  13           HA       ILE  13  14.087 -10.012   5.435
    3    HB   ILE  13           HB       ILE  13  16.170 -11.566   3.880
    4   HG12  ILE  13          HG12      ILE  13  13.891 -12.552   4.703
    5   HG13  ILE  13          HG13      ILE  13  15.373 -13.466   4.970
    6   HG23  ILE  13          HG21      ILE  13  17.583 -10.551   5.400
    7   HG22  ILE  13          HG22      ILE  13  17.040 -11.906   6.382
    8   HG21  ILE  13          HG23      ILE  13  16.314 -10.314   6.600
    9   HD13  ILE  13          HD11      ILE  13  15.487 -12.701   7.289
   10   HD12  ILE  13          HD12      ILE  13  13.881 -13.356   6.986
   11   HD11  ILE  13          HD13      ILE  13  14.125 -11.614   7.023

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ASN  14           H        ASN  14  16.042  -9.473   2.519
    2    HA   ASN  14           HA       ASN  14  17.766  -7.513   3.578
    3    HB2  ASN  14           HB2      ASN  14  17.760  -8.787   1.266
    4    HB3  ASN  14           HB3      ASN  14  16.856  -7.380   0.722
    5   HD21  ASN  14          HD21      ASN  14  19.302  -7.701  -0.457
    6   HD22  ASN  14          HD22      ASN  14  20.433  -6.605   0.169

  No H/Q in entry =           6
  In of MODEL   19
    1    H    SER  15           H        SER  15  14.656  -7.200   1.877
    2    HA   SER  15           HA       SER  15  14.517  -4.381   1.924
    3    HB2  SER  15           HB2      SER  15  12.187  -4.651   1.427
    4    HB3  SER  15           HB3      SER  15  13.000  -6.009   0.659
    5    HG   SER  15           HG       SER  15  11.278  -5.943   2.820

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLY  16           H        GLY  16  13.443  -6.843   4.234
    2    HA3  GLY  16           HA2      GLY  16  12.200  -5.101   6.083
    3    HA2  GLY  16           HA3      GLY  16  12.830  -6.702   6.451

  No H/Q in entry =           3
  In of MODEL   19
    1    H    GLN  17           H        GLN  17  15.539  -6.344   5.864
    2    HA   GLN  17           HA       GLN  17  16.478  -5.106   8.243
    3    HB2  GLN  17           HB2      GLN  17  17.733  -6.887   7.071
    4    HB3  GLN  17           HB3      GLN  17  18.019  -5.788   5.720
    5    HG2  GLN  17           HG2      GLN  17  19.289  -4.284   7.139
    6    HG3  GLN  17           HG3      GLN  17  18.889  -5.233   8.569
    7   HE21  GLN  17          HE21      GLN  17  21.611  -4.790   7.844
    8   HE22  GLN  17          HE22      GLN  17  22.284  -6.267   7.348

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ALA  18           H        ALA  18  16.286  -4.041   4.879
    2    HA   ALA  18           HA       ALA  18  17.697  -1.633   5.101
    3    HB1  ALA  18           HB1      ALA  18  16.596  -2.866   3.035
    4    HB3  ALA  18           HB2      ALA  18  16.843  -1.120   3.015
    5    HB2  ALA  18           HB3      ALA  18  15.250  -1.781   3.382

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ARG  19           H        ARG  19  14.202  -2.255   5.492
    2    HA   ARG  19           HA       ARG  19  13.506   0.390   6.196
    3    HB2  ARG  19           HB2      ARG  19  11.844  -1.381   5.612
    4    HB3  ARG  19           HB3      ARG  19  12.190  -2.170   7.152
    5    HG2  ARG  19           HG2      ARG  19  11.456  -0.182   8.383
    6    HG3  ARG  19           HG3      ARG  19  11.201   0.687   6.871
    7    HD2  ARG  19           HD2      ARG  19   9.066  -0.129   7.689
    8    HD3  ARG  19           HD3      ARG  19   9.497  -1.009   6.216
    9    HE   ARG  19           HE       ARG  19  10.467  -2.535   8.329
   10   HH21  ARG  19          HH11      ARG  19   9.232  -4.185   9.270
   11   HH22  ARG  19          HH12      ARG  19   7.513  -4.176   9.095
   12   HH11  ARG  19          HH21      ARG  19   7.462  -1.277   7.222
   13   HH12  ARG  19          HH22      ARG  19   6.511  -2.529   7.931

  No H/Q in entry =          13
  In of MODEL   19
    1    H    SER  20           H        SER  20  14.388  -2.425   8.167
    2    HA   SER  20           HA       SER  20  14.087  -1.320  10.700
    3    HB2  SER  20           HB2      SER  20  14.577  -3.640  10.588
    4    HB3  SER  20           HB3      SER  20  16.029  -3.366   9.627
    5    HG   SER  20           HG       SER  20  15.566  -2.925  12.367

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU  21           H        LEU  21  16.935  -1.236   8.571
    2    HA   LEU  21           HA       LEU  21  18.589   0.273  10.308
    3    HB2  LEU  21           HB2      LEU  21  18.578  -0.009   7.295
    4    HB3  LEU  21           HB3      LEU  21  19.821   0.867   8.185
    5    HG   LEU  21           HG       LEU  21  19.111  -2.029   8.735
    6   HD11  LEU  21          HD11      LEU  21  21.236  -0.824   6.944
    7   HD13  LEU  21          HD12      LEU  21  19.953  -1.942   6.482
    8   HD12  LEU  21          HD13      LEU  21  21.275  -2.495   7.507
    9   HD22  LEU  21          HD21      LEU  21  20.272  -1.314  10.630
   10   HD21  LEU  21          HD22      LEU  21  21.202  -0.107   9.748
   11   HD23  LEU  21          HD23      LEU  21  21.624  -1.805   9.616

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ALA  22           H        ALA  22  16.322   1.210   7.743
    2    HA   ALA  22           HA       ALA  22  16.832   3.974   7.750
    3    HB3  ALA  22           HB1      ALA  22  15.447   2.712   6.072
    4    HB2  ALA  22           HB2      ALA  22  14.723   4.219   6.632
    5    HB1  ALA  22           HB3      ALA  22  14.147   2.676   7.263

  No H/Q in entry =           5
  In of MODEL   19
    1    H    TYR  23           H        TYR  23  14.349   2.138   9.584
    2    HA   TYR  23           HA       TYR  23  13.360   4.370  11.024
    3    HB2  TYR  23           HB2      TYR  23  12.147   2.243  11.006
    4    HB3  TYR  23           HB3      TYR  23  13.484   1.450  11.838
    5    HD1  TYR  23           HD1      TYR  23  10.963   4.181  12.185
    6    HD2  TYR  23           HD2      TYR  23  13.661   1.509  14.193
    7    HE1  TYR  23           HE1      TYR  23  10.020   4.873  14.374
    8    HE2  TYR  23           HE2      TYR  23  12.718   2.200  16.380
    9    HH   TYR  23           HH       TYR  23  10.169   4.686  16.580

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ALA  24           H        ALA  24  16.026   2.123  11.675
    2    HA   ALA  24           HA       ALA  24  16.680   3.133  14.237
    3    HB1  ALA  24           HB1      ALA  24  18.054   1.353  14.082
    4    HB3  ALA  24           HB2      ALA  24  19.076   2.281  12.983
    5    HB2  ALA  24           HB3      ALA  24  17.793   1.258  12.341

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA  25           H        ALA  25  17.636   4.061  10.958
    2    HA   ALA  25           HA       ALA  25  19.561   6.017  11.603
    3    HB1  ALA  25           HB1      ALA  25  18.860   5.054   9.288
    4    HB3  ALA  25           HB2      ALA  25  19.345   6.747   9.377
    5    HB2  ALA  25           HB3      ALA  25  17.634   6.323   9.305

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU  26           H        LEU  26  16.045   6.210  11.231
    2    HA   LEU  26           HA       LEU  26  15.793   8.991  11.673
    3    HB2  LEU  26           HB2      LEU  26  13.946   7.735  10.744
    4    HB3  LEU  26           HB3      LEU  26  13.861   6.711  12.172
    5    HG   LEU  26           HG       LEU  26  13.233   8.667  13.545
    6   HD12  LEU  26          HD11      LEU  26  12.556  10.758  12.211
    7   HD11  LEU  26          HD12      LEU  26  13.546  10.110  10.906
    8   HD13  LEU  26          HD13      LEU  26  14.283  10.507  12.459
    9   HD21  LEU  26          HD21      LEU  26  11.567   8.331  11.032
   10   HD23  LEU  26          HD22      LEU  26  10.996   9.028  12.545
   11   HD22  LEU  26          HD23      LEU  26  11.464   7.331  12.481

  No H/Q in entry =          11
  In of MODEL   19
    1    H    LYS  27           H        LYS  27  15.705   6.218  13.874
    2    HA   LYS  27           HA       LYS  27  15.094   7.586  16.237
    3    HB2  LYS  27           HB2      LYS  27  15.145   5.110  15.980
    4    HB3  LYS  27           HB3      LYS  27  16.908   5.178  15.941
    5    HG2  LYS  27           HG2      LYS  27  16.943   6.171  18.187
    6    HG3  LYS  27           HG3      LYS  27  15.176   6.174  18.228
    7    HD2  LYS  27           HD2      LYS  27  15.173   3.706  17.999
    8    HD3  LYS  27           HD3      LYS  27  16.938   3.711  17.992
    9    HE2  LYS  27           HE2      LYS  27  16.957   4.707  20.246
   10    HE3  LYS  27           HE3      LYS  27  15.191   4.732  20.256
   11    HZ3  LYS  27           HZ1      LYS  27  15.993   2.790  21.414
   12    HZ2  LYS  27           HZ2      LYS  27  16.917   2.315  20.067
   13    HZ1  LYS  27           HZ3      LYS  27  15.219   2.305  19.983

  No H/Q in entry =          13
  In of MODEL   19
    1    H    GLN  28           H        GLN  28  18.219   7.025  14.655
    2    HA   GLN  28           HA       GLN  28  19.889   8.129  16.646
    3    HB2  GLN  28           HB2      GLN  28  20.187   8.082  13.632
    4    HB3  GLN  28           HB3      GLN  28  21.467   8.559  14.747
    5    HG2  GLN  28           HG2      GLN  28  20.060   5.875  14.785
    6    HG3  GLN  28           HG3      GLN  28  21.642   6.169  14.067
    7   HE21  GLN  28          HE21      GLN  28  20.348   4.874  16.781
    8   HE22  GLN  28          HE22      GLN  28  21.542   5.290  17.912

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ALA  29           H        ALA  29  18.132   9.589  13.945
    2    HA   ALA  29           HA       ALA  29  19.109  12.219  14.192
    3    HB2  ALA  29           HB1      ALA  29  17.409  12.838  12.715
    4    HB1  ALA  29           HB2      ALA  29  16.273  11.657  13.366
    5    HB3  ALA  29           HB3      ALA  29  17.610  11.122  12.348

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LYS  30           H        LYS  30  16.341  10.602  15.711
    2    HA   LYS  30           HA       LYS  30  15.306  12.852  17.059
    3    HB2  LYS  30           HB2      LYS  30  15.215   9.912  17.771
    4    HB3  LYS  30           HB3      LYS  30  14.337  11.159  18.659
    5    HG2  LYS  30           HG2      LYS  30  13.213  11.830  16.535
    6    HG3  LYS  30           HG3      LYS  30  14.030  10.497  15.715
    7    HD2  LYS  30           HD2      LYS  30  12.966   8.887  17.245
    8    HD3  LYS  30           HD3      LYS  30  12.159  10.209  18.090
    9    HE2  LYS  30           HE2      LYS  30  10.992  10.826  15.993
   10    HE3  LYS  30           HE3      LYS  30  11.778   9.476  15.168
   11    HZ2  LYS  30           HZ1      LYS  30   9.471   9.052  16.043
   12    HZ1  LYS  30           HZ2      LYS  30  10.134   9.115  17.612
   13    HZ3  LYS  30           HZ3      LYS  30  10.654   7.930  16.506

  No H/Q in entry =          13
  In of MODEL   19
    1    H    GLN  31           H        GLN  31  17.981  10.704  17.809
    2    HA   GLN  31           HA       GLN  31  18.294  11.729  20.501
    3    HB2  GLN  31           HB2      GLN  31  20.332  10.168  18.906
    4    HB3  GLN  31           HB3      GLN  31  20.193  10.296  20.660
    5    HG2  GLN  31           HG2      GLN  31  17.688   9.324  19.888
    6    HG3  GLN  31           HG3      GLN  31  18.798   8.484  18.813
    7   HE21  GLN  31          HE21      GLN  31  17.258   7.334  21.089
    8   HE22  GLN  31          HE22      GLN  31  18.416   6.684  22.144

  No H/Q in entry =           8
  In of MODEL   19
    1    H    GLY  32           H        GLY  32  18.811  13.041  17.532
    2    HA3  GLY  32           HA2      GLY  32  19.782  15.092  17.015
    3    HA2  GLY  32           HA3      GLY  32  20.536  15.107  18.604

  No H/Q in entry =           3
  In of MODEL   19
    1    H    ASP  33           H        ASP  33  20.983  12.212  16.837
    2    HA   ASP  33           HA       ASP  33  23.805  12.906  16.376
    3    HB2  ASP  33           HB2      ASP  33  22.315  10.280  16.496
    4    HB3  ASP  33           HB3      ASP  33  24.001  10.407  16.005

  No H/Q in entry =           4
  In of MODEL   19
    1    H    PHE  34           H        PHE  34  23.318  14.220  14.489
    2    HA   PHE  34           HA       PHE  34  21.982  13.220  12.202
    3    HB2  PHE  34           HB2      PHE  34  24.097  15.370  12.431
    4    HB3  PHE  34           HB3      PHE  34  23.118  15.068  10.997
    5    HD1  PHE  34           HD1      PHE  34  23.347  17.013  13.906
    6    HD2  PHE  34           HD2      PHE  34  20.491  14.869  11.519
    7    HE1  PHE  34           HE1      PHE  34  21.518  18.400  14.844
    8    HE2  PHE  34           HE2      PHE  34  18.666  16.256  12.460
    9    HZ   PHE  34           HZ       PHE  34  19.183  18.022  14.119

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ALA  35           H        ALA  35  25.356  13.060  13.219
    2    HA   ALA  35           HA       ALA  35  26.473  12.240  10.767
    3    HB3  ALA  35           HB1      ALA  35  28.158  11.088  12.494
    4    HB2  ALA  35           HB2      ALA  35  27.284  12.111  13.635
    5    HB1  ALA  35           HB3      ALA  35  28.119  12.836  12.262

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA  36           H        ALA  36  25.366  10.284  13.535
    2    HA   ALA  36           HA       ALA  36  25.872   7.796  12.268
    3    HB2  ALA  36           HB1      ALA  36  25.442   7.053  14.345
    4    HB3  ALA  36           HB2      ALA  36  23.751   7.534  14.189
    5    HB1  ALA  36           HB3      ALA  36  24.941   8.677  14.812

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA  37           H        ALA  37  23.034   9.900  12.389
    2    HA   ALA  37           HA       ALA  37  21.195   8.112  11.213
    3    HB3  ALA  37           HB1      ALA  37  21.396  11.078  11.497
    4    HB1  ALA  37           HB2      ALA  37  20.091   9.990  11.970
    5    HB2  ALA  37           HB3      ALA  37  20.281  10.459  10.279

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LYS  38           H        LYS  38  23.277  10.587   9.733
    2    HA   LYS  38           HA       LYS  38  22.648  10.146   7.055
    3    HB2  LYS  38           HB2      LYS  38  24.441  11.722   8.500
    4    HB3  LYS  38           HB3      LYS  38  25.485  10.738   7.480
    5    HG2  LYS  38           HG2      LYS  38  24.319  11.493   5.478
    6    HG3  LYS  38           HG3      LYS  38  23.115  12.341   6.454
    7    HD2  LYS  38           HD2      LYS  38  24.695  13.955   7.206
    8    HD3  LYS  38           HD3      LYS  38  26.064  12.979   6.676
    9    HE2  LYS  38           HE2      LYS  38  25.696  14.842   5.118
   10    HE3  LYS  38           HE3      LYS  38  25.376  13.300   4.318
   11    HZ3  LYS  38           HZ1      LYS  38  23.176  13.725   4.181
   12    HZ2  LYS  38           HZ2      LYS  38  23.684  15.345   4.265
   13    HZ1  LYS  38           HZ3      LYS  38  23.113  14.560   5.658

  No H/Q in entry =          13
  In of MODEL   19
    1    H    ALA  39           H        ALA  39  25.171   8.576   9.022
    2    HA   ALA  39           HA       ALA  39  26.260   6.990   6.960
    3    HB2  ALA  39           HB1      ALA  39  26.172   6.035   9.806
    4    HB1  ALA  39           HB2      ALA  39  27.113   7.467   9.388
    5    HB3  ALA  39           HB3      ALA  39  27.480   5.918   8.630

  No H/Q in entry =           5
  In of MODEL   19
    1    H    MET  40           H        MET  40  23.646   6.358   9.253
    2    HA   MET  40           HA       MET  40  23.230   3.647   8.526
    3    HB2  MET  40           HB2      MET  40  21.391   5.678   9.808
    4    HB3  MET  40           HB3      MET  40  21.001   3.965   9.637
    5    HG2  MET  40           HG2      MET  40  23.538   4.933  10.981
    6    HG3  MET  40           HG3      MET  40  22.044   4.646  11.872
    7    HE3  MET  40           HE1      MET  40  21.514   1.008  12.057
    8    HE2  MET  40           HE2      MET  40  20.635   2.300  11.243
    9    HE1  MET  40           HE3      MET  40  21.369   2.599  12.817

  No H/Q in entry =           9
  In of MODEL   19
    1    H    MET  41           H        MET  41  21.791   6.683   7.326
    2    HA   MET  41           HA       MET  41  19.849   5.465   5.653
    3    HB2  MET  41           HB2      MET  41  21.307   8.068   5.136
    4    HB3  MET  41           HB3      MET  41  19.786   7.558   4.415
    5    HG2  MET  41           HG2      MET  41  19.035   7.370   6.965
    6    HG3  MET  41           HG3      MET  41  20.333   8.540   7.187
    7    HE2  MET  41           HE1      MET  41  19.766   9.813   3.845
    8    HE1  MET  41           HE2      MET  41  20.715  10.266   5.257
    9    HE3  MET  41           HE3      MET  41  19.434  11.331   4.687

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ASP  42           H        ASP  42  23.214   6.419   5.105
    2    HA   ASP  42           HA       ASP  42  23.317   5.937   2.349
    3    HB2  ASP  42           HB2      ASP  42  25.055   6.956   4.120
    4    HB3  ASP  42           HB3      ASP  42  25.727   5.337   3.999

  No H/Q in entry =           4
  In of MODEL   19
    1    H    GLN  43           H        GLN  43  24.055   3.797   5.078
    2    HA   GLN  43           HA       GLN  43  24.745   1.542   3.504
    3    HB2  GLN  43           HB2      GLN  43  23.714   1.724   6.344
    4    HB3  GLN  43           HB3      GLN  43  24.309   0.238   5.595
    5    HG2  GLN  43           HG2      GLN  43  26.461   1.468   5.086
    6    HG3  GLN  43           HG3      GLN  43  25.863   2.792   6.080
    7   HE21  GLN  43          HE21      GLN  43  28.103   1.844   7.125
    8   HE22  GLN  43          HE22      GLN  43  27.836   0.762   8.404

  No H/Q in entry =           8
  In of MODEL   19
    1    H    SER  44           H        SER  44  21.675   2.650   4.878
    2    HA   SER  44           HA       SER  44  20.129   0.390   4.208
    3    HB2  SER  44           HB2      SER  44  19.661   2.918   5.345
    4    HB3  SER  44           HB3      SER  44  18.630   2.861   3.918
    5    HG   SER  44           HG       SER  44  17.542   1.912   5.641

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ARG  45           H        ARG  45  20.848   3.357   2.396
    2    HA   ARG  45           HA       ARG  45  19.333   2.849   0.089
    3    HB2  ARG  45           HB2      ARG  45  20.456   4.998   0.670
    4    HB3  ARG  45           HB3      ARG  45  22.008   4.257   0.290
    5    HG2  ARG  45           HG2      ARG  45  21.234   3.837  -2.025
    6    HG3  ARG  45           HG3      ARG  45  19.693   4.601  -1.644
    7    HD2  ARG  45           HD2      ARG  45  20.923   6.711  -1.063
    8    HD3  ARG  45           HD3      ARG  45  22.428   5.950  -1.626
    9    HE   ARG  45           HE       ARG  45  20.504   5.688  -3.665
   10   HH21  ARG  45          HH11      ARG  45  20.489   7.052  -5.433
   11   HH22  ARG  45          HH12      ARG  45  21.231   8.610  -5.331
   12   HH11  ARG  45          HH21      ARG  45  22.208   8.207  -2.042
   13   HH12  ARG  45          HH22      ARG  45  22.203   9.263  -3.409

  No H/Q in entry =          13
  In of MODEL   19
    1    H    MET  46           H        MET  46  22.704   2.008   0.847
    2    HA   MET  46           HA       MET  46  23.326   0.813  -1.632
    3    HB2  MET  46           HB2      MET  46  24.429   0.507   1.160
    4    HB3  MET  46           HB3      MET  46  25.096  -0.387  -0.210
    5    HG2  MET  46           HG2      MET  46  25.529   1.715  -1.402
    6    HG3  MET  46           HG3      MET  46  24.807   2.631  -0.085
    7    HE3  MET  46           HE1      MET  46  27.525  -0.545   0.248
    8    HE2  MET  46           HE2      MET  46  28.788   0.514  -0.372
    9    HE1  MET  46           HE3      MET  46  27.316   0.265  -1.310

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ALA  47           H        ALA  47  21.948  -0.523   1.345
    2    HA   ALA  47           HA       ALA  47  21.920  -3.239   0.551
    3    HB2  ALA  47           HB1      ALA  47  21.533  -2.774   2.853
    4    HB3  ALA  47           HB2      ALA  47  20.002  -3.392   2.233
    5    HB1  ALA  47           HB3      ALA  47  20.217  -1.659   2.486

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU  48           H        LEU  48  19.545  -0.633   0.181
    2    HA   LEU  48           HA       LEU  48  17.516  -2.188  -1.068
    3    HB2  LEU  48           HB2      LEU  48  18.146   0.772  -1.191
    4    HB3  LEU  48           HB3      LEU  48  16.682   0.047  -1.858
    5    HG   LEU  48           HG       LEU  48  17.533  -0.238   1.033
    6   HD13  LEU  48          HD11      LEU  48  17.096   2.058   0.838
    7   HD12  LEU  48          HD12      LEU  48  15.542   1.399   1.347
    8   HD11  LEU  48          HD13      LEU  48  15.813   1.818  -0.345
    9   HD22  LEU  48          HD21      LEU  48  16.019  -1.967   0.655
   10   HD21  LEU  48          HD22      LEU  48  15.140  -1.075  -0.587
   11   HD23  LEU  48          HD23      LEU  48  14.921  -0.667   1.114

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ASN  49           H        ASN  49  20.190  -0.242  -2.301
    2    HA   ASN  49           HA       ASN  49  19.544  -0.339  -5.026
    3    HB2  ASN  49           HB2      ASN  49  21.211   1.191  -4.095
    4    HB3  ASN  49           HB3      ASN  49  22.253  -0.164  -3.675
    5   HD21  ASN  49          HD21      ASN  49  23.219   1.867  -5.359
    6   HD22  ASN  49          HD22      ASN  49  23.402   1.254  -6.931

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLU  50           H        GLU  50  21.543  -2.511  -3.053
    2    HA   GLU  50           HA       GLU  50  22.261  -4.269  -5.172
    3    HB2  GLU  50           HB2      GLU  50  23.456  -4.227  -3.004
    4    HB3  GLU  50           HB3      GLU  50  22.017  -4.863  -2.208
    5    HG2  GLU  50           HG2      GLU  50  22.124  -6.900  -3.560
    6    HG3  GLU  50           HG3      GLU  50  23.496  -6.260  -4.461

  No H/Q in entry =           6
  In of MODEL   19
    1    H    ALA  51           H        ALA  51  19.601  -4.216  -2.849
    2    HA   ALA  51           HA       ALA  51  18.456  -6.701  -3.599
    3    HB3  ALA  51           HB1      ALA  51  16.857  -6.202  -2.048
    4    HB1  ALA  51           HB2      ALA  51  16.632  -4.560  -2.653
    5    HB2  ALA  51           HB3      ALA  51  17.993  -4.932  -1.594

  No H/Q in entry =           5
  In of MODEL   19
    1    H    HIS  52           H        HIS  52  17.844  -3.362  -4.647
    2    HA   HIS  52           HA       HIS  52  15.738  -3.911  -6.447
    3    HB2  HIS  52           HB2      HIS  52  16.363  -1.638  -5.656
    4    HB3  HIS  52           HB3      HIS  52  17.824  -1.727  -6.638
    5    HD1  HIS  52           HD1      HIS  52  17.479  -1.856  -9.269
    6    HD2  HIS  52           HD2      HIS  52  14.025  -1.030  -7.086
    7    HE1  HIS  52           HE1      HIS  52  15.768  -1.003 -10.931
    8    HE2  HIS  52           HE2      HIS  52  13.657  -0.493  -9.615

  No H/Q in entry =           8
  In of MODEL   19
    1    H    LEU  53           H        LEU  53  19.257  -3.891  -6.876
    2    HA   LEU  53           HA       LEU  53  19.319  -4.216  -9.675
    3    HB2  LEU  53           HB2      LEU  53  21.255  -4.949  -7.495
    4    HB3  LEU  53           HB3      LEU  53  21.577  -5.348  -9.179
    5    HG   LEU  53           HG       LEU  53  20.889  -2.535  -8.269
    6   HD12  LEU  53          HD11      LEU  53  23.372  -2.132  -8.518
    7   HD11  LEU  53          HD12      LEU  53  23.583  -3.882  -8.591
    8   HD13  LEU  53          HD13      LEU  53  22.935  -3.134  -7.136
    9   HD21  LEU  53          HD21      LEU  53  21.946  -3.777 -10.814
   10   HD23  LEU  53          HD22      LEU  53  22.288  -2.092 -10.433
   11   HD22  LEU  53          HD23      LEU  53  20.629  -2.624 -10.633

  No H/Q in entry =          11
  In of MODEL   19
    1    H    VAL  54           H        VAL  54  19.223  -6.594  -7.041
    2    HA   VAL  54           HA       VAL  54  19.367  -8.893  -8.691
    3    HB   VAL  54           HB       VAL  54  18.206  -8.469  -5.927
    4   HG12  VAL  54          HG11      VAL  54  18.552 -11.084  -5.912
    5   HG11  VAL  54          HG12      VAL  54  18.368 -10.923  -7.659
    6   HG13  VAL  54          HG13      VAL  54  17.074 -10.399  -6.584
    7   HG22  VAL  54          HG21      VAL  54  20.520  -8.238  -5.702
    8   HG21  VAL  54          HG22      VAL  54  20.868  -9.332  -7.039
    9   HG23  VAL  54          HG23      VAL  54  20.342  -9.978  -5.485

  No H/Q in entry =           9
  In of MODEL   19
    1    H    GLN  55           H        GLN  55  16.622  -7.009  -7.419
    2    HA   GLN  55           HA       GLN  55  14.616  -8.694  -8.488
    3    HB2  GLN  55           HB2      GLN  55  13.853  -7.169  -6.869
    4    HB3  GLN  55           HB3      GLN  55  14.635  -5.796  -7.649
    5    HG2  GLN  55           HG2      GLN  55  12.909  -5.493  -9.142
    6    HG3  GLN  55           HG3      GLN  55  12.603  -7.217  -9.306
    7   HE21  GLN  55          HE21      GLN  55  10.600  -7.780  -8.501
    8   HE22  GLN  55          HE22      GLN  55   9.818  -7.028  -7.196

  No H/Q in entry =           8
  In of MODEL   19
    1    H    THR  56           H        THR  56  16.333  -5.884  -9.857
    2    HA   THR  56           HA       THR  56  14.894  -5.544 -12.208
    3    HB   THR  56           HB       THR  56  17.912  -5.427 -12.035
    4    HG1  THR  56           HG1      THR  56  15.967  -3.984 -10.784
    5   HG22  THR  56          HG21      THR  56  16.075  -3.628 -13.600
    6   HG21  THR  56          HG22      THR  56  16.596  -5.178 -14.258
    7   HG23  THR  56          HG23      THR  56  17.792  -3.945 -13.855

  No H/Q in entry =           7
  In of MODEL   19
    1    H    LYS  57           H        LYS  57  17.563  -7.815 -11.585
    2    HA   LYS  57           HA       LYS  57  17.578  -9.020 -14.159
    3    HB2  LYS  57           HB2      LYS  57  19.364  -9.247 -12.401
    4    HB3  LYS  57           HB3      LYS  57  18.269 -10.261 -11.475
    5    HG2  LYS  57           HG2      LYS  57  18.200 -11.900 -13.289
    6    HG3  LYS  57           HG3      LYS  57  19.231 -10.879 -14.284
    7    HD2  LYS  57           HD2      LYS  57  21.044 -11.083 -12.611
    8    HD3  LYS  57           HD3      LYS  57  20.019 -12.128 -11.629
    9    HE2  LYS  57           HE2      LYS  57  19.905 -13.770 -13.466
   10    HE3  LYS  57           HE3      LYS  57  20.903 -12.731 -14.482
   11    HZ1  LYS  57           HZ1      LYS  57  21.950 -13.403 -11.849
   12    HZ3  LYS  57           HZ2      LYS  57  22.759 -13.223 -13.331
   13    HZ2  LYS  57           HZ3      LYS  57  21.907 -14.653 -12.993

  No H/Q in entry =          13
  In of MODEL   19
    1    H    LEU  58           H        LEU  58  15.800  -9.692 -11.182
    2    HA   LEU  58           HA       LEU  58  14.602 -12.080 -12.108
    3    HB2  LEU  58           HB2      LEU  58  13.787 -10.173  -9.921
    4    HB3  LEU  58           HB3      LEU  58  12.995 -11.720 -10.232
    5    HG   LEU  58           HG       LEU  58  15.965 -11.412  -9.676
    6   HD11  LEU  58          HD11      LEU  58  13.596 -11.844  -7.883
    7   HD13  LEU  58          HD12      LEU  58  15.040 -10.866  -7.624
    8   HD12  LEU  58          HD13      LEU  58  15.129 -12.621  -7.481
    9   HD22  LEU  58          HD21      LEU  58  15.867 -13.479 -10.695
   10   HD21  LEU  58          HD22      LEU  58  14.155 -13.703 -10.335
   11   HD23  LEU  58          HD23      LEU  58  15.365 -13.987  -9.083

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  59           H        ILE  59  13.900  -8.753 -12.805
    2    HA   ILE  59           HA       ILE  59  11.191  -9.431 -13.745
    3    HB   ILE  59           HB       ILE  59  11.978  -7.134 -12.550
    4   HG12  ILE  59          HG12      ILE  59  10.062  -7.043 -14.890
    5   HG13  ILE  59          HG13      ILE  59   9.657  -7.811 -13.377
    6   HG23  ILE  59          HG21      ILE  59  12.527  -5.414 -14.070
    7   HG22  ILE  59          HG22      ILE  59  12.037  -6.350 -15.464
    8   HG21  ILE  59          HG23      ILE  59  13.526  -6.742 -14.608
    9   HD11  ILE  59          HD11      ILE  59  10.560  -4.944 -13.635
   10   HD13  ILE  59          HD12      ILE  59  10.013  -5.732 -12.156
   11   HD12  ILE  59          HD13      ILE  59   8.877  -5.447 -13.475

  No H/Q in entry =          11
  In of MODEL   19
    1    H    GLU  60           H        GLU  60  14.388  -8.554 -15.004
    2    HA   GLU  60           HA       GLU  60  13.607  -8.172 -17.715
    3    HB2  GLU  60           HB2      GLU  60  15.781  -7.420 -16.847
    4    HB3  GLU  60           HB3      GLU  60  16.259  -9.092 -16.569
    5    HG2  GLU  60           HG2      GLU  60  16.060  -9.556 -18.988
    6    HG3  GLU  60           HG3      GLU  60  15.581  -7.884 -19.268

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLY  61           H        GLY  61  14.610 -11.037 -15.887
    2    HA3  GLY  61           HA2      GLY  61  14.086 -12.699 -18.282
    3    HA2  GLY  61           HA3      GLY  61  15.122 -13.165 -16.937

  No H/Q in entry =           3
  In of MODEL   19
    1    H    ASP  62           H        ASP  62  11.987 -11.647 -16.576
    2    HA   ASP  62           HA       ASP  62  11.079 -13.650 -14.772
    3    HB2  ASP  62           HB2      ASP  62   8.936 -12.370 -14.885
    4    HB3  ASP  62           HB3      ASP  62  10.341 -11.380 -14.499

  No H/Q in entry =           4
  In of MODEL   19
    1    H    ALA  63           H        ALA  63  10.829 -13.345 -18.244
    2    HA   ALA  63           HA       ALA  63   8.465 -14.823 -18.730
    3    HB1  ALA  63           HB1      ALA  63   9.616 -15.375 -20.935
    4    HB2  ALA  63           HB2      ALA  63  11.006 -14.478 -20.328
    5    HB3  ALA  63           HB3      ALA  63   9.463 -13.657 -20.560

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLY  64           H        GLY  64  11.819 -15.819 -18.254
    2    HA3  GLY  64           HA2      GLY  64  12.780 -17.839 -17.753
    3    HA2  GLY  64           HA3      GLY  64  11.219 -18.305 -17.091

  No H/Q in entry =           3
  In of MODEL   19
    1    H    GLU  65           H        GLU  65  12.634 -20.282 -18.238
    2    HA   GLU  65           HA       GLU  65  12.234 -20.560 -21.034
    3    HB2  GLU  65           HB2      GLU  65  12.819 -22.599 -18.891
    4    HB3  GLU  65           HB3      GLU  65  12.770 -22.972 -20.614
    5    HG2  GLU  65           HG2      GLU  65  14.532 -21.335 -21.052
    6    HG3  GLU  65           HG3      GLU  65  14.554 -20.870 -19.352

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLY  66           H        GLY  66  10.379 -21.512 -18.263
    2    HA3  GLY  66           HA2      GLY  66   8.506 -23.235 -19.451
    3    HA2  GLY  66           HA3      GLY  66   8.289 -22.356 -17.952

  No H/Q in entry =           3
  In of MODEL   19
    1    H    LYS  67           H        LYS  67   6.537 -21.182 -17.938
    2    HA   LYS  67           HA       LYS  67   5.060 -20.559 -20.281
    3    HB2  LYS  67           HB2      LYS  67   3.443 -19.590 -18.754
    4    HB3  LYS  67           HB3      LYS  67   4.050 -21.115 -18.096
    5    HG2  LYS  67           HG2      LYS  67   5.698 -19.853 -16.734
    6    HG3  LYS  67           HG3      LYS  67   5.036 -18.343 -17.355
    7    HD2  LYS  67           HD2      LYS  67   2.843 -18.896 -16.369
    8    HD3  LYS  67           HD3      LYS  67   3.509 -20.404 -15.740
    9    HE2  LYS  67           HE2      LYS  67   5.159 -19.133 -14.420
   10    HE3  LYS  67           HE3      LYS  67   4.504 -17.622 -15.050
   11    HZ3  LYS  67           HZ1      LYS  67   3.305 -17.763 -13.155
   12    HZ2  LYS  67           HZ2      LYS  67   3.386 -19.456 -13.079
   13    HZ1  LYS  67           HZ3      LYS  67   2.289 -18.702 -14.135

  No H/Q in entry =          13
  In of MODEL   19
    1    H    MET  68           H        MET  68   4.284 -18.562 -20.973
    2    HA   MET  68           HA       MET  68   6.257 -16.652 -21.552
    3    HB2  MET  68           HB2      MET  68   3.269 -16.708 -21.876
    4    HB3  MET  68           HB3      MET  68   4.234 -15.322 -22.387
    5    HG2  MET  68           HG2      MET  68   4.739 -18.173 -23.284
    6    HG3  MET  68           HG3      MET  68   3.849 -16.976 -24.226
    7    HE3  MET  68           HE1      MET  68   6.120 -14.347 -25.262
    8    HE2  MET  68           HE2      MET  68   5.828 -14.159 -23.536
    9    HE1  MET  68           HE3      MET  68   4.543 -14.768 -24.576

  No H/Q in entry =           9
  In of MODEL   19
    1    H    LYS  69           H        LYS  69   3.604 -16.513 -19.154
    2    HA   LYS  69           HA       LYS  69   3.775 -13.817 -18.511
    3    HB2  LYS  69           HB2      LYS  69   3.059 -16.070 -16.627
    4    HB3  LYS  69           HB3      LYS  69   2.593 -14.374 -16.469
    5    HG2  LYS  69           HG2      LYS  69   1.908 -16.076 -18.878
    6    HG3  LYS  69           HG3      LYS  69   0.820 -15.845 -17.509
    7    HD2  LYS  69           HD2      LYS  69   1.157 -13.316 -17.919
    8    HD3  LYS  69           HD3      LYS  69   1.799 -13.795 -19.491
    9    HE2  LYS  69           HE2      LYS  69  -0.282 -15.000 -19.995
   10    HE3  LYS  69           HE3      LYS  69  -0.925 -14.574 -18.409
   11    HZ2  LYS  69           HZ1      LYS  69  -0.413 -12.833 -20.726
   12    HZ1  LYS  69           HZ2      LYS  69  -0.429 -12.180 -19.159
   13    HZ3  LYS  69           HZ3      LYS  69  -1.809 -12.957 -19.773

  No H/Q in entry =          13
  In of MODEL   19
    1    H    VAL  70           H        VAL  70   4.086 -14.172 -15.526
    2    HA   VAL  70           HA       VAL  70   7.039 -14.230 -15.321
    3    HB   VAL  70           HB       VAL  70   6.915 -12.256 -13.842
    4   HG11  VAL  70          HG11      VAL  70   7.212 -12.109 -16.380
    5   HG13  VAL  70          HG12      VAL  70   6.666 -10.636 -15.579
    6   HG12  VAL  70          HG13      VAL  70   5.512 -11.644 -16.452
    7   HG23  VAL  70          HG21      VAL  70   4.614 -10.962 -14.117
    8   HG22  VAL  70          HG22      VAL  70   4.786 -12.209 -12.883
    9   HG21  VAL  70          HG23      VAL  70   3.973 -12.581 -14.402

  No H/Q in entry =           9
  In of MODEL   19
    1    H    SER  71           H        SER  71   7.795 -14.527 -13.105
    2    HA   SER  71           HA       SER  71   6.464 -16.618 -11.714
    3    HB2  SER  71           HB2      SER  71   8.911 -16.290 -11.622
    4    HB3  SER  71           HB3      SER  71   8.671 -14.774 -10.755
    5    HG   SER  71           HG       SER  71   8.839 -17.178  -9.740

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU  72           H        LEU  72   5.143 -16.560  -9.940
    2    HA   LEU  72           HA       LEU  72   3.571 -14.259  -9.506
    3    HB2  LEU  72           HB2      LEU  72   3.880 -16.809  -7.929
    4    HB3  LEU  72           HB3      LEU  72   2.702 -15.561  -7.531
    5    HG   LEU  72           HG       LEU  72   2.871 -16.872 -10.265
    6   HD12  LEU  72          HD11      LEU  72   0.858 -18.153  -9.511
    7   HD11  LEU  72          HD12      LEU  72   1.115 -17.531  -7.882
    8   HD13  LEU  72          HD13      LEU  72   2.320 -18.583  -8.623
    9   HD22  LEU  72          HD21      LEU  72   1.646 -14.888 -10.538
   10   HD21  LEU  72          HD22      LEU  72   0.967 -14.951  -8.920
   11   HD23  LEU  72          HD23      LEU  72   0.374 -16.045 -10.166

  No H/Q in entry =          11
  In of MODEL   19
    1    H    VAL  73           H        VAL  73   6.238 -15.665  -7.724
    2    HA   VAL  73           HA       VAL  73   6.159 -14.124  -5.397
    3    HB   VAL  73           HB       VAL  73   8.370 -14.893  -4.979
    4   HG13  VAL  73          HG11      VAL  73   8.161 -17.293  -5.491
    5   HG12  VAL  73          HG12      VAL  73   6.921 -16.934  -6.692
    6   HG11  VAL  73          HG13      VAL  73   6.611 -16.626  -4.983
    7   HG21  VAL  73          HG21      VAL  73   8.492 -15.032  -7.973
    8   HG23  VAL  73          HG22      VAL  73   9.506 -16.121  -7.028
    9   HG22  VAL  73          HG23      VAL  73   9.672 -14.375  -6.839

  No H/Q in entry =           9
  In of MODEL   19
    1    H    LEU  74           H        LEU  74   7.146 -13.232  -8.574
    2    HA   LEU  74           HA       LEU  74   9.072 -11.264  -8.085
    3    HB2  LEU  74           HB2      LEU  74   8.625 -12.027 -10.321
    4    HB3  LEU  74           HB3      LEU  74   6.956 -11.468 -10.226
    5    HG   LEU  74           HG       LEU  74   7.738  -9.139 -10.031
    6   HD13  LEU  74          HD11      LEU  74   9.837  -9.287  -8.944
    7   HD12  LEU  74          HD12      LEU  74  10.251  -8.830 -10.596
    8   HD11  LEU  74          HD13      LEU  74  10.432 -10.504 -10.071
    9   HD23  LEU  74          HD21      LEU  74   9.268 -10.227 -12.334
   10   HD22  LEU  74          HD22      LEU  74   8.093  -8.933 -12.264
   11   HD21  LEU  74          HD23      LEU  74   7.547 -10.595 -12.244

  No H/Q in entry =          11
  In of MODEL   19
    1    H    VAL  75           H        VAL  75   5.574 -10.913  -8.447
    2    HA   VAL  75           HA       VAL  75   5.451  -8.156  -7.870
    3    HB   VAL  75           HB       VAL  75   3.380 -10.317  -7.480
    4   HG11  VAL  75          HG11      VAL  75   3.149  -7.278  -7.346
    5   HG13  VAL  75          HG12      VAL  75   2.887  -8.400  -6.020
    6   HG12  VAL  75          HG13      VAL  75   1.783  -8.388  -7.387
    7   HG21  VAL  75          HG21      VAL  75   3.948  -8.257  -9.636
    8   HG23  VAL  75          HG22      VAL  75   2.462  -9.200  -9.559
    9   HG22  VAL  75          HG23      VAL  75   4.009 -10.011  -9.805

  No H/Q in entry =           9
  In of MODEL   19
    1    H    GLU  76           H        GLU  76   5.219 -11.027  -5.751
    2    HA   GLU  76           HA       GLU  76   4.730  -9.662  -3.335
    3    HB2  GLU  76           HB2      GLU  76   4.603 -12.149  -3.612
    4    HB3  GLU  76           HB3      GLU  76   6.351 -12.200  -3.751
    5    HG2  GLU  76           HG2      GLU  76   6.588 -11.317  -1.468
    6    HG3  GLU  76           HG3      GLU  76   4.846 -11.205  -1.300

  No H/Q in entry =           6
  In of MODEL   19
    1    H    ALA  77           H        ALA  77   7.802 -10.547  -4.888
    2    HA   ALA  77           HA       ALA  77   9.477  -9.481  -2.871
    3    HB3  ALA  77           HB1      ALA  77   9.888 -10.053  -5.800
    4    HB1  ALA  77           HB2      ALA  77  10.509 -10.941  -4.409
    5    HB2  ALA  77           HB3      ALA  77  11.166  -9.353  -4.807

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLN  78           H        GLN  78   8.080  -8.086  -5.794
    2    HA   GLN  78           HA       GLN  78   9.410  -5.595  -5.694
    3    HB2  GLN  78           HB2      GLN  78   8.123  -6.533  -7.651
    4    HB3  GLN  78           HB3      GLN  78   6.637  -6.153  -6.781
    5    HG2  GLN  78           HG2      GLN  78   7.278  -3.781  -6.705
    6    HG3  GLN  78           HG3      GLN  78   8.774  -4.150  -7.562
    7   HE21  GLN  78          HE21      GLN  78   6.868  -2.343  -8.692
    8   HE22  GLN  78          HE22      GLN  78   6.187  -3.071 -10.066

  No H/Q in entry =           8
  In of MODEL   19
    1    H    LEU  79           H        LEU  79   6.396  -6.754  -4.269
    2    HA   LEU  79           HA       LEU  79   5.378  -4.352  -3.271
    3    HB2  LEU  79           HB2      LEU  79   4.082  -6.415  -3.212
    4    HB3  LEU  79           HB3      LEU  79   5.229  -7.140  -2.091
    5    HG   LEU  79           HG       LEU  79   4.658  -5.497  -0.371
    6   HD13  LEU  79          HD11      LEU  79   4.178  -3.490  -1.431
    7   HD12  LEU  79          HD12      LEU  79   2.556  -4.028  -0.995
    8   HD11  LEU  79          HD13      LEU  79   3.144  -4.251  -2.640
    9   HD23  LEU  79          HD21      LEU  79   2.075  -6.011  -0.288
   10   HD22  LEU  79          HD22      LEU  79   3.226  -7.340  -0.171
   11   HD21  LEU  79          HD23      LEU  79   2.414  -7.015  -1.700

  No H/Q in entry =          11
  In of MODEL   19
    1    H    HIS  80           H        HIS  80   7.576  -6.663  -1.673
    2    HA   HIS  80           HA       HIS  80   7.843  -5.110   0.691
    3    HB2  HIS  80           HB2      HIS  80   9.205  -7.467  -0.495
    4    HB3  HIS  80           HB3      HIS  80  10.104  -6.558   0.722
    5    HD1  HIS  80           HD1      HIS  80   9.610  -7.190   3.065
    6    HD2  HIS  80           HD2      HIS  80   6.410  -8.076   0.545
    7    HE1  HIS  80           HE1      HIS  80   7.843  -8.303   4.512
    8    HE2  HIS  80           HE2      HIS  80   5.885  -8.847   2.984

  No H/Q in entry =           8
  In of MODEL   19
    1    H    LEU  81           H        LEU  81   9.861  -5.380  -2.213
    2    HA   LEU  81           HA       LEU  81  11.887  -3.619  -1.333
    3    HB2  LEU  81           HB2      LEU  81  10.983  -4.429  -4.097
    4    HB3  LEU  81           HB3      LEU  81  12.394  -3.410  -3.805
    5    HG   LEU  81           HG       LEU  81  12.018  -6.130  -2.523
    6   HD12  LEU  81          HD11      LEU  81  13.845  -6.748  -4.264
    7   HD11  LEU  81          HD12      LEU  81  13.271  -5.331  -5.143
    8   HD13  LEU  81          HD13      LEU  81  12.169  -6.664  -4.804
    9   HD23  LEU  81          HD21      LEU  81  14.644  -5.794  -2.501
   10   HD22  LEU  81          HD22      LEU  81  13.651  -5.037  -1.257
   11   HD21  LEU  81          HD23      LEU  81  14.227  -4.085  -2.625

  No H/Q in entry =          11
  In of MODEL   19
    1    H    MET  82           H        MET  82   8.967  -3.012  -3.283
    2    HA   MET  82           HA       MET  82   9.488  -0.284  -3.791
    3    HB2  MET  82           HB2      MET  82   6.940  -1.897  -3.670
    4    HB3  MET  82           HB3      MET  82   6.928  -0.174  -4.041
    5    HG2  MET  82           HG2      MET  82   8.550  -2.241  -5.563
    6    HG3  MET  82           HG3      MET  82   6.980  -1.632  -6.083
    7    HE3  MET  82           HE1      MET  82   7.406   1.822  -7.265
    8    HE2  MET  82           HE2      MET  82   7.027   1.599  -5.559
    9    HE1  MET  82           HE3      MET  82   6.375   0.480  -6.753

  No H/Q in entry =           9
  In of MODEL   19
    1    H    THR  83           H        THR  83   7.698  -1.887  -1.188
    2    HA   THR  83           HA       THR  83   6.825   0.459   0.128
    3    HB   THR  83           HB       THR  83   6.694  -1.109   2.150
    4    HG1  THR  83           HG1      THR  83   7.467  -3.054   1.930
    5   HG22  THR  83          HG21      THR  83   5.058  -2.692   0.682
    6   HG21  THR  83          HG22      THR  83   5.279  -1.366  -0.454
    7   HG23  THR  83          HG23      THR  83   4.630  -1.050   1.156

  No H/Q in entry =           7
  In of MODEL   19
    1    H    SER  84           H        SER  84   9.662  -1.616   0.666
    2    HA   SER  84           HA       SER  84  10.702  -0.170   2.853
    3    HB2  SER  84           HB2      SER  84  11.977  -2.011   0.840
    4    HB3  SER  84           HB3      SER  84  12.913  -1.246   2.122
    5    HG   SER  84           HG       SER  84  10.649  -2.951   2.379

  No H/Q in entry =           5
  In of MODEL   19
    1    H    MET  85           H        MET  85  11.467   0.084  -0.633
    2    HA   MET  85           HA       MET  85  13.450   2.064  -0.381
    3    HB2  MET  85           HB2      MET  85  13.072   0.773  -2.443
    4    HB3  MET  85           HB3      MET  85  11.539   1.613  -2.682
    5    HG2  MET  85           HG2      MET  85  12.718   3.766  -2.817
    6    HG3  MET  85           HG3      MET  85  14.253   2.955  -2.529
    7    HE1  MET  85           HE1      MET  85  11.168   3.256  -4.453
    8    HE3  MET  85           HE2      MET  85  11.225   1.641  -5.153
    9    HE2  MET  85           HE3      MET  85  11.579   3.038  -6.161

  No H/Q in entry =           9
  In of MODEL   19
    1    H    LEU  86           H        LEU  86   9.960   2.373  -0.904
    2    HA   LEU  86           HA       LEU  86   9.878   5.185  -1.096
    3    HB2  LEU  86           HB2      LEU  86   8.047   3.511  -1.673
    4    HB3  LEU  86           HB3      LEU  86   7.711   3.425   0.056
    5    HG   LEU  86           HG       LEU  86   7.534   5.984  -0.006
    6   HD11  LEU  86          HD11      LEU  86   8.322   5.544  -2.703
    7   HD13  LEU  86          HD12      LEU  86   7.873   7.071  -1.950
    8   HD12  LEU  86          HD13      LEU  86   6.647   6.097  -2.756
    9   HD23  LEU  86          HD21      LEU  86   5.415   4.611  -1.672
   10   HD22  LEU  86          HD22      LEU  86   5.212   5.874  -0.461
   11   HD21  LEU  86          HD23      LEU  86   5.621   4.234   0.040

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ALA  87           H        ALA  87   9.416   3.013   1.656
    2    HA   ALA  87           HA       ALA  87   8.848   4.930   3.617
    3    HB1  ALA  87           HB1      ALA  87   9.674   2.115   3.543
    4    HB3  ALA  87           HB2      ALA  87   8.539   2.923   4.622
    5    HB2  ALA  87           HB3      ALA  87  10.266   2.967   4.972

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ARG  88           H        ARG  88  11.944   3.522   2.652
    2    HA   ARG  88           HA       ARG  88  13.538   4.917   4.486
    3    HB2  ARG  88           HB2      ARG  88  14.224   2.943   3.091
    4    HB3  ARG  88           HB3      ARG  88  14.374   4.032   1.715
    5    HG2  ARG  88           HG2      ARG  88  15.832   5.362   3.662
    6    HG3  ARG  88           HG3      ARG  88  16.162   3.676   4.048
    7    HD2  ARG  88           HD2      ARG  88  17.438   3.382   2.207
    8    HD3  ARG  88           HD3      ARG  88  16.299   4.242   1.167
    9    HE   ARG  88           HE       ARG  88  18.683   5.325   2.219
   10   HH21  ARG  88          HH11      ARG  88  19.014   7.545   2.018
   11   HH22  ARG  88          HH12      ARG  88  17.657   8.608   1.866
   12   HH11  ARG  88          HH21      ARG  88  15.340   6.055   1.926
   13   HH12  ARG  88          HH22      ARG  88  15.575   7.761   1.790

  No H/Q in entry =          13
  In of MODEL   19
    1    H    GLU  89           H        GLU  89  12.570   5.797   1.156
    2    HA   GLU  89           HA       GLU  89  14.103   8.167   0.997
    3    HB2  GLU  89           HB2      GLU  89  12.972   7.112  -0.952
    4    HB3  GLU  89           HB3      GLU  89  11.421   7.645  -0.301
    5    HG2  GLU  89           HG2      GLU  89  12.109   9.986  -0.469
    6    HG3  GLU  89           HG3      GLU  89  13.718   9.504  -0.999

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LEU  90           H        LEU  90  10.773   7.639   2.116
    2    HA   LEU  90           HA       LEU  90  10.238  10.371   2.681
    3    HB2  LEU  90           HB2      LEU  90   9.056   7.794   3.712
    4    HB3  LEU  90           HB3      LEU  90   8.414   9.386   4.128
    5    HG   LEU  90           HG       LEU  90   8.848   8.499   1.263
    6   HD12  LEU  90          HD11      LEU  90   6.316   8.154   1.318
    7   HD11  LEU  90          HD12      LEU  90   6.465   8.151   3.076
    8   HD13  LEU  90          HD13      LEU  90   7.294   6.923   2.118
    9   HD22  LEU  90          HD21      LEU  90   8.539  10.805   1.181
   10   HD21  LEU  90          HD22      LEU  90   7.547  10.836   2.637
   11   HD23  LEU  90          HD23      LEU  90   6.859  10.271   1.115

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  91           H        ILE  91  11.512   7.705   4.616
    2    HA   ILE  91           HA       ILE  91  11.635   9.079   7.080
    3    HB   ILE  91           HB       ILE  91  13.208   6.747   5.970
    4   HG12  ILE  91          HG12      ILE  91  11.183   6.909   8.222
    5   HG13  ILE  91          HG13      ILE  91  10.720   6.619   6.546
    6   HG22  ILE  91          HG21      ILE  91  13.670   6.545   8.613
    7   HG21  ILE  91          HG22      ILE  91  13.583   8.303   8.505
    8   HG23  ILE  91          HG23      ILE  91  14.771   7.420   7.548
    9   HD13  ILE  91          HD11      ILE  91  11.736   4.524   6.486
   10   HD12  ILE  91          HD12      ILE  91  11.137   4.584   8.144
   11   HD11  ILE  91          HD13      ILE  91  12.838   4.907   7.810

  No H/Q in entry =          11
  In of MODEL   19
    1    H    THR  92           H        THR  92  13.862   8.915   4.336
    2    HA   THR  92           HA       THR  92  16.014  10.326   5.498
    3    HB   THR  92           HB       THR  92  15.039  10.185   2.635
    4    HG1  THR  92           HG1      THR  92  15.881   8.295   3.049
    5   HG22  THR  92          HG21      THR  92  17.605  10.891   2.347
    6   HG21  THR  92          HG22      THR  92  17.286  11.715   3.873
    7   HG23  THR  92          HG23      THR  92  16.318  12.092   2.448

  No H/Q in entry =           7
  In of MODEL   19
    1    H    GLU  93           H        GLU  93  13.126  11.455   3.756
    2    HA   GLU  93           HA       GLU  93  13.702  14.220   3.863
    3    HB2  GLU  93           HB2      GLU  93  11.006  12.829   3.873
    4    HB3  GLU  93           HB3      GLU  93  11.284  14.530   3.496
    5    HG2  GLU  93           HG2      GLU  93  12.642  12.291   1.980
    6    HG3  GLU  93           HG3      GLU  93  11.093  12.962   1.486

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LEU  94           H        LEU  94  11.966  12.060   6.075
    2    HA   LEU  94           HA       LEU  94  11.138  14.007   7.942
    3    HB2  LEU  94           HB2      LEU  94  11.732  11.057   8.228
    4    HB3  LEU  94           HB3      LEU  94  11.150  12.033   9.574
    5    HG   LEU  94           HG       LEU  94   9.674  12.066   6.940
    6   HD11  LEU  94          HD11      LEU  94   9.765   9.853   8.952
    7   HD13  LEU  94          HD12      LEU  94   9.469   9.783   7.216
    8   HD12  LEU  94          HD13      LEU  94   8.184  10.295   8.309
    9   HD23  LEU  94          HD21      LEU  94   7.747  12.459   8.533
   10   HD22  LEU  94          HD22      LEU  94   8.977  13.721   8.569
   11   HD21  LEU  94          HD23      LEU  94   8.918  12.508   9.847

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  95           H        ILE  95  14.125  12.096   7.722
    2    HA   ILE  95           HA       ILE  95  15.279  13.034  10.136
    3    HB   ILE  95           HB       ILE  95  16.533  11.965   7.595
    4   HG12  ILE  95          HG12      ILE  95  16.236  10.772  10.366
    5   HG13  ILE  95          HG13      ILE  95  15.075  10.501   9.068
    6   HG21  ILE  95          HG21      ILE  95  17.775  12.789  10.239
    7   HG23  ILE  95          HG22      ILE  95  18.239  13.314   8.619
    8   HG22  ILE  95          HG23      ILE  95  18.554  11.658   9.134
    9   HD13  ILE  95          HD11      ILE  95  16.568   9.228   7.814
   10   HD12  ILE  95          HD12      ILE  95  17.038   8.788   9.453
   11   HD11  ILE  95          HD13      ILE  95  17.986   9.971   8.553

  No H/Q in entry =          11
  In of MODEL   19
    1    H    GLU  96           H        GLU  96  15.435  14.257   6.798
    2    HA   GLU  96           HA       GLU  96  17.267  16.350   7.273
    3    HB2  GLU  96           HB2      GLU  96  16.614  15.675   5.014
    4    HB3  GLU  96           HB3      GLU  96  14.966  16.223   5.308
    5    HG2  GLU  96           HG2      GLU  96  15.520  18.354   4.760
    6    HG3  GLU  96           HG3      GLU  96  16.815  18.367   5.946

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LEU  97           H        LEU  97  13.756  16.141   7.693
    2    HA   LEU  97           HA       LEU  97  13.320  18.874   8.324
    3    HB2  LEU  97           HB2      LEU  97  11.816  16.341   8.942
    4    HB3  LEU  97           HB3      LEU  97  11.291  17.887   9.607
    5    HG   LEU  97           HG       LEU  97  11.786  17.464   6.645
    6   HD12  LEU  97          HD11      LEU  97   9.263  17.319   6.520
    7   HD11  LEU  97          HD12      LEU  97   9.253  17.125   8.271
    8   HD13  LEU  97          HD13      LEU  97  10.045  15.919   7.255
    9   HD23  LEU  97          HD21      LEU  97  10.035  19.417   6.666
   10   HD22  LEU  97          HD22      LEU  97  11.712  19.788   7.062
   11   HD21  LEU  97          HD23      LEU  97  10.521  19.615   8.349

  No H/Q in entry =          11
  In of MODEL   19
    1    H    HIS  98           H        HIS  98  14.154  16.060  10.332
    2    HA   HIS  98           HA       HIS  98  13.980  17.328  12.843
    3    HB2  HIS  98           HB2      HIS  98  15.748  15.079  11.854
    4    HB3  HIS  98           HB3      HIS  98  15.738  15.623  13.533
    5    HD1  HIS  98           HD1      HIS  98  13.557  13.971  10.940
    6    HD2  HIS  98           HD2      HIS  98  13.432  14.903  15.001
    7    HE1  HIS  98           HE1      HIS  98  11.537  12.766  11.891
    8    HE2  HIS  98           HE2      HIS  98  11.441  13.326  14.360

  No H/Q in entry =           8
  In of MODEL   19
    1    H    GLU  99           H        GLU  99  16.542  17.222  10.416
    2    HA   GLU  99           HA       GLU  99  18.514  18.571  11.946
    3    HB2  GLU  99           HB2      GLU  99  19.008  17.280   9.883
    4    HB3  GLU  99           HB3      GLU  99  18.192  18.526   8.935
    5    HG2  GLU  99           HG2      GLU  99  19.788  20.209   9.725
    6    HG3  GLU  99           HG3      GLU  99  20.571  19.016  10.754

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LYS 100           H        LYS 100  15.989  19.710   9.719
    2    HA   LYS 100           HA       LYS 100  16.770  22.453   9.856
    3    HB2  LYS 100           HB2      LYS 100  14.147  21.145   9.098
    4    HB3  LYS 100           HB3      LYS 100  14.436  22.885   9.003
    5    HG2  LYS 100           HG2      LYS 100  16.415  22.444   7.543
    6    HG3  LYS 100           HG3      LYS 100  16.012  20.724   7.565
    7    HD2  LYS 100           HD2      LYS 100  13.817  21.217   6.557
    8    HD3  LYS 100           HD3      LYS 100  14.203  22.938   6.542
    9    HE2  LYS 100           HE2      LYS 100  16.169  22.465   5.090
   10    HE3  LYS 100           HE3      LYS 100  15.714  20.757   5.061
   11    HZ1  LYS 100           HZ1      LYS 100  13.878  22.936   4.213
   12    HZ3  LYS 100           HZ2      LYS 100  13.705  21.265   3.956
   13    HZ2  LYS 100           HZ3      LYS 100  14.913  22.131   3.135

  No H/Q in entry =          13
  In of MODEL   19
    1    H    LEU 101           H        LEU 101  14.679  20.400  11.822
    2    HA   LEU 101           HA       LEU 101  13.496  22.467  13.390
    3    HB2  LEU 101           HB2      LEU 101  13.954  19.521  13.785
    4    HB3  LEU 101           HB3      LEU 101  13.409  20.502  15.141
    5    HG   LEU 101           HG       LEU 101  11.998  20.574  12.468
    6   HD12  LEU 101          HD11      LEU 101  10.344  19.004  13.737
    7   HD11  LEU 101          HD12      LEU 101  11.738  18.603  14.737
    8   HD13  LEU 101          HD13      LEU 101  11.779  18.291  13.001
    9   HD21  LEU 101          HD21      LEU 101  11.328  21.372  15.316
   10   HD23  LEU 101          HD22      LEU 101  10.072  21.135  14.102
   11   HD22  LEU 101          HD23      LEU 101  11.300  22.377  13.864

  No H/Q in entry =          11
  In of MODEL   19
    1    H    LYS 102           H        LYS 102  16.648  21.876  12.964
    2    HA   LYS 102           HA       LYS 102  18.487  22.761  14.039
    3    HB2  LYS 102           HB2      LYS 102  16.661  24.269  15.163
    4    HB3  LYS 102           HB3      LYS 102  16.870  23.212  16.544
    5    HG2  LYS 102           HG2      LYS 102  18.755  25.230  15.373
    6    HG3  LYS 102           HG3      LYS 102  18.370  24.919  17.052
    7    HD2  LYS 102           HD2      LYS 102  20.053  23.011  15.377
    8    HD3  LYS 102           HD3      LYS 102  20.732  24.340  16.307
    9    HE2  LYS 102           HE2      LYS 102  20.345  21.792  17.283
   10    HE3  LYS 102           HE3      LYS 102  20.553  23.238  18.270
   11    HZ2  LYS 102           HZ1      LYS 102  18.590  21.945  18.887
   12    HZ1  LYS 102           HZ2      LYS 102  17.949  22.166  17.336
   13    HZ3  LYS 102           HZ3      LYS 102  18.169  23.501  18.358

  No H/Q in entry =          13
  In of MODEL   19
    1    H    ALA 103           H        ALA 103  16.417  21.151  16.461
    2    HA   ALA 103           HA       ALA 103  18.147  19.956  18.124
    3    HB2  ALA 103           HB1      ALA 103  16.574  17.939  18.120
    4    HB1  ALA 103           HB2      ALA 103  15.677  18.783  16.858
    5    HB3  ALA 103           HB3      ALA 103  15.846  19.510  18.454

  No H/Q in entry =           5
  In of MODEL   19
    1    H1   ALA   1           H3       ALA   1  -1.522  -7.134 -21.466
    2    H2   ALA   1           H2       ALA   1  -2.310  -8.572 -21.011
    3    H3   ALA   1           H1       ALA   1  -0.700  -8.616 -21.561
    4    HA   ALA   1           HA       ALA   1  -1.526  -9.095 -23.558
    5    HB1  ALA   1           HB1      ALA   1  -3.660  -9.823 -23.088
    6    HB2  ALA   1           HB2      ALA   1  -4.105  -8.317 -23.892
    7    HB3  ALA   1           HB3      ALA   1  -4.049  -8.392 -22.133

  No H/Q in entry =           7
  In of MODEL   19
    1    H    GLU   2           H        GLU   2  -2.356  -7.915 -25.553
    2    HA   GLU   2           HA       GLU   2  -0.965  -5.897 -26.433
    3    HB2  GLU   2           HB2      GLU   2  -3.971  -5.980 -26.759
    4    HB3  GLU   2           HB3      GLU   2  -2.852  -5.115 -27.808
    5    HG2  GLU   2           HG2      GLU   2  -2.335  -7.006 -28.956
    6    HG3  GLU   2           HG3      GLU   2  -2.038  -7.905 -27.475

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLU   3           H        GLU   3  -4.135  -4.654 -25.546
    2    HA   GLU   3           HA       GLU   3  -3.103  -2.090 -24.922
    3    HB2  GLU   3           HB2      GLU   3  -5.785  -3.418 -24.594
    4    HB3  GLU   3           HB3      GLU   3  -5.498  -1.799 -23.952
    5    HG2  GLU   3           HG2      GLU   3  -5.140  -0.877 -26.079
    6    HG3  GLU   3           HG3      GLU   3  -4.735  -2.432 -26.798

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LEU   4           H        LEU   4  -4.688  -4.451 -22.740
    2    HA   LEU   4           HA       LEU   4  -4.337  -3.214 -20.352
    3    HB2  LEU   4           HB2      LEU   4  -3.778  -6.154 -20.811
    4    HB3  LEU   4           HB3      LEU   4  -4.192  -5.405 -19.270
    5    HG   LEU   4           HG       LEU   4  -5.957  -5.495 -21.740
    6   HD13  LEU   4          HD11      LEU   4  -7.144  -7.216 -20.740
    7   HD12  LEU   4          HD12      LEU   4  -6.667  -6.749 -19.109
    8   HD11  LEU   4          HD13      LEU   4  -5.523  -7.589 -20.155
    9   HD23  LEU   4          HD21      LEU   4  -7.651  -4.687 -19.879
   10   HD22  LEU   4          HD22      LEU   4  -6.616  -3.513 -20.690
   11   HD21  LEU   4          HD23      LEU   4  -6.192  -4.096 -19.082

  No H/Q in entry =          11
  In of MODEL   19
    1    H    GLU   5           H        GLU   5  -1.825  -5.049 -22.070
    2    HA   GLU   5           HA       GLU   5   0.152  -4.749 -20.028
    3    HB2  GLU   5           HB2      GLU   5   0.223  -6.522 -21.783
    4    HB3  GLU   5           HB3      GLU   5   0.551  -5.276 -22.986
    5    HG2  GLU   5           HG2      GLU   5   2.669  -6.213 -22.334
    6    HG3  GLU   5           HG3      GLU   5   2.568  -4.607 -21.613

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLU   6           H        GLU   6  -0.483  -3.048 -23.080
    2    HA   GLU   6           HA       GLU   6   1.677  -1.205 -22.811
    3    HB2  GLU   6           HB2      GLU   6   0.580  -1.685 -24.976
    4    HB3  GLU   6           HB3      GLU   6  -0.900  -0.932 -24.379
    5    HG2  GLU   6           HG2      GLU   6   0.291   1.196 -24.074
    6    HG3  GLU   6           HG3      GLU   6   1.786   0.451 -24.633

  No H/Q in entry =           6
  In of MODEL   19
    1    H    VAL   7           H        VAL   7  -1.664  -1.290 -21.775
    2    HA   VAL   7           HA       VAL   7  -1.902   1.424 -20.948
    3    HB   VAL   7           HB       VAL   7  -3.354  -1.099 -20.108
    4   HG11  VAL   7          HG11      VAL   7  -3.746   1.791 -19.304
    5   HG13  VAL   7          HG12      VAL   7  -3.643   0.370 -18.264
    6   HG12  VAL   7          HG13      VAL   7  -5.073   0.629 -19.262
    7   HG21  VAL   7          HG21      VAL   7  -3.509  -0.030 -22.500
    8   HG23  VAL   7          HG22      VAL   7  -4.463   1.216 -21.695
    9   HG22  VAL   7          HG23      VAL   7  -5.001  -0.464 -21.665

  No H/Q in entry =           9
  In of MODEL   19
    1    H    VAL   8           H        VAL   8  -0.904  -1.551 -19.293
    2    HA   VAL   8           HA       VAL   8  -0.599  -0.462 -16.700
    3    HB   VAL   8           HB       VAL   8   0.797  -2.782 -18.054
    4   HG12  VAL   8          HG11      VAL   8   1.211  -3.407 -15.562
    5   HG11  VAL   8          HG12      VAL   8   0.955  -1.691 -15.248
    6   HG13  VAL   8          HG13      VAL   8   2.267  -2.207 -16.307
    7   HG23  VAL   8          HG21      VAL   8  -1.105  -3.237 -15.820
    8   HG22  VAL   8          HG22      VAL   8  -0.975  -4.065 -17.369
    9   HG21  VAL   8          HG23      VAL   8  -1.848  -2.540 -17.258

  No H/Q in entry =           9
  In of MODEL   19
    1    H    MET   9           H        MET   9   1.659  -0.760 -19.439
    2    HA   MET   9           HA       MET   9   3.937   0.297 -18.174
    3    HB2  MET   9           HB2      MET   9   2.997   0.319 -21.042
    4    HB3  MET   9           HB3      MET   9   4.512   1.081 -20.559
    5    HG2  MET   9           HG2      MET   9   5.267  -1.064 -19.576
    6    HG3  MET   9           HG3      MET   9   3.762  -1.822 -20.100
    7    HE1  MET   9           HE1      MET   9   6.630   0.278 -20.927
    8    HE3  MET   9           HE2      MET   9   7.083  -0.009 -22.604
    9    HE2  MET   9           HE3      MET   9   7.521  -1.183 -21.367

  No H/Q in entry =           9
  In of MODEL   19
    1    H    GLY  10           H        GLY  10   1.250   1.883 -19.864
    2    HA3  GLY  10           HA2      GLY  10   2.201   4.541 -19.624
    3    HA2  GLY  10           HA3      GLY  10   0.514   4.073 -19.833

  No H/Q in entry =           3
  In of MODEL   19
    1    H    LEU  11           H        LEU  11   0.115   2.550 -17.543
    2    HA   LEU  11           HA       LEU  11  -0.428   4.531 -15.591
    3    HB2  LEU  11           HB2      LEU  11  -0.349   1.516 -15.426
    4    HB3  LEU  11           HB3      LEU  11  -0.866   2.540 -14.088
    5    HG   LEU  11           HG       LEU  11  -2.098   2.641 -16.855
    6   HD13  LEU  11          HD11      LEU  11  -2.675   0.498 -16.095
    7   HD12  LEU  11          HD12      LEU  11  -4.031   1.486 -15.556
    8   HD11  LEU  11          HD13      LEU  11  -2.776   1.014 -14.411
    9   HD22  LEU  11          HD21      LEU  11  -2.699   4.658 -15.855
   10   HD21  LEU  11          HD22      LEU  11  -2.626   3.996 -14.222
   11   HD23  LEU  11          HD23      LEU  11  -3.997   3.622 -15.267

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  12           H        ILE  12   2.125   2.074 -15.820
    2    HA   ILE  12           HA       ILE  12   3.322   2.623 -13.315
    3    HB   ILE  12           HB       ILE  12   4.589   1.581 -15.871
    4   HG12  ILE  12          HG12      ILE  12   2.574   0.347 -14.729
    5   HG13  ILE  12          HG13      ILE  12   3.976  -0.585 -15.215
    6   HG22  ILE  12          HG21      ILE  12   6.258   0.561 -14.272
    7   HG21  ILE  12          HG22      ILE  12   5.552   1.548 -12.992
    8   HG23  ILE  12          HG23      ILE  12   6.333   2.320 -14.372
    9   HD11  ILE  12          HD11      ILE  12   3.520   0.520 -12.431
   10   HD13  ILE  12          HD12      ILE  12   4.795  -0.589 -12.934
   11   HD12  ILE  12          HD13      ILE  12   3.128  -1.119 -12.922

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  13           H        ILE  13   3.926   3.879 -16.574
    2    HA   ILE  13           HA       ILE  13   6.055   5.609 -15.849
    3    HB   ILE  13           HB       ILE  13   4.028   5.682 -18.099
    4   HG12  ILE  13          HG12      ILE  13   5.856   3.837 -17.815
    5   HG13  ILE  13          HG13      ILE  13   5.624   4.581 -19.393
    6   HG23  ILE  13          HG21      ILE  13   4.653   7.905 -18.144
    7   HG22  ILE  13          HG22      ILE  13   5.958   7.225 -19.108
    8   HG21  ILE  13          HG23      ILE  13   6.227   7.600 -17.407
    9   HD13  ILE  13          HD11      ILE  13   7.553   6.030 -19.064
   10   HD12  ILE  13          HD12      ILE  13   8.037   4.381 -18.686
   11   HD11  ILE  13          HD13      ILE  13   7.693   5.514 -17.384

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ASN  14           H        ASN  14   2.547   6.090 -16.126
    2    HA   ASN  14           HA       ASN  14   2.493   8.838 -15.497
    3    HB2  ASN  14           HB2      ASN  14   0.608   7.187 -16.327
    4    HB3  ASN  14           HB3      ASN  14   0.283   7.012 -14.607
    5   HD21  ASN  14          HD21      ASN  14  -1.737   8.156 -16.047
    6   HD22  ASN  14          HD22      ASN  14  -1.807   9.830 -15.784

  No H/Q in entry =           6
  In of MODEL   19
    1    H    SER  15           H        SER  15   2.204   5.966 -13.413
    2    HA   SER  15           HA       SER  15   1.887   7.342 -10.969
    3    HB2  SER  15           HB2      SER  15   2.444   5.261  -9.912
    4    HB3  SER  15           HB3      SER  15   1.617   4.835 -11.407
    5    HG   SER  15           HG       SER  15   4.256   4.503 -10.667

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLY  16           H        GLY  16   4.771   6.251 -12.718
    2    HA3  GLY  16           HA2      GLY  16   6.688   7.021 -10.786
    3    HA2  GLY  16           HA3      GLY  16   6.996   6.815 -12.508

  No H/Q in entry =           3
  In of MODEL   19
    1    H    GLN  17           H        GLN  17   5.301   8.763 -13.580
    2    HA   GLN  17           HA       GLN  17   6.867  11.112 -13.275
    3    HB2  GLN  17           HB2      GLN  17   5.554  10.621 -15.318
    4    HB3  GLN  17           HB3      GLN  17   4.063  10.836 -14.400
    5    HG2  GLN  17           HG2      GLN  17   4.611  13.160 -13.948
    6    HG3  GLN  17           HG3      GLN  17   6.189  12.970 -14.714
    7   HE21  GLN  17          HE21      GLN  17   4.329  14.917 -15.671
    8   HE22  GLN  17          HE22      GLN  17   3.801  14.440 -17.212

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ALA  18           H        ALA  18   3.768  10.084 -11.930
    2    HA   ALA  18           HA       ALA  18   3.029  12.472 -10.673
    3    HB1  ALA  18           HB1      ALA  18   1.912  10.010 -10.890
    4    HB2  ALA  18           HB2      ALA  18   1.355  11.230  -9.748
    5    HB3  ALA  18           HB3      ALA  18   2.450   9.955  -9.212

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ARG  19           H        ARG  19   4.914   9.722  -9.381
    2    HA   ARG  19           HA       ARG  19   5.435  10.890  -6.862
    3    HB2  ARG  19           HB2      ARG  19   5.862   8.488  -7.381
    4    HB3  ARG  19           HB3      ARG  19   7.218   8.978  -8.400
    5    HG2  ARG  19           HG2      ARG  19   8.328  10.029  -6.478
    6    HG3  ARG  19           HG3      ARG  19   6.952   9.637  -5.449
    7    HD2  ARG  19           HD2      ARG  19   8.721   8.012  -5.082
    8    HD3  ARG  19           HD3      ARG  19   7.353   7.220  -5.869
    9    HE   ARG  19           HE       ARG  19   9.058   8.042  -7.914
   10   HH21  ARG  19          HH11      ARG  19  10.628   6.643  -8.757
   11   HH22  ARG  19          HH12      ARG  19  11.178   5.301  -7.817
   12   HH11  ARG  19          HH21      ARG  19   9.135   6.020  -5.130
   13   HH12  ARG  19          HH22      ARG  19  10.330   4.948  -5.762

  No H/Q in entry =          13
  In of MODEL   19
    1    H    SER  20           H        SER  20   7.259  10.921  -9.906
    2    HA   SER  20           HA       SER  20   9.494  12.351  -9.081
    3    HB2  SER  20           HB2      SER  20   9.535  11.469 -11.283
    4    HB3  SER  20           HB3      SER  20   8.032  12.276 -11.716
    5    HG   SER  20           HG       SER  20  10.611  13.355 -11.338

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU  21           H        LEU  21   6.390  13.599 -10.289
    2    HA   LEU  21           HA       LEU  21   7.044  16.349 -10.071
    3    HB2  LEU  21           HB2      LEU  21   4.384  14.910  -9.993
    4    HB3  LEU  21           HB3      LEU  21   4.541  16.664 -10.002
    5    HG   LEU  21           HG       LEU  21   5.761  14.877 -12.125
    6   HD11  LEU  21          HD11      LEU  21   3.093  16.312 -12.055
    7   HD13  LEU  21          HD12      LEU  21   3.372  14.581 -12.252
    8   HD12  LEU  21          HD13      LEU  21   3.832  15.700 -13.535
    9   HD22  LEU  21          HD21      LEU  21   6.870  16.923 -12.324
   10   HD21  LEU  21          HD22      LEU  21   5.506  17.856 -11.719
   11   HD23  LEU  21          HD23      LEU  21   5.478  17.227 -13.358

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ALA  22           H        ALA  22   5.541  14.057  -7.820
    2    HA   ALA  22           HA       ALA  22   4.922  15.867  -5.759
    3    HB3  ALA  22           HB1      ALA  22   4.176  13.469  -5.917
    4    HB2  ALA  22           HB2      ALA  22   4.758  13.949  -4.323
    5    HB1  ALA  22           HB3      ALA  22   5.790  12.995  -5.389

  No H/Q in entry =           5
  In of MODEL   19
    1    H    TYR  23           H        TYR  23   7.870  13.859  -6.185
    2    HA   TYR  23           HA       TYR  23   9.241  14.894  -3.933
    3    HB2  TYR  23           HB2      TYR  23  10.043  12.888  -5.084
    4    HB3  TYR  23           HB3      TYR  23  10.355  13.825  -6.545
    5    HD1  TYR  23           HD1      TYR  23  11.310  13.505  -2.949
    6    HD2  TYR  23           HD2      TYR  23  12.383  15.007  -6.828
    7    HE1  TYR  23           HE1      TYR  23  13.562  14.099  -2.097
    8    HE2  TYR  23           HE2      TYR  23  14.634  15.603  -5.975
    9    HH   TYR  23           HH       TYR  23  15.513  15.041  -2.563

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ALA  24           H        ALA  24   9.058  15.990  -7.303
    2    HA   ALA  24           HA       ALA  24  10.938  18.089  -7.058
    3    HB2  ALA  24           HB1      ALA  24  10.500  18.142  -9.268
    4    HB3  ALA  24           HB2      ALA  24   8.938  18.881  -8.914
    5    HB1  ALA  24           HB3      ALA  24   9.077  17.129  -9.039

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA  25           H        ALA  25   7.459  17.881  -6.444
    2    HA   ALA  25           HA       ALA  25   6.957  20.597  -5.884
    3    HB1  ALA  25           HB1      ALA  25   5.312  18.585  -6.083
    4    HB2  ALA  25           HB2      ALA  25   4.932  19.874  -4.939
    5    HB3  ALA  25           HB3      ALA  25   5.631  18.361  -4.362

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU  26           H        LEU  26   8.042  17.932  -3.824
    2    HA   LEU  26           HA       LEU  26   8.130  19.371  -1.391
    3    HB2  LEU  26           HB2      LEU  26   8.244  16.955  -1.378
    4    HB3  LEU  26           HB3      LEU  26   9.717  16.972  -2.345
    5    HG   LEU  26           HG       LEU  26  10.918  18.105  -0.506
    6   HD12  LEU  26          HD11      LEU  26   9.687  18.110   1.751
    7   HD11  LEU  26          HD12      LEU  26   8.203  17.957   0.813
    8   HD13  LEU  26          HD13      LEU  26   9.236  19.371   0.603
    9   HD21  LEU  26          HD21      LEU  26   9.403  15.627   0.371
   10   HD23  LEU  26          HD22      LEU  26  10.912  16.204   1.070
   11   HD22  LEU  26          HD23      LEU  26  10.875  15.640  -0.598

  No H/Q in entry =          11
  In of MODEL   19
    1    H    LYS  27           H        LYS  27  10.557  18.811  -3.909
    2    HA   LYS  27           HA       LYS  27  12.728  20.074  -2.680
    3    HB2  LYS  27           HB2      LYS  27  12.845  18.721  -4.765
    4    HB3  LYS  27           HB3      LYS  27  12.071  20.044  -5.636
    5    HG2  LYS  27           HG2      LYS  27  13.922  21.547  -5.059
    6    HG3  LYS  27           HG3      LYS  27  14.691  20.264  -4.117
    7    HD2  LYS  27           HD2      LYS  27  14.851  18.872  -6.166
    8    HD3  LYS  27           HD3      LYS  27  14.127  20.181  -7.100
    9    HE2  LYS  27           HE2      LYS  27  16.000  21.665  -6.488
   10    HE3  LYS  27           HE3      LYS  27  16.728  20.360  -5.545
   11    HZ3  LYS  27           HZ1      LYS  27  17.722  20.462  -7.730
   12    HZ2  LYS  27           HZ2      LYS  27  16.198  20.328  -8.473
   13    HZ1  LYS  27           HZ3      LYS  27  16.831  19.025  -7.584

  No H/Q in entry =          13
  In of MODEL   19
    1    H    GLN  28           H        GLN  28  10.097  21.426  -4.638
    2    HA   GLN  28           HA       GLN  28  11.033  24.087  -4.798
    3    HB2  GLN  28           HB2      GLN  28   8.209  22.993  -4.687
    4    HB3  GLN  28           HB3      GLN  28   8.609  24.667  -5.069
    5    HG2  GLN  28           HG2      GLN  28   9.624  22.254  -6.600
    6    HG3  GLN  28           HG3      GLN  28   8.287  23.280  -7.114
    7   HE21  GLN  28          HE21      GLN  28  11.415  22.796  -7.859
    8   HE22  GLN  28          HE22      GLN  28  11.901  24.381  -8.222

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ALA  29           H        ALA  29   9.112  22.385  -2.360
    2    HA   ALA  29           HA       ALA  29   8.539  24.577  -0.687
    3    HB2  ALA  29           HB1      ALA  29   7.821  23.007   0.885
    4    HB1  ALA  29           HB2      ALA  29   9.054  21.832   0.426
    5    HB3  ALA  29           HB3      ALA  29   7.667  22.110  -0.626

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LYS  30           H        LYS  30  11.290  22.335  -0.743
    2    HA   LYS  30           HA       LYS  30  12.594  23.308   1.559
    3    HB2  LYS  30           HB2      LYS  30  13.708  22.024  -0.945
    4    HB3  LYS  30           HB3      LYS  30  14.684  22.397   0.478
    5    HG2  LYS  30           HG2      LYS  30  13.141  21.004   1.859
    6    HG3  LYS  30           HG3      LYS  30  12.263  20.569   0.388
    7    HD2  LYS  30           HD2      LYS  30  14.318  19.599  -0.565
    8    HD3  LYS  30           HD3      LYS  30  15.215  20.048   0.887
    9    HE2  LYS  30           HE2      LYS  30  13.721  18.607   2.243
   10    HE3  LYS  30           HE3      LYS  30  12.854  18.138   0.775
   11    HZ2  LYS  30           HZ1      LYS  30  14.659  16.579   1.544
   12    HZ1  LYS  30           HZ2      LYS  30  15.786  17.775   1.091
   13    HZ3  LYS  30           HZ3      LYS  30  14.759  17.078  -0.073

  No H/Q in entry =          13
  In of MODEL   19
    1    H    GLN  31           H        GLN  31  12.481  24.501  -1.741
    2    HA   GLN  31           HA       GLN  31  14.615  26.416  -1.321
    3    HB2  GLN  31           HB2      GLN  31  12.576  26.437  -3.550
    4    HB3  GLN  31           HB3      GLN  31  14.190  27.147  -3.550
    5    HG2  GLN  31           HG2      GLN  31  14.676  24.458  -2.965
    6    HG3  GLN  31           HG3      GLN  31  13.375  24.388  -4.146
    7   HE21  GLN  31          HE21      GLN  31  16.227  23.620  -4.542
    8   HE22  GLN  31          HE22      GLN  31  16.792  24.594  -5.810

  No H/Q in entry =           8
  In of MODEL   19
    1    H    GLY  32           H        GLY  32  11.540  26.208  -0.182
    2    HA3  GLY  32           HA2      GLY  32  10.367  27.770   1.084
    3    HA2  GLY  32           HA3      GLY  32  11.482  29.014   0.533

  No H/Q in entry =           3
  In of MODEL   19
    1    H    ASP  33           H        ASP  33  10.140  27.089  -1.956
    2    HA   ASP  33           HA       ASP  33   8.456  29.344  -2.822
    3    HB2  ASP  33           HB2      ASP  33   9.575  26.930  -4.255
    4    HB3  ASP  33           HB3      ASP  33   8.415  28.033  -4.991

  No H/Q in entry =           4
  In of MODEL   19
    1    H    PHE  34           H        PHE  34   6.769  28.857  -1.261
    2    HA   PHE  34           HA       PHE  34   5.413  26.372  -1.160
    3    HB2  PHE  34           HB2      PHE  34   4.424  29.152  -0.491
    4    HB3  PHE  34           HB3      PHE  34   3.589  27.655  -0.077
    5    HD1  PHE  34           HD1      PHE  34   5.813  30.079   1.135
    6    HD2  PHE  34           HD2      PHE  34   5.173  25.831   1.093
    7    HE1  PHE  34           HE1      PHE  34   7.202  29.847   3.175
    8    HE2  PHE  34           HE2      PHE  34   6.564  25.604   3.131
    9    HZ   PHE  34           HZ       PHE  34   7.573  27.613   4.172

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ALA  35           H        ALA  35   4.960  29.226  -3.181
    2    HA   ALA  35           HA       ALA  35   2.416  28.584  -4.209
    3    HB3  ALA  35           HB1      ALA  35   3.459  29.980  -6.249
    4    HB2  ALA  35           HB2      ALA  35   4.671  30.357  -5.024
    5    HB1  ALA  35           HB3      ALA  35   2.976  30.750  -4.738

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA  36           H        ALA  36   5.654  27.937  -5.555
    2    HA   ALA  36           HA       ALA  36   4.683  26.492  -7.796
    3    HB3  ALA  36           HB1      ALA  36   6.842  26.635  -8.408
    4    HB2  ALA  36           HB2      ALA  36   7.330  25.615  -7.053
    5    HB1  ALA  36           HB3      ALA  36   7.208  27.362  -6.843

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA  37           H        ALA  37   5.642  25.517  -4.536
    2    HA   ALA  37           HA       ALA  37   5.611  22.727  -4.956
    3    HB2  ALA  37           HB1      ALA  37   5.328  24.523  -2.584
    4    HB1  ALA  37           HB2      ALA  37   6.474  23.215  -2.870
    5    HB3  ALA  37           HB3      ALA  37   4.815  22.847  -2.401

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LYS  38           H        LYS  38   3.054  24.914  -3.800
    2    HA   LYS  38           HA       LYS  38   0.972  23.082  -3.576
    3    HB2  LYS  38           HB2      LYS  38   1.297  25.842  -3.333
    4    HB3  LYS  38           HB3      LYS  38   0.101  25.679  -4.614
    5    HG2  LYS  38           HG2      LYS  38  -1.338  24.347  -3.170
    6    HG3  LYS  38           HG3      LYS  38  -0.096  24.302  -1.911
    7    HD2  LYS  38           HD2      LYS  38  -0.305  26.638  -1.471
    8    HD3  LYS  38           HD3      LYS  38  -1.217  26.914  -2.956
    9    HE2  LYS  38           HE2      LYS  38  -2.725  26.940  -1.020
   10    HE3  LYS  38           HE3      LYS  38  -3.083  25.557  -2.059
   11    HZ3  LYS  38           HZ1      LYS  38  -2.347  24.098  -0.520
   12    HZ2  LYS  38           HZ2      LYS  38  -2.712  25.355   0.565
   13    HZ1  LYS  38           HZ3      LYS  38  -1.114  25.118   0.044

  No H/Q in entry =          13
  In of MODEL   19
    1    H    ALA  39           H        ALA  39   1.939  24.985  -6.429
    2    HA   ALA  39           HA       ALA  39  -0.125  24.092  -8.133
    3    HB2  ALA  39           HB1      ALA  39   2.607  24.763  -9.183
    4    HB1  ALA  39           HB2      ALA  39   1.627  26.017  -8.424
    5    HB3  ALA  39           HB3      ALA  39   1.026  25.170  -9.849

  No H/Q in entry =           5
  In of MODEL   19
    1    H    MET  40           H        MET  40   3.124  22.826  -7.543
    2    HA   MET  40           HA       MET  40   3.050  20.799  -9.528
    3    HB2  MET  40           HB2      MET  40   4.654  21.046  -6.977
    4    HB3  MET  40           HB3      MET  40   4.920  19.789  -8.187
    5    HG2  MET  40           HG2      MET  40   4.950  22.743  -8.862
    6    HG3  MET  40           HG3      MET  40   6.404  21.856  -8.407
    7    HE3  MET  40           HE1      MET  40   7.303  19.641 -11.207
    8    HE2  MET  40           HE2      MET  40   6.739  19.321  -9.569
    9    HE1  MET  40           HE3      MET  40   7.822  20.678  -9.871

  No H/Q in entry =           9
  In of MODEL   19
    1    H    MET  41           H        MET  41   2.128  20.843  -6.107
    2    HA   MET  41           HA       MET  41   1.622  18.074  -5.821
    3    HB2  MET  41           HB2      MET  41   0.263  20.423  -4.480
    4    HB3  MET  41           HB3      MET  41   0.123  18.745  -3.967
    5    HG2  MET  41           HG2      MET  41   2.831  18.995  -4.000
    6    HG3  MET  41           HG3      MET  41   2.374  20.650  -3.610
    7    HE2  MET  41           HE1      MET  41  -0.657  19.372  -1.887
    8    HE1  MET  41           HE2      MET  41   0.146  20.892  -2.267
    9    HE3  MET  41           HE3      MET  41   0.089  20.326  -0.598

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ASP  42           H        ASP  42  -0.441  20.775  -6.808
    2    HA   ASP  42           HA       ASP  42  -2.868  19.390  -6.945
    3    HB2  ASP  42           HB2      ASP  42  -2.186  21.966  -7.208
    4    HB3  ASP  42           HB3      ASP  42  -2.330  21.565  -8.916

  No H/Q in entry =           4
  In of MODEL   19
    1    H    GLN  43           H        GLN  43  -0.428  19.998  -9.444
    2    HA   GLN  43           HA       GLN  43  -1.798  18.658 -11.532
    3    HB2  GLN  43           HB2      GLN  43   1.155  19.205 -11.146
    4    HB3  GLN  43           HB3      GLN  43   0.450  18.553 -12.628
    5    HG2  GLN  43           HG2      GLN  43  -1.082  20.565 -12.678
    6    HG3  GLN  43           HG3      GLN  43  -0.138  21.235 -11.351
    7   HE21  GLN  43          HE21      GLN  43   0.011  22.850 -13.442
    8   HE22  GLN  43          HE22      GLN  43   1.430  22.641 -14.345

  No H/Q in entry =           8
  In of MODEL   19
    1    H    SER  44           H        SER  44   0.560  17.549  -9.133
    2    HA   SER  44           HA       SER  44   0.923  14.943 -10.149
    3    HB2  SER  44           HB2      SER  44   1.799  16.398  -7.916
    4    HB3  SER  44           HB3      SER  44   0.949  15.007  -7.242
    5    HG   SER  44           HG       SER  44   3.067  14.408  -7.662

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ARG  45           H        ARG  45  -1.415  16.244  -7.820
    2    HA   ARG  45           HA       ARG  45  -2.778  13.871  -7.181
    3    HB2  ARG  45           HB2      ARG  45  -3.002  16.041  -5.996
    4    HB3  ARG  45           HB3      ARG  45  -3.862  16.695  -7.387
    5    HG2  ARG  45           HG2      ARG  45  -5.610  14.951  -7.102
    6    HG3  ARG  45           HG3      ARG  45  -4.762  14.353  -5.675
    7    HD2  ARG  45           HD2      ARG  45  -4.995  16.620  -4.626
    8    HD3  ARG  45           HD3      ARG  45  -5.984  17.126  -6.013
    9    HE   ARG  45           HE       ARG  45  -7.072  14.741  -4.967
   10   HH21  ARG  45          HH11      ARG  45  -8.911  14.801  -3.701
   11   HH22  ARG  45          HH12      ARG  45  -9.323  16.239  -2.837
   12   HH11  ARG  45          HH21      ARG  45  -6.562  17.997  -3.953
   13   HH12  ARG  45          HH22      ARG  45  -7.988  18.049  -2.978

  No H/Q in entry =          13
  In of MODEL   19
    1    H    MET  46           H        MET  46  -3.383  16.261  -9.740
    2    HA   MET  46           HA       MET  46  -5.707  15.061 -10.803
    3    HB2  MET  46           HB2      MET  46  -3.623  16.911 -11.972
    4    HB3  MET  46           HB3      MET  46  -4.988  16.330 -12.931
    5    HG2  MET  46           HG2      MET  46  -6.563  17.247 -11.301
    6    HG3  MET  46           HG3      MET  46  -5.236  17.760 -10.267
    7    HE3  MET  46           HE1      MET  46  -5.564  18.243 -14.426
    8    HE2  MET  46           HE2      MET  46  -6.807  19.459 -14.149
    9    HE1  MET  46           HE3      MET  46  -6.997  17.843 -13.471

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ALA  47           H        ALA  47  -2.271  14.616 -11.552
    2    HA   ALA  47           HA       ALA  47  -2.593  12.878 -13.758
    3    HB3  ALA  47           HB1      ALA  47  -0.426  13.793 -13.404
    4    HB2  ALA  47           HB2      ALA  47  -0.267  12.067 -13.065
    5    HB1  ALA  47           HB3      ALA  47  -0.375  13.222 -11.735

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU  48           H        LEU  48  -2.324  12.256 -10.281
    2    HA   LEU  48           HA       LEU  48  -2.387   9.415 -10.431
    3    HB2  LEU  48           HB2      LEU  48  -3.177  11.331  -8.225
    4    HB3  LEU  48           HB3      LEU  48  -3.064   9.583  -8.018
    5    HG   LEU  48           HG       LEU  48  -0.782  11.304  -9.016
    6   HD13  LEU  48          HD11      LEU  48  -1.078  12.078  -6.828
    7   HD12  LEU  48          HD12      LEU  48   0.099  10.784  -6.623
    8   HD11  LEU  48          HD13      LEU  48  -1.597  10.504  -6.228
    9   HD22  LEU  48          HD21      LEU  48  -0.258   9.122  -9.649
   10   HD21  LEU  48          HD22      LEU  48  -1.122   8.402  -8.292
   11   HD23  LEU  48          HD23      LEU  48   0.441   9.173  -8.031

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ASN  49           H        ASN  49  -4.878  11.881 -10.043
    2    HA   ASN  49           HA       ASN  49  -7.047  10.194  -9.503
    3    HB2  ASN  49           HB2      ASN  49  -7.125  12.620  -9.190
    4    HB3  ASN  49           HB3      ASN  49  -6.975  12.872 -10.924
    5   HD21  ASN  49          HD21      ASN  49  -9.188  13.932  -9.569
    6   HD22  ASN  49          HD22      ASN  49 -10.585  13.078 -10.011

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLU  50           H        GLU  50  -5.774  11.395 -12.591
    2    HA   GLU  50           HA       GLU  50  -7.710  10.113 -14.237
    3    HB2  GLU  50           HB2      GLU  50  -6.263  11.946 -15.054
    4    HB3  GLU  50           HB3      GLU  50  -4.857  10.890 -14.909
    5    HG2  GLU  50           HG2      GLU  50  -5.810   9.338 -16.543
    6    HG3  GLU  50           HG3      GLU  50  -7.281  10.300 -16.637

  No H/Q in entry =           6
  In of MODEL   19
    1    H    ALA  51           H        ALA  51  -4.532   9.160 -13.021
    2    HA   ALA  51           HA       ALA  51  -4.362   6.704 -14.431
    3    HB2  ALA  51           HB1      ALA  51  -2.381   6.442 -13.325
    4    HB1  ALA  51           HB2      ALA  51  -3.077   6.861 -11.761
    5    HB3  ALA  51           HB3      ALA  51  -2.633   8.134 -12.898

  No H/Q in entry =           5
  In of MODEL   19
    1    H    HIS  52           H        HIS  52  -5.552   7.534 -11.187
    2    HA   HIS  52           HA       HIS  52  -6.210   4.919 -10.349
    3    HB2  HIS  52           HB2      HIS  52  -6.096   6.896  -8.850
    4    HB3  HIS  52           HB3      HIS  52  -7.569   7.517  -9.596
    5    HD1  HIS  52           HD1      HIS  52  -9.768   6.062  -9.256
    6    HD2  HIS  52           HD2      HIS  52  -6.508   4.882  -6.943
    7    HE1  HIS  52           HE1      HIS  52 -10.683   4.531  -7.458
    8    HE2  HIS  52           HE2      HIS  52  -8.707   3.803  -6.039

  No H/Q in entry =           8
  In of MODEL   19
    1    H    LEU  53           H        LEU  53  -8.053   7.351 -12.149
    2    HA   LEU  53           HA       LEU  53 -10.544   6.032 -12.164
    3    HB2  LEU  53           HB2      LEU  53  -9.276   8.024 -14.031
    4    HB3  LEU  53           HB3      LEU  53 -10.863   7.336 -14.365
    5    HG   LEU  53           HG       LEU  53 -10.187   8.664 -11.720
    6   HD12  LEU  53          HD11      LEU  53 -11.454  10.629 -12.657
    7   HD11  LEU  53          HD12      LEU  53 -11.384   9.852 -14.238
    8   HD13  LEU  53          HD13      LEU  53  -9.900  10.351 -13.433
    9   HD21  LEU  53          HD21      LEU  53 -12.726   7.754 -13.088
   10   HD23  LEU  53          HD22      LEU  53 -12.767   9.023 -11.869
   11   HD22  LEU  53          HD23      LEU  53 -12.201   7.418 -11.444

  No H/Q in entry =          11
  In of MODEL   19
    1    H    VAL  54           H        VAL  54  -7.786   5.857 -14.393
    2    HA   VAL  54           HA       VAL  54  -8.985   4.068 -16.234
    3    HB   VAL  54           HB       VAL  54  -6.085   4.607 -15.546
    4   HG12  VAL  54          HG11      VAL  54  -5.820   3.517 -17.931
    5   HG11  VAL  54          HG12      VAL  54  -7.342   2.721 -17.529
    6   HG13  VAL  54          HG13      VAL  54  -5.926   2.485 -16.506
    7   HG22  VAL  54          HG21      VAL  54  -6.872   6.539 -16.599
    8   HG21  VAL  54          HG22      VAL  54  -8.054   5.660 -17.567
    9   HG23  VAL  54          HG23      VAL  54  -6.346   5.596 -17.993

  No H/Q in entry =           9
  In of MODEL   19
    1    H    GLN  55           H        GLN  55  -6.988   3.552 -13.328
    2    HA   GLN  55           HA       GLN  55  -6.869   0.735 -13.575
    3    HB2  GLN  55           HB2      GLN  55  -5.327   1.652 -12.055
    4    HB3  GLN  55           HB3      GLN  55  -6.555   2.608 -11.231
    5    HG2  GLN  55           HG2      GLN  55  -7.229   0.848  -9.910
    6    HG3  GLN  55           HG3      GLN  55  -6.989  -0.341 -11.184
    7   HE21  GLN  55          HE21      GLN  55  -5.352  -1.772 -10.680
    8   HE22  GLN  55          HE22      GLN  55  -3.974  -1.404  -9.766

  No H/Q in entry =           8
  In of MODEL   19
    1    H    THR  56           H        THR  56  -9.226   2.879 -11.973
    2    HA   THR  56           HA       THR  56 -10.795   0.984 -10.682
    3    HB   THR  56           HB       THR  56 -11.912   3.355 -12.199
    4    HG1  THR  56           HG1      THR  56 -10.170   3.214 -10.112
    5   HG22  THR  56          HG21      THR  56 -12.799   2.279  -9.532
    6   HG21  THR  56          HG22      THR  56 -13.387   1.561 -11.033
    7   HG23  THR  56          HG23      THR  56 -13.705   3.261 -10.684

  No H/Q in entry =           7
  In of MODEL   19
    1    H    LYS  57           H        LYS  57 -10.999   2.054 -14.072
    2    HA   LYS  57           HA       LYS  57 -13.136   0.343 -14.826
    3    HB2  LYS  57           HB2      LYS  57 -12.273   2.299 -16.146
    4    HB3  LYS  57           HB3      LYS  57 -10.826   1.370 -16.509
    5    HG2  LYS  57           HG2      LYS  57 -12.159  -0.316 -17.676
    6    HG3  LYS  57           HG3      LYS  57 -13.643   0.534 -17.259
    7    HD2  LYS  57           HD2      LYS  57 -12.854   2.506 -18.552
    8    HD3  LYS  57           HD3      LYS  57 -11.407   1.614 -19.010
    9    HE2  LYS  57           HE2      LYS  57 -12.798  -0.093 -20.131
   10    HE3  LYS  57           HE3      LYS  57 -14.262   0.771 -19.664
   11    HZ1  LYS  57           HZ1      LYS  57 -12.233   2.318 -21.060
   12    HZ3  LYS  57           HZ2      LYS  57 -13.927   2.366 -21.193
   13    HZ2  LYS  57           HZ3      LYS  57 -13.044   1.143 -21.977

  No H/Q in entry =          13
  In of MODEL   19
    1    H    LEU  58           H        LEU  58  -9.627  -0.053 -14.758
    2    HA   LEU  58           HA       LEU  58  -9.607  -2.574 -16.038
    3    HB2  LEU  58           HB2      LEU  58  -7.591  -1.256 -14.228
    4    HB3  LEU  58           HB3      LEU  58  -7.312  -2.778 -15.077
    5    HG   LEU  58           HG       LEU  58  -8.088  -0.186 -16.451
    6   HD11  LEU  58          HD11      LEU  58  -5.431  -1.394 -15.748
    7   HD13  LEU  58          HD12      LEU  58  -5.943   0.292 -15.707
    8   HD12  LEU  58          HD13      LEU  58  -5.592  -0.481 -17.249
    9   HD22  LEU  58          HD21      LEU  58  -8.644  -1.759 -18.038
   10   HD21  LEU  58          HD22      LEU  58  -7.592  -2.994 -17.349
   11   HD23  LEU  58          HD23      LEU  58  -6.911  -1.717 -18.357

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  59           H        ILE  59 -10.446  -1.669 -12.792
    2    HA   ILE  59           HA       ILE  59 -10.070  -4.429 -11.834
    3    HB   ILE  59           HB       ILE  59  -9.659  -2.146 -10.444
    4   HG12  ILE  59          HG12      ILE  59 -10.981  -4.525  -9.120
    5   HG13  ILE  59          HG13      ILE  59  -9.335  -4.565  -9.697
    6   HG23  ILE  59          HG21      ILE  59 -11.503  -1.494  -9.123
    7   HG22  ILE  59          HG22      ILE  59 -12.418  -2.933  -9.509
    8   HG21  ILE  59          HG23      ILE  59 -12.203  -1.667 -10.715
    9   HD11  ILE  59          HD11      ILE  59 -10.393  -2.531  -7.748
   10   HD13  ILE  59          HD12      ILE  59  -8.719  -2.700  -8.256
   11   HD12  ILE  59          HD13      ILE  59  -9.477  -3.961  -7.283

  No H/Q in entry =          11
  In of MODEL   19
    1    H    GLU  60           H        GLU  60 -12.649  -2.143 -12.658
    2    HA   GLU  60           HA       GLU  60 -14.821  -3.678 -11.646
    3    HB2  GLU  60           HB2      GLU  60 -15.060  -1.311 -12.248
    4    HB3  GLU  60           HB3      GLU  60 -14.724  -1.691 -13.935
    5    HG2  GLU  60           HG2      GLU  60 -16.743  -3.135 -13.997
    6    HG3  GLU  60           HG3      GLU  60 -17.093  -2.695 -12.339

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLY  61           H        GLY  61 -13.139  -3.656 -14.756
    2    HA3  GLY  61           HA2      GLY  61 -14.826  -5.922 -15.643
    3    HA2  GLY  61           HA3      GLY  61 -13.989  -4.812 -16.722

  No H/Q in entry =           3
  In of MODEL   19
    1    H    ASP  62           H        ASP  62 -12.609  -6.237 -13.829
    2    HA   ASP  62           HA       ASP  62 -10.308  -7.150 -15.244
    3    HB2  ASP  62           HB2      ASP  62  -9.707  -8.112 -13.006
    4    HB3  ASP  62           HB3      ASP  62 -10.100  -6.397 -12.964

  No H/Q in entry =           4
  In of MODEL   19
    1    H    ALA  63           H        ALA  63 -13.361  -8.673 -14.468
    2    HA   ALA  63           HA       ALA  63 -12.609 -11.403 -14.441
    3    HB1  ALA  63           HB1      ALA  63 -15.001 -11.733 -15.303
    4    HB3  ALA  63           HB2      ALA  63 -15.133  -9.975 -15.330
    5    HB2  ALA  63           HB3      ALA  63 -14.850 -10.816 -13.804

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLY  64           H        GLY  64 -13.391  -9.189 -17.068
    2    HA3  GLY  64           HA2      GLY  64 -13.085  -9.290 -19.335
    3    HA2  GLY  64           HA3      GLY  64 -11.765 -10.403 -19.001

  No H/Q in entry =           3
  In of MODEL   19
    1    H    GLU  65           H        GLU  65 -13.105 -10.875 -21.272
    2    HA   GLU  65           HA       GLU  65 -15.406 -12.507 -20.995
    3    HB2  GLU  65           HB2      GLU  65 -13.422 -12.224 -23.248
    4    HB3  GLU  65           HB3      GLU  65 -14.890 -13.196 -23.353
    5    HG2  GLU  65           HG2      GLU  65 -16.266 -11.236 -22.877
    6    HG3  GLU  65           HG3      GLU  65 -14.823 -10.246 -22.664

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLY  66           H        GLY  66 -12.008 -13.199 -21.118
    2    HA3  GLY  66           HA2      GLY  66 -12.046 -15.986 -21.450
    3    HA2  GLY  66           HA3      GLY  66 -10.739 -15.050 -20.752

  No H/Q in entry =           3
  In of MODEL   19
    1    H    LYS  67           H        LYS  67 -10.170 -15.755 -18.849
    2    HA   LYS  67           HA       LYS  67 -11.754 -17.521 -17.293
    3    HB2  LYS  67           HB2      LYS  67  -9.857 -17.571 -15.787
    4    HB3  LYS  67           HB3      LYS  67  -9.289 -17.623 -17.461
    5    HG2  LYS  67           HG2      LYS  67  -8.942 -15.163 -17.400
    6    HG3  LYS  67           HG3      LYS  67  -9.446 -15.148 -15.713
    7    HD2  LYS  67           HD2      LYS  67  -7.564 -16.632 -15.130
    8    HD3  LYS  67           HD3      LYS  67  -7.059 -16.653 -16.822
    9    HE2  LYS  67           HE2      LYS  67  -6.734 -14.212 -16.771
   10    HE3  LYS  67           HE3      LYS  67  -7.265 -14.171 -15.089
   11    HZ3  LYS  67           HZ1      LYS  67  -5.066 -14.352 -14.717
   12    HZ2  LYS  67           HZ2      LYS  67  -4.744 -15.071 -16.221
   13    HZ1  LYS  67           HZ3      LYS  67  -5.359 -16.006 -14.942

  No H/Q in entry =          13
  In of MODEL   19
    1    H    MET  68           H        MET  68 -12.361 -17.360 -15.138
    2    HA   MET  68           HA       MET  68 -13.969 -15.153 -14.501
    3    HB2  MET  68           HB2      MET  68 -13.016 -17.532 -12.934
    4    HB3  MET  68           HB3      MET  68 -14.076 -16.315 -12.224
    5    HG2  MET  68           HG2      MET  68 -14.673 -17.804 -14.795
    6    HG3  MET  68           HG3      MET  68 -15.325 -18.244 -13.215
    7    HE3  MET  68           HE1      MET  68 -17.577 -15.629 -12.092
    8    HE2  MET  68           HE2      MET  68 -15.930 -15.017 -11.967
    9    HE1  MET  68           HE3      MET  68 -16.249 -16.727 -11.687

  No H/Q in entry =           9
  In of MODEL   19
    1    H    LYS  69           H        LYS  69 -10.733 -16.019 -13.238
    2    HA   LYS  69           HA       LYS  69 -10.629 -14.218 -11.131
    3    HB2  LYS  69           HB2      LYS  69  -8.311 -15.113 -12.853
    4    HB3  LYS  69           HB3      LYS  69  -8.213 -14.508 -11.198
    5    HG2  LYS  69           HG2      LYS  69  -9.835 -16.938 -12.003
    6    HG3  LYS  69           HG3      LYS  69  -8.191 -17.027 -11.375
    7    HD2  LYS  69           HD2      LYS  69  -9.084 -15.649  -9.379
    8    HD3  LYS  69           HD3      LYS  69 -10.688 -16.096  -9.961
    9    HE2  LYS  69           HE2      LYS  69 -10.089 -18.479  -9.825
   10    HE3  LYS  69           HE3      LYS  69  -8.469 -18.050  -9.276
   11    HZ2  LYS  69           HZ1      LYS  69 -11.040 -17.762  -7.865
   12    HZ1  LYS  69           HZ2      LYS  69  -9.722 -16.774  -7.451
   13    HZ3  LYS  69           HZ3      LYS  69  -9.596 -18.464  -7.320

  No H/Q in entry =          13
  In of MODEL   19
    1    H    VAL  70           H        VAL  70  -8.029 -12.901 -11.904
    2    HA   VAL  70           HA       VAL  70  -9.049 -10.641 -13.523
    3    HB   VAL  70           HB       VAL  70  -7.969  -9.097 -11.931
    4   HG11  VAL  70          HG11      VAL  70 -10.393  -9.883 -11.719
    5   HG13  VAL  70          HG12      VAL  70  -9.677  -9.205 -10.256
    6   HG12  VAL  70          HG13      VAL  70  -9.832 -10.953 -10.435
    7   HG23  VAL  70          HG21      VAL  70  -7.456 -10.255  -9.607
    8   HG22  VAL  70          HG22      VAL  70  -6.236 -10.261 -10.878
    9   HG21  VAL  70          HG23      VAL  70  -7.224 -11.695 -10.598

  No H/Q in entry =           9
  In of MODEL   19
    1    H    SER  71           H        SER  71  -7.328  -9.296 -14.396
    2    HA   SER  71           HA       SER  71  -5.219 -10.782 -15.591
    3    HB2  SER  71           HB2      SER  71  -6.200  -8.763 -16.634
    4    HB3  SER  71           HB3      SER  71  -5.552  -7.782 -15.322
    5    HG   SER  71           HG       SER  71  -4.346  -8.479 -17.538

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU  72           H        LEU  72  -3.105 -10.987 -15.033
    2    HA   LEU  72           HA       LEU  72  -2.396 -10.755 -12.320
    3    HB2  LEU  72           HB2      LEU  72  -0.731 -11.179 -14.797
    4    HB3  LEU  72           HB3      LEU  72  -0.072 -11.235 -13.166
    5    HG   LEU  72           HG       LEU  72  -2.402 -12.958 -14.071
    6   HD12  LEU  72          HD11      LEU  72  -0.700 -14.791 -14.170
    7   HD11  LEU  72          HD12      LEU  72   0.563 -13.582 -13.949
    8   HD13  LEU  72          HD13      LEU  72  -0.445 -13.549 -15.397
    9   HD22  LEU  72          HD21      LEU  72  -2.430 -12.958 -11.724
   10   HD21  LEU  72          HD22      LEU  72  -0.686 -12.800 -11.590
   11   HD23  LEU  72          HD23      LEU  72  -1.396 -14.340 -12.070

  No H/Q in entry =          11
  In of MODEL   19
    1    H    VAL  73           H        VAL  73  -1.690  -8.743 -15.106
    2    HA   VAL  73           HA       VAL  73   0.211  -7.022 -14.004
    3    HB   VAL  73           HB       VAL  73  -0.214  -5.598 -15.861
    4   HG13  VAL  73          HG11      VAL  73  -0.211  -7.207 -17.717
    5   HG12  VAL  73          HG12      VAL  73  -0.856  -8.454 -16.652
    6   HG11  VAL  73          HG13      VAL  73   0.764  -7.814 -16.380
    7   HG21  VAL  73          HG21      VAL  73  -2.931  -6.869 -15.746
    8   HG23  VAL  73          HG22      VAL  73  -2.336  -6.251 -17.285
    9   HG22  VAL  73          HG23      VAL  73  -2.506  -5.166 -15.905

  No H/Q in entry =           9
  In of MODEL   19
    1    H    LEU  74           H        LEU  74  -3.187  -7.167 -13.456
    2    HA   LEU  74           HA       LEU  74  -3.831  -4.515 -12.856
    3    HB2  LEU  74           HB2      LEU  74  -5.544  -6.198 -13.029
    4    HB3  LEU  74           HB3      LEU  74  -4.849  -7.109 -11.691
    5    HG   LEU  74           HG       LEU  74  -5.340  -5.240 -10.155
    6   HD13  LEU  74          HD11      LEU  74  -5.214  -3.302 -11.517
    7   HD12  LEU  74          HD12      LEU  74  -6.928  -3.457 -11.136
    8   HD11  LEU  74          HD13      LEU  74  -6.325  -3.971 -12.713
    9   HD23  LEU  74          HD21      LEU  74  -7.884  -5.659 -11.634
   10   HD22  LEU  74          HD22      LEU  74  -7.521  -5.824  -9.930
   11   HD21  LEU  74          HD23      LEU  74  -7.034  -7.081 -11.040

  No H/Q in entry =          11
  In of MODEL   19
    1    H    VAL  75           H        VAL  75  -2.773  -7.083 -10.681
    2    HA   VAL  75           HA       VAL  75  -2.596  -5.521  -8.343
    3    HB   VAL  75           HB       VAL  75  -1.077  -8.006  -9.119
    4   HG11  VAL  75          HG11      VAL  75  -1.294  -6.520  -6.463
    5   HG13  VAL  75          HG12      VAL  75   0.169  -6.781  -7.400
    6   HG12  VAL  75          HG13      VAL  75  -0.639  -8.144  -6.643
    7   HG21  VAL  75          HG21      VAL  75  -3.538  -7.439  -7.430
    8   HG23  VAL  75          HG22      VAL  75  -2.729  -9.005  -7.496
    9   HG22  VAL  75          HG23      VAL  75  -3.487  -8.341  -8.945

  No H/Q in entry =           9
  In of MODEL   19
    1    H    GLU  76           H        GLU  76  -0.173  -6.269 -10.868
    2    HA   GLU  76           HA       GLU  76   1.997  -4.897  -9.710
    3    HB2  GLU  76           HB2      GLU  76   2.173  -6.390 -11.706
    4    HB3  GLU  76           HB3      GLU  76   1.322  -5.185 -12.660
    5    HG2  GLU  76           HG2      GLU  76   3.136  -3.569 -12.284
    6    HG3  GLU  76           HG3      GLU  76   4.000  -4.722 -11.286

  No H/Q in entry =           6
  In of MODEL   19
    1    H    ALA  77           H        ALA  77  -0.539  -3.728 -11.911
    2    HA   ALA  77           HA       ALA  77   0.427  -1.073 -12.094
    3    HB3  ALA  77           HB1      ALA  77  -2.293  -2.317 -12.497
    4    HB1  ALA  77           HB2      ALA  77  -1.166  -1.722 -13.717
    5    HB2  ALA  77           HB3      ALA  77  -2.030  -0.582 -12.686

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLN  78           H        GLN  78  -1.834  -2.641  -9.884
    2    HA   GLN  78           HA       GLN  78  -2.667  -0.325  -8.495
    3    HB2  GLN  78           HB2      GLN  78  -3.756  -2.595  -8.405
    4    HB3  GLN  78           HB3      GLN  78  -2.418  -3.137  -7.396
    5    HG2  GLN  78           HG2      GLN  78  -2.956  -1.390  -5.745
    6    HG3  GLN  78           HG3      GLN  78  -4.304  -0.855  -6.748
    7   HE21  GLN  78          HE21      GLN  78  -4.800  -1.787  -4.108
    8   HE22  GLN  78          HE22      GLN  78  -5.616  -3.273  -4.198

  No H/Q in entry =           8
  In of MODEL   19
    1    H    LEU  79           H        LEU  79   0.031  -2.552  -8.027
    2    HA   LEU  79           HA       LEU  79   0.990  -1.636  -5.570
    3    HB2  LEU  79           HB2      LEU  79   1.884  -3.641  -6.627
    4    HB3  LEU  79           HB3      LEU  79   2.525  -2.688  -7.962
    5    HG   LEU  79           HG       LEU  79   4.064  -1.527  -6.458
    6   HD13  LEU  79          HD11      LEU  79   3.050  -1.284  -4.395
    7   HD12  LEU  79          HD12      LEU  79   4.141  -2.621  -4.042
    8   HD11  LEU  79          HD13      LEU  79   2.440  -2.939  -4.376
    9   HD23  LEU  79          HD21      LEU  79   5.293  -3.659  -5.542
   10   HD22  LEU  79          HD22      LEU  79   5.094  -3.469  -7.281
   11   HD21  LEU  79          HD23      LEU  79   4.024  -4.546  -6.389

  No H/Q in entry =          11
  In of MODEL   19
    1    H    HIS  80           H        HIS  80   1.860  -0.524  -8.845
    2    HA   HIS  80           HA       HIS  80   3.644   1.486  -7.924
    3    HB2  HIS  80           HB2      HIS  80   2.371   0.768 -10.509
    4    HB3  HIS  80           HB3      HIS  80   2.947   2.427 -10.343
    5    HD1  HIS  80           HD1      HIS  80   5.348   2.751 -10.858
    6    HD2  HIS  80           HD2      HIS  80   4.565  -1.164  -9.654
    7    HE1  HIS  80           HE1      HIS  80   7.551   1.496 -11.011
    8    HE2  HIS  80           HE2      HIS  80   7.086  -0.893 -10.281

  No H/Q in entry =           8
  In of MODEL   19
    1    H    LEU  81           H        LEU  81   0.242   1.606  -8.916
    2    HA   LEU  81           HA       LEU  81  -0.065   4.397  -8.598
    3    HB2  LEU  81           HB2      LEU  81  -2.055   2.129  -8.517
    4    HB3  LEU  81           HB3      LEU  81  -2.526   3.828  -8.433
    5    HG   LEU  81           HG       LEU  81  -0.813   2.688 -10.658
    6   HD12  LEU  81          HD11      LEU  81  -3.044   2.978 -11.967
    7   HD11  LEU  81          HD12      LEU  81  -3.804   2.907 -10.377
    8   HD13  LEU  81          HD13      LEU  81  -2.844   1.548 -10.956
    9   HD23  LEU  81          HD21      LEU  81  -1.930   4.815 -11.768
   10   HD22  LEU  81          HD22      LEU  81  -0.519   5.006 -10.731
   11   HD21  LEU  81          HD23      LEU  81  -2.129   5.339 -10.097

  No H/Q in entry =          11
  In of MODEL   19
    1    H    MET  82           H        MET  82  -0.702   1.711  -6.341
    2    HA   MET  82           HA       MET  82  -1.779   3.293  -4.263
    3    HB2  MET  82           HB2      MET  82  -0.375   0.622  -4.287
    4    HB3  MET  82           HB3      MET  82  -0.967   1.347  -2.794
    5    HG2  MET  82           HG2      MET  82  -2.685   0.824  -5.240
    6    HG3  MET  82           HG3      MET  82  -2.600  -0.244  -3.840
    7    HE3  MET  82           HE1      MET  82  -4.351   1.397  -1.037
    8    HE2  MET  82           HE2      MET  82  -2.624   1.694  -1.217
    9    HE1  MET  82           HE3      MET  82  -3.292   0.127  -1.668

  No H/Q in entry =           9
  In of MODEL   19
    1    H    THR  83           H        THR  83   1.536   2.243  -4.937
    2    HA   THR  83           HA       THR  83   2.733   3.370  -2.637
    3    HB   THR  83           HB       THR  83   4.834   3.333  -4.103
    4    HG1  THR  83           HG1      THR  83   4.607   2.797  -6.126
    5   HG22  THR  83          HG21      THR  83   4.422   0.669  -4.426
    6   HG21  THR  83          HG22      THR  83   3.124   1.038  -3.292
    7   HG23  THR  83          HG23      THR  83   4.797   1.403  -2.868

  No H/Q in entry =           7
  In of MODEL   19
    1    H    SER  84           H        SER  84   2.359   4.633  -5.943
    2    HA   SER  84           HA       SER  84   3.669   7.090  -5.493
    3    HB2  SER  84           HB2      SER  84   1.615   6.226  -7.516
    4    HB3  SER  84           HB3      SER  84   2.275   7.861  -7.495
    5    HG   SER  84           HG       SER  84   3.677   5.401  -7.771

  No H/Q in entry =           5
  In of MODEL   19
    1    H    MET  85           H        MET  85   0.183   6.294  -5.330
    2    HA   MET  85           HA       MET  85  -0.711   8.896  -4.742
    3    HB2  MET  85           HB2      MET  85  -2.211   7.068  -5.410
    4    HB3  MET  85           HB3      MET  85  -1.917   6.271  -3.865
    5    HG2  MET  85           HG2      MET  85  -2.837   8.216  -2.670
    6    HG3  MET  85           HG3      MET  85  -3.099   9.042  -4.204
    7    HE1  MET  85           HE1      MET  85  -3.597   6.102  -2.084
    8    HE3  MET  85           HE2      MET  85  -3.972   5.006  -3.412
    9    HE2  MET  85           HE3      MET  85  -5.254   5.538  -2.330

  No H/Q in entry =           9
  In of MODEL   19
    1    H    LEU  86           H        LEU  86   0.232   6.253  -2.585
    2    HA   LEU  86           HA       LEU  86  -0.325   7.559  -0.150
    3    HB2  LEU  86           HB2      LEU  86   0.168   5.091  -0.533
    4    HB3  LEU  86           HB3      LEU  86   1.871   5.539  -0.624
    5    HG   LEU  86           HG       LEU  86   1.525   6.705   1.639
    6   HD11  LEU  86          HD11      LEU  86  -1.159   5.908   1.161
    7   HD13  LEU  86          HD12      LEU  86  -0.506   6.668   2.611
    8   HD12  LEU  86          HD13      LEU  86  -0.578   4.910   2.498
    9   HD23  LEU  86          HD21      LEU  86   1.128   3.709   1.771
   10   HD22  LEU  86          HD22      LEU  86   2.116   4.733   2.811
   11   HD21  LEU  86          HD23      LEU  86   2.626   4.407   1.155

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ALA  87           H        ALA  87   2.666   7.289  -2.028
    2    HA   ALA  87           HA       ALA  87   4.351   8.723  -0.302
    3    HB3  ALA  87           HB1      ALA  87   4.466   7.702  -3.005
    4    HB2  ALA  87           HB2      ALA  87   5.793   8.050  -1.901
    5    HB1  ALA  87           HB3      ALA  87   5.169   9.320  -2.952

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ARG  88           H        ARG  88   2.401   9.829  -3.033
    2    HA   ARG  88           HA       ARG  88   3.148  12.527  -2.923
    3    HB2  ARG  88           HB2      ARG  88   1.912  11.356  -4.781
    4    HB3  ARG  88           HB3      ARG  88   0.450  11.488  -3.803
    5    HG2  ARG  88           HG2      ARG  88   1.444  14.078  -3.725
    6    HG3  ARG  88           HG3      ARG  88   1.879  13.563  -5.353
    7    HD2  ARG  88           HD2      ARG  88  -0.261  13.620  -6.058
    8    HD3  ARG  88           HD3      ARG  88  -0.844  12.766  -4.629
    9    HE   ARG  88           HE       ARG  88  -1.059  15.540  -5.057
   10   HH21  ARG  88          HH11      ARG  88  -1.605  16.871  -3.325
   11   HH22  ARG  88          HH12      ARG  88  -1.309  16.342  -1.705
   12   HH11  ARG  88          HH21      ARG  88  -0.030  13.296  -2.671
   13   HH12  ARG  88          HH22      ARG  88  -0.435  14.312  -1.335

  No H/Q in entry =          13
  In of MODEL   19
    1    H    GLU  89           H        GLU  89   0.456  10.833  -1.286
    2    HA   GLU  89           HA       GLU  89  -0.677  13.138  -0.093
    3    HB2  GLU  89           HB2      GLU  89  -1.774  10.888  -0.176
    4    HB3  GLU  89           HB3      GLU  89  -0.649  10.348   1.071
    5    HG2  GLU  89           HG2      GLU  89  -1.490  12.044   2.622
    6    HG3  GLU  89           HG3      GLU  89  -2.544  12.701   1.372

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LEU  90           H        LEU  90   1.791  10.872   1.097
    2    HA   LEU  90           HA       LEU  90   2.127  12.128   3.623
    3    HB2  LEU  90           HB2      LEU  90   3.922  10.364   1.958
    4    HB3  LEU  90           HB3      LEU  90   4.331  10.890   3.596
    5    HG   LEU  90           HG       LEU  90   1.710   9.519   2.931
    6   HD12  LEU  90          HD11      LEU  90   2.865   7.487   3.950
    7   HD11  LEU  90          HD12      LEU  90   4.380   8.355   3.710
    8   HD13  LEU  90          HD13      LEU  90   3.376   7.934   2.321
    9   HD22  LEU  90          HD21      LEU  90   1.431  10.447   5.049
   10   HD21  LEU  90          HD22      LEU  90   3.148  10.356   5.437
   11   HD23  LEU  90          HD23      LEU  90   2.154   8.901   5.487

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  91           H        ILE  91   3.737  12.514   0.500
    2    HA   ILE  91           HA       ILE  91   5.696  14.365   1.340
    3    HB   ILE  91           HB       ILE  91   4.397  13.855  -1.343
    4   HG12  ILE  91          HG12      ILE  91   7.230  13.394  -0.358
    5   HG13  ILE  91          HG13      ILE  91   5.958  12.187  -0.196
    6   HG22  ILE  91          HG21      ILE  91   6.611  15.218  -2.029
    7   HG21  ILE  91          HG22      ILE  91   6.290  16.021  -0.491
    8   HG23  ILE  91          HG23      ILE  91   5.070  16.035  -1.764
    9   HD13  ILE  91          HD11      ILE  91   5.795  11.854  -2.502
   10   HD12  ILE  91          HD12      ILE  91   7.526  12.112  -2.284
   11   HD11  ILE  91          HD13      ILE  91   6.507  13.425  -2.878

  No H/Q in entry =          11
  In of MODEL   19
    1    H    THR  92           H        THR  92   2.334  14.767   0.320
    2    HA   THR  92           HA       THR  92   2.285  17.590   0.250
    3    HB   THR  92           HB       THR  92   0.132  15.580   0.949
    4    HG1  THR  92           HG1      THR  92   0.444  15.397  -1.134
    5   HG22  THR  92          HG21      THR  92  -1.284  17.728   0.216
    6   HG21  THR  92          HG22      THR  92   0.099  18.567   0.915
    7   HG23  THR  92          HG23      THR  92  -0.836  17.441   1.897

  No H/Q in entry =           7
  In of MODEL   19
    1    H    GLU  93           H        GLU  93   1.747  15.293   2.910
    2    HA   GLU  93           HA       GLU  93   1.193  17.199   4.920
    3    HB2  GLU  93           HB2      GLU  93   2.527  14.486   5.169
    4    HB3  GLU  93           HB3      GLU  93   1.825  15.412   6.497
    5    HG2  GLU  93           HG2      GLU  93   0.227  14.613   4.056
    6    HG3  GLU  93           HG3      GLU  93   0.332  13.596   5.488

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LEU  94           H        LEU  94   4.215  15.738   3.785
    2    HA   LEU  94           HA       LEU  94   5.951  16.905   5.675
    3    HB2  LEU  94           HB2      LEU  94   6.369  15.932   2.848
    4    HB3  LEU  94           HB3      LEU  94   7.690  16.603   3.800
    5    HG   LEU  94           HG       LEU  94   5.964  14.397   4.936
    6   HD11  LEU  94          HD11      LEU  94   8.068  14.181   2.812
    7   HD13  LEU  94          HD12      LEU  94   6.629  13.196   3.072
    8   HD12  LEU  94          HD13      LEU  94   8.053  12.958   4.085
    9   HD23  LEU  94          HD21      LEU  94   8.154  13.881   6.097
   10   HD22  LEU  94          HD22      LEU  94   7.474  15.456   6.507
   11   HD21  LEU  94          HD23      LEU  94   8.817  15.342   5.369

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  95           H        ILE  95   4.812  18.057   2.517
    2    HA   ILE  95           HA       ILE  95   6.366  20.427   2.455
    3    HB   ILE  95           HB       ILE  95   3.732  19.718   1.144
    4   HG12  ILE  95          HG12      ILE  95   6.521  20.074   0.014
    5   HG13  ILE  95          HG13      ILE  95   5.882  18.517   0.532
    6   HG21  ILE  95          HG21      ILE  95   5.462  22.198   0.921
    7   HG23  ILE  95          HG22      ILE  95   3.737  22.118   1.272
    8   HG22  ILE  95          HG23      ILE  95   4.328  21.717  -0.341
    9   HD13  ILE  95          HD11      ILE  95   4.329  18.423  -1.202
   10   HD12  ILE  95          HD12      ILE  95   5.674  19.250  -1.988
   11   HD11  ILE  95          HD13      ILE  95   4.292  20.175  -1.403

  No H/Q in entry =          11
  In of MODEL   19
    1    H    GLU  96           H        GLU  96   3.118  19.754   3.742
    2    HA   GLU  96           HA       GLU  96   2.475  22.398   4.483
    3    HB2  GLU  96           HB2      GLU  96   0.815  20.602   4.495
    4    HB3  GLU  96           HB3      GLU  96   1.678  19.786   5.796
    5    HG2  GLU  96           HG2      GLU  96   0.643  21.066   7.358
    6    HG3  GLU  96           HG3      GLU  96   1.170  22.542   6.558

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LEU  97           H        LEU  97   4.332  19.867   6.122
    2    HA   LEU  97           HA       LEU  97   4.672  21.226   8.590
    3    HB2  LEU  97           HB2      LEU  97   6.230  19.064   7.187
    4    HB3  LEU  97           HB3      LEU  97   6.810  19.758   8.699
    5    HG   LEU  97           HG       LEU  97   4.009  18.643   8.383
    6   HD12  LEU  97          HD11      LEU  97   4.960  16.641   9.605
    7   HD11  LEU  97          HD12      LEU  97   6.568  17.283   9.264
    8   HD13  LEU  97          HD13      LEU  97   5.506  16.813   7.937
    9   HD23  LEU  97          HD21      LEU  97   4.456  18.360  10.950
   10   HD22  LEU  97          HD22      LEU  97   4.066  19.967  10.339
   11   HD21  LEU  97          HD23      LEU  97   5.740  19.541  10.690

  No H/Q in entry =          11
  In of MODEL   19
    1    H    HIS  98           H        HIS  98   6.552  21.246   5.570
    2    HA   HIS  98           HA       HIS  98   8.691  22.844   6.471
    3    HB2  HIS  98           HB2      HIS  98   7.409  22.571   3.742
    4    HB3  HIS  98           HB3      HIS  98   8.840  23.561   4.034
    5    HD1  HIS  98           HD1      HIS  98   7.655  19.982   4.061
    6    HD2  HIS  98           HD2      HIS  98  11.219  22.105   4.491
    7    HE1  HIS  98           HE1      HIS  98   9.522  18.265   4.016
    8    HE2  HIS  98           HE2      HIS  98  11.697  19.538   4.278

  No H/Q in entry =           8
  In of MODEL   19
    1    H    GLU  99           H        GLU  99   5.468  23.652   5.283
    2    HA   GLU  99           HA       GLU  99   5.827  26.470   5.217
    3    HB2  GLU  99           HB2      GLU  99   3.960  25.284   4.084
    4    HB3  GLU  99           HB3      GLU  99   3.262  24.922   5.662
    5    HG2  GLU  99           HG2      GLU  99   3.063  27.314   6.155
    6    HG3  GLU  99           HG3      GLU  99   3.841  27.715   4.627

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LYS 100           H        LYS 100   4.704  24.234   7.742
    2    HA   LYS 100           HA       LYS 100   4.098  26.290   9.628
    3    HB2  LYS 100           HB2      LYS 100   4.692  23.344   9.985
    4    HB3  LYS 100           HB3      LYS 100   4.233  24.418  11.312
    5    HG2  LYS 100           HG2      LYS 100   2.167  25.037  10.056
    6    HG3  LYS 100           HG3      LYS 100   2.606  23.868   8.808
    7    HD2  LYS 100           HD2      LYS 100   2.535  22.052  10.475
    8    HD3  LYS 100           HD3      LYS 100   2.113  23.215  11.734
    9    HE2  LYS 100           HE2      LYS 100   0.060  23.819  10.462
   10    HE3  LYS 100           HE3      LYS 100   0.472  22.598   9.251
   11    HZ1  LYS 100           HZ1      LYS 100   0.202  21.939  12.133
   12    HZ3  LYS 100           HZ2      LYS 100   0.198  20.880  10.802
   13    HZ2  LYS 100           HZ3      LYS 100  -1.126  21.911  11.074

  No H/Q in entry =          13
  In of MODEL   19
    1    H    LEU 101           H        LEU 101   7.036  24.512   8.809
    2    HA   LEU 101           HA       LEU 101   8.621  25.370  11.015
    3    HB2  LEU 101           HB2      LEU 101   9.232  24.378   8.242
    4    HB3  LEU 101           HB3      LEU 101  10.526  25.055   9.225
    5    HG   LEU 101           HG       LEU 101   8.705  22.890  10.290
    6   HD12  LEU 101          HD11      LEU 101  10.771  21.407   9.693
    7   HD11  LEU 101          HD12      LEU 101  11.133  22.669   8.518
    8   HD13  LEU 101          HD13      LEU 101   9.610  21.785   8.422
    9   HD21  LEU 101          HD21      LEU 101  11.419  24.018  11.023
   10   HD23  LEU 101          HD22      LEU 101  10.884  22.444  11.606
   11   HD22  LEU 101          HD23      LEU 101   9.981  23.896  12.037

  No H/Q in entry =          11
  In of MODEL   19
    1    H    LYS 102           H        LYS 102   7.033  27.216   8.863
    2    HA   LYS 102           HA       LYS 102   7.097  29.508   8.565
    3    HB2  LYS 102           HB2      LYS 102   8.655  29.410  10.668
    4    HB3  LYS 102           HB3      LYS 102   9.957  29.609   9.512
    5    HG2  LYS 102           HG2      LYS 102   7.836  31.551  10.361
    6    HG3  LYS 102           HG3      LYS 102   9.548  31.821  10.114
    7    HD2  LYS 102           HD2      LYS 102   7.607  31.379   7.810
    8    HD3  LYS 102           HD3      LYS 102   7.978  32.963   8.474
    9    HE2  LYS 102           HE2      LYS 102   9.365  31.780   6.409
   10    HE3  LYS 102           HE3      LYS 102   9.970  33.094   7.418
   11    HZ2  LYS 102           HZ1      LYS 102  11.503  31.199   7.254
   12    HZ1  LYS 102           HZ2      LYS 102  10.345  30.211   7.996
   13    HZ3  LYS 102           HZ3      LYS 102  11.026  31.505   8.853

  No H/Q in entry =          13
  In of MODEL   19
    1    H    ALA 103           H        ALA 103  10.364  28.188   8.015
    2    HA   ALA 103           HA       ALA 103  11.326  29.565   5.938
    3    HB2  ALA 103           HB1      ALA 103  12.228  27.353   5.020
    4    HB1  ALA 103           HB2      ALA 103  11.333  26.577   6.325
    5    HB3  ALA 103           HB3      ALA 103  12.614  27.731   6.699

  No H/Q in entry =           5
  In of MODEL   19
    1    H1   LYS   3           H1       LYS   3 -31.273   6.548 -19.426
    2    H2   LYS   3           H3       LYS   3 -30.298   6.282 -20.790
    3    H3   LYS   3           H2       LYS   3 -31.696   5.350 -20.550
    4    HA   LYS   3           HA       LYS   3 -30.691   3.925 -19.186
    5    HB2  LYS   3           HB2      LYS   3 -28.412   5.350 -20.508
    6    HB3  LYS   3           HB3      LYS   3 -28.085   4.113 -19.292
    7    HG2  LYS   3           HG2      LYS   3 -29.529   2.566 -20.665
    8    HG3  LYS   3           HG3      LYS   3 -29.486   3.794 -21.930
    9    HD2  LYS   3           HD2      LYS   3 -27.004   3.662 -21.903
   10    HD3  LYS   3           HD3      LYS   3 -27.122   2.339 -20.743
   11    HE2  LYS   3           HE2      LYS   3 -28.643   1.211 -22.471
   12    HE3  LYS   3           HE3      LYS   3 -28.024   2.410 -23.607
   13    HZ3  LYS   3           HZ1      LYS   3 -26.237   1.175 -23.918
   14    HZ2  LYS   3           HZ2      LYS   3 -26.867  -0.012 -22.879
   15    HZ1  LYS   3           HZ3      LYS   3 -25.863   1.213 -22.263

  No H/Q in entry =          15
  In of MODEL   19
    1    H    LYS   4           H        LYS   4 -30.727   3.739 -17.127
    2    HA   LYS   4           HA       LYS   4 -29.966   5.984 -15.435
    3    HB2  LYS   4           HB2      LYS   4 -31.182   3.285 -14.782
    4    HB3  LYS   4           HB3      LYS   4 -30.941   4.598 -13.630
    5    HG2  LYS   4           HG2      LYS   4 -32.770   4.601 -16.036
    6    HG3  LYS   4           HG3      LYS   4 -33.245   4.619 -14.339
    7    HD2  LYS   4           HD2      LYS   4 -32.531   6.830 -14.032
    8    HD3  LYS   4           HD3      LYS   4 -31.503   6.795 -15.464
    9    HE2  LYS   4           HE2      LYS   4 -33.422   8.192 -15.881
   10    HE3  LYS   4           HE3      LYS   4 -33.521   6.742 -16.879
   11    HZ3  LYS   4           HZ1      LYS   4 -35.092   5.809 -15.338
   12    HZ2  LYS   4           HZ2      LYS   4 -35.640   7.321 -15.886
   13    HZ1  LYS   4           HZ3      LYS   4 -34.971   7.171 -14.331

  No H/Q in entry =          13
  In of MODEL   19
    1    H    HIS   5           H        HIS   5 -28.484   6.023 -13.854
    2    HA   HIS   5           HA       HIS   5 -26.220   4.183 -14.245
    3    HB2  HIS   5           HB2      HIS   5 -26.440   6.913 -12.978
    4    HB3  HIS   5           HB3      HIS   5 -24.967   5.945 -12.995
    5    HD1  HIS   5           HD1      HIS   5 -23.499   7.166 -14.571
    6    HD2  HIS   5           HD2      HIS   5 -27.320   6.613 -16.104
    7    HE1  HIS   5           HE1      HIS   5 -23.348   7.797 -17.010
    8    HE2  HIS   5           HE2      HIS   5 -25.676   7.447 -17.914

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ILE   6           H        ILE   6 -25.994   2.580 -12.964
    2    HA   ILE   6           HA       ILE   6 -26.942   2.797 -10.187
    3    HB   ILE   6           HB       ILE   6 -26.155   0.357 -11.784
    4   HG12  ILE   6          HG12      ILE   6 -28.882   1.301 -10.889
    5   HG13  ILE   6          HG13      ILE   6 -28.251   1.492 -12.525
    6   HG23  ILE   6          HG21      ILE   6 -26.524  -0.932  -9.947
    7   HG22  ILE   6          HG22      ILE   6 -27.665   0.210  -9.233
    8   HG21  ILE   6          HG23      ILE   6 -25.931   0.528  -9.152
    9   HD13  ILE   6          HD11      ILE   6 -28.736  -0.612 -13.066
   10   HD12  ILE   6          HD12      ILE   6 -29.739  -0.617 -11.615
   11   HD11  ILE   6          HD13      ILE   6 -28.090  -1.241 -11.550

  No H/Q in entry =          11
  In of MODEL   19
    1    H    TYR   7           H        TYR   7 -25.167   3.394  -8.903
    2    HA   TYR   7           HA       TYR   7 -22.471   2.425  -9.626
    3    HB2  TYR   7           HB2      TYR   7 -23.398   4.836  -8.085
    4    HB3  TYR   7           HB3      TYR   7 -21.719   4.306  -8.149
    5    HD1  TYR   7           HD1      TYR   7 -22.794   3.440 -11.250
    6    HD2  TYR   7           HD2      TYR   7 -22.070   6.958  -8.954
    7    HE1  TYR   7           HE1      TYR   7 -22.369   4.710 -13.318
    8    HE2  TYR   7           HE2      TYR   7 -21.686   8.233 -11.013
    9    HH   TYR   7           HH       TYR   7 -21.924   8.196 -13.245

  No H/Q in entry =           9
  In of MODEL   19
    1    H    LEU   8           H        LEU   8 -21.508   1.035  -8.334
    2    HA   LEU   8           HA       LEU   8 -22.620   0.495  -5.652
    3    HB2  LEU   8           HB2      LEU   8 -20.950  -1.145  -7.537
    4    HB3  LEU   8           HB3      LEU   8 -21.124  -1.562  -5.832
    5    HG   LEU   8           HG       LEU   8 -23.610  -1.700  -6.236
    6   HD13  LEU   8          HD11      LEU   8 -23.747  -0.439  -8.318
    7   HD12  LEU   8          HD12      LEU   8 -24.295  -2.092  -8.589
    8   HD11  LEU   8          HD13      LEU   8 -22.687  -1.599  -9.117
    9   HD23  LEU   8          HD21      LEU   8 -22.371  -3.718  -7.984
   10   HD22  LEU   8          HD22      LEU   8 -23.448  -3.904  -6.600
   11   HD21  LEU   8          HD23      LEU   8 -21.735  -3.574  -6.346

  No H/Q in entry =          11
  In of MODEL   19
    1    H    PHE   9           H        PHE   9 -21.340   0.856  -3.871
    2    HA   PHE   9           HA       PHE   9 -18.546   1.765  -4.382
    3    HB2  PHE   9           HB2      PHE   9 -20.534   2.830  -2.381
    4    HB3  PHE   9           HB3      PHE   9 -18.825   3.240  -2.390
    5    HD1  PHE   9           HD1      PHE   9 -17.863   4.617  -4.142
    6    HD2  PHE   9           HD2      PHE   9 -22.037   3.622  -4.164
    7    HE1  PHE   9           HE1      PHE   9 -18.264   6.333  -5.882
    8    HE2  PHE   9           HE2      PHE   9 -22.439   5.350  -5.899
    9    HZ   PHE   9           HZ       PHE   9 -20.550   6.702  -6.764

  No H/Q in entry =           9
  In of MODEL   19
    1    H    SER  10           H        SER  10 -16.970   0.781  -3.297
    2    HA   SER  10           HA       SER  10 -17.170  -0.157  -0.617
    3    HB2  SER  10           HB2      SER  10 -18.408  -1.997  -1.696
    4    HB3  SER  10           HB3      SER  10 -17.058  -2.249  -2.792
    5    HG   SER  10           HG       SER  10 -17.279  -3.523  -0.702

  No H/Q in entry =           5
  In of MODEL   19
    1    H    SER  11           H        SER  11 -15.154  -0.068   0.207
    2    HA   SER  11           HA       SER  11 -12.974   0.814  -1.308
    3    HB2  SER  11           HB2      SER  11 -11.815   0.861   0.670
    4    HB3  SER  11           HB3      SER  11 -13.471   0.804   1.279
    5    HG   SER  11           HG       SER  11 -12.596  -1.679   0.764

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA  12           H        ALA  12 -14.213  -1.898  -2.128
    2    HA   ALA  12           HA       ALA  12 -11.632  -3.101  -2.758
    3    HB3  ALA  12           HB1      ALA  12 -12.227  -4.303  -0.733
    4    HB2  ALA  12           HB2      ALA  12 -12.388  -5.379  -2.121
    5    HB1  ALA  12           HB3      ALA  12 -13.826  -4.669  -1.386

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLY  13           H        GLY  13 -12.390  -2.084  -4.754
    2    HA3  GLY  13           HA2      GLY  13 -14.667  -2.692  -6.204
    3    HA2  GLY  13           HA3      GLY  13 -13.113  -2.273  -6.941

  No H/Q in entry =           3
  In of MODEL   19
    1    H    MET  14           H        MET  14 -11.643  -4.605  -6.106
    2    HA   MET  14           HA       MET  14 -12.139  -6.293  -8.245
    3    HB2  MET  14           HB2      MET  14 -10.036  -6.439  -7.006
    4    HB3  MET  14           HB3      MET  14 -10.867  -7.139  -5.617
    5    HG2  MET  14           HG2      MET  14 -11.518  -9.086  -6.997
    6    HG3  MET  14           HG3      MET  14 -10.703  -8.374  -8.390
    7    HE3  MET  14           HE1      MET  14  -7.101  -8.598  -7.885
    8    HE2  MET  14           HE2      MET  14  -7.877  -7.169  -7.205
    9    HE1  MET  14           HE3      MET  14  -8.510  -7.886  -8.685

  No H/Q in entry =           9
  In of MODEL   19
    1    H    SER  15           H        SER  15 -13.258  -6.900  -4.894
    2    HA   SER  15           HA       SER  15 -14.659  -9.289  -5.663
    3    HB2  SER  15           HB2      SER  15 -14.122  -9.117  -3.328
    4    HB3  SER  15           HB3      SER  15 -14.931  -7.558  -3.199
    5    HG   SER  15           HG       SER  15 -16.827  -8.520  -3.151

  No H/Q in entry =           5
  In of MODEL   19
    1    H    THR  16           H        THR  16 -15.689  -5.906  -5.191
    2    HA   THR  16           HA       THR  16 -18.491  -6.354  -5.713
    3    HB   THR  16           HB       THR  16 -16.893  -3.811  -6.179
    4    HG1  THR  16           HG1      THR  16 -16.945  -3.450  -4.086
    5   HG22  THR  16          HG21      THR  16 -19.784  -4.306  -5.422
    6   HG21  THR  16          HG22      THR  16 -19.219  -3.833  -7.033
    7   HG23  THR  16          HG23      THR  16 -19.034  -2.732  -5.660

  No H/Q in entry =           7
  In of MODEL   19
    1    H    SER  17           H        SER  17 -15.654  -5.792  -7.574
    2    HA   SER  17           HA       SER  17 -16.794  -4.989 -10.051
    3    HB2  SER  17           HB2      SER  17 -14.180  -6.391  -9.444
    4    HB3  SER  17           HB3      SER  17 -14.631  -5.809 -11.046
    5    HG   SER  17           HG       SER  17 -14.849  -4.000  -8.959

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU  18           H        LEU  18 -16.245  -8.168  -8.673
    2    HA   LEU  18           HA       LEU  18 -16.862  -9.612 -11.055
    3    HB2  LEU  18           HB2      LEU  18 -15.641 -10.676  -9.246
    4    HB3  LEU  18           HB3      LEU  18 -16.985 -10.398  -8.139
    5    HG   LEU  18           HG       LEU  18 -18.395 -11.912  -9.424
    6   HD11  LEU  18          HD11      LEU  18 -15.988 -11.984 -11.237
    7   HD13  LEU  18          HD12      LEU  18 -17.669 -11.654 -11.654
    8   HD12  LEU  18          HD13      LEU  18 -17.174 -13.288 -11.223
    9   HD21  LEU  18          HD21      LEU  18 -15.710 -12.979  -8.625
   10   HD23  LEU  18          HD22      LEU  18 -17.085 -14.002  -9.046
   11   HD22  LEU  18          HD23      LEU  18 -17.189 -12.909  -7.667

  No H/Q in entry =          11
  In of MODEL   19
    1    H    LEU  19           H        LEU  19 -18.799  -8.444  -8.305
    2    HA   LEU  19           HA       LEU  19 -21.279  -9.588  -9.142
    3    HB2  LEU  19           HB2      LEU  19 -20.987  -8.805  -6.876
    4    HB3  LEU  19           HB3      LEU  19 -20.691  -7.164  -7.449
    5    HG   LEU  19           HG       LEU  19 -23.023  -6.964  -8.132
    6   HD13  LEU  19          HD11      LEU  19 -23.493  -9.293  -8.686
    7   HD12  LEU  19          HD12      LEU  19 -24.638  -8.716  -7.475
    8   HD11  LEU  19          HD13      LEU  19 -23.294  -9.752  -6.995
    9   HD22  LEU  19          HD21      LEU  19 -22.430  -6.239  -5.930
   10   HD21  LEU  19          HD22      LEU  19 -22.569  -7.881  -5.301
   11   HD23  LEU  19          HD23      LEU  19 -24.007  -7.025  -5.856

  No H/Q in entry =          11
  In of MODEL   19
    1    H    VAL  20           H        VAL  20 -19.760  -6.427  -9.782
    2    HA   VAL  20           HA       VAL  20 -21.874  -5.334 -11.313
    3    HB   VAL  20           HB       VAL  20 -18.881  -4.766 -11.451
    4   HG11  VAL  20          HG11      VAL  20 -21.191  -3.537 -12.939
    5   HG13  VAL  20          HG12      VAL  20 -19.613  -4.029 -13.556
    6   HG12  VAL  20          HG13      VAL  20 -19.757  -2.584 -12.556
    7   HG21  VAL  20          HG21      VAL  20 -21.196  -3.476 -10.056
    8   HG23  VAL  20          HG22      VAL  20 -19.702  -2.601 -10.382
    9   HG22  VAL  20          HG23      VAL  20 -19.672  -4.049  -9.376

  No H/Q in entry =           9
  In of MODEL   19
    1    H    SER  21           H        SER  21 -19.142  -7.387 -12.404
    2    HA   SER  21           HA       SER  21 -19.947  -7.210 -15.146
    3    HB2  SER  21           HB2      SER  21 -18.532  -9.183 -15.531
    4    HB3  SER  21           HB3      SER  21 -17.683  -7.963 -14.583
    5    HG   SER  21           HG       SER  21 -17.893  -9.171 -12.803

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LYS  22           H        LYS  22 -21.013  -9.440 -12.612
    2    HA   LYS  22           HA       LYS  22 -22.580 -11.007 -14.456
    3    HB2  LYS  22           HB2      LYS  22 -22.864 -10.714 -11.462
    4    HB3  LYS  22           HB3      LYS  22 -23.662 -11.927 -12.460
    5    HG2  LYS  22           HG2      LYS  22 -20.678 -11.696 -12.108
    6    HG3  LYS  22           HG3      LYS  22 -21.715 -12.799 -11.205
    7    HD2  LYS  22           HD2      LYS  22 -22.382 -13.879 -13.316
    8    HD3  LYS  22           HD3      LYS  22 -21.303 -12.794 -14.197
    9    HE2  LYS  22           HE2      LYS  22 -19.375 -13.724 -13.006
   10    HE3  LYS  22           HE3      LYS  22 -20.440 -14.784 -12.085
   11    HZ3  LYS  22           HZ1      LYS  22 -20.843 -16.106 -13.902
   12    HZ2  LYS  22           HZ2      LYS  22 -19.206 -15.705 -14.117
   13    HZ1  LYS  22           HZ3      LYS  22 -20.401 -14.910 -15.025

  No H/Q in entry =          13
  In of MODEL   19
    1    H    MET  23           H        MET  23 -23.261  -8.118 -12.521
    2    HA   MET  23           HA       MET  23 -26.072  -8.158 -13.007
    3    HB2  MET  23           HB2      MET  23 -24.198  -5.880 -12.400
    4    HB3  MET  23           HB3      MET  23 -25.943  -5.690 -12.561
    5    HG2  MET  23           HG2      MET  23 -26.333  -7.031 -10.617
    6    HG3  MET  23           HG3      MET  23 -24.626  -7.463 -10.513
    7    HE2  MET  23           HE1      MET  23 -26.877  -3.813  -9.229
    8    HE1  MET  23           HE2      MET  23 -27.152  -4.749 -10.698
    9    HE3  MET  23           HE3      MET  23 -26.103  -3.331 -10.739

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ARG  24           H        ARG  24 -23.317  -6.720 -14.781
    2    HA   ARG  24           HA       ARG  24 -24.815  -5.361 -16.741
    3    HB2  ARG  24           HB2      ARG  24 -22.360  -5.008 -16.361
    4    HB3  ARG  24           HB3      ARG  24 -22.054  -6.586 -17.043
    5    HG2  ARG  24           HG2      ARG  24 -22.992  -5.817 -19.245
    6    HG3  ARG  24           HG3      ARG  24 -23.212  -4.198 -18.529
    7    HD2  ARG  24           HD2      ARG  24 -20.572  -5.728 -18.703
    8    HD3  ARG  24           HD3      ARG  24 -21.057  -4.396 -19.745
    9    HE   ARG  24           HE       ARG  24 -20.134  -4.073 -17.069
   10   HH21  ARG  24          HH11      ARG  24 -20.775  -2.165 -16.067
   11   HH22  ARG  24          HH12      ARG  24 -21.207  -0.795 -17.030
   12   HH11  ARG  24          HH21      ARG  24 -21.178  -2.729 -19.994
   13   HH12  ARG  24          HH22      ARG  24 -21.432  -1.136 -19.353

  No H/Q in entry =          13
  In of MODEL   19
    1    H    ALA  25           H        ALA  25 -23.729  -8.718 -16.545
    2    HA   ALA  25           HA       ALA  25 -24.386  -9.484 -19.195
    3    HB1  ALA  25           HB1      ALA  25 -23.708 -11.539 -18.549
    4    HB3  ALA  25           HB2      ALA  25 -24.756 -11.536 -17.129
    5    HB2  ALA  25           HB3      ALA  25 -23.191 -10.729 -17.071

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLN  26           H        GLN  26 -26.191  -9.568 -16.160
    2    HA   GLN  26           HA       GLN  26 -28.557 -10.720 -17.185
    3    HB2  GLN  26           HB2      GLN  26 -28.006  -9.032 -14.764
    4    HB3  GLN  26           HB3      GLN  26 -29.580  -9.729 -15.118
    5    HG2  GLN  26           HG2      GLN  26 -27.008 -11.226 -14.700
    6    HG3  GLN  26           HG3      GLN  26 -28.360 -11.131 -13.578
    7   HE21  GLN  26          HE21      GLN  26 -27.177 -13.282 -14.911
    8   HE22  GLN  26          HE22      GLN  26 -28.237 -14.298 -15.723

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ALA  27           H        ALA  27 -27.578  -7.343 -16.725
    2    HA   ALA  27           HA       ALA  27 -30.061  -6.203 -17.466
    3    HB1  ALA  27           HB1      ALA  27 -28.227  -4.936 -16.336
    4    HB3  ALA  27           HB2      ALA  27 -28.818  -4.130 -17.790
    5    HB2  ALA  27           HB3      ALA  27 -27.294  -5.015 -17.831

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLU  28           H        GLU  28 -27.388  -7.417 -19.382
    2    HA   GLU  28           HA       GLU  28 -28.328  -6.309 -21.870
    3    HB2  GLU  28           HB2      GLU  28 -25.954  -7.035 -21.280
    4    HB3  GLU  28           HB3      GLU  28 -26.520  -8.687 -21.515
    5    HG2  GLU  28           HG2      GLU  28 -25.379  -7.881 -23.474
    6    HG3  GLU  28           HG3      GLU  28 -27.082  -8.176 -23.817

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LYS  29           H        LYS  29 -28.521  -9.450 -20.283
    2    HA   LYS  29           HA       LYS  29 -29.856 -10.858 -22.311
    3    HB2  LYS  29           HB2      LYS  29 -28.804 -11.900 -20.337
    4    HB3  LYS  29           HB3      LYS  29 -30.060 -11.201 -19.317
    5    HG2  LYS  29           HG2      LYS  29 -31.745 -12.528 -20.403
    6    HG3  LYS  29           HG3      LYS  29 -30.562 -13.152 -21.551
    7    HD2  LYS  29           HD2      LYS  29 -29.421 -14.371 -19.853
    8    HD3  LYS  29           HD3      LYS  29 -30.308 -13.548 -18.572
    9    HE2  LYS  29           HE2      LYS  29 -31.092 -15.879 -18.982
   10    HE3  LYS  29           HE3      LYS  29 -32.357 -14.666 -19.189
   11    HZ1  LYS  29           HZ1      LYS  29 -31.812 -14.752 -21.623
   12    HZ3  LYS  29           HZ2      LYS  29 -32.544 -16.145 -20.984
   13    HZ2  LYS  29           HZ3      LYS  29 -30.876 -16.129 -21.294

  No H/Q in entry =          13
  In of MODEL   19
    1    H    TYR  30           H        TYR  30 -31.203  -8.794 -19.749
    2    HA   TYR  30           HA       TYR  30 -33.881  -9.183 -20.981
    3    HB2  TYR  30           HB2      TYR  30 -33.194  -8.100 -18.238
    4    HB3  TYR  30           HB3      TYR  30 -34.819  -8.323 -18.885
    5    HD1  TYR  30           HD1      TYR  30 -35.758 -10.599 -19.145
    6    HD2  TYR  30           HD2      TYR  30 -31.904  -9.962 -17.453
    7    HE1  TYR  30           HE1      TYR  30 -35.692 -12.945 -18.403
    8    HE2  TYR  30           HE2      TYR  30 -31.837 -12.294 -16.714
    9    HH   TYR  30           HH       TYR  30 -33.513 -14.609 -17.849

  No H/Q in entry =           9
  In of MODEL   19
    1    H    GLU  31           H        GLU  31 -31.696  -7.200 -21.751
    2    HA   GLU  31           HA       GLU  31 -31.603  -5.025 -22.525
    3    HB2  GLU  31           HB2      GLU  31 -34.509  -5.694 -23.032
    4    HB3  GLU  31           HB3      GLU  31 -33.658  -4.321 -23.736
    5    HG2  GLU  31           HG2      GLU  31 -32.212  -5.747 -24.971
    6    HG3  GLU  31           HG3      GLU  31 -32.787  -7.175 -24.111

  No H/Q in entry =           6
  In of MODEL   19
    1    H    VAL  32           H        VAL  32 -31.781  -4.984 -19.790
    2    HA   VAL  32           HA       VAL  32 -33.615  -2.866 -19.069
    3    HB   VAL  32           HB       VAL  32 -31.223  -3.922 -17.529
    4   HG12  VAL  32          HG11      VAL  32 -32.735  -3.126 -15.603
    5   HG11  VAL  32          HG12      VAL  32 -33.567  -2.183 -16.840
    6   HG13  VAL  32          HG13      VAL  32 -31.854  -1.906 -16.525
    7   HG21  VAL  32          HG21      VAL  32 -33.015  -5.606 -18.243
    8   HG23  VAL  32          HG22      VAL  32 -34.037  -4.795 -17.057
    9   HG22  VAL  32          HG23      VAL  32 -32.524  -5.548 -16.550

  No H/Q in entry =           9
  In of MODEL   19
    1    HA   PRO  33           HA       PRO  33 -30.562   0.067 -20.696
    2    HB2  PRO  33           HB2      PRO  33 -32.049   2.302 -20.511
    3    HB3  PRO  33           HB3      PRO  33 -32.539   1.031 -21.630
    4    HG2  PRO  33           HG2      PRO  33 -33.482   1.492 -18.799
    5    HG3  PRO  33           HG3      PRO  33 -34.459   1.328 -20.259
    6    HD2  PRO  33           HD2      PRO  33 -34.013  -0.788 -18.645
    7    HD3  PRO  33           HD3      PRO  33 -34.090  -0.987 -20.395

  No H/Q in entry =           7
  In of MODEL   19
    1    H    VAL  34           H        VAL  34 -29.290  -0.535 -18.771
    2    HA   VAL  34           HA       VAL  34 -28.970   1.848 -17.069
    3    HB   VAL  34           HB       VAL  34 -28.390   0.335 -15.170
    4   HG12  VAL  34          HG11      VAL  34 -30.809  -0.519 -14.865
    5   HG11  VAL  34          HG12      VAL  34 -31.128   0.279 -16.402
    6   HG13  VAL  34          HG13      VAL  34 -30.555   1.219 -15.024
    7   HG21  VAL  34          HG21      VAL  34 -28.610  -1.641 -17.223
    8   HG23  VAL  34          HG22      VAL  34 -29.661  -2.024 -15.858
    9   HG22  VAL  34          HG23      VAL  34 -27.939  -1.760 -15.597

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ILE  35           H        ILE  35 -26.983   2.243 -16.234
    2    HA   ILE  35           HA       ILE  35 -24.701   0.921 -17.545
    3    HB   ILE  35           HB       ILE  35 -25.067   3.795 -16.663
    4   HG12  ILE  35          HG12      ILE  35 -24.115   2.538 -19.245
    5   HG13  ILE  35          HG13      ILE  35 -25.737   3.168 -18.958
    6   HG21  ILE  35          HG21      ILE  35 -22.522   2.245 -17.027
    7   HG23  ILE  35          HG22      ILE  35 -22.955   3.400 -15.768
    8   HG22  ILE  35          HG23      ILE  35 -22.579   3.968 -17.394
    9   HD11  ILE  35          HD11      ILE  35 -24.310   5.334 -18.317
   10   HD13  ILE  35          HD12      ILE  35 -24.863   4.995 -19.958
   11   HD12  ILE  35          HD13      ILE  35 -23.211   4.598 -19.484

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ILE  36           H        ILE  36 -23.469  -0.151 -15.979
    2    HA   ILE  36           HA       ILE  36 -23.882   0.400 -13.091
    3    HB   ILE  36           HB       ILE  36 -23.090  -2.284 -14.269
    4   HG12  ILE  36          HG12      ILE  36 -25.884  -1.469 -13.465
    5   HG13  ILE  36          HG13      ILE  36 -25.324  -1.415 -15.137
    6   HG23  ILE  36          HG21      ILE  36 -23.434  -3.158 -12.172
    7   HG22  ILE  36          HG22      ILE  36 -24.544  -1.875 -11.695
    8   HG21  ILE  36          HG23      ILE  36 -22.811  -1.558 -11.771
    9   HD13  ILE  36          HD11      ILE  36 -25.513  -3.622 -15.393
   10   HD12  ILE  36          HD12      ILE  36 -26.566  -3.522 -13.984
   11   HD11  ILE  36          HD13      ILE  36 -24.871  -3.964 -13.787

  No H/Q in entry =          11
  In of MODEL   19
    1    H    GLU  37           H        GLU  37 -22.087   0.987 -11.986
    2    HA   GLU  37           HA       GLU  37 -19.412   0.187 -12.941
    3    HB2  GLU  37           HB2      GLU  37 -20.282   2.967 -12.175
    4    HB3  GLU  37           HB3      GLU  37 -18.598   2.465 -12.318
    5    HG2  GLU  37           HG2      GLU  37 -18.883   2.073 -14.681
    6    HG3  GLU  37           HG3      GLU  37 -20.594   2.482 -14.562

  No H/Q in entry =           6
  In of MODEL   19
    1    H    ALA  38           H        ALA  38 -17.915  -0.105 -11.275
    2    HA   ALA  38           HA       ALA  38 -18.924   0.018  -8.494
    3    HB1  ALA  38           HB1      ALA  38 -17.238  -1.902  -9.978
    4    HB3  ALA  38           HB2      ALA  38 -18.280  -2.160  -8.577
    5    HB2  ALA  38           HB3      ALA  38 -16.660  -1.498  -8.361

  No H/Q in entry =           5
  In of MODEL   19
    1    H    PHE  39           H        PHE  39 -17.661   1.182  -7.002
    2    HA   PHE  39           HA       PHE  39 -15.133   2.383  -7.890
    3    HB2  PHE  39           HB2      PHE  39 -17.523   3.869  -6.814
    4    HB3  PHE  39           HB3      PHE  39 -15.888   4.521  -6.734
    5    HD1  PHE  39           HD1      PHE  39 -14.599   4.570  -9.005
    6    HD2  PHE  39           HD2      PHE  39 -18.842   4.376  -8.616
    7    HE1  PHE  39           HE1      PHE  39 -14.839   5.494 -11.292
    8    HE2  PHE  39           HE2      PHE  39 -19.097   5.290 -10.895
    9    HZ   PHE  39           HZ       PHE  39 -17.101   5.824 -12.252

  No H/Q in entry =           9
  In of MODEL   19
    1    HA   PRO  40           HA       PRO  40 -14.168   1.523  -3.629
    2    HB2  PRO  40           HB2      PRO  40 -12.381   3.509  -2.988
    3    HB3  PRO  40           HB3      PRO  40 -11.956   2.200  -4.091
    4    HG2  PRO  40           HG2      PRO  40 -12.966   4.958  -4.765
    5    HG3  PRO  40           HG3      PRO  40 -11.549   4.123  -5.401
    6    HD2  PRO  40           HD2      PRO  40 -13.783   4.084  -6.795
    7    HD3  PRO  40           HD3      PRO  40 -12.838   2.603  -6.646

  No H/Q in entry =           7
  In of MODEL   19
    1    H    GLU  41           H        GLU  41 -14.767   2.454  -1.472
    2    HA   GLU  41           HA       GLU  41 -16.999   4.173  -1.399
    3    HB2  GLU  41           HB2      GLU  41 -16.679   4.164   1.036
    4    HB3  GLU  41           HB3      GLU  41 -16.559   2.540   0.355
    5    HG2  GLU  41           HG2      GLU  41 -14.838   2.536   1.876
    6    HG3  GLU  41           HG3      GLU  41 -14.002   2.989   0.391

  No H/Q in entry =           6
  In of MODEL   19
    1    H    THR  42           H        THR  42 -13.662   5.067  -1.455
    2    HA   THR  42           HA       THR  42 -13.987   7.602  -0.180
    3    HB   THR  42           HB       THR  42 -11.833   8.186  -1.263
    4    HG1  THR  42           HG1      THR  42 -11.120   7.055  -2.906
    5   HG22  THR  42          HG21      THR  42 -11.794   5.338  -0.243
    6   HG21  THR  42          HG22      THR  42 -11.951   6.748   0.807
    7   HG23  THR  42          HG23      THR  42 -10.491   6.524  -0.154

  No H/Q in entry =           7
  In of MODEL   19
    1    H    LEU  43           H        LEU  43 -14.922   6.587  -3.299
    2    HA   LEU  43           HA       LEU  43 -15.164   9.382  -4.202
    3    HB2  LEU  43           HB2      LEU  43 -15.568   6.775  -5.658
    4    HB3  LEU  43           HB3      LEU  43 -15.750   8.376  -6.372
    5    HG   LEU  43           HG       LEU  43 -13.159   7.195  -5.399
    6   HD12  LEU  43          HD11      LEU  43 -13.805   7.796  -8.251
    7   HD11  LEU  43          HD12      LEU  43 -14.381   6.289  -7.541
    8   HD13  LEU  43          HD13      LEU  43 -12.655   6.640  -7.579
    9   HD23  LEU  43          HD21      LEU  43 -12.322   9.178  -6.842
   10   HD22  LEU  43          HD22      LEU  43 -12.932   9.513  -5.220
   11   HD21  LEU  43          HD23      LEU  43 -13.949   9.821  -6.626

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ALA  44           H        ALA  44 -17.107   7.528  -2.377
    2    HA   ALA  44           HA       ALA  44 -19.596   7.435  -3.684
    3    HB2  ALA  44           HB1      ALA  44 -19.450   6.269  -1.614
    4    HB3  ALA  44           HB2      ALA  44 -20.545   7.614  -1.303
    5    HB1  ALA  44           HB3      ALA  44 -18.870   7.699  -0.761

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLY  45           H        GLY  45 -18.145  10.189  -2.098
    2    HA3  GLY  45           HA2      GLY  45 -20.575  11.713  -2.405
    3    HA2  GLY  45           HA3      GLY  45 -19.023  12.314  -1.826

  No H/Q in entry =           3
  In of MODEL   19
    1    H    GLU  46           H        GLU  46 -17.515  11.420  -4.149
    2    HA   GLU  46           HA       GLU  46 -18.150  13.680  -5.861
    3    HB2  GLU  46           HB2      GLU  46 -15.824  13.185  -5.290
    4    HB3  GLU  46           HB3      GLU  46 -15.979  11.581  -6.008
    5    HG2  GLU  46           HG2      GLU  46 -14.795  12.948  -7.543
    6    HG3  GLU  46           HG3      GLU  46 -16.411  12.685  -8.199

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LYS  47           H        LYS  47 -18.057  10.171  -6.379
    2    HA   LYS  47           HA       LYS  47 -19.174  10.460  -9.039
    3    HB2  LYS  47           HB2      LYS  47 -18.011   8.312  -7.415
    4    HB3  LYS  47           HB3      LYS  47 -19.391   7.803  -8.389
    5    HG2  LYS  47           HG2      LYS  47 -17.327   7.413  -9.575
    6    HG3  LYS  47           HG3      LYS  47 -18.276   8.656 -10.390
    7    HD2  LYS  47           HD2      LYS  47 -16.920  10.397  -9.442
    8    HD3  LYS  47           HD3      LYS  47 -16.050   9.231  -8.445
    9    HE2  LYS  47           HE2      LYS  47 -14.656   9.752 -10.297
   10    HE3  LYS  47           HE3      LYS  47 -15.291   8.129 -10.564
   11    HZ3  LYS  47           HZ1      LYS  47 -15.720   9.025 -12.570
   12    HZ2  LYS  47           HZ2      LYS  47 -15.862  10.610 -11.977
   13    HZ1  LYS  47           HZ3      LYS  47 -17.146   9.514 -11.788

  No H/Q in entry =          13
  In of MODEL   19
    1    H    GLY  48           H        GLY  48 -20.479   9.640  -5.900
    2    HA3  GLY  48           HA2      GLY  48 -22.878   8.488  -6.649
    3    HA2  GLY  48           HA3      GLY  48 -22.635   9.447  -5.190

  No H/Q in entry =           3
  In of MODEL   19
    1    H    GLN  49           H        GLN  49 -22.047  11.902  -6.709
    2    HA   GLN  49           HA       GLN  49 -24.599  13.033  -6.808
    3    HB2  GLN  49           HB2      GLN  49 -22.060  13.911  -8.167
    4    HB3  GLN  49           HB3      GLN  49 -23.515  14.884  -8.050
    5    HG2  GLN  49           HG2      GLN  49 -23.337  14.851  -5.615
    6    HG3  GLN  49           HG3      GLN  49 -21.895  13.857  -5.731
    7   HE21  GLN  49          HE21      GLN  49 -21.753  16.054  -4.408
    8   HE22  GLN  49          HE22      GLN  49 -20.827  17.319  -5.034

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ASN  50           H        ASN  50 -22.951  11.198  -9.250
    2    HA   ASN  50           HA       ASN  50 -24.844  12.130 -11.298
    3    HB2  ASN  50           HB2      ASN  50 -22.276  10.578 -11.585
    4    HB3  ASN  50           HB3      ASN  50 -23.334  11.041 -12.912
    5   HD21  ASN  50          HD21      ASN  50 -20.679  11.832 -11.302
    6   HD22  ASN  50          HD22      ASN  50 -20.437  13.474 -11.609

  No H/Q in entry =           6
  In of MODEL   19
    1    H    ALA  51           H        ALA  51 -24.829   9.723  -9.106
    2    HA   ALA  51           HA       ALA  51 -25.643   7.626 -10.975
    3    HB2  ALA  51           HB1      ALA  51 -25.057   6.234  -9.325
    4    HB3  ALA  51           HB2      ALA  51 -26.165   7.025  -8.204
    5    HB1  ALA  51           HB3      ALA  51 -24.524   7.639  -8.401

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ASP  52           H        ASP  52 -27.655   6.582 -10.844
    2    HA   ASP  52           HA       ASP  52 -29.817   8.416 -10.120
    3    HB2  ASP  52           HB2      ASP  52 -29.658   5.948 -11.848
    4    HB3  ASP  52           HB3      ASP  52 -31.193   6.683 -11.385

  No H/Q in entry =           4
  In of MODEL   19
    1    H    VAL  53           H        VAL  53 -28.231   5.492  -9.183
    2    HA   VAL  53           HA       VAL  53 -29.652   5.573  -6.653
    3    HB   VAL  53           HB       VAL  53 -31.073   3.970  -7.923
    4   HG11  VAL  53          HG11      VAL  53 -29.344   3.132  -9.479
    5   HG13  VAL  53          HG12      VAL  53 -30.182   1.825  -8.642
    6   HG12  VAL  53          HG13      VAL  53 -28.564   2.302  -8.133
    7   HG23  VAL  53          HG21      VAL  53 -30.255   1.950  -6.284
    8   HG22  VAL  53          HG22      VAL  53 -31.370   3.253  -5.879
    9   HG21  VAL  53          HG23      VAL  53 -29.659   3.403  -5.480

  No H/Q in entry =           9
  In of MODEL   19
    1    H    VAL  54           H        VAL  54 -28.330   5.092  -5.018
    2    HA   VAL  54           HA       VAL  54 -25.581   4.234  -5.671
    3    HB   VAL  54           HB       VAL  54 -26.620   5.968  -3.373
    4   HG11  VAL  54          HG11      VAL  54 -24.056   4.535  -3.717
    5   HG13  VAL  54          HG12      VAL  54 -24.792   5.187  -2.253
    6   HG12  VAL  54          HG13      VAL  54 -23.886   6.247  -3.332
    7   HG22  VAL  54          HG21      VAL  54 -25.754   7.800  -4.437
    8   HG21  VAL  54          HG22      VAL  54 -26.320   6.846  -5.808
    9   HG23  VAL  54          HG23      VAL  54 -24.609   6.847  -5.382

  No H/Q in entry =           9
  In of MODEL   19
    1    H    LEU  55           H        LEU  55 -25.002   2.292  -5.077
    2    HA   LEU  55           HA       LEU  55 -26.504   0.946  -2.920
    3    HB2  LEU  55           HB2      LEU  55 -24.975  -0.183  -5.254
    4    HB3  LEU  55           HB3      LEU  55 -25.734  -1.140  -3.981
    5    HG   LEU  55           HG       LEU  55 -27.173   0.508  -6.051
    6   HD13  LEU  55          HD11      LEU  55 -26.899  -1.318  -7.314
    7   HD12  LEU  55          HD12      LEU  55 -27.855  -2.212  -6.132
    8   HD11  LEU  55          HD13      LEU  55 -26.097  -2.166  -5.994
    9   HD23  LEU  55          HD21      LEU  55 -28.471  -1.468  -4.230
   10   HD22  LEU  55          HD22      LEU  55 -29.160  -0.061  -5.041
   11   HD21  LEU  55          HD23      LEU  55 -28.127   0.153  -3.627

  No H/Q in entry =          11
  In of MODEL   19
    1    H    LEU  56           H        LEU  56 -25.344   0.300  -1.138
    2    HA   LEU  56           HA       LEU  56 -22.407   0.671  -1.202
    3    HB2  LEU  56           HB2      LEU  56 -24.193   0.421   1.206
    4    HB3  LEU  56           HB3      LEU  56 -22.481   0.835   1.191
    5    HG   LEU  56           HG       LEU  56 -24.771   2.556   0.284
    6   HD11  LEU  56          HD11      LEU  56 -23.641   2.106   2.786
    7   HD13  LEU  56          HD12      LEU  56 -24.623   3.495   2.319
    8   HD12  LEU  56          HD13      LEU  56 -22.866   3.586   2.221
    9   HD23  LEU  56          HD21      LEU  56 -22.813   4.241   0.113
   10   HD22  LEU  56          HD22      LEU  56 -23.215   3.178  -1.235
   11   HD21  LEU  56          HD23      LEU  56 -21.857   2.789  -0.181

  No H/Q in entry =          11
  In of MODEL   19
    1    H    GLY  57           H        GLY  57 -21.038  -0.984  -0.714
    2    HA3  GLY  57           HA2      GLY  57 -21.987  -3.656  -0.970
    3    HA2  GLY  57           HA3      GLY  57 -20.356  -3.188  -0.493

  No H/Q in entry =           3
  In of MODEL   19
    1    HA   PRO  58           HA       PRO  58 -23.146  -4.285   3.218
    2    HB2  PRO  58           HB2      PRO  58 -22.481  -6.909   3.760
    3    HB3  PRO  58           HB3      PRO  58 -23.870  -6.466   2.767
    4    HG2  PRO  58           HG2      PRO  58 -21.156  -7.353   1.939
    5    HG3  PRO  58           HG3      PRO  58 -22.729  -7.783   1.271
    6    HD2  PRO  58           HD2      PRO  58 -21.113  -5.954   0.076
    7    HD3  PRO  58           HD3      PRO  58 -22.872  -5.849  -0.010

  No H/Q in entry =           7
  In of MODEL   19
    1    H    GLN  59           H        GLN  59 -19.784  -4.775   2.574
    2    HA   GLN  59           HA       GLN  59 -19.008  -4.863   5.328
    3    HB2  GLN  59           HB2      GLN  59 -17.312  -3.783   3.086
    4    HB3  GLN  59           HB3      GLN  59 -16.783  -4.496   4.597
    5    HG2  GLN  59           HG2      GLN  59 -16.372  -6.130   2.980
    6    HG3  GLN  59           HG3      GLN  59 -17.852  -6.653   3.769
    7   HE21  GLN  59          HE21      GLN  59 -18.710  -7.572   2.244
    8   HE22  GLN  59          HE22      GLN  59 -19.335  -7.271   0.733

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ILE  60           H        ILE  60 -19.935  -2.253   3.186
    2    HA   ILE  60           HA       ILE  60 -19.049  -0.352   5.268
    3    HB   ILE  60           HB       ILE  60 -19.282   1.421   3.482
    4   HG12  ILE  60          HG12      ILE  60 -19.113  -0.763   1.450
    5   HG13  ILE  60          HG13      ILE  60 -20.693  -0.223   2.020
    6   HG23  ILE  60          HG21      ILE  60 -17.129   1.169   2.761
    7   HG22  ILE  60          HG22      ILE  60 -17.283  -0.576   2.569
    8   HG21  ILE  60          HG23      ILE  60 -17.163   0.125   4.182
    9   HD13  ILE  60          HD11      ILE  60 -20.402   1.128   0.163
   10   HD12  ILE  60          HD12      ILE  60 -18.658   1.249   0.394
   11   HD11  ILE  60          HD13      ILE  60 -19.750   2.165   1.432

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ALA  61           H        ALA  61 -21.519  -1.914   5.320
    2    HA   ALA  61           HA       ALA  61 -23.732  -0.219   4.917
    3    HB1  ALA  61           HB1      ALA  61 -24.951  -1.727   6.218
    4    HB2  ALA  61           HB2      ALA  61 -23.549  -2.153   7.200
    5    HB3  ALA  61           HB3      ALA  61 -23.663  -2.720   5.535

  No H/Q in entry =           5
  In of MODEL   19
    1    H    TYR  62           H        TYR  62 -21.505  -0.416   7.694
    2    HA   TYR  62           HA       TYR  62 -23.031   1.217   9.414
    3    HB2  TYR  62           HB2      TYR  62 -20.969   1.604  10.634
    4    HB3  TYR  62           HB3      TYR  62 -21.062  -0.089  10.150
    5    HD1  TYR  62           HD1      TYR  62 -19.471  -1.027   8.556
    6    HD2  TYR  62           HD2      TYR  62 -19.284   3.108   9.616
    7    HE1  TYR  62           HE1      TYR  62 -17.267  -0.853   7.466
    8    HE2  TYR  62           HE2      TYR  62 -17.065   3.278   8.527
    9    HH   TYR  62           HH       TYR  62 -15.475   0.418   7.237

  No H/Q in entry =           9
  In of MODEL   19
    1    H    MET  63           H        MET  63 -21.402   2.125   6.566
    2    HA   MET  63           HA       MET  63 -21.201   4.940   7.322
    3    HB2  MET  63           HB2      MET  63 -20.627   3.467   4.750
    4    HB3  MET  63           HB3      MET  63 -20.420   5.207   4.965
    5    HG2  MET  63           HG2      MET  63 -18.713   4.789   6.655
    6    HG3  MET  63           HG3      MET  63 -18.914   3.052   6.426
    7    HE3  MET  63           HE1      MET  63 -15.536   3.744   4.656
    8    HE2  MET  63           HE2      MET  63 -16.435   2.432   5.420
    9    HE1  MET  63           HE3      MET  63 -16.258   3.981   6.250

  No H/Q in entry =           9
  In of MODEL   19
    1    H    LEU  64           H        LEU  64 -23.791   3.133   6.335
    2    HA   LEU  64           HA       LEU  64 -25.002   4.611   4.300
    3    HB2  LEU  64           HB2      LEU  64 -25.886   2.493   5.177
    4    HB3  LEU  64           HB3      LEU  64 -26.322   3.307   6.679
    5    HG   LEU  64           HG       LEU  64 -28.013   4.606   5.493
    6   HD13  LEU  64          HD11      LEU  64 -27.746   4.895   3.265
    7   HD12  LEU  64          HD12      LEU  64 -28.410   3.270   3.088
    8   HD11  LEU  64          HD13      LEU  64 -26.664   3.510   3.137
    9   HD23  LEU  64          HD21      LEU  64 -28.567   1.817   4.686
   10   HD22  LEU  64          HD22      LEU  64 -29.536   2.939   5.640
   11   HD21  LEU  64          HD23      LEU  64 -28.163   2.115   6.378

  No H/Q in entry =          11
  In of MODEL   19
    1    HA   PRO  65           HA       PRO  65 -27.127   7.724   7.140
    2    HB2  PRO  65           HB2      PRO  65 -25.106   7.810   9.381
    3    HB3  PRO  65           HB3      PRO  65 -26.843   8.109   9.447
    4    HG2  PRO  65           HG2      PRO  65 -25.931   5.824  10.315
    5    HG3  PRO  65           HG3      PRO  65 -27.358   5.830   9.280
    6    HD2  PRO  65           HD2      PRO  65 -24.499   5.201   8.540
    7    HD3  PRO  65           HD3      PRO  65 -25.970   4.341   8.085

  No H/Q in entry =           7
  In of MODEL   19
    1    H    GLU  66           H        GLU  66 -23.572   7.627   7.182
    2    HA   GLU  66           HA       GLU  66 -23.246  10.431   6.838
    3    HB2  GLU  66           HB2      GLU  66 -21.464   8.118   6.119
    4    HB3  GLU  66           HB3      GLU  66 -20.996   9.810   5.946
    5    HG2  GLU  66           HG2      GLU  66 -21.185  10.129   8.324
    6    HG3  GLU  66           HG3      GLU  66 -21.728   8.463   8.522

  No H/Q in entry =           6
  In of MODEL   19
    1    H    ILE  67           H        ILE  67 -23.398   7.738   4.526
    2    HA   ILE  67           HA       ILE  67 -22.979   9.494   2.267
    3    HB   ILE  67           HB       ILE  67 -23.912   6.595   2.390
    4   HG12  ILE  67          HG12      ILE  67 -21.274   7.753   1.472
    5   HG13  ILE  67          HG13      ILE  67 -21.561   7.299   3.151
    6   HG21  ILE  67          HG21      ILE  67 -23.849   8.522   0.207
    7   HG23  ILE  67          HG22      ILE  67 -24.493   6.881   0.226
    8   HG22  ILE  67          HG23      ILE  67 -22.785   7.152  -0.110
    9   HD12  ILE  67          HD11      ILE  67 -21.181   5.576   0.758
   10   HD11  ILE  67          HD12      ILE  67 -22.192   4.986   2.076
   11   HD13  ILE  67          HD13      ILE  67 -20.511   5.424   2.382

  No H/Q in entry =          11
  In of MODEL   19
    1    H    GLN  68           H        GLN  68 -25.849   8.438   3.901
    2    HA   GLN  68           HA       GLN  68 -27.682   9.437   1.964
    3    HB2  GLN  68           HB2      GLN  68 -27.918   9.014   4.941
    4    HB3  GLN  68           HB3      GLN  68 -29.238   9.648   3.972
    5    HG2  GLN  68           HG2      GLN  68 -29.303   7.649   2.651
    6    HG3  GLN  68           HG3      GLN  68 -27.855   7.035   3.428
    7   HE21  GLN  68          HE21      GLN  68 -30.052   5.709   3.280
    8   HE22  GLN  68          HE22      GLN  68 -30.875   5.232   4.692

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ARG  69           H        ARG  69 -26.032  11.019   4.725
    2    HA   ARG  69           HA       ARG  69 -27.366  13.528   4.387
    3    HB2  ARG  69           HB2      ARG  69 -25.021  12.530   5.934
    4    HB3  ARG  69           HB3      ARG  69 -25.079  14.259   5.615
    5    HG2  ARG  69           HG2      ARG  69 -27.387  14.311   6.607
    6    HG3  ARG  69           HG3      ARG  69 -27.198  12.608   7.041
    7    HD2  ARG  69           HD2      ARG  69 -25.465  14.917   7.993
    8    HD3  ARG  69           HD3      ARG  69 -26.598  14.005   8.977
    9    HE   ARG  69           HE       ARG  69 -24.007  13.060   7.984
   10   HH21  ARG  69          HH11      ARG  69 -23.214  11.258   9.132
   11   HH22  ARG  69          HH12      ARG  69 -24.245  10.431  10.251
   12   HH11  ARG  69          HH21      ARG  69 -26.958  12.514   9.694
   13   HH12  ARG  69          HH22      ARG  69 -26.364  11.140  10.566

  No H/Q in entry =          13
  In of MODEL   19
    1    H    LEU  70           H        LEU  70 -24.526  12.112   2.970
    2    HA   LEU  70           HA       LEU  70 -23.389  14.488   1.847
    3    HB2  LEU  70           HB2      LEU  70 -22.423  12.143   2.380
    4    HB3  LEU  70           HB3      LEU  70 -23.058  11.722   0.790
    5    HG   LEU  70           HG       LEU  70 -21.454  13.097  -0.277
    6   HD11  LEU  70          HD11      LEU  70 -20.595  13.864   2.521
    7   HD13  LEU  70          HD12      LEU  70 -21.286  14.936   1.303
    8   HD12  LEU  70          HD13      LEU  70 -19.687  14.237   1.054
    9   HD22  LEU  70          HD21      LEU  70 -20.044  11.354  -0.097
   10   HD21  LEU  70          HD22      LEU  70 -20.966  10.813   1.306
   11   HD23  LEU  70          HD23      LEU  70 -19.564  11.860   1.523

  No H/Q in entry =          11
  In of MODEL   19
    1    H    LEU  71           H        LEU  71 -25.589  12.004   0.692
    2    HA   LEU  71           HA       LEU  71 -26.113  13.556  -1.784
    3    HB2  LEU  71           HB2      LEU  71 -26.361  10.566  -1.404
    4    HB3  LEU  71           HB3      LEU  71 -26.489  11.463  -2.916
    5    HG   LEU  71           HG       LEU  71 -23.955  11.398  -1.278
    6   HD12  LEU  71          HD11      LEU  71 -24.054   9.828  -3.746
    7   HD11  LEU  71          HD12      LEU  71 -25.063   9.190  -2.449
    8   HD13  LEU  71          HD13      LEU  71 -23.337   9.437  -2.182
    9   HD22  LEU  71          HD21      LEU  71 -24.042  13.250  -2.728
   10   HD21  LEU  71          HD22      LEU  71 -24.567  12.246  -4.080
   11   HD23  LEU  71          HD23      LEU  71 -22.943  12.059  -3.420

  No H/Q in entry =          11
  In of MODEL   19
    1    HA   PRO  72           HA       PRO  72 -29.963  13.109   0.861
    2    HB2  PRO  72           HB2      PRO  72 -30.778  15.685   0.845
    3    HB3  PRO  72           HB3      PRO  72 -29.468  15.186   1.915
    4    HG2  PRO  72           HG2      PRO  72 -29.286  16.440  -0.813
    5    HG3  PRO  72           HG3      PRO  72 -28.497  16.945   0.682
    6    HD2  PRO  72           HD2      PRO  72 -27.201  15.406  -1.132
    7    HD3  PRO  72           HD3      PRO  72 -26.934  15.195   0.598

  No H/Q in entry =           7
  In of MODEL   19
    1    H    ASN  73           H        ASN  73 -29.351  14.127  -2.336
    2    HA   ASN  73           HA       ASN  73 -32.221  13.882  -2.950
    3    HB2  ASN  73           HB2      ASN  73 -31.755  15.028  -5.026
    4    HB3  ASN  73           HB3      ASN  73 -31.203  15.967  -3.647
    5   HD21  ASN  73          HD21      ASN  73 -30.430  16.060  -6.330
    6   HD22  ASN  73          HD22      ASN  73 -28.767  15.874  -6.541

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LYS  74           H        LYS  74 -30.277  11.583  -2.595
    2    HA   LYS  74           HA       LYS  74 -30.892  10.258  -5.169
    3    HB2  LYS  74           HB2      LYS  74 -28.351   9.883  -3.577
    4    HB3  LYS  74           HB3      LYS  74 -28.763   9.112  -5.109
    5    HG2  LYS  74           HG2      LYS  74 -28.442  12.072  -4.842
    6    HG3  LYS  74           HG3      LYS  74 -27.090  10.992  -5.184
    7    HD2  LYS  74           HD2      LYS  74 -28.240  10.129  -7.137
    8    HD3  LYS  74           HD3      LYS  74 -29.639  11.145  -6.782
    9    HE2  LYS  74           HE2      LYS  74 -28.380  13.138  -7.190
   10    HE3  LYS  74           HE3      LYS  74 -26.876  12.223  -7.314
   11    HZ2  LYS  74           HZ1      LYS  74 -28.355  12.901  -9.413
   12    HZ1  LYS  74           HZ2      LYS  74 -29.034  11.382  -9.068
   13    HZ3  LYS  74           HZ3      LYS  74 -27.369  11.518  -9.377

  No H/Q in entry =          13
  In of MODEL   19
    1    HA   PRO  75           HA       PRO  75 -32.316   7.231  -2.254
    2    HB2  PRO  75           HB2      PRO  75 -32.681   5.056  -3.883
    3    HB3  PRO  75           HB3      PRO  75 -33.782   6.433  -3.912
    4    HG2  PRO  75           HG2      PRO  75 -31.472   5.833  -5.716
    5    HG3  PRO  75           HG3      PRO  75 -33.115   6.310  -6.139
    6    HD2  PRO  75           HD2      PRO  75 -31.138   8.137  -6.071
    7    HD3  PRO  75           HD3      PRO  75 -32.758   8.555  -5.509

  No H/Q in entry =           7
  In of MODEL   19
    1    H    VAL  76           H        VAL  76 -30.872   6.118  -0.918
    2    HA   VAL  76           HA       VAL  76 -28.440   4.888  -2.074
    3    HB   VAL  76           HB       VAL  76 -28.677   6.299   0.618
    4   HG11  VAL  76          HG11      VAL  76 -26.358   4.999  -0.823
    5   HG13  VAL  76          HG12      VAL  76 -27.049   4.526   0.730
    6   HG12  VAL  76          HG13      VAL  76 -26.176   6.051   0.582
    7   HG22  VAL  76          HG21      VAL  76 -27.981   8.206  -0.231
    8   HG21  VAL  76          HG22      VAL  76 -28.549   7.555  -1.770
    9   HG23  VAL  76          HG23      VAL  76 -26.846   7.425  -1.333

  No H/Q in entry =           9
  In of MODEL   19
    1    H    GLU  77           H        GLU  77 -28.259   2.716  -1.511
    2    HA   GLU  77           HA       GLU  77 -29.038   1.884   1.130
    3    HB2  GLU  77           HB2      GLU  77 -30.681   0.280   0.577
    4    HB3  GLU  77           HB3      GLU  77 -31.207   1.828  -0.086
    5    HG2  GLU  77           HG2      GLU  77 -30.630   1.109  -2.295
    6    HG3  GLU  77           HG3      GLU  77 -30.012  -0.415  -1.661

  No H/Q in entry =           6
  In of MODEL   19
    1    H    VAL  78           H        VAL  78 -28.745  -0.223   1.740
    2    HA   VAL  78           HA       VAL  78 -26.102  -1.023   0.812
    3    HB   VAL  78           HB       VAL  78 -27.807  -1.929   3.171
    4   HG11  VAL  78          HG11      VAL  78 -25.500  -3.176   1.999
    5   HG13  VAL  78          HG12      VAL  78 -26.405  -3.662   3.435
    6   HG12  VAL  78          HG13      VAL  78 -25.062  -2.528   3.580
    7   HG22  VAL  78          HG21      VAL  78 -26.311  -0.624   4.528
    8   HG21  VAL  78          HG22      VAL  78 -27.040   0.388   3.280
    9   HG23  VAL  78          HG23      VAL  78 -25.375  -0.167   3.105

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ILE  79           H        ILE  79 -25.608  -2.920  -0.141
    2    HA   ILE  79           HA       ILE  79 -27.707  -4.329  -1.503
    3    HB   ILE  79           HB       ILE  79 -24.725  -4.917  -1.320
    4   HG12  ILE  79          HG12      ILE  79 -26.359  -3.731  -3.568
    5   HG13  ILE  79          HG13      ILE  79 -25.457  -2.764  -2.400
    6   HG22  ILE  79          HG21      ILE  79 -25.868  -6.022  -3.655
    7   HG21  ILE  79          HG22      ILE  79 -26.851  -6.557  -2.291
    8   HG23  ILE  79          HG23      ILE  79 -25.115  -6.867  -2.302
    9   HD13  ILE  79          HD11      ILE  79 -24.061  -2.863  -4.233
   10   HD12  ILE  79          HD12      ILE  79 -24.435  -4.557  -4.549
   11   HD11  ILE  79          HD13      ILE  79 -23.430  -4.118  -3.166

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ASP  80           H        ASP  80 -28.603  -6.249  -0.956
    2    HA   ASP  80           HA       ASP  80 -28.545  -7.208   1.670
    3    HB2  ASP  80           HB2      ASP  80 -30.323  -7.716   0.034
    4    HB3  ASP  80           HB3      ASP  80 -29.190  -8.724  -0.868

  No H/Q in entry =           4
  In of MODEL   19
    1    H    SER  81           H        SER  81 -27.022  -8.397   2.761
    2    HA   SER  81           HA       SER  81 -24.549  -9.098   1.534
    3    HB2  SER  81           HB2      SER  81 -23.999 -10.185   3.675
    4    HB3  SER  81           HB3      SER  81 -24.667  -8.574   3.930
    5    HG   SER  81           HG       SER  81 -25.580 -10.976   4.743

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU  82           H        LEU  82 -27.295 -11.146   1.832
    2    HA   LEU  82           HA       LEU  82 -25.796 -13.531   1.246
    3    HB2  LEU  82           HB2      LEU  82 -28.721 -12.848   1.043
    4    HB3  LEU  82           HB3      LEU  82 -28.057 -14.457   0.768
    5    HG   LEU  82           HG       LEU  82 -27.907 -12.973   3.373
    6   HD11  LEU  82          HD11      LEU  82 -30.227 -13.652   2.597
    7   HD13  LEU  82          HD12      LEU  82 -29.699 -14.370   4.120
    8   HD12  LEU  82          HD13      LEU  82 -29.659 -15.322   2.635
    9   HD21  LEU  82          HD21      LEU  82 -27.059 -15.670   2.354
   10   HD23  LEU  82          HD22      LEU  82 -27.390 -15.411   4.067
   11   HD22  LEU  82          HD23      LEU  82 -26.120 -14.486   3.265

  No H/Q in entry =          11
  In of MODEL   19
    1    H    LEU  83           H        LEU  83 -27.728 -11.226  -0.606
    2    HA   LEU  83           HA       LEU  83 -27.573 -12.534  -3.108
    3    HB2  LEU  83           HB2      LEU  83 -27.922  -9.634  -2.393
    4    HB3  LEU  83           HB3      LEU  83 -27.980 -10.242  -4.047
    5    HG   LEU  83           HG       LEU  83 -30.003 -10.639  -1.862
    6   HD13  LEU  83          HD11      LEU  83 -30.732  -8.754  -2.879
    7   HD12  LEU  83          HD12      LEU  83 -31.226  -9.830  -4.185
    8   HD11  LEU  83          HD13      LEU  83 -29.677  -8.992  -4.271
    9   HD23  LEU  83          HD21      LEU  83 -30.187 -11.834  -4.613
   10   HD22  LEU  83          HD22      LEU  83 -31.153 -12.197  -3.183
   11   HD21  LEU  83          HD23      LEU  83 -29.474 -12.730  -3.273

  No H/Q in entry =          11
  In of MODEL   19
    1    H    TYR  84           H        TYR  84 -25.561 -10.222  -1.397
    2    HA   TYR  84           HA       TYR  84 -23.707  -9.723  -3.533
    3    HB2  TYR  84           HB2      TYR  84 -24.168  -8.257  -1.497
    4    HB3  TYR  84           HB3      TYR  84 -23.204  -9.408  -0.574
    5    HD1  TYR  84           HD1      TYR  84 -20.817  -9.420  -0.711
    6    HD2  TYR  84           HD2      TYR  84 -23.097  -6.889  -3.285
    7    HE1  TYR  84           HE1      TYR  84 -18.742  -8.258  -1.384
    8    HE2  TYR  84           HE2      TYR  84 -21.030  -5.725  -3.976
    9    HH   TYR  84           HH       TYR  84 -18.831  -5.433  -3.476

  No H/Q in entry =           9
  In of MODEL   19
    1    H    GLY  85           H        GLY  85 -23.481 -11.794  -0.632
    2    HA3  GLY  85           HA2      GLY  85 -20.926 -12.774  -1.158
    3    HA2  GLY  85           HA3      GLY  85 -22.164 -13.618  -0.228

  No H/Q in entry =           3
  In of MODEL   19
    1    H    LYS  86           H        LYS  86 -24.035 -13.912  -2.281
    2    HA   LYS  86           HA       LYS  86 -23.037 -16.277  -3.600
    3    HB2  LYS  86           HB2      LYS  86 -25.254 -16.212  -2.661
    4    HB3  LYS  86           HB3      LYS  86 -25.653 -14.777  -3.604
    5    HG2  LYS  86           HG2      LYS  86 -26.755 -16.734  -4.470
    6    HG3  LYS  86           HG3      LYS  86 -25.588 -16.104  -5.633
    7    HD2  LYS  86           HD2      LYS  86 -23.964 -17.755  -5.009
    8    HD3  LYS  86           HD3      LYS  86 -24.948 -18.284  -3.646
    9    HE2  LYS  86           HE2      LYS  86 -26.659 -19.099  -5.178
   10    HE3  LYS  86           HE3      LYS  86 -25.709 -18.535  -6.554
   11    HZ3  LYS  86           HZ1      LYS  86 -25.111 -20.745  -6.390
   12    HZ2  LYS  86           HZ2      LYS  86 -25.137 -20.747  -4.691
   13    HZ1  LYS  86           HZ3      LYS  86 -23.867 -19.985  -5.518

  No H/Q in entry =          13
  In of MODEL   19
    1    H    VAL  87           H        VAL  87 -22.973 -13.044  -4.424
    2    HA   VAL  87           HA       VAL  87 -22.667 -11.835  -6.341
    3    HB   VAL  87           HB       VAL  87 -21.652 -14.347  -7.709
    4   HG12  VAL  87          HG11      VAL  87 -20.368 -11.639  -7.787
    5   HG11  VAL  87          HG12      VAL  87 -21.850 -11.902  -8.706
    6   HG13  VAL  87          HG13      VAL  87 -20.423 -12.884  -9.034
    7   HG22  VAL  87          HG21      VAL  87 -20.565 -14.520  -5.625
    8   HG21  VAL  87          HG22      VAL  87 -20.284 -12.782  -5.541
    9   HG23  VAL  87          HG23      VAL  87 -19.405 -13.761  -6.715

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ASP  88           H        ASP  88 -25.192 -12.437  -5.982
    2    HA   ASP  88           HA       ASP  88 -26.356 -13.580  -8.395
    3    HB2  ASP  88           HB2      ASP  88 -27.336 -13.857  -6.067
    4    HB3  ASP  88           HB3      ASP  88 -27.758 -12.146  -6.127

  No H/Q in entry =           4
  In of MODEL   19
    1    H    GLY  89           H        GLY  89 -25.643 -12.301 -10.015
    2    HA3  GLY  89           HA2      GLY  89 -25.775  -9.521 -10.155
    3    HA2  GLY  89           HA3      GLY  89 -25.783 -10.612 -11.539

  No H/Q in entry =           3
  In of MODEL   19
    1    H    LEU  90           H        LEU  90 -28.251 -11.929 -11.098
    2    HA   LEU  90           HA       LEU  90 -30.035  -9.938 -12.153
    3    HB2  LEU  90           HB2      LEU  90 -30.149 -12.319 -12.783
    4    HB3  LEU  90           HB3      LEU  90 -30.647 -12.713 -11.138
    5    HG   LEU  90           HG       LEU  90 -32.748 -11.550 -11.457
    6   HD13  LEU  90          HD11      LEU  90 -32.550  -9.780 -12.897
    7   HD12  LEU  90          HD12      LEU  90 -33.122 -10.983 -14.055
    8   HD11  LEU  90          HD13      LEU  90 -31.401 -10.623 -13.938
    9   HD23  LEU  90          HD21      LEU  90 -32.730 -13.128 -13.928
   10   HD22  LEU  90          HD22      LEU  90 -33.699 -13.306 -12.465
   11   HD21  LEU  90          HD23      LEU  90 -32.057 -13.948 -12.519

  No H/Q in entry =          11
  In of MODEL   19
    1    H    GLY  91           H        GLY  91 -29.866 -11.510  -9.003
    2    HA3  GLY  91           HA2      GLY  91 -32.175 -10.379  -7.918
    3    HA2  GLY  91           HA3      GLY  91 -30.785 -10.957  -7.000

  No H/Q in entry =           3
  In of MODEL   19
    1    H    VAL  92           H        VAL  92 -28.841  -9.147  -7.836
    2    HA   VAL  92           HA       VAL  92 -29.577  -6.865  -6.230
    3    HB   VAL  92           HB       VAL  92 -27.054  -7.346  -7.860
    4   HG12  VAL  92          HG11      VAL  92 -27.163  -5.508  -5.492
    5   HG11  VAL  92          HG12      VAL  92 -27.833  -4.920  -7.015
    6   HG13  VAL  92          HG13      VAL  92 -26.144  -5.421  -6.929
    7   HG22  VAL  92          HG21      VAL  92 -26.845  -8.971  -6.303
    8   HG21  VAL  92          HG22      VAL  92 -27.966  -8.194  -5.183
    9   HG23  VAL  92          HG23      VAL  92 -26.303  -7.620  -5.307

  No H/Q in entry =           9
  In of MODEL   19
    1    H    LEU  93           H        LEU  93 -29.213  -7.460  -9.668
    2    HA   LEU  93           HA       LEU  93 -29.520  -4.800 -10.538
    3    HB2  LEU  93           HB2      LEU  93 -28.924  -6.634 -12.045
    4    HB3  LEU  93           HB3      LEU  93 -30.526  -7.338 -11.822
    5    HG   LEU  93           HG       LEU  93 -31.513  -5.334 -12.894
    6   HD11  LEU  93          HD11      LEU  93 -29.629  -3.782 -12.374
    7   HD13  LEU  93          HD12      LEU  93 -30.085  -3.768 -14.079
    8   HD12  LEU  93          HD13      LEU  93 -28.643  -4.639 -13.559
    9   HD23  LEU  93          HD21      LEU  93 -30.505  -5.870 -15.203
   10   HD22  LEU  93          HD22      LEU  93 -31.361  -7.131 -14.316
   11   HD21  LEU  93          HD23      LEU  93 -29.596  -7.106 -14.333

  No H/Q in entry =          11
  In of MODEL   19
    1    H    LYS  94           H        LYS  94 -31.932  -7.322  -9.720
    2    HA   LYS  94           HA       LYS  94 -34.256  -5.826 -10.291
    3    HB2  LYS  94           HB2      LYS  94 -33.762  -8.062  -8.332
    4    HB3  LYS  94           HB3      LYS  94 -35.350  -7.333  -8.569
    5    HG2  LYS  94           HG2      LYS  94 -35.299  -8.059 -10.920
    6    HG3  LYS  94           HG3      LYS  94 -33.749  -8.845 -10.623
    7    HD2  LYS  94           HD2      LYS  94 -34.875 -10.198  -8.816
    8    HD3  LYS  94           HD3      LYS  94 -36.411  -9.512  -9.343
    9    HE2  LYS  94           HE2      LYS  94 -35.934 -10.401 -11.633
   10    HE3  LYS  94           HE3      LYS  94 -34.527 -11.223 -10.960
   11    HZ3  LYS  94           HZ1      LYS  94 -36.405 -12.708 -11.145
   12    HZ2  LYS  94           HZ2      LYS  94 -37.352 -11.686 -10.172
   13    HZ1  LYS  94           HZ3      LYS  94 -35.999 -12.472  -9.513

  No H/Q in entry =          13
  In of MODEL   19
    1    H    ALA  95           H        ALA  95 -32.406  -6.044  -7.264
    2    HA   ALA  95           HA       ALA  95 -34.214  -4.464  -5.733
    3    HB2  ALA  95           HB1      ALA  95 -31.858  -5.892  -5.248
    4    HB3  ALA  95           HB2      ALA  95 -32.810  -4.995  -4.066
    5    HB1  ALA  95           HB3      ALA  95 -31.455  -4.214  -4.883

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA  96           H        ALA  96 -31.577  -3.612  -7.836
    2    HA   ALA  96           HA       ALA  96 -31.423  -0.870  -7.005
    3    HB2  ALA  96           HB1      ALA  96 -30.077  -0.623  -9.122
    4    HB3  ALA  96           HB2      ALA  96 -30.414  -2.318  -9.475
    5    HB1  ALA  96           HB3      ALA  96 -29.478  -1.885  -8.046

  No H/Q in entry =           5
  In of MODEL   19
    1    H    VAL  97           H        VAL  97 -33.011  -2.498  -9.712
    2    HA   VAL  97           HA       VAL  97 -34.049  -0.153 -10.909
    3    HB   VAL  97           HB       VAL  97 -34.914  -3.061 -11.006
    4   HG11  VAL  97          HG11      VAL  97 -36.672  -1.012 -11.430
    5   HG13  VAL  97          HG12      VAL  97 -36.769  -2.587 -12.220
    6   HG12  VAL  97          HG13      VAL  97 -35.998  -1.232 -13.046
    7   HG21  VAL  97          HG21      VAL  97 -33.620  -1.213 -13.013
    8   HG23  VAL  97          HG22      VAL  97 -34.107  -2.878 -13.334
    9   HG22  VAL  97          HG23      VAL  97 -32.840  -2.541 -12.153

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ALA  98           H        ALA  98 -35.250  -2.363  -8.407
    2    HA   ALA  98           HA       ALA  98 -37.785  -1.174  -8.007
    3    HB1  ALA  98           HB1      ALA  98 -36.804  -3.414  -7.032
    4    HB3  ALA  98           HB2      ALA  98 -37.958  -2.489  -6.069
    5    HB2  ALA  98           HB3      ALA  98 -36.231  -2.381  -5.724

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA  99           H        ALA  99 -34.675  -0.472  -6.373
    2    HA   ALA  99           HA       ALA  99 -35.749   1.497  -4.658
    3    HB1  ALA  99           HB1      ALA  99 -33.127   0.572  -5.450
    4    HB2  ALA  99           HB2      ALA  99 -33.647   1.299  -3.930
    5    HB3  ALA  99           HB3      ALA  99 -33.165   2.327  -5.279

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ILE 100           H        ILE 100 -34.738   1.682  -8.019
    2    HA   ILE 100           HA       ILE 100 -34.861   4.536  -8.174
    3    HB   ILE 100           HB       ILE 100 -35.021   2.433 -10.359
    4   HG12  ILE 100          HG12      ILE 100 -32.810   4.365  -9.665
    5   HG13  ILE 100          HG13      ILE 100 -32.875   2.706  -9.071
    6   HG21  ILE 100          HG21      ILE 100 -35.385   5.363 -10.421
    7   HG23  ILE 100          HG22      ILE 100 -35.927   4.130 -11.560
    8   HG22  ILE 100          HG23      ILE 100 -34.263   4.713 -11.617
    9   HD12  ILE 100          HD11      ILE 100 -32.349   3.714 -11.829
   10   HD11  ILE 100          HD12      ILE 100 -33.040   2.107 -11.603
   11   HD13  ILE 100          HD13      ILE 100 -31.478   2.502 -10.889

  No H/Q in entry =          11
  In of MODEL   19
    1    H    LYS 101           H        LYS 101 -37.215   1.991  -8.935
    2    HA   LYS 101           HA       LYS 101 -39.270   3.706  -9.877
    3    HB2  LYS 101           HB2      LYS 101 -39.201   0.904  -8.813
    4    HB3  LYS 101           HB3      LYS 101 -40.740   1.705  -9.126
    5    HG2  LYS 101           HG2      LYS 101 -40.285   1.882 -11.424
    6    HG3  LYS 101           HG3      LYS 101 -38.595   1.437 -11.196
    7    HD2  LYS 101           HD2      LYS 101 -39.894  -0.425 -12.112
    8    HD3  LYS 101           HD3      LYS 101 -39.258  -0.805 -10.510
    9    HE2  LYS 101           HE2      LYS 101 -41.330  -1.469  -9.999
   10    HE3  LYS 101           HE3      LYS 101 -41.751   0.245  -9.960
   11    HZ3  LYS 101           HZ1      LYS 101 -42.666   0.154 -12.072
   12    HZ2  LYS 101           HZ2      LYS 101 -43.150  -1.325 -11.393
   13    HZ1  LYS 101           HZ3      LYS 101 -41.854  -1.279 -12.488

  No H/Q in entry =          13
  In of MODEL   19
    1    H    LYS 102           H        LYS 102 -38.780   2.146  -6.708
    2    HA   LYS 102           HA       LYS 102 -40.991   3.359  -5.461
    3    HB2  LYS 102           HB2      LYS 102 -39.784   1.445  -4.500
    4    HB3  LYS 102           HB3      LYS 102 -38.369   2.466  -4.246
    5    HG2  LYS 102           HG2      LYS 102 -39.643   3.853  -2.706
    6    HG3  LYS 102           HG3      LYS 102 -41.061   2.836  -2.962
    7    HD2  LYS 102           HD2      LYS 102 -39.864   0.923  -1.990
    8    HD3  LYS 102           HD3      LYS 102 -38.447   1.941  -1.733
    9    HE2  LYS 102           HE2      LYS 102 -39.757   3.413  -0.277
   10    HE3  LYS 102           HE3      LYS 102 -41.191   2.427  -0.555
   11    HZ1  LYS 102           HZ1      LYS 102 -39.499   0.615   0.391
   12    HZ3  LYS 102           HZ2      LYS 102 -40.581   1.502   1.352
   13    HZ2  LYS 102           HZ3      LYS 102 -38.962   1.995   1.221

  No H/Q in entry =          13
  In of MODEL   19
    1    H    ALA 103           H        ALA 103 -38.017   4.712  -6.471
    2    HA   ALA 103           HA       ALA 103 -38.175   6.990  -4.634
    3    HB2  ALA 103           HB1      ALA 103 -36.184   7.719  -6.212
    4    HB3  ALA 103           HB2      ALA 103 -36.188   6.011  -6.650
    5    HB1  ALA 103           HB3      ALA 103 -35.935   6.491  -4.972

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA 104           H        ALA 104 -38.842   6.348  -7.990
    2    HA   ALA 104           HA       ALA 104 -39.375   9.159  -8.543
    3    HB2  ALA 104           HB1      ALA 104 -39.452   8.542 -10.759
    4    HB1  ALA 104           HB2      ALA 104 -40.208   6.988 -10.411
    5    HB3  ALA 104           HB3      ALA 104 -38.478   7.209 -10.141

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA 105           H        ALA 105 -41.011   7.046  -6.771
    2    HA   ALA 105           HA       ALA 105 -43.405   8.489  -6.690
    3    HB2  ALA 105           HB1      ALA 105 -44.186   7.692  -8.741
    4    HB3  ALA 105           HB2      ALA 105 -44.837   6.490  -7.626
    5    HB1  ALA 105           HB3      ALA 105 -43.383   6.133  -8.557

  No H/Q in entry =           5
  In of MODEL   20
    1    H1   ALA   1           H3       ALA   1 -12.044 -16.078  -2.272
    2    H2   ALA   1           H2       ALA   1 -11.090 -17.207  -3.116
    3    H3   ALA   1           H1       ALA   1 -12.253 -16.282  -3.944
    4    HA   ALA   1           HA       ALA   1 -13.624 -18.003  -3.694
    5    HB3  ALA   1           HB1      ALA   1 -12.199 -19.752  -3.237
    6    HB1  ALA   1           HB2      ALA   1 -12.948 -19.648  -1.643
    7    HB2  ALA   1           HB3      ALA   1 -11.385 -18.884  -1.934

  No H/Q in entry =           7
  In of MODEL   20
    1    H    GLU   2           H        GLU   2 -15.225 -18.879  -2.029
    2    HA   GLU   2           HA       GLU   2 -16.893 -17.181  -0.964
    3    HB2  GLU   2           HB2      GLU   2 -15.908 -19.590   0.580
    4    HB3  GLU   2           HB3      GLU   2 -17.443 -18.762   0.841
    5    HG2  GLU   2           HG2      GLU   2 -18.416 -19.867  -0.886
    6    HG3  GLU   2           HG3      GLU   2 -17.105 -19.448  -1.979

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLU   3           H        GLU   3 -14.945 -18.501   1.651
    2    HA   GLU   3           HA       GLU   3 -15.194 -16.148   3.205
    3    HB2  GLU   3           HB2      GLU   3 -13.569 -18.670   3.451
    4    HB3  GLU   3           HB3      GLU   3 -13.351 -17.345   4.595
    5    HG2  GLU   3           HG2      GLU   3 -15.537 -17.528   5.425
    6    HG3  GLU   3           HG3      GLU   3 -16.128 -18.339   3.981

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LEU   4           H        LEU   4 -12.225 -17.584   1.800
    2    HA   LEU   4           HA       LEU   4 -10.416 -15.652   2.385
    3    HB2  LEU   4           HB2      LEU   4 -10.642 -16.958  -0.336
    4    HB3  LEU   4           HB3      LEU   4  -9.198 -16.215   0.339
    5    HG   LEU   4           HG       LEU   4 -10.649 -18.632   1.465
    6   HD13  LEU   4          HD11      LEU   4  -9.002 -19.965   0.529
    7   HD12  LEU   4          HD12      LEU   4  -7.811 -18.664   0.493
    8   HD11  LEU   4          HD13      LEU   4  -9.106 -18.708  -0.703
    9   HD23  LEU   4          HD21      LEU   4  -8.390 -18.659   2.834
   10   HD22  LEU   4          HD22      LEU   4  -9.723 -17.639   3.368
   11   HD21  LEU   4          HD23      LEU   4  -8.376 -16.931   2.477

  No H/Q in entry =          11
  In of MODEL   20
    1    H    GLU   5           H        GLU   5 -12.768 -15.486  -0.277
    2    HA   GLU   5           HA       GLU   5 -11.808 -12.989  -1.287
    3    HB2  GLU   5           HB2      GLU   5 -13.147 -14.616  -2.625
    4    HB3  GLU   5           HB3      GLU   5 -14.547 -14.231  -1.622
    5    HG2  GLU   5           HG2      GLU   5 -14.694 -12.872  -3.606
    6    HG3  GLU   5           HG3      GLU   5 -14.242 -11.813  -2.272

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLU   6           H        GLU   6 -14.508 -13.904   0.821
    2    HA   GLU   6           HA       GLU   6 -15.451 -11.241   1.221
    3    HB2  GLU   6           HB2      GLU   6 -16.848 -13.247   1.631
    4    HB3  GLU   6           HB3      GLU   6 -15.799 -13.685   2.979
    5    HG2  GLU   6           HG2      GLU   6 -16.347 -11.583   4.118
    6    HG3  GLU   6           HG3      GLU   6 -17.354 -11.091   2.759

  No H/Q in entry =           6
  In of MODEL   20
    1    H    VAL   7           H        VAL   7 -13.104 -13.314   2.784
    2    HA   VAL   7           HA       VAL   7 -12.648 -11.728   5.105
    3    HB   VAL   7           HB       VAL   7 -10.922 -13.748   3.650
    4   HG11  VAL   7          HG11      VAL   7 -10.463 -12.204   6.209
    5   HG13  VAL   7          HG12      VAL   7  -9.367 -12.404   4.843
    6   HG12  VAL   7          HG13      VAL   7  -9.695 -13.764   5.917
    7   HG21  VAL   7          HG21      VAL   7 -13.158 -14.344   4.883
    8   HG23  VAL   7          HG22      VAL   7 -12.227 -14.053   6.353
    9   HG22  VAL   7          HG23      VAL   7 -11.721 -15.308   5.224

  No H/Q in entry =           9
  In of MODEL   20
    1    H    VAL   8           H        VAL   8 -11.153 -11.826   1.887
    2    HA   VAL   8           HA       VAL   8  -9.115  -9.921   2.366
    3    HB   VAL   8           HB       VAL   8 -10.582 -10.636  -0.184
    4   HG13  VAL   8          HG11      VAL   8  -9.664  -8.472  -0.560
    5   HG12  VAL   8          HG12      VAL   8  -8.477  -9.590  -1.229
    6   HG11  VAL   8          HG13      VAL   8  -8.199  -8.852   0.348
    7   HG23  VAL   8          HG21      VAL   8  -7.729 -11.369   0.216
    8   HG22  VAL   8          HG22      VAL   8  -9.054 -12.331  -0.433
    9   HG21  VAL   8          HG23      VAL   8  -8.849 -12.185   1.309

  No H/Q in entry =           9
  In of MODEL   20
    1    H    MET   9           H        MET   9 -12.472  -9.584   1.223
    2    HA   MET   9           HA       MET   9 -12.453  -6.807   0.783
    3    HB2  MET   9           HB2      MET   9 -14.633  -8.715   1.626
    4    HB3  MET   9           HB3      MET   9 -14.942  -6.990   1.410
    5    HG2  MET   9           HG2      MET   9 -14.038  -7.151  -0.906
    6    HG3  MET   9           HG3      MET   9 -13.844  -8.890  -0.681
    7    HE2  MET   9           HE1      MET   9 -16.739  -6.209  -1.907
    8    HE1  MET   9           HE2      MET   9 -15.901  -5.935  -0.382
    9    HE3  MET   9           HE3      MET   9 -17.596  -6.413  -0.373

  No H/Q in entry =           9
  In of MODEL   20
    1    H    GLY  10           H        GLY  10 -13.072  -8.703   3.717
    2    HA3  GLY  10           HA2      GLY  10 -13.644  -6.523   5.435
    3    HA2  GLY  10           HA3      GLY  10 -13.053  -8.102   5.949

  No H/Q in entry =           3
  In of MODEL   20
    1    H    LEU  11           H        LEU  11 -10.613  -8.192   4.621
    2    HA   LEU  11           HA       LEU  11  -8.925  -6.729   6.366
    3    HB2  LEU  11           HB2      LEU  11  -8.370  -8.149   3.759
    4    HB3  LEU  11           HB3      LEU  11  -7.106  -7.423   4.749
    5    HG   LEU  11           HG       LEU  11  -9.071  -9.485   5.780
    6   HD13  LEU  11          HD11      LEU  11  -7.839 -10.706   4.212
    7   HD12  LEU  11          HD12      LEU  11  -6.892 -10.927   5.682
    8   HD11  LEU  11          HD13      LEU  11  -6.376  -9.756   4.470
    9   HD22  LEU  11          HD21      LEU  11  -8.224  -8.455   7.690
   10   HD21  LEU  11          HD22      LEU  11  -6.696  -8.031   6.919
   11   HD23  LEU  11          HD23      LEU  11  -6.994  -9.691   7.433

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  12           H        ILE  12  -9.853  -6.202   2.980
    2    HA   ILE  12           HA       ILE  12  -8.199  -3.947   2.541
    3    HB   ILE  12           HB       ILE  12 -10.849  -4.658   1.260
    4   HG12  ILE  12          HG12      ILE  12  -8.790  -6.284   1.182
    5   HG13  ILE  12          HG13      ILE  12  -9.667  -5.946  -0.297
    6   HG22  ILE  12          HG21      ILE  12  -9.964  -3.260  -0.637
    7   HG21  ILE  12          HG22      ILE  12  -8.653  -2.736   0.413
    8   HG23  ILE  12          HG23      ILE  12 -10.305  -2.358   0.808
    9   HD11  ILE  12          HD11      ILE  12  -7.163  -4.485   0.584
   10   HD13  ILE  12          HD12      ILE  12  -7.972  -4.361  -0.977
   11   HD12  ILE  12          HD13      ILE  12  -7.168  -5.845  -0.524

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  13           H        ILE  13 -11.549  -4.265   3.652
    2    HA   ILE  13           HA       ILE  13 -12.052  -1.486   3.919
    3    HB   ILE  13           HB       ILE  13 -13.210  -3.920   5.296
    4   HG12  ILE  13          HG12      ILE  13 -13.455  -3.410   2.759
    5   HG13  ILE  13          HG13      ILE  13 -14.876  -3.867   3.673
    6   HG23  ILE  13          HG21      ILE  13 -13.679  -2.180   6.831
    7   HG22  ILE  13          HG22      ILE  13 -15.138  -2.289   5.855
    8   HG21  ILE  13          HG23      ILE  13 -13.972  -1.002   5.554
    9   HD13  ILE  13          HD11      ILE  13 -15.807  -1.758   3.559
   10   HD12  ILE  13          HD12      ILE  13 -14.859  -1.740   2.084
   11   HD11  ILE  13          HD13      ILE  13 -14.226  -0.968   3.520

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ASN  14           H        ASN  14 -10.889  -3.953   6.192
    2    HA   ASN  14           HA       ASN  14 -10.704  -2.307   8.474
    3    HB2  ASN  14           HB2      ASN  14 -10.410  -4.911   8.155
    4    HB3  ASN  14           HB3      ASN  14  -8.708  -4.496   7.989
    5   HD21  ASN  14          HD21      ASN  14  -9.308  -6.026  10.171
    6   HD22  ASN  14          HD22      ASN  14  -9.288  -5.103  11.593

  No H/Q in entry =           6
  In of MODEL   20
    1    H    SER  15           H        SER  15  -8.301  -3.096   5.971
    2    HA   SER  15           HA       SER  15  -6.177  -1.565   7.030
    3    HB2  SER  15           HB2      SER  15  -5.165  -1.767   4.866
    4    HB3  SER  15           HB3      SER  15  -6.092  -3.244   5.100
    5    HG   SER  15           HG       SER  15  -6.584  -1.054   3.439

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLY  16           H        GLY  16  -8.804  -0.747   4.794
    2    HA3  GLY  16           HA2      GLY  16  -7.994   1.907   4.233
    3    HA2  GLY  16           HA3      GLY  16  -9.635   1.283   4.080

  No H/Q in entry =           3
  In of MODEL   20
    1    H    GLN  17           H        GLN  17 -10.152   0.554   6.734
    2    HA   GLN  17           HA       GLN  17 -10.897   3.049   7.873
    3    HB2  GLN  17           HB2      GLN  17 -12.068   0.910   8.355
    4    HB3  GLN  17           HB3      GLN  17 -10.656   0.367   9.262
    5    HG2  GLN  17           HG2      GLN  17 -12.294   1.293  10.815
    6    HG3  GLN  17           HG3      GLN  17 -10.894   2.363  10.744
    7   HE21  GLN  17          HE21      GLN  17 -11.930   4.377  11.140
    8   HE22  GLN  17          HE22      GLN  17 -13.141   5.014  10.134

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ALA  18           H        ALA  18  -8.226   0.815   8.484
    2    HA   ALA  18           HA       ALA  18  -7.139   2.055  10.747
    3    HB2  ALA  18           HB1      ALA  18  -6.496  -0.152   9.381
    4    HB3  ALA  18           HB2      ALA  18  -5.342   0.653  10.444
    5    HB1  ALA  18           HB3      ALA  18  -5.279   0.929   8.702

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ARG  19           H        ARG  19  -6.394   2.585   7.293
    2    HA   ARG  19           HA       ARG  19  -4.530   4.667   7.708
    3    HB2  ARG  19           HB2      ARG  19  -4.848   3.516   5.517
    4    HB3  ARG  19           HB3      ARG  19  -6.406   4.328   5.346
    5    HG2  ARG  19           HG2      ARG  19  -5.317   6.520   5.404
    6    HG3  ARG  19           HG3      ARG  19  -3.752   5.763   5.702
    7    HD2  ARG  19           HD2      ARG  19  -3.900   6.346   3.358
    8    HD3  ARG  19           HD3      ARG  19  -3.952   4.585   3.508
    9    HE   ARG  19           HE       ARG  19  -6.602   5.446   3.512
   10   HH21  ARG  19          HH11      ARG  19  -7.809   5.576   1.599
   11   HH22  ARG  19          HH12      ARG  19  -6.996   5.666   0.075
   12   HH11  ARG  19          HH21      ARG  19  -3.838   5.556   1.464
   13   HH12  ARG  19          HH22      ARG  19  -4.746   5.651  -0.001

  No H/Q in entry =          13
  In of MODEL   20
    1    H    SER  20           H        SER  20  -8.033   4.717   7.125
    2    HA   SER  20           HA       SER  20  -8.441   7.465   7.072
    3    HB2  SER  20           HB2      SER  20 -10.295   6.087   6.548
    4    HB3  SER  20           HB3      SER  20 -10.164   5.202   8.065
    5    HG   SER  20           HG       SER  20 -10.717   7.158   9.135

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU  21           H        LEU  21  -8.387   5.289   9.881
    2    HA   LEU  21           HA       LEU  21  -8.855   7.281  11.844
    3    HB2  LEU  21           HB2      LEU  21  -7.454   4.605  12.002
    4    HB3  LEU  21           HB3      LEU  21  -7.770   5.620  13.406
    5    HG   LEU  21           HG       LEU  21  -9.939   4.683  11.504
    6   HD13  LEU  21          HD11      LEU  21  -9.175   2.674  12.463
    7   HD12  LEU  21          HD12      LEU  21 -10.479   3.164  13.544
    8   HD11  LEU  21          HD13      LEU  21  -8.799   3.446  14.005
    9   HD22  LEU  21          HD21      LEU  21 -10.869   6.484  12.666
   10   HD21  LEU  21          HD22      LEU  21  -9.888   6.214  14.103
   11   HD23  LEU  21          HD23      LEU  21 -11.259   5.166  13.769

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ALA  22           H        ALA  22  -5.885   5.961  10.425
    2    HA   ALA  22           HA       ALA  22  -4.023   7.313  12.035
    3    HB2  ALA  22           HB1      ALA  22  -3.579   5.464  10.346
    4    HB1  ALA  22           HB2      ALA  22  -2.408   6.782  10.373
    5    HB3  ALA  22           HB3      ALA  22  -3.631   6.713   9.103

  No H/Q in entry =           5
  In of MODEL   20
    1    H    TYR  23           H        TYR  23  -5.374   8.298   8.857
    2    HA   TYR  23           HA       TYR  23  -4.086  10.819   8.775
    3    HB2  TYR  23           HB2      TYR  23  -5.160   9.878   6.791
    4    HB3  TYR  23           HB3      TYR  23  -6.736   9.964   7.579
    5    HD1  TYR  23           HD1      TYR  23  -3.872  12.046   6.402
    6    HD2  TYR  23           HD2      TYR  23  -8.006  11.956   7.562
    7    HE1  TYR  23           HE1      TYR  23  -4.137  14.388   5.633
    8    HE2  TYR  23           HE2      TYR  23  -8.273  14.300   6.793
    9    HH   TYR  23           HH       TYR  23  -5.514  16.112   5.440

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ALA  24           H        ALA  24  -7.180   9.785  10.171
    2    HA   ALA  24           HA       ALA  24  -8.062  12.360  10.940
    3    HB1  ALA  24           HB1      ALA  24  -9.854  11.075  11.419
    4    HB2  ALA  24           HB2      ALA  24  -9.011  10.523  12.864
    5    HB3  ALA  24           HB3      ALA  24  -8.875   9.610  11.362

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA  25           H        ALA  25  -6.006   9.944  12.510
    2    HA   ALA  25           HA       ALA  25  -5.681  11.209  15.008
    3    HB2  ALA  25           HB1      ALA  25  -4.873   8.870  14.189
    4    HB3  ALA  25           HB2      ALA  25  -3.869   9.750  15.343
    5    HB1  ALA  25           HB3      ALA  25  -3.440   9.738  13.632

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU  26           H        LEU  26  -3.910  11.535  11.959
    2    HA   LEU  26           HA       LEU  26  -1.982  13.394  12.862
    3    HB2  LEU  26           HB2      LEU  26  -1.669  12.243  10.759
    4    HB3  LEU  26           HB3      LEU  26  -3.158  12.922  10.109
    5    HG   LEU  26           HG       LEU  26  -2.186  15.191  10.235
    6   HD12  LEU  26          HD11      LEU  26   0.354  15.260  10.637
    7   HD11  LEU  26          HD12      LEU  26   0.164  13.677  11.386
    8   HD13  LEU  26          HD13      LEU  26  -0.668  15.078  12.063
    9   HD21  LEU  26          HD21      LEU  26  -0.411  13.167   8.837
   10   HD23  LEU  26          HD22      LEU  26  -0.488  14.886   8.463
   11   HD22  LEU  26          HD23      LEU  26  -1.893  13.861   8.183

  No H/Q in entry =          11
  In of MODEL   20
    1    H    LYS  27           H        LYS  27  -5.180  13.813  11.398
    2    HA   LYS  27           HA       LYS  27  -5.178  16.602  11.193
    3    HB2  LYS  27           HB2      LYS  27  -6.898  15.089  10.219
    4    HB3  LYS  27           HB3      LYS  27  -7.543  14.824  11.838
    5    HG2  LYS  27           HG2      LYS  27  -8.016  17.223  12.071
    6    HG3  LYS  27           HG3      LYS  27  -7.321  17.529  10.476
    7    HD2  LYS  27           HD2      LYS  27  -9.031  16.060   9.451
    8    HD3  LYS  27           HD3      LYS  27  -9.733  15.771  11.045
    9    HE2  LYS  27           HE2      LYS  27 -10.219  18.174  11.285
   10    HE3  LYS  27           HE3      LYS  27  -9.490  18.485   9.706
   11    HZ3  LYS  27           HZ1      LYS  27 -11.866  18.316   9.475
   12    HZ2  LYS  27           HZ2      LYS  27 -11.882  16.800  10.248
   13    HZ1  LYS  27           HZ3      LYS  27 -11.147  16.974   8.723

  No H/Q in entry =          13
  In of MODEL   20
    1    H    GLN  28           H        GLN  28  -6.015  14.506  13.929
    2    HA   GLN  28           HA       GLN  28  -6.939  16.497  15.705
    3    HB2  GLN  28           HB2      GLN  28  -5.488  13.893  16.246
    4    HB3  GLN  28           HB3      GLN  28  -6.239  14.886  17.495
    5    HG2  GLN  28           HG2      GLN  28  -7.692  13.732  15.098
    6    HG3  GLN  28           HG3      GLN  28  -7.732  13.051  16.724
    7   HE21  GLN  28          HE21      GLN  28  -9.606  14.860  14.735
    8   HE22  GLN  28          HE22      GLN  28 -10.382  15.852  15.873

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ALA  29           H        ALA  29  -3.701  15.257  15.003
    2    HA   ALA  29           HA       ALA  29  -2.278  16.685  16.971
    3    HB1  ALA  29           HB1      ALA  29  -0.341  16.025  15.845
    4    HB3  ALA  29           HB2      ALA  29  -1.105  16.132  14.259
    5    HB2  ALA  29           HB3      ALA  29  -1.499  14.795  15.339

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LYS  30           H        LYS  30  -3.167  17.541  13.644
    2    HA   LYS  30           HA       LYS  30  -1.798  20.004  13.531
    3    HB2  LYS  30           HB2      LYS  30  -4.321  19.086  12.137
    4    HB3  LYS  30           HB3      LYS  30  -3.513  20.613  11.786
    5    HG2  LYS  30           HG2      LYS  30  -1.426  19.353  11.265
    6    HG3  LYS  30           HG3      LYS  30  -2.307  17.843  11.518
    7    HD2  LYS  30           HD2      LYS  30  -3.889  18.454   9.729
    8    HD3  LYS  30           HD3      LYS  30  -3.031  19.976   9.479
    9    HE2  LYS  30           HE2      LYS  30  -0.982  18.714   8.892
   10    HE3  LYS  30           HE3      LYS  30  -1.859  17.197   9.112
   11    HZ2  LYS  30           HZ1      LYS  30  -1.708  18.066   6.767
   12    HZ1  LYS  30           HZ2      LYS  30  -2.769  19.313   7.238
   13    HZ3  LYS  30           HZ3      LYS  30  -3.267  17.688   7.315

  No H/Q in entry =          13
  In of MODEL   20
    1    H    GLN  31           H        GLN  31  -4.878  19.108  14.961
    2    HA   GLN  31           HA       GLN  31  -5.680  21.853  15.411
    3    HB2  GLN  31           HB2      GLN  31  -6.816  19.392  16.744
    4    HB3  GLN  31           HB3      GLN  31  -7.601  20.952  16.499
    5    HG2  GLN  31           HG2      GLN  31  -6.892  20.180  13.908
    6    HG3  GLN  31           HG3      GLN  31  -7.390  18.670  14.661
    7   HE21  GLN  31          HE21      GLN  31  -8.834  20.218  12.563
    8   HE22  GLN  31          HE22      GLN  31 -10.350  20.589  13.227

  No H/Q in entry =           8
  In of MODEL   20
    1    H    GLY  32           H        GLY  32  -3.334  19.963  16.723
    2    HA3  GLY  32           HA2      GLY  32  -1.931  20.449  18.517
    3    HA2  GLY  32           HA3      GLY  32  -3.075  21.676  19.044

  No H/Q in entry =           3
  In of MODEL   20
    1    H    ASP  33           H        ASP  33  -4.457  18.615  18.396
    2    HA   ASP  33           HA       ASP  33  -4.846  18.157  21.278
    3    HB2  ASP  33           HB2      ASP  33  -6.250  17.121  18.810
    4    HB3  ASP  33           HB3      ASP  33  -6.579  16.509  20.429

  No H/Q in entry =           4
  In of MODEL   20
    1    H    PHE  34           H        PHE  34  -2.664  17.338  21.574
    2    HA   PHE  34           HA       PHE  34  -1.639  15.101  20.172
    3    HB2  PHE  34           HB2      PHE  34  -1.022  16.100  22.962
    4    HB3  PHE  34           HB3      PHE  34  -0.080  14.888  22.092
    5    HD1  PHE  34           HD1      PHE  34  -0.298  18.313  22.822
    6    HD2  PHE  34           HD2      PHE  34   0.555  15.616  19.587
    7    HE1  PHE  34           HE1      PHE  34   0.966  20.100  21.658
    8    HE2  PHE  34           HE2      PHE  34   1.814  17.406  18.429
    9    HZ   PHE  34           HZ       PHE  34   2.022  19.645  19.468

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ALA  35           H        ALA  35  -3.668  15.354  23.045
    2    HA   ALA  35           HA       ALA  35  -3.413  12.697  23.945
    3    HB3  ALA  35           HB1      ALA  35  -5.875  13.290  24.814
    4    HB1  ALA  35           HB2      ALA  35  -5.367  14.915  24.353
    5    HB2  ALA  35           HB3      ALA  35  -4.434  14.006  25.541

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA  36           H        ALA  36  -5.895  14.175  21.856
    2    HA   ALA  36           HA       ALA  36  -7.279  11.743  21.389
    3    HB1  ALA  36           HB1      ALA  36  -8.759  13.143  20.438
    4    HB3  ALA  36           HB2      ALA  36  -7.599  13.578  19.183
    5    HB2  ALA  36           HB3      ALA  36  -7.629  14.468  20.705

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA  37           H        ALA  37  -4.630  13.365  19.704
    2    HA   ALA  37           HA       ALA  37  -4.583  11.727  17.410
    3    HB3  ALA  37           HB1      ALA  37  -2.608  13.469  18.819
    4    HB2  ALA  37           HB2      ALA  37  -3.148  13.514  17.142
    5    HB1  ALA  37           HB3      ALA  37  -1.974  12.302  17.659

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LYS  38           H        LYS  38  -2.806  11.451  20.479
    2    HA   LYS  38           HA       LYS  38  -1.449   9.069  19.987
    3    HB2  LYS  38           HB2      LYS  38  -1.786  10.831  22.131
    4    HB3  LYS  38           HB3      LYS  38  -2.380   9.294  22.753
    5    HG2  LYS  38           HG2      LYS  38  -0.273   8.202  22.208
    6    HG3  LYS  38           HG3      LYS  38   0.311   9.654  21.388
    7    HD2  LYS  38           HD2      LYS  38   0.473  10.879  23.421
    8    HD3  LYS  38           HD3      LYS  38  -0.525   9.715  24.295
    9    HE2  LYS  38           HE2      LYS  38   1.838   9.434  24.902
   10    HE3  LYS  38           HE3      LYS  38   1.249   8.008  24.044
   11    HZ3  LYS  38           HZ1      LYS  38   2.534   8.442  22.255
   12    HZ2  LYS  38           HZ2      LYS  38   3.483   9.286  23.385
   13    HZ1  LYS  38           HZ3      LYS  38   2.387  10.129  22.398

  No H/Q in entry =          13
  In of MODEL   20
    1    H    ALA  39           H        ALA  39  -4.687   9.520  21.406
    2    HA   ALA  39           HA       ALA  39  -5.206   6.794  21.917
    3    HB3  ALA  39           HB1      ALA  39  -7.396   8.706  21.158
    4    HB2  ALA  39           HB2      ALA  39  -6.494   8.949  22.654
    5    HB1  ALA  39           HB3      ALA  39  -7.391   7.451  22.398

  No H/Q in entry =           5
  In of MODEL   20
    1    H    MET  40           H        MET  40  -5.834   8.794  19.070
    2    HA   MET  40           HA       MET  40  -7.290   6.838  17.621
    3    HB2  MET  40           HB2      MET  40  -5.720   9.255  16.704
    4    HB3  MET  40           HB3      MET  40  -6.737   8.280  15.641
    5    HG2  MET  40           HG2      MET  40  -7.777   9.517  18.202
    6    HG3  MET  40           HG3      MET  40  -7.854  10.349  16.651
    7    HE3  MET  40           HE1      MET  40 -10.424   8.689  14.602
    8    HE2  MET  40           HE2      MET  40  -8.674   8.831  14.445
    9    HE1  MET  40           HE3      MET  40  -9.608  10.184  15.081

  No H/Q in entry =           9
  In of MODEL   20
    1    H    MET  41           H        MET  41  -3.810   7.627  17.724
    2    HA   MET  41           HA       MET  41  -3.036   5.880  15.623
    3    HB2  MET  41           HB2      MET  41  -1.417   6.574  18.086
    4    HB3  MET  41           HB3      MET  41  -0.798   5.933  16.568
    5    HG2  MET  41           HG2      MET  41  -1.992   8.097  15.567
    6    HG3  MET  41           HG3      MET  41  -1.756   8.691  17.209
    7    HE2  MET  41           HE1      MET  41   1.195   6.636  17.559
    8    HE1  MET  41           HE2      MET  41   0.392   7.920  18.460
    9    HE3  MET  41           HE3      MET  41   2.008   8.186  17.808

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ASP  42           H        ASP  42  -3.396   5.407  19.111
    2    HA   ASP  42           HA       ASP  42  -2.321   2.829  19.270
    3    HB2  ASP  42           HB2      ASP  42  -3.212   4.578  21.094
    4    HB3  ASP  42           HB3      ASP  42  -4.624   3.531  21.031

  No H/Q in entry =           4
  In of MODEL   20
    1    H    GLN  43           H        GLN  43  -5.673   3.882  18.785
    2    HA   GLN  43           HA       GLN  43  -6.779   1.277  18.600
    3    HB2  GLN  43           HB2      GLN  43  -7.747   3.913  17.472
    4    HB3  GLN  43           HB3      GLN  43  -8.688   2.420  17.457
    5    HG2  GLN  43           HG2      GLN  43  -8.380   2.307  19.963
    6    HG3  GLN  43           HG3      GLN  43  -7.680   3.923  19.885
    7   HE21  GLN  43          HE21      GLN  43  -9.853   3.972  21.397
    8   HE22  GLN  43          HE22      GLN  43 -11.226   4.526  20.571

  No H/Q in entry =           8
  In of MODEL   20
    1    H    SER  44           H        SER  44  -5.484   3.507  16.178
    2    HA   SER  44           HA       SER  44  -6.174   2.009  13.895
    3    HB2  SER  44           HB2      SER  44  -4.952   4.412  14.329
    4    HB3  SER  44           HB3      SER  44  -3.585   3.436  13.793
    5    HG   SER  44           HG       SER  44  -4.721   4.388  12.034

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ARG  45           H        ARG  45  -3.285   1.943  15.961
    2    HA   ARG  45           HA       ARG  45  -1.782   0.009  14.574
    3    HB2  ARG  45           HB2      ARG  45  -0.953   1.446  16.437
    4    HB3  ARG  45           HB3      ARG  45  -1.925   0.502  17.563
    5    HG2  ARG  45           HG2      ARG  45  -0.665  -1.539  16.918
    6    HG3  ARG  45           HG3      ARG  45   0.330  -0.570  15.833
    7    HD2  ARG  45           HD2      ARG  45   1.054   0.824  17.783
    8    HD3  ARG  45           HD3      ARG  45   0.153  -0.263  18.863
    9    HE   ARG  45           HE       ARG  45   1.868  -1.835  17.276
   10   HH21  ARG  45          HH11      ARG  45   3.785  -2.628  18.105
   11   HH22  ARG  45          HH12      ARG  45   4.552  -1.829  19.432
   12   HH11  ARG  45          HH21      ARG  45   2.146   0.639  19.661
   13   HH12  ARG  45          HH22      ARG  45   3.624   0.024  20.310

  No H/Q in entry =          13
  In of MODEL   20
    1    H    MET  46           H        MET  46  -4.162  -0.344  17.187
    2    HA   MET  46           HA       MET  46  -3.951  -3.140  17.496
    3    HB2  MET  46           HB2      MET  46  -6.112  -1.141  18.126
    4    HB3  MET  46           HB3      MET  46  -6.356  -2.865  18.418
    5    HG2  MET  46           HG2      MET  46  -4.566  -2.971  19.968
    6    HG3  MET  46           HG3      MET  46  -3.905  -1.430  19.440
    7    HE2  MET  46           HE1      MET  46  -8.099  -1.648  21.303
    8    HE1  MET  46           HE2      MET  46  -7.289  -2.947  20.434
    9    HE3  MET  46           HE3      MET  46  -7.775  -1.490  19.573

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ALA  47           H        ALA  47  -6.011  -1.156  15.409
    2    HA   ALA  47           HA       ALA  47  -7.603  -3.231  14.354
    3    HB3  ALA  47           HB1      ALA  47  -8.318  -1.005  13.938
    4    HB1  ALA  47           HB2      ALA  47  -7.827  -1.633  12.365
    5    HB2  ALA  47           HB3      ALA  47  -6.758  -0.548  13.255

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU  48           H        LEU  48  -4.509  -1.880  13.286
    2    HA   LEU  48           HA       LEU  48  -4.216  -3.469  10.946
    3    HB2  LEU  48           HB2      LEU  48  -2.169  -2.159  12.743
    4    HB3  LEU  48           HB3      LEU  48  -1.797  -2.877  11.175
    5    HG   LEU  48           HG       LEU  48  -3.849  -0.687  11.571
    6   HD13  LEU  48          HD11      LEU  48  -1.737   0.219  12.226
    7   HD12  LEU  48          HD12      LEU  48  -2.027   0.767  10.574
    8   HD11  LEU  48          HD13      LEU  48  -0.910  -0.564  10.879
    9   HD22  LEU  48          HD21      LEU  48  -4.317  -1.681   9.499
   10   HD21  LEU  48          HD22      LEU  48  -2.629  -2.093   9.196
   11   HD23  LEU  48          HD23      LEU  48  -3.172  -0.421   9.037

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ASN  49           H        ASN  49  -3.150  -3.847  14.287
    2    HA   ASN  49           HA       ASN  49  -1.518  -6.088  13.952
    3    HB2  ASN  49           HB2      ASN  49  -1.531  -4.772  16.000
    4    HB3  ASN  49           HB3      ASN  49  -3.196  -5.229  16.325
    5   HD21  ASN  49          HD21      ASN  49   0.051  -6.684  15.893
    6   HD22  ASN  49          HD22      ASN  49  -0.223  -7.977  16.958

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLU  50           H        GLU  50  -4.987  -5.859  14.640
    2    HA   GLU  50           HA       GLU  50  -5.462  -8.664  14.754
    3    HB2  GLU  50           HB2      GLU  50  -7.066  -6.997  15.635
    4    HB3  GLU  50           HB3      GLU  50  -7.374  -6.439  13.989
    5    HG2  GLU  50           HG2      GLU  50  -8.213  -8.647  13.358
    6    HG3  GLU  50           HG3      GLU  50  -7.816  -9.283  14.950

  No H/Q in entry =           6
  In of MODEL   20
    1    H    ALA  51           H        ALA  51  -5.573  -6.271  12.156
    2    HA   ALA  51           HA       ALA  51  -6.545  -8.013  10.140
    3    HB2  ALA  51           HB1      ALA  51  -6.355  -6.200   8.768
    4    HB1  ALA  51           HB2      ALA  51  -4.717  -5.829   9.308
    5    HB3  ALA  51           HB3      ALA  51  -6.103  -5.334  10.283

  No H/Q in entry =           5
  In of MODEL   20
    1    H    HIS  52           H        HIS  52  -3.262  -7.064  11.108
    2    HA   HIS  52           HA       HIS  52  -1.853  -8.538   9.154
    3    HB2  HIS  52           HB2      HIS  52  -0.809  -6.801  10.554
    4    HB3  HIS  52           HB3      HIS  52  -1.006  -7.828  11.973
    5    HD1  HIS  52           HD1      HIS  52   0.309 -10.180  11.893
    6    HD2  HIS  52           HD2      HIS  52   1.465  -7.364   9.044
    7    HE1  HIS  52           HE1      HIS  52   2.552 -10.943  10.999
    8    HE2  HIS  52           HE2      HIS  52   3.270  -9.237   9.261

  No H/Q in entry =           8
  In of MODEL   20
    1    H    LEU  53           H        LEU  53  -3.040  -9.426  12.373
    2    HA   LEU  53           HA       LEU  53  -1.811 -11.956  12.564
    3    HB2  LEU  53           HB2      LEU  53  -4.303 -10.801  13.789
    4    HB3  LEU  53           HB3      LEU  53  -3.827 -12.472  14.079
    5    HG   LEU  53           HG       LEU  53  -1.936 -10.143  14.540
    6   HD12  LEU  53          HD11      LEU  53  -2.527 -10.414  16.958
    7   HD11  LEU  53          HD12      LEU  53  -3.833 -11.495  16.478
    8   HD13  LEU  53          HD13      LEU  53  -3.864  -9.806  15.987
    9   HD21  LEU  53          HD21      LEU  53  -1.970 -13.074  15.289
   10   HD23  LEU  53          HD22      LEU  53  -1.032 -11.915  16.224
   11   HD22  LEU  53          HD23      LEU  53  -0.670 -12.165  14.527

  No H/Q in entry =          11
  In of MODEL   20
    1    H    VAL  54           H        VAL  54  -4.940 -10.965  11.214
    2    HA   VAL  54           HA       VAL  54  -5.827 -13.570  10.534
    3    HB   VAL  54           HB       VAL  54  -6.510 -10.846   9.400
    4   HG12  VAL  54          HG11      VAL  54  -8.600 -12.249   8.599
    5   HG11  VAL  54          HG12      VAL  54  -7.472 -13.602   8.667
    6   HG13  VAL  54          HG13      VAL  54  -7.133 -12.224   7.622
    7   HG22  VAL  54          HG21      VAL  54  -7.407 -10.892  11.555
    8   HG21  VAL  54          HG22      VAL  54  -7.641 -12.638  11.539
    9   HG23  VAL  54          HG23      VAL  54  -8.738 -11.594  10.636

  No H/Q in entry =           9
  In of MODEL   20
    1    H    GLN  55           H        GLN  55  -3.991 -11.100   8.734
    2    HA   GLN  55           HA       GLN  55  -3.855 -12.565   6.318
    3    HB2  GLN  55           HB2      GLN  55  -3.278 -10.294   6.122
    4    HB3  GLN  55           HB3      GLN  55  -2.160 -10.357   7.483
    5    HG2  GLN  55           HG2      GLN  55  -0.439 -11.185   6.200
    6    HG3  GLN  55           HG3      GLN  55  -1.506 -12.173   5.212
    7   HE21  GLN  55          HE21      GLN  55  -1.540 -11.486   3.090
    8   HE22  GLN  55          HE22      GLN  55  -1.362  -9.880   2.577

  No H/Q in entry =           8
  In of MODEL   20
    1    H    THR  56           H        THR  56  -1.737 -12.517   9.189
    2    HA   THR  56           HA       THR  56   0.355 -14.094   8.264
    3    HB   THR  56           HB       THR  56  -0.930 -14.134  11.009
    4    HG1  THR  56           HG1      THR  56   1.237 -12.693   9.887
    5   HG22  THR  56          HG21      THR  56   1.298 -14.976  11.742
    6   HG21  THR  56          HG22      THR  56   1.769 -15.117  10.049
    7   HG23  THR  56          HG23      THR  56   0.458 -16.109  10.686

  No H/Q in entry =           7
  In of MODEL   20
    1    H    LYS  57           H        LYS  57  -2.748 -15.163   9.642
    2    HA   LYS  57           HA       LYS  57  -2.273 -17.954   9.398
    3    HB2  LYS  57           HB2      LYS  57  -4.095 -16.889  10.752
    4    HB3  LYS  57           HB3      LYS  57  -4.897 -16.436   9.255
    5    HG2  LYS  57           HG2      LYS  57  -5.124 -18.797   8.632
    6    HG3  LYS  57           HG3      LYS  57  -4.276 -19.281  10.099
    7    HD2  LYS  57           HD2      LYS  57  -6.070 -18.261  11.468
    8    HD3  LYS  57           HD3      LYS  57  -6.927 -17.801   9.998
    9    HE2  LYS  57           HE2      LYS  57  -7.103 -20.187   9.355
   10    HE3  LYS  57           HE3      LYS  57  -6.257 -20.656  10.828
   11    HZ2  LYS  57           HZ1      LYS  57  -8.871 -20.561  10.689
   12    HZ1  LYS  57           HZ2      LYS  57  -8.599 -18.936  11.105
   13    HZ3  LYS  57           HZ3      LYS  57  -8.036 -20.178  12.116

  No H/Q in entry =          13
  In of MODEL   20
    1    H    LEU  58           H        LEU  58  -3.640 -15.529   7.225
    2    HA   LEU  58           HA       LEU  58  -4.431 -17.365   5.224
    3    HB2  LEU  58           HB2      LEU  58  -3.857 -14.410   5.083
    4    HB3  LEU  58           HB3      LEU  58  -4.516 -15.355   3.747
    5    HG   LEU  58           HG       LEU  58  -5.786 -15.186   6.500
    6   HD11  LEU  58          HD11      LEU  58  -6.114 -13.546   4.008
    7   HD13  LEU  58          HD12      LEU  58  -6.102 -13.036   5.696
    8   HD12  LEU  58          HD13      LEU  58  -7.519 -13.845   5.031
    9   HD22  LEU  58          HD21      LEU  58  -6.732 -17.107   5.637
   10   HD21  LEU  58          HD22      LEU  58  -6.404 -16.653   3.964
   11   HD23  LEU  58          HD23      LEU  58  -7.771 -15.941   4.820

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  59           H        ILE  59  -1.305 -16.119   6.071
    2    HA   ILE  59           HA       ILE  59  -0.211 -16.839   3.430
    3    HB   ILE  59           HB       ILE  59   0.542 -14.765   4.999
    4   HG12  ILE  59          HG12      ILE  59   2.635 -16.391   3.540
    5   HG13  ILE  59          HG13      ILE  59   1.427 -15.450   2.703
    6   HG22  ILE  59          HG21      ILE  59   2.660 -16.787   5.675
    7   HG21  ILE  59          HG22      ILE  59   1.308 -16.540   6.756
    8   HG23  ILE  59          HG23      ILE  59   2.401 -15.208   6.379
    9   HD12  ILE  59          HD11      ILE  59   3.447 -14.394   4.681
   10   HD11  ILE  59          HD12      ILE  59   2.171 -13.422   3.950
   11   HD13  ILE  59          HD13      ILE  59   3.447 -14.108   2.942

  No H/Q in entry =          11
  In of MODEL   20
    1    H    GLU  60           H        GLU  60  -0.196 -17.940   6.799
    2    HA   GLU  60           HA       GLU  60   1.855 -19.897   6.529
    3    HB2  GLU  60           HB2      GLU  60   1.111 -19.133   8.723
    4    HB3  GLU  60           HB3      GLU  60  -0.504 -19.771   8.425
    5    HG2  GLU  60           HG2      GLU  60   1.893 -21.588   8.257
    6    HG3  GLU  60           HG3      GLU  60   1.176 -21.205   9.822

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLY  61           H        GLY  61  -1.657 -20.033   6.057
    2    HA3  GLY  61           HA2      GLY  61  -1.383 -22.824   5.102
    3    HA2  GLY  61           HA3      GLY  61  -2.874 -22.103   5.700

  No H/Q in entry =           3
  In of MODEL   20
    1    H    ASP  62           H        ASP  62  -0.671 -20.501   3.487
    2    HA   ASP  62           HA       ASP  62  -2.764 -19.958   1.621
    3    HB2  ASP  62           HB2      ASP  62  -0.961 -18.888   0.318
    4    HB3  ASP  62           HB3      ASP  62  -0.934 -18.386   2.005

  No H/Q in entry =           4
  In of MODEL   20
    1    H    ALA  63           H        ALA  63  -2.826 -22.684   1.729
    2    HA   ALA  63           HA       ALA  63  -1.184 -24.053  -0.146
    3    HB3  ALA  63           HB1      ALA  63  -2.669 -25.857   0.073
    4    HB2  ALA  63           HB2      ALA  63  -4.026 -24.802   0.471
    5    HB1  ALA  63           HB3      ALA  63  -2.726 -25.047   1.640

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLY  64           H        GLY  64  -4.285 -22.372  -0.402
    2    HA3  GLY  64           HA2      GLY  64  -5.535 -21.675  -2.193
    3    HA2  GLY  64           HA3      GLY  64  -4.007 -21.540  -3.049

  No H/Q in entry =           3
  In of MODEL   20
    1    H    GLU  65           H        GLU  65  -4.312 -22.471  -5.007
    2    HA   GLU  65           HA       GLU  65  -6.194 -24.473  -5.551
    3    HB2  GLU  65           HB2      GLU  65  -3.719 -23.641  -7.062
    4    HB3  GLU  65           HB3      GLU  65  -4.910 -24.783  -7.686
    5    HG2  GLU  65           HG2      GLU  65  -6.674 -23.104  -7.500
    6    HG3  GLU  65           HG3      GLU  65  -5.544 -21.963  -6.775

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLY  66           H        GLY  66  -5.122 -26.390  -7.000
    2    HA3  GLY  66           HA2      GLY  66  -4.439 -28.419  -5.182
    3    HA2  GLY  66           HA3      GLY  66  -4.376 -28.537  -6.930

  No H/Q in entry =           3
  In of MODEL   20
    1    H    LYS  67           H        LYS  67  -2.442 -26.434  -7.261
    2    HA   LYS  67           HA       LYS  67  -0.061 -28.000  -6.819
    3    HB2  LYS  67           HB2      LYS  67  -0.593 -25.431  -8.301
    4    HB3  LYS  67           HB3      LYS  67   0.998 -26.196  -8.212
    5    HG2  LYS  67           HG2      LYS  67   0.056 -28.280  -9.138
    6    HG3  LYS  67           HG3      LYS  67  -1.534 -27.524  -9.229
    7    HD2  LYS  67           HD2      LYS  67  -0.698 -25.879 -10.832
    8    HD3  LYS  67           HD3      LYS  67   0.933 -26.542 -10.693
    9    HE2  LYS  67           HE2      LYS  67  -0.147 -27.453 -12.693
   10    HE3  LYS  67           HE3      LYS  67   0.083 -28.736 -11.506
   11    HZ1  LYS  67           HZ1      LYS  67  -2.415 -27.294 -11.290
   12    HZ3  LYS  67           HZ2      LYS  67  -2.108 -28.962 -11.197
   13    HZ2  LYS  67           HZ3      LYS  67  -2.241 -28.203 -12.711

  No H/Q in entry =          13
  In of MODEL   20
    1    H    MET  68           H        MET  68   1.980 -26.460  -6.569
    2    HA   MET  68           HA       MET  68   2.153 -25.869  -3.808
    3    HB2  MET  68           HB2      MET  68   4.013 -25.346  -6.122
    4    HB3  MET  68           HB3      MET  68   4.438 -25.031  -4.440
    5    HG2  MET  68           HG2      MET  68   4.065 -27.374  -3.868
    6    HG3  MET  68           HG3      MET  68   3.527 -27.717  -5.514
    7    HE1  MET  68           HE1      MET  68   6.091 -26.550  -3.174
    8    HE3  MET  68           HE2      MET  68   6.734 -25.404  -4.349
    9    HE2  MET  68           HE3      MET  68   7.677 -26.826  -3.908

  No H/Q in entry =           9
  In of MODEL   20
    1    H    LYS  69           H        LYS  69   0.915 -23.947  -6.288
    2    HA   LYS  69           HA       LYS  69   1.916 -21.413  -5.631
    3    HB2  LYS  69           HB2      LYS  69  -0.643 -22.208  -6.986
    4    HB3  LYS  69           HB3      LYS  69  -0.106 -20.532  -6.814
    5    HG2  LYS  69           HG2      LYS  69   1.999 -21.063  -7.952
    6    HG3  LYS  69           HG3      LYS  69   1.513 -22.752  -8.094
    7    HD2  LYS  69           HD2      LYS  69  -0.454 -22.047  -9.443
    8    HD3  LYS  69           HD3      LYS  69   0.116 -20.378  -9.357
    9    HE2  LYS  69           HE2      LYS  69   1.675 -22.698 -10.536
   10    HE3  LYS  69           HE3      LYS  69   0.829 -21.462 -11.465
   11    HZ3  LYS  69           HZ1      LYS  69   2.712 -20.318 -11.359
   12    HZ2  LYS  69           HZ2      LYS  69   3.374 -21.338 -10.173
   13    HZ1  LYS  69           HZ3      LYS  69   2.368 -20.046  -9.720

  No H/Q in entry =          13
  In of MODEL   20
    1    H    VAL  70           H        VAL  70   0.079 -19.586  -5.181
    2    HA   VAL  70           HA       VAL  70  -1.249 -20.265  -2.620
    3    HB   VAL  70           HB       VAL  70  -0.528 -18.052  -1.751
    4   HG11  VAL  70          HG11      VAL  70   1.608 -19.990  -2.660
    5   HG13  VAL  70          HG12      VAL  70   0.828 -19.900  -1.080
    6   HG12  VAL  70          HG13      VAL  70   1.953 -18.637  -1.583
    7   HG21  VAL  70          HG21      VAL  70   0.835 -17.918  -4.452
    8   HG23  VAL  70          HG22      VAL  70   1.470 -17.018  -3.076
    9   HG22  VAL  70          HG23      VAL  70  -0.160 -16.693  -3.660

  No H/Q in entry =           9
  In of MODEL   20
    1    H    SER  71           H        SER  71  -2.876 -18.626  -2.013
    2    HA   SER  71           HA       SER  71  -4.744 -18.120  -4.073
    3    HB2  SER  71           HB2      SER  71  -5.347 -18.313  -1.652
    4    HB3  SER  71           HB3      SER  71  -4.538 -16.778  -1.352
    5    HG   SER  71           HG       SER  71  -6.967 -17.320  -2.546

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU  72           H        LEU  72  -5.023 -16.445  -5.397
    2    HA   LEU  72           HA       LEU  72  -2.938 -14.610  -5.890
    3    HB2  LEU  72           HB2      LEU  72  -5.807 -14.693  -6.820
    4    HB3  LEU  72           HB3      LEU  72  -4.622 -13.528  -7.407
    5    HG   LEU  72           HG       LEU  72  -4.204 -16.534  -7.533
    6   HD12  LEU  72          HD11      LEU  72  -4.732 -16.238  -9.976
    7   HD11  LEU  72          HD12      LEU  72  -5.286 -14.605  -9.606
    8   HD13  LEU  72          HD13      LEU  72  -6.121 -15.996  -8.915
    9   HD21  LEU  72          HD21      LEU  72  -2.742 -14.112  -8.567
   10   HD23  LEU  72          HD22      LEU  72  -2.636 -15.618  -9.464
   11   HD22  LEU  72          HD23      LEU  72  -2.084 -15.549  -7.792

  No H/Q in entry =          11
  In of MODEL   20
    1    H    VAL  73           H        VAL  73  -6.027 -14.287  -4.245
    2    HA   VAL  73           HA       VAL  73  -6.102 -11.517  -3.895
    3    HB   VAL  73           HB       VAL  73  -7.801 -11.896  -2.292
    4   HG13  VAL  73          HG11      VAL  73  -9.241 -13.439  -3.451
    5   HG12  VAL  73          HG12      VAL  73  -7.861 -14.305  -4.125
    6   HG11  VAL  73          HG13      VAL  73  -8.222 -12.665  -4.666
    7   HG22  VAL  73          HG21      VAL  73  -6.958 -13.339  -0.674
    8   HG21  VAL  73          HG22      VAL  73  -6.324 -14.471  -1.869
    9   HG23  VAL  73          HG23      VAL  73  -8.054 -14.422  -1.530

  No H/Q in entry =           9
  In of MODEL   20
    1    H    LEU  74           H        LEU  74  -4.129 -13.861  -2.320
    2    HA   LEU  74           HA       LEU  74  -3.718 -12.714   0.199
    3    HB2  LEU  74           HB2      LEU  74  -2.908 -14.919  -0.287
    4    HB3  LEU  74           HB3      LEU  74  -1.883 -14.310  -1.586
    5    HG   LEU  74           HG       LEU  74  -0.567 -13.020   0.068
    6   HD13  LEU  74          HD11      LEU  74  -2.105 -12.554   1.819
    7   HD12  LEU  74          HD12      LEU  74  -0.992 -13.731   2.517
    8   HD11  LEU  74          HD13      LEU  74  -2.582 -14.246   1.956
    9   HD21  LEU  74          HD21      LEU  74  -0.323 -15.575  -0.546
   10   HD23  LEU  74          HD22      LEU  74  -0.732 -15.767   1.144
   11   HD22  LEU  74          HD23      LEU  74   0.686 -14.846   0.702

  No H/Q in entry =          11
  In of MODEL   20
    1    H    VAL  75           H        VAL  75  -1.847 -12.300  -2.768
    2    HA   VAL  75           HA       VAL  75  -0.067 -10.355  -1.768
    3    HB   VAL  75           HB       VAL  75  -1.032 -10.858  -4.585
    4   HG11  VAL  75          HG11      VAL  75   1.218  -9.090  -3.525
    5   HG13  VAL  75          HG12      VAL  75  -0.210  -8.555  -4.398
    6   HG12  VAL  75          HG13      VAL  75   1.003  -9.524  -5.217
    7   HG22  VAL  75          HG21      VAL  75   0.207 -12.713  -3.535
    8   HG21  VAL  75          HG22      VAL  75   1.492 -11.601  -3.061
    9   HG23  VAL  75          HG23      VAL  75   1.204 -11.941  -4.769

  No H/Q in entry =           9
  In of MODEL   20
    1    H    GLU  76           H        GLU  76  -3.230 -10.045  -3.409
    2    HA   GLU  76           HA       GLU  76  -3.315  -7.231  -3.512
    3    HB2  GLU  76           HB2      GLU  76  -4.964  -8.687  -4.665
    4    HB3  GLU  76           HB3      GLU  76  -5.600  -9.197  -3.110
    5    HG2  GLU  76           HG2      GLU  76  -7.077  -7.498  -3.990
    6    HG3  GLU  76           HG3      GLU  76  -6.213  -6.789  -2.640

  No H/Q in entry =           6
  In of MODEL   20
    1    H    ALA  77           H        ALA  77  -4.386  -9.471  -0.965
    2    HA   ALA  77           HA       ALA  77  -5.356  -7.479   0.798
    3    HB2  ALA  77           HB1      ALA  77  -5.085  -9.237   2.553
    4    HB1  ALA  77           HB2      ALA  77  -4.270 -10.248   1.362
    5    HB3  ALA  77           HB3      ALA  77  -5.959  -9.800   1.129

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLN  78           H        GLN  78  -2.193  -8.992   0.417
    2    HA   GLN  78           HA       GLN  78  -0.937  -7.817   2.660
    3    HB2  GLN  78           HB2      GLN  78  -0.058  -9.747   1.306
    4    HB3  GLN  78           HB3      GLN  78   0.351  -8.603   0.031
    5    HG2  GLN  78           HG2      GLN  78   1.810  -7.381   1.591
    6    HG3  GLN  78           HG3      GLN  78   1.403  -8.519   2.873
    7   HE21  GLN  78          HE21      GLN  78   4.113  -8.221   2.015
    8   HE22  GLN  78          HE22      GLN  78   4.587  -9.650   1.229

  No H/Q in entry =           8
  In of MODEL   20
    1    H    LEU  79           H        LEU  79  -1.333  -6.762  -0.686
    2    HA   LEU  79           HA       LEU  79   0.329  -4.517  -0.682
    3    HB2  LEU  79           HB2      LEU  79  -0.700  -5.336  -2.730
    4    HB3  LEU  79           HB3      LEU  79  -2.305  -4.961  -2.113
    5    HG   LEU  79           HG       LEU  79  -1.786  -2.568  -2.092
    6   HD13  LEU  79          HD11      LEU  79   0.454  -2.300  -1.591
    7   HD12  LEU  79          HD12      LEU  79   0.491  -2.013  -3.331
    8   HD11  LEU  79          HD13      LEU  79   0.965  -3.586  -2.686
    9   HD23  LEU  79          HD21      LEU  79  -1.168  -2.364  -4.647
   10   HD22  LEU  79          HD22      LEU  79  -2.684  -3.128  -4.179
   11   HD21  LEU  79          HD23      LEU  79  -1.303  -4.122  -4.631

  No H/Q in entry =          11
  In of MODEL   20
    1    H    HIS  80           H        HIS  80  -3.131  -4.715   0.163
    2    HA   HIS  80           HA       HIS  80  -3.348  -1.961   0.826
    3    HB2  HIS  80           HB2      HIS  80  -5.022  -4.387   1.155
    4    HB3  HIS  80           HB3      HIS  80  -5.351  -3.050   2.260
    5    HD1  HIS  80           HD1      HIS  80  -6.990  -1.430   1.361
    6    HD2  HIS  80           HD2      HIS  80  -4.795  -3.221  -1.698
    7    HE1  HIS  80           HE1      HIS  80  -7.852  -0.443  -0.814
    8    HE2  HIS  80           HE2      HIS  80  -6.521  -1.529  -2.688

  No H/Q in entry =           8
  In of MODEL   20
    1    H    LEU  81           H        LEU  81  -2.819  -4.849   2.818
    2    HA   LEU  81           HA       LEU  81  -2.806  -3.501   5.301
    3    HB2  LEU  81           HB2      LEU  81  -1.566  -6.105   4.416
    4    HB3  LEU  81           HB3      LEU  81  -1.537  -5.545   6.090
    5    HG   LEU  81           HG       LEU  81  -4.089  -5.824   4.476
    6   HD12  LEU  81          HD11      LEU  81  -4.362  -7.892   6.026
    7   HD11  LEU  81          HD12      LEU  81  -2.610  -7.803   6.202
    8   HD13  LEU  81          HD13      LEU  81  -3.325  -8.042   4.607
    9   HD23  LEU  81          HD21      LEU  81  -4.916  -6.034   6.982
   10   HD22  LEU  81          HD22      LEU  81  -4.611  -4.442   6.289
   11   HD21  LEU  81          HD23      LEU  81  -3.411  -5.190   7.343

  No H/Q in entry =          11
  In of MODEL   20
    1    H    MET  82           H        MET  82  -0.128  -4.379   3.117
    2    HA   MET  82           HA       MET  82   1.955  -3.463   4.788
    3    HB2  MET  82           HB2      MET  82   1.727  -3.808   1.798
    4    HB3  MET  82           HB3      MET  82   3.207  -3.223   2.553
    5    HG2  MET  82           HG2      MET  82   1.830  -5.825   3.286
    6    HG3  MET  82           HG3      MET  82   3.194  -5.703   2.178
    7    HE3  MET  82           HE1      MET  82   6.213  -4.937   4.145
    8    HE2  MET  82           HE2      MET  82   5.274  -3.579   3.531
    9    HE1  MET  82           HE3      MET  82   5.372  -5.068   2.596

  No H/Q in entry =           9
  In of MODEL   20
    1    H    THR  83           H        THR  83   0.103  -1.840   2.241
    2    HA   THR  83           HA       THR  83   1.492   0.621   2.318
    3    HB   THR  83           HB       THR  83  -0.698   1.525   1.343
    4    HG1  THR  83           HG1      THR  83  -2.337   0.212   1.246
    5   HG22  THR  83          HG21      THR  83  -0.422  -0.291  -0.658
    6   HG21  THR  83          HG22      THR  83   1.086  -0.569   0.211
    7   HG23  THR  83          HG23      THR  83   0.707   1.040  -0.403

  No H/Q in entry =           7
  In of MODEL   20
    1    H    SER  84           H        SER  84  -1.495  -0.438   3.937
    2    HA   SER  84           HA       SER  84  -2.006   1.988   5.282
    3    HB2  SER  84           HB2      SER  84  -2.810  -0.857   5.853
    4    HB3  SER  84           HB3      SER  84  -3.310   0.480   6.888
    5    HG   SER  84           HG       SER  84  -3.781   0.160   4.099

  No H/Q in entry =           5
  In of MODEL   20
    1    H    MET  85           H        MET  85  -0.263  -0.927   6.404
    2    HA   MET  85           HA       MET  85   0.263   0.006   9.005
    3    HB2  MET  85           HB2      MET  85   0.572  -2.336   8.323
    4    HB3  MET  85           HB3      MET  85   1.948  -1.859   7.326
    5    HG2  MET  85           HG2      MET  85   3.127  -1.027   9.317
    6    HG3  MET  85           HG3      MET  85   1.740  -1.438  10.324
    7    HE3  MET  85           HE1      MET  85   3.339  -3.686   7.275
    8    HE2  MET  85           HE2      MET  85   4.720  -4.195   8.243
    9    HE1  MET  85           HE3      MET  85   4.415  -2.480   7.988

  No H/Q in entry =           9
  In of MODEL   20
    1    H    LEU  86           H        LEU  86   2.178   0.277   6.043
    2    HA   LEU  86           HA       LEU  86   4.387   1.608   7.185
    3    HB2  LEU  86           HB2      LEU  86   4.192   0.522   4.878
    4    HB3  LEU  86           HB3      LEU  86   3.368   1.996   4.369
    5    HG   LEU  86           HG       LEU  86   5.391   3.261   5.337
    6   HD11  LEU  86          HD11      LEU  86   6.124   0.656   6.135
    7   HD13  LEU  86          HD12      LEU  86   7.115   2.110   6.225
    8   HD12  LEU  86          HD13      LEU  86   7.225   1.062   4.814
    9   HD23  LEU  86          HD21      LEU  86   6.110   1.503   2.984
   10   HD22  LEU  86          HD22      LEU  86   6.490   3.203   3.242
   11   HD21  LEU  86          HD23      LEU  86   4.839   2.720   2.853

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ALA  87           H        ALA  87   1.455   2.825   5.616
    2    HA   ALA  87           HA       ALA  87   2.026   5.560   5.694
    3    HB1  ALA  87           HB1      ALA  87  -0.272   3.911   5.167
    4    HB3  ALA  87           HB2      ALA  87   0.021   5.574   4.664
    5    HB2  ALA  87           HB3      ALA  87  -0.761   5.247   6.212

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ARG  88           H        ARG  88   0.367   3.545   8.095
    2    HA   ARG  88           HA       ARG  88  -0.152   5.592   9.943
    3    HB2  ARG  88           HB2      ARG  88  -1.070   3.231  10.017
    4    HB3  ARG  88           HB3      ARG  88   0.479   2.745  10.715
    5    HG2  ARG  88           HG2      ARG  88  -0.006   4.817  12.336
    6    HG3  ARG  88           HG3      ARG  88  -1.672   4.477  11.889
    7    HD2  ARG  88           HD2      ARG  88  -1.756   2.628  13.138
    8    HD3  ARG  88           HD3      ARG  88  -0.165   2.060  12.598
    9    HE   ARG  88           HE       ARG  88  -0.696   3.321  15.054
   10   HH21  ARG  88          HH11      ARG  88   0.860   4.347  16.283
   11   HH22  ARG  88          HH12      ARG  88   2.372   4.787  15.569
   12   HH11  ARG  88          HH21      ARG  88   1.568   3.520  12.464
   13   HH12  ARG  88          HH22      ARG  88   2.781   4.302  13.419

  No H/Q in entry =          13
  In of MODEL   20
    1    H    GLU  89           H        GLU  89   2.663   3.398   9.706
    2    HA   GLU  89           HA       GLU  89   3.929   4.300  12.042
    3    HB2  GLU  89           HB2      GLU  89   4.599   2.287  10.697
    4    HB3  GLU  89           HB3      GLU  89   5.358   3.387   9.545
    5    HG2  GLU  89           HG2      GLU  89   6.845   4.249  11.279
    6    HG3  GLU  89           HG3      GLU  89   6.026   3.286  12.505

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LEU  90           H        LEU  90   4.217   5.458   8.712
    2    HA   LEU  90           HA       LEU  90   6.132   7.477   9.284
    3    HB2  LEU  90           HB2      LEU  90   4.117   7.124   7.068
    4    HB3  LEU  90           HB3      LEU  90   5.335   8.406   7.082
    5    HG   LEU  90           HG       LEU  90   6.038   5.477   7.414
    6   HD12  LEU  90          HD11      LEU  90   6.771   5.715   4.970
    7   HD11  LEU  90          HD12      LEU  90   5.742   7.145   4.926
    8   HD13  LEU  90          HD13      LEU  90   5.039   5.566   5.275
    9   HD22  LEU  90          HD21      LEU  90   7.928   6.645   8.085
   10   HD21  LEU  90          HD22      LEU  90   7.559   8.045   7.078
   11   HD23  LEU  90          HD23      LEU  90   8.229   6.586   6.349

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  91           H        ILE  91   2.592   7.458   9.155
    2    HA   ILE  91           HA       ILE  91   2.225  10.227   9.605
    3    HB   ILE  91           HB       ILE  91   0.460   7.835  10.160
    4   HG12  ILE  91          HG12      ILE  91   0.179  10.112   8.174
    5   HG13  ILE  91          HG13      ILE  91   1.051   8.625   7.799
    6   HG22  ILE  91          HG21      ILE  91  -1.292   9.876  10.231
    7   HG21  ILE  91          HG22      ILE  91   0.105  10.721  10.895
    8   HG23  ILE  91          HG23      ILE  91  -0.513   9.278  11.697
    9   HD13  ILE  91          HD11      ILE  91  -0.880   7.319   7.855
   10   HD12  ILE  91          HD12      ILE  91  -1.488   8.827   7.175
   11   HD11  ILE  91          HD13      ILE  91  -1.746   8.462   8.882

  No H/Q in entry =          11
  In of MODEL   20
    1    H    THR  92           H        THR  92   2.668   7.493  11.807
    2    HA   THR  92           HA       THR  92   2.224   8.864  14.232
    3    HB   THR  92           HB       THR  92   4.053   6.548  13.559
    4    HG1  THR  92           HG1      THR  92   2.091   5.770  13.470
    5   HG22  THR  92          HG21      THR  92   3.686   6.262  16.196
    6   HG21  THR  92          HG22      THR  92   3.603   8.021  16.120
    7   HG23  THR  92          HG23      THR  92   5.042   7.179  15.541

  No H/Q in entry =           7
  In of MODEL   20
    1    H    GLU  93           H        GLU  93   5.169   8.444  12.283
    2    HA   GLU  93           HA       GLU  93   6.916   9.892  13.968
    3    HB2  GLU  93           HB2      GLU  93   6.992   9.574  10.953
    4    HB3  GLU  93           HB3      GLU  93   8.332  10.120  11.960
    5    HG2  GLU  93           HG2      GLU  93   6.954   7.469  12.418
    6    HG3  GLU  93           HG3      GLU  93   8.330   7.634  11.334

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LEU  94           H        LEU  94   4.843  10.881  11.265
    2    HA   LEU  94           HA       LEU  94   5.618  13.593  11.157
    3    HB2  LEU  94           HB2      LEU  94   3.038  12.199  10.419
    4    HB3  LEU  94           HB3      LEU  94   3.276  13.929  10.174
    5    HG   LEU  94           HG       LEU  94   5.310  11.962   9.116
    6   HD11  LEU  94          HD11      LEU  94   2.557  12.481   8.067
    7   HD13  LEU  94          HD12      LEU  94   3.555  11.035   7.938
    8   HD12  LEU  94          HD13      LEU  94   3.870  12.418   6.890
    9   HD23  LEU  94          HD21      LEU  94   5.531  13.798   7.389
   10   HD22  LEU  94          HD22      LEU  94   5.948  14.298   9.028
   11   HD21  LEU  94          HD23      LEU  94   4.389  14.748   8.338

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  95           H        ILE  95   3.108  11.951  13.064
    2    HA   ILE  95           HA       ILE  95   2.045  14.290  14.261
    3    HB   ILE  95           HB       ILE  95   2.100  11.410  15.190
    4   HG12  ILE  95          HG12      ILE  95  -0.147  13.156  14.150
    5   HG13  ILE  95          HG13      ILE  95   0.817  12.107  13.114
    6   HG21  ILE  95          HG21      ILE  95   0.795  13.869  16.395
    7   HG23  ILE  95          HG22      ILE  95   1.861  12.714  17.195
    8   HG22  ILE  95          HG23      ILE  95   0.229  12.233  16.729
    9   HD13  ILE  95          HD11      ILE  95  -0.059  10.159  14.040
   10   HD12  ILE  95          HD12      ILE  95  -1.453  11.232  14.122
   11   HD11  ILE  95          HD13      ILE  95  -0.477  10.948  15.563

  No H/Q in entry =          11
  In of MODEL   20
    1    H    GLU  96           H        GLU  96   4.671  12.103  15.246
    2    HA   GLU  96           HA       GLU  96   5.224  13.312  17.734
    3    HB2  GLU  96           HB2      GLU  96   6.195  11.163  17.084
    4    HB3  GLU  96           HB3      GLU  96   7.112  11.946  15.799
    5    HG2  GLU  96           HG2      GLU  96   8.761  12.516  17.252
    6    HG3  GLU  96           HG3      GLU  96   7.610  13.317  18.312

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LEU  97           H        LEU  97   6.273  14.092  14.441
    2    HA   LEU  97           HA       LEU  97   8.138  16.112  15.141
    3    HB2  LEU  97           HB2      LEU  97   6.541  15.540  12.655
    4    HB3  LEU  97           HB3      LEU  97   7.543  16.984  12.769
    5    HG   LEU  97           HG       LEU  97   8.609  14.200  13.328
    6   HD12  LEU  97          HD11      LEU  97   9.592  14.403  11.005
    7   HD11  LEU  97          HD12      LEU  97   8.522  15.780  10.745
    8   HD13  LEU  97          HD13      LEU  97   7.844  14.180  11.046
    9   HD23  LEU  97          HD21      LEU  97  10.759  15.504  12.572
   10   HD22  LEU  97          HD22      LEU  97  10.144  15.769  14.204
   11   HD21  LEU  97          HD23      LEU  97   9.809  16.946  12.936

  No H/Q in entry =          11
  In of MODEL   20
    1    H    HIS  98           H        HIS  98   4.642  16.203  14.504
    2    HA   HIS  98           HA       HIS  98   4.308  18.999  14.637
    3    HB2  HIS  98           HB2      HIS  98   2.450  16.726  15.376
    4    HB3  HIS  98           HB3      HIS  98   1.962  18.420  15.431
    5    HD1  HIS  98           HD1      HIS  98   3.006  15.715  13.025
    6    HD2  HIS  98           HD2      HIS  98   1.579  19.630  12.904
    7    HE1  HIS  98           HE1      HIS  98   2.428  16.193  10.603
    8    HE2  HIS  98           HE2      HIS  98   1.563  18.572  10.509

  No H/Q in entry =           8
  In of MODEL   20
    1    H    GLU  99           H        GLU  99   4.485  16.516  17.139
    2    HA   GLU  99           HA       GLU  99   3.867  18.205  19.337
    3    HB2  GLU  99           HB2      GLU  99   3.810  15.723  19.438
    4    HB3  GLU  99           HB3      GLU  99   5.570  15.700  19.321
    5    HG2  GLU  99           HG2      GLU  99   5.752  16.997  21.393
    6    HG3  GLU  99           HG3      GLU  99   3.999  17.116  21.497

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LYS 100           H        LYS 100   6.924  17.311  17.758
    2    HA   LYS 100           HA       LYS 100   8.571  18.735  19.605
    3    HB2  LYS 100           HB2      LYS 100   9.067  17.813  16.765
    4    HB3  LYS 100           HB3      LYS 100  10.292  18.600  17.766
    5    HG2  LYS 100           HG2      LYS 100   9.947  16.847  19.511
    6    HG3  LYS 100           HG3      LYS 100   8.819  16.028  18.426
    7    HD2  LYS 100           HD2      LYS 100  10.608  15.765  16.751
    8    HD3  LYS 100           HD3      LYS 100  11.740  16.597  17.820
    9    HE2  LYS 100           HE2      LYS 100  11.375  14.839  19.542
   10    HE3  LYS 100           HE3      LYS 100  10.305  13.988  18.424
   11    HZ1  LYS 100           HZ1      LYS 100  13.113  14.692  17.753
   12    HZ3  LYS 100           HZ2      LYS 100  12.079  13.623  16.932
   13    HZ2  LYS 100           HZ3      LYS 100  12.680  13.213  18.468

  No H/Q in entry =          13
  In of MODEL   20
    1    H    LEU 101           H        LEU 101   6.851  19.636  16.657
    2    HA   LEU 101           HA       LEU 101   8.031  22.208  16.312
    3    HB2  LEU 101           HB2      LEU 101   5.447  20.941  15.440
    4    HB3  LEU 101           HB3      LEU 101   5.675  22.675  15.229
    5    HG   LEU 101           HG       LEU 101   7.731  20.683  14.256
    6   HD12  LEU 101          HD11      LEU 101   6.560  21.171  11.976
    7   HD11  LEU 101          HD12      LEU 101   5.160  21.585  12.963
    8   HD13  LEU 101          HD13      LEU 101   5.845  19.963  13.044
    9   HD21  LEU 101          HD21      LEU 101   7.064  23.586  13.700
   10   HD23  LEU 101          HD22      LEU 101   8.051  22.637  12.589
   11   HD22  LEU 101          HD23      LEU 101   8.598  22.904  14.244

  No H/Q in entry =          11
  In of MODEL   20
    1    H    LYS 102           H        LYS 102   6.521  21.055  18.937
    2    HA   LYS 102           HA       LYS 102   5.885  22.141  20.871
    3    HB2  LYS 102           HB2      LYS 102   7.137  24.145  19.738
    4    HB3  LYS 102           HB3      LYS 102   5.529  24.730  19.369
    5    HG2  LYS 102           HG2      LYS 102   6.923  24.494  22.015
    6    HG3  LYS 102           HG3      LYS 102   5.951  25.810  21.389
    7    HD2  LYS 102           HD2      LYS 102   4.744  23.160  22.277
    8    HD3  LYS 102           HD3      LYS 102   4.981  24.525  23.358
    9    HE2  LYS 102           HE2      LYS 102   2.699  24.092  21.881
   10    HE3  LYS 102           HE3      LYS 102   3.187  25.645  22.559
   11    HZ2  LYS 102           HZ1      LYS 102   2.643  25.743  20.182
   12    HZ1  LYS 102           HZ2      LYS 102   3.916  24.677  19.853
   13    HZ3  LYS 102           HZ3      LYS 102   4.243  26.212  20.493

  No H/Q in entry =          13
  In of MODEL   20
    1    H    ALA 103           H        ALA 103   4.214  23.660  18.110
    2    HA   ALA 103           HA       ALA 103   1.758  24.207  19.007
    3    HB1  ALA 103           HB1      ALA 103   0.858  23.352  16.771
    4    HB2  ALA 103           HB2      ALA 103   2.510  22.835  16.433
    5    HB3  ALA 103           HB3      ALA 103   2.156  24.543  16.699

  No H/Q in entry =           5
  In of MODEL   20
    1    H1   ALA   1           H3       ALA   1  10.768 -20.215  -6.259
    2    H2   ALA   1           H2       ALA   1   9.799 -20.434  -7.640
    3    H3   ALA   1           H1       ALA   1   9.379 -21.184  -6.174
    4    HA   ALA   1           HA       ALA   1  10.435 -22.982  -6.917
    5    HB1  ALA   1           HB1      ALA   1  10.514 -22.624  -9.193
    6    HB2  ALA   1           HB2      ALA   1  12.242 -22.453  -8.874
    7    HB3  ALA   1           HB3      ALA   1  11.226 -21.018  -9.021

  No H/Q in entry =           7
  In of MODEL   20
    1    H    GLU   2           H        GLU   2  12.729 -23.906  -6.986
    2    HA   GLU   2           HA       GLU   2  14.122 -23.806  -4.782
    3    HB2  GLU   2           HB2      GLU   2  15.462 -23.662  -7.488
    4    HB3  GLU   2           HB3      GLU   2  16.205 -24.263  -6.006
    5    HG2  GLU   2           HG2      GLU   2  15.210 -26.291  -6.240
    6    HG3  GLU   2           HG3      GLU   2  13.629 -25.564  -6.491

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLU   3           H        GLU   3  15.859 -21.924  -7.195
    2    HA   GLU   3           HA       GLU   3  17.003 -20.221  -5.243
    3    HB2  GLU   3           HB2      GLU   3  16.931 -20.223  -8.253
    4    HB3  GLU   3           HB3      GLU   3  17.666 -18.885  -7.371
    5    HG2  GLU   3           HG2      GLU   3  19.349 -20.239  -6.456
    6    HG3  GLU   3           HG3      GLU   3  18.418 -21.717  -6.670

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LEU   4           H        LEU   4  14.697 -19.402  -7.862
    2    HA   LEU   4           HA       LEU   4  14.205 -16.798  -7.251
    3    HB2  LEU   4           HB2      LEU   4  12.048 -18.798  -7.967
    4    HB3  LEU   4           HB3      LEU   4  11.952 -17.050  -8.167
    5    HG   LEU   4           HG       LEU   4  13.930 -18.893  -9.549
    6   HD13  LEU   4          HD11      LEU   4  12.616 -18.761 -11.452
    7   HD12  LEU   4          HD12      LEU   4  11.894 -17.224 -10.983
    8   HD11  LEU   4          HD13      LEU   4  11.361 -18.719 -10.217
    9   HD23  LEU   4          HD21      LEU   4  14.234 -16.646 -10.905
   10   HD22  LEU   4          HD22      LEU   4  15.105 -16.877  -9.390
   11   HD21  LEU   4          HD23      LEU   4  13.640 -15.897  -9.422

  No H/Q in entry =          11
  In of MODEL   20
    1    H    GLU   5           H        GLU   5  12.760 -19.597  -5.598
    2    HA   GLU   5           HA       GLU   5  11.075 -18.043  -3.887
    3    HB2  GLU   5           HB2      GLU   5  10.703 -20.442  -4.421
    4    HB3  GLU   5           HB3      GLU   5  12.118 -20.838  -3.444
    5    HG2  GLU   5           HG2      GLU   5  10.172 -21.087  -2.038
    6    HG3  GLU   5           HG3      GLU   5  11.032 -19.637  -1.518

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLU   6           H        GLU   6  14.241 -19.586  -3.460
    2    HA   GLU   6           HA       GLU   6  14.599 -18.723  -0.765
    3    HB2  GLU   6           HB2      GLU   6  15.840 -20.625  -1.767
    4    HB3  GLU   6           HB3      GLU   6  16.690 -19.489  -2.819
    5    HG2  GLU   6           HG2      GLU   6  17.609 -18.333  -0.858
    6    HG3  GLU   6           HG3      GLU   6  16.732 -19.426   0.212

  No H/Q in entry =           6
  In of MODEL   20
    1    H    VAL   7           H        VAL   7  15.332 -17.391  -3.920
    2    HA   VAL   7           HA       VAL   7  16.998 -15.244  -3.067
    3    HB   VAL   7           HB       VAL   7  15.283 -15.630  -5.535
    4   HG11  VAL   7          HG11      VAL   7  17.155 -13.394  -4.735
    5   HG13  VAL   7          HG12      VAL   7  15.507 -13.271  -5.350
    6   HG12  VAL   7          HG13      VAL   7  16.816 -13.760  -6.427
    7   HG21  VAL   7          HG21      VAL   7  17.410 -17.061  -4.976
    8   HG23  VAL   7          HG22      VAL   7  18.295 -15.590  -5.381
    9   HG22  VAL   7          HG23      VAL   7  17.261 -16.353  -6.586

  No H/Q in entry =           9
  In of MODEL   20
    1    H    VAL   8           H        VAL   8  13.506 -15.555  -3.604
    2    HA   VAL   8           HA       VAL   8  12.811 -12.855  -3.132
    3    HB   VAL   8           HB       VAL   8  11.237 -15.406  -2.697
    4   HG13  VAL   8          HG11      VAL   8  10.183 -13.792  -1.311
    5   HG12  VAL   8          HG12      VAL   8   9.267 -13.742  -2.817
    6   HG11  VAL   8          HG13      VAL   8  10.462 -12.494  -2.471
    7   HG23  VAL   8          HG21      VAL   8  10.511 -13.493  -4.854
    8   HG22  VAL   8          HG22      VAL   8  10.624 -15.250  -4.902
    9   HG21  VAL   8          HG23      VAL   8  12.078 -14.271  -5.069

  No H/Q in entry =           9
  In of MODEL   20
    1    H    MET   9           H        MET   9  13.123 -15.654  -0.951
    2    HA   MET   9           HA       MET   9  12.306 -14.390   1.423
    3    HB2  MET   9           HB2      MET   9  14.243 -16.639   0.878
    4    HB3  MET   9           HB3      MET   9  13.930 -16.064   2.516
    5    HG2  MET   9           HG2      MET   9  11.509 -16.477   2.188
    6    HG3  MET   9           HG3      MET   9  11.847 -17.093   0.570
    7    HE2  MET   9           HE1      MET   9  11.586 -18.467   4.431
    8    HE1  MET   9           HE2      MET   9  12.612 -17.073   4.102
    9    HE3  MET   9           HE3      MET   9  13.344 -18.613   4.547

  No H/Q in entry =           9
  In of MODEL   20
    1    H    GLY  10           H        GLY  10  15.480 -14.577  -0.151
    2    HA3  GLY  10           HA2      GLY  10  16.932 -13.136   1.809
    3    HA2  GLY  10           HA3      GLY  10  17.388 -13.298   0.114

  No H/Q in entry =           3
  In of MODEL   20
    1    H    LEU  11           H        LEU  11  15.198 -12.105  -1.115
    2    HA   LEU  11           HA       LEU  11  15.849  -9.351  -0.958
    3    HB2  LEU  11           HB2      LEU  11  13.493 -10.793  -2.179
    4    HB3  LEU  11           HB3      LEU  11  13.750  -9.055  -2.342
    5    HG   LEU  11           HG       LEU  11  15.800 -11.138  -3.139
    6   HD13  LEU  11          HD11      LEU  11  14.051 -11.529  -4.649
    7   HD12  LEU  11          HD12      LEU  11  15.034 -10.336  -5.496
    8   HD11  LEU  11          HD13      LEU  11  13.558  -9.836  -4.670
    9   HD22  LEU  11          HD21      LEU  11  17.007  -9.159  -2.922
   10   HD21  LEU  11          HD22      LEU  11  15.617  -8.140  -3.294
   11   HD23  LEU  11          HD23      LEU  11  16.452  -9.000  -4.587

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  12           H        ILE  12  13.111 -11.212   0.326
    2    HA   ILE  12           HA       ILE  12  11.695  -9.005   1.391
    3    HB   ILE  12           HB       ILE  12  11.774 -11.885   2.344
    4   HG12  ILE  12          HG12      ILE  12  11.065 -11.257  -0.103
    5   HG13  ILE  12          HG13      ILE  12  10.068 -12.371   0.812
    6   HG22  ILE  12          HG21      ILE  12   9.493 -11.332   3.272
    7   HG21  ILE  12          HG22      ILE  12   9.814  -9.636   2.913
    8   HG23  ILE  12          HG23      ILE  12  10.819 -10.496   4.079
    9   HD11  ILE  12          HD11      ILE  12   9.578  -9.388   0.602
   10   HD13  ILE  12          HD12      ILE  12   8.513 -10.585   1.338
   11   HD12  ILE  12          HD13      ILE  12   8.781 -10.595  -0.392

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  13           H        ILE  13  14.124 -11.176   2.786
    2    HA   ILE  13           HA       ILE  13  14.158  -9.993   5.365
    3    HB   ILE  13           HB       ILE  13  16.232 -11.537   3.789
    4   HG12  ILE  13          HG12      ILE  13  13.988 -12.555   4.613
    5   HG13  ILE  13          HG13      ILE  13  15.477 -13.437   4.933
    6   HG23  ILE  13          HG21      ILE  13  17.562 -10.332   5.329
    7   HG22  ILE  13          HG22      ILE  13  17.285 -11.872   6.132
    8   HG21  ILE  13          HG23      ILE  13  16.357 -10.451   6.610
    9   HD13  ILE  13          HD11      ILE  13  15.360 -13.062   7.214
   10   HD12  ILE  13          HD12      ILE  13  13.644 -12.925   6.845
   11   HD11  ILE  13          HD13      ILE  13  14.624 -11.474   7.004

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ASN  14           H        ASN  14  16.088  -9.438   2.435
    2    HA   ASN  14           HA       ASN  14  17.810  -7.470   3.485
    3    HB2  ASN  14           HB2      ASN  14  17.793  -8.739   1.171
    4    HB3  ASN  14           HB3      ASN  14  16.877  -7.336   0.638
    5   HD21  ASN  14          HD21      ASN  14  19.316  -7.641  -0.561
    6   HD22  ASN  14          HD22      ASN  14  20.446  -6.540   0.059

  No H/Q in entry =           6
  In of MODEL   20
    1    H    SER  15           H        SER  15  14.685  -7.171   1.809
    2    HA   SER  15           HA       SER  15  14.531  -4.353   1.863
    3    HB2  SER  15           HB2      SER  15  12.197  -4.635   1.386
    4    HB3  SER  15           HB3      SER  15  13.013  -5.983   0.604
    5    HG   SER  15           HG       SER  15  11.411  -5.934   2.896

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLY  16           H        GLY  16  13.487  -6.826   4.175
    2    HA3  GLY  16           HA2      GLY  16  12.249  -5.094   6.037
    3    HA2  GLY  16           HA3      GLY  16  12.890  -6.692   6.398

  No H/Q in entry =           3
  In of MODEL   20
    1    H    GLN  17           H        GLN  17  15.593  -6.318   5.791
    2    HA   GLN  17           HA       GLN  17  16.542  -5.080   8.165
    3    HB2  GLN  17           HB2      GLN  17  17.781  -6.859   6.942
    4    HB3  GLN  17           HB3      GLN  17  18.092  -5.714   5.637
    5    HG2  GLN  17           HG2      GLN  17  20.030  -5.765   7.101
    6    HG3  GLN  17           HG3      GLN  17  19.221  -4.211   7.288
    7   HE21  GLN  17          HE21      GLN  17  19.708  -3.772   9.490
    8   HE22  GLN  17          HE22      GLN  17  19.237  -4.784  10.768

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ALA  18           H        ALA  18  16.320  -4.009   4.805
    2    HA   ALA  18           HA       ALA  18  17.719  -1.594   5.022
    3    HB2  ALA  18           HB1      ALA  18  16.610  -2.829   2.961
    4    HB3  ALA  18           HB2      ALA  18  16.847  -1.081   2.943
    5    HB1  ALA  18           HB3      ALA  18  15.260  -1.752   3.321

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ARG  19           H        ARG  19  14.231  -2.236   5.437
    2    HA   ARG  19           HA       ARG  19  13.524   0.403   6.152
    3    HB2  ARG  19           HB2      ARG  19  11.868  -1.375   5.576
    4    HB3  ARG  19           HB3      ARG  19  12.230  -2.166   7.112
    5    HG2  ARG  19           HG2      ARG  19  11.495  -0.185   8.353
    6    HG3  ARG  19           HG3      ARG  19  11.223   0.686   6.845
    7    HD2  ARG  19           HD2      ARG  19   9.099  -0.144   7.677
    8    HD3  ARG  19           HD3      ARG  19   9.524  -1.018   6.199
    9    HE   ARG  19           HE       ARG  19  10.518  -2.543   8.301
   10   HH21  ARG  19          HH11      ARG  19   9.300  -4.201   9.248
   11   HH22  ARG  19          HH12      ARG  19   7.579  -4.201   9.086
   12   HH11  ARG  19          HH21      ARG  19   7.498  -1.299   7.220
   13   HH12  ARG  19          HH22      ARG  19   6.559  -2.558   7.933

  No H/Q in entry =          13
  In of MODEL   20
    1    H    SER  20           H        SER  20  14.437  -2.411   8.111
    2    HA   SER  20           HA       SER  20  14.149  -1.313  10.648
    3    HB2  SER  20           HB2      SER  20  14.651  -3.629  10.528
    4    HB3  SER  20           HB3      SER  20  16.093  -3.345   9.556
    5    HG   SER  20           HG       SER  20  16.987  -2.278  11.387

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU  21           H        LEU  21  16.980  -1.208   8.498
    2    HA   LEU  21           HA       LEU  21  18.639   0.306  10.226
    3    HB2  LEU  21           HB2      LEU  21  18.606   0.023   7.214
    4    HB3  LEU  21           HB3      LEU  21  19.848   0.915   8.090
    5    HG   LEU  21           HG       LEU  21  19.174  -1.987   8.655
    6   HD13  LEU  21          HD11      LEU  21  20.013  -2.047   6.451
    7   HD12  LEU  21          HD12      LEU  21  21.446  -2.316   7.442
    8   HD11  LEU  21          HD13      LEU  21  21.142  -0.724   6.750
    9   HD22  LEU  21          HD21      LEU  21  20.344  -1.251  10.537
   10   HD21  LEU  21          HD22      LEU  21  21.253  -0.040   9.643
   11   HD23  LEU  21          HD23      LEU  21  21.692  -1.734   9.513

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ALA  22           H        ALA  22  16.348   1.236   7.680
    2    HA   ALA  22           HA       ALA  22  16.843   4.003   7.689
    3    HB3  ALA  22           HB1      ALA  22  15.452   2.736   6.019
    4    HB2  ALA  22           HB2      ALA  22  14.724   4.238   6.587
    5    HB1  ALA  22           HB3      ALA  22  14.161   2.690   7.219

  No H/Q in entry =           5
  In of MODEL   20
    1    H    TYR  23           H        TYR  23  14.384   2.149   9.538
    2    HA   TYR  23           HA       TYR  23  13.393   4.373  10.989
    3    HB2  TYR  23           HB2      TYR  23  12.192   2.239  10.975
    4    HB3  TYR  23           HB3      TYR  23  13.539   1.452  11.797
    5    HD1  TYR  23           HD1      TYR  23  10.986   4.147  12.164
    6    HD2  TYR  23           HD2      TYR  23  13.750   1.530  14.153
    7    HE1  TYR  23           HE1      TYR  23  10.054   4.830  14.360
    8    HE2  TYR  23           HE2      TYR  23  12.818   2.213  16.348
    9    HH   TYR  23           HH       TYR  23  10.222   4.649  16.563

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ALA  24           H        ALA  24  16.076   2.139  11.616
    2    HA   ALA  24           HA       ALA  24  16.743   3.148  14.175
    3    HB1  ALA  24           HB1      ALA  24  18.126   1.376  14.006
    4    HB3  ALA  24           HB2      ALA  24  19.134   2.312  12.901
    5    HB2  ALA  24           HB3      ALA  24  17.853   1.283  12.267

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA  25           H        ALA  25  17.670   4.088  10.891
    2    HA   ALA  25           HA       ALA  25  19.589   6.053  11.525
    3    HB1  ALA  25           HB1      ALA  25  18.876   5.091   9.214
    4    HB3  ALA  25           HB2      ALA  25  19.352   6.786   9.303
    5    HB2  ALA  25           HB3      ALA  25  17.643   6.353   9.243

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU  26           H        LEU  26  16.069   6.228  11.180
    2    HA   LEU  26           HA       LEU  26  15.805   9.006  11.630
    3    HB2  LEU  26           HB2      LEU  26  13.958   7.742  10.712
    4    HB3  LEU  26           HB3      LEU  26  13.889   6.714  12.139
    5    HG   LEU  26           HG       LEU  26  13.261   8.664  13.520
    6   HD12  LEU  26          HD11      LEU  26  12.562  10.753  12.196
    7   HD11  LEU  26          HD12      LEU  26  13.546  10.114  10.882
    8   HD13  LEU  26          HD13      LEU  26  14.292  10.511  12.430
    9   HD21  LEU  26          HD21      LEU  26  11.578   8.323  11.019
   10   HD23  LEU  26          HD22      LEU  26  11.014   9.014  12.537
   11   HD22  LEU  26          HD23      LEU  26  11.491   7.320  12.467

  No H/Q in entry =          11
  In of MODEL   20
    1    H    LYS  27           H        LYS  27  15.748   6.228  13.826
    2    HA   LYS  27           HA       LYS  27  15.147   7.587  16.196
    3    HB2  LYS  27           HB2      LYS  27  15.210   5.112  15.933
    4    HB3  LYS  27           HB3      LYS  27  16.972   5.191  15.881
    5    HG2  LYS  27           HG2      LYS  27  17.019   6.179  18.130
    6    HG3  LYS  27           HG3      LYS  27  15.252   6.172  18.184
    7    HD2  LYS  27           HD2      LYS  27  15.261   3.705  17.949
    8    HD3  LYS  27           HD3      LYS  27  17.026   3.720  17.929
    9    HE2  LYS  27           HE2      LYS  27  17.056   4.711  20.185
   10    HE3  LYS  27           HE3      LYS  27  15.290   4.726  20.208
   11    HZ3  LYS  27           HZ1      LYS  27  16.112   2.786  21.357
   12    HZ2  LYS  27           HZ2      LYS  27  17.028   2.319  20.002
   13    HZ1  LYS  27           HZ3      LYS  27  15.330   2.300  19.930

  No H/Q in entry =          13
  In of MODEL   20
    1    H    GLN  28           H        GLN  28  18.264   7.048  14.589
    2    HA   GLN  28           HA       GLN  28  19.942   8.157  16.571
    3    HB2  GLN  28           HB2      GLN  28  20.216   8.112  13.554
    4    HB3  GLN  28           HB3      GLN  28  21.501   8.603  14.658
    5    HG2  GLN  28           HG2      GLN  28  20.120   5.905  14.704
    6    HG3  GLN  28           HG3      GLN  28  21.698   6.215  13.982
    7   HE21  GLN  28          HE21      GLN  28  20.408   4.923  16.709
    8   HE22  GLN  28          HE22      GLN  28  21.607   5.345  17.834

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ALA  29           H        ALA  29  18.157   9.613  13.886
    2    HA   ALA  29           HA       ALA  29  19.122  12.247  14.131
    3    HB2  ALA  29           HB1      ALA  29  17.408  12.859  12.668
    4    HB1  ALA  29           HB2      ALA  29  16.283  11.671  13.325
    5    HB3  ALA  29           HB3      ALA  29  17.615  11.146  12.296

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LYS  30           H        LYS  30  16.374  10.612  15.667
    2    HA   LYS  30           HA       LYS  30  15.337  12.853  17.027
    3    HB2  LYS  30           HB2      LYS  30  15.267   9.911  17.734
    4    HB3  LYS  30           HB3      LYS  30  14.389  11.151  18.631
    5    HG2  LYS  30           HG2      LYS  30  13.245  11.820  16.517
    6    HG3  LYS  30           HG3      LYS  30  14.063  10.494  15.688
    7    HD2  LYS  30           HD2      LYS  30  13.019   8.874  17.223
    8    HD3  LYS  30           HD3      LYS  30  12.212  10.190  18.076
    9    HE2  LYS  30           HE2      LYS  30  11.026  10.806  15.989
   10    HE3  LYS  30           HE3      LYS  30  11.814   9.461  15.155
   11    HZ2  LYS  30           HZ1      LYS  30   9.515   9.023  16.047
   12    HZ1  LYS  30           HZ2      LYS  30  10.189   9.086  17.611
   13    HZ3  LYS  30           HZ3      LYS  30  10.707   7.906  16.499

  No H/Q in entry =          13
  In of MODEL   20
    1    H    GLN  31           H        GLN  31  18.029  10.718  17.753
    2    HA   GLN  31           HA       GLN  31  18.356  11.739  20.445
    3    HB2  GLN  31           HB2      GLN  31  20.391  10.193  18.832
    4    HB3  GLN  31           HB3      GLN  31  20.264  10.317  20.587
    5    HG2  GLN  31           HG2      GLN  31  17.759   9.333  19.831
    6    HG3  GLN  31           HG3      GLN  31  18.866   8.501  18.746
    7   HE21  GLN  31          HE21      GLN  31  17.349   7.338  21.031
    8   HE22  GLN  31          HE22      GLN  31  18.518   6.692  22.076

  No H/Q in entry =           8
  In of MODEL   20
    1    H    GLY  32           H        GLY  32  18.844  13.061  17.475
    2    HA3  GLY  32           HA2      GLY  32  19.800  15.118  16.954
    3    HA2  GLY  32           HA3      GLY  32  20.565  15.134  18.538

  No H/Q in entry =           3
  In of MODEL   20
    1    H    ASP  33           H        ASP  33  21.015  12.245  16.762
    2    HA   ASP  33           HA       ASP  33  23.829  12.956  16.281
    3    HB2  ASP  33           HB2      ASP  33  22.355  10.321  16.407
    4    HB3  ASP  33           HB3      ASP  33  24.037  10.459  15.904

  No H/Q in entry =           4
  In of MODEL   20
    1    H    PHE  34           H        PHE  34  23.322  14.271  14.401
    2    HA   PHE  34           HA       PHE  34  21.974  13.268  12.121
    3    HB2  PHE  34           HB2      PHE  34  24.079  15.430  12.339
    4    HB3  PHE  34           HB3      PHE  34  23.090  15.125  10.913
    5    HD1  PHE  34           HD1      PHE  34  23.331  17.065  13.823
    6    HD2  PHE  34           HD2      PHE  34  20.469  14.910  11.453
    7    HE1  PHE  34           HE1      PHE  34  21.501  18.440  14.778
    8    HE2  PHE  34           HE2      PHE  34  18.643  16.285  12.411
    9    HZ   PHE  34           HZ       PHE  34  19.163  18.051  14.069

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ALA  35           H        ALA  35  25.356  13.125  13.113
    2    HA   ALA  35           HA       ALA  35  26.460  12.316  10.651
    3    HB3  ALA  35           HB1      ALA  35  28.164  11.170  12.364
    4    HB2  ALA  35           HB2      ALA  35  27.292  12.185  13.513
    5    HB1  ALA  35           HB3      ALA  35  28.113  12.919  12.135

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA  36           H        ALA  36  25.384  10.348  13.424
    2    HA   ALA  36           HA       ALA  36  25.895   7.866  12.148
    3    HB2  ALA  36           HB1      ALA  36  25.484   7.116  14.226
    4    HB3  ALA  36           HB2      ALA  36  23.789   7.588  14.084
    5    HB1  ALA  36           HB3      ALA  36  24.978   8.736  14.700

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA  37           H        ALA  37  23.045   9.954  12.294
    2    HA   ALA  37           HA       ALA  37  21.208   8.158  11.128
    3    HB3  ALA  37           HB1      ALA  37  21.394  11.124  11.417
    4    HB1  ALA  37           HB2      ALA  37  20.099  10.028  11.897
    5    HB2  ALA  37           HB3      ALA  37  20.274  10.501  10.206

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LYS  38           H        LYS  38  23.266  10.647   9.637
    2    HA   LYS  38           HA       LYS  38  22.619  10.208   6.963
    3    HB2  LYS  38           HB2      LYS  38  24.414  11.792   8.398
    4    HB3  LYS  38           HB3      LYS  38  25.456  10.816   7.368
    5    HG2  LYS  38           HG2      LYS  38  24.271  11.568   5.377
    6    HG3  LYS  38           HG3      LYS  38  23.069  12.407   6.364
    7    HD2  LYS  38           HD2      LYS  38  24.645  14.028   7.107
    8    HD3  LYS  38           HD3      LYS  38  26.016  13.061   6.565
    9    HE2  LYS  38           HE2      LYS  38  25.625  14.926   5.014
   10    HE3  LYS  38           HE3      LYS  38  25.308  13.383   4.213
   11    HZ3  LYS  38           HZ1      LYS  38  23.105  13.796   4.093
   12    HZ2  LYS  38           HZ2      LYS  38  23.605  15.419   4.177
   13    HZ1  LYS  38           HZ3      LYS  38  23.049  14.628   5.572

  No H/Q in entry =          13
  In of MODEL   20
    1    H    ALA  39           H        ALA  39  25.165   8.648   8.908
    2    HA   ALA  39           HA       ALA  39  26.247   7.073   6.835
    3    HB2  ALA  39           HB1      ALA  39  26.186   6.111   9.680
    4    HB1  ALA  39           HB2      ALA  39  27.116   7.550   9.258
    5    HB3  ALA  39           HB3      ALA  39  27.486   6.004   8.494

  No H/Q in entry =           5
  In of MODEL   20
    1    H    MET  40           H        MET  40  23.654   6.422   9.146
    2    HA   MET  40           HA       MET  40  23.247   3.710   8.417
    3    HB2  MET  40           HB2      MET  40  21.407   5.728   9.716
    4    HB3  MET  40           HB3      MET  40  21.025   4.013   9.545
    5    HG2  MET  40           HG2      MET  40  23.567   4.992  10.872
    6    HG3  MET  40           HG3      MET  40  22.081   4.695  11.773
    7    HE3  MET  40           HE1      MET  40  21.572   1.054  11.954
    8    HE2  MET  40           HE2      MET  40  20.680   2.343  11.150
    9    HE1  MET  40           HE3      MET  40  21.425   2.643  12.719

  No H/Q in entry =           9
  In of MODEL   20
    1    H    MET  41           H        MET  41  21.783   6.741   7.234
    2    HA   MET  41           HA       MET  41  19.835   5.515   5.572
    3    HB2  MET  41           HB2      MET  41  21.275   8.127   5.050
    4    HB3  MET  41           HB3      MET  41  19.751   7.610   4.339
    5    HG2  MET  41           HG2      MET  41  19.021   7.413   6.894
    6    HG3  MET  41           HG3      MET  41  20.313   8.590   7.109
    7    HE2  MET  41           HE1      MET  41  19.715   9.866   3.774
    8    HE1  MET  41           HE2      MET  41  20.672  10.321   5.180
    9    HE3  MET  41           HE3      MET  41  19.380  11.381   4.622

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ASP  42           H        ASP  42  23.191   6.488   5.002
    2    HA   ASP  42           HA       ASP  42  23.276   6.013   2.244
    3    HB2  ASP  42           HB2      ASP  42  25.021   7.038   4.004
    4    HB3  ASP  42           HB3      ASP  42  25.702   5.423   3.874

  No H/Q in entry =           4
  In of MODEL   20
    1    H    GLN  43           H        GLN  43  24.046   3.872   4.963
    2    HA   GLN  43           HA       GLN  43  24.737   1.623   3.379
    3    HB2  GLN  43           HB2      GLN  43  23.726   1.794   6.227
    4    HB3  GLN  43           HB3      GLN  43  24.323   0.313   5.470
    5    HG2  GLN  43           HG2      GLN  43  26.465   1.556   4.948
    6    HG3  GLN  43           HG3      GLN  43  25.868   2.875   5.949
    7   HE21  GLN  43          HE21      GLN  43  28.120   1.937   6.975
    8   HE22  GLN  43          HE22      GLN  43  27.869   0.851   8.254

  No H/Q in entry =           8
  In of MODEL   20
    1    H    SER  44           H        SER  44  21.671   2.712   4.778
    2    HA   SER  44           HA       SER  44  20.133   0.445   4.115
    3    HB2  SER  44           HB2      SER  44  19.659   2.967   5.261
    4    HB3  SER  44           HB3      SER  44  18.618   2.908   3.841
    5    HG   SER  44           HG       SER  44  17.548   1.949   5.570

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ARG  45           H        ARG  45  20.822   3.419   2.304
    2    HA   ARG  45           HA       ARG  45  19.293   2.908   0.007
    3    HB2  ARG  45           HB2      ARG  45  20.407   5.061   0.584
    4    HB3  ARG  45           HB3      ARG  45  21.961   4.329   0.191
    5    HG2  ARG  45           HG2      ARG  45  21.172   3.910  -2.119
    6    HG3  ARG  45           HG3      ARG  45  19.630   4.665  -1.725
    7    HD2  ARG  45           HD2      ARG  45  20.852   6.781  -1.149
    8    HD3  ARG  45           HD3      ARG  45  22.357   6.029  -1.724
    9    HE   ARG  45           HE       ARG  45  20.420   5.761  -3.750
   10   HH21  ARG  45          HH11      ARG  45  20.384   7.128  -5.514
   11   HH22  ARG  45          HH12      ARG  45  21.118   8.690  -5.415
   12   HH11  ARG  45          HH21      ARG  45  22.121   8.286  -2.134
   13   HH12  ARG  45          HH22      ARG  45  22.101   9.345  -3.498

  No H/Q in entry =          13
  In of MODEL   20
    1    H    MET  46           H        MET  46  22.673   2.083   0.738
    2    HA   MET  46           HA       MET  46  23.283   0.897  -1.748
    3    HB2  MET  46           HB2      MET  46  24.410   0.562   1.035
    4    HB3  MET  46           HB3      MET  46  25.082  -0.281  -0.364
    5    HG2  MET  46           HG2      MET  46  25.033   2.148  -1.433
    6    HG3  MET  46           HG3      MET  46  25.068   2.652   0.251
    7    HE3  MET  46           HE1      MET  46  28.059   0.443   1.540
    8    HE2  MET  46           HE2      MET  46  26.882  -0.591   0.738
    9    HE1  MET  46           HE3      MET  46  26.329   0.729   1.767

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ALA  47           H        ALA  47  21.936  -0.453   1.236
    2    HA   ALA  47           HA       ALA  47  21.916  -3.167   0.437
    3    HB2  ALA  47           HB1      ALA  47  21.544  -2.709   2.743
    4    HB3  ALA  47           HB2      ALA  47  20.012  -3.335   2.133
    5    HB1  ALA  47           HB3      ALA  47  20.219  -1.600   2.388

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU  48           H        LEU  48  19.525  -0.574   0.090
    2    HA   LEU  48           HA       LEU  48  17.495  -2.137  -1.147
    3    HB2  LEU  48           HB2      LEU  48  18.107   0.826  -1.269
    4    HB3  LEU  48           HB3      LEU  48  16.642   0.095  -1.926
    5    HG   LEU  48           HG       LEU  48  17.517  -0.192   0.958
    6   HD13  LEU  48          HD11      LEU  48  17.066   2.103   0.771
    7   HD12  LEU  48          HD12      LEU  48  15.520   1.434   1.290
    8   HD11  LEU  48          HD13      LEU  48  15.775   1.858  -0.403
    9   HD22  LEU  48          HD21      LEU  48  16.009  -1.928   0.588
   10   HD21  LEU  48          HD22      LEU  48  15.116  -1.039  -0.646
   11   HD23  LEU  48          HD23      LEU  48  14.908  -0.635   1.058

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ASN  49           H        ASN  49  20.149  -0.173  -2.396
    2    HA   ASN  49           HA       ASN  49  19.483  -0.269  -5.116
    3    HB2  ASN  49           HB2      ASN  49  21.142   1.275  -4.230
    4    HB3  ASN  49           HB3      ASN  49  22.186  -0.060  -3.759
    5   HD21  ASN  49          HD21      ASN  49  20.674   1.397  -6.666
    6   HD22  ASN  49          HD22      ASN  49  21.928   0.959  -7.721

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLU  50           H        GLU  50  21.508  -2.434  -3.163
    2    HA   GLU  50           HA       GLU  50  22.221  -4.183  -5.291
    3    HB2  GLU  50           HB2      GLU  50  23.431  -4.139  -3.132
    4    HB3  GLU  50           HB3      GLU  50  22.002  -4.785  -2.326
    5    HG2  GLU  50           HG2      GLU  50  22.111  -6.819  -3.683
    6    HG3  GLU  50           HG3      GLU  50  23.472  -6.169  -4.593

  No H/Q in entry =           6
  In of MODEL   20
    1    H    ALA  51           H        ALA  51  19.578  -4.150  -2.948
    2    HA   ALA  51           HA       ALA  51  18.441  -6.640  -3.695
    3    HB3  ALA  51           HB1      ALA  51  16.851  -6.153  -2.130
    4    HB1  ALA  51           HB2      ALA  51  16.612  -4.511  -2.730
    5    HB2  ALA  51           HB3      ALA  51  17.983  -4.877  -1.682

  No H/Q in entry =           5
  In of MODEL   20
    1    H    HIS  52           H        HIS  52  17.803  -3.302  -4.731
    2    HA   HIS  52           HA       HIS  52  15.686  -3.859  -6.517
    3    HB2  HIS  52           HB2      HIS  52  16.250  -1.585  -5.754
    4    HB3  HIS  52           HB3      HIS  52  17.762  -1.659  -6.657
    5    HD1  HIS  52           HD1      HIS  52  17.499  -1.953  -9.328
    6    HD2  HIS  52           HD2      HIS  52  14.045  -0.832  -7.281
    7    HE1  HIS  52           HE1      HIS  52  15.887  -1.070 -11.071
    8    HE2  HIS  52           HE2      HIS  52  13.777  -0.383  -9.838

  No H/Q in entry =           8
  In of MODEL   20
    1    H    LEU  53           H        LEU  53  19.202  -3.818  -6.971
    2    HA   LEU  53           HA       LEU  53  19.245  -4.138  -9.772
    3    HB2  LEU  53           HB2      LEU  53  21.202  -4.871  -7.608
    4    HB3  LEU  53           HB3      LEU  53  21.513  -5.253  -9.300
    5    HG   LEU  53           HG       LEU  53  20.796  -2.452  -8.384
    6   HD12  LEU  53          HD11      LEU  53  23.248  -1.989  -8.517
    7   HD11  LEU  53          HD12      LEU  53  23.531  -3.718  -8.711
    8   HD13  LEU  53          HD13      LEU  53  22.837  -3.104  -7.216
    9   HD21  LEU  53          HD21      LEU  53  21.938  -3.676 -10.904
   10   HD23  LEU  53          HD22      LEU  53  22.219  -1.982 -10.519
   11   HD22  LEU  53          HD23      LEU  53  20.582  -2.564 -10.757

  No H/Q in entry =          11
  In of MODEL   20
    1    H    VAL  54           H        VAL  54  19.182  -6.521  -7.141
    2    HA   VAL  54           HA       VAL  54  19.327  -8.817  -8.798
    3    HB   VAL  54           HB       VAL  54  18.184  -8.404  -6.024
    4   HG12  VAL  54          HG11      VAL  54  18.545 -11.017  -6.017
    5   HG11  VAL  54          HG12      VAL  54  18.346 -10.854  -7.762
    6   HG13  VAL  54          HG13      VAL  54  17.057 -10.340  -6.676
    7   HG22  VAL  54          HG21      VAL  54  20.498  -8.161  -5.816
    8   HG21  VAL  54          HG22      VAL  54  20.842  -9.250  -7.158
    9   HG23  VAL  54          HG23      VAL  54  20.331  -9.902  -5.601

  No H/Q in entry =           9
  In of MODEL   20
    1    H    GLN  55           H        GLN  55  16.580  -6.950  -7.501
    2    HA   GLN  55           HA       GLN  55  14.576  -8.644  -8.559
    3    HB2  GLN  55           HB2      GLN  55  13.816  -7.126  -6.931
    4    HB3  GLN  55           HB3      GLN  55  14.585  -5.748  -7.714
    5    HG2  GLN  55           HG2      GLN  55  12.847  -5.451  -9.193
    6    HG3  GLN  55           HG3      GLN  55  12.549  -7.176  -9.358
    7   HE21  GLN  55          HE21      GLN  55  10.555  -7.753  -8.540
    8   HE22  GLN  55          HE22      GLN  55   9.779  -7.007  -7.228

  No H/Q in entry =           8
  In of MODEL   20
    1    H    THR  56           H        THR  56  16.267  -5.822  -9.935
    2    HA   THR  56           HA       THR  56  14.809  -5.485 -12.274
    3    HB   THR  56           HB       THR  56  17.810  -5.284 -11.910
    4    HG1  THR  56           HG1      THR  56  15.681  -3.426 -11.716
    5   HG22  THR  56          HG21      THR  56  17.665  -3.754 -13.878
    6   HG21  THR  56          HG22      THR  56  15.975  -4.219 -14.072
    7   HG23  THR  56          HG23      THR  56  17.249  -5.423 -14.275

  No H/Q in entry =           7
  In of MODEL   20
    1    H    LYS  57           H        LYS  57  17.495  -7.743 -11.676
    2    HA   LYS  57           HA       LYS  57  17.497  -8.942 -14.252
    3    HB2  LYS  57           HB2      LYS  57  19.305  -9.168 -12.527
    4    HB3  LYS  57           HB3      LYS  57  18.221 -10.165 -11.568
    5    HG2  LYS  57           HG2      LYS  57  18.110 -11.822 -13.373
    6    HG3  LYS  57           HG3      LYS  57  19.153 -10.824 -14.378
    7    HD2  LYS  57           HD2      LYS  57  20.966 -11.038 -12.708
    8    HD3  LYS  57           HD3      LYS  57  19.928 -12.059 -11.715
    9    HE2  LYS  57           HE2      LYS  57  19.781 -13.709 -13.553
   10    HE3  LYS  57           HE3      LYS  57  20.818 -12.697 -14.557
   11    HZ2  LYS  57           HZ1      LYS  57  21.787 -14.628 -13.099
   12    HZ1  LYS  57           HZ2      LYS  57  21.782 -13.428 -11.898
   13    HZ3  LYS  57           HZ3      LYS  57  22.648 -13.188 -13.339

  No H/Q in entry =          13
  In of MODEL   20
    1    H    LEU  58           H        LEU  58  15.745  -9.630 -11.264
    2    HA   LEU  58           HA       LEU  58  14.553 -12.023 -12.186
    3    HB2  LEU  58           HB2      LEU  58  13.744 -10.125  -9.989
    4    HB3  LEU  58           HB3      LEU  58  12.959 -11.675 -10.297
    5    HG   LEU  58           HG       LEU  58  15.931 -11.352  -9.762
    6   HD11  LEU  58          HD11      LEU  58  13.578 -11.801  -7.953
    7   HD13  LEU  58          HD12      LEU  58  15.018 -10.816  -7.702
    8   HD12  LEU  58          HD13      LEU  58  15.118 -12.570  -7.564
    9   HD22  LEU  58          HD21      LEU  58  15.837 -13.417 -10.785
   10   HD21  LEU  58          HD22      LEU  58  14.129 -13.652 -10.413
   11   HD23  LEU  58          HD23      LEU  58  15.350 -13.932  -9.171

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  59           H        ILE  59  13.828  -8.698 -12.871
    2    HA   ILE  59           HA       ILE  59  11.116  -9.389 -13.792
    3    HB   ILE  59           HB       ILE  59  11.898  -7.092 -12.597
    4   HG12  ILE  59          HG12      ILE  59   9.968  -7.002 -14.926
    5   HG13  ILE  59          HG13      ILE  59   9.575  -7.779 -13.414
    6   HG22  ILE  59          HG21      ILE  59  11.934  -6.278 -15.489
    7   HG21  ILE  59          HG22      ILE  59  13.426  -6.687 -14.674
    8   HG23  ILE  59          HG23      ILE  59  12.433  -5.352 -14.094
    9   HD12  ILE  59          HD11      ILE  59  10.349  -4.886 -13.775
   10   HD11  ILE  59          HD12      ILE  59  10.074  -5.652 -12.212
   11   HD13  ILE  59          HD13      ILE  59   8.745  -5.490 -13.360

  No H/Q in entry =          11
  In of MODEL   20
    1    H    GLU  60           H        GLU  60  14.299  -8.492 -15.073
    2    HA   GLU  60           HA       GLU  60  13.496  -8.109 -17.777
    3    HB2  GLU  60           HB2      GLU  60  15.664  -7.331 -16.970
    4    HB3  GLU  60           HB3      GLU  60  16.155  -8.986 -16.615
    5    HG2  GLU  60           HG2      GLU  60  15.287  -8.241 -19.400
    6    HG3  GLU  60           HG3      GLU  60  16.930  -7.897 -18.863

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLY  61           H        GLY  61  14.528 -10.972 -15.962
    2    HA3  GLY  61           HA2      GLY  61  13.996 -12.632 -18.357
    3    HA2  GLY  61           HA3      GLY  61  15.044 -13.095 -17.020

  No H/Q in entry =           3
  In of MODEL   20
    1    H    ASP  62           H        ASP  62  11.904 -11.596 -16.631
    2    HA   ASP  62           HA       ASP  62  11.020 -13.655 -14.861
    3    HB2  ASP  62           HB2      ASP  62   8.944 -12.336 -14.771
    4    HB3  ASP  62           HB3      ASP  62  10.370 -11.332 -14.529

  No H/Q in entry =           4
  In of MODEL   20
    1    H    ALA  63           H        ALA  63  11.546 -15.079 -17.136
    2    HA   ALA  63           HA       ALA  63   9.377 -15.384 -18.954
    3    HB1  ALA  63           HB1      ALA  63  10.470 -17.369 -19.673
    4    HB3  ALA  63           HB2      ALA  63  11.258 -17.592 -18.112
    5    HB2  ALA  63           HB3      ALA  63  11.765 -16.280 -19.177

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLY  64           H        GLY  64  10.186 -16.926 -15.886
    2    HA3  GLY  64           HA2      GLY  64   8.987 -18.242 -14.442
    3    HA2  GLY  64           HA3      GLY  64   7.565 -17.410 -15.058

  No H/Q in entry =           3
  In of MODEL   20
    1    H    GLU  65           H        GLU  65   6.083 -18.968 -15.462
    2    HA   GLU  65           HA       GLU  65   6.674 -21.626 -16.099
    3    HB2  GLU  65           HB2      GLU  65   4.170 -20.012 -16.563
    4    HB3  GLU  65           HB3      GLU  65   4.275 -21.753 -16.826
    5    HG2  GLU  65           HG2      GLU  65   4.916 -22.103 -14.496
    6    HG3  GLU  65           HG3      GLU  65   4.920 -20.364 -14.209

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLY  66           H        GLY  66   5.199 -22.429 -18.138
    2    HA3  GLY  66           HA2      GLY  66   6.863 -22.200 -20.395
    3    HA2  GLY  66           HA3      GLY  66   5.287 -22.964 -20.348

  No H/Q in entry =           3
  In of MODEL   20
    1    H    LYS  67           H        LYS  67   3.838 -20.620 -19.585
    2    HA   LYS  67           HA       LYS  67   3.505 -19.460 -22.198
    3    HB2  LYS  67           HB2      LYS  67   1.996 -19.164 -19.605
    4    HB3  LYS  67           HB3      LYS  67   1.538 -18.343 -21.103
    5    HG2  LYS  67           HG2      LYS  67   1.411 -20.512 -22.266
    6    HG3  LYS  67           HG3      LYS  67   1.881 -21.341 -20.783
    7    HD2  LYS  67           HD2      LYS  67  -0.151 -20.566 -19.666
    8    HD3  LYS  67           HD3      LYS  67  -0.611 -19.645 -21.100
    9    HE2  LYS  67           HE2      LYS  67  -1.814 -21.776 -21.083
   10    HE3  LYS  67           HE3      LYS  67  -0.656 -21.760 -22.412
   11    HZ1  LYS  67           HZ1      LYS  67   0.351 -22.769 -19.889
   12    HZ3  LYS  67           HZ2      LYS  67   0.590 -23.347 -21.467
   13    HZ2  LYS  67           HZ3      LYS  67  -0.837 -23.727 -20.627

  No H/Q in entry =          13
  In of MODEL   20
    1    H    MET  68           H        MET  68   2.677 -17.057 -22.049
    2    HA   MET  68           HA       MET  68   4.966 -15.424 -21.891
    3    HB2  MET  68           HB2      MET  68   2.036 -14.782 -22.192
    4    HB3  MET  68           HB3      MET  68   3.316 -13.575 -22.315
    5    HG2  MET  68           HG2      MET  68   4.342 -14.796 -24.163
    6    HG3  MET  68           HG3      MET  68   3.146 -16.082 -24.009
    7    HE1  MET  68           HE1      MET  68   4.009 -12.578 -24.620
    8    HE3  MET  68           HE2      MET  68   2.528 -12.009 -23.858
    9    HE2  MET  68           HE3      MET  68   2.727 -11.854 -25.602

  No H/Q in entry =           9
  In of MODEL   20
    1    H    LYS  69           H        LYS  69   2.984 -16.411 -19.324
    2    HA   LYS  69           HA       LYS  69   2.775 -14.042 -17.820
    3    HB2  LYS  69           HB2      LYS  69   2.729 -16.944 -17.001
    4    HB3  LYS  69           HB3      LYS  69   2.404 -15.618 -15.882
    5    HG2  LYS  69           HG2      LYS  69   0.590 -14.812 -17.333
    6    HG3  LYS  69           HG3      LYS  69   0.924 -16.107 -18.483
    7    HD2  LYS  69           HD2      LYS  69   0.409 -17.777 -16.718
    8    HD3  LYS  69           HD3      LYS  69   0.006 -16.459 -15.614
    9    HE2  LYS  69           HE2      LYS  69  -1.354 -17.005 -18.270
   10    HE3  LYS  69           HE3      LYS  69  -2.026 -17.375 -16.682
   11    HZ3  LYS  69           HZ1      LYS  69  -2.871 -15.336 -16.746
   12    HZ2  LYS  69           HZ2      LYS  69  -1.914 -14.878 -18.073
   13    HZ1  LYS  69           HZ3      LYS  69  -1.296 -14.760 -16.494

  No H/Q in entry =          13
  In of MODEL   20
    1    H    VAL  70           H        VAL  70   3.672 -14.283 -15.317
    2    HA   VAL  70           HA       VAL  70   6.622 -14.511 -15.467
    3    HB   VAL  70           HB       VAL  70   6.775 -12.455 -14.090
    4   HG11  VAL  70          HG11      VAL  70   5.359 -12.302 -16.759
    5   HG13  VAL  70          HG12      VAL  70   7.086 -12.137 -16.438
    6   HG12  VAL  70          HG13      VAL  70   5.970 -10.868 -15.934
    7   HG21  VAL  70          HG21      VAL  70   3.767 -12.527 -14.433
    8   HG23  VAL  70          HG22      VAL  70   4.614 -11.013 -14.121
    9   HG22  VAL  70          HG23      VAL  70   4.692 -12.325 -12.945

  No H/Q in entry =           9
  In of MODEL   20
    1    H    SER  71           H        SER  71   7.613 -14.625 -13.289
    2    HA   SER  71           HA       SER  71   6.476 -16.643 -11.672
    3    HB2  SER  71           HB2      SER  71   8.908 -16.154 -11.772
    4    HB3  SER  71           HB3      SER  71   8.619 -14.629 -10.935
    5    HG   SER  71           HG       SER  71   8.632 -17.223  -9.990

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU  72           H        LEU  72   5.136 -16.559  -9.957
    2    HA   LEU  72           HA       LEU  72   3.555 -14.269  -9.507
    3    HB2  LEU  72           HB2      LEU  72   3.890 -16.821  -7.938
    4    HB3  LEU  72           HB3      LEU  72   2.709 -15.580  -7.527
    5    HG   LEU  72           HG       LEU  72   2.862 -16.881 -10.266
    6   HD12  LEU  72          HD11      LEU  72   0.838 -18.156  -9.483
    7   HD11  LEU  72          HD12      LEU  72   1.160 -17.567  -7.853
    8   HD13  LEU  72          HD13      LEU  72   2.328 -18.613  -8.659
    9   HD21  LEU  72          HD21      LEU  72   0.985 -14.974  -8.888
   10   HD23  LEU  72          HD22      LEU  72   0.345 -16.057 -10.112
   11   HD22  LEU  72          HD23      LEU  72   1.611 -14.909 -10.531

  No H/Q in entry =          11
  In of MODEL   20
    1    H    VAL  73           H        VAL  73   6.242 -15.663  -7.747
    2    HA   VAL  73           HA       VAL  73   6.172 -14.128  -5.417
    3    HB   VAL  73           HB       VAL  73   8.372 -14.901  -5.003
    4   HG13  VAL  73          HG11      VAL  73   8.156 -17.263  -5.417
    5   HG12  VAL  73          HG12      VAL  73   7.111 -16.979  -6.809
    6   HG11  VAL  73          HG13      VAL  73   6.530 -16.624  -5.182
    7   HG22  VAL  73          HG21      VAL  73   9.688 -14.329  -6.834
    8   HG21  VAL  73          HG22      VAL  73   8.528 -14.968  -7.998
    9   HG23  VAL  73          HG23      VAL  73   9.543 -16.071  -7.068

  No H/Q in entry =           9
  In of MODEL   20
    1    H    LEU  74           H        LEU  74   7.131 -13.224  -8.599
    2    HA   LEU  74           HA       LEU  74   9.050 -11.246  -8.120
    3    HB2  LEU  74           HB2      LEU  74   8.599 -11.999 -10.355
    4    HB3  LEU  74           HB3      LEU  74   6.921 -11.469 -10.246
    5    HG   LEU  74           HG       LEU  74   7.679  -9.124 -10.032
    6   HD13  LEU  74          HD11      LEU  74   9.815  -9.306  -8.993
    7   HD12  LEU  74          HD12      LEU  74  10.155  -8.755 -10.632
    8   HD11  LEU  74          HD13      LEU  74  10.393 -10.449 -10.205
    9   HD21  LEU  74          HD21      LEU  74   7.423 -10.544 -12.250
   10   HD23  LEU  74          HD22      LEU  74   9.136 -10.205 -12.366
   11   HD22  LEU  74          HD23      LEU  74   7.997  -8.878 -12.296

  No H/Q in entry =          11
  In of MODEL   20
    1    H    VAL  75           H        VAL  75   5.547 -10.913  -8.455
    2    HA   VAL  75           HA       VAL  75   5.413  -8.158  -7.871
    3    HB   VAL  75           HB       VAL  75   3.360 -10.336  -7.480
    4   HG11  VAL  75          HG11      VAL  75   3.120  -7.300  -7.294
    5   HG13  VAL  75          HG12      VAL  75   2.850  -8.452  -5.994
    6   HG12  VAL  75          HG13      VAL  75   1.752  -8.406  -7.364
    7   HG22  VAL  75          HG21      VAL  75   4.069  -9.924  -9.807
    8   HG21  VAL  75          HG22      VAL  75   3.780  -8.198  -9.599
    9   HG23  VAL  75          HG23      VAL  75   2.429  -9.330  -9.554

  No H/Q in entry =           9
  In of MODEL   20
    1    H    GLU  76           H        GLU  76   5.212 -11.035  -5.757
    2    HA   GLU  76           HA       GLU  76   4.734  -9.678  -3.335
    3    HB2  GLU  76           HB2      GLU  76   4.591 -12.145  -3.555
    4    HB3  GLU  76           HB3      GLU  76   6.324 -12.223  -3.819
    5    HG2  GLU  76           HG2      GLU  76   5.922 -12.806  -1.515
    6    HG3  GLU  76           HG3      GLU  76   6.650 -11.210  -1.516

  No H/Q in entry =           6
  In of MODEL   20
    1    H    ALA  77           H        ALA  77   7.799 -10.542  -4.912
    2    HA   ALA  77           HA       ALA  77   9.483  -9.471  -2.905
    3    HB2  ALA  77           HB1      ALA  77  11.222  -9.464  -4.680
    4    HB3  ALA  77           HB2      ALA  77   9.973  -9.833  -5.870
    5    HB1  ALA  77           HB3      ALA  77  10.348 -10.993  -4.597

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLN  78           H        GLN  78   8.056  -8.078  -5.815
    2    HA   GLN  78           HA       GLN  78   9.373  -5.580  -5.720
    3    HB2  GLN  78           HB2      GLN  78   8.084  -6.513  -7.672
    4    HB3  GLN  78           HB3      GLN  78   6.598  -6.162  -6.789
    5    HG2  GLN  78           HG2      GLN  78   7.208  -3.781  -6.698
    6    HG3  GLN  78           HG3      GLN  78   8.699  -4.123  -7.574
    7   HE21  GLN  78          HE21      GLN  78   6.779  -2.331  -8.681
    8   HE22  GLN  78          HE22      GLN  78   6.082  -3.058 -10.047

  No H/Q in entry =           8
  In of MODEL   20
    1    H    LEU  79           H        LEU  79   6.377  -6.759  -4.275
    2    HA   LEU  79           HA       LEU  79   5.354  -4.364  -3.264
    3    HB2  LEU  79           HB2      LEU  79   4.069  -6.434  -3.200
    4    HB3  LEU  79           HB3      LEU  79   5.229  -7.156  -2.089
    5    HG   LEU  79           HG       LEU  79   4.661  -5.519  -0.362
    6   HD13  LEU  79          HD11      LEU  79   4.162  -3.513  -1.413
    7   HD12  LEU  79          HD12      LEU  79   2.546  -4.061  -0.966
    8   HD11  LEU  79          HD13      LEU  79   3.123  -4.277  -2.617
    9   HD23  LEU  79          HD21      LEU  79   2.082  -6.048  -0.260
   10   HD22  LEU  79          HD22      LEU  79   3.240  -7.371  -0.154
   11   HD21  LEU  79          HD23      LEU  79   2.416  -7.047  -1.676

  No H/Q in entry =          11
  In of MODEL   20
    1    H    HIS  80           H        HIS  80   7.576  -6.666  -1.688
    2    HA   HIS  80           HA       HIS  80   7.851  -5.117   0.678
    3    HB2  HIS  80           HB2      HIS  80   9.218  -7.464  -0.523
    4    HB3  HIS  80           HB3      HIS  80  10.121  -6.553   0.689
    5    HD1  HIS  80           HD1      HIS  80   9.648  -7.192   3.035
    6    HD2  HIS  80           HD2      HIS  80   6.434  -8.091   0.537
    7    HE1  HIS  80           HE1      HIS  80   7.898  -8.318   4.492
    8    HE2  HIS  80           HE2      HIS  80   5.932  -8.870   2.977

  No H/Q in entry =           8
  In of MODEL   20
    1    H    LEU  81           H        LEU  81   9.849  -5.369  -2.242
    2    HA   LEU  81           HA       LEU  81  11.873  -3.599  -1.374
    3    HB2  LEU  81           HB2      LEU  81  10.952  -4.408  -4.132
    4    HB3  LEU  81           HB3      LEU  81  12.359  -3.382  -3.848
    5    HG   LEU  81           HG       LEU  81  12.008  -6.107  -2.570
    6   HD12  LEU  81          HD11      LEU  81  13.826  -6.711  -4.325
    7   HD11  LEU  81          HD12      LEU  81  13.238  -5.296  -5.197
    8   HD13  LEU  81          HD13      LEU  81  12.145  -6.635  -4.853
    9   HD23  LEU  81          HD21      LEU  81  14.632  -5.756  -2.566
   10   HD22  LEU  81          HD22      LEU  81  13.645  -5.007  -1.313
   11   HD21  LEU  81          HD23      LEU  81  14.205  -4.050  -2.684

  No H/Q in entry =          11
  In of MODEL   20
    1    H    MET  82           H        MET  82   8.934  -3.005  -3.300
    2    HA   MET  82           HA       MET  82   9.436  -0.273  -3.807
    3    HB2  MET  82           HB2      MET  82   6.898  -1.900  -3.670
    4    HB3  MET  82           HB3      MET  82   6.874  -0.176  -4.036
    5    HG2  MET  82           HG2      MET  82   8.496  -2.231  -5.575
    6    HG3  MET  82           HG3      MET  82   6.919  -1.630  -6.082
    7    HE3  MET  82           HE1      MET  82   7.317   1.829  -7.261
    8    HE2  MET  82           HE2      MET  82   6.952   1.600  -5.552
    9    HE1  MET  82           HE3      MET  82   6.297   0.480  -6.743

  No H/Q in entry =           9
  In of MODEL   20
    1    H    THR  83           H        THR  83   7.675  -1.891  -1.193
    2    HA   THR  83           HA       THR  83   6.798   0.448   0.134
    3    HB   THR  83           HB       THR  83   6.692  -1.125   2.154
    4    HG1  THR  83           HG1      THR  83   7.473  -3.066   1.924
    5   HG22  THR  83          HG21      THR  83   5.054  -2.714   0.694
    6   HG21  THR  83          HG22      THR  83   5.259  -1.384  -0.440
    7   HG23  THR  83          HG23      THR  83   4.620  -1.075   1.175

  No H/Q in entry =           7
  In of MODEL   20
    1    H    SER  84           H        SER  84   9.651  -1.612   0.647
    2    HA   SER  84           HA       SER  84  10.700  -0.166   2.829
    3    HB2  SER  84           HB2      SER  84  11.969  -1.995   0.802
    4    HB3  SER  84           HB3      SER  84  12.911  -1.228   2.079
    5    HG   SER  84           HG       SER  84  10.658  -2.946   2.349

  No H/Q in entry =           5
  In of MODEL   20
    1    H    MET  85           H        MET  85  11.437   0.100  -0.662
    2    HA   MET  85           HA       MET  85  13.411   2.091  -0.421
    3    HB2  MET  85           HB2      MET  85  13.021   0.800  -2.483
    4    HB3  MET  85           HB3      MET  85  11.485   1.637  -2.708
    5    HG2  MET  85           HG2      MET  85  12.656   3.793  -2.849
    6    HG3  MET  85           HG3      MET  85  14.196   2.986  -2.571
    7    HE3  MET  85           HE1      MET  85  11.123   1.694  -5.000
    8    HE2  MET  85           HE2      MET  85  11.492   2.892  -6.237
    9    HE1  MET  85           HE3      MET  85  11.138   3.418  -4.596

  No H/Q in entry =           9
  In of MODEL   20
    1    H    LEU  86           H        LEU  86   9.915   2.381  -0.917
    2    HA   LEU  86           HA       LEU  86   9.816   5.193  -1.103
    3    HB2  LEU  86           HB2      LEU  86   7.990   3.510  -1.670
    4    HB3  LEU  86           HB3      LEU  86   7.668   3.418   0.062
    5    HG   LEU  86           HG       LEU  86   7.475   5.977   0.006
    6   HD11  LEU  86          HD11      LEU  86   8.247   5.547  -2.698
    7   HD13  LEU  86          HD12      LEU  86   7.795   7.070  -1.938
    8   HD12  LEU  86          HD13      LEU  86   6.567   6.091  -2.737
    9   HD23  LEU  86          HD21      LEU  86   5.352   4.596  -1.646
   10   HD22  LEU  86          HD22      LEU  86   5.151   5.855  -0.431
   11   HD21  LEU  86          HD23      LEU  86   5.573   4.216   0.062

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ALA  87           H        ALA  87   9.387   3.013   1.648
    2    HA   ALA  87           HA       ALA  87   8.822   4.923   3.617
    3    HB1  ALA  87           HB1      ALA  87   9.663   2.112   3.531
    4    HB3  ALA  87           HB2      ALA  87   8.533   2.912   4.620
    5    HB2  ALA  87           HB3      ALA  87  10.262   2.965   4.958

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ARG  88           H        ARG  88  11.919   3.534   2.627
    2    HA   ARG  88           HA       ARG  88  13.519   4.934   4.451
    3    HB2  ARG  88           HB2      ARG  88  14.205   2.967   3.047
    4    HB3  ARG  88           HB3      ARG  88  14.340   4.060   1.673
    5    HG2  ARG  88           HG2      ARG  88  15.804   5.394   3.612
    6    HG3  ARG  88           HG3      ARG  88  16.147   3.709   3.992
    7    HD2  ARG  88           HD2      ARG  88  17.410   3.425   2.140
    8    HD3  ARG  88           HD3      ARG  88  16.259   4.281   1.110
    9    HE   ARG  88           HE       ARG  88  18.644   5.375   2.147
   10   HH21  ARG  88          HH11      ARG  88  18.962   7.598   1.948
   11   HH22  ARG  88          HH12      ARG  88  17.598   8.653   1.809
   12   HH11  ARG  88          HH21      ARG  88  15.295   6.088   1.881
   13   HH12  ARG  88          HH22      ARG  88  15.520   7.795   1.746

  No H/Q in entry =          13
  In of MODEL   20
    1    H    GLU  89           H        GLU  89  12.522   5.816   1.130
    2    HA   GLU  89           HA       GLU  89  14.039   8.194   0.965
    3    HB2  GLU  89           HB2      GLU  89  12.900   7.137  -0.977
    4    HB3  GLU  89           HB3      GLU  89  11.352   7.660  -0.314
    5    HG2  GLU  89           HG2      GLU  89  12.025  10.005  -0.483
    6    HG3  GLU  89           HG3      GLU  89  13.632   9.533  -1.025

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LEU  90           H        LEU  90  10.721   7.646   2.108
    2    HA   LEU  90           HA       LEU  90  10.175  10.374   2.682
    3    HB2  LEU  90           HB2      LEU  90   9.016   7.787   3.717
    4    HB3  LEU  90           HB3      LEU  90   8.368   9.375   4.141
    5    HG   LEU  90           HG       LEU  90   8.785   8.497   1.271
    6   HD12  LEU  90          HD11      LEU  90   6.255   8.137   1.344
    7   HD11  LEU  90          HD12      LEU  90   6.417   8.131   3.100
    8   HD13  LEU  90          HD13      LEU  90   7.247   6.910   2.134
    9   HD22  LEU  90          HD21      LEU  90   8.463  10.801   1.196
   10   HD21  LEU  90          HD22      LEU  90   7.482  10.823   2.660
   11   HD23  LEU  90          HD23      LEU  90   6.785  10.258   1.142

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  91           H        ILE  91  11.478   7.710   4.602
    2    HA   ILE  91           HA       ILE  91  11.612   9.080   7.068
    3    HB   ILE  91           HB       ILE  91  13.190   6.759   5.941
    4   HG12  ILE  91          HG12      ILE  91  11.181   6.905   8.209
    5   HG13  ILE  91          HG13      ILE  91  10.707   6.616   6.536
    6   HG22  ILE  91          HG21      ILE  91  13.673   6.555   8.580
    7   HG21  ILE  91          HG22      ILE  91  13.575   8.312   8.477
    8   HG23  ILE  91          HG23      ILE  91  14.760   7.437   7.509
    9   HD13  ILE  91          HD11      ILE  91  11.734   4.527   6.464
   10   HD12  ILE  91          HD12      ILE  91  11.147   4.580   8.126
   11   HD11  ILE  91          HD13      ILE  91  12.844   4.913   7.780

  No H/Q in entry =          11
  In of MODEL   20
    1    H    THR  92           H        THR  92  13.820   8.934   4.308
    2    HA   THR  92           HA       THR  92  15.973  10.355   5.456
    3    HB   THR  92           HB       THR  92  14.976  10.214   2.600
    4    HG1  THR  92           HG1      THR  92  15.833   8.328   3.004
    5   HG22  THR  92          HG21      THR  92  17.537  10.935   2.295
    6   HG21  THR  92          HG22      THR  92  17.225  11.754   3.825
    7   HG23  THR  92          HG23      THR  92  16.244  12.128   2.408

  No H/Q in entry =           7
  In of MODEL   20
    1    H    GLU  93           H        GLU  93  13.065  11.471   3.738
    2    HA   GLU  93           HA       GLU  93  13.626  14.239   3.846
    3    HB2  GLU  93           HB2      GLU  93  10.939  12.833   3.873
    4    HB3  GLU  93           HB3      GLU  93  11.205  14.536   3.498
    5    HG2  GLU  93           HG2      GLU  93  12.563  12.308   1.968
    6    HG3  GLU  93           HG3      GLU  93  11.007  12.971   1.486

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LEU  94           H        LEU  94  11.919  12.065   6.067
    2    HA   LEU  94           HA       LEU  94  11.094  14.003   7.945
    3    HB2  LEU  94           HB2      LEU  94  11.707  11.056   8.220
    4    HB3  LEU  94           HB3      LEU  94  11.129  12.026   9.571
    5    HG   LEU  94           HG       LEU  94   9.633  12.057   6.949
    6   HD11  LEU  94          HD11      LEU  94   9.752   9.839   8.956
    7   HD13  LEU  94          HD12      LEU  94   9.444   9.772   7.222
    8   HD12  LEU  94          HD13      LEU  94   8.163  10.275   8.325
    9   HD23  LEU  94          HD21      LEU  94   7.716  12.435   8.557
   10   HD22  LEU  94          HD22      LEU  94   8.940  13.704   8.587
   11   HD21  LEU  94          HD23      LEU  94   8.897  12.488   9.863

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  95           H        ILE  95  14.090  12.110   7.697
    2    HA   ILE  95           HA       ILE  95  15.257  13.049  10.105
    3    HB   ILE  95           HB       ILE  95  16.497  11.992   7.553
    4   HG12  ILE  95          HG12      ILE  95  16.228  10.791  10.323
    5   HG13  ILE  95          HG13      ILE  95  15.059  10.517   9.034
    6   HG21  ILE  95          HG21      ILE  95  17.754  12.818  10.189
    7   HG23  ILE  95          HG22      ILE  95  18.203  13.349   8.567
    8   HG22  ILE  95          HG23      ILE  95  18.532  11.694   9.076
    9   HD13  ILE  95          HD11      ILE  95  16.549   9.255   7.766
   10   HD12  ILE  95          HD12      ILE  95  17.035   8.814   9.400
   11   HD11  ILE  95          HD13      ILE  95  17.969  10.004   8.495

  No H/Q in entry =          11
  In of MODEL   20
    1    H    GLU  96           H        GLU  96  15.382  14.280   6.768
    2    HA   GLU  96           HA       GLU  96  17.205  16.382   7.235
    3    HB2  GLU  96           HB2      GLU  96  16.539  15.708   4.979
    4    HB3  GLU  96           HB3      GLU  96  14.890  16.246   5.286
    5    HG2  GLU  96           HG2      GLU  96  15.428  18.381   4.739
    6    HG3  GLU  96           HG3      GLU  96  16.732  18.399   5.915

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LEU  97           H        LEU  97  13.698  16.153   7.680
    2    HA   LEU  97           HA       LEU  97  13.252  18.882   8.320
    3    HB2  LEU  97           HB2      LEU  97  11.767  16.339   8.944
    4    HB3  LEU  97           HB3      LEU  97  11.238  17.880   9.616
    5    HG   LEU  97           HG       LEU  97  11.713  17.466   6.649
    6   HD12  LEU  97          HD11      LEU  97   9.191  17.308   6.543
    7   HD11  LEU  97          HD12      LEU  97   9.194  17.110   8.293
    8   HD13  LEU  97          HD13      LEU  97   9.985  15.911   7.269
    9   HD23  LEU  97          HD21      LEU  97   9.951  19.409   6.687
   10   HD22  LEU  97          HD22      LEU  97  11.630  19.790   7.072
   11   HD21  LEU  97          HD23      LEU  97  10.449  19.607   8.367

  No H/Q in entry =          11
  In of MODEL   20
    1    H    HIS  98           H        HIS  98  14.116  16.069  10.316
    2    HA   HIS  98           HA       HIS  98  13.955  17.331  12.831
    3    HB2  HIS  98           HB2      HIS  98  15.727  15.093  11.824
    4    HB3  HIS  98           HB3      HIS  98  15.726  15.634  13.504
    5    HD1  HIS  98           HD1      HIS  98  13.535  13.975  10.924
    6    HD2  HIS  98           HD2      HIS  98  13.436  14.898  14.988
    7    HE1  HIS  98           HE1      HIS  98  11.529  12.757  11.887
    8    HE2  HIS  98           HE2      HIS  98  11.449  13.311  14.358

  No H/Q in entry =           8
  In of MODEL   20
    1    H    GLU  99           H        GLU  99  16.498  17.243  10.384
    2    HA   GLU  99           HA       GLU  99  18.475  18.600  11.903
    3    HB2  GLU  99           HB2      GLU  99  18.960  17.316   9.833
    4    HB3  GLU  99           HB3      GLU  99  18.131  18.560   8.894
    5    HG2  GLU  99           HG2      GLU  99  19.722  20.250   9.676
    6    HG3  GLU  99           HG3      GLU  99  20.520  19.059  10.697

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LYS 100           H        LYS 100  15.927  19.730   9.697
    2    HA   LYS 100           HA       LYS 100  16.693  22.476   9.834
    3    HB2  LYS 100           HB2      LYS 100  14.072  21.156   9.093
    4    HB3  LYS 100           HB3      LYS 100  14.351  22.897   8.999
    5    HG2  LYS 100           HG2      LYS 100  16.321  22.470   7.524
    6    HG3  LYS 100           HG3      LYS 100  15.928  20.748   7.545
    7    HD2  LYS 100           HD2      LYS 100  13.722  21.231   6.555
    8    HD3  LYS 100           HD3      LYS 100  14.099  22.955   6.540
    9    HE2  LYS 100           HE2      LYS 100  16.057  22.495   5.072
   10    HE3  LYS 100           HE3      LYS 100  15.611  20.785   5.043
   11    HZ1  LYS 100           HZ1      LYS 100  13.757  22.956   4.214
   12    HZ3  LYS 100           HZ2      LYS 100  13.591  21.284   3.954
   13    HZ2  LYS 100           HZ3      LYS 100  14.788  22.159   3.127

  No H/Q in entry =          13
  In of MODEL   20
    1    H    LEU 101           H        LEU 101  14.629  20.409  11.811
    2    HA   LEU 101           HA       LEU 101  13.446  22.465  13.392
    3    HB2  LEU 101           HB2      LEU 101  13.924  19.521  13.777
    4    HB3  LEU 101           HB3      LEU 101  13.383  20.497  15.140
    5    HG   LEU 101           HG       LEU 101  11.951  20.566  12.477
    6   HD12  LEU 101          HD11      LEU 101  10.316  18.984  13.755
    7   HD11  LEU 101          HD12      LEU 101  11.720  18.588  14.744
    8   HD13  LEU 101          HD13      LEU 101  11.749  18.280  13.007
    9   HD21  LEU 101          HD21      LEU 101  11.299  21.354  15.331
   10   HD23  LEU 101          HD22      LEU 101  10.035  21.113  14.127
   11   HD22  LEU 101          HD23      LEU 101  11.254  22.362  13.882

  No H/Q in entry =          11
  In of MODEL   20
    1    H    LYS 102           H        LYS 102  16.598  21.893  12.942
    2    HA   LYS 102           HA       LYS 102  18.439  22.785  14.005
    3    HB2  LYS 102           HB2      LYS 102  16.613  24.281  15.145
    4    HB3  LYS 102           HB3      LYS 102  16.839  23.222  16.522
    5    HG2  LYS 102           HG2      LYS 102  18.704  25.254  15.342
    6    HG3  LYS 102           HG3      LYS 102  18.333  24.937  17.023
    7    HD2  LYS 102           HD2      LYS 102  20.014  23.041  15.331
    8    HD3  LYS 102           HD3      LYS 102  20.692  24.372  16.259
    9    HE2  LYS 102           HE2      LYS 102  20.327  21.820  17.233
   10    HE3  LYS 102           HE3      LYS 102  20.534  23.266  18.221
   11    HZ2  LYS 102           HZ1      LYS 102  18.583  21.960  18.850
   12    HZ1  LYS 102           HZ2      LYS 102  17.929  22.181  17.304
   13    HZ3  LYS 102           HZ3      LYS 102  18.150  23.515  18.327

  No H/Q in entry =          13
  In of MODEL   20
    1    H    ALA 103           H        ALA 103  16.397  21.160  16.438
    2    HA   ALA 103           HA       ALA 103  18.145  19.970  18.086
    3    HB2  ALA 103           HB1      ALA 103  16.584  17.945  18.090
    4    HB1  ALA 103           HB2      ALA 103  15.673  18.787  16.836
    5    HB3  ALA 103           HB3      ALA 103  15.850  19.511  18.433

  No H/Q in entry =           5
  In of MODEL   20
    1    H1   ALA   1           H3       ALA   1  -1.666  -7.148 -21.413
    2    H2   ALA   1           H2       ALA   1  -2.443  -8.591 -20.955
    3    H3   ALA   1           H1       ALA   1  -0.837  -8.624 -21.517
    4    HA   ALA   1           HA       ALA   1  -1.675  -9.105 -23.509
    5    HB1  ALA   1           HB1      ALA   1  -3.802  -9.845 -23.025
    6    HB2  ALA   1           HB2      ALA   1  -4.261  -8.340 -23.822
    7    HB3  ALA   1           HB3      ALA   1  -4.191  -8.418 -22.064

  No H/Q in entry =           7
  In of MODEL   20
    1    H    GLU   2           H        GLU   2  -2.527  -7.925 -25.496
    2    HA   GLU   2           HA       GLU   2  -1.154  -5.897 -26.382
    3    HB2  GLU   2           HB2      GLU   2  -4.162  -5.997 -26.686
    4    HB3  GLU   2           HB3      GLU   2  -3.055  -5.123 -27.741
    5    HG2  GLU   2           HG2      GLU   2  -2.537  -7.008 -28.896
    6    HG3  GLU   2           HG3      GLU   2  -2.223  -7.909 -27.419

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLU   3           H        GLU   3  -4.323  -4.673 -25.468
    2    HA   GLU   3           HA       GLU   3  -3.302  -2.106 -24.847
    3    HB2  GLU   3           HB2      GLU   3  -5.974  -3.449 -24.502
    4    HB3  GLU   3           HB3      GLU   3  -5.690  -1.830 -23.858
    5    HG2  GLU   3           HG2      GLU   3  -5.353  -0.901 -25.987
    6    HG3  GLU   3           HG3      GLU   3  -4.945  -2.453 -26.712

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LEU   4           H        LEU   4  -4.857  -4.479 -22.658
    2    HA   LEU   4           HA       LEU   4  -4.495  -3.245 -20.270
    3    HB2  LEU   4           HB2      LEU   4  -3.923  -6.181 -20.739
    4    HB3  LEU   4           HB3      LEU   4  -4.330  -5.438 -19.194
    5    HG   LEU   4           HG       LEU   4  -6.112  -5.532 -21.650
    6   HD13  LEU   4          HD11      LEU   4  -7.283  -7.262 -20.646
    7   HD12  LEU   4          HD12      LEU   4  -6.796  -6.796 -19.017
    8   HD11  LEU   4          HD13      LEU   4  -5.655  -7.627 -20.073
    9   HD23  LEU   4          HD21      LEU   4  -7.797  -4.738 -19.776
   10   HD22  LEU   4          HD22      LEU   4  -6.775  -3.556 -20.592
   11   HD21  LEU   4          HD23      LEU   4  -6.336  -4.140 -18.988

  No H/Q in entry =          11
  In of MODEL   20
    1    H    GLU   5           H        GLU   5  -1.985  -5.063 -22.010
    2    HA   GLU   5           HA       GLU   5   0.004  -4.756 -19.982
    3    HB2  GLU   5           HB2      GLU   5   0.071  -6.525 -21.742
    4    HB3  GLU   5           HB3      GLU   5   0.386  -5.274 -22.945
    5    HG2  GLU   5           HG2      GLU   5   2.513  -6.207 -22.306
    6    HG3  GLU   5           HG3      GLU   5   2.409  -4.599 -21.587

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLU   6           H        GLU   6  -0.663  -3.052 -23.026
    2    HA   GLU   6           HA       GLU   6   1.489  -1.197 -22.769
    3    HB2  GLU   6           HB2      GLU   6   0.363  -1.689 -24.926
    4    HB3  GLU   6           HB3      GLU   6  -1.101  -0.919 -24.315
    5    HG2  GLU   6           HG2      GLU   6   0.103   1.199 -24.038
    6    HG3  GLU   6           HG3      GLU   6   1.595   0.440 -24.585

  No H/Q in entry =           6
  In of MODEL   20
    1    H    VAL   7           H        VAL   7  -1.844  -1.303 -21.709
    2    HA   VAL   7           HA       VAL   7  -2.090   1.407 -20.874
    3    HB   VAL   7           HB       VAL   7  -3.522  -1.125 -20.029
    4   HG11  VAL   7          HG11      VAL   7  -3.924   1.760 -19.216
    5   HG13  VAL   7          HG12      VAL   7  -3.805   0.338 -18.180
    6   HG12  VAL   7          HG13      VAL   7  -5.244   0.591 -19.166
    7   HG21  VAL   7          HG21      VAL   7  -3.701  -0.052 -22.418
    8   HG23  VAL   7          HG22      VAL   7  -4.656   1.187 -21.603
    9   HG22  VAL   7          HG23      VAL   7  -5.184  -0.496 -21.572

  No H/Q in entry =           9
  In of MODEL   20
    1    H    VAL   8           H        VAL   8  -1.064  -1.566 -19.233
    2    HA   VAL   8           HA       VAL   8  -0.746  -0.481 -16.640
    3    HB   VAL   8           HB       VAL   8   0.672  -2.784 -18.002
    4   HG13  VAL   8          HG11      VAL   8   2.101  -2.132 -16.217
    5   HG12  VAL   8          HG12      VAL   8   1.120  -3.439 -15.553
    6   HG11  VAL   8          HG13      VAL   8   0.741  -1.763 -15.157
    7   HG23  VAL   8          HG21      VAL   8  -1.264  -3.252 -15.793
    8   HG22  VAL   8          HG22      VAL   8  -1.086  -4.096 -17.328
    9   HG21  VAL   8          HG23      VAL   8  -1.982  -2.582 -17.258

  No H/Q in entry =           9
  In of MODEL   20
    1    H    MET   9           H        MET   9   1.494  -0.760 -19.397
    2    HA   MET   9           HA       MET   9   3.775   0.307 -18.147
    3    HB2  MET   9           HB2      MET   9   2.815   0.334 -21.008
    4    HB3  MET   9           HB3      MET   9   4.331   1.098 -20.533
    5    HG2  MET   9           HG2      MET   9   5.092  -1.051 -19.556
    6    HG3  MET   9           HG3      MET   9   3.589  -1.809 -20.086
    7    HE2  MET   9           HE1      MET   9   7.373  -1.079 -21.494
    8    HE1  MET   9           HE2      MET   9   6.450   0.270 -20.838
    9    HE3  MET   9           HE3      MET   9   6.782   0.195 -22.566

  No H/Q in entry =           9
  In of MODEL   20
    1    H    GLY  10           H        GLY  10   1.067   1.881 -19.813
    2    HA3  GLY  10           HA2      GLY  10   2.005   4.544 -19.575
    3    HA2  GLY  10           HA3      GLY  10   0.319   4.067 -19.772

  No H/Q in entry =           3
  In of MODEL   20
    1    H    LEU  11           H        LEU  11  -0.054   2.538 -17.483
    2    HA   LEU  11           HA       LEU  11  -0.594   4.511 -15.522
    3    HB2  LEU  11           HB2      LEU  11  -0.497   1.496 -15.364
    4    HB3  LEU  11           HB3      LEU  11  -1.010   2.515 -14.020
    5    HG   LEU  11           HG       LEU  11  -2.263   2.615 -16.777
    6   HD13  LEU  11          HD11      LEU  11  -2.822   0.467 -16.018
    7   HD12  LEU  11          HD12      LEU  11  -4.179   1.446 -15.466
    8   HD11  LEU  11          HD13      LEU  11  -2.913   0.979 -14.332
    9   HD22  LEU  11          HD21      LEU  11  -2.868   4.626 -15.769
   10   HD21  LEU  11          HD22      LEU  11  -2.778   3.962 -14.138
   11   HD23  LEU  11          HD23      LEU  11  -4.155   3.582 -15.173

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  12           H        ILE  12   1.971   2.069 -15.775
    2    HA   ILE  12           HA       ILE  12   3.183   2.619 -13.278
    3    HB   ILE  12           HB       ILE  12   4.436   1.590 -15.846
    4   HG12  ILE  12          HG12      ILE  12   2.438   0.341 -14.694
    5   HG13  ILE  12          HG13      ILE  12   3.844  -0.582 -15.186
    6   HG22  ILE  12          HG21      ILE  12   6.125   0.577 -14.263
    7   HG21  ILE  12          HG22      ILE  12   5.423   1.556 -12.975
    8   HG23  ILE  12          HG23      ILE  12   6.188   2.336 -14.358
    9   HD11  ILE  12          HD11      ILE  12   3.400   0.522 -12.401
   10   HD13  ILE  12          HD12      ILE  12   4.672  -0.587 -12.910
   11   HD12  ILE  12          HD13      ILE  12   3.004  -1.116 -12.887

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  13           H        ILE  13   3.756   3.886 -16.538
    2    HA   ILE  13           HA       ILE  13   5.881   5.627 -15.826
    3    HB   ILE  13           HB       ILE  13   3.837   5.694 -18.060
    4   HG12  ILE  13          HG12      ILE  13   5.655   3.849 -17.811
    5   HG13  ILE  13          HG13      ILE  13   5.445   4.622 -19.378
    6   HG23  ILE  13          HG21      ILE  13   4.511   7.960 -17.888
    7   HG22  ILE  13          HG22      ILE  13   5.540   7.296 -19.151
    8   HG21  ILE  13          HG23      ILE  13   6.185   7.532 -17.527
    9   HD13  ILE  13          HD11      ILE  13   7.484   5.711 -19.259
   10   HD12  ILE  13          HD12      ILE  13   7.855   4.350 -18.207
   11   HD11  ILE  13          HD13      ILE  13   7.384   5.895 -17.509

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ASN  14           H        ASN  14   2.369   6.088 -16.076
    2    HA   ASN  14           HA       ASN  14   2.304   8.834 -15.440
    3    HB2  ASN  14           HB2      ASN  14   0.422   7.174 -16.260
    4    HB3  ASN  14           HB3      ASN  14   0.111   6.994 -14.538
    5   HD21  ASN  14          HD21      ASN  14  -1.926   8.130 -15.961
    6   HD22  ASN  14          HD22      ASN  14  -2.003   9.803 -15.694

  No H/Q in entry =           6
  In of MODEL   20
    1    H    SER  15           H        SER  15   2.047   5.956 -13.360
    2    HA   SER  15           HA       SER  15   1.740   7.325 -10.911
    3    HB2  SER  15           HB2      SER  15   2.316   5.246  -9.864
    4    HB3  SER  15           HB3      SER  15   1.480   4.818 -11.352
    5    HG   SER  15           HG       SER  15   4.187   4.631 -10.689

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLY  16           H        GLY  16   4.617   6.255 -12.685
    2    HA3  GLY  16           HA2      GLY  16   6.544   7.031 -10.764
    3    HA2  GLY  16           HA3      GLY  16   6.840   6.831 -12.489

  No H/Q in entry =           3
  In of MODEL   20
    1    H    GLN  17           H        GLN  17   5.126   8.771 -13.545
    2    HA   GLN  17           HA       GLN  17   6.682  11.128 -13.247
    3    HB2  GLN  17           HB2      GLN  17   5.332  10.605 -15.275
    4    HB3  GLN  17           HB3      GLN  17   3.862  10.873 -14.337
    5    HG2  GLN  17           HG2      GLN  17   4.379  12.907 -15.561
    6    HG3  GLN  17           HG3      GLN  17   4.657  13.193 -13.843
    7   HE21  GLN  17          HE21      GLN  17   6.371  14.717 -13.955
    8   HE22  GLN  17          HE22      GLN  17   7.862  14.390 -14.701

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ALA  18           H        ALA  18   3.599  10.080 -11.881
    2    HA   ALA  18           HA       ALA  18   2.856  12.462 -10.613
    3    HB1  ALA  18           HB1      ALA  18   1.751   9.993 -10.828
    4    HB2  ALA  18           HB2      ALA  18   1.196  11.208  -9.679
    5    HB3  ALA  18           HB3      ALA  18   2.302   9.938  -9.153

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ARG  19           H        ARG  19   4.765   9.720  -9.342
    2    HA   ARG  19           HA       ARG  19   5.298  10.885  -6.823
    3    HB2  ARG  19           HB2      ARG  19   5.735   8.486  -7.351
    4    HB3  ARG  19           HB3      ARG  19   7.081   8.986  -8.379
    5    HG2  ARG  19           HG2      ARG  19   8.199  10.039  -6.463
    6    HG3  ARG  19           HG3      ARG  19   6.833   9.637  -5.424
    7    HD2  ARG  19           HD2      ARG  19   8.614   8.021  -5.074
    8    HD3  ARG  19           HD3      ARG  19   7.244   7.224  -5.852
    9    HE   ARG  19           HE       ARG  19   8.930   8.060  -7.909
   10   HH21  ARG  19          HH11      ARG  19  10.501   6.671  -8.766
   11   HH22  ARG  19          HH12      ARG  19  11.066   5.330  -7.833
   12   HH11  ARG  19          HH21      ARG  19   9.038   6.032  -5.130
   13   HH12  ARG  19          HH22      ARG  19  10.234   4.968  -5.772

  No H/Q in entry =          13
  In of MODEL   20
    1    H    SER  20           H        SER  20   7.099  10.932  -9.881
    2    HA   SER  20           HA       SER  20   9.333  12.374  -9.070
    3    HB2  SER  20           HB2      SER  20   9.364  11.498 -11.273
    4    HB3  SER  20           HB3      SER  20   7.852  12.294 -11.694
    5    HG   SER  20           HG       SER  20   8.956  14.292 -11.474

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU  21           H        LEU  21   6.213  13.606 -10.252
    2    HA   LEU  21           HA       LEU  21   6.853  16.360 -10.033
    3    HB2  LEU  21           HB2      LEU  21   4.205  14.901  -9.944
    4    HB3  LEU  21           HB3      LEU  21   4.345  16.658  -9.939
    5    HG   LEU  21           HG       LEU  21   5.562  14.895 -12.085
    6   HD13  LEU  21          HD11      LEU  21   3.251  14.547 -12.364
    7   HD12  LEU  21          HD12      LEU  21   3.584  15.906 -13.437
    8   HD11  LEU  21          HD13      LEU  21   2.849  16.189 -11.859
    9   HD22  LEU  21          HD21      LEU  21   6.664  16.946 -12.275
   10   HD21  LEU  21          HD22      LEU  21   5.300  17.869 -11.650
   11   HD23  LEU  21          HD23      LEU  21   5.263  17.257 -13.296

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ALA  22           H        ALA  22   5.380  14.054  -7.776
    2    HA   ALA  22           HA       ALA  22   4.766  15.857  -5.707
    3    HB3  ALA  22           HB1      ALA  22   4.033  13.455  -5.864
    4    HB2  ALA  22           HB2      ALA  22   4.623  13.935  -4.273
    5    HB1  ALA  22           HB3      ALA  22   5.653  12.989  -5.349

  No H/Q in entry =           5
  In of MODEL   20
    1    H    TYR  23           H        TYR  23   7.722  13.866  -6.159
    2    HA   TYR  23           HA       TYR  23   9.104  14.904  -3.914
    3    HB2  TYR  23           HB2      TYR  23   9.908  12.905  -5.077
    4    HB3  TYR  23           HB3      TYR  23  10.205  13.848  -6.537
    5    HD1  TYR  23           HD1      TYR  23  11.190  13.504  -2.953
    6    HD2  TYR  23           HD2      TYR  23  12.221  15.059  -6.824
    7    HE1  TYR  23           HE1      TYR  23  13.444  14.107  -2.112
    8    HE2  TYR  23           HE2      TYR  23  14.474  15.662  -5.982
    9    HH   TYR  23           HH       TYR  23  15.384  15.071  -2.584

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ALA  24           H        ALA  24   8.890  16.006  -7.280
    2    HA   ALA  24           HA       ALA  24  10.760  18.115  -7.045
    3    HB2  ALA  24           HB1      ALA  24  10.305  18.170  -9.252
    4    HB3  ALA  24           HB2      ALA  24   8.742  18.900  -8.885
    5    HB1  ALA  24           HB3      ALA  24   8.889  17.149  -9.014

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA  25           H        ALA  25   7.287  17.886  -6.406
    2    HA   ALA  25           HA       ALA  25   6.774  20.598  -5.837
    3    HB1  ALA  25           HB1      ALA  25   5.138  18.578  -6.028
    4    HB2  ALA  25           HB2      ALA  25   4.760  19.863  -4.878
    5    HB3  ALA  25           HB3      ALA  25   5.472  18.351  -4.310

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU  26           H        LEU  26   7.889  17.935  -3.790
    2    HA   LEU  26           HA       LEU  26   7.987  19.370  -1.355
    3    HB2  LEU  26           HB2      LEU  26   8.115  16.955  -1.348
    4    HB3  LEU  26           HB3      LEU  26   9.580  16.981  -2.326
    5    HG   LEU  26           HG       LEU  26  10.789  18.118  -0.494
    6   HD12  LEU  26          HD11      LEU  26   9.574  18.111   1.773
    7   HD11  LEU  26          HD12      LEU  26   8.084  17.952   0.846
    8   HD13  LEU  26          HD13      LEU  26   9.108  19.372   0.630
    9   HD21  LEU  26          HD21      LEU  26   9.294  15.630   0.390
   10   HD23  LEU  26          HD22      LEU  26  10.805  16.214   1.079
   11   HD22  LEU  26          HD23      LEU  26  10.759  15.653  -0.591

  No H/Q in entry =          11
  In of MODEL   20
    1    H    LYS  27           H        LYS  27  10.398  18.828  -3.892
    2    HA   LYS  27           HA       LYS  27  12.571  20.101  -2.677
    3    HB2  LYS  27           HB2      LYS  27  12.681  18.753  -4.766
    4    HB3  LYS  27           HB3      LYS  27  11.892  20.073  -5.628
    5    HG2  LYS  27           HG2      LYS  27  13.739  21.585  -5.062
    6    HG3  LYS  27           HG3      LYS  27  14.523  20.305  -4.128
    7    HD2  LYS  27           HD2      LYS  27  14.675  18.918  -6.181
    8    HD3  LYS  27           HD3      LYS  27  13.936  20.224  -7.107
    9    HE2  LYS  27           HE2      LYS  27  15.806  21.718  -6.506
   10    HE3  LYS  27           HE3      LYS  27  16.549  20.415  -5.571
   11    HZ3  LYS  27           HZ1      LYS  27  17.526  20.527  -7.763
   12    HZ2  LYS  27           HZ2      LYS  27  15.997  20.386  -8.495
   13    HZ1  LYS  27           HZ3      LYS  27  16.643  19.085  -7.613

  No H/Q in entry =          13
  In of MODEL   20
    1    H    GLN  28           H        GLN  28   9.919  21.443  -4.613
    2    HA   GLN  28           HA       GLN  28  10.839  24.109  -4.774
    3    HB2  GLN  28           HB2      GLN  28   8.021  23.000  -4.644
    4    HB3  GLN  28           HB3      GLN  28   8.410  24.676  -5.027
    5    HG2  GLN  28           HG2      GLN  28   9.428  22.271  -6.568
    6    HG3  GLN  28           HG3      GLN  28   8.079  23.288  -7.070
    7   HE21  GLN  28          HE21      GLN  28  11.250  22.833  -7.762
    8   HE22  GLN  28          HE22      GLN  28  11.702  24.420  -8.161

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ALA  29           H        ALA  29   8.945  22.391  -2.325
    2    HA   ALA  29           HA       ALA  29   8.372  24.576  -0.643
    3    HB2  ALA  29           HB1      ALA  29   7.675  22.999   0.931
    4    HB1  ALA  29           HB2      ALA  29   8.911  21.832   0.461
    5    HB3  ALA  29           HB3      ALA  29   7.515  22.104  -0.581

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LYS  30           H        LYS  30  11.135  22.350  -0.724
    2    HA   LYS  30           HA       LYS  30  12.451  23.326   1.570
    3    HB2  LYS  30           HB2      LYS  30  13.553  22.053  -0.945
    4    HB3  LYS  30           HB3      LYS  30  14.538  22.428   0.471
    5    HG2  LYS  30           HG2      LYS  30  13.013  21.024   1.861
    6    HG3  LYS  30           HG3      LYS  30  12.126  20.588   0.396
    7    HD2  LYS  30           HD2      LYS  30  14.180  19.631  -0.575
    8    HD3  LYS  30           HD3      LYS  30  15.085  20.081   0.872
    9    HE2  LYS  30           HE2      LYS  30  13.609  18.629   2.236
   10    HE3  LYS  30           HE3      LYS  30  12.734  18.159   0.773
   11    HZ2  LYS  30           HZ1      LYS  30  14.553  16.608   1.526
   12    HZ1  LYS  30           HZ2      LYS  30  15.670  17.812   1.067
   13    HZ3  LYS  30           HZ3      LYS  30  14.638  17.111  -0.092

  No H/Q in entry =          13
  In of MODEL   20
    1    H    GLN  31           H        GLN  31  12.307  24.525  -1.727
    2    HA   GLN  31           HA       GLN  31  14.433  26.450  -1.319
    3    HB2  GLN  31           HB2      GLN  31  12.378  26.464  -3.532
    4    HB3  GLN  31           HB3      GLN  31  13.987  27.184  -3.543
    5    HG2  GLN  31           HG2      GLN  31  14.493  24.496  -2.967
    6    HG3  GLN  31           HG3      GLN  31  13.183  24.421  -4.139
    7   HE21  GLN  31          HE21      GLN  31  16.036  23.670  -4.557
    8   HE22  GLN  31          HE22      GLN  31  16.587  24.650  -5.827

  No H/Q in entry =           8
  In of MODEL   20
    1    H    GLY  32           H        GLY  32  11.368  26.223  -0.157
    2    HA3  GLY  32           HA2      GLY  32  10.195  27.776   1.121
    3    HA2  GLY  32           HA3      GLY  32  11.299  29.027   0.564

  No H/Q in entry =           3
  In of MODEL   20
    1    H    ASP  33           H        ASP  33   9.950  27.100  -1.919
    2    HA   ASP  33           HA       ASP  33   8.247  29.347  -2.768
    3    HB2  ASP  33           HB2      ASP  33   9.369  26.943  -4.214
    4    HB3  ASP  33           HB3      ASP  33   8.197  28.040  -4.939

  No H/Q in entry =           4
  In of MODEL   20
    1    H    PHE  34           H        PHE  34   6.575  28.848  -1.195
    2    HA   PHE  34           HA       PHE  34   5.233  26.355  -1.089
    3    HB2  PHE  34           HB2      PHE  34   4.234  29.129  -0.407
    4    HB3  PHE  34           HB3      PHE  34   3.410  27.626   0.010
    5    HD1  PHE  34           HD1      PHE  34   5.630  30.059   1.210
    6    HD2  PHE  34           HD2      PHE  34   5.013  25.808   1.165
    7    HE1  PHE  34           HE1      PHE  34   7.035  29.831   3.240
    8    HE2  PHE  34           HE2      PHE  34   6.421  25.585   3.192
    9    HZ   PHE  34           HZ       PHE  34   7.426  27.597   4.229

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ALA  35           H        ALA  35   4.749  29.210  -3.101
    2    HA   ALA  35           HA       ALA  35   2.201  28.557  -4.111
    3    HB3  ALA  35           HB1      ALA  35   3.221  29.962  -6.156
    4    HB2  ALA  35           HB2      ALA  35   4.440  30.343  -4.939
    5    HB1  ALA  35           HB3      ALA  35   2.745  30.727  -4.639

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA  36           H        ALA  36   5.432  27.931  -5.482
    2    HA   ALA  36           HA       ALA  36   4.453  26.484  -7.719
    3    HB3  ALA  36           HB1      ALA  36   6.607  26.641  -8.347
    4    HB2  ALA  36           HB2      ALA  36   7.111  25.621  -6.998
    5    HB1  ALA  36           HB3      ALA  36   6.980  27.367  -6.784

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA  37           H        ALA  37   5.441  25.508  -4.469
    2    HA   ALA  37           HA       ALA  37   5.423  22.719  -4.895
    3    HB2  ALA  37           HB1      ALA  37   5.147  24.508  -2.517
    4    HB1  ALA  37           HB2      ALA  37   6.299  23.207  -2.814
    5    HB3  ALA  37           HB3      ALA  37   4.646  22.829  -2.333

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LYS  38           H        LYS  38   2.863  24.890  -3.715
    2    HA   LYS  38           HA       LYS  38   0.793  23.045  -3.479
    3    HB2  LYS  38           HB2      LYS  38   1.104  25.806  -3.233
    4    HB3  LYS  38           HB3      LYS  38  -0.100  25.640  -4.505
    5    HG2  LYS  38           HG2      LYS  38  -1.522  24.296  -3.053
    6    HG3  LYS  38           HG3      LYS  38  -0.270  24.256  -1.804
    7    HD2  LYS  38           HD2      LYS  38  -0.489  26.590  -1.358
    8    HD3  LYS  38           HD3      LYS  38  -1.413  26.864  -2.835
    9    HE2  LYS  38           HE2      LYS  38  -2.906  26.877  -0.888
   10    HE3  LYS  38           HE3      LYS  38  -3.265  25.494  -1.926
   11    HZ3  LYS  38           HZ1      LYS  38  -2.509  24.036  -0.396
   12    HZ2  LYS  38           HZ2      LYS  38  -2.873  25.289   0.694
   13    HZ1  LYS  38           HZ3      LYS  38  -1.277  25.062   0.161

  No H/Q in entry =          13
  In of MODEL   20
    1    H    ALA  39           H        ALA  39   1.728  24.959  -6.335
    2    HA   ALA  39           HA       ALA  39  -0.344  24.059  -8.026
    3    HB2  ALA  39           HB1      ALA  39   2.377  24.747  -9.095
    4    HB1  ALA  39           HB2      ALA  39   1.395  25.994  -8.326
    5    HB3  ALA  39           HB3      ALA  39   0.788  25.146  -9.748

  No H/Q in entry =           5
  In of MODEL   20
    1    H    MET  40           H        MET  40   2.917  22.810  -7.463
    2    HA   MET  40           HA       MET  40   2.839  20.786  -9.451
    3    HB2  MET  40           HB2      MET  40   4.461  21.037  -6.912
    4    HB3  MET  40           HB3      MET  40   4.724  19.784  -8.127
    5    HG2  MET  40           HG2      MET  40   4.733  22.740  -8.795
    6    HG3  MET  40           HG3      MET  40   6.195  21.860  -8.353
    7    HE3  MET  40           HE1      MET  40   7.086  19.655 -11.164
    8    HE2  MET  40           HE2      MET  40   6.536  19.329  -9.523
    9    HE1  MET  40           HE3      MET  40   7.609  20.692  -9.830

  No H/Q in entry =           9
  In of MODEL   20
    1    H    MET  41           H        MET  41   1.942  20.818  -6.023
    2    HA   MET  41           HA       MET  41   1.454  18.046  -5.739
    3    HB2  MET  41           HB2      MET  41   0.092  20.384  -4.383
    4    HB3  MET  41           HB3      MET  41  -0.035  18.704  -3.873
    5    HG2  MET  41           HG2      MET  41   2.671  18.969  -3.925
    6    HG3  MET  41           HG3      MET  41   2.207  20.621  -3.529
    7    HE2  MET  41           HE1      MET  41  -0.803  19.323  -1.786
    8    HE1  MET  41           HE2      MET  41  -0.012  20.848  -2.169
    9    HE3  MET  41           HE3      MET  41  -0.053  20.279  -0.500

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ASP  42           H        ASP  42  -0.632  20.737  -6.705
    2    HA   ASP  42           HA       ASP  42  -3.052  19.339  -6.827
    3    HB2  ASP  42           HB2      ASP  42  -2.387  21.920  -7.090
    4    HB3  ASP  42           HB3      ASP  42  -2.541  21.521  -8.797

  No H/Q in entry =           4
  In of MODEL   20
    1    H    GLN  43           H        GLN  43  -0.634  19.965  -9.343
    2    HA   GLN  43           HA       GLN  43  -2.012  18.622 -11.423
    3    HB2  GLN  43           HB2      GLN  43   0.940  19.185 -11.058
    4    HB3  GLN  43           HB3      GLN  43   0.229  18.532 -12.536
    5    HG2  GLN  43           HG2      GLN  43  -1.315  20.536 -12.571
    6    HG3  GLN  43           HG3      GLN  43  -0.365  21.208 -11.249
    7   HE21  GLN  43          HE21      GLN  43  -0.240  22.828 -13.338
    8   HE22  GLN  43          HE22      GLN  43   1.173  22.629 -14.252

  No H/Q in entry =           8
  In of MODEL   20
    1    H    SER  44           H        SER  44   0.369  17.522  -9.044
    2    HA   SER  44           HA       SER  44   0.740  14.919 -10.069
    3    HB2  SER  44           HB2      SER  44   1.624  16.375  -7.839
    4    HB3  SER  44           HB3      SER  44   0.787  14.978  -7.162
    5    HG   SER  44           HG       SER  44   2.905  14.392  -7.599

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ARG  45           H        ARG  45  -1.588  16.203  -7.720
    2    HA   ARG  45           HA       ARG  45  -2.933  13.821  -7.075
    3    HB2  ARG  45           HB2      ARG  45  -3.160  15.987  -5.884
    4    HB3  ARG  45           HB3      ARG  45  -4.034  16.639  -7.267
    5    HG2  ARG  45           HG2      ARG  45  -5.770  14.885  -6.973
    6    HG3  ARG  45           HG3      ARG  45  -4.909  14.288  -5.554
    7    HD2  ARG  45           HD2      ARG  45  -5.146  16.553  -4.499
    8    HD3  ARG  45           HD3      ARG  45  -6.149  17.055  -5.876
    9    HE   ARG  45           HE       ARG  45  -7.215  14.663  -4.828
   10   HH21  ARG  45          HH11      ARG  45  -9.045  14.710  -3.547
   11   HH22  ARG  45          HH12      ARG  45  -9.458  16.144  -2.678
   12   HH11  ARG  45          HH21      ARG  45  -6.716  17.919  -3.810
   13   HH12  ARG  45          HH22      ARG  45  -8.135  17.961  -2.825

  No H/Q in entry =          13
  In of MODEL   20
    1    H    MET  46           H        MET  46  -3.570  16.213  -9.625
    2    HA   MET  46           HA       MET  46  -5.895  15.002 -10.673
    3    HB2  MET  46           HB2      MET  46  -3.841  16.895 -11.810
    4    HB3  MET  46           HB3      MET  46  -5.151  16.269 -12.817
    5    HG2  MET  46           HG2      MET  46  -6.819  17.242 -11.441
    6    HG3  MET  46           HG3      MET  46  -5.688  17.522 -10.122
    7    HE2  MET  46           HE1      MET  46  -5.068  19.572 -14.186
    8    HE1  MET  46           HE2      MET  46  -5.905  18.045 -13.925
    9    HE3  MET  46           HE3      MET  46  -4.173  18.155 -13.621

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ALA  47           H        ALA  47  -2.463  14.578 -11.448
    2    HA   ALA  47           HA       ALA  47  -2.792  12.843 -13.655
    3    HB3  ALA  47           HB1      ALA  47  -0.627  13.768 -13.316
    4    HB2  ALA  47           HB2      ALA  47  -0.456  12.043 -12.981
    5    HB1  ALA  47           HB3      ALA  47  -0.560  13.195 -11.649

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU  48           H        LEU  48  -2.493  12.215 -10.182
    2    HA   LEU  48           HA       LEU  48  -2.541   9.374 -10.337
    3    HB2  LEU  48           HB2      LEU  48  -3.325  11.281  -8.121
    4    HB3  LEU  48           HB3      LEU  48  -3.202   9.533  -7.919
    5    HG   LEU  48           HG       LEU  48  -0.936  11.269  -8.931
    6   HD13  LEU  48          HD11      LEU  48  -1.220  12.037  -6.739
    7   HD12  LEU  48          HD12      LEU  48  -0.034  10.749  -6.545
    8   HD11  LEU  48          HD13      LEU  48  -1.726  10.459  -6.139
    9   HD22  LEU  48          HD21      LEU  48  -0.405   9.091  -9.572
   10   HD21  LEU  48          HD22      LEU  48  -1.255   8.363  -8.210
   11   HD23  LEU  48          HD23      LEU  48   0.306   9.143  -7.959

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ASN  49           H        ASN  49  -5.044  11.826  -9.925
    2    HA   ASN  49           HA       ASN  49  -7.198  10.125  -9.373
    3    HB2  ASN  49           HB2      ASN  49  -7.319  12.534  -9.040
    4    HB3  ASN  49           HB3      ASN  49  -7.125  12.817 -10.765
    5   HD21  ASN  49          HD21      ASN  49  -9.331  11.202  -8.444
    6   HD22  ASN  49          HD22      ASN  49 -10.731  11.460  -9.365

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLU  50           H        GLU  50  -5.955  11.340 -12.468
    2    HA   GLU  50           HA       GLU  50  -7.897  10.050 -14.102
    3    HB2  GLU  50           HB2      GLU  50  -6.466  11.893 -14.926
    4    HB3  GLU  50           HB3      GLU  50  -5.053  10.844 -14.794
    5    HG2  GLU  50           HG2      GLU  50  -6.010   9.291 -16.424
    6    HG3  GLU  50           HG3      GLU  50  -7.487  10.244 -16.505

  No H/Q in entry =           6
  In of MODEL   20
    1    H    ALA  51           H        ALA  51  -4.704   9.112 -12.912
    2    HA   ALA  51           HA       ALA  51  -4.531   6.660 -14.328
    3    HB2  ALA  51           HB1      ALA  51  -2.540   6.407 -13.238
    4    HB1  ALA  51           HB2      ALA  51  -3.227   6.819 -11.667
    5    HB3  ALA  51           HB3      ALA  51  -2.798   8.096 -12.805

  No H/Q in entry =           5
  In of MODEL   20
    1    H    HIS  52           H        HIS  52  -5.701   7.476 -11.074
    2    HA   HIS  52           HA       HIS  52  -6.339   4.856 -10.237
    3    HB2  HIS  52           HB2      HIS  52  -6.228   6.776  -8.701
    4    HB3  HIS  52           HB3      HIS  52  -7.650   7.476  -9.473
    5    HD1  HIS  52           HD1      HIS  52  -9.897   5.981  -9.314
    6    HD2  HIS  52           HD2      HIS  52  -6.808   4.897  -6.733
    7    HE1  HIS  52           HE1      HIS  52 -10.933   4.506  -7.535
    8    HE2  HIS  52           HE2      HIS  52  -9.062   3.836  -5.953

  No H/Q in entry =           8
  In of MODEL   20
    1    H    LEU  53           H        LEU  53  -8.208   7.282 -12.018
    2    HA   LEU  53           HA       LEU  53 -10.692   5.950 -12.017
    3    HB2  LEU  53           HB2      LEU  53  -9.450   7.949 -13.895
    4    HB3  LEU  53           HB3      LEU  53 -11.040   7.257 -14.209
    5    HG   LEU  53           HG       LEU  53 -10.338   8.580 -11.568
    6   HD12  LEU  53          HD11      LEU  53 -11.563  10.564 -12.466
    7   HD11  LEU  53          HD12      LEU  53 -11.595   9.787 -14.049
    8   HD13  LEU  53          HD13      LEU  53 -10.059  10.250 -13.323
    9   HD21  LEU  53          HD21      LEU  53 -12.891   7.687 -12.921
   10   HD23  LEU  53          HD22      LEU  53 -12.916   8.944 -11.690
   11   HD22  LEU  53          HD23      LEU  53 -12.351   7.334 -11.286

  No H/Q in entry =          11
  In of MODEL   20
    1    H    VAL  54           H        VAL  54  -7.950   5.794 -14.267
    2    HA   VAL  54           HA       VAL  54  -9.153   4.002 -16.103
    3    HB   VAL  54           HB       VAL  54  -6.251   4.556 -15.435
    4   HG12  VAL  54          HG11      VAL  54  -5.998   3.472 -17.824
    5   HG11  VAL  54          HG12      VAL  54  -7.512   2.667 -17.412
    6   HG13  VAL  54          HG13      VAL  54  -6.087   2.436 -16.400
    7   HG22  VAL  54          HG21      VAL  54  -7.056   6.485 -16.478
    8   HG21  VAL  54          HG22      VAL  54  -8.240   5.602 -17.439
    9   HG23  VAL  54          HG23      VAL  54  -6.535   5.548 -17.878

  No H/Q in entry =           9
  In of MODEL   20
    1    H    GLN  55           H        GLN  55  -7.132   3.491 -13.212
    2    HA   GLN  55           HA       GLN  55  -6.998   0.676 -13.466
    3    HB2  GLN  55           HB2      GLN  55  -5.450   1.598 -11.955
    4    HB3  GLN  55           HB3      GLN  55  -6.678   2.545 -11.121
    5    HG2  GLN  55           HG2      GLN  55  -7.332   0.779  -9.798
    6    HG3  GLN  55           HG3      GLN  55  -7.095  -0.406 -11.076
    7   HE21  GLN  55          HE21      GLN  55  -5.446  -1.829 -10.588
    8   HE22  GLN  55          HE22      GLN  55  -4.063  -1.455  -9.683

  No H/Q in entry =           8
  In of MODEL   20
    1    H    THR  56           H        THR  56  -9.356   2.803 -11.842
    2    HA   THR  56           HA       THR  56 -10.904   0.897 -10.543
    3    HB   THR  56           HB       THR  56 -11.844   3.384 -12.001
    4    HG1  THR  56           HG1      THR  56 -11.050   2.844  -9.338
    5   HG22  THR  56          HG21      THR  56 -13.789   3.235 -10.460
    6   HG21  THR  56          HG22      THR  56 -13.197   1.671  -9.900
    7   HG23  THR  56          HG23      THR  56 -13.712   1.872 -11.575

  No H/Q in entry =           7
  In of MODEL   20
    1    H    LYS  57           H        LYS  57 -11.139   1.972 -13.930
    2    HA   LYS  57           HA       LYS  57 -13.272   0.251 -14.671
    3    HB2  LYS  57           HB2      LYS  57 -12.435   2.213 -15.995
    4    HB3  LYS  57           HB3      LYS  57 -10.981   1.299 -16.366
    5    HG2  LYS  57           HG2      LYS  57 -12.321  -0.411 -17.510
    6    HG3  LYS  57           HG3      LYS  57 -13.797   0.463 -17.116
    7    HD2  LYS  57           HD2      LYS  57 -13.001   2.400 -18.436
    8    HD3  LYS  57           HD3      LYS  57 -11.533   1.516 -18.846
    9    HE2  LYS  57           HE2      LYS  57 -12.878  -0.223 -19.972
   10    HE3  LYS  57           HE3      LYS  57 -14.361   0.635 -19.557
   11    HZ2  LYS  57           HZ1      LYS  57 -13.146   0.982 -21.849
   12    HZ1  LYS  57           HZ2      LYS  57 -12.280   2.134 -20.949
   13    HZ3  LYS  57           HZ3      LYS  57 -13.972   2.245 -21.076

  No H/Q in entry =          13
  In of MODEL   20
    1    H    LEU  58           H        LEU  58  -9.761  -0.126 -14.630
    2    HA   LEU  58           HA       LEU  58  -9.736  -2.644 -15.916
    3    HB2  LEU  58           HB2      LEU  58  -7.714  -1.318 -14.118
    4    HB3  LEU  58           HB3      LEU  58  -7.433  -2.837 -14.972
    5    HG   LEU  58           HG       LEU  58  -8.234  -0.246 -16.335
    6   HD11  LEU  58          HD11      LEU  58  -5.565  -1.441 -15.655
    7   HD13  LEU  58          HD12      LEU  58  -6.086   0.242 -15.606
    8   HD12  LEU  58          HD13      LEU  58  -5.742  -0.526 -17.152
    9   HD22  LEU  58          HD21      LEU  58  -8.792  -1.819 -17.921
   10   HD21  LEU  58          HD22      LEU  58  -7.729  -3.049 -17.243
   11   HD23  LEU  58          HD23      LEU  58  -7.063  -1.767 -18.253

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  59           H        ILE  59 -10.557  -1.750 -12.662
    2    HA   ILE  59           HA       ILE  59 -10.158  -4.510 -11.712
    3    HB   ILE  59           HB       ILE  59  -9.750  -2.227 -10.321
    4   HG12  ILE  59          HG12      ILE  59 -11.047  -4.612  -8.985
    5   HG13  ILE  59          HG13      ILE  59  -9.408  -4.649  -9.585
    6   HG22  ILE  59          HG21      ILE  59 -12.479  -3.017  -9.347
    7   HG21  ILE  59          HG22      ILE  59 -12.309  -1.778 -10.570
    8   HG23  ILE  59          HG23      ILE  59 -11.573  -1.568  -8.983
    9   HD12  ILE  59          HD11      ILE  59 -10.498  -2.734  -7.536
   10   HD11  ILE  59          HD12      ILE  59  -8.866  -2.663  -8.185
   11   HD13  ILE  59          HD13      ILE  59  -9.373  -4.052  -7.222

  No H/Q in entry =          11
  In of MODEL   20
    1    H    GLU  60           H        GLU  60 -12.756  -2.236 -12.512
    2    HA   GLU  60           HA       GLU  60 -14.911  -3.786 -11.487
    3    HB2  GLU  60           HB2      GLU  60 -15.190  -1.429 -12.072
    4    HB3  GLU  60           HB3      GLU  60 -14.825  -1.779 -13.758
    5    HG2  GLU  60           HG2      GLU  60 -17.094  -3.199 -12.383
    6    HG3  GLU  60           HG3      GLU  60 -17.326  -1.590 -13.037

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLY  61           H        GLY  61 -13.252  -3.748 -14.609
    2    HA3  GLY  61           HA2      GLY  61 -14.933  -6.021 -15.489
    3    HA2  GLY  61           HA3      GLY  61 -14.111  -4.905 -16.572

  No H/Q in entry =           3
  In of MODEL   20
    1    H    ASP  62           H        ASP  62 -12.701  -6.327 -13.692
    2    HA   ASP  62           HA       ASP  62 -10.431  -7.265 -15.167
    3    HB2  ASP  62           HB2      ASP  62  -9.673  -8.058 -12.951
    4    HB3  ASP  62           HB3      ASP  62 -10.211  -6.383 -12.899

  No H/Q in entry =           4
  In of MODEL   20
    1    H    ALA  63           H        ALA  63 -12.494  -8.590 -16.384
    2    HA   ALA  63           HA       ALA  63 -13.181 -11.137 -15.320
    3    HB1  ALA  63           HB1      ALA  63 -13.979 -11.629 -17.511
    4    HB2  ALA  63           HB2      ALA  63 -12.819 -10.535 -18.263
    5    HB3  ALA  63           HB3      ALA  63 -14.181  -9.885 -17.348

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLY  64           H        GLY  64 -10.520 -10.010 -17.332
    2    HA3  GLY  64           HA2      GLY  64  -8.530 -10.951 -17.962
    3    HA2  GLY  64           HA3      GLY  64  -8.618 -11.850 -16.453

  No H/Q in entry =           3
  In of MODEL   20
    1    H    GLU  65           H        GLU  65  -8.140 -13.920 -16.956
    2    HA   GLU  65           HA       GLU  65  -8.574 -15.122 -19.444
    3    HB2  GLU  65           HB2      GLU  65  -8.191 -16.359 -16.719
    4    HB3  GLU  65           HB3      GLU  65  -8.209 -17.281 -18.223
    5    HG2  GLU  65           HG2      GLU  65  -6.327 -15.991 -19.084
    6    HG3  GLU  65           HG3      GLU  65  -6.341 -14.965 -17.650

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLY  66           H        GLY  66  -9.680 -17.503 -19.124
    2    HA3  GLY  66           HA2      GLY  66 -12.429 -17.108 -19.569
    3    HA2  GLY  66           HA3      GLY  66 -11.623 -18.654 -19.391

  No H/Q in entry =           3
  In of MODEL   20
    1    H    LYS  67           H        LYS  67 -10.677 -18.177 -16.728
    2    HA   LYS  67           HA       LYS  67 -13.051 -18.951 -15.295
    3    HB2  LYS  67           HB2      LYS  67 -10.141 -18.796 -14.533
    4    HB3  LYS  67           HB3      LYS  67 -11.410 -19.345 -13.431
    5    HG2  LYS  67           HG2      LYS  67 -12.092 -21.066 -15.066
    6    HG3  LYS  67           HG3      LYS  67 -10.824 -20.525 -16.164
    7    HD2  LYS  67           HD2      LYS  67  -9.104 -21.148 -14.537
    8    HD3  LYS  67           HD3      LYS  67 -10.349 -21.617 -13.377
    9    HE2  LYS  67           HE2      LYS  67  -9.503 -23.608 -14.538
   10    HE3  LYS  67           HE3      LYS  67 -11.185 -23.316 -14.985
   11    HZ1  LYS  67           HZ1      LYS  67  -9.199 -22.009 -16.646
   12    HZ3  LYS  67           HZ2      LYS  67 -10.633 -22.807 -17.085
   13    HZ2  LYS  67           HZ3      LYS  67  -9.228 -23.701 -16.750

  No H/Q in entry =          13
  In of MODEL   20
    1    H    MET  68           H        MET  68 -12.930 -18.254 -12.852
    2    HA   MET  68           HA       MET  68 -13.987 -15.645 -12.710
    3    HB2  MET  68           HB2      MET  68 -13.143 -17.607 -10.583
    4    HB3  MET  68           HB3      MET  68 -13.965 -16.087 -10.234
    5    HG2  MET  68           HG2      MET  68 -15.862 -16.755 -11.621
    6    HG3  MET  68           HG3      MET  68 -15.031 -18.242 -12.082
    7    HE1  MET  68           HE1      MET  68 -16.456 -16.042  -9.519
    8    HE3  MET  68           HE2      MET  68 -15.238 -16.528  -8.342
    9    HE2  MET  68           HE3      MET  68 -16.911 -17.036  -8.126

  No H/Q in entry =           9
  In of MODEL   20
    1    H    LYS  69           H        LYS  69 -10.711 -16.519 -12.754
    2    HA   LYS  69           HA       LYS  69  -9.641 -14.796 -10.808
    3    HB2  LYS  69           HB2      LYS  69  -8.448 -15.984 -13.310
    4    HB3  LYS  69           HB3      LYS  69  -7.504 -15.059 -12.140
    5    HG2  LYS  69           HG2      LYS  69  -8.168 -16.616 -10.352
    6    HG3  LYS  69           HG3      LYS  69  -9.149 -17.527 -11.498
    7    HD2  LYS  69           HD2      LYS  69  -7.108 -18.019 -12.825
    8    HD3  LYS  69           HD3      LYS  69  -6.141 -17.165 -11.621
    9    HE2  LYS  69           HE2      LYS  69  -7.878 -19.593 -11.078
   10    HE3  LYS  69           HE3      LYS  69  -6.120 -19.602 -11.211
   11    HZ3  LYS  69           HZ1      LYS  69  -6.121 -19.208  -9.037
   12    HZ2  LYS  69           HZ2      LYS  69  -7.775 -18.826  -9.011
   13    HZ1  LYS  69           HZ3      LYS  69  -6.631 -17.633  -9.404

  No H/Q in entry =          13
  In of MODEL   20
    1    H    VAL  70           H        VAL  70  -7.721 -13.198 -11.756
    2    HA   VAL  70           HA       VAL  70  -9.033 -11.179 -13.478
    3    HB   VAL  70           HB       VAL  70  -8.161  -9.430 -11.959
    4   HG11  VAL  70          HG11      VAL  70 -10.004 -11.543 -10.829
    5   HG13  VAL  70          HG12      VAL  70 -10.447 -10.029 -11.618
    6   HG12  VAL  70          HG13      VAL  70  -9.724 -10.007 -10.010
    7   HG21  VAL  70          HG21      VAL  70  -7.189 -11.857 -10.443
    8   HG23  VAL  70          HG22      VAL  70  -7.539 -10.353  -9.592
    9   HG22  VAL  70          HG23      VAL  70  -6.303 -10.387 -10.849

  No H/Q in entry =           9
  In of MODEL   20
    1    H    SER  71           H        SER  71  -7.464  -9.581 -14.314
    2    HA   SER  71           HA       SER  71  -5.245 -10.795 -15.578
    3    HB2  SER  71           HB2      SER  71  -6.412  -8.782 -16.456
    4    HB3  SER  71           HB3      SER  71  -5.769  -7.847 -15.108
    5    HG   SER  71           HG       SER  71  -4.538  -8.771 -17.396

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU  72           H        LEU  72  -3.181 -11.022 -14.976
    2    HA   LEU  72           HA       LEU  72  -2.452 -10.792 -12.268
    3    HB2  LEU  72           HB2      LEU  72  -0.803 -11.201 -14.758
    4    HB3  LEU  72           HB3      LEU  72  -0.132 -11.259 -13.131
    5    HG   LEU  72           HG       LEU  72  -2.457 -12.991 -14.032
    6   HD12  LEU  72          HD11      LEU  72  -0.724 -14.816 -14.106
    7   HD11  LEU  72          HD12      LEU  72   0.516 -13.574 -13.941
    8   HD13  LEU  72          HD13      LEU  72  -0.524 -13.596 -15.365
    9   HD21  LEU  72          HD21      LEU  72  -0.726 -12.822 -11.571
   10   HD23  LEU  72          HD22      LEU  72  -1.433 -14.367 -12.019
   11   HD22  LEU  72          HD23      LEU  72  -2.475 -12.988 -11.676

  No H/Q in entry =          11
  In of MODEL   20
    1    H    VAL  73           H        VAL  73  -1.779  -8.770 -15.056
    2    HA   VAL  73           HA       VAL  73   0.121  -7.041 -13.964
    3    HB   VAL  73           HB       VAL  73  -0.309  -5.627 -15.819
    4   HG13  VAL  73          HG11      VAL  73  -0.206  -7.184 -17.646
    5   HG12  VAL  73          HG12      VAL  73  -1.083  -8.409 -16.729
    6   HG11  VAL  73          HG13      VAL  73   0.559  -7.969 -16.265
    7   HG22  VAL  73          HG21      VAL  73  -2.588  -5.157 -15.847
    8   HG21  VAL  73          HG22      VAL  73  -3.042  -6.848 -15.652
    9   HG23  VAL  73          HG23      VAL  73  -2.465  -6.265 -17.214

  No H/Q in entry =           9
  In of MODEL   20
    1    H    LEU  74           H        LEU  74  -3.271  -7.206 -13.391
    2    HA   LEU  74           HA       LEU  74  -3.926  -4.559 -12.781
    3    HB2  LEU  74           HB2      LEU  74  -5.638  -6.236 -12.941
    4    HB3  LEU  74           HB3      LEU  74  -4.921  -7.167 -11.629
    5    HG   LEU  74           HG       LEU  74  -5.384  -5.306 -10.062
    6   HD13  LEU  74          HD11      LEU  74  -5.330  -3.361 -11.418
    7   HD12  LEU  74          HD12      LEU  74  -7.031  -3.548 -10.993
    8   HD11  LEU  74          HD13      LEU  74  -6.459  -4.044 -12.587
    9   HD21  LEU  74          HD21      LEU  74  -7.055  -7.180 -10.864
   10   HD23  LEU  74          HD22      LEU  74  -7.919  -5.798 -11.504
   11   HD22  LEU  74          HD23      LEU  74  -7.595  -5.892  -9.790

  No H/Q in entry =          11
  In of MODEL   20
    1    H    VAL  75           H        VAL  75  -2.838  -7.126 -10.619
    2    HA   VAL  75           HA       VAL  75  -2.652  -5.567  -8.279
    3    HB   VAL  75           HB       VAL  75  -1.132  -8.045  -9.075
    4   HG11  VAL  75          HG11      VAL  75  -1.323  -6.576  -6.406
    5   HG13  VAL  75          HG12      VAL  75   0.129  -6.800  -7.372
    6   HG12  VAL  75          HG13      VAL  75  -0.641  -8.185  -6.617
    7   HG22  VAL  75          HG21      VAL  75  -3.567  -8.321  -8.862
    8   HG21  VAL  75          HG22      VAL  75  -3.540  -7.516  -7.294
    9   HG23  VAL  75          HG23      VAL  75  -2.760  -9.086  -7.494

  No H/Q in entry =           9
  In of MODEL   20
    1    H    GLU  76           H        GLU  76  -0.243  -6.296 -10.824
    2    HA   GLU  76           HA       GLU  76   1.927  -4.915  -9.678
    3    HB2  GLU  76           HB2      GLU  76   2.149  -6.389 -11.657
    4    HB3  GLU  76           HB3      GLU  76   1.209  -5.255 -12.613
    5    HG2  GLU  76           HG2      GLU  76   3.533  -4.871 -13.127
    6    HG3  GLU  76           HG3      GLU  76   2.995  -3.509 -12.164

  No H/Q in entry =           6
  In of MODEL   20
    1    H    ALA  77           H        ALA  77  -0.632  -3.755 -11.859
    2    HA   ALA  77           HA       ALA  77   0.318  -1.095 -12.044
    3    HB2  ALA  77           HB1      ALA  77  -2.008  -0.565 -12.768
    4    HB3  ALA  77           HB2      ALA  77  -2.491  -2.200 -12.314
    5    HB1  ALA  77           HB3      ALA  77  -1.328  -1.954 -13.616

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLN  78           H        GLN  78  -1.917  -2.680  -9.820
    2    HA   GLN  78           HA       GLN  78  -2.753  -0.371  -8.420
    3    HB2  GLN  78           HB2      GLN  78  -3.828  -2.647  -8.326
    4    HB3  GLN  78           HB3      GLN  78  -2.480  -3.185  -7.328
    5    HG2  GLN  78           HG2      GLN  78  -3.017  -1.448  -5.667
    6    HG3  GLN  78           HG3      GLN  78  -4.370  -0.911  -6.662
    7   HE21  GLN  78          HE21      GLN  78  -4.828  -1.868  -4.013
    8   HE22  GLN  78          HE22      GLN  78  -5.653  -3.349  -4.110

  No H/Q in entry =           8
  In of MODEL   20
    1    H    LEU  79           H        LEU  79  -0.039  -2.585  -7.977
    2    HA   LEU  79           HA       LEU  79   0.933  -1.668  -5.525
    3    HB2  LEU  79           HB2      LEU  79   1.830  -3.666  -6.593
    4    HB3  LEU  79           HB3      LEU  79   2.456  -2.706  -7.931
    5    HG   LEU  79           HG       LEU  79   4.000  -1.540  -6.435
    6   HD13  LEU  79          HD11      LEU  79   3.000  -1.307  -4.365
    7   HD12  LEU  79          HD12      LEU  79   4.101  -2.639  -4.023
    8   HD11  LEU  79          HD13      LEU  79   2.399  -2.965  -4.345
    9   HD23  LEU  79          HD21      LEU  79   5.248  -3.667  -5.533
   10   HD22  LEU  79          HD22      LEU  79   5.034  -3.475  -7.271
   11   HD21  LEU  79          HD23      LEU  79   3.977  -4.560  -6.372

  No H/Q in entry =          11
  In of MODEL   20
    1    H    HIS  80           H        HIS  80   1.773  -0.544  -8.804
    2    HA   HIS  80           HA       HIS  80   3.552   1.474  -7.892
    3    HB2  HIS  80           HB2      HIS  80   2.263   0.754 -10.469
    4    HB3  HIS  80           HB3      HIS  80   2.832   2.415 -10.303
    5    HD1  HIS  80           HD1      HIS  80   5.227   2.754 -10.836
    6    HD2  HIS  80           HD2      HIS  80   4.475  -1.168  -9.634
    7    HE1  HIS  80           HE1      HIS  80   7.436   1.512 -11.008
    8    HE2  HIS  80           HE2      HIS  80   6.990  -0.881 -10.279

  No H/Q in entry =           8
  In of MODEL   20
    1    H    LEU  81           H        LEU  81   0.142   1.576  -8.859
    2    HA   LEU  81           HA       LEU  81  -0.178   4.365  -8.532
    3    HB2  LEU  81           HB2      LEU  81  -2.155   2.086  -8.441
    4    HB3  LEU  81           HB3      LEU  81  -2.635   3.782  -8.350
    5    HG   LEU  81           HG       LEU  81  -0.932   2.656 -10.591
    6   HD12  LEU  81          HD11      LEU  81  -3.174   2.936 -11.882
    7   HD11  LEU  81          HD12      LEU  81  -3.922   2.858 -10.287
    8   HD13  LEU  81          HD13      LEU  81  -2.959   1.505 -10.875
    9   HD23  LEU  81          HD21      LEU  81  -2.068   4.780 -11.687
   10   HD22  LEU  81          HD22      LEU  81  -0.651   4.976 -10.660
   11   HD21  LEU  81          HD23      LEU  81  -2.259   5.299 -10.014

  No H/Q in entry =          11
  In of MODEL   20
    1    H    MET  82           H        MET  82  -0.783   1.671  -6.276
    2    HA   MET  82           HA       MET  82  -1.854   3.243  -4.187
    3    HB2  MET  82           HB2      MET  82  -0.435   0.580  -4.227
    4    HB3  MET  82           HB3      MET  82  -1.019   1.298  -2.729
    5    HG2  MET  82           HG2      MET  82  -2.753   0.770  -5.162
    6    HG3  MET  82           HG3      MET  82  -2.651  -0.299  -3.765
    7    HE3  MET  82           HE1      MET  82  -4.391   1.326  -0.946
    8    HE2  MET  82           HE2      MET  82  -2.667   1.633  -1.138
    9    HE1  MET  82           HE3      MET  82  -3.330   0.063  -1.587

  No H/Q in entry =           9
  In of MODEL   20
    1    H    THR  83           H        THR  83   1.462   2.213  -4.888
    2    HA   THR  83           HA       THR  83   2.670   3.342  -2.594
    3    HB   THR  83           HB       THR  83   4.760   3.320  -4.076
    4    HG1  THR  83           HG1      THR  83   4.521   2.786  -6.098
    5   HG22  THR  83          HG21      THR  83   4.360   0.654  -4.402
    6   HG21  THR  83          HG22      THR  83   3.069   1.013  -3.257
    7   HG23  THR  83          HG23      THR  83   4.743   1.386  -2.845

  No H/Q in entry =           7
  In of MODEL   20
    1    H    SER  84           H        SER  84   2.265   4.609  -5.895
    2    HA   SER  84           HA       SER  84   3.564   7.073  -5.449
    3    HB2  SER  84           HB2      SER  84   1.500   6.201  -7.459
    4    HB3  SER  84           HB3      SER  84   2.151   7.840  -7.439
    5    HG   SER  84           HG       SER  84   3.564   5.388  -7.731

  No H/Q in entry =           5
  In of MODEL   20
    1    H    MET  85           H        MET  85   0.084   6.257  -5.263
    2    HA   MET  85           HA       MET  85  -0.820   8.853  -4.662
    3    HB2  MET  85           HB2      MET  85  -2.313   7.016  -5.322
    4    HB3  MET  85           HB3      MET  85  -2.006   6.220  -3.780
    5    HG2  MET  85           HG2      MET  85  -2.930   8.158  -2.578
    6    HG3  MET  85           HG3      MET  85  -3.204   8.985  -4.111
    7    HE3  MET  85           HE1      MET  85  -3.926   4.996  -3.302
    8    HE2  MET  85           HE2      MET  85  -5.346   5.379  -2.331
    9    HE1  MET  85           HE3      MET  85  -3.785   6.078  -1.911

  No H/Q in entry =           9
  In of MODEL   20
    1    H    LEU  86           H        LEU  86   0.153   6.210  -2.518
    2    HA   LEU  86           HA       LEU  86  -0.392   7.508  -0.076
    3    HB2  LEU  86           HB2      LEU  86   0.111   5.044  -0.468
    4    HB3  LEU  86           HB3      LEU  86   1.810   5.502  -0.570
    5    HG   LEU  86           HG       LEU  86   1.475   6.661   1.698
    6   HD11  LEU  86          HD11      LEU  86  -1.208   5.850   1.238
    7   HD13  LEU  86          HD12      LEU  86  -0.548   6.610   2.685
    8   HD12  LEU  86          HD13      LEU  86  -0.611   4.853   2.569
    9   HD23  LEU  86          HD21      LEU  86   1.096   3.662   1.826
   10   HD22  LEU  86          HD22      LEU  86   2.086   4.690   2.860
   11   HD21  LEU  86          HD23      LEU  86   2.586   4.370   1.200

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ALA  87           H        ALA  87   2.585   7.259  -1.977
    2    HA   ALA  87           HA       ALA  87   4.275   8.699  -0.260
    3    HB3  ALA  87           HB1      ALA  87   4.376   7.684  -2.967
    4    HB2  ALA  87           HB2      ALA  87   5.709   8.037  -1.871
    5    HB1  ALA  87           HB3      ALA  87   5.070   9.306  -2.915

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ARG  88           H        ARG  88   2.299   9.800  -2.975
    2    HA   ARG  88           HA       ARG  88   3.032  12.501  -2.864
    3    HB2  ARG  88           HB2      ARG  88   1.789  11.327  -4.715
    4    HB3  ARG  88           HB3      ARG  88   0.333  11.449  -3.726
    5    HG2  ARG  88           HG2      ARG  88   1.313  14.045  -3.651
    6    HG3  ARG  88           HG3      ARG  88   1.739  13.535  -5.282
    7    HD2  ARG  88           HD2      ARG  88  -0.406  13.581  -5.971
    8    HD3  ARG  88           HD3      ARG  88  -0.974  12.721  -4.540
    9    HE   ARG  88           HE       ARG  88  -1.208  15.496  -4.960
   10   HH21  ARG  88          HH11      ARG  88  -1.748  16.819  -3.222
   11   HH22  ARG  88          HH12      ARG  88  -1.437  16.289  -1.605
   12   HH11  ARG  88          HH21      ARG  88  -0.148  13.252  -2.587
   13   HH12  ARG  88          HH22      ARG  88  -0.549  14.263  -1.246

  No H/Q in entry =          13
  In of MODEL   20
    1    H    GLU  89           H        GLU  89   0.361  10.789  -1.211
    2    HA   GLU  89           HA       GLU  89  -0.776  13.085  -0.005
    3    HB2  GLU  89           HB2      GLU  89  -1.861  10.830  -0.084
    4    HB3  GLU  89           HB3      GLU  89  -0.723  10.293   1.153
    5    HG2  GLU  89           HG2      GLU  89  -1.562  11.981   2.714
    6    HG3  GLU  89           HG3      GLU  89  -2.629  12.635   1.474

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LEU  90           H        LEU  90   1.714  10.831   1.162
    2    HA   LEU  90           HA       LEU  90   2.062  12.083   3.688
    3    HB2  LEU  90           HB2      LEU  90   3.854  10.333   2.006
    4    HB3  LEU  90           HB3      LEU  90   4.272  10.858   3.642
    5    HG   LEU  90           HG       LEU  90   1.654   9.473   2.994
    6   HD12  LEU  90          HD11      LEU  90   2.828   7.445   4.000
    7   HD11  LEU  90          HD12      LEU  90   4.337   8.323   3.750
    8   HD13  LEU  90          HD13      LEU  90   3.325   7.899   2.368
    9   HD22  LEU  90          HD21      LEU  90   1.386  10.396   5.116
   10   HD21  LEU  90          HD22      LEU  90   3.107  10.313   5.491
   11   HD23  LEU  90          HD23      LEU  90   2.121   8.852   5.545

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  91           H        ILE  91   3.647  12.485   0.554
    2    HA   ILE  91           HA       ILE  91   5.601  14.345   1.383
    3    HB   ILE  91           HB       ILE  91   4.285  13.833  -1.290
    4   HG12  ILE  91          HG12      ILE  91   7.128  13.386  -0.328
    5   HG13  ILE  91          HG13      ILE  91   5.864  12.171  -0.159
    6   HG22  ILE  91          HG21      ILE  91   6.486  15.209  -1.990
    7   HG21  ILE  91          HG22      ILE  91   6.172  16.008  -0.448
    8   HG23  ILE  91          HG23      ILE  91   4.943  16.018  -1.712
    9   HD13  ILE  91          HD11      ILE  91   5.686  11.842  -2.465
   10   HD12  ILE  91          HD12      ILE  91   7.417  12.109  -2.259
   11   HD11  ILE  91          HD13      ILE  91   6.386  13.418  -2.842

  No H/Q in entry =          11
  In of MODEL   20
    1    H    THR  92           H        THR  92   2.230  14.730   0.389
    2    HA   THR  92           HA       THR  92   2.165  17.552   0.326
    3    HB   THR  92           HB       THR  92   0.028  15.529   1.037
    4    HG1  THR  92           HG1      THR  92   0.326  15.352  -1.049
    5   HG22  THR  92          HG21      THR  92  -1.406  17.671   0.318
    6   HG21  THR  92          HG22      THR  92  -0.022  18.516   1.008
    7   HG23  THR  92          HG23      THR  92  -0.943  17.383   1.995

  No H/Q in entry =           7
  In of MODEL   20
    1    H    GLU  93           H        GLU  93   1.659  15.248   2.985
    2    HA   GLU  93           HA       GLU  93   1.110  17.147   5.003
    3    HB2  GLU  93           HB2      GLU  93   2.461  14.440   5.236
    4    HB3  GLU  93           HB3      GLU  93   1.763  15.359   6.571
    5    HG2  GLU  93           HG2      GLU  93   0.151  14.557   4.141
    6    HG3  GLU  93           HG3      GLU  93   0.273  13.537   5.569

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LEU  94           H        LEU  94   4.131  15.704   3.842
    2    HA   LEU  94           HA       LEU  94   5.874  16.877   5.721
    3    HB2  LEU  94           HB2      LEU  94   6.277  15.912   2.890
    4    HB3  LEU  94           HB3      LEU  94   7.601  16.588   3.833
    5    HG   LEU  94           HG       LEU  94   5.896  14.371   4.978
    6   HD11  LEU  94          HD11      LEU  94   7.985  14.170   2.838
    7   HD13  LEU  94          HD12      LEU  94   6.554  13.178   3.106
    8   HD12  LEU  94          HD13      LEU  94   7.987  12.945   4.108
    9   HD23  LEU  94          HD21      LEU  94   8.098  13.865   6.121
   10   HD22  LEU  94          HD22      LEU  94   7.412  15.435   6.539
   11   HD21  LEU  94          HD23      LEU  94   8.747  15.331   5.391

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  95           H        ILE  95   4.706  18.030   2.575
    2    HA   ILE  95           HA       ILE  95   6.246  20.408   2.506
    3    HB   ILE  95           HB       ILE  95   3.606  19.687   1.213
    4   HG12  ILE  95          HG12      ILE  95   6.385  20.060   0.064
    5   HG13  ILE  95          HG13      ILE  95   5.759  18.499   0.583
    6   HG21  ILE  95          HG21      ILE  95   5.321  22.177   0.983
    7   HG23  ILE  95          HG22      ILE  95   3.599  22.087   1.346
    8   HG22  ILE  95          HG23      ILE  95   4.180  21.692  -0.272
    9   HD13  ILE  95          HD11      ILE  95   4.193  18.401  -1.139
   10   HD12  ILE  95          HD12      ILE  95   5.527  19.236  -1.934
   11   HD11  ILE  95          HD13      ILE  95   4.145  20.153  -1.337

  No H/Q in entry =          11
  In of MODEL   20
    1    H    GLU  96           H        GLU  96   3.012  19.714   3.816
    2    HA   GLU  96           HA       GLU  96   2.360  22.353   4.567
    3    HB2  GLU  96           HB2      GLU  96   0.709  20.548   4.588
    4    HB3  GLU  96           HB3      GLU  96   1.587  19.734   5.880
    5    HG2  GLU  96           HG2      GLU  96   0.556  21.005   7.453
    6    HG3  GLU  96           HG3      GLU  96   1.069  22.485   6.652

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LEU  97           H        LEU  97   4.243  19.829   6.187
    2    HA   LEU  97           HA       LEU  97   4.593  21.185   8.655
    3    HB2  LEU  97           HB2      LEU  97   6.152  19.035   7.237
    4    HB3  LEU  97           HB3      LEU  97   6.740  19.729   8.745
    5    HG   LEU  97           HG       LEU  97   3.943  18.598   8.448
    6   HD12  LEU  97          HD11      LEU  97   4.915  16.600   9.659
    7   HD11  LEU  97          HD12      LEU  97   6.516  17.251   9.307
    8   HD13  LEU  97          HD13      LEU  97   5.447  16.778   7.986
    9   HD23  LEU  97          HD21      LEU  97   4.411  18.313  11.011
   10   HD22  LEU  97          HD22      LEU  97   4.007  19.919  10.406
   11   HD21  LEU  97          HD23      LEU  97   5.686  19.501  10.744

  No H/Q in entry =          11
  In of MODEL   20
    1    H    HIS  98           H        HIS  98   6.450  21.222   5.622
    2    HA   HIS  98           HA       HIS  98   8.587  22.830   6.510
    3    HB2  HIS  98           HB2      HIS  98   7.286  22.555   3.790
    4    HB3  HIS  98           HB3      HIS  98   8.715  23.552   4.073
    5    HD1  HIS  98           HD1      HIS  98   7.549  19.966   4.102
    6    HD2  HIS  98           HD2      HIS  98  11.105  22.109   4.509
    7    HE1  HIS  98           HE1      HIS  98   9.425  18.261   4.039
    8    HE2  HIS  98           HE2      HIS  98  11.595  19.545   4.287

  No H/Q in entry =           8
  In of MODEL   20
    1    H    GLU  99           H        GLU  99   5.351  23.622   5.347
    2    HA   GLU  99           HA       GLU  99   5.694  26.442   5.285
    3    HB2  GLU  99           HB2      GLU  99   3.825  25.248   4.163
    4    HB3  GLU  99           HB3      GLU  99   3.141  24.879   5.746
    5    HG2  GLU  99           HG2      GLU  99   2.933  27.269   6.245
    6    HG3  GLU  99           HG3      GLU  99   3.697  27.677   4.712

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LYS 100           H        LYS 100   4.602  24.195   7.814
    2    HA   LYS 100           HA       LYS 100   3.998  26.244   9.708
    3    HB2  LYS 100           HB2      LYS 100   4.612  23.301  10.054
    4    HB3  LYS 100           HB3      LYS 100   4.157  24.369  11.387
    5    HG2  LYS 100           HG2      LYS 100   2.078  24.979  10.147
    6    HG3  LYS 100           HG3      LYS 100   2.514  23.815   8.894
    7    HD2  LYS 100           HD2      LYS 100   2.466  21.995  10.558
    8    HD3  LYS 100           HD3      LYS 100   2.047  23.154  11.822
    9    HE2  LYS 100           HE2      LYS 100  -0.019  23.748  10.567
   10    HE3  LYS 100           HE3      LYS 100   0.391  22.532   9.351
   11    HZ1  LYS 100           HZ1      LYS 100   0.146  21.865  12.233
   12    HZ3  LYS 100           HZ2      LYS 100   0.138  20.810  10.900
   13    HZ2  LYS 100           HZ3      LYS 100  -1.189  21.833  11.184

  No H/Q in entry =          13
  In of MODEL   20
    1    H    LEU 101           H        LEU 101   6.940  24.484   8.863
    2    HA   LEU 101           HA       LEU 101   8.538  25.346  11.060
    3    HB2  LEU 101           HB2      LEU 101   9.133  24.363   8.280
    4    HB3  LEU 101           HB3      LEU 101  10.430  25.045   9.255
    5    HG   LEU 101           HG       LEU 101   8.629  22.868  10.329
    6   HD12  LEU 101          HD11      LEU 101  10.699  21.397   9.713
    7   HD11  LEU 101          HD12      LEU 101  11.045  22.664   8.538
    8   HD13  LEU 101          HD13      LEU 101   9.527  21.772   8.451
    9   HD21  LEU 101          HD21      LEU 101  11.343  24.010  11.044
   10   HD23  LEU 101          HD22      LEU 101  10.821  22.432  11.628
   11   HD22  LEU 101          HD23      LEU 101   9.913  23.877  12.068

  No H/Q in entry =          11
  In of MODEL   20
    1    H    LYS 102           H        LYS 102   6.923  27.188   8.923
    2    HA   LYS 102           HA       LYS 102   6.972  29.481   8.629
    3    HB2  LYS 102           HB2      LYS 102   8.546  29.387  10.721
    4    HB3  LYS 102           HB3      LYS 102   9.839  29.595   9.556
    5    HG2  LYS 102           HG2      LYS 102   7.713  31.524  10.425
    6    HG3  LYS 102           HG3      LYS 102   9.422  31.804  10.166
    7    HD2  LYS 102           HD2      LYS 102   7.466  31.355   7.874
    8    HD3  LYS 102           HD3      LYS 102   7.833  32.940   8.540
    9    HE2  LYS 102           HE2      LYS 102   9.211  31.770   6.461
   10    HE3  LYS 102           HE3      LYS 102   9.816  33.085   7.469
   11    HZ2  LYS 102           HZ1      LYS 102  11.359  31.198   7.289
   12    HZ1  LYS 102           HZ2      LYS 102  10.211  30.203   8.037
   13    HZ3  LYS 102           HZ3      LYS 102  10.892  31.499   8.892

  No H/Q in entry =          13
  In of MODEL   20
    1    H    ALA 103           H        ALA 103  10.242  28.180   8.052
    2    HA   ALA 103           HA       ALA 103  11.181  29.566   5.971
    3    HB2  ALA 103           HB1      ALA 103  12.088  27.361   5.042
    4    HB1  ALA 103           HB2      ALA 103  11.208  26.578   6.352
    5    HB3  ALA 103           HB3      ALA 103  12.485  27.738   6.719

  No H/Q in entry =           5
  In of MODEL   20
    1    H1   LYS   3           H1       LYS   3 -30.880   6.462 -19.729
    2    H2   LYS   3           H3       LYS   3 -29.891   6.150 -21.074
    3    H3   LYS   3           H2       LYS   3 -31.309   5.248 -20.835
    4    HA   LYS   3           HA       LYS   3 -30.347   3.835 -19.426
    5    HB2  LYS   3           HB2      LYS   3 -28.025   5.193 -20.746
    6    HB3  LYS   3           HB3      LYS   3 -27.736   3.977 -19.501
    7    HG2  LYS   3           HG2      LYS   3 -29.188   2.426 -20.861
    8    HG3  LYS   3           HG3      LYS   3 -29.107   3.625 -22.150
    9    HD2  LYS   3           HD2      LYS   3 -26.628   3.452 -22.086
   10    HD3  LYS   3           HD3      LYS   3 -26.785   2.157 -20.901
   11    HE2  LYS   3           HE2      LYS   3 -28.301   1.017 -22.626
   12    HE3  LYS   3           HE3      LYS   3 -27.647   2.181 -23.778
   13    HZ3  LYS   3           HZ1      LYS   3 -25.877   0.911 -24.039
   14    HZ2  LYS   3           HZ2      LYS   3 -26.540  -0.243 -22.983
   15    HZ1  LYS   3           HZ3      LYS   3 -25.525   0.977 -22.379

  No H/Q in entry =          15
  In of MODEL   20
    1    H    LYS   4           H        LYS   4 -30.414   3.693 -17.365
    2    HA   LYS   4           HA       LYS   4 -29.638   5.960 -15.709
    3    HB2  LYS   4           HB2      LYS   4 -30.908   3.297 -15.019
    4    HB3  LYS   4           HB3      LYS   4 -30.660   4.628 -13.891
    5    HG2  LYS   4           HG2      LYS   4 -32.456   4.613 -16.322
    6    HG3  LYS   4           HG3      LYS   4 -32.954   4.675 -14.632
    7    HD2  LYS   4           HD2      LYS   4 -32.205   6.879 -14.360
    8    HD3  LYS   4           HD3      LYS   4 -31.159   6.795 -15.778
    9    HE2  LYS   4           HE2      LYS   4 -33.048   8.216 -16.249
   10    HE3  LYS   4           HE3      LYS   4 -33.159   6.748 -17.219
   11    HZ3  LYS   4           HZ1      LYS   4 -34.765   5.874 -15.681
   12    HZ2  LYS   4           HZ2      LYS   4 -35.280   7.383 -16.267
   13    HZ1  LYS   4           HZ3      LYS   4 -34.635   7.255 -14.702

  No H/Q in entry =          13
  In of MODEL   20
    1    H    HIS   5           H        HIS   5 -28.175   6.007 -14.111
    2    HA   HIS   5           HA       HIS   5 -25.939   4.120 -14.431
    3    HB2  HIS   5           HB2      HIS   5 -26.130   6.880 -13.224
    4    HB3  HIS   5           HB3      HIS   5 -24.672   5.888 -13.200
    5    HD1  HIS   5           HD1      HIS   5 -23.164   7.050 -14.782
    6    HD2  HIS   5           HD2      HIS   5 -26.971   6.528 -16.356
    7    HE1  HIS   5           HE1      HIS   5 -22.968   7.627 -17.230
    8    HE2  HIS   5           HE2      HIS   5 -25.290   7.297 -18.159

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ILE   6           H        ILE   6 -25.759   2.541 -13.114
    2    HA   ILE   6           HA       ILE   6 -26.740   2.834 -10.355
    3    HB   ILE   6           HB       ILE   6 -25.974   0.347 -11.889
    4   HG12  ILE   6          HG12      ILE   6 -28.696   1.355 -11.053
    5   HG13  ILE   6          HG13      ILE   6 -28.040   1.501 -12.683
    6   HG23  ILE   6          HG21      ILE   6 -26.390  -0.896 -10.032
    7   HG22  ILE   6          HG22      ILE   6 -27.519   0.280  -9.359
    8   HG21  ILE   6          HG23      ILE   6 -25.782   0.569  -9.260
    9   HD13  ILE   6          HD11      ILE   6 -28.554  -0.606 -13.188
   10   HD12  ILE   6          HD12      ILE   6 -29.576  -0.563 -11.750
   11   HD11  ILE   6          HD13      ILE   6 -27.939  -1.214 -11.650

  No H/Q in entry =          11
  In of MODEL   20
    1    H    TYR   7           H        TYR   7 -24.972   3.426  -9.058
    2    HA   TYR   7           HA       TYR   7 -22.284   2.397  -9.725
    3    HB2  TYR   7           HB2      TYR   7 -23.190   4.855  -8.247
    4    HB3  TYR   7           HB3      TYR   7 -21.520   4.296  -8.277
    5    HD1  TYR   7           HD1      TYR   7 -22.568   3.383 -11.373
    6    HD2  TYR   7           HD2      TYR   7 -21.813   6.934  -9.141
    7    HE1  TYR   7           HE1      TYR   7 -22.092   4.601 -13.461
    8    HE2  TYR   7           HE2      TYR   7 -21.380   8.160 -11.222
    9    HH   TYR   7           HH       TYR   7 -21.588   8.080 -13.455

  No H/Q in entry =           9
  In of MODEL   20
    1    H    LEU   8           H        LEU   8 -21.363   1.018  -8.391
    2    HA   LEU   8           HA       LEU   8 -22.520   0.554  -5.714
    3    HB2  LEU   8           HB2      LEU   8 -20.854  -1.154  -7.540
    4    HB3  LEU   8           HB3      LEU   8 -21.059  -1.532  -5.830
    5    HG   LEU   8           HG       LEU   8 -23.540  -1.637  -6.266
    6   HD13  LEU   8          HD11      LEU   8 -23.627  -0.416  -8.375
    7   HD12  LEU   8          HD12      LEU   8 -24.200  -2.065  -8.619
    8   HD11  LEU   8          HD13      LEU   8 -22.577  -1.611  -9.136
    9   HD23  LEU   8          HD21      LEU   8 -22.313  -3.711  -7.953
   10   HD22  LEU   8          HD22      LEU   8 -23.411  -3.849  -6.582
   11   HD21  LEU   8          HD23      LEU   8 -21.697  -3.543  -6.310

  No H/Q in entry =          11
  In of MODEL   20
    1    H    PHE   9           H        PHE   9 -21.257   0.938  -3.927
    2    HA   PHE   9           HA       PHE   9 -18.441   1.789  -4.419
    3    HB2  PHE   9           HB2      PHE   9 -20.451   2.926  -2.480
    4    HB3  PHE   9           HB3      PHE   9 -18.732   3.294  -2.438
    5    HD1  PHE   9           HD1      PHE   9 -17.676   4.597  -4.204
    6    HD2  PHE   9           HD2      PHE   9 -21.882   3.757  -4.292
    7    HE1  PHE   9           HE1      PHE   9 -17.979   6.298  -5.979
    8    HE2  PHE   9           HE2      PHE   9 -22.186   5.470  -6.061
    9    HZ   PHE   9           HZ       PHE   9 -20.232   6.736  -6.911

  No H/Q in entry =           9
  In of MODEL   20
    1    H    SER  10           H        SER  10 -16.893   0.799  -3.298
    2    HA   SER  10           HA       SER  10 -17.140  -0.085  -0.604
    3    HB2  SER  10           HB2      SER  10 -17.169  -2.423  -0.848
    4    HB3  SER  10           HB3      SER  10 -18.386  -1.867  -1.986
    5    HG   SER  10           HG       SER  10 -16.805  -1.999  -3.620

  No H/Q in entry =           5
  In of MODEL   20
    1    H    SER  11           H        SER  11 -15.123   0.018   0.235
    2    HA   SER  11           HA       SER  11 -12.918   0.802  -1.298
    3    HB2  SER  11           HB2      SER  11 -11.637   0.605   0.708
    4    HB3  SER  11           HB3      SER  11 -13.253   1.152   1.158
    5    HG   SER  11           HG       SER  11 -12.356  -1.548   1.174

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA  12           H        ALA  12 -14.187  -1.887  -2.065
    2    HA   ALA  12           HA       ALA  12 -11.628  -3.172  -2.609
    3    HB1  ALA  12           HB1      ALA  12 -13.888  -4.685  -1.279
    4    HB3  ALA  12           HB2      ALA  12 -12.339  -4.281  -0.540
    5    HB2  ALA  12           HB3      ALA  12 -12.397  -5.398  -1.903

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLY  13           H        GLY  13 -12.352  -2.166  -4.645
    2    HA3  GLY  13           HA2      GLY  13 -14.616  -2.803  -6.112
    3    HA2  GLY  13           HA3      GLY  13 -13.055  -2.389  -6.834

  No H/Q in entry =           3
  In of MODEL   20
    1    H    MET  14           H        MET  14 -11.583  -4.679  -5.945
    2    HA   MET  14           HA       MET  14 -12.015  -6.438  -8.037
    3    HB2  MET  14           HB2      MET  14  -9.946  -6.533  -6.737
    4    HB3  MET  14           HB3      MET  14 -10.811  -7.194  -5.351
    5    HG2  MET  14           HG2      MET  14 -11.429  -9.179  -6.711
    6    HG3  MET  14           HG3      MET  14 -10.534  -8.510  -8.076
    7    HE3  MET  14           HE1      MET  14  -6.967  -8.693  -7.343
    8    HE2  MET  14           HE2      MET  14  -7.771  -7.269  -6.684
    9    HE1  MET  14           HE3      MET  14  -8.327  -7.959  -8.207

  No H/Q in entry =           9
  In of MODEL   20
    1    H    SER  15           H        SER  15 -13.275  -6.862  -4.732
    2    HA   SER  15           HA       SER  15 -14.628  -9.315  -5.450
    3    HB2  SER  15           HB2      SER  15 -14.979  -7.564  -3.001
    4    HB3  SER  15           HB3      SER  15 -15.841  -9.077  -3.277
    5    HG   SER  15           HG       SER  15 -13.222  -8.631  -2.543

  No H/Q in entry =           5
  In of MODEL   20
    1    H    THR  16           H        THR  16 -15.682  -5.926  -5.026
    2    HA   THR  16           HA       THR  16 -18.475  -6.397  -5.559
    3    HB   THR  16           HB       THR  16 -16.890  -3.854  -6.059
    4    HG1  THR  16           HG1      THR  16 -18.124  -3.768  -3.745
    5   HG21  THR  16          HG21      THR  16 -19.317  -4.117  -6.849
    6   HG23  THR  16          HG22      THR  16 -18.975  -2.734  -5.796
    7   HG22  THR  16          HG23      THR  16 -19.744  -4.189  -5.144

  No H/Q in entry =           7
  In of MODEL   20
    1    H    SER  17           H        SER  17 -15.639  -5.890  -7.408
    2    HA   SER  17           HA       SER  17 -16.730  -5.119  -9.916
    3    HB2  SER  17           HB2      SER  17 -14.147  -6.542  -9.231
    4    HB3  SER  17           HB3      SER  17 -14.567  -6.015 -10.861
    5    HG   SER  17           HG       SER  17 -14.970  -3.961  -9.281

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU  18           H        LEU  18 -16.254  -8.278  -8.465
    2    HA   LEU  18           HA       LEU  18 -16.865  -9.762 -10.824
    3    HB2  LEU  18           HB2      LEU  18 -15.683 -10.755  -8.913
    4    HB3  LEU  18           HB3      LEU  18 -17.113 -10.524  -7.909
    5    HG   LEU  18           HG       LEU  18 -18.375 -12.070  -9.311
    6   HD11  LEU  18          HD11      LEU  18 -15.854 -11.990 -10.940
    7   HD13  LEU  18          HD12      LEU  18 -17.530 -11.858 -11.475
    8   HD12  LEU  18          HD13      LEU  18 -16.886 -13.419 -10.973
    9   HD21  LEU  18          HD21      LEU  18 -16.887 -12.799  -7.397
   10   HD23  LEU  18          HD22      LEU  18 -15.776 -13.384  -8.637
   11   HD22  LEU  18          HD23      LEU  18 -17.411 -14.039  -8.538

  No H/Q in entry =          11
  In of MODEL   20
    1    H    LEU  19           H        LEU  19 -18.819  -8.504  -8.126
    2    HA   LEU  19           HA       LEU  19 -21.306  -9.622  -8.974
    3    HB2  LEU  19           HB2      LEU  19 -21.027  -8.795  -6.721
    4    HB3  LEU  19           HB3      LEU  19 -20.702  -7.172  -7.326
    5    HG   LEU  19           HG       LEU  19 -23.016  -6.933  -8.021
    6   HD11  LEU  19          HD11      LEU  19 -23.344  -9.731  -6.923
    7   HD13  LEU  19          HD12      LEU  19 -23.529  -9.236  -8.606
    8   HD12  LEU  19          HD13      LEU  19 -24.671  -8.667  -7.389
    9   HD22  LEU  19          HD21      LEU  19 -22.397  -6.271  -5.779
   10   HD21  LEU  19          HD22      LEU  19 -22.696  -7.907  -5.189
   11   HD23  LEU  19          HD23      LEU  19 -24.035  -6.928  -5.789

  No H/Q in entry =          11
  In of MODEL   20
    1    H    VAL  20           H        VAL  20 -19.725  -6.501  -9.659
    2    HA   VAL  20           HA       VAL  20 -21.798  -5.405 -11.241
    3    HB   VAL  20           HB       VAL  20 -18.794  -4.892 -11.351
    4   HG13  VAL  20          HG11      VAL  20 -19.749  -4.311 -13.521
    5   HG12  VAL  20          HG12      VAL  20 -19.376  -2.838 -12.626
    6   HG11  VAL  20          HG13      VAL  20 -21.042  -3.405 -12.736
    7   HG22  VAL  20          HG21      VAL  20 -19.634  -4.136  -9.295
    8   HG21  VAL  20          HG22      VAL  20 -21.103  -3.502 -10.035
    9   HG23  VAL  20          HG23      VAL  20 -19.557  -2.703 -10.321

  No H/Q in entry =           9
  In of MODEL   20
    1    H    SER  21           H        SER  21 -19.088  -7.527 -12.251
    2    HA   SER  21           HA       SER  21 -19.852  -7.394 -15.007
    3    HB2  SER  21           HB2      SER  21 -18.465  -9.397 -15.332
    4    HB3  SER  21           HB3      SER  21 -17.610  -8.174 -14.395
    5    HG   SER  21           HG       SER  21 -18.173  -9.329 -12.523

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LYS  22           H        LYS  22 -20.990  -9.551 -12.443
    2    HA   LYS  22           HA       LYS  22 -22.559 -11.130 -14.275
    3    HB2  LYS  22           HB2      LYS  22 -22.910 -10.770 -11.295
    4    HB3  LYS  22           HB3      LYS  22 -23.668 -12.012 -12.290
    5    HG2  LYS  22           HG2      LYS  22 -20.697 -11.751 -11.850
    6    HG3  LYS  22           HG3      LYS  22 -21.756 -12.839 -10.953
    7    HD2  LYS  22           HD2      LYS  22 -22.355 -13.964 -13.066
    8    HD3  LYS  22           HD3      LYS  22 -21.238 -12.904 -13.927
    9    HE2  LYS  22           HE2      LYS  22 -19.363 -13.813 -12.635
   10    HE3  LYS  22           HE3      LYS  22 -20.472 -14.853 -11.740
   11    HZ3  LYS  22           HZ1      LYS  22 -20.212 -16.375 -13.287
   12    HZ2  LYS  22           HZ2      LYS  22 -19.186 -15.353 -14.176
   13    HZ1  LYS  22           HZ3      LYS  22 -20.861 -15.328 -14.456

  No H/Q in entry =          13
  In of MODEL   20
    1    H    MET  23           H        MET  23 -23.217  -8.190 -12.410
    2    HA   MET  23           HA       MET  23 -26.021  -8.192 -12.935
    3    HB2  MET  23           HB2      MET  23 -24.116  -5.935 -12.349
    4    HB3  MET  23           HB3      MET  23 -25.855  -5.718 -12.538
    5    HG2  MET  23           HG2      MET  23 -26.294  -7.011 -10.572
    6    HG3  MET  23           HG3      MET  23 -24.597  -7.469 -10.435
    7    HE2  MET  23           HE1      MET  23 -26.802  -3.756  -9.260
    8    HE1  MET  23           HE2      MET  23 -27.074  -4.717 -10.712
    9    HE3  MET  23           HE3      MET  23 -26.000  -3.319 -10.769

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ARG  24           H        ARG  24 -23.217  -6.840 -14.700
    2    HA   ARG  24           HA       ARG  24 -24.666  -5.497 -16.708
    3    HB2  ARG  24           HB2      ARG  24 -22.213  -5.174 -16.304
    4    HB3  ARG  24           HB3      ARG  24 -21.921  -6.773 -16.942
    5    HG2  ARG  24           HG2      ARG  24 -22.836  -6.033 -19.174
    6    HG3  ARG  24           HG3      ARG  24 -22.999  -4.392 -18.497
    7    HD2  ARG  24           HD2      ARG  24 -20.419  -6.025 -18.621
    8    HD3  ARG  24           HD3      ARG  24 -20.847  -4.699 -19.695
    9    HE   ARG  24           HE       ARG  24 -19.931  -4.351 -17.018
   10   HH21  ARG  24          HH11      ARG  24 -20.498  -2.392 -16.072
   11   HH22  ARG  24          HH12      ARG  24 -20.860  -1.030 -17.075
   12   HH11  ARG  24          HH21      ARG  24 -20.884  -3.039 -19.988
   13   HH12  ARG  24          HH22      ARG  24 -21.076  -1.422 -19.391

  No H/Q in entry =          13
  In of MODEL   20
    1    H    ALA  25           H        ALA  25 -23.641  -8.866 -16.428
    2    HA   ALA  25           HA       ALA  25 -24.275  -9.677 -19.070
    3    HB1  ALA  25           HB1      ALA  25 -23.642 -11.728 -18.371
    4    HB3  ALA  25           HB2      ALA  25 -24.708 -11.678 -16.968
    5    HB2  ALA  25           HB3      ALA  25 -23.130 -10.896 -16.904

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLN  26           H        GLN  26 -26.122  -9.665 -16.058
    2    HA   GLN  26           HA       GLN  26 -28.493 -10.799 -17.092
    3    HB2  GLN  26           HB2      GLN  26 -27.945  -9.069 -14.699
    4    HB3  GLN  26           HB3      GLN  26 -29.526  -9.747 -15.061
    5    HG2  GLN  26           HG2      GLN  26 -26.987 -11.278 -14.577
    6    HG3  GLN  26           HG3      GLN  26 -28.351 -11.137 -13.476
    7   HE21  GLN  26          HE21      GLN  26 -27.189 -13.335 -14.746
    8   HE22  GLN  26          HE22      GLN  26 -28.256 -14.351 -15.551

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ALA  27           H        ALA  27 -27.462  -7.431 -16.690
    2    HA   ALA  27           HA       ALA  27 -29.914  -6.265 -17.488
    3    HB1  ALA  27           HB1      ALA  27 -28.075  -5.004 -16.359
    4    HB3  ALA  27           HB2      ALA  27 -28.632  -4.219 -17.838
    5    HB2  ALA  27           HB3      ALA  27 -27.123  -5.131 -17.840

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLU  28           H        GLU  28 -27.238  -7.563 -19.341
    2    HA   GLU  28           HA       GLU  28 -28.124  -6.492 -21.865
    3    HB2  GLU  28           HB2      GLU  28 -25.771  -7.246 -21.226
    4    HB3  GLU  28           HB3      GLU  28 -26.363  -8.893 -21.435
    5    HG2  GLU  28           HG2      GLU  28 -25.181  -8.147 -23.394
    6    HG3  GLU  28           HG3      GLU  28 -26.885  -8.420 -23.754

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LYS  29           H        LYS  29 -28.393  -9.595 -20.216
    2    HA   LYS  29           HA       LYS  29 -29.725 -11.023 -22.231
    3    HB2  LYS  29           HB2      LYS  29 -28.717 -12.041 -20.222
    4    HB3  LYS  29           HB3      LYS  29 -29.975 -11.299 -19.235
    5    HG2  LYS  29           HG2      LYS  29 -31.668 -12.620 -20.317
    6    HG3  LYS  29           HG3      LYS  29 -30.480 -13.288 -21.433
    7    HD2  LYS  29           HD2      LYS  29 -29.385 -14.491 -19.696
    8    HD3  LYS  29           HD3      LYS  29 -30.274 -13.626 -18.444
    9    HE2  LYS  29           HE2      LYS  29 -31.093 -15.951 -18.817
   10    HE3  LYS  29           HE3      LYS  29 -32.333 -14.721 -19.067
   11    HZ1  LYS  29           HZ1      LYS  29 -31.756 -14.867 -21.490
   12    HZ3  LYS  29           HZ2      LYS  29 -32.521 -16.233 -20.833
   13    HZ2  LYS  29           HZ3      LYS  29 -30.849 -16.252 -21.119

  No H/Q in entry =          13
  In of MODEL   20
    1    H    TYR  30           H        TYR  30 -31.072  -8.884 -19.732
    2    HA   TYR  30           HA       TYR  30 -33.738  -9.253 -20.993
    3    HB2  TYR  30           HB2      TYR  30 -33.069  -8.124 -18.265
    4    HB3  TYR  30           HB3      TYR  30 -34.690  -8.333 -18.929
    5    HD1  TYR  30           HD1      TYR  30 -35.665 -10.597 -19.154
    6    HD2  TYR  30           HD2      TYR  30 -31.822  -9.990 -17.423
    7    HE1  TYR  30           HE1      TYR  30 -35.648 -12.928 -18.362
    8    HE2  TYR  30           HE2      TYR  30 -31.806 -12.307 -16.635
    9    HH   TYR  30           HH       TYR  30 -33.506 -14.616 -17.744

  No H/Q in entry =           9
  In of MODEL   20
    1    H    GLU  31           H        GLU  31 -31.509  -7.322 -21.774
    2    HA   GLU  31           HA       GLU  31 -31.368  -5.167 -22.591
    3    HB2  GLU  31           HB2      GLU  31 -34.278  -5.797 -23.125
    4    HB3  GLU  31           HB3      GLU  31 -33.394  -4.453 -23.846
    5    HG2  GLU  31           HG2      GLU  31 -31.955  -5.930 -25.030
    6    HG3  GLU  31           HG3      GLU  31 -32.566  -7.329 -24.150

  No H/Q in entry =           6
  In of MODEL   20
    1    H    VAL  32           H        VAL  32 -31.582  -5.066 -19.860
    2    HA   VAL  32           HA       VAL  32 -33.388  -2.902 -19.209
    3    HB   VAL  32           HB       VAL  32 -31.036  -3.966 -17.615
    4   HG12  VAL  32          HG11      VAL  32 -32.561  -3.103 -15.728
    5   HG11  VAL  32          HG12      VAL  32 -33.359  -2.173 -16.995
    6   HG13  VAL  32          HG13      VAL  32 -31.646  -1.919 -16.662
    7   HG21  VAL  32          HG21      VAL  32 -32.847  -5.634 -18.319
    8   HG23  VAL  32          HG22      VAL  32 -33.871  -4.781 -17.163
    9   HG22  VAL  32          HG23      VAL  32 -32.379  -5.547 -16.620

  No H/Q in entry =           9
  In of MODEL   20
    1    HA   PRO  33           HA       PRO  33 -30.264  -0.056 -20.855
    2    HB2  PRO  33           HB2      PRO  33 -31.714   2.208 -20.736
    3    HB3  PRO  33           HB3      PRO  33 -32.211   0.922 -21.836
    4    HG2  PRO  33           HG2      PRO  33 -33.184   1.459 -19.029
    5    HG3  PRO  33           HG3      PRO  33 -34.144   1.280 -20.498
    6    HD2  PRO  33           HD2      PRO  33 -33.757  -0.808 -18.834
    7    HD3  PRO  33           HD3      PRO  33 -33.813  -1.044 -20.581

  No H/Q in entry =           7
  In of MODEL   20
    1    H    VAL  34           H        VAL  34 -29.029  -0.639 -18.899
    2    HA   VAL  34           HA       VAL  34 -28.690   1.774 -17.243
    3    HB   VAL  34           HB       VAL  34 -28.162   0.292 -15.305
    4   HG12  VAL  34          HG11      VAL  34 -30.600  -0.515 -15.016
    5   HG11  VAL  34          HG12      VAL  34 -30.885   0.257 -16.575
    6   HG13  VAL  34          HG13      VAL  34 -30.314   1.214 -15.208
    7   HG21  VAL  34          HG21      VAL  34 -28.389  -1.723 -17.320
    8   HG23  VAL  34          HG22      VAL  34 -29.465  -2.059 -15.962
    9   HG22  VAL  34          HG23      VAL  34 -27.741  -1.820 -15.683

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ILE  35           H        ILE  35 -26.709   2.153 -16.389
    2    HA   ILE  35           HA       ILE  35 -24.432   0.764 -17.640
    3    HB   ILE  35           HB       ILE  35 -24.759   3.662 -16.824
    4   HG12  ILE  35          HG12      ILE  35 -23.795   2.336 -19.365
    5   HG13  ILE  35          HG13      ILE  35 -25.410   3.000 -19.116
    6   HG21  ILE  35          HG21      ILE  35 -22.237   2.062 -17.120
    7   HG23  ILE  35          HG22      ILE  35 -22.668   3.250 -15.891
    8   HG22  ILE  35          HG23      ILE  35 -22.261   3.778 -17.524
    9   HD11  ILE  35          HD11      ILE  35 -23.954   5.154 -18.499
   10   HD13  ILE  35          HD12      ILE  35 -24.490   4.790 -20.140
   11   HD12  ILE  35          HD13      ILE  35 -22.853   4.374 -19.634

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ILE  36           H        ILE  36 -23.241  -0.295 -16.036
    2    HA   ILE  36           HA       ILE  36 -23.683   0.324 -13.166
    3    HB   ILE  36           HB       ILE  36 -22.922  -2.398 -14.277
    4   HG12  ILE  36          HG12      ILE  36 -25.711  -1.519 -13.528
    5   HG13  ILE  36          HG13      ILE  36 -25.127  -1.509 -15.193
    6   HG23  ILE  36          HG21      ILE  36 -23.308  -3.222 -12.167
    7   HG22  ILE  36          HG22      ILE  36 -24.403  -1.910 -11.732
    8   HG21  ILE  36          HG23      ILE  36 -22.664  -1.624 -11.790
    9   HD13  ILE  36          HD11      ILE  36 -25.351  -3.717 -15.406
   10   HD12  ILE  36          HD12      ILE  36 -26.422  -3.570 -14.014
   11   HD11  ILE  36          HD13      ILE  36 -24.737  -4.037 -13.785

  No H/Q in entry =          11
  In of MODEL   20
    1    H    GLU  37           H        GLU  37 -21.893   0.903 -12.049
    2    HA   GLU  37           HA       GLU  37 -19.219   0.037 -12.949
    3    HB2  GLU  37           HB2      GLU  37 -20.051   2.848 -12.253
    4    HB3  GLU  37           HB3      GLU  37 -18.374   2.314 -12.364
    5    HG2  GLU  37           HG2      GLU  37 -18.634   1.882 -14.721
    6    HG3  GLU  37           HG3      GLU  37 -20.341   2.315 -14.634

  No H/Q in entry =           6
  In of MODEL   20
    1    H    ALA  38           H        ALA  38 -17.750  -0.244 -11.258
    2    HA   ALA  38           HA       ALA  38 -18.794  -0.045  -8.493
    3    HB1  ALA  38           HB1      ALA  38 -17.123  -2.025  -9.913
    4    HB3  ALA  38           HB2      ALA  38 -18.187  -2.237  -8.522
    5    HB2  ALA  38           HB3      ALA  38 -16.559  -1.597  -8.297

  No H/Q in entry =           5
  In of MODEL   20
    1    H    PHE  39           H        PHE  39 -17.532   1.128  -7.008
    2    HA   PHE  39           HA       PHE  39 -14.972   2.267  -7.885
    3    HB2  PHE  39           HB2      PHE  39 -17.338   3.821  -6.851
    4    HB3  PHE  39           HB3      PHE  39 -15.690   4.446  -6.809
    5    HD1  PHE  39           HD1      PHE  39 -14.468   4.818  -8.936
    6    HD2  PHE  39           HD2      PHE  39 -18.625   3.879  -8.811
    7    HE1  PHE  39           HE1      PHE  39 -14.719   5.679 -11.247
    8    HE2  PHE  39           HE2      PHE  39 -18.891   4.728 -11.114
    9    HZ   PHE  39           HZ       PHE  39 -16.938   5.601 -12.352

  No H/Q in entry =           9
  In of MODEL   20
    1    HA   PRO  40           HA       PRO  40 -14.080   1.480  -3.595
    2    HB2  PRO  40           HB2      PRO  40 -12.268   3.447  -2.971
    3    HB3  PRO  40           HB3      PRO  40 -11.850   2.109  -4.041
    4    HG2  PRO  40           HG2      PRO  40 -12.806   4.872  -4.784
    5    HG3  PRO  40           HG3      PRO  40 -11.394   4.001  -5.382
    6    HD2  PRO  40           HD2      PRO  40 -13.608   3.963  -6.812
    7    HD3  PRO  40           HD3      PRO  40 -12.688   2.472  -6.611

  No H/Q in entry =           7
  In of MODEL   20
    1    H    GLU  41           H        GLU  41 -14.691   2.468  -1.466
    2    HA   GLU  41           HA       GLU  41 -16.894   4.224  -1.460
    3    HB2  GLU  41           HB2      GLU  41 -16.677   4.214   0.955
    4    HB3  GLU  41           HB3      GLU  41 -16.430   2.585   0.325
    5    HG2  GLU  41           HG2      GLU  41 -14.772   2.699   1.898
    6    HG3  GLU  41           HG3      GLU  41 -13.902   3.225   0.457

  No H/Q in entry =           6
  In of MODEL   20
    1    H    THR  42           H        THR  42 -13.542   5.061  -1.487
    2    HA   THR  42           HA       THR  42 -13.841   7.627  -0.271
    3    HB   THR  42           HB       THR  42 -11.664   8.151  -1.360
    4    HG1  THR  42           HG1      THR  42 -12.392   6.584  -3.176
    5   HG22  THR  42          HG21      THR  42 -10.381   6.248  -0.322
    6   HG21  THR  42          HG22      THR  42 -11.925   5.445  -0.032
    7   HG23  THR  42          HG23      THR  42 -11.573   6.985   0.749

  No H/Q in entry =           7
  In of MODEL   20
    1    H    LEU  43           H        LEU  43 -14.751   6.561  -3.380
    2    HA   LEU  43           HA       LEU  43 -14.931   9.341  -4.345
    3    HB2  LEU  43           HB2      LEU  43 -15.154   6.660  -5.678
    4    HB3  LEU  43           HB3      LEU  43 -15.668   8.146  -6.474
    5    HG   LEU  43           HG       LEU  43 -12.846   7.590  -5.599
    6   HD12  LEU  43          HD11      LEU  43 -12.691   7.547  -8.246
    7   HD11  LEU  43          HD12      LEU  43 -14.346   6.958  -8.088
    8   HD13  LEU  43          HD13      LEU  43 -13.024   6.085  -7.315
    9   HD21  LEU  43          HD21      LEU  43 -14.211   9.775  -7.156
   10   HD23  LEU  43          HD22      LEU  43 -12.482   9.463  -7.316
   11   HD22  LEU  43          HD23      LEU  43 -13.154   9.918  -5.752

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ALA  44           H        ALA  44 -16.932   7.558  -2.510
    2    HA   ALA  44           HA       ALA  44 -19.403   7.480  -3.847
    3    HB3  ALA  44           HB1      ALA  44 -19.305   6.356  -1.753
    4    HB2  ALA  44           HB2      ALA  44 -20.383   7.726  -1.485
    5    HB1  ALA  44           HB3      ALA  44 -18.713   7.794  -0.921

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLY  45           H        GLY  45 -17.927  10.243  -2.300
    2    HA3  GLY  45           HA2      GLY  45 -20.326  11.801  -2.673
    3    HA2  GLY  45           HA3      GLY  45 -18.771  12.388  -2.084

  No H/Q in entry =           3
  In of MODEL   20
    1    H    GLU  46           H        GLU  46 -17.247  11.419  -4.367
    2    HA   GLU  46           HA       GLU  46 -17.820  13.654  -6.135
    3    HB2  GLU  46           HB2      GLU  46 -15.675  11.524  -6.145
    4    HB3  GLU  46           HB3      GLU  46 -15.768  12.843  -7.313
    5    HG2  GLU  46           HG2      GLU  46 -14.209  13.616  -5.805
    6    HG3  GLU  46           HG3      GLU  46 -15.698  14.375  -5.240

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LYS  47           H        LYS  47 -17.782  10.134  -6.578
    2    HA   LYS  47           HA       LYS  47 -18.857  10.386  -9.260
    3    HB2  LYS  47           HB2      LYS  47 -18.383   7.967  -7.508
    4    HB3  LYS  47           HB3      LYS  47 -18.903   7.912  -9.193
    5    HG2  LYS  47           HG2      LYS  47 -16.341   9.210  -8.340
    6    HG3  LYS  47           HG3      LYS  47 -16.454   7.497  -8.739
    7    HD2  LYS  47           HD2      LYS  47 -17.332   8.068 -10.949
    8    HD3  LYS  47           HD3      LYS  47 -17.225   9.781 -10.550
    9    HE2  LYS  47           HE2      LYS  47 -14.809   9.583 -10.303
   10    HE3  LYS  47           HE3      LYS  47 -14.906   7.861 -10.668
   11    HZ3  LYS  47           HZ1      LYS  47 -14.652   8.444 -12.768
   12    HZ2  LYS  47           HZ2      LYS  47 -14.896  10.091 -12.436
   13    HZ1  LYS  47           HZ3      LYS  47 -16.228   9.074 -12.720

  No H/Q in entry =          13
  In of MODEL   20
    1    H    GLY  48           H        GLY  48 -20.218   9.654  -6.122
    2    HA3  GLY  48           HA2      GLY  48 -22.626   8.527  -6.880
    3    HA2  GLY  48           HA3      GLY  48 -22.386   9.512  -5.438

  No H/Q in entry =           3
  In of MODEL   20
    1    H    GLN  49           H        GLN  49 -21.736  11.924  -6.999
    2    HA   GLN  49           HA       GLN  49 -24.266  13.096  -7.157
    3    HB2  GLN  49           HB2      GLN  49 -21.694  13.902  -8.499
    4    HB3  GLN  49           HB3      GLN  49 -23.133  14.902  -8.423
    5    HG2  GLN  49           HG2      GLN  49 -22.990  14.917  -5.984
    6    HG3  GLN  49           HG3      GLN  49 -21.564  13.896  -6.060
    7   HE21  GLN  49          HE21      GLN  49 -21.401  16.119  -4.782
    8   HE22  GLN  49          HE22      GLN  49 -20.445  17.354  -5.421

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ASN  50           H        ASN  50 -22.618  11.182  -9.538
    2    HA   ASN  50           HA       ASN  50 -24.466  12.103 -11.630
    3    HB2  ASN  50           HB2      ASN  50 -21.922  10.502 -11.851
    4    HB3  ASN  50           HB3      ASN  50 -22.953  10.956 -13.200
    5   HD21  ASN  50          HD21      ASN  50 -20.308  11.735 -11.570
    6   HD22  ASN  50          HD22      ASN  50 -20.032  13.365 -11.907

  No H/Q in entry =           6
  In of MODEL   20
    1    H    ALA  51           H        ALA  51 -24.523   9.743  -9.390
    2    HA   ALA  51           HA       ALA  51 -25.347   7.621 -11.226
    3    HB2  ALA  51           HB1      ALA  51 -24.807   6.254  -9.538
    4    HB3  ALA  51           HB2      ALA  51 -25.916   7.087  -8.450
    5    HB1  ALA  51           HB3      ALA  51 -24.262   7.669  -8.636

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ASP  52           H        ASP  52 -27.378   6.615 -11.100
    2    HA   ASP  52           HA       ASP  52 -29.518   8.500 -10.445
    3    HB2  ASP  52           HB2      ASP  52 -29.378   5.995 -12.120
    4    HB3  ASP  52           HB3      ASP  52 -30.907   6.765 -11.693

  No H/Q in entry =           4
  In of MODEL   20
    1    H    VAL  53           H        VAL  53 -27.997   5.570  -9.426
    2    HA   VAL  53           HA       VAL  53 -29.448   5.728  -6.918
    3    HB   VAL  53           HB       VAL  53 -30.880   4.124  -8.175
    4   HG11  VAL  53          HG11      VAL  53 -29.146   3.224  -9.688
    5   HG13  VAL  53          HG12      VAL  53 -30.016   1.949  -8.837
    6   HG12  VAL  53          HG13      VAL  53 -28.397   2.409  -8.315
    7   HG23  VAL  53          HG21      VAL  53 -30.119   2.124  -6.482
    8   HG22  VAL  53          HG22      VAL  53 -31.218   3.455  -6.120
    9   HG21  VAL  53          HG23      VAL  53 -29.509   3.584  -5.701

  No H/Q in entry =           9
  In of MODEL   20
    1    H    VAL  54           H        VAL  54 -28.158   5.259  -5.256
    2    HA   VAL  54           HA       VAL  54 -25.416   4.341  -5.852
    3    HB   VAL  54           HB       VAL  54 -26.455   6.141  -3.605
    4   HG11  VAL  54          HG11      VAL  54 -23.912   4.657  -3.883
    5   HG13  VAL  54          HG12      VAL  54 -24.656   5.352  -2.444
    6   HG12  VAL  54          HG13      VAL  54 -23.718   6.374  -3.531
    7   HG22  VAL  54          HG21      VAL  54 -25.543   7.935  -4.695
    8   HG21  VAL  54          HG22      VAL  54 -26.107   6.961  -6.053
    9   HG23  VAL  54          HG23      VAL  54 -24.402   6.943  -5.603

  No H/Q in entry =           9
  In of MODEL   20
    1    H    LEU  55           H        LEU  55 -24.877   2.403  -5.210
    2    HA   LEU  55           HA       LEU  55 -26.433   1.127  -3.046
    3    HB2  LEU  55           HB2      LEU  55 -24.891  -0.076  -5.335
    4    HB3  LEU  55           HB3      LEU  55 -25.685  -0.993  -4.052
    5    HG   LEU  55           HG       LEU  55 -27.066   0.636  -6.176
    6   HD13  LEU  55          HD11      LEU  55 -26.807  -1.222  -7.397
    7   HD12  LEU  55          HD12      LEU  55 -27.794  -2.074  -6.210
    8   HD11  LEU  55          HD13      LEU  55 -26.038  -2.055  -6.048
    9   HD23  LEU  55          HD21      LEU  55 -28.423  -1.280  -4.333
   10   HD22  LEU  55          HD22      LEU  55 -29.077   0.121  -5.182
   11   HD21  LEU  55          HD23      LEU  55 -28.060   0.347  -3.760

  No H/Q in entry =          11
  In of MODEL   20
    1    H    LEU  56           H        LEU  56 -25.308   0.500  -1.235
    2    HA   LEU  56           HA       LEU  56 -22.365   0.820  -1.265
    3    HB2  LEU  56           HB2      LEU  56 -24.187   0.650   1.122
    4    HB3  LEU  56           HB3      LEU  56 -22.468   1.035   1.122
    5    HG   LEU  56           HG       LEU  56 -24.716   2.775   0.147
    6   HD11  LEU  56          HD11      LEU  56 -23.627   2.359   2.674
    7   HD13  LEU  56          HD12      LEU  56 -24.578   3.755   2.165
    8   HD12  LEU  56          HD13      LEU  56 -22.818   3.814   2.089
    9   HD23  LEU  56          HD21      LEU  56 -22.726   4.422  -0.030
   10   HD22  LEU  56          HD22      LEU  56 -23.129   3.339  -1.362
   11   HD21  LEU  56          HD23      LEU  56 -21.792   2.948  -0.282

  No H/Q in entry =          11
  In of MODEL   20
    1    H    GLY  57           H        GLY  57 -21.031  -0.848  -0.726
    2    HA3  GLY  57           HA2      GLY  57 -22.020  -3.508  -0.937
    3    HA2  GLY  57           HA3      GLY  57 -20.389  -3.057  -0.443

  No H/Q in entry =           3
  In of MODEL   20
    1    HA   PRO  58           HA       PRO  58 -23.249  -4.029   3.246
    2    HB2  PRO  58           HB2      PRO  58 -22.636  -6.653   3.851
    3    HB3  PRO  58           HB3      PRO  58 -24.004  -6.206   2.830
    4    HG2  PRO  58           HG2      PRO  58 -21.295  -7.157   2.059
    5    HG3  PRO  58           HG3      PRO  58 -22.866  -7.574   1.377
    6    HD2  PRO  58           HD2      PRO  58 -21.203  -5.797   0.168
    7    HD3  PRO  58           HD3      PRO  58 -22.958  -5.665   0.055

  No H/Q in entry =           7
  In of MODEL   20
    1    H    GLN  59           H        GLN  59 -19.888  -4.589   2.659
    2    HA   GLN  59           HA       GLN  59 -19.151  -4.633   5.425
    3    HB2  GLN  59           HB2      GLN  59 -17.518  -3.803   3.021
    4    HB3  GLN  59           HB3      GLN  59 -16.886  -4.068   4.633
    5    HG2  GLN  59           HG2      GLN  59 -16.778  -5.914   2.735
    6    HG3  GLN  59           HG3      GLN  59 -16.958  -6.327   4.433
    7   HE21  GLN  59          HE21      GLN  59 -18.109  -6.719   1.586
    8   HE22  GLN  59          HE22      GLN  59 -19.605  -7.443   1.589

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ILE  60           H        ILE  60 -20.003  -2.054   3.215
    2    HA   ILE  60           HA       ILE  60 -19.112  -0.124   5.271
    3    HB   ILE  60           HB       ILE  60 -19.281   1.616   3.451
    4   HG12  ILE  60          HG12      ILE  60 -19.133  -0.585   1.442
    5   HG13  ILE  60          HG13      ILE  60 -20.713  -0.048   2.010
    6   HG21  ILE  60          HG21      ILE  60 -17.205   0.234   4.182
    7   HG23  ILE  60          HG22      ILE  60 -17.128   1.315   2.791
    8   HG22  ILE  60          HG23      ILE  60 -17.324  -0.420   2.549
    9   HD11  ILE  60          HD11      ILE  60 -19.855   2.332   1.400
   10   HD13  ILE  60          HD12      ILE  60 -20.376   1.257   0.104
   11   HD12  ILE  60          HD13      ILE  60 -18.657   1.472   0.434

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ALA  61           H        ALA  61 -21.609  -1.643   5.321
    2    HA   ALA  61           HA       ALA  61 -23.787   0.081   4.851
    3    HB1  ALA  61           HB1      ALA  61 -25.051  -1.378   6.167
    4    HB2  ALA  61           HB2      ALA  61 -23.669  -1.807   7.177
    5    HB3  ALA  61           HB3      ALA  61 -23.770  -2.408   5.522

  No H/Q in entry =           5
  In of MODEL   20
    1    H    TYR  62           H        TYR  62 -21.601  -0.095   7.663
    2    HA   TYR  62           HA       TYR  62 -23.122   1.600   9.327
    3    HB2  TYR  62           HB2      TYR  62 -21.066   1.983  10.562
    4    HB3  TYR  62           HB3      TYR  62 -21.192   0.280  10.125
    5    HD1  TYR  62           HD1      TYR  62 -19.625  -0.727   8.532
    6    HD2  TYR  62           HD2      TYR  62 -19.315   3.407   9.567
    7    HE1  TYR  62           HE1      TYR  62 -17.405  -0.630   7.465
    8    HE2  TYR  62           HE2      TYR  62 -17.081   3.498   8.502
    9    HH   TYR  62           HH       TYR  62 -15.849   0.765   6.688

  No H/Q in entry =           9
  In of MODEL   20
    1    H    MET  63           H        MET  63 -21.439   2.420   6.483
    2    HA   MET  63           HA       MET  63 -21.200   5.245   7.183
    3    HB2  MET  63           HB2      MET  63 -20.625   3.719   4.642
    4    HB3  MET  63           HB3      MET  63 -20.373   5.454   4.843
    5    HG2  MET  63           HG2      MET  63 -18.690   5.025   6.539
    6    HG3  MET  63           HG3      MET  63 -18.954   3.290   6.372
    7    HE2  MET  63           HE1      MET  63 -16.828   6.108   3.549
    8    HE1  MET  63           HE2      MET  63 -17.771   6.480   4.993
    9    HE3  MET  63           HE3      MET  63 -18.588   6.183   3.457

  No H/Q in entry =           9
  In of MODEL   20
    1    H    LEU  64           H        LEU  64 -23.808   3.463   6.199
    2    HA   LEU  64           HA       LEU  64 -24.966   4.917   4.117
    3    HB2  LEU  64           HB2      LEU  64 -25.898   2.834   5.025
    4    HB3  LEU  64           HB3      LEU  64 -26.340   3.687   6.503
    5    HG   LEU  64           HG       LEU  64 -27.992   4.989   5.268
    6   HD13  LEU  64          HD11      LEU  64 -27.689   5.226   3.037
    7   HD12  LEU  64          HD12      LEU  64 -28.379   3.609   2.884
    8   HD11  LEU  64          HD13      LEU  64 -26.629   3.820   2.954
    9   HD23  LEU  64          HD21      LEU  64 -28.583   2.193   4.511
   10   HD22  LEU  64          HD22      LEU  64 -29.545   3.352   5.428
   11   HD21  LEU  64          HD23      LEU  64 -28.198   2.520   6.201

  No H/Q in entry =          11
  In of MODEL   20
    1    HA   PRO  65           HA       PRO  65 -27.074   8.126   6.860
    2    HB2  PRO  65           HB2      PRO  65 -25.084   8.224   9.128
    3    HB3  PRO  65           HB3      PRO  65 -26.815   8.553   9.163
    4    HG2  PRO  65           HG2      PRO  65 -25.954   6.272  10.091
    5    HG3  PRO  65           HG3      PRO  65 -27.368   6.281   9.037
    6    HD2  PRO  65           HD2      PRO  65 -24.510   5.587   8.350
    7    HD3  PRO  65           HD3      PRO  65 -25.989   4.743   7.892

  No H/Q in entry =           7
  In of MODEL   20
    1    H    GLU  66           H        GLU  66 -23.522   7.970   6.955
    2    HA   GLU  66           HA       GLU  66 -23.144  10.760   6.557
    3    HB2  GLU  66           HB2      GLU  66 -21.392   8.402   5.911
    4    HB3  GLU  66           HB3      GLU  66 -20.894  10.081   5.710
    5    HG2  GLU  66           HG2      GLU  66 -21.108  10.454   8.077
    6    HG3  GLU  66           HG3      GLU  66 -21.683   8.801   8.303

  No H/Q in entry =           6
  In of MODEL   20
    1    H    ILE  67           H        ILE  67 -23.310   8.022   4.299
    2    HA   ILE  67           HA       ILE  67 -22.831   9.721   2.012
    3    HB   ILE  67           HB       ILE  67 -23.815   6.842   2.181
    4   HG12  ILE  67          HG12      ILE  67 -21.147   7.936   1.276
    5   HG13  ILE  67          HG13      ILE  67 -21.463   7.522   2.959
    6   HG21  ILE  67          HG21      ILE  67 -23.689   8.722  -0.040
    7   HG23  ILE  67          HG22      ILE  67 -24.362   7.092   0.003
    8   HG22  ILE  67          HG23      ILE  67 -22.645   7.328  -0.315
    9   HD12  ILE  67          HD11      ILE  67 -21.081   5.744   0.609
   10   HD11  ILE  67          HD12      ILE  67 -22.119   5.198   1.925
   11   HD13  ILE  67          HD13      ILE  67 -20.436   5.613   2.244

  No H/Q in entry =          11
  In of MODEL   20
    1    H    GLN  68           H        GLN  68 -25.740   8.750   3.626
    2    HA   GLN  68           HA       GLN  68 -27.529   9.738   1.644
    3    HB2  GLN  68           HB2      GLN  68 -27.813   9.382   4.624
    4    HB3  GLN  68           HB3      GLN  68 -29.109  10.018   3.625
    5    HG2  GLN  68           HG2      GLN  68 -29.190   7.993   2.345
    6    HG3  GLN  68           HG3      GLN  68 -27.763   7.371   3.154
    7   HE21  GLN  68          HE21      GLN  68 -29.981   6.080   3.004
    8   HE22  GLN  68          HE22      GLN  68 -30.831   5.646   4.413

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ARG  69           H        ARG  69 -25.890  11.349   4.394
    2    HA   ARG  69           HA       ARG  69 -27.175  13.874   3.986
    3    HB2  ARG  69           HB2      ARG  69 -24.870  12.869   5.585
    4    HB3  ARG  69           HB3      ARG  69 -24.893  14.590   5.230
    5    HG2  ARG  69           HG2      ARG  69 -27.213  14.703   6.188
    6    HG3  ARG  69           HG3      ARG  69 -27.060  13.007   6.660
    7    HD2  ARG  69           HD2      ARG  69 -25.300  15.307   7.588
    8    HD3  ARG  69           HD3      ARG  69 -26.463  14.433   8.574
    9    HE   ARG  69           HE       ARG  69 -23.875  13.423   7.637
   10   HH21  ARG  69          HH11      ARG  69 -23.129  11.634   8.833
   11   HH22  ARG  69          HH12      ARG  69 -24.188  10.847   9.955
   12   HH11  ARG  69          HH21      ARG  69 -26.857  12.965   9.317
   13   HH12  ARG  69          HH22      ARG  69 -26.300  11.600  10.226

  No H/Q in entry =          13
  In of MODEL   20
    1    H    LEU  70           H        LEU  70 -24.342  12.381   2.638
    2    HA   LEU  70           HA       LEU  70 -23.148  14.712   1.481
    3    HB2  LEU  70           HB2      LEU  70 -22.231  12.364   2.077
    4    HB3  LEU  70           HB3      LEU  70 -22.851  11.920   0.487
    5    HG   LEU  70           HG       LEU  70 -21.209  13.244  -0.586
    6   HD11  LEU  70          HD11      LEU  70 -20.376  14.055   2.207
    7   HD13  LEU  70          HD12      LEU  70 -21.031  15.114   0.958
    8   HD12  LEU  70          HD13      LEU  70 -19.442  14.382   0.746
    9   HD22  LEU  70          HD21      LEU  70 -19.833  11.483  -0.350
   10   HD21  LEU  70          HD22      LEU  70 -20.782  10.986   1.051
   11   HD23  LEU  70          HD23      LEU  70 -19.365  12.014   1.265

  No H/Q in entry =          11
  In of MODEL   20
    1    H    LEU  71           H        LEU  71 -25.376  12.242   0.348
    2    HA   LEU  71           HA       LEU  71 -25.839  13.750  -2.168
    3    HB2  LEU  71           HB2      LEU  71 -26.144  10.773  -1.729
    4    HB3  LEU  71           HB3      LEU  71 -26.235  11.641  -3.261
    5    HG   LEU  71           HG       LEU  71 -23.725  11.568  -1.586
    6   HD12  LEU  71          HD11      LEU  71 -23.819   9.947  -4.023
    7   HD11  LEU  71          HD12      LEU  71 -24.856   9.354  -2.726
    8   HD13  LEU  71          HD13      LEU  71 -23.129   9.577  -2.442
    9   HD22  LEU  71          HD21      LEU  71 -23.760  13.389  -3.076
   10   HD21  LEU  71          HD22      LEU  71 -24.285  12.367  -4.413
   11   HD23  LEU  71          HD23      LEU  71 -22.673  12.165  -3.728

  No H/Q in entry =          11
  In of MODEL   20
    1    HA   PRO  72           HA       PRO  72 -29.732  13.425   0.432
    2    HB2  PRO  72           HB2      PRO  72 -30.502  16.013   0.352
    3    HB3  PRO  72           HB3      PRO  72 -29.215  15.515   1.450
    4    HG2  PRO  72           HG2      PRO  72 -28.974  16.709  -1.300
    5    HG3  PRO  72           HG3      PRO  72 -28.197  17.231   0.194
    6    HD2  PRO  72           HD2      PRO  72 -26.904  15.632  -1.568
    7    HD3  PRO  72           HD3      PRO  72 -26.665  15.453   0.169

  No H/Q in entry =           7
  In of MODEL   20
    1    H    ASN  73           H        ASN  73 -29.059  14.364  -2.777
    2    HA   ASN  73           HA       ASN  73 -31.924  14.155  -3.425
    3    HB2  ASN  73           HB2      ASN  73 -31.410  15.249  -5.517
    4    HB3  ASN  73           HB3      ASN  73 -30.861  16.208  -4.151
    5   HD21  ASN  73          HD21      ASN  73 -30.050  16.231  -6.824
    6   HD22  ASN  73          HD22      ASN  73 -28.388  16.013  -7.008

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LYS  74           H        LYS  74 -30.026  11.832  -2.994
    2    HA   LYS  74           HA       LYS  74 -30.627  10.463  -5.549
    3    HB2  LYS  74           HB2      LYS  74 -28.116  10.079  -3.914
    4    HB3  LYS  74           HB3      LYS  74 -28.519   9.284  -5.436
    5    HG2  LYS  74           HG2      LYS  74 -28.152  12.242  -5.227
    6    HG3  LYS  74           HG3      LYS  74 -26.814  11.132  -5.525
    7    HD2  LYS  74           HD2      LYS  74 -27.953  10.249  -7.477
    8    HD3  LYS  74           HD3      LYS  74 -29.338  11.294  -7.162
    9    HE2  LYS  74           HE2      LYS  74 -28.040  13.257  -7.594
   10    HE3  LYS  74           HE3      LYS  74 -26.551  12.314  -7.679
   11    HZ2  LYS  74           HZ1      LYS  74 -27.988  12.972  -9.811
   12    HZ1  LYS  74           HZ2      LYS  74 -28.698  11.474  -9.445
   13    HZ3  LYS  74           HZ3      LYS  74 -27.028  11.575  -9.732

  No H/Q in entry =          13
  In of MODEL   20
    1    HA   PRO  75           HA       PRO  75 -32.144   7.524  -2.591
    2    HB2  PRO  75           HB2      PRO  75 -32.524   5.321  -4.180
    3    HB3  PRO  75           HB3      PRO  75 -33.601   6.715  -4.252
    4    HG2  PRO  75           HG2      PRO  75 -31.277   6.038  -6.012
    5    HG3  PRO  75           HG3      PRO  75 -32.906   6.535  -6.467
    6    HD2  PRO  75           HD2      PRO  75 -30.898   8.329  -6.410
    7    HD3  PRO  75           HD3      PRO  75 -32.518   8.786  -5.879

  No H/Q in entry =           7
  In of MODEL   20
    1    H    VAL  76           H        VAL  76 -30.737   6.414  -1.212
    2    HA   VAL  76           HA       VAL  76 -28.311   5.119  -2.309
    3    HB   VAL  76           HB       VAL  76 -28.561   6.590   0.350
    4   HG11  VAL  76          HG11      VAL  76 -26.245   5.221  -1.031
    5   HG13  VAL  76          HG12      VAL  76 -26.966   4.793   0.521
    6   HG12  VAL  76          HG13      VAL  76 -26.064   6.299   0.354
    7   HG22  VAL  76          HG21      VAL  76 -27.820   8.467  -0.530
    8   HG21  VAL  76          HG22      VAL  76 -28.379   7.793  -2.062
    9   HG23  VAL  76          HG23      VAL  76 -26.684   7.644  -1.598

  No H/Q in entry =           9
  In of MODEL   20
    1    H    GLU  77           H        GLU  77 -28.176   2.957  -1.699
    2    HA   GLU  77           HA       GLU  77 -29.006   2.194   0.948
    3    HB2  GLU  77           HB2      GLU  77 -30.668   0.607   0.405
    4    HB3  GLU  77           HB3      GLU  77 -31.158   2.149  -0.296
    5    HG2  GLU  77           HG2      GLU  77 -30.564   1.375  -2.481
    6    HG3  GLU  77           HG3      GLU  77 -29.980  -0.146  -1.808

  No H/Q in entry =           6
  In of MODEL   20
    1    H    VAL  78           H        VAL  78 -28.757   0.095   1.606
    2    HA   VAL  78           HA       VAL  78 -26.115  -0.770   0.732
    3    HB   VAL  78           HB       VAL  78 -27.867  -1.596   3.086
    4   HG11  VAL  78          HG11      VAL  78 -25.567  -2.906   1.972
    5   HG13  VAL  78          HG12      VAL  78 -26.499  -3.346   3.404
    6   HG12  VAL  78          HG13      VAL  78 -25.139  -2.233   3.544
    7   HG22  VAL  78          HG21      VAL  78 -26.368  -0.289   4.434
    8   HG21  VAL  78          HG22      VAL  78 -27.062   0.710   3.156
    9   HG23  VAL  78          HG23      VAL  78 -25.404   0.122   3.015

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ILE  79           H        ILE  79 -25.642  -2.694  -0.175
    2    HA   ILE  79           HA       ILE  79 -27.746  -4.096  -1.536
    3    HB   ILE  79           HB       ILE  79 -24.777  -4.728  -1.299
    4   HG12  ILE  79          HG12      ILE  79 -26.360  -3.564  -3.595
    5   HG13  ILE  79          HG13      ILE  79 -25.457  -2.588  -2.435
    6   HG22  ILE  79          HG21      ILE  79 -25.907  -5.865  -3.626
    7   HG21  ILE  79          HG22      ILE  79 -26.918  -6.353  -2.265
    8   HG23  ILE  79          HG23      ILE  79 -25.188  -6.694  -2.246
    9   HD13  ILE  79          HD11      ILE  79 -24.038  -2.748  -4.246
   10   HD12  ILE  79          HD12      ILE  79 -24.437  -4.443  -4.531
   11   HD11  ILE  79          HD13      ILE  79 -23.444  -3.993  -3.144

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ASP  80           H        ASP  80 -28.682  -5.988  -0.962
    2    HA   ASP  80           HA       ASP  80 -28.675  -6.893   1.684
    3    HB2  ASP  80           HB2      ASP  80 -30.439  -7.403   0.034
    4    HB3  ASP  80           HB3      ASP  80 -29.313  -8.450  -0.831

  No H/Q in entry =           4
  In of MODEL   20
    1    H    SER  81           H        SER  81 -27.189  -8.083   2.821
    2    HA   SER  81           HA       SER  81 -24.711  -8.853   1.642
    3    HB2  SER  81           HB2      SER  81 -24.209  -9.904   3.813
    4    HB3  SER  81           HB3      SER  81 -24.854  -8.276   4.025
    5    HG   SER  81           HG       SER  81 -26.246 -10.714   4.305

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU  82           H        LEU  82 -27.496 -10.846   1.945
    2    HA   LEU  82           HA       LEU  82 -26.031 -13.267   1.430
    3    HB2  LEU  82           HB2      LEU  82 -28.942 -12.549   1.155
    4    HB3  LEU  82           HB3      LEU  82 -28.293 -14.175   0.954
    5    HG   LEU  82           HG       LEU  82 -28.195 -12.592   3.503
    6   HD11  LEU  82          HD11      LEU  82 -29.983 -14.882   2.645
    7   HD13  LEU  82          HD12      LEU  82 -30.494 -13.208   2.877
    8   HD12  LEU  82          HD13      LEU  82 -29.937 -14.160   4.254
    9   HD21  LEU  82          HD21      LEU  82 -27.306 -15.317   2.607
   10   HD23  LEU  82          HD22      LEU  82 -27.692 -15.006   4.298
   11   HD22  LEU  82          HD23      LEU  82 -26.403 -14.099   3.508

  No H/Q in entry =          11
  In of MODEL   20
    1    H    LEU  83           H        LEU  83 -27.897 -10.971  -0.496
    2    HA   LEU  83           HA       LEU  83 -27.730 -12.332  -2.969
    3    HB2  LEU  83           HB2      LEU  83 -28.041  -9.414  -2.319
    4    HB3  LEU  83           HB3      LEU  83 -28.086 -10.055  -3.960
    5    HG   LEU  83           HG       LEU  83 -30.144 -10.371  -1.796
    6   HD13  LEU  83          HD11      LEU  83 -30.828  -8.496  -2.862
    7   HD12  LEU  83          HD12      LEU  83 -31.324  -9.591  -4.151
    8   HD11  LEU  83          HD13      LEU  83 -29.758  -8.780  -4.234
    9   HD23  LEU  83          HD21      LEU  83 -30.313 -11.620  -4.524
   10   HD22  LEU  83          HD22      LEU  83 -31.303 -11.937  -3.099
   11   HD21  LEU  83          HD23      LEU  83 -29.633 -12.500  -3.155

  No H/Q in entry =          11
  In of MODEL   20
    1    H    TYR  84           H        TYR  84 -25.703 -10.021  -1.278
    2    HA   TYR  84           HA       TYR  84 -23.812  -9.598  -3.398
    3    HB2  TYR  84           HB2      TYR  84 -24.287  -8.094  -1.380
    4    HB3  TYR  84           HB3      TYR  84 -23.320  -9.233  -0.445
    5    HD1  TYR  84           HD1      TYR  84 -20.943  -9.198  -0.534
    6    HD2  TYR  84           HD2      TYR  84 -23.210  -6.806  -3.250
    7    HE1  TYR  84           HE1      TYR  84 -18.870  -8.049  -1.234
    8    HE2  TYR  84           HE2      TYR  84 -21.144  -5.657  -3.966
    9    HH   TYR  84           HH       TYR  84 -18.026  -6.808  -3.111

  No H/Q in entry =           9
  In of MODEL   20
    1    H    GLY  85           H        GLY  85 -23.661 -11.611  -0.452
    2    HA3  GLY  85           HA2      GLY  85 -21.117 -12.646  -0.922
    3    HA2  GLY  85           HA3      GLY  85 -22.382 -13.449   0.008

  No H/Q in entry =           3
  In of MODEL   20
    1    H    LYS  86           H        LYS  86 -24.229 -13.753  -2.063
    2    HA   LYS  86           HA       LYS  86 -23.254 -16.162  -3.319
    3    HB2  LYS  86           HB2      LYS  86 -25.488 -16.006  -2.396
    4    HB3  LYS  86           HB3      LYS  86 -25.847 -14.622  -3.428
    5    HG2  LYS  86           HG2      LYS  86 -26.963 -16.591  -4.220
    6    HG3  LYS  86           HG3      LYS  86 -25.739 -16.073  -5.379
    7    HD2  LYS  86           HD2      LYS  86 -24.207 -17.741  -4.645
    8    HD3  LYS  86           HD3      LYS  86 -25.183 -18.108  -3.224
    9    HE2  LYS  86           HE2      LYS  86 -25.952 -18.630  -6.094
   10    HE3  LYS  86           HE3      LYS  86 -25.450 -19.838  -4.912
   11    HZ3  LYS  86           HZ1      LYS  86 -27.714 -19.952  -4.723
   12    HZ2  LYS  86           HZ2      LYS  86 -27.949 -18.301  -5.053
   13    HZ1  LYS  86           HZ3      LYS  86 -27.379 -18.790  -3.531

  No H/Q in entry =          13
  In of MODEL   20
    1    H    VAL  87           H        VAL  87 -23.123 -12.948  -4.210
    2    HA   VAL  87           HA       VAL  87 -22.771 -11.785  -6.147
    3    HB   VAL  87           HB       VAL  87 -21.793 -14.319  -7.489
    4   HG12  VAL  87          HG11      VAL  87 -20.430 -11.643  -7.469
    5   HG11  VAL  87          HG12      VAL  87 -21.868 -11.872  -8.466
    6   HG13  VAL  87          HG13      VAL  87 -20.442 -12.875  -8.729
    7   HG23  VAL  87          HG21      VAL  87 -20.176 -12.759  -5.485
    8   HG22  VAL  87          HG22      VAL  87 -19.670 -14.179  -6.395
    9   HG21  VAL  87          HG23      VAL  87 -20.920 -14.324  -5.162

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ASP  88           H        ASP  88 -25.311 -12.337  -5.810
    2    HA   ASP  88           HA       ASP  88 -26.461 -13.511  -8.215
    3    HB2  ASP  88           HB2      ASP  88 -27.478 -13.722  -5.897
    4    HB3  ASP  88           HB3      ASP  88 -27.869 -12.006  -5.996

  No H/Q in entry =           4
  In of MODEL   20
    1    H    GLY  89           H        GLY  89 -25.705 -12.278  -9.851
    2    HA3  GLY  89           HA2      GLY  89 -25.787  -9.500 -10.050
    3    HA2  GLY  89           HA3      GLY  89 -25.795 -10.621 -11.412

  No H/Q in entry =           3
  In of MODEL   20
    1    H    LEU  90           H        LEU  90 -28.290 -11.885 -10.977
    2    HA   LEU  90           HA       LEU  90 -30.026  -9.887 -12.098
    3    HB2  LEU  90           HB2      LEU  90 -30.172 -12.278 -12.681
    4    HB3  LEU  90           HB3      LEU  90 -30.699 -12.628 -11.034
    5    HG   LEU  90           HG       LEU  90 -32.776 -11.437 -11.408
    6   HD13  LEU  90          HD11      LEU  90 -32.527  -9.702 -12.880
    7   HD12  LEU  90          HD12      LEU  90 -33.104 -10.919 -14.021
    8   HD11  LEU  90          HD13      LEU  90 -31.378 -10.585 -13.888
    9   HD23  LEU  90          HD21      LEU  90 -32.751 -13.066 -13.844
   10   HD22  LEU  90          HD22      LEU  90 -33.743 -13.197 -12.391
   11   HD21  LEU  90          HD23      LEU  90 -32.112 -13.867 -12.408

  No H/Q in entry =          11
  In of MODEL   20
    1    H    GLY  91           H        GLY  91 -29.926 -11.395  -8.915
    2    HA3  GLY  91           HA2      GLY  91 -32.230 -10.201  -7.885
    3    HA2  GLY  91           HA3      GLY  91 -30.863 -10.784  -6.937

  No H/Q in entry =           3
  In of MODEL   20
    1    H    VAL  92           H        VAL  92 -28.877  -9.025  -7.782
    2    HA   VAL  92           HA       VAL  92 -29.595  -6.698  -6.236
    3    HB   VAL  92           HB       VAL  92 -27.059  -7.255  -7.819
    4   HG12  VAL  92          HG11      VAL  92 -27.168  -5.367  -5.492
    5   HG11  VAL  92          HG12      VAL  92 -27.806  -4.800  -7.036
    6   HG13  VAL  92          HG13      VAL  92 -26.129  -5.327  -6.916
    7   HG22  VAL  92          HG21      VAL  92 -26.899  -8.851  -6.227
    8   HG21  VAL  92          HG22      VAL  92 -28.021  -8.032  -5.139
    9   HG23  VAL  92          HG23      VAL  92 -26.347  -7.489  -5.251

  No H/Q in entry =           9
  In of MODEL   20
    1    H    LEU  93           H        LEU  93 -29.194  -7.372  -9.655
    2    HA   LEU  93           HA       LEU  93 -29.443  -4.726 -10.584
    3    HB2  LEU  93           HB2      LEU  93 -28.859  -6.601 -12.043
    4    HB3  LEU  93           HB3      LEU  93 -30.476  -7.273 -11.829
    5    HG   LEU  93           HG       LEU  93 -31.413  -5.274 -12.956
    6   HD11  LEU  93          HD11      LEU  93 -29.510  -3.744 -12.442
    7   HD13  LEU  93          HD12      LEU  93 -29.943  -3.759 -14.153
    8   HD12  LEU  93          HD13      LEU  93 -28.524  -4.643 -13.595
    9   HD23  LEU  93          HD21      LEU  93 -30.384  -5.876 -15.239
   10   HD22  LEU  93          HD22      LEU  93 -31.274  -7.103 -14.337
   11   HD21  LEU  93          HD23      LEU  93 -29.508  -7.109 -14.331

  No H/Q in entry =          11
  In of MODEL   20
    1    H    LYS  94           H        LYS  94 -31.910  -7.188  -9.747
    2    HA   LYS  94           HA       LYS  94 -34.200  -5.665 -10.382
    3    HB2  LYS  94           HB2      LYS  94 -33.772  -7.868  -8.370
    4    HB3  LYS  94           HB3      LYS  94 -35.342  -7.117  -8.645
    5    HG2  LYS  94           HG2      LYS  94 -35.272  -7.893 -10.978
    6    HG3  LYS  94           HG3      LYS  94 -33.740  -8.698 -10.644
    7    HD2  LYS  94           HD2      LYS  94 -34.915  -9.994  -8.825
    8    HD3  LYS  94           HD3      LYS  94 -36.432  -9.292  -9.387
    9    HE2  LYS  94           HE2      LYS  94 -35.938 -10.238 -11.652
   10    HE3  LYS  94           HE3      LYS  94 -34.555 -11.070 -10.943
   11    HZ3  LYS  94           HZ1      LYS  94 -36.455 -12.526 -11.122
   12    HZ2  LYS  94           HZ2      LYS  94 -37.397 -11.467 -10.184
   13    HZ1  LYS  94           HZ3      LYS  94 -36.068 -12.263  -9.490

  No H/Q in entry =          13
  In of MODEL   20
    1    H    ALA  95           H        ALA  95 -32.396  -5.851  -7.324
    2    HA   ALA  95           HA       ALA  95 -34.195  -4.208  -5.853
    3    HB2  ALA  95           HB1      ALA  95 -31.872  -5.665  -5.306
    4    HB3  ALA  95           HB2      ALA  95 -32.824  -4.728  -4.156
    5    HB1  ALA  95           HB3      ALA  95 -31.446  -3.987  -4.970

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA  96           H        ALA  96 -31.515  -3.446  -7.937
    2    HA   ALA  96           HA       ALA  96 -31.326  -0.690  -7.160
    3    HB2  ALA  96           HB1      ALA  96 -29.948  -0.510  -9.263
    4    HB3  ALA  96           HB2      ALA  96 -30.310  -2.206  -9.586
    5    HB1  ALA  96           HB3      ALA  96 -29.385  -1.759  -8.152

  No H/Q in entry =           5
  In of MODEL   20
    1    H    VAL  97           H        VAL  97 -32.905  -2.348  -9.855
    2    HA   VAL  97           HA       VAL  97 -33.887  -0.010 -11.114
    3    HB   VAL  97           HB       VAL  97 -34.800  -2.904 -11.163
    4   HG11  VAL  97          HG11      VAL  97 -36.517  -0.836 -11.655
    5   HG13  VAL  97          HG12      VAL  97 -36.630  -2.425 -12.412
    6   HG12  VAL  97          HG13      VAL  97 -35.825  -1.102 -13.256
    7   HG21  VAL  97          HG21      VAL  97 -33.447  -1.122 -13.190
    8   HG23  VAL  97          HG22      VAL  97 -33.959  -2.785 -13.483
    9   HG22  VAL  97          HG23      VAL  97 -32.703  -2.444 -12.291

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ALA  98           H        ALA  98 -35.159  -2.147  -8.585
    2    HA   ALA  98           HA       ALA  98 -37.678  -0.907  -8.244
    3    HB1  ALA  98           HB1      ALA  98 -36.750  -3.142  -7.209
    4    HB3  ALA  98           HB2      ALA  98 -37.900  -2.177  -6.282
    5    HB2  ALA  98           HB3      ALA  98 -36.177  -2.091  -5.915

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA  99           H        ALA  99 -34.579  -0.223  -6.582
    2    HA   ALA  99           HA       ALA  99 -35.643   1.799  -4.923
    3    HB1  ALA  99           HB1      ALA  99 -33.026   0.813  -5.659
    4    HB2  ALA  99           HB2      ALA  99 -33.554   1.582  -4.163
    5    HB3  ALA  99           HB3      ALA  99 -33.036   2.572  -5.526

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ILE 100           H        ILE 100 -34.583   1.895  -8.274
    2    HA   ILE 100           HA       ILE 100 -34.654   4.748  -8.489
    3    HB   ILE 100           HB       ILE 100 -34.820   2.602 -10.632
    4   HG12  ILE 100          HG12      ILE 100 -32.587   4.511  -9.948
    5   HG13  ILE 100          HG13      ILE 100 -32.688   2.866  -9.321
    6   HG21  ILE 100          HG21      ILE 100 -35.133   5.536 -10.759
    7   HG23  ILE 100          HG22      ILE 100 -35.681   4.289 -11.880
    8   HG22  ILE 100          HG23      ILE 100 -34.007   4.842 -11.926
    9   HD12  ILE 100          HD11      ILE 100 -32.107   3.807 -12.090
   10   HD11  ILE 100          HD12      ILE 100 -32.829   2.216 -11.842
   11   HD13  ILE 100          HD13      ILE 100 -31.270   2.601 -11.114

  No H/Q in entry =          11
  In of MODEL   20
    1    H    LYS 101           H        LYS 101 -37.041   2.228  -9.230
    2    HA   LYS 101           HA       LYS 101 -39.055   3.957 -10.236
    3    HB2  LYS 101           HB2      LYS 101 -39.048   1.178  -9.113
    4    HB3  LYS 101           HB3      LYS 101 -40.568   1.998  -9.464
    5    HG2  LYS 101           HG2      LYS 101 -40.079   2.118 -11.758
    6    HG3  LYS 101           HG3      LYS 101 -38.401   1.649 -11.498
    7    HD2  LYS 101           HD2      LYS 101 -39.718  -0.209 -12.392
    8    HD3  LYS 101           HD3      LYS 101 -39.110  -0.565 -10.775
    9    HE2  LYS 101           HE2      LYS 101 -41.200  -1.183 -10.279
   10    HE3  LYS 101           HE3      LYS 101 -41.593   0.538 -10.281
   11    HZ3  LYS 101           HZ1      LYS 101 -42.480   0.418 -12.403
   12    HZ2  LYS 101           HZ2      LYS 101 -43.000  -1.038 -11.700
   13    HZ1  LYS 101           HZ3      LYS 101 -41.687  -1.038 -12.778

  No H/Q in entry =          13
  In of MODEL   20
    1    H    LYS 102           H        LYS 102 -38.633   2.456  -7.028
    2    HA   LYS 102           HA       LYS 102 -40.839   3.733  -5.838
    3    HB2  LYS 102           HB2      LYS 102 -39.679   1.819  -4.821
    4    HB3  LYS 102           HB3      LYS 102 -38.251   2.821  -4.568
    5    HG2  LYS 102           HG2      LYS 102 -39.520   4.261  -3.075
    6    HG3  LYS 102           HG3      LYS 102 -40.952   3.264  -3.330
    7    HD2  LYS 102           HD2      LYS 102 -39.802   1.350  -2.301
    8    HD3  LYS 102           HD3      LYS 102 -38.372   2.350  -2.045
    9    HE2  LYS 102           HE2      LYS 102 -39.675   3.875  -0.639
   10    HE3  LYS 102           HE3      LYS 102 -41.123   2.908  -0.917
   11    HZ1  LYS 102           HZ1      LYS 102 -39.474   1.087   0.090
   12    HZ3  LYS 102           HZ2      LYS 102 -40.555   2.012   1.017
   13    HZ2  LYS 102           HZ3      LYS 102 -38.925   2.476   0.899

  No H/Q in entry =          13
  In of MODEL   20
    1    H    ALA 103           H        ALA 103 -37.830   5.014  -6.834
    2    HA   ALA 103           HA       ALA 103 -37.974   7.331  -5.047
    3    HB2  ALA 103           HB1      ALA 103 -35.949   7.994  -6.612
    4    HB3  ALA 103           HB2      ALA 103 -35.976   6.276  -7.014
    5    HB1  ALA 103           HB3      ALA 103 -35.737   6.787  -5.343

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA 104           H        ALA 104 -38.606   6.631  -8.398
    2    HA   ALA 104           HA       ALA 104 -39.082   9.438  -9.017
    3    HB2  ALA 104           HB1      ALA 104 -39.139   8.777 -11.221
    4    HB1  ALA 104           HB2      ALA 104 -39.928   7.243 -10.850
    5    HB3  ALA 104           HB3      ALA 104 -38.198   7.440 -10.562

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA 105           H        ALA 105 -40.778   7.392  -7.225
    2    HA   ALA 105           HA       ALA 105 -43.148   8.875  -7.207
    3    HB2  ALA 105           HB1      ALA 105 -43.915   8.048  -9.251
    4    HB3  ALA 105           HB2      ALA 105 -44.601   6.882  -8.121
    5    HB1  ALA 105           HB3      ALA 105 -43.142   6.481  -9.023

  No H/Q in entry =           5
  In of MODEL   21
    1    H1   ALA   1           H3       ALA   1 -11.996 -16.204  -2.431
    2    H2   ALA   1           H2       ALA   1 -11.031 -17.331  -3.265
    3    H3   ALA   1           H1       ALA   1 -12.190 -16.411  -4.105
    4    HA   ALA   1           HA       ALA   1 -13.557 -18.136  -3.863
    5    HB3  ALA   1           HB1      ALA   1 -12.130 -19.880  -3.391
    6    HB1  ALA   1           HB2      ALA   1 -12.892 -19.776  -1.805
    7    HB2  ALA   1           HB3      ALA   1 -11.330 -19.007  -2.084

  No H/Q in entry =           7
  In of MODEL   21
    1    H    GLU   2           H        GLU   2 -15.169 -19.015  -2.210
    2    HA   GLU   2           HA       GLU   2 -16.851 -17.322  -1.161
    3    HB2  GLU   2           HB2      GLU   2 -15.871 -19.725   0.394
    4    HB3  GLU   2           HB3      GLU   2 -17.411 -18.903   0.641
    5    HG2  GLU   2           HG2      GLU   2 -18.366 -20.013  -1.092
    6    HG3  GLU   2           HG3      GLU   2 -17.048 -19.591  -2.174

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLU   3           H        GLU   3 -14.921 -18.631   1.471
    2    HA   GLU   3           HA       GLU   3 -15.190 -16.277   3.020
    3    HB2  GLU   3           HB2      GLU   3 -13.559 -18.793   3.283
    4    HB3  GLU   3           HB3      GLU   3 -13.355 -17.466   4.427
    5    HG2  GLU   3           HG2      GLU   3 -15.547 -17.655   5.239
    6    HG3  GLU   3           HG3      GLU   3 -16.123 -18.471   3.792

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LEU   4           H        LEU   4 -12.205 -17.705   1.642
    2    HA   LEU   4           HA       LEU   4 -10.408 -15.766   2.239
    3    HB2  LEU   4           HB2      LEU   4 -10.607 -17.077  -0.482
    4    HB3  LEU   4           HB3      LEU   4  -9.170 -16.327   0.204
    5    HG   LEU   4           HG       LEU   4 -10.623 -18.748   1.321
    6   HD13  LEU   4          HD11      LEU   4  -8.963 -20.076   0.400
    7   HD12  LEU   4          HD12      LEU   4  -7.777 -18.771   0.373
    8   HD11  LEU   4          HD13      LEU   4  -9.062 -18.821  -0.833
    9   HD23  LEU   4          HD21      LEU   4  -8.375 -18.765   2.709
   10   HD22  LEU   4          HD22      LEU   4  -9.716 -17.749   3.231
   11   HD21  LEU   4          HD23      LEU   4  -8.364 -17.038   2.350

  No H/Q in entry =          11
  In of MODEL   21
    1    H    GLU   5           H        GLU   5 -12.739 -15.611  -0.442
    2    HA   GLU   5           HA       GLU   5 -11.779 -13.113  -1.448
    3    HB2  GLU   5           HB2      GLU   5 -13.091 -14.728  -2.809
    4    HB3  GLU   5           HB3      GLU   5 -14.501 -14.388  -1.804
    5    HG2  GLU   5           HG2      GLU   5 -14.425 -12.025  -2.457
    6    HG3  GLU   5           HG3      GLU   5 -12.981 -12.325  -3.423

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLU   6           H        GLU   6 -14.493 -14.035   0.639
    2    HA   GLU   6           HA       GLU   6 -15.448 -11.374   1.027
    3    HB2  GLU   6           HB2      GLU   6 -15.823 -13.917   2.622
    4    HB3  GLU   6           HB3      GLU   6 -16.648 -12.403   2.988
    5    HG2  GLU   6           HG2      GLU   6 -17.681 -12.387   0.779
    6    HG3  GLU   6           HG3      GLU   6 -16.792 -13.837   0.322

  No H/Q in entry =           6
  In of MODEL   21
    1    H    VAL   7           H        VAL   7 -13.107 -13.436   2.612
    2    HA   VAL   7           HA       VAL   7 -12.676 -11.845   4.935
    3    HB   VAL   7           HB       VAL   7 -10.931 -13.862   3.497
    4   HG11  VAL   7          HG11      VAL   7 -10.498 -12.312   6.058
    5   HG13  VAL   7          HG12      VAL   7  -9.391 -12.511   4.701
    6   HG12  VAL   7          HG13      VAL   7  -9.722 -13.870   5.774
    7   HG21  VAL   7          HG21      VAL   7 -13.174 -14.464   4.713
    8   HG23  VAL   7          HG22      VAL   7 -12.257 -14.168   6.190
    9   HG22  VAL   7          HG23      VAL   7 -11.737 -15.422   5.066

  No H/Q in entry =           9
  In of MODEL   21
    1    H    VAL   8           H        VAL   8 -11.153 -11.943   1.730
    2    HA   VAL   8           HA       VAL   8  -9.127 -10.031   2.222
    3    HB   VAL   8           HB       VAL   8 -10.569 -10.764  -0.336
    4   HG13  VAL   8          HG11      VAL   8  -9.690  -8.651  -0.836
    5   HG12  VAL   8          HG12      VAL   8  -8.361  -9.717  -1.296
    6   HG11  VAL   8          HG13      VAL   8  -8.311  -8.862   0.246
    7   HG22  VAL   8          HG21      VAL   8  -9.017 -12.449  -0.565
    8   HG21  VAL   8          HG22      VAL   8  -8.825 -12.272   1.176
    9   HG23  VAL   8          HG23      VAL   8  -7.708 -11.460   0.085

  No H/Q in entry =           9
  In of MODEL   21
    1    H    MET   9           H        MET   9 -12.476  -9.706   1.051
    2    HA   MET   9           HA       MET   9 -12.462  -6.930   0.607
    3    HB2  MET   9           HB2      MET   9 -14.616  -8.887   1.371
    4    HB3  MET   9           HB3      MET   9 -14.966  -7.159   1.285
    5    HG2  MET   9           HG2      MET   9 -13.878  -7.239  -1.050
    6    HG3  MET   9           HG3      MET   9 -14.040  -8.991  -0.926
    7    HE1  MET   9           HE1      MET   9 -15.912 -10.298  -0.917
    8    HE3  MET   9           HE2      MET   9 -17.606  -9.844  -1.078
    9    HE2  MET   9           HE3      MET   9 -16.795  -9.653   0.474

  No H/Q in entry =           9
  In of MODEL   21
    1    H    GLY  10           H        GLY  10 -13.098  -8.824   3.539
    2    HA3  GLY  10           HA2      GLY  10 -13.692  -6.644   5.249
    3    HA2  GLY  10           HA3      GLY  10 -13.100  -8.220   5.770

  No H/Q in entry =           3
  In of MODEL   21
    1    H    LEU  11           H        LEU  11 -10.649  -8.303   4.463
    2    HA   LEU  11           HA       LEU  11  -8.981  -6.832   6.220
    3    HB2  LEU  11           HB2      LEU  11  -8.400  -8.254   3.619
    4    HB3  LEU  11           HB3      LEU  11  -7.146  -7.522   4.619
    5    HG   LEU  11           HG       LEU  11  -9.112  -9.589   5.636
    6   HD13  LEU  11          HD11      LEU  11  -7.863 -10.808   4.080
    7   HD12  LEU  11          HD12      LEU  11  -6.928 -11.024   5.558
    8   HD11  LEU  11          HD13      LEU  11  -6.406  -9.853   4.348
    9   HD22  LEU  11          HD21      LEU  11  -8.284  -8.554   7.552
   10   HD21  LEU  11          HD22      LEU  11  -6.752  -8.126   6.792
   11   HD23  LEU  11          HD23      LEU  11  -7.048  -9.786   7.306

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  12           H        ILE  12  -9.882  -6.313   2.825
    2    HA   ILE  12           HA       ILE  12  -8.232  -4.053   2.396
    3    HB   ILE  12           HB       ILE  12 -10.868  -4.779   1.095
    4   HG12  ILE  12          HG12      ILE  12  -8.800  -6.391   1.032
    5   HG13  ILE  12          HG13      ILE  12  -9.664  -6.056  -0.455
    6   HG23  ILE  12          HG21      ILE  12 -10.302  -2.432   0.680
    7   HG22  ILE  12          HG22      ILE  12 -10.012  -3.358  -0.787
    8   HG21  ILE  12          HG23      ILE  12  -8.686  -2.890   0.239
    9   HD11  ILE  12          HD11      ILE  12  -7.184  -4.570   0.449
   10   HD13  ILE  12          HD12      ILE  12  -7.971  -4.470  -1.124
   11   HD12  ILE  12          HD13      ILE  12  -7.157  -5.940  -0.645

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  13           H        ILE  13 -11.591  -4.382   3.480
    2    HA   ILE  13           HA       ILE  13 -12.106  -1.603   3.739
    3    HB   ILE  13           HB       ILE  13 -13.267  -4.040   5.109
    4   HG12  ILE  13          HG12      ILE  13 -13.490  -3.516   2.566
    5   HG13  ILE  13          HG13      ILE  13 -14.909  -4.004   3.468
    6   HG23  ILE  13          HG21      ILE  13 -13.687  -2.222   6.619
    7   HG22  ILE  13          HG22      ILE  13 -15.183  -2.481   5.730
    8   HG21  ILE  13          HG23      ILE  13 -14.127  -1.136   5.304
    9   HD11  ILE  13          HD11      ILE  13 -14.173  -1.106   2.995
   10   HD13  ILE  13          HD12      ILE  13 -15.663  -1.744   3.661
   11   HD12  ILE  13          HD13      ILE  13 -15.287  -2.022   1.975

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ASN  14           H        ASN  14 -10.953  -4.063   6.026
    2    HA   ASN  14           HA       ASN  14 -10.792  -2.414   8.306
    3    HB2  ASN  14           HB2      ASN  14 -10.486  -5.017   7.994
    4    HB3  ASN  14           HB3      ASN  14  -8.785  -4.596   7.841
    5   HD21  ASN  14          HD21      ASN  14  -9.398  -6.125  10.020
    6   HD22  ASN  14          HD22      ASN  14  -9.393  -5.200  11.441

  No H/Q in entry =           6
  In of MODEL   21
    1    H    SER  15           H        SER  15  -8.366  -3.198   5.825
    2    HA   SER  15           HA       SER  15  -6.257  -1.658   6.898
    3    HB2  SER  15           HB2      SER  15  -5.224  -1.862   4.745
    4    HB3  SER  15           HB3      SER  15  -6.153  -3.340   4.970
    5    HG   SER  15           HG       SER  15  -6.372  -1.549   3.040

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLY  16           H        GLY  16  -8.868  -0.852   4.640
    2    HA3  GLY  16           HA2      GLY  16  -8.062   1.804   4.081
    3    HA2  GLY  16           HA3      GLY  16  -9.700   1.174   3.917

  No H/Q in entry =           3
  In of MODEL   21
    1    H    GLN  17           H        GLN  17 -10.236   0.447   6.567
    2    HA   GLN  17           HA       GLN  17 -10.999   2.941   7.696
    3    HB2  GLN  17           HB2      GLN  17 -10.844   0.166   8.889
    4    HB3  GLN  17           HB3      GLN  17 -11.505   1.556   9.750
    5    HG2  GLN  17           HG2      GLN  17 -13.181   1.883   7.995
    6    HG3  GLN  17           HG3      GLN  17 -12.494   0.552   7.066
    7   HE21  GLN  17          HE21      GLN  17 -15.023  -0.008   7.514
    8   HE22  GLN  17          HE22      GLN  17 -15.270  -1.024   8.852

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ALA  18           H        ALA  18  -8.325   0.718   8.332
    2    HA   ALA  18           HA       ALA  18  -7.261   1.964  10.602
    3    HB2  ALA  18           HB1      ALA  18  -6.600  -0.243   9.245
    4    HB3  ALA  18           HB2      ALA  18  -5.457   0.568  10.316
    5    HB1  ALA  18           HB3      ALA  18  -5.380   0.842   8.575

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ARG  19           H        ARG  19  -6.489   2.492   7.154
    2    HA   ARG  19           HA       ARG  19  -4.637   4.581   7.581
    3    HB2  ARG  19           HB2      ARG  19  -4.932   3.426   5.389
    4    HB3  ARG  19           HB3      ARG  19  -6.492   4.232   5.204
    5    HG2  ARG  19           HG2      ARG  19  -5.411   6.428   5.268
    6    HG3  ARG  19           HG3      ARG  19  -3.846   5.677   5.580
    7    HD2  ARG  19           HD2      ARG  19  -3.976   6.256   3.234
    8    HD3  ARG  19           HD3      ARG  19  -4.023   4.495   3.386
    9    HE   ARG  19           HE       ARG  19  -6.676   5.347   3.367
   10   HH21  ARG  19          HH11      ARG  19  -7.868   5.470   1.444
   11   HH22  ARG  19          HH12      ARG  19  -7.043   5.560  -0.073
   12   HH11  ARG  19          HH21      ARG  19  -3.896   5.463   1.342
   13   HH12  ARG  19          HH22      ARG  19  -4.793   5.554  -0.131

  No H/Q in entry =          13
  In of MODEL   21
    1    H    SER  20           H        SER  20  -8.135   4.618   6.969
    2    HA   SER  20           HA       SER  20  -8.552   7.365   6.909
    3    HB2  SER  20           HB2      SER  20 -10.234   5.439   6.547
    4    HB3  SER  20           HB3      SER  20 -10.460   5.494   8.293
    5    HG   SER  20           HG       SER  20 -11.074   7.645   8.102

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU  21           H        LEU  21  -8.514   5.193   9.722
    2    HA   LEU  21           HA       LEU  21  -9.005   7.186  11.678
    3    HB2  LEU  21           HB2      LEU  21  -7.595   4.515  11.852
    4    HB3  LEU  21           HB3      LEU  21  -7.929   5.530  13.251
    5    HG   LEU  21           HG       LEU  21 -10.072   4.574  11.329
    6   HD11  LEU  21          HD11      LEU  21  -8.948   2.682  12.502
    7   HD13  LEU  21          HD12      LEU  21 -10.627   2.882  13.001
    8   HD12  LEU  21          HD13      LEU  21  -9.323   3.449  14.045
    9   HD21  LEU  21          HD21      LEU  21 -10.043   6.117  13.914
   10   HD23  LEU  21          HD22      LEU  21 -11.424   5.079  13.572
   11   HD22  LEU  21          HD23      LEU  21 -11.024   6.394  12.477

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ALA  22           H        ALA  22  -6.018   5.874  10.286
    2    HA   ALA  22           HA       ALA  22  -4.174   7.235  11.909
    3    HB2  ALA  22           HB1      ALA  22  -3.710   5.385  10.226
    4    HB1  ALA  22           HB2      ALA  22  -2.544   6.707  10.260
    5    HB3  ALA  22           HB3      ALA  22  -3.756   6.632   8.981

  No H/Q in entry =           5
  In of MODEL   21
    1    H    TYR  23           H        TYR  23  -5.502   8.210   8.718
    2    HA   TYR  23           HA       TYR  23  -4.222  10.736   8.643
    3    HB2  TYR  23           HB2      TYR  23  -5.276   9.790   6.651
    4    HB3  TYR  23           HB3      TYR  23  -6.860   9.868   7.426
    5    HD1  TYR  23           HD1      TYR  23  -3.995  11.966   6.276
    6    HD2  TYR  23           HD2      TYR  23  -8.140  11.853   7.394
    7    HE1  TYR  23           HE1      TYR  23  -4.266  14.307   5.504
    8    HE2  TYR  23           HE2      TYR  23  -8.412  14.193   6.621
    9    HH   TYR  23           HH       TYR  23  -5.668  15.999   5.229

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ALA  24           H        ALA  24  -7.324   9.693  10.015
    2    HA   ALA  24           HA       ALA  24  -8.222  12.266  10.773
    3    HB1  ALA  24           HB1      ALA  24 -10.013  10.976  11.239
    4    HB2  ALA  24           HB2      ALA  24  -9.180  10.429  12.692
    5    HB3  ALA  24           HB3      ALA  24  -9.029   9.514  11.192

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA  25           H        ALA  25  -6.170   9.860  12.364
    2    HA   ALA  25           HA       ALA  25  -5.870  11.129  14.862
    3    HB2  ALA  25           HB1      ALA  25  -5.047   8.792  14.053
    4    HB3  ALA  25           HB2      ALA  25  -4.056   9.677  15.214
    5    HB1  ALA  25           HB3      ALA  25  -3.613   9.664  13.506

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU  26           H        LEU  26  -4.076  11.457  11.827
    2    HA   LEU  26           HA       LEU  26  -2.162  13.324  12.743
    3    HB2  LEU  26           HB2      LEU  26  -1.827  12.171  10.645
    4    HB3  LEU  26           HB3      LEU  26  -3.313  12.844   9.982
    5    HG   LEU  26           HG       LEU  26  -2.350  15.117  10.113
    6   HD12  LEU  26          HD11      LEU  26   0.186  15.195  10.536
    7   HD11  LEU  26          HD12      LEU  26  -0.005  13.613  11.285
    8   HD13  LEU  26          HD13      LEU  26  -0.846  15.012  11.953
    9   HD21  LEU  26          HD21      LEU  26  -0.556  13.097   8.732
   10   HD23  LEU  26          HD22      LEU  26  -0.636  14.815   8.355
   11   HD22  LEU  26          HD23      LEU  26  -2.036  13.785   8.065

  No H/Q in entry =          11
  In of MODEL   21
    1    H    LYS  27           H        LYS  27  -5.348  13.730  11.253
    2    HA   LYS  27           HA       LYS  27  -5.355  16.518  11.044
    3    HB2  LYS  27           HB2      LYS  27  -7.062  14.999  10.058
    4    HB3  LYS  27           HB3      LYS  27  -7.719  14.734  11.672
    5    HG2  LYS  27           HG2      LYS  27  -8.202  17.130  11.898
    6    HG3  LYS  27           HG3      LYS  27  -7.495  17.437  10.308
    7    HD2  LYS  27           HD2      LYS  27  -9.191  15.961   9.271
    8    HD3  LYS  27           HD3      LYS  27  -9.905  15.671  10.860
    9    HE2  LYS  27           HE2      LYS  27 -10.402  18.073  11.092
   10    HE3  LYS  27           HE3      LYS  27  -9.661  18.385   9.518
   11    HZ3  LYS  27           HZ1      LYS  27 -12.034  18.206   9.269
   12    HZ2  LYS  27           HZ2      LYS  27 -12.051  16.692  10.044
   13    HZ1  LYS  27           HZ3      LYS  27 -11.305  16.866   8.525

  No H/Q in entry =          13
  In of MODEL   21
    1    H    GLN  28           H        GLN  28  -6.207  14.423  13.776
    2    HA   GLN  28           HA       GLN  28  -7.153  16.413  15.541
    3    HB2  GLN  28           HB2      GLN  28  -5.695  13.816  16.099
    4    HB3  GLN  28           HB3      GLN  28  -6.463  14.808  17.339
    5    HG2  GLN  28           HG2      GLN  28  -7.886  13.638  14.932
    6    HG3  GLN  28           HG3      GLN  28  -7.943  12.966  16.561
    7   HE21  GLN  28          HE21      GLN  28  -9.800  14.754  14.539
    8   HE22  GLN  28          HE22      GLN  28 -10.593  15.751  15.661

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ALA  29           H        ALA  29  -3.904  15.184  14.868
    2    HA   ALA  29           HA       ALA  29  -2.503  16.619  16.846
    3    HB1  ALA  29           HB1      ALA  29  -0.554  15.965  15.736
    4    HB3  ALA  29           HB2      ALA  29  -1.306  16.067  14.144
    5    HB2  ALA  29           HB3      ALA  29  -1.703  14.730  15.222

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LYS  30           H        LYS  30  -3.367  17.468  13.510
    2    HA   LYS  30           HA       LYS  30  -2.006  19.936  13.405
    3    HB2  LYS  30           HB2      LYS  30  -4.514  19.007  11.991
    4    HB3  LYS  30           HB3      LYS  30  -3.709  20.536  11.645
    5    HG2  LYS  30           HG2      LYS  30  -1.612  19.282  11.143
    6    HG3  LYS  30           HG3      LYS  30  -2.490  17.770  11.390
    7    HD2  LYS  30           HD2      LYS  30  -4.060  18.373   9.588
    8    HD3  LYS  30           HD3      LYS  30  -3.206  19.897   9.342
    9    HE2  LYS  30           HE2      LYS  30  -1.147  18.642   8.775
   10    HE3  LYS  30           HE3      LYS  30  -2.021  17.122   8.989
   11    HZ2  LYS  30           HZ1      LYS  30  -1.853  17.988   6.645
   12    HZ1  LYS  30           HZ2      LYS  30  -2.922  19.232   7.105
   13    HZ3  LYS  30           HZ3      LYS  30  -3.416  17.606   7.180

  No H/Q in entry =          13
  In of MODEL   21
    1    H    GLN  31           H        GLN  31  -5.094  19.030  14.811
    2    HA   GLN  31           HA       GLN  31  -5.910  21.774  15.250
    3    HB2  GLN  31           HB2      GLN  31  -7.048  19.311  16.578
    4    HB3  GLN  31           HB3      GLN  31  -7.836  20.867  16.324
    5    HG2  GLN  31           HG2      GLN  31  -7.103  20.094  13.739
    6    HG3  GLN  31           HG3      GLN  31  -7.603  18.583  14.490
    7   HE21  GLN  31          HE21      GLN  31  -9.035  20.124  12.378
    8   HE22  GLN  31          HE22      GLN  31 -10.557  20.490  13.030

  No H/Q in entry =           8
  In of MODEL   21
    1    H    GLY  32           H        GLY  32  -3.567  19.894  16.584
    2    HA3  GLY  32           HA2      GLY  32  -2.181  20.387  18.389
    3    HA2  GLY  32           HA3      GLY  32  -3.334  21.611  18.905

  No H/Q in entry =           3
  In of MODEL   21
    1    H    ASP  33           H        ASP  33  -4.700  18.544  18.249
    2    HA   ASP  33           HA       ASP  33  -5.111  18.089  21.129
    3    HB2  ASP  33           HB2      ASP  33  -6.491  17.044  18.651
    4    HB3  ASP  33           HB3      ASP  33  -6.831  16.433  20.268

  No H/Q in entry =           4
  In of MODEL   21
    1    H    PHE  34           H        PHE  34  -2.929  17.278  21.444
    2    HA   PHE  34           HA       PHE  34  -1.884  15.043  20.054
    3    HB2  PHE  34           HB2      PHE  34  -1.294  16.047  22.847
    4    HB3  PHE  34           HB3      PHE  34  -0.341  14.838  21.987
    5    HD1  PHE  34           HD1      PHE  34  -0.576  18.262  22.710
    6    HD2  PHE  34           HD2      PHE  34   0.312  15.564  19.487
    7    HE1  PHE  34           HE1      PHE  34   0.691  20.053  21.554
    8    HE2  PHE  34           HE2      PHE  34   1.574  17.357  18.336
    9    HZ   PHE  34           HZ       PHE  34   1.766  19.599  19.374

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ALA  35           H        ALA  35  -3.938  15.293  22.910
    2    HA   ALA  35           HA       ALA  35  -3.681  12.638  23.816
    3    HB3  ALA  35           HB1      ALA  35  -6.152  13.223  24.664
    4    HB1  ALA  35           HB2      ALA  35  -5.646  14.849  24.204
    5    HB2  ALA  35           HB3      ALA  35  -4.720  13.945  25.401

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA  36           H        ALA  36  -6.151  14.104  21.704
    2    HA   ALA  36           HA       ALA  36  -7.522  11.666  21.230
    3    HB1  ALA  36           HB1      ALA  36  -9.000  13.060  20.264
    4    HB3  ALA  36           HB2      ALA  36  -7.831  13.497  19.018
    5    HB2  ALA  36           HB3      ALA  36  -7.876  14.389  20.539

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA  37           H        ALA  37  -4.865  13.296  19.564
    2    HA   ALA  37           HA       ALA  37  -4.794  11.654  17.272
    3    HB3  ALA  37           HB1      ALA  37  -2.837  13.405  18.695
    4    HB2  ALA  37           HB2      ALA  37  -3.363  13.446  17.014
    5    HB1  ALA  37           HB3      ALA  37  -2.189  12.238  17.542

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LYS  38           H        LYS  38  -3.042  11.388  20.356
    2    HA   LYS  38           HA       LYS  38  -1.672   9.011  19.879
    3    HB2  LYS  38           HB2      LYS  38  -2.033  10.774  22.018
    4    HB3  LYS  38           HB3      LYS  38  -2.627   9.236  22.637
    5    HG2  LYS  38           HG2      LYS  38  -0.511   8.151  22.111
    6    HG3  LYS  38           HG3      LYS  38   0.074   9.604  21.294
    7    HD2  LYS  38           HD2      LYS  38   0.215  10.832  23.326
    8    HD3  LYS  38           HD3      LYS  38  -0.786   9.666  24.193
    9    HE2  LYS  38           HE2      LYS  38   1.573   9.394  24.821
   10    HE3  LYS  38           HE3      LYS  38   0.996   7.965  23.959
   11    HZ3  LYS  38           HZ1      LYS  38   2.295   8.401  22.181
   12    HZ2  LYS  38           HZ2      LYS  38   3.231   9.250  23.318
   13    HZ1  LYS  38           HZ3      LYS  38   2.140  10.087  22.320

  No H/Q in entry =          13
  In of MODEL   21
    1    H    ALA  39           H        ALA  39  -4.923   9.453  21.270
    2    HA   ALA  39           HA       ALA  39  -5.437   6.725  21.781
    3    HB3  ALA  39           HB1      ALA  39  -7.627   8.629  21.002
    4    HB2  ALA  39           HB2      ALA  39  -6.738   8.876  22.505
    5    HB1  ALA  39           HB3      ALA  39  -7.628   7.375  22.243

  No H/Q in entry =           5
  In of MODEL   21
    1    H    MET  40           H        MET  40  -6.049   8.719  18.927
    2    HA   MET  40           HA       MET  40  -7.486   6.756  17.468
    3    HB2  MET  40           HB2      MET  40  -5.916   9.177  16.561
    4    HB3  MET  40           HB3      MET  40  -6.921   8.197  15.490
    5    HG2  MET  40           HG2      MET  40  -7.986   9.435  18.041
    6    HG3  MET  40           HG3      MET  40  -8.054  10.264  16.488
    7    HE3  MET  40           HE1      MET  40 -10.601   8.592  14.421
    8    HE2  MET  40           HE2      MET  40  -8.851   8.740  14.278
    9    HE1  MET  40           HE3      MET  40  -9.795  10.091  14.905

  No H/Q in entry =           9
  In of MODEL   21
    1    H    MET  41           H        MET  41  -4.009   7.557  17.599
    2    HA   MET  41           HA       MET  41  -3.212   5.810  15.506
    3    HB2  MET  41           HB2      MET  41  -1.616   6.514  17.982
    4    HB3  MET  41           HB3      MET  41  -0.982   5.872  16.470
    5    HG2  MET  41           HG2      MET  41  -2.175   8.030  15.456
    6    HG3  MET  41           HG3      MET  41  -1.955   8.627  17.100
    7    HE2  MET  41           HE1      MET  41   1.000   6.584  17.476
    8    HE1  MET  41           HE2      MET  41   0.185   7.866  18.368
    9    HE3  MET  41           HE3      MET  41   1.806   8.137  17.730

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ASP  42           H        ASP  42  -3.599   5.340  18.993
    2    HA   ASP  42           HA       ASP  42  -2.517   2.767  19.164
    3    HB2  ASP  42           HB2      ASP  42  -3.428   4.515  20.978
    4    HB3  ASP  42           HB3      ASP  42  -4.836   3.464  20.905

  No H/Q in entry =           4
  In of MODEL   21
    1    H    GLN  43           H        GLN  43  -5.868   3.807  18.650
    2    HA   GLN  43           HA       GLN  43  -6.963   1.198  18.459
    3    HB2  GLN  43           HB2      GLN  43  -7.931   3.830  17.319
    4    HB3  GLN  43           HB3      GLN  43  -8.867   2.333  17.299
    5    HG2  GLN  43           HG2      GLN  43  -8.579   2.225  19.807
    6    HG3  GLN  43           HG3      GLN  43  -7.884   3.843  19.733
    7   HE21  GLN  43          HE21      GLN  43 -10.070   3.887  21.227
    8   HE22  GLN  43          HE22      GLN  43 -11.438   4.434  20.389

  No H/Q in entry =           8
  In of MODEL   21
    1    H    SER  44           H        SER  44  -5.656   3.430  16.045
    2    HA   SER  44           HA       SER  44  -6.322   1.926  13.758
    3    HB2  SER  44           HB2      SER  44  -5.112   4.334  14.199
    4    HB3  SER  44           HB3      SER  44  -3.738   3.361  13.676
    5    HG   SER  44           HG       SER  44  -4.862   4.307  11.906

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ARG  45           H        ARG  45  -3.450   1.873  15.848
    2    HA   ARG  45           HA       ARG  45  -1.929  -0.058  14.477
    3    HB2  ARG  45           HB2      ARG  45  -1.120   1.384  16.344
    4    HB3  ARG  45           HB3      ARG  45  -2.098   0.439  17.464
    5    HG2  ARG  45           HG2      ARG  45  -0.826  -1.599  16.831
    6    HG3  ARG  45           HG3      ARG  45   0.175  -0.628  15.754
    7    HD2  ARG  45           HD2      ARG  45   0.877   0.772  17.707
    8    HD3  ARG  45           HD3      ARG  45  -0.028  -0.317  18.781
    9    HE   ARG  45           HE       ARG  45   1.705  -1.886  17.211
   10   HH21  ARG  45          HH11      ARG  45   3.618  -2.671  18.057
   11   HH22  ARG  45          HH12      ARG  45   4.372  -1.866  19.388
   12   HH11  ARG  45          HH21      ARG  45   1.955   0.593  19.595
   13   HH12  ARG  45          HH22      ARG  45   3.429  -0.016  20.257

  No H/Q in entry =          13
  In of MODEL   21
    1    H    MET  46           H        MET  46  -4.329  -0.415  17.070
    2    HA   MET  46           HA       MET  46  -4.111  -3.210  17.385
    3    HB2  MET  46           HB2      MET  46  -6.316  -1.240  17.974
    4    HB3  MET  46           HB3      MET  46  -6.498  -2.963  18.314
    5    HG2  MET  46           HG2      MET  46  -4.506  -2.923  19.735
    6    HG3  MET  46           HG3      MET  46  -4.237  -1.231  19.354
    7    HE2  MET  46           HE1      MET  46  -7.172  -3.292  22.037
    8    HE1  MET  46           HE2      MET  46  -6.421  -3.869  20.554
    9    HE3  MET  46           HE3      MET  46  -7.950  -3.000  20.476

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ALA  47           H        ALA  47  -6.160  -1.236  15.278
    2    HA   ALA  47           HA       ALA  47  -7.737  -3.319  14.213
    3    HB3  ALA  47           HB1      ALA  47  -8.456  -1.095  13.788
    4    HB1  ALA  47           HB2      ALA  47  -7.950  -1.724  12.220
    5    HB2  ALA  47           HB3      ALA  47  -6.892  -0.634  13.117

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU  48           H        LEU  48  -4.638  -1.958  13.169
    2    HA   LEU  48           HA       LEU  48  -4.321  -3.549  10.833
    3    HB2  LEU  48           HB2      LEU  48  -2.293  -2.230  12.645
    4    HB3  LEU  48           HB3      LEU  48  -1.906  -2.948  11.081
    5    HG   LEU  48           HG       LEU  48  -3.969  -0.765  11.457
    6   HD13  LEU  48          HD11      LEU  48  -1.865   0.149  12.128
    7   HD12  LEU  48          HD12      LEU  48  -2.144   0.694  10.474
    8   HD11  LEU  48          HD13      LEU  48  -1.024  -0.633  10.790
    9   HD22  LEU  48          HD21      LEU  48  -4.416  -1.764   9.383
   10   HD21  LEU  48          HD22      LEU  48  -2.725  -2.170   9.095
   11   HD23  LEU  48          HD23      LEU  48  -3.272  -0.501   8.929

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ASN  49           H        ASN  49  -3.281  -3.919  14.184
    2    HA   ASN  49           HA       ASN  49  -1.639  -6.155  13.865
    3    HB2  ASN  49           HB2      ASN  49  -1.688  -4.822  15.910
    4    HB3  ASN  49           HB3      ASN  49  -3.344  -5.317  16.227
    5   HD21  ASN  49          HD21      ASN  49  -1.646  -5.873  18.250
    6   HD22  ASN  49          HD22      ASN  49  -1.231  -7.518  18.289

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLU  50           H        GLU  50  -5.114  -5.937  14.524
    2    HA   GLU  50           HA       GLU  50  -5.580  -8.744  14.638
    3    HB2  GLU  50           HB2      GLU  50  -7.197  -7.081  15.504
    4    HB3  GLU  50           HB3      GLU  50  -7.493  -6.526  13.855
    5    HG2  GLU  50           HG2      GLU  50  -8.320  -8.738  13.220
    6    HG3  GLU  50           HG3      GLU  50  -7.934  -9.371  14.816

  No H/Q in entry =           6
  In of MODEL   21
    1    H    ALA  51           H        ALA  51  -5.678  -6.354  12.036
    2    HA   ALA  51           HA       ALA  51  -6.627  -8.103  10.015
    3    HB2  ALA  51           HB1      ALA  51  -6.432  -6.291   8.641
    4    HB1  ALA  51           HB2      ALA  51  -4.800  -5.914   9.195
    5    HB3  ALA  51           HB3      ALA  51  -6.196  -5.422  10.157

  No H/Q in entry =           5
  In of MODEL   21
    1    H    HIS  52           H        HIS  52  -3.355  -7.141  11.008
    2    HA   HIS  52           HA       HIS  52  -1.926  -8.613   9.068
    3    HB2  HIS  52           HB2      HIS  52  -0.908  -6.865  10.486
    4    HB3  HIS  52           HB3      HIS  52  -1.096  -7.909  11.894
    5    HD1  HIS  52           HD1      HIS  52   0.241 -10.248  11.788
    6    HD2  HIS  52           HD2      HIS  52   1.374  -7.387   8.975
    7    HE1  HIS  52           HE1      HIS  52   2.495 -10.978  10.889
    8    HE2  HIS  52           HE2      HIS  52   3.197  -9.244   9.172

  No H/Q in entry =           8
  In of MODEL   21
    1    H    LEU  53           H        LEU  53  -3.136  -9.500  12.278
    2    HA   LEU  53           HA       LEU  53  -1.900 -12.025  12.483
    3    HB2  LEU  53           HB2      LEU  53  -4.403 -10.874  13.686
    4    HB3  LEU  53           HB3      LEU  53  -3.929 -12.546  13.980
    5    HG   LEU  53           HG       LEU  53  -2.046 -10.216  14.460
    6   HD12  LEU  53          HD11      LEU  53  -2.666 -10.681  16.917
    7   HD11  LEU  53          HD12      LEU  53  -4.091 -11.494  16.274
    8   HD13  LEU  53          HD13      LEU  53  -3.836  -9.782  15.955
    9   HD23  LEU  53          HD21      LEU  53  -1.172 -12.013  16.159
   10   HD22  LEU  53          HD22      LEU  53  -0.761 -12.187  14.456
   11   HD21  LEU  53          HD23      LEU  53  -2.045 -13.160  15.150

  No H/Q in entry =          11
  In of MODEL   21
    1    H    VAL  54           H        VAL  54  -5.021 -11.047  11.106
    2    HA   VAL  54           HA       VAL  54  -5.893 -13.656  10.422
    3    HB   VAL  54           HB       VAL  54  -6.577 -10.936   9.278
    4   HG12  VAL  54          HG11      VAL  54  -8.654 -12.348   8.462
    5   HG11  VAL  54          HG12      VAL  54  -7.523 -13.697   8.542
    6   HG13  VAL  54          HG13      VAL  54  -7.180 -12.319   7.498
    7   HG22  VAL  54          HG21      VAL  54  -7.491 -10.982  11.427
    8   HG21  VAL  54          HG22      VAL  54  -7.719 -12.729  11.411
    9   HG23  VAL  54          HG23      VAL  54  -8.812 -11.691  10.498

  No H/Q in entry =           9
  In of MODEL   21
    1    H    GLN  55           H        GLN  55  -4.051 -11.182   8.634
    2    HA   GLN  55           HA       GLN  55  -3.890 -12.650   6.221
    3    HB2  GLN  55           HB2      GLN  55  -3.319 -10.378   6.027
    4    HB3  GLN  55           HB3      GLN  55  -2.213 -10.435   7.397
    5    HG2  GLN  55           HG2      GLN  55  -0.478 -11.258   6.129
    6    HG3  GLN  55           HG3      GLN  55  -1.534 -12.252   5.134
    7   HE21  GLN  55          HE21      GLN  55  -1.552 -11.567   3.010
    8   HE22  GLN  55          HE22      GLN  55  -1.376  -9.962   2.497

  No H/Q in entry =           8
  In of MODEL   21
    1    H    THR  56           H        THR  56  -1.796 -12.591   9.110
    2    HA   THR  56           HA       THR  56   0.309 -14.162   8.204
    3    HB   THR  56           HB       THR  56  -0.937 -14.432  10.948
    4    HG1  THR  56           HG1      THR  56   0.752 -12.449   9.845
    5   HG22  THR  56          HG21      THR  56   1.989 -14.454  10.256
    6   HG21  THR  56          HG22      THR  56   1.020 -15.916  10.068
    7   HG23  THR  56          HG23      THR  56   1.176 -15.157  11.653

  No H/Q in entry =           7
  In of MODEL   21
    1    H    LYS  57           H        LYS  57  -2.801 -15.240   9.558
    2    HA   LYS  57           HA       LYS  57  -2.314 -18.030   9.322
    3    HB2  LYS  57           HB2      LYS  57  -4.153 -16.968  10.659
    4    HB3  LYS  57           HB3      LYS  57  -4.944 -16.522   9.154
    5    HG2  LYS  57           HG2      LYS  57  -5.179 -18.874   8.538
    6    HG3  LYS  57           HG3      LYS  57  -4.307 -19.366   9.987
    7    HD2  LYS  57           HD2      LYS  57  -6.084 -18.359  11.391
    8    HD3  LYS  57           HD3      LYS  57  -6.969 -17.906   9.935
    9    HE2  LYS  57           HE2      LYS  57  -7.142 -20.289   9.294
   10    HE3  LYS  57           HE3      LYS  57  -6.253 -20.757  10.741
   11    HZ1  LYS  57           HZ1      LYS  57  -8.316 -19.099  11.564
   12    HZ3  LYS  57           HZ2      LYS  57  -8.162 -20.771  11.819
   13    HZ2  LYS  57           HZ3      LYS  57  -8.997 -20.191  10.457

  No H/Q in entry =          13
  In of MODEL   21
    1    H    LEU  58           H        LEU  58  -3.672 -15.612   7.134
    2    HA   LEU  58           HA       LEU  58  -4.440 -17.454   5.130
    3    HB2  LEU  58           HB2      LEU  58  -3.875 -14.497   4.989
    4    HB3  LEU  58           HB3      LEU  58  -4.520 -15.447   3.649
    5    HG   LEU  58           HG       LEU  58  -5.813 -15.278   6.391
    6   HD11  LEU  58          HD11      LEU  58  -6.127 -13.642   3.894
    7   HD13  LEU  58          HD12      LEU  58  -6.130 -13.130   5.581
    8   HD12  LEU  58          HD13      LEU  58  -7.539 -13.945   4.906
    9   HD22  LEU  58          HD21      LEU  58  -6.745 -17.203   5.523
   10   HD21  LEU  58          HD22      LEU  58  -6.405 -16.751   3.852
   11   HD23  LEU  58          HD23      LEU  58  -7.782 -16.042   4.696

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  59           H        ILE  59  -1.326 -16.196   6.000
    2    HA   ILE  59           HA       ILE  59  -0.207 -16.915   3.370
    3    HB   ILE  59           HB       ILE  59   0.526 -14.834   4.930
    4   HG12  ILE  59          HG12      ILE  59   2.647 -16.469   3.523
    5   HG13  ILE  59          HG13      ILE  59   1.449 -15.544   2.655
    6   HG21  ILE  59          HG21      ILE  59   1.285 -16.603   6.700
    7   HG23  ILE  59          HG22      ILE  59   2.355 -15.263   6.352
    8   HG22  ILE  59          HG23      ILE  59   2.654 -16.849   5.641
    9   HD12  ILE  59          HD11      ILE  59   3.631 -14.331   3.057
   10   HD11  ILE  59          HD12      ILE  59   3.225 -14.336   4.771
   11   HD13  ILE  59          HD13      ILE  59   2.198 -13.476   3.623

  No H/Q in entry =          11
  In of MODEL   21
    1    H    GLU  60           H        GLU  60  -0.216 -18.012   6.740
    2    HA   GLU  60           HA       GLU  60   1.843 -19.962   6.490
    3    HB2  GLU  60           HB2      GLU  60   1.032 -19.163   8.670
    4    HB3  GLU  60           HB3      GLU  60  -0.539 -19.899   8.362
    5    HG2  GLU  60           HG2      GLU  60   0.523 -22.127   8.249
    6    HG3  GLU  60           HG3      GLU  60   2.097 -21.393   8.546

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLY  61           H        GLY  61  -1.664 -20.111   5.989
    2    HA3  GLY  61           HA2      GLY  61  -1.372 -22.902   5.040
    3    HA2  GLY  61           HA3      GLY  61  -2.870 -22.186   5.625

  No H/Q in entry =           3
  In of MODEL   21
    1    H    ASP  62           H        ASP  62  -0.653 -20.582   3.427
    2    HA   ASP  62           HA       ASP  62  -2.665 -19.883   1.586
    3    HB2  ASP  62           HB2      ASP  62  -0.767 -19.165   0.165
    4    HB3  ASP  62           HB3      ASP  62  -0.604 -18.606   1.826

  No H/Q in entry =           4
  In of MODEL   21
    1    H    ALA  63           H        ALA  63  -0.817 -22.819   1.867
    2    HA   ALA  63           HA       ALA  63  -1.106 -23.645  -0.895
    3    HB2  ALA  63           HB1      ALA  63   0.679 -24.443   0.731
    4    HB3  ALA  63           HB2      ALA  63  -0.123 -25.679  -0.238
    5    HB1  ALA  63           HB3      ALA  63  -0.577 -25.454   1.452

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLY  64           H        GLY  64  -2.272 -25.775  -1.322
    2    HA3  GLY  64           HA2      GLY  64  -4.153 -27.197  -0.362
    3    HA2  GLY  64           HA3      GLY  64  -4.947 -25.659  -0.073

  No H/Q in entry =           3
  In of MODEL   21
    1    H    GLU  65           H        GLU  65  -4.799 -24.239  -2.294
    2    HA   GLU  65           HA       GLU  65  -6.549 -25.568  -4.069
    3    HB2  GLU  65           HB2      GLU  65  -5.012 -22.988  -4.353
    4    HB3  GLU  65           HB3      GLU  65  -6.207 -23.550  -5.522
    5    HG2  GLU  65           HG2      GLU  65  -7.937 -23.582  -3.802
    6    HG3  GLU  65           HG3      GLU  65  -6.757 -23.137  -2.571

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLY  66           H        GLY  66  -3.130 -25.044  -4.116
    2    HA3  GLY  66           HA2      GLY  66  -2.703 -27.072  -6.110
    3    HA2  GLY  66           HA3      GLY  66  -2.291 -25.459  -6.660

  No H/Q in entry =           3
  In of MODEL   21
    1    H    LYS  67           H        LYS  67  -0.364 -27.273  -6.711
    2    HA   LYS  67           HA       LYS  67   1.160 -27.771  -4.457
    3    HB2  LYS  67           HB2      LYS  67   2.061 -27.409  -7.314
    4    HB3  LYS  67           HB3      LYS  67   3.016 -28.166  -6.033
    5    HG2  LYS  67           HG2      LYS  67   0.209 -29.110  -6.544
    6    HG3  LYS  67           HG3      LYS  67   1.515 -29.672  -7.587
    7    HD2  LYS  67           HD2      LYS  67   2.752 -30.446  -5.568
    8    HD3  LYS  67           HD3      LYS  67   1.375 -29.966  -4.573
    9    HE2  LYS  67           HE2      LYS  67   1.205 -32.351  -5.071
   10    HE3  LYS  67           HE3      LYS  67  -0.081 -31.486  -5.910
   11    HZ2  LYS  67           HZ1      LYS  67   1.493 -33.215  -7.122
   12    HZ1  LYS  67           HZ2      LYS  67   2.437 -31.820  -7.338
   13    HZ3  LYS  67           HZ3      LYS  67   0.841 -31.868  -7.919

  No H/Q in entry =          13
  In of MODEL   21
    1    H    MET  68           H        MET  68   2.976 -25.987  -6.705
    2    HA   MET  68           HA       MET  68   4.302 -24.406  -4.790
    3    HB2  MET  68           HB2      MET  68   4.205 -24.446  -7.785
    4    HB3  MET  68           HB3      MET  68   5.109 -23.195  -6.932
    5    HG2  MET  68           HG2      MET  68   5.466 -26.159  -6.425
    6    HG3  MET  68           HG3      MET  68   6.479 -25.228  -7.530
    7    HE1  MET  68           HE1      MET  68   5.513 -26.202  -4.072
    8    HE3  MET  68           HE2      MET  68   6.999 -25.845  -3.194
    9    HE2  MET  68           HE3      MET  68   7.046 -26.913  -4.594

  No H/Q in entry =           9
  In of MODEL   21
    1    H    LYS  69           H        LYS  69   1.642 -23.601  -7.000
    2    HA   LYS  69           HA       LYS  69   1.732 -20.813  -6.563
    3    HB2  LYS  69           HB2      LYS  69  -0.476 -22.556  -7.617
    4    HB3  LYS  69           HB3      LYS  69  -0.547 -20.791  -7.574
    5    HG2  LYS  69           HG2      LYS  69   1.515 -20.655  -8.900
    6    HG3  LYS  69           HG3      LYS  69   1.624 -22.415  -8.930
    7    HD2  LYS  69           HD2      LYS  69  -0.576 -22.504 -10.089
    8    HD3  LYS  69           HD3      LYS  69  -0.601 -20.740 -10.126
    9    HE2  LYS  69           HE2      LYS  69   1.544 -22.484 -11.374
   10    HE3  LYS  69           HE3      LYS  69   0.253 -21.670 -12.256
   11    HZ2  LYS  69           HZ1      LYS  69   2.721 -20.630 -11.431
   12    HZ1  LYS  69           HZ2      LYS  69   1.492 -19.783 -10.619
   13    HZ3  LYS  69           HZ3      LYS  69   1.497 -19.860 -12.317

  No H/Q in entry =          13
  In of MODEL   21
    1    H    VAL  70           H        VAL  70   0.158 -19.409  -5.582
    2    HA   VAL  70           HA       VAL  70  -1.198 -20.555  -3.208
    3    HB   VAL  70           HB       VAL  70  -0.555 -18.470  -1.989
    4   HG13  VAL  70          HG11      VAL  70   0.804 -20.351  -1.508
    5   HG12  VAL  70          HG12      VAL  70   1.951 -19.063  -1.880
    6   HG11  VAL  70          HG13      VAL  70   1.584 -20.293  -3.090
    7   HG21  VAL  70          HG21      VAL  70   1.001 -17.959  -4.549
    8   HG23  VAL  70          HG22      VAL  70   1.399 -17.171  -3.024
    9   HG22  VAL  70          HG23      VAL  70  -0.172 -16.896  -3.769

  No H/Q in entry =           9
  In of MODEL   21
    1    H    SER  71           H        SER  71  -2.725 -18.834  -2.273
    2    HA   SER  71           HA       SER  71  -4.735 -18.197  -4.148
    3    HB2  SER  71           HB2      SER  71  -5.086 -18.462  -1.662
    4    HB3  SER  71           HB3      SER  71  -4.292 -16.908  -1.432
    5    HG   SER  71           HG       SER  71  -6.656 -16.890  -1.610

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU  72           H        LEU  72  -4.948 -16.551  -5.497
    2    HA   LEU  72           HA       LEU  72  -2.866 -14.709  -5.976
    3    HB2  LEU  72           HB2      LEU  72  -5.727 -14.807  -6.930
    4    HB3  LEU  72           HB3      LEU  72  -4.544 -13.635  -7.505
    5    HG   LEU  72           HG       LEU  72  -4.109 -16.637  -7.633
    6   HD11  LEU  72          HD11      LEU  72  -6.060 -15.898  -9.011
    7   HD13  LEU  72          HD12      LEU  72  -4.718 -16.487  -9.991
    8   HD12  LEU  72          HD13      LEU  72  -5.001 -14.753  -9.836
    9   HD22  LEU  72          HD21      LEU  72  -1.993 -15.654  -7.860
   10   HD21  LEU  72          HD22      LEU  72  -2.620 -14.214  -8.644
   11   HD23  LEU  72          HD23      LEU  72  -2.527 -15.730  -9.535

  No H/Q in entry =          11
  In of MODEL   21
    1    H    VAL  73           H        VAL  73  -5.969 -14.395  -4.357
    2    HA   VAL  73           HA       VAL  73  -6.057 -11.624  -4.012
    3    HB   VAL  73           HB       VAL  73  -7.763 -12.010  -2.413
    4   HG13  VAL  73          HG11      VAL  73  -9.220 -13.370  -3.658
    5   HG12  VAL  73          HG12      VAL  73  -7.932 -14.474  -4.135
    6   HG11  VAL  73          HG13      VAL  73  -8.027 -12.866  -4.856
    7   HG21  VAL  73          HG21      VAL  73  -6.304 -14.604  -2.013
    8   HG23  VAL  73          HG22      VAL  73  -8.029 -14.523  -1.655
    9   HG22  VAL  73          HG23      VAL  73  -6.902 -13.467  -0.806

  No H/Q in entry =           9
  In of MODEL   21
    1    H    LEU  74           H        LEU  74  -4.088 -13.960  -2.417
    2    HA   LEU  74           HA       LEU  74  -3.702 -12.807   0.104
    3    HB2  LEU  74           HB2      LEU  74  -2.883 -15.015  -0.390
    4    HB3  LEU  74           HB3      LEU  74  -1.833 -14.388  -1.660
    5    HG   LEU  74           HG       LEU  74  -0.556 -13.113   0.031
    6   HD12  LEU  74          HD11      LEU  74  -1.040 -13.837   2.467
    7   HD11  LEU  74          HD12      LEU  74  -2.621 -14.338   1.864
    8   HD13  LEU  74          HD13      LEU  74  -2.127 -12.648   1.748
    9   HD21  LEU  74          HD21      LEU  74  -0.320 -15.680  -0.577
   10   HD23  LEU  74          HD22      LEU  74  -0.735 -15.852   1.114
   11   HD22  LEU  74          HD23      LEU  74   0.687 -14.939   0.664

  No H/Q in entry =          11
  In of MODEL   21
    1    H    VAL  75           H        VAL  75  -1.809 -12.391  -2.848
    2    HA   VAL  75           HA       VAL  75  -0.043 -10.438  -1.836
    3    HB   VAL  75           HB       VAL  75  -0.983 -10.942  -4.662
    4   HG11  VAL  75          HG11      VAL  75   1.258  -9.180  -3.577
    5   HG13  VAL  75          HG12      VAL  75  -0.158  -8.642  -4.468
    6   HG12  VAL  75          HG13      VAL  75   1.063  -9.614  -5.271
    7   HG23  VAL  75          HG21      VAL  75   1.236 -12.039  -4.835
    8   HG22  VAL  75          HG22      VAL  75   0.244 -12.798  -3.589
    9   HG21  VAL  75          HG23      VAL  75   1.538 -11.688  -3.132

  No H/Q in entry =           9
  In of MODEL   21
    1    H    GLU  76           H        GLU  76  -3.194 -10.142  -3.504
    2    HA   GLU  76           HA       GLU  76  -3.288  -7.329  -3.611
    3    HB2  GLU  76           HB2      GLU  76  -4.921  -8.794  -4.776
    4    HB3  GLU  76           HB3      GLU  76  -5.572  -9.300  -3.224
    5    HG2  GLU  76           HG2      GLU  76  -7.047  -7.610  -4.112
    6    HG3  GLU  76           HG3      GLU  76  -6.185  -6.885  -2.770

  No H/Q in entry =           6
  In of MODEL   21
    1    H    ALA  77           H        ALA  77  -4.372  -9.568  -1.070
    2    HA   ALA  77           HA       ALA  77  -5.363  -7.577   0.682
    3    HB3  ALA  77           HB1      ALA  77  -6.003  -9.841   1.082
    4    HB2  ALA  77           HB2      ALA  77  -5.004  -9.361   2.452
    5    HB1  ALA  77           HB3      ALA  77  -4.325 -10.372   1.179

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLN  78           H        GLN  78  -2.192  -9.080   0.329
    2    HA   GLN  78           HA       GLN  78  -0.958  -7.897   2.581
    3    HB2  GLN  78           HB2      GLN  78  -0.062  -9.828   1.237
    4    HB3  GLN  78           HB3      GLN  78   0.354  -8.682  -0.035
    5    HG2  GLN  78           HG2      GLN  78   1.797  -7.454   1.536
    6    HG3  GLN  78           HG3      GLN  78   1.381  -8.592   2.814
    7   HE21  GLN  78          HE21      GLN  78   4.097  -8.290   1.986
    8   HE22  GLN  78          HE22      GLN  78   4.583  -9.717   1.203

  No H/Q in entry =           8
  In of MODEL   21
    1    H    LEU  79           H        LEU  79  -1.331  -6.848  -0.769
    2    HA   LEU  79           HA       LEU  79   0.323  -4.597  -0.756
    3    HB2  LEU  79           HB2      LEU  79  -0.686  -5.423  -2.811
    4    HB3  LEU  79           HB3      LEU  79  -2.297  -5.053  -2.207
    5    HG   LEU  79           HG       LEU  79  -1.787  -2.658  -2.185
    6   HD13  LEU  79          HD11      LEU  79   0.448  -2.381  -1.667
    7   HD12  LEU  79          HD12      LEU  79   0.498  -2.097  -3.406
    8   HD11  LEU  79          HD13      LEU  79   0.973  -3.667  -2.756
    9   HD23  LEU  79          HD21      LEU  79  -1.148  -2.455  -4.736
   10   HD22  LEU  79          HD22      LEU  79  -2.665  -3.224  -4.279
   11   HD21  LEU  79          HD23      LEU  79  -1.277  -4.214  -4.718

  No H/Q in entry =          11
  In of MODEL   21
    1    H    HIS  80           H        HIS  80  -3.143  -4.807   0.061
    2    HA   HIS  80           HA       HIS  80  -3.375  -2.052   0.719
    3    HB2  HIS  80           HB2      HIS  80  -5.043  -4.484   1.038
    4    HB3  HIS  80           HB3      HIS  80  -5.386  -3.146   2.138
    5    HD1  HIS  80           HD1      HIS  80  -7.023  -1.533   1.223
    6    HD2  HIS  80           HD2      HIS  80  -4.797  -3.321  -1.815
    7    HE1  HIS  80           HE1      HIS  80  -7.871  -0.553  -0.961
    8    HE2  HIS  80           HE2      HIS  80  -6.520  -1.637  -2.822

  No H/Q in entry =           8
  In of MODEL   21
    1    H    LEU  81           H        LEU  81  -2.852  -4.936   2.719
    2    HA   LEU  81           HA       LEU  81  -2.865  -3.584   5.201
    3    HB2  LEU  81           HB2      LEU  81  -1.608  -6.185   4.330
    4    HB3  LEU  81           HB3      LEU  81  -1.595  -5.623   6.002
    5    HG   LEU  81           HG       LEU  81  -4.132  -5.913   4.368
    6   HD12  LEU  81          HD11      LEU  81  -4.411  -7.979   5.919
    7   HD11  LEU  81          HD12      LEU  81  -2.661  -7.885   6.109
    8   HD13  LEU  81          HD13      LEU  81  -3.361  -8.128   4.509
    9   HD23  LEU  81          HD21      LEU  81  -4.979  -6.122   6.867
   10   HD22  LEU  81          HD22      LEU  81  -4.674  -4.531   6.175
   11   HD21  LEU  81          HD23      LEU  81  -3.480  -5.273   7.240

  No H/Q in entry =          11
  In of MODEL   21
    1    H    MET  82           H        MET  82  -0.166  -4.456   3.039
    2    HA   MET  82           HA       MET  82   1.901  -3.530   4.727
    3    HB2  MET  82           HB2      MET  82   1.698  -3.881   1.735
    4    HB3  MET  82           HB3      MET  82   3.171  -3.289   2.501
    5    HG2  MET  82           HG2      MET  82   1.796  -5.895   3.227
    6    HG3  MET  82           HG3      MET  82   3.169  -5.770   2.130
    7    HE3  MET  82           HE1      MET  82   6.169  -4.990   4.120
    8    HE2  MET  82           HE2      MET  82   5.230  -3.636   3.497
    9    HE1  MET  82           HE3      MET  82   5.341  -5.127   2.565

  No H/Q in entry =           9
  In of MODEL   21
    1    H    THR  83           H        THR  83   0.064  -1.917   2.162
    2    HA   THR  83           HA       THR  83   1.444   0.549   2.247
    3    HB   THR  83           HB       THR  83  -0.741   1.444   1.253
    4    HG1  THR  83           HG1      THR  83  -2.374   0.125   1.144
    5   HG22  THR  83          HG21      THR  83  -0.442  -0.374  -0.743
    6   HG21  THR  83          HG22      THR  83   1.060  -0.646   0.138
    7   HG23  THR  83          HG23      THR  83   0.679   0.961  -0.481

  No H/Q in entry =           7
  In of MODEL   21
    1    H    SER  84           H        SER  84  -1.553  -0.519   3.842
    2    HA   SER  84           HA       SER  84  -2.084   1.908   5.180
    3    HB2  SER  84           HB2      SER  84  -2.882  -0.939   5.749
    4    HB3  SER  84           HB3      SER  84  -3.395   0.397   6.777
    5    HG   SER  84           HG       SER  84  -3.842   0.072   3.985

  No H/Q in entry =           5
  In of MODEL   21
    1    H    MET  85           H        MET  85  -0.339  -1.000   6.320
    2    HA   MET  85           HA       MET  85   0.162  -0.062   8.924
    3    HB2  MET  85           HB2      MET  85   0.485  -2.403   8.248
    4    HB3  MET  85           HB3      MET  85   1.866  -1.922   7.262
    5    HG2  MET  85           HG2      MET  85   3.013  -1.065   9.272
    6    HG3  MET  85           HG3      MET  85   1.628  -1.524  10.260
    7    HE3  MET  85           HE1      MET  85   3.928  -3.129   7.415
    8    HE2  MET  85           HE2      MET  85   4.897  -4.148   8.478
    9    HE1  MET  85           HE3      MET  85   4.861  -2.406   8.731

  No H/Q in entry =           9
  In of MODEL   21
    1    H    LEU  86           H        LEU  86   2.101   0.212   5.978
    2    HA   LEU  86           HA       LEU  86   4.295   1.552   7.136
    3    HB2  LEU  86           HB2      LEU  86   4.123   0.463   4.829
    4    HB3  LEU  86           HB3      LEU  86   3.298   1.933   4.311
    5    HG   LEU  86           HG       LEU  86   5.308   3.206   5.294
    6   HD11  LEU  86          HD11      LEU  86   6.044   0.605   6.101
    7   HD13  LEU  86          HD12      LEU  86   7.029   2.063   6.198
    8   HD12  LEU  86          HD13      LEU  86   7.155   1.013   4.789
    9   HD23  LEU  86          HD21      LEU  86   6.053   1.447   2.949
   10   HD22  LEU  86          HD22      LEU  86   6.425   3.150   3.208
   11   HD21  LEU  86          HD23      LEU  86   4.779   2.660   2.807

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ALA  87           H        ALA  87   1.372   2.757   5.541
    2    HA   ALA  87           HA       ALA  87   1.932   5.494   5.620
    3    HB1  ALA  87           HB1      ALA  87  -0.355   3.836   5.077
    4    HB3  ALA  87           HB2      ALA  87  -0.064   5.500   4.574
    5    HB2  ALA  87           HB3      ALA  87  -0.857   5.172   6.116

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ARG  88           H        ARG  88   0.261   3.477   8.011
    2    HA   ARG  88           HA       ARG  88  -0.281   5.524   9.851
    3    HB2  ARG  88           HB2      ARG  88  -1.190   3.161   9.921
    4    HB3  ARG  88           HB3      ARG  88   0.355   2.681  10.632
    5    HG2  ARG  88           HG2      ARG  88  -0.151   4.753  12.246
    6    HG3  ARG  88           HG3      ARG  88  -1.813   4.407  11.786
    7    HD2  ARG  88           HD2      ARG  88  -1.900   2.559  13.037
    8    HD3  ARG  88           HD3      ARG  88  -0.303   1.996  12.511
    9    HE   ARG  88           HE       ARG  88  -0.858   3.258  14.961
   10   HH21  ARG  88          HH11      ARG  88   0.684   4.292  16.201
   11   HH22  ARG  88          HH12      ARG  88   2.200   4.736  15.499
   12   HH11  ARG  88          HH21      ARG  88   1.427   3.462  12.389
   13   HH12  ARG  88          HH22      ARG  88   2.629   4.250  13.353

  No H/Q in entry =          13
  In of MODEL   21
    1    H    GLU  89           H        GLU  89   2.544   3.340   9.641
    2    HA   GLU  89           HA       GLU  89   3.788   4.250  11.986
    3    HB2  GLU  89           HB2      GLU  89   4.476   2.237  10.648
    4    HB3  GLU  89           HB3      GLU  89   5.241   3.338   9.501
    5    HG2  GLU  89           HG2      GLU  89   6.710   4.207  11.247
    6    HG3  GLU  89           HG3      GLU  89   5.884   3.244  12.467

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LEU  90           H        LEU  90   4.099   5.404   8.656
    2    HA   LEU  90           HA       LEU  90   6.002   7.430   9.241
    3    HB2  LEU  90           HB2      LEU  90   4.006   7.067   7.009
    4    HB3  LEU  90           HB3      LEU  90   5.220   8.354   7.031
    5    HG   LEU  90           HG       LEU  90   5.931   5.427   7.374
    6   HD12  LEU  90          HD11      LEU  90   6.683   5.664   4.935
    7   HD11  LEU  90          HD12      LEU  90   5.649   7.091   4.881
    8   HD13  LEU  90          HD13      LEU  90   4.949   5.510   5.226
    9   HD22  LEU  90          HD21      LEU  90   7.811   6.603   8.058
   10   HD21  LEU  90          HD22      LEU  90   7.446   8.001   7.046
   11   HD23  LEU  90          HD23      LEU  90   8.127   6.543   6.325

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  91           H        ILE  91   2.464   7.399   9.083
    2    HA   ILE  91           HA       ILE  91   2.083  10.168   9.526
    3    HB   ILE  91           HB       ILE  91   0.323   7.770  10.070
    4   HG12  ILE  91          HG12      ILE  91   0.049  10.043   8.078
    5   HG13  ILE  91          HG13      ILE  91   0.930   8.559   7.712
    6   HG22  ILE  91          HG21      ILE  91  -1.437   9.805  10.123
    7   HG21  ILE  91          HG22      ILE  91  -0.049  10.656  10.798
    8   HG23  ILE  91          HG23      ILE  91  -0.668   9.212  11.596
    9   HD13  ILE  91          HD11      ILE  91  -0.997   7.246   7.755
   10   HD12  ILE  91          HD12      ILE  91  -1.604   8.751   7.068
   11   HD11  ILE  91          HD13      ILE  91  -1.875   8.388   8.772

  No H/Q in entry =          11
  In of MODEL   21
    1    H    THR  92           H        THR  92   2.518   7.437  11.735
    2    HA   THR  92           HA       THR  92   2.049   8.811  14.154
    3    HB   THR  92           HB       THR  92   3.891   6.500  13.500
    4    HG1  THR  92           HG1      THR  92   1.933   5.715  13.396
    5   HG22  THR  92          HG21      THR  92   3.504   6.217  16.134
    6   HG21  THR  92          HG22      THR  92   3.415   7.975  16.056
    7   HG23  THR  92          HG23      THR  92   4.862   7.138  15.489

  No H/Q in entry =           7
  In of MODEL   21
    1    H    GLU  93           H        GLU  93   5.011   8.398  12.230
    2    HA   GLU  93           HA       GLU  93   6.740   9.854  13.928
    3    HB2  GLU  93           HB2      GLU  93   6.841   9.533  10.914
    4    HB3  GLU  93           HB3      GLU  93   8.171  10.084  11.931
    5    HG2  GLU  93           HG2      GLU  93   6.798   7.430  12.382
    6    HG3  GLU  93           HG3      GLU  93   8.183   7.598  11.309

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LEU  94           H        LEU  94   4.685  10.833  11.207
    2    HA   LEU  94           HA       LEU  94   5.451  13.548  11.101
    3    HB2  LEU  94           HB2      LEU  94   2.883  12.143  10.344
    4    HB3  LEU  94           HB3      LEU  94   3.117  13.873  10.098
    5    HG   LEU  94           HG       LEU  94   5.166  11.912   9.060
    6   HD11  LEU  94          HD11      LEU  94   2.420  12.420   7.988
    7   HD13  LEU  94          HD12      LEU  94   3.425  10.977   7.869
    8   HD12  LEU  94          HD13      LEU  94   3.743  12.360   6.822
    9   HD23  LEU  94          HD21      LEU  94   5.395  13.747   7.332
   10   HD22  LEU  94          HD22      LEU  94   5.797  14.250   8.974
   11   HD21  LEU  94          HD23      LEU  94   4.242  14.694   8.270

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  95           H        ILE  95   2.932  11.899  12.990
    2    HA   ILE  95           HA       ILE  95   1.851  14.236  14.175
    3    HB   ILE  95           HB       ILE  95   1.908  11.357  15.108
    4   HG12  ILE  95          HG12      ILE  95  -0.336  13.095  14.047
    5   HG13  ILE  95          HG13      ILE  95   0.640  12.047  13.021
    6   HG21  ILE  95          HG21      ILE  95   0.585  13.814  16.298
    7   HG23  ILE  95          HG22      ILE  95   1.648  12.663  17.109
    8   HG22  ILE  95          HG23      ILE  95   0.022  12.176  16.631
    9   HD13  ILE  95          HD11      ILE  95  -0.237  10.098  13.943
   10   HD12  ILE  95          HD12      ILE  95  -1.636  11.166  14.011
   11   HD11  ILE  95          HD13      ILE  95  -0.671  10.887  15.460

  No H/Q in entry =          11
  In of MODEL   21
    1    H    GLU  96           H        GLU  96   4.476  12.060  15.185
    2    HA   GLU  96           HA       GLU  96   5.005  13.274  17.675
    3    HB2  GLU  96           HB2      GLU  96   5.988  11.127  17.036
    4    HB3  GLU  96           HB3      GLU  96   6.913  11.912  15.757
    5    HG2  GLU  96           HG2      GLU  96   8.548  12.490  17.223
    6    HG3  GLU  96           HG3      GLU  96   7.386  13.288  18.272

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LEU  97           H        LEU  97   6.078  14.053  14.390
    2    HA   LEU  97           HA       LEU  97   7.930  16.080  15.102
    3    HB2  LEU  97           HB2      LEU  97   6.355  15.499  12.604
    4    HB3  LEU  97           HB3      LEU  97   7.352  16.947  12.724
    5    HG   LEU  97           HG       LEU  97   8.423  14.167  13.295
    6   HD12  LEU  97          HD11      LEU  97   9.424  14.371  10.981
    7   HD11  LEU  97          HD12      LEU  97   8.351  15.744  10.710
    8   HD13  LEU  97          HD13      LEU  97   7.676  14.142  11.007
    9   HD23  LEU  97          HD21      LEU  97  10.574  15.478  12.556
   10   HD22  LEU  97          HD22      LEU  97   9.945  15.743  14.182
   11   HD21  LEU  97          HD23      LEU  97   9.617  16.917  12.909

  No H/Q in entry =          11
  In of MODEL   21
    1    H    HIS  98           H        HIS  98   4.439  16.158  14.436
    2    HA   HIS  98           HA       HIS  98   4.094  18.953  14.562
    3    HB2  HIS  98           HB2      HIS  98   2.239  16.675  15.289
    4    HB3  HIS  98           HB3      HIS  98   1.744  18.368  15.338
    5    HD1  HIS  98           HD1      HIS  98   2.817  15.663  12.945
    6    HD2  HIS  98           HD2      HIS  98   1.378  19.573  12.807
    7    HE1  HIS  98           HE1      HIS  98   2.257  16.135  10.517
    8    HE2  HIS  98           HE2      HIS  98   1.385  18.511  10.412

  No H/Q in entry =           8
  In of MODEL   21
    1    H    GLU  99           H        GLU  99   4.260  16.474  17.069
    2    HA   GLU  99           HA       GLU  99   3.617  18.165  19.260
    3    HB2  GLU  99           HB2      GLU  99   3.568  15.682  19.364
    4    HB3  GLU  99           HB3      GLU  99   5.329  15.665  19.262
    5    HG2  GLU  99           HG2      GLU  99   5.490  16.966  21.333
    6    HG3  GLU  99           HG3      GLU  99   3.735  17.079  21.422

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LYS 100           H        LYS 100   6.691  17.279  17.708
    2    HA   LYS 100           HA       LYS 100   8.317  18.712  19.565
    3    HB2  LYS 100           HB2      LYS 100   8.840  17.787  16.731
    4    HB3  LYS 100           HB3      LYS 100  10.053  18.579  17.741
    5    HG2  LYS 100           HG2      LYS 100   9.700  16.828  19.486
    6    HG3  LYS 100           HG3      LYS 100   8.585  16.003  18.393
    7    HD2  LYS 100           HD2      LYS 100  10.388  15.744  16.732
    8    HD3  LYS 100           HD3      LYS 100  11.508  16.581  17.810
    9    HE2  LYS 100           HE2      LYS 100  11.135  14.825  19.532
   10    HE3  LYS 100           HE3      LYS 100  10.077  13.969  18.405
   11    HZ1  LYS 100           HZ1      LYS 100  12.889  14.682  17.757
   12    HZ3  LYS 100           HZ2      LYS 100  11.865  13.608  16.929
   13    HZ2  LYS 100           HZ3      LYS 100  12.455  13.202  18.470

  No H/Q in entry =          13
  In of MODEL   21
    1    H    LEU 101           H        LEU 101   6.618  19.603  16.602
    2    HA   LEU 101           HA       LEU 101   7.792  22.178  16.264
    3    HB2  LEU 101           HB2      LEU 101   5.219  20.900  15.372
    4    HB3  LEU 101           HB3      LEU 101   5.443  22.635  15.161
    5    HG   LEU 101           HG       LEU 101   7.514  20.649  14.207
    6   HD12  LEU 101          HD11      LEU 101   6.361  21.130  11.917
    7   HD11  LEU 101          HD12      LEU 101   4.951  21.540  12.892
    8   HD13  LEU 101          HD13      LEU 101   5.641  19.920  12.980
    9   HD21  LEU 101          HD21      LEU 101   6.842  23.549  13.641
   10   HD23  LEU 101          HD22      LEU 101   7.841  22.602  12.540
   11   HD22  LEU 101          HD23      LEU 101   8.374  22.873  14.199

  No H/Q in entry =          11
  In of MODEL   21
    1    H    LYS 102           H        LYS 102   6.265  21.023  18.878
    2    HA   LYS 102           HA       LYS 102   5.609  22.109  20.805
    3    HB2  LYS 102           HB2      LYS 102   6.864  24.117  19.679
    4    HB3  LYS 102           HB3      LYS 102   5.256  24.695  19.297
    5    HG2  LYS 102           HG2      LYS 102   6.629  24.468  21.954
    6    HG3  LYS 102           HG3      LYS 102   5.657  25.780  21.318
    7    HD2  LYS 102           HD2      LYS 102   4.453  23.126  22.200
    8    HD3  LYS 102           HD3      LYS 102   4.676  24.494  23.281
    9    HE2  LYS 102           HE2      LYS 102   2.408  24.051  21.786
   10    HE3  LYS 102           HE3      LYS 102   2.885  25.607  22.465
   11    HZ2  LYS 102           HZ1      LYS 102   2.360  25.700  20.084
   12    HZ1  LYS 102           HZ2      LYS 102   3.639  24.637  19.768
   13    HZ3  LYS 102           HZ3      LYS 102   3.956  26.174  20.407

  No H/Q in entry =          13
  In of MODEL   21
    1    H    ALA 103           H        ALA 103   3.956  23.619  18.028
    2    HA   ALA 103           HA       ALA 103   1.490  24.159  18.904
    3    HB1  ALA 103           HB1      ALA 103   0.612  23.297  16.661
    4    HB2  ALA 103           HB2      ALA 103   2.268  22.785  16.338
    5    HB3  ALA 103           HB3      ALA 103   1.906  24.493  16.599

  No H/Q in entry =           5
  In of MODEL   21
    1    H1   ALA   1           H3       ALA   1  10.863 -20.267  -6.225
    2    H2   ALA   1           H2       ALA   1   9.906 -20.491  -7.613
    3    H3   ALA   1           H1       ALA   1   9.476 -21.241  -6.149
    4    HA   ALA   1           HA       ALA   1  10.545 -23.035  -6.881
    5    HB1  ALA   1           HB1      ALA   1  10.642 -22.681  -9.157
    6    HB2  ALA   1           HB2      ALA   1  12.365 -22.503  -8.823
    7    HB3  ALA   1           HB3      ALA   1  11.346 -21.072  -8.981

  No H/Q in entry =           7
  In of MODEL   21
    1    H    GLU   2           H        GLU   2  12.843 -23.952  -6.930
    2    HA   GLU   2           HA       GLU   2  14.216 -23.844  -4.714
    3    HB2  GLU   2           HB2      GLU   2  15.578 -23.699  -7.410
    4    HB3  GLU   2           HB3      GLU   2  16.311 -24.295  -5.921
    5    HG2  GLU   2           HG2      GLU   2  15.325 -26.328  -6.159
    6    HG3  GLU   2           HG3      GLU   2  13.744 -25.606  -6.425

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLU   3           H        GLU   3  15.967 -21.959  -7.115
    2    HA   GLU   3           HA       GLU   3  17.089 -20.250  -5.157
    3    HB2  GLU   3           HB2      GLU   3  17.042 -20.256  -8.167
    4    HB3  GLU   3           HB3      GLU   3  17.765 -18.914  -7.281
    5    HG2  GLU   3           HG2      GLU   3  19.445 -20.261  -6.351
    6    HG3  GLU   3           HG3      GLU   3  18.521 -21.743  -6.570

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LEU   4           H        LEU   4  14.802 -19.443  -7.796
    2    HA   LEU   4           HA       LEU   4  14.295 -16.840  -7.193
    3    HB2  LEU   4           HB2      LEU   4  12.152 -18.848  -7.924
    4    HB3  LEU   4           HB3      LEU   4  12.051 -17.101  -8.127
    5    HG   LEU   4           HG       LEU   4  14.047 -18.938  -9.490
    6   HD13  LEU   4          HD11      LEU   4  12.748 -18.813 -11.404
    7   HD12  LEU   4          HD12      LEU   4  12.017 -17.278 -10.942
    8   HD11  LEU   4          HD13      LEU   4  11.483 -18.775 -10.179
    9   HD23  LEU   4          HD21      LEU   4  14.354 -16.692 -10.846
   10   HD22  LEU   4          HD22      LEU   4  15.213 -16.918  -9.324
   11   HD21  LEU   4          HD23      LEU   4  13.746 -15.943  -9.369

  No H/Q in entry =          11
  In of MODEL   21
    1    H    GLU   5           H        GLU   5  12.847 -19.641  -5.548
    2    HA   GLU   5           HA       GLU   5  11.142 -18.090  -3.853
    3    HB2  GLU   5           HB2      GLU   5  10.754 -20.475  -4.369
    4    HB3  GLU   5           HB3      GLU   5  12.191 -20.888  -3.433
    5    HG2  GLU   5           HG2      GLU   5  11.207 -19.890  -1.427
    6    HG3  GLU   5           HG3      GLU   5   9.788 -19.397  -2.350

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLU   6           H        GLU   6  14.310 -19.622  -3.398
    2    HA   GLU   6           HA       GLU   6  14.643 -18.754  -0.701
    3    HB2  GLU   6           HB2      GLU   6  16.619 -19.669  -2.802
    4    HB3  GLU   6           HB3      GLU   6  17.063 -19.311  -1.132
    5    HG2  GLU   6           HG2      GLU   6  15.517 -21.017  -0.318
    6    HG3  GLU   6           HG3      GLU   6  14.966 -21.337  -1.962

  No H/Q in entry =           6
  In of MODEL   21
    1    H    VAL   7           H        VAL   7  15.397 -17.423  -3.852
    2    HA   VAL   7           HA       VAL   7  17.049 -15.270  -2.988
    3    HB   VAL   7           HB       VAL   7  15.355 -15.665  -5.469
    4   HG11  VAL   7          HG11      VAL   7  17.213 -13.421  -4.658
    5   HG13  VAL   7          HG12      VAL   7  15.570 -13.305  -5.286
    6   HG12  VAL   7          HG13      VAL   7  16.890 -13.791  -6.351
    7   HG21  VAL   7          HG21      VAL   7  17.482 -17.088  -4.891
    8   HG23  VAL   7          HG22      VAL   7  18.366 -15.614  -5.291
    9   HG22  VAL   7          HG23      VAL   7  17.345 -16.383  -6.503

  No H/Q in entry =           9
  In of MODEL   21
    1    H    VAL   8           H        VAL   8  13.562 -15.594  -3.554
    2    HA   VAL   8           HA       VAL   8  12.854 -12.895  -3.091
    3    HB   VAL   8           HB       VAL   8  11.283 -15.450  -2.663
    4   HG13  VAL   8          HG11      VAL   8  10.141 -13.906  -1.319
    5   HG12  VAL   8          HG12      VAL   8   9.332 -13.712  -2.875
    6   HG11  VAL   8          HG13      VAL   8  10.551 -12.546  -2.364
    7   HG22  VAL   8          HG21      VAL   8  10.711 -15.312  -4.887
    8   HG21  VAL   8          HG22      VAL   8  12.144 -14.299  -5.022
    9   HG23  VAL   8          HG23      VAL   8  10.560 -13.556  -4.831

  No H/Q in entry =           9
  In of MODEL   21
    1    H    MET   9           H        MET   9  13.158 -15.691  -0.903
    2    HA   MET   9           HA       MET   9  12.317 -14.426   1.462
    3    HB2  MET   9           HB2      MET   9  14.221 -16.691   0.905
    4    HB3  MET   9           HB3      MET   9  13.993 -16.090   2.547
    5    HG2  MET   9           HG2      MET   9  11.466 -16.359   2.099
    6    HG3  MET   9           HG3      MET   9  11.949 -17.338   0.712
    7    HE1  MET   9           HE1      MET   9  12.949 -19.383   0.637
    8    HE3  MET   9           HE2      MET   9  13.425 -20.460   1.947
    9    HE2  MET   9           HE3      MET   9  14.446 -19.088   1.530

  No H/Q in entry =           9
  In of MODEL   21
    1    H    GLY  10           H        GLY  10  15.505 -14.604  -0.085
    2    HA3  GLY  10           HA2      GLY  10  16.936 -13.155   1.885
    3    HA2  GLY  10           HA3      GLY  10  17.406 -13.317   0.193

  No H/Q in entry =           3
  In of MODEL   21
    1    H    LEU  11           H        LEU  11  15.222 -12.134  -1.055
    2    HA   LEU  11           HA       LEU  11  15.862  -9.378  -0.897
    3    HB2  LEU  11           HB2      LEU  11  13.521 -10.829  -2.135
    4    HB3  LEU  11           HB3      LEU  11  13.774  -9.091  -2.298
    5    HG   LEU  11           HG       LEU  11  15.837 -11.168  -3.075
    6   HD13  LEU  11          HD11      LEU  11  14.102 -11.567  -4.599
    7   HD12  LEU  11          HD12      LEU  11  15.088 -10.372  -5.440
    8   HD11  LEU  11          HD13      LEU  11  13.604  -9.876  -4.627
    9   HD22  LEU  11          HD21      LEU  11  17.036  -9.184  -2.851
   10   HD21  LEU  11          HD22      LEU  11  15.645  -8.171  -3.237
   11   HD23  LEU  11          HD23      LEU  11  16.494  -9.029  -4.521

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  12           H        ILE  12  13.120 -11.246   0.367
    2    HA   ILE  12           HA       ILE  12  11.687  -9.043   1.417
    3    HB   ILE  12           HB       ILE  12  11.769 -11.921   2.375
    4   HG12  ILE  12          HG12      ILE  12  11.079 -11.308  -0.078
    5   HG13  ILE  12          HG13      ILE  12  10.068 -12.411   0.834
    6   HG23  ILE  12          HG21      ILE  12  10.794 -10.524   4.102
    7   HG22  ILE  12          HG22      ILE  12   9.482 -11.378   3.291
    8   HG21  ILE  12          HG23      ILE  12   9.794  -9.685   2.916
    9   HD11  ILE  12          HD11      ILE  12   9.595  -9.429   0.592
   10   HD13  ILE  12          HD12      ILE  12   8.521 -10.610   1.339
   11   HD12  ILE  12          HD13      ILE  12   8.796 -10.645  -0.389

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  13           H        ILE  13  14.113 -11.204   2.835
    2    HA   ILE  13           HA       ILE  13  14.121 -10.017   5.413
    3    HB   ILE  13           HB       ILE  13  16.216 -11.554   3.857
    4   HG12  ILE  13          HG12      ILE  13  13.951 -12.562   4.682
    5   HG13  ILE  13          HG13      ILE  13  15.441 -13.459   4.960
    6   HG23  ILE  13          HG21      ILE  13  17.455 -10.249   5.450
    7   HG22  ILE  13          HG22      ILE  13  17.329 -11.870   6.122
    8   HG21  ILE  13          HG23      ILE  13  16.292 -10.580   6.732
    9   HD11  ILE  13          HD11      ILE  13  14.206 -11.596   7.022
   10   HD13  ILE  13          HD12      ILE  13  15.544 -12.716   7.255
   11   HD12  ILE  13          HD13      ILE  13  13.922 -13.335   6.971

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ASN  14           H        ASN  14  16.073  -9.459   2.498
    2    HA   ASN  14           HA       ASN  14  17.779  -7.484   3.560
    3    HB2  ASN  14           HB2      ASN  14  17.786  -8.756   1.248
    4    HB3  ASN  14           HB3      ASN  14  16.870  -7.357   0.704
    5   HD21  ASN  14          HD21      ASN  14  19.319  -7.655  -0.473
    6   HD22  ASN  14          HD22      ASN  14  20.440  -6.550   0.154

  No H/Q in entry =           6
  In of MODEL   21
    1    H    SER  15           H        SER  15  14.668  -7.198   1.858
    2    HA   SER  15           HA       SER  15  14.503  -4.380   1.906
    3    HB2  SER  15           HB2      SER  15  12.177  -4.671   1.405
    4    HB3  SER  15           HB3      SER  15  13.002  -6.024   0.640
    5    HG   SER  15           HG       SER  15  11.076  -6.109   2.431

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLY  16           H        GLY  16  13.449  -6.854   4.213
    2    HA3  GLY  16           HA2      GLY  16  12.189  -5.124   6.062
    3    HA2  GLY  16           HA3      GLY  16  12.833  -6.719   6.430

  No H/Q in entry =           3
  In of MODEL   21
    1    H    GLN  17           H        GLN  17  15.539  -6.337   5.845
    2    HA   GLN  17           HA       GLN  17  16.465  -5.091   8.226
    3    HB2  GLN  17           HB2      GLN  17  17.906  -5.926   5.694
    4    HB3  GLN  17           HB3      GLN  17  18.739  -5.300   7.119
    5    HG2  GLN  17           HG2      GLN  17  17.825  -7.109   8.488
    6    HG3  GLN  17           HG3      GLN  17  16.908  -7.716   7.110
    7   HE21  GLN  17          HE21      GLN  17  18.454  -9.667   7.947
    8   HE22  GLN  17          HE22      GLN  17  19.910  -9.804   7.087

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ALA  18           H        ALA  18  16.267  -4.026   4.862
    2    HA   ALA  18           HA       ALA  18  17.656  -1.606   5.087
    3    HB2  ALA  18           HB1      ALA  18  16.568  -2.847   3.019
    4    HB3  ALA  18           HB2      ALA  18  16.799  -1.099   3.000
    5    HB1  ALA  18           HB3      ALA  18  15.211  -1.775   3.366

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ARG  19           H        ARG  19  14.166  -2.260   5.475
    2    HA   ARG  19           HA       ARG  19  13.445   0.378   6.180
    3    HB2  ARG  19           HB2      ARG  19  11.800  -1.407   5.593
    4    HB3  ARG  19           HB3      ARG  19  12.152  -2.194   7.133
    5    HG2  ARG  19           HG2      ARG  19  11.399  -0.214   8.365
    6    HG3  ARG  19           HG3      ARG  19  11.137   0.654   6.853
    7    HD2  ARG  19           HD2      ARG  19   9.009  -0.182   7.669
    8    HD3  ARG  19           HD3      ARG  19   9.449  -1.057   6.196
    9    HE   ARG  19           HE       ARG  19  10.431  -2.575   8.309
   10   HH21  ARG  19          HH11      ARG  19   9.211  -4.237   9.248
   11   HH22  ARG  19          HH12      ARG  19   7.491  -4.243   9.071
   12   HH11  ARG  19          HH21      ARG  19   7.416  -1.344   7.200
   13   HH12  ARG  19          HH22      ARG  19   6.475  -2.605   7.908

  No H/Q in entry =          13
  In of MODEL   21
    1    H    SER  20           H        SER  20  14.351  -2.430   8.150
    2    HA   SER  20           HA       SER  20  14.038  -1.329  10.683
    3    HB2  SER  20           HB2      SER  20  14.723  -3.732  10.013
    4    HB3  SER  20           HB3      SER  20  16.371  -3.109  10.003
    5    HG   SER  20           HG       SER  20  16.132  -2.538  12.152

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU  21           H        LEU  21  16.887  -1.218   8.556
    2    HA   LEU  21           HA       LEU  21  18.526   0.305  10.296
    3    HB2  LEU  21           HB2      LEU  21  18.519   0.019   7.284
    4    HB3  LEU  21           HB3      LEU  21  19.751   0.913   8.171
    5    HG   LEU  21           HG       LEU  21  19.078  -1.991   8.723
    6   HD11  LEU  21          HD11      LEU  21  19.952  -1.630   6.407
    7   HD13  LEU  21          HD12      LEU  21  21.050  -2.571   7.416
    8   HD12  LEU  21          HD13      LEU  21  21.383  -0.868   7.103
    9   HD21  LEU  21          HD21      LEU  21  21.137  -0.035   9.722
   10   HD23  LEU  21          HD22      LEU  21  21.575  -1.737   9.630
   11   HD22  LEU  21          HD23      LEU  21  20.226  -1.234  10.634

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ALA  22           H        ALA  22  16.253   1.223   7.730
    2    HA   ALA  22           HA       ALA  22  16.738   3.991   7.739
    3    HB3  ALA  22           HB1      ALA  22  15.365   2.718   6.059
    4    HB2  ALA  22           HB2      ALA  22  14.627   4.218   6.620
    5    HB1  ALA  22           HB3      ALA  22  14.065   2.669   7.249

  No H/Q in entry =           5
  In of MODEL   21
    1    H    TYR  23           H        TYR  23  14.270   2.132   9.570
    2    HA   TYR  23           HA       TYR  23  13.260   4.354  11.010
    3    HB2  TYR  23           HB2      TYR  23  12.065   2.216  10.990
    4    HB3  TYR  23           HB3      TYR  23  13.410   1.435  11.824
    5    HD1  TYR  23           HD1      TYR  23  10.848   4.125  12.168
    6    HD2  TYR  23           HD2      TYR  23  13.598   1.511  14.180
    7    HE1  TYR  23           HE1      TYR  23   9.896   4.808  14.355
    8    HE2  TYR  23           HE2      TYR  23  12.647   2.193  16.366
    9    HH   TYR  23           HH       TYR  23   9.983   4.564  16.552

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ALA  24           H        ALA  24  15.946   2.131  11.662
    2    HA   ALA  24           HA       ALA  24  16.588   3.145  14.226
    3    HB1  ALA  24           HB1      ALA  24  17.979   1.378  14.070
    4    HB3  ALA  24           HB2      ALA  24  18.993   2.316  12.972
    5    HB2  ALA  24           HB3      ALA  24  17.719   1.281  12.329

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA  25           H        ALA  25  17.539   4.084  10.948
    2    HA   ALA  25           HA       ALA  25  19.445   6.056  11.595
    3    HB1  ALA  25           HB1      ALA  25  18.754   5.089   9.280
    4    HB3  ALA  25           HB2      ALA  25  19.224   6.786   9.370
    5    HB2  ALA  25           HB3      ALA  25  17.517   6.346   9.296

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU  26           H        LEU  26  15.928   6.218  11.221
    2    HA   LEU  26           HA       LEU  26  15.650   8.997  11.664
    3    HB2  LEU  26           HB2      LEU  26  13.815   7.724  10.733
    4    HB3  LEU  26           HB3      LEU  26  13.739   6.699  12.161
    5    HG   LEU  26           HG       LEU  26  13.092   8.648  13.534
    6   HD12  LEU  26          HD11      LEU  26  12.397  10.733  12.201
    7   HD11  LEU  26          HD12      LEU  26  13.394  10.095  10.896
    8   HD13  LEU  26          HD13      LEU  26  14.126  10.498  12.450
    9   HD21  LEU  26          HD21      LEU  26  11.431   8.298  11.019
   10   HD23  LEU  26          HD22      LEU  26  10.852   8.989  12.532
   11   HD22  LEU  26          HD23      LEU  26  11.336   7.296  12.468

  No H/Q in entry =          11
  In of MODEL   21
    1    H    LYS  27           H        LYS  27  15.585   6.221  13.864
    2    HA   LYS  27           HA       LYS  27  14.960   7.582  16.226
    3    HB2  LYS  27           HB2      LYS  27  15.034   5.107  15.968
    4    HB3  LYS  27           HB3      LYS  27  16.796   5.191  15.931
    5    HG2  LYS  27           HG2      LYS  27  16.820   6.183  18.178
    6    HG3  LYS  27           HG3      LYS  27  15.053   6.170  18.217
    7    HD2  LYS  27           HD2      LYS  27  15.073   3.702  17.986
    8    HD3  LYS  27           HD3      LYS  27  16.838   3.723  17.981
    9    HE2  LYS  27           HE2      LYS  27  16.846   4.718  20.235
   10    HE3  LYS  27           HE3      LYS  27  15.080   4.727  20.244
   11    HZ3  LYS  27           HZ1      LYS  27  15.899   2.791  21.402
   12    HZ2  LYS  27           HZ2      LYS  27  16.828   2.326  20.055
   13    HZ1  LYS  27           HZ3      LYS  27  15.130   2.300  19.970

  No H/Q in entry =          13
  In of MODEL   21
    1    H    GLN  28           H        GLN  28  18.092   7.051  14.647
    2    HA   GLN  28           HA       GLN  28  19.750   8.169  16.640
    3    HB2  GLN  28           HB2      GLN  28  20.050   8.125  13.626
    4    HB3  GLN  28           HB3      GLN  28  21.324   8.614  14.743
    5    HG2  GLN  28           HG2      GLN  28  19.946   5.915  14.764
    6    HG3  GLN  28           HG3      GLN  28  21.535   6.231  14.070
    7   HE21  GLN  28          HE21      GLN  28  20.221   4.906  16.758
    8   HE22  GLN  28          HE22      GLN  28  21.391   5.334  17.909

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ALA  29           H        ALA  29  17.982   9.614  13.938
    2    HA   ALA  29           HA       ALA  29  18.935  12.252  14.188
    3    HB2  ALA  29           HB1      ALA  29  17.231  12.857  12.710
    4    HB1  ALA  29           HB2      ALA  29  16.105  11.666  13.360
    5    HB3  ALA  29           HB3      ALA  29  17.448  11.144  12.342

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LYS  30           H        LYS  30  16.181  10.610  15.704
    2    HA   LYS  30           HA       LYS  30  15.124  12.849  17.052
    3    HB2  LYS  30           HB2      LYS  30  15.059   9.908  17.762
    4    HB3  LYS  30           HB3      LYS  30  14.169  11.146  18.650
    5    HG2  LYS  30           HG2      LYS  30  13.041  11.809  16.526
    6    HG3  LYS  30           HG3      LYS  30  13.870  10.484  15.705
    7    HD2  LYS  30           HD2      LYS  30  12.819   8.863  17.234
    8    HD3  LYS  30           HD3      LYS  30  12.000  10.177  18.079
    9    HE2  LYS  30           HE2      LYS  30  10.829  10.785  15.981
   10    HE3  LYS  30           HE3      LYS  30  11.629   9.442  15.156
   11    HZ2  LYS  30           HZ1      LYS  30   9.324   8.997  16.029
   12    HZ1  LYS  30           HZ2      LYS  30   9.985   9.065  17.599
   13    HZ3  LYS  30           HZ3      LYS  30  10.517   7.886  16.493

  No H/Q in entry =          13
  In of MODEL   21
    1    H    GLN  31           H        GLN  31  17.818  10.725  17.803
    2    HA   GLN  31           HA       GLN  31  18.119  11.751  20.496
    3    HB2  GLN  31           HB2      GLN  31  20.173  10.209  18.902
    4    HB3  GLN  31           HB3      GLN  31  20.031  10.336  20.656
    5    HG2  GLN  31           HG2      GLN  31  17.535   9.341  19.881
    6    HG3  GLN  31           HG3      GLN  31  18.654   8.512  18.806
    7   HE21  GLN  31          HE21      GLN  31  17.123   7.347  21.080
    8   HE22  GLN  31          HE22      GLN  31  18.285   6.707  22.136

  No H/Q in entry =           8
  In of MODEL   21
    1    H    GLY  32           H        GLY  32  18.627  13.070  17.528
    2    HA3  GLY  32           HA2      GLY  32  19.580  15.130  17.013
    3    HA2  GLY  32           HA3      GLY  32  20.332  15.150  18.603

  No H/Q in entry =           3
  In of MODEL   21
    1    H    ASP  33           H        ASP  33  20.807  12.261  16.834
    2    HA   ASP  33           HA       ASP  33  23.622  12.981  16.376
    3    HB2  ASP  33           HB2      ASP  33  22.156  10.341  16.493
    4    HB3  ASP  33           HB3      ASP  33  23.842  10.484  16.004

  No H/Q in entry =           4
  In of MODEL   21
    1    H    PHE  34           H        PHE  34  23.126  14.292  14.490
    2    HA   PHE  34           HA       PHE  34  21.801  13.281  12.201
    3    HB2  PHE  34           HB2      PHE  34  23.896  15.450  12.433
    4    HB3  PHE  34           HB3      PHE  34  22.920  15.140  10.998
    5    HD1  PHE  34           HD1      PHE  34  23.129  17.085  13.908
    6    HD2  PHE  34           HD2      PHE  34  20.295  14.917  11.518
    7    HE1  PHE  34           HE1      PHE  34  21.287  18.455  14.846
    8    HE2  PHE  34           HE2      PHE  34  18.457  16.287  12.458
    9    HZ   PHE  34           HZ       PHE  34  18.956  18.056  14.118

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ALA  35           H        ALA  35  25.174  13.151  13.220
    2    HA   ALA  35           HA       ALA  35  26.301  12.343  10.769
    3    HB3  ALA  35           HB1      ALA  35  27.995  11.205  12.497
    4    HB2  ALA  35           HB2      ALA  35  27.111  12.219  13.637
    5    HB1  ALA  35           HB3      ALA  35  27.940  12.953  12.265

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA  36           H        ALA  36  25.209  10.375  13.535
    2    HA   ALA  36           HA       ALA  36  25.739   7.893  12.267
    3    HB2  ALA  36           HB1      ALA  36  25.314   7.144  14.343
    4    HB3  ALA  36           HB2      ALA  36  23.619   7.610  14.186
    5    HB1  ALA  36           HB3      ALA  36  24.798   8.763  14.810

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA  37           H        ALA  37  22.882   9.971  12.386
    2    HA   ALA  37           HA       ALA  37  21.060   8.167  11.208
    3    HB3  ALA  37           HB1      ALA  37  21.234  11.134  11.494
    4    HB1  ALA  37           HB2      ALA  37  19.939  10.034  11.965
    5    HB2  ALA  37           HB3      ALA  37  20.125  10.505  10.275

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LYS  38           H        LYS  38  23.121  10.661   9.731
    2    HA   LYS  38           HA       LYS  38  22.498  10.216   7.052
    3    HB2  LYS  38           HB2      LYS  38  24.276  11.808   8.500
    4    HB3  LYS  38           HB3      LYS  38  25.329  10.834   7.480
    5    HG2  LYS  38           HG2      LYS  38  24.158  11.580   5.478
    6    HG3  LYS  38           HG3      LYS  38  22.946  12.415   6.453
    7    HD2  LYS  38           HD2      LYS  38  24.510  14.043   7.207
    8    HD3  LYS  38           HD3      LYS  38  25.889  13.080   6.678
    9    HE2  LYS  38           HE2      LYS  38  25.504  14.941   5.121
   10    HE3  LYS  38           HE3      LYS  38  25.199  13.396   4.319
   11    HZ3  LYS  38           HZ1      LYS  38  22.995  13.802   4.181
   12    HZ2  LYS  38           HZ2      LYS  38  23.489  15.426   4.266
   13    HZ1  LYS  38           HZ3      LYS  38  22.924  14.635   5.659

  No H/Q in entry =          13
  In of MODEL   21
    1    H    ALA  39           H        ALA  39  25.034   8.667   9.020
    2    HA   ALA  39           HA       ALA  39  26.138   7.093   6.958
    3    HB2  ALA  39           HB1      ALA  39  26.057   6.135   9.804
    4    HB1  ALA  39           HB2      ALA  39  26.985   7.576   9.387
    5    HB3  ALA  39           HB3      ALA  39  27.367   6.031   8.629

  No H/Q in entry =           5
  In of MODEL   21
    1    H    MET  40           H        MET  40  23.529   6.436   9.249
    2    HA   MET  40           HA       MET  40  23.137   3.722   8.520
    3    HB2  MET  40           HB2      MET  40  21.280   5.735   9.801
    4    HB3  MET  40           HB3      MET  40  20.905   4.018   9.629
    5    HG2  MET  40           HG2      MET  40  23.432   5.009  10.976
    6    HG3  MET  40           HG3      MET  40  21.940   4.708  11.865
    7    HE3  MET  40           HE1      MET  40  21.442   1.065  12.047
    8    HE2  MET  40           HE2      MET  40  20.553   2.350  11.234
    9    HE1  MET  40           HE3      MET  40  21.283   2.655  12.809

  No H/Q in entry =           9
  In of MODEL   21
    1    H    MET  41           H        MET  41  21.672   6.746   7.321
    2    HA   MET  41           HA       MET  41  19.743   5.511   5.645
    3    HB2  MET  41           HB2      MET  41  21.178   8.127   5.131
    4    HB3  MET  41           HB3      MET  41  19.661   7.604   4.408
    5    HG2  MET  41           HG2      MET  41  18.911   7.408   6.958
    6    HG3  MET  41           HG3      MET  41  20.197   8.590   7.181
    7    HE2  MET  41           HE1      MET  41  19.622   9.859   3.840
    8    HE1  MET  41           HE2      MET  41  20.566  10.320   5.253
    9    HE3  MET  41           HE3      MET  41  19.275  11.374   4.682

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ASP  42           H        ASP  42  23.099   6.495   5.101
    2    HA   ASP  42           HA       ASP  42  23.209   6.017   2.345
    3    HB2  ASP  42           HB2      ASP  42  24.936   7.050   4.117
    4    HB3  ASP  42           HB3      ASP  42  25.623   5.437   3.995

  No H/Q in entry =           4
  In of MODEL   21
    1    H    GLN  43           H        GLN  43  23.964   3.882   5.072
    2    HA   GLN  43           HA       GLN  43  24.675   1.633   3.497
    3    HB2  GLN  43           HB2      GLN  43  23.640   1.804   6.337
    4    HB3  GLN  43           HB3      GLN  43  24.249   0.325   5.587
    5    HG2  GLN  43           HG2      GLN  43  26.391   1.574   5.080
    6    HG3  GLN  43           HG3      GLN  43  25.781   2.893   6.075
    7   HE21  GLN  43          HE21      GLN  43  28.028   1.964   7.121
    8   HE22  GLN  43          HE22      GLN  43  27.770   0.879   8.399

  No H/Q in entry =           8
  In of MODEL   21
    1    H    SER  44           H        SER  44  21.594   2.713   4.870
    2    HA   SER  44           HA       SER  44  20.070   0.440   4.197
    3    HB2  SER  44           HB2      SER  44  19.578   2.962   5.336
    4    HB3  SER  44           HB3      SER  44  18.549   2.897   3.907
    5    HG   SER  44           HG       SER  44  17.467   1.938   5.629

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ARG  45           H        ARG  45  20.763   3.414   2.388
    2    HA   ARG  45           HA       ARG  45  19.255   2.894   0.080
    3    HB2  ARG  45           HB2      ARG  45  20.357   5.053   0.662
    4    HB3  ARG  45           HB3      ARG  45  21.917   4.326   0.284
    5    HG2  ARG  45           HG2      ARG  45  21.148   3.900  -2.032
    6    HG3  ARG  45           HG3      ARG  45  19.600   4.651  -1.652
    7    HD2  ARG  45           HD2      ARG  45  20.810   6.771  -1.069
    8    HD3  ARG  45           HD3      ARG  45  22.322   6.024  -1.631
    9    HE   ARG  45           HE       ARG  45  20.403   5.746  -3.673
   10   HH21  ARG  45          HH11      ARG  45  20.377   7.111  -5.439
   11   HH22  ARG  45          HH12      ARG  45  21.105   8.675  -5.336
   12   HH11  ARG  45          HH21      ARG  45  22.082   8.280  -2.046
   13   HH12  ARG  45          HH22      ARG  45  22.069   9.336  -3.412

  No H/Q in entry =          13
  In of MODEL   21
    1    H    MET  46           H        MET  46  22.632   2.083   0.839
    2    HA   MET  46           HA       MET  46  23.267   0.895  -1.640
    3    HB2  MET  46           HB2      MET  46  24.372   0.601   1.153
    4    HB3  MET  46           HB3      MET  46  25.045  -0.291  -0.214
    5    HG2  MET  46           HG2      MET  46  25.460   1.813  -1.411
    6    HG3  MET  46           HG3      MET  46  24.735   2.724  -0.094
    7    HE2  MET  46           HE1      MET  46  28.699   0.680  -0.509
    8    HE1  MET  46           HE2      MET  46  27.155   0.277  -1.251
    9    HE3  MET  46           HE3      MET  46  27.582  -0.418   0.312

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ALA  47           H        ALA  47  21.899  -0.455   1.335
    2    HA   ALA  47           HA       ALA  47  21.896  -3.171   0.539
    3    HB2  ALA  47           HB1      ALA  47  21.503  -2.711   2.841
    4    HB3  ALA  47           HB2      ALA  47  19.979  -3.343   2.220
    5    HB1  ALA  47           HB3      ALA  47  20.177  -1.607   2.474

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU  48           H        LEU  48  19.498  -0.586   0.169
    2    HA   LEU  48           HA       LEU  48  17.484  -2.158  -1.083
    3    HB2  LEU  48           HB2      LEU  48  18.087   0.807  -1.204
    4    HB3  LEU  48           HB3      LEU  48  16.630   0.069  -1.872
    5    HG   LEU  48           HG       LEU  48  17.482  -0.210   1.019
    6   HD13  LEU  48          HD11      LEU  48  17.025   2.082   0.826
    7   HD12  LEU  48          HD12      LEU  48  15.476   1.409   1.333
    8   HD11  LEU  48          HD13      LEU  48  15.744   1.832  -0.359
    9   HD22  LEU  48          HD21      LEU  48  15.984  -1.952   0.640
   10   HD21  LEU  48          HD22      LEU  48  15.098  -1.068  -0.603
   11   HD23  LEU  48          HD23      LEU  48  14.874  -0.662   1.099

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ASN  49           H        ASN  49  20.141  -0.187  -2.312
    2    HA   ASN  49           HA       ASN  49  19.498  -0.289  -5.037
    3    HB2  ASN  49           HB2      ASN  49  21.149   1.258  -4.115
    4    HB3  ASN  49           HB3      ASN  49  22.201  -0.083  -3.677
    5   HD21  ASN  49          HD21      ASN  49  23.393   1.734  -5.270
    6   HD22  ASN  49          HD22      ASN  49  23.499   1.196  -6.875

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLU  50           H        GLU  50  21.515  -2.444  -3.065
    2    HA   GLU  50           HA       GLU  50  22.251  -4.194  -5.184
    3    HB2  GLU  50           HB2      GLU  50  23.443  -4.142  -3.015
    4    HB3  GLU  50           HB3      GLU  50  22.010  -4.792  -2.221
    5    HG2  GLU  50           HG2      GLU  50  22.137  -6.827  -3.574
    6    HG3  GLU  50           HG3      GLU  50  23.504  -6.174  -4.474

  No H/Q in entry =           6
  In of MODEL   21
    1    H    ALA  51           H        ALA  51  19.589  -4.167  -2.864
    2    HA   ALA  51           HA       ALA  51  18.467  -6.661  -3.616
    3    HB3  ALA  51           HB1      ALA  51  16.863  -6.178  -2.065
    4    HB1  ALA  51           HB2      ALA  51  16.623  -4.537  -2.669
    5    HB2  ALA  51           HB3      ALA  51  17.986  -4.897  -1.609

  No H/Q in entry =           5
  In of MODEL   21
    1    H    HIS  52           H        HIS  52  17.826  -3.327  -4.662
    2    HA   HIS  52           HA       HIS  52  15.726  -3.894  -6.464
    3    HB2  HIS  52           HB2      HIS  52  16.292  -1.617  -5.691
    4    HB3  HIS  52           HB3      HIS  52  17.796  -1.688  -6.609
    5    HD1  HIS  52           HD1      HIS  52  17.505  -1.990  -9.277
    6    HD2  HIS  52           HD2      HIS  52  14.071  -0.868  -7.197
    7    HE1  HIS  52           HE1      HIS  52  15.875  -1.112 -11.006
    8    HE2  HIS  52           HE2      HIS  52  13.776  -0.423  -9.753

  No H/Q in entry =           8
  In of MODEL   21
    1    H    LEU  53           H        LEU  53  19.245  -3.842  -6.890
    2    HA   LEU  53           HA       LEU  53  19.313  -4.165  -9.689
    3    HB2  LEU  53           HB2      LEU  53  21.253  -4.878  -7.506
    4    HB3  LEU  53           HB3      LEU  53  21.579  -5.280  -9.190
    5    HG   LEU  53           HG       LEU  53  20.853  -2.469  -8.312
    6   HD12  LEU  53          HD11      LEU  53  23.375  -2.084  -8.582
    7   HD11  LEU  53          HD12      LEU  53  23.543  -3.836  -8.471
    8   HD13  LEU  53          HD13      LEU  53  22.865  -2.930  -7.124
    9   HD23  LEU  53          HD21      LEU  53  22.294  -2.031 -10.452
   10   HD22  LEU  53          HD22      LEU  53  20.637  -2.586 -10.654
   11   HD21  LEU  53          HD23      LEU  53  21.965  -3.716 -10.835

  No H/Q in entry =          11
  In of MODEL   21
    1    H    VAL  54           H        VAL  54  19.236  -6.545  -7.056
    2    HA   VAL  54           HA       VAL  54  19.402  -8.842  -8.709
    3    HB   VAL  54           HB       VAL  54  18.235  -8.430  -5.945
    4   HG12  VAL  54          HG11      VAL  54  18.605 -11.041  -5.932
    5   HG11  VAL  54          HG12      VAL  54  18.420 -10.882  -7.678
    6   HG13  VAL  54          HG13      VAL  54  17.120 -10.370  -6.603
    7   HG22  VAL  54          HG21      VAL  54  20.546  -8.178  -5.718
    8   HG21  VAL  54          HG22      VAL  54  20.905  -9.268  -7.055
    9   HG23  VAL  54          HG23      VAL  54  20.384  -9.919  -5.502

  No H/Q in entry =           9
  In of MODEL   21
    1    H    GLN  55           H        GLN  55  16.639  -6.983  -7.437
    2    HA   GLN  55           HA       GLN  55  14.649  -8.686  -8.509
    3    HB2  GLN  55           HB2      GLN  55  13.871  -7.168  -6.889
    4    HB3  GLN  55           HB3      GLN  55  14.641  -5.789  -7.668
    5    HG2  GLN  55           HG2      GLN  55  12.914  -5.500  -9.162
    6    HG3  GLN  55           HG3      GLN  55  12.623  -7.226  -9.327
    7   HE21  GLN  55          HE21      GLN  55  10.625  -7.808  -8.524
    8   HE22  GLN  55          HE22      GLN  55   9.835  -7.064  -7.220

  No H/Q in entry =           8
  In of MODEL   21
    1    H    THR  56           H        THR  56  16.341  -5.860  -9.875
    2    HA   THR  56           HA       THR  56  14.901  -5.531 -12.227
    3    HB   THR  56           HB       THR  56  17.918  -5.391 -12.067
    4    HG1  THR  56           HG1      THR  56  15.900  -3.647 -11.145
    5   HG22  THR  56          HG21      THR  56  16.054  -3.582 -13.590
    6   HG21  THR  56          HG22      THR  56  16.575  -5.122 -14.273
    7   HG23  THR  56          HG23      THR  56  17.770  -3.889 -13.867

  No H/Q in entry =           7
  In of MODEL   21
    1    H    LYS  57           H        LYS  57  17.591  -7.779 -11.603
    2    HA   LYS  57           HA       LYS  57  17.618  -8.981 -14.177
    3    HB2  LYS  57           HB2      LYS  57  19.411  -9.198 -12.433
    4    HB3  LYS  57           HB3      LYS  57  18.323 -10.203 -11.488
    5    HG2  LYS  57           HG2      LYS  57  18.246 -11.864 -13.281
    6    HG3  LYS  57           HG3      LYS  57  19.268 -10.853 -14.295
    7    HD2  LYS  57           HD2      LYS  57  21.093 -11.034 -12.634
    8    HD3  LYS  57           HD3      LYS  57  20.076 -12.067 -11.631
    9    HE2  LYS  57           HE2      LYS  57  19.952 -13.734 -13.444
   10    HE3  LYS  57           HE3      LYS  57  20.941 -12.708 -14.481
   11    HZ1  LYS  57           HZ1      LYS  57  22.297 -12.968 -12.080
   12    HZ3  LYS  57           HZ2      LYS  57  22.712 -13.636 -13.585
   13    HZ2  LYS  57           HZ3      LYS  57  21.764 -14.525 -12.493

  No H/Q in entry =          13
  In of MODEL   21
    1    H    LEU  58           H        LEU  58  15.844  -9.671 -11.203
    2    HA   LEU  58           HA       LEU  58  14.668 -12.070 -12.131
    3    HB2  LEU  58           HB2      LEU  58  13.834 -10.172  -9.944
    4    HB3  LEU  58           HB3      LEU  58  13.057 -11.725 -10.256
    5    HG   LEU  58           HG       LEU  58  16.023 -11.391  -9.697
    6   HD11  LEU  58          HD11      LEU  58  13.657 -11.845  -7.907
    7   HD13  LEU  58          HD12      LEU  58  15.092 -10.855  -7.645
    8   HD12  LEU  58          HD13      LEU  58  15.196 -12.609  -7.504
    9   HD22  LEU  58          HD21      LEU  58  15.945 -13.458 -10.718
   10   HD21  LEU  58          HD22      LEU  58  14.235 -13.698 -10.359
   11   HD23  LEU  58          HD23      LEU  58  15.446 -13.972  -9.107

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  59           H        ILE  59  13.937  -8.748 -12.827
    2    HA   ILE  59           HA       ILE  59  11.235  -9.450 -13.769
    3    HB   ILE  59           HB       ILE  59  11.990  -7.151 -12.569
    4   HG12  ILE  59          HG12      ILE  59  10.100  -7.066 -14.931
    5   HG13  ILE  59          HG13      ILE  59   9.683  -7.840 -13.424
    6   HG21  ILE  59          HG21      ILE  59  13.543  -6.725 -14.611
    7   HG23  ILE  59          HG22      ILE  59  12.528  -5.405 -14.073
    8   HG22  ILE  59          HG23      ILE  59  12.073  -6.359 -15.481
    9   HD12  ILE  59          HD11      ILE  59   8.923  -5.440 -13.607
   10   HD11  ILE  59          HD12      ILE  59  10.625  -4.982 -13.584
   11   HD13  ILE  59          HD13      ILE  59   9.912  -5.791 -12.188

  No H/Q in entry =          11
  In of MODEL   21
    1    H    GLU  60           H        GLU  60  14.425  -8.544 -15.025
    2    HA   GLU  60           HA       GLU  60  13.643  -8.167 -17.736
    3    HB2  GLU  60           HB2      GLU  60  15.812  -7.404 -16.846
    4    HB3  GLU  60           HB3      GLU  60  16.304  -9.078 -16.606
    5    HG2  GLU  60           HG2      GLU  60  16.099  -9.492 -19.032
    6    HG3  GLU  60           HG3      GLU  60  15.602  -7.819 -19.275

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLY  61           H        GLY  61  14.670 -11.024 -15.909
    2    HA3  GLY  61           HA2      GLY  61  14.163 -12.690 -18.305
    3    HA2  GLY  61           HA3      GLY  61  15.202 -13.147 -16.960

  No H/Q in entry =           3
  In of MODEL   21
    1    H    ASP  62           H        ASP  62  12.053 -11.658 -16.601
    2    HA   ASP  62           HA       ASP  62  11.144 -13.551 -14.733
    3    HB2  ASP  62           HB2      ASP  62   8.957 -12.435 -15.018
    4    HB3  ASP  62           HB3      ASP  62  10.274 -11.285 -14.802

  No H/Q in entry =           4
  In of MODEL   21
    1    H    ALA  63           H        ALA  63  11.046 -13.627 -18.227
    2    HA   ALA  63           HA       ALA  63   8.863 -15.520 -18.439
    3    HB3  ALA  63           HB1      ALA  63   9.667 -13.910 -20.255
    4    HB1  ALA  63           HB2      ALA  63   9.365 -15.569 -20.765
    5    HB2  ALA  63           HB3      ALA  63  11.018 -15.019 -20.497

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLY  64           H        GLY  64   9.307 -17.652 -19.571
    2    HA3  GLY  64           HA2      GLY  64  11.191 -19.338 -19.886
    3    HA2  GLY  64           HA3      GLY  64  11.540 -19.005 -18.196

  No H/Q in entry =           3
  In of MODEL   21
    1    H    GLU  65           H        GLU  65   9.252 -19.097 -16.873
    2    HA   GLU  65           HA       GLU  65   8.611 -21.850 -16.844
    3    HB2  GLU  65           HB2      GLU  65   7.314 -19.488 -15.492
    4    HB3  GLU  65           HB3      GLU  65   6.841 -21.162 -15.198
    5    HG2  GLU  65           HG2      GLU  65   9.105 -21.714 -14.472
    6    HG3  GLU  65           HG3      GLU  65   9.653 -20.083 -14.850

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLY  66           H        GLY  66   7.054 -19.101 -18.253
    2    HA3  GLY  66           HA2      GLY  66   5.427 -20.721 -19.978
    3    HA2  GLY  66           HA3      GLY  66   4.496 -19.830 -18.791

  No H/Q in entry =           3
  In of MODEL   21
    1    H    LYS  67           H        LYS  67   3.954 -19.391 -21.354
    2    HA   LYS  67           HA       LYS  67   5.394 -17.537 -22.803
    3    HB2  LYS  67           HB2      LYS  67   2.403 -17.932 -22.694
    4    HB3  LYS  67           HB3      LYS  67   3.272 -17.072 -23.971
    5    HG2  LYS  67           HG2      LYS  67   4.130 -19.849 -23.201
    6    HG3  LYS  67           HG3      LYS  67   2.744 -19.634 -24.267
    7    HD2  LYS  67           HD2      LYS  67   4.163 -18.256 -25.782
    8    HD3  LYS  67           HD3      LYS  67   5.549 -18.589 -24.739
    9    HE2  LYS  67           HE2      LYS  67   5.542 -20.167 -26.608
   10    HE3  LYS  67           HE3      LYS  67   5.206 -21.027 -25.106
   11    HZ2  LYS  67           HZ1      LYS  67   3.717 -21.286 -27.272
   12    HZ1  LYS  67           HZ2      LYS  67   2.907 -19.980 -26.549
   13    HZ3  LYS  67           HZ3      LYS  67   3.089 -21.444 -25.704

  No H/Q in entry =          13
  In of MODEL   21
    1    H    MET  68           H        MET  68   2.339 -16.264 -22.055
    2    HA   MET  68           HA       MET  68   3.230 -13.632 -21.618
    3    HB2  MET  68           HB2      MET  68   0.605 -15.047 -21.316
    4    HB3  MET  68           HB3      MET  68   0.780 -13.365 -20.813
    5    HG2  MET  68           HG2      MET  68   1.552 -14.387 -23.557
    6    HG3  MET  68           HG3      MET  68  -0.002 -13.637 -23.190
    7    HE1  MET  68           HE1      MET  68   3.651 -13.348 -23.862
    8    HE3  MET  68           HE2      MET  68   3.746 -11.687 -24.436
    9    HE2  MET  68           HE3      MET  68   2.636 -12.814 -25.209

  No H/Q in entry =           9
  In of MODEL   21
    1    H    LYS  69           H        LYS  69   2.281 -16.143 -19.269
    2    HA   LYS  69           HA       LYS  69   2.162 -14.394 -17.041
    3    HB2  LYS  69           HB2      LYS  69   2.409 -17.393 -17.234
    4    HB3  LYS  69           HB3      LYS  69   2.208 -16.530 -15.706
    5    HG2  LYS  69           HG2      LYS  69   0.133 -15.506 -16.539
    6    HG3  LYS  69           HG3      LYS  69   0.333 -16.337 -18.081
    7    HD2  LYS  69           HD2      LYS  69   0.230 -18.518 -16.885
    8    HD3  LYS  69           HD3      LYS  69  -0.070 -17.649 -15.378
    9    HE2  LYS  69           HE2      LYS  69  -1.808 -17.517 -17.860
   10    HE3  LYS  69           HE3      LYS  69  -2.189 -18.412 -16.390
   11    HZ2  LYS  69           HZ1      LYS  69  -2.636 -15.700 -16.941
   12    HZ1  LYS  69           HZ2      LYS  69  -1.529 -15.805 -15.657
   13    HZ3  LYS  69           HZ3      LYS  69  -3.041 -16.571 -15.544

  No H/Q in entry =          13
  In of MODEL   21
    1    H    VAL  70           H        VAL  70   3.481 -14.360 -15.098
    2    HA   VAL  70           HA       VAL  70   6.354 -14.924 -15.573
    3    HB   VAL  70           HB       VAL  70   6.843 -12.831 -14.315
    4   HG13  VAL  70          HG11      VAL  70   6.969 -12.629 -16.680
    5   HG12  VAL  70          HG12      VAL  70   5.967 -11.270 -16.168
    6   HG11  VAL  70          HG13      VAL  70   5.216 -12.708 -16.858
    7   HG21  VAL  70          HG21      VAL  70   3.820 -12.544 -14.451
    8   HG23  VAL  70          HG22      VAL  70   4.900 -11.186 -14.135
    9   HG22  VAL  70          HG23      VAL  70   4.832 -12.539 -13.006

  No H/Q in entry =           9
  In of MODEL   21
    1    H    SER  71           H        SER  71   7.568 -14.769 -13.409
    2    HA   SER  71           HA       SER  71   6.637 -16.739 -11.619
    3    HB2  SER  71           HB2      SER  71   9.032 -16.060 -11.901
    4    HB3  SER  71           HB3      SER  71   8.665 -14.562 -11.050
    5    HG   SER  71           HG       SER  71   9.479 -16.328  -9.723

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU  72           H        LEU  72   5.249 -16.636  -9.973
    2    HA   LEU  72           HA       LEU  72   3.656 -14.350  -9.539
    3    HB2  LEU  72           HB2      LEU  72   3.987 -16.901  -7.969
    4    HB3  LEU  72           HB3      LEU  72   2.801 -15.662  -7.562
    5    HG   LEU  72           HG       LEU  72   2.969 -16.958 -10.303
    6   HD11  LEU  72          HD11      LEU  72   2.448 -18.616  -8.505
    7   HD13  LEU  72          HD12      LEU  72   1.097 -18.362  -9.608
    8   HD12  LEU  72          HD13      LEU  72   1.085 -17.607  -8.015
    9   HD22  LEU  72          HD21      LEU  72   1.721 -14.994 -10.571
   10   HD21  LEU  72          HD22      LEU  72   1.067 -15.051  -8.942
   11   HD23  LEU  72          HD23      LEU  72   0.460 -16.154 -10.173

  No H/Q in entry =          11
  In of MODEL   21
    1    H    VAL  73           H        VAL  73   6.334 -15.733  -7.756
    2    HA   VAL  73           HA       VAL  73   6.239 -14.194  -5.428
    3    HB   VAL  73           HB       VAL  73   8.441 -14.956  -4.998
    4   HG13  VAL  73          HG11      VAL  73   8.148 -17.275  -5.225
    5   HG12  VAL  73          HG12      VAL  73   7.383 -17.118  -6.806
    6   HG11  VAL  73          HG13      VAL  73   6.501 -16.660  -5.349
    7   HG21  VAL  73          HG21      VAL  73   8.609 -15.047  -7.993
    8   HG23  VAL  73          HG22      VAL  73   9.629 -16.131  -7.047
    9   HG22  VAL  73          HG23      VAL  73   9.760 -14.386  -6.831

  No H/Q in entry =           9
  In of MODEL   21
    1    H    LEU  74           H        LEU  74   7.221 -13.292  -8.604
    2    HA   LEU  74           HA       LEU  74   9.128 -11.306  -8.112
    3    HB2  LEU  74           HB2      LEU  74   8.694 -12.069 -10.349
    4    HB3  LEU  74           HB3      LEU  74   7.017 -11.534 -10.255
    5    HG   LEU  74           HG       LEU  74   7.776  -9.191 -10.044
    6   HD12  LEU  74          HD11      LEU  74  10.268  -8.843 -10.629
    7   HD11  LEU  74          HD12      LEU  74  10.484 -10.525 -10.149
    8   HD13  LEU  74          HD13      LEU  74   9.893  -9.342  -8.981
    9   HD21  LEU  74          HD21      LEU  74   7.566 -10.636 -12.261
   10   HD23  LEU  74          HD22      LEU  74   9.272 -10.259 -12.353
   11   HD22  LEU  74          HD23      LEU  74   8.104  -8.958 -12.302

  No H/Q in entry =          11
  In of MODEL   21
    1    H    VAL  75           H        VAL  75   5.627 -10.987  -8.476
    2    HA   VAL  75           HA       VAL  75   5.479  -8.231  -7.898
    3    HB   VAL  75           HB       VAL  75   3.428 -10.411  -7.511
    4   HG11  VAL  75          HG11      VAL  75   3.186  -7.374  -7.357
    5   HG13  VAL  75          HG12      VAL  75   2.896  -8.515  -6.051
    6   HG12  VAL  75          HG13      VAL  75   1.817  -8.479  -7.437
    7   HG23  VAL  75          HG21      VAL  75   2.514  -9.426  -9.601
    8   HG22  VAL  75          HG22      VAL  75   4.152 -10.030  -9.836
    9   HG21  VAL  75          HG23      VAL  75   3.868  -8.299  -9.653

  No H/Q in entry =           9
  In of MODEL   21
    1    H    GLU  76           H        GLU  76   5.271 -11.106  -5.781
    2    HA   GLU  76           HA       GLU  76   4.768  -9.747  -3.365
    3    HB2  GLU  76           HB2      GLU  76   4.641 -12.218  -3.596
    4    HB3  GLU  76           HB3      GLU  76   6.380 -12.284  -3.822
    5    HG2  GLU  76           HG2      GLU  76   5.922 -12.868  -1.525
    6    HG3  GLU  76           HG3      GLU  76   6.656 -11.275  -1.516

  No H/Q in entry =           6
  In of MODEL   21
    1    H    ALA  77           H        ALA  77   7.849 -10.603  -4.915
    2    HA   ALA  77           HA       ALA  77   9.513  -9.523  -2.896
    3    HB1  ALA  77           HB1      ALA  77  10.494 -11.006  -4.489
    4    HB2  ALA  77           HB2      ALA  77  11.230  -9.427  -4.761
    5    HB3  ALA  77           HB3      ALA  77   9.966 -10.008  -5.844

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLN  78           H        GLN  78   8.105  -8.139  -5.819
    2    HA   GLN  78           HA       GLN  78   9.413  -5.636  -5.717
    3    HB2  GLN  78           HB2      GLN  78   8.141  -6.577  -7.677
    4    HB3  GLN  78           HB3      GLN  78   6.648  -6.226  -6.809
    5    HG2  GLN  78           HG2      GLN  78   7.256  -3.843  -6.717
    6    HG3  GLN  78           HG3      GLN  78   8.752  -4.188  -7.585
    7   HE21  GLN  78          HE21      GLN  78   6.810  -2.403  -8.690
    8   HE22  GLN  78          HE22      GLN  78   6.133  -3.132 -10.065

  No H/Q in entry =           8
  In of MODEL   21
    1    H    LEU  79           H        LEU  79   6.409  -6.823  -4.295
    2    HA   LEU  79           HA       LEU  79   5.368  -4.431  -3.297
    3    HB2  LEU  79           HB2      LEU  79   4.090  -6.505  -3.240
    4    HB3  LEU  79           HB3      LEU  79   5.244  -7.221  -2.118
    5    HG   LEU  79           HG       LEU  79   4.656  -5.584  -0.398
    6   HD13  LEU  79          HD11      LEU  79   4.159  -3.581  -1.456
    7   HD12  LEU  79          HD12      LEU  79   2.541  -4.134  -1.022
    8   HD11  LEU  79          HD13      LEU  79   3.132  -4.351  -2.668
    9   HD23  LEU  79          HD21      LEU  79   2.078  -6.122  -0.317
   10   HD22  LEU  79          HD22      LEU  79   3.240  -7.440  -0.200
   11   HD21  LEU  79          HD23      LEU  79   2.427  -7.122  -1.729

  No H/Q in entry =          11
  In of MODEL   21
    1    H    HIS  80           H        HIS  80   7.585  -6.723  -1.698
    2    HA   HIS  80           HA       HIS  80   7.836  -5.169   0.667
    3    HB2  HIS  80           HB2      HIS  80   9.221  -7.513  -0.519
    4    HB3  HIS  80           HB3      HIS  80  10.110  -6.597   0.699
    5    HD1  HIS  80           HD1      HIS  80   9.621  -7.235   3.042
    6    HD2  HIS  80           HD2      HIS  80   6.430  -8.148   0.519
    7    HE1  HIS  80           HE1      HIS  80   7.863  -8.365   4.486
    8    HE2  HIS  80           HE2      HIS  80   5.911  -8.925   2.956

  No H/Q in entry =           8
  In of MODEL   21
    1    H    LEU  81           H        LEU  81   9.859  -5.419  -2.236
    2    HA   LEU  81           HA       LEU  81  11.869  -3.640  -1.353
    3    HB2  LEU  81           HB2      LEU  81  10.974  -4.457  -4.118
    4    HB3  LEU  81           HB3      LEU  81  12.375  -3.425  -3.824
    5    HG   LEU  81           HG       LEU  81  12.023  -6.149  -2.545
    6   HD12  LEU  81          HD11      LEU  81  13.857  -6.749  -4.285
    7   HD11  LEU  81          HD12      LEU  81  13.271  -5.338  -5.163
    8   HD13  LEU  81          HD13      LEU  81  12.181  -6.680  -4.826
    9   HD23  LEU  81          HD21      LEU  81  14.646  -5.789  -2.520
   10   HD22  LEU  81          HD22      LEU  81  13.645  -5.042  -1.276
   11   HD21  LEU  81          HD23      LEU  81  14.214  -4.085  -2.643

  No H/Q in entry =          11
  In of MODEL   21
    1    H    MET  82           H        MET  82   8.945  -3.059  -3.305
    2    HA   MET  82           HA       MET  82   9.441  -0.326  -3.811
    3    HB2  MET  82           HB2      MET  82   6.908  -1.962  -3.693
    4    HB3  MET  82           HB3      MET  82   6.880  -0.239  -4.062
    5    HG2  MET  82           HG2      MET  82   8.522  -2.290  -5.584
    6    HG3  MET  82           HG3      MET  82   6.947  -1.695  -6.105
    7    HE3  MET  82           HE1      MET  82   7.343   1.764  -7.285
    8    HE2  MET  82           HE2      MET  82   6.965   1.536  -5.580
    9    HE1  MET  82           HE3      MET  82   6.324   0.412  -6.774

  No H/Q in entry =           9
  In of MODEL   21
    1    H    THR  83           H        THR  83   7.664  -1.946  -1.209
    2    HA   THR  83           HA       THR  83   6.768   0.391   0.106
    3    HB   THR  83           HB       THR  83   6.651  -1.180   2.128
    4    HG1  THR  83           HG1      THR  83   7.441  -3.118   1.907
    5   HG22  THR  83          HG21      THR  83   5.030  -2.777   0.657
    6   HG21  THR  83          HG22      THR  83   5.240  -1.448  -0.478
    7   HG23  THR  83          HG23      THR  83   4.587  -1.138   1.132

  No H/Q in entry =           7
  In of MODEL   21
    1    H    SER  84           H        SER  84   9.624  -1.659   0.646
    2    HA   SER  84           HA       SER  84  10.649  -0.205   2.835
    3    HB2  SER  84           HB2      SER  84  11.942  -2.033   0.821
    4    HB3  SER  84           HB3      SER  84  12.870  -1.261   2.105
    5    HG   SER  84           HG       SER  84  10.622  -2.986   2.359

  No H/Q in entry =           5
  In of MODEL   21
    1    H    MET  85           H        MET  85  11.414   0.058  -0.650
    2    HA   MET  85           HA       MET  85  13.380   2.056  -0.396
    3    HB2  MET  85           HB2      MET  85  13.010   0.760  -2.460
    4    HB3  MET  85           HB3      MET  85  11.474   1.595  -2.698
    5    HG2  MET  85           HG2      MET  85  12.655   3.756  -2.811
    6    HG3  MET  85           HG3      MET  85  14.190   2.933  -2.556
    7    HE3  MET  85           HE1      MET  85  10.929   2.524  -4.822
    8    HE2  MET  85           HE2      MET  85  11.622   3.149  -6.316
    9    HE1  MET  85           HE3      MET  85  11.597   4.163  -4.879

  No H/Q in entry =           9
  In of MODEL   21
    1    H    LEU  86           H        LEU  86   9.887   2.334  -0.922
    2    HA   LEU  86           HA       LEU  86   9.780   5.145  -1.112
    3    HB2  LEU  86           HB2      LEU  86   7.965   3.454  -1.691
    4    HB3  LEU  86           HB3      LEU  86   7.628   3.364   0.037
    5    HG   LEU  86           HG       LEU  86   7.427   5.922  -0.023
    6   HD11  LEU  86          HD11      LEU  86   8.222   5.491  -2.720
    7   HD13  LEU  86          HD12      LEU  86   7.759   7.013  -1.966
    8   HD12  LEU  86          HD13      LEU  86   6.542   6.029  -2.774
    9   HD23  LEU  86          HD21      LEU  86   5.323   4.531  -1.691
   10   HD22  LEU  86          HD22      LEU  86   5.107   5.791  -0.480
   11   HD21  LEU  86          HD23      LEU  86   5.530   4.155   0.020

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ALA  87           H        ALA  87   9.335   2.967   1.638
    2    HA   ALA  87           HA       ALA  87   8.748   4.878   3.600
    3    HB1  ALA  87           HB1      ALA  87   9.600   2.070   3.525
    4    HB3  ALA  87           HB2      ALA  87   8.457   2.868   4.604
    5    HB2  ALA  87           HB3      ALA  87  10.183   2.927   4.955

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ARG  88           H        ARG  88  11.858   3.499   2.637
    2    HA   ARG  88           HA       ARG  88  13.437   4.906   4.473
    3    HB2  ARG  88           HB2      ARG  88  14.143   2.940   3.078
    4    HB3  ARG  88           HB3      ARG  88  14.284   4.031   1.702
    5    HG2  ARG  88           HG2      ARG  88  15.728   5.373   3.651
    6    HG3  ARG  88           HG3      ARG  88  16.073   3.690   4.036
    7    HD2  ARG  88           HD2      ARG  88  17.353   3.408   2.196
    8    HD3  ARG  88           HD3      ARG  88  16.207   4.259   1.156
    9    HE   ARG  88           HE       ARG  88  18.580   5.363   2.210
   10   HH21  ARG  88          HH11      ARG  88  18.892   7.586   2.011
   11   HH22  ARG  88          HH12      ARG  88  17.525   8.636   1.859
   12   HH11  ARG  88          HH21      ARG  88  15.231   6.063   1.916
   13   HH12  ARG  88          HH22      ARG  88  15.451   7.771   1.780

  No H/Q in entry =          13
  In of MODEL   21
    1    H    GLU  89           H        GLU  89  12.465   5.780   1.142
    2    HA   GLU  89           HA       GLU  89  13.976   8.163   0.986
    3    HB2  GLU  89           HB2      GLU  89  12.856   7.099  -0.964
    4    HB3  GLU  89           HB3      GLU  89  11.300   7.618  -0.314
    5    HG2  GLU  89           HG2      GLU  89  11.966   9.966  -0.480
    6    HG3  GLU  89           HG3      GLU  89  13.580   9.499  -1.009

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LEU  90           H        LEU  90  10.650   7.605   2.103
    2    HA   LEU  90           HA       LEU  90  10.090  10.332   2.668
    3    HB2  LEU  90           HB2      LEU  90   8.931   7.743   3.698
    4    HB3  LEU  90           HB3      LEU  90   8.274   9.329   4.113
    5    HG   LEU  90           HG       LEU  90   8.718   8.448   1.249
    6   HD12  LEU  90          HD11      LEU  90   6.189   8.080   1.301
    7   HD11  LEU  90          HD12      LEU  90   6.336   8.077   3.059
    8   HD13  LEU  90          HD13      LEU  90   7.178   6.858   2.101
    9   HD22  LEU  90          HD21      LEU  90   8.388  10.751   1.167
   10   HD21  LEU  90          HD22      LEU  90   7.395  10.772   2.623
   11   HD23  LEU  90          HD23      LEU  90   6.713  10.202   1.100

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  91           H        ILE  91  11.386   7.676   4.603
    2    HA   ILE  91           HA       ILE  91  11.495   9.050   7.068
    3    HB   ILE  91           HB       ILE  91  13.090   6.733   5.958
    4   HG12  ILE  91          HG12      ILE  91  11.062   6.875   8.208
    5   HG13  ILE  91          HG13      ILE  91  10.603   6.582   6.532
    6   HG22  ILE  91          HG21      ILE  91  13.552   6.533   8.601
    7   HG21  ILE  91          HG22      ILE  91  13.449   8.290   8.495
    8   HG23  ILE  91          HG23      ILE  91  14.645   7.418   7.537
    9   HD13  ILE  91          HD11      ILE  91  11.638   4.496   6.471
   10   HD12  ILE  91          HD12      ILE  91  11.037   4.549   8.129
   11   HD11  ILE  91          HD13      ILE  91  12.735   4.888   7.796

  No H/Q in entry =          11
  In of MODEL   21
    1    H    THR  92           H        THR  92  13.726   8.908   4.326
    2    HA   THR  92           HA       THR  92  15.864  10.337   5.490
    3    HB   THR  92           HB       THR  92  14.892  10.189   2.626
    4    HG1  THR  92           HG1      THR  92  15.751   8.306   3.040
    5   HG22  THR  92          HG21      THR  92  17.452  10.919   2.341
    6   HG21  THR  92          HG22      THR  92  17.125  11.739   3.867
    7   HG23  THR  92          HG23      THR  92  16.155  12.107   2.441

  No H/Q in entry =           7
  In of MODEL   21
    1    H    GLU  93           H        GLU  93  12.967  11.441   3.747
    2    HA   GLU  93           HA       GLU  93  13.518  14.211   3.856
    3    HB2  GLU  93           HB2      GLU  93  10.835  12.796   3.862
    4    HB3  GLU  93           HB3      GLU  93  11.098  14.499   3.487
    5    HG2  GLU  93           HG2      GLU  93  12.477  12.274   1.971
    6    HG3  GLU  93           HG3      GLU  93  10.922  12.931   1.476

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LEU  94           H        LEU  94  11.800  12.034   6.066
    2    HA   LEU  94           HA       LEU  94  10.952  13.972   7.933
    3    HB2  LEU  94           HB2      LEU  94  11.574  11.027   8.218
    4    HB3  LEU  94           HB3      LEU  94  10.981  11.998   9.563
    5    HG   LEU  94           HG       LEU  94   9.507  12.019   6.928
    6   HD11  LEU  94          HD11      LEU  94   9.616   9.805   8.939
    7   HD13  LEU  94          HD12      LEU  94   9.323   9.734   7.203
    8   HD12  LEU  94          HD13      LEU  94   8.032  10.234   8.295
    9   HD23  LEU  94          HD21      LEU  94   7.575  12.393   8.520
   10   HD22  LEU  94          HD22      LEU  94   8.794  13.666   8.558
   11   HD21  LEU  94          HD23      LEU  94   8.745  12.452   9.836

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  95           H        ILE  95  13.957  12.089   7.713
    2    HA   ILE  95           HA       ILE  95  15.101  13.036  10.129
    3    HB   ILE  95           HB       ILE  95  16.366  11.979   7.589
    4   HG12  ILE  95          HG12      ILE  95  16.078  10.782  10.359
    5   HG13  ILE  95          HG13      ILE  95  14.921  10.501   9.060
    6   HG21  ILE  95          HG21      ILE  95  17.598  12.813  10.234
    7   HG23  ILE  95          HG22      ILE  95  18.059  13.344   8.615
    8   HG22  ILE  95          HG23      ILE  95  18.389  11.690   9.129
    9   HD13  ILE  95          HD11      ILE  95  16.426   9.243   7.806
   10   HD12  ILE  95          HD12      ILE  95  16.899   8.806   9.445
   11   HD11  ILE  95          HD13      ILE  95  17.837   9.998   8.546

  No H/Q in entry =          11
  In of MODEL   21
    1    H    GLU  96           H        GLU  96  15.249  14.262   6.792
    2    HA   GLU  96           HA       GLU  96  17.061  16.371   7.270
    3    HB2  GLU  96           HB2      GLU  96  16.415  15.692   5.010
    4    HB3  GLU  96           HB3      GLU  96  14.763  16.224   5.303
    5    HG2  GLU  96           HG2      GLU  96  15.298  18.361   4.757
    6    HG3  GLU  96           HG3      GLU  96  16.592  18.385   5.944

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LEU  97           H        LEU  97  13.551  16.130   7.687
    2    HA   LEU  97           HA       LEU  97  13.090  18.859   8.320
    3    HB2  LEU  97           HB2      LEU  97  11.609  16.311   8.935
    4    HB3  LEU  97           HB3      LEU  97  11.069  17.852   9.600
    5    HG   LEU  97           HG       LEU  97  11.570  17.436   6.638
    6   HD12  LEU  97          HD11      LEU  97   9.049  17.268   6.511
    7   HD11  LEU  97          HD12      LEU  97   9.039  17.073   8.262
    8   HD13  LEU  97          HD13      LEU  97   9.843  15.875   7.246
    9   HD23  LEU  97          HD21      LEU  97   9.802  19.373   6.659
   10   HD22  LEU  97          HD22      LEU  97  11.476  19.759   7.056
   11   HD21  LEU  97          HD23      LEU  97  10.285  19.574   8.343

  No H/Q in entry =          11
  In of MODEL   21
    1    H    HIS  98           H        HIS  98  13.948  16.051  10.326
    2    HA   HIS  98           HA       HIS  98  13.761  17.316  12.838
    3    HB2  HIS  98           HB2      HIS  98  15.549  15.084  11.849
    4    HB3  HIS  98           HB3      HIS  98  15.533  15.627  13.529
    5    HD1  HIS  98           HD1      HIS  98  13.369  13.956  10.933
    6    HD2  HIS  98           HD2      HIS  98  13.233  14.885  14.994
    7    HE1  HIS  98           HE1      HIS  98  11.360  12.733  11.881
    8    HE2  HIS  98           HE2      HIS  98  11.257  13.290  14.350

  No H/Q in entry =           8
  In of MODEL   21
    1    H    GLU  99           H        GLU  99  16.325  17.234  10.413
    2    HA   GLU  99           HA       GLU  99  18.284  18.600  11.946
    3    HB2  GLU  99           HB2      GLU  99  18.791  17.315   9.882
    4    HB3  GLU  99           HB3      GLU  99  17.965  18.554   8.935
    5    HG2  GLU  99           HG2      GLU  99  19.545  20.252   9.726
    6    HG3  GLU  99           HG3      GLU  99  20.338  19.064  10.756

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LYS 100           H        LYS 100  15.751  19.718   9.717
    2    HA   LYS 100           HA       LYS 100  16.506  22.467   9.856
    3    HB2  LYS 100           HB2      LYS 100  13.896  21.136   9.096
    4    HB3  LYS 100           HB3      LYS 100  14.169  22.879   9.002
    5    HG2  LYS 100           HG2      LYS 100  16.154  22.457   7.543
    6    HG3  LYS 100           HG3      LYS 100  15.766  20.734   7.564
    7    HD2  LYS 100           HD2      LYS 100  13.567  21.207   6.555
    8    HD3  LYS 100           HD3      LYS 100  13.938  22.932   6.541
    9    HE2  LYS 100           HE2      LYS 100  15.909  22.477   5.090
   10    HE3  LYS 100           HE3      LYS 100  15.470  20.766   5.059
   11    HZ1  LYS 100           HZ1      LYS 100  13.615  22.928   4.212
   12    HZ3  LYS 100           HZ2      LYS 100  13.457  21.256   3.953
   13    HZ2  LYS 100           HZ3      LYS 100  14.657  22.134   3.134

  No H/Q in entry =          13
  In of MODEL   21
    1    H    LEU 101           H        LEU 101  14.433  20.395  11.820
    2    HA   LEU 101           HA       LEU 101  13.230  22.449  13.388
    3    HB2  LEU 101           HB2      LEU 101  13.715  19.508  13.781
    4    HB3  LEU 101           HB3      LEU 101  13.159  20.483  15.138
    5    HG   LEU 101           HG       LEU 101  11.750  20.544  12.463
    6   HD12  LEU 101          HD11      LEU 101  10.109  18.959  13.730
    7   HD11  LEU 101          HD12      LEU 101  11.506  18.569  14.731
    8   HD13  LEU 101          HD13      LEU 101  11.551  18.258  12.995
    9   HD21  LEU 101          HD21      LEU 101  11.071  21.334  15.311
   10   HD23  LEU 101          HD22      LEU 101   9.818  21.087  14.097
   11   HD22  LEU 101          HD23      LEU 101  11.035  22.339  13.860

  No H/Q in entry =          11
  In of MODEL   21
    1    H    LYS 102           H        LYS 102  16.388  21.887  12.964
    2    HA   LYS 102           HA       LYS 102  18.217  22.788  14.041
    3    HB2  LYS 102           HB2      LYS 102  16.377  24.279  15.164
    4    HB3  LYS 102           HB3      LYS 102  16.595  23.223  16.545
    5    HG2  LYS 102           HG2      LYS 102  18.462  25.259  15.377
    6    HG3  LYS 102           HG3      LYS 102  18.078  24.943  17.055
    7    HD2  LYS 102           HD2      LYS 102  19.780  23.051  15.380
    8    HD3  LYS 102           HD3      LYS 102  20.446  24.386  16.312
    9    HE2  LYS 102           HE2      LYS 102  20.082  21.834  17.286
   10    HE3  LYS 102           HE3      LYS 102  20.276  23.282  18.274
   11    HZ2  LYS 102           HZ1      LYS 102  18.324  21.970  18.889
   12    HZ1  LYS 102           HZ2      LYS 102  17.682  22.187  17.337
   13    HZ3  LYS 102           HZ3      LYS 102  17.889  23.522  18.360

  No H/Q in entry =          13
  In of MODEL   21
    1    H    ALA 103           H        ALA 103  16.161  21.159  16.460
    2    HA   ALA 103           HA       ALA 103  17.899  19.978  18.124
    3    HB2  ALA 103           HB1      ALA 103  16.345  17.947  18.118
    4    HB1  ALA 103           HB2      ALA 103  15.441  18.784  16.855
    5    HB3  ALA 103           HB3      ALA 103  15.603  19.511  18.452

  No H/Q in entry =           5
  In of MODEL   21
    1    H1   ALA   1           H3       ALA   1  -1.492  -7.264 -21.499
    2    H2   ALA   1           H2       ALA   1  -2.267  -8.710 -21.045
    3    H3   ALA   1           H1       ALA   1  -0.657  -8.738 -21.594
    4    HA   ALA   1           HA       ALA   1  -1.477  -9.224 -23.592
    5    HB1  ALA   1           HB1      ALA   1  -3.605  -9.971 -23.124
    6    HB2  ALA   1           HB2      ALA   1  -4.062  -8.469 -23.927
    7    HB3  ALA   1           HB3      ALA   1  -4.007  -8.544 -22.168

  No H/Q in entry =           7
  In of MODEL   21
    1    H    GLU   2           H        GLU   2  -2.316  -8.050 -25.587
    2    HA   GLU   2           HA       GLU   2  -0.943  -6.019 -26.464
    3    HB2  GLU   2           HB2      GLU   2  -3.948  -6.129 -26.793
    4    HB3  GLU   2           HB3      GLU   2  -2.835  -5.253 -27.840
    5    HG2  GLU   2           HG2      GLU   2  -2.301  -7.138 -28.989
    6    HG3  GLU   2           HG3      GLU   2  -1.996  -8.036 -27.508

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLU   3           H        GLU   3  -4.124  -4.805 -25.579
    2    HA   GLU   3           HA       GLU   3  -3.116  -2.232 -24.953
    3    HB2  GLU   3           HB2      GLU   3  -5.787  -3.584 -24.628
    4    HB3  GLU   3           HB3      GLU   3  -5.514  -1.964 -23.984
    5    HG2  GLU   3           HG2      GLU   3  -5.163  -1.037 -26.111
    6    HG3  GLU   3           HG3      GLU   3  -4.743  -2.588 -26.830

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LEU   4           H        LEU   4  -4.682  -4.609 -22.774
    2    HA   LEU   4           HA       LEU   4  -4.344  -3.370 -20.384
    3    HB2  LEU   4           HB2      LEU   4  -3.757  -6.304 -20.845
    4    HB3  LEU   4           HB3      LEU   4  -4.180  -5.560 -19.304
    5    HG   LEU   4           HG       LEU   4  -5.942  -5.665 -21.775
    6   HD13  LEU   4          HD11      LEU   4  -7.114  -7.397 -20.777
    7   HD12  LEU   4          HD12      LEU   4  -6.642  -6.926 -19.145
    8   HD11  LEU   4          HD13      LEU   4  -5.490  -7.756 -20.191
    9   HD23  LEU   4          HD21      LEU   4  -7.645  -4.873 -19.915
   10   HD22  LEU   4          HD22      LEU   4  -6.620  -3.689 -20.725
   11   HD21  LEU   4          HD23      LEU   4  -6.192  -4.270 -19.116

  No H/Q in entry =          11
  In of MODEL   21
    1    H    GLU   5           H        GLU   5  -1.813  -5.181 -22.101
    2    HA   GLU   5           HA       GLU   5   0.158  -4.865 -20.058
    3    HB2  GLU   5           HB2      GLU   5   0.258  -6.639 -21.801
    4    HB3  GLU   5           HB3      GLU   5   0.552  -5.395 -23.017
    5    HG2  GLU   5           HG2      GLU   5   2.604  -4.716 -21.858
    6    HG3  GLU   5           HG3      GLU   5   2.309  -5.913 -20.599

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLU   6           H        GLU   6  -0.489  -3.167 -23.109
    2    HA   GLU   6           HA       GLU   6   1.654  -1.305 -22.837
    3    HB2  GLU   6           HB2      GLU   6  -0.902  -1.247 -24.455
    4    HB3  GLU   6           HB3      GLU   6   0.345  -0.005 -24.560
    5    HG2  GLU   6           HG2      GLU   6   1.996  -1.670 -25.242
    6    HG3  GLU   6           HG3      GLU   6   0.811  -2.960 -25.046

  No H/Q in entry =           6
  In of MODEL   21
    1    H    VAL   7           H        VAL   7  -1.687  -1.421 -21.804
    2    HA   VAL   7           HA       VAL   7  -1.950   1.290 -20.975
    3    HB   VAL   7           HB       VAL   7  -3.380  -1.246 -20.139
    4   HG11  VAL   7          HG11      VAL   7  -3.799   1.639 -19.333
    5   HG13  VAL   7          HG12      VAL   7  -3.683   0.218 -18.294
    6   HG12  VAL   7          HG13      VAL   7  -5.115   0.465 -19.292
    7   HG21  VAL   7          HG21      VAL   7  -3.543  -0.177 -22.530
    8   HG23  VAL   7          HG22      VAL   7  -4.509   1.060 -21.724
    9   HG22  VAL   7          HG23      VAL   7  -5.031  -0.625 -21.696

  No H/Q in entry =           9
  In of MODEL   21
    1    H    VAL   8           H        VAL   8  -0.927  -1.677 -19.321
    2    HA   VAL   8           HA       VAL   8  -0.634  -0.587 -16.727
    3    HB   VAL   8           HB       VAL   8   0.798  -2.889 -18.076
    4   HG13  VAL   8          HG11      VAL   8   2.239  -2.334 -16.310
    5   HG12  VAL   8          HG12      VAL   8   1.157  -3.508 -15.560
    6   HG11  VAL   8          HG13      VAL   8   0.919  -1.784 -15.278
    7   HG22  VAL   8          HG21      VAL   8  -0.955  -4.222 -17.376
    8   HG21  VAL   8          HG22      VAL   8  -1.846  -2.703 -17.369
    9   HG23  VAL   8          HG23      VAL   8  -1.162  -3.325 -15.872

  No H/Q in entry =           9
  In of MODEL   21
    1    H    MET   9           H        MET   9   1.629  -0.863 -19.465
    2    HA   MET   9           HA       MET   9   3.896   0.214 -18.198
    3    HB2  MET   9           HB2      MET   9   2.954   0.176 -21.058
    4    HB3  MET   9           HB3      MET   9   4.425   1.034 -20.604
    5    HG2  MET   9           HG2      MET   9   5.118  -1.154 -19.425
    6    HG3  MET   9           HG3      MET   9   3.827  -1.914 -20.356
    7    HE1  MET   9           HE1      MET   9   3.670  -2.300 -22.600
    8    HE3  MET   9           HE2      MET   9   4.799  -1.922 -23.898
    9    HE2  MET   9           HE3      MET   9   3.776  -0.653 -23.230

  No H/Q in entry =           9
  In of MODEL   21
    1    H    GLY  10           H        GLY  10   1.197   1.777 -19.889
    2    HA3  GLY  10           HA2      GLY  10   2.123   4.443 -19.647
    3    HA2  GLY  10           HA3      GLY  10   0.441   3.960 -19.857

  No H/Q in entry =           3
  In of MODEL   21
    1    H    LEU  11           H        LEU  11   0.054   2.433 -17.568
    2    HA   LEU  11           HA       LEU  11  -0.509   4.407 -15.615
    3    HB2  LEU  11           HB2      LEU  11  -0.403   1.392 -15.452
    4    HB3  LEU  11           HB3      LEU  11  -0.930   2.411 -14.114
    5    HG   LEU  11           HG       LEU  11  -2.160   2.503 -16.881
    6   HD13  LEU  11          HD11      LEU  11  -2.719   0.354 -16.124
    7   HD12  LEU  11          HD12      LEU  11  -4.084   1.329 -15.585
    8   HD11  LEU  11          HD13      LEU  11  -2.826   0.868 -14.439
    9   HD22  LEU  11          HD21      LEU  11  -2.781   4.513 -15.881
   10   HD21  LEU  11          HD22      LEU  11  -2.703   3.851 -14.249
   11   HD23  LEU  11          HD23      LEU  11  -4.070   3.465 -15.294

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  12           H        ILE  12   2.066   1.973 -15.844
    2    HA   ILE  12           HA       ILE  12   3.257   2.531 -13.337
    3    HB   ILE  12           HB       ILE  12   4.532   1.502 -15.894
    4   HG12  ILE  12          HG12      ILE  12   2.533   0.246 -14.751
    5   HG13  ILE  12          HG13      ILE  12   3.946  -0.672 -15.230
    6   HG23  ILE  12          HG21      ILE  12   6.264   2.272 -14.382
    7   HG22  ILE  12          HG22      ILE  12   6.224   0.510 -14.311
    8   HG21  ILE  12          HG23      ILE  12   5.497   1.462 -13.017
    9   HD11  ILE  12          HD11      ILE  12   3.465   0.437 -12.452
   10   HD13  ILE  12          HD12      ILE  12   4.760  -0.652 -12.944
   11   HD12  ILE  12          HD13      ILE  12   3.102  -1.210 -12.939

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  13           H        ILE  13   3.852   3.795 -16.595
    2    HA   ILE  13           HA       ILE  13   5.965   5.544 -15.867
    3    HB   ILE  13           HB       ILE  13   3.939   5.598 -18.119
    4   HG12  ILE  13          HG12      ILE  13   5.781   3.771 -17.839
    5   HG13  ILE  13          HG13      ILE  13   5.552   4.520 -19.415
    6   HG23  ILE  13          HG21      ILE  13   4.635   7.880 -17.858
    7   HG22  ILE  13          HG22      ILE  13   5.553   7.234 -19.213
    8   HG21  ILE  13          HG23      ILE  13   6.323   7.416 -17.638
    9   HD11  ILE  13          HD11      ILE  13   7.619   5.474 -17.398
   10   HD13  ILE  13          HD12      ILE  13   7.446   5.978 -19.076
   11   HD12  ILE  13          HD13      ILE  13   7.964   4.338 -18.702

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ASN  14           H        ASN  14   2.453   5.993 -16.147
    2    HA   ASN  14           HA       ASN  14   2.373   8.740 -15.516
    3    HB2  ASN  14           HB2      ASN  14   0.504   7.072 -16.349
    4    HB3  ASN  14           HB3      ASN  14   0.180   6.893 -14.629
    5   HD21  ASN  14          HD21      ASN  14  -1.850   8.020 -16.070
    6   HD22  ASN  14          HD22      ASN  14  -1.935   9.693 -15.806

  No H/Q in entry =           6
  In of MODEL   21
    1    H    SER  15           H        SER  15   2.109   5.864 -13.434
    2    HA   SER  15           HA       SER  15   1.777   7.235 -10.990
    3    HB2  SER  15           HB2      SER  15   2.345   5.159  -9.934
    4    HB3  SER  15           HB3      SER  15   1.534   4.725 -11.435
    5    HG   SER  15           HG       SER  15   3.981   4.091 -10.644

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLY  16           H        GLY  16   4.672   6.173 -12.738
    2    HA3  GLY  16           HA2      GLY  16   6.581   6.958 -10.803
    3    HA2  GLY  16           HA3      GLY  16   6.892   6.756 -12.525

  No H/Q in entry =           3
  In of MODEL   21
    1    H    GLN  17           H        GLN  17   5.180   8.689 -13.597
    2    HA   GLN  17           HA       GLN  17   6.725  11.052 -13.290
    3    HB2  GLN  17           HB2      GLN  17   3.989  10.575 -14.502
    4    HB3  GLN  17           HB3      GLN  17   4.814  12.133 -14.564
    5    HG2  GLN  17           HG2      GLN  17   6.704  11.125 -15.743
    6    HG3  GLN  17           HG3      GLN  17   5.957   9.532 -15.621
    7   HE21  GLN  17          HE21      GLN  17   6.339   9.989 -18.166
    8   HE22  GLN  17          HE22      GLN  17   4.984  10.623 -18.968

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ALA  18           H        ALA  18   3.635   9.995 -11.948
    2    HA   ALA  18           HA       ALA  18   2.873  12.376 -10.689
    3    HB1  ALA  18           HB1      ALA  18   1.778   9.903 -10.909
    4    HB2  ALA  18           HB2      ALA  18   1.209  11.118  -9.767
    5    HB3  ALA  18           HB3      ALA  18   2.316   9.852  -9.231

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ARG  19           H        ARG  19   4.781   9.643  -9.398
    2    HA   ARG  19           HA       ARG  19   5.289  10.813  -6.877
    3    HB2  ARG  19           HB2      ARG  19   5.739   8.415  -7.398
    4    HB3  ARG  19           HB3      ARG  19   7.091   8.918  -8.416
    5    HG2  ARG  19           HG2      ARG  19   8.190   9.978  -6.492
    6    HG3  ARG  19           HG3      ARG  19   6.817   9.573  -5.464
    7    HD2  ARG  19           HD2      ARG  19   8.601   7.964  -5.097
    8    HD3  ARG  19           HD3      ARG  19   7.240   7.160  -5.885
    9    HE   ARG  19           HE       ARG  19   8.939   7.999  -7.929
   10   HH21  ARG  19          HH11      ARG  19  10.523   6.615  -8.772
   11   HH22  ARG  19          HH12      ARG  19  11.084   5.277  -7.831
   12   HH11  ARG  19          HH21      ARG  19   9.032   5.976  -5.146
   13   HH12  ARG  19          HH22      ARG  19  10.237   4.915  -5.778

  No H/Q in entry =          13
  In of MODEL   21
    1    H    SER  20           H        SER  20   7.116  10.863  -9.921
    2    HA   SER  20           HA       SER  20   9.337  12.313  -9.093
    3    HB2  SER  20           HB2      SER  20   8.831  11.271 -11.404
    4    HB3  SER  20           HB3      SER  20   8.032  12.798 -11.760
    5    HG   SER  20           HG       SER  20   9.974  13.857 -11.326

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU  21           H        LEU  21   6.223  13.533 -10.302
    2    HA   LEU  21           HA       LEU  21   6.852  16.289 -10.082
    3    HB2  LEU  21           HB2      LEU  21   4.205  14.825 -10.007
    4    HB3  LEU  21           HB3      LEU  21   4.345  16.581 -10.015
    5    HG   LEU  21           HG       LEU  21   5.574  14.800 -12.139
    6   HD11  LEU  21          HD11      LEU  21   3.088  14.618 -12.085
    7   HD13  LEU  21          HD12      LEU  21   3.674  15.404 -13.551
    8   HD12  LEU  21          HD13      LEU  21   2.980  16.371 -12.251
    9   HD21  LEU  21          HD21      LEU  21   5.303  17.770 -11.719
   10   HD23  LEU  21          HD22      LEU  21   5.316  17.151 -13.368
   11   HD22  LEU  21          HD23      LEU  21   6.693  16.865 -12.315

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ALA  22           H        ALA  22   5.368  13.981  -7.833
    2    HA   ALA  22           HA       ALA  22   4.730  15.784  -5.772
    3    HB3  ALA  22           HB1      ALA  22   4.007  13.380  -5.932
    4    HB2  ALA  22           HB2      ALA  22   4.583  13.865  -4.337
    5    HB1  ALA  22           HB3      ALA  22   5.624  12.920  -5.403

  No H/Q in entry =           5
  In of MODEL   21
    1    H    TYR  23           H        TYR  23   7.697  13.804  -6.197
    2    HA   TYR  23           HA       TYR  23   9.057  14.850  -3.943
    3    HB2  TYR  23           HB2      TYR  23   9.880  12.852  -5.093
    4    HB3  TYR  23           HB3      TYR  23  10.180  13.791  -6.555
    5    HD1  TYR  23           HD1      TYR  23  11.140  13.490  -2.958
    6    HD2  TYR  23           HD2      TYR  23  12.199  14.986  -6.844
    7    HE1  TYR  23           HE1      TYR  23  13.387  14.108  -2.108
    8    HE2  TYR  23           HE2      TYR  23  14.445  15.605  -5.993
    9    HH   TYR  23           HH       TYR  23  15.366  14.968  -2.603

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ALA  24           H        ALA  24   8.867  15.946  -7.312
    2    HA   ALA  24           HA       ALA  24  10.727  18.062  -7.065
    3    HB2  ALA  24           HB1      ALA  24  10.291  18.112  -9.275
    4    HB3  ALA  24           HB2      ALA  24   8.722  18.837  -8.922
    5    HB1  ALA  24           HB3      ALA  24   8.877  17.086  -9.048

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA  25           H        ALA  25   7.250  17.822  -6.454
    2    HA   ALA  25           HA       ALA  25   6.723  20.533  -5.893
    3    HB1  ALA  25           HB1      ALA  25   5.096  18.507  -6.094
    4    HB2  ALA  25           HB2      ALA  25   4.704  19.791  -4.950
    5    HB3  ALA  25           HB3      ALA  25   5.417  18.284  -4.373

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU  26           H        LEU  26   7.830  17.876  -3.833
    2    HA   LEU  26           HA       LEU  26   7.904  19.315  -1.399
    3    HB2  LEU  26           HB2      LEU  26   8.040  16.900  -1.388
    4    HB3  LEU  26           HB3      LEU  26   9.513  16.931  -2.354
    5    HG   LEU  26           HG       LEU  26  10.703  18.074  -0.513
    6   HD12  LEU  26          HD11      LEU  26   9.469  18.066   1.743
    7   HD11  LEU  26          HD12      LEU  26   7.987  17.900   0.804
    8   HD13  LEU  26          HD13      LEU  26   9.008  19.323   0.595
    9   HD21  LEU  26          HD21      LEU  26   9.209  15.582   0.362
   10   HD23  LEU  26          HD22      LEU  26  10.712  16.172   1.062
   11   HD22  LEU  26          HD23      LEU  26  10.682  15.608  -0.607

  No H/Q in entry =          11
  In of MODEL   21
    1    H    LYS  27           H        LYS  27  10.337  18.778  -3.915
    2    HA   LYS  27           HA       LYS  27  12.496  20.060  -2.684
    3    HB2  LYS  27           HB2      LYS  27  12.627  18.710  -4.770
    4    HB3  LYS  27           HB3      LYS  27  11.841  20.026  -5.641
    5    HG2  LYS  27           HG2      LYS  27  13.679  21.545  -5.062
    6    HG3  LYS  27           HG3      LYS  27  14.459  20.269  -4.120
    7    HD2  LYS  27           HD2      LYS  27  14.633  18.879  -6.170
    8    HD3  LYS  27           HD3      LYS  27  13.897  20.182  -7.104
    9    HE2  LYS  27           HE2      LYS  27  15.757  21.683  -6.489
   10    HE3  LYS  27           HE3      LYS  27  16.496  20.384  -5.546
   11    HZ3  LYS  27           HZ1      LYS  27  17.491  20.496  -7.730
   12    HZ2  LYS  27           HZ2      LYS  27  15.969  20.349  -8.475
   13    HZ1  LYS  27           HZ3      LYS  27  16.612  19.052  -7.585

  No H/Q in entry =          13
  In of MODEL   21
    1    H    GLN  28           H        GLN  28   9.855  21.390  -4.644
    2    HA   GLN  28           HA       GLN  28  10.767  24.059  -4.801
    3    HB2  GLN  28           HB2      GLN  28   7.951  22.942  -4.691
    4    HB3  GLN  28           HB3      GLN  28   8.341  24.618  -5.078
    5    HG2  GLN  28           HG2      GLN  28   9.371  22.207  -6.601
    6    HG3  GLN  28           HG3      GLN  28   8.029  23.226  -7.118
    7   HE21  GLN  28          HE21      GLN  28  11.200  22.759  -7.790
    8   HE22  GLN  28          HE22      GLN  28  11.661  24.345  -8.186

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ALA  29           H        ALA  29   8.859  22.338  -2.366
    2    HA   ALA  29           HA       ALA  29   8.265  24.524  -0.691
    3    HB2  ALA  29           HB1      ALA  29   7.560  22.946   0.879
    4    HB1  ALA  29           HB2      ALA  29   8.804  21.783   0.420
    5    HB3  ALA  29           HB3      ALA  29   7.416  22.049  -0.633

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LYS  30           H        LYS  30  11.036  22.306  -0.747
    2    HA   LYS  30           HA       LYS  30  12.330  23.290   1.557
    3    HB2  LYS  30           HB2      LYS  30  13.457  22.018  -0.947
    4    HB3  LYS  30           HB3      LYS  30  14.428  22.399   0.477
    5    HG2  LYS  30           HG2      LYS  30  12.897  20.991   1.855
    6    HG3  LYS  30           HG3      LYS  30  12.024  20.549   0.384
    7    HD2  LYS  30           HD2      LYS  30  14.089  19.598  -0.569
    8    HD3  LYS  30           HD3      LYS  30  14.981  20.054   0.885
    9    HE2  LYS  30           HE2      LYS  30  13.499  18.599   2.238
   10    HE3  LYS  30           HE3      LYS  30  12.637  18.124   0.769
   11    HZ2  LYS  30           HZ1      LYS  30  14.455  16.580   1.539
   12    HZ1  LYS  30           HZ2      LYS  30  15.572  17.787   1.088
   13    HZ3  LYS  30           HZ3      LYS  30  14.552  17.081  -0.078

  No H/Q in entry =          13
  In of MODEL   21
    1    H    GLN  31           H        GLN  31  12.208  24.484  -1.743
    2    HA   GLN  31           HA       GLN  31  14.325  26.418  -1.320
    3    HB2  GLN  31           HB2      GLN  31  12.287  26.422  -3.550
    4    HB3  GLN  31           HB3      GLN  31  13.894  27.147  -3.548
    5    HG2  GLN  31           HG2      GLN  31  14.404  24.461  -2.965
    6    HG3  GLN  31           HG3      GLN  31  13.105  24.380  -4.147
    7   HE21  GLN  31          HE21      GLN  31  15.964  23.639  -4.541
    8   HE22  GLN  31          HE22      GLN  31  16.522  24.619  -5.808

  No H/Q in entry =           8
  In of MODEL   21
    1    H    GLY  32           H        GLY  32  11.251  26.182  -0.183
    2    HA3  GLY  32           HA2      GLY  32  10.062  27.732   1.083
    3    HA2  GLY  32           HA3      GLY  32  11.166  28.986   0.533

  No H/Q in entry =           3
  In of MODEL   21
    1    H    ASP  33           H        ASP  33   9.844  27.051  -1.958
    2    HA   ASP  33           HA       ASP  33   8.141  29.291  -2.824
    3    HB2  ASP  33           HB2      ASP  33   9.283  26.889  -4.257
    4    HB3  ASP  33           HB3      ASP  33   8.113  27.981  -4.994

  No H/Q in entry =           4
  In of MODEL   21
    1    H    PHE  34           H        PHE  34   6.457  28.788  -1.264
    2    HA   PHE  34           HA       PHE  34   5.123  26.291  -1.166
    3    HB2  PHE  34           HB2      PHE  34   4.109  29.062  -0.496
    4    HB3  PHE  34           HB3      PHE  34   3.287  27.557  -0.083
    5    HD1  PHE  34           HD1      PHE  34   5.488  29.999   1.131
    6    HD2  PHE  34           HD2      PHE  34   4.887  25.746   1.087
    7    HE1  PHE  34           HE1      PHE  34   6.878  29.780   3.173
    8    HE2  PHE  34           HE2      PHE  34   6.278  25.531   3.126
    9    HZ   PHE  34           HZ       PHE  34   7.268  27.548   4.168

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ALA  35           H        ALA  35   4.646  29.141  -3.185
    2    HA   ALA  35           HA       ALA  35   2.109  28.478  -4.216
    3    HB3  ALA  35           HB1      ALA  35   3.141  29.884  -6.254
    4    HB2  ALA  35           HB2      ALA  35   4.348  30.271  -5.028
    5    HB1  ALA  35           HB3      ALA  35   2.649  30.649  -4.743

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA  36           H        ALA  36   5.353  27.861  -5.560
    2    HA   ALA  36           HA       ALA  36   4.397  26.408  -7.802
    3    HB3  ALA  36           HB1      ALA  36   6.555  26.571  -8.412
    4    HB2  ALA  36           HB2      ALA  36   7.052  25.555  -7.058
    5    HB1  ALA  36           HB3      ALA  36   6.913  27.301  -6.847

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA  37           H        ALA  37   5.362  25.440  -4.542
    2    HA   ALA  37           HA       ALA  37   5.357  22.650  -4.965
    3    HB2  ALA  37           HB1      ALA  37   5.056  24.442  -2.591
    4    HB1  ALA  37           HB2      ALA  37   6.214  23.144  -2.877
    5    HB3  ALA  37           HB3      ALA  37   4.558  22.761  -2.410

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LYS  38           H        LYS  38   2.780  24.813  -3.809
    2    HA   LYS  38           HA       LYS  38   0.714  22.962  -3.588
    3    HB2  LYS  38           HB2      LYS  38   1.014  25.725  -3.343
    4    HB3  LYS  38           HB3      LYS  38  -0.179  25.552  -4.625
    5    HG2  LYS  38           HG2      LYS  38  -1.608  24.206  -3.183
    6    HG3  LYS  38           HG3      LYS  38  -0.366  24.172  -1.923
    7    HD2  LYS  38           HD2      LYS  38  -0.597  26.506  -1.482
    8    HD3  LYS  38           HD3      LYS  38  -1.510  26.774  -2.967
    9    HE2  LYS  38           HE2      LYS  38  -3.019  26.785  -1.032
   10    HE3  LYS  38           HE3      LYS  38  -3.365  25.399  -2.072
   11    HZ3  LYS  38           HZ1      LYS  38  -2.616  23.946  -0.533
   12    HZ2  LYS  38           HZ2      LYS  38  -2.993  25.199   0.552
   13    HZ1  LYS  38           HZ3      LYS  38  -1.393  24.977   0.032

  No H/Q in entry =          13
  In of MODEL   21
    1    H    ALA  39           H        ALA  39   1.666  24.875  -6.439
    2    HA   ALA  39           HA       ALA  39  -0.388  23.965  -8.145
    3    HB2  ALA  39           HB1      ALA  39   2.339  24.662  -9.193
    4    HB1  ALA  39           HB2      ALA  39   1.346  25.907  -8.433
    5    HB3  ALA  39           HB3      ALA  39   0.754  25.055  -9.859

  No H/Q in entry =           5
  In of MODEL   21
    1    H    MET  40           H        MET  40   2.872  22.729  -7.553
    2    HA   MET  40           HA       MET  40   2.817  20.702  -9.540
    3    HB2  MET  40           HB2      MET  40   4.417  20.962  -6.987
    4    HB3  MET  40           HB3      MET  40   4.695  19.708  -8.198
    5    HG2  MET  40           HG2      MET  40   4.699  22.663  -8.871
    6    HG3  MET  40           HG3      MET  40   6.160  21.789  -8.415
    7    HE3  MET  40           HE1      MET  40   7.082  19.583 -11.216
    8    HE2  MET  40           HE2      MET  40   6.520  19.257  -9.579
    9    HE1  MET  40           HE3      MET  40   7.591  20.624  -9.879

  No H/Q in entry =           9
  In of MODEL   21
    1    H    MET  41           H        MET  41   1.892  20.735  -6.119
    2    HA   MET  41           HA       MET  41   1.411  17.962  -5.835
    3    HB2  MET  41           HB2      MET  41   0.030  20.297  -4.494
    4    HB3  MET  41           HB3      MET  41  -0.095  18.618  -3.982
    5    HG2  MET  41           HG2      MET  41   2.611  18.892  -4.012
    6    HG3  MET  41           HG3      MET  41   2.138  20.543  -3.622
    7    HE2  MET  41           HE1      MET  41  -0.883  19.237  -1.902
    8    HE1  MET  41           HE2      MET  41  -0.094  20.764  -2.281
    9    HE3  MET  41           HE3      MET  41  -0.147  20.197  -0.612

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ASP  42           H        ASP  42  -0.676  20.645  -6.822
    2    HA   ASP  42           HA       ASP  42  -3.090  19.238  -6.962
    3    HB2  ASP  42           HB2      ASP  42  -2.431  21.820  -7.223
    4    HB3  ASP  42           HB3      ASP  42  -2.570  21.419  -8.931

  No H/Q in entry =           4
  In of MODEL   21
    1    H    GLN  43           H        GLN  43  -0.654  19.869  -9.459
    2    HA   GLN  43           HA       GLN  43  -2.009  18.518 -11.548
    3    HB2  GLN  43           HB2      GLN  43   0.938  19.092 -11.160
    4    HB3  GLN  43           HB3      GLN  43   0.240  18.435 -12.642
    5    HG2  GLN  43           HG2      GLN  43  -1.310  20.433 -12.693
    6    HG3  GLN  43           HG3      GLN  43  -0.373  21.110 -11.364
    7   HE21  GLN  43          HE21      GLN  43  -0.237  22.728 -13.454
    8   HE22  GLN  43          HE22      GLN  43   1.185  22.532 -14.357

  No H/Q in entry =           8
  In of MODEL   21
    1    H    SER  44           H        SER  44   0.356  17.429  -9.148
    2    HA   SER  44           HA       SER  44   0.744  14.827 -10.166
    3    HB2  SER  44           HB2      SER  44   1.605  16.289  -7.931
    4    HB3  SER  44           HB3      SER  44   0.767  14.890  -7.259
    5    HG   SER  44           HG       SER  44   2.891  14.310  -7.678

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ARG  45           H        ARG  45  -1.608  16.106  -7.838
    2    HA   ARG  45           HA       ARG  45  -2.950  13.720  -7.201
    3    HB2  ARG  45           HB2      ARG  45  -3.194  15.887  -6.015
    4    HB3  ARG  45           HB3      ARG  45  -4.059  16.534  -7.406
    5    HG2  ARG  45           HG2      ARG  45  -5.792  14.775  -7.124
    6    HG3  ARG  45           HG3      ARG  45  -4.940  14.183  -5.697
    7    HD2  ARG  45           HD2      ARG  45  -5.193  16.448  -4.647
    8    HD3  ARG  45           HD3      ARG  45  -6.186  16.945  -6.033
    9    HE   ARG  45           HE       ARG  45  -7.253  14.550  -4.990
   10   HH21  ARG  45          HH11      ARG  45  -9.093  14.592  -3.725
   11   HH22  ARG  45          HH12      ARG  45  -9.519  16.026  -2.861
   12   HH11  ARG  45          HH21      ARG  45  -6.774  17.809  -3.973
   13   HH12  ARG  45          HH22      ARG  45  -8.200  17.848  -3.000

  No H/Q in entry =          13
  In of MODEL   21
    1    H    MET  46           H        MET  46  -3.574  16.106  -9.759
    2    HA   MET  46           HA       MET  46  -5.886  14.886 -10.825
    3    HB2  MET  46           HB2      MET  46  -3.818  16.752 -11.995
    4    HB3  MET  46           HB3      MET  46  -5.183  16.164 -12.950
    5    HG2  MET  46           HG2      MET  46  -6.756  17.069 -11.311
    6    HG3  MET  46           HG3      MET  46  -5.427  17.591 -10.284
    7    HE2  MET  46           HE1      MET  46  -7.110  19.232 -14.104
    8    HE1  MET  46           HE2      MET  46  -7.086  17.572 -13.519
    9    HE3  MET  46           HE3      MET  46  -5.743  18.178 -14.487

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ALA  47           H        ALA  47  -2.446  14.473 -11.571
    2    HA   ALA  47           HA       ALA  47  -2.751  12.733 -13.778
    3    HB3  ALA  47           HB1      ALA  47  -0.592  13.667 -13.423
    4    HB2  ALA  47           HB2      ALA  47  -0.418  11.942 -13.084
    5    HB1  ALA  47           HB3      ALA  47  -0.537  13.096 -11.754

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU  48           H        LEU  48  -2.479  12.112 -10.302
    2    HA   LEU  48           HA       LEU  48  -2.516   9.270 -10.454
    3    HB2  LEU  48           HB2      LEU  48  -3.325  11.178  -8.247
    4    HB3  LEU  48           HB3      LEU  48  -3.196   9.430  -8.042
    5    HG   LEU  48           HG       LEU  48  -0.929  11.173  -9.036
    6   HD13  LEU  48          HD11      LEU  48  -1.233  11.942  -6.849
    7   HD12  LEU  48          HD12      LEU  48  -0.045  10.659  -6.643
    8   HD11  LEU  48          HD13      LEU  48  -1.739  10.363  -6.250
    9   HD22  LEU  48          HD21      LEU  48  -0.384   8.996  -9.670
   10   HD21  LEU  48          HD22      LEU  48  -1.244   8.267  -8.315
   11   HD23  LEU  48          HD23      LEU  48   0.313   9.052  -8.052

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ASN  49           H        ASN  49  -5.030  11.713 -10.066
    2    HA   ASN  49           HA       ASN  49  -7.183  10.006  -9.529
    3    HB2  ASN  49           HB2      ASN  49  -7.294  12.426  -9.209
    4    HB3  ASN  49           HB3      ASN  49  -7.125  12.689 -10.940
    5   HD21  ASN  49          HD21      ASN  49  -9.339  13.820  -9.893
    6   HD22  ASN  49          HD22      ASN  49 -10.734  12.920 -10.239

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLU  50           H        GLU  50  -5.919  11.221 -12.615
    2    HA   GLU  50           HA       GLU  50  -7.842   9.922 -14.264
    3    HB2  GLU  50           HB2      GLU  50  -6.411  11.768 -15.078
    4    HB3  GLU  50           HB3      GLU  50  -4.996  10.725 -14.933
    5    HG2  GLU  50           HG2      GLU  50  -5.933   9.166 -16.569
    6    HG3  GLU  50           HG3      GLU  50  -7.413  10.114 -16.663

  No H/Q in entry =           6
  In of MODEL   21
    1    H    ALA  51           H        ALA  51  -4.656   8.997 -13.046
    2    HA   ALA  51           HA       ALA  51  -4.463   6.544 -14.457
    3    HB2  ALA  51           HB1      ALA  51  -2.480   6.298 -13.350
    4    HB1  ALA  51           HB2      ALA  51  -3.181   6.711 -11.786
    5    HB3  ALA  51           HB3      ALA  51  -2.748   7.988 -12.922

  No H/Q in entry =           5
  In of MODEL   21
    1    H    HIS  52           H        HIS  52  -5.662   7.360 -11.214
    2    HA   HIS  52           HA       HIS  52  -6.298   4.739 -10.378
    3    HB2  HIS  52           HB2      HIS  52  -6.204   6.677  -8.854
    4    HB3  HIS  52           HB3      HIS  52  -7.641   7.347  -9.627
    5    HD1  HIS  52           HD1      HIS  52  -9.856   5.800  -9.466
    6    HD2  HIS  52           HD2      HIS  52  -6.751   4.808  -6.868
    7    HE1  HIS  52           HE1      HIS  52 -10.865   4.318  -7.677
    8    HE2  HIS  52           HE2      HIS  52  -8.984   3.704  -6.084

  No H/Q in entry =           8
  In of MODEL   21
    1    H    LEU  53           H        LEU  53  -8.161   7.156 -12.178
    2    HA   LEU  53           HA       LEU  53 -10.640   5.815 -12.195
    3    HB2  LEU  53           HB2      LEU  53  -9.388   7.822 -14.055
    4    HB3  LEU  53           HB3      LEU  53 -10.965   7.117 -14.400
    5    HG   LEU  53           HG       LEU  53 -10.325   8.439 -11.744
    6   HD12  LEU  53          HD11      LEU  53 -11.713  10.355 -12.761
    7   HD11  LEU  53          HD12      LEU  53 -11.364   9.615 -14.325
    8   HD13  LEU  53          HD13      LEU  53 -10.049  10.202 -13.311
    9   HD23  LEU  53          HD21      LEU  53 -12.918   8.781 -11.940
   10   HD22  LEU  53          HD22      LEU  53 -12.304   7.200 -11.473
   11   HD21  LEU  53          HD23      LEU  53 -12.842   7.477 -13.118

  No H/Q in entry =          11
  In of MODEL   21
    1    H    VAL  54           H        VAL  54  -7.879   5.666 -14.423
    2    HA   VAL  54           HA       VAL  54  -9.061   3.867 -16.266
    3    HB   VAL  54           HB       VAL  54  -6.166   4.431 -15.575
    4   HG12  VAL  54          HG11      VAL  54  -5.890   3.345 -17.960
    5   HG11  VAL  54          HG12      VAL  54  -7.404   2.536 -17.560
    6   HG13  VAL  54          HG13      VAL  54  -5.987   2.312 -16.536
    7   HG22  VAL  54          HG21      VAL  54  -6.970   6.357 -16.627
    8   HG21  VAL  54          HG22      VAL  54  -8.143   5.468 -17.597
    9   HG23  VAL  54          HG23      VAL  54  -6.434   5.420 -18.021

  No H/Q in entry =           9
  In of MODEL   21
    1    H    GLN  55           H        GLN  55  -7.062   3.367 -13.358
    2    HA   GLN  55           HA       GLN  55  -6.917   0.552 -13.607
    3    HB2  GLN  55           HB2      GLN  55  -5.384   1.481 -12.085
    4    HB3  GLN  55           HB3      GLN  55  -6.621   2.426 -11.261
    5    HG2  GLN  55           HG2      GLN  55  -7.280   0.659  -9.942
    6    HG3  GLN  55           HG3      GLN  55  -7.029  -0.527 -11.216
    7   HE21  GLN  55          HE21      GLN  55  -5.379  -1.944 -10.713
    8   HE22  GLN  55          HE22      GLN  55  -4.005  -1.563  -9.797

  No H/Q in entry =           8
  In of MODEL   21
    1    H    THR  56           H        THR  56  -9.294   2.673 -12.006
    2    HA   THR  56           HA       THR  56 -10.847   0.763 -10.717
    3    HB   THR  56           HB       THR  56 -11.982   3.127 -12.233
    4    HG1  THR  56           HG1      THR  56 -10.645   2.954  -9.746
    5   HG22  THR  56          HG21      THR  56 -12.870   2.043  -9.571
    6   HG21  THR  56          HG22      THR  56 -13.442   1.314 -11.071
    7   HG23  THR  56          HG23      THR  56 -13.780   3.011 -10.728

  No H/Q in entry =           7
  In of MODEL   21
    1    H    LYS  57           H        LYS  57 -11.057   1.833 -14.106
    2    HA   LYS  57           HA       LYS  57 -13.178   0.103 -14.863
    3    HB2  LYS  57           HB2      LYS  57 -12.341   2.065 -16.184
    4    HB3  LYS  57           HB3      LYS  57 -10.876   1.160 -16.538
    5    HG2  LYS  57           HG2      LYS  57 -12.182  -0.553 -17.704
    6    HG3  LYS  57           HG3      LYS  57 -13.677   0.288 -17.308
    7    HD2  LYS  57           HD2      LYS  57 -12.907   2.254 -18.609
    8    HD3  LYS  57           HD3      LYS  57 -11.430   1.389 -19.032
    9    HE2  LYS  57           HE2      LYS  57 -12.746  -0.345 -20.182
   10    HE3  LYS  57           HE3      LYS  57 -14.248   0.460 -19.729
   11    HZ1  LYS  57           HZ1      LYS  57 -12.632   2.370 -20.925
   12    HZ3  LYS  57           HZ2      LYS  57 -14.059   1.681 -21.539
   13    HZ2  LYS  57           HZ3      LYS  57 -12.550   0.992 -21.911

  No H/Q in entry =          13
  In of MODEL   21
    1    H    LEU  58           H        LEU  58  -9.667  -0.261 -14.792
    2    HA   LEU  58           HA       LEU  58  -9.622  -2.781 -16.074
    3    HB2  LEU  58           HB2      LEU  58  -7.619  -1.446 -14.262
    4    HB3  LEU  58           HB3      LEU  58  -7.327  -2.964 -15.111
    5    HG   LEU  58           HG       LEU  58  -8.125  -0.379 -16.484
    6   HD11  LEU  58          HD11      LEU  58  -5.458  -1.563 -15.780
    7   HD13  LEU  58          HD12      LEU  58  -5.985   0.119 -15.738
    8   HD12  LEU  58          HD13      LEU  58  -5.626  -0.650 -17.281
    9   HD22  LEU  58          HD21      LEU  58  -8.665  -1.956 -18.073
   10   HD21  LEU  58          HD22      LEU  58  -7.603  -3.181 -17.384
   11   HD23  LEU  58          HD23      LEU  58  -6.933  -1.898 -18.390

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  59           H        ILE  59 -10.473  -1.885 -12.829
    2    HA   ILE  59           HA       ILE  59 -10.072  -4.642 -11.871
    3    HB   ILE  59           HB       ILE  59  -9.668  -2.374 -10.475
    4   HG12  ILE  59          HG12      ILE  59 -11.034  -4.723  -9.147
    5   HG13  ILE  59          HG13      ILE  59  -9.389  -4.803  -9.724
    6   HG21  ILE  59          HG21      ILE  59 -12.245  -1.940 -10.768
    7   HG23  ILE  59          HG22      ILE  59 -11.499  -1.636  -9.216
    8   HG22  ILE  59          HG23      ILE  59 -12.409  -3.119  -9.489
    9   HD12  ILE  59          HD11      ILE  59  -9.598  -4.176  -7.302
   10   HD11  ILE  59          HD12      ILE  59 -10.362  -2.678  -7.821
   11   HD13  ILE  59          HD13      ILE  59  -8.689  -3.018  -8.268

  No H/Q in entry =          11
  In of MODEL   21
    1    H    GLU  60           H        GLU  60 -12.671  -2.379 -12.696
    2    HA   GLU  60           HA       GLU  60 -14.830  -3.934 -11.687
    3    HB2  GLU  60           HB2      GLU  60 -15.072  -1.563 -12.298
    4    HB3  GLU  60           HB3      GLU  60 -14.763  -1.957 -13.985
    5    HG2  GLU  60           HG2      GLU  60 -16.777  -3.403 -14.007
    6    HG3  GLU  60           HG3      GLU  60 -17.100  -2.961 -12.343

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLY  61           H        GLY  61 -13.145  -3.896 -14.795
    2    HA3  GLY  61           HA2      GLY  61 -14.811  -6.176 -15.685
    3    HA2  GLY  61           HA3      GLY  61 -13.984  -5.058 -16.763

  No H/Q in entry =           3
  In of MODEL   21
    1    H    ASP  62           H        ASP  62 -12.594  -6.473 -13.869
    2    HA   ASP  62           HA       ASP  62 -10.233  -7.282 -15.181
    3    HB2  ASP  62           HB2      ASP  62  -9.739  -8.412 -13.029
    4    HB3  ASP  62           HB3      ASP  62 -10.299  -6.758 -12.802

  No H/Q in entry =           4
  In of MODEL   21
    1    H    ALA  63           H        ALA  63 -13.299  -8.927 -14.833
    2    HA   ALA  63           HA       ALA  63 -12.276 -11.610 -15.256
    3    HB2  ALA  63           HB1      ALA  63 -14.506 -10.913 -14.144
    4    HB1  ALA  63           HB2      ALA  63 -14.573 -12.257 -15.281
    5    HB3  ALA  63           HB3      ALA  63 -15.098 -10.649 -15.783

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLY  64           H        GLY  64 -13.154 -12.875 -17.152
    2    HA3  GLY  64           HA2      GLY  64 -13.980 -12.519 -19.531
    3    HA2  GLY  64           HA3      GLY  64 -12.670 -11.350 -19.630

  No H/Q in entry =           3
  In of MODEL   21
    1    H    GLU  65           H        GLU  65 -10.514 -12.472 -18.611
    2    HA   GLU  65           HA       GLU  65  -9.754 -14.374 -20.551
    3    HB2  GLU  65           HB2      GLU  65  -8.413 -13.485 -18.000
    4    HB3  GLU  65           HB3      GLU  65  -7.667 -14.586 -19.160
    5    HG2  GLU  65           HG2      GLU  65  -7.865 -12.910 -20.929
    6    HG3  GLU  65           HG3      GLU  65  -8.693 -11.813 -19.824

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLY  66           H        GLY  66 -10.815 -14.692 -17.270
    2    HA3  GLY  66           HA2      GLY  66 -11.422 -17.481 -17.578
    3    HA2  GLY  66           HA3      GLY  66 -10.108 -17.183 -16.457

  No H/Q in entry =           3
  In of MODEL   21
    1    H    LYS  67           H        LYS  67 -12.248 -18.467 -15.538
    2    HA   LYS  67           HA       LYS  67 -14.433 -17.073 -14.597
    3    HB2  LYS  67           HB2      LYS  67 -13.018 -19.423 -13.338
    4    HB3  LYS  67           HB3      LYS  67 -14.660 -18.893 -12.951
    5    HG2  LYS  67           HG2      LYS  67 -13.897 -19.379 -15.817
    6    HG3  LYS  67           HG3      LYS  67 -14.300 -20.749 -14.783
    7    HD2  LYS  67           HD2      LYS  67 -16.468 -19.648 -14.229
    8    HD3  LYS  67           HD3      LYS  67 -16.066 -18.354 -15.361
    9    HE2  LYS  67           HE2      LYS  67 -17.486 -20.005 -16.483
   10    HE3  LYS  67           HE3      LYS  67 -15.865 -20.044 -17.180
   11    HZ2  LYS  67           HZ1      LYS  67 -17.112 -22.220 -16.398
   12    HZ1  LYS  67           HZ2      LYS  67 -16.388 -21.808 -14.917
   13    HZ3  LYS  67           HZ3      LYS  67 -15.427 -22.062 -16.294

  No H/Q in entry =          13
  In of MODEL   21
    1    H    MET  68           H        MET  68 -12.680 -18.321 -11.977
    2    HA   MET  68           HA       MET  68 -13.080 -16.102 -10.295
    3    HB2  MET  68           HB2      MET  68 -11.486 -18.630 -10.099
    4    HB3  MET  68           HB3      MET  68 -11.380 -17.404  -8.836
    5    HG2  MET  68           HG2      MET  68 -13.993 -18.569  -9.831
    6    HG3  MET  68           HG3      MET  68 -13.133 -19.159  -8.407
    7    HE1  MET  68           HE1      MET  68 -15.288 -16.601 -10.062
    8    HE3  MET  68           HE2      MET  68 -16.111 -15.910  -8.664
    9    HE2  MET  68           HE3      MET  68 -16.174 -17.649  -8.944

  No H/Q in entry =           9
  In of MODEL   21
    1    H    LYS  69           H        LYS  69 -10.183 -17.080 -12.133
    2    HA   LYS  69           HA       LYS  69  -8.430 -15.274 -10.829
    3    HB2  LYS  69           HB2      LYS  69  -8.222 -16.750 -13.452
    4    HB3  LYS  69           HB3      LYS  69  -6.907 -15.785 -12.778
    5    HG2  LYS  69           HG2      LYS  69  -6.958 -17.141 -10.718
    6    HG3  LYS  69           HG3      LYS  69  -8.279 -18.101 -11.379
    7    HD2  LYS  69           HD2      LYS  69  -6.805 -18.787 -13.262
    8    HD3  LYS  69           HD3      LYS  69  -5.478 -17.890 -12.520
    9    HE2  LYS  69           HE2      LYS  69  -6.986 -20.183 -11.226
   10    HE3  LYS  69           HE3      LYS  69  -5.373 -20.289 -11.928
   11    HZ2  LYS  69           HZ1      LYS  69  -6.092 -19.460  -9.354
   12    HZ1  LYS  69           HZ2      LYS  69  -5.418 -18.126 -10.158
   13    HZ3  LYS  69           HZ3      LYS  69  -4.538 -19.573 -10.025

  No H/Q in entry =          13
  In of MODEL   21
    1    H    VAL  70           H        VAL  70  -7.243 -13.455 -11.703
    2    HA   VAL  70           HA       VAL  70  -8.771 -11.830 -13.657
    3    HB   VAL  70           HB       VAL  70  -8.167  -9.849 -12.276
    4   HG13  VAL  70          HG11      VAL  70 -10.372 -10.644 -11.933
    5   HG12  VAL  70          HG12      VAL  70  -9.706 -10.520 -10.304
    6   HG11  VAL  70          HG13      VAL  70  -9.808 -12.092 -11.098
    7   HG21  VAL  70          HG21      VAL  70  -7.078 -12.000 -10.430
    8   HG23  VAL  70          HG22      VAL  70  -7.469 -10.374  -9.873
    9   HG22  VAL  70          HG23      VAL  70  -6.213 -10.610 -11.086

  No H/Q in entry =           9
  In of MODEL   21
    1    H    SER  71           H        SER  71  -7.364  -9.932 -14.400
    2    HA   SER  71           HA       SER  71  -5.063 -10.881 -15.728
    3    HB2  SER  71           HB2      SER  71  -6.418  -8.900 -16.443
    4    HB3  SER  71           HB3      SER  71  -5.765  -8.008 -15.072
    5    HG   SER  71           HG       SER  71  -4.605  -7.739 -17.092

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU  72           H        LEU  72  -3.046 -11.135 -15.069
    2    HA   LEU  72           HA       LEU  72  -2.340 -10.898 -12.355
    3    HB2  LEU  72           HB2      LEU  72  -0.670 -11.306 -14.832
    4    HB3  LEU  72           HB3      LEU  72  -0.012 -11.357 -13.200
    5    HG   LEU  72           HG       LEU  72  -2.328 -13.099 -14.102
    6   HD11  LEU  72          HD11      LEU  72  -0.218 -13.541 -15.395
    7   HD13  LEU  72          HD12      LEU  72  -0.720 -14.897 -14.386
    8   HD12  LEU  72          HD13      LEU  72   0.600 -13.851 -13.861
    9   HD22  LEU  72          HD21      LEU  72  -2.347 -13.112 -11.757
   10   HD21  LEU  72          HD22      LEU  72  -0.606 -12.925 -11.628
   11   HD23  LEU  72          HD23      LEU  72  -1.291 -14.476 -12.109

  No H/Q in entry =          11
  In of MODEL   21
    1    H    VAL  73           H        VAL  73  -1.651  -8.878 -15.140
    2    HA   VAL  73           HA       VAL  73   0.234  -7.141 -14.035
    3    HB   VAL  73           HB       VAL  73  -0.187  -5.730 -15.896
    4   HG13  VAL  73          HG11      VAL  73   0.079  -7.259 -17.670
    5   HG12  VAL  73          HG12      VAL  73  -0.997  -8.443 -16.929
    6   HG11  VAL  73          HG13      VAL  73   0.611  -8.174 -16.259
    7   HG21  VAL  73          HG21      VAL  73  -2.917  -6.967 -15.757
    8   HG23  VAL  73          HG22      VAL  73  -2.325  -6.374 -17.307
    9   HG22  VAL  73          HG23      VAL  73  -2.470  -5.271 -15.938

  No H/Q in entry =           9
  In of MODEL   21
    1    H    LEU  74           H        LEU  74  -3.163  -7.317 -13.490
    2    HA   LEU  74           HA       LEU  74  -3.832  -4.671 -12.889
    3    HB2  LEU  74           HB2      LEU  74  -5.527  -6.372 -13.064
    4    HB3  LEU  74           HB3      LEU  74  -4.827  -7.273 -11.723
    5    HG   LEU  74           HG       LEU  74  -5.336  -5.399 -10.194
    6   HD12  LEU  74          HD11      LEU  74  -6.959  -3.652 -11.192
    7   HD11  LEU  74          HD12      LEU  74  -6.339  -4.162 -12.761
    8   HD13  LEU  74          HD13      LEU  74  -5.245  -3.465 -11.564
    9   HD21  LEU  74          HD21      LEU  74  -7.005  -7.272 -11.078
   10   HD23  LEU  74          HD22      LEU  74  -7.854  -5.855 -11.658
   11   HD22  LEU  74          HD23      LEU  74  -7.527  -6.023  -9.951

  No H/Q in entry =          11
  In of MODEL   21
    1    H    VAL  75           H        VAL  75  -2.753  -7.231 -10.714
    2    HA   VAL  75           HA       VAL  75  -2.592  -5.668  -8.375
    3    HB   VAL  75           HB       VAL  75  -1.046  -8.138  -9.151
    4   HG11  VAL  75          HG11      VAL  75  -1.292  -6.662  -6.491
    5   HG13  VAL  75          HG12      VAL  75   0.178  -6.898  -7.425
    6   HG12  VAL  75          HG13      VAL  75  -0.611  -8.276  -6.677
    7   HG23  VAL  75          HG21      VAL  75  -2.689  -9.200  -7.615
    8   HG22  VAL  75          HG22      VAL  75  -3.491  -8.423  -8.980
    9   HG21  VAL  75          HG23      VAL  75  -3.483  -7.640  -7.399

  No H/Q in entry =           9
  In of MODEL   21
    1    H    GLU  76           H        GLU  76  -0.159  -6.393 -10.899
    2    HA   GLU  76           HA       GLU  76   1.997  -5.002  -9.738
    3    HB2  GLU  76           HB2      GLU  76   2.233  -6.481 -11.716
    4    HB3  GLU  76           HB3      GLU  76   1.307  -5.341 -12.679
    5    HG2  GLU  76           HG2      GLU  76   3.647  -4.977 -13.159
    6    HG3  GLU  76           HG3      GLU  76   3.093  -3.604 -12.221

  No H/Q in entry =           6
  In of MODEL   21
    1    H    ALA  77           H        ALA  77  -0.548  -3.855 -11.941
    2    HA   ALA  77           HA       ALA  77   0.394  -1.191 -12.122
    3    HB1  ALA  77           HB1      ALA  77  -1.206  -1.941 -13.734
    4    HB2  ALA  77           HB2      ALA  77  -2.009  -0.696 -12.778
    5    HB3  ALA  77           HB3      ALA  77  -2.357  -2.399 -12.477

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLN  78           H        GLN  78  -1.854  -2.781  -9.914
    2    HA   GLN  78           HA       GLN  78  -2.709  -0.473  -8.524
    3    HB2  GLN  78           HB2      GLN  78  -3.779  -2.752  -8.435
    4    HB3  GLN  78           HB3      GLN  78  -2.436  -3.285  -7.428
    5    HG2  GLN  78           HG2      GLN  78  -2.988  -1.565  -5.765
    6    HG3  GLN  78           HG3      GLN  78  -4.321  -1.006  -6.772
    7   HE21  GLN  78          HE21      GLN  78  -4.800  -1.994  -4.126
    8   HE22  GLN  78          HE22      GLN  78  -5.651  -3.457  -4.250

  No H/Q in entry =           8
  In of MODEL   21
    1    H    LEU  79           H        LEU  79   0.009  -2.677  -8.055
    2    HA   LEU  79           HA       LEU  79   0.958  -1.754  -5.597
    3    HB2  LEU  79           HB2      LEU  79   1.870  -3.749  -6.655
    4    HB3  LEU  79           HB3      LEU  79   2.503  -2.790  -7.989
    5    HG   LEU  79           HG       LEU  79   4.031  -1.616  -6.483
    6   HD13  LEU  79          HD11      LEU  79   3.014  -1.383  -4.420
    7   HD12  LEU  79          HD12      LEU  79   4.116  -2.711  -4.068
    8   HD11  LEU  79          HD13      LEU  79   2.418  -3.044  -4.403
    9   HD23  LEU  79          HD21      LEU  79   5.279  -3.738  -5.567
   10   HD22  LEU  79          HD22      LEU  79   5.079  -3.548  -7.306
   11   HD21  LEU  79          HD23      LEU  79   4.018  -4.636  -6.415

  No H/Q in entry =          11
  In of MODEL   21
    1    H    HIS  80           H        HIS  80   1.820  -0.631  -8.870
    2    HA   HIS  80           HA       HIS  80   3.585   1.394  -7.948
    3    HB2  HIS  80           HB2      HIS  80   2.320   0.666 -10.533
    4    HB3  HIS  80           HB3      HIS  80   2.882   2.330 -10.366
    5    HD1  HIS  80           HD1      HIS  80   5.279   2.676 -10.879
    6    HD2  HIS  80           HD2      HIS  80   4.532  -1.246  -9.678
    7    HE1  HIS  80           HE1      HIS  80   7.494   1.442 -11.031
    8    HE2  HIS  80           HE2      HIS  80   7.050  -0.952 -10.302

  No H/Q in entry =           8
  In of MODEL   21
    1    H    LEU  81           H        LEU  81   0.183   1.484  -8.942
    2    HA   LEU  81           HA       LEU  81  -0.149   4.271  -8.622
    3    HB2  LEU  81           HB2      LEU  81  -2.119   1.986  -8.544
    4    HB3  LEU  81           HB3      LEU  81  -2.606   3.680  -8.459
    5    HG   LEU  81           HG       LEU  81  -0.880   2.557 -10.684
    6   HD12  LEU  81          HD11      LEU  81  -3.113   2.828 -11.994
    7   HD11  LEU  81          HD12      LEU  81  -3.874   2.749 -10.405
    8   HD13  LEU  81          HD13      LEU  81  -2.901   1.399 -10.984
    9   HD23  LEU  81          HD21      LEU  81  -2.016   4.675 -11.793
   10   HD22  LEU  81          HD22      LEU  81  -0.607   4.878 -10.755
   11   HD21  LEU  81          HD23      LEU  81  -2.221   5.196 -10.122

  No H/Q in entry =          11
  In of MODEL   21
    1    H    MET  82           H        MET  82  -0.764   1.579  -6.367
    2    HA   MET  82           HA       MET  82  -1.857   3.150  -4.290
    3    HB2  MET  82           HB2      MET  82  -0.429   0.492  -4.314
    4    HB3  MET  82           HB3      MET  82  -1.028   1.210  -2.821
    5    HG2  MET  82           HG2      MET  82  -2.740   0.673  -5.268
    6    HG3  MET  82           HG3      MET  82  -2.646  -0.395  -3.869
    7    HE3  MET  82           HE1      MET  82  -4.414   1.228  -1.067
    8    HE2  MET  82           HE2      MET  82  -2.690   1.541  -1.245
    9    HE1  MET  82           HE3      MET  82  -3.344  -0.032  -1.697

  No H/Q in entry =           9
  In of MODEL   21
    1    H    THR  83           H        THR  83   1.468   2.130  -4.961
    2    HA   THR  83           HA       THR  83   2.653   3.267  -2.659
    3    HB   THR  83           HB       THR  83   4.755   3.250  -4.124
    4    HG1  THR  83           HG1      THR  83   4.535   2.712  -6.147
    5   HG22  THR  83          HG21      THR  83   4.367   0.582  -4.449
    6   HG21  THR  83          HG22      THR  83   3.065   0.939  -3.316
    7   HG23  THR  83          HG23      THR  83   4.735   1.318  -2.890

  No H/Q in entry =           7
  In of MODEL   21
    1    H    SER  84           H        SER  84   2.270   4.528  -5.965
    2    HA   SER  84           HA       SER  84   3.557   6.997  -5.512
    3    HB2  SER  84           HB2      SER  84   1.513   6.115  -7.538
    4    HB3  SER  84           HB3      SER  84   2.158   7.756  -7.515
    5    HG   SER  84           HG       SER  84   3.582   5.309  -7.792

  No H/Q in entry =           5
  In of MODEL   21
    1    H    MET  85           H        MET  85   0.078   6.169  -5.353
    2    HA   MET  85           HA       MET  85  -0.839   8.763  -4.764
    3    HB2  MET  85           HB2      MET  85  -2.320   6.919  -5.434
    4    HB3  MET  85           HB3      MET  85  -2.024   6.127  -3.887
    5    HG2  MET  85           HG2      MET  85  -2.956   8.080  -2.701
    6    HG3  MET  85           HG3      MET  85  -3.240   8.881  -4.245
    7    HE3  MET  85           HE1      MET  85  -3.842   5.305  -2.580
    8    HE2  MET  85           HE2      MET  85  -5.570   5.486  -2.287
    9    HE1  MET  85           HE3      MET  85  -4.439   6.632  -1.574

  No H/Q in entry =           9
  In of MODEL   21
    1    H    LEU  86           H        LEU  86   0.125   6.126  -2.608
    2    HA   LEU  86           HA       LEU  86  -0.445   7.425  -0.172
    3    HB2  LEU  86           HB2      LEU  86   0.070   4.963  -0.556
    4    HB3  LEU  86           HB3      LEU  86   1.769   5.427  -0.646
    5    HG   LEU  86           HG       LEU  86   1.411   6.588   1.618
    6   HD11  LEU  86          HD11      LEU  86  -1.265   5.767   1.137
    7   HD13  LEU  86          HD12      LEU  86  -0.620   6.531   2.588
    8   HD12  LEU  86          HD13      LEU  86  -0.676   4.773   2.474
    9   HD23  LEU  86          HD21      LEU  86   1.042   3.588   1.747
   10   HD22  LEU  86          HD22      LEU  86   2.019   4.620   2.788
   11   HD21  LEU  86          HD23      LEU  86   2.534   4.300   1.133

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ALA  87           H        ALA  87   2.549   7.184  -2.048
    2    HA   ALA  87           HA       ALA  87   4.220   8.632  -0.320
    3    HB3  ALA  87           HB1      ALA  87   4.346   7.614  -3.024
    4    HB2  ALA  87           HB2      ALA  87   5.669   7.973  -1.918
    5    HB1  ALA  87           HB3      ALA  87   5.035   9.239  -2.969

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ARG  88           H        ARG  88   2.263   9.723  -3.052
    2    HA   ARG  88           HA       ARG  88   2.985  12.427  -2.940
    3    HB2  ARG  88           HB2      ARG  88   1.761  11.246  -4.799
    4    HB3  ARG  88           HB3      ARG  88   0.297  11.364  -3.822
    5    HG2  ARG  88           HG2      ARG  88   1.268  13.963  -3.742
    6    HG3  ARG  88           HG3      ARG  88   1.708  13.453  -5.370
    7    HD2  ARG  88           HD2      ARG  88  -0.431  13.491  -6.076
    8    HD3  ARG  88           HD3      ARG  88  -1.008  12.631  -4.648
    9    HE   ARG  88           HE       ARG  88  -1.247  15.403  -5.075
   10   HH21  ARG  88          HH11      ARG  88  -1.807  16.728  -3.343
   11   HH22  ARG  88          HH12      ARG  88  -1.507  16.201  -1.722
   12   HH11  ARG  88          HH21      ARG  88  -0.200  13.167  -2.690
   13   HH12  ARG  88          HH22      ARG  88  -0.615  14.178  -1.353

  No H/Q in entry =          13
  In of MODEL   21
    1    H    GLU  89           H        GLU  89   0.307  10.707  -1.306
    2    HA   GLU  89           HA       GLU  89  -0.848  13.002  -0.112
    3    HB2  GLU  89           HB2      GLU  89  -1.924  10.742  -0.197
    4    HB3  GLU  89           HB3      GLU  89  -0.796  10.211   1.050
    5    HG2  GLU  89           HG2      GLU  89  -1.653  11.899   2.601
    6    HG3  GLU  89           HG3      GLU  89  -2.712  12.547   1.352

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LEU  90           H        LEU  90   1.640  10.758   1.078
    2    HA   LEU  90           HA       LEU  90   1.963  12.015   3.606
    3    HB2  LEU  90           HB2      LEU  90   3.774  10.268   1.940
    4    HB3  LEU  90           HB3      LEU  90   4.177  10.797   3.579
    5    HG   LEU  90           HG       LEU  90   1.570   9.403   2.911
    6   HD12  LEU  90          HD11      LEU  90   2.742   7.380   3.930
    7   HD11  LEU  90          HD12      LEU  90   4.250   8.262   3.692
    8   HD13  LEU  90          HD13      LEU  90   3.251   7.833   2.302
    9   HD22  LEU  90          HD21      LEU  90   1.281  10.327   5.030
   10   HD21  LEU  90          HD22      LEU  90   2.998  10.251   5.419
   11   HD23  LEU  90          HD23      LEU  90   2.018   8.786   5.467

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  91           H        ILE  91   3.572  12.418   0.484
    2    HA   ILE  91           HA       ILE  91   5.513  14.285   1.326
    3    HB   ILE  91           HB       ILE  91   4.221  13.765  -1.357
    4   HG12  ILE  91          HG12      ILE  91   7.057  13.329  -0.371
    5   HG13  ILE  91          HG13      ILE  91   5.796  12.110  -0.210
    6   HG22  ILE  91          HG21      ILE  91   6.423  15.148  -2.041
    7   HG21  ILE  91          HG22      ILE  91   6.093  15.948  -0.503
    8   HG23  ILE  91          HG23      ILE  91   4.875  15.952  -1.777
    9   HD13  ILE  91          HD11      ILE  91   5.638  11.778  -2.517
   10   HD12  ILE  91          HD12      ILE  91   7.367  12.051  -2.297
   11   HD11  ILE  91          HD13      ILE  91   6.336  13.355  -2.891

  No H/Q in entry =          11
  In of MODEL   21
    1    H    THR  92           H        THR  92   2.148  14.657   0.304
    2    HA   THR  92           HA       THR  92   2.074  17.479   0.236
    3    HB   THR  92           HB       THR  92  -0.062  15.450   0.932
    4    HG1  THR  92           HG1      THR  92   0.254  15.271  -1.151
    5   HG22  THR  92          HG21      THR  92  -1.497  17.586   0.199
    6   HG21  THR  92          HG22      THR  92  -0.121  18.436   0.899
    7   HG23  THR  92          HG23      THR  92  -1.047  17.301   1.880

  No H/Q in entry =           7
  In of MODEL   21
    1    H    GLU  93           H        GLU  93   1.554  15.177   2.894
    2    HA   GLU  93           HA       GLU  93   0.982  17.077   4.905
    3    HB2  GLU  93           HB2      GLU  93   2.340  14.375   5.154
    4    HB3  GLU  93           HB3      GLU  93   1.629  15.294   6.481
    5    HG2  GLU  93           HG2      GLU  93   0.039  14.482   4.038
    6    HG3  GLU  93           HG3      GLU  93   0.153  13.465   5.470

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LEU  94           H        LEU  94   4.018  15.643   3.771
    2    HA   LEU  94           HA       LEU  94   5.741  16.824   5.663
    3    HB2  LEU  94           HB2      LEU  94   6.170  15.857   2.836
    4    HB3  LEU  94           HB3      LEU  94   7.485  16.539   3.789
    5    HG   LEU  94           HG       LEU  94   5.778  14.318   4.923
    6   HD11  LEU  94          HD11      LEU  94   7.885  14.121   2.801
    7   HD13  LEU  94          HD12      LEU  94   6.455  13.124   3.059
    8   HD12  LEU  94          HD13      LEU  94   7.881  12.898   4.072
    9   HD23  LEU  94          HD21      LEU  94   7.972  13.821   6.086
   10   HD22  LEU  94          HD22      LEU  94   7.277  15.389   6.495
   11   HD21  LEU  94          HD23      LEU  94   8.622  15.288   5.358

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  95           H        ILE  95   4.595  17.969   2.506
    2    HA   ILE  95           HA       ILE  95   6.127  20.352   2.446
    3    HB   ILE  95           HB       ILE  95   3.500  19.621   1.132
    4   HG12  ILE  95          HG12      ILE  95   6.287  20.002   0.005
    5   HG13  ILE  95          HG13      ILE  95   5.662  18.439   0.522
    6   HG21  ILE  95          HG21      ILE  95   5.209  22.116   0.912
    7   HG23  ILE  95          HG22      ILE  95   3.484  22.020   1.262
    8   HG22  ILE  95          HG23      ILE  95   4.080  21.626  -0.351
    9   HD13  ILE  95          HD11      ILE  95   4.111  18.333  -1.213
   10   HD12  ILE  95          HD12      ILE  95   5.449  19.171  -1.998
   11   HD11  ILE  95          HD13      ILE  95   4.059  20.084  -1.414

  No H/Q in entry =          11
  In of MODEL   21
    1    H    GLU  96           H        GLU  96   2.885  19.649   3.730
    2    HA   GLU  96           HA       GLU  96   2.217  22.287   4.472
    3    HB2  GLU  96           HB2      GLU  96   0.573  20.476   4.482
    4    HB3  GLU  96           HB3      GLU  96   1.443  19.667   5.783
    5    HG2  GLU  96           HG2      GLU  96   0.395  20.937   7.345
    6    HG3  GLU  96           HG3      GLU  96   0.909  22.417   6.546

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LEU  97           H        LEU  97   4.096  19.772   6.111
    2    HA   LEU  97           HA       LEU  97   4.421  21.132   8.580
    3    HB2  LEU  97           HB2      LEU  97   5.999  18.985   7.177
    4    HB3  LEU  97           HB3      LEU  97   6.572  19.684   8.690
    5    HG   LEU  97           HG       LEU  97   3.782  18.543   8.371
    6   HD12  LEU  97          HD11      LEU  97   4.750  16.550   9.593
    7   HD11  LEU  97          HD12      LEU  97   6.352  17.206   9.253
    8   HD13  LEU  97          HD13      LEU  97   5.295  16.727   7.925
    9   HD23  LEU  97          HD21      LEU  97   4.229  18.263  10.938
   10   HD22  LEU  97          HD22      LEU  97   3.825  19.866  10.328
   11   HD21  LEU  97          HD23      LEU  97   5.502  19.455  10.680

  No H/Q in entry =          11
  In of MODEL   21
    1    H    HIS  98           H        HIS  98   6.303  21.171   5.562
    2    HA   HIS  98           HA       HIS  98   8.427  22.788   6.465
    3    HB2  HIS  98           HB2      HIS  98   7.149  22.505   3.735
    4    HB3  HIS  98           HB3      HIS  98   8.572  23.507   4.029
    5    HD1  HIS  98           HD1      HIS  98   7.419  19.918   4.053
    6    HD2  HIS  98           HD2      HIS  98  10.964  22.073   4.487
    7    HE1  HIS  98           HE1      HIS  98   9.301  18.218   4.008
    8    HE2  HIS  98           HE2      HIS  98  11.464  19.510   4.272

  No H/Q in entry =           8
  In of MODEL   21
    1    H    GLU  99           H        GLU  99   5.198  23.568   5.275
    2    HA   GLU  99           HA       GLU  99   5.532  26.388   5.211
    3    HB2  GLU  99           HB2      GLU  99   3.676  25.186   4.076
    4    HB3  GLU  99           HB3      GLU  99   2.980  24.817   5.654
    5    HG2  GLU  99           HG2      GLU  99   2.759  27.207   6.148
    6    HG3  GLU  99           HG3      GLU  99   3.535  27.616   4.621

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LYS 100           H        LYS 100   4.427  24.141   7.734
    2    HA   LYS 100           HA       LYS 100   3.800  26.190   9.621
    3    HB2  LYS 100           HB2      LYS 100   4.421  23.250   9.976
    4    HB3  LYS 100           HB3      LYS 100   3.951  24.318  11.304
    5    HG2  LYS 100           HG2      LYS 100   1.881  24.920  10.046
    6    HG3  LYS 100           HG3      LYS 100   2.331  23.755   8.798
    7    HD2  LYS 100           HD2      LYS 100   2.276  21.937  10.464
    8    HD3  LYS 100           HD3      LYS 100   1.842  23.096  11.723
    9    HE2  LYS 100           HE2      LYS 100  -0.215  23.682  10.450
   10    HE3  LYS 100           HE3      LYS 100   0.209  22.465   9.239
   11    HZ1  LYS 100           HZ1      LYS 100  -0.058  21.802  12.121
   12    HZ3  LYS 100           HZ2      LYS 100  -0.052  20.744  10.788
   13    HZ2  LYS 100           HZ3      LYS 100  -1.384  21.763  11.060

  No H/Q in entry =          13
  In of MODEL   21
    1    H    LEU 101           H        LEU 101   6.755  24.439   8.803
    2    HA   LEU 101           HA       LEU 101   8.331  25.310  11.011
    3    HB2  LEU 101           HB2      LEU 101   8.952  24.326   8.238
    4    HB3  LEU 101           HB3      LEU 101  10.240  25.014   9.223
    5    HG   LEU 101           HG       LEU 101   8.438  22.832  10.284
    6   HD12  LEU 101          HD11      LEU 101  10.517  21.367   9.688
    7   HD11  LEU 101          HD12      LEU 101  10.869  22.633   8.514
    8   HD13  LEU 101          HD13      LEU 101   9.354  21.736   8.416
    9   HD21  LEU 101          HD21      LEU 101  11.141  23.984  11.020
   10   HD23  LEU 101          HD22      LEU 101  10.620  22.405  11.602
   11   HD22  LEU 101          HD23      LEU 101   9.703  23.848  12.033

  No H/Q in entry =          11
  In of MODEL   21
    1    H    LYS 102           H        LYS 102   6.728  27.143   8.859
    2    HA   LYS 102           HA       LYS 102   6.771  29.436   8.562
    3    HB2  LYS 102           HB2      LYS 102   8.328  29.350  10.667
    4    HB3  LYS 102           HB3      LYS 102   9.630  29.562   9.512
    5    HG2  LYS 102           HG2      LYS 102   7.491  31.484  10.360
    6    HG3  LYS 102           HG3      LYS 102   9.200  31.770  10.115
    7    HD2  LYS 102           HD2      LYS 102   7.265  31.311   7.809
    8    HD3  LYS 102           HD3      LYS 102   7.621  32.898   8.474
    9    HE2  LYS 102           HE2      LYS 102   9.020  31.730   6.409
   10    HE3  LYS 102           HE3      LYS 102   9.612  33.048   7.420
   11    HZ2  LYS 102           HZ1      LYS 102  11.163  31.167   7.256
   12    HZ1  LYS 102           HZ2      LYS 102  10.013  30.169   7.996
   13    HZ3  LYS 102           HZ3      LYS 102  10.682  31.468   8.854

  No H/Q in entry =          13
  In of MODEL   21
    1    H    ALA 103           H        ALA 103  10.050  28.146   8.014
    2    HA   ALA 103           HA       ALA 103  11.001  29.532   5.938
    3    HB2  ALA 103           HB1      ALA 103  11.924  27.330   5.020
    4    HB1  ALA 103           HB2      ALA 103  11.036  26.545   6.324
    5    HB3  ALA 103           HB3      ALA 103  12.306  27.710   6.699

  No H/Q in entry =           5
  In of MODEL   21
    1    H1   LYS   3           H1       LYS   3 -30.944   6.599 -19.538
    2    H2   LYS   3           H3       LYS   3 -29.976   6.277 -20.897
    3    H3   LYS   3           H2       LYS   3 -31.394   5.382 -20.634
    4    HA   LYS   3           HA       LYS   3 -30.420   3.970 -19.235
    5    HB2  LYS   3           HB2      LYS   3 -28.110   5.311 -20.591
    6    HB3  LYS   3           HB3      LYS   3 -27.810   4.099 -19.346
    7    HG2  LYS   3           HG2      LYS   3 -29.288   2.550 -20.680
    8    HG3  LYS   3           HG3      LYS   3 -29.220   3.744 -21.974
    9    HD2  LYS   3           HD2      LYS   3 -26.742   3.559 -21.945
   10    HD3  LYS   3           HD3      LYS   3 -26.886   2.269 -20.753
   11    HE2  LYS   3           HE2      LYS   3 -28.434   1.131 -22.453
   12    HE3  LYS   3           HE3      LYS   3 -27.790   2.288 -23.617
   13    HZ3  LYS   3           HZ1      LYS   3 -26.030   1.007 -23.898
   14    HZ2  LYS   3           HZ2      LYS   3 -26.684  -0.140 -22.830
   15    HZ1  LYS   3           HZ3      LYS   3 -25.654   1.077 -22.244

  No H/Q in entry =          15
  In of MODEL   21
    1    H    LYS   4           H        LYS   4 -30.458   3.836 -17.172
    2    HA   LYS   4           HA       LYS   4 -29.647   6.105 -15.536
    3    HB2  LYS   4           HB2      LYS   4 -30.921   3.451 -14.817
    4    HB3  LYS   4           HB3      LYS   4 -30.650   4.786 -13.697
    5    HG2  LYS   4           HG2      LYS   4 -32.481   4.770 -16.102
    6    HG3  LYS   4           HG3      LYS   4 -32.954   4.840 -14.407
    7    HD2  LYS   4           HD2      LYS   4 -32.190   7.041 -14.154
    8    HD3  LYS   4           HD3      LYS   4 -31.166   6.948 -15.585
    9    HE2  LYS   4           HE2      LYS   4 -33.053   8.377 -16.036
   10    HE3  LYS   4           HE3      LYS   4 -33.186   6.905 -16.998
   11    HZ3  LYS   4           HZ1      LYS   4 -34.774   6.044 -15.434
   12    HZ2  LYS   4           HZ2      LYS   4 -35.289   7.554 -16.018
   13    HZ1  LYS   4           HZ3      LYS   4 -34.623   7.428 -14.461

  No H/Q in entry =          13
  In of MODEL   21
    1    H    HIS   5           H        HIS   5 -28.163   6.151 -13.958
    2    HA   HIS   5           HA       HIS   5 -25.939   4.252 -14.303
    3    HB2  HIS   5           HB2      HIS   5 -26.099   7.017 -13.103
    4    HB3  HIS   5           HB3      HIS   5 -24.647   6.018 -13.097
    5    HD1  HIS   5           HD1      HIS   5 -23.155   7.166 -14.703
    6    HD2  HIS   5           HD2      HIS   5 -26.988   6.658 -16.222
    7    HE1  HIS   5           HE1      HIS   5 -22.992   7.733 -17.157
    8    HE2  HIS   5           HE2      HIS   5 -25.328   7.412 -18.052

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ILE   6           H        ILE   6 -25.748   2.676 -12.983
    2    HA   ILE   6           HA       ILE   6 -26.689   2.984 -10.211
    3    HB   ILE   6           HB       ILE   6 -25.956   0.487 -11.747
    4   HG12  ILE   6          HG12      ILE   6 -28.661   1.512 -10.876
    5   HG13  ILE   6          HG13      ILE   6 -28.029   1.648 -12.516
    6   HG23  ILE   6          HG21      ILE   6 -26.353  -0.747  -9.880
    7   HG22  ILE   6          HG22      ILE   6 -27.467   0.438  -9.194
    8   HG21  ILE   6          HG23      ILE   6 -25.727   0.718  -9.121
    9   HD13  ILE   6          HD11      ILE   6 -28.560  -0.456 -13.005
   10   HD12  ILE   6          HD12      ILE   6 -29.561  -0.403 -11.554
   11   HD11  ILE   6          HD13      ILE   6 -27.926  -1.062 -11.474

  No H/Q in entry =          11
  In of MODEL   21
    1    H    TYR   7           H        TYR   7 -24.900   3.573  -8.943
    2    HA   TYR   7           HA       TYR   7 -22.227   2.527  -9.642
    3    HB2  TYR   7           HB2      TYR   7 -23.099   4.996  -8.161
    4    HB3  TYR   7           HB3      TYR   7 -21.432   4.428  -8.213
    5    HD1  TYR   7           HD1      TYR   7 -22.529   3.509 -11.291
    6    HD2  TYR   7           HD2      TYR   7 -21.726   7.065  -9.083
    7    HE1  TYR   7           HE1      TYR   7 -22.077   4.717 -13.389
    8    HE2  TYR   7           HE2      TYR   7 -21.314   8.280 -11.173
    9    HH   TYR   7           HH       TYR   7 -21.556   8.193 -13.403

  No H/Q in entry =           9
  In of MODEL   21
    1    H    LEU   8           H        LEU   8 -21.293   1.149  -8.317
    2    HA   LEU   8           HA       LEU   8 -22.415   0.700  -5.622
    3    HB2  LEU   8           HB2      LEU   8 -20.782  -1.023  -7.466
    4    HB3  LEU   8           HB3      LEU   8 -20.965  -1.394  -5.752
    5    HG   LEU   8           HG       LEU   8 -23.453  -1.488  -6.151
    6   HD13  LEU   8          HD11      LEU   8 -23.563  -0.275  -8.264
    7   HD12  LEU   8          HD12      LEU   8 -24.148  -1.922  -8.494
    8   HD11  LEU   8          HD13      LEU   8 -22.530  -1.477  -9.034
    9   HD23  LEU   8          HD21      LEU   8 -22.260  -3.574  -7.849
   10   HD22  LEU   8          HD22      LEU   8 -23.340  -3.702  -6.461
   11   HD21  LEU   8          HD23      LEU   8 -21.620  -3.403  -6.215

  No H/Q in entry =          11
  In of MODEL   21
    1    H    PHE   9           H        PHE   9 -21.120   1.085  -3.851
    2    HA   PHE   9           HA       PHE   9 -18.315   1.936  -4.396
    3    HB2  PHE   9           HB2      PHE   9 -20.296   3.067  -2.425
    4    HB3  PHE   9           HB3      PHE   9 -18.575   3.428  -2.393
    5    HD1  PHE   9           HD1      PHE   9 -17.518   4.703  -4.192
    6    HD2  PHE   9           HD2      PHE   9 -21.741   3.946  -4.190
    7    HE1  PHE   9           HE1      PHE   9 -17.826   6.415  -5.955
    8    HE2  PHE   9           HE2      PHE   9 -22.050   5.670  -5.947
    9    HZ   PHE   9           HZ       PHE   9 -20.091   6.901  -6.836

  No H/Q in entry =           9
  In of MODEL   21
    1    H    SER  10           H        SER  10 -16.736   0.958  -3.300
    2    HA   SER  10           HA       SER  10 -16.913   0.082  -0.605
    3    HB2  SER  10           HB2      SER  10 -16.839  -2.298  -0.889
    4    HB3  SER  10           HB3      SER  10 -18.239  -1.709  -1.769
    5    HG   SER  10           HG       SER  10 -16.767  -1.643  -3.629

  No H/Q in entry =           5
  In of MODEL   21
    1    H    SER  11           H        SER  11 -14.878   0.221   0.157
    2    HA   SER  11           HA       SER  11 -12.708   0.926  -1.465
    3    HB2  SER  11           HB2      SER  11 -13.104   1.205   1.094
    4    HB3  SER  11           HB3      SER  11 -12.285  -0.355   1.202
    5    HG   SER  11           HG       SER  11 -11.010   1.743   1.208

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA  12           H        ALA  12 -14.010  -1.767  -2.102
    2    HA   ALA  12           HA       ALA  12 -11.484  -3.117  -2.637
    3    HB1  ALA  12           HB1      ALA  12 -13.699  -4.775  -1.458
    4    HB3  ALA  12           HB2      ALA  12 -12.503  -3.997  -0.422
    5    HB2  ALA  12           HB3      ALA  12 -11.987  -5.170  -1.633

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLY  13           H        GLY  13 -12.331  -2.114  -4.661
    2    HA3  GLY  13           HA2      GLY  13 -14.603  -2.909  -6.061
    3    HA2  GLY  13           HA3      GLY  13 -13.095  -2.381  -6.822

  No H/Q in entry =           3
  In of MODEL   21
    1    H    MET  14           H        MET  14 -11.582  -4.654  -5.665
    2    HA   MET  14           HA       MET  14 -11.662  -6.413  -7.804
    3    HB2  MET  14           HB2      MET  14  -9.800  -6.427  -6.196
    4    HB3  MET  14           HB3      MET  14 -10.833  -7.184  -4.984
    5    HG2  MET  14           HG2      MET  14  -9.481  -8.899  -6.070
    6    HG3  MET  14           HG3      MET  14 -11.161  -9.113  -6.566
    7    HE2  MET  14           HE1      MET  14  -7.806  -9.440  -7.780
    8    HE1  MET  14           HE2      MET  14  -7.694  -7.731  -7.365
    9    HE3  MET  14           HE3      MET  14  -7.514  -8.236  -9.043

  No H/Q in entry =           9
  In of MODEL   21
    1    H    SER  15           H        SER  15 -13.340  -6.897  -4.702
    2    HA   SER  15           HA       SER  15 -14.601  -9.316  -5.767
    3    HB2  SER  15           HB2      SER  15 -14.610  -8.030  -3.062
    4    HB3  SER  15           HB3      SER  15 -15.936  -9.101  -3.506
    5    HG   SER  15           HG       SER  15 -13.372  -9.984  -4.128

  No H/Q in entry =           5
  In of MODEL   21
    1    H    THR  16           H        THR  16 -15.542  -5.959  -5.033
    2    HA   THR  16           HA       THR  16 -18.368  -6.271  -5.471
    3    HB   THR  16           HB       THR  16 -16.690  -3.805  -6.040
    4    HG1  THR  16           HG1      THR  16 -16.868  -5.130  -3.777
    5   HG21  THR  16          HG21      THR  16 -19.194  -3.983  -6.642
    6   HG23  THR  16          HG22      THR  16 -18.690  -2.593  -5.663
    7   HG22  THR  16          HG23      THR  16 -19.473  -3.987  -4.906

  No H/Q in entry =           7
  In of MODEL   21
    1    H    SER  17           H        SER  17 -15.590  -5.784  -7.390
    2    HA   SER  17           HA       SER  17 -16.713  -5.017  -9.886
    3    HB2  SER  17           HB2      SER  17 -14.122  -6.414  -9.196
    4    HB3  SER  17           HB3      SER  17 -14.562  -5.975 -10.846
    5    HG   SER  17           HG       SER  17 -14.962  -3.844  -9.381

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU  18           H        LEU  18 -16.232  -8.173  -8.430
    2    HA   LEU  18           HA       LEU  18 -16.883  -9.663 -10.775
    3    HB2  LEU  18           HB2      LEU  18 -15.679 -10.644  -8.865
    4    HB3  LEU  18           HB3      LEU  18 -17.107 -10.420  -7.856
    5    HG   LEU  18           HG       LEU  18 -18.368 -11.965  -9.266
    6   HD11  LEU  18          HD11      LEU  18 -15.849 -11.859 -10.888
    7   HD13  LEU  18          HD12      LEU  18 -17.527 -11.789 -11.426
    8   HD12  LEU  18          HD13      LEU  18 -16.833 -13.321 -10.902
    9   HD23  LEU  18          HD21      LEU  18 -15.746 -13.200  -8.495
   10   HD22  LEU  18          HD22      LEU  18 -17.336 -13.964  -8.553
   11   HD21  LEU  18          HD23      LEU  18 -16.993 -12.732  -7.338

  No H/Q in entry =          11
  In of MODEL   21
    1    H    LEU  19           H        LEU  19 -18.792  -8.384  -8.053
    2    HA   LEU  19           HA       LEU  19 -21.298  -9.493  -8.862
    3    HB2  LEU  19           HB2      LEU  19 -20.949  -8.643  -6.612
    4    HB3  LEU  19           HB3      LEU  19 -20.685  -7.021  -7.249
    5    HG   LEU  19           HG       LEU  19 -23.011  -6.821  -7.848
    6   HD11  LEU  19          HD11      LEU  19 -23.037  -9.732  -7.199
    7   HD13  LEU  19          HD12      LEU  19 -23.840  -8.864  -8.508
    8   HD12  LEU  19          HD13      LEU  19 -24.488  -8.785  -6.870
    9   HD23  LEU  19          HD21      LEU  19 -23.998  -6.992  -5.572
   10   HD22  LEU  19          HD22      LEU  19 -22.437  -6.172  -5.624
   11   HD21  LEU  19          HD23      LEU  19 -22.540  -7.838  -5.055

  No H/Q in entry =          11
  In of MODEL   21
    1    H    VAL  20           H        VAL  20 -19.710  -6.383  -9.581
    2    HA   VAL  20           HA       VAL  20 -21.800  -5.283 -11.137
    3    HB   VAL  20           HB       VAL  20 -18.796  -4.784 -11.283
    4   HG12  VAL  20          HG11      VAL  20 -19.659  -2.602 -12.440
    5   HG11  VAL  20          HG12      VAL  20 -21.066  -3.584 -12.843
    6   HG13  VAL  20          HG13      VAL  20 -19.466  -4.067 -13.402
    7   HG21  VAL  20          HG21      VAL  20 -21.088  -3.441  -9.910
    8   HG23  VAL  20          HG22      VAL  20 -19.616  -2.556 -10.300
    9   HG22  VAL  20          HG23      VAL  20 -19.542  -3.966  -9.244

  No H/Q in entry =           9
  In of MODEL   21
    1    H    SER  21           H        SER  21 -19.116  -7.421 -12.178
    2    HA   SER  21           HA       SER  21 -19.918  -7.295 -14.923
    3    HB2  SER  21           HB2      SER  21 -18.543  -9.299 -15.263
    4    HB3  SER  21           HB3      SER  21 -17.671  -8.084 -14.332
    5    HG   SER  21           HG       SER  21 -17.903  -9.259 -12.538

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LYS  22           H        LYS  22 -21.030  -9.437 -12.334
    2    HA   LYS  22           HA       LYS  22 -22.633 -11.014 -14.138
    3    HB2  LYS  22           HB2      LYS  22 -22.938 -10.641 -11.156
    4    HB3  LYS  22           HB3      LYS  22 -23.718 -11.883 -12.134
    5    HG2  LYS  22           HG2      LYS  22 -20.737 -11.642 -11.770
    6    HG3  LYS  22           HG3      LYS  22 -21.775 -12.693 -10.808
    7    HD2  LYS  22           HD2      LYS  22 -22.449 -13.883 -12.854
    8    HD3  LYS  22           HD3      LYS  22 -21.381 -12.844 -13.798
    9    HE2  LYS  22           HE2      LYS  22 -19.443 -13.703 -12.550
   10    HE3  LYS  22           HE3      LYS  22 -20.511 -14.742 -11.606
   11    HZ3  LYS  22           HZ1      LYS  22 -19.718 -16.161 -13.193
   12    HZ2  LYS  22           HZ2      LYS  22 -19.694 -14.982 -14.417
   13    HZ1  LYS  22           HZ3      LYS  22 -21.170 -15.651 -13.911

  No H/Q in entry =          13
  In of MODEL   21
    1    H    MET  23           H        MET  23 -23.249  -8.064 -12.276
    2    HA   MET  23           HA       MET  23 -26.062  -8.055 -12.760
    3    HB2  MET  23           HB2      MET  23 -24.137  -5.805 -12.210
    4    HB3  MET  23           HB3      MET  23 -25.877  -5.580 -12.375
    5    HG2  MET  23           HG2      MET  23 -26.295  -6.864 -10.398
    6    HG3  MET  23           HG3      MET  23 -24.598  -7.330 -10.284
    7    HE2  MET  23           HE1      MET  23 -26.767  -3.602  -9.091
    8    HE1  MET  23           HE2      MET  23 -27.065  -4.566 -10.536
    9    HE3  MET  23           HE3      MET  23 -25.984  -3.174 -10.613

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ARG  24           H        ARG  24 -23.277  -6.722 -14.570
    2    HA   ARG  24           HA       ARG  24 -24.746  -5.381 -16.561
    3    HB2  ARG  24           HB2      ARG  24 -22.286  -5.067 -16.194
    4    HB3  ARG  24           HB3      ARG  24 -22.012  -6.670 -16.830
    5    HG2  ARG  24           HG2      ARG  24 -22.842  -5.980 -19.062
    6    HG3  ARG  24           HG3      ARG  24 -23.196  -4.357 -18.413
    7    HD2  ARG  24           HD2      ARG  24 -21.016  -4.260 -19.486
    8    HD3  ARG  24           HD3      ARG  24 -20.787  -4.190 -17.744
    9    HE   ARG  24           HE       ARG  24 -19.566  -6.031 -17.749
   10   HH21  ARG  24          HH11      ARG  24 -17.994  -6.943 -19.072
   11   HH22  ARG  24          HH12      ARG  24 -18.447  -7.626 -20.595
   12   HH11  ARG  24          HH21      ARG  24 -21.711  -6.278 -20.356
   13   HH12  ARG  24          HH22      ARG  24 -20.649  -7.236 -21.341

  No H/Q in entry =          13
  In of MODEL   21
    1    H    ALA  25           H        ALA  25 -23.734  -8.752 -16.284
    2    HA   ALA  25           HA       ALA  25 -24.409  -9.570 -18.913
    3    HB1  ALA  25           HB1      ALA  25 -23.777 -11.622 -18.217
    4    HB3  ALA  25           HB2      ALA  25 -24.822 -11.562 -16.798
    5    HB2  ALA  25           HB3      ALA  25 -23.240 -10.788 -16.759

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLN  26           H        GLN  26 -26.213  -9.538 -15.876
    2    HA   GLN  26           HA       GLN  26 -28.604 -10.664 -16.873
    3    HB2  GLN  26           HB2      GLN  26 -28.014  -8.929 -14.494
    4    HB3  GLN  26           HB3      GLN  26 -29.604  -9.600 -14.831
    5    HG2  GLN  26           HG2      GLN  26 -27.065 -11.143 -14.376
    6    HG3  GLN  26           HG3      GLN  26 -28.414 -10.991 -13.257
    7   HE21  GLN  26          HE21      GLN  26 -27.280 -13.198 -14.536
    8   HE22  GLN  26          HE22      GLN  26 -28.363 -14.212 -15.322

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ALA  27           H        ALA  27 -27.553  -7.299 -16.496
    2    HA   ALA  27           HA       ALA  27 -30.009  -6.125 -17.265
    3    HB1  ALA  27           HB1      ALA  27 -28.147  -4.870 -16.167
    4    HB3  ALA  27           HB2      ALA  27 -28.722  -4.087 -17.640
    5    HB2  ALA  27           HB3      ALA  27 -27.218  -5.005 -17.660

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLU  28           H        GLU  28 -27.365  -7.443 -19.151
    2    HA   GLU  28           HA       GLU  28 -28.283  -6.377 -21.666
    3    HB2  GLU  28           HB2      GLU  28 -25.924  -7.140 -21.057
    4    HB3  GLU  28           HB3      GLU  28 -26.527  -8.785 -21.252
    5    HG2  GLU  28           HG2      GLU  28 -25.370  -8.052 -23.231
    6    HG3  GLU  28           HG3      GLU  28 -27.079  -8.317 -23.565

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LYS  29           H        LYS  29 -28.543  -9.472 -20.001
    2    HA   LYS  29           HA       LYS  29 -29.910 -10.901 -21.993
    3    HB2  LYS  29           HB2      LYS  29 -28.881 -11.916 -19.995
    4    HB3  LYS  29           HB3      LYS  29 -30.119 -11.165 -18.992
    5    HG2  LYS  29           HG2      LYS  29 -31.834 -12.481 -20.045
    6    HG3  LYS  29           HG3      LYS  29 -30.665 -13.158 -21.176
    7    HD2  LYS  29           HD2      LYS  29 -29.551 -14.360 -19.449
    8    HD3  LYS  29           HD3      LYS  29 -30.419 -13.487 -18.189
    9    HE2  LYS  29           HE2      LYS  29 -31.254 -15.809 -18.541
   10    HE3  LYS  29           HE3      LYS  29 -32.492 -14.574 -18.777
   11    HZ1  LYS  29           HZ1      LYS  29 -31.951 -14.732 -21.209
   12    HZ3  LYS  29           HZ2      LYS  29 -32.712 -16.092 -20.536
   13    HZ2  LYS  29           HZ3      LYS  29 -31.044 -16.121 -20.846

  No H/Q in entry =          13
  In of MODEL   21
    1    H    TYR  30           H        TYR  30 -31.210  -8.745 -19.483
    2    HA   TYR  30           HA       TYR  30 -33.896  -9.105 -20.704
    3    HB2  TYR  30           HB2      TYR  30 -33.184  -7.970 -17.990
    4    HB3  TYR  30           HB3      TYR  30 -34.814  -8.174 -18.630
    5    HD1  TYR  30           HD1      TYR  30 -35.804 -10.433 -18.833
    6    HD2  TYR  30           HD2      TYR  30 -31.934  -9.840 -17.159
    7    HE1  TYR  30           HE1      TYR  30 -35.788 -12.762 -18.033
    8    HE2  TYR  30           HE2      TYR  30 -31.918 -12.153 -16.363
    9    HH   TYR  30           HH       TYR  30 -33.645 -14.459 -17.439

  No H/Q in entry =           9
  In of MODEL   21
    1    H    GLU  31           H        GLU  31 -31.670  -7.190 -21.523
    2    HA   GLU  31           HA       GLU  31 -31.530  -5.037 -22.350
    3    HB2  GLU  31           HB2      GLU  31 -34.451  -5.656 -22.840
    4    HB3  GLU  31           HB3      GLU  31 -33.570  -4.319 -23.579
    5    HG2  GLU  31           HG2      GLU  31 -32.156  -5.807 -24.778
    6    HG3  GLU  31           HG3      GLU  31 -32.761  -7.199 -23.884

  No H/Q in entry =           6
  In of MODEL   21
    1    H    VAL  32           H        VAL  32 -31.705  -4.926 -19.618
    2    HA   VAL  32           HA       VAL  32 -33.490  -2.751 -18.948
    3    HB   VAL  32           HB       VAL  32 -31.121  -3.821 -17.384
    4   HG12  VAL  32          HG11      VAL  32 -32.615  -2.943 -15.478
    5   HG11  VAL  32          HG12      VAL  32 -33.427  -2.014 -16.738
    6   HG13  VAL  32          HG13      VAL  32 -31.708  -1.767 -16.430
    7   HG21  VAL  32          HG21      VAL  32 -32.950  -5.482 -18.055
    8   HG23  VAL  32          HG22      VAL  32 -33.953  -4.620 -16.890
    9   HG22  VAL  32          HG23      VAL  32 -32.457  -5.392 -16.365

  No H/Q in entry =           9
  In of MODEL   21
    1    HA   PRO  33           HA       PRO  33 -30.376   0.074 -20.649
    2    HB2  PRO  33           HB2      PRO  33 -31.813   2.346 -20.518
    3    HB3  PRO  33           HB3      PRO  33 -32.332   1.058 -21.606
    4    HG2  PRO  33           HG2      PRO  33 -33.263   1.609 -18.787
    5    HG3  PRO  33           HG3      PRO  33 -34.244   1.431 -20.242
    6    HD2  PRO  33           HD2      PRO  33 -33.843  -0.654 -18.577
    7    HD3  PRO  33           HD3      PRO  33 -33.926  -0.895 -20.321

  No H/Q in entry =           7
  In of MODEL   21
    1    H    VAL  34           H        VAL  34 -29.117  -0.509 -18.709
    2    HA   VAL  34           HA       VAL  34 -28.742   1.908 -17.068
    3    HB   VAL  34           HB       VAL  34 -28.194   0.431 -15.132
    4   HG12  VAL  34          HG11      VAL  34 -30.631  -0.363 -14.805
    5   HG11  VAL  34          HG12      VAL  34 -30.934   0.405 -16.362
    6   HG13  VAL  34          HG13      VAL  34 -30.340   1.365 -15.006
    7   HG21  VAL  34          HG21      VAL  34 -28.459  -1.590 -17.135
    8   HG23  VAL  34          HG22      VAL  34 -29.518  -1.915 -15.760
    9   HG22  VAL  34          HG23      VAL  34 -27.789  -1.684 -15.507

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ILE  35           H        ILE  35 -26.747   2.281 -16.243
    2    HA   ILE  35           HA       ILE  35 -24.495   0.877 -17.520
    3    HB   ILE  35           HB       ILE  35 -24.797   3.780 -16.711
    4   HG12  ILE  35          HG12      ILE  35 -23.876   2.438 -19.261
    5   HG13  ILE  35          HG13      ILE  35 -25.483   3.112 -18.990
    6   HG21  ILE  35          HG21      ILE  35 -22.287   2.165 -17.037
    7   HG23  ILE  35          HG22      ILE  35 -22.694   3.360 -15.806
    8   HG22  ILE  35          HG23      ILE  35 -22.307   3.880 -17.446
    9   HD11  ILE  35          HD11      ILE  35 -24.008   5.261 -18.403
   10   HD13  ILE  35          HD12      ILE  35 -24.569   4.893 -20.034
   11   HD12  ILE  35          HD13      ILE  35 -22.926   4.471 -19.550

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ILE  36           H        ILE  36 -23.286  -0.184 -15.929
    2    HA   ILE  36           HA       ILE  36 -23.684   0.449 -13.056
    3    HB   ILE  36           HB       ILE  36 -22.953  -2.280 -14.167
    4   HG12  ILE  36          HG12      ILE  36 -25.726  -1.385 -13.383
    5   HG13  ILE  36          HG13      ILE  36 -25.167  -1.384 -15.056
    6   HG23  ILE  36          HG21      ILE  36 -23.313  -3.095 -12.049
    7   HG22  ILE  36          HG22      ILE  36 -24.395  -1.775 -11.604
    8   HG21  ILE  36          HG23      ILE  36 -22.656  -1.499 -11.688
    9   HD13  ILE  36          HD11      ILE  36 -25.404  -3.592 -15.257
   10   HD12  ILE  36          HD12      ILE  36 -26.454  -3.435 -13.851
   11   HD11  ILE  36          HD13      ILE  36 -24.769  -3.908 -13.644

  No H/Q in entry =          11
  In of MODEL   21
    1    H    GLU  37           H        GLU  37 -21.876   1.023 -11.966
    2    HA   GLU  37           HA       GLU  37 -19.220   0.140 -12.902
    3    HB2  GLU  37           HB2      GLU  37 -20.022   2.959 -12.197
    4    HB3  GLU  37           HB3      GLU  37 -18.352   2.412 -12.344
    5    HG2  GLU  37           HG2      GLU  37 -18.693   1.957 -14.699
    6    HG3  GLU  37           HG3      GLU  37 -20.378   2.457 -14.563

  No H/Q in entry =           6
  In of MODEL   21
    1    H    ALA  38           H        ALA  38 -17.727  -0.142 -11.230
    2    HA   ALA  38           HA       ALA  38 -18.732   0.072  -8.452
    3    HB1  ALA  38           HB1      ALA  38 -17.090  -1.921  -9.888
    4    HB3  ALA  38           HB2      ALA  38 -18.135  -2.122  -8.482
    5    HB2  ALA  38           HB3      ALA  38 -16.502  -1.490  -8.282

  No H/Q in entry =           5
  In of MODEL   21
    1    H    PHE  39           H        PHE  39 -17.443   1.245  -6.990
    2    HA   PHE  39           HA       PHE  39 -14.890   2.368  -7.907
    3    HB2  PHE  39           HB2      PHE  39 -17.251   3.929  -6.879
    4    HB3  PHE  39           HB3      PHE  39 -15.603   4.548  -6.795
    5    HD1  PHE  39           HD1      PHE  39 -14.291   4.514  -9.056
    6    HD2  PHE  39           HD2      PHE  39 -18.540   4.433  -8.702
    7    HE1  PHE  39           HE1      PHE  39 -14.488   5.395 -11.364
    8    HE2  PHE  39           HE2      PHE  39 -18.753   5.306 -11.001
    9    HZ   PHE  39           HZ       PHE  39 -16.734   5.761 -12.351

  No H/Q in entry =           9
  In of MODEL   21
    1    HA   PRO  40           HA       PRO  40 -13.942   1.591  -3.626
    2    HB2  PRO  40           HB2      PRO  40 -12.110   3.553  -3.036
    3    HB3  PRO  40           HB3      PRO  40 -11.715   2.208  -4.107
    4    HG2  PRO  40           HG2      PRO  40 -12.665   4.972  -4.848
    5    HG3  PRO  40           HG3      PRO  40 -11.267   4.090  -5.463
    6    HD2  PRO  40           HD2      PRO  40 -13.503   4.064  -6.856
    7    HD3  PRO  40           HD3      PRO  40 -12.589   2.567  -6.670

  No H/Q in entry =           7
  In of MODEL   21
    1    H    GLU  41           H        GLU  41 -14.517   2.590  -1.494
    2    HA   GLU  41           HA       GLU  41 -16.711   4.357  -1.462
    3    HB2  GLU  41           HB2      GLU  41 -16.669   4.151   0.856
    4    HB3  GLU  41           HB3      GLU  41 -15.933   2.645   0.310
    5    HG2  GLU  41           HG2      GLU  41 -14.684   3.414   2.176
    6    HG3  GLU  41           HG3      GLU  41 -13.696   3.667   0.738

  No H/Q in entry =           6
  In of MODEL   21
    1    H    THR  42           H        THR  42 -13.355   5.178  -1.540
    2    HA   THR  42           HA       THR  42 -13.624   7.749  -0.330
    3    HB   THR  42           HB       THR  42 -11.460   8.259  -1.436
    4    HG1  THR  42           HG1      THR  42 -11.528   7.233  -3.346
    5   HG21  THR  42          HG21      THR  42 -11.539   6.947   0.681
    6   HG23  THR  42          HG22      THR  42 -10.148   6.535  -0.323
    7   HG22  THR  42          HG23      THR  42 -11.547   5.464  -0.274

  No H/Q in entry =           7
  In of MODEL   21
    1    H    LEU  43           H        LEU  43 -14.583   6.677  -3.422
    2    HA   LEU  43           HA       LEU  43 -14.764   9.454  -4.394
    3    HB2  LEU  43           HB2      LEU  43 -15.175   6.804  -5.765
    4    HB3  LEU  43           HB3      LEU  43 -15.420   8.372  -6.532
    5    HG   LEU  43           HG       LEU  43 -12.770   7.328  -5.565
    6   HD12  LEU  43          HD11      LEU  43 -13.566   7.701  -8.426
    7   HD11  LEU  43          HD12      LEU  43 -13.954   6.201  -7.586
    8   HD13  LEU  43          HD13      LEU  43 -12.275   6.710  -7.747
    9   HD21  LEU  43          HD21      LEU  43 -13.691   9.839  -6.931
   10   HD23  LEU  43          HD22      LEU  43 -12.044   9.243  -7.155
   11   HD22  LEU  43          HD23      LEU  43 -12.621   9.658  -5.542

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ALA  44           H        ALA  44 -16.747   7.688  -2.523
    2    HA   ALA  44           HA       ALA  44 -19.238   7.617  -3.826
    3    HB2  ALA  44           HB1      ALA  44 -19.116   6.501  -1.729
    4    HB3  ALA  44           HB2      ALA  44 -20.182   7.877  -1.451
    5    HB1  ALA  44           HB3      ALA  44 -18.504   7.938  -0.911

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLY  45           H        GLY  45 -17.727  10.378  -2.309
    2    HA3  GLY  45           HA2      GLY  45 -20.122  11.947  -2.654
    3    HA2  GLY  45           HA3      GLY  45 -18.556  12.528  -2.089

  No H/Q in entry =           3
  In of MODEL   21
    1    H    GLU  46           H        GLU  46 -17.070  11.545  -4.391
    2    HA   GLU  46           HA       GLU  46 -17.657  13.774  -6.158
    3    HB2  GLU  46           HB2      GLU  46 -15.520  11.638  -6.172
    4    HB3  GLU  46           HB3      GLU  46 -15.627  12.931  -7.368
    5    HG2  GLU  46           HG2      GLU  46 -14.045  13.735  -5.902
    6    HG3  GLU  46           HG3      GLU  46 -15.523  14.508  -5.329

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LYS  47           H        LYS  47 -17.642  10.253  -6.588
    2    HA   LYS  47           HA       LYS  47 -18.754  10.500  -9.255
    3    HB2  LYS  47           HB2      LYS  47 -17.674   8.350  -7.560
    4    HB3  LYS  47           HB3      LYS  47 -19.027   7.870  -8.585
    5    HG2  LYS  47           HG2      LYS  47 -16.890   7.431  -9.656
    6    HG3  LYS  47           HG3      LYS  47 -17.825   8.630 -10.549
    7    HD2  LYS  47           HD2      LYS  47 -16.533  10.424  -9.532
    8    HD3  LYS  47           HD3      LYS  47 -15.623   9.249  -8.584
    9    HE2  LYS  47           HE2      LYS  47 -14.737   8.267 -10.628
   10    HE3  LYS  47           HE3      LYS  47 -15.673   9.407 -11.592
   11    HZ2  LYS  47           HZ1      LYS  47 -13.342   9.904  -9.876
   12    HZ1  LYS  47           HZ2      LYS  47 -14.442  11.157 -10.197
   13    HZ3  LYS  47           HZ3      LYS  47 -13.623  10.397 -11.477

  No H/Q in entry =          13
  In of MODEL   21
    1    H    GLY  48           H        GLY  48 -20.074   9.787  -6.096
    2    HA3  GLY  48           HA2      GLY  48 -22.498   8.669  -6.816
    3    HA2  GLY  48           HA3      GLY  48 -22.232   9.659  -5.381

  No H/Q in entry =           3
  In of MODEL   21
    1    H    GLN  49           H        GLN  49 -21.592  12.061  -6.960
    2    HA   GLN  49           HA       GLN  49 -24.120  13.245  -7.087
    3    HB2  GLN  49           HB2      GLN  49 -21.563  14.034  -8.468
    4    HB3  GLN  49           HB3      GLN  49 -22.995  15.041  -8.375
    5    HG2  GLN  49           HG2      GLN  49 -22.817  15.064  -5.939
    6    HG3  GLN  49           HG3      GLN  49 -21.397  14.036  -6.032
    7   HE21  GLN  49          HE21      GLN  49 -21.206  16.263  -4.763
    8   HE22  GLN  49          HE22      GLN  49 -20.252  17.490  -5.421

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ASN  50           H        ASN  50 -22.514  11.315  -9.483
    2    HA   ASN  50           HA       ASN  50 -24.387  12.238 -11.553
    3    HB2  ASN  50           HB2      ASN  50 -21.855  10.623 -11.804
    4    HB3  ASN  50           HB3      ASN  50 -22.903  11.077 -13.140
    5   HD21  ASN  50          HD21      ASN  50 -20.231  11.848 -11.550
    6   HD22  ASN  50          HD22      ASN  50 -19.952  13.476 -11.898

  No H/Q in entry =           6
  In of MODEL   21
    1    H    ALA  51           H        ALA  51 -24.424   9.886  -9.303
    2    HA   ALA  51           HA       ALA  51 -25.285   7.761 -11.119
    3    HB2  ALA  51           HB1      ALA  51 -24.728   6.399  -9.435
    4    HB3  ALA  51           HB2      ALA  51 -25.818   7.241  -8.334
    5    HB1  ALA  51           HB3      ALA  51 -24.163   7.813  -8.546

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ASP  52           H        ASP  52 -27.320   6.765 -10.962
    2    HA   ASP  52           HA       ASP  52 -29.440   8.664 -10.283
    3    HB2  ASP  52           HB2      ASP  52 -29.336   6.152 -11.950
    4    HB3  ASP  52           HB3      ASP  52 -30.855   6.930 -11.504

  No H/Q in entry =           4
  In of MODEL   21
    1    H    VAL  53           H        VAL  53 -27.918   5.730  -9.274
    2    HA   VAL  53           HA       VAL  53 -29.334   5.904  -6.747
    3    HB   VAL  53           HB       VAL  53 -30.791   4.303  -7.977
    4   HG11  VAL  53          HG11      VAL  53 -29.083   3.389  -9.511
    5   HG13  VAL  53          HG12      VAL  53 -29.948   2.121  -8.643
    6   HG12  VAL  53          HG13      VAL  53 -28.319   2.575  -8.146
    7   HG23  VAL  53          HG21      VAL  53 -30.016   2.304  -6.287
    8   HG22  VAL  53          HG22      VAL  53 -31.103   3.643  -5.915
    9   HG21  VAL  53          HG23      VAL  53 -29.388   3.765  -5.520

  No H/Q in entry =           9
  In of MODEL   21
    1    H    VAL  54           H        VAL  54 -28.022   5.434  -5.101
    2    HA   VAL  54           HA       VAL  54 -25.294   4.501  -5.733
    3    HB   VAL  54           HB       VAL  54 -26.292   6.314  -3.478
    4   HG11  VAL  54          HG11      VAL  54 -23.760   4.816  -3.787
    5   HG13  VAL  54          HG12      VAL  54 -24.480   5.521  -2.340
    6   HG12  VAL  54          HG13      VAL  54 -23.552   6.535  -3.445
    7   HG22  VAL  54          HG21      VAL  54 -25.386   8.099  -4.588
    8   HG21  VAL  54          HG22      VAL  54 -25.975   7.124  -5.934
    9   HG23  VAL  54          HG23      VAL  54 -24.264   7.098  -5.509

  No H/Q in entry =           9
  In of MODEL   21
    1    H    LEU  55           H        LEU  55 -24.756   2.563  -5.091
    2    HA   LEU  55           HA       LEU  55 -26.285   1.302  -2.902
    3    HB2  LEU  55           HB2      LEU  55 -24.784   0.084  -5.206
    4    HB3  LEU  55           HB3      LEU  55 -25.562  -0.825  -3.911
    5    HG   LEU  55           HG       LEU  55 -26.966   0.802  -6.019
    6   HD13  LEU  55          HD11      LEU  55 -26.733  -1.061  -7.238
    7   HD12  LEU  55          HD12      LEU  55 -27.707  -1.903  -6.034
    8   HD11  LEU  55          HD13      LEU  55 -25.950  -1.892  -5.896
    9   HD23  LEU  55          HD21      LEU  55 -28.305  -1.100  -4.151
   10   HD22  LEU  55          HD22      LEU  55 -28.964   0.302  -4.995
   11   HD21  LEU  55          HD23      LEU  55 -27.927   0.529  -3.589

  No H/Q in entry =          11
  In of MODEL   21
    1    H    LEU  56           H        LEU  56 -25.139   0.676  -1.104
    2    HA   LEU  56           HA       LEU  56 -22.194   0.981  -1.177
    3    HB2  LEU  56           HB2      LEU  56 -23.983   0.830   1.236
    4    HB3  LEU  56           HB3      LEU  56 -22.262   1.205   1.211
    5    HG   LEU  56           HG       LEU  56 -24.516   2.953   0.261
    6   HD11  LEU  56          HD11      LEU  56 -23.394   2.542   2.774
    7   HD13  LEU  56          HD12      LEU  56 -24.345   3.939   2.273
    8   HD12  LEU  56          HD13      LEU  56 -22.586   3.990   2.171
    9   HD23  LEU  56          HD21      LEU  56 -22.521   4.591   0.049
   10   HD22  LEU  56          HD22      LEU  56 -22.948   3.504  -1.273
   11   HD21  LEU  56          HD23      LEU  56 -21.597   3.110  -0.210

  No H/Q in entry =          11
  In of MODEL   21
    1    H    GLY  57           H        GLY  57 -20.861  -0.691  -0.651
    2    HA3  GLY  57           HA2      GLY  57 -21.867  -3.348  -0.836
    3    HA2  GLY  57           HA3      GLY  57 -20.227  -2.903  -0.369

  No H/Q in entry =           3
  In of MODEL   21
    1    HA   PRO  58           HA       PRO  58 -23.038  -3.847   3.364
    2    HB2  PRO  58           HB2      PRO  58 -22.430  -6.471   3.970
    3    HB3  PRO  58           HB3      PRO  58 -23.810  -6.022   2.967
    4    HG2  PRO  58           HG2      PRO  58 -21.117  -6.988   2.161
    5    HG3  PRO  58           HG3      PRO  58 -22.700  -7.400   1.503
    6    HD2  PRO  58           HD2      PRO  58 -21.045  -5.637   0.264
    7    HD3  PRO  58           HD3      PRO  58 -22.801  -5.496   0.176

  No H/Q in entry =           7
  In of MODEL   21
    1    H    GLN  59           H        GLN  59 -19.689  -4.425   2.732
    2    HA   GLN  59           HA       GLN  59 -18.913  -4.463   5.486
    3    HB2  GLN  59           HB2      GLN  59 -17.141  -3.416   3.304
    4    HB3  GLN  59           HB3      GLN  59 -16.700  -4.276   4.764
    5    HG2  GLN  59           HG2      GLN  59 -16.399  -5.942   3.254
    6    HG3  GLN  59           HG3      GLN  59 -18.097  -6.209   3.613
    7   HE21  GLN  59          HE21      GLN  59 -18.295  -7.034   1.719
    8   HE22  GLN  59          HE22      GLN  59 -18.538  -6.480   0.170

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ILE  60           H        ILE  60 -19.783  -1.887   3.280
    2    HA   ILE  60           HA       ILE  60 -18.854   0.046   5.315
    3    HB   ILE  60           HB       ILE  60 -18.562   1.700   3.673
    4   HG12  ILE  60          HG12      ILE  60 -20.128   0.000   1.733
    5   HG13  ILE  60          HG13      ILE  60 -20.737   1.431   2.563
    6   HG22  ILE  60          HG21      ILE  60 -17.306   0.592   1.805
    7   HG21  ILE  60          HG22      ILE  60 -17.786  -0.947   2.519
    8   HG23  ILE  60          HG23      ILE  60 -16.798   0.183   3.444
    9   HD13  ILE  60          HD11      ILE  60 -19.399   2.882   1.301
   10   HD12  ILE  60          HD12      ILE  60 -19.905   1.674   0.121
   11   HD11  ILE  60          HD13      ILE  60 -18.290   1.597   0.824

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ALA  61           H        ALA  61 -21.358  -1.461   5.407
    2    HA   ALA  61           HA       ALA  61 -23.534   0.271   4.962
    3    HB1  ALA  61           HB1      ALA  61 -24.785  -1.177   6.300
    4    HB2  ALA  61           HB2      ALA  61 -23.392  -1.608   7.292
    5    HB3  ALA  61           HB3      ALA  61 -23.520  -2.215   5.641

  No H/Q in entry =           5
  In of MODEL   21
    1    H    TYR  62           H        TYR  62 -21.308   0.095   7.743
    2    HA   TYR  62           HA       TYR  62 -22.797   1.804   9.422
    3    HB2  TYR  62           HB2      TYR  62 -20.748   2.152  10.649
    4    HB3  TYR  62           HB3      TYR  62 -20.839   0.460  10.162
    5    HD1  TYR  62           HD1      TYR  62 -19.301  -0.434   8.443
    6    HD2  TYR  62           HD2      TYR  62 -18.993   3.614   9.779
    7    HE1  TYR  62           HE1      TYR  62 -17.089  -0.253   7.371
    8    HE2  TYR  62           HE2      TYR  62 -16.766   3.788   8.707
    9    HH   TYR  62           HH       TYR  62 -14.923   1.551   8.001

  No H/Q in entry =           9
  In of MODEL   21
    1    H    MET  63           H        MET  63 -21.151   2.605   6.551
    2    HA   MET  63           HA       MET  63 -20.889   5.431   7.238
    3    HB2  MET  63           HB2      MET  63 -20.351   3.886   4.701
    4    HB3  MET  63           HB3      MET  63 -20.101   5.624   4.877
    5    HG2  MET  63           HG2      MET  63 -18.404   5.204   6.576
    6    HG3  MET  63           HG3      MET  63 -18.646   3.468   6.385
    7    HE1  MET  63           HE1      MET  63 -17.531   6.697   5.030
    8    HE3  MET  63           HE2      MET  63 -18.359   6.400   3.502
    9    HE2  MET  63           HE3      MET  63 -16.597   6.357   3.573

  No H/Q in entry =           9
  In of MODEL   21
    1    H    LEU  64           H        LEU  64 -23.519   3.658   6.297
    2    HA   LEU  64           HA       LEU  64 -24.699   5.111   4.226
    3    HB2  LEU  64           HB2      LEU  64 -25.628   3.036   5.156
    4    HB3  LEU  64           HB3      LEU  64 -26.045   3.896   6.637
    5    HG   LEU  64           HG       LEU  64 -27.708   5.203   5.420
    6   HD13  LEU  64          HD11      LEU  64 -27.436   5.430   3.185
    7   HD12  LEU  64          HD12      LEU  64 -28.135   3.816   3.048
    8   HD11  LEU  64          HD13      LEU  64 -26.384   4.019   3.091
    9   HD23  LEU  64          HD21      LEU  64 -28.323   2.407   4.681
   10   HD22  LEU  64          HD22      LEU  64 -29.267   3.574   5.608
   11   HD21  LEU  64          HD23      LEU  64 -27.912   2.738   6.365

  No H/Q in entry =          11
  In of MODEL   21
    1    HA   PRO  65           HA       PRO  65 -26.752   8.340   6.988
    2    HB2  PRO  65           HB2      PRO  65 -24.729   8.437   9.226
    3    HB3  PRO  65           HB3      PRO  65 -26.458   8.774   9.285
    4    HG2  PRO  65           HG2      PRO  65 -25.595   6.493  10.209
    5    HG3  PRO  65           HG3      PRO  65 -27.024   6.505   9.175
    6    HD2  PRO  65           HD2      PRO  65 -24.179   5.795   8.450
    7    HD3  PRO  65           HD3      PRO  65 -25.669   4.956   8.017

  No H/Q in entry =           7
  In of MODEL   21
    1    H    GLU  66           H        GLU  66 -23.200   8.167   7.032
    2    HA   GLU  66           HA       GLU  66 -22.812  10.953   6.619
    3    HB2  GLU  66           HB2      GLU  66 -21.083   8.585   5.957
    4    HB3  GLU  66           HB3      GLU  66 -20.579  10.261   5.743
    5    HG2  GLU  66           HG2      GLU  66 -20.758  10.642   8.111
    6    HG3  GLU  66           HG3      GLU  66 -21.337   8.995   8.350

  No H/Q in entry =           6
  In of MODEL   21
    1    H    ILE  67           H        ILE  67 -23.025   8.208   4.374
    2    HA   ILE  67           HA       ILE  67 -22.571   9.897   2.073
    3    HB   ILE  67           HB       ILE  67 -23.565   7.022   2.267
    4   HG12  ILE  67          HG12      ILE  67 -20.906   8.101   1.320
    5   HG13  ILE  67          HG13      ILE  67 -21.200   7.694   3.010
    6   HG21  ILE  67          HG21      ILE  67 -23.463   8.893   0.037
    7   HG23  ILE  67          HG22      ILE  67 -24.144   7.268   0.096
    8   HG22  ILE  67          HG23      ILE  67 -22.429   7.493  -0.247
    9   HD12  ILE  67          HD11      ILE  67 -20.860   5.905   0.660
   10   HD11  ILE  67          HD12      ILE  67 -21.883   5.370   1.993
   11   HD13  ILE  67          HD13      ILE  67 -20.192   5.778   2.287

  No H/Q in entry =          11
  In of MODEL   21
    1    H    GLN  68           H        GLN  68 -25.461   8.946   3.732
    2    HA   GLN  68           HA       GLN  68 -27.274   9.936   1.772
    3    HB2  GLN  68           HB2      GLN  68 -27.517   9.592   4.758
    4    HB3  GLN  68           HB3      GLN  68 -28.823  10.231   3.775
    5    HG2  GLN  68           HG2      GLN  68 -28.932   8.201   2.503
    6    HG3  GLN  68           HG3      GLN  68 -27.498   7.576   3.294
    7   HE21  GLN  68          HE21      GLN  68 -29.724   6.294   3.180
    8   HE22  GLN  68          HE22      GLN  68 -30.556   5.871   4.603

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ARG  69           H        ARG  69 -25.587  11.549   4.492
    2    HA   ARG  69           HA       ARG  69 -26.866  14.077   4.092
    3    HB2  ARG  69           HB2      ARG  69 -24.542  13.068   5.664
    4    HB3  ARG  69           HB3      ARG  69 -24.563  14.788   5.302
    5    HG2  ARG  69           HG2      ARG  69 -26.867  14.916   6.293
    6    HG3  ARG  69           HG3      ARG  69 -26.717  13.220   6.769
    7    HD2  ARG  69           HD2      ARG  69 -24.932  15.514   7.663
    8    HD3  ARG  69           HD3      ARG  69 -26.085  14.651   8.669
    9    HE   ARG  69           HE       ARG  69 -23.516  13.624   7.699
   10   HH21  ARG  69          HH11      ARG  69 -22.762  11.835   8.892
   11   HH22  ARG  69          HH12      ARG  69 -23.810  11.059  10.031
   12   HH11  ARG  69          HH21      ARG  69 -26.477  13.187   9.424
   13   HH12  ARG  69          HH22      ARG  69 -25.912  11.822  10.330

  No H/Q in entry =          13
  In of MODEL   21
    1    H    LEU  70           H        LEU  70 -24.059  12.566   2.710
    2    HA   LEU  70           HA       LEU  70 -22.871  14.888   1.529
    3    HB2  LEU  70           HB2      LEU  70 -21.957  12.536   2.120
    4    HB3  LEU  70           HB3      LEU  70 -22.601  12.090   0.540
    5    HG   LEU  70           HG       LEU  70 -20.968  13.402  -0.561
    6   HD11  LEU  70          HD11      LEU  70 -20.091  14.220   2.218
    7   HD13  LEU  70          HD12      LEU  70 -20.760  15.276   0.974
    8   HD12  LEU  70          HD13      LEU  70 -19.176  14.536   0.741
    9   HD22  LEU  70          HD21      LEU  70 -19.598  11.634  -0.338
   10   HD21  LEU  70          HD22      LEU  70 -20.529  11.148   1.078
   11   HD23  LEU  70          HD23      LEU  70 -19.104  12.170   1.269

  No H/Q in entry =          11
  In of MODEL   21
    1    H    LEU  71           H        LEU  71 -25.126  12.424   0.437
    2    HA   LEU  71           HA       LEU  71 -25.617  13.926  -2.078
    3    HB2  LEU  71           HB2      LEU  71 -25.931  10.952  -1.623
    4    HB3  LEU  71           HB3      LEU  71 -26.041  11.814  -3.158
    5    HG   LEU  71           HG       LEU  71 -23.507  11.735  -1.519
    6   HD12  LEU  71          HD11      LEU  71 -23.642  10.106  -3.947
    7   HD11  LEU  71          HD12      LEU  71 -24.664   9.523  -2.634
    8   HD13  LEU  71          HD13      LEU  71 -22.933   9.738  -2.375
    9   HD22  LEU  71          HD21      LEU  71 -23.555  13.551  -3.015
   10   HD21  LEU  71          HD22      LEU  71 -24.103  12.526  -4.341
   11   HD23  LEU  71          HD23      LEU  71 -22.482  12.319  -3.677

  No H/Q in entry =          11
  In of MODEL   21
    1    HA   PRO  72           HA       PRO  72 -29.474  13.629   0.579
    2    HB2  PRO  72           HB2      PRO  72 -30.233  16.220   0.499
    3    HB3  PRO  72           HB3      PRO  72 -28.933  15.720   1.581
    4    HG2  PRO  72           HG2      PRO  72 -28.725  16.902  -1.177
    5    HG3  PRO  72           HG3      PRO  72 -27.925  17.427   0.305
    6    HD2  PRO  72           HD2      PRO  72 -26.664  15.814  -1.470
    7    HD3  PRO  72           HD3      PRO  72 -26.401  15.641   0.264

  No H/Q in entry =           7
  In of MODEL   21
    1    H    ASN  73           H        ASN  73 -28.843  14.554  -2.643
    2    HA   ASN  73           HA       ASN  73 -31.719  14.357  -3.250
    3    HB2  ASN  73           HB2      ASN  73 -31.229  15.440  -5.353
    4    HB3  ASN  73           HB3      ASN  73 -30.655  16.401  -3.998
    5   HD21  ASN  73          HD21      ASN  73 -29.882  16.411  -6.683
    6   HD22  ASN  73          HD22      ASN  73 -28.224  16.184  -6.890

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LYS  74           H        LYS  74 -29.826  12.025  -2.837
    2    HA   LYS  74           HA       LYS  74 -30.470  10.650  -5.378
    3    HB2  LYS  74           HB2      LYS  74 -27.937  10.259  -3.778
    4    HB3  LYS  74           HB3      LYS  74 -28.366   9.461  -5.292
    5    HG2  LYS  74           HG2      LYS  74 -27.981  12.417  -5.098
    6    HG3  LYS  74           HG3      LYS  74 -26.653  11.300  -5.412
    7    HD2  LYS  74           HD2      LYS  74 -27.824  10.415  -7.344
    8    HD3  LYS  74           HD3      LYS  74 -29.199  11.469  -7.013
    9    HE2  LYS  74           HE2      LYS  74 -27.897  13.423  -7.470
   10    HE3  LYS  74           HE3      LYS  74 -26.415  12.473  -7.573
   11    HZ2  LYS  74           HZ1      LYS  74 -27.879  13.131  -9.687
   12    HZ1  LYS  74           HZ2      LYS  74 -28.591  11.637  -9.305
   13    HZ3  LYS  74           HZ3      LYS  74 -26.924  11.729  -9.617

  No H/Q in entry =          13
  In of MODEL   21
    1    HA   PRO  75           HA       PRO  75 -31.958   7.729  -2.389
    2    HB2  PRO  75           HB2      PRO  75 -32.373   5.523  -3.964
    3    HB3  PRO  75           HB3      PRO  75 -33.443   6.921  -4.026
    4    HG2  PRO  75           HG2      PRO  75 -31.147   6.227  -5.816
    5    HG3  PRO  75           HG3      PRO  75 -32.781   6.730  -6.250
    6    HD2  PRO  75           HD2      PRO  75 -30.764   8.514  -6.227
    7    HD3  PRO  75           HD3      PRO  75 -32.374   8.982  -5.676

  No H/Q in entry =           7
  In of MODEL   21
    1    H    VAL  76           H        VAL  76 -30.537   6.617  -1.027
    2    HA   VAL  76           HA       VAL  76 -28.134   5.306  -2.153
    3    HB   VAL  76           HB       VAL  76 -28.339   6.787   0.504
    4   HG11  VAL  76          HG11      VAL  76 -26.049   5.403  -0.905
    5   HG13  VAL  76          HG12      VAL  76 -26.750   4.984   0.660
    6   HG12  VAL  76          HG13      VAL  76 -25.843   6.485   0.474
    7   HG22  VAL  76          HG21      VAL  76 -27.601   8.658  -0.392
    8   HG21  VAL  76          HG22      VAL  76 -28.186   7.982  -1.914
    9   HG23  VAL  76          HG23      VAL  76 -26.484   7.825  -1.474

  No H/Q in entry =           9
  In of MODEL   21
    1    H    GLU  77           H        GLU  77 -28.000   3.146  -1.537
    2    HA   GLU  77           HA       GLU  77 -28.796   2.397   1.126
    3    HB2  GLU  77           HB2      GLU  77 -30.474   0.816   0.613
    4    HB3  GLU  77           HB3      GLU  77 -30.966   2.359  -0.088
    5    HG2  GLU  77           HG2      GLU  77 -30.407   1.572  -2.279
    6    HG3  GLU  77           HG3      GLU  77 -29.822   0.051  -1.608

  No H/Q in entry =           6
  In of MODEL   21
    1    H    VAL  78           H        VAL  78 -28.549   0.299   1.787
    2    HA   VAL  78           HA       VAL  78 -25.924  -0.582   0.878
    3    HB   VAL  78           HB       VAL  78 -27.646  -1.391   3.260
    4   HG11  VAL  78          HG11      VAL  78 -25.369  -2.717   2.119
    5   HG13  VAL  78          HG12      VAL  78 -26.282  -3.147   3.565
    6   HG12  VAL  78          HG13      VAL  78 -24.915  -2.040   3.682
    7   HG22  VAL  78          HG21      VAL  78 -26.122  -0.086   4.583
    8   HG21  VAL  78          HG22      VAL  78 -26.828   0.910   3.311
    9   HG23  VAL  78          HG23      VAL  78 -25.176   0.315   3.149

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ILE  79           H        ILE  79 -25.473  -2.512  -0.027
    2    HA   ILE  79           HA       ILE  79 -27.603  -3.908  -1.354
    3    HB   ILE  79           HB       ILE  79 -24.634  -4.555  -1.156
    4   HG12  ILE  79          HG12      ILE  79 -26.245  -3.391  -3.434
    5   HG13  ILE  79          HG13      ILE  79 -25.320  -2.414  -2.290
    6   HG22  ILE  79          HG21      ILE  79 -25.804  -5.694  -3.463
    7   HG21  ILE  79          HG22      ILE  79 -26.797  -6.172  -2.087
    8   HG23  ILE  79          HG23      ILE  79 -25.069  -6.522  -2.090
    9   HD13  ILE  79          HD11      ILE  79 -23.927  -2.589  -4.121
   10   HD12  ILE  79          HD12      ILE  79 -24.338  -4.283  -4.394
   11   HD11  ILE  79          HD13      ILE  79 -23.324  -3.832  -3.023

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ASP  80           H        ASP  80 -28.540  -5.794  -0.758
    2    HA   ASP  80           HA       ASP  80 -28.500  -6.689   1.890
    3    HB2  ASP  80           HB2      ASP  80 -30.291  -7.197   0.267
    4    HB3  ASP  80           HB3      ASP  80 -29.182  -8.252  -0.610

  No H/Q in entry =           4
  In of MODEL   21
    1    H    SER  81           H        SER  81 -27.003  -7.883   3.010
    2    HA   SER  81           HA       SER  81 -24.547  -8.669   1.799
    3    HB2  SER  81           HB2      SER  81 -24.017  -9.711   3.966
    4    HB3  SER  81           HB3      SER  81 -24.657  -8.082   4.183
    5    HG   SER  81           HG       SER  81 -26.585  -8.927   4.803

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU  82           H        LEU  82 -27.337 -10.647   2.149
    2    HA   LEU  82           HA       LEU  82 -25.891 -13.078   1.622
    3    HB2  LEU  82           HB2      LEU  82 -28.809 -12.478   1.194
    4    HB3  LEU  82           HB3      LEU  82 -28.063 -14.065   1.371
    5    HG   LEU  82           HG       LEU  82 -28.303 -11.994   3.534
    6   HD11  LEU  82          HD11      LEU  82 -29.780 -14.584   3.005
    7   HD13  LEU  82          HD12      LEU  82 -30.465 -12.958   2.973
    8   HD12  LEU  82          HD13      LEU  82 -29.899 -13.646   4.495
    9   HD22  LEU  82          HD21      LEU  82 -26.343 -13.270   3.900
   10   HD21  LEU  82          HD22      LEU  82 -27.117 -14.755   3.350
   11   HD23  LEU  82          HD23      LEU  82 -27.584 -14.038   4.893

  No H/Q in entry =          11
  In of MODEL   21
    1    H    LEU  83           H        LEU  83 -27.774 -10.779  -0.286
    2    HA   LEU  83           HA       LEU  83 -27.649 -12.150  -2.755
    3    HB2  LEU  83           HB2      LEU  83 -27.935  -9.227  -2.112
    4    HB3  LEU  83           HB3      LEU  83 -28.008  -9.874  -3.751
    5    HG   LEU  83           HG       LEU  83 -30.036 -10.172  -1.557
    6   HD13  LEU  83          HD11      LEU  83 -30.726  -8.298  -2.620
    7   HD12  LEU  83          HD12      LEU  83 -31.244  -9.396  -3.897
    8   HD11  LEU  83          HD13      LEU  83 -29.677  -8.593  -4.005
    9   HD23  LEU  83          HD21      LEU  83 -30.250 -11.431  -4.277
   10   HD22  LEU  83          HD22      LEU  83 -31.220 -11.738  -2.837
   11   HD21  LEU  83          HD23      LEU  83 -29.555 -12.310  -2.914

  No H/Q in entry =          11
  In of MODEL   21
    1    H    TYR  84           H        TYR  84 -25.586  -9.843  -1.102
    2    HA   TYR  84           HA       TYR  84 -23.724  -9.437  -3.250
    3    HB2  TYR  84           HB2      TYR  84 -24.165  -7.927  -1.226
    4    HB3  TYR  84           HB3      TYR  84 -23.180  -9.064  -0.309
    5    HD1  TYR  84           HD1      TYR  84 -20.818  -8.976  -0.387
    6    HD2  TYR  84           HD2      TYR  84 -23.113  -6.697  -3.176
    7    HE1  TYR  84           HE1      TYR  84 -18.757  -7.831  -1.127
    8    HE2  TYR  84           HE2      TYR  84 -21.060  -5.550  -3.932
    9    HH   TYR  84           HH       TYR  84 -18.021  -5.965  -2.226

  No H/Q in entry =           9
  In of MODEL   21
    1    H    GLY  85           H        GLY  85 -23.540 -11.440  -0.300
    2    HA3  GLY  85           HA2      GLY  85 -21.007 -12.489  -0.802
    3    HA2  GLY  85           HA3      GLY  85 -22.264 -13.282   0.149

  No H/Q in entry =           3
  In of MODEL   21
    1    H    LYS  86           H        LYS  86 -24.142 -13.584  -1.895
    2    HA   LYS  86           HA       LYS  86 -23.197 -16.003  -3.156
    3    HB2  LYS  86           HB2      LYS  86 -25.415 -15.839  -2.204
    4    HB3  LYS  86           HB3      LYS  86 -25.783 -14.449  -3.226
    5    HG2  LYS  86           HG2      LYS  86 -26.922 -16.413  -4.006
    6    HG3  LYS  86           HG3      LYS  86 -25.715 -15.893  -5.184
    7    HD2  LYS  86           HD2      LYS  86 -24.176 -17.569  -4.481
    8    HD3  LYS  86           HD3      LYS  86 -25.133 -17.941  -3.049
    9    HE2  LYS  86           HE2      LYS  86 -25.505 -19.679  -4.644
   10    HE3  LYS  86           HE3      LYS  86 -26.967 -18.695  -4.579
   11    HZ2  LYS  86           HZ1      LYS  86 -25.941 -19.316  -6.860
   12    HZ1  LYS  86           HZ2      LYS  86 -24.862 -18.046  -6.531
   13    HZ3  LYS  86           HZ3      LYS  86 -26.531 -17.743  -6.611

  No H/Q in entry =          13
  In of MODEL   21
    1    H    VAL  87           H        VAL  87 -23.062 -12.794  -4.060
    2    HA   VAL  87           HA       VAL  87 -22.733 -11.640  -6.006
    3    HB   VAL  87           HB       VAL  87 -21.778 -14.197  -7.327
    4   HG11  VAL  87          HG11      VAL  87 -21.897 -11.840  -8.427
    5   HG13  VAL  87          HG12      VAL  87 -20.402 -12.763  -8.593
    6   HG12  VAL  87          HG13      VAL  87 -20.510 -11.464  -7.406
    7   HG22  VAL  87          HG21      VAL  87 -19.625 -13.999  -6.293
    8   HG21  VAL  87          HG22      VAL  87 -20.845 -14.138  -5.030
    9   HG23  VAL  87          HG23      VAL  87 -20.135 -12.568  -5.401

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ASP  88           H        ASP  88 -25.269 -12.177  -5.631
    2    HA   ASP  88           HA       ASP  88 -26.460 -13.354  -8.015
    3    HB2  ASP  88           HB2      ASP  88 -27.444 -13.551  -5.681
    4    HB3  ASP  88           HB3      ASP  88 -27.828 -11.834  -5.783

  No H/Q in entry =           4
  In of MODEL   21
    1    H    GLY  89           H        GLY  89 -25.720 -12.131  -9.666
    2    HA3  GLY  89           HA2      GLY  89 -25.792  -9.353  -9.874
    3    HA2  GLY  89           HA3      GLY  89 -25.825 -10.478 -11.232

  No H/Q in entry =           3
  In of MODEL   21
    1    H    LEU  90           H        LEU  90 -28.320 -11.729 -10.757
    2    HA   LEU  90           HA       LEU  90 -30.062  -9.726 -11.860
    3    HB2  LEU  90           HB2      LEU  90 -30.228 -12.120 -12.432
    4    HB3  LEU  90           HB3      LEU  90 -30.733 -12.460 -10.777
    5    HG   LEU  90           HG       LEU  90 -32.808 -11.260 -11.126
    6   HD13  LEU  90          HD11      LEU  90 -32.573  -9.532 -12.608
    7   HD12  LEU  90          HD12      LEU  90 -33.172 -10.750 -13.736
    8   HD11  LEU  90          HD13      LEU  90 -31.443 -10.424 -13.628
    9   HD23  LEU  90          HD21      LEU  90 -32.827 -12.899 -13.555
   10   HD22  LEU  90          HD22      LEU  90 -33.798 -13.020 -12.089
   11   HD21  LEU  90          HD23      LEU  90 -32.170 -13.698 -12.126

  No H/Q in entry =          11
  In of MODEL   21
    1    H    GLY  91           H        GLY  91 -29.924 -11.223  -8.673
    2    HA3  GLY  91           HA2      GLY  91 -32.207 -10.015  -7.616
    3    HA2  GLY  91           HA3      GLY  91 -30.829 -10.600  -6.685

  No H/Q in entry =           3
  In of MODEL   21
    1    H    VAL  92           H        VAL  92 -28.847  -8.854  -7.564
    2    HA   VAL  92           HA       VAL  92 -29.532  -6.518  -6.016
    3    HB   VAL  92           HB       VAL  92 -27.021  -7.094  -7.634
    4   HG12  VAL  92          HG11      VAL  92 -27.088  -5.196  -5.312
    5   HG11  VAL  92          HG12      VAL  92 -27.746  -4.632  -6.850
    6   HG13  VAL  92          HG13      VAL  92 -26.069  -5.167  -6.751
    7   HG22  VAL  92          HG21      VAL  92 -26.847  -8.685  -6.038
    8   HG21  VAL  92          HG22      VAL  92 -27.949  -7.856  -4.937
    9   HG23  VAL  92          HG23      VAL  92 -26.274  -7.322  -5.075

  No H/Q in entry =           9
  In of MODEL   21
    1    H    LEU  93           H        LEU  93 -29.183  -7.206  -9.437
    2    HA   LEU  93           HA       LEU  93 -29.432  -4.562 -10.373
    3    HB2  LEU  93           HB2      LEU  93 -28.879  -6.446 -11.835
    4    HB3  LEU  93           HB3      LEU  93 -30.496  -7.108 -11.594
    5    HG   LEU  93           HG       LEU  93 -31.438  -5.110 -12.716
    6   HD11  LEU  93          HD11      LEU  93 -29.521  -3.588 -12.234
    7   HD13  LEU  93          HD12      LEU  93 -29.977  -3.606 -13.939
    8   HD12  LEU  93          HD13      LEU  93 -28.556  -4.496 -13.398
    9   HD23  LEU  93          HD21      LEU  93 -30.445  -5.725 -15.011
   10   HD22  LEU  93          HD22      LEU  93 -31.328  -6.945 -14.092
   11   HD21  LEU  93          HD23      LEU  93 -29.563  -6.959 -14.111

  No H/Q in entry =          11
  In of MODEL   21
    1    H    LYS  94           H        LYS  94 -31.899  -7.009  -9.493
    2    HA   LYS  94           HA       LYS  94 -34.189  -5.477 -10.100
    3    HB2  LYS  94           HB2      LYS  94 -33.744  -7.675  -8.086
    4    HB3  LYS  94           HB3      LYS  94 -35.315  -6.918  -8.341
    5    HG2  LYS  94           HG2      LYS  94 -35.282  -7.703 -10.673
    6    HG3  LYS  94           HG3      LYS  94 -33.748  -8.515 -10.357
    7    HD2  LYS  94           HD2      LYS  94 -34.904  -9.796  -8.517
    8    HD3  LYS  94           HD3      LYS  94 -36.425  -9.091  -9.060
    9    HE2  LYS  94           HE2      LYS  94 -35.969 -10.046 -11.329
   10    HE3  LYS  94           HE3      LYS  94 -34.580 -10.883 -10.636
   11    HZ3  LYS  94           HZ1      LYS  94 -36.490 -12.330 -10.783
   12    HZ2  LYS  94           HZ2      LYS  94 -37.414 -11.264  -9.836
   13    HZ1  LYS  94           HZ3      LYS  94 -36.078 -12.063  -9.158

  No H/Q in entry =          13
  In of MODEL   21
    1    H    ALA  95           H        ALA  95 -32.343  -5.662  -7.069
    2    HA   ALA  95           HA       ALA  95 -34.114  -4.004  -5.577
    3    HB2  ALA  95           HB1      ALA  95 -31.790  -5.471  -5.059
    4    HB3  ALA  95           HB2      ALA  95 -32.721  -4.525  -3.898
    5    HB1  ALA  95           HB3      ALA  95 -31.351  -3.795  -4.735

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA  96           H        ALA  96 -31.460  -3.264  -7.702
    2    HA   ALA  96           HA       ALA  96 -31.246  -0.506  -6.938
    3    HB2  ALA  96           HB1      ALA  96 -29.897  -0.340  -9.062
    4    HB3  ALA  96           HB2      ALA  96 -30.271  -2.035  -9.372
    5    HB1  ALA  96           HB3      ALA  96 -29.324  -1.587  -7.953

  No H/Q in entry =           5
  In of MODEL   21
    1    H    VAL  97           H        VAL  97 -32.871  -2.164  -9.605
    2    HA   VAL  97           HA       VAL  97 -33.860   0.173 -10.858
    3    HB   VAL  97           HB       VAL  97 -34.787  -2.718 -10.883
    4   HG11  VAL  97          HG11      VAL  97 -36.501  -0.642 -11.358
    5   HG13  VAL  97          HG12      VAL  97 -36.633  -2.233 -12.108
    6   HG12  VAL  97          HG13      VAL  97 -35.834  -0.917 -12.968
    7   HG21  VAL  97          HG21      VAL  97 -33.455  -0.949 -12.936
    8   HG23  VAL  97          HG22      VAL  97 -33.978  -2.610 -13.215
    9   HG22  VAL  97          HG23      VAL  97 -32.704  -2.271 -12.043

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ALA  98           H        ALA  98 -35.106  -1.949  -8.303
    2    HA   ALA  98           HA       ALA  98 -37.614  -0.694  -7.931
    3    HB1  ALA  98           HB1      ALA  98 -36.682  -2.931  -6.901
    4    HB3  ALA  98           HB2      ALA  98 -37.814  -1.956  -5.962
    5    HB2  ALA  98           HB3      ALA  98 -36.086  -1.878  -5.619

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA  99           H        ALA  99 -34.489  -0.020  -6.316
    2    HA   ALA  99           HA       ALA  99 -35.519   2.013  -4.650
    3    HB1  ALA  99           HB1      ALA  99 -32.916   1.012  -5.420
    4    HB2  ALA  99           HB2      ALA  99 -33.421   1.788  -3.917
    5    HB3  ALA  99           HB3      ALA  99 -32.916   2.771  -5.292

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ILE 100           H        ILE 100 -34.506   2.092  -8.016
    2    HA   ILE 100           HA       ILE 100 -34.566   4.945  -8.240
    3    HB   ILE 100           HB       ILE 100 -34.773   2.791 -10.373
    4   HG12  ILE 100          HG12      ILE 100 -32.521   4.692  -9.727
    5   HG13  ILE 100          HG13      ILE 100 -32.621   3.049  -9.092
    6   HG21  ILE 100          HG21      ILE 100 -35.074   5.727 -10.506
    7   HG23  ILE 100          HG22      ILE 100 -35.644   4.478 -11.614
    8   HG22  ILE 100          HG23      ILE 100 -33.967   5.023 -11.686
    9   HD12  ILE 100          HD11      ILE 100 -32.075   3.977 -11.874
   10   HD11  ILE 100          HD12      ILE 100 -32.801   2.391 -11.609
   11   HD13  ILE 100          HD13      ILE 100 -31.231   2.771 -10.904

  No H/Q in entry =          11
  In of MODEL   21
    1    H    LYS 101           H        LYS 101 -36.975   2.434  -8.938
    2    HA   LYS 101           HA       LYS 101 -38.994   4.169  -9.921
    3    HB2  LYS 101           HB2      LYS 101 -38.986   1.394  -8.788
    4    HB3  LYS 101           HB3      LYS 101 -40.507   2.221  -9.120
    5    HG2  LYS 101           HG2      LYS 101 -40.050   2.330 -11.423
    6    HG3  LYS 101           HG3      LYS 101 -38.370   1.854 -11.183
    7    HD2  LYS 101           HD2      LYS 101 -39.709  -0.001 -12.052
    8    HD3  LYS 101           HD3      LYS 101 -39.081  -0.355 -10.443
    9    HE2  LYS 101           HE2      LYS 101 -41.167  -0.960  -9.915
   10    HE3  LYS 101           HE3      LYS 101 -41.550   0.762  -9.918
   11    HZ3  LYS 101           HZ1      LYS 101 -42.469   0.639 -12.026
   12    HZ2  LYS 101           HZ2      LYS 101 -42.985  -0.812 -11.311
   13    HZ1  LYS 101           HZ3      LYS 101 -41.688  -0.822 -12.406

  No H/Q in entry =          13
  In of MODEL   21
    1    H    LYS 102           H        LYS 102 -38.536   2.677  -6.714
    2    HA   LYS 102           HA       LYS 102 -40.718   3.969  -5.498
    3    HB2  LYS 102           HB2      LYS 102 -39.553   2.054  -4.490
    4    HB3  LYS 102           HB3      LYS 102 -38.116   3.050  -4.262
    5    HG2  LYS 102           HG2      LYS 102 -39.357   4.501  -2.756
    6    HG3  LYS 102           HG3      LYS 102 -40.797   3.510  -2.986
    7    HD2  LYS 102           HD2      LYS 102 -39.642   1.596  -1.967
    8    HD3  LYS 102           HD3      LYS 102 -38.203   2.589  -1.736
    9    HE2  LYS 102           HE2      LYS 102 -39.479   4.125  -0.317
   10    HE3  LYS 102           HE3      LYS 102 -40.935   3.164  -0.570
   11    HZ1  LYS 102           HZ1      LYS 102 -39.281   1.339   0.421
   12    HZ3  LYS 102           HZ2      LYS 102 -40.344   2.272   1.359
   13    HZ2  LYS 102           HZ3      LYS 102 -38.714   2.728   1.216

  No H/Q in entry =          13
  In of MODEL   21
    1    H    ALA 103           H        ALA 103 -37.717   5.232  -6.541
    2    HA   ALA 103           HA       ALA 103 -37.824   7.557  -4.762
    3    HB2  ALA 103           HB1      ALA 103 -35.818   8.203  -6.357
    4    HB3  ALA 103           HB2      ALA 103 -35.859   6.485  -6.752
    5    HB1  ALA 103           HB3      ALA 103 -35.595   7.000  -5.087

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA 104           H        ALA 104 -38.507   6.848  -8.100
    2    HA   ALA 104           HA       ALA 104 -38.979   9.654  -8.722
    3    HB2  ALA 104           HB1      ALA 104 -39.071   8.985 -10.923
    4    HB1  ALA 104           HB2      ALA 104 -39.860   7.456 -10.535
    5    HB3  ALA 104           HB3      ALA 104 -38.126   7.646 -10.273

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA 105           H        ALA 105 -40.658   7.623  -6.899
    2    HA   ALA 105           HA       ALA 105 -43.020   9.118  -6.852
    3    HB2  ALA 105           HB1      ALA 105 -43.820   8.288  -8.883
    4    HB3  ALA 105           HB2      ALA 105 -44.496   7.130  -7.738
    5    HB1  ALA 105           HB3      ALA 105 -43.052   6.718  -8.659

  No H/Q in entry =           5
  In of MODEL   22
    1    H1   ALA   1           H3       ALA   1 -12.115 -16.002  -2.432
    2    H2   ALA   1           H2       ALA   1 -11.162 -17.138  -3.267
    3    H3   ALA   1           H1       ALA   1 -12.312 -16.205  -4.106
    4    HA   ALA   1           HA       ALA   1 -13.697 -17.917  -3.865
    5    HB3  ALA   1           HB1      ALA   1 -12.287 -19.675  -3.396
    6    HB1  ALA   1           HB2      ALA   1 -13.047 -19.565  -1.809
    7    HB2  ALA   1           HB3      ALA   1 -11.477 -18.812  -2.088

  No H/Q in entry =           7
  In of MODEL   22
    1    H    GLU   2           H        GLU   2 -15.316 -18.781  -2.212
    2    HA   GLU   2           HA       GLU   2 -16.981 -17.072  -1.162
    3    HB2  GLU   2           HB2      GLU   2 -16.025 -19.486   0.391
    4    HB3  GLU   2           HB3      GLU   2 -17.557 -18.648   0.640
    5    HG2  GLU   2           HG2      GLU   2 -18.523 -19.747  -1.094
    6    HG3  GLU   2           HG3      GLU   2 -17.201 -19.337  -2.177

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLU   3           H        GLU   3 -15.063 -18.403   1.469
    2    HA   GLU   3           HA       GLU   3 -15.308 -16.047   3.020
    3    HB2  GLU   3           HB2      GLU   3 -13.702 -18.580   3.281
    4    HB3  GLU   3           HB3      GLU   3 -13.484 -17.256   4.425
    5    HG2  GLU   3           HG2      GLU   3 -15.678 -17.424   5.238
    6    HG3  GLU   3           HG3      GLU   3 -16.263 -18.232   3.790

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LEU   4           H        LEU   4 -12.338 -17.504   1.640
    2    HA   LEU   4           HA       LEU   4 -10.521 -15.584   2.238
    3    HB2  LEU   4           HB2      LEU   4 -10.735 -16.890  -0.485
    4    HB3  LEU   4           HB3      LEU   4  -9.290 -16.156   0.202
    5    HG   LEU   4           HG       LEU   4 -10.767 -18.563   1.317
    6   HD13  LEU   4          HD11      LEU   4  -9.121 -19.907   0.395
    7   HD12  LEU   4          HD12      LEU   4  -7.922 -18.614   0.368
    8   HD11  LEU   4          HD13      LEU   4  -9.207 -18.650  -0.838
    9   HD23  LEU   4          HD21      LEU   4  -8.518 -18.604   2.704
   10   HD22  LEU   4          HD22      LEU   4  -9.849 -17.575   3.227
   11   HD21  LEU   4          HD23      LEU   4  -8.490 -16.877   2.347

  No H/Q in entry =          11
  In of MODEL   22
    1    H    GLU   5           H        GLU   5 -12.851 -15.403  -0.443
    2    HA   GLU   5           HA       GLU   5 -11.866 -12.914  -1.447
    3    HB2  GLU   5           HB2      GLU   5 -13.192 -14.508  -2.813
    4    HB3  GLU   5           HB3      GLU   5 -14.597 -14.169  -1.803
    5    HG2  GLU   5           HG2      GLU   5 -14.519 -11.804  -2.444
    6    HG3  GLU   5           HG3      GLU   5 -13.073 -12.099  -3.410

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLU   6           H        GLU   6 -14.589 -13.810   0.641
    2    HA   GLU   6           HA       GLU   6 -15.517 -11.140   1.032
    3    HB2  GLU   6           HB2      GLU   6 -16.887 -13.204   1.432
    4    HB3  GLU   6           HB3      GLU   6 -15.894 -13.529   2.853
    5    HG2  GLU   6           HG2      GLU   6 -17.766 -12.364   3.710
    6    HG3  GLU   6           HG3      GLU   6 -16.505 -11.138   3.599

  No H/Q in entry =           6
  In of MODEL   22
    1    H    VAL   7           H        VAL   7 -13.196 -13.227   2.614
    2    HA   VAL   7           HA       VAL   7 -12.748 -11.643   4.938
    3    HB   VAL   7           HB       VAL   7 -11.024 -13.676   3.498
    4   HG11  VAL   7          HG11      VAL   7 -10.575 -12.133   6.059
    5   HG13  VAL   7          HG12      VAL   7  -9.470 -12.342   4.702
    6   HG12  VAL   7          HG13      VAL   7  -9.815 -13.699   5.774
    7   HG21  VAL   7          HG21      VAL   7 -13.273 -14.256   4.714
    8   HG23  VAL   7          HG22      VAL   7 -12.352 -13.971   6.191
    9   HG22  VAL   7          HG23      VAL   7 -11.846 -15.229   5.066

  No H/Q in entry =           9
  In of MODEL   22
    1    H    VAL   8           H        VAL   8 -11.228 -11.753   1.732
    2    HA   VAL   8           HA       VAL   8  -9.182  -9.862   2.226
    3    HB   VAL   8           HB       VAL   8 -10.633 -10.570  -0.336
    4   HG11  VAL   8          HG11      VAL   8  -8.184  -8.856   0.172
    5   HG13  VAL   8          HG12      VAL   8  -9.683  -8.372  -0.622
    6   HG12  VAL   8          HG13      VAL   8  -8.597  -9.516  -1.412
    7   HG23  VAL   8          HG21      VAL   8  -7.785 -11.316   0.099
    8   HG22  VAL   8          HG22      VAL   8  -9.104 -12.267  -0.578
    9   HG21  VAL   8          HG23      VAL   8  -8.928 -12.132   1.168

  No H/Q in entry =           9
  In of MODEL   22
    1    H    MET   9           H        MET   9 -12.528  -9.503   1.056
    2    HA   MET   9           HA       MET   9 -12.486  -6.727   0.615
    3    HB2  MET   9           HB2      MET   9 -14.656  -8.666   1.369
    4    HB3  MET   9           HB3      MET   9 -14.993  -6.936   1.304
    5    HG2  MET   9           HG2      MET   9 -13.921  -6.991  -1.035
    6    HG3  MET   9           HG3      MET   9 -14.077  -8.744  -0.932
    7    HE1  MET   9           HE1      MET   9 -15.963 -10.057  -0.902
    8    HE3  MET   9           HE2      MET   9 -17.657  -9.596  -1.038
    9    HE2  MET   9           HE3      MET   9 -16.820  -9.404   0.500

  No H/Q in entry =           9
  In of MODEL   22
    1    H    GLY  10           H        GLY  10 -13.141  -8.616   3.545
    2    HA3  GLY  10           HA2      GLY  10 -13.712  -6.432   5.257
    3    HA2  GLY  10           HA3      GLY  10 -13.135  -8.015   5.777

  No H/Q in entry =           3
  In of MODEL   22
    1    H    LEU  11           H        LEU  11 -10.685  -8.121   4.468
    2    HA   LEU  11           HA       LEU  11  -9.002  -6.669   6.226
    3    HB2  LEU  11           HB2      LEU  11  -8.436  -8.094   3.624
    4    HB3  LEU  11           HB3      LEU  11  -7.175  -7.376   4.624
    5    HG   LEU  11           HG       LEU  11  -9.162  -9.424   5.640
    6   HD13  LEU  11          HD11      LEU  11  -7.925 -10.654   4.082
    7   HD12  LEU  11          HD12      LEU  11  -6.992 -10.881   5.560
    8   HD11  LEU  11          HD13      LEU  11  -6.458  -9.714   4.351
    9   HD22  LEU  11          HD21      LEU  11  -8.322  -8.399   7.556
   10   HD21  LEU  11          HD22      LEU  11  -6.786  -7.986   6.796
   11   HD23  LEU  11          HD23      LEU  11  -7.099  -9.643   7.309

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  12           H        ILE  12  -9.900  -6.138   2.833
    2    HA   ILE  12           HA       ILE  12  -8.227  -3.894   2.405
    3    HB   ILE  12           HB       ILE  12 -10.870  -4.593   1.104
    4   HG12  ILE  12          HG12      ILE  12  -8.823  -6.228   1.037
    5   HG13  ILE  12          HG13      ILE  12  -9.677  -5.876  -0.451
    6   HG22  ILE  12          HG21      ILE  12 -10.024  -3.179  -0.770
    7   HG21  ILE  12          HG22      ILE  12  -8.652  -2.707   0.226
    8   HG23  ILE  12          HG23      ILE  12 -10.272  -2.275   0.693
    9   HD11  ILE  12          HD11      ILE  12  -7.173  -4.442   0.473
   10   HD13  ILE  12          HD12      ILE  12  -7.963  -4.294  -1.095
   11   HD12  ILE  12          HD13      ILE  12  -7.177  -5.789  -0.648

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  13           H        ILE  13 -11.588  -4.189   3.490
    2    HA   ILE  13           HA       ILE  13 -12.074  -1.406   3.751
    3    HB   ILE  13           HB       ILE  13 -13.259  -3.835   5.116
    4   HG12  ILE  13          HG12      ILE  13 -13.481  -3.289   2.574
    5   HG13  ILE  13          HG13      ILE  13 -14.900  -3.777   3.476
    6   HG22  ILE  13          HG21      ILE  13 -15.187  -2.146   5.600
    7   HG21  ILE  13          HG22      ILE  13 -13.950  -0.909   5.423
    8   HG23  ILE  13          HG23      ILE  13 -13.787  -2.143   6.670
    9   HD12  ILE  13          HD11      ILE  13 -15.007  -1.645   1.920
   10   HD11  ILE  13          HD12      ILE  13 -14.232  -0.880   3.295
   11   HD13  ILE  13          HD13      ILE  13 -15.798  -1.633   3.500

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ASN  14           H        ASN  14 -10.946  -3.880   6.035
    2    HA   ASN  14           HA       ASN  14 -10.767  -2.234   8.317
    3    HB2  ASN  14           HB2      ASN  14 -10.488  -4.840   8.003
    4    HB3  ASN  14           HB3      ASN  14  -8.783  -4.436   7.849
    5   HD21  ASN  14          HD21      ASN  14  -9.410  -5.961  10.027
    6   HD22  ASN  14          HD22      ASN  14  -9.395  -5.037  11.449

  No H/Q in entry =           6
  In of MODEL   22
    1    H    SER  15           H        SER  15  -8.350  -3.040   5.834
    2    HA   SER  15           HA       SER  15  -6.225  -1.523   6.908
    3    HB2  SER  15           HB2      SER  15  -5.197  -1.732   4.752
    4    HB3  SER  15           HB3      SER  15  -6.134  -3.203   4.981
    5    HG   SER  15           HG       SER  15  -7.735  -1.370   3.943

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLY  16           H        GLY  16  -8.829  -0.689   4.652
    2    HA3  GLY  16           HA2      GLY  16  -7.996   1.959   4.095
    3    HA2  GLY  16           HA3      GLY  16  -9.641   1.346   3.930

  No H/Q in entry =           3
  In of MODEL   22
    1    H    GLN  17           H        GLN  17 -10.183   0.623   6.581
    2    HA   GLN  17           HA       GLN  17 -10.920   3.123   7.713
    3    HB2  GLN  17           HB2      GLN  17 -12.110   0.992   8.186
    4    HB3  GLN  17           HB3      GLN  17 -10.708   0.440   9.105
    5    HG2  GLN  17           HG2      GLN  17 -10.944   2.415  10.599
    6    HG3  GLN  17           HG3      GLN  17 -12.388   2.892   9.708
    7   HE21  GLN  17          HE21      GLN  17 -14.031   2.477  11.241
    8   HE22  GLN  17          HE22      GLN  17 -14.285   0.961  11.962

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ALA  18           H        ALA  18  -8.269   0.872   8.345
    2    HA   ALA  18           HA       ALA  18  -7.191   2.106  10.616
    3    HB2  ALA  18           HB1      ALA  18  -6.553  -0.107   9.256
    4    HB3  ALA  18           HB2      ALA  18  -5.402   0.692  10.328
    5    HB1  ALA  18           HB3      ALA  18  -5.323   0.966   8.587

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ARG  19           H        ARG  19  -6.416   2.629   7.168
    2    HA   ARG  19           HA       ARG  19  -4.542   4.698   7.597
    3    HB2  ARG  19           HB2      ARG  19  -4.850   3.548   5.403
    4    HB3  ARG  19           HB3      ARG  19  -6.401   4.371   5.220
    5    HG2  ARG  19           HG2      ARG  19  -5.298   6.555   5.285
    6    HG3  ARG  19           HG3      ARG  19  -3.741   5.788   5.596
    7    HD2  ARG  19           HD2      ARG  19  -3.866   6.371   3.251
    8    HD3  ARG  19           HD3      ARG  19  -3.931   4.610   3.401
    9    HE   ARG  19           HE       ARG  19  -6.575   5.489   3.383
   10   HH21  ARG  19          HH11      ARG  19  -7.766   5.626   1.461
   11   HH22  ARG  19          HH12      ARG  19  -6.941   5.709  -0.056
   12   HH11  ARG  19          HH21      ARG  19  -3.794   5.579   1.357
   13   HH12  ARG  19          HH22      ARG  19  -4.691   5.680  -0.115

  No H/Q in entry =          13
  In of MODEL   22
    1    H    SER  20           H        SER  20  -8.039   4.771   6.986
    2    HA   SER  20           HA       SER  20  -8.429   7.522   6.928
    3    HB2  SER  20           HB2      SER  20 -10.288   6.156   6.390
    4    HB3  SER  20           HB3      SER  20 -10.174   5.271   7.910
    5    HG   SER  20           HG       SER  20 -10.789   7.162   8.986

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU  21           H        LEU  21  -8.411   5.348   9.739
    2    HA   LEU  21           HA       LEU  21  -8.882   7.344  11.697
    3    HB2  LEU  21           HB2      LEU  21  -7.493   4.662  11.872
    4    HB3  LEU  21           HB3      LEU  21  -7.829   5.678  13.270
    5    HG   LEU  21           HG       LEU  21  -9.958   4.714  11.336
    6   HD12  LEU  21          HD11      LEU  21 -10.567   3.188  13.280
    7   HD11  LEU  21          HD12      LEU  21  -8.996   3.586  13.974
    8   HD13  LEU  21          HD13      LEU  21  -9.089   2.762  12.416
    9   HD21  LEU  21          HD21      LEU  21  -9.954   6.321  13.878
   10   HD23  LEU  21          HD22      LEU  21 -11.329   5.267  13.563
   11   HD22  LEU  21          HD23      LEU  21 -10.931   6.549  12.430

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ALA  22           H        ALA  22  -5.908   6.003  10.302
    2    HA   ALA  22           HA       ALA  22  -4.050   7.344  11.926
    3    HB2  ALA  22           HB1      ALA  22  -3.606   5.490  10.242
    4    HB1  ALA  22           HB2      ALA  22  -2.426   6.801  10.277
    5    HB3  ALA  22           HB3      ALA  22  -3.640   6.739   8.997

  No H/Q in entry =           5
  In of MODEL   22
    1    H    TYR  23           H        TYR  23  -5.370   8.335   8.737
    2    HA   TYR  23           HA       TYR  23  -4.065  10.847   8.663
    3    HB2  TYR  23           HB2      TYR  23  -5.127   9.918   6.671
    4    HB3  TYR  23           HB3      TYR  23  -6.709  10.004   7.446
    5    HD1  TYR  23           HD1      TYR  23  -3.829  12.090   6.310
    6    HD2  TYR  23           HD2      TYR  23  -7.979  11.993   7.411
    7    HE1  TYR  23           HE1      TYR  23  -4.085  14.435   5.544
    8    HE2  TYR  23           HE2      TYR  23  -8.236  14.338   6.644
    9    HH   TYR  23           HH       TYR  23  -5.490  16.120   5.229

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ALA  24           H        ALA  24  -7.176   9.835  10.036
    2    HA   ALA  24           HA       ALA  24  -8.047  12.416  10.797
    3    HB1  ALA  24           HB1      ALA  24  -9.852  11.144  11.262
    4    HB2  ALA  24           HB2      ALA  24  -9.023  10.587  12.714
    5    HB3  ALA  24           HB3      ALA  24  -8.882   9.673  11.214

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA  25           H        ALA  25  -6.020   9.988  12.384
    2    HA   ALA  25           HA       ALA  25  -5.706  11.252  14.884
    3    HB2  ALA  25           HB1      ALA  25  -4.907   8.907  14.072
    4    HB3  ALA  25           HB2      ALA  25  -3.906   9.781  15.234
    5    HB1  ALA  25           HB3      ALA  25  -3.465   9.765  13.526

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU  26           H        LEU  26  -3.909  11.564  11.848
    2    HA   LEU  26           HA       LEU  26  -1.976  13.411  12.765
    3    HB2  LEU  26           HB2      LEU  26  -1.653  12.257  10.666
    4    HB3  LEU  26           HB3      LEU  26  -3.133  12.945  10.004
    5    HG   LEU  26           HG       LEU  26  -2.147  15.208  10.137
    6   HD12  LEU  26          HD11      LEU  26   0.390  15.260  10.559
    7   HD11  LEU  26          HD12      LEU  26   0.183  13.679  11.307
    8   HD13  LEU  26          HD13      LEU  26  -0.644  15.086  11.977
    9   HD21  LEU  26          HD21      LEU  26  -0.374  13.171   8.753
   10   HD23  LEU  26          HD22      LEU  26  -0.437  14.891   8.378
   11   HD22  LEU  26          HD23      LEU  26  -1.847  13.875   8.088

  No H/Q in entry =          11
  In of MODEL   22
    1    H    LYS  27           H        LYS  27  -5.159  13.850  11.276
    2    HA   LYS  27           HA       LYS  27  -5.137  16.639  11.070
    3    HB2  LYS  27           HB2      LYS  27  -6.860  15.138  10.083
    4    HB3  LYS  27           HB3      LYS  27  -7.519  14.878  11.698
    5    HG2  LYS  27           HG2      LYS  27  -7.978  17.279  11.926
    6    HG3  LYS  27           HG3      LYS  27  -7.268  17.580  10.336
    7    HD2  LYS  27           HD2      LYS  27  -8.980  16.122   9.298
    8    HD3  LYS  27           HD3      LYS  27  -9.696  15.838  10.887
    9    HE2  LYS  27           HE2      LYS  27 -10.168  18.245  11.121
   10    HE3  LYS  27           HE3      LYS  27  -9.424  18.551   9.548
   11    HZ3  LYS  27           HZ1      LYS  27 -11.799  18.396   9.299
   12    HZ2  LYS  27           HZ2      LYS  27 -11.832  16.882  10.073
   13    HZ1  LYS  27           HZ3      LYS  27 -11.084  17.050   8.553

  No H/Q in entry =          13
  In of MODEL   22
    1    H    GLN  28           H        GLN  28  -6.010  14.550  13.801
    2    HA   GLN  28           HA       GLN  28  -6.934  16.548  15.568
    3    HB2  GLN  28           HB2      GLN  28  -5.502  13.937  16.125
    4    HB3  GLN  28           HB3      GLN  28  -6.263  14.935  17.365
    5    HG2  GLN  28           HG2      GLN  28  -7.695  13.785  14.953
    6    HG3  GLN  28           HG3      GLN  28  -7.755  13.104  16.579
    7   HE21  GLN  28          HE21      GLN  28  -9.634  14.874  14.587
    8   HE22  GLN  28          HE22      GLN  28 -10.403  15.890  15.707

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ALA  29           H        ALA  29  -3.699  15.287  14.893
    2    HA   ALA  29           HA       ALA  29  -2.282  16.706  16.871
    3    HB1  ALA  29           HB1      ALA  29  -0.341  16.033  15.760
    4    HB3  ALA  29           HB2      ALA  29  -1.092  16.144  14.169
    5    HB2  ALA  29           HB3      ALA  29  -1.502  14.810  15.246

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LYS  30           H        LYS  30  -3.139  17.567  13.537
    2    HA   LYS  30           HA       LYS  30  -1.753  20.020  13.434
    3    HB2  LYS  30           HB2      LYS  30  -4.271  19.118  12.020
    4    HB3  LYS  30           HB3      LYS  30  -3.450  20.640  11.674
    5    HG2  LYS  30           HG2      LYS  30  -1.367  19.365  11.170
    6    HG3  LYS  30           HG3      LYS  30  -2.260  17.861  11.417
    7    HD2  LYS  30           HD2      LYS  30  -3.824  18.482   9.616
    8    HD3  LYS  30           HD3      LYS  30  -2.954  19.998   9.371
    9    HE2  LYS  30           HE2      LYS  30  -0.909  18.722   8.801
   10    HE3  LYS  30           HE3      LYS  30  -1.798  17.211   9.015
   11    HZ2  LYS  30           HZ1      LYS  30  -1.622  18.077   6.671
   12    HZ1  LYS  30           HZ2      LYS  30  -2.679  19.332   7.133
   13    HZ3  LYS  30           HZ3      LYS  30  -3.189  17.710   7.207

  No H/Q in entry =          13
  In of MODEL   22
    1    H    GLN  31           H        GLN  31  -4.850  19.145  14.839
    2    HA   GLN  31           HA       GLN  31  -5.637  21.896  15.282
    3    HB2  GLN  31           HB2      GLN  31  -6.800  19.444  16.607
    4    HB3  GLN  31           HB3      GLN  31  -7.572  21.008  16.355
    5    HG2  GLN  31           HG2      GLN  31  -6.848  20.230  13.770
    6    HG3  GLN  31           HG3      GLN  31  -7.363  18.724  14.519
    7   HE21  GLN  31          HE21      GLN  31  -8.780  20.280  12.409
    8   HE22  GLN  31          HE22      GLN  31 -10.298  20.661  13.062

  No H/Q in entry =           8
  In of MODEL   22
    1    H    GLY  32           H        GLY  32  -3.314  19.991  16.613
    2    HA3  GLY  32           HA2      GLY  32  -1.922  20.469  18.418
    3    HA2  GLY  32           HA3      GLY  32  -3.062  21.704  18.935

  No H/Q in entry =           3
  In of MODEL   22
    1    H    ASP  33           H        ASP  33  -4.459  18.652  18.277
    2    HA   ASP  33           HA       ASP  33  -4.874  18.198  21.157
    3    HB2  ASP  33           HB2      ASP  33  -6.266  17.170  18.678
    4    HB3  ASP  33           HB3      ASP  33  -6.611  16.561  20.295

  No H/Q in entry =           4
  In of MODEL   22
    1    H    PHE  34           H        PHE  34  -2.700  17.365  21.471
    2    HA   PHE  34           HA       PHE  34  -1.679  15.120  20.078
    3    HB2  PHE  34           HB2      PHE  34  -1.077  16.116  22.872
    4    HB3  PHE  34           HB3      PHE  34  -0.136  14.898  22.010
    5    HD1  PHE  34           HD1      PHE  34  -0.337  18.324  22.736
    6    HD2  PHE  34           HD2      PHE  34   0.523  15.619  19.510
    7    HE1  PHE  34           HE1      PHE  34   0.948  20.102  21.581
    8    HE2  PHE  34           HE2      PHE  34   1.803  17.401  18.360
    9    HZ   PHE  34           HZ       PHE  34   2.017  19.639  19.400

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ALA  35           H        ALA  35  -3.728  15.388  22.935
    2    HA   ALA  35           HA       ALA  35  -3.498  12.730  23.838
    3    HB3  ALA  35           HB1      ALA  35  -5.963  13.339  24.687
    4    HB1  ALA  35           HB2      ALA  35  -5.441  14.960  24.229
    5    HB2  ALA  35           HB3      ALA  35  -4.523  14.046  25.425

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA  36           H        ALA  36  -5.954  14.223  21.728
    2    HA   ALA  36           HA       ALA  36  -7.350  11.800  21.252
    3    HB1  ALA  36           HB1      ALA  36  -8.814  13.209  20.289
    4    HB3  ALA  36           HB2      ALA  36  -7.641  13.636  19.042
    5    HB2  ALA  36           HB3      ALA  36  -7.677  14.526  20.564

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA  37           H        ALA  37  -4.677  13.404  19.587
    2    HA   ALA  37           HA       ALA  37  -4.624  11.763  17.294
    3    HB3  ALA  37           HB1      ALA  37  -2.648  13.493  18.718
    4    HB2  ALA  37           HB2      ALA  37  -3.174  13.541  17.036
    5    HB1  ALA  37           HB3      ALA  37  -2.013  12.321  17.563

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LYS  38           H        LYS  38  -2.873  11.477  20.377
    2    HA   LYS  38           HA       LYS  38  -1.528   9.087  19.897
    3    HB2  LYS  38           HB2      LYS  38  -1.870  10.851  22.038
    4    HB3  LYS  38           HB3      LYS  38  -2.479   9.319  22.656
    5    HG2  LYS  38           HG2      LYS  38  -0.375   8.213  22.127
    6    HG3  LYS  38           HG3      LYS  38   0.225   9.661  21.312
    7    HD2  LYS  38           HD2      LYS  38   0.379  10.885  23.345
    8    HD3  LYS  38           HD3      LYS  38  -0.633   9.729  24.212
    9    HE2  LYS  38           HE2      LYS  38   1.723   9.432  24.838
   10    HE3  LYS  38           HE3      LYS  38   1.132   8.010  23.975
   11    HZ3  LYS  38           HZ1      LYS  38   2.433   8.434  22.197
   12    HZ2  LYS  38           HZ2      LYS  38   3.379   9.272  23.334
   13    HZ1  LYS  38           HZ3      LYS  38   2.296  10.122  22.338

  No H/Q in entry =          13
  In of MODEL   22
    1    H    ALA  39           H        ALA  39  -4.774   9.560  21.290
    2    HA   ALA  39           HA       ALA  39  -5.315   6.838  21.799
    3    HB3  ALA  39           HB1      ALA  39  -7.486   8.764  21.022
    4    HB2  ALA  39           HB2      ALA  39  -6.594   9.001  22.525
    5    HB1  ALA  39           HB3      ALA  39  -7.499   7.509  22.262

  No H/Q in entry =           5
  In of MODEL   22
    1    H    MET  40           H        MET  40  -5.907   8.840  18.946
    2    HA   MET  40           HA       MET  40  -7.365   6.893  17.486
    3    HB2  MET  40           HB2      MET  40  -5.771   9.299  16.581
    4    HB3  MET  40           HB3      MET  40  -6.787   8.330  15.510
    5    HG2  MET  40           HG2      MET  40  -7.838   9.576  18.062
    6    HG3  MET  40           HG3      MET  40  -7.897  10.407  16.510
    7    HE3  MET  40           HE1      MET  40 -10.463   8.763  14.442
    8    HE2  MET  40           HE2      MET  40  -8.711   8.894  14.299
    9    HE1  MET  40           HE3      MET  40  -9.641  10.253  14.927

  No H/Q in entry =           9
  In of MODEL   22
    1    H    MET  41           H        MET  41  -3.880   7.659  17.616
    2    HA   MET  41           HA       MET  41  -3.102   5.906  15.522
    3    HB2  MET  41           HB2      MET  41  -1.497   6.590  17.998
    4    HB3  MET  41           HB3      MET  41  -0.871   5.944  16.485
    5    HG2  MET  41           HG2      MET  41  -2.042   8.115  15.474
    6    HG3  MET  41           HG3      MET  41  -1.815   8.709  17.117
    7    HE2  MET  41           HE1      MET  41   1.119   6.635  17.491
    8    HE1  MET  41           HE2      MET  41   0.317   7.924  18.385
    9    HE3  MET  41           HE3      MET  41   1.941   8.179  17.746

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ASP  42           H        ASP  42  -3.492   5.437  19.008
    2    HA   ASP  42           HA       ASP  42  -2.436   2.852  19.177
    3    HB2  ASP  42           HB2      ASP  42  -3.329   4.608  20.993
    4    HB3  ASP  42           HB3      ASP  42  -4.747   3.571  20.919

  No H/Q in entry =           4
  In of MODEL   22
    1    H    GLN  43           H        GLN  43  -5.777   3.927  18.665
    2    HA   GLN  43           HA       GLN  43  -6.898   1.330  18.472
    3    HB2  GLN  43           HB2      GLN  43  -7.840   3.972  17.335
    4    HB3  GLN  43           HB3      GLN  43  -8.791   2.484  17.313
    5    HG2  GLN  43           HG2      GLN  43  -8.503   2.371  19.822
    6    HG3  GLN  43           HG3      GLN  43  -7.792   3.982  19.749
    7   HE21  GLN  43          HE21      GLN  43  -9.976   4.047  21.243
    8   HE22  GLN  43          HE22      GLN  43 -11.339   4.609  20.406

  No H/Q in entry =           8
  In of MODEL   22
    1    H    SER  44           H        SER  44  -5.570   3.550  16.059
    2    HA   SER  44           HA       SER  44  -6.252   2.055  13.771
    3    HB2  SER  44           HB2      SER  44  -5.017   4.450  14.214
    4    HB3  SER  44           HB3      SER  44  -3.653   3.464  13.690
    5    HG   SER  44           HG       SER  44  -4.768   4.423  11.921

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ARG  45           H        ARG  45  -3.379   1.970  15.860
    2    HA   ARG  45           HA       ARG  45  -1.879   0.026  14.487
    3    HB2  ARG  45           HB2      ARG  45  -1.054   1.458  16.355
    4    HB3  ARG  45           HB3      ARG  45  -2.041   0.521  17.474
    5    HG2  ARG  45           HG2      ARG  45  -0.791  -1.529  16.839
    6    HG3  ARG  45           HG3      ARG  45   0.220  -0.567  15.762
    7    HD2  ARG  45           HD2      ARG  45   0.937   0.824  17.717
    8    HD3  ARG  45           HD3      ARG  45   0.021  -0.257  18.790
    9    HE   ARG  45           HE       ARG  45   1.738  -1.841  17.218
   10   HH21  ARG  45          HH11      ARG  45   3.643  -2.646  18.062
   11   HH22  ARG  45          HH12      ARG  45   4.405  -1.851  19.394
   12   HH11  ARG  45          HH21      ARG  45   2.013   0.633  19.604
   13   HH12  ARG  45          HH22      ARG  45   3.482   0.008  20.264

  No H/Q in entry =          13
  In of MODEL   22
    1    H    MET  46           H        MET  46  -4.281  -0.309  17.080
    2    HA   MET  46           HA       MET  46  -4.091  -3.107  17.393
    3    HB2  MET  46           HB2      MET  46  -6.276  -1.115  17.985
    4    HB3  MET  46           HB3      MET  46  -6.475  -2.836  18.323
    5    HG2  MET  46           HG2      MET  46  -4.484  -2.818  19.744
    6    HG3  MET  46           HG3      MET  46  -4.196  -1.128  19.363
    7    HE1  MET  46           HE1      MET  46  -6.301  -3.773  20.831
    8    HE3  MET  46           HE2      MET  46  -7.769  -2.970  20.284
    9    HE2  MET  46           HE3      MET  46  -7.393  -3.024  22.004

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ALA  47           H        ALA  47  -6.121  -1.110  15.288
    2    HA   ALA  47           HA       ALA  47  -7.719  -3.176  14.222
    3    HB3  ALA  47           HB1      ALA  47  -8.416  -0.945  13.799
    4    HB1  ALA  47           HB2      ALA  47  -7.917  -1.577  12.230
    5    HB2  ALA  47           HB3      ALA  47  -6.848  -0.499  13.129

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU  48           H        LEU  48  -4.608  -1.845  13.178
    2    HA   LEU  48           HA       LEU  48  -4.307  -3.438  10.841
    3    HB2  LEU  48           HB2      LEU  48  -2.266  -2.141  12.653
    4    HB3  LEU  48           HB3      LEU  48  -1.886  -2.861  11.089
    5    HG   LEU  48           HG       LEU  48  -3.927  -0.658  11.467
    6   HD13  LEU  48          HD11      LEU  48  -1.814   0.235  12.138
    7   HD12  LEU  48          HD12      LEU  48  -2.087   0.783  10.484
    8   HD11  LEU  48          HD13      LEU  48  -0.981  -0.555  10.799
    9   HD22  LEU  48          HD21      LEU  48  -4.385  -1.650   9.392
   10   HD21  LEU  48          HD22      LEU  48  -2.698  -2.073   9.103
   11   HD23  LEU  48          HD23      LEU  48  -3.228  -0.398   8.939

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ASN  49           H        ASN  49  -3.270  -3.821  14.191
    2    HA   ASN  49           HA       ASN  49  -1.651  -6.074  13.870
    3    HB2  ASN  49           HB2      ASN  49  -1.709  -4.720  15.914
    4    HB3  ASN  49           HB3      ASN  49  -3.353  -5.251  16.240
    5   HD21  ASN  49          HD21      ASN  49  -2.884  -6.372  18.195
    6   HD22  ASN  49          HD22      ASN  49  -1.914  -7.763  18.245

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLU  50           H        GLU  50  -5.123  -5.820  14.530
    2    HA   GLU  50           HA       GLU  50  -5.618  -8.623  14.641
    3    HB2  GLU  50           HB2      GLU  50  -7.217  -6.944  15.509
    4    HB3  GLU  50           HB3      GLU  50  -7.509  -6.385  13.861
    5    HG2  GLU  50           HG2      GLU  50  -8.358  -8.587  13.224
    6    HG3  GLU  50           HG3      GLU  50  -7.978  -9.226  14.820

  No H/Q in entry =           6
  In of MODEL   22
    1    H    ALA  51           H        ALA  51  -5.692  -6.230  12.041
    2    HA   ALA  51           HA       ALA  51  -6.660  -7.967  10.019
    3    HB2  ALA  51           HB1      ALA  51  -6.447  -6.155   8.647
    4    HB1  ALA  51           HB2      ALA  51  -4.811  -5.796   9.200
    5    HB3  ALA  51           HB3      ALA  51  -6.201  -5.291  10.164

  No H/Q in entry =           5
  In of MODEL   22
    1    H    HIS  52           H        HIS  52  -3.378  -7.039  11.012
    2    HA   HIS  52           HA       HIS  52  -1.964  -8.524   9.070
    3    HB2  HIS  52           HB2      HIS  52  -0.945  -6.781  10.510
    4    HB3  HIS  52           HB3      HIS  52  -1.113  -7.855  11.899
    5    HD1  HIS  52           HD1      HIS  52   0.277 -10.133  11.797
    6    HD2  HIS  52           HD2      HIS  52   1.268  -7.318   8.885
    7    HE1  HIS  52           HE1      HIS  52   2.506 -10.852  10.834
    8    HE2  HIS  52           HE2      HIS  52   3.124  -9.147   9.057

  No H/Q in entry =           8
  In of MODEL   22
    1    H    LEU  53           H        LEU  53  -3.182  -9.402  12.280
    2    HA   LEU  53           HA       LEU  53  -1.972 -11.940  12.482
    3    HB2  LEU  53           HB2      LEU  53  -4.468 -10.771  13.685
    4    HB3  LEU  53           HB3      LEU  53  -3.999 -12.442  13.983
    5    HG   LEU  53           HG       LEU  53  -2.114 -10.111  14.458
    6   HD11  LEU  53          HD11      LEU  53  -4.045 -11.468  16.360
    7   HD13  LEU  53          HD12      LEU  53  -4.021  -9.765  15.905
    8   HD12  LEU  53          HD13      LEU  53  -2.719 -10.434  16.881
    9   HD23  LEU  53          HD21      LEU  53  -1.225 -11.907  16.148
   10   HD22  LEU  53          HD22      LEU  53  -0.826 -12.082  14.442
   11   HD21  LEU  53          HD23      LEU  53  -2.102 -13.057  15.145

  No H/Q in entry =          11
  In of MODEL   22
    1    H    VAL  54           H        VAL  54  -5.083 -10.928  11.107
    2    HA   VAL  54           HA       VAL  54  -5.982 -13.528  10.421
    3    HB   VAL  54           HB       VAL  54  -6.638 -10.800   9.280
    4   HG12  VAL  54          HG11      VAL  54  -8.731 -12.190   8.463
    5   HG11  VAL  54          HG12      VAL  54  -7.613 -13.550   8.542
    6   HG13  VAL  54          HG13      VAL  54  -7.256 -12.175   7.499
    7   HG22  VAL  54          HG21      VAL  54  -7.552 -10.839  11.429
    8   HG21  VAL  54          HG22      VAL  54  -7.798 -12.583  11.411
    9   HG23  VAL  54          HG23      VAL  54  -8.881 -11.533  10.499

  No H/Q in entry =           9
  In of MODEL   22
    1    H    GLN  55           H        GLN  55  -4.116 -11.071   8.635
    2    HA   GLN  55           HA       GLN  55  -3.971 -12.539   6.220
    3    HB2  GLN  55           HB2      GLN  55  -3.377 -10.272   6.028
    4    HB3  GLN  55           HB3      GLN  55  -2.270 -10.341   7.397
    5    HG2  GLN  55           HG2      GLN  55  -0.545 -11.181   6.128
    6    HG3  GLN  55           HG3      GLN  55  -1.610 -12.163   5.132
    7   HE21  GLN  55          HE21      GLN  55  -1.623 -11.476   3.010
    8   HE22  GLN  55          HE22      GLN  55  -1.431  -9.872   2.498

  No H/Q in entry =           8
  In of MODEL   22
    1    H    THR  56           H        THR  56  -1.875 -12.503   9.108
    2    HA   THR  56           HA       THR  56   0.214 -14.095   8.201
    3    HB   THR  56           HB       THR  56  -1.036 -14.348  10.945
    4    HG1  THR  56           HG1      THR  56   0.648 -12.381   9.816
    5   HG21  THR  56          HG21      THR  56   0.918 -15.849  10.032
    6   HG23  THR  56          HG22      THR  56   1.042 -15.141  11.644
    7   HG22  THR  56          HG23      THR  56   1.891 -14.402  10.286

  No H/Q in entry =           7
  In of MODEL   22
    1    H    LYS  57           H        LYS  57  -2.907 -15.142   9.555
    2    HA   LYS  57           HA       LYS  57  -2.448 -17.936   9.315
    3    HB2  LYS  57           HB2      LYS  57  -4.280 -16.819  10.644
    4    HB3  LYS  57           HB3      LYS  57  -5.075 -16.431   9.126
    5    HG2  LYS  57           HG2      LYS  57  -4.321 -19.275   9.524
    6    HG3  LYS  57           HG3      LYS  57  -5.629 -18.665  10.535
    7    HD2  LYS  57           HD2      LYS  57  -6.827 -17.889   8.514
    8    HD3  LYS  57           HD3      LYS  57  -5.527 -18.516   7.502
    9    HE2  LYS  57           HE2      LYS  57  -5.961 -20.799   8.344
   10    HE3  LYS  57           HE3      LYS  57  -7.254 -20.189   9.374
   11    HZ1  LYS  57           HZ1      LYS  57  -8.091 -19.218   7.107
   12    HZ3  LYS  57           HZ2      LYS  57  -8.438 -20.819   7.561
   13    HZ2  LYS  57           HZ3      LYS  57  -7.177 -20.498   6.466

  No H/Q in entry =          13
  In of MODEL   22
    1    H    LEU  58           H        LEU  58  -3.782 -15.503   7.131
    2    HA   LEU  58           HA       LEU  58  -4.570 -17.335   5.125
    3    HB2  LEU  58           HB2      LEU  58  -3.975 -14.384   4.986
    4    HB3  LEU  58           HB3      LEU  58  -4.630 -15.326   3.646
    5    HG   LEU  58           HG       LEU  58  -5.920 -15.147   6.388
    6   HD11  LEU  58          HD11      LEU  58  -6.218 -13.505   3.893
    7   HD13  LEU  58          HD12      LEU  58  -6.216 -12.995   5.581
    8   HD12  LEU  58          HD13      LEU  58  -7.633 -13.795   4.905
    9   HD22  LEU  58          HD21      LEU  58  -6.872 -17.061   5.519
   10   HD21  LEU  58          HD22      LEU  58  -6.528 -16.611   3.849
   11   HD23  LEU  58          HD23      LEU  58  -7.897 -15.889   4.693

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  59           H        ILE  59  -1.442 -16.110   5.995
    2    HA   ILE  59           HA       ILE  59  -0.332 -16.838   3.363
    3    HB   ILE  59           HB       ILE  59   0.422 -14.766   4.930
    4   HG12  ILE  59          HG12      ILE  59   2.522 -16.417   3.509
    5   HG13  ILE  59          HG13      ILE  59   1.331 -15.475   2.650
    6   HG22  ILE  59          HG21      ILE  59   2.517 -16.799   5.642
    7   HG21  ILE  59          HG22      ILE  59   1.153 -16.540   6.705
    8   HG23  ILE  59          HG23      ILE  59   2.257 -15.217   6.338
    9   HD13  ILE  59          HD11      ILE  59   3.319 -14.119   2.884
   10   HD12  ILE  59          HD12      ILE  59   3.367 -14.432   4.618
   11   HD11  ILE  59          HD13      ILE  59   2.072 -13.448   3.934

  No H/Q in entry =          11
  In of MODEL   22
    1    H    GLU  60           H        GLU  60  -0.351 -17.938   6.733
    2    HA   GLU  60           HA       GLU  60   1.688 -19.909   6.480
    3    HB2  GLU  60           HB2      GLU  60   0.892 -19.108   8.662
    4    HB3  GLU  60           HB3      GLU  60  -0.691 -19.816   8.354
    5    HG2  GLU  60           HG2      GLU  60   0.330 -22.061   8.238
    6    HG3  GLU  60           HG3      GLU  60   1.918 -21.355   8.530

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLY  61           H        GLY  61  -1.820 -20.021   5.981
    2    HA3  GLY  61           HA2      GLY  61  -1.558 -22.814   5.029
    3    HA2  GLY  61           HA3      GLY  61  -3.048 -22.083   5.615

  No H/Q in entry =           3
  In of MODEL   22
    1    H    ASP  62           H        ASP  62  -0.818 -20.497   3.419
    2    HA   ASP  62           HA       ASP  62  -2.904 -19.976   1.527
    3    HB2  ASP  62           HB2      ASP  62  -1.064 -18.890   0.245
    4    HB3  ASP  62           HB3      ASP  62  -1.165 -18.334   1.912

  No H/Q in entry =           4
  In of MODEL   22
    1    H    ALA  63           H        ALA  63  -2.271 -22.860   1.911
    2    HA   ALA  63           HA       ALA  63  -0.804 -23.913  -0.272
    3    HB2  ALA  63           HB1      ALA  63  -3.204 -25.260   0.929
    4    HB1  ALA  63           HB2      ALA  63  -1.676 -25.128   1.800
    5    HB3  ALA  63           HB3      ALA  63  -1.744 -25.995   0.265

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLY  64           H        GLY  64  -4.211 -23.036   0.124
    2    HA3  GLY  64           HA2      GLY  64  -5.944 -22.816  -1.364
    3    HA2  GLY  64           HA3      GLY  64  -4.717 -22.227  -2.474

  No H/Q in entry =           3
  In of MODEL   22
    1    H    GLU  65           H        GLU  65  -4.821 -23.259  -4.384
    2    HA   GLU  65           HA       GLU  65  -6.205 -25.700  -4.728
    3    HB2  GLU  65           HB2      GLU  65  -4.320 -24.208  -6.551
    4    HB3  GLU  65           HB3      GLU  65  -5.226 -25.641  -7.038
    5    HG2  GLU  65           HG2      GLU  65  -7.338 -24.523  -6.525
    6    HG3  GLU  65           HG3      GLU  65  -6.471 -23.107  -5.936

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLY  66           H        GLY  66  -2.816 -24.942  -4.470
    2    HA3  GLY  66           HA2      GLY  66  -2.134 -27.629  -3.693
    3    HA2  GLY  66           HA3      GLY  66  -1.465 -27.153  -5.241

  No H/Q in entry =           3
  In of MODEL   22
    1    H    LYS  67           H        LYS  67   0.266 -27.894  -3.395
    2    HA   LYS  67           HA       LYS  67   1.174 -26.039  -1.531
    3    HB2  LYS  67           HB2      LYS  67   2.728 -28.153  -3.025
    4    HB3  LYS  67           HB3      LYS  67   3.259 -27.344  -1.545
    5    HG2  LYS  67           HG2      LYS  67   0.613 -28.800  -1.759
    6    HG3  LYS  67           HG3      LYS  67   2.089 -29.583  -1.200
    7    HD2  LYS  67           HD2      LYS  67   2.244 -27.617   0.486
    8    HD3  LYS  67           HD3      LYS  67   0.543 -27.345   0.095
    9    HE2  LYS  67           HE2      LYS  67   0.011 -29.664   0.712
   10    HE3  LYS  67           HE3      LYS  67   1.711 -29.972   1.064
   11    HZ1  LYS  67           HZ1      LYS  67   0.843 -27.666   2.441
   12    HZ3  LYS  67           HZ2      LYS  67   1.454 -29.120   3.072
   13    HZ2  LYS  67           HZ3      LYS  67  -0.211 -28.951   2.779

  No H/Q in entry =          13
  In of MODEL   22
    1    H    MET  68           H        MET  68   2.134 -26.463  -4.875
    2    HA   MET  68           HA       MET  68   4.260 -24.620  -4.971
    3    HB2  MET  68           HB2      MET  68   2.482 -25.901  -7.013
    4    HB3  MET  68           HB3      MET  68   3.645 -24.665  -7.494
    5    HG2  MET  68           HG2      MET  68   4.596 -26.956  -7.661
    6    HG3  MET  68           HG3      MET  68   5.473 -25.955  -6.501
    7    HE1  MET  68           HE1      MET  68   5.657 -26.270  -4.114
    8    HE3  MET  68           HE2      MET  68   6.537 -27.549  -4.949
    9    HE2  MET  68           HE3      MET  68   5.612 -27.927  -3.498

  No H/Q in entry =           9
  In of MODEL   22
    1    H    LYS  69           H        LYS  69   0.793 -24.168  -5.634
    2    HA   LYS  69           HA       LYS  69   1.313 -21.327  -6.141
    3    HB2  LYS  69           HB2      LYS  69   0.141 -22.506  -7.924
    4    HB3  LYS  69           HB3      LYS  69  -1.171 -22.893  -6.804
    5    HG2  LYS  69           HG2      LYS  69  -1.637 -20.541  -6.444
    6    HG3  LYS  69           HG3      LYS  69  -0.237 -20.076  -7.409
    7    HD2  LYS  69           HD2      LYS  69  -1.262 -21.135  -9.395
    8    HD3  LYS  69           HD3      LYS  69  -2.674 -21.564  -8.426
    9    HE2  LYS  69           HE2      LYS  69  -1.682 -18.723  -8.781
   10    HE3  LYS  69           HE3      LYS  69  -2.957 -19.445  -9.762
   11    HZ2  LYS  69           HZ1      LYS  69  -3.286 -18.196  -7.361
   12    HZ1  LYS  69           HZ2      LYS  69  -3.380 -19.846  -6.967
   13    HZ3  LYS  69           HZ3      LYS  69  -4.425 -19.189  -8.134

  No H/Q in entry =          13
  In of MODEL   22
    1    H    VAL  70           H        VAL  70   0.039 -19.646  -5.284
    2    HA   VAL  70           HA       VAL  70  -1.389 -20.310  -2.768
    3    HB   VAL  70           HB       VAL  70  -0.589 -18.123  -1.908
    4   HG13  VAL  70          HG11      VAL  70   0.783 -19.871  -1.178
    5   HG12  VAL  70          HG12      VAL  70   1.944 -18.794  -1.955
    6   HG11  VAL  70          HG13      VAL  70   1.363 -20.225  -2.806
    7   HG23  VAL  70          HG21      VAL  70   1.049 -18.038  -4.477
    8   HG22  VAL  70          HG22      VAL  70   1.157 -16.887  -3.147
    9   HG21  VAL  70          HG23      VAL  70  -0.316 -16.983  -4.106

  No H/Q in entry =           9
  In of MODEL   22
    1    H    SER  71           H        SER  71  -2.968 -18.643  -2.133
    2    HA   SER  71           HA       SER  71  -4.851 -18.081  -4.165
    3    HB2  SER  71           HB2      SER  71  -5.395 -18.278  -1.715
    4    HB3  SER  71           HB3      SER  71  -4.592 -16.733  -1.452
    5    HG   SER  71           HG       SER  71  -6.902 -17.295  -2.996

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU  72           H        LEU  72  -5.073 -16.418  -5.501
    2    HA   LEU  72           HA       LEU  72  -2.972 -14.596  -5.979
    3    HB2  LEU  72           HB2      LEU  72  -5.834 -14.664  -6.933
    4    HB3  LEU  72           HB3      LEU  72  -4.640 -13.503  -7.508
    5    HG   LEU  72           HG       LEU  72  -4.210 -16.506  -7.629
    6   HD11  LEU  72          HD11      LEU  72  -6.194 -15.771  -8.975
    7   HD13  LEU  72          HD12      LEU  72  -4.875 -16.393  -9.966
    8   HD12  LEU  72          HD13      LEU  72  -5.141 -14.654  -9.843
    9   HD22  LEU  72          HD21      LEU  72  -2.106 -15.509  -7.902
   10   HD21  LEU  72          HD22      LEU  72  -2.758 -14.081  -8.690
   11   HD23  LEU  72          HD23      LEU  72  -2.669 -15.605  -9.567

  No H/Q in entry =          11
  In of MODEL   22
    1    H    VAL  73           H        VAL  73  -6.071 -14.252  -4.358
    2    HA   VAL  73           HA       VAL  73  -6.131 -11.481  -4.011
    3    HB   VAL  73           HB       VAL  73  -7.839 -11.850  -2.410
    4   HG12  VAL  73          HG11      VAL  73  -8.030 -14.307  -4.144
    5   HG11  VAL  73          HG12      VAL  73  -8.118 -12.695  -4.852
    6   HG13  VAL  73          HG13      VAL  73  -9.313 -13.198  -3.655
    7   HG22  VAL  73          HG21      VAL  73  -7.015 -13.316  -0.803
    8   HG21  VAL  73          HG22      VAL  73  -6.396 -14.448  -2.005
    9   HG23  VAL  73          HG23      VAL  73  -8.126 -14.377  -1.669

  No H/Q in entry =           9
  In of MODEL   22
    1    H    LEU  74           H        LEU  74  -4.185 -13.838  -2.419
    2    HA   LEU  74           HA       LEU  74  -3.786 -12.692   0.103
    3    HB2  LEU  74           HB2      LEU  74  -2.990 -14.906  -0.387
    4    HB3  LEU  74           HB3      LEU  74  -1.939 -14.294  -1.664
    5    HG   LEU  74           HG       LEU  74  -0.632 -13.035   0.009
    6   HD13  LEU  74          HD11      LEU  74  -2.209 -12.526   1.718
    7   HD12  LEU  74          HD12      LEU  74  -1.115 -13.699   2.455
    8   HD11  LEU  74          HD13      LEU  74  -2.699 -14.214   1.873
    9   HD22  LEU  74          HD21      LEU  74   0.580 -14.875   0.645
   10   HD21  LEU  74          HD22      LEU  74  -0.465 -15.599  -0.556
   11   HD23  LEU  74          HD23      LEU  74  -0.851 -15.779   1.139

  No H/Q in entry =          11
  In of MODEL   22
    1    H    VAL  75           H        VAL  75  -1.890 -12.292  -2.850
    2    HA   VAL  75           HA       VAL  75  -0.104 -10.358  -1.837
    3    HB   VAL  75           HB       VAL  75  -1.050 -10.857  -4.660
    4   HG11  VAL  75          HG11      VAL  75   1.203  -9.103  -3.584
    5   HG13  VAL  75          HG12      VAL  75  -0.215  -8.559  -4.468
    6   HG12  VAL  75          HG13      VAL  75   0.999  -9.536  -5.277
    7   HG23  VAL  75          HG21      VAL  75   1.578 -11.525  -3.299
    8   HG22  VAL  75          HG22      VAL  75   1.004 -12.099  -4.865
    9   HG21  VAL  75          HG23      VAL  75   0.229 -12.659  -3.383

  No H/Q in entry =           9
  In of MODEL   22
    1    H    GLU  76           H        GLU  76  -3.252 -10.028  -3.503
    2    HA   GLU  76           HA       GLU  76  -3.318  -7.214  -3.607
    3    HB2  GLU  76           HB2      GLU  76  -4.966  -8.662  -4.773
    4    HB3  GLU  76           HB3      GLU  76  -5.620  -9.162  -3.222
    5    HG2  GLU  76           HG2      GLU  76  -7.080  -7.457  -4.107
    6    HG3  GLU  76           HG3      GLU  76  -6.210  -6.743  -2.763

  No H/Q in entry =           6
  In of MODEL   22
    1    H    ALA  77           H        ALA  77  -4.424  -9.445  -1.068
    2    HA   ALA  77           HA       ALA  77  -5.394  -7.446   0.686
    3    HB3  ALA  77           HB1      ALA  77  -6.070  -9.684   1.111
    4    HB2  ALA  77           HB2      ALA  77  -5.019  -9.245   2.457
    5    HB1  ALA  77           HB3      ALA  77  -4.404 -10.260   1.153

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLN  78           H        GLN  78  -2.239  -8.981   0.331
    2    HA   GLN  78           HA       GLN  78  -0.992  -7.812   2.583
    3    HB2  GLN  78           HB2      GLN  78  -0.121  -9.750   1.226
    4    HB3  GLN  78           HB3      GLN  78   0.320  -8.599  -0.032
    5    HG2  GLN  78           HG2      GLN  78   1.765  -7.404   1.564
    6    HG3  GLN  78           HG3      GLN  78   1.329  -8.556   2.825
    7   HE21  GLN  78          HE21      GLN  78   4.056  -8.242   1.963
    8   HE22  GLN  78          HE22      GLN  78   4.530  -9.676   1.185

  No H/Q in entry =           8
  In of MODEL   22
    1    H    LEU  79           H        LEU  79  -1.355  -6.756  -0.766
    2    HA   LEU  79           HA       LEU  79   0.322  -4.522  -0.751
    3    HB2  LEU  79           HB2      LEU  79  -0.697  -5.335  -2.806
    4    HB3  LEU  79           HB3      LEU  79  -2.303  -4.949  -2.202
    5    HG   LEU  79           HG       LEU  79  -1.769  -2.560  -2.178
    6   HD13  LEU  79          HD11      LEU  79   0.469  -2.307  -1.660
    7   HD12  LEU  79          HD12      LEU  79   0.521  -2.021  -3.399
    8   HD11  LEU  79          HD13      LEU  79   0.980  -3.596  -2.750
    9   HD23  LEU  79          HD21      LEU  79  -1.129  -2.362  -4.728
   10   HD22  LEU  79          HD22      LEU  79  -2.654  -3.115  -4.272
   11   HD21  LEU  79          HD23      LEU  79  -1.276  -4.119  -4.712

  No H/Q in entry =          11
  In of MODEL   22
    1    H    HIS  80           H        HIS  80  -3.146  -4.697   0.067
    2    HA   HIS  80           HA       HIS  80  -3.350  -1.941   0.727
    3    HB2  HIS  80           HB2      HIS  80  -5.043  -4.356   1.045
    4    HB3  HIS  80           HB3      HIS  80  -5.371  -3.016   2.146
    5    HD1  HIS  80           HD1      HIS  80  -6.992  -1.386   1.233
    6    HD2  HIS  80           HD2      HIS  80  -4.786  -3.193  -1.807
    7    HE1  HIS  80           HE1      HIS  80  -7.831  -0.394  -0.949
    8    HE2  HIS  80           HE2      HIS  80  -6.492  -1.490  -2.812

  No H/Q in entry =           8
  In of MODEL   22
    1    H    LEU  81           H        LEU  81  -2.855  -4.832   2.725
    2    HA   LEU  81           HA       LEU  81  -2.854  -3.482   5.208
    3    HB2  LEU  81           HB2      LEU  81  -1.624  -6.095   4.334
    4    HB3  LEU  81           HB3      LEU  81  -1.604  -5.534   6.007
    5    HG   LEU  81           HG       LEU  81  -4.145  -5.797   4.373
    6   HD12  LEU  81          HD11      LEU  81  -4.444  -7.862   5.922
    7   HD11  LEU  81          HD12      LEU  81  -2.693  -7.785   6.112
    8   HD13  LEU  81          HD13      LEU  81  -3.397  -8.020   4.512
    9   HD23  LEU  81          HD21      LEU  81  -4.993  -6.000   6.873
   10   HD22  LEU  81          HD22      LEU  81  -4.672  -4.411   6.182
   11   HD21  LEU  81          HD23      LEU  81  -3.485  -5.167   7.245

  No H/Q in entry =          11
  In of MODEL   22
    1    H    MET  82           H        MET  82  -0.164  -4.379   3.044
    2    HA   MET  82           HA       MET  82   1.912  -3.476   4.732
    3    HB2  MET  82           HB2      MET  82   1.705  -3.822   1.740
    4    HB3  MET  82           HB3      MET  82   3.184  -3.246   2.506
    5    HG2  MET  82           HG2      MET  82   1.783  -5.839   3.230
    6    HG3  MET  82           HG3      MET  82   3.156  -5.726   2.133
    7    HE3  MET  82           HE1      MET  82   6.165  -4.979   4.123
    8    HE2  MET  82           HE2      MET  82   5.240  -3.615   3.501
    9    HE1  MET  82           HE3      MET  82   5.335  -5.106   2.567

  No H/Q in entry =           9
  In of MODEL   22
    1    H    THR  83           H        THR  83   0.091  -1.843   2.169
    2    HA   THR  83           HA       THR  83   1.496   0.610   2.256
    3    HB   THR  83           HB       THR  83  -0.680   1.527   1.264
    4    HG1  THR  83           HG1      THR  83  -2.327   0.226   1.155
    5   HG22  THR  83          HG21      THR  83  -0.401  -0.292  -0.734
    6   HG21  THR  83          HG22      THR  83   1.099  -0.579   0.146
    7   HG23  THR  83          HG23      THR  83   0.735   1.032  -0.471

  No H/Q in entry =           7
  In of MODEL   22
    1    H    SER  84           H        SER  84  -1.511  -0.429   3.852
    2    HA   SER  84           HA       SER  84  -2.017   2.001   5.192
    3    HB2  SER  84           HB2      SER  84  -2.843  -0.838   5.758
    4    HB3  SER  84           HB3      SER  84  -3.342   0.503   6.788
    5    HG   SER  84           HG       SER  84  -3.794   0.184   3.995

  No H/Q in entry =           5
  In of MODEL   22
    1    H    MET  85           H        MET  85  -0.302  -0.925   6.329
    2    HA   MET  85           HA       MET  85   0.210   0.006   8.933
    3    HB2  MET  85           HB2      MET  85   0.509  -2.339   8.251
    4    HB3  MET  85           HB3      MET  85   1.899  -1.869   7.271
    5    HG2  MET  85           HG2      MET  85   3.055  -1.041   9.279
    6    HG3  MET  85           HG3      MET  85   1.657  -1.459  10.267
    7    HE2  MET  85           HE1      MET  85   4.729  -4.101   8.246
    8    HE1  MET  85           HE2      MET  85   4.209  -2.469   7.831
    9    HE3  MET  85           HE3      MET  85   3.291  -3.853   7.249

  No H/Q in entry =           9
  In of MODEL   22
    1    H    LEU  86           H        LEU  86   2.150   0.263   5.986
    2    HA   LEU  86           HA       LEU  86   4.359   1.580   7.145
    3    HB2  LEU  86           HB2      LEU  86   4.175   0.494   4.837
    4    HB3  LEU  86           HB3      LEU  86   3.365   1.973   4.321
    5    HG   LEU  86           HG       LEU  86   5.388   3.225   5.304
    6   HD11  LEU  86          HD11      LEU  86   6.097   0.616   6.109
    7   HD13  LEU  86          HD12      LEU  86   7.097   2.063   6.207
    8   HD12  LEU  86          HD13      LEU  86   7.212   1.013   4.797
    9   HD23  LEU  86          HD21      LEU  86   6.114   1.460   2.958
   10   HD22  LEU  86          HD22      LEU  86   6.503   3.159   3.218
   11   HD21  LEU  86          HD23      LEU  86   4.852   2.687   2.817

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ALA  87           H        ALA  87   1.447   2.815   5.552
    2    HA   ALA  87           HA       ALA  87   2.036   5.546   5.634
    3    HB1  ALA  87           HB1      ALA  87  -0.269   3.913   5.090
    4    HB3  ALA  87           HB2      ALA  87   0.040   5.573   4.588
    5    HB2  ALA  87           HB3      ALA  87  -0.757   5.252   6.130

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ARG  88           H        ARG  88   0.345   3.544   8.023
    2    HA   ARG  88           HA       ARG  88  -0.175   5.595   9.866
    3    HB2  ARG  88           HB2      ARG  88  -1.109   3.241   9.933
    4    HB3  ARG  88           HB3      ARG  88   0.431   2.745  10.643
    5    HG2  ARG  88           HG2      ARG  88  -0.053   4.821  12.259
    6    HG3  ARG  88           HG3      ARG  88  -1.718   4.492  11.800
    7    HD2  ARG  88           HD2      ARG  88  -1.824   2.644  13.049
    8    HD3  ARG  88           HD3      ARG  88  -0.232   2.065  12.522
    9    HE   ARG  88           HE       ARG  88  -0.774   3.330  14.973
   10   HH21  ARG  88          HH11      ARG  88   0.779   4.348  16.214
   11   HH22  ARG  88          HH12      ARG  88   2.299   4.777  15.512
   12   HH11  ARG  88          HH21      ARG  88   1.512   3.513  12.401
   13   HH12  ARG  88          HH22      ARG  88   2.722   4.288  13.365

  No H/Q in entry =          13
  In of MODEL   22
    1    H    GLU  89           H        GLU  89   2.627   3.382   9.652
    2    HA   GLU  89           HA       GLU  89   3.881   4.278  11.997
    3    HB2  GLU  89           HB2      GLU  89   4.548   2.259  10.658
    4    HB3  GLU  89           HB3      GLU  89   5.323   3.353   9.511
    5    HG2  GLU  89           HG2      GLU  89   6.802   4.206  11.257
    6    HG3  GLU  89           HG3      GLU  89   5.967   3.250  12.477

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LEU  90           H        LEU  90   4.203   5.431   8.668
    2    HA   LEU  90           HA       LEU  90   6.126   7.438   9.255
    3    HB2  LEU  90           HB2      LEU  90   4.126   7.097   7.024
    4    HB3  LEU  90           HB3      LEU  90   5.353   8.371   7.046
    5    HG   LEU  90           HG       LEU  90   6.034   5.437   7.386
    6   HD12  LEU  90          HD11      LEU  90   6.787   5.669   4.947
    7   HD11  LEU  90          HD12      LEU  90   5.768   7.107   4.894
    8   HD13  LEU  90          HD13      LEU  90   5.052   5.532   5.238
    9   HD22  LEU  90          HD21      LEU  90   7.926   6.593   8.070
   10   HD21  LEU  90          HD22      LEU  90   7.575   7.995   7.060
   11   HD23  LEU  90          HD23      LEU  90   8.240   6.532   6.337

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  91           H        ILE  91   2.587   7.442   9.098
    2    HA   ILE  91           HA       ILE  91   2.236  10.215   9.544
    3    HB   ILE  91           HB       ILE  91   0.451   7.834  10.086
    4   HG12  ILE  91          HG12      ILE  91   0.200  10.112   8.097
    5   HG13  ILE  91          HG13      ILE  91   1.065   8.620   7.729
    6   HG22  ILE  91          HG21      ILE  91  -1.288   9.887  10.142
    7   HG21  ILE  91          HG22      ILE  91   0.109  10.723  10.817
    8   HG23  ILE  91          HG23      ILE  91  -0.525   9.285  11.614
    9   HD13  ILE  91          HD11      ILE  91  -0.875   7.326   7.771
   10   HD12  ILE  91          HD12      ILE  91  -1.467   8.838   7.086
   11   HD11  ILE  91          HD13      ILE  91  -1.741   8.476   8.790

  No H/Q in entry =          11
  In of MODEL   22
    1    H    THR  92           H        THR  92   2.643   7.478  11.750
    2    HA   THR  92           HA       THR  92   2.189   8.854  14.171
    3    HB   THR  92           HB       THR  92   4.007   6.525  13.514
    4    HG1  THR  92           HG1      THR  92   2.041   5.760  13.410
    5   HG22  THR  92          HG21      THR  92   3.619   6.244  16.148
    6   HG21  THR  92          HG22      THR  92   3.548   8.003  16.071
    7   HG23  THR  92          HG23      THR  92   4.985   7.151  15.503

  No H/Q in entry =           7
  In of MODEL   22
    1    H    GLU  93           H        GLU  93   5.146   8.413  12.245
    2    HA   GLU  93           HA       GLU  93   6.890   9.850  13.944
    3    HB2  GLU  93           HB2      GLU  93   6.987   9.530  10.930
    4    HB3  GLU  93           HB3      GLU  93   8.323  10.067  11.946
    5    HG2  GLU  93           HG2      GLU  93   6.923   7.426  12.395
    6    HG3  GLU  93           HG3      GLU  93   8.309   7.582  11.322

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LEU  94           H        LEU  94   4.844  10.851  11.224
    2    HA   LEU  94           HA       LEU  94   5.638  13.559  11.121
    3    HB2  LEU  94           HB2      LEU  94   3.056  12.181  10.363
    4    HB3  LEU  94           HB3      LEU  94   3.307  13.909  10.119
    5    HG   LEU  94           HG       LEU  94   5.336  11.928   9.078
    6   HD11  LEU  94          HD11      LEU  94   2.594  12.465   8.007
    7   HD13  LEU  94          HD12      LEU  94   3.584  11.012   7.887
    8   HD12  LEU  94          HD13      LEU  94   3.916  12.392   6.841
    9   HD23  LEU  94          HD21      LEU  94   5.582  13.762   7.352
   10   HD22  LEU  94          HD22      LEU  94   5.990  14.260   8.994
   11   HD21  LEU  94          HD23      LEU  94   4.439  14.719   8.291

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  95           H        ILE  95   3.103  11.934  13.009
    2    HA   ILE  95           HA       ILE  95   2.046  14.281  14.196
    3    HB   ILE  95           HB       ILE  95   2.074  11.401  15.127
    4   HG12  ILE  95          HG12      ILE  95  -0.152  13.162  14.068
    5   HG13  ILE  95          HG13      ILE  95   0.812  12.105  13.041
    6   HG21  ILE  95          HG21      ILE  95   0.777  13.869  16.320
    7   HG23  ILE  95          HG22      ILE  95   1.828  12.707  17.130
    8   HG22  ILE  95          HG23      ILE  95   0.197  12.237  16.651
    9   HD13  ILE  95          HD11      ILE  95  -0.084  10.164  13.961
   10   HD12  ILE  95          HD12      ILE  95  -1.471  11.247  14.031
   11   HD11  ILE  95          HD13      ILE  95  -0.509  10.956  15.480

  No H/Q in entry =          11
  In of MODEL   22
    1    H    GLU  96           H        GLU  96   4.649  12.077  15.203
    2    HA   GLU  96           HA       GLU  96   5.191  13.283  17.694
    3    HB2  GLU  96           HB2      GLU  96   6.152  11.128  17.054
    4    HB3  GLU  96           HB3      GLU  96   7.085  11.904  15.775
    5    HG2  GLU  96           HG2      GLU  96   8.727  12.464  17.240
    6    HG3  GLU  96           HG3      GLU  96   7.573  13.273  18.291

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LEU  97           H        LEU  97   6.271  14.054  14.410
    2    HA   LEU  97           HA       LEU  97   8.144  16.063  15.123
    3    HB2  LEU  97           HB2      LEU  97   6.562  15.500  12.625
    4    HB3  LEU  97           HB3      LEU  97   7.574  16.937  12.746
    5    HG   LEU  97           HG       LEU  97   8.617  14.146  13.315
    6   HD12  LEU  97          HD11      LEU  97   9.619  14.341  11.000
    7   HD11  LEU  97          HD12      LEU  97   8.560  15.725  10.731
    8   HD13  LEU  97          HD13      LEU  97   7.869  14.130  11.026
    9   HD23  LEU  97          HD21      LEU  97  10.781  15.436  12.575
   10   HD22  LEU  97          HD22      LEU  97  10.155  15.705  14.202
   11   HD21  LEU  97          HD23      LEU  97   9.838  16.884  12.931

  No H/Q in entry =          11
  In of MODEL   22
    1    H    HIS  98           H        HIS  98   4.654  16.176  14.459
    2    HA   HIS  98           HA       HIS  98   4.338  18.974  14.587
    3    HB2  HIS  98           HB2      HIS  98   2.459  16.714  15.313
    4    HB3  HIS  98           HB3      HIS  98   1.982  18.412  15.364
    5    HD1  HIS  98           HD1      HIS  98   3.026  15.699  12.967
    6    HD2  HIS  98           HD2      HIS  98   1.627  19.624  12.833
    7    HE1  HIS  98           HE1      HIS  98   2.471  16.179  10.541
    8    HE2  HIS  98           HE2      HIS  98   1.622  18.563  10.438

  No H/Q in entry =           8
  In of MODEL   22
    1    H    GLU  99           H        GLU  99   4.478  16.492  17.092
    2    HA   GLU  99           HA       GLU  99   3.854  18.187  19.285
    3    HB2  GLU  99           HB2      GLU  99   3.780  15.704  19.386
    4    HB3  GLU  99           HB3      GLU  99   5.540  15.670  19.283
    5    HG2  GLU  99           HG2      GLU  99   5.715  16.967  21.355
    6    HG3  GLU  99           HG3      GLU  99   3.962  17.098  21.446

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LYS 100           H        LYS 100   6.918  17.271  17.730
    2    HA   LYS 100           HA       LYS 100   8.559  18.685  19.589
    3    HB2  LYS 100           HB2      LYS 100   9.071  17.758  16.753
    4    HB3  LYS 100           HB3      LYS 100  10.294  18.537  17.763
    5    HG2  LYS 100           HG2      LYS 100   9.923  16.788  19.507
    6    HG3  LYS 100           HG3      LYS 100   8.799  15.975  18.414
    7    HD2  LYS 100           HD2      LYS 100  10.599  15.700  16.752
    8    HD3  LYS 100           HD3      LYS 100  11.728  16.525  17.830
    9    HE2  LYS 100           HE2      LYS 100  11.338  14.770  19.550
   10    HE3  LYS 100           HE3      LYS 100  10.271  13.926  18.424
   11    HZ1  LYS 100           HZ1      LYS 100  13.089  14.611  17.775
   12    HZ3  LYS 100           HZ2      LYS 100  12.054  13.548  16.946
   13    HZ2  LYS 100           HZ3      LYS 100  12.641  13.135  18.487

  No H/Q in entry =          13
  In of MODEL   22
    1    H    LEU 101           H        LEU 101   6.868  19.596  16.627
    2    HA   LEU 101           HA       LEU 101   8.068  22.160  16.290
    3    HB2  LEU 101           HB2      LEU 101   5.483  20.910  15.399
    4    HB3  LEU 101           HB3      LEU 101   5.724  22.642  15.189
    5    HG   LEU 101           HG       LEU 101   7.775  20.635  14.232
    6   HD12  LEU 101          HD11      LEU 101   6.625  21.130  11.943
    7   HD11  LEU 101          HD12      LEU 101   5.220  21.554  12.919
    8   HD13  LEU 101          HD13      LEU 101   5.894  19.927  13.006
    9   HD21  LEU 101          HD21      LEU 101   7.131  23.543  13.670
   10   HD23  LEU 101          HD22      LEU 101   8.121  22.587  12.567
   11   HD22  LEU 101          HD23      LEU 101   8.656  22.851  14.226

  No H/Q in entry =          11
  In of MODEL   22
    1    H    LYS 102           H        LYS 102   6.531  21.018  18.904
    2    HA   LYS 102           HA       LYS 102   5.887  22.110  20.832
    3    HB2  LYS 102           HB2      LYS 102   7.161  24.105  19.708
    4    HB3  LYS 102           HB3      LYS 102   5.560  24.700  19.327
    5    HG2  LYS 102           HG2      LYS 102   6.931  24.457  21.983
    6    HG3  LYS 102           HG3      LYS 102   5.972  25.779  21.349
    7    HD2  LYS 102           HD2      LYS 102   4.741  23.137  22.229
    8    HD3  LYS 102           HD3      LYS 102   4.979  24.501  23.311
    9    HE2  LYS 102           HE2      LYS 102   2.706  24.083  21.816
   10    HE3  LYS 102           HE3      LYS 102   3.198  25.633  22.497
   11    HZ2  LYS 102           HZ1      LYS 102   2.674  25.733  20.116
   12    HZ1  LYS 102           HZ2      LYS 102   3.942  24.658  19.798
   13    HZ3  LYS 102           HZ3      LYS 102   4.275  26.191  20.439

  No H/Q in entry =          13
  In of MODEL   22
    1    H    ALA 103           H        ALA 103   4.248  23.638  18.058
    2    HA   ALA 103           HA       ALA 103   1.788  24.203  18.935
    3    HB1  ALA 103           HB1      ALA 103   0.900  23.352  16.692
    4    HB2  ALA 103           HB2      ALA 103   2.551  22.824  16.367
    5    HB3  ALA 103           HB3      ALA 103   2.206  24.534  16.630

  No H/Q in entry =           5
  In of MODEL   22
    1    H1   ALA   1           H3       ALA   1  10.700 -20.293  -6.238
    2    H2   ALA   1           H2       ALA   1   9.740 -20.507  -7.626
    3    H3   ALA   1           H1       ALA   1   9.303 -21.253  -6.163
    4    HA   ALA   1           HA       ALA   1  10.353 -23.058  -6.897
    5    HB1  ALA   1           HB1      ALA   1  10.453 -22.702  -9.173
    6    HB2  ALA   1           HB2      ALA   1  12.179 -22.542  -8.839
    7    HB3  ALA   1           HB3      ALA   1  11.173 -21.100  -8.995

  No H/Q in entry =           7
  In of MODEL   22
    1    H    GLU   2           H        GLU   2  12.642 -23.997  -6.947
    2    HA   GLU   2           HA       GLU   2  14.017 -23.905  -4.732
    3    HB2  GLU   2           HB2      GLU   2  15.380 -23.772  -7.428
    4    HB3  GLU   2           HB3      GLU   2  16.107 -24.377  -5.940
    5    HG2  GLU   2           HG2      GLU   2  15.100 -26.399  -6.180
    6    HG3  GLU   2           HG3      GLU   2  13.526 -25.661  -6.444

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLU   3           H        GLU   3  15.786 -22.036  -7.132
    2    HA   GLU   3           HA       GLU   3  16.926 -20.340  -5.173
    3    HB2  GLU   3           HB2      GLU   3  16.877 -20.343  -8.183
    4    HB3  GLU   3           HB3      GLU   3  17.615 -19.009  -7.296
    5    HG2  GLU   3           HG2      GLU   3  19.281 -20.374  -6.367
    6    HG3  GLU   3           HG3      GLU   3  18.343 -21.846  -6.588

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LEU   4           H        LEU   4  14.646 -19.507  -7.810
    2    HA   LEU   4           HA       LEU   4  14.166 -16.900  -7.204
    3    HB2  LEU   4           HB2      LEU   4  12.002 -18.886  -7.936
    4    HB3  LEU   4           HB3      LEU   4  11.920 -17.137  -8.138
    5    HG   LEU   4           HG       LEU   4  13.896 -18.994  -9.503
    6   HD13  LEU   4          HD11      LEU   4  12.598 -18.854 -11.417
    7   HD12  LEU   4          HD12      LEU   4  11.882 -17.312 -10.954
    8   HD11  LEU   4          HD13      LEU   4  11.333 -18.804 -10.191
    9   HD23  LEU   4          HD21      LEU   4  14.225 -16.749 -10.858
   10   HD22  LEU   4          HD22      LEU   4  15.083 -16.985  -9.336
   11   HD21  LEU   4          HD23      LEU   4  13.625 -15.996  -9.380

  No H/Q in entry =          11
  In of MODEL   22
    1    H    GLU   5           H        GLU   5  12.691 -19.688  -5.561
    2    HA   GLU   5           HA       GLU   5  11.002 -18.121  -3.865
    3    HB2  GLU   5           HB2      GLU   5  10.590 -20.503  -4.384
    4    HB3  GLU   5           HB3      GLU   5  12.023 -20.931  -3.446
    5    HG2  GLU   5           HG2      GLU   5  11.043 -19.903  -1.444
    6    HG3  GLU   5           HG3      GLU   5   9.620 -19.430  -2.373

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLU   6           H        GLU   6  14.155 -19.686  -3.412
    2    HA   GLU   6           HA       GLU   6  14.497 -18.823  -0.714
    3    HB2  GLU   6           HB2      GLU   6  15.725 -20.735  -1.784
    4    HB3  GLU   6           HB3      GLU   6  16.645 -19.553  -2.718
    5    HG2  GLU   6           HG2      GLU   6  18.002 -20.003  -0.826
    6    HG3  GLU   6           HG3      GLU   6  17.217 -18.467  -0.456

  No H/Q in entry =           6
  In of MODEL   22
    1    H    VAL   7           H        VAL   7  15.264 -17.498  -3.864
    2    HA   VAL   7           HA       VAL   7  16.937 -15.362  -2.999
    3    HB   VAL   7           HB       VAL   7  15.239 -15.738  -5.480
    4   HG11  VAL   7          HG11      VAL   7  17.119 -13.514  -4.667
    5   HG13  VAL   7          HG12      VAL   7  15.478 -13.381  -5.294
    6   HG12  VAL   7          HG13      VAL   7  16.792 -13.878  -6.361
    7   HG21  VAL   7          HG21      VAL   7  17.352 -17.183  -4.904
    8   HG23  VAL   7          HG22      VAL   7  18.250 -15.718  -5.303
    9   HG22  VAL   7          HG23      VAL   7  17.221 -16.475  -6.515

  No H/Q in entry =           9
  In of MODEL   22
    1    H    VAL   8           H        VAL   8  13.447 -15.650  -3.564
    2    HA   VAL   8           HA       VAL   8  12.766 -12.945  -3.098
    3    HB   VAL   8           HB       VAL   8  11.168 -15.482  -2.666
    4   HG11  VAL   8          HG11      VAL   8  10.362 -12.561  -2.562
    5   HG13  VAL   8          HG12      VAL   8  10.179 -13.770  -1.291
    6   HG12  VAL   8          HG13      VAL   8   9.203 -13.877  -2.755
    7   HG23  VAL   8          HG21      VAL   8  10.498 -13.574  -4.851
    8   HG22  VAL   8          HG22      VAL   8  10.569 -15.334  -4.877
    9   HG21  VAL   8          HG23      VAL   8  12.047 -14.393  -5.038

  No H/Q in entry =           9
  In of MODEL   22
    1    H    MET   9           H        MET   9  13.043 -15.745  -0.913
    2    HA   MET   9           HA       MET   9  12.215 -14.474   1.453
    3    HB2  MET   9           HB2      MET   9  14.090 -16.761   0.890
    4    HB3  MET   9           HB3      MET   9  13.882 -16.155   2.533
    5    HG2  MET   9           HG2      MET   9  11.347 -16.391   2.099
    6    HG3  MET   9           HG3      MET   9  11.811 -17.383   0.716
    7    HE1  MET   9           HE1      MET   9  12.826 -19.466   0.666
    8    HE3  MET   9           HE2      MET   9  13.357 -20.485   1.999
    9    HE2  MET   9           HE3      MET   9  14.318 -19.085   1.534

  No H/Q in entry =           9
  In of MODEL   22
    1    H    GLY  10           H        GLY  10  15.401 -14.683  -0.095
    2    HA3  GLY  10           HA2      GLY  10  16.847 -13.251   1.876
    3    HA2  GLY  10           HA3      GLY  10  17.315 -13.416   0.184

  No H/Q in entry =           3
  In of MODEL   22
    1    H    LEU  11           H        LEU  11  15.143 -12.210  -1.063
    2    HA   LEU  11           HA       LEU  11  15.811  -9.461  -0.903
    3    HB2  LEU  11           HB2      LEU  11  13.455 -10.887  -2.141
    4    HB3  LEU  11           HB3      LEU  11  13.725  -9.151  -2.303
    5    HG   LEU  11           HG       LEU  11  15.767 -11.248  -3.082
    6   HD13  LEU  11          HD11      LEU  11  14.028 -11.628  -4.606
    7   HD12  LEU  11          HD12      LEU  11  15.025 -10.442  -5.446
    8   HD11  LEU  11          HD13      LEU  11  13.547  -9.932  -4.632
    9   HD22  LEU  11          HD21      LEU  11  16.986  -9.277  -2.857
   10   HD21  LEU  11          HD22      LEU  11  15.606  -8.249  -3.241
   11   HD23  LEU  11          HD23      LEU  11  16.445  -9.115  -4.526

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  12           H        ILE  12  13.051 -11.302   0.361
    2    HA   ILE  12           HA       ILE  12  11.641  -9.085   1.414
    3    HB   ILE  12           HB       ILE  12  11.694 -11.964   2.372
    4   HG12  ILE  12          HG12      ILE  12  11.015 -11.347  -0.083
    5   HG13  ILE  12          HG13      ILE  12   9.993 -12.441   0.828
    6   HG22  ILE  12          HG21      ILE  12   9.410 -11.399   3.280
    7   HG21  ILE  12          HG22      ILE  12   9.737  -9.705   2.912
    8   HG23  ILE  12          HG23      ILE  12  10.730 -10.559   4.093
    9   HD11  ILE  12          HD11      ILE  12   9.544  -9.455   0.590
   10   HD13  ILE  12          HD12      ILE  12   8.457 -10.631   1.324
   11   HD12  ILE  12          HD13      ILE  12   8.741 -10.660  -0.403

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  13           H        ILE  13  14.045 -11.271   2.829
    2    HA   ILE  13           HA       ILE  13  14.066 -10.088   5.407
    3    HB   ILE  13           HB       ILE  13  16.144 -11.646   3.850
    4   HG12  ILE  13          HG12      ILE  13  13.872 -12.632   4.676
    5   HG13  ILE  13          HG13      ILE  13  15.352 -13.542   4.957
    6   HG22  ILE  13          HG21      ILE  13  17.128 -11.998   6.232
    7   HG21  ILE  13          HG22      ILE  13  16.257 -10.530   6.657
    8   HG23  ILE  13          HG23      ILE  13  17.496 -10.488   5.401
    9   HD12  ILE  13          HD11      ILE  13  13.600 -13.113   6.937
   10   HD11  ILE  13          HD12      ILE  13  14.487 -11.597   7.055
   11   HD13  ILE  13          HD13      ILE  13  15.336 -13.126   7.237

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ASN  14           H        ASN  14  16.023  -9.547   2.493
    2    HA   ASN  14           HA       ASN  14  17.749  -7.590   3.556
    3    HB2  ASN  14           HB2      ASN  14  17.743  -8.860   1.242
    4    HB3  ASN  14           HB3      ASN  14  16.840  -7.451   0.700
    5   HD21  ASN  14          HD21      ASN  14  19.286  -7.773  -0.478
    6   HD22  ASN  14          HD22      ASN  14  20.418  -6.680   0.150

  No H/Q in entry =           6
  In of MODEL   22
    1    H    SER  15           H        SER  15  14.640  -7.271   1.855
    2    HA   SER  15           HA       SER  15  14.504  -4.451   1.906
    3    HB2  SER  15           HB2      SER  15  12.173  -4.719   1.409
    4    HB3  SER  15           HB3      SER  15  12.986  -6.075   0.636
    5    HG   SER  15           HG       SER  15  12.440  -6.760   3.136

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLY  16           H        GLY  16  13.426  -6.917   4.211
    2    HA3  GLY  16           HA2      GLY  16  12.184  -5.175   6.062
    3    HA2  GLY  16           HA3      GLY  16  12.812  -6.778   6.429

  No H/Q in entry =           3
  In of MODEL   22
    1    H    GLN  17           H        GLN  17  15.522  -6.422   5.843
    2    HA   GLN  17           HA       GLN  17  16.461  -5.189   8.224
    3    HB2  GLN  17           HB2      GLN  17  17.703  -6.974   7.023
    4    HB3  GLN  17           HB3      GLN  17  18.020  -5.846   5.705
    5    HG2  GLN  17           HG2      GLN  17  19.177  -4.337   7.307
    6    HG3  GLN  17           HG3      GLN  17  18.917  -5.525   8.583
    7   HE21  GLN  17          HE21      GLN  17  21.027  -6.321   8.935
    8   HE22  GLN  17          HE22      GLN  17  22.000  -6.990   7.716

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ALA  18           H        ALA  18  16.272  -4.118   4.862
    2    HA   ALA  18           HA       ALA  18  17.686  -1.712   5.088
    3    HB2  ALA  18           HB1      ALA  18  16.584  -2.941   3.020
    4    HB3  ALA  18           HB2      ALA  18  16.833  -1.195   3.002
    5    HB1  ALA  18           HB3      ALA  18  15.239  -1.855   3.368

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ARG  19           H        ARG  19  14.190  -2.331   5.476
    2    HA   ARG  19           HA       ARG  19  13.496   0.313   6.185
    3    HB2  ARG  19           HB2      ARG  19  11.833  -1.454   5.597
    4    HB3  ARG  19           HB3      ARG  19  12.177  -2.247   7.136
    5    HG2  ARG  19           HG2      ARG  19  11.445  -0.260   8.370
    6    HG3  ARG  19           HG3      ARG  19  11.191   0.612   6.859
    7    HD2  ARG  19           HD2      ARG  19   9.055  -0.203   7.675
    8    HD3  ARG  19           HD3      ARG  19   9.486  -1.081   6.201
    9    HE   ARG  19           HE       ARG  19  10.453  -2.611   8.312
   10   HH21  ARG  19          HH11      ARG  19   9.216  -4.261   9.250
   11   HH22  ARG  19          HH12      ARG  19   7.497  -4.250   9.074
   12   HH11  ARG  19          HH21      ARG  19   7.450  -1.348   7.206
   13   HH12  ARG  19          HH22      ARG  19   6.497  -2.601   7.912

  No H/Q in entry =          13
  In of MODEL   22
    1    H    SER  20           H        SER  20  14.374  -2.505   8.152
    2    HA   SER  20           HA       SER  20  14.073  -1.404  10.686
    3    HB2  SER  20           HB2      SER  20  14.561  -3.724  10.572
    4    HB3  SER  20           HB3      SER  20  16.011  -3.450   9.610
    5    HG   SER  20           HG       SER  20  16.963  -2.488  11.415

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU  21           H        LEU  21  16.922  -1.320   8.558
    2    HA   LEU  21           HA       LEU  21  18.578   0.184  10.299
    3    HB2  LEU  21           HB2      LEU  21  18.568  -0.089   7.285
    4    HB3  LEU  21           HB3      LEU  21  19.814   0.779   8.180
    5    HG   LEU  21           HG       LEU  21  19.090  -2.123   8.690
    6   HD12  LEU  21          HD11      LEU  21  21.307  -2.545   7.515
    7   HD11  LEU  21          HD12      LEU  21  21.236  -0.875   6.956
    8   HD13  LEU  21          HD13      LEU  21  19.988  -2.020   6.468
    9   HD21  LEU  21          HD21      LEU  21  21.139  -0.206   9.774
   10   HD23  LEU  21          HD22      LEU  21  21.580  -1.905   9.642
   11   HD22  LEU  21          HD23      LEU  21  20.212  -1.431  10.634

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ALA  22           H        ALA  22  16.313   1.128   7.734
    2    HA   ALA  22           HA       ALA  22  16.826   3.891   7.746
    3    HB3  ALA  22           HB1      ALA  22  15.440   2.633   6.065
    4    HB2  ALA  22           HB2      ALA  22  14.717   4.141   6.627
    5    HB1  ALA  22           HB3      ALA  22  14.139   2.597   7.255

  No H/Q in entry =           5
  In of MODEL   22
    1    H    TYR  23           H        TYR  23  14.340   2.056   9.576
    2    HA   TYR  23           HA       TYR  23  13.353   4.286  11.019
    3    HB2  TYR  23           HB2      TYR  23  12.137   2.161  10.997
    4    HB3  TYR  23           HB3      TYR  23  13.472   1.364  11.827
    5    HD1  TYR  23           HD1      TYR  23  10.944   4.085  12.181
    6    HD2  TYR  23           HD2      TYR  23  13.662   1.431  14.184
    7    HE1  TYR  23           HE1      TYR  23  10.003   4.774  14.371
    8    HE2  TYR  23           HE2      TYR  23  12.721   2.118  16.373
    9    HH   TYR  23           HH       TYR  23  10.054   4.481  16.565

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ALA  24           H        ALA  24  16.016   2.035  11.668
    2    HA   ALA  24           HA       ALA  24  16.670   3.041  14.231
    3    HB1  ALA  24           HB1      ALA  24  18.042   1.259  14.074
    4    HB3  ALA  24           HB2      ALA  24  19.065   2.188  12.976
    5    HB2  ALA  24           HB3      ALA  24  17.782   1.167  12.333

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA  25           H        ALA  25  17.629   3.973  10.954
    2    HA   ALA  25           HA       ALA  25  19.555   5.925  11.602
    3    HB1  ALA  25           HB1      ALA  25  18.854   4.967   9.286
    4    HB3  ALA  25           HB2      ALA  25  19.341   6.659   9.378
    5    HB2  ALA  25           HB3      ALA  25  17.630   6.237   9.305

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU  26           H        LEU  26  16.040   6.123  11.230
    2    HA   LEU  26           HA       LEU  26  15.791   8.904  11.676
    3    HB2  LEU  26           HB2      LEU  26  13.942   7.651  10.744
    4    HB3  LEU  26           HB3      LEU  26  13.856   6.625  12.171
    5    HG   LEU  26           HG       LEU  26  13.229   8.580  13.546
    6   HD12  LEU  26          HD11      LEU  26  12.555  10.673  12.215
    7   HD11  LEU  26          HD12      LEU  26  13.545  10.026  10.910
    8   HD13  LEU  26          HD13      LEU  26  14.282  10.420  12.464
    9   HD21  LEU  26          HD21      LEU  26  11.564   8.249  11.032
   10   HD23  LEU  26          HD22      LEU  26  10.993   8.945  12.546
   11   HD22  LEU  26          HD23      LEU  26  11.460   7.247  12.479

  No H/Q in entry =          11
  In of MODEL   22
    1    H    LYS  27           H        LYS  27  15.698   6.127  13.873
    2    HA   LYS  27           HA       LYS  27  15.087   7.492  16.237
    3    HB2  LYS  27           HB2      LYS  27  15.136   5.017  15.976
    4    HB3  LYS  27           HB3      LYS  27  16.899   5.083  15.938
    5    HG2  LYS  27           HG2      LYS  27  16.934   6.072  18.186
    6    HG3  LYS  27           HG3      LYS  27  15.167   6.077  18.226
    7    HD2  LYS  27           HD2      LYS  27  15.162   3.609  17.993
    8    HD3  LYS  27           HD3      LYS  27  16.927   3.613  17.987
    9    HE2  LYS  27           HE2      LYS  27  16.946   4.605  20.242
   10    HE3  LYS  27           HE3      LYS  27  15.180   4.632  20.252
   11    HZ3  LYS  27           HZ1      LYS  27  15.980   2.688  21.408
   12    HZ2  LYS  27           HZ2      LYS  27  16.903   2.213  20.060
   13    HZ1  LYS  27           HZ3      LYS  27  15.206   2.206  19.976

  No H/Q in entry =          13
  In of MODEL   22
    1    H    GLN  28           H        GLN  28  18.213   6.931  14.656
    2    HA   GLN  28           HA       GLN  28  19.883   8.030  16.650
    3    HB2  GLN  28           HB2      GLN  28  20.182   7.986  13.635
    4    HB3  GLN  28           HB3      GLN  28  21.462   8.461  14.752
    5    HG2  GLN  28           HG2      GLN  28  20.054   5.776  14.774
    6    HG3  GLN  28           HG3      GLN  28  21.643   6.074  14.073
    7   HE21  GLN  28          HE21      GLN  28  20.347   4.742  16.755
    8   HE22  GLN  28          HE22      GLN  28  21.519   5.166  17.906

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ALA  29           H        ALA  29  18.129   9.496  13.950
    2    HA   ALA  29           HA       ALA  29  19.109  12.124  14.202
    3    HB2  ALA  29           HB1      ALA  29  17.411  12.747  12.724
    4    HB1  ALA  29           HB2      ALA  29  16.273  11.567  13.374
    5    HB3  ALA  29           HB3      ALA  29  17.610  11.032  12.355

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LYS  30           H        LYS  30  16.339  10.508  15.717
    2    HA   LYS  30           HA       LYS  30  15.306  12.757  17.067
    3    HB2  LYS  30           HB2      LYS  30  15.211   9.816  17.775
    4    HB3  LYS  30           HB3      LYS  30  14.334  11.062  18.664
    5    HG2  LYS  30           HG2      LYS  30  13.211  11.738  16.541
    6    HG3  LYS  30           HG3      LYS  30  14.027  10.405  15.719
    7    HD2  LYS  30           HD2      LYS  30  12.961   8.794  17.247
    8    HD3  LYS  30           HD3      LYS  30  12.155  10.115  18.093
    9    HE2  LYS  30           HE2      LYS  30  10.989  10.738  15.996
   10    HE3  LYS  30           HE3      LYS  30  11.775   9.387  15.170
   11    HZ2  LYS  30           HZ1      LYS  30   9.466   8.965  16.043
   12    HZ1  LYS  30           HZ2      LYS  30  10.129   9.024  17.612
   13    HZ3  LYS  30           HZ3      LYS  30  10.648   7.841  16.505

  No H/Q in entry =          13
  In of MODEL   22
    1    H    GLN  31           H        GLN  31  17.978  10.605  17.815
    2    HA   GLN  31           HA       GLN  31  18.291  11.625  20.509
    3    HB2  GLN  31           HB2      GLN  31  20.328  10.064  18.913
    4    HB3  GLN  31           HB3      GLN  31  20.188  10.190  20.667
    5    HG2  GLN  31           HG2      GLN  31  17.682   9.222  19.892
    6    HG3  GLN  31           HG3      GLN  31  18.792   8.383  18.816
    7   HE21  GLN  31          HE21      GLN  31  17.250   7.230  21.090
    8   HE22  GLN  31          HE22      GLN  31  18.406   6.578  22.144

  No H/Q in entry =           8
  In of MODEL   22
    1    H    GLY  32           H        GLY  32  18.811  12.941  17.543
    2    HA3  GLY  32           HA2      GLY  32  19.784  14.992  17.028
    3    HA2  GLY  32           HA3      GLY  32  20.537  15.003  18.619

  No H/Q in entry =           3
  In of MODEL   22
    1    H    ASP  33           H        ASP  33  20.982  12.111  16.847
    2    HA   ASP  33           HA       ASP  33  23.804  12.803  16.388
    3    HB2  ASP  33           HB2      ASP  33  22.311  10.178  16.504
    4    HB3  ASP  33           HB3      ASP  33  23.998  10.304  16.014

  No H/Q in entry =           4
  In of MODEL   22
    1    H    PHE  34           H        PHE  34  23.321  14.120  14.504
    2    HA   PHE  34           HA       PHE  34  21.984  13.125  12.214
    3    HB2  PHE  34           HB2      PHE  34  24.102  15.272  12.447
    4    HB3  PHE  34           HB3      PHE  34  23.122  14.974  11.013
    5    HD1  PHE  34           HD1      PHE  34  23.352  16.913  13.924
    6    HD2  PHE  34           HD2      PHE  34  20.495  14.776  11.533
    7    HE1  PHE  34           HE1      PHE  34  21.524  18.301  14.864
    8    HE2  PHE  34           HE2      PHE  34  18.671  16.164  12.476
    9    HZ   PHE  34           HZ       PHE  34  19.189  17.927  14.137

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ALA  35           H        ALA  35  25.357  12.960  13.232
    2    HA   ALA  35           HA       ALA  35  26.475  12.142  10.779
    3    HB3  ALA  35           HB1      ALA  35  28.158  10.986  12.506
    4    HB2  ALA  35           HB2      ALA  35  27.284  12.007  13.647
    5    HB1  ALA  35           HB3      ALA  35  28.120  12.734  12.276

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA  36           H        ALA  36  25.364  10.183  13.544
    2    HA   ALA  36           HA       ALA  36  25.868   7.697  12.274
    3    HB2  ALA  36           HB1      ALA  36  25.436   6.951  14.349
    4    HB3  ALA  36           HB2      ALA  36  23.745   7.434  14.193
    5    HB1  ALA  36           HB3      ALA  36  24.937   8.574  14.818

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA  37           H        ALA  37  23.032   9.804  12.396
    2    HA   ALA  37           HA       ALA  37  21.191   8.020  11.217
    3    HB3  ALA  37           HB1      ALA  37  21.395  10.985  11.506
    4    HB1  ALA  37           HB2      ALA  37  20.090   9.898  11.976
    5    HB2  ALA  37           HB3      ALA  37  20.280  10.368  10.286

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LYS  38           H        LYS  38  23.278  10.494   9.741
    2    HA   LYS  38           HA       LYS  38  22.649  10.058   7.062
    3    HB2  LYS  38           HB2      LYS  38  24.443  11.630   8.511
    4    HB3  LYS  38           HB3      LYS  38  25.486  10.647   7.489
    5    HG2  LYS  38           HG2      LYS  38  24.322  11.406   5.489
    6    HG3  LYS  38           HG3      LYS  38  23.118  12.253   6.465
    7    HD2  LYS  38           HD2      LYS  38  24.699  13.864   7.220
    8    HD3  LYS  38           HD3      LYS  38  26.068  12.888   6.690
    9    HE2  LYS  38           HE2      LYS  38  25.702  14.754   5.134
   10    HE3  LYS  38           HE3      LYS  38  25.381  13.213   4.331
   11    HZ3  LYS  38           HZ1      LYS  38  23.181  13.641   4.194
   12    HZ2  LYS  38           HZ2      LYS  38  23.691  15.260   4.281
   13    HZ1  LYS  38           HZ3      LYS  38  23.119  14.474   5.673

  No H/Q in entry =          13
  In of MODEL   22
    1    H    ALA  39           H        ALA  39  25.169   8.482   9.028
    2    HA   ALA  39           HA       ALA  39  26.257   6.899   6.964
    3    HB2  ALA  39           HB1      ALA  39  26.167   5.939   9.809
    4    HB1  ALA  39           HB2      ALA  39  27.110   7.371   9.393
    5    HB3  ALA  39           HB3      ALA  39  27.476   5.822   8.633

  No H/Q in entry =           5
  In of MODEL   22
    1    H    MET  40           H        MET  40  23.642   6.266   9.255
    2    HA   MET  40           HA       MET  40  23.223   3.556   8.524
    3    HB2  MET  40           HB2      MET  40  21.386   5.587   9.808
    4    HB3  MET  40           HB3      MET  40  20.994   3.874   9.634
    5    HG2  MET  40           HG2      MET  40  23.532   4.838  10.981
    6    HG3  MET  40           HG3      MET  40  22.037   4.551  11.870
    7    HE3  MET  40           HE1      MET  40  21.502   0.914  12.050
    8    HE2  MET  40           HE2      MET  40  20.625   2.208  11.238
    9    HE1  MET  40           HE3      MET  40  21.359   2.504  12.812

  No H/Q in entry =           9
  In of MODEL   22
    1    H    MET  41           H        MET  41  21.788   6.596   7.328
    2    HA   MET  41           HA       MET  41  19.845   5.383   5.652
    3    HB2  MET  41           HB2      MET  41  21.306   7.984   5.139
    4    HB3  MET  41           HB3      MET  41  19.785   7.477   4.417
    5    HG2  MET  41           HG2      MET  41  19.033   7.286   6.967
    6    HG3  MET  41           HG3      MET  41  20.332   8.455   7.191
    7    HE2  MET  41           HE1      MET  41  19.768   9.733   3.851
    8    HE1  MET  41           HE2      MET  41  20.717  10.183   5.264
    9    HE3  MET  41           HE3      MET  41  19.437  11.251   4.695

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ASP  42           H        ASP  42  23.211   6.333   5.107
    2    HA   ASP  42           HA       ASP  42  23.315   5.856   2.351
    3    HB2  ASP  42           HB2      ASP  42  25.053   6.870   4.124
    4    HB3  ASP  42           HB3      ASP  42  25.724   5.250   4.000

  No H/Q in entry =           4
  In of MODEL   22
    1    H    GLN  43           H        GLN  43  24.050   3.711   5.076
    2    HA   GLN  43           HA       GLN  43  24.738   1.457   3.499
    3    HB2  GLN  43           HB2      GLN  43  23.705   1.636   6.339
    4    HB3  GLN  43           HB3      GLN  43  24.299   0.151   5.588
    5    HG2  GLN  43           HG2      GLN  43  26.453   1.379   5.081
    6    HG3  GLN  43           HG3      GLN  43  25.856   2.702   6.077
    7   HE21  GLN  43          HE21      GLN  43  28.095   1.750   7.122
    8   HE22  GLN  43          HE22      GLN  43  27.826   0.666   8.399

  No H/Q in entry =           8
  In of MODEL   22
    1    H    SER  44           H        SER  44  21.668   2.567   4.873
    2    HA   SER  44           HA       SER  44  20.120   0.309   4.199
    3    HB2  SER  44           HB2      SER  44  19.654   2.836   5.340
    4    HB3  SER  44           HB3      SER  44  18.624   2.782   3.912
    5    HG   SER  44           HG       SER  44  17.534   1.832   5.633

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ARG  45           H        ARG  45  20.843   3.278   2.392
    2    HA   ARG  45           HA       ARG  45  19.329   2.776   0.084
    3    HB2  ARG  45           HB2      ARG  45  20.453   4.922   0.669
    4    HB3  ARG  45           HB3      ARG  45  22.005   4.180   0.289
    5    HG2  ARG  45           HG2      ARG  45  21.232   3.765  -2.028
    6    HG3  ARG  45           HG3      ARG  45  19.692   4.530  -1.646
    7    HD2  ARG  45           HD2      ARG  45  20.923   6.638  -1.062
    8    HD3  ARG  45           HD3      ARG  45  22.427   5.876  -1.625
    9    HE   ARG  45           HE       ARG  45  20.505   5.619  -3.666
   10   HH21  ARG  45          HH11      ARG  45  20.491   6.986  -5.431
   11   HH22  ARG  45          HH12      ARG  45  21.235   8.542  -5.327
   12   HH11  ARG  45          HH21      ARG  45  22.210   8.134  -2.038
   13   HH12  ARG  45          HH22      ARG  45  22.207   9.192  -3.403

  No H/Q in entry =          13
  In of MODEL   22
    1    H    MET  46           H        MET  46  22.698   1.929   0.842
    2    HA   MET  46           HA       MET  46  23.320   0.738  -1.639
    3    HB2  MET  46           HB2      MET  46  24.422   0.425   1.154
    4    HB3  MET  46           HB3      MET  46  25.089  -0.466  -0.218
    5    HG2  MET  46           HG2      MET  46  25.521   1.640  -1.405
    6    HG3  MET  46           HG3      MET  46  24.802   2.552  -0.084
    7    HE1  MET  46           HE1      MET  46  27.422   0.292  -1.370
    8    HE3  MET  46           HE2      MET  46  27.392  -0.639   0.125
    9    HE2  MET  46           HE3      MET  46  28.795   0.358  -0.256

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ALA  47           H        ALA  47  21.940  -0.601   1.336
    2    HA   ALA  47           HA       ALA  47  21.908  -3.316   0.537
    3    HB2  ALA  47           HB1      ALA  47  21.521  -2.855   2.840
    4    HB3  ALA  47           HB2      ALA  47  19.990  -3.470   2.218
    5    HB1  ALA  47           HB3      ALA  47  20.206  -1.737   2.474

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU  48           H        LEU  48  19.537  -0.707   0.171
    2    HA   LEU  48           HA       LEU  48  17.506  -2.257  -1.082
    3    HB2  LEU  48           HB2      LEU  48  18.140   0.702  -1.200
    4    HB3  LEU  48           HB3      LEU  48  16.675  -0.021  -1.869
    5    HG   LEU  48           HG       LEU  48  17.525  -0.311   1.022
    6   HD13  LEU  48          HD11      LEU  48  17.091   1.986   0.830
    7   HD12  LEU  48          HD12      LEU  48  15.536   1.328   1.338
    8   HD11  LEU  48          HD13      LEU  48  15.808   1.749  -0.354
    9   HD22  LEU  48          HD21      LEU  48  16.009  -2.037   0.641
   10   HD21  LEU  48          HD22      LEU  48  15.131  -1.143  -0.601
   11   HD23  LEU  48          HD23      LEU  48  14.913  -0.737   1.102

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ASN  49           H        ASN  49  20.183  -0.312  -2.311
    2    HA   ASN  49           HA       ASN  49  19.538  -0.405  -5.036
    3    HB2  ASN  49           HB2      ASN  49  21.210   1.118  -4.086
    4    HB3  ASN  49           HB3      ASN  49  22.254  -0.243  -3.696
    5   HD21  ASN  49          HD21      ASN  49  23.982   0.345  -5.097
    6   HD22  ASN  49          HD22      ASN  49  23.829   0.369  -6.786

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLU  50           H        GLU  50  21.534  -2.582  -3.066
    2    HA   GLU  50           HA       GLU  50  22.251  -4.337  -5.187
    3    HB2  GLU  50           HB2      GLU  50  23.445  -4.300  -3.019
    4    HB3  GLU  50           HB3      GLU  50  22.005  -4.936  -2.224
    5    HG2  GLU  50           HG2      GLU  50  22.111  -6.971  -3.579
    6    HG3  GLU  50           HG3      GLU  50  23.484  -6.331  -4.479

  No H/Q in entry =           6
  In of MODEL   22
    1    H    ALA  51           H        ALA  51  19.590  -4.286  -2.865
    2    HA   ALA  51           HA       ALA  51  18.442  -6.768  -3.620
    3    HB3  ALA  51           HB1      ALA  51  16.844  -6.270  -2.068
    4    HB1  ALA  51           HB2      ALA  51  16.620  -4.626  -2.670
    5    HB2  ALA  51           HB3      ALA  51  17.980  -5.001  -1.611

  No H/Q in entry =           5
  In of MODEL   22
    1    H    HIS  52           H        HIS  52  17.835  -3.426  -4.663
    2    HA   HIS  52           HA       HIS  52  15.728  -3.971  -6.465
    3    HB2  HIS  52           HB2      HIS  52  16.340  -1.700  -5.677
    4    HB3  HIS  52           HB3      HIS  52  17.820  -1.787  -6.632
    5    HD1  HIS  52           HD1      HIS  52  17.499  -1.984  -9.281
    6    HD2  HIS  52           HD2      HIS  52  14.053  -1.019  -7.139
    7    HE1  HIS  52           HE1      HIS  52  15.825  -1.109 -10.970
    8    HE2  HIS  52           HE2      HIS  52  13.720  -0.517  -9.680

  No H/Q in entry =           8
  In of MODEL   22
    1    H    LEU  53           H        LEU  53  19.248  -3.953  -6.892
    2    HA   LEU  53           HA       LEU  53  19.311  -4.274  -9.691
    3    HB2  LEU  53           HB2      LEU  53  21.246  -5.015  -7.511
    4    HB3  LEU  53           HB3      LEU  53  21.568  -5.408  -9.198
    5    HG   LEU  53           HG       LEU  53  20.869  -2.597  -8.295
    6   HD11  LEU  53          HD11      LEU  53  23.584  -3.914  -8.588
    7   HD13  LEU  53          HD12      LEU  53  22.895  -3.224  -7.119
    8   HD12  LEU  53          HD13      LEU  53  23.340  -2.175  -8.460
    9   HD23  LEU  53          HD21      LEU  53  22.297  -2.149 -10.438
   10   HD22  LEU  53          HD22      LEU  53  20.638  -2.701 -10.639
   11   HD21  LEU  53          HD23      LEU  53  21.966  -3.830 -10.833

  No H/Q in entry =          11
  In of MODEL   22
    1    H    VAL  54           H        VAL  54  19.212  -6.656  -7.060
    2    HA   VAL  54           HA       VAL  54  19.354  -8.953  -8.715
    3    HB   VAL  54           HB       VAL  54  18.192  -8.532  -5.950
    4   HG12  VAL  54          HG11      VAL  54  18.535 -11.147  -5.939
    5   HG11  VAL  54          HG12      VAL  54  18.352 -10.984  -7.686
    6   HG13  VAL  54          HG13      VAL  54  17.057 -10.460  -6.610
    7   HG22  VAL  54          HG21      VAL  54  20.506  -8.304  -5.724
    8   HG21  VAL  54          HG22      VAL  54  20.853  -9.396  -7.062
    9   HG23  VAL  54          HG23      VAL  54  20.325 -10.043  -5.509

  No H/Q in entry =           9
  In of MODEL   22
    1    H    GLN  55           H        GLN  55  16.610  -7.067  -7.440
    2    HA   GLN  55           HA       GLN  55  14.603  -8.749  -8.514
    3    HB2  GLN  55           HB2      GLN  55  13.840  -7.225  -6.892
    4    HB3  GLN  55           HB3      GLN  55  14.624  -5.853  -7.670
    5    HG2  GLN  55           HG2      GLN  55  12.900  -5.545  -9.163
    6    HG3  GLN  55           HG3      GLN  55  12.591  -7.268  -9.329
    7   HE21  GLN  55          HE21      GLN  55  10.587  -7.831  -8.526
    8   HE22  GLN  55          HE22      GLN  55   9.806  -7.079  -7.220

  No H/Q in entry =           8
  In of MODEL   22
    1    H    THR  56           H        THR  56  16.323  -5.939  -9.877
    2    HA   THR  56           HA       THR  56  14.885  -5.594 -12.228
    3    HB   THR  56           HB       THR  56  17.904  -5.481 -12.056
    4    HG1  THR  56           HG1      THR  56  15.899  -3.682 -11.201
    5   HG21  THR  56          HG21      THR  56  16.496  -5.200 -14.262
    6   HG23  THR  56          HG22      THR  56  17.804  -4.072 -13.904
    7   HG22  THR  56          HG23      THR  56  16.131  -3.610 -13.589

  No H/Q in entry =           7
  In of MODEL   22
    1    H    LYS  57           H        LYS  57  17.552  -7.869 -11.608
    2    HA   LYS  57           HA       LYS  57  17.566  -9.069 -14.183
    3    HB2  LYS  57           HB2      LYS  57  19.345  -9.295 -12.404
    4    HB3  LYS  57           HB3      LYS  57  18.248 -10.334 -11.509
    5    HG2  LYS  57           HG2      LYS  57  18.711 -11.075 -14.343
    6    HG3  LYS  57           HG3      LYS  57  20.081 -11.285 -13.257
    7    HD2  LYS  57           HD2      LYS  57  18.690 -12.651 -11.747
    8    HD3  LYS  57           HD3      LYS  57  17.306 -12.440 -12.821
    9    HE2  LYS  57           HE2      LYS  57  18.547 -13.563 -14.645
   10    HE3  LYS  57           HE3      LYS  57  19.931 -13.789 -13.577
   11    HZ1  LYS  57           HZ1      LYS  57  18.085 -14.866 -12.072
   12    HZ3  LYS  57           HZ2      LYS  57  18.886 -15.757 -13.276
   13    HZ2  LYS  57           HZ3      LYS  57  17.336 -15.128 -13.570

  No H/Q in entry =          13
  In of MODEL   22
    1    H    LEU  58           H        LEU  58  15.786  -9.744 -11.208
    2    HA   LEU  58           HA       LEU  58  14.586 -12.130 -12.138
    3    HB2  LEU  58           HB2      LEU  58  13.772 -10.225  -9.949
    4    HB3  LEU  58           HB3      LEU  58  12.979 -11.770 -10.262
    5    HG   LEU  58           HG       LEU  58  15.948 -11.466  -9.704
    6   HD11  LEU  58          HD11      LEU  58  13.578 -11.899  -7.914
    7   HD13  LEU  58          HD12      LEU  58  15.023 -10.923  -7.652
    8   HD12  LEU  58          HD13      LEU  58  15.110 -12.678  -7.512
    9   HD22  LEU  58          HD21      LEU  58  15.849 -13.532 -10.727
   10   HD21  LEU  58          HD22      LEU  58  14.137 -13.754 -10.368
   11   HD23  LEU  58          HD23      LEU  58  15.346 -14.042  -9.116

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  59           H        ILE  59  13.888  -8.800 -12.831
    2    HA   ILE  59           HA       ILE  59  11.179  -9.474 -13.773
    3    HB   ILE  59           HB       ILE  59  11.967  -7.180 -12.574
    4   HG12  ILE  59          HG12      ILE  59  10.050  -7.102 -14.916
    5   HG13  ILE  59          HG13      ILE  59   9.645  -7.842 -13.389
    6   HG22  ILE  59          HG21      ILE  59  12.037  -6.379 -15.470
    7   HG21  ILE  59          HG22      ILE  59  13.517  -6.780 -14.628
    8   HG23  ILE  59          HG23      ILE  59  12.514  -5.443 -14.074
    9   HD13  ILE  59          HD11      ILE  59   8.834  -5.556 -13.372
   10   HD12  ILE  59          HD12      ILE  59  10.432  -4.960 -13.817
   11   HD11  ILE  59          HD13      ILE  59  10.175  -5.692 -12.233

  No H/Q in entry =          11
  In of MODEL   22
    1    H    GLU  60           H        GLU  60  14.377  -8.598 -15.029
    2    HA   GLU  60           HA       GLU  60  13.598  -8.212 -17.739
    3    HB2  GLU  60           HB2      GLU  60  15.773  -7.465 -16.865
    4    HB3  GLU  60           HB3      GLU  60  16.248  -9.140 -16.598
    5    HG2  GLU  60           HG2      GLU  60  16.049  -9.589 -19.018
    6    HG3  GLU  60           HG3      GLU  60  15.570  -7.915 -19.289

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLY  61           H        GLY  61  14.597 -11.080 -15.915
    2    HA3  GLY  61           HA2      GLY  61  14.073 -12.738 -18.313
    3    HA2  GLY  61           HA3      GLY  61  15.107 -13.208 -16.968

  No H/Q in entry =           3
  In of MODEL   22
    1    H    ASP  62           H        ASP  62  11.974 -11.686 -16.604
    2    HA   ASP  62           HA       ASP  62  11.064 -13.765 -14.860
    3    HB2  ASP  62           HB2      ASP  62   8.988 -12.405 -14.782
    4    HB3  ASP  62           HB3      ASP  62  10.439 -11.471 -14.430

  No H/Q in entry =           4
  In of MODEL   22
    1    H    ALA  63           H        ALA  63  11.579 -14.629 -17.674
    2    HA   ALA  63           HA       ALA  63   9.172 -15.037 -19.109
    3    HB3  ALA  63           HB1      ALA  63  11.467 -16.996 -19.049
    4    HB2  ALA  63           HB2      ALA  63  11.587 -15.445 -19.878
    5    HB1  ALA  63           HB3      ALA  63  10.382 -16.626 -20.389

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLY  64           H        GLY  64  10.789 -16.939 -16.610
    2    HA3  GLY  64           HA2      GLY  64  10.124 -18.735 -15.348
    3    HA2  GLY  64           HA3      GLY  64   8.530 -17.995 -15.405

  No H/Q in entry =           3
  In of MODEL   22
    1    H    GLU  65           H        GLU  65   7.024 -19.425 -16.031
    2    HA   GLU  65           HA       GLU  65   7.665 -21.858 -17.319
    3    HB2  GLU  65           HB2      GLU  65   5.021 -20.478 -16.879
    4    HB3  GLU  65           HB3      GLU  65   5.178 -22.097 -17.559
    5    HG2  GLU  65           HG2      GLU  65   6.333 -22.871 -15.554
    6    HG3  GLU  65           HG3      GLU  65   6.300 -21.245 -14.875

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLY  66           H        GLY  66   6.379 -18.849 -18.504
    2    HA3  GLY  66           HA2      GLY  66   7.203 -19.400 -21.207
    3    HA2  GLY  66           HA3      GLY  66   5.464 -19.323 -21.004

  No H/Q in entry =           3
  In of MODEL   22
    1    H    LYS  67           H        LYS  67   6.510 -17.630 -22.729
    2    HA   LYS  67           HA       LYS  67   7.536 -15.204 -21.832
    3    HB2  LYS  67           HB2      LYS  67   5.872 -15.777 -24.287
    4    HB3  LYS  67           HB3      LYS  67   6.863 -14.335 -24.033
    5    HG2  LYS  67           HG2      LYS  67   7.979 -17.142 -23.839
    6    HG3  LYS  67           HG3      LYS  67   7.986 -16.220 -25.340
    7    HD2  LYS  67           HD2      LYS  67   9.146 -14.363 -23.956
    8    HD3  LYS  67           HD3      LYS  67   9.455 -15.638 -22.774
    9    HE2  LYS  67           HE2      LYS  67  10.577 -16.987 -24.493
   10    HE3  LYS  67           HE3      LYS  67  10.240 -15.750 -25.702
   11    HZ1  LYS  67           HZ1      LYS  67  11.498 -14.619 -23.426
   12    HZ3  LYS  67           HZ2      LYS  67  11.995 -14.597 -25.049
   13    HZ2  LYS  67           HZ3      LYS  67  12.432 -15.894 -24.041

  No H/Q in entry =          13
  In of MODEL   22
    1    H    MET  68           H        MET  68   4.201 -16.127 -22.379
    2    HA   MET  68           HA       MET  68   2.954 -13.654 -21.919
    3    HB2  MET  68           HB2      MET  68   2.060 -16.510 -21.860
    4    HB3  MET  68           HB3      MET  68   0.959 -15.227 -21.360
    5    HG2  MET  68           HG2      MET  68   0.726 -15.744 -23.774
    6    HG3  MET  68           HG3      MET  68   1.272 -14.089 -23.512
    7    HE1  MET  68           HE1      MET  68   3.427 -13.115 -24.126
    8    HE3  MET  68           HE2      MET  68   2.440 -13.432 -25.549
    9    HE2  MET  68           HE3      MET  68   4.175 -13.733 -25.605

  No H/Q in entry =           9
  In of MODEL   22
    1    H    LYS  69           H        LYS  69   3.723 -16.272 -19.606
    2    HA   LYS  69           HA       LYS  69   2.633 -14.594 -17.456
    3    HB2  LYS  69           HB2      LYS  69   1.655 -16.825 -17.641
    4    HB3  LYS  69           HB3      LYS  69   3.249 -17.549 -17.416
    5    HG2  LYS  69           HG2      LYS  69   3.446 -16.552 -15.204
    6    HG3  LYS  69           HG3      LYS  69   1.927 -15.685 -15.427
    7    HD2  LYS  69           HD2      LYS  69   0.737 -17.854 -15.615
    8    HD3  LYS  69           HD3      LYS  69   2.260 -18.696 -15.319
    9    HE2  LYS  69           HE2      LYS  69   1.065 -16.665 -13.414
   10    HE3  LYS  69           HE3      LYS  69   0.840 -18.407 -13.258
   11    HZ2  LYS  69           HZ1      LYS  69   2.933 -16.940 -12.276
   12    HZ1  LYS  69           HZ2      LYS  69   3.579 -17.728 -13.634
   13    HZ3  LYS  69           HZ3      LYS  69   2.855 -18.629 -12.389

  No H/Q in entry =          13
  In of MODEL   22
    1    H    VAL  70           H        VAL  70   3.681 -14.321 -15.414
    2    HA   VAL  70           HA       VAL  70   6.629 -14.663 -15.491
    3    HB   VAL  70           HB       VAL  70   6.750 -12.579 -14.153
    4   HG13  VAL  70          HG11      VAL  70   7.113 -12.146 -16.422
    5   HG12  VAL  70          HG12      VAL  70   5.758 -11.073 -16.068
    6   HG11  VAL  70          HG13      VAL  70   5.474 -12.614 -16.874
    7   HG23  VAL  70          HG21      VAL  70   3.757 -12.433 -14.692
    8   HG22  VAL  70          HG22      VAL  70   4.725 -11.170 -13.935
    9   HG21  VAL  70          HG23      VAL  70   4.496 -12.714 -13.116

  No H/Q in entry =           9
  In of MODEL   22
    1    H    SER  71           H        SER  71   7.613 -14.708 -13.303
    2    HA   SER  71           HA       SER  71   6.492 -16.712 -11.650
    3    HB2  SER  71           HB2      SER  71   8.925 -16.185 -11.773
    4    HB3  SER  71           HB3      SER  71   8.611 -14.671 -10.929
    5    HG   SER  71           HG       SER  71   8.283 -17.329 -10.019

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU  72           H        LEU  72   5.121 -16.602  -9.981
    2    HA   LEU  72           HA       LEU  72   3.552 -14.301  -9.545
    3    HB2  LEU  72           HB2      LEU  72   3.857 -16.854  -7.972
    4    HB3  LEU  72           HB3      LEU  72   2.681 -15.605  -7.571
    5    HG   LEU  72           HG       LEU  72   2.845 -16.893 -10.315
    6   HD11  LEU  72          HD11      LEU  72   2.332 -18.554  -8.505
    7   HD13  LEU  72          HD12      LEU  72   1.000 -18.322  -9.634
    8   HD12  LEU  72          HD13      LEU  72   0.949 -17.560  -8.045
    9   HD22  LEU  72          HD21      LEU  72   1.600 -14.913 -10.546
   10   HD21  LEU  72          HD22      LEU  72   0.924 -15.017  -8.929
   11   HD23  LEU  72          HD23      LEU  72   0.344 -16.094 -10.195

  No H/Q in entry =          11
  In of MODEL   22
    1    H    VAL  73           H        VAL  73   6.216 -15.712  -7.763
    2    HA   VAL  73           HA       VAL  73   6.138 -14.175  -5.434
    3    HB   VAL  73           HB       VAL  73   8.337 -14.955  -5.009
    4   HG12  VAL  73          HG11      VAL  73   7.213 -17.100  -6.803
    5   HG11  VAL  73          HG12      VAL  73   6.390 -16.642  -5.311
    6   HG13  VAL  73          HG13      VAL  73   8.034 -17.279  -5.254
    7   HG22  VAL  73          HG21      VAL  73   9.663 -14.415  -6.839
    8   HG21  VAL  73          HG22      VAL  73   8.495 -15.043  -8.000
    9   HG23  VAL  73          HG23      VAL  73   9.493 -16.156  -7.067

  No H/Q in entry =           9
  In of MODEL   22
    1    H    LEU  74           H        LEU  74   7.128 -13.279  -8.610
    2    HA   LEU  74           HA       LEU  74   9.056 -11.313  -8.116
    3    HB2  LEU  74           HB2      LEU  74   8.611 -12.071 -10.354
    4    HB3  LEU  74           HB3      LEU  74   6.941 -11.516 -10.259
    5    HG   LEU  74           HG       LEU  74   7.722  -9.184 -10.054
    6   HD13  LEU  74          HD11      LEU  74   9.829  -9.350  -8.976
    7   HD12  LEU  74          HD12      LEU  74  10.226  -8.863 -10.624
    8   HD11  LEU  74          HD13      LEU  74  10.418 -10.545 -10.130
    9   HD22  LEU  74          HD21      LEU  74   8.051  -8.962 -12.307
   10   HD21  LEU  74          HD22      LEU  74   7.530 -10.631 -12.250
   11   HD23  LEU  74          HD23      LEU  74   9.236 -10.264 -12.372

  No H/Q in entry =          11
  In of MODEL   22
    1    H    VAL  75           H        VAL  75   5.558 -10.958  -8.479
    2    HA   VAL  75           HA       VAL  75   5.437  -8.201  -7.898
    3    HB   VAL  75           HB       VAL  75   3.367 -10.364  -7.520
    4   HG11  VAL  75          HG11      VAL  75   3.141  -7.327  -7.349
    5   HG13  VAL  75          HG12      VAL  75   2.865  -8.468  -6.042
    6   HG12  VAL  75          HG13      VAL  75   1.770  -8.430  -7.415
    7   HG23  VAL  75          HG21      VAL  75   3.599  -8.179  -9.609
    8   HG22  VAL  75          HG22      VAL  75   2.518  -9.571  -9.629
    9   HG21  VAL  75          HG23      VAL  75   4.253  -9.799  -9.848

  No H/Q in entry =           9
  In of MODEL   22
    1    H    GLU  76           H        GLU  76   5.201 -11.076  -5.783
    2    HA   GLU  76           HA       GLU  76   4.713  -9.714  -3.366
    3    HB2  GLU  76           HB2      GLU  76   4.558 -12.182  -3.594
    4    HB3  GLU  76           HB3      GLU  76   6.295 -12.269  -3.832
    5    HG2  GLU  76           HG2      GLU  76   5.843 -12.849  -1.531
    6    HG3  GLU  76           HG3      GLU  76   6.598 -11.267  -1.527

  No H/Q in entry =           6
  In of MODEL   22
    1    H    ALA  77           H        ALA  77   7.785 -10.600  -4.918
    2    HA   ALA  77           HA       ALA  77   9.460  -9.539  -2.899
    3    HB1  ALA  77           HB1      ALA  77  10.455 -11.016  -4.470
    4    HB2  ALA  77           HB2      ALA  77  11.166  -9.436  -4.795
    5    HB3  ALA  77           HB3      ALA  77   9.890 -10.062  -5.840

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLN  78           H        GLN  78   8.066  -8.138  -5.820
    2    HA   GLN  78           HA       GLN  78   9.398  -5.648  -5.717
    3    HB2  GLN  78           HB2      GLN  78   8.117  -6.575  -7.677
    4    HB3  GLN  78           HB3      GLN  78   6.628  -6.211  -6.808
    5    HG2  GLN  78           HG2      GLN  78   7.252  -3.834  -6.717
    6    HG3  GLN  78           HG3      GLN  78   8.751  -4.188  -7.574
    7   HE21  GLN  78          HE21      GLN  78   6.845  -2.387  -8.700
    8   HE22  GLN  78          HE22      GLN  78   6.166  -3.112 -10.078

  No H/Q in entry =           8
  In of MODEL   22
    1    H    LEU  79           H        LEU  79   6.383  -6.806  -4.294
    2    HA   LEU  79           HA       LEU  79   5.368  -4.405  -3.293
    3    HB2  LEU  79           HB2      LEU  79   4.068  -6.466  -3.238
    4    HB3  LEU  79           HB3      LEU  79   5.215  -7.195  -2.118
    5    HG   LEU  79           HG       LEU  79   4.644  -5.553  -0.396
    6   HD13  LEU  79          HD11      LEU  79   4.167  -3.544  -1.452
    7   HD12  LEU  79          HD12      LEU  79   2.544  -4.081  -1.018
    8   HD11  LEU  79          HD13      LEU  79   3.132  -4.303  -2.663
    9   HD23  LEU  79          HD21      LEU  79   2.061  -6.065  -0.314
   10   HD22  LEU  79          HD22      LEU  79   3.210  -7.395  -0.198
   11   HD21  LEU  79          HD23      LEU  79   2.399  -7.067  -1.727

  No H/Q in entry =          11
  In of MODEL   22
    1    H    HIS  80           H        HIS  80   7.562  -6.721  -1.698
    2    HA   HIS  80           HA       HIS  80   7.829  -5.172   0.669
    3    HB2  HIS  80           HB2      HIS  80   9.189  -7.528  -0.520
    4    HB3  HIS  80           HB3      HIS  80  10.089  -6.623   0.698
    5    HD1  HIS  80           HD1      HIS  80   9.594  -7.258   3.041
    6    HD2  HIS  80           HD2      HIS  80   6.393  -8.136   0.518
    7    HE1  HIS  80           HE1      HIS  80   7.824  -8.371   4.484
    8    HE2  HIS  80           HE2      HIS  80   5.867  -8.910   2.955

  No H/Q in entry =           8
  In of MODEL   22
    1    H    LEU  81           H        LEU  81   9.848  -5.439  -2.235
    2    HA   LEU  81           HA       LEU  81  11.876  -3.682  -1.352
    3    HB2  LEU  81           HB2      LEU  81  10.972  -4.487  -4.117
    4    HB3  LEU  81           HB3      LEU  81  12.384  -3.470  -3.823
    5    HG   LEU  81           HG       LEU  81  12.005  -6.191  -2.546
    6   HD12  LEU  81          HD11      LEU  81  13.832  -6.809  -4.287
    7   HD11  LEU  81          HD12      LEU  81  13.260  -5.390  -5.163
    8   HD13  LEU  81          HD13      LEU  81  12.156  -6.721  -4.827
    9   HD23  LEU  81          HD21      LEU  81  14.631  -5.858  -2.522
   10   HD22  LEU  81          HD22      LEU  81  13.639  -5.102  -1.277
   11   HD21  LEU  81          HD23      LEU  81  14.216  -4.149  -2.643

  No H/Q in entry =          11
  In of MODEL   22
    1    H    MET  82           H        MET  82   8.957  -3.069  -3.302
    2    HA   MET  82           HA       MET  82   9.481  -0.341  -3.806
    3    HB2  MET  82           HB2      MET  82   6.932  -1.951  -3.688
    4    HB3  MET  82           HB3      MET  82   6.922  -0.228  -4.056
    5    HG2  MET  82           HG2      MET  82   8.542  -2.294  -5.580
    6    HG3  MET  82           HG3      MET  82   6.973  -1.682  -6.100
    7    HE3  MET  82           HE1      MET  82   7.404   1.773  -7.277
    8    HE2  MET  82           HE2      MET  82   7.024   1.548  -5.572
    9    HE1  MET  82           HE3      MET  82   6.371   0.432  -6.767

  No H/Q in entry =           9
  In of MODEL   22
    1    H    THR  83           H        THR  83   7.689  -1.946  -1.205
    2    HA   THR  83           HA       THR  83   6.817   0.400   0.113
    3    HB   THR  83           HB       THR  83   6.685  -1.172   2.134
    4    HG1  THR  83           HG1      THR  83   7.455  -3.117   1.911
    5   HG22  THR  83          HG21      THR  83   5.047  -2.751   0.662
    6   HG21  THR  83          HG22      THR  83   5.270  -1.423  -0.472
    7   HG23  THR  83          HG23      THR  83   4.621  -1.109   1.138

  No H/Q in entry =           7
  In of MODEL   22
    1    H    SER  84           H        SER  84   9.652  -1.680   0.650
    2    HA   SER  84           HA       SER  84  10.693  -0.238   2.840
    3    HB2  SER  84           HB2      SER  84  11.966  -2.077   0.824
    4    HB3  SER  84           HB3      SER  84  12.903  -1.316   2.108
    5    HG   SER  84           HG       SER  84  10.637  -3.019   2.361

  No H/Q in entry =           5
  In of MODEL   22
    1    H    MET  85           H        MET  85  11.460   0.020  -0.645
    2    HA   MET  85           HA       MET  85  13.445   1.998  -0.390
    3    HB2  MET  85           HB2      MET  85  13.064   0.709  -2.455
    4    HB3  MET  85           HB3      MET  85  11.535   1.554  -2.692
    5    HG2  MET  85           HG2      MET  85  12.715   3.703  -2.829
    6    HG3  MET  85           HG3      MET  85  14.249   2.893  -2.530
    7    HE2  MET  85           HE1      MET  85  11.599   2.939  -6.194
    8    HE1  MET  85           HE2      MET  85  11.180   3.220  -4.507
    9    HE3  MET  85           HE3      MET  85  11.232   1.575  -5.126

  No H/Q in entry =           9
  In of MODEL   22
    1    H    LEU  86           H        LEU  86   9.956   2.311  -0.914
    2    HA   LEU  86           HA       LEU  86   9.877   5.124  -1.101
    3    HB2  LEU  86           HB2      LEU  86   8.044   3.452  -1.682
    4    HB3  LEU  86           HB3      LEU  86   7.708   3.364   0.047
    5    HG   LEU  86           HG       LEU  86   7.533   5.924  -0.011
    6   HD11  LEU  86          HD11      LEU  86   8.322   5.487  -2.709
    7   HD13  LEU  86          HD12      LEU  86   7.874   7.014  -1.953
    8   HD12  LEU  86          HD13      LEU  86   6.647   6.042  -2.762
    9   HD23  LEU  86          HD21      LEU  86   5.414   4.556  -1.680
   10   HD22  LEU  86          HD22      LEU  86   5.211   5.817  -0.467
   11   HD21  LEU  86          HD23      LEU  86   5.618   4.176   0.031

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ALA  87           H        ALA  87   9.411   2.948   1.647
    2    HA   ALA  87           HA       ALA  87   8.844   4.863   3.610
    3    HB1  ALA  87           HB1      ALA  87   9.667   2.047   3.533
    4    HB3  ALA  87           HB2      ALA  87   8.533   2.855   4.612
    5    HB2  ALA  87           HB3      ALA  87  10.260   2.896   4.963

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ARG  88           H        ARG  88  11.939   3.453   2.645
    2    HA   ARG  88           HA       ARG  88  13.534   4.843   4.481
    3    HB2  ARG  88           HB2      ARG  88  14.218   2.870   3.084
    4    HB3  ARG  88           HB3      ARG  88  14.371   3.962   1.710
    5    HG2  ARG  88           HG2      ARG  88  15.829   5.287   3.660
    6    HG3  ARG  88           HG3      ARG  88  16.157   3.600   4.043
    7    HD2  ARG  88           HD2      ARG  88  17.433   3.307   2.202
    8    HD3  ARG  88           HD3      ARG  88  16.296   4.170   1.163
    9    HE   ARG  88           HE       ARG  88  18.680   5.249   2.217
   10   HH21  ARG  88          HH11      ARG  88  19.014   7.469   2.020
   11   HH22  ARG  88          HH12      ARG  88  17.658   8.533   1.869
   12   HH11  ARG  88          HH21      ARG  88  15.338   5.984   1.925
   13   HH12  ARG  88          HH22      ARG  88  15.575   7.689   1.791

  No H/Q in entry =          13
  In of MODEL   22
    1    H    GLU  89           H        GLU  89  12.569   5.729   1.152
    2    HA   GLU  89           HA       GLU  89  14.104   8.097   0.997
    3    HB2  GLU  89           HB2      GLU  89  12.973   7.047  -0.953
    4    HB3  GLU  89           HB3      GLU  89  11.422   7.581  -0.302
    5    HG2  GLU  89           HG2      GLU  89  12.112   9.922  -0.466
    6    HG3  GLU  89           HG3      GLU  89  13.721   9.439  -0.996

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LEU  90           H        LEU  90  10.773   7.572   2.115
    2    HA   LEU  90           HA       LEU  90  10.241  10.304   2.683
    3    HB2  LEU  90           HB2      LEU  90   9.056   7.726   3.711
    4    HB3  LEU  90           HB3      LEU  90   8.415   9.318   4.128
    5    HG   LEU  90           HG       LEU  90   8.849   8.435   1.262
    6   HD12  LEU  90          HD11      LEU  90   6.317   8.093   1.316
    7   HD11  LEU  90          HD12      LEU  90   6.465   8.087   3.073
    8   HD13  LEU  90          HD13      LEU  90   7.293   6.860   2.114
    9   HD22  LEU  90          HD21      LEU  90   8.543  10.742   1.183
   10   HD21  LEU  90          HD22      LEU  90   7.551  10.771   2.640
   11   HD23  LEU  90          HD23      LEU  90   6.862  10.210   1.117

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  91           H        ILE  91  11.511   7.633   4.615
    2    HA   ILE  91           HA       ILE  91  11.634   9.003   7.081
    3    HB   ILE  91           HB       ILE  91  13.205   6.671   5.968
    4   HG12  ILE  91          HG12      ILE  91  11.179   6.832   8.220
    5   HG13  ILE  91          HG13      ILE  91  10.717   6.545   6.543
    6   HG22  ILE  91          HG21      ILE  91  13.666   6.465   8.611
    7   HG21  ILE  91          HG22      ILE  91  13.581   8.223   8.506
    8   HG23  ILE  91          HG23      ILE  91  14.768   7.340   7.548
    9   HD13  ILE  91          HD11      ILE  91  11.731   4.449   6.480
   10   HD12  ILE  91          HD12      ILE  91  11.131   4.507   8.138
   11   HD11  ILE  91          HD13      ILE  91  12.832   4.829   7.805

  No H/Q in entry =          11
  In of MODEL   22
    1    H    THR  92           H        THR  92  13.863   8.841   4.338
    2    HA   THR  92           HA       THR  92  16.016  10.248   5.503
    3    HB   THR  92           HB       THR  92  15.041  10.112   2.639
    4    HG1  THR  92           HG1      THR  92  15.882   8.221   3.051
    5   HG22  THR  92          HG21      THR  92  17.608  10.816   2.354
    6   HG21  THR  92          HG22      THR  92  17.290  11.638   3.881
    7   HG23  THR  92          HG23      THR  92  16.323  12.018   2.456

  No H/Q in entry =           7
  In of MODEL   22
    1    H    GLU  93           H        GLU  93  13.129  11.383   3.761
    2    HA   GLU  93           HA       GLU  93  13.708  14.147   3.873
    3    HB2  GLU  93           HB2      GLU  93  11.011  12.759   3.879
    4    HB3  GLU  93           HB3      GLU  93  11.291  14.460   3.506
    5    HG2  GLU  93           HG2      GLU  93  12.647  12.222   1.987
    6    HG3  GLU  93           HG3      GLU  93  11.099  12.895   1.493

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LEU  94           H        LEU  94  11.969  11.985   6.081
    2    HA   LEU  94           HA       LEU  94  11.142  13.930   7.951
    3    HB2  LEU  94           HB2      LEU  94  11.733  10.979   8.233
    4    HB3  LEU  94           HB3      LEU  94  11.151  11.954   9.579
    5    HG   LEU  94           HG       LEU  94   9.677  11.993   6.945
    6   HD11  LEU  94          HD11      LEU  94   9.764   9.776   8.954
    7   HD13  LEU  94          HD12      LEU  94   9.469   9.710   7.218
    8   HD12  LEU  94          HD13      LEU  94   8.184  10.221   8.310
    9   HD23  LEU  94          HD21      LEU  94   7.749  12.385   8.538
   10   HD22  LEU  94          HD22      LEU  94   8.981  13.646   8.577
   11   HD21  LEU  94          HD23      LEU  94   8.920  12.431   9.853

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  95           H        ILE  95  14.127  12.017   7.729
    2    HA   ILE  95           HA       ILE  95  15.281  12.950  10.145
    3    HB   ILE  95           HB       ILE  95  16.535  11.883   7.603
    4   HG12  ILE  95          HG12      ILE  95  16.236  10.686  10.372
    5   HG13  ILE  95          HG13      ILE  95  15.075  10.418   9.073
    6   HG21  ILE  95          HG21      ILE  95  17.777  12.702  10.248
    7   HG23  ILE  95          HG22      ILE  95  18.242  13.229   8.629
    8   HG22  ILE  95          HG23      ILE  95  18.556  11.572   9.142
    9   HD13  ILE  95          HD11      ILE  95  16.567   9.146   7.818
   10   HD12  ILE  95          HD12      ILE  95  17.037   8.702   9.456
   11   HD11  ILE  95          HD13      ILE  95  17.986   9.885   8.558

  No H/Q in entry =          11
  In of MODEL   22
    1    H    GLU  96           H        GLU  96  15.441  14.178   6.809
    2    HA   GLU  96           HA       GLU  96  17.274  16.267   7.288
    3    HB2  GLU  96           HB2      GLU  96  16.621  15.597   5.028
    4    HB3  GLU  96           HB3      GLU  96  14.974  16.146   5.321
    5    HG2  GLU  96           HG2      GLU  96  15.531  18.277   4.777
    6    HG3  GLU  96           HG3      GLU  96  16.825  18.287   5.964

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LEU  97           H        LEU  97  13.763  16.062   7.706
    2    HA   LEU  97           HA       LEU  97  13.329  18.795   8.341
    3    HB2  LEU  97           HB2      LEU  97  11.823  16.262   8.955
    4    HB3  LEU  97           HB3      LEU  97  11.299  17.807   9.621
    5    HG   LEU  97           HG       LEU  97  11.795  17.388   6.659
    6   HD12  LEU  97          HD11      LEU  97   9.272  17.247   6.533
    7   HD11  LEU  97          HD12      LEU  97   9.261  17.050   8.283
    8   HD13  LEU  97          HD13      LEU  97  10.052  15.845   7.266
    9   HD23  LEU  97          HD21      LEU  97  10.046  19.343   6.682
   10   HD22  LEU  97          HD22      LEU  97  11.724  19.712   7.080
   11   HD21  LEU  97          HD23      LEU  97  10.532  19.538   8.366

  No H/Q in entry =          11
  In of MODEL   22
    1    H    HIS  98           H        HIS  98  14.160  15.977  10.345
    2    HA   HIS  98           HA       HIS  98  13.987  17.241  12.858
    3    HB2  HIS  98           HB2      HIS  98  15.752  14.991  11.866
    4    HB3  HIS  98           HB3      HIS  98  15.742  15.533  13.546
    5    HD1  HIS  98           HD1      HIS  98  13.560  13.887  10.950
    6    HD2  HIS  98           HD2      HIS  98  13.434  14.813  15.012
    7    HE1  HIS  98           HE1      HIS  98  11.538  12.683  11.898
    8    HE2  HIS  98           HE2      HIS  98  11.442  13.239  14.368

  No H/Q in entry =           8
  In of MODEL   22
    1    H    GLU  99           H        GLU  99  16.549  17.135  10.432
    2    HA   GLU  99           HA       GLU  99  18.522  18.480  11.965
    3    HB2  GLU  99           HB2      GLU  99  19.015  17.191   9.900
    4    HB3  GLU  99           HB3      GLU  99  18.202  18.440   8.954
    5    HG2  GLU  99           HG2      GLU  99  19.798  20.120   9.747
    6    HG3  GLU  99           HG3      GLU  99  20.580  18.924  10.775

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LYS 100           H        LYS 100  16.000  19.625   9.738
    2    HA   LYS 100           HA       LYS 100  16.783  22.367   9.880
    3    HB2  LYS 100           HB2      LYS 100  14.159  21.063   9.119
    4    HB3  LYS 100           HB3      LYS 100  14.450  22.803   9.026
    5    HG2  LYS 100           HG2      LYS 100  16.429  22.362   7.567
    6    HG3  LYS 100           HG3      LYS 100  16.024  20.643   7.586
    7    HD2  LYS 100           HD2      LYS 100  13.830  21.140   6.578
    8    HD3  LYS 100           HD3      LYS 100  14.218  22.861   6.566
    9    HE2  LYS 100           HE2      LYS 100  16.184  22.387   5.113
   10    HE3  LYS 100           HE3      LYS 100  15.727  20.680   5.082
   11    HZ1  LYS 100           HZ1      LYS 100  13.894  22.862   4.237
   12    HZ3  LYS 100           HZ2      LYS 100  13.719  21.192   3.977
   13    HZ2  LYS 100           HZ3      LYS 100  14.928  22.058   3.158

  No H/Q in entry =          13
  In of MODEL   22
    1    H    LEU 101           H        LEU 101  14.689  20.314  11.842
    2    HA   LEU 101           HA       LEU 101  13.508  22.379  13.413
    3    HB2  LEU 101           HB2      LEU 101  13.963  19.432  13.803
    4    HB3  LEU 101           HB3      LEU 101  13.418  20.412  15.161
    5    HG   LEU 101           HG       LEU 101  12.008  20.489  12.487
    6   HD12  LEU 101          HD11      LEU 101  10.352  18.920  13.753
    7   HD11  LEU 101          HD12      LEU 101  11.745  18.515  14.753
    8   HD13  LEU 101          HD13      LEU 101  11.786  18.206  13.017
    9   HD21  LEU 101          HD21      LEU 101  11.338  21.284  15.336
   10   HD23  LEU 101          HD22      LEU 101  10.082  21.050  14.122
   11   HD22  LEU 101          HD23      LEU 101  11.312  22.291  13.886

  No H/Q in entry =          11
  In of MODEL   22
    1    H    LYS 102           H        LYS 102  16.659  21.785  12.988
    2    HA   LYS 102           HA       LYS 102  18.498  22.667  14.064
    3    HB2  LYS 102           HB2      LYS 102  16.673  24.175  15.189
    4    HB3  LYS 102           HB3      LYS 102  16.881  23.116  16.569
    5    HG2  LYS 102           HG2      LYS 102  18.769  25.134  15.402
    6    HG3  LYS 102           HG3      LYS 102  18.383  24.820  17.081
    7    HD2  LYS 102           HD2      LYS 102  20.064  22.913  15.403
    8    HD3  LYS 102           HD3      LYS 102  20.744  24.239  16.336
    9    HE2  LYS 102           HE2      LYS 102  20.355  21.690  17.308
   10    HE3  LYS 102           HE3      LYS 102  20.563  23.135  18.297
   11    HZ2  LYS 102           HZ1      LYS 102  18.599  21.843  18.911
   12    HZ1  LYS 102           HZ2      LYS 102  17.958  22.068  17.360
   13    HZ3  LYS 102           HZ3      LYS 102  18.179  23.400  18.384

  No H/Q in entry =          13
  In of MODEL   22
    1    H    ALA 103           H        ALA 103  16.426  21.056  16.482
    2    HA   ALA 103           HA       ALA 103  18.154  19.855  18.145
    3    HB2  ALA 103           HB1      ALA 103  16.578  17.841  18.137
    4    HB1  ALA 103           HB2      ALA 103  15.683  18.688  16.876
    5    HB3  ALA 103           HB3      ALA 103  15.853  19.412  18.473

  No H/Q in entry =           5
  In of MODEL   22
    1    H1   ALA   1           H3       ALA   1  -1.528  -7.151 -21.495
    2    H2   ALA   1           H2       ALA   1  -2.318  -8.589 -21.042
    3    H3   ALA   1           H1       ALA   1  -0.708  -8.633 -21.592
    4    HA   ALA   1           HA       ALA   1  -1.534  -9.109 -23.590
    5    HB1  ALA   1           HB1      ALA   1  -3.669  -9.835 -23.123
    6    HB2  ALA   1           HB2      ALA   1  -4.112  -8.328 -23.924
    7    HB3  ALA   1           HB3      ALA   1  -4.056  -8.405 -22.165

  No H/Q in entry =           7
  In of MODEL   22
    1    H    GLU   2           H        GLU   2  -2.362  -7.925 -25.584
    2    HA   GLU   2           HA       GLU   2  -0.968  -5.907 -26.460
    3    HB2  GLU   2           HB2      GLU   2  -3.974  -5.987 -26.788
    4    HB3  GLU   2           HB3      GLU   2  -2.853  -5.121 -27.835
    5    HG2  GLU   2           HG2      GLU   2  -2.339  -7.010 -28.985
    6    HG3  GLU   2           HG3      GLU   2  -2.042  -7.913 -27.505

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLU   3           H        GLU   3  -4.137  -4.661 -25.573
    2    HA   GLU   3           HA       GLU   3  -3.103  -2.100 -24.944
    3    HB2  GLU   3           HB2      GLU   3  -5.786  -3.425 -24.620
    4    HB3  GLU   3           HB3      GLU   3  -5.497  -1.808 -23.975
    5    HG2  GLU   3           HG2      GLU   3  -5.137  -0.883 -26.101
    6    HG3  GLU   3           HG3      GLU   3  -4.734  -2.437 -26.822

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LEU   4           H        LEU   4  -4.691  -4.462 -22.767
    2    HA   LEU   4           HA       LEU   4  -4.340  -3.229 -20.376
    3    HB2  LEU   4           HB2      LEU   4  -3.783  -6.169 -20.840
    4    HB3  LEU   4           HB3      LEU   4  -4.197  -5.422 -19.298
    5    HG   LEU   4           HG       LEU   4  -5.961  -5.507 -21.768
    6   HD13  LEU   4          HD11      LEU   4  -7.151  -7.227 -20.772
    7   HD12  LEU   4          HD12      LEU   4  -6.674  -6.764 -19.140
    8   HD11  LEU   4          HD13      LEU   4  -5.531  -7.604 -20.186
    9   HD23  LEU   4          HD21      LEU   4  -7.655  -4.699 -19.907
   10   HD22  LEU   4          HD22      LEU   4  -6.619  -3.525 -20.716
   11   HD21  LEU   4          HD23      LEU   4  -6.196  -4.112 -19.108

  No H/Q in entry =          11
  In of MODEL   22
    1    H    GLU   5           H        GLU   5  -1.828  -5.065 -22.096
    2    HA   GLU   5           HA       GLU   5   0.147  -4.770 -20.053
    3    HB2  GLU   5           HB2      GLU   5   0.224  -6.543 -21.802
    4    HB3  GLU   5           HB3      GLU   5   0.539  -5.298 -23.013
    5    HG2  GLU   5           HG2      GLU   5   2.597  -4.652 -21.848
    6    HG3  GLU   5           HG3      GLU   5   2.280  -5.846 -20.590

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLU   6           H        GLU   6  -0.484  -3.064 -23.102
    2    HA   GLU   6           HA       GLU   6   1.677  -1.223 -22.829
    3    HB2  GLU   6           HB2      GLU   6   0.508  -1.743 -24.985
    4    HB3  GLU   6           HB3      GLU   6  -0.895  -0.861 -24.382
    5    HG2  GLU   6           HG2      GLU   6   0.300   0.736 -25.658
    6    HG3  GLU   6           HG3      GLU   6   0.729   1.098 -23.988

  No H/Q in entry =           6
  In of MODEL   22
    1    H    VAL   7           H        VAL   7  -1.664  -1.306 -21.796
    2    HA   VAL   7           HA       VAL   7  -1.899   1.407 -20.964
    3    HB   VAL   7           HB       VAL   7  -3.354  -1.116 -20.129
    4   HG11  VAL   7          HG11      VAL   7  -3.744   1.773 -19.320
    5   HG13  VAL   7          HG12      VAL   7  -3.642   0.350 -18.283
    6   HG12  VAL   7          HG13      VAL   7  -5.072   0.613 -19.280
    7   HG21  VAL   7          HG21      VAL   7  -3.507  -0.043 -22.519
    8   HG23  VAL   7          HG22      VAL   7  -4.461   1.203 -21.713
    9   HG22  VAL   7          HG23      VAL   7  -5.000  -0.476 -21.685

  No H/Q in entry =           9
  In of MODEL   22
    1    H    VAL   8           H        VAL   8  -0.906  -1.572 -19.313
    2    HA   VAL   8           HA       VAL   8  -0.600  -0.488 -16.718
    3    HB   VAL   8           HB       VAL   8   0.813  -2.802 -18.068
    4   HG11  VAL   8          HG11      VAL   8   0.812  -1.855 -15.189
    5   HG13  VAL   8          HG12      VAL   8   2.207  -2.067 -16.248
    6   HG12  VAL   8          HG13      VAL   8   1.314  -3.474 -15.674
    7   HG23  VAL   8          HG21      VAL   8  -1.153  -3.240 -15.874
    8   HG22  VAL   8          HG22      VAL   8  -0.953  -4.108 -17.393
    9   HG21  VAL   8          HG23      VAL   8  -1.844  -2.591 -17.360

  No H/Q in entry =           9
  In of MODEL   22
    1    H    MET   9           H        MET   9   1.659  -0.784 -19.457
    2    HA   MET   9           HA       MET   9   3.937   0.269 -18.190
    3    HB2  MET   9           HB2      MET   9   2.992   0.232 -21.048
    4    HB3  MET   9           HB3      MET   9   4.465   1.091 -20.601
    5    HG2  MET   9           HG2      MET   9   5.159  -1.095 -19.414
    6    HG3  MET   9           HG3      MET   9   3.866  -1.856 -20.343
    7    HE1  MET   9           HE1      MET   9   3.703  -2.220 -22.619
    8    HE3  MET   9           HE2      MET   9   4.823  -1.791 -23.909
    9    HE2  MET   9           HE3      MET   9   3.803  -0.549 -23.189

  No H/Q in entry =           9
  In of MODEL   22
    1    H    GLY  10           H        GLY  10   1.253   1.860 -19.878
    2    HA3  GLY  10           HA2      GLY  10   2.207   4.517 -19.634
    3    HA2  GLY  10           HA3      GLY  10   0.519   4.051 -19.844

  No H/Q in entry =           3
  In of MODEL   22
    1    H    LEU  11           H        LEU  11   0.118   2.526 -17.557
    2    HA   LEU  11           HA       LEU  11  -0.424   4.503 -15.601
    3    HB2  LEU  11           HB2      LEU  11  -0.349   1.488 -15.441
    4    HB3  LEU  11           HB3      LEU  11  -0.865   2.511 -14.102
    5    HG   LEU  11           HG       LEU  11  -2.095   2.618 -16.869
    6   HD13  LEU  11          HD11      LEU  11  -2.675   0.474 -16.113
    7   HD12  LEU  11          HD12      LEU  11  -4.030   1.463 -15.573
    8   HD11  LEU  11          HD13      LEU  11  -2.776   0.987 -14.428
    9   HD22  LEU  11          HD21      LEU  11  -2.695   4.633 -15.867
   10   HD21  LEU  11          HD22      LEU  11  -2.623   3.969 -14.235
   11   HD23  LEU  11          HD23      LEU  11  -3.994   3.598 -15.280

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  12           H        ILE  12   2.126   2.044 -15.833
    2    HA   ILE  12           HA       ILE  12   3.323   2.588 -13.327
    3    HB   ILE  12           HB       ILE  12   4.585   1.547 -15.886
    4   HG12  ILE  12          HG12      ILE  12   2.576   0.310 -14.747
    5   HG13  ILE  12          HG13      ILE  12   3.983  -0.622 -15.218
    6   HG22  ILE  12          HG21      ILE  12   6.273   0.543 -14.314
    7   HG21  ILE  12          HG22      ILE  12   5.557   1.485 -13.008
    8   HG23  ILE  12          HG23      ILE  12   6.322   2.303 -14.369
    9   HD11  ILE  12          HD11      ILE  12   3.500   0.497 -12.445
   10   HD13  ILE  12          HD12      ILE  12   4.789  -0.604 -12.928
   11   HD12  ILE  12          HD13      ILE  12   3.126  -1.147 -12.929

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  13           H        ILE  13   3.930   3.849 -16.584
    2    HA   ILE  13           HA       ILE  13   6.061   5.575 -15.855
    3    HB   ILE  13           HB       ILE  13   4.035   5.653 -18.106
    4   HG12  ILE  13          HG12      ILE  13   5.857   3.805 -17.828
    5   HG13  ILE  13          HG13      ILE  13   5.636   4.558 -19.403
    6   HG22  ILE  13          HG21      ILE  13   5.832   7.213 -19.165
    7   HG21  ILE  13          HG22      ILE  13   6.345   7.508 -17.508
    8   HG23  ILE  13          HG23      ILE  13   4.702   7.912 -18.004
    9   HD12  ILE  13          HD11      ILE  13   8.076   4.314 -18.374
   10   HD11  ILE  13          HD12      ILE  13   7.607   5.766 -17.496
   11   HD13  ILE  13          HD13      ILE  13   7.617   5.771 -19.256

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ASN  14           H        ASN  14   2.553   6.061 -16.133
    2    HA   ASN  14           HA       ASN  14   2.502   8.807 -15.500
    3    HB2  ASN  14           HB2      ASN  14   0.615   7.159 -16.333
    4    HB3  ASN  14           HB3      ASN  14   0.290   6.982 -14.613
    5   HD21  ASN  14          HD21      ASN  14  -1.729   8.131 -16.053
    6   HD22  ASN  14          HD22      ASN  14  -1.797   9.804 -15.788

  No H/Q in entry =           6
  In of MODEL   22
    1    H    SER  15           H        SER  15   2.209   5.932 -13.420
    2    HA   SER  15           HA       SER  15   1.892   7.304 -10.974
    3    HB2  SER  15           HB2      SER  15   2.441   5.222  -9.921
    4    HB3  SER  15           HB3      SER  15   1.622   4.797 -11.420
    5    HG   SER  15           HG       SER  15   4.203   5.116 -11.939

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLY  16           H        GLY  16   4.775   6.214 -12.724
    2    HA3  GLY  16           HA2      GLY  16   6.693   6.979 -10.790
    3    HA2  GLY  16           HA3      GLY  16   7.001   6.775 -12.512

  No H/Q in entry =           3
  In of MODEL   22
    1    H    GLN  17           H        GLN  17   5.309   8.726 -13.582
    2    HA   GLN  17           HA       GLN  17   6.877  11.073 -13.273
    3    HB2  GLN  17           HB2      GLN  17   5.541  10.559 -15.312
    4    HB3  GLN  17           HB3      GLN  17   4.065  10.835 -14.385
    5    HG2  GLN  17           HG2      GLN  17   4.825  13.150 -13.903
    6    HG3  GLN  17           HG3      GLN  17   6.252  12.870 -14.900
    7   HE21  GLN  17          HE21      GLN  17   5.823  14.178 -16.723
    8   HE22  GLN  17          HE22      GLN  17   4.422  14.039 -17.674

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ALA  18           H        ALA  18   3.777  10.046 -11.930
    2    HA   ALA  18           HA       ALA  18   3.040  12.434 -10.670
    3    HB1  ALA  18           HB1      ALA  18   1.920   9.972 -10.892
    4    HB2  ALA  18           HB2      ALA  18   1.364  11.192  -9.748
    5    HB3  ALA  18           HB3      ALA  18   2.458   9.914  -9.213

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ARG  19           H        ARG  19   4.921   9.680  -9.382
    2    HA   ARG  19           HA       ARG  19   5.442  10.843  -6.860
    3    HB2  ARG  19           HB2      ARG  19   5.867   8.441  -7.383
    4    HB3  ARG  19           HB3      ARG  19   7.224   8.931  -8.401
    5    HG2  ARG  19           HG2      ARG  19   8.334   9.978  -6.477
    6    HG3  ARG  19           HG3      ARG  19   6.957   9.585  -5.448
    7    HD2  ARG  19           HD2      ARG  19   8.725   7.958  -5.084
    8    HD3  ARG  19           HD3      ARG  19   7.356   7.169  -5.872
    9    HE   ARG  19           HE       ARG  19   9.063   7.992  -7.916
   10   HH21  ARG  19          HH11      ARG  19  10.631   6.593  -8.760
   11   HH22  ARG  19          HH12      ARG  19  11.180   5.248  -7.822
   12   HH11  ARG  19          HH21      ARG  19   9.136   5.966  -5.135
   13   HH12  ARG  19          HH22      ARG  19  10.330   4.893  -5.768

  No H/Q in entry =          13
  In of MODEL   22
    1    H    SER  20           H        SER  20   7.267  10.876  -9.904
    2    HA   SER  20           HA       SER  20   9.504  12.303  -9.076
    3    HB2  SER  20           HB2      SER  20   9.544  11.423 -11.279
    4    HB3  SER  20           HB3      SER  20   8.043  12.235 -11.711
    5    HG   SER  20           HG       SER  20   9.133  14.207 -11.575

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU  21           H        LEU  21   6.402  13.556 -10.283
    2    HA   LEU  21           HA       LEU  21   7.059  16.305 -10.061
    3    HB2  LEU  21           HB2      LEU  21   4.396  14.870  -9.983
    4    HB3  LEU  21           HB3      LEU  21   4.557  16.625  -9.995
    5    HG   LEU  21           HG       LEU  21   5.747  14.812 -12.116
    6   HD12  LEU  21          HD11      LEU  21   3.844  15.725 -13.525
    7   HD11  LEU  21          HD12      LEU  21   3.123  16.322 -12.030
    8   HD13  LEU  21          HD13      LEU  21   3.358  14.590 -12.264
    9   HD21  LEU  21          HD21      LEU  21   5.595  17.783 -11.681
   10   HD23  LEU  21          HD22      LEU  21   5.533  17.188 -13.336
   11   HD22  LEU  21          HD23      LEU  21   6.927  16.829 -12.329

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ALA  22           H        ALA  22   5.552  14.011  -7.813
    2    HA   ALA  22           HA       ALA  22   4.934  15.818  -5.750
    3    HB3  ALA  22           HB1      ALA  22   4.186  13.422  -5.912
    4    HB2  ALA  22           HB2      ALA  22   4.768  13.899  -4.317
    5    HB1  ALA  22           HB3      ALA  22   5.799  12.945  -5.384

  No H/Q in entry =           5
  In of MODEL   22
    1    H    TYR  23           H        TYR  23   7.880  13.808  -6.178
    2    HA   TYR  23           HA       TYR  23   9.251  14.838  -3.923
    3    HB2  TYR  23           HB2      TYR  23  10.052  12.833  -5.076
    4    HB3  TYR  23           HB3      TYR  23  10.364  13.771  -6.536
    5    HD1  TYR  23           HD1      TYR  23  11.316  13.457  -2.938
    6    HD2  TYR  23           HD2      TYR  23  12.398  14.942  -6.822
    7    HE1  TYR  23           HE1      TYR  23  13.569  14.047  -2.086
    8    HE2  TYR  23           HE2      TYR  23  14.649  15.535  -5.968
    9    HH   TYR  23           HH       TYR  23  15.569  14.856  -2.588

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ALA  24           H        ALA  24   9.071  15.939  -7.292
    2    HA   ALA  24           HA       ALA  24  10.953  18.036  -7.043
    3    HB2  ALA  24           HB1      ALA  24  10.516  18.093  -9.253
    4    HB3  ALA  24           HB2      ALA  24   8.956  18.833  -8.899
    5    HB1  ALA  24           HB3      ALA  24   9.092  17.081  -9.026

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA  25           H        ALA  25   7.474  17.831  -6.431
    2    HA   ALA  25           HA       ALA  25   6.975  20.546  -5.867
    3    HB1  ALA  25           HB1      ALA  25   5.327  18.537  -6.070
    4    HB2  ALA  25           HB2      ALA  25   4.948  19.825  -4.924
    5    HB3  ALA  25           HB3      ALA  25   5.646  18.309  -4.349

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU  26           H        LEU  26   8.056  17.877  -3.811
    2    HA   LEU  26           HA       LEU  26   8.144  19.312  -1.375
    3    HB2  LEU  26           HB2      LEU  26   8.256  16.896  -1.366
    4    HB3  LEU  26           HB3      LEU  26   9.729  16.913  -2.333
    5    HG   LEU  26           HG       LEU  26  10.931  18.042  -0.491
    6   HD12  LEU  26          HD11      LEU  26   9.699  18.044   1.765
    7   HD11  LEU  26          HD12      LEU  26   8.215  17.895   0.827
    8   HD13  LEU  26          HD13      LEU  26   9.250  19.308   0.619
    9   HD21  LEU  26          HD21      LEU  26   9.412  15.564   0.382
   10   HD23  LEU  26          HD22      LEU  26  10.922  16.139   1.082
   11   HD22  LEU  26          HD23      LEU  26  10.885  15.577  -0.587

  No H/Q in entry =          11
  In of MODEL   22
    1    H    LYS  27           H        LYS  27  10.572  18.753  -3.893
    2    HA   LYS  27           HA       LYS  27  12.743  20.012  -2.661
    3    HB2  LYS  27           HB2      LYS  27  12.860  18.662  -4.749
    4    HB3  LYS  27           HB3      LYS  27  12.088  19.987  -5.618
    5    HG2  LYS  27           HG2      LYS  27  13.940  21.487  -5.038
    6    HG3  LYS  27           HG3      LYS  27  14.708  20.202  -4.097
    7    HD2  LYS  27           HD2      LYS  27  14.867  18.813  -6.149
    8    HD3  LYS  27           HD3      LYS  27  14.144  20.124  -7.081
    9    HE2  LYS  27           HE2      LYS  27  16.019  21.605  -6.466
   10    HE3  LYS  27           HE3      LYS  27  16.746  20.298  -5.524
   11    HZ3  LYS  27           HZ1      LYS  27  17.740  20.402  -7.708
   12    HZ2  LYS  27           HZ2      LYS  27  16.217  20.271  -8.453
   13    HZ1  LYS  27           HZ3      LYS  27  16.848  18.967  -7.565

  No H/Q in entry =          13
  In of MODEL   22
    1    H    GLN  28           H        GLN  28  10.115  21.370  -4.619
    2    HA   GLN  28           HA       GLN  28  11.055  24.030  -4.774
    3    HB2  GLN  28           HB2      GLN  28   8.229  22.939  -4.667
    4    HB3  GLN  28           HB3      GLN  28   8.631  24.613  -5.045
    5    HG2  GLN  28           HG2      GLN  28   9.642  22.201  -6.580
    6    HG3  GLN  28           HG3      GLN  28   8.308  23.234  -7.093
    7   HE21  GLN  28          HE21      GLN  28  11.425  22.739  -7.852
    8   HE22  GLN  28          HE22      GLN  28  11.921  24.324  -8.204

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ALA  29           H        ALA  29   9.130  22.326  -2.339
    2    HA   ALA  29           HA       ALA  29   8.559  24.517  -0.663
    3    HB2  ALA  29           HB1      ALA  29   7.838  22.945   0.906
    4    HB1  ALA  29           HB2      ALA  29   9.070  21.770   0.446
    5    HB3  ALA  29           HB3      ALA  29   7.685  22.050  -0.606

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LYS  30           H        LYS  30  11.307  22.271  -0.721
    2    HA   LYS  30           HA       LYS  30  12.612  23.240   1.583
    3    HB2  LYS  30           HB2      LYS  30  13.725  21.959  -0.922
    4    HB3  LYS  30           HB3      LYS  30  14.701  22.328   0.501
    5    HG2  LYS  30           HG2      LYS  30  13.155  20.934   1.879
    6    HG3  LYS  30           HG3      LYS  30  12.278  20.503   0.408
    7    HD2  LYS  30           HD2      LYS  30  14.333  19.532  -0.547
    8    HD3  LYS  30           HD3      LYS  30  15.229  19.977   0.907
    9    HE2  LYS  30           HE2      LYS  30  13.733  18.536   2.260
   10    HE3  LYS  30           HE3      LYS  30  12.866  18.071   0.790
   11    HZ2  LYS  30           HZ1      LYS  30  14.669  16.509   1.558
   12    HZ1  LYS  30           HZ2      LYS  30  15.797  17.704   1.108
   13    HZ3  LYS  30           HZ3      LYS  30  14.770  17.010  -0.059

  No H/Q in entry =          13
  In of MODEL   22
    1    H    GLN  31           H        GLN  31  12.501  24.438  -1.716
    2    HA   GLN  31           HA       GLN  31  14.637  26.349  -1.292
    3    HB2  GLN  31           HB2      GLN  31  12.599  26.376  -3.522
    4    HB3  GLN  31           HB3      GLN  31  14.214  27.085  -3.520
    5    HG2  GLN  31           HG2      GLN  31  14.697  24.394  -2.939
    6    HG3  GLN  31           HG3      GLN  31  13.396  24.327  -4.120
    7   HE21  GLN  31          HE21      GLN  31  16.247  23.557  -4.516
    8   HE22  GLN  31          HE22      GLN  31  16.814  24.533  -5.783

  No H/Q in entry =           8
  In of MODEL   22
    1    H    GLY  32           H        GLY  32  11.562  26.144  -0.154
    2    HA3  GLY  32           HA2      GLY  32  10.389  27.704   1.114
    3    HA2  GLY  32           HA3      GLY  32  11.506  28.948   0.565

  No H/Q in entry =           3
  In of MODEL   22
    1    H    ASP  33           H        ASP  33  10.163  27.029  -1.928
    2    HA   ASP  33           HA       ASP  33   8.482  29.287  -2.791
    3    HB2  ASP  33           HB2      ASP  33   9.599  26.874  -4.227
    4    HB3  ASP  33           HB3      ASP  33   8.441  27.979  -4.962

  No H/Q in entry =           4
  In of MODEL   22
    1    H    PHE  34           H        PHE  34   6.794  28.800  -1.231
    2    HA   PHE  34           HA       PHE  34   5.435  26.316  -1.135
    3    HB2  PHE  34           HB2      PHE  34   4.449  29.096  -0.462
    4    HB3  PHE  34           HB3      PHE  34   3.612  27.600  -0.050
    5    HD1  PHE  34           HD1      PHE  34   5.839  30.018   1.166
    6    HD2  PHE  34           HD2      PHE  34   5.194  25.772   1.118
    7    HE1  PHE  34           HE1      PHE  34   7.226  29.783   3.206
    8    HE2  PHE  34           HE2      PHE  34   6.584  25.540   3.156
    9    HZ   PHE  34           HZ       PHE  34   7.594  27.546   4.200

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ALA  35           H        ALA  35   4.986  29.173  -3.151
    2    HA   ALA  35           HA       ALA  35   2.442  28.536  -4.181
    3    HB3  ALA  35           HB1      ALA  35   3.487  29.934  -6.219
    4    HB2  ALA  35           HB2      ALA  35   4.699  30.307  -4.993
    5    HB1  ALA  35           HB3      ALA  35   3.004  30.703  -4.707

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA  36           H        ALA  36   5.679  27.888  -5.527
    2    HA   ALA  36           HA       ALA  36   4.708  26.447  -7.770
    3    HB3  ALA  36           HB1      ALA  36   6.867  26.588  -8.381
    4    HB2  ALA  36           HB2      ALA  36   7.354  25.566  -7.028
    5    HB1  ALA  36           HB3      ALA  36   7.233  27.313  -6.816

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA  37           H        ALA  37   5.664  25.465  -4.512
    2    HA   ALA  37           HA       ALA  37   5.630  22.676  -4.937
    3    HB2  ALA  37           HB1      ALA  37   5.348  24.469  -2.562
    4    HB1  ALA  37           HB2      ALA  37   6.493  23.160  -2.849
    5    HB3  ALA  37           HB3      ALA  37   4.834  22.793  -2.381

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LYS  38           H        LYS  38   3.076  24.865  -3.778
    2    HA   LYS  38           HA       LYS  38   0.991  23.034  -3.558
    3    HB2  LYS  38           HB2      LYS  38   1.319  25.794  -3.310
    4    HB3  LYS  38           HB3      LYS  38   0.124  25.634  -4.592
    5    HG2  LYS  38           HG2      LYS  38  -1.318  24.301  -3.151
    6    HG3  LYS  38           HG3      LYS  38  -0.076  24.253  -1.891
    7    HD2  LYS  38           HD2      LYS  38  -0.283  26.589  -1.448
    8    HD3  LYS  38           HD3      LYS  38  -1.193  26.868  -2.933
    9    HE2  LYS  38           HE2      LYS  38  -2.702  26.892  -0.997
   10    HE3  LYS  38           HE3      LYS  38  -3.062  25.511  -2.038
   11    HZ3  LYS  38           HZ1      LYS  38  -2.328  24.049  -0.501
   12    HZ2  LYS  38           HZ2      LYS  38  -2.692  25.305   0.586
   13    HZ1  LYS  38           HZ3      LYS  38  -1.094  25.067   0.065

  No H/Q in entry =          13
  In of MODEL   22
    1    H    ALA  39           H        ALA  39   1.962  24.940  -6.407
    2    HA   ALA  39           HA       ALA  39  -0.102  24.053  -8.114
    3    HB2  ALA  39           HB1      ALA  39   2.631  24.723  -9.162
    4    HB1  ALA  39           HB2      ALA  39   1.652  25.977  -8.401
    5    HB3  ALA  39           HB3      ALA  39   1.050  25.132  -9.827

  No H/Q in entry =           5
  In of MODEL   22
    1    H    MET  40           H        MET  40   3.145  22.783  -7.524
    2    HA   MET  40           HA       MET  40   3.070  20.758  -9.513
    3    HB2  MET  40           HB2      MET  40   4.673  21.000  -6.961
    4    HB3  MET  40           HB3      MET  40   4.937  19.744  -8.172
    5    HG2  MET  40           HG2      MET  40   4.971  22.700  -8.842
    6    HG3  MET  40           HG3      MET  40   6.424  21.810  -8.388
    7    HE3  MET  40           HE1      MET  40   7.322  19.598 -11.191
    8    HE2  MET  40           HE2      MET  40   6.757  19.276  -9.554
    9    HE1  MET  40           HE3      MET  40   7.842  20.633  -9.854

  No H/Q in entry =           9
  In of MODEL   22
    1    H    MET  41           H        MET  41   2.146  20.798  -6.091
    2    HA   MET  41           HA       MET  41   1.637  18.029  -5.810
    3    HB2  MET  41           HB2      MET  41   0.280  20.377  -4.466
    4    HB3  MET  41           HB3      MET  41   0.138  18.699  -3.956
    5    HG2  MET  41           HG2      MET  41   2.846  18.946  -3.987
    6    HG3  MET  41           HG3      MET  41   2.390  20.601  -3.595
    7    HE2  MET  41           HE1      MET  41  -0.642  19.324  -1.875
    8    HE1  MET  41           HE2      MET  41   0.162  20.844  -2.252
    9    HE3  MET  41           HE3      MET  41   0.104  20.275  -0.584

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ASP  42           H        ASP  42  -0.423  20.734  -6.793
    2    HA   ASP  42           HA       ASP  42  -2.851  19.352  -6.934
    3    HB2  ASP  42           HB2      ASP  42  -2.167  21.928  -7.193
    4    HB3  ASP  42           HB3      ASP  42  -2.310  21.529  -8.901

  No H/Q in entry =           4
  In of MODEL   22
    1    H    GLN  43           H        GLN  43  -0.410  19.961  -9.431
    2    HA   GLN  43           HA       GLN  43  -1.780  18.626 -11.521
    3    HB2  GLN  43           HB2      GLN  43   1.173  19.169 -11.133
    4    HB3  GLN  43           HB3      GLN  43   0.469  18.520 -12.616
    5    HG2  GLN  43           HG2      GLN  43  -1.061  20.534 -12.665
    6    HG3  GLN  43           HG3      GLN  43  -0.117  21.200 -11.336
    7   HE21  GLN  43          HE21      GLN  43   0.035  22.819 -13.424
    8   HE22  GLN  43          HE22      GLN  43   1.454  22.609 -14.327

  No H/Q in entry =           8
  In of MODEL   22
    1    H    SER  44           H        SER  44   0.575  17.511  -9.123
    2    HA   SER  44           HA       SER  44   0.936  14.906 -10.143
    3    HB2  SER  44           HB2      SER  44   1.813  16.356  -7.907
    4    HB3  SER  44           HB3      SER  44   0.961  14.966  -7.236
    5    HG   SER  44           HG       SER  44   3.079  14.365  -7.657

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ARG  45           H        ARG  45  -1.401  16.206  -7.813
    2    HA   ARG  45           HA       ARG  45  -2.767  13.834  -7.178
    3    HB2  ARG  45           HB2      ARG  45  -2.989  16.002  -5.990
    4    HB3  ARG  45           HB3      ARG  45  -3.848  16.658  -7.380
    5    HG2  ARG  45           HG2      ARG  45  -5.598  14.917  -7.099
    6    HG3  ARG  45           HG3      ARG  45  -4.752  14.315  -5.673
    7    HD2  ARG  45           HD2      ARG  45  -4.982  16.581  -4.621
    8    HD3  ARG  45           HD3      ARG  45  -5.970  17.090  -6.006
    9    HE   ARG  45           HE       ARG  45  -7.061  14.705  -4.965
   10   HH21  ARG  45          HH11      ARG  45  -8.900  14.765  -3.699
   11   HH22  ARG  45          HH12      ARG  45  -9.311  16.202  -2.833
   12   HH11  ARG  45          HH21      ARG  45  -6.548  17.958  -3.945
   13   HH12  ARG  45          HH22      ARG  45  -7.974  18.011  -2.971

  No H/Q in entry =          13
  In of MODEL   22
    1    H    MET  46           H        MET  46  -3.368  16.228  -9.734
    2    HA   MET  46           HA       MET  46  -5.693  15.032 -10.800
    3    HB2  MET  46           HB2      MET  46  -3.606  16.878 -11.969
    4    HB3  MET  46           HB3      MET  46  -4.977  16.305 -12.924
    5    HG2  MET  46           HG2      MET  46  -6.542  17.225 -11.284
    6    HG3  MET  46           HG3      MET  46  -5.206  17.733 -10.257
    7    HE1  MET  46           HE1      MET  46  -7.083  17.934 -13.429
    8    HE3  MET  46           HE2      MET  46  -5.589  18.078 -14.348
    9    HE2  MET  46           HE3      MET  46  -6.668  19.465 -14.212

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ALA  47           H        ALA  47  -2.258  14.585 -11.548
    2    HA   ALA  47           HA       ALA  47  -2.581  12.850 -13.756
    3    HB3  ALA  47           HB1      ALA  47  -0.413  13.762 -13.401
    4    HB2  ALA  47           HB2      ALA  47  -0.256  12.036 -13.064
    5    HB1  ALA  47           HB3      ALA  47  -0.363  13.189 -11.733

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU  48           H        LEU  48  -2.314  12.223 -10.281
    2    HA   LEU  48           HA       LEU  48  -2.380   9.382 -10.435
    3    HB2  LEU  48           HB2      LEU  48  -3.168  11.296  -8.226
    4    HB3  LEU  48           HB3      LEU  48  -3.058   9.547  -8.023
    5    HG   LEU  48           HG       LEU  48  -0.773  11.267  -9.017
    6   HD13  LEU  48          HD11      LEU  48  -1.069  12.038  -6.828
    7   HD12  LEU  48          HD12      LEU  48   0.106  10.742  -6.624
    8   HD11  LEU  48          HD13      LEU  48  -1.590  10.463  -6.231
    9   HD22  LEU  48          HD21      LEU  48  -0.251   9.086  -9.653
   10   HD21  LEU  48          HD22      LEU  48  -1.117   8.364  -8.298
   11   HD23  LEU  48          HD23      LEU  48   0.447   9.133  -8.035

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ASN  49           H        ASN  49  -4.869  11.850 -10.044
    2    HA   ASN  49           HA       ASN  49  -7.039  10.165  -9.507
    3    HB2  ASN  49           HB2      ASN  49  -7.109  12.594  -9.194
    4    HB3  ASN  49           HB3      ASN  49  -6.970  12.843 -10.929
    5   HD21  ASN  49          HD21      ASN  49  -9.028  13.848 -11.196
    6   HD22  ASN  49          HD22      ASN  49 -10.489  13.023 -10.949

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLU  50           H        GLU  50  -5.763  11.369 -12.593
    2    HA   GLU  50           HA       GLU  50  -7.701  10.092 -14.242
    3    HB2  GLU  50           HB2      GLU  50  -6.251  11.924 -15.056
    4    HB3  GLU  50           HB3      GLU  50  -4.847  10.866 -14.912
    5    HG2  GLU  50           HG2      GLU  50  -5.800   9.318 -16.549
    6    HG3  GLU  50           HG3      GLU  50  -7.270  10.282 -16.642

  No H/Q in entry =           6
  In of MODEL   22
    1    H    ALA  51           H        ALA  51  -4.524   9.133 -13.026
    2    HA   ALA  51           HA       ALA  51  -4.356   6.679 -14.440
    3    HB2  ALA  51           HB1      ALA  51  -2.375   6.413 -13.334
    4    HB1  ALA  51           HB2      ALA  51  -3.072   6.831 -11.769
    5    HB3  ALA  51           HB3      ALA  51  -2.626   8.105 -12.904

  No H/Q in entry =           5
  In of MODEL   22
    1    H    HIS  52           H        HIS  52  -5.546   7.505 -11.196
    2    HA   HIS  52           HA       HIS  52  -6.208   4.890 -10.362
    3    HB2  HIS  52           HB2      HIS  52  -6.093   6.850  -8.850
    4    HB3  HIS  52           HB3      HIS  52  -7.549   7.496  -9.606
    5    HD1  HIS  52           HD1      HIS  52  -9.766   6.033  -9.324
    6    HD2  HIS  52           HD2      HIS  52  -6.560   4.873  -6.927
    7    HE1  HIS  52           HE1      HIS  52 -10.721   4.517  -7.534
    8    HE2  HIS  52           HE2      HIS  52  -8.779   3.802  -6.064

  No H/Q in entry =           8
  In of MODEL   22
    1    H    LEU  53           H        LEU  53  -8.047   7.327 -12.159
    2    HA   LEU  53           HA       LEU  53 -10.540   6.011 -12.177
    3    HB2  LEU  53           HB2      LEU  53  -9.270   8.000 -14.047
    4    HB3  LEU  53           HB3      LEU  53 -10.863   7.321 -14.371
    5    HG   LEU  53           HG       LEU  53 -10.170   8.638 -11.726
    6   HD11  LEU  53          HD11      LEU  53 -11.361   9.852 -14.235
    7   HD13  LEU  53          HD12      LEU  53  -9.858  10.321 -13.441
    8   HD12  LEU  53          HD13      LEU  53 -11.403  10.622 -12.654
    9   HD23  LEU  53          HD21      LEU  53 -12.754   9.023 -11.883
   10   HD22  LEU  53          HD22      LEU  53 -12.167   7.424 -11.439
   11   HD21  LEU  53          HD23      LEU  53 -12.722   7.730 -13.074

  No H/Q in entry =          11
  In of MODEL   22
    1    H    VAL  54           H        VAL  54  -7.781   5.836 -14.405
    2    HA   VAL  54           HA       VAL  54  -8.982   4.051 -16.249
    3    HB   VAL  54           HB       VAL  54  -6.081   4.586 -15.559
    4   HG12  VAL  54          HG11      VAL  54  -5.817   3.499 -17.946
    5   HG11  VAL  54          HG12      VAL  54  -7.339   2.705 -17.545
    6   HG13  VAL  54          HG13      VAL  54  -5.924   2.465 -16.522
    7   HG22  VAL  54          HG21      VAL  54  -6.866   6.520 -16.609
    8   HG21  VAL  54          HG22      VAL  54  -8.048   5.644 -17.579
    9   HG23  VAL  54          HG23      VAL  54  -6.339   5.579 -18.005

  No H/Q in entry =           9
  In of MODEL   22
    1    H    GLN  55           H        GLN  55  -6.986   3.528 -13.343
    2    HA   GLN  55           HA       GLN  55  -6.870   0.712 -13.594
    3    HB2  GLN  55           HB2      GLN  55  -5.327   1.624 -12.072
    4    HB3  GLN  55           HB3      GLN  55  -6.555   2.581 -11.247
    5    HG2  GLN  55           HG2      GLN  55  -7.232   0.819  -9.929
    6    HG3  GLN  55           HG3      GLN  55  -6.992  -0.367 -11.205
    7   HE21  GLN  55          HE21      GLN  55  -5.357  -1.802 -10.703
    8   HE22  GLN  55          HE22      GLN  55  -3.979  -1.436  -9.787

  No H/Q in entry =           8
  In of MODEL   22
    1    H    THR  56           H        THR  56  -9.226   2.856 -11.990
    2    HA   THR  56           HA       THR  56 -10.797   0.960 -10.703
    3    HB   THR  56           HB       THR  56 -11.905   3.338 -12.216
    4    HG1  THR  56           HG1      THR  56 -10.527   3.136  -9.762
    5   HG21  THR  56          HG21      THR  56 -13.349   1.501 -11.012
    6   HG23  THR  56          HG22      THR  56 -13.731   3.208 -10.777
    7   HG22  THR  56          HG23      THR  56 -12.824   2.327  -9.545

  No H/Q in entry =           7
  In of MODEL   22
    1    H    LYS  57           H        LYS  57 -10.998   2.036 -14.091
    2    HA   LYS  57           HA       LYS  57 -13.137   0.328 -14.848
    3    HB2  LYS  57           HB2      LYS  57 -12.243   2.295 -16.155
    4    HB3  LYS  57           HB3      LYS  57 -10.827   1.328 -16.547
    5    HG2  LYS  57           HG2      LYS  57 -13.461   0.086 -17.129
    6    HG3  LYS  57           HG3      LYS  57 -13.009   1.455 -18.139
    7    HD2  LYS  57           HD2      LYS  57 -10.868   0.341 -18.688
    8    HD3  LYS  57           HD3      LYS  57 -11.329  -1.037 -17.691
    9    HE2  LYS  57           HE2      LYS  57 -13.300  -1.429 -19.140
   10    HE3  LYS  57           HE3      LYS  57 -12.843  -0.056 -20.147
   11    HZ1  LYS  57           HZ1      LYS  57 -10.591  -1.357 -20.244
   12    HZ3  LYS  57           HZ2      LYS  57 -11.875  -1.743 -21.289
   13    HZ2  LYS  57           HZ3      LYS  57 -11.587  -2.687 -19.904

  No H/Q in entry =          13
  In of MODEL   22
    1    H    LEU  58           H        LEU  58  -9.629  -0.072 -14.779
    2    HA   LEU  58           HA       LEU  58  -9.610  -2.591 -16.064
    3    HB2  LEU  58           HB2      LEU  58  -7.593  -1.278 -14.251
    4    HB3  LEU  58           HB3      LEU  58  -7.316  -2.798 -15.102
    5    HG   LEU  58           HG       LEU  58  -8.089  -0.203 -16.472
    6   HD11  LEU  58          HD11      LEU  58  -5.434  -1.415 -15.771
    7   HD13  LEU  58          HD12      LEU  58  -5.944   0.271 -15.727
    8   HD12  LEU  58          HD13      LEU  58  -5.593  -0.500 -17.270
    9   HD22  LEU  58          HD21      LEU  58  -8.646  -1.774 -18.062
   10   HD21  LEU  58          HD22      LEU  58  -7.596  -3.010 -17.375
   11   HD23  LEU  58          HD23      LEU  58  -6.913  -1.733 -18.380

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  59           H        ILE  59 -10.450  -1.689 -12.817
    2    HA   ILE  59           HA       ILE  59 -10.078  -4.452 -11.863
    3    HB   ILE  59           HB       ILE  59  -9.655  -2.181 -10.466
    4   HG12  ILE  59          HG12      ILE  59 -11.023  -4.529  -9.136
    5   HG13  ILE  59          HG13      ILE  59  -9.380  -4.614  -9.722
    6   HG22  ILE  59          HG21      ILE  59 -12.410  -2.910  -9.519
    7   HG21  ILE  59          HG22      ILE  59 -12.206  -1.691 -10.755
    8   HG23  ILE  59          HG23      ILE  59 -11.481  -1.472  -9.164
    9   HD13  ILE  59          HD11      ILE  59  -9.293  -4.011  -7.397
   10   HD12  ILE  59          HD12      ILE  59 -10.452  -2.712  -7.644
   11   HD11  ILE  59          HD13      ILE  59  -8.833  -2.593  -8.333

  No H/Q in entry =          11
  In of MODEL   22
    1    H    GLU  60           H        GLU  60 -12.654  -2.161 -12.684
    2    HA   GLU  60           HA       GLU  60 -14.828  -3.695 -11.675
    3    HB2  GLU  60           HB2      GLU  60 -15.056  -1.326 -12.278
    4    HB3  GLU  60           HB3      GLU  60 -14.733  -1.709 -13.966
    5    HG2  GLU  60           HG2      GLU  60 -16.758  -3.145 -14.014
    6    HG3  GLU  60           HG3      GLU  60 -17.093  -2.705 -12.352

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLY  61           H        GLY  61 -13.144  -3.671 -14.785
    2    HA3  GLY  61           HA2      GLY  61 -14.833  -5.933 -15.676
    3    HA2  GLY  61           HA3      GLY  61 -13.995  -4.823 -16.753

  No H/Q in entry =           3
  In of MODEL   22
    1    H    ASP  62           H        ASP  62 -12.618  -6.253 -13.861
    2    HA   ASP  62           HA       ASP  62 -10.354  -7.223 -15.337
    3    HB2  ASP  62           HB2      ASP  62  -9.628  -8.023 -13.082
    4    HB3  ASP  62           HB3      ASP  62 -10.039  -6.313 -13.120

  No H/Q in entry =           4
  In of MODEL   22
    1    H    ALA  63           H        ALA  63 -12.989  -8.496 -16.004
    2    HA   ALA  63           HA       ALA  63 -13.210 -11.117 -14.962
    3    HB1  ALA  63           HB1      ALA  63 -13.776 -10.347 -17.838
    4    HB2  ALA  63           HB2      ALA  63 -14.824  -9.836 -16.517
    5    HB3  ALA  63           HB3      ALA  63 -14.606 -11.553 -16.857

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLY  64           H        GLY  64 -11.366  -9.808 -17.670
    2    HA3  GLY  64           HA2      GLY  64  -9.687 -10.666 -18.974
    3    HA2  GLY  64           HA3      GLY  64  -9.178 -11.500 -17.512

  No H/Q in entry =           3
  In of MODEL   22
    1    H    GLU  65           H        GLU  65  -8.915 -13.620 -17.859
    2    HA   GLU  65           HA       GLU  65  -9.973 -14.952 -20.114
    3    HB2  GLU  65           HB2      GLU  65  -8.692 -16.009 -17.596
    4    HB3  GLU  65           HB3      GLU  65  -9.137 -17.027 -18.967
    5    HG2  GLU  65           HG2      GLU  65  -7.696 -15.730 -20.449
    6    HG3  GLU  65           HG3      GLU  65  -7.307 -14.618 -19.138

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLY  66           H        GLY  66 -10.945 -14.885 -16.767
    2    HA3  GLY  66           HA2      GLY  66 -13.635 -15.708 -17.394
    3    HA2  GLY  66           HA3      GLY  66 -12.741 -16.866 -16.428

  No H/Q in entry =           3
  In of MODEL   22
    1    H    LYS  67           H        LYS  67 -14.991 -15.936 -15.397
    2    HA   LYS  67           HA       LYS  67 -14.972 -13.549 -13.975
    3    HB2  LYS  67           HB2      LYS  67 -16.400 -16.130 -13.335
    4    HB3  LYS  67           HB3      LYS  67 -16.797 -14.543 -12.661
    5    HG2  LYS  67           HG2      LYS  67 -16.671 -15.074 -15.639
    6    HG3  LYS  67           HG3      LYS  67 -18.158 -15.227 -14.706
    7    HD2  LYS  67           HD2      LYS  67 -17.653 -12.818 -13.893
    8    HD3  LYS  67           HD3      LYS  67 -16.536 -12.749 -15.259
    9    HE2  LYS  67           HE2      LYS  67 -18.354 -13.336 -16.805
   10    HE3  LYS  67           HE3      LYS  67 -19.479 -13.462 -15.451
   11    HZ1  LYS  67           HZ1      LYS  67 -18.132 -10.981 -15.369
   12    HZ3  LYS  67           HZ2      LYS  67 -19.796 -11.288 -15.502
   13    HZ2  LYS  67           HZ3      LYS  67 -18.834 -11.192 -16.898

  No H/Q in entry =          13
  In of MODEL   22
    1    H    MET  68           H        MET  68 -13.940 -16.733 -12.943
    2    HA   MET  68           HA       MET  68 -13.382 -16.185 -10.246
    3    HB2  MET  68           HB2      MET  68 -12.511 -18.293 -12.189
    4    HB3  MET  68           HB3      MET  68 -11.822 -18.234 -10.567
    5    HG2  MET  68           HG2      MET  68 -13.827 -19.711 -10.693
    6    HG3  MET  68           HG3      MET  68 -14.050 -18.364  -9.574
    7    HE1  MET  68           HE1      MET  68 -15.609 -16.496  -9.784
    8    HE3  MET  68           HE2      MET  68 -16.456 -17.998  -9.418
    9    HE2  MET  68           HE3      MET  68 -17.163 -16.850 -10.554

  No H/Q in entry =           9
  In of MODEL   22
    1    H    LYS  69           H        LYS  69 -11.229 -15.963 -13.096
    2    HA   LYS  69           HA       LYS  69  -9.109 -14.978 -11.316
    3    HB2  LYS  69           HB2      LYS  69  -8.538 -16.942 -12.657
    4    HB3  LYS  69           HB3      LYS  69  -8.872 -16.039 -14.136
    5    HG2  LYS  69           HG2      LYS  69  -7.101 -14.440 -13.606
    6    HG3  LYS  69           HG3      LYS  69  -6.811 -15.236 -12.060
    7    HD2  LYS  69           HD2      LYS  69  -6.169 -17.307 -13.257
    8    HD3  LYS  69           HD3      LYS  69  -6.421 -16.483 -14.797
    9    HE2  LYS  69           HE2      LYS  69  -4.489 -15.528 -12.667
   10    HE3  LYS  69           HE3      LYS  69  -4.019 -16.510 -14.053
   11    HZ2  LYS  69           HZ1      LYS  69  -4.226 -13.774 -13.973
   12    HZ1  LYS  69           HZ2      LYS  69  -5.593 -14.278 -14.846
   13    HZ3  LYS  69           HZ3      LYS  69  -4.038 -14.734 -15.359

  No H/Q in entry =          13
  In of MODEL   22
    1    H    VAL  70           H        VAL  70  -7.735 -13.205 -11.853
    2    HA   VAL  70           HA       VAL  70  -8.959 -11.206 -13.672
    3    HB   VAL  70           HB       VAL  70  -8.117  -9.491 -12.095
    4   HG13  VAL  70          HG11      VAL  70 -10.378  -9.972 -11.720
    5   HG12  VAL  70          HG12      VAL  70  -9.674 -10.273 -10.129
    6   HG11  VAL  70          HG13      VAL  70 -10.038 -11.624 -11.203
    7   HG23  VAL  70          HG21      VAL  70  -7.415 -11.886 -10.352
    8   HG22  VAL  70          HG22      VAL  70  -7.308 -10.196  -9.867
    9   HG21  VAL  70          HG23      VAL  70  -6.247 -10.818 -11.129

  No H/Q in entry =           9
  In of MODEL   22
    1    H    SER  71           H        SER  71  -7.395  -9.583 -14.456
    2    HA   SER  71           HA       SER  71  -5.149 -10.754 -15.713
    3    HB2  SER  71           HB2      SER  71  -6.343  -8.725 -16.550
    4    HB3  SER  71           HB3      SER  71  -5.678  -7.816 -15.195
    5    HG   SER  71           HG       SER  71  -4.331  -9.048 -17.358

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU  72           H        LEU  72  -3.119 -11.012 -15.069
    2    HA   LEU  72           HA       LEU  72  -2.410 -10.785 -12.355
    3    HB2  LEU  72           HB2      LEU  72  -0.745 -11.207 -14.832
    4    HB3  LEU  72           HB3      LEU  72  -0.086 -11.268 -13.201
    5    HG   LEU  72           HG       LEU  72  -2.423 -12.983 -14.101
    6   HD11  LEU  72          HD11      LEU  72  -0.324 -13.443 -15.406
    7   HD13  LEU  72          HD12      LEU  72  -0.838 -14.797 -14.401
    8   HD12  LEU  72          HD13      LEU  72   0.496 -13.769 -13.878
    9   HD22  LEU  72          HD21      LEU  72  -2.417 -12.977 -11.747
   10   HD21  LEU  72          HD22      LEU  72  -0.668 -12.859 -11.642
   11   HD23  LEU  72          HD23      LEU  72  -1.421 -14.379 -12.119

  No H/Q in entry =          11
  In of MODEL   22
    1    H    VAL  73           H        VAL  73  -1.701  -8.770 -15.138
    2    HA   VAL  73           HA       VAL  73   0.202  -7.052 -14.032
    3    HB   VAL  73           HB       VAL  73  -0.202  -5.638 -15.893
    4   HG12  VAL  73          HG11      VAL  73  -1.057  -8.324 -16.951
    5   HG11  VAL  73          HG12      VAL  73   0.546  -8.109 -16.248
    6   HG13  VAL  73          HG13      VAL  73   0.066  -7.163 -17.657
    7   HG22  VAL  73          HG21      VAL  73  -2.476  -5.147 -15.940
    8   HG21  VAL  73          HG22      VAL  73  -2.948  -6.834 -15.742
    9   HG23  VAL  73          HG23      VAL  73  -2.355  -6.262 -17.302

  No H/Q in entry =           9
  In of MODEL   22
    1    H    LEU  74           H        LEU  74  -3.196  -7.195 -13.486
    2    HA   LEU  74           HA       LEU  74  -3.838  -4.543 -12.882
    3    HB2  LEU  74           HB2      LEU  74  -5.553  -6.223 -13.059
    4    HB3  LEU  74           HB3      LEU  74  -4.859  -7.137 -11.723
    5    HG   LEU  74           HG       LEU  74  -5.347  -5.270 -10.183
    6   HD13  LEU  74          HD11      LEU  74  -5.229  -3.327 -11.531
    7   HD12  LEU  74          HD12      LEU  74  -6.947  -3.492 -11.172
    8   HD11  LEU  74          HD13      LEU  74  -6.322  -3.998 -12.742
    9   HD22  LEU  74          HD21      LEU  74  -7.544  -5.866  -9.941
   10   HD21  LEU  74          HD22      LEU  74  -7.026  -7.093 -11.078
   11   HD23  LEU  74          HD23      LEU  74  -7.891  -5.691 -11.658

  No H/Q in entry =          11
  In of MODEL   22
    1    H    VAL  75           H        VAL  75  -2.784  -7.115 -10.711
    2    HA   VAL  75           HA       VAL  75  -2.607  -5.557  -8.370
    3    HB   VAL  75           HB       VAL  75  -1.096  -8.046  -9.153
    4   HG11  VAL  75          HG11      VAL  75  -1.301  -6.576  -6.484
    5   HG13  VAL  75          HG12      VAL  75   0.157  -6.805  -7.439
    6   HG12  VAL  75          HG13      VAL  75  -0.624  -8.188  -6.692
    7   HG23  VAL  75          HG21      VAL  75  -3.393  -7.629  -7.215
    8   HG22  VAL  75          HG22      VAL  75  -2.761  -9.163  -7.813
    9   HG21  VAL  75          HG23      VAL  75  -3.639  -8.086  -8.901

  No H/Q in entry =           9
  In of MODEL   22
    1    H    GLU  76           H        GLU  76  -0.183  -6.304 -10.896
    2    HA   GLU  76           HA       GLU  76   1.988  -4.936  -9.734
    3    HB2  GLU  76           HB2      GLU  76   2.205  -6.416 -11.714
    4    HB3  GLU  76           HB3      GLU  76   1.295  -5.262 -12.677
    5    HG2  GLU  76           HG2      GLU  76   3.641  -4.928 -13.152
    6    HG3  GLU  76           HG3      GLU  76   3.102  -3.549 -12.214

  No H/Q in entry =           6
  In of MODEL   22
    1    H    ALA  77           H        ALA  77  -0.546  -3.761 -11.935
    2    HA   ALA  77           HA       ALA  77   0.423  -1.107 -12.114
    3    HB1  ALA  77           HB1      ALA  77  -1.180  -1.811 -13.730
    4    HB2  ALA  77           HB2      ALA  77  -1.993  -0.593 -12.748
    5    HB3  ALA  77           HB3      ALA  77  -2.327  -2.305 -12.485

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLN  78           H        GLN  78  -1.840  -2.676  -9.907
    2    HA   GLN  78           HA       GLN  78  -2.672  -0.361  -8.515
    3    HB2  GLN  78           HB2      GLN  78  -3.763  -2.629  -8.428
    4    HB3  GLN  78           HB3      GLN  78  -2.426  -3.175  -7.420
    5    HG2  GLN  78           HG2      GLN  78  -2.963  -1.440  -5.761
    6    HG3  GLN  78           HG3      GLN  78  -4.299  -0.885  -6.767
    7   HE21  GLN  78          HE21      GLN  78  -4.803  -1.838  -4.129
    8   HE22  GLN  78          HE22      GLN  78  -5.640  -3.311  -4.235

  No H/Q in entry =           8
  In of MODEL   22
    1    H    LEU  79           H        LEU  79   0.024  -2.592  -8.049
    2    HA   LEU  79           HA       LEU  79   0.983  -1.681  -5.590
    3    HB2  LEU  79           HB2      LEU  79   1.875  -3.684  -6.650
    4    HB3  LEU  79           HB3      LEU  79   2.518  -2.730  -7.983
    5    HG   LEU  79           HG       LEU  79   4.058  -1.574  -6.476
    6   HD13  LEU  79          HD11      LEU  79   3.043  -1.332  -4.414
    7   HD12  LEU  79          HD12      LEU  79   4.132  -2.671  -4.062
    8   HD11  LEU  79          HD13      LEU  79   2.431  -2.987  -4.398
    9   HD23  LEU  79          HD21      LEU  79   5.284  -3.708  -5.563
   10   HD22  LEU  79          HD22      LEU  79   5.086  -3.515  -7.302
   11   HD21  LEU  79          HD23      LEU  79   4.014  -4.593  -6.412

  No H/Q in entry =          11
  In of MODEL   22
    1    H    HIS  80           H        HIS  80   1.856  -0.564  -8.862
    2    HA   HIS  80           HA       HIS  80   3.641   1.442  -7.938
    3    HB2  HIS  80           HB2      HIS  80   2.368   0.730 -10.524
    4    HB3  HIS  80           HB3      HIS  80   2.947   2.388 -10.355
    5    HD1  HIS  80           HD1      HIS  80   5.348   2.710 -10.869
    6    HD2  HIS  80           HD2      HIS  80   4.561  -1.206  -9.671
    7    HE1  HIS  80           HE1      HIS  80   7.550   1.453 -11.023
    8    HE2  HIS  80           HE2      HIS  80   7.082  -0.937 -10.297

  No H/Q in entry =           8
  In of MODEL   22
    1    H    LEU  81           H        LEU  81   0.240   1.567  -8.932
    2    HA   LEU  81           HA       LEU  81  -0.064   4.358  -8.609
    3    HB2  LEU  81           HB2      LEU  81  -2.056   2.093  -8.532
    4    HB3  LEU  81           HB3      LEU  81  -2.526   3.792  -8.446
    5    HG   LEU  81           HG       LEU  81  -0.813   2.653 -10.672
    6   HD12  LEU  81          HD11      LEU  81  -3.043   2.948 -11.981
    7   HD11  LEU  81          HD12      LEU  81  -3.804   2.876 -10.392
    8   HD13  LEU  81          HD13      LEU  81  -2.845   1.516 -10.972
    9   HD23  LEU  81          HD21      LEU  81  -1.927   4.784 -11.779
   10   HD22  LEU  81          HD22      LEU  81  -0.516   4.971 -10.741
   11   HD21  LEU  81          HD23      LEU  81  -2.127   5.305 -10.108

  No H/Q in entry =          11
  In of MODEL   22
    1    H    MET  82           H        MET  82  -0.705   1.670  -6.356
    2    HA   MET  82           HA       MET  82  -1.781   3.250  -4.277
    3    HB2  MET  82           HB2      MET  82  -0.380   0.577  -4.304
    4    HB3  MET  82           HB3      MET  82  -0.972   1.300  -2.810
    5    HG2  MET  82           HG2      MET  82  -2.689   0.783  -5.257
    6    HG3  MET  82           HG3      MET  82  -2.606  -0.287  -3.859
    7    HE3  MET  82           HE1      MET  82  -4.357   1.351  -1.055
    8    HE2  MET  82           HE2      MET  82  -2.629   1.647  -1.233
    9    HE1  MET  82           HE3      MET  82  -3.299   0.081  -1.686

  No H/Q in entry =           9
  In of MODEL   22
    1    H    THR  83           H        THR  83   1.533   2.197  -4.951
    2    HA   THR  83           HA       THR  83   2.730   3.320  -2.648
    3    HB   THR  83           HB       THR  83   4.831   3.283  -4.113
    4    HG1  THR  83           HG1      THR  83   4.605   2.749  -6.137
    5   HG22  THR  83          HG21      THR  83   4.417   0.619  -4.441
    6   HG21  THR  83          HG22      THR  83   3.119   0.988  -3.307
    7   HG23  THR  83          HG23      THR  83   4.793   1.350  -2.881

  No H/Q in entry =           7
  In of MODEL   22
    1    H    SER  84           H        SER  84   2.359   4.587  -5.952
    2    HA   SER  84           HA       SER  84   3.671   7.043  -5.498
    3    HB2  SER  84           HB2      SER  84   1.618   6.184  -7.523
    4    HB3  SER  84           HB3      SER  84   2.279   7.818  -7.499
    5    HG   SER  84           HG       SER  84   3.679   5.357  -7.779

  No H/Q in entry =           5
  In of MODEL   22
    1    H    MET  85           H        MET  85   0.185   6.250  -5.338
    2    HA   MET  85           HA       MET  85  -0.706   8.853  -4.746
    3    HB2  MET  85           HB2      MET  85  -2.207   7.026  -5.417
    4    HB3  MET  85           HB3      MET  85  -1.916   6.227  -3.873
    5    HG2  MET  85           HG2      MET  85  -2.844   8.158  -2.673
    6    HG3  MET  85           HG3      MET  85  -3.084   9.006  -4.200
    7    HE2  MET  85           HE1      MET  85  -5.278   5.491  -2.394
    8    HE1  MET  85           HE2      MET  85  -3.616   6.020  -2.142
    9    HE3  MET  85           HE3      MET  85  -4.000   4.966  -3.499

  No H/Q in entry =           9
  In of MODEL   22
    1    H    LEU  86           H        LEU  86   0.232   6.204  -2.593
    2    HA   LEU  86           HA       LEU  86  -0.324   7.507  -0.156
    3    HB2  LEU  86           HB2      LEU  86   0.166   5.040  -0.543
    4    HB3  LEU  86           HB3      LEU  86   1.869   5.486  -0.632
    5    HG   LEU  86           HG       LEU  86   1.524   6.649   1.632
    6   HD11  LEU  86          HD11      LEU  86  -1.161   5.855   1.152
    7   HD13  LEU  86          HD12      LEU  86  -0.507   6.612   2.604
    8   HD12  LEU  86          HD13      LEU  86  -0.581   4.855   2.488
    9   HD23  LEU  86          HD21      LEU  86   1.124   3.653   1.759
   10   HD22  LEU  86          HD22      LEU  86   2.113   4.674   2.801
   11   HD21  LEU  86          HD23      LEU  86   2.623   4.351   1.145

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ALA  87           H        ALA  87   2.667   7.237  -2.033
    2    HA   ALA  87           HA       ALA  87   4.353   8.667  -0.305
    3    HB3  ALA  87           HB1      ALA  87   4.468   7.649  -3.009
    4    HB2  ALA  87           HB2      ALA  87   5.795   7.994  -1.904
    5    HB1  ALA  87           HB3      ALA  87   5.173   9.267  -2.953

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ARG  88           H        ARG  88   2.406   9.780  -3.035
    2    HA   ARG  88           HA       ARG  88   3.156  12.476  -2.920
    3    HB2  ARG  88           HB2      ARG  88   1.919  11.309  -4.780
    4    HB3  ARG  88           HB3      ARG  88   0.457  11.441  -3.803
    5    HG2  ARG  88           HG2      ARG  88   1.454  14.031  -3.721
    6    HG3  ARG  88           HG3      ARG  88   1.888  13.517  -5.349
    7    HD2  ARG  88           HD2      ARG  88  -0.251  13.577  -6.054
    8    HD3  ARG  88           HD3      ARG  88  -0.836  12.722  -4.627
    9    HE   ARG  88           HE       ARG  88  -1.047  15.497  -5.051
   10   HH21  ARG  88          HH11      ARG  88  -1.592  16.826  -3.318
   11   HH22  ARG  88          HH12      ARG  88  -1.298  16.294  -1.698
   12   HH11  ARG  88          HH21      ARG  88  -0.022  13.248  -2.668
   13   HH12  ARG  88          HH22      ARG  88  -0.426  14.262  -1.331

  No H/Q in entry =          13
  In of MODEL   22
    1    H    GLU  89           H        GLU  89   0.460  10.782  -1.287
    2    HA   GLU  89           HA       GLU  89  -0.670  13.087  -0.091
    3    HB2  GLU  89           HB2      GLU  89  -1.770  10.839  -0.177
    4    HB3  GLU  89           HB3      GLU  89  -0.646  10.295   1.069
    5    HG2  GLU  89           HG2      GLU  89  -1.485  11.990   2.622
    6    HG3  GLU  89           HG3      GLU  89  -2.538  12.650   1.373

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LEU  90           H        LEU  90   1.795  10.817   1.097
    2    HA   LEU  90           HA       LEU  90   2.132  12.068   3.625
    3    HB2  LEU  90           HB2      LEU  90   3.925  10.305   1.958
    4    HB3  LEU  90           HB3      LEU  90   4.334  10.828   3.597
    5    HG   LEU  90           HG       LEU  90   1.712   9.461   2.929
    6   HD12  LEU  90          HD11      LEU  90   2.864   7.425   3.945
    7   HD11  LEU  90          HD12      LEU  90   4.381   8.293   3.707
    8   HD13  LEU  90          HD13      LEU  90   3.376   7.875   2.317
    9   HD22  LEU  90          HD21      LEU  90   1.433  10.386   5.048
   10   HD21  LEU  90          HD22      LEU  90   3.150  10.292   5.436
   11   HD23  LEU  90          HD23      LEU  90   2.154   8.838   5.484

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  91           H        ILE  91   3.743  12.458   0.503
    2    HA   ILE  91           HA       ILE  91   5.704  14.305   1.347
    3    HB   ILE  91           HB       ILE  91   4.405  13.800  -1.337
    4   HG12  ILE  91          HG12      ILE  91   7.238  13.335  -0.352
    5   HG13  ILE  91          HG13      ILE  91   5.964  12.128  -0.192
    6   HG22  ILE  91          HG21      ILE  91   6.621  15.162  -2.020
    7   HG21  ILE  91          HG22      ILE  91   6.300  15.963  -0.481
    8   HG23  ILE  91          HG23      ILE  91   5.081  15.980  -1.755
    9   HD13  ILE  91          HD11      ILE  91   5.801  11.800  -2.499
   10   HD12  ILE  91          HD12      ILE  91   7.533  12.055  -2.280
   11   HD11  ILE  91          HD13      ILE  91   6.516  13.370  -2.872

  No H/Q in entry =          11
  In of MODEL   22
    1    H    THR  92           H        THR  92   2.343  14.712   0.326
    2    HA   THR  92           HA       THR  92   2.297  17.535   0.261
    3    HB   THR  92           HB       THR  92   0.141  15.526   0.956
    4    HG1  THR  92           HG1      THR  92   0.454  15.346  -1.128
    5   HG22  THR  92          HG21      THR  92  -1.272  17.677   0.225
    6   HG21  THR  92          HG22      THR  92   0.112  18.513   0.926
    7   HG23  THR  92          HG23      THR  92  -0.825  17.387   1.906

  No H/Q in entry =           7
  In of MODEL   22
    1    H    GLU  93           H        GLU  93   1.755  15.235   2.917
    2    HA   GLU  93           HA       GLU  93   1.203  17.139   4.930
    3    HB2  GLU  93           HB2      GLU  93   2.534  14.423   5.175
    4    HB3  GLU  93           HB3      GLU  93   1.832  15.348   6.504
    5    HG2  GLU  93           HG2      GLU  93   0.233  14.555   4.061
    6    HG3  GLU  93           HG3      GLU  93   0.337  13.535   5.491

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LEU  94           H        LEU  94   4.224  15.675   3.793
    2    HA   LEU  94           HA       LEU  94   5.960  16.837   5.686
    3    HB2  LEU  94           HB2      LEU  94   6.378  15.868   2.858
    4    HB3  LEU  94           HB3      LEU  94   7.699  16.536   3.811
    5    HG   LEU  94           HG       LEU  94   5.971  14.331   4.943
    6   HD11  LEU  94          HD11      LEU  94   8.075  14.115   2.820
    7   HD13  LEU  94          HD12      LEU  94   6.635  13.132   3.078
    8   HD12  LEU  94          HD13      LEU  94   8.058  12.891   4.090
    9   HD23  LEU  94          HD21      LEU  94   8.160  13.811   6.105
   10   HD22  LEU  94          HD22      LEU  94   7.481  15.385   6.516
   11   HD21  LEU  94          HD23      LEU  94   8.824  15.272   5.378

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  95           H        ILE  95   4.824  17.996   2.530
    2    HA   ILE  95           HA       ILE  95   6.380  20.364   2.472
    3    HB   ILE  95           HB       ILE  95   3.745  19.660   1.158
    4   HG12  ILE  95          HG12      ILE  95   6.536  20.014   0.031
    5   HG13  ILE  95          HG13      ILE  95   5.895  18.458   0.546
    6   HG21  ILE  95          HG21      ILE  95   5.479  22.139   0.940
    7   HG23  ILE  95          HG22      ILE  95   3.753  22.060   1.290
    8   HG22  ILE  95          HG23      ILE  95   4.345  21.661  -0.323
    9   HD13  ILE  95          HD11      ILE  95   4.342  18.369  -1.189
   10   HD12  ILE  95          HD12      ILE  95   5.688  19.194  -1.973
   11   HD11  ILE  95          HD13      ILE  95   4.307  20.121  -1.387

  No H/Q in entry =          11
  In of MODEL   22
    1    H    GLU  96           H        GLU  96   3.131  19.693   3.756
    2    HA   GLU  96           HA       GLU  96   2.491  22.337   4.501
    3    HB2  GLU  96           HB2      GLU  96   0.828  20.543   4.510
    4    HB3  GLU  96           HB3      GLU  96   1.690  19.723   5.810
    5    HG2  GLU  96           HG2      GLU  96   0.656  21.002   7.373
    6    HG3  GLU  96           HG3      GLU  96   1.184  22.478   6.576

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LEU  97           H        LEU  97   4.344  19.801   6.137
    2    HA   LEU  97           HA       LEU  97   4.684  21.155   8.607
    3    HB2  LEU  97           HB2      LEU  97   6.240  18.994   7.202
    4    HB3  LEU  97           HB3      LEU  97   6.820  19.685   8.715
    5    HG   LEU  97           HG       LEU  97   4.019  18.573   8.396
    6   HD12  LEU  97          HD11      LEU  97   4.967  16.569   9.615
    7   HD11  LEU  97          HD12      LEU  97   6.576  17.210   9.276
    8   HD13  LEU  97          HD13      LEU  97   5.513  16.743   7.947
    9   HD23  LEU  97          HD21      LEU  97   4.464  18.286  10.962
   10   HD22  LEU  97          HD22      LEU  97   4.076  19.894  10.354
   11   HD21  LEU  97          HD23      LEU  97   5.749  19.466  10.705

  No H/Q in entry =          11
  In of MODEL   22
    1    H    HIS  98           H        HIS  98   6.565  21.178   5.588
    2    HA   HIS  98           HA       HIS  98   8.706  22.772   6.492
    3    HB2  HIS  98           HB2      HIS  98   7.424  22.505   3.762
    4    HB3  HIS  98           HB3      HIS  98   8.857  23.493   4.056
    5    HD1  HIS  98           HD1      HIS  98   7.668  19.915   4.078
    6    HD2  HIS  98           HD2      HIS  98  11.234  22.034   4.512
    7    HE1  HIS  98           HE1      HIS  98   9.533  18.196   4.030
    8    HE2  HIS  98           HE2      HIS  98  11.709  19.466   4.295

  No H/Q in entry =           8
  In of MODEL   22
    1    H    GLU  99           H        GLU  99   5.484  23.586   5.304
    2    HA   GLU  99           HA       GLU  99   5.847  26.403   5.243
    3    HB2  GLU  99           HB2      GLU  99   3.979  25.221   4.107
    4    HB3  GLU  99           HB3      GLU  99   3.279  24.858   5.684
    5    HG2  GLU  99           HG2      GLU  99   3.083  27.250   6.181
    6    HG3  GLU  99           HG3      GLU  99   3.862  27.652   4.654

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LYS 100           H        LYS 100   4.720  24.165   7.764
    2    HA   LYS 100           HA       LYS 100   4.115  26.219   9.653
    3    HB2  LYS 100           HB2      LYS 100   4.706  23.272  10.005
    4    HB3  LYS 100           HB3      LYS 100   4.248  24.344  11.334
    5    HG2  LYS 100           HG2      LYS 100   2.183  24.967  10.078
    6    HG3  LYS 100           HG3      LYS 100   2.621  23.799   8.828
    7    HD2  LYS 100           HD2      LYS 100   2.548  21.981  10.493
    8    HD3  LYS 100           HD3      LYS 100   2.126  23.143  11.753
    9    HE2  LYS 100           HE2      LYS 100   0.075  23.751  10.481
   10    HE3  LYS 100           HE3      LYS 100   0.486  22.531   9.269
   11    HZ1  LYS 100           HZ1      LYS 100   0.213  21.868  12.150
   12    HZ3  LYS 100           HZ2      LYS 100   0.209  20.811  10.817
   13    HZ2  LYS 100           HZ3      LYS 100  -1.114  21.844  11.090

  No H/Q in entry =          13
  In of MODEL   22
    1    H    LEU 101           H        LEU 101   7.052  24.439   8.832
    2    HA   LEU 101           HA       LEU 101   8.637  25.291  11.040
    3    HB2  LEU 101           HB2      LEU 101   9.247  24.303   8.266
    4    HB3  LEU 101           HB3      LEU 101  10.542  24.977   9.251
    5    HG   LEU 101           HG       LEU 101   8.718  22.813  10.311
    6   HD12  LEU 101          HD11      LEU 101  10.783  21.328   9.713
    7   HD11  LEU 101          HD12      LEU 101  11.147  22.591   8.540
    8   HD13  LEU 101          HD13      LEU 101   9.623  21.710   8.442
    9   HD21  LEU 101          HD21      LEU 101  11.434  23.937  11.047
   10   HD23  LEU 101          HD22      LEU 101  10.897  22.362  11.628
   11   HD22  LEU 101          HD23      LEU 101   9.995  23.814  12.060

  No H/Q in entry =          11
  In of MODEL   22
    1    H    LYS 102           H        LYS 102   7.052  27.143   8.891
    2    HA   LYS 102           HA       LYS 102   7.118  29.435   8.595
    3    HB2  LYS 102           HB2      LYS 102   8.676  29.332  10.700
    4    HB3  LYS 102           HB3      LYS 102   9.978  29.531   9.545
    5    HG2  LYS 102           HG2      LYS 102   7.859  31.475  10.396
    6    HG3  LYS 102           HG3      LYS 102   9.571  31.743  10.150
    7    HD2  LYS 102           HD2      LYS 102   7.631  31.306   7.844
    8    HD3  LYS 102           HD3      LYS 102   8.003  32.889   8.511
    9    HE2  LYS 102           HE2      LYS 102   9.390  31.708   6.444
   10    HE3  LYS 102           HE3      LYS 102   9.996  33.020   7.456
   11    HZ2  LYS 102           HZ1      LYS 102  11.527  31.123   7.289
   12    HZ1  LYS 102           HZ2      LYS 102  10.367  30.135   8.029
   13    HZ3  LYS 102           HZ3      LYS 102  11.050  31.427   8.888

  No H/Q in entry =          13
  In of MODEL   22
    1    H    ALA 103           H        ALA 103  10.384  28.112   8.045
    2    HA   ALA 103           HA       ALA 103  11.348  29.491   5.970
    3    HB2  ALA 103           HB1      ALA 103  12.248  27.280   5.049
    4    HB1  ALA 103           HB2      ALA 103  11.353  26.503   6.353
    5    HB3  ALA 103           HB3      ALA 103  12.635  27.654   6.729

  No H/Q in entry =           5
  In of MODEL   22
    1    H1   LYS   3           H1       LYS   3 -31.281   6.261 -19.636
    2    H2   LYS   3           H3       LYS   3 -30.295   5.975 -20.988
    3    H3   LYS   3           H2       LYS   3 -31.685   5.035 -20.737
    4    HA   LYS   3           HA       LYS   3 -30.673   3.650 -19.335
    5    HB2  LYS   3           HB2      LYS   3 -28.401   5.070 -20.673
    6    HB3  LYS   3           HB3      LYS   3 -28.068   3.864 -19.431
    7    HG2  LYS   3           HG2      LYS   3 -29.488   2.272 -20.777
    8    HG3  LYS   3           HG3      LYS   3 -29.450   3.472 -22.069
    9    HD2  LYS   3           HD2      LYS   3 -26.967   3.367 -22.024
   10    HD3  LYS   3           HD3      LYS   3 -27.078   2.069 -20.836
   11    HE2  LYS   3           HE2      LYS   3 -28.577   0.887 -22.548
   12    HE3  LYS   3           HE3      LYS   3 -27.964   2.067 -23.706
   13    HZ3  LYS   3           HZ1      LYS   3 -26.161   0.844 -23.980
   14    HZ2  LYS   3           HZ2      LYS   3 -26.785  -0.325 -22.918
   15    HZ1  LYS   3           HZ3      LYS   3 -25.798   0.922 -22.323

  No H/Q in entry =          15
  In of MODEL   22
    1    H    LYS   4           H        LYS   4 -30.721   3.509 -17.273
    2    HA   LYS   4           HA       LYS   4 -29.994   5.798 -15.626
    3    HB2  LYS   4           HB2      LYS   4 -31.185   3.102 -14.922
    4    HB3  LYS   4           HB3      LYS   4 -30.965   4.441 -13.797
    5    HG2  LYS   4           HG2      LYS   4 -32.779   4.374 -16.214
    6    HG3  LYS   4           HG3      LYS   4 -33.265   4.423 -14.520
    7    HD2  LYS   4           HD2      LYS   4 -32.575   6.647 -14.257
    8    HD3  LYS   4           HD3      LYS   4 -31.538   6.592 -15.682
    9    HE2  LYS   4           HE2      LYS   4 -33.468   7.960 -16.141
   10    HE3  LYS   4           HE3      LYS   4 -33.547   6.487 -17.108
   11    HZ3  LYS   4           HZ1      LYS   4 -35.116   5.572 -15.556
   12    HZ2  LYS   4           HZ2      LYS   4 -35.677   7.066 -16.140
   13    HZ1  LYS   4           HZ3      LYS   4 -35.016   6.956 -14.579

  No H/Q in entry =          13
  In of MODEL   22
    1    H    HIS   5           H        HIS   5 -28.520   5.888 -14.038
    2    HA   HIS   5           HA       HIS   5 -26.236   4.063 -14.375
    3    HB2  HIS   5           HB2      HIS   5 -26.492   6.818 -13.169
    4    HB3  HIS   5           HB3      HIS   5 -25.009   5.865 -13.156
    5    HD1  HIS   5           HD1      HIS   5 -23.545   7.067 -14.750
    6    HD2  HIS   5           HD2      HIS   5 -27.349   6.439 -16.294
    7    HE1  HIS   5           HE1      HIS   5 -23.385   7.646 -17.201
    8    HE2  HIS   5           HE2      HIS   5 -25.704   7.252 -18.110

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ILE   6           H        ILE   6 -26.001   2.491 -13.058
    2    HA   ILE   6           HA       ILE   6 -26.969   2.759 -10.292
    3    HB   ILE   6           HB       ILE   6 -26.146   0.292 -11.830
    4   HG12  ILE   6          HG12      ILE   6 -28.888   1.226 -10.973
    5   HG13  ILE   6          HG13      ILE   6 -28.251   1.388 -12.608
    6   HG23  ILE   6          HG21      ILE   6 -26.513  -0.960  -9.968
    7   HG22  ILE   6          HG22      ILE   6 -27.670   0.186  -9.286
    8   HG21  ILE   6          HG23      ILE   6 -25.941   0.523  -9.202
    9   HD13  ILE   6          HD11      ILE   6 -28.709  -0.732 -13.106
   10   HD12  ILE   6          HD12      ILE   6 -29.721  -0.715 -11.662
   11   HD11  ILE   6          HD13      ILE   6 -28.066  -1.321 -11.573

  No H/Q in entry =          11
  In of MODEL   22
    1    H    TYR   7           H        TYR   7 -25.207   3.401  -9.010
    2    HA   TYR   7           HA       TYR   7 -22.497   2.446  -9.696
    3    HB2  TYR   7           HB2      TYR   7 -23.458   4.880  -8.214
    4    HB3  TYR   7           HB3      TYR   7 -21.774   4.366  -8.256
    5    HD1  TYR   7           HD1      TYR   7 -22.821   3.422 -11.343
    6    HD2  TYR   7           HD2      TYR   7 -22.147   6.995  -9.121
    7    HE1  TYR   7           HE1      TYR   7 -22.396   4.650 -13.436
    8    HE2  TYR   7           HE2      TYR   7 -21.764   8.229 -11.205
    9    HH   TYR   7           HH       TYR   7 -21.987   8.141 -13.437

  No H/Q in entry =           9
  In of MODEL   22
    1    H    LEU   8           H        LEU   8 -21.528   1.095  -8.369
    2    HA   LEU   8           HA       LEU   8 -22.651   0.601  -5.682
    3    HB2  LEU   8           HB2      LEU   8 -20.953  -1.062  -7.520
    4    HB3  LEU   8           HB3      LEU   8 -21.134  -1.443  -5.808
    5    HG   LEU   8           HG       LEU   8 -23.614  -1.617  -6.224
    6   HD13  LEU   8          HD11      LEU   8 -23.751  -0.403  -8.334
    7   HD12  LEU   8          HD12      LEU   8 -24.282  -2.066  -8.571
    8   HD11  LEU   8          HD13      LEU   8 -22.675  -1.568  -9.101
    9   HD23  LEU   8          HD21      LEU   8 -22.345  -3.659  -7.919
   10   HD22  LEU   8          HD22      LEU   8 -23.428  -3.825  -6.539
   11   HD21  LEU   8          HD23      LEU   8 -21.721  -3.472  -6.281

  No H/Q in entry =          11
  In of MODEL   22
    1    H    PHE   9           H        PHE   9 -21.378   1.016  -3.899
    2    HA   PHE   9           HA       PHE   9 -18.594   1.946  -4.421
    3    HB2  PHE   9           HB2      PHE   9 -20.601   3.026  -2.447
    4    HB3  PHE   9           HB3      PHE   9 -18.896   3.455  -2.457
    5    HD1  PHE   9           HD1      PHE   9 -17.942   4.808  -4.233
    6    HD2  PHE   9           HD2      PHE   9 -22.105   3.769  -4.249
    7    HE1  PHE   9           HE1      PHE   9 -18.354   6.486  -6.007
    8    HE2  PHE   9           HE2      PHE   9 -22.519   5.460  -6.018
    9    HZ   PHE   9           HZ       PHE   9 -20.641   6.813  -6.903

  No H/Q in entry =           9
  In of MODEL   22
    1    H    SER  10           H        SER  10 -16.995   1.030  -3.285
    2    HA   SER  10           HA       SER  10 -17.186   0.147  -0.598
    3    HB2  SER  10           HB2      SER  10 -17.041  -2.236  -0.884
    4    HB3  SER  10           HB3      SER  10 -18.459  -1.678  -1.756
    5    HG   SER  10           HG       SER  10 -15.965  -1.857  -3.033

  No H/Q in entry =           5
  In of MODEL   22
    1    H    SER  11           H        SER  11 -15.167   0.239   0.205
    2    HA   SER  11           HA       SER  11 -12.982   1.028  -1.377
    3    HB2  SER  11           HB2      SER  11 -13.113  -0.046   1.434
    4    HB3  SER  11           HB3      SER  11 -11.641   0.585   0.694
    5    HG   SER  11           HG       SER  11 -12.432   2.555   0.794

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA  12           H        ALA  12 -14.223  -1.676  -2.065
    2    HA   ALA  12           HA       ALA  12 -11.664  -2.988  -2.551
    3    HB2  ALA  12           HB1      ALA  12 -12.317  -5.139  -1.697
    4    HB1  ALA  12           HB2      ALA  12 -13.932  -4.552  -1.304
    5    HB3  ALA  12           HB3      ALA  12 -12.537  -3.956  -0.405

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLY  13           H        GLY  13 -12.511  -1.950  -4.592
    2    HA3  GLY  13           HA2      GLY  13 -14.737  -2.799  -6.030
    3    HA2  GLY  13           HA3      GLY  13 -13.237  -2.217  -6.768

  No H/Q in entry =           3
  In of MODEL   22
    1    H    MET  14           H        MET  14 -11.692  -4.488  -5.582
    2    HA   MET  14           HA       MET  14 -11.706  -6.206  -7.768
    3    HB2  MET  14           HB2      MET  14  -9.845  -6.205  -6.167
    4    HB3  MET  14           HB3      MET  14 -10.862  -6.980  -4.953
    5    HG2  MET  14           HG2      MET  14  -9.460  -8.654  -6.066
    6    HG3  MET  14           HG3      MET  14 -11.147  -8.925  -6.507
    7    HE1  MET  14           HE1      MET  14  -7.728  -7.551  -7.429
    8    HE3  MET  14           HE2      MET  14  -7.609  -8.058  -9.112
    9    HE2  MET  14           HE3      MET  14  -7.875  -9.262  -7.854

  No H/Q in entry =           9
  In of MODEL   22
    1    H    SER  15           H        SER  15 -13.388  -6.766  -4.684
    2    HA   SER  15           HA       SER  15 -14.586  -9.206  -5.772
    3    HB2  SER  15           HB2      SER  15 -14.716  -7.913  -3.063
    4    HB3  SER  15           HB3      SER  15 -15.938  -9.088  -3.542
    5    HG   SER  15           HG       SER  15 -13.294  -9.762  -4.087

  No H/Q in entry =           5
  In of MODEL   22
    1    H    THR  16           H        THR  16 -15.591  -5.864  -5.071
    2    HA   THR  16           HA       THR  16 -18.409  -6.243  -5.540
    3    HB   THR  16           HB       THR  16 -16.804  -3.728  -6.093
    4    HG1  THR  16           HG1      THR  16 -16.301  -3.760  -4.079
    5   HG23  THR  16          HG21      THR  16 -18.852  -2.598  -5.594
    6   HG22  THR  16          HG22      THR  16 -19.596  -4.080  -4.969
    7   HG21  THR  16          HG23      THR  16 -19.264  -3.904  -6.699

  No H/Q in entry =           7
  In of MODEL   22
    1    H    SER  17           H        SER  17 -15.609  -5.653  -7.424
    2    HA   SER  17           HA       SER  17 -16.742  -4.915  -9.925
    3    HB2  SER  17           HB2      SER  17 -14.111  -6.237  -9.230
    4    HB3  SER  17           HB3      SER  17 -14.555  -5.792 -10.877
    5    HG   SER  17           HG       SER  17 -14.983  -3.742  -9.189

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU  18           H        LEU  18 -16.167  -8.058  -8.475
    2    HA   LEU  18           HA       LEU  18 -16.755  -9.561 -10.828
    3    HB2  LEU  18           HB2      LEU  18 -15.533 -10.548  -8.960
    4    HB3  LEU  18           HB3      LEU  18 -16.922 -10.303  -7.902
    5    HG   LEU  18           HG       LEU  18 -18.236 -11.816  -9.409
    6   HD11  LEU  18          HD11      LEU  18 -15.547 -11.954 -10.725
    7   HD13  LEU  18          HD12      LEU  18 -17.147 -11.856 -11.460
    8   HD12  LEU  18          HD13      LEU  18 -16.596 -13.370 -10.744
    9   HD22  LEU  18          HD21      LEU  18 -17.342 -12.599  -7.324
   10   HD21  LEU  18          HD22      LEU  18 -15.785 -12.934  -8.084
   11   HD23  LEU  18          HD23      LEU  18 -17.209 -13.862  -8.549

  No H/Q in entry =          11
  In of MODEL   22
    1    H    LEU  19           H        LEU  19 -18.722  -8.354  -8.115
    2    HA   LEU  19           HA       LEU  19 -21.184  -9.541  -8.943
    3    HB2  LEU  19           HB2      LEU  19 -20.892  -8.695  -6.689
    4    HB3  LEU  19           HB3      LEU  19 -20.649  -7.063  -7.310
    5    HG   LEU  19           HG       LEU  19 -22.965  -6.884  -7.921
    6   HD13  LEU  19          HD11      LEU  19 -23.623  -9.002  -8.675
    7   HD12  LEU  19          HD12      LEU  19 -24.490  -8.825  -7.151
    8   HD11  LEU  19          HD13      LEU  19 -23.026  -9.804  -7.223
    9   HD22  LEU  19          HD21      LEU  19 -22.650  -6.205  -5.732
   10   HD21  LEU  19          HD22      LEU  19 -22.332  -7.844  -5.162
   11   HD23  LEU  19          HD23      LEU  19 -23.973  -7.363  -5.594

  No H/Q in entry =          11
  In of MODEL   22
    1    H    VAL  20           H        VAL  20 -19.694  -6.379  -9.642
    2    HA   VAL  20           HA       VAL  20 -21.809  -5.341 -11.209
    3    HB   VAL  20           HB       VAL  20 -18.821  -4.748 -11.366
    4   HG11  VAL  20          HG11      VAL  20 -21.163  -3.412 -12.741
    5   HG13  VAL  20          HG12      VAL  20 -19.731  -4.115 -13.494
    6   HG12  VAL  20          HG13      VAL  20 -19.591  -2.638 -12.541
    7   HG21  VAL  20          HG21      VAL  20 -21.130  -3.493  -9.934
    8   HG23  VAL  20          HG22      VAL  20 -19.677  -2.572 -10.315
    9   HG22  VAL  20          HG23      VAL  20 -19.569  -4.006  -9.293

  No H/Q in entry =           9
  In of MODEL   22
    1    H    SER  21           H        SER  21 -19.051  -7.389 -12.239
    2    HA   SER  21           HA       SER  21 -19.839  -7.281 -14.989
    3    HB2  SER  21           HB2      SER  21 -18.402  -9.250 -15.321
    4    HB3  SER  21           HB3      SER  21 -17.572  -7.997 -14.399
    5    HG   SER  21           HG       SER  21 -17.800  -9.161 -12.583

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LYS  22           H        LYS  22 -20.897  -9.465 -12.413
    2    HA   LYS  22           HA       LYS  22 -22.437 -11.088 -14.232
    3    HB2  LYS  22           HB2      LYS  22 -22.697 -10.734 -11.243
    4    HB3  LYS  22           HB3      LYS  22 -23.547 -11.945 -12.201
    5    HG2  LYS  22           HG2      LYS  22 -20.547 -11.792 -11.979
    6    HG3  LYS  22           HG3      LYS  22 -21.560 -12.793 -10.941
    7    HD2  LYS  22           HD2      LYS  22 -22.387 -13.993 -12.922
    8    HD3  LYS  22           HD3      LYS  22 -21.342 -13.004 -13.945
    9    HE2  LYS  22           HE2      LYS  22 -19.363 -13.910 -12.821
   10    HE3  LYS  22           HE3      LYS  22 -20.392 -14.874 -11.761
   11    HZ2  LYS  22           HZ1      LYS  22 -20.015 -15.187 -14.681
   12    HZ1  LYS  22           HZ2      LYS  22 -21.222 -15.995 -13.800
   13    HZ3  LYS  22           HZ3      LYS  22 -19.583 -16.279 -13.455

  No H/Q in entry =          13
  In of MODEL   22
    1    H    MET  23           H        MET  23 -23.159  -8.166 -12.365
    2    HA   MET  23           HA       MET  23 -25.968  -8.246 -12.867
    3    HB2  MET  23           HB2      MET  23 -24.121  -5.936 -12.298
    4    HB3  MET  23           HB3      MET  23 -25.867  -5.768 -12.473
    5    HG2  MET  23           HG2      MET  23 -26.254  -7.070 -10.503
    6    HG3  MET  23           HG3      MET  23 -24.544  -7.481 -10.379
    7    HE2  MET  23           HE1      MET  23 -26.841  -3.829  -9.189
    8    HE1  MET  23           HE2      MET  23 -27.097  -4.798 -10.639
    9    HE3  MET  23           HE3      MET  23 -26.062  -3.371 -10.705

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ARG  24           H        ARG  24 -23.216  -6.818 -14.655
    2    HA   ARG  24           HA       ARG  24 -24.717  -5.519 -16.653
    3    HB2  ARG  24           HB2      ARG  24 -22.274  -5.121 -16.274
    4    HB3  ARG  24           HB3      ARG  24 -21.938  -6.717 -16.899
    5    HG2  ARG  24           HG2      ARG  24 -22.802  -6.058 -19.139
    6    HG3  ARG  24           HG3      ARG  24 -23.165  -4.435 -18.495
    7    HD2  ARG  24           HD2      ARG  24 -20.415  -5.768 -18.501
    8    HD3  ARG  24           HD3      ARG  24 -20.954  -4.537 -19.636
    9    HE   ARG  24           HE       ARG  24 -21.282  -3.170 -17.450
   10   HH21  ARG  24          HH11      ARG  24 -19.765  -1.512 -17.501
   11   HH22  ARG  24          HH12      ARG  24 -18.079  -1.895 -17.522
   12   HH11  ARG  24          HH21      ARG  24 -18.750  -5.326 -18.079
   13   HH12  ARG  24          HH22      ARG  24 -17.489  -4.154 -17.854

  No H/Q in entry =          13
  In of MODEL   22
    1    H    ALA  25           H        ALA  25 -23.597  -8.858 -16.377
    2    HA   ALA  25           HA       ALA  25 -24.230  -9.689 -19.014
    3    HB1  ALA  25           HB1      ALA  25 -23.535 -11.722 -18.319
    4    HB3  ALA  25           HB2      ALA  25 -24.591 -11.699 -16.906
    5    HB2  ALA  25           HB3      ALA  25 -23.034 -10.875 -16.856

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLN  26           H        GLN  26 -26.052  -9.725 -15.988
    2    HA   GLN  26           HA       GLN  26 -28.400 -10.924 -17.002
    3    HB2  GLN  26           HB2      GLN  26 -27.882  -9.178 -14.615
    4    HB3  GLN  26           HB3      GLN  26 -29.446  -9.899 -14.963
    5    HG2  GLN  26           HG2      GLN  26 -26.862 -11.360 -14.498
    6    HG3  GLN  26           HG3      GLN  26 -28.220 -11.255 -13.386
    7   HE21  GLN  26          HE21      GLN  26 -27.007 -13.421 -14.664
    8   HE22  GLN  26          HE22      GLN  26 -28.053 -14.466 -15.460

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ALA  27           H        ALA  27 -27.459  -7.529 -16.610
    2    HA   ALA  27           HA       ALA  27 -29.948  -6.431 -17.391
    3    HB1  ALA  27           HB1      ALA  27 -28.135  -5.120 -16.277
    4    HB3  ALA  27           HB2      ALA  27 -28.725  -4.352 -17.752
    5    HB2  ALA  27           HB3      ALA  27 -27.192  -5.222 -17.765

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLU  28           H        GLU  28 -27.251  -7.658 -19.264
    2    HA   GLU  28           HA       GLU  28 -28.188  -6.615 -21.782
    3    HB2  GLU  28           HB2      GLU  28 -25.810  -7.302 -21.160
    4    HB3  GLU  28           HB3      GLU  28 -26.357  -8.965 -21.363
    5    HG2  GLU  28           HG2      GLU  28 -25.212  -8.190 -23.333
    6    HG3  GLU  28           HG3      GLU  28 -26.911  -8.510 -23.679

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LYS  29           H        LYS  29 -28.357  -9.722 -20.126
    2    HA   LYS  29           HA       LYS  29 -29.665 -11.189 -22.131
    3    HB2  LYS  29           HB2      LYS  29 -28.615 -12.175 -20.129
    4    HB3  LYS  29           HB3      LYS  29 -29.885 -11.467 -19.132
    5    HG2  LYS  29           HG2      LYS  29 -31.548 -12.835 -20.199
    6    HG3  LYS  29           HG3      LYS  29 -30.352 -13.472 -21.326
    7    HD2  LYS  29           HD2      LYS  29 -29.210 -14.642 -19.595
    8    HD3  LYS  29           HD3      LYS  29 -30.113 -13.801 -18.338
    9    HE2  LYS  29           HE2      LYS  29 -30.871 -16.148 -18.701
   10    HE3  LYS  29           HE3      LYS  29 -32.147 -14.953 -18.942
   11    HZ1  LYS  29           HZ1      LYS  29 -31.585 -15.085 -21.370
   12    HZ3  LYS  29           HZ2      LYS  29 -32.306 -16.472 -20.705
   13    HZ2  LYS  29           HZ3      LYS  29 -30.636 -16.445 -21.005

  No H/Q in entry =          13
  In of MODEL   22
    1    H    TYR  30           H        TYR  30 -31.051  -9.083 -19.623
    2    HA   TYR  30           HA       TYR  30 -33.715  -9.527 -20.862
    3    HB2  TYR  30           HB2      TYR  30 -33.058  -8.377 -18.141
    4    HB3  TYR  30           HB3      TYR  30 -34.676  -8.631 -18.792
    5    HD1  TYR  30           HD1      TYR  30 -35.590 -10.921 -19.007
    6    HD2  TYR  30           HD2      TYR  30 -31.753 -10.208 -17.307
    7    HE1  TYR  30           HE1      TYR  30 -35.504 -13.250 -18.213
    8    HE2  TYR  30           HE2      TYR  30 -31.666 -12.522 -16.516
    9    HH   TYR  30           HH       TYR  30 -33.312 -14.879 -17.611

  No H/Q in entry =           9
  In of MODEL   22
    1    H    GLU  31           H        GLU  31 -31.548  -7.537 -21.663
    2    HA   GLU  31           HA       GLU  31 -31.472  -5.379 -22.483
    3    HB2  GLU  31           HB2      GLU  31 -34.369  -6.090 -22.993
    4    HB3  GLU  31           HB3      GLU  31 -33.527  -4.723 -23.722
    5    HG2  GLU  31           HG2      GLU  31 -32.057  -6.162 -24.917
    6    HG3  GLU  31           HG3      GLU  31 -32.623  -7.576 -24.029

  No H/Q in entry =           6
  In of MODEL   22
    1    H    VAL  32           H        VAL  32 -31.668  -5.281 -19.751
    2    HA   VAL  32           HA       VAL  32 -33.527  -3.167 -19.086
    3    HB   VAL  32           HB       VAL  32 -31.134  -4.165 -17.510
    4   HG12  VAL  32          HG11      VAL  32 -32.666  -3.341 -15.611
    5   HG11  VAL  32          HG12      VAL  32 -33.501  -2.436 -16.874
    6   HG13  VAL  32          HG13      VAL  32 -31.792  -2.133 -16.556
    7   HG21  VAL  32          HG21      VAL  32 -32.904  -5.883 -18.198
    8   HG23  VAL  32          HG22      VAL  32 -33.942  -5.056 -17.035
    9   HG22  VAL  32          HG23      VAL  32 -32.425  -5.781 -16.504

  No H/Q in entry =           9
  In of MODEL   22
    1    HA   PRO  33           HA       PRO  33 -30.495  -0.239 -20.760
    2    HB2  PRO  33           HB2      PRO  33 -32.006   1.985 -20.632
    3    HB3  PRO  33           HB3      PRO  33 -32.476   0.685 -21.727
    4    HG2  PRO  33           HG2      PRO  33 -33.442   1.198 -18.912
    5    HG3  PRO  33           HG3      PRO  33 -34.407   0.991 -20.373
    6    HD2  PRO  33           HD2      PRO  33 -33.950  -1.084 -18.711
    7    HD3  PRO  33           HD3      PRO  33 -34.014  -1.323 -20.457

  No H/Q in entry =           7
  In of MODEL   22
    1    H    VAL  34           H        VAL  34 -29.229  -0.785 -18.814
    2    HA   VAL  34           HA       VAL  34 -28.943   1.638 -17.163
    3    HB   VAL  34           HB       VAL  34 -28.360   0.173 -15.228
    4   HG12  VAL  34          HG11      VAL  34 -30.772  -0.700 -14.919
    5   HG11  VAL  34          HG12      VAL  34 -31.090   0.062 -16.476
    6   HG13  VAL  34          HG13      VAL  34 -30.536   1.037 -15.115
    7   HG21  VAL  34          HG21      VAL  34 -28.547  -1.850 -17.239
    8   HG23  VAL  34          HG22      VAL  34 -29.603  -2.213 -15.873
    9   HG22  VAL  34          HG23      VAL  34 -27.884  -1.926 -15.606

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ILE  35           H        ILE  35 -26.967   2.072 -16.325
    2    HA   ILE  35           HA       ILE  35 -24.663   0.746 -17.593
    3    HB   ILE  35           HB       ILE  35 -25.063   3.634 -16.777
    4   HG12  ILE  35          HG12      ILE  35 -24.083   2.332 -19.325
    5   HG13  ILE  35          HG13      ILE  35 -25.713   2.951 -19.062
    6   HG21  ILE  35          HG21      ILE  35 -22.501   2.103 -17.092
    7   HG23  ILE  35          HG22      ILE  35 -22.954   3.281 -15.861
    8   HG22  ILE  35          HG23      ILE  35 -22.574   3.818 -17.497
    9   HD11  ILE  35          HD11      ILE  35 -24.312   5.146 -18.460
   10   HD13  ILE  35          HD12      ILE  35 -24.852   4.765 -20.096
   11   HD12  ILE  35          HD13      ILE  35 -23.199   4.395 -19.602

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ILE  36           H        ILE  36 -23.429  -0.279 -15.996
    2    HA   ILE  36           HA       ILE  36 -23.867   0.331 -13.124
    3    HB   ILE  36           HB       ILE  36 -23.039  -2.370 -14.239
    4   HG12  ILE  36          HG12      ILE  36 -25.846  -1.567 -13.469
    5   HG13  ILE  36          HG13      ILE  36 -25.276  -1.543 -15.138
    6   HG23  ILE  36          HG21      ILE  36 -23.386  -3.202 -12.125
    7   HG22  ILE  36          HG22      ILE  36 -24.513  -1.920 -11.683
    8   HG21  ILE  36          HG23      ILE  36 -22.784  -1.586 -11.755
    9   HD13  ILE  36          HD11      ILE  36 -25.441  -3.757 -15.348
   10   HD12  ILE  36          HD12      ILE  36 -26.504  -3.638 -13.947
   11   HD11  ILE  36          HD13      ILE  36 -24.805  -4.057 -13.730

  No H/Q in entry =          11
  In of MODEL   22
    1    H    GLU  37           H        GLU  37 -22.084   0.960 -12.022
    2    HA   GLU  37           HA       GLU  37 -19.395   0.167 -12.943
    3    HB2  GLU  37           HB2      GLU  37 -20.285   2.956 -12.226
    4    HB3  GLU  37           HB3      GLU  37 -18.600   2.460 -12.384
    5    HG2  GLU  37           HG2      GLU  37 -18.936   2.012 -14.740
    6    HG3  GLU  37           HG3      GLU  37 -20.636   2.455 -14.594

  No H/Q in entry =           6
  In of MODEL   22
    1    H    ALA  38           H        ALA  38 -17.905  -0.072 -11.263
    2    HA   ALA  38           HA       ALA  38 -18.932   0.101  -8.490
    3    HB1  ALA  38           HB1      ALA  38 -17.218  -1.833  -9.921
    4    HB3  ALA  38           HB2      ALA  38 -18.266  -2.072  -8.523
    5    HB2  ALA  38           HB3      ALA  38 -16.654  -1.388  -8.311

  No H/Q in entry =           5
  In of MODEL   22
    1    H    PHE  39           H        PHE  39 -17.692   1.311  -7.017
    2    HA   PHE  39           HA       PHE  39 -15.170   2.519  -7.915
    3    HB2  PHE  39           HB2      PHE  39 -17.585   4.001  -6.892
    4    HB3  PHE  39           HB3      PHE  39 -15.958   4.673  -6.806
    5    HD1  PHE  39           HD1      PHE  39 -14.643   4.691  -9.063
    6    HD2  PHE  39           HD2      PHE  39 -18.888   4.457  -8.719
    7    HE1  PHE  39           HE1      PHE  39 -14.867   5.568 -11.371
    8    HE2  PHE  39           HE2      PHE  39 -19.126   5.324 -11.019
    9    HZ   PHE  39           HZ       PHE  39 -17.121   5.853 -12.363

  No H/Q in entry =           9
  In of MODEL   22
    1    HA   PRO  40           HA       PRO  40 -14.223   1.761  -3.632
    2    HB2  PRO  40           HB2      PRO  40 -12.461   3.781  -3.024
    3    HB3  PRO  40           HB3      PRO  40 -12.015   2.451  -4.094
    4    HG2  PRO  40           HG2      PRO  40 -13.048   5.183  -4.837
    5    HG3  PRO  40           HG3      PRO  40 -11.621   4.347  -5.446
    6    HD2  PRO  40           HD2      PRO  40 -13.844   4.256  -6.850
    7    HD3  PRO  40           HD3      PRO  40 -12.886   2.789  -6.664

  No H/Q in entry =           7
  In of MODEL   22
    1    H    GLU  41           H        GLU  41 -14.845   2.734  -1.499
    2    HA   GLU  41           HA       GLU  41 -17.095   4.430  -1.476
    3    HB2  GLU  41           HB2      GLU  41 -17.038   4.250   0.855
    4    HB3  GLU  41           HB3      GLU  41 -16.314   2.742   0.295
    5    HG2  GLU  41           HG2      GLU  41 -14.893   3.302   2.002
    6    HG3  GLU  41           HG3      GLU  41 -14.066   4.027   0.623

  No H/Q in entry =           6
  In of MODEL   22
    1    H    THR  42           H        THR  42 -13.767   5.359  -1.532
    2    HA   THR  42           HA       THR  42 -14.126   7.916  -0.316
    3    HB   THR  42           HB       THR  42 -11.973   8.499  -1.404
    4    HG1  THR  42           HG1      THR  42 -11.331   7.397  -3.075
    5   HG23  THR  42          HG21      THR  42 -10.648   7.015  -0.144
    6   HG22  THR  42          HG22      THR  42 -11.766   5.672  -0.388
    7   HG21  THR  42          HG23      THR  42 -12.202   6.997   0.691

  No H/Q in entry =           7
  In of MODEL   22
    1    H    LEU  43           H        LEU  43 -15.031   6.822  -3.416
    2    HA   LEU  43           HA       LEU  43 -15.296   9.596  -4.383
    3    HB2  LEU  43           HB2      LEU  43 -15.646   6.947  -5.776
    4    HB3  LEU  43           HB3      LEU  43 -15.875   8.524  -6.531
    5    HG   LEU  43           HG       LEU  43 -13.249   7.451  -5.528
    6   HD13  LEU  43          HD11      LEU  43 -12.713   6.880  -7.709
    7   HD12  LEU  43          HD12      LEU  43 -13.964   7.915  -8.395
    8   HD11  LEU  43          HD13      LEU  43 -14.407   6.399  -7.614
    9   HD23  LEU  43          HD21      LEU  43 -12.488   9.408  -7.060
   10   HD22  LEU  43          HD22      LEU  43 -13.075   9.773  -5.436
   11   HD21  LEU  43          HD23      LEU  43 -14.130  10.010  -6.828

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ALA  44           H        ALA  44 -17.232   7.761  -2.529
    2    HA   ALA  44           HA       ALA  44 -19.711   7.613  -3.847
    3    HB2  ALA  44           HB1      ALA  44 -19.566   6.494  -1.753
    4    HB3  ALA  44           HB2      ALA  44 -20.678   7.835  -1.477
    5    HB1  ALA  44           HB3      ALA  44 -19.006   7.949  -0.926

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLY  45           H        GLY  45 -18.300  10.416  -2.313
    2    HA3  GLY  45           HA2      GLY  45 -20.743  11.908  -2.669
    3    HA2  GLY  45           HA3      GLY  45 -19.200  12.538  -2.093

  No H/Q in entry =           3
  In of MODEL   22
    1    H    GLU  46           H        GLU  46 -17.668  11.609  -4.387
    2    HA   GLU  46           HA       GLU  46 -18.316  13.825  -6.152
    3    HB2  GLU  46           HB2      GLU  46 -16.123  11.746  -6.235
    4    HB3  GLU  46           HB3      GLU  46 -16.248  13.125  -7.327
    5    HG2  GLU  46           HG2      GLU  46 -15.898  13.301  -4.342
    6    HG3  GLU  46           HG3      GLU  46 -14.604  13.462  -5.529

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LYS  47           H        LYS  47 -18.185  10.307  -6.592
    2    HA   LYS  47           HA       LYS  47 -19.288  10.526  -9.266
    3    HB2  LYS  47           HB2      LYS  47 -18.110   8.428  -7.589
    4    HB3  LYS  47           HB3      LYS  47 -19.481   7.880  -8.556
    5    HG2  LYS  47           HG2      LYS  47 -17.435   7.478  -9.745
    6    HG3  LYS  47           HG3      LYS  47 -18.360   8.732 -10.569
    7    HD2  LYS  47           HD2      LYS  47 -16.991  10.446  -9.445
    8    HD3  LYS  47           HD3      LYS  47 -16.038   9.167  -8.696
    9    HE2  LYS  47           HE2      LYS  47 -16.334   9.594 -11.662
   10    HE3  LYS  47           HE3      LYS  47 -14.955  10.111 -10.694
   11    HZ3  LYS  47           HZ1      LYS  47 -14.166   8.125 -11.303
   12    HZ2  LYS  47           HZ2      LYS  47 -15.703   7.463 -11.594
   13    HZ1  LYS  47           HZ3      LYS  47 -15.106   7.559 -10.006

  No H/Q in entry =          13
  In of MODEL   22
    1    H    GLY  48           H        GLY  48 -20.604   9.761  -6.116
    2    HA3  GLY  48           HA2      GLY  48 -22.985   8.567  -6.855
    3    HA2  GLY  48           HA3      GLY  48 -22.761   9.560  -5.415

  No H/Q in entry =           3
  In of MODEL   22
    1    H    GLN  49           H        GLN  49 -22.190  11.987  -6.984
    2    HA   GLN  49           HA       GLN  49 -24.753  13.090  -7.124
    3    HB2  GLN  49           HB2      GLN  49 -22.214  13.965  -8.487
    4    HB3  GLN  49           HB3      GLN  49 -23.680  14.924  -8.399
    5    HG2  GLN  49           HG2      GLN  49 -23.517  14.946  -5.963
    6    HG3  GLN  49           HG3      GLN  49 -22.064  13.965  -6.049
    7   HE21  GLN  49          HE21      GLN  49 -21.953  16.193  -4.774
    8   HE22  GLN  49          HE22      GLN  49 -21.036  17.452  -5.421

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ASN  50           H        ASN  50 -23.071  11.219  -9.515
    2    HA   ASN  50           HA       ASN  50 -24.960  12.086 -11.593
    3    HB2  ASN  50           HB2      ASN  50 -22.376  10.555 -11.832
    4    HB3  ASN  50           HB3      ASN  50 -23.429  10.979 -13.174
    5   HD21  ASN  50          HD21      ASN  50 -20.793  11.832 -11.566
    6   HD22  ASN  50          HD22      ASN  50 -20.565  13.468 -11.907

  No H/Q in entry =           6
  In of MODEL   22
    1    H    ALA  51           H        ALA  51 -24.935   9.728  -9.350
    2    HA   ALA  51           HA       ALA  51 -25.714   7.582 -11.178
    3    HB2  ALA  51           HB1      ALA  51 -25.125   6.233  -9.494
    4    HB3  ALA  51           HB2      ALA  51 -26.248   7.037  -8.398
    5    HB1  ALA  51           HB3      ALA  51 -24.611   7.663  -8.597

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ASP  52           H        ASP  52 -27.716   6.520 -11.035
    2    HA   ASP  52           HA       ASP  52 -29.903   8.347 -10.365
    3    HB2  ASP  52           HB2      ASP  52 -29.707   5.844 -12.038
    4    HB3  ASP  52           HB3      ASP  52 -31.253   6.572 -11.600

  No H/Q in entry =           4
  In of MODEL   22
    1    H    VAL  53           H        VAL  53 -28.292   5.461  -9.354
    2    HA   VAL  53           HA       VAL  53 -29.729   5.582  -6.836
    3    HB   VAL  53           HB       VAL  53 -31.125   3.937  -8.079
    4   HG11  VAL  53          HG11      VAL  53 -29.379   3.084  -9.605
    5   HG13  VAL  53          HG12      VAL  53 -30.207   1.786  -8.746
    6   HG12  VAL  53          HG13      VAL  53 -28.598   2.292  -8.238
    7   HG23  VAL  53          HG21      VAL  53 -30.296   1.961  -6.391
    8   HG22  VAL  53          HG22      VAL  53 -31.427   3.262  -6.020
    9   HG21  VAL  53          HG23      VAL  53 -29.720   3.438  -5.616

  No H/Q in entry =           9
  In of MODEL   22
    1    H    VAL  54           H        VAL  54 -28.412   5.150  -5.183
    2    HA   VAL  54           HA       VAL  54 -25.651   4.308  -5.800
    3    HB   VAL  54           HB       VAL  54 -26.721   6.081  -3.547
    4   HG11  VAL  54          HG11      VAL  54 -24.140   4.666  -3.843
    5   HG13  VAL  54          HG12      VAL  54 -24.893   5.344  -2.400
    6   HG12  VAL  54          HG13      VAL  54 -23.991   6.390  -3.495
    7   HG22  VAL  54          HG21      VAL  54 -25.867   7.898  -4.645
    8   HG21  VAL  54          HG22      VAL  54 -26.415   6.908  -5.998
    9   HG23  VAL  54          HG23      VAL  54 -24.708   6.936  -5.562

  No H/Q in entry =           9
  In of MODEL   22
    1    H    LEU  55           H        LEU  55 -25.055   2.386  -5.160
    2    HA   LEU  55           HA       LEU  55 -26.557   1.070  -2.984
    3    HB2  LEU  55           HB2      LEU  55 -25.001  -0.093  -5.283
    4    HB3  LEU  55           HB3      LEU  55 -25.758  -1.029  -3.994
    5    HG   LEU  55           HG       LEU  55 -27.202   0.558  -6.107
    6   HD13  LEU  55          HD11      LEU  55 -26.901  -1.293  -7.329
    7   HD12  LEU  55          HD12      LEU  55 -27.854  -2.171  -6.134
    8   HD11  LEU  55          HD13      LEU  55 -26.099  -2.104  -5.986
    9   HD23  LEU  55          HD21      LEU  55 -28.490  -1.392  -4.252
   10   HD22  LEU  55          HD22      LEU  55 -29.188  -0.011  -5.097
   11   HD21  LEU  55          HD23      LEU  55 -28.167   0.245  -3.683

  No H/Q in entry =          11
  In of MODEL   22
    1    H    LEU  56           H        LEU  56 -25.401   0.476  -1.181
    2    HA   LEU  56           HA       LEU  56 -22.467   0.876  -1.235
    3    HB2  LEU  56           HB2      LEU  56 -24.266   0.660   1.166
    4    HB3  LEU  56           HB3      LEU  56 -22.557   1.092   1.153
    5    HG   LEU  56           HG       LEU  56 -24.861   2.767   0.194
    6   HD11  LEU  56          HD11      LEU  56 -23.741   2.385   2.712
    7   HD13  LEU  56          HD12      LEU  56 -24.734   3.754   2.209
    8   HD12  LEU  56          HD13      LEU  56 -22.977   3.861   2.119
    9   HD23  LEU  56          HD21      LEU  56 -22.918   4.470   0.000
   10   HD22  LEU  56          HD22      LEU  56 -23.302   3.373  -1.329
   11   HD21  LEU  56          HD23      LEU  56 -21.946   3.021  -0.257

  No H/Q in entry =          11
  In of MODEL   22
    1    H    GLY  57           H        GLY  57 -21.085  -0.754  -0.706
    2    HA3  GLY  57           HA2      GLY  57 -22.000  -3.440  -0.905
    3    HA2  GLY  57           HA3      GLY  57 -20.380  -2.943  -0.421

  No H/Q in entry =           3
  In of MODEL   22
    1    HA   PRO  58           HA       PRO  58 -23.182  -3.990   3.288
    2    HB2  PRO  58           HB2      PRO  58 -22.494  -6.594   3.890
    3    HB3  PRO  58           HB3      PRO  58 -23.881  -6.187   2.879
    4    HG2  PRO  58           HG2      PRO  58 -21.153  -7.063   2.088
    5    HG3  PRO  58           HG3      PRO  58 -22.717  -7.525   1.419
    6    HD2  PRO  58           HD2      PRO  58 -21.113  -5.705   0.195
    7    HD3  PRO  58           HD3      PRO  58 -22.872  -5.621   0.096

  No H/Q in entry =           7
  In of MODEL   22
    1    H    GLN  59           H        GLN  59 -19.812  -4.457   2.674
    2    HA   GLN  59           HA       GLN  59 -19.053  -4.477   5.434
    3    HB2  GLN  59           HB2      GLN  59 -17.470  -3.621   3.007
    4    HB3  GLN  59           HB3      GLN  59 -16.811  -3.834   4.615
    5    HG2  GLN  59           HG2      GLN  59 -18.053  -5.994   2.920
    6    HG3  GLN  59           HG3      GLN  59 -16.332  -5.737   3.154
    7   HE21  GLN  59          HE21      GLN  59 -18.557  -7.530   3.975
    8   HE22  GLN  59          HE22      GLN  59 -18.362  -8.248   5.463

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ILE  60           H        ILE  60 -19.993  -1.925   3.230
    2    HA   ILE  60           HA       ILE  60 -19.139   0.031   5.275
    3    HB   ILE  60           HB       ILE  60 -19.380   1.762   3.449
    4   HG12  ILE  60          HG12      ILE  60 -19.178  -0.468   1.469
    5   HG13  ILE  60          HG13      ILE  60 -20.765   0.075   2.015
    6   HG21  ILE  60          HG21      ILE  60 -17.249   0.535   4.193
    7   HG23  ILE  60          HG22      ILE  60 -17.223   1.504   2.721
    8   HG22  ILE  60          HG23      ILE  60 -17.354  -0.251   2.618
    9   HD12  ILE  60          HD11      ILE  60 -18.725   1.527   0.374
   10   HD11  ILE  60          HD12      ILE  60 -19.844   2.452   1.375
   11   HD13  ILE  60          HD13      ILE  60 -20.463   1.377   0.121

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ALA  61           H        ALA  61 -21.593  -1.557   5.347
    2    HA   ALA  61           HA       ALA  61 -23.821   0.106   4.893
    3    HB1  ALA  61           HB1      ALA  61 -25.033  -1.386   6.220
    4    HB2  ALA  61           HB2      ALA  61 -23.633  -1.775   7.220
    5    HB3  ALA  61           HB3      ALA  61 -23.730  -2.380   5.567

  No H/Q in entry =           5
  In of MODEL   22
    1    H    TYR  62           H        TYR  62 -21.609  -0.007   7.687
    2    HA   TYR  62           HA       TYR  62 -23.163   1.648   9.362
    3    HB2  TYR  62           HB2      TYR  62 -21.108   2.087  10.581
    4    HB3  TYR  62           HB3      TYR  62 -21.190   0.381  10.144
    5    HD1  TYR  62           HD1      TYR  62 -19.684  -0.530   8.381
    6    HD2  TYR  62           HD2      TYR  62 -19.330   3.508   9.732
    7    HE1  TYR  62           HE1      TYR  62 -17.476  -0.365   7.297
    8    HE2  TYR  62           HE2      TYR  62 -17.108   3.667   8.649
    9    HH   TYR  62           HH       TYR  62 -15.801   2.660   7.065

  No H/Q in entry =           9
  In of MODEL   22
    1    H    MET  63           H        MET  63 -21.526   2.510   6.504
    2    HA   MET  63           HA       MET  63 -21.358   5.342   7.200
    3    HB2  MET  63           HB2      MET  63 -20.759   3.825   4.660
    4    HB3  MET  63           HB3      MET  63 -20.559   5.568   4.849
    5    HG2  MET  63           HG2      MET  63 -18.842   5.215   6.513
    6    HG3  MET  63           HG3      MET  63 -19.067   3.471   6.400
    7    HE3  MET  63           HE1      MET  63 -18.528   6.130   3.015
    8    HE2  MET  63           HE2      MET  63 -17.002   6.391   3.861
    9    HE1  MET  63           HE3      MET  63 -18.531   6.616   4.713

  No H/Q in entry =           9
  In of MODEL   22
    1    H    LEU  64           H        LEU  64 -23.924   3.487   6.238
    2    HA   LEU  64           HA       LEU  64 -25.138   4.908   4.164
    3    HB2  LEU  64           HB2      LEU  64 -26.004   2.801   5.081
    4    HB3  LEU  64           HB3      LEU  64 -26.459   3.642   6.562
    5    HG   LEU  64           HG       LEU  64 -28.156   4.897   5.339
    6   HD13  LEU  64          HD11      LEU  64 -27.877   5.140   3.105
    7   HD12  LEU  64          HD12      LEU  64 -28.523   3.505   2.960
    8   HD11  LEU  64          HD13      LEU  64 -26.780   3.764   3.016
    9   HD23  LEU  64          HD21      LEU  64 -28.676   2.085   4.589
   10   HD22  LEU  64          HD22      LEU  64 -29.662   3.218   5.512
   11   HD21  LEU  64          HD23      LEU  64 -28.286   2.425   6.276

  No H/Q in entry =          11
  In of MODEL   22
    1    HA   PRO  65           HA       PRO  65 -27.312   8.060   6.922
    2    HB2  PRO  65           HB2      PRO  65 -25.307   8.215   9.172
    3    HB3  PRO  65           HB3      PRO  65 -27.046   8.497   9.222
    4    HG2  PRO  65           HG2      PRO  65 -26.115   6.241  10.145
    5    HG3  PRO  65           HG3      PRO  65 -27.537   6.210   9.102
    6    HD2  PRO  65           HD2      PRO  65 -24.666   5.594   8.392
    7    HD3  PRO  65           HD3      PRO  65 -26.126   4.710   7.947

  No H/Q in entry =           7
  In of MODEL   22
    1    H    GLU  66           H        GLU  66 -23.756   8.001   6.988
    2    HA   GLU  66           HA       GLU  66 -23.457  10.800   6.584
    3    HB2  GLU  66           HB2      GLU  66 -21.647   8.492   5.927
    4    HB3  GLU  66           HB3      GLU  66 -21.196  10.183   5.720
    5    HG2  GLU  66           HG2      GLU  66 -21.402  10.553   8.088
    6    HG3  GLU  66           HG3      GLU  66 -21.929   8.885   8.320

  No H/Q in entry =           6
  In of MODEL   22
    1    H    ILE  67           H        ILE  67 -23.566   8.056   4.330
    2    HA   ILE  67           HA       ILE  67 -23.153   9.766   2.037
    3    HB   ILE  67           HB       ILE  67 -24.055   6.860   2.216
    4   HG12  ILE  67          HG12      ILE  67 -21.425   8.027   1.289
    5   HG13  ILE  67          HG13      ILE  67 -21.718   7.606   2.977
    6   HG21  ILE  67          HG21      ILE  67 -23.999   8.740  -0.008
    7   HG23  ILE  67          HG22      ILE  67 -24.628   7.093   0.043
    8   HG22  ILE  67          HG23      ILE  67 -22.919   7.375  -0.288
    9   HD12  ILE  67          HD11      ILE  67 -21.305   5.835   0.624
   10   HD11  ILE  67          HD12      ILE  67 -22.317   5.264   1.948
   11   HD13  ILE  67          HD13      ILE  67 -20.643   5.725   2.255

  No H/Q in entry =          11
  In of MODEL   22
    1    H    GLN  68           H        GLN  68 -26.021   8.717   3.676
    2    HA   GLN  68           HA       GLN  68 -27.852   9.653   1.707
    3    HB2  GLN  68           HB2      GLN  68 -28.103   9.294   4.690
    4    HB3  GLN  68           HB3      GLN  68 -29.423   9.892   3.700
    5    HG2  GLN  68           HG2      GLN  68 -29.459   7.863   2.422
    6    HG3  GLN  68           HG3      GLN  68 -28.009   7.283   3.221
    7   HE21  GLN  68          HE21      GLN  68 -30.191   5.930   3.089
    8   HE22  GLN  68          HE22      GLN  68 -31.019   5.475   4.506

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ARG  69           H        ARG  69 -26.236  11.313   4.441
    2    HA   ARG  69           HA       ARG  69 -27.594  13.799   4.041
    3    HB2  ARG  69           HB2      ARG  69 -25.248  12.861   5.623
    4    HB3  ARG  69           HB3      ARG  69 -25.322  14.580   5.267
    5    HG2  ARG  69           HG2      ARG  69 -27.636  14.631   6.244
    6    HG3  ARG  69           HG3      ARG  69 -27.433  12.939   6.715
    7    HD2  ARG  69           HD2      ARG  69 -25.729  15.287   7.628
    8    HD3  ARG  69           HD3      ARG  69 -26.860  14.385   8.624
    9    HE   ARG  69           HE       ARG  69 -24.253  13.445   7.667
   10   HH21  ARG  69          HH11      ARG  69 -23.448  11.677   8.860
   11   HH22  ARG  69          HH12      ARG  69 -24.477  10.864   9.990
   12   HH11  ARG  69          HH21      ARG  69 -27.209  12.906   9.371
   13   HH12  ARG  69          HH22      ARG  69 -26.606  11.558  10.278

  No H/Q in entry =          13
  In of MODEL   22
    1    H    LEU  70           H        LEU  70 -24.731  12.384   2.673
    2    HA   LEU  70           HA       LEU  70 -23.611  14.746   1.505
    3    HB2  LEU  70           HB2      LEU  70 -22.625  12.423   2.095
    4    HB3  LEU  70           HB3      LEU  70 -23.246  11.962   0.510
    5    HG   LEU  70           HG       LEU  70 -21.649  13.329  -0.578
    6   HD11  LEU  70          HD11      LEU  70 -20.817  14.166   2.209
    7   HD13  LEU  70          HD12      LEU  70 -21.511  15.204   0.964
    8   HD12  LEU  70          HD13      LEU  70 -19.902  14.516   0.740
    9   HD22  LEU  70          HD21      LEU  70 -20.222  11.606  -0.350
   10   HD21  LEU  70          HD22      LEU  70 -21.147  11.086   1.058
   11   HD23  LEU  70          HD23      LEU  70 -19.757  12.152   1.260

  No H/Q in entry =          11
  In of MODEL   22
    1    H    LEU  71           H        LEU  71 -25.779  12.213   0.392
    2    HA   LEU  71           HA       LEU  71 -26.302  13.706  -2.122
    3    HB2  LEU  71           HB2      LEU  71 -26.522  10.722  -1.678
    4    HB3  LEU  71           HB3      LEU  71 -26.650  11.585  -3.210
    5    HG   LEU  71           HG       LEU  71 -24.126  11.583  -1.555
    6   HD12  LEU  71          HD11      LEU  71 -24.193   9.958  -3.989
    7   HD11  LEU  71          HD12      LEU  71 -25.204   9.339  -2.684
    8   HD13  LEU  71          HD13      LEU  71 -23.482   9.608  -2.413
    9   HD22  LEU  71          HD21      LEU  71 -24.223  13.402  -3.047
   10   HD21  LEU  71          HD22      LEU  71 -24.730  12.363  -4.379
   11   HD23  LEU  71          HD23      LEU  71 -23.107  12.207  -3.705

  No H/Q in entry =          11
  In of MODEL   22
    1    HA   PRO  72           HA       PRO  72 -30.165  13.276   0.510
    2    HB2  PRO  72           HB2      PRO  72 -31.007  15.842   0.433
    3    HB3  PRO  72           HB3      PRO  72 -29.698  15.381   1.521
    4    HG2  PRO  72           HG2      PRO  72 -29.511  16.578  -1.232
    5    HG3  PRO  72           HG3      PRO  72 -28.737  17.123   0.255
    6    HD2  PRO  72           HD2      PRO  72 -27.415  15.558  -1.516
    7    HD3  PRO  72           HD3      PRO  72 -27.156  15.387   0.219

  No H/Q in entry =           7
  In of MODEL   22
    1    H    ASN  73           H        ASN  73 -29.543  14.231  -2.706
    2    HA   ASN  73           HA       ASN  73 -32.407  13.943  -3.330
    3    HB2  ASN  73           HB2      ASN  73 -31.939  15.048  -5.428
    4    HB3  ASN  73           HB3      ASN  73 -31.407  16.022  -4.067
    5   HD21  ASN  73          HD21      ASN  73 -30.617  16.065  -6.746
    6   HD22  ASN  73          HD22      ASN  73 -28.951  15.892  -6.944

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LYS  74           H        LYS  74 -30.442  11.672  -2.914
    2    HA   LYS  74           HA       LYS  74 -31.027  10.284  -5.461
    3    HB2  LYS  74           HB2      LYS  74 -28.492   9.971  -3.848
    4    HB3  LYS  74           HB3      LYS  74 -28.885   9.163  -5.365
    5    HG2  LYS  74           HG2      LYS  74 -28.597  12.131  -5.160
    6    HG3  LYS  74           HG3      LYS  74 -27.233  11.058  -5.470
    7    HD2  LYS  74           HD2      LYS  74 -28.362  10.141  -7.411
    8    HD3  LYS  74           HD3      LYS  74 -29.772  11.150  -7.086
    9    HE2  LYS  74           HE2      LYS  74 -28.532  13.146  -7.529
   10    HE3  LYS  74           HE3      LYS  74 -27.018  12.244  -7.626
   11    HZ2  LYS  74           HZ1      LYS  74 -28.490  12.861  -9.747
   12    HZ1  LYS  74           HZ2      LYS  74 -29.156  11.344  -9.374
   13    HZ3  LYS  74           HZ3      LYS  74 -27.491  11.490  -9.675

  No H/Q in entry =          13
  In of MODEL   22
    1    HA   PRO  75           HA       PRO  75 -32.438   7.308  -2.489
    2    HB2  PRO  75           HB2      PRO  75 -32.770   5.094  -4.073
    3    HB3  PRO  75           HB3      PRO  75 -33.884   6.458  -4.138
    4    HG2  PRO  75           HG2      PRO  75 -31.557   5.843  -5.916
    5    HG3  PRO  75           HG3      PRO  75 -33.203   6.295  -6.358
    6    HD2  PRO  75           HD2      PRO  75 -31.245   8.143  -6.318
    7    HD3  PRO  75           HD3      PRO  75 -32.873   8.555  -5.776

  No H/Q in entry =           7
  In of MODEL   22
    1    H    VAL  76           H        VAL  76 -30.990   6.239  -1.121
    2    HA   VAL  76           HA       VAL  76 -28.538   5.010  -2.236
    3    HB   VAL  76           HB       VAL  76 -28.807   6.477   0.423
    4   HG11  VAL  76          HG11      VAL  76 -26.465   5.170  -0.975
    5   HG13  VAL  76          HG12      VAL  76 -27.161   4.724   0.584
    6   HG12  VAL  76          HG13      VAL  76 -26.304   6.254   0.408
    7   HG22  VAL  76          HG21      VAL  76 -28.125   8.372  -0.463
    8   HG21  VAL  76          HG22      VAL  76 -28.677   7.682  -1.991
    9   HG23  VAL  76          HG23      VAL  76 -26.975   7.579  -1.540

  No H/Q in entry =           9
  In of MODEL   22
    1    H    GLU  77           H        GLU  77 -28.338   2.853  -1.625
    2    HA   GLU  77           HA       GLU  77 -29.125   2.071   1.031
    3    HB2  GLU  77           HB2      GLU  77 -30.748   0.438   0.503
    4    HB3  GLU  77           HB3      GLU  77 -31.286   1.966  -0.197
    5    HG2  GLU  77           HG2      GLU  77 -30.689   1.204  -2.387
    6    HG3  GLU  77           HG3      GLU  77 -30.058  -0.299  -1.717

  No H/Q in entry =           6
  In of MODEL   22
    1    H    VAL  78           H        VAL  78 -28.814  -0.020   1.688
    2    HA   VAL  78           HA       VAL  78 -26.157  -0.813   0.793
    3    HB   VAL  78           HB       VAL  78 -27.867  -1.684   3.161
    4   HG11  VAL  78          HG11      VAL  78 -25.540  -2.932   2.030
    5   HG13  VAL  78          HG12      VAL  78 -26.449  -3.396   3.471
    6   HG12  VAL  78          HG13      VAL  78 -25.119  -2.245   3.599
    7   HG22  VAL  78          HG21      VAL  78 -26.393  -0.335   4.497
    8   HG21  VAL  78          HG22      VAL  78 -27.124   0.642   3.224
    9   HG23  VAL  78          HG23      VAL  78 -25.452   0.101   3.071

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ILE  79           H        ILE  79 -25.638  -2.725  -0.114
    2    HA   ILE  79           HA       ILE  79 -27.713  -4.185  -1.458
    3    HB   ILE  79           HB       ILE  79 -24.727  -4.736  -1.245
    4   HG12  ILE  79          HG12      ILE  79 -26.360  -3.618  -3.528
    5   HG13  ILE  79          HG13      ILE  79 -25.475  -2.616  -2.377
    6   HG22  ILE  79          HG21      ILE  79 -25.844  -5.905  -3.562
    7   HG21  ILE  79          HG22      ILE  79 -26.830  -6.419  -2.192
    8   HG23  ILE  79          HG23      ILE  79 -25.091  -6.712  -2.186
    9   HD13  ILE  79          HD11      ILE  79 -24.066  -2.740  -4.199
   10   HD12  ILE  79          HD12      ILE  79 -24.420  -4.445  -4.480
   11   HD11  ILE  79          HD13      ILE  79 -23.429  -3.965  -3.101

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ASP  80           H        ASP  80 -28.592  -6.101  -0.875
    2    HA   ASP  80           HA       ASP  80 -28.541  -7.003   1.772
    3    HB2  ASP  80           HB2      ASP  80 -30.303  -7.564   0.136
    4    HB3  ASP  80           HB3      ASP  80 -29.155  -8.580  -0.736

  No H/Q in entry =           4
  In of MODEL   22
    1    H    SER  81           H        SER  81 -27.012  -8.151   2.898
    2    HA   SER  81           HA       SER  81 -24.524  -8.853   1.700
    3    HB2  SER  81           HB2      SER  81 -23.975  -9.885   3.868
    4    HB3  SER  81           HB3      SER  81 -24.666  -8.278   4.084
    5    HG   SER  81           HG       SER  81 -26.724  -9.576   4.254

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU  82           H        LEU  82 -27.251 -10.922   2.027
    2    HA   LEU  82           HA       LEU  82 -25.724 -13.303   1.503
    3    HB2  LEU  82           HB2      LEU  82 -28.656 -12.662   1.256
    4    HB3  LEU  82           HB3      LEU  82 -27.967 -14.270   1.040
    5    HG   LEU  82           HG       LEU  82 -27.869 -12.700   3.597
    6   HD12  LEU  82          HD11      LEU  82 -29.490 -14.626   4.248
    7   HD11  LEU  82          HD12      LEU  82 -29.768 -14.760   2.510
    8   HD13  LEU  82          HD13      LEU  82 -30.133 -13.252   3.348
    9   HD23  LEU  82          HD21      LEU  82 -27.323 -15.107   4.376
   10   HD22  LEU  82          HD22      LEU  82 -26.058 -14.185   3.563
   11   HD21  LEU  82          HD23      LEU  82 -26.964 -15.411   2.675

  No H/Q in entry =          11
  In of MODEL   22
    1    H    LEU  83           H        LEU  83 -27.668 -11.061  -0.411
    2    HA   LEU  83           HA       LEU  83 -27.484 -12.420  -2.883
    3    HB2  LEU  83           HB2      LEU  83 -27.868  -9.510  -2.234
    4    HB3  LEU  83           HB3      LEU  83 -27.909 -10.154  -3.874
    5    HG   LEU  83           HG       LEU  83 -29.942 -10.524  -1.693
    6   HD13  LEU  83          HD11      LEU  83 -30.684  -8.670  -2.756
    7   HD12  LEU  83          HD12      LEU  83 -31.159  -9.779  -4.040
    8   HD11  LEU  83          HD13      LEU  83 -29.619  -8.926  -4.135
    9   HD23  LEU  83          HD21      LEU  83 -30.097 -11.781  -4.418
   10   HD22  LEU  83          HD22      LEU  83 -31.066 -12.123  -2.986
   11   HD21  LEU  83          HD23      LEU  83 -29.383 -12.640  -3.055

  No H/Q in entry =          11
  In of MODEL   22
    1    H    TYR  84           H        TYR  84 -25.507 -10.051  -1.211
    2    HA   TYR  84           HA       TYR  84 -23.646  -9.579  -3.346
    3    HB2  TYR  84           HB2      TYR  84 -24.161  -8.110  -1.291
    4    HB3  TYR  84           HB3      TYR  84 -23.096  -9.202  -0.410
    5    HD1  TYR  84           HD1      TYR  84 -20.761  -8.924  -0.476
    6    HD2  TYR  84           HD2      TYR  84 -23.205  -6.859  -3.305
    7    HE1  TYR  84           HE1      TYR  84 -18.782  -7.657  -1.242
    8    HE2  TYR  84           HE2      TYR  84 -21.234  -5.593  -4.088
    9    HH   TYR  84           HH       TYR  84 -17.996  -6.262  -2.748

  No H/Q in entry =           9
  In of MODEL   22
    1    H    GLY  85           H        GLY  85 -23.416 -11.584  -0.399
    2    HA3  GLY  85           HA2      GLY  85 -20.847 -12.549  -0.889
    3    HA2  GLY  85           HA3      GLY  85 -22.083 -13.385   0.052

  No H/Q in entry =           3
  In of MODEL   22
    1    H    LYS  86           H        LYS  86 -23.938 -13.742  -2.004
    2    HA   LYS  86           HA       LYS  86 -22.907 -16.126  -3.266
    3    HB2  LYS  86           HB2      LYS  86 -25.545 -14.668  -3.436
    4    HB3  LYS  86           HB3      LYS  86 -25.231 -16.276  -4.086
    5    HG2  LYS  86           HG2      LYS  86 -25.022 -15.625  -1.177
    6    HG3  LYS  86           HG3      LYS  86 -26.507 -16.183  -1.947
    7    HD2  LYS  86           HD2      LYS  86 -25.260 -18.141  -2.834
    8    HD3  LYS  86           HD3      LYS  86 -23.839 -17.603  -1.942
    9    HE2  LYS  86           HE2      LYS  86 -26.496 -18.269  -0.682
   10    HE3  LYS  86           HE3      LYS  86 -25.124 -19.372  -0.771
   11    HZ3  LYS  86           HZ1      LYS  86 -23.855 -18.043   0.626
   12    HZ2  LYS  86           HZ2      LYS  86 -25.400 -17.960   1.328
   13    HZ1  LYS  86           HZ3      LYS  86 -24.827 -16.670   0.384

  No H/Q in entry =          13
  In of MODEL   22
    1    H    VAL  87           H        VAL  87 -22.871 -12.911  -4.161
    2    HA   VAL  87           HA       VAL  87 -22.566 -11.740  -6.102
    3    HB   VAL  87           HB       VAL  87 -21.513 -14.279  -7.393
    4   HG13  VAL  87          HG11      VAL  87 -20.255 -12.830  -8.735
    5   HG12  VAL  87          HG12      VAL  87 -20.336 -11.516  -7.560
    6   HG11  VAL  87          HG13      VAL  87 -21.754 -11.926  -8.523
    7   HG23  VAL  87          HG21      VAL  87 -19.272 -13.581  -6.418
    8   HG22  VAL  87          HG22      VAL  87 -20.405 -14.376  -5.328
    9   HG21  VAL  87          HG23      VAL  87 -20.197 -12.626  -5.259

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ASP  88           H        ASP  88 -25.087 -12.361  -5.745
    2    HA   ASP  88           HA       ASP  88 -26.224 -13.569  -8.138
    3    HB2  ASP  88           HB2      ASP  88 -27.215 -13.805  -5.811
    4    HB3  ASP  88           HB3      ASP  88 -27.655 -12.101  -5.910

  No H/Q in entry =           4
  In of MODEL   22
    1    H    GLY  89           H        GLY  89 -25.514 -12.318  -9.782
    2    HA3  GLY  89           HA2      GLY  89 -25.675  -9.544  -9.983
    3    HA2  GLY  89           HA3      GLY  89 -25.662 -10.665 -11.344

  No H/Q in entry =           3
  In of MODEL   22
    1    H    LEU  90           H        LEU  90 -28.118 -11.997 -10.887
    2    HA   LEU  90           HA       LEU  90 -29.918 -10.049 -11.996
    3    HB2  LEU  90           HB2      LEU  90 -30.003 -12.444 -12.576
    4    HB3  LEU  90           HB3      LEU  90 -30.506 -12.807 -10.926
    5    HG   LEU  90           HG       LEU  90 -32.618 -11.673 -11.283
    6   HD13  LEU  90          HD11      LEU  90 -32.429  -9.933 -12.759
    7   HD12  LEU  90          HD12      LEU  90 -32.981 -11.167 -13.894
    8   HD11  LEU  90          HD13      LEU  90 -31.264 -10.786 -13.775
    9   HD23  LEU  90          HD21      LEU  90 -32.567 -13.304 -13.717
   10   HD22  LEU  90          HD22      LEU  90 -33.544 -13.461 -12.257
   11   HD21  LEU  90          HD23      LEU  90 -31.895 -14.086 -12.287

  No H/Q in entry =          11
  In of MODEL   22
    1    H    GLY  91           H        GLY  91 -29.751 -11.550  -8.813
    2    HA3  GLY  91           HA2      GLY  91 -32.079 -10.419  -7.766
    3    HA2  GLY  91           HA3      GLY  91 -30.688 -10.962  -6.828

  No H/Q in entry =           3
  In of MODEL   22
    1    H    VAL  92           H        VAL  92 -28.758  -9.151  -7.690
    2    HA   VAL  92           HA       VAL  92 -29.528  -6.843  -6.141
    3    HB   VAL  92           HB       VAL  92 -26.990  -7.333  -7.744
    4   HG12  VAL  92          HG11      VAL  92 -27.133  -5.445  -5.417
    5   HG11  VAL  92          HG12      VAL  92 -27.799  -4.897  -6.958
    6   HG13  VAL  92          HG13      VAL  92 -26.106  -5.377  -6.850
    7   HG22  VAL  92          HG21      VAL  92 -26.774  -8.920  -6.151
    8   HG21  VAL  92          HG22      VAL  92 -27.910  -8.131  -5.055
    9   HG23  VAL  92          HG23      VAL  92 -26.252  -7.543  -5.181

  No H/Q in entry =           9
  In of MODEL   22
    1    H    LEU  93           H        LEU  93 -29.136  -7.509  -9.562
    2    HA   LEU  93           HA       LEU  93 -29.465  -4.872 -10.492
    3    HB2  LEU  93           HB2      LEU  93 -28.842  -6.731 -11.954
    4    HB3  LEU  93           HB3      LEU  93 -30.438  -7.448 -11.726
    5    HG   LEU  93           HG       LEU  93 -31.437  -5.477 -12.848
    6   HD11  LEU  93          HD11      LEU  93 -29.574  -3.895 -12.351
    7   HD13  LEU  93          HD12      LEU  93 -30.019  -3.923 -14.057
    8   HD12  LEU  93          HD13      LEU  93 -28.571  -4.768 -13.511
    9   HD23  LEU  93          HD21      LEU  93 -30.411  -6.053 -15.139
   10   HD22  LEU  93          HD22      LEU  93 -31.259  -7.304 -14.229
   11   HD21  LEU  93          HD23      LEU  93 -29.494  -7.260 -14.237

  No H/Q in entry =          11
  In of MODEL   22
    1    H    LYS  94           H        LYS  94 -31.856  -7.399  -9.633
    2    HA   LYS  94           HA       LYS  94 -34.192  -5.941 -10.251
    3    HB2  LYS  94           HB2      LYS  94 -33.687  -8.129  -8.240
    4    HB3  LYS  94           HB3      LYS  94 -35.280  -7.422  -8.503
    5    HG2  LYS  94           HG2      LYS  94 -35.208  -8.199 -10.837
    6    HG3  LYS  94           HG3      LYS  94 -33.651  -8.962 -10.514
    7    HD2  LYS  94           HD2      LYS  94 -34.775 -10.286  -8.684
    8    HD3  LYS  94           HD3      LYS  94 -36.316  -9.628  -9.235
    9    HE2  LYS  94           HE2      LYS  94 -35.814 -10.561 -11.503
   10    HE3  LYS  94           HE3      LYS  94 -34.403 -11.354 -10.804
   11    HZ3  LYS  94           HZ1      LYS  94 -36.264 -12.862 -10.967
   12    HZ2  LYS  94           HZ2      LYS  94 -37.227 -11.829 -10.022
   13    HZ1  LYS  94           HZ3      LYS  94 -35.871 -12.587  -9.338

  No H/Q in entry =          13
  In of MODEL   22
    1    H    ALA  95           H        ALA  95 -32.359  -6.074  -7.208
    2    HA   ALA  95           HA       ALA  95 -34.192  -4.480  -5.724
    3    HB2  ALA  95           HB1      ALA  95 -31.825  -5.872  -5.194
    4    HB3  ALA  95           HB2      ALA  95 -32.793  -4.959  -4.037
    5    HB1  ALA  95           HB3      ALA  95 -31.442  -4.183  -4.864

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA  96           H        ALA  96 -31.551  -3.646  -7.830
    2    HA   ALA  96           HA       ALA  96 -31.431  -0.886  -7.057
    3    HB2  ALA  96           HB1      ALA  96 -30.074  -0.670  -9.171
    4    HB3  ALA  96           HB2      ALA  96 -30.392  -2.375  -9.489
    5    HB1  ALA  96           HB3      ALA  96 -29.469  -1.902  -8.064

  No H/Q in entry =           5
  In of MODEL   22
    1    H    VAL  97           H        VAL  97 -32.985  -2.589  -9.738
    2    HA   VAL  97           HA       VAL  97 -34.040  -0.281 -10.991
    3    HB   VAL  97           HB       VAL  97 -34.874  -3.200 -11.029
    4   HG11  VAL  97          HG11      VAL  97 -36.652  -1.179 -11.510
    5   HG13  VAL  97          HG12      VAL  97 -36.726  -2.771 -12.266
    6   HG12  VAL  97          HG13      VAL  97 -35.964  -1.428 -13.116
    7   HG21  VAL  97          HG21      VAL  97 -33.587  -1.383 -13.069
    8   HG23  VAL  97          HG22      VAL  97 -34.055  -3.059 -13.357
    9   HG22  VAL  97          HG23      VAL  97 -32.799  -2.682 -12.175

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ALA  98           H        ALA  98 -35.233  -2.449  -8.450
    2    HA   ALA  98           HA       ALA  98 -37.783  -1.278  -8.090
    3    HB1  ALA  98           HB1      ALA  98 -36.785  -3.485  -7.060
    4    HB3  ALA  98           HB2      ALA  98 -37.954  -2.551  -6.125
    5    HB2  ALA  98           HB3      ALA  98 -36.232  -2.418  -5.771

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA  99           H        ALA  99 -34.691  -0.508  -6.453
    2    HA   ALA  99           HA       ALA  99 -35.796   1.486  -4.788
    3    HB1  ALA  99           HB1      ALA  99 -33.158   0.572  -5.545
    4    HB2  ALA  99           HB2      ALA  99 -33.696   1.328  -4.044
    5    HB3  ALA  99           HB3      ALA  99 -33.216   2.330  -5.412

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ILE 100           H        ILE 100 -34.766   1.609  -8.147
    2    HA   ILE 100           HA       ILE 100 -34.918   4.458  -8.365
    3    HB   ILE 100           HB       ILE 100 -35.042   2.306 -10.504
    4   HG12  ILE 100          HG12      ILE 100 -32.855   4.276  -9.839
    5   HG13  ILE 100          HG13      ILE 100 -32.906   2.629  -9.210
    6   HG21  ILE 100          HG21      ILE 100 -35.435   5.229 -10.632
    7   HG23  ILE 100          HG22      ILE 100 -35.958   3.966 -11.747
    8   HG22  ILE 100          HG23      ILE 100 -34.300   4.565 -11.807
    9   HD12  ILE 100          HD11      ILE 100 -32.375   3.582 -11.985
   10   HD11  ILE 100          HD12      ILE 100 -33.050   1.973 -11.729
   11   HD13  ILE 100          HD13      ILE 100 -31.496   2.401 -11.014

  No H/Q in entry =          11
  In of MODEL   22
    1    H    LYS 101           H        LYS 101 -37.240   1.873  -9.084
    2    HA   LYS 101           HA       LYS 101 -39.308   3.544 -10.075
    3    HB2  LYS 101           HB2      LYS 101 -39.216   0.768  -8.950
    4    HB3  LYS 101           HB3      LYS 101 -40.761   1.546  -9.290
    5    HG2  LYS 101           HG2      LYS 101 -40.293   1.676 -11.588
    6    HG3  LYS 101           HG3      LYS 101 -38.601   1.254 -11.340
    7    HD2  LYS 101           HD2      LYS 101 -39.874  -0.641 -12.223
    8    HD3  LYS 101           HD3      LYS 101 -39.245  -0.979 -10.610
    9    HE2  LYS 101           HE2      LYS 101 -41.312  -1.653 -10.097
   10    HE3  LYS 101           HE3      LYS 101 -41.751   0.056 -10.098
   11    HZ3  LYS 101           HZ1      LYS 101 -42.652  -0.090 -12.212
   12    HZ2  LYS 101           HZ2      LYS 101 -43.126  -1.560 -11.504
   13    HZ1  LYS 101           HZ3      LYS 101 -41.823  -1.524 -12.591

  No H/Q in entry =          13
  In of MODEL   22
    1    H    LYS 102           H        LYS 102 -38.820   2.058  -6.870
    2    HA   LYS 102           HA       LYS 102 -41.052   3.276  -5.663
    3    HB2  LYS 102           HB2      LYS 102 -39.831   1.396  -4.654
    4    HB3  LYS 102           HB3      LYS 102 -38.428   2.437  -4.414
    5    HG2  LYS 102           HG2      LYS 102 -39.726   3.843  -2.911
    6    HG3  LYS 102           HG3      LYS 102 -41.131   2.807  -3.153
    7    HD2  LYS 102           HD2      LYS 102 -39.921   0.927  -2.133
    8    HD3  LYS 102           HD3      LYS 102 -38.516   1.966  -1.889
    9    HE2  LYS 102           HE2      LYS 102 -39.851   3.456  -0.475
   10    HE3  LYS 102           HE3      LYS 102 -41.272   2.449  -0.740
   11    HZ1  LYS 102           HZ1      LYS 102 -39.567   0.676   0.257
   12    HZ3  LYS 102           HZ2      LYS 102 -40.666   1.572   1.191
   13    HZ2  LYS 102           HZ3      LYS 102 -39.049   2.080   1.060

  No H/Q in entry =          13
  In of MODEL   22
    1    H    ALA 103           H        ALA 103 -38.086   4.638  -6.684
    2    HA   ALA 103           HA       ALA 103 -38.280   6.953  -4.899
    3    HB2  ALA 103           HB1      ALA 103 -36.286   7.669  -6.480
    4    HB3  ALA 103           HB2      ALA 103 -36.269   5.950  -6.880
    5    HB1  ALA 103           HB3      ALA 103 -36.031   6.470  -5.212

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA 104           H        ALA 104 -38.918   6.232  -8.244
    2    HA   ALA 104           HA       ALA 104 -39.477   9.023  -8.861
    3    HB2  ALA 104           HB1      ALA 104 -39.534   8.358 -11.065
    4    HB1  ALA 104           HB2      ALA 104 -40.276   6.804 -10.686
    5    HB3  ALA 104           HB3      ALA 104 -38.549   7.048 -10.412

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA 105           H        ALA 105 -41.101   6.933  -7.054
    2    HA   ALA 105           HA       ALA 105 -43.511   8.351  -7.019
    3    HB2  ALA 105           HB1      ALA 105 -44.270   7.502  -9.056
    4    HB3  ALA 105           HB2      ALA 105 -44.916   6.319  -7.919
    5    HB1  ALA 105           HB3      ALA 105 -43.453   5.956  -8.833

  No H/Q in entry =           5
  In of MODEL   23
    1    H1   ALA   1           H3       ALA   1 -12.218 -15.679  -2.403
    2    H2   ALA   1           H2       ALA   1 -11.278 -16.823  -3.243
    3    H3   ALA   1           H1       ALA   1 -12.419 -15.876  -4.077
    4    HA   ALA   1           HA       ALA   1 -13.821 -17.573  -3.839
    5    HB3  ALA   1           HB1      ALA   1 -12.429 -19.348  -3.376
    6    HB1  ALA   1           HB2      ALA   1 -13.186 -19.234  -1.787
    7    HB2  ALA   1           HB3      ALA   1 -11.609 -18.496  -2.067

  No H/Q in entry =           7
  In of MODEL   23
    1    H    GLU   2           H        GLU   2 -15.447 -18.425  -2.185
    2    HA   GLU   2           HA       GLU   2 -17.092 -16.701  -1.127
    3    HB2  GLU   2           HB2      GLU   2 -16.159 -19.129   0.418
    4    HB3  GLU   2           HB3      GLU   2 -17.681 -18.276   0.671
    5    HG2  GLU   2           HG2      GLU   2 -18.662 -19.360  -1.064
    6    HG3  GLU   2           HG3      GLU   2 -17.338 -18.962  -2.148

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLU   3           H        GLU   3 -15.184 -18.059   1.497
    2    HA   GLU   3           HA       GLU   3 -15.402 -15.705   3.054
    3    HB2  GLU   3           HB2      GLU   3 -13.822 -18.255   3.305
    4    HB3  GLU   3           HB3      GLU   3 -13.588 -16.936   4.453
    5    HG2  GLU   3           HG2      GLU   3 -15.782 -17.083   5.270
    6    HG3  GLU   3           HG3      GLU   3 -16.378 -17.882   3.820

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LEU   4           H        LEU   4 -12.449 -17.190   1.665
    2    HA   LEU   4           HA       LEU   4 -10.612 -15.290   2.265
    3    HB2  LEU   4           HB2      LEU   4 -10.843 -16.587  -0.461
    4    HB3  LEU   4           HB3      LEU   4  -9.390 -15.870   0.225
    5    HG   LEU   4           HG       LEU   4 -10.890 -18.264   1.337
    6   HD13  LEU   4          HD11      LEU   4  -9.259 -19.623   0.408
    7   HD12  LEU   4          HD12      LEU   4  -8.047 -18.342   0.382
    8   HD11  LEU   4          HD13      LEU   4  -9.335 -18.361  -0.821
    9   HD23  LEU   4          HD21      LEU   4  -8.639 -18.332   2.720
   10   HD22  LEU   4          HD22      LEU   4  -9.959 -17.290   3.248
   11   HD21  LEU   4          HD23      LEU   4  -8.594 -16.604   2.367

  No H/Q in entry =          11
  In of MODEL   23
    1    H    GLU   5           H        GLU   5 -12.944 -15.078  -0.411
    2    HA   GLU   5           HA       GLU   5 -11.935 -12.597  -1.411
    3    HB2  GLU   5           HB2      GLU   5 -13.283 -14.181  -2.773
    4    HB3  GLU   5           HB3      GLU   5 -14.683 -13.812  -1.765
    5    HG2  GLU   5           HG2      GLU   5 -14.550 -11.446  -2.410
    6    HG3  GLU   5           HG3      GLU   5 -13.122 -11.784  -3.389

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLU   6           H        GLU   6 -14.663 -13.469   0.679
    2    HA   GLU   6           HA       GLU   6 -15.562 -10.791   1.078
    3    HB2  GLU   6           HB2      GLU   6 -15.987 -13.336   2.658
    4    HB3  GLU   6           HB3      GLU   6 -16.773 -11.805   3.045
    5    HG2  GLU   6           HG2      GLU   6 -17.818 -11.742   0.838
    6    HG3  GLU   6           HG3      GLU   6 -16.969 -13.213   0.367

  No H/Q in entry =           6
  In of MODEL   23
    1    H    VAL   7           H        VAL   7 -13.261 -12.906   2.651
    2    HA   VAL   7           HA       VAL   7 -12.793 -11.333   4.979
    3    HB   VAL   7           HB       VAL   7 -11.092 -13.380   3.531
    4   HG11  VAL   7          HG11      VAL   7 -10.623 -11.848   6.095
    5   HG13  VAL   7          HG12      VAL   7  -9.522 -12.065   4.735
    6   HG12  VAL   7          HG13      VAL   7  -9.879 -13.421   5.805
    7   HG21  VAL   7          HG21      VAL   7 -13.345 -13.939   4.749
    8   HG23  VAL   7          HG22      VAL   7 -12.419 -13.668   6.225
    9   HG22  VAL   7          HG23      VAL   7 -11.928 -14.928   5.096

  No H/Q in entry =           9
  In of MODEL   23
    1    H    VAL   8           H        VAL   8 -11.279 -11.450   1.770
    2    HA   VAL   8           HA       VAL   8  -9.212  -9.582   2.265
    3    HB   VAL   8           HB       VAL   8 -10.675 -10.258  -0.299
    4   HG12  VAL   8          HG11      VAL   8  -8.499  -9.274  -1.297
    5   HG11  VAL   8          HG12      VAL   8  -8.284  -8.504   0.276
    6   HG13  VAL   8          HG13      VAL   8  -9.709  -8.137  -0.698
    7   HG23  VAL   8          HG21      VAL   8  -7.845 -11.065   0.130
    8   HG22  VAL   8          HG22      VAL   8  -9.185 -11.987  -0.545
    9   HG21  VAL   8          HG23      VAL   8  -9.001 -11.860   1.201

  No H/Q in entry =           9
  In of MODEL   23
    1    H    MET   9           H        MET   9 -12.556  -9.185   1.102
    2    HA   MET   9           HA       MET   9 -12.486  -6.408   0.668
    3    HB2  MET   9           HB2      MET   9 -14.696  -8.294   1.474
    4    HB3  MET   9           HB3      MET   9 -14.985  -6.561   1.302
    5    HG2  MET   9           HG2      MET   9 -14.142  -6.645  -1.014
    6    HG3  MET   9           HG3      MET   9 -13.852  -8.376  -0.846
    7    HE1  MET   9           HE1      MET   9 -16.085  -5.554  -0.412
    8    HE3  MET   9           HE2      MET   9 -17.359  -6.374   0.485
    9    HE2  MET   9           HE3      MET   9 -17.611  -5.962  -1.209

  No H/Q in entry =           9
  In of MODEL   23
    1    H    GLY  10           H        GLY  10 -13.156  -8.298   3.595
    2    HA3  GLY  10           HA2      GLY  10 -13.701  -6.113   5.313
    3    HA2  GLY  10           HA3      GLY  10 -13.140  -7.703   5.827

  No H/Q in entry =           3
  In of MODEL   23
    1    H    LEU  11           H        LEU  11 -10.694  -7.831   4.514
    2    HA   LEU  11           HA       LEU  11  -8.992  -6.401   6.273
    3    HB2  LEU  11           HB2      LEU  11  -8.446  -7.826   3.666
    4    HB3  LEU  11           HB3      LEU  11  -7.175  -7.123   4.666
    5    HG   LEU  11           HG       LEU  11  -9.182  -9.153   5.680
    6   HD13  LEU  11          HD11      LEU  11  -7.961 -10.392   4.117
    7   HD12  LEU  11          HD12      LEU  11  -7.027 -10.632   5.593
    8   HD11  LEU  11          HD13      LEU  11  -6.484  -9.468   4.386
    9   HD22  LEU  11          HD21      LEU  11  -8.329  -8.142   7.598
   10   HD21  LEU  11          HD22      LEU  11  -6.789  -7.743   6.836
   11   HD23  LEU  11          HD23      LEU  11  -7.118  -9.398   7.345

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  12           H        ILE  12  -9.890  -5.852   2.882
    2    HA   ILE  12           HA       ILE  12  -8.194  -3.625   2.457
    3    HB   ILE  12           HB       ILE  12 -10.849  -4.289   1.159
    4   HG12  ILE  12          HG12      ILE  12  -8.814  -5.947   1.090
    5   HG13  ILE  12          HG13      ILE  12  -9.679  -5.594  -0.392
    6   HG22  ILE  12          HG21      ILE  12  -9.955  -2.893  -0.722
    7   HG21  ILE  12          HG22      ILE  12  -8.611  -2.416   0.308
    8   HG23  ILE  12          HG23      ILE  12 -10.243  -1.989   0.733
    9   HD11  ILE  12          HD11      ILE  12  -7.159  -4.166   0.499
   10   HD13  ILE  12          HD12      ILE  12  -7.957  -4.039  -1.066
   11   HD12  ILE  12          HD13      ILE  12  -7.175  -5.531  -0.602

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  13           H        ILE  13 -11.557  -3.888   3.548
    2    HA   ILE  13           HA       ILE  13 -12.014  -1.100   3.817
    3    HB   ILE  13           HB       ILE  13 -13.223  -3.522   5.171
    4   HG12  ILE  13          HG12      ILE  13 -13.451  -2.970   2.640
    5   HG13  ILE  13          HG13      ILE  13 -14.880  -3.418   3.545
    6   HG21  ILE  13          HG21      ILE  13 -13.837  -0.596   5.516
    7   HG23  ILE  13          HG22      ILE  13 -13.739  -1.850   6.745
    8   HG22  ILE  13          HG23      ILE  13 -15.130  -1.784   5.665
    9   HD13  ILE  13          HD11      ILE  13 -15.754  -1.268   3.513
   10   HD12  ILE  13          HD12      ILE  13 -14.884  -1.295   1.992
   11   HD11  ILE  13          HD13      ILE  13 -14.155  -0.528   3.384

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ASN  14           H        ASN  14 -10.907  -3.592   6.093
    2    HA   ASN  14           HA       ASN  14 -10.707  -1.954   8.378
    3    HB2  ASN  14           HB2      ASN  14 -10.456  -4.561   8.057
    4    HB3  ASN  14           HB3      ASN  14  -8.747  -4.175   7.901
    5   HD21  ASN  14          HD21      ASN  14  -9.387  -5.699  10.077
    6   HD22  ASN  14          HD22      ASN  14  -9.360  -4.779  11.501

  No H/Q in entry =           6
  In of MODEL   23
    1    H    SER  15           H        SER  15  -8.303  -2.779   5.889
    2    HA   SER  15           HA       SER  15  -6.160  -1.287   6.963
    3    HB2  SER  15           HB2      SER  15  -5.139  -1.500   4.805
    4    HB3  SER  15           HB3      SER  15  -6.091  -2.963   5.032
    5    HG   SER  15           HG       SER  15  -7.800  -1.458   3.990

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLY  16           H        GLY  16  -8.759  -0.420   4.713
    2    HA3  GLY  16           HA2      GLY  16  -7.900   2.221   4.163
    3    HA2  GLY  16           HA3      GLY  16  -9.551   1.626   3.999

  No H/Q in entry =           3
  In of MODEL   23
    1    H    GLN  17           H        GLN  17 -10.097   0.901   6.648
    2    HA   GLN  17           HA       GLN  17 -10.806   3.406   7.788
    3    HB2  GLN  17           HB2      GLN  17 -10.707   0.624   8.967
    4    HB3  GLN  17           HB3      GLN  17 -11.333   2.023   9.839
    5    HG2  GLN  17           HG2      GLN  17 -12.354   1.075   7.145
    6    HG3  GLN  17           HG3      GLN  17 -13.130   0.728   8.690
    7   HE21  GLN  17          HE21      GLN  17 -13.528   2.707   6.130
    8   HE22  GLN  17          HE22      GLN  17 -14.125   4.096   6.903

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ALA  18           H        ALA  18  -8.177   1.126   8.410
    2    HA   ALA  18           HA       ALA  18  -7.082   2.343  10.682
    3    HB2  ALA  18           HB1      ALA  18  -6.470   0.127   9.316
    4    HB3  ALA  18           HB2      ALA  18  -5.308   0.911  10.387
    5    HB1  ALA  18           HB3      ALA  18  -5.229   1.189   8.647

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ARG  19           H        ARG  19  -6.307   2.866   7.234
    2    HA   ARG  19           HA       ARG  19  -4.411   4.915   7.665
    3    HB2  ARG  19           HB2      ARG  19  -4.735   3.774   5.469
    4    HB3  ARG  19           HB3      ARG  19  -6.278   4.613   5.290
    5    HG2  ARG  19           HG2      ARG  19  -5.152   6.786   5.359
    6    HG3  ARG  19           HG3      ARG  19  -3.602   6.002   5.666
    7    HD2  ARG  19           HD2      ARG  19  -3.725   6.591   3.322
    8    HD3  ARG  19           HD3      ARG  19  -3.808   4.831   3.468
    9    HE   ARG  19           HE       ARG  19  -6.443   5.738   3.457
   10   HH21  ARG  19          HH11      ARG  19  -7.636   5.892   1.538
   11   HH22  ARG  19          HH12      ARG  19  -6.812   5.970   0.019
   12   HH11  ARG  19          HH21      ARG  19  -3.665   5.804   1.427
   13   HH12  ARG  19          HH22      ARG  19  -4.563   5.918  -0.044

  No H/Q in entry =          13
  In of MODEL   23
    1    H    SER  20           H        SER  20  -7.909   5.026   7.060
    2    HA   SER  20           HA       SER  20  -8.269   7.781   7.011
    3    HB2  SER  20           HB2      SER  20 -10.144   6.437   6.472
    4    HB3  SER  20           HB3      SER  20 -10.037   5.546   7.988
    5    HG   SER  20           HG       SER  20 -10.412   8.337   7.971

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU  21           H        LEU  21  -8.270   5.599   9.816
    2    HA   LEU  21           HA       LEU  21  -8.716   7.595  11.779
    3    HB2  LEU  21           HB2      LEU  21  -7.362   4.895  11.940
    4    HB3  LEU  21           HB3      LEU  21  -7.670   5.912  13.345
    5    HG   LEU  21           HG       LEU  21  -9.842   5.019  11.426
    6   HD12  LEU  21          HD11      LEU  21 -10.435   3.453  13.363
    7   HD11  LEU  21          HD12      LEU  21  -8.816   3.777  13.986
    8   HD13  LEU  21          HD13      LEU  21  -9.019   3.009  12.409
    9   HD22  LEU  21          HD21      LEU  21 -10.770   6.813  12.587
   10   HD21  LEU  21          HD22      LEU  21  -9.775   6.555  14.017
   11   HD23  LEU  21          HD23      LEU  21 -11.151   5.509  13.708

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ALA  22           H        ALA  22  -5.759   6.227  10.376
    2    HA   ALA  22           HA       ALA  22  -3.885   7.544  12.000
    3    HB2  ALA  22           HB1      ALA  22  -3.463   5.690  10.310
    4    HB1  ALA  22           HB2      ALA  22  -2.269   6.989  10.347
    5    HB3  ALA  22           HB3      ALA  22  -3.485   6.942   9.069

  No H/Q in entry =           5
  In of MODEL   23
    1    H    TYR  23           H        TYR  23  -5.199   8.557   8.816
    2    HA   TYR  23           HA       TYR  23  -3.868  11.056   8.746
    3    HB2  TYR  23           HB2      TYR  23  -4.943  10.143   6.753
    4    HB3  TYR  23           HB3      TYR  23  -6.523  10.244   7.532
    5    HD1  TYR  23           HD1      TYR  23  -3.626  12.296   6.382
    6    HD2  TYR  23           HD2      TYR  23  -7.768  12.252   7.515
    7    HE1  TYR  23           HE1      TYR  23  -3.857  14.645   5.622
    8    HE2  TYR  23           HE2      TYR  23  -8.001  14.602   6.755
    9    HH   TYR  23           HH       TYR  23  -5.610  16.170   4.881

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ALA  24           H        ALA  24  -6.987  10.073  10.121
    2    HA   ALA  24           HA       ALA  24  -7.830  12.661  10.890
    3    HB1  ALA  24           HB1      ALA  24  -9.647  11.407  11.356
    4    HB2  ALA  24           HB2      ALA  24  -8.822  10.837  12.805
    5    HB3  ALA  24           HB3      ALA  24  -8.693   9.925  11.302

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA  25           H        ALA  25  -5.826  10.208  12.468
    2    HA   ALA  25           HA       ALA  25  -5.494  11.462  14.971
    3    HB2  ALA  25           HB1      ALA  25  -4.721   9.111  14.152
    4    HB3  ALA  25           HB2      ALA  25  -3.710   9.972  15.314
    5    HB1  ALA  25           HB3      ALA  25  -3.271   9.955  13.605

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU  26           H        LEU  26  -3.699  11.763  11.933
    2    HA   LEU  26           HA       LEU  26  -1.746  13.587  12.851
    3    HB2  LEU  26           HB2      LEU  26  -1.439  12.435  10.748
    4    HB3  LEU  26           HB3      LEU  26  -2.912  13.140  10.091
    5    HG   LEU  26           HG       LEU  26  -1.902  15.393  10.227
    6   HD12  LEU  26          HD11      LEU  26   0.636  15.417  10.645
    7   HD11  LEU  26          HD12      LEU  26   0.414  13.836  11.390
    8   HD13  LEU  26          HD13      LEU  26  -0.397  15.250  12.064
    9   HD21  LEU  26          HD21      LEU  26  -0.153  13.341   8.836
   10   HD23  LEU  26          HD22      LEU  26  -0.199  15.062   8.465
   11   HD22  LEU  26          HD23      LEU  26  -1.620  14.062   8.175

  No H/Q in entry =          11
  In of MODEL   23
    1    H    LYS  27           H        LYS  27  -4.926  14.064  11.369
    2    HA   LYS  27           HA       LYS  27  -4.876  16.852  11.170
    3    HB2  LYS  27           HB2      LYS  27  -6.615  15.372  10.182
    4    HB3  LYS  27           HB3      LYS  27  -7.274  15.115  11.797
    5    HG2  LYS  27           HG2      LYS  27  -7.708  17.520  12.032
    6    HG3  LYS  27           HG3      LYS  27  -6.998  17.818  10.442
    7    HD2  LYS  27           HD2      LYS  27  -8.727  16.380   9.403
    8    HD3  LYS  27           HD3      LYS  27  -9.443  16.100  10.992
    9    HE2  LYS  27           HE2      LYS  27  -9.889  18.510  11.234
   10    HE3  LYS  27           HE3      LYS  27  -9.145  18.813   9.660
   11    HZ3  LYS  27           HZ1      LYS  27 -11.522  18.684   9.415
   12    HZ2  LYS  27           HZ2      LYS  27 -11.569  17.168  10.185
   13    HZ1  LYS  27           HZ3      LYS  27 -10.822  17.332   8.664

  No H/Q in entry =          13
  In of MODEL   23
    1    H    GLN  28           H        GLN  28  -5.765  14.766  13.896
    2    HA   GLN  28           HA       GLN  28  -6.666  16.769  15.670
    3    HB2  GLN  28           HB2      GLN  28  -5.265  14.138  16.211
    4    HB3  GLN  28           HB3      GLN  28  -6.000  15.142  17.462
    5    HG2  GLN  28           HG2      GLN  28  -7.467  14.016  15.060
    6    HG3  GLN  28           HG3      GLN  28  -7.530  13.342  16.688
    7   HE21  GLN  28          HE21      GLN  28  -9.402  15.119  14.707
    8   HE22  GLN  28          HE22      GLN  28 -10.142  16.158  15.825

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ALA  29           H        ALA  29  -3.445  15.475  14.986
    2    HA   ALA  29           HA       ALA  29  -2.011  16.875  16.966
    3    HB1  ALA  29           HB1      ALA  29  -0.078  16.184  15.850
    4    HB3  ALA  29           HB2      ALA  29  -0.830  16.307  14.260
    5    HB2  ALA  29           HB3      ALA  29  -1.253  14.975  15.334

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LYS  30           H        LYS  30  -2.864  17.753  13.635
    2    HA   LYS  30           HA       LYS  30  -1.452  20.192  13.536
    3    HB2  LYS  30           HB2      LYS  30  -3.982  19.320  12.124
    4    HB3  LYS  30           HB3      LYS  30  -3.146  20.834  11.781
    5    HG2  LYS  30           HG2      LYS  30  -1.077  19.538  11.270
    6    HG3  LYS  30           HG3      LYS  30  -1.985  18.043  11.514
    7    HD2  LYS  30           HD2      LYS  30  -3.546  18.685   9.718
    8    HD3  LYS  30           HD3      LYS  30  -2.661  20.192   9.475
    9    HE2  LYS  30           HE2      LYS  30  -0.629  18.896   8.899
   10    HE3  LYS  30           HE3      LYS  30  -1.534  17.395   9.110
   11    HZ2  LYS  30           HZ1      LYS  30  -1.353  18.265   6.768
   12    HZ1  LYS  30           HZ2      LYS  30  -2.396  19.529   7.235
   13    HZ3  LYS  30           HZ3      LYS  30  -2.923  17.913   7.306

  No H/Q in entry =          13
  In of MODEL   23
    1    H    GLN  31           H        GLN  31  -4.556  19.345  14.945
    2    HA   GLN  31           HA       GLN  31  -5.314  22.104  15.395
    3    HB2  GLN  31           HB2      GLN  31  -6.500  19.660  16.717
    4    HB3  GLN  31           HB3      GLN  31  -7.256  21.233  16.470
    5    HG2  GLN  31           HG2      GLN  31  -6.544  20.454  13.881
    6    HG3  GLN  31           HG3      GLN  31  -7.073  18.951  14.628
    7   HE21  GLN  31          HE21      GLN  31  -8.477  20.528  12.525
    8   HE22  GLN  31          HE22      GLN  31  -9.991  20.923  13.181

  No H/Q in entry =           8
  In of MODEL   23
    1    H    GLY  32           H        GLY  32  -3.008  20.171  16.718
    2    HA3  GLY  32           HA2      GLY  32  -1.608  20.629  18.522
    3    HA2  GLY  32           HA3      GLY  32  -2.734  21.875  19.044

  No H/Q in entry =           3
  In of MODEL   23
    1    H    ASP  33           H        ASP  33  -4.164  18.840  18.381
    2    HA   ASP  33           HA       ASP  33  -4.579  18.383  21.260
    3    HB2  ASP  33           HB2      ASP  33  -5.986  17.375  18.781
    4    HB3  ASP  33           HB3      ASP  33  -6.334  16.766  20.397

  No H/Q in entry =           4
  In of MODEL   23
    1    H    PHE  34           H        PHE  34  -2.413  17.526  21.568
    2    HA   PHE  34           HA       PHE  34  -1.418  15.274  20.168
    3    HB2  PHE  34           HB2      PHE  34  -0.801  16.256  22.963
    4    HB3  PHE  34           HB3      PHE  34   0.125  15.031  22.096
    5    HD1  PHE  34           HD1      PHE  34  -0.038  18.457  22.832
    6    HD2  PHE  34           HD2      PHE  34   0.788  15.752  19.597
    7    HE1  PHE  34           HE1      PHE  34   1.263  20.225  21.679
    8    HE2  PHE  34           HE2      PHE  34   2.084  17.523  18.450
    9    HZ   PHE  34           HZ       PHE  34   2.324  19.756  19.495

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ALA  35           H        ALA  35  -3.460  15.557  23.029
    2    HA   ALA  35           HA       ALA  35  -3.256  12.894  23.925
    3    HB3  ALA  35           HB1      ALA  35  -5.713  13.527  24.780
    4    HB1  ALA  35           HB2      ALA  35  -5.175  15.143  24.325
    5    HB2  ALA  35           HB3      ALA  35  -4.264  14.217  25.517

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA  36           H        ALA  36  -5.700  14.418  21.823
    2    HA   ALA  36           HA       ALA  36  -7.122  12.011  21.343
    3    HB1  ALA  36           HB1      ALA  36  -8.572  13.438  20.386
    4    HB3  ALA  36           HB2      ALA  36  -7.397  13.855  19.138
    5    HB2  ALA  36           HB3      ALA  36  -7.421  14.742  20.662

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA  37           H        ALA  37  -4.435  13.591  19.677
    2    HA   ALA  37           HA       ALA  37  -4.403  11.956  17.380
    3    HB3  ALA  37           HB1      ALA  37  -2.406  13.661  18.805
    4    HB2  ALA  37           HB2      ALA  37  -2.935  13.719  17.125
    5    HB1  ALA  37           HB3      ALA  37  -1.786  12.486  17.646

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LYS  38           H        LYS  38  -2.650  11.644  20.460
    2    HA   LYS  38           HA       LYS  38  -1.330   9.240  19.971
    3    HB2  LYS  38           HB2      LYS  38  -1.651  11.003  22.117
    4    HB3  LYS  38           HB3      LYS  38  -2.275   9.475  22.732
    5    HG2  LYS  38           HG2      LYS  38  -0.183   8.349  22.197
    6    HG3  LYS  38           HG3      LYS  38   0.431   9.792  21.385
    7    HD2  LYS  38           HD2      LYS  38   0.601  11.010  23.420
    8    HD3  LYS  38           HD3      LYS  38  -0.422   9.862  24.286
    9    HE2  LYS  38           HE2      LYS  38   1.932   9.539  24.907
   10    HE3  LYS  38           HE3      LYS  38   1.324   8.125  24.042
   11    HZ3  LYS  38           HZ1      LYS  38   2.628   8.541  22.262
   12    HZ2  LYS  38           HZ2      LYS  38   3.584   9.366  23.400
   13    HZ1  LYS  38           HZ3      LYS  38   2.508  10.229  22.408

  No H/Q in entry =          13
  In of MODEL   23
    1    H    ALA  39           H        ALA  39  -4.569   9.744  21.371
    2    HA   ALA  39           HA       ALA  39  -5.137   7.026  21.874
    3    HB3  ALA  39           HB1      ALA  39  -7.290   8.977  21.105
    4    HB2  ALA  39           HB2      ALA  39  -6.393   9.201  22.607
    5    HB1  ALA  39           HB3      ALA  39  -7.313   7.719  22.342

  No H/Q in entry =           5
  In of MODEL   23
    1    H    MET  40           H        MET  40  -5.714   9.042  19.027
    2    HA   MET  40           HA       MET  40  -7.194   7.114  17.565
    3    HB2  MET  40           HB2      MET  40  -5.577   9.505  16.663
    4    HB3  MET  40           HB3      MET  40  -6.604   8.550  15.591
    5    HG2  MET  40           HG2      MET  40  -7.638   9.800  18.149
    6    HG3  MET  40           HG3      MET  40  -7.692  10.636  16.598
    7    HE3  MET  40           HE1      MET  40 -10.278   9.024  14.531
    8    HE2  MET  40           HE2      MET  40  -8.524   9.137  14.384
    9    HE1  MET  40           HE3      MET  40  -9.439  10.504  15.018

  No H/Q in entry =           9
  In of MODEL   23
    1    H    MET  41           H        MET  41  -3.701   7.843  17.691
    2    HA   MET  41           HA       MET  41  -2.945   6.087  15.591
    3    HB2  MET  41           HB2      MET  41  -1.329   6.749  18.066
    4    HB3  MET  41           HB3      MET  41  -0.712   6.100  16.550
    5    HG2  MET  41           HG2      MET  41  -1.862   8.286  15.546
    6    HG3  MET  41           HG3      MET  41  -1.626   8.872  17.191
    7    HE2  MET  41           HE1      MET  41   1.286   6.767  17.555
    8    HE1  MET  41           HE2      MET  41   0.500   8.062  18.453
    9    HE3  MET  41           HE3      MET  41   2.124   8.302  17.812

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ASP  42           H        ASP  42  -3.335   5.613  19.076
    2    HA   ASP  42           HA       ASP  42  -2.305   3.017  19.237
    3    HB2  ASP  42           HB2      ASP  42  -3.177   4.778  21.059
    4    HB3  ASP  42           HB3      ASP  42  -4.606   3.756  20.984

  No H/Q in entry =           4
  In of MODEL   23
    1    H    GLN  43           H        GLN  43  -5.635   4.128  18.733
    2    HA   GLN  43           HA       GLN  43  -6.784   1.543  18.536
    3    HB2  GLN  43           HB2      GLN  43  -7.701   4.198  17.407
    4    HB3  GLN  43           HB3      GLN  43  -8.666   2.721  17.383
    5    HG2  GLN  43           HG2      GLN  43  -8.376   2.598  19.891
    6    HG3  GLN  43           HG3      GLN  43  -7.648   4.201  19.821
    7   HE21  GLN  43          HE21      GLN  43  -9.829   4.285  21.319
    8   HE22  GLN  43          HE22      GLN  43 -11.188   4.864  20.486

  No H/Q in entry =           8
  In of MODEL   23
    1    H    SER  44           H        SER  44  -5.437   3.756  16.126
    2    HA   SER  44           HA       SER  44  -6.138   2.274  13.836
    3    HB2  SER  44           HB2      SER  44  -4.877   4.654  14.282
    4    HB3  SER  44           HB3      SER  44  -3.525   3.656  13.753
    5    HG   SER  44           HG       SER  44  -4.633   4.631  11.989

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ARG  45           H        ARG  45  -3.263   2.154  15.920
    2    HA   ARG  45           HA       ARG  45  -1.786   0.197  14.538
    3    HB2  ARG  45           HB2      ARG  45  -0.943   1.616  16.409
    4    HB3  ARG  45           HB3      ARG  45  -1.938   0.687  17.527
    5    HG2  ARG  45           HG2      ARG  45  -0.710  -1.374  16.885
    6    HG3  ARG  45           HG3      ARG  45   0.309  -0.421  15.809
    7    HD2  ARG  45           HD2      ARG  45   1.044   0.958  17.766
    8    HD3  ARG  45           HD3      ARG  45   0.118  -0.116  18.838
    9    HE   ARG  45           HE       ARG  45   1.816  -1.714  17.259
   10   HH21  ARG  45          HH11      ARG  45   3.714  -2.542  18.098
   11   HH22  ARG  45          HH12      ARG  45   4.487  -1.758  19.430
   12   HH11  ARG  45          HH21      ARG  45   2.122   0.750  19.650
   13   HH12  ARG  45          HH22      ARG  45   3.585   0.108  20.307

  No H/Q in entry =          13
  In of MODEL   23
    1    H    MET  46           H        MET  46  -4.187  -0.119  17.135
    2    HA   MET  46           HA       MET  46  -4.026  -2.919  17.441
    3    HB2  MET  46           HB2      MET  46  -6.190  -0.907  18.040
    4    HB3  MET  46           HB3      MET  46  -6.404  -2.627  18.377
    5    HG2  MET  46           HG2      MET  46  -4.409  -2.629  19.794
    6    HG3  MET  46           HG3      MET  46  -4.107  -0.940  19.413
    7    HE3  MET  46           HE1      MET  46  -7.693  -2.747  20.322
    8    HE2  MET  46           HE2      MET  46  -7.336  -2.797  22.044
    9    HE1  MET  46           HE3      MET  46  -6.243  -3.574  20.904

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ALA  47           H        ALA  47  -6.038  -0.896  15.344
    2    HA   ALA  47           HA       ALA  47  -7.660  -2.942  14.275
    3    HB3  ALA  47           HB1      ALA  47  -8.333  -0.703  13.860
    4    HB1  ALA  47           HB2      ALA  47  -7.844  -1.337  12.288
    5    HB2  ALA  47           HB3      ALA  47  -6.762  -0.272  13.188

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU  48           H        LEU  48  -4.536  -1.642  13.230
    2    HA   LEU  48           HA       LEU  48  -4.256  -3.231  10.888
    3    HB2  LEU  48           HB2      LEU  48  -2.198  -1.960  12.700
    4    HB3  LEU  48           HB3      LEU  48  -1.829  -2.681  11.133
    5    HG   LEU  48           HG       LEU  48  -3.846  -0.457  11.521
    6   HD13  LEU  48          HD11      LEU  48  -1.722   0.411  12.190
    7   HD12  LEU  48          HD12      LEU  48  -1.993   0.967  10.538
    8   HD11  LEU  48          HD13      LEU  48  -0.900  -0.383  10.848
    9   HD22  LEU  48          HD21      LEU  48  -4.317  -1.439   9.444
   10   HD21  LEU  48          HD22      LEU  48  -2.635  -1.879   9.151
   11   HD23  LEU  48          HD23      LEU  48  -3.149  -0.198   8.992

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ASN  49           H        ASN  49  -3.217  -3.634  14.235
    2    HA   ASN  49           HA       ASN  49  -1.622  -5.902  13.906
    3    HB2  ASN  49           HB2      ASN  49  -1.643  -4.573  15.955
    4    HB3  ASN  49           HB3      ASN  49  -3.306  -5.042  16.275
    5   HD21  ASN  49          HD21      ASN  49  -1.345  -5.584  18.195
    6   HD22  ASN  49          HD22      ASN  49  -1.072  -7.257  18.268

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLU  50           H        GLU  50  -5.091  -5.615  14.572
    2    HA   GLU  50           HA       GLU  50  -5.614  -8.412  14.678
    3    HB2  GLU  50           HB2      GLU  50  -7.195  -6.719  15.553
    4    HB3  GLU  50           HB3      GLU  50  -7.483  -6.152  13.906
    5    HG2  GLU  50           HG2      GLU  50  -8.356  -8.344  13.265
    6    HG3  GLU  50           HG3      GLU  50  -7.980  -8.991  14.858

  No H/Q in entry =           6
  In of MODEL   23
    1    H    ALA  51           H        ALA  51  -5.668  -6.012  12.084
    2    HA   ALA  51           HA       ALA  51  -6.658  -7.733  10.059
    3    HB2  ALA  51           HB1      ALA  51  -6.428  -5.921   8.691
    4    HB1  ALA  51           HB2      ALA  51  -4.787  -5.580   9.242
    5    HB3  ALA  51           HB3      ALA  51  -6.170  -5.063  10.209

  No H/Q in entry =           5
  In of MODEL   23
    1    H    HIS  52           H        HIS  52  -3.365  -6.842  11.048
    2    HA   HIS  52           HA       HIS  52  -1.970  -8.337   9.100
    3    HB2  HIS  52           HB2      HIS  52  -0.942  -6.604  10.558
    4    HB3  HIS  52           HB3      HIS  52  -1.096  -7.702  11.929
    5    HD1  HIS  52           HD1      HIS  52   0.314  -9.952  11.807
    6    HD2  HIS  52           HD2      HIS  52   1.228  -7.142   8.865
    7    HE1  HIS  52           HE1      HIS  52   2.525 -10.665  10.798
    8    HE2  HIS  52           HE2      HIS  52   3.096  -8.962   9.003

  No H/Q in entry =           8
  In of MODEL   23
    1    H    LEU  53           H        LEU  53  -3.191  -9.211  12.310
    2    HA   LEU  53           HA       LEU  53  -2.007 -11.761  12.503
    3    HB2  LEU  53           HB2      LEU  53  -4.489 -10.569  13.714
    4    HB3  LEU  53           HB3      LEU  53  -4.036 -12.247  14.006
    5    HG   LEU  53           HG       LEU  53  -2.116  -9.945  14.480
    6   HD11  LEU  53          HD11      LEU  53  -4.174 -11.191  16.309
    7   HD13  LEU  53          HD12      LEU  53  -3.912  -9.482  15.963
    8   HD12  LEU  53          HD13      LEU  53  -2.745 -10.372  16.934
    9   HD23  LEU  53          HD21      LEU  53  -1.273 -11.753  16.184
   10   HD22  LEU  53          HD22      LEU  53  -0.866 -11.938  14.482
   11   HD21  LEU  53          HD23      LEU  53  -2.166 -12.888  15.179

  No H/Q in entry =          11
  In of MODEL   23
    1    H    VAL  54           H        VAL  54  -5.110 -10.714  11.137
    2    HA   VAL  54           HA       VAL  54  -6.037 -13.302  10.446
    3    HB   VAL  54           HB       VAL  54  -6.667 -10.565   9.313
    4   HG12  VAL  54          HG11      VAL  54  -8.775 -11.930   8.496
    5   HG11  VAL  54          HG12      VAL  54  -7.671 -13.303   8.569
    6   HG13  VAL  54          HG13      VAL  54  -7.302 -11.929   7.529
    7   HG22  VAL  54          HG21      VAL  54  -7.578 -10.599  11.462
    8   HG21  VAL  54          HG22      VAL  54  -7.842 -12.341  11.441
    9   HG23  VAL  54          HG23      VAL  54  -8.915 -11.277  10.534

  No H/Q in entry =           9
  In of MODEL   23
    1    H    GLN  55           H        GLN  55  -4.148 -10.860   8.662
    2    HA   GLN  55           HA       GLN  55  -4.023 -12.323   6.243
    3    HB2  GLN  55           HB2      GLN  55  -3.405 -10.062   6.056
    4    HB3  GLN  55           HB3      GLN  55  -2.297 -10.147   7.423
    5    HG2  GLN  55           HG2      GLN  55  -0.583 -11.002   6.149
    6    HG3  GLN  55           HG3      GLN  55  -1.661 -11.969   5.153
    7   HE21  GLN  55          HE21      GLN  55  -1.670 -11.278   3.032
    8   HE22  GLN  55          HE22      GLN  55  -1.461  -9.674   2.523

  No H/Q in entry =           8
  In of MODEL   23
    1    H    THR  56           H        THR  56  -1.922 -12.318   9.128
    2    HA   THR  56           HA       THR  56   0.148 -13.928   8.213
    3    HB   THR  56           HB       THR  56  -1.097 -14.183  10.958
    4    HG1  THR  56           HG1      THR  56   0.170 -12.092   9.711
    5   HG22  THR  56          HG21      THR  56   1.834 -14.221  10.346
    6   HG21  THR  56          HG22      THR  56   0.876 -15.661   9.996
    7   HG23  THR  56          HG23      THR  56   0.951 -15.029  11.641

  No H/Q in entry =           7
  In of MODEL   23
    1    H    LYS  57           H        LYS  57  -2.980 -14.946   9.570
    2    HA   LYS  57           HA       LYS  57  -2.552 -17.745   9.322
    3    HB2  LYS  57           HB2      LYS  57  -4.365 -16.645  10.666
    4    HB3  LYS  57           HB3      LYS  57  -5.151 -16.187   9.163
    5    HG2  LYS  57           HG2      LYS  57  -5.400 -18.550   8.547
    6    HG3  LYS  57           HG3      LYS  57  -4.579 -19.035  10.028
    7    HD2  LYS  57           HD2      LYS  57  -6.374 -17.987  11.368
    8    HD3  LYS  57           HD3      LYS  57  -7.204 -17.512   9.886
    9    HE2  LYS  57           HE2      LYS  57  -8.202 -19.578  10.749
   10    HE3  LYS  57           HE3      LYS  57  -7.360 -19.935   9.243
   11    HZ2  LYS  57           HZ1      LYS  57  -6.909 -21.535  11.048
   12    HZ1  LYS  57           HZ2      LYS  57  -6.175 -20.287  11.939
   13    HZ3  LYS  57           HZ3      LYS  57  -5.510 -20.780  10.455

  No H/Q in entry =          13
  In of MODEL   23
    1    H    LEU  58           H        LEU  58  -3.864 -15.292   7.146
    2    HA   LEU  58           HA       LEU  58  -4.674 -17.110   5.137
    3    HB2  LEU  58           HB2      LEU  58  -4.048 -14.166   5.005
    4    HB3  LEU  58           HB3      LEU  58  -4.715 -15.097   3.663
    5    HG   LEU  58           HG       LEU  58  -5.999 -14.911   6.408
    6   HD11  LEU  58          HD11      LEU  58  -6.284 -13.261   3.918
    7   HD13  LEU  58          HD12      LEU  58  -6.274 -12.754   5.607
    8   HD12  LEU  58          HD13      LEU  58  -7.700 -13.538   4.932
    9   HD22  LEU  58          HD21      LEU  58  -6.972 -16.814   5.536
   10   HD21  LEU  58          HD22      LEU  58  -6.627 -16.363   3.866
   11   HD23  LEU  58          HD23      LEU  58  -7.987 -15.629   4.715

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  59           H        ILE  59  -1.532 -15.921   6.005
    2    HA   ILE  59           HA       ILE  59  -0.434 -16.653   3.370
    3    HB   ILE  59           HB       ILE  59   0.345 -14.596   4.950
    4   HG12  ILE  59          HG12      ILE  59   2.408 -16.258   3.487
    5   HG13  ILE  59          HG13      ILE  59   1.228 -15.276   2.657
    6   HG22  ILE  59          HG21      ILE  59   2.415 -16.668   5.630
    7   HG21  ILE  59          HG22      ILE  59   1.071 -16.374   6.711
    8   HG23  ILE  59          HG23      ILE  59   2.203 -15.078   6.325
    9   HD12  ILE  59          HD11      ILE  59   3.267 -14.295   4.651
   10   HD11  ILE  59          HD12      ILE  59   2.019 -13.282   3.929
   11   HD13  ILE  59          HD13      ILE  59   3.279 -13.988   2.916

  No H/Q in entry =          11
  In of MODEL   23
    1    H    GLU  60           H        GLU  60  -0.459 -17.762   6.737
    2    HA   GLU  60           HA       GLU  60   1.559 -19.753   6.475
    3    HB2  GLU  60           HB2      GLU  60   0.794 -18.964   8.664
    4    HB3  GLU  60           HB3      GLU  60  -0.813 -19.617   8.355
    5    HG2  GLU  60           HG2      GLU  60   0.139 -21.894   8.213
    6    HG3  GLU  60           HG3      GLU  60   1.746 -21.239   8.521

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLY  61           H        GLY  61  -1.951 -19.827   5.982
    2    HA3  GLY  61           HA2      GLY  61  -1.719 -22.621   5.022
    3    HA2  GLY  61           HA3      GLY  61  -3.201 -21.876   5.613

  No H/Q in entry =           3
  In of MODEL   23
    1    H    ASP  62           H        ASP  62  -0.956 -20.311   3.415
    2    HA   ASP  62           HA       ASP  62  -2.980 -19.610   1.570
    3    HB2  ASP  62           HB2      ASP  62  -1.114 -18.781   0.202
    4    HB3  ASP  62           HB3      ASP  62  -0.926 -18.305   1.887

  No H/Q in entry =           4
  In of MODEL   23
    1    H    ALA  63           H        ALA  63  -3.712 -20.545  -0.304
    2    HA   ALA  63           HA       ALA  63  -2.207 -22.619  -1.668
    3    HB3  ALA  63           HB1      ALA  63  -3.717 -24.425  -1.358
    4    HB2  ALA  63           HB2      ALA  63  -4.868 -23.401  -0.499
    5    HB1  ALA  63           HB3      ALA  63  -3.328 -23.818   0.254

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLY  64           H        GLY  64  -5.476 -21.285  -1.189
    2    HA3  GLY  64           HA2      GLY  64  -7.062 -20.520  -2.656
    3    HA2  GLY  64           HA3      GLY  64  -5.715 -19.997  -3.652

  No H/Q in entry =           3
  In of MODEL   23
    1    H    GLU  65           H        GLU  65  -4.866 -21.514  -5.251
    2    HA   GLU  65           HA       GLU  65  -7.002 -23.026  -6.455
    3    HB2  GLU  65           HB2      GLU  65  -4.134 -22.585  -7.286
    4    HB3  GLU  65           HB3      GLU  65  -5.319 -23.475  -8.244
    5    HG2  GLU  65           HG2      GLU  65  -5.487 -21.307  -9.121
    6    HG3  GLU  65           HG3      GLU  65  -6.799 -21.349  -7.947

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLY  66           H        GLY  66  -6.420 -25.136  -7.502
    2    HA3  GLY  66           HA2      GLY  66  -6.147 -27.150  -5.563
    3    HA2  GLY  66           HA3      GLY  66  -6.157 -27.386  -7.299

  No H/Q in entry =           3
  In of MODEL   23
    1    H    LYS  67           H        LYS  67  -3.837 -25.842  -7.862
    2    HA   LYS  67           HA       LYS  67  -1.841 -27.839  -7.316
    3    HB2  LYS  67           HB2      LYS  67  -1.807 -25.312  -8.962
    4    HB3  LYS  67           HB3      LYS  67  -0.458 -26.452  -8.867
    5    HG2  LYS  67           HG2      LYS  67  -1.982 -28.280  -9.591
    6    HG3  LYS  67           HG3      LYS  67  -3.283 -27.103  -9.763
    7    HD2  LYS  67           HD2      LYS  67  -0.649 -26.873 -11.238
    8    HD3  LYS  67           HD3      LYS  67  -2.068 -27.678 -11.914
    9    HE2  LYS  67           HE2      LYS  67  -3.353 -25.522 -11.389
   10    HE3  LYS  67           HE3      LYS  67  -1.777 -24.774 -11.129
   11    HZ1  LYS  67           HZ1      LYS  67  -2.617 -26.162 -13.614
   12    HZ3  LYS  67           HZ2      LYS  67  -1.137 -25.371 -13.358
   13    HZ2  LYS  67           HZ3      LYS  67  -2.583 -24.481 -13.404

  No H/Q in entry =          13
  In of MODEL   23
    1    H    MET  68           H        MET  68   0.480 -26.439  -7.407
    2    HA   MET  68           HA       MET  68   1.072 -25.998  -4.701
    3    HB2  MET  68           HB2      MET  68   2.608 -25.232  -7.186
    4    HB3  MET  68           HB3      MET  68   3.269 -25.238  -5.550
    5    HG2  MET  68           HG2      MET  68   2.061 -27.649  -6.938
    6    HG3  MET  68           HG3      MET  68   3.792 -27.338  -6.779
    7    HE3  MET  68           HE1      MET  68   4.774 -27.772  -3.318
    8    HE2  MET  68           HE2      MET  68   4.053 -26.189  -3.601
    9    HE1  MET  68           HE3      MET  68   4.989 -26.964  -4.877

  No H/Q in entry =           9
  In of MODEL   23
    1    H    LYS  69           H        LYS  69   0.432 -23.660  -7.300
    2    HA   LYS  69           HA       LYS  69   1.310 -21.322  -6.323
    3    HB2  LYS  69           HB2      LYS  69  -1.336 -21.825  -7.649
    4    HB3  LYS  69           HB3      LYS  69  -0.680 -20.210  -7.355
    5    HG2  LYS  69           HG2      LYS  69   1.351 -20.783  -8.605
    6    HG3  LYS  69           HG3      LYS  69   0.735 -22.413  -8.881
    7    HD2  LYS  69           HD2      LYS  69  -1.176 -21.489 -10.129
    8    HD3  LYS  69           HD3      LYS  69  -0.574 -19.854  -9.846
    9    HE2  LYS  69           HE2      LYS  69   1.501 -20.397 -11.057
   10    HE3  LYS  69           HE3      LYS  69   0.918 -22.039 -11.328
   11    HZ2  LYS  69           HZ1      LYS  69   0.571 -20.150 -13.097
   12    HZ1  LYS  69           HZ2      LYS  69  -0.801 -19.823 -12.151
   13    HZ3  LYS  69           HZ3      LYS  69  -0.596 -21.356 -12.854

  No H/Q in entry =          13
  In of MODEL   23
    1    H    VAL  70           H        VAL  70  -0.307 -19.415  -5.614
    2    HA   VAL  70           HA       VAL  70  -1.606 -20.235  -3.077
    3    HB   VAL  70           HB       VAL  70  -0.732 -18.135  -2.077
    4   HG13  VAL  70          HG11      VAL  70   0.584 -20.016  -1.550
    5   HG12  VAL  70          HG12      VAL  70   1.758 -18.855  -2.171
    6   HG11  VAL  70          HG13      VAL  70   1.186 -20.169  -3.200
    7   HG22  VAL  70          HG21      VAL  70  -0.379 -16.647  -3.887
    8   HG21  VAL  70          HG22      VAL  70   0.493 -17.857  -4.824
    9   HG23  VAL  70          HG23      VAL  70   1.264 -17.102  -3.433

  No H/Q in entry =           9
  In of MODEL   23
    1    H    SER  71           H        SER  71  -3.075 -18.508  -2.254
    2    HA   SER  71           HA       SER  71  -5.044 -17.798  -4.153
    3    HB2  SER  71           HB2      SER  71  -5.433 -18.059  -1.671
    4    HB3  SER  71           HB3      SER  71  -4.585 -16.536  -1.426
    5    HG   SER  71           HG       SER  71  -7.030 -17.041  -2.744

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU  72           H        LEU  72  -5.185 -16.161  -5.485
    2    HA   LEU  72           HA       LEU  72  -3.066 -14.360  -5.963
    3    HB2  LEU  72           HB2      LEU  72  -5.929 -14.402  -6.912
    4    HB3  LEU  72           HB3      LEU  72  -4.730 -13.244  -7.482
    5    HG   LEU  72           HG       LEU  72  -4.331 -16.251  -7.626
    6   HD11  LEU  72          HD11      LEU  72  -5.303 -14.327  -9.763
    7   HD13  LEU  72          HD12      LEU  72  -6.269 -15.587  -8.994
    8   HD12  LEU  72          HD13      LEU  72  -4.904 -16.026 -10.021
    9   HD22  LEU  72          HD21      LEU  72  -2.208 -15.287  -7.870
   10   HD21  LEU  72          HD22      LEU  72  -2.830 -13.837  -8.641
   11   HD23  LEU  72          HD23      LEU  72  -2.759 -15.348  -9.541

  No H/Q in entry =          11
  In of MODEL   23
    1    H    VAL  73           H        VAL  73  -6.159 -13.988  -4.336
    2    HA   VAL  73           HA       VAL  73  -6.189 -11.217  -3.981
    3    HB   VAL  73           HB       VAL  73  -7.908 -11.568  -2.399
    4   HG11  VAL  73          HG11      VAL  73  -8.376 -12.316  -4.739
    5   HG13  VAL  73          HG12      VAL  73  -9.343 -13.167  -3.536
    6   HG12  VAL  73          HG13      VAL  73  -7.945 -13.959  -4.264
    7   HG21  VAL  73          HG21      VAL  73  -6.469 -14.161  -1.944
    8   HG23  VAL  73          HG22      VAL  73  -8.200 -14.082  -1.619
    9   HG22  VAL  73          HG23      VAL  73  -7.093 -13.010  -0.762

  No H/Q in entry =           9
  In of MODEL   23
    1    H    LEU  74           H        LEU  74  -4.266 -13.598  -2.399
    2    HA   LEU  74           HA       LEU  74  -3.850 -12.463   0.126
    3    HB2  LEU  74           HB2      LEU  74  -3.078 -14.684  -0.371
    4    HB3  LEU  74           HB3      LEU  74  -2.023 -14.079  -1.648
    5    HG   LEU  74           HG       LEU  74  -0.707 -12.831   0.032
    6   HD13  LEU  74          HD11      LEU  74  -2.246 -12.330   1.763
    7   HD12  LEU  74          HD12      LEU  74  -1.193 -13.556   2.473
    8   HD11  LEU  74          HD13      LEU  74  -2.791 -14.003   1.875
    9   HD22  LEU  74          HD21      LEU  74   0.504 -14.680   0.643
   10   HD21  LEU  74          HD22      LEU  74  -0.546 -15.387  -0.566
   11   HD23  LEU  74          HD23      LEU  74  -0.927 -15.588   1.129

  No H/Q in entry =          11
  In of MODEL   23
    1    H    VAL  75           H        VAL  75  -1.955 -12.076  -2.829
    2    HA   VAL  75           HA       VAL  75  -0.147 -10.163  -1.814
    3    HB   VAL  75           HB       VAL  75  -1.103 -10.638  -4.639
    4   HG12  VAL  75          HG11      VAL  75   0.971  -9.341  -5.253
    5   HG11  VAL  75          HG12      VAL  75   1.168  -8.935  -3.555
    6   HG13  VAL  75          HG13      VAL  75  -0.234  -8.352  -4.437
    7   HG22  VAL  75          HG21      VAL  75   0.923 -11.917  -4.854
    8   HG21  VAL  75          HG22      VAL  75   0.146 -12.465  -3.369
    9   HG23  VAL  75          HG23      VAL  75   1.518 -11.358  -3.290

  No H/Q in entry =           9
  In of MODEL   23
    1    H    GLU  76           H        GLU  76  -3.295  -9.796  -3.474
    2    HA   GLU  76           HA       GLU  76  -3.331  -6.981  -3.571
    3    HB2  GLU  76           HB2      GLU  76  -4.997  -8.399  -4.741
    4    HB3  GLU  76           HB3      GLU  76  -5.649  -8.912  -3.192
    5    HG2  GLU  76           HG2      GLU  76  -7.103  -7.190  -4.044
    6    HG3  GLU  76           HG3      GLU  76  -6.213  -6.485  -2.709

  No H/Q in entry =           6
  In of MODEL   23
    1    H    ALA  77           H        ALA  77  -4.456  -9.206  -1.036
    2    HA   ALA  77           HA       ALA  77  -5.402  -7.202   0.725
    3    HB2  ALA  77           HB1      ALA  77  -5.948  -9.618   0.935
    4    HB3  ALA  77           HB2      ALA  77  -5.347  -8.927   2.440
    5    HB1  ALA  77           HB3      ALA  77  -4.289  -9.925   1.445

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLN  78           H        GLN  78  -2.264  -8.768   0.361
    2    HA   GLN  78           HA       GLN  78  -1.001  -7.619   2.613
    3    HB2  GLN  78           HB2      GLN  78  -0.147  -9.562   1.262
    4    HB3  GLN  78           HB3      GLN  78   0.289  -8.422  -0.009
    5    HG2  GLN  78           HG2      GLN  78   1.758  -7.226   1.564
    6    HG3  GLN  78           HG3      GLN  78   1.327  -8.365   2.837
    7   HE21  GLN  78          HE21      GLN  78   3.249  -9.571   3.108
    8   HE22  GLN  78          HE22      GLN  78   4.046 -10.376   1.844

  No H/Q in entry =           8
  In of MODEL   23
    1    H    LEU  79           H        LEU  79  -1.358  -6.551  -0.732
    2    HA   LEU  79           HA       LEU  79   0.342  -4.334  -0.714
    3    HB2  LEU  79           HB2      LEU  79  -0.689  -5.132  -2.770
    4    HB3  LEU  79           HB3      LEU  79  -2.290  -4.731  -2.162
    5    HG   LEU  79           HG       LEU  79  -1.731  -2.347  -2.133
    6   HD13  LEU  79          HD11      LEU  79   0.510  -2.119  -1.618
    7   HD12  LEU  79          HD12      LEU  79   0.563  -1.829  -3.357
    8   HD11  LEU  79          HD13      LEU  79   1.006  -3.411  -2.712
    9   HD23  LEU  79          HD21      LEU  79  -1.094  -2.149  -4.684
   10   HD22  LEU  79          HD22      LEU  79  -2.625  -2.887  -4.227
   11   HD21  LEU  79          HD23      LEU  79  -1.259  -3.904  -4.672

  No H/Q in entry =          11
  In of MODEL   23
    1    H    HIS  80           H        HIS  80  -3.127  -4.475   0.109
    2    HA   HIS  80           HA       HIS  80  -3.300  -1.719   0.777
    3    HB2  HIS  80           HB2      HIS  80  -5.018  -4.116   1.091
    4    HB3  HIS  80           HB3      HIS  80  -5.330  -2.776   2.197
    5    HD1  HIS  80           HD1      HIS  80  -6.936  -1.127   1.290
    6    HD2  HIS  80           HD2      HIS  80  -4.753  -2.949  -1.759
    7    HE1  HIS  80           HE1      HIS  80  -7.768  -0.121  -0.888
    8    HE2  HIS  80           HE2      HIS  80  -6.443  -1.226  -2.756

  No H/Q in entry =           8
  In of MODEL   23
    1    H    LEU  81           H        LEU  81  -2.833  -4.620   2.766
    2    HA   LEU  81           HA       LEU  81  -2.813  -3.276   5.252
    3    HB2  LEU  81           HB2      LEU  81  -1.612  -5.900   4.369
    4    HB3  LEU  81           HB3      LEU  81  -1.583  -5.344   6.044
    5    HG   LEU  81           HG       LEU  81  -4.129  -5.576   4.414
    6   HD12  LEU  81          HD11      LEU  81  -4.448  -7.641   5.958
    7   HD11  LEU  81          HD12      LEU  81  -2.695  -7.583   6.146
    8   HD13  LEU  81          HD13      LEU  81  -3.404  -7.806   4.546
    9   HD23  LEU  81          HD21      LEU  81  -4.976  -5.776   6.914
   10   HD22  LEU  81          HD22      LEU  81  -4.639  -4.189   6.227
   11   HD21  LEU  81          HD23      LEU  81  -3.458  -4.959   7.287

  No H/Q in entry =          11
  In of MODEL   23
    1    H    MET  82           H        MET  82  -0.137  -4.196   3.082
    2    HA   MET  82           HA       MET  82   1.952  -3.319   4.768
    3    HB2  MET  82           HB2      MET  82   1.736  -3.655   1.775
    4    HB3  MET  82           HB3      MET  82   3.222  -3.096   2.541
    5    HG2  MET  82           HG2      MET  82   1.795  -5.676   3.260
    6    HG3  MET  82           HG3      MET  82   3.168  -5.575   2.161
    7    HE3  MET  82           HE1      MET  82   6.188  -4.865   4.148
    8    HE2  MET  82           HE2      MET  82   5.276  -3.490   3.531
    9    HE1  MET  82           HE3      MET  82   5.354  -4.979   2.593

  No H/Q in entry =           9
  In of MODEL   23
    1    H    THR  83           H        THR  83   0.144  -1.660   2.213
    2    HA   THR  83           HA       THR  83   1.575   0.777   2.304
    3    HB   THR  83           HB       THR  83  -0.594   1.720   1.317
    4    HG1  THR  83           HG1      THR  83  -2.254   0.436   1.208
    5   HG22  THR  83          HG21      THR  83  -0.336  -0.097  -0.686
    6   HG21  THR  83          HG22      THR  83   1.161  -0.402   0.192
    7   HG23  THR  83          HG23      THR  83   0.813   1.215  -0.421

  No H/Q in entry =           7
  In of MODEL   23
    1    H    SER  84           H        SER  84  -1.440  -0.234   3.902
    2    HA   SER  84           HA       SER  84  -1.918   2.198   5.249
    3    HB2  SER  84           HB2      SER  84  -2.774  -0.634   5.809
    4    HB3  SER  84           HB3      SER  84  -3.257   0.709   6.844
    5    HG   SER  84           HG       SER  84  -3.717   0.403   4.051

  No H/Q in entry =           5
  In of MODEL   23
    1    H    MET  85           H        MET  85  -0.232  -0.749   6.376
    2    HA   MET  85           HA       MET  85   0.293   0.170   8.981
    3    HB2  MET  85           HB2      MET  85   0.567  -2.175   8.296
    4    HB3  MET  85           HB3      MET  85   1.957  -1.719   7.311
    5    HG2  MET  85           HG2      MET  85   3.118  -0.888   9.327
    6    HG3  MET  85           HG3      MET  85   1.726  -1.337  10.311
    7    HE2  MET  85           HE1      MET  85   0.768  -3.869  10.400
    8    HE1  MET  85           HE2      MET  85   1.802  -3.243  11.684
    9    HE3  MET  85           HE3      MET  85   2.036  -4.885  11.094

  No H/Q in entry =           9
  In of MODEL   23
    1    H    LEU  86           H        LEU  86   2.232   0.414   6.032
    2    HA   LEU  86           HA       LEU  86   4.456   1.705   7.190
    3    HB2  LEU  86           HB2      LEU  86   4.257   0.627   4.880
    4    HB3  LEU  86           HB3      LEU  86   3.461   2.115   4.369
    5    HG   LEU  86           HG       LEU  86   5.499   3.344   5.352
    6   HD11  LEU  86          HD11      LEU  86   6.182   0.725   6.148
    7   HD13  LEU  86          HD12      LEU  86   7.198   2.162   6.248
    8   HD12  LEU  86          HD13      LEU  86   7.299   1.114   4.835
    9   HD23  LEU  86          HD21      LEU  86   6.202   1.578   2.999
   10   HD22  LEU  86          HD22      LEU  86   6.610   3.271   3.264
   11   HD21  LEU  86          HD23      LEU  86   4.953   2.817   2.864

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ALA  87           H        ALA  87   1.555   2.974   5.606
    2    HA   ALA  87           HA       ALA  87   2.172   5.699   5.693
    3    HB1  ALA  87           HB1      ALA  87  -0.151   4.091   5.149
    4    HB3  ALA  87           HB2      ALA  87   0.174   5.750   4.651
    5    HB2  ALA  87           HB3      ALA  87  -0.623   5.433   6.193

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ARG  88           H        ARG  88   0.464   3.709   8.080
    2    HA   ARG  88           HA       ARG  88  -0.032   5.760   9.929
    3    HB2  ARG  88           HB2      ARG  88  -0.990   3.416   9.992
    4    HB3  ARG  88           HB3      ARG  88   0.547   2.902  10.698
    5    HG2  ARG  88           HG2      ARG  88   0.087   4.978  12.320
    6    HG3  ARG  88           HG3      ARG  88  -1.583   4.668  11.863
    7    HD2  ARG  88           HD2      ARG  88  -1.706   2.818  13.107
    8    HD3  ARG  88           HD3      ARG  88  -0.121   2.224  12.576
    9    HE   ARG  88           HE       ARG  88  -0.645   3.489  15.032
   10   HH21  ARG  88          HH11      ARG  88   0.920   4.487  16.272
   11   HH22  ARG  88          HH12      ARG  88   2.443   4.902  15.568
   12   HH11  ARG  88          HH21      ARG  88   1.638   3.654  12.456
   13   HH12  ARG  88          HH22      ARG  88   2.858   4.414  13.420

  No H/Q in entry =          13
  In of MODEL   23
    1    H    GLU  89           H        GLU  89   2.747   3.519   9.704
    2    HA   GLU  89           HA       GLU  89   4.014   4.395  12.050
    3    HB2  GLU  89           HB2      GLU  89   4.657   2.373  10.704
    4    HB3  GLU  89           HB3      GLU  89   5.442   3.462   9.559
    5    HG2  GLU  89           HG2      GLU  89   6.933   4.295  11.305
    6    HG3  GLU  89           HG3      GLU  89   6.090   3.344  12.523

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LEU  90           H        LEU  90   4.342   5.554   8.723
    2    HA   LEU  90           HA       LEU  90   6.288   7.538   9.312
    3    HB2  LEU  90           HB2      LEU  90   4.280   7.225   7.083
    4    HB3  LEU  90           HB3      LEU  90   5.521   8.486   7.106
    5    HG   LEU  90           HG       LEU  90   6.172   5.544   7.437
    6   HD12  LEU  90          HD11      LEU  90   6.923   5.774   4.998
    7   HD11  LEU  90          HD12      LEU  90   5.919   7.222   4.951
    8   HD13  LEU  90          HD13      LEU  90   5.187   5.654   5.292
    9   HD22  LEU  90          HD21      LEU  90   8.077   6.678   8.122
   10   HD21  LEU  90          HD22      LEU  90   7.739   8.087   7.116
   11   HD23  LEU  90          HD23      LEU  90   8.387   6.618   6.388

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  91           H        ILE  91   2.749   7.581   9.161
    2    HA   ILE  91           HA       ILE  91   2.427  10.355   9.614
    3    HB   ILE  91           HB       ILE  91   0.618   7.992  10.153
    4   HG12  ILE  91          HG12      ILE  91   0.388  10.277   8.171
    5   HG13  ILE  91          HG13      ILE  91   1.237   8.777   7.798
    6   HG22  ILE  91          HG21      ILE  91  -1.099  10.063  10.218
    7   HG21  ILE  91          HG22      ILE  91   0.308  10.882  10.892
    8   HG23  ILE  91          HG23      ILE  91  -0.340   9.449  11.687
    9   HD13  ILE  91          HD11      ILE  91  -0.716   7.504   7.840
   10   HD12  ILE  91          HD12      ILE  91  -1.294   9.023   7.159
   11   HD11  ILE  91          HD13      ILE  91  -1.569   8.660   8.863

  No H/Q in entry =          11
  In of MODEL   23
    1    H    THR  92           H        THR  92   2.809   7.609  11.813
    2    HA   THR  92           HA       THR  92   2.374   8.983  14.238
    3    HB   THR  92           HB       THR  92   4.167   6.637  13.572
    4    HG1  THR  92           HG1      THR  92   2.193   5.893  13.470
    5   HG22  THR  92          HG21      THR  92   3.780   6.353  16.206
    6   HG21  THR  92          HG22      THR  92   3.727   8.113  16.134
    7   HG23  THR  92          HG23      THR  92   5.155   7.248  15.561

  No H/Q in entry =           7
  In of MODEL   23
    1    H    GLU  93           H        GLU  93   5.323   8.516  12.306
    2    HA   GLU  93           HA       GLU  93   7.085   9.931  14.006
    3    HB2  GLU  93           HB2      GLU  93   7.174   9.618  10.990
    4    HB3  GLU  93           HB3      GLU  93   8.517  10.138  12.006
    5    HG2  GLU  93           HG2      GLU  93   7.090   7.510  12.451
    6    HG3  GLU  93           HG3      GLU  93   8.475   7.654  11.376

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LEU  94           H        LEU  94   5.045  10.960  11.292
    2    HA   LEU  94           HA       LEU  94   5.867  13.659  11.194
    3    HB2  LEU  94           HB2      LEU  94   3.269  12.311  10.437
    4    HB3  LEU  94           HB3      LEU  94   3.538  14.037  10.197
    5    HG   LEU  94           HG       LEU  94   5.544  12.037   9.147
    6   HD11  LEU  94          HD11      LEU  94   2.807  12.605   8.083
    7   HD13  LEU  94          HD12      LEU  94   3.781  11.143   7.957
    8   HD12  LEU  94          HD13      LEU  94   4.125  12.522   6.914
    9   HD23  LEU  94          HD21      LEU  94   5.807  13.873   7.426
   10   HD22  LEU  94          HD22      LEU  94   6.223  14.362   9.069
   11   HD21  LEU  94          HD23      LEU  94   4.676  14.840   8.369

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  95           H        ILE  95   3.318  12.056  13.082
    2    HA   ILE  95           HA       ILE  95   2.288  14.411  14.278
    3    HB   ILE  95           HB       ILE  95   2.287  11.529  15.201
    4   HG12  ILE  95          HG12      ILE  95   0.078  13.316  14.150
    5   HG13  ILE  95          HG13      ILE  95   1.029  12.252  13.118
    6   HG21  ILE  95          HG21      ILE  95   1.018  14.008  16.402
    7   HG23  ILE  95          HG22      ILE  95   2.059  12.833  17.207
    8   HG22  ILE  95          HG23      ILE  95   0.422  12.381  16.730
    9   HD13  ILE  95          HD11      ILE  95   0.115  10.318  14.036
   10   HD12  ILE  95          HD12      ILE  95  -1.262  11.414  14.111
   11   HD11  ILE  95          HD13      ILE  95  -0.299  11.110  15.557

  No H/Q in entry =          11
  In of MODEL   23
    1    H    GLU  96           H        GLU  96   4.870  12.178  15.274
    2    HA   GLU  96           HA       GLU  96   5.429  13.372  17.767
    3    HB2  GLU  96           HB2      GLU  96   6.366  11.208  17.120
    4    HB3  GLU  96           HB3      GLU  96   7.304  11.977  15.841
    5    HG2  GLU  96           HG2      GLU  96   8.954  12.516  17.306
    6    HG3  GLU  96           HG3      GLU  96   7.811  13.335  18.360

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LEU  97           H        LEU  97   6.510  14.140  14.483
    2    HA   LEU  97           HA       LEU  97   8.406  16.127  15.198
    3    HB2  LEU  97           HB2      LEU  97   6.814  15.587  12.701
    4    HB3  LEU  97           HB3      LEU  97   7.840  17.013  12.825
    5    HG   LEU  97           HG       LEU  97   8.855  14.210  13.384
    6   HD12  LEU  97          HD11      LEU  97   9.855  14.401  11.068
    7   HD11  LEU  97          HD12      LEU  97   8.811  15.796  10.804
    8   HD13  LEU  97          HD13      LEU  97   8.104  14.208  11.097
    9   HD23  LEU  97          HD21      LEU  97  11.031  15.479  12.644
   10   HD22  LEU  97          HD22      LEU  97  10.412  15.751  14.273
   11   HD21  LEU  97          HD23      LEU  97  10.105  16.936  13.005

  No H/Q in entry =          11
  In of MODEL   23
    1    H    HIS  98           H        HIS  98   4.915  16.279  14.540
    2    HA   HIS  98           HA       HIS  98   4.629  19.080  14.677
    3    HB2  HIS  98           HB2      HIS  98   2.728  16.838  15.399
    4    HB3  HIS  98           HB3      HIS  98   2.269  18.540  15.456
    5    HD1  HIS  98           HD1      HIS  98   3.280  15.822  13.050
    6    HD2  HIS  98           HD2      HIS  98   1.922  19.761  12.929
    7    HE1  HIS  98           HE1      HIS  98   2.726  16.314  10.626
    8    HE2  HIS  98           HE2      HIS  98   1.902  18.708  10.531

  No H/Q in entry =           8
  In of MODEL   23
    1    H    GLU  99           H        GLU  99   4.748  16.589  17.174
    2    HA   GLU  99           HA       GLU  99   4.145  18.285  19.373
    3    HB2  GLU  99           HB2      GLU  99   4.045  15.803  19.468
    4    HB3  GLU  99           HB3      GLU  99   5.805  15.751  19.362
    5    HG2  GLU  99           HG2      GLU  99   5.997  17.041  21.437
    6    HG3  GLU  99           HG3      GLU  99   4.245  17.189  21.531

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LYS 100           H        LYS 100   7.197  17.342  17.811
    2    HA   LYS 100           HA       LYS 100   8.856  18.734  19.670
    3    HB2  LYS 100           HB2      LYS 100   9.354  17.809  16.831
    4    HB3  LYS 100           HB3      LYS 100  10.586  18.572  17.841
    5    HG2  LYS 100           HG2      LYS 100  10.200  16.822  19.581
    6    HG3  LYS 100           HG3      LYS 100   9.065  16.024  18.488
    7    HD2  LYS 100           HD2      LYS 100  10.860  15.734  16.822
    8    HD3  LYS 100           HD3      LYS 100  11.999  16.544  17.900
    9    HE2  LYS 100           HE2      LYS 100  11.593  14.790  19.617
   10    HE3  LYS 100           HE3      LYS 100  10.516  13.959  18.490
   11    HZ1  LYS 100           HZ1      LYS 100  13.340  14.617  17.838
   12    HZ3  LYS 100           HZ2      LYS 100  12.292  13.567  17.008
   13    HZ2  LYS 100           HZ3      LYS 100  12.877  13.144  18.547

  No H/Q in entry =          13
  In of MODEL   23
    1    H    LEU 101           H        LEU 101   7.170  19.670  16.713
    2    HA   LEU 101           HA       LEU 101   8.396  22.222  16.381
    3    HB2  LEU 101           HB2      LEU 101   5.796  21.001  15.491
    4    HB3  LEU 101           HB3      LEU 101   6.055  22.731  15.285
    5    HG   LEU 101           HG       LEU 101   8.083  20.705  14.320
    6   HD12  LEU 101          HD11      LEU 101   6.934  21.218  12.034
    7   HD11  LEU 101          HD12      LEU 101   5.536  21.654  13.013
    8   HD13  LEU 101          HD13      LEU 101   6.192  20.020  13.095
    9   HD21  LEU 101          HD21      LEU 101   7.469  23.621  13.766
   10   HD23  LEU 101          HD22      LEU 101   8.446  22.657  12.659
   11   HD22  LEU 101          HD23      LEU 101   8.987  22.911  14.318

  No H/Q in entry =          11
  In of MODEL   23
    1    H    LYS 102           H        LYS 102   6.851  21.089  18.994
    2    HA   LYS 102           HA       LYS 102   6.221  22.182  20.927
    3    HB2  LYS 102           HB2      LYS 102   7.515  24.167  19.805
    4    HB3  LYS 102           HB3      LYS 102   5.919  24.780  19.428
    5    HG2  LYS 102           HG2      LYS 102   7.292  24.516  22.081
    6    HG3  LYS 102           HG3      LYS 102   6.346  25.849  21.453
    7    HD2  LYS 102           HD2      LYS 102   5.089  23.218  22.328
    8    HD3  LYS 102           HD3      LYS 102   5.343  24.577  23.413
    9    HE2  LYS 102           HE2      LYS 102   3.063  24.186  21.921
   10    HE3  LYS 102           HE3      LYS 102   3.573  25.729  22.605
   11    HZ2  LYS 102           HZ1      LYS 102   3.045  25.841  20.225
   12    HZ1  LYS 102           HZ2      LYS 102   4.302  24.754  19.902
   13    HZ3  LYS 102           HZ3      LYS 102   4.652  26.282  20.547

  No H/Q in entry =          13
  In of MODEL   23
    1    H    ALA 103           H        ALA 103   4.594  23.735  18.159
    2    HA   ALA 103           HA       ALA 103   2.141  24.323  19.042
    3    HB1  ALA 103           HB1      ALA 103   1.241  23.487  16.798
    4    HB2  ALA 103           HB2      ALA 103   2.886  22.943  16.469
    5    HB3  ALA 103           HB3      ALA 103   2.560  24.656  16.737

  No H/Q in entry =           5
  In of MODEL   23
    1    H1   ALA   1           H3       ALA   1  10.545 -20.199  -6.259
    2    H2   ALA   1           H2       ALA   1   9.581 -20.399  -7.646
    3    H3   ALA   1           H1       ALA   1   9.138 -21.144  -6.184
    4    HA   ALA   1           HA       ALA   1  10.168 -22.958  -6.924
    5    HB1  ALA   1           HB1      ALA   1  10.268 -22.597  -9.200
    6    HB2  ALA   1           HB2      ALA   1  11.995 -22.457  -8.869
    7    HB3  ALA   1           HB3      ALA   1  11.005 -21.004  -9.020

  No H/Q in entry =           7
  In of MODEL   23
    1    H    GLU   2           H        GLU   2  12.447 -23.921  -6.981
    2    HA   GLU   2           HA       GLU   2  13.827 -23.849  -4.768
    3    HB2  GLU   2           HB2      GLU   2  15.186 -23.723  -7.466
    4    HB3  GLU   2           HB3      GLU   2  15.909 -24.340  -5.981
    5    HG2  GLU   2           HG2      GLU   2  14.881 -26.350  -6.225
    6    HG3  GLU   2           HG3      GLU   2  13.315 -25.596  -6.484

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLU   3           H        GLU   3  15.610 -21.993  -7.167
    2    HA   GLU   3           HA       GLU   3  16.772 -20.314  -5.205
    3    HB2  GLU   3           HB2      GLU   3  16.718 -20.309  -8.215
    4    HB3  GLU   3           HB3      GLU   3  17.471 -18.985  -7.326
    5    HG2  GLU   3           HG2      GLU   3  19.125 -20.370  -6.403
    6    HG3  GLU   3           HG3      GLU   3  18.170 -21.831  -6.626

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LEU   4           H        LEU   4  14.497 -19.451  -7.836
    2    HA   LEU   4           HA       LEU   4  14.045 -16.840  -7.223
    3    HB2  LEU   4           HB2      LEU   4  11.859 -18.801  -7.956
    4    HB3  LEU   4           HB3      LEU   4  11.794 -17.051  -8.154
    5    HG   LEU   4           HG       LEU   4  13.749 -18.925  -9.527
    6   HD13  LEU   4          HD11      LEU   4  12.449 -18.767 -11.438
    7   HD12  LEU   4          HD12      LEU   4  11.750 -17.218 -10.969
    8   HD11  LEU   4          HD13      LEU   4  11.187 -18.706 -10.210
    9   HD23  LEU   4          HD21      LEU   4  14.099 -16.680 -10.876
   10   HD22  LEU   4          HD22      LEU   4  14.957 -16.929  -9.356
   11   HD21  LEU   4          HD23      LEU   4  13.510 -15.924  -9.396

  No H/Q in entry =          11
  In of MODEL   23
    1    H    GLU   5           H        GLU   5  12.543 -19.616  -5.584
    2    HA   GLU   5           HA       GLU   5  10.874 -18.036  -3.881
    3    HB2  GLU   5           HB2      GLU   5  10.428 -20.409  -4.401
    4    HB3  GLU   5           HB3      GLU   5  11.866 -20.858  -3.481
    5    HG2  GLU   5           HG2      GLU   5  10.918 -19.830  -1.463
    6    HG3  GLU   5           HG3      GLU   5   9.491 -19.337  -2.375

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLU   6           H        GLU   6  14.010 -19.635  -3.438
    2    HA   GLU   6           HA       GLU   6  14.366 -18.783  -0.739
    3    HB2  GLU   6           HB2      GLU   6  16.314 -19.738  -2.849
    4    HB3  GLU   6           HB3      GLU   6  16.777 -19.384  -1.183
    5    HG2  GLU   6           HG2      GLU   6  15.198 -21.057  -0.355
    6    HG3  GLU   6           HG3      GLU   6  14.637 -21.373  -1.996

  No H/Q in entry =           6
  In of MODEL   23
    1    H    VAL   7           H        VAL   7  15.142 -17.458  -3.887
    2    HA   VAL   7           HA       VAL   7  16.839 -15.341  -3.019
    3    HB   VAL   7           HB       VAL   7  15.133 -15.693  -5.498
    4   HG11  VAL   7          HG11      VAL   7  17.037 -13.491  -4.682
    5   HG13  VAL   7          HG12      VAL   7  15.396 -13.339  -5.307
    6   HG12  VAL   7          HG13      VAL   7  16.703 -13.848  -6.376
    7   HG21  VAL   7          HG21      VAL   7  17.231 -17.162  -4.929
    8   HG23  VAL   7          HG22      VAL   7  18.144 -15.705  -5.325
    9   HG22  VAL   7          HG23      VAL   7  17.105 -16.448  -6.538

  No H/Q in entry =           9
  In of MODEL   23
    1    H    VAL   8           H        VAL   8  13.345 -15.592  -3.578
    2    HA   VAL   8           HA       VAL   8  12.694 -12.880  -3.104
    3    HB   VAL   8           HB       VAL   8  11.071 -15.403  -2.679
    4   HG12  VAL   8          HG11      VAL   8   9.145 -13.669  -2.854
    5   HG11  VAL   8          HG12      VAL   8  10.371 -12.478  -2.423
    6   HG13  VAL   8          HG13      VAL   8  10.001 -13.800  -1.319
    7   HG23  VAL   8          HG21      VAL   8  10.402 -13.483  -4.850
    8   HG22  VAL   8          HG22      VAL   8  10.476 -15.243  -4.889
    9   HG21  VAL   8          HG23      VAL   8  11.953 -14.298  -5.048

  No H/Q in entry =           9
  In of MODEL   23
    1    H    MET   9           H        MET   9  12.945 -15.690  -0.927
    2    HA   MET   9           HA       MET   9  12.134 -14.416   1.444
    3    HB2  MET   9           HB2      MET   9  14.026 -16.702   0.901
    4    HB3  MET   9           HB3      MET   9  13.735 -16.119   2.539
    5    HG2  MET   9           HG2      MET   9  11.321 -16.507   2.265
    6    HG3  MET   9           HG3      MET   9  11.593 -17.061   0.611
    7    HE1  MET   9           HE1      MET   9  12.488 -17.206   4.114
    8    HE3  MET   9           HE2      MET   9  13.925 -18.216   3.980
    9    HE2  MET   9           HE3      MET   9  12.428 -18.904   4.603

  No H/Q in entry =           9
  In of MODEL   23
    1    H    GLY  10           H        GLY  10  15.315 -14.654  -0.111
    2    HA3  GLY  10           HA2      GLY  10  16.779 -13.242   1.862
    3    HA2  GLY  10           HA3      GLY  10  17.243 -13.408   0.168

  No H/Q in entry =           3
  In of MODEL   23
    1    H    LEU  11           H        LEU  11  15.081 -12.176  -1.072
    2    HA   LEU  11           HA       LEU  11  15.778  -9.434  -0.905
    3    HB2  LEU  11           HB2      LEU  11  13.405 -10.832  -2.143
    4    HB3  LEU  11           HB3      LEU  11  13.693  -9.099  -2.301
    5    HG   LEU  11           HG       LEU  11  15.712 -11.216  -3.089
    6   HD13  LEU  11          HD11      LEU  11  13.966 -11.574  -4.611
    7   HD12  LEU  11          HD12      LEU  11  14.974 -10.396  -5.450
    8   HD11  LEU  11          HD13      LEU  11  13.502  -9.872  -4.632
    9   HD22  LEU  11          HD21      LEU  11  16.952  -9.258  -2.861
   10   HD21  LEU  11          HD22      LEU  11  15.581  -8.215  -3.240
   11   HD23  LEU  11          HD23      LEU  11  16.410  -9.086  -4.529

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  12           H        ILE  12  13.001 -11.250   0.358
    2    HA   ILE  12           HA       ILE  12  11.616  -9.021   1.419
    3    HB   ILE  12           HB       ILE  12  11.640 -11.904   2.368
    4   HG12  ILE  12          HG12      ILE  12  10.962 -11.275  -0.081
    5   HG13  ILE  12          HG13      ILE  12   9.924 -12.353   0.831
    6   HG22  ILE  12          HG21      ILE  12   9.350 -11.303   3.267
    7   HG21  ILE  12          HG22      ILE  12   9.730  -9.613   2.936
    8   HG23  ILE  12          HG23      ILE  12  10.692 -10.521   4.103
    9   HD11  ILE  12          HD11      ILE  12   9.524  -9.360   0.594
   10   HD13  ILE  12          HD12      ILE  12   8.418 -10.518   1.331
   11   HD12  ILE  12          HD13      ILE  12   8.699 -10.552  -0.396

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  13           H        ILE  13  13.999 -11.236   2.825
    2    HA   ILE  13           HA       ILE  13  14.037 -10.059   5.406
    3    HB   ILE  13           HB       ILE  13  16.091 -11.638   3.839
    4   HG12  ILE  13          HG12      ILE  13  13.818 -12.604   4.671
    5   HG13  ILE  13          HG13      ILE  13  15.291 -13.524   4.964
    6   HG21  ILE  13          HG21      ILE  13  16.238 -10.471   6.610
    7   HG23  ILE  13          HG22      ILE  13  17.486 -10.531   5.373
    8   HG22  ILE  13          HG23      ILE  13  17.056 -11.992   6.261
    9   HD13  ILE  13          HD11      ILE  13  15.232 -13.138   7.252
   10   HD12  ILE  13          HD12      ILE  13  13.511 -13.025   6.907
   11   HD11  ILE  13          HD13      ILE  13  14.472 -11.560   7.058

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ASN  14           H        ASN  14  15.995  -9.532   2.490
    2    HA   ASN  14           HA       ASN  14  17.743  -7.595   3.554
    3    HB2  ASN  14           HB2      ASN  14  17.719  -8.860   1.238
    4    HB3  ASN  14           HB3      ASN  14  16.830  -7.440   0.701
    5   HD21  ASN  14          HD21      ASN  14  19.271  -7.784  -0.483
    6   HD22  ASN  14          HD22      ASN  14  20.416  -6.704   0.146

  No H/Q in entry =           6
  In of MODEL   23
    1    H    SER  15           H        SER  15  14.635  -7.240   1.860
    2    HA   SER  15           HA       SER  15  14.528  -4.419   1.918
    3    HB2  SER  15           HB2      SER  15  12.198  -4.660   1.417
    4    HB3  SER  15           HB3      SER  15  12.991  -6.031   0.651
    5    HG   SER  15           HG       SER  15  12.526  -6.991   2.907

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLY  16           H        GLY  16  13.428  -6.879   4.219
    2    HA3  GLY  16           HA2      GLY  16  12.208  -5.129   6.076
    3    HA2  GLY  16           HA3      GLY  16  12.820  -6.739   6.438

  No H/Q in entry =           3
  In of MODEL   23
    1    H    GLN  17           H        GLN  17  15.532  -6.410   5.848
    2    HA   GLN  17           HA       GLN  17  16.488  -5.193   8.231
    3    HB2  GLN  17           HB2      GLN  17  17.913  -6.037   5.694
    4    HB3  GLN  17           HB3      GLN  17  18.754  -5.450   7.128
    5    HG2  GLN  17           HG2      GLN  17  16.855  -7.811   7.099
    6    HG3  GLN  17           HG3      GLN  17  18.612  -7.942   7.047
    7   HE21  GLN  17          HE21      GLN  17  16.189  -8.310   9.195
    8   HE22  GLN  17          HE22      GLN  17  16.941  -7.749  10.610

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ALA  18           H        ALA  18  16.305  -4.112   4.872
    2    HA   ALA  18           HA       ALA  18  17.744  -1.721   5.102
    3    HB1  ALA  18           HB1      ALA  18  16.626  -2.933   3.032
    4    HB3  ALA  18           HB2      ALA  18  16.893  -1.190   3.019
    5    HB2  ALA  18           HB3      ALA  18  15.293  -1.834   3.386

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ARG  19           H        ARG  19  14.243  -2.305   5.495
    2    HA   ARG  19           HA       ARG  19  13.577   0.345   6.211
    3    HB2  ARG  19           HB2      ARG  19  11.895  -1.403   5.621
    4    HB3  ARG  19           HB3      ARG  19  12.234  -2.203   7.158
    5    HG2  ARG  19           HG2      ARG  19  11.524  -0.212   8.398
    6    HG3  ARG  19           HG3      ARG  19  11.277   0.666   6.890
    7    HD2  ARG  19           HD2      ARG  19   9.134  -0.129   7.707
    8    HD3  ARG  19           HD3      ARG  19   9.553  -1.007   6.230
    9    HE   ARG  19           HE       ARG  19  10.507  -2.553   8.335
   10   HH21  ARG  19          HH11      ARG  19   9.255  -4.192   9.271
   11   HH22  ARG  19          HH12      ARG  19   7.536  -4.162   9.099
   12   HH11  ARG  19          HH21      ARG  19   7.516  -1.255   7.238
   13   HH12  ARG  19          HH22      ARG  19   6.551  -2.500   7.943

  No H/Q in entry =          13
  In of MODEL   23
    1    H    SER  20           H        SER  20  14.429  -2.488   8.169
    2    HA   SER  20           HA       SER  20  14.144  -1.390  10.707
    3    HB2  SER  20           HB2      SER  20  14.608  -3.715  10.585
    4    HB3  SER  20           HB3      SER  20  16.061  -3.453   9.622
    5    HG   SER  20           HG       SER  20  15.819  -2.318  12.186

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU  21           H        LEU  21  16.990  -1.330   8.574
    2    HA   LEU  21           HA       LEU  21  18.664   0.153  10.316
    3    HB2  LEU  21           HB2      LEU  21  18.645  -0.122   7.303
    4    HB3  LEU  21           HB3      LEU  21  19.897   0.743   8.190
    5    HG   LEU  21           HG       LEU  21  19.165  -2.148   8.735
    6   HD12  LEU  21          HD11      LEU  21  21.375  -2.582   7.523
    7   HD11  LEU  21          HD12      LEU  21  21.251  -0.932   6.913
    8   HD13  LEU  21          HD13      LEU  21  20.012  -2.118   6.504
    9   HD22  LEU  21          HD21      LEU  21  20.328  -1.452  10.633
   10   HD21  LEU  21          HD22      LEU  21  21.264  -0.244   9.761
   11   HD23  LEU  21          HD23      LEU  21  21.680  -1.944   9.618

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ALA  22           H        ALA  22  16.405   1.127   7.758
    2    HA   ALA  22           HA       ALA  22  16.947   3.884   7.775
    3    HB3  ALA  22           HB1      ALA  22  15.545   2.645   6.094
    4    HB2  ALA  22           HB2      ALA  22  14.840   4.158   6.661
    5    HB1  ALA  22           HB3      ALA  22  14.246   2.619   7.286

  No H/Q in entry =           5
  In of MODEL   23
    1    H    TYR  23           H        TYR  23  14.445   2.070   9.605
    2    HA   TYR  23           HA       TYR  23  13.484   4.307  11.055
    3    HB2  TYR  23           HB2      TYR  23  12.246   2.195  11.031
    4    HB3  TYR  23           HB3      TYR  23  13.574   1.382  11.856
    5    HD1  TYR  23           HD1      TYR  23  11.079   4.133  12.222
    6    HD2  TYR  23           HD2      TYR  23  13.765   1.436  14.212
    7    HE1  TYR  23           HE1      TYR  23  10.149   4.826  14.416
    8    HE2  TYR  23           HE2      TYR  23  12.836   2.128  16.404
    9    HH   TYR  23           HH       TYR  23   9.960   3.955  16.687

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ALA  24           H        ALA  24  16.125   2.027  11.694
    2    HA   ALA  24           HA       ALA  24  16.793   3.019  14.259
    3    HB1  ALA  24           HB1      ALA  24  18.147   1.224  14.094
    4    HB3  ALA  24           HB2      ALA  24  19.178   2.144  12.998
    5    HB2  ALA  24           HB3      ALA  24  17.882   1.139  12.354

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA  25           H        ALA  25  17.756   3.949  10.982
    2    HA   ALA  25           HA       ALA  25  19.704   5.879  11.632
    3    HB1  ALA  25           HB1      ALA  25  18.989   4.935   9.315
    4    HB3  ALA  25           HB2      ALA  25  19.494   6.621   9.410
    5    HB2  ALA  25           HB3      ALA  25  17.778   6.217   9.339

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU  26           H        LEU  26  16.190   6.115  11.266
    2    HA   LEU  26           HA       LEU  26  15.971   8.897  11.720
    3    HB2  LEU  26           HB2      LEU  26  14.108   7.666  10.788
    4    HB3  LEU  26           HB3      LEU  26  14.014   6.638  12.212
    5    HG   LEU  26           HG       LEU  26  13.410   8.595  13.594
    6   HD12  LEU  26          HD11      LEU  26  12.755  10.699  12.269
    7   HD11  LEU  26          HD12      LEU  26  13.736  10.045  10.961
    8   HD13  LEU  26          HD13      LEU  26  14.480  10.427  12.514
    9   HD21  LEU  26          HD21      LEU  26  11.737   8.288  11.081
   10   HD23  LEU  26          HD22      LEU  26  11.176   8.986  12.598
   11   HD22  LEU  26          HD23      LEU  26  11.624   7.284  12.527

  No H/Q in entry =          11
  In of MODEL   23
    1    H    LYS  27           H        LYS  27  15.854   6.116  13.910
    2    HA   LYS  27           HA       LYS  27  15.261   7.481  16.279
    3    HB2  LYS  27           HB2      LYS  27  15.283   5.006  16.011
    4    HB3  LYS  27           HB3      LYS  27  17.047   5.054  15.971
    5    HG2  LYS  27           HG2      LYS  27  17.096   6.037  18.221
    6    HG3  LYS  27           HG3      LYS  27  15.329   6.060  18.264
    7    HD2  LYS  27           HD2      LYS  27  15.298   3.594  18.025
    8    HD3  LYS  27           HD3      LYS  27  17.063   3.578  18.016
    9    HE2  LYS  27           HE2      LYS  27  17.096   4.565  20.273
   10    HE3  LYS  27           HE3      LYS  27  15.330   4.610  20.286
   11    HZ3  LYS  27           HZ1      LYS  27  16.111   2.654  21.436
   12    HZ2  LYS  27           HZ2      LYS  27  17.028   2.174  20.085
   13    HZ1  LYS  27           HZ3      LYS  27  15.330   2.184  20.004

  No H/Q in entry =          13
  In of MODEL   23
    1    H    GLN  28           H        GLN  28  18.378   6.891  14.690
    2    HA   GLN  28           HA       GLN  28  20.063   7.968  16.684
    3    HB2  GLN  28           HB2      GLN  28  20.355   7.925  13.669
    4    HB3  GLN  28           HB3      GLN  28  21.641   8.390  14.782
    5    HG2  GLN  28           HG2      GLN  28  20.213   5.717  14.813
    6    HG3  GLN  28           HG3      GLN  28  21.801   6.001  14.103
    7   HE21  GLN  28          HE21      GLN  28  20.551   4.637  16.767
    8   HE22  GLN  28          HE22      GLN  28  21.715   5.072  17.922

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ALA  29           H        ALA  29  18.319   9.459  13.991
    2    HA   ALA  29           HA       ALA  29  19.327  12.076  14.248
    3    HB2  ALA  29           HB1      ALA  29  17.633  12.720  12.775
    4    HB1  ALA  29           HB2      ALA  29  16.484  11.550  13.424
    5    HB3  ALA  29           HB3      ALA  29  17.814  11.004  12.401

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LYS  30           H        LYS  30  16.543  10.485  15.764
    2    HA   LYS  30           HA       LYS  30  15.535  12.741  17.122
    3    HB2  LYS  30           HB2      LYS  30  15.411   9.800  17.822
    4    HB3  LYS  30           HB3      LYS  30  14.549  11.053  18.716
    5    HG2  LYS  30           HG2      LYS  30  13.430  11.746  16.597
    6    HG3  LYS  30           HG3      LYS  30  14.230  10.407  15.770
    7    HD2  LYS  30           HD2      LYS  30  13.149   8.802  17.295
    8    HD3  LYS  30           HD3      LYS  30  12.359  10.130  18.146
    9    HE2  LYS  30           HE2      LYS  30  11.197  10.770  16.053
   10    HE3  LYS  30           HE3      LYS  30  11.967   9.414  15.222
   11    HZ2  LYS  30           HZ1      LYS  30   9.655   9.013  16.098
   12    HZ1  LYS  30           HZ2      LYS  30  10.321   9.062  17.666
   13    HZ3  LYS  30           HZ3      LYS  30  10.826   7.876  16.555

  No H/Q in entry =          13
  In of MODEL   23
    1    H    GLN  31           H        GLN  31  18.186  10.559  17.860
    2    HA   GLN  31           HA       GLN  31  18.514  11.569  20.556
    3    HB2  GLN  31           HB2      GLN  31  20.532   9.991  18.952
    4    HB3  GLN  31           HB3      GLN  31  20.397  10.115  20.706
    5    HG2  GLN  31           HG2      GLN  31  17.880   9.174  19.933
    6    HG3  GLN  31           HG3      GLN  31  18.979   8.326  18.854
    7   HE21  GLN  31          HE21      GLN  31  17.428   7.184  21.127
    8   HE22  GLN  31          HE22      GLN  31  18.580   6.517  22.178

  No H/Q in entry =           8
  In of MODEL   23
    1    H    GLY  32           H        GLY  32  19.043  12.888  17.592
    2    HA3  GLY  32           HA2      GLY  32  20.037  14.929  17.081
    3    HA2  GLY  32           HA3      GLY  32  20.793  14.929  18.670

  No H/Q in entry =           3
  In of MODEL   23
    1    H    ASP  33           H        ASP  33  21.204  12.037  16.890
    2    HA   ASP  33           HA       ASP  33  24.033  12.700  16.428
    3    HB2  ASP  33           HB2      ASP  33  22.513  10.090  16.540
    4    HB3  ASP  33           HB3      ASP  33  24.200  10.200  16.047

  No H/Q in entry =           4
  In of MODEL   23
    1    H    PHE  34           H        PHE  34  23.560  14.027  14.548
    2    HA   PHE  34           HA       PHE  34  22.209  13.052  12.258
    3    HB2  PHE  34           HB2      PHE  34  24.349  15.176  12.493
    4    HB3  PHE  34           HB3      PHE  34  23.365  14.892  11.059
    5    HD1  PHE  34           HD1      PHE  34  23.620  16.822  13.976
    6    HD2  PHE  34           HD2      PHE  34  20.737  14.721  11.584
    7    HE1  PHE  34           HE1      PHE  34  21.808  18.226  14.922
    8    HE2  PHE  34           HE2      PHE  34  18.929  16.125  12.533
    9    HZ   PHE  34           HZ       PHE  34  19.468  17.878  14.198

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ALA  35           H        ALA  35  25.582  12.849  13.270
    2    HA   ALA  35           HA       ALA  35  26.687  12.026  10.813
    3    HB3  ALA  35           HB1      ALA  35  28.361  10.848  12.534
    4    HB2  ALA  35           HB2      ALA  35  27.500  11.875  13.679
    5    HB1  ALA  35           HB3      ALA  35  28.341  12.597  12.309

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA  36           H        ALA  36  25.560  10.071  13.575
    2    HA   ALA  36           HA       ALA  36  26.036   7.583  12.297
    3    HB2  ALA  36           HB1      ALA  36  25.600   6.836  14.371
    4    HB3  ALA  36           HB2      ALA  36  23.914   7.338  14.220
    5    HB1  ALA  36           HB3      ALA  36  25.119   8.464  14.845

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA  37           H        ALA  37  23.222   9.720  12.430
    2    HA   ALA  37           HA       ALA  37  21.361   7.958  11.250
    3    HB3  ALA  37           HB1      ALA  37  21.597  10.920  11.545
    4    HB1  ALA  37           HB2      ALA  37  20.281   9.845  12.015
    5    HB2  ALA  37           HB3      ALA  37  20.473  10.318  10.326

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LYS  38           H        LYS  38  23.471  10.414   9.776
    2    HA   LYS  38           HA       LYS  38  22.833   9.991   7.097
    3    HB2  LYS  38           HB2      LYS  38  24.646  11.541   8.547
    4    HB3  LYS  38           HB3      LYS  38  25.678  10.549   7.521
    5    HG2  LYS  38           HG2      LYS  38  24.518  11.326   5.524
    6    HG3  LYS  38           HG3      LYS  38  23.325  12.183   6.505
    7    HD2  LYS  38           HD2      LYS  38  24.924  13.776   7.261
    8    HD3  LYS  38           HD3      LYS  38  26.281  12.786   6.726
    9    HE2  LYS  38           HE2      LYS  38  25.932  14.660   5.176
   10    HE3  LYS  38           HE3      LYS  38  25.594  13.124   4.370
   11    HZ3  LYS  38           HZ1      LYS  38  23.398  13.576   4.237
   12    HZ2  LYS  38           HZ2      LYS  38  23.925  15.189   4.327
   13    HZ1  LYS  38           HZ3      LYS  38  23.348  14.405   5.718

  No H/Q in entry =          13
  In of MODEL   23
    1    H    ALA  39           H        ALA  39  25.340   8.384   9.055
    2    HA   ALA  39           HA       ALA  39  26.408   6.795   6.985
    3    HB2  ALA  39           HB1      ALA  39  26.313   5.828   9.827
    4    HB1  ALA  39           HB2      ALA  39  27.270   7.252   9.414
    5    HB3  ALA  39           HB3      ALA  39  27.618   5.701   8.649

  No H/Q in entry =           5
  In of MODEL   23
    1    H    MET  40           H        MET  40  23.790   6.183   9.279
    2    HA   MET  40           HA       MET  40  23.341   3.480   8.541
    3    HB2  MET  40           HB2      MET  40  21.528   5.527   9.834
    4    HB3  MET  40           HB3      MET  40  21.118   3.819   9.656
    5    HG2  MET  40           HG2      MET  40  23.668   4.752  11.001
    6    HG3  MET  40           HG3      MET  40  22.172   4.479  11.893
    7    HE3  MET  40           HE1      MET  40  21.599   0.847  12.063
    8    HE2  MET  40           HE2      MET  40  20.735   2.153  11.256
    9    HE1  MET  40           HE3      MET  40  21.474   2.437  12.830

  No H/Q in entry =           9
  In of MODEL   23
    1    H    MET  41           H        MET  41  21.936   6.538   7.356
    2    HA   MET  41           HA       MET  41  19.978   5.349   5.680
    3    HB2  MET  41           HB2      MET  41  21.466   7.937   5.171
    4    HB3  MET  41           HB3      MET  41  19.938   7.447   4.451
    5    HG2  MET  41           HG2      MET  41  19.188   7.258   7.001
    6    HG3  MET  41           HG3      MET  41  20.499   8.412   7.226
    7    HE2  MET  41           HE1      MET  41  19.943   9.705   3.890
    8    HE1  MET  41           HE2      MET  41  20.899  10.141   5.303
    9    HE3  MET  41           HE3      MET  41  19.630  11.224   4.738

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ASP  42           H        ASP  42  23.353   6.266   5.132
    2    HA   ASP  42           HA       ASP  42  23.448   5.795   2.374
    3    HB2  ASP  42           HB2      ASP  42  25.199   6.786   4.146
    4    HB3  ASP  42           HB3      ASP  42  25.853   5.160   4.018

  No H/Q in entry =           4
  In of MODEL   23
    1    H    GLN  43           H        GLN  43  24.164   3.635   5.093
    2    HA   GLN  43           HA       GLN  43  24.826   1.378   3.508
    3    HB2  GLN  43           HB2      GLN  43  23.800   1.560   6.351
    4    HB3  GLN  43           HB3      GLN  43  24.377   0.071   5.595
    5    HG2  GLN  43           HG2      GLN  43  26.543   1.278   5.088
    6    HG3  GLN  43           HG3      GLN  43  25.962   2.605   6.088
    7   HE21  GLN  43          HE21      GLN  43  28.192   1.626   7.126
    8   HE22  GLN  43          HE22      GLN  43  27.914   0.543   8.401

  No H/Q in entry =           8
  In of MODEL   23
    1    H    SER  44           H        SER  44  21.770   2.516   4.891
    2    HA   SER  44           HA       SER  44  20.198   0.277   4.214
    3    HB2  SER  44           HB2      SER  44  19.760   2.806   5.362
    4    HB3  SER  44           HB3      SER  44  18.727   2.766   3.936
    5    HG   SER  44           HG       SER  44  17.630   1.823   5.656

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ARG  45           H        ARG  45  20.949   3.242   2.413
    2    HA   ARG  45           HA       ARG  45  19.426   2.762   0.107
    3    HB2  ARG  45           HB2      ARG  45  20.573   4.895   0.695
    4    HB3  ARG  45           HB3      ARG  45  22.116   4.138   0.310
    5    HG2  ARG  45           HG2      ARG  45  21.335   3.737  -2.006
    6    HG3  ARG  45           HG3      ARG  45  19.804   4.517  -1.620
    7    HD2  ARG  45           HD2      ARG  45  21.058   6.610  -1.032
    8    HD3  ARG  45           HD3      ARG  45  22.553   5.834  -1.600
    9    HE   ARG  45           HE       ARG  45  20.625   5.603  -3.638
   10   HH21  ARG  45          HH11      ARG  45  20.623   6.974  -5.400
   11   HH22  ARG  45          HH12      ARG  45  21.383   8.522  -5.293
   12   HH11  ARG  45          HH21      ARG  45  22.359   8.095  -2.007
   13   HH12  ARG  45          HH22      ARG  45  22.365   9.157  -3.369

  No H/Q in entry =          13
  In of MODEL   23
    1    H    MET  46           H        MET  46  22.787   1.879   0.856
    2    HA   MET  46           HA       MET  46  23.392   0.687  -1.629
    3    HB2  MET  46           HB2      MET  46  24.496   0.360   1.161
    4    HB3  MET  46           HB3      MET  46  25.148  -0.542  -0.210
    5    HG2  MET  46           HG2      MET  46  25.610   1.554  -1.401
    6    HG3  MET  46           HG3      MET  46  24.899   2.480  -0.086
    7    HE3  MET  46           HE1      MET  46  27.425  -0.749   0.164
    8    HE2  MET  46           HE2      MET  46  28.853   0.212  -0.211
    9    HE1  MET  46           HE3      MET  46  27.506   0.167  -1.347

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ALA  47           H        ALA  47  22.003  -0.645   1.345
    2    HA   ALA  47           HA       ALA  47  21.942  -3.357   0.539
    3    HB2  ALA  47           HB1      ALA  47  21.563  -2.898   2.844
    4    HB3  ALA  47           HB2      ALA  47  20.025  -3.496   2.224
    5    HB1  ALA  47           HB3      ALA  47  20.259  -1.766   2.484

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU  48           H        LEU  48  19.597  -0.723   0.184
    2    HA   LEU  48           HA       LEU  48  17.548  -2.248  -1.069
    3    HB2  LEU  48           HB2      LEU  48  18.212   0.704  -1.181
    4    HB3  LEU  48           HB3      LEU  48  16.739  -0.001  -1.849
    5    HG   LEU  48           HG       LEU  48  17.591  -0.308   1.039
    6   HD13  LEU  48          HD11      LEU  48  17.180   1.994   0.855
    7   HD12  LEU  48          HD12      LEU  48  15.620   1.351   1.363
    8   HD11  LEU  48          HD13      LEU  48  15.893   1.774  -0.328
    9   HD22  LEU  48          HD21      LEU  48  16.056  -2.017   0.657
   10   HD21  LEU  48          HD22      LEU  48  15.186  -1.111  -0.581
   11   HD23  LEU  48          HD23      LEU  48  14.974  -0.707   1.123

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ASN  49           H        ASN  49  20.243  -0.328  -2.298
    2    HA   ASN  49           HA       ASN  49  19.592  -0.408  -5.022
    3    HB2  ASN  49           HB2      ASN  49  21.277   1.101  -4.098
    4    HB3  ASN  49           HB3      ASN  49  22.301  -0.262  -3.666
    5   HD21  ASN  49          HD21      ASN  49  23.325   1.728  -5.343
    6   HD22  ASN  49          HD22      ASN  49  23.501   1.111  -6.915

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLU  50           H        GLU  50  21.569  -2.611  -3.061
    2    HA   GLU  50           HA       GLU  50  22.264  -4.368  -5.188
    3    HB2  GLU  50           HB2      GLU  50  23.462  -4.348  -3.021
    4    HB3  GLU  50           HB3      GLU  50  22.017  -4.971  -2.226
    5    HG2  GLU  50           HG2      GLU  50  22.099  -7.004  -3.586
    6    HG3  GLU  50           HG3      GLU  50  23.477  -6.376  -4.487

  No H/Q in entry =           6
  In of MODEL   23
    1    H    ALA  51           H        ALA  51  19.608  -4.294  -2.862
    2    HA   ALA  51           HA       ALA  51  18.433  -6.762  -3.620
    3    HB3  ALA  51           HB1      ALA  51  16.842  -6.251  -2.065
    4    HB1  ALA  51           HB2      ALA  51  16.635  -4.604  -2.662
    5    HB2  ALA  51           HB3      ALA  51  17.993  -4.996  -1.607

  No H/Q in entry =           5
  In of MODEL   23
    1    H    HIS  52           H        HIS  52  17.859  -3.412  -4.653
    2    HA   HIS  52           HA       HIS  52  15.743  -3.929  -6.453
    3    HB2  HIS  52           HB2      HIS  52  16.403  -1.667  -5.650
    4    HB3  HIS  52           HB3      HIS  52  17.855  -1.768  -6.645
    5    HD1  HIS  52           HD1      HIS  52  17.479  -1.904  -9.277
    6    HD2  HIS  52           HD2      HIS  52  14.069  -1.003  -7.055
    7    HE1  HIS  52           HE1      HIS  52  15.766  -1.017 -10.919
    8    HE2  HIS  52           HE2      HIS  52  13.682  -0.462  -9.580

  No H/Q in entry =           8
  In of MODEL   23
    1    H    LEU  53           H        LEU  53  19.262  -3.948  -6.886
    2    HA   LEU  53           HA       LEU  53  19.317  -4.262  -9.687
    3    HB2  LEU  53           HB2      LEU  53  21.248  -5.034  -7.513
    4    HB3  LEU  53           HB3      LEU  53  21.563  -5.418  -9.204
    5    HG   LEU  53           HG       LEU  53  20.897  -2.607  -8.273
    6   HD11  LEU  53          HD11      LEU  53  23.558  -4.026  -8.491
    7   HD13  LEU  53          HD12      LEU  53  22.912  -3.129  -7.118
    8   HD12  LEU  53          HD13      LEU  53  23.421  -2.272  -8.567
    9   HD23  LEU  53          HD21      LEU  53  22.334  -2.172 -10.427
   10   HD22  LEU  53          HD22      LEU  53  20.652  -2.659 -10.611
   11   HD21  LEU  53          HD23      LEU  53  21.933  -3.835 -10.835

  No H/Q in entry =          11
  In of MODEL   23
    1    H    VAL  54           H        VAL  54  19.197  -6.650  -7.062
    2    HA   VAL  54           HA       VAL  54  19.313  -8.944  -8.722
    3    HB   VAL  54           HB       VAL  54  18.160  -8.517  -5.954
    4   HG12  VAL  54          HG11      VAL  54  18.476 -11.136  -5.951
    5   HG11  VAL  54          HG12      VAL  54  18.291 -10.967  -7.697
    6   HG13  VAL  54          HG13      VAL  54  17.004 -10.432  -6.617
    7   HG22  VAL  54          HG21      VAL  54  20.476  -8.314  -5.732
    8   HG21  VAL  54          HG22      VAL  54  20.810  -9.407  -7.074
    9   HG23  VAL  54          HG23      VAL  54  20.278 -10.052  -5.521

  No H/Q in entry =           9
  In of MODEL   23
    1    H    GLN  55           H        GLN  55  16.591  -7.033  -7.438
    2    HA   GLN  55           HA       GLN  55  14.564  -8.691  -8.512
    3    HB2  GLN  55           HB2      GLN  55  13.821  -7.163  -6.885
    4    HB3  GLN  55           HB3      GLN  55  14.618  -5.797  -7.661
    5    HG2  GLN  55           HG2      GLN  55  12.894  -5.467  -9.150
    6    HG3  GLN  55           HG3      GLN  55  12.567  -7.187  -9.321
    7   HE21  GLN  55          HE21      GLN  55  10.559  -7.730  -8.515
    8   HE22  GLN  55          HE22      GLN  55   9.788  -6.974  -7.207

  No H/Q in entry =           8
  In of MODEL   23
    1    H    THR  56           H        THR  56  16.311  -5.895  -9.872
    2    HA   THR  56           HA       THR  56  14.874  -5.529 -12.220
    3    HB   THR  56           HB       THR  56  17.893  -5.450 -12.065
    4    HG1  THR  56           HG1      THR  56  15.959  -3.961 -10.815
    5   HG22  THR  56          HG21      THR  56  16.135  -3.537 -13.559
    6   HG21  THR  56          HG22      THR  56  16.460  -5.127 -14.251
    7   HG23  THR  56          HG23      THR  56  17.796  -4.029 -13.899

  No H/Q in entry =           7
  In of MODEL   23
    1    H    LYS  57           H        LYS  57  17.518  -7.833 -11.609
    2    HA   LYS  57           HA       LYS  57  17.515  -9.027 -14.188
    3    HB2  LYS  57           HB2      LYS  57  19.305  -9.285 -12.442
    4    HB3  LYS  57           HB3      LYS  57  18.198 -10.278 -11.506
    5    HG2  LYS  57           HG2      LYS  57  18.082 -11.908 -13.341
    6    HG3  LYS  57           HG3      LYS  57  19.166 -10.916 -14.308
    7    HD2  LYS  57           HD2      LYS  57  20.938 -11.190 -12.606
    8    HD3  LYS  57           HD3      LYS  57  19.858 -12.202 -11.646
    9    HE2  LYS  57           HE2      LYS  57  21.350 -13.627 -12.972
   10    HE3  LYS  57           HE3      LYS  57  19.702 -13.804 -13.569
   11    HZ2  LYS  57           HZ1      LYS  57  21.398 -13.499 -15.326
   12    HZ1  LYS  57           HZ2      LYS  57  21.682 -11.934 -14.733
   13    HZ3  LYS  57           HZ3      LYS  57  20.158 -12.343 -15.362

  No H/Q in entry =          13
  In of MODEL   23
    1    H    LEU  58           H        LEU  58  15.733  -9.691 -11.212
    2    HA   LEU  58           HA       LEU  58  14.506 -12.062 -12.146
    3    HB2  LEU  58           HB2      LEU  58  13.716 -10.154  -9.950
    4    HB3  LEU  58           HB3      LEU  58  12.906 -11.690 -10.266
    5    HG   LEU  58           HG       LEU  58  15.880 -11.419  -9.712
    6   HD11  LEU  58          HD11      LEU  58  13.508 -11.831  -7.919
    7   HD13  LEU  58          HD12      LEU  58  14.964 -10.871  -7.657
    8   HD12  LEU  58          HD13      LEU  58  15.032 -12.627  -7.522
    9   HD22  LEU  58          HD21      LEU  58  15.757 -13.480 -10.740
   10   HD21  LEU  58          HD22      LEU  58  14.043 -13.686 -10.379
   11   HD23  LEU  58          HD23      LEU  58  15.251 -13.990  -9.130

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  59           H        ILE  59  13.842  -8.723 -12.828
    2    HA   ILE  59           HA       ILE  59  11.124  -9.366 -13.767
    3    HB   ILE  59           HB       ILE  59  11.934  -7.086 -12.562
    4   HG12  ILE  59          HG12      ILE  59  10.027  -6.971 -14.912
    5   HG13  ILE  59          HG13      ILE  59   9.607  -7.720 -13.392
    6   HG22  ILE  59          HG21      ILE  59  12.022  -6.272 -15.454
    7   HG21  ILE  59          HG22      ILE  59  13.495  -6.697 -14.611
    8   HG23  ILE  59          HG23      ILE  59  12.508  -5.350 -14.052
    9   HD12  ILE  59          HD11      ILE  59  10.433  -4.846 -13.794
   10   HD11  ILE  59          HD12      ILE  59  10.155  -5.584 -12.217
   11   HD13  ILE  59          HD13      ILE  59   8.822  -5.420 -13.361

  No H/Q in entry =          11
  In of MODEL   23
    1    H    GLU  60           H        GLU  60  14.330  -8.521 -15.027
    2    HA   GLU  60           HA       GLU  60  13.550  -8.119 -17.735
    3    HB2  GLU  60           HB2      GLU  60  15.731  -7.391 -16.882
    4    HB3  GLU  60           HB3      GLU  60  16.190  -9.065 -16.584
    5    HG2  GLU  60           HG2      GLU  60  15.992  -9.554 -18.998
    6    HG3  GLU  60           HG3      GLU  60  15.534  -7.879 -19.299

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLY  61           H        GLY  61  14.522 -11.002 -15.920
    2    HA3  GLY  61           HA2      GLY  61  13.976 -12.649 -18.321
    3    HA2  GLY  61           HA3      GLY  61  15.008 -13.133 -16.979

  No H/Q in entry =           3
  In of MODEL   23
    1    H    ASP  62           H        ASP  62  11.892 -11.580 -16.607
    2    HA   ASP  62           HA       ASP  62  10.951 -13.515 -14.776
    3    HB2  ASP  62           HB2      ASP  62   8.845 -12.278 -14.889
    4    HB3  ASP  62           HB3      ASP  62  10.212 -11.176 -14.765

  No H/Q in entry =           4
  In of MODEL   23
    1    H    ALA  63           H        ALA  63   9.687 -15.336 -14.999
    2    HA   ALA  63           HA       ALA  63   8.147 -15.842 -17.412
    3    HB1  ALA  63           HB1      ALA  63   9.335 -17.781 -18.171
    4    HB3  ALA  63           HB2      ALA  63  10.416 -17.740 -16.779
    5    HB2  ALA  63           HB3      ALA  63  10.526 -16.488 -18.018

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLY  64           H        GLY  64   9.707 -17.426 -14.639
    2    HA3  GLY  64           HA2      GLY  64   8.920 -18.856 -13.031
    3    HA2  GLY  64           HA3      GLY  64   7.393 -17.998 -13.190

  No H/Q in entry =           3
  In of MODEL   23
    1    H    GLU  65           H        GLU  65   5.813 -18.798 -14.710
    2    HA   GLU  65           HA       GLU  65   5.818 -21.669 -14.825
    3    HB2  GLU  65           HB2      GLU  65   3.838 -19.636 -15.850
    4    HB3  GLU  65           HB3      GLU  65   3.582 -21.381 -15.879
    5    HG2  GLU  65           HG2      GLU  65   2.558 -20.764 -13.868
    6    HG3  GLU  65           HG3      GLU  65   4.164 -21.258 -13.334

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLY  66           H        GLY  66   4.961 -22.734 -16.816
    2    HA3  GLY  66           HA2      GLY  66   6.885 -22.706 -18.861
    3    HA2  GLY  66           HA3      GLY  66   5.366 -23.576 -18.891

  No H/Q in entry =           3
  In of MODEL   23
    1    H    LYS  67           H        LYS  67   3.663 -21.313 -18.721
    2    HA   LYS  67           HA       LYS  67   3.626 -20.572 -21.495
    3    HB2  LYS  67           HB2      LYS  67   1.773 -19.965 -19.193
    4    HB3  LYS  67           HB3      LYS  67   1.468 -19.474 -20.864
    5    HG2  LYS  67           HG2      LYS  67   1.690 -21.850 -21.575
    6    HG3  LYS  67           HG3      LYS  67   1.899 -22.315 -19.890
    7    HD2  LYS  67           HD2      LYS  67  -0.537 -20.835 -20.907
    8    HD3  LYS  67           HD3      LYS  67  -0.454 -22.593 -20.772
    9    HE2  LYS  67           HE2      LYS  67   0.241 -22.222 -18.332
   10    HE3  LYS  67           HE3      LYS  67  -0.271 -20.550 -18.552
   11    HZ1  LYS  67           HZ1      LYS  67  -1.988 -22.919 -19.053
   12    HZ3  LYS  67           HZ2      LYS  67  -2.460 -21.290 -19.134
   13    HZ2  LYS  67           HZ3      LYS  67  -2.028 -21.979 -17.642

  No H/Q in entry =          13
  In of MODEL   23
    1    H    MET  68           H        MET  68   2.411 -18.162 -21.506
    2    HA   MET  68           HA       MET  68   4.534 -16.344 -21.685
    3    HB2  MET  68           HB2      MET  68   1.556 -15.859 -21.590
    4    HB3  MET  68           HB3      MET  68   2.759 -14.669 -22.085
    5    HG2  MET  68           HG2      MET  68   2.359 -17.370 -23.399
    6    HG3  MET  68           HG3      MET  68   1.753 -15.841 -24.032
    7    HE3  MET  68           HE1      MET  68   4.522 -13.850 -25.232
    8    HE2  MET  68           HE2      MET  68   4.355 -13.723 -23.484
    9    HE1  MET  68           HE3      MET  68   2.921 -13.941 -24.484

  No H/Q in entry =           9
  In of MODEL   23
    1    H    LYS  69           H        LYS  69   2.111 -16.724 -19.086
    2    HA   LYS  69           HA       LYS  69   2.309 -14.445 -17.673
    3    HB2  LYS  69           HB2      LYS  69   2.253 -17.269 -16.620
    4    HB3  LYS  69           HB3      LYS  69   2.029 -15.850 -15.593
    5    HG2  LYS  69           HG2      LYS  69   0.149 -15.111 -17.000
    6    HG3  LYS  69           HG3      LYS  69   0.376 -16.511 -18.048
    7    HD2  LYS  69           HD2      LYS  69  -0.102 -18.014 -16.154
    8    HD3  LYS  69           HD3      LYS  69  -0.322 -16.617 -15.098
    9    HE2  LYS  69           HE2      LYS  69  -2.179 -15.829 -16.516
   10    HE3  LYS  69           HE3      LYS  69  -1.959 -17.218 -17.579
   11    HZ2  LYS  69           HZ1      LYS  69  -3.685 -17.259 -15.624
   12    HZ1  LYS  69           HZ2      LYS  69  -2.321 -17.716 -14.719
   13    HZ3  LYS  69           HZ3      LYS  69  -2.813 -18.648 -16.051

  No H/Q in entry =          13
  In of MODEL   23
    1    H    VAL  70           H        VAL  70   3.351 -14.445 -15.239
    2    HA   VAL  70           HA       VAL  70   6.283 -14.761 -15.541
    3    HB   VAL  70           HB       VAL  70   6.539 -12.621 -14.313
    4   HG13  VAL  70          HG11      VAL  70   6.756 -12.363 -16.644
    5   HG12  VAL  70          HG12      VAL  70   5.529 -11.167 -16.226
    6   HG11  VAL  70          HG13      VAL  70   5.052 -12.709 -16.932
    7   HG22  VAL  70          HG21      VAL  70   4.551 -12.344 -13.059
    8   HG21  VAL  70          HG22      VAL  70   3.526 -12.716 -14.445
    9   HG23  VAL  70          HG23      VAL  70   4.354 -11.162 -14.353

  No H/Q in entry =           9
  In of MODEL   23
    1    H    SER  71           H        SER  71   7.394 -14.654 -13.389
    2    HA   SER  71           HA       SER  71   6.397 -16.594 -11.594
    3    HB2  SER  71           HB2      SER  71   8.811 -15.978 -11.862
    4    HB3  SER  71           HB3      SER  71   8.474 -14.465 -11.024
    5    HG   SER  71           HG       SER  71   8.327 -17.122 -10.072

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU  72           H        LEU  72   4.999 -16.440  -9.983
    2    HA   LEU  72           HA       LEU  72   3.454 -14.124  -9.539
    3    HB2  LEU  72           HB2      LEU  72   3.736 -16.684  -7.974
    4    HB3  LEU  72           HB3      LEU  72   2.574 -15.424  -7.566
    5    HG   LEU  72           HG       LEU  72   2.718 -16.707 -10.313
    6   HD11  LEU  72          HD11      LEU  72   0.922 -17.383  -7.963
    7   HD13  LEU  72          HD12      LEU  72   2.182 -18.420  -8.630
    8   HD12  LEU  72          HD13      LEU  72   0.757 -18.036  -9.593
    9   HD22  LEU  72          HD21      LEU  72   1.490 -14.723 -10.552
   10   HD21  LEU  72          HD22      LEU  72   0.834 -14.799  -8.926
   11   HD23  LEU  72          HD23      LEU  72   0.221 -15.880 -10.173

  No H/Q in entry =          11
  In of MODEL   23
    1    H    VAL  73           H        VAL  73   6.107 -15.567  -7.765
    2    HA   VAL  73           HA       VAL  73   6.049 -14.035  -5.432
    3    HB   VAL  73           HB       VAL  73   8.232 -14.848  -5.005
    4   HG11  VAL  73          HG11      VAL  73   6.402 -16.554  -5.153
    5   HG13  VAL  73          HG12      VAL  73   8.001 -17.217  -5.490
    6   HG12  VAL  73          HG13      VAL  73   6.890 -16.874  -6.816
    7   HG21  VAL  73          HG21      VAL  73   8.403 -14.922  -8.002
    8   HG23  VAL  73          HG22      VAL  73   9.402 -16.027  -7.060
    9   HG22  VAL  73          HG23      VAL  73   9.562 -14.285  -6.834

  No H/Q in entry =           9
  In of MODEL   23
    1    H    LEU  74           H        LEU  74   7.042 -13.142  -8.607
    2    HA   LEU  74           HA       LEU  74   8.991 -11.198  -8.112
    3    HB2  LEU  74           HB2      LEU  74   8.538 -11.943 -10.351
    4    HB3  LEU  74           HB3      LEU  74   6.871 -11.377 -10.251
    5    HG   LEU  74           HG       LEU  74   7.674  -9.049 -10.036
    6   HD13  LEU  74          HD11      LEU  74   9.787  -9.241  -8.975
    7   HD12  LEU  74          HD12      LEU  74  10.174  -8.748 -10.622
    8   HD11  LEU  74          HD13      LEU  74  10.358 -10.434 -10.141
    9   HD22  LEU  74          HD21      LEU  74   8.008  -8.816 -12.292
   10   HD21  LEU  74          HD22      LEU  74   7.438 -10.468 -12.237
   11   HD23  LEU  74          HD23      LEU  74   9.153 -10.153 -12.369

  No H/Q in entry =          11
  In of MODEL   23
    1    H    VAL  75           H        VAL  75   5.497 -10.805  -8.468
    2    HA   VAL  75           HA       VAL  75   5.406  -8.049  -7.880
    3    HB   VAL  75           HB       VAL  75   3.312 -10.189  -7.498
    4   HG12  VAL  75          HG11      VAL  75   1.729  -8.244  -7.375
    5   HG11  VAL  75          HG12      VAL  75   3.111  -7.158  -7.360
    6   HG13  VAL  75          HG13      VAL  75   2.856  -8.266  -6.020
    7   HG22  VAL  75          HG21      VAL  75   2.472  -9.397  -9.609
    8   HG21  VAL  75          HG22      VAL  75   4.204  -9.644  -9.825
    9   HG23  VAL  75          HG23      VAL  75   3.567  -8.015  -9.599

  No H/Q in entry =           9
  In of MODEL   23
    1    H    GLU  76           H        GLU  76   5.144 -10.926  -5.772
    2    HA   GLU  76           HA       GLU  76   4.674  -9.566  -3.350
    3    HB2  GLU  76           HB2      GLU  76   4.489 -12.028  -3.575
    4    HB3  GLU  76           HB3      GLU  76   6.222 -12.138  -3.832
    5    HG2  GLU  76           HG2      GLU  76   5.818 -12.715  -1.533
    6    HG3  GLU  76           HG3      GLU  76   6.547 -11.120  -1.524

  No H/Q in entry =           6
  In of MODEL   23
    1    H    ALA  77           H        ALA  77   7.734 -10.479  -4.910
    2    HA   ALA  77           HA       ALA  77   9.423  -9.441  -2.891
    3    HB1  ALA  77           HB1      ALA  77  10.177 -10.992  -4.677
    4    HB2  ALA  77           HB2      ALA  77  11.193  -9.555  -4.562
    5    HB3  ALA  77           HB3      ALA  77  10.000  -9.690  -5.854

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLN  78           H        GLN  78   8.039  -8.018  -5.807
    2    HA   GLN  78           HA       GLN  78   9.397  -5.543  -5.699
    3    HB2  GLN  78           HB2      GLN  78   8.101  -6.453  -7.658
    4    HB3  GLN  78           HB3      GLN  78   6.618  -6.070  -6.785
    5    HG2  GLN  78           HG2      GLN  78   7.281  -3.702  -6.689
    6    HG3  GLN  78           HG3      GLN  78   8.766  -4.078  -7.563
    7   HE21  GLN  78          HE21      GLN  78   8.386  -3.104  -9.597
    8   HE22  GLN  78          HE22      GLN  78   7.040  -3.447 -10.572

  No H/Q in entry =           8
  In of MODEL   23
    1    H    LEU  79           H        LEU  79   6.373  -6.673  -4.274
    2    HA   LEU  79           HA       LEU  79   5.384  -4.263  -3.265
    3    HB2  LEU  79           HB2      LEU  79   4.063  -6.311  -3.213
    4    HB3  LEU  79           HB3      LEU  79   5.204  -7.054  -2.096
    5    HG   LEU  79           HG       LEU  79   4.654  -5.412  -0.369
    6   HD13  LEU  79          HD11      LEU  79   4.196  -3.395  -1.420
    7   HD12  LEU  79          HD12      LEU  79   2.568  -3.916  -0.984
    8   HD11  LEU  79          HD13      LEU  79   3.151  -4.139  -2.631
    9   HD23  LEU  79          HD21      LEU  79   2.065  -5.896  -0.284
   10   HD22  LEU  79          HD22      LEU  79   3.201  -7.239  -0.174
   11   HD21  LEU  79          HD23      LEU  79   2.391  -6.899  -1.701

  No H/Q in entry =          11
  In of MODEL   23
    1    H    HIS  80           H        HIS  80   7.556  -6.606  -1.680
    2    HA   HIS  80           HA       HIS  80   7.844  -5.066   0.691
    3    HB2  HIS  80           HB2      HIS  80   9.178  -7.434  -0.507
    4    HB3  HIS  80           HB3      HIS  80  10.088  -6.541   0.713
    5    HD1  HIS  80           HD1      HIS  80   9.591  -7.176   3.054
    6    HD2  HIS  80           HD2      HIS  80   6.377  -8.015   0.535
    7    HE1  HIS  80           HE1      HIS  80   7.812  -8.275   4.498
    8    HE2  HIS  80           HE2      HIS  80   5.847  -8.790   2.971

  No H/Q in entry =           8
  In of MODEL   23
    1    H    LEU  81           H        LEU  81   9.855  -5.347  -2.217
    2    HA   LEU  81           HA       LEU  81  11.903  -3.614  -1.333
    3    HB2  LEU  81           HB2      LEU  81  10.986  -4.402  -4.099
    4    HB3  LEU  81           HB3      LEU  81  12.409  -3.401  -3.805
    5    HG   LEU  81           HG       LEU  81  12.003  -6.121  -2.533
    6   HD12  LEU  81          HD11      LEU  81  13.821  -6.753  -4.279
    7   HD11  LEU  81          HD12      LEU  81  13.263  -5.326  -5.151
    8   HD13  LEU  81          HD13      LEU  81  12.146  -6.647  -4.817
    9   HD23  LEU  81          HD21      LEU  81  14.633  -5.815  -2.513
   10   HD22  LEU  81          HD22      LEU  81  13.651  -5.052  -1.265
   11   HD21  LEU  81          HD23      LEU  81  14.236  -4.102  -2.630

  No H/Q in entry =          11
  In of MODEL   23
    1    H    MET  82           H        MET  82   8.988  -2.965  -3.276
    2    HA   MET  82           HA       MET  82   9.539  -0.241  -3.774
    3    HB2  MET  82           HB2      MET  82   6.973  -1.825  -3.656
    4    HB3  MET  82           HB3      MET  82   6.980  -0.101  -4.020
    5    HG2  MET  82           HG2      MET  82   8.576  -2.180  -5.552
    6    HG3  MET  82           HG3      MET  82   7.013  -1.551  -6.068
    7    HE3  MET  82           HE1      MET  82   7.478   1.903  -7.237
    8    HE2  MET  82           HE2      MET  82   7.098   1.677  -5.531
    9    HE1  MET  82           HE3      MET  82   6.432   0.571  -6.728

  No H/Q in entry =           9
  In of MODEL   23
    1    H    THR  83           H        THR  83   7.734  -1.834  -1.175
    2    HA   THR  83           HA       THR  83   6.890   0.517   0.151
    3    HB   THR  83           HB       THR  83   6.744  -1.058   2.168
    4    HG1  THR  83           HG1      THR  83   7.494  -3.011   1.939
    5   HG22  THR  83          HG21      THR  83   5.088  -2.616   0.695
    6   HG21  THR  83          HG22      THR  83   5.323  -1.288  -0.436
    7   HG23  THR  83          HG23      THR  83   4.680  -0.971   1.176

  No H/Q in entry =           7
  In of MODEL   23
    1    H    SER  84           H        SER  84   9.703  -1.593   0.678
    2    HA   SER  84           HA       SER  84  10.764  -0.169   2.869
    3    HB2  SER  84           HB2      SER  84  12.014  -2.016   0.846
    4    HB3  SER  84           HB3      SER  84  12.961  -1.267   2.131
    5    HG   SER  84           HG       SER  84  10.678  -2.947   2.384

  No H/Q in entry =           5
  In of MODEL   23
    1    H    MET  85           H        MET  85  11.526   0.091  -0.617
    2    HA   MET  85           HA       MET  85  13.533   2.047  -0.359
    3    HB2  MET  85           HB2      MET  85  13.133   0.766  -2.427
    4    HB3  MET  85           HB3      MET  85  11.614   1.633  -2.659
    5    HG2  MET  85           HG2      MET  85  12.843   3.771  -2.761
    6    HG3  MET  85           HG3      MET  85  14.360   2.910  -2.523
    7    HE2  MET  85           HE1      MET  85  15.165   0.910  -4.198
    8    HE1  MET  85           HE2      MET  85  15.832   2.536  -4.302
    9    HE3  MET  85           HE3      MET  85  15.438   1.664  -5.777

  No H/Q in entry =           9
  In of MODEL   23
    1    H    LEU  86           H        LEU  86  10.046   2.398  -0.877
    2    HA   LEU  86           HA       LEU  86   9.996   5.212  -1.057
    3    HB2  LEU  86           HB2      LEU  86   8.145   3.561  -1.638
    4    HB3  LEU  86           HB3      LEU  86   7.811   3.472   0.091
    5    HG   LEU  86           HG       LEU  86   7.663   6.034   0.039
    6   HD11  LEU  86          HD11      LEU  86   8.443   5.596  -2.661
    7   HD13  LEU  86          HD12      LEU  86   8.013   7.125  -1.900
    8   HD12  LEU  86          HD13      LEU  86   6.774   6.168  -2.709
    9   HD23  LEU  86          HD21      LEU  86   5.527   4.692  -1.629
   10   HD22  LEU  86          HD22      LEU  86   5.339   5.952  -0.413
   11   HD21  LEU  86          HD23      LEU  86   5.730   4.306   0.080

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ALA  87           H        ALA  87   9.513   3.034   1.687
    2    HA   ALA  87           HA       ALA  87   8.969   4.949   3.656
    3    HB1  ALA  87           HB1      ALA  87   9.762   2.125   3.570
    4    HB3  ALA  87           HB2      ALA  87   8.639   2.942   4.653
    5    HB2  ALA  87           HB3      ALA  87  10.367   2.965   5.001

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ARG  88           H        ARG  88  12.048   3.510   2.682
    2    HA   ARG  88           HA       ARG  88  13.660   4.879   4.519
    3    HB2  ARG  88           HB2      ARG  88  14.321   2.903   3.115
    4    HB3  ARG  88           HB3      ARG  88  14.483   3.996   1.744
    5    HG2  ARG  88           HG2      ARG  88  15.958   5.301   3.694
    6    HG3  ARG  88           HG3      ARG  88  16.269   3.610   4.073
    7    HD2  ARG  88           HD2      ARG  88  17.539   3.308   2.229
    8    HD3  ARG  88           HD3      ARG  88  16.409   4.186   1.194
    9    HE   ARG  88           HE       ARG  88  18.806   5.237   2.247
   10   HH21  ARG  88          HH11      ARG  88  19.163   7.454   2.055
   11   HH22  ARG  88          HH12      ARG  88  17.818   8.532   1.909
   12   HH11  ARG  88          HH21      ARG  88  15.472   6.007   1.962
   13   HH12  ARG  88          HH22      ARG  88  15.726   7.710   1.832

  No H/Q in entry =          13
  In of MODEL   23
    1    H    GLU  89           H        GLU  89  12.698   5.784   1.194
    2    HA   GLU  89           HA       GLU  89  14.258   8.136   1.042
    3    HB2  GLU  89           HB2      GLU  89  13.112   7.102  -0.909
    4    HB3  GLU  89           HB3      GLU  89  11.569   7.650  -0.254
    5    HG2  GLU  89           HG2      GLU  89  12.283   9.985  -0.414
    6    HG3  GLU  89           HG3      GLU  89  13.886   9.486  -0.947

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LEU  90           H        LEU  90  10.923   7.643   2.164
    2    HA   LEU  90           HA       LEU  90  10.421  10.378   2.740
    3    HB2  LEU  90           HB2      LEU  90   9.211   7.810   3.763
    4    HB3  LEU  90           HB3      LEU  90   8.587   9.408   4.186
    5    HG   LEU  90           HG       LEU  90   9.007   8.528   1.317
    6   HD12  LEU  90          HD11      LEU  90   6.472   8.212   1.374
    7   HD11  LEU  90          HD12      LEU  90   6.623   8.200   3.131
    8   HD13  LEU  90          HD13      LEU  90   7.437   6.967   2.167
    9   HD22  LEU  90          HD21      LEU  90   8.725  10.838   1.244
   10   HD21  LEU  90          HD22      LEU  90   7.736  10.874   2.703
   11   HD23  LEU  90          HD23      LEU  90   7.039  10.324   1.179

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  91           H        ILE  91  11.666   7.689   4.663
    2    HA   ILE  91           HA       ILE  91  11.808   9.052   7.133
    3    HB   ILE  91           HB       ILE  91  13.353   6.706   6.011
    4   HG12  ILE  91          HG12      ILE  91  11.333   6.882   8.266
    5   HG13  ILE  91          HG13      ILE  91  10.864   6.605   6.590
    6   HG22  ILE  91          HG21      ILE  91  13.816   6.489   8.652
    7   HG21  ILE  91          HG22      ILE  91  13.749   8.248   8.552
    8   HG23  ILE  91          HG23      ILE  91  14.925   7.355   7.590
    9   HD13  ILE  91          HD11      ILE  91  11.856   4.498   6.520
   10   HD12  ILE  91          HD12      ILE  91  11.260   4.558   8.179
   11   HD11  ILE  91          HD13      ILE  91  12.964   4.863   7.844

  No H/Q in entry =          11
  In of MODEL   23
    1    H    THR  92           H        THR  92  14.030   8.873   4.385
    2    HA   THR  92           HA       THR  92  16.200  10.255   5.550
    3    HB   THR  92           HB       THR  92  15.219  10.137   2.688
    4    HG1  THR  92           HG1      THR  92  16.040   8.235   3.093
    5   HG22  THR  92          HG21      THR  92  17.793  10.814   2.399
    6   HG21  THR  92          HG22      THR  92  17.486  11.636   3.929
    7   HG23  THR  92          HG23      THR  92  16.521  12.029   2.507

  No H/Q in entry =           7
  In of MODEL   23
    1    H    GLU  93           H        GLU  93  13.322  11.424   3.816
    2    HA   GLU  93           HA       GLU  93  13.930  14.182   3.934
    3    HB2  GLU  93           HB2      GLU  93  11.219  12.822   3.941
    4    HB3  GLU  93           HB3      GLU  93  11.516  14.521   3.571
    5    HG2  GLU  93           HG2      GLU  93  12.846  12.273   2.045
    6    HG3  GLU  93           HG3      GLU  93  11.304  12.964   1.555

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LEU  94           H        LEU  94  12.173  12.033   6.140
    2    HA   LEU  94           HA       LEU  94  11.369  13.982   8.016
    3    HB2  LEU  94           HB2      LEU  94  11.930  11.024   8.289
    4    HB3  LEU  94           HB3      LEU  94  11.360  12.001   9.639
    5    HG   LEU  94           HG       LEU  94   9.882  12.062   7.007
    6   HD11  LEU  94          HD11      LEU  94   9.950   9.839   9.010
    7   HD13  LEU  94          HD12      LEU  94   9.651   9.781   7.275
    8   HD12  LEU  94          HD13      LEU  94   8.373  10.303   8.371
    9   HD23  LEU  94          HD21      LEU  94   7.961  12.470   8.604
   10   HD22  LEU  94          HD22      LEU  94   9.206  13.718   8.644
   11   HD21  LEU  94          HD23      LEU  94   9.135  12.501   9.918

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  95           H        ILE  95  14.334  12.038   7.783
    2    HA   ILE  95           HA       ILE  95  15.502  12.952  10.200
    3    HB   ILE  95           HB       ILE  95  16.740  11.879   7.653
    4   HG12  ILE  95          HG12      ILE  95  16.433  10.678  10.419
    5   HG13  ILE  95          HG13      ILE  95  15.267  10.426   9.122
    6   HG21  ILE  95          HG21      ILE  95  17.994  12.678  10.298
    7   HG23  ILE  95          HG22      ILE  95  18.462  13.204   8.680
    8   HG22  ILE  95          HG23      ILE  95  18.760  11.542   9.188
    9   HD13  ILE  95          HD11      ILE  95  16.744   9.141   7.861
   10   HD12  ILE  95          HD12      ILE  95  17.211   8.688   9.497
   11   HD11  ILE  95          HD13      ILE  95  18.172   9.864   8.601

  No H/Q in entry =          11
  In of MODEL   23
    1    H    GLU  96           H        GLU  96  15.668  14.187   6.867
    2    HA   GLU  96           HA       GLU  96  17.525  16.256   7.348
    3    HB2  GLU  96           HB2      GLU  96  16.861  15.599   5.087
    4    HB3  GLU  96           HB3      GLU  96  15.220  16.164   5.385
    5    HG2  GLU  96           HG2      GLU  96  15.798  18.290   4.845
    6    HG3  GLU  96           HG3      GLU  96  17.094  18.284   6.030

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LEU  97           H        LEU  97  14.012  16.086   7.771
    2    HA   LEU  97           HA       LEU  97  13.608  18.822   8.414
    3    HB2  LEU  97           HB2      LEU  97  12.076  16.303   9.024
    4    HB3  LEU  97           HB3      LEU  97  11.570  17.852   9.696
    5    HG   LEU  97           HG       LEU  97  12.056  17.436   6.731
    6   HD12  LEU  97          HD11      LEU  97   9.532  17.321   6.609
    7   HD11  LEU  97          HD12      LEU  97   9.521  17.120   8.359
    8   HD13  LEU  97          HD13      LEU  97  10.297  15.909   7.337
    9   HD23  LEU  97          HD21      LEU  97  10.327  19.409   6.762
   10   HD22  LEU  97          HD22      LEU  97  12.010  19.760   7.158
   11   HD21  LEU  97          HD23      LEU  97  10.818  19.594   8.446

  No H/Q in entry =          11
  In of MODEL   23
    1    H    HIS  98           H        HIS  98  14.412  15.990  10.409
    2    HA   HIS  98           HA       HIS  98  14.256  17.250  12.926
    3    HB2  HIS  98           HB2      HIS  98  15.996  14.984  11.926
    4    HB3  HIS  98           HB3      HIS  98  15.995  15.522  13.607
    5    HD1  HIS  98           HD1      HIS  98  13.791  13.905  11.010
    6    HD2  HIS  98           HD2      HIS  98  13.682  14.823  15.075
    7    HE1  HIS  98           HE1      HIS  98  11.759  12.720  11.959
    8    HE2  HIS  98           HE2      HIS  98  11.673  13.271  14.430

  No H/Q in entry =           8
  In of MODEL   23
    1    H    GLU  99           H        GLU  99  16.813  17.123  10.495
    2    HA   GLU  99           HA       GLU  99  18.803  18.443  12.029
    3    HB2  GLU  99           HB2      GLU  99  19.279  17.155   9.959
    4    HB3  GLU  99           HB3      GLU  99  18.477  18.415   9.018
    5    HG2  GLU  99           HG2      GLU  99  20.093  20.076   9.812
    6    HG3  GLU  99           HG3      GLU  99  20.864  18.869  10.836

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LYS 100           H        LYS 100  16.289  19.621   9.809
    2    HA   LYS 100           HA       LYS 100  17.101  22.354   9.956
    3    HB2  LYS 100           HB2      LYS 100  14.462  21.079   9.197
    4    HB3  LYS 100           HB3      LYS 100  14.771  22.816   9.108
    5    HG2  LYS 100           HG2      LYS 100  16.743  22.358   7.644
    6    HG3  LYS 100           HG3      LYS 100  16.321  20.644   7.660
    7    HD2  LYS 100           HD2      LYS 100  14.130  21.166   6.657
    8    HD3  LYS 100           HD3      LYS 100  14.536  22.883   6.648
    9    HE2  LYS 100           HE2      LYS 100  16.494  22.392   5.191
   10    HE3  LYS 100           HE3      LYS 100  16.020  20.690   5.156
   11    HZ1  LYS 100           HZ1      LYS 100  14.208  22.894   4.320
   12    HZ3  LYS 100           HZ2      LYS 100  14.015  21.226   4.056
   13    HZ2  LYS 100           HZ3      LYS 100  15.232  22.082   3.237

  No H/Q in entry =          13
  In of MODEL   23
    1    H    LEU 101           H        LEU 101  14.989  20.318  11.917
    2    HA   LEU 101           HA       LEU 101  13.832  22.391  13.495
    3    HB2  LEU 101           HB2      LEU 101  14.257  19.439  13.877
    4    HB3  LEU 101           HB3      LEU 101  13.724  20.421  15.238
    5    HG   LEU 101           HG       LEU 101  12.311  20.519  12.567
    6   HD12  LEU 101          HD11      LEU 101  10.641  18.964  13.832
    7   HD11  LEU 101          HD12      LEU 101  12.032  18.542  14.828
    8   HD13  LEU 101          HD13      LEU 101  12.066  18.237  13.091
    9   HD21  LEU 101          HD21      LEU 101  11.654  21.314  15.419
   10   HD23  LEU 101          HD22      LEU 101  10.394  21.096  14.206
   11   HD22  LEU 101          HD23      LEU 101  11.636  22.324  13.971

  No H/Q in entry =          11
  In of MODEL   23
    1    H    LYS 102           H        LYS 102  16.977  21.766  13.063
    2    HA   LYS 102           HA       LYS 102  18.827  22.625  14.139
    3    HB2  LYS 102           HB2      LYS 102  17.020  24.149  15.271
    4    HB3  LYS 102           HB3      LYS 102  17.219  23.084  16.647
    5    HG2  LYS 102           HG2      LYS 102  19.125  25.085  15.482
    6    HG3  LYS 102           HG3      LYS 102  18.739  24.772  17.160
    7    HD2  LYS 102           HD2      LYS 102  20.397  22.851  15.475
    8    HD3  LYS 102           HD3      LYS 102  21.093  24.168  16.410
    9    HE2  LYS 102           HE2      LYS 102  20.678  21.621  17.376
   10    HE3  LYS 102           HE3      LYS 102  20.904  23.061  18.369
   11    HZ2  LYS 102           HZ1      LYS 102  18.927  21.788  18.983
   12    HZ1  LYS 102           HZ2      LYS 102  18.286  22.023  17.433
   13    HZ3  LYS 102           HZ3      LYS 102  18.523  23.350  18.461

  No H/Q in entry =          13
  In of MODEL   23
    1    H    ALA 103           H        ALA 103  16.742  21.029  16.556
    2    HA   ALA 103           HA       ALA 103  18.459  19.807  18.212
    3    HB2  ALA 103           HB1      ALA 103  16.863  17.809  18.203
    4    HB1  ALA 103           HB2      ALA 103  15.975  18.669  16.944
    5    HB3  ALA 103           HB3      ALA 103  16.155  19.387  18.544

  No H/Q in entry =           5
  In of MODEL   23
    1    H1   ALA   1           H3       ALA   1  -1.571  -6.891 -21.462
    2    H2   ALA   1           H2       ALA   1  -2.375  -8.322 -21.012
    3    H3   ALA   1           H1       ALA   1  -0.767  -8.381 -21.564
    4    HA   ALA   1           HA       ALA   1  -1.600  -8.843 -23.562
    5    HB1  ALA   1           HB1      ALA   1  -3.742  -9.548 -23.093
    6    HB2  ALA   1           HB2      ALA   1  -4.170  -8.034 -23.889
    7    HB3  ALA   1           HB3      ALA   1  -4.113  -8.117 -22.131

  No H/Q in entry =           7
  In of MODEL   23
    1    H    GLU   2           H        GLU   2  -2.419  -7.646 -25.552
    2    HA   GLU   2           HA       GLU   2  -1.006  -5.640 -26.425
    3    HB2  GLU   2           HB2      GLU   2  -4.013  -5.687 -26.748
    4    HB3  GLU   2           HB3      GLU   2  -2.885  -4.831 -27.794
    5    HG2  GLU   2           HG2      GLU   2  -2.392  -6.722 -28.951
    6    HG3  GLU   2           HG3      GLU   2  -2.103  -7.631 -27.473

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLU   3           H        GLU   3  -4.160  -4.364 -25.529
    2    HA   GLU   3           HA       GLU   3  -3.098  -1.815 -24.896
    3    HB2  GLU   3           HB2      GLU   3  -5.795  -3.113 -24.570
    4    HB3  GLU   3           HB3      GLU   3  -5.488  -1.500 -23.921
    5    HG2  GLU   3           HG2      GLU   3  -5.122  -0.573 -26.045
    6    HG3  GLU   3           HG3      GLU   3  -4.736  -2.130 -26.771

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LEU   4           H        LEU   4  -4.707  -4.166 -22.721
    2    HA   LEU   4           HA       LEU   4  -4.339  -2.943 -20.328
    3    HB2  LEU   4           HB2      LEU   4  -3.814  -5.887 -20.800
    4    HB3  LEU   4           HB3      LEU   4  -4.218  -5.140 -19.256
    5    HG   LEU   4           HG       LEU   4  -5.987  -5.199 -21.724
    6   HD13  LEU   4          HD11      LEU   4  -7.193  -6.910 -20.730
    7   HD12  LEU   4          HD12      LEU   4  -6.708  -6.456 -19.097
    8   HD11  LEU   4          HD13      LEU   4  -5.576  -7.305 -20.148
    9   HD23  LEU   4          HD21      LEU   4  -7.669  -4.379 -19.858
   10   HD22  LEU   4          HD22      LEU   4  -6.622  -3.214 -20.665
   11   HD21  LEU   4          HD23      LEU   4  -6.203  -3.809 -19.059

  No H/Q in entry =          11
  In of MODEL   23
    1    H    GLU   5           H        GLU   5  -1.850  -4.800 -22.057
    2    HA   GLU   5           HA       GLU   5   0.132  -4.531 -20.017
    3    HB2  GLU   5           HB2      GLU   5   0.188  -6.300 -21.770
    4    HB3  GLU   5           HB3      GLU   5   0.512  -5.057 -22.979
    5    HG2  GLU   5           HG2      GLU   5   2.580  -4.432 -21.818
    6    HG3  GLU   5           HG3      GLU   5   2.255  -5.625 -20.561

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLU   6           H        GLU   6  -0.487  -2.810 -23.060
    2    HA   GLU   6           HA       GLU   6   1.694  -0.993 -22.787
    3    HB2  GLU   6           HB2      GLU   6  -0.862  -0.881 -24.400
    4    HB3  GLU   6           HB3      GLU   6   0.405   0.340 -24.502
    5    HG2  GLU   6           HG2      GLU   6   2.029  -1.356 -25.186
    6    HG3  GLU   6           HG3      GLU   6   0.814  -2.620 -25.008

  No H/Q in entry =           6
  In of MODEL   23
    1    H    VAL   7           H        VAL   7  -1.646  -1.044 -21.748
    2    HA   VAL   7           HA       VAL   7  -1.851   1.669 -20.909
    3    HB   VAL   7           HB       VAL   7  -3.331  -0.840 -20.078
    4   HG11  VAL   7          HG11      VAL   7  -3.689   2.050 -19.261
    5   HG13  VAL   7          HG12      VAL   7  -3.601   0.624 -18.227
    6   HG12  VAL   7          HG13      VAL   7  -5.029   0.904 -19.222
    7   HG21  VAL   7          HG21      VAL   7  -3.477   0.240 -22.465
    8   HG23  VAL   7          HG22      VAL   7  -4.416   1.494 -21.653
    9   HG22  VAL   7          HG23      VAL   7  -4.972  -0.180 -21.629

  No H/Q in entry =           9
  In of MODEL   23
    1    H    VAL   8           H        VAL   8  -0.886  -1.324 -19.267
    2    HA   VAL   8           HA       VAL   8  -0.565  -0.250 -16.670
    3    HB   VAL   8           HB       VAL   8   0.825  -2.574 -18.026
    4   HG12  VAL   8          HG11      VAL   8   1.201  -3.232 -15.549
    5   HG11  VAL   8          HG12      VAL   8   0.905  -1.531 -15.194
    6   HG13  VAL   8          HG13      VAL   8   2.252  -1.992 -16.233
    7   HG23  VAL   8          HG21      VAL   8  -1.149  -3.003 -15.840
    8   HG22  VAL   8          HG22      VAL   8  -0.956  -3.865 -17.363
    9   HG21  VAL   8          HG23      VAL   8  -1.831  -2.339 -17.324

  No H/Q in entry =           9
  In of MODEL   23
    1    H    MET   9           H        MET   9   1.686  -0.563 -19.414
    2    HA   MET   9           HA       MET   9   3.977   0.463 -18.147
    3    HB2  MET   9           HB2      MET   9   3.034   0.497 -21.012
    4    HB3  MET   9           HB3      MET   9   4.550   1.258 -20.534
    5    HG2  MET   9           HG2      MET   9   5.336  -0.873 -19.585
    6    HG3  MET   9           HG3      MET   9   3.809  -1.640 -20.027
    7    HE1  MET   9           HE1      MET   9   6.641   0.405 -20.969
    8    HE3  MET   9           HE2      MET   9   6.059   0.941 -22.542
    9    HE2  MET   9           HE3      MET   9   7.324  -0.280 -22.448

  No H/Q in entry =           9
  In of MODEL   23
    1    H    GLY  10           H        GLY  10   1.307   2.087 -19.827
    2    HA3  GLY  10           HA2      GLY  10   2.289   4.733 -19.578
    3    HA2  GLY  10           HA3      GLY  10   0.597   4.285 -19.786

  No H/Q in entry =           3
  In of MODEL   23
    1    H    LEU  11           H        LEU  11   0.183   2.758 -17.502
    2    HA   LEU  11           HA       LEU  11  -0.335   4.736 -15.541
    3    HB2  LEU  11           HB2      LEU  11  -0.291   1.720 -15.388
    4    HB3  LEU  11           HB3      LEU  11  -0.794   2.745 -14.045
    5    HG   LEU  11           HG       LEU  11  -2.028   2.872 -16.810
    6   HD13  LEU  11          HD11      LEU  11  -2.629   0.732 -16.059
    7   HD12  LEU  11          HD12      LEU  11  -3.973   1.733 -15.514
    8   HD11  LEU  11          HD13      LEU  11  -2.722   1.242 -14.372
    9   HD22  LEU  11          HD21      LEU  11  -2.605   4.891 -15.802
   10   HD21  LEU  11          HD22      LEU  11  -2.537   4.222 -14.172
   11   HD23  LEU  11          HD23      LEU  11  -3.914   3.868 -15.216

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  12           H        ILE  12   2.189   2.251 -15.783
    2    HA   ILE  12           HA       ILE  12   3.396   2.776 -13.278
    3    HB   ILE  12           HB       ILE  12   4.646   1.730 -15.840
    4   HG12  ILE  12          HG12      ILE  12   2.620   0.514 -14.699
    5   HG13  ILE  12          HG13      ILE  12   4.011  -0.432 -15.189
    6   HG22  ILE  12          HG21      ILE  12   6.303   0.682 -14.240
    7   HG21  ILE  12          HG22      ILE  12   5.616   1.685 -12.964
    8   HG23  ILE  12          HG23      ILE  12   6.406   2.437 -14.349
    9   HD11  ILE  12          HD11      ILE  12   3.560   0.664 -12.402
   10   HD13  ILE  12          HD12      ILE  12   4.836  -0.442 -12.907
   11   HD12  ILE  12          HD13      ILE  12   3.168  -0.971 -12.901

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  13           H        ILE  13   4.010   4.039 -16.532
    2    HA   ILE  13           HA       ILE  13   6.160   5.741 -15.803
    3    HB   ILE  13           HB       ILE  13   4.133   5.843 -18.050
    4   HG12  ILE  13          HG12      ILE  13   5.930   3.977 -17.789
    5   HG13  ILE  13          HG13      ILE  13   5.733   4.750 -19.358
    6   HG21  ILE  13          HG21      ILE  13   6.417   7.691 -17.403
    7   HG23  ILE  13          HG22      ILE  13   4.805   8.091 -17.986
    8   HG22  ILE  13          HG23      ILE  13   5.989   7.393 -19.089
    9   HD13  ILE  13          HD11      ILE  13   7.778   5.835 -19.227
   10   HD12  ILE  13          HD12      ILE  13   8.138   4.455 -18.196
   11   HD11  ILE  13          HD13      ILE  13   7.681   5.994 -17.474

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ASN  14           H        ASN  14   2.658   6.264 -16.073
    2    HA   ASN  14           HA       ASN  14   2.636   9.009 -15.433
    3    HB2  ASN  14           HB2      ASN  14   0.731   7.383 -16.267
    4    HB3  ASN  14           HB3      ASN  14   0.407   7.205 -14.548
    5   HD21  ASN  14          HD21      ASN  14  -1.602   8.379 -15.981
    6   HD22  ASN  14          HD22      ASN  14  -1.652  10.052 -15.711

  No H/Q in entry =           6
  In of MODEL   23
    1    H    SER  15           H        SER  15   2.317   6.132 -13.360
    2    HA   SER  15           HA       SER  15   2.018   7.501 -10.910
    3    HB2  SER  15           HB2      SER  15   2.555   5.410  -9.863
    4    HB3  SER  15           HB3      SER  15   1.716   5.001 -11.355
    5    HG   SER  15           HG       SER  15   4.086   5.118 -12.167

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLY  16           H        GLY  16   4.887   6.385 -12.668
    2    HA3  GLY  16           HA2      GLY  16   6.816   7.125 -10.735
    3    HA2  GLY  16           HA3      GLY  16   7.119   6.922 -12.458

  No H/Q in entry =           3
  In of MODEL   23
    1    H    GLN  17           H        GLN  17   5.445   8.894 -13.520
    2    HA   GLN  17           HA       GLN  17   7.039  11.223 -13.208
    3    HB2  GLN  17           HB2      GLN  17   4.287  10.816 -14.411
    4    HB3  GLN  17           HB3      GLN  17   5.158  12.348 -14.481
    5    HG2  GLN  17           HG2      GLN  17   6.237   9.715 -15.524
    6    HG3  GLN  17           HG3      GLN  17   5.487  10.956 -16.527
    7   HE21  GLN  17          HE21      GLN  17   8.470   9.847 -15.824
    8   HE22  GLN  17          HE22      GLN  17   9.356  11.294 -15.871

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ALA  18           H        ALA  18   3.930  10.225 -11.863
    2    HA   ALA  18           HA       ALA  18   3.220  12.617 -10.595
    3    HB1  ALA  18           HB1      ALA  18   2.075  10.168 -10.821
    4    HB2  ALA  18           HB2      ALA  18   1.533  11.391  -9.673
    5    HB3  ALA  18           HB3      ALA  18   2.614  10.100  -9.144

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ARG  19           H        ARG  19   5.074   9.840  -9.317
    2    HA   ARG  19           HA       ARG  19   5.612  10.992  -6.793
    3    HB2  ARG  19           HB2      ARG  19   6.011   8.587  -7.323
    4    HB3  ARG  19           HB3      ARG  19   7.371   9.065  -8.342
    5    HG2  ARG  19           HG2      ARG  19   8.495  10.096  -6.417
    6    HG3  ARG  19           HG3      ARG  19   7.116   9.715  -5.388
    7    HD2  ARG  19           HD2      ARG  19   8.868   8.068  -5.030
    8    HD3  ARG  19           HD3      ARG  19   7.489   7.296  -5.818
    9    HE   ARG  19           HE       ARG  19   9.201   8.106  -7.863
   10   HH21  ARG  19          HH11      ARG  19  10.753   6.693  -8.713
   11   HH22  ARG  19          HH12      ARG  19  11.290   5.340  -7.779
   12   HH11  ARG  19          HH21      ARG  19   9.258   6.072  -5.087
   13   HH12  ARG  19          HH22      ARG  19  10.439   4.988  -5.724

  No H/Q in entry =          13
  In of MODEL   23
    1    H    SER  20           H        SER  20   7.432  11.014  -9.840
    2    HA   SER  20           HA       SER  20   9.685  12.415  -9.012
    3    HB2  SER  20           HB2      SER  20   9.715  11.542 -11.217
    4    HB3  SER  20           HB3      SER  20   8.219  12.366 -11.645
    5    HG   SER  20           HG       SER  20  10.484  13.819 -10.816

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU  21           H        LEU  21   6.595  13.703 -10.211
    2    HA   LEU  21           HA       LEU  21   7.280  16.445  -9.983
    3    HB2  LEU  21           HB2      LEU  21   4.604  15.036  -9.908
    4    HB3  LEU  21           HB3      LEU  21   4.780  16.789  -9.908
    5    HG   LEU  21           HG       LEU  21   5.975  14.995 -12.042
    6   HD12  LEU  21          HD11      LEU  21   4.041  15.952 -13.431
    7   HD11  LEU  21          HD12      LEU  21   3.305  16.406 -11.892
    8   HD13  LEU  21          HD13      LEU  21   3.621  14.709 -12.251
    9   HD22  LEU  21          HD21      LEU  21   7.116  17.024 -12.233
   10   HD21  LEU  21          HD22      LEU  21   5.767  17.975 -11.618
   11   HD23  LEU  21          HD23      LEU  21   5.725  17.358 -13.262

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ALA  22           H        ALA  22   5.754  14.161  -7.739
    2    HA   ALA  22           HA       ALA  22   5.158  15.969  -5.670
    3    HB3  ALA  22           HB1      ALA  22   4.385  13.581  -5.837
    4    HB2  ALA  22           HB2      ALA  22   4.974  14.048  -4.241
    5    HB1  ALA  22           HB3      ALA  22   5.993  13.086  -5.312

  No H/Q in entry =           5
  In of MODEL   23
    1    H    TYR  23           H        TYR  23   8.082  13.930  -6.108
    2    HA   TYR  23           HA       TYR  23   9.468  14.939  -3.853
    3    HB2  TYR  23           HB2      TYR  23  10.248  12.930  -5.010
    4    HB3  TYR  23           HB3      TYR  23  10.563  13.865  -6.471
    5    HD1  TYR  23           HD1      TYR  23  11.529  13.526  -2.880
    6    HD2  TYR  23           HD2      TYR  23  12.603  15.030  -6.759
    7    HE1  TYR  23           HE1      TYR  23  13.791  14.096  -2.035
    8    HE2  TYR  23           HE2      TYR  23  14.862  15.600  -5.914
    9    HH   TYR  23           HH       TYR  23  16.039  14.470  -2.910

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ALA  24           H        ALA  24   9.293  16.051  -7.218
    2    HA   ALA  24           HA       ALA  24  11.198  18.128  -6.968
    3    HB2  ALA  24           HB1      ALA  24  10.758  18.194  -9.177
    4    HB3  ALA  24           HB2      ALA  24   9.205  18.950  -8.818
    5    HB1  ALA  24           HB3      ALA  24   9.323  17.197  -8.950

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA  25           H        ALA  25   7.718  17.957  -6.350
    2    HA   ALA  25           HA       ALA  25   7.248  20.676  -5.778
    3    HB1  ALA  25           HB1      ALA  25   5.579  18.684  -5.983
    4    HB2  ALA  25           HB2      ALA  25   5.215  19.973  -4.834
    5    HB3  ALA  25           HB3      ALA  25   5.898  18.449  -4.264

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU  26           H        LEU  26   8.304  17.990  -3.730
    2    HA   LEU  26           HA       LEU  26   8.412  19.418  -1.292
    3    HB2  LEU  26           HB2      LEU  26   8.499  17.001  -1.289
    4    HB3  LEU  26           HB3      LEU  26   9.970  17.005  -2.258
    5    HG   LEU  26           HG       LEU  26  11.187  18.117  -0.416
    6   HD12  LEU  26          HD11      LEU  26   9.958  18.126   1.843
    7   HD11  LEU  26          HD12      LEU  26   8.471  17.995   0.907
    8   HD13  LEU  26          HD13      LEU  26   9.521  19.397   0.700
    9   HD21  LEU  26          HD21      LEU  26   9.644  15.653   0.453
   10   HD23  LEU  26          HD22      LEU  26  11.161  16.210   1.153
   11   HD22  LEU  26          HD23      LEU  26  11.115  15.653  -0.518

  No H/Q in entry =          11
  In of MODEL   23
    1    H    LYS  27           H        LYS  27  10.829  18.840  -3.815
    2    HA   LYS  27           HA       LYS  27  13.016  20.073  -2.584
    3    HB2  LYS  27           HB2      LYS  27  13.115  18.728  -4.675
    4    HB3  LYS  27           HB3      LYS  27  12.355  20.063  -5.539
    5    HG2  LYS  27           HG2      LYS  27  14.224  21.542  -4.959
    6    HG3  LYS  27           HG3      LYS  27  14.980  20.247  -4.023
    7    HD2  LYS  27           HD2      LYS  27  15.121  18.861  -6.078
    8    HD3  LYS  27           HD3      LYS  27  14.411  20.182  -7.006
    9    HE2  LYS  27           HE2      LYS  27  16.302  21.642  -6.390
   10    HE3  LYS  27           HE3      LYS  27  17.016  20.325  -5.453
   11    HZ3  LYS  27           HZ1      LYS  27  18.008  20.424  -7.639
   12    HZ2  LYS  27           HZ2      LYS  27  16.482  20.311  -8.381
   13    HZ1  LYS  27           HZ3      LYS  27  17.101  18.997  -7.497

  No H/Q in entry =          13
  In of MODEL   23
    1    H    GLN  28           H        GLN  28  10.399  21.464  -4.533
    2    HA   GLN  28           HA       GLN  28  11.366  24.114  -4.683
    3    HB2  GLN  28           HB2      GLN  28   8.530  23.049  -4.576
    4    HB3  GLN  28           HB3      GLN  28   8.946  24.723  -4.946
    5    HG2  GLN  28           HG2      GLN  28   9.935  22.311  -6.496
    6    HG3  GLN  28           HG3      GLN  28   8.608  23.356  -7.001
    7   HE21  GLN  28          HE21      GLN  28  11.710  22.840  -7.786
    8   HE22  GLN  28          HE22      GLN  28  12.222  24.424  -8.123

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ALA  29           H        ALA  29   9.427  22.425  -2.250
    2    HA   ALA  29           HA       ALA  29   8.882  24.616  -0.567
    3    HB2  ALA  29           HB1      ALA  29   8.148  23.048   1.000
    4    HB1  ALA  29           HB2      ALA  29   9.367  21.861   0.534
    5    HB3  ALA  29           HB3      ALA  29   7.982  22.159  -0.515

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LYS  30           H        LYS  30  11.607  22.343  -0.636
    2    HA   LYS  30           HA       LYS  30  12.925  23.291   1.669
    3    HB2  LYS  30           HB2      LYS  30  14.021  22.005  -0.842
    4    HB3  LYS  30           HB3      LYS  30  15.003  22.361   0.581
    5    HG2  LYS  30           HG2      LYS  30  13.445  20.980   1.958
    6    HG3  LYS  30           HG3      LYS  30  12.561  20.562   0.487
    7    HD2  LYS  30           HD2      LYS  30  14.604  19.572  -0.473
    8    HD3  LYS  30           HD3      LYS  30  15.508  20.004   0.980
    9    HE2  LYS  30           HE2      LYS  30  13.999  18.575   2.332
   10    HE3  LYS  30           HE3      LYS  30  13.124  18.122   0.863
   11    HZ2  LYS  30           HZ1      LYS  30  14.912  16.539   1.623
   12    HZ1  LYS  30           HZ2      LYS  30  16.052  17.724   1.174
   13    HZ3  LYS  30           HZ3      LYS  30  15.016  17.044   0.008

  No H/Q in entry =          13
  In of MODEL   23
    1    H    GLN  31           H        GLN  31  12.822  24.499  -1.627
    2    HA   GLN  31           HA       GLN  31  14.978  26.387  -1.202
    3    HB2  GLN  31           HB2      GLN  31  12.937  26.441  -3.428
    4    HB3  GLN  31           HB3      GLN  31  14.559  27.133  -3.427
    5    HG2  GLN  31           HG2      GLN  31  15.014  24.435  -2.853
    6    HG3  GLN  31           HG3      GLN  31  13.711  24.385  -4.033
    7   HE21  GLN  31          HE21      GLN  31  16.553  23.586  -4.436
    8   HE22  GLN  31          HE22      GLN  31  17.129  24.559  -5.701

  No H/Q in entry =           8
  In of MODEL   23
    1    H    GLY  32           H        GLY  32  11.903  26.211  -0.059
    2    HA3  GLY  32           HA2      GLY  32  10.749  27.780   1.215
    3    HA2  GLY  32           HA3      GLY  32  11.878  29.014   0.667

  No H/Q in entry =           3
  In of MODEL   23
    1    H    ASP  33           H        ASP  33  10.511  27.115  -1.828
    2    HA   ASP  33           HA       ASP  33   8.852  29.392  -2.683
    3    HB2  ASP  33           HB2      ASP  33   9.941  26.972  -4.127
    4    HB3  ASP  33           HB3      ASP  33   8.793  28.091  -4.857

  No H/Q in entry =           4
  In of MODEL   23
    1    H    PHE  34           H        PHE  34   7.162  28.919  -1.121
    2    HA   PHE  34           HA       PHE  34   5.776  26.450  -1.029
    3    HB2  PHE  34           HB2      PHE  34   4.821  29.238  -0.347
    4    HB3  PHE  34           HB3      PHE  34   3.969  27.749   0.062
    5    HD1  PHE  34           HD1      PHE  34   6.223  30.142   1.281
    6    HD2  PHE  34           HD2      PHE  34   5.534  25.902   1.223
    7    HE1  PHE  34           HE1      PHE  34   7.612  29.886   3.318
    8    HE2  PHE  34           HE2      PHE  34   6.924  25.651   3.258
    9    HZ   PHE  34           HZ       PHE  34   7.957  27.644   4.305

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ALA  35           H        ALA  35   5.354  29.316  -3.037
    2    HA   ALA  35           HA       ALA  35   2.802  28.709  -4.065
    3    HB3  ALA  35           HB1      ALA  35   3.858  30.100  -6.100
    4    HB2  ALA  35           HB2      ALA  35   5.076  30.458  -4.875
    5    HB1  ALA  35           HB3      ALA  35   3.386  30.870  -4.585

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA  36           H        ALA  36   6.030  28.030  -5.417
    2    HA   ALA  36           HA       ALA  36   5.040  26.605  -7.663
    3    HB3  ALA  36           HB1      ALA  36   7.200  26.725  -8.277
    4    HB2  ALA  36           HB2      ALA  36   7.678  25.694  -6.927
    5    HB1  ALA  36           HB3      ALA  36   7.576  27.442  -6.710

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA  37           H        ALA  37   5.991  25.605  -4.408
    2    HA   ALA  37           HA       ALA  37   5.927  22.818  -4.840
    3    HB2  ALA  37           HB1      ALA  37   5.668  24.607  -2.460
    4    HB1  ALA  37           HB2      ALA  37   6.799  23.287  -2.753
    5    HB3  ALA  37           HB3      ALA  37   5.136  22.936  -2.283

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LYS  38           H        LYS  38   3.398  25.030  -3.672
    2    HA   LYS  38           HA       LYS  38   1.295  23.221  -3.452
    3    HB2  LYS  38           HB2      LYS  38   1.652  25.976  -3.198
    4    HB3  LYS  38           HB3      LYS  38   0.453  25.832  -4.478
    5    HG2  LYS  38           HG2      LYS  38  -1.000  24.510  -3.038
    6    HG3  LYS  38           HG3      LYS  38   0.243  24.447  -1.781
    7    HD2  LYS  38           HD2      LYS  38   0.061  26.783  -1.332
    8    HD3  LYS  38           HD3      LYS  38  -0.849  27.075  -2.814
    9    HE2  LYS  38           HE2      LYS  38  -2.354  27.110  -0.876
   10    HE3  LYS  38           HE3      LYS  38  -2.730  25.736  -1.919
   11    HZ3  LYS  38           HZ1      LYS  38  -2.008  24.262  -0.387
   12    HZ2  LYS  38           HZ2      LYS  38  -2.357  25.519   0.703
   13    HZ1  LYS  38           HZ3      LYS  38  -0.763  25.266   0.179

  No H/Q in entry =          13
  In of MODEL   23
    1    H    ALA  39           H        ALA  39   2.280  25.124  -6.299
    2    HA   ALA  39           HA       ALA  39   0.204  24.262  -8.004
    3    HB2  ALA  39           HB1      ALA  39   2.943  24.906  -9.055
    4    HB1  ALA  39           HB2      ALA  39   1.978  26.168  -8.289
    5    HB3  ALA  39           HB3      ALA  39   1.365  25.334  -9.717

  No H/Q in entry =           5
  In of MODEL   23
    1    H    MET  40           H        MET  40   3.439  22.956  -7.423
    2    HA   MET  40           HA       MET  40   3.339  20.938  -9.417
    3    HB2  MET  40           HB2      MET  40   4.949  21.157  -6.867
    4    HB3  MET  40           HB3      MET  40   5.198  19.901  -8.082
    5    HG2  MET  40           HG2      MET  40   5.262  22.858  -8.745
    6    HG3  MET  40           HG3      MET  40   6.706  21.952  -8.295
    7    HE3  MET  40           HE1      MET  40   7.576  19.738 -11.105
    8    HE2  MET  40           HE2      MET  40   7.011  19.418  -9.468
    9    HE1  MET  40           HE3      MET  40   8.109  20.763  -9.766

  No H/Q in entry =           9
  In of MODEL   23
    1    H    MET  41           H        MET  41   2.422  20.979  -5.993
    2    HA   MET  41           HA       MET  41   1.884  18.215  -5.719
    3    HB2  MET  41           HB2      MET  41   0.554  20.574  -4.366
    4    HB3  MET  41           HB3      MET  41   0.395  18.896  -3.860
    5    HG2  MET  41           HG2      MET  41   3.106  19.114  -3.895
    6    HG3  MET  41           HG3      MET  41   2.668  20.773  -3.498
    7    HE2  MET  41           HE1      MET  41  -0.375  19.523  -1.776
    8    HE1  MET  41           HE2      MET  41   0.445  21.035  -2.151
    9    HE3  MET  41           HE3      MET  41   0.383  20.463  -0.484

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ASP  42           H        ASP  42  -0.149  20.944  -6.691
    2    HA   ASP  42           HA       ASP  42  -2.592  19.587  -6.831
    3    HB2  ASP  42           HB2      ASP  42  -1.881  22.157  -7.085
    4    HB3  ASP  42           HB3      ASP  42  -2.031  21.764  -8.794

  No H/Q in entry =           4
  In of MODEL   23
    1    H    GLN  43           H        GLN  43  -0.148  20.177  -9.331
    2    HA   GLN  43           HA       GLN  43  -1.536  18.862 -11.423
    3    HB2  GLN  43           HB2      GLN  43   1.423  19.373 -11.038
    4    HB3  GLN  43           HB3      GLN  43   0.709  18.736 -12.522
    5    HG2  GLN  43           HG2      GLN  43  -0.799  20.765 -12.562
    6    HG3  GLN  43           HG3      GLN  43   0.154  21.418 -11.233
    7   HE21  GLN  43          HE21      GLN  43   0.319  23.041 -13.317
    8   HE22  GLN  43          HE22      GLN  43   1.734  22.818 -14.224

  No H/Q in entry =           8
  In of MODEL   23
    1    H    SER  44           H        SER  44   0.811  17.716  -9.031
    2    HA   SER  44           HA       SER  44   1.144  15.110 -10.059
    3    HB2  SER  44           HB2      SER  44   2.039  16.545  -7.820
    4    HB3  SER  44           HB3      SER  44   1.174  15.162  -7.151
    5    HG   SER  44           HG       SER  44   3.284  14.540  -7.577

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ARG  45           H        ARG  45  -1.176  16.429  -7.721
    2    HA   ARG  45           HA       ARG  45  -2.566  14.069  -7.090
    3    HB2  ARG  45           HB2      ARG  45  -2.763  16.236  -5.896
    4    HB3  ARG  45           HB3      ARG  45  -3.617  16.905  -7.283
    5    HG2  ARG  45           HG2      ARG  45  -5.385  15.181  -7.003
    6    HG3  ARG  45           HG3      ARG  45  -4.543  14.567  -5.579
    7    HD2  ARG  45           HD2      ARG  45  -4.748  16.833  -4.521
    8    HD3  ARG  45           HD3      ARG  45  -5.733  17.355  -5.904
    9    HE   ARG  45           HE       ARG  45  -6.846  14.979  -4.867
   10   HH21  ARG  45          HH11      ARG  45  -8.683  15.055  -3.598
   11   HH22  ARG  45          HH12      ARG  45  -9.078  16.495  -2.728
   12   HH11  ARG  45          HH21      ARG  45  -6.298  18.224  -3.840
   13   HH12  ARG  45          HH22      ARG  45  -7.722  18.289  -2.863

  No H/Q in entry =          13
  In of MODEL   23
    1    H    MET  46           H        MET  46  -3.146  16.476  -9.638
    2    HA   MET  46           HA       MET  46  -5.485  15.307 -10.703
    3    HB2  MET  46           HB2      MET  46  -3.381  17.134 -11.873
    4    HB3  MET  46           HB3      MET  46  -4.762  16.579 -12.825
    5    HG2  MET  46           HG2      MET  46  -6.312  17.515 -11.186
    6    HG3  MET  46           HG3      MET  46  -4.972  17.996 -10.151
    7    HE3  MET  46           HE1      MET  46  -5.319  18.358 -14.232
    8    HE2  MET  46           HE2      MET  46  -6.360  19.773 -14.117
    9    HE1  MET  46           HE3      MET  46  -6.842  18.266 -13.338

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ALA  47           H        ALA  47  -2.056  14.826 -11.459
    2    HA   ALA  47           HA       ALA  47  -2.401  13.101 -13.671
    3    HB3  ALA  47           HB1      ALA  47  -0.223  13.989 -13.316
    4    HB2  ALA  47           HB2      ALA  47  -0.083  12.260 -12.984
    5    HB1  ALA  47           HB3      ALA  47  -0.176  13.411 -11.650

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU  48           H        LEU  48  -2.135  12.462 -10.197
    2    HA   LEU  48           HA       LEU  48  -2.231   9.622 -10.359
    3    HB2  LEU  48           HB2      LEU  48  -2.995  11.538  -8.144
    4    HB3  LEU  48           HB3      LEU  48  -2.903   9.787  -7.944
    5    HG   LEU  48           HG       LEU  48  -0.602  11.487  -8.938
    6   HD13  LEU  48          HD11      LEU  48  -0.886  12.255  -6.747
    7   HD12  LEU  48          HD12      LEU  48   0.276  10.946  -6.549
    8   HD11  LEU  48          HD13      LEU  48  -1.422  10.684  -6.153
    9   HD22  LEU  48          HD21      LEU  48  -0.104   9.301  -9.581
   10   HD21  LEU  48          HD22      LEU  48  -0.975   8.585  -8.226
   11   HD23  LEU  48          HD23      LEU  48   0.598   9.337  -7.964

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ASN  49           H        ASN  49  -4.693  12.115  -9.957
    2    HA   ASN  49           HA       ASN  49  -6.880  10.451  -9.421
    3    HB2  ASN  49           HB2      ASN  49  -6.941  12.871  -9.093
    4    HB3  ASN  49           HB3      ASN  49  -6.770  13.137 -10.824
    5   HD21  ASN  49          HD21      ASN  49  -8.983  14.213  -9.480
    6   HD22  ASN  49          HD22      ASN  49 -10.386  13.381  -9.945

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLU  50           H        GLU  50  -5.597  11.650 -12.506
    2    HA   GLU  50           HA       GLU  50  -7.550  10.397 -14.155
    3    HB2  GLU  50           HB2      GLU  50  -6.083  12.216 -14.966
    4    HB3  GLU  50           HB3      GLU  50  -4.689  11.143 -14.827
    5    HG2  GLU  50           HG2      GLU  50  -5.662   9.610 -16.466
    6    HG3  GLU  50           HG3      GLU  50  -7.122  10.589 -16.555

  No H/Q in entry =           6
  In of MODEL   23
    1    H    ALA  51           H        ALA  51  -4.382   9.402 -12.947
    2    HA   ALA  51           HA       ALA  51  -4.242   6.951 -14.367
    3    HB2  ALA  51           HB1      ALA  51  -2.262   6.660 -13.265
    4    HB1  ALA  51           HB2      ALA  51  -2.952   7.082 -11.698
    5    HB3  ALA  51           HB3      ALA  51  -2.494   8.353 -12.831

  No H/Q in entry =           5
  In of MODEL   23
    1    H    HIS  52           H        HIS  52  -5.418   7.780 -11.119
    2    HA   HIS  52           HA       HIS  52  -6.106   5.170 -10.290
    3    HB2  HIS  52           HB2      HIS  52  -5.966   7.144  -8.786
    4    HB3  HIS  52           HB3      HIS  52  -7.437   7.777  -9.524
    5    HD1  HIS  52           HD1      HIS  52  -9.646   6.333  -9.185
    6    HD2  HIS  52           HD2      HIS  52  -6.388   5.132  -6.879
    7    HE1  HIS  52           HE1      HIS  52 -10.565   4.804  -7.387
    8    HE2  HIS  52           HE2      HIS  52  -8.590   4.064  -5.972

  No H/Q in entry =           8
  In of MODEL   23
    1    H    LEU  53           H        LEU  53  -7.922   7.631 -12.078
    2    HA   LEU  53           HA       LEU  53 -10.428   6.341 -12.095
    3    HB2  LEU  53           HB2      LEU  53  -9.141   8.319 -13.965
    4    HB3  LEU  53           HB3      LEU  53 -10.743   7.660 -14.282
    5    HG   LEU  53           HG       LEU  53 -10.018   8.971 -11.643
    6   HD11  LEU  53          HD11      LEU  53 -11.088  10.165 -14.203
    7   HD13  LEU  53          HD12      LEU  53  -9.727  10.717 -13.226
    8   HD12  LEU  53          HD13      LEU  53 -11.375  10.916 -12.639
    9   HD23  LEU  53          HD21      LEU  53 -12.604   9.373 -11.781
   10   HD22  LEU  53          HD22      LEU  53 -12.021   7.777 -11.327
   11   HD21  LEU  53          HD23      LEU  53 -12.588   8.068 -12.959

  No H/Q in entry =          11
  In of MODEL   23
    1    H    VAL  54           H        VAL  54  -7.675   6.143 -14.329
    2    HA   VAL  54           HA       VAL  54  -8.898   4.375 -16.175
    3    HB   VAL  54           HB       VAL  54  -5.990   4.878 -15.488
    4   HG12  VAL  54          HG11      VAL  54  -5.742   3.795 -17.878
    5   HG11  VAL  54          HG12      VAL  54  -7.271   3.015 -17.477
    6   HG13  VAL  54          HG13      VAL  54  -5.857   2.758 -16.457
    7   HG22  VAL  54          HG21      VAL  54  -6.757   6.823 -16.532
    8   HG21  VAL  54          HG22      VAL  54  -7.950   5.962 -17.503
    9   HG23  VAL  54          HG23      VAL  54  -6.243   5.880 -17.931

  No H/Q in entry =           9
  In of MODEL   23
    1    H    GLN  55           H        GLN  55  -6.903   3.824 -13.273
    2    HA   GLN  55           HA       GLN  55  -6.817   1.007 -13.532
    3    HB2  GLN  55           HB2      GLN  55  -5.262   1.900 -12.010
    4    HB3  GLN  55           HB3      GLN  55  -6.478   2.867 -11.181
    5    HG2  GLN  55           HG2      GLN  55  -7.171   1.109  -9.866
    6    HG3  GLN  55           HG3      GLN  55  -6.946  -0.077 -11.145
    7   HE21  GLN  55          HE21      GLN  55  -5.325  -1.529 -10.650
    8   HE22  GLN  55          HE22      GLN  55  -3.941  -1.180  -9.736

  No H/Q in entry =           8
  In of MODEL   23
    1    H    THR  56           H        THR  56  -9.147   3.172 -11.919
    2    HA   THR  56           HA       THR  56 -10.736   1.290 -10.633
    3    HB   THR  56           HB       THR  56 -11.832   3.676 -12.139
    4    HG1  THR  56           HG1      THR  56 -10.146   3.486  -9.972
    5   HG22  THR  56          HG21      THR  56 -12.733   2.698  -9.454
    6   HG21  THR  56          HG22      THR  56 -13.270   1.847 -10.902
    7   HG23  THR  56          HG23      THR  56 -13.646   3.558 -10.692

  No H/Q in entry =           7
  In of MODEL   23
    1    H    LYS  57           H        LYS  57 -10.931   2.376 -14.018
    2    HA   LYS  57           HA       LYS  57 -13.089   0.692 -14.776
    3    HB2  LYS  57           HB2      LYS  57 -12.194   2.647 -16.086
    4    HB3  LYS  57           HB3      LYS  57 -10.771   1.689 -16.465
    5    HG2  LYS  57           HG2      LYS  57 -12.174   0.026 -17.609
    6    HG3  LYS  57           HG3      LYS  57 -13.616   0.953 -17.211
    7    HD2  LYS  57           HD2      LYS  57 -12.772   2.855 -18.535
    8    HD3  LYS  57           HD3      LYS  57 -11.316   1.944 -18.929
    9    HE2  LYS  57           HE2      LYS  57 -12.908   1.782 -20.788
   10    HE3  LYS  57           HE3      LYS  57 -12.746   0.199 -20.028
   11    HZ2  LYS  57           HZ1      LYS  57 -15.068   0.905 -20.489
   12    HZ1  LYS  57           HZ2      LYS  57 -14.877   2.140 -19.337
   13    HZ3  LYS  57           HZ3      LYS  57 -14.770   0.510 -18.866

  No H/Q in entry =          13
  In of MODEL   23
    1    H    LEU  58           H        LEU  58  -9.586   0.256 -14.715
    2    HA   LEU  58           HA       LEU  58  -9.596  -2.260 -16.005
    3    HB2  LEU  58           HB2      LEU  58  -7.562  -0.973 -14.193
    4    HB3  LEU  58           HB3      LEU  58  -7.302  -2.494 -15.048
    5    HG   LEU  58           HG       LEU  58  -8.050   0.112 -16.411
    6   HD11  LEU  58          HD11      LEU  58  -5.407  -1.129 -15.716
    7   HD13  LEU  58          HD12      LEU  58  -5.899   0.563 -15.667
    8   HD12  LEU  58          HD13      LEU  58  -5.559  -0.208 -17.213
    9   HD22  LEU  58          HD21      LEU  58  -8.626  -1.448 -18.003
   10   HD21  LEU  58          HD22      LEU  58  -7.588  -2.697 -17.321
   11   HD23  LEU  58          HD23      LEU  58  -6.893  -1.424 -18.324

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  59           H        ILE  59 -10.421  -1.358 -12.755
    2    HA   ILE  59           HA       ILE  59 -10.075  -4.127 -11.808
    3    HB   ILE  59           HB       ILE  59  -9.632  -1.858 -10.408
    4   HG12  ILE  59          HG12      ILE  59 -10.995  -4.218  -9.091
    5   HG13  ILE  59          HG13      ILE  59  -9.350  -4.285  -9.670
    6   HG22  ILE  59          HG21      ILE  59 -12.389  -2.586  -9.462
    7   HG21  ILE  59          HG22      ILE  59 -12.177  -1.349 -10.680
    8   HG23  ILE  59          HG23      ILE  59 -11.451  -1.160  -9.085
    9   HD12  ILE  59          HD11      ILE  59 -10.434  -2.367  -7.621
   10   HD11  ILE  59          HD12      ILE  59  -8.797  -2.301  -8.260
   11   HD13  ILE  59          HD13      ILE  59  -9.319  -3.694  -7.311

  No H/Q in entry =          11
  In of MODEL   23
    1    H    GLU  60           H        GLU  60 -12.629  -1.807 -12.619
    2    HA   GLU  60           HA       GLU  60 -14.817  -3.321 -11.611
    3    HB2  GLU  60           HB2      GLU  60 -15.051  -0.959 -12.192
    4    HB3  GLU  60           HB3      GLU  60 -14.683  -1.312 -13.877
    5    HG2  GLU  60           HG2      GLU  60 -16.706  -2.759 -13.992
    6    HG3  GLU  60           HG3      GLU  60 -17.091  -2.316 -12.342

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLY  61           H        GLY  61 -13.138  -3.307 -14.723
    2    HA3  GLY  61           HA2      GLY  61 -14.853  -5.549 -15.617
    3    HA2  GLY  61           HA3      GLY  61 -14.005  -4.445 -16.693

  No H/Q in entry =           3
  In of MODEL   23
    1    H    ASP  62           H        ASP  62 -12.638  -5.897 -13.807
    2    HA   ASP  62           HA       ASP  62 -10.322  -6.788 -15.178
    3    HB2  ASP  62           HB2      ASP  62  -9.731  -7.785 -13.007
    4    HB3  ASP  62           HB3      ASP  62 -10.323  -6.140 -12.810

  No H/Q in entry =           4
  In of MODEL   23
    1    H    ALA  63           H        ALA  63  -9.753  -8.764 -16.049
    2    HA   ALA  63           HA       ALA  63 -11.229 -11.197 -15.436
    3    HB2  ALA  63           HB1      ALA  63 -12.142 -11.578 -17.623
    4    HB1  ALA  63           HB2      ALA  63 -11.279 -10.195 -18.296
    5    HB3  ALA  63           HB3      ALA  63 -12.623  -9.941 -17.182

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLY  64           H        GLY  64  -9.146  -9.648 -17.855
    2    HA3  GLY  64           HA2      GLY  64  -7.175 -10.278 -18.837
    3    HA2  GLY  64           HA3      GLY  64  -6.808 -11.066 -17.308

  No H/Q in entry =           3
  In of MODEL   23
    1    H    GLU  65           H        GLU  65  -7.430 -13.291 -17.015
    2    HA   GLU  65           HA       GLU  65  -7.141 -14.802 -19.440
    3    HB2  GLU  65           HB2      GLU  65  -7.549 -15.675 -16.579
    4    HB3  GLU  65           HB3      GLU  65  -7.241 -16.776 -17.923
    5    HG2  GLU  65           HG2      GLU  65  -5.087 -16.409 -17.085
    6    HG3  GLU  65           HG3      GLU  65  -5.188 -15.228 -18.389

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLY  66           H        GLY  66  -8.449 -16.798 -19.725
    2    HA3  GLY  66           HA2      GLY  66 -11.081 -16.185 -20.475
    3    HA2  GLY  66           HA3      GLY  66 -10.370 -17.787 -20.432

  No H/Q in entry =           3
  In of MODEL   23
    1    H    LYS  67           H        LYS  67  -9.838 -17.865 -17.650
    2    HA   LYS  67           HA       LYS  67 -12.426 -18.679 -16.718
    3    HB2  LYS  67           HB2      LYS  67  -9.681 -18.798 -15.479
    4    HB3  LYS  67           HB3      LYS  67 -11.132 -19.484 -14.736
    5    HG2  LYS  67           HG2      LYS  67 -11.526 -20.813 -16.808
    6    HG3  LYS  67           HG3      LYS  67 -10.019 -20.185 -17.470
    7    HD2  LYS  67           HD2      LYS  67 -10.166 -21.694 -14.849
    8    HD3  LYS  67           HD3      LYS  67  -9.846 -22.476 -16.399
    9    HE2  LYS  67           HE2      LYS  67  -7.962 -20.762 -16.706
   10    HE3  LYS  67           HE3      LYS  67  -8.176 -20.382 -14.996
   11    HZ1  LYS  67           HZ1      LYS  67  -7.619 -23.092 -16.075
   12    HZ3  LYS  67           HZ2      LYS  67  -7.734 -22.662 -14.436
   13    HZ2  LYS  67           HZ3      LYS  67  -6.458 -22.067 -15.385

  No H/Q in entry =          13
  In of MODEL   23
    1    H    MET  68           H        MET  68 -12.280 -18.379 -14.042
    2    HA   MET  68           HA       MET  68 -13.566 -15.934 -13.576
    3    HB2  MET  68           HB2      MET  68 -12.339 -17.892 -11.632
    4    HB3  MET  68           HB3      MET  68 -13.445 -16.590 -11.194
    5    HG2  MET  68           HG2      MET  68 -14.082 -18.808 -13.160
    6    HG3  MET  68           HG3      MET  68 -14.620 -18.764 -11.480
    7    HE3  MET  68           HE1      MET  68 -17.110 -16.174 -11.081
    8    HE2  MET  68           HE2      MET  68 -15.485 -15.494 -11.072
    9    HE1  MET  68           HE3      MET  68 -15.762 -17.106 -10.415

  No H/Q in entry =           9
  In of MODEL   23
    1    H    LYS  69           H        LYS  69 -10.178 -16.854 -12.904
    2    HA   LYS  69           HA       LYS  69  -9.326 -14.954 -11.205
    3    HB2  LYS  69           HB2      LYS  69  -7.931 -15.975 -13.676
    4    HB3  LYS  69           HB3      LYS  69  -7.120 -15.010 -12.439
    5    HG2  LYS  69           HG2      LYS  69  -7.740 -16.667 -10.725
    6    HG3  LYS  69           HG3      LYS  69  -8.579 -17.625 -11.944
    7    HD2  LYS  69           HD2      LYS  69  -6.460 -17.949 -13.159
    8    HD3  LYS  69           HD3      LYS  69  -5.615 -16.983 -11.950
    9    HE2  LYS  69           HE2      LYS  69  -6.271 -18.598 -10.199
   10    HE3  LYS  69           HE3      LYS  69  -7.106 -19.568 -11.410
   11    HZ2  LYS  69           HZ1      LYS  69  -4.623 -20.041 -10.716
   12    HZ1  LYS  69           HZ2      LYS  69  -4.314 -18.884 -11.920
   13    HZ3  LYS  69           HZ3      LYS  69  -5.172 -20.302 -12.298

  No H/Q in entry =          13
  In of MODEL   23
    1    H    VAL  70           H        VAL  70  -7.539 -13.161 -11.984
    2    HA   VAL  70           HA       VAL  70  -8.951 -11.219 -13.723
    3    HB   VAL  70           HB       VAL  70  -8.234  -9.449 -12.142
    4   HG13  VAL  70          HG11      VAL  70 -10.471 -10.135 -11.828
    5   HG12  VAL  70          HG12      VAL  70  -9.773 -10.266 -10.213
    6   HG11  VAL  70          HG13      VAL  70  -9.990 -11.710 -11.200
    7   HG22  VAL  70          HG21      VAL  70  -6.344 -10.302 -11.006
    8   HG21  VAL  70          HG22      VAL  70  -7.133 -11.843 -10.678
    9   HG23  VAL  70          HG23      VAL  70  -7.603 -10.403  -9.776

  No H/Q in entry =           9
  In of MODEL   23
    1    H    SER  71           H        SER  71  -7.475  -9.449 -14.432
    2    HA   SER  71           HA       SER  71  -5.175 -10.441 -15.734
    3    HB2  SER  71           HB2      SER  71  -6.484  -8.418 -16.441
    4    HB3  SER  71           HB3      SER  71  -5.803  -7.556 -15.063
    5    HG   SER  71           HG       SER  71  -4.519  -8.594 -17.350

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU  72           H        LEU  72  -3.191 -10.752 -15.043
    2    HA   LEU  72           HA       LEU  72  -2.475 -10.539 -12.330
    3    HB2  LEU  72           HB2      LEU  72  -0.816 -10.969 -14.809
    4    HB3  LEU  72           HB3      LEU  72  -0.159 -11.047 -13.178
    5    HG   LEU  72           HG       LEU  72  -2.513 -12.731 -14.095
    6   HD11  LEU  72          HD11      LEU  72   0.439 -13.422 -13.968
    7   HD13  LEU  72          HD12      LEU  72  -0.544 -13.316 -15.427
    8   HD12  LEU  72          HD13      LEU  72  -0.860 -14.584 -14.243
    9   HD22  LEU  72          HD21      LEU  72  -2.533 -12.749 -11.747
   10   HD21  LEU  72          HD22      LEU  72  -0.786 -12.621 -11.619
   11   HD23  LEU  72          HD23      LEU  72  -1.521 -14.144 -12.111

  No H/Q in entry =          11
  In of MODEL   23
    1    H    VAL  73           H        VAL  73  -1.750  -8.524 -15.109
    2    HA   VAL  73           HA       VAL  73   0.173  -6.829 -14.002
    3    HB   VAL  73           HB       VAL  73  -0.213  -5.411 -15.860
    4   HG11  VAL  73          HG11      VAL  73   0.634  -7.716 -16.357
    5   HG13  VAL  73          HG12      VAL  73  -0.232  -6.989 -17.709
    6   HG12  VAL  73          HG13      VAL  73  -1.022  -8.206 -16.709
    7   HG21  VAL  73          HG21      VAL  73  -2.981  -6.550 -15.693
    8   HG23  VAL  73          HG22      VAL  73  -2.384  -5.999 -17.258
    9   HG22  VAL  73          HG23      VAL  73  -2.474  -4.873 -15.903

  No H/Q in entry =           9
  In of MODEL   23
    1    H    LEU  74           H        LEU  74  -3.226  -6.937 -13.450
    2    HA   LEU  74           HA       LEU  74  -3.839  -4.280 -12.839
    3    HB2  LEU  74           HB2      LEU  74  -5.574  -5.935 -13.014
    4    HB3  LEU  74           HB3      LEU  74  -4.885  -6.870 -11.691
    5    HG   LEU  74           HG       LEU  74  -5.336  -4.997 -10.137
    6   HD13  LEU  74          HD11      LEU  74  -5.230  -3.058 -11.500
    7   HD12  LEU  74          HD12      LEU  74  -6.937  -3.212 -11.091
    8   HD11  LEU  74          HD13      LEU  74  -6.360  -3.725 -12.678
    9   HD22  LEU  74          HD21      LEU  74  -7.542  -5.571  -9.873
   10   HD21  LEU  74          HD22      LEU  74  -7.024  -6.821 -10.984
   11   HD23  LEU  74          HD23      LEU  74  -7.893  -5.434 -11.594

  No H/Q in entry =          11
  In of MODEL   23
    1    H    VAL  75           H        VAL  75  -2.808  -6.870 -10.675
    2    HA   VAL  75           HA       VAL  75  -2.610  -5.319  -8.331
    3    HB   VAL  75           HB       VAL  75  -1.120  -7.818  -9.120
    4   HG12  VAL  75          HG11      VAL  75  -0.663  -7.971  -6.645
    5   HG11  VAL  75          HG12      VAL  75  -1.330  -6.356  -6.462
    6   HG13  VAL  75          HG13      VAL  75   0.138  -6.594  -7.395
    7   HG22  VAL  75          HG21      VAL  75  -2.800  -8.935  -7.817
    8   HG21  VAL  75          HG22      VAL  75  -3.669  -7.827  -8.878
    9   HG23  VAL  75          HG23      VAL  75  -3.418  -7.411  -7.182

  No H/Q in entry =           9
  In of MODEL   23
    1    H    GLU  76           H        GLU  76  -0.199  -6.085 -10.863
    2    HA   GLU  76           HA       GLU  76   1.988  -4.743  -9.701
    3    HB2  GLU  76           HB2      GLU  76   2.199  -6.216 -11.681
    4    HB3  GLU  76           HB3      GLU  76   1.282  -5.066 -12.641
    5    HG2  GLU  76           HG2      GLU  76   3.616  -4.721 -13.139
    6    HG3  GLU  76           HG3      GLU  76   3.091  -3.348 -12.184

  No H/Q in entry =           6
  In of MODEL   23
    1    H    ALA  77           H        ALA  77  -0.537  -3.535 -11.895
    2    HA   ALA  77           HA       ALA  77   0.460  -0.891 -12.069
    3    HB1  ALA  77           HB1      ALA  77  -1.249  -1.871 -13.601
    4    HB2  ALA  77           HB2      ALA  77  -1.739  -0.313 -12.933
    5    HB3  ALA  77           HB3      ALA  77  -2.423  -1.803 -12.285

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLN  78           H        GLN  78  -1.816  -2.442  -9.862
    2    HA   GLN  78           HA       GLN  78  -2.621  -0.122  -8.462
    3    HB2  GLN  78           HB2      GLN  78  -3.734  -2.382  -8.381
    4    HB3  GLN  78           HB3      GLN  78  -2.402  -2.940  -7.371
    5    HG2  GLN  78           HG2      GLN  78  -2.927  -1.198  -5.714
    6    HG3  GLN  78           HG3      GLN  78  -4.259  -0.635  -6.722
    7   HE21  GLN  78          HE21      GLN  78  -6.077  -1.269  -5.479
    8   HE22  GLN  78          HE22      GLN  78  -6.369  -2.869  -4.990

  No H/Q in entry =           8
  In of MODEL   23
    1    H    LEU  79           H        LEU  79   0.052  -2.383  -8.007
    2    HA   LEU  79           HA       LEU  79   1.025  -1.488  -5.548
    3    HB2  LEU  79           HB2      LEU  79   1.894  -3.498  -6.614
    4    HB3  LEU  79           HB3      LEU  79   2.544  -2.547  -7.946
    5    HG   LEU  79           HG       LEU  79   4.098  -1.410  -6.439
    6   HD13  LEU  79          HD11      LEU  79   3.090  -1.164  -4.374
    7   HD12  LEU  79          HD12      LEU  79   4.166  -2.515  -4.028
    8   HD11  LEU  79          HD13      LEU  79   2.461  -2.812  -4.361
    9   HD23  LEU  79          HD21      LEU  79   5.304  -3.560  -5.533
   10   HD22  LEU  79          HD22      LEU  79   5.105  -3.361  -7.272
   11   HD21  LEU  79          HD23      LEU  79   4.023  -4.429  -6.382

  No H/Q in entry =          11
  In of MODEL   23
    1    H    HIS  80           H        HIS  80   1.903  -0.372  -8.818
    2    HA   HIS  80           HA       HIS  80   3.711   1.614  -7.892
    3    HB2  HIS  80           HB2      HIS  80   2.427   0.921 -10.478
    4    HB3  HIS  80           HB3      HIS  80   3.023   2.572 -10.306
    5    HD1  HIS  80           HD1      HIS  80   5.426   2.870 -10.823
    6    HD2  HIS  80           HD2      HIS  80   4.600  -1.040  -9.634
    7    HE1  HIS  80           HE1      HIS  80   7.615   1.591 -10.984
    8    HE2  HIS  80           HE2      HIS  80   7.123  -0.795 -10.263

  No H/Q in entry =           8
  In of MODEL   23
    1    H    LEU  81           H        LEU  81   0.310   1.776  -8.879
    2    HA   LEU  81           HA       LEU  81   0.036   4.569  -8.549
    3    HB2  LEU  81           HB2      LEU  81  -1.980   2.325  -8.475
    4    HB3  LEU  81           HB3      LEU  81  -2.432   4.028  -8.383
    5    HG   LEU  81           HG       LEU  81  -0.735   2.878 -10.616
    6   HD12  LEU  81          HD11      LEU  81  -2.964   3.199 -11.920
    7   HD11  LEU  81          HD12      LEU  81  -3.723   3.131 -10.330
    8   HD13  LEU  81          HD13      LEU  81  -2.779   1.763 -10.915
    9   HD23  LEU  81          HD21      LEU  81  -1.828   5.023 -11.715
   10   HD22  LEU  81          HD22      LEU  81  -0.414   5.193 -10.679
   11   HD21  LEU  81          HD23      LEU  81  -2.020   5.542 -10.042

  No H/Q in entry =          11
  In of MODEL   23
    1    H    MET  82           H        MET  82  -0.629   1.882  -6.302
    2    HA   MET  82           HA       MET  82  -1.686   3.468  -4.217
    3    HB2  MET  82           HB2      MET  82  -0.312   0.781  -4.254
    4    HB3  MET  82           HB3      MET  82  -0.894   1.506  -2.757
    5    HG2  MET  82           HG2      MET  82  -2.622   1.013  -5.202
    6    HG3  MET  82           HG3      MET  82  -2.547  -0.061  -3.807
    7    HE3  MET  82           HE1      MET  82  -4.276   1.588  -0.995
    8    HE2  MET  82           HE2      MET  82  -2.545   1.866  -1.176
    9    HE1  MET  82           HE3      MET  82  -3.232   0.309  -1.632

  No H/Q in entry =           9
  In of MODEL   23
    1    H    THR  83           H        THR  83   1.616   2.383  -4.899
    2    HA   THR  83           HA       THR  83   2.829   3.486  -2.596
    3    HB   THR  83           HB       THR  83   4.927   3.431  -4.065
    4    HG1  THR  83           HG1      THR  83   4.692   2.905  -6.089
    5   HG22  THR  83          HG21      THR  83   4.484   0.773  -4.398
    6   HG21  THR  83          HG22      THR  83   3.192   1.153  -3.261
    7   HG23  THR  83          HG23      THR  83   4.870   1.496  -2.838

  No H/Q in entry =           7
  In of MODEL   23
    1    H    SER  84           H        SER  84   2.466   4.767  -5.896
    2    HA   SER  84           HA       SER  84   3.804   7.207  -5.438
    3    HB2  SER  84           HB2      SER  84   1.738   6.375  -7.462
    4    HB3  SER  84           HB3      SER  84   2.416   8.002  -7.435
    5    HG   SER  84           HG       SER  84   3.790   5.527  -7.723

  No H/Q in entry =           5
  In of MODEL   23
    1    H    MET  85           H        MET  85   0.309   6.450  -5.274
    2    HA   MET  85           HA       MET  85  -0.553   9.061  -4.674
    3    HB2  MET  85           HB2      MET  85  -2.074   7.251  -5.347
    4    HB3  MET  85           HB3      MET  85  -1.790   6.445  -3.804
    5    HG2  MET  85           HG2      MET  85  -2.680   8.410  -2.606
    6    HG3  MET  85           HG3      MET  85  -2.948   9.227  -4.145
    7    HE2  MET  85           HE1      MET  85  -4.493   8.150  -6.105
    8    HE1  MET  85           HE2      MET  85  -5.108   9.421  -5.050
    9    HE3  MET  85           HE3      MET  85  -6.142   8.058  -5.470

  No H/Q in entry =           9
  In of MODEL   23
    1    H    LEU  86           H        LEU  86   0.361   6.397  -2.529
    2    HA   LEU  86           HA       LEU  86  -0.177   7.699  -0.088
    3    HB2  LEU  86           HB2      LEU  86   0.286   5.228  -0.482
    4    HB3  LEU  86           HB3      LEU  86   1.994   5.657  -0.573
    5    HG   LEU  86           HG       LEU  86   1.665   6.817   1.695
    6   HD11  LEU  86          HD11      LEU  86  -1.029   6.053   1.218
    7   HD13  LEU  86          HD12      LEU  86  -0.365   6.799   2.670
    8   HD12  LEU  86          HD13      LEU  86  -0.457   5.044   2.550
    9   HD23  LEU  86          HD21      LEU  86   1.234   3.825   1.815
   10   HD22  LEU  86          HD22      LEU  86   2.235   4.833   2.858
   11   HD21  LEU  86          HD23      LEU  86   2.739   4.509   1.200

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ALA  87           H        ALA  87   2.808   7.403  -1.971
    2    HA   ALA  87           HA       ALA  87   4.511   8.810  -0.242
    3    HB3  ALA  87           HB1      ALA  87   4.611   7.799  -2.949
    4    HB2  ALA  87           HB2      ALA  87   5.943   8.127  -1.845
    5    HB1  ALA  87           HB3      ALA  87   5.333   9.409  -2.890

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ARG  88           H        ARG  88   2.571   9.951  -2.966
    2    HA   ARG  88           HA       ARG  88   3.350  12.639  -2.845
    3    HB2  ARG  88           HB2      ARG  88   2.098  11.489  -4.706
    4    HB3  ARG  88           HB3      ARG  88   0.639  11.635  -3.726
    5    HG2  ARG  88           HG2      ARG  88   1.662  14.213  -3.639
    6    HG3  ARG  88           HG3      ARG  88   2.089  13.699  -5.269
    7    HD2  ARG  88           HD2      ARG  88  -0.051  13.784  -5.971
    8    HD3  ARG  88           HD3      ARG  88  -0.642  12.931  -4.545
    9    HE   ARG  88           HE       ARG  88  -0.825  15.709  -4.961
   10   HH21  ARG  88          HH11      ARG  88  -1.353  17.039  -3.224
   11   HH22  ARG  88          HH12      ARG  88  -1.061  16.500  -1.606
   12   HH11  ARG  88          HH21      ARG  88   0.181  13.443  -2.586
   13   HH12  ARG  88          HH22      ARG  88  -0.210  14.458  -1.245

  No H/Q in entry =          13
  In of MODEL   23
    1    H    GLU  89           H        GLU  89   0.640  10.969  -1.212
    2    HA   GLU  89           HA       GLU  89  -0.465  13.283  -0.008
    3    HB2  GLU  89           HB2      GLU  89  -1.588  11.046  -0.098
    4    HB3  GLU  89           HB3      GLU  89  -0.468  10.487   1.145
    5    HG2  GLU  89           HG2      GLU  89  -1.287  12.187   2.703
    6    HG3  GLU  89           HG3      GLU  89  -2.335  12.861   1.458

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LEU  90           H        LEU  90   1.978  10.983   1.170
    2    HA   LEU  90           HA       LEU  90   2.332  12.225   3.701
    3    HB2  LEU  90           HB2      LEU  90   4.104  10.447   2.025
    4    HB3  LEU  90           HB3      LEU  90   4.521  10.962   3.665
    5    HG   LEU  90           HG       LEU  90   1.884   9.624   2.998
    6   HD12  LEU  90          HD11      LEU  90   3.017   7.574   4.007
    7   HD11  LEU  90          HD12      LEU  90   4.542   8.426   3.769
    8   HD13  LEU  90          HD13      LEU  90   3.531   8.022   2.380
    9   HD22  LEU  90          HD21      LEU  90   1.618  10.546   5.120
   10   HD21  LEU  90          HD22      LEU  90   3.335  10.434   5.506
   11   HD23  LEU  90          HD23      LEU  90   2.324   8.990   5.551

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  91           H        ILE  91   3.943  12.605   0.577
    2    HA   ILE  91           HA       ILE  91   5.924  14.430   1.422
    3    HB   ILE  91           HB       ILE  91   4.616  13.945  -1.261
    4   HG12  ILE  91          HG12      ILE  91   7.445  13.448  -0.282
    5   HG13  ILE  91          HG13      ILE  91   6.159  12.255  -0.123
    6   HG22  ILE  91          HG21      ILE  91   6.844  15.286  -1.944
    7   HG21  ILE  91          HG22      ILE  91   6.534  16.086  -0.403
    8   HG23  ILE  91          HG23      ILE  91   5.314  16.120  -1.674
    9   HD13  ILE  91          HD11      ILE  91   5.989  11.934  -2.431
   10   HD12  ILE  91          HD12      ILE  91   7.724  12.171  -2.214
   11   HD11  ILE  91          HD13      ILE  91   6.719  13.497  -2.801

  No H/Q in entry =          11
  In of MODEL   23
    1    H    THR  92           H        THR  92   2.565  14.874   0.408
    2    HA   THR  92           HA       THR  92   2.549  17.698   0.350
    3    HB   THR  92           HB       THR  92   0.373  15.710   1.043
    4    HG1  THR  92           HG1      THR  92   0.681  15.532  -1.041
    5   HG22  THR  92          HG21      THR  92  -1.018  17.878   0.321
    6   HG21  THR  92          HG22      THR  92   0.375  18.697   1.021
    7   HG23  THR  92          HG23      THR  92  -0.572  17.579   2.000

  No H/Q in entry =           7
  In of MODEL   23
    1    H    GLU  93           H        GLU  93   1.988  15.397   3.001
    2    HA   GLU  93           HA       GLU  93   1.459  17.301   5.020
    3    HB2  GLU  93           HB2      GLU  93   2.762  14.572   5.256
    4    HB3  GLU  93           HB3      GLU  93   2.072  15.500   6.588
    5    HG2  GLU  93           HG2      GLU  93   0.461  14.730   4.146
    6    HG3  GLU  93           HG3      GLU  93   0.556  13.706   5.573

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LEU  94           H        LEU  94   4.462  15.809   3.874
    2    HA   LEU  94           HA       LEU  94   6.213  16.949   5.767
    3    HB2  LEU  94           HB2      LEU  94   6.617  15.982   2.936
    4    HB3  LEU  94           HB3      LEU  94   7.947  16.634   3.888
    5    HG   LEU  94           HG       LEU  94   6.197  14.444   5.018
    6   HD11  LEU  94          HD11      LEU  94   8.296  14.212   2.890
    7   HD13  LEU  94          HD12      LEU  94   6.845  13.243   3.148
    8   HD12  LEU  94          HD13      LEU  94   8.268  12.984   4.158
    9   HD23  LEU  94          HD21      LEU  94   8.382  13.898   6.174
   10   HD22  LEU  94          HD22      LEU  94   7.721  15.479   6.591
   11   HD21  LEU  94          HD23      LEU  94   9.061  15.354   5.450

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  95           H        ILE  95   5.084  18.127   2.616
    2    HA   ILE  95           HA       ILE  95   6.665  20.479   2.561
    3    HB   ILE  95           HB       ILE  95   4.021  19.806   1.250
    4   HG12  ILE  95          HG12      ILE  95   6.813  20.134   0.119
    5   HG13  ILE  95          HG13      ILE  95   6.157  18.583   0.631
    6   HG21  ILE  95          HG21      ILE  95   5.780  22.267   1.035
    7   HG23  ILE  95          HG22      ILE  95   4.055  22.205   1.388
    8   HG22  ILE  95          HG23      ILE  95   4.639  21.804  -0.227
    9   HD13  ILE  95          HD11      ILE  95   4.600  18.514  -1.101
   10   HD12  ILE  95          HD12      ILE  95   5.954  19.328  -1.886
   11   HD11  ILE  95          HD13      ILE  95   4.584  20.267  -1.295

  No H/Q in entry =          11
  In of MODEL   23
    1    H    GLU  96           H        GLU  96   3.412  19.838   3.850
    2    HA   GLU  96           HA       GLU  96   2.800  22.487   4.602
    3    HB2  GLU  96           HB2      GLU  96   1.119  20.710   4.609
    4    HB3  GLU  96           HB3      GLU  96   1.975  19.878   5.905
    5    HG2  GLU  96           HG2      GLU  96   0.956  21.164   7.474
    6    HG3  GLU  96           HG3      GLU  96   1.499  22.637   6.679

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LEU  97           H        LEU  97   4.630  19.927   6.228
    2    HA   LEU  97           HA       LEU  97   4.988  21.272   8.701
    3    HB2  LEU  97           HB2      LEU  97   6.519  19.098   7.288
    4    HB3  LEU  97           HB3      LEU  97   7.109  19.780   8.802
    5    HG   LEU  97           HG       LEU  97   4.296  18.698   8.484
    6   HD12  LEU  97          HD11      LEU  97   5.225  16.681   9.697
    7   HD11  LEU  97          HD12      LEU  97   6.839  17.305   9.357
    8   HD13  LEU  97          HD13      LEU  97   5.770  16.853   8.029
    9   HD23  LEU  97          HD21      LEU  97   4.742  18.399  11.050
   10   HD22  LEU  97          HD22      LEU  97   4.370  20.013  10.446
   11   HD21  LEU  97          HD23      LEU  97   6.039  19.566  10.793

  No H/Q in entry =          11
  In of MODEL   23
    1    H    HIS  98           H        HIS  98   6.865  21.283   5.679
    2    HA   HIS  98           HA       HIS  98   9.023  22.852   6.584
    3    HB2  HIS  98           HB2      HIS  98   7.734  22.605   3.855
    4    HB3  HIS  98           HB3      HIS  98   9.178  23.577   4.149
    5    HD1  HIS  98           HD1      HIS  98   7.951  20.012   4.163
    6    HD2  HIS  98           HD2      HIS  98  11.540  22.092   4.597
    7    HE1  HIS  98           HE1      HIS  98   9.798  18.274   4.109
    8    HE2  HIS  98           HE2      HIS  98  11.988  19.520   4.373

  No H/Q in entry =           8
  In of MODEL   23
    1    H    GLU  99           H        GLU  99   5.808  23.703   5.403
    2    HA   GLU  99           HA       GLU  99   6.200  26.516   5.348
    3    HB2  GLU  99           HB2      GLU  99   4.318  25.356   4.213
    4    HB3  GLU  99           HB3      GLU  99   3.617  24.997   5.790
    5    HG2  GLU  99           HG2      GLU  99   3.447  27.389   6.293
    6    HG3  GLU  99           HG3      GLU  99   4.228  27.787   4.766

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LYS 100           H        LYS 100   5.054  24.284   7.866
    2    HA   LYS 100           HA       LYS 100   4.474  26.339   9.761
    3    HB2  LYS 100           HB2      LYS 100   5.035  23.384  10.105
    4    HB3  LYS 100           HB3      LYS 100   4.590  24.458  11.437
    5    HG2  LYS 100           HG2      LYS 100   2.529  25.106  10.186
    6    HG3  LYS 100           HG3      LYS 100   2.953  23.937   8.933
    7    HD2  LYS 100           HD2      LYS 100   2.864  22.115  10.592
    8    HD3  LYS 100           HD3      LYS 100   2.457  23.278  11.856
    9    HE2  LYS 100           HE2      LYS 100   0.409  23.911  10.590
   10    HE3  LYS 100           HE3      LYS 100   0.806  22.690   9.374
   11    HZ1  LYS 100           HZ1      LYS 100   0.531  22.022  12.253
   12    HZ3  LYS 100           HZ2      LYS 100   0.513  20.969  10.918
   13    HZ2  LYS 100           HZ3      LYS 100  -0.798  22.014  11.196

  No H/Q in entry =          13
  In of MODEL   23
    1    H    LEU 101           H        LEU 101   7.390  24.530   8.931
    2    HA   LEU 101           HA       LEU 101   8.989  25.360  11.138
    3    HB2  LEU 101           HB2      LEU 101   9.584  24.373   8.360
    4    HB3  LEU 101           HB3      LEU 101  10.887  25.031   9.345
    5    HG   LEU 101           HG       LEU 101   9.042  22.883  10.403
    6   HD12  LEU 101          HD11      LEU 101  11.090  21.378   9.797
    7   HD11  LEU 101          HD12      LEU 101  11.465  22.640   8.626
    8   HD13  LEU 101          HD13      LEU 101   9.933  21.775   8.529
    9   HD21  LEU 101          HD21      LEU 101  11.771  23.976  11.137
   10   HD23  LEU 101          HD22      LEU 101  11.218  22.406  11.714
   11   HD22  LEU 101          HD23      LEU 101  10.332  23.866  12.152

  No H/Q in entry =          11
  In of MODEL   23
    1    H    LYS 102           H        LYS 102   7.419  27.233   8.996
    2    HA   LYS 102           HA       LYS 102   7.509  29.526   8.706
    3    HB2  LYS 102           HB2      LYS 102   9.069  29.401  10.808
    4    HB3  LYS 102           HB3      LYS 102  10.371  29.590   9.651
    5    HG2  LYS 102           HG2      LYS 102   8.274  31.553  10.511
    6    HG3  LYS 102           HG3      LYS 102   9.989  31.804  10.263
    7    HD2  LYS 102           HD2      LYS 102   8.040  31.393   7.959
    8    HD3  LYS 102           HD3      LYS 102   8.430  32.970   8.629
    9    HE2  LYS 102           HE2      LYS 102   9.800  31.781   6.557
   10    HE3  LYS 102           HE3      LYS 102  10.422  33.083   7.571
   11    HZ2  LYS 102           HZ1      LYS 102  11.933  31.171   7.397
   12    HZ1  LYS 102           HZ2      LYS 102  10.764  30.194   8.136
   13    HZ3  LYS 102           HZ3      LYS 102  11.461  31.476   8.998

  No H/Q in entry =          13
  In of MODEL   23
    1    H    ALA 103           H        ALA 103  10.760  28.170   8.147
    2    HA   ALA 103           HA       ALA 103  11.735  29.544   6.074
    3    HB2  ALA 103           HB1      ALA 103  12.610  27.326   5.146
    4    HB1  ALA 103           HB2      ALA 103  11.708  26.555   6.450
    5    HB3  ALA 103           HB3      ALA 103  13.003  27.692   6.826

  No H/Q in entry =           5
  In of MODEL   23
    1    H1   LYS   3           H1       LYS   3 -31.738   5.858 -19.625
    2    H2   LYS   3           H3       LYS   3 -30.752   5.605 -20.984
    3    H3   LYS   3           H2       LYS   3 -32.116   4.625 -20.729
    4    HA   LYS   3           HA       LYS   3 -31.060   3.262 -19.339
    5    HB2  LYS   3           HB2      LYS   3 -28.834   4.748 -20.685
    6    HB3  LYS   3           HB3      LYS   3 -28.462   3.546 -19.449
    7    HG2  LYS   3           HG2      LYS   3 -29.846   1.922 -20.794
    8    HG3  LYS   3           HG3      LYS   3 -29.848   3.128 -22.080
    9    HD2  LYS   3           HD2      LYS   3 -27.363   3.089 -22.051
   10    HD3  LYS   3           HD3      LYS   3 -27.433   1.783 -20.868
   11    HE2  LYS   3           HE2      LYS   3 -28.909   0.569 -22.576
   12    HE3  LYS   3           HE3      LYS   3 -28.335   1.769 -23.733
   13    HZ3  LYS   3           HZ1      LYS   3 -26.503   0.597 -24.022
   14    HZ2  LYS   3           HZ2      LYS   3 -27.089  -0.593 -22.961
   15    HZ1  LYS   3           HZ3      LYS   3 -26.132   0.677 -22.366

  No H/Q in entry =          15
  In of MODEL   23
    1    H    LYS   4           H        LYS   4 -31.092   3.111 -17.278
    2    HA   LYS   4           HA       LYS   4 -30.416   5.412 -15.625
    3    HB2  LYS   4           HB2      LYS   4 -31.531   2.683 -14.926
    4    HB3  LYS   4           HB3      LYS   4 -31.340   4.023 -13.797
    5    HG2  LYS   4           HG2      LYS   4 -33.165   3.917 -16.203
    6    HG3  LYS   4           HG3      LYS   4 -33.643   3.947 -14.507
    7    HD2  LYS   4           HD2      LYS   4 -33.010   6.188 -14.238
    8    HD3  LYS   4           HD3      LYS   4 -31.981   6.165 -15.670
    9    HE2  LYS   4           HE2      LYS   4 -33.950   7.484 -16.111
   10    HE3  LYS   4           HE3      LYS   4 -33.995   6.013 -17.084
   11    HZ3  LYS   4           HZ1      LYS   4 -35.531   5.050 -15.527
   12    HZ2  LYS   4           HZ2      LYS   4 -36.133   6.531 -16.101
   13    HZ1  LYS   4           HZ3      LYS   4 -35.461   6.433 -14.544

  No H/Q in entry =          13
  In of MODEL   23
    1    H    HIS   5           H        HIS   5 -28.936   5.534 -14.045
    2    HA   HIS   5           HA       HIS   5 -26.606   3.772 -14.403
    3    HB2  HIS   5           HB2      HIS   5 -26.928   6.514 -13.184
    4    HB3  HIS   5           HB3      HIS   5 -25.420   5.602 -13.183
    5    HD1  HIS   5           HD1      HIS   5 -23.998   6.848 -14.781
    6    HD2  HIS   5           HD2      HIS   5 -27.793   6.126 -16.305
    7    HE1  HIS   5           HE1      HIS   5 -23.867   7.442 -17.230
    8    HE2  HIS   5           HE2      HIS   5 -26.180   6.990 -18.128

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ILE   6           H        ILE   6 -26.322   2.202 -13.094
    2    HA   ILE   6           HA       ILE   6 -27.281   2.433 -10.321
    3    HB   ILE   6           HB       ILE   6 -26.401  -0.005 -11.875
    4   HG12  ILE   6          HG12      ILE   6 -29.162   0.853 -10.997
    5   HG13  ILE   6          HG13      ILE   6 -28.538   1.038 -12.636
    6   HG23  ILE   6          HG21      ILE   6 -26.725  -1.273 -10.016
    7   HG22  ILE   6          HG22      ILE   6 -27.907  -0.162  -9.323
    8   HG21  ILE   6          HG23      ILE   6 -26.187   0.221  -9.246
    9   HD13  ILE   6          HD11      ILE   6 -28.944  -1.091 -13.140
   10   HD12  ILE   6          HD12      ILE   6 -29.948  -1.107 -11.690
   11   HD11  ILE   6          HD13      ILE   6 -28.277  -1.670 -11.613

  No H/Q in entry =          11
  In of MODEL   23
    1    H    TYR   7           H        TYR   7 -25.529   3.117  -9.046
    2    HA   TYR   7           HA       TYR   7 -22.799   2.236  -9.752
    3    HB2  TYR   7           HB2      TYR   7 -23.816   4.637  -8.254
    4    HB3  TYR   7           HB3      TYR   7 -22.118   4.169  -8.309
    5    HD1  TYR   7           HD1      TYR   7 -23.158   3.209 -11.394
    6    HD2  TYR   7           HD2      TYR   7 -22.565   6.790  -9.159
    7    HE1  TYR   7           HE1      TYR   7 -22.777   4.457 -13.484
    8    HE2  TYR   7           HE2      TYR   7 -22.227   8.043 -11.241
    9    HH   TYR   7           HH       TYR   7 -22.462   7.958 -13.472

  No H/Q in entry =           9
  In of MODEL   23
    1    H    LEU   8           H        LEU   8 -21.787   0.906  -8.436
    2    HA   LEU   8           HA       LEU   8 -22.880   0.371  -5.746
    3    HB2  LEU   8           HB2      LEU   8 -21.149  -1.239  -7.600
    4    HB3  LEU   8           HB3      LEU   8 -21.310  -1.632  -5.889
    5    HG   LEU   8           HG       LEU   8 -23.787  -1.869  -6.291
    6   HD13  LEU   8          HD11      LEU   8 -23.969  -0.650  -8.395
    7   HD12  LEU   8          HD12      LEU   8 -24.456  -2.326  -8.637
    8   HD11  LEU   8          HD13      LEU   8 -22.867  -1.783  -9.174
    9   HD23  LEU   8          HD21      LEU   8 -22.474  -3.869  -8.003
   10   HD22  LEU   8          HD22      LEU   8 -23.545  -4.071  -6.616
   11   HD21  LEU   8          HD23      LEU   8 -21.846  -3.674  -6.367

  No H/Q in entry =          11
  In of MODEL   23
    1    H    PHE   9           H        PHE   9 -21.611   0.798  -3.969
    2    HA   PHE   9           HA       PHE   9 -18.848   1.795  -4.483
    3    HB2  PHE   9           HB2      PHE   9 -20.875   2.841  -2.509
    4    HB3  PHE   9           HB3      PHE   9 -19.181   3.311  -2.535
    5    HD1  PHE   9           HD1      PHE   9 -18.280   4.696  -4.305
    6    HD2  PHE   9           HD2      PHE   9 -22.405   3.517  -4.326
    7    HE1  PHE   9           HE1      PHE   9 -18.745   6.353  -6.086
    8    HE2  PHE   9           HE2      PHE   9 -22.873   5.187  -6.101
    9    HZ   PHE   9           HZ       PHE   9 -21.040   6.600  -6.987

  No H/Q in entry =           9
  In of MODEL   23
    1    H    SER  10           H        SER  10 -17.226   0.964  -3.288
    2    HA   SER  10           HA       SER  10 -17.450   0.072  -0.610
    3    HB2  SER  10           HB2      SER  10 -18.630  -1.832  -1.641
    4    HB3  SER  10           HB3      SER  10 -17.261  -2.090  -2.710
    5    HG   SER  10           HG       SER  10 -16.540  -1.907  -0.098

  No H/Q in entry =           5
  In of MODEL   23
    1    H    SER  11           H        SER  11 -15.423   0.128   0.260
    2    HA   SER  11           HA       SER  11 -13.244   1.037  -1.267
    3    HB2  SER  11           HB2      SER  11 -12.895  -0.352   1.364
    4    HB3  SER  11           HB3      SER  11 -12.029   1.040   0.710
    5    HG   SER  11           HG       SER  11 -14.520   1.757   0.744

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA  12           H        ALA  12 -14.406  -1.616  -2.136
    2    HA   ALA  12           HA       ALA  12 -11.834  -2.867  -2.669
    3    HB2  ALA  12           HB1      ALA  12 -12.689  -5.139  -2.027
    4    HB1  ALA  12           HB2      ALA  12 -14.052  -4.346  -1.238
    5    HB3  ALA  12           HB3      ALA  12 -12.411  -4.056  -0.661

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLY  13           H        GLY  13 -12.728  -1.762  -4.658
    2    HA3  GLY  13           HA2      GLY  13 -14.948  -2.543  -6.109
    3    HA2  GLY  13           HA3      GLY  13 -13.436  -1.995  -6.847

  No H/Q in entry =           3
  In of MODEL   23
    1    H    MET  14           H        MET  14 -11.812  -4.228  -5.961
    2    HA   MET  14           HA       MET  14 -12.124  -5.947  -8.120
    3    HB2  MET  14           HB2      MET  14 -10.053  -5.940  -6.813
    4    HB3  MET  14           HB3      MET  14 -10.877  -6.701  -5.453
    5    HG2  MET  14           HG2      MET  14 -11.354  -8.679  -6.871
    6    HG3  MET  14           HG3      MET  14 -10.516  -7.909  -8.219
    7    HE1  MET  14           HE1      MET  14  -8.436  -6.910  -8.104
    8    HE3  MET  14           HE2      MET  14  -7.690  -8.452  -8.519
    9    HE2  MET  14           HE3      MET  14  -7.003  -7.469  -7.228

  No H/Q in entry =           9
  In of MODEL   23
    1    H    SER  15           H        SER  15 -13.278  -6.611  -4.805
    2    HA   SER  15           HA       SER  15 -14.520  -9.085  -5.597
    3    HB2  SER  15           HB2      SER  15 -14.057  -8.956  -3.267
    4    HB3  SER  15           HB3      SER  15 -14.843  -7.386  -3.124
    5    HG   SER  15           HG       SER  15 -16.770  -8.318  -3.150

  No H/Q in entry =           5
  In of MODEL   23
    1    H    THR  16           H        THR  16 -15.727  -5.761  -5.158
    2    HA   THR  16           HA       THR  16 -18.502  -6.345  -5.682
    3    HB   THR  16           HB       THR  16 -17.023  -3.738  -6.183
    4    HG1  THR  16           HG1      THR  16 -16.769  -4.769  -4.032
    5   HG21  THR  16          HG21      THR  16 -19.449  -4.119  -6.957
    6   HG23  THR  16          HG22      THR  16 -19.146  -2.705  -5.933
    7   HG22  THR  16          HG23      THR  16 -19.854  -4.174  -5.246

  No H/Q in entry =           7
  In of MODEL   23
    1    H    SER  17           H        SER  17 -15.686  -5.686  -7.554
    2    HA   SER  17           HA       SER  17 -16.851  -4.969 -10.045
    3    HB2  SER  17           HB2      SER  17 -14.190  -6.279  -9.431
    4    HB3  SER  17           HB3      SER  17 -14.664  -5.703 -11.030
    5    HG   SER  17           HG       SER  17 -13.603  -4.329  -9.028

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU  18           H        LEU  18 -16.186  -8.102  -8.612
    2    HA   LEU  18           HA       LEU  18 -16.748  -9.610 -10.969
    3    HB2  LEU  18           HB2      LEU  18 -15.491 -10.496  -9.017
    4    HB3  LEU  18           HB3      LEU  18 -16.975 -10.433  -8.069
    5    HG   LEU  18           HG       LEU  18 -18.024 -12.033  -9.618
    6   HD13  LEU  18          HD11      LEU  18 -17.021 -11.776 -11.696
    7   HD12  LEU  18          HD12      LEU  18 -16.229 -13.241 -11.114
    8   HD11  LEU  18          HD13      LEU  18 -15.398 -11.690 -11.016
    9   HD21  LEU  18          HD21      LEU  18 -15.401 -12.900  -8.441
   10   HD23  LEU  18          HD22      LEU  18 -16.690 -13.984  -8.968
   11   HD22  LEU  18          HD23      LEU  18 -16.970 -12.861  -7.637

  No H/Q in entry =          11
  In of MODEL   23
    1    H    LEU  19           H        LEU  19 -18.729  -8.466  -8.239
    2    HA   LEU  19           HA       LEU  19 -21.165  -9.715  -9.058
    3    HB2  LEU  19           HB2      LEU  19 -20.895  -8.878  -6.804
    4    HB3  LEU  19           HB3      LEU  19 -20.673  -7.238  -7.411
    5    HG   LEU  19           HG       LEU  19 -23.003  -7.117  -8.054
    6   HD12  LEU  19          HD11      LEU  19 -24.552  -8.956  -7.442
    7   HD11  LEU  19          HD12      LEU  19 -23.160  -9.955  -7.030
    8   HD13  LEU  19          HD13      LEU  19 -23.402  -9.424  -8.693
    9   HD21  LEU  19          HD21      LEU  19 -22.509  -8.093  -5.251
   10   HD23  LEU  19          HD22      LEU  19 -24.002  -7.317  -5.780
   11   HD22  LEU  19          HD23      LEU  19 -22.480  -6.428  -5.833

  No H/Q in entry =          11
  In of MODEL   23
    1    H    VAL  20           H        VAL  20 -19.762  -6.512  -9.753
    2    HA   VAL  20           HA       VAL  20 -21.913  -5.525 -11.303
    3    HB   VAL  20           HB       VAL  20 -18.944  -4.849 -11.444
    4   HG12  VAL  20          HG11      VAL  20 -19.714  -2.793 -12.678
    5   HG11  VAL  20          HG12      VAL  20 -21.291  -3.561 -12.857
    6   HG13  VAL  20          HG13      VAL  20 -19.867  -4.287 -13.600
    7   HG23  VAL  20          HG21      VAL  20 -19.813  -2.705 -10.407
    8   HG22  VAL  20          HG22      VAL  20 -19.811  -4.139  -9.383
    9   HG21  VAL  20          HG23      VAL  20 -21.316  -3.581 -10.114

  No H/Q in entry =           9
  In of MODEL   23
    1    H    SER  21           H        SER  21 -19.107  -7.493 -12.357
    2    HA   SER  21           HA       SER  21 -19.915  -7.395 -15.102
    3    HB2  SER  21           HB2      SER  21 -18.426  -9.318 -15.453
    4    HB3  SER  21           HB3      SER  21 -17.626  -8.054 -14.521
    5    HG   SER  21           HG       SER  21 -18.928  -9.797 -12.931

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LYS  22           H        LYS  22 -20.900  -9.617 -12.529
    2    HA   LYS  22           HA       LYS  22 -22.406 -11.274 -14.346
    3    HB2  LYS  22           HB2      LYS  22 -22.540 -10.942 -11.349
    4    HB3  LYS  22           HB3      LYS  22 -23.537 -12.081 -12.253
    5    HG2  LYS  22           HG2      LYS  22 -21.466 -13.196 -13.041
    6    HG3  LYS  22           HG3      LYS  22 -20.534 -12.115 -12.007
    7    HD2  LYS  22           HD2      LYS  22 -20.732 -14.029 -10.706
    8    HD3  LYS  22           HD3      LYS  22 -22.035 -13.006 -10.101
    9    HE2  LYS  22           HE2      LYS  22 -23.680 -14.244 -11.332
   10    HE3  LYS  22           HE3      LYS  22 -22.437 -15.137 -12.208
   11    HZ2  LYS  22           HZ1      LYS  22 -23.706 -16.136 -10.147
   12    HZ1  LYS  22           HZ2      LYS  22 -22.450 -15.364  -9.302
   13    HZ3  LYS  22           HZ3      LYS  22 -22.088 -16.526 -10.486

  No H/Q in entry =          13
  In of MODEL   23
    1    H    MET  23           H        MET  23 -23.195  -8.378 -12.462
    2    HA   MET  23           HA       MET  23 -26.004  -8.530 -12.948
    3    HB2  MET  23           HB2      MET  23 -24.215  -6.176 -12.381
    4    HB3  MET  23           HB3      MET  23 -25.965  -6.053 -12.546
    5    HG2  MET  23           HG2      MET  23 -26.307  -7.372 -10.578
    6    HG3  MET  23           HG3      MET  23 -24.586  -7.739 -10.466
    7    HE2  MET  23           HE1      MET  23 -26.972  -4.154  -9.248
    8    HE1  MET  23           HE2      MET  23 -27.211  -5.124 -10.700
    9    HE3  MET  23           HE3      MET  23 -26.214  -3.669 -10.766

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ARG  24           H        ARG  24 -23.302  -7.024 -14.747
    2    HA   ARG  24           HA       ARG  24 -24.846  -5.756 -16.730
    3    HB2  ARG  24           HB2      ARG  24 -22.002  -6.817 -16.791
    4    HB3  ARG  24           HB3      ARG  24 -22.709  -5.924 -18.116
    5    HG2  ARG  24           HG2      ARG  24 -22.976  -3.917 -16.679
    6    HG3  ARG  24           HG3      ARG  24 -22.308  -4.834 -15.302
    7    HD2  ARG  24           HD2      ARG  24 -20.235  -5.270 -16.650
    8    HD3  ARG  24           HD3      ARG  24 -20.907  -4.261 -17.924
    9    HE   ARG  24           HE       ARG  24 -20.931  -2.506 -15.989
   10   HH21  ARG  24          HH11      ARG  24 -19.463  -0.909 -16.582
   11   HH22  ARG  24          HH12      ARG  24 -17.798  -1.318 -16.809
   12   HH11  ARG  24          HH21      ARG  24 -18.508  -4.781 -16.629
   13   HH12  ARG  24          HH22      ARG  24 -17.242  -3.610 -16.825

  No H/Q in entry =          13
  In of MODEL   23
    1    H    ALA  25           H        ALA  25 -23.638  -9.065 -16.476
    2    HA   ALA  25           HA       ALA  25 -24.264  -9.902 -19.111
    3    HB1  ALA  25           HB1      ALA  25 -23.511 -11.918 -18.429
    4    HB3  ALA  25           HB2      ALA  25 -24.559 -11.930 -17.011
    5    HB2  ALA  25           HB3      ALA  25 -23.025 -11.064 -16.965

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLN  26           H        GLN  26 -26.067  -9.998 -16.076
    2    HA   GLN  26           HA       GLN  26 -28.388 -11.256 -17.081
    3    HB2  GLN  26           HB2      GLN  26 -27.902  -9.506 -14.690
    4    HB3  GLN  26           HB3      GLN  26 -29.449 -10.267 -15.032
    5    HG2  GLN  26           HG2      GLN  26 -26.823 -11.660 -14.588
    6    HG3  GLN  26           HG3      GLN  26 -28.178 -11.596 -13.468
    7   HE21  GLN  26          HE21      GLN  26 -26.917 -13.724 -14.763
    8   HE22  GLN  26          HE22      GLN  26 -27.938 -14.794 -15.556

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ALA  27           H        ALA  27 -27.535  -7.838 -16.681
    2    HA   ALA  27           HA       ALA  27 -30.057  -6.804 -17.442
    3    HB1  ALA  27           HB1      ALA  27 -28.273  -5.449 -16.334
    4    HB3  ALA  27           HB2      ALA  27 -28.892  -4.691 -17.802
    5    HB2  ALA  27           HB3      ALA  27 -27.335  -5.520 -17.827

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLU  28           H        GLU  28 -27.339  -7.951 -19.336
    2    HA   GLU  28           HA       GLU  28 -28.317  -6.923 -21.843
    3    HB2  GLU  28           HB2      GLU  28 -25.918  -7.550 -21.240
    4    HB3  GLU  28           HB3      GLU  28 -26.423  -9.226 -21.446
    5    HG2  GLU  28           HG2      GLU  28 -25.311  -8.412 -23.418
    6    HG3  GLU  28           HG3      GLU  28 -27.002  -8.776 -23.756

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LYS  29           H        LYS  29 -28.395 -10.040 -20.201
    2    HA   LYS  29           HA       LYS  29 -29.675 -11.532 -22.204
    3    HB2  LYS  29           HB2      LYS  29 -28.588 -12.499 -20.212
    4    HB3  LYS  29           HB3      LYS  29 -29.870 -11.828 -19.205
    5    HG2  LYS  29           HG2      LYS  29 -31.503 -13.236 -20.269
    6    HG3  LYS  29           HG3      LYS  29 -30.297 -13.836 -21.404
    7    HD2  LYS  29           HD2      LYS  29 -29.114 -14.983 -19.685
    8    HD3  LYS  29           HD3      LYS  29 -30.033 -14.171 -18.419
    9    HE2  LYS  29           HE2      LYS  29 -30.729 -16.536 -18.788
   10    HE3  LYS  29           HE3      LYS  29 -32.038 -15.374 -19.017
   11    HZ1  LYS  29           HZ1      LYS  29 -31.487 -15.482 -21.449
   12    HZ3  LYS  29           HZ2      LYS  29 -32.168 -16.890 -20.786
   13    HZ2  LYS  29           HZ3      LYS  29 -30.501 -16.818 -21.095

  No H/Q in entry =          13
  In of MODEL   23
    1    H    TYR  30           H        TYR  30 -31.101  -9.475 -19.679
    2    HA   TYR  30           HA       TYR  30 -33.761  -9.983 -20.904
    3    HB2  TYR  30           HB2      TYR  30 -33.118  -8.828 -18.182
    4    HB3  TYR  30           HB3      TYR  30 -34.733  -9.122 -18.826
    5    HD1  TYR  30           HD1      TYR  30 -35.587 -11.435 -19.045
    6    HD2  TYR  30           HD2      TYR  30 -31.760 -10.627 -17.364
    7    HE1  TYR  30           HE1      TYR  30 -35.435 -13.764 -18.262
    8    HE2  TYR  30           HE2      TYR  30 -31.608 -12.941 -16.584
    9    HH   TYR  30           HH       TYR  30 -33.196 -15.337 -17.678

  No H/Q in entry =           9
  In of MODEL   23
    1    H    GLU  31           H        GLU  31 -31.651  -7.934 -21.710
    2    HA   GLU  31           HA       GLU  31 -31.638  -5.772 -22.521
    3    HB2  GLU  31           HB2      GLU  31 -34.517  -6.557 -23.018
    4    HB3  GLU  31           HB3      GLU  31 -33.716  -5.165 -23.745
    5    HG2  GLU  31           HG2      GLU  31 -32.216  -6.559 -24.955
    6    HG3  GLU  31           HG3      GLU  31 -32.739  -7.991 -24.070

  No H/Q in entry =           6
  In of MODEL   23
    1    H    VAL  32           H        VAL  32 -31.820  -5.690 -19.787
    2    HA   VAL  32           HA       VAL  32 -33.731  -3.628 -19.103
    3    HB   VAL  32           HB       VAL  32 -31.302  -4.568 -17.545
    4   HG12  VAL  32          HG11      VAL  32 -32.845  -3.794 -15.634
    5   HG11  VAL  32          HG12      VAL  32 -33.711  -2.906 -16.888
    6   HG13  VAL  32          HG13      VAL  32 -32.009  -2.560 -16.578
    7   HG21  VAL  32          HG21      VAL  32 -33.031  -6.330 -18.230
    8   HG23  VAL  32          HG22      VAL  32 -34.084  -5.536 -17.058
    9   HG22  VAL  32          HG23      VAL  32 -32.545  -6.223 -16.539

  No H/Q in entry =           9
  In of MODEL   23
    1    HA   PRO  33           HA       PRO  33 -30.788  -0.613 -20.782
    2    HB2  PRO  33           HB2      PRO  33 -32.355   1.569 -20.635
    3    HB3  PRO  33           HB3      PRO  33 -32.798   0.260 -21.734
    4    HG2  PRO  33           HG2      PRO  33 -33.759   0.736 -18.911
    5    HG3  PRO  33           HG3      PRO  33 -34.728   0.510 -20.368
    6    HD2  PRO  33           HD2      PRO  33 -34.206  -1.559 -18.716
    7    HD3  PRO  33           HD3      PRO  33 -34.274  -1.793 -20.464

  No H/Q in entry =           7
  In of MODEL   23
    1    H    VAL  34           H        VAL  34 -29.496  -1.135 -18.845
    2    HA   VAL  34           HA       VAL  34 -29.265   1.288 -17.186
    3    HB   VAL  34           HB       VAL  34 -28.631  -0.168 -15.260
    4   HG12  VAL  34          HG11      VAL  34 -31.017  -1.106 -14.942
    5   HG11  VAL  34          HG12      VAL  34 -31.365  -0.346 -16.493
    6   HG13  VAL  34          HG13      VAL  34 -30.829   0.636 -15.131
    7   HG21  VAL  34          HG21      VAL  34 -28.777  -2.188 -17.279
    8   HG23  VAL  34          HG22      VAL  34 -29.814  -2.585 -15.907
    9   HG22  VAL  34          HG23      VAL  34 -28.102  -2.253 -15.651

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ILE  35           H        ILE  35 -27.295   1.771 -16.357
    2    HA   ILE  35           HA       ILE  35 -24.964   0.511 -17.644
    3    HB   ILE  35           HB       ILE  35 -25.437   3.385 -16.814
    4   HG12  ILE  35          HG12      ILE  35 -24.437   2.119 -19.373
    5   HG13  ILE  35          HG13      ILE  35 -26.082   2.694 -19.098
    6   HG21  ILE  35          HG21      ILE  35 -22.836   1.924 -17.150
    7   HG23  ILE  35          HG22      ILE  35 -23.313   3.083 -15.910
    8   HG22  ILE  35          HG23      ILE  35 -22.958   3.637 -17.547
    9   HD11  ILE  35          HD11      ILE  35 -24.736   4.923 -18.494
   10   HD13  ILE  35          HD12      ILE  35 -25.274   4.534 -20.129
   11   HD12  ILE  35          HD13      ILE  35 -23.610   4.207 -19.646

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ILE  36           H        ILE  36 -23.696  -0.487 -16.059
    2    HA   ILE  36           HA       ILE  36 -24.131   0.100 -13.183
    3    HB   ILE  36           HB       ILE  36 -23.239  -2.573 -14.312
    4   HG12  ILE  36          HG12      ILE  36 -26.061  -1.849 -13.524
    5   HG13  ILE  36          HG13      ILE  36 -25.502  -1.803 -15.196
    6   HG23  ILE  36          HG21      ILE  36 -23.552  -3.423 -12.201
    7   HG22  ILE  36          HG22      ILE  36 -24.710  -2.173 -11.747
    8   HG21  ILE  36          HG23      ILE  36 -22.990  -1.794 -11.827
    9   HD13  ILE  36          HD11      ILE  36 -25.610  -4.020 -15.413
   10   HD12  ILE  36          HD12      ILE  36 -26.668  -3.935 -14.006
   11   HD11  ILE  36          HD13      ILE  36 -24.957  -4.309 -13.802

  No H/Q in entry =          11
  In of MODEL   23
    1    H    GLU  37           H        GLU  37 -22.360   0.771 -12.086
    2    HA   GLU  37           HA       GLU  37 -19.655   0.053 -13.027
    3    HB2  GLU  37           HB2      GLU  37 -20.582   2.816 -12.253
    4    HB3  GLU  37           HB3      GLU  37 -18.901   2.348 -12.508
    5    HG2  GLU  37           HG2      GLU  37 -21.048   2.342 -14.611
    6    HG3  GLU  37           HG3      GLU  37 -19.841   3.607 -14.381

  No H/Q in entry =           6
  In of MODEL   23
    1    H    ALA  38           H        ALA  38 -18.150  -0.152 -11.356
    2    HA   ALA  38           HA       ALA  38 -19.166  -0.018  -8.577
    3    HB1  ALA  38           HB1      ALA  38 -17.409  -1.901 -10.026
    4    HB3  ALA  38           HB2      ALA  38 -18.442  -2.174  -8.623
    5    HB2  ALA  38           HB3      ALA  38 -16.847  -1.447  -8.417

  No H/Q in entry =           5
  In of MODEL   23
    1    H    PHE  39           H        PHE  39 -17.949   1.218  -7.105
    2    HA   PHE  39           HA       PHE  39 -15.466   2.496  -8.013
    3    HB2  PHE  39           HB2      PHE  39 -17.916   3.908  -6.977
    4    HB3  PHE  39           HB3      PHE  39 -16.307   4.622  -6.885
    5    HD1  PHE  39           HD1      PHE  39 -14.992   4.675  -9.146
    6    HD2  PHE  39           HD2      PHE  39 -19.230   4.357  -8.795
    7    HE1  PHE  39           HE1      PHE  39 -15.239   5.561 -11.449
    8    HE2  PHE  39           HE2      PHE  39 -19.492   5.232 -11.088
    9    HZ   PHE  39           HZ       PHE  39 -17.501   5.809 -12.434

  No H/Q in entry =           9
  In of MODEL   23
    1    HA   PRO  40           HA       PRO  40 -14.475   1.745  -3.738
    2    HB2  PRO  40           HB2      PRO  40 -12.763   3.809  -3.133
    3    HB3  PRO  40           HB3      PRO  40 -12.288   2.496  -4.210
    4    HG2  PRO  40           HG2      PRO  40 -13.394   5.203  -4.937
    5    HG3  PRO  40           HG3      PRO  40 -11.951   4.404  -5.559
    6    HD2  PRO  40           HD2      PRO  40 -14.181   4.265  -6.948
    7    HD3  PRO  40           HD3      PRO  40 -13.184   2.821  -6.775

  No H/Q in entry =           7
  In of MODEL   23
    1    H    GLU  41           H        GLU  41 -15.108   2.693  -1.598
    2    HA   GLU  41           HA       GLU  41 -17.402   4.328  -1.556
    3    HB2  GLU  41           HB2      GLU  41 -17.353   4.104   0.759
    4    HB3  GLU  41           HB3      GLU  41 -16.520   2.651   0.205
    5    HG2  GLU  41           HG2      GLU  41 -15.319   3.474   2.074
    6    HG3  GLU  41           HG3      GLU  41 -14.354   3.824   0.640

  No H/Q in entry =           6
  In of MODEL   23
    1    H    THR  42           H        THR  42 -14.101   5.345  -1.626
    2    HA   THR  42           HA       THR  42 -14.521   7.888  -0.397
    3    HB   THR  42           HB       THR  42 -12.389   8.531  -1.489
    4    HG1  THR  42           HG1      THR  42 -13.003   6.224  -2.937
    5   HG21  THR  42          HG21      THR  42 -12.436   7.145   0.607
    6   HG23  THR  42          HG22      THR  42 -10.983   6.916  -0.370
    7   HG22  THR  42          HG23      THR  42 -12.267   5.709  -0.404

  No H/Q in entry =           7
  In of MODEL   23
    1    H    LEU  43           H        LEU  43 -15.415   6.784  -3.497
    2    HA   LEU  43           HA       LEU  43 -15.758   9.552  -4.450
    3    HB2  LEU  43           HB2      LEU  43 -16.031   6.897  -5.846
    4    HB3  LEU  43           HB3      LEU  43 -16.333   8.463  -6.599
    5    HG   LEU  43           HG       LEU  43 -13.651   7.511  -5.622
    6   HD11  LEU  43          HD11      LEU  43 -14.758   6.361  -7.663
    7   HD13  LEU  43          HD12      LEU  43 -13.110   6.967  -7.817
    8   HD12  LEU  43          HD13      LEU  43 -14.454   7.893  -8.482
    9   HD21  LEU  43          HD21      LEU  43 -14.583   9.966  -7.115
   10   HD23  LEU  43          HD22      LEU  43 -12.893   9.467  -7.021
   11   HD22  LEU  43          HD23      LEU  43 -13.767   9.897  -5.552

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ALA  44           H        ALA  44 -17.634   7.659  -2.593
    2    HA   ALA  44           HA       ALA  44 -20.117   7.452  -3.897
    3    HB2  ALA  44           HB1      ALA  44 -19.929   6.329  -1.808
    4    HB3  ALA  44           HB2      ALA  44 -21.075   7.638  -1.521
    5    HB1  ALA  44           HB3      ALA  44 -19.403   7.794  -0.980

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLY  45           H        GLY  45 -18.770  10.285  -2.360
    2    HA3  GLY  45           HA2      GLY  45 -21.255  11.713  -2.695
    3    HA2  GLY  45           HA3      GLY  45 -19.725  12.381  -2.125

  No H/Q in entry =           3
  In of MODEL   23
    1    H    GLU  46           H        GLU  46 -18.183  11.503  -4.433
    2    HA   GLU  46           HA       GLU  46 -18.900  13.707  -6.184
    3    HB2  GLU  46           HB2      GLU  46 -16.642  11.700  -6.213
    4    HB3  GLU  46           HB3      GLU  46 -16.824  12.994  -7.398
    5    HG2  GLU  46           HG2      GLU  46 -16.562  14.660  -5.666
    6    HG3  GLU  46           HG3      GLU  46 -16.471  13.399  -4.435

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LYS  47           H        LYS  47 -18.677  10.196  -6.640
    2    HA   LYS  47           HA       LYS  47 -19.802  10.396  -9.307
    3    HB2  LYS  47           HB2      LYS  47 -18.571   8.316  -7.639
    4    HB3  LYS  47           HB3      LYS  47 -19.921   7.746  -8.621
    5    HG2  LYS  47           HG2      LYS  47 -17.820   7.420  -9.773
    6    HG3  LYS  47           HG3      LYS  47 -18.818   8.600 -10.622
    7    HD2  LYS  47           HD2      LYS  47 -17.555  10.421  -9.675
    8    HD3  LYS  47           HD3      LYS  47 -16.627   9.303  -8.676
    9    HE2  LYS  47           HE2      LYS  47 -15.268   9.882 -10.537
   10    HE3  LYS  47           HE3      LYS  47 -15.823   8.229 -10.792
   11    HZ2  LYS  47           HZ1      LYS  47 -16.546  10.677 -12.203
   12    HZ1  LYS  47           HZ2      LYS  47 -17.743   9.487 -12.026
   13    HZ3  LYS  47           HZ3      LYS  47 -16.281   9.112 -12.806

  No H/Q in entry =          13
  In of MODEL   23
    1    H    GLY  48           H        GLY  48 -21.078   9.584  -6.153
    2    HA3  GLY  48           HA2      GLY  48 -23.431   8.330  -6.882
    3    HA2  GLY  48           HA3      GLY  48 -23.226   9.323  -5.439

  No H/Q in entry =           3
  In of MODEL   23
    1    H    GLN  49           H        GLN  49 -22.727  11.771  -7.002
    2    HA   GLN  49           HA       GLN  49 -25.320  12.806  -7.122
    3    HB2  GLN  49           HB2      GLN  49 -22.814  13.753  -8.496
    4    HB3  GLN  49           HB3      GLN  49 -24.304  14.673  -8.396
    5    HG2  GLN  49           HG2      GLN  49 -24.127  14.689  -5.960
    6    HG3  GLN  49           HG3      GLN  49 -22.650  13.747  -6.058
    7   HE21  GLN  49          HE21      GLN  49 -22.590  15.972  -4.774
    8   HE22  GLN  49          HE22      GLN  49 -21.710  17.258  -5.422

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ASN  50           H        ASN  50 -23.603  10.990  -9.531
    2    HA   ASN  50           HA       ASN  50 -25.527  11.816 -11.595
    3    HB2  ASN  50           HB2      ASN  50 -22.904  10.355 -11.855
    4    HB3  ASN  50           HB3      ASN  50 -23.976  10.755 -13.189
    5   HD21  ASN  50          HD21      ASN  50 -21.354  11.672 -11.593
    6   HD22  ASN  50          HD22      ASN  50 -21.173  13.315 -11.928

  No H/Q in entry =           6
  In of MODEL   23
    1    H    ALA  51           H        ALA  51 -25.426   9.449  -9.361
    2    HA   ALA  51           HA       ALA  51 -26.159   7.291 -11.194
    3    HB2  ALA  51           HB1      ALA  51 -25.524   5.951  -9.518
    4    HB3  ALA  51           HB2      ALA  51 -26.662   6.720  -8.413
    5    HB1  ALA  51           HB3      ALA  51 -25.043   7.391  -8.619

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ASP  52           H        ASP  52 -28.131   6.176 -11.044
    2    HA   ASP  52           HA       ASP  52 -30.361   7.941 -10.354
    3    HB2  ASP  52           HB2      ASP  52 -30.109   5.451 -12.039
    4    HB3  ASP  52           HB3      ASP  52 -31.671   6.137 -11.588

  No H/Q in entry =           4
  In of MODEL   23
    1    H    VAL  53           H        VAL  53 -28.669   5.096  -9.365
    2    HA   VAL  53           HA       VAL  53 -30.093   5.167  -6.838
    3    HB   VAL  53           HB       VAL  53 -31.453   3.492  -8.080
    4   HG11  VAL  53          HG11      VAL  53 -29.694   2.691  -9.619
    5   HG13  VAL  53          HG12      VAL  53 -30.483   1.368  -8.761
    6   HG12  VAL  53          HG13      VAL  53 -28.884   1.914  -8.260
    7   HG23  VAL  53          HG21      VAL  53 -30.562   1.531  -6.404
    8   HG22  VAL  53          HG22      VAL  53 -31.726   2.801  -6.023
    9   HG21  VAL  53          HG23      VAL  53 -30.022   3.019  -5.627

  No H/Q in entry =           9
  In of MODEL   23
    1    H    VAL  54           H        VAL  54 -28.756   4.764  -5.194
    2    HA   VAL  54           HA       VAL  54 -25.978   3.998  -5.831
    3    HB   VAL  54           HB       VAL  54 -27.081   5.732  -3.564
    4   HG11  VAL  54          HG11      VAL  54 -24.465   4.389  -3.881
    5   HG13  VAL  54          HG12      VAL  54 -25.227   5.039  -2.430
    6   HG12  VAL  54          HG13      VAL  54 -24.360   6.113  -3.527
    7   HG22  VAL  54          HG21      VAL  54 -26.282   7.576  -4.660
    8   HG21  VAL  54          HG22      VAL  54 -26.812   6.577  -6.013
    9   HG23  VAL  54          HG23      VAL  54 -25.102   6.649  -5.588

  No H/Q in entry =           9
  In of MODEL   23
    1    H    LEU  55           H        LEU  55 -25.327   2.089  -5.203
    2    HA   LEU  55           HA       LEU  55 -26.781   0.726  -3.024
    3    HB2  LEU  55           HB2      LEU  55 -25.209  -0.386  -5.336
    4    HB3  LEU  55           HB3      LEU  55 -25.934  -1.348  -4.047
    5    HG   LEU  55           HG       LEU  55 -27.430   0.209  -6.145
    6   HD13  LEU  55          HD11      LEU  55 -27.087  -1.629  -7.377
    7   HD12  LEU  55          HD12      LEU  55 -28.011  -2.536  -6.180
    8   HD11  LEU  55          HD13      LEU  55 -26.256  -2.422  -6.040
    9   HD23  LEU  55          HD21      LEU  55 -28.656  -1.782  -4.291
   10   HD22  LEU  55          HD22      LEU  55 -29.396  -0.416  -5.126
   11   HD21  LEU  55          HD23      LEU  55 -28.372  -0.139  -3.716

  No H/Q in entry =          11
  In of MODEL   23
    1    H    LEU  56           H        LEU  56 -25.600   0.155  -1.230
    2    HA   LEU  56           HA       LEU  56 -22.678   0.633  -1.298
    3    HB2  LEU  56           HB2      LEU  56 -24.456   0.359   1.112
    4    HB3  LEU  56           HB3      LEU  56 -22.759   0.836   1.091
    5    HG   LEU  56           HG       LEU  56 -25.111   2.454   0.152
    6   HD11  LEU  56          HD11      LEU  56 -23.968   2.091   2.663
    7   HD13  LEU  56          HD12      LEU  56 -25.000   3.435   2.171
    8   HD12  LEU  56          HD13      LEU  56 -23.246   3.589   2.072
    9   HD23  LEU  56          HD21      LEU  56 -23.216   4.208  -0.047
   10   HD22  LEU  56          HD22      LEU  56 -23.579   3.108  -1.376
   11   HD21  LEU  56          HD23      LEU  56 -22.208   2.787  -0.315

  No H/Q in entry =          11
  In of MODEL   23
    1    H    GLY  57           H        GLY  57 -21.249  -0.962  -0.784
    2    HA3  GLY  57           HA2      GLY  57 -22.098  -3.671  -0.986
    3    HA2  GLY  57           HA3      GLY  57 -20.486  -3.134  -0.518

  No H/Q in entry =           3
  In of MODEL   23
    1    HA   PRO  58           HA       PRO  58 -23.237  -4.269   3.208
    2    HB2  PRO  58           HB2      PRO  58 -22.476  -6.857   3.795
    3    HB3  PRO  58           HB3      PRO  58 -23.879  -6.482   2.794
    4    HG2  PRO  58           HG2      PRO  58 -21.134  -7.283   1.983
    5    HG3  PRO  58           HG3      PRO  58 -22.690  -7.782   1.321
    6    HD2  PRO  58           HD2      PRO  58 -21.142  -5.915   0.096
    7    HD3  PRO  58           HD3      PRO  58 -22.904  -5.877   0.008

  No H/Q in entry =           7
  In of MODEL   23
    1    H    GLN  59           H        GLN  59 -19.859  -4.645   2.573
    2    HA   GLN  59           HA       GLN  59 -19.083  -4.655   5.328
    3    HB2  GLN  59           HB2      GLN  59 -17.537  -3.746   2.896
    4    HB3  GLN  59           HB3      GLN  59 -16.865  -3.952   4.500
    5    HG2  GLN  59           HG2      GLN  59 -18.079  -6.141   2.822
    6    HG3  GLN  59           HG3      GLN  59 -16.359  -5.830   2.996
    7   HE21  GLN  59          HE21      GLN  59 -18.471  -7.710   3.879
    8   HE22  GLN  59          HE22      GLN  59 -18.206  -8.418   5.361

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ILE  60           H        ILE  60 -20.103  -2.120   3.140
    2    HA   ILE  60           HA       ILE  60 -19.290  -0.151   5.189
    3    HB   ILE  60           HB       ILE  60 -19.571   1.583   3.382
    4   HG12  ILE  60          HG12      ILE  60 -19.352  -0.600   1.358
    5   HG13  ILE  60          HG13      ILE  60 -20.947  -0.141   1.955
    6   HG21  ILE  60          HG21      ILE  60 -17.417   0.310   4.070
    7   HG23  ILE  60          HG22      ILE  60 -17.419   1.388   2.674
    8   HG22  ILE  60          HG23      ILE  60 -17.533  -0.356   2.442
    9   HD13  ILE  60          HD11      ILE  60 -20.686   1.176   0.035
   10   HD12  ILE  60          HD12      ILE  60 -18.986   1.499   0.374
   11   HD11  ILE  60          HD13      ILE  60 -20.240   2.276   1.339

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ALA  61           H        ALA  61 -21.700  -1.804   5.269
    2    HA   ALA  61           HA       ALA  61 -23.975  -0.198   4.834
    3    HB1  ALA  61           HB1      ALA  61 -25.139  -1.727   6.161
    4    HB2  ALA  61           HB2      ALA  61 -23.724  -2.083   7.152
    5    HB3  ALA  61           HB3      ALA  61 -23.815  -2.684   5.496

  No H/Q in entry =           5
  In of MODEL   23
    1    H    TYR  62           H        TYR  62 -21.744  -0.263   7.616
    2    HA   TYR  62           HA       TYR  62 -23.331   1.342   9.305
    3    HB2  TYR  62           HB2      TYR  62 -21.302   1.808  10.533
    4    HB3  TYR  62           HB3      TYR  62 -21.302   0.114  10.044
    5    HD1  TYR  62           HD1      TYR  62 -19.673  -0.724   8.419
    6    HD2  TYR  62           HD2      TYR  62 -19.676   3.392   9.566
    7    HE1  TYR  62           HE1      TYR  62 -17.474  -0.427   7.344
    8    HE2  TYR  62           HE2      TYR  62 -17.462   3.684   8.492
    9    HH   TYR  62           HH       TYR  62 -16.151   1.322   6.419

  No H/Q in entry =           9
  In of MODEL   23
    1    H    MET  63           H        MET  63 -21.735   2.259   6.442
    2    HA   MET  63           HA       MET  63 -21.639   5.092   7.149
    3    HB2  MET  63           HB2      MET  63 -21.013   3.601   4.599
    4    HB3  MET  63           HB3      MET  63 -20.860   5.349   4.792
    5    HG2  MET  63           HG2      MET  63 -19.125   5.036   6.448
    6    HG3  MET  63           HG3      MET  63 -19.301   3.287   6.327
    7    HE3  MET  63           HE1      MET  63 -18.848   5.979   2.952
    8    HE2  MET  63           HE2      MET  63 -17.332   6.280   3.802
    9    HE1  MET  63           HE3      MET  63 -18.869   6.453   4.653

  No H/Q in entry =           9
  In of MODEL   23
    1    H    LEU  64           H        LEU  64 -24.159   3.174   6.194
    2    HA   LEU  64           HA       LEU  64 -25.423   4.570   4.133
    3    HB2  LEU  64           HB2      LEU  64 -26.227   2.437   5.046
    4    HB3  LEU  64           HB3      LEU  64 -26.695   3.260   6.533
    5    HG   LEU  64           HG       LEU  64 -28.432   4.475   5.325
    6   HD13  LEU  64          HD11      LEU  64 -28.173   4.735   3.091
    7   HD12  LEU  64          HD12      LEU  64 -28.777   3.083   2.943
    8   HD11  LEU  64          HD13      LEU  64 -27.040   3.388   2.988
    9   HD23  LEU  64          HD21      LEU  64 -28.882   1.653   4.566
   10   HD22  LEU  64          HD22      LEU  64 -29.892   2.756   5.500
   11   HD21  LEU  64          HD23      LEU  64 -28.491   1.996   6.252

  No H/Q in entry =          11
  In of MODEL   23
    1    HA   PRO  65           HA       PRO  65 -27.663   7.652   6.916
    2    HB2  PRO  65           HB2      PRO  65 -25.650   7.852   9.155
    3    HB3  PRO  65           HB3      PRO  65 -27.395   8.087   9.217
    4    HG2  PRO  65           HG2      PRO  65 -26.400   5.853  10.124
    5    HG3  PRO  65           HG3      PRO  65 -27.826   5.788   9.091
    6    HD2  PRO  65           HD2      PRO  65 -24.945   5.251   8.361
    7    HD3  PRO  65           HD3      PRO  65 -26.383   4.330   7.921

  No H/Q in entry =           7
  In of MODEL   23
    1    H    GLU  66           H        GLU  66 -24.107   7.688   6.961
    2    HA   GLU  66           HA       GLU  66 -23.884  10.495   6.568
    3    HB2  GLU  66           HB2      GLU  66 -22.018   8.237   5.891
    4    HB3  GLU  66           HB3      GLU  66 -21.613   9.942   5.688
    5    HG2  GLU  66           HG2      GLU  66 -21.815  10.296   8.060
    6    HG3  GLU  66           HG3      GLU  66 -22.296   8.615   8.287

  No H/Q in entry =           6
  In of MODEL   23
    1    H    ILE  67           H        ILE  67 -23.934   7.759   4.303
    2    HA   ILE  67           HA       ILE  67 -23.579   9.488   2.015
    3    HB   ILE  67           HB       ILE  67 -24.404   6.558   2.188
    4   HG12  ILE  67          HG12      ILE  67 -21.810   7.798   1.250
    5   HG13  ILE  67          HG13      ILE  67 -22.082   7.363   2.937
    6   HG21  ILE  67          HG21      ILE  67 -24.411   8.449  -0.029
    7   HG23  ILE  67          HG22      ILE  67 -24.993   6.785   0.019
    8   HG22  ILE  67          HG23      ILE  67 -23.295   7.114  -0.321
    9   HD12  ILE  67          HD11      ILE  67 -21.636   5.613   0.575
   10   HD11  ILE  67          HD12      ILE  67 -22.626   5.009   1.903
   11   HD13  ILE  67          HD13      ILE  67 -20.963   5.515   2.202

  No H/Q in entry =          11
  In of MODEL   23
    1    H    GLN  68           H        GLN  68 -26.409   8.356   3.666
    2    HA   GLN  68           HA       GLN  68 -28.276   9.252   1.712
    3    HB2  GLN  68           HB2      GLN  68 -28.499   8.873   4.695
    4    HB3  GLN  68           HB3      GLN  68 -29.840   9.441   3.715
    5    HG2  GLN  68           HG2      GLN  68 -29.830   7.417   2.429
    6    HG3  GLN  68           HG3      GLN  68 -28.361   6.872   3.217
    7   HE21  GLN  68          HE21      GLN  68 -30.508   5.462   3.092
    8   HE22  GLN  68          HE22      GLN  68 -31.314   4.980   4.511

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ARG  69           H        ARG  69 -26.688  10.942   4.444
    2    HA   ARG  69           HA       ARG  69 -28.114  13.394   4.062
    3    HB2  ARG  69           HB2      ARG  69 -25.735  12.511   5.628
    4    HB3  ARG  69           HB3      ARG  69 -25.856  14.230   5.278
    5    HG2  ARG  69           HG2      ARG  69 -28.165  14.214   6.269
    6    HG3  ARG  69           HG3      ARG  69 -27.914  12.527   6.732
    7    HD2  ARG  69           HD2      ARG  69 -26.269  14.916   7.644
    8    HD3  ARG  69           HD3      ARG  69 -27.369  13.979   8.643
    9    HE   ARG  69           HE       ARG  69 -24.744  13.113   7.667
   10   HH21  ARG  69          HH11      ARG  69 -23.886  11.363   8.847
   11   HH22  ARG  69          HH12      ARG  69 -24.886  10.517   9.980
   12   HH11  ARG  69          HH21      ARG  69 -27.674  12.489   9.386
   13   HH12  ARG  69          HH22      ARG  69 -27.030  11.154  10.283

  No H/Q in entry =          13
  In of MODEL   23
    1    H    LEU  70           H        LEU  70 -25.223  12.060   2.671
    2    HA   LEU  70           HA       LEU  70 -24.172  14.456   1.507
    3    HB2  LEU  70           HB2      LEU  70 -23.121  12.158   2.082
    4    HB3  LEU  70           HB3      LEU  70 -23.738  11.686   0.499
    5    HG   LEU  70           HG       LEU  70 -22.186  13.099  -0.592
    6   HD11  LEU  70          HD11      LEU  70 -21.359  13.947   2.193
    7   HD13  LEU  70          HD12      LEU  70 -22.087  14.972   0.956
    8   HD12  LEU  70          HD13      LEU  70 -20.463  14.328   0.720
    9   HD22  LEU  70          HD21      LEU  70 -20.712  11.415  -0.381
   10   HD21  LEU  70          HD22      LEU  70 -21.614  10.864   1.032
   11   HD23  LEU  70          HD23      LEU  70 -20.253  11.967   1.229

  No H/Q in entry =          11
  In of MODEL   23
    1    H    LEU  71           H        LEU  71 -26.278  11.872   0.396
    2    HA   LEU  71           HA       LEU  71 -26.857  13.360  -2.108
    3    HB2  LEU  71           HB2      LEU  71 -26.995  10.370  -1.676
    4    HB3  LEU  71           HB3      LEU  71 -27.154  11.235  -3.204
    5    HG   LEU  71           HG       LEU  71 -24.621  11.293  -1.564
    6   HD12  LEU  71          HD11      LEU  71 -24.660   9.677  -4.003
    7   HD11  LEU  71          HD12      LEU  71 -25.646   9.025  -2.695
    8   HD13  LEU  71          HD13      LEU  71 -23.930   9.340  -2.434
    9   HD22  LEU  71          HD21      LEU  71 -24.775  13.115  -3.047
   10   HD21  LEU  71          HD22      LEU  71 -25.262  12.069  -4.380
   11   HD23  LEU  71          HD23      LEU  71 -23.632  11.952  -3.717

  No H/Q in entry =          11
  In of MODEL   23
    1    HA   PRO  72           HA       PRO  72 -30.690  12.818   0.543
    2    HB2  PRO  72           HB2      PRO  72 -31.600  15.361   0.482
    3    HB3  PRO  72           HB3      PRO  72 -30.273  14.930   1.560
    4    HG2  PRO  72           HG2      PRO  72 -30.135  16.142  -1.189
    5    HG3  PRO  72           HG3      PRO  72 -29.367  16.701   0.298
    6    HD2  PRO  72           HD2      PRO  72 -28.013  15.180  -1.488
    7    HD3  PRO  72           HD3      PRO  72 -27.740  15.009   0.245

  No H/Q in entry =           7
  In of MODEL   23
    1    H    ASN  73           H        ASN  73 -30.113  13.801  -2.672
    2    HA   ASN  73           HA       ASN  73 -32.971  13.440  -3.281
    3    HB2  ASN  73           HB2      ASN  73 -32.546  14.566  -5.377
    4    HB3  ASN  73           HB3      ASN  73 -32.031  15.549  -4.015
    5   HD21  ASN  73          HD21      ASN  73 -31.259  15.623  -6.699
    6   HD22  ASN  73          HD22      ASN  73 -29.590  15.495  -6.905

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LYS  74           H        LYS  74 -30.945  11.221  -2.885
    2    HA   LYS  74           HA       LYS  74 -31.507   9.829  -5.435
    3    HB2  LYS  74           HB2      LYS  74 -28.956   9.576  -3.838
    4    HB3  LYS  74           HB3      LYS  74 -29.337   8.764  -5.356
    5    HG2  LYS  74           HG2      LYS  74 -29.126  11.737  -5.141
    6    HG3  LYS  74           HG3      LYS  74 -27.735  10.702  -5.462
    7    HD2  LYS  74           HD2      LYS  74 -28.851   9.763  -7.401
    8    HD3  LYS  74           HD3      LYS  74 -30.286  10.732  -7.064
    9    HE2  LYS  74           HE2      LYS  74 -29.102  12.764  -7.506
   10    HE3  LYS  74           HE3      LYS  74 -27.566  11.903  -7.614
   11    HZ2  LYS  74           HZ1      LYS  74 -29.065  12.489  -9.724
   12    HZ1  LYS  74           HZ2      LYS  74 -29.689  10.952  -9.354
   13    HZ3  LYS  74           HZ3      LYS  74 -28.030  11.144  -9.664

  No H/Q in entry =          13
  In of MODEL   23
    1    HA   PRO  75           HA       PRO  75 -32.822   6.804  -2.469
    2    HB2  PRO  75           HB2      PRO  75 -33.105   4.588  -4.059
    3    HB3  PRO  75           HB3      PRO  75 -34.256   5.922  -4.112
    4    HG2  PRO  75           HG2      PRO  75 -31.923   5.376  -5.906
    5    HG3  PRO  75           HG3      PRO  75 -33.583   5.785  -6.337
    6    HD2  PRO  75           HD2      PRO  75 -31.675   7.685  -6.300
    7    HD3  PRO  75           HD3      PRO  75 -33.309   8.053  -5.746

  No H/Q in entry =           7
  In of MODEL   23
    1    H    VAL  76           H        VAL  76 -31.339   5.767  -1.113
    2    HA   VAL  76           HA       VAL  76 -28.862   4.608  -2.246
    3    HB   VAL  76           HB       VAL  76 -29.154   6.056   0.420
    4   HG11  VAL  76          HG11      VAL  76 -26.786   4.818  -0.997
    5   HG13  VAL  76          HG12      VAL  76 -27.462   4.347   0.564
    6   HG12  VAL  76          HG13      VAL  76 -26.645   5.901   0.389
    7   HG22  VAL  76          HG21      VAL  76 -28.527   7.973  -0.462
    8   HG21  VAL  76          HG22      VAL  76 -29.070   7.275  -1.989
    9   HG23  VAL  76          HG23      VAL  76 -27.363   7.215  -1.549

  No H/Q in entry =           9
  In of MODEL   23
    1    H    GLU  77           H        GLU  77 -28.602   2.456  -1.647
    2    HA   GLU  77           HA       GLU  77 -29.352   1.641   1.010
    3    HB2  GLU  77           HB2      GLU  77 -30.934  -0.032   0.484
    4    HB3  GLU  77           HB3      GLU  77 -31.515   1.483  -0.205
    5    HG2  GLU  77           HG2      GLU  77 -30.912   0.748  -2.402
    6    HG3  GLU  77           HG3      GLU  77 -30.237  -0.741  -1.741

  No H/Q in entry =           6
  In of MODEL   23
    1    H    VAL  78           H        VAL  78 -28.982  -0.443   1.657
    2    HA   VAL  78           HA       VAL  78 -26.309  -1.162   0.743
    3    HB   VAL  78           HB       VAL  78 -27.982  -2.087   3.118
    4   HG11  VAL  78          HG11      VAL  78 -25.630  -3.268   1.969
    5   HG13  VAL  78          HG12      VAL  78 -26.517  -3.763   3.411
    6   HG12  VAL  78          HG13      VAL  78 -25.218  -2.578   3.537
    7   HG22  VAL  78          HG21      VAL  78 -26.537  -0.705   4.451
    8   HG21  VAL  78          HG22      VAL  78 -27.301   0.257   3.187
    9   HG23  VAL  78          HG23      VAL  78 -25.616  -0.239   3.021

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ILE  79           H        ILE  79 -25.746  -3.055  -0.176
    2    HA   ILE  79           HA       ILE  79 -27.789  -4.564  -1.514
    3    HB   ILE  79           HB       ILE  79 -24.788  -5.037  -1.320
    4   HG12  ILE  79          HG12      ILE  79 -26.463  -3.953  -3.589
    5   HG13  ILE  79          HG13      ILE  79 -25.598  -2.932  -2.438
    6   HG22  ILE  79          HG21      ILE  79 -25.887  -6.227  -3.634
    7   HG21  ILE  79          HG22      ILE  79 -26.851  -6.772  -2.262
    8   HG23  ILE  79          HG23      ILE  79 -25.105  -7.018  -2.267
    9   HD13  ILE  79          HD11      ILE  79 -24.198  -3.012  -4.269
   10   HD12  ILE  79          HD12      ILE  79 -24.508  -4.724  -4.555
   11   HD11  ILE  79          HD13      ILE  79 -23.522  -4.225  -3.179

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ASP  80           H        ASP  80 -28.614  -6.506  -0.933
    2    HA   ASP  80           HA       ASP  80 -28.523  -7.417   1.709
    3    HB2  ASP  80           HB2      ASP  80 -30.279  -8.017   0.082
    4    HB3  ASP  80           HB3      ASP  80 -29.110  -9.000  -0.802

  No H/Q in entry =           4
  In of MODEL   23
    1    H    SER  81           H        SER  81 -26.958  -8.529   2.822
    2    HA   SER  81           HA       SER  81 -24.459  -9.159   1.607
    3    HB2  SER  81           HB2      SER  81 -23.873 -10.190   3.768
    4    HB3  SER  81           HB3      SER  81 -24.598  -8.598   3.992
    5    HG   SER  81           HG       SER  81 -26.345  -9.474   4.813

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU  82           H        LEU  82 -27.129 -11.301   1.941
    2    HA   LEU  82           HA       LEU  82 -25.542 -13.639   1.397
    3    HB2  LEU  82           HB2      LEU  82 -28.491 -13.074   1.170
    4    HB3  LEU  82           HB3      LEU  82 -27.761 -14.663   0.943
    5    HG   LEU  82           HG       LEU  82 -27.703 -13.098   3.505
    6   HD11  LEU  82          HD11      LEU  82 -29.446 -15.374   2.539
    7   HD13  LEU  82          HD12      LEU  82 -29.969 -13.772   3.063
    8   HD12  LEU  82          HD13      LEU  82 -29.300 -14.907   4.235
    9   HD21  LEU  82          HD21      LEU  82 -26.703 -15.776   2.577
   10   HD23  LEU  82          HD22      LEU  82 -27.057 -15.478   4.279
   11   HD22  LEU  82          HD23      LEU  82 -25.833 -14.514   3.452

  No H/Q in entry =          11
  In of MODEL   23
    1    H    LEU  83           H        LEU  83 -27.556 -11.441  -0.496
    2    HA   LEU  83           HA       LEU  83 -27.350 -12.785  -2.975
    3    HB2  LEU  83           HB2      LEU  83 -27.808  -9.888  -2.310
    4    HB3  LEU  83           HB3      LEU  83 -27.841 -10.527  -3.954
    5    HG   LEU  83           HG       LEU  83 -29.850 -10.959  -1.763
    6   HD13  LEU  83          HD11      LEU  83 -30.648  -9.121  -2.813
    7   HD12  LEU  83          HD12      LEU  83 -31.101 -10.238  -4.099
    8   HD11  LEU  83          HD13      LEU  83 -29.583  -9.344  -4.200
    9   HD23  LEU  83          HD21      LEU  83 -29.988 -12.209  -4.492
   10   HD22  LEU  83          HD22      LEU  83 -30.940 -12.582  -3.056
   11   HD21  LEU  83          HD23      LEU  83 -29.243 -13.054  -3.136

  No H/Q in entry =          11
  In of MODEL   23
    1    H    TYR  84           H        TYR  84 -25.426 -10.371  -1.304
    2    HA   TYR  84           HA       TYR  84 -23.592  -9.841  -3.447
    3    HB2  TYR  84           HB2      TYR  84 -24.125  -8.381  -1.403
    4    HB3  TYR  84           HB3      TYR  84 -23.059  -9.460  -0.506
    5    HD1  TYR  84           HD1      TYR  84 -20.705  -9.228  -0.617
    6    HD2  TYR  84           HD2      TYR  84 -23.178  -7.051  -3.333
    7    HE1  TYR  84           HE1      TYR  84 -18.732  -7.941  -1.363
    8    HE2  TYR  84           HE2      TYR  84 -21.213  -5.763  -4.095
    9    HH   TYR  84           HH       TYR  84 -19.023  -5.158  -3.366

  No H/Q in entry =           9
  In of MODEL   23
    1    H    GLY  85           H        GLY  85 -23.291 -11.851  -0.511
    2    HA3  GLY  85           HA2      GLY  85 -20.701 -12.746  -1.018
    3    HA2  GLY  85           HA3      GLY  85 -21.909 -13.618  -0.075

  No H/Q in entry =           3
  In of MODEL   23
    1    H    LYS  86           H        LYS  86 -23.765 -14.016  -2.121
    2    HA   LYS  86           HA       LYS  86 -22.678 -16.366  -3.399
    3    HB2  LYS  86           HB2      LYS  86 -25.347 -14.962  -3.415
    4    HB3  LYS  86           HB3      LYS  86 -25.038 -16.467  -4.279
    5    HG2  LYS  86           HG2      LYS  86 -24.498 -17.502  -2.082
    6    HG3  LYS  86           HG3      LYS  86 -25.093 -16.025  -1.325
    7    HD2  LYS  86           HD2      LYS  86 -26.666 -17.649  -3.326
    8    HD3  LYS  86           HD3      LYS  86 -26.830 -17.820  -1.580
    9    HE2  LYS  86           HE2      LYS  86 -27.296 -15.304  -1.563
   10    HE3  LYS  86           HE3      LYS  86 -27.522 -15.464  -3.304
   11    HZ2  LYS  86           HZ1      LYS  86 -29.590 -15.708  -1.957
   12    HZ1  LYS  86           HZ2      LYS  86 -28.944 -17.139  -1.307
   13    HZ3  LYS  86           HZ3      LYS  86 -29.258 -17.030  -2.971

  No H/Q in entry =          13
  In of MODEL   23
    1    H    VAL  87           H        VAL  87 -22.734 -13.147  -4.280
    2    HA   VAL  87           HA       VAL  87 -22.472 -11.962  -6.219
    3    HB   VAL  87           HB       VAL  87 -21.409 -14.347  -7.707
    4   HG11  VAL  87          HG11      VAL  87 -21.424 -11.763  -8.315
    5   HG13  VAL  87          HG12      VAL  87 -20.037 -12.774  -8.724
    6   HG12  VAL  87          HG13      VAL  87 -19.987 -11.743  -7.295
    7   HG21  VAL  87          HG21      VAL  87 -20.161 -13.236  -5.218
    8   HG23  VAL  87          HG22      VAL  87 -19.199 -13.989  -6.487
    9   HG22  VAL  87          HG23      VAL  87 -20.443 -14.920  -5.656

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ASP  88           H        ASP  88 -24.972 -12.651  -5.849
    2    HA   ASP  88           HA       ASP  88 -26.091 -13.878  -8.241
    3    HB2  ASP  88           HB2      ASP  88 -27.062 -14.150  -5.910
    4    HB3  ASP  88           HB3      ASP  88 -27.547 -12.458  -6.000

  No H/Q in entry =           4
  In of MODEL   23
    1    H    GLY  89           H        GLY  89 -25.424 -12.602  -9.884
    2    HA3  GLY  89           HA2      GLY  89 -25.659  -9.832 -10.073
    3    HA2  GLY  89           HA3      GLY  89 -25.625 -10.947 -11.438

  No H/Q in entry =           3
  In of MODEL   23
    1    H    LEU  90           H        LEU  90 -28.043 -12.346 -10.974
    2    HA   LEU  90           HA       LEU  90 -29.898 -10.441 -12.064
    3    HB2  LEU  90           HB2      LEU  90 -29.924 -12.836 -12.653
    4    HB3  LEU  90           HB3      LEU  90 -30.408 -13.218 -11.000
    5    HG   LEU  90           HG       LEU  90 -32.551 -12.139 -11.341
    6   HD13  LEU  90          HD11      LEU  90 -32.417 -10.389 -12.811
    7   HD12  LEU  90          HD12      LEU  90 -32.943 -11.633 -13.948
    8   HD11  LEU  90          HD13      LEU  90 -31.236 -11.207 -13.837
    9   HD23  LEU  90          HD21      LEU  90 -32.472 -13.758 -13.783
   10   HD22  LEU  90          HD22      LEU  90 -33.436 -13.947 -12.318
   11   HD21  LEU  90          HD23      LEU  90 -31.770 -14.529 -12.360

  No H/Q in entry =          11
  In of MODEL   23
    1    H    GLY  91           H        GLY  91 -29.674 -11.950  -8.887
    2    HA3  GLY  91           HA2      GLY  91 -32.025 -10.886  -7.822
    3    HA2  GLY  91           HA3      GLY  91 -30.615 -11.397  -6.894

  No H/Q in entry =           3
  In of MODEL   23
    1    H    VAL  92           H        VAL  92 -28.739  -9.530  -7.761
    2    HA   VAL  92           HA       VAL  92 -29.560  -7.250  -6.196
    3    HB   VAL  92           HB       VAL  92 -27.020  -7.665  -7.816
    4   HG12  VAL  92          HG11      VAL  92 -27.199  -5.792  -5.481
    5   HG11  VAL  92          HG12      VAL  92 -27.888  -5.256  -7.015
    6   HG13  VAL  92          HG13      VAL  92 -26.183  -5.692  -6.919
    7   HG22  VAL  92          HG21      VAL  92 -26.752  -9.254  -6.231
    8   HG21  VAL  92          HG22      VAL  92 -27.902  -8.500  -5.126
    9   HG23  VAL  92          HG23      VAL  92 -26.261  -7.867  -5.259

  No H/Q in entry =           9
  In of MODEL   23
    1    H    LEU  93           H        LEU  93 -29.171  -7.892  -9.623
    2    HA   LEU  93           HA       LEU  93 -29.575  -5.260 -10.539
    3    HB2  LEU  93           HB2      LEU  93 -28.911  -7.097 -12.013
    4    HB3  LEU  93           HB3      LEU  93 -30.486  -7.855 -11.779
    5    HG   LEU  93           HG       LEU  93 -31.545  -5.909 -12.887
    6   HD11  LEU  93          HD11      LEU  93 -29.720  -4.280 -12.393
    7   HD13  LEU  93          HD12      LEU  93 -30.175  -4.312 -14.098
    8   HD12  LEU  93          HD13      LEU  93 -28.702  -5.120 -13.562
    9   HD23  LEU  93          HD21      LEU  93 -30.516  -6.447 -15.186
   10   HD22  LEU  93          HD22      LEU  93 -31.325  -7.723 -14.276
   11   HD21  LEU  93          HD23      LEU  93 -29.562  -7.633 -14.294

  No H/Q in entry =          11
  In of MODEL   23
    1    H    LYS  94           H        LYS  94 -31.893  -7.855  -9.678
    2    HA   LYS  94           HA       LYS  94 -34.270  -6.456 -10.276
    3    HB2  LYS  94           HB2      LYS  94 -33.696  -8.637  -8.277
    4    HB3  LYS  94           HB3      LYS  94 -35.309  -7.972  -8.528
    5    HG2  LYS  94           HG2      LYS  94 -35.229  -8.736 -10.866
    6    HG3  LYS  94           HG3      LYS  94 -33.651  -9.459 -10.555
    7    HD2  LYS  94           HD2      LYS  94 -34.729 -10.821  -8.724
    8    HD3  LYS  94           HD3      LYS  94 -36.290 -10.201  -9.264
    9    HE2  LYS  94           HE2      LYS  94 -35.777 -11.112 -11.539
   10    HE3  LYS  94           HE3      LYS  94 -34.341 -11.871 -10.851
   11    HZ3  LYS  94           HZ1      LYS  94 -36.163 -13.426 -11.010
   12    HZ2  LYS  94           HZ2      LYS  94 -37.148 -12.423 -10.055
   13    HZ1  LYS  94           HZ3      LYS  94 -35.767 -13.147  -9.382

  No H/Q in entry =          13
  In of MODEL   23
    1    H    ALA  95           H        ALA  95 -32.416  -6.552  -7.244
    2    HA   ALA  95           HA       ALA  95 -34.283  -5.013  -5.742
    3    HB2  ALA  95           HB1      ALA  95 -31.877  -6.345  -5.233
    4    HB3  ALA  95           HB2      ALA  95 -32.861  -5.462  -4.067
    5    HB1  ALA  95           HB3      ALA  95 -31.537  -4.647  -4.897

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA  96           H        ALA  96 -31.677  -4.101  -7.860
    2    HA   ALA  96           HA       ALA  96 -31.626  -1.341  -7.076
    3    HB2  ALA  96           HB1      ALA  96 -30.287  -1.081  -9.198
    4    HB3  ALA  96           HB2      ALA  96 -30.562  -2.794  -9.521
    5    HB1  ALA  96           HB3      ALA  96 -29.643  -2.302  -8.099

  No H/Q in entry =           5
  In of MODEL   23
    1    H    VAL  97           H        VAL  97 -33.150  -3.075  -9.756
    2    HA   VAL  97           HA       VAL  97 -34.273  -0.790 -10.993
    3    HB   VAL  97           HB       VAL  97 -35.030  -3.730 -11.039
    4   HG11  VAL  97          HG11      VAL  97 -36.862  -1.755 -11.500
    5   HG13  VAL  97          HG12      VAL  97 -36.899  -3.345 -12.263
    6   HG12  VAL  97          HG13      VAL  97 -36.178  -1.979 -13.112
    7   HG21  VAL  97          HG21      VAL  97 -33.802  -1.871 -13.078
    8   HG23  VAL  97          HG22      VAL  97 -34.228  -3.558 -13.371
    9   HG22  VAL  97          HG23      VAL  97 -32.976  -3.153 -12.194

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ALA  98           H        ALA  98 -35.394  -3.000  -8.454
    2    HA   ALA  98           HA       ALA  98 -37.970  -1.898  -8.075
    3    HB1  ALA  98           HB1      ALA  98 -36.909  -4.083  -7.061
    4    HB3  ALA  98           HB2      ALA  98 -38.097  -3.184  -6.114
    5    HB2  ALA  98           HB3      ALA  98 -36.376  -3.006  -5.770

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA  99           H        ALA  99 -34.891  -1.053  -6.453
    2    HA   ALA  99           HA       ALA  99 -36.039   0.905  -4.772
    3    HB1  ALA  99           HB1      ALA  99 -33.383   0.064  -5.548
    4    HB2  ALA  99           HB2      ALA  99 -33.932   0.798  -4.040
    5    HB3  ALA  99           HB3      ALA  99 -33.486   1.818  -5.407

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ILE 100           H        ILE 100 -35.032   1.067  -8.136
    2    HA   ILE 100           HA       ILE 100 -35.260   3.913  -8.342
    3    HB   ILE 100           HB       ILE 100 -35.340   1.766 -10.488
    4   HG12  ILE 100          HG12      ILE 100 -33.202   3.791  -9.829
    5   HG13  ILE 100          HG13      ILE 100 -33.206   2.141  -9.205
    6   HG21  ILE 100          HG21      ILE 100 -35.811   4.680 -10.602
    7   HG23  ILE 100          HG22      ILE 100 -36.306   3.408 -11.719
    8   HG22  ILE 100          HG23      ILE 100 -34.666   4.051 -11.786
    9   HD12  ILE 100          HD11      ILE 100 -32.715   3.119 -11.980
   10   HD11  ILE 100          HD12      ILE 100 -33.347   1.493 -11.726
   11   HD13  ILE 100          HD13      ILE 100 -31.802   1.958 -11.020

  No H/Q in entry =          11
  In of MODEL   23
    1    H    LYS 101           H        LYS 101 -37.517   1.270  -9.058
    2    HA   LYS 101           HA       LYS 101 -39.634   2.889 -10.031
    3    HB2  LYS 101           HB2      LYS 101 -39.462   0.112  -8.918
    4    HB3  LYS 101           HB3      LYS 101 -41.030   0.851  -9.245
    5    HG2  LYS 101           HG2      LYS 101 -40.579   1.003 -11.546
    6    HG3  LYS 101           HG3      LYS 101 -38.874   0.625 -11.310
    7    HD2  LYS 101           HD2      LYS 101 -40.102  -1.300 -12.193
    8    HD3  LYS 101           HD3      LYS 101 -39.454  -1.627 -10.586
    9    HE2  LYS 101           HE2      LYS 101 -41.501  -2.358 -10.063
   10    HE3  LYS 101           HE3      LYS 101 -41.985  -0.661 -10.054
   11    HZ3  LYS 101           HZ1      LYS 101 -42.894  -0.823 -12.164
   12    HZ2  LYS 101           HZ2      LYS 101 -43.324  -2.307 -11.459
   13    HZ1  LYS 101           HZ3      LYS 101 -42.029  -2.232 -12.554

  No H/Q in entry =          13
  In of MODEL   23
    1    H    LYS 102           H        LYS 102 -39.089   1.405  -6.834
    2    HA   LYS 102           HA       LYS 102 -41.344   2.557  -5.610
    3    HB2  LYS 102           HB2      LYS 102 -40.069   0.707  -4.616
    4    HB3  LYS 102           HB3      LYS 102 -38.692   1.783  -4.379
    5    HG2  LYS 102           HG2      LYS 102 -40.018   3.148  -2.863
    6    HG3  LYS 102           HG3      LYS 102 -41.398   2.076  -3.102
    7    HD2  LYS 102           HD2      LYS 102 -40.132   0.226  -2.097
    8    HD3  LYS 102           HD3      LYS 102 -38.753   1.299  -1.856
    9    HE2  LYS 102           HE2      LYS 102 -40.118   2.748  -0.427
   10    HE3  LYS 102           HE3      LYS 102 -41.515   1.705  -0.689
   11    HZ1  LYS 102           HZ1      LYS 102 -39.757  -0.026   0.291
   12    HZ3  LYS 102           HZ2      LYS 102 -40.873   0.836   1.235
   13    HZ2  LYS 102           HZ3      LYS 102 -39.273   1.387   1.097

  No H/Q in entry =          13
  In of MODEL   23
    1    H    ALA 103           H        ALA 103 -38.422   4.002  -6.642
    2    HA   ALA 103           HA       ALA 103 -38.666   6.304  -4.846
    3    HB2  ALA 103           HB1      ALA 103 -36.701   7.078  -6.436
    4    HB3  ALA 103           HB2      ALA 103 -36.642   5.363  -6.842
    5    HB1  ALA 103           HB3      ALA 103 -36.408   5.882  -5.174

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA 104           H        ALA 104 -39.306   5.580  -8.190
    2    HA   ALA 104           HA       ALA 104 -39.942   8.358  -8.792
    3    HB2  ALA 104           HB1      ALA 104 -39.994   7.700 -10.998
    4    HB1  ALA 104           HB2      ALA 104 -40.692   6.125 -10.622
    5    HB3  ALA 104           HB3      ALA 104 -38.972   6.414 -10.356

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA 105           H        ALA 105 -41.499   6.218  -6.985
    2    HA   ALA 105           HA       ALA 105 -43.945   7.572  -6.930
    3    HB2  ALA 105           HB1      ALA 105 -44.694   6.710  -8.966
    4    HB3  ALA 105           HB2      ALA 105 -45.301   5.506  -7.831
    5    HB1  ALA 105           HB3      ALA 105 -43.834   5.186  -8.753

  No H/Q in entry =           5
  In of MODEL   24
    1    H1   ALA   1           H3       ALA   1 -12.486 -15.389  -2.391
    2    H2   ALA   1           H2       ALA   1 -11.561 -16.550  -3.223
    3    H3   ALA   1           H1       ALA   1 -12.684 -15.589  -4.066
    4    HA   ALA   1           HA       ALA   1 -14.113 -17.264  -3.826
    5    HB3  ALA   1           HB1      ALA   1 -12.750 -19.058  -3.351
    6    HB1  ALA   1           HB2      ALA   1 -13.512 -18.926  -1.766
    7    HB2  ALA   1           HB3      ALA   1 -11.922 -18.214  -2.042

  No H/Q in entry =           7
  In of MODEL   24
    1    H    GLU   2           H        GLU   2 -15.759 -18.084  -2.177
    2    HA   GLU   2           HA       GLU   2 -17.382 -16.331  -1.132
    3    HB2  GLU   2           HB2      GLU   2 -16.492 -18.767   0.426
    4    HB3  GLU   2           HB3      GLU   2 -18.002 -17.889   0.669
    5    HG2  GLU   2           HG2      GLU   2 -18.992 -18.965  -1.066
    6    HG3  GLU   2           HG3      GLU   2 -17.657 -18.591  -2.145

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLU   3           H        GLU   3 -15.505 -17.707   1.505
    2    HA   GLU   3           HA       GLU   3 -15.694 -15.345   3.052
    3    HB2  GLU   3           HB2      GLU   3 -14.154 -17.917   3.320
    4    HB3  GLU   3           HB3      GLU   3 -13.905 -16.598   4.463
    5    HG2  GLU   3           HG2      GLU   3 -16.104 -16.708   5.271
    6    HG3  GLU   3           HG3      GLU   3 -16.706 -17.503   3.823

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LEU   4           H        LEU   4 -12.758 -16.880   1.681
    2    HA   LEU   4           HA       LEU   4 -10.894 -15.006   2.281
    3    HB2  LEU   4           HB2      LEU   4 -11.134 -16.310  -0.440
    4    HB3  LEU   4           HB3      LEU   4  -9.673 -15.612   0.250
    5    HG   LEU   4           HG       LEU   4 -11.214 -17.979   1.364
    6   HD13  LEU   4          HD11      LEU   4  -9.601 -19.366   0.448
    7   HD12  LEU   4          HD12      LEU   4  -8.369 -18.105   0.422
    8   HD11  LEU   4          HD13      LEU   4  -9.652 -18.109  -0.787
    9   HD23  LEU   4          HD21      LEU   4  -8.971 -18.077   2.757
   10   HD22  LEU   4          HD22      LEU   4 -10.276 -17.012   3.276
   11   HD21  LEU   4          HD23      LEU   4  -8.898 -16.350   2.397

  No H/Q in entry =          11
  In of MODEL   24
    1    H    GLU   5           H        GLU   5 -13.212 -14.769  -0.405
    2    HA   GLU   5           HA       GLU   5 -12.160 -12.307  -1.410
    3    HB2  GLU   5           HB2      GLU   5 -13.547 -13.907  -2.746
    4    HB3  GLU   5           HB3      GLU   5 -14.942 -13.440  -1.772
    5    HG2  GLU   5           HG2      GLU   5 -15.014 -12.095  -3.758
    6    HG3  GLU   5           HG3      GLU   5 -14.483 -11.042  -2.446

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLU   6           H        GLU   6 -14.911 -13.129   0.672
    2    HA   GLU   6           HA       GLU   6 -15.770 -10.436   1.057
    3    HB2  GLU   6           HB2      GLU   6 -17.237 -12.393   1.456
    4    HB3  GLU   6           HB3      GLU   6 -16.216 -12.864   2.814
    5    HG2  GLU   6           HG2      GLU   6 -16.705 -10.744   3.946
    6    HG3  GLU   6           HG3      GLU   6 -17.684 -10.221   2.578

  No H/Q in entry =           6
  In of MODEL   24
    1    H    VAL   7           H        VAL   7 -13.508 -12.581   2.648
    2    HA   VAL   7           HA       VAL   7 -13.025 -11.005   4.972
    3    HB   VAL   7           HB       VAL   7 -11.351 -13.084   3.538
    4   HG11  VAL   7          HG11      VAL   7 -10.869 -11.550   6.099
    5   HG13  VAL   7          HG12      VAL   7  -9.766 -11.789   4.745
    6   HG12  VAL   7          HG13      VAL   7 -10.148 -13.135   5.818
    7   HG21  VAL   7          HG21      VAL   7 -13.617 -13.604   4.749
    8   HG23  VAL   7          HG22      VAL   7 -12.693 -13.341   6.228
    9   HG22  VAL   7          HG23      VAL   7 -12.216 -14.613   5.106

  No H/Q in entry =           9
  In of MODEL   24
    1    H    VAL   8           H        VAL   8 -11.500 -11.159   1.770
    2    HA   VAL   8           HA       VAL   8  -9.407  -9.321   2.266
    3    HB   VAL   8           HB       VAL   8 -10.870  -9.987  -0.300
    4   HG12  VAL   8          HG11      VAL   8  -8.755  -9.011  -1.344
    5   HG11  VAL   8          HG12      VAL   8  -8.398  -8.320   0.239
    6   HG13  VAL   8          HG13      VAL   8  -9.859  -7.841  -0.623
    7   HG23  VAL   8          HG21      VAL   8  -8.050 -10.825   0.152
    8   HG22  VAL   8          HG22      VAL   8  -9.392 -11.730  -0.540
    9   HG21  VAL   8          HG23      VAL   8  -9.228 -11.609   1.208

  No H/Q in entry =           9
  In of MODEL   24
    1    H    MET   9           H        MET   9 -12.740  -8.876   1.087
    2    HA   MET   9           HA       MET   9 -12.625  -6.103   0.643
    3    HB2  MET   9           HB2      MET   9 -14.866  -7.953   1.445
    4    HB3  MET   9           HB3      MET   9 -15.130  -6.216   1.269
    5    HG2  MET   9           HG2      MET   9 -13.997  -6.488  -1.045
    6    HG3  MET   9           HG3      MET   9 -14.302  -8.211  -0.833
    7    HE3  MET   9           HE1      MET   9 -18.071  -8.575  -0.588
    8    HE2  MET   9           HE2      MET   9 -16.884  -8.498   0.710
    9    HE1  MET   9           HE3      MET   9 -16.495  -9.356  -0.777

  No H/Q in entry =           9
  In of MODEL   24
    1    H    GLY  10           H        GLY  10 -13.336  -7.971   3.574
    2    HA3  GLY  10           HA2      GLY  10 -13.855  -5.771   5.281
    3    HA2  GLY  10           HA3      GLY  10 -13.321  -7.367   5.804

  No H/Q in entry =           3
  In of MODEL   24
    1    H    LEU  11           H        LEU  11 -10.871  -7.538   4.502
    2    HA   LEU  11           HA       LEU  11  -9.155  -6.128   6.262
    3    HB2  LEU  11           HB2      LEU  11  -8.620  -7.571   3.663
    4    HB3  LEU  11           HB3      LEU  11  -7.343  -6.884   4.666
    5    HG   LEU  11           HG       LEU  11  -9.384  -8.879   5.679
    6   HD13  LEU  11          HD11      LEU  11  -8.176 -10.142   4.126
    7   HD12  LEU  11          HD12      LEU  11  -7.253 -10.391   5.607
    8   HD11  LEU  11          HD13      LEU  11  -6.686  -9.240   4.398
    9   HD22  LEU  11          HD21      LEU  11  -8.524  -7.873   7.597
   10   HD21  LEU  11          HD22      LEU  11  -6.976  -7.500   6.840
   11   HD23  LEU  11          HD23      LEU  11  -7.332  -9.149   7.354

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  12           H        ILE  12 -10.030  -5.578   2.866
    2    HA   ILE  12           HA       ILE  12  -8.299  -3.379   2.440
    3    HB   ILE  12           HB       ILE  12 -10.960  -3.996   1.132
    4   HG12  ILE  12          HG12      ILE  12  -8.966  -5.705   1.088
    5   HG13  ILE  12          HG13      ILE  12  -9.816  -5.344  -0.401
    6   HG21  ILE  12          HG21      ILE  12  -8.669  -2.189   0.290
    7   HG23  ILE  12          HG22      ILE  12 -10.312  -1.690   0.672
    8   HG22  ILE  12          HG23      ILE  12  -9.989  -2.658  -0.737
    9   HD11  ILE  12          HD11      ILE  12  -7.276  -3.951   0.482
   10   HD13  ILE  12          HD12      ILE  12  -8.054  -3.858  -1.096
   11   HD12  ILE  12          HD13      ILE  12  -7.299  -5.347  -0.578

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  13           H        ILE  13 -11.669  -3.586   3.516
    2    HA   ILE  13           HA       ILE  13 -12.084  -0.791   3.773
    3    HB   ILE  13           HB       ILE  13 -13.336  -3.189   5.130
    4   HG12  ILE  13          HG12      ILE  13 -13.546  -2.630   2.594
    5   HG13  ILE  13          HG13      ILE  13 -14.981  -3.069   3.494
    6   HG23  ILE  13          HG21      ILE  13 -13.766  -1.467   6.685
    7   HG22  ILE  13          HG22      ILE  13 -15.211  -1.482   5.682
    8   HG21  ILE  13          HG23      ILE  13 -13.978  -0.249   5.429
    9   HD12  ILE  13          HD11      ILE  13 -15.278  -1.041   2.017
   10   HD11  ILE  13          HD12      ILE  13 -14.111  -0.226   3.040
   11   HD13  ILE  13          HD13      ILE  13 -15.631  -0.756   3.725

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ASN  14           H        ASN  14 -11.026  -3.290   6.063
    2    HA   ASN  14           HA       ASN  14 -10.811  -1.646   8.343
    3    HB2  ASN  14           HB2      ASN  14 -10.598  -4.259   8.033
    4    HB3  ASN  14           HB3      ASN  14  -8.882  -3.900   7.883
    5   HD21  ASN  14          HD21      ASN  14  -9.555  -5.405  10.062
    6   HD22  ASN  14          HD22      ASN  14  -9.519  -4.480  11.483

  No H/Q in entry =           6
  In of MODEL   24
    1    H    SER  15           H        SER  15  -8.409  -2.518   5.868
    2    HA   SER  15           HA       SER  15  -6.248  -1.055   6.945
    3    HB2  SER  15           HB2      SER  15  -5.219  -1.297   4.796
    4    HB3  SER  15           HB3      SER  15  -6.202  -2.740   5.017
    5    HG   SER  15           HG       SER  15  -6.660  -0.483   3.407

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLY  16           H        GLY  16  -8.823  -0.156   4.681
    2    HA3  GLY  16           HA2      GLY  16  -7.922   2.469   4.123
    3    HA2  GLY  16           HA3      GLY  16  -9.581   1.898   3.955

  No H/Q in entry =           3
  In of MODEL   24
    1    H    GLN  17           H        GLN  17 -10.149   1.192   6.605
    2    HA   GLN  17           HA       GLN  17 -10.824   3.712   7.732
    3    HB2  GLN  17           HB2      GLN  17 -12.113   1.688   8.237
    4    HB3  GLN  17           HB3      GLN  17 -10.714   0.986   9.050
    5    HG2  GLN  17           HG2      GLN  17 -10.730   2.799  10.699
    6    HG3  GLN  17           HG3      GLN  17 -12.084   3.565   9.868
    7   HE21  GLN  17          HE21      GLN  17 -12.308   2.749  12.600
    8   HE22  GLN  17          HE22      GLN  17 -13.413   1.461  12.682

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ALA  18           H        ALA  18  -8.233   1.394   8.374
    2    HA   ALA  18           HA       ALA  18  -7.129   2.603  10.646
    3    HB2  ALA  18           HB1      ALA  18  -6.545   0.373   9.291
    4    HB3  ALA  18           HB2      ALA  18  -5.377   1.143  10.364
    5    HB1  ALA  18           HB3      ALA  18  -5.286   1.413   8.623

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ARG  19           H        ARG  19  -6.332   3.101   7.199
    2    HA   ARG  19           HA       ARG  19  -4.406   5.122   7.630
    3    HB2  ARG  19           HB2      ARG  19  -4.738   3.977   5.438
    4    HB3  ARG  19           HB3      ARG  19  -6.268   4.840   5.249
    5    HG2  ARG  19           HG2      ARG  19  -5.108   6.995   5.314
    6    HG3  ARG  19           HG3      ARG  19  -3.572   6.189   5.630
    7    HD2  ARG  19           HD2      ARG  19  -3.676   6.771   3.284
    8    HD3  ARG  19           HD3      ARG  19  -3.787   5.013   3.436
    9    HE   ARG  19           HE       ARG  19  -6.408   5.960   3.411
   10   HH21  ARG  19          HH11      ARG  19  -7.590   6.125   1.485
   11   HH22  ARG  19          HH12      ARG  19  -6.759   6.184  -0.030
   12   HH11  ARG  19          HH21      ARG  19  -3.621   5.975   1.392
   13   HH12  ARG  19          HH22      ARG  19  -4.510   6.097  -0.083

  No H/Q in entry =          13
  In of MODEL   24
    1    H    SER  20           H        SER  20  -7.899   5.285   7.010
    2    HA   SER  20           HA       SER  20  -8.217   8.045   6.948
    3    HB2  SER  20           HB2      SER  20 -10.111   6.729   6.407
    4    HB3  SER  20           HB3      SER  20 -10.023   5.840   7.925
    5    HG   SER  20           HG       SER  20 -10.244   8.204   8.756

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU  21           H        LEU  21  -8.263   5.874   9.762
    2    HA   LEU  21           HA       LEU  21  -8.687   7.884  11.716
    3    HB2  LEU  21           HB2      LEU  21  -7.372   5.166  11.895
    4    HB3  LEU  21           HB3      LEU  21  -7.677   6.193  13.293
    5    HG   LEU  21           HG       LEU  21  -9.843   5.308  11.363
    6   HD12  LEU  21          HD11      LEU  21 -10.484   3.743  13.241
    7   HD11  LEU  21          HD12      LEU  21  -8.935   4.117  13.997
    8   HD13  LEU  21          HD13      LEU  21  -8.978   3.322  12.422
    9   HD23  LEU  21          HD21      LEU  21 -11.201   5.852  13.561
   10   HD22  LEU  21          HD22      LEU  21 -10.709   7.183  12.519
   11   HD21  LEU  21          HD23      LEU  21  -9.796   6.829  13.977

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ALA  22           H        ALA  22  -5.746   6.465  10.331
    2    HA   ALA  22           HA       ALA  22  -3.858   7.760  11.958
    3    HB2  ALA  22           HB1      ALA  22  -3.457   5.893  10.277
    4    HB1  ALA  22           HB2      ALA  22  -2.244   7.173  10.313
    5    HB3  ALA  22           HB3      ALA  22  -3.455   7.140   9.030

  No H/Q in entry =           5
  In of MODEL   24
    1    H    TYR  23           H        TYR  23  -5.143   8.781   8.763
    2    HA   TYR  23           HA       TYR  23  -3.773  11.258   8.690
    3    HB2  TYR  23           HB2      TYR  23  -4.855  10.353   6.696
    4    HB3  TYR  23           HB3      TYR  23  -6.435  10.483   7.468
    5    HD1  TYR  23           HD1      TYR  23  -3.506  12.477   6.305
    6    HD2  TYR  23           HD2      TYR  23  -7.643  12.517   7.454
    7    HE1  TYR  23           HE1      TYR  23  -3.697  14.827   5.534
    8    HE2  TYR  23           HE2      TYR  23  -7.835  14.867   6.683
    9    HH   TYR  23           HH       TYR  23  -5.561  16.348   4.727

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ALA  24           H        ALA  24  -6.913  10.329  10.056
    2    HA   ALA  24           HA       ALA  24  -7.719  12.933  10.811
    3    HB1  ALA  24           HB1      ALA  24  -9.557  11.708  11.274
    4    HB2  ALA  24           HB2      ALA  24  -8.747  11.132  12.729
    5    HB3  ALA  24           HB3      ALA  24  -8.626  10.212  11.230

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA  25           H        ALA  25  -5.759  10.455  12.407
    2    HA   ALA  25           HA       ALA  25  -5.419  11.713  14.906
    3    HB2  ALA  25           HB1      ALA  25  -4.679   9.348  14.099
    4    HB3  ALA  25           HB2      ALA  25  -3.659  10.197  15.262
    5    HB1  ALA  25           HB3      ALA  25  -3.214  10.167  13.556

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU  26           H        LEU  26  -3.607  11.975  11.875
    2    HA   LEU  26           HA       LEU  26  -1.630  13.773  12.795
    3    HB2  LEU  26           HB2      LEU  26  -1.332  12.608  10.697
    4    HB3  LEU  26           HB3      LEU  26  -2.791  13.333  10.031
    5    HG   LEU  26           HG       LEU  26  -1.747  15.570  10.163
    6   HD12  LEU  26          HD11      LEU  26   0.789  15.557  10.592
    7   HD11  LEU  26          HD12      LEU  26   0.540  13.983  11.341
    8   HD13  LEU  26          HD13      LEU  26  -0.253  15.412  12.007
    9   HD21  LEU  26          HD21      LEU  26  -0.024  13.486   8.787
   10   HD23  LEU  26          HD22      LEU  26  -0.042  15.206   8.409
   11   HD22  LEU  26          HD23      LEU  26  -1.477  14.227   8.117

  No H/Q in entry =          11
  In of MODEL   24
    1    H    LYS  27           H        LYS  27  -4.796  14.292  11.297
    2    HA   LYS  27           HA       LYS  27  -4.702  17.079  11.087
    3    HB2  LYS  27           HB2      LYS  27  -6.460  15.621  10.098
    4    HB3  LYS  27           HB3      LYS  27  -7.130  15.381  11.711
    5    HG2  LYS  27           HG2      LYS  27  -7.528  17.794  11.934
    6    HG3  LYS  27           HG3      LYS  27  -6.806  18.074  10.346
    7    HD2  LYS  27           HD2      LYS  27  -8.552  16.659   9.306
    8    HD3  LYS  27           HD3      LYS  27  -9.279  16.396  10.893
    9    HE2  LYS  27           HE2      LYS  27  -9.690  18.814  11.123
   10    HE3  LYS  27           HE3      LYS  27  -8.935  19.099   9.551
   11    HZ3  LYS  27           HZ1      LYS  27 -11.312  19.006   9.297
   12    HZ2  LYS  27           HZ2      LYS  27 -11.386  17.493  10.072
   13    HZ1  LYS  27           HZ3      LYS  27 -10.630  17.640   8.554

  No H/Q in entry =          13
  In of MODEL   24
    1    H    GLN  28           H        GLN  28  -5.635  15.017  13.818
    2    HA   GLN  28           HA       GLN  28  -6.512  17.041  15.580
    3    HB2  GLN  28           HB2      GLN  28  -5.149  14.394  16.144
    4    HB3  GLN  28           HB3      GLN  28  -5.887  15.413  17.381
    5    HG2  GLN  28           HG2      GLN  28  -7.343  14.298  14.966
    6    HG3  GLN  28           HG3      GLN  28  -7.424  13.620  16.591
    7   HE21  GLN  28          HE21      GLN  28  -9.227  15.470  14.583
    8   HE22  GLN  28          HE22      GLN  28  -9.983  16.490  15.708

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ALA  29           H        ALA  29  -3.308  15.695  14.915
    2    HA   ALA  29           HA       ALA  29  -1.861  17.080  16.895
    3    HB1  ALA  29           HB1      ALA  29   0.065  16.355  15.790
    4    HB3  ALA  29           HB2      ALA  29  -0.678  16.484  14.196
    5    HB2  ALA  29           HB3      ALA  29  -1.126  15.162  15.274

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LYS  30           H        LYS  30  -2.687  17.958  13.557
    2    HA   LYS  30           HA       LYS  30  -1.237  20.375  13.455
    3    HB2  LYS  30           HB2      LYS  30  -3.774  19.536  12.036
    4    HB3  LYS  30           HB3      LYS  30  -2.914  21.036  11.690
    5    HG2  LYS  30           HG2      LYS  30  -0.863  19.707  11.193
    6    HG3  LYS  30           HG3      LYS  30  -1.795  18.227  11.439
    7    HD2  LYS  30           HD2      LYS  30  -3.338  18.886   9.634
    8    HD3  LYS  30           HD3      LYS  30  -2.429  20.378   9.389
    9    HE2  LYS  30           HE2      LYS  30  -0.415  19.049   8.826
   10    HE3  LYS  30           HE3      LYS  30  -1.344  17.562   9.039
   11    HZ2  LYS  30           HZ1      LYS  30  -1.140  18.420   6.695
   12    HZ1  LYS  30           HZ2      LYS  30  -2.165  19.702   7.152
   13    HZ3  LYS  30           HZ3      LYS  30  -2.717  18.095   7.227

  No H/Q in entry =          13
  In of MODEL   24
    1    H    GLN  31           H        GLN  31  -4.359  19.582  14.854
    2    HA   GLN  31           HA       GLN  31  -5.077  22.353  15.290
    3    HB2  GLN  31           HB2      GLN  31  -6.306  19.933  16.616
    4    HB3  GLN  31           HB3      GLN  31  -7.037  21.517  16.360
    5    HG2  GLN  31           HG2      GLN  31  -6.327  20.717  13.778
    6    HG3  GLN  31           HG3      GLN  31  -6.882  19.225  14.528
    7   HE21  GLN  31          HE21      GLN  31  -8.253  20.815  12.412
    8   HE22  GLN  31          HE22      GLN  31  -9.763  21.236  13.060

  No H/Q in entry =           8
  In of MODEL   24
    1    H    GLY  32           H        GLY  32  -2.807  20.390  16.630
    2    HA3  GLY  32           HA2      GLY  32  -1.407  20.834  18.438
    3    HA2  GLY  32           HA3      GLY  32  -2.517  22.099  18.951

  No H/Q in entry =           3
  In of MODEL   24
    1    H    ASP  33           H        ASP  33  -3.990  19.083  18.293
    2    HA   ASP  33           HA       ASP  33  -4.424  18.644  21.173
    3    HB2  ASP  33           HB2      ASP  33  -5.836  17.649  18.691
    4    HB3  ASP  33           HB3      ASP  33  -6.200  17.051  20.308

  No H/Q in entry =           4
  In of MODEL   24
    1    H    PHE  34           H        PHE  34  -2.273  17.755  21.493
    2    HA   PHE  34           HA       PHE  34  -1.307  15.483  20.105
    3    HB2  PHE  34           HB2      PHE  34  -0.686  16.467  22.899
    4    HB3  PHE  34           HB3      PHE  34   0.224  15.224  22.042
    5    HD1  PHE  34           HD1      PHE  34   0.111  18.655  22.763
    6    HD2  PHE  34           HD2      PHE  34   0.908  15.925  19.543
    7    HE1  PHE  34           HE1      PHE  34   1.444  20.398  21.609
    8    HE2  PHE  34           HE2      PHE  34   2.237  17.671  18.394
    9    HZ   PHE  34           HZ       PHE  34   2.507  19.905  19.432

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ALA  35           H        ALA  35  -3.356  15.808  22.957
    2    HA   ALA  35           HA       ALA  35  -3.197  13.146  23.864
    3    HB3  ALA  35           HB1      ALA  35  -5.648  13.820  24.706
    4    HB1  ALA  35           HB2      ALA  35  -5.082  15.426  24.247
    5    HB2  ALA  35           HB3      ALA  35  -4.191  14.490  25.446

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA  36           H        ALA  36  -5.608  14.699  21.746
    2    HA   ALA  36           HA       ALA  36  -7.065  12.312  21.269
    3    HB1  ALA  36           HB1      ALA  36  -8.489  13.758  20.301
    4    HB3  ALA  36           HB2      ALA  36  -7.303  14.152  19.056
    5    HB2  ALA  36           HB3      ALA  36  -7.319  15.045  20.577

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA  37           H        ALA  37  -4.347  13.844  19.609
    2    HA   ALA  37           HA       ALA  37  -4.331  12.200  17.318
    3    HB3  ALA  37           HB1      ALA  37  -2.314  13.880  18.745
    4    HB2  ALA  37           HB2      ALA  37  -2.835  13.940  17.062
    5    HB1  ALA  37           HB3      ALA  37  -1.707  12.691  17.594

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LYS  38           H        LYS  38  -2.595  11.873  20.406
    2    HA   LYS  38           HA       LYS  38  -1.311   9.448  19.933
    3    HB2  LYS  38           HB2      LYS  38  -1.613  11.224  22.070
    4    HB3  LYS  38           HB3      LYS  38  -2.263   9.708  22.689
    5    HG2  LYS  38           HG2      LYS  38  -0.187   8.547  22.167
    6    HG3  LYS  38           HG3      LYS  38   0.452   9.978  21.351
    7    HD2  LYS  38           HD2      LYS  38   0.633  11.201  23.383
    8    HD3  LYS  38           HD3      LYS  38  -0.411  10.073  24.249
    9    HE2  LYS  38           HE2      LYS  38   1.934   9.716  24.881
   10    HE3  LYS  38           HE3      LYS  38   1.309   8.308  24.019
   11    HZ3  LYS  38           HZ1      LYS  38   2.626   8.697  22.243
   12    HZ2  LYS  38           HZ2      LYS  38   3.590   9.511  23.382
   13    HZ1  LYS  38           HZ3      LYS  38   2.532  10.387  22.382

  No H/Q in entry =          13
  In of MODEL   24
    1    H    ALA  39           H        ALA  39  -4.547  10.007  21.317
    2    HA   ALA  39           HA       ALA  39  -5.160   7.300  21.828
    3    HB3  ALA  39           HB1      ALA  39  -7.279   9.281  21.042
    4    HB2  ALA  39           HB2      ALA  39  -6.385   9.497  22.547
    5    HB1  ALA  39           HB3      ALA  39  -7.327   8.028  22.284

  No H/Q in entry =           5
  In of MODEL   24
    1    H    MET  40           H        MET  40  -5.693   9.313  18.971
    2    HA   MET  40           HA       MET  40  -7.197   7.403  17.510
    3    HB2  MET  40           HB2      MET  40  -5.539   9.765  16.605
    4    HB3  MET  40           HB3      MET  40  -6.577   8.821  15.533
    5    HG2  MET  40           HG2      MET  40  -7.602  10.098  18.081
    6    HG3  MET  40           HG3      MET  40  -7.636  10.928  16.527
    7    HE3  MET  40           HE1      MET  40 -10.238   9.348  14.455
    8    HE2  MET  40           HE2      MET  40  -8.482   9.433  14.316
    9    HE1  MET  40           HE3      MET  40  -9.379  10.817  14.940

  No H/Q in entry =           9
  In of MODEL   24
    1    H    MET  41           H        MET  41  -3.694   8.078  17.648
    2    HA   MET  41           HA       MET  41  -2.956   6.303  15.558
    3    HB2  MET  41           HB2      MET  41  -1.341   6.949  18.037
    4    HB3  MET  41           HB3      MET  41  -0.727   6.285  16.527
    5    HG2  MET  41           HG2      MET  41  -1.839   8.484  15.509
    6    HG3  MET  41           HG3      MET  41  -1.601   9.073  17.153
    7    HE2  MET  41           HE1      MET  41   1.277   6.925  17.537
    8    HE1  MET  41           HE2      MET  41   0.507   8.236  18.427
    9    HE3  MET  41           HE3      MET  41   2.138   8.448  17.792

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ASP  42           H        ASP  42  -3.367   5.849  19.043
    2    HA   ASP  42           HA       ASP  42  -2.378   3.238  19.218
    3    HB2  ASP  42           HB2      ASP  42  -3.230   5.019  21.030
    4    HB3  ASP  42           HB3      ASP  42  -4.675   4.018  20.953

  No H/Q in entry =           4
  In of MODEL   24
    1    H    GLN  43           H        GLN  43  -5.689   4.398  18.696
    2    HA   GLN  43           HA       GLN  43  -6.877   1.830  18.504
    3    HB2  GLN  43           HB2      GLN  43  -7.747   4.494  17.361
    4    HB3  GLN  43           HB3      GLN  43  -8.736   3.032  17.339
    5    HG2  GLN  43           HG2      GLN  43  -8.458   2.914  19.848
    6    HG3  GLN  43           HG3      GLN  43  -7.705   4.506  19.775
    7   HE21  GLN  43          HE21      GLN  43  -9.891   4.629  21.263
    8   HE22  GLN  43          HE22      GLN  43 -11.237   5.226  20.423

  No H/Q in entry =           8
  In of MODEL   24
    1    H    SER  44           H        SER  44  -5.485   4.012  16.092
    2    HA   SER  44           HA       SER  44  -6.200   2.532  13.804
    3    HB2  SER  44           HB2      SER  44  -4.904   4.895  14.246
    4    HB3  SER  44           HB3      SER  44  -3.565   3.874  13.727
    5    HG   SER  44           HG       SER  44  -4.651   4.859  11.955

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ARG  45           H        ARG  45  -3.336   2.376  15.900
    2    HA   ARG  45           HA       ARG  45  -1.883   0.392  14.533
    3    HB2  ARG  45           HB2      ARG  45  -1.026   1.805  16.401
    4    HB3  ARG  45           HB3      ARG  45  -2.040   0.895  17.519
    5    HG2  ARG  45           HG2      ARG  45  -0.841  -1.187  16.890
    6    HG3  ARG  45           HG3      ARG  45   0.197  -0.253  15.815
    7    HD2  ARG  45           HD2      ARG  45   0.945   1.121  17.770
    8    HD3  ARG  45           HD3      ARG  45  -0.002   0.066  18.842
    9    HE   ARG  45           HE       ARG  45   1.678  -1.564  17.276
   10   HH21  ARG  45          HH11      ARG  45   3.559  -2.417  18.126
   11   HH22  ARG  45          HH12      ARG  45   4.338  -1.640  19.459
   12   HH11  ARG  45          HH21      ARG  45   2.011   0.905  19.659
   13   HH12  ARG  45          HH22      ARG  45   3.461   0.243  20.325

  No H/Q in entry =          13
  In of MODEL   24
    1    H    MET  46           H        MET  46  -4.299   0.122  17.121
    2    HA   MET  46           HA       MET  46  -4.183  -2.678  17.438
    3    HB2  MET  46           HB2      MET  46  -6.321  -0.633  18.019
    4    HB3  MET  46           HB3      MET  46  -6.558  -2.347  18.365
    5    HG2  MET  46           HG2      MET  46  -4.563  -2.364  19.786
    6    HG3  MET  46           HG3      MET  46  -4.246  -0.680  19.401
    7    HE3  MET  46           HE1      MET  46  -7.952  -2.375  20.423
    8    HE2  MET  46           HE2      MET  46  -7.359  -2.587  22.067
    9    HE1  MET  46           HE3      MET  46  -6.461  -3.279  20.720

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ALA  47           H        ALA  47  -6.155  -0.633  15.325
    2    HA   ALA  47           HA       ALA  47  -7.803  -2.658  14.257
    3    HB3  ALA  47           HB1      ALA  47  -8.440  -0.410  13.830
    4    HB1  ALA  47           HB2      ALA  47  -7.954  -1.058  12.263
    5    HB2  ALA  47           HB3      ALA  47  -6.860  -0.006  13.163

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU  48           H        LEU  48  -4.655  -1.410  13.220
    2    HA   LEU  48           HA       LEU  48  -4.390  -3.013  10.885
    3    HB2  LEU  48           HB2      LEU  48  -2.320  -1.766  12.701
    4    HB3  LEU  48           HB3      LEU  48  -1.956  -2.499  11.139
    5    HG   LEU  48           HG       LEU  48  -3.940  -0.243  11.509
    6   HD13  LEU  48          HD11      LEU  48  -1.806   0.596  12.184
    7   HD12  LEU  48          HD12      LEU  48  -2.061   1.149  10.529
    8   HD11  LEU  48          HD13      LEU  48  -0.991  -0.217  10.848
    9   HD22  LEU  48          HD21      LEU  48  -4.418  -1.226   9.434
   10   HD21  LEU  48          HD22      LEU  48  -2.742  -1.693   9.150
   11   HD23  LEU  48          HD23      LEU  48  -3.228  -0.005   8.982

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ASN  49           H        ASN  49  -3.372  -3.418  14.238
    2    HA   ASN  49           HA       ASN  49  -1.810  -5.712  13.924
    3    HB2  ASN  49           HB2      ASN  49  -1.846  -4.349  15.967
    4    HB3  ASN  49           HB3      ASN  49  -3.499  -4.852  16.291
    5   HD21  ASN  49          HD21      ASN  49  -2.829  -5.839  18.326
    6   HD22  ASN  49          HD22      ASN  49  -1.973  -7.304  18.345

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLU  50           H        GLU  50  -5.277  -5.368  14.575
    2    HA   GLU  50           HA       GLU  50  -5.844  -8.157  14.689
    3    HB2  GLU  50           HB2      GLU  50  -7.402  -6.437  15.551
    4    HB3  GLU  50           HB3      GLU  50  -7.675  -5.872  13.901
    5    HG2  GLU  50           HG2      GLU  50  -8.578  -8.053  13.264
    6    HG3  GLU  50           HG3      GLU  50  -8.219  -8.699  14.862

  No H/Q in entry =           6
  In of MODEL   24
    1    H    ALA  51           H        ALA  51  -5.850  -5.766  12.086
    2    HA   ALA  51           HA       ALA  51  -6.857  -7.481  10.063
    3    HB3  ALA  51           HB1      ALA  51  -6.594  -5.677   8.690
    4    HB1  ALA  51           HB2      ALA  51  -4.951  -5.359   9.247
    5    HB2  ALA  51           HB3      ALA  51  -6.330  -4.817  10.206

  No H/Q in entry =           5
  In of MODEL   24
    1    H    HIS  52           H        HIS  52  -3.555  -6.636  11.063
    2    HA   HIS  52           HA       HIS  52  -2.175  -8.160   9.127
    3    HB2  HIS  52           HB2      HIS  52  -1.131  -6.435  10.588
    4    HB3  HIS  52           HB3      HIS  52  -1.300  -7.533  11.957
    5    HD1  HIS  52           HD1      HIS  52   0.167  -9.703  11.944
    6    HD2  HIS  52           HD2      HIS  52   0.950  -7.095   8.786
    7    HE1  HIS  52           HE1      HIS  52   2.349 -10.467  10.909
    8    HE2  HIS  52           HE2      HIS  52   2.839  -8.887   8.981

  No H/Q in entry =           8
  In of MODEL   24
    1    H    LEU  53           H        LEU  53  -3.423  -9.002  12.335
    2    HA   LEU  53           HA       LEU  53  -2.279 -11.570  12.543
    3    HB2  LEU  53           HB2      LEU  53  -4.746 -10.334  13.740
    4    HB3  LEU  53           HB3      LEU  53  -4.324 -12.017  14.039
    5    HG   LEU  53           HG       LEU  53  -2.381  -9.736  14.521
    6   HD12  LEU  53          HD11      LEU  53  -4.197 -11.114  16.522
    7   HD11  LEU  53          HD12      LEU  53  -4.421  -9.473  15.917
    8   HD13  LEU  53          HD13      LEU  53  -3.005  -9.871  16.884
    9   HD22  LEU  53          HD21      LEU  53  -1.123 -11.722  14.519
   10   HD21  LEU  53          HD22      LEU  53  -2.456 -12.679  15.157
   11   HD23  LEU  53          HD23      LEU  53  -1.565 -11.604  16.218

  No H/Q in entry =          11
  In of MODEL   24
    1    H    VAL  54           H        VAL  54  -5.360 -10.480  11.159
    2    HA   VAL  54           HA       VAL  54  -6.324 -13.057  10.474
    3    HB   VAL  54           HB       VAL  54  -6.907 -10.315   9.328
    4   HG12  VAL  54          HG11      VAL  54  -9.032 -11.651   8.508
    5   HG11  VAL  54          HG12      VAL  54  -7.950 -13.039   8.591
    6   HG13  VAL  54          HG13      VAL  54  -7.555 -11.676   7.547
    7   HG22  VAL  54          HG21      VAL  54  -7.827 -10.327  11.474
    8   HG21  VAL  54          HG22      VAL  54  -8.118 -12.064  11.458
    9   HG23  VAL  54          HG23      VAL  54  -9.171 -10.988  10.542

  No H/Q in entry =           9
  In of MODEL   24
    1    H    GLN  55           H        GLN  55  -4.391 -10.651   8.689
    2    HA   GLN  55           HA       GLN  55  -4.277 -12.125   6.277
    3    HB2  GLN  55           HB2      GLN  55  -3.624  -9.875   6.084
    4    HB3  GLN  55           HB3      GLN  55  -2.523  -9.971   7.456
    5    HG2  GLN  55           HG2      GLN  55  -0.817 -10.857   6.192
    6    HG3  GLN  55           HG3      GLN  55  -1.905 -11.812   5.195
    7   HE21  GLN  55          HE21      GLN  55  -1.895 -11.129   3.071
    8   HE22  GLN  55          HE22      GLN  55  -1.660  -9.530   2.558

  No H/Q in entry =           8
  In of MODEL   24
    1    H    THR  56           H        THR  56  -2.188 -12.141   9.170
    2    HA   THR  56           HA       THR  56  -0.140 -13.786   8.270
    3    HB   THR  56           HB       THR  56  -1.454 -13.771  11.000
    4    HG1  THR  56           HG1      THR  56   0.502 -12.253   9.709
    5   HG22  THR  56          HG21      THR  56   0.833 -14.629  11.707
    6   HG21  THR  56          HG22      THR  56   1.142 -14.951  10.000
    7   HG23  THR  56          HG23      THR  56  -0.172 -15.783  10.831

  No H/Q in entry =           7
  In of MODEL   24
    1    H    LYS  57           H        LYS  57  -3.289 -14.751   9.618
    2    HA   LYS  57           HA       LYS  57  -2.903 -17.556   9.383
    3    HB2  LYS  57           HB2      LYS  57  -4.706 -16.420  10.714
    4    HB3  LYS  57           HB3      LYS  57  -5.479 -15.963   9.204
    5    HG2  LYS  57           HG2      LYS  57  -5.773 -18.318   8.604
    6    HG3  LYS  57           HG3      LYS  57  -4.941 -18.816  10.075
    7    HD2  LYS  57           HD2      LYS  57  -6.709 -17.726  11.432
    8    HD3  LYS  57           HD3      LYS  57  -7.555 -17.272   9.954
    9    HE2  LYS  57           HE2      LYS  57  -7.817 -19.647   9.353
   10    HE3  LYS  57           HE3      LYS  57  -6.932 -20.133  10.797
   11    HZ2  LYS  57           HZ1      LYS  57  -9.523 -18.692  10.704
   12    HZ1  LYS  57           HZ2      LYS  57  -8.643 -18.995  12.125
   13    HZ3  LYS  57           HZ3      LYS  57  -9.262 -20.289  11.215

  No H/Q in entry =          13
  In of MODEL   24
    1    H    LEU  58           H        LEU  58  -4.167 -15.093   7.192
    2    HA   LEU  58           HA       LEU  58  -4.997 -16.906   5.186
    3    HB2  LEU  58           HB2      LEU  58  -4.326 -13.972   5.045
    4    HB3  LEU  58           HB3      LEU  58  -5.001 -14.898   3.704
    5    HG   LEU  58           HG       LEU  58  -6.293 -14.682   6.443
    6   HD11  LEU  58          HD11      LEU  58  -6.543 -13.037   3.945
    7   HD13  LEU  58          HD12      LEU  58  -6.532 -12.524   5.633
    8   HD12  LEU  58          HD13      LEU  58  -7.967 -13.288   4.954
    9   HD22  LEU  58          HD21      LEU  58  -7.292 -16.573   5.574
   10   HD21  LEU  58          HD22      LEU  58  -6.933 -16.134   3.904
   11   HD23  LEU  58          HD23      LEU  58  -8.285 -15.375   4.744

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  59           H        ILE  59  -1.841 -15.761   6.063
    2    HA   ILE  59           HA       ILE  59  -0.744 -16.521   3.435
    3    HB   ILE  59           HB       ILE  59   0.060 -14.469   5.005
    4   HG12  ILE  59          HG12      ILE  59   2.122 -16.166   3.585
    5   HG13  ILE  59          HG13      ILE  59   0.950 -15.202   2.723
    6   HG23  ILE  59          HG21      ILE  59   1.880 -14.989   6.411
    7   HG22  ILE  59          HG22      ILE  59   2.108 -16.573   5.704
    8   HG21  ILE  59          HG23      ILE  59   0.743 -16.265   6.776
    9   HD11  ILE  59          HD11      ILE  59   2.880 -14.126   4.778
   10   HD13  ILE  59          HD12      ILE  59   1.738 -13.167   3.840
   11   HD12  ILE  59          HD13      ILE  59   3.082 -13.977   3.034

  No H/Q in entry =          11
  In of MODEL   24
    1    H    GLU  60           H        GLU  60  -0.800 -17.616   6.806
    2    HA   GLU  60           HA       GLU  60   1.189 -19.639   6.561
    3    HB2  GLU  60           HB2      GLU  60   0.433 -18.834   8.743
    4    HB3  GLU  60           HB3      GLU  60  -1.187 -19.451   8.431
    5    HG2  GLU  60           HG2      GLU  60  -0.292 -21.750   8.303
    6    HG3  GLU  60           HG3      GLU  60   1.331 -21.134   8.607

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLY  61           H        GLY  61  -2.320 -19.661   6.053
    2    HA3  GLY  61           HA2      GLY  61  -2.127 -22.462   5.105
    3    HA2  GLY  61           HA3      GLY  61  -3.600 -21.692   5.687

  No H/Q in entry =           3
  In of MODEL   24
    1    H    ASP  62           H        ASP  62  -1.322 -20.169   3.493
    2    HA   ASP  62           HA       ASP  62  -3.313 -19.420   1.642
    3    HB2  ASP  62           HB2      ASP  62  -1.396 -18.720   0.242
    4    HB3  ASP  62           HB3      ASP  62  -1.231 -18.179   1.909

  No H/Q in entry =           4
  In of MODEL   24
    1    H    ALA  63           H        ALA  63  -1.132 -22.224   1.704
    2    HA   ALA  63           HA       ALA  63  -1.432 -23.106  -0.953
    3    HB3  ALA  63           HB1      ALA  63   0.177 -24.079   0.627
    4    HB2  ALA  63           HB2      ALA  63  -0.834 -25.311  -0.128
    5    HB1  ALA  63           HB3      ALA  63  -1.155 -24.803   1.531

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLY  64           H        GLY  64  -2.634 -25.306  -1.364
    2    HA3  GLY  64           HA2      GLY  64  -4.666 -26.588  -0.782
    3    HA2  GLY  64           HA3      GLY  64  -5.406 -25.054  -0.358

  No H/Q in entry =           3
  In of MODEL   24
    1    H    GLU  65           H        GLU  65  -4.456 -23.571  -2.644
    2    HA   GLU  65           HA       GLU  65  -6.508 -24.260  -4.477
    3    HB2  GLU  65           HB2      GLU  65  -4.202 -22.330  -4.732
    4    HB3  GLU  65           HB3      GLU  65  -5.524 -22.461  -5.892
    5    HG2  GLU  65           HG2      GLU  65  -6.310 -20.769  -4.495
    6    HG3  GLU  65           HG3      GLU  65  -7.045 -22.196  -3.766

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLY  66           H        GLY  66  -3.071 -24.770  -4.460
    2    HA3  GLY  66           HA2      GLY  66  -3.173 -26.972  -6.252
    3    HA2  GLY  66           HA3      GLY  66  -2.516 -25.554  -7.045

  No H/Q in entry =           3
  In of MODEL   24
    1    H    LYS  67           H        LYS  67  -0.636 -26.913  -7.317
    2    HA   LYS  67           HA       LYS  67   0.893 -28.029  -5.297
    3    HB2  LYS  67           HB2      LYS  67   1.707 -26.922  -7.981
    4    HB3  LYS  67           HB3      LYS  67   2.766 -27.893  -6.950
    5    HG2  LYS  67           HG2      LYS  67   1.109 -29.714  -6.936
    6    HG3  LYS  67           HG3      LYS  67   0.030 -28.750  -7.943
    7    HD2  LYS  67           HD2      LYS  67   1.717 -28.737  -9.743
    8    HD3  LYS  67           HD3      LYS  67   2.795 -29.708  -8.737
    9    HE2  LYS  67           HE2      LYS  67   1.092 -31.498  -8.645
   10    HE3  LYS  67           HE3      LYS  67   0.029 -30.534  -9.669
   11    HZ2  LYS  67           HZ1      LYS  67   1.975 -32.299 -10.493
   12    HZ1  LYS  67           HZ2      LYS  67   2.611 -30.758 -10.818
   13    HZ3  LYS  67           HZ3      LYS  67   1.108 -31.212 -11.463

  No H/Q in entry =          13
  In of MODEL   24
    1    H    MET  68           H        MET  68   2.084 -25.224  -7.032
    2    HA   MET  68           HA       MET  68   3.340 -24.200  -4.576
    3    HB2  MET  68           HB2      MET  68   3.992 -23.780  -7.492
    4    HB3  MET  68           HB3      MET  68   4.824 -22.973  -6.162
    5    HG2  MET  68           HG2      MET  68   4.605 -25.980  -6.486
    6    HG3  MET  68           HG3      MET  68   6.021 -25.024  -6.932
    7    HE3  MET  68           HE1      MET  68   7.675 -23.871  -3.907
    8    HE2  MET  68           HE2      MET  68   6.372 -22.834  -4.483
    9    HE1  MET  68           HE3      MET  68   7.350 -23.732  -5.640

  No H/Q in entry =           9
  In of MODEL   24
    1    H    LYS  69           H        LYS  69   0.677 -23.543  -6.483
    2    HA   LYS  69           HA       LYS  69   0.881 -20.674  -6.481
    3    HB2  LYS  69           HB2      LYS  69  -0.251 -21.852  -8.303
    4    HB3  LYS  69           HB3      LYS  69  -1.511 -22.364  -7.174
    5    HG2  LYS  69           HG2      LYS  69  -2.089 -20.056  -6.687
    6    HG3  LYS  69           HG3      LYS  69  -0.751 -19.476  -7.679
    7    HD2  LYS  69           HD2      LYS  69  -1.788 -20.502  -9.673
    8    HD3  LYS  69           HD3      LYS  69  -3.135 -21.060  -8.678
    9    HE2  LYS  69           HE2      LYS  69  -2.329 -18.151  -8.948
   10    HE3  LYS  69           HE3      LYS  69  -3.606 -18.911  -9.897
   11    HZ1  LYS  69           HZ1      LYS  69  -4.284 -19.644  -7.423
   12    HZ3  LYS  69           HZ2      LYS  69  -4.889 -18.260  -8.199
   13    HZ2  LYS  69           HZ3      LYS  69  -3.592 -18.127  -7.110

  No H/Q in entry =          13
  In of MODEL   24
    1    H    VAL  70           H        VAL  70  -0.472 -19.150  -5.479
    2    HA   VAL  70           HA       VAL  70  -1.865 -20.078  -3.030
    3    HB   VAL  70           HB       VAL  70  -1.058 -18.008  -1.920
    4   HG11  VAL  70          HG11      VAL  70   0.200 -20.112  -1.653
    5   HG13  VAL  70          HG12      VAL  70   1.290 -18.725  -1.650
    6   HG12  VAL  70          HG13      VAL  70   1.147 -19.731  -3.092
    7   HG21  VAL  70          HG21      VAL  70   0.234 -17.594  -4.618
    8   HG23  VAL  70          HG22      VAL  70   0.999 -16.938  -3.173
    9   HG22  VAL  70          HG23      VAL  70  -0.629 -16.428  -3.612

  No H/Q in entry =           9
  In of MODEL   24
    1    H    SER  71           H        SER  71  -3.353 -18.350  -2.189
    2    HA   SER  71           HA       SER  71  -5.300 -17.641  -4.098
    3    HB2  SER  71           HB2      SER  71  -5.722 -17.879  -1.629
    4    HB3  SER  71           HB3      SER  71  -4.845 -16.374  -1.374
    5    HG   SER  71           HG       SER  71  -6.486 -15.713  -3.180

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU  72           H        LEU  72  -5.449 -15.990  -5.442
    2    HA   LEU  72           HA       LEU  72  -3.301 -14.225  -5.917
    3    HB2  LEU  72           HB2      LEU  72  -6.160 -14.222  -6.878
    4    HB3  LEU  72           HB3      LEU  72  -4.938 -13.090  -7.449
    5    HG   LEU  72           HG       LEU  72  -4.589 -16.104  -7.572
    6   HD13  LEU  72          HD11      LEU  72  -6.518 -15.421  -8.946
    7   HD12  LEU  72          HD12      LEU  72  -5.159 -15.887  -9.970
    8   HD11  LEU  72          HD13      LEU  72  -5.532 -14.181  -9.722
    9   HD23  LEU  72          HD21      LEU  72  -2.998 -15.274  -9.480
   10   HD22  LEU  72          HD22      LEU  72  -2.440 -15.127  -7.821
   11   HD21  LEU  72          HD23      LEU  72  -3.086 -13.720  -8.660

  No H/Q in entry =          11
  In of MODEL   24
    1    H    VAL  73           H        VAL  73  -6.394 -13.798  -4.305
    2    HA   VAL  73           HA       VAL  73  -6.383 -11.026  -3.961
    3    HB   VAL  73           HB       VAL  73  -8.102 -11.351  -2.357
    4   HG11  VAL  73          HG11      VAL  73  -8.476 -12.113  -4.773
    5   HG13  VAL  73          HG12      VAL  73  -9.605 -12.737  -3.573
    6   HG12  VAL  73          HG13      VAL  73  -8.298 -13.761  -4.171
    7   HG22  VAL  73          HG21      VAL  73  -7.360 -12.848  -0.750
    8   HG21  VAL  73          HG22      VAL  73  -6.709 -13.968  -1.946
    9   HG23  VAL  73          HG23      VAL  73  -8.447 -13.898  -1.660

  No H/Q in entry =           9
  In of MODEL   24
    1    H    LEU  74           H        LEU  74  -4.503 -13.430  -2.361
    2    HA   LEU  74           HA       LEU  74  -4.081 -12.291   0.161
    3    HB2  LEU  74           HB2      LEU  74  -3.341 -14.526  -0.326
    4    HB3  LEU  74           HB3      LEU  74  -2.271 -13.942  -1.600
    5    HG   LEU  74           HG       LEU  74  -0.942 -12.711   0.081
    6   HD13  LEU  74          HD11      LEU  74  -2.487 -12.173   1.799
    7   HD12  LEU  74          HD12      LEU  74  -1.452 -13.405   2.524
    8   HD11  LEU  74          HD13      LEU  74  -3.054 -13.839   1.923
    9   HD21  LEU  74          HD21      LEU  74  -0.835 -15.306  -0.502
   10   HD23  LEU  74          HD22      LEU  74  -1.206 -15.421   1.204
   11   HD22  LEU  74          HD23      LEU  74   0.237 -14.578   0.693

  No H/Q in entry =          11
  In of MODEL   24
    1    H    VAL  75           H        VAL  75  -2.168 -11.945  -2.788
    2    HA   VAL  75           HA       VAL  75  -0.335 -10.056  -1.773
    3    HB   VAL  75           HB       VAL  75  -1.287 -10.533  -4.599
    4   HG11  VAL  75          HG11      VAL  75   1.005  -8.836  -3.514
    5   HG13  VAL  75          HG12      VAL  75  -0.391  -8.259  -4.412
    6   HG12  VAL  75          HG13      VAL  75   0.804  -9.271  -5.207
    7   HG23  VAL  75          HG21      VAL  75   0.996 -11.619  -4.723
    8   HG22  VAL  75          HG22      VAL  75  -0.135 -12.444  -3.651
    9   HG21  VAL  75          HG23      VAL  75   1.126 -11.412  -2.976

  No H/Q in entry =           9
  In of MODEL   24
    1    H    GLU  76           H        GLU  76  -3.470  -9.647  -3.447
    2    HA   GLU  76           HA       GLU  76  -3.462  -6.833  -3.556
    3    HB2  GLU  76           HB2      GLU  76  -5.142  -8.309  -4.697
    4    HB3  GLU  76           HB3      GLU  76  -5.849  -8.669  -3.131
    5    HG2  GLU  76           HG2      GLU  76  -6.418  -6.296  -2.815
    6    HG3  GLU  76           HG3      GLU  76  -5.693  -5.887  -4.358

  No H/Q in entry =           6
  In of MODEL   24
    1    H    ALA  77           H        ALA  77  -4.632  -9.031  -1.016
    2    HA   ALA  77           HA       ALA  77  -5.555  -7.005   0.733
    3    HB2  ALA  77           HB1      ALA  77  -6.137  -9.414   0.947
    4    HB3  ALA  77           HB2      ALA  77  -5.537  -8.723   2.453
    5    HB1  ALA  77           HB3      ALA  77  -4.484  -9.740   1.472

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLN  78           H        GLN  78  -2.439  -8.621   0.388
    2    HA   GLN  78           HA       GLN  78  -1.168  -7.482   2.642
    3    HB2  GLN  78           HB2      GLN  78  -0.348  -9.445   1.281
    4    HB3  GLN  78           HB3      GLN  78   0.136  -8.299   0.033
    5    HG2  GLN  78           HG2      GLN  78   1.602  -7.157   1.648
    6    HG3  GLN  78           HG3      GLN  78   1.121  -8.300   2.898
    7   HE21  GLN  78          HE21      GLN  78   1.131 -10.125   0.140
    8   HE22  GLN  78          HE22      GLN  78   2.730 -10.694   0.180

  No H/Q in entry =           8
  In of MODEL   24
    1    H    LEU  79           H        LEU  79  -1.495  -6.422  -0.710
    2    HA   LEU  79           HA       LEU  79   0.239  -4.232  -0.693
    3    HB2  LEU  79           HB2      LEU  79  -0.795  -5.021  -2.750
    4    HB3  LEU  79           HB3      LEU  79  -2.393  -4.593  -2.150
    5    HG   LEU  79           HG       LEU  79  -1.797  -2.219  -2.128
    6   HD13  LEU  79          HD11      LEU  79   0.445  -2.022  -1.604
    7   HD12  LEU  79          HD12      LEU  79   0.509  -1.740  -3.344
    8   HD11  LEU  79          HD13      LEU  79   0.926  -3.326  -2.692
    9   HD23  LEU  79          HD21      LEU  79  -1.146  -2.040  -4.677
   10   HD22  LEU  79          HD22      LEU  79  -2.691  -2.753  -4.224
   11   HD21  LEU  79          HD23      LEU  79  -1.338  -3.793  -4.659

  No H/Q in entry =          11
  In of MODEL   24
    1    H    HIS  80           H        HIS  80  -3.235  -4.316   0.116
    2    HA   HIS  80           HA       HIS  80  -3.369  -1.555   0.772
    3    HB2  HIS  80           HB2      HIS  80  -5.124  -3.924   1.088
    4    HB3  HIS  80           HB3      HIS  80  -5.421  -2.575   2.188
    5    HD1  HIS  80           HD1      HIS  80  -6.997  -0.905   1.268
    6    HD2  HIS  80           HD2      HIS  80  -4.830  -2.773  -1.764
    7    HE1  HIS  80           HE1      HIS  80  -7.804   0.105  -0.917
    8    HE2  HIS  80           HE2      HIS  80  -6.489  -1.028  -2.775

  No H/Q in entry =           8
  In of MODEL   24
    1    H    LEU  81           H        LEU  81  -2.954  -4.455   2.775
    2    HA   LEU  81           HA       LEU  81  -2.924  -3.102   5.256
    3    HB2  LEU  81           HB2      LEU  81  -1.760  -5.747   4.388
    4    HB3  LEU  81           HB3      LEU  81  -1.730  -5.185   6.061
    5    HG   LEU  81           HG       LEU  81  -4.272  -5.384   4.421
    6   HD12  LEU  81          HD11      LEU  81  -4.629  -7.439   5.972
    7   HD11  LEU  81          HD12      LEU  81  -2.877  -7.407   6.166
    8   HD13  LEU  81          HD13      LEU  81  -3.582  -7.625   4.564
    9   HD23  LEU  81          HD21      LEU  81  -5.132  -5.562   6.918
   10   HD22  LEU  81          HD22      LEU  81  -4.768  -3.983   6.226
   11   HD21  LEU  81          HD23      LEU  81  -3.604  -4.767   7.294

  No H/Q in entry =          11
  In of MODEL   24
    1    H    MET  82           H        MET  82  -0.253  -4.071   3.101
    2    HA   MET  82           HA       MET  82   1.841  -3.220   4.792
    3    HB2  MET  82           HB2      MET  82   1.633  -3.564   1.800
    4    HB3  MET  82           HB3      MET  82   3.124  -3.026   2.569
    5    HG2  MET  82           HG2      MET  82   1.655  -5.580   3.293
    6    HG3  MET  82           HG3      MET  82   3.034  -5.505   2.199
    7    HE3  MET  82           HE1      MET  82   6.056  -4.833   4.196
    8    HE2  MET  82           HE2      MET  82   5.167  -3.446   3.570
    9    HE1  MET  82           HE3      MET  82   5.226  -4.940   2.639

  No H/Q in entry =           9
  In of MODEL   24
    1    H    THR  83           H        THR  83   0.070  -1.543   2.223
    2    HA   THR  83           HA       THR  83   1.537   0.872   2.310
    3    HB   THR  83           HB       THR  83  -0.612   1.844   1.311
    4    HG1  THR  83           HG1      THR  83  -2.292   0.585   1.200
    5   HG22  THR  83          HG21      THR  83  -0.374   0.016  -0.684
    6   HG21  THR  83          HG22      THR  83   1.115  -0.309   0.201
    7   HG23  THR  83          HG23      THR  83   0.794   1.310  -0.419

  No H/Q in entry =           7
  In of MODEL   24
    1    H    SER  84           H        SER  84  -1.500  -0.086   3.899
    2    HA   SER  84           HA       SER  84  -1.946   2.358   5.236
    3    HB2  SER  84           HB2      SER  84  -2.847  -0.458   5.803
    4    HB3  SER  84           HB3      SER  84  -3.314   0.896   6.830
    5    HG   SER  84           HG       SER  84  -3.766   0.586   4.037

  No H/Q in entry =           5
  In of MODEL   24
    1    H    MET  85           H        MET  85  -0.310  -0.610   6.381
    2    HA   MET  85           HA       MET  85   0.219   0.311   8.985
    3    HB2  MET  85           HB2      MET  85   0.460  -2.041   8.311
    4    HB3  MET  85           HB3      MET  85   1.859  -1.611   7.328
    5    HG2  MET  85           HG2      MET  85   3.033  -0.797   9.338
    6    HG3  MET  85           HG3      MET  85   1.629  -1.201  10.325
    7    HE2  MET  85           HE1      MET  85   5.115  -2.908   9.095
    8    HE1  MET  85           HE2      MET  85   4.095  -2.205   7.842
    9    HE3  MET  85           HE3      MET  85   4.304  -3.951   7.922

  No H/Q in entry =           9
  In of MODEL   24
    1    H    LEU  86           H        LEU  86   2.173   0.513   6.043
    2    HA   LEU  86           HA       LEU  86   4.412   1.774   7.205
    3    HB2  LEU  86           HB2      LEU  86   4.206   0.690   4.899
    4    HB3  LEU  86           HB3      LEU  86   3.436   2.189   4.378
    5    HG   LEU  86           HG       LEU  86   5.488   3.390   5.365
    6   HD11  LEU  86          HD11      LEU  86   6.127   0.764   6.175
    7   HD13  LEU  86          HD12      LEU  86   7.164   2.185   6.274
    8   HD12  LEU  86          HD13      LEU  86   7.255   1.131   4.865
    9   HD23  LEU  86          HD21      LEU  86   6.174   1.604   3.023
   10   HD22  LEU  86          HD22      LEU  86   6.606   3.292   3.282
   11   HD21  LEU  86          HD23      LEU  86   4.945   2.862   2.877

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ALA  87           H        ALA  87   1.537   3.082   5.604
    2    HA   ALA  87           HA       ALA  87   2.196   5.797   5.683
    3    HB1  ALA  87           HB1      ALA  87  -0.149   4.223   5.135
    4    HB3  ALA  87           HB2      ALA  87   0.204   5.875   4.632
    5    HB2  ALA  87           HB3      ALA  87  -0.605   5.576   6.173

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ARG  88           H        ARG  88   0.448   3.843   8.070
    2    HA   ARG  88           HA       ARG  88  -0.024   5.909   9.909
    3    HB2  ARG  88           HB2      ARG  88  -1.018   3.580   9.977
    4    HB3  ARG  88           HB3      ARG  88   0.507   3.045  10.692
    5    HG2  ARG  88           HG2      ARG  88   0.072   5.135  12.304
    6    HG3  ARG  88           HG3      ARG  88  -1.600   4.848  11.841
    7    HD2  ARG  88           HD2      ARG  88  -1.757   3.006  13.092
    8    HD3  ARG  88           HD3      ARG  88  -0.179   2.385  12.570
    9    HE   ARG  88           HE       ARG  88  -0.694   3.667  15.018
   10   HH21  ARG  88          HH11      ARG  88   0.882   4.646  16.261
   11   HH22  ARG  88          HH12      ARG  88   2.414   5.035  15.563
   12   HH11  ARG  88          HH21      ARG  88   1.602   3.788  12.452
   13   HH12  ARG  88          HH22      ARG  88   2.830   4.532  13.418

  No H/Q in entry =          13
  In of MODEL   24
    1    H    GLU  89           H        GLU  89   2.720   3.624   9.706
    2    HA   GLU  89           HA       GLU  89   3.992   4.490  12.053
    3    HB2  GLU  89           HB2      GLU  89   4.609   2.453  10.718
    4    HB3  GLU  89           HB3      GLU  89   5.416   3.525   9.572
    5    HG2  GLU  89           HG2      GLU  89   6.912   4.342  11.321
    6    HG3  GLU  89           HG3      GLU  89   6.049   3.409  12.539

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LEU  90           H        LEU  90   4.351   5.630   8.724
    2    HA   LEU  90           HA       LEU  90   6.324   7.587   9.312
    3    HB2  LEU  90           HB2      LEU  90   4.322   7.296   7.076
    4    HB3  LEU  90           HB3      LEU  90   5.581   8.538   7.100
    5    HG   LEU  90           HG       LEU  90   6.186   5.587   7.445
    6   HD12  LEU  90          HD11      LEU  90   6.951   5.796   5.009
    7   HD11  LEU  90          HD12      LEU  90   5.969   7.260   4.951
    8   HD13  LEU  90          HD13      LEU  90   5.212   5.705   5.295
    9   HD22  LEU  90          HD21      LEU  90   8.105   6.695   8.133
   10   HD21  LEU  90          HD22      LEU  90   7.793   8.105   7.121
   11   HD23  LEU  90          HD23      LEU  90   8.422   6.623   6.401

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  91           H        ILE  91   2.788   7.683   9.146
    2    HA   ILE  91           HA       ILE  91   2.506  10.464   9.588
    3    HB   ILE  91           HB       ILE  91   0.659   8.132  10.128
    4   HG12  ILE  91          HG12      ILE  91   0.472  10.412   8.136
    5   HG13  ILE  91          HG13      ILE  91   1.300   8.898   7.772
    6   HG22  ILE  91          HG21      ILE  91  -1.026  10.229  10.178
    7   HG21  ILE  91          HG22      ILE  91   0.390  11.029  10.855
    8   HG23  ILE  91          HG23      ILE  91  -0.283   9.609  11.652
    9   HD13  ILE  91          HD11      ILE  91  -0.673   7.654   7.811
   10   HD12  ILE  91          HD12      ILE  91  -1.225   9.180   7.122
   11   HD11  ILE  91          HD13      ILE  91  -1.512   8.828   8.826

  No H/Q in entry =          11
  In of MODEL   24
    1    H    THR  92           H        THR  92   2.837   7.721  11.799
    2    HA   THR  92           HA       THR  92   2.413   9.112  14.216
    3    HB   THR  92           HB       THR  92   4.172   6.735  13.567
    4    HG1  THR  92           HG1      THR  92   2.187   6.022  13.459
    5   HG22  THR  92          HG21      THR  92   3.770   6.468  16.200
    6   HG21  THR  92          HG22      THR  92   3.744   8.228  16.121
    7   HG23  THR  92          HG23      THR  92   5.161   7.339  15.558

  No H/Q in entry =           7
  In of MODEL   24
    1    H    GLU  93           H        GLU  93   5.363   8.592  12.299
    2    HA   GLU  93           HA       GLU  93   7.139   9.985  14.000
    3    HB2  GLU  93           HB2      GLU  93   7.235   9.659  10.987
    4    HB3  GLU  93           HB3      GLU  93   8.582  10.163  12.006
    5    HG2  GLU  93           HG2      GLU  93   7.113   7.559  12.455
    6    HG3  GLU  93           HG3      GLU  93   8.505   7.678  11.385

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LEU  94           H        LEU  94   5.126  11.036  11.274
    2    HA   LEU  94           HA       LEU  94   5.990  13.721  11.170
    3    HB2  LEU  94           HB2      LEU  94   3.375  12.410  10.407
    4    HB3  LEU  94           HB3      LEU  94   3.671  14.131  10.161
    5    HG   LEU  94           HG       LEU  94   5.651  12.096   9.128
    6   HD11  LEU  94          HD11      LEU  94   2.927  12.702   8.049
    7   HD13  LEU  94          HD12      LEU  94   3.879  11.225   7.934
    8   HD12  LEU  94          HD13      LEU  94   4.249  12.594   6.886
    9   HD23  LEU  94          HD21      LEU  94   5.949  13.921   7.400
   10   HD22  LEU  94          HD22      LEU  94   6.366  14.410   9.043
   11   HD21  LEU  94          HD23      LEU  94   4.829  14.909   8.335

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  95           H        ILE  95   3.409  12.165  13.053
    2    HA   ILE  95           HA       ILE  95   2.410  14.540  14.235
    3    HB   ILE  95           HB       ILE  95   2.361  11.662  15.169
    4   HG12  ILE  95          HG12      ILE  95   0.184  13.478  14.102
    5   HG13  ILE  95          HG13      ILE  95   1.123  12.396  13.079
    6   HG21  ILE  95          HG21      ILE  95   1.125  14.165  16.356
    7   HG23  ILE  95          HG22      ILE  95   2.144  12.977  17.169
    8   HG22  ILE  95          HG23      ILE  95   0.502  12.549  16.687
    9   HD13  ILE  95          HD11      ILE  95   0.175  10.480  13.999
   10   HD12  ILE  95          HD12      ILE  95  -1.184  11.598  14.065
   11   HD11  ILE  95          HD13      ILE  95  -0.233  11.284  15.516

  No H/Q in entry =          11
  In of MODEL   24
    1    H    GLU  96           H        GLU  96   4.953  12.271  15.251
    2    HA   GLU  96           HA       GLU  96   5.520  13.466  17.742
    3    HB2  GLU  96           HB2      GLU  96   6.426  11.286  17.106
    4    HB3  GLU  96           HB3      GLU  96   7.382  12.036  15.829
    5    HG2  GLU  96           HG2      GLU  96   9.034  12.555  17.298
    6    HG3  GLU  96           HG3      GLU  96   7.898  13.395  18.345

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LEU  97           H        LEU  97   6.627  14.205  14.459
    2    HA   LEU  97           HA       LEU  97   8.550  16.165  15.175
    3    HB2  LEU  97           HB2      LEU  97   6.960  15.640  12.673
    4    HB3  LEU  97           HB3      LEU  97   8.008  17.051  12.795
    5    HG   LEU  97           HG       LEU  97   8.977  14.235  13.370
    6   HD12  LEU  97          HD11      LEU  97   9.990  14.401  11.057
    7   HD11  LEU  97          HD12      LEU  97   8.968  15.812  10.784
    8   HD13  LEU  97          HD13      LEU  97   8.235  14.235  11.080
    9   HD23  LEU  97          HD21      LEU  97  11.176  15.467  12.635
   10   HD22  LEU  97          HD22      LEU  97  10.553  15.755  14.259
   11   HD21  LEU  97          HD23      LEU  97  10.270  16.940  12.986

  No H/Q in entry =          11
  In of MODEL   24
    1    H    HIS  98           H        HIS  98   5.065  16.368  14.501
    2    HA   HIS  98           HA       HIS  98   4.821  19.174  14.626
    3    HB2  HIS  98           HB2      HIS  98   2.883  16.964  15.349
    4    HB3  HIS  98           HB3      HIS  98   2.449  18.674  15.397
    5    HD1  HIS  98           HD1      HIS  98   3.429  15.931  13.006
    6    HD2  HIS  98           HD2      HIS  98   2.132  19.890  12.864
    7    HE1  HIS  98           HE1      HIS  98   2.893  16.422  10.578
    8    HE2  HIS  98           HE2      HIS  98   2.106  18.827  10.470

  No H/Q in entry =           8
  In of MODEL   24
    1    H    GLU  99           H        GLU  99   4.891  16.692  17.134
    2    HA   GLU  99           HA       GLU  99   4.306  18.405  19.323
    3    HB2  GLU  99           HB2      GLU  99   4.167  15.926  19.427
    4    HB3  GLU  99           HB3      GLU  99   5.926  15.845  19.329
    5    HG2  GLU  99           HG2      GLU  99   6.129  17.140  21.400
    6    HG3  GLU  99           HG3      GLU  99   4.379  17.316  21.485

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LYS 100           H        LYS 100   7.348  17.409  17.777
    2    HA   LYS 100           HA       LYS 100   9.021  18.782  19.638
    3    HB2  LYS 100           HB2      LYS 100   9.516  17.839  16.805
    4    HB3  LYS 100           HB3      LYS 100  10.756  18.587  17.817
    5    HG2  LYS 100           HG2      LYS 100  10.336  16.850  19.562
    6    HG3  LYS 100           HG3      LYS 100   9.194  16.066  18.467
    7    HD2  LYS 100           HD2      LYS 100  10.991  15.742  16.811
    8    HD3  LYS 100           HD3      LYS 100  12.138  16.538  17.890
    9    HE2  LYS 100           HE2      LYS 100  11.698  14.797  19.612
   10    HE3  LYS 100           HE3      LYS 100  10.612  13.979  18.484
   11    HZ1  LYS 100           HZ1      LYS 100  13.449  14.590  17.841
   12    HZ3  LYS 100           HZ2      LYS 100  12.389  13.553  17.011
   13    HZ2  LYS 100           HZ3      LYS 100  12.961  13.127  18.554

  No H/Q in entry =          13
  In of MODEL   24
    1    H    LEU 101           H        LEU 101   7.362  19.733  16.671
    2    HA   LEU 101           HA       LEU 101   8.628  22.264  16.334
    3    HB2  LEU 101           HB2      LEU 101   6.014  21.080  15.437
    4    HB3  LEU 101           HB3      LEU 101   6.300  22.805  15.226
    5    HG   LEU 101           HG       LEU 101   8.301  20.745  14.277
    6   HD12  LEU 101          HD11      LEU 101   7.170  21.266  11.985
    7   HD11  LEU 101          HD12      LEU 101   5.774  21.727  12.956
    8   HD13  LEU 101          HD13      LEU 101   6.405  20.084  13.047
    9   HD21  LEU 101          HD21      LEU 101   7.734  23.667  13.709
   10   HD23  LEU 101          HD22      LEU 101   8.701  22.684  12.611
   11   HD22  LEU 101          HD23      LEU 101   9.239  22.937  14.271

  No H/Q in entry =          11
  In of MODEL   24
    1    H    LYS 102           H        LYS 102   7.055  21.166  18.945
    2    HA   LYS 102           HA       LYS 102   6.435  22.276  20.870
    3    HB2  LYS 102           HB2      LYS 102   7.763  24.236  19.747
    4    HB3  LYS 102           HB3      LYS 102   6.178  24.872  19.361
    5    HG2  LYS 102           HG2      LYS 102   7.536  24.597  22.021
    6    HG3  LYS 102           HG3      LYS 102   6.614  25.943  21.383
    7    HD2  LYS 102           HD2      LYS 102   5.313  23.335  22.263
    8    HD3  LYS 102           HD3      LYS 102   5.583  24.694  23.343
    9    HE2  LYS 102           HE2      LYS 102   3.304  24.332  21.844
   10    HE3  LYS 102           HE3      LYS 102   3.834  25.870  22.524
   11    HZ2  LYS 102           HZ1      LYS 102   3.318  25.981  20.141
   12    HZ1  LYS 102           HZ2      LYS 102   4.559  24.872  19.828
   13    HZ3  LYS 102           HZ3      LYS 102   4.930  26.398  20.468

  No H/Q in entry =          13
  In of MODEL   24
    1    H    ALA 103           H        ALA 103   4.843  23.843  18.090
    2    HA   ALA 103           HA       ALA 103   2.396  24.472  18.960
    3    HB1  ALA 103           HB1      ALA 103   1.492  23.641  16.716
    4    HB2  ALA 103           HB2      ALA 103   3.130  23.070  16.396
    5    HB3  ALA 103           HB3      ALA 103   2.829  24.789  16.656

  No H/Q in entry =           5
  In of MODEL   24
    1    H1   ALA   1           H3       ALA   1  10.220 -20.273  -6.133
    2    H2   ALA   1           H2       ALA   1   9.259 -20.463  -7.524
    3    H3   ALA   1           H1       ALA   1   8.798 -21.196  -6.061
    4    HA   ALA   1           HA       ALA   1   9.804 -23.028  -6.789
    5    HB1  ALA   1           HB1      ALA   1   9.918 -22.678  -9.065
    6    HB2  ALA   1           HB2      ALA   1  11.647 -22.563  -8.728
    7    HB3  ALA   1           HB3      ALA   1  10.679 -21.096  -8.888

  No H/Q in entry =           7
  In of MODEL   24
    1    H    GLU   2           H        GLU   2  12.067 -24.027  -6.833
    2    HA   GLU   2           HA       GLU   2  13.439 -23.967  -4.614
    3    HB2  GLU   2           HB2      GLU   2  14.811 -23.873  -7.307
    4    HB3  GLU   2           HB3      GLU   2  15.519 -24.494  -5.816
    5    HG2  GLU   2           HG2      GLU   2  14.461 -26.490  -6.056
    6    HG3  GLU   2           HG3      GLU   2  12.907 -25.712  -6.325

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLU   3           H        GLU   3  15.261 -22.148  -7.012
    2    HA   GLU   3           HA       GLU   3  16.440 -20.479  -5.052
    3    HB2  GLU   3           HB2      GLU   3  16.399 -20.485  -8.062
    4    HB3  GLU   3           HB3      GLU   3  17.168 -19.170  -7.175
    5    HG2  GLU   3           HG2      GLU   3  18.797 -20.576  -6.240
    6    HG3  GLU   3           HG3      GLU   3  17.821 -22.023  -6.461

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LEU   4           H        LEU   4  14.189 -19.592  -7.697
    2    HA   LEU   4           HA       LEU   4  13.775 -16.972  -7.095
    3    HB2  LEU   4           HB2      LEU   4  11.562 -18.902  -7.830
    4    HB3  LEU   4           HB3      LEU   4  11.526 -17.152  -8.034
    5    HG   LEU   4           HG       LEU   4  13.457 -19.061  -9.392
    6   HD13  LEU   4          HD11      LEU   4  12.168 -18.890 -11.309
    7   HD12  LEU   4          HD12      LEU   4  11.490 -17.329 -10.850
    8   HD11  LEU   4          HD13      LEU   4  10.902 -18.806 -10.087
    9   HD23  LEU   4          HD21      LEU   4  13.847 -16.827 -10.749
   10   HD22  LEU   4          HD22      LEU   4  14.694 -17.084  -9.224
   11   HD21  LEU   4          HD23      LEU   4  13.263 -16.057  -9.273

  No H/Q in entry =          11
  In of MODEL   24
    1    H    GLU   5           H        GLU   5  12.224 -19.718  -5.452
    2    HA   GLU   5           HA       GLU   5  10.572 -18.106  -3.762
    3    HB2  GLU   5           HB2      GLU   5  10.130 -20.494  -4.296
    4    HB3  GLU   5           HB3      GLU   5  11.520 -20.933  -3.300
    5    HG2  GLU   5           HG2      GLU   5   9.580 -21.118  -1.896
    6    HG3  GLU   5           HG3      GLU   5  10.436 -19.657  -1.403

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLU   6           H        GLU   6  13.682 -19.751  -3.299
    2    HA   GLU   6           HA       GLU   6  14.040 -18.894  -0.602
    3    HB2  GLU   6           HB2      GLU   6  15.232 -20.837  -1.567
    4    HB3  GLU   6           HB3      GLU   6  16.112 -19.747  -2.641
    5    HG2  GLU   6           HG2      GLU   6  17.087 -18.592  -0.715
    6    HG3  GLU   6           HG3      GLU   6  16.163 -19.612   0.388

  No H/Q in entry =           6
  In of MODEL   24
    1    H    VAL   7           H        VAL   7  14.848 -17.593  -3.752
    2    HA   VAL   7           HA       VAL   7  16.574 -15.500  -2.885
    3    HB   VAL   7           HB       VAL   7  14.873 -15.835  -5.369
    4   HG11  VAL   7          HG11      VAL   7  16.808 -13.660  -4.555
    5   HG13  VAL   7          HG12      VAL   7  15.172 -13.485  -5.186
    6   HG12  VAL   7          HG13      VAL   7  16.476 -14.018  -6.249
    7   HG21  VAL   7          HG21      VAL   7  16.946 -17.334  -4.786
    8   HG23  VAL   7          HG22      VAL   7  17.884 -15.893  -5.184
    9   HG22  VAL   7          HG23      VAL   7  16.838 -16.625  -6.398

  No H/Q in entry =           9
  In of MODEL   24
    1    H    VAL   8           H        VAL   8  13.079 -15.699  -3.458
    2    HA   VAL   8           HA       VAL   8  12.468 -12.976  -2.998
    3    HB   VAL   8           HB       VAL   8  10.799 -15.467  -2.557
    4   HG12  VAL   8          HG11      VAL   8   8.887 -13.777  -2.707
    5   HG11  VAL   8          HG12      VAL   8  10.099 -12.522  -2.450
    6   HG13  VAL   8          HG13      VAL   8   9.823 -13.747  -1.213
    7   HG23  VAL   8          HG21      VAL   8  10.194 -13.567  -4.766
    8   HG22  VAL   8          HG22      VAL   8  10.220 -15.328  -4.773
    9   HG21  VAL   8          HG23      VAL   8  11.724 -14.426  -4.936

  No H/Q in entry =           9
  In of MODEL   24
    1    H    MET   9           H        MET   9  12.666 -15.780  -0.808
    2    HA   MET   9           HA       MET   9  11.866 -14.485   1.554
    3    HB2  MET   9           HB2      MET   9  13.704 -16.811   1.013
    4    HB3  MET   9           HB3      MET   9  13.461 -16.207   2.652
    5    HG2  MET   9           HG2      MET   9  10.931 -16.397   2.135
    6    HG3  MET   9           HG3      MET   9  11.428 -17.408   0.777
    7    HE3  MET   9           HE1      MET   9  13.105 -20.441   2.254
    8    HE2  MET   9           HE2      MET   9  13.888 -18.987   1.640
    9    HE1  MET   9           HE3      MET   9  12.447 -19.606   0.840

  No H/Q in entry =           9
  In of MODEL   24
    1    H    GLY  10           H        GLY  10  15.049 -14.778   0.014
    2    HA3  GLY  10           HA2      GLY  10  16.527 -13.381   1.987
    3    HA2  GLY  10           HA3      GLY  10  16.995 -13.561   0.296

  No H/Q in entry =           3
  In of MODEL   24
    1    H    LEU  11           H        LEU  11  14.857 -12.300  -0.957
    2    HA   LEU  11           HA       LEU  11  15.596  -9.569  -0.799
    3    HB2  LEU  11           HB2      LEU  11  13.206 -10.935  -2.041
    4    HB3  LEU  11           HB3      LEU  11  13.522  -9.207  -2.205
    5    HG   LEU  11           HG       LEU  11  15.511 -11.358  -2.976
    6   HD13  LEU  11          HD11      LEU  11  13.766 -11.695  -4.504
    7   HD12  LEU  11          HD12      LEU  11  14.796 -10.536  -5.343
    8   HD11  LEU  11          HD13      LEU  11  13.329  -9.986  -4.533
    9   HD22  LEU  11          HD21      LEU  11  16.780  -9.418  -2.750
   10   HD21  LEU  11          HD22      LEU  11  15.427  -8.356  -3.139
   11   HD23  LEU  11          HD23      LEU  11  16.248  -9.244  -4.421

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  12           H        ILE  12  12.786 -11.337   0.460
    2    HA   ILE  12           HA       ILE  12  11.430  -9.083   1.506
    3    HB   ILE  12           HB       ILE  12  11.407 -11.961   2.469
    4   HG12  ILE  12          HG12      ILE  12  10.753 -11.337   0.012
    5   HG13  ILE  12          HG13      ILE  12   9.694 -12.394   0.923
    6   HG21  ILE  12          HG21      ILE  12   9.520  -9.644   3.005
    7   HG23  ILE  12          HG22      ILE  12  10.465 -10.541   4.192
    8   HG22  ILE  12          HG23      ILE  12   9.127 -11.327   3.354
    9   HD11  ILE  12          HD11      ILE  12   9.332  -9.396   0.701
   10   HD13  ILE  12          HD12      ILE  12   8.195 -10.557   1.385
   11   HD12  ILE  12          HD13      ILE  12   8.524 -10.560  -0.334

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  13           H        ILE  13  13.774 -11.329   2.931
    2    HA   ILE  13           HA       ILE  13  13.819 -10.142   5.508
    3    HB   ILE  13           HB       ILE  13  15.858 -11.756   3.957
    4   HG12  ILE  13          HG12      ILE  13  13.554 -12.673   4.795
    5   HG13  ILE  13          HG13      ILE  13  15.010 -13.629   5.056
    6   HG23  ILE  13          HG21      ILE  13  17.207 -10.587   5.509
    7   HG22  ILE  13          HG22      ILE  13  16.880 -12.120   6.306
    8   HG21  ILE  13          HG23      ILE  13  15.989 -10.673   6.780
    9   HD12  ILE  13          HD11      ILE  13  13.493 -13.427   7.094
   10   HD11  ILE  13          HD12      ILE  13  13.890 -11.713   7.116
   11   HD13  ILE  13          HD13      ILE  13  15.157 -12.909   7.355

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ASN  14           H        ASN  14  15.796  -9.656   2.598
    2    HA   ASN  14           HA       ASN  14  17.570  -7.743   3.662
    3    HB2  ASN  14           HB2      ASN  14  17.536  -9.016   1.350
    4    HB3  ASN  14           HB3      ASN  14  16.672  -7.585   0.805
    5   HD21  ASN  14          HD21      ASN  14  19.112  -7.971  -0.368
    6   HD22  ASN  14          HD22      ASN  14  20.271  -6.906   0.262

  No H/Q in entry =           6
  In of MODEL   24
    1    H    SER  15           H        SER  15  14.474  -7.346   1.953
    2    HA   SER  15           HA       SER  15  14.411  -4.524   2.000
    3    HB2  SER  15           HB2      SER  15  12.082  -4.731   1.488
    4    HB3  SER  15           HB3      SER  15  12.854  -6.120   0.734
    5    HG   SER  15           HG       SER  15  11.279  -5.979   3.055

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLY  16           H        GLY  16  13.264  -6.957   4.306
    2    HA3  GLY  16           HA2      GLY  16  12.063  -5.182   6.151
    3    HA2  GLY  16           HA3      GLY  16  12.648  -6.800   6.521

  No H/Q in entry =           3
  In of MODEL   24
    1    H    GLN  17           H        GLN  17  15.368  -6.515   5.942
    2    HA   GLN  17           HA       GLN  17  16.333  -5.303   8.324
    3    HB2  GLN  17           HB2      GLN  17  17.567  -7.105   7.207
    4    HB3  GLN  17           HB3      GLN  17  17.830  -6.073   5.800
    5    HG2  GLN  17           HG2      GLN  17  19.124  -4.501   7.152
    6    HG3  GLN  17           HG3      GLN  17  18.804  -5.450   8.602
    7   HE21  GLN  17          HE21      GLN  17  21.483  -4.965   7.711
    8   HE22  GLN  17          HE22      GLN  17  22.149  -6.441   7.201

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ALA  18           H        ALA  18  16.180  -4.232   4.960
    2    HA   ALA  18           HA       ALA  18  17.654  -1.864   5.187
    3    HB1  ALA  18           HB1      ALA  18  16.527  -3.066   3.118
    4    HB3  ALA  18           HB2      ALA  18  16.821  -1.327   3.098
    5    HB2  ALA  18           HB3      ALA  18  15.209  -1.945   3.461

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ARG  19           H        ARG  19  14.143  -2.392   5.567
    2    HA   ARG  19           HA       ARG  19  13.515   0.271   6.271
    3    HB2  ARG  19           HB2      ARG  19  11.809  -1.454   5.680
    4    HB3  ARG  19           HB3      ARG  19  12.129  -2.253   7.221
    5    HG2  ARG  19           HG2      ARG  19  11.445  -0.246   8.451
    6    HG3  ARG  19           HG3      ARG  19  11.218   0.630   6.938
    7    HD2  ARG  19           HD2      ARG  19   9.059  -0.129   7.749
    8    HD3  ARG  19           HD3      ARG  19   9.471  -1.019   6.278
    9    HE   ARG  19           HE       ARG  19  10.393  -2.571   8.393
   10   HH21  ARG  19          HH11      ARG  19   9.111  -4.187   9.330
   11   HH22  ARG  19          HH12      ARG  19   7.393  -4.132   9.150
   12   HH11  ARG  19          HH21      ARG  19   7.426  -1.232   7.278
   13   HH12  ARG  19          HH22      ARG  19   6.439  -2.459   7.984

  No H/Q in entry =          13
  In of MODEL   24
    1    H    SER  20           H        SER  20  14.316  -2.567   8.243
    2    HA   SER  20           HA       SER  20  14.037  -1.455  10.775
    3    HB2  SER  20           HB2      SER  20  14.465  -3.787  10.662
    4    HB3  SER  20           HB3      SER  20  15.927  -3.551   9.708
    5    HG   SER  20           HG       SER  20  16.481  -2.211  11.755

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU  21           H        LEU  21  16.892  -1.447   8.655
    2    HA   LEU  21           HA       LEU  21  18.582   0.016  10.398
    3    HB2  LEU  21           HB2      LEU  21  18.574  -0.258   7.383
    4    HB3  LEU  21           HB3      LEU  21  19.840   0.575   8.282
    5    HG   LEU  21           HG       LEU  21  19.035  -2.302   8.810
    6   HD12  LEU  21          HD11      LEU  21  21.199  -2.822   7.599
    7   HD11  LEU  21          HD12      LEU  21  21.215  -1.146   7.050
    8   HD13  LEU  21          HD13      LEU  21  19.902  -2.218   6.565
    9   HD23  LEU  21          HD21      LEU  21  21.509  -2.198   9.732
   10   HD22  LEU  21          HD22      LEU  21  20.205  -1.572  10.733
   11   HD21  LEU  21          HD23      LEU  21  21.216  -0.464   9.821

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ALA  22           H        ALA  22  16.348   1.015   7.826
    2    HA   ALA  22           HA       ALA  22  16.933   3.764   7.835
    3    HB3  ALA  22           HB1      ALA  22  15.519   2.540   6.153
    4    HB2  ALA  22           HB2      ALA  22  14.834   4.066   6.711
    5    HB1  ALA  22           HB3      ALA  22  14.215   2.539   7.340

  No H/Q in entry =           5
  In of MODEL   24
    1    H    TYR  23           H        TYR  23  14.396   1.995   9.661
    2    HA   TYR  23           HA       TYR  23  13.463   4.253  11.099
    3    HB2  TYR  23           HB2      TYR  23  12.191   2.162  11.079
    4    HB3  TYR  23           HB3      TYR  23  13.505   1.329  11.908
    5    HD1  TYR  23           HD1      TYR  23  11.023   4.090  12.261
    6    HD2  TYR  23           HD2      TYR  23  13.720   1.417  14.267
    7    HE1  TYR  23           HE1      TYR  23  10.101   4.802  14.451
    8    HE2  TYR  23           HE2      TYR  23  12.797   2.128  16.456
    9    HH   TYR  23           HH       TYR  23   9.922   3.802  16.781

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ALA  24           H        ALA  24  16.066   1.935  11.757
    2    HA   ALA  24           HA       ALA  24  16.738   2.926  14.322
    3    HB1  ALA  24           HB1      ALA  24  18.065   1.110  14.170
    4    HB3  ALA  24           HB2      ALA  24  19.114   2.010  13.074
    5    HB2  ALA  24           HB3      ALA  24  17.806   1.022  12.428

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA  25           H        ALA  25  17.729   3.829  11.046
    2    HA   ALA  25           HA       ALA  25  19.704   5.732  11.696
    3    HB1  ALA  25           HB1      ALA  25  18.984   4.789   9.380
    4    HB3  ALA  25           HB2      ALA  25  19.514   6.468   9.471
    5    HB2  ALA  25           HB3      ALA  25  17.793   6.090   9.393

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU  26           H        LEU  26  16.196   6.020  11.315
    2    HA   LEU  26           HA       LEU  26  16.018   8.807  11.756
    3    HB2  LEU  26           HB2      LEU  26  14.140   7.601  10.822
    4    HB3  LEU  26           HB3      LEU  26  14.023   6.580  12.249
    5    HG   LEU  26           HG       LEU  26  13.444   8.552  13.620
    6   HD12  LEU  26          HD11      LEU  26  12.827  10.660  12.285
    7   HD11  LEU  26          HD12      LEU  26  13.804   9.986  10.983
    8   HD13  LEU  26          HD13      LEU  26  14.547  10.362  12.539
    9   HD21  LEU  26          HD21      LEU  26  11.777   8.260  11.102
   10   HD23  LEU  26          HD22      LEU  26  11.221   8.973  12.614
   11   HD22  LEU  26          HD23      LEU  26  11.643   7.263  12.551

  No H/Q in entry =          11
  In of MODEL   24
    1    H    LYS  27           H        LYS  27  15.848   6.036  13.957
    2    HA   LYS  27           HA       LYS  27  15.267   7.420  16.318
    3    HB2  LYS  27           HB2      LYS  27  15.252   4.943  16.060
    4    HB3  LYS  27           HB3      LYS  27  17.016   4.964  16.026
    5    HG2  LYS  27           HG2      LYS  27  17.071   5.955  18.273
    6    HG3  LYS  27           HG3      LYS  27  15.305   6.006  18.309
    7    HD2  LYS  27           HD2      LYS  27  15.236   3.539  18.079
    8    HD3  LYS  27           HD3      LYS  27  17.001   3.497  18.077
    9    HE2  LYS  27           HE2      LYS  27  17.040   4.491  20.331
   10    HE3  LYS  27           HE3      LYS  27  15.275   4.564  20.336
   11    HZ3  LYS  27           HZ1      LYS  27  16.021   2.601  21.497
   12    HZ2  LYS  27           HZ2      LYS  27  16.936   2.101  20.152
   13    HZ1  LYS  27           HZ3      LYS  27  15.239   2.137  20.063

  No H/Q in entry =          13
  In of MODEL   24
    1    H    GLN  28           H        GLN  28  18.381   6.776  14.745
    2    HA   GLN  28           HA       GLN  28  20.073   7.834  16.742
    3    HB2  GLN  28           HB2      GLN  28  20.378   7.777  13.728
    4    HB3  GLN  28           HB3      GLN  28  21.667   8.223  14.847
    5    HG2  GLN  28           HG2      GLN  28  20.194   5.573  14.868
    6    HG3  GLN  28           HG3      GLN  28  21.795   5.832  14.178
    7   HE21  GLN  28          HE21      GLN  28  20.431   4.554  16.863
    8   HE22  GLN  28          HE22      GLN  28  21.612   4.944  18.016

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ALA  29           H        ALA  29  18.365   9.341  14.035
    2    HA   ALA  29           HA       ALA  29  19.412  11.943  14.287
    3    HB2  ALA  29           HB1      ALA  29  17.734  12.608  12.804
    4    HB1  ALA  29           HB2      ALA  29  16.564  11.458  13.452
    5    HB3  ALA  29           HB3      ALA  29  17.889  10.888  12.438

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LYS  30           H        LYS  30  16.597  10.402  15.797
    2    HA   LYS  30           HA       LYS  30  15.618  12.678  17.142
    3    HB2  LYS  30           HB2      LYS  30  15.446   9.742  17.853
    4    HB3  LYS  30           HB3      LYS  30  14.599  11.011  18.738
    5    HG2  LYS  30           HG2      LYS  30  13.500  11.713  16.612
    6    HG3  LYS  30           HG3      LYS  30  14.283  10.359  15.793
    7    HD2  LYS  30           HD2      LYS  30  13.171   8.777  17.320
    8    HD3  LYS  30           HD3      LYS  30  12.398  10.120  18.163
    9    HE2  LYS  30           HE2      LYS  30  11.254  10.770  16.062
   10    HE3  LYS  30           HE3      LYS  30  12.007   9.398  15.239
   11    HZ2  LYS  30           HZ1      LYS  30   9.686   9.037  16.108
   12    HZ1  LYS  30           HZ2      LYS  30  10.346   9.081  17.678
   13    HZ3  LYS  30           HZ3      LYS  30  10.837   7.883  16.574

  No H/Q in entry =          13
  In of MODEL   24
    1    H    GLN  31           H        GLN  31  18.232  10.459  17.899
    2    HA   GLN  31           HA       GLN  31  18.564  11.474  20.593
    3    HB2  GLN  31           HB2      GLN  31  20.565   9.859  19.004
    4    HB3  GLN  31           HB3      GLN  31  20.423   9.991  20.757
    5    HG2  GLN  31           HG2      GLN  31  17.896   9.087  19.977
    6    HG3  GLN  31           HG3      GLN  31  18.986   8.218  18.905
    7   HE21  GLN  31          HE21      GLN  31  17.409   7.109  21.176
    8   HE22  GLN  31          HE22      GLN  31  18.545   6.428  22.235

  No H/Q in entry =           8
  In of MODEL   24
    1    H    GLY  32           H        GLY  32  19.126  12.773  17.626
    2    HA3  GLY  32           HA2      GLY  32  20.153  14.797  17.112
    3    HA2  GLY  32           HA3      GLY  32  20.902  14.791  18.704

  No H/Q in entry =           3
  In of MODEL   24
    1    H    ASP  33           H        ASP  33  21.277  11.886  16.937
    2    HA   ASP  33           HA       ASP  33  24.117  12.504  16.484
    3    HB2  ASP  33           HB2      ASP  33  22.557   9.918  16.599
    4    HB3  ASP  33           HB3      ASP  33  24.248  10.000  16.114

  No H/Q in entry =           4
  In of MODEL   24
    1    H    PHE  34           H        PHE  34  23.672  13.831  14.597
    2    HA   PHE  34           HA       PHE  34  22.317  12.867  12.305
    3    HB2  PHE  34           HB2      PHE  34  24.488  14.959  12.541
    4    HB3  PHE  34           HB3      PHE  34  23.505  14.685  11.104
    5    HD1  PHE  34           HD1      PHE  34  23.778  16.621  14.014
    6    HD2  PHE  34           HD2      PHE  34  20.873  14.556  11.618
    7    HE1  PHE  34           HE1      PHE  34  21.984  18.057  14.947
    8    HE2  PHE  34           HE2      PHE  34  19.083  15.991  12.554
    9    HZ   PHE  34           HZ       PHE  34  19.642  17.742  14.215

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ALA  35           H        ALA  35  25.681  12.616  13.332
    2    HA   ALA  35           HA       ALA  35  26.784  11.767  10.883
    3    HB3  ALA  35           HB1      ALA  35  28.432  10.570  12.615
    4    HB2  ALA  35           HB2      ALA  35  27.582  11.615  13.754
    5    HB1  ALA  35           HB3      ALA  35  28.440  12.318  12.384

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA  36           H        ALA  36  25.616   9.841  13.648
    2    HA   ALA  36           HA       ALA  36  26.059   7.341  12.382
    3    HB2  ALA  36           HB1      ALA  36  25.602   6.609  14.457
    4    HB3  ALA  36           HB2      ALA  36  23.925   7.135  14.296
    5    HB1  ALA  36           HB3      ALA  36  25.144   8.245  14.922

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA  37           H        ALA  37  23.278   9.520  12.494
    2    HA   ALA  37           HA       ALA  37  21.395   7.783  11.313
    3    HB3  ALA  37           HB1      ALA  37  21.675  10.742  11.598
    4    HB1  ALA  37           HB2      ALA  37  20.340   9.690  12.066
    5    HB2  ALA  37           HB3      ALA  37  20.547  10.153  10.377

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LYS  38           H        LYS  38  23.548  10.200   9.839
    2    HA   LYS  38           HA       LYS  38  22.915   9.777   7.159
    3    HB2  LYS  38           HB2      LYS  38  24.746  11.304   8.610
    4    HB3  LYS  38           HB3      LYS  38  25.766  10.293   7.593
    5    HG2  LYS  38           HG2      LYS  38  24.627  11.079   5.588
    6    HG3  LYS  38           HG3      LYS  38  23.443  11.959   6.560
    7    HD2  LYS  38           HD2      LYS  38  25.063  13.530   7.317
    8    HD3  LYS  38           HD3      LYS  38  26.407  12.517   6.792
    9    HE2  LYS  38           HE2      LYS  38  26.093  14.390   5.233
   10    HE3  LYS  38           HE3      LYS  38  25.735  12.857   4.431
   11    HZ3  LYS  38           HZ1      LYS  38  23.547  13.341   4.288
   12    HZ2  LYS  38           HZ2      LYS  38  24.099  14.947   4.374
   13    HZ1  LYS  38           HZ3      LYS  38  23.503  14.177   5.765

  No H/Q in entry =          13
  In of MODEL   24
    1    H    ALA  39           H        ALA  39  25.389   8.139   9.133
    2    HA   ALA  39           HA       ALA  39  26.440   6.526   7.074
    3    HB2  ALA  39           HB1      ALA  39  26.319   5.572   9.920
    4    HB1  ALA  39           HB2      ALA  39  27.299   6.979   9.505
    5    HB3  ALA  39           HB3      ALA  39  27.627   5.420   8.748

  No H/Q in entry =           5
  In of MODEL   24
    1    H    MET  40           H        MET  40  23.804   5.963   9.360
    2    HA   MET  40           HA       MET  40  23.317   3.265   8.630
    3    HB2  MET  40           HB2      MET  40  21.530   5.344   9.907
    4    HB3  MET  40           HB3      MET  40  21.094   3.642   9.735
    5    HG2  MET  40           HG2      MET  40  23.653   4.541  11.087
    6    HG3  MET  40           HG3      MET  40  22.149   4.295  11.973
    7    HE3  MET  40           HE1      MET  40  21.520   0.672  12.155
    8    HE2  MET  40           HE2      MET  40  20.679   1.988  11.339
    9    HE1  MET  40           HE3      MET  40  21.416   2.267  12.915

  No H/Q in entry =           9
  In of MODEL   24
    1    H    MET  41           H        MET  41  21.964   6.339   7.427
    2    HA   MET  41           HA       MET  41  19.995   5.174   5.747
    3    HB2  MET  41           HB2      MET  41  21.524   7.736   5.235
    4    HB3  MET  41           HB3      MET  41  19.992   7.268   4.510
    5    HG2  MET  41           HG2      MET  41  19.229   7.100   7.058
    6    HG3  MET  41           HG3      MET  41  20.557   8.235   7.283
    7    HE2  MET  41           HE1      MET  41  20.035   9.523   3.940
    8    HE1  MET  41           HE2      MET  41  20.991   9.949   5.356
    9    HE3  MET  41           HE3      MET  41  19.741  11.049   4.782

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ASP  42           H        ASP  42  23.386   6.036   5.210
    2    HA   ASP  42           HA       ASP  42  23.485   5.553   2.454
    3    HB2  ASP  42           HB2      ASP  42  25.243   6.525   4.231
    4    HB3  ASP  42           HB3      ASP  42  25.873   4.888   4.111

  No H/Q in entry =           4
  In of MODEL   24
    1    H    GLN  43           H        GLN  43  24.157   3.394   5.185
    2    HA   GLN  43           HA       GLN  43  24.790   1.120   3.612
    3    HB2  GLN  43           HB2      GLN  43  23.755   1.329   6.449
    4    HB3  GLN  43           HB3      GLN  43  24.312  -0.171   5.701
    5    HG2  GLN  43           HG2      GLN  43  26.499   1.000   5.199
    6    HG3  GLN  43           HG3      GLN  43  25.934   2.340   6.192
    7   HE21  GLN  43          HE21      GLN  43  28.144   1.331   7.243
    8   HE22  GLN  43          HE22      GLN  43  27.844   0.257   8.521

  No H/Q in entry =           8
  In of MODEL   24
    1    H    SER  44           H        SER  44  21.747   2.311   4.977
    2    HA   SER  44           HA       SER  44  20.143   0.093   4.302
    3    HB2  SER  44           HB2      SER  44  19.739   2.633   5.439
    4    HB3  SER  44           HB3      SER  44  18.712   2.604   4.008
    5    HG   SER  44           HG       SER  44  17.593   1.684   5.727

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ARG  45           H        ARG  45  20.947   3.040   2.493
    2    HA   ARG  45           HA       ARG  45  19.426   2.574   0.182
    3    HB2  ARG  45           HB2      ARG  45  20.604   4.692   0.766
    4    HB3  ARG  45           HB3      ARG  45  22.137   3.909   0.391
    5    HG2  ARG  45           HG2      ARG  45  21.359   3.511  -1.926
    6    HG3  ARG  45           HG3      ARG  45  19.838   4.316  -1.550
    7    HD2  ARG  45           HD2      ARG  45  21.122   6.392  -0.965
    8    HD3  ARG  45           HD3      ARG  45  22.608   5.591  -1.523
    9    HE   ARG  45           HE       ARG  45  20.684   5.381  -3.569
   10   HH21  ARG  45          HH11      ARG  45  20.711   6.745  -5.336
   11   HH22  ARG  45          HH12      ARG  45  21.494   8.282  -5.232
   12   HH11  ARG  45          HH21      ARG  45  22.450   7.853  -1.940
   13   HH12  ARG  45          HH22      ARG  45  22.478   8.909  -3.306

  No H/Q in entry =          13
  In of MODEL   24
    1    H    MET  46           H        MET  46  22.770   1.642   0.949
    2    HA   MET  46           HA       MET  46  23.367   0.431  -1.528
    3    HB2  MET  46           HB2      MET  46  24.453   0.094   1.267
    4    HB3  MET  46           HB3      MET  46  25.101  -0.816  -0.102
    5    HG2  MET  46           HG2      MET  46  25.591   1.276  -1.290
    6    HG3  MET  46           HG3      MET  46  24.891   2.209   0.027
    7    HE3  MET  46           HE1      MET  46  27.555  -1.034   0.369
    8    HE2  MET  46           HE2      MET  46  28.813   0.007  -0.290
    9    HE1  MET  46           HE3      MET  46  27.317  -0.234  -1.191

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ALA  47           H        ALA  47  21.945  -0.868   1.444
    2    HA   ALA  47           HA       ALA  47  21.846  -3.582   0.649
    3    HB2  ALA  47           HB1      ALA  47  21.464  -3.107   2.950
    4    HB3  ALA  47           HB2      ALA  47  19.920  -3.684   2.325
    5    HB1  ALA  47           HB3      ALA  47  20.180  -1.957   2.580

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU  48           H        LEU  48  19.544  -0.913   0.273
    2    HA   LEU  48           HA       LEU  48  17.477  -2.412  -0.983
    3    HB2  LEU  48           HB2      LEU  48  18.186   0.529  -1.103
    4    HB3  LEU  48           HB3      LEU  48  16.706  -0.156  -1.775
    5    HG   LEU  48           HG       LEU  48  17.540  -0.464   1.119
    6   HD13  LEU  48          HD11      LEU  48  17.166   1.843   0.923
    7   HD12  LEU  48          HD12      LEU  48  15.593   1.226   1.427
    8   HD11  LEU  48          HD13      LEU  48  15.880   1.638  -0.264
    9   HD22  LEU  48          HD21      LEU  48  15.981  -2.151   0.736
   10   HD21  LEU  48          HD22      LEU  48  15.130  -1.236  -0.509
   11   HD23  LEU  48          HD23      LEU  48  14.918  -0.822   1.192

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ASN  49           H        ASN  49  20.206  -0.538  -2.207
    2    HA   ASN  49           HA       ASN  49  19.566  -0.618  -4.934
    3    HB2  ASN  49           HB2      ASN  49  21.276   0.861  -3.976
    4    HB3  ASN  49           HB3      ASN  49  22.283  -0.528  -3.591
    5   HD21  ASN  49          HD21      ASN  49  23.993   0.287  -4.993
    6   HD22  ASN  49          HD22      ASN  49  23.853   0.209  -6.682

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLU  50           H        GLU  50  21.499  -2.844  -2.956
    2    HA   GLU  50           HA       GLU  50  22.176  -4.619  -5.073
    3    HB2  GLU  50           HB2      GLU  50  23.365  -4.610  -2.902
    4    HB3  GLU  50           HB3      GLU  50  21.908  -5.208  -2.110
    5    HG2  GLU  50           HG2      GLU  50  21.964  -7.246  -3.462
    6    HG3  GLU  50           HG3      GLU  50  23.355  -6.643  -4.359

  No H/Q in entry =           6
  In of MODEL   24
    1    H    ALA  51           H        ALA  51  19.512  -4.496  -2.758
    2    HA   ALA  51           HA       ALA  51  18.302  -6.949  -3.512
    3    HB3  ALA  51           HB1      ALA  51  16.713  -6.407  -1.966
    4    HB1  ALA  51           HB2      ALA  51  16.534  -4.759  -2.571
    5    HB2  ALA  51           HB3      ALA  51  17.881  -5.168  -1.507

  No H/Q in entry =           5
  In of MODEL   24
    1    H    HIS  52           H        HIS  52  17.784  -3.594  -4.561
    2    HA   HIS  52           HA       HIS  52  15.669  -4.086  -6.368
    3    HB2  HIS  52           HB2      HIS  52  16.362  -1.831  -5.570
    4    HB3  HIS  52           HB3      HIS  52  17.814  -1.958  -6.561
    5    HD1  HIS  52           HD1      HIS  52  17.492  -1.953  -9.168
    6    HD2  HIS  52           HD2      HIS  52  13.991  -1.281  -7.008
    7    HE1  HIS  52           HE1      HIS  52  15.784  -1.083 -10.823
    8    HE2  HIS  52           HE2      HIS  52  13.644  -0.668  -9.523

  No H/Q in entry =           8
  In of MODEL   24
    1    H    LEU  53           H        LEU  53  19.188  -4.160  -6.786
    2    HA   LEU  53           HA       LEU  53  19.251  -4.487  -9.585
    3    HB2  LEU  53           HB2      LEU  53  21.160  -5.277  -7.400
    4    HB3  LEU  53           HB3      LEU  53  21.476  -5.675  -9.087
    5    HG   LEU  53           HG       LEU  53  20.861  -2.851  -8.160
    6   HD12  LEU  53          HD11      LEU  53  23.575  -4.109  -8.660
    7   HD11  LEU  53          HD12      LEU  53  22.919  -3.742  -7.066
    8   HD13  LEU  53          HD13      LEU  53  23.264  -2.439  -8.196
    9   HD22  LEU  53          HD21      LEU  53  20.589  -2.898 -10.501
   10   HD21  LEU  53          HD22      LEU  53  21.838  -4.121 -10.713
   11   HD23  LEU  53          HD23      LEU  53  22.288  -2.465 -10.355

  No H/Q in entry =          11
  In of MODEL   24
    1    H    VAL  54           H        VAL  54  19.083  -6.861  -6.951
    2    HA   VAL  54           HA       VAL  54  19.170  -9.164  -8.602
    3    HB   VAL  54           HB       VAL  54  18.012  -8.708  -5.841
    4   HG12  VAL  54          HG11      VAL  54  18.288 -11.332  -5.826
    5   HG11  VAL  54          HG12      VAL  54  18.113 -11.166  -7.573
    6   HG13  VAL  54          HG13      VAL  54  16.830 -10.608  -6.502
    7   HG22  VAL  54          HG21      VAL  54  20.331  -8.540  -5.609
    8   HG21  VAL  54          HG22      VAL  54  20.653  -9.643  -6.945
    9   HG23  VAL  54          HG23      VAL  54  20.105 -10.274  -5.393

  No H/Q in entry =           9
  In of MODEL   24
    1    H    GLN  55           H        GLN  55  16.472  -7.206  -7.337
    2    HA   GLN  55           HA       GLN  55  14.425  -8.837  -8.414
    3    HB2  GLN  55           HB2      GLN  55  13.699  -7.291  -6.795
    4    HB3  GLN  55           HB3      GLN  55  14.520  -5.941  -7.573
    5    HG2  GLN  55           HG2      GLN  55  12.807  -5.590  -9.071
    6    HG3  GLN  55           HG3      GLN  55  12.455  -7.305  -9.236
    7   HE21  GLN  55          HE21      GLN  55  10.435  -7.815  -8.437
    8   HE22  GLN  55          HE22      GLN  55   9.670  -7.042  -7.135

  No H/Q in entry =           8
  In of MODEL   24
    1    H    THR  56           H        THR  56  16.221  -6.074  -9.776
    2    HA   THR  56           HA       THR  56  14.799  -5.695 -12.132
    3    HB   THR  56           HB       THR  56  17.800  -5.589 -11.734
    4    HG1  THR  56           HG1      THR  56  15.659  -3.855 -11.287
    5   HG22  THR  56          HG21      THR  56  17.634  -3.980 -13.697
    6   HG21  THR  56          HG22      THR  56  16.002  -4.595 -13.950
    7   HG23  THR  56          HG23      THR  56  17.384  -5.683 -14.088

  No H/Q in entry =           7
  In of MODEL   24
    1    H    LYS  57           H        LYS  57  17.404  -8.037 -11.501
    2    HA   LYS  57           HA       LYS  57  17.394  -9.241 -14.075
    3    HB2  LYS  57           HB2      LYS  57  19.173  -9.519 -12.321
    4    HB3  LYS  57           HB3      LYS  57  18.046 -10.491 -11.385
    5    HG2  LYS  57           HG2      LYS  57  17.924 -12.144 -13.181
    6    HG3  LYS  57           HG3      LYS  57  18.978 -11.162 -14.192
    7    HD2  LYS  57           HD2      LYS  57  20.794 -11.402 -12.526
    8    HD3  LYS  57           HD3      LYS  57  19.745 -12.412 -11.532
    9    HE2  LYS  57           HE2      LYS  57  19.578 -14.064 -13.356
   10    HE3  LYS  57           HE3      LYS  57  20.597 -13.059 -14.384
   11    HZ2  LYS  57           HZ1      LYS  57  21.379 -14.310 -11.812
   12    HZ1  LYS  57           HZ2      LYS  57  22.358 -13.255 -12.713
   13    HZ3  LYS  57           HZ3      LYS  57  21.910 -14.761 -13.358

  No H/Q in entry =          13
  In of MODEL   24
    1    H    LEU  58           H        LEU  58  15.590  -9.865 -11.104
    2    HA   LEU  58           HA       LEU  58  14.330 -12.221 -12.034
    3    HB2  LEU  58           HB2      LEU  58  13.561 -10.293  -9.849
    4    HB3  LEU  58           HB3      LEU  58  12.728 -11.817 -10.163
    5    HG   LEU  58           HG       LEU  58  15.703 -11.589  -9.597
    6   HD11  LEU  58          HD11      LEU  58  13.319 -11.958  -7.812
    7   HD13  LEU  58          HD12      LEU  58  14.788 -11.019  -7.548
    8   HD12  LEU  58          HD13      LEU  58  14.829 -12.776  -7.406
    9   HD22  LEU  58          HD21      LEU  58  15.554 -13.653 -10.617
   10   HD21  LEU  58          HD22      LEU  58  13.835 -13.831 -10.263
   11   HD23  LEU  58          HD23      LEU  58  15.033 -14.148  -9.008

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  59           H        ILE  59  13.720  -8.875 -12.732
    2    HA   ILE  59           HA       ILE  59  10.997  -9.479 -13.680
    3    HB   ILE  59           HB       ILE  59  11.839  -7.206 -12.481
    4   HG12  ILE  59          HG12      ILE  59   9.941  -7.061 -14.835
    5   HG13  ILE  59          HG13      ILE  59   9.505  -7.817 -13.323
    6   HG23  ILE  59          HG21      ILE  59  12.438  -5.498 -14.000
    7   HG22  ILE  59          HG22      ILE  59  11.944  -6.428 -15.396
    8   HG21  ILE  59          HG23      ILE  59  13.413  -6.850 -14.522
    9   HD11  ILE  59          HD11      ILE  59  10.467  -4.970 -13.602
   10   HD13  ILE  59          HD12      ILE  59   9.945  -5.738 -12.105
   11   HD12  ILE  59          HD13      ILE  59   8.781  -5.448 -13.397

  No H/Q in entry =          11
  In of MODEL   24
    1    H    GLU  60           H        GLU  60  14.221  -8.689 -14.930
    2    HA   GLU  60           HA       GLU  60  13.458  -8.286 -17.643
    3    HB2  GLU  60           HB2      GLU  60  15.646  -7.584 -16.791
    4    HB3  GLU  60           HB3      GLU  60  16.078  -9.261 -16.470
    5    HG2  GLU  60           HG2      GLU  60  15.886  -9.777 -18.880
    6    HG3  GLU  60           HG3      GLU  60  15.458  -8.098 -19.203

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLY  61           H        GLY  61  14.378 -11.177 -15.812
    2    HA3  GLY  61           HA2      GLY  61  13.817 -12.824 -18.209
    3    HA2  GLY  61           HA3      GLY  61  14.836 -13.318 -16.861

  No H/Q in entry =           3
  In of MODEL   24
    1    H    ASP  62           H        ASP  62  11.740 -11.717 -16.511
    2    HA   ASP  62           HA       ASP  62  10.766 -13.600 -14.656
    3    HB2  ASP  62           HB2      ASP  62   8.641 -12.370 -14.878
    4    HB3  ASP  62           HB3      ASP  62  10.015 -11.287 -14.675

  No H/Q in entry =           4
  In of MODEL   24
    1    H    ALA  63           H        ALA  63  10.277 -13.334 -18.175
    2    HA   ALA  63           HA       ALA  63   8.109 -15.114 -18.468
    3    HB3  ALA  63           HB1      ALA  63   9.021 -13.702 -20.293
    4    HB1  ALA  63           HB2      ALA  63   8.882 -15.393 -20.772
    5    HB2  ALA  63           HB3      ALA  63  10.457 -14.725 -20.346

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLY  64           H        GLY  64   8.470 -17.278 -19.705
    2    HA3  GLY  64           HA2      GLY  64   9.992 -19.224 -19.889
    3    HA2  GLY  64           HA3      GLY  64  10.486 -18.870 -18.239

  No H/Q in entry =           3
  In of MODEL   24
    1    H    GLU  65           H        GLU  65   7.858 -18.319 -17.198
    2    HA   GLU  65           HA       GLU  65   7.083 -20.965 -16.557
    3    HB2  GLU  65           HB2      GLU  65   5.695 -18.331 -16.067
    4    HB3  GLU  65           HB3      GLU  65   5.170 -19.872 -15.387
    5    HG2  GLU  65           HG2      GLU  65   6.529 -19.053 -13.681
    6    HG3  GLU  65           HG3      GLU  65   7.663 -20.057 -14.585

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLY  66           H        GLY  66   5.803 -18.599 -18.755
    2    HA3  GLY  66           HA2      GLY  66   4.505 -20.508 -20.404
    3    HA2  GLY  66           HA3      GLY  66   3.333 -19.629 -19.443

  No H/Q in entry =           3
  In of MODEL   24
    1    H    LYS  67           H        LYS  67   2.525 -19.003 -21.554
    2    HA   LYS  67           HA       LYS  67   3.876 -17.559 -23.477
    3    HB2  LYS  67           HB2      LYS  67   0.976 -17.455 -22.658
    4    HB3  LYS  67           HB3      LYS  67   1.614 -16.727 -24.137
    5    HG2  LYS  67           HG2      LYS  67   2.511 -18.917 -24.834
    6    HG3  LYS  67           HG3      LYS  67   1.879 -19.649 -23.363
    7    HD2  LYS  67           HD2      LYS  67  -0.415 -19.062 -24.049
    8    HD3  LYS  67           HD3      LYS  67   0.215 -18.322 -25.522
    9    HE2  LYS  67           HE2      LYS  67   1.166 -20.482 -26.219
   10    HE3  LYS  67           HE3      LYS  67   0.570 -21.231 -24.739
   11    HZ2  LYS  67           HZ1      LYS  67  -0.783 -20.991 -27.113
   12    HZ1  LYS  67           HZ2      LYS  67  -1.497 -19.831 -26.100
   13    HZ3  LYS  67           HZ3      LYS  67  -1.435 -21.461 -25.620

  No H/Q in entry =          13
  In of MODEL   24
    1    H    MET  68           H        MET  68   1.462 -15.929 -21.539
    2    HA   MET  68           HA       MET  68   3.075 -13.470 -21.526
    3    HB2  MET  68           HB2      MET  68   0.110 -13.937 -21.205
    4    HB3  MET  68           HB3      MET  68   0.890 -12.361 -21.064
    5    HG2  MET  68           HG2      MET  68   1.069 -14.149 -23.504
    6    HG3  MET  68           HG3      MET  68  -0.027 -12.776 -23.348
    7    HE3  MET  68           HE1      MET  68   1.884  -9.697 -23.489
    8    HE2  MET  68           HE2      MET  68   1.784 -10.413 -21.883
    9    HE1  MET  68           HE3      MET  68   0.439 -10.594 -23.006

  No H/Q in entry =           9
  In of MODEL   24
    1    H    LYS  69           H        LYS  69   2.329 -15.939 -19.375
    2    HA   LYS  69           HA       LYS  69   1.881 -14.291 -17.050
    3    HB2  LYS  69           HB2      LYS  69   0.789 -16.476 -17.283
    4    HB3  LYS  69           HB3      LYS  69   2.366 -17.267 -17.217
    5    HG2  LYS  69           HG2      LYS  69   2.770 -16.382 -14.984
    6    HG3  LYS  69           HG3      LYS  69   1.272 -15.455 -15.048
    7    HD2  LYS  69           HD2      LYS  69  -0.017 -17.557 -15.216
    8    HD3  LYS  69           HD3      LYS  69   1.487 -18.479 -15.127
    9    HE2  LYS  69           HE2      LYS  69   0.570 -16.529 -12.996
   10    HE3  LYS  69           HE3      LYS  69   0.304 -18.270 -12.918
   11    HZ1  LYS  69           HZ1      LYS  69   2.916 -18.159 -13.458
   12    HZ3  LYS  69           HZ2      LYS  69   2.276 -18.260 -11.889
   13    HZ2  LYS  69           HZ3      LYS  69   2.738 -16.755 -12.525

  No H/Q in entry =          13
  In of MODEL   24
    1    H    VAL  70           H        VAL  70   3.141 -14.181 -15.120
    2    HA   VAL  70           HA       VAL  70   6.034 -14.734 -15.473
    3    HB   VAL  70           HB       VAL  70   6.467 -12.643 -14.212
    4   HG11  VAL  70          HG11      VAL  70   6.471 -12.628 -16.681
    5   HG13  VAL  70          HG12      VAL  70   5.878 -11.094 -16.044
    6   HG12  VAL  70          HG13      VAL  70   4.742 -12.281 -16.682
    7   HG21  VAL  70          HG21      VAL  70   3.451 -12.542 -14.241
    8   HG23  VAL  70          HG22      VAL  70   4.377 -11.042 -14.207
    9   HG22  VAL  70          HG23      VAL  70   4.553 -12.217 -12.903

  No H/Q in entry =           9
  In of MODEL   24
    1    H    SER  71           H        SER  71   7.178 -14.668 -13.301
    2    HA   SER  71           HA       SER  71   6.128 -16.607 -11.539
    3    HB2  SER  71           HB2      SER  71   8.552 -16.069 -11.774
    4    HB3  SER  71           HB3      SER  71   8.261 -14.535 -10.957
    5    HG   SER  71           HG       SER  71   7.184 -16.117  -9.349

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU  72           H        LEU  72   4.748 -16.444  -9.895
    2    HA   LEU  72           HA       LEU  72   3.237 -14.102  -9.466
    3    HB2  LEU  72           HB2      LEU  72   3.473 -16.661  -7.890
    4    HB3  LEU  72           HB3      LEU  72   2.328 -15.381  -7.493
    5    HG   LEU  72           HG       LEU  72   2.466 -16.680 -10.233
    6   HD13  LEU  72          HD11      LEU  72   1.892 -18.372  -8.539
    7   HD12  LEU  72          HD12      LEU  72   0.478 -17.973  -9.512
    8   HD11  LEU  72          HD13      LEU  72   0.645 -17.307  -7.888
    9   HD23  LEU  72          HD21      LEU  72  -0.010 -15.816 -10.125
   10   HD22  LEU  72          HD22      LEU  72   1.260 -14.656 -10.474
   11   HD21  LEU  72          HD23      LEU  72   0.589 -14.762  -8.850

  No H/Q in entry =          11
  In of MODEL   24
    1    H    VAL  73           H        VAL  73   5.860 -15.579  -7.676
    2    HA   VAL  73           HA       VAL  73   5.815 -14.038  -5.349
    3    HB   VAL  73           HB       VAL  73   7.999 -14.869  -4.921
    4   HG11  VAL  73          HG11      VAL  73   6.036 -16.514  -5.151
    5   HG13  VAL  73          HG12      VAL  73   7.659 -17.203  -5.203
    6   HG12  VAL  73          HG13      VAL  73   6.751 -16.969  -6.697
    7   HG22  VAL  73          HG21      VAL  73   9.351 -14.404  -6.742
    8   HG21  VAL  73          HG22      VAL  73   8.148 -14.952  -7.909
    9   HG23  VAL  73          HG23      VAL  73   9.091 -16.130  -6.996

  No H/Q in entry =           9
  In of MODEL   24
    1    H    LEU  74           H        LEU  74   6.836 -13.172  -8.523
    2    HA   LEU  74           HA       LEU  74   8.813 -11.256  -8.027
    3    HB2  LEU  74           HB2      LEU  74   8.360 -12.000 -10.265
    4    HB3  LEU  74           HB3      LEU  74   6.700 -11.415 -10.175
    5    HG   LEU  74           HG       LEU  74   7.524  -9.096  -9.969
    6   HD13  LEU  74          HD11      LEU  74   9.625  -9.291  -8.891
    7   HD12  LEU  74          HD12      LEU  74  10.038  -8.830 -10.542
    8   HD11  LEU  74          HD13      LEU  74  10.192 -10.511 -10.030
    9   HD21  LEU  74          HD21      LEU  74   7.307 -10.553 -12.186
   10   HD23  LEU  74          HD22      LEU  74   9.017 -10.194 -12.263
   11   HD22  LEU  74          HD23      LEU  74   7.862  -8.881 -12.223

  No H/Q in entry =          11
  In of MODEL   24
    1    H    VAL  75           H        VAL  75   5.326 -10.811  -8.400
    2    HA   VAL  75           HA       VAL  75   5.276  -8.051  -7.822
    3    HB   VAL  75           HB       VAL  75   3.149 -10.160  -7.445
    4   HG11  VAL  75          HG11      VAL  75   3.002  -7.116  -7.283
    5   HG13  VAL  75          HG12      VAL  75   2.692  -8.247  -5.974
    6   HG12  VAL  75          HG13      VAL  75   1.603  -8.183  -7.351
    7   HG23  VAL  75          HG21      VAL  75   2.263  -9.021  -9.519
    8   HG22  VAL  75          HG22      VAL  75   3.799  -9.851  -9.764
    9   HG21  VAL  75          HG23      VAL  75   3.762  -8.096  -9.588

  No H/Q in entry =           9
  In of MODEL   24
    1    H    GLU  76           H        GLU  76   4.960 -10.916  -5.705
    2    HA   GLU  76           HA       GLU  76   4.501  -9.539  -3.290
    3    HB2  GLU  76           HB2      GLU  76   4.301 -12.017  -3.554
    4    HB3  GLU  76           HB3      GLU  76   6.046 -12.124  -3.714
    5    HG2  GLU  76           HG2      GLU  76   6.344 -11.268  -1.435
    6    HG3  GLU  76           HG3      GLU  76   4.613 -11.067  -1.246

  No H/Q in entry =           6
  In of MODEL   24
    1    H    ALA  77           H        ALA  77   7.553 -10.506  -4.834
    2    HA   ALA  77           HA       ALA  77   9.249  -9.486  -2.812
    3    HB1  ALA  77           HB1      ALA  77   9.975 -11.057  -4.601
    4    HB2  ALA  77           HB2      ALA  77  11.025  -9.646  -4.462
    5    HB3  ALA  77           HB3      ALA  77   9.845  -9.742  -5.769

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLN  78           H        GLN  78   7.899  -8.054  -5.738
    2    HA   GLN  78           HA       GLN  78   9.296  -5.599  -5.634
    3    HB2  GLN  78           HB2      GLN  78   7.991  -6.501  -7.595
    4    HB3  GLN  78           HB3      GLN  78   6.512  -6.084  -6.729
    5    HG2  GLN  78           HG2      GLN  78   7.203  -3.729  -6.655
    6    HG3  GLN  78           HG3      GLN  78   8.703  -4.131  -7.491
    7   HE21  GLN  78          HE21      GLN  78   6.434  -6.180  -8.798
    8   HE22  GLN  78          HE22      GLN  78   5.937  -5.236 -10.119

  No H/Q in entry =           8
  In of MODEL   24
    1    H    LEU  79           H        LEU  79   6.248  -6.677  -4.218
    2    HA   LEU  79           HA       LEU  79   5.292  -4.248  -3.223
    3    HB2  LEU  79           HB2      LEU  79   3.940  -6.275  -3.168
    4    HB3  LEU  79           HB3      LEU  79   5.065  -7.032  -2.044
    5    HG   LEU  79           HG       LEU  79   4.532  -5.374  -0.325
    6   HD13  LEU  79          HD11      LEU  79   4.110  -3.355  -1.386
    7   HD12  LEU  79          HD12      LEU  79   2.473  -3.849  -0.955
    8   HD11  LEU  79          HD13      LEU  79   3.059  -4.087  -2.599
    9   HD23  LEU  79          HD21      LEU  79   1.936  -5.818  -0.250
   10   HD22  LEU  79          HD22      LEU  79   3.050  -7.178  -0.130
   11   HD21  LEU  79          HD23      LEU  79   2.252  -6.831  -1.661

  No H/Q in entry =          11
  In of MODEL   24
    1    H    HIS  80           H        HIS  80   7.422  -6.618  -1.619
    2    HA   HIS  80           HA       HIS  80   7.723  -5.073   0.747
    3    HB2  HIS  80           HB2      HIS  80   9.025  -7.466  -0.436
    4    HB3  HIS  80           HB3      HIS  80   9.944  -6.582   0.784
    5    HD1  HIS  80           HD1      HIS  80   9.427  -7.201   3.126
    6    HD2  HIS  80           HD2      HIS  80   6.211  -8.000   0.596
    7    HE1  HIS  80           HE1      HIS  80   7.626  -8.266   4.566
    8    HE2  HIS  80           HE2      HIS  80   5.659  -8.757   3.033

  No H/Q in entry =           8
  In of MODEL   24
    1    H    LEU  81           H        LEU  81   9.742  -5.397  -2.151
    2    HA   LEU  81           HA       LEU  81  11.813  -3.691  -1.265
    3    HB2  LEU  81           HB2      LEU  81  10.895  -4.476  -4.032
    4    HB3  LEU  81           HB3      LEU  81  12.332  -3.496  -3.735
    5    HG   LEU  81           HG       LEU  81  11.879  -6.205  -2.455
    6   HD12  LEU  81          HD11      LEU  81  13.694  -6.871  -4.191
    7   HD11  LEU  81          HD12      LEU  81  13.161  -5.440  -5.071
    8   HD13  LEU  81          HD13      LEU  81  12.023  -6.741  -4.736
    9   HD23  LEU  81          HD21      LEU  81  14.513  -5.939  -2.425
   10   HD22  LEU  81          HD22      LEU  81  13.537  -5.156  -1.184
   11   HD21  LEU  81          HD23      LEU  81  14.143  -4.220  -2.550

  No H/Q in entry =          11
  In of MODEL   24
    1    H    MET  82           H        MET  82   8.915  -3.006  -3.223
    2    HA   MET  82           HA       MET  82   9.511  -0.293  -3.730
    3    HB2  MET  82           HB2      MET  82   6.920  -1.836  -3.616
    4    HB3  MET  82           HB3      MET  82   6.956  -0.114  -3.986
    5    HG2  MET  82           HG2      MET  82   8.526  -2.223  -5.504
    6    HG3  MET  82           HG3      MET  82   6.974  -1.572  -6.029
    7    HE3  MET  82           HE1      MET  82   7.498   1.870  -7.209
    8    HE2  MET  82           HE2      MET  82   7.107   1.657  -5.504
    9    HE1  MET  82           HE3      MET  82   6.429   0.556  -6.700

  No H/Q in entry =           9
  In of MODEL   24
    1    H    THR  83           H        THR  83   7.671  -1.847  -1.131
    2    HA   THR  83           HA       THR  83   6.857   0.522   0.182
    3    HB   THR  83           HB       THR  83   6.679  -1.043   2.204
    4    HG1  THR  83           HG1      THR  83   7.399  -3.008   1.985
    5   HG22  THR  83          HG21      THR  83   5.005  -2.581   0.730
    6   HG21  THR  83          HG22      THR  83   5.265  -1.261  -0.405
    7   HG23  THR  83          HG23      THR  83   4.620  -0.928   1.203

  No H/Q in entry =           7
  In of MODEL   24
    1    H    SER  84           H        SER  84   9.636  -1.629   0.728
    2    HA   SER  84           HA       SER  84  10.708  -0.213   2.919
    3    HB2  SER  84           HB2      SER  84  11.939  -2.086   0.908
    4    HB3  SER  84           HB3      SER  84  12.891  -1.348   2.194
    5    HG   SER  84           HG       SER  84  10.582  -2.991   2.444

  No H/Q in entry =           5
  In of MODEL   24
    1    H    MET  85           H        MET  85  11.490   0.022  -0.565
    2    HA   MET  85           HA       MET  85  13.525   1.947  -0.306
    3    HB2  MET  85           HB2      MET  85  13.119   0.668  -2.370
    4    HB3  MET  85           HB3      MET  85  11.610   1.548  -2.612
    5    HG2  MET  85           HG2      MET  85  12.855   3.672  -2.725
    6    HG3  MET  85           HG3      MET  85  14.365   2.804  -2.467
    7    HE2  MET  85           HE1      MET  85  12.063   4.101  -5.577
    8    HE1  MET  85           HE2      MET  85  11.252   3.191  -4.307
    9    HE3  MET  85           HE3      MET  85  11.441   2.476  -5.902

  No H/Q in entry =           9
  In of MODEL   24
    1    H    LEU  86           H        LEU  86  10.046   2.350  -0.840
    2    HA   LEU  86           HA       LEU  86  10.040   5.163  -1.031
    3    HB2  LEU  86           HB2      LEU  86   8.167   3.539  -1.614
    4    HB3  LEU  86           HB3      LEU  86   7.824   3.462   0.114
    5    HG   LEU  86           HG       LEU  86   7.715   6.025   0.052
    6   HD11  LEU  86          HD11      LEU  86   8.500   5.565  -2.643
    7   HD13  LEU  86          HD12      LEU  86   8.090   7.103  -1.891
    8   HD12  LEU  86          HD13      LEU  86   6.840   6.163  -2.701
    9   HD23  LEU  86          HD21      LEU  86   5.566   4.711  -1.621
   10   HD22  LEU  86          HD22      LEU  86   5.393   5.978  -0.410
   11   HD21  LEU  86          HD23      LEU  86   5.755   4.328   0.091

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ALA  87           H        ALA  87   9.512   3.004   1.719
    2    HA   ALA  87           HA       ALA  87   8.989   4.935   3.678
    3    HB1  ALA  87           HB1      ALA  87   9.740   2.099   3.606
    4    HB3  ALA  87           HB2      ALA  87   8.624   2.938   4.682
    5    HB2  ALA  87           HB3      ALA  87  10.351   2.935   5.037

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ARG  88           H        ARG  88  12.049   3.445   2.723
    2    HA   ARG  88           HA       ARG  88  13.675   4.796   4.561
    3    HB2  ARG  88           HB2      ARG  88  14.312   2.805   3.168
    4    HB3  ARG  88           HB3      ARG  88  14.496   3.890   1.793
    5    HG2  ARG  88           HG2      ARG  88  15.983   5.180   3.745
    6    HG3  ARG  88           HG3      ARG  88  16.266   3.485   4.131
    7    HD2  ARG  88           HD2      ARG  88  17.539   3.157   2.294
    8    HD3  ARG  88           HD3      ARG  88  16.427   4.048   1.251
    9    HE   ARG  88           HE       ARG  88  18.836   5.066   2.310
   10   HH21  ARG  88          HH11      ARG  88  19.228   7.276   2.111
   11   HH22  ARG  88          HH12      ARG  88  17.900   8.375   1.955
   12   HH11  ARG  88          HH21      ARG  88  15.514   5.886   2.008
   13   HH12  ARG  88          HH22      ARG  88  15.796   7.585   1.872

  No H/Q in entry =          13
  In of MODEL   24
    1    H    GLU  89           H        GLU  89  12.742   5.703   1.229
    2    HA   GLU  89           HA       GLU  89  14.337   8.030   1.075
    3    HB2  GLU  89           HB2      GLU  89  13.185   7.006  -0.877
    4    HB3  GLU  89           HB3      GLU  89  11.647   7.581  -0.231
    5    HG2  GLU  89           HG2      GLU  89  12.398   9.903  -0.397
    6    HG3  GLU  89           HG3      GLU  89  13.995   9.378  -0.921

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LEU  90           H        LEU  90  10.991   7.592   2.184
    2    HA   LEU  90           HA       LEU  90  10.528  10.338   2.748
    3    HB2  LEU  90           HB2      LEU  90   9.275   7.792   3.775
    4    HB3  LEU  90           HB3      LEU  90   8.674   9.402   4.189
    5    HG   LEU  90           HG       LEU  90   9.093   8.504   1.326
    6   HD12  LEU  90          HD11      LEU  90   6.552   8.227   1.373
    7   HD11  LEU  90          HD12      LEU  90   6.696   8.219   3.131
    8   HD13  LEU  90          HD13      LEU  90   7.495   6.970   2.175
    9   HD22  LEU  90          HD21      LEU  90   8.846  10.817   1.243
   10   HD21  LEU  90          HD22      LEU  90   7.851  10.874   2.697
   11   HD23  LEU  90          HD23      LEU  90   7.153  10.329   1.173

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  91           H        ILE  91  11.724   7.637   4.686
    2    HA   ILE  91           HA       ILE  91  11.877   9.007   7.151
    3    HB   ILE  91           HB       ILE  91  13.390   6.634   6.045
    4   HG12  ILE  91          HG12      ILE  91  11.363   6.850   8.291
    5   HG13  ILE  91          HG13      ILE  91  10.898   6.573   6.613
    6   HG22  ILE  91          HG21      ILE  91  13.839   6.419   8.689
    7   HG21  ILE  91          HG22      ILE  91  13.799   8.179   8.582
    8   HG23  ILE  91          HG23      ILE  91  14.965   7.264   7.628
    9   HD13  ILE  91          HD11      ILE  91  11.857   4.451   6.556
   10   HD12  ILE  91          HD12      ILE  91  11.255   4.527   8.212
   11   HD11  ILE  91          HD13      ILE  91  12.965   4.804   7.883

  No H/Q in entry =          11
  In of MODEL   24
    1    H    THR  92           H        THR  92  14.107   8.784   4.414
    2    HA   THR  92           HA       THR  92  16.293  10.136   5.583
    3    HB   THR  92           HB       THR  92  15.323  10.022   2.716
    4    HG1  THR  92           HG1      THR  92  16.113   8.110   3.132
    5   HG22  THR  92          HG21      THR  92  17.908  10.659   2.437
    6   HG21  THR  92          HG22      THR  92  17.607  11.491   3.962
    7   HG23  THR  92          HG23      THR  92  16.654  11.894   2.534

  No H/Q in entry =           7
  In of MODEL   24
    1    H    GLU  93           H        GLU  93  13.441  11.343   3.832
    2    HA   GLU  93           HA       GLU  93  14.091  14.091   3.941
    3    HB2  GLU  93           HB2      GLU  93  11.359  12.774   3.943
    4    HB3  GLU  93           HB3      GLU  93  11.684  14.466   3.568
    5    HG2  GLU  93           HG2      GLU  93  12.985  12.192   2.055
    6    HG3  GLU  93           HG3      GLU  93  11.456  12.904   1.556

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LEU  94           H        LEU  94  12.291  11.978   6.148
    2    HA   LEU  94           HA       LEU  94  11.510  13.947   8.013
    3    HB2  LEU  94           HB2      LEU  94  12.024  10.982   8.300
    4    HB3  LEU  94           HB3      LEU  94  11.464  11.973   9.644
    5    HG   LEU  94           HG       LEU  94   9.997  12.046   7.006
    6   HD11  LEU  94          HD11      LEU  94  10.023   9.831   9.018
    7   HD13  LEU  94          HD12      LEU  94   9.730   9.770   7.281
    8   HD12  LEU  94          HD13      LEU  94   8.456  10.316   8.370
    9   HD23  LEU  94          HD21      LEU  94   8.077  12.490   8.593
   10   HD22  LEU  94          HD22      LEU  94   9.341  13.719   8.634
   11   HD21  LEU  94          HD23      LEU  94   9.245  12.508   9.911

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  95           H        ILE  95  14.445  11.956   7.801
    2    HA   ILE  95           HA       ILE  95  15.617  12.862  10.219
    3    HB   ILE  95           HB       ILE  95  16.849  11.760   7.682
    4   HG12  ILE  95          HG12      ILE  95  16.512  10.575  10.451
    5   HG13  ILE  95          HG13      ILE  95  15.348  10.336   9.150
    6   HG21  ILE  95          HG21      ILE  95  18.105  12.550  10.329
    7   HG23  ILE  95          HG22      ILE  95  18.588  13.063   8.711
    8   HG22  ILE  95          HG23      ILE  95  18.857  11.399   9.226
    9   HD13  ILE  95          HD11      ILE  95  16.810   9.023   7.900
   10   HD12  ILE  95          HD12      ILE  95  17.263   8.570   9.540
   11   HD11  ILE  95          HD13      ILE  95  18.246   9.727   8.643

  No H/Q in entry =          11
  In of MODEL   24
    1    H    GLU  96           H        GLU  96  15.816  14.082   6.882
    2    HA   GLU  96           HA       GLU  96  17.702  16.124   7.363
    3    HB2  GLU  96           HB2      GLU  96  17.038  15.468   5.102
    4    HB3  GLU  96           HB3      GLU  96  15.405  16.059   5.391
    5    HG2  GLU  96           HG2      GLU  96  16.017  18.175   4.845
    6    HG3  GLU  96           HG3      GLU  96  17.309  18.152   6.035

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LEU  97           H        LEU  97  14.185  16.010   7.772
    2    HA   LEU  97           HA       LEU  97  13.821  18.753   8.403
    3    HB2  LEU  97           HB2      LEU  97  12.248  16.261   9.016
    4    HB3  LEU  97           HB3      LEU  97  11.763  17.820   9.679
    5    HG   LEU  97           HG       LEU  97  12.255  17.385   6.718
    6   HD12  LEU  97          HD11      LEU  97   9.730  17.308   6.586
    7   HD11  LEU  97          HD12      LEU  97   9.709  17.114   8.337
    8   HD13  LEU  97          HD13      LEU  97  10.471  15.888   7.323
    9   HD23  LEU  97          HD21      LEU  97  10.557  19.384   6.735
   10   HD22  LEU  97          HD22      LEU  97  12.243  19.711   7.136
   11   HD21  LEU  97          HD23      LEU  97  11.043  19.569   8.419

  No H/Q in entry =          11
  In of MODEL   24
    1    H    HIS  98           H        HIS  98  14.573  15.918  10.412
    2    HA   HIS  98           HA       HIS  98  14.426  17.189  12.923
    3    HB2  HIS  98           HB2      HIS  98  16.135  14.894  11.939
    4    HB3  HIS  98           HB3      HIS  98  16.135  15.437  13.618
    5    HD1  HIS  98           HD1      HIS  98  13.918  13.845  11.018
    6    HD2  HIS  98           HD2      HIS  98  13.806  14.780  15.079
    7    HE1  HIS  98           HE1      HIS  98  11.863  12.695  11.963
    8    HE2  HIS  98           HE2      HIS  98  11.775  13.256  14.431

  No H/Q in entry =           8
  In of MODEL   24
    1    H    GLU  99           H        GLU  99  16.991  17.014  10.504
    2    HA   GLU  99           HA       GLU  99  18.995  18.309  12.040
    3    HB2  GLU  99           HB2      GLU  99  19.459  17.006   9.978
    4    HB3  GLU  99           HB3      GLU  99  18.681  18.274   9.029
    5    HG2  GLU  99           HG2      GLU  99  20.319  19.914   9.824
    6    HG3  GLU  99           HG3      GLU  99  21.067  18.699  10.855

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LYS 100           H        LYS 100  16.508  19.517   9.806
    2    HA   LYS 100           HA       LYS 100  17.361  22.237   9.946
    3    HB2  LYS 100           HB2      LYS 100  14.707  21.001   9.180
    4    HB3  LYS 100           HB3      LYS 100  15.043  22.732   9.086
    5    HG2  LYS 100           HG2      LYS 100  17.014  22.238   7.632
    6    HG3  LYS 100           HG3      LYS 100  16.565  20.530   7.653
    7    HD2  LYS 100           HD2      LYS 100  14.386  21.082   6.638
    8    HD3  LYS 100           HD3      LYS 100  14.819  22.793   6.625
    9    HE2  LYS 100           HE2      LYS 100  16.776  22.267   5.178
   10    HE3  LYS 100           HE3      LYS 100  16.275  20.572   5.147
   11    HZ1  LYS 100           HZ1      LYS 100  14.501  22.800   4.295
   12    HZ3  LYS 100           HZ2      LYS 100  14.283  21.134   4.037
   13    HZ2  LYS 100           HZ3      LYS 100  15.517  21.968   3.220

  No H/Q in entry =          13
  In of MODEL   24
    1    H    LEU 101           H        LEU 101  15.211  20.242  11.905
    2    HA   LEU 101           HA       LEU 101  14.079  22.339  13.471
    3    HB2  LEU 101           HB2      LEU 101  14.457  19.382  13.866
    4    HB3  LEU 101           HB3      LEU 101  13.934  20.377  15.221
    5    HG   LEU 101           HG       LEU 101  12.533  20.487  12.543
    6   HD12  LEU 101          HD11      LEU 101  10.834  18.962  13.807
    7   HD11  LEU 101          HD12      LEU 101  12.214  18.523  14.811
    8   HD13  LEU 101          HD13      LEU 101  12.251  18.211  13.075
    9   HD21  LEU 101          HD21      LEU 101  11.877  21.302  15.389
   10   HD23  LEU 101          HD22      LEU 101  10.618  21.100  14.172
   11   HD22  LEU 101          HD23      LEU 101  11.880  22.308  13.938

  No H/Q in entry =          11
  In of MODEL   24
    1    H    LYS 102           H        LYS 102  17.215  21.663  13.054
    2    HA   LYS 102           HA       LYS 102  19.074  22.498  14.135
    3    HB2  LYS 102           HB2      LYS 102  17.286  24.055  15.253
    4    HB3  LYS 102           HB3      LYS 102  17.462  22.992  16.634
    5    HG2  LYS 102           HG2      LYS 102  19.404  24.959  15.470
    6    HG3  LYS 102           HG3      LYS 102  19.006  24.658  17.148
    7    HD2  LYS 102           HD2      LYS 102  20.642  22.705  15.477
    8    HD3  LYS 102           HD3      LYS 102  21.354  24.015  16.410
    9    HE2  LYS 102           HE2      LYS 102  20.896  21.479  17.384
   10    HE3  LYS 102           HE3      LYS 102  21.139  22.919  18.372
   11    HZ2  LYS 102           HZ1      LYS 102  19.140  21.679  18.982
   12    HZ1  LYS 102           HZ2      LYS 102  18.510  21.918  17.429
   13    HZ3  LYS 102           HZ3      LYS 102  18.763  23.245  18.452

  No H/Q in entry =          13
  In of MODEL   24
    1    H    ALA 103           H        ALA 103  16.955  20.945  16.549
    2    HA   ALA 103           HA       ALA 103  18.646  19.702  18.218
    3    HB2  ALA 103           HB1      ALA 103  17.019  17.729  18.209
    4    HB1  ALA 103           HB2      ALA 103  16.149  18.597  16.943
    5    HB3  ALA 103           HB3      ALA 103  16.334  19.319  18.541

  No H/Q in entry =           5
  In of MODEL   24
    1    H1   ALA   1           H3       ALA   1  -1.626  -6.840 -21.439
    2    H2   ALA   1           H2       ALA   1  -2.454  -8.257 -20.986
    3    H3   ALA   1           H1       ALA   1  -0.844  -8.343 -21.532
    4    HA   ALA   1           HA       ALA   1  -1.676  -8.800 -23.531
    5    HB1  ALA   1           HB1      ALA   1  -3.831  -9.470 -23.068
    6    HB2  ALA   1           HB2      ALA   1  -4.232  -7.953 -23.873
    7    HB3  ALA   1           HB3      ALA   1  -4.184  -8.029 -22.113

  No H/Q in entry =           7
  In of MODEL   24
    1    H    GLU   2           H        GLU   2  -2.469  -7.598 -25.529
    2    HA   GLU   2           HA       GLU   2  -1.021  -5.617 -26.404
    3    HB2  GLU   2           HB2      GLU   2  -4.027  -5.620 -26.739
    4    HB3  GLU   2           HB3      GLU   2  -2.882  -4.784 -27.784
    5    HG2  GLU   2           HG2      GLU   2  -2.413  -6.688 -28.931
    6    HG3  GLU   2           HG3      GLU   2  -2.144  -7.596 -27.449

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLU   3           H        GLU   3  -4.159  -4.289 -25.526
    2    HA   GLU   3           HA       GLU   3  -3.060  -1.755 -24.898
    3    HB2  GLU   3           HB2      GLU   3  -5.778  -3.010 -24.579
    4    HB3  GLU   3           HB3      GLU   3  -5.449  -1.399 -23.935
    5    HG2  GLU   3           HG2      GLU   3  -5.060  -0.487 -26.061
    6    HG3  GLU   3           HG3      GLU   3  -4.695  -2.052 -26.779

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LEU   4           H        LEU   4  -4.715  -4.072 -22.722
    2    HA   LEU   4           HA       LEU   4  -4.338  -2.845 -20.332
    3    HB2  LEU   4           HB2      LEU   4  -3.856  -5.799 -20.790
    4    HB3  LEU   4           HB3      LEU   4  -4.255  -5.040 -19.251
    5    HG   LEU   4           HG       LEU   4  -6.014  -5.082 -21.725
    6   HD13  LEU   4          HD11      LEU   4  -7.251  -6.770 -20.730
    7   HD12  LEU   4          HD12      LEU   4  -6.766  -6.316 -19.097
    8   HD11  LEU   4          HD13      LEU   4  -5.642  -7.187 -20.140
    9   HD23  LEU   4          HD21      LEU   4  -7.692  -4.229 -19.870
   10   HD22  LEU   4          HD22      LEU   4  -6.623  -3.083 -20.677
   11   HD21  LEU   4          HD23      LEU   4  -6.220  -3.678 -19.068

  No H/Q in entry =          11
  In of MODEL   24
    1    H    GLU   5           H        GLU   5  -1.871  -4.747 -22.043
    2    HA   GLU   5           HA       GLU   5   0.107  -4.501 -19.995
    3    HB2  GLU   5           HB2      GLU   5   0.122  -6.271 -21.766
    4    HB3  GLU   5           HB3      GLU   5   0.520  -5.027 -22.951
    5    HG2  GLU   5           HG2      GLU   5   2.591  -6.042 -22.279
    6    HG3  GLU   5           HG3      GLU   5   2.533  -4.450 -21.524

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLU   6           H        GLU   6  -0.473  -2.783 -23.048
    2    HA   GLU   6           HA       GLU   6   1.735  -0.998 -22.772
    3    HB2  GLU   6           HB2      GLU   6   0.630  -1.450 -24.941
    4    HB3  GLU   6           HB3      GLU   6  -0.828  -0.654 -24.349
    5    HG2  GLU   6           HG2      GLU   6   0.412   1.441 -24.048
    6    HG3  GLU   6           HG3      GLU   6   1.896   0.656 -24.583

  No H/Q in entry =           6
  In of MODEL   24
    1    H    VAL   7           H        VAL   7  -1.610  -0.994 -21.747
    2    HA   VAL   7           HA       VAL   7  -1.777   1.725 -20.919
    3    HB   VAL   7           HB       VAL   7  -3.299  -0.757 -20.085
    4   HG11  VAL   7          HG11      VAL   7  -3.615   2.141 -19.281
    5   HG13  VAL   7          HG12      VAL   7  -3.553   0.718 -18.241
    6   HG12  VAL   7          HG13      VAL   7  -4.973   1.016 -19.243
    7   HG21  VAL   7          HG21      VAL   7  -3.418   0.315 -22.477
    8   HG23  VAL   7          HG22      VAL   7  -4.341   1.587 -21.674
    9   HG22  VAL   7          HG23      VAL   7  -4.923  -0.078 -21.646

  No H/Q in entry =           9
  In of MODEL   24
    1    H    VAL   8           H        VAL   8  -0.865  -1.276 -19.262
    2    HA   VAL   8           HA       VAL   8  -0.538  -0.196 -16.668
    3    HB   VAL   8           HB       VAL   8   0.826  -2.545 -18.008
    4   HG12  VAL   8          HG11      VAL   8   1.255  -3.226 -15.588
    5   HG11  VAL   8          HG12      VAL   8   0.836  -1.572 -15.139
    6   HG13  VAL   8          HG13      VAL   8   2.225  -1.878 -16.180
    7   HG23  VAL   8          HG21      VAL   8  -1.173  -2.939 -15.836
    8   HG22  VAL   8          HG22      VAL   8  -0.979  -3.809 -17.355
    9   HG21  VAL   8          HG23      VAL   8  -1.833  -2.269 -17.327

  No H/Q in entry =           9
  In of MODEL   24
    1    H    MET   9           H        MET   9   1.720  -0.554 -19.401
    2    HA   MET   9           HA       MET   9   4.021   0.441 -18.129
    3    HB2  MET   9           HB2      MET   9   3.087   0.464 -20.996
    4    HB3  MET   9           HB3      MET   9   4.606   1.224 -20.522
    5    HG2  MET   9           HG2      MET   9   5.126  -1.028 -19.347
    6    HG3  MET   9           HG3      MET   9   3.825  -1.682 -20.342
    7    HE3  MET   9           HE1      MET   9   4.925  -1.315 -23.922
    8    HE2  MET   9           HE2      MET   9   3.871  -0.234 -23.017
    9    HE1  MET   9           HE3      MET   9   3.781  -1.972 -22.746

  No H/Q in entry =           9
  In of MODEL   24
    1    H    GLY  10           H        GLY  10   1.383   2.099 -19.826
    2    HA3  GLY  10           HA2      GLY  10   2.405   4.730 -19.583
    3    HA2  GLY  10           HA3      GLY  10   0.706   4.308 -19.796

  No H/Q in entry =           3
  In of MODEL   24
    1    H    LEU  11           H        LEU  11   0.259   2.796 -17.509
    2    HA   LEU  11           HA       LEU  11  -0.236   4.790 -15.557
    3    HB2  LEU  11           HB2      LEU  11  -0.239   1.774 -15.393
    4    HB3  LEU  11           HB3      LEU  11  -0.732   2.812 -14.056
    5    HG   LEU  11           HG       LEU  11  -1.952   2.947 -16.826
    6   HD13  LEU  11          HD11      LEU  11  -2.589   0.819 -16.069
    7   HD12  LEU  11          HD12      LEU  11  -3.920   1.843 -15.534
    8   HD11  LEU  11          HD13      LEU  11  -2.681   1.337 -14.385
    9   HD22  LEU  11          HD21      LEU  11  -2.502   4.978 -15.828
   10   HD21  LEU  11          HD22      LEU  11  -2.452   4.315 -14.195
   11   HD23  LEU  11          HD23      LEU  11  -3.829   3.978 -15.244

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  12           H        ILE  12   2.250   2.265 -15.779
    2    HA   ILE  12           HA       ILE  12   3.454   2.781 -13.270
    3    HB   ILE  12           HB       ILE  12   4.699   1.707 -15.823
    4   HG12  ILE  12          HG12      ILE  12   2.651   0.524 -14.694
    5   HG13  ILE  12          HG13      ILE  12   4.033  -0.446 -15.162
    6   HG21  ILE  12          HG21      ILE  12   5.653   1.644 -12.941
    7   HG23  ILE  12          HG22      ILE  12   6.461   2.401 -14.314
    8   HG22  ILE  12          HG23      ILE  12   6.336   0.645 -14.222
    9   HD11  ILE  12          HD11      ILE  12   3.578   0.683 -12.388
   10   HD13  ILE  12          HD12      ILE  12   4.832  -0.458 -12.873
   11   HD12  ILE  12          HD13      ILE  12   3.152  -0.948 -12.875

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  13           H        ILE  13   4.102   4.022 -16.527
    2    HA   ILE  13           HA       ILE  13   6.275   5.694 -15.795
    3    HB   ILE  13           HB       ILE  13   4.259   5.813 -18.052
    4   HG12  ILE  13          HG12      ILE  13   6.059   3.938 -17.757
    5   HG13  ILE  13          HG13      ILE  13   5.835   4.677 -19.338
    6   HG23  ILE  13          HG21      ILE  13   4.974   8.061 -17.894
    7   HG22  ILE  13          HG22      ILE  13   6.028   7.369 -19.122
    8   HG21  ILE  13          HG23      ILE  13   6.628   7.606 -17.481
    9   HD12  ILE  13          HD11      ILE  13   8.265   4.457 -18.628
   10   HD11  ILE  13          HD12      ILE  13   7.915   5.605 -17.341
   11   HD13  ILE  13          HD13      ILE  13   7.763   6.101 -19.022

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ASN  14           H        ASN  14   2.782   6.269 -16.083
    2    HA   ASN  14           HA       ASN  14   2.800   9.017 -15.453
    3    HB2  ASN  14           HB2      ASN  14   0.873   7.417 -16.289
    4    HB3  ASN  14           HB3      ASN  14   0.539   7.251 -14.570
    5   HD21  ASN  14          HD21      ASN  14  -1.446   8.450 -16.016
    6   HD22  ASN  14          HD22      ASN  14  -1.471  10.125 -15.753

  No H/Q in entry =           6
  In of MODEL   24
    1    H    SER  15           H        SER  15   2.428   6.153 -13.371
    2    HA   SER  15           HA       SER  15   2.140   7.537 -10.927
    3    HB2  SER  15           HB2      SER  15   2.634   5.442  -9.870
    4    HB3  SER  15           HB3      SER  15   1.804   5.037 -11.369
    5    HG   SER  15           HG       SER  15   4.530   4.843 -10.715

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLY  16           H        GLY  16   4.999   6.370 -12.669
    2    HA3  GLY  16           HA2      GLY  16   6.931   7.087 -10.730
    3    HA2  GLY  16           HA3      GLY  16   7.238   6.873 -12.451

  No H/Q in entry =           3
  In of MODEL   24
    1    H    GLN  17           H        GLN  17   5.599   8.866 -13.528
    2    HA   GLN  17           HA       GLN  17   7.227  11.172 -13.218
    3    HB2  GLN  17           HB2      GLN  17   5.940  10.759 -15.272
    4    HB3  GLN  17           HB3      GLN  17   4.431  10.923 -14.372
    5    HG2  GLN  17           HG2      GLN  17   4.978  13.247 -13.824
    6    HG3  GLN  17           HG3      GLN  17   6.527  13.095 -14.651
    7   HE21  GLN  17          HE21      GLN  17   4.589  15.043 -15.474
    8   HE22  GLN  17          HE22      GLN  17   4.019  14.604 -17.011

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ALA  18           H        ALA  18   4.097  10.227 -11.882
    2    HA   ALA  18           HA       ALA  18   3.419  12.635 -10.626
    3    HB1  ALA  18           HB1      ALA  18   2.237  10.203 -10.848
    4    HB2  ALA  18           HB2      ALA  18   1.709  11.438  -9.707
    5    HB3  ALA  18           HB3      ALA  18   2.768  10.133  -9.168

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ARG  19           H        ARG  19   5.225   9.835  -9.330
    2    HA   ARG  19           HA       ARG  19   5.770  10.987  -6.809
    3    HB2  ARG  19           HB2      ARG  19   6.134   8.575  -7.327
    4    HB3  ARG  19           HB3      ARG  19   7.505   9.028  -8.343
    5    HG2  ARG  19           HG2      ARG  19   8.637  10.049  -6.417
    6    HG3  ARG  19           HG3      ARG  19   7.248   9.693  -5.391
    7    HD2  ARG  19           HD2      ARG  19   8.972   8.021  -5.020
    8    HD3  ARG  19           HD3      ARG  19   7.586   7.267  -5.811
    9    HE   ARG  19           HE       ARG  19   9.318   8.043  -7.851
   10   HH21  ARG  19          HH11      ARG  19  10.852   6.603  -8.690
   11   HH22  ARG  19          HH12      ARG  19  11.364   5.246  -7.748
   12   HH11  ARG  19          HH21      ARG  19   9.332   6.019  -5.068
   13   HH12  ARG  19          HH22      ARG  19  10.500   4.915  -5.696

  No H/Q in entry =          13
  In of MODEL   24
    1    H    SER  20           H        SER  20   7.603  10.970  -9.848
    2    HA   SER  20           HA       SER  20   9.873  12.339  -9.016
    3    HB2  SER  20           HB2      SER  20   9.898  11.457 -11.217
    4    HB3  SER  20           HB3      SER  20   8.418  12.303 -11.655
    5    HG   SER  20           HG       SER  20   9.890  14.227 -10.990

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU  21           H        LEU  21   6.808  13.670 -10.232
    2    HA   LEU  21           HA       LEU  21   7.535  16.402 -10.012
    3    HB2  LEU  21           HB2      LEU  21   4.834  15.040  -9.934
    4    HB3  LEU  21           HB3      LEU  21   5.044  16.789  -9.958
    5    HG   LEU  21           HG       LEU  21   6.200  14.938 -12.064
    6   HD12  LEU  21          HD11      LEU  21   4.312  15.862 -13.484
    7   HD11  LEU  21          HD12      LEU  21   3.596  16.483 -11.995
    8   HD13  LEU  21          HD13      LEU  21   3.808  14.746 -12.212
    9   HD23  LEU  21          HD21      LEU  21   6.057  17.252 -13.329
   10   HD22  LEU  21          HD22      LEU  21   7.403  16.972 -12.228
   11   HD21  LEU  21          HD23      LEU  21   6.032  17.939 -11.707

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ALA  22           H        ALA  22   5.964  14.150  -7.766
    2    HA   ALA  22           HA       ALA  22   5.387  15.976  -5.707
    3    HB3  ALA  22           HB1      ALA  22   4.578  13.599  -5.867
    4    HB2  ALA  22           HB2      ALA  22   5.168  14.063  -4.271
    5    HB1  ALA  22           HB3      ALA  22   6.177  13.081  -5.334

  No H/Q in entry =           5
  In of MODEL   24
    1    H    TYR  23           H        TYR  23   8.282  13.890  -6.124
    2    HA   TYR  23           HA       TYR  23   9.673  14.887  -3.867
    3    HB2  TYR  23           HB2      TYR  23  10.425  12.861  -5.015
    4    HB3  TYR  23           HB3      TYR  23  10.765  13.788  -6.476
    5    HD1  TYR  23           HD1      TYR  23  11.711  13.419  -2.885
    6    HD2  TYR  23           HD2      TYR  23  12.817  14.940  -6.748
    7    HE1  TYR  23           HE1      TYR  23  13.977  13.953  -2.028
    8    HE2  TYR  23           HE2      TYR  23  15.081  15.477  -5.889
    9    HH   TYR  23           HH       TYR  23  16.294  14.254  -3.019

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ALA  24           H        ALA  24   9.530  15.988  -7.237
    2    HA   ALA  24           HA       ALA  24  11.465  18.036  -6.987
    3    HB2  ALA  24           HB1      ALA  24  11.036  18.101  -9.198
    4    HB3  ALA  24           HB2      ALA  24   9.493  18.882  -8.849
    5    HB1  ALA  24           HB3      ALA  24   9.585  17.126  -8.973

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA  25           H        ALA  25   7.980  17.921  -6.383
    2    HA   ALA  25           HA       ALA  25   7.550  20.650  -5.824
    3    HB1  ALA  25           HB1      ALA  25   5.852  18.683  -6.028
    4    HB2  ALA  25           HB2      ALA  25   5.503  19.982  -4.885
    5    HB3  ALA  25           HB3      ALA  25   6.160  18.449  -4.307

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU  26           H        LEU  26   8.556  17.956  -3.761
    2    HA   LEU  26           HA       LEU  26   8.676  19.392  -1.328
    3    HB2  LEU  26           HB2      LEU  26   8.725  16.974  -1.315
    4    HB3  LEU  26           HB3      LEU  26  10.200  16.951  -2.278
    5    HG   LEU  26           HG       LEU  26  11.426  18.051  -0.435
    6   HD12  LEU  26          HD11      LEU  26  10.189  18.088   1.819
    7   HD11  LEU  26          HD12      LEU  26   8.704  17.976   0.877
    8   HD13  LEU  26          HD13      LEU  26   9.776  19.361   0.669
    9   HD21  LEU  26          HD21      LEU  26   9.842  15.615   0.437
   10   HD23  LEU  26          HD22      LEU  26  11.364  16.151   1.141
   11   HD22  LEU  26          HD23      LEU  26  11.317  15.588  -0.528

  No H/Q in entry =          11
  In of MODEL   24
    1    H    LYS  27           H        LYS  27  11.094  18.767  -3.838
    2    HA   LYS  27           HA       LYS  27  13.295  19.970  -2.602
    3    HB2  LYS  27           HB2      LYS  27  13.382  18.616  -4.688
    4    HB3  LYS  27           HB3      LYS  27  12.646  19.959  -5.561
    5    HG2  LYS  27           HG2      LYS  27  14.535  21.412  -4.978
    6    HG3  LYS  27           HG3      LYS  27  15.267  20.108  -4.034
    7    HD2  LYS  27           HD2      LYS  27  15.395  18.713  -6.083
    8    HD3  LYS  27           HD3      LYS  27  14.709  20.041  -7.019
    9    HE2  LYS  27           HE2      LYS  27  16.620  21.474  -6.401
   10    HE3  LYS  27           HE3      LYS  27  17.310  20.150  -5.456
   11    HZ3  LYS  27           HZ1      LYS  27  18.313  20.225  -7.637
   12    HZ2  LYS  27           HZ2      LYS  27  16.788  20.132  -8.386
   13    HZ1  LYS  27           HZ3      LYS  27  17.383  18.813  -7.494

  No H/Q in entry =          13
  In of MODEL   24
    1    H    GLN  28           H        GLN  28  10.708  21.394  -4.568
    2    HA   GLN  28           HA       GLN  28  11.716  24.028  -4.724
    3    HB2  GLN  28           HB2      GLN  28   8.863  23.010  -4.623
    4    HB3  GLN  28           HB3      GLN  28   9.308  24.673  -5.002
    5    HG2  GLN  28           HG2      GLN  28  10.255  22.233  -6.533
    6    HG3  GLN  28           HG3      GLN  28   8.957  23.307  -7.052
    7   HE21  GLN  28          HE21      GLN  28  12.123  22.718  -7.688
    8   HE22  GLN  28          HE22      GLN  28  12.645  24.285  -8.083

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ALA  29           H        ALA  29   9.741  22.378  -2.293
    2    HA   ALA  29           HA       ALA  29   9.223  24.585  -0.620
    3    HB2  ALA  29           HB1      ALA  29   8.458  23.034   0.949
    4    HB1  ALA  29           HB2      ALA  29   9.660  21.827   0.493
    5    HB3  ALA  29           HB3      ALA  29   8.285  22.142  -0.563

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LYS  30           H        LYS  30  11.913  22.269  -0.669
    2    HA   LYS  30           HA       LYS  30  13.236  23.207   1.637
    3    HB2  LYS  30           HB2      LYS  30  14.322  21.894  -0.864
    4    HB3  LYS  30           HB3      LYS  30  15.303  22.240   0.562
    5    HG2  LYS  30           HG2      LYS  30  13.719  20.888   1.938
    6    HG3  LYS  30           HG3      LYS  30  12.834  20.478   0.464
    7    HD2  LYS  30           HD2      LYS  30  14.865  19.453  -0.483
    8    HD3  LYS  30           HD3      LYS  30  15.770  19.877   0.972
    9    HE2  LYS  30           HE2      LYS  30  14.233  18.476   2.323
   10    HE3  LYS  30           HE3      LYS  30  13.359  18.032   0.852
   11    HZ2  LYS  30           HZ1      LYS  30  15.118  16.425   1.626
   12    HZ1  LYS  30           HZ2      LYS  30  16.278  17.590   1.177
   13    HZ3  LYS  30           HZ3      LYS  30  15.237  16.921   0.009

  No H/Q in entry =          13
  In of MODEL   24
    1    H    GLN  31           H        GLN  31  13.164  24.403  -1.663
    2    HA   GLN  31           HA       GLN  31  15.348  26.259  -1.236
    3    HB2  GLN  31           HB2      GLN  31  13.317  26.335  -3.471
    4    HB3  GLN  31           HB3      GLN  31  14.949  27.002  -3.466
    5    HG2  GLN  31           HG2      GLN  31  15.361  24.300  -2.881
    6    HG3  GLN  31           HG3      GLN  31  14.062  24.266  -4.066
    7   HE21  GLN  31          HE21      GLN  31  16.893  23.422  -4.453
    8   HE22  GLN  31          HE22      GLN  31  17.489  24.381  -5.719

  No H/Q in entry =           8
  In of MODEL   24
    1    H    GLY  32           H        GLY  32  12.265  26.134  -0.106
    2    HA3  GLY  32           HA2      GLY  32  11.130  27.726   1.157
    3    HA2  GLY  32           HA3      GLY  32  12.280  28.940   0.609

  No H/Q in entry =           3
  In of MODEL   24
    1    H    ASP  33           H        ASP  33  10.895  27.053  -1.885
    2    HA   ASP  33           HA       ASP  33   9.275  29.352  -2.755
    3    HB2  ASP  33           HB2      ASP  33  10.333  26.910  -4.185
    4    HB3  ASP  33           HB3      ASP  33   9.205  28.043  -4.924

  No H/Q in entry =           4
  In of MODEL   24
    1    H    PHE  34           H        PHE  34   7.571  28.911  -1.199
    2    HA   PHE  34           HA       PHE  34   6.148  26.464  -1.103
    3    HB2  PHE  34           HB2      PHE  34   5.232  29.269  -0.436
    4    HB3  PHE  34           HB3      PHE  34   4.355  27.795  -0.025
    5    HD1  PHE  34           HD1      PHE  34   6.641  30.157   1.194
    6    HD2  PHE  34           HD2      PHE  34   5.887  25.929   1.149
    7    HE1  PHE  34           HE1      PHE  34   8.017  29.888   3.238
    8    HE2  PHE  34           HE2      PHE  34   7.265  25.664   3.192
    9    HZ   PHE  34           HZ       PHE  34   8.324  27.645   4.236

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ALA  35           H        ALA  35   5.777  29.328  -3.124
    2    HA   ALA  35           HA       ALA  35   3.221  28.756  -4.160
    3    HB1  ALA  35           HB1      ALA  35   4.307  30.123  -6.197
    4    HB3  ALA  35           HB2      ALA  35   5.525  30.467  -4.968
    5    HB2  ALA  35           HB3      ALA  35   3.840  30.906  -4.687

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA  36           H        ALA  36   6.444  28.022  -5.496
    2    HA   ALA  36           HA       ALA  36   5.441  26.604  -7.741
    3    HB3  ALA  36           HB1      ALA  36   7.605  26.689  -8.346
    4    HB2  ALA  36           HB2      ALA  36   8.062  25.656  -6.990
    5    HB1  ALA  36           HB3      ALA  36   7.986  27.406  -6.780

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA  37           H        ALA  37   6.364  25.603  -4.478
    2    HA   ALA  37           HA       ALA  37   6.258  22.815  -4.900
    3    HB2  ALA  37           HB1      ALA  37   6.017  24.617  -2.528
    4    HB1  ALA  37           HB2      ALA  37   7.128  23.279  -2.811
    5    HB3  ALA  37           HB3      ALA  37   5.459  22.956  -2.347

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LYS  38           H        LYS  38   3.758  25.070  -3.751
    2    HA   LYS  38           HA       LYS  38   1.627  23.294  -3.533
    3    HB2  LYS  38           HB2      LYS  38   2.025  26.045  -3.288
    4    HB3  LYS  38           HB3      LYS  38   0.830  25.915  -4.573
    5    HG2  LYS  38           HG2      LYS  38  -0.650  24.621  -3.134
    6    HG3  LYS  38           HG3      LYS  38   0.587  24.543  -1.871
    7    HD2  LYS  38           HD2      LYS  38   0.439  26.884  -1.431
    8    HD3  LYS  38           HD3      LYS  38  -0.460  27.184  -2.919
    9    HE2  LYS  38           HE2      LYS  38  -1.972  27.250  -0.987
   10    HE3  LYS  38           HE3      LYS  38  -2.365  25.877  -2.027
   11    HZ3  LYS  38           HZ1      LYS  38  -1.672  24.399  -0.486
   12    HZ2  LYS  38           HZ2      LYS  38  -2.007  25.665   0.598
   13    HZ1  LYS  38           HZ3      LYS  38  -0.414  25.385   0.081

  No H/Q in entry =          13
  In of MODEL   24
    1    H    ALA  39           H        ALA  39   2.654  25.171  -6.383
    2    HA   ALA  39           HA       ALA  39   0.572  24.335  -8.093
    3    HB2  ALA  39           HB1      ALA  39   3.324  24.932  -9.135
    4    HB1  ALA  39           HB2      ALA  39   2.376  26.212  -8.378
    5    HB3  ALA  39           HB3      ALA  39   1.756  25.382  -9.805

  No H/Q in entry =           5
  In of MODEL   24
    1    H    MET  40           H        MET  40   3.784  22.982  -7.494
    2    HA   MET  40           HA       MET  40   3.661  20.958  -9.480
    3    HB2  MET  40           HB2      MET  40   5.263  21.161  -6.924
    4    HB3  MET  40           HB3      MET  40   5.498  19.897  -8.134
    5    HG2  MET  40           HG2      MET  40   5.610  22.850  -8.807
    6    HG3  MET  40           HG3      MET  40   7.038  21.924  -8.348
    7    HE3  MET  40           HE1      MET  40   7.886  19.685 -11.146
    8    HE2  MET  40           HE2      MET  40   7.309  19.381  -9.510
    9    HE1  MET  40           HE3      MET  40   8.429  20.708  -9.808

  No H/Q in entry =           9
  In of MODEL   24
    1    H    MET  41           H        MET  41   2.730  21.026  -6.061
    2    HA   MET  41           HA       MET  41   2.149  18.271  -5.778
    3    HB2  MET  41           HB2      MET  41   0.850  20.656  -4.440
    4    HB3  MET  41           HB3      MET  41   0.663  18.982  -3.928
    5    HG2  MET  41           HG2      MET  41   3.377  19.159  -3.952
    6    HG3  MET  41           HG3      MET  41   2.963  20.825  -3.564
    7    HE2  MET  41           HE1      MET  41  -0.106  19.630  -1.850
    8    HE1  MET  41           HE2      MET  41   0.738  21.128  -2.227
    9    HE3  MET  41           HE3      MET  41   0.661  20.563  -0.558

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ASP  42           H        ASP  42   0.162  21.027  -6.770
    2    HA   ASP  42           HA       ASP  42  -2.301  19.708  -6.915
    3    HB2  ASP  42           HB2      ASP  42  -1.549  22.265  -7.175
    4    HB3  ASP  42           HB3      ASP  42  -1.699  21.868  -8.883

  No H/Q in entry =           4
  In of MODEL   24
    1    H    GLN  43           H        GLN  43   0.162  20.250  -9.406
    2    HA   GLN  43           HA       GLN  43  -1.237  18.948 -11.498
    3    HB2  GLN  43           HB2      GLN  43   1.728  19.416 -11.103
    4    HB3  GLN  43           HB3      GLN  43   1.011  18.783 -12.587
    5    HG2  GLN  43           HG2      GLN  43  -0.466  20.836 -12.642
    6    HG3  GLN  43           HG3      GLN  43   0.491  21.479 -11.312
    7   HE21  GLN  43          HE21      GLN  43   0.690  23.091 -13.402
    8   HE22  GLN  43          HE22      GLN  43   2.105  22.843 -14.301

  No H/Q in entry =           8
  In of MODEL   24
    1    H    SER  44           H        SER  44   1.082  17.776  -9.093
    2    HA   SER  44           HA       SER  44   1.379  15.161 -10.109
    3    HB2  SER  44           HB2      SER  44   2.286  16.591  -7.872
    4    HB3  SER  44           HB3      SER  44   1.398  15.224  -7.202
    5    HG   SER  44           HG       SER  44   3.500  14.568  -7.616

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ARG  45           H        ARG  45  -0.930  16.525  -7.786
    2    HA   ARG  45           HA       ARG  45  -2.359  14.189  -7.151
    3    HB2  ARG  45           HB2      ARG  45  -2.527  16.364  -5.967
    4    HB3  ARG  45           HB3      ARG  45  -3.365  17.040  -7.360
    5    HG2  ARG  45           HG2      ARG  45  -5.161  15.345  -7.081
    6    HG3  ARG  45           HG3      ARG  45  -4.334  14.723  -5.652
    7    HD2  ARG  45           HD2      ARG  45  -4.509  16.996  -4.603
    8    HD3  ARG  45           HD3      ARG  45  -5.480  17.528  -5.992
    9    HE   ARG  45           HE       ARG  45  -6.634  15.174  -4.951
   10   HH21  ARG  45          HH11      ARG  45  -8.475  15.283  -3.690
   11   HH22  ARG  45          HH12      ARG  45  -8.851  16.731  -2.827
   12   HH11  ARG  45          HH21      ARG  45  -6.040  18.414  -3.934
   13   HH12  ARG  45          HH22      ARG  45  -7.467  18.505  -2.963

  No H/Q in entry =          13
  In of MODEL   24
    1    H    MET  46           H        MET  46  -2.891  16.595  -9.712
    2    HA   MET  46           HA       MET  46  -5.244  15.458 -10.782
    3    HB2  MET  46           HB2      MET  46  -3.106  17.244 -11.956
    4    HB3  MET  46           HB3      MET  46  -4.498  16.711 -12.903
    5    HG2  MET  46           HG2      MET  46  -6.026  17.680 -11.260
    6    HG3  MET  46           HG3      MET  46  -4.673  18.146 -10.236
    7    HE3  MET  46           HE1      MET  46  -4.999  18.673 -14.406
    8    HE2  MET  46           HE2      MET  46  -6.233  19.889 -14.094
    9    HE1  MET  46           HE3      MET  46  -6.423  18.264 -13.440

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ALA  47           H        ALA  47  -1.819  14.921 -11.521
    2    HA   ALA  47           HA       ALA  47  -2.181  13.192 -13.728
    3    HB3  ALA  47           HB1      ALA  47   0.009  14.048 -13.368
    4    HB2  ALA  47           HB2      ALA  47   0.120  12.319 -13.028
    5    HB1  ALA  47           HB3      ALA  47   0.039  13.476 -11.699

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU  48           H        LEU  48  -1.939  12.563 -10.251
    2    HA   LEU  48           HA       LEU  48  -2.078   9.725 -10.402
    3    HB2  LEU  48           HB2      LEU  48  -2.823  11.661  -8.198
    4    HB3  LEU  48           HB3      LEU  48  -2.758   9.910  -7.991
    5    HG   LEU  48           HG       LEU  48  -0.427  11.569  -8.982
    6   HD13  LEU  48          HD11      LEU  48  -0.709  12.351  -6.795
    7   HD12  LEU  48          HD12      LEU  48   0.433  11.025  -6.586
    8   HD11  LEU  48          HD13      LEU  48  -1.271  10.791  -6.197
    9   HD22  LEU  48          HD21      LEU  48   0.040   9.374  -9.614
   10   HD21  LEU  48          HD22      LEU  48  -0.848   8.677  -8.260
   11   HD23  LEU  48          HD23      LEU  48   0.735   9.406  -7.994

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ASN  49           H        ASN  49  -4.503  12.257 -10.020
    2    HA   ASN  49           HA       ASN  49  -6.718  10.629  -9.487
    3    HB2  ASN  49           HB2      ASN  49  -6.720  13.061  -9.179
    4    HB3  ASN  49           HB3      ASN  49  -6.581  13.300 -10.916
    5   HD21  ASN  49          HD21      ASN  49  -8.636  14.452 -10.961
    6   HD22  ASN  49          HD22      ASN  49 -10.107  13.625 -10.796

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLU  50           H        GLU  50  -5.404  11.796 -12.571
    2    HA   GLU  50           HA       GLU  50  -7.369  10.567 -14.224
    3    HB2  GLU  50           HB2      GLU  50  -5.871  12.360 -15.036
    4    HB3  GLU  50           HB3      GLU  50  -4.495  11.266 -14.887
    5    HG2  GLU  50           HG2      GLU  50  -5.484   9.741 -16.524
    6    HG3  GLU  50           HG3      GLU  50  -6.928  10.742 -16.622

  No H/Q in entry =           6
  In of MODEL   24
    1    H    ALA  51           H        ALA  51  -4.221   9.528 -12.998
    2    HA   ALA  51           HA       ALA  51  -4.113   7.069 -14.408
    3    HB2  ALA  51           HB1      ALA  51  -2.143   6.752 -13.297
    4    HB1  ALA  51           HB2      ALA  51  -2.832   7.191 -11.734
    5    HB3  ALA  51           HB3      ALA  51  -2.351   8.450 -12.870

  No H/Q in entry =           5
  In of MODEL   24
    1    H    HIS  52           H        HIS  52  -5.290   7.929 -11.168
    2    HA   HIS  52           HA       HIS  52  -6.021   5.333 -10.333
    3    HB2  HIS  52           HB2      HIS  52  -5.858   7.315  -8.839
    4    HB3  HIS  52           HB3      HIS  52  -7.321   7.960  -9.581
    5    HD1  HIS  52           HD1      HIS  52  -9.560   6.657  -9.147
    6    HD2  HIS  52           HD2      HIS  52  -6.288   5.202  -7.013
    7    HE1  HIS  52           HE1      HIS  52 -10.493   5.117  -7.366
    8    HE2  HIS  52           HE2      HIS  52  -8.510   4.222  -6.056

  No H/Q in entry =           8
  In of MODEL   24
    1    H    LEU  53           H        LEU  53  -7.792   7.814 -12.138
    2    HA   LEU  53           HA       LEU  53 -10.318   6.563 -12.160
    3    HB2  LEU  53           HB2      LEU  53  -8.992   8.517 -14.028
    4    HB3  LEU  53           HB3      LEU  53 -10.600   7.877 -14.358
    5    HG   LEU  53           HG       LEU  53  -9.872   9.198 -11.723
    6   HD12  LEU  53          HD11      LEU  53 -11.229  10.432 -14.140
    7   HD11  LEU  53          HD12      LEU  53  -9.581  10.782 -13.616
    8   HD13  LEU  53          HD13      LEU  53 -10.946  11.222 -12.594
    9   HD22  LEU  53          HD21      LEU  53 -11.883   8.014 -11.389
   10   HD21  LEU  53          HD22      LEU  53 -12.421   8.279 -13.042
   11   HD23  LEU  53          HD23      LEU  53 -12.481   9.591 -11.882

  No H/Q in entry =          11
  In of MODEL   24
    1    H    VAL  54           H        VAL  54  -7.559   6.314 -14.381
    2    HA   VAL  54           HA       VAL  54  -8.801   4.558 -16.226
    3    HB   VAL  54           HB       VAL  54  -5.889   5.018 -15.529
    4   HG12  VAL  54          HG11      VAL  54  -5.647   3.922 -17.914
    5   HG11  VAL  54          HG12      VAL  54  -7.190   3.168 -17.517
    6   HG13  VAL  54          HG13      VAL  54  -5.784   2.893 -16.489
    7   HG22  VAL  54          HG21      VAL  54  -6.621   6.971 -16.584
    8   HG21  VAL  54          HG22      VAL  54  -7.823   6.125 -17.556
    9   HG23  VAL  54          HG23      VAL  54  -6.115   6.015 -17.977

  No H/Q in entry =           9
  In of MODEL   24
    1    H    GLN  55           H        GLN  55  -6.827   3.987 -13.314
    2    HA   GLN  55           HA       GLN  55  -6.783   1.169 -13.562
    3    HB2  GLN  55           HB2      GLN  55  -5.221   2.043 -12.037
    4    HB3  GLN  55           HB3      GLN  55  -6.426   3.032 -11.216
    5    HG2  GLN  55           HG2      GLN  55  -7.151   1.291  -9.897
    6    HG3  GLN  55           HG3      GLN  55  -6.939   0.096 -11.171
    7   HE21  GLN  55          HE21      GLN  55  -5.343  -1.379 -10.663
    8   HE22  GLN  55          HE22      GLN  55  -3.957  -1.048  -9.745

  No H/Q in entry =           8
  In of MODEL   24
    1    H    THR  56           H        THR  56  -9.086   3.375 -11.967
    2    HA   THR  56           HA       THR  56 -10.709   1.523 -10.680
    3    HB   THR  56           HB       THR  56 -11.553   4.037 -12.152
    4    HG1  THR  56           HG1      THR  56 -10.529   3.446  -9.619
    5   HG22  THR  56          HG21      THR  56 -13.479   3.929 -10.504
    6   HG21  THR  56          HG22      THR  56 -12.982   2.272 -10.155
    7   HG23  THR  56          HG23      THR  56 -13.513   2.713 -11.779

  No H/Q in entry =           7
  In of MODEL   24
    1    H    LYS  57           H        LYS  57 -10.874   2.598 -14.071
    2    HA   LYS  57           HA       LYS  57 -13.054   0.946 -14.831
    3    HB2  LYS  57           HB2      LYS  57 -12.135   2.879 -16.148
    4    HB3  LYS  57           HB3      LYS  57 -10.713   1.910 -16.508
    5    HG2  LYS  57           HG2      LYS  57 -12.082   0.265 -17.683
    6    HG3  LYS  57           HG3      LYS  57 -13.548   1.145 -17.263
    7    HD2  LYS  57           HD2      LYS  57 -12.747   3.096 -18.558
    8    HD3  LYS  57           HD3      LYS  57 -11.288   2.209 -18.992
    9    HE2  LYS  57           HE2      LYS  57 -12.653   0.498 -20.138
   10    HE3  LYS  57           HE3      LYS  57 -14.128   1.357 -19.697
   11    HZ2  LYS  57           HZ1      LYS  57 -11.945   2.343 -21.445
   12    HZ1  LYS  57           HZ2      LYS  57 -13.243   3.299 -20.911
   13    HZ3  LYS  57           HZ3      LYS  57 -13.529   1.952 -21.907

  No H/Q in entry =          13
  In of MODEL   24
    1    H    LEU  58           H        LEU  58  -9.558   0.456 -14.753
    2    HA   LEU  58           HA       LEU  58  -9.601  -2.065 -16.034
    3    HB2  LEU  58           HB2      LEU  58  -7.556  -0.802 -14.218
    4    HB3  LEU  58           HB3      LEU  58  -7.316  -2.331 -15.066
    5    HG   LEU  58           HG       LEU  58  -8.018   0.282 -16.442
    6   HD11  LEU  58          HD11      LEU  58  -5.397  -0.998 -15.731
    7   HD13  LEU  58          HD12      LEU  58  -5.863   0.702 -15.691
    8   HD12  LEU  58          HD13      LEU  58  -5.528  -0.080 -17.233
    9   HD22  LEU  58          HD21      LEU  58  -8.611  -1.276 -18.031
   10   HD21  LEU  58          HD22      LEU  58  -7.595  -2.538 -17.339
   11   HD23  LEU  58          HD23      LEU  58  -6.877  -1.280 -18.345

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  59           H        ILE  59 -10.426  -1.138 -12.791
    2    HA   ILE  59           HA       ILE  59 -10.127  -3.908 -11.832
    3    HB   ILE  59           HB       ILE  59  -9.655  -1.641 -10.439
    4   HG12  ILE  59          HG12      ILE  59 -11.061  -3.967  -9.111
    5   HG13  ILE  59          HG13      ILE  59  -9.420  -4.075  -9.694
    6   HG23  ILE  59          HG21      ILE  59 -11.484  -0.924  -9.133
    7   HG22  ILE  59          HG22      ILE  59 -12.439  -2.340  -9.510
    8   HG21  ILE  59          HG23      ILE  59 -12.187  -1.089 -10.725
    9   HD11  ILE  59          HD11      ILE  59 -10.411  -2.030  -7.720
   10   HD13  ILE  59          HD12      ILE  59  -8.750  -2.191  -8.273
   11   HD12  ILE  59          HD13      ILE  59  -9.483  -3.465  -7.297

  No H/Q in entry =          11
  In of MODEL   24
    1    H    GLU  60           H        GLU  60 -12.641  -1.552 -12.663
    2    HA   GLU  60           HA       GLU  60 -14.857  -3.029 -11.658
    3    HB2  GLU  60           HB2      GLU  60 -15.066  -0.671 -12.242
    4    HB3  GLU  60           HB3      GLU  60 -14.672  -1.022 -13.922
    5    HG2  GLU  60           HG2      GLU  60 -16.708  -2.449 -14.075
    6    HG3  GLU  60           HG3      GLU  60 -17.119  -2.001 -12.432

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLY  61           H        GLY  61 -13.165  -3.052 -14.763
    2    HA3  GLY  61           HA2      GLY  61 -14.910  -5.271 -15.655
    3    HA2  GLY  61           HA3      GLY  61 -14.040  -4.184 -16.732

  No H/Q in entry =           3
  In of MODEL   24
    1    H    ASP  62           H        ASP  62 -12.708  -5.646 -13.835
    2    HA   ASP  62           HA       ASP  62 -10.386  -6.560 -15.163
    3    HB2  ASP  62           HB2      ASP  62  -9.896  -7.650 -12.996
    4    HB3  ASP  62           HB3      ASP  62 -10.405  -5.978 -12.792

  No H/Q in entry =           4
  In of MODEL   24
    1    H    ALA  63           H        ALA  63 -13.420  -8.236 -14.324
    2    HA   ALA  63           HA       ALA  63 -12.602 -10.905 -14.753
    3    HB2  ALA  63           HB1      ALA  63 -14.803 -10.207 -13.794
    4    HB1  ALA  63           HB2      ALA  63 -14.993 -11.352 -15.122
    5    HB3  ALA  63           HB3      ALA  63 -15.289  -9.633 -15.389

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLY  64           H        GLY  64 -13.568 -12.210 -16.637
    2    HA3  GLY  64           HA2      GLY  64 -14.142 -12.089 -19.051
    3    HA2  GLY  64           HA3      GLY  64 -12.881 -10.869 -19.182

  No H/Q in entry =           3
  In of MODEL   24
    1    H    GLU  65           H        GLU  65 -10.967 -12.161 -17.473
    2    HA   GLU  65           HA       GLU  65  -9.722 -13.826 -19.393
    3    HB2  GLU  65           HB2      GLU  65  -9.073 -13.346 -16.485
    4    HB3  GLU  65           HB3      GLU  65  -8.041 -14.245 -17.598
    5    HG2  GLU  65           HG2      GLU  65  -7.146 -12.101 -17.774
    6    HG3  GLU  65           HG3      GLU  65  -8.294 -12.115 -19.112

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLY  66           H        GLY  66 -11.527 -14.500 -16.504
    2    HA3  GLY  66           HA2      GLY  66 -12.242 -17.129 -17.291
    3    HA2  GLY  66           HA3      GLY  66 -11.016 -17.176 -16.040

  No H/Q in entry =           3
  In of MODEL   24
    1    H    LYS  67           H        LYS  67 -12.699 -18.345 -14.889
    2    HA   LYS  67           HA       LYS  67 -15.167 -17.367 -14.141
    3    HB2  LYS  67           HB2      LYS  67 -13.285 -19.200 -12.662
    4    HB3  LYS  67           HB3      LYS  67 -14.978 -18.948 -12.218
    5    HG2  LYS  67           HG2      LYS  67 -15.685 -19.649 -14.473
    6    HG3  LYS  67           HG3      LYS  67 -14.001 -19.888 -14.933
    7    HD2  LYS  67           HD2      LYS  67 -13.769 -21.631 -13.204
    8    HD3  LYS  67           HD3      LYS  67 -15.452 -21.388 -12.733
    9    HE2  LYS  67           HE2      LYS  67 -16.185 -22.012 -15.008
   10    HE3  LYS  67           HE3      LYS  67 -14.504 -22.254 -15.483
   11    HZ2  LYS  67           HZ1      LYS  67 -16.180 -24.113 -14.348
   12    HZ1  LYS  67           HZ2      LYS  67 -15.112 -23.677 -13.102
   13    HZ3  LYS  67           HZ3      LYS  67 -14.505 -24.262 -14.577

  No H/Q in entry =          13
  In of MODEL   24
    1    H    MET  68           H        MET  68 -12.643 -17.607 -11.730
    2    HA   MET  68           HA       MET  68 -13.595 -15.143 -10.435
    3    HB2  MET  68           HB2      MET  68 -12.047 -17.506  -9.375
    4    HB3  MET  68           HB3      MET  68 -12.433 -16.066  -8.432
    5    HG2  MET  68           HG2      MET  68 -14.489 -17.827  -9.797
    6    HG3  MET  68           HG3      MET  68 -14.079 -17.909  -8.083
    7    HE3  MET  68           HE1      MET  68 -15.369 -14.941  -6.413
    8    HE2  MET  68           HE2      MET  68 -13.770 -14.766  -7.132
    9    HE1  MET  68           HE3      MET  68 -14.267 -16.325  -6.477

  No H/Q in entry =           9
  In of MODEL   24
    1    H    LYS  69           H        LYS  69 -11.019 -16.079 -12.391
    2    HA   LYS  69           HA       LYS  69  -8.954 -14.630 -10.995
    3    HB2  LYS  69           HB2      LYS  69  -8.453 -16.661 -12.283
    4    HB3  LYS  69           HB3      LYS  69  -8.909 -15.826 -13.770
    5    HG2  LYS  69           HG2      LYS  69  -7.141 -14.170 -13.423
    6    HG3  LYS  69           HG3      LYS  69  -6.723 -14.905 -11.877
    7    HD2  LYS  69           HD2      LYS  69  -6.114 -17.000 -13.038
    8    HD3  LYS  69           HD3      LYS  69  -6.512 -16.252 -14.586
    9    HE2  LYS  69           HE2      LYS  69  -4.442 -15.156 -12.662
   10    HE3  LYS  69           HE3      LYS  69  -4.059 -16.184 -14.042
   11    HZ1  LYS  69           HZ1      LYS  69  -5.585 -14.322 -15.191
   12    HZ3  LYS  69           HZ2      LYS  69  -3.891 -14.231 -15.100
   13    HZ2  LYS  69           HZ3      LYS  69  -4.852 -13.398 -13.972

  No H/Q in entry =          13
  In of MODEL   24
    1    H    VAL  70           H        VAL  70  -7.708 -12.844 -11.747
    2    HA   VAL  70           HA       VAL  70  -9.106 -11.037 -13.638
    3    HB   VAL  70           HB       VAL  70  -8.399  -9.163 -12.179
    4   HG11  VAL  70          HG11      VAL  70 -10.649 -10.162 -11.941
    5   HG13  VAL  70          HG12      VAL  70 -10.044  -9.588 -10.387
    6   HG12  VAL  70          HG13      VAL  70 -10.011 -11.310 -10.765
    7   HG21  VAL  70          HG21      VAL  70  -7.247 -11.446 -10.581
    8   HG23  VAL  70          HG22      VAL  70  -7.786  -9.988  -9.751
    9   HG22  VAL  70          HG23      VAL  70  -6.516  -9.888 -10.968

  No H/Q in entry =           9
  In of MODEL   24
    1    H    SER  71           H        SER  71  -7.603  -9.265 -14.386
    2    HA   SER  71           HA       SER  71  -5.334 -10.332 -15.683
    3    HB2  SER  71           HB2      SER  71  -6.582  -8.308 -16.448
    4    HB3  SER  71           HB3      SER  71  -5.935  -7.426 -15.067
    5    HG   SER  71           HG       SER  71  -3.844  -8.453 -16.070

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU  72           H        LEU  72  -3.332 -10.650 -15.011
    2    HA   LEU  72           HA       LEU  72  -2.624 -10.438 -12.296
    3    HB2  LEU  72           HB2      LEU  72  -0.965 -10.906 -14.769
    4    HB3  LEU  72           HB3      LEU  72  -0.312 -10.981 -13.135
    5    HG   LEU  72           HG       LEU  72  -2.690 -12.636 -14.039
    6   HD13  LEU  72          HD11      LEU  72  -0.700 -13.231 -15.370
    7   HD12  LEU  72          HD12      LEU  72  -1.085 -14.510 -14.220
    8   HD11  LEU  72          HD13      LEU  72   0.244 -13.399 -13.888
    9   HD23  LEU  72          HD21      LEU  72  -1.729 -14.057 -12.060
   10   HD22  LEU  72          HD22      LEU  72  -2.680 -12.633 -11.667
   11   HD21  LEU  72          HD23      LEU  72  -0.922 -12.565 -11.592

  No H/Q in entry =          11
  In of MODEL   24
    1    H    VAL  73           H        VAL  73  -1.857  -8.445 -15.080
    2    HA   VAL  73           HA       VAL  73   0.087  -6.776 -13.972
    3    HB   VAL  73           HB       VAL  73  -0.288  -5.344 -15.831
    4   HG11  VAL  73          HG11      VAL  73   0.498  -7.757 -16.223
    5   HG13  VAL  73          HG12      VAL  73  -0.118  -6.890 -17.630
    6   HG12  VAL  73          HG13      VAL  73  -1.133  -8.075 -16.810
    7   HG22  VAL  73          HG21      VAL  73  -2.547  -4.821 -15.920
    8   HG21  VAL  73          HG22      VAL  73  -3.049  -6.493 -15.679
    9   HG23  VAL  73          HG23      VAL  73  -2.444  -5.972 -17.253

  No H/Q in entry =           9
  In of MODEL   24
    1    H    LEU  74           H        LEU  74  -3.315  -6.830 -13.434
    2    HA   LEU  74           HA       LEU  74  -3.890  -4.161 -12.835
    3    HB2  LEU  74           HB2      LEU  74  -5.648  -5.795 -13.013
    4    HB3  LEU  74           HB3      LEU  74  -4.980  -6.728 -11.676
    5    HG   LEU  74           HG       LEU  74  -5.420  -4.844 -10.138
    6   HD13  LEU  74          HD11      LEU  74  -5.255  -2.910 -11.497
    7   HD12  LEU  74          HD12      LEU  74  -6.974  -3.030 -11.124
    8   HD11  LEU  74          HD13      LEU  74  -6.373  -3.556 -12.698
    9   HD21  LEU  74          HD21      LEU  74  -7.157  -6.649 -11.026
   10   HD23  LEU  74          HD22      LEU  74  -7.952  -5.202 -11.607
   11   HD22  LEU  74          HD23      LEU  74  -7.633  -5.383  -9.899

  No H/Q in entry =          11
  In of MODEL   24
    1    H    VAL  75           H        VAL  75  -2.908  -6.757 -10.658
    2    HA   VAL  75           HA       VAL  75  -2.696  -5.201  -8.318
    3    HB   VAL  75           HB       VAL  75  -1.246  -7.728  -9.093
    4   HG11  VAL  75          HG11      VAL  75  -1.424  -6.245  -6.431
    5   HG13  VAL  75          HG12      VAL  75   0.032  -6.525  -7.375
    6   HG12  VAL  75          HG13      VAL  75  -0.797  -7.878  -6.625
    7   HG23  VAL  75          HG21      VAL  75  -2.921  -8.674  -7.461
    8   HG22  VAL  75          HG22      VAL  75  -3.658  -8.005  -8.917
    9   HG21  VAL  75          HG23      VAL  75  -3.694  -7.089  -7.409

  No H/Q in entry =           9
  In of MODEL   24
    1    H    GLU  76           H        GLU  76  -0.286  -6.013 -10.837
    2    HA   GLU  76           HA       GLU  76   1.916  -4.700  -9.671
    3    HB2  GLU  76           HB2      GLU  76   2.036  -6.201 -11.677
    4    HB3  GLU  76           HB3      GLU  76   1.253  -4.949 -12.628
    5    HG2  GLU  76           HG2      GLU  76   3.137  -3.420 -12.204
    6    HG3  GLU  76           HG3      GLU  76   3.937  -4.634 -11.223

  No H/Q in entry =           6
  In of MODEL   24
    1    H    ALA  77           H        ALA  77  -0.581  -3.463 -11.880
    2    HA   ALA  77           HA       ALA  77   0.457  -0.835 -12.060
    3    HB1  ALA  77           HB1      ALA  77  -1.250  -1.774 -13.605
    4    HB2  ALA  77           HB2      ALA  77  -1.745  -0.226 -12.919
    5    HB3  ALA  77           HB3      ALA  77  -2.431  -1.725 -12.294

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLN  78           H        GLN  78  -1.852  -2.342  -9.857
    2    HA   GLN  78           HA       GLN  78  -2.627  -0.005  -8.470
    3    HB2  GLN  78           HB2      GLN  78  -3.767  -2.256  -8.388
    4    HB3  GLN  78           HB3      GLN  78  -2.453  -2.816  -7.356
    5    HG2  GLN  78           HG2      GLN  78  -2.979  -1.062  -5.719
    6    HG3  GLN  78           HG3      GLN  78  -4.283  -0.478  -6.752
    7   HE21  GLN  78          HE21      GLN  78  -4.303  -3.760  -7.208
    8   HE22  GLN  78          HE22      GLN  78  -5.416  -4.205  -6.005

  No H/Q in entry =           8
  In of MODEL   24
    1    H    LEU  79           H        LEU  79   0.010  -2.304  -7.994
    2    HA   LEU  79           HA       LEU  79   0.986  -1.415  -5.534
    3    HB2  LEU  79           HB2      LEU  79   1.828  -3.442  -6.589
    4    HB3  LEU  79           HB3      LEU  79   2.498  -2.507  -7.922
    5    HG   LEU  79           HG       LEU  79   4.064  -1.388  -6.413
    6   HD13  LEU  79          HD11      LEU  79   3.051  -1.118  -4.353
    7   HD12  LEU  79          HD12      LEU  79   4.104  -2.484  -3.997
    8   HD11  LEU  79          HD13      LEU  79   2.396  -2.756  -4.336
    9   HD23  LEU  79          HD21      LEU  79   5.233  -3.553  -5.494
   10   HD22  LEU  79          HD22      LEU  79   5.044  -3.357  -7.234
   11   HD21  LEU  79          HD23      LEU  79   3.942  -4.405  -6.344

  No H/Q in entry =          11
  In of MODEL   24
    1    H    HIS  80           H        HIS  80   1.895  -0.325  -8.806
    2    HA   HIS  80           HA       HIS  80   3.730   1.635  -7.880
    3    HB2  HIS  80           HB2      HIS  80   2.445   0.952 -10.468
    4    HB3  HIS  80           HB3      HIS  80   3.066   2.595 -10.300
    5    HD1  HIS  80           HD1      HIS  80   5.475   2.854 -10.807
    6    HD2  HIS  80           HD2      HIS  80   4.584  -1.038  -9.607
    7    HE1  HIS  80           HE1      HIS  80   7.645   1.541 -10.955
    8    HE2  HIS  80           HE2      HIS  80   7.113  -0.835 -10.226

  No H/Q in entry =           8
  In of MODEL   24
    1    H    LEU  81           H        LEU  81   0.335   1.847  -8.882
    2    HA   LEU  81           HA       LEU  81   0.103   4.645  -8.563
    3    HB2  LEU  81           HB2      LEU  81  -1.948   2.432  -8.489
    4    HB3  LEU  81           HB3      LEU  81  -2.374   4.142  -8.406
    5    HG   LEU  81           HG       LEU  81  -0.685   2.957 -10.627
    6   HD12  LEU  81          HD11      LEU  81  -2.903   3.307 -11.941
    7   HD11  LEU  81          HD12      LEU  81  -3.670   3.257 -10.354
    8   HD13  LEU  81          HD13      LEU  81  -2.745   1.872 -10.930
    9   HD23  LEU  81          HD21      LEU  81  -1.741   5.114 -11.739
   10   HD22  LEU  81          HD22      LEU  81  -0.328   5.267 -10.697
   11   HD21  LEU  81          HD23      LEU  81  -1.931   5.643 -10.069

  No H/Q in entry =          11
  In of MODEL   24
    1    H    MET  82           H        MET  82  -0.613   1.977  -6.309
    2    HA   MET  82           HA       MET  82  -1.654   3.587  -4.234
    3    HB2  MET  82           HB2      MET  82  -0.322   0.879  -4.255
    4    HB3  MET  82           HB3      MET  82  -0.899   1.619  -2.763
    5    HG2  MET  82           HG2      MET  82  -2.623   1.143  -5.214
    6    HG3  MET  82           HG3      MET  82  -2.571   0.074  -3.814
    7    HE3  MET  82           HE1      MET  82  -4.286   1.760  -1.017
    8    HE2  MET  82           HE2      MET  82  -2.550   2.011  -1.191
    9    HE1  MET  82           HE3      MET  82  -3.259   0.462  -1.644

  No H/Q in entry =           9
  In of MODEL   24
    1    H    THR  83           H        THR  83   1.634   2.449  -4.898
    2    HA   THR  83           HA       THR  83   2.854   3.542  -2.594
    3    HB   THR  83           HB       THR  83   4.957   3.449  -4.054
    4    HG1  THR  83           HG1      THR  83   4.722   2.919  -6.077
    5   HG22  THR  83          HG21      THR  83   4.474   0.797  -4.379
    6   HG21  THR  83          HG22      THR  83   3.183   1.201  -3.249
    7   HG23  THR  83          HG23      THR  83   4.865   1.520  -2.819

  No H/Q in entry =           7
  In of MODEL   24
    1    H    SER  84           H        SER  84   2.524   4.815  -5.901
    2    HA   SER  84           HA       SER  84   3.898   7.236  -5.446
    3    HB2  SER  84           HB2      SER  84   1.828   6.428  -7.476
    4    HB3  SER  84           HB3      SER  84   2.531   8.045  -7.452
    5    HG   SER  84           HG       SER  84   3.867   5.548  -7.725

  No H/Q in entry =           5
  In of MODEL   24
    1    H    MET  85           H        MET  85   0.391   6.534  -5.294
    2    HA   MET  85           HA       MET  85  -0.433   9.160  -4.708
    3    HB2  MET  85           HB2      MET  85  -1.982   7.377  -5.381
    4    HB3  MET  85           HB3      MET  85  -1.712   6.565  -3.840
    5    HG2  MET  85           HG2      MET  85  -2.576   8.538  -2.639
    6    HG3  MET  85           HG3      MET  85  -2.827   9.364  -4.175
    7    HE2  MET  85           HE1      MET  85  -4.909   6.999  -1.586
    8    HE1  MET  85           HE2      MET  85  -3.319   6.426  -2.086
    9    HE3  MET  85           HE3      MET  85  -4.764   5.579  -2.630

  No H/Q in entry =           9
  In of MODEL   24
    1    H    LEU  86           H        LEU  86   0.431   6.491  -2.549
    2    HA   LEU  86           HA       LEU  86  -0.098   7.811  -0.115
    3    HB2  LEU  86           HB2      LEU  86   0.330   5.332  -0.497
    4    HB3  LEU  86           HB3      LEU  86   2.044   5.734  -0.583
    5    HG   LEU  86           HG       LEU  86   1.723   6.908   1.679
    6   HD11  LEU  86          HD11      LEU  86  -0.980   6.183   1.193
    7   HD13  LEU  86          HD12      LEU  86  -0.311   6.925   2.645
    8   HD12  LEU  86          HD13      LEU  86  -0.430   5.170   2.531
    9   HD23  LEU  86          HD21      LEU  86   1.245   3.923   1.809
   10   HD22  LEU  86          HD22      LEU  86   2.257   4.920   2.852
   11   HD21  LEU  86          HD23      LEU  86   2.764   4.581   1.197

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ALA  87           H        ALA  87   2.890   7.461  -1.984
    2    HA   ALA  87           HA       ALA  87   4.608   8.849  -0.253
    3    HB3  ALA  87           HB1      ALA  87   4.703   7.826  -2.956
    4    HB2  ALA  87           HB2      ALA  87   6.036   8.138  -1.848
    5    HB1  ALA  87           HB3      ALA  87   5.450   9.425  -2.900

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ARG  88           H        ARG  88   2.697  10.008  -2.990
    2    HA   ARG  88           HA       ARG  88   3.517  12.685  -2.877
    3    HB2  ARG  88           HB2      ARG  88   2.254  11.547  -4.738
    4    HB3  ARG  88           HB3      ARG  88   0.794  11.719  -3.765
    5    HG2  ARG  88           HG2      ARG  88   1.857  14.282  -3.684
    6    HG3  ARG  88           HG3      ARG  88   2.282  13.755  -5.310
    7    HD2  ARG  88           HD2      ARG  88   0.147  13.869  -6.021
    8    HD3  ARG  88           HD3      ARG  88  -0.463  13.031  -4.594
    9    HE   ARG  88           HE       ARG  88  -0.602  15.811  -5.022
   10   HH21  ARG  88          HH11      ARG  88  -1.117  17.155  -3.292
   11   HH22  ARG  88          HH12      ARG  88  -0.840  16.618  -1.671
   12   HH11  ARG  88          HH21      ARG  88   0.359  13.539  -2.634
   13   HH12  ARG  88          HH22      ARG  88  -0.022  14.565  -1.299

  No H/Q in entry =          13
  In of MODEL   24
    1    H    GLU  89           H        GLU  89   0.774  11.063  -1.248
    2    HA   GLU  89           HA       GLU  89  -0.300  13.398  -0.058
    3    HB2  GLU  89           HB2      GLU  89  -1.457  11.179  -0.144
    4    HB3  GLU  89           HB3      GLU  89  -0.351  10.608   1.105
    5    HG2  GLU  89           HG2      GLU  89  -1.150  12.326   2.654
    6    HG3  GLU  89           HG3      GLU  89  -2.182  13.011   1.402

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LEU  90           H        LEU  90   2.103  11.066   1.139
    2    HA   LEU  90           HA       LEU  90   2.465  12.312   3.667
    3    HB2  LEU  90           HB2      LEU  90   4.216  10.501   2.006
    4    HB3  LEU  90           HB3      LEU  90   4.635  11.015   3.645
    5    HG   LEU  90           HG       LEU  90   1.980   9.715   2.972
    6   HD12  LEU  90          HD11      LEU  90   3.077   7.652   3.994
    7   HD11  LEU  90          HD12      LEU  90   4.616   8.480   3.759
    8   HD13  LEU  90          HD13      LEU  90   3.605   8.086   2.367
    9   HD22  LEU  90          HD21      LEU  90   1.720  10.650   5.090
   10   HD21  LEU  90          HD22      LEU  90   3.433  10.513   5.483
   11   HD23  LEU  90          HD23      LEU  90   2.400   9.085   5.529

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  91           H        ILE  91   4.095  12.656   0.548
    2    HA   ILE  91           HA       ILE  91   6.100  14.452   1.394
    3    HB   ILE  91           HB       ILE  91   4.796  13.978  -1.292
    4   HG12  ILE  91          HG12      ILE  91   7.613  13.441  -0.299
    5   HG13  ILE  91          HG13      ILE  91   6.308  12.268  -0.141
    6   HG22  ILE  91          HG21      ILE  91   7.047  15.281  -1.971
    7   HG21  ILE  91          HG22      ILE  91   6.743  16.092  -0.434
    8   HG23  ILE  91          HG23      ILE  91   5.529  16.140  -1.711
    9   HD13  ILE  91          HD11      ILE  91   6.143  11.941  -2.448
   10   HD12  ILE  91          HD12      ILE  91   7.880  12.152  -2.224
   11   HD11  ILE  91          HD13      ILE  91   6.898  13.492  -2.821

  No H/Q in entry =          11
  In of MODEL   24
    1    H    THR  92           H        THR  92   2.753  14.945   0.365
    2    HA   THR  92           HA       THR  92   2.780  17.768   0.296
    3    HB   THR  92           HB       THR  92   0.571  15.817   0.988
    4    HG1  THR  92           HG1      THR  92   0.885  15.626  -1.095
    5   HG22  THR  92          HG21      THR  92  -0.784  18.003   0.251
    6   HG21  THR  92          HG22      THR  92   0.619  18.803   0.954
    7   HG23  THR  92          HG23      THR  92  -0.349  17.703   1.933

  No H/Q in entry =           7
  In of MODEL   24
    1    H    GLU  93           H        GLU  93   2.172  15.487   2.953
    2    HA   GLU  93           HA       GLU  93   1.665  17.406   4.962
    3    HB2  GLU  93           HB2      GLU  93   2.924  14.658   5.215
    4    HB3  GLU  93           HB3      GLU  93   2.243  15.602   6.540
    5    HG2  GLU  93           HG2      GLU  93   0.631  14.848   4.094
    6    HG3  GLU  93           HG3      GLU  93   0.704  13.828   5.526

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LEU  94           H        LEU  94   4.649  15.864   3.836
    2    HA   LEU  94           HA       LEU  94   6.410  16.984   5.731
    3    HB2  LEU  94           HB2      LEU  94   6.810  16.000   2.905
    4    HB3  LEU  94           HB3      LEU  94   8.146  16.635   3.861
    5    HG   LEU  94           HG       LEU  94   6.358  14.477   4.992
    6   HD11  LEU  94          HD11      LEU  94   8.462  14.204   2.874
    7   HD13  LEU  94          HD12      LEU  94   6.996  13.259   3.130
    8   HD12  LEU  94          HD13      LEU  94   8.410  12.982   4.146
    9   HD23  LEU  94          HD21      LEU  94   8.530  13.902   6.159
   10   HD22  LEU  94          HD22      LEU  94   7.891  15.494   6.567
   11   HD21  LEU  94          HD23      LEU  94   9.234  15.344   5.433

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  95           H        ILE  95   5.312  18.167   2.571
    2    HA   ILE  95           HA       ILE  95   6.929  20.494   2.514
    3    HB   ILE  95           HB       ILE  95   4.281  19.857   1.194
    4   HG12  ILE  95          HG12      ILE  95   7.082  20.137   0.073
    5   HG13  ILE  95          HG13      ILE  95   6.400  18.598   0.589
    6   HG21  ILE  95          HG21      ILE  95   6.079  22.289   0.977
    7   HG23  ILE  95          HG22      ILE  95   4.350  22.256   1.323
    8   HG22  ILE  95          HG23      ILE  95   4.935  21.839  -0.288
    9   HD13  ILE  95          HD11      ILE  95   4.850  18.547  -1.150
   10   HD12  ILE  95          HD12      ILE  95   6.219  19.337  -1.932
   11   HD11  ILE  95          HD13      ILE  95   4.861  20.299  -1.351

  No H/Q in entry =          11
  In of MODEL   24
    1    H    GLU  96           H        GLU  96   3.661  19.908   3.791
    2    HA   GLU  96           HA       GLU  96   3.087  22.569   4.530
    3    HB2  GLU  96           HB2      GLU  96   1.379  20.818   4.537
    4    HB3  GLU  96           HB3      GLU  96   2.216  19.979   5.840
    5    HG2  GLU  96           HG2      GLU  96   1.211  21.286   7.399
    6    HG3  GLU  96           HG3      GLU  96   1.780  22.747   6.601

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LEU  97           H        LEU  97   4.870  19.988   6.174
    2    HA   LEU  97           HA       LEU  97   5.239  21.337   8.643
    3    HB2  LEU  97           HB2      LEU  97   6.742  19.134   7.245
    4    HB3  LEU  97           HB3      LEU  97   7.336  19.812   8.759
    5    HG   LEU  97           HG       LEU  97   4.508  18.773   8.434
    6   HD12  LEU  97          HD11      LEU  97   5.401  16.746   9.658
    7   HD11  LEU  97          HD12      LEU  97   7.026  17.345   9.322
    8   HD13  LEU  97          HD13      LEU  97   5.956  16.904   7.991
    9   HD23  LEU  97          HD21      LEU  97   4.939  18.478  11.002
   10   HD22  LEU  97          HD22      LEU  97   4.594  20.094  10.390
   11   HD21  LEU  97          HD23      LEU  97   6.255  19.623  10.747

  No H/Q in entry =          11
  In of MODEL   24
    1    H    HIS  98           H        HIS  98   7.128  21.307   5.629
    2    HA   HIS  98           HA       HIS  98   9.307  22.847   6.537
    3    HB2  HIS  98           HB2      HIS  98   8.025  22.609   3.804
    4    HB3  HIS  98           HB3      HIS  98   9.483  23.560   4.100
    5    HD1  HIS  98           HD1      HIS  98   8.201  20.014   4.123
    6    HD2  HIS  98           HD2      HIS  98  11.820  22.040   4.564
    7    HE1  HIS  98           HE1      HIS  98  10.021  18.248   4.083
    8    HE2  HIS  98           HE2      HIS  98  12.229  19.461   4.352

  No H/Q in entry =           8
  In of MODEL   24
    1    H    GLU  99           H        GLU  99   6.110  23.742   5.339
    2    HA   GLU  99           HA       GLU  99   6.545  26.548   5.275
    3    HB2  GLU  99           HB2      GLU  99   4.650  25.413   4.137
    4    HB3  GLU  99           HB3      GLU  99   3.938  25.071   5.713
    5    HG2  GLU  99           HG2      GLU  99   3.802  27.467   6.205
    6    HG3  GLU  99           HG3      GLU  99   4.595  27.847   4.680

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LYS 100           H        LYS 100   5.355  24.344   7.797
    2    HA   LYS 100           HA       LYS 100   4.798  26.415   9.681
    3    HB2  LYS 100           HB2      LYS 100   5.312  23.454  10.039
    4    HB3  LYS 100           HB3      LYS 100   4.878  24.539  11.365
    5    HG2  LYS 100           HG2      LYS 100   2.833  25.214  10.103
    6    HG3  LYS 100           HG3      LYS 100   3.244  24.033   8.856
    7    HD2  LYS 100           HD2      LYS 100   3.120  22.220  10.522
    8    HD3  LYS 100           HD3      LYS 100   2.725  23.394  11.780
    9    HE2  LYS 100           HE2      LYS 100   0.693  24.053  10.502
   10    HE3  LYS 100           HE3      LYS 100   1.076  22.821   9.293
   11    HZ1  LYS 100           HZ1      LYS 100   0.779  22.169  12.174
   12    HZ3  LYS 100           HZ2      LYS 100   0.750  21.111  10.842
   13    HZ2  LYS 100           HZ3      LYS 100  -0.545  22.178  11.111

  No H/Q in entry =          13
  In of MODEL   24
    1    H    LEU 101           H        LEU 101   7.690  24.558   8.870
    2    HA   LEU 101           HA       LEU 101   9.291  25.372  11.082
    3    HB2  LEU 101           HB2      LEU 101   9.883  24.365   8.310
    4    HB3  LEU 101           HB3      LEU 101  11.192  25.007   9.298
    5    HG   LEU 101           HG       LEU 101   9.310  22.892  10.356
    6   HD12  LEU 101          HD11      LEU 101  11.337  21.353   9.765
    7   HD11  LEU 101          HD12      LEU 101  11.737  22.605   8.591
    8   HD13  LEU 101          HD13      LEU 101  10.191  21.763   8.490
    9   HD21  LEU 101          HD21      LEU 101  12.052  23.946  11.098
   10   HD23  LEU 101          HD22      LEU 101  11.473  22.387  11.678
   11   HD22  LEU 101          HD23      LEU 101  10.608  23.862  12.107

  No H/Q in entry =          11
  In of MODEL   24
    1    H    LYS 102           H        LYS 102   7.760  27.261   8.926
    2    HA   LYS 102           HA       LYS 102   7.886  29.551   8.628
    3    HB2  LYS 102           HB2      LYS 102   9.435  29.410  10.736
    4    HB3  LYS 102           HB3      LYS 102  10.745  29.575   9.584
    5    HG2  LYS 102           HG2      LYS 102   8.675  31.573  10.427
    6    HG3  LYS 102           HG3      LYS 102  10.394  31.797  10.186
    7    HD2  LYS 102           HD2      LYS 102   8.449  31.407   7.875
    8    HD3  LYS 102           HD3      LYS 102   8.860  32.980   8.541
    9    HE2  LYS 102           HE2      LYS 102  10.221  31.762   6.480
   10    HE3  LYS 102           HE3      LYS 102  10.858  33.059   7.491
   11    HZ2  LYS 102           HZ1      LYS 102  12.340  31.122   7.331
   12    HZ1  LYS 102           HZ2      LYS 102  11.153  30.166   8.069
   13    HZ3  LYS 102           HZ3      LYS 102  11.867  31.441   8.928

  No H/Q in entry =          13
  In of MODEL   24
    1    H    ALA 103           H        ALA 103  11.118  28.144   8.087
    2    HA   ALA 103           HA       ALA 103  12.123  29.494   6.013
    3    HB2  ALA 103           HB1      ALA 103  12.968  27.259   5.098
    4    HB1  ALA 103           HB2      ALA 103  12.049  26.508   6.400
    5    HB3  ALA 103           HB3      ALA 103  13.360  27.626   6.778

  No H/Q in entry =           5
  In of MODEL   24
    1    H1   LYS   3           H1       LYS   3 -31.734   5.813 -19.613
    2    H2   LYS   3           H3       LYS   3 -30.723   5.626 -20.964
    3    H3   LYS   3           H2       LYS   3 -32.058   4.599 -20.755
    4    HA   LYS   3           HA       LYS   3 -30.980   3.233 -19.387
    5    HB2  LYS   3           HB2      LYS   3 -28.783   4.821 -20.658
    6    HB3  LYS   3           HB3      LYS   3 -28.391   3.598 -19.449
    7    HG2  LYS   3           HG2      LYS   3 -29.706   1.969 -20.858
    8    HG3  LYS   3           HG3      LYS   3 -29.727   3.209 -22.111
    9    HD2  LYS   3           HD2      LYS   3 -27.242   3.246 -22.046
   10    HD3  LYS   3           HD3      LYS   3 -27.287   1.907 -20.899
   11    HE2  LYS   3           HE2      LYS   3 -28.701   0.695 -22.661
   12    HE3  LYS   3           HE3      LYS   3 -28.148   1.943 -23.776
   13    HZ3  LYS   3           HZ1      LYS   3 -26.277   0.836 -24.069
   14    HZ2  LYS   3           HZ2      LYS   3 -26.839  -0.401 -23.050
   15    HZ1  LYS   3           HZ3      LYS   3 -25.932   0.883 -22.407

  No H/Q in entry =          15
  In of MODEL   24
    1    H    LYS   4           H        LYS   4 -31.036   3.024 -17.331
    2    HA   LYS   4           HA       LYS   4 -30.456   5.300 -15.606
    3    HB2  LYS   4           HB2      LYS   4 -31.496   2.519 -14.998
    4    HB3  LYS   4           HB3      LYS   4 -31.362   3.833 -13.830
    5    HG2  LYS   4           HG2      LYS   4 -33.149   3.736 -16.266
    6    HG3  LYS   4           HG3      LYS   4 -33.652   3.706 -14.577
    7    HD2  LYS   4           HD2      LYS   4 -33.093   5.957 -14.238
    8    HD3  LYS   4           HD3      LYS   4 -32.043   6.004 -15.655
    9    HE2  LYS   4           HE2      LYS   4 -34.045   7.273 -16.090
   10    HE3  LYS   4           HE3      LYS   4 -34.031   5.829 -17.102
   11    HZ3  LYS   4           HZ1      LYS   4 -35.558   4.777 -15.595
   12    HZ2  LYS   4           HZ2      LYS   4 -36.198   6.254 -16.139
   13    HZ1  LYS   4           HZ3      LYS   4 -35.545   6.135 -14.575

  No H/Q in entry =          13
  In of MODEL   24
    1    H    HIS   5           H        HIS   5 -29.003   5.424 -14.003
    2    HA   HIS   5           HA       HIS   5 -26.615   3.744 -14.372
    3    HB2  HIS   5           HB2      HIS   5 -27.039   6.440 -13.085
    4    HB3  HIS   5           HB3      HIS   5 -25.504   5.576 -13.086
    5    HD1  HIS   5           HD1      HIS   5 -24.098   6.908 -14.628
    6    HD2  HIS   5           HD2      HIS   5 -27.847   6.112 -16.228
    7    HE1  HIS   5           HE1      HIS   5 -23.951   7.571 -17.058
    8    HE2  HIS   5           HE2      HIS   5 -26.236   7.072 -18.003

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ILE   6           H        ILE   6 -26.301   2.148 -13.101
    2    HA   ILE   6           HA       ILE   6 -27.306   2.274 -10.337
    3    HB   ILE   6           HB       ILE   6 -26.329  -0.092 -11.943
    4   HG12  ILE   6          HG12      ILE   6 -29.128   0.656 -11.084
    5   HG13  ILE   6          HG13      ILE   6 -28.486   0.905 -12.708
    6   HG23  ILE   6          HG21      ILE   6 -26.639  -1.420 -10.123
    7   HG22  ILE   6          HG22      ILE   6 -27.865  -0.365  -9.419
    8   HG21  ILE   6          HG23      ILE   6 -26.159   0.068  -9.306
    9   HD13  ILE   6          HD11      ILE   6 -28.818  -1.221 -13.275
   10   HD12  ILE   6          HD12      ILE   6 -29.841  -1.307 -11.840
   11   HD11  ILE   6          HD13      ILE   6 -28.155  -1.820 -11.754

  No H/Q in entry =          11
  In of MODEL   24
    1    H    TYR   7           H        TYR   7 -25.594   2.977  -9.020
    2    HA   TYR   7           HA       TYR   7 -22.828   2.200  -9.707
    3    HB2  TYR   7           HB2      TYR   7 -23.940   4.528  -8.161
    4    HB3  TYR   7           HB3      TYR   7 -22.228   4.112  -8.203
    5    HD1  TYR   7           HD1      TYR   7 -23.194   3.206 -11.328
    6    HD2  TYR   7           HD2      TYR   7 -22.745   6.742  -8.990
    7    HE1  TYR   7           HE1      TYR   7 -22.823   4.521 -13.377
    8    HE2  TYR   7           HE2      TYR   7 -22.416   8.060 -11.032
    9    HH   TYR   7           HH       TYR   7 -22.616   8.028 -13.267

  No H/Q in entry =           9
  In of MODEL   24
    1    H    LEU   8           H        LEU   8 -21.793   0.865  -8.412
    2    HA   LEU   8           HA       LEU   8 -22.909   0.225  -5.754
    3    HB2  LEU   8           HB2      LEU   8 -21.102  -1.280  -7.624
    4    HB3  LEU   8           HB3      LEU   8 -21.275  -1.724  -5.926
    5    HG   LEU   8           HG       LEU   8 -23.738  -2.026  -6.372
    6   HD13  LEU   8          HD11      LEU   8 -23.926  -0.756  -8.445
    7   HD12  LEU   8          HD12      LEU   8 -24.358  -2.440  -8.738
    8   HD11  LEU   8          HD13      LEU   8 -22.779  -1.835  -9.236
    9   HD23  LEU   8          HD21      LEU   8 -22.338  -3.938  -8.116
   10   HD22  LEU   8          HD22      LEU   8 -23.421  -4.210  -6.752
   11   HD21  LEU   8          HD23      LEU   8 -21.740  -3.767  -6.467

  No H/Q in entry =          11
  In of MODEL   24
    1    H    PHE   9           H        PHE   9 -21.676   0.661  -3.946
    2    HA   PHE   9           HA       PHE   9 -18.946   1.767  -4.416
    3    HB2  PHE   9           HB2      PHE   9 -21.042   2.656  -2.439
    4    HB3  PHE   9           HB3      PHE   9 -19.359   3.162  -2.371
    5    HD1  PHE   9           HD1      PHE   9 -18.397   4.587  -4.110
    6    HD2  PHE   9           HD2      PHE   9 -22.538   3.466  -4.196
    7    HE1  PHE   9           HE1      PHE   9 -18.832   6.325  -5.820
    8    HE2  PHE   9           HE2      PHE   9 -22.975   5.216  -5.900
    9    HZ   PHE   9           HZ       PHE   9 -21.120   6.641  -6.718

  No H/Q in entry =           9
  In of MODEL   24
    1    H    SER  10           H        SER  10 -17.310   0.879  -3.336
    2    HA   SER  10           HA       SER  10 -17.444  -0.114  -0.676
    3    HB2  SER  10           HB2      SER  10 -17.189  -2.456  -1.035
    4    HB3  SER  10           HB3      SER  10 -18.581  -1.960  -1.984
    5    HG   SER  10           HG       SER  10 -16.725  -3.305  -2.931

  No H/Q in entry =           5
  In of MODEL   24
    1    H    SER  11           H        SER  11 -15.443   0.148   0.136
    2    HA   SER  11           HA       SER  11 -13.322   1.134  -1.404
    3    HB2  SER  11           HB2      SER  11 -12.773  -0.233   1.188
    4    HB3  SER  11           HB3      SER  11 -12.153   1.296   0.562
    5    HG   SER  11           HG       SER  11 -14.647   1.743   0.688

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA  12           H        ALA  12 -14.350  -1.604  -2.249
    2    HA   ALA  12           HA       ALA  12 -11.703  -2.700  -2.774
    3    HB1  ALA  12           HB1      ALA  12 -13.818  -4.188  -1.237
    4    HB2  ALA  12           HB2      ALA  12 -12.100  -4.019  -0.874
    5    HB3  ALA  12           HB3      ALA  12 -12.619  -5.048  -2.208

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLY  13           H        GLY  13 -12.505  -1.706  -4.801
    2    HA3  GLY  13           HA2      GLY  13 -14.681  -2.483  -6.313
    3    HA2  GLY  13           HA3      GLY  13 -13.133  -1.984  -7.010

  No H/Q in entry =           3
  In of MODEL   24
    1    H    MET  14           H        MET  14 -11.618  -4.250  -5.957
    2    HA   MET  14           HA       MET  14 -11.884  -6.020  -8.096
    3    HB2  MET  14           HB2      MET  14  -9.866  -5.928  -6.626
    4    HB3  MET  14           HB3      MET  14 -10.753  -6.826  -5.395
    5    HG2  MET  14           HG2      MET  14  -9.605  -8.525  -6.533
    6    HG3  MET  14           HG3      MET  14 -11.168  -8.542  -7.350
    7    HE1  MET  14           HE1      MET  14  -7.610  -8.633  -7.641
    8    HE3  MET  14           HE2      MET  14  -7.572  -6.885  -7.422
    9    HE2  MET  14           HE3      MET  14  -7.075  -7.582  -8.962

  No H/Q in entry =           9
  In of MODEL   24
    1    H    SER  15           H        SER  15 -13.191  -6.475  -4.819
    2    HA   SER  15           HA       SER  15 -14.399  -9.006  -5.506
    3    HB2  SER  15           HB2      SER  15 -14.803  -7.208  -3.111
    4    HB3  SER  15           HB3      SER  15 -15.750  -8.669  -3.375
    5    HG   SER  15           HG       SER  15 -12.908  -8.476  -3.200

  No H/Q in entry =           5
  In of MODEL   24
    1    H    THR  16           H        THR  16 -15.620  -5.673  -5.224
    2    HA   THR  16           HA       THR  16 -18.373  -6.314  -5.834
    3    HB   THR  16           HB       THR  16 -16.944  -3.663  -6.236
    4    HG1  THR  16           HG1      THR  16 -16.701  -3.631  -4.179
    5   HG23  THR  16          HG21      THR  16 -19.063  -2.698  -6.174
    6   HG22  THR  16          HG22      THR  16 -19.774  -4.070  -5.305
    7   HG21  THR  16          HG23      THR  16 -19.388  -4.202  -7.027

  No H/Q in entry =           7
  In of MODEL   24
    1    H    SER  17           H        SER  17 -15.504  -5.557  -7.616
    2    HA   SER  17           HA       SER  17 -16.656  -4.809 -10.103
    3    HB2  SER  17           HB2      SER  17 -13.959  -5.990  -9.414
    4    HB3  SER  17           HB3      SER  17 -14.413  -5.540 -11.057
    5    HG   SER  17           HG       SER  17 -15.012  -3.445  -9.828

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU  18           H        LEU  18 -15.913  -7.957  -8.744
    2    HA   LEU  18           HA       LEU  18 -16.395  -9.417 -11.148
    3    HB2  LEU  18           HB2      LEU  18 -15.133 -10.378  -9.285
    4    HB3  LEU  18           HB3      LEU  18 -16.556 -10.267  -8.251
    5    HG   LEU  18           HG       LEU  18 -17.736 -11.817  -9.816
    6   HD12  LEU  18          HD11      LEU  18 -15.987 -13.180 -11.221
    7   HD11  LEU  18          HD12      LEU  18 -15.049 -11.690 -11.135
    8   HD13  LEU  18          HD13      LEU  18 -16.652 -11.682 -11.867
    9   HD22  LEU  18          HD21      LEU  18 -16.788 -13.761  -8.907
   10   HD21  LEU  18          HD22      LEU  18 -16.546 -12.482  -7.716
   11   HD23  LEU  18          HD23      LEU  18 -15.204 -12.999  -8.737

  No H/Q in entry =          11
  In of MODEL   24
    1    H    LEU  19           H        LEU  19 -18.449  -8.409  -8.419
    2    HA   LEU  19           HA       LEU  19 -20.833  -9.709  -9.307
    3    HB2  LEU  19           HB2      LEU  19 -20.649  -8.941  -7.032
    4    HB3  LEU  19           HB3      LEU  19 -20.420  -7.280  -7.574
    5    HG   LEU  19           HG       LEU  19 -22.755  -7.224  -8.349
    6   HD12  LEU  19          HD11      LEU  19 -24.267  -9.057  -7.550
    7   HD11  LEU  19          HD12      LEU  19 -22.829 -10.001  -7.165
    8   HD13  LEU  19          HD13      LEU  19 -23.161  -9.545  -8.834
    9   HD23  LEU  19          HD21      LEU  19 -22.410  -8.059  -5.474
   10   HD22  LEU  19          HD22      LEU  19 -23.751  -7.124  -6.135
   11   HD21  LEU  19          HD23      LEU  19 -22.124  -6.444  -6.123

  No H/Q in entry =          11
  In of MODEL   24
    1    H    VAL  20           H        VAL  20 -19.522  -6.447  -9.895
    2    HA   VAL  20           HA       VAL  20 -21.680  -5.485 -11.451
    3    HB   VAL  20           HB       VAL  20 -18.731  -4.714 -11.526
    4   HG12  VAL  20          HG11      VAL  20 -19.541  -2.654 -12.724
    5   HG11  VAL  20          HG12      VAL  20 -21.092  -3.462 -12.946
    6   HG13  VAL  20          HG13      VAL  20 -19.637  -4.129 -13.684
    7   HG23  VAL  20          HG21      VAL  20 -19.661  -2.634 -10.440
    8   HG22  VAL  20          HG22      VAL  20 -19.678  -4.098  -9.460
    9   HG21  VAL  20          HG23      VAL  20 -21.164  -3.532 -10.223

  No H/Q in entry =           9
  In of MODEL   24
    1    H    SER  21           H        SER  21 -18.799  -7.338 -12.515
    2    HA   SER  21           HA       SER  21 -19.570  -7.189 -15.268
    3    HB2  SER  21           HB2      SER  21 -18.018  -9.057 -15.646
    4    HB3  SER  21           HB3      SER  21 -17.271  -7.793 -14.673
    5    HG   SER  21           HG       SER  21 -17.394  -9.035 -12.921

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LYS  22           H        LYS  22 -20.522  -9.510 -12.771
    2    HA   LYS  22           HA       LYS  22 -21.951 -11.161 -14.653
    3    HB2  LYS  22           HB2      LYS  22 -22.322 -10.920 -11.665
    4    HB3  LYS  22           HB3      LYS  22 -22.988 -12.186 -12.693
    5    HG2  LYS  22           HG2      LYS  22 -20.043 -11.710 -12.253
    6    HG3  LYS  22           HG3      LYS  22 -21.011 -12.904 -11.389
    7    HD2  LYS  22           HD2      LYS  22 -21.527 -14.011 -13.530
    8    HD3  LYS  22           HD3      LYS  22 -20.511 -12.836 -14.366
    9    HE2  LYS  22           HE2      LYS  22 -18.554 -13.623 -13.112
   10    HE3  LYS  22           HE3      LYS  22 -19.564 -14.781 -12.247
   11    HZ2  LYS  22           HZ1      LYS  22 -18.262 -15.088 -14.707
   12    HZ1  LYS  22           HZ2      LYS  22 -19.936 -15.201 -14.975
   13    HZ3  LYS  22           HZ3      LYS  22 -19.186 -16.224 -13.846

  No H/Q in entry =          13
  In of MODEL   24
    1    H    MET  23           H        MET  23 -22.856  -8.344 -12.705
    2    HA   MET  23           HA       MET  23 -25.651  -8.569 -13.237
    3    HB2  MET  23           HB2      MET  23 -23.944  -6.177 -12.581
    4    HB3  MET  23           HB3      MET  23 -25.696  -6.103 -12.768
    5    HG2  MET  23           HG2      MET  23 -26.024  -7.486 -10.842
    6    HG3  MET  23           HG3      MET  23 -24.293  -7.803 -10.713
    7    HE2  MET  23           HE1      MET  23 -26.807  -4.327  -9.436
    8    HE1  MET  23           HE2      MET  23 -26.995  -5.264 -10.917
    9    HE3  MET  23           HE3      MET  23 -26.043  -3.778 -10.929

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ARG  24           H        ARG  24 -22.972  -6.932 -14.954
    2    HA   ARG  24           HA       ARG  24 -24.528  -5.659 -16.925
    3    HB2  ARG  24           HB2      ARG  24 -22.112  -5.139 -16.507
    4    HB3  ARG  24           HB3      ARG  24 -21.685  -6.689 -17.188
    5    HG2  ARG  24           HG2      ARG  24 -22.633  -5.978 -19.403
    6    HG3  ARG  24           HG3      ARG  24 -22.979  -4.382 -18.688
    7    HD2  ARG  24           HD2      ARG  24 -20.230  -5.712 -18.760
    8    HD3  ARG  24           HD3      ARG  24 -20.781  -4.476 -19.884
    9    HE   ARG  24           HE       ARG  24 -21.099  -3.191 -17.597
   10   HH21  ARG  24          HH11      ARG  24 -19.725  -1.417 -17.723
   11   HH22  ARG  24          HH12      ARG  24 -18.027  -1.661 -17.940
   12   HH11  ARG  24          HH21      ARG  24 -18.495  -5.109 -18.594
   13   HH12  ARG  24          HH22      ARG  24 -17.308  -3.850 -18.443

  No H/Q in entry =          13
  In of MODEL   24
    1    H    ALA  25           H        ALA  25 -23.220  -8.935 -16.741
    2    HA   ALA  25           HA       ALA  25 -23.781  -9.719 -19.408
    3    HB3  ALA  25           HB1      ALA  25 -22.977 -11.728 -18.769
    4    HB2  ALA  25           HB2      ALA  25 -24.044 -11.812 -17.367
    5    HB1  ALA  25           HB3      ALA  25 -22.538 -10.900 -17.275

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLN  26           H        GLN  26 -25.625  -9.953 -16.403
    2    HA   GLN  26           HA       GLN  26 -27.890 -11.253 -17.476
    3    HB2  GLN  26           HB2      GLN  26 -27.493  -9.555 -15.033
    4    HB3  GLN  26           HB3      GLN  26 -29.010 -10.353 -15.418
    5    HG2  GLN  26           HG2      GLN  26 -26.350 -11.677 -14.972
    6    HG3  GLN  26           HG3      GLN  26 -27.721 -11.685 -13.871
    7   HE21  GLN  26          HE21      GLN  26 -26.376 -13.737 -15.202
    8   HE22  GLN  26          HE22      GLN  26 -27.352 -14.816 -16.040

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ALA  27           H        ALA  27 -27.150  -7.823 -16.972
    2    HA   ALA  27           HA       ALA  27 -29.692  -6.847 -17.744
    3    HB1  ALA  27           HB1      ALA  27 -27.966  -5.469 -16.573
    4    HB3  ALA  27           HB2      ALA  27 -28.588  -4.691 -18.030
    5    HB2  ALA  27           HB3      ALA  27 -27.006  -5.470 -18.054

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLU  28           H        GLU  28 -26.914  -7.858 -19.627
    2    HA   GLU  28           HA       GLU  28 -27.888  -6.793 -22.120
    3    HB2  GLU  28           HB2      GLU  28 -25.479  -7.362 -21.497
    4    HB3  GLU  28           HB3      GLU  28 -25.928  -9.046 -21.755
    5    HG2  GLU  28           HG2      GLU  28 -24.813  -8.145 -23.689
    6    HG3  GLU  28           HG3      GLU  28 -26.488  -8.551 -24.062

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LYS  29           H        LYS  29 -27.891  -9.954 -20.562
    2    HA   LYS  29           HA       LYS  29 -29.096 -11.430 -22.624
    3    HB2  LYS  29           HB2      LYS  29 -28.007 -12.417 -20.642
    4    HB3  LYS  29           HB3      LYS  29 -29.323 -11.814 -19.637
    5    HG2  LYS  29           HG2      LYS  29 -30.898 -13.242 -20.763
    6    HG3  LYS  29           HG3      LYS  29 -29.657 -13.773 -21.895
    7    HD2  LYS  29           HD2      LYS  29 -28.464 -14.929 -20.189
    8    HD3  LYS  29           HD3      LYS  29 -29.424 -14.180 -18.916
    9    HE2  LYS  29           HE2      LYS  29 -30.042 -16.555 -19.359
   10    HE3  LYS  29           HE3      LYS  29 -31.382 -15.428 -19.576
   11    HZ1  LYS  29           HZ1      LYS  29 -30.794 -15.452 -22.001
   12    HZ3  LYS  29           HZ2      LYS  29 -31.440 -16.898 -21.387
   13    HZ2  LYS  29           HZ3      LYS  29 -29.772 -16.767 -21.669

  No H/Q in entry =          13
  In of MODEL   24
    1    H    TYR  30           H        TYR  30 -30.620  -9.487 -20.067
    2    HA   TYR  30           HA       TYR  30 -33.245 -10.044 -21.345
    3    HB2  TYR  30           HB2      TYR  30 -32.677  -8.943 -18.583
    4    HB3  TYR  30           HB3      TYR  30 -34.273  -9.269 -19.259
    5    HD1  TYR  30           HD1      TYR  30 -35.052 -11.600 -19.553
    6    HD2  TYR  30           HD2      TYR  30 -31.276 -10.721 -17.793
    7    HE1  TYR  30           HE1      TYR  30 -34.839 -13.943 -18.829
    8    HE2  TYR  30           HE2      TYR  30 -31.063 -13.050 -17.073
    9    HH   TYR  30           HH       TYR  30 -32.561 -15.462 -18.255

  No H/Q in entry =           9
  In of MODEL   24
    1    H    GLU  31           H        GLU  31 -31.189  -7.910 -22.063
    2    HA   GLU  31           HA       GLU  31 -31.231  -5.726 -22.817
    3    HB2  GLU  31           HB2      GLU  31 -34.078  -6.586 -23.377
    4    HB3  GLU  31           HB3      GLU  31 -33.310  -5.151 -24.055
    5    HG2  GLU  31           HG2      GLU  31 -31.751  -6.465 -25.279
    6    HG3  GLU  31           HG3      GLU  31 -32.241  -7.935 -24.440

  No H/Q in entry =           6
  In of MODEL   24
    1    H    VAL  32           H        VAL  32 -31.454  -5.723 -20.084
    2    HA   VAL  32           HA       VAL  32 -33.438  -3.741 -19.375
    3    HB   VAL  32           HB       VAL  32 -31.004  -4.648 -17.806
    4   HG12  VAL  32          HG11      VAL  32 -32.597  -3.974 -15.899
    5   HG11  VAL  32          HG12      VAL  32 -33.472  -3.079 -17.141
    6   HG13  VAL  32          HG13      VAL  32 -31.787  -2.689 -16.796
    7   HG21  VAL  32          HG21      VAL  32 -32.667  -6.443 -18.564
    8   HG23  VAL  32          HG22      VAL  32 -33.760  -5.714 -17.387
    9   HG22  VAL  32          HG23      VAL  32 -32.209  -6.367 -16.862

  No H/Q in entry =           9
  In of MODEL   24
    1    HA   PRO  33           HA       PRO  33 -30.566  -0.593 -20.928
    2    HB2  PRO  33           HB2      PRO  33 -32.204   1.535 -20.746
    3    HB3  PRO  33           HB3      PRO  33 -32.589   0.244 -21.885
    4    HG2  PRO  33           HG2      PRO  33 -33.605   0.613 -19.066
    5    HG3  PRO  33           HG3      PRO  33 -34.545   0.397 -20.543
    6    HD2  PRO  33           HD2      PRO  33 -33.983  -1.699 -18.940
    7    HD3  PRO  33           HD3      PRO  33 -34.019  -1.887 -20.693

  No H/Q in entry =           7
  In of MODEL   24
    1    H    VAL  34           H        VAL  34 -29.287  -1.127 -18.986
    2    HA   VAL  34           HA       VAL  34 -29.155   1.256 -17.260
    3    HB   VAL  34           HB       VAL  34 -28.504  -0.231 -15.364
    4   HG12  VAL  34          HG11      VAL  34 -30.864  -1.252 -15.107
    5   HG11  VAL  34          HG12      VAL  34 -31.214  -0.461 -16.642
    6   HG13  VAL  34          HG13      VAL  34 -30.727   0.501 -15.246
    7   HG21  VAL  34          HG21      VAL  34 -28.558  -2.199 -17.438
    8   HG23  VAL  34          HG22      VAL  34 -29.602  -2.665 -16.094
    9   HG22  VAL  34          HG23      VAL  34 -27.905  -2.288 -15.802

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ILE  35           H        ILE  35 -27.213   1.777 -16.389
    2    HA   ILE  35           HA       ILE  35 -24.827   0.624 -17.674
    3    HB   ILE  35           HB       ILE  35 -25.399   3.459 -16.774
    4   HG12  ILE  35          HG12      ILE  35 -24.325   2.294 -19.350
    5   HG13  ILE  35          HG13      ILE  35 -25.991   2.810 -19.085
    6   HG21  ILE  35          HG21      ILE  35 -22.751   2.088 -17.110
    7   HG23  ILE  35          HG22      ILE  35 -23.281   3.199 -15.847
    8   HG22  ILE  35          HG23      ILE  35 -22.920   3.806 -17.463
    9   HD11  ILE  35          HD11      ILE  35 -24.724   5.062 -18.402
   10   HD13  ILE  35          HD12      ILE  35 -25.227   4.702 -20.055
   11   HD12  ILE  35          HD13      ILE  35 -23.560   4.412 -19.556

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ILE  36           H        ILE  36 -23.549  -0.377 -16.097
    2    HA   ILE  36           HA       ILE  36 -24.044   0.118 -13.212
    3    HB   ILE  36           HB       ILE  36 -23.054  -2.495 -14.399
    4   HG12  ILE  36          HG12      ILE  36 -25.908  -1.879 -13.634
    5   HG13  ILE  36          HG13      ILE  36 -25.328  -1.771 -15.296
    6   HG23  ILE  36          HG21      ILE  36 -23.370  -3.411 -12.317
    7   HG22  ILE  36          HG22      ILE  36 -24.573  -2.211 -11.846
    8   HG21  ILE  36          HG23      ILE  36 -22.864  -1.777 -11.891
    9   HD13  ILE  36          HD11      ILE  36 -25.362  -3.983 -15.575
   10   HD12  ILE  36          HD12      ILE  36 -26.443  -3.969 -14.182
   11   HD11  ILE  36          HD13      ILE  36 -24.724  -4.296 -13.962

  No H/Q in entry =          11
  In of MODEL   24
    1    H    GLU  37           H        GLU  37 -22.311   0.813 -12.073
    2    HA   GLU  37           HA       GLU  37 -19.572   0.205 -12.991
    3    HB2  GLU  37           HB2      GLU  37 -20.642   2.913 -12.217
    4    HB3  GLU  37           HB3      GLU  37 -18.925   2.528 -12.334
    5    HG2  GLU  37           HG2      GLU  37 -19.137   2.146 -14.702
    6    HG3  GLU  37           HG3      GLU  37 -20.877   2.423 -14.615

  No H/Q in entry =           6
  In of MODEL   24
    1    H    ALA  38           H        ALA  38 -18.086   0.000 -11.304
    2    HA   ALA  38           HA       ALA  38 -19.144   0.027  -8.538
    3    HB1  ALA  38           HB1      ALA  38 -17.310  -1.760 -10.010
    4    HB3  ALA  38           HB2      ALA  38 -18.352  -2.103  -8.630
    5    HB2  ALA  38           HB3      ALA  38 -16.785  -1.333  -8.381

  No H/Q in entry =           5
  In of MODEL   24
    1    H    PHE  39           H        PHE  39 -17.987   1.259  -7.016
    2    HA   PHE  39           HA       PHE  39 -15.533   2.638  -7.852
    3    HB2  PHE  39           HB2      PHE  39 -18.038   3.945  -6.814
    4    HB3  PHE  39           HB3      PHE  39 -16.455   4.705  -6.681
    5    HD1  PHE  39           HD1      PHE  39 -15.111   4.850  -8.925
    6    HD2  PHE  39           HD2      PHE  39 -19.343   4.411  -8.634
    7    HE1  PHE  39           HE1      PHE  39 -15.354   5.789 -11.206
    8    HE2  PHE  39           HE2      PHE  39 -19.600   5.340 -10.907
    9    HZ   PHE  39           HZ       PHE  39 -17.609   6.003 -12.213

  No H/Q in entry =           9
  In of MODEL   24
    1    HA   PRO  40           HA       PRO  40 -14.579   1.802  -3.584
    2    HB2  PRO  40           HB2      PRO  40 -12.941   3.900  -2.898
    3    HB3  PRO  40           HB3      PRO  40 -12.411   2.632  -4.003
    4    HG2  PRO  40           HG2      PRO  40 -13.591   5.323  -4.672
    5    HG3  PRO  40           HG3      PRO  40 -12.114   4.587  -5.293
    6    HD2  PRO  40           HD2      PRO  40 -14.318   4.413  -6.722
    7    HD3  PRO  40           HD3      PRO  40 -13.277   2.999  -6.569

  No H/Q in entry =           7
  In of MODEL   24
    1    H    GLU  41           H        GLU  41 -15.272   2.671  -1.429
    2    HA   GLU  41           HA       GLU  41 -17.617   4.234  -1.377
    3    HB2  GLU  41           HB2      GLU  41 -17.592   3.949   0.931
    4    HB3  GLU  41           HB3      GLU  41 -16.707   2.537   0.350
    5    HG2  GLU  41           HG2      GLU  41 -15.558   3.345   2.259
    6    HG3  GLU  41           HG3      GLU  41 -14.585   3.762   0.848

  No H/Q in entry =           6
  In of MODEL   24
    1    H    THR  42           H        THR  42 -14.347   5.353  -1.370
    2    HA   THR  42           HA       THR  42 -14.863   7.847  -0.081
    3    HB   THR  42           HB       THR  42 -12.740   8.586  -1.140
    4    HG1  THR  42           HG1      THR  42 -12.160   6.126  -2.176
    5   HG23  THR  42          HG21      THR  42 -11.293   6.955  -0.050
    6   HG22  THR  42          HG22      THR  42 -12.597   5.766  -0.046
    7   HG21  THR  42          HG23      THR  42 -12.727   7.221   0.941

  No H/Q in entry =           7
  In of MODEL   24
    1    H    LEU  43           H        LEU  43 -15.679   6.800  -3.223
    2    HA   LEU  43           HA       LEU  43 -16.094   9.582  -4.106
    3    HB2  LEU  43           HB2      LEU  43 -16.303   6.968  -5.592
    4    HB3  LEU  43           HB3      LEU  43 -16.575   8.563  -6.293
    5    HG   LEU  43           HG       LEU  43 -13.931   7.536  -5.289
    6   HD11  LEU  43          HD11      LEU  43 -15.038   6.569  -7.453
    7   HD13  LEU  43          HD12      LEU  43 -13.347   7.069  -7.474
    8   HD12  LEU  43          HD13      LEU  43 -14.587   8.128  -8.142
    9   HD23  LEU  43          HD21      LEU  43 -13.215   9.593  -6.715
   10   HD22  LEU  43          HD22      LEU  43 -13.821   9.851  -5.078
   11   HD21  LEU  43          HD23      LEU  43 -14.875  10.129  -6.462

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ALA  44           H        ALA  44 -17.937   7.582  -2.328
    2    HA   ALA  44           HA       ALA  44 -20.392   7.334  -3.676
    3    HB2  ALA  44           HB1      ALA  44 -20.200   6.161  -1.614
    4    HB3  ALA  44           HB2      ALA  44 -21.389   7.426  -1.309
    5    HB1  ALA  44           HB3      ALA  44 -19.732   7.619  -0.739

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLY  45           H        GLY  45 -19.158  10.165  -2.043
    2    HA3  GLY  45           HA2      GLY  45 -21.680  11.524  -2.377
    3    HA2  GLY  45           HA3      GLY  45 -20.180  12.223  -1.768

  No H/Q in entry =           3
  In of MODEL   24
    1    H    GLU  46           H        GLU  46 -18.579  11.456  -4.073
    2    HA   GLU  46           HA       GLU  46 -19.339  13.685  -5.776
    3    HB2  GLU  46           HB2      GLU  46 -17.021  11.746  -5.844
    4    HB3  GLU  46           HB3      GLU  46 -17.224  13.088  -6.971
    5    HG2  GLU  46           HG2      GLU  46 -15.740  13.945  -5.437
    6    HG3  GLU  46           HG3      GLU  46 -17.287  14.553  -4.848

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LYS  47           H        LYS  47 -19.001  10.195  -6.322
    2    HA   LYS  47           HA       LYS  47 -20.093  10.433  -8.998
    3    HB2  LYS  47           HB2      LYS  47 -19.408   8.018  -7.315
    4    HB3  LYS  47           HB3      LYS  47 -19.933   7.960  -8.998
    5    HG2  LYS  47           HG2      LYS  47 -17.497   9.479  -8.152
    6    HG3  LYS  47           HG3      LYS  47 -17.445   7.759  -8.532
    7    HD2  LYS  47           HD2      LYS  47 -18.410   8.230 -10.741
    8    HD3  LYS  47           HD3      LYS  47 -18.414   9.950 -10.360
    9    HE2  LYS  47           HE2      LYS  47 -15.982   9.906 -10.127
   10    HE3  LYS  47           HE3      LYS  47 -15.978   8.184 -10.502
   11    HZ1  LYS  47           HZ1      LYS  47 -17.282   9.032 -12.588
   12    HZ3  LYS  47           HZ2      LYS  47 -15.585   9.034 -12.542
   13    HZ2  LYS  47           HZ3      LYS  47 -16.444  10.471 -12.254

  No H/Q in entry =          13
  In of MODEL   24
    1    H    GLY  48           H        GLY  48 -21.388   9.496  -5.887
    2    HA3  GLY  48           HA2      GLY  48 -23.691   8.192  -6.686
    3    HA2  GLY  48           HA3      GLY  48 -23.537   9.151  -5.214

  No H/Q in entry =           3
  In of MODEL   24
    1    H    GLN  49           H        GLN  49 -23.093  11.655  -6.703
    2    HA   GLN  49           HA       GLN  49 -25.714  12.611  -6.833
    3    HB2  GLN  49           HB2      GLN  49 -23.219  13.672  -8.144
    4    HB3  GLN  49           HB3      GLN  49 -24.738  14.544  -8.042
    5    HG2  GLN  49           HG2      GLN  49 -24.596  14.499  -5.604
    6    HG3  GLN  49           HG3      GLN  49 -23.089  13.605  -5.705
    7   HE21  GLN  49          HE21      GLN  49 -23.117  15.796  -4.362
    8   HE22  GLN  49          HE22      GLN  49 -22.269  17.125  -4.962

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ASN  50           H        ASN  50 -23.908  10.915  -9.265
    2    HA   ASN  50           HA       ASN  50 -25.827  11.737 -11.334
    3    HB2  ASN  50           HB2      ASN  50 -23.156  10.365 -11.594
    4    HB3  ASN  50           HB3      ASN  50 -24.221  10.769 -12.932
    5   HD21  ASN  50          HD21      ASN  50 -21.652  11.722 -11.273
    6   HD22  ASN  50          HD22      ASN  50 -21.517  13.379 -11.561

  No H/Q in entry =           6
  In of MODEL   24
    1    H    ALA  51           H        ALA  51 -25.683   9.315  -9.163
    2    HA   ALA  51           HA       ALA  51 -26.324   7.186 -11.063
    3    HB1  ALA  51           HB1      ALA  51 -25.671   5.822  -9.415
    4    HB3  ALA  51           HB2      ALA  51 -26.847   6.525  -8.307
    5    HB2  ALA  51           HB3      ALA  51 -25.248   7.250  -8.471

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ASP  52           H        ASP  52 -28.262   6.008 -10.974
    2    HA   ASP  52           HA       ASP  52 -30.555   7.685 -10.269
    3    HB2  ASP  52           HB2      ASP  52 -30.201   5.250 -12.016
    4    HB3  ASP  52           HB3      ASP  52 -31.791   5.874 -11.572

  No H/Q in entry =           4
  In of MODEL   24
    1    H    VAL  53           H        VAL  53 -28.789   4.866  -9.332
    2    HA   VAL  53           HA       VAL  53 -30.251   4.826  -6.825
    3    HB   VAL  53           HB       VAL  53 -31.541   3.144  -8.133
    4   HG11  VAL  53          HG11      VAL  53 -29.736   2.439  -9.666
    5   HG13  VAL  53          HG12      VAL  53 -30.494   1.070  -8.855
    6   HG12  VAL  53          HG13      VAL  53 -28.921   1.652  -8.315
    7   HG23  VAL  53          HG21      VAL  53 -30.613   1.167  -6.496
    8   HG22  VAL  53          HG22      VAL  53 -31.821   2.389  -6.098
    9   HG21  VAL  53          HG23      VAL  53 -30.129   2.649  -5.671

  No H/Q in entry =           9
  In of MODEL   24
    1    H    VAL  54           H        VAL  54 -28.926   4.419  -5.174
    2    HA   VAL  54           HA       VAL  54 -26.116   3.756  -5.788
    3    HB   VAL  54           HB       VAL  54 -27.305   5.394  -3.492
    4   HG11  VAL  54          HG11      VAL  54 -24.645   4.140  -3.806
    5   HG13  VAL  54          HG12      VAL  54 -25.446   4.728  -2.350
    6   HG12  VAL  54          HG13      VAL  54 -24.597   5.857  -3.404
    7   HG22  VAL  54          HG21      VAL  54 -26.548   7.290  -4.527
    8   HG21  VAL  54          HG22      VAL  54 -27.026   6.313  -5.914
    9   HG23  VAL  54          HG23      VAL  54 -25.328   6.426  -5.461

  No H/Q in entry =           9
  In of MODEL   24
    1    H    LEU  55           H        LEU  55 -25.415   1.852  -5.201
    2    HA   LEU  55           HA       LEU  55 -26.856   0.386  -3.081
    3    HB2  LEU  55           HB2      LEU  55 -25.218  -0.614  -5.399
    4    HB3  LEU  55           HB3      LEU  55 -25.931  -1.633  -4.147
    5    HG   LEU  55           HG       LEU  55 -27.445  -0.065  -6.225
    6   HD13  LEU  55          HD11      LEU  55 -27.028  -1.857  -7.500
    7   HD12  LEU  55          HD12      LEU  55 -27.939  -2.825  -6.342
    8   HD11  LEU  55          HD13      LEU  55 -26.192  -2.661  -6.173
    9   HD23  LEU  55          HD21      LEU  55 -28.634  -2.143  -4.443
   10   HD22  LEU  55          HD22      LEU  55 -29.405  -0.778  -5.252
   11   HD21  LEU  55          HD23      LEU  55 -28.411  -0.507  -3.822

  No H/Q in entry =          11
  In of MODEL   24
    1    H    LEU  56           H        LEU  56 -25.683  -0.197  -1.286
    2    HA   LEU  56           HA       LEU  56 -22.777   0.372  -1.298
    3    HB2  LEU  56           HB2      LEU  56 -24.580  -0.021   1.077
    4    HB3  LEU  56           HB3      LEU  56 -22.900   0.508   1.094
    5    HG   LEU  56           HG       LEU  56 -25.288   2.078   0.164
    6   HD11  LEU  56          HD11      LEU  56 -24.168   1.683   2.680
    7   HD13  LEU  56          HD12      LEU  56 -25.234   3.007   2.210
    8   HD12  LEU  56          HD13      LEU  56 -23.486   3.217   2.141
    9   HD23  LEU  56          HD21      LEU  56 -23.445   3.894   0.041
   10   HD22  LEU  56          HD22      LEU  56 -23.754   2.820  -1.324
   11   HD21  LEU  56          HD23      LEU  56 -22.388   2.513  -0.251

  No H/Q in entry =          11
  In of MODEL   24
    1    H    GLY  57           H        GLY  57 -21.307  -1.191  -0.805
    2    HA3  GLY  57           HA2      GLY  57 -22.067  -3.919  -1.092
    3    HA2  GLY  57           HA3      GLY  57 -20.480  -3.344  -0.584

  No H/Q in entry =           3
  In of MODEL   24
    1    HA   PRO  58           HA       PRO  58 -23.249  -4.665   3.066
    2    HB2  PRO  58           HB2      PRO  58 -22.416  -7.243   3.596
    3    HB3  PRO  58           HB3      PRO  58 -23.815  -6.885   2.585
    4    HG2  PRO  58           HG2      PRO  58 -21.035  -7.578   1.794
    5    HG3  PRO  58           HG3      PRO  58 -22.565  -8.107   1.095
    6    HD2  PRO  58           HD2      PRO  58 -21.058  -6.161  -0.056
    7    HD3  PRO  58           HD3      PRO  58 -22.818  -6.175  -0.170

  No H/Q in entry =           7
  In of MODEL   24
    1    H    GLN  59           H        GLN  59 -19.851  -4.920   2.473
    2    HA   GLN  59           HA       GLN  59 -19.114  -4.981   5.238
    3    HB2  GLN  59           HB2      GLN  59 -17.611  -4.081   2.782
    4    HB3  GLN  59           HB3      GLN  59 -16.920  -4.056   4.392
    5    HG2  GLN  59           HG2      GLN  59 -17.863  -6.476   2.867
    6    HG3  GLN  59           HG3      GLN  59 -16.200  -6.028   3.205
    7   HE21  GLN  59          HE21      GLN  59 -18.249  -8.004   3.988
    8   HE22  GLN  59          HE22      GLN  59 -18.117  -8.580   5.544

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ILE  60           H        ILE  60 -20.182  -2.420   3.103
    2    HA   ILE  60           HA       ILE  60 -19.459  -0.483   5.216
    3    HB   ILE  60           HB       ILE  60 -19.800   1.285   3.433
    4   HG12  ILE  60          HG12      ILE  60 -19.411  -0.881   1.407
    5   HG13  ILE  60          HG13      ILE  60 -21.039  -0.449   1.929
    6   HG22  ILE  60          HG21      ILE  60 -17.621  -0.614   2.680
    7   HG21  ILE  60          HG22      ILE  60 -17.603   0.292   4.193
    8   HG23  ILE  60          HG23      ILE  60 -17.618   1.149   2.653
    9   HD13  ILE  60          HD11      ILE  60 -20.815   0.938   0.103
   10   HD12  ILE  60          HD12      ILE  60 -19.077   1.131   0.327
   11   HD11  ILE  60          HD13      ILE  60 -20.202   2.002   1.368

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ALA  61           H        ALA  61 -21.818  -2.210   5.216
    2    HA   ALA  61           HA       ALA  61 -24.134  -0.664   4.790
    3    HB1  ALA  61           HB1      ALA  61 -25.270  -2.264   6.058
    4    HB2  ALA  61           HB2      ALA  61 -23.858  -2.603   7.059
    5    HB3  ALA  61           HB3      ALA  61 -23.907  -3.161   5.388

  No H/Q in entry =           5
  In of MODEL   24
    1    H    TYR  62           H        TYR  62 -21.943  -0.737   7.602
    2    HA   TYR  62           HA       TYR  62 -23.604   0.773   9.310
    3    HB2  TYR  62           HB2      TYR  62 -21.603   1.272  10.577
    4    HB3  TYR  62           HB3      TYR  62 -21.551  -0.410  10.050
    5    HD1  TYR  62           HD1      TYR  62 -19.871  -1.171   8.444
    6    HD2  TYR  62           HD2      TYR  62 -20.015   2.925   9.655
    7    HE1  TYR  62           HE1      TYR  62 -17.667  -0.791   7.406
    8    HE2  TYR  62           HE2      TYR  62 -17.797   3.301   8.618
    9    HH   TYR  62           HH       TYR  62 -16.373   2.373   7.026

  No H/Q in entry =           9
  In of MODEL   24
    1    H    MET  63           H        MET  63 -21.995   1.816   6.496
    2    HA   MET  63           HA       MET  63 -21.997   4.630   7.280
    3    HB2  MET  63           HB2      MET  63 -21.287   3.227   4.703
    4    HB3  MET  63           HB3      MET  63 -21.196   4.974   4.942
    5    HG2  MET  63           HG2      MET  63 -19.478   4.673   6.622
    6    HG3  MET  63           HG3      MET  63 -19.589   2.922   6.440
    7    HE1  MET  63           HE1      MET  63 -19.239   6.158   4.879
    8    HE3  MET  63           HE2      MET  63 -19.195   5.738   3.166
    9    HE2  MET  63           HE3      MET  63 -17.693   6.061   4.033

  No H/Q in entry =           9
  In of MODEL   24
    1    H    LEU  64           H        LEU  64 -24.443   2.663   6.237
    2    HA   LEU  64           HA       LEU  64 -25.720   4.074   4.194
    3    HB2  LEU  64           HB2      LEU  64 -26.471   1.894   5.038
    4    HB3  LEU  64           HB3      LEU  64 -26.986   2.661   6.540
    5    HG   LEU  64           HG       LEU  64 -28.742   3.855   5.338
    6   HD13  LEU  64          HD11      LEU  64 -28.459   4.183   3.117
    7   HD12  LEU  64          HD12      LEU  64 -29.009   2.518   2.915
    8   HD11  LEU  64          HD13      LEU  64 -27.284   2.875   2.994
    9   HD23  LEU  64          HD21      LEU  64 -29.093   1.043   4.498
   10   HD22  LEU  64          HD22      LEU  64 -30.150   2.088   5.446
   11   HD21  LEU  64          HD23      LEU  64 -28.737   1.350   6.198

  No H/Q in entry =          11
  In of MODEL   24
    1    HA   PRO  65           HA       PRO  65 -28.095   7.010   7.025
    2    HB2  PRO  65           HB2      PRO  65 -26.120   7.210   9.299
    3    HB3  PRO  65           HB3      PRO  65 -27.873   7.390   9.340
    4    HG2  PRO  65           HG2      PRO  65 -26.822   5.163  10.202
    5    HG3  PRO  65           HG3      PRO  65 -28.231   5.083   9.146
    6    HD2  PRO  65           HD2      PRO  65 -25.324   4.655   8.446
    7    HD3  PRO  65           HD3      PRO  65 -26.726   3.702   7.960

  No H/Q in entry =           7
  In of MODEL   24
    1    H    GLU  66           H        GLU  66 -24.542   7.153   7.125
    2    HA   GLU  66           HA       GLU  66 -24.401   9.976   6.809
    3    HB2  GLU  66           HB2      GLU  66 -22.457   7.796   6.101
    4    HB3  GLU  66           HB3      GLU  66 -22.102   9.516   5.950
    5    HG2  GLU  66           HG2      GLU  66 -22.349   9.799   8.326
    6    HG3  GLU  66           HG3      GLU  66 -22.781   8.099   8.501

  No H/Q in entry =           6
  In of MODEL   24
    1    H    ILE  67           H        ILE  67 -24.334   7.302   4.472
    2    HA   ILE  67           HA       ILE  67 -24.001   9.102   2.237
    3    HB   ILE  67           HB       ILE  67 -24.736   6.146   2.318
    4   HG12  ILE  67          HG12      ILE  67 -22.170   7.489   1.454
    5   HG13  ILE  67          HG13      ILE  67 -22.451   7.001   3.124
    6   HG21  ILE  67          HG21      ILE  67 -24.770   8.094   0.153
    7   HG23  ILE  67          HG22      ILE  67 -25.302   6.413   0.148
    8   HG22  ILE  67          HG23      ILE  67 -23.611   6.802  -0.158
    9   HD12  ILE  67          HD11      ILE  67 -21.918   5.330   0.723
   10   HD11  ILE  67          HD12      ILE  67 -22.906   4.661   2.019
   11   HD13  ILE  67          HD13      ILE  67 -21.265   5.207   2.356

  No H/Q in entry =          11
  In of MODEL   24
    1    H    GLN  68           H        GLN  68 -26.817   7.840   3.814
    2    HA   GLN  68           HA       GLN  68 -28.683   8.730   1.857
    3    HB2  GLN  68           HB2      GLN  68 -28.937   8.265   4.824
    4    HB3  GLN  68           HB3      GLN  68 -30.281   8.817   3.840
    5    HG2  GLN  68           HG2      GLN  68 -30.189   6.830   2.501
    6    HG3  GLN  68           HG3      GLN  68 -28.715   6.309   3.296
    7   HE21  GLN  68          HE21      GLN  68 -30.815   4.838   3.102
    8   HE22  GLN  68          HE22      GLN  68 -31.627   4.293   4.495

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ARG  69           H        ARG  69 -27.187  10.394   4.657
    2    HA   ARG  69           HA       ARG  69 -28.682  12.811   4.319
    3    HB2  ARG  69           HB2      ARG  69 -26.300  11.958   5.895
    4    HB3  ARG  69           HB3      ARG  69 -26.470  13.682   5.591
    5    HG2  ARG  69           HG2      ARG  69 -28.792  13.569   6.545
    6    HG3  ARG  69           HG3      ARG  69 -28.494  11.878   6.968
    7    HD2  ARG  69           HD2      ARG  69 -26.937  14.290   7.968
    8    HD3  ARG  69           HD3      ARG  69 -28.022  13.294   8.924
    9    HE   ARG  69           HE       ARG  69 -25.358  12.535   7.966
   10   HH21  ARG  69          HH11      ARG  69 -24.463  10.780   9.112
   11   HH22  ARG  69          HH12      ARG  69 -25.452   9.875  10.206
   12   HH11  ARG  69          HH21      ARG  69 -28.290  11.776   9.623
   13   HH12  ARG  69          HH22      ARG  69 -27.619  10.436  10.493

  No H/Q in entry =          13
  In of MODEL   24
    1    H    LEU  70           H        LEU  70 -25.732  11.604   2.936
    2    HA   LEU  70           HA       LEU  70 -24.741  14.061   1.852
    3    HB2  LEU  70           HB2      LEU  70 -23.627  11.782   2.381
    4    HB3  LEU  70           HB3      LEU  70 -24.207  11.335   0.777
    5    HG   LEU  70           HG       LEU  70 -22.683  12.824  -0.253
    6   HD11  LEU  70          HD11      LEU  70 -21.923  13.622   2.567
    7   HD13  LEU  70          HD12      LEU  70 -22.666  14.656   1.347
    8   HD12  LEU  70          HD13      LEU  70 -21.019  14.070   1.117
    9   HD22  LEU  70          HD21      LEU  70 -21.161  11.180  -0.063
   10   HD21  LEU  70          HD22      LEU  70 -22.066  10.565   1.319
   11   HD23  LEU  70          HD23      LEU  70 -20.741  11.702   1.567

  No H/Q in entry =          11
  In of MODEL   24
    1    H    LEU  71           H        LEU  71 -26.749  11.445   0.642
    2    HA   LEU  71           HA       LEU  71 -27.338  12.983  -1.831
    3    HB2  LEU  71           HB2      LEU  71 -27.389   9.979  -1.481
    4    HB3  LEU  71           HB3      LEU  71 -27.554  10.880  -2.987
    5    HG   LEU  71           HG       LEU  71 -25.047  10.971  -1.308
    6   HD12  LEU  71          HD11      LEU  71 -25.001   9.421  -3.790
    7   HD11  LEU  71          HD12      LEU  71 -25.985   8.704  -2.515
    8   HD13  LEU  71          HD13      LEU  71 -24.284   9.064  -2.220
    9   HD22  LEU  71          HD21      LEU  71 -25.236  12.826  -2.743
   10   HD21  LEU  71          HD22      LEU  71 -25.671  11.802  -4.112
   11   HD23  LEU  71          HD23      LEU  71 -24.048  11.718  -3.428

  No H/Q in entry =          11
  In of MODEL   24
    1    HA   PRO  72           HA       PRO  72 -31.190  12.251   0.747
    2    HB2  PRO  72           HB2      PRO  72 -32.177  14.766   0.740
    3    HB3  PRO  72           HB3      PRO  72 -30.853  14.347   1.826
    4    HG2  PRO  72           HG2      PRO  72 -30.714  15.637  -0.886
    5    HG3  PRO  72           HG3      PRO  72 -29.984  16.179   0.625
    6    HD2  PRO  72           HD2      PRO  72 -28.560  14.747  -1.180
    7    HD3  PRO  72           HD3      PRO  72 -28.306  14.539   0.552

  No H/Q in entry =           7
  In of MODEL   24
    1    H    ASN  73           H        ASN  73 -30.598  13.339  -2.431
    2    HA   ASN  73           HA       ASN  73 -33.436  12.906  -3.093
    3    HB2  ASN  73           HB2      ASN  73 -33.015  14.101  -5.151
    4    HB3  ASN  73           HB3      ASN  73 -32.551  15.062  -3.755
    5   HD21  ASN  73          HD21      ASN  73 -31.743  15.233  -6.425
    6   HD22  ASN  73          HD22      ASN  73 -30.068  15.162  -6.610

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LYS  74           H        LYS  74 -31.347  10.741  -2.726
    2    HA   LYS  74           HA       LYS  74 -31.829   9.402  -5.321
    3    HB2  LYS  74           HB2      LYS  74 -29.295   9.184  -3.692
    4    HB3  LYS  74           HB3      LYS  74 -29.628   8.403  -5.237
    5    HG2  LYS  74           HG2      LYS  74 -29.513  11.374  -4.939
    6    HG3  LYS  74           HG3      LYS  74 -28.086  10.391  -5.267
    7    HD2  LYS  74           HD2      LYS  74 -29.145   9.471  -7.247
    8    HD3  LYS  74           HD3      LYS  74 -30.614  10.387  -6.906
    9    HE2  LYS  74           HE2      LYS  74 -29.487  12.464  -7.276
   10    HE3  LYS  74           HE3      LYS  74 -27.924  11.654  -7.384
   11    HZ2  LYS  74           HZ1      LYS  74 -29.411  12.251  -9.499
   12    HZ1  LYS  74           HZ2      LYS  74 -29.991  10.687  -9.180
   13    HZ3  LYS  74           HZ3      LYS  74 -28.334  10.938  -9.459

  No H/Q in entry =          13
  In of MODEL   24
    1    HA   PRO  75           HA       PRO  75 -33.091   6.258  -2.455
    2    HB2  PRO  75           HB2      PRO  75 -33.282   4.078  -4.109
    3    HB3  PRO  75           HB3      PRO  75 -34.473   5.377  -4.144
    4    HG2  PRO  75           HG2      PRO  75 -32.099   4.953  -5.915
    5    HG3  PRO  75           HG3      PRO  75 -33.764   5.323  -6.361
    6    HD2  PRO  75           HD2      PRO  75 -31.917   7.279  -6.245
    7    HD3  PRO  75           HD3      PRO  75 -33.570   7.580  -5.706

  No H/Q in entry =           7
  In of MODEL   24
    1    H    VAL  76           H        VAL  76 -31.596   5.232  -1.106
    2    HA   VAL  76           HA       VAL  76 -29.068   4.180  -2.232
    3    HB   VAL  76           HB       VAL  76 -29.442   5.545   0.467
    4   HG11  VAL  76          HG11      VAL  76 -27.018   4.419  -0.947
    5   HG13  VAL  76          HG12      VAL  76 -27.700   3.887   0.591
    6   HG12  VAL  76          HG13      VAL  76 -26.930   5.467   0.470
    7   HG22  VAL  76          HG21      VAL  76 -28.864   7.504  -0.354
    8   HG21  VAL  76          HG22      VAL  76 -29.362   6.831  -1.907
    9   HG23  VAL  76          HG23      VAL  76 -27.661   6.812  -1.443

  No H/Q in entry =           9
  In of MODEL   24
    1    H    GLU  77           H        GLU  77 -28.749   2.021  -1.686
    2    HA   GLU  77           HA       GLU  77 -29.512   1.112   0.935
    3    HB2  GLU  77           HB2      GLU  77 -31.033  -0.594   0.342
    4    HB3  GLU  77           HB3      GLU  77 -31.652   0.921  -0.315
    5    HG2  GLU  77           HG2      GLU  77 -30.994   0.264  -2.521
    6    HG3  GLU  77           HG3      GLU  77 -30.283  -1.220  -1.891

  No H/Q in entry =           6
  In of MODEL   24
    1    H    VAL  78           H        VAL  78 -29.087  -0.976   1.532
    2    HA   VAL  78           HA       VAL  78 -26.380  -1.588   0.640
    3    HB   VAL  78           HB       VAL  78 -28.057  -2.628   2.964
    4   HG11  VAL  78          HG11      VAL  78 -25.653  -3.705   1.819
    5   HG13  VAL  78          HG12      VAL  78 -26.545  -4.265   3.235
    6   HG12  VAL  78          HG13      VAL  78 -25.285  -3.045   3.411
    7   HG22  VAL  78          HG21      VAL  78 -26.674  -1.239   4.355
    8   HG21  VAL  78          HG22      VAL  78 -27.450  -0.267   3.105
    9   HG23  VAL  78          HG23      VAL  78 -25.748  -0.706   2.951

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ILE  79           H        ILE  79 -25.744  -3.437  -0.320
    2    HA   ILE  79           HA       ILE  79 -27.721  -4.971  -1.729
    3    HB   ILE  79           HB       ILE  79 -24.710  -5.357  -1.502
    4   HG12  ILE  79          HG12      ILE  79 -26.385  -4.263  -3.766
    5   HG13  ILE  79          HG13      ILE  79 -25.569  -3.249  -2.576
    6   HG22  ILE  79          HG21      ILE  79 -25.738  -6.516  -3.864
    7   HG21  ILE  79          HG22      ILE  79 -26.704  -7.128  -2.522
    8   HG23  ILE  79          HG23      ILE  79 -24.951  -7.321  -2.507
    9   HD13  ILE  79          HD11      ILE  79 -24.140  -3.236  -4.387
   10   HD12  ILE  79          HD12      ILE  79 -24.394  -4.948  -4.723
   11   HD11  ILE  79          HD13      ILE  79 -23.443  -4.456  -3.321

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ASP  80           H        ASP  80 -28.494  -6.952  -1.212
    2    HA   ASP  80           HA       ASP  80 -28.412  -7.931   1.406
    3    HB2  ASP  80           HB2      ASP  80 -30.124  -8.541  -0.264
    4    HB3  ASP  80           HB3      ASP  80 -28.913  -9.463  -1.155

  No H/Q in entry =           4
  In of MODEL   24
    1    H    SER  81           H        SER  81 -26.829  -9.025   2.511
    2    HA   SER  81           HA       SER  81 -24.295  -9.545   1.318
    3    HB2  SER  81           HB2      SER  81 -23.701 -10.605   3.457
    4    HB3  SER  81           HB3      SER  81 -24.495  -9.053   3.719
    5    HG   SER  81           HG       SER  81 -26.461 -10.341   3.946

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU  82           H        LEU  82 -26.900 -11.776   1.554
    2    HA   LEU  82           HA       LEU  82 -25.235 -14.048   0.973
    3    HB2  LEU  82           HB2      LEU  82 -28.196 -13.568   0.717
    4    HB3  LEU  82           HB3      LEU  82 -27.414 -15.127   0.457
    5    HG   LEU  82           HG       LEU  82 -27.432 -13.635   3.063
    6   HD11  LEU  82          HD11      LEU  82 -29.184 -15.788   1.901
    7   HD13  LEU  82          HD12      LEU  82 -29.657 -14.318   2.756
    8   HD12  LEU  82          HD13      LEU  82 -28.939 -15.663   3.644
    9   HD22  LEU  82          HD21      LEU  82 -25.529 -15.005   2.995
   10   HD21  LEU  82          HD22      LEU  82 -26.357 -16.258   2.070
   11   HD23  LEU  82          HD23      LEU  82 -26.740 -16.022   3.775

  No H/Q in entry =          11
  In of MODEL   24
    1    H    LEU  83           H        LEU  83 -27.289 -11.863  -0.891
    2    HA   LEU  83           HA       LEU  83 -27.006 -13.132  -3.402
    3    HB2  LEU  83           HB2      LEU  83 -27.563 -10.270  -2.667
    4    HB3  LEU  83           HB3      LEU  83 -27.553 -10.864  -4.328
    5    HG   LEU  83           HG       LEU  83 -29.578 -11.418  -2.180
    6   HD13  LEU  83          HD11      LEU  83 -30.418  -9.577  -3.192
    7   HD12  LEU  83          HD12      LEU  83 -30.818 -10.671  -4.514
    8   HD11  LEU  83          HD13      LEU  83 -29.328  -9.729  -4.569
    9   HD23  LEU  83          HD21      LEU  83 -29.638 -12.596  -4.943
   10   HD22  LEU  83          HD22      LEU  83 -30.598 -13.038  -3.532
   11   HD21  LEU  83          HD23      LEU  83 -28.887 -13.455  -3.599

  No H/Q in entry =          11
  In of MODEL   24
    1    H    TYR  84           H        TYR  84 -25.182 -10.707  -1.638
    2    HA   TYR  84           HA       TYR  84 -23.335 -10.063  -3.739
    3    HB2  TYR  84           HB2      TYR  84 -23.940  -8.673  -1.668
    4    HB3  TYR  84           HB3      TYR  84 -22.860  -9.745  -0.780
    5    HD1  TYR  84           HD1      TYR  84 -20.480 -10.062  -2.053
    6    HD2  TYR  84           HD2      TYR  84 -23.031  -6.649  -2.337
    7    HE1  TYR  84           HE1      TYR  84 -18.546  -8.688  -2.750
    8    HE2  TYR  84           HE2      TYR  84 -21.109  -5.267  -3.044
    9    HH   TYR  84           HH       TYR  84 -18.945  -5.339  -3.741

  No H/Q in entry =           9
  In of MODEL   24
    1    H    GLY  85           H        GLY  85 -23.014 -12.141  -0.853
    2    HA3  GLY  85           HA2      GLY  85 -20.390 -12.943  -1.345
    3    HA2  GLY  85           HA3      GLY  85 -21.583 -13.877  -0.443

  No H/Q in entry =           3
  In of MODEL   24
    1    H    LYS  86           H        LYS  86 -23.397 -14.276  -2.529
    2    HA   LYS  86           HA       LYS  86 -22.220 -16.555  -3.852
    3    HB2  LYS  86           HB2      LYS  86 -24.933 -15.237  -3.919
    4    HB3  LYS  86           HB3      LYS  86 -24.548 -16.746  -4.745
    5    HG2  LYS  86           HG2      LYS  86 -24.152 -17.817  -2.613
    6    HG3  LYS  86           HG3      LYS  86 -24.529 -16.305  -1.784
    7    HD2  LYS  86           HD2      LYS  86 -26.753 -16.288  -2.832
    8    HD3  LYS  86           HD3      LYS  86 -26.377 -17.805  -3.649
    9    HE2  LYS  86           HE2      LYS  86 -26.150 -18.922  -1.493
   10    HE3  LYS  86           HE3      LYS  86 -26.487 -17.404  -0.662
   11    HZ1  LYS  86           HZ1      LYS  86 -28.645 -17.342  -1.831
   12    HZ3  LYS  86           HZ2      LYS  86 -28.493 -18.684  -0.799
   13    HZ2  LYS  86           HZ3      LYS  86 -28.320 -18.880  -2.477

  No H/Q in entry =          13
  In of MODEL   24
    1    H    VAL  87           H        VAL  87 -22.362 -13.317  -4.647
    2    HA   VAL  87           HA       VAL  87 -22.109 -12.072  -6.549
    3    HB   VAL  87           HB       VAL  87 -20.917 -14.474  -7.959
    4   HG11  VAL  87          HG11      VAL  87 -21.203 -12.043  -8.896
    5   HG13  VAL  87          HG12      VAL  87 -19.667 -12.879  -9.136
    6   HG12  VAL  87          HG13      VAL  87 -19.826 -11.672  -7.859
    7   HG21  VAL  87          HG21      VAL  87 -20.016 -14.524  -5.677
    8   HG23  VAL  87          HG22      VAL  87 -19.497 -12.850  -5.857
    9   HG22  VAL  87          HG23      VAL  87 -18.787 -14.106  -6.870

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ASP  88           H        ASP  88 -24.593 -12.847  -6.235
    2    HA   ASP  88           HA       ASP  88 -25.639 -14.043  -8.677
    3    HB2  ASP  88           HB2      ASP  88 -26.634 -14.408  -6.368
    4    HB3  ASP  88           HB3      ASP  88 -27.170 -12.729  -6.419

  No H/Q in entry =           4
  In of MODEL   24
    1    H    GLY  89           H        GLY  89 -24.989 -12.703 -10.274
    2    HA3  GLY  89           HA2      GLY  89 -25.306  -9.938 -10.392
    3    HA2  GLY  89           HA3      GLY  89 -25.219 -11.013 -11.785

  No H/Q in entry =           3
  In of MODEL   24
    1    H    LEU  90           H        LEU  90 -27.598 -12.498 -11.395
    2    HA   LEU  90           HA       LEU  90 -29.497 -10.622 -12.462
    3    HB2  LEU  90           HB2      LEU  90 -29.440 -13.000 -13.115
    4    HB3  LEU  90           HB3      LEU  90 -29.935 -13.440 -11.481
    5    HG   LEU  90           HG       LEU  90 -32.105 -12.420 -11.825
    6   HD13  LEU  90          HD11      LEU  90 -32.004 -10.628 -13.246
    7   HD12  LEU  90          HD12      LEU  90 -32.476 -11.854 -14.424
    8   HD11  LEU  90          HD13      LEU  90 -30.784 -11.380 -14.276
    9   HD23  LEU  90          HD21      LEU  90 -31.941 -13.968 -14.309
   10   HD22  LEU  90          HD22      LEU  90 -32.919 -14.227 -12.864
   11   HD21  LEU  90          HD23      LEU  90 -31.237 -14.755 -12.895

  No H/Q in entry =          11
  In of MODEL   24
    1    H    GLY  91           H        GLY  91 -29.271 -12.209  -9.324
    2    HA3  GLY  91           HA2      GLY  91 -31.668 -11.247  -8.267
    3    HA2  GLY  91           HA3      GLY  91 -30.256 -11.739  -7.332

  No H/Q in entry =           3
  In of MODEL   24
    1    H    VAL  92           H        VAL  92 -28.427  -9.793  -8.120
    2    HA   VAL  92           HA       VAL  92 -29.340  -7.583  -6.507
    3    HB   VAL  92           HB       VAL  92 -26.766  -7.876  -8.099
    4   HG12  VAL  92          HG11      VAL  92 -27.036  -6.073  -5.718
    5   HG11  VAL  92          HG12      VAL  92 -27.720  -5.516  -7.247
    6   HG13  VAL  92          HG13      VAL  92 -26.004  -5.902  -7.138
    7   HG22  VAL  92          HG21      VAL  92 -26.472  -9.497  -6.554
    8   HG21  VAL  92          HG22      VAL  92 -27.660  -8.809  -5.446
    9   HG23  VAL  92          HG23      VAL  92 -26.038  -8.123  -5.538

  No H/Q in entry =           9
  In of MODEL   24
    1    H    LEU  93           H        LEU  93 -28.883  -8.119  -9.943
    2    HA   LEU  93           HA       LEU  93 -29.356  -5.476 -10.795
    3    HB2  LEU  93           HB2      LEU  93 -28.614  -7.251 -12.307
    4    HB3  LEU  93           HB3      LEU  93 -30.168  -8.064 -12.117
    5    HG   LEU  93           HG       LEU  93 -31.271  -6.121 -13.189
    6   HD11  LEU  93          HD11      LEU  93 -29.505  -4.451 -12.624
    7   HD13  LEU  93          HD12      LEU  93 -29.934  -4.451 -14.337
    8   HD12  LEU  93          HD13      LEU  93 -28.446  -5.228 -13.801
    9   HD23  LEU  93          HD21      LEU  93 -30.193  -6.565 -15.485
   10   HD22  LEU  93          HD22      LEU  93 -30.976  -7.890 -14.623
   11   HD21  LEU  93          HD23      LEU  93 -29.217  -7.745 -14.612

  No H/Q in entry =          11
  In of MODEL   24
    1    H    LYS  94           H        LYS  94 -31.605  -8.163 -10.039
    2    HA   LYS  94           HA       LYS  94 -34.015  -6.823 -10.635
    3    HB2  LYS  94           HB2      LYS  94 -33.402  -9.039  -8.687
    4    HB3  LYS  94           HB3      LYS  94 -35.031  -8.417  -8.945
    5    HG2  LYS  94           HG2      LYS  94 -34.894  -9.115 -11.300
    6    HG3  LYS  94           HG3      LYS  94 -33.299  -9.797 -10.984
    7    HD2  LYS  94           HD2      LYS  94 -34.360 -11.240  -9.208
    8    HD3  LYS  94           HD3      LYS  94 -35.931 -10.655  -9.754
    9    HE2  LYS  94           HE2      LYS  94 -35.359 -11.486 -12.043
   10    HE3  LYS  94           HE3      LYS  94 -33.909 -12.219 -11.355
   11    HZ3  LYS  94           HZ1      LYS  94 -35.679 -13.826 -11.583
   12    HZ2  LYS  94           HZ2      LYS  94 -36.708 -12.879 -10.617
   13    HZ1  LYS  94           HZ3      LYS  94 -35.316 -13.579  -9.942

  No H/Q in entry =          13
  In of MODEL   24
    1    H    ALA  95           H        ALA  95 -32.202  -6.945  -7.579
    2    HA   ALA  95           HA       ALA  95 -34.136  -5.505  -6.065
    3    HB2  ALA  95           HB1      ALA  95 -31.698  -6.775  -5.555
    4    HB3  ALA  95           HB2      ALA  95 -32.727  -5.955  -4.381
    5    HB1  ALA  95           HB3      ALA  95 -31.415  -5.077  -5.169

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA  96           H        ALA  96 -31.531  -4.456  -8.118
    2    HA   ALA  96           HA       ALA  96 -31.577  -1.719  -7.261
    3    HB2  ALA  96           HB1      ALA  96 -30.216  -1.360  -9.353
    4    HB3  ALA  96           HB2      ALA  96 -30.434  -3.070  -9.726
    5    HB1  ALA  96           HB3      ALA  96 -29.551  -2.589  -8.277

  No H/Q in entry =           5
  In of MODEL   24
    1    H    VAL  97           H        VAL  97 -33.007  -3.424 -10.008
    2    HA   VAL  97           HA       VAL  97 -34.184  -1.143 -11.199
    3    HB   VAL  97           HB       VAL  97 -34.847  -4.102 -11.337
    4   HG11  VAL  97          HG11      VAL  97 -36.734  -2.172 -11.773
    5   HG13  VAL  97          HG12      VAL  97 -36.711  -3.741 -12.577
    6   HG12  VAL  97          HG13      VAL  97 -36.021  -2.331 -13.378
    7   HG21  VAL  97          HG21      VAL  97 -33.651  -2.151 -13.306
    8   HG23  VAL  97          HG22      VAL  97 -34.019  -3.842 -13.649
    9   HG22  VAL  97          HG23      VAL  97 -32.796  -3.431 -12.445

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ALA  98           H        ALA  98 -35.271  -3.454  -8.739
    2    HA   ALA  98           HA       ALA  98 -37.886  -2.443  -8.369
    3    HB1  ALA  98           HB1      ALA  98 -36.772  -4.620  -7.398
    4    HB3  ALA  98           HB2      ALA  98 -38.000  -3.784  -6.446
    5    HB2  ALA  98           HB3      ALA  98 -36.290  -3.563  -6.071

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA  99           H        ALA  99 -34.858  -1.547  -6.678
    2    HA   ALA  99           HA       ALA  99 -36.089   0.328  -4.964
    3    HB1  ALA  99           HB1      ALA  99 -33.398  -0.410  -5.722
    4    HB2  ALA  99           HB2      ALA  99 -33.990   0.266  -4.203
    5    HB3  ALA  99           HB3      ALA  99 -33.557   1.337  -5.536

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ILE 100           H        ILE 100 -35.040   0.613  -8.307
    2    HA   ILE 100           HA       ILE 100 -35.354   3.455  -8.439
    3    HB   ILE 100           HB       ILE 100 -35.336   1.365 -10.644
    4   HG12  ILE 100          HG12      ILE 100 -33.273   3.436  -9.899
    5   HG13  ILE 100          HG13      ILE 100 -33.234   1.771  -9.320
    6   HG21  ILE 100          HG21      ILE 100 -35.897   4.265 -10.687
    7   HG23  ILE 100          HG22      ILE 100 -36.337   3.009 -11.845
    8   HG22  ILE 100          HG23      ILE 100 -34.716   3.704 -11.870
    9   HD12  ILE 100          HD11      ILE 100 -32.734   2.839 -12.059
   10   HD11  ILE 100          HD12      ILE 100 -33.319   1.187 -11.859
   11   HD13  ILE 100          HD13      ILE 100 -31.799   1.680 -11.116

  No H/Q in entry =          11
  In of MODEL   24
    1    H    LYS 101           H        LYS 101 -37.517   0.763  -9.260
    2    HA   LYS 101           HA       LYS 101 -39.670   2.343 -10.221
    3    HB2  LYS 101           HB2      LYS 101 -39.428  -0.456  -9.180
    4    HB3  LYS 101           HB3      LYS 101 -41.012   0.241  -9.511
    5    HG2  LYS 101           HG2      LYS 101 -40.534   0.471 -11.800
    6    HG3  LYS 101           HG3      LYS 101 -38.822   0.138 -11.548
    7    HD2  LYS 101           HD2      LYS 101 -39.976  -1.798 -12.501
    8    HD3  LYS 101           HD3      LYS 101 -39.341  -2.148 -10.893
    9    HE2  LYS 101           HE2      LYS 101 -41.372  -2.956 -10.421
   10    HE3  LYS 101           HE3      LYS 101 -41.908  -1.276 -10.374
   11    HZ3  LYS 101           HZ1      LYS 101 -42.782  -1.408 -12.501
   12    HZ2  LYS 101           HZ2      LYS 101 -43.175  -2.923 -11.843
   13    HZ1  LYS 101           HZ3      LYS 101 -41.868  -2.779 -12.916

  No H/Q in entry =          13
  In of MODEL   24
    1    H    LYS 102           H        LYS 102 -39.124   0.790  -7.057
    2    HA   LYS 102           HA       LYS 102 -41.432   1.840  -5.837
    3    HB2  LYS 102           HB2      LYS 102 -40.113   0.002  -4.873
    4    HB3  LYS 102           HB3      LYS 102 -38.775   1.113  -4.588
    5    HG2  LYS 102           HG2      LYS 102 -40.163   2.396  -3.056
    6    HG3  LYS 102           HG3      LYS 102 -41.505   1.288  -3.343
    7    HD2  LYS 102           HD2      LYS 102 -40.197  -0.549  -2.369
    8    HD3  LYS 102           HD3      LYS 102 -38.856   0.560  -2.079
    9    HE2  LYS 102           HE2      LYS 102 -40.285   1.927  -0.633
   10    HE3  LYS 102           HE3      LYS 102 -41.645   0.849  -0.943
   11    HZ1  LYS 102           HZ1      LYS 102 -39.849  -0.854   0.015
   12    HZ3  LYS 102           HZ2      LYS 102 -41.004  -0.052   0.966
   13    HZ2  LYS 102           HZ3      LYS 102 -39.420   0.551   0.866

  No H/Q in entry =          13
  In of MODEL   24
    1    H    ALA 103           H        ALA 103 -38.541   3.400  -6.786
    2    HA   ALA 103           HA       ALA 103 -38.883   5.643  -4.933
    3    HB2  ALA 103           HB1      ALA 103 -36.920   6.521  -6.471
    4    HB3  ALA 103           HB2      ALA 103 -36.802   4.820  -6.924
    5    HB1  ALA 103           HB3      ALA 103 -36.608   5.300  -5.238

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA 104           H        ALA 104 -39.451   4.991  -8.305
    2    HA   ALA 104           HA       ALA 104 -40.164   7.764  -8.842
    3    HB2  ALA 104           HB1      ALA 104 -40.164   7.165 -11.064
    4    HB1  ALA 104           HB2      ALA 104 -40.819   5.560 -10.741
    5    HB3  ALA 104           HB3      ALA 104 -39.112   5.895 -10.443

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA 105           H        ALA 105 -41.680   5.529  -7.116
    2    HA   ALA 105           HA       ALA 105 -44.169   6.805  -7.061
    3    HB2  ALA 105           HB1      ALA 105 -44.861   5.977  -9.130
    4    HB3  ALA 105           HB2      ALA 105 -45.446   4.724  -8.036
    5    HB1  ALA 105           HB3      ALA 105 -43.957   4.474  -8.947

  No H/Q in entry =           5
  In of MODEL   25
    1    H1   ALA   1           H3       ALA   1 -12.271 -15.618  -2.333
    2    H2   ALA   1           H2       ALA   1 -11.333 -16.767  -3.169
    3    H3   ALA   1           H1       ALA   1 -12.471 -15.819  -4.007
    4    HA   ALA   1           HA       ALA   1 -13.878 -17.512  -3.766
    5    HB3  ALA   1           HB1      ALA   1 -12.492 -19.289  -3.296
    6    HB1  ALA   1           HB2      ALA   1 -13.251 -19.169  -1.709
    7    HB2  ALA   1           HB3      ALA   1 -11.671 -18.437  -1.989

  No H/Q in entry =           7
  In of MODEL   25
    1    H    GLU   2           H        GLU   2 -15.509 -18.354  -2.112
    2    HA   GLU   2           HA       GLU   2 -17.150 -16.622  -1.061
    3    HB2  GLU   2           HB2      GLU   2 -16.226 -19.048   0.492
    4    HB3  GLU   2           HB3      GLU   2 -17.747 -18.190   0.740
    5    HG2  GLU   2           HG2      GLU   2 -18.728 -19.276  -0.993
    6    HG3  GLU   2           HG3      GLU   2 -17.401 -18.885  -2.076

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLU   3           H        GLU   3 -15.250 -17.978   1.569
    2    HA   GLU   3           HA       GLU   3 -15.463 -15.619   3.120
    3    HB2  GLU   3           HB2      GLU   3 -13.891 -18.174   3.380
    4    HB3  GLU   3           HB3      GLU   3 -13.655 -16.852   4.524
    5    HG2  GLU   3           HG2      GLU   3 -15.851 -16.990   5.338
    6    HG3  GLU   3           HG3      GLU   3 -16.447 -17.791   3.890

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LEU   4           H        LEU   4 -12.513 -17.117   1.739
    2    HA   LEU   4           HA       LEU   4 -10.670 -15.222   2.336
    3    HB2  LEU   4           HB2      LEU   4 -10.902 -16.525  -0.386
    4    HB3  LEU   4           HB3      LEU   4  -9.447 -15.811   0.300
    5    HG   LEU   4           HG       LEU   4 -10.956 -18.197   1.416
    6   HD13  LEU   4          HD11      LEU   4  -9.329 -19.564   0.493
    7   HD12  LEU   4          HD12      LEU   4  -8.112 -18.287   0.466
    8   HD11  LEU   4          HD13      LEU   4  -9.399 -18.306  -0.740
    9   HD23  LEU   4          HD21      LEU   4  -8.708 -18.269   2.802
   10   HD22  LEU   4          HD22      LEU   4 -10.025 -17.221   3.326
   11   HD21  LEU   4          HD23      LEU   4  -8.657 -16.542   2.444

  No H/Q in entry =          11
  In of MODEL   25
    1    H    GLU   5           H        GLU   5 -12.998 -15.010  -0.344
    2    HA   GLU   5           HA       GLU   5 -11.979 -12.534  -1.349
    3    HB2  GLU   5           HB2      GLU   5 -13.332 -14.120  -2.708
    4    HB3  GLU   5           HB3      GLU   5 -14.732 -13.741  -1.704
    5    HG2  GLU   5           HG2      GLU   5 -14.580 -11.375  -2.356
    6    HG3  GLU   5           HG3      GLU   5 -13.159 -11.729  -3.339

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLU   6           H        GLU   6 -14.714 -13.392   0.740
    2    HA   GLU   6           HA       GLU   6 -15.604 -10.710   1.130
    3    HB2  GLU   6           HB2      GLU   6 -17.050 -12.682   1.532
    4    HB3  GLU   6           HB3      GLU   6 -16.017 -13.148   2.883
    5    HG2  GLU   6           HG2      GLU   6 -16.520 -11.036   4.024
    6    HG3  GLU   6           HG3      GLU   6 -17.514 -10.520   2.664

  No H/Q in entry =           6
  In of MODEL   25
    1    H    VAL   7           H        VAL   7 -13.312 -12.829   2.712
    2    HA   VAL   7           HA       VAL   7 -12.842 -11.250   5.036
    3    HB   VAL   7           HB       VAL   7 -11.146 -13.307   3.596
    4   HG11  VAL   7          HG11      VAL   7 -10.676 -11.769   6.157
    5   HG13  VAL   7          HG12      VAL   7  -9.574 -11.993   4.799
    6   HG12  VAL   7          HG13      VAL   7  -9.937 -13.345   5.872
    7   HG21  VAL   7          HG21      VAL   7 -13.403 -13.856   4.812
    8   HG23  VAL   7          HG22      VAL   7 -12.477 -13.583   6.289
    9   HG22  VAL   7          HG23      VAL   7 -11.989 -14.848   5.164

  No H/Q in entry =           9
  In of MODEL   25
    1    H    VAL   8           H        VAL   8 -11.324 -11.381   1.830
    2    HA   VAL   8           HA       VAL   8  -9.253  -9.518   2.322
    3    HB   VAL   8           HB       VAL   8 -10.699 -10.336  -0.199
    4   HG13  VAL   8          HG11      VAL   8 -10.035  -8.139  -0.735
    5   HG12  VAL   8          HG12      VAL   8  -8.676  -9.116  -1.294
    6   HG11  VAL   8          HG13      VAL   8  -8.566  -8.248   0.237
    7   HG23  VAL   8          HG21      VAL   8  -7.906 -10.877  -0.273
    8   HG22  VAL   8          HG22      VAL   8  -9.208 -12.046  -0.075
    9   HG21  VAL   8          HG23      VAL   8  -8.441 -11.340   1.344

  No H/Q in entry =           9
  In of MODEL   25
    1    H    MET   9           H        MET   9 -12.593  -9.114   1.154
    2    HA   MET   9           HA       MET   9 -12.514  -6.339   0.712
    3    HB2  MET   9           HB2      MET   9 -14.739  -8.200   1.541
    4    HB3  MET   9           HB3      MET   9 -15.010  -6.471   1.319
    5    HG2  MET   9           HG2      MET   9 -14.176  -6.619  -0.988
    6    HG3  MET   9           HG3      MET   9 -13.865  -8.342  -0.773
    7    HE2  MET   9           HE1      MET   9 -17.641  -5.982  -1.231
    8    HE1  MET   9           HE2      MET   9 -16.137  -5.539  -0.428
    9    HE3  MET   9           HE3      MET   9 -17.409  -6.346   0.484

  No H/Q in entry =           9
  In of MODEL   25
    1    H    GLY  10           H        GLY  10 -13.194  -8.218   3.643
    2    HA3  GLY  10           HA2      GLY  10 -13.734  -6.026   5.354
    3    HA2  GLY  10           HA3      GLY  10 -13.180  -7.617   5.874

  No H/Q in entry =           3
  In of MODEL   25
    1    H    LEU  11           H        LEU  11 -10.732  -7.757   4.565
    2    HA   LEU  11           HA       LEU  11  -9.028  -6.327   6.322
    3    HB2  LEU  11           HB2      LEU  11  -8.482  -7.760   3.719
    4    HB3  LEU  11           HB3      LEU  11  -7.211  -7.059   4.719
    5    HG   LEU  11           HG       LEU  11  -9.225  -9.080   5.736
    6   HD13  LEU  11          HD11      LEU  11  -8.006 -10.327   4.178
    7   HD12  LEU  11          HD12      LEU  11  -7.076 -10.566   5.656
    8   HD11  LEU  11          HD13      LEU  11  -6.527  -9.407   4.446
    9   HD22  LEU  11          HD21      LEU  11  -8.372  -8.066   7.652
   10   HD21  LEU  11          HD22      LEU  11  -6.830  -7.674   6.892
   11   HD23  LEU  11          HD23      LEU  11  -7.165  -9.327   7.405

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  12           H        ILE  12  -9.919  -5.785   2.928
    2    HA   ILE  12           HA       ILE  12  -8.216  -3.564   2.500
    3    HB   ILE  12           HB       ILE  12 -10.870  -4.229   1.200
    4   HG12  ILE  12          HG12      ILE  12  -8.852  -5.892   1.128
    5   HG13  ILE  12          HG13      ILE  12  -9.686  -5.516  -0.366
    6   HG21  ILE  12          HG21      ILE  12  -8.632  -2.359   0.351
    7   HG23  ILE  12          HG22      ILE  12 -10.280  -1.899   0.759
    8   HG22  ILE  12          HG23      ILE  12  -9.956  -2.849  -0.662
    9   HD13  ILE  12          HD11      ILE  12  -7.936  -3.984  -1.005
   10   HD12  ILE  12          HD12      ILE  12  -7.171  -5.492  -0.510
   11   HD11  ILE  12          HD13      ILE  12  -7.177  -4.118   0.569

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  13           H        ILE  13 -11.581  -3.813   3.586
    2    HA   ILE  13           HA       ILE  13 -12.029  -1.023   3.846
    3    HB   ILE  13           HB       ILE  13 -13.248  -3.440   5.201
    4   HG12  ILE  13          HG12      ILE  13 -13.475  -2.882   2.670
    5   HG13  ILE  13          HG13      ILE  13 -14.907  -3.326   3.575
    6   HG21  ILE  13          HG21      ILE  13 -13.912  -0.511   5.506
    7   HG23  ILE  13          HG22      ILE  13 -13.703  -1.715   6.770
    8   HG22  ILE  13          HG23      ILE  13 -15.142  -1.748   5.753
    9   HD11  ILE  13          HD11      ILE  13 -14.064  -0.453   3.120
   10   HD13  ILE  13          HD12      ILE  13 -15.572  -1.039   3.797
   11   HD12  ILE  13          HD13      ILE  13 -15.225  -1.318   2.106

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ASN  14           H        ASN  14 -10.934  -3.512   6.131
    2    HA   ASN  14           HA       ASN  14 -10.732  -1.868   8.412
    3    HB2  ASN  14           HB2      ASN  14 -10.489  -4.478   8.098
    4    HB3  ASN  14           HB3      ASN  14  -8.778  -4.097   7.944
    5   HD21  ASN  14          HD21      ASN  14  -9.425  -5.613  10.123
    6   HD22  ASN  14          HD22      ASN  14  -9.398  -4.689  11.545

  No H/Q in entry =           6
  In of MODEL   25
    1    H    SER  15           H        SER  15  -8.327  -2.708   5.929
    2    HA   SER  15           HA       SER  15  -6.181  -1.220   7.002
    3    HB2  SER  15           HB2      SER  15  -5.154  -1.448   4.850
    4    HB3  SER  15           HB3      SER  15  -6.121  -2.902   5.071
    5    HG   SER  15           HG       SER  15  -6.541  -0.694   3.412

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLY  16           H        GLY  16  -8.774  -0.350   4.746
    2    HA3  GLY  16           HA2      GLY  16  -7.906   2.286   4.189
    3    HA2  GLY  16           HA3      GLY  16  -9.558   1.696   4.025

  No H/Q in entry =           3
  In of MODEL   25
    1    H    GLN  17           H        GLN  17 -10.110   0.980   6.675
    2    HA   GLN  17           HA       GLN  17 -10.813   3.490   7.807
    3    HB2  GLN  17           HB2      GLN  17 -10.715   0.718   9.013
    4    HB3  GLN  17           HB3      GLN  17 -11.365   2.126   9.853
    5    HG2  GLN  17           HG2      GLN  17 -12.336   1.211   7.133
    6    HG3  GLN  17           HG3      GLN  17 -13.098   0.732   8.648
    7   HE21  GLN  17          HE21      GLN  17 -14.453   2.266   9.704
    8   HE22  GLN  17          HE22      GLN  17 -14.757   3.816   9.080

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ALA  18           H        ALA  18  -8.192   1.203   8.439
    2    HA   ALA  18           HA       ALA  18  -7.097   2.423  10.709
    3    HB2  ALA  18           HB1      ALA  18  -6.489   0.202   9.350
    4    HB3  ALA  18           HB2      ALA  18  -5.327   0.985  10.421
    5    HB1  ALA  18           HB3      ALA  18  -5.244   1.258   8.680

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ARG  19           H        ARG  19  -6.315   2.935   7.261
    2    HA   ARG  19           HA       ARG  19  -4.413   4.979   7.688
    3    HB2  ARG  19           HB2      ARG  19  -4.738   3.832   5.496
    4    HB3  ARG  19           HB3      ARG  19  -6.278   4.676   5.312
    5    HG2  ARG  19           HG2      ARG  19  -5.144   6.845   5.377
    6    HG3  ARG  19           HG3      ARG  19  -3.598   6.057   5.687
    7    HD2  ARG  19           HD2      ARG  19  -3.716   6.641   3.342
    8    HD3  ARG  19           HD3      ARG  19  -3.805   4.881   3.493
    9    HE   ARG  19           HE       ARG  19  -6.437   5.796   3.476
   10   HH21  ARG  19          HH11      ARG  19  -7.626   5.949   1.554
   11   HH22  ARG  19          HH12      ARG  19  -6.800   6.020   0.036
   12   HH11  ARG  19          HH21      ARG  19  -3.656   5.848   1.449
   13   HH12  ARG  19          HH22      ARG  19  -4.551   5.960  -0.023

  No H/Q in entry =          13
  In of MODEL   25
    1    H    SER  20           H        SER  20  -7.910   5.099   7.079
    2    HA   SER  20           HA       SER  20  -8.261   7.855   7.021
    3    HB2  SER  20           HB2      SER  20 -10.140   6.516   6.484
    4    HB3  SER  20           HB3      SER  20 -10.037   5.627   8.001
    5    HG   SER  20           HG       SER  20 -11.092   8.133   7.445

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU  21           H        LEU  21  -8.273   5.681   9.832
    2    HA   LEU  21           HA       LEU  21  -8.715   7.684  11.789
    3    HB2  LEU  21           HB2      LEU  21  -7.368   4.981  11.961
    4    HB3  LEU  21           HB3      LEU  21  -7.679   6.003  13.361
    5    HG   LEU  21           HG       LEU  21  -9.844   5.099  11.438
    6   HD13  LEU  21          HD11      LEU  21  -9.012   3.105  12.459
    7   HD12  LEU  21          HD12      LEU  21 -10.454   3.548  13.372
    8   HD11  LEU  21          HD13      LEU  21  -8.854   3.892  14.031
    9   HD21  LEU  21          HD21      LEU  21  -9.785   6.617  14.042
   10   HD23  LEU  21          HD22      LEU  21 -11.195   5.634  13.662
   11   HD22  LEU  21          HD23      LEU  21 -10.733   6.951  12.596

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ALA  22           H        ALA  22  -5.761   6.302  10.394
    2    HA   ALA  22           HA       ALA  22  -3.884   7.618  12.017
    3    HB2  ALA  22           HB1      ALA  22  -3.466   5.758  10.333
    4    HB1  ALA  22           HB2      ALA  22  -2.269   7.053  10.368
    5    HB3  ALA  22           HB3      ALA  22  -3.483   7.007   9.088

  No H/Q in entry =           5
  In of MODEL   25
    1    H    TYR  23           H        TYR  23  -5.191   8.627   8.828
    2    HA   TYR  23           HA       TYR  23  -3.852  11.121   8.754
    3    HB2  TYR  23           HB2      TYR  23  -4.929  10.202   6.762
    4    HB3  TYR  23           HB3      TYR  23  -6.509  10.317   7.539
    5    HD1  TYR  23           HD1      TYR  23  -3.598  12.347   6.386
    6    HD2  TYR  23           HD2      TYR  23  -7.742  12.332   7.510
    7    HE1  TYR  23           HE1      TYR  23  -3.815  14.694   5.615
    8    HE2  TYR  23           HE2      TYR  23  -7.960  14.679   6.739
    9    HH   TYR  23           HH       TYR  23  -5.151  16.458   5.455

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ALA  24           H        ALA  24  -6.976  10.151  10.127
    2    HA   ALA  24           HA       ALA  24  -7.812  12.745  10.888
    3    HB1  ALA  24           HB1      ALA  24  -9.634  11.497  11.354
    4    HB2  ALA  24           HB2      ALA  24  -8.813  10.929  12.806
    5    HB3  ALA  24           HB3      ALA  24  -8.684  10.012  11.306

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA  25           H        ALA  25  -5.818  10.289  12.475
    2    HA   ALA  25           HA       ALA  25  -5.486  11.549  14.974
    3    HB2  ALA  25           HB1      ALA  25  -4.719   9.194  14.163
    4    HB3  ALA  25           HB2      ALA  25  -3.706  10.054  15.324
    5    HB1  ALA  25           HB3      ALA  25  -3.265  10.031  13.616

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU  26           H        LEU  26  -3.686  11.836  11.939
    2    HA   LEU  26           HA       LEU  26  -1.728  13.657  12.855
    3    HB2  LEU  26           HB2      LEU  26  -1.421  12.498  10.755
    4    HB3  LEU  26           HB3      LEU  26  -2.892  13.206  10.094
    5    HG   LEU  26           HG       LEU  26  -1.875  15.455  10.226
    6   HD12  LEU  26          HD11      LEU  26   0.662  15.473  10.647
    7   HD11  LEU  26          HD12      LEU  26   0.435  13.895  11.396
    8   HD13  LEU  26          HD13      LEU  26  -0.373  15.313  12.065
    9   HD21  LEU  26          HD21      LEU  26  -0.130  13.394   8.842
   10   HD23  LEU  26          HD22      LEU  26  -0.170  15.114   8.466
   11   HD22  LEU  26          HD23      LEU  26  -1.594  14.118   8.177

  No H/Q in entry =          11
  In of MODEL   25
    1    H    LYS  27           H        LYS  27  -4.905  14.139  11.367
    2    HA   LYS  27           HA       LYS  27  -4.845  16.927  11.160
    3    HB2  LYS  27           HB2      LYS  27  -6.588  15.449  10.174
    4    HB3  LYS  27           HB3      LYS  27  -7.250  15.199  11.788
    5    HG2  LYS  27           HG2      LYS  27  -7.677  17.606  12.016
    6    HG3  LYS  27           HG3      LYS  27  -6.963  17.897  10.426
    7    HD2  LYS  27           HD2      LYS  27  -8.695  16.462   9.389
    8    HD3  LYS  27           HD3      LYS  27  -9.414  16.189  10.978
    9    HE2  LYS  27           HE2      LYS  27  -9.854  18.601  11.212
   10    HE3  LYS  27           HE3      LYS  27  -9.106  18.897   9.638
   11    HZ3  LYS  27           HZ1      LYS  27 -11.483  18.775   9.390
   12    HZ2  LYS  27           HZ2      LYS  27 -11.536  17.261  10.164
   13    HZ1  LYS  27           HZ3      LYS  27 -10.786  17.418   8.644

  No H/Q in entry =          13
  In of MODEL   25
    1    H    GLN  28           H        GLN  28  -5.745  14.851  13.891
    2    HA   GLN  28           HA       GLN  28  -6.642  16.862  15.658
    3    HB2  GLN  28           HB2      GLN  28  -5.247  14.230  16.212
    4    HB3  GLN  28           HB3      GLN  28  -5.989  15.239  17.455
    5    HG2  GLN  28           HG2      GLN  28  -7.443  14.107  15.048
    6    HG3  GLN  28           HG3      GLN  28  -7.514  13.435  16.677
    7   HE21  GLN  28          HE21      GLN  28  -9.350  15.246  14.670
    8   HE22  GLN  28          HE22      GLN  28 -10.107  16.272  15.790

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ALA  29           H        ALA  29  -3.424  15.556  14.982
    2    HA   ALA  29           HA       ALA  29  -1.988  16.956  16.960
    3    HB1  ALA  29           HB1      ALA  29  -0.056  16.257  15.849
    4    HB3  ALA  29           HB2      ALA  29  -0.806  16.378  14.257
    5    HB2  ALA  29           HB3      ALA  29  -1.234  15.050  15.334

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LYS  30           H        LYS  30  -2.834  17.828  13.625
    2    HA   LYS  30           HA       LYS  30  -1.414  20.262  13.521
    3    HB2  LYS  30           HB2      LYS  30  -3.945  19.394  12.108
    4    HB3  LYS  30           HB3      LYS  30  -3.104  20.905  11.762
    5    HG2  LYS  30           HG2      LYS  30  -1.038  19.601  11.258
    6    HG3  LYS  30           HG3      LYS  30  -1.951  18.110  11.505
    7    HD2  LYS  30           HD2      LYS  30  -3.508  18.752   9.704
    8    HD3  LYS  30           HD3      LYS  30  -2.617  20.255   9.459
    9    HE2  LYS  30           HE2      LYS  30  -0.589  18.952   8.889
   10    HE3  LYS  30           HE3      LYS  30  -1.499  17.453   9.103
   11    HZ2  LYS  30           HZ1      LYS  30  -1.312  18.316   6.759
   12    HZ1  LYS  30           HZ2      LYS  30  -2.351  19.585   7.221
   13    HZ3  LYS  30           HZ3      LYS  30  -2.883  17.971   7.295

  No H/Q in entry =          13
  In of MODEL   25
    1    H    GLN  31           H        GLN  31  -4.522  19.430  14.928
    2    HA   GLN  31           HA       GLN  31  -5.272  22.192  15.370
    3    HB2  GLN  31           HB2      GLN  31  -6.468  19.755  16.697
    4    HB3  GLN  31           HB3      GLN  31  -7.219  21.330  16.444
    5    HG2  GLN  31           HG2      GLN  31  -6.506  20.542  13.859
    6    HG3  GLN  31           HG3      GLN  31  -7.041  19.043  14.609
    7   HE21  GLN  31          HE21      GLN  31  -8.437  20.618  12.499
    8   HE22  GLN  31          HE22      GLN  31  -9.950  21.020  13.152

  No H/Q in entry =           8
  In of MODEL   25
    1    H    GLY  32           H        GLY  32  -2.974  20.255  16.701
    2    HA3  GLY  32           HA2      GLY  32  -1.576  20.714  18.506
    3    HA2  GLY  32           HA3      GLY  32  -2.699  21.965  19.023

  No H/Q in entry =           3
  In of MODEL   25
    1    H    ASP  33           H        ASP  33  -4.137  18.932  18.366
    2    HA   ASP  33           HA       ASP  33  -4.558  18.485  21.246
    3    HB2  ASP  33           HB2      ASP  33  -5.964  17.475  18.768
    4    HB3  ASP  33           HB3      ASP  33  -6.317  16.871  20.385

  No H/Q in entry =           4
  In of MODEL   25
    1    H    PHE  34           H        PHE  34  -2.395  17.622  21.559
    2    HA   PHE  34           HA       PHE  34  -1.405  15.363  20.167
    3    HB2  PHE  34           HB2      PHE  34  -0.789  16.351  22.960
    4    HB3  PHE  34           HB3      PHE  34   0.135  15.120  22.098
    5    HD1  PHE  34           HD1      PHE  34  -0.019  18.549  22.824
    6    HD2  PHE  34           HD2      PHE  34   0.803  15.832  19.598
    7    HE1  PHE  34           HE1      PHE  34   1.290  20.309  21.668
    8    HE2  PHE  34           HE2      PHE  34   2.107  17.596  18.447
    9    HZ   PHE  34           HZ       PHE  34   2.352  19.831  19.487

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ALA  35           H        ALA  35  -3.450  15.660  23.024
    2    HA   ALA  35           HA       ALA  35  -3.256  12.999  23.928
    3    HB3  ALA  35           HB1      ALA  35  -5.712  13.642  24.778
    4    HB1  ALA  35           HB2      ALA  35  -5.168  15.256  24.319
    5    HB2  ALA  35           HB3      ALA  35  -4.262  14.329  25.515

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA  36           H        ALA  36  -5.692  14.525  21.818
    2    HA   ALA  36           HA       ALA  36  -7.121  12.121  21.343
    3    HB1  ALA  36           HB1      ALA  36  -8.565  13.550  20.380
    4    HB3  ALA  36           HB2      ALA  36  -7.387  13.960  19.133
    5    HB2  ALA  36           HB3      ALA  36  -7.410  14.851  20.654

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA  37           H        ALA  37  -4.427  13.688  19.677
    2    HA   ALA  37           HA       ALA  37  -4.396  12.046  17.384
    3    HB3  ALA  37           HB1      ALA  37  -2.397  13.750  18.807
    4    HB2  ALA  37           HB2      ALA  37  -2.923  13.804  17.126
    5    HB1  ALA  37           HB3      ALA  37  -1.778  12.569  17.653

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LYS  38           H        LYS  38  -2.648  11.737  20.467
    2    HA   LYS  38           HA       LYS  38  -1.336   9.328  19.987
    3    HB2  LYS  38           HB2      LYS  38  -1.654  11.098  22.127
    4    HB3  LYS  38           HB3      LYS  38  -2.283   9.574  22.746
    5    HG2  LYS  38           HG2      LYS  38  -0.195   8.439  22.217
    6    HG3  LYS  38           HG3      LYS  38   0.425   9.879  21.401
    7    HD2  LYS  38           HD2      LYS  38   0.596  11.101  23.434
    8    HD3  LYS  38           HD3      LYS  38  -0.432   9.959  24.301
    9    HE2  LYS  38           HE2      LYS  38   1.920   9.631  24.927
   10    HE3  LYS  38           HE3      LYS  38   1.309   8.216  24.065
   11    HZ3  LYS  38           HZ1      LYS  38   2.616   8.623  22.286
   12    HZ2  LYS  38           HZ2      LYS  38   3.574   9.448  23.423
   13    HZ1  LYS  38           HZ3      LYS  38   2.502  10.312  22.427

  No H/Q in entry =          13
  In of MODEL   25
    1    H    ALA  39           H        ALA  39  -4.575   9.846  21.381
    2    HA   ALA  39           HA       ALA  39  -5.153   7.131  21.890
    3    HB3  ALA  39           HB1      ALA  39  -7.298   9.087  21.113
    4    HB2  ALA  39           HB2      ALA  39  -6.402   9.312  22.616
    5    HB1  ALA  39           HB3      ALA  39  -7.327   7.833  22.354

  No H/Q in entry =           5
  In of MODEL   25
    1    H    MET  40           H        MET  40  -5.719   9.141  19.038
    2    HA   MET  40           HA       MET  40  -7.203   7.214  17.578
    3    HB2  MET  40           HB2      MET  40  -5.577   9.598  16.672
    4    HB3  MET  40           HB3      MET  40  -6.606   8.642  15.601
    5    HG2  MET  40           HG2      MET  40  -7.639   9.903  18.154
    6    HG3  MET  40           HG3      MET  40  -7.688  10.735  16.601
    7    HE3  MET  40           HE1      MET  40 -10.276   9.125  14.535
    8    HE2  MET  40           HE2      MET  40  -8.523   9.232  14.391
    9    HE1  MET  40           HE3      MET  40  -9.434  10.604  15.019

  No H/Q in entry =           9
  In of MODEL   25
    1    H    MET  41           H        MET  41  -3.708   7.932  17.708
    2    HA   MET  41           HA       MET  41  -2.955   6.168  15.613
    3    HB2  MET  41           HB2      MET  41  -1.340   6.832  18.089
    4    HB3  MET  41           HB3      MET  41  -0.723   6.176  16.576
    5    HG2  MET  41           HG2      MET  41  -1.865   8.363  15.564
    6    HG3  MET  41           HG3      MET  41  -1.629   8.954  17.208
    7    HE2  MET  41           HE1      MET  41   1.276   6.840  17.581
    8    HE1  MET  41           HE2      MET  41   0.492   8.140  18.475
    9    HE3  MET  41           HE3      MET  41   2.119   8.373  17.835

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ASP  42           H        ASP  42  -3.351   5.705  19.099
    2    HA   ASP  42           HA       ASP  42  -2.329   3.106  19.268
    3    HB2  ASP  42           HB2      ASP  42  -3.198   4.875  21.084
    4    HB3  ASP  42           HB3      ASP  42  -4.630   3.857  21.011

  No H/Q in entry =           4
  In of MODEL   25
    1    H    GLN  43           H        GLN  43  -5.656   4.227  18.757
    2    HA   GLN  43           HA       GLN  43  -6.812   1.645  18.565
    3    HB2  GLN  43           HB2      GLN  43  -7.719   4.299  17.428
    4    HB3  GLN  43           HB3      GLN  43  -8.689   2.825  17.407
    5    HG2  GLN  43           HG2      GLN  43  -8.403   2.708  19.915
    6    HG3  GLN  43           HG3      GLN  43  -7.670   4.309  19.842
    7   HE21  GLN  43          HE21      GLN  43  -9.852   4.404  21.337
    8   HE22  GLN  43          HE22      GLN  43 -11.208   4.985  20.500

  No H/Q in entry =           8
  In of MODEL   25
    1    H    SER  44           H        SER  44  -5.454   3.846  16.152
    2    HA   SER  44           HA       SER  44  -6.157   2.360  13.864
    3    HB2  SER  44           HB2      SER  44  -4.890   4.738  14.306
    4    HB3  SER  44           HB3      SER  44  -3.539   3.734  13.781
    5    HG   SER  44           HG       SER  44  -4.642   4.707  12.013

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ARG  45           H        ARG  45  -3.286   2.237  15.952
    2    HA   ARG  45           HA       ARG  45  -1.812   0.272  14.579
    3    HB2  ARG  45           HB2      ARG  45  -0.968   1.693  16.446
    4    HB3  ARG  45           HB3      ARG  45  -1.967   0.770  17.566
    5    HG2  ARG  45           HG2      ARG  45  -0.745  -1.297  16.932
    6    HG3  ARG  45           HG3      ARG  45   0.279  -0.349  15.854
    7    HD2  ARG  45           HD2      ARG  45   1.015   1.032  17.808
    8    HD3  ARG  45           HD3      ARG  45   0.085  -0.035  18.882
    9    HE   ARG  45           HE       ARG  45   1.780  -1.644  17.309
   10   HH21  ARG  45          HH11      ARG  45   3.673  -2.474  18.154
   11   HH22  ARG  45          HH12      ARG  45   4.447  -1.689  19.485
   12   HH11  ARG  45          HH21      ARG  45   2.089   0.827  19.695
   13   HH12  ARG  45          HH22      ARG  45   3.550   0.182  20.355

  No H/Q in entry =          13
  In of MODEL   25
    1    H    MET  46           H        MET  46  -4.218  -0.030  17.173
    2    HA   MET  46           HA       MET  46  -4.066  -2.829  17.486
    3    HB2  MET  46           HB2      MET  46  -6.230  -0.813  18.075
    4    HB3  MET  46           HB3      MET  46  -6.440  -2.530  18.424
    5    HG2  MET  46           HG2      MET  46  -4.412  -2.505  19.818
    6    HG3  MET  46           HG3      MET  46  -4.174  -0.802  19.460
    7    HE3  MET  46           HE1      MET  46  -5.234  -0.496  23.130
    8    HE2  MET  46           HE2      MET  46  -4.224   0.174  21.853
    9    HE1  MET  46           HE3      MET  46  -4.062  -1.523  22.294

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ALA  47           H        ALA  47  -6.070  -0.806  15.382
    2    HA   ALA  47           HA       ALA  47  -7.696  -2.850  14.316
    3    HB3  ALA  47           HB1      ALA  47  -8.362  -0.610  13.894
    4    HB1  ALA  47           HB2      ALA  47  -7.872  -1.249  12.325
    5    HB2  ALA  47           HB3      ALA  47  -6.788  -0.185  13.222

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU  48           H        LEU  48  -4.567  -1.562  13.271
    2    HA   LEU  48           HA       LEU  48  -4.289  -3.159  10.934
    3    HB2  LEU  48           HB2      LEU  48  -2.229  -1.889  12.746
    4    HB3  LEU  48           HB3      LEU  48  -1.860  -2.616  11.181
    5    HG   LEU  48           HG       LEU  48  -3.870  -0.385  11.560
    6   HD13  LEU  48          HD11      LEU  48  -1.745   0.479  12.230
    7   HD12  LEU  48          HD12      LEU  48  -2.012   1.031  10.577
    8   HD11  LEU  48          HD13      LEU  48  -0.923  -0.322  10.891
    9   HD22  LEU  48          HD21      LEU  48  -4.342  -1.371   9.485
   10   HD21  LEU  48          HD22      LEU  48  -2.661  -1.817   9.196
   11   HD23  LEU  48          HD23      LEU  48  -3.169  -0.135   9.031

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ASN  49           H        ASN  49  -3.255  -3.556  14.284
    2    HA   ASN  49           HA       ASN  49  -1.667  -5.830  13.963
    3    HB2  ASN  49           HB2      ASN  49  -1.693  -4.488  16.008
    4    HB3  ASN  49           HB3      ASN  49  -3.353  -4.966  16.329
    5   HD21  ASN  49          HD21      ASN  49  -1.335  -5.487  18.228
    6   HD22  ASN  49          HD22      ASN  49  -1.075  -7.161  18.312

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLU  50           H        GLU  50  -5.136  -5.529  14.624
    2    HA   GLU  50           HA       GLU  50  -5.668  -8.325  14.737
    3    HB2  GLU  50           HB2      GLU  50  -7.244  -6.625  15.605
    4    HB3  GLU  50           HB3      GLU  50  -7.529  -6.061  13.956
    5    HG2  GLU  50           HG2      GLU  50  -8.408  -8.253  13.320
    6    HG3  GLU  50           HG3      GLU  50  -8.036  -8.896  14.916

  No H/Q in entry =           6
  In of MODEL   25
    1    H    ALA  51           H        ALA  51  -5.711  -5.932  12.136
    2    HA   ALA  51           HA       ALA  51  -6.703  -7.656  10.114
    3    HB2  ALA  51           HB1      ALA  51  -6.465  -5.848   8.742
    4    HB1  ALA  51           HB2      ALA  51  -4.825  -5.510   9.295
    5    HB3  ALA  51           HB3      ALA  51  -6.208  -4.986  10.258

  No H/Q in entry =           5
  In of MODEL   25
    1    H    HIS  52           H        HIS  52  -3.409  -6.773  11.106
    2    HA   HIS  52           HA       HIS  52  -2.015  -8.277   9.164
    3    HB2  HIS  52           HB2      HIS  52  -0.990  -6.541  10.625
    4    HB3  HIS  52           HB3      HIS  52  -1.140  -7.644  11.992
    5    HD1  HIS  52           HD1      HIS  52   0.327  -9.828  11.935
    6    HD2  HIS  52           HD2      HIS  52   1.121  -7.138   8.850
    7    HE1  HIS  52           HE1      HIS  52   2.522 -10.553  10.899
    8    HE2  HIS  52           HE2      HIS  52   3.020  -8.923   9.017

  No H/Q in entry =           8
  In of MODEL   25
    1    H    LEU  53           H        LEU  53  -3.244  -9.138  12.374
    2    HA   LEU  53           HA       LEU  53  -2.068 -11.692  12.577
    3    HB2  LEU  53           HB2      LEU  53  -4.544 -10.484  13.783
    4    HB3  LEU  53           HB3      LEU  53  -4.107 -12.164  14.076
    5    HG   LEU  53           HG       LEU  53  -2.176  -9.874  14.555
    6   HD12  LEU  53          HD11      LEU  53  -2.786 -10.220  16.988
    7   HD11  LEU  53          HD12      LEU  53  -4.161 -11.174  16.434
    8   HD13  LEU  53          HD13      LEU  53  -4.047  -9.468  16.017
    9   HD23  LEU  53          HD21      LEU  53  -1.317 -11.682  16.241
   10   HD22  LEU  53          HD22      LEU  53  -0.938 -11.881  14.533
   11   HD21  LEU  53          HD23      LEU  53  -2.233 -12.818  15.256

  No H/Q in entry =          11
  In of MODEL   25
    1    H    VAL  54           H        VAL  54  -5.166 -10.638  11.203
    2    HA   VAL  54           HA       VAL  54  -6.101 -13.226  10.518
    3    HB   VAL  54           HB       VAL  54  -6.720 -10.489   9.376
    4   HG12  VAL  54          HG11      VAL  54  -8.831 -11.850   8.560
    5   HG11  VAL  54          HG12      VAL  54  -7.732 -13.226   8.639
    6   HG13  VAL  54          HG13      VAL  54  -7.357 -11.856   7.595
    7   HG22  VAL  54          HG21      VAL  54  -7.634 -10.515  11.525
    8   HG21  VAL  54          HG22      VAL  54  -7.903 -12.256  11.508
    9   HG23  VAL  54          HG23      VAL  54  -8.972 -11.191  10.596

  No H/Q in entry =           9
  In of MODEL   25
    1    H    GLN  55           H        GLN  55  -4.202 -10.795   8.730
    2    HA   GLN  55           HA       GLN  55  -4.077 -12.265   6.316
    3    HB2  GLN  55           HB2      GLN  55  -3.452 -10.006   6.123
    4    HB3  GLN  55           HB3      GLN  55  -2.347 -10.090   7.492
    5    HG2  GLN  55           HG2      GLN  55  -0.633 -10.954   6.223
    6    HG3  GLN  55           HG3      GLN  55  -1.712 -11.921   5.227
    7   HE21  GLN  55          HE21      GLN  55  -1.716 -11.235   3.104
    8   HE22  GLN  55          HE22      GLN  55  -1.502  -9.634   2.592

  No H/Q in entry =           8
  In of MODEL   25
    1    H    THR  56           H        THR  56  -1.980 -12.257   9.203
    2    HA   THR  56           HA       THR  56   0.086 -13.877   8.295
    3    HB   THR  56           HB       THR  56  -1.166 -14.114  11.040
    4    HG1  THR  56           HG1      THR  56   0.909 -12.345  10.393
    5   HG22  THR  56          HG21      THR  56   1.759 -14.217  10.357
    6   HG21  THR  56          HG22      THR  56   0.752 -15.651  10.152
    7   HG23  THR  56          HG23      THR  56   0.919 -14.908  11.744

  No H/Q in entry =           7
  In of MODEL   25
    1    H    LYS  57           H        LYS  57  -3.048 -14.881   9.651
    2    HA   LYS  57           HA       LYS  57  -2.628 -17.682   9.412
    3    HB2  LYS  57           HB2      LYS  57  -4.442 -16.561  10.747
    4    HB3  LYS  57           HB3      LYS  57  -5.227 -16.125   9.237
    5    HG2  LYS  57           HG2      LYS  57  -5.499 -18.481   8.654
    6    HG3  LYS  57           HG3      LYS  57  -4.634 -18.967  10.110
    7    HD2  LYS  57           HD2      LYS  57  -6.397 -17.908  11.498
    8    HD3  LYS  57           HD3      LYS  57  -7.274 -17.466  10.034
    9    HE2  LYS  57           HE2      LYS  57  -6.555 -20.321  10.786
   10    HE3  LYS  57           HE3      LYS  57  -8.127 -19.591  11.105
   11    HZ1  LYS  57           HZ1      LYS  57  -7.423 -19.131   8.425
   12    HZ3  LYS  57           HZ2      LYS  57  -8.731 -20.022   9.043
   13    HZ2  LYS  57           HZ3      LYS  57  -7.240 -20.786   8.757

  No H/Q in entry =          13
  In of MODEL   25
    1    H    LEU  58           H        LEU  58  -3.929 -15.231   7.227
    2    HA   LEU  58           HA       LEU  58  -4.742 -17.053   5.221
    3    HB2  LEU  58           HB2      LEU  58  -4.107 -14.110   5.082
    4    HB3  LEU  58           HB3      LEU  58  -4.775 -15.043   3.742
    5    HG   LEU  58           HG       LEU  58  -6.062 -14.846   6.485
    6   HD11  LEU  58          HD11      LEU  58  -6.338 -13.201   3.989
    7   HD13  LEU  58          HD12      LEU  58  -6.329 -12.690   5.677
    8   HD12  LEU  58          HD13      LEU  58  -7.757 -13.471   5.002
    9   HD22  LEU  58          HD21      LEU  58  -7.040 -16.748   5.616
   10   HD21  LEU  58          HD22      LEU  58  -6.691 -16.302   3.946
   11   HD23  LEU  58          HD23      LEU  58  -8.050 -15.562   4.791

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  59           H        ILE  59  -1.598 -15.870   6.090
    2    HA   ILE  59           HA       ILE  59  -0.499 -16.614   3.459
    3    HB   ILE  59           HB       ILE  59   0.285 -14.551   5.022
    4   HG12  ILE  59          HG12      ILE  59   2.378 -16.225   3.621
    5   HG13  ILE  59          HG13      ILE  59   1.189 -15.299   2.743
    6   HG21  ILE  59          HG21      ILE  59   1.001 -16.321   6.796
    7   HG23  ILE  59          HG22      ILE  59   2.123 -15.031   6.426
    8   HG22  ILE  59          HG23      ILE  59   2.351 -16.634   5.731
    9   HD12  ILE  59          HD11      ILE  59   3.305 -14.039   3.056
   10   HD11  ILE  59          HD12      ILE  59   3.074 -14.144   4.799
   11   HD13  ILE  59          HD13      ILE  59   1.934 -13.231   3.811

  No H/Q in entry =          11
  In of MODEL   25
    1    H    GLU  60           H        GLU  60  -0.531 -17.713   6.829
    2    HA   GLU  60           HA       GLU  60   1.481 -19.711   6.575
    3    HB2  GLU  60           HB2      GLU  60   0.726 -18.921   8.762
    4    HB3  GLU  60           HB3      GLU  60  -0.891 -19.549   8.453
    5    HG2  GLU  60           HG2      GLU  60   0.025 -21.842   8.312
    6    HG3  GLU  60           HG3      GLU  60   1.640 -21.212   8.624

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLY  61           H        GLY  61  -2.029 -19.776   6.077
    2    HA3  GLY  61           HA2      GLY  61  -1.805 -22.573   5.126
    3    HA2  GLY  61           HA3      GLY  61  -3.285 -21.821   5.713

  No H/Q in entry =           3
  In of MODEL   25
    1    H    ASP  62           H        ASP  62  -1.031 -20.271   3.513
    2    HA   ASP  62           HA       ASP  62  -3.026 -19.516   1.679
    3    HB2  ASP  62           HB2      ASP  62  -1.128 -18.823   0.263
    4    HB3  ASP  62           HB3      ASP  62  -0.913 -18.310   1.933

  No H/Q in entry =           4
  In of MODEL   25
    1    H    ALA  63           H        ALA  63  -0.882 -22.348   1.718
    2    HA   ALA  63           HA       ALA  63  -1.304 -23.213  -0.950
    3    HB3  ALA  63           HB1      ALA  63   0.461 -24.210   0.298
    4    HB2  ALA  63           HB2      ALA  63  -0.718 -25.478  -0.034
    5    HB1  ALA  63           HB3      ALA  63  -0.646 -24.739   1.566

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLY  64           H        GLY  64  -2.294 -25.696   1.081
    2    HA3  GLY  64           HA2      GLY  64  -4.291 -26.769   1.481
    3    HA2  GLY  64           HA3      GLY  64  -5.115 -25.253   1.156

  No H/Q in entry =           3
  In of MODEL   25
    1    H    GLU  65           H        GLU  65  -3.036 -26.264  -1.371
    2    HA   GLU  65           HA       GLU  65  -5.244 -27.621  -2.759
    3    HB2  GLU  65           HB2      GLU  65  -3.765 -25.196  -3.771
    4    HB3  GLU  65           HB3      GLU  65  -4.753 -26.238  -4.795
    5    HG2  GLU  65           HG2      GLU  65  -6.717 -25.801  -3.411
    6    HG3  GLU  65           HG3      GLU  65  -5.748 -24.839  -2.297

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLY  66           H        GLY  66  -4.622 -28.540  -4.821
    2    HA3  GLY  66           HA2      GLY  66  -2.504 -30.351  -4.627
    3    HA2  GLY  66           HA3      GLY  66  -3.424 -30.006  -6.078

  No H/Q in entry =           3
  In of MODEL   25
    1    H    LYS  67           H        LYS  67  -2.713 -27.317  -6.407
    2    HA   LYS  67           HA       LYS  67  -0.057 -27.658  -7.527
    3    HB2  LYS  67           HB2      LYS  67  -0.580 -25.650  -8.810
    4    HB3  LYS  67           HB3      LYS  67  -1.904 -26.818  -8.910
    5    HG2  LYS  67           HG2      LYS  67  -3.063 -25.630  -7.061
    6    HG3  LYS  67           HG3      LYS  67  -1.770 -24.434  -7.039
    7    HD2  LYS  67           HD2      LYS  67  -2.291 -23.829  -9.377
    8    HD3  LYS  67           HD3      LYS  67  -3.595 -25.020  -9.389
    9    HE2  LYS  67           HE2      LYS  67  -4.708 -23.831  -7.538
   10    HE3  LYS  67           HE3      LYS  67  -3.405 -22.645  -7.511
   11    HZ2  LYS  67           HZ1      LYS  67  -5.673 -22.463  -8.982
   12    HZ1  LYS  67           HZ2      LYS  67  -4.543 -23.022 -10.118
   13    HZ3  LYS  67           HZ3      LYS  67  -4.250 -21.586  -9.260

  No H/Q in entry =          13
  In of MODEL   25
    1    H    MET  68           H        MET  68   1.525 -25.999  -7.508
    2    HA   MET  68           HA       MET  68   2.361 -25.280  -4.919
    3    HB2  MET  68           HB2      MET  68   3.321 -24.340  -7.624
    4    HB3  MET  68           HB3      MET  68   4.177 -24.084  -6.104
    5    HG2  MET  68           HG2      MET  68   3.591 -26.804  -6.079
    6    HG3  MET  68           HG3      MET  68   4.025 -26.484  -7.759
    7    HE3  MET  68           HE1      MET  68   5.947 -24.352  -4.591
    8    HE2  MET  68           HE2      MET  68   6.196 -25.957  -3.907
    9    HE1  MET  68           HE3      MET  68   4.572 -25.439  -4.352

  No H/Q in entry =           9
  In of MODEL   25
    1    H    LYS  69           H        LYS  69   0.818 -23.335  -7.459
    2    HA   LYS  69           HA       LYS  69   1.258 -20.799  -6.575
    3    HB2  LYS  69           HB2      LYS  69  -1.241 -21.919  -7.806
    4    HB3  LYS  69           HB3      LYS  69  -0.958 -20.191  -7.561
    5    HG2  LYS  69           HG2      LYS  69   1.126 -20.334  -8.862
    6    HG3  LYS  69           HG3      LYS  69   0.860 -22.060  -9.107
    7    HD2  LYS  69           HD2      LYS  69  -1.224 -21.589 -10.315
    8    HD3  LYS  69           HD3      LYS  69  -1.007 -19.859 -10.035
    9    HE2  LYS  69           HE2      LYS  69  -0.142 -20.191 -12.213
   10    HE3  LYS  69           HE3      LYS  69   1.290 -20.159 -11.185
   11    HZ2  LYS  69           HZ1      LYS  69   1.163 -22.024 -12.839
   12    HZ1  LYS  69           HZ2      LYS  69  -0.104 -22.669 -11.908
   13    HZ3  LYS  69           HZ3      LYS  69   1.445 -22.490 -11.232

  No H/Q in entry =          13
  In of MODEL   25
    1    H    VAL  70           H        VAL  70  -0.303 -19.196  -5.622
    2    HA   VAL  70           HA       VAL  70  -1.658 -20.287  -3.221
    3    HB   VAL  70           HB       VAL  70  -0.869 -18.264  -2.002
    4   HG12  VAL  70          HG11      VAL  70   1.380 -19.870  -3.248
    5   HG11  VAL  70          HG12      VAL  70   0.387 -20.408  -1.893
    6   HG13  VAL  70          HG13      VAL  70   1.444 -19.008  -1.710
    7   HG23  VAL  70          HG21      VAL  70   1.025 -16.951  -3.061
    8   HG22  VAL  70          HG22      VAL  70  -0.535 -16.718  -3.845
    9   HG21  VAL  70          HG23      VAL  70   0.668 -17.772  -4.582

  No H/Q in entry =           9
  In of MODEL   25
    1    H    SER  71           H        SER  71  -3.075 -18.507  -2.233
    2    HA   SER  71           HA       SER  71  -5.101 -17.763  -4.053
    3    HB2  SER  71           HB2      SER  71  -5.368 -18.043  -1.541
    4    HB3  SER  71           HB3      SER  71  -4.554 -16.494  -1.348
    5    HG   SER  71           HG       SER  71  -6.723 -16.076  -1.428

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU  72           H        LEU  72  -5.235 -16.131  -5.404
    2    HA   LEU  72           HA       LEU  72  -3.110 -14.339  -5.884
    3    HB2  LEU  72           HB2      LEU  72  -5.973 -14.364  -6.835
    4    HB3  LEU  72           HB3      LEU  72  -4.760 -13.224  -7.413
    5    HG   LEU  72           HG       LEU  72  -4.383 -16.235  -7.529
    6   HD12  LEU  72          HD11      LEU  72  -5.251 -14.389  -9.771
    7   HD11  LEU  72          HD12      LEU  72  -6.358 -15.428  -8.874
    8   HD13  LEU  72          HD13      LEU  72  -5.070 -16.142  -9.845
    9   HD22  LEU  72          HD21      LEU  72  -2.261 -15.261  -7.795
   10   HD21  LEU  72          HD22      LEU  72  -2.892 -13.838  -8.607
   11   HD23  LEU  72          HD23      LEU  72  -2.818 -15.378  -9.461

  No H/Q in entry =          11
  In of MODEL   25
    1    H    VAL  73           H        VAL  73  -6.204 -13.952  -4.262
    2    HA   VAL  73           HA       VAL  73  -6.225 -11.180  -3.915
    3    HB   VAL  73           HB       VAL  73  -7.971 -11.512  -2.383
    4   HG13  VAL  73          HG11      VAL  73  -9.402 -12.963  -3.558
    5   HG12  VAL  73          HG12      VAL  73  -8.098 -14.085  -3.944
    6   HG11  VAL  73          HG13      VAL  73  -8.194 -12.528  -4.767
    7   HG21  VAL  73          HG21      VAL  73  -6.651 -14.186  -1.868
    8   HG23  VAL  73          HG22      VAL  73  -8.294 -13.827  -1.335
    9   HG22  VAL  73          HG23      VAL  73  -6.939 -12.881  -0.718

  No H/Q in entry =           9
  In of MODEL   25
    1    H    LEU  74           H        LEU  74  -4.312 -13.563  -2.323
    2    HA   LEU  74           HA       LEU  74  -3.897 -12.422   0.199
    3    HB2  LEU  74           HB2      LEU  74  -3.129 -14.645  -0.285
    4    HB3  LEU  74           HB3      LEU  74  -2.077 -14.053  -1.571
    5    HG   LEU  74           HG       LEU  74  -0.745 -12.803   0.093
    6   HD13  LEU  74          HD11      LEU  74  -2.291 -12.273   1.817
    7   HD12  LEU  74          HD12      LEU  74  -1.226 -13.478   2.543
    8   HD11  LEU  74          HD13      LEU  74  -2.824 -13.948   1.964
    9   HD21  LEU  74          HD21      LEU  74  -0.598 -15.388  -0.483
   10   HD23  LEU  74          HD22      LEU  74  -0.992 -15.521   1.216
   11   HD22  LEU  74          HD23      LEU  74   0.449 -14.658   0.732

  No H/Q in entry =          11
  In of MODEL   25
    1    H    VAL  75           H        VAL  75  -1.996 -12.049  -2.755
    2    HA   VAL  75           HA       VAL  75  -0.184 -10.139  -1.743
    3    HB   VAL  75           HB       VAL  75  -1.137 -10.622  -4.567
    4   HG13  VAL  75          HG11      VAL  75  -0.262  -8.325  -4.368
    5   HG12  VAL  75          HG12      VAL  75   0.924  -9.333  -5.183
    6   HG11  VAL  75          HG13      VAL  75   1.143  -8.918  -3.490
    7   HG21  VAL  75          HG21      VAL  75   0.152 -12.402  -3.184
    8   HG23  VAL  75          HG22      VAL  75   1.526 -11.303  -3.310
    9   HG22  VAL  75          HG23      VAL  75   0.801 -11.978  -4.770

  No H/Q in entry =           9
  In of MODEL   25
    1    H    GLU  76           H        GLU  76  -3.328  -9.766  -3.408
    2    HA   GLU  76           HA       GLU  76  -3.355  -6.952  -3.513
    3    HB2  GLU  76           HB2      GLU  76  -5.021  -8.424  -4.661
    4    HB3  GLU  76           HB3      GLU  76  -5.706  -8.834  -3.097
    5    HG2  GLU  76           HG2      GLU  76  -6.322  -6.479  -2.724
    6    HG3  GLU  76           HG3      GLU  76  -5.628  -6.026  -4.268

  No H/Q in entry =           6
  In of MODEL   25
    1    H    ALA  77           H        ALA  77  -4.490  -9.167  -0.973
    2    HA   ALA  77           HA       ALA  77  -5.433  -7.154   0.781
    3    HB1  ALA  77           HB1      ALA  77  -4.468  -9.975   1.267
    4    HB3  ALA  77           HB2      ALA  77  -6.131  -9.397   1.188
    5    HB2  ALA  77           HB3      ALA  77  -5.107  -8.950   2.551

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLN  78           H        GLN  78  -2.299  -8.732   0.425
    2    HA   GLN  78           HA       GLN  78  -1.035  -7.580   2.677
    3    HB2  GLN  78           HB2      GLN  78  -0.190  -9.530   1.323
    4    HB3  GLN  78           HB3      GLN  78   0.262  -8.388   0.060
    5    HG2  GLN  78           HG2      GLN  78   1.726  -7.207   1.650
    6    HG3  GLN  78           HG3      GLN  78   1.280  -8.349   2.915
    7   HE21  GLN  78          HE21      GLN  78   3.216  -9.540   3.190
    8   HE22  GLN  78          HE22      GLN  78   4.008 -10.355   1.927

  No H/Q in entry =           8
  In of MODEL   25
    1    H    LEU  79           H        LEU  79  -1.385  -6.520  -0.672
    2    HA   LEU  79           HA       LEU  79   0.322  -4.309  -0.658
    3    HB2  LEU  79           HB2      LEU  79  -0.708  -5.109  -2.713
    4    HB3  LEU  79           HB3      LEU  79  -2.309  -4.701  -2.108
    5    HG   LEU  79           HG       LEU  79  -1.742  -2.319  -2.085
    6   HD13  LEU  79          HD11      LEU  79   0.499  -2.096  -1.568
    7   HD12  LEU  79          HD12      LEU  79   0.555  -1.812  -3.307
    8   HD11  LEU  79          HD13      LEU  79   0.992  -3.393  -2.658
    9   HD23  LEU  79          HD21      LEU  79  -1.101  -2.130  -4.636
   10   HD22  LEU  79          HD22      LEU  79  -2.635  -2.862  -4.179
   11   HD21  LEU  79          HD23      LEU  79  -1.271  -3.885  -4.619

  No H/Q in entry =          11
  In of MODEL   25
    1    H    HIS  80           H        HIS  80  -3.148  -4.437   0.161
    2    HA   HIS  80           HA       HIS  80  -3.314  -1.678   0.820
    3    HB2  HIS  80           HB2      HIS  80  -5.039  -4.069   1.139
    4    HB3  HIS  80           HB3      HIS  80  -5.349  -2.724   2.240
    5    HD1  HIS  80           HD1      HIS  80  -6.948  -1.073   1.327
    6    HD2  HIS  80           HD2      HIS  80  -4.767  -2.911  -1.714
    7    HE1  HIS  80           HE1      HIS  80  -7.774  -0.071  -0.855
    8    HE2  HIS  80           HE2      HIS  80  -6.450  -1.185  -2.718

  No H/Q in entry =           8
  In of MODEL   25
    1    H    LEU  81           H        LEU  81  -2.858  -4.575   2.818
    2    HA   LEU  81           HA       LEU  81  -2.837  -3.224   5.301
    3    HB2  LEU  81           HB2      LEU  81  -1.643  -5.854   4.427
    4    HB3  LEU  81           HB3      LEU  81  -1.615  -5.293   6.100
    5    HG   LEU  81           HG       LEU  81  -4.160  -5.522   4.467
    6   HD12  LEU  81          HD11      LEU  81  -4.487  -7.582   6.017
    7   HD11  LEU  81          HD12      LEU  81  -2.735  -7.529   6.206
    8   HD13  LEU  81          HD13      LEU  81  -3.442  -7.754   4.606
    9   HD23  LEU  81          HD21      LEU  81  -5.010  -5.713   6.967
   10   HD22  LEU  81          HD22      LEU  81  -4.668  -4.128   6.276
   11   HD21  LEU  81          HD23      LEU  81  -3.491  -4.900   7.339

  No H/Q in entry =          11
  In of MODEL   25
    1    H    MET  82           H        MET  82  -0.161  -4.158   3.137
    2    HA   MET  82           HA       MET  82   1.928  -3.284   4.824
    3    HB2  MET  82           HB2      MET  82   1.715  -3.627   1.832
    4    HB3  MET  82           HB3      MET  82   3.202  -3.071   2.597
    5    HG2  MET  82           HG2      MET  82   1.766  -5.644   3.322
    6    HG3  MET  82           HG3      MET  82   3.141  -5.551   2.225
    7    HE3  MET  82           HE1      MET  82   6.160  -4.844   4.214
    8    HE2  MET  82           HE2      MET  82   5.253  -3.468   3.592
    9    HE1  MET  82           HE3      MET  82   5.328  -4.960   2.658

  No H/Q in entry =           9
  In of MODEL   25
    1    H    THR  83           H        THR  83   0.129  -1.626   2.261
    2    HA   THR  83           HA       THR  83   1.567   0.807   2.347
    3    HB   THR  83           HB       THR  83  -0.597   1.754   1.355
    4    HG1  THR  83           HG1      THR  83  -2.261   0.475   1.247
    5   HG22  THR  83          HG21      THR  83  -0.343  -0.069  -0.642
    6   HG21  THR  83          HG22      THR  83   1.153  -0.377   0.238
    7   HG23  THR  83          HG23      THR  83   0.811   1.239  -0.380

  No H/Q in entry =           7
  In of MODEL   25
    1    H    SER  84           H        SER  84  -1.454  -0.190   3.944
    2    HA   SER  84           HA       SER  84  -1.926   2.247   5.284
    3    HB2  SER  84           HB2      SER  84  -2.791  -0.581   5.851
    4    HB3  SER  84           HB3      SER  84  -3.271   0.767   6.881
    5    HG   SER  84           HG       SER  84  -3.728   0.454   4.088

  No H/Q in entry =           5
  In of MODEL   25
    1    H    MET  85           H        MET  85  -0.250  -0.702   6.421
    2    HA   MET  85           HA       MET  85   0.274   0.222   9.025
    3    HB2  MET  85           HB2      MET  85   0.542  -2.125   8.360
    4    HB3  MET  85           HB3      MET  85   1.923  -1.682   7.356
    5    HG2  MET  85           HG2      MET  85   3.124  -0.857   9.340
    6    HG3  MET  85           HG3      MET  85   1.735  -1.251  10.352
    7    HE1  MET  85           HE1      MET  85   4.944  -2.312   8.826
    8    HE3  MET  85           HE2      MET  85   3.945  -2.923   7.510
    9    HE2  MET  85           HE3      MET  85   4.840  -4.050   8.524

  No H/Q in entry =           9
  In of MODEL   25
    1    H    LEU  86           H        LEU  86   2.218   0.452   6.077
    2    HA   LEU  86           HA       LEU  86   4.444   1.739   7.235
    3    HB2  LEU  86           HB2      LEU  86   4.245   0.655   4.928
    4    HB3  LEU  86           HB3      LEU  86   3.455   2.145   4.411
    5    HG   LEU  86           HG       LEU  86   5.495   3.370   5.394
    6   HD11  LEU  86          HD11      LEU  86   6.169   0.751   6.199
    7   HD13  LEU  86          HD12      LEU  86   7.189   2.185   6.296
    8   HD12  LEU  86          HD13      LEU  86   7.288   1.133   4.886
    9   HD23  LEU  86          HD21      LEU  86   6.196   1.595   3.047
   10   HD22  LEU  86          HD22      LEU  86   6.609   3.288   3.307
   11   HD21  LEU  86          HD23      LEU  86   4.951   2.838   2.906

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ALA  87           H        ALA  87   1.549   3.013   5.643
    2    HA   ALA  87           HA       ALA  87   2.175   5.736   5.723
    3    HB1  ALA  87           HB1      ALA  87  -0.152   4.134   5.181
    4    HB3  ALA  87           HB2      ALA  87   0.179   5.791   4.679
    5    HB2  ALA  87           HB3      ALA  87  -0.622   5.481   6.221

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ARG  88           H        ARG  88   0.457   3.758   8.114
    2    HA   ARG  88           HA       ARG  88  -0.034   5.817   9.956
    3    HB2  ARG  88           HB2      ARG  88  -1.000   3.475  10.024
    4    HB3  ARG  88           HB3      ARG  88   0.534   2.959  10.734
    5    HG2  ARG  88           HG2      ARG  88   0.078   5.041  12.350
    6    HG3  ARG  88           HG3      ARG  88  -1.591   4.734  11.891
    7    HD2  ARG  88           HD2      ARG  88  -1.722   2.889  13.141
    8    HD3  ARG  88           HD3      ARG  88  -0.138   2.288  12.614
    9    HE   ARG  88           HE       ARG  88  -0.662   3.561  15.064
   10   HH21  ARG  88          HH11      ARG  88   0.905   4.557  16.304
   11   HH22  ARG  88          HH12      ARG  88   2.430   4.966  15.602
   12   HH11  ARG  88          HH21      ARG  88   1.625   3.712  12.492
   13   HH12  ARG  88          HH22      ARG  88   2.846   4.471  13.455

  No H/Q in entry =          13
  In of MODEL   25
    1    H    GLU  89           H        GLU  89   2.737   3.566   9.742
    2    HA   GLU  89           HA       GLU  89   4.004   4.444  12.087
    3    HB2  GLU  89           HB2      GLU  89   4.643   2.416  10.748
    4    HB3  GLU  89           HB3      GLU  89   5.433   3.500   9.601
    5    HG2  GLU  89           HG2      GLU  89   6.924   4.333  11.346
    6    HG3  GLU  89           HG3      GLU  89   6.076   3.388  12.566

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LEU  90           H        LEU  90   4.341   5.593   8.758
    2    HA   LEU  90           HA       LEU  90   6.291   7.573   9.343
    3    HB2  LEU  90           HB2      LEU  90   4.286   7.259   7.113
    4    HB3  LEU  90           HB3      LEU  90   5.531   8.516   7.134
    5    HG   LEU  90           HG       LEU  90   6.172   5.573   7.474
    6   HD12  LEU  90          HD11      LEU  90   6.927   5.794   5.036
    7   HD11  LEU  90          HD12      LEU  90   5.928   7.246   4.983
    8   HD13  LEU  90          HD13      LEU  90   5.190   5.681   5.327
    9   HD22  LEU  90          HD21      LEU  90   8.080   6.704   8.158
   10   HD21  LEU  90          HD22      LEU  90   7.747   8.110   7.148
   11   HD23  LEU  90          HD23      LEU  90   8.392   6.637   6.425

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  91           H        ILE  91   2.753   7.626   9.187
    2    HA   ILE  91           HA       ILE  91   2.439  10.403   9.632
    3    HB   ILE  91           HB       ILE  91   0.622   8.047  10.176
    4   HG12  ILE  91          HG12      ILE  91   0.402  10.327   8.186
    5   HG13  ILE  91          HG13      ILE  91   1.247   8.823   7.819
    6   HG22  ILE  91          HG21      ILE  91  -1.089  10.123  10.232
    7   HG21  ILE  91          HG22      ILE  91   0.320  10.940  10.906
    8   HG23  ILE  91          HG23      ILE  91  -0.333   9.511  11.704
    9   HD13  ILE  91          HD11      ILE  91  -0.710   7.556   7.861
   10   HD12  ILE  91          HD12      ILE  91  -1.283   9.076   7.176
   11   HD11  ILE  91          HD13      ILE  91  -1.561   8.718   8.880

  No H/Q in entry =          11
  In of MODEL   25
    1    H    THR  92           H        THR  92   2.810   7.661  11.840
    2    HA   THR  92           HA       THR  92   2.375   9.044  14.260
    3    HB   THR  92           HB       THR  92   4.162   6.690  13.603
    4    HG1  THR  92           HG1      THR  92   2.186   5.952  13.500
    5   HG22  THR  92          HG21      THR  92   3.770   6.415  16.237
    6   HG21  THR  92          HG22      THR  92   3.723   8.174  16.160
    7   HG23  THR  92          HG23      THR  92   5.149   7.303  15.592

  No H/Q in entry =           7
  In of MODEL   25
    1    H    GLU  93           H        GLU  93   5.326   8.562  12.334
    2    HA   GLU  93           HA       GLU  93   7.090   9.976  14.032
    3    HB2  GLU  93           HB2      GLU  93   7.182   9.654  11.017
    4    HB3  GLU  93           HB3      GLU  93   8.525  10.173  12.034
    5    HG2  GLU  93           HG2      GLU  93   7.089   7.551  12.483
    6    HG3  GLU  93           HG3      GLU  93   8.477   7.688  11.410

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LEU  94           H        LEU  94   5.057  11.004  11.312
    2    HA   LEU  94           HA       LEU  94   5.887  13.700  11.208
    3    HB2  LEU  94           HB2      LEU  94   3.286  12.358  10.451
    4    HB3  LEU  94           HB3      LEU  94   3.561  14.082  10.207
    5    HG   LEU  94           HG       LEU  94   5.562  12.074   9.165
    6   HD11  LEU  94          HD11      LEU  94   2.828  12.647   8.095
    7   HD13  LEU  94          HD12      LEU  94   3.798  11.181   7.975
    8   HD12  LEU  94          HD13      LEU  94   4.148  12.557   6.929
    9   HD23  LEU  94          HD21      LEU  94   5.833  13.904   7.439
   10   HD22  LEU  94          HD22      LEU  94   6.249  14.396   9.081
   11   HD21  LEU  94          HD23      LEU  94   4.704  14.877   8.378

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  95           H        ILE  95   3.331  12.111  13.097
    2    HA   ILE  95           HA       ILE  95   2.306  14.472  14.284
    3    HB   ILE  95           HB       ILE  95   2.296  11.592  15.215
    4   HG12  ILE  95          HG12      ILE  95   0.093  13.383  14.157
    5   HG13  ILE  95          HG13      ILE  95   1.043  12.313  13.129
    6   HG21  ILE  95          HG21      ILE  95   1.032  14.078  16.408
    7   HG23  ILE  95          HG22      ILE  95   2.068  12.902  17.218
    8   HG22  ILE  95          HG23      ILE  95   0.430  12.454  16.740
    9   HD13  ILE  95          HD11      ILE  95   0.121  10.385  14.051
   10   HD12  ILE  95          HD12      ILE  95  -1.252  11.486  14.121
   11   HD11  ILE  95          HD13      ILE  95  -0.293  11.183  15.569

  No H/Q in entry =          11
  In of MODEL   25
    1    H    GLU  96           H        GLU  96   4.880  12.233  15.291
    2    HA   GLU  96           HA       GLU  96   5.439  13.432  17.782
    3    HB2  GLU  96           HB2      GLU  96   6.370  11.264  17.141
    4    HB3  GLU  96           HB3      GLU  96   7.313  12.027  15.862
    5    HG2  GLU  96           HG2      GLU  96   8.963  12.565  17.327
    6    HG3  GLU  96           HG3      GLU  96   7.820  13.390  18.377

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LEU  97           H        LEU  97   6.528  14.188  14.497
    2    HA   LEU  97           HA       LEU  97   8.428  16.171  15.209
    3    HB2  LEU  97           HB2      LEU  97   6.838  15.629  12.711
    4    HB3  LEU  97           HB3      LEU  97   7.869  17.052  12.832
    5    HG   LEU  97           HG       LEU  97   8.874  14.248  13.401
    6   HD12  LEU  97          HD11      LEU  97   9.878  14.429  11.086
    7   HD11  LEU  97          HD12      LEU  97   8.839  15.827  10.816
    8   HD13  LEU  97          HD13      LEU  97   8.126  14.241  11.113
    9   HD23  LEU  97          HD21      LEU  97  11.055  15.508  12.660
   10   HD22  LEU  97          HD22      LEU  97  10.434  15.786  14.287
   11   HD21  LEU  97          HD23      LEU  97  10.133  16.969  13.016

  No H/Q in entry =          11
  In of MODEL   25
    1    H    HIS  98           H        HIS  98   4.940  16.332  14.545
    2    HA   HIS  98           HA       HIS  98   4.662  19.134  14.674
    3    HB2  HIS  98           HB2      HIS  98   2.753  16.900  15.400
    4    HB3  HIS  98           HB3      HIS  98   2.299  18.604  15.451
    5    HD1  HIS  98           HD1      HIS  98   3.305  15.876  13.054
    6    HD2  HIS  98           HD2      HIS  98   1.960  19.820  12.920
    7    HE1  HIS  98           HE1      HIS  98   2.756  16.364  10.628
    8    HE2  HIS  98           HE2      HIS  98   1.940  18.759  10.525

  No H/Q in entry =           8
  In of MODEL   25
    1    H    GLU  99           H        GLU  99   4.769  16.650  17.179
    2    HA   GLU  99           HA       GLU  99   4.169  18.354  19.371
    3    HB2  GLU  99           HB2      GLU  99   4.061  15.873  19.473
    4    HB3  GLU  99           HB3      GLU  99   5.821  15.814  19.370
    5    HG2  GLU  99           HG2      GLU  99   6.014  17.110  21.442
    6    HG3  GLU  99           HG3      GLU  99   4.262  17.264  21.532

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LYS 100           H        LYS 100   7.219  17.397  17.816
    2    HA   LYS 100           HA       LYS 100   8.880  18.789  19.674
    3    HB2  LYS 100           HB2      LYS 100   9.379  17.854  16.838
    4    HB3  LYS 100           HB3      LYS 100  10.612  18.617  17.848
    5    HG2  LYS 100           HG2      LYS 100  10.218  16.873  19.592
    6    HG3  LYS 100           HG3      LYS 100   9.083  16.075  18.499
    7    HD2  LYS 100           HD2      LYS 100  10.879  15.775  16.837
    8    HD3  LYS 100           HD3      LYS 100  12.019  16.585  17.915
    9    HE2  LYS 100           HE2      LYS 100  11.605  14.836  19.636
   10    HE3  LYS 100           HE3      LYS 100  10.527  14.006  18.509
   11    HZ1  LYS 100           HZ1      LYS 100  13.354  14.653  17.860
   12    HZ3  LYS 100           HZ2      LYS 100  12.304  13.604  17.031
   13    HZ2  LYS 100           HZ3      LYS 100  12.886  13.184  18.572

  No H/Q in entry =          13
  In of MODEL   25
    1    H    LEU 101           H        LEU 101   7.201  19.722  16.712
    2    HA   LEU 101           HA       LEU 101   8.436  22.269  16.375
    3    HB2  LEU 101           HB2      LEU 101   5.833  21.054  15.484
    4    HB3  LEU 101           HB3      LEU 101   6.098  22.782  15.274
    5    HG   LEU 101           HG       LEU 101   8.121  20.748  14.317
    6   HD12  LEU 101          HD11      LEU 101   6.977  21.258  12.028
    7   HD11  LEU 101          HD12      LEU 101   5.579  21.701  13.005
    8   HD13  LEU 101          HD13      LEU 101   6.230  20.066  13.091
    9   HD21  LEU 101          HD21      LEU 101   7.517  23.664  13.754
   10   HD23  LEU 101          HD22      LEU 101   8.493  22.694  12.652
   11   HD22  LEU 101          HD23      LEU 101   9.033  22.951  14.311

  No H/Q in entry =          11
  In of MODEL   25
    1    H    LYS 102           H        LYS 102   6.884  21.149  18.989
    2    HA   LYS 102           HA       LYS 102   6.255  22.249  20.917
    3    HB2  LYS 102           HB2      LYS 102   7.556  24.227  19.792
    4    HB3  LYS 102           HB3      LYS 102   5.963  24.843  19.411
    5    HG2  LYS 102           HG2      LYS 102   7.331  24.582  22.067
    6    HG3  LYS 102           HG3      LYS 102   6.391  25.917  21.433
    7    HD2  LYS 102           HD2      LYS 102   5.124  23.292  22.314
    8    HD3  LYS 102           HD3      LYS 102   5.381  24.654  23.395
    9    HE2  LYS 102           HE2      LYS 102   3.102  24.266  21.902
   10    HE3  LYS 102           HE3      LYS 102   3.616  25.809  22.582
   11    HZ2  LYS 102           HZ1      LYS 102   3.092  25.916  20.201
   12    HZ1  LYS 102           HZ2      LYS 102   4.345  24.824  19.883
   13    HZ3  LYS 102           HZ3      LYS 102   4.699  26.353  20.524

  No H/Q in entry =          13
  In of MODEL   25
    1    H    ALA 103           H        ALA 103   4.636  23.799  18.143
    2    HA   ALA 103           HA       ALA 103   2.185  24.397  19.021
    3    HB1  ALA 103           HB1      ALA 103   1.285  23.559  16.778
    4    HB2  ALA 103           HB2      ALA 103   2.929  23.008  16.453
    5    HB3  ALA 103           HB3      ALA 103   2.607  24.723  16.715

  No H/Q in entry =           5
  In of MODEL   25
    1    H1   ALA   1           H3       ALA   1  10.483 -20.221  -6.145
    2    H2   ALA   1           H2       ALA   1   9.520 -20.422  -7.532
    3    H3   ALA   1           H1       ALA   1   9.073 -21.161  -6.069
    4    HA   ALA   1           HA       ALA   1  10.099 -22.981  -6.803
    5    HB1  ALA   1           HB1      ALA   1  10.202 -22.627  -9.079
    6    HB2  ALA   1           HB2      ALA   1  11.930 -22.491  -8.746
    7    HB3  ALA   1           HB3      ALA   1  10.945 -21.035  -8.902

  No H/Q in entry =           7
  In of MODEL   25
    1    H    GLU   2           H        GLU   2  12.374 -23.951  -6.854
    2    HA   GLU   2           HA       GLU   2  13.751 -23.878  -4.639
    3    HB2  GLU   2           HB2      GLU   2  15.114 -23.763  -7.335
    4    HB3  GLU   2           HB3      GLU   2  15.834 -24.378  -5.848
    5    HG2  GLU   2           HG2      GLU   2  14.800 -26.386  -6.087
    6    HG3  GLU   2           HG3      GLU   2  13.236 -25.627  -6.350

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLU   3           H        GLU   3  15.544 -22.033  -7.040
    2    HA   GLU   3           HA       GLU   3  16.708 -20.353  -5.081
    3    HB2  GLU   3           HB2      GLU   3  16.659 -20.356  -8.091
    4    HB3  GLU   3           HB3      GLU   3  17.414 -19.032  -7.205
    5    HG2  GLU   3           HG2      GLU   3  19.063 -20.419  -6.276
    6    HG3  GLU   3           HG3      GLU   3  18.104 -21.878  -6.496

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LEU   4           H        LEU   4  14.439 -19.489  -7.718
    2    HA   LEU   4           HA       LEU   4  13.995 -16.875  -7.113
    3    HB2  LEU   4           HB2      LEU   4  11.804 -18.832  -7.844
    4    HB3  LEU   4           HB3      LEU   4  11.745 -17.083  -8.046
    5    HG   LEU   4           HG       LEU   4  13.695 -18.966  -9.411
    6   HD13  LEU   4          HD11      LEU   4  12.399 -18.809 -11.324
    7   HD12  LEU   4          HD12      LEU   4  11.704 -17.257 -10.861
    8   HD11  LEU   4          HD13      LEU   4  11.135 -18.741 -10.098
    9   HD23  LEU   4          HD21      LEU   4  14.055 -16.726 -10.766
   10   HD22  LEU   4          HD22      LEU   4  14.909 -16.974  -9.245
   11   HD21  LEU   4          HD23      LEU   4  13.466 -15.964  -9.289

  No H/Q in entry =          11
  In of MODEL   25
    1    H    GLU   5           H        GLU   5  12.482 -19.643  -5.469
    2    HA   GLU   5           HA       GLU   5  10.815 -18.053  -3.772
    3    HB2  GLU   5           HB2      GLU   5  10.371 -20.429  -4.290
    4    HB3  GLU   5           HB3      GLU   5  11.798 -20.876  -3.354
    5    HG2  GLU   5           HG2      GLU   5  10.832 -19.833  -1.351
    6    HG3  GLU   5           HG3      GLU   5   9.415 -19.344  -2.280

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLU   6           H        GLU   6  13.946 -19.660  -3.320
    2    HA   GLU   6           HA       GLU   6  14.301 -18.802  -0.622
    3    HB2  GLU   6           HB2      GLU   6  15.513 -20.729  -1.598
    4    HB3  GLU   6           HB3      GLU   6  16.381 -19.623  -2.667
    5    HG2  GLU   6           HG2      GLU   6  17.323 -18.457  -0.720
    6    HG3  GLU   6           HG3      GLU   6  16.436 -19.527   0.364

  No H/Q in entry =           6
  In of MODEL   25
    1    H    VAL   7           H        VAL   7  15.085 -17.488  -3.773
    2    HA   VAL   7           HA       VAL   7  16.788 -15.374  -2.909
    3    HB   VAL   7           HB       VAL   7  15.084 -15.728  -5.389
    4   HG11  VAL   7          HG11      VAL   7  16.994 -13.529  -4.577
    5   HG13  VAL   7          HG12      VAL   7  15.355 -13.374  -5.204
    6   HG12  VAL   7          HG13      VAL   7  16.662 -13.890  -6.271
    7   HG21  VAL   7          HG21      VAL   7  17.177 -17.201  -4.813
    8   HG23  VAL   7          HG22      VAL   7  18.095 -15.749  -5.212
    9   HG22  VAL   7          HG23      VAL   7  17.055 -16.492  -6.424

  No H/Q in entry =           9
  In of MODEL   25
    1    H    VAL   8           H        VAL   8  13.294 -15.615  -3.472
    2    HA   VAL   8           HA       VAL   8  12.650 -12.901  -3.007
    3    HB   VAL   8           HB       VAL   8  11.066 -15.454  -2.698
    4   HG13  VAL   8          HG11      VAL   8  10.000 -14.070  -1.122
    5   HG12  VAL   8          HG12      VAL   8   9.092 -13.750  -2.599
    6   HG11  VAL   8          HG13      VAL   8  10.317 -12.607  -2.054
    7   HG23  VAL   8          HG21      VAL   8   9.946 -13.645  -4.593
    8   HG22  VAL   8          HG22      VAL   8  10.795 -15.150  -4.931
    9   HG21  VAL   8          HG23      VAL   8  11.686 -13.633  -4.877

  No H/Q in entry =           9
  In of MODEL   25
    1    H    MET   9           H        MET   9  12.889 -15.704  -0.822
    2    HA   MET   9           HA       MET   9  12.080 -14.421   1.545
    3    HB2  MET   9           HB2      MET   9  13.977 -16.709   1.018
    4    HB3  MET   9           HB3      MET   9  13.660 -16.127   2.653
    5    HG2  MET   9           HG2      MET   9  11.256 -16.527   2.352
    6    HG3  MET   9           HG3      MET   9  11.542 -17.063   0.695
    7    HE2  MET   9           HE1      MET   9  12.272 -18.941   4.672
    8    HE1  MET   9           HE2      MET   9  12.379 -17.246   4.204
    9    HE3  MET   9           HE3      MET   9  13.809 -18.271   4.111

  No H/Q in entry =           9
  In of MODEL   25
    1    H    GLY  10           H        GLY  10  15.262 -14.674  -0.005
    2    HA3  GLY  10           HA2      GLY  10  16.728 -13.261   1.966
    3    HA2  GLY  10           HA3      GLY  10  17.193 -13.433   0.273

  No H/Q in entry =           3
  In of MODEL   25
    1    H    LEU  11           H        LEU  11  15.037 -12.198  -0.973
    2    HA   LEU  11           HA       LEU  11  15.743  -9.458  -0.813
    3    HB2  LEU  11           HB2      LEU  11  13.367 -10.852  -2.051
    4    HB3  LEU  11           HB3      LEU  11  13.661  -9.120  -2.213
    5    HG   LEU  11           HG       LEU  11  15.674 -11.245  -2.993
    6   HD13  LEU  11          HD11      LEU  11  13.929 -11.602  -4.516
    7   HD12  LEU  11          HD12      LEU  11  14.942 -10.430  -5.356
    8   HD11  LEU  11          HD13      LEU  11  13.471  -9.899  -4.542
    9   HD22  LEU  11          HD21      LEU  11  16.919  -9.291  -2.768
   10   HD21  LEU  11          HD22      LEU  11  15.553  -8.245  -3.151
   11   HD23  LEU  11          HD23      LEU  11  16.380  -9.122  -4.437

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  12           H        ILE  12  12.958 -11.261   0.452
    2    HA   ILE  12           HA       ILE  12  11.578  -9.025   1.504
    3    HB   ILE  12           HB       ILE  12  11.593 -11.907   2.455
    4   HG12  ILE  12          HG12      ILE  12  10.910 -11.274   0.008
    5   HG13  ILE  12          HG13      ILE  12   9.868 -12.346   0.923
    6   HG21  ILE  12          HG21      ILE  12   9.672  -9.624   3.015
    7   HG23  ILE  12          HG22      ILE  12  10.658 -10.491   4.192
    8   HG22  ILE  12          HG23      ILE  12   9.328 -11.314   3.379
    9   HD13  ILE  12          HD11      ILE  12   8.363 -10.517   1.415
   10   HD12  ILE  12          HD12      ILE  12   8.663 -10.531  -0.321
   11   HD11  ILE  12          HD13      ILE  12   9.471  -9.361   0.698

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  13           H        ILE  13  13.953 -11.244   2.919
    2    HA   ILE  13           HA       ILE  13  13.991 -10.060   5.497
    3    HB   ILE  13           HB       ILE  13  16.045 -11.647   3.939
    4   HG12  ILE  13          HG12      ILE  13  13.756 -12.594   4.779
    5   HG13  ILE  13          HG13      ILE  13  15.224 -13.531   5.040
    6   HG21  ILE  13          HG21      ILE  13  16.163 -10.555   6.752
    7   HG23  ILE  13          HG22      ILE  13  17.392 -10.468   5.498
    8   HG22  ILE  13          HG23      ILE  13  17.061 -12.003   6.301
    9   HD11  ILE  13          HD11      ILE  13  14.069 -11.638   7.120
   10   HD13  ILE  13          HD12      ILE  13  15.365 -12.809   7.335
   11   HD12  ILE  13          HD13      ILE  13  13.719 -13.364   7.065

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ASN  14           H        ASN  14  15.954  -9.546   2.582
    2    HA   ASN  14           HA       ASN  14  17.707  -7.613   3.644
    3    HB2  ASN  14           HB2      ASN  14  17.683  -8.884   1.331
    4    HB3  ASN  14           HB3      ASN  14  16.799  -7.463   0.789
    5   HD21  ASN  14          HD21      ASN  14  19.240  -7.818  -0.390
    6   HD22  ASN  14          HD22      ASN  14  20.388  -6.740   0.237

  No H/Q in entry =           6
  In of MODEL   25
    1    H    SER  15           H        SER  15  14.602  -7.252   1.944
    2    HA   SER  15           HA       SER  15  14.505  -4.431   1.995
    3    HB2  SER  15           HB2      SER  15  12.172  -4.667   1.495
    4    HB3  SER  15           HB3      SER  15  12.964  -6.036   0.727
    5    HG   SER  15           HG       SER  15  11.341  -5.937   3.002

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLY  16           H        GLY  16  13.393  -6.881   4.300
    2    HA3  GLY  16           HA2      GLY  16  12.176  -5.122   6.152
    3    HA2  GLY  16           HA3      GLY  16  12.782  -6.733   6.518

  No H/Q in entry =           3
  In of MODEL   25
    1    H    GLN  17           H        GLN  17  15.497  -6.414   5.932
    2    HA   GLN  17           HA       GLN  17  16.453  -5.193   8.312
    3    HB2  GLN  17           HB2      GLN  17  17.885  -6.040   5.778
    4    HB3  GLN  17           HB3      GLN  17  18.719  -5.467   7.224
    5    HG2  GLN  17           HG2      GLN  17  16.775  -7.787   7.226
    6    HG3  GLN  17           HG3      GLN  17  18.519  -7.979   7.069
    7   HE21  GLN  17          HE21      GLN  17  19.799  -7.786   8.976
    8   HE22  GLN  17          HE22      GLN  17  19.136  -7.482  10.509

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ALA  18           H        ALA  18  16.278  -4.121   4.950
    2    HA   ALA  18           HA       ALA  18  17.724  -1.734   5.176
    3    HB1  ALA  18           HB1      ALA  18  16.606  -2.948   3.108
    4    HB3  ALA  18           HB2      ALA  18  16.878  -1.206   3.089
    5    HB2  ALA  18           HB3      ALA  18  15.275  -1.844   3.456

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ARG  19           H        ARG  19  14.221  -2.306   5.565
    2    HA   ARG  19           HA       ARG  19  13.563   0.348   6.273
    3    HB2  ARG  19           HB2      ARG  19  11.875  -1.397   5.685
    4    HB3  ARG  19           HB3      ARG  19  12.210  -2.193   7.225
    5    HG2  ARG  19           HG2      ARG  19  11.505  -0.197   8.459
    6    HG3  ARG  19           HG3      ARG  19  11.262   0.678   6.948
    7    HD2  ARG  19           HD2      ARG  19   9.115  -0.108   7.764
    8    HD3  ARG  19           HD3      ARG  19   9.534  -0.992   6.290
    9    HE   ARG  19           HE       ARG  19  10.481  -2.534   8.401
   10   HH21  ARG  19          HH11      ARG  19   9.222  -4.167   9.340
   11   HH22  ARG  19          HH12      ARG  19   7.503  -4.132   9.164
   12   HH11  ARG  19          HH21      ARG  19   7.495  -1.231   7.296
   13   HH12  ARG  19          HH22      ARG  19   6.525  -2.470   8.003

  No H/Q in entry =          13
  In of MODEL   25
    1    H    SER  20           H        SER  20  14.403  -2.482   8.240
    2    HA   SER  20           HA       SER  20  14.118  -1.376  10.774
    3    HB2  SER  20           HB2      SER  20  14.574  -3.702  10.659
    4    HB3  SER  20           HB3      SER  20  16.029  -3.449   9.698
    5    HG   SER  20           HG       SER  20  15.608  -3.211  12.431

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU  21           H        LEU  21  16.967  -1.331   8.645
    2    HA   LEU  21           HA       LEU  21  18.643   0.151  10.385
    3    HB2  LEU  21           HB2      LEU  21  18.628  -0.131   7.373
    4    HB3  LEU  21           HB3      LEU  21  19.881   0.732   8.260
    5    HG   LEU  21           HG       LEU  21  19.139  -2.156   8.813
    6   HD13  LEU  21          HD11      LEU  21  19.991  -2.142   6.585
    7   HD12  LEU  21          HD12      LEU  21  21.355  -2.596   7.606
    8   HD11  LEU  21          HD13      LEU  21  21.228  -0.951   6.987
    9   HD21  LEU  21          HD21      LEU  21  21.273  -0.261   9.786
   10   HD23  LEU  21          HD22      LEU  21  21.626  -1.984   9.729
   11   HD22  LEU  21          HD23      LEU  21  20.303  -1.393  10.721

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ALA  22           H        ALA  22  16.391   1.125   7.821
    2    HA   ALA  22           HA       ALA  22  16.942   3.881   7.832
    3    HB3  ALA  22           HB1      ALA  22  15.538   2.642   6.152
    4    HB2  ALA  22           HB2      ALA  22  14.836   4.158   6.714
    5    HB1  ALA  22           HB3      ALA  22  14.237   2.623   7.343

  No H/Q in entry =           5
  In of MODEL   25
    1    H    TYR  23           H        TYR  23  14.432   2.080   9.663
    2    HA   TYR  23           HA       TYR  23  13.475   4.324  11.106
    3    HB2  TYR  23           HB2      TYR  23  12.229   2.217  11.086
    4    HB3  TYR  23           HB3      TYR  23  13.555   1.400  11.914
    5    HD1  TYR  23           HD1      TYR  23  11.051   4.141  12.271
    6    HD2  TYR  23           HD2      TYR  23  13.763   1.479  14.271
    7    HE1  TYR  23           HE1      TYR  23  10.122   4.840  14.463
    8    HE2  TYR  23           HE2      TYR  23  12.835   2.177  16.461
    9    HH   TYR  23           HH       TYR  23  10.256   4.635  16.664

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ALA  24           H        ALA  24  16.108   2.037  11.754
    2    HA   ALA  24           HA       ALA  24  16.776   3.034  14.318
    3    HB1  ALA  24           HB1      ALA  24  18.124   1.234  14.160
    4    HB3  ALA  24           HB2      ALA  24  19.159   2.148  13.062
    5    HB2  ALA  24           HB3      ALA  24  17.861   1.145  12.419

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA  25           H        ALA  25  17.746   3.952  11.040
    2    HA   ALA  25           HA       ALA  25  19.699   5.878  11.687
    3    HB1  ALA  25           HB1      ALA  25  18.985   4.929   9.372
    4    HB3  ALA  25           HB2      ALA  25  19.494   6.614   9.463
    5    HB2  ALA  25           HB3      ALA  25  17.778   6.216   9.390

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU  26           H        LEU  26  16.187   6.124  11.316
    2    HA   LEU  26           HA       LEU  26  15.976   8.908  11.761
    3    HB2  LEU  26           HB2      LEU  26  14.110   7.680  10.830
    4    HB3  LEU  26           HB3      LEU  26  14.010   6.656  12.257
    5    HG   LEU  26           HG       LEU  26  13.411   8.619  13.632
    6   HD12  LEU  26          HD11      LEU  26  12.765  10.721  12.301
    7   HD11  LEU  26          HD12      LEU  26  13.746  10.060  10.996
    8   HD13  LEU  26          HD13      LEU  26  14.488  10.444  12.549
    9   HD21  LEU  26          HD21      LEU  26  11.741   8.311  11.118
   10   HD23  LEU  26          HD22      LEU  26  11.180   9.014  12.632
   11   HD22  LEU  26          HD23      LEU  26  11.623   7.310  12.566

  No H/Q in entry =          11
  In of MODEL   25
    1    H    LYS  27           H        LYS  27  15.846   6.133  13.959
    2    HA   LYS  27           HA       LYS  27  15.255   7.507  16.323
    3    HB2  LYS  27           HB2      LYS  27  15.270   5.031  16.063
    4    HB3  LYS  27           HB3      LYS  27  17.033   5.073  16.024
    5    HG2  LYS  27           HG2      LYS  27  17.083   6.063  18.272
    6    HG3  LYS  27           HG3      LYS  27  15.316   6.091  18.313
    7    HD2  LYS  27           HD2      LYS  27  15.277   3.624  18.080
    8    HD3  LYS  27           HD3      LYS  27  17.042   3.603  18.073
    9    HE2  LYS  27           HE2      LYS  27  17.075   4.596  20.328
   10    HE3  LYS  27           HE3      LYS  27  15.310   4.647  20.338
   11    HZ3  LYS  27           HZ1      LYS  27  16.083   2.692  21.494
   12    HZ2  LYS  27           HZ2      LYS  27  17.000   2.205  20.147
   13    HZ1  LYS  27           HZ3      LYS  27  15.302   2.220  20.063

  No H/Q in entry =          13
  In of MODEL   25
    1    H    GLN  28           H        GLN  28  18.372   6.903  14.741
    2    HA   GLN  28           HA       GLN  28  20.057   7.979  16.734
    3    HB2  GLN  28           HB2      GLN  28  20.353   7.928  13.720
    4    HB3  GLN  28           HB3      GLN  28  21.640   8.391  14.834
    5    HG2  GLN  28           HG2      GLN  28  20.202   5.723  14.866
    6    HG3  GLN  28           HG3      GLN  28  21.792   6.000  14.160
    7   HE21  GLN  28          HE21      GLN  28  20.491   4.688  16.847
    8   HE22  GLN  28          HE22      GLN  28  21.671   5.103  17.995

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ALA  29           H        ALA  29  18.323   9.469  14.034
    2    HA   ALA  29           HA       ALA  29  19.338  12.083  14.285
    3    HB2  ALA  29           HB1      ALA  29  17.648  12.728  12.808
    4    HB1  ALA  29           HB2      ALA  29  16.495  11.564  13.458
    5    HB3  ALA  29           HB3      ALA  29  17.824  11.011  12.440

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LYS  30           H        LYS  30  16.547  10.505  15.801
    2    HA   LYS  30           HA       LYS  30  15.545  12.768  17.152
    3    HB2  LYS  30           HB2      LYS  30  15.410   9.829  17.860
    4    HB3  LYS  30           HB3      LYS  30  14.551  11.087  18.749
    5    HG2  LYS  30           HG2      LYS  30  13.437  11.778  16.627
    6    HG3  LYS  30           HG3      LYS  30  14.234  10.434  15.804
    7    HD2  LYS  30           HD2      LYS  30  13.146   8.838  17.333
    8    HD3  LYS  30           HD3      LYS  30  12.359  10.170  18.179
    9    HE2  LYS  30           HE2      LYS  30  11.201  10.808  16.082
   10    HE3  LYS  30           HE3      LYS  30  11.968   9.447  15.256
   11    HZ2  LYS  30           HZ1      LYS  30   9.654   9.056  16.130
   12    HZ1  LYS  30           HZ2      LYS  30  10.318   9.107  17.699
   13    HZ3  LYS  30           HZ3      LYS  30  10.820   7.916  16.592

  No H/Q in entry =          13
  In of MODEL   25
    1    H    GLN  31           H        GLN  31  18.187  10.580  17.900
    2    HA   GLN  31           HA       GLN  31  18.515  11.597  20.593
    3    HB2  GLN  31           HB2      GLN  31  20.530  10.008  18.997
    4    HB3  GLN  31           HB3      GLN  31  20.392  10.136  20.751
    5    HG2  GLN  31           HG2      GLN  31  17.874   9.202  19.977
    6    HG3  GLN  31           HG3      GLN  31  18.972   8.347  18.901
    7   HE21  GLN  31          HE21      GLN  31  17.414   7.217  21.175
    8   HE22  GLN  31          HE22      GLN  31  18.562   6.549  22.230

  No H/Q in entry =           8
  In of MODEL   25
    1    H    GLY  32           H        GLY  32  19.052  12.905  17.626
    2    HA3  GLY  32           HA2      GLY  32  20.054  14.942  17.111
    3    HA2  GLY  32           HA3      GLY  32  20.807  14.944  18.701

  No H/Q in entry =           3
  In of MODEL   25
    1    H    ASP  33           H        ASP  33  21.212  12.045  16.930
    2    HA   ASP  33           HA       ASP  33  24.043  12.698  16.470
    3    HB2  ASP  33           HB2      ASP  33  22.515  10.094  16.587
    4    HB3  ASP  33           HB3      ASP  33  24.203  10.197  16.096

  No H/Q in entry =           4
  In of MODEL   25
    1    H    PHE  34           H        PHE  34  23.577  14.022  14.586
    2    HA   PHE  34           HA       PHE  34  22.226  13.044  12.296
    3    HB2  PHE  34           HB2      PHE  34  24.373  15.163  12.529
    4    HB3  PHE  34           HB3      PHE  34  23.389  14.877  11.095
    5    HD1  PHE  34           HD1      PHE  34  23.647  16.814  14.006
    6    HD2  PHE  34           HD2      PHE  34  20.760  14.716  11.616
    7    HE1  PHE  34           HE1      PHE  34  21.838  18.227  14.946
    8    HE2  PHE  34           HE2      PHE  34  18.955  16.129  12.559
    9    HZ   PHE  34           HZ       PHE  34  19.498  17.885  14.219

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ALA  35           H        ALA  35  25.597  12.833  13.314
    2    HA   ALA  35           HA       ALA  35  26.703  12.000  10.861
    3    HB3  ALA  35           HB1      ALA  35  28.370  10.822  12.587
    4    HB2  ALA  35           HB2      ALA  35  27.511  11.855  13.729
    5    HB1  ALA  35           HB3      ALA  35  28.356  12.570  12.357

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA  36           H        ALA  36  25.566  10.057  13.627
    2    HA   ALA  36           HA       ALA  36  26.036   7.564  12.356
    3    HB2  ALA  36           HB1      ALA  36  25.595   6.824  14.432
    4    HB3  ALA  36           HB2      ALA  36  23.910   7.330  14.277
    5    HB1  ALA  36           HB3      ALA  36  25.118   8.455  14.901

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA  37           H        ALA  37  23.229   9.709  12.479
    2    HA   ALA  37           HA       ALA  37  21.364   7.950  11.301
    3    HB3  ALA  37           HB1      ALA  37  21.608  10.912  11.589
    4    HB1  ALA  37           HB2      ALA  37  20.288   9.843  12.060
    5    HB2  ALA  37           HB3      ALA  37  20.485  10.311  10.370

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LYS  38           H        LYS  38  23.483  10.395   9.824
    2    HA   LYS  38           HA       LYS  38  22.848   9.967   7.145
    3    HB2  LYS  38           HB2      LYS  38  24.664  11.515   8.593
    4    HB3  LYS  38           HB3      LYS  38  25.693  10.518   7.572
    5    HG2  LYS  38           HG2      LYS  38  24.539  11.292   5.571
    6    HG3  LYS  38           HG3      LYS  38  23.347  12.156   6.548
    7    HD2  LYS  38           HD2      LYS  38  24.950  13.746   7.302
    8    HD3  LYS  38           HD3      LYS  38  26.305  12.750   6.771
    9    HE2  LYS  38           HE2      LYS  38  25.964  14.621   5.216
   10    HE3  LYS  38           HE3      LYS  38  25.622  13.084   4.413
   11    HZ3  LYS  38           HZ1      LYS  38  23.428  13.542   4.276
   12    HZ2  LYS  38           HZ2      LYS  38  23.960  15.154   4.363
   13    HZ1  LYS  38           HZ3      LYS  38  23.378  14.376   5.755

  No H/Q in entry =          13
  In of MODEL   25
    1    H    ALA  39           H        ALA  39  25.347   8.358   9.111
    2    HA   ALA  39           HA       ALA  39  26.412   6.759   7.047
    3    HB2  ALA  39           HB1      ALA  39  26.311   5.801   9.892
    4    HB1  ALA  39           HB2      ALA  39  27.273   7.220   9.476
    5    HB3  ALA  39           HB3      ALA  39  27.617   5.667   8.716

  No H/Q in entry =           5
  In of MODEL   25
    1    H    MET  40           H        MET  40  23.790   6.162   9.339
    2    HA   MET  40           HA       MET  40  23.333   3.459   8.608
    3    HB2  MET  40           HB2      MET  40  21.525   5.515   9.892
    4    HB3  MET  40           HB3      MET  40  21.109   3.808   9.719
    5    HG2  MET  40           HG2      MET  40  23.660   4.737  11.065
    6    HG3  MET  40           HG3      MET  40  22.162   4.471  11.955
    7    HE3  MET  40           HE1      MET  40  21.578   0.841  12.135
    8    HE2  MET  40           HE2      MET  40  20.719   2.147  11.323
    9    HE1  MET  40           HE3      MET  40  21.457   2.433  12.898

  No H/Q in entry =           9
  In of MODEL   25
    1    H    MET  41           H        MET  41  21.940   6.518   7.412
    2    HA   MET  41           HA       MET  41  19.980   5.331   5.737
    3    HB2  MET  41           HB2      MET  41  21.477   7.912   5.223
    4    HB3  MET  41           HB3      MET  41  19.948   7.425   4.502
    5    HG2  MET  41           HG2      MET  41  19.194   7.245   7.051
    6    HG3  MET  41           HG3      MET  41  20.509   8.396   7.275
    7    HE2  MET  41           HE1      MET  41  19.962   9.681   3.935
    8    HE1  MET  41           HE2      MET  41  20.917  10.118   5.348
    9    HE3  MET  41           HE3      MET  41  19.652  11.203   4.779

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ASP  42           H        ASP  42  23.359   6.235   5.191
    2    HA   ASP  42           HA       ASP  42  23.456   5.756   2.434
    3    HB2  ASP  42           HB2      ASP  42  25.207   6.747   4.207
    4    HB3  ASP  42           HB3      ASP  42  25.856   5.118   4.083

  No H/Q in entry =           4
  In of MODEL   25
    1    H    GLN  43           H        GLN  43  24.162   3.602   5.160
    2    HA   GLN  43           HA       GLN  43  24.818   1.338   3.583
    3    HB2  GLN  43           HB2      GLN  43  23.789   1.531   6.424
    4    HB3  GLN  43           HB3      GLN  43  24.362   0.038   5.673
    5    HG2  GLN  43           HG2      GLN  43  26.533   1.237   5.165
    6    HG3  GLN  43           HG3      GLN  43  25.955   2.569   6.161
    7   HE21  GLN  43          HE21      GLN  43  28.180   1.586   7.205
    8   HE22  GLN  43          HE22      GLN  43  27.897   0.507   8.482

  No H/Q in entry =           8
  In of MODEL   25
    1    H    SER  44           H        SER  44  21.764   2.490   4.958
    2    HA   SER  44           HA       SER  44  20.186   0.254   4.285
    3    HB2  SER  44           HB2      SER  44  19.755   2.787   5.426
    4    HB3  SER  44           HB3      SER  44  18.724   2.747   3.998
    5    HG   SER  44           HG       SER  44  17.621   1.812   5.720

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ARG  45           H        ARG  45  20.949   3.212   2.478
    2    HA   ARG  45           HA       ARG  45  19.427   2.730   0.170
    3    HB2  ARG  45           HB2      ARG  45  20.581   4.861   0.754
    4    HB3  ARG  45           HB3      ARG  45  22.122   4.097   0.373
    5    HG2  ARG  45           HG2      ARG  45  21.342   3.692  -1.943
    6    HG3  ARG  45           HG3      ARG  45  19.813   4.479  -1.561
    7    HD2  ARG  45           HD2      ARG  45  21.073   6.570  -0.977
    8    HD3  ARG  45           HD3      ARG  45  22.567   5.787  -1.541
    9    HE   ARG  45           HE       ARG  45  20.640   5.556  -3.581
   10   HH21  ARG  45          HH11      ARG  45  20.645   6.922  -5.347
   11   HH22  ARG  45          HH12      ARG  45  21.410   8.469  -5.243
   12   HH11  ARG  45          HH21      ARG  45  22.380   8.048  -1.954
   13   HH12  ARG  45          HH22      ARG  45  22.392   9.105  -3.319

  No H/Q in entry =          13
  In of MODEL   25
    1    H    MET  46           H        MET  46  22.784   1.838   0.927
    2    HA   MET  46           HA       MET  46  23.389   0.637  -1.554
    3    HB2  MET  46           HB2      MET  46  24.488   0.306   1.238
    4    HB3  MET  46           HB3      MET  46  25.143  -0.588  -0.137
    5    HG2  MET  46           HG2      MET  46  25.584   1.526  -1.319
    6    HG3  MET  46           HG3      MET  46  24.901   2.433   0.025
    7    HE3  MET  46           HE1      MET  46  28.609   3.323   0.445
    8    HE2  MET  46           HE2      MET  46  26.964   3.906   0.681
    9    HE1  MET  46           HE3      MET  46  27.471   3.343  -0.910

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ALA  47           H        ALA  47  21.992  -0.682   1.421
    2    HA   ALA  47           HA       ALA  47  21.923  -3.396   0.623
    3    HB2  ALA  47           HB1      ALA  47  21.543  -2.929   2.926
    4    HB3  ALA  47           HB2      ALA  47  20.004  -3.524   2.305
    5    HB1  ALA  47           HB3      ALA  47  20.243  -1.794   2.561

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU  48           H        LEU  48  19.588  -0.755   0.257
    2    HA   LEU  48           HA       LEU  48  17.536  -2.278  -0.995
    3    HB2  LEU  48           HB2      LEU  48  18.209   0.672  -1.114
    4    HB3  LEU  48           HB3      LEU  48  16.735  -0.031  -1.782
    5    HG   LEU  48           HG       LEU  48  17.581  -0.332   1.109
    6   HD13  LEU  48          HD11      LEU  48  17.179   1.971   0.917
    7   HD12  LEU  48          HD12      LEU  48  15.615   1.334   1.425
    8   HD11  LEU  48          HD13      LEU  48  15.892   1.751  -0.267
    9   HD22  LEU  48          HD21      LEU  48  16.042  -2.038   0.729
   10   HD21  LEU  48          HD22      LEU  48  15.176  -1.132  -0.513
   11   HD23  LEU  48          HD23      LEU  48  14.963  -0.722   1.189

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ASN  49           H        ASN  49  20.238  -0.370  -2.225
    2    HA   ASN  49           HA       ASN  49  19.591  -0.455  -4.949
    3    HB2  ASN  49           HB2      ASN  49  21.283   1.047  -4.008
    4    HB3  ASN  49           HB3      ASN  49  22.306  -0.326  -3.604
    5   HD21  ASN  49          HD21      ASN  49  23.300   1.699  -5.274
    6   HD22  ASN  49          HD22      ASN  49  23.464   1.098  -6.853

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLU  50           H        GLU  50  21.558  -2.659  -2.979
    2    HA   GLU  50           HA       GLU  50  22.250  -4.424  -5.101
    3    HB2  GLU  50           HB2      GLU  50  23.445  -4.402  -2.933
    4    HB3  GLU  50           HB3      GLU  50  21.997  -5.018  -2.137
    5    HG2  GLU  50           HG2      GLU  50  22.075  -7.055  -3.492
    6    HG3  GLU  50           HG3      GLU  50  23.456  -6.434  -4.392

  No H/Q in entry =           6
  In of MODEL   25
    1    H    ALA  51           H        ALA  51  19.591  -4.335  -2.778
    2    HA   ALA  51           HA       ALA  51  18.409  -6.802  -3.532
    3    HB3  ALA  51           HB1      ALA  51  16.818  -6.282  -1.980
    4    HB1  ALA  51           HB2      ALA  51  16.617  -4.635  -2.582
    5    HB2  ALA  51           HB3      ALA  51  17.972  -5.028  -1.524

  No H/Q in entry =           5
  In of MODEL   25
    1    H    HIS  52           H        HIS  52  17.848  -3.452  -4.575
    2    HA   HIS  52           HA       HIS  52  15.733  -3.968  -6.376
    3    HB2  HIS  52           HB2      HIS  52  16.404  -1.706  -5.577
    4    HB3  HIS  52           HB3      HIS  52  17.851  -1.815  -6.577
    5    HD1  HIS  52           HD1      HIS  52  17.506  -1.828  -9.185
    6    HD2  HIS  52           HD2      HIS  52  14.022  -1.165  -6.995
    7    HE1  HIS  52           HE1      HIS  52  15.779  -0.973 -10.828
    8    HE2  HIS  52           HE2      HIS  52  13.649  -0.563  -9.508

  No H/Q in entry =           8
  In of MODEL   25
    1    H    LEU  53           H        LEU  53  19.252  -3.999  -6.805
    2    HA   LEU  53           HA       LEU  53  19.311  -4.322  -9.604
    3    HB2  LEU  53           HB2      LEU  53  21.236  -5.089  -7.424
    4    HB3  LEU  53           HB3      LEU  53  21.551  -5.486  -9.111
    5    HG   LEU  53           HG       LEU  53  20.895  -2.666  -8.202
    6   HD12  LEU  53          HD11      LEU  53  23.392  -2.299  -8.429
    7   HD11  LEU  53          HD12      LEU  53  23.573  -4.053  -8.472
    8   HD13  LEU  53          HD13      LEU  53  22.915  -3.271  -7.039
    9   HD23  LEU  53          HD21      LEU  53  22.339  -2.252 -10.355
   10   HD22  LEU  53          HD22      LEU  53  20.656  -2.734 -10.540
   11   HD21  LEU  53          HD23      LEU  53  21.933  -3.916 -10.753

  No H/Q in entry =          11
  In of MODEL   25
    1    H    VAL  54           H        VAL  54  19.179  -6.701  -6.973
    2    HA   VAL  54           HA       VAL  54  19.290  -9.001  -8.626
    3    HB   VAL  54           HB       VAL  54  18.134  -8.563  -5.862
    4   HG12  VAL  54          HG11      VAL  54  18.442 -11.182  -5.850
    5   HG11  VAL  54          HG12      VAL  54  18.260 -11.017  -7.597
    6   HG13  VAL  54          HG13      VAL  54  16.974 -10.475  -6.521
    7   HG22  VAL  54          HG21      VAL  54  20.451  -8.366  -5.636
    8   HG21  VAL  54          HG22      VAL  54  20.783  -9.463  -6.974
    9   HG23  VAL  54          HG23      VAL  54  20.247 -10.103  -5.421

  No H/Q in entry =           9
  In of MODEL   25
    1    H    GLN  55           H        GLN  55  16.572  -7.077  -7.352
    2    HA   GLN  55           HA       GLN  55  14.542  -8.732  -8.424
    3    HB2  GLN  55           HB2      GLN  55  13.801  -7.197  -6.802
    4    HB3  GLN  55           HB3      GLN  55  14.603  -5.836  -7.581
    5    HG2  GLN  55           HG2      GLN  55  12.883  -5.505  -9.073
    6    HG3  GLN  55           HG3      GLN  55  12.551  -7.224  -9.239
    7   HE21  GLN  55          HE21      GLN  55  10.539  -7.759  -8.435
    8   HE22  GLN  55          HE22      GLN  55   9.769  -6.996  -7.130

  No H/Q in entry =           8
  In of MODEL   25
    1    H    THR  56           H        THR  56  16.300  -5.946  -9.789
    2    HA   THR  56           HA       THR  56  14.867  -5.581 -12.140
    3    HB   THR  56           HB       THR  56  17.886  -5.510 -11.970
    4    HG1  THR  56           HG1      THR  56  16.212  -3.317 -11.479
    5   HG22  THR  56          HG21      THR  56  16.105  -3.645 -13.512
    6   HG21  THR  56          HG22      THR  56  16.524  -5.221 -14.181
    7   HG23  THR  56          HG23      THR  56  17.796  -4.059 -13.799

  No H/Q in entry =           7
  In of MODEL   25
    1    H    LYS  57           H        LYS  57  17.502  -7.892 -11.519
    2    HA   LYS  57           HA       LYS  57  17.499  -9.094 -14.094
    3    HB2  LYS  57           HB2      LYS  57  19.286  -9.352 -12.346
    4    HB3  LYS  57           HB3      LYS  57  18.175 -10.338 -11.408
    5    HG2  LYS  57           HG2      LYS  57  18.067 -11.990 -13.208
    6    HG3  LYS  57           HG3      LYS  57  19.109 -10.995 -14.217
    7    HD2  LYS  57           HD2      LYS  57  20.923 -11.211 -12.534
    8    HD3  LYS  57           HD3      LYS  57  19.885 -12.259 -11.569
    9    HE2  LYS  57           HE2      LYS  57  20.660 -12.848 -14.446
   10    HE3  LYS  57           HE3      LYS  57  21.507 -13.521 -13.054
   11    HZ1  LYS  57           HZ1      LYS  57  18.745 -13.894 -12.720
   12    HZ3  LYS  57           HZ2      LYS  57  19.964 -15.066 -12.878
   13    HZ2  LYS  57           HZ3      LYS  57  19.184 -14.458 -14.257

  No H/Q in entry =          13
  In of MODEL   25
    1    H    LEU  58           H        LEU  58  15.711  -9.743 -11.119
    2    HA   LEU  58           HA       LEU  58  14.478 -12.113 -12.048
    3    HB2  LEU  58           HB2      LEU  58  13.691 -10.197  -9.859
    4    HB3  LEU  58           HB3      LEU  58  12.876 -11.731 -10.172
    5    HG   LEU  58           HG       LEU  58  15.850 -11.467  -9.615
    6   HD11  LEU  58          HD11      LEU  58  13.475 -11.867  -7.823
    7   HD13  LEU  58          HD12      LEU  58  14.933 -10.911  -7.562
    8   HD12  LEU  58          HD13      LEU  58  14.996 -12.667  -7.422
    9   HD22  LEU  58          HD21      LEU  58  15.723 -13.531 -10.637
   10   HD21  LEU  58          HD22      LEU  58  14.007 -13.731 -10.277
   11   HD23  LEU  58          HD23      LEU  58  15.213 -14.034  -9.026

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  59           H        ILE  59  13.825  -8.774 -12.741
    2    HA   ILE  59           HA       ILE  59  11.107  -9.411 -13.682
    3    HB   ILE  59           HB       ILE  59  11.919  -7.131 -12.481
    4   HG12  ILE  59          HG12      ILE  59  10.027  -6.997 -14.839
    5   HG13  ILE  59          HG13      ILE  59   9.594  -7.766 -13.335
    6   HG21  ILE  59          HG21      ILE  59  13.467  -6.757 -14.551
    7   HG23  ILE  59          HG22      ILE  59  12.524  -5.406 -13.968
    8   HG22  ILE  59          HG23      ILE  59  11.996  -6.313 -15.382
    9   HD12  ILE  59          HD11      ILE  59   8.849  -5.399 -13.417
   10   HD11  ILE  59          HD12      ILE  59  10.534  -4.908 -13.573
   11   HD13  ILE  59          HD13      ILE  59   9.980  -5.699 -12.097

  No H/Q in entry =          11
  In of MODEL   25
    1    H    GLU  60           H        GLU  60  14.317  -8.579 -14.939
    2    HA   GLU  60           HA       GLU  60  13.542  -8.183 -17.650
    3    HB2  GLU  60           HB2      GLU  60  15.724  -7.459 -16.796
    4    HB3  GLU  60           HB3      GLU  60  16.178  -9.133 -16.493
    5    HG2  GLU  60           HG2      GLU  60  15.974  -9.626 -18.909
    6    HG3  GLU  60           HG3      GLU  60  15.534  -7.946 -19.209

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLY  61           H        GLY  61  14.502 -11.064 -15.825
    2    HA3  GLY  61           HA2      GLY  61  13.955 -12.716 -18.223
    3    HA2  GLY  61           HA3      GLY  61  14.983 -13.199 -16.878

  No H/Q in entry =           3
  In of MODEL   25
    1    H    ASP  62           H        ASP  62  11.870 -11.635 -16.516
    2    HA   ASP  62           HA       ASP  62  10.917 -13.504 -14.648
    3    HB2  ASP  62           HB2      ASP  62   8.768 -12.335 -14.908
    4    HB3  ASP  62           HB3      ASP  62  10.110 -11.206 -14.748

  No H/Q in entry =           4
  In of MODEL   25
    1    H    ALA  63           H        ALA  63  10.448 -13.338 -18.177
    2    HA   ALA  63           HA       ALA  63   8.357 -15.245 -18.393
    3    HB3  ALA  63           HB1      ALA  63   8.909 -13.885 -20.297
    4    HB1  ALA  63           HB2      ALA  63   9.263 -15.556 -20.735
    5    HB2  ALA  63           HB3      ALA  63  10.576 -14.463 -20.299

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLY  64           H        GLY  64  10.873 -16.403 -20.246
    2    HA3  GLY  64           HA2      GLY  64  12.230 -18.263 -20.179
    3    HA2  GLY  64           HA3      GLY  64  12.077 -18.259 -18.427

  No H/Q in entry =           3
  In of MODEL   25
    1    H    GLU  65           H        GLU  65   9.087 -18.237 -20.101
    2    HA   GLU  65           HA       GLU  65   8.890 -21.167 -19.972
    3    HB2  GLU  65           HB2      GLU  65   7.058 -19.230 -18.565
    4    HB3  GLU  65           HB3      GLU  65   6.665 -20.927 -18.837
    5    HG2  GLU  65           HG2      GLU  65   8.653 -21.624 -17.601
    6    HG3  GLU  65           HG3      GLU  65   9.139 -19.943 -17.388

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLY  66           H        GLY  66   6.927 -22.019 -20.886
    2    HA3  GLY  66           HA2      GLY  66   6.483 -21.236 -23.527
    3    HA2  GLY  66           HA3      GLY  66   5.499 -22.366 -22.621

  No H/Q in entry =           3
  In of MODEL   25
    1    H    LYS  67           H        LYS  67   4.543 -20.620 -20.651
    2    HA   LYS  67           HA       LYS  67   2.501 -19.241 -22.185
    3    HB2  LYS  67           HB2      LYS  67   1.273 -19.171 -20.081
    4    HB3  LYS  67           HB3      LYS  67   1.891 -20.800 -20.385
    5    HG2  LYS  67           HG2      LYS  67   3.851 -20.311 -18.947
    6    HG3  LYS  67           HG3      LYS  67   3.197 -18.711 -18.615
    7    HD2  LYS  67           HD2      LYS  67   1.195 -19.739 -17.596
    8    HD3  LYS  67           HD3      LYS  67   1.862 -21.342 -17.918
    9    HE2  LYS  67           HE2      LYS  67   3.828 -20.805 -16.520
   10    HE3  LYS  67           HE3      LYS  67   3.152 -19.212 -16.187
   11    HZ2  LYS  67           HZ1      LYS  67   2.712 -21.455 -14.725
   12    HZ1  LYS  67           HZ2      LYS  67   1.307 -21.341 -15.669
   13    HZ3  LYS  67           HZ3      LYS  67   1.773 -20.045 -14.675

  No H/Q in entry =          13
  In of MODEL   25
    1    H    MET  68           H        MET  68   1.659 -17.206 -21.604
    2    HA   MET  68           HA       MET  68   3.544 -15.128 -21.656
    3    HB2  MET  68           HB2      MET  68   0.582 -15.068 -21.073
    4    HB3  MET  68           HB3      MET  68   1.569 -13.653 -21.437
    5    HG2  MET  68           HG2      MET  68   1.238 -16.049 -23.263
    6    HG3  MET  68           HG3      MET  68   0.401 -14.508 -23.454
    7    HE1  MET  68           HE1      MET  68   1.450 -12.392 -23.345
    8    HE3  MET  68           HE2      MET  68   2.873 -11.943 -24.281
    9    HE2  MET  68           HE3      MET  68   3.050 -12.391 -22.587

  No H/Q in entry =           9
  In of MODEL   25
    1    H    LYS  69           H        LYS  69   1.604 -16.359 -18.920
    2    HA   LYS  69           HA       LYS  69   1.887 -14.348 -17.098
    3    HB2  LYS  69           HB2      LYS  69   1.926 -17.330 -16.650
    4    HB3  LYS  69           HB3      LYS  69   1.791 -16.153 -15.343
    5    HG2  LYS  69           HG2      LYS  69  -0.206 -15.180 -16.418
    6    HG3  LYS  69           HG3      LYS  69  -0.078 -16.363 -17.720
    7    HD2  LYS  69           HD2      LYS  69  -0.401 -18.193 -16.119
    8    HD3  LYS  69           HD3      LYS  69  -0.479 -17.033 -14.790
    9    HE2  LYS  69           HE2      LYS  69  -2.749 -17.463 -15.311
   10    HE3  LYS  69           HE3      LYS  69  -2.403 -15.931 -16.112
   11    HZ2  LYS  69           HZ1      LYS  69  -3.578 -17.679 -17.475
   12    HZ1  LYS  69           HZ2      LYS  69  -2.110 -18.531 -17.490
   13    HZ3  LYS  69           HZ3      LYS  69  -2.202 -16.982 -18.179

  No H/Q in entry =          13
  In of MODEL   25
    1    H    VAL  70           H        VAL  70   3.175 -14.330 -14.997
    2    HA   VAL  70           HA       VAL  70   6.040 -14.916 -15.488
    3    HB   VAL  70           HB       VAL  70   6.554 -12.786 -14.313
    4   HG12  VAL  70          HG11      VAL  70   4.727 -12.452 -16.714
    5   HG11  VAL  70          HG12      VAL  70   6.431 -12.902 -16.796
    6   HG13  VAL  70          HG13      VAL  70   5.967 -11.314 -16.188
    7   HG23  VAL  70          HG21      VAL  70   4.654 -11.130 -14.069
    8   HG22  VAL  70          HG22      VAL  70   4.538 -12.514 -12.984
    9   HG21  VAL  70          HG23      VAL  70   3.532 -12.442 -14.431

  No H/Q in entry =           9
  In of MODEL   25
    1    H    SER  71           H        SER  71   7.282 -14.700 -13.347
    2    HA   SER  71           HA       SER  71   6.368 -16.612 -11.488
    3    HB2  SER  71           HB2      SER  71   8.763 -15.915 -11.844
    4    HB3  SER  71           HB3      SER  71   8.401 -14.431 -10.969
    5    HG   SER  71           HG       SER  71   9.143 -15.889  -9.482

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU  72           H        LEU  72   4.954 -16.455  -9.887
    2    HA   LEU  72           HA       LEU  72   3.416 -14.132  -9.451
    3    HB2  LEU  72           HB2      LEU  72   3.687 -16.686  -7.873
    4    HB3  LEU  72           HB3      LEU  72   2.524 -15.423  -7.480
    5    HG   LEU  72           HG       LEU  72   2.685 -16.726 -10.217
    6   HD12  LEU  72          HD11      LEU  72   0.731 -17.353  -7.987
    7   HD11  LEU  72          HD12      LEU  72   2.138 -18.348  -8.358
    8   HD13  LEU  72          HD13      LEU  72   0.857 -18.154  -9.553
    9   HD22  LEU  72          HD21      LEU  72   1.468 -14.732 -10.467
   10   HD21  LEU  72          HD22      LEU  72   0.781 -14.817  -8.853
   11   HD23  LEU  72          HD23      LEU  72   0.194 -15.894 -10.117

  No H/Q in entry =          11
  In of MODEL   25
    1    H    VAL  73           H        VAL  73   6.061 -15.579  -7.670
    2    HA   VAL  73           HA       VAL  73   6.005 -14.041  -5.341
    3    HB   VAL  73           HB       VAL  73   8.139 -14.901  -4.878
    4   HG13  VAL  73          HG11      VAL  73   7.856 -17.205  -5.267
    5   HG12  VAL  73          HG12      VAL  73   7.132 -16.942  -6.853
    6   HG11  VAL  73          HG13      VAL  73   6.217 -16.571  -5.392
    7   HG21  VAL  73          HG21      VAL  73   8.444 -15.036  -7.885
    8   HG23  VAL  73          HG22      VAL  73   9.538 -15.879  -6.789
    9   HG22  VAL  73          HG23      VAL  73   9.421 -14.120  -6.737

  No H/Q in entry =           9
  In of MODEL   25
    1    H    LEU  74           H        LEU  74   7.006 -13.159  -8.517
    2    HA   LEU  74           HA       LEU  74   8.960 -11.220  -8.025
    3    HB2  LEU  74           HB2      LEU  74   8.513 -11.965 -10.262
    4    HB3  LEU  74           HB3      LEU  74   6.845 -11.404 -10.167
    5    HG   LEU  74           HG       LEU  74   7.634  -9.074  -9.962
    6   HD13  LEU  74          HD11      LEU  74   9.740  -9.251  -8.881
    7   HD12  LEU  74          HD12      LEU  74  10.137  -8.760 -10.526
    8   HD11  LEU  74          HD13      LEU  74  10.326 -10.445 -10.039
    9   HD21  LEU  74          HD21      LEU  74   7.420 -10.514 -12.178
   10   HD23  LEU  74          HD22      LEU  74   9.134 -10.174 -12.256
   11   HD22  LEU  74          HD23      LEU  74   7.995  -8.848 -12.218

  No H/Q in entry =          11
  In of MODEL   25
    1    H    VAL  75           H        VAL  75   5.468 -10.817  -8.387
    2    HA   VAL  75           HA       VAL  75   5.385  -8.059  -7.806
    3    HB   VAL  75           HB       VAL  75   3.283 -10.190  -7.418
    4   HG13  VAL  75          HG11      VAL  75   2.797  -8.273  -5.950
    5   HG12  VAL  75          HG12      VAL  75   1.723  -8.223  -7.340
    6   HG11  VAL  75          HG13      VAL  75   3.117  -7.155  -7.272
    7   HG21  VAL  75          HG21      VAL  75   4.257  -9.554  -9.745
    8   HG23  VAL  75          HG22      VAL  75   3.425  -8.018  -9.513
    9   HG22  VAL  75          HG23      VAL  75   2.504  -9.522  -9.556

  No H/Q in entry =           9
  In of MODEL   25
    1    H    GLU  76           H        GLU  76   5.111 -10.930  -5.691
    2    HA   GLU  76           HA       GLU  76   4.642  -9.561  -3.274
    3    HB2  GLU  76           HB2      GLU  76   4.474 -12.042  -3.544
    4    HB3  GLU  76           HB3      GLU  76   6.220 -12.124  -3.700
    5    HG2  GLU  76           HG2      GLU  76   6.491 -11.247  -1.418
    6    HG3  GLU  76           HG3      GLU  76   4.752 -11.108  -1.234

  No H/Q in entry =           6
  In of MODEL   25
    1    H    ALA  77           H        ALA  77   7.701 -10.489  -4.826
    2    HA   ALA  77           HA       ALA  77   9.390  -9.450  -2.808
    3    HB3  ALA  77           HB1      ALA  77   9.827  -9.952  -5.754
    4    HB1  ALA  77           HB2      ALA  77  10.342 -10.952  -4.397
    5    HB2  ALA  77           HB3      ALA  77  11.108  -9.389  -4.680

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLN  78           H        GLN  78   8.014  -8.031  -5.729
    2    HA   GLN  78           HA       GLN  78   9.381  -5.560  -5.626
    3    HB2  GLN  78           HB2      GLN  78   8.082  -6.475  -7.584
    4    HB3  GLN  78           HB3      GLN  78   6.601  -6.078  -6.714
    5    HG2  GLN  78           HG2      GLN  78   7.277  -3.713  -6.630
    6    HG3  GLN  78           HG3      GLN  78   8.763  -4.103  -7.496
    7   HE21  GLN  78          HE21      GLN  78   8.411  -3.160  -9.546
    8   HE22  GLN  78          HE22      GLN  78   7.061  -3.491 -10.521

  No H/Q in entry =           8
  In of MODEL   25
    1    H    LEU  79           H        LEU  79   6.351  -6.676  -4.203
    2    HA   LEU  79           HA       LEU  79   5.368  -4.261  -3.202
    3    HB2  LEU  79           HB2      LEU  79   4.041  -6.304  -3.146
    4    HB3  LEU  79           HB3      LEU  79   5.178  -7.048  -2.026
    5    HG   LEU  79           HG       LEU  79   4.630  -5.399  -0.304
    6   HD13  LEU  79          HD11      LEU  79   4.180  -3.384  -1.361
    7   HD12  LEU  79          HD12      LEU  79   2.550  -3.898  -0.926
    8   HD11  LEU  79          HD13      LEU  79   3.135  -4.128  -2.572
    9   HD23  LEU  79          HD21      LEU  79   2.040  -5.875  -0.222
   10   HD22  LEU  79          HD22      LEU  79   3.171  -7.221  -0.106
   11   HD21  LEU  79          HD23      LEU  79   2.365  -6.882  -1.635

  No H/Q in entry =          11
  In of MODEL   25
    1    H    HIS  80           H        HIS  80   7.531  -6.606  -1.607
    2    HA   HIS  80           HA       HIS  80   7.820  -5.061   0.760
    3    HB2  HIS  80           HB2      HIS  80   9.148  -7.436  -0.429
    4    HB3  HIS  80           HB3      HIS  80  10.060  -6.542   0.789
    5    HD1  HIS  80           HD1      HIS  80   9.557  -7.170   3.131
    6    HD2  HIS  80           HD2      HIS  80   6.344  -8.005   0.610
    7    HE1  HIS  80           HE1      HIS  80   7.773  -8.258   4.576
    8    HE2  HIS  80           HE2      HIS  80   5.808  -8.771   3.047

  No H/Q in entry =           8
  In of MODEL   25
    1    H    LEU  81           H        LEU  81   9.835  -5.356  -2.145
    2    HA   LEU  81           HA       LEU  81  11.887  -3.627  -1.263
    3    HB2  LEU  81           HB2      LEU  81  10.971  -4.419  -4.027
    4    HB3  LEU  81           HB3      LEU  81  12.396  -3.422  -3.734
    5    HG   LEU  81           HG       LEU  81  11.981  -6.138  -2.456
    6   HD12  LEU  81          HD11      LEU  81  13.799  -6.780  -4.197
    7   HD11  LEU  81          HD12      LEU  81  13.246  -5.354  -5.074
    8   HD13  LEU  81          HD13      LEU  81  12.124  -6.670  -4.737
    9   HD23  LEU  81          HD21      LEU  81  14.611  -5.840  -2.433
   10   HD22  LEU  81          HD22      LEU  81  13.630  -5.070  -1.188
   11   HD21  LEU  81          HD23      LEU  81  14.220  -4.125  -2.555

  No H/Q in entry =          11
  In of MODEL   25
    1    H    MET  82           H        MET  82   8.976  -2.974  -3.212
    2    HA   MET  82           HA       MET  82   9.537  -0.253  -3.717
    3    HB2  MET  82           HB2      MET  82   6.966  -1.829  -3.598
    4    HB3  MET  82           HB3      MET  82   6.979  -0.105  -3.966
    5    HG2  MET  82           HG2      MET  82   8.570  -2.194  -5.490
    6    HG3  MET  82           HG3      MET  82   7.010  -1.561  -6.010
    7    HE3  MET  82           HE1      MET  82   7.487   1.888  -7.188
    8    HE2  MET  82           HE2      MET  82   7.105   1.668  -5.482
    9    HE1  MET  82           HE3      MET  82   6.436   0.561  -6.677

  No H/Q in entry =           9
  In of MODEL   25
    1    H    THR  83           H        THR  83   7.723  -1.833  -1.115
    2    HA   THR  83           HA       THR  83   6.884   0.524   0.203
    3    HB   THR  83           HB       THR  83   6.731  -1.045   2.224
    4    HG1  THR  83           HG1      THR  83   7.474  -3.001   2.001
    5   HG22  THR  83          HG21      THR  83   5.072  -2.602   0.753
    6   HG21  THR  83          HG22      THR  83   5.313  -1.277  -0.381
    7   HG23  THR  83          HG23      THR  83   4.668  -0.954   1.229

  No H/Q in entry =           7
  In of MODEL   25
    1    H    SER  84           H        SER  84   9.690  -1.593   0.739
    2    HA   SER  84           HA       SER  84  10.752  -0.166   2.929
    3    HB2  SER  84           HB2      SER  84  11.999  -2.023   0.913
    4    HB3  SER  84           HB3      SER  84  12.947  -1.273   2.196
    5    HG   SER  84           HG       SER  84  10.658  -2.945   2.451

  No H/Q in entry =           5
  In of MODEL   25
    1    H    MET  85           H        MET  85  11.521   0.082  -0.557
    2    HA   MET  85           HA       MET  85  13.533   2.032  -0.302
    3    HB2  MET  85           HB2      MET  85  13.138   0.750  -2.367
    4    HB3  MET  85           HB3      MET  85  11.616   1.610  -2.603
    5    HG2  MET  85           HG2      MET  85  12.824   3.749  -2.732
    6    HG3  MET  85           HG3      MET  85  14.348   2.913  -2.453
    7    HE1  MET  85           HE1      MET  85  11.796   4.148  -4.857
    8    HE3  MET  85           HE2      MET  85  11.108   2.533  -4.714
    9    HE2  MET  85           HE3      MET  85  11.805   3.047  -6.244

  No H/Q in entry =           9
  In of MODEL   25
    1    H    LEU  86           H        LEU  86  10.048   2.393  -0.826
    2    HA   LEU  86           HA       LEU  86  10.007   5.206  -1.014
    3    HB2  LEU  86           HB2      LEU  86   8.152   3.559  -1.593
    4    HB3  LEU  86           HB3      LEU  86   7.815   3.476   0.136
    5    HG   LEU  86           HG       LEU  86   7.675   6.038   0.077
    6   HD11  LEU  86          HD11      LEU  86   8.457   5.590  -2.621
    7   HD13  LEU  86          HD12      LEU  86   8.031   7.123  -1.865
    8   HD12  LEU  86          HD13      LEU  86   6.790   6.168  -2.673
    9   HD23  LEU  86          HD21      LEU  86   5.537   4.699  -1.591
   10   HD22  LEU  86          HD22      LEU  86   5.352   5.963  -0.378
   11   HD21  LEU  86          HD23      LEU  86   5.736   4.316   0.120

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ALA  87           H        ALA  87   9.513   3.037   1.735
    2    HA   ALA  87           HA       ALA  87   8.973   4.960   3.698
    3    HB1  ALA  87           HB1      ALA  87   9.757   2.133   3.621
    4    HB3  ALA  87           HB2      ALA  87   8.635   2.957   4.701
    5    HB2  ALA  87           HB3      ALA  87  10.362   2.975   5.051

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ARG  88           H        ARG  88  12.048   3.508   2.733
    2    HA   ARG  88           HA       ARG  88  13.662   4.877   4.568
    3    HB2  ARG  88           HB2      ARG  88  14.319   2.895   3.171
    4    HB3  ARG  88           HB3      ARG  88  14.486   3.983   1.797
    5    HG2  ARG  88           HG2      ARG  88  15.963   5.289   3.746
    6    HG3  ARG  88           HG3      ARG  88  16.268   3.598   4.129
    7    HD2  ARG  88           HD2      ARG  88  17.539   3.287   2.288
    8    HD3  ARG  88           HD3      ARG  88  16.413   4.166   1.249
    9    HE   ARG  88           HE       ARG  88  18.813   5.212   2.303
   10   HH21  ARG  88          HH11      ARG  88  19.177   7.427   2.105
   11   HH22  ARG  88          HH12      ARG  88  17.835   8.510   1.954
   12   HH11  ARG  88          HH21      ARG  88  15.481   5.992   2.011
   13   HH12  ARG  88          HH22      ARG  88  15.741   7.694   1.876

  No H/Q in entry =          13
  In of MODEL   25
    1    H    GLU  89           H        GLU  89  12.708   5.775   1.239
    2    HA   GLU  89           HA       GLU  89  14.275   8.122   1.083
    3    HB2  GLU  89           HB2      GLU  89  13.129   7.087  -0.866
    4    HB3  GLU  89           HB3      GLU  89  11.587   7.642  -0.215
    5    HG2  GLU  89           HG2      GLU  89  12.308   9.973  -0.380
    6    HG3  GLU  89           HG3      GLU  89  13.910   9.468  -0.910

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LEU  90           H        LEU  90  10.938   7.643   2.202
    2    HA   LEU  90           HA       LEU  90  10.443  10.381   2.770
    3    HB2  LEU  90           HB2      LEU  90   9.223   7.820   3.798
    4    HB3  LEU  90           HB3      LEU  90   8.604   9.421   4.215
    5    HG   LEU  90           HG       LEU  90   9.026   8.532   1.350
    6   HD12  LEU  90          HD11      LEU  90   6.489   8.224   1.404
    7   HD11  LEU  90          HD12      LEU  90   6.637   8.216   3.161
    8   HD13  LEU  90          HD13      LEU  90   7.449   6.978   2.202
    9   HD22  LEU  90          HD21      LEU  90   8.751  10.842   1.270
   10   HD21  LEU  90          HD22      LEU  90   7.759  10.886   2.727
   11   HD23  LEU  90          HD23      LEU  90   7.063  10.333   1.204

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  91           H        ILE  91  11.677   7.694   4.702
    2    HA   ILE  91           HA       ILE  91  11.820   9.063   7.168
    3    HB   ILE  91           HB       ILE  91  13.359   6.709   6.055
    4   HG12  ILE  91          HG12      ILE  91  11.336   6.898   8.307
    5   HG13  ILE  91          HG13      ILE  91  10.869   6.617   6.630
    6   HG22  ILE  91          HG21      ILE  91  13.818   6.497   8.697
    7   HG21  ILE  91          HG22      ILE  91  13.757   8.256   8.592
    8   HG23  ILE  91          HG23      ILE  91  14.931   7.357   7.634
    9   HD13  ILE  91          HD11      ILE  91  11.854   4.507   6.568
   10   HD12  ILE  91          HD12      ILE  91  11.256   4.574   8.225
   11   HD11  ILE  91          HD13      ILE  91  12.961   4.872   7.892

  No H/Q in entry =          11
  In of MODEL   25
    1    H    THR  92           H        THR  92  14.045   8.870   4.424
    2    HA   THR  92           HA       THR  92  16.218  10.247   5.588
    3    HB   THR  92           HB       THR  92  15.240  10.125   2.724
    4    HG1  THR  92           HG1      THR  92  16.055   8.222   3.136
    5   HG22  THR  92          HG21      THR  92  17.817  10.793   2.438
    6   HG21  THR  92          HG22      THR  92  17.510  11.620   3.965
    7   HG23  THR  92          HG23      THR  92  16.548  12.012   2.540

  No H/Q in entry =           7
  In of MODEL   25
    1    H    GLU  93           H        GLU  93  13.346  11.421   3.847
    2    HA   GLU  93           HA       GLU  93  13.963  14.177   3.957
    3    HB2  GLU  93           HB2      GLU  93  11.247  12.826   3.965
    4    HB3  GLU  93           HB3      GLU  93  11.550  14.523   3.591
    5    HG2  GLU  93           HG2      GLU  93  12.875  12.266   2.072
    6    HG3  GLU  93           HG3      GLU  93  11.336  12.961   1.579

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LEU  94           H        LEU  94  12.195  12.040   6.167
    2    HA   LEU  94           HA       LEU  94  11.395  13.996   8.037
    3    HB2  LEU  94           HB2      LEU  94  11.946  11.037   8.319
    4    HB3  LEU  94           HB3      LEU  94  11.378  12.020   9.665
    5    HG   LEU  94           HG       LEU  94   9.903  12.079   7.031
    6   HD11  LEU  94          HD11      LEU  94   9.961   9.861   9.041
    7   HD13  LEU  94          HD12      LEU  94   9.665   9.799   7.305
    8   HD12  LEU  94          HD13      LEU  94   8.387  10.328   8.397
    9   HD23  LEU  94          HD21      LEU  94   7.982  12.497   8.624
   10   HD22  LEU  94          HD22      LEU  94   9.231  13.741   8.663
   11   HD21  LEU  94          HD23      LEU  94   9.154  12.528   9.939

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  95           H        ILE  95  14.354  12.042   7.814
    2    HA   ILE  95           HA       ILE  95  15.521  12.960  10.229
    3    HB   ILE  95           HB       ILE  95  16.760  11.876   7.687
    4   HG12  ILE  95          HG12      ILE  95  16.445  10.683  10.457
    5   HG13  ILE  95          HG13      ILE  95  15.281  10.431   9.158
    6   HG21  ILE  95          HG21      ILE  95  18.013  12.678  10.332
    7   HG23  ILE  95          HG22      ILE  95  18.485  13.199   8.713
    8   HG22  ILE  95          HG23      ILE  95  18.776  11.537   9.226
    9   HD13  ILE  95          HD11      ILE  95  16.754   9.138   7.903
   10   HD12  ILE  95          HD12      ILE  95  17.218   8.689   9.541
   11   HD11  ILE  95          HD13      ILE  95  18.184   9.859   8.642

  No H/Q in entry =          11
  In of MODEL   25
    1    H    GLU  96           H        GLU  96  15.696  14.185   6.893
    2    HA   GLU  96           HA       GLU  96  17.559  16.250   7.371
    3    HB2  GLU  96           HB2      GLU  96  16.896  15.588   5.111
    4    HB3  GLU  96           HB3      GLU  96  15.256  16.159   5.405
    5    HG2  GLU  96           HG2      GLU  96  15.842  18.282   4.860
    6    HG3  GLU  96           HG3      GLU  96  17.137  18.275   6.047

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LEU  97           H        LEU  97  14.044  16.092   7.790
    2    HA   LEU  97           HA       LEU  97  13.649  18.831   8.425
    3    HB2  LEU  97           HB2      LEU  97  12.108  16.319   9.040
    4    HB3  LEU  97           HB3      LEU  97  11.605  17.871   9.706
    5    HG   LEU  97           HG       LEU  97  12.094  17.445   6.743
    6   HD12  LEU  97          HD11      LEU  97   9.570  17.338   6.618
    7   HD11  LEU  97          HD12      LEU  97   9.556  17.142   8.369
    8   HD13  LEU  97          HD13      LEU  97  10.330  15.926   7.351
    9   HD23  LEU  97          HD21      LEU  97  10.372  19.423   6.767
   10   HD22  LEU  97          HD22      LEU  97  12.055  19.770   7.164
   11   HD21  LEU  97          HD23      LEU  97  10.861  19.612   8.450

  No H/Q in entry =          11
  In of MODEL   25
    1    H    HIS  98           H        HIS  98  14.441  16.002  10.429
    2    HA   HIS  98           HA       HIS  98  14.286  17.269  12.942
    3    HB2  HIS  98           HB2      HIS  98  16.020  14.995  11.950
    4    HB3  HIS  98           HB3      HIS  98  16.018  15.537  13.630
    5    HD1  HIS  98           HD1      HIS  98  13.813  13.921  11.035
    6    HD2  HIS  98           HD2      HIS  98  13.701  14.850  15.097
    7    HE1  HIS  98           HE1      HIS  98  11.775  12.745  11.983
    8    HE2  HIS  98           HE2      HIS  98  11.687  13.302  14.453

  No H/Q in entry =           8
  In of MODEL   25
    1    H    GLU  99           H        GLU  99  16.845  17.128  10.515
    2    HA   GLU  99           HA       GLU  99  18.837  18.446  12.047
    3    HB2  GLU  99           HB2      GLU  99  19.312  17.150   9.982
    4    HB3  GLU  99           HB3      GLU  99  18.516  18.410   9.037
    5    HG2  GLU  99           HG2      GLU  99  20.135  20.068   9.829
    6    HG3  GLU  99           HG3      GLU  99  20.901  18.862  10.856

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LYS 100           H        LYS 100  16.330  19.625   9.821
    2    HA   LYS 100           HA       LYS 100  17.150  22.356   9.962
    3    HB2  LYS 100           HB2      LYS 100  14.509  21.088   9.202
    4    HB3  LYS 100           HB3      LYS 100  14.824  22.824   9.109
    5    HG2  LYS 100           HG2      LYS 100  16.796  22.355   7.649
    6    HG3  LYS 100           HG3      LYS 100  16.368  20.642   7.669
    7    HD2  LYS 100           HD2      LYS 100  14.180  21.168   6.661
    8    HD3  LYS 100           HD3      LYS 100  14.592  22.884   6.649
    9    HE2  LYS 100           HE2      LYS 100  16.551  22.383   5.196
   10    HE3  LYS 100           HE3      LYS 100  16.071  20.683   5.164
   11    HZ1  LYS 100           HZ1      LYS 100  14.267  22.889   4.320
   12    HZ3  LYS 100           HZ2      LYS 100  14.069  21.221   4.060
   13    HZ2  LYS 100           HZ3      LYS 100  15.290  22.071   3.241

  No H/Q in entry =          13
  In of MODEL   25
    1    H    LEU 101           H        LEU 101  15.030  20.332  11.925
    2    HA   LEU 101           HA       LEU 101  13.877  22.413  13.496
    3    HB2  LEU 101           HB2      LEU 101  14.292  19.461  13.887
    4    HB3  LEU 101           HB3      LEU 101  13.761  20.448  15.244
    5    HG   LEU 101           HG       LEU 101  12.351  20.544  12.571
    6   HD12  LEU 101          HD11      LEU 101  10.675  18.997  13.838
    7   HD11  LEU 101          HD12      LEU 101  12.062  18.574  14.837
    8   HD13  LEU 101          HD13      LEU 101  12.098  18.264  13.101
    9   HD21  LEU 101          HD21      LEU 101  11.693  21.348  15.419
   10   HD23  LEU 101          HD22      LEU 101  10.434  21.131  14.206
   11   HD22  LEU 101          HD23      LEU 101  11.680  22.355  13.969

  No H/Q in entry =          11
  In of MODEL   25
    1    H    LYS 102           H        LYS 102  17.020  21.777  13.070
    2    HA   LYS 102           HA       LYS 102  18.871  22.633  14.146
    3    HB2  LYS 102           HB2      LYS 102  17.067  24.166  15.271
    4    HB3  LYS 102           HB3      LYS 102  17.261  23.105  16.651
    5    HG2  LYS 102           HG2      LYS 102  19.175  25.096  15.483
    6    HG3  LYS 102           HG3      LYS 102  18.786  24.789  17.162
    7    HD2  LYS 102           HD2      LYS 102  20.440  22.858  15.484
    8    HD3  LYS 102           HD3      LYS 102  21.139  24.176  16.416
    9    HE2  LYS 102           HE2      LYS 102  20.715  21.632  17.389
   10    HE3  LYS 102           HE3      LYS 102  20.944  23.074  18.378
   11    HZ2  LYS 102           HZ1      LYS 102  18.962  21.809  18.993
   12    HZ1  LYS 102           HZ2      LYS 102  18.324  22.042  17.442
   13    HZ3  LYS 102           HZ3      LYS 102  18.564  23.372  18.466

  No H/Q in entry =          13
  In of MODEL   25
    1    H    ALA 103           H        ALA 103  16.778  21.051  16.565
    2    HA   ALA 103           HA       ALA 103  18.489  19.828  18.227
    3    HB2  ALA 103           HB1      ALA 103  16.887  17.835  18.220
    4    HB1  ALA 103           HB2      ALA 103  16.003  18.694  16.959
    5    HB3  ALA 103           HB3      ALA 103  16.183  19.416  18.556

  No H/Q in entry =           5
  In of MODEL   25
    1    H1   ALA   1           H3       ALA   1  -1.569  -6.917 -21.402
    2    H2   ALA   1           H2       ALA   1  -2.378  -8.344 -20.948
    3    H3   ALA   1           H1       ALA   1  -0.770  -8.410 -21.498
    4    HA   ALA   1           HA       ALA   1  -1.602  -8.875 -23.496
    5    HB1  ALA   1           HB1      ALA   1  -3.747  -9.572 -23.028
    6    HB2  ALA   1           HB2      ALA   1  -4.169  -8.059 -23.829
    7    HB3  ALA   1           HB3      ALA   1  -4.114  -8.137 -22.070

  No H/Q in entry =           7
  In of MODEL   25
    1    H    GLU   2           H        GLU   2  -2.415  -7.681 -25.490
    2    HA   GLU   2           HA       GLU   2  -0.994  -5.682 -26.367
    3    HB2  GLU   2           HB2      GLU   2  -4.001  -5.720 -26.694
    4    HB3  GLU   2           HB3      GLU   2  -2.868  -4.870 -27.741
    5    HG2  GLU   2           HG2      GLU   2  -2.380  -6.767 -28.891
    6    HG3  GLU   2           HG3      GLU   2  -2.096  -7.673 -27.411

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLU   3           H        GLU   3  -4.145  -4.393 -25.479
    2    HA   GLU   3           HA       GLU   3  -3.076  -1.846 -24.851
    3    HB2  GLU   3           HB2      GLU   3  -5.777  -3.134 -24.526
    4    HB3  GLU   3           HB3      GLU   3  -5.466  -1.521 -23.881
    5    HG2  GLU   3           HG2      GLU   3  -5.094  -0.601 -26.007
    6    HG3  GLU   3           HG3      GLU   3  -4.712  -2.161 -26.728

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LEU   4           H        LEU   4  -4.696  -4.186 -22.673
    2    HA   LEU   4           HA       LEU   4  -4.327  -2.957 -20.283
    3    HB2  LEU   4           HB2      LEU   4  -3.811  -5.904 -20.746
    4    HB3  LEU   4           HB3      LEU   4  -4.214  -5.152 -19.204
    5    HG   LEU   4           HG       LEU   4  -5.980  -5.212 -21.674
    6   HD13  LEU   4          HD11      LEU   4  -7.192  -6.917 -20.677
    7   HD12  LEU   4          HD12      LEU   4  -6.708  -6.459 -19.045
    8   HD11  LEU   4          HD13      LEU   4  -5.577  -7.315 -20.092
    9   HD23  LEU   4          HD21      LEU   4  -7.662  -4.382 -19.813
   10   HD22  LEU   4          HD22      LEU   4  -6.610  -3.222 -20.622
   11   HD21  LEU   4          HD23      LEU   4  -6.195  -3.814 -19.014

  No H/Q in entry =          11
  In of MODEL   25
    1    H    GLU   5           H        GLU   5  -1.841  -4.827 -22.003
    2    HA   GLU   5           HA       GLU   5   0.139  -4.559 -19.960
    3    HB2  GLU   5           HB2      GLU   5   0.189  -6.332 -21.712
    4    HB3  GLU   5           HB3      GLU   5   0.525  -5.091 -22.920
    5    HG2  GLU   5           HG2      GLU   5   2.589  -4.475 -21.739
    6    HG3  GLU   5           HG3      GLU   5   2.253  -5.680 -20.497

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLU   6           H        GLU   6  -0.470  -2.845 -23.010
    2    HA   GLU   6           HA       GLU   6   1.716  -1.033 -22.738
    3    HB2  GLU   6           HB2      GLU   6   0.609  -1.497 -24.905
    4    HB3  GLU   6           HB3      GLU   6  -0.855  -0.716 -24.306
    5    HG2  GLU   6           HG2      GLU   6   0.370   1.390 -24.006
    6    HG3  GLU   6           HG3      GLU   6   1.855   0.618 -24.554

  No H/Q in entry =           6
  In of MODEL   25
    1    H    VAL   7           H        VAL   7  -1.626  -1.071 -21.703
    2    HA   VAL   7           HA       VAL   7  -1.824   1.645 -20.872
    3    HB   VAL   7           HB       VAL   7  -3.313  -0.857 -20.036
    4   HG11  VAL   7          HG11      VAL   7  -3.662   2.037 -19.228
    5   HG13  VAL   7          HG12      VAL   7  -3.580   0.613 -18.190
    6   HG12  VAL   7          HG13      VAL   7  -5.006   0.895 -19.187
    7   HG21  VAL   7          HG21      VAL   7  -3.452   0.217 -22.427
    8   HG23  VAL   7          HG22      VAL   7  -4.388   1.476 -21.620
    9   HG22  VAL   7          HG23      VAL   7  -4.950  -0.196 -21.592

  No H/Q in entry =           9
  In of MODEL   25
    1    H    VAL   8           H        VAL   8  -0.870  -1.347 -19.221
    2    HA   VAL   8           HA       VAL   8  -0.550  -0.266 -16.626
    3    HB   VAL   8           HB       VAL   8   0.762  -2.618 -18.003
    4   HG13  VAL   8          HG11      VAL   8   2.339  -2.096 -16.347
    5   HG12  VAL   8          HG12      VAL   8   1.271  -3.221 -15.510
    6   HG11  VAL   8          HG13      VAL   8   1.114  -1.486 -15.235
    7   HG22  VAL   8          HG21      VAL   8  -0.888  -3.938 -16.942
    8   HG21  VAL   8          HG22      VAL   8  -1.793  -2.477 -17.320
    9   HG23  VAL   8          HG23      VAL   8  -1.186  -2.735 -15.689

  No H/Q in entry =           9
  In of MODEL   25
    1    H    MET   9           H        MET   9   1.705  -0.593 -19.366
    2    HA   MET   9           HA       MET   9   3.997   0.429 -18.099
    3    HB2  MET   9           HB2      MET   9   3.060   0.472 -20.968
    4    HB3  MET   9           HB3      MET   9   4.587   1.205 -20.482
    5    HG2  MET   9           HG2      MET   9   5.337  -0.938 -19.539
    6    HG3  MET   9           HG3      MET   9   3.797  -1.680 -19.980
    7    HE2  MET   9           HE1      MET   9   7.350  -0.412 -22.375
    8    HE1  MET   9           HE2      MET   9   6.674   0.305 -20.916
    9    HE3  MET   9           HE3      MET   9   6.119   0.851 -22.494

  No H/Q in entry =           9
  In of MODEL   25
    1    H    GLY  10           H        GLY  10   1.335   2.056 -19.787
    2    HA3  GLY  10           HA2      GLY  10   2.325   4.699 -19.544
    3    HA2  GLY  10           HA3      GLY  10   0.631   4.257 -19.753

  No H/Q in entry =           3
  In of MODEL   25
    1    H    LEU  11           H        LEU  11   0.209   2.737 -17.466
    2    HA   LEU  11           HA       LEU  11  -0.305   4.723 -15.511
    3    HB2  LEU  11           HB2      LEU  11  -0.271   1.707 -15.350
    4    HB3  LEU  11           HB3      LEU  11  -0.772   2.737 -14.010
    5    HG   LEU  11           HG       LEU  11  -2.002   2.860 -16.777
    6   HD13  LEU  11          HD11      LEU  11  -2.611   0.724 -16.021
    7   HD12  LEU  11          HD12      LEU  11  -3.952   1.731 -15.480
    8   HD11  LEU  11          HD13      LEU  11  -2.705   1.239 -14.336
    9   HD22  LEU  11          HD21      LEU  11  -2.574   4.883 -15.775
   10   HD21  LEU  11          HD22      LEU  11  -2.511   4.219 -14.143
   11   HD23  LEU  11          HD23      LEU  11  -3.887   3.866 -15.188

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  12           H        ILE  12   2.211   2.229 -15.743
    2    HA   ILE  12           HA       ILE  12   3.416   2.757 -13.237
    3    HB   ILE  12           HB       ILE  12   4.664   1.698 -15.795
    4   HG12  ILE  12          HG12      ILE  12   2.639   0.487 -14.664
    5   HG13  ILE  12          HG13      ILE  12   4.037  -0.464 -15.123
    6   HG21  ILE  12          HG21      ILE  12   5.633   1.644 -12.918
    7   HG23  ILE  12          HG22      ILE  12   6.422   2.420 -14.291
    8   HG22  ILE  12          HG23      ILE  12   6.326   0.662 -14.207
    9   HD13  ILE  12          HD11      ILE  12   4.830  -0.449 -12.830
   10   HD12  ILE  12          HD12      ILE  12   3.149  -0.979 -12.841
   11   HD11  ILE  12          HD13      ILE  12   3.550   0.654 -12.359

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  13           H        ILE  13   4.039   4.009 -16.494
    2    HA   ILE  13           HA       ILE  13   6.194   5.706 -15.766
    3    HB   ILE  13           HB       ILE  13   4.170   5.801 -18.017
    4   HG12  ILE  13          HG12      ILE  13   5.992   3.949 -17.734
    5   HG13  ILE  13          HG13      ILE  13   5.763   4.693 -19.311
    6   HG21  ILE  13          HG21      ILE  13   6.506   7.623 -17.431
    7   HG23  ILE  13          HG22      ILE  13   4.861   8.066 -17.872
    8   HG22  ILE  13          HG23      ILE  13   5.939   7.375 -19.083
    9   HD11  ILE  13          HD11      ILE  13   7.844   5.651 -17.313
   10   HD13  ILE  13          HD12      ILE  13   7.679   6.119 -19.002
   11   HD12  ILE  13          HD13      ILE  13   8.177   4.483 -18.591

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ASN  14           H        ASN  14   2.693   6.239 -16.043
    2    HA   ASN  14           HA       ASN  14   2.679   8.986 -15.411
    3    HB2  ASN  14           HB2      ASN  14   0.770   7.364 -16.243
    4    HB3  ASN  14           HB3      ASN  14   0.443   7.192 -14.523
    5   HD21  ASN  14          HD21      ASN  14  -1.560   8.368 -15.962
    6   HD22  ASN  14          HD22      ASN  14  -1.605  10.042 -15.698

  No H/Q in entry =           6
  In of MODEL   25
    1    H    SER  15           H        SER  15   2.348   6.116 -13.330
    2    HA   SER  15           HA       SER  15   2.050   7.493 -10.885
    3    HB2  SER  15           HB2      SER  15   2.575   5.403  -9.831
    4    HB3  SER  15           HB3      SER  15   1.743   4.991 -11.327
    5    HG   SER  15           HG       SER  15   4.432   4.730 -10.630

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLY  16           H        GLY  16   4.918   6.363 -12.636
    2    HA3  GLY  16           HA2      GLY  16   6.847   7.102 -10.701
    3    HA2  GLY  16           HA3      GLY  16   7.152   6.893 -12.424

  No H/Q in entry =           3
  In of MODEL   25
    1    H    GLN  17           H        GLN  17   5.485   8.867 -13.494
    2    HA   GLN  17           HA       GLN  17   7.086  11.193 -13.185
    3    HB2  GLN  17           HB2      GLN  17   4.331  10.797 -14.388
    4    HB3  GLN  17           HB3      GLN  17   5.217  12.321 -14.467
    5    HG2  GLN  17           HG2      GLN  17   6.328   9.686 -15.464
    6    HG3  GLN  17           HG3      GLN  17   5.505  10.854 -16.498
    7   HE21  GLN  17          HE21      GLN  17   6.689  12.711 -17.175
    8   HE22  GLN  17          HE22      GLN  17   8.301  12.997 -16.724

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ALA  18           H        ALA  18   3.972  10.208 -11.842
    2    HA   ALA  18           HA       ALA  18   3.268  12.606 -10.582
    3    HB1  ALA  18           HB1      ALA  18   2.115  10.160 -10.803
    4    HB2  ALA  18           HB2      ALA  18   1.576  11.387  -9.659
    5    HB3  ALA  18           HB3      ALA  18   2.652  10.095  -9.125

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ARG  19           H        ARG  19   5.112   9.827  -9.294
    2    HA   ARG  19           HA       ARG  19   5.649  10.983  -6.772
    3    HB2  ARG  19           HB2      ARG  19   6.042   8.576  -7.295
    4    HB3  ARG  19           HB3      ARG  19   7.405   9.047  -8.313
    5    HG2  ARG  19           HG2      ARG  19   8.529  10.079  -6.390
    6    HG3  ARG  19           HG3      ARG  19   7.147   9.706  -5.361
    7    HD2  ARG  19           HD2      ARG  19   8.893   8.055  -4.996
    8    HD3  ARG  19           HD3      ARG  19   7.513   7.284  -5.784
    9    HE   ARG  19           HE       ARG  19   9.231   8.084  -7.828
   10   HH21  ARG  19          HH11      ARG  19  10.780   6.663  -8.673
   11   HH22  ARG  19          HH12      ARG  19  11.310   5.311  -7.734
   12   HH11  ARG  19          HH21      ARG  19   9.277   6.057  -5.047
   13   HH12  ARG  19          HH22      ARG  19  10.456   4.968  -5.680

  No H/Q in entry =          13
  In of MODEL   25
    1    H    SER  20           H        SER  20   7.474  10.991  -9.817
    2    HA   SER  20           HA       SER  20   9.730  12.388  -8.990
    3    HB2  SER  20           HB2      SER  20   9.765  11.511 -11.191
    4    HB3  SER  20           HB3      SER  20   8.268  12.331 -11.623
    5    HG   SER  20           HG       SER  20  10.869  13.282 -11.489

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU  21           H        LEU  21   6.645  13.683 -10.196
    2    HA   LEU  21           HA       LEU  21   7.339  16.423  -9.974
    3    HB2  LEU  21           HB2      LEU  21   4.657  15.024  -9.896
    4    HB3  LEU  21           HB3      LEU  21   4.842  16.776  -9.908
    5    HG   LEU  21           HG       LEU  21   6.027  14.961 -12.028
    6   HD13  LEU  21          HD11      LEU  21   3.666  14.694 -12.227
    7   HD12  LEU  21          HD12      LEU  21   4.105  15.911 -13.427
    8   HD11  LEU  21          HD13      LEU  21   3.372  16.402 -11.901
    9   HD21  LEU  21          HD21      LEU  21   5.810  17.939 -11.625
   10   HD23  LEU  21          HD22      LEU  21   5.823  17.308 -13.269
   11   HD22  LEU  21          HD23      LEU  21   7.187  17.006 -12.205

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ALA  22           H        ALA  22   5.802  14.150  -7.726
    2    HA   ALA  22           HA       ALA  22   5.209  15.966  -5.664
    3    HB3  ALA  22           HB1      ALA  22   4.429  13.580  -5.825
    4    HB2  ALA  22           HB2      ALA  22   5.017  14.049  -4.230
    5    HB1  ALA  22           HB3      ALA  22   6.035  13.081  -5.297

  No H/Q in entry =           5
  In of MODEL   25
    1    H    TYR  23           H        TYR  23   8.128  13.916  -6.092
    2    HA   TYR  23           HA       TYR  23   9.513  14.927  -3.838
    3    HB2  TYR  23           HB2      TYR  23  10.288  12.911  -4.990
    4    HB3  TYR  23           HB3      TYR  23  10.611  13.844  -6.451
    5    HD1  TYR  23           HD1      TYR  23  11.566  13.502  -2.858
    6    HD2  TYR  23           HD2      TYR  23  12.655  15.003  -6.733
    7    HE1  TYR  23           HE1      TYR  23  13.826  14.064  -2.006
    8    HE2  TYR  23           HE2      TYR  23  14.914  15.566  -5.881
    9    HH   TYR  23           HH       TYR  23  15.802  14.945  -2.480

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ALA  24           H        ALA  24   9.347  16.030  -7.206
    2    HA   ALA  24           HA       ALA  24  11.258  18.101  -6.959
    3    HB2  ALA  24           HB1      ALA  24  10.821  18.163  -9.169
    4    HB3  ALA  24           HB2      ALA  24   9.271  18.925  -8.814
    5    HB1  ALA  24           HB3      ALA  24   9.383  17.171  -8.941

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA  25           H        ALA  25   7.776  17.943  -6.346
    2    HA   ALA  25           HA       ALA  25   7.314  20.666  -5.782
    3    HB1  ALA  25           HB1      ALA  25   5.640  18.679  -5.984
    4    HB2  ALA  25           HB2      ALA  25   5.278  19.972  -4.838
    5    HB3  ALA  25           HB3      ALA  25   5.956  18.447  -4.263

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU  26           H        LEU  26   8.359  17.982  -3.725
    2    HA   LEU  26           HA       LEU  26   8.468  19.416  -1.290
    3    HB2  LEU  26           HB2      LEU  26   8.547  16.999  -1.280
    4    HB3  LEU  26           HB3      LEU  26  10.020  16.996  -2.248
    5    HG   LEU  26           HG       LEU  26  11.238  18.109  -0.407
    6   HD12  LEU  26          HD11      LEU  26  10.006  18.128   1.850
    7   HD11  LEU  26          HD12      LEU  26   8.520  17.999   0.912
    8   HD13  LEU  26          HD13      LEU  26   9.574  19.397   0.704
    9   HD21  LEU  26          HD21      LEU  26   9.686  15.652   0.467
   10   HD23  LEU  26          HD22      LEU  26  11.203  16.206   1.167
   11   HD22  LEU  26          HD23      LEU  26  11.158  15.645  -0.502

  No H/Q in entry =          11
  In of MODEL   25
    1    H    LYS  27           H        LYS  27  10.887  18.824  -3.808
    2    HA   LYS  27           HA       LYS  27  13.076  20.053  -2.577
    3    HB2  LYS  27           HB2      LYS  27  13.174  18.702  -4.665
    4    HB3  LYS  27           HB3      LYS  27  12.419  20.037  -5.534
    5    HG2  LYS  27           HG2      LYS  27  14.292  21.512  -4.955
    6    HG3  LYS  27           HG3      LYS  27  15.043  20.217  -4.014
    7    HD2  LYS  27           HD2      LYS  27  15.182  18.825  -6.065
    8    HD3  LYS  27           HD3      LYS  27  14.477  20.145  -6.998
    9    HE2  LYS  27           HE2      LYS  27  16.372  21.601  -6.383
   10    HE3  LYS  27           HE3      LYS  27  17.081  20.284  -5.442
   11    HZ3  LYS  27           HZ1      LYS  27  18.077  20.374  -7.626
   12    HZ2  LYS  27           HZ2      LYS  27  16.551  20.264  -8.370
   13    HZ1  LYS  27           HZ3      LYS  27  17.164  18.951  -7.482

  No H/Q in entry =          13
  In of MODEL   25
    1    H    GLN  28           H        GLN  28  10.466  21.447  -4.535
    2    HA   GLN  28           HA       GLN  28  11.441  24.093  -4.690
    3    HB2  GLN  28           HB2      GLN  28   8.602  23.040  -4.582
    4    HB3  GLN  28           HB3      GLN  28   9.025  24.709  -4.960
    5    HG2  GLN  28           HG2      GLN  28  10.010  22.288  -6.497
    6    HG3  GLN  28           HG3      GLN  28   8.684  23.331  -7.008
    7   HE21  GLN  28          HE21      GLN  28  11.843  22.816  -7.692
    8   HE22  GLN  28          HE22      GLN  28  12.330  24.397  -8.079

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ALA  29           H        ALA  29   9.494  22.417  -2.255
    2    HA   ALA  29           HA       ALA  29   8.954  24.615  -0.579
    3    HB2  ALA  29           HB1      ALA  29   8.212  23.053   0.991
    4    HB1  ALA  29           HB2      ALA  29   9.428  21.861   0.531
    5    HB3  ALA  29           HB3      ALA  29   8.046  22.161  -0.521

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LYS  30           H        LYS  30  11.672  22.332  -0.638
    2    HA   LYS  30           HA       LYS  30  12.990  23.284   1.666
    3    HB2  LYS  30           HB2      LYS  30  14.084  21.987  -0.839
    4    HB3  LYS  30           HB3      LYS  30  15.066  22.343   0.584
    5    HG2  LYS  30           HG2      LYS  30  13.502  20.971   1.962
    6    HG3  LYS  30           HG3      LYS  30  12.618  20.552   0.491
    7    HD2  LYS  30           HD2      LYS  30  14.659  19.552  -0.463
    8    HD3  LYS  30           HD3      LYS  30  15.562  19.986   0.990
    9    HE2  LYS  30           HE2      LYS  30  14.047  18.565   2.343
   10    HE3  LYS  30           HE3      LYS  30  13.173  18.112   0.874
   11    HZ2  LYS  30           HZ1      LYS  30  14.955  16.525   1.642
   12    HZ1  LYS  30           HZ2      LYS  30  16.099  17.705   1.191
   13    HZ3  LYS  30           HZ3      LYS  30  15.063  17.025   0.025

  No H/Q in entry =          13
  In of MODEL   25
    1    H    GLN  31           H        GLN  31  12.894  24.483  -1.633
    2    HA   GLN  31           HA       GLN  31  15.056  26.365  -1.210
    3    HB2  GLN  31           HB2      GLN  31  13.019  26.419  -3.439
    4    HB3  GLN  31           HB3      GLN  31  14.642  27.106  -3.438
    5    HG2  GLN  31           HG2      GLN  31  15.089  24.408  -2.857
    6    HG3  GLN  31           HG3      GLN  31  13.787  24.359  -4.038
    7   HE21  GLN  31          HE21      GLN  31  16.627  23.550  -4.434
    8   HE22  GLN  31          HE22      GLN  31  17.207  24.518  -5.701

  No H/Q in entry =           8
  In of MODEL   25
    1    H    GLY  32           H        GLY  32  11.979  26.201  -0.071
    2    HA3  GLY  32           HA2      GLY  32  10.828  27.778   1.197
    3    HA2  GLY  32           HA3      GLY  32  11.961  29.006   0.647

  No H/Q in entry =           3
  In of MODEL   25
    1    H    ASP  33           H        ASP  33  10.592  27.105  -1.845
    2    HA   ASP  33           HA       ASP  33   8.942  29.385  -2.708
    3    HB2  ASP  33           HB2      ASP  33  10.025  26.958  -4.144
    4    HB3  ASP  33           HB3      ASP  33   8.881  28.078  -4.879

  No H/Q in entry =           4
  In of MODEL   25
    1    H    PHE  34           H        PHE  34   7.247  28.921  -1.147
    2    HA   PHE  34           HA       PHE  34   5.854  26.457  -1.050
    3    HB2  PHE  34           HB2      PHE  34   4.907  29.250  -0.378
    4    HB3  PHE  34           HB3      PHE  34   4.049  27.765   0.034
    5    HD1  PHE  34           HD1      PHE  34   6.309  30.154   1.249
    6    HD2  PHE  34           HD2      PHE  34   5.607  25.916   1.202
    7    HE1  PHE  34           HE1      PHE  34   7.694  29.899   3.289
    8    HE2  PHE  34           HE2      PHE  34   6.994  25.666   3.240
    9    HZ   PHE  34           HZ       PHE  34   8.032  27.659   4.283

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ALA  35           H        ALA  35   5.444  29.319  -3.067
    2    HA   ALA  35           HA       ALA  35   2.891  28.717  -4.097
    3    HB3  ALA  35           HB1      ALA  35   3.955  30.099  -6.135
    4    HB2  ALA  35           HB2      ALA  35   5.172  30.457  -4.909
    5    HB1  ALA  35           HB3      ALA  35   3.483  30.875  -4.622

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA  36           H        ALA  36   6.119  28.024  -5.443
    2    HA   ALA  36           HA       ALA  36   5.128  26.596  -7.686
    3    HB3  ALA  36           HB1      ALA  36   7.289  26.708  -8.297
    4    HB2  ALA  36           HB2      ALA  36   7.762  25.679  -6.944
    5    HB1  ALA  36           HB3      ALA  36   7.665  27.428  -6.732

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA  37           H        ALA  37   6.071  25.602  -4.427
    2    HA   ALA  37           HA       ALA  37   5.999  22.814  -4.851
    3    HB2  ALA  37           HB1      ALA  37   5.742  24.610  -2.477
    4    HB1  ALA  37           HB2      ALA  37   6.869  23.286  -2.764
    5    HB3  ALA  37           HB3      ALA  37   5.205  22.942  -2.296

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LYS  38           H        LYS  38   3.475  25.037  -3.693
    2    HA   LYS  38           HA       LYS  38   1.366  23.235  -3.471
    3    HB2  LYS  38           HB2      LYS  38   1.731  25.990  -3.225
    4    HB3  LYS  38           HB3      LYS  38   0.534  25.847  -4.506
    5    HG2  LYS  38           HG2      LYS  38  -0.925  24.533  -3.064
    6    HG3  LYS  38           HG3      LYS  38   0.316  24.469  -1.805
    7    HD2  LYS  38           HD2      LYS  38   0.141  26.807  -1.362
    8    HD3  LYS  38           HD3      LYS  38  -0.766  27.098  -2.847
    9    HE2  LYS  38           HE2      LYS  38  -2.274  27.144  -0.911
   10    HE3  LYS  38           HE3      LYS  38  -2.653  25.768  -1.951
   11    HZ3  LYS  38           HZ1      LYS  38  -1.938  24.296  -0.414
   12    HZ2  LYS  38           HZ2      LYS  38  -2.285  25.557   0.672
   13    HZ1  LYS  38           HZ3      LYS  38  -0.690  25.297   0.151

  No H/Q in entry =          13
  In of MODEL   25
    1    H    ALA  39           H        ALA  39   2.362  25.127  -6.322
    2    HA   ALA  39           HA       ALA  39   0.285  24.268  -8.027
    3    HB2  ALA  39           HB1      ALA  39   3.027  24.900  -9.076
    4    HB1  ALA  39           HB2      ALA  39   2.065  26.167  -8.315
    5    HB3  ALA  39           HB3      ALA  39   1.451  25.331  -9.742

  No H/Q in entry =           5
  In of MODEL   25
    1    H    MET  40           H        MET  40   3.515  22.953  -7.439
    2    HA   MET  40           HA       MET  40   3.411  20.930  -9.426
    3    HB2  MET  40           HB2      MET  40   5.019  21.150  -6.875
    4    HB3  MET  40           HB3      MET  40   5.265  19.891  -8.087
    5    HG2  MET  40           HG2      MET  40   5.339  22.845  -8.757
    6    HG3  MET  40           HG3      MET  40   6.780  21.936  -8.303
    7    HE3  MET  40           HE1      MET  40   7.647  19.711 -11.106
    8    HE2  MET  40           HE2      MET  40   7.079  19.398  -9.469
    9    HE1  MET  40           HE3      MET  40   8.181  20.739  -9.769

  No H/Q in entry =           9
  In of MODEL   25
    1    H    MET  41           H        MET  41   2.489  20.983  -6.005
    2    HA   MET  41           HA       MET  41   1.943  18.222  -5.723
    3    HB2  MET  41           HB2      MET  41   0.619  20.588  -4.379
    4    HB3  MET  41           HB3      MET  41   0.454  18.912  -3.868
    5    HG2  MET  41           HG2      MET  41   3.165  19.122  -3.900
    6    HG3  MET  41           HG3      MET  41   2.732  20.783  -3.508
    7    HE2  MET  41           HE1      MET  41  -0.318  19.548  -1.787
    8    HE1  MET  41           HE2      MET  41   0.507  21.056  -2.166
    9    HE3  MET  41           HE3      MET  41   0.442  20.489  -0.497

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ASP  42           H        ASP  42  -0.080  20.954  -6.706
    2    HA   ASP  42           HA       ASP  42  -2.527  19.605  -6.846
    3    HB2  ASP  42           HB2      ASP  42  -1.808  22.171  -7.105
    4    HB3  ASP  42           HB3      ASP  42  -1.957  21.774  -8.814

  No H/Q in entry =           4
  In of MODEL   25
    1    H    GLN  43           H        GLN  43  -0.078  20.180  -9.344
    2    HA   GLN  43           HA       GLN  43  -1.467  18.863 -11.433
    3    HB2  GLN  43           HB2      GLN  43   1.493  19.366 -11.046
    4    HB3  GLN  43           HB3      GLN  43   0.779  18.727 -12.529
    5    HG2  GLN  43           HG2      GLN  43  -0.723  20.761 -12.577
    6    HG3  GLN  43           HG3      GLN  43   0.230  21.415 -11.249
    7   HE21  GLN  43          HE21      GLN  43   0.404  23.031 -13.337
    8   HE22  GLN  43          HE22      GLN  43   1.819  22.802 -14.241

  No H/Q in entry =           8
  In of MODEL   25
    1    H    SER  44           H        SER  44   0.873  17.716  -9.036
    2    HA   SER  44           HA       SER  44   1.198  15.106 -10.055
    3    HB2  SER  44           HB2      SER  44   2.095  16.545  -7.820
    4    HB3  SER  44           HB3      SER  44   1.225  15.167  -7.148
    5    HG   SER  44           HG       SER  44   3.334  14.537  -7.569

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ARG  45           H        ARG  45  -1.121  16.439  -7.725
    2    HA   ARG  45           HA       ARG  45  -2.519  14.086  -7.089
    3    HB2  ARG  45           HB2      ARG  45  -2.710  16.257  -5.901
    4    HB3  ARG  45           HB3      ARG  45  -3.560  16.925  -7.291
    5    HG2  ARG  45           HG2      ARG  45  -5.334  15.207  -7.009
    6    HG3  ARG  45           HG3      ARG  45  -4.496  14.594  -5.583
    7    HD2  ARG  45           HD2      ARG  45  -4.695  16.864  -4.531
    8    HD3  ARG  45           HD3      ARG  45  -5.677  17.385  -5.917
    9    HE   ARG  45           HE       ARG  45  -6.799  15.016  -4.875
   10   HH21  ARG  45          HH11      ARG  45  -8.637  15.101  -3.608
   11   HH22  ARG  45          HH12      ARG  45  -9.028  16.544  -2.743
   12   HH11  ARG  45          HH21      ARG  45  -6.242  18.262  -3.856
   13   HH12  ARG  45          HH22      ARG  45  -7.667  18.334  -2.881

  No H/Q in entry =          13
  In of MODEL   25
    1    H    MET  46           H        MET  46  -3.087  16.488  -9.645
    2    HA   MET  46           HA       MET  46  -5.429  15.323 -10.710
    3    HB2  MET  46           HB2      MET  46  -3.316  17.136 -11.888
    4    HB3  MET  46           HB3      MET  46  -4.705  16.588 -12.832
    5    HG2  MET  46           HG2      MET  46  -6.232  17.519 -11.142
    6    HG3  MET  46           HG3      MET  46  -4.860  18.049 -10.177
    7    HE3  MET  46           HE1      MET  46  -6.079  21.466 -11.398
    8    HE2  MET  46           HE2      MET  46  -5.289  20.606 -10.080
    9    HE1  MET  46           HE3      MET  46  -6.874  20.077 -10.644

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ALA  47           H        ALA  47  -2.000  14.829 -11.459
    2    HA   ALA  47           HA       ALA  47  -2.347  13.099 -13.667
    3    HB3  ALA  47           HB1      ALA  47  -0.167  13.981 -13.312
    4    HB2  ALA  47           HB2      ALA  47  -0.033  12.252 -12.975
    5    HB1  ALA  47           HB3      ALA  47  -0.125  13.407 -11.644

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU  48           H        LEU  48  -2.088  12.468 -10.191
    2    HA   LEU  48           HA       LEU  48  -2.192   9.629 -10.345
    3    HB2  LEU  48           HB2      LEU  48  -2.954  11.553  -8.136
    4    HB3  LEU  48           HB3      LEU  48  -2.868   9.803  -7.932
    5    HG   LEU  48           HG       LEU  48  -0.560  11.492  -8.927
    6   HD13  LEU  48          HD11      LEU  48  -0.845  12.267  -6.739
    7   HD12  LEU  48          HD12      LEU  48   0.313  10.956  -6.535
    8   HD11  LEU  48          HD13      LEU  48  -1.387  10.700  -6.141
    9   HD22  LEU  48          HD21      LEU  48  -0.068   9.303  -9.563
   10   HD21  LEU  48          HD22      LEU  48  -0.943   8.594  -8.207
   11   HD23  LEU  48          HD23      LEU  48   0.631   9.342  -7.945

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ASN  49           H        ASN  49  -4.648  12.131  -9.954
    2    HA   ASN  49           HA       ASN  49  -6.841  10.475  -9.416
    3    HB2  ASN  49           HB2      ASN  49  -6.880  12.903  -9.101
    4    HB3  ASN  49           HB3      ASN  49  -6.732  13.153 -10.836
    5   HD21  ASN  49          HD21      ASN  49  -8.928  14.234  -9.449
    6   HD22  ASN  49          HD22      ASN  49 -10.337  13.406  -9.902

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLU  50           H        GLU  50  -5.549  11.661 -12.503
    2    HA   GLU  50           HA       GLU  50  -7.504  10.410 -14.151
    3    HB2  GLU  50           HB2      GLU  50  -6.030  12.222 -14.965
    4    HB3  GLU  50           HB3      GLU  50  -4.640  11.145 -14.821
    5    HG2  GLU  50           HG2      GLU  50  -5.616   9.610 -16.457
    6    HG3  GLU  50           HG3      GLU  50  -7.072  10.594 -16.550

  No H/Q in entry =           6
  In of MODEL   25
    1    H    ALA  51           H        ALA  51  -4.341   9.408 -12.936
    2    HA   ALA  51           HA       ALA  51  -4.207   6.952 -14.349
    3    HB2  ALA  51           HB1      ALA  51  -2.230   6.659 -13.243
    4    HB1  ALA  51           HB2      ALA  51  -2.920   7.087 -11.678
    5    HB3  ALA  51           HB3      ALA  51  -2.457   8.354 -12.814

  No H/Q in entry =           5
  In of MODEL   25
    1    H    HIS  52           H        HIS  52  -5.384   7.795 -11.104
    2    HA   HIS  52           HA       HIS  52  -6.082   5.189 -10.270
    3    HB2  HIS  52           HB2      HIS  52  -5.938   7.175  -8.776
    4    HB3  HIS  52           HB3      HIS  52  -7.414   7.798  -9.511
    5    HD1  HIS  52           HD1      HIS  52  -9.630   6.457  -9.069
    6    HD2  HIS  52           HD2      HIS  52  -6.328   5.060  -6.945
    7    HE1  HIS  52           HE1      HIS  52 -10.532   4.902  -7.284
    8    HE2  HIS  52           HE2      HIS  52  -8.530   4.043  -5.980

  No H/Q in entry =           8
  In of MODEL   25
    1    H    LEU  53           H        LEU  53  -7.888   7.651 -12.067
    2    HA   LEU  53           HA       LEU  53 -10.398   6.369 -12.083
    3    HB2  LEU  53           HB2      LEU  53  -9.101   8.343 -13.950
    4    HB3  LEU  53           HB3      LEU  53 -10.699   7.681 -14.281
    5    HG   LEU  53           HG       LEU  53 -10.004   8.989 -11.633
    6   HD12  LEU  53          HD11      LEU  53 -11.228  10.982 -12.567
    7   HD11  LEU  53          HD12      LEU  53 -11.160  10.211 -14.152
    8   HD13  LEU  53          HD13      LEU  53  -9.673  10.679 -13.333
    9   HD23  LEU  53          HD21      LEU  53 -12.584   9.400 -11.800
   10   HD22  LEU  53          HD22      LEU  53 -12.015   7.796 -11.355
   11   HD21  LEU  53          HD23      LEU  53 -12.560   8.108 -12.992

  No H/Q in entry =          11
  In of MODEL   25
    1    H    VAL  54           H        VAL  54  -7.643   6.156 -14.313
    2    HA   VAL  54           HA       VAL  54  -8.868   4.387 -16.156
    3    HB   VAL  54           HB       VAL  54  -5.960   4.882 -15.467
    4   HG12  VAL  54          HG11      VAL  54  -5.711   3.791 -17.853
    5   HG11  VAL  54          HG12      VAL  54  -7.244   3.018 -17.452
    6   HG13  VAL  54          HG13      VAL  54  -5.832   2.759 -16.429
    7   HG22  VAL  54          HG21      VAL  54  -6.719   6.826 -16.517
    8   HG21  VAL  54          HG22      VAL  54  -7.913   5.967 -17.487
    9   HG23  VAL  54          HG23      VAL  54  -6.206   5.878 -17.913

  No H/Q in entry =           9
  In of MODEL   25
    1    H    GLN  55           H        GLN  55  -6.879   3.837 -13.250
    2    HA   GLN  55           HA       GLN  55  -6.801   1.020 -13.501
    3    HB2  GLN  55           HB2      GLN  55  -5.246   1.911 -11.979
    4    HB3  GLN  55           HB3      GLN  55  -6.460   2.885 -11.155
    5    HG2  GLN  55           HG2      GLN  55  -7.160   1.133  -9.835
    6    HG3  GLN  55           HG3      GLN  55  -6.938  -0.057 -11.111
    7   HE21  GLN  55          HE21      GLN  55  -5.322  -1.513 -10.610
    8   HE22  GLN  55          HE22      GLN  55  -3.938  -1.167  -9.694

  No H/Q in entry =           8
  In of MODEL   25
    1    H    THR  56           H        THR  56  -9.127   3.196 -11.897
    2    HA   THR  56           HA       THR  56 -10.724   1.322 -10.608
    3    HB   THR  56           HB       THR  56 -11.806   3.710 -12.123
    4    HG1  THR  56           HG1      THR  56 -10.941   3.752  -9.450
    5   HG22  THR  56          HG21      THR  56 -12.711   2.674  -9.451
    6   HG21  THR  56          HG22      THR  56 -13.292   1.923 -10.938
    7   HG23  THR  56          HG23      THR  56 -13.608   3.631 -10.629

  No H/Q in entry =           7
  In of MODEL   25
    1    H    LYS  57           H        LYS  57 -10.911   2.400 -13.997
    2    HA   LYS  57           HA       LYS  57 -13.073   0.721 -14.753
    3    HB2  LYS  57           HB2      LYS  57 -12.175   2.669 -16.068
    4    HB3  LYS  57           HB3      LYS  57 -10.749   1.710 -16.439
    5    HG2  LYS  57           HG2      LYS  57 -12.114   0.059 -17.611
    6    HG3  LYS  57           HG3      LYS  57 -13.583   0.925 -17.176
    7    HD2  LYS  57           HD2      LYS  57 -12.797   2.892 -18.467
    8    HD3  LYS  57           HD3      LYS  57 -11.346   2.003 -18.927
    9    HE2  LYS  57           HE2      LYS  57 -14.176   1.086 -19.550
   10    HE3  LYS  57           HE3      LYS  57 -13.143   1.939 -20.697
   11    HZ1  LYS  57           HZ1      LYS  57 -11.722  -0.212 -19.568
   12    HZ3  LYS  57           HZ2      LYS  57 -12.141   0.054 -21.194
   13    HZ2  LYS  57           HZ3      LYS  57 -13.204  -0.782 -20.163

  No H/Q in entry =          13
  In of MODEL   25
    1    H    LEU  58           H        LEU  58  -9.571   0.274 -14.685
    2    HA   LEU  58           HA       LEU  58  -9.587  -2.246 -15.969
    3    HB2  LEU  58           HB2      LEU  58  -7.552  -0.960 -14.157
    4    HB3  LEU  58           HB3      LEU  58  -7.296  -2.484 -15.007
    5    HG   LEU  58           HG       LEU  58  -8.033   0.120 -16.379
    6   HD11  LEU  58          HD11      LEU  58  -5.395  -1.127 -15.677
    7   HD13  LEU  58          HD12      LEU  58  -5.882   0.566 -15.633
    8   HD12  LEU  58          HD13      LEU  58  -5.542  -0.210 -17.177
    9   HD22  LEU  58          HD21      LEU  58  -8.612  -1.442 -17.968
   10   HD21  LEU  58          HD22      LEU  58  -7.579  -2.693 -17.280
   11   HD23  LEU  58          HD23      LEU  58  -6.879  -1.425 -18.286

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  59           H        ILE  59 -10.414  -1.333 -12.722
    2    HA   ILE  59           HA       ILE  59 -10.078  -4.099 -11.767
    3    HB   ILE  59           HB       ILE  59  -9.626  -1.835 -10.371
    4   HG12  ILE  59          HG12      ILE  59 -11.025  -4.158  -9.034
    5   HG13  ILE  59          HG13      ILE  59  -9.389  -4.276  -9.631
    6   HG21  ILE  59          HG21      ILE  59 -12.161  -1.307 -10.640
    7   HG23  ILE  59          HG22      ILE  59 -11.447  -1.117  -9.056
    8   HG22  ILE  59          HG23      ILE  59 -12.401  -2.548  -9.434
    9   HD12  ILE  59          HD11      ILE  59  -9.460  -3.661  -7.236
   10   HD11  ILE  59          HD12      ILE  59 -10.339  -2.199  -7.659
   11   HD13  ILE  59          HD13      ILE  59  -8.678  -2.420  -8.212

  No H/Q in entry =          11
  In of MODEL   25
    1    H    GLU  60           H        GLU  60 -12.623  -1.774 -12.589
    2    HA   GLU  60           HA       GLU  60 -14.818  -3.278 -11.579
    3    HB2  GLU  60           HB2      GLU  60 -15.055  -0.921 -12.162
    4    HB3  GLU  60           HB3      GLU  60 -14.666  -1.269 -13.844
    5    HG2  GLU  60           HG2      GLU  60 -16.687  -2.725 -13.978
    6    HG3  GLU  60           HG3      GLU  60 -17.096  -2.265 -12.338

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLY  61           H        GLY  61 -13.135  -3.278 -14.688
    2    HA3  GLY  61           HA2      GLY  61 -14.855  -5.517 -15.579
    3    HA2  GLY  61           HA3      GLY  61 -14.002  -4.418 -16.657

  No H/Q in entry =           3
  In of MODEL   25
    1    H    ASP  62           H        ASP  62 -12.645  -5.869 -13.765
    2    HA   ASP  62           HA       ASP  62 -10.303  -6.727 -15.074
    3    HB2  ASP  62           HB2      ASP  62  -9.825  -7.861 -12.930
    4    HB3  ASP  62           HB3      ASP  62 -10.382  -6.209 -12.687

  No H/Q in entry =           4
  In of MODEL   25
    1    H    ALA  63           H        ALA  63 -13.314  -8.484 -14.322
    2    HA   ALA  63           HA       ALA  63 -12.410 -11.118 -14.872
    3    HB2  ALA  63           HB1      ALA  63 -14.553 -10.786 -13.806
    4    HB1  ALA  63           HB2      ALA  63 -14.874 -11.518 -15.377
    5    HB3  ALA  63           HB3      ALA  63 -15.123  -9.787 -15.142

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLY  64           H        GLY  64 -14.953 -10.540 -16.936
    2    HA3  GLY  64           HA2      GLY  64 -15.217 -10.432 -19.219
    3    HA2  GLY  64           HA3      GLY  64 -13.582  -9.799 -19.333

  No H/Q in entry =           3
  In of MODEL   25
    1    H    GLU  65           H        GLU  65 -13.891 -12.747 -17.603
    2    HA   GLU  65           HA       GLU  65 -13.255 -14.328 -19.995
    3    HB2  GLU  65           HB2      GLU  65 -11.524 -14.121 -17.535
    4    HB3  GLU  65           HB3      GLU  65 -11.368 -15.410 -18.729
    5    HG2  GLU  65           HG2      GLU  65 -10.948 -13.775 -20.494
    6    HG3  GLU  65           HG3      GLU  65 -11.194 -12.450 -19.356

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLY  66           H        GLY  66 -13.173 -16.620 -19.614
    2    HA3  GLY  66           HA2      GLY  66 -15.492 -17.657 -18.460
    3    HA2  GLY  66           HA3      GLY  66 -14.115 -18.596 -19.004

  No H/Q in entry =           3
  In of MODEL   25
    1    H    LYS  67           H        LYS  67 -12.192 -17.627 -17.224
    2    HA   LYS  67           HA       LYS  67 -12.948 -19.106 -14.844
    3    HB2  LYS  67           HB2      LYS  67 -10.561 -19.125 -14.358
    4    HB3  LYS  67           HB3      LYS  67 -10.855 -19.611 -16.033
    5    HG2  LYS  67           HG2      LYS  67 -10.420 -17.281 -16.772
    6    HG3  LYS  67           HG3      LYS  67 -10.073 -16.830 -15.104
    7    HD2  LYS  67           HD2      LYS  67  -8.194 -18.420 -15.052
    8    HD3  LYS  67           HD3      LYS  67  -8.547 -18.895 -16.715
    9    HE2  LYS  67           HE2      LYS  67  -8.156 -16.577 -17.468
   10    HE3  LYS  67           HE3      LYS  67  -7.806 -16.096 -15.807
   11    HZ2  LYS  67           HZ1      LYS  67  -5.988 -16.992 -17.612
   12    HZ1  LYS  67           HZ2      LYS  67  -6.283 -18.369 -16.662
   13    HZ3  LYS  67           HZ3      LYS  67  -5.761 -16.927 -15.932

  No H/Q in entry =          13
  In of MODEL   25
    1    H    MET  68           H        MET  68 -12.364 -18.472 -12.737
    2    HA   MET  68           HA       MET  68 -13.452 -16.016 -11.930
    3    HB2  MET  68           HB2      MET  68 -11.723 -17.975 -10.418
    4    HB3  MET  68           HB3      MET  68 -12.644 -16.664  -9.683
    5    HG2  MET  68           HG2      MET  68 -13.837 -18.892 -11.359
    6    HG3  MET  68           HG3      MET  68 -13.870 -18.823  -9.595
    7    HE1  MET  68           HE1      MET  68 -14.465 -16.913  -8.350
    8    HE3  MET  68           HE2      MET  68 -15.980 -16.040  -8.569
    9    HE2  MET  68           HE3      MET  68 -14.487 -15.380  -9.234

  No H/Q in entry =           9
  In of MODEL   25
    1    H    LYS  69           H        LYS  69 -10.019 -16.965 -12.250
    2    HA   LYS  69           HA       LYS  69  -8.774 -14.964 -10.883
    3    HB2  LYS  69           HB2      LYS  69  -7.967 -16.259 -13.486
    4    HB3  LYS  69           HB3      LYS  69  -6.890 -15.230 -12.539
    5    HG2  LYS  69           HG2      LYS  69  -7.195 -16.712 -10.583
    6    HG3  LYS  69           HG3      LYS  69  -8.264 -17.742 -11.533
    7    HD2  LYS  69           HD2      LYS  69  -6.438 -18.258 -13.082
    8    HD3  LYS  69           HD3      LYS  69  -5.361 -17.174 -12.199
    9    HE2  LYS  69           HE2      LYS  69  -4.846 -19.319 -11.339
   10    HE3  LYS  69           HE3      LYS  69  -5.916 -18.615 -10.128
   11    HZ2  LYS  69           HZ1      LYS  69  -6.434 -20.955 -10.853
   12    HZ1  LYS  69           HZ2      LYS  69  -6.918 -20.303 -12.344
   13    HZ3  LYS  69           HZ3      LYS  69  -7.725 -19.858 -10.916

  No H/Q in entry =          13
  In of MODEL   25
    1    H    VAL  70           H        VAL  70  -7.399 -13.118 -11.737
    2    HA   VAL  70           HA       VAL  70  -8.913 -11.441 -13.658
    3    HB   VAL  70           HB       VAL  70  -8.336  -9.500 -12.219
    4   HG12  VAL  70          HG11      VAL  70  -9.833 -11.706 -10.773
    5   HG11  VAL  70          HG12      VAL  70 -10.525 -10.669 -12.021
    6   HG13  VAL  70          HG13      VAL  70 -10.007  -9.976 -10.485
    7   HG23  VAL  70          HG21      VAL  70  -7.572 -10.000  -9.866
    8   HG22  VAL  70          HG22      VAL  70  -6.361 -10.378 -11.091
    9   HG21  VAL  70          HG23      VAL  70  -7.304 -11.673 -10.355

  No H/Q in entry =           9
  In of MODEL   25
    1    H    SER  71           H        SER  71  -7.501  -9.513 -14.323
    2    HA   SER  71           HA       SER  71  -5.192 -10.424 -15.669
    3    HB2  SER  71           HB2      SER  71  -6.586  -8.401 -16.279
    4    HB3  SER  71           HB3      SER  71  -5.828  -7.559 -14.931
    5    HG   SER  71           HG       SER  71  -4.587  -7.134 -16.700

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU  72           H        LEU  72  -3.211 -10.755 -14.974
    2    HA   LEU  72           HA       LEU  72  -2.498 -10.537 -12.260
    3    HB2  LEU  72           HB2      LEU  72  -0.840 -10.982 -14.738
    4    HB3  LEU  72           HB3      LEU  72  -0.181 -11.050 -13.106
    5    HG   LEU  72           HG       LEU  72  -2.542 -12.734 -14.002
    6   HD12  LEU  72          HD11      LEU  72   0.358 -13.588 -13.771
    7   HD11  LEU  72          HD12      LEU  72  -0.429 -13.204 -15.301
    8   HD13  LEU  72          HD13      LEU  72  -1.000 -14.564 -14.335
    9   HD22  LEU  72          HD21      LEU  72  -2.530 -12.724 -11.648
   10   HD21  LEU  72          HD22      LEU  72  -0.778 -12.638 -11.548
   11   HD23  LEU  72          HD23      LEU  72  -1.560 -14.144 -12.022

  No H/Q in entry =          11
  In of MODEL   25
    1    H    VAL  73           H        VAL  73  -1.762  -8.532 -15.044
    2    HA   VAL  73           HA       VAL  73   0.164  -6.840 -13.939
    3    HB   VAL  73           HB       VAL  73  -0.167  -5.465 -15.814
    4   HG13  VAL  73          HG11      VAL  73  -0.101  -7.010 -17.597
    5   HG12  VAL  73          HG12      VAL  73  -1.249  -8.096 -16.816
    6   HG11  VAL  73          HG13      VAL  73   0.398  -7.964 -16.202
    7   HG21  VAL  73          HG21      VAL  73  -2.986  -6.562 -15.790
    8   HG23  VAL  73          HG22      VAL  73  -2.321  -5.698 -17.173
    9   HG22  VAL  73          HG23      VAL  73  -2.477  -4.882 -15.617

  No H/Q in entry =           9
  In of MODEL   25
    1    H    LEU  74           H        LEU  74  -3.236  -6.936 -13.392
    2    HA   LEU  74           HA       LEU  74  -3.841  -4.275 -12.789
    3    HB2  LEU  74           HB2      LEU  74  -5.582  -5.926 -12.962
    4    HB3  LEU  74           HB3      LEU  74  -4.897  -6.859 -11.635
    5    HG   LEU  74           HG       LEU  74  -5.349  -4.990 -10.083
    6   HD13  LEU  74          HD11      LEU  74  -5.208  -3.050 -11.446
    7   HD12  LEU  74          HD12      LEU  74  -6.919  -3.181 -11.038
    8   HD11  LEU  74          HD13      LEU  74  -6.349  -3.697 -12.626
    9   HD21  LEU  74          HD21      LEU  74  -7.067  -6.811 -10.954
   10   HD23  LEU  74          HD22      LEU  74  -7.880  -5.380 -11.552
   11   HD22  LEU  74          HD23      LEU  74  -7.565  -5.540  -9.841

  No H/Q in entry =          11
  In of MODEL   25
    1    H    VAL  75           H        VAL  75  -2.822  -6.862 -10.617
    2    HA   VAL  75           HA       VAL  75  -2.622  -5.305  -8.276
    3    HB   VAL  75           HB       VAL  75  -1.143  -7.814  -9.058
    4   HG13  VAL  75          HG11      VAL  75   0.135  -6.596  -7.335
    5   HG12  VAL  75          HG12      VAL  75  -0.693  -7.955  -6.590
    6   HG11  VAL  75          HG13      VAL  75  -1.336  -6.332  -6.404
    7   HG21  VAL  75          HG21      VAL  75  -3.731  -7.693  -8.754
    8   HG23  VAL  75          HG22      VAL  75  -3.370  -7.468  -7.043
    9   HG22  VAL  75          HG23      VAL  75  -2.853  -8.940  -7.868

  No H/Q in entry =           9
  In of MODEL   25
    1    H    GLU  76           H        GLU  76  -0.210  -6.086 -10.803
    2    HA   GLU  76           HA       GLU  76   1.980  -4.747  -9.642
    3    HB2  GLU  76           HB2      GLU  76   2.136  -6.240 -11.639
    4    HB3  GLU  76           HB3      GLU  76   1.300  -5.024 -12.592
    5    HG2  GLU  76           HG2      GLU  76   3.135  -3.430 -12.213
    6    HG3  GLU  76           HG3      GLU  76   3.986  -4.598 -11.221

  No H/Q in entry =           6
  In of MODEL   25
    1    H    ALA  77           H        ALA  77  -0.538  -3.538 -11.842
    2    HA   ALA  77           HA       ALA  77   0.467  -0.898 -12.022
    3    HB3  ALA  77           HB1      ALA  77  -2.308  -2.046 -12.381
    4    HB1  ALA  77           HB2      ALA  77  -1.151  -1.600 -13.634
    5    HB2  ALA  77           HB3      ALA  77  -1.930  -0.347 -12.670

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLN  78           H        GLN  78  -1.817  -2.435  -9.814
    2    HA   GLN  78           HA       GLN  78  -2.617  -0.109  -8.422
    3    HB2  GLN  78           HB2      GLN  78  -3.736  -2.365  -8.336
    4    HB3  GLN  78           HB3      GLN  78  -2.408  -2.924  -7.323
    5    HG2  GLN  78           HG2      GLN  78  -2.928  -1.172  -5.673
    6    HG3  GLN  78           HG3      GLN  78  -4.262  -0.614  -6.683
    7   HE21  GLN  78          HE21      GLN  78  -6.090  -1.250  -5.465
    8   HE22  GLN  78          HE22      GLN  78  -6.377  -2.844  -4.956

  No H/Q in entry =           8
  In of MODEL   25
    1    H    LEU  79           H        LEU  79   0.049  -2.377  -7.956
    2    HA   LEU  79           HA       LEU  79   1.021  -1.478  -5.498
    3    HB2  LEU  79           HB2      LEU  79   1.885  -3.494  -6.558
    4    HB3  LEU  79           HB3      LEU  79   2.540  -2.549  -7.891
    5    HG   LEU  79           HG       LEU  79   4.096  -1.413  -6.385
    6   HD13  LEU  79          HD11      LEU  79   3.086  -1.157  -4.323
    7   HD12  LEU  79          HD12      LEU  79   4.157  -2.511  -3.971
    8   HD11  LEU  79          HD13      LEU  79   2.451  -2.803  -4.306
    9   HD23  LEU  79          HD21      LEU  79   5.294  -3.564  -5.472
   10   HD22  LEU  79          HD22      LEU  79   5.097  -3.369  -7.211
   11   HD21  LEU  79          HD23      LEU  79   4.011  -4.431  -6.320

  No H/Q in entry =          11
  In of MODEL   25
    1    H    HIS  80           H        HIS  80   1.908  -0.374  -8.771
    2    HA   HIS  80           HA       HIS  80   3.721   1.608  -7.848
    3    HB2  HIS  80           HB2      HIS  80   2.437   0.912 -10.434
    4    HB3  HIS  80           HB3      HIS  80   3.038   2.562 -10.265
    5    HD1  HIS  80           HD1      HIS  80   5.443   2.851 -10.779
    6    HD2  HIS  80           HD2      HIS  80   4.603  -1.053  -9.581
    7    HE1  HIS  80           HE1      HIS  80   7.628   1.565 -10.934
    8    HE2  HIS  80           HE2      HIS  80   7.128  -0.818 -10.207

  No H/Q in entry =           8
  In of MODEL   25
    1    H    LEU  81           H        LEU  81   0.321   1.779  -8.840
    2    HA   LEU  81           HA       LEU  81   0.055   4.574  -8.518
    3    HB2  LEU  81           HB2      LEU  81  -1.968   2.336  -8.440
    4    HB3  LEU  81           HB3      LEU  81  -2.414   4.041  -8.354
    5    HG   LEU  81           HG       LEU  81  -0.718   2.879 -10.581
    6   HD12  LEU  81          HD11      LEU  81  -2.944   3.203 -11.889
    7   HD11  LEU  81          HD12      LEU  81  -3.705   3.142 -10.300
    8   HD13  LEU  81          HD13      LEU  81  -2.765   1.770 -10.880
    9   HD23  LEU  81          HD21      LEU  81  -1.803   5.024 -11.688
   10   HD22  LEU  81          HD22      LEU  81  -0.389   5.193 -10.650
   11   HD21  LEU  81          HD23      LEU  81  -1.995   5.549 -10.016

  No H/Q in entry =          11
  In of MODEL   25
    1    H    MET  82           H        MET  82  -0.621   1.895  -6.264
    2    HA   MET  82           HA       MET  82  -1.676   3.490  -4.185
    3    HB2  MET  82           HB2      MET  82  -0.311   0.799  -4.213
    4    HB3  MET  82           HB3      MET  82  -0.892   1.530  -2.719
    5    HG2  MET  82           HG2      MET  82  -2.618   1.036  -5.165
    6    HG3  MET  82           HG3      MET  82  -2.548  -0.035  -3.767
    7    HE3  MET  82           HE1      MET  82  -4.276   1.628  -0.962
    8    HE2  MET  82           HE2      MET  82  -2.544   1.899  -1.141
    9    HE1  MET  82           HE3      MET  82  -3.236   0.343  -1.594

  No H/Q in entry =           9
  In of MODEL   25
    1    H    THR  83           H        THR  83   1.624   2.392  -4.860
    2    HA   THR  83           HA       THR  83   2.836   3.499  -2.558
    3    HB   THR  83           HB       THR  83   4.937   3.433  -4.024
    4    HG1  THR  83           HG1      THR  83   4.703   2.902  -6.047
    5   HG22  THR  83          HG21      THR  83   4.486   0.775  -4.351
    6   HG21  THR  83          HG22      THR  83   3.193   1.162  -3.216
    7   HG23  THR  83          HG23      THR  83   4.872   1.501  -2.791

  No H/Q in entry =           7
  In of MODEL   25
    1    H    SER  84           H        SER  84   2.482   4.771  -5.863
    2    HA   SER  84           HA       SER  84   3.827   7.208  -5.409
    3    HB2  SER  84           HB2      SER  84   1.762   6.377  -7.433
    4    HB3  SER  84           HB3      SER  84   2.445   8.002  -7.410
    5    HG   SER  84           HG       SER  84   3.811   5.522  -7.690

  No H/Q in entry =           5
  In of MODEL   25
    1    H    MET  85           H        MET  85   0.330   6.463  -5.248
    2    HA   MET  85           HA       MET  85  -0.525   9.078  -4.656
    3    HB2  MET  85           HB2      MET  85  -2.053   7.278  -5.327
    4    HB3  MET  85           HB3      MET  85  -1.768   6.466  -3.788
    5    HG2  MET  85           HG2      MET  85  -2.660   8.415  -2.577
    6    HG3  MET  85           HG3      MET  85  -2.910   9.257  -4.105
    7    HE1  MET  85           HE1      MET  85  -4.219   6.982  -1.484
    8    HE3  MET  85           HE2      MET  85  -3.609   5.682  -2.506
    9    HE2  MET  85           HE3      MET  85  -5.344   5.863  -2.265

  No H/Q in entry =           9
  In of MODEL   25
    1    H    LEU  86           H        LEU  86   0.378   6.417  -2.503
    2    HA   LEU  86           HA       LEU  86  -0.160   7.728  -0.066
    3    HB2  LEU  86           HB2      LEU  86   0.297   5.255  -0.452
    4    HB3  LEU  86           HB3      LEU  86   2.006   5.678  -0.542
    5    HG   LEU  86           HG       LEU  86   1.677   6.845   1.722
    6   HD11  LEU  86          HD11      LEU  86  -1.018   6.088   1.243
    7   HD13  LEU  86          HD12      LEU  86  -0.355   6.836   2.694
    8   HD12  LEU  86          HD13      LEU  86  -0.452   5.080   2.579
    9   HD23  LEU  86          HD21      LEU  86   1.236   3.855   1.850
   10   HD22  LEU  86          HD22      LEU  86   2.239   4.863   2.891
   11   HD21  LEU  86          HD23      LEU  86   2.745   4.532   1.235

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ALA  87           H        ALA  87   2.827   7.417  -1.944
    2    HA   ALA  87           HA       ALA  87   4.532   8.824  -0.216
    3    HB3  ALA  87           HB1      ALA  87   4.633   7.805  -2.921
    4    HB2  ALA  87           HB2      ALA  87   5.965   8.132  -1.816
    5    HB1  ALA  87           HB3      ALA  87   5.360   9.412  -2.865

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ARG  88           H        ARG  88   2.600   9.963  -2.946
    2    HA   ARG  88           HA       ARG  88   3.387  12.649  -2.832
    3    HB2  ARG  88           HB2      ARG  88   2.134  11.498  -4.691
    4    HB3  ARG  88           HB3      ARG  88   0.674  11.651  -3.714
    5    HG2  ARG  88           HG2      ARG  88   1.705  14.226  -3.633
    6    HG3  ARG  88           HG3      ARG  88   2.133  13.706  -5.260
    7    HD2  ARG  88           HD2      ARG  88  -0.006  13.796  -5.966
    8    HD3  ARG  88           HD3      ARG  88  -0.602  12.949  -4.538
    9    HE   ARG  88           HE       ARG  88  -0.776  15.726  -4.962
   10   HH21  ARG  88          HH11      ARG  88  -1.302  17.062  -3.229
   11   HH22  ARG  88          HH12      ARG  88  -1.014  16.527  -1.609
   12   HH11  ARG  88          HH21      ARG  88   0.220  13.464  -2.580
   13   HH12  ARG  88          HH22      ARG  88  -0.170  14.484  -1.242

  No H/Q in entry =          13
  In of MODEL   25
    1    H    GLU  89           H        GLU  89   0.669  10.992  -1.198
    2    HA   GLU  89           HA       GLU  89  -0.430  13.312  -0.002
    3    HB2  GLU  89           HB2      GLU  89  -1.560  11.079  -0.088
    4    HB3  GLU  89           HB3      GLU  89  -0.443  10.520   1.158
    5    HG2  GLU  89           HG2      GLU  89  -1.259  12.227   2.711
    6    HG3  GLU  89           HG3      GLU  89  -2.303  12.901   1.463

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LEU  90           H        LEU  90   2.004  11.009   1.185
    2    HA   LEU  90           HA       LEU  90   2.359  12.256   3.714
    3    HB2  LEU  90           HB2      LEU  90   4.127  10.468   2.046
    4    HB3  LEU  90           HB3      LEU  90   4.544  10.986   3.685
    5    HG   LEU  90           HG       LEU  90   1.903   9.655   3.018
    6   HD12  LEU  90          HD11      LEU  90   3.028   7.604   4.034
    7   HD11  LEU  90          HD12      LEU  90   4.556   8.450   3.795
    8   HD13  LEU  90          HD13      LEU  90   3.546   8.046   2.406
    9   HD22  LEU  90          HD21      LEU  90   1.638  10.584   5.137
   10   HD21  LEU  90          HD22      LEU  90   3.353  10.467   5.525
   11   HD23  LEU  90          HD23      LEU  90   2.338   9.026   5.573

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  91           H        ILE  91   3.975  12.623   0.591
    2    HA   ILE  91           HA       ILE  91   5.960  14.443   1.434
    3    HB   ILE  91           HB       ILE  91   4.655  13.956  -1.250
    4   HG12  ILE  91          HG12      ILE  91   7.481  13.452  -0.265
    5   HG13  ILE  91          HG13      ILE  91   6.191  12.263  -0.105
    6   HG22  ILE  91          HG21      ILE  91   6.888  15.287  -1.934
    7   HG21  ILE  91          HG22      ILE  91   6.579  16.093  -0.395
    8   HG23  ILE  91          HG23      ILE  91   5.360  16.127  -1.668
    9   HD13  ILE  91          HD11      ILE  91   6.023  11.936  -2.412
   10   HD12  ILE  91          HD12      ILE  91   7.758  12.169  -2.193
   11   HD11  ILE  91          HD13      ILE  91   6.758  13.497  -2.785

  No H/Q in entry =          11
  In of MODEL   25
    1    H    THR  92           H        THR  92   2.605  14.896   0.414
    2    HA   THR  92           HA       THR  92   2.598  17.719   0.348
    3    HB   THR  92           HB       THR  92   0.415  15.740   1.044
    4    HG1  THR  92           HG1      THR  92   0.725  15.556  -1.040
    5   HG22  THR  92          HG21      THR  92  -0.969  17.910   0.313
    6   HG21  THR  92          HG22      THR  92   0.426  18.727   1.013
    7   HG23  THR  92          HG23      THR  92  -0.526  17.614   1.994

  No H/Q in entry =           7
  In of MODEL   25
    1    H    GLU  93           H        GLU  93   2.025  15.428   3.004
    2    HA   GLU  93           HA       GLU  93   1.500  17.339   5.017
    3    HB2  GLU  93           HB2      GLU  93   2.793  14.606   5.263
    4    HB3  GLU  93           HB3      GLU  93   2.105  15.540   6.592
    5    HG2  GLU  93           HG2      GLU  93   0.495  14.769   4.149
    6    HG3  GLU  93           HG3      GLU  93   0.585  13.748   5.580

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LEU  94           H        LEU  94   4.500  15.834   3.880
    2    HA   LEU  94           HA       LEU  94   6.252  16.973   5.772
    3    HB2  LEU  94           HB2      LEU  94   6.656  15.998   2.944
    4    HB3  LEU  94           HB3      LEU  94   7.987  16.648   3.897
    5    HG   LEU  94           HG       LEU  94   6.229  14.467   5.030
    6   HD11  LEU  94          HD11      LEU  94   8.329  14.222   2.906
    7   HD13  LEU  94          HD12      LEU  94   6.876  13.259   3.165
    8   HD12  LEU  94          HD13      LEU  94   8.296  12.998   4.177
    9   HD23  LEU  94          HD21      LEU  94   8.411  13.917   6.191
   10   HD22  LEU  94          HD22      LEU  94   7.753  15.501   6.602
   11   HD21  LEU  94          HD23      LEU  94   9.095  15.369   5.464

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  95           H        ILE  95   5.131  18.147   2.616
    2    HA   ILE  95           HA       ILE  95   6.720  20.493   2.557
    3    HB   ILE  95           HB       ILE  95   4.075  19.825   1.244
    4   HG12  ILE  95          HG12      ILE  95   6.870  20.141   0.116
    5   HG13  ILE  95          HG13      ILE  95   6.208  18.593   0.632
    6   HG21  ILE  95          HG21      ILE  95   5.842  22.280   1.025
    7   HG23  ILE  95          HG22      ILE  95   4.116  22.225   1.376
    8   HG22  ILE  95          HG23      ILE  95   4.701  21.817  -0.238
    9   HD13  ILE  95          HD11      ILE  95   4.654  18.525  -1.102
   10   HD12  ILE  95          HD12      ILE  95   6.011  19.332  -1.888
   11   HD11  ILE  95          HD13      ILE  95   4.643  20.277  -1.301

  No H/Q in entry =          11
  In of MODEL   25
    1    H    GLU  96           H        GLU  96   3.462  19.866   3.843
    2    HA   GLU  96           HA       GLU  96   2.858  22.519   4.587
    3    HB2  GLU  96           HB2      GLU  96   1.171  20.748   4.597
    4    HB3  GLU  96           HB3      GLU  96   2.022  19.917   5.896
    5    HG2  GLU  96           HG2      GLU  96   1.006  21.210   7.460
    6    HG3  GLU  96           HG3      GLU  96   1.554  22.679   6.662

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LEU  97           H        LEU  97   4.677  19.958   6.223
    2    HA   LEU  97           HA       LEU  97   5.036  21.309   8.692
    3    HB2  LEU  97           HB2      LEU  97   6.562  19.126   7.287
    4    HB3  LEU  97           HB3      LEU  97   7.152  19.810   8.800
    5    HG   LEU  97           HG       LEU  97   4.336  18.736   8.482
    6   HD12  LEU  97          HD11      LEU  97   5.257  16.719   9.702
    7   HD11  LEU  97          HD12      LEU  97   6.874  17.338   9.362
    8   HD13  LEU  97          HD13      LEU  97   5.805  16.885   8.034
    9   HD23  LEU  97          HD21      LEU  97   4.778  18.443  11.049
   10   HD22  LEU  97          HD22      LEU  97   4.412  20.057  10.440
   11   HD21  LEU  97          HD23      LEU  97   6.079  19.605  10.791

  No H/Q in entry =          11
  In of MODEL   25
    1    H    HIS  98           H        HIS  98   6.917  21.305   5.673
    2    HA   HIS  98           HA       HIS  98   9.079  22.871   6.577
    3    HB2  HIS  98           HB2      HIS  98   7.793  22.620   3.847
    4    HB3  HIS  98           HB3      HIS  98   9.239  23.588   4.140
    5    HD1  HIS  98           HD1      HIS  98   8.001  20.027   4.163
    6    HD2  HIS  98           HD2      HIS  98  11.597  22.097   4.596
    7    HE1  HIS  98           HE1      HIS  98   9.843  18.283   4.115
    8    HE2  HIS  98           HE2      HIS  98  12.036  19.523   4.379

  No H/Q in entry =           8
  In of MODEL   25
    1    H    GLU  99           H        GLU  99   5.869  23.728   5.389
    2    HA   GLU  99           HA       GLU  99   6.269  26.540   5.327
    3    HB2  GLU  99           HB2      GLU  99   4.385  25.383   4.192
    4    HB3  GLU  99           HB3      GLU  99   3.681  25.030   5.770
    5    HG2  GLU  99           HG2      GLU  99   3.518  27.424   6.265
    6    HG3  GLU  99           HG3      GLU  99   4.302  27.815   4.738

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LYS 100           H        LYS 100   5.113  24.318   7.849
    2    HA   LYS 100           HA       LYS 100   4.536  26.380   9.737
    3    HB2  LYS 100           HB2      LYS 100   5.087  23.425  10.090
    4    HB3  LYS 100           HB3      LYS 100   4.644  24.504  11.419
    5    HG2  LYS 100           HG2      LYS 100   2.587  25.155  10.163
    6    HG3  LYS 100           HG3      LYS 100   3.009  23.980   8.914
    7    HD2  LYS 100           HD2      LYS 100   2.912  22.163  10.579
    8    HD3  LYS 100           HD3      LYS 100   2.507  23.332  11.839
    9    HE2  LYS 100           HE2      LYS 100   0.463  23.967  10.568
   10    HE3  LYS 100           HE3      LYS 100   0.857  22.742   9.355
   11    HZ1  LYS 100           HZ1      LYS 100   0.577  22.083  12.237
   12    HZ3  LYS 100           HZ2      LYS 100   0.557  21.026  10.904
   13    HZ2  LYS 100           HZ3      LYS 100  -0.751  22.076  11.177

  No H/Q in entry =          13
  In of MODEL   25
    1    H    LEU 101           H        LEU 101   7.448  24.560   8.916
    2    HA   LEU 101           HA       LEU 101   9.046  25.391  11.124
    3    HB2  LEU 101           HB2      LEU 101   9.642  24.394   8.350
    4    HB3  LEU 101           HB3      LEU 101  10.946  25.051   9.334
    5    HG   LEU 101           HG       LEU 101   9.093  22.911  10.396
    6   HD12  LEU 101          HD11      LEU 101  11.137  21.399   9.797
    7   HD11  LEU 101          HD12      LEU 101  11.518  22.656   8.623
    8   HD13  LEU 101          HD13      LEU 101   9.982  21.796   8.526
    9   HD21  LEU 101          HD21      LEU 101  11.824  23.999  11.130
   10   HD23  LEU 101          HD22      LEU 101  11.266  22.432  11.711
   11   HD22  LEU 101          HD23      LEU 101  10.384  23.896  12.144

  No H/Q in entry =          11
  In of MODEL   25
    1    H    LYS 102           H        LYS 102   7.485  27.263   8.974
    2    HA   LYS 102           HA       LYS 102   7.583  29.555   8.679
    3    HB2  LYS 102           HB2      LYS 102   9.139  29.431  10.782
    4    HB3  LYS 102           HB3      LYS 102  10.444  29.612   9.627
    5    HG2  LYS 102           HG2      LYS 102   8.352  31.584  10.478
    6    HG3  LYS 102           HG3      LYS 102  10.068  31.829  10.232
    7    HD2  LYS 102           HD2      LYS 102   8.121  31.418   7.926
    8    HD3  LYS 102           HD3      LYS 102   8.515  32.996   8.593
    9    HE2  LYS 102           HE2      LYS 102   9.885  31.796   6.526
   10    HE3  LYS 102           HE3      LYS 102  10.509  33.099   7.537
   11    HZ2  LYS 102           HZ1      LYS 102  12.014  31.182   7.371
   12    HZ1  LYS 102           HZ2      LYS 102  10.841  30.210   8.111
   13    HZ3  LYS 102           HZ3      LYS 102  11.541  31.493   8.970

  No H/Q in entry =          13
  In of MODEL   25
    1    H    ALA 103           H        ALA 103  10.830  28.187   8.127
    2    HA   ALA 103           HA       ALA 103  11.813  29.552   6.052
    3    HB2  ALA 103           HB1      ALA 103  12.682  27.329   5.132
    4    HB1  ALA 103           HB2      ALA 103  11.776  26.565   6.436
    5    HB3  ALA 103           HB3      ALA 103  13.074  27.699   6.811

  No H/Q in entry =           5
  In of MODEL   25
    1    H1   LYS   3           H1       LYS   3 -31.623   5.962 -19.713
    2    H2   LYS   3           H3       LYS   3 -30.625   5.722 -21.066
    3    H3   LYS   3           H2       LYS   3 -31.989   4.738 -20.829
    4    HA   LYS   3           HA       LYS   3 -30.942   3.366 -19.442
    5    HB2  LYS   3           HB2      LYS   3 -28.707   4.868 -20.757
    6    HB3  LYS   3           HB3      LYS   3 -28.343   3.656 -19.528
    7    HG2  LYS   3           HG2      LYS   3 -29.713   2.040 -20.896
    8    HG3  LYS   3           HG3      LYS   3 -29.707   3.256 -22.173
    9    HD2  LYS   3           HD2      LYS   3 -27.221   3.222 -22.124
   10    HD3  LYS   3           HD3      LYS   3 -27.298   1.908 -20.951
   11    HE2  LYS   3           HE2      LYS   3 -28.757   0.703 -22.682
   12    HE3  LYS   3           HE3      LYS   3 -28.177   1.914 -23.824
   13    HZ3  LYS   3           HZ1      LYS   3 -26.339   0.748 -24.107
   14    HZ2  LYS   3           HZ2      LYS   3 -26.931  -0.452 -23.061
   15    HZ1  LYS   3           HZ3      LYS   3 -25.982   0.817 -22.449

  No H/Q in entry =          15
  In of MODEL   25
    1    H    LYS   4           H        LYS   4 -30.989   3.199 -17.382
    2    HA   LYS   4           HA       LYS   4 -30.332   5.489 -15.706
    3    HB2  LYS   4           HB2      LYS   4 -31.447   2.751 -15.037
    4    HB3  LYS   4           HB3      LYS   4 -31.268   4.083 -13.895
    5    HG2  LYS   4           HG2      LYS   4 -33.074   3.991 -16.318
    6    HG3  LYS   4           HG3      LYS   4 -33.565   4.007 -14.625
    7    HD2  LYS   4           HD2      LYS   4 -32.939   6.247 -14.333
    8    HD3  LYS   4           HD3      LYS   4 -31.899   6.237 -15.756
    9    HE2  LYS   4           HE2      LYS   4 -33.867   7.555 -16.204
   10    HE3  LYS   4           HE3      LYS   4 -33.901   6.092 -17.189
   11    HZ3  LYS   4           HZ1      LYS   4 -35.447   5.113 -15.652
   12    HZ2  LYS   4           HZ2      LYS   4 -36.049   6.598 -16.219
   13    HZ1  LYS   4           HZ3      LYS   4 -35.389   6.489 -14.659

  No H/Q in entry =          13
  In of MODEL   25
    1    H    HIS   5           H        HIS   5 -28.867   5.601 -14.113
    2    HA   HIS   5           HA       HIS   5 -26.529   3.847 -14.465
    3    HB2  HIS   5           HB2      HIS   5 -26.868   6.578 -13.227
    4    HB3  HIS   5           HB3      HIS   5 -25.357   5.670 -13.221
    5    HD1  HIS   5           HD1      HIS   5 -23.925   6.931 -14.797
    6    HD2  HIS   5           HD2      HIS   5 -27.705   6.213 -16.358
    7    HE1  HIS   5           HE1      HIS   5 -23.776   7.545 -17.240
    8    HE2  HIS   5           HE2      HIS   5 -26.081   7.095 -18.161

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ILE   6           H        ILE   6 -26.253   2.267 -13.166
    2    HA   ILE   6           HA       ILE   6 -27.234   2.474 -10.399
    3    HB   ILE   6           HB       ILE   6 -26.336   0.051 -11.965
    4   HG12  ILE   6          HG12      ILE   6 -29.106   0.895 -11.104
    5   HG13  ILE   6          HG13      ILE   6 -28.470   1.094 -12.736
    6   HG23  ILE   6          HG21      ILE   6 -26.672  -1.234 -10.119
    7   HG22  ILE   6          HG22      ILE   6 -27.863  -0.131  -9.426
    8   HG21  ILE   6          HG23      ILE   6 -26.144   0.256  -9.333
    9   HD13  ILE   6          HD11      ILE   6 -28.867  -1.032 -13.260
   10   HD12  ILE   6          HD12      ILE   6 -29.882  -1.061 -11.818
   11   HD11  ILE   6          HD13      ILE   6 -28.210  -1.621 -11.733

  No H/Q in entry =          11
  In of MODEL   25
    1    H    TYR   7           H        TYR   7 -25.495   3.151  -9.105
    2    HA   TYR   7           HA       TYR   7 -22.757   2.283  -9.795
    3    HB2  TYR   7           HB2      TYR   7 -23.792   4.671  -8.286
    4    HB3  TYR   7           HB3      TYR   7 -22.093   4.206  -8.331
    5    HD1  TYR   7           HD1      TYR   7 -23.104   3.269 -11.432
    6    HD2  TYR   7           HD2      TYR   7 -22.539   6.834  -9.164
    7    HE1  TYR   7           HE1      TYR   7 -22.710   4.534 -13.509
    8    HE2  TYR   7           HE2      TYR   7 -22.187   8.102 -11.233
    9    HH   TYR   7           HH       TYR   7 -22.403   8.035 -13.467

  No H/Q in entry =           9
  In of MODEL   25
    1    H    LEU   8           H        LEU   8 -21.752   0.944  -8.482
    2    HA   LEU   8           HA       LEU   8 -22.867   0.387  -5.805
    3    HB2  LEU   8           HB2      LEU   8 -21.117  -1.206  -7.657
    4    HB3  LEU   8           HB3      LEU   8 -21.291  -1.612  -5.950
    5    HG   LEU   8           HG       LEU   8 -23.765  -1.851  -6.374
    6   HD13  LEU   8          HD11      LEU   8 -23.931  -0.617  -8.470
    7   HD12  LEU   8          HD12      LEU   8 -24.412  -2.292  -8.729
    8   HD11  LEU   8          HD13      LEU   8 -22.820  -1.742  -9.248
    9   HD23  LEU   8          HD21      LEU   8 -22.432  -3.835  -8.091
   10   HD22  LEU   8          HD22      LEU   8 -23.514  -4.051  -6.715
   11   HD21  LEU   8          HD23      LEU   8 -21.818  -3.650  -6.449

  No H/Q in entry =          11
  In of MODEL   25
    1    H    PHE   9           H        PHE   9 -21.613   0.799  -4.018
    2    HA   PHE   9           HA       PHE   9 -18.847   1.808  -4.493
    3    HB2  PHE   9           HB2      PHE   9 -20.910   2.826  -2.541
    4    HB3  PHE   9           HB3      PHE   9 -19.212   3.287  -2.512
    5    HD1  PHE   9           HD1      PHE   9 -18.248   4.673  -4.258
    6    HD2  PHE   9           HD2      PHE   9 -22.393   3.568  -4.358
    7    HE1  PHE   9           HE1      PHE   9 -18.659   6.365  -6.020
    8    HE2  PHE   9           HE2      PHE   9 -22.804   5.271  -6.115
    9    HZ   PHE   9           HZ       PHE   9 -20.935   6.666  -6.952

  No H/Q in entry =           9
  In of MODEL   25
    1    H    SER  10           H        SER  10 -17.239   0.939  -3.329
    2    HA   SER  10           HA       SER  10 -17.460   0.011  -0.657
    3    HB2  SER  10           HB2      SER  10 -18.627  -1.877  -1.748
    4    HB3  SER  10           HB3      SER  10 -17.234  -2.114  -2.791
    5    HG   SER  10           HG       SER  10 -16.713  -3.414  -1.203

  No H/Q in entry =           5
  In of MODEL   25
    1    H    SER  11           H        SER  11 -15.436   0.069   0.219
    2    HA   SER  11           HA       SER  11 -13.264   1.026  -1.289
    3    HB2  SER  11           HB2      SER  11 -12.744  -0.402   1.264
    4    HB3  SER  11           HB3      SER  11 -12.145   1.156   0.690
    5    HG   SER  11           HG       SER  11 -14.764   0.526   1.606

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA  12           H        ALA  12 -14.395  -1.636  -2.191
    2    HA   ALA  12           HA       ALA  12 -11.801  -2.842  -2.730
    3    HB3  ALA  12           HB1      ALA  12 -12.859  -5.158  -2.199
    4    HB1  ALA  12           HB2      ALA  12 -13.959  -4.239  -1.173
    5    HB2  ALA  12           HB3      ALA  12 -12.223  -4.186  -0.870

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLY  13           H        GLY  13 -12.536  -1.807  -4.751
    2    HA3  GLY  13           HA2      GLY  13 -14.772  -2.453  -6.243
    3    HA2  GLY  13           HA3      GLY  13 -13.211  -2.015  -6.952

  No H/Q in entry =           3
  In of MODEL   25
    1    H    MET  14           H        MET  14 -11.701  -4.292  -6.147
    2    HA   MET  14           HA       MET  14 -12.207  -6.021  -8.262
    3    HB2  MET  14           HB2      MET  14 -10.060  -6.074  -7.085
    4    HB3  MET  14           HB3      MET  14 -10.825  -6.793  -5.668
    5    HG2  MET  14           HG2      MET  14 -11.460  -8.765  -7.034
    6    HG3  MET  14           HG3      MET  14 -10.678  -8.038  -8.438
    7    HE1  MET  14           HE1      MET  14  -8.544  -7.253  -8.584
    8    HE3  MET  14           HE2      MET  14  -7.104  -8.086  -7.999
    9    HE2  MET  14           HE3      MET  14  -7.792  -6.766  -7.057

  No H/Q in entry =           9
  In of MODEL   25
    1    H    SER  15           H        SER  15 -13.231  -6.559  -4.879
    2    HA   SER  15           HA       SER  15 -14.538  -9.036  -5.489
    3    HB2  SER  15           HB2      SER  15 -13.948  -8.465  -3.147
    4    HB3  SER  15           HB3      SER  15 -15.144  -7.171  -3.179
    5    HG   SER  15           HG       SER  15 -15.680  -9.481  -2.384

  No H/Q in entry =           5
  In of MODEL   25
    1    H    THR  16           H        THR  16 -15.735  -5.688  -5.206
    2    HA   THR  16           HA       THR  16 -18.500  -6.300  -5.774
    3    HB   THR  16           HB       THR  16 -17.042  -3.677  -6.250
    4    HG1  THR  16           HG1      THR  16 -16.642  -3.859  -4.195
    5   HG22  THR  16          HG21      THR  16 -19.846  -3.989  -5.251
    6   HG21  THR  16          HG22      THR  16 -19.527  -4.225  -6.978
    7   HG23  THR  16          HG23      THR  16 -19.137  -2.687  -6.197

  No H/Q in entry =           7
  In of MODEL   25
    1    H    SER  17           H        SER  17 -15.643  -5.640  -7.601
    2    HA   SER  17           HA       SER  17 -16.790  -4.906 -10.096
    3    HB2  SER  17           HB2      SER  17 -14.132  -6.225  -9.483
    4    HB3  SER  17           HB3      SER  17 -14.595  -5.611 -11.070
    5    HG   SER  17           HG       SER  17 -15.073  -3.658  -9.439

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU  18           H        LEU  18 -16.129  -8.048  -8.682
    2    HA   LEU  18           HA       LEU  18 -16.668  -9.539 -11.055
    3    HB2  LEU  18           HB2      LEU  18 -15.421 -10.478  -9.153
    4    HB3  LEU  18           HB3      LEU  18 -16.864 -10.349  -8.149
    5    HG   LEU  18           HG       LEU  18 -18.028 -11.952  -9.570
    6   HD11  LEU  18          HD11      LEU  18 -15.529 -11.672 -11.206
    7   HD13  LEU  18          HD12      LEU  18 -17.212 -11.677 -11.733
    8   HD12  LEU  18          HD13      LEU  18 -16.437 -13.182 -11.244
    9   HD23  LEU  18          HD21      LEU  18 -16.681 -13.926  -9.045
   10   HD22  LEU  18          HD22      LEU  18 -16.788 -12.792  -7.697
   11   HD21  LEU  18          HD23      LEU  18 -15.316 -12.874  -8.666

  No H/Q in entry =          11
  In of MODEL   25
    1    H    LEU  19           H        LEU  19 -18.674  -8.421  -8.333
    2    HA   LEU  19           HA       LEU  19 -21.100  -9.670  -9.181
    3    HB2  LEU  19           HB2      LEU  19 -20.850  -8.848  -6.919
    4    HB3  LEU  19           HB3      LEU  19 -20.631  -7.203  -7.512
    5    HG   LEU  19           HG       LEU  19 -22.954  -7.082  -8.167
    6   HD13  LEU  19          HD11      LEU  19 -23.344  -9.381  -8.841
    7   HD12  LEU  19          HD12      LEU  19 -24.500  -8.938  -7.585
    8   HD11  LEU  19          HD13      LEU  19 -23.103  -9.937  -7.185
    9   HD22  LEU  19          HD21      LEU  19 -22.470  -6.411  -5.941
   10   HD21  LEU  19          HD22      LEU  19 -22.461  -8.081  -5.374
   11   HD23  LEU  19          HD23      LEU  19 -23.971  -7.335  -5.898

  No H/Q in entry =          11
  In of MODEL   25
    1    H    VAL  20           H        VAL  20 -19.699  -6.457  -9.839
    2    HA   VAL  20           HA       VAL  20 -21.840  -5.463 -11.399
    3    HB   VAL  20           HB       VAL  20 -18.871  -4.779 -11.509
    4   HG12  VAL  20          HG11      VAL  20 -19.589  -2.741 -12.760
    5   HG11  VAL  20          HG12      VAL  20 -21.202  -3.440 -12.906
    6   HG13  VAL  20          HG13      VAL  20 -19.825  -4.229 -13.675
    7   HG21  VAL  20          HG21      VAL  20 -21.252  -3.619 -10.126
    8   HG23  VAL  20          HG22      VAL  20 -19.856  -2.615 -10.511
    9   HG22  VAL  20          HG23      VAL  20 -19.665  -4.026  -9.471

  No H/Q in entry =           9
  In of MODEL   25
    1    H    SER  21           H        SER  21 -19.021  -7.417 -12.446
    2    HA   SER  21           HA       SER  21 -19.806  -7.299 -15.197
    3    HB2  SER  21           HB2      SER  21 -18.311  -9.217 -15.549
    4    HB3  SER  21           HB3      SER  21 -17.521  -7.958 -14.604
    5    HG   SER  21           HG       SER  21 -17.682 -10.431 -13.982

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LYS  22           H        LYS  22 -20.807  -9.544 -12.650
    2    HA   LYS  22           HA       LYS  22 -22.295 -11.189 -14.492
    3    HB2  LYS  22           HB2      LYS  22 -22.435 -10.884 -11.494
    4    HB3  LYS  22           HB3      LYS  22 -23.448 -12.002 -12.405
    5    HG2  LYS  22           HG2      LYS  22 -20.557 -12.250 -12.889
    6    HG3  LYS  22           HG3      LYS  22 -21.090 -12.661 -11.260
    7    HD2  LYS  22           HD2      LYS  22 -21.118 -14.672 -12.535
    8    HD3  LYS  22           HD3      LYS  22 -22.797 -14.182 -12.297
    9    HE2  LYS  22           HE2      LYS  22 -22.964 -13.369 -14.540
   10    HE3  LYS  22           HE3      LYS  22 -21.225 -13.523 -14.793
   11    HZ1  LYS  22           HZ1      LYS  22 -22.693 -15.947 -14.116
   12    HZ3  LYS  22           HZ2      LYS  22 -21.379 -15.725 -15.169
   13    HZ2  LYS  22           HZ3      LYS  22 -22.945 -15.299 -15.666

  No H/Q in entry =          13
  In of MODEL   25
    1    H    MET  23           H        MET  23 -23.106  -8.311 -12.592
    2    HA   MET  23           HA       MET  23 -25.909  -8.466 -13.102
    3    HB2  MET  23           HB2      MET  23 -24.131  -6.111 -12.501
    4    HB3  MET  23           HB3      MET  23 -25.880  -5.990 -12.680
    5    HG2  MET  23           HG2      MET  23 -26.235  -7.327 -10.726
    6    HG3  MET  23           HG3      MET  23 -24.515  -7.690 -10.602
    7    HE2  MET  23           HE1      MET  23 -26.919  -4.120  -9.375
    8    HE1  MET  23           HE2      MET  23 -27.143  -5.080 -10.837
    9    HE3  MET  23           HE3      MET  23 -26.149  -3.623 -10.883

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ARG  24           H        ARG  24 -23.196  -6.938 -14.867
    2    HA   ARG  24           HA       ARG  24 -24.728  -5.659 -16.852
    3    HB2  ARG  24           HB2      ARG  24 -22.292  -5.208 -16.452
    4    HB3  ARG  24           HB3      ARG  24 -21.920  -6.777 -17.123
    5    HG2  ARG  24           HG2      ARG  24 -22.779  -6.083 -19.343
    6    HG3  ARG  24           HG3      ARG  24 -23.227  -4.498 -18.658
    7    HD2  ARG  24           HD2      ARG  24 -21.048  -4.270 -19.725
    8    HD3  ARG  24           HD3      ARG  24 -20.840  -4.201 -17.981
    9    HE   ARG  24           HE       ARG  24 -20.369  -6.785 -18.474
   10   HH21  ARG  24          HH11      ARG  24 -18.292  -7.136 -17.690
   11   HH22  ARG  24          HH12      ARG  24 -16.976  -6.195 -18.301
   12   HH11  ARG  24          HH21      ARG  24 -19.180  -4.005 -19.995
   13   HH12  ARG  24          HH22      ARG  24 -17.511  -4.352 -19.672

  No H/Q in entry =          13
  In of MODEL   25
    1    H    ALA  25           H        ALA  25 -23.514  -8.967 -16.614
    2    HA   ALA  25           HA       ALA  25 -24.116  -9.785 -19.261
    3    HB1  ALA  25           HB1      ALA  25 -23.365 -11.804 -18.589
    4    HB3  ALA  25           HB2      ALA  25 -24.424 -11.829 -17.179
    5    HB2  ALA  25           HB3      ALA  25 -22.892 -10.960 -17.114

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLN  26           H        GLN  26 -25.944  -9.909 -16.241
    2    HA   GLN  26           HA       GLN  26 -28.253 -11.164 -17.276
    3    HB2  GLN  26           HB2      GLN  26 -27.791  -9.431 -14.867
    4    HB3  GLN  26           HB3      GLN  26 -29.333 -10.193 -15.228
    5    HG2  GLN  26           HG2      GLN  26 -26.709 -11.584 -14.773
    6    HG3  GLN  26           HG3      GLN  26 -28.073 -11.531 -13.664
    7   HE21  GLN  26          HE21      GLN  26 -26.796 -13.647 -14.965
    8   HE22  GLN  26          HE22      GLN  26 -27.808 -14.713 -15.775

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ALA  27           H        ALA  27 -27.412  -7.747 -16.842
    2    HA   ALA  27           HA       ALA  27 -29.929  -6.713 -17.615
    3    HB1  ALA  27           HB1      ALA  27 -28.158  -5.363 -16.481
    4    HB3  ALA  27           HB2      ALA  27 -28.767  -4.594 -17.949
    5    HB2  ALA  27           HB3      ALA  27 -27.209  -5.419 -17.968

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLU  28           H        GLU  28 -27.194  -7.838 -19.495
    2    HA   GLU  28           HA       GLU  28 -28.154  -6.793 -22.003
    3    HB2  GLU  28           HB2      GLU  28 -25.759  -7.419 -21.384
    4    HB3  GLU  28           HB3      GLU  28 -26.258  -9.094 -21.608
    5    HG2  GLU  28           HG2      GLU  28 -25.130  -8.262 -23.565
    6    HG3  GLU  28           HG3      GLU  28 -26.819  -8.627 -23.920

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LYS  29           H        LYS  29 -28.238  -9.922 -20.386
    2    HA   LYS  29           HA       LYS  29 -29.498 -11.403 -22.411
    3    HB2  LYS  29           HB2      LYS  29 -28.425 -12.382 -20.419
    4    HB3  LYS  29           HB3      LYS  29 -29.716 -11.724 -19.417
    5    HG2  LYS  29           HG2      LYS  29 -31.338 -13.126 -20.504
    6    HG3  LYS  29           HG3      LYS  29 -30.121 -13.714 -21.634
    7    HD2  LYS  29           HD2      LYS  29 -28.949 -14.872 -19.915
    8    HD3  LYS  29           HD3      LYS  29 -29.880 -14.071 -18.650
    9    HE2  LYS  29           HE2      LYS  29 -30.568 -16.435 -19.044
   10    HE3  LYS  29           HE3      LYS  29 -31.877 -15.275 -19.274
   11    HZ1  LYS  29           HZ1      LYS  29 -31.306 -15.362 -21.702
   12    HZ3  LYS  29           HZ2      LYS  29 -31.990 -16.776 -21.056
   13    HZ2  LYS  29           HZ3      LYS  29 -30.320 -16.699 -21.351

  No H/Q in entry =          13
  In of MODEL   25
    1    H    TYR  30           H        TYR  30 -30.950  -9.368 -19.883
    2    HA   TYR  30           HA       TYR  30 -33.598  -9.873 -21.134
    3    HB2  TYR  30           HB2      TYR  30 -32.979  -8.738 -18.397
    4    HB3  TYR  30           HB3      TYR  30 -34.589  -9.030 -19.056
    5    HD1  TYR  30           HD1      TYR  30 -35.436 -11.344 -19.300
    6    HD2  TYR  30           HD2      TYR  30 -31.625 -10.539 -17.581
    7    HE1  TYR  30           HE1      TYR  30 -35.285 -13.678 -18.534
    8    HE2  TYR  30           HE2      TYR  30 -31.473 -12.860 -16.819
    9    HH   TYR  30           HH       TYR  30 -33.047 -15.250 -17.945

  No H/Q in entry =           9
  In of MODEL   25
    1    H    GLU  31           H        GLU  31 -31.486  -7.813 -21.905
    2    HA   GLU  31           HA       GLU  31 -31.471  -5.644 -22.699
    3    HB2  GLU  31           HB2      GLU  31 -34.344  -6.432 -23.225
    4    HB3  GLU  31           HB3      GLU  31 -33.541  -5.032 -23.935
    5    HG2  GLU  31           HG2      GLU  31 -32.028  -6.413 -25.144
    6    HG3  GLU  31           HG3      GLU  31 -32.555  -7.854 -24.275

  No H/Q in entry =           6
  In of MODEL   25
    1    H    VAL  32           H        VAL  32 -31.676  -5.584 -19.966
    2    HA   VAL  32           HA       VAL  32 -33.597  -3.533 -19.283
    3    HB   VAL  32           HB       VAL  32 -31.180  -4.480 -17.711
    4   HG12  VAL  32          HG11      VAL  32 -32.741  -3.724 -15.807
    5   HG11  VAL  32          HG12      VAL  32 -33.596  -2.827 -17.061
    6   HG13  VAL  32          HG13      VAL  32 -31.899  -2.480 -16.734
    7   HG21  VAL  32          HG21      VAL  32 -32.898  -6.239 -18.425
    8   HG23  VAL  32          HG22      VAL  32 -33.962  -5.457 -17.255
    9   HG22  VAL  32          HG23      VAL  32 -32.426  -6.145 -16.728

  No H/Q in entry =           9
  In of MODEL   25
    1    HA   PRO  33           HA       PRO  33 -30.647  -0.498 -20.913
    2    HB2  PRO  33           HB2      PRO  33 -32.221   1.679 -20.762
    3    HB3  PRO  33           HB3      PRO  33 -32.651   0.379 -21.874
    4    HG2  PRO  33           HG2      PRO  33 -33.637   0.831 -19.056
    5    HG3  PRO  33           HG3      PRO  33 -34.594   0.614 -20.522
    6    HD2  PRO  33           HD2      PRO  33 -34.081  -1.467 -18.883
    7    HD3  PRO  33           HD3      PRO  33 -34.134  -1.687 -20.632

  No H/Q in entry =           7
  In of MODEL   25
    1    H    VAL  34           H        VAL  34 -29.371  -1.032 -18.969
    2    HA   VAL  34           HA       VAL  34 -29.159   1.379 -17.289
    3    HB   VAL  34           HB       VAL  34 -28.538  -0.091 -15.370
    4   HG12  VAL  34          HG11      VAL  34 -30.924  -1.037 -15.078
    5   HG11  VAL  34          HG12      VAL  34 -31.261  -0.267 -16.626
    6   HG13  VAL  34          HG13      VAL  34 -30.738   0.707 -15.252
    7   HG21  VAL  34          HG21      VAL  34 -28.662  -2.094 -17.405
    8   HG23  VAL  34          HG22      VAL  34 -29.710  -2.504 -16.046
    9   HG22  VAL  34          HG23      VAL  34 -28.001  -2.171 -15.772

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ILE  35           H        ILE  35 -27.197   1.861 -16.440
    2    HA   ILE  35           HA       ILE  35 -24.854   0.617 -17.717
    3    HB   ILE  35           HB       ILE  35 -25.339   3.482 -16.868
    4   HG12  ILE  35          HG12      ILE  35 -24.316   2.239 -19.429
    5   HG13  ILE  35          HG13      ILE  35 -25.963   2.808 -19.163
    6   HG21  ILE  35          HG21      ILE  35 -22.733   2.029 -17.194
    7   HG23  ILE  35          HG22      ILE  35 -23.222   3.178 -15.951
    8   HG22  ILE  35          HG23      ILE  35 -22.855   3.745 -17.580
    9   HD11  ILE  35          HD11      ILE  35 -24.628   5.034 -18.531
   10   HD13  ILE  35          HD12      ILE  35 -25.152   4.658 -20.173
   11   HD12  ILE  35          HD13      ILE  35 -23.491   4.330 -19.680

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ILE  36           H        ILE  36 -23.595  -0.392 -16.131
    2    HA   ILE  36           HA       ILE  36 -24.056   0.171 -13.253
    3    HB   ILE  36           HB       ILE  36 -23.148  -2.491 -14.396
    4   HG12  ILE  36          HG12      ILE  36 -25.979  -1.779 -13.625
    5   HG13  ILE  36          HG13      ILE  36 -25.406  -1.719 -15.292
    6   HG23  ILE  36          HG21      ILE  36 -23.477  -3.359 -12.294
    7   HG22  ILE  36          HG22      ILE  36 -24.641  -2.115 -11.840
    8   HG21  ILE  36          HG23      ILE  36 -22.921  -1.731 -11.904
    9   HD13  ILE  36          HD11      ILE  36 -25.506  -3.934 -15.528
   10   HD12  ILE  36          HD12      ILE  36 -26.576  -3.863 -14.129
   11   HD11  ILE  36          HD13      ILE  36 -24.867  -4.235 -13.913

  No H/Q in entry =          11
  In of MODEL   25
    1    H    GLU  37           H        GLU  37 -22.295   0.838 -12.137
    2    HA   GLU  37           HA       GLU  37 -19.581   0.134 -13.061
    3    HB2  GLU  37           HB2      GLU  37 -20.554   2.887 -12.313
    4    HB3  GLU  37           HB3      GLU  37 -18.855   2.442 -12.472
    5    HG2  GLU  37           HG2      GLU  37 -19.145   2.037 -14.827
    6    HG3  GLU  37           HG3      GLU  37 -20.871   2.371 -14.697

  No H/Q in entry =           6
  In of MODEL   25
    1    H    ALA  38           H        ALA  38 -18.090  -0.082 -11.379
    2    HA   ALA  38           HA       ALA  38 -19.129   0.028  -8.608
    3    HB1  ALA  38           HB1      ALA  38 -17.356  -1.839 -10.058
    4    HB3  ALA  38           HB2      ALA  38 -18.399  -2.125  -8.664
    5    HB2  ALA  38           HB3      ALA  38 -16.808  -1.397  -8.439

  No H/Q in entry =           5
  In of MODEL   25
    1    H    PHE  39           H        PHE  39 -17.927   1.255  -7.117
    2    HA   PHE  39           HA       PHE  39 -15.439   2.546  -7.993
    3    HB2  PHE  39           HB2      PHE  39 -17.915   3.936  -7.000
    4    HB3  PHE  39           HB3      PHE  39 -16.315   4.653  -6.825
    5    HD1  PHE  39           HD1      PHE  39 -14.919   4.880  -8.980
    6    HD2  PHE  39           HD2      PHE  39 -19.143   4.305  -8.908
    7    HE1  PHE  39           HE1      PHE  39 -15.074   5.817 -11.270
    8    HE2  PHE  39           HE2      PHE  39 -19.314   5.231 -11.190
    9    HZ   PHE  39           HZ       PHE  39 -17.280   5.961 -12.391

  No H/Q in entry =           9
  In of MODEL   25
    1    HA   PRO  40           HA       PRO  40 -14.481   1.764  -3.716
    2    HB2  PRO  40           HB2      PRO  40 -12.779   3.825  -3.081
    3    HB3  PRO  40           HB3      PRO  40 -12.292   2.523  -4.166
    4    HG2  PRO  40           HG2      PRO  40 -13.401   5.235  -4.876
    5    HG3  PRO  40           HG3      PRO  40 -11.949   4.446  -5.493
    6    HD2  PRO  40           HD2      PRO  40 -14.167   4.304  -6.908
    7    HD3  PRO  40           HD3      PRO  40 -13.164   2.866  -6.729

  No H/Q in entry =           7
  In of MODEL   25
    1    H    GLU  41           H        GLU  41 -15.135   2.694  -1.574
    2    HA   GLU  41           HA       GLU  41 -17.433   4.323  -1.538
    3    HB2  GLU  41           HB2      GLU  41 -17.292   4.218   0.837
    4    HB3  GLU  41           HB3      GLU  41 -16.745   2.659   0.218
    5    HG2  GLU  41           HG2      GLU  41 -14.429   3.289   0.612
    6    HG3  GLU  41           HG3      GLU  41 -14.942   4.881   1.173

  No H/Q in entry =           6
  In of MODEL   25
    1    H    THR  42           H        THR  42 -14.133   5.347  -1.573
    2    HA   THR  42           HA       THR  42 -14.569   7.879  -0.327
    3    HB   THR  42           HB       THR  42 -12.431   8.536  -1.399
    4    HG1  THR  42           HG1      THR  42 -12.243   5.951  -2.475
    5   HG21  THR  42          HG21      THR  42 -12.569   7.058   0.681
    6   HG23  THR  42          HG22      THR  42 -11.047   7.007  -0.211
    7   HG22  THR  42          HG23      THR  42 -12.216   5.701  -0.388

  No H/Q in entry =           7
  In of MODEL   25
    1    H    LEU  43           H        LEU  43 -15.435   6.798  -3.443
    2    HA   LEU  43           HA       LEU  43 -15.777   9.573  -4.377
    3    HB2  LEU  43           HB2      LEU  43 -15.947   6.909  -5.766
    4    HB3  LEU  43           HB3      LEU  43 -16.396   8.434  -6.529
    5    HG   LEU  43           HG       LEU  43 -13.622   7.725  -5.610
    6   HD11  LEU  43          HD11      LEU  43 -15.105   7.242  -8.110
    7   HD13  LEU  43          HD12      LEU  43 -13.690   6.420  -7.455
    8   HD12  LEU  43          HD13      LEU  43 -13.502   7.955  -8.301
    9   HD23  LEU  43          HD21      LEU  43 -13.142   9.712  -7.179
   10   HD22  LEU  43          HD22      LEU  43 -13.801  10.064  -5.580
   11   HD21  LEU  43          HD23      LEU  43 -14.854  10.094  -6.994

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ALA  44           H        ALA  44 -17.664   7.661  -2.550
    2    HA   ALA  44           HA       ALA  44 -20.135   7.458  -3.877
    3    HB2  ALA  44           HB1      ALA  44 -19.962   6.319  -1.796
    4    HB3  ALA  44           HB2      ALA  44 -21.112   7.624  -1.507
    5    HB1  ALA  44           HB3      ALA  44 -19.447   7.779  -0.952

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLY  45           H        GLY  45 -18.808  10.283  -2.307
    2    HA3  GLY  45           HA2      GLY  45 -21.293  11.707  -2.650
    3    HA2  GLY  45           HA3      GLY  45 -19.770  12.374  -2.063

  No H/Q in entry =           3
  In of MODEL   25
    1    H    GLU  46           H        GLU  46 -18.207  11.518  -4.365
    2    HA   GLU  46           HA       GLU  46 -18.914  13.735  -6.105
    3    HB2  GLU  46           HB2      GLU  46 -16.658  11.724  -6.185
    4    HB3  GLU  46           HB3      GLU  46 -16.824  13.087  -7.290
    5    HG2  GLU  46           HG2      GLU  46 -16.490  13.304  -4.305
    6    HG3  GLU  46           HG3      GLU  46 -15.197  13.493  -5.490

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LYS  47           H        LYS  47 -18.680  10.228  -6.586
    2    HA   LYS  47           HA       LYS  47 -19.783  10.446  -9.260
    3    HB2  LYS  47           HB2      LYS  47 -19.146   8.049  -7.533
    4    HB3  LYS  47           HB3      LYS  47 -19.700   7.966  -9.205
    5    HG2  LYS  47           HG2      LYS  47 -17.205   9.422  -8.418
    6    HG3  LYS  47           HG3      LYS  47 -17.216   7.699  -8.792
    7    HD2  LYS  47           HD2      LYS  47 -18.209   8.200 -10.986
    8    HD3  LYS  47           HD3      LYS  47 -18.137   9.921 -10.611
    9    HE2  LYS  47           HE2      LYS  47 -15.705   9.778 -10.423
   10    HE3  LYS  47           HE3      LYS  47 -15.777   8.057 -10.791
   11    HZ3  LYS  47           HZ1      LYS  47 -16.472   8.472 -12.949
   12    HZ2  LYS  47           HZ2      LYS  47 -15.270   9.642 -12.679
   13    HZ1  LYS  47           HZ3      LYS  47 -16.911  10.079 -12.614

  No H/Q in entry =          13
  In of MODEL   25
    1    H    GLY  48           H        GLY  48 -21.083   9.606  -6.124
    2    HA3  GLY  48           HA2      GLY  48 -23.428   8.354  -6.883
    3    HA2  GLY  48           HA3      GLY  48 -23.236   9.335  -5.431

  No H/Q in entry =           3
  In of MODEL   25
    1    H    GLN  49           H        GLN  49 -22.731  11.796  -6.969
    2    HA   GLN  49           HA       GLN  49 -25.324  12.825  -7.103
    3    HB2  GLN  49           HB2      GLN  49 -22.809  13.790  -8.448
    4    HB3  GLN  49           HB3      GLN  49 -24.302  14.705  -8.353
    5    HG2  GLN  49           HG2      GLN  49 -24.145  14.703  -5.915
    6    HG3  GLN  49           HG3      GLN  49 -22.665  13.765  -6.009
    7   HE21  GLN  49          HE21      GLN  49 -22.621  15.979  -4.708
    8   HE22  GLN  49          HE22      GLN  49 -21.739  17.273  -5.338

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ASN  50           H        ASN  50 -23.583  11.032  -9.512
    2    HA   ASN  50           HA       ASN  50 -25.493  11.870 -11.585
    3    HB2  ASN  50           HB2      ASN  50 -22.863  10.417 -11.835
    4    HB3  ASN  50           HB3      ASN  50 -23.925  10.827 -13.174
    5   HD21  ASN  50          HD21      ASN  50 -21.320  11.737 -11.549
    6   HD22  ASN  50          HD22      ASN  50 -21.139  13.382 -11.870

  No H/Q in entry =           6
  In of MODEL   25
    1    H    ALA  51           H        ALA  51 -25.404   9.486  -9.369
    2    HA   ALA  51           HA       ALA  51 -26.118   7.341 -11.225
    3    HB2  ALA  51           HB1      ALA  51 -25.493   5.990  -9.554
    4    HB3  ALA  51           HB2      ALA  51 -26.641   6.747  -8.453
    5    HB1  ALA  51           HB3      ALA  51 -25.023   7.424  -8.641

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ASP  52           H        ASP  52 -28.089   6.221 -11.101
    2    HA   ASP  52           HA       ASP  52 -30.327   7.975 -10.414
    3    HB2  ASP  52           HB2      ASP  52 -30.055   5.500 -12.116
    4    HB3  ASP  52           HB3      ASP  52 -31.623   6.178 -11.674

  No H/Q in entry =           4
  In of MODEL   25
    1    H    VAL  53           H        VAL  53 -28.637   5.125  -9.434
    2    HA   VAL  53           HA       VAL  53 -30.082   5.175  -6.917
    3    HB   VAL  53           HB       VAL  53 -31.429   3.506  -8.185
    4   HG11  VAL  53          HG11      VAL  53 -29.653   2.721  -9.716
    5   HG13  VAL  53          HG12      VAL  53 -30.446   1.389  -8.874
    6   HG12  VAL  53          HG13      VAL  53 -28.854   1.936  -8.355
    7   HG23  VAL  53          HG21      VAL  53 -30.546   1.533  -6.517
    8   HG22  VAL  53          HG22      VAL  53 -31.716   2.798  -6.135
    9   HG21  VAL  53          HG23      VAL  53 -30.015   3.017  -5.723

  No H/Q in entry =           9
  In of MODEL   25
    1    H    VAL  54           H        VAL  54 -28.758   4.761  -5.267
    2    HA   VAL  54           HA       VAL  54 -25.972   4.006  -5.886
    3    HB   VAL  54           HB       VAL  54 -27.099   5.721  -3.615
    4   HG11  VAL  54          HG11      VAL  54 -24.477   4.386  -3.921
    5   HG13  VAL  54          HG12      VAL  54 -25.252   5.023  -2.471
    6   HG12  VAL  54          HG13      VAL  54 -24.378   6.107  -3.552
    7   HG22  VAL  54          HG21      VAL  54 -26.294   7.575  -4.690
    8   HG21  VAL  54          HG22      VAL  54 -26.810   6.586  -6.056
    9   HG23  VAL  54          HG23      VAL  54 -25.105   6.658  -5.615

  No H/Q in entry =           9
  In of MODEL   25
    1    H    LEU  55           H        LEU  55 -25.322   2.095  -5.268
    2    HA   LEU  55           HA       LEU  55 -26.790   0.711  -3.111
    3    HB2  LEU  55           HB2      LEU  55 -25.197  -0.380  -5.420
    4    HB3  LEU  55           HB3      LEU  55 -25.930  -1.353  -4.144
    5    HG   LEU  55           HG       LEU  55 -27.413   0.217  -6.242
    6   HD13  LEU  55          HD11      LEU  55 -27.055  -1.609  -7.486
    7   HD12  LEU  55          HD12      LEU  55 -27.987  -2.529  -6.303
    8   HD11  LEU  55          HD13      LEU  55 -26.234  -2.413  -6.149
    9   HD23  LEU  55          HD21      LEU  55 -28.649  -1.791  -4.414
   10   HD22  LEU  55          HD22      LEU  55 -29.385  -0.420  -5.245
   11   HD21  LEU  55          HD23      LEU  55 -28.374  -0.152  -3.825

  No H/Q in entry =          11
  In of MODEL   25
    1    H    LEU  56           H        LEU  56 -25.622   0.129  -1.312
    2    HA   LEU  56           HA       LEU  56 -22.702   0.613  -1.354
    3    HB2  LEU  56           HB2      LEU  56 -24.499   0.317   1.040
    4    HB3  LEU  56           HB3      LEU  56 -22.804   0.798   1.036
    5    HG   LEU  56           HG       LEU  56 -25.152   2.418   0.091
    6   HD11  LEU  56          HD11      LEU  56 -24.028   2.038   2.608
    7   HD13  LEU  56          HD12      LEU  56 -25.058   3.382   2.119
    8   HD12  LEU  56          HD13      LEU  56 -23.305   3.542   2.035
    9   HD23  LEU  56          HD21      LEU  56 -23.259   4.177  -0.078
   10   HD22  LEU  56          HD22      LEU  56 -23.608   3.086  -1.420
   11   HD21  LEU  56          HD23      LEU  56 -22.245   2.761  -0.349

  No H/Q in entry =          11
  In of MODEL   25
    1    H    GLY  57           H        GLY  57 -21.273  -0.981  -0.838
    2    HA3  GLY  57           HA2      GLY  57 -22.116  -3.691  -1.072
    3    HA2  GLY  57           HA3      GLY  57 -20.508  -3.155  -0.588

  No H/Q in entry =           3
  In of MODEL   25
    1    HA   PRO  58           HA       PRO  58 -23.287  -4.325   3.109
    2    HB2  PRO  58           HB2      PRO  58 -22.525  -6.916   3.682
    3    HB3  PRO  58           HB3      PRO  58 -23.920  -6.536   2.673
    4    HG2  PRO  58           HG2      PRO  58 -21.167  -7.325   1.879
    5    HG3  PRO  58           HG3      PRO  58 -22.716  -7.822   1.199
    6    HD2  PRO  58           HD2      PRO  58 -21.161  -5.942   0.002
    7    HD3  PRO  58           HD3      PRO  58 -22.923  -5.907  -0.101

  No H/Q in entry =           7
  In of MODEL   25
    1    H    GLN  59           H        GLN  59 -19.903  -4.688   2.500
    2    HA   GLN  59           HA       GLN  59 -19.150  -4.719   5.261
    3    HB2  GLN  59           HB2      GLN  59 -17.604  -3.826   2.824
    4    HB3  GLN  59           HB3      GLN  59 -16.928  -3.960   4.435
    5    HG2  GLN  59           HG2      GLN  59 -18.088  -6.231   2.829
    6    HG3  GLN  59           HG3      GLN  59 -16.376  -5.879   3.007
    7   HE21  GLN  59          HE21      GLN  59 -18.496  -7.743   3.954
    8   HE22  GLN  59          HE22      GLN  59 -18.224  -8.401   5.458

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ILE  60           H        ILE  60 -20.158  -2.169   3.085
    2    HA   ILE  60           HA       ILE  60 -19.366  -0.213   5.155
    3    HB   ILE  60           HB       ILE  60 -19.648   1.532   3.353
    4   HG12  ILE  60          HG12      ILE  60 -19.379  -0.651   1.332
    5   HG13  ILE  60          HG13      ILE  60 -20.984  -0.188   1.897
    6   HG21  ILE  60          HG21      ILE  60 -17.470   0.724   4.035
    7   HG23  ILE  60          HG22      ILE  60 -17.505   1.114   2.316
    8   HG22  ILE  60          HG23      ILE  60 -17.569  -0.568   2.840
    9   HD13  ILE  60          HD11      ILE  60 -20.720   1.145   0.007
   10   HD12  ILE  60          HD12      ILE  60 -19.005   1.412   0.312
   11   HD11  ILE  60          HD13      ILE  60 -20.213   2.234   1.298

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ALA  61           H        ALA  61 -21.773  -1.873   5.202
    2    HA   ALA  61           HA       ALA  61 -24.047  -0.269   4.762
    3    HB1  ALA  61           HB1      ALA  61 -25.219  -1.811   6.067
    4    HB2  ALA  61           HB2      ALA  61 -23.810  -2.171   7.067
    5    HB3  ALA  61           HB3      ALA  61 -23.887  -2.759   5.405

  No H/Q in entry =           5
  In of MODEL   25
    1    H    TYR  62           H        TYR  62 -21.840  -0.351   7.561
    2    HA   TYR  62           HA       TYR  62 -23.444   1.238   9.251
    3    HB2  TYR  62           HB2      TYR  62 -21.457   1.658  10.524
    4    HB3  TYR  62           HB3      TYR  62 -21.386  -0.007   9.951
    5    HD1  TYR  62           HD1      TYR  62 -19.763  -0.656   8.189
    6    HD2  TYR  62           HD2      TYR  62 -19.810   3.301   9.798
    7    HE1  TYR  62           HE1      TYR  62 -17.559  -0.222   7.173
    8    HE2  TYR  62           HE2      TYR  62 -17.592   3.731   8.783
    9    HH   TYR  62           HH       TYR  62 -16.014   1.251   6.804

  No H/Q in entry =           9
  In of MODEL   25
    1    H    MET  63           H        MET  63 -21.826   2.181   6.407
    2    HA   MET  63           HA       MET  63 -21.743   5.008   7.138
    3    HB2  MET  63           HB2      MET  63 -21.095   3.542   4.579
    4    HB3  MET  63           HB3      MET  63 -20.943   5.287   4.793
    5    HG2  MET  63           HG2      MET  63 -19.235   4.931   6.490
    6    HG3  MET  63           HG3      MET  63 -19.388   3.188   6.281
    7    HE1  MET  63           HE1      MET  63 -18.370   6.485   4.958
    8    HE3  MET  63           HE2      MET  63 -19.274   6.162   3.478
    9    HE2  MET  63           HE3      MET  63 -17.511   6.192   3.444

  No H/Q in entry =           9
  In of MODEL   25
    1    H    LEU  64           H        LEU  64 -24.251   3.092   6.147
    2    HA   LEU  64           HA       LEU  64 -25.500   4.501   4.085
    3    HB2  LEU  64           HB2      LEU  64 -26.307   2.359   4.975
    4    HB3  LEU  64           HB3      LEU  64 -26.790   3.170   6.465
    5    HG   LEU  64           HG       LEU  64 -28.519   4.390   5.252
    6   HD13  LEU  64          HD11      LEU  64 -28.243   4.667   3.023
    7   HD12  LEU  64          HD12      LEU  64 -28.841   3.016   2.856
    8   HD11  LEU  64          HD13      LEU  64 -27.106   3.325   2.919
    9   HD23  LEU  64          HD21      LEU  64 -28.956   1.574   4.468
   10   HD22  LEU  64          HD22      LEU  64 -29.977   2.666   5.401
   11   HD21  LEU  64          HD23      LEU  64 -28.580   1.903   6.160

  No H/Q in entry =          11
  In of MODEL   25
    1    HA   PRO  65           HA       PRO  65 -27.771   7.556   6.875
    2    HB2  PRO  65           HB2      PRO  65 -25.776   7.743   9.132
    3    HB3  PRO  65           HB3      PRO  65 -27.523   7.973   9.180
    4    HG2  PRO  65           HG2      PRO  65 -26.530   5.734  10.079
    5    HG3  PRO  65           HG3      PRO  65 -27.948   5.675   9.033
    6    HD2  PRO  65           HD2      PRO  65 -25.059   5.151   8.323
    7    HD3  PRO  65           HD3      PRO  65 -26.491   4.230   7.864

  No H/Q in entry =           7
  In of MODEL   25
    1    H    GLU  66           H        GLU  66 -24.215   7.599   6.950
    2    HA   GLU  66           HA       GLU  66 -23.996  10.411   6.580
    3    HB2  GLU  66           HB2      GLU  66 -22.119   8.163   5.901
    4    HB3  GLU  66           HB3      GLU  66 -21.716   9.870   5.715
    5    HG2  GLU  66           HG2      GLU  66 -21.939  10.204   8.087
    6    HG3  GLU  66           HG3      GLU  66 -22.418   8.520   8.297

  No H/Q in entry =           6
  In of MODEL   25
    1    H    ILE  67           H        ILE  67 -24.020   7.692   4.294
    2    HA   ILE  67           HA       ILE  67 -23.651   9.440   2.023
    3    HB   ILE  67           HB       ILE  67 -24.469   6.508   2.164
    4   HG12  ILE  67          HG12      ILE  67 -21.873   7.760   1.259
    5   HG13  ILE  67          HG13      ILE  67 -22.156   7.311   2.940
    6   HG21  ILE  67          HG21      ILE  67 -24.464   8.415  -0.036
    7   HG23  ILE  67          HG22      ILE  67 -25.043   6.750  -0.007
    8   HG22  ILE  67          HG23      ILE  67 -23.343   7.086  -0.331
    9   HD12  ILE  67          HD11      ILE  67 -21.688   5.581   0.568
   10   HD11  ILE  67          HD12      ILE  67 -22.686   4.965   1.883
   11   HD13  ILE  67          HD13      ILE  67 -21.027   5.471   2.199

  No H/Q in entry =          11
  In of MODEL   25
    1    H    GLN  68           H        GLN  68 -26.492   8.289   3.640
    2    HA   GLN  68           HA       GLN  68 -28.345   9.195   1.678
    3    HB2  GLN  68           HB2      GLN  68 -28.591   8.793   4.656
    4    HB3  GLN  68           HB3      GLN  68 -29.927   9.365   3.670
    5    HG2  GLN  68           HG2      GLN  68 -29.901   7.351   2.368
    6    HG3  GLN  68           HG3      GLN  68 -28.437   6.803   3.164
    7   HE21  GLN  68          HE21      GLN  68 -30.579   5.391   3.010
    8   HE22  GLN  68          HE22      GLN  68 -31.396   4.895   4.419

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ARG  69           H        ARG  69 -26.783  10.868   4.437
    2    HA   ARG  69           HA       ARG  69 -28.211  13.320   4.063
    3    HB2  ARG  69           HB2      ARG  69 -25.844  12.429   5.640
    4    HB3  ARG  69           HB3      ARG  69 -25.966  14.151   5.303
    5    HG2  ARG  69           HG2      ARG  69 -28.284  14.123   6.275
    6    HG3  ARG  69           HG3      ARG  69 -28.033  12.433   6.727
    7    HD2  ARG  69           HD2      ARG  69 -26.399  14.817   7.671
    8    HD3  ARG  69           HD3      ARG  69 -27.505  13.871   8.654
    9    HE   ARG  69           HE       ARG  69 -24.871  13.018   7.693
   10   HH21  ARG  69          HH11      ARG  69 -24.018  11.260   8.867
   11   HH22  ARG  69          HH12      ARG  69 -25.025  10.403   9.984
   12   HH11  ARG  69          HH21      ARG  69 -27.813  12.374   9.382
   13   HH12  ARG  69          HH22      ARG  69 -27.174  11.033  10.274

  No H/Q in entry =          13
  In of MODEL   25
    1    H    LEU  70           H        LEU  70 -25.306  12.003   2.685
    2    HA   LEU  70           HA       LEU  70 -24.252  14.410   1.548
    3    HB2  LEU  70           HB2      LEU  70 -23.200  12.110   2.113
    4    HB3  LEU  70           HB3      LEU  70 -23.804  11.650   0.522
    5    HG   LEU  70           HG       LEU  70 -22.245  13.075  -0.545
    6   HD11  LEU  70          HD11      LEU  70 -21.443  13.903   2.253
    7   HD13  LEU  70          HD12      LEU  70 -22.164  14.935   1.019
    8   HD12  LEU  70          HD13      LEU  70 -20.536  14.298   0.790
    9   HD22  LEU  70          HD21      LEU  70 -20.769  11.392  -0.335
   10   HD21  LEU  70          HD22      LEU  70 -21.682  10.829   1.065
   11   HD23  LEU  70          HD23      LEU  70 -20.324  11.932   1.283

  No H/Q in entry =          11
  In of MODEL   25
    1    H    LEU  71           H        LEU  71 -26.342  11.830   0.400
    2    HA   LEU  71           HA       LEU  71 -26.903  13.337  -2.098
    3    HB2  LEU  71           HB2      LEU  71 -27.038  10.343  -1.689
    4    HB3  LEU  71           HB3      LEU  71 -27.187  11.220  -3.212
    5    HG   LEU  71           HG       LEU  71 -24.668  11.271  -1.551
    6   HD12  LEU  71          HD11      LEU  71 -24.682   9.673  -4.004
    7   HD11  LEU  71          HD12      LEU  71 -25.678   9.010  -2.709
    8   HD13  LEU  71          HD13      LEU  71 -23.965   9.327  -2.430
    9   HD22  LEU  71          HD21      LEU  71 -24.813  13.103  -3.020
   10   HD21  LEU  71          HD22      LEU  71 -25.287  12.067  -4.366
   11   HD23  LEU  71          HD23      LEU  71 -23.663  11.950  -3.690

  No H/Q in entry =          11
  In of MODEL   25
    1    HA   PRO  72           HA       PRO  72 -30.758  12.765   0.517
    2    HB2  PRO  72           HB2      PRO  72 -31.673  15.306   0.470
    3    HB3  PRO  72           HB3      PRO  72 -30.353  14.870   1.555
    4    HG2  PRO  72           HG2      PRO  72 -30.196  16.105  -1.183
    5    HG3  PRO  72           HG3      PRO  72 -29.441  16.653   0.314
    6    HD2  PRO  72           HD2      PRO  72 -28.070  15.148  -1.473
    7    HD3  PRO  72           HD3      PRO  72 -27.811  14.965   0.261

  No H/Q in entry =           7
  In of MODEL   25
    1    H    ASN  73           H        ASN  73 -30.157  13.775  -2.684
    2    HA   ASN  73           HA       ASN  73 -33.009  13.412  -3.320
    3    HB2  ASN  73           HB2      ASN  73 -32.569  14.555  -5.403
    4    HB3  ASN  73           HB3      ASN  73 -32.067  15.529  -4.029
    5   HD21  ASN  73          HD21      ASN  73 -31.273  15.626  -6.706
    6   HD22  ASN  73          HD22      ASN  73 -29.603  15.503  -6.900

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LYS  74           H        LYS  74 -30.980  11.194  -2.925
    2    HA   LYS  74           HA       LYS  74 -31.518   9.821  -5.491
    3    HB2  LYS  74           HB2      LYS  74 -28.980   9.561  -3.874
    4    HB3  LYS  74           HB3      LYS  74 -29.346   8.761  -5.402
    5    HG2  LYS  74           HG2      LYS  74 -29.145  11.734  -5.161
    6    HG3  LYS  74           HG3      LYS  74 -27.748  10.704  -5.480
    7    HD2  LYS  74           HD2      LYS  74 -28.847   9.777  -7.434
    8    HD3  LYS  74           HD3      LYS  74 -30.286  10.741  -7.102
    9    HE2  LYS  74           HE2      LYS  74 -29.103  12.778  -7.517
   10    HE3  LYS  74           HE3      LYS  74 -27.564  11.921  -7.621
   11    HZ2  LYS  74           HZ1      LYS  74 -29.047  12.520  -9.739
   12    HZ1  LYS  74           HZ2      LYS  74 -29.671  10.980  -9.385
   13    HZ3  LYS  74           HZ3      LYS  74 -28.009  11.178  -9.679

  No H/Q in entry =          13
  In of MODEL   25
    1    HA   PRO  75           HA       PRO  75 -32.850   6.769  -2.559
    2    HB2  PRO  75           HB2      PRO  75 -33.115   4.566  -4.169
    3    HB3  PRO  75           HB3      PRO  75 -34.269   5.898  -4.221
    4    HG2  PRO  75           HG2      PRO  75 -31.919   5.372  -6.000
    5    HG3  PRO  75           HG3      PRO  75 -33.577   5.781  -6.441
    6    HD2  PRO  75           HD2      PRO  75 -31.673   7.684  -6.374
    7    HD3  PRO  75           HD3      PRO  75 -33.314   8.043  -5.830

  No H/Q in entry =           7
  In of MODEL   25
    1    H    VAL  76           H        VAL  76 -31.376   5.726  -1.199
    2    HA   VAL  76           HA       VAL  76 -28.887   4.581  -2.321
    3    HB   VAL  76           HB       VAL  76 -29.205   6.008   0.354
    4   HG11  VAL  76          HG11      VAL  76 -26.823   4.787  -1.053
    5   HG13  VAL  76          HG12      VAL  76 -27.509   4.303   0.499
    6   HG12  VAL  76          HG13      VAL  76 -26.695   5.858   0.342
    7   HG22  VAL  76          HG21      VAL  76 -28.575   7.933  -0.508
    8   HG21  VAL  76          HG22      VAL  76 -29.104   7.246  -2.044
    9   HG23  VAL  76          HG23      VAL  76 -27.401   7.186  -1.591

  No H/Q in entry =           9
  In of MODEL   25
    1    H    GLU  77           H        GLU  77 -28.626   2.425  -1.736
    2    HA   GLU  77           HA       GLU  77 -29.397   1.588   0.908
    3    HB2  GLU  77           HB2      GLU  77 -30.970  -0.085   0.356
    4    HB3  GLU  77           HB3      GLU  77 -31.551   1.435  -0.327
    5    HG2  GLU  77           HG2      GLU  77 -30.926   0.718  -2.523
    6    HG3  GLU  77           HG3      GLU  77 -30.253  -0.774  -1.869

  No H/Q in entry =           6
  In of MODEL   25
    1    H    VAL  78           H        VAL  78 -29.027  -0.500   1.541
    2    HA   VAL  78           HA       VAL  78 -26.346  -1.205   0.644
    3    HB   VAL  78           HB       VAL  78 -28.036  -2.154   2.998
    4   HG11  VAL  78          HG11      VAL  78 -25.671  -3.320   1.858
    5   HG13  VAL  78          HG12      VAL  78 -26.569  -3.827   3.291
    6   HG12  VAL  78          HG13      VAL  78 -25.273  -2.641   3.436
    7   HG22  VAL  78          HG21      VAL  78 -26.605  -0.779   4.354
    8   HG21  VAL  78          HG22      VAL  78 -27.361   0.192   3.090
    9   HG23  VAL  78          HG23      VAL  78 -25.674  -0.299   2.935

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ILE  79           H        ILE  79 -25.769  -3.091  -0.285
    2    HA   ILE  79           HA       ILE  79 -27.800  -4.594  -1.652
    3    HB   ILE  79           HB       ILE  79 -24.798  -5.061  -1.436
    4   HG12  ILE  79          HG12      ILE  79 -26.457  -3.962  -3.711
    5   HG13  ILE  79          HG13      ILE  79 -25.604  -2.950  -2.545
    6   HG22  ILE  79          HG21      ILE  79 -25.876  -6.235  -3.770
    7   HG21  ILE  79          HG22      ILE  79 -26.849  -6.793  -2.409
    8   HG23  ILE  79          HG23      ILE  79 -25.103  -7.036  -2.402
    9   HD13  ILE  79          HD11      ILE  79 -24.188  -3.011  -4.364
   10   HD12  ILE  79          HD12      ILE  79 -24.492  -4.722  -4.667
   11   HD11  ILE  79          HD13      ILE  79 -23.518  -4.231  -3.279

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ASP  80           H        ASP  80 -28.624  -6.542  -1.093
    2    HA   ASP  80           HA       ASP  80 -28.552  -7.473   1.542
    3    HB2  ASP  80           HB2      ASP  80 -30.294  -8.065  -0.104
    4    HB3  ASP  80           HB3      ASP  80 -29.115  -9.037  -0.986

  No H/Q in entry =           4
  In of MODEL   25
    1    H    SER  81           H        SER  81 -26.994  -8.590   2.659
    2    HA   SER  81           HA       SER  81 -24.484  -9.206   1.460
    3    HB2  SER  81           HB2      SER  81 -23.907 -10.242   3.616
    4    HB3  SER  81           HB3      SER  81 -24.653  -8.662   3.852
    5    HG   SER  81           HG       SER  81 -26.254  -9.559   4.825

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU  82           H        LEU  82 -27.151 -11.357   1.755
    2    HA   LEU  82           HA       LEU  82 -25.555 -13.686   1.207
    3    HB2  LEU  82           HB2      LEU  82 -28.499 -13.254   0.764
    4    HB3  LEU  82           HB3      LEU  82 -27.662 -14.798   0.915
    5    HG   LEU  82           HG       LEU  82 -28.039 -12.789   3.117
    6   HD12  LEU  82          HD11      LEU  82 -29.280 -15.523   2.741
    7   HD11  LEU  82          HD12      LEU  82 -30.098 -14.012   2.335
    8   HD13  LEU  82          HD13      LEU  82 -29.643 -14.348   4.006
    9   HD21  LEU  82          HD21      LEU  82 -26.680 -15.467   2.884
   10   HD23  LEU  82          HD22      LEU  82 -27.207 -14.818   4.436
   11   HD22  LEU  82          HD23      LEU  82 -26.009 -13.948   3.478

  No H/Q in entry =          11
  In of MODEL   25
    1    H    LEU  83           H        LEU  83 -27.558 -11.478  -0.686
    2    HA   LEU  83           HA       LEU  83 -27.329 -12.801  -3.173
    3    HB2  LEU  83           HB2      LEU  83 -27.798  -9.912  -2.490
    4    HB3  LEU  83           HB3      LEU  83 -27.816 -10.536  -4.139
    5    HG   LEU  83           HG       LEU  83 -29.843 -10.992  -1.969
    6   HD13  LEU  83          HD11      LEU  83 -30.636  -9.147  -3.010
    7   HD12  LEU  83          HD12      LEU  83 -31.076 -10.254  -4.309
    8   HD11  LEU  83          HD13      LEU  83 -29.559  -9.356  -4.390
    9   HD23  LEU  83          HD21      LEU  83 -29.955 -12.220  -4.708
   10   HD22  LEU  83          HD22      LEU  83 -30.918 -12.606  -3.283
   11   HD21  LEU  83          HD23      LEU  83 -29.220 -13.074  -3.353

  No H/Q in entry =          11
  In of MODEL   25
    1    H    TYR  84           H        TYR  84 -25.425 -10.397  -1.468
    2    HA   TYR  84           HA       TYR  84 -23.572  -9.846  -3.592
    3    HB2  TYR  84           HB2      TYR  84 -24.125  -8.401  -1.543
    4    HB3  TYR  84           HB3      TYR  84 -23.068  -9.486  -0.643
    5    HD1  TYR  84           HD1      TYR  84 -20.712  -9.256  -0.733
    6    HD2  TYR  84           HD2      TYR  84 -23.161  -7.053  -3.450
    7    HE1  TYR  84           HE1      TYR  84 -18.732  -7.961  -1.449
    8    HE2  TYR  84           HE2      TYR  84 -21.190  -5.757  -4.182
    9    HH   TYR  84           HH       TYR  84 -18.322  -6.510  -3.990

  No H/Q in entry =           9
  In of MODEL   25
    1    H    GLY  85           H        GLY  85 -23.293 -11.878  -0.669
    2    HA3  GLY  85           HA2      GLY  85 -20.696 -12.763  -1.162
    3    HA2  GLY  85           HA3      GLY  85 -21.908 -13.645  -0.236

  No H/Q in entry =           3
  In of MODEL   25
    1    H    LYS  86           H        LYS  86 -23.748 -14.031  -2.301
    2    HA   LYS  86           HA       LYS  86 -22.646 -16.368  -3.588
    3    HB2  LYS  86           HB2      LYS  86 -25.320 -14.975  -3.667
    4    HB3  LYS  86           HB3      LYS  86 -24.983 -16.511  -4.462
    5    HG2  LYS  86           HG2      LYS  86 -24.624 -17.558  -2.322
    6    HG3  LYS  86           HG3      LYS  86 -24.910 -16.018  -1.509
    7    HD2  LYS  86           HD2      LYS  86 -27.148 -15.910  -2.560
    8    HD3  LYS  86           HD3      LYS  86 -26.860 -17.487  -3.293
    9    HE2  LYS  86           HE2      LYS  86 -26.930 -16.906  -0.334
   10    HE3  LYS  86           HE3      LYS  86 -28.210 -17.683  -1.264
   11    HZ3  LYS  86           HZ1      LYS  86 -27.119 -19.527  -0.582
   12    HZ2  LYS  86           HZ2      LYS  86 -25.623 -18.735  -0.422
   13    HZ1  LYS  86           HZ3      LYS  86 -26.173 -19.209  -1.957

  No H/Q in entry =          13
  In of MODEL   25
    1    H    VAL  87           H        VAL  87 -22.700 -13.143  -4.444
    2    HA   VAL  87           HA       VAL  87 -22.425 -11.941  -6.370
    3    HB   VAL  87           HB       VAL  87 -21.297 -14.429  -7.697
    4   HG11  VAL  87          HG11      VAL  87 -21.594 -12.015  -8.739
    5   HG13  VAL  87          HG12      VAL  87 -20.117 -12.935  -9.034
    6   HG12  VAL  87          HG13      VAL  87 -20.137 -11.666  -7.810
    7   HG21  VAL  87          HG21      VAL  87 -20.423 -14.137  -5.320
    8   HG23  VAL  87          HG22      VAL  87 -19.658 -12.664  -5.912
    9   HG22  VAL  87          HG23      VAL  87 -19.233 -14.222  -6.616

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ASP  88           H        ASP  88 -24.927 -12.639  -6.027
    2    HA   ASP  88           HA       ASP  88 -26.023 -13.850  -8.439
    3    HB2  ASP  88           HB2      ASP  88 -27.013 -14.143  -6.118
    4    HB3  ASP  88           HB3      ASP  88 -27.501 -12.450  -6.197

  No H/Q in entry =           4
  In of MODEL   25
    1    H    GLY  89           H        GLY  89 -25.346 -12.560 -10.065
    2    HA3  GLY  89           HA2      GLY  89 -25.585  -9.789 -10.234
    3    HA2  GLY  89           HA3      GLY  89 -25.538 -10.893 -11.607

  No H/Q in entry =           3
  In of MODEL   25
    1    H    LEU  90           H        LEU  90 -27.956 -12.301 -11.174
    2    HA   LEU  90           HA       LEU  90 -29.807 -10.391 -12.264
    3    HB2  LEU  90           HB2      LEU  90 -29.822 -12.781 -12.873
    4    HB3  LEU  90           HB3      LEU  90 -30.319 -13.178 -11.228
    5    HG   LEU  90           HG       LEU  90 -32.461 -12.102 -11.578
    6   HD13  LEU  90          HD11      LEU  90 -32.320 -10.340 -13.033
    7   HD12  LEU  90          HD12      LEU  90 -32.834 -11.575 -14.184
    8   HD11  LEU  90          HD13      LEU  90 -31.128 -11.146 -14.055
    9   HD23  LEU  90          HD21      LEU  90 -32.359 -13.702 -14.032
   10   HD22  LEU  90          HD22      LEU  90 -33.334 -13.904 -12.577
   11   HD21  LEU  90          HD23      LEU  90 -31.667 -14.480 -12.608

  No H/Q in entry =          11
  In of MODEL   25
    1    H    GLY  91           H        GLY  91 -29.605 -11.926  -9.099
    2    HA3  GLY  91           HA2      GLY  91 -31.967 -10.875  -8.046
    3    HA2  GLY  91           HA3      GLY  91 -30.564 -11.389  -7.109

  No H/Q in entry =           3
  In of MODEL   25
    1    H    VAL  92           H        VAL  92 -28.685  -9.513  -7.945
    2    HA   VAL  92           HA       VAL  92 -29.525  -7.247  -6.370
    3    HB   VAL  92           HB       VAL  92 -26.970  -7.643  -7.971
    4   HG12  VAL  92          HG11      VAL  92 -27.173  -5.789  -5.624
    5   HG11  VAL  92          HG12      VAL  92 -27.851  -5.241  -7.159
    6   HG13  VAL  92          HG13      VAL  92 -26.145  -5.675  -7.053
    7   HG22  VAL  92          HG21      VAL  92 -26.712  -9.244  -6.398
    8   HG21  VAL  92          HG22      VAL  92 -27.872  -8.501  -5.295
    9   HG23  VAL  92          HG23      VAL  92 -26.232  -7.864  -5.410

  No H/Q in entry =           9
  In of MODEL   25
    1    H    LEU  93           H        LEU  93 -29.106  -7.860  -9.797
    2    HA   LEU  93           HA       LEU  93 -29.508  -5.222 -10.696
    3    HB2  LEU  93           HB2      LEU  93 -28.828  -7.045 -12.180
    4    HB3  LEU  93           HB3      LEU  93 -30.403  -7.810 -11.964
    5    HG   LEU  93           HG       LEU  93 -31.457  -5.856 -13.066
    6   HD11  LEU  93          HD11      LEU  93 -29.640  -4.227 -12.544
    7   HD13  LEU  93          HD12      LEU  93 -30.081  -4.247 -14.253
    8   HD12  LEU  93          HD13      LEU  93 -28.612  -5.057 -13.712
    9   HD23  LEU  93          HD21      LEU  93 -30.408  -6.375 -15.360
   10   HD22  LEU  93          HD22      LEU  93 -31.222  -7.659 -14.468
   11   HD21  LEU  93          HD23      LEU  93 -29.460  -7.566 -14.471

  No H/Q in entry =          11
  In of MODEL   25
    1    H    LYS  94           H        LYS  94 -31.828  -7.829  -9.875
    2    HA   LYS  94           HA       LYS  94 -34.202  -6.430 -10.482
    3    HB2  LYS  94           HB2      LYS  94 -33.640  -8.627  -8.496
    4    HB3  LYS  94           HB3      LYS  94 -35.252  -7.963  -8.755
    5    HG2  LYS  94           HG2      LYS  94 -35.152  -8.709 -11.098
    6    HG3  LYS  94           HG3      LYS  94 -33.574  -9.431 -10.779
    7    HD2  LYS  94           HD2      LYS  94 -34.664 -10.809  -8.968
    8    HD3  LYS  94           HD3      LYS  94 -36.221 -10.188  -9.516
    9    HE2  LYS  94           HE2      LYS  94 -35.688 -11.080 -11.794
   10    HE3  LYS  94           HE3      LYS  94 -34.257 -11.841 -11.100
   11    HZ3  LYS  94           HZ1      LYS  94 -36.073 -13.400 -11.286
   12    HZ2  LYS  94           HZ2      LYS  94 -37.068 -12.406 -10.332
   13    HZ1  LYS  94           HZ3      LYS  94 -35.692 -13.132  -9.653

  No H/Q in entry =          13
  In of MODEL   25
    1    H    ALA  95           H        ALA  95 -32.374  -6.547  -7.436
    2    HA   ALA  95           HA       ALA  95 -34.256  -5.025  -5.937
    3    HB2  ALA  95           HB1      ALA  95 -31.851  -6.354  -5.418
    4    HB3  ALA  95           HB2      ALA  95 -32.847  -5.483  -4.253
    5    HB1  ALA  95           HB3      ALA  95 -31.518  -4.658  -5.067

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA  96           H        ALA  96 -31.635  -4.090  -8.027
    2    HA   ALA  96           HA       ALA  96 -31.596  -1.336  -7.221
    3    HB2  ALA  96           HB1      ALA  96 -30.242  -1.056  -9.328
    4    HB3  ALA  96           HB2      ALA  96 -30.509  -2.766  -9.667
    5    HB1  ALA  96           HB3      ALA  96 -29.604  -2.283  -8.233

  No H/Q in entry =           5
  In of MODEL   25
    1    H    VAL  97           H        VAL  97 -33.095  -3.051  -9.926
    2    HA   VAL  97           HA       VAL  97 -34.213  -0.759 -11.153
    3    HB   VAL  97           HB       VAL  97 -34.962  -3.701 -11.230
    4   HG11  VAL  97          HG11      VAL  97 -36.796  -1.727 -11.691
    5   HG13  VAL  97          HG12      VAL  97 -36.823  -3.311 -12.466
    6   HG12  VAL  97          HG13      VAL  97 -36.098  -1.936 -13.298
    7   HG21  VAL  97          HG21      VAL  97 -33.723  -1.823 -13.244
    8   HG23  VAL  97          HG22      VAL  97 -34.142  -3.509 -13.553
    9   HG22  VAL  97          HG23      VAL  97 -32.899  -3.110 -12.364

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ALA  98           H        ALA  98 -35.350  -2.992  -8.642
    2    HA   ALA  98           HA       ALA  98 -37.932  -1.899  -8.276
    3    HB1  ALA  98           HB1      ALA  98 -36.873  -4.090  -7.270
    4    HB3  ALA  98           HB2      ALA  98 -38.071  -3.200  -6.327
    5    HB2  ALA  98           HB3      ALA  98 -36.354  -3.021  -5.967

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA  99           H        ALA  99 -34.868  -1.059  -6.622
    2    HA   ALA  99           HA       ALA  99 -36.033   0.882  -4.935
    3    HB1  ALA  99           HB1      ALA  99 -33.370   0.053  -5.695
    4    HB2  ALA  99           HB2      ALA  99 -33.932   0.774  -4.187
    5    HB3  ALA  99           HB3      ALA  99 -33.477   1.806  -5.542

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ILE 100           H        ILE 100 -35.000   1.073  -8.290
    2    HA   ILE 100           HA       ILE 100 -35.232   3.920  -8.474
    3    HB   ILE 100           HB       ILE 100 -35.290   1.791 -10.639
    4   HG12  ILE 100          HG12      ILE 100 -33.163   3.815  -9.946
    5   HG13  ILE 100          HG13      ILE 100 -33.168   2.160  -9.336
    6   HG21  ILE 100          HG21      ILE 100 -35.768   4.704 -10.733
    7   HG23  ILE 100          HG22      ILE 100 -36.250   3.439 -11.864
    8   HG22  ILE 100          HG23      ILE 100 -34.611   4.087 -11.913
    9   HD12  ILE 100          HD11      ILE 100 -32.657   3.161 -12.098
   10   HD11  ILE 100          HD12      ILE 100 -33.287   1.531 -11.862
   11   HD13  ILE 100          HD13      ILE 100 -31.748   1.994 -11.138

  No H/Q in entry =          11
  In of MODEL   25
    1    H    LYS 101           H        LYS 101 -37.478   1.278  -9.230
    2    HA   LYS 101           HA       LYS 101 -39.591   2.900 -10.208
    3    HB2  LYS 101           HB2      LYS 101 -39.422   0.114  -9.115
    4    HB3  LYS 101           HB3      LYS 101 -40.988   0.852  -9.450
    5    HG2  LYS 101           HG2      LYS 101 -40.519   1.024 -11.745
    6    HG3  LYS 101           HG3      LYS 101 -38.816   0.647 -11.498
    7    HD2  LYS 101           HD2      LYS 101 -40.030  -1.273 -12.406
    8    HD3  LYS 101           HD3      LYS 101 -39.396  -1.612 -10.796
    9    HE2  LYS 101           HE2      LYS 101 -41.445  -2.351 -10.297
   10    HE3  LYS 101           HE3      LYS 101 -41.933  -0.656 -10.278
   11    HZ3  LYS 101           HZ1      LYS 101 -42.824  -0.803 -12.396
   12    HZ2  LYS 101           HZ2      LYS 101 -43.257  -2.293 -11.707
   13    HZ1  LYS 101           HZ3      LYS 101 -41.953  -2.208 -12.791

  No H/Q in entry =          13
  In of MODEL   25
    1    H    LYS 102           H        LYS 102 -39.069   1.392  -7.018
    2    HA   LYS 102           HA       LYS 102 -41.336   2.529  -5.804
    3    HB2  LYS 102           HB2      LYS 102 -40.064   0.673  -4.813
    4    HB3  LYS 102           HB3      LYS 102 -38.693   1.751  -4.557
    5    HG2  LYS 102           HG2      LYS 102 -40.035   3.101  -3.041
    6    HG3  LYS 102           HG3      LYS 102 -41.409   2.028  -3.300
    7    HD2  LYS 102           HD2      LYS 102 -40.147   0.172  -2.299
    8    HD3  LYS 102           HD3      LYS 102 -38.774   1.247  -2.038
    9    HE2  LYS 102           HE2      LYS 102 -40.153   2.681  -0.610
   10    HE3  LYS 102           HE3      LYS 102 -41.546   1.637  -0.891
   11    HZ1  LYS 102           HZ1      LYS 102 -39.792  -0.098   0.089
   12    HZ3  LYS 102           HZ2      LYS 102 -40.918   0.755   1.031
   13    HZ2  LYS 102           HZ3      LYS 102 -39.318   1.311   0.910

  No H/Q in entry =          13
  In of MODEL   25
    1    H    ALA 103           H        ALA 103 -38.409   3.988  -6.800
    2    HA   ALA 103           HA       ALA 103 -38.674   6.275  -4.988
    3    HB2  ALA 103           HB1      ALA 103 -36.698   7.067  -6.555
    4    HB3  ALA 103           HB2      ALA 103 -36.630   5.356  -6.976
    5    HB1  ALA 103           HB3      ALA 103 -36.412   5.861  -5.301

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA 104           H        ALA 104 -39.283   5.576  -8.343
    2    HA   ALA 104           HA       ALA 104 -39.921   8.357  -8.929
    3    HB2  ALA 104           HB1      ALA 104 -39.953   7.718 -11.140
    4    HB1  ALA 104           HB2      ALA 104 -40.651   6.138 -10.782
    5    HB3  ALA 104           HB3      ALA 104 -38.933   6.429 -10.500

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA 105           H        ALA 105 -41.489   6.199  -7.152
    2    HA   ALA 105           HA       ALA 105 -43.939   7.548  -7.105
    3    HB2  ALA 105           HB1      ALA 105 -44.668   6.701  -9.155
    4    HB3  ALA 105           HB2      ALA 105 -45.282   5.487  -8.033
    5    HB1  ALA 105           HB3      ALA 105 -43.807   5.177  -8.947

  No H/Q in entry =           5
  In of MODEL   26
    1    H1   ALA   1           H3       ALA   1 -12.109 -16.012  -2.278
    2    H2   ALA   1           H2       ALA   1 -11.158 -17.143  -3.123
    3    H3   ALA   1           H1       ALA   1 -12.319 -16.214  -3.951
    4    HA   ALA   1           HA       ALA   1 -13.694 -17.932  -3.702
    5    HB3  ALA   1           HB1      ALA   1 -12.273 -19.685  -3.247
    6    HB1  ALA   1           HB2      ALA   1 -13.021 -19.581  -1.653
    7    HB2  ALA   1           HB3      ALA   1 -11.457 -18.820  -1.944

  No H/Q in entry =           7
  In of MODEL   26
    1    H    GLU   2           H        GLU   2 -15.296 -18.805  -2.037
    2    HA   GLU   2           HA       GLU   2 -16.960 -17.105  -0.970
    3    HB2  GLU   2           HB2      GLU   2 -15.981 -19.517   0.571
    4    HB3  GLU   2           HB3      GLU   2 -17.514 -18.686   0.833
    5    HG2  GLU   2           HG2      GLU   2 -18.490 -19.787  -0.895
    6    HG3  GLU   2           HG3      GLU   2 -17.178 -19.370  -1.987

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLU   3           H        GLU   3 -15.015 -18.432   1.643
    2    HA   GLU   3           HA       GLU   3 -15.258 -16.080   3.199
    3    HB2  GLU   3           HB2      GLU   3 -13.639 -18.606   3.443
    4    HB3  GLU   3           HB3      GLU   3 -13.417 -17.283   4.587
    5    HG2  GLU   3           HG2      GLU   3 -15.604 -17.461   5.418
    6    HG3  GLU   3           HG3      GLU   3 -16.197 -18.270   3.974

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LEU   4           H        LEU   4 -12.292 -17.522   1.792
    2    HA   LEU   4           HA       LEU   4 -10.479 -15.595   2.379
    3    HB2  LEU   4           HB2      LEU   4 -10.709 -16.898  -0.344
    4    HB3  LEU   4           HB3      LEU   4  -9.262 -16.159   0.332
    5    HG   LEU   4           HG       LEU   4 -10.719 -18.574   1.455
    6   HD13  LEU   4          HD11      LEU   4  -9.075 -19.909   0.518
    7   HD12  LEU   4          HD12      LEU   4  -7.882 -18.611   0.483
    8   HD11  LEU   4          HD13      LEU   4  -9.177 -18.651  -0.712
    9   HD23  LEU   4          HD21      LEU   4  -8.460 -18.608   2.824
   10   HD22  LEU   4          HD22      LEU   4  -9.791 -17.585   3.360
   11   HD21  LEU   4          HD23      LEU   4  -8.442 -16.879   2.469

  No H/Q in entry =          11
  In of MODEL   26
    1    H    GLU   5           H        GLU   5 -12.831 -15.420  -0.282
    2    HA   GLU   5           HA       GLU   5 -11.865 -12.925  -1.290
    3    HB2  GLU   5           HB2      GLU   5 -13.193 -14.519  -2.652
    4    HB3  GLU   5           HB3      GLU   5 -14.592 -14.196  -1.626
    5    HG2  GLU   5           HG2      GLU   5 -14.515 -11.816  -2.248
    6    HG3  GLU   5           HG3      GLU   5 -13.102 -12.122  -3.260

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLU   6           H        GLU   6 -14.567 -13.836   0.818
    2    HA   GLU   6           HA       GLU   6 -15.503 -11.170   1.220
    3    HB2  GLU   6           HB2      GLU   6 -15.880 -13.720   2.805
    4    HB3  GLU   6           HB3      GLU   6 -16.687 -12.200   3.195
    5    HG2  GLU   6           HG2      GLU   6 -17.765 -12.158   1.016
    6    HG3  GLU   6           HG3      GLU   6 -16.873 -13.589   0.508

  No H/Q in entry =           6
  In of MODEL   26
    1    H    VAL   7           H        VAL   7 -13.161 -13.251   2.780
    2    HA   VAL   7           HA       VAL   7 -12.701 -11.668   5.104
    3    HB   VAL   7           HB       VAL   7 -10.980 -13.691   3.646
    4   HG11  VAL   7          HG11      VAL   7 -10.517 -12.151   6.206
    5   HG13  VAL   7          HG12      VAL   7  -9.421 -12.352   4.840
    6   HG12  VAL   7          HG13      VAL   7  -9.752 -13.713   5.913
    7   HG21  VAL   7          HG21      VAL   7 -13.217 -14.283   4.879
    8   HG23  VAL   7          HG22      VAL   7 -12.285 -13.996   6.349
    9   HG22  VAL   7          HG23      VAL   7 -11.782 -15.250   5.218

  No H/Q in entry =           9
  In of MODEL   26
    1    H    VAL   8           H        VAL   8 -11.206 -11.766   1.885
    2    HA   VAL   8           HA       VAL   8  -9.164  -9.868   2.365
    3    HB   VAL   8           HB       VAL   8 -10.633 -10.574  -0.186
    4   HG13  VAL   8          HG11      VAL   8  -9.702  -8.406  -0.545
    5   HG12  VAL   8          HG12      VAL   8  -8.534  -9.533  -1.236
    6   HG11  VAL   8          HG13      VAL   8  -8.233  -8.810   0.344
    7   HG23  VAL   8          HG21      VAL   8  -7.782 -11.320   0.232
    8   HG22  VAL   8          HG22      VAL   8  -9.102 -12.267  -0.448
    9   HG21  VAL   8          HG23      VAL   8  -8.921 -12.143   1.299

  No H/Q in entry =           9
  In of MODEL   26
    1    H    MET   9           H        MET   9 -12.521  -9.521   1.224
    2    HA   MET   9           HA       MET   9 -12.494  -6.744   0.786
    3    HB2  MET   9           HB2      MET   9 -14.679  -8.646   1.628
    4    HB3  MET   9           HB3      MET   9 -14.984  -6.921   1.414
    5    HG2  MET   9           HG2      MET   9 -14.087  -7.080  -0.902
    6    HG3  MET   9           HG3      MET   9 -13.886  -8.818  -0.681
    7    HE1  MET   9           HE1      MET   9 -16.086  -5.883  -0.275
    8    HE3  MET   9           HE2      MET   9 -17.720  -6.362  -0.725
    9    HE2  MET   9           HE3      MET   9 -16.504  -6.126  -1.977

  No H/Q in entry =           9
  In of MODEL   26
    1    H    GLY  10           H        GLY  10 -13.117  -8.641   3.719
    2    HA3  GLY  10           HA2      GLY  10 -13.683  -6.462   5.439
    3    HA2  GLY  10           HA3      GLY  10 -13.096  -8.043   5.951

  No H/Q in entry =           3
  In of MODEL   26
    1    H    LEU  11           H        LEU  11 -10.657  -8.137   4.623
    2    HA   LEU  11           HA       LEU  11  -8.965  -6.680   6.369
    3    HB2  LEU  11           HB2      LEU  11  -8.414  -8.099   3.760
    4    HB3  LEU  11           HB3      LEU  11  -7.148  -7.377   4.751
    5    HG   LEU  11           HG       LEU  11  -9.118  -9.435   5.780
    6   HD13  LEU  11          HD11      LEU  11  -7.889 -10.657   4.210
    7   HD12  LEU  11          HD12      LEU  11  -6.943 -10.882   5.680
    8   HD11  LEU  11          HD13      LEU  11  -6.424  -9.711   4.468
    9   HD22  LEU  11          HD21      LEU  11  -8.267  -8.409   7.691
   10   HD21  LEU  11          HD22      LEU  11  -6.739  -7.988   6.919
   11   HD23  LEU  11          HD23      LEU  11  -7.040  -9.648   7.432

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  12           H        ILE  12  -9.892  -6.148   2.984
    2    HA   ILE  12           HA       ILE  12  -8.233  -3.896   2.546
    3    HB   ILE  12           HB       ILE  12 -10.886  -4.597   1.266
    4   HG12  ILE  12          HG12      ILE  12  -8.834  -6.232   1.187
    5   HG13  ILE  12          HG13      ILE  12  -9.710  -5.890  -0.291
    6   HG21  ILE  12          HG21      ILE  12  -8.699  -2.645   0.494
    7   HG23  ILE  12          HG22      ILE  12 -10.405  -2.299   0.745
    8   HG22  ILE  12          HG23      ILE  12  -9.888  -3.235  -0.626
    9   HD11  ILE  12          HD11      ILE  12  -7.201  -4.434   0.587
   10   HD13  ILE  12          HD12      ILE  12  -8.008  -4.319  -0.976
   11   HD12  ILE  12          HD13      ILE  12  -7.207  -5.801  -0.512

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  13           H        ILE  13 -11.584  -4.207   3.658
    2    HA   ILE  13           HA       ILE  13 -12.080  -1.426   3.928
    3    HB   ILE  13           HB       ILE  13 -13.244  -3.865   5.291
    4   HG12  ILE  13          HG12      ILE  13 -13.493  -3.292   2.755
    5   HG13  ILE  13          HG13      ILE  13 -14.898  -3.804   3.667
    6   HG21  ILE  13          HG21      ILE  13 -14.009  -0.951   5.561
    7   HG23  ILE  13          HG22      ILE  13 -13.684  -2.103   6.849
    8   HG22  ILE  13          HG23      ILE  13 -15.156  -2.246   5.892
    9   HD12  ILE  13          HD11      ILE  13 -15.287  -1.770   2.207
   10   HD11  ILE  13          HD12      ILE  13 -14.164  -0.919   3.249
   11   HD13  ILE  13          HD13      ILE  13 -15.658  -1.534   3.919

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ASN  14           H        ASN  14 -10.922  -3.899   6.198
    2    HA   ASN  14           HA       ASN  14 -10.732  -2.256   8.481
    3    HB2  ASN  14           HB2      ASN  14 -10.444  -4.860   8.160
    4    HB3  ASN  14           HB3      ASN  14  -8.742  -4.449   7.994
    5   HD21  ASN  14          HD21      ASN  14  -9.345  -5.980  10.175
    6   HD22  ASN  14          HD22      ASN  14  -9.323  -5.058  11.598

  No H/Q in entry =           6
  In of MODEL   26
    1    H    SER  15           H        SER  15  -8.332  -3.048   5.978
    2    HA   SER  15           HA       SER  15  -6.204  -1.524   7.037
    3    HB2  SER  15           HB2      SER  15  -5.191  -1.729   4.876
    4    HB3  SER  15           HB3      SER  15  -6.128  -3.201   5.103
    5    HG   SER  15           HG       SER  15  -7.696  -1.298   4.076

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLY  16           H        GLY  16  -8.830  -0.697   4.803
    2    HA3  GLY  16           HA2      GLY  16  -8.013   1.956   4.244
    3    HA2  GLY  16           HA3      GLY  16  -9.656   1.336   4.092

  No H/Q in entry =           3
  In of MODEL   26
    1    H    GLN  17           H        GLN  17 -10.174   0.606   6.745
    2    HA   GLN  17           HA       GLN  17 -10.913   3.101   7.887
    3    HB2  GLN  17           HB2      GLN  17 -10.762   0.324   9.076
    4    HB3  GLN  17           HB3      GLN  17 -11.414   1.717   9.939
    5    HG2  GLN  17           HG2      GLN  17 -13.095   2.049   8.189
    6    HG3  GLN  17           HG3      GLN  17 -12.420   0.708   7.263
    7   HE21  GLN  17          HE21      GLN  17 -14.876   1.455   9.423
    8   HE22  GLN  17          HE22      GLN  17 -15.153  -0.099  10.050

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ALA  18           H        ALA  18  -8.247   0.860   8.494
    2    HA   ALA  18           HA       ALA  18  -7.156   2.095  10.758
    3    HB2  ALA  18           HB1      ALA  18  -6.519  -0.112   9.390
    4    HB3  ALA  18           HB2      ALA  18  -5.363   0.689  10.453
    5    HB1  ALA  18           HB3      ALA  18  -5.299   0.967   8.712

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ARG  19           H        ARG  19  -6.410   2.627   7.305
    2    HA   ARG  19           HA       ARG  19  -4.542   4.704   7.722
    3    HB2  ARG  19           HB2      ARG  19  -4.863   3.556   5.529
    4    HB3  ARG  19           HB3      ARG  19  -6.419   4.372   5.359
    5    HG2  ARG  19           HG2      ARG  19  -5.325   6.561   5.419
    6    HG3  ARG  19           HG3      ARG  19  -3.762   5.800   5.716
    7    HD2  ARG  19           HD2      ARG  19  -3.908   6.386   3.373
    8    HD3  ARG  19           HD3      ARG  19  -3.965   4.625   3.521
    9    HE   ARG  19           HE       ARG  19  -6.613   5.493   3.526
   10   HH21  ARG  19          HH11      ARG  19  -7.820   5.628   1.614
   11   HH22  ARG  19          HH12      ARG  19  -7.007   5.716   0.090
   12   HH11  ARG  19          HH21      ARG  19  -3.849   5.597   1.478
   13   HH12  ARG  19          HH22      ARG  19  -4.758   5.697   0.013

  No H/Q in entry =          13
  In of MODEL   26
    1    H    SER  20           H        SER  20  -8.045   4.763   7.139
    2    HA   SER  20           HA       SER  20  -8.446   7.512   7.090
    3    HB2  SER  20           HB2      SER  20 -10.304   6.141   6.564
    4    HB3  SER  20           HB3      SER  20 -10.174   5.251   8.080
    5    HG   SER  20           HG       SER  20 -11.305   7.716   7.531

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU  21           H        LEU  21  -8.397   5.333   9.896
    2    HA   LEU  21           HA       LEU  21  -8.859   7.324  11.861
    3    HB2  LEU  21           HB2      LEU  21  -7.462   4.646  12.018
    4    HB3  LEU  21           HB3      LEU  21  -7.782   5.660  13.422
    5    HG   LEU  21           HG       LEU  21  -9.942   4.717  11.512
    6   HD12  LEU  21          HD11      LEU  21 -10.514   3.098  13.334
    7   HD11  LEU  21          HD12      LEU  21  -9.023   3.555  14.158
    8   HD13  LEU  21          HD13      LEU  21  -8.952   2.769  12.579
    9   HD22  LEU  21          HD21      LEU  21 -10.863   6.538  12.663
   10   HD21  LEU  21          HD22      LEU  21  -9.912   6.249  14.116
   11   HD23  LEU  21          HD23      LEU  21 -11.287   5.218  13.750

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ALA  22           H        ALA  22  -5.892   5.998  10.440
    2    HA   ALA  22           HA       ALA  22  -4.026   7.345  12.051
    3    HB2  ALA  22           HB1      ALA  22  -3.588   5.496  10.360
    4    HB1  ALA  22           HB2      ALA  22  -2.414   6.811  10.388
    5    HB3  ALA  22           HB3      ALA  22  -3.637   6.746   9.118

  No H/Q in entry =           5
  In of MODEL   26
    1    H    TYR  23           H        TYR  23  -5.376   8.335   8.874
    2    HA   TYR  23           HA       TYR  23  -4.082  10.853   8.794
    3    HB2  TYR  23           HB2      TYR  23  -5.157   9.921   6.809
    4    HB3  TYR  23           HB3      TYR  23  -6.734  10.003   7.597
    5    HD1  TYR  23           HD1      TYR  23  -3.867  12.098   6.446
    6    HD2  TYR  23           HD2      TYR  23  -8.010  11.987   7.567
    7    HE1  TYR  23           HE1      TYR  23  -4.134  14.443   5.684
    8    HE2  TYR  23           HE2      TYR  23  -8.280  14.332   6.804
    9    HH   TYR  23           HH       TYR  23  -5.830  15.965   4.990

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ALA  24           H        ALA  24  -7.178   9.826  10.190
    2    HA   ALA  24           HA       ALA  24  -8.054  12.402  10.962
    3    HB1  ALA  24           HB1      ALA  24  -9.849  11.121  11.440
    4    HB2  ALA  24           HB2      ALA  24  -9.007  10.566  12.885
    5    HB3  ALA  24           HB3      ALA  24  -8.873   9.654  11.382

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA  25           H        ALA  25  -6.003   9.980  12.530
    2    HA   ALA  25           HA       ALA  25  -5.675  11.241  15.028
    3    HB2  ALA  25           HB1      ALA  25  -4.872   8.901  14.207
    4    HB3  ALA  25           HB2      ALA  25  -3.866   9.778  15.361
    5    HB1  ALA  25           HB3      ALA  25  -3.438   9.766  13.650

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU  26           H        LEU  26  -3.904  11.566  11.979
    2    HA   LEU  26           HA       LEU  26  -1.971  13.419  12.883
    3    HB2  LEU  26           HB2      LEU  26  -1.661  12.270  10.780
    4    HB3  LEU  26           HB3      LEU  26  -3.149  12.952  10.131
    5    HG   LEU  26           HG       LEU  26  -2.171  15.220  10.259
    6   HD12  LEU  26          HD11      LEU  26   0.369  15.282  10.661
    7   HD11  LEU  26          HD12      LEU  26   0.175  13.699  11.408
    8   HD13  LEU  26          HD13      LEU  26  -0.653  15.101  12.086
    9   HD21  LEU  26          HD21      LEU  26  -0.401  13.192   8.858
   10   HD23  LEU  26          HD22      LEU  26  -0.474  14.912   8.486
   11   HD22  LEU  26          HD23      LEU  26  -1.882  13.891   8.206

  No H/Q in entry =          11
  In of MODEL   26
    1    H    LYS  27           H        LYS  27  -5.168  13.847  11.421
    2    HA   LYS  27           HA       LYS  27  -5.160  16.636  11.219
    3    HB2  LYS  27           HB2      LYS  27  -6.884  15.129  10.244
    4    HB3  LYS  27           HB3      LYS  27  -7.528  14.864  11.863
    5    HG2  LYS  27           HG2      LYS  27  -7.996  17.263  12.099
    6    HG3  LYS  27           HG3      LYS  27  -7.301  17.570  10.504
    7    HD2  LYS  27           HD2      LYS  27  -9.014  16.106   9.478
    8    HD3  LYS  27           HD3      LYS  27  -9.716  15.817  11.071
    9    HE2  LYS  27           HE2      LYS  27 -10.197  18.221  11.314
   10    HE3  LYS  27           HE3      LYS  27  -9.467  18.532   9.735
   11    HZ3  LYS  27           HZ1      LYS  27 -11.843  18.368   9.505
   12    HZ2  LYS  27           HZ2      LYS  27 -11.863  16.852  10.277
   13    HZ1  LYS  27           HZ3      LYS  27 -11.128  17.026   8.751

  No H/Q in entry =          13
  In of MODEL   26
    1    H    GLN  28           H        GLN  28  -6.001  14.540  13.953
    2    HA   GLN  28           HA       GLN  28  -6.920  16.531  15.731
    3    HB2  GLN  28           HB2      GLN  28  -5.470  13.926  16.274
    4    HB3  GLN  28           HB3      GLN  28  -6.230  14.918  17.520
    5    HG2  GLN  28           HG2      GLN  28  -7.669  13.764  15.114
    6    HG3  GLN  28           HG3      GLN  28  -7.715  13.078  16.738
    7   HE21  GLN  28          HE21      GLN  28  -9.611  14.851  14.759
    8   HE22  GLN  28          HE22      GLN  28 -10.383  15.854  15.890

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ALA  29           H        ALA  29  -3.684  15.284  15.027
    2    HA   ALA  29           HA       ALA  29  -2.258  16.706  16.997
    3    HB1  ALA  29           HB1      ALA  29  -0.323  16.043  15.869
    4    HB3  ALA  29           HB2      ALA  29  -1.087  16.154  14.284
    5    HB2  ALA  29           HB3      ALA  29  -1.483  14.816  15.362

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LYS  30           H        LYS  30  -3.146  17.569  13.671
    2    HA   LYS  30           HA       LYS  30  -1.770  20.028  13.560
    3    HB2  LYS  30           HB2      LYS  30  -4.296  19.118  12.165
    4    HB3  LYS  30           HB3      LYS  30  -3.485  20.643  11.816
    5    HG2  LYS  30           HG2      LYS  30  -1.400  19.378  11.293
    6    HG3  LYS  30           HG3      LYS  30  -2.285  17.870  11.544
    7    HD2  LYS  30           HD2      LYS  30  -3.867  18.487   9.757
    8    HD3  LYS  30           HD3      LYS  30  -3.005  20.007   9.508
    9    HE2  LYS  30           HE2      LYS  30  -0.959  18.741   8.919
   10    HE3  LYS  30           HE3      LYS  30  -1.839  17.226   9.137
   11    HZ2  LYS  30           HZ1      LYS  30  -1.687  18.096   6.794
   12    HZ1  LYS  30           HZ2      LYS  30  -2.744  19.346   7.266
   13    HZ3  LYS  30           HZ3      LYS  30  -3.247  17.722   7.342

  No H/Q in entry =          13
  In of MODEL   26
    1    H    GLN  31           H        GLN  31  -4.852  19.138  14.990
    2    HA   GLN  31           HA       GLN  31  -5.648  21.885  15.443
    3    HB2  GLN  31           HB2      GLN  31  -6.790  19.425  16.774
    4    HB3  GLN  31           HB3      GLN  31  -7.570  20.987  16.531
    5    HG2  GLN  31           HG2      GLN  31  -6.864  20.216  13.938
    6    HG3  GLN  31           HG3      GLN  31  -7.366  18.706  14.689
    7   HE21  GLN  31          HE21      GLN  31  -8.806  20.260  12.594
    8   HE22  GLN  31          HE22      GLN  31 -10.321  20.634  13.259

  No H/Q in entry =           8
  In of MODEL   26
    1    H    GLY  32           H        GLY  32  -3.305  19.987  16.752
    2    HA3  GLY  32           HA2      GLY  32  -1.901  20.468  18.547
    3    HA2  GLY  32           HA3      GLY  32  -3.042  21.698  19.075

  No H/Q in entry =           3
  In of MODEL   26
    1    H    ASP  33           H        ASP  33  -4.431  18.641  18.424
    2    HA   ASP  33           HA       ASP  33  -4.821  18.181  21.306
    3    HB2  ASP  33           HB2      ASP  33  -6.228  17.150  18.837
    4    HB3  ASP  33           HB3      ASP  33  -6.558  16.537  20.455

  No H/Q in entry =           4
  In of MODEL   26
    1    H    PHE  34           H        PHE  34  -2.641  17.356  21.600
    2    HA   PHE  34           HA       PHE  34  -1.622  15.118  20.196
    3    HB2  PHE  34           HB2      PHE  34  -1.001  16.112  22.986
    4    HB3  PHE  34           HB3      PHE  34  -0.063  14.899  22.115
    5    HD1  PHE  34           HD1      PHE  34  -0.272  18.323  22.848
    6    HD2  PHE  34           HD2      PHE  34   0.573  15.628  19.611
    7    HE1  PHE  34           HE1      PHE  34   0.996  20.109  21.686
    8    HE2  PHE  34           HE2      PHE  34   1.836  17.416  18.454
    9    HZ   PHE  34           HZ       PHE  34   2.050  19.654  19.496

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ALA  35           H        ALA  35  -3.649  15.373  23.070
    2    HA   ALA  35           HA       ALA  35  -3.401  12.714  23.967
    3    HB3  ALA  35           HB1      ALA  35  -5.861  13.312  24.837
    4    HB1  ALA  35           HB2      ALA  35  -5.349  14.936  24.377
    5    HB2  ALA  35           HB3      ALA  35  -4.418  14.024  25.564

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA  36           H        ALA  36  -5.880  14.201  21.879
    2    HA   ALA  36           HA       ALA  36  -7.269  11.772  21.411
    3    HB1  ALA  36           HB1      ALA  36  -8.747  13.177  20.462
    4    HB3  ALA  36           HB2      ALA  36  -7.586  13.610  19.206
    5    HB2  ALA  36           HB3      ALA  36  -7.613  14.498  20.730

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA  37           H        ALA  37  -4.617  13.390  19.727
    2    HA   ALA  37           HA       ALA  37  -4.575  11.753  17.430
    3    HB3  ALA  37           HB1      ALA  37  -2.595  13.489  18.841
    4    HB2  ALA  37           HB2      ALA  37  -3.135  13.538  17.164
    5    HB1  ALA  37           HB3      ALA  37  -1.964  12.322  17.680

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LYS  38           H        LYS  38  -2.798  11.470  20.499
    2    HA   LYS  38           HA       LYS  38  -1.447   9.086  20.004
    3    HB2  LYS  38           HB2      LYS  38  -1.779  10.846  22.150
    4    HB3  LYS  38           HB3      LYS  38  -2.376   9.309  22.771
    5    HG2  LYS  38           HG2      LYS  38  -0.272   8.213  22.224
    6    HG3  LYS  38           HG3      LYS  38   0.315   9.665  21.406
    7    HD2  LYS  38           HD2      LYS  38   0.481  10.887  23.439
    8    HD3  LYS  38           HD3      LYS  38  -0.520   9.725  24.313
    9    HE2  LYS  38           HE2      LYS  38   1.842   9.437  24.919
   10    HE3  LYS  38           HE3      LYS  38   1.250   8.014  24.059
   11    HZ3  LYS  38           HZ1      LYS  38   2.536   8.447  22.271
   12    HZ2  LYS  38           HZ2      LYS  38   3.487   9.287  23.402
   13    HZ1  LYS  38           HZ3      LYS  38   2.392  10.133  22.415

  No H/Q in entry =          13
  In of MODEL   26
    1    H    ALA  39           H        ALA  39  -4.683   9.543  21.424
    2    HA   ALA  39           HA       ALA  39  -5.208   6.818  21.933
    3    HB3  ALA  39           HB1      ALA  39  -7.394   8.736  21.177
    4    HB2  ALA  39           HB2      ALA  39  -6.491   8.974  22.673
    5    HB1  ALA  39           HB3      ALA  39  -7.391   7.479  22.415

  No H/Q in entry =           5
  In of MODEL   26
    1    H    MET  40           H        MET  40  -5.833   8.822  19.089
    2    HA   MET  40           HA       MET  40  -7.294   6.871  17.637
    3    HB2  MET  40           HB2      MET  40  -5.718   9.285  16.723
    4    HB3  MET  40           HB3      MET  40  -6.738   8.313  15.658
    5    HG2  MET  40           HG2      MET  40  -7.773   9.551  18.222
    6    HG3  MET  40           HG3      MET  40  -7.849  10.384  16.671
    7    HE3  MET  40           HE1      MET  40 -10.424   8.733  14.622
    8    HE2  MET  40           HE2      MET  40  -8.674   8.871  14.464
    9    HE1  MET  40           HE3      MET  40  -9.605  10.226  15.102

  No H/Q in entry =           9
  In of MODEL   26
    1    H    MET  41           H        MET  41  -3.811   7.651  17.740
    2    HA   MET  41           HA       MET  41  -3.043   5.905  15.637
    3    HB2  MET  41           HB2      MET  41  -1.421   6.593  18.101
    4    HB3  MET  41           HB3      MET  41  -0.804   5.951  16.582
    5    HG2  MET  41           HG2      MET  41  -1.993   8.119  15.583
    6    HG3  MET  41           HG3      MET  41  -1.755   8.711  17.226
    7    HE2  MET  41           HE1      MET  41   1.191   6.649  17.573
    8    HE1  MET  41           HE2      MET  41   0.391   7.933  18.475
    9    HE3  MET  41           HE3      MET  41   2.008   8.196  17.823

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ASP  42           H        ASP  42  -3.403   5.429  19.125
    2    HA   ASP  42           HA       ASP  42  -2.334   2.848  19.281
    3    HB2  ASP  42           HB2      ASP  42  -3.220   4.598  21.107
    4    HB3  ASP  42           HB3      ASP  42  -4.635   3.555  21.043

  No H/Q in entry =           4
  In of MODEL   26
    1    H    GLN  43           H        GLN  43  -5.684   3.910  18.798
    2    HA   GLN  43           HA       GLN  43  -6.796   1.308  18.610
    3    HB2  GLN  43           HB2      GLN  43  -7.758   3.948  17.485
    4    HB3  GLN  43           HB3      GLN  43  -8.702   2.457  17.469
    5    HG2  GLN  43           HG2      GLN  43  -8.394   2.341  19.975
    6    HG3  GLN  43           HG3      GLN  43  -7.690   3.955  19.899
    7   HE21  GLN  43          HE21      GLN  43  -9.863   4.008  21.411
    8   HE22  GLN  43          HE22      GLN  43 -11.235   4.566  20.586

  No H/Q in entry =           8
  In of MODEL   26
    1    H    SER  44           H        SER  44  -5.496   3.538  16.191
    2    HA   SER  44           HA       SER  44  -6.191   2.043  13.906
    3    HB2  SER  44           HB2      SER  44  -4.962   4.443  14.342
    4    HB3  SER  44           HB3      SER  44  -3.598   3.464  13.805
    5    HG   SER  44           HG       SER  44  -4.732   4.421  12.048

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ARG  45           H        ARG  45  -3.301   1.968  15.971
    2    HA   ARG  45           HA       ARG  45  -1.803   0.032  14.582
    3    HB2  ARG  45           HB2      ARG  45  -0.970   1.464  16.446
    4    HB3  ARG  45           HB3      ARG  45  -1.944   0.522  17.572
    5    HG2  ARG  45           HG2      ARG  45  -0.690  -1.521  16.924
    6    HG3  ARG  45           HG3      ARG  45   0.308  -0.554  15.840
    7    HD2  ARG  45           HD2      ARG  45   1.035   0.837  17.791
    8    HD3  ARG  45           HD3      ARG  45   0.132  -0.249  18.870
    9    HE   ARG  45           HE       ARG  45   1.843  -1.824  17.281
   10   HH21  ARG  45          HH11      ARG  45   3.758  -2.622  18.109
   11   HH22  ARG  45          HH12      ARG  45   4.528  -1.826  19.436
   12   HH11  ARG  45          HH21      ARG  45   2.128   0.647  19.668
   13   HH12  ARG  45          HH22      ARG  45   3.604   0.028  20.316

  No H/Q in entry =          13
  In of MODEL   26
    1    H    MET  46           H        MET  46  -4.183  -0.318  17.195
    2    HA   MET  46           HA       MET  46  -3.979  -3.114  17.501
    3    HB2  MET  46           HB2      MET  46  -6.167  -1.133  18.114
    4    HB3  MET  46           HB3      MET  46  -6.357  -2.856  18.451
    5    HG2  MET  46           HG2      MET  46  -4.355  -2.832  19.858
    6    HG3  MET  46           HG3      MET  46  -4.074  -1.141  19.475
    7    HE3  MET  46           HE1      MET  46  -7.775  -2.892  20.635
    8    HE2  MET  46           HE2      MET  46  -7.008  -3.167  22.195
    9    HE1  MET  46           HE3      MET  46  -6.246  -3.774  20.728

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ALA  47           H        ALA  47  -6.034  -1.123  15.417
    2    HA   ALA  47           HA       ALA  47  -7.632  -3.194  14.360
    3    HB3  ALA  47           HB1      ALA  47  -8.341  -0.965  13.946
    4    HB1  ALA  47           HB2      ALA  47  -7.853  -1.593  12.373
    5    HB2  ALA  47           HB3      ALA  47  -6.781  -0.511  13.264

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU  48           H        LEU  48  -4.535  -1.849  13.293
    2    HA   LEU  48           HA       LEU  48  -4.247  -3.436  10.951
    3    HB2  LEU  48           HB2      LEU  48  -2.196  -2.133  12.748
    4    HB3  LEU  48           HB3      LEU  48  -1.826  -2.850  11.180
    5    HG   LEU  48           HG       LEU  48  -3.873  -0.656  11.579
    6   HD13  LEU  48          HD11      LEU  48  -1.758   0.245  12.234
    7   HD12  LEU  48          HD12      LEU  48  -2.048   0.795  10.583
    8   HD11  LEU  48          HD13      LEU  48  -0.933  -0.539  10.886
    9   HD22  LEU  48          HD21      LEU  48  -4.343  -1.647   9.506
   10   HD21  LEU  48          HD22      LEU  48  -2.657  -2.062   9.202
   11   HD23  LEU  48          HD23      LEU  48  -3.196  -0.389   9.045

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ASN  49           H        ASN  49  -3.180  -3.820  14.292
    2    HA   ASN  49           HA       ASN  49  -1.554  -6.065  13.954
    3    HB2  ASN  49           HB2      ASN  49  -1.570  -4.744  16.002
    4    HB3  ASN  49           HB3      ASN  49  -3.232  -5.213  16.330
    5   HD21  ASN  49          HD21      ASN  49  -1.383  -5.768  18.292
    6   HD22  ASN  49          HD22      ASN  49  -1.056  -7.432  18.348

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLU  50           H        GLU  50  -5.022  -5.828  14.642
    2    HA   GLU  50           HA       GLU  50  -5.504  -8.633  14.754
    3    HB2  GLU  50           HB2      GLU  50  -7.104  -6.962  15.637
    4    HB3  GLU  50           HB3      GLU  50  -7.411  -6.401  13.992
    5    HG2  GLU  50           HG2      GLU  50  -8.256  -8.607  13.358
    6    HG3  GLU  50           HG3      GLU  50  -7.860  -9.246  14.950

  No H/Q in entry =           6
  In of MODEL   26
    1    H    ALA  51           H        ALA  51  -5.610  -6.236  12.158
    2    HA   ALA  51           HA       ALA  51  -6.587  -7.974  10.141
    3    HB2  ALA  51           HB1      ALA  51  -6.392  -6.160   8.770
    4    HB1  ALA  51           HB2      ALA  51  -4.754  -5.794   9.311
    5    HB3  ALA  51           HB3      ALA  51  -6.138  -5.296  10.286

  No H/Q in entry =           5
  In of MODEL   26
    1    H    HIS  52           H        HIS  52  -3.301  -7.034  11.108
    2    HA   HIS  52           HA       HIS  52  -1.897  -8.509   9.153
    3    HB2  HIS  52           HB2      HIS  52  -0.833  -6.783  10.537
    4    HB3  HIS  52           HB3      HIS  52  -1.058  -7.783  11.971
    5    HD1  HIS  52           HD1      HIS  52   0.194 -10.190  11.892
    6    HD2  HIS  52           HD2      HIS  52   1.481  -7.363   9.111
    7    HE1  HIS  52           HE1      HIS  52   2.445 -10.987  11.049
    8    HE2  HIS  52           HE2      HIS  52   3.243  -9.275   9.352

  No H/Q in entry =           8
  In of MODEL   26
    1    H    LEU  53           H        LEU  53  -3.085  -9.398  12.371
    2    HA   LEU  53           HA       LEU  53  -1.862 -11.931  12.559
    3    HB2  LEU  53           HB2      LEU  53  -4.356 -10.779  13.784
    4    HB3  LEU  53           HB3      LEU  53  -3.869 -12.445  14.078
    5    HG   LEU  53           HG       LEU  53  -2.008 -10.093  14.539
    6   HD13  LEU  53          HD11      LEU  53  -3.990  -9.853  15.978
    7   HD12  LEU  53          HD12      LEU  53  -2.582 -10.318  16.932
    8   HD11  LEU  53          HD13      LEU  53  -3.804 -11.517  16.523
    9   HD21  LEU  53          HD21      LEU  53  -1.975 -13.033  15.242
   10   HD23  LEU  53          HD22      LEU  53  -1.071 -11.873  16.208
   11   HD22  LEU  53          HD23      LEU  53  -0.692 -12.077  14.508

  No H/Q in entry =          11
  In of MODEL   26
    1    H    VAL  54           H        VAL  54  -4.989 -10.930  11.211
    2    HA   VAL  54           HA       VAL  54  -5.882 -13.533  10.529
    3    HB   VAL  54           HB       VAL  54  -6.559 -10.806   9.397
    4   HG12  VAL  54          HG11      VAL  54  -8.652 -12.203   8.595
    5   HG11  VAL  54          HG12      VAL  54  -7.528 -13.559   8.662
    6   HG13  VAL  54          HG13      VAL  54  -7.186 -12.181   7.619
    7   HG22  VAL  54          HG21      VAL  54  -7.456 -10.852  11.553
    8   HG21  VAL  54          HG22      VAL  54  -7.694 -12.597  11.535
    9   HG23  VAL  54          HG23      VAL  54  -8.789 -11.550  10.633

  No H/Q in entry =           9
  In of MODEL   26
    1    H    GLN  55           H        GLN  55  -4.041 -11.065   8.731
    2    HA   GLN  55           HA       GLN  55  -3.909 -12.528   6.313
    3    HB2  GLN  55           HB2      GLN  55  -3.326 -10.259   6.120
    4    HB3  GLN  55           HB3      GLN  55  -2.209 -10.325   7.480
    5    HG2  GLN  55           HG2      GLN  55  -0.490 -11.156   6.195
    6    HG3  GLN  55           HG3      GLN  55  -1.560 -12.141   5.207
    7   HE21  GLN  55          HE21      GLN  55  -1.592 -11.451   3.085
    8   HE22  GLN  55          HE22      GLN  55  -1.411  -9.845   2.574

  No H/Q in entry =           8
  In of MODEL   26
    1    H    THR  56           H        THR  56  -1.790 -12.489   9.184
    2    HA   THR  56           HA       THR  56   0.297 -14.070   8.257
    3    HB   THR  56           HB       THR  56  -0.930 -14.330  11.010
    4    HG1  THR  56           HG1      THR  56   0.588 -12.310   9.797
    5   HG22  THR  56          HG21      THR  56   1.952 -14.512  10.100
    6   HG21  THR  56          HG22      THR  56   0.903 -15.914  10.313
    7   HG23  THR  56          HG23      THR  56   1.310 -14.900  11.696

  No H/Q in entry =           7
  In of MODEL   26
    1    H    LYS  57           H        LYS  57  -2.807 -15.132   9.634
    2    HA   LYS  57           HA       LYS  57  -2.339 -17.924   9.387
    3    HB2  LYS  57           HB2      LYS  57  -4.160 -16.849  10.742
    4    HB3  LYS  57           HB3      LYS  57  -4.963 -16.405   9.242
    5    HG2  LYS  57           HG2      LYS  57  -5.191 -18.767   8.631
    6    HG3  LYS  57           HG3      LYS  57  -4.338 -19.246  10.097
    7    HD2  LYS  57           HD2      LYS  57  -6.127 -18.219  11.468
    8    HD3  LYS  57           HD3      LYS  57  -6.991 -17.770   9.998
    9    HE2  LYS  57           HE2      LYS  57  -7.193 -20.147   9.373
   10    HE3  LYS  57           HE3      LYS  57  -6.298 -20.624  10.814
   11    HZ3  LYS  57           HZ1      LYS  57  -8.379 -20.807  11.624
   12    HZ2  LYS  57           HZ2      LYS  57  -9.034 -19.661  10.552
   13    HZ1  LYS  57           HZ3      LYS  57  -8.174 -19.148  11.926

  No H/Q in entry =          13
  In of MODEL   26
    1    H    LEU  58           H        LEU  58  -3.701 -15.493   7.217
    2    HA   LEU  58           HA       LEU  58  -4.497 -17.325   5.215
    3    HB2  LEU  58           HB2      LEU  58  -3.916 -14.372   5.076
    4    HB3  LEU  58           HB3      LEU  58  -4.577 -15.314   3.739
    5    HG   LEU  58           HG       LEU  58  -5.846 -15.145   6.493
    6   HD11  LEU  58          HD11      LEU  58  -6.171 -13.501   4.002
    7   HD13  LEU  58          HD12      LEU  58  -6.158 -12.993   5.691
    8   HD12  LEU  58          HD13      LEU  58  -7.577 -13.798   5.026
    9   HD22  LEU  58          HD21      LEU  58  -6.797 -17.062   5.628
   10   HD21  LEU  58          HD22      LEU  58  -6.469 -16.608   3.956
   11   HD23  LEU  58          HD23      LEU  58  -7.834 -15.893   4.813

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  59           H        ILE  59  -1.368 -16.089   6.061
    2    HA   ILE  59           HA       ILE  59  -0.276 -16.808   3.420
    3    HB   ILE  59           HB       ILE  59   0.483 -14.737   4.988
    4   HG12  ILE  59          HG12      ILE  59   2.576 -16.368   3.537
    5   HG13  ILE  59          HG13      ILE  59   1.370 -15.431   2.694
    6   HG21  ILE  59          HG21      ILE  59   1.259 -16.517   6.735
    7   HG23  ILE  59          HG22      ILE  59   2.336 -15.187   6.374
    8   HG22  ILE  59          HG23      ILE  59   2.607 -16.773   5.653
    9   HD12  ILE  59          HD11      ILE  59   3.358 -14.352   4.691
   10   HD11  ILE  59          HD12      ILE  59   2.110 -13.393   3.899
   11   HD13  ILE  59          HD13      ILE  59   3.413 -14.106   2.947

  No H/Q in entry =          11
  In of MODEL   26
    1    H    GLU  60           H        GLU  60  -0.263 -17.913   6.788
    2    HA   GLU  60           HA       GLU  60   1.783 -19.875   6.515
    3    HB2  GLU  60           HB2      GLU  60   1.009 -19.086   8.706
    4    HB3  GLU  60           HB3      GLU  60  -0.581 -19.785   8.409
    5    HG2  GLU  60           HG2      GLU  60   1.867 -21.526   8.236
    6    HG3  GLU  60           HG3      GLU  60   1.175 -21.141   9.811

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLY  61           H        GLY  61  -1.729 -20.001   6.044
    2    HA3  GLY  61           HA2      GLY  61  -1.463 -22.792   5.086
    3    HA2  GLY  61           HA3      GLY  61  -2.951 -22.068   5.685

  No H/Q in entry =           3
  In of MODEL   26
    1    H    ASP  62           H        ASP  62  -0.742 -20.475   3.470
    2    HA   ASP  62           HA       ASP  62  -2.795 -19.802   1.644
    3    HB2  ASP  62           HB2      ASP  62  -0.918 -18.983   0.244
    4    HB3  ASP  62           HB3      ASP  62  -0.807 -18.428   1.911

  No H/Q in entry =           4
  In of MODEL   26
    1    H    ALA  63           H        ALA  63  -0.472 -22.484   1.688
    2    HA   ALA  63           HA       ALA  63  -0.676 -23.347  -0.979
    3    HB1  ALA  63           HB1      ALA  63  -0.461 -25.161   1.417
    4    HB2  ALA  63           HB2      ALA  63   0.892 -24.235   0.767
    5    HB3  ALA  63           HB3      ALA  63   0.111 -25.467  -0.226

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLY  64           H        GLY  64  -2.603 -24.250   1.874
    2    HA3  GLY  64           HA2      GLY  64  -4.699 -25.150   2.101
    3    HA2  GLY  64           HA3      GLY  64  -5.077 -24.393   0.563

  No H/Q in entry =           3
  In of MODEL   26
    1    H    GLU  65           H        GLU  65  -6.459 -26.377   0.353
    2    HA   GLU  65           HA       GLU  65  -5.266 -28.934   0.114
    3    HB2  GLU  65           HB2      GLU  65  -7.882 -27.887  -0.971
    4    HB3  GLU  65           HB3      GLU  65  -7.404 -29.585  -0.967
    5    HG2  GLU  65           HG2      GLU  65  -7.537 -27.865   1.523
    6    HG3  GLU  65           HG3      GLU  65  -8.834 -28.937   0.998

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLY  66           H        GLY  66  -5.930 -26.414  -2.176
    2    HA3  GLY  66           HA2      GLY  66  -5.609 -27.678  -4.618
    3    HA2  GLY  66           HA3      GLY  66  -5.249 -25.992  -4.303

  No H/Q in entry =           3
  In of MODEL   26
    1    H    LYS  67           H        LYS  67  -3.650 -26.377  -5.992
    2    HA   LYS  67           HA       LYS  67  -1.449 -28.111  -5.641
    3    HB2  LYS  67           HB2      LYS  67  -1.880 -25.709  -7.409
    4    HB3  LYS  67           HB3      LYS  67  -0.452 -26.748  -7.502
    5    HG2  LYS  67           HG2      LYS  67  -1.886 -28.715  -7.868
    6    HG3  LYS  67           HG3      LYS  67  -3.322 -27.699  -7.751
    7    HD2  LYS  67           HD2      LYS  67  -2.533 -26.403  -9.723
    8    HD3  LYS  67           HD3      LYS  67  -1.157 -27.499  -9.862
    9    HE2  LYS  67           HE2      LYS  67  -4.052 -28.396  -9.922
   10    HE3  LYS  67           HE3      LYS  67  -3.075 -28.117 -11.363
   11    HZ3  LYS  67           HZ1      LYS  67  -2.259 -30.145 -11.145
   12    HZ2  LYS  67           HZ2      LYS  67  -3.167 -30.396  -9.731
   13    HZ1  LYS  67           HZ3      LYS  67  -1.604 -29.736  -9.635

  No H/Q in entry =          13
  In of MODEL   26
    1    H    MET  68           H        MET  68   0.765 -26.717  -6.232
    2    HA   MET  68           HA       MET  68   1.808 -26.029  -3.714
    3    HB2  MET  68           HB2      MET  68   2.892 -25.530  -6.488
    4    HB3  MET  68           HB3      MET  68   3.822 -25.374  -4.996
    5    HG2  MET  68           HG2      MET  68   2.419 -27.904  -5.904
    6    HG3  MET  68           HG3      MET  68   4.147 -27.593  -6.077
    7    HE1  MET  68           HE1      MET  68   5.696 -27.161  -4.473
    8    HE3  MET  68           HE2      MET  68   5.711 -27.713  -2.799
    9    HE2  MET  68           HE3      MET  68   5.000 -26.151  -3.197

  No H/Q in entry =           9
  In of MODEL   26
    1    H    LYS  69           H        LYS  69   0.766 -23.948  -6.407
    2    HA   LYS  69           HA       LYS  69   1.792 -21.537  -5.603
    3    HB2  LYS  69           HB2      LYS  69  -0.801 -22.100  -7.005
    4    HB3  LYS  69           HB3      LYS  69  -0.136 -20.477  -6.795
    5    HG2  LYS  69           HG2      LYS  69   1.935 -21.153  -7.917
    6    HG3  LYS  69           HG3      LYS  69   1.319 -22.795  -8.096
    7    HD2  LYS  69           HD2      LYS  69  -0.563 -21.916  -9.458
    8    HD3  LYS  69           HD3      LYS  69   0.129 -20.297  -9.330
    9    HE2  LYS  69           HE2      LYS  69   1.528 -22.704 -10.533
   10    HE3  LYS  69           HE3      LYS  69   0.789 -21.392 -11.451
   11    HZ1  LYS  69           HZ1      LYS  69   2.302 -19.910 -10.021
   12    HZ3  LYS  69           HZ2      LYS  69   2.988 -20.762 -11.322
   13    HZ2  LYS  69           HZ3      LYS  69   3.181 -21.331  -9.732

  No H/Q in entry =          13
  In of MODEL   26
    1    H    VAL  70           H        VAL  70  -0.025 -19.608  -5.204
    2    HA   VAL  70           HA       VAL  70  -1.330 -20.213  -2.613
    3    HB   VAL  70           HB       VAL  70  -0.559 -18.006  -1.793
    4   HG12  VAL  70          HG11      VAL  70   1.895 -18.600  -1.626
    5   HG11  VAL  70          HG12      VAL  70   1.579 -19.921  -2.753
    6   HG13  VAL  70          HG13      VAL  70   0.791 -19.900  -1.175
    7   HG22  VAL  70          HG21      VAL  70  -0.318 -16.865  -3.976
    8   HG21  VAL  70          HG22      VAL  70   1.014 -17.939  -4.396
    9   HG23  VAL  70          HG23      VAL  70   1.200 -16.782  -3.080

  No H/Q in entry =           9
  In of MODEL   26
    1    H    SER  71           H        SER  71  -2.947 -18.579  -2.022
    2    HA   SER  71           HA       SER  71  -4.819 -18.069  -4.081
    3    HB2  SER  71           HB2      SER  71  -5.418 -18.261  -1.658
    4    HB3  SER  71           HB3      SER  71  -4.603 -16.729  -1.360
    5    HG   SER  71           HG       SER  71  -6.808 -17.184  -3.097

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU  72           H        LEU  72  -5.090 -16.393  -5.405
    2    HA   LEU  72           HA       LEU  72  -3.001 -14.563  -5.898
    3    HB2  LEU  72           HB2      LEU  72  -5.870 -14.635  -6.827
    4    HB3  LEU  72           HB3      LEU  72  -4.681 -13.476  -7.413
    5    HG   LEU  72           HG       LEU  72  -4.268 -16.481  -7.539
    6   HD13  LEU  72          HD11      LEU  72  -6.153 -16.047  -8.941
    7   HD12  LEU  72          HD12      LEU  72  -4.757 -16.099 -10.020
    8   HD11  LEU  72          HD13      LEU  72  -5.445 -14.547  -9.544
    9   HD22  LEU  72          HD21      LEU  72  -2.154 -15.492  -7.803
   10   HD21  LEU  72          HD22      LEU  72  -2.796 -14.068  -8.602
   11   HD23  LEU  72          HD23      LEU  72  -2.713 -15.598  -9.468

  No H/Q in entry =          11
  In of MODEL   26
    1    H    VAL  73           H        VAL  73  -6.088 -14.234  -4.251
    2    HA   VAL  73           HA       VAL  73  -6.157 -11.464  -3.899
    3    HB   VAL  73           HB       VAL  73  -7.857 -11.841  -2.297
    4   HG11  VAL  73          HG11      VAL  73  -8.311 -12.591  -4.652
    5   HG13  VAL  73          HG12      VAL  73  -9.290 -13.417  -3.442
    6   HG12  VAL  73          HG13      VAL  73  -7.899 -14.233  -4.156
    7   HG21  VAL  73          HG21      VAL  73  -6.384 -14.420  -1.873
    8   HG23  VAL  73          HG22      VAL  73  -8.114 -14.363  -1.534
    9   HG22  VAL  73          HG23      VAL  73  -7.011 -13.284  -0.678

  No H/Q in entry =           9
  In of MODEL   26
    1    H    LEU  74           H        LEU  74  -4.189 -13.815  -2.327
    2    HA   LEU  74           HA       LEU  74  -3.774 -12.671   0.194
    3    HB2  LEU  74           HB2      LEU  74  -2.969 -14.878  -0.293
    4    HB3  LEU  74           HB3      LEU  74  -1.946 -14.270  -1.593
    5    HG   LEU  74           HG       LEU  74  -0.613 -12.994   0.048
    6   HD12  LEU  74          HD11      LEU  74  -1.050 -13.682   2.507
    7   HD11  LEU  74          HD12      LEU  74  -2.653 -14.162   1.947
    8   HD13  LEU  74          HD13      LEU  74  -2.132 -12.484   1.797
    9   HD21  LEU  74          HD21      LEU  74  -0.395 -15.555  -0.536
   10   HD23  LEU  74          HD22      LEU  74  -0.819 -15.730   1.153
   11   HD22  LEU  74          HD23      LEU  74   0.613 -14.830   0.713

  No H/Q in entry =          11
  In of MODEL   26
    1    H    VAL  75           H        VAL  75  -1.903 -12.259  -2.773
    2    HA   VAL  75           HA       VAL  75  -0.118 -10.319  -1.772
    3    HB   VAL  75           HB       VAL  75  -1.084 -10.811  -4.589
    4   HG13  VAL  75          HG11      VAL  75  -0.242  -8.500  -4.383
    5   HG12  VAL  75          HG12      VAL  75   0.948  -9.487  -5.219
    6   HG11  VAL  75          HG13      VAL  75   1.182  -9.081  -3.527
    7   HG22  VAL  75          HG21      VAL  75   1.095 -11.947  -4.794
    8   HG21  VAL  75          HG22      VAL  75   0.150 -12.667  -3.491
    9   HG23  VAL  75          HG23      VAL  75   1.468 -11.556  -3.115

  No H/Q in entry =           9
  In of MODEL   26
    1    H    GLU  76           H        GLU  76  -3.281 -10.000  -3.412
    2    HA   GLU  76           HA       GLU  76  -3.359  -7.186  -3.511
    3    HB2  GLU  76           HB2      GLU  76  -5.007  -8.686  -4.649
    4    HB3  GLU  76           HB3      GLU  76  -5.674  -9.110  -3.080
    5    HG2  GLU  76           HG2      GLU  76  -6.334  -6.771  -2.701
    6    HG3  GLU  76           HG3      GLU  76  -5.648  -6.296  -4.242

  No H/Q in entry =           6
  In of MODEL   26
    1    H    ALA  77           H        ALA  77  -4.435  -9.425  -0.966
    2    HA   ALA  77           HA       ALA  77  -5.399  -7.433   0.799
    3    HB1  ALA  77           HB1      ALA  77  -4.192 -10.050   1.688
    4    HB2  ALA  77           HB2      ALA  77  -5.773  -9.967   0.913
    5    HB3  ALA  77           HB3      ALA  77  -5.496  -9.135   2.441

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLN  78           H        GLN  78  -2.240  -8.954   0.416
    2    HA   GLN  78           HA       GLN  78  -0.980  -7.783   2.659
    3    HB2  GLN  78           HB2      GLN  78  -0.149  -9.718   1.211
    4    HB3  GLN  78           HB3      GLN  78   0.375  -8.499   0.051
    5    HG2  GLN  78           HG2      GLN  78   1.848  -7.493   1.676
    6    HG3  GLN  78           HG3      GLN  78   1.220  -8.524   2.959
    7   HE21  GLN  78          HE21      GLN  78   1.316 -11.053   2.100
    8   HE22  GLN  78          HE22      GLN  78   2.849 -11.488   1.514

  No H/Q in entry =           8
  In of MODEL   26
    1    H    LEU  79           H        LEU  79  -1.375  -6.724  -0.685
    2    HA   LEU  79           HA       LEU  79   0.292  -4.483  -0.680
    3    HB2  LEU  79           HB2      LEU  79  -0.739  -5.297  -2.728
    4    HB3  LEU  79           HB3      LEU  79  -2.342  -4.919  -2.110
    5    HG   LEU  79           HG       LEU  79  -1.818  -2.528  -2.086
    6   HD13  LEU  79          HD11      LEU  79   0.423  -2.266  -1.586
    7   HD12  LEU  79          HD12      LEU  79   0.460  -1.977  -3.326
    8   HD11  LEU  79          HD13      LEU  79   0.931  -3.551  -2.683
    9   HD23  LEU  79          HD21      LEU  79  -1.200  -2.322  -4.642
   10   HD22  LEU  79          HD22      LEU  79  -2.718  -3.083  -4.175
   11   HD21  LEU  79          HD23      LEU  79  -1.339  -4.080  -4.628

  No H/Q in entry =          11
  In of MODEL   26
    1    H    HIS  80           H        HIS  80  -3.168  -4.674   0.166
    2    HA   HIS  80           HA       HIS  80  -3.378  -1.919   0.832
    3    HB2  HIS  80           HB2      HIS  80  -5.058  -4.342   1.159
    4    HB3  HIS  80           HB3      HIS  80  -5.383  -3.005   2.266
    5    HD1  HIS  80           HD1      HIS  80  -7.019  -1.380   1.369
    6    HD2  HIS  80           HD2      HIS  80  -4.829  -3.174  -1.693
    7    HE1  HIS  80           HE1      HIS  80  -7.879  -0.389  -0.805
    8    HE2  HIS  80           HE2      HIS  80  -6.550  -1.477  -2.680

  No H/Q in entry =           8
  In of MODEL   26
    1    H    LEU  81           H        LEU  81  -2.855  -4.811   2.821
    2    HA   LEU  81           HA       LEU  81  -2.839  -3.465   5.306
    3    HB2  LEU  81           HB2      LEU  81  -1.605  -6.072   4.418
    4    HB3  LEU  81           HB3      LEU  81  -1.574  -5.514   6.092
    5    HG   LEU  81           HG       LEU  81  -4.127  -5.785   4.478
    6   HD12  LEU  81          HD11      LEU  81  -4.405  -7.853   6.026
    7   HD11  LEU  81          HD12      LEU  81  -2.652  -7.769   6.202
    8   HD13  LEU  81          HD13      LEU  81  -3.368  -8.004   4.607
    9   HD23  LEU  81          HD21      LEU  81  -4.954  -5.995   6.984
   10   HD22  LEU  81          HD22      LEU  81  -4.645  -4.404   6.293
   11   HD21  LEU  81          HD23      LEU  81  -3.447  -5.156   7.346

  No H/Q in entry =          11
  In of MODEL   26
    1    H    MET  82           H        MET  82  -0.163  -4.348   3.119
    2    HA   MET  82           HA       MET  82   1.923  -3.439   4.791
    3    HB2  MET  82           HB2      MET  82   1.693  -3.781   1.800
    4    HB3  MET  82           HB3      MET  82   3.175  -3.199   2.556
    5    HG2  MET  82           HG2      MET  82   1.791  -5.799   3.287
    6    HG3  MET  82           HG3      MET  82   3.156  -5.679   2.179
    7    HE3  MET  82           HE1      MET  82   6.177  -4.923   4.145
    8    HE2  MET  82           HE2      MET  82   5.241  -3.561   3.533
    9    HE1  MET  82           HE3      MET  82   5.335  -5.050   2.596

  No H/Q in entry =           9
  In of MODEL   26
    1    H    THR  83           H        THR  83   0.074  -1.809   2.246
    2    HA   THR  83           HA       THR  83   1.469   0.649   2.326
    3    HB   THR  83           HB       THR  83  -0.719   1.559   1.353
    4    HG1  THR  83           HG1      THR  83  -2.361   0.251   1.255
    5   HG22  THR  83          HG21      THR  83  -0.447  -0.256  -0.650
    6   HG21  THR  83          HG22      THR  83   1.060  -0.538   0.217
    7   HG23  THR  83          HG23      THR  83   0.684   1.073  -0.395

  No H/Q in entry =           7
  In of MODEL   26
    1    H    SER  84           H        SER  84  -1.520  -0.405   3.944
    2    HA   SER  84           HA       SER  84  -2.025   2.021   5.292
    3    HB2  SER  84           HB2      SER  84  -2.835  -0.822   5.860
    4    HB3  SER  84           HB3      SER  84  -3.332   0.515   6.897
    5    HG   SER  84           HG       SER  84  -3.804   0.199   4.107

  No H/Q in entry =           5
  In of MODEL   26
    1    H    MET  85           H        MET  85  -0.289  -0.899   6.410
    2    HA   MET  85           HA       MET  85   0.240   0.030   9.012
    3    HB2  MET  85           HB2      MET  85   0.545  -2.310   8.353
    4    HB3  MET  85           HB3      MET  85   1.899  -1.846   7.321
    5    HG2  MET  85           HG2      MET  85   3.273  -1.305   9.143
    6    HG3  MET  85           HG3      MET  85   1.902  -1.081  10.229
    7    HE3  MET  85           HE1      MET  85   1.398  -4.237   7.983
    8    HE2  MET  85           HE2      MET  85   2.821  -5.184   8.410
    9    HE1  MET  85           HE3      MET  85   3.015  -3.607   7.654

  No H/Q in entry =           9
  In of MODEL   26
    1    H    LEU  86           H        LEU  86   2.156   0.299   6.050
    2    HA   LEU  86           HA       LEU  86   4.368   1.624   7.193
    3    HB2  LEU  86           HB2      LEU  86   4.170   0.541   4.885
    4    HB3  LEU  86           HB3      LEU  86   3.349   2.017   4.378
    5    HG   LEU  86           HG       LEU  86   5.375   3.276   5.346
    6   HD11  LEU  86          HD11      LEU  86   6.102   0.669   6.141
    7   HD13  LEU  86          HD12      LEU  86   7.097   2.120   6.233
    8   HD12  LEU  86          HD13      LEU  86   7.204   1.073   4.821
    9   HD23  LEU  86          HD21      LEU  86   6.089   1.518   2.991
   10   HD22  LEU  86          HD22      LEU  86   6.473   3.218   3.251
   11   HD21  LEU  86          HD23      LEU  86   4.822   2.739   2.862

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ALA  87           H        ALA  87   1.438   2.849   5.626
    2    HA   ALA  87           HA       ALA  87   2.016   5.583   5.707
    3    HB1  ALA  87           HB1      ALA  87  -0.286   3.940   5.179
    4    HB3  ALA  87           HB2      ALA  87   0.011   5.603   4.677
    5    HB2  ALA  87           HB3      ALA  87  -0.772   5.276   6.225

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ARG  88           H        ARG  88   0.353   3.570   8.106
    2    HA   ARG  88           HA       ARG  88  -0.161   5.616   9.956
    3    HB2  ARG  88           HB2      ARG  88  -1.084   3.257  10.028
    4    HB3  ARG  88           HB3      ARG  88   0.464   2.767  10.725
    5    HG2  ARG  88           HG2      ARG  88  -0.016   4.838  12.348
    6    HG3  ARG  88           HG3      ARG  88  -1.683   4.502  11.902
    7    HD2  ARG  88           HD2      ARG  88  -1.771   2.652  13.148
    8    HD3  ARG  88           HD3      ARG  88  -0.181   2.081  12.608
    9    HE   ARG  88           HE       ARG  88  -0.709   3.340  15.065
   10   HH21  ARG  88          HH11      ARG  88   0.850   4.362  16.295
   11   HH22  ARG  88          HH12      ARG  88   2.362   4.799  15.581
   12   HH11  ARG  88          HH21      ARG  88   1.555   3.537  12.475
   13   HH12  ARG  88          HH22      ARG  88   2.770   4.315  13.430

  No H/Q in entry =          13
  In of MODEL   26
    1    H    GLU  89           H        GLU  89   2.648   3.415   9.716
    2    HA   GLU  89           HA       GLU  89   3.918   4.312  12.053
    3    HB2  GLU  89           HB2      GLU  89   4.582   2.298  10.705
    4    HB3  GLU  89           HB3      GLU  89   5.344   3.397   9.554
    5    HG2  GLU  89           HG2      GLU  89   6.833   4.254  11.289
    6    HG3  GLU  89           HG3      GLU  89   6.012   3.292  12.514

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LEU  90           H        LEU  90   4.208   5.472   8.724
    2    HA   LEU  90           HA       LEU  90   6.127   7.486   9.298
    3    HB2  LEU  90           HB2      LEU  90   4.111   7.140   7.082
    4    HB3  LEU  90           HB3      LEU  90   5.332   8.420   7.096
    5    HG   LEU  90           HG       LEU  90   6.029   5.488   7.426
    6   HD12  LEU  90          HD11      LEU  90   6.761   5.727   4.982
    7   HD11  LEU  90          HD12      LEU  90   5.735   7.160   4.939
    8   HD13  LEU  90          HD13      LEU  90   5.029   5.582   5.287
    9   HD22  LEU  90          HD21      LEU  90   7.922   6.651   8.097
   10   HD21  LEU  90          HD22      LEU  90   7.556   8.053   7.092
   11   HD23  LEU  90          HD23      LEU  90   8.222   6.593   6.361

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  91           H        ILE  91   2.588   7.476   9.169
    2    HA   ILE  91           HA       ILE  91   2.228  10.246   9.622
    3    HB   ILE  91           HB       ILE  91   0.457   7.857  10.175
    4   HG12  ILE  91          HG12      ILE  91   0.181  10.137   8.192
    5   HG13  ILE  91          HG13      ILE  91   1.050   8.649   7.815
    6   HG22  ILE  91          HG21      ILE  91  -1.290   9.902  10.249
    7   HG21  ILE  91          HG22      ILE  91   0.109  10.743  10.914
    8   HG23  ILE  91          HG23      ILE  91  -0.512   9.301  11.714
    9   HD13  ILE  91          HD11      ILE  91  -0.885   7.347   7.871
   10   HD12  ILE  91          HD12      ILE  91  -1.489   8.857   7.192
   11   HD11  ILE  91          HD13      ILE  91  -1.748   8.491   8.898

  No H/Q in entry =          11
  In of MODEL   26
    1    H    THR  92           H        THR  92   2.664   7.508  11.821
    2    HA   THR  92           HA       THR  92   2.224   8.878  14.248
    3    HB   THR  92           HB       THR  92   4.047   6.557  13.572
    4    HG1  THR  92           HG1      THR  92   2.084   5.785  13.483
    5   HG22  THR  92          HG21      THR  92   3.681   6.270  16.208
    6   HG21  THR  92          HG22      THR  92   3.602   8.029  16.135
    7   HG23  THR  92          HG23      THR  92   5.039   7.185  15.554

  No H/Q in entry =           7
  In of MODEL   26
    1    H    GLU  93           H        GLU  93   5.168   8.452  12.297
    2    HA   GLU  93           HA       GLU  93   6.919   9.894  13.984
    3    HB2  GLU  93           HB2      GLU  93   6.993   9.579  10.969
    4    HB3  GLU  93           HB3      GLU  93   8.335  10.121  11.975
    5    HG2  GLU  93           HG2      GLU  93   6.950   7.473  12.431
    6    HG3  GLU  93           HG3      GLU  93   8.326   7.636  11.347

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LEU  94           H        LEU  94   4.847  10.891  11.283
    2    HA   LEU  94           HA       LEU  94   5.629  13.602  11.177
    3    HB2  LEU  94           HB2      LEU  94   3.046  12.214  10.438
    4    HB3  LEU  94           HB3      LEU  94   3.288  13.944  10.195
    5    HG   LEU  94           HG       LEU  94   5.317  11.973   9.134
    6   HD11  LEU  94          HD11      LEU  94   2.565  12.500   8.087
    7   HD13  LEU  94          HD12      LEU  94   3.559  11.052   7.956
    8   HD12  LEU  94          HD13      LEU  94   3.877  12.435   6.909
    9   HD23  LEU  94          HD21      LEU  94   5.541  13.811   7.410
   10   HD22  LEU  94          HD22      LEU  94   5.961  14.308   9.049
   11   HD21  LEU  94          HD23      LEU  94   4.402  14.762   8.359

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  95           H        ILE  95   3.116  11.963  13.083
    2    HA   ILE  95           HA       ILE  95   2.059  14.304  14.283
    3    HB   ILE  95           HB       ILE  95   2.107  11.423  15.208
    4   HG12  ILE  95          HG12      ILE  95  -0.136  13.176  14.171
    5   HG13  ILE  95          HG13      ILE  95   0.825  12.125  13.134
    6   HG21  ILE  95          HG21      ILE  95   0.809  13.884  16.416
    7   HG23  ILE  95          HG22      ILE  95   1.872  12.725  17.215
    8   HG22  ILE  95          HG23      ILE  95   0.238  12.249  16.749
    9   HD13  ILE  95          HD11      ILE  95  -0.055  10.179  14.058
   10   HD12  ILE  95          HD12      ILE  95  -1.447  11.255  14.142
   11   HD11  ILE  95          HD13      ILE  95  -0.472  10.966  15.582

  No H/Q in entry =          11
  In of MODEL   26
    1    H    GLU  96           H        GLU  96   4.679  12.109  15.265
    2    HA   GLU  96           HA       GLU  96   5.237  13.314  17.754
    3    HB2  GLU  96           HB2      GLU  96   6.201  11.164  17.102
    4    HB3  GLU  96           HB3      GLU  96   7.120  11.946  15.817
    5    HG2  GLU  96           HG2      GLU  96   8.772  12.510  17.270
    6    HG3  GLU  96           HG3      GLU  96   7.623  13.313  18.331

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LEU  97           H        LEU  97   6.286  14.095  14.462
    2    HA   LEU  97           HA       LEU  97   8.156  16.110  15.163
    3    HB2  LEU  97           HB2      LEU  97   6.557  15.544  12.677
    4    HB3  LEU  97           HB3      LEU  97   7.563  16.986  12.792
    5    HG   LEU  97           HG       LEU  97   8.622  14.199  13.348
    6   HD12  LEU  97          HD11      LEU  97   9.605  14.402  11.025
    7   HD11  LEU  97          HD12      LEU  97   8.538  15.781  10.767
    8   HD13  LEU  97          HD13      LEU  97   7.856  14.183  11.066
    9   HD23  LEU  97          HD21      LEU  97  10.775  15.499  12.593
   10   HD22  LEU  97          HD22      LEU  97  10.162  15.763  14.225
   11   HD21  LEU  97          HD23      LEU  97   9.829  16.942  12.958

  No H/Q in entry =          11
  In of MODEL   26
    1    H    HIS  98           H        HIS  98   4.660  16.210  14.527
    2    HA   HIS  98           HA       HIS  98   4.333  19.007  14.663
    3    HB2  HIS  98           HB2      HIS  98   2.470  16.737  15.400
    4    HB3  HIS  98           HB3      HIS  98   1.986  18.433  15.457
    5    HD1  HIS  98           HD1      HIS  98   3.023  15.728  13.048
    6    HD2  HIS  98           HD2      HIS  98   1.606  19.647  12.932
    7    HE1  HIS  98           HE1      HIS  98   2.445  16.210  10.627
    8    HE2  HIS  98           HE2      HIS  98   1.586  18.590  10.535

  No H/Q in entry =           8
  In of MODEL   26
    1    H    GLU  99           H        GLU  99   4.505  16.520  17.162
    2    HA   GLU  99           HA       GLU  99   3.892  18.209  19.363
    3    HB2  GLU  99           HB2      GLU  99   3.829  15.727  19.461
    4    HB3  GLU  99           HB3      GLU  99   5.588  15.700  19.343
    5    HG2  GLU  99           HG2      GLU  99   5.775  16.994  21.416
    6    HG3  GLU  99           HG3      GLU  99   4.021  17.117  21.521

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LYS 100           H        LYS 100   6.946  17.309  17.782
    2    HA   LYS 100           HA       LYS 100   8.597  18.728  19.629
    3    HB2  LYS 100           HB2      LYS 100   9.090  17.807  16.788
    4    HB3  LYS 100           HB3      LYS 100  10.317  18.590  17.790
    5    HG2  LYS 100           HG2      LYS 100   9.968  16.836  19.533
    6    HG3  LYS 100           HG3      LYS 100   8.839  16.020  18.448
    7    HD2  LYS 100           HD2      LYS 100  10.626  15.755  16.772
    8    HD3  LYS 100           HD3      LYS 100  11.761  16.583  17.842
    9    HE2  LYS 100           HE2      LYS 100  11.391  14.824  19.562
   10    HE3  LYS 100           HE3      LYS 100  10.319  13.977  18.443
   11    HZ1  LYS 100           HZ1      LYS 100  13.129  14.675  17.772
   12    HZ3  LYS 100           HZ2      LYS 100  12.092  13.609  16.950
   13    HZ2  LYS 100           HZ3      LYS 100  12.693  13.197  18.485

  No H/Q in entry =          13
  In of MODEL   26
    1    H    LEU 101           H        LEU 101   6.878  19.636  16.683
    2    HA   LEU 101           HA       LEU 101   8.064  22.205  16.341
    3    HB2  LEU 101           HB2      LEU 101   5.477  20.945  15.468
    4    HB3  LEU 101           HB3      LEU 101   5.709  22.679  15.259
    5    HG   LEU 101           HG       LEU 101   7.760  20.683  14.283
    6   HD12  LEU 101          HD11      LEU 101   6.590  21.176  12.004
    7   HD11  LEU 101          HD12      LEU 101   5.191  21.592  12.992
    8   HD13  LEU 101          HD13      LEU 101   5.873  19.969  13.070
    9   HD21  LEU 101          HD21      LEU 101   7.100  23.588  13.730
   10   HD23  LEU 101          HD22      LEU 101   8.085  22.638  12.618
   11   HD22  LEU 101          HD23      LEU 101   8.633  22.902  14.273

  No H/Q in entry =          11
  In of MODEL   26
    1    H    LYS 102           H        LYS 102   6.553  21.053  18.965
    2    HA   LYS 102           HA       LYS 102   5.920  22.138  20.900
    3    HB2  LYS 102           HB2      LYS 102   7.177  24.141  19.768
    4    HB3  LYS 102           HB3      LYS 102   5.570  24.730  19.401
    5    HG2  LYS 102           HG2      LYS 102   6.963  24.488  22.046
    6    HG3  LYS 102           HG3      LYS 102   5.994  25.807  21.422
    7    HD2  LYS 102           HD2      LYS 102   4.782  23.159  22.308
    8    HD3  LYS 102           HD3      LYS 102   5.022  24.522  23.389
    9    HE2  LYS 102           HE2      LYS 102   2.739  24.097  21.913
   10    HE3  LYS 102           HE3      LYS 102   3.231  25.647  22.592
   11    HZ2  LYS 102           HZ1      LYS 102   2.686  25.750  20.215
   12    HZ1  LYS 102           HZ2      LYS 102   3.957  24.680  19.886
   13    HZ3  LYS 102           HZ3      LYS 102   4.288  26.214  20.526

  No H/Q in entry =          13
  In of MODEL   26
    1    H    ALA 103           H        ALA 103   4.252  23.664  18.141
    2    HA   ALA 103           HA       ALA 103   1.797  24.217  19.039
    3    HB1  ALA 103           HB1      ALA 103   0.895  23.366  16.802
    4    HB2  ALA 103           HB2      ALA 103   2.545  22.845  16.463
    5    HB3  ALA 103           HB3      ALA 103   2.196  24.554  16.732

  No H/Q in entry =           5
  In of MODEL   26
    1    H1   ALA   1           H3       ALA   1  10.692 -20.201  -6.276
    2    H2   ALA   1           H2       ALA   1   9.722 -20.416  -7.657
    3    H3   ALA   1           H1       ALA   1   9.300 -21.167  -6.191
    4    HA   ALA   1           HA       ALA   1  10.352 -22.966  -6.936
    5    HB1  ALA   1           HB1      ALA   1  10.432 -22.606  -9.213
    6    HB2  ALA   1           HB2      ALA   1  12.159 -22.440  -8.893
    7    HB3  ALA   1           HB3      ALA   1  11.147 -21.002  -9.039

  No H/Q in entry =           7
  In of MODEL   26
    1    H    GLU   2           H        GLU   2  12.644 -23.896  -7.007
    2    HA   GLU   2           HA       GLU   2  14.037 -23.801  -4.803
    3    HB2  GLU   2           HB2      GLU   2  15.377 -23.658  -7.510
    4    HB3  GLU   2           HB3      GLU   2  16.119 -24.262  -6.029
    5    HG2  GLU   2           HG2      GLU   2  15.119 -26.288  -6.264
    6    HG3  GLU   2           HG3      GLU   2  13.540 -25.556  -6.514

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLU   3           H        GLU   3  15.778 -21.921  -7.215
    2    HA   GLU   3           HA       GLU   3  16.927 -20.224  -5.262
    3    HB2  GLU   3           HB2      GLU   3  16.854 -20.222  -8.271
    4    HB3  GLU   3           HB3      GLU   3  17.593 -18.886  -7.388
    5    HG2  GLU   3           HG2      GLU   3  19.273 -20.246  -6.475
    6    HG3  GLU   3           HG3      GLU   3  18.338 -21.721  -6.691

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LEU   4           H        LEU   4  14.623 -19.396  -7.879
    2    HA   LEU   4           HA       LEU   4  14.136 -16.792  -7.265
    3    HB2  LEU   4           HB2      LEU   4  11.975 -18.785  -7.983
    4    HB3  LEU   4           HB3      LEU   4  11.883 -17.037  -8.181
    5    HG   LEU   4           HG       LEU   4  13.856 -18.883  -9.565
    6   HD13  LEU   4          HD11      LEU   4  12.542 -18.746 -11.468
    7   HD12  LEU   4          HD12      LEU   4  11.823 -17.207 -10.997
    8   HD11  LEU   4          HD13      LEU   4  11.287 -18.703 -10.232
    9   HD23  LEU   4          HD21      LEU   4  14.165 -16.635 -10.919
   10   HD22  LEU   4          HD22      LEU   4  15.036 -16.870  -9.405
   11   HD21  LEU   4          HD23      LEU   4  13.574 -15.886  -9.435

  No H/Q in entry =          11
  In of MODEL   26
    1    H    GLU   5           H        GLU   5  12.686 -19.588  -5.615
    2    HA   GLU   5           HA       GLU   5  11.004 -18.032  -3.902
    3    HB2  GLU   5           HB2      GLU   5  10.594 -20.411  -4.418
    4    HB3  GLU   5           HB3      GLU   5  12.040 -20.838  -3.503
    5    HG2  GLU   5           HG2      GLU   5  11.082 -19.811  -1.485
    6    HG3  GLU   5           HG3      GLU   5   9.641 -19.357  -2.395

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLU   6           H        GLU   6  14.167 -19.583  -3.478
    2    HA   GLU   6           HA       GLU   6  14.528 -18.724  -0.781
    3    HB2  GLU   6           HB2      GLU   6  16.487 -19.639  -2.899
    4    HB3  GLU   6           HB3      GLU   6  16.937 -19.299  -1.227
    5    HG2  GLU   6           HG2      GLU   6  15.405 -21.008  -0.418
    6    HG3  GLU   6           HG3      GLU   6  14.810 -21.294  -2.053

  No H/Q in entry =           6
  In of MODEL   26
    1    H    VAL   7           H        VAL   7  15.263 -17.390  -3.935
    2    HA   VAL   7           HA       VAL   7  16.935 -15.248  -3.081
    3    HB   VAL   7           HB       VAL   7  15.218 -15.628  -5.548
    4   HG11  VAL   7          HG11      VAL   7  17.095 -13.397  -4.747
    5   HG13  VAL   7          HG12      VAL   7  15.448 -13.270  -5.361
    6   HG12  VAL   7          HG13      VAL   7  16.756 -13.760  -6.438
    7   HG21  VAL   7          HG21      VAL   7  17.342 -17.065  -4.991
    8   HG23  VAL   7          HG22      VAL   7  18.231 -15.595  -5.395
    9   HG22  VAL   7          HG23      VAL   7  17.194 -16.355  -6.600

  No H/Q in entry =           9
  In of MODEL   26
    1    H    VAL   8           H        VAL   8  13.442 -15.550  -3.617
    2    HA   VAL   8           HA       VAL   8  12.753 -12.849  -3.142
    3    HB   VAL   8           HB       VAL   8  11.169 -15.394  -2.701
    4   HG13  VAL   8          HG11      VAL   8  10.153 -13.730  -1.321
    5   HG12  VAL   8          HG12      VAL   8   9.201 -13.757  -2.806
    6   HG11  VAL   8          HG13      VAL   8  10.382 -12.476  -2.540
    7   HG23  VAL   8          HG21      VAL   8  10.483 -13.477  -4.877
    8   HG22  VAL   8          HG22      VAL   8  10.540 -15.238  -4.905
    9   HG21  VAL   8          HG23      VAL   8  12.025 -14.308  -5.079

  No H/Q in entry =           9
  In of MODEL   26
    1    H    MET   9           H        MET   9  13.059 -15.652  -0.963
    2    HA   MET   9           HA       MET   9  12.246 -14.388   1.412
    3    HB2  MET   9           HB2      MET   9  14.179 -16.640   0.866
    4    HB3  MET   9           HB3      MET   9  13.865 -16.067   2.504
    5    HG2  MET   9           HG2      MET   9  11.442 -16.476   2.171
    6    HG3  MET   9           HG3      MET   9  11.783 -17.090   0.552
    7    HE1  MET   9           HE1      MET   9  12.664 -17.139   4.133
    8    HE3  MET   9           HE2      MET   9  12.992 -18.808   4.591
    9    HE2  MET   9           HE3      MET   9  11.334 -18.291   4.299

  No H/Q in entry =           9
  In of MODEL   26
    1    H    GLY  10           H        GLY  10  15.420 -14.581  -0.163
    2    HA3  GLY  10           HA2      GLY  10  16.876 -13.145   1.798
    3    HA2  GLY  10           HA3      GLY  10  17.331 -13.306   0.102

  No H/Q in entry =           3
  In of MODEL   26
    1    H    LEU  11           H        LEU  11  15.143 -12.107  -1.125
    2    HA   LEU  11           HA       LEU  11  15.801  -9.355  -0.965
    3    HB2  LEU  11           HB2      LEU  11  13.441 -10.790  -2.187
    4    HB3  LEU  11           HB3      LEU  11  13.702  -9.052  -2.348
    5    HG   LEU  11           HG       LEU  11  15.747 -11.140  -3.147
    6   HD13  LEU  11          HD11      LEU  11  13.996 -11.525  -4.658
    7   HD12  LEU  11          HD12      LEU  11  14.982 -10.333  -5.503
    8   HD11  LEU  11          HD13      LEU  11  13.508  -9.830  -4.677
    9   HD22  LEU  11          HD21      LEU  11  16.959  -9.164  -2.929
   10   HD21  LEU  11          HD22      LEU  11  15.571  -8.141  -3.300
   11   HD23  LEU  11          HD23      LEU  11  16.404  -9.001  -4.593

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  12           H        ILE  12  13.059 -11.210   0.318
    2    HA   ILE  12           HA       ILE  12  11.648  -9.001   1.385
    3    HB   ILE  12           HB       ILE  12  11.721 -11.882   2.336
    4   HG12  ILE  12          HG12      ILE  12  11.016 -11.260  -0.110
    5   HG13  ILE  12          HG13      ILE  12  10.006 -12.360   0.808
    6   HG21  ILE  12          HG21      ILE  12   9.845  -9.585   2.954
    7   HG23  ILE  12          HG22      ILE  12  10.740 -10.589   4.094
    8   HG22  ILE  12          HG23      ILE  12   9.386 -11.270   3.193
    9   HD11  ILE  12          HD11      ILE  12   9.540  -9.374   0.613
   10   HD13  ILE  12          HD12      ILE  12   8.455 -10.577   1.307
   11   HD12  ILE  12          HD13      ILE  12   8.755 -10.559  -0.418

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  13           H        ILE  13  14.073 -11.179   2.777
    2    HA   ILE  13           HA       ILE  13  14.110 -10.000   5.358
    3    HB   ILE  13           HB       ILE  13  16.176 -11.551   3.779
    4   HG12  ILE  13          HG12      ILE  13  13.910 -12.529   4.657
    5   HG13  ILE  13          HG13      ILE  13  15.395 -13.447   4.883
    6   HG21  ILE  13          HG21      ILE  13  16.302 -10.498   6.611
    7   HG23  ILE  13          HG22      ILE  13  17.495 -10.305   5.334
    8   HG22  ILE  13          HG23      ILE  13  17.261 -11.882   6.092
    9   HD12  ILE  13          HD11      ILE  13  13.926 -13.301   6.956
   10   HD11  ILE  13          HD12      ILE  13  14.257 -11.573   6.973
   11   HD13  ILE  13          HD13      ILE  13  15.574 -12.719   7.182

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ASN  14           H        ASN  14  16.040  -9.446   2.428
    2    HA   ASN  14           HA       ASN  14  17.767  -7.484   3.480
    3    HB2  ASN  14           HB2      ASN  14  17.747  -8.750   1.165
    4    HB3  ASN  14           HB3      ASN  14  16.834  -7.344   0.633
    5   HD21  ASN  14          HD21      ASN  14  19.272  -7.654  -0.567
    6   HD22  ASN  14          HD22      ASN  14  20.405  -6.557   0.054

  No H/Q in entry =           6
  In of MODEL   26
    1    H    SER  15           H        SER  15  14.643  -7.175   1.805
    2    HA   SER  15           HA       SER  15  14.496  -4.356   1.862
    3    HB2  SER  15           HB2      SER  15  12.163  -4.633   1.381
    4    HB3  SER  15           HB3      SER  15  12.974  -5.986   0.603
    5    HG   SER  15           HG       SER  15  12.402  -6.589   3.155

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLY  16           H        GLY  16  13.446  -6.830   4.172
    2    HA3  GLY  16           HA2      GLY  16  12.213  -5.097   6.035
    3    HA2  GLY  16           HA3      GLY  16  12.850  -6.697   6.394

  No H/Q in entry =           3
  In of MODEL   26
    1    H    GLN  17           H        GLN  17  15.554  -6.329   5.787
    2    HA   GLN  17           HA       GLN  17  16.507  -5.095   8.163
    3    HB2  GLN  17           HB2      GLN  17  17.924  -5.928   5.617
    4    HB3  GLN  17           HB3      GLN  17  18.770  -5.316   7.039
    5    HG2  GLN  17           HG2      GLN  17  17.860  -7.128   8.403
    6    HG3  GLN  17           HG3      GLN  17  16.917  -7.716   7.034
    7   HE21  GLN  17          HE21      GLN  17  19.796  -8.236   8.684
    8   HE22  GLN  17          HE22      GLN  17  20.672  -8.997   7.445

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ALA  18           H        ALA  18  16.286  -4.020   4.804
    2    HA   ALA  18           HA       ALA  18  17.691  -1.609   5.023
    3    HB2  ALA  18           HB1      ALA  18  16.578  -2.838   2.961
    4    HB3  ALA  18           HB2      ALA  18  16.820  -1.092   2.944
    5    HB1  ALA  18           HB3      ALA  18  15.231  -1.759   3.322

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ARG  19           H        ARG  19  14.202  -2.243   5.438
    2    HA   ARG  19           HA       ARG  19  13.502   0.398   6.156
    3    HB2  ARG  19           HB2      ARG  19  11.842  -1.376   5.579
    4    HB3  ARG  19           HB3      ARG  19  12.202  -2.169   7.114
    5    HG2  ARG  19           HG2      ARG  19  11.471  -0.188   8.357
    6    HG3  ARG  19           HG3      ARG  19  11.202   0.685   6.850
    7    HD2  ARG  19           HD2      ARG  19   9.075  -0.140   7.681
    8    HD3  ARG  19           HD3      ARG  19   9.498  -1.014   6.203
    9    HE   ARG  19           HE       ARG  19  10.489  -2.543   8.303
   10   HH21  ARG  19          HH11      ARG  19   9.267  -4.200   9.249
   11   HH22  ARG  19          HH12      ARG  19   7.546  -4.195   9.087
   12   HH11  ARG  19          HH21      ARG  19   7.472  -1.291   7.224
   13   HH12  ARG  19          HH22      ARG  19   6.530  -2.549   7.936

  No H/Q in entry =          13
  In of MODEL   26
    1    H    SER  20           H        SER  20  14.408  -2.421   8.111
    2    HA   SER  20           HA       SER  20  14.123  -1.325  10.650
    3    HB2  SER  20           HB2      SER  20  14.620  -3.643  10.525
    4    HB3  SER  20           HB3      SER  20  16.064  -3.360   9.556
    5    HG   SER  20           HG       SER  20  15.655  -3.135  12.291

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU  21           H        LEU  21  16.954  -1.225   8.499
    2    HA   LEU  21           HA       LEU  21  18.617   0.284  10.229
    3    HB2  LEU  21           HB2      LEU  21  18.584   0.009   7.215
    4    HB3  LEU  21           HB3      LEU  21  19.830   0.889   8.097
    5    HG   LEU  21           HG       LEU  21  19.136  -2.012   8.641
    6   HD12  LEU  21          HD11      LEU  21  21.239  -2.509   7.379
    7   HD11  LEU  21          HD12      LEU  21  21.313  -0.814   6.899
    8   HD13  LEU  21          HD13      LEU  21  19.972  -1.823   6.360
    9   HD22  LEU  21          HD21      LEU  21  20.291  -1.272  10.538
   10   HD21  LEU  21          HD22      LEU  21  21.241  -0.092   9.642
   11   HD23  LEU  21          HD23      LEU  21  21.636  -1.800   9.531

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ALA  22           H        ALA  22  16.328   1.222   7.684
    2    HA   ALA  22           HA       ALA  22  16.829   3.987   7.696
    3    HB3  ALA  22           HB1      ALA  22  15.435   2.726   6.025
    4    HB2  ALA  22           HB2      ALA  22  14.711   4.229   6.595
    5    HB1  ALA  22           HB3      ALA  22  14.144   2.682   7.225

  No H/Q in entry =           5
  In of MODEL   26
    1    H    TYR  23           H        TYR  23  14.366   2.138   9.543
    2    HA   TYR  23           HA       TYR  23  13.381   4.362  10.998
    3    HB2  TYR  23           HB2      TYR  23  12.173   2.233  10.983
    4    HB3  TYR  23           HB3      TYR  23  13.520   1.439  11.800
    5    HD1  TYR  23           HD1      TYR  23  10.998   4.165  12.182
    6    HD2  TYR  23           HD2      TYR  23  13.715   1.487  14.154
    7    HE1  TYR  23           HE1      TYR  23  10.072   4.845  14.381
    8    HE2  TYR  23           HE2      TYR  23  12.790   2.167  16.352
    9    HH   TYR  23           HH       TYR  23   9.907   4.028  16.636

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ALA  24           H        ALA  24  16.060   2.122  11.621
    2    HA   ALA  24           HA       ALA  24  16.730   3.126  14.181
    3    HB1  ALA  24           HB1      ALA  24  18.109   1.350  14.009
    4    HB3  ALA  24           HB2      ALA  24  19.118   2.285  12.905
    5    HB2  ALA  24           HB3      ALA  24  17.834   1.260  12.271

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA  25           H        ALA  25  17.658   4.067  10.898
    2    HA   ALA  25           HA       ALA  25  19.581   6.026  11.533
    3    HB1  ALA  25           HB1      ALA  25  18.865   5.069   9.222
    4    HB3  ALA  25           HB2      ALA  25  19.346   6.763   9.312
    5    HB2  ALA  25           HB3      ALA  25  17.636   6.334   9.252

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU  26           H        LEU  26  16.062   6.210  11.190
    2    HA   LEU  26           HA       LEU  26  15.805   8.989  11.642
    3    HB2  LEU  26           HB2      LEU  26  13.955   7.730  10.724
    4    HB3  LEU  26           HB3      LEU  26  13.884   6.702  12.149
    5    HG   LEU  26           HG       LEU  26  13.260   8.651  13.533
    6   HD12  LEU  26          HD11      LEU  26  12.566  10.744  12.211
    7   HD11  LEU  26          HD12      LEU  26  13.549  10.103  10.896
    8   HD13  LEU  26          HD13      LEU  26  14.296  10.497  12.445
    9   HD21  LEU  26          HD21      LEU  26  11.576   8.317  11.032
   10   HD23  LEU  26          HD22      LEU  26  11.015   9.008  12.551
   11   HD22  LEU  26          HD23      LEU  26  11.488   7.312  12.478

  No H/Q in entry =          11
  In of MODEL   26
    1    H    LYS  27           H        LYS  27  15.742   6.209  13.836
    2    HA   LYS  27           HA       LYS  27  15.145   7.567  16.207
    3    HB2  LYS  27           HB2      LYS  27  15.202   5.092  15.942
    4    HB3  LYS  27           HB3      LYS  27  16.964   5.166  15.889
    5    HG2  LYS  27           HG2      LYS  27  17.014   6.152  18.139
    6    HG3  LYS  27           HG3      LYS  27  15.247   6.149  18.193
    7    HD2  LYS  27           HD2      LYS  27  15.250   3.682  17.956
    8    HD3  LYS  27           HD3      LYS  27  17.015   3.693  17.936
    9    HE2  LYS  27           HE2      LYS  27  17.048   4.682  20.192
   10    HE3  LYS  27           HE3      LYS  27  15.282   4.701  20.216
   11    HZ3  LYS  27           HZ1      LYS  27  16.099   2.758  21.362
   12    HZ2  LYS  27           HZ2      LYS  27  17.014   2.290  20.007
   13    HZ1  LYS  27           HZ3      LYS  27  15.316   2.275  19.936

  No H/Q in entry =          13
  In of MODEL   26
    1    H    GLN  28           H        GLN  28  18.260   7.022  14.599
    2    HA   GLN  28           HA       GLN  28  19.941   8.124  16.581
    3    HB2  GLN  28           HB2      GLN  28  20.217   8.089  13.565
    4    HB3  GLN  28           HB3      GLN  28  21.504   8.564  14.673
    5    HG2  GLN  28           HG2      GLN  28  20.103   5.875  14.697
    6    HG3  GLN  28           HG3      GLN  28  21.686   6.179  13.986
    7   HE21  GLN  28          HE21      GLN  28  20.407   4.843  16.677
    8   HE22  GLN  28          HE22      GLN  28  21.589   5.263  17.819

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ALA  29           H        ALA  29  18.159   9.587  13.898
    2    HA   ALA  29           HA       ALA  29  19.130  12.219  14.146
    3    HB2  ALA  29           HB1      ALA  29  17.417  12.837  12.684
    4    HB1  ALA  29           HB2      ALA  29  16.290  11.651  13.340
    5    HB3  ALA  29           HB3      ALA  29  17.621  11.124  12.310

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LYS  30           H        LYS  30  16.379  10.589  15.681
    2    HA   LYS  30           HA       LYS  30  15.347  12.831  17.044
    3    HB2  LYS  30           HB2      LYS  30  15.271   9.889  17.748
    4    HB3  LYS  30           HB3      LYS  30  14.396  11.130  18.646
    5    HG2  LYS  30           HG2      LYS  30  13.253  11.804  16.533
    6    HG3  LYS  30           HG3      LYS  30  14.068  10.477  15.702
    7    HD2  LYS  30           HD2      LYS  30  13.021   8.858  17.236
    8    HD3  LYS  30           HD3      LYS  30  12.217  10.175  18.091
    9    HE2  LYS  30           HE2      LYS  30  11.031  10.796  16.005
   10    HE3  LYS  30           HE3      LYS  30  11.816   9.450  15.169
   11    HZ2  LYS  30           HZ1      LYS  30   9.516   9.016  16.061
   12    HZ1  LYS  30           HZ2      LYS  30  10.191   9.076  17.625
   13    HZ3  LYS  30           HZ3      LYS  30  10.706   7.897  16.512

  No H/Q in entry =          13
  In of MODEL   26
    1    H    GLN  31           H        GLN  31  18.035  10.690  17.767
    2    HA   GLN  31           HA       GLN  31  18.365  11.707  20.460
    3    HB2  GLN  31           HB2      GLN  31  20.396  10.157  18.844
    4    HB3  GLN  31           HB3      GLN  31  20.269  10.280  20.599
    5    HG2  GLN  31           HG2      GLN  31  17.762   9.302  19.843
    6    HG3  GLN  31           HG3      GLN  31  18.867   8.469  18.757
    7   HE21  GLN  31          HE21      GLN  31  17.347   7.307  21.041
    8   HE22  GLN  31          HE22      GLN  31  18.515   6.658  22.086

  No H/Q in entry =           8
  In of MODEL   26
    1    H    GLY  32           H        GLY  32  18.856  13.030  17.491
    2    HA3  GLY  32           HA2      GLY  32  19.816  15.085  16.972
    3    HA2  GLY  32           HA3      GLY  32  20.582  15.098  18.556

  No H/Q in entry =           3
  In of MODEL   26
    1    H    ASP  33           H        ASP  33  21.024  12.210  16.776
    2    HA   ASP  33           HA       ASP  33  23.840  12.914  16.296
    3    HB2  ASP  33           HB2      ASP  33  22.359  10.283  16.419
    4    HB3  ASP  33           HB3      ASP  33  24.042  10.417  15.916

  No H/Q in entry =           4
  In of MODEL   26
    1    H    PHE  34           H        PHE  34  23.335  14.233  14.417
    2    HA   PHE  34           HA       PHE  34  21.985  13.235  12.137
    3    HB2  PHE  34           HB2      PHE  34  24.095  15.392  12.356
    4    HB3  PHE  34           HB3      PHE  34  23.105  15.091  10.929
    5    HD1  PHE  34           HD1      PHE  34  23.351  17.027  13.842
    6    HD2  PHE  34           HD2      PHE  34  20.483  14.882  11.471
    7    HE1  PHE  34           HE1      PHE  34  21.525  18.406  14.799
    8    HE2  PHE  34           HE2      PHE  34  18.661  16.260  12.430
    9    HZ   PHE  34           HZ       PHE  34  19.185  18.023  14.090

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ALA  35           H        ALA  35  25.366  13.083  13.127
    2    HA   ALA  35           HA       ALA  35  26.468  12.274  10.664
    3    HB3  ALA  35           HB1      ALA  35  28.169  11.122  12.375
    4    HB2  ALA  35           HB2      ALA  35  27.301  12.138  13.525
    5    HB1  ALA  35           HB3      ALA  35  28.123  12.871  12.149

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA  36           H        ALA  36  25.387  10.306  13.435
    2    HA   ALA  36           HA       ALA  36  25.892   7.824  12.156
    3    HB2  ALA  36           HB1      ALA  36  25.480   7.073  14.234
    4    HB3  ALA  36           HB2      ALA  36  23.786   7.549  14.093
    5    HB1  ALA  36           HB3      ALA  36  24.978   8.694  14.709

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA  37           H        ALA  37  23.048   9.919  12.305
    2    HA   ALA  37           HA       ALA  37  21.205   8.129  11.138
    3    HB3  ALA  37           HB1      ALA  37  21.399  11.094  11.430
    4    HB1  ALA  37           HB2      ALA  37  20.102  10.001  11.909
    5    HB2  ALA  37           HB3      ALA  37  20.277  10.475  10.219

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LYS  38           H        LYS  38  23.269  10.614   9.649
    2    HA   LYS  38           HA       LYS  38  22.621  10.179   6.975
    3    HB2  LYS  38           HB2      LYS  38  24.420  11.757   8.411
    4    HB3  LYS  38           HB3      LYS  38  25.459  10.780   7.380
    5    HG2  LYS  38           HG2      LYS  38  24.275  11.537   5.390
    6    HG3  LYS  38           HG3      LYS  38  23.076  12.378   6.378
    7    HD2  LYS  38           HD2      LYS  38  24.656  13.994   7.122
    8    HD3  LYS  38           HD3      LYS  38  26.025  13.024   6.579
    9    HE2  LYS  38           HE2      LYS  38  25.638  14.891   5.030
   10    HE3  LYS  38           HE3      LYS  38  25.317  13.350   4.227
   11    HZ3  LYS  38           HZ1      LYS  38  23.115  13.769   4.108
   12    HZ2  LYS  38           HZ2      LYS  38  23.618  15.390   4.194
   13    HZ1  LYS  38           HZ3      LYS  38  23.061  14.599   5.589

  No H/Q in entry =          13
  In of MODEL   26
    1    H    ALA  39           H        ALA  39  25.164   8.611   8.918
    2    HA   ALA  39           HA       ALA  39  26.241   7.036   6.842
    3    HB2  ALA  39           HB1      ALA  39  26.179   6.071   9.686
    4    HB1  ALA  39           HB2      ALA  39  27.112   7.508   9.266
    5    HB3  ALA  39           HB3      ALA  39  27.478   5.962   8.500

  No H/Q in entry =           5
  In of MODEL   26
    1    H    MET  40           H        MET  40  23.647   6.388   9.154
    2    HA   MET  40           HA       MET  40  23.234   3.678   8.421
    3    HB2  MET  40           HB2      MET  40  21.399   5.699   9.724
    4    HB3  MET  40           HB3      MET  40  21.012   3.985   9.550
    5    HG2  MET  40           HG2      MET  40  23.557   4.957  10.878
    6    HG3  MET  40           HG3      MET  40  22.071   4.663  11.779
    7    HE3  MET  40           HE1      MET  40  21.553   1.023  11.957
    8    HE2  MET  40           HE2      MET  40  20.664   2.315  11.154
    9    HE1  MET  40           HE3      MET  40  21.409   2.611  12.723

  No H/Q in entry =           9
  In of MODEL   26
    1    H    MET  41           H        MET  41  21.776   6.714   7.242
    2    HA   MET  41           HA       MET  41  19.825   5.495   5.580
    3    HB2  MET  41           HB2      MET  41  21.271   8.103   5.060
    4    HB3  MET  41           HB3      MET  41  19.746   7.591   4.349
    5    HG2  MET  41           HG2      MET  41  19.016   7.393   6.904
    6    HG3  MET  41           HG3      MET  41  20.311   8.566   7.120
    7    HE2  MET  41           HE1      MET  41  19.715   9.848   3.786
    8    HE1  MET  41           HE2      MET  41  20.673  10.299   5.193
    9    HE3  MET  41           HE3      MET  41  19.384  11.362   4.636

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ASP  42           H        ASP  42  23.183   6.460   5.010
    2    HA   ASP  42           HA       ASP  42  23.266   5.988   2.251
    3    HB2  ASP  42           HB2      ASP  42  25.014   7.007   4.012
    4    HB3  ASP  42           HB3      ASP  42  25.691   5.390   3.880

  No H/Q in entry =           4
  In of MODEL   26
    1    H    GLN  43           H        GLN  43  24.032   3.842   4.968
    2    HA   GLN  43           HA       GLN  43  24.717   1.593   3.381
    3    HB2  GLN  43           HB2      GLN  43  23.707   1.763   6.230
    4    HB3  GLN  43           HB3      GLN  43  24.300   0.282   5.471
    5    HG2  GLN  43           HG2      GLN  43  26.446   1.520   4.949
    6    HG3  GLN  43           HG3      GLN  43  25.851   2.839   5.952
    7   HE21  GLN  43          HE21      GLN  43  28.102   1.894   6.977
    8   HE22  GLN  43          HE22      GLN  43  27.848   0.808   8.254

  No H/Q in entry =           8
  In of MODEL   26
    1    H    SER  44           H        SER  44  21.654   2.688   4.782
    2    HA   SER  44           HA       SER  44  20.110   0.425   4.117
    3    HB2  SER  44           HB2      SER  44  19.642   2.948   5.266
    4    HB3  SER  44           HB3      SER  44  18.601   2.892   3.846
    5    HG   SER  44           HG       SER  44  17.529   1.935   5.575

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ARG  45           H        ARG  45  20.806   3.399   2.309
    2    HA   ARG  45           HA       ARG  45  19.275   2.894   0.013
    3    HB2  ARG  45           HB2      ARG  45  20.395   5.045   0.591
    4    HB3  ARG  45           HB3      ARG  45  21.947   4.309   0.197
    5    HG2  ARG  45           HG2      ARG  45  21.156   3.895  -2.113
    6    HG3  ARG  45           HG3      ARG  45  19.616   4.653  -1.718
    7    HD2  ARG  45           HD2      ARG  45  20.843   6.765  -1.140
    8    HD3  ARG  45           HD3      ARG  45  22.346   6.010  -1.717
    9    HE   ARG  45           HE       ARG  45  20.408   5.749  -3.742
   10   HH21  ARG  45          HH11      ARG  45  20.375   7.118  -5.505
   11   HH22  ARG  45          HH12      ARG  45  21.113   8.678  -5.404
   12   HH11  ARG  45          HH21      ARG  45  22.116   8.268  -2.124
   13   HH12  ARG  45          HH22      ARG  45  22.098   9.328  -3.487

  No H/Q in entry =          13
  In of MODEL   26
    1    H    MET  46           H        MET  46  22.653   2.061   0.742
    2    HA   MET  46           HA       MET  46  23.260   0.876  -1.746
    3    HB2  MET  46           HB2      MET  46  24.387   0.569   1.037
    4    HB3  MET  46           HB3      MET  46  25.043  -0.325  -0.338
    5    HG2  MET  46           HG2      MET  46  25.461   1.778  -1.536
    6    HG3  MET  46           HG3      MET  46  24.753   2.692  -0.210
    7    HE3  MET  46           HE1      MET  46  27.606  -0.455   0.153
    8    HE2  MET  46           HE2      MET  46  28.703   0.643  -0.678
    9    HE1  MET  46           HE3      MET  46  27.150   0.242  -1.408

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ALA  47           H        ALA  47  21.910  -0.474   1.237
    2    HA   ALA  47           HA       ALA  47  21.884  -3.187   0.435
    3    HB2  ALA  47           HB1      ALA  47  21.513  -2.731   2.741
    4    HB3  ALA  47           HB2      ALA  47  19.980  -3.352   2.131
    5    HB1  ALA  47           HB3      ALA  47  20.190  -1.618   2.388

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU  48           H        LEU  48  19.498  -0.588   0.092
    2    HA   LEU  48           HA       LEU  48  17.464  -2.144  -1.147
    3    HB2  LEU  48           HB2      LEU  48  18.084   0.817  -1.266
    4    HB3  LEU  48           HB3      LEU  48  16.617   0.090  -1.923
    5    HG   LEU  48           HG       LEU  48  17.491  -0.202   0.960
    6   HD13  LEU  48          HD11      LEU  48  17.046   2.094   0.776
    7   HD12  LEU  48          HD12      LEU  48  15.498   1.429   1.294
    8   HD11  LEU  48          HD13      LEU  48  15.754   1.854  -0.398
    9   HD22  LEU  48          HD21      LEU  48  15.980  -1.934   0.589
   10   HD21  LEU  48          HD22      LEU  48  15.088  -1.041  -0.644
   11   HD23  LEU  48          HD23      LEU  48  14.882  -0.639   1.060

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ASN  49           H        ASN  49  20.123  -0.186  -2.394
    2    HA   ASN  49           HA       ASN  49  19.456  -0.278  -5.114
    3    HB2  ASN  49           HB2      ASN  49  21.122   1.259  -4.210
    4    HB3  ASN  49           HB3      ASN  49  22.167  -0.087  -3.770
    5   HD21  ASN  49          HD21      ASN  49  23.241   1.836  -5.428
    6   HD22  ASN  49          HD22      ASN  49  23.385   1.246  -7.012

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLU  50           H        GLU  50  21.476  -2.450  -3.164
    2    HA   GLU  50           HA       GLU  50  22.184  -4.198  -5.294
    3    HB2  GLU  50           HB2      GLU  50  23.395  -4.159  -3.135
    4    HB3  GLU  50           HB3      GLU  50  21.965  -4.802  -2.330
    5    HG2  GLU  50           HG2      GLU  50  22.068  -6.835  -3.689
    6    HG3  GLU  50           HG3      GLU  50  23.431  -6.188  -4.599

  No H/Q in entry =           6
  In of MODEL   26
    1    H    ALA  51           H        ALA  51  19.542  -4.161  -2.950
    2    HA   ALA  51           HA       ALA  51  18.398  -6.647  -3.699
    3    HB3  ALA  51           HB1      ALA  51  16.810  -6.158  -2.134
    4    HB1  ALA  51           HB2      ALA  51  16.575  -4.515  -2.732
    5    HB2  ALA  51           HB3      ALA  51  17.945  -4.885  -1.685

  No H/Q in entry =           5
  In of MODEL   26
    1    H    HIS  52           H        HIS  52  17.769  -3.306  -4.732
    2    HA   HIS  52           HA       HIS  52  15.650  -3.857  -6.518
    3    HB2  HIS  52           HB2      HIS  52  16.205  -1.585  -5.761
    4    HB3  HIS  52           HB3      HIS  52  17.732  -1.661  -6.639
    5    HD1  HIS  52           HD1      HIS  52  17.492  -2.002  -9.321
    6    HD2  HIS  52           HD2      HIS  52  14.047  -0.778  -7.318
    7    HE1  HIS  52           HE1      HIS  52  15.916  -1.103 -11.088
    8    HE2  HIS  52           HE2      HIS  52  13.812  -0.352  -9.882

  No H/Q in entry =           8
  In of MODEL   26
    1    H    LEU  53           H        LEU  53  19.165  -3.824  -6.973
    2    HA   LEU  53           HA       LEU  53  19.207  -4.140  -9.774
    3    HB2  LEU  53           HB2      LEU  53  21.164  -4.885  -7.614
    4    HB3  LEU  53           HB3      LEU  53  21.472  -5.258  -9.308
    5    HG   LEU  53           HG       LEU  53  20.779  -2.463  -8.349
    6   HD13  LEU  53          HD11      LEU  53  22.860  -3.218  -7.260
    7   HD12  LEU  53          HD12      LEU  53  23.198  -1.990  -8.479
    8   HD11  LEU  53          HD13      LEU  53  23.512  -3.686  -8.828
    9   HD21  LEU  53          HD21      LEU  53  21.818  -3.661 -10.922
   10   HD23  LEU  53          HD22      LEU  53  22.156  -1.981 -10.519
   11   HD22  LEU  53          HD23      LEU  53  20.498  -2.517 -10.712

  No H/Q in entry =          11
  In of MODEL   26
    1    H    VAL  54           H        VAL  54  19.139  -6.527  -7.146
    2    HA   VAL  54           HA       VAL  54  19.278  -8.821  -8.805
    3    HB   VAL  54           HB       VAL  54  18.137  -8.408  -6.030
    4   HG12  VAL  54          HG11      VAL  54  18.491 -11.022  -6.027
    5   HG11  VAL  54          HG12      VAL  54  18.293 -10.857  -7.771
    6   HG13  VAL  54          HG13      VAL  54  17.005 -10.341  -6.684
    7   HG22  VAL  54          HG21      VAL  54  20.451  -8.171  -5.823
    8   HG21  VAL  54          HG22      VAL  54  20.792  -9.260  -7.166
    9   HG23  VAL  54          HG23      VAL  54  20.280  -9.912  -5.609

  No H/Q in entry =           9
  In of MODEL   26
    1    H    GLN  55           H        GLN  55  16.536  -6.949  -7.506
    2    HA   GLN  55           HA       GLN  55  14.528  -8.637  -8.565
    3    HB2  GLN  55           HB2      GLN  55  13.772  -7.119  -6.934
    4    HB3  GLN  55           HB3      GLN  55  14.544  -5.742  -7.717
    5    HG2  GLN  55           HG2      GLN  55  12.806  -5.439  -9.195
    6    HG3  GLN  55           HG3      GLN  55  12.503  -7.163  -9.362
    7   HE21  GLN  55          HE21      GLN  55  10.509  -7.736  -8.543
    8   HE22  GLN  55          HE22      GLN  55   9.735  -6.989  -7.230

  No H/Q in entry =           8
  In of MODEL   26
    1    H    THR  56           H        THR  56  16.225  -5.818  -9.938
    2    HA   THR  56           HA       THR  56  14.767  -5.475 -12.277
    3    HB   THR  56           HB       THR  56  17.786  -5.348 -12.128
    4    HG1  THR  56           HG1      THR  56  15.771  -3.734 -11.065
    5   HG22  THR  56          HG21      THR  56  15.820  -3.682 -13.714
    6   HG21  THR  56          HG22      THR  56  16.626  -5.112 -14.361
    7   HG23  THR  56          HG23      THR  56  17.578  -3.708 -13.873

  No H/Q in entry =           7
  In of MODEL   26
    1    H    LYS  57           H        LYS  57  17.448  -7.739 -11.681
    2    HA   LYS  57           HA       LYS  57  17.446  -8.936 -14.259
    3    HB2  LYS  57           HB2      LYS  57  19.249  -9.163 -12.520
    4    HB3  LYS  57           HB3      LYS  57  18.163 -10.178 -11.582
    5    HG2  LYS  57           HG2      LYS  57  18.070 -11.810 -13.411
    6    HG3  LYS  57           HG3      LYS  57  19.119 -10.794 -14.394
    7    HD2  LYS  57           HD2      LYS  57  20.917 -11.025 -12.708
    8    HD3  LYS  57           HD3      LYS  57  19.874 -12.068 -11.743
    9    HE2  LYS  57           HE2      LYS  57  19.765 -13.700 -13.583
   10    HE3  LYS  57           HE3      LYS  57  20.765 -12.660 -14.595
   11    HZ3  LYS  57           HZ1      LYS  57  22.374 -13.960 -13.734
   12    HZ2  LYS  57           HZ2      LYS  57  21.511 -14.309 -12.314
   13    HZ1  LYS  57           HZ3      LYS  57  22.315 -12.822 -12.479

  No H/Q in entry =          13
  In of MODEL   26
    1    H    LEU  58           H        LEU  58  15.694  -9.622 -11.271
    2    HA   LEU  58           HA       LEU  58  14.496 -12.012 -12.195
    3    HB2  LEU  58           HB2      LEU  58  13.692 -10.114  -9.996
    4    HB3  LEU  58           HB3      LEU  58  12.902 -11.662 -10.305
    5    HG   LEU  58           HG       LEU  58  15.875 -11.347  -9.771
    6   HD11  LEU  58          HD11      LEU  58  13.522 -11.792  -7.962
    7   HD13  LEU  58          HD12      LEU  58  14.965 -10.810  -7.710
    8   HD12  LEU  58          HD13      LEU  58  15.060 -12.565  -7.574
    9   HD22  LEU  58          HD21      LEU  58  15.776 -13.411 -10.796
   10   HD21  LEU  58          HD22      LEU  58  14.068 -13.641 -10.424
   11   HD23  LEU  58          HD23      LEU  58  15.288 -13.926  -9.182

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  59           H        ILE  59  13.778  -8.684 -12.876
    2    HA   ILE  59           HA       ILE  59  11.064  -9.368 -13.797
    3    HB   ILE  59           HB       ILE  59  11.846  -7.076 -12.598
    4   HG12  ILE  59          HG12      ILE  59   9.931  -6.968 -14.940
    5   HG13  ILE  59          HG13      ILE  59   9.526  -7.754 -13.435
    6   HG21  ILE  59          HG21      ILE  59  13.379  -6.652 -14.653
    7   HG23  ILE  59          HG22      ILE  59  12.374  -5.329 -14.107
    8   HG22  ILE  59          HG23      ILE  59  11.904  -6.282 -15.512
    9   HD11  ILE  59          HD11      ILE  59  10.365  -4.869 -13.722
   10   HD13  ILE  59          HD12      ILE  59   9.956  -5.662 -12.202
   11   HD12  ILE  59          HD13      ILE  59   8.716  -5.430 -13.435

  No H/Q in entry =          11
  In of MODEL   26
    1    H    GLU  60           H        GLU  60  14.249  -8.477 -15.078
    2    HA   GLU  60           HA       GLU  60  13.446  -8.089 -17.781
    3    HB2  GLU  60           HB2      GLU  60  15.622  -7.330 -16.937
    4    HB3  GLU  60           HB3      GLU  60  16.108  -8.999 -16.652
    5    HG2  GLU  60           HG2      GLU  60  15.209  -8.161 -19.397
    6    HG3  GLU  60           HG3      GLU  60  16.855  -7.816 -18.870

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLY  61           H        GLY  61  14.472 -10.956 -15.970
    2    HA3  GLY  61           HA2      GLY  61  13.935 -12.613 -18.366
    3    HA2  GLY  61           HA3      GLY  61  14.982 -13.080 -17.031

  No H/Q in entry =           3
  In of MODEL   26
    1    H    ASP  62           H        ASP  62  11.845 -11.573 -16.640
    2    HA   ASP  62           HA       ASP  62  10.949 -13.517 -14.798
    3    HB2  ASP  62           HB2      ASP  62   8.794 -12.322 -14.958
    4    HB3  ASP  62           HB3      ASP  62  10.152 -11.223 -14.735

  No H/Q in entry =           4
  In of MODEL   26
    1    H    ALA  63           H        ALA  63  10.409 -13.182 -18.301
    2    HA   ALA  63           HA       ALA  63   8.248 -14.944 -18.634
    3    HB1  ALA  63           HB1      ALA  63  10.610 -14.711 -20.510
    4    HB3  ALA  63           HB2      ALA  63   9.331 -13.503 -20.410
    5    HB2  ALA  63           HB3      ALA  63   8.951 -15.147 -20.923

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLY  64           H        GLY  64  11.734 -15.621 -18.700
    2    HA3  GLY  64           HA2      GLY  64  12.942 -17.539 -18.366
    3    HA2  GLY  64           HA3      GLY  64  11.607 -18.082 -17.361

  No H/Q in entry =           3
  In of MODEL   26
    1    H    GLU  65           H        GLU  65  12.283 -20.221 -18.298
    2    HA   GLU  65           HA       GLU  65  11.931 -20.762 -21.051
    3    HB2  GLU  65           HB2      GLU  65  11.881 -22.613 -18.669
    4    HB3  GLU  65           HB3      GLU  65  11.904 -23.149 -20.349
    5    HG2  GLU  65           HG2      GLU  65  13.992 -21.350 -19.089
    6    HG3  GLU  65           HG3      GLU  65  14.183 -23.085 -19.337

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLY  66           H        GLY  66   9.781 -20.931 -18.331
    2    HA3  GLY  66           HA2      GLY  66   7.627 -22.362 -19.321
    3    HA2  GLY  66           HA3      GLY  66   7.524 -21.098 -18.111

  No H/Q in entry =           3
  In of MODEL   26
    1    H    LYS  67           H        LYS  67   5.391 -20.863 -19.141
    2    HA   LYS  67           HA       LYS  67   5.070 -19.946 -21.782
    3    HB2  LYS  67           HB2      LYS  67   3.288 -19.772 -19.356
    4    HB3  LYS  67           HB3      LYS  67   2.780 -19.302 -20.983
    5    HG2  LYS  67           HG2      LYS  67   3.336 -21.543 -21.826
    6    HG3  LYS  67           HG3      LYS  67   3.886 -22.022 -20.222
    7    HD2  LYS  67           HD2      LYS  67   1.601 -21.622 -19.340
    8    HD3  LYS  67           HD3      LYS  67   1.061 -21.214 -20.971
    9    HE2  LYS  67           HE2      LYS  67   2.333 -23.859 -20.213
   10    HE3  LYS  67           HE3      LYS  67   0.595 -23.599 -20.343
   11    HZ3  LYS  67           HZ1      LYS  67   0.757 -23.944 -22.507
   12    HZ2  LYS  67           HZ2      LYS  67   2.440 -24.132 -22.389
   13    HZ1  LYS  67           HZ3      LYS  67   1.772 -22.593 -22.657

  No H/Q in entry =          13
  In of MODEL   26
    1    H    MET  68           H        MET  68   3.426 -17.837 -21.725
    2    HA   MET  68           HA       MET  68   5.144 -15.628 -21.934
    3    HB2  MET  68           HB2      MET  68   2.130 -15.757 -21.808
    4    HB3  MET  68           HB3      MET  68   3.062 -14.346 -22.312
    5    HG2  MET  68           HG2      MET  68   3.201 -17.072 -23.629
    6    HG3  MET  68           HG3      MET  68   2.294 -15.694 -24.253
    7    HE1  MET  68           HE1      MET  68   3.044 -13.635 -24.862
    8    HE3  MET  68           HE2      MET  68   4.630 -13.194 -25.485
    9    HE2  MET  68           HE3      MET  68   4.316 -13.101 -23.754

  No H/Q in entry =           9
  In of MODEL   26
    1    H    LYS  69           H        LYS  69   2.852 -16.475 -19.322
    2    HA   LYS  69           HA       LYS  69   2.794 -14.095 -17.942
    3    HB2  LYS  69           HB2      LYS  69   2.688 -16.926 -16.910
    4    HB3  LYS  69           HB3      LYS  69   2.345 -15.514 -15.907
    5    HG2  LYS  69           HG2      LYS  69   0.587 -14.807 -17.475
    6    HG3  LYS  69           HG3      LYS  69   0.935 -16.197 -18.504
    7    HD2  LYS  69           HD2      LYS  69   0.342 -17.710 -16.630
    8    HD3  LYS  69           HD3      LYS  69  -0.062 -16.304 -15.642
    9    HE2  LYS  69           HE2      LYS  69  -1.367 -17.015 -18.287
   10    HE3  LYS  69           HE3      LYS  69  -2.081 -17.280 -16.697
   11    HZ1  LYS  69           HZ1      LYS  69  -1.631 -14.780 -16.388
   12    HZ3  LYS  69           HZ2      LYS  69  -2.967 -15.265 -17.318
   13    HZ2  LYS  69           HZ3      LYS  69  -1.543 -14.738 -18.080

  No H/Q in entry =          13
  In of MODEL   26
    1    H    VAL  70           H        VAL  70   3.630 -14.324 -15.353
    2    HA   VAL  70           HA       VAL  70   6.585 -14.485 -15.468
    3    HB   VAL  70           HB       VAL  70   6.685 -12.425 -14.104
    4   HG12  VAL  70          HG11      VAL  70   5.916 -10.848 -15.925
    5   HG11  VAL  70          HG12      VAL  70   5.199 -12.240 -16.738
    6   HG13  VAL  70          HG13      VAL  70   6.943 -12.163 -16.494
    7   HG21  VAL  70          HG21      VAL  70   4.446 -12.608 -13.049
    8   HG23  VAL  70          HG22      VAL  70   3.690 -12.316 -14.615
    9   HG22  VAL  70          HG23      VAL  70   4.632 -11.042 -13.840

  No H/Q in entry =           9
  In of MODEL   26
    1    H    SER  71           H        SER  71   7.555 -14.584 -13.282
    2    HA   SER  71           HA       SER  71   6.425 -16.615 -11.670
    3    HB2  SER  71           HB2      SER  71   8.854 -16.118 -11.761
    4    HB3  SER  71           HB3      SER  71   8.557 -14.590 -10.936
    5    HG   SER  71           HG       SER  71   7.951 -17.196  -9.970

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU  72           H        LEU  72   5.068 -16.528  -9.968
    2    HA   LEU  72           HA       LEU  72   3.492 -14.234  -9.515
    3    HB2  LEU  72           HB2      LEU  72   3.821 -16.782  -7.940
    4    HB3  LEU  72           HB3      LEU  72   2.635 -15.543  -7.543
    5    HG   LEU  72           HG       LEU  72   2.808 -16.839 -10.282
    6   HD13  LEU  72          HD11      LEU  72   2.276 -18.622  -8.777
    7   HD12  LEU  72          HD12      LEU  72   0.740 -18.091  -9.458
    8   HD11  LEU  72          HD13      LEU  72   1.202 -17.591  -7.831
    9   HD22  LEU  72          HD21      LEU  72   1.538 -14.882 -10.527
   10   HD21  LEU  72          HD22      LEU  72   0.878 -14.971  -8.902
   11   HD23  LEU  72          HD23      LEU  72   0.294 -16.067 -10.150

  No H/Q in entry =          11
  In of MODEL   26
    1    H    VAL  73           H        VAL  73   6.177 -15.636  -7.758
    2    HA   VAL  73           HA       VAL  73   6.111 -14.103  -5.426
    3    HB   VAL  73           HB       VAL  73   8.303 -14.888  -5.008
    4   HG11  VAL  73          HG11      VAL  73   6.497 -16.624  -5.170
    5   HG13  VAL  73          HG12      VAL  73   8.110 -17.257  -5.500
    6   HG12  VAL  73          HG13      VAL  73   7.000 -16.929  -6.831
    7   HG21  VAL  73          HG21      VAL  73   8.475 -14.918  -8.001
    8   HG23  VAL  73          HG22      VAL  73   9.476 -16.044  -7.086
    9   HG22  VAL  73          HG23      VAL  73   9.636 -14.308  -6.821

  No H/Q in entry =           9
  In of MODEL   26
    1    H    LEU  74           H        LEU  74   7.071 -13.198  -8.608
    2    HA   LEU  74           HA       LEU  74   8.995 -11.225  -8.127
    3    HB2  LEU  74           HB2      LEU  74   8.548 -11.970 -10.362
    4    HB3  LEU  74           HB3      LEU  74   6.867 -11.451 -10.253
    5    HG   LEU  74           HG       LEU  74   7.606  -9.101 -10.043
    6   HD12  LEU  74          HD11      LEU  74  10.091  -8.728 -10.641
    7   HD11  LEU  74          HD12      LEU  74  10.326 -10.408 -10.166
    8   HD13  LEU  74          HD13      LEU  74   9.730  -9.235  -8.992
    9   HD21  LEU  74          HD21      LEU  74   7.368 -10.510 -12.261
   10   HD23  LEU  74          HD22      LEU  74   9.084 -10.191 -12.362
   11   HD22  LEU  74          HD23      LEU  74   7.961  -8.851 -12.305

  No H/Q in entry =          11
  In of MODEL   26
    1    H    VAL  75           H        VAL  75   5.493 -10.884  -8.461
    2    HA   VAL  75           HA       VAL  75   5.366  -8.129  -7.874
    3    HB   VAL  75           HB       VAL  75   3.307 -10.301  -7.482
    4   HG13  VAL  75          HG11      VAL  75   2.796  -8.409  -5.989
    5   HG12  VAL  75          HG12      VAL  75   1.710  -8.365  -7.370
    6   HG11  VAL  75          HG13      VAL  75   3.083  -7.271  -7.303
    7   HG22  VAL  75          HG21      VAL  75   2.390  -9.357  -9.562
    8   HG21  VAL  75          HG22      VAL  75   4.061  -9.855  -9.812
    9   HG23  VAL  75          HG23      VAL  75   3.672  -8.148  -9.597

  No H/Q in entry =           9
  In of MODEL   26
    1    H    GLU  76           H        GLU  76   5.159 -11.008  -5.762
    2    HA   GLU  76           HA       GLU  76   4.685  -9.652  -3.339
    3    HB2  GLU  76           HB2      GLU  76   4.570 -12.143  -3.636
    4    HB3  GLU  76           HB3      GLU  76   6.320 -12.179  -3.763
    5    HG2  GLU  76           HG2      GLU  76   6.526 -11.290  -1.474
    6    HG3  GLU  76           HG3      GLU  76   4.781 -11.215  -1.319

  No H/Q in entry =           6
  In of MODEL   26
    1    H    ALA  77           H        ALA  77   7.747 -10.522  -4.918
    2    HA   ALA  77           HA       ALA  77   9.434  -9.457  -2.911
    3    HB3  ALA  77           HB1      ALA  77  10.119  -9.543  -5.847
    4    HB1  ALA  77           HB2      ALA  77  10.068 -10.998  -4.853
    5    HB2  ALA  77           HB3      ALA  77  11.204  -9.706  -4.466

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLN  78           H        GLN  78   8.010  -8.058  -5.818
    2    HA   GLN  78           HA       GLN  78   9.333  -5.563  -5.721
    3    HB2  GLN  78           HB2      GLN  78   7.974  -6.564  -7.642
    4    HB3  GLN  78           HB3      GLN  78   6.537  -6.038  -6.770
    5    HG2  GLN  78           HG2      GLN  78   7.239  -3.732  -6.867
    6    HG3  GLN  78           HG3      GLN  78   8.804  -4.185  -7.539
    7   HE21  GLN  78          HE21      GLN  78   8.350  -5.800  -9.627
    8   HE22  GLN  78          HE22      GLN  78   7.260  -5.130 -10.744

  No H/Q in entry =           8
  In of MODEL   26
    1    H    LEU  79           H        LEU  79   6.334  -6.736  -4.276
    2    HA   LEU  79           HA       LEU  79   5.317  -4.340  -3.263
    3    HB2  LEU  79           HB2      LEU  79   4.027  -6.407  -3.201
    4    HB3  LEU  79           HB3      LEU  79   5.186  -7.132  -2.090
    5    HG   LEU  79           HG       LEU  79   4.622  -5.496  -0.362
    6   HD13  LEU  79          HD11      LEU  79   4.128  -3.488  -1.411
    7   HD12  LEU  79          HD12      LEU  79   2.511  -4.032  -0.964
    8   HD11  LEU  79          HD13      LEU  79   3.087  -4.248  -2.615
    9   HD23  LEU  79          HD21      LEU  79   2.042  -6.019  -0.260
   10   HD22  LEU  79          HD22      LEU  79   3.197  -7.345  -0.156
   11   HD21  LEU  79          HD23      LEU  79   2.373  -7.017  -1.677

  No H/Q in entry =          11
  In of MODEL   26
    1    H    HIS  80           H        HIS  80   7.534  -6.649  -1.689
    2    HA   HIS  80           HA       HIS  80   7.814  -5.103   0.678
    3    HB2  HIS  80           HB2      HIS  80   9.174  -7.452  -0.526
    4    HB3  HIS  80           HB3      HIS  80  10.080  -6.544   0.687
    5    HD1  HIS  80           HD1      HIS  80   9.606  -7.185   3.032
    6    HD2  HIS  80           HD2      HIS  80   6.389  -8.073   0.534
    7    HE1  HIS  80           HE1      HIS  80   7.854  -8.308   4.488
    8    HE2  HIS  80           HE2      HIS  80   5.886  -8.853   2.974

  No H/Q in entry =           8
  In of MODEL   26
    1    H    LEU  81           H        LEU  81   9.810  -5.357  -2.243
    2    HA   LEU  81           HA       LEU  81  11.838  -3.593  -1.373
    3    HB2  LEU  81           HB2      LEU  81  10.915  -4.397  -4.132
    4    HB3  LEU  81           HB3      LEU  81  12.325  -3.375  -3.848
    5    HG   LEU  81           HG       LEU  81  11.967  -6.100  -2.572
    6   HD12  LEU  81          HD11      LEU  81  13.783  -6.706  -4.329
    7   HD11  LEU  81          HD12      LEU  81  13.198  -5.289  -5.199
    8   HD13  LEU  81          HD13      LEU  81  12.103  -6.625  -4.856
    9   HD23  LEU  81          HD21      LEU  81  14.592  -5.755  -2.569
   10   HD22  LEU  81          HD22      LEU  81  13.607  -5.005  -1.315
   11   HD21  LEU  81          HD23      LEU  81  14.169  -4.048  -2.684

  No H/Q in entry =          11
  In of MODEL   26
    1    H    MET  82           H        MET  82   8.901  -2.989  -3.298
    2    HA   MET  82           HA       MET  82   9.409  -0.258  -3.802
    3    HB2  MET  82           HB2      MET  82   6.868  -1.879  -3.667
    4    HB3  MET  82           HB3      MET  82   6.847  -0.155  -4.031
    5    HG2  MET  82           HG2      MET  82   8.464  -2.212  -5.572
    6    HG3  MET  82           HG3      MET  82   6.888  -1.606  -6.079
    7    HE3  MET  82           HE1      MET  82   7.295   1.853  -7.253
    8    HE2  MET  82           HE2      MET  82   6.929   1.623  -5.545
    9    HE1  MET  82           HE3      MET  82   6.271   0.506  -6.737

  No H/Q in entry =           9
  In of MODEL   26
    1    H    THR  83           H        THR  83   7.645  -1.874  -1.190
    2    HA   THR  83           HA       THR  83   6.774   0.465   0.140
    3    HB   THR  83           HB       THR  83   6.664  -1.110   2.158
    4    HG1  THR  83           HG1      THR  83   7.441  -3.052   1.926
    5   HG22  THR  83          HG21      THR  83   5.022  -2.693   0.697
    6   HG21  THR  83          HG22      THR  83   5.230  -1.363  -0.436
    7   HG23  THR  83          HG23      THR  83   4.593  -1.054   1.180

  No H/Q in entry =           7
  In of MODEL   26
    1    H    SER  84           H        SER  84   9.622  -1.603   0.650
    2    HA   SER  84           HA       SER  84  10.675  -0.161   2.834
    3    HB2  SER  84           HB2      SER  84  11.939  -1.991   0.804
    4    HB3  SER  84           HB3      SER  84  12.883  -1.228   2.082
    5    HG   SER  84           HG       SER  84  10.627  -2.940   2.351

  No H/Q in entry =           5
  In of MODEL   26
    1    H    MET  85           H        MET  85  11.412   0.107  -0.658
    2    HA   MET  85           HA       MET  85  13.391   2.092  -0.415
    3    HB2  MET  85           HB2      MET  85  12.901   0.754  -2.474
    4    HB3  MET  85           HB3      MET  85  11.469   1.753  -2.721
    5    HG2  MET  85           HG2      MET  85  13.130   3.759  -2.506
    6    HG3  MET  85           HG3      MET  85  14.365   2.552  -2.850
    7    HE1  MET  85           HE1      MET  85  13.618   0.601  -4.568
    8    HE3  MET  85           HE2      MET  85  12.830   0.923  -6.109
    9    HE2  MET  85           HE3      MET  85  11.855   0.745  -4.656

  No H/Q in entry =           9
  In of MODEL   26
    1    H    LEU  86           H        LEU  86   9.896   2.392  -0.910
    2    HA   LEU  86           HA       LEU  86   9.803   5.204  -1.093
    3    HB2  LEU  86           HB2      LEU  86   7.973   3.526  -1.661
    4    HB3  LEU  86           HB3      LEU  86   7.651   3.433   0.071
    5    HG   LEU  86           HG       LEU  86   7.465   5.992   0.018
    6   HD11  LEU  86          HD11      LEU  86   8.234   5.563  -2.687
    7   HD13  LEU  86          HD12      LEU  86   7.786   7.087  -1.925
    8   HD12  LEU  86          HD13      LEU  86   6.557   6.111  -2.725
    9   HD23  LEU  86          HD21      LEU  86   5.338   4.618  -1.636
   10   HD22  LEU  86          HD22      LEU  86   5.140   5.877  -0.419
   11   HD21  LEU  86          HD23      LEU  86   5.558   4.237   0.073

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ALA  87           H        ALA  87   9.369   3.022   1.656
    2    HA   ALA  87           HA       ALA  87   8.810   4.931   3.627
    3    HB1  ALA  87           HB1      ALA  87   9.644   2.119   3.538
    4    HB3  ALA  87           HB2      ALA  87   8.516   2.920   4.628
    5    HB2  ALA  87           HB3      ALA  87  10.245   2.969   4.965

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ARG  88           H        ARG  88  11.903   3.536   2.634
    2    HA   ARG  88           HA       ARG  88  13.507   4.930   4.460
    3    HB2  ARG  88           HB2      ARG  88  14.188   2.963   3.054
    4    HB3  ARG  88           HB3      ARG  88  14.325   4.057   1.680
    5    HG2  ARG  88           HG2      ARG  88  15.793   5.385   3.620
    6    HG3  ARG  88           HG3      ARG  88  16.132   3.699   3.998
    7    HD2  ARG  88           HD2      ARG  88  17.394   3.414   2.147
    8    HD3  ARG  88           HD3      ARG  88  16.244   4.274   1.118
    9    HE   ARG  88           HE       ARG  88  18.633   5.361   2.155
   10   HH21  ARG  88          HH11      ARG  88  18.956   7.583   1.958
   11   HH22  ARG  88          HH12      ARG  88  17.594   8.642   1.820
   12   HH11  ARG  88          HH21      ARG  88  15.286   6.082   1.890
   13   HH12  ARG  88          HH22      ARG  88  15.515   7.789   1.757

  No H/Q in entry =          13
  In of MODEL   26
    1    H    GLU  89           H        GLU  89  12.511   5.818   1.140
    2    HA   GLU  89           HA       GLU  89  14.035   8.192   0.977
    3    HB2  GLU  89           HB2      GLU  89  12.892   7.140  -0.966
    4    HB3  GLU  89           HB3      GLU  89  11.345   7.666  -0.302
    5    HG2  GLU  89           HG2      GLU  89  12.024  10.010  -0.468
    6    HG3  GLU  89           HG3      GLU  89  13.630   9.535  -1.011

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LEU  90           H        LEU  90  10.715   7.651   2.121
    2    HA   LEU  90           HA       LEU  90  10.176  10.380   2.697
    3    HB2  LEU  90           HB2      LEU  90   9.011   7.795   3.730
    4    HB3  LEU  90           HB3      LEU  90   8.366   9.384   4.155
    5    HG   LEU  90           HG       LEU  90   8.781   8.508   1.285
    6   HD12  LEU  90          HD11      LEU  90   6.251   8.155   1.358
    7   HD11  LEU  90          HD12      LEU  90   6.413   8.146   3.114
    8   HD13  LEU  90          HD13      LEU  90   7.239   6.924   2.146
    9   HD22  LEU  90          HD21      LEU  90   8.464  10.813   1.212
   10   HD21  LEU  90          HD22      LEU  90   7.484  10.836   2.676
   11   HD23  LEU  90          HD23      LEU  90   6.786  10.274   1.158

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  91           H        ILE  91  11.473   7.711   4.615
    2    HA   ILE  91           HA       ILE  91  11.611   9.078   7.082
    3    HB   ILE  91           HB       ILE  91  13.183   6.755   5.952
    4   HG12  ILE  91          HG12      ILE  91  11.175   6.903   8.221
    5   HG13  ILE  91          HG13      ILE  91  10.700   6.617   6.547
    6   HG22  ILE  91          HG21      ILE  91  13.666   6.546   8.591
    7   HG21  ILE  91          HG22      ILE  91  13.573   8.304   8.490
    8   HG23  ILE  91          HG23      ILE  91  14.756   7.427   7.520
    9   HD13  ILE  91          HD11      ILE  91  11.722   4.525   6.473
   10   HD12  ILE  91          HD12      ILE  91  11.136   4.578   8.135
   11   HD11  ILE  91          HD13      ILE  91  12.833   4.907   7.789

  No H/Q in entry =          11
  In of MODEL   26
    1    H    THR  92           H        THR  92  13.818   8.930   4.321
    2    HA   THR  92           HA       THR  92  15.974  10.344   5.470
    3    HB   THR  92           HB       THR  92  14.977  10.209   2.614
    4    HG1  THR  92           HG1      THR  92  15.829   8.320   3.016
    5   HG22  THR  92          HG21      THR  92  17.539  10.924   2.309
    6   HG21  THR  92          HG22      THR  92  17.229  11.742   3.840
    7   HG23  THR  92          HG23      THR  92  16.249  12.120   2.423

  No H/Q in entry =           7
  In of MODEL   26
    1    H    GLU  93           H        GLU  93  13.069  11.469   3.754
    2    HA   GLU  93           HA       GLU  93  13.637  14.235   3.865
    3    HB2  GLU  93           HB2      GLU  93  10.946  12.836   3.891
    4    HB3  GLU  93           HB3      GLU  93  11.216  14.539   3.518
    5    HG2  GLU  93           HG2      GLU  93  12.569  12.309   1.984
    6    HG3  GLU  93           HG3      GLU  93  11.014  12.977   1.504

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LEU  94           H        LEU  94  11.925  12.063   6.084
    2    HA   LEU  94           HA       LEU  94  11.105  14.002   7.964
    3    HB2  LEU  94           HB2      LEU  94  11.711  11.053   8.236
    4    HB3  LEU  94           HB3      LEU  94  11.136  12.023   9.588
    5    HG   LEU  94           HG       LEU  94   9.640  12.060   6.966
    6   HD11  LEU  94          HD11      LEU  94   9.753   9.840   8.971
    7   HD13  LEU  94          HD12      LEU  94   9.444   9.775   7.237
    8   HD12  LEU  94          HD13      LEU  94   8.166  10.280   8.341
    9   HD23  LEU  94          HD21      LEU  94   7.724  12.441   8.575
   10   HD22  LEU  94          HD22      LEU  94   8.951  13.707   8.606
   11   HD21  LEU  94          HD23      LEU  94   8.905  12.490   9.881

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  95           H        ILE  95  14.097  12.101   7.714
    2    HA   ILE  95           HA       ILE  95  15.266  13.035  10.122
    3    HB   ILE  95           HB       ILE  95  16.504  11.978   7.568
    4   HG12  ILE  95          HG12      ILE  95  16.232  10.775  10.338
    5   HG13  ILE  95          HG13      ILE  95  15.062  10.505   9.048
    6   HG21  ILE  95          HG21      ILE  95  17.763  12.797  10.205
    7   HG23  ILE  95          HG22      ILE  95  18.213  13.329   8.583
    8   HG22  ILE  95          HG23      ILE  95  18.538  11.673   9.090
    9   HD13  ILE  95          HD11      ILE  95  16.549   9.240   7.778
   10   HD12  ILE  95          HD12      ILE  95  17.034   8.796   9.412
   11   HD11  ILE  95          HD13      ILE  95  17.971   9.985   8.508

  No H/Q in entry =          11
  In of MODEL   26
    1    H    GLU  96           H        GLU  96  15.393  14.269   6.787
    2    HA   GLU  96           HA       GLU  96  17.222  16.366   7.254
    3    HB2  GLU  96           HB2      GLU  96  16.553  15.697   4.999
    4    HB3  GLU  96           HB3      GLU  96  14.906  16.238   5.306
    5    HG2  GLU  96           HG2      GLU  96  15.449  18.372   4.761
    6    HG3  GLU  96           HG3      GLU  96  16.754  18.386   5.937

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LEU  97           H        LEU  97  13.715  16.145   7.700
    2    HA   LEU  97           HA       LEU  97  13.275  18.875   8.344
    3    HB2  LEU  97           HB2      LEU  97  11.784  16.335   8.965
    4    HB3  LEU  97           HB3      LEU  97  11.259  17.877   9.639
    5    HG   LEU  97           HG       LEU  97  11.732  17.465   6.672
    6   HD12  LEU  97          HD11      LEU  97   9.210  17.312   6.566
    7   HD11  LEU  97          HD12      LEU  97   9.213  17.113   8.316
    8   HD13  LEU  97          HD13      LEU  97  10.001  15.913   7.290
    9   HD23  LEU  97          HD21      LEU  97   9.976  19.412   6.712
   10   HD22  LEU  97          HD22      LEU  97  11.655  19.788   7.097
   11   HD21  LEU  97          HD23      LEU  97  10.474  19.606   8.392

  No H/Q in entry =          11
  In of MODEL   26
    1    H    HIS  98           H        HIS  98  14.133  16.057  10.336
    2    HA   HIS  98           HA       HIS  98  13.975  17.317  12.852
    3    HB2  HIS  98           HB2      HIS  98  15.742  15.076  11.843
    4    HB3  HIS  98           HB3      HIS  98  15.743  15.615  13.524
    5    HD1  HIS  98           HD1      HIS  98  13.547  13.964  10.942
    6    HD2  HIS  98           HD2      HIS  98  13.451  14.883  15.007
    7    HE1  HIS  98           HE1      HIS  98  11.539  12.750  11.905
    8    HE2  HIS  98           HE2      HIS  98  11.460  13.302  14.376

  No H/Q in entry =           8
  In of MODEL   26
    1    H    GLU  99           H        GLU  99  16.518  17.226  10.405
    2    HA   GLU  99           HA       GLU  99  18.498  18.576  11.925
    3    HB2  GLU  99           HB2      GLU  99  18.980  17.293   9.853
    4    HB3  GLU  99           HB3      GLU  99  18.153  18.540   8.916
    5    HG2  GLU  99           HG2      GLU  99  19.750  20.226   9.699
    6    HG3  GLU  99           HG3      GLU  99  20.545  19.031  10.718

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LYS 100           H        LYS 100  15.953  19.714   9.720
    2    HA   LYS 100           HA       LYS 100  16.725  22.459   9.860
    3    HB2  LYS 100           HB2      LYS 100  14.101  21.145   9.118
    4    HB3  LYS 100           HB3      LYS 100  14.384  22.887   9.026
    5    HG2  LYS 100           HG2      LYS 100  16.353  22.456   7.550
    6    HG3  LYS 100           HG3      LYS 100  15.956  20.735   7.570
    7    HD2  LYS 100           HD2      LYS 100  13.751  21.224   6.581
    8    HD3  LYS 100           HD3      LYS 100  14.132  22.947   6.568
    9    HE2  LYS 100           HE2      LYS 100  16.088  22.484   5.099
   10    HE3  LYS 100           HE3      LYS 100  15.638  20.775   5.068
   11    HZ1  LYS 100           HZ1      LYS 100  13.789  22.951   4.242
   12    HZ3  LYS 100           HZ2      LYS 100  13.619  21.280   3.980
   13    HZ2  LYS 100           HZ3      LYS 100  14.818  22.153   3.153

  No H/Q in entry =          13
  In of MODEL   26
    1    H    LEU 101           H        LEU 101  14.657  20.394  11.836
    2    HA   LEU 101           HA       LEU 101  13.479  22.452  13.420
    3    HB2  LEU 101           HB2      LEU 101  13.950  19.506  13.801
    4    HB3  LEU 101           HB3      LEU 101  13.412  20.482  15.165
    5    HG   LEU 101           HG       LEU 101  11.980  20.557  12.503
    6   HD12  LEU 101          HD11      LEU 101  10.341  18.978  13.780
    7   HD11  LEU 101          HD12      LEU 101  11.744  18.578  14.768
    8   HD13  LEU 101          HD13      LEU 101  11.772  18.272  13.031
    9   HD21  LEU 101          HD21      LEU 101  11.330  21.344  15.358
   10   HD23  LEU 101          HD22      LEU 101  10.065  21.107  14.154
   11   HD22  LEU 101          HD23      LEU 101  11.287  22.353  13.910

  No H/Q in entry =          11
  In of MODEL   26
    1    H    LYS 102           H        LYS 102  16.630  21.872  12.968
    2    HA   LYS 102           HA       LYS 102  18.474  22.759  14.031
    3    HB2  LYS 102           HB2      LYS 102  16.652  24.258  15.173
    4    HB3  LYS 102           HB3      LYS 102  16.875  23.198  16.549
    5    HG2  LYS 102           HG2      LYS 102  18.744  25.225  15.371
    6    HG3  LYS 102           HG3      LYS 102  18.374  24.908  17.051
    7    HD2  LYS 102           HD2      LYS 102  20.049  23.010  15.358
    8    HD3  LYS 102           HD3      LYS 102  20.731  24.338  16.287
    9    HE2  LYS 102           HE2      LYS 102  20.360  21.786  17.257
   10    HE3  LYS 102           HE3      LYS 102  20.571  23.230  18.248
   11    HZ2  LYS 102           HZ1      LYS 102  18.617  21.929  18.875
   12    HZ1  LYS 102           HZ2      LYS 102  17.963  22.153  17.330
   13    HZ3  LYS 102           HZ3      LYS 102  18.187  23.485  18.354

  No H/Q in entry =          13
  In of MODEL   26
    1    H    ALA 103           H        ALA 103  16.428  21.136  16.463
    2    HA   ALA 103           HA       ALA 103  18.174  19.940  18.110
    3    HB2  ALA 103           HB1      ALA 103  16.607  17.919  18.112
    4    HB1  ALA 103           HB2      ALA 103  15.698  18.765  16.858
    5    HB3  ALA 103           HB3      ALA 103  15.878  19.487  18.456

  No H/Q in entry =           5
  In of MODEL   26
    1    H1   ALA   1           H3       ALA   1  -1.715  -7.087 -21.413
    2    H2   ALA   1           H2       ALA   1  -2.495  -8.529 -20.956
    3    H3   ALA   1           H1       ALA   1  -0.889  -8.566 -21.519
    4    HA   ALA   1           HA       ALA   1  -1.729  -9.042 -23.511
    5    HB1  ALA   1           HB1      ALA   1  -3.857  -9.778 -23.027
    6    HB2  ALA   1           HB2      ALA   1  -4.313  -8.271 -23.822
    7    HB3  ALA   1           HB3      ALA   1  -4.243  -8.351 -22.064

  No H/Q in entry =           7
  In of MODEL   26
    1    H    GLU   2           H        GLU   2  -2.578  -7.858 -25.496
    2    HA   GLU   2           HA       GLU   2  -1.200  -5.833 -26.380
    3    HB2  GLU   2           HB2      GLU   2  -4.208  -5.925 -26.683
    4    HB3  GLU   2           HB3      GLU   2  -3.100  -5.052 -27.738
    5    HG2  GLU   2           HG2      GLU   2  -2.586  -6.938 -28.896
    6    HG3  GLU   2           HG3      GLU   2  -2.275  -7.841 -27.420

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLU   3           H        GLU   3  -4.367  -4.602 -25.465
    2    HA   GLU   3           HA       GLU   3  -3.338  -2.037 -24.841
    3    HB2  GLU   3           HB2      GLU   3  -6.014  -3.374 -24.497
    4    HB3  GLU   3           HB3      GLU   3  -5.726  -1.757 -23.851
    5    HG2  GLU   3           HG2      GLU   3  -5.388  -0.827 -25.979
    6    HG3  GLU   3           HG3      GLU   3  -4.983  -2.378 -26.705

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LEU   4           H        LEU   4  -4.899  -4.410 -22.654
    2    HA   LEU   4           HA       LEU   4  -4.534  -3.179 -20.265
    3    HB2  LEU   4           HB2      LEU   4  -3.969  -6.116 -20.737
    4    HB3  LEU   4           HB3      LEU   4  -4.373  -5.373 -19.191
    5    HG   LEU   4           HG       LEU   4  -6.157  -5.461 -21.647
    6   HD13  LEU   4          HD11      LEU   4  -7.331  -7.188 -20.644
    7   HD12  LEU   4          HD12      LEU   4  -6.842  -6.725 -19.015
    8   HD11  LEU   4          HD13      LEU   4  -5.705  -7.559 -20.072
    9   HD23  LEU   4          HD21      LEU   4  -7.839  -4.664 -19.771
   10   HD22  LEU   4          HD22      LEU   4  -6.814  -3.484 -20.587
   11   HD21  LEU   4          HD23      LEU   4  -6.376  -4.071 -18.983

  No H/Q in entry =          11
  In of MODEL   26
    1    H    GLU   5           H        GLU   5  -2.029  -5.001 -22.008
    2    HA   GLU   5           HA       GLU   5  -0.038  -4.701 -19.980
    3    HB2  GLU   5           HB2      GLU   5   0.046  -6.474 -21.720
    4    HB3  GLU   5           HB3      GLU   5   0.316  -5.233 -22.944
    5    HG2  GLU   5           HG2      GLU   5   2.386  -4.545 -21.813
    6    HG3  GLU   5           HG3      GLU   5   2.115  -5.752 -20.557

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLU   6           H        GLU   6  -0.701  -2.993 -23.022
    2    HA   GLU   6           HA       GLU   6   1.455  -1.143 -22.763
    3    HB2  GLU   6           HB2      GLU   6  -1.115  -1.065 -24.359
    4    HB3  GLU   6           HB3      GLU   6   0.140   0.168 -24.474
    5    HG2  GLU   6           HG2      GLU   6   1.771  -1.494 -25.186
    6    HG3  GLU   6           HG3      GLU   6   0.597  -2.788 -24.958

  No H/Q in entry =           6
  In of MODEL   26
    1    H    VAL   7           H        VAL   7  -1.878  -1.242 -21.703
    2    HA   VAL   7           HA       VAL   7  -2.117   1.468 -20.865
    3    HB   VAL   7           HB       VAL   7  -3.555  -1.061 -20.022
    4   HG11  VAL   7          HG11      VAL   7  -3.950   1.824 -19.206
    5   HG13  VAL   7          HG12      VAL   7  -3.834   0.400 -18.171
    6   HG12  VAL   7          HG13      VAL   7  -5.273   0.658 -19.157
    7   HG21  VAL   7          HG21      VAL   7  -3.732   0.014 -22.409
    8   HG23  VAL   7          HG22      VAL   7  -4.684   1.255 -21.593
    9   HG22  VAL   7          HG23      VAL   7  -5.216  -0.427 -21.564

  No H/Q in entry =           9
  In of MODEL   26
    1    H    VAL   8           H        VAL   8  -1.098  -1.509 -19.227
    2    HA   VAL   8           HA       VAL   8  -0.776  -0.427 -16.633
    3    HB   VAL   8           HB       VAL   8   0.641  -2.731 -17.996
    4   HG13  VAL   8          HG11      VAL   8   2.054  -2.056 -16.196
    5   HG12  VAL   8          HG12      VAL   8   1.098  -3.398 -15.563
    6   HG11  VAL   8          HG13      VAL   8   0.679  -1.739 -15.137
    7   HG23  VAL   8          HG21      VAL   8  -1.319  -3.183 -15.797
    8   HG22  VAL   8          HG22      VAL   8  -1.115  -4.050 -17.316
    9   HG21  VAL   8          HG23      VAL   8  -2.015  -2.538 -17.283

  No H/Q in entry =           9
  In of MODEL   26
    1    H    MET   9           H        MET   9   1.462  -0.710 -19.391
    2    HA   MET   9           HA       MET   9   3.746   0.351 -18.140
    3    HB2  MET   9           HB2      MET   9   2.785   0.385 -21.001
    4    HB3  MET   9           HB3      MET   9   4.305   1.141 -20.524
    5    HG2  MET   9           HG2      MET   9   5.058  -1.012 -19.554
    6    HG3  MET   9           HG3      MET   9   3.551  -1.763 -20.081
    7    HE1  MET   9           HE1      MET   9   6.419   0.366 -20.939
    8    HE3  MET   9           HE2      MET   9   6.920  -0.013 -22.584
    9    HE2  MET   9           HE3      MET   9   7.290  -1.134 -21.278

  No H/Q in entry =           9
  In of MODEL   26
    1    H    GLY  10           H        GLY  10   1.041   1.933 -19.804
    2    HA3  GLY  10           HA2      GLY  10   1.986   4.594 -19.563
    3    HA2  GLY  10           HA3      GLY  10   0.299   4.121 -19.760

  No H/Q in entry =           3
  In of MODEL   26
    1    H    LEU  11           H        LEU  11  -0.078   2.590 -17.473
    2    HA   LEU  11           HA       LEU  11  -0.612   4.563 -15.509
    3    HB2  LEU  11           HB2      LEU  11  -0.523   1.548 -15.355
    4    HB3  LEU  11           HB3      LEU  11  -1.032   2.566 -14.009
    5    HG   LEU  11           HG       LEU  11  -2.286   2.672 -16.766
    6   HD13  LEU  11          HD11      LEU  11  -2.850   0.525 -16.009
    7   HD12  LEU  11          HD12      LEU  11  -4.205   1.507 -15.456
    8   HD11  LEU  11          HD13      LEU  11  -2.940   1.035 -14.323
    9   HD22  LEU  11          HD21      LEU  11  -2.886   4.684 -15.756
   10   HD21  LEU  11          HD22      LEU  11  -2.798   4.017 -14.126
   11   HD23  LEU  11          HD23      LEU  11  -4.176   3.642 -15.161

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  12           H        ILE  12   1.947   2.114 -15.766
    2    HA   ILE  12           HA       ILE  12   3.161   2.659 -13.268
    3    HB   ILE  12           HB       ILE  12   4.411   1.630 -15.838
    4   HG12  ILE  12          HG12      ILE  12   2.411   0.385 -14.689
    5   HG13  ILE  12          HG13      ILE  12   3.814  -0.541 -15.180
    6   HG21  ILE  12          HG21      ILE  12   5.401   1.683 -12.975
    7   HG23  ILE  12          HG22      ILE  12   6.204   2.314 -14.413
    8   HG22  ILE  12          HG23      ILE  12   6.051   0.574 -14.179
    9   HD11  ILE  12          HD11      ILE  12   3.354   0.556 -12.394
   10   HD13  ILE  12          HD12      ILE  12   4.643  -0.534 -12.898
   11   HD12  ILE  12          HD13      ILE  12   2.983  -1.086 -12.887

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  13           H        ILE  13   3.736   3.928 -16.528
    2    HA   ILE  13           HA       ILE  13   5.866   5.663 -15.814
    3    HB   ILE  13           HB       ILE  13   3.823   5.725 -18.049
    4   HG12  ILE  13          HG12      ILE  13   5.688   3.909 -17.777
    5   HG13  ILE  13          HG13      ILE  13   5.419   4.642 -19.354
    6   HG21  ILE  13          HG21      ILE  13   6.172   7.562 -17.527
    7   HG23  ILE  13          HG22      ILE  13   4.500   8.012 -17.841
    8   HG22  ILE  13          HG23      ILE  13   5.490   7.349 -19.140
    9   HD12  ILE  13          HD11      ILE  13   7.867   4.493 -18.646
   10   HD11  ILE  13          HD12      ILE  13   7.483   5.663 -17.389
   11   HD13  ILE  13          HD13      ILE  13   7.310   6.108 -19.082

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ASN  14           H        ASN  14   2.354   6.133 -16.063
    2    HA   ASN  14           HA       ASN  14   2.296   8.879 -15.424
    3    HB2  ASN  14           HB2      ASN  14   0.410   7.224 -16.245
    4    HB3  ASN  14           HB3      ASN  14   0.099   7.043 -14.523
    5   HD21  ASN  14          HD21      ASN  14  -1.936   8.186 -15.944
    6   HD22  ASN  14          HD22      ASN  14  -2.008   9.858 -15.676

  No H/Q in entry =           6
  In of MODEL   26
    1    H    SER  15           H        SER  15   2.033   5.999 -13.347
    2    HA   SER  15           HA       SER  15   1.730   7.366 -10.897
    3    HB2  SER  15           HB2      SER  15   2.304   5.284  -9.851
    4    HB3  SER  15           HB3      SER  15   1.462   4.861 -11.338
    5    HG   SER  15           HG       SER  15   4.071   5.205 -11.832

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLY  16           H        GLY  16   4.603   6.291 -12.672
    2    HA3  GLY  16           HA2      GLY  16   6.534   7.061 -10.752
    3    HA2  GLY  16           HA3      GLY  16   6.829   6.861 -12.477

  No H/Q in entry =           3
  In of MODEL   26
    1    H    GLN  17           H        GLN  17   5.119   8.806 -13.530
    2    HA   GLN  17           HA       GLN  17   6.680  11.160 -13.230
    3    HB2  GLN  17           HB2      GLN  17   3.929  10.707 -14.416
    4    HB3  GLN  17           HB3      GLN  17   4.770  12.256 -14.488
    5    HG2  GLN  17           HG2      GLN  17   6.636  11.228 -15.686
    6    HG3  GLN  17           HG3      GLN  17   5.878   9.643 -15.552
    7   HE21  GLN  17          HE21      GLN  17   6.294  12.150 -17.709
    8   HE22  GLN  17          HE22      GLN  17   4.909  11.919 -18.663

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ALA  18           H        ALA  18   3.595  10.117 -11.864
    2    HA   ALA  18           HA       ALA  18   2.858  12.500 -10.593
    3    HB1  ALA  18           HB1      ALA  18   1.747  10.034 -10.810
    4    HB2  ALA  18           HB2      ALA  18   1.195  11.249  -9.660
    5    HB3  ALA  18           HB3      ALA  18   2.299   9.976  -9.136

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ARG  19           H        ARG  19   4.761   9.752  -9.325
    2    HA   ARG  19           HA       ARG  19   5.298  10.913  -6.806
    3    HB2  ARG  19           HB2      ARG  19   5.729   8.514  -7.336
    4    HB3  ARG  19           HB3      ARG  19   7.075   9.012  -8.364
    5    HG2  ARG  19           HG2      ARG  19   8.197  10.060  -6.447
    6    HG3  ARG  19           HG3      ARG  19   6.830   9.660  -5.409
    7    HD2  ARG  19           HD2      ARG  19   8.607   8.040  -5.061
    8    HD3  ARG  19           HD3      ARG  19   7.235   7.246  -5.839
    9    HE   ARG  19           HE       ARG  19   8.922   8.080  -7.896
   10   HH21  ARG  19          HH11      ARG  19  10.490   6.688  -8.755
   11   HH22  ARG  19          HH12      ARG  19  11.052   5.345  -7.823
   12   HH11  ARG  19          HH21      ARG  19   9.026   6.049  -5.118
   13   HH12  ARG  19          HH22      ARG  19  10.220   4.983  -5.763

  No H/Q in entry =          13
  In of MODEL   26
    1    H    SER  20           H        SER  20   7.098  10.959  -9.864
    2    HA   SER  20           HA       SER  20   9.335  12.394  -9.052
    3    HB2  SER  20           HB2      SER  20   9.365  11.520 -11.257
    4    HB3  SER  20           HB3      SER  20   7.854  12.320 -11.676
    5    HG   SER  20           HG       SER  20  10.441  13.303 -11.572

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU  21           H        LEU  21   6.219  13.636 -10.232
    2    HA   LEU  21           HA       LEU  21   6.866  16.387 -10.011
    3    HB2  LEU  21           HB2      LEU  21   4.211  14.939  -9.917
    4    HB3  LEU  21           HB3      LEU  21   4.361  16.695  -9.921
    5    HG   LEU  21           HG       LEU  21   5.565  14.912 -12.059
    6   HD12  LEU  21          HD11      LEU  21   3.638  15.687 -13.458
    7   HD11  LEU  21          HD12      LEU  21   2.923  16.401 -12.012
    8   HD13  LEU  21          HD13      LEU  21   3.146  14.655 -12.115
    9   HD22  LEU  21          HD21      LEU  21   6.683  16.957 -12.249
   10   HD21  LEU  21          HD22      LEU  21   5.318  17.893 -11.647
   11   HD23  LEU  21          HD23      LEU  21   5.292  17.264 -13.286

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ALA  22           H        ALA  22   5.387  14.083  -7.755
    2    HA   ALA  22           HA       ALA  22   4.778  15.885  -5.684
    3    HB3  ALA  22           HB1      ALA  22   4.039  13.485  -5.844
    4    HB2  ALA  22           HB2      ALA  22   4.631  13.962  -4.252
    5    HB1  ALA  22           HB3      ALA  22   5.658  13.014  -5.329

  No H/Q in entry =           5
  In of MODEL   26
    1    H    TYR  23           H        TYR  23   7.729  13.888  -6.139
    2    HA   TYR  23           HA       TYR  23   9.114  14.920  -3.894
    3    HB2  TYR  23           HB2      TYR  23   9.915  12.920  -5.055
    4    HB3  TYR  23           HB3      TYR  23  10.209  13.861  -6.517
    5    HD1  TYR  23           HD1      TYR  23  11.194  13.551  -2.928
    6    HD2  TYR  23           HD2      TYR  23  12.236  15.039  -6.822
    7    HE1  TYR  23           HE1      TYR  23  13.452  14.152  -2.096
    8    HE2  TYR  23           HE2      TYR  23  14.492  15.642  -5.988
    9    HH   TYR  23           HH       TYR  23  15.664  14.578  -2.926

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ALA  24           H        ALA  24   8.902  16.026  -7.259
    2    HA   ALA  24           HA       ALA  24  10.777  18.130  -7.022
    3    HB2  ALA  24           HB1      ALA  24  10.322  18.188  -9.228
    4    HB3  ALA  24           HB2      ALA  24   8.761  18.922  -8.860
    5    HB1  ALA  24           HB3      ALA  24   8.904  17.170  -8.992

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA  25           H        ALA  25   7.304  17.909  -6.382
    2    HA   ALA  25           HA       ALA  25   6.798  20.622  -5.810
    3    HB1  ALA  25           HB1      ALA  25   5.157  18.606  -6.002
    4    HB2  ALA  25           HB2      ALA  25   4.782  19.890  -4.852
    5    HB3  ALA  25           HB3      ALA  25   5.491  18.376  -4.285

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU  26           H        LEU  26   7.907  17.953  -3.766
    2    HA   LEU  26           HA       LEU  26   8.009  19.385  -1.330
    3    HB2  LEU  26           HB2      LEU  26   8.131  16.970  -1.325
    4    HB3  LEU  26           HB3      LEU  26   9.596  16.994  -2.304
    5    HG   LEU  26           HG       LEU  26  10.808  18.126  -0.470
    6   HD12  LEU  26          HD11      LEU  26   9.594  18.119   1.796
    7   HD11  LEU  26          HD12      LEU  26   8.103  17.965   0.870
    8   HD13  LEU  26          HD13      LEU  26   9.131  19.382   0.655
    9   HD21  LEU  26          HD21      LEU  26   9.307  15.640   0.411
   10   HD23  LEU  26          HD22      LEU  26  10.820  16.220   1.100
   11   HD22  LEU  26          HD23      LEU  26  10.772  15.661  -0.570

  No H/Q in entry =          11
  In of MODEL   26
    1    H    LYS  27           H        LYS  27  10.418  18.840  -3.868
    2    HA   LYS  27           HA       LYS  27  12.594  20.106  -2.652
    3    HB2  LYS  27           HB2      LYS  27  12.700  18.761  -4.742
    4    HB3  LYS  27           HB3      LYS  27  11.915  20.084  -5.603
    5    HG2  LYS  27           HG2      LYS  27  13.766  21.591  -5.035
    6    HG3  LYS  27           HG3      LYS  27  14.546  20.308  -4.103
    7    HD2  LYS  27           HD2      LYS  27  14.695  18.922  -6.158
    8    HD3  LYS  27           HD3      LYS  27  13.959  20.232  -7.082
    9    HE2  LYS  27           HE2      LYS  27  15.832  21.720  -6.480
   10    HE3  LYS  27           HE3      LYS  27  16.572  20.414  -5.547
   11    HZ3  LYS  27           HZ1      LYS  27  17.549  20.526  -7.739
   12    HZ2  LYS  27           HZ2      LYS  27  16.020  20.389  -8.471
   13    HZ1  LYS  27           HZ3      LYS  27  16.663  19.086  -7.590

  No H/Q in entry =          13
  In of MODEL   26
    1    H    GLN  28           H        GLN  28   9.945  21.457  -4.586
    2    HA   GLN  28           HA       GLN  28  10.872  24.121  -4.744
    3    HB2  GLN  28           HB2      GLN  28   8.051  23.019  -4.614
    4    HB3  GLN  28           HB3      GLN  28   8.444  24.695  -4.996
    5    HG2  GLN  28           HG2      GLN  28   9.442  22.283  -6.540
    6    HG3  GLN  28           HG3      GLN  28   8.111  23.323  -7.043
    7   HE21  GLN  28          HE21      GLN  28  11.257  22.815  -7.762
    8   HE22  GLN  28          HE22      GLN  28  11.744  24.397  -8.140

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ALA  29           H        ALA  29   8.974  22.405  -2.297
    2    HA   ALA  29           HA       ALA  29   8.407  24.590  -0.612
    3    HB2  ALA  29           HB1      ALA  29   7.706  23.013   0.960
    4    HB1  ALA  29           HB2      ALA  29   8.939  21.844   0.488
    5    HB3  ALA  29           HB3      ALA  29   7.544  22.120  -0.552

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LYS  30           H        LYS  30  11.165  22.357  -0.697
    2    HA   LYS  30           HA       LYS  30  12.484  23.327   1.599
    3    HB2  LYS  30           HB2      LYS  30  13.582  22.055  -0.918
    4    HB3  LYS  30           HB3      LYS  30  14.568  22.426   0.498
    5    HG2  LYS  30           HG2      LYS  30  13.039  21.024   1.887
    6    HG3  LYS  30           HG3      LYS  30  12.151  20.591   0.422
    7    HD2  LYS  30           HD2      LYS  30  14.203  19.630  -0.551
    8    HD3  LYS  30           HD3      LYS  30  15.110  20.077   0.896
    9    HE2  LYS  30           HE2      LYS  30  13.630  18.627   2.259
   10    HE3  LYS  30           HE3      LYS  30  12.754  18.161   0.796
   11    HZ2  LYS  30           HZ1      LYS  30  14.569  16.605   1.546
   12    HZ1  LYS  30           HZ2      LYS  30  15.689  17.806   1.089
   13    HZ3  LYS  30           HZ3      LYS  30  14.655  17.110  -0.070

  No H/Q in entry =          13
  In of MODEL   26
    1    H    GLN  31           H        GLN  31  12.341  24.530  -1.697
    2    HA   GLN  31           HA       GLN  31  14.473  26.450  -1.288
    3    HB2  GLN  31           HB2      GLN  31  12.417  26.472  -3.501
    4    HB3  GLN  31           HB3      GLN  31  14.028  27.187  -3.511
    5    HG2  GLN  31           HG2      GLN  31  14.527  24.497  -2.938
    6    HG3  GLN  31           HG3      GLN  31  13.217  24.427  -4.109
    7   HE21  GLN  31          HE21      GLN  31  16.068  23.669  -4.529
    8   HE22  GLN  31          HE22      GLN  31  16.621  24.650  -5.799

  No H/Q in entry =           8
  In of MODEL   26
    1    H    GLY  32           H        GLY  32  11.407  26.230  -0.125
    2    HA3  GLY  32           HA2      GLY  32  10.239  27.783   1.155
    3    HA2  GLY  32           HA3      GLY  32  11.345  29.033   0.599

  No H/Q in entry =           3
  In of MODEL   26
    1    H    ASP  33           H        ASP  33   9.991  27.112  -1.886
    2    HA   ASP  33           HA       ASP  33   8.293  29.364  -2.732
    3    HB2  ASP  33           HB2      ASP  33   9.409  26.958  -4.181
    4    HB3  ASP  33           HB3      ASP  33   8.239  28.059  -4.905

  No H/Q in entry =           4
  In of MODEL   26
    1    H    PHE  34           H        PHE  34   6.620  28.867  -1.159
    2    HA   PHE  34           HA       PHE  34   5.272  26.377  -1.056
    3    HB2  PHE  34           HB2      PHE  34   4.280  29.152  -0.370
    4    HB3  PHE  34           HB3      PHE  34   3.452  27.651   0.046
    5    HD1  PHE  34           HD1      PHE  34   5.679  30.078   1.248
    6    HD2  PHE  34           HD2      PHE  34   5.052  25.829   1.198
    7    HE1  PHE  34           HE1      PHE  34   7.084  29.845   3.276
    8    HE2  PHE  34           HE2      PHE  34   6.459  25.600   3.224
    9    HZ   PHE  34           HZ       PHE  34   7.469  27.609   4.263

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ALA  35           H        ALA  35   4.794  29.236  -3.064
    2    HA   ALA  35           HA       ALA  35   2.245  28.589  -4.075
    3    HB3  ALA  35           HB1      ALA  35   3.268  29.995  -6.118
    4    HB2  ALA  35           HB2      ALA  35   4.488  30.371  -4.901
    5    HB1  ALA  35           HB3      ALA  35   2.794  30.759  -4.601

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA  36           H        ALA  36   5.474  27.957  -5.447
    2    HA   ALA  36           HA       ALA  36   4.491  26.515  -7.685
    3    HB3  ALA  36           HB1      ALA  36   6.645  26.667  -8.313
    4    HB2  ALA  36           HB2      ALA  36   7.147  25.644  -6.965
    5    HB1  ALA  36           HB3      ALA  36   7.020  27.391  -6.749

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA  37           H        ALA  37   5.478  25.533  -4.436
    2    HA   ALA  37           HA       ALA  37   5.452  22.744  -4.865
    3    HB2  ALA  37           HB1      ALA  37   5.182  24.532  -2.485
    4    HB1  ALA  37           HB2      ALA  37   6.330  23.229  -2.784
    5    HB3  ALA  37           HB3      ALA  37   4.676  22.854  -2.303

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LYS  38           H        LYS  38   2.898  24.920  -3.682
    2    HA   LYS  38           HA       LYS  38   0.823  23.081  -3.448
    3    HB2  LYS  38           HB2      LYS  38   1.141  25.841  -3.199
    4    HB3  LYS  38           HB3      LYS  38  -0.064  25.679  -4.471
    5    HG2  LYS  38           HG2      LYS  38  -1.488  24.337  -3.020
    6    HG3  LYS  38           HG3      LYS  38  -0.236  24.293  -1.771
    7    HD2  LYS  38           HD2      LYS  38  -0.449  26.627  -1.322
    8    HD3  LYS  38           HD3      LYS  38  -1.373  26.904  -2.799
    9    HE2  LYS  38           HE2      LYS  38  -2.866  26.919  -0.851
   10    HE3  LYS  38           HE3      LYS  38  -3.228  25.538  -1.891
   11    HZ3  LYS  38           HZ1      LYS  38  -2.475  24.077  -0.363
   12    HZ2  LYS  38           HZ2      LYS  38  -2.836  25.329   0.729
   13    HZ1  LYS  38           HZ3      LYS  38  -1.241  25.099   0.195

  No H/Q in entry =          13
  In of MODEL   26
    1    H    ALA  39           H        ALA  39   1.762  24.995  -6.302
    2    HA   ALA  39           HA       ALA  39  -0.312  24.102  -7.993
    3    HB2  ALA  39           HB1      ALA  39   2.410  24.785  -9.062
    4    HB1  ALA  39           HB2      ALA  39   1.432  26.033  -8.292
    5    HB3  ALA  39           HB3      ALA  39   0.822  25.189  -9.714

  No H/Q in entry =           5
  In of MODEL   26
    1    H    MET  40           H        MET  40   2.945  22.844  -7.432
    2    HA   MET  40           HA       MET  40   2.862  20.823  -9.423
    3    HB2  MET  40           HB2      MET  40   4.485  21.067  -6.884
    4    HB3  MET  40           HB3      MET  40   4.745  19.814  -8.100
    5    HG2  MET  40           HG2      MET  40   4.761  22.771  -8.765
    6    HG3  MET  40           HG3      MET  40   6.221  21.887  -8.324
    7    HE3  MET  40           HE1      MET  40   7.106  19.683 -11.138
    8    HE2  MET  40           HE2      MET  40   6.556  19.357  -9.497
    9    HE1  MET  40           HE3      MET  40   7.632  20.718  -9.803

  No H/Q in entry =           9
  In of MODEL   26
    1    H    MET  41           H        MET  41   1.966  20.853  -5.994
    2    HA   MET  41           HA       MET  41   1.471  18.082  -5.713
    3    HB2  MET  41           HB2      MET  41   0.116  20.422  -4.355
    4    HB3  MET  41           HB3      MET  41  -0.015  18.742  -3.846
    5    HG2  MET  41           HG2      MET  41   2.692  19.001  -3.899
    6    HG3  MET  41           HG3      MET  41   2.232  20.653  -3.500
    7    HE2  MET  41           HE1      MET  41  -0.781  19.361  -1.758
    8    HE1  MET  41           HE2      MET  41   0.013  20.884  -2.139
    9    HE3  MET  41           HE3      MET  41  -0.029  20.313  -0.471

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ASP  42           H        ASP  42  -0.608  20.780  -6.676
    2    HA   ASP  42           HA       ASP  42  -3.031  19.387  -6.799
    3    HB2  ASP  42           HB2      ASP  42  -2.360  21.967  -7.059
    4    HB3  ASP  42           HB3      ASP  42  -2.515  21.570  -8.767

  No H/Q in entry =           4
  In of MODEL   26
    1    H    GLN  43           H        GLN  43  -0.613  20.011  -9.314
    2    HA   GLN  43           HA       GLN  43  -1.994  18.673 -11.396
    3    HB2  GLN  43           HB2      GLN  43   0.959  19.228 -11.031
    4    HB3  GLN  43           HB3      GLN  43   0.246  18.579 -12.509
    5    HG2  GLN  43           HG2      GLN  43  -1.293  20.586 -12.542
    6    HG3  GLN  43           HG3      GLN  43  -0.341  21.254 -11.219
    7   HE21  GLN  43          HE21      GLN  43  -0.213  22.877 -13.306
    8   HE22  GLN  43          HE22      GLN  43   1.199  22.674 -14.222

  No H/Q in entry =           8
  In of MODEL   26
    1    H    SER  44           H        SER  44   0.385  17.564  -9.019
    2    HA   SER  44           HA       SER  44   0.749  14.962 -10.046
    3    HB2  SER  44           HB2      SER  44   1.637  16.413  -7.814
    4    HB3  SER  44           HB3      SER  44   0.797  15.018  -7.139
    5    HG   SER  44           HG       SER  44   2.913  14.426  -7.577

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ARG  45           H        ARG  45  -1.575  16.249  -7.695
    2    HA   ARG  45           HA       ARG  45  -2.926  13.870  -7.052
    3    HB2  ARG  45           HB2      ARG  45  -3.147  16.035  -5.859
    4    HB3  ARG  45           HB3      ARG  45  -4.020  16.690  -7.241
    5    HG2  ARG  45           HG2      ARG  45  -5.761  14.941  -6.948
    6    HG3  ARG  45           HG3      ARG  45  -4.900  14.340  -5.530
    7    HD2  ARG  45           HD2      ARG  45  -5.132  16.604  -4.473
    8    HD3  ARG  45           HD3      ARG  45  -6.133  17.110  -5.849
    9    HE   ARG  45           HE       ARG  45  -7.205  14.719  -4.803
   10   HH21  ARG  45          HH11      ARG  45  -9.035  14.770  -3.522
   11   HH22  ARG  45          HH12      ARG  45  -9.445  16.204  -2.651
   12   HH11  ARG  45          HH21      ARG  45  -6.698  17.973  -3.782
   13   HH12  ARG  45          HH22      ARG  45  -8.116  18.018  -2.796

  No H/Q in entry =          13
  In of MODEL   26
    1    H    MET  46           H        MET  46  -3.558  16.266  -9.599
    2    HA   MET  46           HA       MET  46  -5.886  15.061 -10.648
    3    HB2  MET  46           HB2      MET  46  -3.818  16.919 -11.831
    4    HB3  MET  46           HB3      MET  46  -5.192  16.341 -12.776
    5    HG2  MET  46           HG2      MET  46  -6.747  17.246 -11.116
    6    HG3  MET  46           HG3      MET  46  -5.403  17.770 -10.109
    7    HE3  MET  46           HE1      MET  46  -5.789  18.368 -14.313
    8    HE2  MET  46           HE2      MET  46  -7.152  19.401 -13.897
    9    HE1  MET  46           HE3      MET  46  -7.107  17.737 -13.317

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ALA  47           H        ALA  47  -2.456  14.630 -11.425
    2    HA   ALA  47           HA       ALA  47  -2.789  12.898 -13.634
    3    HB3  ALA  47           HB1      ALA  47  -0.622  13.818 -13.294
    4    HB2  ALA  47           HB2      ALA  47  -0.455  12.092 -12.961
    5    HB1  ALA  47           HB3      ALA  47  -0.556  13.242 -11.627

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU  48           H        LEU  48  -2.491  12.266 -10.161
    2    HA   LEU  48           HA       LEU  48  -2.546   9.425 -10.319
    3    HB2  LEU  48           HB2      LEU  48  -3.325  11.332  -8.101
    4    HB3  LEU  48           HB3      LEU  48  -3.205   9.583  -7.901
    5    HG   LEU  48           HG       LEU  48  -0.936  11.315  -8.911
    6   HD13  LEU  48          HD11      LEU  48  -1.218  12.081  -6.719
    7   HD12  LEU  48          HD12      LEU  48  -0.035  10.790  -6.527
    8   HD11  LEU  48          HD13      LEU  48  -1.727  10.503  -6.120
    9   HD22  LEU  48          HD21      LEU  48  -0.410   9.136  -9.555
   10   HD21  LEU  48          HD22      LEU  48  -1.262   8.409  -8.194
   11   HD23  LEU  48          HD23      LEU  48   0.301   9.184  -7.942

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ASN  49           H        ASN  49  -5.042  11.882  -9.904
    2    HA   ASN  49           HA       ASN  49  -7.201  10.187  -9.353
    3    HB2  ASN  49           HB2      ASN  49  -7.296  12.605  -9.027
    4    HB3  ASN  49           HB3      ASN  49  -7.139  12.873 -10.757
    5   HD21  ASN  49          HD21      ASN  49  -9.352  13.959  -9.512
    6   HD22  ASN  49          HD22      ASN  49 -10.748  13.091  -9.926

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLU  50           H        GLU  50  -5.956  11.401 -12.447
    2    HA   GLU  50           HA       GLU  50  -7.901  10.118 -14.082
    3    HB2  GLU  50           HB2      GLU  50  -6.465  11.958 -14.904
    4    HB3  GLU  50           HB3      GLU  50  -5.056  10.906 -14.774
    5    HG2  GLU  50           HG2      GLU  50  -6.016   9.356 -16.405
    6    HG3  GLU  50           HG3      GLU  50  -7.491  10.314 -16.485

  No H/Q in entry =           6
  In of MODEL   26
    1    H    ALA  51           H        ALA  51  -4.710   9.171 -12.894
    2    HA   ALA  51           HA       ALA  51  -4.544   6.720 -14.313
    3    HB2  ALA  51           HB1      ALA  51  -2.553   6.461 -13.223
    4    HB1  ALA  51           HB2      ALA  51  -3.238   6.873 -11.652
    5    HB3  ALA  51           HB3      ALA  51  -2.807   8.150 -12.789

  No H/Q in entry =           5
  In of MODEL   26
    1    H    HIS  52           H        HIS  52  -5.711   7.536 -11.057
    2    HA   HIS  52           HA       HIS  52  -6.355   4.916 -10.222
    3    HB2  HIS  52           HB2      HIS  52  -6.240   6.811  -8.672
    4    HB3  HIS  52           HB3      HIS  52  -7.635   7.550  -9.457
    5    HD1  HIS  52           HD1      HIS  52  -9.907   6.056  -9.374
    6    HD2  HIS  52           HD2      HIS  52  -6.906   4.989  -6.686
    7    HE1  HIS  52           HE1      HIS  52 -11.007   4.610  -7.610
    8    HE2  HIS  52           HE2      HIS  52  -9.190   3.951  -5.963

  No H/Q in entry =           8
  In of MODEL   26
    1    H    LEU  53           H        LEU  53  -8.219   7.349 -12.001
    2    HA   LEU  53           HA       LEU  53 -10.706   6.022 -12.000
    3    HB2  LEU  53           HB2      LEU  53  -9.461   8.014 -13.887
    4    HB3  LEU  53           HB3      LEU  53 -11.060   7.335 -14.183
    5    HG   LEU  53           HG       LEU  53 -10.316   8.663 -11.557
    6   HD13  LEU  53          HD11      LEU  53 -10.059  10.314 -13.345
    7   HD12  LEU  53          HD12      LEU  53 -11.533  10.650 -12.434
    8   HD11  LEU  53          HD13      LEU  53 -11.626   9.869 -14.010
    9   HD21  LEU  53          HD21      LEU  53 -12.885   7.750 -12.858
   10   HD23  LEU  53          HD22      LEU  53 -12.901   9.036 -11.658
   11   HD22  LEU  53          HD23      LEU  53 -12.327   7.439 -11.220

  No H/Q in entry =          11
  In of MODEL   26
    1    H    VAL  54           H        VAL  54  -7.965   5.863 -14.251
    2    HA   VAL  54           HA       VAL  54  -9.173   4.075 -16.089
    3    HB   VAL  54           HB       VAL  54  -6.269   4.621 -15.421
    4   HG12  VAL  54          HG11      VAL  54  -6.019   3.539 -17.811
    5   HG11  VAL  54          HG12      VAL  54  -7.535   2.738 -17.400
    6   HG13  VAL  54          HG13      VAL  54  -6.111   2.503 -16.389
    7   HG22  VAL  54          HG21      VAL  54  -7.070   6.554 -16.462
    8   HG21  VAL  54          HG22      VAL  54  -8.256   5.674 -17.424
    9   HG23  VAL  54          HG23      VAL  54  -6.551   5.617 -17.863

  No H/Q in entry =           9
  In of MODEL   26
    1    H    GLN  55           H        GLN  55  -7.152   3.556 -13.199
    2    HA   GLN  55           HA       GLN  55  -7.025   0.741 -13.456
    3    HB2  GLN  55           HB2      GLN  55  -5.474   1.657 -11.945
    4    HB3  GLN  55           HB3      GLN  55  -6.699   2.607 -11.109
    5    HG2  GLN  55           HG2      GLN  55  -7.358   0.841  -9.788
    6    HG3  GLN  55           HG3      GLN  55  -7.124  -0.343 -11.067
    7   HE21  GLN  55          HE21      GLN  55  -5.478  -1.771 -10.581
    8   HE22  GLN  55          HE22      GLN  55  -4.094  -1.401  -9.676

  No H/Q in entry =           8
  In of MODEL   26
    1    H    THR  56           H        THR  56  -9.377   2.872 -11.830
    2    HA   THR  56           HA       THR  56 -10.930   0.968 -10.532
    3    HB   THR  56           HB       THR  56 -12.062   3.342 -12.033
    4    HG1  THR  56           HG1      THR  56 -10.550   3.137  -9.680
    5   HG22  THR  56          HG21      THR  56 -12.909   2.076  -9.420
    6   HG21  THR  56          HG22      THR  56 -13.622   1.655 -10.977
    7   HG23  THR  56          HG23      THR  56 -13.779   3.296 -10.349

  No H/Q in entry =           7
  In of MODEL   26
    1    H    LYS  57           H        LYS  57 -11.163   2.048 -13.917
    2    HA   LYS  57           HA       LYS  57 -13.300   0.333 -14.660
    3    HB2  LYS  57           HB2      LYS  57 -12.457   2.295 -15.982
    4    HB3  LYS  57           HB3      LYS  57 -11.007   1.375 -16.355
    5    HG2  LYS  57           HG2      LYS  57 -12.338  -0.317 -17.518
    6    HG3  LYS  57           HG3      LYS  57 -13.824   0.527 -17.093
    7    HD2  LYS  57           HD2      LYS  57 -13.068   2.499 -18.392
    8    HD3  LYS  57           HD3      LYS  57 -11.599   1.634 -18.841
    9    HE2  LYS  57           HE2      LYS  57 -12.959  -0.106 -19.961
   10    HE3  LYS  57           HE3      LYS  57 -14.435   0.750 -19.520
   11    HZ3  LYS  57           HZ1      LYS  57 -14.117   1.628 -21.556
   12    HZ2  LYS  57           HZ2      LYS  57 -12.432   1.406 -21.529
   13    HZ1  LYS  57           HZ3      LYS  57 -13.134   2.710 -20.693

  No H/Q in entry =          13
  In of MODEL   26
    1    H    LEU  58           H        LEU  58  -9.790  -0.052 -14.620
    2    HA   LEU  58           HA       LEU  58  -9.772  -2.570 -15.908
    3    HB2  LEU  58           HB2      LEU  58  -7.746  -1.251 -14.110
    4    HB3  LEU  58           HB3      LEU  58  -7.469  -2.769 -14.965
    5    HG   LEU  58           HG       LEU  58  -8.264  -0.175 -16.326
    6   HD11  LEU  58          HD11      LEU  58  -5.598  -1.377 -15.647
    7   HD13  LEU  58          HD12      LEU  58  -6.115   0.308 -15.596
    8   HD12  LEU  58          HD13      LEU  58  -5.773  -0.460 -17.144
    9   HD22  LEU  58          HD21      LEU  58  -8.827  -1.745 -17.913
   10   HD21  LEU  58          HD22      LEU  58  -7.766  -2.978 -17.237
   11   HD23  LEU  58          HD23      LEU  58  -7.097  -1.696 -18.246

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  59           H        ILE  59 -10.589  -1.677 -12.654
    2    HA   ILE  59           HA       ILE  59 -10.197  -4.439 -11.707
    3    HB   ILE  59           HB       ILE  59  -9.778  -2.164 -10.312
    4   HG12  ILE  59          HG12      ILE  59 -11.101  -4.539  -8.982
    5   HG13  ILE  59          HG13      ILE  59  -9.460  -4.588  -9.573
    6   HG21  ILE  59          HG21      ILE  59 -12.315  -1.675 -10.546
    7   HG23  ILE  59          HG22      ILE  59 -11.606  -1.514  -8.956
    8   HG22  ILE  59          HG23      ILE  59 -12.537  -2.950  -9.372
    9   HD12  ILE  59          HD11      ILE  59 -10.536  -2.636  -7.549
   10   HD11  ILE  59          HD12      ILE  59  -8.887  -2.636  -8.160
   11   HD13  ILE  59          HD13      ILE  59  -9.470  -3.992  -7.195

  No H/Q in entry =          11
  In of MODEL   26
    1    H    GLU  60           H        GLU  60 -12.789  -2.158 -12.504
    2    HA   GLU  60           HA       GLU  60 -14.949  -3.703 -11.480
    3    HB2  GLU  60           HB2      GLU  60 -15.184  -1.329 -12.082
    4    HB3  GLU  60           HB3      GLU  60 -14.888  -1.719 -13.773
    5    HG2  GLU  60           HG2      GLU  60 -17.117  -3.099 -12.303
    6    HG3  GLU  60           HG3      GLU  60 -17.360  -1.484 -12.934

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLY  61           H        GLY  61 -13.291  -3.667 -14.603
    2    HA3  GLY  61           HA2      GLY  61 -14.977  -5.935 -15.484
    3    HA2  GLY  61           HA3      GLY  61 -14.152  -4.819 -16.566

  No H/Q in entry =           3
  In of MODEL   26
    1    H    ASP  62           H        ASP  62 -12.748  -6.250 -13.688
    2    HA   ASP  62           HA       ASP  62 -10.424  -7.103 -15.070
    3    HB2  ASP  62           HB2      ASP  62  -9.847  -8.143 -12.889
    4    HB3  ASP  62           HB3      ASP  62 -10.364  -6.469 -12.723

  No H/Q in entry =           4
  In of MODEL   26
    1    H    ALA  63           H        ALA  63 -13.397  -8.826 -14.145
    2    HA   ALA  63           HA       ALA  63 -12.551 -11.492 -14.461
    3    HB1  ALA  63           HB1      ALA  63 -15.236 -10.379 -15.339
    4    HB2  ALA  63           HB2      ALA  63 -14.820 -10.643 -13.647
    5    HB3  ALA  63           HB3      ALA  63 -14.890 -12.009 -14.762

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLY  64           H        GLY  64 -13.927  -9.247 -16.835
    2    HA3  GLY  64           HA2      GLY  64 -13.870  -9.180 -19.123
    3    HA2  GLY  64           HA3      GLY  64 -12.336 -10.031 -19.005

  No H/Q in entry =           3
  In of MODEL   26
    1    H    GLU  65           H        GLU  65 -13.148 -11.038 -21.050
    2    HA   GLU  65           HA       GLU  65 -15.402 -12.747 -21.029
    3    HB2  GLU  65           HB2      GLU  65 -12.969 -12.745 -22.817
    4    HB3  GLU  65           HB3      GLU  65 -14.423 -13.702 -23.104
    5    HG2  GLU  65           HG2      GLU  65 -14.384 -10.685 -22.813
    6    HG3  GLU  65           HG3      GLU  65 -14.432 -11.542 -24.353

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLY  66           H        GLY  66 -12.038 -13.282 -20.345
    2    HA3  GLY  66           HA2      GLY  66 -11.821 -16.034 -20.303
    3    HA2  GLY  66           HA3      GLY  66 -10.886 -14.941 -19.303

  No H/Q in entry =           3
  In of MODEL   26
    1    H    LYS  67           H        LYS  67 -10.957 -16.829 -17.867
    2    HA   LYS  67           HA       LYS  67 -13.338 -17.734 -16.662
    3    HB2  LYS  67           HB2      LYS  67 -10.448 -17.935 -15.832
    4    HB3  LYS  67           HB3      LYS  67 -11.767 -18.759 -14.991
    5    HG2  LYS  67           HG2      LYS  67 -12.436 -19.862 -17.087
    6    HG3  LYS  67           HG3      LYS  67 -11.145 -19.028 -17.949
    7    HD2  LYS  67           HD2      LYS  67  -9.474 -20.150 -16.497
    8    HD3  LYS  67           HD3      LYS  67 -10.782 -21.022 -15.695
    9    HE2  LYS  67           HE2      LYS  67 -10.246 -21.135 -18.678
   10    HE3  LYS  67           HE3      LYS  67  -9.682 -22.347 -17.525
   11    HZ3  LYS  67           HZ1      LYS  67 -11.649 -23.318 -17.686
   12    HZ2  LYS  67           HZ2      LYS  67 -12.221 -22.095 -18.715
   13    HZ1  LYS  67           HZ3      LYS  67 -12.385 -21.938 -17.032

  No H/Q in entry =          13
  In of MODEL   26
    1    H    MET  68           H        MET  68 -12.935 -17.849 -14.028
    2    HA   MET  68           HA       MET  68 -14.153 -15.521 -13.042
    3    HB2  MET  68           HB2      MET  68 -12.776 -17.775 -11.577
    4    HB3  MET  68           HB3      MET  68 -13.821 -16.569 -10.825
    5    HG2  MET  68           HG2      MET  68 -14.662 -18.430 -13.068
    6    HG3  MET  68           HG3      MET  68 -15.045 -18.667 -11.361
    7    HE1  MET  68           HE1      MET  68 -16.207 -17.311  -9.948
    8    HE3  MET  68           HE2      MET  68 -17.485 -16.162 -10.339
    9    HE2  MET  68           HE3      MET  68 -15.810 -15.617 -10.278

  No H/Q in entry =           9
  In of MODEL   26
    1    H    LYS  69           H        LYS  69 -10.732 -16.547 -12.813
    2    HA   LYS  69           HA       LYS  69  -9.829 -14.769 -10.922
    3    HB2  LYS  69           HB2      LYS  69  -8.437 -15.877 -13.356
    4    HB3  LYS  69           HB3      LYS  69  -7.597 -14.967 -12.098
    5    HG2  LYS  69           HG2      LYS  69  -8.377 -16.577 -10.400
    6    HG3  LYS  69           HG3      LYS  69  -9.237 -17.480 -11.646
    7    HD2  LYS  69           HD2      LYS  69  -7.083 -17.899 -12.806
    8    HD3  LYS  69           HD3      LYS  69  -6.239 -17.048 -11.512
    9    HE2  LYS  69           HE2      LYS  69  -7.955 -19.522 -11.150
   10    HE3  LYS  69           HE3      LYS  69  -6.193 -19.495 -11.152
   11    HZ1  LYS  69           HZ1      LYS  69  -6.481 -17.755  -9.308
   12    HZ3  LYS  69           HZ2      LYS  69  -6.730 -19.390  -8.921
   13    HZ2  LYS  69           HZ3      LYS  69  -8.059 -18.361  -9.170

  No H/Q in entry =          13
  In of MODEL   26
    1    H    VAL  70           H        VAL  70  -7.810 -13.172 -11.817
    2    HA   VAL  70           HA       VAL  70  -9.093 -11.092 -13.489
    3    HB   VAL  70           HB       VAL  70  -8.205  -9.394 -11.929
    4   HG12  VAL  70          HG11      VAL  70  -9.778  -9.927 -10.025
    5   HG11  VAL  70          HG12      VAL  70 -10.005 -11.523 -10.742
    6   HG13  VAL  70          HG13      VAL  70 -10.506 -10.080 -11.624
    7   HG22  VAL  70          HG21      VAL  70  -6.318 -10.694 -11.003
    8   HG21  VAL  70          HG22      VAL  70  -7.453 -11.807 -10.243
    9   HG23  VAL  70          HG23      VAL  70  -7.361 -10.135  -9.696

  No H/Q in entry =           9
  In of MODEL   26
    1    H    SER  71           H        SER  71  -7.514  -9.512 -14.313
    2    HA   SER  71           HA       SER  71  -5.298 -10.732 -15.583
    3    HB2  SER  71           HB2      SER  71  -6.462  -8.715 -16.457
    4    HB3  SER  71           HB3      SER  71  -5.816  -7.785 -15.107
    5    HG   SER  71           HG       SER  71  -4.339  -9.173 -17.101

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU  72           H        LEU  72  -3.237 -10.965 -14.980
    2    HA   LEU  72           HA       LEU  72  -2.507 -10.739 -12.272
    3    HB2  LEU  72           HB2      LEU  72  -0.852 -11.143 -14.760
    4    HB3  LEU  72           HB3      LEU  72  -0.192 -11.218 -13.130
    5    HG   LEU  72           HG       LEU  72  -2.528 -12.927 -14.043
    6   HD13  LEU  72          HD11      LEU  72  -0.689 -13.614 -15.407
    7   HD12  LEU  72          HD12      LEU  72  -0.737 -14.756 -14.064
    8   HD11  LEU  72          HD13      LEU  72   0.451 -13.452 -14.069
    9   HD22  LEU  72          HD21      LEU  72  -2.528 -12.954 -11.694
   10   HD21  LEU  72          HD22      LEU  72  -0.780 -12.812 -11.580
   11   HD23  LEU  72          HD23      LEU  72  -1.509 -14.338 -12.073

  No H/Q in entry =          11
  In of MODEL   26
    1    H    VAL  73           H        VAL  73  -1.829  -8.716 -15.057
    2    HA   VAL  73           HA       VAL  73   0.075  -6.993 -13.964
    3    HB   VAL  73           HB       VAL  73  -0.348  -5.579 -15.819
    4   HG11  VAL  73          HG11      VAL  73   0.538  -7.875 -16.310
    5   HG13  VAL  73          HG12      VAL  73  -0.329  -7.154 -17.664
    6   HG12  VAL  73          HG13      VAL  73  -1.110  -8.385 -16.674
    7   HG21  VAL  73          HG21      VAL  73  -3.091  -6.780 -15.646
    8   HG23  VAL  73          HG22      VAL  73  -2.511  -6.204 -17.208
    9   HG22  VAL  73          HG23      VAL  73  -2.623  -5.091 -15.845

  No H/Q in entry =           9
  In of MODEL   26
    1    H    LEU  74           H        LEU  74  -3.318  -7.150 -13.390
    2    HA   LEU  74           HA       LEU  74  -3.966  -4.502 -12.777
    3    HB2  LEU  74           HB2      LEU  74  -5.679  -6.180 -12.940
    4    HB3  LEU  74           HB3      LEU  74  -4.967  -7.107 -11.622
    5    HG   LEU  74           HG       LEU  74  -5.437  -5.248 -10.061
    6   HD12  LEU  74          HD11      LEU  74  -7.041  -3.465 -10.985
    7   HD11  LEU  74          HD12      LEU  74  -6.507  -3.974 -12.585
    8   HD13  LEU  74          HD13      LEU  74  -5.344  -3.307 -11.439
    9   HD21  LEU  74          HD21      LEU  74  -7.125  -7.101 -10.909
   10   HD23  LEU  74          HD22      LEU  74  -7.971  -5.693 -11.510
   11   HD22  LEU  74          HD23      LEU  74  -7.642  -5.835  -9.800

  No H/Q in entry =          11
  In of MODEL   26
    1    H    VAL  75           H        VAL  75  -2.883  -7.074 -10.618
    2    HA   VAL  75           HA       VAL  75  -2.693  -5.518  -8.277
    3    HB   VAL  75           HB       VAL  75  -1.176  -7.998  -9.075
    4   HG13  VAL  75          HG11      VAL  75   0.090  -6.751  -7.358
    5   HG12  VAL  75          HG12      VAL  75  -0.695  -8.138  -6.617
    6   HG11  VAL  75          HG13      VAL  75  -1.380  -6.534  -6.411
    7   HG22  VAL  75          HG21      VAL  75  -2.809  -9.082  -7.594
    8   HG21  VAL  75          HG22      VAL  75  -3.659  -8.182  -8.851
    9   HG23  VAL  75          HG23      VAL  75  -3.539  -7.520  -7.219

  No H/Q in entry =           9
  In of MODEL   26
    1    H    GLU  76           H        GLU  76  -0.287  -6.251 -10.823
    2    HA   GLU  76           HA       GLU  76   1.887  -4.875  -9.677
    3    HB2  GLU  76           HB2      GLU  76   2.054  -6.361 -11.678
    4    HB3  GLU  76           HB3      GLU  76   1.189  -5.159 -12.622
    5    HG2  GLU  76           HG2      GLU  76   2.998  -3.534 -12.259
    6    HG3  GLU  76           HG3      GLU  76   3.877  -4.684 -11.271

  No H/Q in entry =           6
  In of MODEL   26
    1    H    ALA  77           H        ALA  77  -0.669  -3.707 -11.855
    2    HA   ALA  77           HA       ALA  77   0.287  -1.049 -12.038
    3    HB3  ALA  77           HB1      ALA  77  -2.627  -1.826 -12.173
    4    HB1  ALA  77           HB2      ALA  77  -1.500  -2.209 -13.474
    5    HB2  ALA  77           HB3      ALA  77  -1.798  -0.528 -13.035

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLN  78           H        GLN  78  -1.952  -2.631  -9.815
    2    HA   GLN  78           HA       GLN  78  -2.781  -0.322  -8.412
    3    HB2  GLN  78           HB2      GLN  78  -3.797  -2.669  -8.350
    4    HB3  GLN  78           HB3      GLN  78  -2.503  -3.091  -7.232
    5    HG2  GLN  78           HG2      GLN  78  -3.230  -1.416  -5.657
    6    HG3  GLN  78           HG3      GLN  78  -4.409  -0.779  -6.802
    7   HE21  GLN  78          HE21      GLN  78  -5.854  -2.843  -7.707
    8   HE22  GLN  78          HE22      GLN  78  -6.509  -3.780  -6.452

  No H/Q in entry =           8
  In of MODEL   26
    1    H    LEU  79           H        LEU  79  -0.072  -2.542  -7.972
    2    HA   LEU  79           HA       LEU  79   0.903  -1.631  -5.520
    3    HB2  LEU  79           HB2      LEU  79   1.794  -3.629  -6.590
    4    HB3  LEU  79           HB3      LEU  79   2.422  -2.670  -7.927
    5    HG   LEU  79           HG       LEU  79   3.969  -1.509  -6.431
    6   HD13  LEU  79          HD11      LEU  79   2.971  -1.276  -4.360
    7   HD12  LEU  79          HD12      LEU  79   4.068  -2.611  -4.019
    8   HD11  LEU  79          HD13      LEU  79   2.366  -2.933  -4.341
    9   HD23  LEU  79          HD21      LEU  79   5.212  -3.640  -5.531
   10   HD22  LEU  79          HD22      LEU  79   4.999  -3.446  -7.268
   11   HD21  LEU  79          HD23      LEU  79   3.939  -4.529  -6.371

  No H/Q in entry =          11
  In of MODEL   26
    1    H    HIS  80           H        HIS  80   1.744  -0.505  -8.797
    2    HA   HIS  80           HA       HIS  80   3.529   1.507  -7.885
    3    HB2  HIS  80           HB2      HIS  80   2.237   0.793 -10.461
    4    HB3  HIS  80           HB3      HIS  80   2.810   2.453 -10.294
    5    HD1  HIS  80           HD1      HIS  80   5.205   2.786 -10.827
    6    HD2  HIS  80           HD2      HIS  80   4.445  -1.135  -9.629
    7    HE1  HIS  80           HE1      HIS  80   7.412   1.539 -11.001
    8    HE2  HIS  80           HE2      HIS  80   6.960  -0.854 -10.274

  No H/Q in entry =           8
  In of MODEL   26
    1    H    LEU  81           H        LEU  81   0.119   1.619  -8.850
    2    HA   LEU  81           HA       LEU  81  -0.194   4.408  -8.520
    3    HB2  LEU  81           HB2      LEU  81  -2.177   2.134  -8.431
    4    HB3  LEU  81           HB3      LEU  81  -2.653   3.831  -8.338
    5    HG   LEU  81           HG       LEU  81  -0.953   2.703 -10.580
    6   HD12  LEU  81          HD11      LEU  81  -3.195   2.990 -11.870
    7   HD11  LEU  81          HD12      LEU  81  -3.943   2.913 -10.276
    8   HD13  LEU  81          HD13      LEU  81  -2.983   1.558 -10.866
    9   HD23  LEU  81          HD21      LEU  81  -2.085   4.831 -11.675
   10   HD22  LEU  81          HD22      LEU  81  -0.667   5.023 -10.647
   11   HD21  LEU  81          HD23      LEU  81  -2.273   5.349 -10.001

  No H/Q in entry =          11
  In of MODEL   26
    1    H    MET  82           H        MET  82  -0.805   1.714  -6.267
    2    HA   MET  82           HA       MET  82  -1.872   3.286  -4.176
    3    HB2  MET  82           HB2      MET  82  -0.459   0.619  -4.219
    4    HB3  MET  82           HB3      MET  82  -1.042   1.337  -2.720
    5    HG2  MET  82           HG2      MET  82  -2.778   0.816  -5.153
    6    HG3  MET  82           HG3      MET  82  -2.678  -0.255  -3.758
    7    HE3  MET  82           HE1      MET  82  -4.413   1.371  -0.936
    8    HE2  MET  82           HE2      MET  82  -2.688   1.674  -1.129
    9    HE1  MET  82           HE3      MET  82  -3.355   0.107  -1.579

  No H/Q in entry =           9
  In of MODEL   26
    1    H    THR  83           H        THR  83   1.441   2.248  -4.879
    2    HA   THR  83           HA       THR  83   2.652   3.372  -2.584
    3    HB   THR  83           HB       THR  83   4.742   3.346  -4.066
    4    HG1  THR  83           HG1      THR  83   4.501   2.815  -6.089
    5   HG22  THR  83          HG21      THR  83   4.336   0.682  -4.395
    6   HG21  THR  83          HG22      THR  83   3.045   1.043  -3.250
    7   HG23  THR  83          HG23      THR  83   4.721   1.412  -2.837

  No H/Q in entry =           7
  In of MODEL   26
    1    H    SER  84           H        SER  84   2.249   4.643  -5.883
    2    HA   SER  84           HA       SER  84   3.554   7.104  -5.435
    3    HB2  SER  84           HB2      SER  84   1.488   6.239  -7.445
    4    HB3  SER  84           HB3      SER  84   2.143   7.876  -7.424
    5    HG   SER  84           HG       SER  84   3.550   5.422  -7.719

  No H/Q in entry =           5
  In of MODEL   26
    1    H    MET  85           H        MET  85   0.073   6.296  -5.249
    2    HA   MET  85           HA       MET  85  -0.824   8.894  -4.645
    3    HB2  MET  85           HB2      MET  85  -2.270   6.963  -5.299
    4    HB3  MET  85           HB3      MET  85  -2.052   6.315  -3.673
    5    HG2  MET  85           HG2      MET  85  -2.836   8.683  -2.891
    6    HG3  MET  85           HG3      MET  85  -3.472   8.826  -4.529
    7    HE1  MET  85           HE1      MET  85  -4.426   6.525  -5.594
    8    HE3  MET  85           HE2      MET  85  -5.534   5.453  -4.740
    9    HE2  MET  85           HE3      MET  85  -3.797   5.263  -4.528

  No H/Q in entry =           9
  In of MODEL   26
    1    H    LEU  86           H        LEU  86   0.143   6.246  -2.504
    2    HA   LEU  86           HA       LEU  86  -0.399   7.543  -0.061
    3    HB2  LEU  86           HB2      LEU  86   0.098   5.078  -0.455
    4    HB3  LEU  86           HB3      LEU  86   1.799   5.532  -0.558
    5    HG   LEU  86           HG       LEU  86   1.467   6.690   1.711
    6   HD11  LEU  86          HD11      LEU  86  -1.218   5.885   1.252
    7   HD13  LEU  86          HD12      LEU  86  -0.556   6.643   2.699
    8   HD12  LEU  86          HD13      LEU  86  -0.623   4.886   2.581
    9   HD23  LEU  86          HD21      LEU  86   1.081   3.691   1.837
   10   HD22  LEU  86          HD22      LEU  86   2.073   4.715   2.872
   11   HD21  LEU  86          HD23      LEU  86   2.572   4.397   1.211

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ALA  87           H        ALA  87   2.578   7.288  -1.962
    2    HA   ALA  87           HA       ALA  87   4.271   8.722  -0.245
    3    HB3  ALA  87           HB1      ALA  87   4.369   7.710  -2.952
    4    HB2  ALA  87           HB2      ALA  87   5.703   8.059  -1.857
    5    HB1  ALA  87           HB3      ALA  87   5.067   9.330  -2.899

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ARG  88           H        ARG  88   2.297   9.831  -2.958
    2    HA   ARG  88           HA       ARG  88   3.037  12.531  -2.845
    3    HB2  ARG  88           HB2      ARG  88   1.790  11.361  -4.696
    4    HB3  ARG  88           HB3      ARG  88   0.335  11.486  -3.707
    5    HG2  ARG  88           HG2      ARG  88   1.322  14.079  -3.629
    6    HG3  ARG  88           HG3      ARG  88   1.745  13.570  -5.261
    7    HD2  ARG  88           HD2      ARG  88  -0.400  13.622  -5.950
    8    HD3  ARG  88           HD3      ARG  88  -0.969  12.762  -4.519
    9    HE   ARG  88           HE       ARG  88  -1.196  15.538  -4.936
   10   HH21  ARG  88          HH11      ARG  88  -1.733  16.861  -3.197
   11   HH22  ARG  88          HH12      ARG  88  -1.422  16.328  -1.580
   12   HH11  ARG  88          HH21      ARG  88  -0.141  13.289  -2.566
   13   HH12  ARG  88          HH22      ARG  88  -0.539  14.299  -1.223

  No H/Q in entry =          13
  In of MODEL   26
    1    H    GLU  89           H        GLU  89   0.362  10.823  -1.193
    2    HA   GLU  89           HA       GLU  89  -0.769  13.121   0.017
    3    HB2  GLU  89           HB2      GLU  89  -1.859  10.868  -0.065
    4    HB3  GLU  89           HB3      GLU  89  -0.723  10.327   1.171
    5    HG2  GLU  89           HG2      GLU  89  -1.557  12.016   2.734
    6    HG3  GLU  89           HG3      GLU  89  -2.623  12.674   1.495

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LEU  90           H        LEU  90   1.716  10.859   1.180
    2    HA   LEU  90           HA       LEU  90   2.068  12.108   3.708
    3    HB2  LEU  90           HB2      LEU  90   3.855  10.355   2.023
    4    HB3  LEU  90           HB3      LEU  90   4.275  10.877   3.660
    5    HG   LEU  90           HG       LEU  90   1.653   9.500   3.011
    6   HD12  LEU  90          HD11      LEU  90   2.822   7.468   4.014
    7   HD11  LEU  90          HD12      LEU  90   4.333   8.342   3.765
    8   HD13  LEU  90          HD13      LEU  90   3.320   7.922   2.383
    9   HD22  LEU  90          HD21      LEU  90   1.388  10.421   5.133
   10   HD21  LEU  90          HD22      LEU  90   3.108  10.334   5.508
   11   HD23  LEU  90          HD23      LEU  90   2.119   8.875   5.561

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  91           H        ILE  91   3.653  12.509   0.574
    2    HA   ILE  91           HA       ILE  91   5.612  14.363   1.404
    3    HB   ILE  91           HB       ILE  91   4.294  13.857  -1.270
    4   HG12  ILE  91          HG12      ILE  91   7.136  13.403  -0.309
    5   HG13  ILE  91          HG13      ILE  91   5.869  12.191  -0.140
    6   HG22  ILE  91          HG21      ILE  91   6.498  15.230  -1.969
    7   HG21  ILE  91          HG22      ILE  91   6.186  16.027  -0.426
    8   HG23  ILE  91          HG23      ILE  91   4.957  16.041  -1.689
    9   HD13  ILE  91          HD11      ILE  91   5.689  11.865  -2.446
   10   HD12  ILE  91          HD12      ILE  91   7.421  12.128  -2.241
   11   HD11  ILE  91          HD13      ILE  91   6.393  13.439  -2.823

  No H/Q in entry =          11
  In of MODEL   26
    1    H    THR  92           H        THR  92   2.241  14.758   0.412
    2    HA   THR  92           HA       THR  92   2.183  17.581   0.351
    3    HB   THR  92           HB       THR  92   0.041  15.562   1.060
    4    HG1  THR  92           HG1      THR  92   0.338  15.386  -1.026
    5   HG22  THR  92          HG21      THR  92  -1.387  17.708   0.345
    6   HG21  THR  92          HG22      THR  92  -0.001  18.549   1.035
    7   HG23  THR  92          HG23      THR  92  -0.925  17.417   2.021

  No H/Q in entry =           7
  In of MODEL   26
    1    H    GLU  93           H        GLU  93   1.672  15.274   3.007
    2    HA   GLU  93           HA       GLU  93   1.128  17.173   5.028
    3    HB2  GLU  93           HB2      GLU  93   2.472  14.462   5.258
    4    HB3  GLU  93           HB3      GLU  93   1.777  15.382   6.594
    5    HG2  GLU  93           HG2      GLU  93   0.163  14.586   4.163
    6    HG3  GLU  93           HG3      GLU  93   0.282  13.565   5.591

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LEU  94           H        LEU  94   4.146  15.724   3.865
    2    HA   LEU  94           HA       LEU  94   5.892  16.890   5.745
    3    HB2  LEU  94           HB2      LEU  94   6.291  15.927   2.912
    4    HB3  LEU  94           HB3      LEU  94   7.618  16.600   3.856
    5    HG   LEU  94           HG       LEU  94   5.908  14.385   4.999
    6   HD11  LEU  94          HD11      LEU  94   7.996  14.182   2.858
    7   HD13  LEU  94          HD12      LEU  94   6.562  13.192   3.126
    8   HD12  LEU  94          HD13      LEU  94   7.995  12.955   4.126
    9   HD23  LEU  94          HD21      LEU  94   8.108  13.873   6.141
   10   HD22  LEU  94          HD22      LEU  94   7.426  15.444   6.560
   11   HD21  LEU  94          HD23      LEU  94   8.761  15.338   5.412

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  95           H        ILE  95   4.726  18.049   2.600
    2    HA   ILE  95           HA       ILE  95   6.272  20.424   2.534
    3    HB   ILE  95           HB       ILE  95   3.629  19.711   1.240
    4   HG12  ILE  95          HG12      ILE  95   6.409  20.079   0.090
    5   HG13  ILE  95          HG13      ILE  95   5.779  18.518   0.608
    6   HG21  ILE  95          HG21      ILE  95   5.351  22.197   1.012
    7   HG23  ILE  95          HG22      ILE  95   3.628  22.111   1.376
    8   HG22  ILE  95          HG23      ILE  95   4.208  21.716  -0.243
    9   HD13  ILE  95          HD11      ILE  95   4.212  18.425  -1.114
   10   HD12  ILE  95          HD12      ILE  95   5.549  19.258  -1.908
   11   HD11  ILE  95          HD13      ILE  95   4.169  20.178  -1.309

  No H/Q in entry =          11
  In of MODEL   26
    1    H    GLU  96           H        GLU  96   3.036  19.737   3.843
    2    HA   GLU  96           HA       GLU  96   2.390  22.377   4.597
    3    HB2  GLU  96           HB2      GLU  96   0.735  20.576   4.617
    4    HB3  GLU  96           HB3      GLU  96   1.612  19.758   5.908
    5    HG2  GLU  96           HG2      GLU  96   0.585  21.030   7.482
    6    HG3  GLU  96           HG3      GLU  96   1.101  22.509   6.683

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LEU  97           H        LEU  97   4.268  19.846   6.214
    2    HA   LEU  97           HA       LEU  97   4.622  21.198   8.683
    3    HB2  LEU  97           HB2      LEU  97   6.176  19.046   7.262
    4    HB3  LEU  97           HB3      LEU  97   6.765  19.737   8.772
    5    HG   LEU  97           HG       LEU  97   3.966  18.614   8.473
    6   HD12  LEU  97          HD11      LEU  97   4.933  16.612   9.682
    7   HD11  LEU  97          HD12      LEU  97   6.536  17.260   9.331
    8   HD13  LEU  97          HD13      LEU  97   5.465  16.790   8.010
    9   HD23  LEU  97          HD21      LEU  97   4.434  18.324  11.036
   10   HD22  LEU  97          HD22      LEU  97   4.034  19.932  10.433
   11   HD21  LEU  97          HD23      LEU  97   5.711  19.510  10.770

  No H/Q in entry =          11
  In of MODEL   26
    1    H    HIS  98           H        HIS  98   6.479  21.234   5.649
    2    HA   HIS  98           HA       HIS  98   8.620  22.836   6.539
    3    HB2  HIS  98           HB2      HIS  98   7.317  22.567   3.819
    4    HB3  HIS  98           HB3      HIS  98   8.748  23.560   4.103
    5    HD1  HIS  98           HD1      HIS  98   7.574  19.978   4.128
    6    HD2  HIS  98           HD2      HIS  98  11.135  22.111   4.537
    7    HE1  HIS  98           HE1      HIS  98   9.446  18.267   4.063
    8    HE2  HIS  98           HE2      HIS  98  11.619  19.546   4.312

  No H/Q in entry =           8
  In of MODEL   26
    1    H    GLU  99           H        GLU  99   5.385  23.638   5.378
    2    HA   GLU  99           HA       GLU  99   5.735  26.456   5.318
    3    HB2  GLU  99           HB2      GLU  99   3.863  25.268   4.196
    4    HB3  GLU  99           HB3      GLU  99   3.178  24.900   5.778
    5    HG2  GLU  99           HG2      GLU  99   2.976  27.289   6.280
    6    HG3  GLU  99           HG3      GLU  99   3.741  27.697   4.747

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LYS 100           H        LYS 100   4.639  24.210   7.845
    2    HA   LYS 100           HA       LYS 100   4.040  26.258   9.742
    3    HB2  LYS 100           HB2      LYS 100   4.647  23.312  10.085
    4    HB3  LYS 100           HB3      LYS 100   4.195  24.381  11.419
    5    HG2  LYS 100           HG2      LYS 100   2.117  24.997  10.180
    6    HG3  LYS 100           HG3      LYS 100   2.550  23.833   8.926
    7    HD2  LYS 100           HD2      LYS 100   2.498  22.011  10.588
    8    HD3  LYS 100           HD3      LYS 100   2.082  23.170  11.853
    9    HE2  LYS 100           HE2      LYS 100   0.017  23.771  10.599
   10    HE3  LYS 100           HE3      LYS 100   0.424  22.555   9.382
   11    HZ1  LYS 100           HZ1      LYS 100   0.177  21.886  12.264
   12    HZ3  LYS 100           HZ2      LYS 100   0.166  20.832  10.929
   13    HZ2  LYS 100           HZ3      LYS 100  -1.158  21.858  11.215

  No H/Q in entry =          13
  In of MODEL   26
    1    H    LEU 101           H        LEU 101   6.977  24.491   8.895
    2    HA   LEU 101           HA       LEU 101   8.578  25.347  11.091
    3    HB2  LEU 101           HB2      LEU 101   9.169  24.366   8.310
    4    HB3  LEU 101           HB3      LEU 101  10.469  25.044   9.286
    5    HG   LEU 101           HG       LEU 101   8.663  22.870  10.358
    6   HD12  LEU 101          HD11      LEU 101  10.729  21.395   9.740
    7   HD11  LEU 101          HD12      LEU 101  11.078  22.662   8.566
    8   HD13  LEU 101          HD13      LEU 101   9.557  21.774   8.479
    9   HD21  LEU 101          HD21      LEU 101  11.379  24.004  11.073
   10   HD23  LEU 101          HD22      LEU 101  10.854  22.427  11.655
   11   HD22  LEU 101          HD23      LEU 101   9.950  23.874  12.098

  No H/Q in entry =          11
  In of MODEL   26
    1    H    LYS 102           H        LYS 102   6.967  27.195   8.957
    2    HA   LYS 102           HA       LYS 102   7.021  29.489   8.665
    3    HB2  LYS 102           HB2      LYS 102   8.596  29.388  10.757
    4    HB3  LYS 102           HB3      LYS 102   9.888  29.595   9.592
    5    HG2  LYS 102           HG2      LYS 102   7.768  31.528  10.463
    6    HG3  LYS 102           HG3      LYS 102   9.477  31.804  10.204
    7    HD2  LYS 102           HD2      LYS 102   7.520  31.363   7.913
    8    HD3  LYS 102           HD3      LYS 102   7.891  32.946   8.579
    9    HE2  LYS 102           HE2      LYS 102   9.266  31.774   6.500
   10    HE3  LYS 102           HE3      LYS 102   9.874  33.087   7.508
   11    HZ2  LYS 102           HZ1      LYS 102  11.412  31.197   7.326
   12    HZ1  LYS 102           HZ2      LYS 102  10.262  30.203   8.074
   13    HZ3  LYS 102           HZ3      LYS 102  10.946  31.497   8.930

  No H/Q in entry =          13
  In of MODEL   26
    1    H    ALA 103           H        ALA 103  10.288  28.180   8.086
    2    HA   ALA 103           HA       ALA 103  11.230  29.566   6.006
    3    HB2  ALA 103           HB1      ALA 103  12.131  27.360   5.074
    4    HB1  ALA 103           HB2      ALA 103  11.249  26.578   6.384
    5    HB3  ALA 103           HB3      ALA 103  12.530  27.734   6.752

  No H/Q in entry =           5
  In of MODEL   26
    1    H1   LYS   3           H1       LYS   3 -30.894   6.324 -19.751
    2    H2   LYS   3           H3       LYS   3 -29.916   6.002 -21.101
    3    H3   LYS   3           H2       LYS   3 -31.334   5.104 -20.848
    4    HA   LYS   3           HA       LYS   3 -30.366   3.697 -19.438
    5    HB2  LYS   3           HB2      LYS   3 -28.050   5.043 -20.780
    6    HB3  LYS   3           HB3      LYS   3 -27.755   3.833 -19.530
    7    HG2  LYS   3           HG2      LYS   3 -29.219   2.277 -20.871
    8    HG3  LYS   3           HG3      LYS   3 -29.145   3.469 -22.168
    9    HD2  LYS   3           HD2      LYS   3 -26.665   3.292 -22.120
   10    HD3  LYS   3           HD3      LYS   3 -26.816   2.002 -20.926
   11    HE2  LYS   3           HE2      LYS   3 -28.348   0.857 -22.635
   12    HE3  LYS   3           HE3      LYS   3 -27.699   2.013 -23.797
   13    HZ3  LYS   3           HZ1      LYS   3 -25.933   0.736 -24.062
   14    HZ2  LYS   3           HZ2      LYS   3 -26.592  -0.409 -22.996
   15    HZ1  LYS   3           HZ3      LYS   3 -25.570   0.812 -22.405

  No H/Q in entry =          15
  In of MODEL   26
    1    H    LYS   4           H        LYS   4 -30.419   3.567 -17.375
    2    HA   LYS   4           HA       LYS   4 -29.626   5.843 -15.738
    3    HB2  LYS   4           HB2      LYS   4 -30.898   3.187 -15.023
    4    HB3  LYS   4           HB3      LYS   4 -30.640   4.524 -13.904
    5    HG2  LYS   4           HG2      LYS   4 -32.452   4.498 -16.323
    6    HG3  LYS   4           HG3      LYS   4 -32.938   4.571 -14.631
    7    HD2  LYS   4           HD2      LYS   4 -32.182   6.775 -14.377
    8    HD3  LYS   4           HD3      LYS   4 -31.147   6.681 -15.801
    9    HE2  LYS   4           HE2      LYS   4 -33.035   8.104 -16.267
   10    HE3  LYS   4           HE3      LYS   4 -33.156   6.629 -17.228
   11    HZ3  LYS   4           HZ1      LYS   4 -34.755   5.769 -15.674
   12    HZ2  LYS   4           HZ2      LYS   4 -35.269   7.275 -16.266
   13    HZ1  LYS   4           HZ3      LYS   4 -34.614   7.155 -14.703

  No H/Q in entry =          13
  In of MODEL   26
    1    H    HIS   5           H        HIS   5 -28.154   5.896 -14.148
    2    HA   HIS   5           HA       HIS   5 -25.923   4.002 -14.473
    3    HB2  HIS   5           HB2      HIS   5 -26.099   6.769 -13.281
    4    HB3  HIS   5           HB3      HIS   5 -24.645   5.774 -13.261
    5    HD1  HIS   5           HD1      HIS   5 -23.143   6.922 -14.859
    6    HD2  HIS   5           HD2      HIS   5 -26.963   6.402 -16.405
    7    HE1  HIS   5           HE1      HIS   5 -22.963   7.486 -17.313
    8    HE2  HIS   5           HE2      HIS   5 -25.292   7.156 -18.223

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ILE   6           H        ILE   6 -25.738   2.430 -13.148
    2    HA   ILE   6           HA       ILE   6 -26.701   2.740 -10.385
    3    HB   ILE   6           HB       ILE   6 -25.950   0.243 -11.910
    4   HG12  ILE   6          HG12      ILE   6 -28.663   1.263 -11.060
    5   HG13  ILE   6          HG13      ILE   6 -28.019   1.397 -12.696
    6   HG23  ILE   6          HG21      ILE   6 -26.356  -0.989 -10.043
    7   HG22  ILE   6          HG22      ILE   6 -27.479   0.195  -9.368
    8   HG21  ILE   6          HG23      ILE   6 -25.740   0.481  -9.283
    9   HD13  ILE   6          HD11      ILE   6 -28.540  -0.711 -13.184
   10   HD12  ILE   6          HD12      ILE   6 -29.553  -0.657 -11.742
   11   HD11  ILE   6          HD13      ILE   6 -27.917  -1.311 -11.648

  No H/Q in entry =          11
  In of MODEL   26
    1    H    TYR   7           H        TYR   7 -24.922   3.337  -9.104
    2    HA   TYR   7           HA       TYR   7 -22.241   2.298  -9.781
    3    HB2  TYR   7           HB2      TYR   7 -23.131   4.767  -8.312
    4    HB3  TYR   7           HB3      TYR   7 -21.462   4.203  -8.350
    5    HD1  TYR   7           HD1      TYR   7 -22.533   3.275 -11.434
    6    HD2  TYR   7           HD2      TYR   7 -21.756   6.837  -9.227
    7    HE1  TYR   7           HE1      TYR   7 -22.069   4.480 -13.532
    8    HE2  TYR   7           HE2      TYR   7 -21.333   8.050 -11.318
    9    HH   TYR   7           HH       TYR   7 -21.557   7.957 -13.549

  No H/Q in entry =           9
  In of MODEL   26
    1    H    LEU   8           H        LEU   8 -21.314   0.925  -8.446
    2    HA   LEU   8           HA       LEU   8 -22.454   0.478  -5.759
    3    HB2  LEU   8           HB2      LEU   8 -20.804  -1.244  -7.586
    4    HB3  LEU   8           HB3      LEU   8 -20.998  -1.611  -5.873
    5    HG   LEU   8           HG       LEU   8 -23.483  -1.713  -6.291
    6   HD13  LEU   8          HD11      LEU   8 -23.580  -0.505  -8.407
    7   HD12  LEU   8          HD12      LEU   8 -24.159  -2.154  -8.637
    8   HD11  LEU   8          HD13      LEU   8 -22.538  -1.707  -9.167
    9   HD23  LEU   8          HD21      LEU   8 -22.271  -3.800  -7.975
   10   HD22  LEU   8          HD22      LEU   8 -23.361  -3.928  -6.594
   11   HD21  LEU   8          HD23      LEU   8 -21.644  -3.624  -6.337

  No H/Q in entry =          11
  In of MODEL   26
    1    H    PHE   9           H        PHE   9 -21.169   0.867  -3.977
    2    HA   PHE   9           HA       PHE   9 -18.362   1.720  -4.507
    3    HB2  PHE   9           HB2      PHE   9 -20.357   2.847  -2.549
    4    HB3  PHE   9           HB3      PHE   9 -18.637   3.205  -2.498
    5    HD1  PHE   9           HD1      PHE   9 -17.560   4.486  -4.282
    6    HD2  PHE   9           HD2      PHE   9 -21.783   3.733  -4.326
    7    HE1  PHE   9           HE1      PHE   9 -17.849   6.203  -6.042
    8    HE2  PHE   9           HE2      PHE   9 -22.073   5.462  -6.081
    9    HZ   PHE   9           HZ       PHE   9 -20.103   6.694  -6.945

  No H/Q in entry =           9
  In of MODEL   26
    1    H    SER  10           H        SER  10 -16.803   0.691  -3.445
    2    HA   SER  10           HA       SER  10 -16.997  -0.177  -0.737
    3    HB2  SER  10           HB2      SER  10 -18.280  -2.012  -1.798
    4    HB3  SER  10           HB3      SER  10 -16.915  -2.324  -2.858
    5    HG   SER  10           HG       SER  10 -15.783  -3.100  -1.217

  No H/Q in entry =           5
  In of MODEL   26
    1    H    SER  11           H        SER  11 -14.979  -0.039   0.053
    2    HA   SER  11           HA       SER  11 -12.795   0.734  -1.510
    3    HB2  SER  11           HB2      SER  11 -13.264   0.848   1.082
    4    HB3  SER  11           HB3      SER  11 -12.315  -0.639   1.087
    5    HG   SER  11           HG       SER  11 -10.795   0.644  -0.265

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA  12           H        ALA  12 -14.062  -1.974  -2.222
    2    HA   ALA  12           HA       ALA  12 -11.503  -3.251  -2.793
    3    HB3  ALA  12           HB1      ALA  12 -12.276  -4.312  -0.681
    4    HB2  ALA  12           HB2      ALA  12 -12.177  -5.450  -2.023
    5    HB1  ALA  12           HB3      ALA  12 -13.745  -4.829  -1.512

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLY  13           H        GLY  13 -12.222  -2.280  -4.830
    2    HA3  GLY  13           HA2      GLY  13 -14.502  -2.871  -6.278
    3    HA2  GLY  13           HA3      GLY  13 -12.931  -2.530  -7.016

  No H/Q in entry =           3
  In of MODEL   26
    1    H    MET  14           H        MET  14 -11.522  -4.860  -6.135
    2    HA   MET  14           HA       MET  14 -12.101  -6.622  -8.193
    3    HB2  MET  14           HB2      MET  14  -9.982  -6.774  -6.981
    4    HB3  MET  14           HB3      MET  14 -10.809  -7.391  -5.552
    5    HG2  MET  14           HG2      MET  14 -11.553  -9.367  -6.865
    6    HG3  MET  14           HG3      MET  14 -10.692  -8.743  -8.273
    7    HE2  MET  14           HE1      MET  14  -7.839  -7.588  -7.016
    8    HE1  MET  14           HE2      MET  14  -8.466  -8.283  -8.509
    9    HE3  MET  14           HE3      MET  14  -7.106  -9.050  -7.693

  No H/Q in entry =           9
  In of MODEL   26
    1    H    SER  15           H        SER  15 -13.183  -7.036  -4.806
    2    HA   SER  15           HA       SER  15 -14.647  -9.429  -5.417
    3    HB2  SER  15           HB2      SER  15 -13.988  -8.929  -3.079
    4    HB3  SER  15           HB3      SER  15 -15.089  -7.552  -3.080
    5    HG   SER  15           HG       SER  15 -15.625 -10.157  -2.652

  No H/Q in entry =           5
  In of MODEL   26
    1    H    THR  16           H        THR  16 -15.637  -6.008  -5.078
    2    HA   THR  16           HA       THR  16 -18.439  -6.448  -5.598
    3    HB   THR  16           HB       THR  16 -16.818  -3.934  -6.133
    4    HG1  THR  16           HG1      THR  16 -16.533  -3.838  -4.084
    5   HG23  THR  16          HG21      THR  16 -18.915  -2.796  -5.785
    6   HG22  THR  16          HG22      THR  16 -19.707  -4.301  -5.286
    7   HG21  THR  16          HG23      THR  16 -19.189  -4.074  -6.963

  No H/Q in entry =           7
  In of MODEL   26
    1    H    SER  17           H        SER  17 -15.599  -5.991  -7.461
    2    HA   SER  17           HA       SER  17 -16.706  -5.232  -9.967
    3    HB2  SER  17           HB2      SER  17 -14.118  -6.634  -9.267
    4    HB3  SER  17           HB3      SER  17 -14.546  -6.171 -10.913
    5    HG   SER  17           HG       SER  17 -13.239  -4.634  -9.699

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU  18           H        LEU  18 -16.227  -8.383  -8.501
    2    HA   LEU  18           HA       LEU  18 -16.856  -9.880 -10.847
    3    HB2  LEU  18           HB2      LEU  18 -15.664 -10.844  -8.915
    4    HB3  LEU  18           HB3      LEU  18 -17.113 -10.639  -7.932
    5    HG   LEU  18           HG       LEU  18 -18.329 -12.193  -9.376
    6   HD11  LEU  18          HD11      LEU  18 -15.769 -12.067 -10.933
    7   HD13  LEU  18          HD12      LEU  18 -17.434 -12.008 -11.514
    8   HD12  LEU  18          HD13      LEU  18 -16.742 -13.536 -10.973
    9   HD23  LEU  18          HD21      LEU  18 -17.071 -14.230  -8.796
   10   HD22  LEU  18          HD22      LEU  18 -17.233 -13.089  -7.459
   11   HD21  LEU  18          HD23      LEU  18 -15.706 -13.213  -8.332

  No H/Q in entry =          11
  In of MODEL   26
    1    H    LEU  19           H        LEU  19 -18.790  -8.601  -8.143
    2    HA   LEU  19           HA       LEU  19 -21.286  -9.719  -8.968
    3    HB2  LEU  19           HB2      LEU  19 -21.006  -8.888  -6.723
    4    HB3  LEU  19           HB3      LEU  19 -20.651  -7.271  -7.329
    5    HG   LEU  19           HG       LEU  19 -22.987  -7.066  -8.092
    6   HD11  LEU  19          HD11      LEU  19 -23.327  -9.725  -6.695
    7   HD13  LEU  19          HD12      LEU  19 -23.504  -9.430  -8.424
    8   HD12  LEU  19          HD13      LEU  19 -24.640  -8.708  -7.286
    9   HD22  LEU  19          HD21      LEU  19 -23.889  -6.636  -5.938
   10   HD21  LEU  19          HD22      LEU  19 -22.155  -6.325  -5.852
   11   HD23  LEU  19          HD23      LEU  19 -22.817  -7.818  -5.185

  No H/Q in entry =          11
  In of MODEL   26
    1    H    VAL  20           H        VAL  20 -19.701  -6.606  -9.681
    2    HA   VAL  20           HA       VAL  20 -21.783  -5.514 -11.256
    3    HB   VAL  20           HB       VAL  20 -18.778  -5.010 -11.415
    4   HG12  VAL  20          HG11      VAL  20 -19.369  -2.955 -12.665
    5   HG11  VAL  20          HG12      VAL  20 -21.051  -3.480 -12.710
    6   HG13  VAL  20          HG13      VAL  20 -19.814  -4.412 -13.553
    7   HG21  VAL  20          HG21      VAL  20 -21.047  -3.686  -9.981
    8   HG23  VAL  20          HG22      VAL  20 -19.571  -2.806 -10.370
    9   HG22  VAL  20          HG23      VAL  20 -19.497  -4.239  -9.344

  No H/Q in entry =           9
  In of MODEL   26
    1    H    SER  21           H        SER  21 -19.084  -7.648 -12.272
    2    HA   SER  21           HA       SER  21 -19.866  -7.529 -15.023
    3    HB2  SER  21           HB2      SER  21 -18.486  -9.537 -15.346
    4    HB3  SER  21           HB3      SER  21 -17.622  -8.311 -14.421
    5    HG   SER  21           HG       SER  21 -18.518 -10.804 -13.680

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LYS  22           H        LYS  22 -20.993  -9.669 -12.439
    2    HA   LYS  22           HA       LYS  22 -22.578 -11.255 -14.251
    3    HB2  LYS  22           HB2      LYS  22 -22.875 -10.876 -11.268
    4    HB3  LYS  22           HB3      LYS  22 -23.691 -12.100 -12.239
    5    HG2  LYS  22           HG2      LYS  22 -20.700 -11.928 -11.934
    6    HG3  LYS  22           HG3      LYS  22 -21.738 -12.930 -10.921
    7    HD2  LYS  22           HD2      LYS  22 -22.500 -14.142 -12.922
    8    HD3  LYS  22           HD3      LYS  22 -21.426 -13.156 -13.915
    9    HE2  LYS  22           HE2      LYS  22 -20.369 -15.287 -13.502
   10    HE3  LYS  22           HE3      LYS  22 -19.491 -14.034 -12.624
   11    HZ3  LYS  22           HZ1      LYS  22 -19.762 -15.195 -10.791
   12    HZ2  LYS  22           HZ2      LYS  22 -20.644 -16.380 -11.629
   13    HZ1  LYS  22           HZ3      LYS  22 -21.450 -15.061 -10.927

  No H/Q in entry =          13
  In of MODEL   26
    1    H    MET  23           H        MET  23 -23.215  -8.302 -12.399
    2    HA   MET  23           HA       MET  23 -26.023  -8.301 -12.904
    3    HB2  MET  23           HB2      MET  23 -24.109  -6.045 -12.345
    4    HB3  MET  23           HB3      MET  23 -25.849  -5.825 -12.523
    5    HG2  MET  23           HG2      MET  23 -26.279  -7.106 -10.547
    6    HG3  MET  23           HG3      MET  23 -24.581  -7.568 -10.419
    7    HE2  MET  23           HE1      MET  23 -26.769  -3.842  -9.250
    8    HE1  MET  23           HE2      MET  23 -27.053  -4.811 -10.695
    9    HE3  MET  23           HE3      MET  23 -25.975  -3.416 -10.768

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ARG  24           H        ARG  24 -23.229  -6.965 -14.696
    2    HA   ARG  24           HA       ARG  24 -24.687  -5.631 -16.703
    3    HB2  ARG  24           HB2      ARG  24 -21.905  -6.846 -16.724
    4    HB3  ARG  24           HB3      ARG  24 -22.550  -5.941 -18.071
    5    HG2  ARG  24           HG2      ARG  24 -22.737  -3.902 -16.654
    6    HG3  ARG  24           HG3      ARG  24 -22.095  -4.831 -15.275
    7    HD2  ARG  24           HD2      ARG  24 -20.672  -4.499 -17.957
    8    HD3  ARG  24           HD3      ARG  24 -20.349  -3.525 -16.528
    9    HE   ARG  24           HE       ARG  24 -19.875  -5.865 -15.490
   10   HH21  ARG  24          HH11      ARG  24 -17.675  -5.918 -15.031
   11   HH22  ARG  24          HH12      ARG  24 -16.527  -5.764 -16.316
   12   HH11  ARG  24          HH21      ARG  24 -19.060  -4.866 -18.619
   13   HH12  ARG  24          HH22      ARG  24 -17.357  -5.152 -18.436

  No H/Q in entry =          13
  In of MODEL   26
    1    H    ALA  25           H        ALA  25 -23.668  -9.001 -16.409
    2    HA   ALA  25           HA       ALA  25 -24.322  -9.826 -19.043
    3    HB1  ALA  25           HB1      ALA  25 -23.688 -11.874 -18.337
    4    HB3  ALA  25           HB2      ALA  25 -24.744 -11.814 -16.926
    5    HB2  ALA  25           HB3      ALA  25 -23.165 -11.035 -16.877

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLN  26           H        GLN  26 -26.149  -9.793 -16.019
    2    HA   GLN  26           HA       GLN  26 -28.529 -10.927 -17.030
    3    HB2  GLN  26           HB2      GLN  26 -27.962  -9.185 -14.651
    4    HB3  GLN  26           HB3      GLN  26 -29.546  -9.861 -14.998
    5    HG2  GLN  26           HG2      GLN  26 -27.007 -11.395 -14.522
    6    HG3  GLN  26           HG3      GLN  26 -28.364 -11.245 -13.413
    7   HE21  GLN  26          HE21      GLN  26 -27.215 -13.452 -14.680
    8   HE22  GLN  26          HE22      GLN  26 -28.289 -14.470 -15.470

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ALA  27           H        ALA  27 -27.488  -7.558 -16.654
    2    HA   ALA  27           HA       ALA  27 -29.942  -6.391 -17.443
    3    HB1  ALA  27           HB1      ALA  27 -28.093  -5.129 -16.334
    4    HB3  ALA  27           HB2      ALA  27 -28.659  -4.352 -17.813
    5    HB2  ALA  27           HB3      ALA  27 -27.151  -5.266 -17.820

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLU  28           H        GLU  28 -27.281  -7.707 -19.306
    2    HA   GLU  28           HA       GLU  28 -28.183  -6.649 -21.831
    3    HB2  GLU  28           HB2      GLU  28 -25.826  -7.404 -21.203
    4    HB3  GLU  28           HB3      GLU  28 -26.423  -9.051 -21.398
    5    HG2  GLU  28           HG2      GLU  28 -25.253  -8.319 -23.370
    6    HG3  GLU  28           HG3      GLU  28 -26.960  -8.590 -23.717

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LYS  29           H        LYS  29 -28.446  -9.741 -20.161
    2    HA   LYS  29           HA       LYS  29 -29.796 -11.177 -22.161
    3    HB2  LYS  29           HB2      LYS  29 -28.777 -12.186 -20.152
    4    HB3  LYS  29           HB3      LYS  29 -30.026 -11.436 -19.160
    5    HG2  LYS  29           HG2      LYS  29 -31.729 -12.758 -20.223
    6    HG3  LYS  29           HG3      LYS  29 -30.550 -13.436 -21.344
    7    HD2  LYS  29           HD2      LYS  29 -29.446 -14.631 -19.606
    8    HD3  LYS  29           HD3      LYS  29 -30.326 -13.757 -18.354
    9    HE2  LYS  29           HE2      LYS  29 -31.152 -16.082 -18.708
   10    HE3  LYS  29           HE3      LYS  29 -32.391 -14.851 -18.956
   11    HZ1  LYS  29           HZ1      LYS  29 -31.831 -15.013 -21.383
   12    HZ3  LYS  29           HZ2      LYS  29 -32.594 -16.373 -20.712
   13    HZ2  LYS  29           HZ3      LYS  29 -30.924 -16.398 -21.011

  No H/Q in entry =          13
  In of MODEL   26
    1    H    TYR  30           H        TYR  30 -31.121  -9.020 -19.665
    2    HA   TYR  30           HA       TYR  30 -33.796  -9.390 -20.905
    3    HB2  TYR  30           HB2      TYR  30 -33.107  -8.248 -18.188
    4    HB3  TYR  30           HB3      TYR  30 -34.732  -8.456 -18.840
    5    HD1  TYR  30           HD1      TYR  30 -35.714 -10.720 -19.045
    6    HD2  TYR  30           HD2      TYR  30 -31.858 -10.112 -17.344
    7    HE1  TYR  30           HE1      TYR  30 -35.698 -13.046 -18.240
    8    HE2  TYR  30           HE2      TYR  30 -31.842 -12.423 -16.542
    9    HH   TYR  30           HH       TYR  30 -33.555 -14.736 -17.627

  No H/Q in entry =           9
  In of MODEL   26
    1    H    GLU  31           H        GLU  31 -31.569  -7.471 -21.712
    2    HA   GLU  31           HA       GLU  31 -31.427  -5.320 -22.543
    3    HB2  GLU  31           HB2      GLU  31 -34.343  -5.947 -23.053
    4    HB3  GLU  31           HB3      GLU  31 -33.461  -4.608 -23.787
    5    HG2  GLU  31           HG2      GLU  31 -32.033  -6.096 -24.973
    6    HG3  GLU  31           HG3      GLU  31 -32.641  -7.488 -24.080

  No H/Q in entry =           6
  In of MODEL   26
    1    H    VAL  32           H        VAL  32 -31.624  -5.202 -19.811
    2    HA   VAL  32           HA       VAL  32 -33.421  -3.030 -19.160
    3    HB   VAL  32           HB       VAL  32 -31.060  -4.091 -17.575
    4   HG12  VAL  32          HG11      VAL  32 -32.570  -3.213 -15.683
    5   HG11  VAL  32          HG12      VAL  32 -33.375  -2.289 -16.950
    6   HG13  VAL  32          HG13      VAL  32 -31.660  -2.037 -16.632
    7   HG21  VAL  32          HG21      VAL  32 -32.880  -5.759 -18.257
    8   HG23  VAL  32          HG22      VAL  32 -33.893  -4.896 -17.101
    9   HG22  VAL  32          HG23      VAL  32 -32.399  -5.664 -16.564

  No H/Q in entry =           9
  In of MODEL   26
    1    HA   PRO  33           HA       PRO  33 -30.301  -0.201 -20.843
    2    HB2  PRO  33           HB2      PRO  33 -31.745   2.067 -20.728
    3    HB3  PRO  33           HB3      PRO  33 -32.252   0.775 -21.817
    4    HG2  PRO  33           HG2      PRO  33 -33.205   1.330 -19.007
    5    HG3  PRO  33           HG3      PRO  33 -34.175   1.146 -20.469
    6    HD2  PRO  33           HD2      PRO  33 -33.782  -0.934 -18.795
    7    HD3  PRO  33           HD3      PRO  33 -33.850  -1.180 -20.541

  No H/Q in entry =           7
  In of MODEL   26
    1    H    VAL  34           H        VAL  34 -29.054  -0.776 -18.893
    2    HA   VAL  34           HA       VAL  34 -28.698   1.645 -17.253
    3    HB   VAL  34           HB       VAL  34 -28.161   0.174 -15.310
    4   HG12  VAL  34          HG11      VAL  34 -30.598  -0.627 -15.000
    5   HG11  VAL  34          HG12      VAL  34 -30.892   0.137 -16.562
    6   HG13  VAL  34          HG13      VAL  34 -30.311   1.101 -15.203
    7   HG21  VAL  34          HG21      VAL  34 -28.407  -1.853 -17.311
    8   HG23  VAL  34          HG22      VAL  34 -29.474  -2.178 -15.945
    9   HG22  VAL  34          HG23      VAL  34 -27.747  -1.941 -15.678

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ILE  35           H        ILE  35 -26.710   2.024 -16.414
    2    HA   ILE  35           HA       ILE  35 -24.446   0.625 -17.672
    3    HB   ILE  35           HB       ILE  35 -24.761   3.527 -16.871
    4   HG12  ILE  35          HG12      ILE  35 -23.817   2.184 -19.411
    5   HG13  ILE  35          HG13      ILE  35 -25.428   2.853 -19.154
    6   HG21  ILE  35          HG21      ILE  35 -22.245   1.920 -17.176
    7   HG23  ILE  35          HG22      ILE  35 -22.665   3.115 -15.950
    8   HG22  ILE  35          HG23      ILE  35 -22.267   3.633 -17.588
    9   HD11  ILE  35          HD11      ILE  35 -23.963   5.008 -18.560
   10   HD13  ILE  35          HD12      ILE  35 -24.512   4.635 -20.196
   11   HD12  ILE  35          HD13      ILE  35 -22.871   4.219 -19.698

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ILE  36           H        ILE  36 -23.245  -0.429 -16.070
    2    HA   ILE  36           HA       ILE  36 -23.668   0.208 -13.202
    3    HB   ILE  36           HB       ILE  36 -22.920  -2.521 -14.301
    4   HG12  ILE  36          HG12      ILE  36 -25.702  -1.632 -13.540
    5   HG13  ILE  36          HG13      ILE  36 -25.130  -1.634 -15.208
    6   HG23  ILE  36          HG21      ILE  36 -23.294  -3.333 -12.185
    7   HG22  ILE  36          HG22      ILE  36 -24.384  -2.015 -11.750
    8   HG21  ILE  36          HG23      ILE  36 -22.644  -1.735 -11.821
    9   HD13  ILE  36          HD11      ILE  36 -25.360  -3.842 -15.407
   10   HD12  ILE  36          HD12      ILE  36 -26.421  -3.685 -14.008
   11   HD11  ILE  36          HD13      ILE  36 -24.735  -4.153 -13.787

  No H/Q in entry =          11
  In of MODEL   26
    1    H    GLU  37           H        GLU  37 -21.869   0.789 -12.100
    2    HA   GLU  37           HA       GLU  37 -19.203  -0.088 -13.013
    3    HB2  GLU  37           HB2      GLU  37 -20.024   2.729 -12.327
    4    HB3  GLU  37           HB3      GLU  37 -18.349   2.190 -12.445
    5    HG2  GLU  37           HG2      GLU  37 -18.781   1.622 -14.827
    6    HG3  GLU  37           HG3      GLU  37 -20.366   2.376 -14.660

  No H/Q in entry =           6
  In of MODEL   26
    1    H    ALA  38           H        ALA  38 -17.723  -0.363 -11.330
    2    HA   ALA  38           HA       ALA  38 -18.748  -0.146  -8.559
    3    HB1  ALA  38           HB1      ALA  38 -17.090  -2.137  -9.979
    4    HB3  ALA  38           HB2      ALA  38 -18.146  -2.339  -8.581
    5    HB2  ALA  38           HB3      ALA  38 -16.516  -1.701  -8.369

  No H/Q in entry =           5
  In of MODEL   26
    1    H    PHE  39           H        PHE  39 -17.474   1.033  -7.090
    2    HA   PHE  39           HA       PHE  39 -14.917   2.162  -7.991
    3    HB2  PHE  39           HB2      PHE  39 -16.946   3.874  -6.584
    4    HB3  PHE  39           HB3      PHE  39 -15.472   4.372  -7.412
    5    HD1  PHE  39           HD1      PHE  39 -15.571   5.178  -9.560
    6    HD2  PHE  39           HD2      PHE  39 -18.784   2.814  -8.051
    7    HE1  PHE  39           HE1      PHE  39 -16.875   5.658 -11.614
    8    HE2  PHE  39           HE2      PHE  39 -20.093   3.279 -10.092
    9    HZ   PHE  39           HZ       PHE  39 -19.134   4.675 -11.892

  No H/Q in entry =           9
  In of MODEL   26
    1    HA   PRO  40           HA       PRO  40 -13.998   1.397  -3.701
    2    HB2  PRO  40           HB2      PRO  40 -12.178   3.366  -3.103
    3    HB3  PRO  40           HB3      PRO  40 -11.770   2.018  -4.165
    4    HG2  PRO  40           HG2      PRO  40 -12.720   4.777  -4.922
    5    HG3  PRO  40           HG3      PRO  40 -11.317   3.895  -5.525
    6    HD2  PRO  40           HD2      PRO  40 -13.542   3.865  -6.932
    7    HD3  PRO  40           HD3      PRO  40 -12.628   2.370  -6.738

  No H/Q in entry =           7
  In of MODEL   26
    1    H    GLU  41           H        GLU  41 -14.594   2.398  -1.575
    2    HA   GLU  41           HA       GLU  41 -16.791   4.160  -1.564
    3    HB2  GLU  41           HB2      GLU  41 -16.778   3.942   0.748
    4    HB3  GLU  41           HB3      GLU  41 -16.001   2.450   0.218
    5    HG2  GLU  41           HG2      GLU  41 -14.641   4.900   1.334
    6    HG3  GLU  41           HG3      GLU  41 -14.854   3.349   2.145

  No H/Q in entry =           6
  In of MODEL   26
    1    H    THR  42           H        THR  42 -13.438   4.989  -1.619
    2    HA   THR  42           HA       THR  42 -13.723   7.562  -0.416
    3    HB   THR  42           HB       THR  42 -11.550   8.075  -1.490
    4    HG1  THR  42           HG1      THR  42 -12.164   5.663  -2.831
    5   HG21  THR  42          HG21      THR  42 -11.751   6.644   0.604
    6   HG23  THR  42          HG22      THR  42 -10.254   6.453  -0.310
    7   HG22  THR  42          HG23      THR  42 -11.527   5.243  -0.442

  No H/Q in entry =           7
  In of MODEL   26
    1    H    LEU  43           H        LEU  43 -14.656   6.481  -3.512
    2    HA   LEU  43           HA       LEU  43 -14.836   9.256  -4.492
    3    HB2  LEU  43           HB2      LEU  43 -15.254   6.610  -5.871
    4    HB3  LEU  43           HB3      LEU  43 -15.452   8.185  -6.636
    5    HG   LEU  43           HG       LEU  43 -12.851   7.043  -5.643
    6   HD12  LEU  43          HD11      LEU  43 -13.679   7.534  -8.491
    7   HD11  LEU  43          HD12      LEU  43 -13.952   5.985  -7.695
    8   HD13  LEU  43          HD13      LEU  43 -12.311   6.598  -7.888
    9   HD21  LEU  43          HD21      LEU  43 -13.645   9.635  -6.943
   10   HD23  LEU  43          HD22      LEU  43 -12.011   8.993  -7.109
   11   HD22  LEU  43          HD23      LEU  43 -12.650   9.375  -5.512

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ALA  44           H        ALA  44 -16.829   7.489  -2.632
    2    HA   ALA  44           HA       ALA  44 -19.310   7.408  -3.954
    3    HB2  ALA  44           HB1      ALA  44 -19.200   6.296  -1.854
    4    HB3  ALA  44           HB2      ALA  44 -20.272   7.670  -1.586
    5    HB1  ALA  44           HB3      ALA  44 -18.598   7.737  -1.034

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLY  45           H        GLY  45 -17.817  10.176  -2.432
    2    HA3  GLY  45           HA2      GLY  45 -20.214  11.738  -2.798
    3    HA2  GLY  45           HA3      GLY  45 -18.654  12.324  -2.223

  No H/Q in entry =           3
  In of MODEL   26
    1    H    GLU  46           H        GLU  46 -17.148  11.339  -4.510
    2    HA   GLU  46           HA       GLU  46 -17.728  13.564  -6.287
    3    HB2  GLU  46           HB2      GLU  46 -15.467  11.915  -5.623
    4    HB3  GLU  46           HB3      GLU  46 -15.714  11.910  -7.370
    5    HG2  GLU  46           HG2      GLU  46 -15.503  14.412  -5.713
    6    HG3  GLU  46           HG3      GLU  46 -14.134  13.650  -6.523

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LYS  47           H        LYS  47 -17.700  10.043  -6.709
    2    HA   LYS  47           HA       LYS  47 -18.792  10.280  -9.386
    3    HB2  LYS  47           HB2      LYS  47 -18.287   7.882  -7.617
    4    HB3  LYS  47           HB3      LYS  47 -18.859   7.798  -9.283
    5    HG2  LYS  47           HG2      LYS  47 -16.276   9.118  -8.540
    6    HG3  LYS  47           HG3      LYS  47 -16.395   7.394  -8.891
    7    HD2  LYS  47           HD2      LYS  47 -17.336   7.898 -11.087
    8    HD3  LYS  47           HD3      LYS  47 -17.238   9.623 -10.737
    9    HE2  LYS  47           HE2      LYS  47 -14.811   9.453 -10.550
   10    HE3  LYS  47           HE3      LYS  47 -14.904   7.723 -10.882
   11    HZ1  LYS  47           HZ1      LYS  47 -16.204   8.600 -12.966
   12    HZ3  LYS  47           HZ2      LYS  47 -14.510   8.492 -12.952
   13    HZ2  LYS  47           HZ3      LYS  47 -15.268   9.989 -12.682

  No H/Q in entry =          13
  In of MODEL   26
    1    H    GLY  48           H        GLY  48 -20.134   9.570  -6.235
    2    HA3  GLY  48           HA2      GLY  48 -22.550   8.445  -6.971
    3    HA2  GLY  48           HA3      GLY  48 -22.299   9.438  -5.535

  No H/Q in entry =           3
  In of MODEL   26
    1    H    GLN  49           H        GLN  49 -21.653  11.838  -7.116
    2    HA   GLN  49           HA       GLN  49 -24.181  13.016  -7.264
    3    HB2  GLN  49           HB2      GLN  49 -21.617  13.808  -8.627
    4    HB3  GLN  49           HB3      GLN  49 -23.053  14.812  -8.546
    5    HG2  GLN  49           HG2      GLN  49 -22.892  14.840  -6.109
    6    HG3  GLN  49           HG3      GLN  49 -21.470  13.816  -6.188
    7   HE21  GLN  49          HE21      GLN  49 -21.294  16.046  -4.924
    8   HE22  GLN  49          HE22      GLN  49 -20.339  17.274  -5.577

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ASN  50           H        ASN  50 -22.553  11.084  -9.644
    2    HA   ASN  50           HA       ASN  50 -24.413  11.998 -11.728
    3    HB2  ASN  50           HB2      ASN  50 -21.875  10.389 -11.957
    4    HB3  ASN  50           HB3      ASN  50 -22.914  10.837 -13.302
    5   HD21  ASN  50          HD21      ASN  50 -20.256  11.620 -11.695
    6   HD22  ASN  50          HD22      ASN  50 -19.979  13.247 -12.044

  No H/Q in entry =           6
  In of MODEL   26
    1    H    ALA  51           H        ALA  51 -24.461   9.650  -9.474
    2    HA   ALA  51           HA       ALA  51 -25.303   7.520 -11.292
    3    HB2  ALA  51           HB1      ALA  51 -24.755   6.162  -9.601
    4    HB3  ALA  51           HB2      ALA  51 -25.854   7.003  -8.511
    5    HB1  ALA  51           HB3      ALA  51 -24.200   7.581  -8.710

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ASP  52           H        ASP  52 -27.335   6.519 -11.148
    2    HA   ASP  52           HA       ASP  52 -29.465   8.413 -10.489
    3    HB2  ASP  52           HB2      ASP  52 -29.342   5.898 -12.150
    4    HB3  ASP  52           HB3      ASP  52 -30.867   6.673 -11.717

  No H/Q in entry =           4
  In of MODEL   26
    1    H    VAL  53           H        VAL  53 -27.943   5.485  -9.462
    2    HA   VAL  53           HA       VAL  53 -29.379   5.661  -6.947
    3    HB   VAL  53           HB       VAL  53 -30.822   4.053  -8.184
    4   HG11  VAL  53          HG11      VAL  53 -29.100   3.140  -9.703
    5   HG13  VAL  53          HG12      VAL  53 -29.968   1.872  -8.838
    6   HG12  VAL  53          HG13      VAL  53 -28.344   2.332  -8.330
    7   HG23  VAL  53          HG21      VAL  53 -30.054   2.061  -6.484
    8   HG22  VAL  53          HG22      VAL  53 -31.147   3.398  -6.122
    9   HG21  VAL  53          HG23      VAL  53 -29.437   3.524  -5.716

  No H/Q in entry =           9
  In of MODEL   26
    1    H    VAL  54           H        VAL  54 -28.078   5.199  -5.290
    2    HA   VAL  54           HA       VAL  54 -25.342   4.271  -5.899
    3    HB   VAL  54           HB       VAL  54 -26.362   6.086  -3.656
    4   HG11  VAL  54          HG11      VAL  54 -23.824   4.595  -3.942
    5   HG13  VAL  54          HG12      VAL  54 -24.557   5.301  -2.503
    6   HG12  VAL  54          HG13      VAL  54 -23.624   6.314  -3.602
    7   HG22  VAL  54          HG21      VAL  54 -25.453   7.872  -4.763
    8   HG21  VAL  54          HG22      VAL  54 -26.029   6.892  -6.110
    9   HG23  VAL  54          HG23      VAL  54 -24.321   6.871  -5.673

  No H/Q in entry =           9
  In of MODEL   26
    1    H    LEU  55           H        LEU  55 -24.804   2.336  -5.249
    2    HA   LEU  55           HA       LEU  55 -26.347   1.076  -3.068
    3    HB2  LEU  55           HB2      LEU  55 -24.825  -0.144  -5.360
    4    HB3  LEU  55           HB3      LEU  55 -25.610  -1.052  -4.067
    5    HG   LEU  55           HG       LEU  55 -27.003   0.568  -6.191
    6   HD13  LEU  55          HD11      LEU  55 -26.756  -1.297  -7.403
    7   HD12  LEU  55          HD12      LEU  55 -27.737  -2.141  -6.205
    8   HD11  LEU  55          HD13      LEU  55 -25.980  -2.125  -6.054
    9   HD23  LEU  55          HD21      LEU  55 -28.351  -1.334  -4.327
   10   HD22  LEU  55          HD22      LEU  55 -29.008   0.063  -5.180
   11   HD21  LEU  55          HD23      LEU  55 -27.981   0.296  -3.765

  No H/Q in entry =          11
  In of MODEL   26
    1    H    LEU  56           H        LEU  56 -25.212   0.457  -1.261
    2    HA   LEU  56           HA       LEU  56 -22.268   0.769  -1.313
    3    HB2  LEU  56           HB2      LEU  56 -24.075   0.618   1.087
    4    HB3  LEU  56           HB3      LEU  56 -22.354   0.999   1.074
    5    HG   LEU  56           HG       LEU  56 -24.605   2.738   0.104
    6   HD11  LEU  56          HD11      LEU  56 -23.501   2.335   2.626
    7   HD13  LEU  56          HD12      LEU  56 -24.452   3.729   2.115
    8   HD12  LEU  56          HD13      LEU  56 -22.693   3.784   2.027
    9   HD23  LEU  56          HD21      LEU  56 -22.613   4.380  -0.096
   10   HD22  LEU  56          HD22      LEU  56 -23.028   3.290  -1.419
   11   HD21  LEU  56          HD23      LEU  56 -21.685   2.903  -0.346

  No H/Q in entry =          11
  In of MODEL   26
    1    H    GLY  57           H        GLY  57 -20.935  -0.898  -0.773
    2    HA3  GLY  57           HA2      GLY  57 -21.932  -3.558  -0.959
    3    HA2  GLY  57           HA3      GLY  57 -20.296  -3.107  -0.481

  No H/Q in entry =           3
  In of MODEL   26
    1    HA   PRO  58           HA       PRO  58 -23.133  -4.052   3.232
    2    HB2  PRO  58           HB2      PRO  58 -22.523  -6.672   3.848
    3    HB3  PRO  58           HB3      PRO  58 -23.895  -6.229   2.834
    4    HG2  PRO  58           HG2      PRO  58 -21.194  -7.190   2.051
    5    HG3  PRO  58           HG3      PRO  58 -22.772  -7.608   1.381
    6    HD2  PRO  58           HD2      PRO  58 -21.112  -5.841   0.152
    7    HD3  PRO  58           HD3      PRO  58 -22.867  -5.706   0.050

  No H/Q in entry =           7
  In of MODEL   26
    1    H    GLN  59           H        GLN  59 -19.777  -4.623   2.626
    2    HA   GLN  59           HA       GLN  59 -19.022  -4.652   5.387
    3    HB2  GLN  59           HB2      GLN  59 -17.237  -3.605   3.214
    4    HB3  GLN  59           HB3      GLN  59 -16.804  -4.459   4.681
    5    HG2  GLN  59           HG2      GLN  59 -16.446  -5.965   2.907
    6    HG3  GLN  59           HG3      GLN  59 -17.928  -6.489   3.690
    7   HE21  GLN  59          HE21      GLN  59 -18.819  -7.281   2.107
    8   HE22  GLN  59          HE22      GLN  59 -19.470  -6.848   0.639

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ILE  60           H        ILE  60 -19.883  -2.083   3.169
    2    HA   ILE  60           HA       ILE  60 -18.974  -0.144   5.207
    3    HB   ILE  60           HB       ILE  60 -19.172   1.584   3.365
    4   HG12  ILE  60          HG12      ILE  60 -19.016  -0.682   1.417
    5   HG13  ILE  60          HG13      ILE  60 -20.586  -0.064   1.932
    6   HG22  ILE  60          HG21      ILE  60 -17.182  -0.497   2.598
    7   HG21  ILE  60          HG22      ILE  60 -17.071   0.353   4.139
    8   HG23  ILE  60          HG23      ILE  60 -17.017   1.258   2.627
    9   HD11  ILE  60          HD11      ILE  60 -19.498   2.263   1.271
   10   HD13  ILE  60          HD12      ILE  60 -20.241   1.225   0.057
   11   HD12  ILE  60          HD13      ILE  60 -18.489   1.237   0.252

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ALA  61           H        ALA  61 -21.474  -1.657   5.283
    2    HA   ALA  61           HA       ALA  61 -23.651   0.069   4.818
    3    HB1  ALA  61           HB1      ALA  61 -24.909  -1.379   6.149
    4    HB2  ALA  61           HB2      ALA  61 -23.523  -1.805   7.153
    5    HB3  ALA  61           HB3      ALA  61 -23.636  -2.415   5.503

  No H/Q in entry =           5
  In of MODEL   26
    1    H    TYR  62           H        TYR  62 -21.447  -0.096   7.615
    2    HA   TYR  62           HA       TYR  62 -22.953   1.612   9.280
    3    HB2  TYR  62           HB2      TYR  62 -20.877   2.008  10.491
    4    HB3  TYR  62           HB3      TYR  62 -21.029   0.298  10.084
    5    HD1  TYR  62           HD1      TYR  62 -19.495  -0.752   8.484
    6    HD2  TYR  62           HD2      TYR  62 -19.116   3.390   9.464
    7    HE1  TYR  62           HE1      TYR  62 -17.285  -0.701   7.393
    8    HE2  TYR  62           HE2      TYR  62 -16.892   3.435   8.375
    9    HH   TYR  62           HH       TYR  62 -15.196   2.029   7.672

  No H/Q in entry =           9
  In of MODEL   26
    1    H    MET  63           H        MET  63 -21.287   2.412   6.420
    2    HA   MET  63           HA       MET  63 -21.037   5.241   7.103
    3    HB2  MET  63           HB2      MET  63 -20.476   3.690   4.574
    4    HB3  MET  63           HB3      MET  63 -20.234   5.430   4.745
    5    HG2  MET  63           HG2      MET  63 -18.541   5.033   6.444
    6    HG3  MET  63           HG3      MET  63 -18.786   3.295   6.288
    7    HE3  MET  63           HE1      MET  63 -15.370   4.044   4.635
    8    HE2  MET  63           HE2      MET  63 -16.201   2.563   5.114
    9    HE1  MET  63           HE3      MET  63 -16.229   3.972   6.176

  No H/Q in entry =           9
  In of MODEL   26
    1    H    LEU  64           H        LEU  64 -23.656   3.459   6.146
    2    HA   LEU  64           HA       LEU  64 -24.824   4.904   4.063
    3    HB2  LEU  64           HB2      LEU  64 -25.754   2.829   4.989
    4    HB3  LEU  64           HB3      LEU  64 -26.185   3.690   6.465
    5    HG   LEU  64           HG       LEU  64 -27.842   4.990   5.233
    6   HD13  LEU  64          HD11      LEU  64 -27.554   5.213   3.000
    7   HD12  LEU  64          HD12      LEU  64 -28.248   3.598   2.861
    8   HD11  LEU  64          HD13      LEU  64 -26.497   3.804   2.917
    9   HD23  LEU  64          HD21      LEU  64 -28.445   2.191   4.497
   10   HD22  LEU  64          HD22      LEU  64 -29.398   3.357   5.413
   11   HD21  LEU  64          HD23      LEU  64 -28.047   2.526   6.182

  No H/Q in entry =          11
  In of MODEL   26
    1    HA   PRO  65           HA       PRO  65 -26.907   8.133   6.802
    2    HB2  PRO  65           HB2      PRO  65 -24.901   8.241   9.054
    3    HB3  PRO  65           HB3      PRO  65 -26.630   8.574   9.101
    4    HG2  PRO  65           HG2      PRO  65 -25.769   6.296  10.036
    5    HG3  PRO  65           HG3      PRO  65 -27.190   6.302   8.991
    6    HD2  PRO  65           HD2      PRO  65 -24.338   5.598   8.289
    7    HD3  PRO  65           HD3      PRO  65 -25.822   4.755   7.846

  No H/Q in entry =           7
  In of MODEL   26
    1    H    GLU  66           H        GLU  66 -23.354   7.970   6.873
    2    HA   GLU  66           HA       GLU  66 -22.971  10.756   6.457
    3    HB2  GLU  66           HB2      GLU  66 -21.231   8.392   5.813
    4    HB3  GLU  66           HB3      GLU  66 -20.729  10.068   5.598
    5    HG2  GLU  66           HG2      GLU  66 -20.927  10.455   7.965
    6    HG3  GLU  66           HG3      GLU  66 -21.504   8.805   8.204

  No H/Q in entry =           6
  In of MODEL   26
    1    H    ILE  67           H        ILE  67 -23.160   8.006   4.216
    2    HA   ILE  67           HA       ILE  67 -22.693   9.691   1.915
    3    HB   ILE  67           HB       ILE  67 -23.682   6.815   2.107
    4   HG12  ILE  67          HG12      ILE  67 -21.017   7.898   1.179
    5   HG13  ILE  67          HG13      ILE  67 -21.324   7.495   2.867
    6   HG21  ILE  67          HG21      ILE  67 -23.567   8.681  -0.126
    7   HG23  ILE  67          HG22      ILE  67 -24.244   7.054  -0.067
    8   HG22  ILE  67          HG23      ILE  67 -22.527   7.284  -0.398
    9   HD12  ILE  67          HD11      ILE  67 -20.961   5.701   0.524
   10   HD11  ILE  67          HD12      ILE  67 -21.992   5.166   1.850
   11   HD13  ILE  67          HD13      ILE  67 -20.305   5.579   2.156

  No H/Q in entry =          11
  In of MODEL   26
    1    H    GLN  68           H        GLN  68 -25.593   8.735   3.555
    2    HA   GLN  68           HA       GLN  68 -27.394   9.716   1.580
    3    HB2  GLN  68           HB2      GLN  68 -27.658   9.379   4.564
    4    HB3  GLN  68           HB3      GLN  68 -28.958  10.012   3.569
    5    HG2  GLN  68           HG2      GLN  68 -29.053   7.979   2.301
    6    HG3  GLN  68           HG3      GLN  68 -27.622   7.359   3.104
    7   HE21  GLN  68          HE21      GLN  68 -29.844   6.072   2.977
    8   HE22  GLN  68          HE22      GLN  68 -30.686   5.648   4.395

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ARG  69           H        ARG  69 -25.732  11.340   4.309
    2    HA   ARG  69           HA       ARG  69 -27.014  13.865   3.894
    3    HB2  ARG  69           HB2      ARG  69 -24.700  12.864   5.484
    4    HB3  ARG  69           HB3      ARG  69 -24.722  14.584   5.119
    5    HG2  ARG  69           HG2      ARG  69 -27.035  14.707   6.093
    6    HG3  ARG  69           HG3      ARG  69 -26.883  13.014   6.573
    7    HD2  ARG  69           HD2      ARG  69 -25.111  15.314   7.476
    8    HD3  ARG  69           HD3      ARG  69 -26.269  14.450   8.475
    9    HE   ARG  69           HE       ARG  69 -23.691  13.428   7.526
   10   HH21  ARG  69          HH11      ARG  69 -22.940  11.644   8.728
   11   HH22  ARG  69          HH12      ARG  69 -23.994  10.867   9.861
   12   HH11  ARG  69          HH21      ARG  69 -26.663  12.986   9.229
   13   HH12  ARG  69          HH22      ARG  69 -26.102  11.625  10.142

  No H/Q in entry =          13
  In of MODEL   26
    1    H    LEU  70           H        LEU  70 -24.193  12.357   2.536
    2    HA   LEU  70           HA       LEU  70 -23.003  14.679   1.358
    3    HB2  LEU  70           HB2      LEU  70 -22.086  12.332   1.961
    4    HB3  LEU  70           HB3      LEU  70 -22.718  11.881   0.378
    5    HG   LEU  70           HG       LEU  70 -21.081  13.195  -0.714
    6   HD11  LEU  70          HD11      LEU  70 -20.226  14.020   2.070
    7   HD13  LEU  70          HD12      LEU  70 -20.888  15.072   0.818
    8   HD12  LEU  70          HD13      LEU  70 -19.301  14.337   0.599
    9   HD22  LEU  70          HD21      LEU  70 -19.706  11.432  -0.476
   10   HD21  LEU  70          HD22      LEU  70 -20.648  10.946   0.933
   11   HD23  LEU  70          HD23      LEU  70 -19.227  11.971   1.132

  No H/Q in entry =          11
  In of MODEL   26
    1    H    LEU  71           H        LEU  71 -25.242  12.208   0.255
    2    HA   LEU  71           HA       LEU  71 -25.720  13.703  -2.266
    3    HB2  LEU  71           HB2      LEU  71 -26.027  10.729  -1.809
    4    HB3  LEU  71           HB3      LEU  71 -26.128  11.588  -3.344
    5    HG   LEU  71           HG       LEU  71 -23.607  11.518  -1.687
    6   HD12  LEU  71          HD11      LEU  71 -23.720   9.884  -4.113
    7   HD11  LEU  71          HD12      LEU  71 -24.750   9.302  -2.806
    8   HD13  LEU  71          HD13      LEU  71 -23.021   9.521  -2.535
    9   HD22  LEU  71          HD21      LEU  71 -23.648  13.332  -3.187
   10   HD21  LEU  71          HD22      LEU  71 -24.183  12.302  -4.515
   11   HD23  LEU  71          HD23      LEU  71 -22.567  12.101  -3.839

  No H/Q in entry =          11
  In of MODEL   26
    1    HA   PRO  72           HA       PRO  72 -29.596  13.401   0.361
    2    HB2  PRO  72           HB2      PRO  72 -30.360  15.991   0.271
    3    HB3  PRO  72           HB3      PRO  72 -29.067  15.496   1.362
    4    HG2  PRO  72           HG2      PRO  72 -28.842  16.673  -1.396
    5    HG3  PRO  72           HG3      PRO  72 -28.053  17.202   0.090
    6    HD2  PRO  72           HD2      PRO  72 -26.776  15.590  -1.672
    7    HD3  PRO  72           HD3      PRO  72 -26.525  15.420   0.066

  No H/Q in entry =           7
  In of MODEL   26
    1    H    ASN  73           H        ASN  73 -28.942  14.320  -2.858
    2    HA   ASN  73           HA       ASN  73 -31.812  14.115  -3.485
    3    HB2  ASN  73           HB2      ASN  73 -31.309  15.195  -5.588
    4    HB3  ASN  73           HB3      ASN  73 -30.749  16.161  -4.230
    5   HD21  ASN  73          HD21      ASN  73 -29.956  16.166  -6.909
    6   HD22  ASN  73          HD22      ASN  73 -28.295  15.943  -7.103

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LYS  74           H        LYS  74 -29.916  11.790  -3.055
    2    HA   LYS  74           HA       LYS  74 -30.539  10.407  -5.596
    3    HB2  LYS  74           HB2      LYS  74 -28.016  10.027  -3.977
    4    HB3  LYS  74           HB3      LYS  74 -28.432   9.223  -5.492
    5    HG2  LYS  74           HG2      LYS  74 -28.056  12.182  -5.301
    6    HG3  LYS  74           HG3      LYS  74 -26.723  11.067  -5.603
    7    HD2  LYS  74           HD2      LYS  74 -27.877  10.175  -7.541
    8    HD3  LYS  74           HD3      LYS  74 -29.258  11.226  -7.223
    9    HE2  LYS  74           HE2      LYS  74 -27.958  13.183  -7.675
   10    HE3  LYS  74           HE3      LYS  74 -26.471  12.237  -7.764
   11    HZ2  LYS  74           HZ1      LYS  74 -27.921  12.886  -9.890
   12    HZ1  LYS  74           HZ2      LYS  74 -28.632  11.391  -9.511
   13    HZ3  LYS  74           HZ3      LYS  74 -26.963  11.486  -9.811

  No H/Q in entry =          13
  In of MODEL   26
    1    HA   PRO  75           HA       PRO  75 -32.041   7.488  -2.612
    2    HB2  PRO  75           HB2      PRO  75 -32.437   5.277  -4.186
    3    HB3  PRO  75           HB3      PRO  75 -33.511   6.673  -4.259
    4    HG2  PRO  75           HG2      PRO  75 -31.200   5.981  -6.030
    5    HG3  PRO  75           HG3      PRO  75 -32.831   6.479  -6.477
    6    HD2  PRO  75           HD2      PRO  75 -30.820   8.269  -6.443
    7    HD3  PRO  75           HD3      PRO  75 -32.434   8.732  -5.905

  No H/Q in entry =           7
  In of MODEL   26
    1    H    VAL  76           H        VAL  76 -30.628   6.383  -1.236
    2    HA   VAL  76           HA       VAL  76 -28.212   5.076  -2.342
    3    HB   VAL  76           HB       VAL  76 -28.441   6.563   0.311
    4   HG11  VAL  76          HG11      VAL  76 -26.137   5.180  -1.079
    5   HG13  VAL  76          HG12      VAL  76 -26.849   4.764   0.482
    6   HG12  VAL  76          HG13      VAL  76 -25.945   6.267   0.298
    7   HG22  VAL  76          HG21      VAL  76 -27.701   8.433  -0.585
    8   HG21  VAL  76          HG22      VAL  76 -28.272   7.753  -2.110
    9   HG23  VAL  76          HG23      VAL  76 -26.574   7.602  -1.656

  No H/Q in entry =           9
  In of MODEL   26
    1    H    GLU  77           H        GLU  77 -28.077   2.918  -1.720
    2    HA   GLU  77           HA       GLU  77 -28.890   2.172   0.937
    3    HB2  GLU  77           HB2      GLU  77 -30.560   0.585   0.415
    4    HB3  GLU  77           HB3      GLU  77 -31.051   2.125  -0.292
    5    HG2  GLU  77           HG2      GLU  77 -30.474   1.336  -2.477
    6    HG3  GLU  77           HG3      GLU  77 -29.889  -0.182  -1.799

  No H/Q in entry =           6
  In of MODEL   26
    1    H    VAL  78           H        VAL  78 -28.643   0.077   1.605
    2    HA   VAL  78           HA       VAL  78 -26.009  -0.800   0.718
    3    HB   VAL  78           HB       VAL  78 -27.747  -1.608   3.089
    4   HG11  VAL  78          HG11      VAL  78 -25.457  -2.930   1.967
    5   HG13  VAL  78          HG12      VAL  78 -26.380  -3.360   3.408
    6   HG12  VAL  78          HG13      VAL  78 -25.018  -2.248   3.533
    7   HG22  VAL  78          HG21      VAL  78 -26.235  -0.297   4.420
    8   HG21  VAL  78          HG22      VAL  78 -26.936   0.695   3.142
    9   HG23  VAL  78          HG23      VAL  78 -25.280   0.104   2.993

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ILE  79           H        ILE  79 -25.545  -2.730  -0.179
    2    HA   ILE  79           HA       ILE  79 -27.662  -4.134  -1.519
    3    HB   ILE  79           HB       ILE  79 -24.693  -4.774  -1.298
    4   HG12  ILE  79          HG12      ILE  79 -26.289  -3.618  -3.590
    5   HG13  ILE  79          HG13      ILE  79 -25.376  -2.637  -2.442
    6   HG22  ILE  79          HG21      ILE  79 -25.842  -5.921  -3.611
    7   HG21  ILE  79          HG22      ILE  79 -26.844  -6.398  -2.241
    8   HG23  ILE  79          HG23      ILE  79 -25.115  -6.743  -2.231
    9   HD13  ILE  79          HD11      ILE  79 -23.970  -2.812  -4.261
   10   HD12  ILE  79          HD12      ILE  79 -24.374  -4.507  -4.534
   11   HD11  ILE  79          HD13      ILE  79 -23.370  -4.050  -3.157

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ASP  80           H        ASP  80 -28.599  -6.021  -0.927
    2    HA   ASP  80           HA       ASP  80 -28.577  -6.911   1.724
    3    HB2  ASP  80           HB2      ASP  80 -30.353  -7.427   0.088
    4    HB3  ASP  80           HB3      ASP  80 -29.235  -8.482  -0.777

  No H/Q in entry =           4
  In of MODEL   26
    1    H    SER  81           H        SER  81 -27.085  -8.099   2.858
    2    HA   SER  81           HA       SER  81 -24.617  -8.880   1.666
    3    HB2  SER  81           HB2      SER  81 -24.101  -9.919   3.840
    4    HB3  SER  81           HB3      SER  81 -24.743  -8.290   4.047
    5    HG   SER  81           HG       SER  81 -26.801  -9.315   4.396

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU  82           H        LEU  82 -27.404 -10.866   2.000
    2    HA   LEU  82           HA       LEU  82 -25.949 -13.293   1.489
    3    HB2  LEU  82           HB2      LEU  82 -28.860 -12.572   1.225
    4    HB3  LEU  82           HB3      LEU  82 -28.213 -14.201   1.036
    5    HG   LEU  82           HG       LEU  82 -28.107 -12.592   3.570
    6   HD13  LEU  82          HD11      LEU  82 -30.399 -13.174   3.098
    7   HD12  LEU  82          HD12      LEU  82 -29.796 -14.301   4.315
    8   HD11  LEU  82          HD13      LEU  82 -29.936 -14.812   2.632
    9   HD21  LEU  82          HD21      LEU  82 -27.217 -15.327   2.703
   10   HD23  LEU  82          HD22      LEU  82 -27.583 -14.987   4.393
   11   HD22  LEU  82          HD23      LEU  82 -26.305 -14.091   3.573

  No H/Q in entry =          11
  In of MODEL   26
    1    H    LEU  83           H        LEU  83 -27.822 -11.004  -0.438
    2    HA   LEU  83           HA       LEU  83 -27.675 -12.380  -2.904
    3    HB2  LEU  83           HB2      LEU  83 -27.974  -9.457  -2.269
    4    HB3  LEU  83           HB3      LEU  83 -28.032 -10.107  -3.907
    5    HG   LEU  83           HG       LEU  83 -30.077 -10.406  -1.727
    6   HD13  LEU  83          HD11      LEU  83 -30.763  -8.536  -2.799
    7   HD12  LEU  83          HD12      LEU  83 -31.270  -9.637  -4.079
    8   HD11  LEU  83          HD13      LEU  83 -29.703  -8.830  -4.176
    9   HD23  LEU  83          HD21      LEU  83 -30.266 -11.671  -4.446
   10   HD22  LEU  83          HD22      LEU  83 -31.247 -11.977  -3.012
   11   HD21  LEU  83          HD23      LEU  83 -29.580 -12.545  -3.076

  No H/Q in entry =          11
  In of MODEL   26
    1    H    TYR  84           H        TYR  84 -25.632 -10.063  -1.240
    2    HA   TYR  84           HA       TYR  84 -23.754  -9.657  -3.374
    3    HB2  TYR  84           HB2      TYR  84 -24.197  -8.124  -1.388
    4    HB3  TYR  84           HB3      TYR  84 -23.272  -9.270  -0.420
    5    HD1  TYR  84           HD1      TYR  84 -20.875  -9.391  -0.580
    6    HD2  TYR  84           HD2      TYR  84 -23.080  -6.785  -3.146
    7    HE1  TYR  84           HE1      TYR  84 -18.766  -8.299  -1.263
    8    HE2  TYR  84           HE2      TYR  84 -20.979  -5.691  -3.846
    9    HH   TYR  84           HH       TYR  84 -18.748  -5.706  -3.674

  No H/Q in entry =           9
  In of MODEL   26
    1    H    GLY  85           H        GLY  85 -23.588 -11.653  -0.418
    2    HA3  GLY  85           HA2      GLY  85 -21.048 -12.696  -0.899
    3    HA2  GLY  85           HA3      GLY  85 -22.309 -13.491   0.043

  No H/Q in entry =           3
  In of MODEL   26
    1    H    LYS  86           H        LYS  86 -24.171 -13.803  -2.014
    2    HA   LYS  86           HA       LYS  86 -23.210 -16.222  -3.262
    3    HB2  LYS  86           HB2      LYS  86 -25.460 -15.918  -2.280
    4    HB3  LYS  86           HB3      LYS  86 -25.807 -14.701  -3.505
    5    HG2  LYS  86           HG2      LYS  86 -25.666 -16.403  -5.227
    6    HG3  LYS  86           HG3      LYS  86 -25.340 -17.618  -3.990
    7    HD2  LYS  86           HD2      LYS  86 -27.734 -15.807  -3.827
    8    HD3  LYS  86           HD3      LYS  86 -27.784 -17.309  -4.747
    9    HE2  LYS  86           HE2      LYS  86 -26.942 -18.439  -2.618
   10    HE3  LYS  86           HE3      LYS  86 -27.366 -16.937  -1.797
   11    HZ1  LYS  86           HZ1      LYS  86 -29.421 -17.912  -3.564
   12    HZ3  LYS  86           HZ2      LYS  86 -29.537 -17.377  -1.955
   13    HZ2  LYS  86           HZ3      LYS  86 -29.072 -18.975  -2.285

  No H/Q in entry =          13
  In of MODEL   26
    1    H    VAL  87           H        VAL  87 -23.077 -13.014  -4.172
    2    HA   VAL  87           HA       VAL  87 -22.736 -11.862  -6.119
    3    HB   VAL  87           HB       VAL  87 -21.768 -14.413  -7.439
    4   HG13  VAL  87          HG11      VAL  87 -20.390 -12.977  -8.686
    5   HG12  VAL  87          HG12      VAL  87 -20.475 -11.694  -7.478
    6   HG11  VAL  87          HG13      VAL  87 -21.867 -12.034  -8.506
    7   HG23  VAL  87          HG21      VAL  87 -19.515 -13.873  -6.400
    8   HG22  VAL  87          HG22      VAL  87 -20.710 -14.640  -5.356
    9   HG21  VAL  87          HG23      VAL  87 -20.409 -12.908  -5.227

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ASP  88           H        ASP  88 -25.274 -12.406  -5.762
    2    HA   ASP  88           HA       ASP  88 -26.444 -13.591  -8.151
    3    HB2  ASP  88           HB2      ASP  88 -27.445 -13.787  -5.824
    4    HB3  ASP  88           HB3      ASP  88 -27.833 -12.071  -5.932

  No H/Q in entry =           4
  In of MODEL   26
    1    H    GLY  89           H        GLY  89 -25.695 -12.369  -9.800
    2    HA3  GLY  89           HA2      GLY  89 -25.772  -9.593 -10.014
    3    HA2  GLY  89           HA3      GLY  89 -25.792 -10.721 -11.369

  No H/Q in entry =           3
  In of MODEL   26
    1    H    LEU  90           H        LEU  90 -28.287 -11.978 -10.910
    2    HA   LEU  90           HA       LEU  90 -30.026  -9.982 -12.032
    3    HB2  LEU  90           HB2      LEU  90 -30.182 -12.377 -12.600
    4    HB3  LEU  90           HB3      LEU  90 -30.699 -12.715 -10.948
    5    HG   LEU  90           HG       LEU  90 -32.775 -11.522 -11.314
    6   HD13  LEU  90          HD11      LEU  90 -32.532  -9.796 -12.798
    7   HD12  LEU  90          HD12      LEU  90 -33.120 -11.018 -13.928
    8   HD11  LEU  90          HD13      LEU  90 -31.391 -10.687 -13.808
    9   HD23  LEU  90          HD21      LEU  90 -32.770 -13.165 -13.741
   10   HD22  LEU  90          HD22      LEU  90 -33.752 -13.286 -12.281
   11   HD21  LEU  90          HD23      LEU  90 -32.123 -13.960 -12.305

  No H/Q in entry =          11
  In of MODEL   26
    1    H    GLY  91           H        GLY  91 -29.909 -11.472  -8.840
    2    HA3  GLY  91           HA2      GLY  91 -32.202 -10.268  -7.803
    3    HA2  GLY  91           HA3      GLY  91 -30.830 -10.847  -6.860

  No H/Q in entry =           3
  In of MODEL   26
    1    H    VAL  92           H        VAL  92 -28.847  -9.098  -7.729
    2    HA   VAL  92           HA       VAL  92 -29.549  -6.761  -6.191
    3    HB   VAL  92           HB       VAL  92 -27.024  -7.332  -7.787
    4   HG12  VAL  92          HG11      VAL  92 -27.115  -5.430  -5.471
    5   HG11  VAL  92          HG12      VAL  92 -27.762  -4.870  -7.014
    6   HG13  VAL  92          HG13      VAL  92 -26.085  -5.401  -6.902
    7   HG22  VAL  92          HG21      VAL  92 -26.857  -8.919  -6.188
    8   HG21  VAL  92          HG22      VAL  92 -27.971  -8.092  -5.097
    9   HG23  VAL  92          HG23      VAL  92 -26.296  -7.553  -5.224

  No H/Q in entry =           9
  In of MODEL   26
    1    H    LEU  93           H        LEU  93 -29.172  -7.455  -9.608
    2    HA   LEU  93           HA       LEU  93 -29.422  -4.813 -10.551
    3    HB2  LEU  93           HB2      LEU  93 -28.852  -6.698 -12.003
    4    HB3  LEU  93           HB3      LEU  93 -30.469  -7.365 -11.774
    5    HG   LEU  93           HG       LEU  93 -31.409  -5.372 -12.908
    6   HD11  LEU  93          HD11      LEU  93 -29.499  -3.843 -12.415
    7   HD13  LEU  93          HD12      LEU  93 -29.943  -3.865 -14.122
    8   HD12  LEU  93          HD13      LEU  93 -28.522  -4.751 -13.569
    9   HD23  LEU  93          HD21      LEU  93 -30.397  -5.989 -15.194
   10   HD22  LEU  93          HD22      LEU  93 -31.283  -7.209 -14.279
   11   HD21  LEU  93          HD23      LEU  93 -29.518  -7.218 -14.285

  No H/Q in entry =          11
  In of MODEL   26
    1    H    LYS  94           H        LYS  94 -31.888  -7.265  -9.684
    2    HA   LYS  94           HA       LYS  94 -34.179  -5.740 -10.312
    3    HB2  LYS  94           HB2      LYS  94 -33.741  -7.932  -8.290
    4    HB3  LYS  94           HB3      LYS  94 -35.313  -7.179  -8.558
    5    HG2  LYS  94           HG2      LYS  94 -35.260  -7.970 -10.889
    6    HG3  LYS  94           HG3      LYS  94 -33.728  -8.777 -10.560
    7    HD2  LYS  94           HD2      LYS  94 -34.893 -10.058  -8.725
    8    HD3  LYS  94           HD3      LYS  94 -36.412  -9.357  -9.281
    9    HE2  LYS  94           HE2      LYS  94 -35.936 -10.317 -11.544
   10    HE3  LYS  94           HE3      LYS  94 -34.550 -11.148 -10.839
   11    HZ3  LYS  94           HZ1      LYS  94 -36.455 -12.601 -10.997
   12    HZ2  LYS  94           HZ2      LYS  94 -37.388 -11.535 -10.059
   13    HZ1  LYS  94           HZ3      LYS  94 -36.056 -12.329  -9.369

  No H/Q in entry =          13
  In of MODEL   26
    1    H    ALA  95           H        ALA  95 -32.354  -5.913  -7.266
    2    HA   ALA  95           HA       ALA  95 -34.141  -4.258  -5.791
    3    HB2  ALA  95           HB1      ALA  95 -31.817  -5.717  -5.252
    4    HB3  ALA  95           HB2      ALA  95 -32.759  -4.771  -4.101
    5    HB1  ALA  95           HB3      ALA  95 -31.384  -4.039  -4.929

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA  96           H        ALA  96 -31.474  -3.513  -7.898
    2    HA   ALA  96           HA       ALA  96 -31.273  -0.754  -7.139
    3    HB2  ALA  96           HB1      ALA  96 -29.907  -0.589  -9.251
    4    HB3  ALA  96           HB2      ALA  96 -30.275  -2.285  -9.562
    5    HB1  ALA  96           HB3      ALA  96 -29.341  -1.833  -8.137

  No H/Q in entry =           5
  In of MODEL   26
    1    H    VAL  97           H        VAL  97 -32.873  -2.423  -9.813
    2    HA   VAL  97           HA       VAL  97 -33.858  -0.090 -11.079
    3    HB   VAL  97           HB       VAL  97 -34.778  -2.983 -11.105
    4   HG11  VAL  97          HG11      VAL  97 -36.494  -0.913 -11.598
    5   HG13  VAL  97          HG12      VAL  97 -36.615  -2.506 -12.346
    6   HG12  VAL  97          HG13      VAL  97 -35.812  -1.191 -13.201
    7   HG21  VAL  97          HG21      VAL  97 -33.435  -1.216 -13.151
    8   HG23  VAL  97          HG22      VAL  97 -33.952  -2.878 -13.431
    9   HG22  VAL  97          HG23      VAL  97 -32.687  -2.534 -12.251

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ALA  98           H        ALA  98 -35.118  -2.210  -8.529
    2    HA   ALA  98           HA       ALA  98 -37.632  -0.962  -8.179
    3    HB1  ALA  98           HB1      ALA  98 -36.702  -3.194  -7.138
    4    HB3  ALA  98           HB2      ALA  98 -37.843  -2.221  -6.208
    5    HB2  ALA  98           HB3      ALA  98 -36.118  -2.136  -5.853

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA  99           H        ALA  99 -34.521  -0.276  -6.542
    2    HA   ALA  99           HA       ALA  99 -35.569   1.758  -4.887
    3    HB1  ALA  99           HB1      ALA  99 -32.958   0.763  -5.635
    4    HB2  ALA  99           HB2      ALA  99 -33.475   1.540  -4.139
    5    HB3  ALA  99           HB3      ALA  99 -32.964   2.521  -5.512

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ILE 100           H        ILE 100 -34.531   1.833  -8.245
    2    HA   ILE 100           HA       ILE 100 -34.597   4.684  -8.476
    3    HB   ILE 100           HB       ILE 100 -34.783   2.526 -10.606
    4   HG12  ILE 100          HG12      ILE 100 -32.540   4.434  -9.948
    5   HG13  ILE 100          HG13      ILE 100 -32.640   2.792  -9.311
    6   HG21  ILE 100          HG21      ILE 100 -35.089   5.460 -10.748
    7   HG23  ILE 100          HG22      ILE 100 -35.648   4.208 -11.858
    8   HG22  ILE 100          HG23      ILE 100 -33.973   4.757 -11.918
    9   HD12  ILE 100          HD11      ILE 100 -32.077   3.716 -12.089
   10   HD11  ILE 100          HD12      ILE 100 -32.800   2.129 -11.826
   11   HD13  ILE 100          HD13      ILE 100 -31.236   2.514 -11.112

  No H/Q in entry =          11
  In of MODEL   26
    1    H    LYS 101           H        LYS 101 -36.994   2.166  -9.187
    2    HA   LYS 101           HA       LYS 101 -39.010   3.892 -10.190
    3    HB2  LYS 101           HB2      LYS 101 -39.003   1.121  -9.051
    4    HB3  LYS 101           HB3      LYS 101 -40.524   1.942  -9.396
    5    HG2  LYS 101           HG2      LYS 101 -40.050   2.048 -11.695
    6    HG3  LYS 101           HG3      LYS 101 -38.370   1.577 -11.441
    7    HD2  LYS 101           HD2      LYS 101 -39.698  -0.283 -12.317
    8    HD3  LYS 101           HD3      LYS 101 -39.081  -0.632 -10.702
    9    HE2  LYS 101           HE2      LYS 101 -41.169  -1.242 -10.189
   10    HE3  LYS 101           HE3      LYS 101 -41.557   0.480 -10.198
   11    HZ3  LYS 101           HZ1      LYS 101 -42.459   0.349 -12.313
   12    HZ2  LYS 101           HZ2      LYS 101 -42.977  -1.102 -11.599
   13    HZ1  LYS 101           HZ3      LYS 101 -41.671  -1.110 -12.685

  No H/Q in entry =          13
  In of MODEL   26
    1    H    LYS 102           H        LYS 102 -38.571   2.410  -6.975
    2    HA   LYS 102           HA       LYS 102 -40.766   3.699  -5.778
    3    HB2  LYS 102           HB2      LYS 102 -39.603   1.788  -4.758
    4    HB3  LYS 102           HB3      LYS 102 -38.172   2.788  -4.521
    5    HG2  LYS 102           HG2      LYS 102 -39.428   4.240  -3.028
    6    HG3  LYS 102           HG3      LYS 102 -40.864   3.245  -3.266
    7    HD2  LYS 102           HD2      LYS 102 -39.711   1.335  -2.235
    8    HD3  LYS 102           HD3      LYS 102 -38.276   2.332  -1.995
    9    HE2  LYS 102           HE2      LYS 102 -39.567   3.868  -0.590
   10    HE3  LYS 102           HE3      LYS 102 -41.019   2.903  -0.851
   11    HZ1  LYS 102           HZ1      LYS 102 -39.368   1.084   0.156
   12    HZ3  LYS 102           HZ2      LYS 102 -40.440   2.017   1.084
   13    HZ2  LYS 102           HZ3      LYS 102 -38.810   2.476   0.952

  No H/Q in entry =          13
  In of MODEL   26
    1    H    ALA 103           H        ALA 103 -37.761   4.967  -6.801
    2    HA   ALA 103           HA       ALA 103 -37.888   7.295  -5.028
    3    HB2  ALA 103           HB1      ALA 103 -35.872   7.943  -6.610
    4    HB3  ALA 103           HB2      ALA 103 -35.906   6.224  -7.002
    5    HB1  ALA 103           HB3      ALA 103 -35.655   6.744  -5.336

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA 104           H        ALA 104 -38.543   6.577  -8.370
    2    HA   ALA 104           HA       ALA 104 -39.018   9.381  -9.002
    3    HB2  ALA 104           HB1      ALA 104 -39.091   8.707 -11.202
    4    HB1  ALA 104           HB2      ALA 104 -39.880   7.177 -10.817
    5    HB3  ALA 104           HB3      ALA 104 -38.148   7.372 -10.542

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA 105           H        ALA 105 -40.706   7.348  -7.187
    2    HA   ALA 105           HA       ALA 105 -43.073   8.839  -7.161
    3    HB2  ALA 105           HB1      ALA 105 -43.855   8.002  -9.196
    4    HB3  ALA 105           HB2      ALA 105 -44.537   6.844  -8.053
    5    HB1  ALA 105           HB3      ALA 105 -43.084   6.433  -8.964

  No H/Q in entry =           5
  In of MODEL   27
    1    H1   ALA   1           H3       ALA   1 -12.076 -16.022  -2.394
    2    H2   ALA   1           H2       ALA   1 -11.122 -17.155  -3.233
    3    H3   ALA   1           H1       ALA   1 -12.278 -16.225  -4.067
    4    HA   ALA   1           HA       ALA   1 -13.656 -17.941  -3.823
    5    HB3  ALA   1           HB1      ALA   1 -12.239 -19.696  -3.359
    6    HB1  ALA   1           HB2      ALA   1 -12.995 -19.589  -1.770
    7    HB2  ALA   1           HB3      ALA   1 -11.428 -18.831  -2.053

  No H/Q in entry =           7
  In of MODEL   27
    1    H    GLU   2           H        GLU   2 -15.267 -18.812  -2.166
    2    HA   GLU   2           HA       GLU   2 -16.934 -17.109  -1.108
    3    HB2  GLU   2           HB2      GLU   2 -15.965 -19.521   0.440
    4    HB3  GLU   2           HB3      GLU   2 -17.499 -18.688   0.694
    5    HG2  GLU   2           HG2      GLU   2 -18.467 -19.789  -1.038
    6    HG3  GLU   2           HG3      GLU   2 -17.150 -19.374  -2.124

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLU   3           H        GLU   3 -15.004 -18.435   1.515
    2    HA   GLU   3           HA       GLU   3 -15.251 -16.081   3.069
    3    HB2  GLU   3           HB2      GLU   3 -13.636 -18.609   3.322
    4    HB3  GLU   3           HB3      GLU   3 -13.419 -17.285   4.467
    5    HG2  GLU   3           HG2      GLU   3 -15.610 -17.460   5.287
    6    HG3  GLU   3           HG3      GLU   3 -16.197 -18.270   3.840

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LEU   4           H        LEU   4 -12.281 -17.528   1.678
    2    HA   LEU   4           HA       LEU   4 -10.468 -15.603   2.271
    3    HB2  LEU   4           HB2      LEU   4 -10.686 -16.908  -0.452
    4    HB3  LEU   4           HB3      LEU   4  -9.242 -16.169   0.231
    5    HG   LEU   4           HG       LEU   4 -10.707 -18.581   1.349
    6   HD13  LEU   4          HD11      LEU   4  -9.060 -19.920   0.421
    7   HD12  LEU   4          HD12      LEU   4  -7.865 -18.623   0.391
    8   HD11  LEU   4          HD13      LEU   4  -9.155 -18.662  -0.811
    9   HD23  LEU   4          HD21      LEU   4  -8.454 -18.617   2.729
   10   HD22  LEU   4          HD22      LEU   4  -9.787 -17.591   3.257
   11   HD21  LEU   4          HD23      LEU   4  -8.433 -16.888   2.373

  No H/Q in entry =          11
  In of MODEL   27
    1    H    GLU   5           H        GLU   5 -12.808 -15.428  -0.402
    2    HA   GLU   5           HA       GLU   5 -11.834 -12.934  -1.408
    3    HB2  GLU   5           HB2      GLU   5 -13.162 -14.537  -2.767
    4    HB3  GLU   5           HB3      GLU   5 -14.565 -14.192  -1.756
    5    HG2  GLU   5           HG2      GLU   5 -14.472 -11.824  -2.400
    6    HG3  GLU   5           HG3      GLU   5 -13.040 -12.138  -3.383

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLU   6           H        GLU   6 -14.547 -13.840   0.688
    2    HA   GLU   6           HA       GLU   6 -15.482 -11.173   1.084
    3    HB2  GLU   6           HB2      GLU   6 -16.886 -13.178   1.487
    4    HB3  GLU   6           HB3      GLU   6 -15.847 -13.613   2.844
    5    HG2  GLU   6           HG2      GLU   6 -16.398 -11.500   3.966
    6    HG3  GLU   6           HG3      GLU   6 -17.404 -11.022   2.601

  No H/Q in entry =           6
  In of MODEL   27
    1    H    VAL   7           H        VAL   7 -13.149 -13.255   2.657
    2    HA   VAL   7           HA       VAL   7 -12.699 -11.670   4.981
    3    HB   VAL   7           HB       VAL   7 -10.974 -13.697   3.534
    4   HG11  VAL   7          HG11      VAL   7 -10.521 -12.154   6.095
    5   HG13  VAL   7          HG12      VAL   7  -9.420 -12.358   4.734
    6   HG12  VAL   7          HG13      VAL   7  -9.756 -13.717   5.807
    7   HG21  VAL   7          HG21      VAL   7 -13.217 -14.284   4.757
    8   HG23  VAL   7          HG22      VAL   7 -12.292 -13.997   6.231
    9   HG22  VAL   7          HG23      VAL   7 -11.785 -15.253   5.103

  No H/Q in entry =           9
  In of MODEL   27
    1    H    VAL   8           H        VAL   8 -11.189 -11.773   1.770
    2    HA   VAL   8           HA       VAL   8  -9.147  -9.876   2.258
    3    HB   VAL   8           HB       VAL   8 -10.605 -10.582  -0.300
    4   HG13  VAL   8          HG11      VAL   8  -9.647  -8.378  -0.563
    5   HG12  VAL   8          HG12      VAL   8  -8.584  -9.520  -1.388
    6   HG11  VAL   8          HG13      VAL   8  -8.139  -8.889   0.198
    7   HG22  VAL   8          HG21      VAL   8  -9.069 -12.285  -0.553
    8   HG21  VAL   8          HG22      VAL   8  -8.910 -12.145   1.195
    9   HG23  VAL   8          HG23      VAL   8  -7.755 -11.334   0.143

  No H/Q in entry =           9
  In of MODEL   27
    1    H    MET   9           H        MET   9 -12.498  -9.527   1.100
    2    HA   MET   9           HA       MET   9 -12.467  -6.750   0.660
    3    HB2  MET   9           HB2      MET   9 -14.624  -8.703   1.410
    4    HB3  MET   9           HB3      MET   9 -14.972  -6.973   1.367
    5    HG2  MET   9           HG2      MET   9 -13.926  -6.986  -0.978
    6    HG3  MET   9           HG3      MET   9 -14.041  -8.744  -0.897
    7    HE1  MET   9           HE1      MET   9 -15.847 -10.091  -0.832
    8    HE3  MET   9           HE2      MET   9 -17.547  -9.712  -1.093
    9    HE2  MET   9           HE3      MET   9 -16.837  -9.493   0.505

  No H/Q in entry =           9
  In of MODEL   27
    1    H    GLY  10           H        GLY  10 -13.106  -8.644   3.591
    2    HA3  GLY  10           HA2      GLY  10 -13.678  -6.462   5.306
    3    HA2  GLY  10           HA3      GLY  10 -13.095  -8.043   5.823

  No H/Q in entry =           3
  In of MODEL   27
    1    H    LEU  11           H        LEU  11 -10.649  -8.141   4.507
    2    HA   LEU  11           HA       LEU  11  -8.965  -6.684   6.260
    3    HB2  LEU  11           HB2      LEU  11  -8.403  -8.106   3.655
    4    HB3  LEU  11           HB3      LEU  11  -7.140  -7.385   4.651
    5    HG   LEU  11           HG       LEU  11  -9.117  -9.440   5.673
    6   HD13  LEU  11          HD11      LEU  11  -7.882 -10.665   4.110
    7   HD12  LEU  11          HD12      LEU  11  -6.943 -10.889   5.585
    8   HD11  LEU  11          HD13      LEU  11  -6.417  -9.720   4.375
    9   HD22  LEU  11          HD21      LEU  11  -8.275  -8.413   7.587
   10   HD21  LEU  11          HD22      LEU  11  -6.743  -7.995   6.822
   11   HD23  LEU  11          HD23      LEU  11  -7.049  -9.654   7.335

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  12           H        ILE  12  -9.875  -6.155   2.870
    2    HA   ILE  12           HA       ILE  12  -8.211  -3.905   2.438
    3    HB   ILE  12           HB       ILE  12 -10.851  -4.632   1.146
    4   HG12  ILE  12          HG12      ILE  12  -8.788  -6.231   1.048
    5   HG13  ILE  12          HG13      ILE  12  -9.628  -5.857  -0.444
    6   HG21  ILE  12          HG21      ILE  12  -8.687  -2.676   0.305
    7   HG23  ILE  12          HG22      ILE  12 -10.351  -2.282   0.717
    8   HG22  ILE  12          HG23      ILE  12  -9.990  -3.209  -0.712
    9   HD13  ILE  12          HD11      ILE  12  -7.921  -4.237  -1.031
   10   HD12  ILE  12          HD12      ILE  12  -7.131  -5.755  -0.613
   11   HD11  ILE  12          HD13      ILE  12  -7.146  -4.431   0.529

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  13           H        ILE  13 -11.568  -4.212   3.533
    2    HA   ILE  13           HA       ILE  13 -12.062  -1.430   3.798
    3    HB   ILE  13           HB       ILE  13 -13.236  -3.863   5.164
    4   HG12  ILE  13          HG12      ILE  13 -13.467  -3.314   2.624
    5   HG13  ILE  13          HG13      ILE  13 -14.881  -3.809   3.530
    6   HG23  ILE  13          HG21      ILE  13 -13.868  -2.290   6.726
    7   HG22  ILE  13          HG22      ILE  13 -15.172  -2.060   5.568
    8   HG21  ILE  13          HG23      ILE  13 -13.802  -0.953   5.582
    9   HD13  ILE  13          HD11      ILE  13 -15.633  -1.516   3.754
   10   HD12  ILE  13          HD12      ILE  13 -15.268  -1.826   2.068
   11   HD11  ILE  13          HD13      ILE  13 -14.126  -0.927   3.042

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ASN  14           H        ASN  14 -10.918  -3.902   6.077
    2    HA   ASN  14           HA       ASN  14 -10.738  -2.257   8.359
    3    HB2  ASN  14           HB2      ASN  14 -10.451  -4.861   8.042
    4    HB3  ASN  14           HB3      ASN  14  -8.747  -4.453   7.884
    5   HD21  ASN  14          HD21      ASN  14  -9.363  -5.981  10.063
    6   HD22  ASN  14          HD22      ASN  14  -9.347  -5.057  11.485

  No H/Q in entry =           6
  In of MODEL   27
    1    H    SER  15           H        SER  15  -8.326  -3.054   5.868
    2    HA   SER  15           HA       SER  15  -6.202  -1.531   6.936
    3    HB2  SER  15           HB2      SER  15  -5.180  -1.736   4.777
    4    HB3  SER  15           HB3      SER  15  -6.115  -3.209   5.007
    5    HG   SER  15           HG       SER  15  -7.502  -2.584   3.525

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLY  16           H        GLY  16  -8.816  -0.703   4.688
    2    HA3  GLY  16           HA2      GLY  16  -7.994   1.948   4.131
    3    HA2  GLY  16           HA3      GLY  16  -9.637   1.330   3.971

  No H/Q in entry =           3
  In of MODEL   27
    1    H    GLN  17           H        GLN  17 -10.168   0.603   6.623
    2    HA   GLN  17           HA       GLN  17 -10.910   3.100   7.758
    3    HB2  GLN  17           HB2      GLN  17 -10.774   0.319   8.940
    4    HB3  GLN  17           HB3      GLN  17 -11.411   1.712   9.815
    5    HG2  GLN  17           HG2      GLN  17 -12.431   0.795   7.111
    6    HG3  GLN  17           HG3      GLN  17 -13.182   0.366   8.647
    7   HE21  GLN  17          HE21      GLN  17 -14.417   1.994   9.751
    8   HE22  GLN  17          HE22      GLN  17 -14.734   3.515   9.067

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ALA  18           H        ALA  18  -8.249   0.857   8.381
    2    HA   ALA  18           HA       ALA  18  -7.168   2.093  10.649
    3    HB2  ALA  18           HB1      ALA  18  -6.527  -0.117   9.286
    4    HB3  ALA  18           HB2      ALA  18  -5.375   0.685  10.355
    5    HB1  ALA  18           HB3      ALA  18  -5.302   0.961   8.613

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ARG  19           H        ARG  19  -6.405   2.621   7.199
    2    HA   ARG  19           HA       ARG  19  -4.537   4.696   7.623
    3    HB2  ARG  19           HB2      ARG  19  -4.848   3.546   5.430
    4    HB3  ARG  19           HB3      ARG  19  -6.403   4.364   5.252
    5    HG2  ARG  19           HG2      ARG  19  -5.306   6.552   5.315
    6    HG3  ARG  19           HG3      ARG  19  -3.746   5.790   5.620
    7    HD2  ARG  19           HD2      ARG  19  -3.880   6.373   3.276
    8    HD3  ARG  19           HD3      ARG  19  -3.939   4.612   3.425
    9    HE   ARG  19           HE       ARG  19  -6.586   5.483   3.417
   10   HH21  ARG  19          HH11      ARG  19  -7.784   5.617   1.499
   11   HH22  ARG  19          HH12      ARG  19  -6.964   5.704  -0.021
   12   HH11  ARG  19          HH21      ARG  19  -3.812   5.583   1.382
   13   HH12  ARG  19          HH22      ARG  19  -4.714   5.681  -0.087

  No H/Q in entry =          13
  In of MODEL   27
    1    H    SER  20           H        SER  20  -8.036   4.758   7.024
    2    HA   SER  20           HA       SER  20  -8.435   7.508   6.969
    3    HB2  SER  20           HB2      SER  20 -10.206   5.865   6.477
    4    HB3  SER  20           HB3      SER  20 -10.251   5.412   8.180
    5    HG   SER  20           HG       SER  20 -11.198   7.676   6.890

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU  21           H        LEU  21  -8.402   5.332   9.778
    2    HA   LEU  21           HA       LEU  21  -8.872   7.325  11.739
    3    HB2  LEU  21           HB2      LEU  21  -7.475   4.646  11.907
    4    HB3  LEU  21           HB3      LEU  21  -7.808   5.662  13.308
    5    HG   LEU  21           HG       LEU  21  -9.953   4.721  11.381
    6   HD12  LEU  21          HD11      LEU  21 -10.530   3.073  13.154
    7   HD11  LEU  21          HD12      LEU  21  -9.085   3.551  14.043
    8   HD13  LEU  21          HD13      LEU  21  -8.934   2.778  12.463
    9   HD22  LEU  21          HD21      LEU  21 -10.885   6.532  12.537
   10   HD21  LEU  21          HD22      LEU  21  -9.939   6.241  13.992
   11   HD23  LEU  21          HD23      LEU  21 -11.309   5.207  13.617

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ALA  22           H        ALA  22  -5.899   5.994  10.334
    2    HA   ALA  22           HA       ALA  22  -4.040   7.340  11.953
    3    HB2  ALA  22           HB1      ALA  22  -3.595   5.489  10.266
    4    HB1  ALA  22           HB2      ALA  22  -2.419   6.804  10.298
    5    HB3  ALA  22           HB3      ALA  22  -3.637   6.738   9.022

  No H/Q in entry =           5
  In of MODEL   27
    1    H    TYR  23           H        TYR  23  -5.373   8.329   8.768
    2    HA   TYR  23           HA       TYR  23  -4.076  10.846   8.692
    3    HB2  TYR  23           HB2      TYR  23  -5.141   9.914   6.702
    4    HB3  TYR  23           HB3      TYR  23  -6.722   9.995   7.483
    5    HD1  TYR  23           HD1      TYR  23  -3.847  12.097   6.359
    6    HD2  TYR  23           HD2      TYR  23  -8.004  11.973   7.431
    7    HE1  TYR  23           HE1      TYR  23  -4.112  14.442   5.595
    8    HE2  TYR  23           HE2      TYR  23  -8.270  14.318   6.666
    9    HH   TYR  23           HH       TYR  23  -5.785  15.965   4.897

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ALA  24           H        ALA  24  -7.180   9.823  10.074
    2    HA   ALA  24           HA       ALA  24  -8.057  12.401  10.839
    3    HB1  ALA  24           HB1      ALA  24  -9.855  11.123  11.309
    4    HB2  ALA  24           HB2      ALA  24  -9.021  10.567  12.758
    5    HB3  ALA  24           HB3      ALA  24  -8.881   9.654  11.257

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA  25           H        ALA  25  -6.016   9.978  12.418
    2    HA   ALA  25           HA       ALA  25  -5.698  11.241  14.918
    3    HB2  ALA  25           HB1      ALA  25  -4.895   8.900  14.102
    4    HB3  ALA  25           HB2      ALA  25  -3.893   9.776  15.261
    5    HB1  ALA  25           HB3      ALA  25  -3.457   9.762  13.552

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU  26           H        LEU  26  -3.913  11.561  11.877
    2    HA   LEU  26           HA       LEU  26  -1.982  13.414  12.789
    3    HB2  LEU  26           HB2      LEU  26  -1.663  12.262  10.688
    4    HB3  LEU  26           HB3      LEU  26  -3.147  12.946  10.031
    5    HG   LEU  26           HG       LEU  26  -2.168  15.212  10.162
    6   HD12  LEU  26          HD11      LEU  26   0.370  15.272  10.576
    7   HD11  LEU  26          HD12      LEU  26   0.171  13.690  11.324
    8   HD13  LEU  26          HD13      LEU  26  -0.658  15.093  11.997
    9   HD21  LEU  26          HD21      LEU  26  -0.393  13.181   8.771
   10   HD23  LEU  26          HD22      LEU  26  -0.463  14.901   8.397
   11   HD22  LEU  26          HD23      LEU  26  -1.870  13.881   8.111

  No H/Q in entry =          11
  In of MODEL   27
    1    H    LYS  27           H        LYS  27  -5.172  13.844  11.310
    2    HA   LYS  27           HA       LYS  27  -5.159  16.632  11.106
    3    HB2  LYS  27           HB2      LYS  27  -6.880  15.126  10.123
    4    HB3  LYS  27           HB3      LYS  27  -7.533  14.863  11.740
    5    HG2  LYS  27           HG2      LYS  27  -8.000  17.263  11.971
    6    HG3  LYS  27           HG3      LYS  27  -7.296  17.567  10.379
    7    HD2  LYS  27           HD2      LYS  27  -9.006  16.105   9.346
    8    HD3  LYS  27           HD3      LYS  27  -9.716  15.817  10.937
    9    HE2  LYS  27           HE2      LYS  27 -10.195  18.222  11.174
   10    HE3  LYS  27           HE3      LYS  27  -9.458  18.531   9.599
   11    HZ3  LYS  27           HZ1      LYS  27 -11.833  18.370   9.357
   12    HZ2  LYS  27           HZ2      LYS  27 -11.858  16.855  10.130
   13    HZ1  LYS  27           HZ3      LYS  27 -11.116  17.026   8.608

  No H/Q in entry =          13
  In of MODEL   27
    1    H    GLN  28           H        GLN  28  -6.016  14.539  13.838
    2    HA   GLN  28           HA       GLN  28  -6.942  16.534  15.609
    3    HB2  GLN  28           HB2      GLN  28  -5.502  13.924  16.156
    4    HB3  GLN  28           HB3      GLN  28  -6.254  14.921  17.403
    5    HG2  GLN  28           HG2      GLN  28  -7.715  13.798  14.996
    6    HG3  GLN  28           HG3      GLN  28  -7.741  13.076  16.604
    7   HE21  GLN  28          HE21      GLN  28  -7.896  15.482  18.165
    8   HE22  GLN  28          HE22      GLN  28  -9.397  16.213  17.858

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ALA  29           H        ALA  29  -3.704  15.283  14.923
    2    HA   ALA  29           HA       ALA  29  -2.286  16.705  16.898
    3    HB1  ALA  29           HB1      ALA  29  -0.346  16.039  15.780
    4    HB3  ALA  29           HB2      ALA  29  -1.102  16.149  14.191
    5    HB2  ALA  29           HB3      ALA  29  -1.505  14.813  15.268

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LYS  30           H        LYS  30  -3.156  17.565  13.566
    2    HA   LYS  30           HA       LYS  30  -1.778  20.023  13.460
    3    HB2  LYS  30           HB2      LYS  30  -4.298  19.114  12.054
    4    HB3  LYS  30           HB3      LYS  30  -3.483  20.638  11.707
    5    HG2  LYS  30           HG2      LYS  30  -1.398  19.370  11.195
    6    HG3  LYS  30           HG3      LYS  30  -2.285  17.864  11.444
    7    HD2  LYS  30           HD2      LYS  30  -3.857  18.481   9.648
    8    HD3  LYS  30           HD3      LYS  30  -2.993  19.999   9.402
    9    HE2  LYS  30           HE2      LYS  30  -0.945  18.730   8.824
   10    HE3  LYS  30           HE3      LYS  30  -1.828  17.217   9.040
   11    HZ2  LYS  30           HZ1      LYS  30  -1.663  18.085   6.696
   12    HZ1  LYS  30           HZ2      LYS  30  -2.722  19.336   7.162
   13    HZ3  LYS  30           HZ3      LYS  30  -3.227  17.713   7.237

  No H/Q in entry =          13
  In of MODEL   27
    1    H    GLN  31           H        GLN  31  -4.868  19.137  14.875
    2    HA   GLN  31           HA       GLN  31  -5.663  21.886  15.322
    3    HB2  GLN  31           HB2      GLN  31  -6.814  19.429  16.650
    4    HB3  GLN  31           HB3      GLN  31  -7.592  20.991  16.401
    5    HG2  GLN  31           HG2      GLN  31  -6.873  20.217  13.813
    6    HG3  GLN  31           HG3      GLN  31  -7.381  18.708  14.563
    7   HE21  GLN  31          HE21      GLN  31  -8.809  20.262  12.459
    8   HE22  GLN  31          HE22      GLN  31 -10.327  20.637  13.117

  No H/Q in entry =           8
  In of MODEL   27
    1    H    GLY  32           H        GLY  32  -3.329  19.987  16.645
    2    HA3  GLY  32           HA2      GLY  32  -1.933  20.468  18.445
    3    HA2  GLY  32           HA3      GLY  32  -3.075  21.699  18.967

  No H/Q in entry =           3
  In of MODEL   27
    1    H    ASP  33           H        ASP  33  -4.465  18.643  18.312
    2    HA   ASP  33           HA       ASP  33  -4.869  18.186  21.193
    3    HB2  ASP  33           HB2      ASP  33  -6.265  17.155  18.718
    4    HB3  ASP  33           HB3      ASP  33  -6.603  16.544  20.335

  No H/Q in entry =           4
  In of MODEL   27
    1    H    PHE  34           H        PHE  34  -2.691  17.360  21.499
    2    HA   PHE  34           HA       PHE  34  -1.667  15.119  20.101
    3    HB2  PHE  34           HB2      PHE  34  -1.059  16.115  22.894
    4    HB3  PHE  34           HB3      PHE  34  -0.118  14.901  22.028
    5    HD1  PHE  34           HD1      PHE  34  -0.327  18.326  22.757
    6    HD2  PHE  34           HD2      PHE  34   0.531  15.626  19.527
    7    HE1  PHE  34           HE1      PHE  34   0.949  20.109  21.599
    8    HE2  PHE  34           HE2      PHE  34   1.802  17.412  18.374
    9    HZ   PHE  34           HZ       PHE  34   2.012  19.651  19.415

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ALA  35           H        ALA  35  -3.708  15.379  22.965
    2    HA   ALA  35           HA       ALA  35  -3.467  12.721  23.866
    3    HB3  ALA  35           HB1      ALA  35  -5.931  13.322  24.723
    4    HB1  ALA  35           HB2      ALA  35  -5.415  14.945  24.264
    5    HB2  ALA  35           HB3      ALA  35  -4.491  14.033  25.457

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA  36           H        ALA  36  -5.934  14.208  21.765
    2    HA   ALA  36           HA       ALA  36  -7.324  11.780  21.292
    3    HB1  ALA  36           HB1      ALA  36  -8.795  13.186  20.334
    4    HB3  ALA  36           HB2      ALA  36  -7.628  13.616  19.084
    5    HB2  ALA  36           HB3      ALA  36  -7.661  14.506  20.606

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA  37           H        ALA  37  -4.662  13.394  19.619
    2    HA   ALA  37           HA       ALA  37  -4.610  11.755  17.325
    3    HB3  ALA  37           HB1      ALA  37  -2.635  13.490  18.743
    4    HB2  ALA  37           HB2      ALA  37  -3.167  13.538  17.064
    5    HB1  ALA  37           HB3      ALA  37  -2.000  12.321  17.586

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LYS  38           H        LYS  38  -2.848  11.473  20.402
    2    HA   LYS  38           HA       LYS  38  -1.497   9.087  19.916
    3    HB2  LYS  38           HB2      LYS  38  -1.838  10.849  22.059
    4    HB3  LYS  38           HB3      LYS  38  -2.440   9.314  22.678
    5    HG2  LYS  38           HG2      LYS  38  -0.334   8.215  22.142
    6    HG3  LYS  38           HG3      LYS  38   0.258   9.666  21.326
    7    HD2  LYS  38           HD2      LYS  38   0.415  10.889  23.359
    8    HD3  LYS  38           HD3      LYS  38  -0.591   9.729  24.229
    9    HE2  LYS  38           HE2      LYS  38   1.768   9.440  24.847
   10    HE3  LYS  38           HE3      LYS  38   1.179   8.016  23.985
   11    HZ3  LYS  38           HZ1      LYS  38   2.473   8.446  22.203
   12    HZ2  LYS  38           HZ2      LYS  38   3.420   9.286  23.338
   13    HZ1  LYS  38           HZ3      LYS  38   2.331  10.133  22.345

  No H/Q in entry =          13
  In of MODEL   27
    1    H    ALA  39           H        ALA  39  -4.740   9.549  21.320
    2    HA   ALA  39           HA       ALA  39  -5.271   6.824  21.829
    3    HB3  ALA  39           HB1      ALA  39  -7.451   8.744  21.060
    4    HB2  ALA  39           HB2      ALA  39  -6.555   8.983  22.560
    5    HB1  ALA  39           HB3      ALA  39  -7.455   7.489  22.300

  No H/Q in entry =           5
  In of MODEL   27
    1    H    MET  40           H        MET  40  -5.879   8.826  18.979
    2    HA   MET  40           HA       MET  40  -7.335   6.876  17.523
    3    HB2  MET  40           HB2      MET  40  -5.752   9.287  16.614
    4    HB3  MET  40           HB3      MET  40  -6.768   8.316  15.545
    5    HG2  MET  40           HG2      MET  40  -7.815   9.557  18.102
    6    HG3  MET  40           HG3      MET  40  -7.882  10.389  16.550
    7    HE3  MET  40           HE1      MET  40 -10.449   8.738  14.490
    8    HE2  MET  40           HE2      MET  40  -8.697   8.874  14.341
    9    HE1  MET  40           HE3      MET  40  -9.630  10.230  14.973

  No H/Q in entry =           9
  In of MODEL   27
    1    H    MET  41           H        MET  41  -3.852   7.652  17.642
    2    HA   MET  41           HA       MET  41  -3.075   5.903  15.544
    3    HB2  MET  41           HB2      MET  41  -1.465   6.592  18.016
    4    HB3  MET  41           HB3      MET  41  -0.841   5.948  16.501
    5    HG2  MET  41           HG2      MET  41  -2.023   8.116  15.494
    6    HG3  MET  41           HG3      MET  41  -1.792   8.709  17.137
    7    HE2  MET  41           HE1      MET  41   1.149   6.645  17.501
    8    HE1  MET  41           HE2      MET  41   0.347   7.931  18.397
    9    HE3  MET  41           HE3      MET  41   1.967   8.192  17.753

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ASP  42           H        ASP  42  -3.453   5.431  19.031
    2    HA   ASP  42           HA       ASP  42  -2.388   2.849  19.195
    3    HB2  ASP  42           HB2      ASP  42  -3.281   4.602  21.015
    4    HB3  ASP  42           HB3      ASP  42  -4.696   3.560  20.945

  No H/Q in entry =           4
  In of MODEL   27
    1    H    GLN  43           H        GLN  43  -5.734   3.914  18.694
    2    HA   GLN  43           HA       GLN  43  -6.847   1.313  18.504
    3    HB2  GLN  43           HB2      GLN  43  -7.802   3.953  17.371
    4    HB3  GLN  43           HB3      GLN  43  -8.747   2.463  17.352
    5    HG2  GLN  43           HG2      GLN  43  -8.452   2.349  19.859
    6    HG3  GLN  43           HG3      GLN  43  -7.746   3.962  19.785
    7   HE21  GLN  43          HE21      GLN  43  -9.925   4.019  21.286
    8   HE22  GLN  43          HE22      GLN  43 -11.293   4.577  20.455

  No H/Q in entry =           8
  In of MODEL   27
    1    H    SER  44           H        SER  44  -5.534   3.539  16.088
    2    HA   SER  44           HA       SER  44  -6.218   2.043  13.802
    3    HB2  SER  44           HB2      SER  44  -4.990   4.442  14.241
    4    HB3  SER  44           HB3      SER  44  -3.624   3.461  13.712
    5    HG   SER  44           HG       SER  44  -4.748   4.417  11.948

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ARG  45           H        ARG  45  -3.339   1.967  15.881
    2    HA   ARG  45           HA       ARG  45  -1.837   0.028  14.501
    3    HB2  ARG  45           HB2      ARG  45  -1.011   1.462  16.368
    4    HB3  ARG  45           HB3      ARG  45  -1.991   0.521  17.490
    5    HG2  ARG  45           HG2      ARG  45  -0.736  -1.524  16.850
    6    HG3  ARG  45           HG3      ARG  45   0.268  -0.559  15.770
    7    HD2  ARG  45           HD2      ARG  45   0.987   0.833  17.723
    8    HD3  ARG  45           HD3      ARG  45   0.078  -0.251  18.799
    9    HE   ARG  45           HE       ARG  45   1.795  -1.829  17.220
   10   HH21  ARG  45          HH11      ARG  45   3.705  -2.629  18.058
   11   HH22  ARG  45          HH12      ARG  45   4.469  -1.832  19.388
   12   HH11  ARG  45          HH21      ARG  45   2.070   0.644  19.606
   13   HH12  ARG  45          HH22      ARG  45   3.543   0.024  20.262

  No H/Q in entry =          13
  In of MODEL   27
    1    H    MET  46           H        MET  46  -4.230  -0.316  17.103
    2    HA   MET  46           HA       MET  46  -4.030  -3.113  17.413
    3    HB2  MET  46           HB2      MET  46  -6.231  -1.138  18.005
    4    HB3  MET  46           HB3      MET  46  -6.401  -2.859  18.362
    5    HG2  MET  46           HG2      MET  46  -4.379  -2.787  19.754
    6    HG3  MET  46           HG3      MET  46  -4.159  -1.085  19.377
    7    HE1  MET  46           HE1      MET  46  -3.817  -1.487  21.874
    8    HE3  MET  46           HE2      MET  46  -5.070  -1.246  23.087
    9    HE2  MET  46           HE3      MET  46  -4.570   0.100  22.070

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ALA  47           H        ALA  47  -6.073  -1.122  15.316
    2    HA   ALA  47           HA       ALA  47  -7.668  -3.192  14.253
    3    HB3  ALA  47           HB1      ALA  47  -8.373  -0.963  13.835
    4    HB1  ALA  47           HB2      ALA  47  -7.877  -1.593  12.264
    5    HB2  ALA  47           HB3      ALA  47  -6.808  -0.512  13.159

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU  48           H        LEU  48  -4.564  -1.851  13.201
    2    HA   LEU  48           HA       LEU  48  -4.266  -3.441  10.861
    3    HB2  LEU  48           HB2      LEU  48  -2.222  -2.139  12.668
    4    HB3  LEU  48           HB3      LEU  48  -1.846  -2.857  11.102
    5    HG   LEU  48           HG       LEU  48  -3.892  -0.661  11.488
    6   HD13  LEU  48          HD11      LEU  48  -1.780   0.238  12.153
    7   HD12  LEU  48          HD12      LEU  48  -2.061   0.787  10.500
    8   HD11  LEU  48          HD13      LEU  48  -0.949  -0.547  10.810
    9   HD22  LEU  48          HD21      LEU  48  -4.353  -1.653   9.414
   10   HD21  LEU  48          HD22      LEU  48  -2.666  -2.071   9.119
   11   HD23  LEU  48          HD23      LEU  48  -3.203  -0.397   8.958

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ASN  49           H        ASN  49  -3.216  -3.823  14.208
    2    HA   ASN  49           HA       ASN  49  -1.591  -6.070  13.880
    3    HB2  ASN  49           HB2      ASN  49  -1.613  -4.749  15.927
    4    HB3  ASN  49           HB3      ASN  49  -3.279  -5.211  16.246
    5   HD21  ASN  49          HD21      ASN  49   0.054  -6.286  16.388
    6   HD22  ASN  49          HD22      ASN  49  -0.253  -7.737  17.213

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLU  50           H        GLU  50  -5.062  -5.829  14.551
    2    HA   GLU  50           HA       GLU  50  -5.547  -8.633  14.663
    3    HB2  GLU  50           HB2      GLU  50  -7.149  -6.960  15.537
    4    HB3  GLU  50           HB3      GLU  50  -7.448  -6.400  13.890
    5    HG2  GLU  50           HG2      GLU  50  -8.292  -8.605  13.254
    6    HG3  GLU  50           HG3      GLU  50  -7.905  -9.243  14.849

  No H/Q in entry =           6
  In of MODEL   27
    1    H    ALA  51           H        ALA  51  -5.638  -6.238  12.064
    2    HA   ALA  51           HA       ALA  51  -6.607  -7.977  10.044
    3    HB2  ALA  51           HB1      ALA  51  -6.404  -6.164   8.673
    4    HB1  ALA  51           HB2      ALA  51  -4.767  -5.800   9.221
    5    HB3  ALA  51           HB3      ALA  51  -6.156  -5.300  10.189

  No H/Q in entry =           5
  In of MODEL   27
    1    H    HIS  52           H        HIS  52  -3.325  -7.039  11.027
    2    HA   HIS  52           HA       HIS  52  -1.912  -8.518   9.080
    3    HB2  HIS  52           HB2      HIS  52  -0.896  -6.773  10.520
    4    HB3  HIS  52           HB3      HIS  52  -1.053  -7.851  11.906
    5    HD1  HIS  52           HD1      HIS  52   0.313 -10.162  11.740
    6    HD2  HIS  52           HD2      HIS  52   1.348  -7.256   8.935
    7    HE1  HIS  52           HE1      HIS  52   2.550 -10.858  10.778
    8    HE2  HIS  52           HE2      HIS  52   3.194  -9.097   9.065

  No H/Q in entry =           8
  In of MODEL   27
    1    H    LEU  53           H        LEU  53  -3.117  -9.403  12.293
    2    HA   LEU  53           HA       LEU  53  -1.897 -11.936  12.490
    3    HB2  LEU  53           HB2      LEU  53  -4.392 -10.774  13.703
    4    HB3  LEU  53           HB3      LEU  53  -3.921 -12.446  13.995
    5    HG   LEU  53           HG       LEU  53  -2.030 -10.120  14.467
    6   HD11  LEU  53          HD11      LEU  53  -4.038 -11.420  16.318
    7   HD13  LEU  53          HD12      LEU  53  -3.856  -9.707  15.946
    8   HD12  LEU  53          HD13      LEU  53  -2.641 -10.530  16.915
    9   HD23  LEU  53          HD21      LEU  53  -1.152 -11.920  16.163
   10   HD22  LEU  53          HD22      LEU  53  -0.750 -12.095  14.458
   11   HD21  LEU  53          HD23      LEU  53  -2.033 -13.065  15.158

  No H/Q in entry =          11
  In of MODEL   27
    1    H    VAL  54           H        VAL  54  -5.017 -10.934  11.126
    2    HA   VAL  54           HA       VAL  54  -5.909 -13.537  10.441
    3    HB   VAL  54           HB       VAL  54  -6.578 -10.810   9.304
    4   HG12  VAL  54          HG11      VAL  54  -8.669 -12.206   8.493
    5   HG11  VAL  54          HG12      VAL  54  -7.546 -13.563   8.567
    6   HG13  VAL  54          HG13      VAL  54  -7.197 -12.186   7.523
    7   HG22  VAL  54          HG21      VAL  54  -7.485 -10.853  11.455
    8   HG21  VAL  54          HG22      VAL  54  -7.725 -12.598  11.438
    9   HG23  VAL  54          HG23      VAL  54  -8.815 -11.551  10.530

  No H/Q in entry =           9
  In of MODEL   27
    1    H    GLN  55           H        GLN  55  -4.057 -11.072   8.650
    2    HA   GLN  55           HA       GLN  55  -3.915 -12.538   6.234
    3    HB2  GLN  55           HB2      GLN  55  -3.329 -10.269   6.042
    4    HB3  GLN  55           HB3      GLN  55  -2.218 -10.336   7.407
    5    HG2  GLN  55           HG2      GLN  55  -0.493 -11.170   6.132
    6    HG3  GLN  55           HG3      GLN  55  -1.559 -12.154   5.139
    7   HE21  GLN  55          HE21      GLN  55  -1.581 -11.467   3.017
    8   HE22  GLN  55          HE22      GLN  55  -1.395  -9.861   2.505

  No H/Q in entry =           8
  In of MODEL   27
    1    H    THR  56           H        THR  56  -1.810 -12.498   9.115
    2    HA   THR  56           HA       THR  56   0.281 -14.082   8.200
    3    HB   THR  56           HB       THR  56  -0.960 -14.340  10.948
    4    HG1  THR  56           HG1      THR  56   0.694 -12.361   9.802
    5   HG22  THR  56          HG21      THR  56   1.966 -14.389  10.278
    6   HG21  THR  56          HG22      THR  56   0.990 -15.839  10.037
    7   HG23  THR  56          HG23      THR  56   1.126 -15.121  11.643

  No H/Q in entry =           7
  In of MODEL   27
    1    H    LYS  57           H        LYS  57  -2.832 -15.140   9.564
    2    HA   LYS  57           HA       LYS  57  -2.365 -17.933   9.321
    3    HB2  LYS  57           HB2      LYS  57  -4.192 -16.855  10.666
    4    HB3  LYS  57           HB3      LYS  57  -4.987 -16.411   9.162
    5    HG2  LYS  57           HG2      LYS  57  -5.213 -18.774   8.552
    6    HG3  LYS  57           HG3      LYS  57  -4.369 -19.252  10.023
    7    HD2  LYS  57           HD2      LYS  57  -6.165 -18.227  11.384
    8    HD3  LYS  57           HD3      LYS  57  -7.018 -17.769   9.912
    9    HE2  LYS  57           HE2      LYS  57  -7.968 -19.852  10.797
   10    HE3  LYS  57           HE3      LYS  57  -7.148 -20.194   9.275
   11    HZ2  LYS  57           HZ1      LYS  57  -6.727 -21.542  11.535
   12    HZ1  LYS  57           HZ2      LYS  57  -5.495 -20.378  11.644
   13    HZ3  LYS  57           HZ3      LYS  57  -5.580 -21.401  10.290

  No H/Q in entry =          13
  In of MODEL   27
    1    H    LEU  58           H        LEU  58  -3.714 -15.503   7.142
    2    HA   LEU  58           HA       LEU  58  -4.502 -17.336   5.138
    3    HB2  LEU  58           HB2      LEU  58  -3.917 -14.383   4.999
    4    HB3  LEU  58           HB3      LEU  58  -4.573 -15.326   3.660
    5    HG   LEU  58           HG       LEU  58  -5.855 -15.153   6.407
    6   HD11  LEU  58          HD11      LEU  58  -6.166 -13.511   3.913
    7   HD13  LEU  58          HD12      LEU  58  -6.160 -13.001   5.602
    8   HD12  LEU  58          HD13      LEU  58  -7.577 -13.805   4.930
    9   HD22  LEU  58          HD21      LEU  58  -6.804 -17.070   5.539
   10   HD21  LEU  58          HD22      LEU  58  -6.467 -16.617   3.868
   11   HD23  LEU  58          HD23      LEU  58  -7.836 -15.900   4.718

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  59           H        ILE  59  -1.376 -16.101   5.999
    2    HA   ILE  59           HA       ILE  59  -0.272 -16.824   3.363
    3    HB   ILE  59           HB       ILE  59   0.481 -14.751   4.929
    4   HG12  ILE  59          HG12      ILE  59   2.591 -16.386   3.507
    5   HG13  ILE  59          HG13      ILE  59   1.384 -15.468   2.643
    6   HG23  ILE  59          HG21      ILE  59   2.319 -15.219   6.329
    7   HG22  ILE  59          HG22      ILE  59   2.590 -16.795   5.621
    8   HG21  ILE  59          HG23      ILE  59   1.221 -16.527   6.699
    9   HD12  ILE  59          HD11      ILE  59   3.400 -14.379   4.604
   10   HD11  ILE  59          HD12      ILE  59   2.097 -13.421   3.905
   11   HD13  ILE  59          HD13      ILE  59   3.361 -14.084   2.867

  No H/Q in entry =          11
  In of MODEL   27
    1    H    GLU  60           H        GLU  60  -0.276 -17.926   6.732
    2    HA   GLU  60           HA       GLU  60   1.769 -19.890   6.471
    3    HB2  GLU  60           HB2      GLU  60   0.984 -19.098   8.658
    4    HB3  GLU  60           HB3      GLU  60  -0.604 -19.797   8.353
    5    HG2  GLU  60           HG2      GLU  60   0.402 -22.048   8.230
    6    HG3  GLU  60           HG3      GLU  60   1.997 -21.351   8.515

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLY  61           H        GLY  61  -1.741 -20.014   5.983
    2    HA3  GLY  61           HA2      GLY  61  -1.473 -22.806   5.029
    3    HA2  GLY  61           HA3      GLY  61  -2.964 -22.079   5.620

  No H/Q in entry =           3
  In of MODEL   27
    1    H    ASP  62           H        ASP  62  -0.742 -20.490   3.416
    2    HA   ASP  62           HA       ASP  62  -2.763 -19.782   1.584
    3    HB2  ASP  62           HB2      ASP  62  -0.579 -18.600   1.938
    4    HB3  ASP  62           HB3      ASP  62   0.216 -19.918   1.083

  No H/Q in entry =           4
  In of MODEL   27
    1    H    ALA  63           H        ALA  63  -3.674 -22.093   1.373
    2    HA   ALA  63           HA       ALA  63  -2.294 -24.066  -0.150
    3    HB2  ALA  63           HB1      ALA  63  -4.271 -24.567   1.223
    4    HB1  ALA  63           HB2      ALA  63  -4.467 -25.103  -0.445
    5    HB3  ALA  63           HB3      ALA  63  -5.272 -23.634   0.108

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLY  64           H        GLY  64  -4.449 -21.394  -0.985
    2    HA3  GLY  64           HA2      GLY  64  -4.731 -20.245  -2.962
    3    HA2  GLY  64           HA3      GLY  64  -3.394 -21.159  -3.636

  No H/Q in entry =           3
  In of MODEL   27
    1    H    GLU  65           H        GLU  65  -4.689 -21.207  -5.626
    2    HA   GLU  65           HA       GLU  65  -7.229 -22.423  -5.737
    3    HB2  GLU  65           HB2      GLU  65  -5.118 -22.118  -7.873
    4    HB3  GLU  65           HB3      GLU  65  -6.772 -22.653  -8.171
    5    HG2  GLU  65           HG2      GLU  65  -6.035 -20.029  -6.848
    6    HG3  GLU  65           HG3      GLU  65  -6.466 -20.201  -8.547

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLY  66           H        GLY  66  -4.017 -23.724  -6.011
    2    HA3  GLY  66           HA2      GLY  66  -5.083 -26.469  -5.928
    3    HA2  GLY  66           HA3      GLY  66  -3.733 -26.040  -6.961

  No H/Q in entry =           3
  In of MODEL   27
    1    H    LYS  67           H        LYS  67  -2.616 -27.750  -5.878
    2    HA   LYS  67           HA       LYS  67  -2.108 -27.840  -3.124
    3    HB2  LYS  67           HB2      LYS  67  -0.412 -28.939  -5.365
    4    HB3  LYS  67           HB3      LYS  67  -0.409 -29.476  -3.680
    5    HG2  LYS  67           HG2      LYS  67  -2.863 -29.495  -5.462
    6    HG3  LYS  67           HG3      LYS  67  -1.840 -30.903  -5.182
    7    HD2  LYS  67           HD2      LYS  67  -2.267 -30.455  -2.665
    8    HD3  LYS  67           HD3      LYS  67  -3.601 -29.442  -3.223
    9    HE2  LYS  67           HE2      LYS  67  -4.531 -31.343  -4.485
   10    HE3  LYS  67           HE3      LYS  67  -3.194 -32.359  -3.948
   11    HZ1  LYS  67           HZ1      LYS  67  -3.905 -31.935  -1.646
   12    HZ3  LYS  67           HZ2      LYS  67  -5.088 -32.741  -2.560
   13    HZ2  LYS  67           HZ3      LYS  67  -5.249 -31.083  -2.229

  No H/Q in entry =          13
  In of MODEL   27
    1    H    MET  68           H        MET  68   0.479 -27.330  -5.429
    2    HA   MET  68           HA       MET  68   2.208 -26.024  -3.618
    3    HB2  MET  68           HB2      MET  68   2.264 -26.189  -6.633
    4    HB3  MET  68           HB3      MET  68   3.600 -25.626  -5.627
    5    HG2  MET  68           HG2      MET  68   2.306 -28.360  -5.418
    6    HG3  MET  68           HG3      MET  68   3.837 -28.027  -6.230
    7    HE1  MET  68           HE1      MET  68   5.690 -27.004  -5.376
    8    HE3  MET  68           HE2      MET  68   6.355 -27.223  -3.760
    9    HE2  MET  68           HE3      MET  68   5.330 -25.832  -4.101

  No H/Q in entry =           9
  In of MODEL   27
    1    H    LYS  69           H        LYS  69   0.074 -24.726  -6.150
    2    HA   LYS  69           HA       LYS  69   1.028 -22.134  -6.248
    3    HB2  LYS  69           HB2      LYS  69  -1.743 -23.184  -6.713
    4    HB3  LYS  69           HB3      LYS  69  -1.283 -21.505  -7.015
    5    HG2  LYS  69           HG2      LYS  69   0.524 -22.258  -8.510
    6    HG3  LYS  69           HG3      LYS  69   0.071 -23.936  -8.215
    7    HD2  LYS  69           HD2      LYS  69  -2.135 -23.547  -9.200
    8    HD3  LYS  69           HD3      LYS  69  -1.748 -21.841  -9.433
    9    HE2  LYS  69           HE2      LYS  69  -1.398 -23.064 -11.530
   10    HE3  LYS  69           HE3      LYS  69   0.146 -22.486 -10.902
   11    HZ3  LYS  69           HZ1      LYS  69   0.859 -24.555 -10.521
   12    HZ2  LYS  69           HZ2      LYS  69  -0.347 -25.019 -11.623
   13    HZ1  LYS  69           HZ3      LYS  69  -0.645 -25.096  -9.952

  No H/Q in entry =          13
  In of MODEL   27
    1    H    VAL  70           H        VAL  70  -0.483 -20.157  -5.709
    2    HA   VAL  70           HA       VAL  70  -1.269 -20.267  -2.854
    3    HB   VAL  70           HB       VAL  70  -0.263 -17.967  -2.634
    4   HG12  VAL  70          HG11      VAL  70   2.158 -18.853  -2.715
    5   HG11  VAL  70          HG12      VAL  70   1.448 -20.367  -3.276
    6   HG13  VAL  70          HG13      VAL  70   1.015 -19.724  -1.692
    7   HG22  VAL  70          HG21      VAL  70   1.073 -17.015  -4.328
    8   HG21  VAL  70          HG22      VAL  70  -0.239 -17.742  -5.253
    9   HG23  VAL  70          HG23      VAL  70   1.315 -18.563  -5.141

  No H/Q in entry =           9
  In of MODEL   27
    1    H    SER  71           H        SER  71  -2.737 -18.576  -2.230
    2    HA   SER  71           HA       SER  71  -4.813 -18.070  -4.132
    3    HB2  SER  71           HB2      SER  71  -5.194 -18.311  -1.655
    4    HB3  SER  71           HB3      SER  71  -4.374 -16.771  -1.419
    5    HG   SER  71           HG       SER  71  -6.906 -17.307  -2.296

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU  72           H        LEU  72  -5.042 -16.414  -5.486
    2    HA   LEU  72           HA       LEU  72  -2.948 -14.586  -5.970
    3    HB2  LEU  72           HB2      LEU  72  -5.813 -14.662  -6.914
    4    HB3  LEU  72           HB3      LEU  72  -4.625 -13.497  -7.491
    5    HG   LEU  72           HG       LEU  72  -4.199 -16.500  -7.620
    6   HD13  LEU  72          HD11      LEU  72  -6.124 -15.948  -9.003
    7   HD12  LEU  72          HD12      LEU  72  -4.735 -16.223 -10.054
    8   HD11  LEU  72          HD13      LEU  72  -5.267 -14.578  -9.709
    9   HD22  LEU  72          HD21      LEU  72  -2.088 -15.506  -7.871
   10   HD21  LEU  72          HD22      LEU  72  -2.729 -14.079  -8.668
   11   HD23  LEU  72          HD23      LEU  72  -2.637 -15.606  -9.541

  No H/Q in entry =          11
  In of MODEL   27
    1    H    VAL  73           H        VAL  73  -6.044 -14.252  -4.339
    2    HA   VAL  73           HA       VAL  73  -6.111 -11.481  -3.989
    3    HB   VAL  73           HB       VAL  73  -7.816 -11.856  -2.388
    4   HG13  VAL  73          HG11      VAL  73  -9.281 -13.242  -3.614
    5   HG12  VAL  73          HG12      VAL  73  -7.980 -14.316  -4.126
    6   HG11  VAL  73          HG13      VAL  73  -8.114 -12.700  -4.821
    7   HG22  VAL  73          HG21      VAL  73  -6.983 -13.310  -0.776
    8   HG21  VAL  73          HG22      VAL  73  -6.356 -14.442  -1.973
    9   HG23  VAL  73          HG23      VAL  73  -8.087 -14.383  -1.638

  No H/Q in entry =           9
  In of MODEL   27
    1    H    LEU  74           H        LEU  74  -4.153 -13.833  -2.405
    2    HA   LEU  74           HA       LEU  74  -3.750 -12.687   0.117
    3    HB2  LEU  74           HB2      LEU  74  -2.948 -14.899  -0.383
    4    HB3  LEU  74           HB3      LEU  74  -1.899 -14.279  -1.656
    5    HG   LEU  74           HG       LEU  74  -0.660 -12.960   0.077
    6   HD11  LEU  74          HD11      LEU  74  -2.612 -14.422   1.863
    7   HD13  LEU  74          HD12      LEU  74  -2.232 -12.700   1.843
    8   HD12  LEU  74          HD13      LEU  74  -1.055 -13.856   2.467
    9   HD21  LEU  74          HD21      LEU  74  -0.236 -15.415  -0.722
   10   HD23  LEU  74          HD22      LEU  74  -0.718 -15.803   0.914
   11   HD22  LEU  74          HD23      LEU  74   0.668 -14.772   0.647

  No H/Q in entry =          11
  In of MODEL   27
    1    H    VAL  75           H        VAL  75  -1.864 -12.280  -2.842
    2    HA   VAL  75           HA       VAL  75  -0.081 -10.340  -1.834
    3    HB   VAL  75           HB       VAL  75  -1.035 -10.831  -4.657
    4   HG13  VAL  75          HG11      VAL  75  -0.185  -8.524  -4.448
    5   HG12  VAL  75          HG12      VAL  75   1.007  -9.516  -5.273
    6   HG11  VAL  75          HG13      VAL  75   1.231  -9.108  -3.580
    7   HG21  VAL  75          HG21      VAL  75   1.367 -11.688  -3.014
    8   HG23  VAL  75          HG22      VAL  75   1.311 -11.832  -4.771
    9   HG22  VAL  75          HG23      VAL  75   0.162 -12.729  -3.776

  No H/Q in entry =           9
  In of MODEL   27
    1    H    GLU  76           H        GLU  76  -3.236 -10.020  -3.490
    2    HA   GLU  76           HA       GLU  76  -3.311  -7.206  -3.592
    3    HB2  GLU  76           HB2      GLU  76  -4.959  -8.647  -4.756
    4    HB3  GLU  76           HB3      GLU  76  -5.601  -9.170  -3.206
    5    HG2  GLU  76           HG2      GLU  76  -7.080  -7.468  -4.064
    6    HG3  GLU  76           HG3      GLU  76  -6.205  -6.756  -2.722

  No H/Q in entry =           6
  In of MODEL   27
    1    H    ALA  77           H        ALA  77  -4.401  -9.442  -1.051
    2    HA   ALA  77           HA       ALA  77  -5.373  -7.447   0.708
    3    HB2  ALA  77           HB1      ALA  77  -4.884  -9.285   2.472
    4    HB1  ALA  77           HB2      ALA  77  -4.443 -10.283   1.088
    5    HB3  ALA  77           HB3      ALA  77  -6.073  -9.625   1.216

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLN  78           H        GLN  78  -2.213  -8.971   0.342
    2    HA   GLN  78           HA       GLN  78  -0.963  -7.800   2.590
    3    HB2  GLN  78           HB2      GLN  78  -0.087  -9.734   1.237
    4    HB3  GLN  78           HB3      GLN  78   0.337  -8.588  -0.031
    5    HG2  GLN  78           HG2      GLN  78   1.787  -7.375   1.549
    6    HG3  GLN  78           HG3      GLN  78   1.371  -8.524   2.817
    7   HE21  GLN  78          HE21      GLN  78   3.337  -9.669   3.080
    8   HE22  GLN  78          HE22      GLN  78   4.134 -10.474   1.815

  No H/Q in entry =           8
  In of MODEL   27
    1    H    LEU  79           H        LEU  79  -1.340  -6.743  -0.757
    2    HA   LEU  79           HA       LEU  79   0.329  -4.504  -0.746
    3    HB2  LEU  79           HB2      LEU  79  -0.693  -5.319  -2.798
    4    HB3  LEU  79           HB3      LEU  79  -2.299  -4.939  -2.189
    5    HG   LEU  79           HG       LEU  79  -1.772  -2.548  -2.164
    6   HD13  LEU  79          HD11      LEU  79   0.466  -2.288  -1.654
    7   HD12  LEU  79          HD12      LEU  79   0.512  -2.001  -3.393
    8   HD11  LEU  79          HD13      LEU  79   0.978  -3.575  -2.746
    9   HD23  LEU  79          HD21      LEU  79  -1.142  -2.346  -4.717
   10   HD22  LEU  79          HD22      LEU  79  -2.662  -3.104  -4.257
   11   HD21  LEU  79          HD23      LEU  79  -1.283  -4.103  -4.702

  No H/Q in entry =          11
  In of MODEL   27
    1    H    HIS  80           H        HIS  80  -3.135  -4.690   0.083
    2    HA   HIS  80           HA       HIS  80  -3.346  -1.935   0.746
    3    HB2  HIS  80           HB2      HIS  80  -5.030  -4.356   1.067
    4    HB3  HIS  80           HB3      HIS  80  -5.359  -3.017   2.171
    5    HD1  HIS  80           HD1      HIS  80  -6.988  -1.392   1.264
    6    HD2  HIS  80           HD2      HIS  80  -4.786  -3.191  -1.785
    7    HE1  HIS  80           HE1      HIS  80  -7.837  -0.402  -0.915
    8    HE2  HIS  80           HE2      HIS  80  -6.501  -1.493  -2.783

  No H/Q in entry =           8
  In of MODEL   27
    1    H    LEU  81           H        LEU  81  -2.835  -4.826   2.740
    2    HA   LEU  81           HA       LEU  81  -2.830  -3.477   5.224
    3    HB2  LEU  81           HB2      LEU  81  -1.595  -6.086   4.344
    4    HB3  LEU  81           HB3      LEU  81  -1.571  -5.526   6.018
    5    HG   LEU  81           HG       LEU  81  -4.116  -5.796   4.392
    6   HD12  LEU  81          HD11      LEU  81  -4.404  -7.863   5.941
    7   HD11  LEU  81          HD12      LEU  81  -2.652  -7.781   6.125
    8   HD13  LEU  81          HD13      LEU  81  -3.361  -8.017   4.527
    9   HD23  LEU  81          HD21      LEU  81  -4.956  -6.004   6.894
   10   HD22  LEU  81          HD22      LEU  81  -4.642  -4.413   6.203
   11   HD21  LEU  81          HD23      LEU  81  -3.450  -5.165   7.262

  No H/Q in entry =          11
  In of MODEL   27
    1    H    MET  82           H        MET  82  -0.145  -4.365   3.051
    2    HA   MET  82           HA       MET  82   1.934  -3.456   4.733
    3    HB2  MET  82           HB2      MET  82   1.718  -3.801   1.741
    4    HB3  MET  82           HB3      MET  82   3.198  -3.220   2.503
    5    HG2  MET  82           HG2      MET  82   1.807  -5.818   3.229
    6    HG3  MET  82           HG3      MET  82   3.177  -5.700   2.128
    7    HE3  MET  82           HE1      MET  82   6.190  -4.945   4.109
    8    HE2  MET  82           HE2      MET  82   5.258  -3.583   3.491
    9    HE1  MET  82           HE3      MET  82   5.355  -5.073   2.556

  No H/Q in entry =           9
  In of MODEL   27
    1    H    THR  83           H        THR  83   0.100  -1.827   2.177
    2    HA   THR  83           HA       THR  83   1.497   0.630   2.260
    3    HB   THR  83           HB       THR  83  -0.686   1.541   1.276
    4    HG1  THR  83           HG1      THR  83  -2.329   0.234   1.171
    5   HG22  THR  83          HG21      THR  83  -0.406  -0.276  -0.724
    6   HG21  THR  83          HG22      THR  83   1.097  -0.559   0.152
    7   HG23  THR  83          HG23      THR  83   0.725   1.052  -0.464

  No H/Q in entry =           7
  In of MODEL   27
    1    H    SER  84           H        SER  84  -1.502  -0.419   3.865
    2    HA   SER  84           HA       SER  84  -2.011   2.008   5.209
    3    HB2  SER  84           HB2      SER  84  -2.827  -0.834   5.776
    4    HB3  SER  84           HB3      SER  84  -3.327   0.505   6.808
    5    HG   SER  84           HG       SER  84  -3.786   0.187   4.017

  No H/Q in entry =           5
  In of MODEL   27
    1    H    MET  85           H        MET  85  -0.283  -0.913   6.338
    2    HA   MET  85           HA       MET  85   0.234   0.018   8.941
    3    HB2  MET  85           HB2      MET  85   0.539  -2.324   8.268
    4    HB3  MET  85           HB3      MET  85   1.914  -1.855   7.268
    5    HG2  MET  85           HG2      MET  85   3.107  -1.031   9.248
    6    HG3  MET  85           HG3      MET  85   1.718  -1.416  10.263
    7    HE1  MET  85           HE1      MET  85   4.241  -2.461   7.841
    8    HE3  MET  85           HE2      MET  85   3.368  -3.882   7.273
    9    HE2  MET  85           HE3      MET  85   4.786  -4.078   8.299

  No H/Q in entry =           9
  In of MODEL   27
    1    H    LEU  86           H        LEU  86   2.164   0.283   5.988
    2    HA   LEU  86           HA       LEU  86   4.372   1.606   7.141
    3    HB2  LEU  86           HB2      LEU  86   4.185   0.521   4.833
    4    HB3  LEU  86           HB3      LEU  86   3.368   1.998   4.320
    5    HG   LEU  86           HG       LEU  86   5.390   3.256   5.298
    6   HD11  LEU  86          HD11      LEU  86   6.110   0.649   6.099
    7   HD13  LEU  86          HD12      LEU  86   7.106   2.099   6.194
    8   HD12  LEU  86          HD13      LEU  86   7.220   1.050   4.783
    9   HD23  LEU  86          HD21      LEU  86   6.114   1.495   2.948
   10   HD22  LEU  86          HD22      LEU  86   6.499   3.194   3.208
   11   HD21  LEU  86          HD23      LEU  86   4.848   2.717   2.812

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ALA  87           H        ALA  87   1.452   2.833   5.558
    2    HA   ALA  87           HA       ALA  87   2.032   5.566   5.639
    3    HB1  ALA  87           HB1      ALA  87  -0.270   3.926   5.102
    4    HB3  ALA  87           HB2      ALA  87   0.032   5.588   4.600
    5    HB2  ALA  87           HB3      ALA  87  -0.759   5.263   6.145

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ARG  88           H        ARG  88   0.355   3.557   8.033
    2    HA   ARG  88           HA       ARG  88  -0.166   5.606   9.878
    3    HB2  ARG  88           HB2      ARG  88  -1.092   3.248   9.948
    4    HB3  ARG  88           HB3      ARG  88   0.452   2.757  10.653
    5    HG2  ARG  88           HG2      ARG  88  -0.034   4.830  12.271
    6    HG3  ARG  88           HG3      ARG  88  -1.699   4.496  11.817
    7    HD2  ARG  88           HD2      ARG  88  -1.795   2.647  13.065
    8    HD3  ARG  88           HD3      ARG  88  -0.203   2.073  12.533
    9    HE   ARG  88           HE       ARG  88  -0.741   3.336  14.987
   10   HH21  ARG  88          HH11      ARG  88   0.813   4.357  16.223
   11   HH22  ARG  88          HH12      ARG  88   2.329   4.792  15.516
   12   HH11  ARG  88          HH21      ARG  88   1.536   3.527  12.407
   13   HH12  ARG  88          HH22      ARG  88   2.747   4.306  13.368

  No H/Q in entry =          13
  In of MODEL   27
    1    H    GLU  89           H        GLU  89   2.642   3.402   9.654
    2    HA   GLU  89           HA       GLU  89   3.901   4.300  11.996
    3    HB2  GLU  89           HB2      GLU  89   4.570   2.284  10.654
    4    HB3  GLU  89           HB3      GLU  89   5.338   3.381   9.505
    5    HG2  GLU  89           HG2      GLU  89   6.820   4.238  11.247
    6    HG3  GLU  89           HG3      GLU  89   5.992   3.278  12.469

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LEU  90           H        LEU  90   4.208   5.456   8.667
    2    HA   LEU  90           HA       LEU  90   6.127   7.468   9.249
    3    HB2  LEU  90           HB2      LEU  90   4.121   7.123   7.024
    4    HB3  LEU  90           HB3      LEU  90   5.344   8.401   7.042
    5    HG   LEU  90           HG       LEU  90   6.036   5.469   7.378
    6   HD12  LEU  90          HD11      LEU  90   6.781   5.705   4.938
    7   HD11  LEU  90          HD12      LEU  90   5.756   7.139   4.889
    8   HD13  LEU  90          HD13      LEU  90   5.046   5.562   5.234
    9   HD22  LEU  90          HD21      LEU  90   7.927   6.631   8.058
   10   HD21  LEU  90          HD22      LEU  90   7.567   8.032   7.049
   11   HD23  LEU  90          HD23      LEU  90   8.235   6.571   6.323

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  91           H        ILE  91   2.588   7.462   9.103
    2    HA   ILE  91           HA       ILE  91   2.229  10.233   9.552
    3    HB   ILE  91           HB       ILE  91   0.454   7.846  10.098
    4   HG12  ILE  91          HG12      ILE  91   0.189  10.124   8.111
    5   HG13  ILE  91          HG13      ILE  91   1.058   8.635   7.740
    6   HG22  ILE  91          HG21      ILE  91  -1.292   9.894  10.161
    7   HG21  ILE  91          HG22      ILE  91   0.105  10.734  10.832
    8   HG23  ILE  91          HG23      ILE  91  -0.522   9.293  11.630
    9   HD13  ILE  91          HD11      ILE  91  -0.878   7.335   7.787
   10   HD12  ILE  91          HD12      ILE  91  -1.477   8.846   7.105
   11   HD11  ILE  91          HD13      ILE  91  -1.745   8.482   8.810

  No H/Q in entry =          11
  In of MODEL   27
    1    H    THR  92           H        THR  92   2.652   7.496  11.755
    2    HA   THR  92           HA       THR  92   2.202   8.869  14.178
    3    HB   THR  92           HB       THR  92   4.025   6.546  13.514
    4    HG1  THR  92           HG1      THR  92   2.062   5.776  13.416
    5   HG22  THR  92          HG21      THR  92   3.646   6.262  16.148
    6   HG21  THR  92          HG22      THR  92   3.569   8.021  16.073
    7   HG23  THR  92          HG23      THR  92   5.008   7.175  15.500

  No H/Q in entry =           7
  In of MODEL   27
    1    H    GLU  93           H        GLU  93   5.154   8.439  12.243
    2    HA   GLU  93           HA       GLU  93   6.899   9.880  13.937
    3    HB2  GLU  93           HB2      GLU  93   6.987   9.563  10.922
    4    HB3  GLU  93           HB3      GLU  93   8.325  10.104  11.935
    5    HG2  GLU  93           HG2      GLU  93   6.935   7.458  12.386
    6    HG3  GLU  93           HG3      GLU  93   8.317   7.618  11.309

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LEU  94           H        LEU  94   4.841  10.877  11.224
    2    HA   LEU  94           HA       LEU  94   5.626  13.587  11.120
    3    HB2  LEU  94           HB2      LEU  94   3.045  12.201  10.369
    4    HB3  LEU  94           HB3      LEU  94   3.291  13.930  10.126
    5    HG   LEU  94           HG       LEU  94   5.322  11.957   9.077
    6   HD11  LEU  94          HD11      LEU  94   2.576  12.485   8.015
    7   HD13  LEU  94          HD12      LEU  94   3.570  11.036   7.891
    8   HD12  LEU  94          HD13      LEU  94   3.894  12.417   6.845
    9   HD23  LEU  94          HD21      LEU  94   5.557  13.792   7.352
   10   HD22  LEU  94          HD22      LEU  94   5.969  14.290   8.993
   11   HD21  LEU  94          HD23      LEU  94   4.414  14.746   8.295

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  95           H        ILE  95   3.102  11.953  13.015
    2    HA   ILE  95           HA       ILE  95   2.041  14.296  14.207
    3    HB   ILE  95           HB       ILE  95   2.082  11.415  15.136
    4   HG12  ILE  95          HG12      ILE  95  -0.154  13.170  14.085
    5   HG13  ILE  95          HG13      ILE  95   0.811  12.117  13.054
    6   HG21  ILE  95          HG21      ILE  95   0.780  13.879  16.335
    7   HG23  ILE  95          HG22      ILE  95   1.838  12.720  17.140
    8   HG22  ILE  95          HG23      ILE  95   0.207  12.245  16.667
    9   HD13  ILE  95          HD11      ILE  95  -0.076  10.172  13.976
   10   HD12  ILE  95          HD12      ILE  95  -1.467  11.250  14.052
   11   HD11  ILE  95          HD13      ILE  95  -0.499  10.962  15.497

  No H/Q in entry =          11
  In of MODEL   27
    1    H    GLU  96           H        GLU  96   4.655  12.100  15.204
    2    HA   GLU  96           HA       GLU  96   5.201  13.306  17.694
    3    HB2  GLU  96           HB2      GLU  96   6.167  11.154  17.049
    4    HB3  GLU  96           HB3      GLU  96   7.093  11.934  15.768
    5    HG2  GLU  96           HG2      GLU  96   8.738  12.498  17.229
    6    HG3  GLU  96           HG3      GLU  96   7.585  13.303  18.283

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LEU  97           H        LEU  97   6.268  14.083  14.407
    2    HA   LEU  97           HA       LEU  97   8.137  16.096  15.115
    3    HB2  LEU  97           HB2      LEU  97   6.549  15.530  12.622
    4    HB3  LEU  97           HB3      LEU  97   7.556  16.970  12.741
    5    HG   LEU  97           HG       LEU  97   8.610  14.183  13.304
    6   HD12  LEU  97          HD11      LEU  97   9.604  14.383  10.986
    7   HD11  LEU  97          HD12      LEU  97   8.540  15.763  10.721
    8   HD13  LEU  97          HD13      LEU  97   7.855  14.166  11.018
    9   HD23  LEU  97          HD21      LEU  97  10.767  15.480  12.559
   10   HD22  LEU  97          HD22      LEU  97  10.146  15.746  14.188
   11   HD21  LEU  97          HD23      LEU  97   9.821  16.925  12.918

  No H/Q in entry =          11
  In of MODEL   27
    1    H    HIS  98           H        HIS  98   4.644  16.200  14.462
    2    HA   HIS  98           HA       HIS  98   4.319  18.996  14.594
    3    HB2  HIS  98           HB2      HIS  98   2.450  16.730  15.324
    4    HB3  HIS  98           HB3      HIS  98   1.968  18.426  15.377
    5    HD1  HIS  98           HD1      HIS  98   3.013  15.717  12.976
    6    HD2  HIS  98           HD2      HIS  98   1.601  19.638  12.849
    7    HE1  HIS  98           HE1      HIS  98   2.448  16.198  10.551
    8    HE2  HIS  98           HE2      HIS  98   1.592  18.579  10.453

  No H/Q in entry =           8
  In of MODEL   27
    1    H    GLU  99           H        GLU  99   4.476  16.513  17.096
    2    HA   GLU  99           HA       GLU  99   3.853  18.204  19.292
    3    HB2  GLU  99           HB2      GLU  99   3.787  15.722  19.392
    4    HB3  GLU  99           HB3      GLU  99   5.548  15.693  19.284
    5    HG2  GLU  99           HG2      GLU  99   5.725  16.989  21.356
    6    HG3  GLU  99           HG3      GLU  99   3.972  17.114  21.452

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LYS 100           H        LYS 100   6.915  17.300  17.727
    2    HA   LYS 100           HA       LYS 100   8.558  18.718  19.581
    3    HB2  LYS 100           HB2      LYS 100   9.064  17.794  16.744
    4    HB3  LYS 100           HB3      LYS 100  10.287  18.577  17.750
    5    HG2  LYS 100           HG2      LYS 100   9.927  16.825  19.494
    6    HG3  LYS 100           HG3      LYS 100   8.802  16.009  18.404
    7    HD2  LYS 100           HD2      LYS 100  10.598  15.741  16.736
    8    HD3  LYS 100           HD3      LYS 100  11.728  16.568  17.811
    9    HE2  LYS 100           HE2      LYS 100  11.349  14.812  19.532
   10    HE3  LYS 100           HE3      LYS 100  10.281  13.965  18.408
   11    HZ1  LYS 100           HZ1      LYS 100  13.095  14.659  17.751
   12    HZ3  LYS 100           HZ2      LYS 100  12.060  13.594  16.924
   13    HZ2  LYS 100           HZ3      LYS 100  12.653  13.182  18.463

  No H/Q in entry =          13
  In of MODEL   27
    1    H    LEU 101           H        LEU 101   6.854  19.625  16.625
    2    HA   LEU 101           HA       LEU 101   8.045  22.193  16.287
    3    HB2  LEU 101           HB2      LEU 101   5.461  20.935  15.402
    4    HB3  LEU 101           HB3      LEU 101   5.696  22.668  15.193
    5    HG   LEU 101           HG       LEU 101   7.750  20.669  14.229
    6   HD12  LEU 101          HD11      LEU 101   6.591  21.161  11.944
    7   HD11  LEU 101          HD12      LEU 101   5.188  21.580  12.924
    8   HD13  LEU 101          HD13      LEU 101   5.867  19.955  13.008
    9   HD21  LEU 101          HD21      LEU 101   7.095  23.575  13.670
   10   HD23  LEU 101          HD22      LEU 101   8.084  22.622  12.564
   11   HD22  LEU 101          HD23      LEU 101   8.624  22.887  14.221

  No H/Q in entry =          11
  In of MODEL   27
    1    H    LYS 102           H        LYS 102   6.519  21.044  18.904
    2    HA   LYS 102           HA       LYS 102   5.878  22.133  20.835
    3    HB2  LYS 102           HB2      LYS 102   7.142  24.133  19.708
    4    HB3  LYS 102           HB3      LYS 102   5.538  24.723  19.332
    5    HG2  LYS 102           HG2      LYS 102   6.918  24.483  21.984
    6    HG3  LYS 102           HG3      LYS 102   5.954  25.802  21.354
    7    HD2  LYS 102           HD2      LYS 102   4.734  23.156  22.237
    8    HD3  LYS 102           HD3      LYS 102   4.971  24.520  23.318
    9    HE2  LYS 102           HE2      LYS 102   2.695  24.095  21.831
   10    HE3  LYS 102           HE3      LYS 102   3.184  25.646  22.511
   11    HZ2  LYS 102           HZ1      LYS 102   2.652  25.747  20.131
   12    HZ1  LYS 102           HZ2      LYS 102   3.922  24.676  19.809
   13    HZ3  LYS 102           HZ3      LYS 102   4.252  26.210  20.450

  No H/Q in entry =          13
  In of MODEL   27
    1    H    ALA 103           H        ALA 103   4.225  23.658  18.067
    2    HA   ALA 103           HA       ALA 103   1.767  24.214  18.953
    3    HB1  ALA 103           HB1      ALA 103   0.874  23.362  16.712
    4    HB2  ALA 103           HB2      ALA 103   2.526  22.839  16.382
    5    HB3  ALA 103           HB3      ALA 103   2.177  24.548  16.646

  No H/Q in entry =           5
  In of MODEL   27
    1    H1   ALA   1           H3       ALA   1  10.740 -20.238  -6.276
    2    H2   ALA   1           H2       ALA   1   9.777 -20.454  -7.661
    3    H3   ALA   1           H1       ALA   1   9.347 -21.202  -6.197
    4    HA   ALA   1           HA       ALA   1  10.401 -23.003  -6.935
    5    HB1  ALA   1           HB1      ALA   1  10.492 -22.646  -9.211
    6    HB2  ALA   1           HB2      ALA   1  12.218 -22.481  -8.883
    7    HB3  ALA   1           HB3      ALA   1  11.208 -21.042  -9.035

  No H/Q in entry =           7
  In of MODEL   27
    1    H    GLU   2           H        GLU   2  12.692 -23.935  -6.993
    2    HA   GLU   2           HA       GLU   2  14.074 -23.840  -4.783
    3    HB2  GLU   2           HB2      GLU   2  15.427 -23.701  -7.483
    4    HB3  GLU   2           HB3      GLU   2  16.161 -24.305  -5.998
    5    HG2  GLU   2           HG2      GLU   2  15.161 -26.330  -6.236
    6    HG3  GLU   2           HG3      GLU   2  13.583 -25.597  -6.494

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLU   3           H        GLU   3  15.829 -21.964  -7.188
    2    HA   GLU   3           HA       GLU   3  16.970 -20.266  -5.231
    3    HB2  GLU   3           HB2      GLU   3  16.912 -20.267  -8.240
    4    HB3  GLU   3           HB3      GLU   3  17.648 -18.932  -7.355
    5    HG2  GLU   3           HG2      GLU   3  19.322 -20.292  -6.433
    6    HG3  GLU   3           HG3      GLU   3  18.387 -21.766  -6.651

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LEU   4           H        LEU   4  14.679 -19.439  -7.860
    2    HA   LEU   4           HA       LEU   4  14.193 -16.833  -7.251
    3    HB2  LEU   4           HB2      LEU   4  12.033 -18.825  -7.978
    4    HB3  LEU   4           HB3      LEU   4  11.944 -17.077  -8.178
    5    HG   LEU   4           HG       LEU   4  13.922 -18.927  -9.551
    6   HD13  LEU   4          HD11      LEU   4  12.617 -18.790 -11.460
    7   HD12  LEU   4          HD12      LEU   4  11.898 -17.250 -10.993
    8   HD11  LEU   4          HD13      LEU   4  11.356 -18.744 -10.230
    9   HD23  LEU   4          HD21      LEU   4  14.239 -16.680 -10.905
   10   HD22  LEU   4          HD22      LEU   4  15.102 -16.914  -9.386
   11   HD21  LEU   4          HD23      LEU   4  13.642 -15.929  -9.425

  No H/Q in entry =          11
  In of MODEL   27
    1    H    GLU   5           H        GLU   5  12.731 -19.627  -5.605
    2    HA   GLU   5           HA       GLU   5  11.043 -18.067  -3.902
    3    HB2  GLU   5           HB2      GLU   5  10.640 -20.452  -4.423
    4    HB3  GLU   5           HB3      GLU   5  12.074 -20.872  -3.485
    5    HG2  GLU   5           HG2      GLU   5  11.091 -19.851  -1.483
    6    HG3  GLU   5           HG3      GLU   5   9.668 -19.377  -2.412

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLU   6           H        GLU   6  14.202 -19.621  -3.461
    2    HA   GLU   6           HA       GLU   6  14.550 -18.759  -0.763
    3    HB2  GLU   6           HB2      GLU   6  15.792 -20.665  -1.744
    4    HB3  GLU   6           HB3      GLU   6  16.638 -19.544  -2.814
    5    HG2  GLU   6           HG2      GLU   6  17.564 -18.363  -0.868
    6    HG3  GLU   6           HG3      GLU   6  16.699 -19.452   0.217

  No H/Q in entry =           6
  In of MODEL   27
    1    H    VAL   7           H        VAL   7  15.303 -17.430  -3.915
    2    HA   VAL   7           HA       VAL   7  16.972 -15.289  -3.054
    3    HB   VAL   7           HB       VAL   7  15.267 -15.669  -5.530
    4   HG11  VAL   7          HG11      VAL   7  17.143 -13.439  -4.722
    5   HG13  VAL   7          HG12      VAL   7  15.499 -13.311  -5.343
    6   HG12  VAL   7          HG13      VAL   7  16.811 -13.804  -6.414
    7   HG21  VAL   7          HG21      VAL   7  17.386 -17.107  -4.961
    8   HG23  VAL   7          HG22      VAL   7  18.279 -15.639  -5.362
    9   HG22  VAL   7          HG23      VAL   7  17.248 -16.399  -6.571

  No H/Q in entry =           9
  In of MODEL   27
    1    H    VAL   8           H        VAL   8  13.481 -15.588  -3.608
    2    HA   VAL   8           HA       VAL   8  12.793 -12.885  -3.138
    3    HB   VAL   8           HB       VAL   8  11.206 -15.429  -2.705
    4   HG13  VAL   8          HG11      VAL   8  10.248 -13.694  -1.315
    5   HG12  VAL   8          HG12      VAL   8   9.229 -13.859  -2.745
    6   HG11  VAL   8          HG13      VAL   8  10.365 -12.516  -2.623
    7   HG22  VAL   8          HG21      VAL   8  10.600 -15.274  -4.926
    8   HG21  VAL   8          HG22      VAL   8  12.072 -14.319  -5.070
    9   HG23  VAL   8          HG23      VAL   8  10.518 -13.514  -4.877

  No H/Q in entry =           9
  In of MODEL   27
    1    H    MET   9           H        MET   9  13.086 -15.686  -0.956
    2    HA   MET   9           HA       MET   9  12.262 -14.419   1.414
    3    HB2  MET   9           HB2      MET   9  14.139 -16.702   0.840
    4    HB3  MET   9           HB3      MET   9  13.943 -16.095   2.486
    5    HG2  MET   9           HG2      MET   9  11.408 -16.339   2.084
    6    HG3  MET   9           HG3      MET   9  11.852 -17.314   0.682
    7    HE1  MET   9           HE1      MET   9  12.822 -19.361   0.568
    8    HE3  MET   9           HE2      MET   9  13.286 -20.469   1.856
    9    HE2  MET   9           HE3      MET   9  14.338 -19.118   1.443

  No H/Q in entry =           9
  In of MODEL   27
    1    H    GLY  10           H        GLY  10  15.443 -14.617  -0.145
    2    HA3  GLY  10           HA2      GLY  10  16.891 -13.181   1.822
    3    HA2  GLY  10           HA3      GLY  10  17.354 -13.344   0.129

  No H/Q in entry =           3
  In of MODEL   27
    1    H    LEU  11           H        LEU  11  15.174 -12.144  -1.110
    2    HA   LEU  11           HA       LEU  11  15.834  -9.392  -0.950
    3    HB2  LEU  11           HB2      LEU  11  13.478 -10.825  -2.182
    4    HB3  LEU  11           HB3      LEU  11  13.743  -9.088  -2.344
    5    HG   LEU  11           HG       LEU  11  15.789 -11.179  -3.131
    6   HD13  LEU  11          HD11      LEU  11  14.045 -11.564  -4.649
    7   HD12  LEU  11          HD12      LEU  11  15.036 -10.374  -5.492
    8   HD11  LEU  11          HD13      LEU  11  13.559  -9.868  -4.673
    9   HD22  LEU  11          HD21      LEU  11  17.002  -9.204  -2.908
   10   HD21  LEU  11          HD22      LEU  11  15.617  -8.180  -3.287
   11   HD23  LEU  11          HD23      LEU  11  16.455  -9.042  -4.576

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  12           H        ILE  12  13.084 -11.243   0.321
    2    HA   ILE  12           HA       ILE  12  11.670  -9.032   1.380
    3    HB   ILE  12           HB       ILE  12  11.737 -11.927   2.287
    4   HG12  ILE  12          HG12      ILE  12  10.977 -11.271  -0.113
    5   HG13  ILE  12          HG13      ILE  12   9.932 -12.322   0.821
    6   HG21  ILE  12          HG21      ILE  12   9.813  -9.681   2.975
    7   HG23  ILE  12          HG22      ILE  12  10.850 -10.564   4.094
    8   HG22  ILE  12          HG23      ILE  12   9.503 -11.384   3.306
    9   HD13  ILE  12          HD11      ILE  12   8.507 -10.433   1.385
   10   HD12  ILE  12          HD12      ILE  12   8.716 -10.496  -0.363
   11   HD11  ILE  12          HD13      ILE  12   9.610  -9.327   0.586

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  13           H        ILE  13  14.086 -11.211   2.786
    2    HA   ILE  13           HA       ILE  13  14.111 -10.029   5.365
    3    HB   ILE  13           HB       ILE  13  16.190 -11.578   3.800
    4   HG12  ILE  13          HG12      ILE  13  13.914 -12.562   4.645
    5   HG13  ILE  13          HG13      ILE  13  15.398 -13.479   4.888
    6   HG23  ILE  13          HG21      ILE  13  17.619 -10.579   5.307
    7   HG22  ILE  13          HG22      ILE  13  17.062 -11.913   6.310
    8   HG21  ILE  13          HG23      ILE  13  16.356 -10.308   6.506
    9   HD13  ILE  13          HD11      ILE  13  15.543 -12.738   7.208
   10   HD12  ILE  13          HD12      ILE  13  13.923 -13.367   6.923
   11   HD11  ILE  13          HD13      ILE  13  14.194 -11.630   6.969

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ASN  14           H        ASN  14  16.057  -9.480   2.444
    2    HA   ASN  14           HA       ASN  14  17.780  -7.518   3.503
    3    HB2  ASN  14           HB2      ASN  14  17.770  -8.787   1.188
    4    HB3  ASN  14           HB3      ASN  14  16.861  -7.381   0.651
    5   HD21  ASN  14          HD21      ASN  14  19.305  -7.694  -0.536
    6   HD22  ASN  14          HD22      ASN  14  20.436  -6.597   0.089

  No H/Q in entry =           6
  In of MODEL   27
    1    H    SER  15           H        SER  15  14.665  -7.208   1.812
    2    HA   SER  15           HA       SER  15  14.520  -4.389   1.866
    3    HB2  SER  15           HB2      SER  15  12.189  -4.664   1.375
    4    HB3  SER  15           HB3      SER  15  13.003  -6.017   0.601
    5    HG   SER  15           HG       SER  15  12.192  -7.364   2.047

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLY  16           H        GLY  16  13.457  -6.859   4.172
    2    HA3  GLY  16           HA2      GLY  16  12.216  -5.123   6.029
    3    HA2  GLY  16           HA3      GLY  16  12.850  -6.724   6.392

  No H/Q in entry =           3
  In of MODEL   27
    1    H    GLN  17           H        GLN  17  15.557  -6.359   5.798
    2    HA   GLN  17           HA       GLN  17  16.500  -5.124   8.177
    3    HB2  GLN  17           HB2      GLN  17  17.925  -5.965   5.639
    4    HB3  GLN  17           HB3      GLN  17  18.768  -5.345   7.060
    5    HG2  GLN  17           HG2      GLN  17  16.900  -7.731   7.094
    6    HG3  GLN  17           HG3      GLN  17  18.656  -7.848   6.995
    7   HE21  GLN  17          HE21      GLN  17  19.878  -7.485   8.929
    8   HE22  GLN  17          HE22      GLN  17  19.148  -7.210  10.436

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ALA  18           H        ALA  18  16.296  -4.052   4.816
    2    HA   ALA  18           HA       ALA  18  17.703  -1.642   5.039
    3    HB2  ALA  18           HB1      ALA  18  16.599  -2.872   2.974
    4    HB3  ALA  18           HB2      ALA  18  16.842  -1.126   2.956
    5    HB1  ALA  18           HB3      ALA  18  15.251  -1.791   3.327

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ARG  19           H        ARG  19  14.211  -2.272   5.438
    2    HA   ARG  19           HA       ARG  19  13.510   0.370   6.151
    3    HB2  ARG  19           HB2      ARG  19  11.851  -1.403   5.567
    4    HB3  ARG  19           HB3      ARG  19  12.203  -2.195   7.104
    5    HG2  ARG  19           HG2      ARG  19  11.468  -0.211   8.342
    6    HG3  ARG  19           HG3      ARG  19  11.207   0.660   6.832
    7    HD2  ARG  19           HD2      ARG  19   9.076  -0.162   7.654
    8    HD3  ARG  19           HD3      ARG  19   9.505  -1.038   6.179
    9    HE   ARG  19           HE       ARG  19  10.483  -2.566   8.285
   10   HH21  ARG  19          HH11      ARG  19   9.255  -4.220   9.226
   11   HH22  ARG  19          HH12      ARG  19   7.535  -4.214   9.056
   12   HH11  ARG  19          HH21      ARG  19   7.473  -1.312   7.190
   13   HH12  ARG  19          HH22      ARG  19   6.526  -2.568   7.899

  No H/Q in entry =          13
  In of MODEL   27
    1    H    SER  20           H        SER  20  14.404  -2.447   8.113
    2    HA   SER  20           HA       SER  20  14.108  -1.349  10.649
    3    HB2  SER  20           HB2      SER  20  14.644  -3.726  10.257
    4    HB3  SER  20           HB3      SER  20  16.258  -3.270   9.719
    5    HG   SER  20           HG       SER  20  15.167  -3.356  12.264

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU  21           H        LEU  21  16.949  -1.254   8.512
    2    HA   LEU  21           HA       LEU  21  18.606   0.255  10.248
    3    HB2  LEU  21           HB2      LEU  21  18.587  -0.023   7.235
    4    HB3  LEU  21           HB3      LEU  21  19.829   0.857   8.121
    5    HG   LEU  21           HG       LEU  21  19.131  -2.042   8.669
    6   HD12  LEU  21          HD11      LEU  21  21.213  -2.561   7.403
    7   HD11  LEU  21          HD12      LEU  21  21.332  -0.863   6.945
    8   HD13  LEU  21          HD13      LEU  21  19.973  -1.833   6.381
    9   HD22  LEU  21          HD21      LEU  21  20.280  -1.288  10.566
   10   HD21  LEU  21          HD22      LEU  21  21.243  -0.125   9.663
   11   HD23  LEU  21          HD23      LEU  21  21.623  -1.837   9.568

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ALA  22           H        ALA  22  16.329   1.193   7.692
    2    HA   ALA  22           HA       ALA  22  16.834   3.958   7.703
    3    HB3  ALA  22           HB1      ALA  22  15.446   2.696   6.026
    4    HB2  ALA  22           HB2      ALA  22  14.721   4.201   6.591
    5    HB1  ALA  22           HB3      ALA  22  14.150   2.655   7.220

  No H/Q in entry =           5
  In of MODEL   27
    1    H    TYR  23           H        TYR  23  14.360   2.113   9.540
    2    HA   TYR  23           HA       TYR  23  13.370   4.339  10.987
    3    HB2  TYR  23           HB2      TYR  23  12.160   2.213  10.969
    4    HB3  TYR  23           HB3      TYR  23  13.502   1.417  11.791
    5    HD1  TYR  23           HD1      TYR  23  10.977   4.142  12.163
    6    HD2  TYR  23           HD2      TYR  23  13.691   1.468  14.146
    7    HE1  TYR  23           HE1      TYR  23  10.046   4.825  14.358
    8    HE2  TYR  23           HE2      TYR  23  12.758   2.150  16.341
    9    HH   TYR  23           HH       TYR  23   9.887   4.090  16.594

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ALA  24           H        ALA  24  16.043   2.097  11.626
    2    HA   ALA  24           HA       ALA  24  16.701   3.103  14.188
    3    HB1  ALA  24           HB1      ALA  24  18.079   1.326  14.025
    4    HB3  ALA  24           HB2      ALA  24  19.095   2.258  12.925
    5    HB2  ALA  24           HB3      ALA  24  17.813   1.234  12.285

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA  25           H        ALA  25  17.647   4.040  10.908
    2    HA   ALA  25           HA       ALA  25  19.569   5.998  11.552
    3    HB1  ALA  25           HB1      ALA  25  18.863   5.039   9.238
    4    HB3  ALA  25           HB2      ALA  25  19.345   6.732   9.329
    5    HB2  ALA  25           HB3      ALA  25  17.635   6.305   9.260

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU  26           H        LEU  26  16.052   6.185  11.191
    2    HA   LEU  26           HA       LEU  26  15.795   8.964  11.639
    3    HB2  LEU  26           HB2      LEU  26  13.948   7.706  10.713
    4    HB3  LEU  26           HB3      LEU  26  13.869   6.679  12.139
    5    HG   LEU  26           HG       LEU  26  13.241   8.631  13.518
    6   HD12  LEU  26          HD11      LEU  26  12.556  10.723  12.190
    7   HD11  LEU  26          HD12      LEU  26  13.544  10.080  10.881
    8   HD13  LEU  26          HD13      LEU  26  14.284  10.475  12.433
    9   HD21  LEU  26          HD21      LEU  26  11.569   8.296  11.008
   10   HD23  LEU  26          HD22      LEU  26  11.000   8.989  12.524
   11   HD22  LEU  26          HD23      LEU  26  11.472   7.293  12.456

  No H/Q in entry =          11
  In of MODEL   27
    1    H    LYS  27           H        LYS  27  15.719   6.186  13.835
    2    HA   LYS  27           HA       LYS  27  15.111   7.547  16.202
    3    HB2  LYS  27           HB2      LYS  27  15.167   5.072  15.939
    4    HB3  LYS  27           HB3      LYS  27  16.929   5.144  15.896
    5    HG2  LYS  27           HG2      LYS  27  16.969   6.133  18.144
    6    HG3  LYS  27           HG3      LYS  27  15.202   6.132  18.190
    7    HD2  LYS  27           HD2      LYS  27  15.204   3.664  17.956
    8    HD3  LYS  27           HD3      LYS  27  16.969   3.673  17.944
    9    HE2  LYS  27           HE2      LYS  27  16.992   4.664  20.199
   10    HE3  LYS  27           HE3      LYS  27  15.226   4.685  20.214
   11    HZ3  LYS  27           HZ1      LYS  27  16.035   2.743  21.367
   12    HZ2  LYS  27           HZ2      LYS  27  16.956   2.273  20.016
   13    HZ1  LYS  27           HZ3      LYS  27  15.258   2.259  19.937

  No H/Q in entry =          13
  In of MODEL   27
    1    H    GLN  28           H        GLN  28  18.234   6.997  14.610
    2    HA   GLN  28           HA       GLN  28  19.906   8.100  16.599
    3    HB2  GLN  28           HB2      GLN  28  20.192   8.052  13.584
    4    HB3  GLN  28           HB3      GLN  28  21.474   8.543  14.692
    5    HG2  GLN  28           HG2      GLN  28  20.088   5.849  14.762
    6    HG3  GLN  28           HG3      GLN  28  21.653   6.148  14.009
    7   HE21  GLN  28          HE21      GLN  28  22.743   7.949  15.971
    8   HE22  GLN  28          HE22      GLN  28  22.973   7.080  17.409

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ALA  29           H        ALA  29  18.139   9.563  13.906
    2    HA   ALA  29           HA       ALA  29  19.111  12.193  14.156
    3    HB2  ALA  29           HB1      ALA  29  17.406  12.812  12.685
    4    HB1  ALA  29           HB2      ALA  29  16.274  11.628  13.337
    5    HB3  ALA  29           HB3      ALA  29  17.610  11.098  12.314

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LYS  30           H        LYS  30  16.351  10.568  15.679
    2    HA   LYS  30           HA       LYS  30  15.315  12.813  17.035
    3    HB2  LYS  30           HB2      LYS  30  15.232   9.871  17.741
    4    HB3  LYS  30           HB3      LYS  30  14.354  11.114  18.634
    5    HG2  LYS  30           HG2      LYS  30  13.222  11.787  16.515
    6    HG3  LYS  30           HG3      LYS  30  14.040  10.458  15.689
    7    HD2  LYS  30           HD2      LYS  30  12.983   8.842  17.219
    8    HD3  LYS  30           HD3      LYS  30  12.176  10.160  18.069
    9    HE2  LYS  30           HE2      LYS  30  11.002  10.780  15.976
   10    HE3  LYS  30           HE3      LYS  30  11.789   9.433  15.146
   11    HZ2  LYS  30           HZ1      LYS  30   9.485   9.002  16.027
   12    HZ1  LYS  30           HZ2      LYS  30  10.152   9.063  17.594
   13    HZ3  LYS  30           HZ3      LYS  30  10.671   7.882  16.485

  No H/Q in entry =          13
  In of MODEL   27
    1    H    GLN  31           H        GLN  31  17.996  10.669  17.773
    2    HA   GLN  31           HA       GLN  31  18.315  11.688  20.466
    3    HB2  GLN  31           HB2      GLN  31  20.352  10.135  18.862
    4    HB3  GLN  31           HB3      GLN  31  20.217  10.259  20.617
    5    HG2  GLN  31           HG2      GLN  31  17.712   9.283  19.849
    6    HG3  GLN  31           HG3      GLN  31  18.821   8.448  18.770
    7   HE21  GLN  31          HE21      GLN  31  17.290   7.290  21.047
    8   HE22  GLN  31          HE22      GLN  31  18.452   6.641  22.098

  No H/Q in entry =           8
  In of MODEL   27
    1    H    GLY  32           H        GLY  32  18.821  13.008  17.499
    2    HA3  GLY  32           HA2      GLY  32  19.786  15.062  16.983
    3    HA2  GLY  32           HA3      GLY  32  20.544  15.075  18.570

  No H/Q in entry =           3
  In of MODEL   27
    1    H    ASP  33           H        ASP  33  20.992  12.185  16.796
    2    HA   ASP  33           HA       ASP  33  23.811  12.886  16.328
    3    HB2  ASP  33           HB2      ASP  33  22.327  10.256  16.447
    4    HB3  ASP  33           HB3      ASP  33  24.012  10.388  15.951

  No H/Q in entry =           4
  In of MODEL   27
    1    H    PHE  34           H        PHE  34  23.317  14.203  14.446
    2    HA   PHE  34           HA       PHE  34  21.977  13.205  12.160
    3    HB2  PHE  34           HB2      PHE  34  24.088  15.359  12.388
    4    HB3  PHE  34           HB3      PHE  34  23.105  15.058  10.956
    5    HD1  PHE  34           HD1      PHE  34  23.338  16.997  13.868
    6    HD2  PHE  34           HD2      PHE  34  20.480  14.852  11.485
    7    HE1  PHE  34           HE1      PHE  34  21.509  18.378  14.815
    8    HE2  PHE  34           HE2      PHE  34  18.655  16.233  12.434
    9    HZ   PHE  34           HZ       PHE  34  19.173  17.997  14.095

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ALA  35           H        ALA  35  25.353  13.050  13.167
    2    HA   ALA  35           HA       ALA  35  26.466  12.238  10.710
    3    HB3  ALA  35           HB1      ALA  35  28.158  11.086  12.430
    4    HB2  ALA  35           HB2      ALA  35  27.285  12.104  13.576
    5    HB1  ALA  35           HB3      ALA  35  28.114  12.834  12.202

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA  36           H        ALA  36  25.370  10.273  13.478
    2    HA   ALA  36           HA       ALA  36  25.878   7.789  12.204
    3    HB2  ALA  36           HB1      ALA  36  25.455   7.041  14.280
    4    HB3  ALA  36           HB2      ALA  36  23.763   7.518  14.130
    5    HB1  ALA  36           HB3      ALA  36  24.952   8.662  14.752

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA  37           H        ALA  37  23.035   9.887  12.337
    2    HA   ALA  37           HA       ALA  37  21.197   8.098  11.163
    3    HB3  ALA  37           HB1      ALA  37  21.392  11.063  11.452
    4    HB1  ALA  37           HB2      ALA  37  20.092   9.972  11.926
    5    HB2  ALA  37           HB3      ALA  37  20.275  10.444  10.236

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LYS  38           H        LYS  38  23.270  10.579   9.681
    2    HA   LYS  38           HA       LYS  38  22.635  10.143   7.004
    3    HB2  LYS  38           HB2      LYS  38  24.429  11.720   8.448
    4    HB3  LYS  38           HB3      LYS  38  25.472  10.741   7.423
    5    HG2  LYS  38           HG2      LYS  38  24.299  11.498   5.426
    6    HG3  LYS  38           HG3      LYS  38  23.095  12.340   6.407
    7    HD2  LYS  38           HD2      LYS  38  24.674  13.956   7.158
    8    HD3  LYS  38           HD3      LYS  38  26.044  12.984   6.622
    9    HE2  LYS  38           HE2      LYS  38  25.667  14.850   5.070
   10    HE3  LYS  38           HE3      LYS  38  25.348  13.309   4.267
   11    HZ3  LYS  38           HZ1      LYS  38  23.146  13.730   4.137
   12    HZ2  LYS  38           HZ2      LYS  38  23.651  15.350   4.223
   13    HZ1  LYS  38           HZ3      LYS  38  23.086  14.561   5.616

  No H/Q in entry =          13
  In of MODEL   27
    1    H    ALA  39           H        ALA  39  25.166   8.574   8.961
    2    HA   ALA  39           HA       ALA  39  26.252   6.996   6.893
    3    HB2  ALA  39           HB1      ALA  39  26.175   6.034   9.737
    4    HB1  ALA  39           HB2      ALA  39  27.112   7.469   9.319
    5    HB3  ALA  39           HB3      ALA  39  27.480   5.922   8.557

  No H/Q in entry =           5
  In of MODEL   27
    1    H    MET  40           H        MET  40  23.647   6.353   9.192
    2    HA   MET  40           HA       MET  40  23.234   3.642   8.460
    3    HB2  MET  40           HB2      MET  40  21.395   5.667   9.751
    4    HB3  MET  40           HB3      MET  40  21.008   3.953   9.578
    5    HG2  MET  40           HG2      MET  40  23.547   4.924  10.917
    6    HG3  MET  40           HG3      MET  40  22.056   4.632  11.811
    7    HE3  MET  40           HE1      MET  40  21.533   0.992  11.990
    8    HE2  MET  40           HE2      MET  40  20.650   2.285  11.182
    9    HE1  MET  40           HE3      MET  40  21.388   2.582  12.754

  No H/Q in entry =           9
  In of MODEL   27
    1    H    MET  41           H        MET  41  21.785   6.678   7.271
    2    HA   MET  41           HA       MET  41  19.841   5.460   5.600
    3    HB2  MET  41           HB2      MET  41  21.293   8.067   5.084
    4    HB3  MET  41           HB3      MET  41  19.770   7.555   4.367
    5    HG2  MET  41           HG2      MET  41  19.027   7.360   6.919
    6    HG3  MET  41           HG3      MET  41  20.323   8.533   7.139
    7    HE2  MET  41           HE1      MET  41  19.744   9.811   3.802
    8    HE1  MET  41           HE2      MET  41  20.696  10.263   5.213
    9    HE3  MET  41           HE3      MET  41  19.411  11.327   4.648

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ASP  42           H        ASP  42  23.203   6.421   5.045
    2    HA   ASP  42           HA       ASP  42  23.299   5.946   2.288
    3    HB2  ASP  42           HB2      ASP  42  25.039   6.965   4.056
    4    HB3  ASP  42           HB3      ASP  42  25.715   5.347   3.929

  No H/Q in entry =           4
  In of MODEL   27
    1    H    GLN  43           H        GLN  43  24.050   3.802   5.010
    2    HA   GLN  43           HA       GLN  43  24.739   1.551   3.429
    3    HB2  GLN  43           HB2      GLN  43  23.716   1.725   6.273
    4    HB3  GLN  43           HB3      GLN  43  24.312   0.242   5.519
    5    HG2  GLN  43           HG2      GLN  43  26.461   1.478   5.006
    6    HG3  GLN  43           HG3      GLN  43  25.863   2.799   6.005
    7   HE21  GLN  43          HE21      GLN  43  28.107   1.852   7.041
    8   HE22  GLN  43          HE22      GLN  43  27.846   0.768   8.318

  No H/Q in entry =           8
  In of MODEL   27
    1    H    SER  44           H        SER  44  21.671   2.650   4.814
    2    HA   SER  44           HA       SER  44  20.128   0.388   4.144
    3    HB2  SER  44           HB2      SER  44  19.658   2.913   5.288
    4    HB3  SER  44           HB3      SER  44  18.623   2.857   3.863
    5    HG   SER  44           HG       SER  44  17.541   1.902   5.587

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ARG  45           H        ARG  45  20.836   3.360   2.336
    2    HA   ARG  45           HA       ARG  45  19.316   2.855   0.033
    3    HB2  ARG  45           HB2      ARG  45  20.435   5.004   0.615
    4    HB3  ARG  45           HB3      ARG  45  21.988   4.267   0.229
    5    HG2  ARG  45           HG2      ARG  45  21.208   3.851  -2.085
    6    HG3  ARG  45           HG3      ARG  45  19.667   4.611  -1.698
    7    HD2  ARG  45           HD2      ARG  45  20.894   6.723  -1.116
    8    HD3  ARG  45           HD3      ARG  45  22.399   5.966  -1.685
    9    HE   ARG  45           HE       ARG  45  20.470   5.704  -3.719
   10   HH21  ARG  45          HH11      ARG  45  20.447   7.072  -5.484
   11   HH22  ARG  45          HH12      ARG  45  21.186   8.631  -5.381
   12   HH11  ARG  45          HH21      ARG  45  22.173   8.223  -2.096
   13   HH12  ARG  45          HH22      ARG  45  22.162   9.282  -3.460

  No H/Q in entry =          13
  In of MODEL   27
    1    H    MET  46           H        MET  46  22.690   2.019   0.779
    2    HA   MET  46           HA       MET  46  23.307   0.831  -1.705
    3    HB2  MET  46           HB2      MET  46  24.419   0.496   1.084
    4    HB3  MET  46           HB3      MET  46  25.094  -0.357  -0.307
    5    HG2  MET  46           HG2      MET  46  25.460   1.799  -1.457
    6    HG3  MET  46           HG3      MET  46  24.786   2.654  -0.075
    7    HE1  MET  46           HE1      MET  46  26.952   3.773  -0.883
    8    HE3  MET  46           HE2      MET  46  28.517   3.497  -0.125
    9    HE2  MET  46           HE3      MET  46  27.176   4.117   0.837

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ALA  47           H        ALA  47  21.941  -0.515   1.274
    2    HA   ALA  47           HA       ALA  47  21.916  -3.229   0.473
    3    HB2  ALA  47           HB1      ALA  47  21.534  -2.770   2.778
    4    HB3  ALA  47           HB2      ALA  47  20.004  -3.390   2.161
    5    HB1  ALA  47           HB3      ALA  47  20.215  -1.657   2.417

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU  48           H        LEU  48  19.535  -0.627   0.116
    2    HA   LEU  48           HA       LEU  48  17.505  -2.183  -1.131
    3    HB2  LEU  48           HB2      LEU  48  18.129   0.777  -1.249
    4    HB3  LEU  48           HB3      LEU  48  16.665   0.051  -1.914
    5    HG   LEU  48           HG       LEU  48  17.524  -0.239   0.974
    6   HD13  LEU  48          HD11      LEU  48  17.082   2.057   0.785
    7   HD12  LEU  48          HD12      LEU  48  15.531   1.394   1.297
    8   HD11  LEU  48          HD13      LEU  48  15.796   1.817  -0.395
    9   HD22  LEU  48          HD21      LEU  48  16.013  -1.969   0.597
   10   HD21  LEU  48          HD22      LEU  48  15.128  -1.077  -0.641
   11   HD23  LEU  48          HD23      LEU  48  14.914  -0.673   1.062

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ASN  49           H        ASN  49  20.172  -0.229  -2.367
    2    HA   ASN  49           HA       ASN  49  19.518  -0.323  -5.090
    3    HB2  ASN  49           HB2      ASN  49  21.180   1.215  -4.189
    4    HB3  ASN  49           HB3      ASN  49  22.219  -0.127  -3.726
    5   HD21  ASN  49          HD21      ASN  49  21.151   1.854  -6.406
    6   HD22  ASN  49          HD22      ASN  49  22.216   1.207  -7.557

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLU  50           H        GLU  50  21.527  -2.495  -3.128
    2    HA   GLU  50           HA       GLU  50  22.243  -4.246  -5.252
    3    HB2  GLU  50           HB2      GLU  50  23.444  -4.206  -3.088
    4    HB3  GLU  50           HB3      GLU  50  22.009  -4.847  -2.289
    5    HG2  GLU  50           HG2      GLU  50  22.117  -6.881  -3.645
    6    HG3  GLU  50           HG3      GLU  50  23.485  -6.236  -4.549

  No H/Q in entry =           6
  In of MODEL   27
    1    H    ALA  51           H        ALA  51  19.590  -4.204  -2.922
    2    HA   ALA  51           HA       ALA  51  18.448  -6.690  -3.674
    3    HB3  ALA  51           HB1      ALA  51  16.852  -6.198  -2.117
    4    HB1  ALA  51           HB2      ALA  51  16.622  -4.554  -2.718
    5    HB2  ALA  51           HB3      ALA  51  17.987  -4.925  -1.663

  No H/Q in entry =           5
  In of MODEL   27
    1    H    HIS  52           H        HIS  52  17.826  -3.349  -4.713
    2    HA   HIS  52           HA       HIS  52  15.716  -3.899  -6.509
    3    HB2  HIS  52           HB2      HIS  52  16.328  -1.627  -5.719
    4    HB3  HIS  52           HB3      HIS  52  17.798  -1.709  -6.689
    5    HD1  HIS  52           HD1      HIS  52  17.425  -1.975  -9.342
    6    HD2  HIS  52           HD2      HIS  52  14.052  -0.882  -7.149
    7    HE1  HIS  52           HE1      HIS  52  15.741  -1.087 -11.013
    8    HE2  HIS  52           HE2      HIS  52  13.680  -0.415  -9.691

  No H/Q in entry =           8
  In of MODEL   27
    1    H    LEU  53           H        LEU  53  19.233  -3.870  -6.947
    2    HA   LEU  53           HA       LEU  53  19.289  -4.190  -9.747
    3    HB2  LEU  53           HB2      LEU  53  21.233  -4.925  -7.574
    4    HB3  LEU  53           HB3      LEU  53  21.551  -5.317  -9.261
    5    HG   LEU  53           HG       LEU  53  20.844  -2.508  -8.359
    6   HD11  LEU  53          HD11      LEU  53  23.537  -3.874  -8.568
    7   HD13  LEU  53          HD12      LEU  53  22.860  -3.023  -7.180
    8   HD12  LEU  53          HD13      LEU  53  23.353  -2.123  -8.608
    9   HD23  LEU  53          HD21      LEU  53  22.268  -2.054 -10.502
   10   HD22  LEU  53          HD22      LEU  53  20.613  -2.619 -10.704
   11   HD21  LEU  53          HD23      LEU  53  21.949  -3.739 -10.895

  No H/Q in entry =          11
  In of MODEL   27
    1    H    VAL  54           H        VAL  54  19.206  -6.573  -7.117
    2    HA   VAL  54           HA       VAL  54  19.350  -8.869  -8.773
    3    HB   VAL  54           HB       VAL  54  18.195  -8.453  -6.005
    4   HG12  VAL  54          HG11      VAL  54  18.547 -11.067  -5.997
    5   HG11  VAL  54          HG12      VAL  54  18.358 -10.903  -7.742
    6   HG13  VAL  54          HG13      VAL  54  17.065 -10.384  -6.662
    7   HG22  VAL  54          HG21      VAL  54  20.509  -8.217  -5.786
    8   HG21  VAL  54          HG22      VAL  54  20.856  -9.308  -7.126
    9   HG23  VAL  54          HG23      VAL  54  20.335  -9.958  -5.572

  No H/Q in entry =           9
  In of MODEL   27
    1    H    GLN  55           H        GLN  55  16.604  -6.993  -7.489
    2    HA   GLN  55           HA       GLN  55  14.599  -8.680  -8.557
    3    HB2  GLN  55           HB2      GLN  55  13.837  -7.160  -6.932
    4    HB3  GLN  55           HB3      GLN  55  14.614  -5.784  -7.711
    5    HG2  GLN  55           HG2      GLN  55  12.883  -5.481  -9.199
    6    HG3  GLN  55           HG3      GLN  55  12.580  -7.205  -9.365
    7   HE21  GLN  55          HE21      GLN  55  10.580  -7.775  -8.556
    8   HE22  GLN  55          HE22      GLN  55   9.801  -7.027  -7.247

  No H/Q in entry =           8
  In of MODEL   27
    1    H    THR  56           H        THR  56  16.305  -5.864  -9.924
    2    HA   THR  56           HA       THR  56  14.859  -5.522 -12.271
    3    HB   THR  56           HB       THR  56  17.878  -5.400 -12.114
    4    HG1  THR  56           HG1      THR  56  15.867  -3.640 -11.204
    5   HG22  THR  56          HG21      THR  56  16.079  -3.540 -13.633
    6   HG21  THR  56          HG22      THR  56  16.471  -5.119 -14.310
    7   HG23  THR  56          HG23      THR  56  17.761  -3.971 -13.949

  No H/Q in entry =           7
  In of MODEL   27
    1    H    LYS  57           H        LYS  57  17.535  -7.789 -11.660
    2    HA   LYS  57           HA       LYS  57  17.545  -8.988 -14.236
    3    HB2  LYS  57           HB2      LYS  57  19.339  -9.215 -12.486
    4    HB3  LYS  57           HB3      LYS  57  18.247 -10.230 -11.556
    5    HG2  LYS  57           HG2      LYS  57  18.162 -11.859 -13.391
    6    HG3  LYS  57           HG3      LYS  57  19.223 -10.844 -14.361
    7    HD2  LYS  57           HD2      LYS  57  21.009 -11.088 -12.670
    8    HD3  LYS  57           HD3      LYS  57  19.952 -12.112 -11.699
    9    HE2  LYS  57           HE2      LYS  57  21.459 -13.519 -13.029
   10    HE3  LYS  57           HE3      LYS  57  19.809 -13.727 -13.612
   11    HZ2  LYS  57           HZ1      LYS  57  21.878 -13.161 -15.184
   12    HZ1  LYS  57           HZ2      LYS  57  21.309 -11.593 -14.864
   13    HZ3  LYS  57           HZ3      LYS  57  20.275 -12.749 -15.554

  No H/Q in entry =          13
  In of MODEL   27
    1    H    LEU  58           H        LEU  58  15.777  -9.670 -11.256
    2    HA   LEU  58           HA       LEU  58  14.581 -12.059 -12.184
    3    HB2  LEU  58           HB2      LEU  58  13.768 -10.158  -9.990
    4    HB3  LEU  58           HB3      LEU  58  12.979 -11.706 -10.302
    5    HG   LEU  58           HG       LEU  58  15.949 -11.393  -9.754
    6   HD11  LEU  58          HD11      LEU  58  13.587 -11.834  -7.956
    7   HD13  LEU  58          HD12      LEU  58  15.029 -10.853  -7.698
    8   HD12  LEU  58          HD13      LEU  58  15.122 -12.608  -7.559
    9   HD22  LEU  58          HD21      LEU  58  15.854 -13.457 -10.777
   10   HD21  LEU  58          HD22      LEU  58  14.143 -13.686 -10.413
   11   HD23  LEU  58          HD23      LEU  58  15.357 -13.970  -9.165

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  59           H        ILE  59  13.870  -8.731 -12.872
    2    HA   ILE  59           HA       ILE  59  11.160  -9.413 -13.805
    3    HB   ILE  59           HB       ILE  59  11.939  -7.119 -12.606
    4   HG12  ILE  59          HG12      ILE  59  10.035  -7.011 -14.953
    5   HG13  ILE  59          HG13      ILE  59   9.622  -7.799 -13.452
    6   HG23  ILE  59          HG21      ILE  59  12.505  -5.395 -14.110
    7   HG22  ILE  59          HG22      ILE  59  12.003  -6.313 -15.513
    8   HG21  ILE  59          HG23      ILE  59  13.492  -6.725 -14.666
    9   HD12  ILE  59          HD11      ILE  59  10.382  -4.902 -13.806
   10   HD11  ILE  59          HD12      ILE  59  10.149  -5.670 -12.237
   11   HD13  ILE  59          HD13      ILE  59   8.793  -5.524 -13.356

  No H/Q in entry =          11
  In of MODEL   27
    1    H    GLU  60           H        GLU  60  14.352  -8.526 -15.071
    2    HA   GLU  60           HA       GLU  60  13.563  -8.141 -17.779
    3    HB2  GLU  60           HB2      GLU  60  15.736  -7.384 -16.923
    4    HB3  GLU  60           HB3      GLU  60  16.218  -9.053 -16.637
    5    HG2  GLU  60           HG2      GLU  60  16.018  -9.531 -19.053
    6    HG3  GLU  60           HG3      GLU  60  15.537  -7.860 -19.341

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLY  61           H        GLY  61  14.577 -11.007 -15.960
    2    HA3  GLY  61           HA2      GLY  61  14.050 -12.665 -18.357
    3    HA2  GLY  61           HA3      GLY  61  15.090 -13.132 -17.016

  No H/Q in entry =           3
  In of MODEL   27
    1    H    ASP  62           H        ASP  62  11.953 -11.622 -16.642
    2    HA   ASP  62           HA       ASP  62  11.039 -13.540 -14.791
    3    HB2  ASP  62           HB2      ASP  62  10.279 -11.166 -14.959
    4    HB3  ASP  62           HB3      ASP  62   9.373 -11.606 -16.402

  No H/Q in entry =           4
  In of MODEL   27
    1    H    ALA  63           H        ALA  63  11.560 -15.511 -16.227
    2    HA   ALA  63           HA       ALA  63   9.912 -16.158 -18.465
    3    HB1  ALA  63           HB1      ALA  63  12.041 -17.314 -17.958
    4    HB3  ALA  63           HB2      ALA  63  10.706 -18.454 -18.115
    5    HB2  ALA  63           HB3      ALA  63  11.308 -18.017 -16.516

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLY  64           H        GLY  64   9.648 -16.743 -14.998
    2    HA3  GLY  64           HA2      GLY  64   7.808 -17.185 -13.681
    3    HA2  GLY  64           HA3      GLY  64   6.793 -16.968 -15.100

  No H/Q in entry =           3
  In of MODEL   27
    1    H    GLU  65           H        GLU  65   5.560 -18.811 -14.253
    2    HA   GLU  65           HA       GLU  65   6.708 -21.364 -13.919
    3    HB2  GLU  65           HB2      GLU  65   3.871 -20.567 -14.561
    4    HB3  GLU  65           HB3      GLU  65   4.370 -22.199 -14.121
    5    HG2  GLU  65           HG2      GLU  65   4.834 -19.738 -12.415
    6    HG3  GLU  65           HG3      GLU  65   3.530 -20.898 -12.164

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLY  66           H        GLY  66   5.290 -19.800 -16.684
    2    HA3  GLY  66           HA2      GLY  66   6.253 -21.961 -18.440
    3    HA2  GLY  66           HA3      GLY  66   4.701 -21.189 -18.693

  No H/Q in entry =           3
  In of MODEL   27
    1    H    LYS  67           H        LYS  67   5.481 -20.782 -20.834
    2    HA   LYS  67           HA       LYS  67   7.745 -19.261 -21.452
    3    HB2  LYS  67           HB2      LYS  67   5.197 -19.526 -23.050
    4    HB3  LYS  67           HB3      LYS  67   6.791 -19.077 -23.671
    5    HG2  LYS  67           HG2      LYS  67   6.202 -21.676 -22.226
    6    HG3  LYS  67           HG3      LYS  67   6.250 -21.516 -23.979
    7    HD2  LYS  67           HD2      LYS  67   8.618 -20.528 -23.620
    8    HD3  LYS  67           HD3      LYS  67   8.510 -21.239 -22.006
    9    HE2  LYS  67           HE2      LYS  67   8.047 -23.447 -23.001
   10    HE3  LYS  67           HE3      LYS  67   8.144 -22.743 -24.615
   11    HZ1  LYS  67           HZ1      LYS  67  10.438 -22.075 -24.102
   12    HZ3  LYS  67           HZ2      LYS  67  10.226 -23.758 -24.060
   13    HZ2  LYS  67           HZ3      LYS  67  10.329 -22.875 -22.612

  No H/Q in entry =          13
  In of MODEL   27
    1    H    MET  68           H        MET  68   4.537 -18.067 -22.172
    2    HA   MET  68           HA       MET  68   5.234 -15.336 -22.149
    3    HB2  MET  68           HB2      MET  68   2.536 -16.684 -22.014
    4    HB3  MET  68           HB3      MET  68   2.792 -14.969 -22.334
    5    HG2  MET  68           HG2      MET  68   3.929 -17.231 -24.002
    6    HG3  MET  68           HG3      MET  68   2.514 -16.271 -24.432
    7    HE1  MET  68           HE1      MET  68   2.353 -14.003 -24.618
    8    HE3  MET  68           HE2      MET  68   3.558 -12.919 -25.308
    9    HE2  MET  68           HE3      MET  68   3.469 -13.127 -23.561

  No H/Q in entry =           9
  In of MODEL   27
    1    H    LYS  69           H        LYS  69   3.639 -17.325 -19.642
    2    HA   LYS  69           HA       LYS  69   2.760 -15.292 -17.976
    3    HB2  LYS  69           HB2      LYS  69   3.656 -18.100 -17.359
    4    HB3  LYS  69           HB3      LYS  69   2.940 -17.038 -16.145
    5    HG2  LYS  69           HG2      LYS  69   0.957 -16.725 -17.581
    6    HG3  LYS  69           HG3      LYS  69   1.666 -17.797 -18.788
    7    HD2  LYS  69           HD2      LYS  69   1.638 -19.656 -17.201
    8    HD3  LYS  69           HD3      LYS  69   1.015 -18.594 -15.936
    9    HE2  LYS  69           HE2      LYS  69  -0.830 -19.862 -16.935
   10    HE3  LYS  69           HE3      LYS  69  -0.995 -18.152 -17.327
   11    HZ3  LYS  69           HZ1      LYS  69  -0.601 -18.517 -19.490
   12    HZ2  LYS  69           HZ2      LYS  69  -1.094 -20.102 -19.135
   13    HZ1  LYS  69           HZ3      LYS  69   0.559 -19.719 -19.205

  No H/Q in entry =          13
  In of MODEL   27
    1    H    VAL  70           H        VAL  70   3.591 -15.186 -15.523
    2    HA   VAL  70           HA       VAL  70   6.490 -14.583 -15.515
    3    HB   VAL  70           HB       VAL  70   5.923 -12.557 -14.134
    4   HG12  VAL  70          HG11      VAL  70   5.001 -11.261 -16.157
    5   HG11  VAL  70          HG12      VAL  70   4.978 -12.814 -16.993
    6   HG13  VAL  70          HG13      VAL  70   6.503 -12.150 -16.408
    7   HG22  VAL  70          HG21      VAL  70   3.708 -11.822 -13.851
    8   HG21  VAL  70          HG22      VAL  70   3.527 -13.570 -13.710
    9   HG23  VAL  70          HG23      VAL  70   3.117 -12.762 -15.223

  No H/Q in entry =           9
  In of MODEL   27
    1    H    SER  71           H        SER  71   7.427 -14.547 -13.378
    2    HA   SER  71           HA       SER  71   6.530 -16.653 -11.667
    3    HB2  SER  71           HB2      SER  71   8.923 -15.981 -11.935
    4    HB3  SER  71           HB3      SER  71   8.561 -14.484 -11.081
    5    HG   SER  71           HG       SER  71   8.861 -17.048 -10.138

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU  72           H        LEU  72   5.138 -16.563  -9.999
    2    HA   LEU  72           HA       LEU  72   3.562 -14.267  -9.556
    3    HB2  LEU  72           HB2      LEU  72   3.881 -16.819  -7.985
    4    HB3  LEU  72           HB3      LEU  72   2.701 -15.575  -7.581
    5    HG   LEU  72           HG       LEU  72   2.865 -16.862 -10.325
    6   HD13  LEU  72          HD11      LEU  72   2.352 -18.603  -8.695
    7   HD12  LEU  72          HD12      LEU  72   0.881 -18.187  -9.572
    8   HD11  LEU  72          HD13      LEU  72   1.135 -17.575  -7.937
    9   HD22  LEU  72          HD21      LEU  72   1.609 -14.889 -10.555
   10   HD21  LEU  72          HD22      LEU  72   0.939 -14.995  -8.935
   11   HD23  LEU  72          HD23      LEU  72   0.359 -16.075 -10.199

  No H/Q in entry =          11
  In of MODEL   27
    1    H    VAL  73           H        VAL  73   6.237 -15.670  -7.784
    2    HA   VAL  73           HA       VAL  73   6.161 -14.135  -5.454
    3    HB   VAL  73           HB       VAL  73   8.362 -14.912  -5.034
    4   HG13  VAL  73          HG11      VAL  73   8.079 -17.244  -5.312
    5   HG12  VAL  73          HG12      VAL  73   7.219 -17.042  -6.838
    6   HG11  VAL  73          HG13      VAL  73   6.435 -16.608  -5.319
    7   HG22  VAL  73          HG21      VAL  73   9.678 -14.352  -6.869
    8   HG21  VAL  73          HG22      VAL  73   8.517 -14.998  -8.028
    9   HG23  VAL  73          HG23      VAL  73   9.529 -16.096  -7.089

  No H/Q in entry =           9
  In of MODEL   27
    1    H    LEU  74           H        LEU  74   7.138 -13.234  -8.632
    2    HA   LEU  74           HA       LEU  74   9.061 -11.262  -8.143
    3    HB2  LEU  74           HB2      LEU  74   8.611 -12.021 -10.380
    4    HB3  LEU  74           HB3      LEU  74   6.939 -11.469 -10.279
    5    HG   LEU  74           HG       LEU  74   7.780  -9.127 -10.000
    6   HD11  LEU  74          HD11      LEU  74  10.414 -10.561 -10.361
    7   HD13  LEU  74          HD12      LEU  74   9.971  -9.389  -9.123
    8   HD12  LEU  74          HD13      LEU  74  10.231  -8.859 -10.784
    9   HD21  LEU  74          HD21      LEU  74   7.262 -10.409 -12.213
   10   HD23  LEU  74          HD22      LEU  74   8.991 -10.297 -12.446
   11   HD22  LEU  74          HD23      LEU  74   8.048  -8.833 -12.288

  No H/Q in entry =          11
  In of MODEL   27
    1    H    VAL  75           H        VAL  75   5.561 -10.918  -8.495
    2    HA   VAL  75           HA       VAL  75   5.434  -8.162  -7.912
    3    HB   VAL  75           HB       VAL  75   3.369 -10.329  -7.520
    4   HG13  VAL  75          HG11      VAL  75   2.859  -8.420  -6.046
    5   HG12  VAL  75          HG12      VAL  75   1.775  -8.392  -7.430
    6   HG11  VAL  75          HG13      VAL  75   3.148  -7.298  -7.372
    7   HG21  VAL  75          HG21      VAL  75   3.968  -8.286  -9.680
    8   HG23  VAL  75          HG22      VAL  75   2.442  -9.163  -9.590
    9   HG22  VAL  75          HG23      VAL  75   3.951 -10.042  -9.845

  No H/Q in entry =           9
  In of MODEL   27
    1    H    GLU  76           H        GLU  76   5.214 -11.039  -5.798
    2    HA   GLU  76           HA       GLU  76   4.729  -9.680  -3.378
    3    HB2  GLU  76           HB2      GLU  76   4.578 -12.146  -3.599
    4    HB3  GLU  76           HB3      GLU  76   6.311 -12.231  -3.857
    5    HG2  GLU  76           HG2      GLU  76   5.907 -12.813  -1.555
    6    HG3  GLU  76           HG3      GLU  76   6.632 -11.215  -1.553

  No H/Q in entry =           6
  In of MODEL   27
    1    H    ALA  77           H        ALA  77   7.799 -10.555  -4.941
    2    HA   ALA  77           HA       ALA  77   9.476  -9.490  -2.927
    3    HB2  ALA  77           HB1      ALA  77  11.138  -9.327  -4.913
    4    HB3  ALA  77           HB2      ALA  77   9.860 -10.107  -5.845
    5    HB1  ALA  77           HB3      ALA  77  10.550 -10.921  -4.440

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLN  78           H        GLN  78   8.068  -8.092  -5.842
    2    HA   GLN  78           HA       GLN  78   9.393  -5.598  -5.741
    3    HB2  GLN  78           HB2      GLN  78   8.111  -6.525  -7.699
    4    HB3  GLN  78           HB3      GLN  78   6.622  -6.172  -6.825
    5    HG2  GLN  78           HG2      GLN  78   7.236  -3.791  -6.727
    6    HG3  GLN  78           HG3      GLN  78   8.729  -4.137  -7.598
    7   HE21  GLN  78          HE21      GLN  78   8.334  -3.167  -9.632
    8   HE22  GLN  78          HE22      GLN  78   6.997  -3.537 -10.610

  No H/Q in entry =           8
  In of MODEL   27
    1    H    LEU  79           H        LEU  79   6.387  -6.766  -4.310
    2    HA   LEU  79           HA       LEU  79   5.367  -4.369  -3.304
    3    HB2  LEU  79           HB2      LEU  79   4.074  -6.434  -3.246
    4    HB3  LEU  79           HB3      LEU  79   5.227  -7.160  -2.130
    5    HG   LEU  79           HG       LEU  79   4.656  -5.521  -0.405
    6   HD13  LEU  79          HD11      LEU  79   4.169  -3.513  -1.459
    7   HD12  LEU  79          HD12      LEU  79   2.550  -4.056  -1.019
    8   HD11  LEU  79          HD13      LEU  79   3.133  -4.274  -2.667
    9   HD23  LEU  79          HD21      LEU  79   2.075  -6.041  -0.315
   10   HD22  LEU  79          HD22      LEU  79   3.229  -7.368  -0.204
   11   HD21  LEU  79          HD23      LEU  79   2.412  -7.042  -1.730

  No H/Q in entry =          11
  In of MODEL   27
    1    H    HIS  80           H        HIS  80   7.573  -6.679  -1.717
    2    HA   HIS  80           HA       HIS  80   7.844  -5.130   0.649
    3    HB2  HIS  80           HB2      HIS  80   9.207  -7.482  -0.545
    4    HB3  HIS  80           HB3      HIS  80  10.108  -6.574   0.671
    5    HD1  HIS  80           HD1      HIS  80   9.622  -7.212   3.014
    6    HD2  HIS  80           HD2      HIS  80   6.416  -8.099   0.501
    7    HE1  HIS  80           HE1      HIS  80   7.861  -8.331   4.463
    8    HE2  HIS  80           HE2      HIS  80   5.900  -8.876   2.939

  No H/Q in entry =           8
  In of MODEL   27
    1    H    LEU  81           H        LEU  81   9.854  -5.389  -2.261
    2    HA   LEU  81           HA       LEU  81  11.879  -3.626  -1.383
    3    HB2  LEU  81           HB2      LEU  81  10.969  -4.432  -4.146
    4    HB3  LEU  81           HB3      LEU  81  12.378  -3.411  -3.856
    5    HG   LEU  81           HG       LEU  81  12.012  -6.135  -2.579
    6   HD12  LEU  81          HD11      LEU  81  13.836  -6.745  -4.326
    7   HD11  LEU  81          HD12      LEU  81  13.256  -5.328  -5.200
    8   HD13  LEU  81          HD13      LEU  81  12.158  -6.663  -4.861
    9   HD23  LEU  81          HD21      LEU  81  14.637  -5.793  -2.563
   10   HD22  LEU  81          HD22      LEU  81  13.646  -5.041  -1.315
   11   HD21  LEU  81          HD23      LEU  81  14.216  -4.085  -2.683

  No H/Q in entry =          11
  In of MODEL   27
    1    H    MET  82           H        MET  82   8.952  -3.022  -3.323
    2    HA   MET  82           HA       MET  82   9.466  -0.291  -3.827
    3    HB2  MET  82           HB2      MET  82   6.922  -1.910  -3.703
    4    HB3  MET  82           HB3      MET  82   6.905  -0.186  -4.069
    5    HG2  MET  82           HG2      MET  82   8.527  -2.246  -5.600
    6    HG3  MET  82           HG3      MET  82   6.954  -1.639  -6.115
    7    HE3  MET  82           HE1      MET  82   7.370   1.818  -7.291
    8    HE2  MET  82           HE2      MET  82   6.996   1.590  -5.584
    9    HE1  MET  82           HE3      MET  82   6.343   0.473  -6.778

  No H/Q in entry =           9
  In of MODEL   27
    1    H    THR  83           H        THR  83   7.687  -1.903  -1.222
    2    HA   THR  83           HA       THR  83   6.812   0.438   0.101
    3    HB   THR  83           HB       THR  83   6.691  -1.135   2.121
    4    HG1  THR  83           HG1      THR  83   7.467  -3.078   1.894
    5   HG22  THR  83          HG21      THR  83   5.054  -2.718   0.653
    6   HG21  THR  83          HG22      THR  83   5.269  -1.389  -0.481
    7   HG23  THR  83          HG23      THR  83   4.624  -1.078   1.132

  No H/Q in entry =           7
  In of MODEL   27
    1    H    SER  84           H        SER  84   9.655  -1.632   0.627
    2    HA   SER  84           HA       SER  84  10.699  -0.189   2.814
    3    HB2  SER  84           HB2      SER  84  11.971  -2.023   0.793
    4    HB3  SER  84           HB3      SER  84  12.909  -1.259   2.075
    5    HG   SER  84           HG       SER  84  10.650  -2.969   2.334

  No H/Q in entry =           5
  In of MODEL   27
    1    H    MET  85           H        MET  85  11.453   0.074  -0.673
    2    HA   MET  85           HA       MET  85  13.433   2.058  -0.423
    3    HB2  MET  85           HB2      MET  85  13.047   0.768  -2.487
    4    HB3  MET  85           HB3      MET  85  11.516   1.613  -2.719
    5    HG2  MET  85           HG2      MET  85  12.692   3.760  -2.864
    6    HG3  MET  85           HG3      MET  85  14.229   2.956  -2.560
    7    HE1  MET  85           HE1      MET  85  11.162   3.252  -4.520
    8    HE3  MET  85           HE2      MET  85  11.222   1.624  -5.190
    9    HE2  MET  85           HE3      MET  85  11.586   3.002  -6.221

  No H/Q in entry =           9
  In of MODEL   27
    1    H    LEU  86           H        LEU  86   9.941   2.361  -0.936
    2    HA   LEU  86           HA       LEU  86   9.852   5.173  -1.121
    3    HB2  LEU  86           HB2      LEU  86   8.023   3.496  -1.697
    4    HB3  LEU  86           HB3      LEU  86   7.692   3.406   0.033
    5    HG   LEU  86           HG       LEU  86   7.509   5.965  -0.023
    6   HD11  LEU  86          HD11      LEU  86   8.291   5.532  -2.724
    7   HD13  LEU  86          HD12      LEU  86   7.841   7.057  -1.965
    8   HD12  LEU  86          HD13      LEU  86   6.614   6.082  -2.770
    9   HD23  LEU  86          HD21      LEU  86   5.389   4.591  -1.686
   10   HD22  LEU  86          HD22      LEU  86   5.186   5.851  -0.471
   11   HD21  LEU  86          HD23      LEU  86   5.600   4.211   0.024

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ALA  87           H        ALA  87   9.402   2.994   1.627
    2    HA   ALA  87           HA       ALA  87   8.836   4.906   3.594
    3    HB1  ALA  87           HB1      ALA  87   9.667   2.092   3.512
    4    HB3  ALA  87           HB2      ALA  87   8.534   2.896   4.595
    5    HB2  ALA  87           HB3      ALA  87  10.262   2.943   4.941

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ARG  88           H        ARG  88  11.932   3.506   2.618
    2    HA   ARG  88           HA       ARG  88  13.528   4.901   4.450
    3    HB2  ARG  88           HB2      ARG  88  14.214   2.931   3.049
    4    HB3  ARG  88           HB3      ARG  88  14.359   4.024   1.675
    5    HG2  ARG  88           HG2      ARG  88  15.819   5.353   3.621
    6    HG3  ARG  88           HG3      ARG  88  16.154   3.666   4.002
    7    HD2  ARG  88           HD2      ARG  88  17.425   3.378   2.157
    8    HD3  ARG  88           HD3      ARG  88  16.281   4.239   1.122
    9    HE   ARG  88           HE       ARG  88  18.666   5.324   2.169
   10   HH21  ARG  88          HH11      ARG  88  18.992   7.546   1.972
   11   HH22  ARG  88          HH12      ARG  88  17.632   8.606   1.827
   12   HH11  ARG  88          HH21      ARG  88  15.320   6.048   1.888
   13   HH12  ARG  88          HH22      ARG  88  15.552   7.755   1.754

  No H/Q in entry =          13
  In of MODEL   27
    1    H    GLU  89           H        GLU  89  12.550   5.786   1.124
    2    HA   GLU  89           HA       GLU  89  14.076   8.159   0.966
    3    HB2  GLU  89           HB2      GLU  89  12.942   7.106  -0.981
    4    HB3  GLU  89           HB3      GLU  89  11.393   7.634  -0.325
    5    HG2  GLU  89           HG2      GLU  89  12.074   9.978  -0.490
    6    HG3  GLU  89           HG3      GLU  89  13.683   9.500  -1.025

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LEU  90           H        LEU  90  10.751   7.622   2.094
    2    HA   LEU  90           HA       LEU  90  10.212  10.352   2.665
    3    HB2  LEU  90           HB2      LEU  90   9.038   7.770   3.695
    4    HB3  LEU  90           HB3      LEU  90   8.394   9.360   4.116
    5    HG   LEU  90           HG       LEU  90   8.821   8.480   1.248
    6   HD12  LEU  90          HD11      LEU  90   6.290   8.129   1.309
    7   HD11  LEU  90          HD12      LEU  90   6.444   8.123   3.066
    8   HD13  LEU  90          HD13      LEU  90   7.274   6.899   2.104
    9   HD22  LEU  90          HD21      LEU  90   8.508  10.785   1.171
   10   HD21  LEU  90          HD22      LEU  90   7.520  10.811   2.631
   11   HD23  LEU  90          HD23      LEU  90   6.828  10.248   1.110

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  91           H        ILE  91  11.496   7.684   4.592
    2    HA   ILE  91           HA       ILE  91  11.624   9.053   7.058
    3    HB   ILE  91           HB       ILE  91  13.198   6.727   5.938
    4   HG12  ILE  91          HG12      ILE  91  11.179   6.880   8.197
    5   HG13  ILE  91          HG13      ILE  91  10.712   6.592   6.521
    6   HG22  ILE  91          HG21      ILE  91  13.669   6.521   8.580
    7   HG21  ILE  91          HG22      ILE  91  13.578   8.278   8.476
    8   HG23  ILE  91          HG23      ILE  91  14.764   7.399   7.514
    9   HD13  ILE  91          HD11      ILE  91  11.733   4.499   6.454
   10   HD12  ILE  91          HD12      ILE  91  11.138   4.555   8.114
   11   HD11  ILE  91          HD13      ILE  91  12.837   4.882   7.776

  No H/Q in entry =          11
  In of MODEL   27
    1    H    THR  92           H        THR  92  13.843   8.900   4.308
    2    HA   THR  92           HA       THR  92  15.996  10.313   5.467
    3    HB   THR  92           HB       THR  92  15.013  10.176   2.606
    4    HG1  THR  92           HG1      THR  92  15.860   8.287   3.013
    5   HG22  THR  92          HG21      THR  92  17.577  10.888   2.313
    6   HG21  THR  92          HG22      THR  92  17.261  11.708   3.841
    7   HG23  THR  92          HG23      THR  92  16.288  12.086   2.419

  No H/Q in entry =           7
  In of MODEL   27
    1    H    GLU  93           H        GLU  93  13.100  11.439   3.735
    2    HA   GLU  93           HA       GLU  93  13.671  14.205   3.846
    3    HB2  GLU  93           HB2      GLU  93  10.978  12.809   3.861
    4    HB3  GLU  93           HB3      GLU  93  11.252  14.511   3.487
    5    HG2  GLU  93           HG2      GLU  93  12.610  12.278   1.962
    6    HG3  GLU  93           HG3      GLU  93  11.058  12.947   1.474

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LEU  94           H        LEU  94  11.946  12.037   6.059
    2    HA   LEU  94           HA       LEU  94  11.119  13.978   7.933
    3    HB2  LEU  94           HB2      LEU  94  11.720  11.029   8.211
    4    HB3  LEU  94           HB3      LEU  94  11.139  12.001   9.559
    5    HG   LEU  94           HG       LEU  94   9.656  12.036   6.930
    6   HD11  LEU  94          HD11      LEU  94   9.757   9.819   8.937
    7   HD13  LEU  94          HD12      LEU  94   9.457   9.753   7.202
    8   HD12  LEU  94          HD13      LEU  94   8.173  10.260   8.299
    9   HD23  LEU  94          HD21      LEU  94   7.732  12.421   8.529
   10   HD22  LEU  94          HD22      LEU  94   8.960  13.686   8.565
   11   HD21  LEU  94          HD23      LEU  94   8.908  12.471   9.841

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  95           H        ILE  95  14.109  12.074   7.699
    2    HA   ILE  95           HA       ILE  95  15.268  13.010  10.112
    3    HB   ILE  95           HB       ILE  95  16.517  11.948   7.566
    4   HG12  ILE  95          HG12      ILE  95  16.231  10.748  10.335
    5   HG13  ILE  95          HG13      ILE  95  15.067  10.478   9.040
    6   HG21  ILE  95          HG21      ILE  95  17.764  12.769  10.207
    7   HG23  ILE  95          HG22      ILE  95  18.223  13.299   8.588
    8   HG22  ILE  95          HG23      ILE  95  18.543  11.643   9.098
    9   HD13  ILE  95          HD11      ILE  95  16.558   9.211   7.779
   10   HD12  ILE  95          HD12      ILE  95  17.034   8.768   9.415
   11   HD11  ILE  95          HD13      ILE  95  17.977   9.955   8.515

  No H/Q in entry =          11
  In of MODEL   27
    1    H    GLU  96           H        GLU  96  15.413  14.240   6.776
    2    HA   GLU  96           HA       GLU  96  17.241  16.335   7.251
    3    HB2  GLU  96           HB2      GLU  96  16.583  15.665   4.993
    4    HB3  GLU  96           HB3      GLU  96  14.935  16.207   5.292
    5    HG2  GLU  96           HG2      GLU  96  15.483  18.341   4.747
    6    HG3  GLU  96           HG3      GLU  96  16.781  18.354   5.930

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LEU  97           H        LEU  97  13.731  16.118   7.680
    2    HA   LEU  97           HA       LEU  97  13.291  18.849   8.318
    3    HB2  LEU  97           HB2      LEU  97  11.795  16.311   8.935
    4    HB3  LEU  97           HB3      LEU  97  11.268  17.855   9.605
    5    HG   LEU  97           HG       LEU  97  11.756  17.439   6.640
    6   HD12  LEU  97          HD11      LEU  97   9.233  17.289   6.522
    7   HD11  LEU  97          HD12      LEU  97   9.228  17.092   8.273
    8   HD13  LEU  97          HD13      LEU  97  10.019  15.890   7.252
    9   HD23  LEU  97          HD21      LEU  97  10.001  19.388   6.670
   10   HD22  LEU  97          HD22      LEU  97  11.679  19.763   7.063
   11   HD21  LEU  97          HD23      LEU  97  10.491  19.584   8.353

  No H/Q in entry =          11
  In of MODEL   27
    1    H    HIS  98           H        HIS  98  14.137  16.033  10.318
    2    HA   HIS  98           HA       HIS  98  13.968  17.295  12.832
    3    HB2  HIS  98           HB2      HIS  98  15.737  15.052  11.833
    4    HB3  HIS  98           HB3      HIS  98  15.731  15.592  13.514
    5    HD1  HIS  98           HD1      HIS  98  13.546  13.941  10.923
    6    HD2  HIS  98           HD2      HIS  98  13.431  14.864  14.987
    7    HE1  HIS  98           HE1      HIS  98  11.531  12.730  11.877
    8    HE2  HIS  98           HE2      HIS  98  11.441  13.284  14.348

  No H/Q in entry =           8
  In of MODEL   27
    1    H    GLU  99           H        GLU  99  16.523  17.199  10.398
    2    HA   GLU  99           HA       GLU  99  18.497  18.549  11.925
    3    HB2  GLU  99           HB2      GLU  99  18.987  17.263   9.858
    4    HB3  GLU  99           HB3      GLU  99  18.167  18.510   8.915
    5    HG2  GLU  99           HG2      GLU  99  19.761  20.195   9.704
    6    HG3  GLU  99           HG3      GLU  99  20.550  19.001  10.729

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LYS 100           H        LYS 100  15.963  19.688   9.708
    2    HA   LYS 100           HA       LYS 100  16.738  22.432   9.848
    3    HB2  LYS 100           HB2      LYS 100  14.116  21.120   9.095
    4    HB3  LYS 100           HB3      LYS 100  14.401  22.861   9.003
    5    HG2  LYS 100           HG2      LYS 100  16.377  22.427   7.537
    6    HG3  LYS 100           HG3      LYS 100  15.978  20.706   7.556
    7    HD2  LYS 100           HD2      LYS 100  13.778  21.197   6.555
    8    HD3  LYS 100           HD3      LYS 100  14.161  22.919   6.543
    9    HE2  LYS 100           HE2      LYS 100  16.124  22.453   5.084
   10    HE3  LYS 100           HE3      LYS 100  15.672  20.744   5.052
   11    HZ1  LYS 100           HZ1      LYS 100  13.830  22.921   4.215
   12    HZ3  LYS 100           HZ2      LYS 100  13.659  21.250   3.955
   13    HZ2  LYS 100           HZ3      LYS 100  14.863  22.121   3.132

  No H/Q in entry =          13
  In of MODEL   27
    1    H    LEU 101           H        LEU 101  14.657  20.371  11.816
    2    HA   LEU 101           HA       LEU 101  13.474  22.431  13.392
    3    HB2  LEU 101           HB2      LEU 101  13.940  19.486  13.779
    4    HB3  LEU 101           HB3      LEU 101  13.396  20.463  15.139
    5    HG   LEU 101           HG       LEU 101  11.978  20.537  12.470
    6   HD12  LEU 101          HD11      LEU 101  10.331  18.961  13.740
    7   HD11  LEU 101          HD12      LEU 101  11.729  18.561  14.735
    8   HD13  LEU 101          HD13      LEU 101  11.765  18.252  12.999
    9   HD21  LEU 101          HD21      LEU 101  11.314  21.328  15.321
   10   HD23  LEU 101          HD22      LEU 101  10.055  21.091  14.111
   11   HD22  LEU 101          HD23      LEU 101  11.280  22.335  13.872

  No H/Q in entry =          11
  In of MODEL   27
    1    H    LYS 102           H        LYS 102  16.627  21.848  12.956
    2    HA   LYS 102           HA       LYS 102  18.466  22.734  14.028
    3    HB2  LYS 102           HB2      LYS 102  16.640  24.236  15.159
    4    HB3  LYS 102           HB3      LYS 102  16.856  23.177  16.537
    5    HG2  LYS 102           HG2      LYS 102  18.733  25.201  15.366
    6    HG3  LYS 102           HG3      LYS 102  18.353  24.886  17.045
    7    HD2  LYS 102           HD2      LYS 102  20.035  22.985  15.361
    8    HD3  LYS 102           HD3      LYS 102  20.714  24.313  16.293
    9    HE2  LYS 102           HE2      LYS 102  20.336  21.762  17.264
   10    HE3  LYS 102           HE3      LYS 102  20.543  23.207  18.254
   11    HZ2  LYS 102           HZ1      LYS 102  18.585  21.908  18.873
   12    HZ1  LYS 102           HZ2      LYS 102  17.939  22.132  17.324
   13    HZ3  LYS 102           HZ3      LYS 102  18.159  23.464  18.349

  No H/Q in entry =          13
  In of MODEL   27
    1    H    ALA 103           H        ALA 103  16.407  21.115  16.451
    2    HA   ALA 103           HA       ALA 103  18.144  19.920  18.107
    3    HB2  ALA 103           HB1      ALA 103  16.575  17.900  18.104
    4    HB1  ALA 103           HB2      ALA 103  15.673  18.745  16.845
    5    HB3  ALA 103           HB3      ALA 103  15.845  19.469  18.443

  No H/Q in entry =           5
  In of MODEL   27
    1    H1   ALA   1           H3       ALA   1  -1.579  -7.127 -21.486
    2    H2   ALA   1           H2       ALA   1  -2.363  -8.567 -21.031
    3    H3   ALA   1           H1       ALA   1  -0.755  -8.606 -21.586
    4    HA   ALA   1           HA       ALA   1  -1.585  -9.083 -23.582
    5    HB1  ALA   1           HB1      ALA   1  -3.716  -9.816 -23.108
    6    HB2  ALA   1           HB2      ALA   1  -4.166  -8.310 -23.907
    7    HB3  ALA   1           HB3      ALA   1  -4.105  -8.388 -22.148

  No H/Q in entry =           7
  In of MODEL   27
    1    H    GLU   2           H        GLU   2  -2.423  -7.901 -25.572
    2    HA   GLU   2           HA       GLU   2  -1.039  -5.878 -26.452
    3    HB2  GLU   2           HB2      GLU   2  -4.046  -5.967 -26.770
    4    HB3  GLU   2           HB3      GLU   2  -2.931  -5.097 -27.820
    5    HG2  GLU   2           HG2      GLU   2  -2.414  -6.984 -28.973
    6    HG3  GLU   2           HG3      GLU   2  -2.110  -7.886 -27.495

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLU   3           H        GLU   3  -4.208  -4.643 -25.553
    2    HA   GLU   3           HA       GLU   3  -3.181  -2.078 -24.927
    3    HB2  GLU   3           HB2      GLU   3  -5.859  -3.412 -24.594
    4    HB3  GLU   3           HB3      GLU   3  -5.573  -1.794 -23.949
    5    HG2  GLU   3           HG2      GLU   3  -5.223  -0.867 -26.076
    6    HG3  GLU   3           HG3      GLU   3  -4.816  -2.420 -26.799

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LEU   4           H        LEU   4  -4.754  -4.447 -22.745
    2    HA   LEU   4           HA       LEU   4  -4.399  -3.214 -20.355
    3    HB2  LEU   4           HB2      LEU   4  -3.835  -6.152 -20.822
    4    HB3  LEU   4           HB3      LEU   4  -4.247  -5.407 -19.279
    5    HG   LEU   4           HG       LEU   4  -6.018  -5.496 -21.744
    6   HD13  LEU   4          HD11      LEU   4  -7.199  -7.221 -20.745
    7   HD12  LEU   4          HD12      LEU   4  -6.718  -6.757 -19.114
    8   HD11  LEU   4          HD13      LEU   4  -5.576  -7.593 -20.164
    9   HD23  LEU   4          HD21      LEU   4  -7.709  -4.695 -19.877
   10   HD22  LEU   4          HD22      LEU   4  -6.679  -3.517 -20.688
   11   HD21  LEU   4          HD23      LEU   4  -6.249  -4.103 -19.082

  No H/Q in entry =          11
  In of MODEL   27
    1    H    GLU   5           H        GLU   5  -1.888  -5.041 -22.084
    2    HA   GLU   5           HA       GLU   5   0.093  -4.741 -20.047
    3    HB2  GLU   5           HB2      GLU   5   0.182  -6.514 -21.787
    4    HB3  GLU   5           HB3      GLU   5   0.464  -5.275 -23.009
    5    HG2  GLU   5           HG2      GLU   5   2.529  -4.594 -21.873
    6    HG3  GLU   5           HG3      GLU   5   2.245  -5.789 -20.608

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLU   6           H        GLU   6  -0.553  -3.035 -23.093
    2    HA   GLU   6           HA       GLU   6   1.603  -1.187 -22.826
    3    HB2  GLU   6           HB2      GLU   6   0.491  -1.672 -24.989
    4    HB3  GLU   6           HB3      GLU   6  -0.978  -0.906 -24.386
    5    HG2  GLU   6           HG2      GLU   6   0.237   1.212 -24.083
    6    HG3  GLU   6           HG3      GLU   6   1.718   0.452 -24.662

  No H/Q in entry =           6
  In of MODEL   27
    1    H    VAL   7           H        VAL   7  -1.735  -1.282 -21.782
    2    HA   VAL   7           HA       VAL   7  -1.976   1.430 -20.948
    3    HB   VAL   7           HB       VAL   7  -3.420  -1.098 -20.110
    4   HG11  VAL   7          HG11      VAL   7  -3.816   1.789 -19.298
    5   HG13  VAL   7          HG12      VAL   7  -3.706   0.366 -18.262
    6   HG12  VAL   7          HG13      VAL   7  -5.140   0.625 -19.255
    7   HG21  VAL   7          HG21      VAL   7  -3.584  -0.024 -22.499
    8   HG23  VAL   7          HG22      VAL   7  -4.539   1.218 -21.688
    9   HG22  VAL   7          HG23      VAL   7  -5.072  -0.463 -21.661

  No H/Q in entry =           9
  In of MODEL   27
    1    H    VAL   8           H        VAL   8  -0.967  -1.547 -19.302
    2    HA   VAL   8           HA       VAL   8  -0.657  -0.463 -16.708
    3    HB   VAL   8           HB       VAL   8   0.761  -2.771 -18.062
    4   HG13  VAL   8          HG11      VAL   8   2.143  -1.998 -16.232
    5   HG12  VAL   8          HG12      VAL   8   1.296  -3.448 -15.692
    6   HG11  VAL   8          HG13      VAL   8   0.741  -1.858 -15.171
    7   HG22  VAL   8          HG21      VAL   8  -1.006  -4.092 -17.380
    8   HG21  VAL   8          HG22      VAL   8  -1.886  -2.568 -17.359
    9   HG23  VAL   8          HG23      VAL   8  -1.206  -3.209 -15.868

  No H/Q in entry =           9
  In of MODEL   27
    1    H    MET   9           H        MET   9   1.594  -0.750 -19.454
    2    HA   MET   9           HA       MET   9   3.873   0.309 -18.193
    3    HB2  MET   9           HB2      MET   9   2.919   0.274 -21.049
    4    HB3  MET   9           HB3      MET   9   4.393   1.133 -20.604
    5    HG2  MET   9           HG2      MET   9   5.101  -1.049 -19.430
    6    HG3  MET   9           HG3      MET   9   3.795  -1.815 -20.336
    7    HE1  MET   9           HE1      MET   9   3.581  -2.191 -22.558
    8    HE3  MET   9           HE2      MET   9   4.711  -1.891 -23.876
    9    HE2  MET   9           HE3      MET   9   3.726  -0.571 -23.250

  No H/Q in entry =           9
  In of MODEL   27
    1    H    GLY  10           H        GLY  10   1.178   1.893 -19.872
    2    HA3  GLY  10           HA2      GLY  10   2.125   4.552 -19.630
    3    HA2  GLY  10           HA3      GLY  10   0.438   4.081 -19.834

  No H/Q in entry =           3
  In of MODEL   27
    1    H    LEU  11           H        LEU  11   0.049   2.553 -17.547
    2    HA   LEU  11           HA       LEU  11  -0.494   4.528 -15.588
    3    HB2  LEU  11           HB2      LEU  11  -0.408   1.513 -15.430
    4    HB3  LEU  11           HB3      LEU  11  -0.923   2.534 -14.088
    5    HG   LEU  11           HG       LEU  11  -2.163   2.638 -16.852
    6   HD13  LEU  11          HD11      LEU  11  -2.733   0.492 -16.095
    7   HD12  LEU  11          HD12      LEU  11  -4.090   1.476 -15.550
    8   HD11  LEU  11          HD13      LEU  11  -2.830   1.004 -14.410
    9   HD22  LEU  11          HD21      LEU  11  -2.765   4.651 -15.846
   10   HD21  LEU  11          HD22      LEU  11  -2.686   3.986 -14.215
   11   HD23  LEU  11          HD23      LEU  11  -4.059   3.611 -15.256

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  12           H        ILE  12   2.064   2.077 -15.830
    2    HA   ILE  12           HA       ILE  12   3.267   2.623 -13.327
    3    HB   ILE  12           HB       ILE  12   4.489   1.566 -15.897
    4   HG12  ILE  12          HG12      ILE  12   2.547   0.312 -14.700
    5   HG13  ILE  12          HG13      ILE  12   3.976  -0.607 -15.130
    6   HG21  ILE  12          HG21      ILE  12   5.562   1.590 -13.057
    7   HG23  ILE  12          HG22      ILE  12   6.272   2.379 -14.465
    8   HG22  ILE  12          HG23      ILE  12   6.243   0.619 -14.361
    9   HD13  ILE  12          HD11      ILE  12   4.788  -0.429 -12.834
   10   HD12  ILE  12          HD12      ILE  12   3.153  -1.087 -12.834
   11   HD11  ILE  12          HD13      ILE  12   3.423   0.589 -12.411

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  13           H        ILE  13   3.860   3.888 -16.585
    2    HA   ILE  13           HA       ILE  13   5.987   5.621 -15.862
    3    HB   ILE  13           HB       ILE  13   3.955   5.692 -18.106
    4   HG12  ILE  13          HG12      ILE  13   5.800   3.858 -17.826
    5   HG13  ILE  13          HG13      ILE  13   5.546   4.593 -19.405
    6   HG23  ILE  13          HG21      ILE  13   4.563   7.910 -18.178
    7   HG22  ILE  13          HG22      ILE  13   5.901   7.240 -19.105
    8   HG21  ILE  13          HG23      ILE  13   6.122   7.631 -17.400
    9   HD13  ILE  13          HD11      ILE  13   7.464   6.059 -19.103
   10   HD12  ILE  13          HD12      ILE  13   7.968   4.419 -18.714
   11   HD11  ILE  13          HD13      ILE  13   7.624   5.558 -17.419

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ASN  14           H        ASN  14   2.477   6.095 -16.129
    2    HA   ASN  14           HA       ASN  14   2.419   8.841 -15.493
    3    HB2  ASN  14           HB2      ASN  14   0.535   7.188 -16.322
    4    HB3  ASN  14           HB3      ASN  14   0.216   7.008 -14.601
    5   HD21  ASN  14          HD21      ASN  14  -1.811   8.152 -16.033
    6   HD22  ASN  14          HD22      ASN  14  -1.883   9.825 -15.767

  No H/Q in entry =           6
  In of MODEL   27
    1    H    SER  15           H        SER  15   2.142   5.964 -13.415
    2    HA   SER  15           HA       SER  15   1.829   7.334 -10.967
    3    HB2  SER  15           HB2      SER  15   2.394   5.252  -9.917
    4    HB3  SER  15           HB3      SER  15   1.562   4.827 -11.409
    5    HG   SER  15           HG       SER  15   3.380   4.112 -12.242

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLY  16           H        GLY  16   4.710   6.254 -12.727
    2    HA3  GLY  16           HA2      GLY  16   6.632   7.023 -10.798
    3    HA2  GLY  16           HA3      GLY  16   6.935   6.822 -12.522

  No H/Q in entry =           3
  In of MODEL   27
    1    H    GLN  17           H        GLN  17   5.233   8.768 -13.585
    2    HA   GLN  17           HA       GLN  17   6.795  11.120 -13.279
    3    HB2  GLN  17           HB2      GLN  17   4.044  10.678 -14.474
    4    HB3  GLN  17           HB3      GLN  17   4.902  12.217 -14.554
    5    HG2  GLN  17           HG2      GLN  17   6.043   9.600 -15.565
    6    HG3  GLN  17           HG3      GLN  17   5.218  10.774 -16.589
    7   HE21  GLN  17          HE21      GLN  17   6.347  12.742 -17.127
    8   HE22  GLN  17          HE22      GLN  17   7.976  12.989 -16.719

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ALA  18           H        ALA  18   3.702  10.082 -11.928
    2    HA   ALA  18           HA       ALA  18   2.961  12.466 -10.663
    3    HB1  ALA  18           HB1      ALA  18   1.849  10.002 -10.883
    4    HB2  ALA  18           HB2      ALA  18   1.292  11.219  -9.736
    5    HB3  ALA  18           HB3      ALA  18   2.392   9.944  -9.206

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ARG  19           H        ARG  19   4.855   9.718  -9.383
    2    HA   ARG  19           HA       ARG  19   5.381  10.881  -6.862
    3    HB2  ARG  19           HB2      ARG  19   5.812   8.481  -7.388
    4    HB3  ARG  19           HB3      ARG  19   7.164   8.976  -8.410
    5    HG2  ARG  19           HG2      ARG  19   8.277  10.025  -6.489
    6    HG3  ARG  19           HG3      ARG  19   6.904   9.628  -5.456
    7    HD2  ARG  19           HD2      ARG  19   8.678   8.006  -5.098
    8    HD3  ARG  19           HD3      ARG  19   7.310   7.213  -5.883
    9    HE   ARG  19           HE       ARG  19   9.007   8.043  -7.931
   10   HH21  ARG  19          HH11      ARG  19  10.578   6.649  -8.782
   11   HH22  ARG  19          HH12      ARG  19  11.133   5.306  -7.845
   12   HH11  ARG  19          HH21      ARG  19   9.096   6.015  -5.152
   13   HH12  ARG  19          HH22      ARG  19  10.291   4.947  -5.789

  No H/Q in entry =          13
  In of MODEL   27
    1    H    SER  20           H        SER  20   7.196  10.922  -9.912
    2    HA   SER  20           HA       SER  20   9.430  12.356  -9.090
    3    HB2  SER  20           HB2      SER  20   9.211  11.361 -11.338
    4    HB3  SER  20           HB3      SER  20   7.996  12.568 -11.747
    5    HG   SER  20           HG       SER  20  10.739  12.781 -11.550

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU  21           H        LEU  21   6.321  13.599 -10.286
    2    HA   LEU  21           HA       LEU  21   6.970  16.350 -10.064
    3    HB2  LEU  21           HB2      LEU  21   4.312  14.906  -9.980
    4    HB3  LEU  21           HB3      LEU  21   4.467  16.662  -9.990
    5    HG   LEU  21           HG       LEU  21   5.677  14.871 -12.116
    6   HD12  LEU  21          HD11      LEU  21   3.759  15.630 -13.528
    7   HD11  LEU  21          HD12      LEU  21   3.040  16.370 -12.096
    8   HD13  LEU  21          HD13      LEU  21   3.252  14.621 -12.171
    9   HD22  LEU  21          HD21      LEU  21   6.798  16.918 -12.295
   10   HD21  LEU  21          HD22      LEU  21   5.420  17.854 -11.723
   11   HD23  LEU  21          HD23      LEU  21   5.424  17.211 -13.356

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ALA  22           H        ALA  22   5.477  14.050  -7.814
    2    HA   ALA  22           HA       ALA  22   4.860  15.854  -5.748
    3    HB3  ALA  22           HB1      ALA  22   4.119  13.455  -5.909
    4    HB2  ALA  22           HB2      ALA  22   4.704  13.934  -4.315
    5    HB1  ALA  22           HB3      ALA  22   5.735  12.983  -5.386

  No H/Q in entry =           5
  In of MODEL   27
    1    H    TYR  23           H        TYR  23   7.811  13.854  -6.186
    2    HA   TYR  23           HA       TYR  23   9.186  14.887  -3.935
    3    HB2  TYR  23           HB2      TYR  23   9.991  12.885  -5.092
    4    HB3  TYR  23           HB3      TYR  23  10.294  13.825  -6.553
    5    HD1  TYR  23           HD1      TYR  23  11.257  13.521  -2.957
    6    HD2  TYR  23           HD2      TYR  23  12.326  14.995  -6.848
    7    HE1  TYR  23           HE1      TYR  23  13.512  14.120  -2.112
    8    HE2  TYR  23           HE2      TYR  23  14.578  15.595  -6.003
    9    HH   TYR  23           HH       TYR  23  15.683  14.598  -2.850

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ALA  24           H        ALA  24   8.992  15.989  -7.302
    2    HA   ALA  24           HA       ALA  24  10.868  18.092  -7.059
    3    HB2  ALA  24           HB1      ALA  24  10.424  18.149  -9.267
    4    HB3  ALA  24           HB2      ALA  24   8.862  18.884  -8.908
    5    HB1  ALA  24           HB3      ALA  24   9.004  17.132  -9.036

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA  25           H        ALA  25   7.392  17.875  -6.436
    2    HA   ALA  25           HA       ALA  25   6.886  20.589  -5.868
    3    HB1  ALA  25           HB1      ALA  25   5.244  18.574  -6.067
    4    HB2  ALA  25           HB2      ALA  25   4.864  19.860  -4.919
    5    HB3  ALA  25           HB3      ALA  25   5.569  18.347  -4.348

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU  26           H        LEU  26   7.981  17.922  -3.817
    2    HA   LEU  26           HA       LEU  26   8.073  19.356  -1.381
    3    HB2  LEU  26           HB2      LEU  26   8.193  16.940  -1.373
    4    HB3  LEU  26           HB3      LEU  26   9.662  16.962  -2.345
    5    HG   LEU  26           HG       LEU  26  10.867  18.094  -0.506
    6   HD12  LEU  26          HD11      LEU  26   9.642  18.091   1.754
    7   HD11  LEU  26          HD12      LEU  26   8.155  17.937   0.820
    8   HD13  LEU  26          HD13      LEU  26   9.185  19.354   0.610
    9   HD21  LEU  26          HD21      LEU  26   9.359  15.611   0.370
   10   HD23  LEU  26          HD22      LEU  26  10.869  16.190   1.065
   11   HD22  LEU  26          HD23      LEU  26  10.829  15.629  -0.604

  No H/Q in entry =          11
  In of MODEL   27
    1    H    LYS  27           H        LYS  27  10.494  18.806  -3.906
    2    HA   LYS  27           HA       LYS  27  12.666  20.071  -2.681
    3    HB2  LYS  27           HB2      LYS  27  12.781  18.723  -4.770
    4    HB3  LYS  27           HB3      LYS  27  12.001  20.046  -5.636
    5    HG2  LYS  27           HG2      LYS  27  13.851  21.552  -5.061
    6    HG3  LYS  27           HG3      LYS  27  14.625  20.269  -4.123
    7    HD2  LYS  27           HD2      LYS  27  14.782  18.881  -6.176
    8    HD3  LYS  27           HD3      LYS  27  14.052  20.190  -7.105
    9    HE2  LYS  27           HE2      LYS  27  15.924  21.677  -6.495
   10    HE3  LYS  27           HE3      LYS  27  16.658  20.372  -5.557
   11    HZ3  LYS  27           HZ1      LYS  27  17.646  20.480  -7.744
   12    HZ2  LYS  27           HZ2      LYS  27  16.120  20.345  -8.484
   13    HZ1  LYS  27           HZ3      LYS  27  16.758  19.042  -7.599

  No H/Q in entry =          13
  In of MODEL   27
    1    H    GLN  28           H        GLN  28  10.027  21.422  -4.629
    2    HA   GLN  28           HA       GLN  28  10.957  24.085  -4.786
    3    HB2  GLN  28           HB2      GLN  28   8.140  22.975  -4.677
    4    HB3  GLN  28           HB3      GLN  28   8.525  24.658  -5.038
    5    HG2  GLN  28           HG2      GLN  28   9.578  22.282  -6.601
    6    HG3  GLN  28           HG3      GLN  28   8.207  23.275  -7.096
    7   HE21  GLN  28          HE21      GLN  28   9.226  25.851  -6.350
    8   HE22  GLN  28          HE22      GLN  28  10.561  26.201  -7.339

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ALA  29           H        ALA  29   9.046  22.374  -2.346
    2    HA   ALA  29           HA       ALA  29   8.474  24.561  -0.666
    3    HB2  ALA  29           HB1      ALA  29   7.763  22.986   0.904
    4    HB1  ALA  29           HB2      ALA  29   8.997  21.815   0.439
    5    HB3  ALA  29           HB3      ALA  29   7.607  22.092  -0.608

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LYS  30           H        LYS  30  11.229  22.325  -0.735
    2    HA   LYS  30           HA       LYS  30  12.538  23.296   1.566
    3    HB2  LYS  30           HB2      LYS  30  13.647  22.020  -0.944
    4    HB3  LYS  30           HB3      LYS  30  14.626  22.392   0.476
    5    HG2  LYS  30           HG2      LYS  30  13.090  20.992   1.858
    6    HG3  LYS  30           HG3      LYS  30  12.208  20.559   0.389
    7    HD2  LYS  30           HD2      LYS  30  14.263  19.595  -0.572
    8    HD3  LYS  30           HD3      LYS  30  15.164  20.043   0.879
    9    HE2  LYS  30           HE2      LYS  30  13.676  18.596   2.236
   10    HE3  LYS  30           HE3      LYS  30  12.806  18.129   0.769
   11    HZ2  LYS  30           HZ1      LYS  30  14.616  16.572   1.530
   12    HZ1  LYS  30           HZ2      LYS  30  15.739  17.771   1.077
   13    HZ3  LYS  30           HZ3      LYS  30  14.711  17.074  -0.087

  No H/Q in entry =          13
  In of MODEL   27
    1    H    GLN  31           H        GLN  31  12.412  24.496  -1.732
    2    HA   GLN  31           HA       GLN  31  14.544  26.414  -1.314
    3    HB2  GLN  31           HB2      GLN  31  12.499  26.435  -3.537
    4    HB3  GLN  31           HB3      GLN  31  14.111  27.149  -3.540
    5    HG2  GLN  31           HG2      GLN  31  14.604  24.460  -2.962
    6    HG3  GLN  31           HG3      GLN  31  13.300  24.389  -4.140
    7   HE21  GLN  31          HE21      GLN  31  16.152  23.628  -4.545
    8   HE22  GLN  31          HE22      GLN  31  16.712  24.607  -5.813

  No H/Q in entry =           8
  In of MODEL   27
    1    H    GLY  32           H        GLY  32  11.473  26.198  -0.166
    2    HA3  GLY  32           HA2      GLY  32  10.299  27.754   1.106
    3    HA2  GLY  32           HA3      GLY  32  11.410  29.002   0.554

  No H/Q in entry =           3
  In of MODEL   27
    1    H    ASP  33           H        ASP  33  10.066  27.080  -1.935
    2    HA   ASP  33           HA       ASP  33   8.375  29.332  -2.792
    3    HB2  ASP  33           HB2      ASP  33   9.495  26.924  -4.233
    4    HB3  ASP  33           HB3      ASP  33   8.330  28.026  -4.963

  No H/Q in entry =           4
  In of MODEL   27
    1    H    PHE  34           H        PHE  34   6.693  28.839  -1.226
    2    HA   PHE  34           HA       PHE  34   5.342  26.351  -1.127
    3    HB2  PHE  34           HB2      PHE  34   4.350  29.128  -0.449
    4    HB3  PHE  34           HB3      PHE  34   3.518  27.628  -0.036
    5    HD1  PHE  34           HD1      PHE  34   5.741  30.053   1.174
    6    HD2  PHE  34           HD2      PHE  34   5.110  25.805   1.125
    7    HE1  PHE  34           HE1      PHE  34   7.137  29.821   3.210
    8    HE2  PHE  34           HE2      PHE  34   6.507  25.576   3.159
    9    HZ   PHE  34           HZ       PHE  34   7.515  27.585   4.201

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ALA  35           H        ALA  35   4.877  29.208  -3.141
    2    HA   ALA  35           HA       ALA  35   2.332  28.563  -4.163
    3    HB3  ALA  35           HB1      ALA  35   3.367  29.965  -6.203
    4    HB2  ALA  35           HB2      ALA  35   4.581  30.342  -4.980
    5    HB1  ALA  35           HB3      ALA  35   2.886  30.732  -4.689

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA  36           H        ALA  36   5.568  27.926  -5.519
    2    HA   ALA  36           HA       ALA  36   4.594  26.483  -7.761
    3    HB3  ALA  36           HB1      ALA  36   6.751  26.632  -8.378
    4    HB2  ALA  36           HB2      ALA  36   7.245  25.610  -7.027
    5    HB1  ALA  36           HB3      ALA  36   7.119  27.357  -6.813

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA  37           H        ALA  37   5.564  25.503  -4.506
    2    HA   ALA  37           HA       ALA  37   5.537  22.714  -4.932
    3    HB2  ALA  37           HB1      ALA  37   5.257  24.504  -2.555
    4    HB1  ALA  37           HB2      ALA  37   6.405  23.199  -2.847
    5    HB3  ALA  37           HB3      ALA  37   4.748  22.827  -2.374

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LYS  38           H        LYS  38   2.979  24.894  -3.764
    2    HA   LYS  38           HA       LYS  38   0.902  23.056  -3.538
    3    HB2  LYS  38           HB2      LYS  38   1.221  25.816  -3.290
    4    HB3  LYS  38           HB3      LYS  38   0.023  25.654  -4.568
    5    HG2  LYS  38           HG2      LYS  38  -1.410  24.315  -3.123
    6    HG3  LYS  38           HG3      LYS  38  -0.165  24.271  -1.867
    7    HD2  LYS  38           HD2      LYS  38  -0.377  26.606  -1.422
    8    HD3  LYS  38           HD3      LYS  38  -1.294  26.882  -2.904
    9    HE2  LYS  38           HE2      LYS  38  -2.796  26.901  -0.963
   10    HE3  LYS  38           HE3      LYS  38  -3.155  25.520  -2.004
   11    HZ3  LYS  38           HZ1      LYS  38  -2.411  24.059  -0.470
   12    HZ2  LYS  38           HZ2      LYS  38  -2.775  25.313   0.619
   13    HZ1  LYS  38           HZ3      LYS  38  -1.178  25.080   0.092

  No H/Q in entry =          13
  In of MODEL   27
    1    H    ALA  39           H        ALA  39   1.857  24.967  -6.389
    2    HA   ALA  39           HA       ALA  39  -0.210  24.074  -8.090
    3    HB2  ALA  39           HB1      ALA  39   2.518  24.753  -9.146
    4    HB1  ALA  39           HB2      ALA  39   1.537  26.004  -8.382
    5    HB3  ALA  39           HB3      ALA  39   0.933  25.158  -9.807

  No H/Q in entry =           5
  In of MODEL   27
    1    H    MET  40           H        MET  40   3.043  22.814  -7.512
    2    HA   MET  40           HA       MET  40   2.968  20.791  -9.501
    3    HB2  MET  40           HB2      MET  40   4.579  21.036  -6.954
    4    HB3  MET  40           HB3      MET  40   4.843  19.782  -8.167
    5    HG2  MET  40           HG2      MET  40   4.865  22.738  -8.836
    6    HG3  MET  40           HG3      MET  40   6.322  21.852  -8.387
    7    HE3  MET  40           HE1      MET  40   7.219  19.645 -11.194
    8    HE2  MET  40           HE2      MET  40   6.660  19.320  -9.555
    9    HE1  MET  40           HE3      MET  40   7.739  20.680  -9.857

  No H/Q in entry =           9
  In of MODEL   27
    1    H    MET  41           H        MET  41   2.055  20.825  -6.076
    2    HA   MET  41           HA       MET  41   1.556  18.055  -5.796
    3    HB2  MET  41           HB2      MET  41   0.196  20.398  -4.446
    4    HB3  MET  41           HB3      MET  41   0.061  18.719  -3.936
    5    HG2  MET  41           HG2      MET  41   2.768  18.974  -3.976
    6    HG3  MET  41           HG3      MET  41   2.308  20.627  -3.581
    7    HE2  MET  41           HE1      MET  41  -0.715  19.340  -1.852
    8    HE1  MET  41           HE2      MET  41   0.083  20.862  -2.231
    9    HE3  MET  41           HE3      MET  41   0.032  20.293  -0.563

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ASP  42           H        ASP  42  -0.516  20.754  -6.771
    2    HA   ASP  42           HA       ASP  42  -2.940  19.364  -6.904
    3    HB2  ASP  42           HB2      ASP  42  -2.265  21.942  -7.164
    4    HB3  ASP  42           HB3      ASP  42  -2.412  21.544  -8.872

  No H/Q in entry =           4
  In of MODEL   27
    1    H    GLN  43           H        GLN  43  -0.509  19.982  -9.409
    2    HA   GLN  43           HA       GLN  43  -1.881  18.644 -11.495
    3    HB2  GLN  43           HB2      GLN  43   1.071  19.196 -11.116
    4    HB3  GLN  43           HB3      GLN  43   0.364  18.546 -12.598
    5    HG2  GLN  43           HG2      GLN  43  -1.172  20.555 -12.640
    6    HG3  GLN  43           HG3      GLN  43  -0.226  21.224 -11.313
    7   HE21  GLN  43          HE21      GLN  43  -0.086  22.844 -13.401
    8   HE22  GLN  43          HE22      GLN  43   1.330  22.639 -14.309

  No H/Q in entry =           8
  In of MODEL   27
    1    H    SER  44           H        SER  44   0.485  17.535  -9.105
    2    HA   SER  44           HA       SER  44   0.851  14.931 -10.128
    3    HB2  SER  44           HB2      SER  44   1.730  16.383  -7.894
    4    HB3  SER  44           HB3      SER  44   0.885  14.990  -7.221
    5    HG   SER  44           HG       SER  44   3.003  14.396  -7.649

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ARG  45           H        ARG  45  -1.483  16.223  -7.790
    2    HA   ARG  45           HA       ARG  45  -2.839  13.846  -7.152
    3    HB2  ARG  45           HB2      ARG  45  -3.064  16.012  -5.962
    4    HB3  ARG  45           HB3      ARG  45  -3.929  16.667  -7.349
    5    HG2  ARG  45           HG2      ARG  45  -5.673  14.920  -7.063
    6    HG3  ARG  45           HG3      ARG  45  -4.820  14.320  -5.640
    7    HD2  ARG  45           HD2      ARG  45  -5.055  16.585  -4.586
    8    HD3  ARG  45           HD3      ARG  45  -6.049  17.091  -5.968
    9    HE   ARG  45           HE       ARG  45  -7.128  14.702  -4.925
   10   HH21  ARG  45          HH11      ARG  45  -8.964  14.755  -3.653
   11   HH22  ARG  45          HH12      ARG  45  -9.377  16.191  -2.785
   12   HH11  ARG  45          HH21      ARG  45  -6.623  17.956  -3.904
   13   HH12  ARG  45          HH22      ARG  45  -8.046  18.003  -2.925

  No H/Q in entry =          13
  In of MODEL   27
    1    H    MET  46           H        MET  46  -3.456  16.240  -9.704
    2    HA   MET  46           HA       MET  46  -5.781  15.037 -10.763
    3    HB2  MET  46           HB2      MET  46  -3.702  16.886 -11.946
    4    HB3  MET  46           HB3      MET  46  -5.086  16.315 -12.886
    5    HG2  MET  46           HG2      MET  46  -6.621  17.218 -11.186
    6    HG3  MET  46           HG3      MET  46  -5.253  17.774 -10.231
    7    HE1  MET  46           HE1      MET  46  -6.993  19.619 -10.346
    8    HE3  MET  46           HE2      MET  46  -6.955  20.937 -11.511
    9    HE2  MET  46           HE3      MET  46  -5.601  20.709 -10.406

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ALA  47           H        ALA  47  -2.346  14.601 -11.523
    2    HA   ALA  47           HA       ALA  47  -2.671  12.867 -13.731
    3    HB3  ALA  47           HB1      ALA  47  -0.505  13.785 -13.382
    4    HB2  ALA  47           HB2      ALA  47  -0.341  12.059 -13.047
    5    HB1  ALA  47           HB3      ALA  47  -0.448  13.211 -11.714

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU  48           H        LEU  48  -2.391  12.238 -10.257
    2    HA   LEU  48           HA       LEU  48  -2.448   9.397 -10.413
    3    HB2  LEU  48           HB2      LEU  48  -3.236  11.307  -8.200
    4    HB3  LEU  48           HB3      LEU  48  -3.119   9.558  -7.998
    5    HG   LEU  48           HG       LEU  48  -0.843  11.287  -8.998
    6   HD13  LEU  48          HD11      LEU  48  -1.134  12.055  -6.808
    7   HD12  LEU  48          HD12      LEU  48   0.046  10.763  -6.609
    8   HD11  LEU  48          HD13      LEU  48  -1.648  10.479  -6.210
    9   HD22  LEU  48          HD21      LEU  48  -0.316   9.107  -9.637
   10   HD21  LEU  48          HD22      LEU  48  -1.175   8.382  -8.280
   11   HD23  LEU  48          HD23      LEU  48   0.388   9.156  -8.022

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ASN  49           H        ASN  49  -4.943  11.857 -10.012
    2    HA   ASN  49           HA       ASN  49  -7.107  10.165  -9.470
    3    HB2  ASN  49           HB2      ASN  49  -7.214  12.576  -9.140
    4    HB3  ASN  49           HB3      ASN  49  -7.022  12.854 -10.867
    5   HD21  ASN  49          HD21      ASN  49  -9.290  11.940  -8.361
    6   HD22  ASN  49          HD22      ASN  49 -10.666  11.911  -9.351

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLU  50           H        GLU  50  -5.845  11.375 -12.559
    2    HA   GLU  50           HA       GLU  50  -7.783  10.093 -14.203
    3    HB2  GLU  50           HB2      GLU  50  -6.342  11.930 -15.019
    4    HB3  GLU  50           HB3      GLU  50  -4.934  10.876 -14.881
    5    HG2  GLU  50           HG2      GLU  50  -5.888   9.326 -16.515
    6    HG3  GLU  50           HG3      GLU  50  -7.361  10.285 -16.603

  No H/Q in entry =           6
  In of MODEL   27
    1    H    ALA  51           H        ALA  51  -4.599   9.143 -12.997
    2    HA   ALA  51           HA       ALA  51  -4.428   6.691 -14.413
    3    HB2  ALA  51           HB1      ALA  51  -2.443   6.430 -13.314
    4    HB1  ALA  51           HB2      ALA  51  -3.136   6.845 -11.746
    5    HB3  ALA  51           HB3      ALA  51  -2.698   8.121 -12.882

  No H/Q in entry =           5
  In of MODEL   27
    1    H    HIS  52           H        HIS  52  -5.611   7.511 -11.164
    2    HA   HIS  52           HA       HIS  52  -6.262   4.893 -10.330
    3    HB2  HIS  52           HB2      HIS  52  -6.147   6.856  -8.821
    4    HB3  HIS  52           HB3      HIS  52  -7.613   7.491  -9.568
    5    HD1  HIS  52           HD1      HIS  52  -9.805   5.957  -9.313
    6    HD2  HIS  52           HD2      HIS  52  -6.600   4.933  -6.854
    7    HE1  HIS  52           HE1      HIS  52 -10.742   4.450  -7.506
    8    HE2  HIS  52           HE2      HIS  52  -8.800   3.816  -5.998

  No H/Q in entry =           8
  In of MODEL   27
    1    H    LEU  53           H        LEU  53  -8.114   7.325 -12.120
    2    HA   LEU  53           HA       LEU  53 -10.603   6.001 -12.130
    3    HB2  LEU  53           HB2      LEU  53  -9.345   7.997 -13.999
    4    HB3  LEU  53           HB3      LEU  53 -10.934   7.310 -14.324
    5    HG   LEU  53           HG       LEU  53 -10.251   8.623 -11.676
    6   HD11  LEU  53          HD11      LEU  53 -11.354   9.830 -14.223
    7   HD13  LEU  53          HD12      LEU  53  -9.943  10.353 -13.302
    8   HD12  LEU  53          HD13      LEU  53 -11.561  10.582 -12.646
    9   HD23  LEU  53          HD21      LEU  53 -12.838   9.005 -11.850
   10   HD22  LEU  53          HD22      LEU  53 -12.246   7.412 -11.393
   11   HD21  LEU  53          HD23      LEU  53 -12.793   7.704 -13.033

  No H/Q in entry =          11
  In of MODEL   27
    1    H    VAL  54           H        VAL  54  -7.851   5.837 -14.368
    2    HA   VAL  54           HA       VAL  54  -9.051   4.049 -16.209
    3    HB   VAL  54           HB       VAL  54  -6.150   4.592 -15.528
    4   HG12  VAL  54          HG11      VAL  54  -5.890   3.508 -17.916
    5   HG11  VAL  54          HG12      VAL  54  -7.408   2.708 -17.511
    6   HG13  VAL  54          HG13      VAL  54  -5.990   2.473 -16.492
    7   HG22  VAL  54          HG21      VAL  54  -6.944   6.524 -16.574
    8   HG21  VAL  54          HG22      VAL  54  -8.127   5.645 -17.541
    9   HG23  VAL  54          HG23      VAL  54  -6.420   5.586 -17.972

  No H/Q in entry =           9
  In of MODEL   27
    1    H    GLN  55           H        GLN  55  -7.045   3.530 -13.309
    2    HA   GLN  55           HA       GLN  55  -6.920   0.715 -13.563
    3    HB2  GLN  55           HB2      GLN  55  -5.376   1.631 -12.045
    4    HB3  GLN  55           HB3      GLN  55  -6.604   2.583 -11.216
    5    HG2  GLN  55           HG2      GLN  55  -7.271   0.819  -9.896
    6    HG3  GLN  55           HG3      GLN  55  -7.031  -0.366 -11.173
    7   HE21  GLN  55          HE21      GLN  55  -5.390  -1.796 -10.678
    8   HE22  GLN  55          HE22      GLN  55  -4.010  -1.426  -9.767

  No H/Q in entry =           8
  In of MODEL   27
    1    H    THR  56           H        THR  56  -9.278   2.850 -11.950
    2    HA   THR  56           HA       THR  56 -10.839   0.949 -10.658
    3    HB   THR  56           HB       THR  56 -11.968   3.319 -12.168
    4    HG1  THR  56           HG1      THR  56 -10.607   3.143  -9.696
    5   HG22  THR  56          HG21      THR  56 -12.854   2.318  -9.484
    6   HG21  THR  56          HG22      THR  56 -13.390   1.478 -10.940
    7   HG23  THR  56          HG23      THR  56 -13.777   3.185 -10.709

  No H/Q in entry =           7
  In of MODEL   27
    1    H    LYS  57           H        LYS  57 -11.054   2.026 -14.045
    2    HA   LYS  57           HA       LYS  57 -13.190   0.312 -14.797
    3    HB2  LYS  57           HB2      LYS  57 -12.335   2.273 -16.115
    4    HB3  LYS  57           HB3      LYS  57 -10.887   1.347 -16.484
    5    HG2  LYS  57           HG2      LYS  57 -12.233  -0.346 -17.638
    6    HG3  LYS  57           HG3      LYS  57 -13.708   0.526 -17.236
    7    HD2  LYS  57           HD2      LYS  57 -12.918   2.468 -18.549
    8    HD3  LYS  57           HD3      LYS  57 -11.446   1.590 -18.962
    9    HE2  LYS  57           HE2      LYS  57 -13.058   1.405 -20.805
   10    HE3  LYS  57           HE3      LYS  57 -12.844  -0.178 -20.060
   11    HZ2  LYS  57           HZ1      LYS  57 -15.213   0.981 -20.493
   12    HZ1  LYS  57           HZ2      LYS  57 -14.921   1.453 -18.886
   13    HZ3  LYS  57           HZ3      LYS  57 -14.933  -0.195 -19.304

  No H/Q in entry =          13
  In of MODEL   27
    1    H    LEU  58           H        LEU  58  -9.681  -0.077 -14.740
    2    HA   LEU  58           HA       LEU  58  -9.658  -2.595 -16.025
    3    HB2  LEU  58           HB2      LEU  58  -7.640  -1.277 -14.219
    4    HB3  LEU  58           HB3      LEU  58  -7.360  -2.796 -15.071
    5    HG   LEU  58           HG       LEU  58  -8.146  -0.203 -16.438
    6   HD11  LEU  58          HD11      LEU  58  -5.484  -1.407 -15.745
    7   HD13  LEU  58          HD12      LEU  58  -6.000   0.278 -15.698
    8   HD12  LEU  58          HD13      LEU  58  -5.651  -0.491 -17.243
    9   HD22  LEU  58          HD21      LEU  58  -8.702  -1.774 -18.026
   10   HD21  LEU  58          HD22      LEU  58  -7.646  -3.008 -17.343
   11   HD23  LEU  58          HD23      LEU  58  -6.971  -1.727 -18.350

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  59           H        ILE  59 -10.491  -1.699 -12.775
    2    HA   ILE  59           HA       ILE  59 -10.106  -4.460 -11.824
    3    HB   ILE  59           HB       ILE  59  -9.687  -2.189 -10.427
    4   HG12  ILE  59          HG12      ILE  59 -11.042  -4.536  -9.087
    5   HG13  ILE  59          HG13      ILE  59  -9.407  -4.627  -9.691
    6   HG23  ILE  59          HG21      ILE  59 -11.523  -1.490  -9.140
    7   HG22  ILE  59          HG22      ILE  59 -12.438  -2.944  -9.462
    8   HG21  ILE  59          HG23      ILE  59 -12.248  -1.720 -10.714
    9   HD12  ILE  59          HD11      ILE  59 -10.444  -2.695  -7.631
   10   HD11  ILE  59          HD12      ILE  59  -8.824  -2.623  -8.311
   11   HD13  ILE  59          HD13      ILE  59  -9.315  -4.015  -7.345

  No H/Q in entry =          11
  In of MODEL   27
    1    H    GLU  60           H        GLU  60 -12.692  -2.177 -12.636
    2    HA   GLU  60           HA       GLU  60 -14.858  -3.719 -11.621
    3    HB2  GLU  60           HB2      GLU  60 -15.119  -1.359 -12.210
    4    HB3  GLU  60           HB3      GLU  60 -14.759  -1.717 -13.896
    5    HG2  GLU  60           HG2      GLU  60 -16.766  -3.186 -13.989
    6    HG3  GLU  60           HG3      GLU  60 -17.144  -2.742 -12.337

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLY  61           H        GLY  61 -13.184  -3.688 -14.736
    2    HA3  GLY  61           HA2      GLY  61 -14.869  -5.955 -15.623
    3    HA2  GLY  61           HA3      GLY  61 -14.038  -4.841 -16.702

  No H/Q in entry =           3
  In of MODEL   27
    1    H    ASP  62           H        ASP  62 -12.649  -6.271 -13.816
    2    HA   ASP  62           HA       ASP  62 -10.309  -7.112 -15.166
    3    HB2  ASP  62           HB2      ASP  62 -10.484  -6.505 -12.744
    4    HB3  ASP  62           HB3      ASP  62 -11.349  -8.012 -12.470

  No H/Q in entry =           4
  In of MODEL   27
    1    H    ALA  63           H        ALA  63 -11.551  -8.364 -16.939
    2    HA   ALA  63           HA       ALA  63 -12.768 -10.884 -16.397
    3    HB1  ALA  63           HB1      ALA  63 -12.974  -9.650 -18.555
    4    HB2  ALA  63           HB2      ALA  63 -12.410 -11.303 -18.800
    5    HB3  ALA  63           HB3      ALA  63 -11.268  -9.960 -18.875

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLY  64           H        GLY  64  -9.462  -9.883 -17.065
    2    HA3  GLY  64           HA2      GLY  64  -7.448 -10.903 -16.611
    3    HA2  GLY  64           HA3      GLY  64  -8.326 -12.158 -15.748

  No H/Q in entry =           3
  In of MODEL   27
    1    H    GLU  65           H        GLU  65  -6.770 -13.642 -16.761
    2    HA   GLU  65           HA       GLU  65  -6.580 -13.960 -19.552
    3    HB2  GLU  65           HB2      GLU  65  -6.092 -15.943 -17.328
    4    HB3  GLU  65           HB3      GLU  65  -5.658 -16.210 -19.017
    5    HG2  GLU  65           HG2      GLU  65  -4.697 -13.868 -17.348
    6    HG3  GLU  65           HG3      GLU  65  -3.757 -15.327 -17.658

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLY  66           H        GLY  66  -8.707 -15.386 -17.198
    2    HA3  GLY  66           HA2      GLY  66 -10.360 -16.546 -19.344
    3    HA2  GLY  66           HA3      GLY  66 -10.051 -17.408 -17.849

  No H/Q in entry =           3
  In of MODEL   27
    1    H    LYS  67           H        LYS  67 -12.358 -17.542 -17.697
    2    HA   LYS  67           HA       LYS  67 -14.086 -15.350 -17.546
    3    HB2  LYS  67           HB2      LYS  67 -14.409 -18.062 -16.260
    4    HB3  LYS  67           HB3      LYS  67 -15.702 -16.919 -16.647
    5    HG2  LYS  67           HG2      LYS  67 -13.780 -18.068 -18.692
    6    HG3  LYS  67           HG3      LYS  67 -15.398 -18.701 -18.393
    7    HD2  LYS  67           HD2      LYS  67 -16.208 -16.281 -18.839
    8    HD3  LYS  67           HD3      LYS  67 -14.611 -16.029 -19.549
    9    HE2  LYS  67           HE2      LYS  67 -14.981 -17.943 -21.067
   10    HE3  LYS  67           HE3      LYS  67 -16.580 -18.191 -20.363
   11    HZ1  LYS  67           HZ1      LYS  67 -17.133 -15.899 -21.051
   12    HZ3  LYS  67           HZ2      LYS  67 -16.801 -16.929 -22.361
   13    HZ2  LYS  67           HZ3      LYS  67 -15.641 -15.800 -21.850

  No H/Q in entry =          13
  In of MODEL   27
    1    H    MET  68           H        MET  68 -13.588 -17.412 -14.768
    2    HA   MET  68           HA       MET  68 -14.264 -15.468 -12.843
    3    HB2  MET  68           HB2      MET  68 -12.823 -18.106 -12.554
    4    HB3  MET  68           HB3      MET  68 -13.482 -17.162 -11.217
    5    HG2  MET  68           HG2      MET  68 -15.090 -18.227 -13.557
    6    HG3  MET  68           HG3      MET  68 -15.052 -18.937 -11.942
    7    HE1  MET  68           HE1      MET  68 -15.555 -17.961  -9.951
    8    HE3  MET  68           HE2      MET  68 -16.823 -16.778  -9.639
    9    HE2  MET  68           HE3      MET  68 -15.170 -16.234  -9.916

  No H/Q in entry =           9
  In of MODEL   27
    1    H    LYS  69           H        LYS  69 -11.051 -16.600 -13.932
    2    HA   LYS  69           HA       LYS  69  -9.507 -15.477 -11.925
    3    HB2  LYS  69           HB2      LYS  69  -8.891 -16.004 -14.828
    4    HB3  LYS  69           HB3      LYS  69  -7.665 -15.478 -13.673
    5    HG2  LYS  69           HG2      LYS  69  -8.200 -17.414 -12.227
    6    HG3  LYS  69           HG3      LYS  69  -9.410 -17.944 -13.393
    7    HD2  LYS  69           HD2      LYS  69  -7.686 -18.249 -15.097
    8    HD3  LYS  69           HD3      LYS  69  -6.456 -17.625 -13.996
    9    HE2  LYS  69           HE2      LYS  69  -6.403 -20.077 -13.999
   10    HE3  LYS  69           HE3      LYS  69  -6.943 -19.488 -12.427
   11    HZ3  LYS  69           HZ1      LYS  69  -8.996 -20.309 -12.726
   12    HZ2  LYS  69           HZ2      LYS  69  -8.234 -21.337 -13.842
   13    HZ1  LYS  69           HZ3      LYS  69  -9.037 -19.939 -14.380

  No H/Q in entry =          13
  In of MODEL   27
    1    H    VAL  70           H        VAL  70  -7.662 -13.768 -12.523
    2    HA   VAL  70           HA       VAL  70  -8.929 -11.294 -13.543
    3    HB   VAL  70           HB       VAL  70  -7.773 -10.093 -11.667
    4   HG12  VAL  70          HG11      VAL  70  -9.404 -10.985  -9.892
    5   HG11  VAL  70          HG12      VAL  70  -9.896 -12.169 -11.104
    6   HG13  VAL  70          HG13      VAL  70 -10.117 -10.447 -11.414
    7   HG22  VAL  70          HG21      VAL  70  -6.707 -11.240  -9.914
    8   HG21  VAL  70          HG22      VAL  70  -6.239 -12.209 -11.310
    9   HG23  VAL  70          HG23      VAL  70  -7.548 -12.751 -10.261

  No H/Q in entry =           9
  In of MODEL   27
    1    H    SER  71           H        SER  71  -7.405  -9.685 -14.233
    2    HA   SER  71           HA       SER  71  -5.180 -10.722 -15.696
    3    HB2  SER  71           HB2      SER  71  -6.503  -8.718 -16.396
    4    HB3  SER  71           HB3      SER  71  -5.832  -7.841 -15.024
    5    HG   SER  71           HG       SER  71  -4.704  -8.497 -17.429

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU  72           H        LEU  72  -3.136 -10.997 -15.056
    2    HA   LEU  72           HA       LEU  72  -2.420 -10.769 -12.345
    3    HB2  LEU  72           HB2      LEU  72  -0.763 -11.186 -14.829
    4    HB3  LEU  72           HB3      LEU  72  -0.096 -11.240 -13.200
    5    HG   LEU  72           HG       LEU  72  -2.429 -12.968 -14.087
    6   HD13  LEU  72          HD11      LEU  72  -0.496 -13.565 -15.441
    7   HD12  LEU  72          HD12      LEU  72  -0.718 -14.797 -14.199
    8   HD11  LEU  72          HD13      LEU  72   0.542 -13.576 -14.014
    9   HD22  LEU  72          HD21      LEU  72  -2.418 -12.957 -11.734
   10   HD21  LEU  72          HD22      LEU  72  -0.669 -12.830 -11.633
   11   HD23  LEU  72          HD23      LEU  72  -1.413 -14.355 -12.105

  No H/Q in entry =          11
  In of MODEL   27
    1    H    VAL  73           H        VAL  73  -1.726  -8.749 -15.129
    2    HA   VAL  73           HA       VAL  73   0.175  -7.027 -14.028
    3    HB   VAL  73           HB       VAL  73  -0.237  -5.614 -15.886
    4   HG13  VAL  73          HG11      VAL  73  -0.025  -7.148 -17.673
    5   HG12  VAL  73          HG12      VAL  73  -1.082  -8.328 -16.899
    6   HG11  VAL  73          HG13      VAL  73   0.541  -8.051 -16.269
    7   HG22  VAL  73          HG21      VAL  73  -2.503  -5.116 -15.946
    8   HG21  VAL  73          HG22      VAL  73  -2.983  -6.794 -15.705
    9   HG23  VAL  73          HG23      VAL  73  -2.403  -6.260 -17.284

  No H/Q in entry =           9
  In of MODEL   27
    1    H    LEU  74           H        LEU  74  -3.221  -7.180 -13.471
    2    HA   LEU  74           HA       LEU  74  -3.870  -4.530 -12.864
    3    HB2  LEU  74           HB2      LEU  74  -5.580  -6.213 -13.035
    4    HB3  LEU  74           HB3      LEU  74  -4.879  -7.130 -11.704
    5    HG   LEU  74           HG       LEU  74  -5.323  -5.182 -10.192
    6   HD11  LEU  74          HD11      LEU  74  -6.524  -4.119 -12.750
    7   HD13  LEU  74          HD12      LEU  74  -5.415  -3.310 -11.644
    8   HD12  LEU  74          HD13      LEU  74  -7.096  -3.571 -11.174
    9   HD21  LEU  74          HD21      LEU  74  -6.904  -7.176 -10.769
   10   HD23  LEU  74          HD22      LEU  74  -7.847  -5.933 -11.561
   11   HD22  LEU  74          HD23      LEU  74  -7.530  -5.813  -9.847

  No H/Q in entry =          11
  In of MODEL   27
    1    H    VAL  75           H        VAL  75  -2.800  -7.101 -10.697
    2    HA   VAL  75           HA       VAL  75  -2.620  -5.543  -8.356
    3    HB   VAL  75           HB       VAL  75  -1.098  -8.024  -9.142
    4   HG13  VAL  75          HG11      VAL  75   0.163  -6.807  -7.417
    5   HG12  VAL  75          HG12      VAL  75  -0.668  -8.158  -6.661
    6   HG11  VAL  75          HG13      VAL  75  -1.312  -6.534  -6.495
    7   HG21  VAL  75          HG21      VAL  75  -3.579  -7.446  -7.494
    8   HG23  VAL  75          HG22      VAL  75  -2.746  -8.999  -7.468
    9   HG22  VAL  75          HG23      VAL  75  -3.479  -8.417  -8.963

  No H/Q in entry =           9
  In of MODEL   27
    1    H    GLU  76           H        GLU  76  -0.202  -6.281 -10.890
    2    HA   GLU  76           HA       GLU  76   1.968  -4.907  -9.734
    3    HB2  GLU  76           HB2      GLU  76   2.199  -6.380 -11.710
    4    HB3  GLU  76           HB3      GLU  76   1.260  -5.249 -12.671
    5    HG2  GLU  76           HG2      GLU  76   3.586  -4.866 -13.179
    6    HG3  GLU  76           HG3      GLU  76   3.044  -3.500 -12.221

  No H/Q in entry =           6
  In of MODEL   27
    1    H    ALA  77           H        ALA  77  -0.577  -3.738 -11.926
    2    HA   ALA  77           HA       ALA  77   0.383  -1.081 -12.107
    3    HB2  ALA  77           HB1      ALA  77  -2.114  -0.616 -12.649
    4    HB3  ALA  77           HB2      ALA  77  -2.306  -2.365 -12.540
    5    HB1  ALA  77           HB3      ALA  77  -1.206  -1.673 -13.731

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLN  78           H        GLN  78  -1.868  -2.659  -9.894
    2    HA   GLN  78           HA       GLN  78  -2.702  -0.347  -8.497
    3    HB2  GLN  78           HB2      GLN  78  -3.782  -2.625  -8.411
    4    HB3  GLN  78           HB3      GLN  78  -2.442  -3.159  -7.398
    5    HG2  GLN  78           HG2      GLN  78  -2.994  -1.422  -5.746
    6    HG3  GLN  78           HG3      GLN  78  -4.331  -0.877  -6.758
    7   HE21  GLN  78          HE21      GLN  78  -6.146  -1.532  -5.525
    8   HE22  GLN  78          HE22      GLN  78  -6.419  -3.133  -5.029

  No H/Q in entry =           8
  In of MODEL   27
    1    H    LEU  79           H        LEU  79   0.002  -2.570  -8.041
    2    HA   LEU  79           HA       LEU  79   0.966  -1.657  -5.585
    3    HB2  LEU  79           HB2      LEU  79   1.861  -3.658  -6.649
    4    HB3  LEU  79           HB3      LEU  79   2.496  -2.700  -7.984
    5    HG   LEU  79           HG       LEU  79   4.037  -1.540  -6.481
    6   HD13  LEU  79          HD11      LEU  79   3.029  -1.303  -4.415
    7   HD12  LEU  79          HD12      LEU  79   4.123  -2.639  -4.068
    8   HD11  LEU  79          HD13      LEU  79   2.422  -2.959  -4.398
    9   HD23  LEU  79          HD21      LEU  79   5.274  -3.671  -5.574
   10   HD22  LEU  79          HD22      LEU  79   5.069  -3.478  -7.312
   11   HD21  LEU  79          HD23      LEU  79   4.003  -4.559  -6.418

  No H/Q in entry =          11
  In of MODEL   27
    1    H    HIS  80           H        HIS  80   1.825  -0.536  -8.860
    2    HA   HIS  80           HA       HIS  80   3.607   1.476  -7.940
    3    HB2  HIS  80           HB2      HIS  80   2.328   0.760 -10.523
    4    HB3  HIS  80           HB3      HIS  80   2.901   2.420 -10.354
    5    HD1  HIS  80           HD1      HIS  80   5.299   2.750 -10.876
    6    HD2  HIS  80           HD2      HIS  80   4.529  -1.169  -9.678
    7    HE1  HIS  80           HE1      HIS  80   7.505   1.501 -11.038
    8    HE2  HIS  80           HE2      HIS  80   7.047  -0.891 -10.311

  No H/Q in entry =           8
  In of MODEL   27
    1    H    LEU  81           H        LEU  81   0.202   1.590  -8.922
    2    HA   LEU  81           HA       LEU  81  -0.110   4.380  -8.597
    3    HB2  LEU  81           HB2      LEU  81  -2.095   2.108  -8.515
    4    HB3  LEU  81           HB3      LEU  81  -2.570   3.805  -8.426
    5    HG   LEU  81           HG       LEU  81  -0.860   2.674 -10.659
    6   HD12  LEU  81          HD11      LEU  81  -3.095   2.962 -11.960
    7   HD11  LEU  81          HD12      LEU  81  -3.851   2.886 -10.369
    8   HD13  LEU  81          HD13      LEU  81  -2.890   1.530 -10.953
    9   HD23  LEU  81          HD21      LEU  81  -1.985   4.802 -11.761
   10   HD22  LEU  81          HD22      LEU  81  -0.571   4.993 -10.727
   11   HD21  LEU  81          HD23      LEU  81  -2.181   5.321 -10.089

  No H/Q in entry =          11
  In of MODEL   27
    1    H    MET  82           H        MET  82  -0.735   1.688  -6.344
    2    HA   MET  82           HA       MET  82  -1.810   3.264  -4.260
    3    HB2  MET  82           HB2      MET  82  -0.400   0.596  -4.294
    4    HB3  MET  82           HB3      MET  82  -0.989   1.315  -2.798
    5    HG2  MET  82           HG2      MET  82  -2.713   0.794  -5.239
    6    HG3  MET  82           HG3      MET  82  -2.622  -0.276  -3.842
    7    HE3  MET  82           HE1      MET  82  -4.369   1.355  -1.031
    8    HE2  MET  82           HE2      MET  82  -2.642   1.656  -1.215
    9    HE1  MET  82           HE3      MET  82  -3.309   0.088  -1.667

  No H/Q in entry =           9
  In of MODEL   27
    1    H    THR  83           H        THR  83   1.506   2.222  -4.945
    2    HA   THR  83           HA       THR  83   2.707   3.347  -2.646
    3    HB   THR  83           HB       THR  83   4.803   3.317  -4.118
    4    HG1  THR  83           HG1      THR  83   4.572   2.784  -6.141
    5   HG22  THR  83          HG21      THR  83   4.396   0.653  -4.446
    6   HG21  THR  83          HG22      THR  83   3.100   1.017  -3.307
    7   HG23  THR  83          HG23      THR  83   4.774   1.384  -2.887

  No H/Q in entry =           7
  In of MODEL   27
    1    H    SER  84           H        SER  84   2.321   4.615  -5.948
    2    HA   SER  84           HA       SER  84   3.626   7.074  -5.496
    3    HB2  SER  84           HB2      SER  84   1.569   6.210  -7.516
    4    HB3  SER  84           HB3      SER  84   2.225   7.847  -7.493
    5    HG   SER  84           HG       SER  84   3.632   5.390  -7.779

  No H/Q in entry =           5
  In of MODEL   27
    1    H    MET  85           H        MET  85   0.143   6.270  -5.326
    2    HA   MET  85           HA       MET  85  -0.754   8.870  -4.730
    3    HB2  MET  85           HB2      MET  85  -2.253   7.043  -5.397
    4    HB3  MET  85           HB3      MET  85  -1.952   6.238  -3.858
    5    HG2  MET  85           HG2      MET  85  -2.882   8.157  -2.643
    6    HG3  MET  85           HG3      MET  85  -3.129   9.015  -4.163
    7    HE1  MET  85           HE1      MET  85  -3.676   6.067  -2.076
    8    HE3  MET  85           HE2      MET  85  -4.045   4.976  -3.409
    9    HE2  MET  85           HE3      MET  85  -5.337   5.523  -2.344

  No H/Q in entry =           9
  In of MODEL   27
    1    H    LEU  86           H        LEU  86   0.199   6.224  -2.581
    2    HA   LEU  86           HA       LEU  86  -0.353   7.523  -0.142
    3    HB2  LEU  86           HB2      LEU  86   0.144   5.058  -0.531
    4    HB3  LEU  86           HB3      LEU  86   1.845   5.510  -0.626
    5    HG   LEU  86           HG       LEU  86   1.504   6.670   1.640
    6   HD11  LEU  86          HD11      LEU  86  -1.180   5.868   1.168
    7   HD13  LEU  86          HD12      LEU  86  -0.525   6.626   2.618
    8   HD12  LEU  86          HD13      LEU  86  -0.593   4.869   2.502
    9   HD23  LEU  86          HD21      LEU  86   1.114   3.672   1.767
   10   HD22  LEU  86          HD22      LEU  86   2.102   4.696   2.806
   11   HD21  LEU  86          HD23      LEU  86   2.608   4.375   1.148

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ALA  87           H        ALA  87   2.633   7.264  -2.029
    2    HA   ALA  87           HA       ALA  87   4.320   8.698  -0.304
    3    HB3  ALA  87           HB1      ALA  87   4.429   7.682  -3.010
    4    HB2  ALA  87           HB2      ALA  87   5.759   8.031  -1.909
    5    HB1  ALA  87           HB3      ALA  87   5.129   9.302  -2.955

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ARG  88           H        ARG  88   2.360   9.806  -3.028
    2    HA   ARG  88           HA       ARG  88   3.102  12.505  -2.914
    3    HB2  ARG  88           HB2      ARG  88   1.863  11.335  -4.770
    4    HB3  ARG  88           HB3      ARG  88   0.403  11.462  -3.788
    5    HG2  ARG  88           HG2      ARG  88   1.392  14.054  -3.708
    6    HG3  ARG  88           HG3      ARG  88   1.823  13.543  -5.338
    7    HD2  ARG  88           HD2      ARG  88  -0.318  13.597  -6.036
    8    HD3  ARG  88           HD3      ARG  88  -0.896  12.739  -4.608
    9    HE   ARG  88           HE       ARG  88  -1.118  15.514  -5.029
   10   HH21  ARG  88          HH11      ARG  88  -1.661  16.839  -3.293
   11   HH22  ARG  88          HH12      ARG  88  -1.360  16.308  -1.675
   12   HH11  ARG  88          HH21      ARG  88  -0.077  13.266  -2.651
   13   HH12  ARG  88          HH22      ARG  88  -0.480  14.279  -1.312

  No H/Q in entry =          13
  In of MODEL   27
    1    H    GLU  89           H        GLU  89   0.417  10.801  -1.273
    2    HA   GLU  89           HA       GLU  89  -0.717  13.102  -0.072
    3    HB2  GLU  89           HB2      GLU  89  -1.810  10.850  -0.156
    4    HB3  GLU  89           HB3      GLU  89  -0.680  10.309   1.086
    5    HG2  GLU  89           HG2      GLU  89  -1.520  12.000   2.643
    6    HG3  GLU  89           HG3      GLU  89  -2.579  12.658   1.398

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LEU  90           H        LEU  90   1.759  10.839   1.106
    2    HA   LEU  90           HA       LEU  90   2.100  12.090   3.635
    3    HB2  LEU  90           HB2      LEU  90   3.893  10.333   1.960
    4    HB3  LEU  90           HB3      LEU  90   4.306  10.856   3.598
    5    HG   LEU  90           HG       LEU  90   1.686   9.481   2.938
    6   HD12  LEU  90          HD11      LEU  90   2.848   7.449   3.949
    7   HD11  LEU  90          HD12      LEU  90   4.361   8.321   3.707
    8   HD13  LEU  90          HD13      LEU  90   3.354   7.901   2.320
    9   HD22  LEU  90          HD21      LEU  90   1.411  10.404   5.058
   10   HD21  LEU  90          HD22      LEU  90   3.130  10.316   5.441
   11   HD23  LEU  90          HD23      LEU  90   2.139   8.858   5.491

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  91           H        ILE  91   3.701  12.486   0.508
    2    HA   ILE  91           HA       ILE  91   5.658  14.339   1.346
    3    HB   ILE  91           HB       ILE  91   4.352  13.832  -1.334
    4   HG12  ILE  91          HG12      ILE  91   7.189  13.375  -0.358
    5   HG13  ILE  91          HG13      ILE  91   5.920  12.164  -0.195
    6   HG22  ILE  91          HG21      ILE  91   6.561  15.201  -2.023
    7   HG21  ILE  91          HG22      ILE  91   6.243  16.000  -0.483
    8   HG23  ILE  91          HG23      ILE  91   5.020  16.015  -1.752
    9   HD13  ILE  91          HD11      ILE  91   5.751  11.837  -2.502
   10   HD12  ILE  91          HD12      ILE  91   7.483  12.098  -2.288
   11   HD11  ILE  91          HD13      ILE  91   6.459  13.410  -2.876

  No H/Q in entry =          11
  In of MODEL   27
    1    H    THR  92           H        THR  92   2.292  14.736   0.336
    2    HA   THR  92           HA       THR  92   2.237  17.559   0.273
    3    HB   THR  92           HB       THR  92   0.090  15.543   0.973
    4    HG1  THR  92           HG1      THR  92   0.397  15.365  -1.111
    5   HG22  THR  92          HG21      THR  92  -1.333  17.690   0.249
    6   HG21  THR  92          HG22      THR  92   0.051  18.530   0.945
    7   HG23  THR  92          HG23      THR  92  -0.879  17.400   1.928

  No H/Q in entry =           7
  In of MODEL   27
    1    H    GLU  93           H        GLU  93   1.711  15.256   2.929
    2    HA   GLU  93           HA       GLU  93   1.159  17.156   4.945
    3    HB2  GLU  93           HB2      GLU  93   2.500  14.445   5.185
    4    HB3  GLU  93           HB3      GLU  93   1.799  15.367   6.516
    5    HG2  GLU  93           HG2      GLU  93   0.195  14.570   4.078
    6    HG3  GLU  93           HG3      GLU  93   0.307  13.550   5.507

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LEU  94           H        LEU  94   4.181  15.703   3.798
    2    HA   LEU  94           HA       LEU  94   5.919  16.870   5.685
    3    HB2  LEU  94           HB2      LEU  94   6.331  15.904   2.856
    4    HB3  LEU  94           HB3      LEU  94   7.654  16.576   3.805
    5    HG   LEU  94           HG       LEU  94   5.936  14.364   4.942
    6   HD11  LEU  94          HD11      LEU  94   8.034  14.156   2.811
    7   HD13  LEU  94          HD12      LEU  94   6.598  13.169   3.073
    8   HD12  LEU  94          HD13      LEU  94   8.026  12.931   4.081
    9   HD23  LEU  94          HD21      LEU  94   8.130  13.850   6.096
   10   HD22  LEU  94          HD22      LEU  94   7.448  15.422   6.510
   11   HD21  LEU  94          HD23      LEU  94   8.788  15.314   5.368

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  95           H        ILE  95   4.769  18.027   2.534
    2    HA   ILE  95           HA       ILE  95   6.318  20.400   2.473
    3    HB   ILE  95           HB       ILE  95   3.682  19.688   1.167
    4   HG12  ILE  95          HG12      ILE  95   6.467  20.052   0.031
    5   HG13  ILE  95          HG13      ILE  95   5.833  18.493   0.547
    6   HG21  ILE  95          HG21      ILE  95   5.407  22.173   0.945
    7   HG23  ILE  95          HG22      ILE  95   3.682  22.088   1.300
    8   HG22  ILE  95          HG23      ILE  95   4.270  21.692  -0.315
    9   HD13  ILE  95          HD11      ILE  95   4.275  18.400  -1.183
   10   HD12  ILE  95          HD12      ILE  95   5.616  19.231  -1.971
   11   HD11  ILE  95          HD13      ILE  95   4.234  20.152  -1.380

  No H/Q in entry =          11
  In of MODEL   27
    1    H    GLU  96           H        GLU  96   3.075  19.717   3.767
    2    HA   GLU  96           HA       GLU  96   2.429  22.359   4.515
    3    HB2  GLU  96           HB2      GLU  96   0.772  20.559   4.528
    4    HB3  GLU  96           HB3      GLU  96   1.641  19.742   5.825
    5    HG2  GLU  96           HG2      GLU  96   0.608  21.017   7.393
    6    HG3  GLU  96           HG3      GLU  96   1.129  22.495   6.594

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LEU  97           H        LEU  97   4.296  19.828   6.144
    2    HA   LEU  97           HA       LEU  97   4.639  21.182   8.613
    3    HB2  LEU  97           HB2      LEU  97   6.198  19.027   7.202
    4    HB3  LEU  97           HB3      LEU  97   6.781  19.719   8.714
    5    HG   LEU  97           HG       LEU  97   3.982  18.598   8.403
    6   HD12  LEU  97          HD11      LEU  97   4.940  16.596   9.618
    7   HD11  LEU  97          HD12      LEU  97   6.546  17.242   9.274
    8   HD13  LEU  97          HD13      LEU  97   5.481  16.772   7.948
    9   HD23  LEU  97          HD21      LEU  97   4.436  18.311  10.968
   10   HD22  LEU  97          HD22      LEU  97   4.041  19.918  10.361
   11   HD21  LEU  97          HD23      LEU  97   5.717  19.495  10.708

  No H/Q in entry =          11
  In of MODEL   27
    1    H    HIS  98           H        HIS  98   6.511  21.213   5.589
    2    HA   HIS  98           HA       HIS  98   8.649  22.813   6.487
    3    HB2  HIS  98           HB2      HIS  98   7.360  22.543   3.761
    4    HB3  HIS  98           HB3      HIS  98   8.790  23.535   4.051
    5    HD1  HIS  98           HD1      HIS  98   7.612  19.954   4.074
    6    HD2  HIS  98           HD2      HIS  98  11.174  22.084   4.498
    7    HE1  HIS  98           HE1      HIS  98   9.483  18.241   4.020
    8    HE2  HIS  98           HE2      HIS  98  11.656  19.518   4.278

  No H/Q in entry =           8
  In of MODEL   27
    1    H    GLU  99           H        GLU  99   5.421  23.617   5.310
    2    HA   GLU  99           HA       GLU  99   5.774  26.435   5.249
    3    HB2  GLU  99           HB2      GLU  99   3.907  25.248   4.118
    4    HB3  GLU  99           HB3      GLU  99   3.213  24.882   5.698
    5    HG2  GLU  99           HG2      GLU  99   3.011  27.272   6.196
    6    HG3  GLU  99           HG3      GLU  99   3.784  27.678   4.667

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LYS 100           H        LYS 100   4.663  24.193   7.772
    2    HA   LYS 100           HA       LYS 100   4.057  26.243   9.664
    3    HB2  LYS 100           HB2      LYS 100   4.659  23.298  10.013
    4    HB3  LYS 100           HB3      LYS 100   4.202  24.367  11.344
    5    HG2  LYS 100           HG2      LYS 100   2.131  24.985  10.095
    6    HG3  LYS 100           HG3      LYS 100   2.569  23.819   8.843
    7    HD2  LYS 100           HD2      LYS 100   2.506  21.999  10.507
    8    HD3  LYS 100           HD3      LYS 100   2.086  23.159  11.769
    9    HE2  LYS 100           HE2      LYS 100   0.028  23.761  10.504
   10    HE3  LYS 100           HE3      LYS 100   0.439  22.544   9.290
   11    HZ1  LYS 100           HZ1      LYS 100   0.178  21.878  12.171
   12    HZ3  LYS 100           HZ2      LYS 100   0.172  20.822  10.837
   13    HZ2  LYS 100           HZ3      LYS 100  -1.152  21.850  11.116

  No H/Q in entry =          13
  In of MODEL   27
    1    H    LEU 101           H        LEU 101   6.997  24.473   8.833
    2    HA   LEU 101           HA       LEU 101   8.587  25.329  11.037
    3    HB2  LEU 101           HB2      LEU 101   9.191  24.345   8.260
    4    HB3  LEU 101           HB3      LEU 101  10.487  25.022   9.241
    5    HG   LEU 101           HG       LEU 101   8.674  22.851  10.306
    6   HD12  LEU 101          HD11      LEU 101  10.741  21.373   9.700
    7   HD11  LEU 101          HD12      LEU 101  11.097  22.639   8.526
    8   HD13  LEU 101          HD13      LEU 101   9.576  21.752   8.433
    9   HD21  LEU 101          HD21      LEU 101  11.388  23.984  11.034
   10   HD23  LEU 101          HD22      LEU 101  10.858  22.407  11.615
   11   HD22  LEU 101          HD23      LEU 101   9.953  23.856  12.051

  No H/Q in entry =          11
  In of MODEL   27
    1    H    LYS 102           H        LYS 102   6.989  27.177   8.893
    2    HA   LYS 102           HA       LYS 102   7.047  29.470   8.599
    3    HB2  LYS 102           HB2      LYS 102   8.611  29.370  10.698
    4    HB3  LYS 102           HB3      LYS 102   9.910  29.574   9.539
    5    HG2  LYS 102           HG2      LYS 102   7.787  31.510  10.398
    6    HG3  LYS 102           HG3      LYS 102   9.498  31.784  10.147
    7    HD2  LYS 102           HD2      LYS 102   7.551  31.343   7.847
    8    HD3  LYS 102           HD3      LYS 102   7.920  32.926   8.514
    9    HE2  LYS 102           HE2      LYS 102   9.304  31.751   6.442
   10    HE3  LYS 102           HE3      LYS 102   9.909  33.064   7.453
   11    HZ2  LYS 102           HZ1      LYS 102  11.446  31.172   7.280
   12    HZ1  LYS 102           HZ2      LYS 102  10.292  30.181   8.023
   13    HZ3  LYS 102           HZ3      LYS 102  10.973  31.474   8.881

  No H/Q in entry =          13
  In of MODEL   27
    1    H    ALA 103           H        ALA 103  10.315  28.158   8.037
    2    HA   ALA 103           HA       ALA 103  11.268  29.540   5.961
    3    HB2  ALA 103           HB1      ALA 103  12.172  27.333   5.035
    4    HB1  ALA 103           HB2      ALA 103  11.283  26.552   6.342
    5    HB3  ALA 103           HB3      ALA 103  12.563  27.708   6.714

  No H/Q in entry =           5
  In of MODEL   27
    1    H1   LYS   3           H1       LYS   3 -31.184   6.395 -19.528
    2    H2   LYS   3           H3       LYS   3 -30.202   6.112 -20.883
    3    H3   LYS   3           H2       LYS   3 -31.600   5.181 -20.639
    4    HA   LYS   3           HA       LYS   3 -30.601   3.776 -19.249
    5    HB2  LYS   3           HB2      LYS   3 -28.316   5.185 -20.579
    6    HB3  LYS   3           HB3      LYS   3 -27.994   3.966 -19.345
    7    HG2  LYS   3           HG2      LYS   3 -29.429   2.398 -20.703
    8    HG3  LYS   3           HG3      LYS   3 -29.382   3.608 -21.984
    9    HD2  LYS   3           HD2      LYS   3 -26.900   3.480 -21.944
   10    HD3  LYS   3           HD3      LYS   3 -27.022   2.173 -20.766
   11    HE2  LYS   3           HE2      LYS   3 -28.533   1.019 -22.486
   12    HE3  LYS   3           HE3      LYS   3 -27.910   2.203 -23.636
   13    HZ3  LYS   3           HZ1      LYS   3 -26.120   0.965 -23.920
   14    HZ2  LYS   3           HZ2      LYS   3 -26.753  -0.207 -22.867
   15    HZ1  LYS   3           HZ3      LYS   3 -25.754   1.027 -22.263

  No H/Q in entry =          15
  In of MODEL   27
    1    H    LYS   4           H        LYS   4 -30.648   3.618 -17.189
    2    HA   LYS   4           HA       LYS   4 -29.898   5.888 -15.524
    3    HB2  LYS   4           HB2      LYS   4 -31.114   3.197 -14.841
    4    HB3  LYS   4           HB3      LYS   4 -30.880   4.526 -13.704
    5    HG2  LYS   4           HG2      LYS   4 -32.697   4.494 -16.120
    6    HG3  LYS   4           HG3      LYS   4 -33.181   4.535 -14.426
    7    HD2  LYS   4           HD2      LYS   4 -32.469   6.750 -14.146
    8    HD3  LYS   4           HD3      LYS   4 -31.435   6.696 -15.572
    9    HE2  LYS   4           HE2      LYS   4 -33.353   8.086 -16.018
   10    HE3  LYS   4           HE3      LYS   4 -33.446   6.622 -16.996
   11    HZ3  LYS   4           HZ1      LYS   4 -35.023   5.708 -15.451
   12    HZ2  LYS   4           HZ2      LYS   4 -35.569   7.213 -16.022
   13    HZ1  LYS   4           HZ3      LYS   4 -34.909   7.085 -14.463

  No H/Q in entry =          13
  In of MODEL   27
    1    H    HIS   5           H        HIS   5 -28.423   5.950 -13.936
    2    HA   HIS   5           HA       HIS   5 -26.156   4.107 -14.289
    3    HB2  HIS   5           HB2      HIS   5 -26.385   6.854 -13.062
    4    HB3  HIS   5           HB3      HIS   5 -24.911   5.888 -13.057
    5    HD1  HIS   5           HD1      HIS   5 -23.437   7.088 -14.643
    6    HD2  HIS   5           HD2      HIS   5 -27.248   6.510 -16.188
    7    HE1  HIS   5           HE1      HIS   5 -23.273   7.686 -17.089
    8    HE2  HIS   5           HE2      HIS   5 -25.597   7.321 -18.000

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ILE   6           H        ILE   6 -25.935   2.522 -12.986
    2    HA   ILE   6           HA       ILE   6 -26.898   2.777 -10.216
    3    HB   ILE   6           HB       ILE   6 -26.100   0.315 -11.775
    4   HG12  ILE   6          HG12      ILE   6 -28.832   1.269 -10.908
    5   HG13  ILE   6          HG13      ILE   6 -28.193   1.438 -12.542
    6   HG23  ILE   6          HG21      ILE   6 -26.477  -0.948  -9.924
    7   HG22  ILE   6          HG22      ILE   6 -27.622   0.203  -9.231
    8   HG21  ILE   6          HG23      ILE   6 -25.890   0.524  -9.145
    9   HD13  ILE   6          HD11      ILE   6 -28.673  -0.674 -13.057
   10   HD12  ILE   6          HD12      ILE   6 -29.683  -0.659 -11.611
   11   HD11  ILE   6          HD13      ILE   6 -28.035  -1.282 -11.530

  No H/Q in entry =          11
  In of MODEL   27
    1    H    TYR   7           H        TYR   7 -25.130   3.393  -8.931
    2    HA   TYR   7           HA       TYR   7 -22.430   2.417  -9.627
    3    HB2  TYR   7           HB2      TYR   7 -23.366   4.849  -8.125
    4    HB3  TYR   7           HB3      TYR   7 -21.687   4.320  -8.173
    5    HD1  TYR   7           HD1      TYR   7 -22.745   3.410 -11.267
    6    HD2  TYR   7           HD2      TYR   7 -22.036   6.959  -9.016
    7    HE1  TYR   7           HE1      TYR   7 -22.310   4.651 -13.350
    8    HE2  TYR   7           HE2      TYR   7 -21.642   8.206 -11.090
    9    HH   TYR   7           HH       TYR   7 -21.869   8.138 -13.323

  No H/Q in entry =           9
  In of MODEL   27
    1    H    LEU   8           H        LEU   8 -21.471   1.047  -8.311
    2    HA   LEU   8           HA       LEU   8 -22.596   0.543  -5.628
    3    HB2  LEU   8           HB2      LEU   8 -20.916  -1.122  -7.480
    4    HB3  LEU   8           HB3      LEU   8 -21.099  -1.516  -5.771
    5    HG   LEU   8           HG       LEU   8 -23.581  -1.662  -6.187
    6   HD13  LEU   8          HD11      LEU   8 -23.708  -0.430  -8.286
    7   HD12  LEU   8          HD12      LEU   8 -24.254  -2.087  -8.537
    8   HD11  LEU   8          HD13      LEU   8 -22.644  -1.600  -9.064
    9   HD23  LEU   8          HD21      LEU   8 -22.332  -3.702  -7.900
   10   HD22  LEU   8          HD22      LEU   8 -23.416  -3.871  -6.520
   11   HD21  LEU   8          HD23      LEU   8 -21.705  -3.535  -6.260

  No H/Q in entry =          11
  In of MODEL   27
    1    H    PHE   9           H        PHE   9 -21.311   0.915  -3.837
    2    HA   PHE   9           HA       PHE   9 -18.523   1.832  -4.366
    3    HB2  PHE   9           HB2      PHE   9 -20.525   2.896  -2.380
    4    HB3  PHE   9           HB3      PHE   9 -18.810   3.283  -2.337
    5    HD1  PHE   9           HD1      PHE   9 -17.771   4.613  -4.105
    6    HD2  PHE   9           HD2      PHE   9 -21.979   3.779  -4.138
    7    HE1  PHE   9           HE1      PHE   9 -18.102   6.351  -5.838
    8    HE2  PHE   9           HE2      PHE   9 -22.311   5.529  -5.865
    9    HZ   PHE   9           HZ       PHE   9 -20.371   6.811  -6.722

  No H/Q in entry =           9
  In of MODEL   27
    1    H    SER  10           H        SER  10 -16.933   0.830  -3.307
    2    HA   SER  10           HA       SER  10 -17.113  -0.096  -0.619
    3    HB2  SER  10           HB2      SER  10 -18.357  -1.942  -1.662
    4    HB3  SER  10           HB3      SER  10 -17.041  -2.185  -2.800
    5    HG   SER  10           HG       SER  10 -15.695  -2.662  -1.040

  No H/Q in entry =           5
  In of MODEL   27
    1    H    SER  11           H        SER  11 -15.095   0.025   0.184
    2    HA   SER  11           HA       SER  11 -12.920   0.881  -1.357
    3    HB2  SER  11           HB2      SER  11 -11.695   0.868   0.620
    4    HB3  SER  11           HB3      SER  11 -13.358   1.030   1.188
    5    HG   SER  11           HG       SER  11 -11.583  -1.103   1.370

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA  12           H        ALA  12 -14.142  -1.829  -2.146
    2    HA   ALA  12           HA       ALA  12 -11.563  -3.052  -2.735
    3    HB1  ALA  12           HB1      ALA  12 -13.767  -4.694  -1.469
    4    HB3  ALA  12           HB2      ALA  12 -12.313  -4.156  -0.630
    5    HB2  ALA  12           HB3      ALA  12 -12.182  -5.272  -1.989

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLY  13           H        GLY  13 -12.294  -2.081  -4.760
    2    HA3  GLY  13           HA2      GLY  13 -14.568  -2.723  -6.209
    3    HA2  GLY  13           HA3      GLY  13 -13.013  -2.309  -6.944

  No H/Q in entry =           3
  In of MODEL   27
    1    H    MET  14           H        MET  14 -11.531  -4.605  -6.065
    2    HA   MET  14           HA       MET  14 -12.011  -6.355  -8.159
    3    HB2  MET  14           HB2      MET  14  -9.906  -6.456  -6.931
    4    HB3  MET  14           HB3      MET  14 -10.724  -7.101  -5.509
    5    HG2  MET  14           HG2      MET  14 -11.370  -9.108  -6.794
    6    HG3  MET  14           HG3      MET  14 -10.584  -8.450  -8.229
    7    HE3  MET  14           HE1      MET  14  -8.375  -9.062  -8.901
    8    HE2  MET  14           HE2      MET  14  -6.963  -8.900  -7.857
    9    HE1  MET  14           HE3      MET  14  -8.047  -7.529  -8.079

  No H/Q in entry =           9
  In of MODEL   27
    1    H    SER  15           H        SER  15 -13.201  -6.768  -4.826
    2    HA   SER  15           HA       SER  15 -14.555  -9.230  -5.509
    3    HB2  SER  15           HB2      SER  15 -14.700  -7.487  -3.048
    4    HB3  SER  15           HB3      SER  15 -15.795  -8.845  -3.297
    5    HG   SER  15           HG       SER  15 -13.071  -8.810  -2.751

  No H/Q in entry =           5
  In of MODEL   27
    1    H    THR  16           H        THR  16 -15.616  -5.843  -5.058
    2    HA   THR  16           HA       THR  16 -18.416  -6.330  -5.549
    3    HB   THR  16           HB       THR  16 -16.855  -3.772  -6.056
    4    HG1  THR  16           HG1      THR  16 -16.406  -4.404  -3.984
    5   HG23  THR  16          HG21      THR  16 -18.948  -2.678  -5.734
    6   HG22  THR  16          HG22      THR  16 -19.708  -4.156  -5.118
    7   HG21  THR  16          HG23      THR  16 -19.272  -4.019  -6.827

  No H/Q in entry =           7
  In of MODEL   27
    1    H    SER  17           H        SER  17 -15.616  -5.764  -7.427
    2    HA   SER  17           HA       SER  17 -16.743  -4.995  -9.920
    3    HB2  SER  17           HB2      SER  17 -14.124  -6.348  -9.238
    4    HB3  SER  17           HB3      SER  17 -14.565  -5.884 -10.882
    5    HG   SER  17           HG       SER  17 -14.994  -3.736  -9.705

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU  18           H        LEU  18 -16.197  -8.155  -8.496
    2    HA   LEU  18           HA       LEU  18 -16.800  -9.633 -10.861
    3    HB2  LEU  18           HB2      LEU  18 -15.584 -10.614  -8.963
    4    HB3  LEU  18           HB3      LEU  18 -17.014 -10.422  -7.950
    5    HG   LEU  18           HG       LEU  18 -18.251 -11.983  -9.355
    6   HD12  LEU  18          HD11      LEU  18 -16.692 -13.286 -11.026
    7   HD11  LEU  18          HD12      LEU  18 -15.766 -11.785 -11.016
    8   HD13  LEU  18          HD13      LEU  18 -17.454 -11.777 -11.525
    9   HD23  LEU  18          HD21      LEU  18 -15.575 -13.079  -8.541
   10   HD22  LEU  18          HD22      LEU  18 -17.066 -13.994  -8.769
   11   HD21  LEU  18          HD23      LEU  18 -16.950 -12.810  -7.469

  No H/Q in entry =          11
  In of MODEL   27
    1    H    LEU  19           H        LEU  19 -18.753  -8.429  -8.136
    2    HA   LEU  19           HA       LEU  19 -21.228  -9.587  -8.972
    3    HB2  LEU  19           HB2      LEU  19 -20.917  -8.756  -6.711
    4    HB3  LEU  19           HB3      LEU  19 -20.676  -7.121  -7.325
    5    HG   LEU  19           HG       LEU  19 -22.998  -6.949  -7.932
    6   HD12  LEU  19          HD11      LEU  19 -24.465  -8.947  -7.034
    7   HD11  LEU  19          HD12      LEU  19 -22.993  -9.872  -7.327
    8   HD13  LEU  19          HD13      LEU  19 -23.765  -9.002  -8.651
    9   HD22  LEU  19          HD21      LEU  19 -22.617  -6.269  -5.737
   10   HD21  LEU  19          HD22      LEU  19 -22.386  -7.922  -5.167
   11   HD23  LEU  19          HD23      LEU  19 -23.997  -7.360  -5.614

  No H/Q in entry =          11
  In of MODEL   27
    1    H    VAL  20           H        VAL  20 -19.708  -6.434  -9.647
    2    HA   VAL  20           HA       VAL  20 -21.816  -5.363 -11.203
    3    HB   VAL  20           HB       VAL  20 -18.823  -4.794 -11.318
    4   HG13  VAL  20          HG11      VAL  20 -19.694  -4.206 -13.487
    5   HG12  VAL  20          HG12      VAL  20 -19.505  -2.715 -12.565
    6   HG11  VAL  20          HG13      VAL  20 -21.104  -3.430 -12.765
    7   HG23  VAL  20          HG21      VAL  20 -19.636  -2.616 -10.300
    8   HG22  VAL  20          HG22      VAL  20 -19.683  -4.045  -9.271
    9   HG21  VAL  20          HG23      VAL  20 -21.165  -3.447 -10.015

  No H/Q in entry =           9
  In of MODEL   27
    1    H    SER  21           H        SER  21 -19.076  -7.428 -12.252
    2    HA   SER  21           HA       SER  21 -19.866  -7.290 -15.000
    3    HB2  SER  21           HB2      SER  21 -18.446  -9.266 -15.351
    4    HB3  SER  21           HB3      SER  21 -17.606  -8.034 -14.412
    5    HG   SER  21           HG       SER  21 -18.471 -10.551 -13.694

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LYS  22           H        LYS  22 -20.943  -9.486 -12.441
    2    HA   LYS  22           HA       LYS  22 -22.500 -11.080 -14.271
    3    HB2  LYS  22           HB2      LYS  22 -22.802 -10.747 -11.283
    4    HB3  LYS  22           HB3      LYS  22 -23.591 -11.977 -12.270
    5    HG2  LYS  22           HG2      LYS  22 -20.606 -11.734 -11.927
    6    HG3  LYS  22           HG3      LYS  22 -21.636 -12.805 -10.977
    7    HD2  LYS  22           HD2      LYS  22 -22.324 -13.952 -13.046
    8    HD3  LYS  22           HD3      LYS  22 -21.250 -12.903 -13.970
    9    HE2  LYS  22           HE2      LYS  22 -19.912 -14.762 -13.714
   10    HE3  LYS  22           HE3      LYS  22 -19.423 -13.811 -12.311
   11    HZ3  LYS  22           HZ1      LYS  22 -20.563 -15.185 -10.877
   12    HZ2  LYS  22           HZ2      LYS  22 -19.925 -16.281 -12.007
   13    HZ1  LYS  22           HZ3      LYS  22 -21.559 -15.829 -12.094

  No H/Q in entry =          13
  In of MODEL   27
    1    H    MET  23           H        MET  23 -23.193  -8.165 -12.380
    2    HA   MET  23           HA       MET  23 -26.002  -8.215 -12.880
    3    HB2  MET  23           HB2      MET  23 -24.133  -5.928 -12.295
    4    HB3  MET  23           HB3      MET  23 -25.877  -5.742 -12.467
    5    HG2  MET  23           HG2      MET  23 -26.276  -7.056 -10.507
    6    HG3  MET  23           HG3      MET  23 -24.569  -7.484 -10.389
    7    HE2  MET  23           HE1      MET  23 -26.831  -3.820  -9.167
    8    HE1  MET  23           HE2      MET  23 -27.098  -4.775 -10.624
    9    HE3  MET  23           HE3      MET  23 -26.049  -3.357 -10.680

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ARG  24           H        ARG  24 -23.239  -6.799 -14.660
    2    HA   ARG  24           HA       ARG  24 -24.728  -5.470 -16.645
    3    HB2  ARG  24           HB2      ARG  24 -22.275  -5.111 -16.256
    4    HB3  ARG  24           HB3      ARG  24 -21.966  -6.696 -16.921
    5    HG2  ARG  24           HG2      ARG  24 -22.891  -5.951 -19.134
    6    HG3  ARG  24           HG3      ARG  24 -23.121  -4.325 -18.437
    7    HD2  ARG  24           HD2      ARG  24 -20.475  -5.847 -18.579
    8    HD3  ARG  24           HD3      ARG  24 -20.958  -4.530 -19.639
    9    HE   ARG  24           HE       ARG  24 -20.056  -4.172 -16.959
   10   HH21  ARG  24          HH11      ARG  24 -20.706  -2.250 -15.991
   11   HH22  ARG  24          HH12      ARG  24 -21.128  -0.894 -16.978
   12   HH11  ARG  24          HH21      ARG  24 -21.070  -2.870 -19.914
   13   HH12  ARG  24          HH22      ARG  24 -21.331  -1.268 -19.298

  No H/Q in entry =          13
  In of MODEL   27
    1    H    ALA  25           H        ALA  25 -23.640  -8.821 -16.399
    2    HA   ALA  25           HA       ALA  25 -24.283  -9.625 -19.040
    3    HB1  ALA  25           HB1      ALA  25 -23.607 -11.670 -18.362
    4    HB3  ALA  25           HB2      ALA  25 -24.661 -11.649 -16.949
    5    HB2  ALA  25           HB3      ALA  25 -23.097 -10.839 -16.893

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLN  26           H        GLN  26 -26.104  -9.669 -16.013
    2    HA   GLN  26           HA       GLN  26 -28.463 -10.837 -17.035
    3    HB2  GLN  26           HB2      GLN  26 -27.926  -9.116 -14.634
    4    HB3  GLN  26           HB3      GLN  26 -29.497  -9.818 -14.987
    5    HG2  GLN  26           HG2      GLN  26 -26.927 -11.307 -14.536
    6    HG3  GLN  26           HG3      GLN  26 -28.283 -11.199 -13.422
    7   HE21  GLN  26          HE21      GLN  26 -27.092 -13.366 -14.719
    8   HE22  GLN  26          HE22      GLN  26 -28.148 -14.396 -15.521

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ALA  27           H        ALA  27 -27.490  -7.454 -16.617
    2    HA   ALA  27           HA       ALA  27 -29.969  -6.328 -17.386
    3    HB1  ALA  27           HB1      ALA  27 -28.143  -5.041 -16.264
    4    HB3  ALA  27           HB2      ALA  27 -28.728  -4.257 -17.732
    5    HB2  ALA  27           HB3      ALA  27 -27.202  -5.140 -17.753

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLU  28           H        GLU  28 -27.286  -7.564 -19.272
    2    HA   GLU  28           HA       GLU  28 -28.214  -6.492 -21.779
    3    HB2  GLU  28           HB2      GLU  28 -25.842  -7.207 -21.166
    4    HB3  GLU  28           HB3      GLU  28 -26.405  -8.863 -21.381
    5    HG2  GLU  28           HG2      GLU  28 -25.255  -8.083 -23.346
    6    HG3  GLU  28           HG3      GLU  28 -26.956  -8.383 -23.694

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LYS  29           H        LYS  29 -28.412  -9.611 -20.150
    2    HA   LYS  29           HA       LYS  29 -29.735 -11.049 -22.165
    3    HB2  LYS  29           HB2      LYS  29 -28.693 -12.061 -20.172
    4    HB3  LYS  29           HB3      LYS  29 -29.954 -11.349 -19.168
    5    HG2  LYS  29           HG2      LYS  29 -31.633 -12.694 -20.244
    6    HG3  LYS  29           HG3      LYS  29 -30.442 -13.332 -21.377
    7    HD2  LYS  29           HD2      LYS  29 -29.310 -14.526 -19.656
    8    HD3  LYS  29           HD3      LYS  29 -30.205 -13.686 -18.392
    9    HE2  LYS  29           HE2      LYS  29 -30.984 -16.024 -18.773
   10    HE3  LYS  29           HE3      LYS  29 -32.249 -14.814 -19.004
   11    HZ1  LYS  29           HZ1      LYS  29 -31.690 -14.933 -21.433
   12    HZ3  LYS  29           HZ2      LYS  29 -32.424 -16.318 -20.780
   13    HZ2  LYS  29           HZ3      LYS  29 -30.755 -16.304 -21.080

  No H/Q in entry =          13
  In of MODEL   27
    1    H    TYR  30           H        TYR  30 -31.098  -8.950 -19.639
    2    HA   TYR  30           HA       TYR  30 -33.769  -9.359 -20.879
    3    HB2  TYR  30           HB2      TYR  30 -33.097  -8.237 -18.149
    4    HB3  TYR  30           HB3      TYR  30 -34.719  -8.471 -18.801
    5    HD1  TYR  30           HD1      TYR  30 -35.655 -10.750 -19.033
    6    HD2  TYR  30           HD2      TYR  30 -31.809 -10.086 -17.331
    7    HE1  TYR  30           HE1      TYR  30 -35.590 -13.087 -18.259
    8    HE2  TYR  30           HE2      TYR  30 -31.744 -12.408 -16.560
    9    HH   TYR  30           HH       TYR  30 -33.412 -14.740 -17.671

  No H/Q in entry =           9
  In of MODEL   27
    1    H    GLU  31           H        GLU  31 -31.582  -7.384 -21.665
    2    HA   GLU  31           HA       GLU  31 -31.486  -5.220 -22.469
    3    HB2  GLU  31           HB2      GLU  31 -34.390  -5.900 -22.982
    4    HB3  GLU  31           HB3      GLU  31 -33.537  -4.535 -23.700
    5    HG2  GLU  31           HG2      GLU  31 -32.082  -5.977 -24.908
    6    HG3  GLU  31           HG3      GLU  31 -32.660  -7.393 -24.032

  No H/Q in entry =           6
  In of MODEL   27
    1    H    VAL  32           H        VAL  32 -31.679  -5.142 -19.735
    2    HA   VAL  32           HA       VAL  32 -33.518  -3.015 -19.053
    3    HB   VAL  32           HB       VAL  32 -31.133  -4.048 -17.487
    4   HG12  VAL  32          HG11      VAL  32 -32.657  -3.226 -15.580
    5   HG11  VAL  32          HG12      VAL  32 -33.483  -2.303 -16.834
    6   HG13  VAL  32          HG13      VAL  32 -31.773  -2.019 -16.515
    7   HG21  VAL  32          HG21      VAL  32 -32.920  -5.744 -18.186
    8   HG23  VAL  32          HG22      VAL  32 -33.949  -4.917 -17.017
    9   HG22  VAL  32          HG23      VAL  32 -32.438  -5.661 -16.492

  No H/Q in entry =           9
  In of MODEL   27
    1    HA   PRO  33           HA       PRO  33 -30.460  -0.103 -20.706
    2    HB2  PRO  33           HB2      PRO  33 -31.950   2.134 -20.558
    3    HB3  PRO  33           HB3      PRO  33 -32.433   0.847 -21.663
    4    HG2  PRO  33           HG2      PRO  33 -33.392   1.346 -18.844
    5    HG3  PRO  33           HG3      PRO  33 -34.360   1.161 -20.306
    6    HD2  PRO  33           HD2      PRO  33 -33.921  -0.932 -18.660
    7    HD3  PRO  33           HD3      PRO  33 -33.989  -1.156 -20.409

  No H/Q in entry =           7
  In of MODEL   27
    1    H    VAL  34           H        VAL  34 -29.198  -0.677 -18.765
    2    HA   VAL  34           HA       VAL  34 -28.888   1.730 -17.095
    3    HB   VAL  34           HB       VAL  34 -28.317   0.245 -15.172
    4   HG12  VAL  34          HG11      VAL  34 -30.737  -0.609 -14.868
    5   HG11  VAL  34          HG12      VAL  34 -31.049   0.169 -16.419
    6   HG13  VAL  34          HG13      VAL  34 -30.485   1.127 -15.049
    7   HG21  VAL  34          HG21      VAL  34 -28.525  -1.761 -17.199
    8   HG23  VAL  34          HG22      VAL  34 -29.583  -2.125 -15.834
    9   HG22  VAL  34          HG23      VAL  34 -27.861  -1.856 -15.567

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ILE  35           H        ILE  35 -26.907   2.140 -16.255
    2    HA   ILE  35           HA       ILE  35 -24.617   0.802 -17.536
    3    HB   ILE  35           HB       ILE  35 -24.989   3.687 -16.696
    4   HG12  ILE  35          HG12      ILE  35 -24.024   2.396 -19.256
    5   HG13  ILE  35          HG13      ILE  35 -25.648   3.028 -18.986
    6   HG21  ILE  35          HG21      ILE  35 -22.441   2.135 -17.025
    7   HG23  ILE  35          HG22      ILE  35 -22.882   3.306 -15.784
    8   HG22  ILE  35          HG23      ILE  35 -22.499   3.852 -17.417
    9   HD11  ILE  35          HD11      ILE  35 -24.226   5.204 -18.367
   10   HD13  ILE  35          HD12      ILE  35 -24.770   4.842 -20.006
   11   HD12  ILE  35          HD13      ILE  35 -23.120   4.453 -19.518

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ILE  36           H        ILE  36 -23.391  -0.247 -15.949
    2    HA   ILE  36           HA       ILE  36 -23.820   0.344 -13.071
    3    HB   ILE  36           HB       ILE  36 -23.020  -2.356 -14.208
    4   HG12  ILE  36          HG12      ILE  36 -25.818  -1.533 -13.429
    5   HG13  ILE  36          HG13      ILE  36 -25.249  -1.501 -15.099
    6   HG23  ILE  36          HG21      ILE  36 -23.373  -3.202 -12.101
    7   HG22  ILE  36          HG22      ILE  36 -24.488  -1.913 -11.647
    8   HG21  ILE  36          HG23      ILE  36 -22.754  -1.595 -11.719
    9   HD13  ILE  36          HD11      ILE  36 -25.435  -3.712 -15.326
   10   HD12  ILE  36          HD12      ILE  36 -26.496  -3.594 -13.924
   11   HD11  ILE  36          HD13      ILE  36 -24.801  -4.031 -13.711

  No H/Q in entry =          11
  In of MODEL   27
    1    H    GLU  37           H        GLU  37 -22.031   0.947 -11.965
    2    HA   GLU  37           HA       GLU  37 -19.350   0.136 -12.895
    3    HB2  GLU  37           HB2      GLU  37 -20.229   2.926 -12.173
    4    HB3  GLU  37           HB3      GLU  37 -18.543   2.424 -12.299
    5    HG2  GLU  37           HG2      GLU  37 -18.826   1.988 -14.660
    6    HG3  GLU  37           HG3      GLU  37 -20.531   2.425 -14.550

  No H/Q in entry =           6
  In of MODEL   27
    1    H    ALA  38           H        ALA  38 -17.861  -0.130 -11.218
    2    HA   ALA  38           HA       ALA  38 -18.885   0.030  -8.443
    3    HB1  ALA  38           HB1      ALA  38 -17.190  -1.909  -9.892
    4    HB3  ALA  38           HB2      ALA  38 -18.238  -2.149  -8.494
    5    HB2  ALA  38           HB3      ALA  38 -16.620  -1.482  -8.278

  No H/Q in entry =           5
  In of MODEL   27
    1    H    PHE  39           H        PHE  39 -17.632   1.216  -6.962
    2    HA   PHE  39           HA       PHE  39 -15.100   2.408  -7.852
    3    HB2  PHE  39           HB2      PHE  39 -17.501   3.903  -6.820
    4    HB3  PHE  39           HB3      PHE  39 -15.868   4.558  -6.723
    5    HD1  PHE  39           HD1      PHE  39 -14.547   4.577  -8.979
    6    HD2  PHE  39           HD2      PHE  39 -18.794   4.398  -8.641
    7    HE1  PHE  39           HE1      PHE  39 -14.756   5.477 -11.279
    8    HE2  PHE  39           HE2      PHE  39 -19.019   5.289 -10.932
    9    HZ   PHE  39           HZ       PHE  39 -17.006   5.803 -12.271

  No H/Q in entry =           9
  In of MODEL   27
    1    HA   PRO  40           HA       PRO  40 -14.157   1.607  -3.575
    2    HB2  PRO  40           HB2      PRO  40 -12.375   3.605  -2.955
    3    HB3  PRO  40           HB3      PRO  40 -11.942   2.279  -4.033
    4    HG2  PRO  40           HG2      PRO  40 -12.948   5.027  -4.757
    5    HG3  PRO  40           HG3      PRO  40 -11.531   4.179  -5.373
    6    HD2  PRO  40           HD2      PRO  40 -13.758   4.123  -6.775
    7    HD3  PRO  40           HD3      PRO  40 -12.812   2.646  -6.601

  No H/Q in entry =           7
  In of MODEL   27
    1    H    GLU  41           H        GLU  41 -14.767   2.568  -1.434
    2    HA   GLU  41           HA       GLU  41 -17.002   4.285  -1.397
    3    HB2  GLU  41           HB2      GLU  41 -16.861   4.177   0.976
    4    HB3  GLU  41           HB3      GLU  41 -16.362   2.601   0.362
    5    HG2  GLU  41           HG2      GLU  41 -14.018   3.190   0.736
    6    HG3  GLU  41           HG3      GLU  41 -14.511   4.774   1.336

  No H/Q in entry =           6
  In of MODEL   27
    1    H    THR  42           H        THR  42 -13.665   5.182  -1.448
    2    HA   THR  42           HA       THR  42 -13.999   7.733  -0.211
    3    HB   THR  42           HB       THR  42 -11.842   8.305  -1.300
    4    HG1  THR  42           HG1      THR  42 -10.881   6.635  -2.579
    5   HG23  THR  42          HG21      THR  42 -11.674   7.119   0.776
    6   HG22  THR  42          HG22      THR  42 -10.525   6.367  -0.332
    7   HG21  THR  42          HG23      THR  42 -12.069   5.585  -0.001

  No H/Q in entry =           7
  In of MODEL   27
    1    H    LEU  43           H        LEU  43 -14.917   6.674  -3.319
    2    HA   LEU  43           HA       LEU  43 -15.157   9.456  -4.263
    3    HB2  LEU  43           HB2      LEU  43 -15.560   6.832  -5.689
    4    HB3  LEU  43           HB3      LEU  43 -15.722   8.426  -6.422
    5    HG   LEU  43           HG       LEU  43 -13.153   7.228  -5.417
    6   HD11  LEU  43          HD11      LEU  43 -14.365   6.328  -7.567
    7   HD13  LEU  43          HD12      LEU  43 -12.632   6.658  -7.585
    8   HD12  LEU  43          HD13      LEU  43 -13.759   7.825  -8.276
    9   HD21  LEU  43          HD21      LEU  43 -13.888   9.851  -6.696
   10   HD23  LEU  43          HD22      LEU  43 -12.257   9.189  -6.825
   11   HD22  LEU  43          HD23      LEU  43 -12.936   9.560  -5.241

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ALA  44           H        ALA  44 -17.109   7.625  -2.422
    2    HA   ALA  44           HA       ALA  44 -19.590   7.512  -3.739
    3    HB2  ALA  44           HB1      ALA  44 -19.453   6.375  -1.654
    4    HB3  ALA  44           HB2      ALA  44 -20.552   7.723  -1.366
    5    HB1  ALA  44           HB3      ALA  44 -18.879   7.817  -0.817

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLY  45           H        GLY  45 -18.151  10.289  -2.184
    2    HA3  GLY  45           HA2      GLY  45 -20.579  11.806  -2.525
    3    HA2  GLY  45           HA3      GLY  45 -19.030  12.417  -1.946

  No H/Q in entry =           3
  In of MODEL   27
    1    H    GLU  46           H        GLU  46 -17.510  11.493  -4.250
    2    HA   GLU  46           HA       GLU  46 -18.138  13.728  -5.996
    3    HB2  GLU  46           HB2      GLU  46 -15.954  11.640  -6.026
    4    HB3  GLU  46           HB3      GLU  46 -16.083  12.949  -7.202
    5    HG2  GLU  46           HG2      GLU  46 -15.762  14.593  -5.463
    6    HG3  GLU  46           HG3      GLU  46 -15.739  13.328  -4.234

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LYS  47           H        LYS  47 -18.040  10.213  -6.465
    2    HA   LYS  47           HA       LYS  47 -19.143  10.464  -9.136
    3    HB2  LYS  47           HB2      LYS  47 -18.588   8.051  -7.399
    4    HB3  LYS  47           HB3      LYS  47 -19.158   7.980  -9.067
    5    HG2  LYS  47           HG2      LYS  47 -16.602   9.343  -8.305
    6    HG3  LYS  47           HG3      LYS  47 -16.684   7.621  -8.675
    7    HD2  LYS  47           HD2      LYS  47 -17.675   8.157 -10.862
    8    HD3  LYS  47           HD3      LYS  47 -17.530   9.874 -10.491
    9    HE2  LYS  47           HE2      LYS  47 -15.106   9.638 -10.328
   10    HE3  LYS  47           HE3      LYS  47 -15.247   7.917 -10.681
   11    HZ2  LYS  47           HZ1      LYS  47 -16.061  10.133 -12.472
   12    HZ1  LYS  47           HZ2      LYS  47 -16.223   8.478 -12.813
   13    HZ3  LYS  47           HZ3      LYS  47 -14.678   9.164 -12.648

  No H/Q in entry =          13
  In of MODEL   27
    1    H    GLY  48           H        GLY  48 -20.463   9.685  -5.991
    2    HA3  GLY  48           HA2      GLY  48 -22.857   8.520  -6.737
    3    HA2  GLY  48           HA3      GLY  48 -22.622   9.500  -5.290

  No H/Q in entry =           3
  In of MODEL   27
    1    H    GLN  49           H        GLN  49 -22.029  11.933  -6.839
    2    HA   GLN  49           HA       GLN  49 -24.582  13.060  -6.967
    3    HB2  GLN  49           HB2      GLN  49 -22.037  13.922  -8.326
    4    HB3  GLN  49           HB3      GLN  49 -23.493  14.896  -8.229
    5    HG2  GLN  49           HG2      GLN  49 -23.328  14.896  -5.792
    6    HG3  GLN  49           HG3      GLN  49 -21.884  13.903  -5.887
    7   HE21  GLN  49          HE21      GLN  49 -21.751  16.118  -4.595
    8   HE22  GLN  49          HE22      GLN  49 -20.823  17.375  -5.234

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ASN  50           H        ASN  50 -22.920  11.193  -9.375
    2    HA   ASN  50           HA       ASN  50 -24.803  12.096 -11.445
    3    HB2  ASN  50           HB2      ASN  50 -22.232  10.542 -11.699
    4    HB3  ASN  50           HB3      ASN  50 -23.283  10.987 -13.036
    5   HD21  ASN  50          HD21      ASN  50 -20.638  11.802 -11.423
    6   HD22  ASN  50          HD22      ASN  50 -20.395  13.439 -11.752

  No H/Q in entry =           6
  In of MODEL   27
    1    H    ALA  51           H        ALA  51 -24.797   9.719  -9.221
    2    HA   ALA  51           HA       ALA  51 -25.599   7.595 -11.064
    3    HB2  ALA  51           HB1      ALA  51 -25.020   6.227  -9.392
    4    HB3  ALA  51           HB2      ALA  51 -26.135   7.032  -8.289
    5    HB1  ALA  51           HB3      ALA  51 -24.492   7.646  -8.485

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ASP  52           H        ASP  52 -27.610   6.552 -10.929
    2    HA   ASP  52           HA       ASP  52 -29.778   8.393 -10.242
    3    HB2  ASP  52           HB2      ASP  52 -29.608   5.902 -11.935
    4    HB3  ASP  52           HB3      ASP  52 -31.146   6.641 -11.490

  No H/Q in entry =           4
  In of MODEL   27
    1    H    VAL  53           H        VAL  53 -28.195   5.484  -9.257
    2    HA   VAL  53           HA       VAL  53 -29.627   5.598  -6.736
    3    HB   VAL  53           HB       VAL  53 -31.041   3.978  -7.991
    4   HG11  VAL  53          HG11      VAL  53 -29.304   3.119  -9.526
    5   HG13  VAL  53          HG12      VAL  53 -30.144   1.822  -8.676
    6   HG12  VAL  53          HG13      VAL  53 -28.529   2.309  -8.165
    7   HG23  VAL  53          HG21      VAL  53 -30.229   1.980  -6.319
    8   HG22  VAL  53          HG22      VAL  53 -31.348   3.289  -5.938
    9   HG21  VAL  53          HG23      VAL  53 -29.639   3.445  -5.534

  No H/Q in entry =           9
  In of MODEL   27
    1    H    VAL  54           H        VAL  54 -28.314   5.141  -5.088
    2    HA   VAL  54           HA       VAL  54 -25.561   4.277  -5.714
    3    HB   VAL  54           HB       VAL  54 -26.613   6.043  -3.446
    4   HG11  VAL  54          HG11      VAL  54 -24.046   4.607  -3.756
    5   HG13  VAL  54          HG12      VAL  54 -24.791   5.279  -2.306
    6   HG12  VAL  54          HG13      VAL  54 -23.880   6.326  -3.394
    7   HG22  VAL  54          HG21      VAL  54 -25.743   7.860  -4.531
    8   HG21  VAL  54          HG22      VAL  54 -26.301   6.887  -5.890
    9   HG23  VAL  54          HG23      VAL  54 -24.593   6.895  -5.456

  No H/Q in entry =           9
  In of MODEL   27
    1    H    LEU  55           H        LEU  55 -24.982   2.345  -5.090
    2    HA   LEU  55           HA       LEU  55 -26.495   1.027  -2.923
    3    HB2  LEU  55           HB2      LEU  55 -24.954  -0.133  -5.232
    4    HB3  LEU  55           HB3      LEU  55 -25.718  -1.073  -3.950
    5    HG   LEU  55           HG       LEU  55 -27.148   0.545  -6.050
    6   HD13  LEU  55          HD11      LEU  55 -26.865  -1.299  -7.287
    7   HD12  LEU  55          HD12      LEU  55 -27.826  -2.177  -6.097
    8   HD11  LEU  55          HD13      LEU  55 -26.070  -2.127  -5.950
    9   HD23  LEU  55          HD21      LEU  55 -28.453  -1.408  -4.209
   10   HD22  LEU  55          HD22      LEU  55 -29.139  -0.013  -5.043
   11   HD21  LEU  55          HD23      LEU  55 -28.114   0.222  -3.628

  No H/Q in entry =          11
  In of MODEL   27
    1    H    LEU  56           H        LEU  56 -25.344   0.407  -1.125
    2    HA   LEU  56           HA       LEU  56 -22.407   0.780  -1.179
    3    HB2  LEU  56           HB2      LEU  56 -24.206   0.562   1.223
    4    HB3  LEU  56           HB3      LEU  56 -22.493   0.977   1.211
    5    HG   LEU  56           HG       LEU  56 -24.781   2.682   0.267
    6   HD11  LEU  56          HD11      LEU  56 -23.663   2.270   2.782
    7   HD13  LEU  56          HD12      LEU  56 -24.644   3.650   2.291
    8   HD12  LEU  56          HD13      LEU  56 -22.886   3.742   2.199
    9   HD23  LEU  56          HD21      LEU  56 -22.822   4.367   0.084
   10   HD22  LEU  56          HD22      LEU  56 -23.218   3.286  -1.252
   11   HD21  LEU  56          HD23      LEU  56 -21.864   2.912  -0.185

  No H/Q in entry =          11
  In of MODEL   27
    1    H    GLY  57           H        GLY  57 -21.038  -0.867  -0.664
    2    HA3  GLY  57           HA2      GLY  57 -21.982  -3.543  -0.882
    3    HA2  GLY  57           HA3      GLY  57 -20.355  -3.066  -0.402

  No H/Q in entry =           3
  In of MODEL   27
    1    HA   PRO  58           HA       PRO  58 -23.164  -4.115   3.305
    2    HB2  PRO  58           HB2      PRO  58 -22.500  -6.731   3.887
    3    HB3  PRO  58           HB3      PRO  58 -23.882  -6.303   2.880
    4    HG2  PRO  58           HG2      PRO  58 -21.165  -7.199   2.080
    5    HG3  PRO  58           HG3      PRO  58 -22.735  -7.640   1.407
    6    HD2  PRO  58           HD2      PRO  58 -21.113  -5.825   0.197
    7    HD3  PRO  58           HD3      PRO  58 -22.872  -5.723   0.100

  No H/Q in entry =           7
  In of MODEL   27
    1    H    GLN  59           H        GLN  59 -19.799  -4.610   2.685
    2    HA   GLN  59           HA       GLN  59 -19.038  -4.659   5.443
    3    HB2  GLN  59           HB2      GLN  59 -17.424  -3.752   3.055
    4    HB3  GLN  59           HB3      GLN  59 -16.791  -4.087   4.654
    5    HG2  GLN  59           HG2      GLN  59 -18.095  -6.099   2.826
    6    HG3  GLN  59           HG3      GLN  59 -16.365  -5.907   3.066
    7   HE21  GLN  59          HE21      GLN  59 -18.584  -7.722   3.760
    8   HE22  GLN  59          HE22      GLN  59 -18.414  -8.525   5.207

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ILE  60           H        ILE  60 -19.955  -2.081   3.261
    2    HA   ILE  60           HA       ILE  60 -19.081  -0.150   5.321
    3    HB   ILE  60           HB       ILE  60 -19.302   1.599   3.512
    4   HG12  ILE  60          HG12      ILE  60 -19.138  -0.613   1.508
    5   HG13  ILE  60          HG13      ILE  60 -20.715  -0.057   2.067
    6   HG21  ILE  60          HG21      ILE  60 -17.185   0.348   4.236
    7   HG23  ILE  60          HG22      ILE  60 -17.152   1.314   2.762
    8   HG22  ILE  60          HG23      ILE  60 -17.307  -0.439   2.662
    9   HD11  ILE  60          HD11      ILE  60 -19.800   2.315   1.444
   10   HD13  ILE  60          HD12      ILE  60 -20.385   1.246   0.170
   11   HD12  ILE  60          HD13      ILE  60 -18.653   1.411   0.457

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ALA  61           H        ALA  61 -21.550  -1.715   5.382
    2    HA   ALA  61           HA       ALA  61 -23.763  -0.027   4.945
    3    HB1  ALA  61           HB1      ALA  61 -24.988  -1.518   6.259
    4    HB2  ALA  61           HB2      ALA  61 -23.590  -1.928   7.256
    5    HB3  ALA  61           HB3      ALA  61 -23.696  -2.519   5.597

  No H/Q in entry =           5
  In of MODEL   27
    1    H    TYR  62           H        TYR  62 -21.550  -0.183   7.735
    2    HA   TYR  62           HA       TYR  62 -23.086   1.473   9.424
    3    HB2  TYR  62           HB2      TYR  62 -21.067   1.838  10.680
    4    HB3  TYR  62           HB3      TYR  62 -21.087   0.158  10.141
    5    HD1  TYR  62           HD1      TYR  62 -19.526  -0.601   8.357
    6    HD2  TYR  62           HD2      TYR  62 -19.332   3.368   9.930
    7    HE1  TYR  62           HE1      TYR  62 -17.312  -0.302   7.316
    8    HE2  TYR  62           HE2      TYR  62 -17.103   3.661   8.889
    9    HH   TYR  62           HH       TYR  62 -15.787   2.766   7.169

  No H/Q in entry =           9
  In of MODEL   27
    1    H    MET  63           H        MET  63 -21.443   2.343   6.572
    2    HA   MET  63           HA       MET  63 -21.249   5.167   7.290
    3    HB2  MET  63           HB2      MET  63 -20.665   3.664   4.738
    4    HB3  MET  63           HB3      MET  63 -20.451   5.405   4.939
    5    HG2  MET  63           HG2      MET  63 -18.738   5.023   6.605
    6    HG3  MET  63           HG3      MET  63 -18.973   3.281   6.469
    7    HE3  MET  63           HE1      MET  63 -18.423   5.975   3.114
    8    HE2  MET  63           HE2      MET  63 -16.898   6.224   3.964
    9    HE1  MET  63           HE3      MET  63 -18.427   6.443   4.817

  No H/Q in entry =           9
  In of MODEL   27
    1    H    LEU  64           H        LEU  64 -23.832   3.345   6.316
    2    HA   LEU  64           HA       LEU  64 -25.035   4.792   4.254
    3    HB2  LEU  64           HB2      LEU  64 -25.920   2.687   5.156
    4    HB3  LEU  64           HB3      LEU  64 -26.366   3.520   6.644
    5    HG   LEU  64           HG       LEU  64 -28.052   4.802   5.431
    6   HD13  LEU  64          HD11      LEU  64 -27.773   5.059   3.201
    7   HD12  LEU  64          HD12      LEU  64 -28.434   3.432   3.043
    8   HD11  LEU  64          HD13      LEU  64 -26.688   3.674   3.098
    9   HD23  LEU  64          HD21      LEU  64 -28.599   2.001   4.660
   10   HD22  LEU  64          HD22      LEU  64 -29.573   3.136   5.594
   11   HD21  LEU  64          HD23      LEU  64 -28.204   2.323   6.349

  No H/Q in entry =          11
  In of MODEL   27
    1    HA   PRO  65           HA       PRO  65 -27.177   7.943   7.039
    2    HB2  PRO  65           HB2      PRO  65 -25.168   8.062   9.289
    3    HB3  PRO  65           HB3      PRO  65 -26.905   8.359   9.342
    4    HG2  PRO  65           HG2      PRO  65 -25.995   6.088  10.246
    5    HG3  PRO  65           HG3      PRO  65 -27.417   6.079   9.205
    6    HD2  PRO  65           HD2      PRO  65 -24.554   5.441   8.488
    7    HD3  PRO  65           HD3      PRO  65 -26.021   4.573   8.037

  No H/Q in entry =           7
  In of MODEL   27
    1    H    GLU  66           H        GLU  66 -23.621   7.850   7.102
    2    HA   GLU  66           HA       GLU  66 -23.297  10.649   6.720
    3    HB2  GLU  66           HB2      GLU  66 -21.509   8.329   6.043
    4    HB3  GLU  66           HB3      GLU  66 -21.043  10.018   5.849
    5    HG2  GLU  66           HG2      GLU  66 -21.244  10.370   8.220
    6    HG3  GLU  66           HG3      GLU  66 -21.785   8.706   8.439

  No H/Q in entry =           6
  In of MODEL   27
    1    H    ILE  67           H        ILE  67 -23.434   7.926   4.444
    2    HA   ILE  67           HA       ILE  67 -23.006   9.649   2.165
    3    HB   ILE  67           HB       ILE  67 -23.936   6.750   2.322
    4   HG12  ILE  67          HG12      ILE  67 -21.296   7.900   1.402
    5   HG13  ILE  67          HG13      ILE  67 -21.591   7.468   3.085
    6   HG21  ILE  67          HG21      ILE  67 -23.864   8.648   0.113
    7   HG23  ILE  67          HG22      ILE  67 -24.507   7.007   0.152
    8   HG22  ILE  67          HG23      ILE  67 -22.797   7.275  -0.180
    9   HD12  ILE  67          HD11      ILE  67 -21.197   5.713   0.719
   10   HD11  ILE  67          HD12      ILE  67 -22.213   5.140   2.040
   11   HD13  ILE  67          HD13      ILE  67 -20.534   5.583   2.348

  No H/Q in entry =          11
  In of MODEL   27
    1    H    GLN  68           H        GLN  68 -25.883   8.614   3.798
    2    HA   GLN  68           HA       GLN  68 -27.707   9.582   1.838
    3    HB2  GLN  68           HB2      GLN  68 -27.958   9.201   4.818
    4    HB3  GLN  68           HB3      GLN  68 -29.274   9.820   3.834
    5    HG2  GLN  68           HG2      GLN  68 -29.330   7.802   2.541
    6    HG3  GLN  68           HG3      GLN  68 -27.885   7.201   3.333
    7   HE21  GLN  68          HE21      GLN  68 -30.080   5.872   3.193
    8   HE22  GLN  68          HE22      GLN  68 -30.910   5.413   4.606

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ARG  69           H        ARG  69 -26.073  11.204   4.584
    2    HA   ARG  69           HA       ARG  69 -27.407  13.708   4.206
    3    HB2  ARG  69           HB2      ARG  69 -25.069  12.734   5.778
    4    HB3  ARG  69           HB3      ARG  69 -25.127  14.458   5.435
    5    HG2  ARG  69           HG2      ARG  69 -27.440  14.522   6.415
    6    HG3  ARG  69           HG3      ARG  69 -27.252  12.825   6.872
    7    HD2  ARG  69           HD2      ARG  69 -25.527  15.149   7.802
    8    HD3  ARG  69           HD3      ARG  69 -26.664  14.249   8.792
    9    HE   ARG  69           HE       ARG  69 -24.067  13.292   7.825
   10   HH21  ARG  69          HH11      ARG  69 -23.278  11.508   9.003
   11   HH22  ARG  69          HH12      ARG  69 -24.314  10.696  10.127
   12   HH11  ARG  69          HH21      ARG  69 -27.026  12.768   9.528
   13   HH12  ARG  69          HH22      ARG  69 -26.436  11.407  10.422

  No H/Q in entry =          13
  In of MODEL   27
    1    H    LEU  70           H        LEU  70 -24.559  12.276   2.823
    2    HA   LEU  70           HA       LEU  70 -23.417  14.637   1.672
    3    HB2  LEU  70           HB2      LEU  70 -22.453  12.301   2.244
    4    HB3  LEU  70           HB3      LEU  70 -23.079  11.858   0.656
    5    HG   LEU  70           HG       LEU  70 -21.470  13.218  -0.422
    6   HD11  LEU  70          HD11      LEU  70 -20.628  14.025   2.371
    7   HD13  LEU  70          HD12      LEU  70 -21.313  15.080   1.134
    8   HD12  LEU  70          HD13      LEU  70 -19.712  14.379   0.902
    9   HD22  LEU  70          HD21      LEU  70 -20.060  11.480  -0.210
   10   HD21  LEU  70          HD22      LEU  70 -20.989  10.958   1.196
   11   HD23  LEU  70          HD23      LEU  70 -19.589  12.009   1.405

  No H/Q in entry =          11
  In of MODEL   27
    1    H    LEU  71           H        LEU  71 -25.610  12.134   0.542
    2    HA   LEU  71           HA       LEU  71 -26.122  13.651  -1.959
    3    HB2  LEU  71           HB2      LEU  71 -26.370  10.667  -1.539
    4    HB3  LEU  71           HB3      LEU  71 -26.490  11.543  -3.064
    5    HG   LEU  71           HG       LEU  71 -23.965  11.504  -1.412
    6   HD12  LEU  71          HD11      LEU  71 -24.050   9.899  -3.859
    7   HD11  LEU  71          HD12      LEU  71 -25.065   9.279  -2.558
    8   HD13  LEU  71          HD13      LEU  71 -23.340   9.530  -2.286
    9   HD22  LEU  71          HD21      LEU  71 -24.046  13.335  -2.889
   10   HD21  LEU  71          HD22      LEU  71 -24.564  12.312  -4.228
   11   HD23  LEU  71          HD23      LEU  71 -22.943  12.134  -3.557

  No H/Q in entry =          11
  In of MODEL   27
    1    HA   PRO  72           HA       PRO  72 -29.986  13.238   0.672
    2    HB2  PRO  72           HB2      PRO  72 -30.804  15.812   0.617
    3    HB3  PRO  72           HB3      PRO  72 -29.497  15.330   1.699
    4    HG2  PRO  72           HG2      PRO  72 -29.302  16.546  -1.044
    5    HG3  PRO  72           HG3      PRO  72 -28.522  17.073   0.447
    6    HD2  PRO  72           HD2      PRO  72 -27.216  15.509  -1.338
    7    HD3  PRO  72           HD3      PRO  72 -26.958  15.323   0.396

  No H/Q in entry =           7
  In of MODEL   27
    1    H    ASN  73           H        ASN  73 -29.358  14.212  -2.536
    2    HA   ASN  73           HA       ASN  73 -32.225  13.955  -3.161
    3    HB2  ASN  73           HB2      ASN  73 -31.749  15.073  -5.250
    4    HB3  ASN  73           HB3      ASN  73 -31.206  16.032  -3.882
    5   HD21  ASN  73          HD21      ASN  73 -30.418  16.088  -6.562
    6   HD22  ASN  73          HD22      ASN  73 -28.754  15.901  -6.761

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LYS  74           H        LYS  74 -30.281  11.663  -2.764
    2    HA   LYS  74           HA       LYS  74 -30.880  10.302  -5.322
    3    HB2  LYS  74           HB2      LYS  74 -28.347   9.952  -3.713
    4    HB3  LYS  74           HB3      LYS  74 -28.751   9.160  -5.237
    5    HG2  LYS  74           HG2      LYS  74 -28.434  12.124  -5.009
    6    HG3  LYS  74           HG3      LYS  74 -27.079  11.040  -5.328
    7    HD2  LYS  74           HD2      LYS  74 -28.219  10.149  -7.275
    8    HD3  LYS  74           HD3      LYS  74 -29.620  11.168  -6.941
    9    HE2  LYS  74           HE2      LYS  74 -28.361  13.156  -7.369
   10    HE3  LYS  74           HE3      LYS  74 -26.856  12.241  -7.474
   11    HZ2  LYS  74           HZ1      LYS  74 -28.323  12.888  -9.589
   12    HZ1  LYS  74           HZ2      LYS  74 -29.004  11.375  -9.228
   13    HZ3  LYS  74           HZ3      LYS  74 -27.338  11.508  -9.529

  No H/Q in entry =          13
  In of MODEL   27
    1    HA   PRO  75           HA       PRO  75 -32.317   7.315  -2.373
    2    HB2  PRO  75           HB2      PRO  75 -32.672   5.117  -3.974
    3    HB3  PRO  75           HB3      PRO  75 -33.773   6.492  -4.028
    4    HG2  PRO  75           HG2      PRO  75 -31.454   5.870  -5.812
    5    HG3  PRO  75           HG3      PRO  75 -33.094   6.340  -6.249
    6    HD2  PRO  75           HD2      PRO  75 -31.120   8.170  -6.196
    7    HD3  PRO  75           HD3      PRO  75 -32.743   8.593  -5.649

  No H/Q in entry =           7
  In of MODEL   27
    1    H    VAL  76           H        VAL  76 -30.878   6.221  -1.015
    2    HA   VAL  76           HA       VAL  76 -28.440   4.978  -2.141
    3    HB   VAL  76           HB       VAL  76 -28.692   6.425   0.530
    4   HG11  VAL  76          HG11      VAL  76 -26.364   5.108  -0.881
    5   HG13  VAL  76          HG12      VAL  76 -27.064   4.657   0.676
    6   HG12  VAL  76          HG13      VAL  76 -26.190   6.180   0.510
    7   HG22  VAL  76          HG21      VAL  76 -27.993   8.322  -0.342
    8   HG21  VAL  76          HG22      VAL  76 -28.553   7.650  -1.874
    9   HG23  VAL  76          HG23      VAL  76 -26.852   7.527  -1.426

  No H/Q in entry =           9
  In of MODEL   27
    1    H    GLU  77           H        GLU  77 -28.260   2.815  -1.548
    2    HA   GLU  77           HA       GLU  77 -29.052   2.019   1.101
    3    HB2  GLU  77           HB2      GLU  77 -30.690   0.405   0.562
    4    HB3  GLU  77           HB3      GLU  77 -31.214   1.944  -0.125
    5    HG2  GLU  77           HG2      GLU  77 -30.626   1.194  -2.321
    6    HG3  GLU  77           HG3      GLU  77 -30.008  -0.319  -1.663

  No H/Q in entry =           6
  In of MODEL   27
    1    H    VAL  78           H        VAL  78 -28.760  -0.079   1.742
    2    HA   VAL  78           HA       VAL  78 -26.111  -0.891   0.839
    3    HB   VAL  78           HB       VAL  78 -27.827  -1.765   3.202
    4   HG11  VAL  78          HG11      VAL  78 -25.513  -3.025   2.059
    5   HG13  VAL  78          HG12      VAL  78 -26.424  -3.492   3.496
    6   HG12  VAL  78          HG13      VAL  78 -25.084  -2.356   3.632
    7   HG22  VAL  78          HG21      VAL  78 -26.340  -0.440   4.547
    8   HG21  VAL  78          HG22      VAL  78 -27.062   0.554   3.282
    9   HG23  VAL  78          HG23      VAL  78 -25.396  -0.002   3.123

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ILE  79           H        ILE  79 -25.610  -2.800  -0.085
    2    HA   ILE  79           HA       ILE  79 -27.701  -4.230  -1.439
    3    HB   ILE  79           HB       ILE  79 -24.719  -4.811  -1.231
    4   HG12  ILE  79          HG12      ILE  79 -26.343  -3.658  -3.506
    5   HG13  ILE  79          HG13      ILE  79 -25.448  -2.674  -2.346
    6   HG22  ILE  79          HG21      ILE  79 -25.849  -5.951  -3.557
    7   HG21  ILE  79          HG22      ILE  79 -26.839  -6.466  -2.191
    8   HG23  ILE  79          HG23      ILE  79 -25.102  -6.776  -2.188
    9   HD13  ILE  79          HD11      ILE  79 -24.042  -2.797  -4.170
   10   HD12  ILE  79          HD12      ILE  79 -24.412  -4.497  -4.465
   11   HD11  ILE  79          HD13      ILE  79 -23.416  -4.037  -3.083

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ASP  80           H        ASP  80 -28.597  -6.143  -0.869
    2    HA   ASP  80           HA       ASP  80 -28.552  -7.065   1.769
    3    HB2  ASP  80           HB2      ASP  80 -30.320  -7.597   0.131
    4    HB3  ASP  80           HB3      ASP  80 -29.183  -8.617  -0.751

  No H/Q in entry =           4
  In of MODEL   27
    1    H    SER  81           H        SER  81 -27.033  -8.237   2.885
    2    HA   SER  81           HA       SER  81 -24.553  -8.953   1.680
    3    HB2  SER  81           HB2      SER  81 -24.005  -9.998   3.837
    4    HB3  SER  81           HB3      SER  81 -24.697  -8.394   4.071
    5    HG   SER  81           HG       SER  81 -26.107 -10.833   4.251

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU  82           H        LEU  82 -27.299 -10.999   1.992
    2    HA   LEU  82           HA       LEU  82 -25.794 -13.390   1.447
    3    HB2  LEU  82           HB2      LEU  82 -28.719 -12.715   1.216
    4    HB3  LEU  82           HB3      LEU  82 -28.050 -14.328   0.973
    5    HG   LEU  82           HG       LEU  82 -27.924 -12.798   3.553
    6   HD13  LEU  82          HD11      LEU  82 -30.233 -13.394   2.971
    7   HD12  LEU  82          HD12      LEU  82 -29.647 -14.401   4.296
    8   HD11  LEU  82          HD13      LEU  82 -29.732 -15.058   2.662
    9   HD22  LEU  82          HD21      LEU  82 -26.131 -14.304   3.495
   10   HD21  LEU  82          HD22      LEU  82 -27.049 -15.500   2.582
   11   HD23  LEU  82          HD23      LEU  82 -27.407 -15.229   4.288

  No H/Q in entry =          11
  In of MODEL   27
    1    H    LEU  83           H        LEU  83 -27.719 -11.114  -0.447
    2    HA   LEU  83           HA       LEU  83 -27.549 -12.455  -2.929
    3    HB2  LEU  83           HB2      LEU  83 -27.907  -9.546  -2.257
    4    HB3  LEU  83           HB3      LEU  83 -27.955 -10.177  -3.902
    5    HG   LEU  83           HG       LEU  83 -29.988 -10.545  -1.722
    6   HD13  LEU  83          HD11      LEU  83 -30.715  -8.677  -2.769
    7   HD12  LEU  83          HD12      LEU  83 -31.201  -9.771  -4.062
    8   HD11  LEU  83          HD13      LEU  83 -29.652  -8.932  -4.152
    9   HD23  LEU  83          HD21      LEU  83 -30.158 -11.779  -4.457
   10   HD22  LEU  83          HD22      LEU  83 -31.129 -12.123  -3.027
   11   HD21  LEU  83          HD23      LEU  83 -29.450 -12.656  -3.101

  No H/Q in entry =          11
  In of MODEL   27
    1    H    TYR  84           H        TYR  84 -25.549 -10.119  -1.240
    2    HA   TYR  84           HA       TYR  84 -23.685  -9.647  -3.373
    3    HB2  TYR  84           HB2      TYR  84 -24.182  -8.184  -1.314
    4    HB3  TYR  84           HB3      TYR  84 -23.139  -9.297  -0.431
    5    HD1  TYR  84           HD1      TYR  84 -20.791  -9.087  -0.512
    6    HD2  TYR  84           HD2      TYR  84 -23.201  -6.907  -3.284
    7    HE1  TYR  84           HE1      TYR  84 -18.788  -7.847  -1.259
    8    HE2  TYR  84           HE2      TYR  84 -21.205  -5.667  -4.047
    9    HH   TYR  84           HH       TYR  84 -18.240  -5.767  -2.317

  No H/Q in entry =           9
  In of MODEL   27
    1    H    GLY  85           H        GLY  85 -23.472 -11.677  -0.443
    2    HA3  GLY  85           HA2      GLY  85 -20.912 -12.663  -0.942
    3    HA2  GLY  85           HA3      GLY  85 -22.155 -13.494  -0.008

  No H/Q in entry =           3
  In of MODEL   27
    1    H    LYS  86           H        LYS  86 -24.015 -13.818  -2.065
    2    HA   LYS  86           HA       LYS  86 -23.008 -16.200  -3.346
    3    HB2  LYS  86           HB2      LYS  86 -25.261 -15.958  -2.356
    4    HB3  LYS  86           HB3      LYS  86 -25.635 -14.729  -3.562
    5    HG2  LYS  86           HG2      LYS  86 -25.457 -16.405  -5.311
    6    HG3  LYS  86           HG3      LYS  86 -25.118 -17.630  -4.088
    7    HD2  LYS  86           HD2      LYS  86 -27.544 -15.857  -3.937
    8    HD3  LYS  86           HD3      LYS  86 -27.559 -17.373  -4.836
    9    HE2  LYS  86           HE2      LYS  86 -26.704 -18.452  -2.684
   10    HE3  LYS  86           HE3      LYS  86 -27.170 -16.949  -1.890
   11    HZ3  LYS  86           HZ1      LYS  86 -29.107 -18.104  -1.714
   12    HZ2  LYS  86           HZ2      LYS  86 -28.853 -18.996  -3.137
   13    HZ1  LYS  86           HZ3      LYS  86 -29.375 -17.383  -3.229

  No H/Q in entry =          13
  In of MODEL   27
    1    H    VAL  87           H        VAL  87 -22.942 -12.978  -4.215
    2    HA   VAL  87           HA       VAL  87 -22.628 -11.795  -6.147
    3    HB   VAL  87           HB       VAL  87 -21.602 -14.331  -7.465
    4   HG12  VAL  87          HG11      VAL  87 -20.445 -11.548  -7.585
    5   HG11  VAL  87          HG12      VAL  87 -21.806 -12.010  -8.610
    6   HG13  VAL  87          HG13      VAL  87 -20.270 -12.863  -8.747
    7   HG21  VAL  87          HG21      VAL  87 -20.303 -12.751  -5.276
    8   HG23  VAL  87          HG22      VAL  87 -19.348 -13.621  -6.474
    9   HG22  VAL  87          HG23      VAL  87 -20.470 -14.498  -5.435

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ASP  88           H        ASP  88 -25.154 -12.395  -5.792
    2    HA   ASP  88           HA       ASP  88 -26.305 -13.574  -8.195
    3    HB2  ASP  88           HB2      ASP  88 -27.297 -13.819  -5.869
    4    HB3  ASP  88           HB3      ASP  88 -27.720 -12.109  -5.953

  No H/Q in entry =           4
  In of MODEL   27
    1    H    GLY  89           H        GLY  89 -25.584 -12.316  -9.829
    2    HA3  GLY  89           HA2      GLY  89 -25.719  -9.538 -10.008
    3    HA2  GLY  89           HA3      GLY  89 -25.719 -10.649 -11.376

  No H/Q in entry =           3
  In of MODEL   27
    1    H    LEU  90           H        LEU  90 -28.187 -11.962 -10.930
    2    HA   LEU  90           HA       LEU  90 -29.968  -9.988 -12.022
    3    HB2  LEU  90           HB2      LEU  90 -30.076 -12.378 -12.620
    4    HB3  LEU  90           HB3      LEU  90 -30.582 -12.748 -10.972
    5    HG   LEU  90           HG       LEU  90 -32.683 -11.592 -11.318
    6   HD13  LEU  90          HD11      LEU  90 -32.479  -9.843 -12.780
    7   HD12  LEU  90          HD12      LEU  90 -33.044 -11.062 -13.925
    8   HD11  LEU  90          HD13      LEU  90 -31.323 -10.698 -13.804
    9   HD23  LEU  90          HD21      LEU  90 -32.650 -13.204 -13.766
   10   HD22  LEU  90          HD22      LEU  90 -33.626 -13.364 -12.306
   11   HD21  LEU  90          HD23      LEU  90 -31.984 -14.003 -12.343

  No H/Q in entry =          11
  In of MODEL   27
    1    H    GLY  91           H        GLY  91 -29.813 -11.516  -8.850
    2    HA3  GLY  91           HA2      GLY  91 -32.129 -10.372  -7.793
    3    HA2  GLY  91           HA3      GLY  91 -30.743 -10.936  -6.860

  No H/Q in entry =           3
  In of MODEL   27
    1    H    VAL  92           H        VAL  92 -28.797  -9.135  -7.709
    2    HA   VAL  92           HA       VAL  92 -29.543  -6.833  -6.140
    3    HB   VAL  92           HB       VAL  92 -27.011  -7.334  -7.749
    4   HG12  VAL  92          HG11      VAL  92 -27.136  -5.463  -5.408
    5   HG11  VAL  92          HG12      VAL  92 -27.798  -4.896  -6.943
    6   HG13  VAL  92          HG13      VAL  92 -26.109  -5.394  -6.841
    7   HG22  VAL  92          HG21      VAL  92 -26.810  -8.937  -6.169
    8   HG21  VAL  92          HG22      VAL  92 -27.937  -8.145  -5.067
    9   HG23  VAL  92          HG23      VAL  92 -26.274  -7.571  -5.190

  No H/Q in entry =           9
  In of MODEL   27
    1    H    LEU  93           H        LEU  93 -29.161  -7.475  -9.567
    2    HA   LEU  93           HA       LEU  93 -29.465  -4.827 -10.475
    3    HB2  LEU  93           HB2      LEU  93 -28.861  -6.681 -11.954
    4    HB3  LEU  93           HB3      LEU  93 -30.464  -7.384 -11.729
    5    HG   LEU  93           HG       LEU  93 -31.446  -5.396 -12.835
    6   HD11  LEU  93          HD11      LEU  93 -29.567  -3.835 -12.326
    7   HD13  LEU  93          HD12      LEU  93 -30.013  -3.845 -14.034
    8   HD12  LEU  93          HD13      LEU  93 -28.574  -4.708 -13.494
    9   HD23  LEU  93          HD21      LEU  93 -30.426  -5.962 -15.130
   10   HD22  LEU  93          HD22      LEU  93 -31.286  -7.212 -14.230
   11   HD21  LEU  93          HD23      LEU  93 -29.521  -7.185 -14.240

  No H/Q in entry =          11
  In of MODEL   27
    1    H    LYS  94           H        LYS  94 -31.880  -7.340  -9.635
    2    HA   LYS  94           HA       LYS  94 -34.202  -5.854 -10.239
    3    HB2  LYS  94           HB2      LYS  94 -33.716  -8.063  -8.246
    4    HB3  LYS  94           HB3      LYS  94 -35.304  -7.339  -8.503
    5    HG2  LYS  94           HG2      LYS  94 -35.239  -8.098 -10.843
    6    HG3  LYS  94           HG3      LYS  94 -33.690  -8.878 -10.526
    7    HD2  LYS  94           HD2      LYS  94 -34.825 -10.206  -8.707
    8    HD3  LYS  94           HD3      LYS  94 -36.360  -9.529  -9.251
    9    HE2  LYS  94           HE2      LYS  94 -35.868 -10.449 -11.527
   10    HE3  LYS  94           HE3      LYS  94 -34.465 -11.261 -10.835
   11    HZ3  LYS  94           HZ1      LYS  94 -36.340 -12.750 -11.008
   12    HZ2  LYS  94           HZ2      LYS  94 -37.293 -11.715 -10.055
   13    HZ1  LYS  94           HZ3      LYS  94 -35.943 -12.491  -9.378

  No H/Q in entry =          13
  In of MODEL   27
    1    H    ALA  95           H        ALA  95 -32.368  -6.029  -7.199
    2    HA   ALA  95           HA       ALA  95 -34.185  -4.429  -5.700
    3    HB2  ALA  95           HB1      ALA  95 -31.831  -5.848  -5.184
    4    HB3  ALA  95           HB2      ALA  95 -32.789  -4.936  -4.019
    5    HB1  ALA  95           HB3      ALA  95 -31.432  -4.165  -4.840

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA  96           H        ALA  96 -31.538  -3.605  -7.802
    2    HA   ALA  96           HA       ALA  96 -31.391  -0.851  -7.007
    3    HB2  ALA  96           HB1      ALA  96 -30.034  -0.632  -9.120
    4    HB3  ALA  96           HB2      ALA  96 -30.368  -2.331  -9.451
    5    HB1  ALA  96           HB3      ALA  96 -29.440  -1.877  -8.023

  No H/Q in entry =           5
  In of MODEL   27
    1    H    VAL  97           H        VAL  97 -32.963  -2.518  -9.700
    2    HA   VAL  97           HA       VAL  97 -33.999  -0.190 -10.933
    3    HB   VAL  97           HB       VAL  97 -34.859  -3.100 -10.996
    4   HG11  VAL  97          HG11      VAL  97 -36.618  -1.060 -11.457
    5   HG13  VAL  97          HG12      VAL  97 -36.709  -2.644 -12.226
    6   HG12  VAL  97          HG13      VAL  97 -35.934  -1.301 -13.066
    7   HG21  VAL  97          HG21      VAL  97 -33.557  -1.279 -13.021
    8   HG23  VAL  97          HG22      VAL  97 -34.040  -2.949 -13.322
    9   HG22  VAL  97          HG23      VAL  97 -32.780  -2.593 -12.139

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ALA  98           H        ALA  98 -35.209  -2.368  -8.409
    2    HA   ALA  98           HA       ALA  98 -37.747  -1.175  -8.038
    3    HB1  ALA  98           HB1      ALA  98 -36.770  -3.400  -7.026
    4    HB3  ALA  98           HB2      ALA  98 -37.929  -2.463  -6.083
    5    HB2  ALA  98           HB3      ALA  98 -36.204  -2.348  -5.730

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA  99           H        ALA  99 -34.647  -0.447  -6.398
    2    HA   ALA  99           HA       ALA  99 -35.732   1.544  -4.715
    3    HB1  ALA  99           HB1      ALA  99 -33.104   0.611  -5.481
    4    HB2  ALA  99           HB2      ALA  99 -33.633   1.359  -3.974
    5    HB3  ALA  99           HB3      ALA  99 -33.145   2.368  -5.335

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ILE 100           H        ILE 100 -34.704   1.683  -8.074
    2    HA   ILE 100           HA       ILE 100 -34.828   4.536  -8.268
    3    HB   ILE 100           HB       ILE 100 -34.975   2.401 -10.425
    4   HG12  ILE 100          HG12      ILE 100 -32.770   4.346  -9.747
    5   HG13  ILE 100          HG13      ILE 100 -32.835   2.695  -9.130
    6   HG21  ILE 100          HG21      ILE 100 -35.342   5.330 -10.529
    7   HG23  ILE 100          HG22      ILE 100 -35.876   4.081 -11.654
    8   HG22  ILE 100          HG23      ILE 100 -34.212   4.665 -11.710
    9   HD12  ILE 100          HD11      ILE 100 -32.297   3.665 -11.899
   10   HD11  ILE 100          HD12      ILE 100 -32.988   2.060 -11.655
   11   HD13  ILE 100          HD13      ILE 100 -31.430   2.468 -10.937

  No H/Q in entry =          11
  In of MODEL   27
    1    H    LYS 101           H        LYS 101 -37.175   1.978  -9.007
    2    HA   LYS 101           HA       LYS 101 -39.228   3.676  -9.983
    3    HB2  LYS 101           HB2      LYS 101 -39.162   0.890  -8.880
    4    HB3  LYS 101           HB3      LYS 101 -40.701   1.686  -9.212
    5    HG2  LYS 101           HG2      LYS 101 -40.233   1.830 -11.510
    6    HG3  LYS 101           HG3      LYS 101 -38.545   1.390 -11.266
    7    HD2  LYS 101           HD2      LYS 101 -39.836  -0.486 -12.163
    8    HD3  LYS 101           HD3      LYS 101 -39.208  -0.842 -10.554
    9    HE2  LYS 101           HE2      LYS 101 -41.282  -1.500 -10.045
   10    HE3  LYS 101           HE3      LYS 101 -41.705   0.212 -10.031
   11    HZ3  LYS 101           HZ1      LYS 101 -42.609   0.091 -12.146
   12    HZ2  LYS 101           HZ2      LYS 101 -43.095  -1.379 -11.448
   13    HZ1  LYS 101           HZ3      LYS 101 -41.793  -1.347 -12.538

  No H/Q in entry =          13
  In of MODEL   27
    1    H    LYS 102           H        LYS 102 -38.752   2.161  -6.789
    2    HA   LYS 102           HA       LYS 102 -40.971   3.390  -5.572
    3    HB2  LYS 102           HB2      LYS 102 -39.768   1.490  -4.578
    4    HB3  LYS 102           HB3      LYS 102 -38.355   2.516  -4.331
    5    HG2  LYS 102           HG2      LYS 102 -39.637   3.923  -2.817
    6    HG3  LYS 102           HG3      LYS 102 -41.053   2.902  -3.065
    7    HD2  LYS 102           HD2      LYS 102 -39.860   1.003  -2.061
    8    HD3  LYS 102           HD3      LYS 102 -38.445   2.026  -1.810
    9    HE2  LYS 102           HE2      LYS 102 -39.764   3.517  -0.383
   10    HE3  LYS 102           HE3      LYS 102 -41.196   2.525  -0.654
   11    HZ1  LYS 102           HZ1      LYS 102 -39.506   0.728   0.326
   12    HZ3  LYS 102           HZ2      LYS 102 -40.596   1.627   1.268
   13    HZ2  LYS 102           HZ3      LYS 102 -38.976   2.121   1.140

  No H/Q in entry =          13
  In of MODEL   27
    1    H    ALA 103           H        ALA 103 -37.994   4.732  -6.584
    2    HA   ALA 103           HA       ALA 103 -38.164   7.034  -4.780
    3    HB2  ALA 103           HB1      ALA 103 -36.165   7.744  -6.357
    4    HB3  ALA 103           HB2      ALA 103 -36.165   6.029  -6.771
    5    HB1  ALA 103           HB3      ALA 103 -35.921   6.533  -5.100

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA 104           H        ALA 104 -38.812   6.346  -8.130
    2    HA   ALA 104           HA       ALA 104 -39.345   9.147  -8.725
    3    HB2  ALA 104           HB1      ALA 104 -39.410   8.501 -10.933
    4    HB1  ALA 104           HB2      ALA 104 -40.166   6.949 -10.567
    5    HB3  ALA 104           HB3      ALA 104 -38.438   7.176 -10.292

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA 105           H        ALA 105 -40.988   7.058  -6.933
    2    HA   ALA 105           HA       ALA 105 -43.384   8.499  -6.884
    3    HB2  ALA 105           HB1      ALA 105 -44.153   7.673  -8.927
    4    HB3  ALA 105           HB2      ALA 105 -44.809   6.486  -7.799
    5    HB1  ALA 105           HB3      ALA 105 -43.349   6.118  -8.716

  No H/Q in entry =           5
  In of MODEL   28
    1    H1   ALA   1           H3       ALA   1 -12.108 -15.972  -2.373
    2    H2   ALA   1           H2       ALA   1 -11.154 -17.109  -3.206
    3    H3   ALA   1           H1       ALA   1 -12.304 -16.179  -4.047
    4    HA   ALA   1           HA       ALA   1 -13.687 -17.891  -3.803
    5    HB3  ALA   1           HB1      ALA   1 -12.277 -19.648  -3.329
    6    HB1  ALA   1           HB2      ALA   1 -13.038 -19.535  -1.743
    7    HB2  ALA   1           HB3      ALA   1 -11.469 -18.781  -2.023

  No H/Q in entry =           7
  In of MODEL   28
    1    H    GLU   2           H        GLU   2 -15.307 -18.753  -2.150
    2    HA   GLU   2           HA       GLU   2 -16.974 -17.043  -1.104
    3    HB2  GLU   2           HB2      GLU   2 -16.017 -19.453   0.455
    4    HB3  GLU   2           HB3      GLU   2 -17.550 -18.616   0.701
    5    HG2  GLU   2           HG2      GLU   2 -18.514 -19.719  -1.032
    6    HG3  GLU   2           HG3      GLU   2 -17.192 -19.311  -2.114

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLU   3           H        GLU   3 -15.057 -18.367   1.531
    2    HA   GLU   3           HA       GLU   3 -15.305 -16.009   3.077
    3    HB2  GLU   3           HB2      GLU   3 -13.697 -18.539   3.344
    4    HB3  GLU   3           HB3      GLU   3 -13.481 -17.213   4.485
    5    HG2  GLU   3           HG2      GLU   3 -15.675 -17.380   5.298
    6    HG3  GLU   3           HG3      GLU   3 -16.259 -18.192   3.851

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LEU   4           H        LEU   4 -12.333 -17.466   1.701
    2    HA   LEU   4           HA       LEU   4 -10.518 -15.544   2.296
    3    HB2  LEU   4           HB2      LEU   4 -10.728 -16.856  -0.423
    4    HB3  LEU   4           HB3      LEU   4  -9.285 -16.119   0.263
    5    HG   LEU   4           HG       LEU   4 -10.760 -18.525   1.382
    6   HD13  LEU   4          HD11      LEU   4  -9.113 -19.869   0.464
    7   HD12  LEU   4          HD12      LEU   4  -7.915 -18.576   0.435
    8   HD11  LEU   4          HD13      LEU   4  -9.199 -18.615  -0.772
    9   HD23  LEU   4          HD21      LEU   4  -8.513 -18.561   2.771
   10   HD22  LEU   4          HD22      LEU   4  -9.845 -17.531   3.291
   11   HD21  LEU   4          HD23      LEU   4  -8.486 -16.834   2.410

  No H/Q in entry =          11
  In of MODEL   28
    1    H    GLU   5           H        GLU   5 -12.846 -15.370  -0.386
    2    HA   GLU   5           HA       GLU   5 -11.862 -12.882  -1.394
    3    HB2  GLU   5           HB2      GLU   5 -13.196 -14.497  -2.745
    4    HB3  GLU   5           HB3      GLU   5 -14.602 -14.118  -1.750
    5    HG2  GLU   5           HG2      GLU   5 -14.748 -12.749  -3.721
    6    HG3  GLU   5           HG3      GLU   5 -14.285 -11.694  -2.387

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLU   6           H        GLU   6 -14.586 -13.775   0.693
    2    HA   GLU   6           HA       GLU   6 -15.515 -11.105   1.078
    3    HB2  GLU   6           HB2      GLU   6 -16.920 -13.115   1.481
    4    HB3  GLU   6           HB3      GLU   6 -15.893 -13.533   2.851
    5    HG2  GLU   6           HG2      GLU   6 -16.457 -11.413   3.950
    6    HG3  GLU   6           HG3      GLU   6 -17.449 -10.946   2.570

  No H/Q in entry =           6
  In of MODEL   28
    1    H    VAL   7           H        VAL   7 -13.194 -13.188   2.666
    2    HA   VAL   7           HA       VAL   7 -12.749 -11.598   4.988
    3    HB   VAL   7           HB       VAL   7 -11.023 -13.633   3.553
    4   HG11  VAL   7          HG11      VAL   7 -10.576 -12.085   6.111
    5   HG13  VAL   7          HG12      VAL   7  -9.470 -12.295   4.755
    6   HG12  VAL   7          HG13      VAL   7  -9.815 -13.650   5.830
    7   HG21  VAL   7          HG21      VAL   7 -13.272 -14.212   4.768
    8   HG23  VAL   7          HG22      VAL   7 -12.352 -13.923   6.245
    9   HG22  VAL   7          HG23      VAL   7 -11.844 -15.184   5.123

  No H/Q in entry =           9
  In of MODEL   28
    1    H    VAL   8           H        VAL   8 -11.227 -11.714   1.783
    2    HA   VAL   8           HA       VAL   8  -9.182  -9.820   2.274
    3    HB   VAL   8           HB       VAL   8 -10.630 -10.542  -0.284
    4   HG13  VAL   8          HG11      VAL   8  -9.721  -8.388  -0.688
    5   HG12  VAL   8          HG12      VAL   8  -8.500  -9.501  -1.308
    6   HG11  VAL   8          HG13      VAL   8  -8.275  -8.732   0.263
    7   HG23  VAL   8          HG21      VAL   8  -7.778 -11.264   0.146
    8   HG22  VAL   8          HG22      VAL   8  -9.090 -12.229  -0.521
    9   HG21  VAL   8          HG23      VAL   8  -8.909 -12.084   1.224

  No H/Q in entry =           9
  In of MODEL   28
    1    H    MET   9           H        MET   9 -12.527  -9.466   1.101
    2    HA   MET   9           HA       MET   9 -12.488  -6.691   0.654
    3    HB2  MET   9           HB2      MET   9 -14.685  -8.587   1.479
    4    HB3  MET   9           HB3      MET   9 -14.983  -6.861   1.266
    5    HG2  MET   9           HG2      MET   9 -14.206  -6.966  -1.042
    6    HG3  MET   9           HG3      MET   9 -13.764  -8.663  -0.843
    7    HE1  MET   9           HE1      MET   9 -16.341  -6.016  -0.624
    8    HE3  MET   9           HE2      MET   9 -17.169  -6.923   0.638
    9    HE2  MET   9           HE3      MET   9 -17.912  -6.762  -0.951

  No H/Q in entry =           9
  In of MODEL   28
    1    H    GLY  10           H        GLY  10 -13.143  -8.575   3.588
    2    HA3  GLY  10           HA2      GLY  10 -13.716  -6.387   5.295
    3    HA2  GLY  10           HA3      GLY  10 -13.139  -7.968   5.818

  No H/Q in entry =           3
  In of MODEL   28
    1    H    LEU  11           H        LEU  11 -10.688  -8.076   4.511
    2    HA   LEU  11           HA       LEU  11  -9.007  -6.619   6.267
    3    HB2  LEU  11           HB2      LEU  11  -8.439  -8.049   3.668
    4    HB3  LEU  11           HB3      LEU  11  -7.178  -7.328   4.667
    5    HG   LEU  11           HG       LEU  11  -9.164  -9.375   5.687
    6   HD13  LEU  11          HD11      LEU  11  -7.926 -10.607   4.132
    7   HD12  LEU  11          HD12      LEU  11  -6.994 -10.830   5.611
    8   HD11  LEU  11          HD13      LEU  11  -6.460  -9.666   4.400
    9   HD22  LEU  11          HD21      LEU  11  -8.327  -8.345   7.602
   10   HD21  LEU  11          HD22      LEU  11  -6.791  -7.933   6.842
   11   HD23  LEU  11          HD23      LEU  11  -7.102  -9.590   7.358

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  12           H        ILE  12  -9.903  -6.096   2.872
    2    HA   ILE  12           HA       ILE  12  -8.231  -3.851   2.440
    3    HB   ILE  12           HB       ILE  12 -10.875  -4.554   1.139
    4   HG12  ILE  12          HG12      ILE  12  -8.822  -6.186   1.080
    5   HG13  ILE  12          HG13      ILE  12  -9.682  -5.844  -0.408
    6   HG23  ILE  12          HG21      ILE  12 -10.316  -2.224   0.698
    7   HG22  ILE  12          HG22      ILE  12  -9.964  -3.153  -0.754
    8   HG21  ILE  12          HG23      ILE  12  -8.680  -2.667   0.315
    9   HD13  ILE  12          HD11      ILE  12  -7.971  -4.276  -1.081
   10   HD12  ILE  12          HD12      ILE  12  -7.175  -5.771  -0.596
   11   HD11  ILE  12          HD13      ILE  12  -7.184  -4.395   0.482

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  13           H        ILE  13 -11.593  -4.147   3.524
    2    HA   ILE  13           HA       ILE  13 -12.082  -1.363   3.779
    3    HB   ILE  13           HB       ILE  13 -13.267  -3.791   5.145
    4   HG12  ILE  13          HG12      ILE  13 -13.489  -3.242   2.604
    5   HG13  ILE  13          HG13      ILE  13 -14.908  -3.732   3.506
    6   HG21  ILE  13          HG21      ILE  13 -13.986  -0.871   5.414
    7   HG23  ILE  13          HG22      ILE  13 -13.749  -2.052   6.694
    8   HG22  ILE  13          HG23      ILE  13 -15.188  -2.131   5.680
    9   HD11  ILE  13          HD11      ILE  13 -14.161  -0.832   3.066
   10   HD13  ILE  13          HD12      ILE  13 -15.655  -1.474   3.720
   11   HD12  ILE  13          HD13      ILE  13 -15.276  -1.731   2.031

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ASN  14           H        ASN  14 -10.953  -3.832   6.069
    2    HA   ASN  14           HA       ASN  14 -10.777  -2.181   8.348
    3    HB2  ASN  14           HB2      ASN  14 -10.496  -4.787   8.039
    4    HB3  ASN  14           HB3      ASN  14  -8.791  -4.383   7.886
    5   HD21  ASN  14          HD21      ASN  14  -9.418  -5.904  10.067
    6   HD22  ASN  14          HD22      ASN  14  -9.405  -4.976  11.487

  No H/Q in entry =           6
  In of MODEL   28
    1    H    SER  15           H        SER  15  -8.358  -2.991   5.868
    2    HA   SER  15           HA       SER  15  -6.234  -1.470   6.940
    3    HB2  SER  15           HB2      SER  15  -5.203  -1.686   4.788
    4    HB3  SER  15           HB3      SER  15  -6.145  -3.155   5.015
    5    HG   SER  15           HG       SER  15  -7.424  -2.572   3.450

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLY  16           H        GLY  16  -8.837  -0.642   4.680
    2    HA3  GLY  16           HA2      GLY  16  -8.007   2.005   4.119
    3    HA2  GLY  16           HA3      GLY  16  -9.650   1.391   3.954

  No H/Q in entry =           3
  In of MODEL   28
    1    H    GLN  17           H        GLN  17 -10.194   0.673   6.605
    2    HA   GLN  17           HA       GLN  17 -10.934   3.175   7.732
    3    HB2  GLN  17           HB2      GLN  17 -10.810   0.396   8.918
    4    HB3  GLN  17           HB3      GLN  17 -11.444   1.792   9.791
    5    HG2  GLN  17           HG2      GLN  17 -13.130   2.151   8.055
    6    HG3  GLN  17           HG3      GLN  17 -12.464   0.824   7.105
    7   HE21  GLN  17          HE21      GLN  17 -12.009  -0.461   9.998
    8   HE22  GLN  17          HE22      GLN  17 -13.520  -1.176  10.296

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ALA  18           H        ALA  18  -8.281   0.927   8.371
    2    HA   ALA  18           HA       ALA  18  -7.205   2.166  10.640
    3    HB2  ALA  18           HB1      ALA  18  -6.565  -0.049   9.285
    4    HB3  ALA  18           HB2      ALA  18  -5.415   0.753  10.356
    5    HB1  ALA  18           HB3      ALA  18  -5.335   1.024   8.614

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ARG  19           H        ARG  19  -6.428   2.683   7.191
    2    HA   ARG  19           HA       ARG  19  -4.556   4.754   7.616
    3    HB2  ARG  19           HB2      ARG  19  -4.862   3.599   5.426
    4    HB3  ARG  19           HB3      ARG  19  -6.414   4.420   5.239
    5    HG2  ARG  19           HG2      ARG  19  -5.312   6.606   5.301
    6    HG3  ARG  19           HG3      ARG  19  -3.755   5.841   5.614
    7    HD2  ARG  19           HD2      ARG  19  -3.878   6.418   3.268
    8    HD3  ARG  19           HD3      ARG  19  -3.942   4.658   3.422
    9    HE   ARG  19           HE       ARG  19  -6.587   5.535   3.400
   10   HH21  ARG  19          HH11      ARG  19  -7.777   5.667   1.477
   11   HH22  ARG  19          HH12      ARG  19  -6.951   5.747  -0.040
   12   HH11  ARG  19          HH21      ARG  19  -3.805   5.622   1.376
   13   HH12  ARG  19          HH22      ARG  19  -4.701   5.719  -0.097

  No H/Q in entry =          13
  In of MODEL   28
    1    H    SER  20           H        SER  20  -8.053   4.824   7.003
    2    HA   SER  20           HA       SER  20  -8.445   7.574   6.940
    3    HB2  SER  20           HB2      SER  20 -10.303   6.210   6.404
    4    HB3  SER  20           HB3      SER  20 -10.188   5.322   7.921
    5    HG   SER  20           HG       SER  20 -10.613   7.435   8.929

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU  21           H        LEU  21  -8.427   5.406   9.755
    2    HA   LEU  21           HA       LEU  21  -8.900   7.405  11.708
    3    HB2  LEU  21           HB2      LEU  21  -7.517   4.722  11.885
    4    HB3  LEU  21           HB3      LEU  21  -7.839   5.742  13.284
    5    HG   LEU  21           HG       LEU  21  -9.995   4.810  11.365
    6   HD13  LEU  21          HD11      LEU  21  -9.117   2.829  12.388
    7   HD12  LEU  21          HD12      LEU  21 -10.583   3.239  13.279
    8   HD11  LEU  21          HD13      LEU  21  -9.000   3.616  13.963
    9   HD21  LEU  21          HD21      LEU  21  -9.947   6.328  13.967
   10   HD23  LEU  21          HD22      LEU  21 -11.344   5.323  13.599
   11   HD22  LEU  21          HD23      LEU  21 -10.911   6.645  12.528

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ALA  22           H        ALA  22  -5.925   6.063  10.319
    2    HA   ALA  22           HA       ALA  22  -4.069   7.409  11.941
    3    HB2  ALA  22           HB1      ALA  22  -3.623   5.553  10.261
    4    HB1  ALA  22           HB2      ALA  22  -2.444   6.864  10.294
    5    HB3  ALA  22           HB3      ALA  22  -3.656   6.798   9.013

  No H/Q in entry =           5
  In of MODEL   28
    1    H    TYR  23           H        TYR  23  -5.387   8.393   8.748
    2    HA   TYR  23           HA       TYR  23  -4.084  10.906   8.671
    3    HB2  TYR  23           HB2      TYR  23  -5.145   9.970   6.680
    4    HB3  TYR  23           HB3      TYR  23  -6.728  10.061   7.454
    5    HD1  TYR  23           HD1      TYR  23  -3.845  12.138   6.312
    6    HD2  TYR  23           HD2      TYR  23  -7.995  12.052   7.411
    7    HE1  TYR  23           HE1      TYR  23  -4.096  14.481   5.539
    8    HE2  TYR  23           HE2      TYR  23  -8.249  14.395   6.637
    9    HH   TYR  23           HH       TYR  23  -6.311  16.463   6.377

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ALA  24           H        ALA  24  -7.195   9.894  10.043
    2    HA   ALA  24           HA       ALA  24  -8.069  12.477  10.798
    3    HB1  ALA  24           HB1      ALA  24  -9.873  11.204  11.265
    4    HB2  ALA  24           HB2      ALA  24  -9.045  10.651  12.719
    5    HB3  ALA  24           HB3      ALA  24  -8.902   9.733  11.220

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA  25           H        ALA  25  -6.041  10.053  12.392
    2    HA   ALA  25           HA       ALA  25  -5.729  11.322  14.889
    3    HB2  ALA  25           HB1      ALA  25  -4.928   8.977  14.083
    4    HB3  ALA  25           HB2      ALA  25  -3.929   9.854  15.243
    5    HB1  ALA  25           HB3      ALA  25  -3.486   9.834  13.536

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU  26           H        LEU  26  -3.931  11.630  11.854
    2    HA   LEU  26           HA       LEU  26  -2.000  13.480  12.769
    3    HB2  LEU  26           HB2      LEU  26  -1.675  12.322  10.672
    4    HB3  LEU  26           HB3      LEU  26  -3.155  13.007  10.008
    5    HG   LEU  26           HG       LEU  26  -2.170  15.271  10.136
    6   HD12  LEU  26          HD11      LEU  26   0.366  15.326  10.560
    7   HD11  LEU  26          HD12      LEU  26   0.160  13.747  11.311
    8   HD13  LEU  26          HD13      LEU  26  -0.668  15.154  11.977
    9   HD21  LEU  26          HD21      LEU  26  -0.395  13.233   8.758
   10   HD23  LEU  26          HD22      LEU  26  -0.459  14.951   8.379
   11   HD22  LEU  26          HD23      LEU  26  -1.868  13.934   8.090

  No H/Q in entry =          11
  In of MODEL   28
    1    H    LYS  27           H        LYS  27  -5.182  13.914  11.277
    2    HA   LYS  27           HA       LYS  27  -5.162  16.702  11.065
    3    HB2  LYS  27           HB2      LYS  27  -6.883  15.197  10.080
    4    HB3  LYS  27           HB3      LYS  27  -7.543  14.941  11.695
    5    HG2  LYS  27           HG2      LYS  27  -8.004  17.342  11.917
    6    HG3  LYS  27           HG3      LYS  27  -7.294  17.640  10.327
    7    HD2  LYS  27           HD2      LYS  27  -9.003  16.179   9.291
    8    HD3  LYS  27           HD3      LYS  27  -9.720  15.898  10.880
    9    HE2  LYS  27           HE2      LYS  27 -10.194  18.304  11.109
   10    HE3  LYS  27           HE3      LYS  27  -9.450  18.607   9.536
   11    HZ3  LYS  27           HZ1      LYS  27 -11.825  18.451   9.286
   12    HZ2  LYS  27           HZ2      LYS  27 -11.856  16.938  10.063
   13    HZ1  LYS  27           HZ3      LYS  27 -11.108  17.103   8.543

  No H/Q in entry =          13
  In of MODEL   28
    1    H    GLN  28           H        GLN  28  -6.035  14.618  13.799
    2    HA   GLN  28           HA       GLN  28  -6.962  16.620  15.561
    3    HB2  GLN  28           HB2      GLN  28  -5.525  14.013  16.129
    4    HB3  GLN  28           HB3      GLN  28  -6.296  15.012  17.362
    5    HG2  GLN  28           HG2      GLN  28  -7.728  13.887  14.939
    6    HG3  GLN  28           HG3      GLN  28  -7.759  13.150  16.540
    7   HE21  GLN  28          HE21      GLN  28  -8.120  15.265  18.259
    8   HE22  GLN  28          HE22      GLN  28  -9.549  16.104  17.892

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ALA  29           H        ALA  29  -3.725  15.359  14.891
    2    HA   ALA  29           HA       ALA  29  -2.311  16.783  16.867
    3    HB1  ALA  29           HB1      ALA  29  -0.368  16.109  15.759
    4    HB3  ALA  29           HB2      ALA  29  -1.118  16.217  14.166
    5    HB2  ALA  29           HB3      ALA  29  -1.529  14.885  15.246

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LYS  30           H        LYS  30  -3.166  17.636  13.530
    2    HA   LYS  30           HA       LYS  30  -1.782  20.091  13.423
    3    HB2  LYS  30           HB2      LYS  30  -4.298  19.184  12.009
    4    HB3  LYS  30           HB3      LYS  30  -3.479  20.705  11.661
    5    HG2  LYS  30           HG2      LYS  30  -1.394  19.431  11.161
    6    HG3  LYS  30           HG3      LYS  30  -2.286  17.927  11.410
    7    HD2  LYS  30           HD2      LYS  30  -3.850  18.543   9.607
    8    HD3  LYS  30           HD3      LYS  30  -2.981  20.059   9.360
    9    HE2  LYS  30           HE2      LYS  30  -0.934  18.783   8.794
   10    HE3  LYS  30           HE3      LYS  30  -1.822  17.272   9.010
   11    HZ2  LYS  30           HZ1      LYS  30  -1.645  18.134   6.664
   12    HZ1  LYS  30           HZ2      LYS  30  -2.703  19.388   7.123
   13    HZ3  LYS  30           HZ3      LYS  30  -3.212  17.767   7.200

  No H/Q in entry =          13
  In of MODEL   28
    1    H    GLN  31           H        GLN  31  -4.879  19.216  14.828
    2    HA   GLN  31           HA       GLN  31  -5.669  21.968  15.264
    3    HB2  GLN  31           HB2      GLN  31  -6.831  19.517  16.595
    4    HB3  GLN  31           HB3      GLN  31  -7.604  21.081  16.339
    5    HG2  GLN  31           HG2      GLN  31  -6.878  20.298  13.755
    6    HG3  GLN  31           HG3      GLN  31  -7.391  18.792  14.508
    7   HE21  GLN  31          HE21      GLN  31  -8.808  20.344  12.394
    8   HE22  GLN  31          HE22      GLN  31 -10.327  20.725  13.045

  No H/Q in entry =           8
  In of MODEL   28
    1    H    GLY  32           H        GLY  32  -3.345  20.067  16.602
    2    HA3  GLY  32           HA2      GLY  32  -1.954  20.550  18.406
    3    HA2  GLY  32           HA3      GLY  32  -3.096  21.785  18.920

  No H/Q in entry =           3
  In of MODEL   28
    1    H    ASP  33           H        ASP  33  -4.490  18.731  18.268
    2    HA   ASP  33           HA       ASP  33  -4.907  18.283  21.148
    3    HB2  ASP  33           HB2      ASP  33  -6.296  17.248  18.671
    4    HB3  ASP  33           HB3      ASP  33  -6.642  16.642  20.289

  No H/Q in entry =           4
  In of MODEL   28
    1    H    PHE  34           H        PHE  34  -2.732  17.451  21.465
    2    HA   PHE  34           HA       PHE  34  -1.708  15.204  20.078
    3    HB2  PHE  34           HB2      PHE  34  -1.109  16.207  22.870
    4    HB3  PHE  34           HB3      PHE  34  -0.167  14.987  22.011
    5    HD1  PHE  34           HD1      PHE  34  -0.370  18.415  22.730
    6    HD2  PHE  34           HD2      PHE  34   0.493  15.704  19.510
    7    HE1  PHE  34           HE1      PHE  34   0.914  20.192  21.572
    8    HE2  PHE  34           HE2      PHE  34   1.773  17.484  18.357
    9    HZ   PHE  34           HZ       PHE  34   1.985  19.725  19.393

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ALA  35           H        ALA  35  -3.760  15.477  22.933
    2    HA   ALA  35           HA       ALA  35  -3.529  12.821  23.842
    3    HB3  ALA  35           HB1      ALA  35  -5.995  13.430  24.688
    4    HB1  ALA  35           HB2      ALA  35  -5.473  15.051  24.227
    5    HB2  ALA  35           HB3      ALA  35  -4.555  14.140  25.425

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA  36           H        ALA  36  -5.984  14.308  21.727
    2    HA   ALA  36           HA       ALA  36  -7.378  11.883  21.255
    3    HB1  ALA  36           HB1      ALA  36  -8.842  13.289  20.288
    4    HB3  ALA  36           HB2      ALA  36  -7.669  13.714  19.041
    5    HB2  ALA  36           HB3      ALA  36  -7.706  14.608  20.561

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA  37           H        ALA  37  -4.705  13.485  19.588
    2    HA   ALA  37           HA       ALA  37  -4.649  11.840  17.299
    3    HB3  ALA  37           HB1      ALA  37  -2.676  13.574  18.720
    4    HB2  ALA  37           HB2      ALA  37  -3.201  13.619  17.039
    5    HB1  ALA  37           HB3      ALA  37  -2.039  12.400  17.569

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LYS  38           H        LYS  38  -2.900  11.562  20.384
    2    HA   LYS  38           HA       LYS  38  -1.553   9.171  19.910
    3    HB2  LYS  38           HB2      LYS  38  -1.898  10.940  22.046
    4    HB3  LYS  38           HB3      LYS  38  -2.506   9.408  22.667
    5    HG2  LYS  38           HG2      LYS  38  -0.401   8.303  22.143
    6    HG3  LYS  38           HG3      LYS  38   0.198   9.749  21.325
    7    HD2  LYS  38           HD2      LYS  38   0.351  10.978  23.355
    8    HD3  LYS  38           HD3      LYS  38  -0.662   9.823  24.224
    9    HE2  LYS  38           HE2      LYS  38   1.694   9.529  24.852
   10    HE3  LYS  38           HE3      LYS  38   1.104   8.104  23.992
   11    HZ3  LYS  38           HZ1      LYS  38   2.407   8.526  22.213
   12    HZ2  LYS  38           HZ2      LYS  38   3.352   9.367  23.349
   13    HZ1  LYS  38           HZ3      LYS  38   2.268  10.214  22.351

  No H/Q in entry =          13
  In of MODEL   28
    1    H    ALA  39           H        ALA  39  -4.800   9.645  21.299
    2    HA   ALA  39           HA       ALA  39  -5.340   6.923  21.814
    3    HB3  ALA  39           HB1      ALA  39  -7.512   8.846  21.031
    4    HB2  ALA  39           HB2      ALA  39  -6.621   9.087  22.534
    5    HB1  ALA  39           HB3      ALA  39  -7.524   7.594  22.274

  No H/Q in entry =           5
  In of MODEL   28
    1    H    MET  40           H        MET  40  -5.932   8.919  18.957
    2    HA   MET  40           HA       MET  40  -7.387   6.968  17.500
    3    HB2  MET  40           HB2      MET  40  -5.794   9.373  16.590
    4    HB3  MET  40           HB3      MET  40  -6.809   8.401  15.521
    5    HG2  MET  40           HG2      MET  40  -7.862   9.652  18.070
    6    HG3  MET  40           HG3      MET  40  -7.921  10.480  16.516
    7    HE3  MET  40           HE1      MET  40 -10.484   8.830  14.450
    8    HE2  MET  40           HE2      MET  40  -8.732   8.961  14.307
    9    HE1  MET  40           HE3      MET  40  -9.664  10.321  14.932

  No H/Q in entry =           9
  In of MODEL   28
    1    H    MET  41           H        MET  41  -3.903   7.736  17.631
    2    HA   MET  41           HA       MET  41  -3.122   5.980  15.540
    3    HB2  MET  41           HB2      MET  41  -1.520   6.671  18.016
    4    HB3  MET  41           HB3      MET  41  -0.891   6.022  16.505
    5    HG2  MET  41           HG2      MET  41  -2.064   8.190  15.488
    6    HG3  MET  41           HG3      MET  41  -1.838   8.787  17.131
    7    HE2  MET  41           HE1      MET  41   1.097   6.716  17.511
    8    HE1  MET  41           HE2      MET  41   0.294   8.006  18.401
    9    HE3  MET  41           HE3      MET  41   1.917   8.261  17.763

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ASP  42           H        ASP  42  -3.515   5.518  19.027
    2    HA   ASP  42           HA       ASP  42  -2.456   2.934  19.202
    3    HB2  ASP  42           HB2      ASP  42  -3.352   4.693  21.014
    4    HB3  ASP  42           HB3      ASP  42  -4.769   3.655  20.941

  No H/Q in entry =           4
  In of MODEL   28
    1    H    GLN  43           H        GLN  43  -5.798   4.006  18.685
    2    HA   GLN  43           HA       GLN  43  -6.917   1.407  18.498
    3    HB2  GLN  43           HB2      GLN  43  -7.860   4.046  17.354
    4    HB3  GLN  43           HB3      GLN  43  -8.810   2.558  17.335
    5    HG2  GLN  43           HG2      GLN  43  -8.524   2.450  19.844
    6    HG3  GLN  43           HG3      GLN  43  -7.814   4.061  19.768
    7   HE21  GLN  43          HE21      GLN  43  -9.999   4.128  21.261
    8   HE22  GLN  43          HE22      GLN  43 -11.362   4.687  20.422

  No H/Q in entry =           8
  In of MODEL   28
    1    H    SER  44           H        SER  44  -5.589   3.623  16.081
    2    HA   SER  44           HA       SER  44  -6.268   2.123  13.796
    3    HB2  SER  44           HB2      SER  44  -5.035   4.520  14.234
    4    HB3  SER  44           HB3      SER  44  -3.670   3.534  13.713
    5    HG   SER  44           HG       SER  44  -4.785   4.488  11.942

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ARG  45           H        ARG  45  -3.397   2.045  15.887
    2    HA   ARG  45           HA       ARG  45  -1.894   0.098  14.518
    3    HB2  ARG  45           HB2      ARG  45  -1.072   1.535  16.384
    4    HB3  ARG  45           HB3      ARG  45  -2.059   0.600  17.504
    5    HG2  ARG  45           HG2      ARG  45  -0.806  -1.450  16.875
    6    HG3  ARG  45           HG3      ARG  45   0.204  -0.490  15.796
    7    HD2  ARG  45           HD2      ARG  45   0.919   0.905  17.749
    8    HD3  ARG  45           HD3      ARG  45   0.003  -0.173  18.824
    9    HE   ARG  45           HE       ARG  45   1.722  -1.760  17.256
   10   HH21  ARG  45          HH11      ARG  45   3.627  -2.562  18.103
   11   HH22  ARG  45          HH12      ARG  45   4.388  -1.764  19.434
   12   HH11  ARG  45          HH21      ARG  45   1.994   0.719  19.636
   13   HH12  ARG  45          HH22      ARG  45   3.463   0.096  20.299

  No H/Q in entry =          13
  In of MODEL   28
    1    H    MET  46           H        MET  46  -4.298  -0.233  17.111
    2    HA   MET  46           HA       MET  46  -4.106  -3.029  17.430
    3    HB2  MET  46           HB2      MET  46  -6.299  -1.042  18.012
    4    HB3  MET  46           HB3      MET  46  -6.486  -2.763  18.362
    5    HG2  MET  46           HG2      MET  46  -4.471  -2.713  19.767
    6    HG3  MET  46           HG3      MET  46  -4.234  -1.013  19.396
    7    HE1  MET  46           HE1      MET  46  -4.213  -0.101  21.735
    8    HE3  MET  46           HE2      MET  46  -4.203  -1.764  22.315
    9    HE2  MET  46           HE3      MET  46  -5.302  -0.594  23.038

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ALA  47           H        ALA  47  -6.136  -1.039  15.320
    2    HA   ALA  47           HA       ALA  47  -7.732  -3.108  14.256
    3    HB3  ALA  47           HB1      ALA  47  -8.430  -0.878  13.829
    4    HB1  ALA  47           HB2      ALA  47  -7.929  -1.514  12.261
    5    HB2  ALA  47           HB3      ALA  47  -6.862  -0.432  13.158

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU  48           H        LEU  48  -4.621  -1.777  13.212
    2    HA   LEU  48           HA       LEU  48  -4.318  -3.375  10.878
    3    HB2  LEU  48           HB2      LEU  48  -2.278  -2.072  12.689
    4    HB3  LEU  48           HB3      LEU  48  -1.898  -2.796  11.126
    5    HG   LEU  48           HG       LEU  48  -3.940  -0.593  11.499
    6   HD13  LEU  48          HD11      LEU  48  -1.828   0.302  12.169
    7   HD12  LEU  48          HD12      LEU  48  -2.101   0.847  10.514
    8   HD11  LEU  48          HD13      LEU  48  -0.994  -0.489  10.832
    9   HD22  LEU  48          HD21      LEU  48  -4.395  -1.590   9.426
   10   HD21  LEU  48          HD22      LEU  48  -2.708  -2.013   9.138
   11   HD23  LEU  48          HD23      LEU  48  -3.240  -0.338   8.970

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ASN  49           H        ASN  49  -3.282  -3.750  14.230
    2    HA   ASN  49           HA       ASN  49  -1.661  -6.002  13.914
    3    HB2  ASN  49           HB2      ASN  49  -1.706  -4.658  15.957
    4    HB3  ASN  49           HB3      ASN  49  -3.362  -5.156  16.276
    5   HD21  ASN  49          HD21      ASN  49  -2.933  -6.283  18.235
    6   HD22  ASN  49          HD22      ASN  49  -1.981  -7.686  18.301

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLU  50           H        GLU  50  -5.134  -5.750  14.571
    2    HA   GLU  50           HA       GLU  50  -5.627  -8.552  14.689
    3    HB2  GLU  50           HB2      GLU  50  -7.228  -6.873  15.552
    4    HB3  GLU  50           HB3      GLU  50  -7.519  -6.317  13.902
    5    HG2  GLU  50           HG2      GLU  50  -8.366  -8.522  13.269
    6    HG3  GLU  50           HG3      GLU  50  -7.987  -9.157  14.867

  No H/Q in entry =           6
  In of MODEL   28
    1    H    ALA  51           H        ALA  51  -5.701  -6.165  12.083
    2    HA   ALA  51           HA       ALA  51  -6.667  -7.907  10.064
    3    HB2  ALA  51           HB1      ALA  51  -6.454  -6.098   8.689
    4    HB1  ALA  51           HB2      ALA  51  -4.819  -5.736   9.242
    5    HB3  ALA  51           HB3      ALA  51  -6.210  -5.231  10.204

  No H/Q in entry =           5
  In of MODEL   28
    1    H    HIS  52           H        HIS  52  -3.386  -6.975  11.057
    2    HA   HIS  52           HA       HIS  52  -1.970  -8.462   9.119
    3    HB2  HIS  52           HB2      HIS  52  -0.957  -6.714  10.562
    4    HB3  HIS  52           HB3      HIS  52  -1.118  -7.794  11.947
    5    HD1  HIS  52           HD1      HIS  52   0.306 -10.038  11.868
    6    HD2  HIS  52           HD2      HIS  52   1.231  -7.265   8.895
    7    HE1  HIS  52           HE1      HIS  52   2.528 -10.753  10.889
    8    HE2  HIS  52           HE2      HIS  52   3.106  -9.074   9.075

  No H/Q in entry =           8
  In of MODEL   28
    1    H    LEU  53           H        LEU  53  -3.189  -9.335  12.330
    2    HA   LEU  53           HA       LEU  53  -1.977 -11.871  12.539
    3    HB2  LEU  53           HB2      LEU  53  -4.478 -10.705  13.737
    4    HB3  LEU  53           HB3      LEU  53  -4.001 -12.373  14.042
    5    HG   LEU  53           HG       LEU  53  -2.124 -10.034  14.506
    6   HD13  LEU  53          HD11      LEU  53  -4.080  -9.716  15.930
    7   HD12  LEU  53          HD12      LEU  53  -2.727 -10.277  16.911
    8   HD11  LEU  53          HD13      LEU  53  -4.006 -11.396  16.452
    9   HD21  LEU  53          HD21      LEU  53  -2.141 -12.964  15.255
   10   HD23  LEU  53          HD22      LEU  53  -1.222 -11.800  16.201
   11   HD22  LEU  53          HD23      LEU  53  -0.841 -12.043  14.508

  No H/Q in entry =          11
  In of MODEL   28
    1    H    VAL  54           H        VAL  54  -5.089 -10.865  11.160
    2    HA   VAL  54           HA       VAL  54  -5.985 -13.467  10.479
    3    HB   VAL  54           HB       VAL  54  -6.643 -10.742   9.331
    4   HG12  VAL  54          HG11      VAL  54  -8.734 -12.135   8.516
    5   HG11  VAL  54          HG12      VAL  54  -7.615 -13.494   8.598
    6   HG13  VAL  54          HG13      VAL  54  -7.258 -12.121   7.552
    7   HG22  VAL  54          HG21      VAL  54  -7.558 -10.777  11.479
    8   HG21  VAL  54          HG22      VAL  54  -7.802 -12.521  11.466
    9   HG23  VAL  54          HG23      VAL  54  -8.886 -11.474  10.551

  No H/Q in entry =           9
  In of MODEL   28
    1    H    GLN  55           H        GLN  55  -4.120 -11.012   8.688
    2    HA   GLN  55           HA       GLN  55  -3.972 -12.485   6.277
    3    HB2  GLN  55           HB2      GLN  55  -3.379 -10.218   6.081
    4    HB3  GLN  55           HB3      GLN  55  -2.274 -10.284   7.450
    5    HG2  GLN  55           HG2      GLN  55  -0.547 -11.125   6.184
    6    HG3  GLN  55           HG3      GLN  55  -1.611 -12.110   5.190
    7   HE21  GLN  55          HE21      GLN  55  -1.623 -11.428   3.066
    8   HE22  GLN  55          HE22      GLN  55  -1.431  -9.824   2.550

  No H/Q in entry =           8
  In of MODEL   28
    1    H    THR  56           H        THR  56  -1.878 -12.442   9.166
    2    HA   THR  56           HA       THR  56   0.212 -14.034   8.263
    3    HB   THR  56           HB       THR  56  -1.041 -14.276  11.007
    4    HG1  THR  56           HG1      THR  56   0.060 -12.159   9.758
    5   HG22  THR  56          HG21      THR  56   1.862 -14.442  10.180
    6   HG21  THR  56          HG22      THR  56   0.815 -15.859  10.271
    7   HG23  THR  56          HG23      THR  56   1.148 -14.912  11.722

  No H/Q in entry =           7
  In of MODEL   28
    1    H    LYS  57           H        LYS  57  -2.908 -15.080   9.618
    2    HA   LYS  57           HA       LYS  57  -2.448 -17.875   9.384
    3    HB2  LYS  57           HB2      LYS  57  -4.278 -16.785  10.717
    4    HB3  LYS  57           HB3      LYS  57  -5.066 -16.351   9.208
    5    HG2  LYS  57           HG2      LYS  57  -5.283 -18.722   8.614
    6    HG3  LYS  57           HG3      LYS  57  -4.456 -19.184  10.099
    7    HD2  LYS  57           HD2      LYS  57  -6.265 -18.156  11.431
    8    HD3  LYS  57           HD3      LYS  57  -7.099 -17.692   9.948
    9    HE2  LYS  57           HE2      LYS  57  -7.300 -20.072   9.310
   10    HE3  LYS  57           HE3      LYS  57  -6.456 -20.553  10.780
   11    HZ1  LYS  57           HZ1      LYS  57  -8.230 -19.431  12.053
   12    HZ3  LYS  57           HZ2      LYS  57  -8.790 -20.745  11.131
   13    HZ2  LYS  57           HZ3      LYS  57  -9.064 -19.153  10.600

  No H/Q in entry =          13
  In of MODEL   28
    1    H    LEU  58           H        LEU  58  -3.782 -15.447   7.194
    2    HA   LEU  58           HA       LEU  58  -4.567 -17.284   5.191
    3    HB2  LEU  58           HB2      LEU  58  -3.974 -14.333   5.047
    4    HB3  LEU  58           HB3      LEU  58  -4.627 -15.278   3.708
    5    HG   LEU  58           HG       LEU  58  -5.919 -15.094   6.449
    6   HD11  LEU  58          HD11      LEU  58  -6.217 -13.458   3.950
    7   HD13  LEU  58          HD12      LEU  58  -6.216 -12.944   5.637
    8   HD12  LEU  58          HD13      LEU  58  -7.632 -13.746   4.962
    9   HD22  LEU  58          HD21      LEU  58  -6.869 -17.011   5.583
   10   HD21  LEU  58          HD22      LEU  58  -6.525 -16.564   3.912
   11   HD23  LEU  58          HD23      LEU  58  -7.895 -15.841   4.755

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  59           H        ILE  59  -1.441 -16.055   6.061
    2    HA   ILE  59           HA       ILE  59  -0.329 -16.788   3.432
    3    HB   ILE  59           HB       ILE  59   0.424 -14.711   4.991
    4   HG12  ILE  59          HG12      ILE  59   2.526 -16.370   3.580
    5   HG13  ILE  59          HG13      ILE  59   1.340 -15.425   2.717
    6   HG21  ILE  59          HG21      ILE  59   1.166 -16.477   6.766
    7   HG23  ILE  59          HG22      ILE  59   2.259 -15.160   6.404
    8   HG22  ILE  59          HG23      ILE  59   2.526 -16.756   5.703
    9   HD11  ILE  59          HD11      ILE  59   2.081 -13.406   4.019
   10   HD13  ILE  59          HD12      ILE  59   3.316 -14.061   2.945
   11   HD12  ILE  59          HD13      ILE  59   3.386 -14.391   4.676

  No H/Q in entry =          11
  In of MODEL   28
    1    H    GLU  60           H        GLU  60  -0.349 -17.881   6.804
    2    HA   GLU  60           HA       GLU  60   1.692 -19.850   6.556
    3    HB2  GLU  60           HB2      GLU  60   0.897 -19.048   8.737
    4    HB3  GLU  60           HB3      GLU  60  -0.688 -19.753   8.429
    5    HG2  GLU  60           HG2      GLU  60   0.335 -22.000   8.308
    6    HG3  GLU  60           HG3      GLU  60   1.919 -21.293   8.618

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLY  61           H        GLY  61  -1.816 -19.966   6.055
    2    HA3  GLY  61           HA2      GLY  61  -1.551 -22.762   5.109
    3    HA2  GLY  61           HA3      GLY  61  -3.042 -22.030   5.693

  No H/Q in entry =           3
  In of MODEL   28
    1    H    ASP  62           H        ASP  62  -0.811 -20.446   3.494
    2    HA   ASP  62           HA       ASP  62  -2.908 -19.977   1.586
    3    HB2  ASP  62           HB2      ASP  62  -1.082 -18.819   0.331
    4    HB3  ASP  62           HB3      ASP  62  -1.267 -18.254   1.987

  No H/Q in entry =           4
  In of MODEL   28
    1    H    ALA  63           H        ALA  63  -1.004 -22.677   2.085
    2    HA   ALA  63           HA       ALA  63  -0.172 -23.408  -0.525
    3    HB1  ALA  63           HB1      ALA  63  -0.870 -25.013   1.917
    4    HB3  ALA  63           HB2      ALA  63   0.723 -24.662   1.247
    5    HB2  ALA  63           HB3      ALA  63  -0.360 -25.773   0.408

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLY  64           H        GLY  64  -3.206 -23.802   1.235
    2    HA3  GLY  64           HA2      GLY  64  -5.286 -24.548   0.612
    3    HA2  GLY  64           HA3      GLY  64  -4.935 -23.755  -0.915

  No H/Q in entry =           3
  In of MODEL   28
    1    H    GLU  65           H        GLU  65  -4.766 -25.012  -2.710
    2    HA   GLU  65           HA       GLU  65  -5.406 -27.766  -2.535
    3    HB2  GLU  65           HB2      GLU  65  -4.423 -26.081  -4.835
    4    HB3  GLU  65           HB3      GLU  65  -4.902 -27.772  -4.999
    5    HG2  GLU  65           HG2      GLU  65  -7.137 -27.259  -4.156
    6    HG3  GLU  65           HG3      GLU  65  -6.672 -25.582  -3.880

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLY  66           H        GLY  66  -4.033 -29.182  -4.195
    2    HA3  GLY  66           HA2      GLY  66  -1.764 -30.081  -2.790
    3    HA2  GLY  66           HA3      GLY  66  -2.282 -30.623  -4.374

  No H/Q in entry =           3
  In of MODEL   28
    1    H    LYS  67           H        LYS  67  -2.083 -28.029  -5.609
    2    HA   LYS  67           HA       LYS  67   0.651 -28.140  -6.390
    3    HB2  LYS  67           HB2      LYS  67  -1.614 -26.299  -7.140
    4    HB3  LYS  67           HB3      LYS  67  -0.013 -26.240  -7.889
    5    HG2  LYS  67           HG2      LYS  67  -0.205 -28.597  -8.544
    6    HG3  LYS  67           HG3      LYS  67  -1.779 -28.703  -7.759
    7    HD2  LYS  67           HD2      LYS  67  -2.651 -26.976  -9.314
    8    HD3  LYS  67           HD3      LYS  67  -1.083 -26.940 -10.124
    9    HE2  LYS  67           HE2      LYS  67  -2.822 -29.408  -9.836
   10    HE3  LYS  67           HE3      LYS  67  -2.708 -28.423 -11.294
   11    HZ2  LYS  67           HZ1      LYS  67  -0.643 -30.118 -10.046
   12    HZ1  LYS  67           HZ2      LYS  67  -0.209 -28.846 -11.084
   13    HZ3  LYS  67           HZ3      LYS  67  -1.188 -30.113 -11.652

  No H/Q in entry =          13
  In of MODEL   28
    1    H    MET  68           H        MET  68   2.088 -26.354  -6.579
    2    HA   MET  68           HA       MET  68   2.777 -25.214  -4.108
    3    HB2  MET  68           HB2      MET  68   3.707 -24.541  -6.901
    4    HB3  MET  68           HB3      MET  68   4.496 -24.005  -5.416
    5    HG2  MET  68           HG2      MET  68   4.193 -26.735  -5.024
    6    HG3  MET  68           HG3      MET  68   4.600 -26.615  -6.737
    7    HE3  MET  68           HE1      MET  68   6.287 -23.917  -3.869
    8    HE2  MET  68           HE2      MET  68   6.698 -25.400  -3.009
    9    HE1  MET  68           HE3      MET  68   5.030 -25.104  -3.494

  No H/Q in entry =           9
  In of MODEL   28
    1    H    LYS  69           H        LYS  69   1.153 -23.758  -6.917
    2    HA   LYS  69           HA       LYS  69   1.297 -21.109  -6.387
    3    HB2  LYS  69           HB2      LYS  69   0.147 -22.052  -8.327
    4    HB3  LYS  69           HB3      LYS  69  -1.222 -22.483  -7.294
    5    HG2  LYS  69           HG2      LYS  69  -1.563 -20.149  -6.694
    6    HG3  LYS  69           HG3      LYS  69  -0.131 -19.673  -7.606
    7    HD2  LYS  69           HD2      LYS  69  -1.189 -20.483  -9.686
    8    HD3  LYS  69           HD3      LYS  69  -2.629 -20.934  -8.771
    9    HE2  LYS  69           HE2      LYS  69  -2.932 -18.587  -8.075
   10    HE3  LYS  69           HE3      LYS  69  -1.490 -18.131  -8.982
   11    HZ3  LYS  69           HZ1      LYS  69  -2.987 -17.745 -10.593
   12    HZ2  LYS  69           HZ2      LYS  69  -4.149 -18.797  -9.937
   13    HZ1  LYS  69           HZ3      LYS  69  -2.862 -19.416 -10.857

  No H/Q in entry =          13
  In of MODEL   28
    1    H    VAL  70           H        VAL  70   0.069 -19.492  -5.369
    2    HA   VAL  70           HA       VAL  70  -1.415 -20.389  -2.960
    3    HB   VAL  70           HB       VAL  70  -0.633 -18.291  -1.897
    4   HG13  VAL  70          HG11      VAL  70   0.686 -20.325  -1.574
    5   HG12  VAL  70          HG12      VAL  70   1.764 -18.934  -1.697
    6   HG11  VAL  70          HG13      VAL  70   1.564 -20.019  -3.073
    7   HG22  VAL  70          HG21      VAL  70  -0.285 -16.742  -3.650
    8   HG21  VAL  70          HG22      VAL  70   0.630 -17.902  -4.611
    9   HG23  VAL  70          HG23      VAL  70   1.365 -17.166  -3.190

  No H/Q in entry =           9
  In of MODEL   28
    1    H    SER  71           H        SER  71  -2.935 -18.677  -2.157
    2    HA   SER  71           HA       SER  71  -4.887 -18.030  -4.091
    3    HB2  SER  71           HB2      SER  71  -5.325 -18.266  -1.623
    4    HB3  SER  71           HB3      SER  71  -4.486 -16.738  -1.368
    5    HG   SER  71           HG       SER  71  -6.065 -15.952  -3.039

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU  72           H        LEU  72  -5.063 -16.389  -5.437
    2    HA   LEU  72           HA       LEU  72  -2.963 -14.568  -5.918
    3    HB2  LEU  72           HB2      LEU  72  -5.826 -14.634  -6.872
    4    HB3  LEU  72           HB3      LEU  72  -4.627 -13.481  -7.452
    5    HG   LEU  72           HG       LEU  72  -4.238 -16.491  -7.567
    6   HD11  LEU  72          HD11      LEU  72  -6.174 -15.733  -8.950
    7   HD13  LEU  72          HD12      LEU  72  -4.837 -16.336  -9.930
    8   HD12  LEU  72          HD13      LEU  72  -5.104 -14.600  -9.774
    9   HD22  LEU  72          HD21      LEU  72  -2.106 -15.532  -7.791
   10   HD21  LEU  72          HD22      LEU  72  -2.713 -14.096  -8.597
   11   HD23  LEU  72          HD23      LEU  72  -2.636 -15.625  -9.468

  No H/Q in entry =          11
  In of MODEL   28
    1    H    VAL  73           H        VAL  73  -6.064 -14.222  -4.299
    2    HA   VAL  73           HA       VAL  73  -6.126 -11.450  -3.958
    3    HB   VAL  73           HB       VAL  73  -7.848 -11.813  -2.385
    4   HG11  VAL  73          HG11      VAL  73  -8.208 -12.647  -4.760
    5   HG13  VAL  73          HG12      VAL  73  -9.279 -13.340  -3.544
    6   HG12  VAL  73          HG13      VAL  73  -7.907 -14.273  -4.145
    7   HG23  VAL  73          HG21      VAL  73  -8.116 -14.310  -1.567
    8   HG22  VAL  73          HG22      VAL  73  -7.005 -13.224  -0.733
    9   HG21  VAL  73          HG23      VAL  73  -6.387 -14.391  -1.901

  No H/Q in entry =           9
  In of MODEL   28
    1    H    LEU  74           H        LEU  74  -4.180 -13.802  -2.360
    2    HA   LEU  74           HA       LEU  74  -3.783 -12.651   0.160
    3    HB2  LEU  74           HB2      LEU  74  -2.986 -14.866  -0.331
    4    HB3  LEU  74           HB3      LEU  74  -1.929 -14.251  -1.601
    5    HG   LEU  74           HG       LEU  74  -0.634 -12.993   0.082
    6   HD12  LEU  74          HD11      LEU  74  -1.133 -13.685   2.525
    7   HD11  LEU  74          HD12      LEU  74  -2.722 -14.165   1.923
    8   HD13  LEU  74          HD13      LEU  74  -2.199 -12.486   1.792
    9   HD23  LEU  74          HD21      LEU  74  -0.852 -15.739   1.202
   10   HD22  LEU  74          HD22      LEU  74   0.557 -14.820   0.723
   11   HD21  LEU  74          HD23      LEU  74  -0.438 -15.570  -0.503

  No H/Q in entry =          11
  In of MODEL   28
    1    H    VAL  75           H        VAL  75  -1.885 -12.256  -2.792
    2    HA   VAL  75           HA       VAL  75  -0.102 -10.319  -1.782
    3    HB   VAL  75           HB       VAL  75  -1.046 -10.816  -4.607
    4   HG12  VAL  75          HG11      VAL  75   1.017  -9.501  -5.222
    5   HG11  VAL  75          HG12      VAL  75   1.208  -9.089  -3.525
    6   HG13  VAL  75          HG13      VAL  75  -0.197  -8.520  -4.411
    7   HG23  VAL  75          HG21      VAL  75   1.606 -11.481  -3.304
    8   HG22  VAL  75          HG22      VAL  75   0.944 -12.118  -4.811
    9   HG21  VAL  75          HG23      VAL  75   0.244 -12.604  -3.266

  No H/Q in entry =           9
  In of MODEL   28
    1    H    GLU  76           H        GLU  76  -3.249  -9.994  -3.451
    2    HA   GLU  76           HA       GLU  76  -3.316  -7.181  -3.561
    3    HB2  GLU  76           HB2      GLU  76  -4.963  -8.635  -4.724
    4    HB3  GLU  76           HB3      GLU  76  -5.620  -9.128  -3.171
    5    HG2  GLU  76           HG2      GLU  76  -7.079  -7.427  -4.059
    6    HG3  GLU  76           HG3      GLU  76  -6.202  -6.699  -2.728

  No H/Q in entry =           6
  In of MODEL   28
    1    H    ALA  77           H        ALA  77  -4.422  -9.407  -1.018
    2    HA   ALA  77           HA       ALA  77  -5.396  -7.405   0.731
    3    HB2  ALA  77           HB1      ALA  77  -5.041  -9.194   2.504
    4    HB1  ALA  77           HB2      ALA  77  -4.391 -10.212   1.220
    5    HB3  ALA  77           HB3      ALA  77  -6.063  -9.656   1.143

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLN  78           H        GLN  78  -2.239  -8.938   0.381
    2    HA   GLN  78           HA       GLN  78  -0.994  -7.764   2.632
    3    HB2  GLN  78           HB2      GLN  78  -0.117  -9.704   1.286
    4    HB3  GLN  78           HB3      GLN  78   0.316  -8.560   0.017
    5    HG2  GLN  78           HG2      GLN  78   1.768  -7.354   1.592
    6    HG3  GLN  78           HG3      GLN  78   1.332  -8.484   2.872
    7   HE21  GLN  78          HE21      GLN  78   4.057  -8.208   2.033
    8   HE22  GLN  78          HE22      GLN  78   4.526  -9.648   1.265

  No H/Q in entry =           8
  In of MODEL   28
    1    H    LEU  79           H        LEU  79  -1.356  -6.715  -0.720
    2    HA   LEU  79           HA       LEU  79   0.319  -4.480  -0.708
    3    HB2  LEU  79           HB2      LEU  79  -0.697  -5.298  -2.763
    4    HB3  LEU  79           HB3      LEU  79  -2.304  -4.912  -2.160
    5    HG   LEU  79           HG       LEU  79  -1.772  -2.523  -2.140
    6   HD13  LEU  79          HD11      LEU  79   0.466  -2.267  -1.622
    7   HD12  LEU  79          HD12      LEU  79   0.519  -1.985  -3.362
    8   HD11  LEU  79          HD13      LEU  79   0.978  -3.558  -2.709
    9   HD23  LEU  79          HD21      LEU  79  -1.131  -2.329  -4.691
   10   HD22  LEU  79          HD22      LEU  79  -2.655  -3.083  -4.234
   11   HD21  LEU  79          HD23      LEU  79  -1.276  -4.086  -4.672

  No H/Q in entry =          11
  In of MODEL   28
    1    H    HIS  80           H        HIS  80  -3.149  -4.656   0.108
    2    HA   HIS  80           HA       HIS  80  -3.355  -1.898   0.762
    3    HB2  HIS  80           HB2      HIS  80  -5.046  -4.314   1.083
    4    HB3  HIS  80           HB3      HIS  80  -5.376  -2.972   2.182
    5    HD1  HIS  80           HD1      HIS  80  -6.998  -1.345   1.265
    6    HD2  HIS  80           HD2      HIS  80  -4.788  -3.157  -1.771
    7    HE1  HIS  80           HE1      HIS  80  -7.836  -0.358  -0.920
    8    HE2  HIS  80           HE2      HIS  80  -6.495  -1.457  -2.780

  No H/Q in entry =           8
  In of MODEL   28
    1    H    LEU  81           H        LEU  81  -2.860  -4.785   2.766
    2    HA   LEU  81           HA       LEU  81  -2.860  -3.429   5.246
    3    HB2  LEU  81           HB2      LEU  81  -1.628  -6.044   4.378
    4    HB3  LEU  81           HB3      LEU  81  -1.610  -5.480   6.050
    5    HG   LEU  81           HG       LEU  81  -4.149  -5.748   4.416
    6   HD12  LEU  81          HD11      LEU  81  -4.448  -7.809   5.969
    7   HD11  LEU  81          HD12      LEU  81  -2.697  -7.731   6.160
    8   HD13  LEU  81          HD13      LEU  81  -3.400  -7.969   4.559
    9   HD23  LEU  81          HD21      LEU  81  -4.999  -5.946   6.915
   10   HD22  LEU  81          HD22      LEU  81  -4.679  -4.358   6.221
   11   HD21  LEU  81          HD23      LEU  81  -3.492  -5.110   7.287

  No H/Q in entry =          11
  In of MODEL   28
    1    H    MET  82           H        MET  82  -0.169  -4.329   3.086
    2    HA   MET  82           HA       MET  82   1.905  -3.422   4.773
    3    HB2  MET  82           HB2      MET  82   1.701  -3.774   1.782
    4    HB3  MET  82           HB3      MET  82   3.178  -3.195   2.548
    5    HG2  MET  82           HG2      MET  82   1.779  -5.787   3.276
    6    HG3  MET  82           HG3      MET  82   3.153  -5.676   2.180
    7    HE3  MET  82           HE1      MET  82   6.160  -4.922   4.170
    8    HE2  MET  82           HE2      MET  82   5.234  -3.560   3.545
    9    HE1  MET  82           HE3      MET  82   5.331  -5.053   2.614

  No H/Q in entry =           9
  In of MODEL   28
    1    H    THR  83           H        THR  83   0.085  -1.795   2.206
    2    HA   THR  83           HA       THR  83   1.488   0.659   2.288
    3    HB   THR  83           HB       THR  83  -0.688   1.573   1.293
    4    HG1  THR  83           HG1      THR  83  -2.334   0.270   1.185
    5   HG22  THR  83          HG21      THR  83  -0.406  -0.250  -0.701
    6   HG21  THR  83          HG22      THR  83   1.093  -0.535   0.181
    7   HG23  THR  83          HG23      THR  83   0.728   1.075  -0.440

  No H/Q in entry =           7
  In of MODEL   28
    1    H    SER  84           H        SER  84  -1.519  -0.378   3.884
    2    HA   SER  84           HA       SER  84  -2.027   2.054   5.219
    3    HB2  SER  84           HB2      SER  84  -2.852  -0.784   5.791
    4    HB3  SER  84           HB3      SER  84  -3.353   0.558   6.818
    5    HG   SER  84           HG       SER  84  -3.803   0.233   4.025

  No H/Q in entry =           5
  In of MODEL   28
    1    H    MET  85           H        MET  85  -0.311  -0.868   6.363
    2    HA   MET  85           HA       MET  85   0.198   0.068   8.966
    3    HB2  MET  85           HB2      MET  85   0.500  -2.277   8.295
    4    HB3  MET  85           HB3      MET  85   1.884  -1.812   7.306
    5    HG2  MET  85           HG2      MET  85   3.052  -0.974   9.304
    6    HG3  MET  85           HG3      MET  85   1.658  -1.387  10.301
    7    HE2  MET  85           HE1      MET  85   1.894  -4.914  11.145
    8    HE1  MET  85           HE2      MET  85   0.798  -3.571  10.832
    9    HE3  MET  85           HE3      MET  85   2.179  -3.341  11.900

  No H/Q in entry =           9
  In of MODEL   28
    1    H    LEU  86           H        LEU  86   2.140   0.320   6.020
    2    HA   LEU  86           HA       LEU  86   4.347   1.641   7.177
    3    HB2  LEU  86           HB2      LEU  86   4.166   0.550   4.872
    4    HB3  LEU  86           HB3      LEU  86   3.355   2.028   4.352
    5    HG   LEU  86           HG       LEU  86   5.376   3.283   5.334
    6   HD11  LEU  86          HD11      LEU  86   6.087   0.676   6.144
    7   HD13  LEU  86          HD12      LEU  86   7.086   2.125   6.240
    8   HD12  LEU  86          HD13      LEU  86   7.202   1.072   4.832
    9   HD23  LEU  86          HD21      LEU  86   6.105   1.514   2.991
   10   HD22  LEU  86          HD22      LEU  86   6.493   3.214   3.248
   11   HD21  LEU  86          HD23      LEU  86   4.843   2.739   2.847

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ALA  87           H        ALA  87   1.436   2.871   5.580
    2    HA   ALA  87           HA       ALA  87   2.022   5.603   5.656
    3    HB1  ALA  87           HB1      ALA  87  -0.281   3.967   5.114
    4    HB3  ALA  87           HB2      ALA  87   0.027   5.626   4.609
    5    HB2  ALA  87           HB3      ALA  87  -0.771   5.308   6.151

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ARG  88           H        ARG  88   0.331   3.605   8.048
    2    HA   ARG  88           HA       ARG  88  -0.192   5.659   9.886
    3    HB2  ARG  88           HB2      ARG  88  -1.124   3.304   9.958
    4    HB3  ARG  88           HB3      ARG  88   0.417   2.811  10.671
    5    HG2  ARG  88           HG2      ARG  88  -0.070   4.890  12.282
    6    HG3  ARG  88           HG3      ARG  88  -1.735   4.559  11.822
    7    HD2  ARG  88           HD2      ARG  88  -1.840   2.713  13.075
    8    HD3  ARG  88           HD3      ARG  88  -0.248   2.134  12.550
    9    HE   ARG  88           HE       ARG  88  -0.792   3.405  14.999
   10   HH21  ARG  88          HH11      ARG  88   0.759   4.426  16.238
   11   HH22  ARG  88          HH12      ARG  88   2.280   4.854  15.536
   12   HH11  ARG  88          HH21      ARG  88   1.495   3.584  12.427
   13   HH12  ARG  88          HH22      ARG  88   2.704   4.362  13.390

  No H/Q in entry =          13
  In of MODEL   28
    1    H    GLU  89           H        GLU  89   2.612   3.448   9.679
    2    HA   GLU  89           HA       GLU  89   3.864   4.349  12.023
    3    HB2  GLU  89           HB2      GLU  89   4.533   2.328  10.689
    4    HB3  GLU  89           HB3      GLU  89   5.309   3.420   9.540
    5    HG2  GLU  89           HG2      GLU  89   6.786   4.278  11.285
    6    HG3  GLU  89           HG3      GLU  89   5.951   3.324  12.507

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LEU  90           H        LEU  90   4.187   5.496   8.692
    2    HA   LEU  90           HA       LEU  90   6.109   7.505   9.276
    3    HB2  LEU  90           HB2      LEU  90   4.111   7.158   7.044
    4    HB3  LEU  90           HB3      LEU  90   5.337   8.433   7.064
    5    HG   LEU  90           HG       LEU  90   6.019   5.500   7.411
    6   HD12  LEU  90          HD11      LEU  90   6.774   5.728   4.972
    7   HD11  LEU  90          HD12      LEU  90   5.754   7.164   4.916
    8   HD13  LEU  90          HD13      LEU  90   5.039   5.590   5.262
    9   HD22  LEU  90          HD21      LEU  90   7.911   6.659   8.094
   10   HD21  LEU  90          HD22      LEU  90   7.559   8.059   7.081
   11   HD23  LEU  90          HD23      LEU  90   8.226   6.594   6.361

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  91           H        ILE  91   2.570   7.507   9.117
    2    HA   ILE  91           HA       ILE  91   2.216  10.280   9.556
    3    HB   ILE  91           HB       ILE  91   0.433   7.899  10.102
    4   HG12  ILE  91          HG12      ILE  91   0.181  10.172   8.108
    5   HG13  ILE  91          HG13      ILE  91   1.048   8.680   7.744
    6   HG22  ILE  91          HG21      ILE  91  -1.308   9.951  10.153
    7   HG21  ILE  91          HG22      ILE  91   0.088  10.789  10.827
    8   HG23  ILE  91          HG23      ILE  91  -0.545   9.352  11.627
    9   HD13  ILE  91          HD11      ILE  91  -0.891   7.385   7.788
   10   HD12  ILE  91          HD12      ILE  91  -1.484   8.895   7.099
   11   HD11  ILE  91          HD13      ILE  91  -1.759   8.536   8.804

  No H/Q in entry =          11
  In of MODEL   28
    1    H    THR  92           H        THR  92   2.624   7.548  11.769
    2    HA   THR  92           HA       THR  92   2.167   8.929  14.186
    3    HB   THR  92           HB       THR  92   3.988   6.600  13.536
    4    HG1  THR  92           HG1      THR  92   2.023   5.833  13.432
    5   HG22  THR  92          HG21      THR  92   3.598   6.324  16.169
    6   HG21  THR  92          HG22      THR  92   3.526   8.082  16.089
    7   HG23  THR  92          HG23      THR  92   4.964   7.231  15.524

  No H/Q in entry =           7
  In of MODEL   28
    1    H    GLU  93           H        GLU  93   5.126   8.486  12.263
    2    HA   GLU  93           HA       GLU  93   6.868   9.928  13.960
    3    HB2  GLU  93           HB2      GLU  93   6.968   9.602  10.947
    4    HB3  GLU  93           HB3      GLU  93   8.302  10.142  11.963
    5    HG2  GLU  93           HG2      GLU  93   6.904   7.501  12.417
    6    HG3  GLU  93           HG3      GLU  93   8.290   7.655  11.344

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LEU  94           H        LEU  94   4.823  10.922  11.237
    2    HA   LEU  94           HA       LEU  94   5.615  13.629  11.129
    3    HB2  LEU  94           HB2      LEU  94   3.034  12.248  10.372
    4    HB3  LEU  94           HB3      LEU  94   3.285  13.976  10.125
    5    HG   LEU  94           HG       LEU  94   5.315  11.994   9.089
    6   HD11  LEU  94          HD11      LEU  94   2.574  12.527   8.015
    7   HD13  LEU  94          HD12      LEU  94   3.565  11.075   7.899
    8   HD12  LEU  94          HD13      LEU  94   3.897  12.453   6.850
    9   HD23  LEU  94          HD21      LEU  94   5.562  13.825   7.360
   10   HD22  LEU  94          HD22      LEU  94   5.968  14.326   9.001
   11   HD21  LEU  94          HD23      LEU  94   4.417  14.784   8.296

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  95           H        ILE  95   3.080  12.007  13.018
    2    HA   ILE  95           HA       ILE  95   2.021  14.356  14.200
    3    HB   ILE  95           HB       ILE  95   2.050  11.478  15.137
    4   HG12  ILE  95          HG12      ILE  95  -0.177  13.235  14.073
    5   HG13  ILE  95          HG13      ILE  95   0.789  12.177  13.048
    6   HG21  ILE  95          HG21      ILE  95   0.750  13.948  16.324
    7   HG23  ILE  95          HG22      ILE  95   1.802  12.788  17.137
    8   HG22  ILE  95          HG23      ILE  95   0.171  12.316  16.658
    9   HD13  ILE  95          HD11      ILE  95  -0.106  10.237  13.972
   10   HD12  ILE  95          HD12      ILE  95  -1.494  11.319  14.040
   11   HD11  ILE  95          HD13      ILE  95  -0.533  11.032  15.489

  No H/Q in entry =          11
  In of MODEL   28
    1    H    GLU  96           H        GLU  96   4.625  12.156  15.213
    2    HA   GLU  96           HA       GLU  96   5.165  13.368  17.702
    3    HB2  GLU  96           HB2      GLU  96   6.128  11.212  17.067
    4    HB3  GLU  96           HB3      GLU  96   7.061  11.985  15.787
    5    HG2  GLU  96           HG2      GLU  96   8.701  12.550  17.252
    6    HG3  GLU  96           HG3      GLU  96   7.546  13.360  18.300

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LEU  97           H        LEU  97   6.246  14.133  14.417
    2    HA   LEU  97           HA       LEU  97   8.117  16.144  15.127
    3    HB2  LEU  97           HB2      LEU  97   6.537  15.574  12.629
    4    HB3  LEU  97           HB3      LEU  97   7.547  17.013  12.748
    5    HG   LEU  97           HG       LEU  97   8.592  14.224  13.323
    6   HD12  LEU  97          HD11      LEU  97   9.595  14.415  11.008
    7   HD11  LEU  97          HD12      LEU  97   8.536  15.798  10.736
    8   HD13  LEU  97          HD13      LEU  97   7.846  14.202  11.034
    9   HD23  LEU  97          HD21      LEU  97  10.756  15.514  12.582
   10   HD22  LEU  97          HD22      LEU  97  10.129  15.786  14.208
   11   HD21  LEU  97          HD23      LEU  97   9.812  16.962  12.934

  No H/Q in entry =          11
  In of MODEL   28
    1    H    HIS  98           H        HIS  98   4.627  16.254  14.460
    2    HA   HIS  98           HA       HIS  98   4.309  19.052  14.583
    3    HB2  HIS  98           HB2      HIS  98   2.431  16.792  15.312
    4    HB3  HIS  98           HB3      HIS  98   1.953  18.489  15.359
    5    HD1  HIS  98           HD1      HIS  98   3.000  15.772  12.969
    6    HD2  HIS  98           HD2      HIS  98   1.599  19.695  12.826
    7    HE1  HIS  98           HE1      HIS  98   2.446  16.247  10.541
    8    HE2  HIS  98           HE2      HIS  98   1.596  18.630  10.433

  No H/Q in entry =           8
  In of MODEL   28
    1    H    GLU  99           H        GLU  99   4.450  16.574  17.093
    2    HA   GLU  99           HA       GLU  99   3.823  18.274  19.281
    3    HB2  GLU  99           HB2      GLU  99   3.750  15.791  19.388
    4    HB3  GLU  99           HB3      GLU  99   5.511  15.758  19.286
    5    HG2  GLU  99           HG2      GLU  99   5.684  17.060  21.356
    6    HG3  GLU  99           HG3      GLU  99   3.930  17.189  21.445

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LYS 100           H        LYS 100   6.888  17.357  17.731
    2    HA   LYS 100           HA       LYS 100   8.527  18.776  19.587
    3    HB2  LYS 100           HB2      LYS 100   9.042  17.844  16.754
    4    HB3  LYS 100           HB3      LYS 100  10.263  18.626  17.763
    5    HG2  LYS 100           HG2      LYS 100   9.893  16.880  19.510
    6    HG3  LYS 100           HG3      LYS 100   8.770  16.064  18.418
    7    HD2  LYS 100           HD2      LYS 100  10.571  15.786  16.759
    8    HD3  LYS 100           HD3      LYS 100  11.699  16.614  17.835
    9    HE2  LYS 100           HE2      LYS 100  11.309  14.863  19.559
   10    HE3  LYS 100           HE3      LYS 100  10.243  14.016  18.434
   11    HZ1  LYS 100           HZ1      LYS 100  13.061  14.701  17.785
   12    HZ3  LYS 100           HZ2      LYS 100  12.027  13.636  16.958
   13    HZ2  LYS 100           HZ3      LYS 100  12.613  13.227  18.500

  No H/Q in entry =          13
  In of MODEL   28
    1    H    LEU 101           H        LEU 101   6.838  19.680  16.623
    2    HA   LEU 101           HA       LEU 101   8.036  22.244  16.281
    3    HB2  LEU 101           HB2      LEU 101   5.452  20.989  15.391
    4    HB3  LEU 101           HB3      LEU 101   5.692  22.721  15.177
    5    HG   LEU 101           HG       LEU 101   7.745  20.714  14.227
    6   HD12  LEU 101          HD11      LEU 101   6.596  21.204  11.936
    7   HD11  LEU 101          HD12      LEU 101   5.190  21.628  12.910
    8   HD13  LEU 101          HD13      LEU 101   5.865  20.002  13.000
    9   HD21  LEU 101          HD21      LEU 101   7.100  23.620  13.657
   10   HD23  LEU 101          HD22      LEU 101   8.090  22.662  12.558
   11   HD22  LEU 101          HD23      LEU 101   8.625  22.930  14.216

  No H/Q in entry =          11
  In of MODEL   28
    1    H    LYS 102           H        LYS 102   6.497  21.106  18.896
    2    HA   LYS 102           HA       LYS 102   5.851  22.201  20.822
    3    HB2  LYS 102           HB2      LYS 102   7.125  24.195  19.694
    4    HB3  LYS 102           HB3      LYS 102   5.524  24.788  19.311
    5    HG2  LYS 102           HG2      LYS 102   6.893  24.551  21.968
    6    HG3  LYS 102           HG3      LYS 102   5.934  25.871  21.331
    7    HD2  LYS 102           HD2      LYS 102   4.704  23.231  22.216
    8    HD3  LYS 102           HD3      LYS 102   4.940  24.597  23.295
    9    HE2  LYS 102           HE2      LYS 102   2.669  24.174  21.800
   10    HE3  LYS 102           HE3      LYS 102   3.160  25.726  22.478
   11    HZ2  LYS 102           HZ1      LYS 102   2.637  25.821  20.096
   12    HZ1  LYS 102           HZ2      LYS 102   3.906  24.746  19.781
   13    HZ3  LYS 102           HZ3      LYS 102   4.237  26.281  20.419

  No H/Q in entry =          13
  In of MODEL   28
    1    H    ALA 103           H        ALA 103   4.213  23.723  18.043
    2    HA   ALA 103           HA       ALA 103   1.752  24.287  18.918
    3    HB1  ALA 103           HB1      ALA 103   0.867  23.431  16.676
    4    HB2  ALA 103           HB2      ALA 103   2.519  22.903  16.353
    5    HB3  ALA 103           HB3      ALA 103   2.172  24.614  16.612

  No H/Q in entry =           5
  In of MODEL   28
    1    H1   ALA   1           H3       ALA   1  10.712 -20.255  -6.155
    2    H2   ALA   1           H2       ALA   1   9.754 -20.472  -7.544
    3    H3   ALA   1           H1       ALA   1   9.316 -21.216  -6.079
    4    HA   ALA   1           HA       ALA   1  10.368 -23.021  -6.808
    5    HB1  ALA   1           HB1      ALA   1  10.469 -22.670  -9.085
    6    HB2  ALA   1           HB2      ALA   1  12.194 -22.509  -8.751
    7    HB3  ALA   1           HB3      ALA   1  11.188 -21.068  -8.911

  No H/Q in entry =           7
  In of MODEL   28
    1    H    GLU   2           H        GLU   2  12.657 -23.959  -6.855
    2    HA   GLU   2           HA       GLU   2  14.031 -23.862  -4.640
    3    HB2  GLU   2           HB2      GLU   2  15.395 -23.733  -7.335
    4    HB3  GLU   2           HB3      GLU   2  16.122 -24.334  -5.846
    5    HG2  GLU   2           HG2      GLU   2  15.117 -26.358  -6.082
    6    HG3  GLU   2           HG3      GLU   2  13.543 -25.621  -6.348

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLU   3           H        GLU   3  15.800 -21.996  -7.043
    2    HA   GLU   3           HA       GLU   3  16.938 -20.296  -5.086
    3    HB2  GLU   3           HB2      GLU   3  16.891 -20.305  -8.096
    4    HB3  GLU   3           HB3      GLU   3  17.627 -18.969  -7.212
    5    HG2  GLU   3           HG2      GLU   3  19.294 -20.331  -6.279
    6    HG3  GLU   3           HG3      GLU   3  18.356 -21.803  -6.497

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LEU   4           H        LEU   4  14.659 -19.470  -7.727
    2    HA   LEU   4           HA       LEU   4  14.177 -16.862  -7.127
    3    HB2  LEU   4           HB2      LEU   4  12.015 -18.850  -7.856
    4    HB3  LEU   4           HB3      LEU   4  11.931 -17.103  -8.061
    5    HG   LEU   4           HG       LEU   4  13.910 -18.961  -9.422
    6   HD13  LEU   4          HD11      LEU   4  12.613 -18.826 -11.336
    7   HD12  LEU   4          HD12      LEU   4  11.895 -17.283 -10.877
    8   HD11  LEU   4          HD13      LEU   4  11.347 -18.774 -10.111
    9   HD23  LEU   4          HD21      LEU   4  14.238 -16.719 -10.781
   10   HD22  LEU   4          HD22      LEU   4  15.095 -16.951  -9.258
   11   HD21  LEU   4          HD23      LEU   4  13.637 -15.962  -9.305

  No H/Q in entry =          11
  In of MODEL   28
    1    H    GLU   5           H        GLU   5  12.702 -19.647  -5.479
    2    HA   GLU   5           HA       GLU   5  11.011 -18.078  -3.786
    3    HB2  GLU   5           HB2      GLU   5  10.620 -20.471  -4.311
    4    HB3  GLU   5           HB3      GLU   5  12.034 -20.881  -3.339
    5    HG2  GLU   5           HG2      GLU   5  10.104 -21.118  -1.918
    6    HG3  GLU   5           HG3      GLU   5  10.957 -19.660  -1.414

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLU   6           H        GLU   6  14.165 -19.639  -3.329
    2    HA   GLU   6           HA       GLU   6  14.505 -18.771  -0.632
    3    HB2  GLU   6           HB2      GLU   6  15.742 -20.683  -1.629
    4    HB3  GLU   6           HB3      GLU   6  16.614 -19.549  -2.662
    5    HG2  GLU   6           HG2      GLU   6  17.506 -18.405  -0.677
    6    HG3  GLU   6           HG3      GLU   6  16.614 -19.508   0.370

  No H/Q in entry =           6
  In of MODEL   28
    1    H    VAL   7           H        VAL   7  15.272 -17.452  -3.785
    2    HA   VAL   7           HA       VAL   7  16.944 -15.313  -2.923
    3    HB   VAL   7           HB       VAL   7  15.248 -15.695  -5.404
    4   HG11  VAL   7          HG11      VAL   7  17.126 -13.468  -4.595
    5   HG13  VAL   7          HG12      VAL   7  15.485 -13.337  -5.224
    6   HG12  VAL   7          HG13      VAL   7  16.800 -13.836  -6.288
    7   HG21  VAL   7          HG21      VAL   7  17.361 -17.137  -4.824
    8   HG23  VAL   7          HG22      VAL   7  18.259 -15.673  -5.225
    9   HG22  VAL   7          HG23      VAL   7  17.230 -16.433  -6.436

  No H/Q in entry =           9
  In of MODEL   28
    1    H    VAL   8           H        VAL   8  13.455 -15.604  -3.489
    2    HA   VAL   8           HA       VAL   8  12.772 -12.899  -3.030
    3    HB   VAL   8           HB       VAL   8  11.180 -15.440  -2.605
    4   HG13  VAL   8          HG11      VAL   8  10.132 -13.813  -1.223
    5   HG12  VAL   8          HG12      VAL   8   9.218 -13.775  -2.731
    6   HG11  VAL   8          HG13      VAL   8  10.412 -12.524  -2.393
    7   HG23  VAL   8          HG21      VAL   8  10.497 -13.513  -4.769
    8   HG22  VAL   8          HG22      VAL   8  10.567 -15.272  -4.812
    9   HG21  VAL   8          HG23      VAL   8  12.046 -14.329  -4.970

  No H/Q in entry =           9
  In of MODEL   28
    1    H    MET   9           H        MET   9  13.049 -15.694  -0.839
    2    HA   MET   9           HA       MET   9  12.219 -14.419   1.524
    3    HB2  MET   9           HB2      MET   9  14.148 -16.680   1.003
    4    HB3  MET   9           HB3      MET   9  13.823 -16.100   2.637
    5    HG2  MET   9           HG2      MET   9  11.443 -16.560   2.374
    6    HG3  MET   9           HG3      MET   9  11.693 -17.029   0.691
    7    HE1  MET   9           HE1      MET   9  12.510 -17.476   4.264
    8    HE3  MET   9           HE2      MET   9  14.129 -18.028   3.842
    9    HE2  MET   9           HE3      MET   9  12.963 -19.166   4.511

  No H/Q in entry =           9
  In of MODEL   28
    1    H    GLY  10           H        GLY  10  15.406 -14.629  -0.022
    2    HA3  GLY  10           HA2      GLY  10  16.850 -13.191   1.947
    3    HA2  GLY  10           HA3      GLY  10  17.319 -13.360   0.256

  No H/Q in entry =           3
  In of MODEL   28
    1    H    LEU  11           H        LEU  11  15.146 -12.158  -0.995
    2    HA   LEU  11           HA       LEU  11  15.812  -9.408  -0.840
    3    HB2  LEU  11           HB2      LEU  11  13.458 -10.838  -2.077
    4    HB3  LEU  11           HB3      LEU  11  13.727  -9.102  -2.242
    5    HG   LEU  11           HG       LEU  11  15.771 -11.200  -3.016
    6   HD13  LEU  11          HD11      LEU  11  14.033 -11.585  -4.540
    7   HD12  LEU  11          HD12      LEU  11  15.030 -10.400  -5.381
    8   HD11  LEU  11          HD13      LEU  11  13.551  -9.888  -4.569
    9   HD22  LEU  11          HD21      LEU  11  16.988  -9.227  -2.794
   10   HD21  LEU  11          HD22      LEU  11  15.608  -8.202  -3.180
   11   HD23  LEU  11          HD23      LEU  11  16.449  -9.069  -4.464

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  12           H        ILE  12  13.053 -11.248   0.426
    2    HA   ILE  12           HA       ILE  12  11.640  -9.031   1.473
    3    HB   ILE  12           HB       ILE  12  11.695 -11.909   2.431
    4   HG12  ILE  12          HG12      ILE  12  11.008 -11.292  -0.019
    5   HG13  ILE  12          HG13      ILE  12   9.984 -12.380   0.896
    6   HG23  ILE  12          HG21      ILE  12  10.731 -10.529   4.166
    7   HG22  ILE  12          HG22      ILE  12   9.399 -11.330   3.334
    8   HG21  ILE  12          HG23      ILE  12   9.764  -9.639   2.991
    9   HD13  ILE  12          HD11      ILE  12   8.448 -10.572   1.384
   10   HD12  ILE  12          HD12      ILE  12   8.746 -10.593  -0.353
   11   HD11  ILE  12          HD13      ILE  12   9.537  -9.402   0.658

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  13           H        ILE  13  14.045 -11.212   2.894
    2    HA   ILE  13           HA       ILE  13  14.064 -10.023   5.470
    3    HB   ILE  13           HB       ILE  13  16.143 -11.582   3.918
    4   HG12  ILE  13          HG12      ILE  13  13.868 -12.564   4.752
    5   HG13  ILE  13          HG13      ILE  13  15.349 -13.477   5.023
    6   HG21  ILE  13          HG21      ILE  13  16.236 -10.505   6.739
    7   HG23  ILE  13          HG22      ILE  13  17.459 -10.364   5.483
    8   HG22  ILE  13          HG23      ILE  13  17.175 -11.919   6.265
    9   HD11  ILE  13          HD11      ILE  13  14.162 -11.593   7.092
   10   HD13  ILE  13          HD12      ILE  13  15.468 -12.752   7.315
   11   HD12  ILE  13          HD13      ILE  13  13.826 -13.322   7.039

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ASN  14           H        ASN  14  16.022  -9.487   2.556
    2    HA   ASN  14           HA       ASN  14  17.746  -7.526   3.616
    3    HB2  ASN  14           HB2      ASN  14  17.742  -8.802   1.305
    4    HB3  ASN  14           HB3      ASN  14  16.839  -7.395   0.760
    5   HD21  ASN  14          HD21      ASN  14  19.286  -7.717  -0.417
    6   HD22  ASN  14          HD22      ASN  14  20.417  -6.621   0.210

  No H/Q in entry =           6
  In of MODEL   28
    1    H    SER  15           H        SER  15  14.638  -7.213   1.912
    2    HA   SER  15           HA       SER  15  14.500  -4.394   1.958
    3    HB2  SER  15           HB2      SER  15  12.175  -4.663   1.452
    4    HB3  SER  15           HB3      SER  15  12.984  -6.030   0.694
    5    HG   SER  15           HG       SER  15  12.009  -7.334   2.023

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLY  16           H        GLY  16  13.422  -6.855   4.267
    2    HA3  GLY  16           HA2      GLY  16  12.178  -5.111   6.114
    3    HA2  GLY  16           HA3      GLY  16  12.807  -6.712   6.484

  No H/Q in entry =           3
  In of MODEL   28
    1    H    GLN  17           H        GLN  17  15.517  -6.355   5.899
    2    HA   GLN  17           HA       GLN  17  16.454  -5.116   8.278
    3    HB2  GLN  17           HB2      GLN  17  17.877  -5.984   5.750
    4    HB3  GLN  17           HB3      GLN  17  18.726  -5.338   7.155
    5    HG2  GLN  17           HG2      GLN  17  17.839  -7.121   8.562
    6    HG3  GLN  17           HG3      GLN  17  16.874  -7.736   7.221
    7   HE21  GLN  17          HE21      GLN  17  19.474  -6.848   5.554
    8   HE22  GLN  17          HE22      GLN  17  20.455  -8.224   5.707

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ALA  18           H        ALA  18  16.266  -4.053   4.914
    2    HA   ALA  18           HA       ALA  18  17.678  -1.646   5.136
    3    HB2  ALA  18           HB1      ALA  18  16.579  -2.879   3.070
    4    HB3  ALA  18           HB2      ALA  18  16.826  -1.133   3.048
    5    HB1  ALA  18           HB3      ALA  18  15.232  -1.793   3.415

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ARG  19           H        ARG  19  14.182  -2.266   5.523
    2    HA   ARG  19           HA       ARG  19  13.486   0.380   6.226
    3    HB2  ARG  19           HB2      ARG  19  11.824  -1.391   5.640
    4    HB3  ARG  19           HB3      ARG  19  12.168  -2.179   7.181
    5    HG2  ARG  19           HG2      ARG  19  11.434  -0.191   8.411
    6    HG3  ARG  19           HG3      ARG  19  11.180   0.677   6.898
    7    HD2  ARG  19           HD2      ARG  19   9.044  -0.137   7.714
    8    HD3  ARG  19           HD3      ARG  19   9.477  -1.018   6.242
    9    HE   ARG  19           HE       ARG  19  10.443  -2.543   8.356
   10   HH21  ARG  19          HH11      ARG  19   9.207  -4.192   9.297
   11   HH22  ARG  19          HH12      ARG  19   7.488  -4.182   9.120
   12   HH11  ARG  19          HH21      ARG  19   7.440  -1.284   7.246
   13   HH12  ARG  19          HH22      ARG  19   6.488  -2.536   7.955

  No H/Q in entry =          13
  In of MODEL   28
    1    H    SER  20           H        SER  20  14.365  -2.435   8.199
    2    HA   SER  20           HA       SER  20  14.061  -1.328  10.731
    3    HB2  SER  20           HB2      SER  20  14.551  -3.647  10.627
    4    HB3  SER  20           HB3      SER  20  15.999  -3.377   9.659
    5    HG   SER  20           HG       SER  20  16.771  -2.169  11.557

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU  21           H        LEU  21  16.912  -1.247   8.605
    2    HA   LEU  21           HA       LEU  21  18.565   0.263  10.343
    3    HB2  LEU  21           HB2      LEU  21  18.557  -0.023   7.330
    4    HB3  LEU  21           HB3      LEU  21  19.798   0.855   8.219
    5    HG   LEU  21           HG       LEU  21  19.089  -2.040   8.773
    6   HD13  LEU  21          HD11      LEU  21  19.939  -1.982   6.531
    7   HD12  LEU  21          HD12      LEU  21  21.283  -2.481   7.558
    8   HD11  LEU  21          HD13      LEU  21  21.194  -0.822   6.968
    9   HD21  LEU  21          HD21      LEU  21  21.198  -0.119   9.747
   10   HD23  LEU  21          HD22      LEU  21  21.577  -1.836   9.687
   11   HD22  LEU  21          HD23      LEU  21  20.245  -1.268  10.680

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ALA  22           H        ALA  22  16.301   1.199   7.775
    2    HA   ALA  22           HA       ALA  22  16.812   3.963   7.781
    3    HB3  ALA  22           HB1      ALA  22  15.428   2.701   6.102
    4    HB2  ALA  22           HB2      ALA  22  14.704   4.208   6.661
    5    HB1  ALA  22           HB3      ALA  22  14.127   2.666   7.292

  No H/Q in entry =           5
  In of MODEL   28
    1    H    TYR  23           H        TYR  23  14.326   2.129   9.613
    2    HA   TYR  23           HA       TYR  23  13.337   4.362  11.051
    3    HB2  TYR  23           HB2      TYR  23  12.121   2.238  11.034
    4    HB3  TYR  23           HB3      TYR  23  13.458   1.442  11.865
    5    HD1  TYR  23           HD1      TYR  23  10.933   4.168  12.215
    6    HD2  TYR  23           HD2      TYR  23  13.643   1.507  14.221
    7    HE1  TYR  23           HE1      TYR  23   9.992   4.859  14.403
    8    HE2  TYR  23           HE2      TYR  23  12.701   2.198  16.409
    9    HH   TYR  23           HH       TYR  23  11.359   4.600  17.155

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ALA  24           H        ALA  24  16.001   2.115  11.706
    2    HA   ALA  24           HA       ALA  24  16.652   3.126  14.268
    3    HB1  ALA  24           HB1      ALA  24  18.027   1.345  14.115
    4    HB3  ALA  24           HB2      ALA  24  19.049   2.272  13.017
    5    HB2  ALA  24           HB3      ALA  24  17.767   1.249  12.374

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA  25           H        ALA  25  17.613   4.052  10.990
    2    HA   ALA  25           HA       ALA  25  19.538   6.007  11.635
    3    HB1  ALA  25           HB1      ALA  25  18.838   5.043   9.321
    4    HB3  ALA  25           HB2      ALA  25  19.324   6.736   9.409
    5    HB2  ALA  25           HB3      ALA  25  17.613   6.313   9.335

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU  26           H        LEU  26  16.022   6.202  11.260
    2    HA   LEU  26           HA       LEU  26  15.771   8.983  11.700
    3    HB2  LEU  26           HB2      LEU  26  13.924   7.727  10.770
    4    HB3  LEU  26           HB3      LEU  26  13.837   6.704  12.198
    5    HG   LEU  26           HG       LEU  26  13.209   8.661  13.569
    6   HD12  LEU  26          HD11      LEU  26  12.534  10.751  12.234
    7   HD11  LEU  26          HD12      LEU  26  13.525  10.102  10.930
    8   HD13  LEU  26          HD13      LEU  26  14.261  10.500  12.484
    9   HD21  LEU  26          HD21      LEU  26  11.545   8.324  11.054
   10   HD23  LEU  26          HD22      LEU  26  10.973   9.022  12.566
   11   HD22  LEU  26          HD23      LEU  26  11.440   7.325  12.504

  No H/Q in entry =          11
  In of MODEL   28
    1    H    LYS  27           H        LYS  27  15.679   6.211  13.903
    2    HA   LYS  27           HA       LYS  27  15.066   7.580  16.264
    3    HB2  LYS  27           HB2      LYS  27  15.116   5.104  16.008
    4    HB3  LYS  27           HB3      LYS  27  16.879   5.172  15.971
    5    HG2  LYS  27           HG2      LYS  27  16.912   6.166  18.217
    6    HG3  LYS  27           HG3      LYS  27  15.145   6.170  18.256
    7    HD2  LYS  27           HD2      LYS  27  15.142   3.702  18.028
    8    HD3  LYS  27           HD3      LYS  27  16.907   3.706  18.023
    9    HE2  LYS  27           HE2      LYS  27  16.924   4.703  20.276
   10    HE3  LYS  27           HE3      LYS  27  15.158   4.729  20.284
   11    HZ3  LYS  27           HZ1      LYS  27  15.958   2.788  21.445
   12    HZ2  LYS  27           HZ2      LYS  27  16.883   2.311  20.099
   13    HZ1  LYS  27           HZ3      LYS  27  15.185   2.302  20.013

  No H/Q in entry =          13
  In of MODEL   28
    1    H    GLN  28           H        GLN  28  18.193   7.018  14.685
    2    HA   GLN  28           HA       GLN  28  19.861   8.122  16.678
    3    HB2  GLN  28           HB2      GLN  28  20.160   8.068  13.664
    4    HB3  GLN  28           HB3      GLN  28  21.439   8.554  14.777
    5    HG2  GLN  28           HG2      GLN  28  20.037   5.868  14.854
    6    HG3  GLN  28           HG3      GLN  28  21.600   6.154  14.090
    7   HE21  GLN  28          HE21      GLN  28  22.976   7.716  15.874
    8   HE22  GLN  28          HE22      GLN  28  23.100   6.951  17.384

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ALA  29           H        ALA  29  18.107   9.582  13.974
    2    HA   ALA  29           HA       ALA  29  19.085  12.211  14.221
    3    HB2  ALA  29           HB1      ALA  29  17.387  12.829  12.741
    4    HB1  ALA  29           HB2      ALA  29  16.250  11.650  13.392
    5    HB3  ALA  29           HB3      ALA  29  17.588  11.114  12.376

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LYS  30           H        LYS  30  16.315  10.596  15.738
    2    HA   LYS  30           HA       LYS  30  15.279  12.847  17.083
    3    HB2  LYS  30           HB2      LYS  30  15.186   9.908  17.797
    4    HB3  LYS  30           HB3      LYS  30  14.308  11.155  18.683
    5    HG2  LYS  30           HG2      LYS  30  13.186  11.826  16.558
    6    HG3  LYS  30           HG3      LYS  30  14.003  10.492  15.739
    7    HD2  LYS  30           HD2      LYS  30  12.937   8.883  17.269
    8    HD3  LYS  30           HD3      LYS  30  12.130  10.205  18.112
    9    HE2  LYS  30           HE2      LYS  30  10.965  10.823  16.013
   10    HE3  LYS  30           HE3      LYS  30  11.752   9.471  15.190
   11    HZ2  LYS  30           HZ1      LYS  30   9.444   9.049  16.063
   12    HZ1  LYS  30           HZ2      LYS  30  10.105   9.112  17.633
   13    HZ3  LYS  30           HZ3      LYS  30  10.626   7.927  16.528

  No H/Q in entry =          13
  In of MODEL   28
    1    H    GLN  31           H        GLN  31  17.953  10.698  17.837
    2    HA   GLN  31           HA       GLN  31  18.263  11.725  20.529
    3    HB2  GLN  31           HB2      GLN  31  20.303  10.162  18.937
    4    HB3  GLN  31           HB3      GLN  31  20.161  10.292  20.691
    5    HG2  GLN  31           HG2      GLN  31  17.657   9.320  19.916
    6    HG3  GLN  31           HG3      GLN  31  18.768   8.479  18.843
    7   HE21  GLN  31          HE21      GLN  31  17.225   7.330  21.118
    8   HE22  GLN  31          HE22      GLN  31  18.381   6.681  22.175

  No H/Q in entry =           8
  In of MODEL   28
    1    H    GLY  32           H        GLY  32  18.784  13.035  17.560
    2    HA3  GLY  32           HA2      GLY  32  19.757  15.085  17.042
    3    HA2  GLY  32           HA3      GLY  32  20.508  15.101  18.633

  No H/Q in entry =           3
  In of MODEL   28
    1    H    ASP  33           H        ASP  33  20.956  12.205  16.868
    2    HA   ASP  33           HA       ASP  33  23.779  12.898  16.409
    3    HB2  ASP  33           HB2      ASP  33  22.287  10.272  16.529
    4    HB3  ASP  33           HB3      ASP  33  23.975  10.398  16.040

  No H/Q in entry =           4
  In of MODEL   28
    1    H    PHE  34           H        PHE  34  23.295  14.211  14.521
    2    HA   PHE  34           HA       PHE  34  21.961  13.210  12.233
    3    HB2  PHE  34           HB2      PHE  34  24.077  15.359  12.463
    4    HB3  PHE  34           HB3      PHE  34  23.098  15.057  11.029
    5    HD1  PHE  34           HD1      PHE  34  23.325  17.003  13.936
    6    HD2  PHE  34           HD2      PHE  34  20.471  14.859  11.548
    7    HE1  PHE  34           HE1      PHE  34  21.496  18.391  14.872
    8    HE2  PHE  34           HE2      PHE  34  18.646  16.247  12.486
    9    HZ   PHE  34           HZ       PHE  34  19.162  18.014  14.144

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ALA  35           H        ALA  35  25.333  13.049  13.253
    2    HA   ALA  35           HA       ALA  35  26.453  12.227  10.803
    3    HB3  ALA  35           HB1      ALA  35  28.136  11.076  12.533
    4    HB2  ALA  35           HB2      ALA  35  27.261  12.099  13.672
    5    HB1  ALA  35           HB3      ALA  35  28.097  12.824  12.300

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA  36           H        ALA  36  25.342  10.273  13.572
    2    HA   ALA  36           HA       ALA  36  25.849   7.785  12.307
    3    HB2  ALA  36           HB1      ALA  36  25.416   7.042  14.383
    4    HB3  ALA  36           HB2      ALA  36  23.725   7.524  14.225
    5    HB1  ALA  36           HB3      ALA  36  24.915   8.667  14.848

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA  37           H        ALA  37  23.011   9.890  12.423
    2    HA   ALA  37           HA       ALA  37  21.172   8.102  11.247
    3    HB3  ALA  37           HB1      ALA  37  21.374  11.068  11.529
    4    HB1  ALA  37           HB2      ALA  37  20.069   9.981  12.001
    5    HB2  ALA  37           HB3      ALA  37  20.260  10.448  10.310

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LYS  38           H        LYS  38  23.258  10.574   9.767
    2    HA   LYS  38           HA       LYS  38  22.631  10.132   7.088
    3    HB2  LYS  38           HB2      LYS  38  24.423  11.709   8.534
    4    HB3  LYS  38           HB3      LYS  38  25.468  10.724   7.516
    5    HG2  LYS  38           HG2      LYS  38  24.305  11.478   5.513
    6    HG3  LYS  38           HG3      LYS  38  23.100  12.327   6.487
    7    HD2  LYS  38           HD2      LYS  38  24.679  13.941   7.239
    8    HD3  LYS  38           HD3      LYS  38  26.049  12.964   6.712
    9    HE2  LYS  38           HE2      LYS  38  25.682  14.827   5.152
   10    HE3  LYS  38           HE3      LYS  38  25.363  13.283   4.353
   11    HZ3  LYS  38           HZ1      LYS  38  23.163  13.710   4.213
   12    HZ2  LYS  38           HZ2      LYS  38  23.672  15.329   4.297
   13    HZ1  LYS  38           HZ3      LYS  38  23.099  14.546   5.690

  No H/Q in entry =          13
  In of MODEL   28
    1    H    ALA  39           H        ALA  39  25.151   8.562   9.059
    2    HA   ALA  39           HA       ALA  39  26.241   6.975   6.999
    3    HB2  ALA  39           HB1      ALA  39  26.151   6.021   9.846
    4    HB1  ALA  39           HB2      ALA  39  27.093   7.453   9.428
    5    HB3  ALA  39           HB3      ALA  39  27.460   5.903   8.671

  No H/Q in entry =           5
  In of MODEL   28
    1    H    MET  40           H        MET  40  23.626   6.345   9.290
    2    HA   MET  40           HA       MET  40  23.209   3.634   8.564
    3    HB2  MET  40           HB2      MET  40  21.370   5.666   9.842
    4    HB3  MET  40           HB3      MET  40  20.979   3.953   9.672
    5    HG2  MET  40           HG2      MET  40  23.515   4.921  11.019
    6    HG3  MET  40           HG3      MET  40  22.020   4.636  11.908
    7    HE3  MET  40           HE1      MET  40  21.488   0.998  12.094
    8    HE2  MET  40           HE2      MET  40  20.610   2.290  11.279
    9    HE1  MET  40           HE3      MET  40  21.343   2.590  12.854

  No H/Q in entry =           9
  In of MODEL   28
    1    H    MET  41           H        MET  41  21.772   6.670   7.361
    2    HA   MET  41           HA       MET  41  19.832   5.452   5.686
    3    HB2  MET  41           HB2      MET  41  21.291   8.054   5.169
    4    HB3  MET  41           HB3      MET  41  19.770   7.544   4.447
    5    HG2  MET  41           HG2      MET  41  19.017   7.358   6.996
    6    HG3  MET  41           HG3      MET  41  20.315   8.528   7.219
    7    HE2  MET  41           HE1      MET  41  19.752   9.799   3.876
    8    HE1  MET  41           HE2      MET  41  20.700  10.252   5.289
    9    HE3  MET  41           HE3      MET  41  19.420  11.318   4.716

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ASP  42           H        ASP  42  23.198   6.404   5.142
    2    HA   ASP  42           HA       ASP  42  23.304   5.921   2.386
    3    HB2  ASP  42           HB2      ASP  42  25.039   6.940   4.158
    4    HB3  ASP  42           HB3      ASP  42  25.712   5.320   4.038

  No H/Q in entry =           4
  In of MODEL   28
    1    H    GLN  43           H        GLN  43  24.038   3.782   5.117
    2    HA   GLN  43           HA       GLN  43  24.728   1.525   3.544
    3    HB2  GLN  43           HB2      GLN  43  23.694   1.709   6.384
    4    HB3  GLN  43           HB3      GLN  43  24.289   0.223   5.636
    5    HG2  GLN  43           HG2      GLN  43  26.443   1.452   5.128
    6    HG3  GLN  43           HG3      GLN  43  25.845   2.777   6.121
    7   HE21  GLN  43          HE21      GLN  43  28.083   1.828   7.169
    8   HE22  GLN  43          HE22      GLN  43  27.814   0.747   8.448

  No H/Q in entry =           8
  In of MODEL   28
    1    H    SER  44           H        SER  44  21.657   2.636   4.915
    2    HA   SER  44           HA       SER  44  20.111   0.376   4.244
    3    HB2  SER  44           HB2      SER  44  19.643   2.905   5.380
    4    HB3  SER  44           HB3      SER  44  18.614   2.847   3.951
    5    HG   SER  44           HG       SER  44  17.523   1.900   5.673

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ARG  45           H        ARG  45  20.833   3.341   2.432
    2    HA   ARG  45           HA       ARG  45  19.321   2.833   0.124
    3    HB2  ARG  45           HB2      ARG  45  20.443   4.982   0.704
    4    HB3  ARG  45           HB3      ARG  45  21.996   4.240   0.327
    5    HG2  ARG  45           HG2      ARG  45  21.224   3.819  -1.989
    6    HG3  ARG  45           HG3      ARG  45  19.683   4.584  -1.610
    7    HD2  ARG  45           HD2      ARG  45  20.913   6.694  -1.029
    8    HD3  ARG  45           HD3      ARG  45  22.418   5.932  -1.590
    9    HE   ARG  45           HE       ARG  45  20.497   5.670  -3.632
   10   HH21  ARG  45          HH11      ARG  45  20.484   7.032  -5.400
   11   HH22  ARG  45          HH12      ARG  45  21.227   8.590  -5.298
   12   HH11  ARG  45          HH21      ARG  45  22.200   8.189  -2.008
   13   HH12  ARG  45          HH22      ARG  45  22.197   9.244  -3.375

  No H/Q in entry =          13
  In of MODEL   28
    1    H    MET  46           H        MET  46  22.690   1.991   0.885
    2    HA   MET  46           HA       MET  46  23.314   0.795  -1.593
    3    HB2  MET  46           HB2      MET  46  24.415   0.479   1.201
    4    HB3  MET  46           HB3      MET  46  25.087  -0.400  -0.175
    5    HG2  MET  46           HG2      MET  46  25.486   1.728  -1.352
    6    HG3  MET  46           HG3      MET  46  24.798   2.615   0.001
    7    HE2  MET  46           HE1      MET  46  26.763   4.112   0.489
    8    HE1  MET  46           HE2      MET  46  27.513   3.488  -0.977
    9    HE3  MET  46           HE3      MET  46  28.456   3.600   0.507

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ALA  47           H        ALA  47  21.933  -0.540   1.384
    2    HA   ALA  47           HA       ALA  47  21.904  -3.256   0.591
    3    HB2  ALA  47           HB1      ALA  47  21.515  -2.790   2.892
    4    HB3  ALA  47           HB2      ALA  47  19.985  -3.408   2.271
    5    HB1  ALA  47           HB3      ALA  47  20.200  -1.674   2.524

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU  48           H        LEU  48  19.531  -0.649   0.217
    2    HA   LEU  48           HA       LEU  48  17.503  -2.204  -1.033
    3    HB2  LEU  48           HB2      LEU  48  18.134   0.755  -1.157
    4    HB3  LEU  48           HB3      LEU  48  16.670   0.031  -1.825
    5    HG   LEU  48           HG       LEU  48  17.518  -0.253   1.067
    6   HD13  LEU  48          HD11      LEU  48  17.083   2.043   0.870
    7   HD12  LEU  48          HD12      LEU  48  15.528   1.386   1.378
    8   HD11  LEU  48          HD13      LEU  48  15.801   1.803  -0.314
    9   HD22  LEU  48          HD21      LEU  48  16.004  -1.981   0.688
   10   HD21  LEU  48          HD22      LEU  48  15.126  -1.090  -0.556
   11   HD23  LEU  48          HD23      LEU  48  14.906  -0.680   1.146

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ASN  49           H        ASN  49  20.179  -0.259  -2.264
    2    HA   ASN  49           HA       ASN  49  19.535  -0.359  -4.990
    3    HB2  ASN  49           HB2      ASN  49  21.203   1.172  -4.056
    4    HB3  ASN  49           HB3      ASN  49  22.244  -0.184  -3.637
    5   HD21  ASN  49          HD21      ASN  49  23.986   0.374  -5.030
    6   HD22  ASN  49          HD22      ASN  49  23.848   0.385  -6.722

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLU  50           H        GLU  50  21.531  -2.530  -3.014
    2    HA   GLU  50           HA       GLU  50  22.251  -4.289  -5.131
    3    HB2  GLU  50           HB2      GLU  50  23.444  -4.246  -2.962
    4    HB3  GLU  50           HB3      GLU  50  22.004  -4.882  -2.167
    5    HG2  GLU  50           HG2      GLU  50  22.112  -6.919  -3.517
    6    HG3  GLU  50           HG3      GLU  50  23.485  -6.280  -4.418

  No H/Q in entry =           6
  In of MODEL   28
    1    H    ALA  51           H        ALA  51  19.589  -4.234  -2.811
    2    HA   ALA  51           HA       ALA  51  18.443  -6.719  -3.561
    3    HB3  ALA  51           HB1      ALA  51  16.843  -6.219  -2.011
    4    HB1  ALA  51           HB2      ALA  51  16.619  -4.576  -2.617
    5    HB2  ALA  51           HB3      ALA  51  17.979  -4.948  -1.557

  No H/Q in entry =           5
  In of MODEL   28
    1    H    HIS  52           H        HIS  52  17.835  -3.380  -4.611
    2    HA   HIS  52           HA       HIS  52  15.729  -3.930  -6.413
    3    HB2  HIS  52           HB2      HIS  52  16.348  -1.657  -5.626
    4    HB3  HIS  52           HB3      HIS  52  17.818  -1.745  -6.595
    5    HD1  HIS  52           HD1      HIS  52  17.494  -1.881  -9.229
    6    HD2  HIS  52           HD2      HIS  52  14.025  -1.044  -7.076
    7    HE1  HIS  52           HE1      HIS  52  15.798  -1.028 -10.906
    8    HE2  HIS  52           HE2      HIS  52  13.678  -0.512  -9.609

  No H/Q in entry =           8
  In of MODEL   28
    1    H    LEU  53           H        LEU  53  19.249  -3.911  -6.838
    2    HA   LEU  53           HA       LEU  53  19.314  -4.238  -9.637
    3    HB2  LEU  53           HB2      LEU  53  21.249  -4.981  -7.457
    4    HB3  LEU  53           HB3      LEU  53  21.571  -5.362  -9.146
    5    HG   LEU  53           HG       LEU  53  20.869  -2.560  -8.220
    6   HD13  LEU  53          HD11      LEU  53  22.910  -3.244  -7.061
    7   HD12  LEU  53          HD12      LEU  53  23.315  -2.108  -8.347
    8   HD11  LEU  53          HD13      LEU  53  23.598  -3.830  -8.572
    9   HD21  LEU  53          HD21      LEU  53  21.983  -3.779 -10.753
   10   HD23  LEU  53          HD22      LEU  53  22.295  -2.092 -10.358
   11   HD22  LEU  53          HD23      LEU  53  20.648  -2.646 -10.592

  No H/Q in entry =          11
  In of MODEL   28
    1    H    VAL  54           H        VAL  54  19.215  -6.614  -7.001
    2    HA   VAL  54           HA       VAL  54  19.360  -8.914  -8.651
    3    HB   VAL  54           HB       VAL  54  18.196  -8.488  -5.888
    4   HG12  VAL  54          HG11      VAL  54  18.541 -11.103  -5.871
    5   HG11  VAL  54          HG12      VAL  54  18.358 -10.943  -7.618
    6   HG13  VAL  54          HG13      VAL  54  17.063 -10.418  -6.544
    7   HG22  VAL  54          HG21      VAL  54  20.509  -8.258  -5.661
    8   HG21  VAL  54          HG22      VAL  54  20.858  -9.353  -6.996
    9   HG23  VAL  54          HG23      VAL  54  20.330  -9.997  -5.442

  No H/Q in entry =           9
  In of MODEL   28
    1    H    GLN  55           H        GLN  55  16.613  -7.028  -7.382
    2    HA   GLN  55           HA       GLN  55  14.608  -8.713  -8.453
    3    HB2  GLN  55           HB2      GLN  55  13.844  -7.186  -6.835
    4    HB3  GLN  55           HB3      GLN  55  14.627  -5.815  -7.615
    5    HG2  GLN  55           HG2      GLN  55  12.904  -5.512  -9.110
    6    HG3  GLN  55           HG3      GLN  55  12.596  -7.236  -9.273
    7   HE21  GLN  55          HE21      GLN  55  10.592  -7.798  -8.470
    8   HE22  GLN  55          HE22      GLN  55   9.810  -7.044  -7.166

  No H/Q in entry =           8
  In of MODEL   28
    1    H    THR  56           H        THR  56  16.327  -5.905  -9.821
    2    HA   THR  56           HA       THR  56  14.891  -5.566 -12.174
    3    HB   THR  56           HB       THR  56  17.909  -5.452 -12.009
    4    HG1  THR  56           HG1      THR  56  16.008  -4.058 -10.682
    5   HG22  THR  56          HG21      THR  56  15.987  -3.726 -13.578
    6   HG21  THR  56          HG22      THR  56  16.699  -5.198 -14.237
    7   HG23  THR  56          HG23      THR  56  17.737  -3.850 -13.769

  No H/Q in entry =           7
  In of MODEL   28
    1    H    LYS  57           H        LYS  57  17.559  -7.837 -11.547
    2    HA   LYS  57           HA       LYS  57  17.576  -9.043 -14.120
    3    HB2  LYS  57           HB2      LYS  57  19.366  -9.274 -12.372
    4    HB3  LYS  57           HB3      LYS  57  18.267 -10.271 -11.429
    5    HG2  LYS  57           HG2      LYS  57  18.173 -11.922 -13.240
    6    HG3  LYS  57           HG3      LYS  57  19.230 -10.922 -14.231
    7    HD2  LYS  57           HD2      LYS  57  21.024 -11.147 -12.542
    8    HD3  LYS  57           HD3      LYS  57  19.972 -12.167 -11.561
    9    HE2  LYS  57           HE2      LYS  57  19.833 -13.805 -13.418
   10    HE3  LYS  57           HE3      LYS  57  20.906 -12.801 -14.390
   11    HZ1  LYS  57           HZ1      LYS  57  22.581 -13.027 -12.621
   12    HZ3  LYS  57           HZ2      LYS  57  22.169 -14.511 -13.335
   13    HZ2  LYS  57           HZ3      LYS  57  21.556 -14.102 -11.806

  No H/Q in entry =          13
  In of MODEL   28
    1    H    LEU  58           H        LEU  58  15.795  -9.713 -11.145
    2    HA   LEU  58           HA       LEU  58  14.596 -12.102 -12.071
    3    HB2  LEU  58           HB2      LEU  58  13.780 -10.193  -9.886
    4    HB3  LEU  58           HB3      LEU  58  12.988 -11.739 -10.196
    5    HG   LEU  58           HG       LEU  58  15.957 -11.432  -9.637
    6   HD11  LEU  58          HD11      LEU  58  13.586 -11.862  -7.847
    7   HD13  LEU  58          HD12      LEU  58  15.030 -10.885  -7.586
    8   HD12  LEU  58          HD13      LEU  58  15.118 -12.640  -7.443
    9   HD22  LEU  58          HD21      LEU  58  15.860 -13.500 -10.655
   10   HD21  LEU  58          HD22      LEU  58  14.147 -13.723 -10.297
   11   HD23  LEU  58          HD23      LEU  58  15.356 -14.007  -9.044

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  59           H        ILE  59  13.896  -8.774 -12.770
    2    HA   ILE  59           HA       ILE  59  11.189  -9.451 -13.713
    3    HB   ILE  59           HB       ILE  59  11.963  -7.159 -12.514
    4   HG12  ILE  59          HG12      ILE  59  10.078  -7.059 -14.881
    5   HG13  ILE  59          HG13      ILE  59   9.650  -7.824 -13.372
    6   HG21  ILE  59          HG21      ILE  59  13.520  -6.757 -14.565
    7   HG23  ILE  59          HG22      ILE  59  12.535  -5.423 -14.010
    8   HG22  ILE  59          HG23      ILE  59  12.051  -6.358 -15.423
    9   HD11  ILE  59          HD11      ILE  59  10.196  -5.683 -12.182
   10   HD13  ILE  59          HD12      ILE  59   8.833  -5.552 -13.293
   11   HD12  ILE  59          HD13      ILE  59  10.417  -4.933 -13.764

  No H/Q in entry =          11
  In of MODEL   28
    1    H    GLU  60           H        GLU  60  14.387  -8.576 -14.969
    2    HA   GLU  60           HA       GLU  60  13.609  -8.196 -17.680
    3    HB2  GLU  60           HB2      GLU  60  15.781  -7.443 -16.816
    4    HB3  GLU  60           HB3      GLU  60  16.258  -9.114 -16.527
    5    HG2  GLU  60           HG2      GLU  60  16.067  -9.592 -18.943
    6    HG3  GLU  60           HG3      GLU  60  15.586  -7.921 -19.235

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLY  61           H        GLY  61  14.609 -11.060 -15.850
    2    HA3  GLY  61           HA2      GLY  61  14.087 -12.724 -18.244
    3    HA2  GLY  61           HA3      GLY  61  15.121 -13.189 -16.898

  No H/Q in entry =           3
  In of MODEL   28
    1    H    ASP  62           H        ASP  62  11.988 -11.669 -16.536
    2    HA   ASP  62           HA       ASP  62  11.076 -13.786 -14.824
    3    HB2  ASP  62           HB2      ASP  62   9.017 -12.386 -14.688
    4    HB3  ASP  62           HB3      ASP  62  10.493 -11.516 -14.279

  No H/Q in entry =           4
  In of MODEL   28
    1    H    ALA  63           H        ALA  63  11.130 -13.575 -18.167
    2    HA   ALA  63           HA       ALA  63   8.554 -14.470 -18.944
    3    HB1  ALA  63           HB1      ALA  63  11.297 -14.795 -20.161
    4    HB3  ALA  63           HB2      ALA  63  10.000 -13.715 -20.667
    5    HB2  ALA  63           HB3      ALA  63   9.852 -15.453 -20.929

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLY  64           H        GLY  64  11.447 -16.170 -17.871
    2    HA3  GLY  64           HA2      GLY  64  11.854 -18.359 -17.315
    3    HA2  GLY  64           HA3      GLY  64  10.212 -18.340 -16.685

  No H/Q in entry =           3
  In of MODEL   28
    1    H    GLU  65           H        GLU  65   8.744 -19.654 -17.634
    2    HA   GLU  65           HA       GLU  65   9.566 -21.464 -19.643
    3    HB2  GLU  65           HB2      GLU  65   6.838 -20.845 -18.521
    4    HB3  GLU  65           HB3      GLU  65   7.153 -22.152 -19.662
    5    HG2  GLU  65           HG2      GLU  65   8.754 -23.161 -18.116
    6    HG3  GLU  65           HG3      GLU  65   8.537 -21.828 -16.984

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLY  66           H        GLY  66   7.734 -21.887 -21.398
    2    HA3  GLY  66           HA2      GLY  66   8.184 -20.060 -23.492
    3    HA2  GLY  66           HA3      GLY  66   7.061 -21.404 -23.518

  No H/Q in entry =           3
  In of MODEL   28
    1    H    LYS  67           H        LYS  67   5.475 -20.459 -21.310
    2    HA   LYS  67           HA       LYS  67   3.658 -18.826 -22.765
    3    HB2  LYS  67           HB2      LYS  67   3.648 -19.887 -19.945
    4    HB3  LYS  67           HB3      LYS  67   2.307 -18.976 -20.647
    5    HG2  LYS  67           HG2      LYS  67   2.140 -20.601 -22.485
    6    HG3  LYS  67           HG3      LYS  67   3.501 -21.504 -21.825
    7    HD2  LYS  67           HD2      LYS  67   2.196 -21.914 -19.752
    8    HD3  LYS  67           HD3      LYS  67   0.823 -21.072 -20.473
    9    HE2  LYS  67           HE2      LYS  67   2.167 -23.509 -21.679
   10    HE3  LYS  67           HE3      LYS  67   0.679 -23.556 -20.735
   11    HZ2  LYS  67           HZ1      LYS  67   1.144 -22.331 -23.378
   12    HZ1  LYS  67           HZ2      LYS  67  -0.155 -21.837 -22.403
   13    HZ3  LYS  67           HZ3      LYS  67  -0.042 -23.452 -22.921

  No H/Q in entry =          13
  In of MODEL   28
    1    H    MET  68           H        MET  68   2.630 -16.923 -22.019
    2    HA   MET  68           HA       MET  68   4.368 -14.756 -21.667
    3    HB2  MET  68           HB2      MET  68   1.378 -14.936 -21.294
    4    HB3  MET  68           HB3      MET  68   2.293 -13.433 -21.412
    5    HG2  MET  68           HG2      MET  68   2.242 -15.595 -23.535
    6    HG3  MET  68           HG3      MET  68   1.311 -14.099 -23.596
    7    HE1  MET  68           HE1      MET  68   2.187 -11.968 -23.136
    8    HE3  MET  68           HE2      MET  68   3.583 -11.300 -23.975
    9    HE2  MET  68           HE3      MET  68   3.761 -11.908 -22.331

  No H/Q in entry =           9
  In of MODEL   28
    1    H    LYS  69           H        LYS  69   2.307 -16.400 -19.249
    2    HA   LYS  69           HA       LYS  69   2.338 -14.644 -17.179
    3    HB2  LYS  69           HB2      LYS  69   1.186 -16.810 -17.150
    4    HB3  LYS  69           HB3      LYS  69   2.734 -17.625 -16.911
    5    HG2  LYS  69           HG2      LYS  69   3.085 -16.429 -14.811
    6    HG3  LYS  69           HG3      LYS  69   1.601 -15.509 -15.060
    7    HD2  LYS  69           HD2      LYS  69   0.291 -17.600 -14.978
    8    HD3  LYS  69           HD3      LYS  69   1.777 -18.516 -14.712
    9    HE2  LYS  69           HE2      LYS  69   2.190 -17.259 -12.634
   10    HE3  LYS  69           HE3      LYS  69   0.717 -16.328 -12.900
   11    HZ3  LYS  69           HZ1      LYS  69  -0.186 -17.932 -11.641
   12    HZ2  LYS  69           HZ2      LYS  69   1.044 -19.054 -11.972
   13    HZ1  LYS  69           HZ3      LYS  69  -0.215 -18.815 -13.088

  No H/Q in entry =          13
  In of MODEL   28
    1    H    VAL  70           H        VAL  70   3.527 -14.302 -15.229
    2    HA   VAL  70           HA       VAL  70   6.435 -14.844 -15.469
    3    HB   VAL  70           HB       VAL  70   6.767 -12.723 -14.244
    4   HG13  VAL  70          HG11      VAL  70   6.816 -12.656 -16.678
    5   HG12  VAL  70          HG12      VAL  70   6.007 -11.206 -16.085
    6   HG11  VAL  70          HG13      VAL  70   5.058 -12.538 -16.741
    7   HG22  VAL  70          HG21      VAL  70   4.822 -12.412 -12.931
    8   HG21  VAL  70          HG22      VAL  70   3.751 -12.739 -14.293
    9   HG23  VAL  70          HG23      VAL  70   4.622 -11.208 -14.205

  No H/Q in entry =           9
  In of MODEL   28
    1    H    SER  71           H        SER  71   7.548 -14.754 -13.302
    2    HA   SER  71           HA       SER  71   6.537 -16.706 -11.535
    3    HB2  SER  71           HB2      SER  71   8.949 -16.091 -11.758
    4    HB3  SER  71           HB3      SER  71   8.602 -14.571 -10.935
    5    HG   SER  71           HG       SER  71   7.626 -16.060  -9.277

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU  72           H        LEU  72   5.134 -16.576  -9.910
    2    HA   LEU  72           HA       LEU  72   3.562 -14.275  -9.479
    3    HB2  LEU  72           HB2      LEU  72   3.868 -16.820  -7.894
    4    HB3  LEU  72           HB3      LEU  72   2.684 -15.573  -7.509
    5    HG   LEU  72           HG       LEU  72   2.876 -16.905 -10.233
    6   HD11  LEU  72          HD11      LEU  72   2.311 -18.539  -8.439
    7   HD13  LEU  72          HD12      LEU  72   0.959 -18.261  -9.535
    8   HD12  LEU  72          HD13      LEU  72   0.974 -17.500  -7.945
    9   HD22  LEU  72          HD21      LEU  72   1.653 -14.932 -10.550
   10   HD21  LEU  72          HD22      LEU  72   0.978 -14.953  -8.929
   11   HD23  LEU  72          HD23      LEU  72   0.373 -16.071 -10.147

  No H/Q in entry =          11
  In of MODEL   28
    1    H    VAL  73           H        VAL  73   6.226 -15.680  -7.693
    2    HA   VAL  73           HA       VAL  73   6.145 -14.138  -5.367
    3    HB   VAL  73           HB       VAL  73   8.326 -14.934  -4.925
    4   HG11  VAL  73          HG11      VAL  73   6.488 -16.656  -5.153
    5   HG13  VAL  73          HG12      VAL  73   8.118 -17.292  -5.373
    6   HG12  VAL  73          HG13      VAL  73   7.092 -16.989  -6.775
    7   HG23  VAL  73          HG21      VAL  73   9.529 -16.088  -6.981
    8   HG22  VAL  73          HG22      VAL  73   9.682 -14.351  -6.721
    9   HG21  VAL  73          HG23      VAL  73   8.540 -14.967  -7.916

  No H/Q in entry =           9
  In of MODEL   28
    1    H    LEU  74           H        LEU  74   7.137 -13.249  -8.544
    2    HA   LEU  74           HA       LEU  74   9.063 -11.280  -8.054
    3    HB2  LEU  74           HB2      LEU  74   8.621 -12.042 -10.290
    4    HB3  LEU  74           HB3      LEU  74   6.950 -11.490 -10.197
    5    HG   LEU  74           HG       LEU  74   7.729  -9.156  -9.994
    6   HD12  LEU  74          HD11      LEU  74  10.226  -8.825 -10.560
    7   HD11  LEU  74          HD12      LEU  74  10.428 -10.510 -10.085
    8   HD13  LEU  74          HD13      LEU  74   9.840  -9.329  -8.915
    9   HD23  LEU  74          HD21      LEU  74   9.234 -10.256 -12.311
   10   HD22  LEU  74          HD22      LEU  74   8.085  -8.941 -12.230
   11   HD21  LEU  74          HD23      LEU  74   7.507 -10.592 -12.208

  No H/Q in entry =          11
  In of MODEL   28
    1    H    VAL  75           H        VAL  75   5.565 -10.928  -8.420
    2    HA   VAL  75           HA       VAL  75   5.442  -8.171  -7.844
    3    HB   VAL  75           HB       VAL  75   3.370 -10.331  -7.454
    4   HG12  VAL  75          HG11      VAL  75   1.769  -8.393  -7.361
    5   HG11  VAL  75          HG12      VAL  75   3.146  -7.302  -7.331
    6   HG13  VAL  75          HG13      VAL  75   2.879  -8.410  -5.994
    7   HG23  VAL  75          HG21      VAL  75   3.548  -8.165  -9.561
    8   HG22  VAL  75          HG22      VAL  75   2.552  -9.619  -9.582
    9   HG21  VAL  75          HG23      VAL  75   4.300  -9.743  -9.785

  No H/Q in entry =           9
  In of MODEL   28
    1    H    GLU  76           H        GLU  76   5.207 -11.041  -5.724
    2    HA   GLU  76           HA       GLU  76   4.717  -9.675  -3.310
    3    HB2  GLU  76           HB2      GLU  76   4.567 -12.146  -3.541
    4    HB3  GLU  76           HB3      GLU  76   6.306 -12.227  -3.761
    5    HG2  GLU  76           HG2      GLU  76   5.848 -12.803  -1.466
    6    HG3  GLU  76           HG3      GLU  76   6.575 -11.207  -1.454

  No H/Q in entry =           6
  In of MODEL   28
    1    H    ALA  77           H        ALA  77   7.790 -10.561  -4.858
    2    HA   ALA  77           HA       ALA  77   9.462  -9.495  -2.840
    3    HB2  ALA  77           HB1      ALA  77  11.177  -9.407  -4.720
    4    HB3  ALA  77           HB2      ALA  77   9.904 -10.006  -5.783
    5    HB1  ALA  77           HB3      ALA  77  10.444 -10.983  -4.419

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLN  78           H        GLN  78   8.069  -8.101  -5.765
    2    HA   GLN  78           HA       GLN  78   9.400  -5.610  -5.666
    3    HB2  GLN  78           HB2      GLN  78   8.122  -6.541  -7.626
    4    HB3  GLN  78           HB3      GLN  78   6.630  -6.178  -6.757
    5    HG2  GLN  78           HG2      GLN  78   7.246  -3.802  -6.671
    6    HG3  GLN  78           HG3      GLN  78   8.751  -4.151  -7.521
    7   HE21  GLN  78          HE21      GLN  78   6.825  -2.360  -8.649
    8   HE22  GLN  78          HE22      GLN  78   6.163  -3.089 -10.032

  No H/Q in entry =           8
  In of MODEL   28
    1    H    LEU  79           H        LEU  79   6.385  -6.767  -4.243
    2    HA   LEU  79           HA       LEU  79   5.367  -4.365  -3.248
    3    HB2  LEU  79           HB2      LEU  79   4.069  -6.427  -3.189
    4    HB3  LEU  79           HB3      LEU  79   5.215  -7.152  -2.066
    5    HG   LEU  79           HG       LEU  79   4.642  -5.508  -0.348
    6   HD13  LEU  79          HD11      LEU  79   4.165  -3.501  -1.409
    7   HD12  LEU  79          HD12      LEU  79   2.542  -4.038  -0.975
    8   HD11  LEU  79          HD13      LEU  79   3.131  -4.262  -2.620
    9   HD23  LEU  79          HD21      LEU  79   2.060  -6.021  -0.267
   10   HD22  LEU  79          HD22      LEU  79   3.209  -7.350  -0.148
   11   HD21  LEU  79          HD23      LEU  79   2.400  -7.026  -1.678

  No H/Q in entry =          11
  In of MODEL   28
    1    H    HIS  80           H        HIS  80   7.561  -6.676  -1.646
    2    HA   HIS  80           HA       HIS  80   7.827  -5.122   0.718
    3    HB2  HIS  80           HB2      HIS  80   9.189  -7.479  -0.466
    4    HB3  HIS  80           HB3      HIS  80  10.087  -6.571   0.752
    5    HD1  HIS  80           HD1      HIS  80   9.591  -7.201   3.095
    6    HD2  HIS  80           HD2      HIS  80   6.392  -8.087   0.572
    7    HE1  HIS  80           HE1      HIS  80   7.821  -8.312   4.540
    8    HE2  HIS  80           HE2      HIS  80   5.865  -8.857   3.010

  No H/Q in entry =           8
  In of MODEL   28
    1    H    LEU  81           H        LEU  81   9.847  -5.394  -2.184
    2    HA   LEU  81           HA       LEU  81  11.874  -3.633  -1.304
    3    HB2  LEU  81           HB2      LEU  81  10.972  -4.444  -4.068
    4    HB3  LEU  81           HB3      LEU  81  12.383  -3.426  -3.775
    5    HG   LEU  81           HG       LEU  81  12.005  -6.145  -2.492
    6   HD12  LEU  81          HD11      LEU  81  13.834  -6.764  -4.231
    7   HD11  LEU  81          HD12      LEU  81  13.261  -5.348  -5.111
    8   HD13  LEU  81          HD13      LEU  81  12.158  -6.680  -4.772
    9   HD23  LEU  81          HD21      LEU  81  14.631  -5.810  -2.467
   10   HD22  LEU  81          HD22      LEU  81  13.637  -5.052  -1.224
   11   HD21  LEU  81          HD23      LEU  81  14.215  -4.101  -2.593

  No H/Q in entry =          11
  In of MODEL   28
    1    H    MET  82           H        MET  82   8.956  -3.026  -3.257
    2    HA   MET  82           HA       MET  82   9.478  -0.299  -3.766
    3    HB2  MET  82           HB2      MET  82   6.930  -1.911  -3.647
    4    HB3  MET  82           HB3      MET  82   6.918  -0.188  -4.018
    5    HG2  MET  82           HG2      MET  82   8.541  -2.256  -5.537
    6    HG3  MET  82           HG3      MET  82   6.972  -1.647  -6.060
    7    HE3  MET  82           HE1      MET  82   7.401   1.806  -7.243
    8    HE2  MET  82           HE2      MET  82   7.020   1.584  -5.538
    9    HE1  MET  82           HE3      MET  82   6.369   0.465  -6.731

  No H/Q in entry =           9
  In of MODEL   28
    1    H    THR  83           H        THR  83   7.685  -1.899  -1.163
    2    HA   THR  83           HA       THR  83   6.811   0.448   0.150
    3    HB   THR  83           HB       THR  83   6.678  -1.119   2.173
    4    HG1  THR  83           HG1      THR  83   7.450  -3.065   1.955
    5   HG22  THR  83          HG21      THR  83   5.043  -2.702   0.704
    6   HG21  THR  83          HG22      THR  83   5.266  -1.377  -0.432
    7   HG23  THR  83          HG23      THR  83   4.615  -1.060   1.176

  No H/Q in entry =           7
  In of MODEL   28
    1    H    SER  84           H        SER  84   9.647  -1.628   0.693
    2    HA   SER  84           HA       SER  84  10.686  -0.181   2.880
    3    HB2  SER  84           HB2      SER  84  11.961  -2.024   0.869
    4    HB3  SER  84           HB3      SER  84  12.897  -1.259   2.152
    5    HG   SER  84           HG       SER  84  10.632  -2.963   2.407

  No H/Q in entry =           5
  In of MODEL   28
    1    H    MET  85           H        MET  85  11.454   0.071  -0.605
    2    HA   MET  85           HA       MET  85  13.438   2.050  -0.353
    3    HB2  MET  85           HB2      MET  85  13.057   0.755  -2.415
    4    HB3  MET  85           HB3      MET  85  11.529   1.603  -2.655
    5    HG2  MET  85           HG2      MET  85  12.721   3.751  -2.783
    6    HG3  MET  85           HG3      MET  85  14.252   2.927  -2.503
    7    HE2  MET  85           HE1      MET  85  15.428   1.651  -5.697
    8    HE1  MET  85           HE2      MET  85  15.409   1.389  -3.956
    9    HE3  MET  85           HE3      MET  85  15.750   2.994  -4.590

  No H/Q in entry =           9
  In of MODEL   28
    1    H    LEU  86           H        LEU  86   9.949   2.360  -0.880
    2    HA   LEU  86           HA       LEU  86   9.868   5.172  -1.073
    3    HB2  LEU  86           HB2      LEU  86   8.037   3.498  -1.651
    4    HB3  LEU  86           HB3      LEU  86   7.699   3.413   0.078
    5    HG   LEU  86           HG       LEU  86   7.522   5.972   0.014
    6   HD11  LEU  86          HD11      LEU  86   8.314   5.531  -2.682
    7   HD13  LEU  86          HD12      LEU  86   7.865   7.058  -1.930
    8   HD12  LEU  86          HD13      LEU  86   6.638   6.084  -2.737
    9   HD23  LEU  86          HD21      LEU  86   5.405   4.600  -1.653
   10   HD22  LEU  86          HD22      LEU  86   5.201   5.863  -0.443
   11   HD21  LEU  86          HD23      LEU  86   5.609   4.223   0.058

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ALA  87           H        ALA  87   9.402   3.001   1.679
    2    HA   ALA  87           HA       ALA  87   8.832   4.920   3.638
    3    HB1  ALA  87           HB1      ALA  87   9.657   2.104   3.567
    4    HB3  ALA  87           HB2      ALA  87   8.522   2.914   4.644
    5    HB2  ALA  87           HB3      ALA  87  10.249   2.957   4.996

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ARG  88           H        ARG  88  11.929   3.510   2.678
    2    HA   ARG  88           HA       ARG  88  13.521   4.906   4.512
    3    HB2  ARG  88           HB2      ARG  88  14.208   2.931   3.120
    4    HB3  ARG  88           HB3      ARG  88  14.361   4.019   1.743
    5    HG2  ARG  88           HG2      ARG  88  15.817   5.350   3.691
    6    HG3  ARG  88           HG3      ARG  88  16.146   3.664   4.079
    7    HD2  ARG  88           HD2      ARG  88  17.423   3.367   2.239
    8    HD3  ARG  88           HD3      ARG  88  16.286   4.228   1.197
    9    HE   ARG  88           HE       ARG  88  18.669   5.310   2.251
   10   HH21  ARG  88          HH11      ARG  88  19.002   7.530   2.049
   11   HH22  ARG  88          HH12      ARG  88  17.645   8.593   1.895
   12   HH11  ARG  88          HH21      ARG  88  15.327   6.042   1.955
   13   HH12  ARG  88          HH22      ARG  88  15.563   7.748   1.817

  No H/Q in entry =          13
  In of MODEL   28
    1    H    GLU  89           H        GLU  89  12.558   5.784   1.181
    2    HA   GLU  89           HA       GLU  89  14.091   8.153   1.022
    3    HB2  GLU  89           HB2      GLU  89  12.962   7.097  -0.927
    4    HB3  GLU  89           HB3      GLU  89  11.411   7.632  -0.278
    5    HG2  GLU  89           HG2      GLU  89  12.100   9.973  -0.447
    6    HG3  GLU  89           HG3      GLU  89  13.709   9.490  -0.974

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LEU  90           H        LEU  90  10.760   7.628   2.139
    2    HA   LEU  90           HA       LEU  90  10.226  10.360   2.701
    3    HB2  LEU  90           HB2      LEU  90   9.042   7.784   3.733
    4    HB3  LEU  90           HB3      LEU  90   8.400   9.377   4.147
    5    HG   LEU  90           HG       LEU  90   8.836   8.488   1.283
    6   HD12  LEU  90          HD11      LEU  90   6.304   8.144   1.335
    7   HD11  LEU  90          HD12      LEU  90   6.451   8.141   3.093
    8   HD13  LEU  90          HD13      LEU  90   7.281   6.913   2.137
    9   HD22  LEU  90          HD21      LEU  90   8.528  10.794   1.199
   10   HD21  LEU  90          HD22      LEU  90   7.535  10.826   2.655
   11   HD23  LEU  90          HD23      LEU  90   6.848  10.260   1.132

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  91           H        ILE  91  11.496   7.694   4.639
    2    HA   ILE  91           HA       ILE  91  11.617   9.070   7.103
    3    HB   ILE  91           HB       ILE  91  13.191   6.737   5.995
    4   HG12  ILE  91          HG12      ILE  91  11.163   6.901   8.245
    5   HG13  ILE  91          HG13      ILE  91  10.702   6.610   6.569
    6   HG22  ILE  91          HG21      ILE  91  13.650   6.536   8.639
    7   HG21  ILE  91          HG22      ILE  91  13.564   8.294   8.530
    8   HG23  ILE  91          HG23      ILE  91  14.752   7.410   7.575
    9   HD13  ILE  91          HD11      ILE  91  11.718   4.514   6.511
   10   HD12  ILE  91          HD12      ILE  91  11.117   4.575   8.168
   11   HD11  ILE  91          HD13      ILE  91  12.818   4.898   7.836

  No H/Q in entry =          11
  In of MODEL   28
    1    H    THR  92           H        THR  92  13.847   8.904   4.361
    2    HA   THR  92           HA       THR  92  15.999  10.314   5.525
    3    HB   THR  92           HB       THR  92  15.026  10.172   2.660
    4    HG1  THR  92           HG1      THR  92  15.868   8.282   3.076
    5   HG22  THR  92          HG21      THR  92  17.593  10.877   2.375
    6   HG21  THR  92          HG22      THR  92  17.273  11.702   3.900
    7   HG23  THR  92          HG23      THR  92  16.307  12.078   2.474

  No H/Q in entry =           7
  In of MODEL   28
    1    H    GLU  93           H        GLU  93  13.112  11.443   3.779
    2    HA   GLU  93           HA       GLU  93  13.690  14.208   3.884
    3    HB2  GLU  93           HB2      GLU  93  10.994  12.819   3.892
    4    HB3  GLU  93           HB3      GLU  93  11.273  14.518   3.515
    5    HG2  GLU  93           HG2      GLU  93  12.631  12.279   2.002
    6    HG3  GLU  93           HG3      GLU  93  11.083  12.950   1.506

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LEU  94           H        LEU  94  11.951  12.050   6.097
    2    HA   LEU  94           HA       LEU  94  11.121  13.998   7.962
    3    HB2  LEU  94           HB2      LEU  94  11.714  11.048   8.250
    4    HB3  LEU  94           HB3      LEU  94  11.131  12.026   9.594
    5    HG   LEU  94           HG       LEU  94   9.658  12.058   6.959
    6   HD11  LEU  94          HD11      LEU  94   9.746   9.845   8.972
    7   HD13  LEU  94          HD12      LEU  94   9.452   9.775   7.236
    8   HD12  LEU  94          HD13      LEU  94   8.165  10.288   8.327
    9   HD23  LEU  94          HD21      LEU  94   7.729  12.452   8.549
   10   HD22  LEU  94          HD22      LEU  94   8.960  13.714   8.586
   11   HD21  LEU  94          HD23      LEU  94   8.899  12.502   9.865

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  95           H        ILE  95  14.108  12.087   7.745
    2    HA   ILE  95           HA       ILE  95  15.260  13.025  10.160
    3    HB   ILE  95           HB       ILE  95  16.516  11.954   7.621
    4   HG12  ILE  95          HG12      ILE  95  16.216  10.762  10.392
    5   HG13  ILE  95          HG13      ILE  95  15.056  10.492   9.093
    6   HG21  ILE  95          HG21      ILE  95  17.755  12.779  10.265
    7   HG23  ILE  95          HG22      ILE  95  18.221  13.304   8.646
    8   HG22  ILE  95          HG23      ILE  95  18.535  11.648   9.162
    9   HD13  ILE  95          HD11      ILE  95  16.550   9.217   7.842
   10   HD12  ILE  95          HD12      ILE  95  17.018   8.778   9.481
   11   HD11  ILE  95          HD13      ILE  95  17.968   9.960   8.581

  No H/Q in entry =          11
  In of MODEL   28
    1    H    GLU  96           H        GLU  96  15.420  14.247   6.821
    2    HA   GLU  96           HA       GLU  96  17.252  16.338   7.297
    3    HB2  GLU  96           HB2      GLU  96  16.601  15.663   5.038
    4    HB3  GLU  96           HB3      GLU  96  14.953  16.211   5.330
    5    HG2  GLU  96           HG2      GLU  96  15.509  18.342   4.781
    6    HG3  GLU  96           HG3      GLU  96  16.802  18.355   5.969

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LEU  97           H        LEU  97  13.740  16.132   7.713
    2    HA   LEU  97           HA       LEU  97  13.305  18.865   8.343
    3    HB2  LEU  97           HB2      LEU  97  11.799  16.333   8.961
    4    HB3  LEU  97           HB3      LEU  97  11.274  17.879   9.624
    5    HG   LEU  97           HG       LEU  97  11.772  17.454   6.663
    6   HD12  LEU  97          HD11      LEU  97   9.250  17.310   6.535
    7   HD11  LEU  97          HD12      LEU  97   9.237  17.118   8.286
    8   HD13  LEU  97          HD13      LEU  97  10.030  15.911   7.272
    9   HD23  LEU  97          HD21      LEU  97  10.022  19.408   6.680
   10   HD22  LEU  97          HD22      LEU  97  11.699  19.779   7.078
   11   HD21  LEU  97          HD23      LEU  97  10.506  19.607   8.364

  No H/Q in entry =          11
  In of MODEL   28
    1    H    HIS  98           H        HIS  98  14.136  16.052  10.353
    2    HA   HIS  98           HA       HIS  98  13.960  17.322  12.863
    3    HB2  HIS  98           HB2      HIS  98  15.727  15.071  11.877
    4    HB3  HIS  98           HB3      HIS  98  15.716  15.616  13.556
    5    HD1  HIS  98           HD1      HIS  98  13.537  13.963  10.962
    6    HD2  HIS  98           HD2      HIS  98  13.408  14.898  15.022
    7    HE1  HIS  98           HE1      HIS  98  11.515  12.760  11.911
    8    HE2  HIS  98           HE2      HIS  98  11.417  13.321  14.380

  No H/Q in entry =           8
  In of MODEL   28
    1    H    GLU  99           H        GLU  99  16.524  17.212  10.439
    2    HA   GLU  99           HA       GLU  99  18.495  18.562  11.971
    3    HB2  GLU  99           HB2      GLU  99  18.990  17.269   9.908
    4    HB3  GLU  99           HB3      GLU  99  18.177  18.515   8.959
    5    HG2  GLU  99           HG2      GLU  99  19.772  20.199   9.750
    6    HG3  GLU  99           HG3      GLU  99  20.554  19.005  10.781

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LYS 100           H        LYS 100  15.973  19.701   9.740
    2    HA   LYS 100           HA       LYS 100  16.754  22.443   9.876
    3    HB2  LYS 100           HB2      LYS 100  14.132  21.136   9.116
    4    HB3  LYS 100           HB3      LYS 100  14.422  22.876   9.020
    5    HG2  LYS 100           HG2      LYS 100  16.402  22.433   7.563
    6    HG3  LYS 100           HG3      LYS 100  15.999  20.714   7.586
    7    HD2  LYS 100           HD2      LYS 100  13.804  21.207   6.575
    8    HD3  LYS 100           HD3      LYS 100  14.191  22.928   6.559
    9    HE2  LYS 100           HE2      LYS 100  16.159  22.453   5.109
   10    HE3  LYS 100           HE3      LYS 100  15.703  20.745   5.081
   11    HZ1  LYS 100           HZ1      LYS 100  13.869  22.925   4.230
   12    HZ3  LYS 100           HZ2      LYS 100  13.695  21.253   3.974
   13    HZ2  LYS 100           HZ3      LYS 100  14.904  22.119   3.154

  No H/Q in entry =          13
  In of MODEL   28
    1    H    LEU 101           H        LEU 101  14.661  20.393  11.841
    2    HA   LEU 101           HA       LEU 101  13.477  22.460  13.407
    3    HB2  LEU 101           HB2      LEU 101  13.934  19.515  13.804
    4    HB3  LEU 101           HB3      LEU 101  13.387  20.497  15.159
    5    HG   LEU 101           HG       LEU 101  11.979  20.567  12.484
    6   HD12  LEU 101          HD11      LEU 101  10.324  18.999  13.753
    7   HD11  LEU 101          HD12      LEU 101  11.717  18.598  14.754
    8   HD13  LEU 101          HD13      LEU 101  11.758  18.285  13.019
    9   HD21  LEU 101          HD21      LEU 101  11.307  21.368  15.331
   10   HD23  LEU 101          HD22      LEU 101  10.052  21.131  14.116
   11   HD22  LEU 101          HD23      LEU 101  11.281  22.371  13.879

  No H/Q in entry =          11
  In of MODEL   28
    1    H    LYS 102           H        LYS 102  16.629  21.868  12.985
    2    HA   LYS 102           HA       LYS 102  18.467  22.753  14.061
    3    HB2  LYS 102           HB2      LYS 102  16.640  24.262  15.182
    4    HB3  LYS 102           HB3      LYS 102  16.848  23.206  16.564
    5    HG2  LYS 102           HG2      LYS 102  18.735  25.223  15.394
    6    HG3  LYS 102           HG3      LYS 102  18.348  24.913  17.073
    7    HD2  LYS 102           HD2      LYS 102  20.032  23.003  15.401
    8    HD3  LYS 102           HD3      LYS 102  20.710  24.332  16.331
    9    HE2  LYS 102           HE2      LYS 102  20.322  21.785  17.308
   10    HE3  LYS 102           HE3      LYS 102  20.529  23.232  18.294
   11    HZ2  LYS 102           HZ1      LYS 102  18.565  21.940  18.910
   12    HZ1  LYS 102           HZ2      LYS 102  17.926  22.160  17.357
   13    HZ3  LYS 102           HZ3      LYS 102  18.145  23.495  18.379

  No H/Q in entry =          13
  In of MODEL   28
    1    H    ALA 103           H        ALA 103  16.395  21.146  16.481
    2    HA   ALA 103           HA       ALA 103  18.122  19.950  18.147
    3    HB2  ALA 103           HB1      ALA 103  16.548  17.934  18.143
    4    HB1  ALA 103           HB2      ALA 103  15.653  18.778  16.879
    5    HB3  ALA 103           HB3      ALA 103  15.821  19.506  18.475

  No H/Q in entry =           5
  In of MODEL   28
    1    H1   ALA   1           H3       ALA   1  -1.515  -7.155 -21.448
    2    H2   ALA   1           H2       ALA   1  -2.304  -8.592 -20.993
    3    H3   ALA   1           H1       ALA   1  -0.694  -8.636 -21.541
    4    HA   ALA   1           HA       ALA   1  -1.518  -9.117 -23.539
    5    HB1  ALA   1           HB1      ALA   1  -3.653  -9.843 -23.072
    6    HB2  ALA   1           HB2      ALA   1  -4.096  -8.338 -23.876
    7    HB3  ALA   1           HB3      ALA   1  -4.042  -8.411 -22.117

  No H/Q in entry =           7
  In of MODEL   28
    1    H    GLU   2           H        GLU   2  -2.346  -7.937 -25.536
    2    HA   GLU   2           HA       GLU   2  -0.953  -5.920 -26.416
    3    HB2  GLU   2           HB2      GLU   2  -3.959  -6.003 -26.745
    4    HB3  GLU   2           HB3      GLU   2  -2.838  -5.138 -27.793
    5    HG2  GLU   2           HG2      GLU   2  -2.321  -7.030 -28.939
    6    HG3  GLU   2           HG3      GLU   2  -2.025  -7.929 -27.457

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLU   3           H        GLU   3  -4.123  -4.675 -25.533
    2    HA   GLU   3           HA       GLU   3  -3.091  -2.112 -24.909
    3    HB2  GLU   3           HB2      GLU   3  -5.774  -3.438 -24.583
    4    HB3  GLU   3           HB3      GLU   3  -5.486  -1.819 -23.941
    5    HG2  GLU   3           HG2      GLU   3  -5.126  -0.898 -26.069
    6    HG3  GLU   3           HG3      GLU   3  -4.721  -2.454 -26.787

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LEU   4           H        LEU   4  -4.679  -4.471 -22.727
    2    HA   LEU   4           HA       LEU   4  -4.330  -3.232 -20.339
    3    HB2  LEU   4           HB2      LEU   4  -3.771  -6.173 -20.796
    4    HB3  LEU   4           HB3      LEU   4  -4.187  -5.423 -19.257
    5    HG   LEU   4           HG       LEU   4  -5.949  -5.513 -21.728
    6   HD13  LEU   4          HD11      LEU   4  -7.138  -7.233 -20.729
    7   HD12  LEU   4          HD12      LEU   4  -6.663  -6.765 -19.097
    8   HD11  LEU   4          HD13      LEU   4  -5.518  -7.607 -20.141
    9   HD23  LEU   4          HD21      LEU   4  -7.645  -4.704 -19.870
   10   HD22  LEU   4          HD22      LEU   4  -6.609  -3.530 -20.680
   11   HD21  LEU   4          HD23      LEU   4  -6.187  -4.113 -19.071

  No H/Q in entry =          11
  In of MODEL   28
    1    H    GLU   5           H        GLU   5  -1.817  -5.070 -22.054
    2    HA   GLU   5           HA       GLU   5   0.157  -4.769 -20.010
    3    HB2  GLU   5           HB2      GLU   5   0.227  -6.542 -21.766
    4    HB3  GLU   5           HB3      GLU   5   0.563  -5.295 -22.967
    5    HG2  GLU   5           HG2      GLU   5   2.677  -6.240 -22.307
    6    HG3  GLU   5           HG3      GLU   5   2.576  -4.634 -21.587

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLU   6           H        GLU   6  -0.473  -3.069 -23.063
    2    HA   GLU   6           HA       GLU   6   1.687  -1.227 -22.793
    3    HB2  GLU   6           HB2      GLU   6   0.566  -1.724 -24.956
    4    HB3  GLU   6           HB3      GLU   6  -0.888  -0.924 -24.359
    5    HG2  GLU   6           HG2      GLU   6   0.359   1.173 -24.083
    6    HG3  GLU   6           HG3      GLU   6   1.834   0.382 -24.630

  No H/Q in entry =           6
  In of MODEL   28
    1    H    VAL   7           H        VAL   7  -1.655  -1.310 -21.761
    2    HA   VAL   7           HA       VAL   7  -1.893   1.404 -20.935
    3    HB   VAL   7           HB       VAL   7  -3.347  -1.117 -20.096
    4   HG11  VAL   7          HG11      VAL   7  -3.738   1.773 -19.294
    5   HG13  VAL   7          HG12      VAL   7  -3.637   0.352 -18.253
    6   HG12  VAL   7          HG13      VAL   7  -5.066   0.612 -19.252
    7   HG21  VAL   7          HG21      VAL   7  -3.499  -0.050 -22.489
    8   HG23  VAL   7          HG22      VAL   7  -4.453   1.197 -21.685
    9   HG22  VAL   7          HG23      VAL   7  -4.991  -0.482 -21.655

  No H/Q in entry =           9
  In of MODEL   28
    1    H    VAL   8           H        VAL   8  -0.898  -1.570 -19.278
    2    HA   VAL   8           HA       VAL   8  -0.595  -0.480 -16.685
    3    HB   VAL   8           HB       VAL   8   0.809  -2.799 -18.034
    4   HG13  VAL   8          HG11      VAL   8   2.249  -2.151 -16.259
    5   HG12  VAL   8          HG12      VAL   8   1.259  -3.444 -15.582
    6   HG11  VAL   8          HG13      VAL   8   0.898  -1.762 -15.195
    7   HG23  VAL   8          HG21      VAL   8  -1.135  -3.219 -15.814
    8   HG22  VAL   8          HG22      VAL   8  -0.950  -4.101 -17.327
    9   HG21  VAL   8          HG23      VAL   8  -1.839  -2.582 -17.300

  No H/Q in entry =           9
  In of MODEL   28
    1    H    MET   9           H        MET   9   1.666  -0.780 -19.422
    2    HA   MET   9           HA       MET   9   3.942   0.277 -18.155
    3    HB2  MET   9           HB2      MET   9   3.006   0.298 -21.023
    4    HB3  MET   9           HB3      MET   9   4.520   1.060 -20.540
    5    HG2  MET   9           HG2      MET   9   5.344  -1.049 -19.633
    6    HG3  MET   9           HG3      MET   9   3.798  -1.830 -19.973
    7    HE1  MET   9           HE1      MET   9   6.744   0.039 -21.164
    8    HE3  MET   9           HE2      MET   9   5.789   0.784 -22.442
    9    HE2  MET   9           HE3      MET   9   7.025  -0.400 -22.853

  No H/Q in entry =           9
  In of MODEL   28
    1    H    GLY  10           H        GLY  10   1.258   1.862 -19.849
    2    HA3  GLY  10           HA2      GLY  10   2.210   4.520 -19.609
    3    HA2  GLY  10           HA3      GLY  10   0.523   4.053 -19.819

  No H/Q in entry =           3
  In of MODEL   28
    1    H    LEU  11           H        LEU  11   0.121   2.532 -17.529
    2    HA   LEU  11           HA       LEU  11  -0.424   4.513 -15.578
    3    HB2  LEU  11           HB2      LEU  11  -0.346   1.499 -15.412
    4    HB3  LEU  11           HB3      LEU  11  -0.864   2.524 -14.075
    5    HG   LEU  11           HG       LEU  11  -2.092   2.624 -16.843
    6   HD13  LEU  11          HD11      LEU  11  -2.671   0.481 -16.083
    7   HD12  LEU  11          HD12      LEU  11  -4.027   1.470 -15.546
    8   HD11  LEU  11          HD13      LEU  11  -2.774   0.998 -14.399
    9   HD22  LEU  11          HD21      LEU  11  -2.694   4.641 -15.845
   10   HD21  LEU  11          HD22      LEU  11  -2.623   3.981 -14.212
   11   HD23  LEU  11          HD23      LEU  11  -3.993   3.606 -15.258

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  12           H        ILE  12   2.129   2.055 -15.804
    2    HA   ILE  12           HA       ILE  12   3.324   2.605 -13.297
    3    HB   ILE  12           HB       ILE  12   4.589   1.560 -15.853
    4   HG12  ILE  12          HG12      ILE  12   2.580   0.323 -14.716
    5   HG13  ILE  12          HG13      ILE  12   3.990  -0.609 -15.178
    6   HG23  ILE  12          HG21      ILE  12   6.336   2.309 -14.355
    7   HG22  ILE  12          HG22      ILE  12   6.266   0.549 -14.256
    8   HG21  ILE  12          HG23      ILE  12   5.556   1.534 -12.978
    9   HD13  ILE  12          HD11      ILE  12   4.787  -0.588 -12.889
   10   HD12  ILE  12          HD12      ILE  12   3.111  -1.130 -12.892
   11   HD11  ILE  12          HD13      ILE  12   3.501   0.507 -12.414

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  13           H        ILE  13   3.932   3.860 -16.556
    2    HA   ILE  13           HA       ILE  13   6.061   5.590 -15.830
    3    HB   ILE  13           HB       ILE  13   4.038   5.653 -18.083
    4   HG12  ILE  13          HG12      ILE  13   5.877   3.822 -17.798
    5   HG13  ILE  13          HG13      ILE  13   5.648   4.567 -19.376
    6   HG21  ILE  13          HG21      ILE  13   6.370   7.493 -17.519
    7   HG23  ILE  13          HG22      ILE  13   4.712   7.932 -17.914
    8   HG22  ILE  13          HG23      ILE  13   5.760   7.254 -19.157
    9   HD11  ILE  13          HD11      ILE  13   7.713   5.536 -17.366
   10   HD13  ILE  13          HD12      ILE  13   7.548   6.014 -19.051
   11   HD12  ILE  13          HD13      ILE  13   8.060   4.380 -18.650

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ASN  14           H        ASN  14   2.553   6.072 -16.111
    2    HA   ASN  14           HA       ASN  14   2.500   8.820 -15.484
    3    HB2  ASN  14           HB2      ASN  14   0.615   7.169 -16.315
    4    HB3  ASN  14           HB3      ASN  14   0.288   6.995 -14.595
    5   HD21  ASN  14          HD21      ASN  14  -1.730   8.139 -16.038
    6   HD22  ASN  14          HD22      ASN  14  -1.800   9.813 -15.777

  No H/Q in entry =           6
  In of MODEL   28
    1    H    SER  15           H        SER  15   2.207   5.949 -13.399
    2    HA   SER  15           HA       SER  15   1.888   7.326 -10.956
    3    HB2  SER  15           HB2      SER  15   2.434   5.247  -9.899
    4    HB3  SER  15           HB3      SER  15   1.622   4.816 -11.399
    5    HG   SER  15           HG       SER  15   3.419   4.008 -12.140

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLY  16           H        GLY  16   4.773   6.234 -12.702
    2    HA3  GLY  16           HA2      GLY  16   6.689   7.004 -10.767
    3    HA2  GLY  16           HA3      GLY  16   6.999   6.797 -12.489

  No H/Q in entry =           3
  In of MODEL   28
    1    H    GLN  17           H        GLN  17   5.305   8.744 -13.564
    2    HA   GLN  17           HA       GLN  17   6.872  11.093 -13.259
    3    HB2  GLN  17           HB2      GLN  17   4.135  10.637 -14.473
    4    HB3  GLN  17           HB3      GLN  17   4.967  12.190 -14.534
    5    HG2  GLN  17           HG2      GLN  17   6.851  11.177 -15.713
    6    HG3  GLN  17           HG3      GLN  17   6.104   9.586 -15.587
    7   HE21  GLN  17          HE21      GLN  17   3.417  11.251 -16.034
    8   HE22  GLN  17          HE22      GLN  17   3.361  11.368 -17.726

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ALA  18           H        ALA  18   3.772  10.067 -11.916
    2    HA   ALA  18           HA       ALA  18   3.032  12.457 -10.661
    3    HB1  ALA  18           HB1      ALA  18   1.914   9.994 -10.879
    4    HB2  ALA  18           HB2      ALA  18   1.356  11.215  -9.738
    5    HB3  ALA  18           HB3      ALA  18   2.451   9.940  -9.200

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ARG  19           H        ARG  19   4.914   9.707  -9.366
    2    HA   ARG  19           HA       ARG  19   5.433  10.875  -6.847
    3    HB2  ARG  19           HB2      ARG  19   5.860   8.473  -7.364
    4    HB3  ARG  19           HB3      ARG  19   7.217   8.962  -8.383
    5    HG2  ARG  19           HG2      ARG  19   8.325  10.013  -6.460
    6    HG3  ARG  19           HG3      ARG  19   6.948   9.622  -5.431
    7    HD2  ARG  19           HD2      ARG  19   8.717   7.997  -5.062
    8    HD3  ARG  19           HD3      ARG  19   7.349   7.205  -5.850
    9    HE   ARG  19           HE       ARG  19   9.056   8.026  -7.894
   10   HH21  ARG  19          HH11      ARG  19  10.626   6.625  -8.735
   11   HH22  ARG  19          HH12      ARG  19  11.175   5.283  -7.793
   12   HH11  ARG  19          HH21      ARG  19   9.129   6.005  -5.109
   13   HH12  ARG  19          HH22      ARG  19  10.324   4.932  -5.739

  No H/Q in entry =          13
  In of MODEL   28
    1    H    SER  20           H        SER  20   7.260  10.904  -9.890
    2    HA   SER  20           HA       SER  20   9.495  12.334  -9.063
    3    HB2  SER  20           HB2      SER  20   9.543  11.453 -11.263
    4    HB3  SER  20           HB3      SER  20   8.036  12.252 -11.698
    5    HG   SER  20           HG       SER  20   9.246  14.261 -11.277

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU  21           H        LEU  21   6.393  13.582 -10.275
    2    HA   LEU  21           HA       LEU  21   7.048  16.332 -10.058
    3    HB2  LEU  21           HB2      LEU  21   4.390  14.890  -9.988
    4    HB3  LEU  21           HB3      LEU  21   4.540  16.645  -9.985
    5    HG   LEU  21           HG       LEU  21   5.765  14.871 -12.118
    6   HD13  LEU  21          HD11      LEU  21   3.382  14.577 -12.265
    7   HD12  LEU  21          HD12      LEU  21   3.838  15.727 -13.524
    8   HD11  LEU  21          HD13      LEU  21   3.097  16.302 -12.031
    9   HD21  LEU  21          HD21      LEU  21   5.475  17.843 -11.699
   10   HD23  LEU  21          HD22      LEU  21   5.525  17.216 -13.344
   11   HD22  LEU  21          HD23      LEU  21   6.882  16.946 -12.261

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ALA  22           H        ALA  22   5.541  14.042  -7.807
    2    HA   ALA  22           HA       ALA  22   4.920  15.853  -5.748
    3    HB3  ALA  22           HB1      ALA  22   4.174  13.456  -5.905
    4    HB2  ALA  22           HB2      ALA  22   4.754  13.937  -4.310
    5    HB1  ALA  22           HB3      ALA  22   5.787  12.981  -5.375

  No H/Q in entry =           5
  In of MODEL   28
    1    H    TYR  23           H        TYR  23   7.868  13.844  -6.170
    2    HA   TYR  23           HA       TYR  23   9.237  14.880  -3.916
    3    HB2  TYR  23           HB2      TYR  23  10.040  12.873  -5.065
    4    HB3  TYR  23           HB3      TYR  23  10.353  13.809  -6.526
    5    HD1  TYR  23           HD1      TYR  23  11.306  13.485  -2.931
    6    HD2  TYR  23           HD2      TYR  23  12.382  14.995  -6.807
    7    HE1  TYR  23           HE1      TYR  23  13.557  14.079  -2.076
    8    HE2  TYR  23           HE2      TYR  23  14.632  15.590  -5.952
    9    HH   TYR  23           HH       TYR  23  15.510  16.149  -3.326

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ALA  24           H        ALA  24   9.058  15.974  -7.287
    2    HA   ALA  24           HA       ALA  24  10.939  18.073  -7.041
    3    HB2  ALA  24           HB1      ALA  24  10.503  18.124  -9.252
    4    HB3  ALA  24           HB2      ALA  24   8.942  18.864  -8.900
    5    HB1  ALA  24           HB3      ALA  24   9.080  17.112  -9.024

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA  25           H        ALA  25   7.459  17.866  -6.431
    2    HA   ALA  25           HA       ALA  25   6.958  20.582  -5.873
    3    HB1  ALA  25           HB1      ALA  25   5.312  18.571  -6.073
    4    HB2  ALA  25           HB2      ALA  25   4.931  19.861  -4.930
    5    HB3  ALA  25           HB3      ALA  25   5.630  18.347  -4.352

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU  26           H        LEU  26   8.039  17.918  -3.810
    2    HA   LEU  26           HA       LEU  26   8.125  19.358  -1.378
    3    HB2  LEU  26           HB2      LEU  26   8.239  16.943  -1.364
    4    HB3  LEU  26           HB3      LEU  26   9.712  16.958  -2.330
    5    HG   LEU  26           HG       LEU  26  10.912  18.092  -0.489
    6   HD12  LEU  26          HD11      LEU  26   9.679  18.098   1.766
    7   HD11  LEU  26          HD12      LEU  26   8.195  17.946   0.827
    8   HD13  LEU  26          HD13      LEU  26   9.230  19.359   0.617
    9   HD21  LEU  26          HD21      LEU  26   9.395  15.615   0.388
   10   HD23  LEU  26          HD22      LEU  26  10.904  16.192   1.088
   11   HD22  LEU  26          HD23      LEU  26  10.868  15.627  -0.580

  No H/Q in entry =          11
  In of MODEL   28
    1    H    LYS  27           H        LYS  27  10.555  18.796  -3.893
    2    HA   LYS  27           HA       LYS  27  12.725  20.059  -2.662
    3    HB2  LYS  27           HB2      LYS  27  12.844  18.705  -4.747
    4    HB3  LYS  27           HB3      LYS  27  12.071  20.027  -5.620
    5    HG2  LYS  27           HG2      LYS  27  13.922  21.530  -5.041
    6    HG3  LYS  27           HG3      LYS  27  14.690  20.248  -4.098
    7    HD2  LYS  27           HD2      LYS  27  14.851  18.854  -6.146
    8    HD3  LYS  27           HD3      LYS  27  14.129  20.163  -7.082
    9    HE2  LYS  27           HE2      LYS  27  16.002  21.646  -6.468
   10    HE3  LYS  27           HE3      LYS  27  16.729  20.342  -5.524
   11    HZ3  LYS  27           HZ1      LYS  27  17.725  20.442  -7.707
   12    HZ2  LYS  27           HZ2      LYS  27  16.202  20.308  -8.453
   13    HZ1  LYS  27           HZ3      LYS  27  16.833  19.006  -7.561

  No H/Q in entry =          13
  In of MODEL   28
    1    H    GLN  28           H        GLN  28  10.097  21.411  -4.625
    2    HA   GLN  28           HA       GLN  28  11.034  24.071  -4.784
    3    HB2  GLN  28           HB2      GLN  28   8.208  22.981  -4.674
    4    HB3  GLN  28           HB3      GLN  28   8.614  24.653  -5.063
    5    HG2  GLN  28           HG2      GLN  28   9.656  22.246  -6.581
    6    HG3  GLN  28           HG3      GLN  28   8.283  23.223  -7.093
    7   HE21  GLN  28          HE21      GLN  28   9.113  25.818  -6.661
    8   HE22  GLN  28          HE22      GLN  28  10.521  26.152  -7.548

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ALA  29           H        ALA  29   9.109  22.371  -2.348
    2    HA   ALA  29           HA       ALA  29   8.536  24.565  -0.676
    3    HB2  ALA  29           HB1      ALA  29   7.815  22.996   0.896
    4    HB1  ALA  29           HB2      ALA  29   9.049  21.820   0.439
    5    HB3  ALA  29           HB3      ALA  29   7.663  22.098  -0.615

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LYS  30           H        LYS  30  11.286  22.321  -0.728
    2    HA   LYS  30           HA       LYS  30  12.588  23.295   1.575
    3    HB2  LYS  30           HB2      LYS  30  13.704  22.010  -0.927
    4    HB3  LYS  30           HB3      LYS  30  14.679  22.383   0.496
    5    HG2  LYS  30           HG2      LYS  30  13.133  20.991   1.876
    6    HG3  LYS  30           HG3      LYS  30  12.257  20.556   0.405
    7    HD2  LYS  30           HD2      LYS  30  14.313  19.585  -0.546
    8    HD3  LYS  30           HD3      LYS  30  15.209  20.034   0.907
    9    HE2  LYS  30           HE2      LYS  30  13.712  18.594   2.262
   10    HE3  LYS  30           HE3      LYS  30  12.847  18.125   0.793
   11    HZ2  LYS  30           HZ1      LYS  30  14.650  16.566   1.565
   12    HZ1  LYS  30           HZ2      LYS  30  15.778  17.761   1.113
   13    HZ3  LYS  30           HZ3      LYS  30  14.752  17.064  -0.052

  No H/Q in entry =          13
  In of MODEL   28
    1    H    GLN  31           H        GLN  31  12.479  24.487  -1.727
    2    HA   GLN  31           HA       GLN  31  14.613  26.401  -1.305
    3    HB2  GLN  31           HB2      GLN  31  12.577  26.421  -3.536
    4    HB3  GLN  31           HB3      GLN  31  14.191  27.131  -3.535
    5    HG2  GLN  31           HG2      GLN  31  14.675  24.442  -2.948
    6    HG3  GLN  31           HG3      GLN  31  13.375  24.371  -4.130
    7   HE21  GLN  31          HE21      GLN  31  16.227  23.602  -4.523
    8   HE22  GLN  31          HE22      GLN  31  16.794  24.576  -5.791

  No H/Q in entry =           8
  In of MODEL   28
    1    H    GLY  32           H        GLY  32  11.537  26.195  -0.169
    2    HA3  GLY  32           HA2      GLY  32  10.363  27.758   1.095
    3    HA2  GLY  32           HA3      GLY  32  11.479  29.001   0.544

  No H/Q in entry =           3
  In of MODEL   28
    1    H    ASP  33           H        ASP  33  10.139  27.076  -1.946
    2    HA   ASP  33           HA       ASP  33   8.457  29.330  -2.815
    3    HB2  ASP  33           HB2      ASP  33   9.577  26.916  -4.245
    4    HB3  ASP  33           HB3      ASP  33   8.418  28.018  -4.983

  No H/Q in entry =           4
  In of MODEL   28
    1    H    PHE  34           H        PHE  34   6.768  28.845  -1.254
    2    HA   PHE  34           HA       PHE  34   5.411  26.361  -1.154
    3    HB2  PHE  34           HB2      PHE  34   4.423  29.142  -0.488
    4    HB3  PHE  34           HB3      PHE  34   3.586  27.645  -0.073
    5    HD1  PHE  34           HD1      PHE  34   5.810  30.068   1.139
    6    HD2  PHE  34           HD2      PHE  34   5.169  25.821   1.099
    7    HE1  PHE  34           HE1      PHE  34   7.197  29.838   3.181
    8    HE2  PHE  34           HE2      PHE  34   6.558  25.595   3.139
    9    HZ   PHE  34           HZ       PHE  34   7.566  27.604   4.179

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ALA  35           H        ALA  35   4.961  29.213  -3.177
    2    HA   ALA  35           HA       ALA  35   2.418  28.572  -4.207
    3    HB3  ALA  35           HB1      ALA  35   3.464  29.966  -6.247
    4    HB2  ALA  35           HB2      ALA  35   4.675  30.343  -5.021
    5    HB1  ALA  35           HB3      ALA  35   2.979  30.738  -4.737

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA  36           H        ALA  36   5.657  27.923  -5.549
    2    HA   ALA  36           HA       ALA  36   4.688  26.477  -7.790
    3    HB3  ALA  36           HB1      ALA  36   6.848  26.619  -8.400
    4    HB2  ALA  36           HB2      ALA  36   7.334  25.599  -7.044
    5    HB1  ALA  36           HB3      ALA  36   7.212  27.347  -6.836

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA  37           H        ALA  37   5.643  25.503  -4.529
    2    HA   ALA  37           HA       ALA  37   5.611  22.713  -4.948
    3    HB2  ALA  37           HB1      ALA  37   5.326  24.510  -2.577
    4    HB1  ALA  37           HB2      ALA  37   6.473  23.202  -2.861
    5    HB3  ALA  37           HB3      ALA  37   4.813  22.835  -2.394

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LYS  38           H        LYS  38   3.054  24.902  -3.796
    2    HA   LYS  38           HA       LYS  38   0.971  23.071  -3.573
    3    HB2  LYS  38           HB2      LYS  38   1.297  25.831  -3.331
    4    HB3  LYS  38           HB3      LYS  38   0.103  25.668  -4.613
    5    HG2  LYS  38           HG2      LYS  38  -1.339  24.337  -3.170
    6    HG3  LYS  38           HG3      LYS  38  -0.098  24.293  -1.910
    7    HD2  LYS  38           HD2      LYS  38  -0.307  26.629  -1.472
    8    HD3  LYS  38           HD3      LYS  38  -1.217  26.904  -2.958
    9    HE2  LYS  38           HE2      LYS  38  -2.726  26.932  -1.023
   10    HE3  LYS  38           HE3      LYS  38  -3.085  25.548  -2.061
   11    HZ3  LYS  38           HZ1      LYS  38  -2.350  24.090  -0.520
   12    HZ2  LYS  38           HZ2      LYS  38  -2.716  25.348   0.563
   13    HZ1  LYS  38           HZ3      LYS  38  -1.117  25.110   0.044

  No H/Q in entry =          13
  In of MODEL   28
    1    H    ALA  39           H        ALA  39   1.942  24.972  -6.426
    2    HA   ALA  39           HA       ALA  39  -0.120  24.079  -8.132
    3    HB2  ALA  39           HB1      ALA  39   2.613  24.748  -9.179
    4    HB1  ALA  39           HB2      ALA  39   1.633  26.004  -8.422
    5    HB3  ALA  39           HB3      ALA  39   1.032  25.156  -9.847

  No H/Q in entry =           5
  In of MODEL   28
    1    H    MET  40           H        MET  40   3.128  22.812  -7.538
    2    HA   MET  40           HA       MET  40   3.055  20.784  -9.522
    3    HB2  MET  40           HB2      MET  40   4.656  21.032  -6.969
    4    HB3  MET  40           HB3      MET  40   4.922  19.774  -8.178
    5    HG2  MET  40           HG2      MET  40   4.955  22.728  -8.854
    6    HG3  MET  40           HG3      MET  40   6.408  21.840  -8.397
    7    HE3  MET  40           HE1      MET  40   7.309  19.623 -11.195
    8    HE2  MET  40           HE2      MET  40   6.744  19.304  -9.558
    9    HE1  MET  40           HE3      MET  40   7.827  20.661  -9.859

  No H/Q in entry =           9
  In of MODEL   28
    1    H    MET  41           H        MET  41   2.129  20.830  -6.101
    2    HA   MET  41           HA       MET  41   1.622  18.062  -5.814
    3    HB2  MET  41           HB2      MET  41   0.263  20.412  -4.476
    4    HB3  MET  41           HB3      MET  41   0.121  18.734  -3.963
    5    HG2  MET  41           HG2      MET  41   2.830  18.983  -3.992
    6    HG3  MET  41           HG3      MET  41   2.372  20.638  -3.604
    7    HE2  MET  41           HE1      MET  41  -0.661  19.363  -1.883
    8    HE1  MET  41           HE2      MET  41   0.143  20.882  -2.264
    9    HE3  MET  41           HE3      MET  41   0.084  20.317  -0.594

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ASP  42           H        ASP  42  -0.439  20.763  -6.805
    2    HA   ASP  42           HA       ASP  42  -2.867  19.379  -6.944
    3    HB2  ASP  42           HB2      ASP  42  -2.184  21.955  -7.208
    4    HB3  ASP  42           HB3      ASP  42  -2.326  21.552  -8.915

  No H/Q in entry =           4
  In of MODEL   28
    1    H    GLN  43           H        GLN  43  -0.424  19.984  -9.441
    2    HA   GLN  43           HA       GLN  43  -1.792  18.644 -11.529
    3    HB2  GLN  43           HB2      GLN  43   1.160  19.190 -11.140
    4    HB3  GLN  43           HB3      GLN  43   0.458  18.537 -12.622
    5    HG2  GLN  43           HG2      GLN  43  -1.074  20.550 -12.676
    6    HG3  GLN  43           HG3      GLN  43  -0.131  21.220 -11.348
    7   HE21  GLN  43          HE21      GLN  43   0.021  22.834 -13.439
    8   HE22  GLN  43          HE22      GLN  43   1.441  22.623 -14.341

  No H/Q in entry =           8
  In of MODEL   28
    1    H    SER  44           H        SER  44   0.563  17.535  -9.127
    2    HA   SER  44           HA       SER  44   0.926  14.928 -10.142
    3    HB2  SER  44           HB2      SER  44   1.800  16.384  -7.908
    4    HB3  SER  44           HB3      SER  44   0.949  14.994  -7.234
    5    HG   SER  44           HG       SER  44   3.067  14.394  -7.652

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ARG  45           H        ARG  45  -1.414  16.232  -7.816
    2    HA   ARG  45           HA       ARG  45  -2.779  13.860  -7.176
    3    HB2  ARG  45           HB2      ARG  45  -3.002  16.030  -5.993
    4    HB3  ARG  45           HB3      ARG  45  -3.861  16.683  -7.385
    5    HG2  ARG  45           HG2      ARG  45  -5.610  14.941  -7.101
    6    HG3  ARG  45           HG3      ARG  45  -4.764  14.343  -5.673
    7    HD2  ARG  45           HD2      ARG  45  -4.997  16.611  -4.626
    8    HD3  ARG  45           HD3      ARG  45  -5.985  17.116  -6.013
    9    HE   ARG  45           HE       ARG  45  -7.074  14.733  -4.968
   10   HH21  ARG  45          HH11      ARG  45  -8.915  14.794  -3.703
   11   HH22  ARG  45          HH12      ARG  45  -9.327  16.233  -2.841
   12   HH11  ARG  45          HH21      ARG  45  -6.565  17.988  -3.954
   13   HH12  ARG  45          HH22      ARG  45  -7.991  18.042  -2.981

  No H/Q in entry =          13
  In of MODEL   28
    1    H    MET  46           H        MET  46  -3.379  16.249  -9.737
    2    HA   MET  46           HA       MET  46  -5.703  15.048 -10.802
    3    HB2  MET  46           HB2      MET  46  -3.616  16.889 -11.982
    4    HB3  MET  46           HB3      MET  46  -4.997  16.319 -12.926
    5    HG2  MET  46           HG2      MET  46  -6.539  17.238 -11.250
    6    HG3  MET  46           HG3      MET  46  -5.180  17.774 -10.269
    7    HE2  MET  46           HE1      MET  46  -5.756  20.236 -10.128
    8    HE1  MET  46           HE2      MET  46  -7.295  19.816 -10.874
    9    HE3  MET  46           HE3      MET  46  -6.384  21.202 -11.471

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ALA  47           H        ALA  47  -2.267  14.602 -11.547
    2    HA   ALA  47           HA       ALA  47  -2.587  12.863 -13.752
    3    HB3  ALA  47           HB1      ALA  47  -0.420  13.777 -13.397
    4    HB2  ALA  47           HB2      ALA  47  -0.262  12.051 -13.056
    5    HB1  ALA  47           HB3      ALA  47  -0.371  13.207 -11.728

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU  48           H        LEU  48  -2.322  12.243 -10.275
    2    HA   LEU  48           HA       LEU  48  -2.386   9.402 -10.424
    3    HB2  LEU  48           HB2      LEU  48  -3.177  11.319  -8.219
    4    HB3  LEU  48           HB3      LEU  48  -3.065   9.571  -8.012
    5    HG   LEU  48           HG       LEU  48  -0.781  11.291  -9.008
    6   HD13  LEU  48          HD11      LEU  48  -1.079  12.066  -6.821
    7   HD12  LEU  48          HD12      LEU  48   0.097  10.772  -6.614
    8   HD11  LEU  48          HD13      LEU  48  -1.599  10.493  -6.221
    9   HD22  LEU  48          HD21      LEU  48  -0.257   9.108  -9.639
   10   HD21  LEU  48          HD22      LEU  48  -1.124   8.389  -8.283
   11   HD23  LEU  48          HD23      LEU  48   0.440   9.160  -8.021

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ASN  49           H        ASN  49  -4.877  11.869 -10.039
    2    HA   ASN  49           HA       ASN  49  -7.046  10.183  -9.501
    3    HB2  ASN  49           HB2      ASN  49  -7.129  12.607  -9.187
    4    HB3  ASN  49           HB3      ASN  49  -6.968  12.861 -10.919
    5   HD21  ASN  49          HD21      ASN  49  -9.019  13.853 -11.241
    6   HD22  ASN  49          HD22      ASN  49 -10.484  13.032 -11.005

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLU  50           H        GLU  50  -5.769  11.382 -12.588
    2    HA   GLU  50           HA       GLU  50  -7.705  10.100 -14.236
    3    HB2  GLU  50           HB2      GLU  50  -6.256  11.931 -15.052
    4    HB3  GLU  50           HB3      GLU  50  -4.851  10.875 -14.905
    5    HG2  GLU  50           HG2      GLU  50  -5.802   9.323 -16.539
    6    HG3  GLU  50           HG3      GLU  50  -7.273  10.285 -16.635

  No H/Q in entry =           6
  In of MODEL   28
    1    H    ALA  51           H        ALA  51  -4.528   9.146 -13.016
    2    HA   ALA  51           HA       ALA  51  -4.357   6.689 -14.424
    3    HB2  ALA  51           HB1      ALA  51  -2.377   6.427 -13.316
    4    HB1  ALA  51           HB2      ALA  51  -3.075   6.847 -11.753
    5    HB3  ALA  51           HB3      ALA  51  -2.629   8.119 -12.890

  No H/Q in entry =           5
  In of MODEL   28
    1    H    HIS  52           H        HIS  52  -5.550   7.521 -11.182
    2    HA   HIS  52           HA       HIS  52  -6.211   4.907 -10.343
    3    HB2  HIS  52           HB2      HIS  52  -6.097   6.875  -8.840
    4    HB3  HIS  52           HB3      HIS  52  -7.560   7.511  -9.594
    5    HD1  HIS  52           HD1      HIS  52  -9.771   6.055  -9.287
    6    HD2  HIS  52           HD2      HIS  52  -6.545   4.883  -6.922
    7    HE1  HIS  52           HE1      HIS  52 -10.712   4.535  -7.493
    8    HE2  HIS  52           HE2      HIS  52  -8.756   3.812  -6.042

  No H/Q in entry =           8
  In of MODEL   28
    1    H    LEU  53           H        LEU  53  -8.050   7.339 -12.147
    2    HA   LEU  53           HA       LEU  53 -10.542   6.021 -12.163
    3    HB2  LEU  53           HB2      LEU  53  -9.273   8.005 -14.041
    4    HB3  LEU  53           HB3      LEU  53 -10.868   7.326 -14.357
    5    HG   LEU  53           HG       LEU  53 -10.160   8.658 -11.723
    6   HD13  LEU  53          HD11      LEU  53  -9.873  10.310 -13.499
    7   HD12  LEU  53          HD12      LEU  53 -11.369  10.644 -12.626
    8   HD11  LEU  53          HD13      LEU  53 -11.421   9.860 -14.204
    9   HD21  LEU  53          HD21      LEU  53 -12.720   7.771 -13.068
   10   HD23  LEU  53          HD22      LEU  53 -12.735   9.031 -11.840
   11   HD22  LEU  53          HD23      LEU  53 -12.178   7.419 -11.433

  No H/Q in entry =          11
  In of MODEL   28
    1    H    VAL  54           H        VAL  54  -7.782   5.844 -14.390
    2    HA   VAL  54           HA       VAL  54  -8.980   4.054 -16.231
    3    HB   VAL  54           HB       VAL  54  -6.080   4.592 -15.540
    4   HG12  VAL  54          HG11      VAL  54  -5.814   3.500 -17.924
    5   HG11  VAL  54          HG12      VAL  54  -7.335   2.706 -17.523
    6   HG13  VAL  54          HG13      VAL  54  -5.921   2.469 -16.498
    7   HG22  VAL  54          HG21      VAL  54  -6.866   6.523 -16.595
    8   HG21  VAL  54          HG22      VAL  54  -8.046   5.644 -17.564
    9   HG23  VAL  54          HG23      VAL  54  -6.338   5.580 -17.988

  No H/Q in entry =           9
  In of MODEL   28
    1    H    GLN  55           H        GLN  55  -6.986   3.538 -13.322
    2    HA   GLN  55           HA       GLN  55  -6.868   0.721 -13.567
    3    HB2  GLN  55           HB2      GLN  55  -5.327   1.638 -12.046
    4    HB3  GLN  55           HB3      GLN  55  -6.556   2.596 -11.224
    5    HG2  GLN  55           HG2      GLN  55  -7.232   0.837  -9.903
    6    HG3  GLN  55           HG3      GLN  55  -6.991  -0.353 -11.176
    7   HE21  GLN  55          HE21      GLN  55  -5.355  -1.785 -10.670
    8   HE22  GLN  55          HE22      GLN  55  -3.977  -1.416  -9.754

  No H/Q in entry =           8
  In of MODEL   28
    1    H    THR  56           H        THR  56  -9.226   2.867 -11.970
    2    HA   THR  56           HA       THR  56 -10.797   0.973 -10.679
    3    HB   THR  56           HB       THR  56 -11.908   3.346 -12.198
    4    HG1  THR  56           HG1      THR  56 -10.141   3.222 -10.155
    5   HG22  THR  56          HG21      THR  56 -12.788   2.139  -9.572
    6   HG21  THR  56          HG22      THR  56 -13.458   1.634 -11.124
    7   HG23  THR  56          HG23      THR  56 -13.659   3.299 -10.574

  No H/Q in entry =           7
  In of MODEL   28
    1    H    LYS  57           H        LYS  57 -10.996   2.042 -14.070
    2    HA   LYS  57           HA       LYS  57 -13.133   0.331 -14.825
    3    HB2  LYS  57           HB2      LYS  57 -12.279   2.282 -16.149
    4    HB3  LYS  57           HB3      LYS  57 -10.821   1.366 -16.500
    5    HG2  LYS  57           HG2      LYS  57 -12.140  -0.339 -17.663
    6    HG3  LYS  57           HG3      LYS  57 -13.627   0.515 -17.273
    7    HD2  LYS  57           HD2      LYS  57 -12.843   2.468 -18.580
    8    HD3  LYS  57           HD3      LYS  57 -11.367   1.599 -18.990
    9    HE2  LYS  57           HE2      LYS  57 -12.720  -0.162 -20.103
   10    HE3  LYS  57           HE3      LYS  57 -14.193   0.730 -19.727
   11    HZ1  LYS  57           HZ1      LYS  57 -13.248   2.622 -20.978
   12    HZ3  LYS  57           HZ2      LYS  57 -13.531   1.248 -21.937
   13    HZ2  LYS  57           HZ3      LYS  57 -11.951   1.635 -21.445

  No H/Q in entry =          13
  In of MODEL   28
    1    H    LEU  58           H        LEU  58  -9.625  -0.066 -14.753
    2    HA   LEU  58           HA       LEU  58  -9.604  -2.588 -16.031
    3    HB2  LEU  58           HB2      LEU  58  -7.589  -1.270 -14.221
    4    HB3  LEU  58           HB3      LEU  58  -7.311  -2.792 -15.068
    5    HG   LEU  58           HG       LEU  58  -8.084  -0.201 -16.444
    6   HD11  LEU  58          HD11      LEU  58  -5.429  -1.409 -15.738
    7   HD13  LEU  58          HD12      LEU  58  -5.940   0.277 -15.698
    8   HD12  LEU  58          HD13      LEU  58  -5.587  -0.497 -17.240
    9   HD22  LEU  58          HD21      LEU  58  -8.639  -1.774 -18.031
   10   HD21  LEU  58          HD22      LEU  58  -7.588  -3.009 -17.340
   11   HD23  LEU  58          HD23      LEU  58  -6.906  -1.733 -18.348

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  59           H        ILE  59 -10.447  -1.681 -12.787
    2    HA   ILE  59           HA       ILE  59 -10.073  -4.440 -11.827
    3    HB   ILE  59           HB       ILE  59  -9.654  -2.167 -10.435
    4   HG12  ILE  59          HG12      ILE  59 -11.016  -4.521  -9.109
    5   HG13  ILE  59          HG13      ILE  59  -9.368  -4.591  -9.681
    6   HG21  ILE  59          HG21      ILE  59 -12.206  -1.690 -10.710
    7   HG23  ILE  59          HG22      ILE  59 -11.484  -1.461  -9.135
    8   HG22  ILE  59          HG23      ILE  59 -12.413  -2.916  -9.483
    9   HD11  ILE  59          HD11      ILE  59  -8.863  -2.560  -8.301
   10   HD13  ILE  59          HD12      ILE  59  -9.283  -3.982  -7.354
   11   HD12  ILE  59          HD13      ILE  59 -10.475  -2.704  -7.605

  No H/Q in entry =          11
  In of MODEL   28
    1    H    GLU  60           H        GLU  60 -12.650  -2.153 -12.655
    2    HA   GLU  60           HA       GLU  60 -14.824  -3.687 -11.644
    3    HB2  GLU  60           HB2      GLU  60 -15.067  -1.324 -12.245
    4    HB3  GLU  60           HB3      GLU  60 -14.719  -1.698 -13.931
    5    HG2  GLU  60           HG2      GLU  60 -16.734  -3.152 -14.004
    6    HG3  GLU  60           HG3      GLU  60 -17.098  -2.701 -12.350

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLY  61           H        GLY  61 -13.138  -3.668 -14.752
    2    HA3  GLY  61           HA2      GLY  61 -14.825  -5.934 -15.640
    3    HA2  GLY  61           HA3      GLY  61 -13.987  -4.825 -16.719

  No H/Q in entry =           3
  In of MODEL   28
    1    H    ASP  62           H        ASP  62 -12.608  -6.244 -13.823
    2    HA   ASP  62           HA       ASP  62 -10.371  -7.261 -15.327
    3    HB2  ASP  62           HB2      ASP  62  -9.591  -7.982 -13.055
    4    HB3  ASP  62           HB3      ASP  62  -9.968  -6.266 -13.166

  No H/Q in entry =           4
  In of MODEL   28
    1    H    ALA  63           H        ALA  63 -13.420  -8.546 -14.805
    2    HA   ALA  63           HA       ALA  63 -12.921 -11.257 -14.126
    3    HB1  ALA  63           HB1      ALA  63 -15.082  -9.874 -15.738
    4    HB2  ALA  63           HB2      ALA  63 -15.190 -10.493 -14.090
    5    HB3  ALA  63           HB3      ALA  63 -15.106 -11.613 -15.451

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLY  64           H        GLY  64 -12.901  -9.514 -17.178
    2    HA3  GLY  64           HA2      GLY  64 -12.267 -10.090 -19.306
    3    HA2  GLY  64           HA3      GLY  64 -11.016 -11.032 -18.507

  No H/Q in entry =           3
  In of MODEL   28
    1    H    GLU  65           H        GLU  65 -11.073 -13.204 -18.719
    2    HA   GLU  65           HA       GLU  65 -12.953 -14.394 -20.464
    3    HB2  GLU  65           HB2      GLU  65 -10.894 -15.612 -18.628
    4    HB3  GLU  65           HB3      GLU  65 -11.860 -16.546 -19.771
    5    HG2  GLU  65           HG2      GLU  65 -10.997 -15.221 -21.635
    6    HG3  GLU  65           HG3      GLU  65 -10.086 -14.205 -20.519

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLY  66           H        GLY  66 -13.710 -16.714 -19.673
    2    HA3  GLY  66           HA2      GLY  66 -16.039 -16.336 -18.144
    3    HA2  GLY  66           HA3      GLY  66 -15.396 -17.875 -18.681

  No H/Q in entry =           3
  In of MODEL   28
    1    H    LYS  67           H        LYS  67 -12.897 -17.620 -17.285
    2    HA   LYS  67           HA       LYS  67 -13.683 -18.741 -14.794
    3    HB2  LYS  67           HB2      LYS  67 -10.990 -18.082 -15.972
    4    HB3  LYS  67           HB3      LYS  67 -11.208 -18.923 -14.433
    5    HG2  LYS  67           HG2      LYS  67 -12.545 -20.659 -15.551
    6    HG3  LYS  67           HG3      LYS  67 -12.370 -19.817 -17.089
    7    HD2  LYS  67           HD2      LYS  67  -9.911 -20.123 -16.960
    8    HD3  LYS  67           HD3      LYS  67 -10.118 -21.012 -15.448
    9    HE2  LYS  67           HE2      LYS  67 -11.370 -21.796 -18.098
   10    HE3  LYS  67           HE3      LYS  67  -9.925 -22.536 -17.408
   11    HZ2  LYS  67           HZ1      LYS  67 -12.698 -22.622 -16.395
   12    HZ1  LYS  67           HZ2      LYS  67 -11.378 -22.953 -15.380
   13    HZ3  LYS  67           HZ3      LYS  67 -11.661 -23.916 -16.750

  No H/Q in entry =          13
  In of MODEL   28
    1    H    MET  68           H        MET  68 -12.898 -18.195 -12.727
    2    HA   MET  68           HA       MET  68 -13.611 -15.633 -11.861
    3    HB2  MET  68           HB2      MET  68 -12.009 -17.777 -10.466
    4    HB3  MET  68           HB3      MET  68 -12.722 -16.372  -9.675
    5    HG2  MET  68           HG2      MET  68 -14.278 -18.445 -11.248
    6    HG3  MET  68           HG3      MET  68 -14.169 -18.385  -9.487
    7    HE1  MET  68           HE1      MET  68 -14.417 -16.423  -8.219
    8    HE3  MET  68           HE2      MET  68 -15.875 -15.435  -8.283
    9    HE2  MET  68           HE3      MET  68 -14.406 -14.876  -9.079

  No H/Q in entry =           9
  In of MODEL   28
    1    H    LYS  69           H        LYS  69 -10.340 -16.972 -12.414
    2    HA   LYS  69           HA       LYS  69  -8.768 -15.141 -11.169
    3    HB2  LYS  69           HB2      LYS  69  -7.935 -17.112 -12.371
    4    HB3  LYS  69           HB3      LYS  69  -8.233 -16.298 -13.909
    5    HG2  LYS  69           HG2      LYS  69  -6.665 -14.513 -13.295
    6    HG3  LYS  69           HG3      LYS  69  -6.405 -15.260 -11.721
    7    HD2  LYS  69           HD2      LYS  69  -5.497 -17.275 -12.832
    8    HD3  LYS  69           HD3      LYS  69  -5.730 -16.505 -14.402
    9    HE2  LYS  69           HE2      LYS  69  -4.204 -14.685 -13.749
   10    HE3  LYS  69           HE3      LYS  69  -3.981 -15.433 -12.168
   11    HZ3  LYS  69           HZ1      LYS  69  -2.228 -16.354 -13.217
   12    HZ2  LYS  69           HZ2      LYS  69  -2.919 -16.213 -14.761
   13    HZ1  LYS  69           HZ3      LYS  69  -3.389 -17.480 -13.729

  No H/Q in entry =          13
  In of MODEL   28
    1    H    VAL  70           H        VAL  70  -7.557 -13.261 -11.715
    2    HA   VAL  70           HA       VAL  70  -8.884 -11.483 -13.685
    3    HB   VAL  70           HB       VAL  70  -8.227  -9.626 -12.197
    4   HG13  VAL  70          HG11      VAL  70 -10.449 -10.607 -11.929
    5   HG12  VAL  70          HG12      VAL  70  -9.809 -10.177 -10.342
    6   HG11  VAL  70          HG13      VAL  70  -9.795 -11.858 -10.872
    7   HG22  VAL  70          HG21      VAL  70  -6.298 -10.354 -11.039
    8   HG21  VAL  70          HG22      VAL  70  -7.033 -11.899 -10.618
    9   HG23  VAL  70          HG23      VAL  70  -7.541 -10.428  -9.791

  No H/Q in entry =           9
  In of MODEL   28
    1    H    SER  71           H        SER  71  -7.401  -9.693 -14.413
    2    HA   SER  71           HA       SER  71  -5.106 -10.719 -15.697
    3    HB2  SER  71           HB2      SER  71  -6.387  -8.714 -16.463
    4    HB3  SER  71           HB3      SER  71  -5.753  -7.825 -15.082
    5    HG   SER  71           HG       SER  71  -3.623  -8.584 -15.955

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU  72           H        LEU  72  -3.107 -11.003 -15.015
    2    HA   LEU  72           HA       LEU  72  -2.400 -10.770 -12.301
    3    HB2  LEU  72           HB2      LEU  72  -0.728 -11.191 -14.774
    4    HB3  LEU  72           HB3      LEU  72  -0.078 -11.257 -13.139
    5    HG   LEU  72           HG       LEU  72  -2.403 -12.971 -14.076
    6   HD11  LEU  72          HD11      LEU  72  -0.297 -13.457 -15.335
    7   HD13  LEU  72          HD12      LEU  72  -0.793 -14.792 -14.294
    8   HD12  LEU  72          HD13      LEU  72   0.521 -13.727 -13.794
    9   HD22  LEU  72          HD21      LEU  72  -2.474 -12.987 -11.733
   10   HD21  LEU  72          HD22      LEU  72  -0.735 -12.810 -11.565
   11   HD23  LEU  72          HD23      LEU  72  -1.419 -14.357 -12.060

  No H/Q in entry =          11
  In of MODEL   28
    1    H    VAL  73           H        VAL  73  -1.691  -8.760 -15.088
    2    HA   VAL  73           HA       VAL  73   0.210  -7.039 -13.984
    3    HB   VAL  73           HB       VAL  73  -0.180  -5.639 -15.852
    4   HG11  VAL  73          HG11      VAL  73   0.630  -8.004 -16.290
    5   HG13  VAL  73          HG12      VAL  73  -0.113  -7.204 -17.674
    6   HG12  VAL  73          HG13      VAL  73  -1.023  -8.403 -16.756
    7   HG23  VAL  73          HG21      VAL  73  -2.353  -6.240 -17.245
    8   HG22  VAL  73          HG22      VAL  73  -2.440  -5.107 -15.898
    9   HG21  VAL  73          HG23      VAL  73  -2.946  -6.783 -15.675

  No H/Q in entry =           9
  In of MODEL   28
    1    H    LEU  74           H        LEU  74  -3.189  -7.182 -13.440
    2    HA   LEU  74           HA       LEU  74  -3.833  -4.529 -12.842
    3    HB2  LEU  74           HB2      LEU  74  -5.548  -6.208 -13.015
    4    HB3  LEU  74           HB3      LEU  74  -4.853  -7.123 -11.681
    5    HG   LEU  74           HG       LEU  74  -5.337  -5.251 -10.142
    6   HD12  LEU  74          HD11      LEU  74  -6.940  -3.481 -11.117
    7   HD11  LEU  74          HD12      LEU  74  -6.348  -3.994 -12.696
    8   HD13  LEU  74          HD13      LEU  74  -5.229  -3.314 -11.512
    9   HD23  LEU  74          HD21      LEU  74  -7.880  -5.701 -11.618
   10   HD22  LEU  74          HD22      LEU  74  -7.523  -5.829  -9.909
   11   HD21  LEU  74          HD23      LEU  74  -7.021  -7.105 -10.993

  No H/Q in entry =          11
  In of MODEL   28
    1    H    VAL  75           H        VAL  75  -2.778  -7.097 -10.665
    2    HA   VAL  75           HA       VAL  75  -2.603  -5.533  -8.327
    3    HB   VAL  75           HB       VAL  75  -1.079  -8.017  -9.099
    4   HG12  VAL  75          HG11      VAL  75  -0.636  -8.156  -6.621
    5   HG11  VAL  75          HG12      VAL  75  -1.327  -6.549  -6.448
    6   HG13  VAL  75          HG13      VAL  75   0.150  -6.770  -7.370
    7   HG23  VAL  75          HG21      VAL  75  -3.368  -7.660  -7.150
    8   HG22  VAL  75          HG22      VAL  75  -2.763  -9.162  -7.847
    9   HG21  VAL  75          HG23      VAL  75  -3.649  -8.015  -8.854

  No H/Q in entry =           9
  In of MODEL   28
    1    H    GLU  76           H        GLU  76  -0.177  -6.283 -10.850
    2    HA   GLU  76           HA       GLU  76   1.992  -4.912  -9.689
    3    HB2  GLU  76           HB2      GLU  76   2.210  -6.396 -11.668
    4    HB3  GLU  76           HB3      GLU  76   1.302  -5.243 -12.632
    5    HG2  GLU  76           HG2      GLU  76   3.638  -4.897 -13.114
    6    HG3  GLU  76           HG3      GLU  76   3.113  -3.528 -12.152

  No H/Q in entry =           6
  In of MODEL   28
    1    H    ALA  77           H        ALA  77  -0.542  -3.743 -11.894
    2    HA   ALA  77           HA       ALA  77   0.426  -1.089 -12.078
    3    HB2  ALA  77           HB1      ALA  77  -1.993  -0.578 -12.712
    4    HB3  ALA  77           HB2      ALA  77  -2.322  -2.291 -12.449
    5    HB1  ALA  77           HB3      ALA  77  -1.175  -1.796 -13.695

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLN  78           H        GLN  78  -1.838  -2.655  -9.870
    2    HA   GLN  78           HA       GLN  78  -2.672  -0.337  -8.483
    3    HB2  GLN  78           HB2      GLN  78  -3.765  -2.602  -8.390
    4    HB3  GLN  78           HB3      GLN  78  -2.426  -3.151  -7.387
    5    HG2  GLN  78           HG2      GLN  78  -2.954  -1.422  -5.723
    6    HG3  GLN  78           HG3      GLN  78  -4.289  -0.856  -6.725
    7   HE21  GLN  78          HE21      GLN  78  -4.790  -1.818  -4.087
    8   HE22  GLN  78          HE22      GLN  78  -5.637  -3.285  -4.199

  No H/Q in entry =           8
  In of MODEL   28
    1    H    LEU  79           H        LEU  79   0.025  -2.566  -8.010
    2    HA   LEU  79           HA       LEU  79   0.982  -1.648  -5.553
    3    HB2  LEU  79           HB2      LEU  79   1.876  -3.654  -6.608
    4    HB3  LEU  79           HB3      LEU  79   2.519  -2.702  -7.943
    5    HG   LEU  79           HG       LEU  79   4.057  -1.541  -6.438
    6   HD13  LEU  79          HD11      LEU  79   3.041  -1.296  -4.376
    7   HD12  LEU  79          HD12      LEU  79   4.131  -2.633  -4.021
    8   HD11  LEU  79          HD13      LEU  79   2.430  -2.951  -4.357
    9   HD23  LEU  79          HD21      LEU  79   5.284  -3.673  -5.519
   10   HD22  LEU  79          HD22      LEU  79   5.087  -3.484  -7.259
   11   HD21  LEU  79          HD23      LEU  79   4.015  -4.560  -6.367

  No H/Q in entry =          11
  In of MODEL   28
    1    H    HIS  80           H        HIS  80   1.856  -0.538  -8.827
    2    HA   HIS  80           HA       HIS  80   3.640   1.472  -7.906
    3    HB2  HIS  80           HB2      HIS  80   2.369   0.753 -10.492
    4    HB3  HIS  80           HB3      HIS  80   2.946   2.411 -10.326
    5    HD1  HIS  80           HD1      HIS  80   5.347   2.734 -10.838
    6    HD2  HIS  80           HD2      HIS  80   4.562  -1.180  -9.633
    7    HE1  HIS  80           HE1      HIS  80   7.550   1.479 -10.989
    8    HE2  HIS  80           HE2      HIS  80   7.083  -0.910 -10.257

  No H/Q in entry =           8
  In of MODEL   28
    1    H    LEU  81           H        LEU  81   0.239   1.592  -8.902
    2    HA   LEU  81           HA       LEU  81  -0.067   4.383  -8.585
    3    HB2  LEU  81           HB2      LEU  81  -2.058   2.117  -8.505
    4    HB3  LEU  81           HB3      LEU  81  -2.529   3.815  -8.423
    5    HG   LEU  81           HG       LEU  81  -0.814   2.674 -10.646
    6   HD12  LEU  81          HD11      LEU  81  -3.043   2.964 -11.956
    7   HD11  LEU  81          HD12      LEU  81  -3.806   2.894 -10.368
    8   HD13  LEU  81          HD13      LEU  81  -2.845   1.534 -10.945
    9   HD23  LEU  81          HD21      LEU  81  -1.929   4.801 -11.758
   10   HD22  LEU  81          HD22      LEU  81  -0.519   4.992 -10.719
   11   HD21  LEU  81          HD23      LEU  81  -2.130   5.326 -10.087

  No H/Q in entry =          11
  In of MODEL   28
    1    H    MET  82           H        MET  82  -0.708   1.699  -6.327
    2    HA   MET  82           HA       MET  82  -1.787   3.283  -4.252
    3    HB2  MET  82           HB2      MET  82  -0.383   0.611  -4.273
    4    HB3  MET  82           HB3      MET  82  -0.977   1.337  -2.781
    5    HG2  MET  82           HG2      MET  82  -2.693   0.813  -5.228
    6    HG3  MET  82           HG3      MET  82  -2.609  -0.253  -3.828
    7    HE3  MET  82           HE1      MET  82  -4.363   1.389  -1.028
    8    HE2  MET  82           HE2      MET  82  -2.635   1.686  -1.206
    9    HE1  MET  82           HE3      MET  82  -3.304   0.119  -1.656

  No H/Q in entry =           9
  In of MODEL   28
    1    H    THR  83           H        THR  83   1.529   2.231  -4.922
    2    HA   THR  83           HA       THR  83   2.724   3.359  -2.620
    3    HB   THR  83           HB       THR  83   4.826   3.321  -4.084
    4    HG1  THR  83           HG1      THR  83   4.601   2.783  -6.107
    5   HG22  THR  83          HG21      THR  83   4.413   0.656  -4.407
    6   HG21  THR  83          HG22      THR  83   3.114   1.026  -3.274
    7   HG23  THR  83          HG23      THR  83   4.787   1.391  -2.848

  No H/Q in entry =           7
  In of MODEL   28
    1    H    SER  84           H        SER  84   2.354   4.620  -5.928
    2    HA   SER  84           HA       SER  84   3.664   7.077  -5.478
    3    HB2  SER  84           HB2      SER  84   1.612   6.212  -7.503
    4    HB3  SER  84           HB3      SER  84   2.272   7.847  -7.481
    5    HG   SER  84           HG       SER  84   3.674   5.387  -7.755

  No H/Q in entry =           5
  In of MODEL   28
    1    H    MET  85           H        MET  85   0.178   6.282  -5.318
    2    HA   MET  85           HA       MET  85  -0.715   8.885  -4.733
    3    HB2  MET  85           HB2      MET  85  -2.218   7.063  -5.401
    4    HB3  MET  85           HB3      MET  85  -1.922   6.258  -3.860
    5    HG2  MET  85           HG2      MET  85  -2.843   8.197  -2.655
    6    HG3  MET  85           HG3      MET  85  -3.104   9.032  -4.185
    7    HE2  MET  85           HE1      MET  85  -6.258   7.864  -5.571
    8    HE1  MET  85           HE2      MET  85  -4.643   8.452  -5.958
    9    HE3  MET  85           HE3      MET  85  -5.603   9.278  -4.735

  No H/Q in entry =           9
  In of MODEL   28
    1    H    LEU  86           H        LEU  86   0.223   6.243  -2.573
    2    HA   LEU  86           HA       LEU  86  -0.335   7.550  -0.139
    3    HB2  LEU  86           HB2      LEU  86   0.157   5.082  -0.520
    4    HB3  LEU  86           HB3      LEU  86   1.860   5.530  -0.610
    5    HG   LEU  86           HG       LEU  86   1.512   6.697   1.652
    6   HD11  LEU  86          HD11      LEU  86  -1.171   5.900   1.172
    7   HD13  LEU  86          HD12      LEU  86  -0.520   6.661   2.622
    8   HD12  LEU  86          HD13      LEU  86  -0.592   4.903   2.510
    9   HD23  LEU  86          HD21      LEU  86   1.114   3.701   1.785
   10   HD22  LEU  86          HD22      LEU  86   2.102   4.725   2.825
   11   HD21  LEU  86          HD23      LEU  86   2.613   4.398   1.170

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ALA  87           H        ALA  87   2.657   7.278  -2.014
    2    HA   ALA  87           HA       ALA  87   4.341   8.713  -0.287
    3    HB3  ALA  87           HB1      ALA  87   4.458   7.690  -2.990
    4    HB2  ALA  87           HB2      ALA  87   5.784   8.038  -1.884
    5    HB1  ALA  87           HB3      ALA  87   5.162   9.308  -2.937

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ARG  88           H        ARG  88   2.395   9.818  -3.021
    2    HA   ARG  88           HA       ARG  88   3.143  12.516  -2.912
    3    HB2  ARG  88           HB2      ARG  88   1.908  11.344  -4.770
    4    HB3  ARG  88           HB3      ARG  88   0.445  11.477  -3.794
    5    HG2  ARG  88           HG2      ARG  88   1.440  14.067  -3.717
    6    HG3  ARG  88           HG3      ARG  88   1.876  13.550  -5.343
    7    HD2  ARG  88           HD2      ARG  88  -0.263  13.608  -6.051
    8    HD3  ARG  88           HD3      ARG  88  -0.848  12.755  -4.621
    9    HE   ARG  88           HE       ARG  88  -1.061  15.529  -5.051
   10   HH21  ARG  88          HH11      ARG  88  -1.608  16.861  -3.321
   11   HH22  ARG  88          HH12      ARG  88  -1.314  16.333  -1.700
   12   HH11  ARG  88          HH21      ARG  88  -0.035  13.286  -2.664
   13   HH12  ARG  88          HH22      ARG  88  -0.441  14.303  -1.328

  No H/Q in entry =          13
  In of MODEL   28
    1    H    GLU  89           H        GLU  89   0.448  10.823  -1.277
    2    HA   GLU  89           HA       GLU  89  -0.686  13.130  -0.086
    3    HB2  GLU  89           HB2      GLU  89  -1.783  10.880  -0.168
    4    HB3  GLU  89           HB3      GLU  89  -0.660  10.340   1.079
    5    HG2  GLU  89           HG2      GLU  89  -1.502  12.038   2.628
    6    HG3  GLU  89           HG3      GLU  89  -2.554  12.694   1.378

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LEU  90           H        LEU  90   1.780  10.864   1.108
    2    HA   LEU  90           HA       LEU  90   2.115  12.121   3.634
    3    HB2  LEU  90           HB2      LEU  90   3.910  10.355   1.971
    4    HB3  LEU  90           HB3      LEU  90   4.318  10.882   3.609
    5    HG   LEU  90           HG       LEU  90   1.697   9.512   2.943
    6   HD12  LEU  90          HD11      LEU  90   2.850   7.479   3.964
    7   HD11  LEU  90          HD12      LEU  90   4.366   8.347   3.725
    8   HD13  LEU  90          HD13      LEU  90   3.363   7.926   2.335
    9   HD22  LEU  90          HD21      LEU  90   1.416  10.441   5.060
   10   HD21  LEU  90          HD22      LEU  90   3.133  10.349   5.449
   11   HD23  LEU  90          HD23      LEU  90   2.138   8.894   5.499

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  91           H        ILE  91   3.728  12.505   0.512
    2    HA   ILE  91           HA       ILE  91   5.687  14.355   1.353
    3    HB   ILE  91           HB       ILE  91   4.390  13.844  -1.331
    4   HG12  ILE  91          HG12      ILE  91   7.223  13.383  -0.343
    5   HG13  ILE  91          HG13      ILE  91   5.950  12.176  -0.181
    6   HG22  ILE  91          HG21      ILE  91   6.606  15.205  -2.015
    7   HG21  ILE  91          HG22      ILE  91   6.283  16.010  -0.478
    8   HG23  ILE  91          HG23      ILE  91   5.065  16.024  -1.752
    9   HD13  ILE  91          HD11      ILE  91   5.789  11.842  -2.488
   10   HD12  ILE  91          HD12      ILE  91   7.520  12.099  -2.268
   11   HD11  ILE  91          HD13      ILE  91   6.502  13.412  -2.863

  No H/Q in entry =          11
  In of MODEL   28
    1    H    THR  92           H        THR  92   2.326  14.757   0.329
    2    HA   THR  92           HA       THR  92   2.278  17.580   0.258
    3    HB   THR  92           HB       THR  92   0.123  15.572   0.956
    4    HG1  THR  92           HG1      THR  92   0.438  15.387  -1.127
    5   HG22  THR  92          HG21      THR  92  -1.291  17.720   0.220
    6   HG21  THR  92          HG22      THR  92   0.092  18.558   0.919
    7   HG23  THR  92          HG23      THR  92  -0.845  17.434   1.901

  No H/Q in entry =           7
  In of MODEL   28
    1    H    GLU  93           H        GLU  93   1.736  15.286   2.918
    2    HA   GLU  93           HA       GLU  93   1.181  17.193   4.927
    3    HB2  GLU  93           HB2      GLU  93   2.514  14.479   5.179
    4    HB3  GLU  93           HB3      GLU  93   1.811  15.406   6.506
    5    HG2  GLU  93           HG2      GLU  93   0.215  14.607   4.063
    6    HG3  GLU  93           HG3      GLU  93   0.318  13.591   5.496

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LEU  94           H        LEU  94   4.204  15.729   3.796
    2    HA   LEU  94           HA       LEU  94   5.938  16.897   5.687
    3    HB2  LEU  94           HB2      LEU  94   6.359  15.922   2.861
    4    HB3  LEU  94           HB3      LEU  94   7.679  16.593   3.814
    5    HG   LEU  94           HG       LEU  94   5.951  14.389   4.950
    6   HD11  LEU  94          HD11      LEU  94   8.057  14.170   2.828
    7   HD13  LEU  94          HD12      LEU  94   6.617  13.187   3.087
    8   HD12  LEU  94          HD13      LEU  94   8.041  12.948   4.101
    9   HD23  LEU  94          HD21      LEU  94   8.140  13.873   6.113
   10   HD22  LEU  94          HD22      LEU  94   7.460  15.448   6.521
   11   HD21  LEU  94          HD23      LEU  94   8.804  15.333   5.385

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  95           H        ILE  95   4.803  18.048   2.528
    2    HA   ILE  95           HA       ILE  95   6.358  20.417   2.466
    3    HB   ILE  95           HB       ILE  95   3.725  19.709   1.152
    4   HG12  ILE  95          HG12      ILE  95   6.515  20.062   0.025
    5   HG13  ILE  95          HG13      ILE  95   5.875  18.506   0.543
    6   HG21  ILE  95          HG21      ILE  95   5.457  22.188   0.930
    7   HG23  ILE  95          HG22      ILE  95   3.731  22.109   1.279
    8   HG22  ILE  95          HG23      ILE  95   4.324  21.707  -0.333
    9   HD13  ILE  95          HD11      ILE  95   4.324  18.412  -1.192
   10   HD12  ILE  95          HD12      ILE  95   5.670  19.238  -1.978
   11   HD11  ILE  95          HD13      ILE  95   4.288  20.164  -1.394

  No H/Q in entry =          11
  In of MODEL   28
    1    H    GLU  96           H        GLU  96   3.109  19.746   3.750
    2    HA   GLU  96           HA       GLU  96   2.466  22.391   4.488
    3    HB2  GLU  96           HB2      GLU  96   0.804  20.596   4.500
    4    HB3  GLU  96           HB3      GLU  96   1.666  19.780   5.802
    5    HG2  GLU  96           HG2      GLU  96   0.630  21.062   7.362
    6    HG3  GLU  96           HG3      GLU  96   1.158  22.536   6.562

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LEU  97           H        LEU  97   4.320  19.860   6.131
    2    HA   LEU  97           HA       LEU  97   4.657  21.220   8.598
    3    HB2  LEU  97           HB2      LEU  97   6.216  19.057   7.198
    4    HB3  LEU  97           HB3      LEU  97   6.795  19.752   8.710
    5    HG   LEU  97           HG       LEU  97   3.994  18.637   8.392
    6   HD12  LEU  97          HD11      LEU  97   4.943  16.636   9.616
    7   HD11  LEU  97          HD12      LEU  97   6.551  17.277   9.277
    8   HD13  LEU  97          HD13      LEU  97   5.490  16.807   7.948
    9   HD23  LEU  97          HD21      LEU  97   4.438  18.356  10.959
   10   HD22  LEU  97          HD22      LEU  97   4.049  19.963  10.347
   11   HD21  LEU  97          HD23      LEU  97   5.722  19.536  10.701

  No H/Q in entry =          11
  In of MODEL   28
    1    H    HIS  98           H        HIS  98   6.541  21.238   5.580
    2    HA   HIS  98           HA       HIS  98   8.680  22.836   6.483
    3    HB2  HIS  98           HB2      HIS  98   7.400  22.561   3.752
    4    HB3  HIS  98           HB3      HIS  98   8.832  23.551   4.045
    5    HD1  HIS  98           HD1      HIS  98   7.645  19.972   4.073
    6    HD2  HIS  98           HD2      HIS  98  11.210  22.094   4.505
    7    HE1  HIS  98           HE1      HIS  98   9.511  18.255   4.031
    8    HE2  HIS  98           HE2      HIS  98  11.687  19.527   4.294

  No H/Q in entry =           8
  In of MODEL   28
    1    H    GLU  99           H        GLU  99   5.458  23.645   5.290
    2    HA   GLU  99           HA       GLU  99   5.819  26.462   5.223
    3    HB2  GLU  99           HB2      GLU  99   3.952  25.276   4.089
    4    HB3  GLU  99           HB3      GLU  99   3.252  24.916   5.667
    5    HG2  GLU  99           HG2      GLU  99   3.054  27.308   6.158
    6    HG3  GLU  99           HG3      GLU  99   3.834  27.707   4.631

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LYS 100           H        LYS 100   4.692  24.228   7.749
    2    HA   LYS 100           HA       LYS 100   4.084  26.286   9.633
    3    HB2  LYS 100           HB2      LYS 100   4.677  23.340   9.992
    4    HB3  LYS 100           HB3      LYS 100   4.217  24.414  11.318
    5    HG2  LYS 100           HG2      LYS 100   2.152  25.034  10.059
    6    HG3  LYS 100           HG3      LYS 100   2.592  23.863   8.813
    7    HD2  LYS 100           HD2      LYS 100   2.519  22.048  10.481
    8    HD3  LYS 100           HD3      LYS 100   2.096  23.213  11.738
    9    HE2  LYS 100           HE2      LYS 100   0.045  23.816  10.464
   10    HE3  LYS 100           HE3      LYS 100   0.458  22.594   9.254
   11    HZ1  LYS 100           HZ1      LYS 100   0.184  21.937  12.137
   12    HZ3  LYS 100           HZ2      LYS 100   0.181  20.878  10.806
   13    HZ2  LYS 100           HZ3      LYS 100  -1.142  21.909  11.076

  No H/Q in entry =          13
  In of MODEL   28
    1    H    LEU 101           H        LEU 101   7.022  24.506   8.818
    2    HA   LEU 101           HA       LEU 101   8.606  25.364  11.025
    3    HB2  LEU 101           HB2      LEU 101   9.219  24.371   8.253
    4    HB3  LEU 101           HB3      LEU 101  10.512  25.048   9.238
    5    HG   LEU 101           HG       LEU 101   8.689  22.884  10.302
    6   HD12  LEU 101          HD11      LEU 101  10.755  21.399   9.708
    7   HD11  LEU 101          HD12      LEU 101  11.119  22.660   8.532
    8   HD13  LEU 101          HD13      LEU 101   9.596  21.778   8.435
    9   HD21  LEU 101          HD21      LEU 101  11.403  24.012  11.037
   10   HD23  LEU 101          HD22      LEU 101  10.867  22.438  11.620
   11   HD22  LEU 101          HD23      LEU 101   9.964  23.890  12.049

  No H/Q in entry =          11
  In of MODEL   28
    1    H    LYS 102           H        LYS 102   7.021  27.210   8.871
    2    HA   LYS 102           HA       LYS 102   7.086  29.502   8.571
    3    HB2  LYS 102           HB2      LYS 102   8.642  29.404  10.676
    4    HB3  LYS 102           HB3      LYS 102   9.945  29.602   9.521
    5    HG2  LYS 102           HG2      LYS 102   7.824  31.545  10.367
    6    HG3  LYS 102           HG3      LYS 102   9.536  31.815  10.122
    7    HD2  LYS 102           HD2      LYS 102   7.597  31.371   7.815
    8    HD3  LYS 102           HD3      LYS 102   7.968  32.956   8.479
    9    HE2  LYS 102           HE2      LYS 102   9.357  31.772   6.416
   10    HE3  LYS 102           HE3      LYS 102   9.961  33.086   7.425
   11    HZ2  LYS 102           HZ1      LYS 102  11.494  31.190   7.264
   12    HZ1  LYS 102           HZ2      LYS 102  10.334  30.203   8.005
   13    HZ3  LYS 102           HZ3      LYS 102  11.016  31.497   8.862

  No H/Q in entry =          13
  In of MODEL   28
    1    H    ALA 103           H        ALA 103  10.353  28.180   8.025
    2    HA   ALA 103           HA       ALA 103  11.318  29.555   5.948
    3    HB2  ALA 103           HB1      ALA 103  12.220  27.343   5.032
    4    HB1  ALA 103           HB2      ALA 103  11.324  26.568   6.337
    5    HB3  ALA 103           HB3      ALA 103  12.605  27.721   6.712

  No H/Q in entry =           5
  In of MODEL   28
    1    H1   LYS   3           H1       LYS   3 -31.145   6.510 -19.545
    2    H2   LYS   3           H3       LYS   3 -30.161   6.233 -20.902
    3    H3   LYS   3           H2       LYS   3 -31.561   5.303 -20.663
    4    HA   LYS   3           HA       LYS   3 -30.565   3.888 -19.282
    5    HB2  LYS   3           HB2      LYS   3 -28.277   5.303 -20.600
    6    HB3  LYS   3           HB3      LYS   3 -27.958   4.076 -19.374
    7    HG2  LYS   3           HG2      LYS   3 -29.393   2.518 -20.743
    8    HG3  LYS   3           HG3      LYS   3 -29.342   3.736 -22.017
    9    HD2  LYS   3           HD2      LYS   3 -26.860   3.604 -21.973
   10    HD3  LYS   3           HD3      LYS   3 -26.986   2.290 -20.803
   11    HE2  LYS   3           HE2      LYS   3 -28.496   1.148 -22.533
   12    HE3  LYS   3           HE3      LYS   3 -27.870   2.338 -23.675
   13    HZ3  LYS   3           HZ1      LYS   3 -26.082   1.101 -23.964
   14    HZ2  LYS   3           HZ2      LYS   3 -26.717  -0.077 -22.919
   15    HZ1  LYS   3           HZ3      LYS   3 -25.717   1.152 -22.306

  No H/Q in entry =          15
  In of MODEL   28
    1    H    LYS   4           H        LYS   4 -30.615   3.718 -17.222
    2    HA   LYS   4           HA       LYS   4 -29.864   5.977 -15.543
    3    HB2  LYS   4           HB2      LYS   4 -31.084   3.284 -14.877
    4    HB3  LYS   4           HB3      LYS   4 -30.850   4.605 -13.733
    5    HG2  LYS   4           HG2      LYS   4 -32.663   4.590 -16.151
    6    HG3  LYS   4           HG3      LYS   4 -33.150   4.621 -14.458
    7    HD2  LYS   4           HD2      LYS   4 -32.436   6.834 -14.162
    8    HD3  LYS   4           HD3      LYS   4 -31.400   6.787 -15.588
    9    HE2  LYS   4           HE2      LYS   4 -33.316   8.182 -16.028
   10    HE3  LYS   4           HE3      LYS   4 -33.410   6.724 -17.016
   11    HZ3  LYS   4           HZ1      LYS   4 -34.989   5.803 -15.477
   12    HZ2  LYS   4           HZ2      LYS   4 -35.533   7.311 -16.040
   13    HZ1  LYS   4           HZ3      LYS   4 -34.874   7.173 -14.481

  No H/Q in entry =          13
  In of MODEL   28
    1    H    HIS   5           H        HIS   5 -28.391   6.028 -13.954
    2    HA   HIS   5           HA       HIS   5 -26.125   4.184 -14.315
    3    HB2  HIS   5           HB2      HIS   5 -26.353   6.925 -13.071
    4    HB3  HIS   5           HB3      HIS   5 -24.880   5.957 -13.070
    5    HD1  HIS   5           HD1      HIS   5 -23.402   7.165 -14.646
    6    HD2  HIS   5           HD2      HIS   5 -27.212   6.600 -16.201
    7    HE1  HIS   5           HE1      HIS   5 -23.235   7.777 -17.090
    8    HE2  HIS   5           HE2      HIS   5 -25.558   7.420 -18.006

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ILE   6           H        ILE   6 -25.908   2.591 -13.021
    2    HA   ILE   6           HA       ILE   6 -26.874   2.831 -10.251
    3    HB   ILE   6           HB       ILE   6 -26.076   0.378 -11.823
    4   HG12  ILE   6          HG12      ILE   6 -28.809   1.328 -10.953
    5   HG13  ILE   6          HG13      ILE   6 -28.168   1.506 -12.586
    6   HG23  ILE   6          HG21      ILE   6 -26.457  -0.896  -9.979
    7   HG22  ILE   6          HG22      ILE   6 -27.602   0.251  -9.281
    8   HG21  ILE   6          HG23      ILE   6 -25.870   0.570  -9.192
    9   HD13  ILE   6          HD11      ILE   6 -28.649  -0.600 -13.114
   10   HD12  ILE   6          HD12      ILE   6 -29.661  -0.594 -11.669
   11   HD11  ILE   6          HD13      ILE   6 -28.014  -1.218 -11.590

  No H/Q in entry =          11
  In of MODEL   28
    1    H    TYR   7           H        TYR   7 -25.106   3.437  -8.959
    2    HA   TYR   7           HA       TYR   7 -22.406   2.462  -9.659
    3    HB2  TYR   7           HB2      TYR   7 -23.342   4.886  -8.142
    4    HB3  TYR   7           HB3      TYR   7 -21.663   4.355  -8.191
    5    HD1  TYR   7           HD1      TYR   7 -22.718   3.465 -11.292
    6    HD2  TYR   7           HD2      TYR   7 -22.008   7.000  -9.019
    7    HE1  TYR   7           HE1      TYR   7 -22.279   4.718 -13.367
    8    HE2  TYR   7           HE2      TYR   7 -21.610   8.259 -11.086
    9    HH   TYR   7           HH       TYR   7 -21.835   8.205 -13.319

  No H/Q in entry =           9
  In of MODEL   28
    1    H    LEU   8           H        LEU   8 -21.451   1.083  -8.350
    2    HA   LEU   8           HA       LEU   8 -22.581   0.564  -5.671
    3    HB2  LEU   8           HB2      LEU   8 -20.899  -1.092  -7.531
    4    HB3  LEU   8           HB3      LEU   8 -21.085  -1.495  -5.825
    5    HG   LEU   8           HG       LEU   8 -23.567  -1.636  -6.243
    6   HD13  LEU   8          HD11      LEU   8 -23.689  -0.391  -8.336
    7   HD12  LEU   8          HD12      LEU   8 -24.237  -2.045  -8.598
    8   HD11  LEU   8          HD13      LEU   8 -22.626  -1.557  -9.119
    9   HD23  LEU   8          HD21      LEU   8 -22.318  -3.667  -7.968
   10   HD22  LEU   8          HD22      LEU   8 -23.404  -3.842  -6.590
   11   HD21  LEU   8          HD23      LEU   8 -21.693  -3.510  -6.327

  No H/Q in entry =          11
  In of MODEL   28
    1    H    PHE   9           H        PHE   9 -21.299   0.911  -3.881
    2    HA   PHE   9           HA       PHE   9 -18.508   1.836  -4.381
    3    HB2  PHE   9           HB2      PHE   9 -20.529   2.872  -2.401
    4    HB3  PHE   9           HB3      PHE   9 -18.812   3.242  -2.314
    5    HD1  PHE   9           HD1      PHE   9 -17.715   4.545  -4.093
    6    HD2  PHE   9           HD2      PHE   9 -21.950   3.857  -4.108
    7    HE1  PHE   9           HE1      PHE   9 -17.998   6.321  -5.796
    8    HE2  PHE   9           HE2      PHE   9 -22.234   5.646  -5.805
    9    HZ   PHE   9           HZ       PHE   9 -20.256   6.873  -6.656

  No H/Q in entry =           9
  In of MODEL   28
    1    H    SER  10           H        SER  10 -16.931   0.810  -3.334
    2    HA   SER  10           HA       SER  10 -17.135  -0.165  -0.661
    3    HB2  SER  10           HB2      SER  10 -17.103  -2.489  -0.989
    4    HB3  SER  10           HB3      SER  10 -18.326  -1.932  -2.120
    5    HG   SER  10           HG       SER  10 -16.341  -1.764  -3.574

  No H/Q in entry =           5
  In of MODEL   28
    1    H    SER  11           H        SER  11 -15.120  -0.020   0.174
    2    HA   SER  11           HA       SER  11 -12.945   0.876  -1.343
    3    HB2  SER  11           HB2      SER  11 -11.742   0.870   0.638
    4    HB3  SER  11           HB3      SER  11 -13.408   0.967   1.209
    5    HG   SER  11           HG       SER  11 -11.893  -0.702   2.137

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA  12           H        ALA  12 -14.147  -1.848  -2.159
    2    HA   ALA  12           HA       ALA  12 -11.555  -3.042  -2.753
    3    HB3  ALA  12           HB1      ALA  12 -12.142  -4.232  -0.725
    4    HB2  ALA  12           HB2      ALA  12 -12.317  -5.322  -2.100
    5    HB1  ALA  12           HB3      ALA  12 -13.747  -4.598  -1.364

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLY  13           H        GLY  13 -12.335  -2.029  -4.765
    2    HA3  GLY  13           HA2      GLY  13 -14.583  -2.688  -6.228
    3    HA2  GLY  13           HA3      GLY  13 -13.027  -2.266  -6.958

  No H/Q in entry =           3
  In of MODEL   28
    1    H    MET  14           H        MET  14 -11.556  -4.576  -6.054
    2    HA   MET  14           HA       MET  14 -12.000  -6.314  -8.163
    3    HB2  MET  14           HB2      MET  14  -9.926  -6.422  -6.874
    4    HB3  MET  14           HB3      MET  14 -10.784  -7.098  -5.491
    5    HG2  MET  14           HG2      MET  14 -11.398  -9.073  -6.851
    6    HG3  MET  14           HG3      MET  14 -10.544  -8.387  -8.233
    7    HE1  MET  14           HE1      MET  14  -8.331  -8.008  -8.531
    8    HE3  MET  14           HE2      MET  14  -6.948  -8.613  -7.621
    9    HE2  MET  14           HE3      MET  14  -7.783  -7.160  -7.077

  No H/Q in entry =           9
  In of MODEL   28
    1    H    SER  15           H        SER  15 -13.212  -6.814  -4.835
    2    HA   SER  15           HA       SER  15 -14.586  -9.234  -5.596
    3    HB2  SER  15           HB2      SER  15 -13.955  -8.847  -3.224
    4    HB3  SER  15           HB3      SER  15 -15.104  -7.513  -3.157
    5    HG   SER  15           HG       SER  15 -16.752  -9.027  -3.693

  No H/Q in entry =           5
  In of MODEL   28
    1    H    THR  16           H        THR  16 -15.631  -5.844  -5.120
    2    HA   THR  16           HA       THR  16 -18.425  -6.313  -5.642
    3    HB   THR  16           HB       THR  16 -16.849  -3.760  -6.118
    4    HG1  THR  16           HG1      THR  16 -16.410  -4.083  -4.070
    5   HG21  THR  16          HG21      THR  16 -19.263  -3.985  -6.910
    6   HG23  THR  16          HG22      THR  16 -18.942  -2.651  -5.789
    7   HG22  THR  16          HG23      THR  16 -19.702  -4.141  -5.214

  No H/Q in entry =           7
  In of MODEL   28
    1    H    SER  17           H        SER  17 -15.604  -5.738  -7.499
    2    HA   SER  17           HA       SER  17 -16.728  -4.955  -9.989
    3    HB2  SER  17           HB2      SER  17 -14.113  -6.323  -9.322
    4    HB3  SER  17           HB3      SER  17 -14.552  -5.827 -10.956
    5    HG   SER  17           HG       SER  17 -14.669  -3.995  -8.829

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU  18           H        LEU  18 -16.186  -8.123  -8.584
    2    HA   LEU  18           HA       LEU  18 -16.790  -9.586 -10.958
    3    HB2  LEU  18           HB2      LEU  18 -15.578 -10.608  -9.098
    4    HB3  LEU  18           HB3      LEU  18 -16.970 -10.371  -8.043
    5    HG   LEU  18           HG       LEU  18 -18.286 -11.846  -9.600
    6   HD12  LEU  18          HD11      LEU  18 -16.726 -13.396 -10.959
    7   HD11  LEU  18          HD12      LEU  18 -15.543 -12.095 -10.814
    8   HD13  LEU  18          HD13      LEU  18 -17.084 -11.802 -11.620
    9   HD22  LEU  18          HD21      LEU  18 -17.480 -13.856  -8.637
   10   HD21  LEU  18          HD22      LEU  18 -17.268 -12.560  -7.457
   11   HD23  LEU  18          HD23      LEU  18 -15.882 -13.155  -8.371

  No H/Q in entry =          11
  In of MODEL   28
    1    H    LEU  19           H        LEU  19 -18.744  -8.397  -8.228
    2    HA   LEU  19           HA       LEU  19 -21.219  -9.547  -9.073
    3    HB2  LEU  19           HB2      LEU  19 -20.930  -8.741  -6.810
    4    HB3  LEU  19           HB3      LEU  19 -20.650  -7.103  -7.401
    5    HG   LEU  19           HG       LEU  19 -23.023  -7.062  -8.190
    6   HD11  LEU  19          HD11      LEU  19 -23.361  -9.508  -8.296
    7   HD13  LEU  19          HD12      LEU  19 -24.568  -8.717  -7.282
    8   HD12  LEU  19          HD13      LEU  19 -23.227  -9.586  -6.539
    9   HD21  LEU  19          HD21      LEU  19 -22.478  -7.490  -5.259
   10   HD23  LEU  19          HD22      LEU  19 -23.934  -6.742  -5.917
   11   HD22  LEU  19          HD23      LEU  19 -22.365  -5.973  -6.152

  No H/Q in entry =          11
  In of MODEL   28
    1    H    VAL  20           H        VAL  20 -19.695  -6.391  -9.728
    2    HA   VAL  20           HA       VAL  20 -21.799  -5.309 -11.281
    3    HB   VAL  20           HB       VAL  20 -18.805  -4.744 -11.416
    4   HG13  VAL  20          HG11      VAL  20 -19.530  -4.001 -13.516
    5   HG12  VAL  20          HG12      VAL  20 -19.695  -2.558 -12.516
    6   HG11  VAL  20          HG13      VAL  20 -21.116  -3.526 -12.908
    7   HG23  VAL  20          HG21      VAL  20 -19.681  -2.556 -10.371
    8   HG22  VAL  20          HG22      VAL  20 -19.538  -3.989  -9.355
    9   HG21  VAL  20          HG23      VAL  20 -21.115  -3.506  -9.979

  No H/Q in entry =           9
  In of MODEL   28
    1    H    SER  21           H        SER  21 -19.061  -7.371 -12.339
    2    HA   SER  21           HA       SER  21 -19.848  -7.216 -15.086
    3    HB2  SER  21           HB2      SER  21 -18.430  -9.190 -15.448
    4    HB3  SER  21           HB3      SER  21 -17.589  -7.965 -14.500
    5    HG   SER  21           HG       SER  21 -17.647  -9.204 -12.791

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LYS  22           H        LYS  22 -20.930  -9.425 -12.543
    2    HA   LYS  22           HA       LYS  22 -22.487 -11.006 -14.384
    3    HB2  LYS  22           HB2      LYS  22 -21.696 -11.527 -11.911
    4    HB3  LYS  22           HB3      LYS  22 -23.245 -10.785 -11.511
    5    HG2  LYS  22           HG2      LYS  22 -24.404 -12.447 -12.873
    6    HG3  LYS  22           HG3      LYS  22 -22.860 -13.183 -13.297
    7    HD2  LYS  22           HD2      LYS  22 -22.486 -13.614 -10.859
    8    HD3  LYS  22           HD3      LYS  22 -24.133 -13.054 -10.565
    9    HE2  LYS  22           HE2      LYS  22 -24.852 -14.850 -12.256
   10    HE3  LYS  22           HE3      LYS  22 -23.226 -15.505 -12.067
   11    HZ2  LYS  22           HZ1      LYS  22 -25.491 -15.762 -10.367
   12    HZ1  LYS  22           HZ2      LYS  22 -24.148 -15.162  -9.516
   13    HZ3  LYS  22           HZ3      LYS  22 -24.029 -16.629 -10.362

  No H/Q in entry =          13
  In of MODEL   28
    1    H    MET  23           H        MET  23 -23.178  -8.102 -12.476
    2    HA   MET  23           HA       MET  23 -25.987  -8.146 -12.979
    3    HB2  MET  23           HB2      MET  23 -24.117  -5.864 -12.378
    4    HB3  MET  23           HB3      MET  23 -25.860  -5.676 -12.552
    5    HG2  MET  23           HG2      MET  23 -26.262  -7.001 -10.600
    6    HG3  MET  23           HG3      MET  23 -24.556  -7.431 -10.481
    7    HE2  MET  23           HE1      MET  23 -26.815  -3.772  -9.241
    8    HE1  MET  23           HE2      MET  23 -27.081  -4.718 -10.704
    9    HE3  MET  23           HE3      MET  23 -26.031  -3.302 -10.750

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ARG  24           H        ARG  24 -23.221  -6.723 -14.748
    2    HA   ARG  24           HA       ARG  24 -24.706  -5.379 -16.727
    3    HB2  ARG  24           HB2      ARG  24 -22.254  -5.023 -16.335
    4    HB3  ARG  24           HB3      ARG  24 -21.943  -6.606 -17.002
    5    HG2  ARG  24           HG2      ARG  24 -22.789  -5.881 -19.222
    6    HG3  ARG  24           HG3      ARG  24 -23.156  -4.276 -18.538
    7    HD2  ARG  24           HD2      ARG  24 -20.975  -4.150 -19.615
    8    HD3  ARG  24           HD3      ARG  24 -20.751  -4.097 -17.872
    9    HE   ARG  24           HE       ARG  24 -19.509  -5.923 -17.895
   10   HH21  ARG  24          HH11      ARG  24 -17.932  -6.812 -19.228
   11   HH22  ARG  24          HH12      ARG  24 -18.382  -7.489 -20.754
   12   HH11  ARG  24          HH21      ARG  24 -21.657  -6.172 -20.500
   13   HH12  ARG  24          HH22      ARG  24 -20.590  -7.114 -21.493

  No H/Q in entry =          13
  In of MODEL   28
    1    H    ALA  25           H        ALA  25 -23.621  -8.733 -16.498
    2    HA   ALA  25           HA       ALA  25 -24.262  -9.521 -19.146
    3    HB1  ALA  25           HB1      ALA  25 -23.589 -11.570 -18.480
    4    HB3  ALA  25           HB2      ALA  25 -24.645 -11.557 -17.067
    5    HB2  ALA  25           HB3      ALA  25 -23.080 -10.748 -17.004

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLN  26           H        GLN  26 -26.086  -9.580 -16.121
    2    HA   GLN  26           HA       GLN  26 -28.445 -10.741 -17.153
    3    HB2  GLN  26           HB2      GLN  26 -27.910  -9.033 -14.742
    4    HB3  GLN  26           HB3      GLN  26 -29.481  -9.733 -15.100
    5    HG2  GLN  26           HG2      GLN  26 -26.913 -11.227 -14.654
    6    HG3  GLN  26           HG3      GLN  26 -28.271 -11.123 -13.542
    7   HE21  GLN  26          HE21      GLN  26 -27.081 -13.284 -14.851
    8   HE22  GLN  26          HE22      GLN  26 -28.136 -14.307 -15.660

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ALA  27           H        ALA  27 -27.469  -7.360 -16.713
    2    HA   ALA  27           HA       ALA  27 -29.946  -6.227 -17.479
    3    HB1  ALA  27           HB1      ALA  27 -28.120  -4.950 -16.347
    4    HB3  ALA  27           HB2      ALA  27 -28.702  -4.156 -17.811
    5    HB2  ALA  27           HB3      ALA  27 -27.177  -5.040 -17.836

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLU  28           H        GLU  28 -27.262  -7.455 -19.369
    2    HA   GLU  28           HA       GLU  28 -28.186  -6.367 -21.871
    3    HB2  GLU  28           HB2      GLU  28 -25.815  -7.088 -21.260
    4    HB3  GLU  28           HB3      GLU  28 -26.380  -8.742 -21.486
    5    HG2  GLU  28           HG2      GLU  28 -25.226  -7.952 -23.444
    6    HG3  GLU  28           HG3      GLU  28 -26.928  -8.248 -23.795

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LYS  29           H        LYS  29 -28.389  -9.495 -20.260
    2    HA   LYS  29           HA       LYS  29 -29.712 -10.919 -22.286
    3    HB2  LYS  29           HB2      LYS  29 -28.672 -11.945 -20.297
    4    HB3  LYS  29           HB3      LYS  29 -29.935 -11.238 -19.291
    5    HG2  LYS  29           HG2      LYS  29 -31.613 -12.573 -20.377
    6    HG3  LYS  29           HG3      LYS  29 -30.422 -13.207 -21.512
    7    HD2  LYS  29           HD2      LYS  29 -29.294 -14.413 -19.798
    8    HD3  LYS  29           HD3      LYS  29 -30.189 -13.580 -18.529
    9    HE2  LYS  29           HE2      LYS  29 -30.971 -15.913 -18.926
   10    HE3  LYS  29           HE3      LYS  29 -32.234 -14.702 -19.150
   11    HZ1  LYS  29           HZ1      LYS  29 -31.672 -14.807 -21.580
   12    HZ3  LYS  29           HZ2      LYS  29 -32.409 -16.194 -20.935
   13    HZ2  LYS  29           HZ3      LYS  29 -30.739 -16.181 -21.234

  No H/Q in entry =          13
  In of MODEL   28
    1    H    TYR  30           H        TYR  30 -31.076  -8.835 -19.749
    2    HA   TYR  30           HA       TYR  30 -33.745  -9.233 -20.995
    3    HB2  TYR  30           HB2      TYR  30 -33.075  -8.129 -18.257
    4    HB3  TYR  30           HB3      TYR  30 -34.696  -8.357 -18.912
    5    HD1  TYR  30           HD1      TYR  30 -35.635 -10.634 -19.159
    6    HD2  TYR  30           HD2      TYR  30 -31.790  -9.985 -17.449
    7    HE1  TYR  30           HE1      TYR  30 -35.573 -12.974 -18.398
    8    HE2  TYR  30           HE2      TYR  30 -31.729 -12.310 -16.691
    9    HH   TYR  30           HH       TYR  30 -33.398 -14.635 -17.818

  No H/Q in entry =           9
  In of MODEL   28
    1    H    GLU  31           H        GLU  31 -31.556  -7.256 -21.766
    2    HA   GLU  31           HA       GLU  31 -31.457  -5.087 -22.556
    3    HB2  GLU  31           HB2      GLU  31 -34.360  -5.760 -23.077
    4    HB3  GLU  31           HB3      GLU  31 -33.504  -4.392 -23.786
    5    HG2  GLU  31           HG2      GLU  31 -32.049  -5.829 -25.001
    6    HG3  GLU  31           HG3      GLU  31 -32.630  -7.250 -24.133

  No H/Q in entry =           6
  In of MODEL   28
    1    H    VAL  32           H        VAL  32 -31.653  -5.025 -19.823
    2    HA   VAL  32           HA       VAL  32 -33.490  -2.901 -19.129
    3    HB   VAL  32           HB       VAL  32 -31.108  -3.945 -17.566
    4   HG12  VAL  32          HG11      VAL  32 -32.633  -3.134 -15.657
    5   HG11  VAL  32          HG12      VAL  32 -33.457  -2.201 -16.907
    6   HG13  VAL  32          HG13      VAL  32 -31.745  -1.921 -16.583
    7   HG21  VAL  32          HG21      VAL  32 -32.896  -5.635 -18.279
    8   HG23  VAL  32          HG22      VAL  32 -33.926  -4.814 -17.106
    9   HG22  VAL  32          HG23      VAL  32 -32.416  -5.562 -16.584

  No H/Q in entry =           9
  In of MODEL   28
    1    HA   PRO  33           HA       PRO  33 -30.427   0.019 -20.761
    2    HB2  PRO  33           HB2      PRO  33 -31.915   2.256 -20.602
    3    HB3  PRO  33           HB3      PRO  33 -32.398   0.976 -21.715
    4    HG2  PRO  33           HG2      PRO  33 -33.358   1.459 -18.894
    5    HG3  PRO  33           HG3      PRO  33 -34.326   1.283 -20.359
    6    HD2  PRO  33           HD2      PRO  33 -33.891  -0.819 -18.725
    7    HD3  PRO  33           HD3      PRO  33 -33.957  -1.033 -20.474

  No H/Q in entry =           7
  In of MODEL   28
    1    H    VAL  34           H        VAL  34 -29.168  -0.568 -18.823
    2    HA   VAL  34           HA       VAL  34 -28.857   1.828 -17.138
    3    HB   VAL  34           HB       VAL  34 -28.290   0.331 -15.223
    4   HG12  VAL  34          HG11      VAL  34 -30.711  -0.522 -14.927
    5   HG11  VAL  34          HG12      VAL  34 -31.021   0.265 -16.473
    6   HG13  VAL  34          HG13      VAL  34 -30.456   1.215 -15.098
    7   HG21  VAL  34          HG21      VAL  34 -28.498  -1.662 -17.262
    8   HG23  VAL  34          HG22      VAL  34 -29.557  -2.033 -15.901
    9   HG22  VAL  34          HG23      VAL  34 -27.836  -1.769 -15.631

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ILE  35           H        ILE  35 -26.876   2.230 -16.293
    2    HA   ILE  35           HA       ILE  35 -24.586   0.897 -17.579
    3    HB   ILE  35           HB       ILE  35 -24.956   3.778 -16.723
    4   HG12  ILE  35          HG12      ILE  35 -23.989   2.501 -19.288
    5   HG13  ILE  35          HG13      ILE  35 -25.613   3.134 -19.017
    6   HG21  ILE  35          HG21      ILE  35 -22.410   2.225 -17.058
    7   HG23  ILE  35          HG22      ILE  35 -22.852   3.388 -15.810
    8   HG22  ILE  35          HG23      ILE  35 -22.465   3.945 -17.439
    9   HD11  ILE  35          HD11      ILE  35 -24.189   5.304 -18.384
   10   HD13  ILE  35          HD12      ILE  35 -24.731   4.952 -20.025
   11   HD12  ILE  35          HD13      ILE  35 -23.082   4.558 -19.537

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ILE  36           H        ILE  36 -23.364  -0.163 -15.997
    2    HA   ILE  36           HA       ILE  36 -23.796   0.411 -13.116
    3    HB   ILE  36           HB       ILE  36 -22.996  -2.282 -14.268
    4   HG12  ILE  36          HG12      ILE  36 -25.794  -1.461 -13.488
    5   HG13  ILE  36          HG13      ILE  36 -25.224  -1.420 -15.157
    6   HG23  ILE  36          HG21      ILE  36 -23.353  -3.141 -12.167
    7   HG22  ILE  36          HG22      ILE  36 -24.467  -1.853 -11.706
    8   HG21  ILE  36          HG23      ILE  36 -22.733  -1.537 -11.775
    9   HD13  ILE  36          HD11      ILE  36 -25.411  -3.628 -15.398
   10   HD12  ILE  36          HD12      ILE  36 -26.474  -3.519 -13.995
   11   HD11  ILE  36          HD13      ILE  36 -24.780  -3.958 -13.784

  No H/Q in entry =          11
  In of MODEL   28
    1    H    GLU  37           H        GLU  37 -22.007   1.005 -12.004
    2    HA   GLU  37           HA       GLU  37 -19.325   0.198 -12.936
    3    HB2  GLU  37           HB2      GLU  37 -20.199   2.985 -12.194
    4    HB3  GLU  37           HB3      GLU  37 -18.514   2.479 -12.329
    5    HG2  GLU  37           HG2      GLU  37 -18.789   2.079 -14.689
    6    HG3  GLU  37           HG3      GLU  37 -20.503   2.477 -14.580

  No H/Q in entry =           6
  In of MODEL   28
    1    H    ALA  38           H        ALA  38 -17.839  -0.081 -11.259
    2    HA   ALA  38           HA       ALA  38 -18.866   0.065  -8.484
    3    HB1  ALA  38           HB1      ALA  38 -17.171  -1.867  -9.942
    4    HB3  ALA  38           HB2      ALA  38 -18.221  -2.116  -8.548
    5    HB2  ALA  38           HB3      ALA  38 -16.603  -1.451  -8.325

  No H/Q in entry =           5
  In of MODEL   28
    1    H    PHE  39           H        PHE  39 -17.613   1.240  -6.994
    2    HA   PHE  39           HA       PHE  39 -15.079   2.433  -7.875
    3    HB2  PHE  39           HB2      PHE  39 -17.495   3.918  -6.869
    4    HB3  PHE  39           HB3      PHE  39 -15.866   4.572  -6.702
    5    HD1  PHE  39           HD1      PHE  39 -14.485   4.850  -8.821
    6    HD2  PHE  39           HD2      PHE  39 -18.704   4.234  -8.814
    7    HE1  PHE  39           HE1      PHE  39 -14.614   5.796 -11.108
    8    HE2  PHE  39           HE2      PHE  39 -18.849   5.168 -11.095
    9    HZ   PHE  39           HZ       PHE  39 -16.806   5.924 -12.262

  No H/Q in entry =           9
  In of MODEL   28
    1    HA   PRO  40           HA       PRO  40 -14.142   1.606  -3.601
    2    HB2  PRO  40           HB2      PRO  40 -12.358   3.595  -2.965
    3    HB3  PRO  40           HB3      PRO  40 -11.926   2.280  -4.057
    4    HG2  PRO  40           HG2      PRO  40 -12.933   5.034  -4.755
    5    HG3  PRO  40           HG3      PRO  40 -11.512   4.195  -5.376
    6    HD2  PRO  40           HD2      PRO  40 -13.736   4.140  -6.788
    7    HD3  PRO  40           HD3      PRO  40 -12.791   2.662  -6.616

  No H/Q in entry =           7
  In of MODEL   28
    1    H    GLU  41           H        GLU  41 -14.754   2.555  -1.456
    2    HA   GLU  41           HA       GLU  41 -16.986   4.274  -1.410
    3    HB2  GLU  41           HB2      GLU  41 -16.805   4.194   0.981
    4    HB3  GLU  41           HB3      GLU  41 -16.411   2.596   0.344
    5    HG2  GLU  41           HG2      GLU  41 -14.013   3.095   0.641
    6    HG3  GLU  41           HG3      GLU  41 -14.446   4.653   1.346

  No H/Q in entry =           6
  In of MODEL   28
    1    H    THR  42           H        THR  42 -13.648   5.168  -1.452
    2    HA   THR  42           HA       THR  42 -13.982   7.712  -0.200
    3    HB   THR  42           HB       THR  42 -11.822   8.288  -1.282
    4    HG1  THR  42           HG1      THR  42 -11.173   7.189  -2.954
    5   HG22  THR  42          HG21      THR  42 -10.521   6.297  -0.348
    6   HG21  THR  42          HG22      THR  42 -12.090   5.581   0.029
    7   HG23  THR  42          HG23      THR  42 -11.615   7.106   0.775

  No H/Q in entry =           7
  In of MODEL   28
    1    H    LEU  43           H        LEU  43 -14.897   6.672  -3.316
    2    HA   LEU  43           HA       LEU  43 -15.132   9.461  -4.243
    3    HB2  LEU  43           HB2      LEU  43 -15.322   6.794  -5.610
    4    HB3  LEU  43           HB3      LEU  43 -15.862   8.284  -6.381
    5    HG   LEU  43           HG       LEU  43 -13.029   7.692  -5.561
    6   HD11  LEU  43          HD11      LEU  43 -14.546   7.362  -8.116
    7   HD13  LEU  43          HD12      LEU  43 -13.354   6.294  -7.377
    8   HD12  LEU  43          HD13      LEU  43 -12.834   7.785  -8.160
    9   HD22  LEU  43          HD21      LEU  43 -13.201  10.006  -5.550
   10   HD21  LEU  43          HD22      LEU  43 -14.426  10.026  -6.820
   11   HD23  LEU  43          HD23      LEU  43 -12.743   9.689  -7.222

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ALA  44           H        ALA  44 -17.088   7.621  -2.416
    2    HA   ALA  44           HA       ALA  44 -19.568   7.518  -3.736
    3    HB2  ALA  44           HB1      ALA  44 -19.435   6.368  -1.658
    4    HB3  ALA  44           HB2      ALA  44 -20.533   7.717  -1.364
    5    HB1  ALA  44           HB3      ALA  44 -18.861   7.805  -0.812

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLY  45           H        GLY  45 -18.128  10.284  -2.164
    2    HA3  GLY  45           HA2      GLY  45 -20.554  11.807  -2.498
    3    HA2  GLY  45           HA3      GLY  45 -19.005  12.412  -1.914

  No H/Q in entry =           3
  In of MODEL   28
    1    H    GLU  46           H        GLU  46 -17.483  11.500  -4.220
    2    HA   GLU  46           HA       GLU  46 -18.107  13.746  -5.955
    3    HB2  GLU  46           HB2      GLU  46 -15.926  11.655  -6.005
    4    HB3  GLU  46           HB3      GLU  46 -16.050  12.983  -7.159
    5    HG2  GLU  46           HG2      GLU  46 -14.500  13.779  -5.660
    6    HG3  GLU  46           HG3      GLU  46 -15.998  14.490  -5.059

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LYS  47           H        LYS  47 -18.012  10.233  -6.443
    2    HA   LYS  47           HA       LYS  47 -19.112  10.502  -9.114
    3    HB2  LYS  47           HB2      LYS  47 -17.978   8.357  -7.456
    4    HB3  LYS  47           HB3      LYS  47 -19.333   7.852  -8.467
    5    HG2  LYS  47           HG2      LYS  47 -17.258   7.453  -9.613
    6    HG3  LYS  47           HG3      LYS  47 -18.158   8.729 -10.434
    7    HD2  LYS  47           HD2      LYS  47 -16.797  10.423  -9.371
    8    HD3  LYS  47           HD3      LYS  47 -15.946   9.192  -8.439
    9    HE2  LYS  47           HE2      LYS  47 -15.084   8.222 -10.510
   10    HE3  LYS  47           HE3      LYS  47 -15.935   9.453 -11.441
   11    HZ2  LYS  47           HZ1      LYS  47 -13.565   9.701  -9.751
   12    HZ1  LYS  47           HZ2      LYS  47 -14.618  11.030  -9.853
   13    HZ3  LYS  47           HZ3      LYS  47 -13.902  10.404 -11.261

  No H/Q in entry =          13
  In of MODEL   28
    1    H    GLY  48           H        GLY  48 -20.436   9.706  -5.975
    2    HA3  GLY  48           HA2      GLY  48 -22.830   8.548  -6.732
    3    HA2  GLY  48           HA3      GLY  48 -22.596   9.519  -5.278

  No H/Q in entry =           3
  In of MODEL   28
    1    H    GLN  49           H        GLN  49 -21.998  11.961  -6.813
    2    HA   GLN  49           HA       GLN  49 -24.550  13.092  -6.937
    3    HB2  GLN  49           HB2      GLN  49 -22.002  13.960  -8.287
    4    HB3  GLN  49           HB3      GLN  49 -23.458  14.933  -8.186
    5    HG2  GLN  49           HG2      GLN  49 -23.295  14.919  -5.750
    6    HG3  GLN  49           HG3      GLN  49 -21.853  13.924  -5.849
    7   HE21  GLN  49          HE21      GLN  49 -21.719  16.132  -4.543
    8   HE22  GLN  49          HE22      GLN  49 -20.788  17.392  -5.172

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ASN  50           H        ASN  50 -22.887  11.238  -9.354
    2    HA   ASN  50           HA       ASN  50 -24.766  12.154 -11.421
    3    HB2  ASN  50           HB2      ASN  50 -22.197  10.600 -11.681
    4    HB3  ASN  50           HB3      ASN  50 -23.246  11.054 -13.016
    5   HD21  ASN  50          HD21      ASN  50 -20.602  11.856 -11.396
    6   HD22  ASN  50          HD22      ASN  50 -20.358  13.495 -11.714

  No H/Q in entry =           6
  In of MODEL   28
    1    H    ALA  51           H        ALA  51 -24.766   9.764  -9.210
    2    HA   ALA  51           HA       ALA  51 -25.568   7.652 -11.068
    3    HB2  ALA  51           HB1      ALA  51 -24.993   6.274  -9.403
    4    HB3  ALA  51           HB2      ALA  51 -26.108   7.074  -8.297
    5    HB1  ALA  51           HB3      ALA  51 -24.465   7.686  -8.487

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ASP  52           H        ASP  52 -27.581   6.610 -10.942
    2    HA   ASP  52           HA       ASP  52 -29.748   8.450 -10.246
    3    HB2  ASP  52           HB2      ASP  52 -29.578   5.969 -11.955
    4    HB3  ASP  52           HB3      ASP  52 -31.117   6.707 -11.507

  No H/Q in entry =           4
  In of MODEL   28
    1    H    VAL  53           H        VAL  53 -28.169   5.533  -9.276
    2    HA   VAL  53           HA       VAL  53 -29.605   5.634  -6.757
    3    HB   VAL  53           HB       VAL  53 -31.018   4.023  -8.023
    4   HG11  VAL  53          HG11      VAL  53 -29.280   3.172  -9.560
    5   HG13  VAL  53          HG12      VAL  53 -30.122   1.871  -8.719
    6   HG12  VAL  53          HG13      VAL  53 -28.508   2.352  -8.204
    7   HG23  VAL  53          HG21      VAL  53 -30.211   2.013  -6.361
    8   HG22  VAL  53          HG22      VAL  53 -31.328   3.322  -5.974
    9   HG21  VAL  53          HG23      VAL  53 -29.620   3.473  -5.567

  No H/Q in entry =           9
  In of MODEL   28
    1    H    VAL  54           H        VAL  54 -28.294   5.165  -5.110
    2    HA   VAL  54           HA       VAL  54 -25.541   4.303  -5.738
    3    HB   VAL  54           HB       VAL  54 -26.593   6.055  -3.460
    4   HG11  VAL  54          HG11      VAL  54 -24.028   4.619  -3.775
    5   HG13  VAL  54          HG12      VAL  54 -24.773   5.283  -2.322
    6   HG12  VAL  54          HG13      VAL  54 -23.860   6.334  -3.404
    7   HG22  VAL  54          HG21      VAL  54 -25.720   7.879  -4.532
    8   HG21  VAL  54          HG22      VAL  54 -26.278   6.914  -5.899
    9   HG23  VAL  54          HG23      VAL  54 -24.570   6.917  -5.462

  No H/Q in entry =           9
  In of MODEL   28
    1    H    LEU  55           H        LEU  55 -24.965   2.366  -5.124
    2    HA   LEU  55           HA       LEU  55 -26.481   1.036  -2.968
    3    HB2  LEU  55           HB2      LEU  55 -24.938  -0.111  -5.282
    4    HB3  LEU  55           HB3      LEU  55 -25.705  -1.057  -4.007
    5    HG   LEU  55           HG       LEU  55 -27.131   0.574  -6.098
    6   HD13  LEU  55          HD11      LEU  55 -26.849  -1.262  -7.346
    7   HD12  LEU  55          HD12      LEU  55 -27.813  -2.147  -6.163
    8   HD11  LEU  55          HD13      LEU  55 -26.056  -2.100  -6.013
    9   HD23  LEU  55          HD21      LEU  55 -28.440  -1.388  -4.270
   10   HD22  LEU  55          HD22      LEU  55 -29.124   0.013  -5.097
   11   HD21  LEU  55          HD23      LEU  55 -28.100   0.238  -3.678

  No H/Q in entry =          11
  In of MODEL   28
    1    H    LEU  56           H        LEU  56 -25.334   0.404  -1.173
    2    HA   LEU  56           HA       LEU  56 -22.396   0.774  -1.220
    3    HB2  LEU  56           HB2      LEU  56 -24.197   0.544   1.177
    4    HB3  LEU  56           HB3      LEU  56 -22.484   0.957   1.170
    5    HG   LEU  56           HG       LEU  56 -24.769   2.671   0.235
    6   HD11  LEU  56          HD11      LEU  56 -23.655   2.242   2.748
    7   HD13  LEU  56          HD12      LEU  56 -24.633   3.626   2.264
    8   HD12  LEU  56          HD13      LEU  56 -22.875   3.717   2.176
    9   HD23  LEU  56          HD21      LEU  56 -22.809   4.354   0.065
   10   HD22  LEU  56          HD22      LEU  56 -23.203   3.282  -1.278
   11   HD21  LEU  56          HD23      LEU  56 -21.853   2.900  -0.213

  No H/Q in entry =          11
  In of MODEL   28
    1    H    GLY  57           H        GLY  57 -21.030  -0.877  -0.713
    2    HA3  GLY  57           HA2      GLY  57 -21.978  -3.552  -0.948
    3    HA2  GLY  57           HA3      GLY  57 -20.350  -3.078  -0.467

  No H/Q in entry =           3
  In of MODEL   28
    1    HA   PRO  58           HA       PRO  58 -23.163  -4.147   3.233
    2    HB2  PRO  58           HB2      PRO  58 -22.502  -6.767   3.800
    3    HB3  PRO  58           HB3      PRO  58 -23.884  -6.331   2.795
    4    HG2  PRO  58           HG2      PRO  58 -21.166  -7.225   1.991
    5    HG3  PRO  58           HG3      PRO  58 -22.736  -7.660   1.315
    6    HD2  PRO  58           HD2      PRO  58 -21.111  -5.840   0.117
    7    HD3  PRO  58           HD3      PRO  58 -22.869  -5.735   0.019

  No H/Q in entry =           7
  In of MODEL   28
    1    H    GLN  59           H        GLN  59 -19.798  -4.641   2.615
    2    HA   GLN  59           HA       GLN  59 -19.040  -4.708   5.373
    3    HB2  GLN  59           HB2      GLN  59 -17.439  -3.818   2.971
    4    HB3  GLN  59           HB3      GLN  59 -16.792  -4.097   4.574
    5    HG2  GLN  59           HG2      GLN  59 -18.085  -6.182   2.825
    6    HG3  GLN  59           HG3      GLN  59 -16.355  -5.955   3.025
    7   HE21  GLN  59          HE21      GLN  59 -18.272  -7.937   3.708
    8   HE22  GLN  59          HE22      GLN  59 -18.112  -8.661   5.198

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ILE  60           H        ILE  60 -19.953  -2.116   3.205
    2    HA   ILE  60           HA       ILE  60 -19.079  -0.198   5.279
    3    HB   ILE  60           HB       ILE  60 -19.280   1.563   3.489
    4   HG12  ILE  60          HG12      ILE  60 -19.138  -0.597   1.436
    5   HG13  ILE  60          HG13      ILE  60 -20.717  -0.095   2.040
    6   HG21  ILE  60          HG21      ILE  60 -17.174   0.263   4.175
    7   HG23  ILE  60          HG22      ILE  60 -17.140   1.261   2.724
    8   HG22  ILE  60          HG23      ILE  60 -17.323  -0.487   2.587
    9   HD13  ILE  60          HD11      ILE  60 -20.394   1.229   0.126
   10   HD12  ILE  60          HD12      ILE  60 -18.697   1.521   0.506
   11   HD11  ILE  60          HD13      ILE  60 -19.959   2.302   1.457

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ALA  61           H        ALA  61 -21.549  -1.761   5.328
    2    HA   ALA  61           HA       ALA  61 -23.760  -0.068   4.897
    3    HB1  ALA  61           HB1      ALA  61 -24.988  -1.565   6.202
    4    HB2  ALA  61           HB2      ALA  61 -23.593  -1.983   7.197
    5    HB3  ALA  61           HB3      ALA  61 -23.696  -2.564   5.534

  No H/Q in entry =           5
  In of MODEL   28
    1    H    TYR  62           H        TYR  62 -21.550  -0.243   7.690
    2    HA   TYR  62           HA       TYR  62 -23.087   1.404   9.386
    3    HB2  TYR  62           HB2      TYR  62 -21.058   1.771  10.638
    4    HB3  TYR  62           HB3      TYR  62 -21.099   0.089  10.111
    5    HD1  TYR  62           HD1      TYR  62 -19.527  -0.722   8.383
    6    HD2  TYR  62           HD2      TYR  62 -19.333   3.298   9.821
    7    HE1  TYR  62           HE1      TYR  62 -17.311  -0.457   7.333
    8    HE2  TYR  62           HE2      TYR  62 -17.104   3.556   8.774
    9    HH   TYR  62           HH       TYR  62 -15.545   0.824   7.170

  No H/Q in entry =           9
  In of MODEL   28
    1    H    MET  63           H        MET  63 -21.440   2.290   6.541
    2    HA   MET  63           HA       MET  63 -21.243   5.109   7.277
    3    HB2  MET  63           HB2      MET  63 -20.636   3.595   4.739
    4    HB3  MET  63           HB3      MET  63 -20.469   5.345   4.901
    5    HG2  MET  63           HG2      MET  63 -18.772   5.008   6.629
    6    HG3  MET  63           HG3      MET  63 -18.919   3.265   6.420
    7    HE3  MET  63           HE1      MET  63 -15.648   4.993   4.774
    8    HE2  MET  63           HE2      MET  63 -15.940   3.427   5.532
    9    HE1  MET  63           HE3      MET  63 -16.495   4.904   6.322

  No H/Q in entry =           9
  In of MODEL   28
    1    H    LEU  64           H        LEU  64 -23.827   3.295   6.288
    2    HA   LEU  64           HA       LEU  64 -25.026   4.757   4.233
    3    HB2  LEU  64           HB2      LEU  64 -25.914   2.647   5.121
    4    HB3  LEU  64           HB3      LEU  64 -26.361   3.472   6.615
    5    HG   LEU  64           HG       LEU  64 -28.044   4.762   5.408
    6   HD13  LEU  64          HD11      LEU  64 -27.762   5.034   3.179
    7   HD12  LEU  64          HD12      LEU  64 -28.425   3.408   3.010
    8   HD11  LEU  64          HD13      LEU  64 -26.679   3.647   3.069
    9   HD23  LEU  64          HD21      LEU  64 -28.593   1.967   4.619
   10   HD22  LEU  64          HD22      LEU  64 -29.568   3.097   5.558
   11   HD21  LEU  64          HD23      LEU  64 -28.200   2.278   6.311

  No H/Q in entry =          11
  In of MODEL   28
    1    HA   PRO  65           HA       PRO  65 -27.168   7.893   7.035
    2    HB2  PRO  65           HB2      PRO  65 -25.161   7.996   9.288
    3    HB3  PRO  65           HB3      PRO  65 -26.897   8.295   9.342
    4    HG2  PRO  65           HG2      PRO  65 -25.991   6.017  10.233
    5    HG3  PRO  65           HG3      PRO  65 -27.413   6.015   9.190
    6    HD2  PRO  65           HD2      PRO  65 -24.549   5.380   8.472
    7    HD3  PRO  65           HD3      PRO  65 -26.017   4.517   8.015

  No H/Q in entry =           7
  In of MODEL   28
    1    H    GLU  66           H        GLU  66 -23.612   7.797   7.101
    2    HA   GLU  66           HA       GLU  66 -23.283  10.597   6.737
    3    HB2  GLU  66           HB2      GLU  66 -21.499   8.280   6.048
    4    HB3  GLU  66           HB3      GLU  66 -21.029   9.969   5.865
    5    HG2  GLU  66           HG2      GLU  66 -21.233  10.307   8.238
    6    HG3  GLU  66           HG3      GLU  66 -21.777   8.642   8.446

  No H/Q in entry =           6
  In of MODEL   28
    1    H    ILE  67           H        ILE  67 -23.421   7.886   4.445
    2    HA   ILE  67           HA       ILE  67 -22.989   9.624   2.176
    3    HB   ILE  67           HB       ILE  67 -23.922   6.726   2.315
    4   HG12  ILE  67          HG12      ILE  67 -21.280   7.877   1.405
    5   HG13  ILE  67          HG13      ILE  67 -21.577   7.436   3.085
    6   HG21  ILE  67          HG21      ILE  67 -23.846   8.636   0.117
    7   HG23  ILE  67          HG22      ILE  67 -24.491   6.995   0.145
    8   HG22  ILE  67          HG23      ILE  67 -22.779   7.264  -0.182
    9   HD12  ILE  67          HD11      ILE  67 -21.182   5.695   0.708
   10   HD11  ILE  67          HD12      ILE  67 -22.201   5.115   2.025
   11   HD13  ILE  67          HD13      ILE  67 -20.523   5.554   2.338

  No H/Q in entry =          11
  In of MODEL   28
    1    H    GLN  68           H        GLN  68 -25.869   8.582   3.799
    2    HA   GLN  68           HA       GLN  68 -27.689   9.565   1.844
    3    HB2  GLN  68           HB2      GLN  68 -27.944   9.166   4.821
    4    HB3  GLN  68           HB3      GLN  68 -29.258   9.792   3.839
    5    HG2  GLN  68           HG2      GLN  68 -29.315   7.782   2.533
    6    HG3  GLN  68           HG3      GLN  68 -27.872   7.175   3.324
    7   HE21  GLN  68          HE21      GLN  68 -30.068   5.848   3.173
    8   HE22  GLN  68          HE22      GLN  68 -30.901   5.382   4.583

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ARG  69           H        ARG  69 -26.057  11.168   4.602
    2    HA   ARG  69           HA       ARG  69 -27.387  13.675   4.235
    3    HB2  ARG  69           HB2      ARG  69 -25.053  12.689   5.806
    4    HB3  ARG  69           HB3      ARG  69 -25.109  14.415   5.473
    5    HG2  ARG  69           HG2      ARG  69 -27.423  14.476   6.450
    6    HG3  ARG  69           HG3      ARG  69 -27.237  12.776   6.898
    7    HD2  ARG  69           HD2      ARG  69 -25.509  15.093   7.844
    8    HD3  ARG  69           HD3      ARG  69 -26.650  14.188   8.827
    9    HE   ARG  69           HE       ARG  69 -24.053  13.235   7.858
   10   HH21  ARG  69          HH11      ARG  69 -23.267  11.442   9.025
   11   HH22  ARG  69          HH12      ARG  69 -24.305  10.623  10.143
   12   HH11  ARG  69          HH21      ARG  69 -27.014  12.704   9.553
   13   HH12  ARG  69          HH22      ARG  69 -26.426  11.336  10.440

  No H/Q in entry =          13
  In of MODEL   28
    1    H    LEU  70           H        LEU  70 -24.540  12.249   2.848
    2    HA   LEU  70           HA       LEU  70 -23.395  14.615   1.714
    3    HB2  LEU  70           HB2      LEU  70 -22.433  12.274   2.272
    4    HB3  LEU  70           HB3      LEU  70 -23.058  11.841   0.680
    5    HG   LEU  70           HG       LEU  70 -21.446  13.207  -0.387
    6   HD11  LEU  70          HD11      LEU  70 -20.606  13.996   2.411
    7   HD13  LEU  70          HD12      LEU  70 -21.289  15.059   1.180
    8   HD12  LEU  70          HD13      LEU  70 -19.688  14.358   0.947
    9   HD22  LEU  70          HD21      LEU  70 -20.038  11.466  -0.184
   10   HD21  LEU  70          HD22      LEU  70 -20.970  10.936   1.217
   11   HD23  LEU  70          HD23      LEU  70 -19.568  11.985   1.434

  No H/Q in entry =          11
  In of MODEL   28
    1    H    LEU  71           H        LEU  71 -25.588  12.121   0.565
    2    HA   LEU  71           HA       LEU  71 -26.095  13.655  -1.927
    3    HB2  LEU  71           HB2      LEU  71 -26.346  10.668  -1.526
    4    HB3  LEU  71           HB3      LEU  71 -26.465  11.553  -3.045
    5    HG   LEU  71           HG       LEU  71 -23.941  11.501  -1.391
    6   HD12  LEU  71          HD11      LEU  71 -24.025   9.911  -3.847
    7   HD11  LEU  71          HD12      LEU  71 -25.042   9.284  -2.551
    8   HD13  LEU  71          HD13      LEU  71 -23.318   9.532  -2.276
    9   HD22  LEU  71          HD21      LEU  71 -24.019  13.341  -2.856
   10   HD21  LEU  71          HD22      LEU  71 -24.535  12.327  -4.203
   11   HD23  LEU  71          HD23      LEU  71 -22.915  12.144  -3.531

  No H/Q in entry =          11
  In of MODEL   28
    1    HA   PRO  72           HA       PRO  72 -29.963  13.229   0.697
    2    HB2  PRO  72           HB2      PRO  72 -30.778  15.805   0.656
    3    HB3  PRO  72           HB3      PRO  72 -29.474  15.314   1.737
    4    HG2  PRO  72           HG2      PRO  72 -29.273  16.548  -0.998
    5    HG3  PRO  72           HG3      PRO  72 -28.494  17.063   0.497
    6    HD2  PRO  72           HD2      PRO  72 -27.188  15.509  -1.296
    7    HD3  PRO  72           HD3      PRO  72 -26.933  15.312   0.437

  No H/Q in entry =           7
  In of MODEL   28
    1    H    ASN  73           H        ASN  73 -29.330  14.221  -2.505
    2    HA   ASN  73           HA       ASN  73 -32.196  13.972  -3.134
    3    HB2  ASN  73           HB2      ASN  73 -31.717  15.102  -5.217
    4    HB3  ASN  73           HB3      ASN  73 -31.173  16.053  -3.842
    5   HD21  ASN  73          HD21      ASN  73 -30.383  16.124  -6.520
    6   HD22  ASN  73          HD22      ASN  73 -28.719  15.936  -6.718

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LYS  74           H        LYS  74 -30.255  11.677  -2.748
    2    HA   LYS  74           HA       LYS  74 -30.853  10.330  -5.316
    3    HB2  LYS  74           HB2      LYS  74 -28.324   9.968  -3.706
    4    HB3  LYS  74           HB3      LYS  74 -28.725   9.186  -5.235
    5    HG2  LYS  74           HG2      LYS  74 -28.405  12.147  -4.989
    6    HG3  LYS  74           HG3      LYS  74 -27.052  11.064  -5.312
    7    HD2  LYS  74           HD2      LYS  74 -28.190  10.187  -7.267
    8    HD3  LYS  74           HD3      LYS  74 -29.591  11.204  -6.928
    9    HE2  LYS  74           HE2      LYS  74 -28.328  13.194  -7.343
   10    HE3  LYS  74           HE3      LYS  74 -26.825  12.278  -7.452
   11    HZ2  LYS  74           HZ1      LYS  74 -28.289  12.940  -9.565
   12    HZ1  LYS  74           HZ2      LYS  74 -28.970  11.424  -9.213
   13    HZ3  LYS  74           HZ3      LYS  74 -27.304  11.558  -9.511

  No H/Q in entry =          13
  In of MODEL   28
    1    HA   PRO  75           HA       PRO  75 -32.297   7.327  -2.387
    2    HB2  PRO  75           HB2      PRO  75 -32.652   5.140  -4.001
    3    HB3  PRO  75           HB3      PRO  75 -33.753   6.516  -4.048
    4    HG2  PRO  75           HG2      PRO  75 -31.431   5.902  -5.833
    5    HG3  PRO  75           HG3      PRO  75 -33.071   6.376  -6.270
    6    HD2  PRO  75           HD2      PRO  75 -31.095   8.204  -6.203
    7    HD3  PRO  75           HD3      PRO  75 -32.718   8.626  -5.656

  No H/Q in entry =           7
  In of MODEL   28
    1    H    VAL  76           H        VAL  76 -30.861   6.225  -1.033
    2    HA   VAL  76           HA       VAL  76 -28.422   4.984  -2.164
    3    HB   VAL  76           HB       VAL  76 -28.677   6.417   0.516
    4   HG11  VAL  76          HG11      VAL  76 -26.348   5.106  -0.900
    5   HG13  VAL  76          HG12      VAL  76 -27.050   4.646   0.652
    6   HG12  VAL  76          HG13      VAL  76 -26.175   6.169   0.497
    7   HG22  VAL  76          HG21      VAL  76 -27.974   8.318  -0.344
    8   HG21  VAL  76          HG22      VAL  76 -28.534   7.655  -1.881
    9   HG23  VAL  76          HG23      VAL  76 -26.833   7.527  -1.432

  No H/Q in entry =           9
  In of MODEL   28
    1    H    GLU  77           H        GLU  77 -28.246   2.818  -1.584
    2    HA   GLU  77           HA       GLU  77 -29.042   2.007   1.060
    3    HB2  GLU  77           HB2      GLU  77 -30.681   0.398   0.509
    4    HB3  GLU  77           HB3      GLU  77 -31.203   1.942  -0.169
    5    HG2  GLU  77           HG2      GLU  77 -30.612   1.204  -2.370
    6    HG3  GLU  77           HG3      GLU  77 -29.997  -0.314  -1.719

  No H/Q in entry =           6
  In of MODEL   28
    1    H    VAL  78           H        VAL  78 -28.753  -0.095   1.688
    2    HA   VAL  78           HA       VAL  78 -26.103  -0.904   0.783
    3    HB   VAL  78           HB       VAL  78 -27.824  -1.790   3.139
    4   HG11  VAL  78          HG11      VAL  78 -25.510  -3.046   1.991
    5   HG13  VAL  78          HG12      VAL  78 -26.424  -3.521   3.424
    6   HG12  VAL  78          HG13      VAL  78 -25.082  -2.387   3.569
    7   HG22  VAL  78          HG21      VAL  78 -26.336  -0.476   4.494
    8   HG21  VAL  78          HG22      VAL  78 -27.057   0.527   3.235
    9   HG23  VAL  78          HG23      VAL  78 -25.391  -0.030   3.073

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ILE  79           H        ILE  79 -25.604  -2.809  -0.151
    2    HA   ILE  79           HA       ILE  79 -27.695  -4.227  -1.516
    3    HB   ILE  79           HB       ILE  79 -24.714  -4.813  -1.309
    4   HG12  ILE  79          HG12      ILE  79 -26.334  -3.645  -3.578
    5   HG13  ILE  79          HG13      ILE  79 -25.439  -2.669  -2.412
    6   HG22  ILE  79          HG21      ILE  79 -25.842  -5.938  -3.643
    7   HG21  ILE  79          HG22      ILE  79 -26.834  -6.461  -2.281
    8   HG23  ILE  79          HG23      ILE  79 -25.098  -6.772  -2.278
    9   HD13  ILE  79          HD11      ILE  79 -24.031  -2.782  -4.235
   10   HD12  ILE  79          HD12      ILE  79 -24.403  -4.479  -4.540
   11   HD11  ILE  79          HD13      ILE  79 -23.407  -4.030  -3.155

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ASP  80           H        ASP  80 -28.594  -6.143  -0.959
    2    HA   ASP  80           HA       ASP  80 -28.553  -7.082   1.674
    3    HB2  ASP  80           HB2      ASP  80 -30.320  -7.602   0.030
    4    HB3  ASP  80           HB3      ASP  80 -29.183  -8.617  -0.856

  No H/Q in entry =           4
  In of MODEL   28
    1    H    SER  81           H        SER  81 -27.037  -8.262   2.784
    2    HA   SER  81           HA       SER  81 -24.556  -8.973   1.578
    3    HB2  SER  81           HB2      SER  81 -24.021 -10.045   3.731
    4    HB3  SER  81           HB3      SER  81 -24.689  -8.431   3.968
    5    HG   SER  81           HG       SER  81 -26.489  -9.254   4.745

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU  82           H        LEU  82 -27.304 -11.018   1.875
    2    HA   LEU  82           HA       LEU  82 -25.802 -13.407   1.317
    3    HB2  LEU  82           HB2      LEU  82 -28.729 -12.862   0.881
    4    HB3  LEU  82           HB3      LEU  82 -27.951 -14.436   1.033
    5    HG   LEU  82           HG       LEU  82 -28.246 -12.413   3.233
    6   HD11  LEU  82          HD11      LEU  82 -30.347 -13.581   2.421
    7   HD13  LEU  82          HD12      LEU  82 -29.932 -13.863   4.114
    8   HD12  LEU  82          HD13      LEU  82 -29.588 -15.100   2.904
    9   HD23  LEU  82          HD21      LEU  82 -27.502 -14.483   4.550
   10   HD22  LEU  82          HD22      LEU  82 -26.269 -13.650   3.603
   11   HD21  LEU  82          HD23      LEU  82 -26.991 -15.139   2.994

  No H/Q in entry =          11
  In of MODEL   28
    1    H    LEU  83           H        LEU  83 -27.722 -11.117  -0.566
    2    HA   LEU  83           HA       LEU  83 -27.551 -12.444  -3.056
    3    HB2  LEU  83           HB2      LEU  83 -27.905  -9.539  -2.366
    4    HB3  LEU  83           HB3      LEU  83 -27.952 -10.159  -4.016
    5    HG   LEU  83           HG       LEU  83 -29.989 -10.540  -1.841
    6   HD13  LEU  83          HD11      LEU  83 -30.713  -8.663  -2.877
    7   HD12  LEU  83          HD12      LEU  83 -31.198  -9.749  -4.177
    8   HD11  LEU  83          HD13      LEU  83 -29.648  -8.911  -4.260
    9   HD23  LEU  83          HD21      LEU  83 -30.157 -11.755  -4.583
   10   HD22  LEU  83          HD22      LEU  83 -31.130 -12.107  -3.156
   11   HD21  LEU  83          HD23      LEU  83 -29.452 -12.642  -3.232

  No H/Q in entry =          11
  In of MODEL   28
    1    H    TYR  84           H        TYR  84 -25.550 -10.120  -1.351
    2    HA   TYR  84           HA       TYR  84 -23.683  -9.638  -3.478
    3    HB2  TYR  84           HB2      TYR  84 -24.155  -8.152  -1.461
    4    HB3  TYR  84           HB3      TYR  84 -23.203  -9.297  -0.519
    5    HD1  TYR  84           HD1      TYR  84 -20.804  -9.819  -1.517
    6    HD2  TYR  84           HD2      TYR  84 -23.073  -6.302  -2.366
    7    HE1  TYR  84           HE1      TYR  84 -18.730  -8.661  -2.198
    8    HE2  TYR  84           HE2      TYR  84 -21.010  -5.136  -3.059
    9    HH   TYR  84           HH       TYR  84 -17.919  -6.862  -3.245

  No H/Q in entry =           9
  In of MODEL   28
    1    H    GLY  85           H        GLY  85 -23.476 -11.685  -0.560
    2    HA3  GLY  85           HA2      GLY  85 -20.917 -12.670  -1.062
    3    HA2  GLY  85           HA3      GLY  85 -22.162 -13.507  -0.134

  No H/Q in entry =           3
  In of MODEL   28
    1    H    LYS  86           H        LYS  86 -24.019 -13.816  -2.196
    2    HA   LYS  86           HA       LYS  86 -23.013 -16.192  -3.490
    3    HB2  LYS  86           HB2      LYS  86 -25.630 -14.693  -3.549
    4    HB3  LYS  86           HB3      LYS  86 -25.359 -16.232  -4.362
    5    HG2  LYS  86           HG2      LYS  86 -25.041 -17.320  -2.241
    6    HG3  LYS  86           HG3      LYS  86 -25.245 -15.781  -1.405
    7    HD2  LYS  86           HD2      LYS  86 -27.382 -16.794  -1.352
    8    HD3  LYS  86           HD3      LYS  86 -27.474 -15.588  -2.635
    9    HE2  LYS  86           HE2      LYS  86 -27.385 -17.199  -4.320
   10    HE3  LYS  86           HE3      LYS  86 -26.732 -18.428  -3.237
   11    HZ2  LYS  86           HZ1      LYS  86 -29.321 -18.226  -3.903
   12    HZ1  LYS  86           HZ2      LYS  86 -29.299 -17.346  -2.449
   13    HZ3  LYS  86           HZ3      LYS  86 -28.761 -18.956  -2.475

  No H/Q in entry =          13
  In of MODEL   28
    1    H    VAL  87           H        VAL  87 -22.943 -12.965  -4.339
    2    HA   VAL  87           HA       VAL  87 -22.625 -11.771  -6.264
    3    HB   VAL  87           HB       VAL  87 -21.606 -14.288  -7.616
    4   HG11  VAL  87          HG11      VAL  87 -21.781 -11.847  -8.615
    5   HG13  VAL  87          HG12      VAL  87 -20.345 -12.826  -8.918
    6   HG12  VAL  87          HG13      VAL  87 -20.316 -11.580  -7.670
    7   HG23  VAL  87          HG21      VAL  87 -19.412 -13.914  -6.590
    8   HG22  VAL  87          HG22      VAL  87 -20.632 -14.342  -5.393
    9   HG21  VAL  87          HG23      VAL  87 -20.112 -12.666  -5.562

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ASP  88           H        ASP  88 -25.152 -12.370  -5.916
    2    HA   ASP  88           HA       ASP  88 -26.302 -13.533  -8.327
    3    HB2  ASP  88           HB2      ASP  88 -27.296 -13.791  -6.004
    4    HB3  ASP  88           HB3      ASP  88 -27.718 -12.080  -6.079

  No H/Q in entry =           4
  In of MODEL   28
    1    H    GLY  89           H        GLY  89 -25.578 -12.266  -9.953
    2    HA3  GLY  89           HA2      GLY  89 -25.708  -9.487 -10.114
    3    HA2  GLY  89           HA3      GLY  89 -25.708 -10.589 -11.490

  No H/Q in entry =           3
  In of MODEL   28
    1    H    LEU  90           H        LEU  90 -28.178 -11.902 -11.054
    2    HA   LEU  90           HA       LEU  90 -29.956  -9.919 -12.136
    3    HB2  LEU  90           HB2      LEU  90 -30.066 -12.306 -12.749
    4    HB3  LEU  90           HB3      LEU  90 -30.575 -12.685 -11.104
    5    HG   LEU  90           HG       LEU  90 -32.673 -11.525 -11.446
    6   HD13  LEU  90          HD11      LEU  90 -32.466  -9.767 -12.897
    7   HD12  LEU  90          HD12      LEU  90 -33.031 -10.979 -14.050
    8   HD11  LEU  90          HD13      LEU  90 -31.310 -10.618 -13.925
    9   HD23  LEU  90          HD21      LEU  90 -32.640 -13.122 -13.904
   10   HD22  LEU  90          HD22      LEU  90 -33.618 -13.289 -12.446
   11   HD21  LEU  90          HD23      LEU  90 -31.976 -13.931 -12.483

  No H/Q in entry =          11
  In of MODEL   28
    1    H    GLY  91           H        GLY  91 -29.807 -11.467  -8.973
    2    HA3  GLY  91           HA2      GLY  91 -32.123 -10.327  -7.912
    3    HA2  GLY  91           HA3      GLY  91 -30.738 -10.897  -6.981

  No H/Q in entry =           3
  In of MODEL   28
    1    H    VAL  92           H        VAL  92 -28.789  -9.094  -7.818
    2    HA   VAL  92           HA       VAL  92 -29.535  -6.801  -6.235
    3    HB   VAL  92           HB       VAL  92 -27.002  -7.294  -7.845
    4   HG12  VAL  92          HG11      VAL  92 -27.127  -5.438  -5.492
    5   HG11  VAL  92          HG12      VAL  92 -27.785  -4.861  -7.025
    6   HG13  VAL  92          HG13      VAL  92 -26.098  -5.361  -6.924
    7   HG22  VAL  92          HG21      VAL  92 -26.803  -8.907  -6.275
    8   HG21  VAL  92          HG22      VAL  92 -27.930  -8.121  -5.168
    9   HG23  VAL  92          HG23      VAL  92 -26.267  -7.548  -5.285

  No H/Q in entry =           9
  In of MODEL   28
    1    H    LEU  93           H        LEU  93 -29.149  -7.423  -9.665
    2    HA   LEU  93           HA       LEU  93 -29.449  -4.769 -10.558
    3    HB2  LEU  93           HB2      LEU  93 -28.845  -6.615 -12.046
    4    HB3  LEU  93           HB3      LEU  93 -30.449  -7.317 -11.829
    5    HG   LEU  93           HG       LEU  93 -31.427  -5.321 -12.924
    6   HD11  LEU  93          HD11      LEU  93 -29.547  -3.765 -12.404
    7   HD13  LEU  93          HD12      LEU  93 -29.992  -3.765 -14.111
    8   HD12  LEU  93          HD13      LEU  93 -28.554  -4.632 -13.575
    9   HD23  LEU  93          HD21      LEU  93 -30.406  -5.875 -15.222
   10   HD22  LEU  93          HD22      LEU  93 -31.268  -7.129 -14.329
   11   HD21  LEU  93          HD23      LEU  93 -29.503  -7.104 -14.336

  No H/Q in entry =          11
  In of MODEL   28
    1    H    LYS  94           H        LYS  94 -31.867  -7.284  -9.736
    2    HA   LYS  94           HA       LYS  94 -34.188  -5.792 -10.334
    3    HB2  LYS  94           HB2      LYS  94 -33.707  -8.013  -8.354
    4    HB3  LYS  94           HB3      LYS  94 -35.292  -7.286  -8.607
    5    HG2  LYS  94           HG2      LYS  94 -35.227  -8.030 -10.952
    6    HG3  LYS  94           HG3      LYS  94 -33.678  -8.814 -10.640
    7    HD2  LYS  94           HD2      LYS  94 -34.817 -10.152  -8.828
    8    HD3  LYS  94           HD3      LYS  94 -36.350  -9.470  -9.371
    9    HE2  LYS  94           HE2      LYS  94 -35.858 -10.377 -11.651
   10    HE3  LYS  94           HE3      LYS  94 -34.455 -11.194 -10.963
   11    HZ3  LYS  94           HZ1      LYS  94 -36.333 -12.681 -11.147
   12    HZ2  LYS  94           HZ2      LYS  94 -37.285 -11.650 -10.189
   13    HZ1  LYS  94           HZ3      LYS  94 -35.937 -12.432  -9.515

  No H/Q in entry =          13
  In of MODEL   28
    1    H    ALA  95           H        ALA  95 -32.358  -5.986  -7.293
    2    HA   ALA  95           HA       ALA  95 -34.174  -4.395  -5.787
    3    HB2  ALA  95           HB1      ALA  95 -31.822  -5.819  -5.275
    4    HB3  ALA  95           HB2      ALA  95 -32.781  -4.913  -4.107
    5    HB1  ALA  95           HB3      ALA  95 -31.422  -4.138  -4.922

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA  96           H        ALA  96 -31.523  -3.560  -7.881
    2    HA   ALA  96           HA       ALA  96 -31.375  -0.811  -7.068
    3    HB2  ALA  96           HB1      ALA  96 -30.015  -0.580  -9.180
    4    HB3  ALA  96           HB2      ALA  96 -30.351  -2.277  -9.521
    5    HB1  ALA  96           HB3      ALA  96 -29.423  -1.834  -8.088

  No H/Q in entry =           5
  In of MODEL   28
    1    H    VAL  97           H        VAL  97 -32.945  -2.459  -9.774
    2    HA   VAL  97           HA       VAL  97 -33.976  -0.124 -10.994
    3    HB   VAL  97           HB       VAL  97 -34.841  -3.033 -11.074
    4   HG11  VAL  97          HG11      VAL  97 -36.596  -0.987 -11.526
    5   HG13  VAL  97          HG12      VAL  97 -36.687  -2.567 -12.304
    6   HG12  VAL  97          HG13      VAL  97 -35.912  -1.221 -13.136
    7   HG21  VAL  97          HG21      VAL  97 -33.534  -1.201 -13.088
    8   HG23  VAL  97          HG22      VAL  97 -34.018  -2.868 -13.399
    9   HG22  VAL  97          HG23      VAL  97 -32.760  -2.521 -12.212

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ALA  98           H        ALA  98 -35.193  -2.315  -8.484
    2    HA   ALA  98           HA       ALA  98 -37.730  -1.122  -8.109
    3    HB1  ALA  98           HB1      ALA  98 -36.757  -3.355  -7.111
    4    HB3  ALA  98           HB2      ALA  98 -37.916  -2.421  -6.163
    5    HB2  ALA  98           HB3      ALA  98 -36.191  -2.310  -5.807

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA  99           H        ALA  99 -34.631  -0.407  -6.460
    2    HA   ALA  99           HA       ALA  99 -35.716   1.574  -4.767
    3    HB1  ALA  99           HB1      ALA  99 -33.088   0.643  -5.536
    4    HB2  ALA  99           HB2      ALA  99 -33.619   1.383  -4.025
    5    HB3  ALA  99           HB3      ALA  99 -33.126   2.399  -5.378

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ILE 100           H        ILE 100 -34.683   1.732  -8.124
    2    HA   ILE 100           HA       ILE 100 -34.804   4.587  -8.301
    3    HB   ILE 100           HB       ILE 100 -34.950   2.466 -10.471
    4   HG12  ILE 100          HG12      ILE 100 -32.745   4.403  -9.778
    5   HG13  ILE 100          HG13      ILE 100 -32.812   2.749  -9.172
    6   HG21  ILE 100          HG21      ILE 100 -35.314   5.395 -10.558
    7   HG23  ILE 100          HG22      ILE 100 -35.848   4.153 -11.691
    8   HG22  ILE 100          HG23      ILE 100 -34.185   4.736 -11.742
    9   HD12  ILE 100          HD11      ILE 100 -32.269   3.735 -11.934
   10   HD11  ILE 100          HD12      ILE 100 -32.962   2.130 -11.700
   11   HD13  ILE 100          HD13      ILE 100 -31.405   2.531 -10.980

  No H/Q in entry =          11
  In of MODEL   28
    1    H    LYS 101           H        LYS 101 -37.154   2.036  -9.058
    2    HA   LYS 101           HA       LYS 101 -39.204   3.743 -10.026
    3    HB2  LYS 101           HB2      LYS 101 -39.142   0.950  -8.940
    4    HB3  LYS 101           HB3      LYS 101 -40.678   1.748  -9.269
    5    HG2  LYS 101           HG2      LYS 101 -40.209   1.908 -11.566
    6    HG3  LYS 101           HG3      LYS 101 -38.520   1.463 -11.323
    7    HD2  LYS 101           HD2      LYS 101 -39.812  -0.405 -12.232
    8    HD3  LYS 101           HD3      LYS 101 -39.188  -0.772 -10.625
    9    HE2  LYS 101           HE2      LYS 101 -41.263  -1.431 -10.121
   10    HE3  LYS 101           HE3      LYS 101 -41.684   0.281 -10.098
   11    HZ3  LYS 101           HZ1      LYS 101 -42.585   0.174 -12.215
   12    HZ2  LYS 101           HZ2      LYS 101 -43.075  -1.299 -11.527
   13    HZ1  LYS 101           HZ3      LYS 101 -41.770  -1.262 -12.614

  No H/Q in entry =          13
  In of MODEL   28
    1    H    LYS 102           H        LYS 102 -38.733   2.208  -6.842
    2    HA   LYS 102           HA       LYS 102 -40.952   3.431  -5.619
    3    HB2  LYS 102           HB2      LYS 102 -39.751   1.525  -4.635
    4    HB3  LYS 102           HB3      LYS 102 -38.338   2.547  -4.381
    5    HG2  LYS 102           HG2      LYS 102 -39.621   3.946  -2.859
    6    HG3  LYS 102           HG3      LYS 102 -41.037   2.928  -3.116
    7    HD2  LYS 102           HD2      LYS 102 -39.847   1.022  -2.121
    8    HD3  LYS 102           HD3      LYS 102 -38.431   2.042  -1.864
    9    HE2  LYS 102           HE2      LYS 102 -39.751   3.526  -0.428
   10    HE3  LYS 102           HE3      LYS 102 -41.184   2.538  -0.707
   11    HZ1  LYS 102           HZ1      LYS 102 -39.498   0.733   0.264
   12    HZ3  LYS 102           HZ2      LYS 102 -40.587   1.627   1.211
   13    HZ2  LYS 102           HZ3      LYS 102 -38.966   2.120   1.087

  No H/Q in entry =          13
  In of MODEL   28
    1    H    ALA 103           H        ALA 103 -37.972   4.776  -6.620
    2    HA   ALA 103           HA       ALA 103 -38.141   7.068  -4.802
    3    HB2  ALA 103           HB1      ALA 103 -36.140   7.784  -6.373
    4    HB3  ALA 103           HB2      ALA 103 -36.141   6.073  -6.797
    5    HB1  ALA 103           HB3      ALA 103 -35.898   6.566  -5.122

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA 104           H        ALA 104 -38.786   6.400  -8.157
    2    HA   ALA 104           HA       ALA 104 -39.315   9.206  -8.736
    3    HB2  ALA 104           HB1      ALA 104 -39.379   8.572 -10.947
    4    HB1  ALA 104           HB2      ALA 104 -40.137   7.021 -10.591
    5    HB3  ALA 104           HB3      ALA 104 -38.409   7.243 -10.313

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA 105           H        ALA 105 -40.963   7.108  -6.959
    2    HA   ALA 105           HA       ALA 105 -43.357   8.551  -6.903
    3    HB2  ALA 105           HB1      ALA 105 -44.125   7.738  -8.953
    4    HB3  ALA 105           HB2      ALA 105 -44.783   6.546  -7.833
    5    HB1  ALA 105           HB3      ALA 105 -43.324   6.180  -8.751

  No H/Q in entry =           5
  In of MODEL   29
    1    H1   ALA   1           H3       ALA   1 -12.231 -15.764  -2.259
    2    H2   ALA   1           H2       ALA   1 -11.293 -16.902  -3.108
    3    H3   ALA   1           H1       ALA   1 -12.445 -15.960  -3.932
    4    HA   ALA   1           HA       ALA   1 -13.837 -17.664  -3.684
    5    HB3  ALA   1           HB1      ALA   1 -12.434 -19.433  -3.235
    6    HB1  ALA   1           HB2      ALA   1 -13.179 -19.324  -1.640
    7    HB2  ALA   1           HB3      ALA   1 -11.607 -18.579  -1.931

  No H/Q in entry =           7
  In of MODEL   29
    1    H    GLU   2           H        GLU   2 -15.446 -18.525  -2.019
    2    HA   GLU   2           HA       GLU   2 -17.091 -16.811  -0.946
    3    HB2  GLU   2           HB2      GLU   2 -16.134 -19.236   0.588
    4    HB3  GLU   2           HB3      GLU   2 -17.659 -18.390   0.854
    5    HG2  GLU   2           HG2      GLU   2 -18.648 -19.477  -0.874
    6    HG3  GLU   2           HG3      GLU   2 -17.334 -19.071  -1.968

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLU   3           H        GLU   3 -15.157 -18.162   1.661
    2    HA   GLU   3           HA       GLU   3 -15.373 -15.811   3.223
    3    HB2  GLU   3           HB2      GLU   3 -13.779 -18.354   3.459
    4    HB3  GLU   3           HB3      GLU   3 -13.543 -17.036   4.606
    5    HG2  GLU   3           HG2      GLU   3 -15.730 -17.194   5.440
    6    HG3  GLU   3           HG3      GLU   3 -16.333 -17.994   3.994

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LEU   4           H        LEU   4 -12.424 -17.281   1.809
    2    HA   LEU   4           HA       LEU   4 -10.591 -15.373   2.397
    3    HB2  LEU   4           HB2      LEU   4 -10.838 -16.668  -0.328
    4    HB3  LEU   4           HB3      LEU   4  -9.383 -15.945   0.347
    5    HG   LEU   4           HG       LEU   4 -10.862 -18.347   1.467
    6   HD13  LEU   4          HD11      LEU   4  -9.233 -19.697   0.525
    7   HD12  LEU   4          HD12      LEU   4  -8.027 -18.411   0.491
    8   HD11  LEU   4          HD13      LEU   4  -9.324 -18.435  -0.702
    9   HD23  LEU   4          HD21      LEU   4  -8.601 -18.407   2.833
   10   HD22  LEU   4          HD22      LEU   4  -9.921 -17.371   3.373
   11   HD21  LEU   4          HD23      LEU   4  -8.567 -16.678   2.482

  No H/Q in entry =          11
  In of MODEL   29
    1    H    GLU   5           H        GLU   5 -12.945 -15.169  -0.261
    2    HA   GLU   5           HA       GLU   5 -11.955 -12.681  -1.265
    3    HB2  GLU   5           HB2      GLU   5 -13.305 -14.265  -2.622
    4    HB3  GLU   5           HB3      GLU   5 -14.699 -13.916  -1.600
    5    HG2  GLU   5           HG2      GLU   5 -14.583 -11.541  -2.230
    6    HG3  GLU   5           HG3      GLU   5 -13.173 -11.871  -3.237

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLU   6           H        GLU   6 -14.663 -13.569   0.845
    2    HA   GLU   6           HA       GLU   6 -15.571 -10.895   1.255
    3    HB2  GLU   6           HB2      GLU   6 -16.993 -12.886   1.661
    4    HB3  GLU   6           HB3      GLU   6 -15.948 -13.339   3.006
    5    HG2  GLU   6           HG2      GLU   6 -16.475 -11.253   4.164
    6    HG3  GLU   6           HG3      GLU   6 -17.452 -10.716   2.800

  No H/Q in entry =           6
  In of MODEL   29
    1    H    VAL   7           H        VAL   7 -13.248 -13.002   2.807
    2    HA   VAL   7           HA       VAL   7 -12.769 -11.429   5.133
    3    HB   VAL   7           HB       VAL   7 -11.071 -13.467   3.669
    4   HG11  VAL   7          HG11      VAL   7 -10.589 -11.936   6.232
    5   HG13  VAL   7          HG12      VAL   7  -9.497 -12.146   4.863
    6   HG12  VAL   7          HG13      VAL   7  -9.840 -13.505   5.934
    7   HG21  VAL   7          HG21      VAL   7 -13.312 -14.038   4.904
    8   HG23  VAL   7          HG22      VAL   7 -12.375 -13.764   6.373
    9   HG22  VAL   7          HG23      VAL   7 -11.887 -15.021   5.239

  No H/Q in entry =           9
  In of MODEL   29
    1    H    VAL   8           H        VAL   8 -11.280 -11.536   1.912
    2    HA   VAL   8           HA       VAL   8  -9.218  -9.659   2.394
    3    HB   VAL   8           HB       VAL   8 -10.698 -10.348  -0.157
    4   HG11  VAL   8          HG11      VAL   8  -8.388  -8.505   0.420
    5   HG13  VAL   8          HG12      VAL   8  -9.769  -8.255  -0.650
    6   HG12  VAL   8          HG13      VAL   8  -8.474  -9.352  -1.126
    7   HG22  VAL   8          HG21      VAL   8  -9.172 -12.058  -0.425
    8   HG21  VAL   8          HG22      VAL   8  -9.001 -11.924   1.322
    9   HG23  VAL   8          HG23      VAL   8  -7.848 -11.116   0.265

  No H/Q in entry =           9
  In of MODEL   29
    1    H    MET   9           H        MET   9 -12.573  -9.276   1.257
    2    HA   MET   9           HA       MET   9 -12.519  -6.498   0.826
    3    HB2  MET   9           HB2      MET   9 -14.699  -8.419   1.608
    4    HB3  MET   9           HB3      MET   9 -15.019  -6.686   1.521
    5    HG2  MET   9           HG2      MET   9 -13.949  -6.793  -0.824
    6    HG3  MET   9           HG3      MET   9 -14.147  -8.541  -0.693
    7    HE3  MET   9           HE1      MET   9 -17.852  -9.191  -0.482
    8    HE2  MET   9           HE2      MET   9 -16.756  -9.034   0.887
    9    HE1  MET   9           HE3      MET   9 -16.200  -9.813  -0.591

  No H/Q in entry =           9
  In of MODEL   29
    1    H    GLY  10           H        GLY  10 -13.157  -8.395   3.755
    2    HA3  GLY  10           HA2      GLY  10 -13.699  -6.214   5.480
    3    HA2  GLY  10           HA3      GLY  10 -13.127  -7.802   5.988

  No H/Q in entry =           3
  In of MODEL   29
    1    H    LEU  11           H        LEU  11 -10.690  -7.918   4.656
    2    HA   LEU  11           HA       LEU  11  -8.982  -6.482   6.403
    3    HB2  LEU  11           HB2      LEU  11  -8.449  -7.901   3.791
    4    HB3  LEU  11           HB3      LEU  11  -7.174  -7.194   4.781
    5    HG   LEU  11           HG       LEU  11  -9.163  -9.234   5.809
    6   HD13  LEU  11          HD11      LEU  11  -7.949 -10.465   4.235
    7   HD12  LEU  11          HD12      LEU  11  -7.003 -10.703   5.703
    8   HD11  LEU  11          HD13      LEU  11  -6.474  -9.535   4.493
    9   HD22  LEU  11          HD21      LEU  11  -8.300  -8.221   7.721
   10   HD21  LEU  11          HD22      LEU  11  -6.768  -7.814   6.948
   11   HD23  LEU  11          HD23      LEU  11  -7.086  -9.471   7.458

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  12           H        ILE  12  -9.908  -5.933   3.021
    2    HA   ILE  12           HA       ILE  12  -8.226  -3.697   2.585
    3    HB   ILE  12           HB       ILE  12 -10.887  -4.373   1.307
    4   HG12  ILE  12          HG12      ILE  12  -8.847  -6.020   1.218
    5   HG13  ILE  12          HG13      ILE  12  -9.721  -5.667  -0.257
    6   HG23  ILE  12          HG21      ILE  12 -10.326  -2.050   0.864
    7   HG22  ILE  12          HG22      ILE  12  -9.971  -2.973  -0.591
    8   HG21  ILE  12          HG23      ILE  12  -8.689  -2.492   0.482
    9   HD11  ILE  12          HD11      ILE  12  -7.203  -4.231   0.624
   10   HD13  ILE  12          HD12      ILE  12  -8.009  -4.103  -0.938
   11   HD12  ILE  12          HD13      ILE  12  -7.217  -5.592  -0.480

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  13           H        ILE  13 -11.579  -3.977   3.701
    2    HA   ILE  13           HA       ILE  13 -12.047  -1.192   3.977
    3    HB   ILE  13           HB       ILE  13 -13.233  -3.615   5.351
    4   HG12  ILE  13          HG12      ILE  13 -13.479  -3.125   2.821
    5   HG13  ILE  13          HG13      ILE  13 -14.917  -3.520   3.738
    6   HG23  ILE  13          HG21      ILE  13 -13.604  -1.785   6.864
    7   HG22  ILE  13          HG22      ILE  13 -15.116  -2.036   6.002
    8   HG21  ILE  13          HG23      ILE  13 -14.057  -0.701   5.552
    9   HD11  ILE  13          HD11      ILE  13 -14.216  -0.636   3.614
   10   HD13  ILE  13          HD12      ILE  13 -15.779  -1.429   3.559
   11   HD12  ILE  13          HD13      ILE  13 -14.788  -1.383   2.118

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ASN  14           H        ASN  14 -10.911  -3.681   6.241
    2    HA   ASN  14           HA       ASN  14 -10.701  -2.045   8.528
    3    HB2  ASN  14           HB2      ASN  14 -10.440  -4.651   8.201
    4    HB3  ASN  14           HB3      ASN  14  -8.734  -4.257   8.033
    5   HD21  ASN  14          HD21      ASN  14  -9.350  -5.786  10.211
    6   HD22  ASN  14          HD22      ASN  14  -9.316  -4.868  11.636

  No H/Q in entry =           6
  In of MODEL   29
    1    H    SER  15           H        SER  15  -8.313  -2.856   6.019
    2    HA   SER  15           HA       SER  15  -6.168  -1.355   7.078
    3    HB2  SER  15           HB2      SER  15  -5.161  -1.564   4.913
    4    HB3  SER  15           HB3      SER  15  -6.109  -3.028   5.142
    5    HG   SER  15           HG       SER  15  -6.527  -0.862   3.452

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLY  16           H        GLY  16  -8.788  -0.497   4.850
    2    HA3  GLY  16           HA2      GLY  16  -7.946   2.148   4.295
    3    HA2  GLY  16           HA3      GLY  16  -9.595   1.546   4.144

  No H/Q in entry =           3
  In of MODEL   29
    1    H    GLN  17           H        GLN  17 -10.117   0.815   6.796
    2    HA   GLN  17           HA       GLN  17 -10.829   3.315   7.944
    3    HB2  GLN  17           HB2      GLN  17 -10.707   0.532   9.121
    4    HB3  GLN  17           HB3      GLN  17 -11.336   1.929   9.997
    5    HG2  GLN  17           HG2      GLN  17 -12.368   0.980   7.308
    6    HG3  GLN  17           HG3      GLN  17 -13.130   0.618   8.856
    7   HE21  GLN  17          HE21      GLN  17 -13.536   2.622   6.305
    8   HE22  GLN  17          HE22      GLN  17 -14.152   3.995   7.092

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ALA  18           H        ALA  18  -8.184   1.046   8.544
    2    HA   ALA  18           HA       ALA  18  -7.078   2.266  10.808
    3    HB2  ALA  18           HB1      ALA  18  -6.466   0.054   9.435
    4    HB3  ALA  18           HB2      ALA  18  -5.300   0.842  10.498
    5    HB1  ALA  18           HB3      ALA  18  -5.236   1.123   8.757

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ARG  19           H        ARG  19  -6.332   2.797   7.355
    2    HA   ARG  19           HA       ARG  19  -4.442   4.854   7.774
    3    HB2  ARG  19           HB2      ARG  19  -4.778   3.714   5.579
    4    HB3  ARG  19           HB3      ARG  19  -6.326   4.546   5.413
    5    HG2  ARG  19           HG2      ARG  19  -5.209   6.724   5.476
    6    HG3  ARG  19           HG3      ARG  19  -3.654   5.947   5.770
    7    HD2  ARG  19           HD2      ARG  19  -3.797   6.539   3.428
    8    HD3  ARG  19           HD3      ARG  19  -3.872   4.778   3.572
    9    HE   ARG  19           HE       ARG  19  -6.510   5.672   3.583
   10   HH21  ARG  19          HH11      ARG  19  -7.719   5.823   1.673
   11   HH22  ARG  19          HH12      ARG  19  -6.908   5.907   0.148
   12   HH11  ARG  19          HH21      ARG  19  -3.749   5.753   1.531
   13   HH12  ARG  19          HH22      ARG  19  -4.658   5.865   0.068

  No H/Q in entry =          13
  In of MODEL   29
    1    H    SER  20           H        SER  20  -7.945   4.949   7.196
    2    HA   SER  20           HA       SER  20  -8.319   7.703   7.153
    3    HB2  SER  20           HB2      SER  20 -10.189   6.345   6.627
    4    HB3  SER  20           HB3      SER  20 -10.070   5.460   8.147
    5    HG   SER  20           HG       SER  20 -10.568   8.247   7.965

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU  21           H        LEU  21  -8.288   5.518   9.955
    2    HA   LEU  21           HA       LEU  21  -8.728   7.509  11.925
    3    HB2  LEU  21           HB2      LEU  21  -7.358   4.816  12.073
    4    HB3  LEU  21           HB3      LEU  21  -7.664   5.830  13.480
    5    HG   LEU  21           HG       LEU  21  -9.840   4.919  11.574
    6   HD12  LEU  21          HD11      LEU  21 -10.382   3.436  13.671
    7   HD11  LEU  21          HD12      LEU  21  -8.669   3.649  14.032
    8   HD13  LEU  21          HD13      LEU  21  -9.164   2.894  12.516
    9   HD22  LEU  21          HD21      LEU  21 -10.772   6.716  12.731
   10   HD21  LEU  21          HD22      LEU  21  -9.773   6.467  14.160
   11   HD23  LEU  21          HD23      LEU  21 -11.145   5.413  13.856

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ALA  22           H        ALA  22  -5.776   6.156  10.497
    2    HA   ALA  22           HA       ALA  22  -3.894   7.480  12.108
    3    HB2  ALA  22           HB1      ALA  22  -3.477   5.630  10.413
    4    HB1  ALA  22           HB2      ALA  22  -2.289   6.934  10.441
    5    HB3  ALA  22           HB3      ALA  22  -3.515   6.884   9.173

  No H/Q in entry =           5
  In of MODEL   29
    1    H    TYR  23           H        TYR  23  -5.238   8.491   8.935
    2    HA   TYR  23           HA       TYR  23  -3.919  10.996   8.859
    3    HB2  TYR  23           HB2      TYR  23  -5.005  10.080   6.872
    4    HB3  TYR  23           HB3      TYR  23  -6.580  10.173   7.664
    5    HD1  TYR  23           HD1      TYR  23  -3.689  12.258   6.545
    6    HD2  TYR  23           HD2      TYR  23  -7.848  12.157   7.609
    7    HE1  TYR  23           HE1      TYR  23  -3.938  14.608   5.790
    8    HE2  TYR  23           HE2      TYR  23  -8.098  14.506   6.854
    9    HH   TYR  23           HH       TYR  23  -5.791  16.086   4.976

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ALA  24           H        ALA  24  -7.023   9.997  10.257
    2    HA   ALA  24           HA       ALA  24  -7.872  12.580  11.035
    3    HB1  ALA  24           HB1      ALA  24  -9.679  11.317  11.513
    4    HB2  ALA  24           HB2      ALA  24  -8.841  10.750  12.955
    5    HB3  ALA  24           HB3      ALA  24  -8.719   9.840  11.450

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA  25           H        ALA  25  -5.844  10.134  12.595
    2    HA   ALA  25           HA       ALA  25  -5.499  11.387  15.096
    3    HB2  ALA  25           HB1      ALA  25  -4.722   9.041  14.268
    4    HB3  ALA  25           HB2      ALA  25  -3.705   9.905  15.423
    5    HB1  ALA  25           HB3      ALA  25  -3.279   9.892  13.711

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU  26           H        LEU  26  -3.729  11.700  12.045
    2    HA   LEU  26           HA       LEU  26  -1.777  13.532  12.950
    3    HB2  LEU  26           HB2      LEU  26  -1.481  12.384  10.843
    4    HB3  LEU  26           HB3      LEU  26  -2.963  13.083  10.198
    5    HG   LEU  26           HG       LEU  26  -1.962  15.340  10.330
    6   HD12  LEU  26          HD11      LEU  26   0.579  15.376  10.728
    7   HD11  LEU  26          HD12      LEU  26   0.370  13.793  11.472
    8   HD13  LEU  26          HD13      LEU  26  -0.442  15.202  12.155
    9   HD21  LEU  26          HD21      LEU  26  -0.214  13.298   8.922
   10   HD23  LEU  26          HD22      LEU  26  -0.271  15.019   8.554
   11   HD22  LEU  26          HD23      LEU  26  -1.689  14.013   8.273

  No H/Q in entry =          11
  In of MODEL   29
    1    H    LYS  27           H        LYS  27  -4.971  13.996  11.493
    2    HA   LYS  27           HA       LYS  27  -4.935  16.785  11.297
    3    HB2  LYS  27           HB2      LYS  27  -6.675  15.297  10.321
    4    HB3  LYS  27           HB3      LYS  27  -7.321  15.035  11.941
    5    HG2  LYS  27           HG2      LYS  27  -7.764  17.438  12.181
    6    HG3  LYS  27           HG3      LYS  27  -7.067  17.741  10.586
    7    HD2  LYS  27           HD2      LYS  27  -8.797  16.297   9.560
    8    HD3  LYS  27           HD3      LYS  27  -9.499  16.011  11.154
    9    HE2  LYS  27           HE2      LYS  27  -9.956  18.420  11.402
   10    HE3  LYS  27           HE3      LYS  27  -9.225  18.727   9.822
   11    HZ3  LYS  27           HZ1      LYS  27 -11.603  18.588   9.595
   12    HZ2  LYS  27           HZ2      LYS  27 -11.637  17.070  10.364
   13    HZ1  LYS  27           HZ3      LYS  27 -10.903  17.240   8.838

  No H/Q in entry =          13
  In of MODEL   29
    1    H    GLN  28           H        GLN  28  -5.794  14.691  14.028
    2    HA   GLN  28           HA       GLN  28  -6.690  16.688  15.811
    3    HB2  GLN  28           HB2      GLN  28  -5.275  14.061  16.336
    4    HB3  GLN  28           HB3      GLN  28  -5.999  15.062  17.595
    5    HG2  GLN  28           HG2      GLN  28  -7.494  13.947  15.205
    6    HG3  GLN  28           HG3      GLN  28  -7.527  13.252  16.824
    7   HE21  GLN  28          HE21      GLN  28  -9.439  15.046  14.897
    8   HE22  GLN  28          HE22      GLN  28 -10.168  16.066  16.041

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ALA  29           H        ALA  29  -3.468  15.410  15.100
    2    HA   ALA  29           HA       ALA  29  -2.025  16.813  17.071
    3    HB1  ALA  29           HB1      ALA  29  -0.098  16.133  15.939
    4    HB3  ALA  29           HB2      ALA  29  -0.863  16.255  14.355
    5    HB2  ALA  29           HB3      ALA  29  -1.271  14.919  15.431

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LYS  30           H        LYS  30  -2.908  17.692  13.748
    2    HA   LYS  30           HA       LYS  30  -1.508  20.137  13.640
    3    HB2  LYS  30           HB2      LYS  30  -4.045  19.255  12.247
    4    HB3  LYS  30           HB3      LYS  30  -3.219  20.773  11.899
    5    HG2  LYS  30           HG2      LYS  30  -1.148  19.488  11.371
    6    HG3  LYS  30           HG3      LYS  30  -2.047  17.989  11.621
    7    HD2  LYS  30           HD2      LYS  30  -3.625  18.625   9.837
    8    HD3  LYS  30           HD3      LYS  30  -2.749  20.137   9.590
    9    HE2  LYS  30           HE2      LYS  30  -0.716  18.851   8.996
   10    HE3  LYS  30           HE3      LYS  30  -1.612  17.345   9.212
   11    HZ2  LYS  30           HZ1      LYS  30  -1.453  18.219   6.870
   12    HZ1  LYS  30           HZ2      LYS  30  -2.498  19.478   7.346
   13    HZ3  LYS  30           HZ3      LYS  30  -3.017  17.859   7.419

  No H/Q in entry =          13
  In of MODEL   29
    1    H    GLN  31           H        GLN  31  -4.597  19.275  15.072
    2    HA   GLN  31           HA       GLN  31  -5.364  22.029  15.532
    3    HB2  GLN  31           HB2      GLN  31  -6.529  19.578  16.860
    4    HB3  GLN  31           HB3      GLN  31  -7.294  21.148  16.621
    5    HG2  GLN  31           HG2      GLN  31  -6.599  20.376  14.026
    6    HG3  GLN  31           HG3      GLN  31  -7.115  18.869  14.774
    7   HE21  GLN  31          HE21      GLN  31  -8.543  20.442  12.684
    8   HE22  GLN  31          HE22      GLN  31 -10.053  20.830  13.352

  No H/Q in entry =           8
  In of MODEL   29
    1    H    GLY  32           H        GLY  32  -3.039  20.105  16.835
    2    HA3  GLY  32           HA2      GLY  32  -1.628  20.568  18.628
    3    HA2  GLY  32           HA3      GLY  32  -2.756  21.808  19.161

  No H/Q in entry =           3
  In of MODEL   29
    1    H    ASP  33           H        ASP  33  -4.177  18.767  18.504
    2    HA   ASP  33           HA       ASP  33  -4.567  18.304  21.387
    3    HB2  ASP  33           HB2      ASP  33  -5.988  17.294  18.917
    4    HB3  ASP  33           HB3      ASP  33  -6.322  16.680  20.535

  No H/Q in entry =           4
  In of MODEL   29
    1    H    PHE  34           H        PHE  34  -2.395  17.457  21.676
    2    HA   PHE  34           HA       PHE  34  -1.400  15.212  20.266
    3    HB2  PHE  34           HB2      PHE  34  -0.766  16.194  23.057
    4    HB3  PHE  34           HB3      PHE  34   0.159  14.973  22.182
    5    HD1  PHE  34           HD1      PHE  34  -0.015  18.398  22.923
    6    HD2  PHE  34           HD2      PHE  34   0.799  15.701  19.679
    7    HE1  PHE  34           HE1      PHE  34   1.270  20.173  21.762
    8    HE2  PHE  34           HE2      PHE  34   2.078  17.479  18.523
    9    HZ   PHE  34           HZ       PHE  34   2.316  19.712  19.570

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ALA  35           H        ALA  35  -3.421  15.481  23.143
    2    HA   ALA  35           HA       ALA  35  -3.198  12.818  24.034
    3    HB3  ALA  35           HB1      ALA  35  -5.652  13.439  24.909
    4    HB1  ALA  35           HB2      ALA  35  -5.124  15.059  24.452
    5    HB2  ALA  35           HB3      ALA  35  -4.200  14.135  25.635

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA  36           H        ALA  36  -5.665  14.334  21.953
    2    HA   ALA  36           HA       ALA  36  -7.080  11.921  21.481
    3    HB1  ALA  36           HB1      ALA  36  -8.544  13.342  20.537
    4    HB3  ALA  36           HB2      ALA  36  -7.381  13.766  19.281
    5    HB2  ALA  36           HB3      ALA  36  -7.397  14.652  20.806

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA  37           H        ALA  37  -4.413  13.515  19.797
    2    HA   ALA  37           HA       ALA  37  -4.391  11.883  17.497
    3    HB3  ALA  37           HB1      ALA  37  -2.392  13.596  18.909
    4    HB2  ALA  37           HB2      ALA  37  -2.934  13.654  17.233
    5    HB1  ALA  37           HB3      ALA  37  -1.775  12.425  17.744

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LYS  38           H        LYS  38  -2.613  11.575  20.563
    2    HA   LYS  38           HA       LYS  38  -1.286   9.178  20.061
    3    HB2  LYS  38           HB2      LYS  38  -1.598  10.937  22.211
    4    HB3  LYS  38           HB3      LYS  38  -2.210   9.406  22.830
    5    HG2  LYS  38           HG2      LYS  38  -0.118   8.290  22.277
    6    HG3  LYS  38           HG3      LYS  38   0.483   9.737  21.462
    7    HD2  LYS  38           HD2      LYS  38   0.664  10.953  23.497
    8    HD3  LYS  38           HD3      LYS  38  -0.347   9.799  24.370
    9    HE2  LYS  38           HE2      LYS  38   2.013   9.487  24.972
   10    HE3  LYS  38           HE3      LYS  38   1.405   8.071  24.110
   11    HZ3  LYS  38           HZ1      LYS  38   2.692   8.495  22.321
   12    HZ2  LYS  38           HZ2      LYS  38   3.654   9.323  23.452
   13    HZ1  LYS  38           HZ3      LYS  38   2.566  10.182  22.469

  No H/Q in entry =          13
  In of MODEL   29
    1    H    ALA  39           H        ALA  39  -4.516   9.666  21.486
    2    HA   ALA  39           HA       ALA  39  -5.068   6.944  21.990
    3    HB3  ALA  39           HB1      ALA  39  -7.236   8.886  21.241
    4    HB2  ALA  39           HB2      ALA  39  -6.328   9.113  22.736
    5    HB1  ALA  39           HB3      ALA  39  -7.244   7.627  22.477

  No H/Q in entry =           5
  In of MODEL   29
    1    H    MET  40           H        MET  40  -5.676   8.961  19.151
    2    HA   MET  40           HA       MET  40  -7.159   7.028  17.698
    3    HB2  MET  40           HB2      MET  40  -5.559   9.428  16.786
    4    HB3  MET  40           HB3      MET  40  -6.591   8.469  15.721
    5    HG2  MET  40           HG2      MET  40  -7.611   9.712  18.288
    6    HG3  MET  40           HG3      MET  40  -7.680  10.549  16.739
    7    HE3  MET  40           HE1      MET  40 -10.274   8.928  14.690
    8    HE2  MET  40           HE2      MET  40  -8.523   9.048  14.530
    9    HE1  MET  40           HE3      MET  40  -9.439  10.411  15.172

  No H/Q in entry =           9
  In of MODEL   29
    1    H    MET  41           H        MET  41  -3.668   7.773  17.798
    2    HA   MET  41           HA       MET  41  -2.920   6.023  15.690
    3    HB2  MET  41           HB2      MET  41  -1.289   6.689  18.153
    4    HB3  MET  41           HB3      MET  41  -0.680   6.045  16.632
    5    HG2  MET  41           HG2      MET  41  -1.848   8.227  15.639
    6    HG3  MET  41           HG3      MET  41  -1.602   8.812  17.283
    7    HE2  MET  41           HE1      MET  41   1.323   6.720  17.621
    8    HE1  MET  41           HE2      MET  41   0.537   8.011  18.527
    9    HE3  MET  41           HE3      MET  41   2.156   8.259  17.874

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ASP  42           H        ASP  42  -3.281   5.543  19.177
    2    HA   ASP  42           HA       ASP  42  -2.238   2.952  19.326
    3    HB2  ASP  42           HB2      ASP  42  -3.104   4.706  21.157
    4    HB3  ASP  42           HB3      ASP  42  -4.529   3.678  21.093

  No H/Q in entry =           4
  In of MODEL   29
    1    H    GLN  43           H        GLN  43  -5.577   4.048  18.850
    2    HA   GLN  43           HA       GLN  43  -6.715   1.458  18.659
    3    HB2  GLN  43           HB2      GLN  43  -7.653   4.110  17.540
    4    HB3  GLN  43           HB3      GLN  43  -8.612   2.628  17.522
    5    HG2  GLN  43           HG2      GLN  43  -8.302   2.504  20.027
    6    HG3  GLN  43           HG3      GLN  43  -7.582   4.111  19.954
    7   HE21  GLN  43          HE21      GLN  43  -9.751   4.183  21.469
    8   HE22  GLN  43          HE22      GLN  43 -11.119   4.756  20.647

  No H/Q in entry =           8
  In of MODEL   29
    1    H    SER  44           H        SER  44  -5.397   3.680  16.242
    2    HA   SER  44           HA       SER  44  -6.109   2.197  13.955
    3    HB2  SER  44           HB2      SER  44  -4.856   4.583  14.394
    4    HB3  SER  44           HB3      SER  44  -3.503   3.592  13.853
    5    HG   SER  44           HG       SER  44  -4.629   4.564  12.099

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ARG  45           H        ARG  45  -3.218   2.088  16.016
    2    HA   ARG  45           HA       ARG  45  -1.742   0.140  14.621
    3    HB2  ARG  45           HB2      ARG  45  -0.891   1.560  16.486
    4    HB3  ARG  45           HB3      ARG  45  -1.873   0.625  17.612
    5    HG2  ARG  45           HG2      ARG  45  -0.641  -1.429  16.958
    6    HG3  ARG  45           HG3      ARG  45   0.366  -0.469  15.874
    7    HD2  ARG  45           HD2      ARG  45   1.109   0.910  17.827
    8    HD3  ARG  45           HD3      ARG  45   0.197  -0.169  18.905
    9    HE   ARG  45           HE       ARG  45   1.890  -1.758  17.311
   10   HH21  ARG  45          HH11      ARG  45   3.797  -2.577  18.134
   11   HH22  ARG  45          HH12      ARG  45   4.577  -1.792  19.462
   12   HH11  ARG  45          HH21      ARG  45   2.202   0.705  19.703
   13   HH12  ARG  45          HH22      ARG  45   3.673   0.069  20.348

  No H/Q in entry =          13
  In of MODEL   29
    1    H    MET  46           H        MET  46  -4.122  -0.191  17.236
    2    HA   MET  46           HA       MET  46  -3.945  -2.990  17.537
    3    HB2  MET  46           HB2      MET  46  -6.117  -0.991  18.154
    4    HB3  MET  46           HB3      MET  46  -6.314  -2.712  18.494
    5    HG2  MET  46           HG2      MET  46  -4.322  -2.700  19.905
    6    HG3  MET  46           HG3      MET  46  -4.010  -1.019  19.503
    7    HE3  MET  46           HE1      MET  46  -7.695  -2.716  20.564
    8    HE2  MET  46           HE2      MET  46  -7.107  -2.896  22.214
    9    HE1  MET  46           HE3      MET  46  -6.203  -3.609  20.882

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ALA  47           H        ALA  47  -5.983  -0.974  15.459
    2    HA   ALA  47           HA       ALA  47  -7.603  -3.026  14.400
    3    HB3  ALA  47           HB1      ALA  47  -8.290  -0.790  13.992
    4    HB1  ALA  47           HB2      ALA  47  -7.810  -1.419  12.416
    5    HB2  ALA  47           HB3      ALA  47  -6.726  -0.350  13.308

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU  48           H        LEU  48  -4.494  -1.710  13.331
    2    HA   LEU  48           HA       LEU  48  -4.225  -3.296  10.985
    3    HB2  LEU  48           HB2      LEU  48  -2.158  -2.017  12.783
    4    HB3  LEU  48           HB3      LEU  48  -1.798  -2.734  11.212
    5    HG   LEU  48           HG       LEU  48  -3.822  -0.520  11.619
    6   HD13  LEU  48          HD11      LEU  48  -1.698   0.357  12.273
    7   HD12  LEU  48          HD12      LEU  48  -1.984   0.914  10.624
    8   HD11  LEU  48          HD13      LEU  48  -0.882  -0.432  10.923
    9   HD22  LEU  48          HD21      LEU  48  -4.305  -1.502   9.544
   10   HD21  LEU  48          HD22      LEU  48  -2.624  -1.934   9.237
   11   HD23  LEU  48          HD23      LEU  48  -3.146  -0.255   9.085

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ASN  49           H        ASN  49  -3.158  -3.697  14.324
    2    HA   ASN  49           HA       ASN  49  -1.555  -5.958  13.979
    3    HB2  ASN  49           HB2      ASN  49  -1.555  -4.641  16.030
    4    HB3  ASN  49           HB3      ASN  49  -3.221  -5.094  16.360
    5   HD21  ASN  49          HD21      ASN  49   0.036  -6.524  15.956
    6   HD22  ASN  49          HD22      ASN  49  -0.244  -7.835  16.996

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLU  50           H        GLU  50  -5.020  -5.687  14.673
    2    HA   GLU  50           HA       GLU  50  -5.530  -8.487  14.779
    3    HB2  GLU  50           HB2      GLU  50  -7.111  -6.802  15.669
    4    HB3  GLU  50           HB3      GLU  50  -7.415  -6.235  14.025
    5    HG2  GLU  50           HG2      GLU  50  -8.283  -8.430  13.388
    6    HG3  GLU  50           HG3      GLU  50  -7.891  -9.077  14.978

  No H/Q in entry =           6
  In of MODEL   29
    1    H    ALA  51           H        ALA  51  -5.615  -6.084  12.189
    2    HA   ALA  51           HA       ALA  51  -6.612  -7.808  10.169
    3    HB2  ALA  51           HB1      ALA  51  -6.401  -5.992   8.802
    4    HB1  ALA  51           HB2      ALA  51  -4.758  -5.644   9.341
    5    HB3  ALA  51           HB3      ALA  51  -6.136  -5.135  10.319

  No H/Q in entry =           5
  In of MODEL   29
    1    H    HIS  52           H        HIS  52  -3.315  -6.903  11.135
    2    HA   HIS  52           HA       HIS  52  -1.928  -8.388   9.174
    3    HB2  HIS  52           HB2      HIS  52  -0.858  -6.670  10.576
    4    HB3  HIS  52           HB3      HIS  52  -1.069  -7.695  11.994
    5    HD1  HIS  52           HD1      HIS  52   0.198 -10.082  11.885
    6    HD2  HIS  52           HD2      HIS  52   1.422  -7.243   9.088
    7    HE1  HIS  52           HE1      HIS  52   2.434 -10.871  10.996
    8    HE2  HIS  52           HE2      HIS  52   3.194  -9.151   9.289

  No H/Q in entry =           8
  In of MODEL   29
    1    H    LEU  53           H        LEU  53  -3.121  -9.272  12.392
    2    HA   LEU  53           HA       LEU  53  -1.924 -11.817  12.573
    3    HB2  LEU  53           HB2      LEU  53  -4.399 -10.635  13.805
    4    HB3  LEU  53           HB3      LEU  53  -3.942 -12.313  14.090
    5    HG   LEU  53           HG       LEU  53  -2.025 -10.007  14.555
    6   HD11  LEU  53          HD11      LEU  53  -3.953 -11.336  16.480
    7   HD13  LEU  53          HD12      LEU  53  -3.931  -9.638  16.007
    8   HD12  LEU  53          HD13      LEU  53  -2.620 -10.299  16.977
    9   HD21  LEU  53          HD21      LEU  53  -2.090 -12.939  15.299
   10   HD23  LEU  53          HD22      LEU  53  -1.132 -11.793  16.228
   11   HD22  LEU  53          HD23      LEU  53  -0.784 -12.046  14.528

  No H/Q in entry =          11
  In of MODEL   29
    1    H    VAL  54           H        VAL  54  -5.042 -10.782  11.232
    2    HA   VAL  54           HA       VAL  54  -5.963 -13.374  10.545
    3    HB   VAL  54           HB       VAL  54  -6.614 -10.638   9.420
    4   HG12  VAL  54          HG11      VAL  54  -8.722 -12.012   8.618
    5   HG11  VAL  54          HG12      VAL  54  -7.611 -13.380   8.681
    6   HG13  VAL  54          HG13      VAL  54  -7.256 -12.003   7.639
    7   HG22  VAL  54          HG21      VAL  54  -7.507 -10.680  11.577
    8   HG21  VAL  54          HG22      VAL  54  -7.764 -12.423  11.555
    9   HG23  VAL  54          HG23      VAL  54  -8.849 -11.363  10.658

  No H/Q in entry =           9
  In of MODEL   29
    1    H    GLN  55           H        GLN  55  -4.099 -10.921   8.749
    2    HA   GLN  55           HA       GLN  55  -3.985 -12.381   6.328
    3    HB2  GLN  55           HB2      GLN  55  -3.380 -10.117   6.139
    4    HB3  GLN  55           HB3      GLN  55  -2.261 -10.197   7.497
    5    HG2  GLN  55           HG2      GLN  55  -0.552 -11.043   6.209
    6    HG3  GLN  55           HG3      GLN  55  -1.633 -12.015   5.220
    7   HE21  GLN  55          HE21      GLN  55  -1.662 -11.320   3.100
    8   HE22  GLN  55          HE22      GLN  55  -1.465  -9.715   2.592

  No H/Q in entry =           8
  In of MODEL   29
    1    H    THR  56           H        THR  56  -1.862 -12.369   9.196
    2    HA   THR  56           HA       THR  56   0.208 -13.969   8.263
    3    HB   THR  56           HB       THR  56  -1.074 -13.991  11.009
    4    HG1  THR  56           HG1      THR  56   0.008 -12.049   9.918
    5   HG21  THR  56          HG21      THR  56   1.412 -15.253   9.891
    6   HG23  THR  56          HG22      THR  56   0.226 -15.931  11.007
    7   HG22  THR  56          HG23      THR  56   1.379 -14.721  11.570

  No H/Q in entry =           7
  In of MODEL   29
    1    H    LYS  57           H        LYS  57  -2.905 -15.003   9.643
    2    HA   LYS  57           HA       LYS  57  -2.465 -17.799   9.389
    3    HB2  LYS  57           HB2      LYS  57  -4.274 -16.710  10.748
    4    HB3  LYS  57           HB3      LYS  57  -5.073 -16.252   9.252
    5    HG2  LYS  57           HG2      LYS  57  -5.312 -18.618   8.633
    6    HG3  LYS  57           HG3      LYS  57  -4.484 -19.099  10.112
    7    HD2  LYS  57           HD2      LYS  57  -6.282 -18.040  11.453
    8    HD3  LYS  57           HD3      LYS  57  -7.122 -17.599   9.967
    9    HE2  LYS  57           HE2      LYS  57  -7.340 -19.979   9.364
   10    HE3  LYS  57           HE3      LYS  57  -6.460 -20.451  10.815
   11    HZ1  LYS  57           HZ1      LYS  57  -8.986 -18.895  10.837
   12    HZ3  LYS  57           HZ2      LYS  57  -8.176 -19.559  12.176
   13    HZ2  LYS  57           HZ3      LYS  57  -8.902 -20.580  11.028

  No H/Q in entry =          13
  In of MODEL   29
    1    H    LEU  58           H        LEU  58  -3.805 -15.350   7.226
    2    HA   LEU  58           HA       LEU  58  -4.623 -17.169   5.221
    3    HB2  LEU  58           HB2      LEU  58  -4.012 -14.222   5.088
    4    HB3  LEU  58           HB3      LEU  58  -4.685 -15.155   3.750
    5    HG   LEU  58           HG       LEU  58  -5.948 -14.978   6.505
    6   HD11  LEU  58          HD11      LEU  58  -6.260 -13.326   4.019
    7   HD13  LEU  58          HD12      LEU  58  -6.239 -12.821   5.709
    8   HD12  LEU  58          HD13      LEU  58  -7.667 -13.611   5.044
    9   HD22  LEU  58          HD21      LEU  58  -6.919 -16.884   5.638
   10   HD21  LEU  58          HD22      LEU  58  -6.589 -16.429   3.966
   11   HD23  LEU  58          HD23      LEU  58  -7.946 -15.702   4.826

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  59           H        ILE  59  -1.480 -15.966   6.066
    2    HA   ILE  59           HA       ILE  59  -0.399 -16.691   3.421
    3    HB   ILE  59           HB       ILE  59   0.382 -14.631   4.997
    4   HG12  ILE  59          HG12      ILE  59   2.453 -16.276   3.527
    5   HG13  ILE  59          HG13      ILE  59   1.253 -15.320   2.696
    6   HG22  ILE  59          HG21      ILE  59   2.475 -16.685   5.658
    7   HG21  ILE  59          HG22      ILE  59   1.131 -16.419   6.747
    8   HG23  ILE  59          HG23      ILE  59   2.242 -15.104   6.367
    9   HD12  ILE  59          HD11      ILE  59   3.279 -14.286   4.677
   10   HD11  ILE  59          HD12      ILE  59   2.020 -13.302   3.935
   11   HD13  ILE  59          HD13      ILE  59   3.293 -14.006   2.937

  No H/Q in entry =          11
  In of MODEL   29
    1    H    GLU  60           H        GLU  60  -0.393 -17.803   6.787
    2    HA   GLU  60           HA       GLU  60   1.633 -19.785   6.507
    3    HB2  GLU  60           HB2      GLU  60   0.915 -19.029   8.706
    4    HB3  GLU  60           HB3      GLU  60  -0.719 -19.619   8.410
    5    HG2  GLU  60           HG2      GLU  60   1.640 -21.491   8.245
    6    HG3  GLU  60           HG3      GLU  60   0.897 -21.114   9.799

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLY  61           H        GLY  61  -1.881 -19.875   6.041
    2    HA3  GLY  61           HA2      GLY  61  -1.644 -22.666   5.076
    3    HA2  GLY  61           HA3      GLY  61  -3.124 -21.928   5.679

  No H/Q in entry =           3
  In of MODEL   29
    1    H    ASP  62           H        ASP  62  -0.905 -20.348   3.468
    2    HA   ASP  62           HA       ASP  62  -2.965 -19.701   1.625
    3    HB2  ASP  62           HB2      ASP  62  -0.838 -18.403   2.066
    4    HB3  ASP  62           HB3      ASP  62   0.016 -19.629   1.137

  No H/Q in entry =           4
  In of MODEL   29
    1    H    ALA  63           H        ALA  63  -1.480 -22.658   2.076
    2    HA   ALA  63           HA       ALA  63  -0.822 -23.611  -0.467
    3    HB1  ALA  63           HB1      ALA  63  -2.201 -25.102   1.765
    4    HB2  ALA  63           HB2      ALA  63  -0.461 -24.909   1.562
    5    HB3  ALA  63           HB3      ALA  63  -1.386 -25.840   0.384

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLY  64           H        GLY  64  -3.978 -23.569   1.176
    2    HA3  GLY  64           HA2      GLY  64  -6.125 -23.813   0.404
    3    HA2  GLY  64           HA3      GLY  64  -5.563 -22.937  -1.009

  No H/Q in entry =           3
  In of MODEL   29
    1    H    GLU  65           H        GLU  65  -5.992 -23.981  -2.867
    2    HA   GLU  65           HA       GLU  65  -7.021 -26.511  -3.098
    3    HB2  GLU  65           HB2      GLU  65  -5.386 -24.951  -5.094
    4    HB3  GLU  65           HB3      GLU  65  -6.250 -26.436  -5.488
    5    HG2  GLU  65           HG2      GLU  65  -8.367 -25.427  -4.798
    6    HG3  GLU  65           HG3      GLU  65  -7.531 -23.957  -4.306

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLY  66           H        GLY  66  -5.959 -28.194  -4.607
    2    HA3  GLY  66           HA2      GLY  66  -4.066 -29.649  -3.121
    3    HA2  GLY  66           HA3      GLY  66  -4.621 -30.027  -4.740

  No H/Q in entry =           3
  In of MODEL   29
    1    H    LYS  67           H        LYS  67  -3.712 -27.678  -6.013
    2    HA   LYS  67           HA       LYS  67  -0.991 -28.430  -6.485
    3    HB2  LYS  67           HB2      LYS  67  -2.774 -26.315  -7.679
    4    HB3  LYS  67           HB3      LYS  67  -1.122 -26.629  -8.229
    5    HG2  LYS  67           HG2      LYS  67  -1.703 -28.995  -8.634
    6    HG3  LYS  67           HG3      LYS  67  -3.354 -28.682  -8.099
    7    HD2  LYS  67           HD2      LYS  67  -3.649 -27.072  -9.945
    8    HD3  LYS  67           HD3      LYS  67  -1.997 -27.385 -10.481
    9    HE2  LYS  67           HE2      LYS  67  -2.549 -29.760 -10.836
   10    HE3  LYS  67           HE3      LYS  67  -4.199 -29.461 -10.288
   11    HZ3  LYS  67           HZ1      LYS  67  -4.761 -28.568 -12.237
   12    HZ2  LYS  67           HZ2      LYS  67  -3.360 -29.310 -12.847
   13    HZ1  LYS  67           HZ3      LYS  67  -3.323 -27.680 -12.371

  No H/Q in entry =          13
  In of MODEL   29
    1    H    MET  68           H        MET  68   0.844 -27.214  -6.415
    2    HA   MET  68           HA       MET  68   1.463 -25.894  -4.080
    3    HB2  MET  68           HB2      MET  68   2.769 -25.793  -6.794
    4    HB3  MET  68           HB3      MET  68   3.488 -25.082  -5.349
    5    HG2  MET  68           HG2      MET  68   3.450 -27.258  -4.226
    6    HG3  MET  68           HG3      MET  68   2.660 -27.988  -5.625
    7    HE2  MET  68           HE1      MET  68   6.932 -26.552  -5.083
    8    HE1  MET  68           HE2      MET  68   5.502 -26.246  -4.099
    9    HE3  MET  68           HE3      MET  68   5.774 -25.303  -5.563

  No H/Q in entry =           9
  In of MODEL   29
    1    H    LYS  69           H        LYS  69  -0.593 -24.612  -6.311
    2    HA   LYS  69           HA       LYS  69   0.310 -21.953  -6.552
    3    HB2  LYS  69           HB2      LYS  69  -2.426 -23.142  -6.886
    4    HB3  LYS  69           HB3      LYS  69  -2.055 -21.444  -7.211
    5    HG2  LYS  69           HG2      LYS  69  -0.298 -22.120  -8.796
    6    HG3  LYS  69           HG3      LYS  69  -0.653 -23.818  -8.473
    7    HD2  LYS  69           HD2      LYS  69  -2.946 -23.507  -9.319
    8    HD3  LYS  69           HD3      LYS  69  -2.600 -21.805  -9.636
    9    HE2  LYS  69           HE2      LYS  69  -0.812 -22.451 -11.205
   10    HE3  LYS  69           HE3      LYS  69  -1.142 -24.153 -10.884
   11    HZ2  LYS  69           HZ1      LYS  69  -2.730 -22.199 -12.378
   12    HZ1  LYS  69           HZ2      LYS  69  -3.551 -23.429 -11.543
   13    HZ3  LYS  69           HZ3      LYS  69  -2.407 -23.826 -12.733

  No H/Q in entry =          13
  In of MODEL   29
    1    H    VAL  70           H        VAL  70  -0.659 -19.979  -5.755
    2    HA   VAL  70           HA       VAL  70  -1.584 -20.202  -2.942
    3    HB   VAL  70           HB       VAL  70  -0.472 -17.977  -2.619
    4   HG12  VAL  70          HG11      VAL  70   1.875 -18.892  -2.709
    5   HG11  VAL  70          HG12      VAL  70   1.231 -20.296  -3.561
    6   HG13  VAL  70          HG13      VAL  70   0.716 -19.956  -1.909
    7   HG23  VAL  70          HG21      VAL  70   0.834 -18.505  -5.314
    8   HG22  VAL  70          HG22      VAL  70   1.004 -17.075  -4.297
    9   HG21  VAL  70          HG23      VAL  70  -0.526 -17.398  -5.109

  No H/Q in entry =           9
  In of MODEL   29
    1    H    SER  71           H        SER  71  -2.970 -18.480  -2.219
    2    HA   SER  71           HA       SER  71  -5.074 -17.836  -4.035
    3    HB2  SER  71           HB2      SER  71  -5.348 -18.107  -1.535
    4    HB3  SER  71           HB3      SER  71  -4.501 -16.578  -1.330
    5    HG   SER  71           HG       SER  71  -6.856 -16.969  -2.871

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU  72           H        LEU  72  -5.221 -16.209  -5.396
    2    HA   LEU  72           HA       LEU  72  -3.114 -14.399  -5.888
    3    HB2  LEU  72           HB2      LEU  72  -5.984 -14.449  -6.814
    4    HB3  LEU  72           HB3      LEU  72  -4.793 -13.289  -7.394
    5    HG   LEU  72           HG       LEU  72  -4.377 -16.293  -7.536
    6   HD13  LEU  72          HD11      LEU  72  -5.000 -16.092  -9.918
    7   HD12  LEU  72          HD12      LEU  72  -5.393 -14.390  -9.671
    8   HD11  LEU  72          HD13      LEU  72  -6.347 -15.640  -8.872
    9   HD23  LEU  72          HD21      LEU  72  -2.839 -15.415  -9.467
   10   HD22  LEU  72          HD22      LEU  72  -2.257 -15.268  -7.817
   11   HD21  LEU  72          HD23      LEU  72  -2.948 -13.869  -8.633

  No H/Q in entry =          11
  In of MODEL   29
    1    H    VAL  73           H        VAL  73  -6.195 -14.043  -4.236
    2    HA   VAL  73           HA       VAL  73  -6.236 -11.272  -3.878
    3    HB   VAL  73           HB       VAL  73  -7.938 -11.635  -2.277
    4   HG11  VAL  73          HG11      VAL  73  -8.349 -12.415  -4.657
    5   HG13  VAL  73          HG12      VAL  73  -9.401 -13.135  -3.441
    6   HG12  VAL  73          HG13      VAL  73  -8.044 -14.057  -4.089
    7   HG22  VAL  73          HG21      VAL  73  -7.109 -13.085  -0.658
    8   HG21  VAL  73          HG22      VAL  73  -6.489 -14.225  -1.852
    9   HG23  VAL  73          HG23      VAL  73  -8.219 -14.157  -1.512

  No H/Q in entry =           9
  In of MODEL   29
    1    H    LEU  74           H        LEU  74  -4.289 -13.646  -2.313
    2    HA   LEU  74           HA       LEU  74  -3.859 -12.512   0.209
    3    HB2  LEU  74           HB2      LEU  74  -3.084 -14.733  -0.314
    4    HB3  LEU  74           HB3      LEU  74  -2.025 -14.108  -1.577
    5    HG   LEU  74           HG       LEU  74  -0.782 -12.817   0.174
    6   HD11  LEU  74          HD11      LEU  74  -2.784 -14.248   1.921
    7   HD13  LEU  74          HD12      LEU  74  -2.315 -12.547   1.953
    8   HD12  LEU  74          HD13      LEU  74  -1.205 -13.779   2.554
    9   HD23  LEU  74          HD21      LEU  74  -0.861 -15.690   0.989
   10   HD22  LEU  74          HD22      LEU  74   0.508 -14.633   0.726
   11   HD21  LEU  74          HD23      LEU  74  -0.369 -15.265  -0.649

  No H/Q in entry =          11
  In of MODEL   29
    1    H    VAL  75           H        VAL  75  -1.989 -12.113  -2.760
    2    HA   VAL  75           HA       VAL  75  -0.183 -10.193  -1.757
    3    HB   VAL  75           HB       VAL  75  -1.158 -10.669  -4.574
    4   HG13  VAL  75          HG11      VAL  75  -0.294  -8.370  -4.377
    5   HG12  VAL  75          HG12      VAL  75   0.895  -9.368  -5.199
    6   HG11  VAL  75          HG13      VAL  75   1.119  -8.956  -3.506
    7   HG21  VAL  75          HG21      VAL  75   0.070 -12.528  -3.432
    8   HG23  VAL  75          HG22      VAL  75   1.411 -11.421  -3.136
    9   HG22  VAL  75          HG23      VAL  75   0.977 -11.858  -4.790

  No H/Q in entry =           9
  In of MODEL   29
    1    H    GLU  76           H        GLU  76  -3.344  -9.838  -3.392
    2    HA   GLU  76           HA       GLU  76  -3.394  -7.023  -3.485
    3    HB2  GLU  76           HB2      GLU  76  -5.062  -8.456  -4.640
    4    HB3  GLU  76           HB3      GLU  76  -5.704  -8.961  -3.085
    5    HG2  GLU  76           HG2      GLU  76  -7.166  -7.246  -3.938
    6    HG3  GLU  76           HG3      GLU  76  -6.268  -6.532  -2.613

  No H/Q in entry =           6
  In of MODEL   29
    1    H    ALA  77           H        ALA  77  -4.489  -9.257  -0.944
    2    HA   ALA  77           HA       ALA  77  -5.431  -7.259   0.827
    3    HB1  ALA  77           HB1      ALA  77  -4.237  -9.840   1.798
    4    HB2  ALA  77           HB2      ALA  77  -5.752  -9.842   0.895
    5    HB3  ALA  77           HB3      ALA  77  -5.635  -8.961   2.417

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLN  78           H        GLN  78  -2.288  -8.811   0.436
    2    HA   GLN  78           HA       GLN  78  -1.013  -7.658   2.681
    3    HB2  GLN  78           HB2      GLN  78  -0.162  -9.596   1.319
    4    HB3  GLN  78           HB3      GLN  78   0.262  -8.450   0.048
    5    HG2  GLN  78           HG2      GLN  78   1.738  -7.256   1.613
    6    HG3  GLN  78           HG3      GLN  78   1.316  -8.393   2.889
    7   HE21  GLN  78          HE21      GLN  78   4.031  -8.105   1.989
    8   HE22  GLN  78          HE22      GLN  78   4.485  -9.546   1.215

  No H/Q in entry =           8
  In of MODEL   29
    1    H    LEU  79           H        LEU  79  -1.402  -6.588  -0.661
    2    HA   LEU  79           HA       LEU  79   0.288  -4.363  -0.653
    3    HB2  LEU  79           HB2      LEU  79  -0.755  -5.163  -2.702
    4    HB3  LEU  79           HB3      LEU  79  -2.353  -4.770  -2.081
    5    HG   LEU  79           HG       LEU  79  -1.805  -2.384  -2.053
    6   HD13  LEU  79          HD11      LEU  79   0.440  -2.146  -1.556
    7   HD12  LEU  79          HD12      LEU  79   0.477  -1.854  -3.294
    8   HD11  LEU  79          HD13      LEU  79   0.933  -3.434  -2.655
    9   HD23  LEU  79          HD21      LEU  79  -1.188  -2.180  -4.609
   10   HD22  LEU  79          HD22      LEU  79  -2.712  -2.926  -4.141
   11   HD21  LEU  79          HD23      LEU  79  -1.345  -3.936  -4.598

  No H/Q in entry =          11
  In of MODEL   29
    1    H    HIS  80           H        HIS  80  -3.173  -4.521   0.197
    2    HA   HIS  80           HA       HIS  80  -3.354  -1.766   0.869
    3    HB2  HIS  80           HB2      HIS  80  -5.058  -4.172   1.193
    4    HB3  HIS  80           HB3      HIS  80  -5.368  -2.835   2.303
    5    HD1  HIS  80           HD1      HIS  80  -6.989  -1.192   1.411
    6    HD2  HIS  80           HD2      HIS  80  -4.821  -3.001  -1.656
    7    HE1  HIS  80           HE1      HIS  80  -7.842  -0.187  -0.759
    8    HE2  HIS  80           HE2      HIS  80  -6.527  -1.284  -2.638

  No H/Q in entry =           8
  In of MODEL   29
    1    H    LEU  81           H        LEU  81  -2.858  -4.668   2.851
    2    HA   LEU  81           HA       LEU  81  -2.825  -3.327   5.339
    3    HB2  LEU  81           HB2      LEU  81  -1.619  -5.944   4.444
    4    HB3  LEU  81           HB3      LEU  81  -1.579  -5.390   6.119
    5    HG   LEU  81           HG       LEU  81  -4.137  -5.632   4.508
    6   HD12  LEU  81          HD11      LEU  81  -4.434  -7.701   6.052
    7   HD11  LEU  81          HD12      LEU  81  -2.681  -7.635   6.226
    8   HD13  LEU  81          HD13      LEU  81  -3.401  -7.859   4.631
    9   HD23  LEU  81          HD21      LEU  81  -4.963  -5.839   7.014
   10   HD22  LEU  81          HD22      LEU  81  -4.639  -4.249   6.326
   11   HD21  LEU  81          HD23      LEU  81  -3.447  -5.016   7.376

  No H/Q in entry =          11
  In of MODEL   29
    1    H    MET  82           H        MET  82  -0.161  -4.232   3.147
    2    HA   MET  82           HA       MET  82   1.936  -3.348   4.818
    3    HB2  MET  82           HB2      MET  82   1.699  -3.681   1.826
    4    HB3  MET  82           HB3      MET  82   3.188  -3.116   2.581
    5    HG2  MET  82           HG2      MET  82   1.779  -5.703   3.308
    6    HG3  MET  82           HG3      MET  82   3.143  -5.595   2.199
    7    HE3  MET  82           HE1      MET  82   6.174  -4.873   4.163
    8    HE2  MET  82           HE2      MET  82   5.251  -3.501   3.555
    9    HE1  MET  82           HE3      MET  82   5.329  -4.989   2.615

  No H/Q in entry =           9
  In of MODEL   29
    1    H    THR  83           H        THR  83   0.101  -1.694   2.278
    2    HA   THR  83           HA       THR  83   1.521   0.750   2.361
    3    HB   THR  83           HB       THR  83  -0.660   1.684   1.393
    4    HG1  THR  83           HG1      THR  83  -2.315   0.393   1.295
    5   HG22  THR  83          HG21      THR  83  -0.409  -0.129  -0.614
    6   HG21  THR  83          HG22      THR  83   1.097  -0.428   0.251
    7   HG23  THR  83          HG23      THR  83   0.736   1.187  -0.357

  No H/Q in entry =           7
  In of MODEL   29
    1    H    SER  84           H        SER  84  -1.477  -0.277   3.981
    2    HA   SER  84           HA       SER  84  -1.956   2.151   5.335
    3    HB2  SER  84           HB2      SER  84  -2.794  -0.685   5.899
    4    HB3  SER  84           HB3      SER  84  -3.275   0.655   6.939
    5    HG   SER  84           HG       SER  84  -3.755   0.349   4.149

  No H/Q in entry =           5
  In of MODEL   29
    1    H    MET  85           H        MET  85  -0.247  -0.789   6.445
    2    HA   MET  85           HA       MET  85   0.294   0.129   9.048
    3    HB2  MET  85           HB2      MET  85   0.573  -2.214   8.364
    4    HB3  MET  85           HB3      MET  85   1.948  -1.753   7.359
    5    HG2  MET  85           HG2      MET  85   3.151  -0.939   9.343
    6    HG3  MET  85           HG3      MET  85   1.765  -1.335  10.358
    7    HE2  MET  85           HE1      MET  85   4.769  -4.048   8.310
    8    HE1  MET  85           HE2      MET  85   4.334  -2.380   7.944
    9    HE3  MET  85           HE3      MET  85   3.350  -3.699   7.316

  No H/Q in entry =           9
  In of MODEL   29
    1    H    LEU  86           H        LEU  86   2.208   0.385   6.084
    2    HA   LEU  86           HA       LEU  86   4.435   1.685   7.226
    3    HB2  LEU  86           HB2      LEU  86   4.223   0.609   4.916
    4    HB3  LEU  86           HB3      LEU  86   3.417   2.095   4.413
    5    HG   LEU  86           HG       LEU  86   5.457   3.331   5.382
    6   HD11  LEU  86          HD11      LEU  86   6.158   0.715   6.170
    7   HD13  LEU  86          HD12      LEU  86   7.168   2.156   6.264
    8   HD12  LEU  86          HD13      LEU  86   7.263   1.111   4.849
    9   HD23  LEU  86          HD21      LEU  86   6.150   1.571   3.022
   10   HD22  LEU  86          HD22      LEU  86   6.552   3.266   3.285
   11   HD21  LEU  86          HD23      LEU  86   4.894   2.805   2.898

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ALA  87           H        ALA  87   1.516   2.943   5.666
    2    HA   ALA  87           HA       ALA  87   2.121   5.671   5.752
    3    HB1  ALA  87           HB1      ALA  87  -0.198   4.053   5.224
    4    HB3  ALA  87           HB2      ALA  87   0.115   5.714   4.725
    5    HB2  ALA  87           HB3      ALA  87  -0.668   5.391   6.274

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ARG  88           H        ARG  88   0.441   3.670   8.149
    2    HA   ARG  88           HA       ARG  88  -0.049   5.717  10.005
    3    HB2  ARG  88           HB2      ARG  88  -0.996   3.368  10.072
    4    HB3  ARG  88           HB3      ARG  88   0.548   2.860  10.766
    5    HG2  ARG  88           HG2      ARG  88   0.091   4.933  12.394
    6    HG3  ARG  88           HG3      ARG  88  -1.580   4.615  11.949
    7    HD2  ARG  88           HD2      ARG  88  -1.685   2.763  13.192
    8    HD3  ARG  88           HD3      ARG  88  -0.102   2.177  12.649
    9    HE   ARG  88           HE       ARG  88  -0.613   3.436  15.109
   10   HH21  ARG  88          HH11      ARG  88   0.958   4.440  16.339
   11   HH22  ARG  88          HH12      ARG  88   2.473   4.863  15.624
   12   HH11  ARG  88          HH21      ARG  88   1.649   3.615  12.516
   13   HH12  ARG  88          HH22      ARG  88   2.873   4.380  13.471

  No H/Q in entry =          13
  In of MODEL   29
    1    H    GLU  89           H        GLU  89   2.737   3.488   9.756
    2    HA   GLU  89           HA       GLU  89   4.019   4.368  12.093
    3    HB2  GLU  89           HB2      GLU  89   4.661   2.350  10.740
    4    HB3  GLU  89           HB3      GLU  89   5.432   3.444   9.590
    5    HG2  GLU  89           HG2      GLU  89   6.933   4.282  11.325
    6    HG3  GLU  89           HG3      GLU  89   6.104   3.326  12.549

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LEU  90           H        LEU  90   4.316   5.532   8.765
    2    HA   LEU  90           HA       LEU  90   6.257   7.525   9.341
    3    HB2  LEU  90           HB2      LEU  90   4.234   7.204   7.127
    4    HB3  LEU  90           HB3      LEU  90   5.468   8.471   7.143
    5    HG   LEU  90           HG       LEU  90   6.135   5.532   7.465
    6   HD12  LEU  90          HD11      LEU  90   6.867   5.768   5.021
    7   HD11  LEU  90          HD12      LEU  90   5.856   7.212   4.983
    8   HD13  LEU  90          HD13      LEU  90   5.133   5.641   5.327
    9   HD22  LEU  90          HD21      LEU  90   8.041   6.674   8.136
   10   HD21  LEU  90          HD22      LEU  90   7.688   8.082   7.135
   11   HD23  LEU  90          HD23      LEU  90   8.338   6.617   6.400

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  91           H        ILE  91   2.717   7.551   9.218
    2    HA   ILE  91           HA       ILE  91   2.385  10.323   9.677
    3    HB   ILE  91           HB       ILE  91   0.592   7.951  10.227
    4   HG12  ILE  91          HG12      ILE  91   0.336  10.238   8.249
    5   HG13  ILE  91          HG13      ILE  91   1.189   8.742   7.868
    6   HG22  ILE  91          HG21      ILE  91  -1.135  10.014  10.307
    7   HG21  ILE  91          HG22      ILE  91   0.274  10.839  10.972
    8   HG23  ILE  91          HG23      ILE  91  -0.361   9.402  11.770
    9   HD13  ILE  91          HD11      ILE  91  -0.758   7.459   7.923
   10   HD12  ILE  91          HD12      ILE  91  -1.349   8.977   7.249
   11   HD11  ILE  91          HD13      ILE  91  -1.608   8.610   8.955

  No H/Q in entry =          11
  In of MODEL   29
    1    H    THR  92           H        THR  92   2.798   7.576  11.869
    2    HA   THR  92           HA       THR  92   2.375   8.946  14.299
    3    HB   THR  92           HB       THR  92   4.173   6.608  13.617
    4    HG1  THR  92           HG1      THR  92   2.202   5.856  13.528
    5   HG22  THR  92          HG21      THR  92   3.808   6.320  16.253
    6   HG21  THR  92          HG22      THR  92   3.746   8.079  16.183
    7   HG23  THR  92          HG23      THR  92   5.173   7.222  15.599

  No H/Q in entry =           7
  In of MODEL   29
    1    H    GLU  93           H        GLU  93   5.311   8.495  12.344
    2    HA   GLU  93           HA       GLU  93   7.079   9.915  14.031
    3    HB2  GLU  93           HB2      GLU  93   7.146   9.606  11.015
    4    HB3  GLU  93           HB3      GLU  93   8.495  10.132  12.021
    5    HG2  GLU  93           HG2      GLU  93   7.083   7.497  12.473
    6    HG3  GLU  93           HG3      GLU  93   8.460   7.648  11.388

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LEU  94           H        LEU  94   5.014  10.939  11.335
    2    HA   LEU  94           HA       LEU  94   5.822  13.641  11.234
    3    HB2  LEU  94           HB2      LEU  94   3.225  12.282  10.496
    4    HB3  LEU  94           HB3      LEU  94   3.484  14.009  10.256
    5    HG   LEU  94           HG       LEU  94   5.491  12.020   9.188
    6   HD11  LEU  94          HD11      LEU  94   2.743  12.577   8.145
    7   HD13  LEU  94          HD12      LEU  94   3.723  11.119   8.010
    8   HD12  LEU  94          HD13      LEU  94   4.053  12.501   6.966
    9   HD23  LEU  94          HD21      LEU  94   5.732  13.859   7.467
   10   HD22  LEU  94          HD22      LEU  94   6.159  14.349   9.107
   11   HD21  LEU  94          HD23      LEU  94   4.604  14.820   8.420

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  95           H        ILE  95   3.295  12.024  13.140
    2    HA   ILE  95           HA       ILE  95   2.263  14.373  14.346
    3    HB   ILE  95           HB       ILE  95   2.284  11.490  15.265
    4   HG12  ILE  95          HG12      ILE  95   0.058  13.267  14.234
    5   HG13  ILE  95          HG13      ILE  95   1.006  12.209  13.194
    6   HG21  ILE  95          HG21      ILE  95   1.012  13.961  16.480
    7   HG23  ILE  95          HG22      ILE  95   2.065  12.790  17.275
    8   HG22  ILE  95          HG23      ILE  95   0.426  12.331  16.811
    9   HD13  ILE  95          HD11      ILE  95   0.108  10.270  14.116
   10   HD12  ILE  95          HD12      ILE  95  -1.273  11.360  14.203
   11   HD11  ILE  95          HD13      ILE  95  -0.298  11.058  15.641

  No H/Q in entry =          11
  In of MODEL   29
    1    H    GLU  96           H        GLU  96   4.863  12.150  15.320
    2    HA   GLU  96           HA       GLU  96   5.436  13.344  17.810
    3    HB2  GLU  96           HB2      GLU  96   6.378  11.186  17.153
    4    HB3  GLU  96           HB3      GLU  96   7.303  11.961  15.868
    5    HG2  GLU  96           HG2      GLU  96   8.962  12.506  17.320
    6    HG3  GLU  96           HG3      GLU  96   7.823  13.317  18.384

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LEU  97           H        LEU  97   6.489  14.121  14.519
    2    HA   LEU  97           HA       LEU  97   8.380  16.116  15.222
    3    HB2  LEU  97           HB2      LEU  97   6.772  15.572  12.736
    4    HB3  LEU  97           HB3      LEU  97   7.793  17.002  12.854
    5    HG   LEU  97           HG       LEU  97   8.825  14.204  13.402
    6   HD12  LEU  97          HD11      LEU  97   9.806  14.402  11.078
    7   HD11  LEU  97          HD12      LEU  97   8.753  15.793  10.824
    8   HD13  LEU  97          HD13      LEU  97   8.056  14.200  11.121
    9   HD23  LEU  97          HD21      LEU  97  10.989  15.483  12.646
   10   HD22  LEU  97          HD22      LEU  97  10.381  15.750  14.280
   11   HD21  LEU  97          HD23      LEU  97  10.059  16.936  13.016

  No H/Q in entry =          11
  In of MODEL   29
    1    H    HIS  98           H        HIS  98   4.885  16.253  14.591
    2    HA   HIS  98           HA       HIS  98   4.586  19.052  14.733
    3    HB2  HIS  98           HB2      HIS  98   2.701  16.800  15.467
    4    HB3  HIS  98           HB3      HIS  98   2.235  18.500  15.529
    5    HD1  HIS  98           HD1      HIS  98   3.240  15.790  13.113
    6    HD2  HIS  98           HD2      HIS  98   1.863  19.723  13.007
    7    HE1  HIS  98           HE1      HIS  98   2.665  16.283  10.693
    8    HE2  HIS  98           HE2      HIS  98   1.829  18.672  10.608

  No H/Q in entry =           8
  In of MODEL   29
    1    H    GLU  99           H        GLU  99   4.736  16.559  17.226
    2    HA   GLU  99           HA       GLU  99   4.143  18.249  19.431
    3    HB2  GLU  99           HB2      GLU  99   4.055  15.767  19.525
    4    HB3  GLU  99           HB3      GLU  99   5.814  15.723  19.405
    5    HG2  GLU  99           HG2      GLU  99   6.016  17.011  21.480
    6    HG3  GLU  99           HG3      GLU  99   4.264  17.152  21.587

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LYS 100           H        LYS 100   7.186  17.322  17.845
    2    HA   LYS 100           HA       LYS 100   8.853  18.720  19.693
    3    HB2  LYS 100           HB2      LYS 100   9.333  17.800  16.849
    4    HB3  LYS 100           HB3      LYS 100  10.570  18.568  17.850
    5    HG2  LYS 100           HG2      LYS 100  10.205  16.814  19.591
    6    HG3  LYS 100           HG3      LYS 100   9.066  16.013  18.506
    7    HD2  LYS 100           HD2      LYS 100  10.849  15.733  16.826
    8    HD3  LYS 100           HD3      LYS 100  11.993  16.547  17.896
    9    HE2  LYS 100           HE2      LYS 100  11.608  14.788  19.614
   10    HE3  LYS 100           HE3      LYS 100  10.526  13.954  18.494
   11    HZ1  LYS 100           HZ1      LYS 100  13.342  14.626  17.821
   12    HZ3  LYS 100           HZ2      LYS 100  12.293  13.572  16.998
   13    HZ2  LYS 100           HZ3      LYS 100  12.891  13.150  18.532

  No H/Q in entry =          13
  In of MODEL   29
    1    H    LEU 101           H        LEU 101   7.140  19.651  16.750
    2    HA   LEU 101           HA       LEU 101   8.351  22.209  16.412
    3    HB2  LEU 101           HB2      LEU 101   5.750  20.977  15.540
    4    HB3  LEU 101           HB3      LEU 101   6.000  22.709  15.334
    5    HG   LEU 101           HG       LEU 101   8.029  20.694  14.351
    6   HD12  LEU 101          HD11      LEU 101   6.861  21.204  12.075
    7   HD11  LEU 101          HD12      LEU 101   5.468  21.632  13.066
    8   HD13  LEU 101          HD13      LEU 101   6.133  20.002  13.140
    9   HD21  LEU 101          HD21      LEU 101   7.398  23.607  13.805
   10   HD23  LEU 101          HD22      LEU 101   8.371  22.649  12.690
   11   HD22  LEU 101          HD23      LEU 101   8.924  22.904  14.345

  No H/Q in entry =          11
  In of MODEL   29
    1    H    LYS 102           H        LYS 102   6.832  21.066  19.036
    2    HA   LYS 102           HA       LYS 102   6.213  22.154  20.974
    3    HB2  LYS 102           HB2      LYS 102   7.488  24.147  19.845
    4    HB3  LYS 102           HB3      LYS 102   5.887  24.752  19.481
    5    HG2  LYS 102           HG2      LYS 102   7.281  24.491  22.123
    6    HG3  LYS 102           HG3      LYS 102   6.325  25.821  21.503
    7    HD2  LYS 102           HD2      LYS 102   5.086  23.183  22.385
    8    HD3  LYS 102           HD3      LYS 102   5.342  24.542  23.470
    9    HE2  LYS 102           HE2      LYS 102   3.053  24.143  21.996
   10    HE3  LYS 102           HE3      LYS 102   3.561  25.687  22.677
   11    HZ2  LYS 102           HZ1      LYS 102   3.015  25.799  20.301
   12    HZ1  LYS 102           HZ2      LYS 102   4.274  24.718  19.968
   13    HZ3  LYS 102           HZ3      LYS 102   4.621  26.247  20.611

  No H/Q in entry =          13
  In of MODEL   29
    1    H    ALA 103           H        ALA 103   4.556  23.703  18.221
    2    HA   ALA 103           HA       ALA 103   2.108  24.278  19.123
    3    HB1  ALA 103           HB1      ALA 103   1.195  23.441  16.886
    4    HB2  ALA 103           HB2      ALA 103   2.840  22.905  16.544
    5    HB3  ALA 103           HB3      ALA 103   2.507  24.616  16.816

  No H/Q in entry =           5
  In of MODEL   29
    1    H1   ALA   1           H3       ALA   1  10.521 -20.174  -6.297
    2    H2   ALA   1           H2       ALA   1   9.547 -20.377  -7.676
    3    H3   ALA   1           H1       ALA   1   9.119 -21.126  -6.212
    4    HA   ALA   1           HA       ALA   1  10.152 -22.934  -6.962
    5    HB1  ALA   1           HB1      ALA   1  10.232 -22.570  -9.238
    6    HB2  ALA   1           HB2      ALA   1  11.962 -22.422  -8.920
    7    HB3  ALA   1           HB3      ALA   1  10.964 -20.974  -9.061

  No H/Q in entry =           7
  In of MODEL   29
    1    H    GLU   2           H        GLU   2  12.435 -23.886  -7.038
    2    HA   GLU   2           HA       GLU   2  13.831 -23.811  -4.836
    3    HB2  GLU   2           HB2      GLU   2  15.169 -23.675  -7.544
    4    HB3  GLU   2           HB3      GLU   2  15.907 -24.290  -6.065
    5    HG2  GLU   2           HG2      GLU   2  14.886 -26.305  -6.303
    6    HG3  GLU   2           HG3      GLU   2  13.314 -25.557  -6.549

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLU   3           H        GLU   3  15.588 -21.943  -7.246
    2    HA   GLU   3           HA       GLU   3  16.757 -20.261  -5.291
    3    HB2  GLU   3           HB2      GLU   3  16.680 -20.253  -8.300
    4    HB3  GLU   3           HB3      GLU   3  17.433 -18.927  -7.415
    5    HG2  GLU   3           HG2      GLU   3  19.101 -20.305  -6.507
    6    HG3  GLU   3           HG3      GLU   3  18.151 -21.770  -6.725

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LEU   4           H        LEU   4  14.457 -19.405  -7.903
    2    HA   LEU   4           HA       LEU   4  13.998 -16.797  -7.283
    3    HB2  LEU   4           HB2      LEU   4  11.816 -18.768  -8.002
    4    HB3  LEU   4           HB3      LEU   4  11.741 -17.018  -8.197
    5    HG   LEU   4           HG       LEU   4  13.694 -18.881  -9.587
    6   HD13  LEU   4          HD11      LEU   4  12.379 -18.727 -11.488
    7   HD12  LEU   4          HD12      LEU   4  11.676 -17.182 -11.012
    8   HD11  LEU   4          HD13      LEU   4  11.126 -18.673 -10.250
    9   HD23  LEU   4          HD21      LEU   4  14.024 -16.633 -10.937
   10   HD22  LEU   4          HD22      LEU   4  14.894 -16.880  -9.424
   11   HD21  LEU   4          HD23      LEU   4  13.442 -15.882  -9.450

  No H/Q in entry =          11
  In of MODEL   29
    1    H    GLU   5           H        GLU   5  12.522 -19.583  -5.636
    2    HA   GLU   5           HA       GLU   5  10.858 -18.013  -3.918
    3    HB2  GLU   5           HB2      GLU   5  10.432 -20.392  -4.445
    4    HB3  GLU   5           HB3      GLU   5  11.867 -20.829  -3.514
    5    HG2  GLU   5           HG2      GLU   5  10.901 -19.802  -1.506
    6    HG3  GLU   5           HG3      GLU   5   9.479 -19.316  -2.427

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLU   6           H        GLU   6  14.006 -19.597  -3.501
    2    HA   GLU   6           HA       GLU   6  14.379 -18.747  -0.804
    3    HB2  GLU   6           HB2      GLU   6  15.596 -20.660  -1.806
    4    HB3  GLU   6           HB3      GLU   6  16.451 -19.539  -2.867
    5    HG2  GLU   6           HG2      GLU   6  17.412 -18.395  -0.928
    6    HG3  GLU   6           HG3      GLU   6  16.512 -19.447   0.163

  No H/Q in entry =           6
  In of MODEL   29
    1    H    VAL   7           H        VAL   7  15.123 -17.414  -3.956
    2    HA   VAL   7           HA       VAL   7  16.817 -15.291  -3.099
    3    HB   VAL   7           HB       VAL   7  15.094 -15.648  -5.565
    4   HG11  VAL   7          HG11      VAL   7  16.995 -13.438  -4.762
    5   HG13  VAL   7          HG12      VAL   7  15.348 -13.293  -5.373
    6   HG12  VAL   7          HG13      VAL   7  16.649 -13.794  -6.454
    7   HG21  VAL   7          HG21      VAL   7  17.203 -17.108  -5.014
    8   HG23  VAL   7          HG22      VAL   7  18.107 -15.646  -5.416
    9   HG22  VAL   7          HG23      VAL   7  17.061 -16.393  -6.621

  No H/Q in entry =           9
  In of MODEL   29
    1    H    VAL   8           H        VAL   8  13.321 -15.557  -3.632
    2    HA   VAL   8           HA       VAL   8  12.660 -12.849  -3.150
    3    HB   VAL   8           HB       VAL   8  11.053 -15.380  -2.715
    4   HG11  VAL   8          HG11      VAL   8  10.372 -12.465  -2.399
    5   HG13  VAL   8          HG12      VAL   8   9.941 -13.823  -1.360
    6   HG12  VAL   8          HG13      VAL   8   9.131 -13.608  -2.910
    7   HG22  VAL   8          HG21      VAL   8  10.429 -15.210  -4.930
    8   HG21  VAL   8          HG22      VAL   8  11.914 -14.275  -5.081
    9   HG23  VAL   8          HG23      VAL   8  10.373 -13.448  -4.876

  No H/Q in entry =           9
  In of MODEL   29
    1    H    MET   9           H        MET   9  12.941 -15.660  -0.977
    2    HA   MET   9           HA       MET   9  12.143 -14.393   1.401
    3    HB2  MET   9           HB2      MET   9  14.008 -16.685   0.817
    4    HB3  MET   9           HB3      MET   9  13.801 -16.089   2.464
    5    HG2  MET   9           HG2      MET   9  11.262 -16.313   2.017
    6    HG3  MET   9           HG3      MET   9  11.734 -17.310   0.640
    7    HE3  MET   9           HE1      MET   9  13.442 -20.350   2.027
    8    HE2  MET   9           HE2      MET   9  14.239 -18.894   1.437
    9    HE1  MET   9           HE3      MET   9  12.775 -19.470   0.646

  No H/Q in entry =           9
  In of MODEL   29
    1    H    GLY  10           H        GLY  10  15.313 -14.615  -0.178
    2    HA3  GLY  10           HA2      GLY  10  16.786 -13.198   1.784
    3    HA2  GLY  10           HA3      GLY  10  17.237 -13.360   0.087

  No H/Q in entry =           3
  In of MODEL   29
    1    H    LEU  11           H        LEU  11  15.060 -12.136  -1.134
    2    HA   LEU  11           HA       LEU  11  15.746  -9.392  -0.970
    3    HB2  LEU  11           HB2      LEU  11  13.370 -10.799  -2.191
    4    HB3  LEU  11           HB3      LEU  11  13.649  -9.064  -2.349
    5    HG   LEU  11           HG       LEU  11  15.671 -11.171  -3.156
    6   HD13  LEU  11          HD11      LEU  11  13.915 -11.535  -4.664
    7   HD12  LEU  11          HD12      LEU  11  14.911 -10.352  -5.509
    8   HD11  LEU  11          HD13      LEU  11  13.444  -9.835  -4.679
    9   HD22  LEU  11          HD21      LEU  11  16.904  -9.207  -2.935
   10   HD21  LEU  11          HD22      LEU  11  15.526  -8.170  -3.302
   11   HD23  LEU  11          HD23      LEU  11  16.348  -9.036  -4.598

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  12           H        ILE  12  12.987 -11.221   0.313
    2    HA   ILE  12           HA       ILE  12  11.600  -9.001   1.387
    3    HB   ILE  12           HB       ILE  12  11.645 -11.885   2.329
    4   HG12  ILE  12          HG12      ILE  12  10.940 -11.249  -0.112
    5   HG13  ILE  12          HG13      ILE  12   9.918 -12.337   0.806
    6   HG23  ILE  12          HG21      ILE  12  10.710 -10.489   4.075
    7   HG22  ILE  12          HG22      ILE  12   9.372 -11.306   3.267
    8   HG21  ILE  12          HG23      ILE  12   9.720  -9.615   2.908
    9   HD11  ILE  12          HD11      ILE  12   9.495  -9.346   0.592
   10   HD13  ILE  12          HD12      ILE  12   8.404 -10.517   1.327
   11   HD12  ILE  12          HD13      ILE  12   8.673 -10.535  -0.402

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  13           H        ILE  13  14.005 -11.206   2.771
    2    HA   ILE  13           HA       ILE  13  14.057 -10.032   5.354
    3    HB   ILE  13           HB       ILE  13  16.113 -11.594   3.772
    4   HG12  ILE  13          HG12      ILE  13  13.866 -12.604   4.566
    5   HG13  ILE  13          HG13      ILE  13  15.343 -13.491   4.925
    6   HG23  ILE  13          HG21      ILE  13  17.371 -10.300   5.370
    7   HG22  ILE  13          HG22      ILE  13  17.256 -11.935   6.007
    8   HG21  ILE  13          HG23      ILE  13  16.226 -10.660   6.660
    9   HD11  ILE  13          HD11      ILE  13  14.531 -11.523   6.997
   10   HD13  ILE  13          HD12      ILE  13  15.145 -13.163   7.172
   11   HD12  ILE  13          HD13      ILE  13  13.450 -12.898   6.790

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ASN  14           H        ASN  14  15.989  -9.492   2.423
    2    HA   ASN  14           HA       ASN  14  17.737  -7.549   3.477
    3    HB2  ASN  14           HB2      ASN  14  17.701  -8.811   1.158
    4    HB3  ASN  14           HB3      ASN  14  16.802  -7.394   0.631
    5   HD21  ASN  14          HD21      ASN  14  19.234  -7.726  -0.573
    6   HD22  ASN  14          HD22      ASN  14  20.379  -6.641   0.049

  No H/Q in entry =           6
  In of MODEL   29
    1    H    SER  15           H        SER  15  14.614  -7.205   1.806
    2    HA   SER  15           HA       SER  15  14.495  -4.385   1.869
    3    HB2  SER  15           HB2      SER  15  12.159  -4.637   1.391
    4    HB3  SER  15           HB3      SER  15  12.955  -5.997   0.609
    5    HG   SER  15           HG       SER  15  11.281  -5.927   2.821

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLY  16           H        GLY  16  13.424  -6.853   4.175
    2    HA3  GLY  16           HA2      GLY  16  12.210  -5.111   6.044
    3    HA2  GLY  16           HA3      GLY  16  12.832  -6.719   6.399

  No H/Q in entry =           3
  In of MODEL   29
    1    H    GLN  17           H        GLN  17  15.538  -6.377   5.789
    2    HA   GLN  17           HA       GLN  17  16.507  -5.157   8.166
    3    HB2  GLN  17           HB2      GLN  17  17.913  -5.999   5.616
    4    HB3  GLN  17           HB3      GLN  17  18.766  -5.400   7.039
    5    HG2  GLN  17           HG2      GLN  17  16.880  -7.771   7.045
    6    HG3  GLN  17           HG3      GLN  17  18.637  -7.894   6.968
    7   HE21  GLN  17          HE21      GLN  17  16.238  -8.249   9.153
    8   HE22  GLN  17          HE22      GLN  17  17.012  -7.685  10.554

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ALA  18           H        ALA  18  16.293  -4.073   4.809
    2    HA   ALA  18           HA       ALA  18  17.723  -1.677   5.032
    3    HB2  ALA  18           HB1      ALA  18  16.595  -2.891   2.969
    4    HB3  ALA  18           HB2      ALA  18  16.854  -1.147   2.955
    5    HB1  ALA  18           HB3      ALA  18  15.259  -1.798   3.334

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ARG  19           H        ARG  19  14.227  -2.277   5.450
    2    HA   ARG  19           HA       ARG  19  13.555   0.369   6.175
    3    HB2  ARG  19           HB2      ARG  19  11.876  -1.387   5.596
    4    HB3  ARG  19           HB3      ARG  19  12.231  -2.187   7.129
    5    HG2  ARG  19           HG2      ARG  19  11.522  -0.200   8.377
    6    HG3  ARG  19           HG3      ARG  19  11.259   0.678   6.872
    7    HD2  ARG  19           HD2      ARG  19   9.125  -0.127   7.705
    8    HD3  ARG  19           HD3      ARG  19   9.538  -1.002   6.224
    9    HE   ARG  19           HE       ARG  19  10.515  -2.545   8.320
   10   HH21  ARG  19          HH11      ARG  19   9.278  -4.192   9.263
   11   HH22  ARG  19          HH12      ARG  19   7.557  -4.170   9.104
   12   HH11  ARG  19          HH21      ARG  19   7.509  -1.261   7.247
   13   HH12  ARG  19          HH22      ARG  19   6.556  -2.511   7.958

  No H/Q in entry =          13
  In of MODEL   29
    1    H    SER  20           H        SER  20  14.435  -2.462   8.123
    2    HA   SER  20           HA       SER  20  14.165  -1.369  10.664
    3    HB2  SER  20           HB2      SER  20  14.638  -3.691  10.538
    4    HB3  SER  20           HB3      SER  20  16.081  -3.423   9.562
    5    HG   SER  20           HG       SER  20  15.749  -2.464  12.211

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU  21           H        LEU  21  16.994  -1.293   8.510
    2    HA   LEU  21           HA       LEU  21  18.675   0.195  10.240
    3    HB2  LEU  21           HB2      LEU  21  18.635  -0.067   7.226
    4    HB3  LEU  21           HB3      LEU  21  19.894   0.790   8.110
    5    HG   LEU  21           HG       LEU  21  19.161  -2.102   8.649
    6   HD12  LEU  21          HD11      LEU  21  21.478  -2.402   7.442
    7   HD11  LEU  21          HD12      LEU  21  21.080  -0.852   6.703
    8   HD13  LEU  21          HD13      LEU  21  20.010  -2.235   6.478
    9   HD22  LEU  21          HD21      LEU  21  20.358  -1.449  10.532
   10   HD21  LEU  21          HD22      LEU  21  21.249  -0.196   9.677
   11   HD23  LEU  21          HD23      LEU  21  21.707  -1.880   9.484

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ALA  22           H        ALA  22  16.391   1.162   7.701
    2    HA   ALA  22           HA       ALA  22  16.921   3.922   7.717
    3    HB3  ALA  22           HB1      ALA  22  15.511   2.678   6.045
    4    HB2  ALA  22           HB2      ALA  22  14.803   4.188   6.620
    5    HB1  ALA  22           HB3      ALA  22  14.222   2.645   7.248

  No H/Q in entry =           5
  In of MODEL   29
    1    H    TYR  23           H        TYR  23  14.442   2.094   9.564
    2    HA   TYR  23           HA       TYR  23  13.481   4.325  11.025
    3    HB2  TYR  23           HB2      TYR  23  12.251   2.210  11.009
    4    HB3  TYR  23           HB3      TYR  23  13.591   1.398  11.818
    5    HD1  TYR  23           HD1      TYR  23  11.108   4.159  12.218
    6    HD2  TYR  23           HD2      TYR  23  13.785   1.426  14.171
    7    HE1  TYR  23           HE1      TYR  23  10.198   4.842  14.423
    8    HE2  TYR  23           HE2      TYR  23  12.875   2.107  16.374
    9    HH   TYR  23           HH       TYR  23  10.013   3.869  16.714

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ALA  24           H        ALA  24  16.137   2.056  11.640
    2    HA   ALA  24           HA       ALA  24  16.821   3.048  14.201
    3    HB1  ALA  24           HB1      ALA  24  18.182   1.259  14.024
    4    HB3  ALA  24           HB2      ALA  24  19.200   2.186  12.920
    5    HB2  ALA  24           HB3      ALA  24  17.904   1.175  12.285

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA  25           H        ALA  25  17.754   3.987  10.918
    2    HA   ALA  25           HA       ALA  25  19.698   5.925  11.555
    3    HB1  ALA  25           HB1      ALA  25  18.970   4.980   9.243
    4    HB3  ALA  25           HB2      ALA  25  19.467   6.669   9.336
    5    HB2  ALA  25           HB3      ALA  25  17.753   6.257   9.277

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU  26           H        LEU  26  16.181   6.145  11.217
    2    HA   LEU  26           HA       LEU  26  15.952   8.926  11.676
    3    HB2  LEU  26           HB2      LEU  26  14.088   7.687  10.757
    4    HB3  LEU  26           HB3      LEU  26  14.009   6.656  12.181
    5    HG   LEU  26           HG       LEU  26  13.407   8.610  13.569
    6   HD12  LEU  26          HD11      LEU  26  12.732  10.712  12.252
    7   HD11  LEU  26          HD12      LEU  26  13.706  10.064  10.935
    8   HD13  LEU  26          HD13      LEU  26  14.460  10.447  12.483
    9   HD21  LEU  26          HD21      LEU  26  11.716   8.298  11.069
   10   HD23  LEU  26          HD22      LEU  26  11.164   8.991  12.591
   11   HD22  LEU  26          HD23      LEU  26  11.619   7.291  12.514

  No H/Q in entry =          11
  In of MODEL   29
    1    H    LYS  27           H        LYS  27  15.864   6.141  13.863
    2    HA   LYS  27           HA       LYS  27  15.284   7.501  16.238
    3    HB2  LYS  27           HB2      LYS  27  15.316   5.026  15.968
    4    HB3  LYS  27           HB3      LYS  27  17.078   5.082  15.913
    5    HG2  LYS  27           HG2      LYS  27  17.141   6.063  18.165
    6    HG3  LYS  27           HG3      LYS  27  15.374   6.078  18.221
    7    HD2  LYS  27           HD2      LYS  27  15.352   3.611  17.979
    8    HD3  LYS  27           HD3      LYS  27  17.117   3.604  17.957
    9    HE2  LYS  27           HE2      LYS  27  17.163   4.588  20.215
   10    HE3  LYS  27           HE3      LYS  27  15.398   4.625  20.241
   11    HZ3  LYS  27           HZ1      LYS  27  16.197   2.672  21.382
   12    HZ2  LYS  27           HZ2      LYS  27  17.105   2.198  20.025
   13    HZ1  LYS  27           HZ3      LYS  27  15.406   2.200  19.956

  No H/Q in entry =          13
  In of MODEL   29
    1    H    GLN  28           H        GLN  28  18.391   6.927  14.625
    2    HA   GLN  28           HA       GLN  28  20.086   8.009  16.607
    3    HB2  GLN  28           HB2      GLN  28  20.353   7.967  13.590
    4    HB3  GLN  28           HB3      GLN  28  21.646   8.443  14.690
    5    HG2  GLN  28           HG2      GLN  28  20.238   5.760  14.746
    6    HG3  GLN  28           HG3      GLN  28  21.812   6.053  14.009
    7   HE21  GLN  28          HE21      GLN  28  20.586   4.719  16.716
    8   HE22  GLN  28          HE22      GLN  28  21.778   5.154  17.843

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ALA  29           H        ALA  29  18.315   9.495  13.929
    2    HA   ALA  29           HA       ALA  29  19.313  12.117  14.182
    3    HB2  ALA  29           HB1      ALA  29  17.605  12.755  12.723
    4    HB1  ALA  29           HB2      ALA  29  16.466  11.579  13.379
    5    HB3  ALA  29           HB3      ALA  29  17.790  11.040  12.346

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LYS  30           H        LYS  30  16.548  10.511  15.717
    2    HA   LYS  30           HA       LYS  30  15.541  12.761  17.086
    3    HB2  LYS  30           HB2      LYS  30  15.435   9.818  17.783
    4    HB3  LYS  30           HB3      LYS  30  14.574  11.066  18.685
    5    HG2  LYS  30           HG2      LYS  30  13.436  11.756  16.576
    6    HG3  LYS  30           HG3      LYS  30  14.236  10.422  15.741
    7    HD2  LYS  30           HD2      LYS  30  13.174   8.811  17.273
    8    HD3  LYS  30           HD3      LYS  30  12.384  10.134  18.132
    9    HE2  LYS  30           HE2      LYS  30  11.203  10.771  16.048
   10    HE3  LYS  30           HE3      LYS  30  11.972   9.419  15.209
   11    HZ2  LYS  30           HZ1      LYS  30   9.670   9.007  16.103
   12    HZ1  LYS  30           HZ2      LYS  30  10.348   9.057  17.666
   13    HZ3  LYS  30           HZ3      LYS  30  10.849   7.874  16.550

  No H/Q in entry =          13
  In of MODEL   29
    1    H    GLN  31           H        GLN  31  18.207  10.591  17.801
    2    HA   GLN  31           HA       GLN  31  18.551  11.599  20.495
    3    HB2  GLN  31           HB2      GLN  31  20.564  10.032  18.874
    4    HB3  GLN  31           HB3      GLN  31  20.441  10.153  20.629
    5    HG2  GLN  31           HG2      GLN  31  17.923   9.202  19.874
    6    HG3  GLN  31           HG3      GLN  31  19.018   8.360  18.785
    7   HE21  GLN  31          HE21      GLN  31  17.490   7.208  21.069
    8   HE22  GLN  31          HE22      GLN  31  18.653   6.545  22.110

  No H/Q in entry =           8
  In of MODEL   29
    1    H    GLY  32           H        GLY  32  19.051  12.923  17.528
    2    HA3  GLY  32           HA2      GLY  32  20.032  14.970  17.013
    3    HA2  GLY  32           HA3      GLY  32  20.799  14.971  18.596

  No H/Q in entry =           3
  In of MODEL   29
    1    H    ASP  33           H        ASP  33  21.211  12.083  16.809
    2    HA   ASP  33           HA       ASP  33  24.033  12.760  16.326
    3    HB2  ASP  33           HB2      ASP  33  22.526  10.143  16.446
    4    HB3  ASP  33           HB3      ASP  33  24.209  10.261  15.941

  No H/Q in entry =           4
  In of MODEL   29
    1    H    PHE  34           H        PHE  34  23.539  14.087  14.451
    2    HA   PHE  34           HA       PHE  34  22.175  13.108  12.170
    3    HB2  PHE  34           HB2      PHE  34  24.307  15.243  12.392
    4    HB3  PHE  34           HB3      PHE  34  23.313  14.955  10.965
    5    HD1  PHE  34           HD1      PHE  34  23.582  16.883  13.882
    6    HD2  PHE  34           HD2      PHE  34  20.689  14.771  11.510
    7    HE1  PHE  34           HE1      PHE  34  21.771  18.277  14.844
    8    HE2  PHE  34           HE2      PHE  34  18.883  16.166  12.475
    9    HZ   PHE  34           HZ       PHE  34  19.427  17.920  14.137

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ALA  35           H        ALA  35  25.556  12.920  13.156
    2    HA   ALA  35           HA       ALA  35  26.646  12.105  10.690
    3    HB3  ALA  35           HB1      ALA  35  28.338  10.932  12.396
    4    HB2  ALA  35           HB2      ALA  35  27.482  11.955  13.550
    5    HB1  ALA  35           HB3      ALA  35  28.309  12.682  12.173

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA  36           H        ALA  36  25.550  10.142  13.458
    2    HA   ALA  36           HA       ALA  36  26.028   7.658  12.173
    3    HB2  ALA  36           HB1      ALA  36  25.611   6.906  14.250
    4    HB3  ALA  36           HB2      ALA  36  23.922   7.400  14.112
    5    HB1  ALA  36           HB3      ALA  36  25.126   8.531  14.730

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA  37           H        ALA  37  23.205   9.781  12.330
    2    HA   ALA  37           HA       ALA  37  21.343   8.012  11.163
    3    HB3  ALA  37           HB1      ALA  37  21.567  10.974  11.460
    4    HB1  ALA  37           HB2      ALA  37  20.260   9.893  11.939
    5    HB2  ALA  37           HB3      ALA  37  20.437  10.369  10.249

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LYS  38           H        LYS  38  23.430  10.479   9.676
    2    HA   LYS  38           HA       LYS  38  22.773  10.057   7.002
    3    HB2  LYS  38           HB2      LYS  38  24.590  11.613   8.439
    4    HB3  LYS  38           HB3      LYS  38  25.618  10.628   7.404
    5    HG2  LYS  38           HG2      LYS  38  24.439  11.401   5.417
    6    HG3  LYS  38           HG3      LYS  38  23.250  12.252   6.408
    7    HD2  LYS  38           HD2      LYS  38  24.847  13.851   7.154
    8    HD3  LYS  38           HD3      LYS  38  26.205  12.868   6.607
    9    HE2  LYS  38           HE2      LYS  38  25.836  14.742   5.062
   10    HE3  LYS  38           HE3      LYS  38  25.498  13.206   4.257
   11    HZ3  LYS  38           HZ1      LYS  38  23.300  13.647   4.142
   12    HZ2  LYS  38           HZ2      LYS  38  23.820  15.263   4.230
   13    HZ1  LYS  38           HZ3      LYS  38  23.256  14.475   5.624

  No H/Q in entry =          13
  In of MODEL   29
    1    H    ALA  39           H        ALA  39  25.303   8.459   8.938
    2    HA   ALA  39           HA       ALA  39  26.361   6.877   6.857
    3    HB2  ALA  39           HB1      ALA  39  26.293   5.907   9.699
    4    HB1  ALA  39           HB2      ALA  39  27.240   7.335   9.280
    5    HB3  ALA  39           HB3      ALA  39  27.590   5.787   8.511

  No H/Q in entry =           5
  In of MODEL   29
    1    H    MET  40           H        MET  40  23.765   6.251   9.171
    2    HA   MET  40           HA       MET  40  23.322   3.546   8.434
    3    HB2  MET  40           HB2      MET  40  21.510   5.583   9.742
    4    HB3  MET  40           HB3      MET  40  21.106   3.874   9.566
    5    HG2  MET  40           HG2      MET  40  23.662   4.817  10.893
    6    HG3  MET  40           HG3      MET  40  22.174   4.536  11.795
    7    HE3  MET  40           HE1      MET  40  21.620   0.901  11.966
    8    HE2  MET  40           HE2      MET  40  20.743   2.204  11.167
    9    HE1  MET  40           HE3      MET  40  21.493   2.489  12.736

  No H/Q in entry =           9
  In of MODEL   29
    1    H    MET  41           H        MET  41  21.894   6.599   7.263
    2    HA   MET  41           HA       MET  41  19.929   5.404   5.601
    3    HB2  MET  41           HB2      MET  41  21.400   7.998   5.084
    4    HB3  MET  41           HB3      MET  41  19.869   7.503   4.374
    5    HG2  MET  41           HG2      MET  41  19.140   7.307   6.930
    6    HG3  MET  41           HG3      MET  41  20.448   8.467   7.146
    7    HE2  MET  41           HE1      MET  41  19.860   9.761   3.816
    8    HE1  MET  41           HE2      MET  41  20.825  10.200   5.222
    9    HE3  MET  41           HE3      MET  41  19.546  11.277   4.669

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ASP  42           H        ASP  42  23.295   6.336   5.028
    2    HA   ASP  42           HA       ASP  42  23.370   5.869   2.268
    3    HB2  ASP  42           HB2      ASP  42  25.130   6.867   4.028
    4    HB3  ASP  42           HB3      ASP  42  25.791   5.243   3.893

  No H/Q in entry =           4
  In of MODEL   29
    1    H    GLN  43           H        GLN  43  24.118   3.710   4.979
    2    HA   GLN  43           HA       GLN  43  24.778   1.457   3.387
    3    HB2  GLN  43           HB2      GLN  43  23.773   1.631   6.237
    4    HB3  GLN  43           HB3      GLN  43  24.351   0.146   5.475
    5    HG2  GLN  43           HG2      GLN  43  26.508   1.363   4.953
    6    HG3  GLN  43           HG3      GLN  43  25.928   2.687   5.959
    7   HE21  GLN  43          HE21      GLN  43  28.171   1.717   6.979
    8   HE22  GLN  43          HE22      GLN  43  27.907   0.630   8.254

  No H/Q in entry =           8
  In of MODEL   29
    1    H    SER  44           H        SER  44  21.728   2.580   4.794
    2    HA   SER  44           HA       SER  44  20.161   0.334   4.127
    3    HB2  SER  44           HB2      SER  44  19.720   2.859   5.281
    4    HB3  SER  44           HB3      SER  44  18.676   2.817   3.863
    5    HG   SER  44           HG       SER  44  17.596   1.867   5.591

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ARG  45           H        ARG  45  20.884   3.305   2.324
    2    HA   ARG  45           HA       ARG  45  19.345   2.821   0.028
    3    HB2  ARG  45           HB2      ARG  45  20.487   4.958   0.610
    4    HB3  ARG  45           HB3      ARG  45  22.031   4.208   0.213
    5    HG2  ARG  45           HG2      ARG  45  21.233   3.806  -2.097
    6    HG3  ARG  45           HG3      ARG  45  19.701   4.579  -1.699
    7    HD2  ARG  45           HD2      ARG  45  20.950   6.678  -1.118
    8    HD3  ARG  45           HD3      ARG  45  22.445   5.909  -1.698
    9    HE   ARG  45           HE       ARG  45  20.502   5.671  -3.722
   10   HH21  ARG  45          HH11      ARG  45  20.480   7.044  -5.482
   11   HH22  ARG  45          HH12      ARG  45  21.234   8.596  -5.379
   12   HH11  ARG  45          HH21      ARG  45  22.237   8.170  -2.101
   13   HH12  ARG  45          HH22      ARG  45  22.228   9.233  -3.462

  No H/Q in entry =          13
  In of MODEL   29
    1    H    MET  46           H        MET  46  22.716   1.952   0.751
    2    HA   MET  46           HA       MET  46  23.307   0.766  -1.740
    3    HB2  MET  46           HB2      MET  46  24.433   0.430   1.041
    4    HB3  MET  46           HB3      MET  46  25.084  -0.450  -0.346
    5    HG2  MET  46           HG2      MET  46  25.521   1.661  -1.515
    6    HG3  MET  46           HG3      MET  46  24.804   2.567  -0.188
    7    HE3  MET  46           HE1      MET  46  27.476  -0.627   0.116
    8    HE2  MET  46           HE2      MET  46  28.777   0.408  -0.462
    9    HE1  MET  46           HE3      MET  46  27.322   0.206  -1.437

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ALA  47           H        ALA  47  21.947  -0.577   1.243
    2    HA   ALA  47           HA       ALA  47  21.892  -3.288   0.434
    3    HB2  ALA  47           HB1      ALA  47  21.529  -2.833   2.742
    4    HB3  ALA  47           HB2      ALA  47  19.989  -3.437   2.133
    5    HB1  ALA  47           HB3      ALA  47  20.218  -1.706   2.394

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU  48           H        LEU  48  19.533  -0.664   0.100
    2    HA   LEU  48           HA       LEU  48  17.482  -2.197  -1.139
    3    HB2  LEU  48           HB2      LEU  48  18.131   0.758  -1.252
    4    HB3  LEU  48           HB3      LEU  48  16.656   0.047  -1.910
    5    HG   LEU  48           HG       LEU  48  17.531  -0.260   0.972
    6   HD13  LEU  48          HD11      LEU  48  17.109   2.041   0.793
    7   HD12  LEU  48          HD12      LEU  48  15.555   1.390   1.312
    8   HD11  LEU  48          HD13      LEU  48  15.813   1.816  -0.380
    9   HD22  LEU  48          HD21      LEU  48  16.002  -1.975   0.599
   10   HD21  LEU  48          HD22      LEU  48  15.118  -1.071  -0.631
   11   HD23  LEU  48          HD23      LEU  48  14.918  -0.670   1.075

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ASN  49           H        ASN  49  20.158  -0.264  -2.386
    2    HA   ASN  49           HA       ASN  49  19.487  -0.343  -5.105
    3    HB2  ASN  49           HB2      ASN  49  21.168   1.177  -4.207
    4    HB3  ASN  49           HB3      ASN  49  22.198  -0.177  -3.759
    5   HD21  ASN  49          HD21      ASN  49  20.718   1.384  -6.621
    6   HD22  ASN  49          HD22      ASN  49  21.944   0.919  -7.698

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLU  50           H        GLU  50  21.488  -2.539  -3.162
    2    HA   GLU  50           HA       GLU  50  22.175  -4.290  -5.297
    3    HB2  GLU  50           HB2      GLU  50  23.389  -4.268  -3.139
    4    HB3  GLU  50           HB3      GLU  50  21.953  -4.898  -2.333
    5    HG2  GLU  50           HG2      GLU  50  22.034  -6.929  -3.697
    6    HG3  GLU  50           HG3      GLU  50  23.403  -6.293  -4.607

  No H/Q in entry =           6
  In of MODEL   29
    1    H    ALA  51           H        ALA  51  19.537  -4.231  -2.950
    2    HA   ALA  51           HA       ALA  51  18.367  -6.704  -3.702
    3    HB3  ALA  51           HB1      ALA  51  16.786  -6.202  -2.134
    4    HB1  ALA  51           HB2      ALA  51  16.567  -4.555  -2.728
    5    HB2  ALA  51           HB3      ALA  51  17.935  -4.942  -1.683

  No H/Q in entry =           5
  In of MODEL   29
    1    H    HIS  52           H        HIS  52  17.770  -3.355  -4.727
    2    HA   HIS  52           HA       HIS  52  15.643  -3.880  -6.511
    3    HB2  HIS  52           HB2      HIS  52  16.234  -1.616  -5.743
    4    HB3  HIS  52           HB3      HIS  52  17.747  -1.706  -6.644
    5    HD1  HIS  52           HD1      HIS  52  17.485  -1.985  -9.316
    6    HD2  HIS  52           HD2      HIS  52  14.039  -0.833  -7.272
    7    HE1  HIS  52           HE1      HIS  52  15.886  -1.079 -11.059
    8    HE2  HIS  52           HE2      HIS  52  13.782  -0.372  -9.828

  No H/Q in entry =           8
  In of MODEL   29
    1    H    LEU  53           H        LEU  53  19.158  -3.882  -6.971
    2    HA   LEU  53           HA       LEU  53  19.193  -4.193  -9.772
    3    HB2  LEU  53           HB2      LEU  53  21.144  -4.956  -7.615
    4    HB3  LEU  53           HB3      LEU  53  21.447  -5.339  -9.307
    5    HG   LEU  53           HG       LEU  53  20.772  -2.530  -8.381
    6   HD11  LEU  53          HD11      LEU  53  23.478  -3.861  -8.699
    7   HD13  LEU  53          HD12      LEU  53  22.803  -3.172  -7.222
    8   HD12  LEU  53          HD13      LEU  53  23.244  -2.121  -8.563
    9   HD21  LEU  53          HD21      LEU  53  21.877  -3.762 -10.914
   10   HD23  LEU  53          HD22      LEU  53  22.184  -2.072 -10.524
   11   HD22  LEU  53          HD23      LEU  53  20.538  -2.633 -10.753

  No H/Q in entry =          11
  In of MODEL   29
    1    H    VAL  54           H        VAL  54  19.104  -6.584  -7.149
    2    HA   VAL  54           HA       VAL  54  19.218  -8.876  -8.813
    3    HB   VAL  54           HB       VAL  54  18.084  -8.458  -6.036
    4   HG12  VAL  54          HG11      VAL  54  18.412 -11.075  -6.039
    5   HG11  VAL  54          HG12      VAL  54  18.213 -10.904  -7.782
    6   HG13  VAL  54          HG13      VAL  54  16.932 -10.377  -6.693
    7   HG22  VAL  54          HG21      VAL  54  20.402  -8.244  -5.832
    8   HG21  VAL  54          HG22      VAL  54  20.730  -9.333  -7.177
    9   HG23  VAL  54          HG23      VAL  54  20.213  -9.983  -5.621

  No H/Q in entry =           9
  In of MODEL   29
    1    H    GLN  55           H        GLN  55  16.497  -6.979  -7.506
    2    HA   GLN  55           HA       GLN  55  14.470  -8.644  -8.567
    3    HB2  GLN  55           HB2      GLN  55  13.732  -7.122  -6.932
    4    HB3  GLN  55           HB3      GLN  55  14.516  -5.751  -7.712
    5    HG2  GLN  55           HG2      GLN  55  12.780  -5.428  -9.188
    6    HG3  GLN  55           HG3      GLN  55  12.460  -7.149  -9.358
    7   HE21  GLN  55          HE21      GLN  55  10.460  -7.703  -8.537
    8   HE22  GLN  55          HE22      GLN  55   9.695  -6.952  -7.222

  No H/Q in entry =           8
  In of MODEL   29
    1    H    THR  56           H        THR  56  16.193  -5.840  -9.936
    2    HA   THR  56           HA       THR  56  14.736  -5.477 -12.272
    3    HB   THR  56           HB       THR  56  17.740  -5.315 -11.912
    4    HG1  THR  56           HG1      THR  56  16.044  -3.974 -10.698
    5   HG21  THR  56          HG21      THR  56  15.888  -4.532 -14.142
    6   HG23  THR  56          HG22      THR  56  17.469  -5.308 -14.230
    7   HG22  THR  56          HG23      THR  56  17.350  -3.590 -13.844

  No H/Q in entry =           7
  In of MODEL   29
    1    H    LYS  57           H        LYS  57  17.395  -7.770 -11.685
    2    HA   LYS  57           HA       LYS  57  17.378  -8.961 -14.265
    3    HB2  LYS  57           HB2      LYS  57  19.181  -9.210 -12.529
    4    HB3  LYS  57           HB3      LYS  57  18.085 -10.216 -11.592
    5    HG2  LYS  57           HG2      LYS  57  17.976 -11.845 -13.419
    6    HG3  LYS  57           HG3      LYS  57  19.025 -10.837 -14.408
    7    HD2  LYS  57           HD2      LYS  57  20.835 -11.085 -12.741
    8    HD3  LYS  57           HD3      LYS  57  19.789 -12.109 -11.758
    9    HE2  LYS  57           HE2      LYS  57  19.629 -13.737 -13.618
   10    HE3  LYS  57           HE3      LYS  57  20.684 -12.725 -14.604
   11    HZ1  LYS  57           HZ1      LYS  57  21.446 -13.850 -11.969
   12    HZ3  LYS  57           HZ2      LYS  57  22.452 -13.027 -13.061
   13    HZ2  LYS  57           HZ3      LYS  57  21.840 -14.560 -13.458

  No H/Q in entry =          13
  In of MODEL   29
    1    H    LEU  58           H        LEU  58  15.622  -9.636 -11.276
    2    HA   LEU  58           HA       LEU  58  14.399 -12.011 -12.204
    3    HB2  LEU  58           HB2      LEU  58  13.617 -10.110  -9.999
    4    HB3  LEU  58           HB3      LEU  58  12.812 -11.650 -10.311
    5    HG   LEU  58           HG       LEU  58  15.788 -11.365  -9.780
    6   HD11  LEU  58          HD11      LEU  58  13.433 -11.790  -7.969
    7   HD13  LEU  58          HD12      LEU  58  14.886 -10.824  -7.717
    8   HD12  LEU  58          HD13      LEU  58  14.964 -12.580  -7.584
    9   HD22  LEU  58          HD21      LEU  58  15.667 -13.426 -10.809
   10   HD21  LEU  58          HD22      LEU  58  13.957 -13.640 -10.435
   11   HD23  LEU  58          HD23      LEU  58  15.176 -13.939  -9.196

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  59           H        ILE  59  13.714  -8.675 -12.877
    2    HA   ILE  59           HA       ILE  59  10.992  -9.329 -13.796
    3    HB   ILE  59           HB       ILE  59  11.797  -7.048 -12.593
    4   HG12  ILE  59          HG12      ILE  59   9.883  -6.921 -14.934
    5   HG13  ILE  59          HG13      ILE  59   9.470  -7.697 -13.427
    6   HG22  ILE  59          HG21      ILE  59  11.865  -6.221 -15.480
    7   HG21  ILE  59          HG22      ILE  59  13.345  -6.655 -14.656
    8   HG23  ILE  59          HG23      ILE  59  12.366  -5.309 -14.078
    9   HD12  ILE  59          HD11      ILE  59  10.288  -4.814 -13.773
   10   HD11  ILE  59          HD12      ILE  59   9.993  -5.583 -12.214
   11   HD13  ILE  59          HD13      ILE  59   8.672  -5.398 -13.368

  No H/Q in entry =          11
  In of MODEL   29
    1    H    GLU  60           H        GLU  60  14.184  -8.468 -15.079
    2    HA   GLU  60           HA       GLU  60  13.381  -8.067 -17.780
    3    HB2  GLU  60           HB2      GLU  60  15.558  -7.314 -16.991
    4    HB3  GLU  60           HB3      GLU  60  16.028  -8.969 -16.613
    5    HG2  GLU  60           HG2      GLU  60  15.189  -8.224 -19.410
    6    HG3  GLU  60           HG3      GLU  60  16.841  -7.943 -18.865

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLY  61           H        GLY  61  14.380 -10.948 -15.976
    2    HA3  GLY  61           HA2      GLY  61  13.824 -12.594 -18.375
    3    HA2  GLY  61           HA3      GLY  61  14.868 -13.074 -17.042

  No H/Q in entry =           3
  In of MODEL   29
    1    H    ASP  62           H        ASP  62  11.748 -11.537 -16.642
    2    HA   ASP  62           HA       ASP  62  10.835 -13.518 -14.832
    3    HB2  ASP  62           HB2      ASP  62  10.181 -11.084 -14.871
    4    HB3  ASP  62           HB3      ASP  62   9.162 -11.453 -16.259

  No H/Q in entry =           4
  In of MODEL   29
    1    H    ALA  63           H        ALA  63  11.027 -13.709 -18.178
    2    HA   ALA  63           HA       ALA  63   8.612 -14.790 -19.058
    3    HB1  ALA  63           HB1      ALA  63  11.415 -15.670 -19.802
    4    HB3  ALA  63           HB2      ALA  63  10.518 -14.350 -20.550
    5    HB2  ALA  63           HB3      ALA  63   9.955 -16.012 -20.732

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLY  64           H        GLY  64  11.370 -16.471 -17.584
    2    HA3  GLY  64           HA2      GLY  64  11.573 -18.523 -16.579
    3    HA2  GLY  64           HA3      GLY  64   9.939 -18.241 -15.993

  No H/Q in entry =           3
  In of MODEL   29
    1    H    GLU  65           H        GLU  65   8.598 -19.879 -16.467
    2    HA   GLU  65           HA       GLU  65   9.153 -22.026 -18.073
    3    HB2  GLU  65           HB2      GLU  65   6.472 -20.838 -17.378
    4    HB3  GLU  65           HB3      GLU  65   6.671 -22.404 -18.165
    5    HG2  GLU  65           HG2      GLU  65   8.012 -23.216 -16.294
    6    HG3  GLU  65           HG3      GLU  65   7.928 -21.638 -15.514

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLY  66           H        GLY  66   7.614 -22.711 -19.902
    2    HA3  GLY  66           HA2      GLY  66   8.377 -21.393 -22.264
    3    HA2  GLY  66           HA3      GLY  66   7.194 -22.679 -22.139

  No H/Q in entry =           3
  In of MODEL   29
    1    H    LYS  67           H        LYS  67   5.328 -21.368 -20.503
    2    HA   LYS  67           HA       LYS  67   3.915 -19.876 -22.486
    3    HB2  LYS  67           HB2      LYS  67   3.257 -20.649 -19.648
    4    HB3  LYS  67           HB3      LYS  67   2.137 -19.792 -20.713
    5    HG2  LYS  67           HG2      LYS  67   2.330 -21.598 -22.382
    6    HG3  LYS  67           HG3      LYS  67   3.450 -22.457 -21.328
    7    HD2  LYS  67           HD2      LYS  67   1.691 -22.641 -19.607
    8    HD3  LYS  67           HD3      LYS  67   0.567 -21.789 -20.669
    9    HE2  LYS  67           HE2      LYS  67   0.834 -23.566 -22.369
   10    HE3  LYS  67           HE3      LYS  67   1.933 -24.425 -21.291
   11    HZ3  LYS  67           HZ1      LYS  67   0.250 -25.195 -20.075
   12    HZ2  LYS  67           HZ2      LYS  67  -0.744 -24.761 -21.381
   13    HZ1  LYS  67           HZ3      LYS  67  -0.563 -23.706 -20.061

  No H/Q in entry =          13
  In of MODEL   29
    1    H    MET  68           H        MET  68   3.074 -17.852 -22.411
    2    HA   MET  68           HA       MET  68   4.724 -15.734 -21.832
    3    HB2  MET  68           HB2      MET  68   1.727 -15.843 -22.138
    4    HB3  MET  68           HB3      MET  68   2.638 -14.336 -22.052
    5    HG2  MET  68           HG2      MET  68   3.965 -14.999 -24.005
    6    HG3  MET  68           HG3      MET  68   3.113 -16.542 -24.078
    7    HE2  MET  68           HE1      MET  68   1.709 -12.354 -25.108
    8    HE1  MET  68           HE2      MET  68   3.126 -12.882 -24.203
    9    HE3  MET  68           HE3      MET  68   1.562 -12.786 -23.398

  No H/Q in entry =           9
  In of MODEL   29
    1    H    LYS  69           H        LYS  69   3.368 -17.555 -19.414
    2    HA   LYS  69           HA       LYS  69   2.406 -15.589 -17.628
    3    HB2  LYS  69           HB2      LYS  69   3.383 -18.406 -17.186
    4    HB3  LYS  69           HB3      LYS  69   2.695 -17.411 -15.901
    5    HG2  LYS  69           HG2      LYS  69   0.644 -17.096 -17.229
    6    HG3  LYS  69           HG3      LYS  69   1.327 -18.084 -18.521
    7    HD2  LYS  69           HD2      LYS  69   1.451 -20.011 -16.992
    8    HD3  LYS  69           HD3      LYS  69   0.778 -19.026 -15.691
    9    HE2  LYS  69           HE2      LYS  69  -1.271 -18.667 -17.011
   10    HE3  LYS  69           HE3      LYS  69  -0.601 -19.636 -18.322
   11    HZ2  LYS  69           HZ1      LYS  69  -1.584 -20.486 -15.699
   12    HZ1  LYS  69           HZ2      LYS  69  -0.316 -21.368 -16.403
   13    HZ3  LYS  69           HZ3      LYS  69  -1.798 -21.209 -17.217

  No H/Q in entry =          13
  In of MODEL   29
    1    H    VAL  70           H        VAL  70   3.256 -15.021 -15.470
    2    HA   VAL  70           HA       VAL  70   6.200 -14.642 -15.489
    3    HB   VAL  70           HB       VAL  70   5.736 -12.534 -14.223
    4   HG12  VAL  70          HG11      VAL  70   4.814 -11.293 -16.226
    5   HG11  VAL  70          HG12      VAL  70   4.520 -12.861 -16.978
    6   HG13  VAL  70          HG13      VAL  70   6.167 -12.363 -16.595
    7   HG23  VAL  70          HG21      VAL  70   2.849 -12.968 -15.067
    8   HG22  VAL  70          HG22      VAL  70   3.490 -11.667 -14.066
    9   HG21  VAL  70          HG23      VAL  70   3.434 -13.313 -13.438

  No H/Q in entry =           9
  In of MODEL   29
    1    H    SER  71           H        SER  71   7.207 -14.558 -13.397
    2    HA   SER  71           HA       SER  71   6.344 -16.571 -11.580
    3    HB2  SER  71           HB2      SER  71   8.728 -15.862 -11.929
    4    HB3  SER  71           HB3      SER  71   8.357 -14.365 -11.078
    5    HG   SER  71           HG       SER  71   7.931 -16.977 -10.043

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU  72           H        LEU  72   4.929 -16.436  -9.973
    2    HA   LEU  72           HA       LEU  72   3.377 -14.128  -9.513
    3    HB2  LEU  72           HB2      LEU  72   3.683 -16.686  -7.948
    4    HB3  LEU  72           HB3      LEU  72   2.514 -15.433  -7.540
    5    HG   LEU  72           HG       LEU  72   2.657 -16.719 -10.286
    6   HD12  LEU  72          HD11      LEU  72   0.719 -18.074  -9.556
    7   HD11  LEU  72          HD12      LEU  72   0.872 -17.408  -7.932
    8   HD13  LEU  72          HD13      LEU  72   2.151 -18.430  -8.588
    9   HD23  LEU  72          HD21      LEU  72   0.172 -15.920 -10.174
   10   HD22  LEU  72          HD22      LEU  72   1.407 -14.709 -10.483
   11   HD21  LEU  72          HD23      LEU  72   0.724 -14.878  -8.868

  No H/Q in entry =          11
  In of MODEL   29
    1    H    VAL  73           H        VAL  73   6.050 -15.561  -7.762
    2    HA   VAL  73           HA       VAL  73   6.003 -14.032  -5.427
    3    HB   VAL  73           HB       VAL  73   8.191 -14.837  -5.017
    4   HG11  VAL  73          HG11      VAL  73   6.312 -16.536  -5.236
    5   HG13  VAL  73          HG12      VAL  73   7.940 -17.187  -5.420
    6   HG12  VAL  73          HG13      VAL  73   6.939 -16.899  -6.843
    7   HG22  VAL  73          HG21      VAL  73   9.527 -14.279  -6.831
    8   HG21  VAL  73          HG22      VAL  73   8.353 -14.865  -8.009
    9   HG23  VAL  73          HG23      VAL  73   9.338 -16.012  -7.102

  No H/Q in entry =           9
  In of MODEL   29
    1    H    LEU  74           H        LEU  74   6.968 -13.130  -8.608
    2    HA   LEU  74           HA       LEU  74   8.912 -11.178  -8.126
    3    HB2  LEU  74           HB2      LEU  74   8.433 -11.931 -10.362
    4    HB3  LEU  74           HB3      LEU  74   6.774 -11.350 -10.249
    5    HG   LEU  74           HG       LEU  74   7.662  -9.023  -9.964
    6   HD11  LEU  74          HD11      LEU  74  10.257 -10.518 -10.329
    7   HD13  LEU  74          HD12      LEU  74   9.855  -9.296  -9.125
    8   HD12  LEU  74          HD13      LEU  74  10.115  -8.826 -10.804
    9   HD23  LEU  74          HD21      LEU  74   8.830 -10.197 -12.452
   10   HD22  LEU  74          HD22      LEU  74   7.894  -8.736 -12.231
   11   HD21  LEU  74          HD23      LEU  74   7.092 -10.289 -12.178

  No H/Q in entry =          11
  In of MODEL   29
    1    H    VAL  75           H        VAL  75   5.413 -10.801  -8.455
    2    HA   VAL  75           HA       VAL  75   5.314  -8.046  -7.862
    3    HB   VAL  75           HB       VAL  75   3.234 -10.198  -7.473
    4   HG13  VAL  75          HG11      VAL  75   2.745  -8.306  -5.975
    5   HG12  VAL  75          HG12      VAL  75   1.657  -8.246  -7.353
    6   HG11  VAL  75          HG13      VAL  75   3.041  -7.167  -7.284
    7   HG21  VAL  75          HG21      VAL  75   4.015  -9.730  -9.802
    8   HG23  VAL  75          HG22      VAL  75   3.593  -8.035  -9.576
    9   HG22  VAL  75          HG23      VAL  75   2.332  -9.267  -9.555

  No H/Q in entry =           9
  In of MODEL   29
    1    H    GLU  76           H        GLU  76   5.081 -10.927  -5.756
    2    HA   GLU  76           HA       GLU  76   4.624  -9.571  -3.329
    3    HB2  GLU  76           HB2      GLU  76   4.456 -12.040  -3.572
    4    HB3  GLU  76           HB3      GLU  76   6.192 -12.131  -3.812
    5    HG2  GLU  76           HG2      GLU  76   5.757 -12.718  -1.516
    6    HG3  GLU  76           HG3      GLU  76   6.492 -11.125  -1.502

  No H/Q in entry =           6
  In of MODEL   29
    1    H    ALA  77           H        ALA  77   7.676 -10.469  -4.914
    2    HA   ALA  77           HA       ALA  77   9.376  -9.425  -2.907
    3    HB3  ALA  77           HB1      ALA  77  10.137  -9.427  -5.812
    4    HB1  ALA  77           HB2      ALA  77   9.920 -10.949  -4.949
    5    HB2  ALA  77           HB3      ALA  77  11.132  -9.792  -4.401

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLN  78           H        GLN  78   7.962  -8.006  -5.809
    2    HA   GLN  78           HA       GLN  78   9.310  -5.524  -5.709
    3    HB2  GLN  78           HB2      GLN  78   8.006  -6.435  -7.662
    4    HB3  GLN  78           HB3      GLN  78   6.526  -6.068  -6.776
    5    HG2  GLN  78           HG2      GLN  78   7.162  -3.695  -6.680
    6    HG3  GLN  78           HG3      GLN  78   8.652  -4.052  -7.554
    7   HE21  GLN  78          HE21      GLN  78   6.692  -2.242  -8.624
    8   HE22  GLN  78          HE22      GLN  78   6.017  -2.955 -10.010

  No H/Q in entry =           8
  In of MODEL   29
    1    H    LEU  79           H        LEU  79   6.302  -6.670  -4.263
    2    HA   LEU  79           HA       LEU  79   5.310  -4.266  -3.243
    3    HB2  LEU  79           HB2      LEU  79   3.999  -6.320  -3.183
    4    HB3  LEU  79           HB3      LEU  79   5.152  -7.059  -2.076
    5    HG   LEU  79           HG       LEU  79   4.607  -5.421  -0.343
    6   HD13  LEU  79          HD11      LEU  79   4.132  -3.406  -1.387
    7   HD12  LEU  79          HD12      LEU  79   2.511  -3.935  -0.940
    8   HD11  LEU  79          HD13      LEU  79   3.082  -4.153  -2.592
    9   HD23  LEU  79          HD21      LEU  79   2.022  -5.918  -0.239
   10   HD22  LEU  79          HD22      LEU  79   3.164  -7.255  -0.139
   11   HD21  LEU  79          HD23      LEU  79   2.341  -6.917  -1.659

  No H/Q in entry =          11
  In of MODEL   29
    1    H    HIS  80           H        HIS  80   7.506  -6.601  -1.677
    2    HA   HIS  80           HA       HIS  80   7.805  -5.062   0.693
    3    HB2  HIS  80           HB2      HIS  80   9.140  -7.422  -0.518
    4    HB3  HIS  80           HB3      HIS  80  10.056  -6.526   0.695
    5    HD1  HIS  80           HD1      HIS  80   9.579  -7.167   3.040
    6    HD2  HIS  80           HD2      HIS  80   6.350  -8.017   0.544
    7    HE1  HIS  80           HE1      HIS  80   7.817  -8.275   4.496
    8    HE2  HIS  80           HE2      HIS  80   5.842  -8.798   2.983

  No H/Q in entry =           8
  In of MODEL   29
    1    H    LEU  81           H        LEU  81   9.794  -5.330  -2.231
    2    HA   LEU  81           HA       LEU  81  11.841  -3.589  -1.361
    3    HB2  LEU  81           HB2      LEU  81  10.906  -4.377  -4.120
    4    HB3  LEU  81           HB3      LEU  81  12.326  -3.370  -3.836
    5    HG   LEU  81           HG       LEU  81  11.944  -6.094  -2.565
    6   HD12  LEU  81          HD11      LEU  81  13.751  -6.715  -4.325
    7   HD11  LEU  81          HD12      LEU  81  13.179  -5.290  -5.191
    8   HD13  LEU  81          HD13      LEU  81  12.071  -6.616  -4.850
    9   HD23  LEU  81          HD21      LEU  81  14.572  -5.776  -2.564
   10   HD22  LEU  81          HD22      LEU  81  13.596  -5.019  -1.308
   11   HD21  LEU  81          HD23      LEU  81  14.166  -4.064  -2.676

  No H/Q in entry =          11
  In of MODEL   29
    1    H    MET  82           H        MET  82   8.908  -2.951  -3.281
    2    HA   MET  82           HA       MET  82   9.443  -0.224  -3.779
    3    HB2  MET  82           HB2      MET  82   6.885  -1.820  -3.644
    4    HB3  MET  82           HB3      MET  82   6.881  -0.095  -4.005
    5    HG2  MET  82           HG2      MET  82   8.475  -2.165  -5.552
    6    HG3  MET  82           HG3      MET  82   6.905  -1.542  -6.055
    7    HE3  MET  82           HE1      MET  82   7.345   1.915  -7.223
    8    HE2  MET  82           HE2      MET  82   6.980   1.685  -5.515
    9    HE1  MET  82           HE3      MET  82   6.309   0.577  -6.708

  No H/Q in entry =           9
  In of MODEL   29
    1    H    THR  83           H        THR  83   7.665  -1.828  -1.168
    2    HA   THR  83           HA       THR  83   6.820   0.517   0.167
    3    HB   THR  83           HB       THR  83   6.697  -1.061   2.183
    4    HG1  THR  83           HG1      THR  83   7.454  -3.010   1.946
    5   HG22  THR  83          HG21      THR  83   5.037  -2.625   0.721
    6   HG21  THR  83          HG22      THR  83   5.257  -1.294  -0.410
    7   HG23  THR  83          HG23      THR  83   4.625  -0.982   1.207

  No H/Q in entry =           7
  In of MODEL   29
    1    H    SER  84           H        SER  84   9.648  -1.581   0.670
    2    HA   SER  84           HA       SER  84  10.718  -0.154   2.855
    3    HB2  SER  84           HB2      SER  84  11.961  -1.992   0.820
    4    HB3  SER  84           HB3      SER  84  12.914  -1.241   2.098
    5    HG   SER  84           HG       SER  84  10.641  -2.932   2.366

  No H/Q in entry =           5
  In of MODEL   29
    1    H    MET  85           H        MET  85  11.453   0.114  -0.637
    2    HA   MET  85           HA       MET  85  13.452   2.078  -0.393
    3    HB2  MET  85           HB2      MET  85  13.040   0.797  -2.458
    4    HB3  MET  85           HB3      MET  85  11.517   1.660  -2.679
    5    HG2  MET  85           HG2      MET  85  12.724   3.797  -2.813
    6    HG3  MET  85           HG3      MET  85  14.251   2.964  -2.539
    7    HE2  MET  85           HE1      MET  85  11.556   3.044  -6.180
    8    HE1  MET  85           HE2      MET  85  11.169   3.374  -4.494
    9    HE3  MET  85           HE3      MET  85  11.176   1.714  -5.076

  No H/Q in entry =           9
  In of MODEL   29
    1    H    LEU  86           H        LEU  86   9.960   2.414  -0.883
    2    HA   LEU  86           HA       LEU  86   9.895   5.228  -1.059
    3    HB2  LEU  86           HB2      LEU  86   8.048   3.569  -1.628
    4    HB3  LEU  86           HB3      LEU  86   7.727   3.477   0.104
    5    HG   LEU  86           HG       LEU  86   7.567   6.037   0.056
    6   HD11  LEU  86          HD11      LEU  86   8.328   5.606  -2.650
    7   HD13  LEU  86          HD12      LEU  86   7.896   7.132  -1.885
    8   HD12  LEU  86          HD13      LEU  86   6.656   6.171  -2.685
    9   HD23  LEU  86          HD21      LEU  86   5.424   4.688  -1.597
   10   HD22  LEU  86          HD22      LEU  86   5.240   5.946  -0.378
   11   HD21  LEU  86          HD23      LEU  86   5.642   4.301   0.110

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ALA  87           H        ALA  87   9.443   3.044   1.686
    2    HA   ALA  87           HA       ALA  87   8.906   4.955   3.661
    3    HB1  ALA  87           HB1      ALA  87   9.712   2.135   3.566
    4    HB3  ALA  87           HB2      ALA  87   8.593   2.945   4.659
    5    HB2  ALA  87           HB3      ALA  87  10.323   2.975   4.994

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ARG  88           H        ARG  88  11.984   3.531   2.662
    2    HA   ARG  88           HA       ARG  88  13.603   4.905   4.488
    3    HB2  ARG  88           HB2      ARG  88  14.263   2.934   3.077
    4    HB3  ARG  88           HB3      ARG  88  14.409   4.029   1.705
    5    HG2  ARG  88           HG2      ARG  88  15.893   5.339   3.646
    6    HG3  ARG  88           HG3      ARG  88  16.215   3.649   4.020
    7    HD2  ARG  88           HD2      ARG  88  17.472   3.355   2.166
    8    HD3  ARG  88           HD3      ARG  88  16.330   4.229   1.141
    9    HE   ARG  88           HE       ARG  88  18.731   5.289   2.177
   10   HH21  ARG  88          HH11      ARG  88  19.076   7.508   1.984
   11   HH22  ARG  88          HH12      ARG  88  17.725   8.581   1.851
   12   HH11  ARG  88          HH21      ARG  88  15.390   6.045   1.918
   13   HH12  ARG  88          HH22      ARG  88  15.636   7.749   1.789

  No H/Q in entry =          13
  In of MODEL   29
    1    H    GLU  89           H        GLU  89  12.612   5.809   1.172
    2    HA   GLU  89           HA       GLU  89  14.160   8.169   1.011
    3    HB2  GLU  89           HB2      GLU  89  13.004   7.132  -0.933
    4    HB3  GLU  89           HB3      GLU  89  11.463   7.673  -0.265
    5    HG2  GLU  89           HG2      GLU  89  12.165  10.010  -0.427
    6    HG3  GLU  89           HG3      GLU  89  13.766   9.520  -0.974

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LEU  90           H        LEU  90  10.836   7.659   2.158
    2    HA   LEU  90           HA       LEU  90  10.326  10.391   2.741
    3    HB2  LEU  90           HB2      LEU  90   9.136   7.817   3.770
    4    HB3  LEU  90           HB3      LEU  90   8.508   9.411   4.200
    5    HG   LEU  90           HG       LEU  90   8.910   8.537   1.327
    6   HD12  LEU  90          HD11      LEU  90   6.376   8.209   1.403
    7   HD11  LEU  90          HD12      LEU  90   6.541   8.195   3.159
    8   HD13  LEU  90          HD13      LEU  90   7.353   6.967   2.187
    9   HD22  LEU  90          HD21      LEU  90   8.616  10.845   1.259
   10   HD21  LEU  90          HD22      LEU  90   7.638  10.875   2.725
   11   HD23  LEU  90          HD23      LEU  90   6.932  10.323   1.206

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  91           H        ILE  91  11.598   7.706   4.651
    2    HA   ILE  91           HA       ILE  91  11.753   9.066   7.121
    3    HB   ILE  91           HB       ILE  91  13.300   6.729   5.984
    4   HG12  ILE  91          HG12      ILE  91  11.296   6.893   8.256
    5   HG13  ILE  91          HG13      ILE  91  10.816   6.616   6.582
    6   HG22  ILE  91          HG21      ILE  91  13.785   6.511   8.622
    7   HG21  ILE  91          HG22      ILE  91  13.709   8.269   8.525
    8   HG23  ILE  91          HG23      ILE  91  14.881   7.383   7.552
    9   HD13  ILE  91          HD11      ILE  91  11.818   4.514   6.503
   10   HD12  ILE  91          HD12      ILE  91  11.234   4.569   8.166
   11   HD11  ILE  91          HD13      ILE  91  12.934   4.882   7.818

  No H/Q in entry =          11
  In of MODEL   29
    1    H    THR  92           H        THR  92  13.954   8.902   4.357
    2    HA   THR  92           HA       THR  92  16.127  10.291   5.506
    3    HB   THR  92           HB       THR  92  15.124  10.172   2.651
    4    HG1  THR  92           HG1      THR  92  15.958   8.274   3.048
    5   HG22  THR  92          HG21      THR  92  17.693  10.862   2.344
    6   HG21  THR  92          HG22      THR  92  17.394  11.680   3.877
    7   HG23  THR  92          HG23      THR  92  16.416  12.071   2.462

  No H/Q in entry =           7
  In of MODEL   29
    1    H    GLU  93           H        GLU  93  13.230  11.449   3.796
    2    HA   GLU  93           HA       GLU  93  13.827  14.210   3.912
    3    HB2  GLU  93           HB2      GLU  93  11.122  12.838   3.939
    4    HB3  GLU  93           HB3      GLU  93  11.408  14.538   3.569
    5    HG2  GLU  93           HG2      GLU  93  12.737  12.298   2.029
    6    HG3  GLU  93           HG3      GLU  93  11.188  12.982   1.552

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LEU  94           H        LEU  94  12.096  12.050   6.129
    2    HA   LEU  94           HA       LEU  94  11.298  13.993   8.014
    3    HB2  LEU  94           HB2      LEU  94  11.875  11.037   8.279
    4    HB3  LEU  94           HB3      LEU  94  11.311  12.011   9.634
    5    HG   LEU  94           HG       LEU  94   9.812  12.068   7.014
    6   HD11  LEU  94          HD11      LEU  94   9.906   9.843   9.014
    7   HD13  LEU  94          HD12      LEU  94   9.594   9.785   7.281
    8   HD12  LEU  94          HD13      LEU  94   8.322  10.300   8.387
    9   HD23  LEU  94          HD21      LEU  94   7.902  12.465   8.626
   10   HD22  LEU  94          HD22      LEU  94   9.142  13.719   8.658
   11   HD21  LEU  94          HD23      LEU  94   9.086  12.500   9.931

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  95           H        ILE  95  14.270  12.063   7.756
    2    HA   ILE  95           HA       ILE  95  15.452  12.980  10.164
    3    HB   ILE  95           HB       ILE  95  16.675  11.916   7.607
    4   HG12  ILE  95          HG12      ILE  95  16.396  10.710  10.374
    5   HG13  ILE  95          HG13      ILE  95  15.221  10.454   9.085
    6   HG21  ILE  95          HG21      ILE  95  17.947  12.717  10.243
    7   HG23  ILE  95          HG22      ILE  95  18.400  13.248   8.622
    8   HG22  ILE  95          HG23      ILE  95  18.709  11.587   9.126
    9   HD13  ILE  95          HD11      ILE  95  16.693   9.177   7.811
   10   HD12  ILE  95          HD12      ILE  95  17.176   8.725   9.443
   11   HD11  ILE  95          HD13      ILE  95  18.124   9.906   8.541

  No H/Q in entry =          11
  In of MODEL   29
    1    H    GLU  96           H        GLU  96  15.587  14.220   6.831
    2    HA   GLU  96           HA       GLU  96  17.438  16.297   7.301
    3    HB2  GLU  96           HB2      GLU  96  16.759  15.639   5.045
    4    HB3  GLU  96           HB3      GLU  96  15.118  16.196   5.356
    5    HG2  GLU  96           HG2      GLU  96  15.682  18.326   4.814
    6    HG3  GLU  96           HG3      GLU  96  16.988  18.324   5.989

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LEU  97           H        LEU  97  13.929  16.110   7.751
    2    HA   LEU  97           HA       LEU  97  13.518  18.843   8.401
    3    HB2  LEU  97           HB2      LEU  97  12.002  16.317   9.019
    4    HB3  LEU  97           HB3      LEU  97  11.494  17.863   9.697
    5    HG   LEU  97           HG       LEU  97  11.959  17.452   6.728
    6   HD12  LEU  97          HD11      LEU  97   9.434  17.325   6.625
    7   HD11  LEU  97          HD12      LEU  97   9.438  17.122   8.375
    8   HD13  LEU  97          HD13      LEU  97  10.212  15.917   7.346
    9   HD23  LEU  97          HD21      LEU  97  10.222  19.417   6.775
   10   HD22  LEU  97          HD22      LEU  97  11.905  19.775   7.158
   11   HD21  LEU  97          HD23      LEU  97  10.724  19.603   8.455

  No H/Q in entry =          11
  In of MODEL   29
    1    H    HIS  98           H        HIS  98  14.350  16.013  10.386
    2    HA   HIS  98           HA       HIS  98  14.208  17.269  12.905
    3    HB2  HIS  98           HB2      HIS  98  15.951  15.013  11.889
    4    HB3  HIS  98           HB3      HIS  98  15.960  15.548  13.571
    5    HD1  HIS  98           HD1      HIS  98  13.744  13.924  10.989
    6    HD2  HIS  98           HD2      HIS  98  13.662  14.836  15.056
    7    HE1  HIS  98           HE1      HIS  98  11.724  12.729  11.952
    8    HE2  HIS  98           HE2      HIS  98  11.654  13.276  14.424

  No H/Q in entry =           8
  In of MODEL   29
    1    H    GLU  99           H        GLU  99  16.747  17.157  10.455
    2    HA   GLU  99           HA       GLU  99  18.742  18.484  11.974
    3    HB2  GLU  99           HB2      GLU  99  19.208  17.201   9.900
    4    HB3  GLU  99           HB3      GLU  99  18.393  18.458   8.966
    5    HG2  GLU  99           HG2      GLU  99  20.007  20.126   9.750
    6    HG3  GLU  99           HG3      GLU  99  20.792  18.921  10.766

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LYS 100           H        LYS 100  16.206  19.653   9.776
    2    HA   LYS 100           HA       LYS 100  17.006  22.389   9.920
    3    HB2  LYS 100           HB2      LYS 100  14.368  21.104   9.179
    4    HB3  LYS 100           HB3      LYS 100  14.668  22.842   9.090
    5    HG2  LYS 100           HG2      LYS 100  16.631  22.395   7.611
    6    HG3  LYS 100           HG3      LYS 100  16.216  20.678   7.627
    7    HD2  LYS 100           HD2      LYS 100  14.015  21.192   6.642
    8    HD3  LYS 100           HD3      LYS 100  14.413  22.910   6.632
    9    HE2  LYS 100           HE2      LYS 100  16.362  22.431   5.160
   10    HE3  LYS 100           HE3      LYS 100  15.895  20.727   5.126
   11    HZ1  LYS 100           HZ1      LYS 100  14.067  22.923   4.307
   12    HZ3  LYS 100           HZ2      LYS 100  13.880  21.254   4.042
   13    HZ2  LYS 100           HZ3      LYS 100  15.086  22.116   3.215

  No H/Q in entry =          13
  In of MODEL   29
    1    H    LEU 101           H        LEU 101  14.919  20.341  11.894
    2    HA   LEU 101           HA       LEU 101  13.765  22.407  13.484
    3    HB2  LEU 101           HB2      LEU 101  14.206  19.456  13.859
    4    HB3  LEU 101           HB3      LEU 101  13.680  20.434  15.225
    5    HG   LEU 101           HG       LEU 101  12.245  20.530  12.565
    6   HD12  LEU 101          HD11      LEU 101  10.592  18.965  13.841
    7   HD11  LEU 101          HD12      LEU 101  11.992  18.549  14.827
    8   HD13  LEU 101          HD13      LEU 101  12.015  18.245  13.089
    9   HD21  LEU 101          HD21      LEU 101  11.607  21.317  15.423
   10   HD23  LEU 101          HD22      LEU 101  10.338  21.096  14.220
   11   HD22  LEU 101          HD23      LEU 101  11.573  22.330  13.977

  No H/Q in entry =          11
  In of MODEL   29
    1    H    LYS 102           H        LYS 102  16.909  21.797  13.027
    2    HA   LYS 102           HA       LYS 102  18.763  22.663  14.089
    3    HB2  LYS 102           HB2      LYS 102  16.958  24.178  15.237
    4    HB3  LYS 102           HB3      LYS 102  17.172  23.112  16.611
    5    HG2  LYS 102           HG2      LYS 102  19.060  25.124  15.434
    6    HG3  LYS 102           HG3      LYS 102  18.688  24.806  17.114
    7    HD2  LYS 102           HD2      LYS 102  20.342  22.895  15.414
    8    HD3  LYS 102           HD3      LYS 102  21.039  24.214  16.345
    9    HE2  LYS 102           HE2      LYS 102  20.644  21.664  17.311
   10    HE3  LYS 102           HE3      LYS 102  20.870  23.104  18.304
   11    HZ2  LYS 102           HZ1      LYS 102  18.904  21.821  18.932
   12    HZ1  LYS 102           HZ2      LYS 102  18.251  22.055  17.387
   13    HZ3  LYS 102           HZ3      LYS 102  18.489  23.382  18.414

  No H/Q in entry =          13
  In of MODEL   29
    1    H    ALA 103           H        ALA 103  16.704  21.055  16.521
    2    HA   ALA 103           HA       ALA 103  18.440  19.839  18.162
    3    HB2  ALA 103           HB1      ALA 103  16.853  17.833  18.162
    4    HB1  ALA 103           HB2      ALA 103  15.951  18.691  16.912
    5    HB3  ALA 103           HB3      ALA 103  16.140  19.408  18.511

  No H/Q in entry =           5
  In of MODEL   29
    1    H1   ALA   1           H3       ALA   1  -1.773  -6.904 -21.389
    2    H2   ALA   1           H2       ALA   1  -2.567  -8.339 -20.934
    3    H3   ALA   1           H1       ALA   1  -0.963  -8.391 -21.499
    4    HA   ALA   1           HA       ALA   1  -1.810  -8.854 -23.491
    5    HB1  ALA   1           HB1      ALA   1  -3.945  -9.570 -23.006
    6    HB2  ALA   1           HB2      ALA   1  -4.386  -8.056 -23.797
    7    HB3  ALA   1           HB3      ALA   1  -4.315  -8.141 -22.039

  No H/Q in entry =           7
  In of MODEL   29
    1    H    GLU   2           H        GLU   2  -2.650  -7.658 -25.473
    2    HA   GLU   2           HA       GLU   2  -1.253  -5.645 -26.354
    3    HB2  GLU   2           HB2      GLU   2  -4.262  -5.705 -26.654
    4    HB3  GLU   2           HB3      GLU   2  -3.146  -4.842 -27.708
    5    HG2  GLU   2           HG2      GLU   2  -2.653  -6.730 -28.870
    6    HG3  GLU   2           HG3      GLU   2  -2.349  -7.640 -27.397

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLU   3           H        GLU   3  -4.406  -4.384 -25.432
    2    HA   GLU   3           HA       GLU   3  -3.351  -1.831 -24.804
    3    HB2  GLU   3           HB2      GLU   3  -6.039  -3.142 -24.459
    4    HB3  GLU   3           HB3      GLU   3  -5.734  -1.528 -23.811
    5    HG2  GLU   3           HG2      GLU   3  -5.389  -0.597 -25.937
    6    HG3  GLU   3           HG3      GLU   3  -5.001  -2.152 -26.667

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LEU   4           H        LEU   4  -4.932  -4.192 -22.620
    2    HA   LEU   4           HA       LEU   4  -4.551  -2.970 -20.229
    3    HB2  LEU   4           HB2      LEU   4  -4.016  -5.911 -20.708
    4    HB3  LEU   4           HB3      LEU   4  -4.411  -5.168 -19.160
    5    HG   LEU   4           HG       LEU   4  -6.199  -5.233 -21.614
    6   HD13  LEU   4          HD11      LEU   4  -7.389  -6.950 -20.613
    7   HD12  LEU   4          HD12      LEU   4  -6.894  -6.495 -18.983
    8   HD11  LEU   4          HD13      LEU   4  -5.766  -7.338 -20.044
    9   HD23  LEU   4          HD21      LEU   4  -7.871  -4.423 -19.734
   10   HD22  LEU   4          HD22      LEU   4  -6.835  -3.251 -20.548
   11   HD21  LEU   4          HD23      LEU   4  -6.400  -3.846 -18.947

  No H/Q in entry =          11
  In of MODEL   29
    1    H    GLU   5           H        GLU   5  -2.067  -4.814 -21.979
    2    HA   GLU   5           HA       GLU   5  -0.070  -4.538 -19.954
    3    HB2  GLU   5           HB2      GLU   5  -0.015  -6.306 -21.705
    4    HB3  GLU   5           HB3      GLU   5   0.284  -5.062 -22.919
    5    HG2  GLU   5           HG2      GLU   5   2.358  -4.415 -21.774
    6    HG3  GLU   5           HG3      GLU   5   2.059  -5.624 -20.524

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLU   6           H        GLU   6  -0.721  -2.817 -22.990
    2    HA   GLU   6           HA       GLU   6   1.454  -0.990 -22.731
    3    HB2  GLU   6           HB2      GLU   6   0.296  -1.475 -24.884
    4    HB3  GLU   6           HB3      GLU   6  -1.133  -0.647 -24.266
    5    HG2  GLU   6           HG2      GLU   6   0.159   1.424 -24.001
    6    HG3  GLU   6           HG3      GLU   6   1.611   0.605 -24.573

  No H/Q in entry =           6
  In of MODEL   29
    1    H    VAL   7           H        VAL   7  -1.878  -1.057 -21.667
    2    HA   VAL   7           HA       VAL   7  -2.089   1.654 -20.823
    3    HB   VAL   7           HB       VAL   7  -3.551  -0.863 -19.983
    4   HG11  VAL   7          HG11      VAL   7  -3.916   2.025 -19.160
    5   HG13  VAL   7          HG12      VAL   7  -3.813   0.597 -18.129
    6   HG12  VAL   7          HG13      VAL   7  -5.250   0.872 -19.112
    7   HG21  VAL   7          HG21      VAL   7  -3.720   0.219 -22.368
    8   HG23  VAL   7          HG22      VAL   7  -4.658   1.468 -21.548
    9   HG22  VAL   7          HG23      VAL   7  -5.207  -0.208 -21.522

  No H/Q in entry =           9
  In of MODEL   29
    1    H    VAL   8           H        VAL   8  -1.097  -1.337 -19.192
    2    HA   VAL   8           HA       VAL   8  -0.761  -0.264 -16.596
    3    HB   VAL   8           HB       VAL   8   0.632  -2.579 -17.966
    4   HG11  VAL   8          HG11      VAL   8   0.766  -1.490 -15.162
    5   HG13  VAL   8          HG12      VAL   8   2.077  -2.065 -16.193
    6   HG12  VAL   8          HG13      VAL   8   0.970  -3.218 -15.448
    7   HG22  VAL   8          HG21      VAL   8  -1.145  -3.889 -17.286
    8   HG21  VAL   8          HG22      VAL   8  -2.013  -2.357 -17.254
    9   HG23  VAL   8          HG23      VAL   8  -1.334  -3.012 -15.768

  No H/Q in entry =           9
  In of MODEL   29
    1    H    MET   9           H        MET   9   1.470  -0.563 -19.358
    2    HA   MET   9           HA       MET   9   3.766   0.472 -18.108
    3    HB2  MET   9           HB2      MET   9   2.795   0.465 -20.959
    4    HB3  MET   9           HB3      MET   9   4.287   1.293 -20.515
    5    HG2  MET   9           HG2      MET   9   4.940  -0.920 -19.347
    6    HG3  MET   9           HG3      MET   9   3.636  -1.644 -20.291
    7    HE3  MET   9           HE1      MET   9   4.599  -1.315 -23.903
    8    HE2  MET   9           HE2      MET   9   3.560  -0.207 -23.012
    9    HE1  MET   9           HE3      MET   9   3.497  -1.933 -22.668

  No H/Q in entry =           9
  In of MODEL   29
    1    H    GLY  10           H        GLY  10   1.076   2.085 -19.765
    2    HA3  GLY  10           HA2      GLY  10   2.047   4.735 -19.520
    3    HA2  GLY  10           HA3      GLY  10   0.356   4.280 -19.716

  No H/Q in entry =           3
  In of MODEL   29
    1    H    LEU  11           H        LEU  11  -0.033   2.748 -17.431
    2    HA   LEU  11           HA       LEU  11  -0.546   4.722 -15.463
    3    HB2  LEU  11           HB2      LEU  11  -0.486   1.706 -15.315
    4    HB3  LEU  11           HB3      LEU  11  -0.983   2.727 -13.966
    5    HG   LEU  11           HG       LEU  11  -2.239   2.851 -16.721
    6   HD13  LEU  11          HD11      LEU  11  -2.825   0.707 -15.968
    7   HD12  LEU  11          HD12      LEU  11  -4.169   1.702 -15.411
    8   HD11  LEU  11          HD13      LEU  11  -2.907   1.215 -14.280
    9   HD22  LEU  11          HD21      LEU  11  -2.818   4.866 -15.706
   10   HD21  LEU  11          HD22      LEU  11  -2.734   4.195 -14.077
   11   HD23  LEU  11          HD23      LEU  11  -4.117   3.836 -15.111

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  12           H        ILE  12   1.988   2.248 -15.728
    2    HA   ILE  12           HA       ILE  12   3.212   2.776 -13.231
    3    HB   ILE  12           HB       ILE  12   4.447   1.739 -15.804
    4   HG12  ILE  12          HG12      ILE  12   2.437   0.510 -14.659
    5   HG13  ILE  12          HG13      ILE  12   3.834  -0.429 -15.145
    6   HG23  ILE  12          HG21      ILE  12   6.215   2.457 -14.321
    7   HG22  ILE  12          HG22      ILE  12   6.123   0.698 -14.219
    8   HG21  ILE  12          HG23      ILE  12   5.435   1.693 -12.937
    9   HD11  ILE  12          HD11      ILE  12   3.398   0.683 -12.362
   10   HD13  ILE  12          HD12      ILE  12   4.651  -0.449 -12.868
   11   HD12  ILE  12          HD13      ILE  12   2.974  -0.949 -12.847

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  13           H        ILE  13   3.795   4.045 -16.489
    2    HA   ILE  13           HA       ILE  13   5.943   5.757 -15.774
    3    HB   ILE  13           HB       ILE  13   3.896   5.856 -18.005
    4   HG12  ILE  13          HG12      ILE  13   5.668   3.980 -17.786
    5   HG13  ILE  13          HG13      ILE  13   5.513   4.794 -19.339
    6   HG23  ILE  13          HG21      ILE  13   4.647   8.127 -17.715
    7   HG22  ILE  13          HG22      ILE  13   5.501   7.476 -19.110
    8   HG21  ILE  13          HG23      ILE  13   6.331   7.618 -17.562
    9   HD11  ILE  13          HD11      ILE  13   7.447   6.030 -17.447
   10   HD13  ILE  13          HD12      ILE  13   7.572   5.764 -19.181
   11   HD12  ILE  13          HD13      ILE  13   7.885   4.439 -18.066

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ASN  14           H        ASN  14   2.436   6.264 -16.017
    2    HA   ASN  14           HA       ASN  14   2.407   9.008 -15.373
    3    HB2  ASN  14           HB2      ASN  14   0.503   7.374 -16.195
    4    HB3  ASN  14           HB3      ASN  14   0.193   7.192 -14.473
    5   HD21  ASN  14          HD21      ASN  14  -1.833   8.359 -15.888
    6   HD22  ASN  14          HD22      ASN  14  -1.888  10.031 -15.616

  No H/Q in entry =           6
  In of MODEL   29
    1    H    SER  15           H        SER  15   2.117   6.127 -13.301
    2    HA   SER  15           HA       SER  15   1.831   7.492 -10.848
    3    HB2  SER  15           HB2      SER  15   2.380   5.402  -9.807
    4    HB3  SER  15           HB3      SER  15   1.541   4.989 -11.299
    5    HG   SER  15           HG       SER  15   4.222   4.716 -10.606

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLY  16           H        GLY  16   4.691   6.391 -12.629
    2    HA3  GLY  16           HA2      GLY  16   6.632   7.137 -10.710
    3    HA2  GLY  16           HA3      GLY  16   6.922   6.938 -12.436

  No H/Q in entry =           3
  In of MODEL   29
    1    H    GLN  17           H        GLN  17   5.231   8.903 -13.482
    2    HA   GLN  17           HA       GLN  17   6.816  11.240 -13.179
    3    HB2  GLN  17           HB2      GLN  17   4.056  10.823 -14.360
    4    HB3  GLN  17           HB3      GLN  17   4.923  12.358 -14.437
    5    HG2  GLN  17           HG2      GLN  17   6.003   9.729 -15.489
    6    HG3  GLN  17           HG3      GLN  17   5.238  10.966 -16.486
    7   HE21  GLN  17          HE21      GLN  17   8.237   9.871 -15.743
    8   HE22  GLN  17          HE22      GLN  17   9.114  11.321 -15.827

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ALA  18           H        ALA  18   3.723  10.226 -11.811
    2    HA   ALA  18           HA       ALA  18   3.012  12.613 -10.535
    3    HB1  ALA  18           HB1      ALA  18   1.876  10.159 -10.755
    4    HB2  ALA  18           HB2      ALA  18   1.337  11.378  -9.602
    5    HB3  ALA  18           HB3      ALA  18   2.429  10.092  -9.082

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ARG  19           H        ARG  19   4.888   9.843  -9.275
    2    HA   ARG  19           HA       ARG  19   5.440  10.994  -6.754
    3    HB2  ARG  19           HB2      ARG  19   5.846   8.592  -7.290
    4    HB3  ARG  19           HB3      ARG  19   7.196   9.078  -8.319
    5    HG2  ARG  19           HG2      ARG  19   8.331  10.111  -6.402
    6    HG3  ARG  19           HG3      ARG  19   6.961   9.723  -5.362
    7    HD2  ARG  19           HD2      ARG  19   8.723   8.084  -5.020
    8    HD3  ARG  19           HD3      ARG  19   7.342   7.306  -5.798
    9    HE   ARG  19           HE       ARG  19   9.034   8.127  -7.855
   10   HH21  ARG  19          HH11      ARG  19  10.587   6.721  -8.719
   11   HH22  ARG  19          HH12      ARG  19  11.136   5.370  -7.791
   12   HH11  ARG  19          HH21      ARG  19   9.122   6.089  -5.082
   13   HH12  ARG  19          HH22      ARG  19  10.304   5.012  -5.730

  No H/Q in entry =          13
  In of MODEL   29
    1    H    SER  20           H        SER  20   7.237  11.028  -9.815
    2    HA   SER  20           HA       SER  20   9.489  12.439  -9.003
    3    HB2  SER  20           HB2      SER  20   9.506  11.568 -11.209
    4    HB3  SER  20           HB3      SER  20   8.004  12.387 -11.624
    5    HG   SER  20           HG       SER  20  10.402  13.721 -10.906

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU  21           H        LEU  21   6.384  13.714 -10.176
    2    HA   LEU  21           HA       LEU  21   7.059  16.459  -9.950
    3    HB2  LEU  21           HB2      LEU  21   4.389  15.038  -9.854
    4    HB3  LEU  21           HB3      LEU  21   4.558  16.792  -9.857
    5    HG   LEU  21           HG       LEU  21   5.739  15.000 -11.999
    6   HD12  LEU  21          HD11      LEU  21   3.762  16.109 -13.329
    7   HD11  LEU  21          HD12      LEU  21   3.039  16.291 -11.730
    8   HD13  LEU  21          HD13      LEU  21   3.450  14.686 -12.333
    9   HD22  LEU  21          HD21      LEU  21   6.879  17.020 -12.223
   10   HD21  LEU  21          HD22      LEU  21   5.557  17.975 -11.560
   11   HD23  LEU  21          HD23      LEU  21   5.463  17.376 -13.208

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ALA  22           H        ALA  22   5.560  14.165  -7.697
    2    HA   ALA  22           HA       ALA  22   4.972  15.968  -5.621
    3    HB3  ALA  22           HB1      ALA  22   4.209  13.577  -5.785
    4    HB2  ALA  22           HB2      ALA  22   4.808  14.045  -4.193
    5    HB1  ALA  22           HB3      ALA  22   5.823  13.088  -5.274

  No H/Q in entry =           5
  In of MODEL   29
    1    H    TYR  23           H        TYR  23   7.902  13.943  -6.085
    2    HA   TYR  23           HA       TYR  23   9.300  14.956  -3.839
    3    HB2  TYR  23           HB2      TYR  23  10.080  12.951  -5.007
    4    HB3  TYR  23           HB3      TYR  23  10.382  13.892  -6.466
    5    HD1  TYR  23           HD1      TYR  23  11.361  13.575  -2.875
    6    HD2  TYR  23           HD2      TYR  23  12.425  15.037  -6.772
    7    HE1  TYR  23           HE1      TYR  23  13.626  14.151  -2.041
    8    HE2  TYR  23           HE2      TYR  23  14.689  15.613  -5.938
    9    HH   TYR  23           HH       TYR  23  15.903  14.483  -2.989

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ALA  24           H        ALA  24   9.095  16.071  -7.201
    2    HA   ALA  24           HA       ALA  24  10.992  18.156  -6.963
    3    HB2  ALA  24           HB1      ALA  24  10.534  18.223  -9.169
    4    HB3  ALA  24           HB2      ALA  24   8.981  18.972  -8.797
    5    HB1  ALA  24           HB3      ALA  24   9.106  17.219  -8.932

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA  25           H        ALA  25   7.517  17.968  -6.319
    2    HA   ALA  25           HA       ALA  25   7.039  20.685  -5.740
    3    HB1  ALA  25           HB1      ALA  25   5.378  18.686  -5.934
    4    HB2  ALA  25           HB2      ALA  25   5.017  19.971  -4.781
    5    HB3  ALA  25           HB3      ALA  25   5.712  18.450  -4.218

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU  26           H        LEU  26   8.124  18.001  -3.704
    2    HA   LEU  26           HA       LEU  26   8.244  19.427  -1.264
    3    HB2  LEU  26           HB2      LEU  26   8.342  17.011  -1.265
    4    HB3  LEU  26           HB3      LEU  26   9.805  17.022  -2.245
    5    HG   LEU  26           HG       LEU  26  11.031  18.137  -0.411
    6   HD12  LEU  26          HD11      LEU  26   9.820  18.139   1.857
    7   HD11  LEU  26          HD12      LEU  26   8.327  18.001   0.932
    8   HD13  LEU  26          HD13      LEU  26   9.368  19.409   0.719
    9   HD21  LEU  26          HD21      LEU  26   9.507  15.666   0.467
   10   HD23  LEU  26          HD22      LEU  26  11.026  16.228   1.155
   11   HD22  LEU  26          HD23      LEU  26  10.970  15.673  -0.516

  No H/Q in entry =          11
  In of MODEL   29
    1    H    LYS  27           H        LYS  27  10.644  18.863  -3.806
    2    HA   LYS  27           HA       LYS  27  12.835  20.105  -2.591
    3    HB2  LYS  27           HB2      LYS  27  12.924  18.762  -4.684
    4    HB3  LYS  27           HB3      LYS  27  12.151  20.095  -5.541
    5    HG2  LYS  27           HG2      LYS  27  14.018  21.582  -4.973
    6    HG3  LYS  27           HG3      LYS  27  14.787  20.289  -4.045
    7    HD2  LYS  27           HD2      LYS  27  14.918  18.906  -6.103
    8    HD3  LYS  27           HD3      LYS  27  14.194  20.225  -7.023
    9    HE2  LYS  27           HE2      LYS  27  16.084  21.693  -6.420
   10    HE3  LYS  27           HE3      LYS  27  16.811  20.378  -5.491
   11    HZ3  LYS  27           HZ1      LYS  27  17.786  20.485  -7.684
   12    HZ2  LYS  27           HZ2      LYS  27  16.255  20.365  -8.414
   13    HZ1  LYS  27           HZ3      LYS  27  16.886  19.054  -7.537

  No H/Q in entry =          13
  In of MODEL   29
    1    H    GLN  28           H        GLN  28  10.196  21.486  -4.518
    2    HA   GLN  28           HA       GLN  28  11.150  24.140  -4.672
    3    HB2  GLN  28           HB2      GLN  28   8.320  23.063  -4.545
    4    HB3  GLN  28           HB3      GLN  28   8.725  24.738  -4.916
    5    HG2  GLN  28           HG2      GLN  28   9.713  22.333  -6.476
    6    HG3  GLN  28           HG3      GLN  28   8.377  23.371  -6.969
    7   HE21  GLN  28          HE21      GLN  28  11.515  22.876  -7.714
    8   HE22  GLN  28          HE22      GLN  28  12.000  24.461  -8.081

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ALA  29           H        ALA  29   9.238  22.439  -2.226
    2    HA   ALA  29           HA       ALA  29   8.696  24.626  -0.536
    3    HB2  ALA  29           HB1      ALA  29   7.981  23.053   1.034
    4    HB1  ALA  29           HB2      ALA  29   9.202  21.872   0.558
    5    HB3  ALA  29           HB3      ALA  29   7.808  22.165  -0.480

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LYS  30           H        LYS  30  11.430  22.365  -0.629
    2    HA   LYS  30           HA       LYS  30  12.762  23.317   1.666
    3    HB2  LYS  30           HB2      LYS  30  13.844  22.039  -0.854
    4    HB3  LYS  30           HB3      LYS  30  14.836  22.398   0.561
    5    HG2  LYS  30           HG2      LYS  30  13.295  21.008   1.949
    6    HG3  LYS  30           HG3      LYS  30  12.401  20.587   0.484
    7    HD2  LYS  30           HD2      LYS  30  14.441  19.608  -0.493
    8    HD3  LYS  30           HD3      LYS  30  15.354  20.042   0.953
    9    HE2  LYS  30           HE2      LYS  30  13.862  18.605   2.315
   10    HE3  LYS  30           HE3      LYS  30  12.979  18.150   0.852
   11    HZ2  LYS  30           HZ1      LYS  30  14.779  16.575   1.597
   12    HZ1  LYS  30           HZ2      LYS  30  15.910  17.765   1.140
   13    HZ3  LYS  30           HZ3      LYS  30  14.868  17.082  -0.019

  No H/Q in entry =          13
  In of MODEL   29
    1    H    GLN  31           H        GLN  31  12.627  24.529  -1.627
    2    HA   GLN  31           HA       GLN  31  14.779  26.426  -1.216
    3    HB2  GLN  31           HB2      GLN  31  12.720  26.473  -3.426
    4    HB3  GLN  31           HB3      GLN  31  14.338  27.172  -3.437
    5    HG2  GLN  31           HG2      GLN  31  14.811  24.476  -2.871
    6    HG3  GLN  31           HG3      GLN  31  13.499  24.422  -4.040
    7   HE21  GLN  31          HE21      GLN  31  16.341  23.636  -4.466
    8   HE22  GLN  31          HE22      GLN  31  16.902  24.614  -5.734

  No H/Q in entry =           8
  In of MODEL   29
    1    H    GLY  32           H        GLY  32  11.713  26.234  -0.050
    2    HA3  GLY  32           HA2      GLY  32  10.561  27.797   1.235
    3    HA2  GLY  32           HA3      GLY  32  11.680  29.036   0.680

  No H/Q in entry =           3
  In of MODEL   29
    1    H    ASP  33           H        ASP  33  10.303  27.134  -1.807
    2    HA   ASP  33           HA       ASP  33   8.627  29.405  -2.646
    3    HB2  ASP  33           HB2      ASP  33   9.716  26.991  -4.101
    4    HB3  ASP  33           HB3      ASP  33   8.557  28.105  -4.821

  No H/Q in entry =           4
  In of MODEL   29
    1    H    PHE  34           H        PHE  34   6.951  28.922  -1.072
    2    HA   PHE  34           HA       PHE  34   5.578  26.446  -0.972
    3    HB2  PHE  34           HB2      PHE  34   4.615  29.229  -0.279
    4    HB3  PHE  34           HB3      PHE  34   3.773  27.736   0.135
    5    HD1  PHE  34           HD1      PHE  34   6.025  30.137   1.339
    6    HD2  PHE  34           HD2      PHE  34   5.355  25.895   1.281
    7    HE1  PHE  34           HE1      PHE  34   7.431  29.885   3.365
    8    HE2  PHE  34           HE2      PHE  34   6.763  25.647   3.305
    9    HZ   PHE  34           HZ       PHE  34   7.795  27.643   4.346

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ALA  35           H        ALA  35   5.126  29.313  -2.973
    2    HA   ALA  35           HA       ALA  35   2.570  28.694  -3.982
    3    HB3  ALA  35           HB1      ALA  35   3.604  30.094  -6.024
    4    HB2  ALA  35           HB2      ALA  35   4.829  30.455  -4.808
    5    HB1  ALA  35           HB3      ALA  35   3.140  30.860  -4.504

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA  36           H        ALA  36   5.790  28.032  -5.360
    2    HA   ALA  36           HA       ALA  36   4.789  26.605  -7.600
    3    HB3  ALA  36           HB1      ALA  36   6.944  26.737  -8.231
    4    HB2  ALA  36           HB2      ALA  36   7.437  25.706  -6.886
    5    HB1  ALA  36           HB3      ALA  36   7.329  27.453  -6.666

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA  37           H        ALA  37   5.771  25.606  -4.354
    2    HA   ALA  37           HA       ALA  37   5.716  22.819  -4.789
    3    HB2  ALA  37           HB1      ALA  37   5.467  24.604  -2.405
    4    HB1  ALA  37           HB2      ALA  37   6.602  23.290  -2.708
    5    HB3  ALA  37           HB3      ALA  37   4.944  22.931  -2.226

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LYS  38           H        LYS  38   3.185  25.018  -3.598
    2    HA   LYS  38           HA       LYS  38   1.093  23.199  -3.365
    3    HB2  LYS  38           HB2      LYS  38   1.439  25.955  -3.110
    4    HB3  LYS  38           HB3      LYS  38   0.231  25.808  -4.381
    5    HG2  LYS  38           HG2      LYS  38  -1.205  24.477  -2.931
    6    HG3  LYS  38           HG3      LYS  38   0.048  24.418  -1.684
    7    HD2  LYS  38           HD2      LYS  38  -0.141  26.753  -1.230
    8    HD3  LYS  38           HD3      LYS  38  -1.064  27.043  -2.705
    9    HE2  LYS  38           HE2      LYS  38  -2.554  27.069  -0.755
   10    HE3  LYS  38           HE3      LYS  38  -2.931  25.694  -1.798
   11    HZ3  LYS  38           HZ1      LYS  38  -2.191  24.222  -0.273
   12    HZ2  LYS  38           HZ2      LYS  38  -2.538  25.476   0.822
   13    HZ1  LYS  38           HZ3      LYS  38  -0.946  25.230   0.285

  No H/Q in entry =          13
  In of MODEL   29
    1    H    ALA  39           H        ALA  39   2.047  25.110  -6.216
    2    HA   ALA  39           HA       ALA  39  -0.038  24.241  -7.907
    3    HB2  ALA  39           HB1      ALA  39   2.689  24.899  -8.978
    4    HB1  ALA  39           HB2      ALA  39   1.725  26.156  -8.203
    5    HB3  ALA  39           HB3      ALA  39   1.104  25.320  -9.627

  No H/Q in entry =           5
  In of MODEL   29
    1    H    MET  40           H        MET  40   3.207  22.949  -7.353
    2    HA   MET  40           HA       MET  40   3.101  20.933  -9.347
    3    HB2  MET  40           HB2      MET  40   4.730  21.156  -6.810
    4    HB3  MET  40           HB3      MET  40   4.975  19.903  -8.029
    5    HG2  MET  40           HG2      MET  40   5.020  22.861  -8.688
    6    HG3  MET  40           HG3      MET  40   6.472  21.961  -8.251
    7    HE3  MET  40           HE1      MET  40   7.331  19.754 -11.070
    8    HE2  MET  40           HE2      MET  40   6.779  19.430  -9.430
    9    HE1  MET  40           HE3      MET  40   7.869  20.781  -9.734

  No H/Q in entry =           9
  In of MODEL   29
    1    H    MET  41           H        MET  41   2.210  20.966  -5.917
    2    HA   MET  41           HA       MET  41   1.687  18.199  -5.642
    3    HB2  MET  41           HB2      MET  41   0.358  20.550  -4.276
    4    HB3  MET  41           HB3      MET  41   0.210  18.870  -3.771
    5    HG2  MET  41           HG2      MET  41   2.920  19.101  -3.827
    6    HG3  MET  41           HG3      MET  41   2.477  20.757  -3.424
    7    HE2  MET  41           HE1      MET  41  -0.547  19.492  -1.680
    8    HE1  MET  41           HE2      MET  41   0.263  21.008  -2.060
    9    HE3  MET  41           HE3      MET  41   0.217  20.434  -0.393

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ASP  42           H        ASP  42  -0.366  20.920  -6.595
    2    HA   ASP  42           HA       ASP  42  -2.803  19.552  -6.718
    3    HB2  ASP  42           HB2      ASP  42  -2.106  22.125  -6.974
    4    HB3  ASP  42           HB3      ASP  42  -2.268  21.733  -8.682

  No H/Q in entry =           4
  In of MODEL   29
    1    H    GLN  43           H        GLN  43  -0.382  20.156  -9.236
    2    HA   GLN  43           HA       GLN  43  -1.779  18.837 -11.318
    3    HB2  GLN  43           HB2      GLN  43   1.180  19.361 -10.956
    4    HB3  GLN  43           HB3      GLN  43   0.458  18.722 -12.435
    5    HG2  GLN  43           HG2      GLN  43  -1.060  20.745 -12.461
    6    HG3  GLN  43           HG3      GLN  43  -0.100  21.401 -11.139
    7   HE21  GLN  43          HE21      GLN  43   0.041  23.026 -13.222
    8   HE22  GLN  43          HE22      GLN  43   1.451  22.812 -14.140

  No H/Q in entry =           8
  In of MODEL   29
    1    H    SER  44           H        SER  44   0.592  17.699  -8.946
    2    HA   SER  44           HA       SER  44   0.928  15.095  -9.980
    3    HB2  SER  44           HB2      SER  44   1.834  16.532  -7.746
    4    HB3  SER  44           HB3      SER  44   0.980  15.144  -7.073
    5    HG   SER  44           HG       SER  44   3.090  14.533  -7.515

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ARG  45           H        ARG  45  -1.380  16.401  -7.623
    2    HA   ARG  45           HA       ARG  45  -2.754  14.034  -6.983
    3    HB2  ARG  45           HB2      ARG  45  -2.952  16.199  -5.785
    4    HB3  ARG  45           HB3      ARG  45  -3.820  16.866  -7.165
    5    HG2  ARG  45           HG2      ARG  45  -5.578  15.133  -6.873
    6    HG3  ARG  45           HG3      ARG  45  -4.721  14.521  -5.457
    7    HD2  ARG  45           HD2      ARG  45  -4.928  16.785  -4.395
    8    HD3  ARG  45           HD3      ARG  45  -5.927  17.304  -5.769
    9    HE   ARG  45           HE       ARG  45  -7.021  14.922  -4.727
   10   HH21  ARG  45          HH11      ARG  45  -8.848  14.988  -3.443
   11   HH22  ARG  45          HH12      ARG  45  -9.243  16.424  -2.568
   12   HH11  ARG  45          HH21      ARG  45  -6.480  18.168  -3.700
   13   HH12  ARG  45          HH22      ARG  45  -7.896  18.225  -2.712

  No H/Q in entry =          13
  In of MODEL   29
    1    H    MET  46           H        MET  46  -3.365  16.442  -9.524
    2    HA   MET  46           HA       MET  46  -5.707  15.263 -10.573
    3    HB2  MET  46           HB2      MET  46  -3.620  17.101 -11.756
    4    HB3  MET  46           HB3      MET  46  -5.005  16.540 -12.699
    5    HG2  MET  46           HG2      MET  46  -6.548  17.470 -11.053
    6    HG3  MET  46           HG3      MET  46  -5.207  17.948 -10.019
    7    HE3  MET  46           HE1      MET  46  -5.519  18.482 -14.169
    8    HE2  MET  46           HE2      MET  46  -6.745  19.714 -13.890
    9    HE1  MET  46           HE3      MET  46  -6.966  18.095 -13.228

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ALA  47           H        ALA  47  -2.282  14.798 -11.355
    2    HA   ALA  47           HA       ALA  47  -2.635  13.074 -13.567
    3    HB3  ALA  47           HB1      ALA  47  -0.459  13.972 -13.228
    4    HB2  ALA  47           HB2      ALA  47  -0.309  12.243 -12.899
    5    HB1  ALA  47           HB3      ALA  47  -0.397  13.392 -11.563

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU  48           H        LEU  48  -2.339  12.432 -10.096
    2    HA   LEU  48           HA       LEU  48  -2.423   9.592 -10.260
    3    HB2  LEU  48           HB2      LEU  48  -3.180  11.502  -8.037
    4    HB3  LEU  48           HB3      LEU  48  -3.078   9.752  -7.841
    5    HG   LEU  48           HG       LEU  48  -0.792  11.463  -8.850
    6   HD13  LEU  48          HD11      LEU  48  -1.063  12.227  -6.656
    7   HD12  LEU  48          HD12      LEU  48   0.107  10.924  -6.468
    8   HD11  LEU  48          HD13      LEU  48  -1.587  10.653  -6.059
    9   HD22  LEU  48          HD21      LEU  48  -0.289   9.281  -9.499
   10   HD21  LEU  48          HD22      LEU  48  -1.147   8.559  -8.139
   11   HD23  LEU  48          HD23      LEU  48   0.425   9.318  -7.888

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ASN  49           H        ASN  49  -4.894  12.074  -9.836
    2    HA   ASN  49           HA       ASN  49  -7.069  10.399  -9.286
    3    HB2  ASN  49           HB2      ASN  49  -7.151  12.811  -8.948
    4    HB3  ASN  49           HB3      ASN  49  -6.970  13.092 -10.676
    5   HD21  ASN  49          HD21      ASN  49  -9.182  11.595  -8.294
    6   HD22  ASN  49          HD22      ASN  49 -10.585  11.833  -9.217

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLU  50           H        GLU  50  -5.815  11.607 -12.379
    2    HA   GLU  50           HA       GLU  50  -7.776  10.348 -14.014
    3    HB2  GLU  50           HB2      GLU  50  -6.323  12.174 -14.835
    4    HB3  GLU  50           HB3      GLU  50  -4.924  11.108 -14.708
    5    HG2  GLU  50           HG2      GLU  50  -5.902   9.571 -16.341
    6    HG3  GLU  50           HG3      GLU  50  -7.367  10.544 -16.417

  No H/Q in entry =           6
  In of MODEL   29
    1    H    ALA  51           H        ALA  51  -4.593   9.366 -12.832
    2    HA   ALA  51           HA       ALA  51  -4.453   6.916 -14.256
    3    HB2  ALA  51           HB1      ALA  51  -2.464   6.634 -13.170
    4    HB1  ALA  51           HB2      ALA  51  -3.143   7.051 -11.597
    5    HB3  ALA  51           HB3      ALA  51  -2.700   8.326 -12.732

  No H/Q in entry =           5
  In of MODEL   29
    1    H    HIS  52           H        HIS  52  -5.608   7.737 -10.998
    2    HA   HIS  52           HA       HIS  52  -6.277   5.122 -10.167
    3    HB2  HIS  52           HB2      HIS  52  -6.139   7.033  -8.625
    4    HB3  HIS  52           HB3      HIS  52  -7.551   7.757  -9.394
    5    HD1  HIS  52           HD1      HIS  52  -9.819   6.291  -9.244
    6    HD2  HIS  52           HD2      HIS  52  -6.751   5.161  -6.660
    7    HE1  HIS  52           HE1      HIS  52 -10.879   4.827  -7.470
    8    HE2  HIS  52           HE2      HIS  52  -9.020   4.129  -5.887

  No H/Q in entry =           8
  In of MODEL   29
    1    H    LEU  53           H        LEU  53  -8.118   7.577 -11.938
    2    HA   LEU  53           HA       LEU  53 -10.619   6.276 -11.937
    3    HB2  LEU  53           HB2      LEU  53  -9.355   8.267 -13.808
    4    HB3  LEU  53           HB3      LEU  53 -10.951   7.594 -14.126
    5    HG   LEU  53           HG       LEU  53 -10.240   8.895 -11.478
    6   HD11  LEU  53          HD11      LEU  53 -11.421  10.125 -13.983
    7   HD13  LEU  53          HD12      LEU  53  -9.928  10.594 -13.170
    8   HD12  LEU  53          HD13      LEU  53 -11.484  10.885 -12.398
    9   HD21  LEU  53          HD21      LEU  53 -12.804   8.054 -12.848
   10   HD23  LEU  53          HD22      LEU  53 -12.809   9.290 -11.596
   11   HD22  LEU  53          HD23      LEU  53 -12.270   7.666 -11.218

  No H/Q in entry =          11
  In of MODEL   29
    1    H    VAL  54           H        VAL  54  -7.883   6.093 -14.192
    2    HA   VAL  54           HA       VAL  54  -9.111   4.322 -16.031
    3    HB   VAL  54           HB       VAL  54  -6.201   4.837 -15.367
    4   HG12  VAL  54          HG11      VAL  54  -5.965   3.758 -17.760
    5   HG11  VAL  54          HG12      VAL  54  -7.488   2.971 -17.348
    6   HG13  VAL  54          HG13      VAL  54  -6.065   2.719 -16.339
    7   HG22  VAL  54          HG21      VAL  54  -6.984   6.780 -16.402
    8   HG21  VAL  54          HG22      VAL  54  -8.180   5.914 -17.364
    9   HG23  VAL  54          HG23      VAL  54  -6.477   5.841 -17.806

  No H/Q in entry =           9
  In of MODEL   29
    1    H    GLN  55           H        GLN  55  -7.092   3.776 -13.146
    2    HA   GLN  55           HA       GLN  55  -6.994   0.960 -13.409
    3    HB2  GLN  55           HB2      GLN  55  -5.432   1.858 -11.898
    4    HB3  GLN  55           HB3      GLN  55  -6.646   2.819 -11.058
    5    HG2  GLN  55           HG2      GLN  55  -7.320   1.056  -9.740
    6    HG3  GLN  55           HG3      GLN  55  -7.100  -0.127 -11.022
    7   HE21  GLN  55          HE21      GLN  55  -5.469  -1.573 -10.541
    8   HE22  GLN  55          HE22      GLN  55  -4.079  -1.219  -9.637

  No H/Q in entry =           8
  In of MODEL   29
    1    H    THR  56           H        THR  56  -9.322   3.112 -11.775
    2    HA   THR  56           HA       THR  56 -10.892   1.221 -10.479
    3    HB   THR  56           HB       THR  56 -11.793   3.730 -11.925
    4    HG1  THR  56           HG1      THR  56 -10.215   3.640 -10.028
    5   HG21  THR  56          HG21      THR  56 -13.194   1.801 -10.097
    6   HG23  THR  56          HG22      THR  56 -13.785   2.553 -11.579
    7   HG22  THR  56          HG23      THR  56 -13.649   3.503 -10.099

  No H/Q in entry =           7
  In of MODEL   29
    1    H    LYS  57           H        LYS  57 -11.119   2.310 -13.861
    2    HA   LYS  57           HA       LYS  57 -13.274   0.618 -14.605
    3    HB2  LYS  57           HB2      LYS  57 -12.407   2.577 -15.921
    4    HB3  LYS  57           HB3      LYS  57 -10.973   1.635 -16.305
    5    HG2  LYS  57           HG2      LYS  57 -12.357  -0.043 -17.447
    6    HG3  LYS  57           HG3      LYS  57 -13.811   0.860 -17.041
    7    HD2  LYS  57           HD2      LYS  57 -12.974   2.787 -18.356
    8    HD3  LYS  57           HD3      LYS  57 -11.536   1.865 -18.785
    9    HE2  LYS  57           HE2      LYS  57 -12.947   0.166 -19.900
   10    HE3  LYS  57           HE3      LYS  57 -14.397   1.074 -19.473
   11    HZ1  LYS  57           HZ1      LYS  57 -12.172   2.189 -21.082
   12    HZ3  LYS  57           HZ2      LYS  57 -13.697   2.887 -20.808
   13    HZ2  LYS  57           HZ3      LYS  57 -13.559   1.482 -21.755

  No H/Q in entry =          13
  In of MODEL   29
    1    H    LEU  58           H        LEU  58  -9.768   0.198 -14.571
    2    HA   LEU  58           HA       LEU  58  -9.777  -2.317 -15.864
    3    HB2  LEU  58           HB2      LEU  58  -7.735  -1.022 -14.066
    4    HB3  LEU  58           HB3      LEU  58  -7.475  -2.541 -14.925
    5    HG   LEU  58           HG       LEU  58  -8.245   0.063 -16.279
    6   HD11  LEU  58          HD11      LEU  58  -5.591  -1.167 -15.606
    7   HD13  LEU  58          HD12      LEU  58  -6.091   0.522 -15.551
    8   HD12  LEU  58          HD13      LEU  58  -5.759  -0.245 -17.101
    9   HD22  LEU  58          HD21      LEU  58  -8.826  -1.498 -17.869
   10   HD21  LEU  58          HD22      LEU  58  -7.777  -2.743 -17.196
   11   HD23  LEU  58          HD23      LEU  58  -7.096  -1.466 -18.203

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  59           H        ILE  59 -10.581  -1.423 -12.606
    2    HA   ILE  59           HA       ILE  59 -10.215  -4.191 -11.666
    3    HB   ILE  59           HB       ILE  59  -9.769  -1.926 -10.266
    4   HG12  ILE  59          HG12      ILE  59 -11.125  -4.284  -8.940
    5   HG13  ILE  59          HG13      ILE  59  -9.484  -4.355  -9.531
    6   HG22  ILE  59          HG21      ILE  59 -12.525  -2.654  -9.316
    7   HG21  ILE  59          HG22      ILE  59 -12.307  -1.405 -10.520
    8   HG23  ILE  59          HG23      ILE  59 -11.582  -1.237  -8.924
    9   HD12  ILE  59          HD11      ILE  59 -10.541  -2.412  -7.490
   10   HD11  ILE  59          HD12      ILE  59  -8.899  -2.394  -8.121
   11   HD13  ILE  59          HD13      ILE  59  -9.461  -3.764  -7.162

  No H/Q in entry =          11
  In of MODEL   29
    1    H    GLU  60           H        GLU  60 -12.786  -1.882 -12.454
    2    HA   GLU  60           HA       GLU  60 -14.959  -3.407 -11.431
    3    HB2  GLU  60           HB2      GLU  60 -15.228  -1.053 -11.998
    4    HB3  GLU  60           HB3      GLU  60 -14.838  -1.383 -13.684
    5    HG2  GLU  60           HG2      GLU  60 -17.143  -2.794 -12.355
    6    HG3  GLU  60           HG3      GLU  60 -17.346  -1.185 -13.017

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLY  61           H        GLY  61 -13.305  -3.381 -14.556
    2    HA3  GLY  61           HA2      GLY  61 -15.015  -5.630 -15.439
    3    HA2  GLY  61           HA3      GLY  61 -14.181  -4.521 -16.521

  No H/Q in entry =           3
  In of MODEL   29
    1    H    ASP  62           H        ASP  62 -12.785  -5.969 -13.647
    2    HA   ASP  62           HA       ASP  62 -10.492  -6.876 -15.066
    3    HB2  ASP  62           HB2      ASP  62 -10.592  -6.143 -12.654
    4    HB3  ASP  62           HB3      ASP  62 -11.389  -7.669 -12.290

  No H/Q in entry =           4
  In of MODEL   29
    1    H    ALA  63           H        ALA  63 -13.560  -8.234 -14.984
    2    HA   ALA  63           HA       ALA  63 -13.232 -10.977 -14.581
    3    HB1  ALA  63           HB1      ALA  63 -14.884  -9.575 -16.717
    4    HB2  ALA  63           HB2      ALA  63 -15.411  -9.896 -15.066
    5    HB3  ALA  63           HB3      ALA  63 -15.120 -11.236 -16.178

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLY  64           H        GLY  64 -12.775  -9.110 -17.559
    2    HA3  GLY  64           HA2      GLY  64 -11.689  -9.567 -19.526
    3    HA2  GLY  64           HA3      GLY  64 -10.520 -10.409 -18.518

  No H/Q in entry =           3
  In of MODEL   29
    1    H    GLU  65           H        GLU  65 -10.176 -12.438 -19.185
    2    HA   GLU  65           HA       GLU  65 -11.552 -13.799 -21.110
    3    HB2  GLU  65           HB2      GLU  65 -10.018 -14.925 -18.769
    4    HB3  GLU  65           HB3      GLU  65 -10.576 -15.893 -20.134
    5    HG2  GLU  65           HG2      GLU  65  -9.300 -14.507 -21.688
    6    HG3  GLU  65           HG3      GLU  65  -8.796 -13.452 -20.368

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLY  66           H        GLY  66 -12.489 -16.067 -20.695
    2    HA3  GLY  66           HA2      GLY  66 -15.116 -15.795 -19.733
    3    HA2  GLY  66           HA3      GLY  66 -14.349 -17.290 -20.227

  No H/Q in entry =           3
  In of MODEL   29
    1    H    LYS  67           H        LYS  67 -12.297 -17.368 -18.322
    2    HA   LYS  67           HA       LYS  67 -13.718 -18.495 -16.120
    3    HB2  LYS  67           HB2      LYS  67 -10.781 -18.194 -16.719
    4    HB3  LYS  67           HB3      LYS  67 -11.412 -19.055 -15.309
    5    HG2  LYS  67           HG2      LYS  67 -12.747 -20.512 -16.793
    6    HG3  LYS  67           HG3      LYS  67 -12.107 -19.662 -18.200
    7    HD2  LYS  67           HD2      LYS  67  -9.825 -20.380 -17.603
    8    HD3  LYS  67           HD3      LYS  67 -10.461 -21.227 -16.192
    9    HE2  LYS  67           HE2      LYS  67 -11.836 -22.658 -17.651
   10    HE3  LYS  67           HE3      LYS  67 -11.229 -21.803 -19.069
   11    HZ3  LYS  67           HZ1      LYS  67  -9.309 -22.912 -19.009
   12    HZ2  LYS  67           HZ2      LYS  67 -10.124 -24.019 -18.011
   13    HZ1  LYS  67           HZ3      LYS  67  -9.165 -22.797 -17.323

  No H/Q in entry =          13
  In of MODEL   29
    1    H    MET  68           H        MET  68 -13.616 -18.061 -13.979
    2    HA   MET  68           HA       MET  68 -14.056 -15.508 -13.088
    3    HB2  MET  68           HB2      MET  68 -13.076 -17.939 -11.600
    4    HB3  MET  68           HB3      MET  68 -13.585 -16.453 -10.798
    5    HG2  MET  68           HG2      MET  68 -15.798 -16.621 -11.847
    6    HG3  MET  68           HG3      MET  68 -15.294 -18.079 -12.704
    7    HE2  MET  68           HE1      MET  68 -16.251 -17.415  -8.323
    8    HE1  MET  68           HE2      MET  68 -15.922 -16.247  -9.600
    9    HE3  MET  68           HE3      MET  68 -14.581 -17.037  -8.775

  No H/Q in entry =           9
  In of MODEL   29
    1    H    LYS  69           H        LYS  69 -11.048 -16.469 -14.158
    2    HA   LYS  69           HA       LYS  69  -9.334 -15.416 -12.184
    3    HB2  LYS  69           HB2      LYS  69  -8.934 -15.938 -15.128
    4    HB3  LYS  69           HB3      LYS  69  -7.631 -15.415 -14.058
    5    HG2  LYS  69           HG2      LYS  69  -8.044 -17.363 -12.597
    6    HG3  LYS  69           HG3      LYS  69  -9.351 -17.884 -13.659
    7    HD2  LYS  69           HD2      LYS  69  -7.759 -18.141 -15.517
    8    HD3  LYS  69           HD3      LYS  69  -6.444 -17.596 -14.473
    9    HE2  LYS  69           HE2      LYS  69  -6.841 -19.504 -12.963
   10    HE3  LYS  69           HE3      LYS  69  -8.160 -20.051 -13.996
   11    HZ2  LYS  69           HZ1      LYS  69  -5.272 -20.108 -14.479
   12    HZ1  LYS  69           HZ2      LYS  69  -6.305 -19.916 -15.813
   13    HZ3  LYS  69           HZ3      LYS  69  -6.446 -21.284 -14.815

  No H/Q in entry =          13
  In of MODEL   29
    1    H    VAL  70           H        VAL  70  -7.814 -13.595 -12.355
    2    HA   VAL  70           HA       VAL  70  -9.067 -11.186 -13.553
    3    HB   VAL  70           HB       VAL  70  -8.018  -9.952 -11.649
    4   HG12  VAL  70          HG11      VAL  70  -9.634 -10.847  -9.921
    5   HG11  VAL  70          HG12      VAL  70  -9.975 -12.178 -11.026
    6   HG13  VAL  70          HG13      VAL  70 -10.362 -10.523 -11.494
    7   HG23  VAL  70          HG21      VAL  70  -7.555 -12.709 -10.458
    8   HG22  VAL  70          HG22      VAL  70  -7.096 -11.154  -9.768
    9   HG21  VAL  70          HG23      VAL  70  -6.273 -11.757 -11.205

  No H/Q in entry =           9
  In of MODEL   29
    1    H    SER  71           H        SER  71  -7.583  -9.513 -14.191
    2    HA   SER  71           HA       SER  71  -5.316 -10.450 -15.644
    3    HB2  SER  71           HB2      SER  71  -6.693  -8.442 -16.266
    4    HB3  SER  71           HB3      SER  71  -5.997  -7.600 -14.884
    5    HG   SER  71           HG       SER  71  -4.528  -8.797 -17.002

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU  72           H        LEU  72  -3.326 -10.780 -14.962
    2    HA   LEU  72           HA       LEU  72  -2.590 -10.567 -12.254
    3    HB2  LEU  72           HB2      LEU  72  -0.951 -10.989 -14.749
    4    HB3  LEU  72           HB3      LEU  72  -0.277 -11.060 -13.124
    5    HG   LEU  72           HG       LEU  72  -2.637 -12.756 -13.996
    6   HD12  LEU  72          HD11      LEU  72  -1.003 -14.597 -14.238
    7   HD11  LEU  72          HD12      LEU  72   0.311 -13.466 -13.922
    8   HD13  LEU  72          HD13      LEU  72  -0.668 -13.294 -15.379
    9   HD23  LEU  72          HD21      LEU  72  -1.614 -14.175 -12.053
   10   HD22  LEU  72          HD22      LEU  72  -2.566 -12.764 -11.622
   11   HD21  LEU  72          HD23      LEU  72  -0.808 -12.680 -11.592

  No H/Q in entry =          11
  In of MODEL   29
    1    H    VAL  73           H        VAL  73  -1.895  -8.545 -15.036
    2    HA   VAL  73           HA       VAL  73   0.028  -6.843 -13.942
    3    HB   VAL  73           HB       VAL  73  -0.379  -5.425 -15.796
    4   HG11  VAL  73          HG11      VAL  73   0.416  -7.806 -16.239
    5   HG13  VAL  73          HG12      VAL  73  -0.294  -6.972 -17.619
    6   HG12  VAL  73          HG13      VAL  73  -1.235  -8.170 -16.733
    7   HG22  VAL  73          HG21      VAL  73  -2.642  -4.898 -15.820
    8   HG21  VAL  73          HG22      VAL  73  -3.140  -6.576 -15.607
    9   HG23  VAL  73          HG23      VAL  73  -2.560  -6.021 -17.179

  No H/Q in entry =           9
  In of MODEL   29
    1    H    LEU  74           H        LEU  74  -3.366  -6.968 -13.364
    2    HA   LEU  74           HA       LEU  74  -3.987  -4.314 -12.745
    3    HB2  LEU  74           HB2      LEU  74  -5.708  -5.995 -12.913
    4    HB3  LEU  74           HB3      LEU  74  -5.012  -6.902 -11.573
    5    HG   LEU  74           HG       LEU  74  -5.441  -4.930 -10.083
    6   HD11  LEU  74          HD11      LEU  74  -6.620  -3.897 -12.659
    7   HD13  LEU  74          HD12      LEU  74  -5.545  -3.070 -11.533
    8   HD12  LEU  74          HD13      LEU  74  -7.234  -3.344 -11.101
    9   HD23  LEU  74          HD21      LEU  74  -7.996  -5.701 -11.433
   10   HD22  LEU  74          HD22      LEU  74  -7.625  -5.550  -9.730
   11   HD21  LEU  74          HD23      LEU  74  -7.028  -6.927 -10.622

  No H/Q in entry =          11
  In of MODEL   29
    1    H    VAL  75           H        VAL  75  -2.927  -6.901 -10.593
    2    HA   VAL  75           HA       VAL  75  -2.718  -5.352  -8.248
    3    HB   VAL  75           HB       VAL  75  -1.229  -7.846  -9.054
    4   HG13  VAL  75          HG11      VAL  75   0.063  -6.634  -7.341
    5   HG12  VAL  75          HG12      VAL  75  -0.758  -7.993  -6.587
    6   HG11  VAL  75          HG13      VAL  75  -1.399  -6.370  -6.396
    7   HG21  VAL  75          HG21      VAL  75  -3.717  -7.988  -8.822
    8   HG23  VAL  75          HG22      VAL  75  -3.574  -7.351  -7.183
    9   HG22  VAL  75          HG23      VAL  75  -2.875  -8.921  -7.584

  No H/Q in entry =           9
  In of MODEL   29
    1    H    GLU  76           H        GLU  76  -0.323  -6.104 -10.800
    2    HA   GLU  76           HA       GLU  76   1.867  -4.753  -9.653
    3    HB2  GLU  76           HB2      GLU  76   2.059  -6.227 -11.640
    4    HB3  GLU  76           HB3      GLU  76   1.143  -5.067 -12.589
    5    HG2  GLU  76           HG2      GLU  76   3.477  -4.728 -13.096
    6    HG3  GLU  76           HG3      GLU  76   2.962  -3.360 -12.129

  No H/Q in entry =           6
  In of MODEL   29
    1    H    ALA  77           H        ALA  77  -0.681  -3.555 -11.826
    2    HA   ALA  77           HA       ALA  77   0.302  -0.906 -12.004
    3    HB3  ALA  77           HB1      ALA  77  -2.633  -1.555 -12.115
    4    HB1  ALA  77           HB2      ALA  77  -1.548  -2.116 -13.389
    5    HB2  ALA  77           HB3      ALA  77  -1.715  -0.389 -13.071

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLN  78           H        GLN  78  -1.949  -2.470  -9.782
    2    HA   GLN  78           HA       GLN  78  -2.754  -0.155  -8.373
    3    HB2  GLN  78           HB2      GLN  78  -3.857  -2.418  -8.285
    4    HB3  GLN  78           HB3      GLN  78  -2.515  -2.976  -7.291
    5    HG2  GLN  78           HG2      GLN  78  -3.026  -1.242  -5.621
    6    HG3  GLN  78           HG3      GLN  78  -4.370  -0.678  -6.613
    7   HE21  GLN  78          HE21      GLN  78  -4.782  -1.680  -3.944
    8   HE22  GLN  78          HE22      GLN  78  -5.657  -3.130  -4.060

  No H/Q in entry =           8
  In of MODEL   29
    1    H    LEU  79           H        LEU  79  -0.067  -2.404  -7.941
    2    HA   LEU  79           HA       LEU  79   0.921  -1.508  -5.488
    3    HB2  LEU  79           HB2      LEU  79   1.790  -3.513  -6.564
    4    HB3  LEU  79           HB3      LEU  79   2.426  -2.557  -7.899
    5    HG   LEU  79           HG       LEU  79   3.987  -1.415  -6.403
    6   HD13  LEU  79          HD11      LEU  79   2.993  -1.176  -4.330
    7   HD12  LEU  79          HD12      LEU  79   4.078  -2.522  -3.994
    8   HD11  LEU  79          HD13      LEU  79   2.372  -2.827  -4.314
    9   HD23  LEU  79          HD21      LEU  79   5.209  -3.561  -5.510
   10   HD22  LEU  79          HD22      LEU  79   4.996  -3.360  -7.246
   11   HD21  LEU  79          HD23      LEU  79   3.926  -4.434  -6.349

  No H/Q in entry =          11
  In of MODEL   29
    1    H    HIS  80           H        HIS  80   1.769  -0.384  -8.764
    2    HA   HIS  80           HA       HIS  80   3.575   1.609  -7.850
    3    HB2  HIS  80           HB2      HIS  80   2.273   0.913 -10.426
    4    HB3  HIS  80           HB3      HIS  80   2.863   2.567 -10.257
    5    HD1  HIS  80           HD1      HIS  80   5.260   2.877 -10.792
    6    HD2  HIS  80           HD2      HIS  80   4.462  -1.039  -9.601
    7    HE1  HIS  80           HE1      HIS  80   7.454   1.608 -10.972
    8    HE2  HIS  80           HE2      HIS  80   6.978  -0.782 -10.249

  No H/Q in entry =           8
  In of MODEL   29
    1    H    LEU  81           H        LEU  81   0.165   1.757  -8.810
    2    HA   LEU  81           HA       LEU  81  -0.120   4.548  -8.474
    3    HB2  LEU  81           HB2      LEU  81  -2.125   2.295  -8.387
    4    HB3  LEU  81           HB3      LEU  81  -2.583   3.996  -8.290
    5    HG   LEU  81           HG       LEU  81  -0.898   2.856 -10.537
    6   HD12  LEU  81          HD11      LEU  81  -3.139   3.168 -11.823
    7   HD11  LEU  81          HD12      LEU  81  -3.885   3.094 -10.228
    8   HD13  LEU  81          HD13      LEU  81  -2.940   1.731 -10.822
    9   HD23  LEU  81          HD21      LEU  81  -2.010   4.997 -11.625
   10   HD22  LEU  81          HD22      LEU  81  -0.589   5.172 -10.600
   11   HD21  LEU  81          HD23      LEU  81  -2.191   5.513  -9.950

  No H/Q in entry =          11
  In of MODEL   29
    1    H    MET  82           H        MET  82  -0.755   1.855  -6.226
    2    HA   MET  82           HA       MET  82  -1.802   3.434  -4.131
    3    HB2  MET  82           HB2      MET  82  -0.417   0.753  -4.181
    4    HB3  MET  82           HB3      MET  82  -0.991   1.474  -2.679
    5    HG2  MET  82           HG2      MET  82  -2.735   0.976  -5.112
    6    HG3  MET  82           HG3      MET  82  -2.644  -0.100  -3.718
    7    HE3  MET  82           HE1      MET  82  -4.358   1.538  -0.891
    8    HE2  MET  82           HE2      MET  82  -2.631   1.824  -1.085
    9    HE1  MET  82           HE3      MET  82  -3.314   0.264  -1.538

  No H/Q in entry =           9
  In of MODEL   29
    1    H    THR  83           H        THR  83   1.499   2.365  -4.840
    2    HA   THR  83           HA       THR  83   2.724   3.471  -2.544
    3    HB   THR  83           HB       THR  83   4.811   3.427  -4.030
    4    HG1  THR  83           HG1      THR  83   4.563   2.903  -6.053
    5   HG22  THR  83          HG21      THR  83   4.378   0.768  -4.363
    6   HG21  THR  83          HG22      THR  83   3.093   1.140  -3.215
    7   HG23  THR  83          HG23      THR  83   4.773   1.490  -2.804

  No H/Q in entry =           7
  In of MODEL   29
    1    H    SER  84           H        SER  84   2.330   4.753  -5.840
    2    HA   SER  84           HA       SER  84   3.660   7.199  -5.389
    3    HB2  SER  84           HB2      SER  84   1.583   6.360  -7.398
    4    HB3  SER  84           HB3      SER  84   2.254   7.991  -7.374
    5    HG   SER  84           HG       SER  84   3.636   5.522  -7.677

  No H/Q in entry =           5
  In of MODEL   29
    1    H    MET  85           H        MET  85   0.171   6.426  -5.199
    2    HA   MET  85           HA       MET  85  -0.699   9.032  -4.590
    3    HB2  MET  85           HB2      MET  85  -2.218   7.220  -5.253
    4    HB3  MET  85           HB3      MET  85  -1.915   6.409  -3.717
    5    HG2  MET  85           HG2      MET  85  -2.816   8.345  -2.497
    6    HG3  MET  85           HG3      MET  85  -3.077   9.194  -4.020
    7    HE2  MET  85           HE1      MET  85  -5.284   5.675  -2.202
    8    HE1  MET  85           HE2      MET  85  -3.657   6.266  -1.874
    9    HE3  MET  85           HE3      MET  85  -3.936   5.186  -3.237

  No H/Q in entry =           9
  In of MODEL   29
    1    H    LEU  86           H        LEU  86   0.244   6.370  -2.455
    2    HA   LEU  86           HA       LEU  86  -0.281   7.667  -0.008
    3    HB2  LEU  86           HB2      LEU  86   0.190   5.199  -0.408
    4    HB3  LEU  86           HB3      LEU  86   1.895   5.635  -0.512
    5    HG   LEU  86           HG       LEU  86   1.578   6.791   1.760
    6   HD11  LEU  86          HD11      LEU  86  -1.115   6.015   1.302
    7   HD13  LEU  86          HD12      LEU  86  -0.444   6.763   2.750
    8   HD12  LEU  86          HD13      LEU  86  -0.529   5.007   2.628
    9   HD23  LEU  86          HD21      LEU  86   1.162   3.797   1.879
   10   HD22  LEU  86          HD22      LEU  86   2.166   4.809   2.915
   11   HD21  LEU  86          HD23      LEU  86   2.659   4.489   1.253

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ALA  87           H        ALA  87   2.690   7.387  -1.915
    2    HA   ALA  87           HA       ALA  87   4.400   8.800  -0.197
    3    HB3  ALA  87           HB1      ALA  87   4.484   7.792  -2.906
    4    HB2  ALA  87           HB2      ALA  87   5.823   8.125  -1.812
    5    HB1  ALA  87           HB3      ALA  87   5.199   9.405  -2.851

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ARG  88           H        ARG  88   2.434   9.934  -2.904
    2    HA   ARG  88           HA       ARG  88   3.201  12.626  -2.787
    3    HB2  ARG  88           HB2      ARG  88   1.940  11.473  -4.639
    4    HB3  ARG  88           HB3      ARG  88   0.488  11.610  -3.648
    5    HG2  ARG  88           HG2      ARG  88   1.500  14.193  -3.565
    6    HG3  ARG  88           HG3      ARG  88   1.917  13.683  -5.199
    7    HD2  ARG  88           HD2      ARG  88  -0.229  13.759  -5.885
    8    HD3  ARG  88           HD3      ARG  88  -0.805  12.902  -4.455
    9    HE   ARG  88           HE       ARG  88  -1.004  15.680  -4.866
   10   HH21  ARG  88          HH11      ARG  88  -1.525  17.005  -3.123
   11   HH22  ARG  88          HH12      ARG  88  -1.218  16.465  -1.508
   12   HH11  ARG  88          HH21      ARG  88   0.031  13.415  -2.502
   13   HH12  ARG  88          HH22      ARG  88  -0.355  14.427  -1.157

  No H/Q in entry =          13
  In of MODEL   29
    1    H    GLU  89           H        GLU  89   0.511  10.942  -1.135
    2    HA   GLU  89           HA       GLU  89  -0.595  13.249   0.081
    3    HB2  GLU  89           HB2      GLU  89  -1.708  11.007  -0.003
    4    HB3  GLU  89           HB3      GLU  89  -0.576  10.452   1.230
    5    HG2  GLU  89           HG2      GLU  89  -1.390  12.146   2.797
    6    HG3  GLU  89           HG3      GLU  89  -2.451  12.817   1.561

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LEU  90           H        LEU  90   1.868  10.960   1.237
    2    HA   LEU  90           HA       LEU  90   2.236  12.200   3.766
    3    HB2  LEU  90           HB2      LEU  90   4.003  10.432   2.075
    4    HB3  LEU  90           HB3      LEU  90   4.431  10.946   3.713
    5    HG   LEU  90           HG       LEU  90   1.795   9.597   3.064
    6   HD12  LEU  90          HD11      LEU  90   2.944   7.552   4.062
    7   HD11  LEU  90          HD12      LEU  90   4.464   8.411   3.813
    8   HD13  LEU  90          HD13      LEU  90   3.444   8.004   2.431
    9   HD22  LEU  90          HD21      LEU  90   1.541  10.516   5.189
   10   HD21  LEU  90          HD22      LEU  90   3.261  10.411   5.561
   11   HD23  LEU  90          HD23      LEU  90   2.258   8.962   5.613

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  91           H        ILE  91   3.821  12.591   0.631
    2    HA   ILE  91           HA       ILE  91   5.800  14.424   1.462
    3    HB   ILE  91           HB       ILE  91   4.473  13.937  -1.211
    4   HG12  ILE  91          HG12      ILE  91   7.312  13.451  -0.254
    5   HG13  ILE  91          HG13      ILE  91   6.033  12.252  -0.087
    6   HG22  ILE  91          HG21      ILE  91   6.690  15.288  -1.910
    7   HG21  ILE  91          HG22      ILE  91   6.388  16.085  -0.365
    8   HG23  ILE  91          HG23      ILE  91   5.158  16.115  -1.627
    9   HD13  ILE  91          HD11      ILE  91   5.847  11.933  -2.393
   10   HD12  ILE  91          HD12      ILE  91   7.582  12.177  -2.189
   11   HD11  ILE  91          HD13      ILE  91   6.566  13.500  -2.767

  No H/Q in entry =          11
  In of MODEL   29
    1    H    THR  92           H        THR  92   2.432  14.854   0.475
    2    HA   THR  92           HA       THR  92   2.402  17.678   0.421
    3    HB   THR  92           HB       THR  92   0.241  15.679   1.129
    4    HG1  THR  92           HG1      THR  92   0.533  15.505  -0.958
    5   HG22  THR  92          HG21      THR  92  -1.167  17.841   0.419
    6   HG21  THR  92          HG22      THR  92   0.229  18.666   1.110
    7   HG23  THR  92          HG23      THR  92  -0.705  17.542   2.095

  No H/Q in entry =           7
  In of MODEL   29
    1    H    GLU  93           H        GLU  93   1.872  15.371   3.073
    2    HA   GLU  93           HA       GLU  93   1.350  17.270   5.099
    3    HB2  GLU  93           HB2      GLU  93   2.667  14.546   5.321
    4    HB3  GLU  93           HB3      GLU  93   1.983  15.470   6.660
    5    HG2  GLU  93           HG2      GLU  93   0.357  14.696   4.229
    6    HG3  GLU  93           HG3      GLU  93   0.468  13.670   5.655

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LEU  94           H        LEU  94   4.351  15.794   3.928
    2    HA   LEU  94           HA       LEU  94   6.111  16.939   5.808
    3    HB2  LEU  94           HB2      LEU  94   6.497  15.978   2.973
    4    HB3  LEU  94           HB3      LEU  94   7.832  16.635   3.916
    5    HG   LEU  94           HG       LEU  94   6.101  14.435   5.057
    6   HD11  LEU  94          HD11      LEU  94   8.184  14.215   2.912
    7   HD13  LEU  94          HD12      LEU  94   6.740  13.240   3.180
    8   HD12  LEU  94          HD13      LEU  94   8.172  12.986   4.179
    9   HD23  LEU  94          HD21      LEU  94   8.298  13.898   6.195
   10   HD22  LEU  94          HD22      LEU  94   7.632  15.475   6.619
   11   HD21  LEU  94          HD23      LEU  94   8.964  15.358   5.468

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  95           H        ILE  95   4.953  18.116   2.667
    2    HA   ILE  95           HA       ILE  95   6.522  20.475   2.604
    3    HB   ILE  95           HB       ILE  95   3.871  19.791   1.312
    4   HG12  ILE  95          HG12      ILE  95   6.653  20.133   0.160
    5   HG13  ILE  95          HG13      ILE  95   6.008  18.579   0.675
    6   HG21  ILE  95          HG21      ILE  95   5.617  22.261   1.087
    7   HG23  ILE  95          HG22      ILE  95   3.894  22.191   1.453
    8   HG22  ILE  95          HG23      ILE  95   4.468  21.794  -0.167
    9   HD13  ILE  95          HD11      ILE  95   4.438  18.505  -1.045
   10   HD12  ILE  95          HD12      ILE  95   5.782  19.326  -1.839
   11   HD11  ILE  95          HD13      ILE  95   4.412  20.258  -1.237

  No H/Q in entry =          11
  In of MODEL   29
    1    H    GLU  96           H        GLU  96   3.282  19.817   3.916
    2    HA   GLU  96           HA       GLU  96   2.664  22.462   4.677
    3    HB2  GLU  96           HB2      GLU  96   0.991  20.678   4.695
    4    HB3  GLU  96           HB3      GLU  96   1.861  19.849   5.983
    5    HG2  GLU  96           HG2      GLU  96   0.848  21.128   7.561
    6    HG3  GLU  96           HG3      GLU  96   1.378  22.604   6.764

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LEU  97           H        LEU  97   4.518  19.910   6.286
    2    HA   LEU  97           HA       LEU  97   4.889  21.253   8.757
    3    HB2  LEU  97           HB2      LEU  97   6.419  19.088   7.329
    4    HB3  LEU  97           HB3      LEU  97   7.017  19.770   8.839
    5    HG   LEU  97           HG       LEU  97   4.207  18.676   8.543
    6   HD12  LEU  97          HD11      LEU  97   5.155  16.661   9.746
    7   HD11  LEU  97          HD12      LEU  97   6.764  17.294   9.394
    8   HD13  LEU  97          HD13      LEU  97   5.686  16.838   8.073
    9   HD23  LEU  97          HD21      LEU  97   4.675  18.376  11.104
   10   HD22  LEU  97          HD22      LEU  97   4.290  19.989  10.505
   11   HD21  LEU  97          HD23      LEU  97   5.964  19.549  10.839

  No H/Q in entry =          11
  In of MODEL   29
    1    H    HIS  98           H        HIS  98   6.742  21.276   5.721
    2    HA   HIS  98           HA       HIS  98   8.900  22.855   6.611
    3    HB2  HIS  98           HB2      HIS  98   7.591  22.605   3.892
    4    HB3  HIS  98           HB3      HIS  98   9.033  23.583   4.176
    5    HD1  HIS  98           HD1      HIS  98   7.822  20.012   4.195
    6    HD2  HIS  98           HD2      HIS  98  11.405  22.108   4.604
    7    HE1  HIS  98           HE1      HIS  98   9.677  18.283   4.124
    8    HE2  HIS  98           HE2      HIS  98  11.863  19.539   4.373

  No H/Q in entry =           8
  In of MODEL   29
    1    H    GLU  99           H        GLU  99   5.672  23.691   5.456
    2    HA   GLU  99           HA       GLU  99   6.051  26.506   5.402
    3    HB2  GLU  99           HB2      GLU  99   4.165  25.339   4.279
    4    HB3  GLU  99           HB3      GLU  99   3.478  24.975   5.862
    5    HG2  GLU  99           HG2      GLU  99   3.301  27.366   6.369
    6    HG3  GLU  99           HG3      GLU  99   4.068  27.769   4.836

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LYS 100           H        LYS 100   4.935  24.266   7.925
    2    HA   LYS 100           HA       LYS 100   4.360  26.316   9.827
    3    HB2  LYS 100           HB2      LYS 100   4.937  23.364  10.163
    4    HB3  LYS 100           HB3      LYS 100   4.497  24.434  11.500
    5    HG2  LYS 100           HG2      LYS 100   2.424  25.074  10.266
    6    HG3  LYS 100           HG3      LYS 100   2.844  23.908   9.008
    7    HD2  LYS 100           HD2      LYS 100   2.775  22.084  10.666
    8    HD3  LYS 100           HD3      LYS 100   2.373  23.244  11.934
    9    HE2  LYS 100           HE2      LYS 100   0.313  23.868  10.685
   10    HE3  LYS 100           HE3      LYS 100   0.705  22.651   9.464
   11    HZ1  LYS 100           HZ1      LYS 100   0.456  21.978  12.345
   12    HZ3  LYS 100           HZ2      LYS 100   0.433  20.927  11.008
   13    HZ2  LYS 100           HZ3      LYS 100  -0.881  21.966  11.298

  No H/Q in entry =          13
  In of MODEL   29
    1    H    LEU 101           H        LEU 101   7.278  24.522   8.972
    2    HA   LEU 101           HA       LEU 101   8.889  25.356  11.168
    3    HB2  LEU 101           HB2      LEU 101   9.467  24.375   8.385
    4    HB3  LEU 101           HB3      LEU 101  10.775  25.038   9.360
    5    HG   LEU 101           HG       LEU 101   8.949  22.880  10.430
    6   HD12  LEU 101          HD11      LEU 101  10.999  21.386   9.806
    7   HD11  LEU 101          HD12      LEU 101  11.359  22.651   8.634
    8   HD13  LEU 101          HD13      LEU 101   9.830  21.779   8.547
    9   HD21  LEU 101          HD21      LEU 101  11.677  23.986  11.144
   10   HD23  LEU 101          HD22      LEU 101  11.137  22.412  11.723
   11   HD22  LEU 101          HD23      LEU 101  10.248  23.868  12.170

  No H/Q in entry =          11
  In of MODEL   29
    1    H    LYS 102           H        LYS 102   7.294  27.225   9.041
    2    HA   LYS 102           HA       LYS 102   7.371  29.519   8.753
    3    HB2  LYS 102           HB2      LYS 102   8.948  29.398  10.842
    4    HB3  LYS 102           HB3      LYS 102  10.241  29.594   9.676
    5    HG2  LYS 102           HG2      LYS 102   8.141  31.547  10.554
    6    HG3  LYS 102           HG3      LYS 102   9.853  31.806  10.293
    7    HD2  LYS 102           HD2      LYS 102   7.888  31.389   8.004
    8    HD3  LYS 102           HD3      LYS 102   8.276  32.967   8.673
    9    HE2  LYS 102           HE2      LYS 102   9.636  31.786   6.589
   10    HE3  LYS 102           HE3      LYS 102  10.259  33.090   7.600
   11    HZ2  LYS 102           HZ1      LYS 102  11.777  31.185   7.412
   12    HZ1  LYS 102           HZ2      LYS 102  10.619  30.202   8.159
   13    HZ3  LYS 102           HZ3      LYS 102  11.317  31.487   9.016

  No H/Q in entry =          13
  In of MODEL   29
    1    H    ALA 103           H        ALA 103  10.624  28.179   8.167
    2    HA   ALA 103           HA       ALA 103  11.577  29.559   6.088
    3    HB2  ALA 103           HB1      ALA 103  12.455  27.347   5.151
    4    HB1  ALA 103           HB2      ALA 103  11.567  26.570   6.460
    5    HB3  ALA 103           HB3      ALA 103  12.860  27.713   6.828

  No H/Q in entry =           5
  In of MODEL   29
    1    H1   LYS   3           H1       LYS   3 -31.138   5.844 -19.917
    2    H2   LYS   3           H3       LYS   3 -30.130   5.555 -21.253
    3    H3   LYS   3           H2       LYS   3 -31.512   4.599 -21.010
    4    HA   LYS   3           HA       LYS   3 -30.505   3.244 -19.578
    5    HB2  LYS   3           HB2      LYS   3 -28.230   4.675 -20.900
    6    HB3  LYS   3           HB3      LYS   3 -27.901   3.487 -19.639
    7    HG2  LYS   3           HG2      LYS   3 -29.283   1.862 -20.987
    8    HG3  LYS   3           HG3      LYS   3 -29.241   3.048 -22.291
    9    HD2  LYS   3           HD2      LYS   3 -26.757   2.974 -22.210
   10    HD3  LYS   3           HD3      LYS   3 -26.870   1.688 -21.010
   11    HE2  LYS   3           HE2      LYS   3 -28.330   0.469 -22.729
   12    HE3  LYS   3           HE3      LYS   3 -27.714   1.643 -23.891
   13    HZ3  LYS   3           HZ1      LYS   3 -25.895   0.439 -24.125
   14    HZ2  LYS   3           HZ2      LYS   3 -26.519  -0.726 -23.059
   15    HZ1  LYS   3           HZ3      LYS   3 -25.556   0.540 -22.464

  No H/Q in entry =          15
  In of MODEL   29
    1    H    LYS   4           H        LYS   4 -30.580   3.125 -17.516
    2    HA   LYS   4           HA       LYS   4 -29.904   5.441 -15.885
    3    HB2  LYS   4           HB2      LYS   4 -31.073   2.740 -15.166
    4    HB3  LYS   4           HB3      LYS   4 -30.885   4.095 -14.055
    5    HG2  LYS   4           HG2      LYS   4 -32.663   3.977 -16.496
    6    HG3  LYS   4           HG3      LYS   4 -33.173   4.040 -14.810
    7    HD2  LYS   4           HD2      LYS   4 -32.513   6.276 -14.562
    8    HD3  LYS   4           HD3      LYS   4 -31.457   6.216 -15.973
    9    HE2  LYS   4           HE2      LYS   4 -33.397   7.556 -16.474
   10    HE3  LYS   4           HE3      LYS   4 -33.444   6.071 -17.424
   11    HZ3  LYS   4           HZ1      LYS   4 -35.024   5.155 -15.885
   12    HZ2  LYS   4           HZ2      LYS   4 -35.594   6.636 -16.494
   13    HZ1  LYS   4           HZ3      LYS   4 -34.954   6.552 -14.923

  No H/Q in entry =          13
  In of MODEL   29
    1    H    HIS   5           H        HIS   5 -28.455   5.567 -14.277
    2    HA   HIS   5           HA       HIS   5 -26.144   3.766 -14.560
    3    HB2  HIS   5           HB2      HIS   5 -26.450   6.531 -13.390
    4    HB3  HIS   5           HB3      HIS   5 -24.956   5.596 -13.345
    5    HD1  HIS   5           HD1      HIS   5 -23.484   6.797 -14.931
    6    HD2  HIS   5           HD2      HIS   5 -27.258   6.107 -16.522
    7    HE1  HIS   5           HE1      HIS   5 -23.295   7.350 -17.387
    8    HE2  HIS   5           HE2      HIS   5 -25.596   6.917 -18.325

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ILE   6           H        ILE   6 -25.910   2.212 -13.222
    2    HA   ILE   6           HA       ILE   6 -26.921   2.500 -10.473
    3    HB   ILE   6           HB       ILE   6 -26.047   0.025 -11.970
    4   HG12  ILE   6          HG12      ILE   6 -28.812   0.937 -11.163
    5   HG13  ILE   6          HG13      ILE   6 -28.152   1.087 -12.791
    6   HG23  ILE   6          HG21      ILE   6 -26.426  -1.209 -10.100
    7   HG22  ILE   6          HG22      ILE   6 -27.606  -0.070  -9.448
    8   HG21  ILE   6          HG23      ILE   6 -25.882   0.290  -9.343
    9   HD13  ILE   6          HD11      ILE   6 -28.579  -1.042 -13.272
   10   HD12  ILE   6          HD12      ILE   6 -29.611  -1.022 -11.842
   11   HD11  ILE   6          HD13      ILE   6 -27.951  -1.608 -11.722

  No H/Q in entry =          11
  In of MODEL   29
    1    H    TYR   7           H        TYR   7 -25.186   3.178  -9.174
    2    HA   TYR   7           HA       TYR   7 -22.455   2.247  -9.810
    3    HB2  TYR   7           HB2      TYR   7 -23.465   4.687  -8.370
    4    HB3  TYR   7           HB3      TYR   7 -21.775   4.192  -8.383
    5    HD1  TYR   7           HD1      TYR   7 -22.766   3.200 -11.474
    6    HD2  TYR   7           HD2      TYR   7 -22.166   6.806  -9.283
    7    HE1  TYR   7           HE1      TYR   7 -22.325   4.410 -13.574
    8    HE2  TYR   7           HE2      TYR   7 -21.767   8.021 -11.377
    9    HH   TYR   7           HH       TYR   7 -21.958   7.905 -13.609

  No H/Q in entry =           9
  In of MODEL   29
    1    H    LEU   8           H        LEU   8 -21.489   0.923  -8.454
    2    HA   LEU   8           HA       LEU   8 -22.644   0.447  -5.778
    3    HB2  LEU   8           HB2      LEU   8 -20.900  -1.217  -7.572
    4    HB3  LEU   8           HB3      LEU   8 -21.101  -1.581  -5.858
    5    HG   LEU   8           HG       LEU   8 -23.574  -1.789  -6.307
    6   HD13  LEU   8          HD11      LEU   8 -23.695  -0.599  -8.432
    7   HD12  LEU   8          HD12      LEU   8 -24.201  -2.273  -8.659
    8   HD11  LEU   8          HD13      LEU   8 -22.594  -1.762  -9.171
    9   HD23  LEU   8          HD21      LEU   8 -22.256  -3.834  -7.961
   10   HD22  LEU   8          HD22      LEU   8 -23.356  -3.998  -6.593
   11   HD21  LEU   8          HD23      LEU   8 -21.657  -3.622  -6.316

  No H/Q in entry =          11
  In of MODEL   29
    1    H    PHE   9           H        PHE   9 -21.400   0.889  -3.985
    2    HA   PHE   9           HA       PHE   9 -18.622   1.853  -4.481
    3    HB2  PHE   9           HB2      PHE   9 -20.689   2.917  -2.565
    4    HB3  PHE   9           HB3      PHE   9 -18.984   3.336  -2.483
    5    HD1  PHE   9           HD1      PHE   9 -17.917   4.638  -4.260
    6    HD2  PHE   9           HD2      PHE   9 -22.114   3.752  -4.366
    7    HE1  PHE   9           HE1      PHE   9 -18.232   6.335  -6.037
    8    HE2  PHE   9           HE2      PHE   9 -22.429   5.462  -6.136
    9    HZ   PHE   9           HZ       PHE   9 -20.486   6.749  -6.977

  No H/Q in entry =           9
  In of MODEL   29
    1    H    SER  10           H        SER  10 -17.022   0.934  -3.346
    2    HA   SER  10           HA       SER  10 -17.238   0.052  -0.652
    3    HB2  SER  10           HB2      SER  10 -17.165  -2.293  -0.887
    4    HB3  SER  10           HB3      SER  10 -18.434  -1.782  -1.989
    5    HG   SER  10           HG       SER  10 -15.780  -2.552  -2.549

  No H/Q in entry =           5
  In of MODEL   29
    1    H    SER  11           H        SER  11 -15.232   0.185   0.189
    2    HA   SER  11           HA       SER  11 -13.040   1.028  -1.348
    3    HB2  SER  11           HB2      SER  11 -13.578   1.125   1.250
    4    HB3  SER  11           HB3      SER  11 -12.539  -0.302   1.260
    5    HG   SER  11           HG       SER  11 -10.982   0.963   0.126

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA  12           H        ALA  12 -14.216  -1.675  -2.110
    2    HA   ALA  12           HA       ALA  12 -11.627  -2.927  -2.586
    3    HB2  ALA  12           HB1      ALA  12 -12.603  -5.199  -1.955
    4    HB1  ALA  12           HB2      ALA  12 -13.861  -4.309  -1.100
    5    HB3  ALA  12           HB3      ALA  12 -12.174  -4.129  -0.618

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLY  13           H        GLY  13 -12.426  -1.879  -4.626
    2    HA3  GLY  13           HA2      GLY  13 -14.618  -2.618  -6.125
    3    HA2  GLY  13           HA3      GLY  13 -13.058  -2.172  -6.832

  No H/Q in entry =           3
  In of MODEL   29
    1    H    MET  14           H        MET  14 -11.586  -4.469  -5.793
    2    HA   MET  14           HA       MET  14 -11.950  -6.239  -7.916
    3    HB2  MET  14           HB2      MET  14  -9.887  -6.276  -6.604
    4    HB3  MET  14           HB3      MET  14 -10.747  -6.942  -5.216
    5    HG2  MET  14           HG2      MET  14  -9.595  -8.734  -6.427
    6    HG3  MET  14           HG3      MET  14 -11.339  -8.941  -6.604
    7    HE3  MET  14           HE1      MET  14  -8.002  -7.804  -8.233
    8    HE2  MET  14           HE2      MET  14  -8.239  -8.655  -9.759
    9    HE1  MET  14           HE3      MET  14  -8.364  -9.537  -8.240

  No H/Q in entry =           9
  In of MODEL   29
    1    H    SER  15           H        SER  15 -13.146  -6.716  -4.589
    2    HA   SER  15           HA       SER  15 -14.485  -9.170  -5.261
    3    HB2  SER  15           HB2      SER  15 -14.063  -8.959  -2.941
    4    HB3  SER  15           HB3      SER  15 -14.730  -7.329  -2.887
    5    HG   SER  15           HG       SER  15 -16.716  -8.636  -3.738

  No H/Q in entry =           5
  In of MODEL   29
    1    H    THR  16           H        THR  16 -15.590  -5.788  -4.962
    2    HA   THR  16           HA       THR  16 -18.371  -6.315  -5.528
    3    HB   THR  16           HB       THR  16 -16.823  -3.752  -6.047
    4    HG1  THR  16           HG1      THR  16 -16.403  -4.233  -3.962
    5   HG21  THR  16          HG21      THR  16 -19.713  -4.304  -5.323
    6   HG23  THR  16          HG22      THR  16 -19.129  -3.844  -6.932
    7   HG22  THR  16          HG23      THR  16 -19.003  -2.714  -5.576

  No H/Q in entry =           7
  In of MODEL   29
    1    H    SER  17           H        SER  17 -15.505  -5.742  -7.347
    2    HA   SER  17           HA       SER  17 -16.609  -5.048  -9.871
    3    HB2  SER  17           HB2      SER  17 -13.971  -6.303  -9.099
    4    HB3  SER  17           HB3      SER  17 -14.394  -5.942 -10.773
    5    HG   SER  17           HG       SER  17 -13.196  -4.272  -9.689

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU  18           H        LEU  18 -16.019  -8.166  -8.377
    2    HA   LEU  18           HA       LEU  18 -16.556  -9.703 -10.720
    3    HB2  LEU  18           HB2      LEU  18 -15.351 -10.584  -8.740
    4    HB3  LEU  18           HB3      LEU  18 -16.844 -10.471  -7.811
    5    HG   LEU  18           HG       LEU  18 -17.911 -12.081  -9.327
    6   HD13  LEU  18          HD11      LEU  18 -16.898 -11.860 -11.410
    7   HD12  LEU  18          HD12      LEU  18 -16.155 -13.344 -10.813
    8   HD11  LEU  18          HD13      LEU  18 -15.274 -11.821 -10.727
    9   HD21  LEU  18          HD21      LEU  18 -15.316 -12.926  -8.082
   10   HD23  LEU  18          HD22      LEU  18 -16.539 -14.046  -8.682
   11   HD22  LEU  18          HD23      LEU  18 -16.925 -12.946  -7.360

  No H/Q in entry =          11
  In of MODEL   29
    1    H    LEU  19           H        LEU  19 -18.575  -8.487  -8.050
    2    HA   LEU  19           HA       LEU  19 -21.012  -9.714  -8.899
    3    HB2  LEU  19           HB2      LEU  19 -20.783  -8.850  -6.654
    4    HB3  LEU  19           HB3      LEU  19 -20.512  -7.223  -7.277
    5    HG   LEU  19           HG       LEU  19 -22.829  -7.086  -8.001
    6   HD12  LEU  19          HD11      LEU  19 -24.424  -8.862  -7.342
    7   HD11  LEU  19          HD12      LEU  19 -23.065  -9.863  -6.832
    8   HD13  LEU  19          HD13      LEU  19 -23.248  -9.423  -8.529
    9   HD23  LEU  19          HD21      LEU  19 -22.819  -8.066  -5.168
   10   HD22  LEU  19          HD22      LEU  19 -23.757  -6.756  -5.883
   11   HD21  LEU  19          HD23      LEU  19 -22.021  -6.566  -5.640

  No H/Q in entry =          11
  In of MODEL   29
    1    H    VAL  20           H        VAL  20 -19.549  -6.542  -9.614
    2    HA   VAL  20           HA       VAL  20 -21.653  -5.548 -11.223
    3    HB   VAL  20           HB       VAL  20 -18.671  -4.920 -11.345
    4   HG12  VAL  20          HG11      VAL  20 -19.421  -2.846 -12.568
    5   HG11  VAL  20          HG12      VAL  20 -21.005  -3.600 -12.749
    6   HG13  VAL  20          HG13      VAL  20 -19.587  -4.337 -13.495
    7   HG23  VAL  20          HG21      VAL  20 -19.607  -2.732 -10.345
    8   HG22  VAL  20          HG22      VAL  20 -19.420  -4.139  -9.302
    9   HG21  VAL  20          HG23      VAL  20 -21.011  -3.715  -9.931

  No H/Q in entry =           9
  In of MODEL   29
    1    H    SER  21           H        SER  21 -18.856  -7.575 -12.189
    2    HA   SER  21           HA       SER  21 -19.607  -7.507 -14.952
    3    HB2  SER  21           HB2      SER  21 -18.141  -9.462 -15.240
    4    HB3  SER  21           HB3      SER  21 -17.340  -8.191 -14.320
    5    HG   SER  21           HG       SER  21 -18.103 -10.716 -13.573

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LYS  22           H        LYS  22 -20.676  -9.674 -12.366
    2    HA   LYS  22           HA       LYS  22 -22.171 -11.337 -14.187
    3    HB2  LYS  22           HB2      LYS  22 -22.336 -10.959 -11.198
    4    HB3  LYS  22           HB3      LYS  22 -23.364 -12.078 -12.094
    5    HG2  LYS  22           HG2      LYS  22 -21.316 -13.263 -12.857
    6    HG3  LYS  22           HG3      LYS  22 -20.367 -12.208 -11.811
    7    HD2  LYS  22           HD2      LYS  22 -21.675 -13.035  -9.868
    8    HD3  LYS  22           HD3      LYS  22 -22.498 -14.164 -10.947
    9    HE2  LYS  22           HE2      LYS  22 -19.520 -14.100 -10.408
   10    HE3  LYS  22           HE3      LYS  22 -20.663 -15.248  -9.709
   11    HZ3  LYS  22           HZ1      LYS  22 -20.998 -16.266 -11.761
   12    HZ2  LYS  22           HZ2      LYS  22 -19.319 -16.012 -11.684
   13    HZ1  LYS  22           HZ3      LYS  22 -20.291 -14.988 -12.629

  No H/Q in entry =          13
  In of MODEL   29
    1    H    MET  23           H        MET  23 -22.954  -8.401 -12.364
    2    HA   MET  23           HA       MET  23 -25.754  -8.521 -12.905
    3    HB2  MET  23           HB2      MET  23 -23.942  -6.183 -12.337
    4    HB3  MET  23           HB3      MET  23 -25.687  -6.038 -12.540
    5    HG2  MET  23           HG2      MET  23 -26.088  -7.322 -10.559
    6    HG3  MET  23           HG3      MET  23 -24.374  -7.711 -10.407
    7    HE2  MET  23           HE1      MET  23 -26.730  -4.073  -9.292
    8    HE1  MET  23           HE2      MET  23 -26.955  -5.062 -10.735
    9    HE3  MET  23           HE3      MET  23 -25.936  -3.623 -10.802

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ARG  24           H        ARG  24 -22.994  -7.081 -14.672
    2    HA   ARG  24           HA       ARG  24 -24.480  -5.823 -16.705
    3    HB2  ARG  24           HB2      ARG  24 -21.650  -6.923 -16.688
    4    HB3  ARG  24           HB3      ARG  24 -22.316  -6.048 -18.043
    5    HG2  ARG  24           HG2      ARG  24 -22.634  -4.026 -16.588
    6    HG3  ARG  24           HG3      ARG  24 -21.882  -4.932 -15.248
    7    HD2  ARG  24           HD2      ARG  24 -20.594  -4.436 -17.973
    8    HD3  ARG  24           HD3      ARG  24 -20.257  -3.513 -16.515
    9    HE   ARG  24           HE       ARG  24 -19.614  -5.863 -15.608
   10   HH21  ARG  24          HH11      ARG  24 -17.393  -5.825 -15.261
   11   HH22  ARG  24          HH12      ARG  24 -16.322  -5.565 -16.593
   12   HH11  ARG  24          HH21      ARG  24 -19.009  -4.705 -18.730
   13   HH12  ARG  24          HH22      ARG  24 -17.288  -4.913 -18.643

  No H/Q in entry =          13
  In of MODEL   29
    1    H    ALA  25           H        ALA  25 -23.326  -9.144 -16.374
    2    HA   ALA  25           HA       ALA  25 -23.911 -10.013 -19.010
    3    HB1  ALA  25           HB1      ALA  25 -23.202 -12.030 -18.281
    4    HB3  ALA  25           HB2      ALA  25 -24.278 -12.004 -16.885
    5    HB2  ALA  25           HB3      ALA  25 -22.733 -11.160 -16.821

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLN  26           H        GLN  26 -25.776 -10.037 -16.010
    2    HA   GLN  26           HA       GLN  26 -28.094 -11.276 -17.043
    3    HB2  GLN  26           HB2      GLN  26 -27.630  -9.496 -14.670
    4    HB3  GLN  26           HB3      GLN  26 -29.181 -10.238 -15.032
    5    HG2  GLN  26           HG2      GLN  26 -26.586 -11.664 -14.512
    6    HG3  GLN  26           HG3      GLN  26 -27.963 -11.562 -13.421
    7   HE21  GLN  26          HE21      GLN  26 -26.706 -13.728 -14.657
    8   HE22  GLN  26          HE22      GLN  26 -27.727 -14.795 -15.456

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ALA  27           H        ALA  27 -27.199  -7.864 -16.678
    2    HA   ALA  27           HA       ALA  27 -29.690  -6.805 -17.507
    3    HB1  ALA  27           HB1      ALA  27 -27.908  -5.460 -16.383
    4    HB3  ALA  27           HB2      ALA  27 -28.486  -4.716 -17.875
    5    HB2  ALA  27           HB3      ALA  27 -26.943  -5.568 -17.856

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLU  28           H        GLU  28 -26.952  -8.022 -19.327
    2    HA   GLU  28           HA       GLU  28 -27.863  -7.019 -21.869
    3    HB2  GLU  28           HB2      GLU  28 -25.487  -7.671 -21.207
    4    HB3  GLU  28           HB3      GLU  28 -26.012  -9.343 -21.397
    5    HG2  GLU  28           HG2      GLU  28 -24.848  -8.576 -23.359
    6    HG3  GLU  28           HG3      GLU  28 -26.537  -8.920 -23.726

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LYS  29           H        LYS  29 -28.021 -10.108 -20.181
    2    HA   LYS  29           HA       LYS  29 -29.282 -11.613 -22.186
    3    HB2  LYS  29           HB2      LYS  29 -28.250 -12.564 -20.159
    4    HB3  LYS  29           HB3      LYS  29 -29.541 -11.860 -19.188
    5    HG2  LYS  29           HG2      LYS  29 -31.174 -13.261 -20.262
    6    HG3  LYS  29           HG3      LYS  29 -29.954 -13.896 -21.364
    7    HD2  LYS  29           HD2      LYS  29 -28.823 -15.032 -19.604
    8    HD3  LYS  29           HD3      LYS  29 -29.755 -14.186 -18.370
    9    HE2  LYS  29           HE2      LYS  29 -30.478 -16.547 -18.717
   10    HE3  LYS  29           HE3      LYS  29 -31.765 -15.370 -18.989
   11    HZ1  LYS  29           HZ1      LYS  29 -31.167 -15.524 -21.407
   12    HZ3  LYS  29           HZ2      LYS  29 -31.882 -16.910 -20.737
   13    HZ2  LYS  29           HZ3      LYS  29 -30.209 -16.868 -21.013

  No H/Q in entry =          13
  In of MODEL   29
    1    H    TYR  30           H        TYR  30 -30.729  -9.496 -19.723
    2    HA   TYR  30           HA       TYR  30 -33.370  -9.986 -20.995
    3    HB2  TYR  30           HB2      TYR  30 -32.765  -8.796 -18.278
    4    HB3  TYR  30           HB3      TYR  30 -34.370  -9.077 -18.950
    5    HD1  TYR  30           HD1      TYR  30 -35.255 -11.381 -19.150
    6    HD2  TYR  30           HD2      TYR  30 -31.450 -10.602 -17.405
    7    HE1  TYR  30           HE1      TYR  30 -35.152 -13.699 -18.328
    8    HE2  TYR  30           HE2      TYR  30 -31.349 -12.906 -16.586
    9    HH   TYR  30           HH       TYR  30 -32.949 -15.294 -17.676

  No H/Q in entry =           9
  In of MODEL   29
    1    H    GLU  31           H        GLU  31 -31.214  -7.980 -21.787
    2    HA   GLU  31           HA       GLU  31 -31.152  -5.831 -22.632
    3    HB2  GLU  31           HB2      GLU  31 -34.032  -6.582 -23.175
    4    HB3  GLU  31           HB3      GLU  31 -33.196  -5.213 -23.907
    5    HG2  GLU  31           HG2      GLU  31 -31.694  -6.647 -25.065
    6    HG3  GLU  31           HG3      GLU  31 -32.255  -8.058 -24.169

  No H/Q in entry =           6
  In of MODEL   29
    1    H    VAL  32           H        VAL  32 -31.388  -5.703 -19.903
    2    HA   VAL  32           HA       VAL  32 -33.282  -3.604 -19.291
    3    HB   VAL  32           HB       VAL  32 -30.899  -4.554 -17.669
    4   HG12  VAL  32          HG11      VAL  32 -32.469  -3.728 -15.802
    5   HG11  VAL  32          HG12      VAL  32 -33.295  -2.846 -17.087
    6   HG13  VAL  32          HG13      VAL  32 -31.596  -2.521 -16.747
    7   HG21  VAL  32          HG21      VAL  32 -32.640  -6.301 -18.362
    8   HG23  VAL  32          HG22      VAL  32 -33.703  -5.474 -17.224
    9   HG22  VAL  32          HG23      VAL  32 -32.186  -6.175 -16.662

  No H/Q in entry =           9
  In of MODEL   29
    1    HA   PRO  33           HA       PRO  33 -30.261  -0.659 -20.956
    2    HB2  PRO  33           HB2      PRO  33 -31.799   1.547 -20.875
    3    HB3  PRO  33           HB3      PRO  33 -32.238   0.229 -21.960
    4    HG2  PRO  33           HG2      PRO  33 -33.250   0.763 -19.166
    5    HG3  PRO  33           HG3      PRO  33 -34.191   0.528 -20.639
    6    HD2  PRO  33           HD2      PRO  33 -33.734  -1.522 -18.945
    7    HD3  PRO  33           HD3      PRO  33 -33.771  -1.782 -20.690

  No H/Q in entry =           7
  In of MODEL   29
    1    H    VAL  34           H        VAL  34 -29.016  -1.168 -18.985
    2    HA   VAL  34           HA       VAL  34 -28.783   1.277 -17.358
    3    HB   VAL  34           HB       VAL  34 -28.210  -0.159 -15.398
    4   HG12  VAL  34          HG11      VAL  34 -30.616  -1.057 -15.113
    5   HG11  VAL  34          HG12      VAL  34 -30.921  -0.317 -16.683
    6   HG13  VAL  34          HG13      VAL  34 -30.397   0.681 -15.326
    7   HG21  VAL  34          HG21      VAL  34 -28.345  -2.207 -17.388
    8   HG23  VAL  34          HG22      VAL  34 -29.415  -2.567 -16.032
    9   HG22  VAL  34          HG23      VAL  34 -27.704  -2.256 -15.746

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ILE  35           H        ILE  35 -26.823   1.744 -16.497
    2    HA   ILE  35           HA       ILE  35 -24.486   0.431 -17.717
    3    HB   ILE  35           HB       ILE  35 -24.932   3.324 -16.941
    4   HG12  ILE  35          HG12      ILE  35 -23.900   2.004 -19.458
    5   HG13  ILE  35          HG13      ILE  35 -25.542   2.606 -19.226
    6   HG21  ILE  35          HG21      ILE  35 -22.348   1.819 -17.201
    7   HG23  ILE  35          HG22      ILE  35 -22.833   3.005 -15.990
    8   HG22  ILE  35          HG23      ILE  35 -22.436   3.528 -17.626
    9   HD11  ILE  35          HD11      ILE  35 -24.175   4.824 -18.629
   10   HD13  ILE  35          HD12      ILE  35 -24.686   4.418 -20.268
   11   HD12  ILE  35          HD13      ILE  35 -23.036   4.075 -19.748

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ILE  36           H        ILE  36 -23.264  -0.561 -16.091
    2    HA   ILE  36           HA       ILE  36 -23.749   0.078 -13.233
    3    HB   ILE  36           HB       ILE  36 -22.874  -2.626 -14.304
    4   HG12  ILE  36          HG12      ILE  36 -25.701  -1.848 -13.583
    5   HG13  ILE  36          HG13      ILE  36 -25.107  -1.837 -15.244
    6   HG23  ILE  36          HG21      ILE  36 -23.242  -3.438 -12.186
    7   HG22  ILE  36          HG22      ILE  36 -24.390  -2.165 -11.775
    8   HG21  ILE  36          HG23      ILE  36 -22.663  -1.811 -11.826
    9   HD13  ILE  36          HD11      ILE  36 -25.243  -4.055 -15.430
   10   HD12  ILE  36          HD12      ILE  36 -26.328  -3.932 -14.046
   11   HD11  ILE  36          HD13      ILE  36 -24.627  -4.329 -13.801

  No H/Q in entry =          11
  In of MODEL   29
    1    H    GLU  37           H        GLU  37 -21.991   0.740 -12.112
    2    HA   GLU  37           HA       GLU  37 -19.279  -0.031 -12.986
    3    HB2  GLU  37           HB2      GLU  37 -20.220   2.754 -12.323
    4    HB3  GLU  37           HB3      GLU  37 -18.524   2.281 -12.432
    5    HG2  GLU  37           HG2      GLU  37 -18.781   1.807 -14.786
    6    HG3  GLU  37           HG3      GLU  37 -20.498   2.197 -14.696

  No H/Q in entry =           6
  In of MODEL   29
    1    H    ALA  38           H        ALA  38 -17.810  -0.233 -11.283
    2    HA   ALA  38           HA       ALA  38 -18.880  -0.040  -8.527
    3    HB1  ALA  38           HB1      ALA  38 -17.123  -1.971  -9.911
    4    HB3  ALA  38           HB2      ALA  38 -18.187  -2.207  -8.524
    5    HB2  ALA  38           HB3      ALA  38 -16.587  -1.501  -8.298

  No H/Q in entry =           5
  In of MODEL   29
    1    H    PHE  39           H        PHE  39 -17.675   1.200  -7.050
    2    HA   PHE  39           HA       PHE  39 -15.155   2.428  -7.926
    3    HB2  PHE  39           HB2      PHE  39 -17.603   3.891  -6.960
    4    HB3  PHE  39           HB3      PHE  39 -15.986   4.584  -6.851
    5    HD1  PHE  39           HD1      PHE  39 -14.718   5.094  -8.893
    6    HD2  PHE  39           HD2      PHE  39 -18.785   3.816  -9.003
    7    HE1  PHE  39           HE1      PHE  39 -14.911   5.948 -11.212
    8    HE2  PHE  39           HE2      PHE  39 -18.993   4.657 -11.315
    9    HZ   PHE  39           HZ       PHE  39 -17.052   5.697 -12.439

  No H/Q in entry =           9
  In of MODEL   29
    1    HA   PRO  40           HA       PRO  40 -14.261   1.730  -3.621
    2    HB2  PRO  40           HB2      PRO  40 -12.531   3.775  -3.011
    3    HB3  PRO  40           HB3      PRO  40 -12.055   2.441  -4.063
    4    HG2  PRO  40           HG2      PRO  40 -13.113   5.154  -4.845
    5    HG3  PRO  40           HG3      PRO  40 -11.663   4.333  -5.425
    6    HD2  PRO  40           HD2      PRO  40 -13.865   4.191  -6.865
    7    HD3  PRO  40           HD3      PRO  40 -12.891   2.739  -6.643

  No H/Q in entry =           7
  In of MODEL   29
    1    H    GLU  41           H        GLU  41 -14.925   2.721  -1.509
    2    HA   GLU  41           HA       GLU  41 -17.194   4.390  -1.539
    3    HB2  GLU  41           HB2      GLU  41 -17.196   4.198   0.779
    4    HB3  GLU  41           HB3      GLU  41 -16.369   2.726   0.265
    5    HG2  GLU  41           HG2      GLU  41 -15.054   5.227   1.327
    6    HG3  GLU  41           HG3      GLU  41 -15.296   3.722   2.214

  No H/Q in entry =           6
  In of MODEL   29
    1    H    THR  42           H        THR  42 -13.877   5.356  -1.557
    2    HA   THR  42           HA       THR  42 -14.283   7.924  -0.377
    3    HB   THR  42           HB       THR  42 -12.121   8.520  -1.430
    4    HG1  THR  42           HG1      THR  42 -11.649   6.016  -2.411
    5   HG23  THR  42          HG21      THR  42 -10.766   6.924  -0.246
    6   HG22  THR  42          HG22      THR  42 -12.039   5.704  -0.328
    7   HG21  THR  42          HG23      THR  42 -12.254   7.134   0.678

  No H/Q in entry =           7
  In of MODEL   29
    1    H    LEU  43           H        LEU  43 -15.132   6.785  -3.477
    2    HA   LEU  43           HA       LEU  43 -15.414   9.542  -4.478
    3    HB2  LEU  43           HB2      LEU  43 -15.518   6.836  -5.776
    4    HB3  LEU  43           HB3      LEU  43 -16.094   8.288  -6.594
    5    HG   LEU  43           HG       LEU  43 -13.253   7.832  -5.717
    6   HD13  LEU  43          HD11      LEU  43 -13.457   6.337  -7.460
    7   HD12  LEU  43          HD12      LEU  43 -13.046   7.814  -8.330
    8   HD11  LEU  43          HD13      LEU  43 -14.722   7.275  -8.256
    9   HD23  LEU  43          HD21      LEU  43 -12.964   9.753  -7.411
   10   HD22  LEU  43          HD22      LEU  43 -13.609  10.149  -5.817
   11   HD21  LEU  43          HD23      LEU  43 -14.694  10.017  -7.200

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ALA  44           H        ALA  44 -17.355   7.707  -2.631
    2    HA   ALA  44           HA       ALA  44 -19.814   7.514  -3.983
    3    HB2  ALA  44           HB1      ALA  44 -19.685   6.421  -1.873
    4    HB3  ALA  44           HB2      ALA  44 -20.816   7.752  -1.629
    5    HB1  ALA  44           HB3      ALA  44 -19.154   7.892  -1.056

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLY  45           H        GLY  45 -18.457  10.352  -2.462
    2    HA3  GLY  45           HA2      GLY  45 -20.912  11.809  -2.869
    3    HA2  GLY  45           HA3      GLY  45 -19.386  12.464  -2.280

  No H/Q in entry =           3
  In of MODEL   29
    1    H    GLU  46           H        GLU  46 -17.810  11.528  -4.540
    2    HA   GLU  46           HA       GLU  46 -18.458  13.715  -6.341
    3    HB2  GLU  46           HB2      GLU  46 -16.236  11.665  -6.344
    4    HB3  GLU  46           HB3      GLU  46 -16.366  13.004  -7.485
    5    HG2  GLU  46           HG2      GLU  46 -16.054  13.281  -4.503
    6    HG3  GLU  46           HG3      GLU  46 -14.754  13.436  -5.685

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LYS  47           H        LYS  47 -18.279  10.194  -6.737
    2    HA   LYS  47           HA       LYS  47 -19.346  10.369  -9.428
    3    HB2  LYS  47           HB2      LYS  47 -18.715   8.028  -7.626
    4    HB3  LYS  47           HB3      LYS  47 -19.342   7.868  -9.268
    5    HG2  LYS  47           HG2      LYS  47 -16.745   9.191  -8.534
    6    HG3  LYS  47           HG3      LYS  47 -16.912   7.539  -9.126
    7    HD2  LYS  47           HD2      LYS  47 -18.176   8.607 -11.101
    8    HD3  LYS  47           HD3      LYS  47 -17.439  10.115 -10.561
    9    HE2  LYS  47           HE2      LYS  47 -16.201   7.735 -11.805
   10    HE3  LYS  47           HE3      LYS  47 -15.826   9.445 -12.010
   11    HZ1  LYS  47           HZ1      LYS  47 -15.304   8.575  -9.360
   12    HZ3  LYS  47           HZ2      LYS  47 -14.266   9.322 -10.477
   13    HZ2  LYS  47           HZ3      LYS  47 -14.453   7.634 -10.488

  No H/Q in entry =          13
  In of MODEL   29
    1    H    GLY  48           H        GLY  48 -20.698   9.624  -6.289
    2    HA3  GLY  48           HA2      GLY  48 -23.054   8.395  -7.048
    3    HA2  GLY  48           HA3      GLY  48 -22.863   9.407  -5.617

  No H/Q in entry =           3
  In of MODEL   29
    1    H    GLN  49           H        GLN  49 -22.298  11.822  -7.206
    2    HA   GLN  49           HA       GLN  49 -24.871  12.892  -7.394
    3    HB2  GLN  49           HB2      GLN  49 -22.324  13.781  -8.731
    4    HB3  GLN  49           HB3      GLN  49 -23.802  14.725  -8.675
    5    HG2  GLN  49           HG2      GLN  49 -23.674  14.776  -6.237
    6    HG3  GLN  49           HG3      GLN  49 -22.209  13.812  -6.291
    7   HE21  GLN  49          HE21      GLN  49 -22.143  16.054  -5.041
    8   HE22  GLN  49          HE22      GLN  49 -21.231  17.318  -5.689

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ASN  50           H        ASN  50 -23.133  11.014  -9.739
    2    HA   ASN  50           HA       ASN  50 -25.003  11.835 -11.855
    3    HB2  ASN  50           HB2      ASN  50 -22.397  10.332 -12.039
    4    HB3  ASN  50           HB3      ASN  50 -23.436  10.728 -13.400
    5   HD21  ASN  50          HD21      ASN  50 -20.834  11.631 -11.765
    6   HD22  ASN  50          HD22      ASN  50 -20.620  13.267 -12.122

  No H/Q in entry =           6
  In of MODEL   29
    1    H    ALA  51           H        ALA  51 -24.982   9.503  -9.584
    2    HA   ALA  51           HA       ALA  51 -25.710   7.327 -11.397
    3    HB2  ALA  51           HB1      ALA  51 -25.128   6.005  -9.689
    4    HB3  ALA  51           HB2      ALA  51 -26.277   6.807  -8.620
    5    HB1  ALA  51           HB3      ALA  51 -24.644   7.451  -8.803

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ASP  52           H        ASP  52 -27.701   6.243 -11.271
    2    HA   ASP  52           HA       ASP  52 -29.918   8.051 -10.653
    3    HB2  ASP  52           HB2      ASP  52 -29.668   5.532 -12.293
    4    HB3  ASP  52           HB3      ASP  52 -31.229   6.247 -11.887

  No H/Q in entry =           4
  In of MODEL   29
    1    H    VAL  53           H        VAL  53 -28.289   5.197  -9.586
    2    HA   VAL  53           HA       VAL  53 -29.762   5.329  -7.090
    3    HB   VAL  53           HB       VAL  53 -31.122   3.655  -8.333
    4   HG11  VAL  53          HG11      VAL  53 -29.343   2.804  -9.824
    5   HG13  VAL  53          HG12      VAL  53 -30.169   1.506  -8.962
    6   HG12  VAL  53          HG13      VAL  53 -28.573   2.037  -8.437
    7   HG23  VAL  53          HG21      VAL  53 -30.294   1.707  -6.610
    8   HG22  VAL  53          HG22      VAL  53 -31.446   2.999  -6.272
    9   HG21  VAL  53          HG23      VAL  53 -29.747   3.200  -5.845

  No H/Q in entry =           9
  In of MODEL   29
    1    H    VAL  54           H        VAL  54 -28.465   4.932  -5.414
    2    HA   VAL  54           HA       VAL  54 -25.685   4.116  -5.982
    3    HB   VAL  54           HB       VAL  54 -26.808   5.902  -3.765
    4   HG11  VAL  54          HG11      VAL  54 -24.208   4.515  -4.007
    5   HG13  VAL  54          HG12      VAL  54 -24.988   5.199  -2.583
    6   HG12  VAL  54          HG13      VAL  54 -24.082   6.244  -3.678
    7   HG22  VAL  54          HG21      VAL  54 -25.960   7.716  -4.872
    8   HG21  VAL  54          HG22      VAL  54 -26.477   6.704  -6.221
    9   HG23  VAL  54          HG23      VAL  54 -24.777   6.757  -5.762

  No H/Q in entry =           9
  In of MODEL   29
    1    H    LEU  55           H        LEU  55 -25.075   2.209  -5.311
    2    HA   LEU  55           HA       LEU  55 -26.593   0.901  -3.141
    3    HB2  LEU  55           HB2      LEU  55 -24.991  -0.270  -5.404
    4    HB3  LEU  55           HB3      LEU  55 -25.756  -1.201  -4.115
    5    HG   LEU  55           HG       LEU  55 -27.187   0.345  -6.268
    6   HD13  LEU  55          HD11      LEU  55 -26.847  -1.517  -7.463
    7   HD12  LEU  55          HD12      LEU  55 -27.808  -2.392  -6.271
    8   HD11  LEU  55          HD13      LEU  55 -26.055  -2.301  -6.098
    9   HD23  LEU  55          HD21      LEU  55 -28.479  -1.600  -4.408
   10   HD22  LEU  55          HD22      LEU  55 -29.182  -0.236  -5.279
   11   HD21  LEU  55          HD23      LEU  55 -28.183   0.048  -3.854

  No H/Q in entry =          11
  In of MODEL   29
    1    H    LEU  56           H        LEU  56 -25.457   0.341  -1.315
    2    HA   LEU  56           HA       LEU  56 -22.528   0.775  -1.332
    3    HB2  LEU  56           HB2      LEU  56 -24.357   0.565   1.046
    4    HB3  LEU  56           HB3      LEU  56 -22.655   1.017   1.051
    5    HG   LEU  56           HG       LEU  56 -24.963   2.655   0.041
    6   HD11  LEU  56          HD11      LEU  56 -23.875   2.314   2.579
    7   HD13  LEU  56          HD12      LEU  56 -24.877   3.665   2.046
    8   HD12  LEU  56          HD13      LEU  56 -23.120   3.792   1.979
    9   HD23  LEU  56          HD21      LEU  56 -23.038   4.377  -0.146
   10   HD22  LEU  56          HD22      LEU  56 -23.390   3.261  -1.466
   11   HD21  LEU  56          HD23      LEU  56 -22.046   2.938  -0.373

  No H/Q in entry =          11
  In of MODEL   29
    1    H    GLY  57           H        GLY  57 -21.133  -0.831  -0.762
    2    HA3  GLY  57           HA2      GLY  57 -22.018  -3.531  -0.944
    3    HA2  GLY  57           HA3      GLY  57 -20.409  -3.011  -0.452

  No H/Q in entry =           3
  In of MODEL   29
    1    HA   PRO  58           HA       PRO  58 -23.251  -4.047   3.236
    2    HB2  PRO  58           HB2      PRO  58 -22.539  -6.636   3.879
    3    HB3  PRO  58           HB3      PRO  58 -23.916  -6.257   2.844
    4    HG2  PRO  58           HG2      PRO  58 -21.168  -7.110   2.102
    5    HG3  PRO  58           HG3      PRO  58 -22.717  -7.597   1.416
    6    HD2  PRO  58           HD2      PRO  58 -21.117  -5.772   0.194
    7    HD3  PRO  58           HD3      PRO  58 -22.876  -5.710   0.069

  No H/Q in entry =           7
  In of MODEL   29
    1    H    GLN  59           H        GLN  59 -19.866  -4.481   2.677
    2    HA   GLN  59           HA       GLN  59 -19.146  -4.461   5.447
    3    HB2  GLN  59           HB2      GLN  59 -17.526  -3.587   3.050
    4    HB3  GLN  59           HB3      GLN  59 -16.901  -3.831   4.668
    5    HG2  GLN  59           HG2      GLN  59 -18.124  -5.963   2.924
    6    HG3  GLN  59           HG3      GLN  59 -16.404  -5.704   3.159
    7   HE21  GLN  59          HE21      GLN  59 -18.569  -7.554   3.931
    8   HE22  GLN  59          HE22      GLN  59 -18.378  -8.286   5.412

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ILE  60           H        ILE  60 -20.085  -1.946   3.199
    2    HA   ILE  60           HA       ILE  60 -19.283   0.044   5.235
    3    HB   ILE  60           HB       ILE  60 -19.513   1.751   3.389
    4   HG12  ILE  60          HG12      ILE  60 -19.275  -0.496   1.432
    5   HG13  ILE  60          HG13      ILE  60 -20.870   0.043   1.955
    6   HG21  ILE  60          HG21      ILE  60 -17.383   0.533   4.166
    7   HG23  ILE  60          HG22      ILE  60 -17.345   1.509   2.698
    8   HG22  ILE  60          HG23      ILE  60 -17.463  -0.246   2.586
    9   HD12  ILE  60          HD11      ILE  60 -18.811   1.509   0.344
   10   HD11  ILE  60          HD12      ILE  60 -19.985   2.416   1.297
   11   HD13  ILE  60          HD13      ILE  60 -20.536   1.313   0.036

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ALA  61           H        ALA  61 -21.718  -1.572   5.290
    2    HA   ALA  61           HA       ALA  61 -23.960   0.059   4.786
    3    HB1  ALA  61           HB1      ALA  61 -25.174  -1.432   6.111
    4    HB2  ALA  61           HB2      ALA  61 -23.783  -1.792   7.136
    5    HB3  ALA  61           HB3      ALA  61 -23.850  -2.418   5.488

  No H/Q in entry =           5
  In of MODEL   29
    1    H    TYR  62           H        TYR  62 -21.787   0.005   7.612
    2    HA   TYR  62           HA       TYR  62 -23.384   1.660   9.244
    3    HB2  TYR  62           HB2      TYR  62 -21.389   2.096  10.520
    4    HB3  TYR  62           HB3      TYR  62 -21.372   0.405  10.021
    5    HD1  TYR  62           HD1      TYR  62 -19.763  -0.375   8.296
    6    HD2  TYR  62           HD2      TYR  62 -19.680   3.647   9.739
    7    HE1  TYR  62           HE1      TYR  62 -17.540  -0.061   7.279
    8    HE2  TYR  62           HE2      TYR  62 -17.442   3.956   8.723
    9    HH   TYR  62           HH       TYR  62 -16.144   1.681   6.522

  No H/Q in entry =           9
  In of MODEL   29
    1    H    MET  63           H        MET  63 -21.716   2.509   6.400
    2    HA   MET  63           HA       MET  63 -21.593   5.351   7.066
    3    HB2  MET  63           HB2      MET  63 -20.938   3.811   4.552
    4    HB3  MET  63           HB3      MET  63 -20.764   5.559   4.722
    5    HG2  MET  63           HG2      MET  63 -19.074   5.235   6.434
    6    HG3  MET  63           HG3      MET  63 -19.261   3.488   6.300
    7    HE1  MET  63           HE1      MET  63 -18.288   6.698   4.854
    8    HE3  MET  63           HE2      MET  63 -18.959   6.320   3.267
    9    HE2  MET  63           HE3      MET  63 -17.210   6.356   3.499

  No H/Q in entry =           9
  In of MODEL   29
    1    H    LEU  64           H        LEU  64 -24.122   3.455   6.089
    2    HA   LEU  64           HA       LEU  64 -25.322   4.836   3.980
    3    HB2  LEU  64           HB2      LEU  64 -26.177   2.730   4.911
    4    HB3  LEU  64           HB3      LEU  64 -26.663   3.582   6.375
    5    HG   LEU  64           HG       LEU  64 -28.357   4.803   5.113
    6   HD13  LEU  64          HD11      LEU  64 -28.049   5.024   2.881
    7   HD12  LEU  64          HD12      LEU  64 -28.674   3.380   2.746
    8   HD11  LEU  64          HD13      LEU  64 -26.934   3.660   2.822
    9   HD23  LEU  64          HD21      LEU  64 -28.832   1.977   4.389
   10   HD22  LEU  64          HD22      LEU  64 -29.846   3.109   5.284
   11   HD21  LEU  64          HD23      LEU  64 -28.471   2.340   6.077

  No H/Q in entry =          11
  In of MODEL   29
    1    HA   PRO  65           HA       PRO  65 -27.572   7.994   6.670
    2    HB2  PRO  65           HB2      PRO  65 -25.602   8.199   8.948
    3    HB3  PRO  65           HB3      PRO  65 -27.345   8.461   8.969
    4    HG2  PRO  65           HG2      PRO  65 -26.401   6.227   9.931
    5    HG3  PRO  65           HG3      PRO  65 -27.807   6.167   8.870
    6    HD2  PRO  65           HD2      PRO  65 -24.920   5.578   8.208
    7    HD3  PRO  65           HD3      PRO  65 -26.362   4.670   7.752

  No H/Q in entry =           7
  In of MODEL   29
    1    H    GLU  66           H        GLU  66 -24.018   7.979   6.788
    2    HA   GLU  66           HA       GLU  66 -23.746  10.775   6.356
    3    HB2  GLU  66           HB2      GLU  66 -21.900   8.481   5.752
    4    HB3  GLU  66           HB3      GLU  66 -21.465  10.176   5.531
    5    HG2  GLU  66           HG2      GLU  66 -21.710  10.569   7.892
    6    HG3  GLU  66           HG3      GLU  66 -22.220   8.899   8.135

  No H/Q in entry =           6
  In of MODEL   29
    1    H    ILE  67           H        ILE  67 -23.790   8.005   4.132
    2    HA   ILE  67           HA       ILE  67 -23.364   9.693   1.826
    3    HB   ILE  67           HB       ILE  67 -24.235   6.779   2.026
    4   HG12  ILE  67          HG12      ILE  67 -21.605   7.966   1.123
    5   HG13  ILE  67          HG13      ILE  67 -21.918   7.561   2.810
    6   HG21  ILE  67          HG21      ILE  67 -24.169   8.633  -0.218
    7   HG23  ILE  67          HG22      ILE  67 -24.778   6.980  -0.157
    8   HG22  ILE  67          HG23      ILE  67 -23.069   7.279  -0.468
    9   HD12  ILE  67          HD11      ILE  67 -21.450   5.769   0.486
   10   HD11  ILE  67          HD12      ILE  67 -22.474   5.200   1.802
   11   HD13  ILE  67          HD13      ILE  67 -20.811   5.685   2.127

  No H/Q in entry =          11
  In of MODEL   29
    1    H    GLN  68           H        GLN  68 -26.243   8.629   3.436
    2    HA   GLN  68           HA       GLN  68 -28.057   9.521   1.430
    3    HB2  GLN  68           HB2      GLN  68 -28.345   9.191   4.413
    4    HB3  GLN  68           HB3      GLN  68 -29.658   9.764   3.398
    5    HG2  GLN  68           HG2      GLN  68 -29.653   7.720   2.145
    6    HG3  GLN  68           HG3      GLN  68 -28.208   7.165   2.970
    7   HE21  GLN  68          HE21      GLN  68 -30.372   5.787   2.823
    8   HE22  GLN  68          HE22      GLN  68 -31.214   5.337   4.233

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ARG  69           H        ARG  69 -26.499  11.230   4.169
    2    HA   ARG  69           HA       ARG  69 -27.881  13.696   3.720
    3    HB2  ARG  69           HB2      ARG  69 -25.547  12.803   5.347
    4    HB3  ARG  69           HB3      ARG  69 -25.636  14.518   4.969
    5    HG2  ARG  69           HG2      ARG  69 -27.964  14.552   5.912
    6    HG3  ARG  69           HG3      ARG  69 -27.747  12.869   6.407
    7    HD2  ARG  69           HD2      ARG  69 -26.085  15.247   7.315
    8    HD3  ARG  69           HD3      ARG  69 -27.220  14.342   8.306
    9    HE   ARG  69           HE       ARG  69 -24.589  13.422   7.397
   10   HH21  ARG  69          HH11      ARG  69 -23.781  11.678   8.622
   11   HH22  ARG  69          HH12      ARG  69 -24.815  10.866   9.746
   12   HH11  ARG  69          HH21      ARG  69 -27.561  12.869   9.066
   13   HH12  ARG  69          HH22      ARG  69 -26.956  11.538   9.995

  No H/Q in entry =          13
  In of MODEL   29
    1    H    LEU  70           H        LEU  70 -24.982  12.298   2.409
    2    HA   LEU  70           HA       LEU  70 -23.873  14.660   1.229
    3    HB2  LEU  70           HB2      LEU  70 -22.868  12.357   1.861
    4    HB3  LEU  70           HB3      LEU  70 -23.461  11.869   0.273
    5    HG   LEU  70           HG       LEU  70 -21.864  13.243  -0.808
    6   HD11  LEU  70          HD11      LEU  70 -21.081  14.122   1.980
    7   HD13  LEU  70          HD12      LEU  70 -21.770  15.138   0.714
    8   HD12  LEU  70          HD13      LEU  70 -20.151  14.466   0.520
    9   HD22  LEU  70          HD21      LEU  70 -20.421  11.540  -0.540
   10   HD21  LEU  70          HD22      LEU  70 -21.361  11.026   0.861
   11   HD23  LEU  70          HD23      LEU  70 -19.985  12.111   1.071

  No H/Q in entry =          11
  In of MODEL   29
    1    H    LEU  71           H        LEU  71 -25.994  12.090   0.115
    2    HA   LEU  71           HA       LEU  71 -26.500  13.547  -2.422
    3    HB2  LEU  71           HB2      LEU  71 -26.691  10.566  -1.947
    4    HB3  LEU  71           HB3      LEU  71 -26.807  11.409  -3.490
    5    HG   LEU  71           HG       LEU  71 -24.307  11.457  -1.801
    6   HD12  LEU  71          HD11      LEU  71 -24.321   9.803  -4.216
    7   HD11  LEU  71          HD12      LEU  71 -25.342   9.187  -2.918
    8   HD13  LEU  71          HD13      LEU  71 -23.628   9.480  -2.627
    9   HD22  LEU  71          HD21      LEU  71 -24.404  13.257  -3.314
   10   HD21  LEU  71          HD22      LEU  71 -24.879  12.197  -4.641
   11   HD23  LEU  71          HD23      LEU  71 -23.265  12.068  -3.943

  No H/Q in entry =          11
  In of MODEL   29
    1    HA   PRO  72           HA       PRO  72 -30.394  13.102   0.158
    2    HB2  PRO  72           HB2      PRO  72 -31.264  15.657   0.040
    3    HB3  PRO  72           HB3      PRO  72 -29.965  15.224   1.152
    4    HG2  PRO  72           HG2      PRO  72 -29.754  16.391  -1.612
    5    HG3  PRO  72           HG3      PRO  72 -29.008  16.962  -0.120
    6    HD2  PRO  72           HD2      PRO  72 -27.642  15.392  -1.854
    7    HD3  PRO  72           HD3      PRO  72 -27.407  15.245  -0.113

  No H/Q in entry =           7
  In of MODEL   29
    1    H    ASN  73           H        ASN  73 -29.738  14.027  -3.059
    2    HA   ASN  73           HA       ASN  73 -32.588  13.697  -3.721
    3    HB2  ASN  73           HB2      ASN  73 -32.104  14.783  -5.824
    4    HB3  ASN  73           HB3      ASN  73 -31.602  15.781  -4.467
    5   HD21  ASN  73          HD21      ASN  73 -30.776  15.801  -7.136
    6   HD22  ASN  73          HD22      ASN  73 -29.104  15.646  -7.307

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LYS  74           H        LYS  74 -30.603  11.455  -3.249
    2    HA   LYS  74           HA       LYS  74 -31.135  10.032  -5.789
    3    HB2  LYS  74           HB2      LYS  74 -28.620   9.767  -4.136
    4    HB3  LYS  74           HB3      LYS  74 -28.982   8.937  -5.649
    5    HG2  LYS  74           HG2      LYS  74 -28.732  11.911  -5.475
    6    HG3  LYS  74           HG3      LYS  74 -27.350  10.850  -5.752
    7    HD2  LYS  74           HD2      LYS  74 -28.442   9.897  -7.698
    8    HD3  LYS  74           HD3      LYS  74 -29.868  10.893  -7.406
    9    HE2  LYS  74           HE2      LYS  74 -28.646  12.899  -7.855
   10    HE3  LYS  74           HE3      LYS  74 -27.120  12.014  -7.919
   11    HZ2  LYS  74           HZ1      LYS  74 -28.567  12.588 -10.067
   12    HZ1  LYS  74           HZ2      LYS  74 -29.221  11.067  -9.686
   13    HZ3  LYS  74           HZ3      LYS  74 -27.553  11.231  -9.966

  No H/Q in entry =          13
  In of MODEL   29
    1    HA   PRO  75           HA       PRO  75 -32.554   7.072  -2.803
    2    HB2  PRO  75           HB2      PRO  75 -32.837   4.837  -4.365
    3    HB3  PRO  75           HB3      PRO  75 -33.967   6.187  -4.462
    4    HG2  PRO  75           HG2      PRO  75 -31.607   5.580  -6.199
    5    HG3  PRO  75           HG3      PRO  75 -33.250   6.006  -6.670
    6    HD2  PRO  75           HD2      PRO  75 -31.316   7.878  -6.624
    7    HD3  PRO  75           HD3      PRO  75 -32.956   8.278  -6.110

  No H/Q in entry =           7
  In of MODEL   29
    1    H    VAL  76           H        VAL  76 -31.113   6.037  -1.402
    2    HA   VAL  76           HA       VAL  76 -28.631   4.824  -2.467
    3    HB   VAL  76           HB       VAL  76 -28.956   6.318   0.172
    4   HG11  VAL  76          HG11      VAL  76 -26.579   5.023  -1.179
    5   HG13  VAL  76          HG12      VAL  76 -27.292   4.588   0.376
    6   HG12  VAL  76          HG13      VAL  76 -26.449   6.125   0.193
    7   HG22  VAL  76          HG21      VAL  76 -28.283   8.212  -0.728
    8   HG21  VAL  76          HG22      VAL  76 -28.806   7.497  -2.255
    9   HG23  VAL  76          HG23      VAL  76 -27.109   7.420  -1.779

  No H/Q in entry =           9
  In of MODEL   29
    1    H    GLU  77           H        GLU  77 -28.415   2.677  -1.828
    2    HA   GLU  77           HA       GLU  77 -29.231   1.916   0.824
    3    HB2  GLU  77           HB2      GLU  77 -30.827   0.258   0.292
    4    HB3  GLU  77           HB3      GLU  77 -31.372   1.772  -0.432
    5    HG2  GLU  77           HG2      GLU  77 -30.735   0.992  -2.604
    6    HG3  GLU  77           HG3      GLU  77 -30.096  -0.495  -1.908

  No H/Q in entry =           6
  In of MODEL   29
    1    H    VAL  78           H        VAL  78 -28.905  -0.162   1.510
    2    HA   VAL  78           HA       VAL  78 -26.226  -0.935   0.663
    3    HB   VAL  78           HB       VAL  78 -27.960  -1.798   3.016
    4   HG11  VAL  78          HG11      VAL  78 -25.602  -3.031   1.934
    5   HG13  VAL  78          HG12      VAL  78 -26.526  -3.490   3.366
    6   HG12  VAL  78          HG13      VAL  78 -25.212  -2.322   3.500
    7   HG22  VAL  78          HG21      VAL  78 -26.521  -0.417   4.358
    8   HG21  VAL  78          HG22      VAL  78 -27.245   0.537   3.063
    9   HG23  VAL  78          HG23      VAL  78 -25.565   0.014   2.940

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ILE  79           H        ILE  79 -25.672  -2.851  -0.215
    2    HA   ILE  79           HA       ILE  79 -27.711  -4.350  -1.571
    3    HB   ILE  79           HB       ILE  79 -24.721  -4.864  -1.309
    4   HG12  ILE  79          HG12      ILE  79 -26.334  -3.791  -3.628
    5   HG13  ILE  79          HG13      ILE  79 -25.476  -2.765  -2.476
    6   HG22  ILE  79          HG21      ILE  79 -25.791  -6.073  -3.628
    7   HG21  ILE  79          HG22      ILE  79 -26.790  -6.583  -2.266
    8   HG23  ILE  79          HG23      ILE  79 -25.048  -6.854  -2.232
    9   HD13  ILE  79          HD11      ILE  79 -24.041  -2.893  -4.276
   10   HD12  ILE  79          HD12      ILE  79 -24.371  -4.605  -4.542
   11   HD11  ILE  79          HD13      ILE  79 -23.406  -4.099  -3.155

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ASP  80           H        ASP  80 -28.576  -6.270  -0.977
    2    HA   ASP  80           HA       ASP  80 -28.551  -7.141   1.680
    3    HB2  ASP  80           HB2      ASP  80 -30.283  -7.741   0.026
    4    HB3  ASP  80           HB3      ASP  80 -29.110  -8.754  -0.818

  No H/Q in entry =           4
  In of MODEL   29
    1    H    SER  81           H        SER  81 -27.025  -8.258   2.840
    2    HA   SER  81           HA       SER  81 -24.512  -8.944   1.686
    3    HB2  SER  81           HB2      SER  81 -23.984  -9.947   3.874
    4    HB3  SER  81           HB3      SER  81 -24.692  -8.343   4.061
    5    HG   SER  81           HG       SER  81 -26.273  -9.182   5.094

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU  82           H        LEU  82 -27.219 -11.041   1.999
    2    HA   LEU  82           HA       LEU  82 -25.656 -13.410   1.524
    3    HB2  LEU  82           HB2      LEU  82 -28.591 -12.811   1.219
    4    HB3  LEU  82           HB3      LEU  82 -27.876 -14.412   1.048
    5    HG   LEU  82           HG       LEU  82 -27.885 -12.783   3.571
    6   HD12  LEU  82          HD11      LEU  82 -29.518 -14.495   4.326
    7   HD11  LEU  82          HD12      LEU  82 -29.535 -15.165   2.693
    8   HD13  LEU  82          HD13      LEU  82 -30.133 -13.531   2.982
    9   HD21  LEU  82          HD21      LEU  82 -26.819 -15.465   2.738
   10   HD23  LEU  82          HD22      LEU  82 -27.241 -15.143   4.420
   11   HD22  LEU  82          HD23      LEU  82 -26.002 -14.175   3.621

  No H/Q in entry =          11
  In of MODEL   29
    1    H    LEU  83           H        LEU  83 -27.599 -11.213  -0.443
    2    HA   LEU  83           HA       LEU  83 -27.363 -12.598  -2.897
    3    HB2  LEU  83           HB2      LEU  83 -27.792  -9.685  -2.286
    4    HB3  LEU  83           HB3      LEU  83 -27.801 -10.348  -3.920
    5    HG   LEU  83           HG       LEU  83 -29.860 -10.718  -1.764
    6   HD13  LEU  83          HD11      LEU  83 -30.609  -8.885  -2.858
    7   HD12  LEU  83          HD12      LEU  83 -31.053 -10.015  -4.137
    8   HD11  LEU  83          HD13      LEU  83 -29.520  -9.144  -4.220
    9   HD23  LEU  83          HD21      LEU  83 -29.962 -12.007  -4.476
   10   HD22  LEU  83          HD22      LEU  83 -30.947 -12.344  -3.054
   11   HD21  LEU  83          HD23      LEU  83 -29.256 -12.843  -3.093

  No H/Q in entry =          11
  In of MODEL   29
    1    H    TYR  84           H        TYR  84 -25.439 -10.187  -1.224
    2    HA   TYR  84           HA       TYR  84 -23.553  -9.717  -3.338
    3    HB2  TYR  84           HB2      TYR  84 -24.109  -8.223  -1.320
    4    HB3  TYR  84           HB3      TYR  84 -23.065  -9.299  -0.394
    5    HD1  TYR  84           HD1      TYR  84 -20.703  -9.751  -1.652
    6    HD2  TYR  84           HD2      TYR  84 -23.131  -6.265  -2.083
    7    HE1  TYR  84           HE1      TYR  84 -18.722  -8.480  -2.408
    8    HE2  TYR  84           HE2      TYR  84 -21.162  -4.985  -2.849
    9    HH   TYR  84           HH       TYR  84 -18.006  -6.104  -2.446

  No H/Q in entry =           9
  In of MODEL   29
    1    H    GLY  85           H        GLY  85 -23.342 -11.685  -0.365
    2    HA3  GLY  85           HA2      GLY  85 -20.755 -12.625  -0.807
    3    HA2  GLY  85           HA3      GLY  85 -21.994 -13.465   0.125

  No H/Q in entry =           3
  In of MODEL   29
    1    H    LYS  86           H        LYS  86 -23.815 -13.867  -1.952
    2    HA   LYS  86           HA       LYS  86 -22.738 -16.253  -3.171
    3    HB2  LYS  86           HB2      LYS  86 -25.167 -15.409  -2.267
    4    HB3  LYS  86           HB3      LYS  86 -25.350 -15.187  -4.005
    5    HG2  LYS  86           HG2      LYS  86 -24.702 -17.754  -2.602
    6    HG3  LYS  86           HG3      LYS  86 -26.251 -17.299  -3.314
    7    HD2  LYS  86           HD2      LYS  86 -25.049 -16.967  -5.498
    8    HD3  LYS  86           HD3      LYS  86 -23.614 -17.659  -4.743
    9    HE2  LYS  86           HE2      LYS  86 -26.273 -19.064  -4.938
   10    HE3  LYS  86           HE3      LYS  86 -24.940 -19.294  -6.069
   11    HZ2  LYS  86           HZ1      LYS  86 -25.067 -19.988  -3.200
   12    HZ1  LYS  86           HZ2      LYS  86 -23.571 -19.777  -3.979
   13    HZ3  LYS  86           HZ3      LYS  86 -24.646 -20.976  -4.515

  No H/Q in entry =          13
  In of MODEL   29
    1    H    VAL  87           H        VAL  87 -22.727 -13.048  -4.102
    2    HA   VAL  87           HA       VAL  87 -22.409 -11.897  -6.053
    3    HB   VAL  87           HB       VAL  87 -21.357 -14.303  -7.504
    4   HG13  VAL  87          HG11      VAL  87 -19.914 -12.760  -8.468
    5   HG12  VAL  87          HG12      VAL  87 -19.882 -11.738  -7.031
    6   HG11  VAL  87          HG13      VAL  87 -21.287 -11.719  -8.095
    7   HG22  VAL  87          HG21      VAL  87 -20.468 -14.911  -5.425
    8   HG21  VAL  87          HG22      VAL  87 -20.146 -13.239  -4.975
    9   HG23  VAL  87          HG23      VAL  87 -19.174 -14.019  -6.222

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ASP  88           H        ASP  88 -24.927 -12.544  -5.724
    2    HA   ASP  88           HA       ASP  88 -26.015 -13.792  -8.120
    3    HB2  ASP  88           HB2      ASP  88 -27.037 -14.014  -5.804
    4    HB3  ASP  88           HB3      ASP  88 -27.494 -12.316  -5.930

  No H/Q in entry =           4
  In of MODEL   29
    1    H    GLY  89           H        GLY  89 -25.296 -12.551  -9.768
    2    HA3  GLY  89           HA2      GLY  89 -25.486  -9.782 -10.002
    3    HA2  GLY  89           HA3      GLY  89 -25.442 -10.919 -11.349

  No H/Q in entry =           3
  In of MODEL   29
    1    H    LEU  90           H        LEU  90 -27.889 -12.275 -10.914
    2    HA   LEU  90           HA       LEU  90 -29.694 -10.361 -12.071
    3    HB2  LEU  90           HB2      LEU  90 -29.743 -12.763 -12.623
    4    HB3  LEU  90           HB3      LEU  90 -30.266 -13.112 -10.976
    5    HG   LEU  90           HG       LEU  90 -32.385 -12.008 -11.376
    6   HD13  LEU  90          HD11      LEU  90 -32.195 -10.284 -12.870
    7   HD12  LEU  90          HD12      LEU  90 -32.717 -11.537 -13.999
    8   HD11  LEU  90          HD13      LEU  90 -31.006 -11.134 -13.860
    9   HD23  LEU  90          HD21      LEU  90 -32.281 -13.667 -13.791
   10   HD22  LEU  90          HD22      LEU  90 -33.276 -13.818 -12.343
   11   HD21  LEU  90          HD23      LEU  90 -31.620 -14.424 -12.342

  No H/Q in entry =          11
  In of MODEL   29
    1    H    GLY  91           H        GLY  91 -29.555 -11.823  -8.867
    2    HA3  GLY  91           HA2      GLY  91 -31.911 -10.708  -7.868
    3    HA2  GLY  91           HA3      GLY  91 -30.527 -11.223  -6.903

  No H/Q in entry =           3
  In of MODEL   29
    1    H    VAL  92           H        VAL  92 -28.607  -9.399  -7.759
    2    HA   VAL  92           HA       VAL  92 -29.426  -7.083  -6.248
    3    HB   VAL  92           HB       VAL  92 -26.860  -7.561  -7.808
    4   HG12  VAL  92          HG11      VAL  92 -27.059  -5.648  -5.506
    5   HG11  VAL  92          HG12      VAL  92 -27.708  -5.126  -7.062
    6   HG13  VAL  92          HG13      VAL  92 -26.012  -5.586  -6.926
    7   HG22  VAL  92          HG21      VAL  92 -26.648  -9.128  -6.195
    8   HG21  VAL  92          HG22      VAL  92 -27.808  -8.340  -5.124
    9   HG23  VAL  92          HG23      VAL  92 -26.156  -7.733  -5.234

  No H/Q in entry =           9
  In of MODEL   29
    1    H    LEU  93           H        LEU  93 -28.978  -7.784  -9.655
    2    HA   LEU  93           HA       LEU  93 -29.324  -5.161 -10.619
    3    HB2  LEU  93           HB2      LEU  93 -28.658  -7.030 -12.052
    4    HB3  LEU  93           HB3      LEU  93 -30.248  -7.762 -11.837
    5    HG   LEU  93           HG       LEU  93 -31.255  -5.818 -12.996
    6   HD11  LEU  93          HD11      LEU  93 -29.417  -4.208 -12.491
    7   HD13  LEU  93          HD12      LEU  93 -29.838  -4.260 -14.204
    8   HD12  LEU  93          HD13      LEU  93 -28.389  -5.081 -13.626
    9   HD23  LEU  93          HD21      LEU  93 -30.188  -6.408 -15.265
   10   HD22  LEU  93          HD22      LEU  93 -31.035  -7.657 -14.354
   11   HD21  LEU  93          HD23      LEU  93 -29.271  -7.593 -14.337

  No H/Q in entry =          11
  In of MODEL   29
    1    H    LYS  94           H        LYS  94 -31.697  -7.708  -9.766
    2    HA   LYS  94           HA       LYS  94 -34.041  -6.284 -10.433
    3    HB2  LYS  94           HB2      LYS  94 -33.540  -8.442  -8.390
    4    HB3  LYS  94           HB3      LYS  94 -35.136  -7.758  -8.685
    5    HG2  LYS  94           HG2      LYS  94 -35.021  -8.560 -11.008
    6    HG3  LYS  94           HG3      LYS  94 -33.461  -9.301 -10.654
    7    HD2  LYS  94           HD2      LYS  94 -34.595 -10.617  -8.826
    8    HD3  LYS  94           HD3      LYS  94 -36.135  -9.984  -9.406
    9    HE2  LYS  94           HE2      LYS  94 -35.590 -10.938 -11.655
   10    HE3  LYS  94           HE3      LYS  94 -34.180 -11.706 -10.927
   11    HZ3  LYS  94           HZ1      LYS  94 -36.021 -13.237 -11.098
   12    HZ2  LYS  94           HZ2      LYS  94 -37.010 -12.205 -10.180
   13    HZ1  LYS  94           HZ3      LYS  94 -35.654 -12.939  -9.468

  No H/Q in entry =          13
  In of MODEL   29
    1    H    ALA  95           H        ALA  95 -32.251  -6.361  -7.364
    2    HA   ALA  95           HA       ALA  95 -34.123  -4.771  -5.924
    3    HB2  ALA  95           HB1      ALA  95 -31.747  -6.129  -5.345
    4    HB3  ALA  95           HB2      ALA  95 -32.743  -5.214  -4.213
    5    HB1  ALA  95           HB3      ALA  95 -31.389  -4.431  -5.028

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA  96           H        ALA  96 -31.461  -3.931  -8.002
    2    HA   ALA  96           HA       ALA  96 -31.385  -1.160  -7.259
    3    HB2  ALA  96           HB1      ALA  96 -30.001  -0.953  -9.357
    4    HB3  ALA  96           HB2      ALA  96 -30.294  -2.665  -9.659
    5    HB1  ALA  96           HB3      ALA  96 -29.398  -2.165  -8.226

  No H/Q in entry =           5
  In of MODEL   29
    1    H    VAL  97           H        VAL  97 -32.881  -2.912  -9.943
    2    HA   VAL  97           HA       VAL  97 -33.945  -0.631 -11.238
    3    HB   VAL  97           HB       VAL  97 -34.744  -3.560 -11.254
    4   HG11  VAL  97          HG11      VAL  97 -36.538  -1.566 -11.783
    5   HG13  VAL  97          HG12      VAL  97 -36.583  -3.168 -12.521
    6   HG12  VAL  97          HG13      VAL  97 -35.825  -1.826 -13.376
    7   HG21  VAL  97          HG21      VAL  97 -33.448  -1.751 -13.296
    8   HG23  VAL  97          HG22      VAL  97 -33.893  -3.436 -13.570
    9   HG22  VAL  97          HG23      VAL  97 -32.659  -3.031 -12.376

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ALA  98           H        ALA  98 -35.149  -2.785  -8.688
    2    HA   ALA  98           HA       ALA  98 -37.716  -1.640  -8.379
    3    HB1  ALA  98           HB1      ALA  98 -36.709  -3.823  -7.309
    4    HB3  ALA  98           HB2      ALA  98 -37.901  -2.893  -6.402
    5    HB2  ALA  98           HB3      ALA  98 -36.185  -2.735  -6.026

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA  99           H        ALA  99 -34.658  -0.814  -6.708
    2    HA   ALA  99           HA       ALA  99 -35.811   1.186  -5.080
    3    HB1  ALA  99           HB1      ALA  99 -33.152   0.295  -5.789
    4    HB2  ALA  99           HB2      ALA  99 -33.720   1.060  -4.305
    5    HB3  ALA  99           HB3      ALA  99 -33.231   2.053  -5.678

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ILE 100           H        ILE 100 -34.733   1.281  -8.426
    2    HA   ILE 100           HA       ILE 100 -34.915   4.126  -8.679
    3    HB   ILE 100           HB       ILE 100 -34.983   1.949 -10.795
    4   HG12  ILE 100          HG12      ILE 100 -32.831   3.952 -10.122
    5   HG13  ILE 100          HG13      ILE 100 -32.871   2.312  -9.475
    6   HG21  ILE 100          HG21      ILE 100 -35.410   4.866 -10.962
    7   HG23  ILE 100          HG22      ILE 100 -35.901   3.583 -12.069
    8   HG22  ILE 100          HG23      ILE 100 -34.250   4.202 -12.114
    9   HD12  ILE 100          HD11      ILE 100 -32.310   3.240 -12.253
   10   HD11  ILE 100          HD12      ILE 100 -32.971   1.625 -11.987
   11   HD13  ILE 100          HD13      ILE 100 -31.433   2.080 -11.256

  No H/Q in entry =          11
  In of MODEL   29
    1    H    LYS 101           H        LYS 101 -37.196   1.505  -9.402
    2    HA   LYS 101           HA       LYS 101 -39.270   3.141 -10.441
    3    HB2  LYS 101           HB2      LYS 101 -39.161   0.378  -9.282
    4    HB3  LYS 101           HB3      LYS 101 -40.710   1.134  -9.653
    5    HG2  LYS 101           HG2      LYS 101 -40.211   1.244 -11.946
    6    HG3  LYS 101           HG3      LYS 101 -38.518   0.845 -11.669
    7    HD2  LYS 101           HD2      LYS 101 -39.755  -1.075 -12.548
    8    HD3  LYS 101           HD3      LYS 101 -39.145  -1.386 -10.922
    9    HE2  LYS 101           HE2      LYS 101 -41.213  -2.080 -10.431
   10    HE3  LYS 101           HE3      LYS 101 -41.672  -0.376 -10.458
   11    HZ3  LYS 101           HZ1      LYS 101 -42.540  -0.558 -12.583
   12    HZ2  LYS 101           HZ2      LYS 101 -43.006  -2.023 -11.864
   13    HZ1  LYS 101           HZ3      LYS 101 -41.688  -1.985 -12.934

  No H/Q in entry =          13
  In of MODEL   29
    1    H    LYS 102           H        LYS 102 -38.811   1.698  -7.212
    2    HA   LYS 102           HA       LYS 102 -41.073   2.903  -6.052
    3    HB2  LYS 102           HB2      LYS 102 -39.845   1.049  -5.003
    4    HB3  LYS 102           HB3      LYS 102 -38.458   2.109  -4.755
    5    HG2  LYS 102           HG2      LYS 102 -39.794   3.517  -3.288
    6    HG3  LYS 102           HG3      LYS 102 -41.183   2.462  -3.538
    7    HD2  LYS 102           HD2      LYS 102 -39.966   0.608  -2.479
    8    HD3  LYS 102           HD3      LYS 102 -38.577   1.666  -2.227
    9    HE2  LYS 102           HE2      LYS 102 -39.949   3.157  -0.849
   10    HE3  LYS 102           HE3      LYS 102 -41.355   2.129  -1.122
   11    HZ1  LYS 102           HZ1      LYS 102 -39.643   0.388  -0.081
   12    HZ3  LYS 102           HZ2      LYS 102 -40.765   1.282   0.827
   13    HZ2  LYS 102           HZ3      LYS 102 -39.154   1.807   0.713

  No H/Q in entry =          13
  In of MODEL   29
    1    H    ALA 103           H        ALA 103 -38.109   4.288  -7.046
    2    HA   ALA 103           HA       ALA 103 -38.355   6.621  -5.291
    3    HB2  ALA 103           HB1      ALA 103 -36.348   7.342  -6.851
    4    HB3  ALA 103           HB2      ALA 103 -36.306   5.620  -7.232
    5    HB1  ALA 103           HB3      ALA 103 -36.098   6.162  -5.567

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA 104           H        ALA 104 -38.938   5.854  -8.636
    2    HA   ALA 104           HA       ALA 104 -39.520   8.631  -9.294
    3    HB2  ALA 104           HB1      ALA 104 -39.537   7.941 -11.489
    4    HB1  ALA 104           HB2      ALA 104 -40.267   6.381 -11.103
    5    HB3  ALA 104           HB3      ALA 104 -38.548   6.650 -10.808

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA 105           H        ALA 105 -41.145   6.542  -7.486
    2    HA   ALA 105           HA       ALA 105 -43.573   7.933  -7.501
    3    HB2  ALA 105           HB1      ALA 105 -44.292   7.051  -9.538
    4    HB3  ALA 105           HB2      ALA 105 -44.940   5.873  -8.397
    5    HB1  ALA 105           HB3      ALA 105 -43.460   5.518  -9.286

  No H/Q in entry =           5
  In of MODEL   30
    1    H1   ALA   1           H3       ALA   1 -12.478 -15.363  -2.238
    2    H2   ALA   1           H2       ALA   1 -11.560 -16.518  -3.087
    3    H3   ALA   1           H1       ALA   1 -12.694 -15.554  -3.911
    4    HA   ALA   1           HA       ALA   1 -14.117 -17.233  -3.666
    5    HB3  ALA   1           HB1      ALA   1 -12.746 -19.027  -3.217
    6    HB1  ALA   1           HB2      ALA   1 -13.490 -18.906  -1.623
    7    HB2  ALA   1           HB3      ALA   1 -11.905 -18.190  -1.912

  No H/Q in entry =           7
  In of MODEL   30
    1    H    GLU   2           H        GLU   2 -15.743 -18.066  -2.003
    2    HA   GLU   2           HA       GLU   2 -17.357 -16.322  -0.930
    3    HB2  GLU   2           HB2      GLU   2 -16.445 -18.766   0.604
    4    HB3  GLU   2           HB3      GLU   2 -17.954 -17.892   0.869
    5    HG2  GLU   2           HG2      GLU   2 -18.962 -18.960  -0.861
    6    HG3  GLU   2           HG3      GLU   2 -17.640 -18.577  -1.953

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLU   3           H        GLU   3 -15.449 -17.711   1.678
    2    HA   GLU   3           HA       GLU   3 -15.624 -15.358   3.241
    3    HB2  GLU   3           HB2      GLU   3 -14.076 -17.929   3.476
    4    HB3  GLU   3           HB3      GLU   3 -13.817 -16.616   4.624
    5    HG2  GLU   3           HG2      GLU   3 -16.007 -16.735   5.457
    6    HG3  GLU   3           HG3      GLU   3 -16.624 -17.522   4.010

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LEU   4           H        LEU   4 -12.701 -16.879   1.828
    2    HA   LEU   4           HA       LEU   4 -10.834 -15.006   2.418
    3    HB2  LEU   4           HB2      LEU   4 -11.102 -16.294  -0.308
    4    HB3  LEU   4           HB3      LEU   4  -9.635 -15.598   0.369
    5    HG   LEU   4           HG       LEU   4 -11.159 -17.974   1.487
    6   HD13  LEU   4          HD11      LEU   4  -9.554 -19.353   0.544
    7   HD12  LEU   4          HD12      LEU   4  -8.324 -18.089   0.512
    8   HD11  LEU   4          HD13      LEU   4  -9.621 -18.088  -0.682
    9   HD23  LEU   4          HD21      LEU   4  -8.900 -18.076   2.854
   10   HD22  LEU   4          HD22      LEU   4 -10.201 -17.017   3.394
   11   HD21  LEU   4          HD23      LEU   4  -8.834 -16.347   2.504

  No H/Q in entry =          11
  In of MODEL   30
    1    H    GLU   5           H        GLU   5 -13.182 -14.757  -0.240
    2    HA   GLU   5           HA       GLU   5 -12.146 -12.287  -1.242
    3    HB2  GLU   5           HB2      GLU   5 -13.541 -13.875  -2.577
    4    HB3  GLU   5           HB3      GLU   5 -14.927 -13.432  -1.579
    5    HG2  GLU   5           HG2      GLU   5 -15.014 -12.076  -3.571
    6    HG3  GLU   5           HG3      GLU   5 -14.529 -11.031  -2.236

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLU   6           H        GLU   6 -14.871 -13.127   0.866
    2    HA   GLU   6           HA       GLU   6 -15.731 -10.437   1.276
    3    HB2  GLU   6           HB2      GLU   6 -17.191 -12.399   1.680
    4    HB3  GLU   6           HB3      GLU   6 -16.153 -12.877   3.024
    5    HG2  GLU   6           HG2      GLU   6 -16.635 -10.776   4.181
    6    HG3  GLU   6           HG3      GLU   6 -17.616 -10.229   2.824

  No H/Q in entry =           6
  In of MODEL   30
    1    H    VAL   7           H        VAL   7 -13.448 -12.587   2.829
    2    HA   VAL   7           HA       VAL   7 -12.942 -11.025   5.156
    3    HB   VAL   7           HB       VAL   7 -11.280 -13.092   3.692
    4   HG11  VAL   7          HG11      VAL   7 -10.771 -11.572   6.256
    5   HG13  VAL   7          HG12      VAL   7  -9.683 -11.801   4.888
    6   HG12  VAL   7          HG13      VAL   7 -10.051 -13.154   5.957
    7   HG21  VAL   7          HG21      VAL   7 -13.531 -13.623   4.925
    8   HG23  VAL   7          HG22      VAL   7 -12.591 -13.367   6.395
    9   HG22  VAL   7          HG23      VAL   7 -12.125 -14.632   5.260

  No H/Q in entry =           9
  In of MODEL   30
    1    H    VAL   8           H        VAL   8 -11.452 -11.156   1.936
    2    HA   VAL   8           HA       VAL   8  -9.357  -9.318   2.420
    3    HB   VAL   8           HB       VAL   8 -10.833 -10.111  -0.091
    4   HG13  VAL   8          HG11      VAL   8 -10.152  -7.896  -0.588
    5   HG12  VAL   8          HG12      VAL   8  -8.847  -8.899  -1.222
    6   HG11  VAL   8          HG13      VAL   8  -8.648  -8.066   0.319
    7   HG23  VAL   8          HG21      VAL   8  -8.039 -10.667  -0.182
    8   HG22  VAL   8          HG22      VAL   8  -9.350 -11.829  -0.001
    9   HG21  VAL   8          HG23      VAL   8  -8.579 -11.147   1.428

  No H/Q in entry =           9
  In of MODEL   30
    1    H    MET   9           H        MET   9 -12.703  -8.873   1.282
    2    HA   MET   9           HA       MET   9 -12.599  -6.096   0.852
    3    HB2  MET   9           HB2      MET   9 -14.830  -7.950   1.675
    4    HB3  MET   9           HB3      MET   9 -15.094  -6.213   1.499
    5    HG2  MET   9           HG2      MET   9 -14.298  -6.308  -0.821
    6    HG3  MET   9           HG3      MET   9 -13.976  -8.034  -0.652
    7    HE1  MET   9           HE1      MET   9 -16.342  -5.208  -0.431
    8    HE3  MET   9           HE2      MET   9 -17.250  -6.038   0.830
    9    HE2  MET   9           HE3      MET   9 -17.964  -5.830  -0.766

  No H/Q in entry =           9
  In of MODEL   30
    1    H    GLY  10           H        GLY  10 -13.273  -7.983   3.780
    2    HA3  GLY  10           HA2      GLY  10 -13.777  -5.794   5.507
    3    HA2  GLY  10           HA3      GLY  10 -13.234  -7.392   6.014

  No H/Q in entry =           3
  In of MODEL   30
    1    H    LEU  11           H        LEU  11 -10.799  -7.551   4.683
    2    HA   LEU  11           HA       LEU  11  -9.065  -6.148   6.433
    3    HB2  LEU  11           HB2      LEU  11  -8.557  -7.574   3.819
    4    HB3  LEU  11           HB3      LEU  11  -7.270  -6.892   4.811
    5    HG   LEU  11           HG       LEU  11  -9.297  -8.896   5.836
    6   HD13  LEU  11          HD11      LEU  11  -8.104 -10.148   4.262
    7   HD12  LEU  11          HD12      LEU  11  -7.163 -10.404   5.730
    8   HD11  LEU  11          HD13      LEU  11  -6.612  -9.245   4.522
    9   HD22  LEU  11          HD21      LEU  11  -8.416  -7.900   7.749
   10   HD21  LEU  11          HD22      LEU  11  -6.877  -7.520   6.978
   11   HD23  LEU  11          HD23      LEU  11  -7.225  -9.172   7.486

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  12           H        ILE  12  -9.980  -5.580   3.050
    2    HA   ILE  12           HA       ILE  12  -8.257  -3.375   2.617
    3    HB   ILE  12           HB       ILE  12 -10.929  -4.001   1.336
    4   HG12  ILE  12          HG12      ILE  12  -8.922  -5.688   1.248
    5   HG13  ILE  12          HG13      ILE  12  -9.785  -5.313  -0.230
    6   HG23  ILE  12          HG21      ILE  12 -10.326  -1.689   0.894
    7   HG22  ILE  12          HG22      ILE  12  -9.985  -2.618  -0.560
    8   HG21  ILE  12          HG23      ILE  12  -8.697  -2.160   0.515
    9   HD11  ILE  12          HD11      ILE  12  -7.241  -3.930   0.662
   10   HD13  ILE  12          HD12      ILE  12  -8.040  -3.781  -0.901
   11   HD12  ILE  12          HD13      ILE  12  -7.280  -5.288  -0.446

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  13           H        ILE  13 -11.615  -3.595   3.730
    2    HA   ILE  13           HA       ILE  13 -12.032  -0.802   4.008
    3    HB   ILE  13           HB       ILE  13 -13.263  -3.206   5.375
    4   HG12  ILE  13          HG12      ILE  13 -13.502  -2.696   2.847
    5   HG13  ILE  13          HG13      ILE  13 -14.946  -3.069   3.763
    6   HG23  ILE  13          HG21      ILE  13 -13.644  -1.432   6.915
    7   HG22  ILE  13          HG22      ILE  13 -15.130  -1.548   5.982
    8   HG21  ILE  13          HG23      ILE  13 -13.970  -0.270   5.631
    9   HD11  ILE  13          HD11      ILE  13 -14.182  -0.199   3.640
   10   HD13  ILE  13          HD12      ILE  13 -15.764  -0.954   3.616
   11   HD12  ILE  13          HD13      ILE  13 -14.799  -0.934   2.156

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ASN  14           H        ASN  14 -10.944  -3.312   6.271
    2    HA   ASN  14           HA       ASN  14 -10.705  -1.682   8.559
    3    HB2  ASN  14           HB2      ASN  14 -10.492  -4.292   8.230
    4    HB3  ASN  14           HB3      ASN  14  -8.779  -3.929   8.064
    5   HD21  ASN  14          HD21      ASN  14  -9.424  -5.449  10.240
    6   HD22  ASN  14          HD22      ASN  14  -9.374  -4.532  11.666

  No H/Q in entry =           6
  In of MODEL   30
    1    H    SER  15           H        SER  15  -8.330  -2.535   6.051
    2    HA   SER  15           HA       SER  15  -6.160  -1.074   7.113
    3    HB2  SER  15           HB2      SER  15  -5.156  -1.297   4.947
    4    HB3  SER  15           HB3      SER  15  -6.127  -2.747   5.178
    5    HG   SER  15           HG       SER  15  -6.299  -1.018   3.226

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLY  16           H        GLY  16  -8.762  -0.167   4.883
    2    HA3  GLY  16           HA2      GLY  16  -7.871   2.463   4.331
    3    HA2  GLY  16           HA3      GLY  16  -9.531   1.891   4.178

  No H/Q in entry =           3
  In of MODEL   30
    1    H    GLN  17           H        GLN  17 -10.068   1.168   6.830
    2    HA   GLN  17           HA       GLN  17 -10.735   3.680   7.979
    3    HB2  GLN  17           HB2      GLN  17 -11.996   1.617   8.471
    4    HB3  GLN  17           HB3      GLN  17 -10.591   0.963   9.314
    5    HG2  GLN  17           HG2      GLN  17 -10.667   2.867  10.897
    6    HG3  GLN  17           HG3      GLN  17 -12.092   3.490  10.066
    7   HE21  GLN  17          HE21      GLN  17 -14.008   2.899  11.073
    8   HE22  GLN  17          HE22      GLN  17 -14.241   1.473  11.967

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ALA  18           H        ALA  18  -8.133   1.363   8.579
    2    HA   ALA  18           HA       ALA  18  -7.006   2.560  10.845
    3    HB2  ALA  18           HB1      ALA  18  -6.433   0.339   9.470
    4    HB3  ALA  18           HB2      ALA  18  -5.254   1.105  10.535
    5    HB1  ALA  18           HB3      ALA  18  -5.183   1.386   8.795

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ARG  19           H        ARG  19  -6.248   3.080   7.393
    2    HA   ARG  19           HA       ARG  19  -4.322   5.102   7.814
    3    HB2  ARG  19           HB2      ARG  19  -4.676   3.970   5.618
    4    HB3  ARG  19           HB3      ARG  19  -6.209   4.830   5.452
    5    HG2  ARG  19           HG2      ARG  19  -5.053   6.987   5.517
    6    HG3  ARG  19           HG3      ARG  19  -3.512   6.182   5.811
    7    HD2  ARG  19           HD2      ARG  19  -3.643   6.778   3.470
    8    HD3  ARG  19           HD3      ARG  19  -3.749   5.019   3.613
    9    HE   ARG  19           HE       ARG  19  -6.372   5.961   3.622
   10   HH21  ARG  19          HH11      ARG  19  -7.576   6.135   1.712
   11   HH22  ARG  19          HH12      ARG  19  -6.762   6.206   0.187
   12   HH11  ARG  19          HH21      ARG  19  -3.608   5.993   1.572
   13   HH12  ARG  19          HH22      ARG  19  -4.514   6.122   0.108

  No H/Q in entry =          13
  In of MODEL   30
    1    H    SER  20           H        SER  20  -7.821   5.262   7.234
    2    HA   SER  20           HA       SER  20  -8.145   8.022   7.193
    3    HB2  SER  20           HB2      SER  20 -10.041   6.703   6.665
    4    HB3  SER  20           HB3      SER  20  -9.935   5.809   8.179
    5    HG   SER  20           HG       SER  20 -10.954   8.337   7.640

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU  21           H        LEU  21  -8.156   5.834   9.993
    2    HA   LEU  21           HA       LEU  21  -8.561   7.832  11.964
    3    HB2  LEU  21           HB2      LEU  21  -7.239   5.115  12.112
    4    HB3  LEU  21           HB3      LEU  21  -7.529   6.133  13.519
    5    HG   LEU  21           HG       LEU  21  -9.720   5.264  11.610
    6   HD11  LEU  21          HD11      LEU  21  -8.670   4.005  14.145
    7   HD13  LEU  21          HD12      LEU  21  -8.956   3.241  12.583
    8   HD12  LEU  21          HD13      LEU  21 -10.321   3.731  13.589
    9   HD23  LEU  21          HD21      LEU  21 -11.030   5.771  13.859
   10   HD22  LEU  21          HD22      LEU  21 -10.595   7.104  12.796
   11   HD21  LEU  21          HD23      LEU  21  -9.628   6.772  14.224

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ALA  22           H        ALA  22  -5.633   6.426  10.537
    2    HA   ALA  22           HA       ALA  22  -3.729   7.715  12.151
    3    HB2  ALA  22           HB1      ALA  22  -3.344   5.859  10.454
    4    HB1  ALA  22           HB2      ALA  22  -2.133   7.141  10.485
    5    HB3  ALA  22           HB3      ALA  22  -3.358   7.114   9.216

  No H/Q in entry =           5
  In of MODEL   30
    1    H    TYR  23           H        TYR  23  -5.052   8.752   8.977
    2    HA   TYR  23           HA       TYR  23  -3.687  11.233   8.904
    3    HB2  TYR  23           HB2      TYR  23  -4.788  10.340   6.916
    4    HB3  TYR  23           HB3      TYR  23  -6.361  10.457   7.706
    5    HD1  TYR  23           HD1      TYR  23  -3.440  12.489   6.571
    6    HD2  TYR  23           HD2      TYR  23  -7.591  12.470   7.675
    7    HE1  TYR  23           HE1      TYR  23  -3.651  14.844   5.820
    8    HE2  TYR  23           HE2      TYR  23  -7.801  14.824   6.922
    9    HH   TYR  23           HH       TYR  23  -5.316  16.404   5.119

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ALA  24           H        ALA  24  -6.810  10.289  10.299
    2    HA   ALA  24           HA       ALA  24  -7.612  12.887  11.079
    3    HB1  ALA  24           HB1      ALA  24  -9.442  11.657  11.554
    4    HB2  ALA  24           HB2      ALA  24  -8.615  11.073  12.997
    5    HB3  ALA  24           HB3      ALA  24  -8.509  10.162  11.491

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA  25           H        ALA  25  -5.630  10.404  12.638
    2    HA   ALA  25           HA       ALA  25  -5.264  11.648  15.140
    3    HB2  ALA  25           HB1      ALA  25  -4.529   9.289  14.311
    4    HB3  ALA  25           HB2      ALA  25  -3.497  10.133  15.467
    5    HB1  ALA  25           HB3      ALA  25  -3.071  10.114  13.756

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU  26           H        LEU  26  -3.487  11.931  12.090
    2    HA   LEU  26           HA       LEU  26  -1.502  13.727  12.998
    3    HB2  LEU  26           HB2      LEU  26  -1.226  12.575  10.891
    4    HB3  LEU  26           HB3      LEU  26  -2.694  13.301  10.245
    5    HG   LEU  26           HG       LEU  26  -1.653  15.539  10.379
    6   HD12  LEU  26          HD11      LEU  26   0.888  15.529  10.779
    7   HD11  LEU  26          HD12      LEU  26   0.650  13.950  11.522
    8   HD13  LEU  26          HD13      LEU  26  -0.137  15.373  12.205
    9   HD21  LEU  26          HD21      LEU  26   0.059  13.467   8.971
   10   HD23  LEU  26          HD22      LEU  26   0.034  15.189   8.604
   11   HD22  LEU  26          HD23      LEU  26  -1.403  14.209   8.322

  No H/Q in entry =          11
  In of MODEL   30
    1    H    LYS  27           H        LYS  27  -4.686  14.249  11.539
    2    HA   LYS  27           HA       LYS  27  -4.599  17.037  11.345
    3    HB2  LYS  27           HB2      LYS  27  -6.366  15.583  10.367
    4    HB3  LYS  27           HB3      LYS  27  -7.017  15.331  11.986
    5    HG2  LYS  27           HG2      LYS  27  -7.416  17.742  12.228
    6    HG3  LYS  27           HG3      LYS  27  -6.713  18.033  10.634
    7    HD2  LYS  27           HD2      LYS  27  -8.469  16.621   9.605
    8    HD3  LYS  27           HD3      LYS  27  -9.177  16.347  11.199
    9    HE2  LYS  27           HE2      LYS  27  -9.589  18.763  11.448
   10    HE3  LYS  27           HE3      LYS  27  -8.852  19.059   9.869
   11    HZ3  LYS  27           HZ1      LYS  27 -11.232  18.963   9.641
   12    HZ2  LYS  27           HZ2      LYS  27 -11.295  17.446  10.408
   13    HZ1  LYS  27           HZ3      LYS  27 -10.556  17.603   8.883

  No H/Q in entry =          13
  In of MODEL   30
    1    H    GLN  28           H        GLN  28  -5.498  14.958  14.074
    2    HA   GLN  28           HA       GLN  28  -6.359  16.969  15.858
    3    HB2  GLN  28           HB2      GLN  28  -4.992  14.317  16.382
    4    HB3  GLN  28           HB3      GLN  28  -5.698  15.330  17.642
    5    HG2  GLN  28           HG2      GLN  28  -7.206  14.231  15.252
    6    HG3  GLN  28           HG3      GLN  28  -7.265  13.557  16.880
    7   HE21  GLN  28          HE21      GLN  28  -9.093  15.406  14.900
    8   HE22  GLN  28          HE22      GLN  28  -9.821  16.439  16.033

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ALA  29           H        ALA  29  -3.160  15.633  15.149
    2    HA   ALA  29           HA       ALA  29  -1.693  17.009  17.121
    3    HB1  ALA  29           HB1      ALA  29   0.222  16.295  15.990
    4    HB3  ALA  29           HB2      ALA  29  -0.540  16.432  14.406
    5    HB2  ALA  29           HB3      ALA  29  -0.973  15.103  15.480

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LYS  30           H        LYS  30  -2.558  17.906  13.798
    2    HA   LYS  30           HA       LYS  30  -1.114  20.326  13.694
    3    HB2  LYS  30           HB2      LYS  30  -3.665  19.491  12.298
    4    HB3  LYS  30           HB3      LYS  30  -2.811  20.994  11.952
    5    HG2  LYS  30           HG2      LYS  30  -0.764  19.671  11.424
    6    HG3  LYS  30           HG3      LYS  30  -1.690  18.189  11.672
    7    HD2  LYS  30           HD2      LYS  30  -3.255  18.855   9.887
    8    HD3  LYS  30           HD3      LYS  30  -2.351  20.351   9.642
    9    HE2  LYS  30           HE2      LYS  30  -0.342  19.028   9.048
   10    HE3  LYS  30           HE3      LYS  30  -1.265  17.539   9.263
   11    HZ2  LYS  30           HZ1      LYS  30  -1.089  18.411   6.922
   12    HZ1  LYS  30           HZ2      LYS  30  -2.111  19.689   7.398
   13    HZ3  LYS  30           HZ3      LYS  30  -2.659  18.080   7.470

  No H/Q in entry =          13
  In of MODEL   30
    1    H    GLN  31           H        GLN  31  -4.219  19.518  15.122
    2    HA   GLN  31           HA       GLN  31  -4.936  22.286  15.584
    3    HB2  GLN  31           HB2      GLN  31  -6.146  19.856  16.909
    4    HB3  GLN  31           HB3      GLN  31  -6.882  21.440  16.671
    5    HG2  GLN  31           HG2      GLN  31  -6.200  20.656  14.076
    6    HG3  GLN  31           HG3      GLN  31  -6.744  19.159  14.823
    7   HE21  GLN  31          HE21      GLN  31  -8.141  20.759  12.733
    8   HE22  GLN  31          HE22      GLN  31  -9.644  21.174  13.400

  No H/Q in entry =           8
  In of MODEL   30
    1    H    GLY  32           H        GLY  32  -2.647  20.319  16.887
    2    HA3  GLY  32           HA2      GLY  32  -1.229  20.755  18.681
    3    HA2  GLY  32           HA3      GLY  32  -2.335  22.015  19.214

  No H/Q in entry =           3
  In of MODEL   30
    1    H    ASP  33           H        ASP  33  -3.810  19.000  18.555
    2    HA   ASP  33           HA       ASP  33  -4.211  18.543  21.436
    3    HB2  ASP  33           HB2      ASP  33  -5.648  17.560  18.965
    4    HB3  ASP  33           HB3      ASP  33  -5.994  16.952  20.582

  No H/Q in entry =           4
  In of MODEL   30
    1    H    PHE  34           H        PHE  34  -2.055  17.656  21.727
    2    HA   PHE  34           HA       PHE  34  -1.100  15.394  20.315
    3    HB2  PHE  34           HB2      PHE  34  -0.450  16.362  23.108
    4    HB3  PHE  34           HB3      PHE  34   0.453  15.126  22.232
    5    HD1  PHE  34           HD1      PHE  34   0.342  18.553  22.976
    6    HD2  PHE  34           HD2      PHE  34   1.108  15.843  19.730
    7    HE1  PHE  34           HE1      PHE  34   1.659  20.305  21.817
    8    HE2  PHE  34           HE2      PHE  34   2.420  17.599  18.577
    9    HZ   PHE  34           HZ       PHE  34   2.698  19.826  19.625

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ALA  35           H        ALA  35  -3.117  15.698  23.191
    2    HA   ALA  35           HA       ALA  35  -2.944  13.031  24.081
    3    HB3  ALA  35           HB1      ALA  35  -5.386  13.696  24.954
    4    HB1  ALA  35           HB2      ALA  35  -4.829  15.306  24.499
    5    HB2  ALA  35           HB3      ALA  35  -3.923  14.365  25.682

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA  36           H        ALA  36  -5.381  14.593  21.999
    2    HA   ALA  36           HA       ALA  36  -6.839  12.206  21.525
    3    HB1  ALA  36           HB1      ALA  36  -8.277  13.655  20.581
    4    HB3  ALA  36           HB2      ALA  36  -7.105  14.058  19.326
    5    HB2  ALA  36           HB3      ALA  36  -7.106  14.943  20.852

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA  37           H        ALA  37  -4.143  13.753  19.843
    2    HA   ALA  37           HA       ALA  37  -4.149  12.122  17.542
    3    HB3  ALA  37           HB1      ALA  37  -2.120  13.798  18.957
    4    HB2  ALA  37           HB2      ALA  37  -2.660  13.866  17.280
    5    HB1  ALA  37           HB3      ALA  37  -1.523  12.616  17.791

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LYS  38           H        LYS  38  -2.379  11.780  20.609
    2    HA   LYS  38           HA       LYS  38  -1.096   9.360  20.106
    3    HB2  LYS  38           HB2      LYS  38  -1.377  11.123  22.258
    4    HB3  LYS  38           HB3      LYS  38  -2.017   9.602  22.875
    5    HG2  LYS  38           HG2      LYS  38   0.055   8.448  22.323
    6    HG3  LYS  38           HG3      LYS  38   0.683   9.885  21.509
    7    HD2  LYS  38           HD2      LYS  38   0.884  11.096  23.545
    8    HD3  LYS  38           HD3      LYS  38  -0.149   9.961  24.416
    9    HE2  LYS  38           HE2      LYS  38   2.205   9.605  25.020
   10    HE3  LYS  38           HE3      LYS  38   1.572   8.201  24.156
   11    HZ3  LYS  38           HZ1      LYS  38   2.869   8.602  22.368
   12    HZ2  LYS  38           HZ2      LYS  38   3.844   9.412  23.501
   13    HZ1  LYS  38           HZ3      LYS  38   2.773  10.292  22.518

  No H/Q in entry =          13
  In of MODEL   30
    1    H    ALA  39           H        ALA  39  -4.317   9.905  21.530
    2    HA   ALA  39           HA       ALA  39  -4.919   7.194  22.032
    3    HB3  ALA  39           HB1      ALA  39  -7.050   9.175  21.282
    4    HB2  ALA  39           HB2      ALA  39  -6.139   9.384  22.778
    5    HB1  ALA  39           HB3      ALA  39  -7.082   7.916  22.517

  No H/Q in entry =           5
  In of MODEL   30
    1    H    MET  40           H        MET  40  -5.488   9.223  19.193
    2    HA   MET  40           HA       MET  40  -7.005   7.319  17.738
    3    HB2  MET  40           HB2      MET  40  -5.361   9.690  16.829
    4    HB3  MET  40           HB3      MET  40  -6.409   8.750  15.762
    5    HG2  MET  40           HG2      MET  40  -7.408  10.009  18.330
    6    HG3  MET  40           HG3      MET  40  -7.461  10.849  16.781
    7    HE3  MET  40           HE1      MET  40 -10.083   9.276  14.729
    8    HE2  MET  40           HE2      MET  40  -8.330   9.366  14.571
    9    HE1  MET  40           HE3      MET  40  -9.221  10.744  15.213

  No H/Q in entry =           9
  In of MODEL   30
    1    H    MET  41           H        MET  41  -3.501   7.999  17.841
    2    HA   MET  41           HA       MET  41  -2.784   6.238  15.732
    3    HB2  MET  41           HB2      MET  41  -1.142   6.873  18.196
    4    HB3  MET  41           HB3      MET  41  -0.544   6.218  16.675
    5    HG2  MET  41           HG2      MET  41  -1.672   8.422  15.684
    6    HG3  MET  41           HG3      MET  41  -1.416   9.002  17.328
    7    HE2  MET  41           HE1      MET  41   1.470   6.856  17.667
    8    HE1  MET  41           HE2      MET  41   0.708   8.160  18.573
    9    HE3  MET  41           HE3      MET  41   2.331   8.380  17.921

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ASP  42           H        ASP  42  -3.155   5.762  19.219
    2    HA   ASP  42           HA       ASP  42  -2.160   3.152  19.367
    3    HB2  ASP  42           HB2      ASP  42  -2.995   4.921  21.198
    4    HB3  ASP  42           HB3      ASP  42  -4.438   3.918  21.132

  No H/Q in entry =           4
  In of MODEL   30
    1    H    GLN  43           H        GLN  43  -5.478   4.310  18.889
    2    HA   GLN  43           HA       GLN  43  -6.663   1.741  18.695
    3    HB2  GLN  43           HB2      GLN  43  -7.552   4.410  17.578
    4    HB3  GLN  43           HB3      GLN  43  -8.538   2.946  17.558
    5    HG2  GLN  43           HG2      GLN  43  -8.231   2.814  20.063
    6    HG3  GLN  43           HG3      GLN  43  -7.482   4.408  19.991
    7   HE21  GLN  43          HE21      GLN  43  -9.651   4.518  21.505
    8   HE22  GLN  43          HE22      GLN  43 -11.008   5.117  20.683

  No H/Q in entry =           8
  In of MODEL   30
    1    H    SER  44           H        SER  44  -5.303   3.939  16.280
    2    HA   SER  44           HA       SER  44  -6.041   2.472  13.992
    3    HB2  SER  44           HB2      SER  44  -4.745   4.835  14.434
    4    HB3  SER  44           HB3      SER  44  -3.410   3.819  13.893
    5    HG   SER  44           HG       SER  44  -4.517   4.812  12.139

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ARG  45           H        ARG  45  -3.153   2.309  16.055
    2    HA   ARG  45           HA       ARG  45  -1.712   0.335  14.659
    3    HB2  ARG  45           HB2      ARG  45  -0.837   1.739  16.527
    4    HB3  ARG  45           HB3      ARG  45  -1.836   0.821  17.650
    5    HG2  ARG  45           HG2      ARG  45  -0.641  -1.256  16.996
    6    HG3  ARG  45           HG3      ARG  45   0.383  -0.314  15.914
    7    HD2  ARG  45           HD2      ARG  45   1.151   1.051  17.868
    8    HD3  ARG  45           HD3      ARG  45   0.218  -0.012  18.945
    9    HE   ARG  45           HE       ARG  45   1.883  -1.631  17.351
   10   HH21  ARG  45          HH11      ARG  45   3.775  -2.485  18.175
   11   HH22  ARG  45          HH12      ARG  45   4.567  -1.715  19.503
   12   HH11  ARG  45          HH21      ARG  45   2.238   0.825  19.745
   13   HH12  ARG  45          HH22      ARG  45   3.697   0.162  20.390

  No H/Q in entry =          13
  In of MODEL   30
    1    H    MET  46           H        MET  46  -4.099   0.046  17.273
    2    HA   MET  46           HA       MET  46  -3.974  -2.756  17.571
    3    HB2  MET  46           HB2      MET  46  -6.115  -0.722  18.185
    4    HB3  MET  46           HB3      MET  46  -6.334  -2.439  18.532
    5    HG2  MET  46           HG2      MET  46  -4.296  -2.432  19.911
    6    HG3  MET  46           HG3      MET  46  -4.042  -0.732  19.550
    7    HE2  MET  46           HE1      MET  46  -4.103   0.280  21.973
    8    HE1  MET  46           HE2      MET  46  -3.879  -1.429  22.330
    9    HE3  MET  46           HE3      MET  46  -5.051  -0.492  23.250

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ALA  47           H        ALA  47  -5.973  -0.702  15.494
    2    HA   ALA  47           HA       ALA  47  -7.630  -2.724  14.432
    3    HB3  ALA  47           HB1      ALA  47  -8.276  -0.475  14.026
    4    HB1  ALA  47           HB2      ALA  47  -7.806  -1.112  12.450
    5    HB2  ALA  47           HB3      ALA  47  -6.704  -0.063  13.343

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU  48           H        LEU  48  -4.496  -1.464  13.367
    2    HA   LEU  48           HA       LEU  48  -4.255  -3.052  11.020
    3    HB2  LEU  48           HB2      LEU  48  -2.167  -1.813  12.820
    4    HB3  LEU  48           HB3      LEU  48  -1.819  -2.535  11.249
    5    HG   LEU  48           HG       LEU  48  -3.802  -0.285  11.656
    6   HD13  LEU  48          HD11      LEU  48  -1.662   0.553  12.312
    7   HD12  LEU  48          HD12      LEU  48  -1.937   1.116  10.663
    8   HD11  LEU  48          HD13      LEU  48  -0.861  -0.250  10.961
    9   HD22  LEU  48          HD21      LEU  48  -4.301  -1.256   9.580
   10   HD21  LEU  48          HD22      LEU  48  -2.628  -1.719   9.274
   11   HD23  LEU  48          HD23      LEU  48  -3.119  -0.031   9.122

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ASN  49           H        ASN  49  -3.198  -3.476  14.359
    2    HA   ASN  49           HA       ASN  49  -1.636  -5.765  14.014
    3    HB2  ASN  49           HB2      ASN  49  -1.633  -4.431  16.065
    4    HB3  ASN  49           HB3      ASN  49  -3.294  -4.898  16.398
    5   HD21  ASN  49          HD21      ASN  49  -1.284  -5.446  18.286
    6   HD22  ASN  49          HD22      ASN  49  -1.025  -7.121  18.354

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLU  50           H        GLU  50  -5.095  -5.431  14.705
    2    HA   GLU  50           HA       GLU  50  -5.656  -8.221  14.809
    3    HB2  GLU  50           HB2      GLU  50  -7.207  -6.509  15.699
    4    HB3  GLU  50           HB3      GLU  50  -7.500  -5.935  14.055
    5    HG2  GLU  50           HG2      GLU  50  -8.407  -8.114  13.416
    6    HG3  GLU  50           HG3      GLU  50  -8.028  -8.768  15.006

  No H/Q in entry =           6
  In of MODEL   30
    1    H    ALA  51           H        ALA  51  -5.696  -5.815  12.220
    2    HA   ALA  51           HA       ALA  51  -6.723  -7.519  10.199
    3    HB2  ALA  51           HB1      ALA  51  -6.478  -5.707   8.833
    4    HB1  ALA  51           HB2      ALA  51  -4.829  -5.390   9.374
    5    HB3  ALA  51           HB3      ALA  51  -6.198  -4.856  10.351

  No H/Q in entry =           5
  In of MODEL   30
    1    H    HIS  52           H        HIS  52  -3.411  -6.675  11.167
    2    HA   HIS  52           HA       HIS  52  -2.050  -8.184   9.206
    3    HB2  HIS  52           HB2      HIS  52  -0.988  -6.468  10.659
    4    HB3  HIS  52           HB3      HIS  52  -1.150  -7.566  12.030
    5    HD1  HIS  52           HD1      HIS  52   0.352  -9.696  12.048
    6    HD2  HIS  52           HD2      HIS  52   1.041  -7.175   8.800
    7    HE1  HIS  52           HE1      HIS  52   2.514 -10.474  10.983
    8    HE2  HIS  52           HE2      HIS  52   2.948  -8.948   9.002

  No H/Q in entry =           8
  In of MODEL   30
    1    H    LEU  53           H        LEU  53  -3.261  -9.048  12.423
    2    HA   LEU  53           HA       LEU  53  -2.110 -11.615  12.603
    3    HB2  LEU  53           HB2      LEU  53  -4.564 -10.387  13.836
    4    HB3  LEU  53           HB3      LEU  53  -4.140 -12.075  14.117
    5    HG   LEU  53           HG       LEU  53  -2.191  -9.798  14.596
    6   HD12  LEU  53          HD11      LEU  53  -3.928 -11.209  16.641
    7   HD11  LEU  53          HD12      LEU  53  -4.257  -9.596  16.007
    8   HD13  LEU  53          HD13      LEU  53  -2.797  -9.894  16.943
    9   HD22  LEU  53          HD21      LEU  53  -0.948 -11.803  14.542
   10   HD21  LEU  53          HD22      LEU  53  -2.265 -12.744  15.236
   11   HD23  LEU  53          HD23      LEU  53  -1.331 -11.664  16.254

  No H/Q in entry =          11
  In of MODEL   30
    1    H    VAL  54           H        VAL  54  -5.208 -10.523  11.260
    2    HA   VAL  54           HA       VAL  54  -6.175 -13.097  10.571
    3    HB   VAL  54           HB       VAL  54  -6.776 -10.349   9.448
    4   HG12  VAL  54          HG11      VAL  54  -8.908 -11.684   8.643
    5   HG11  VAL  54          HG12      VAL  54  -7.822 -13.071   8.706
    6   HG13  VAL  54          HG13      VAL  54  -7.442 -11.701   7.666
    7   HG22  VAL  54          HG21      VAL  54  -7.672 -10.376  11.604
    8   HG21  VAL  54          HG22      VAL  54  -7.959 -12.114  11.581
    9   HG23  VAL  54          HG23      VAL  54  -9.025 -11.034  10.683

  No H/Q in entry =           9
  In of MODEL   30
    1    H    GLN  55           H        GLN  55  -4.266 -10.677   8.779
    2    HA   GLN  55           HA       GLN  55  -4.177 -12.137   6.356
    3    HB2  GLN  55           HB2      GLN  55  -3.531  -9.884   6.170
    4    HB3  GLN  55           HB3      GLN  55  -2.414  -9.986   7.528
    5    HG2  GLN  55           HG2      GLN  55  -0.721 -10.862   6.241
    6    HG3  GLN  55           HG3      GLN  55  -1.818 -11.813   5.250
    7   HE21  GLN  55          HE21      GLN  55  -1.833 -11.117   3.130
    8   HE22  GLN  55          HE22      GLN  55  -1.606  -9.515   2.624

  No H/Q in entry =           8
  In of MODEL   30
    1    H    THR  56           H        THR  56  -2.056 -12.165   9.226
    2    HA   THR  56           HA       THR  56  -0.015 -13.802   8.293
    3    HB   THR  56           HB       THR  56  -1.248 -14.033  11.047
    4    HG1  THR  56           HG1      THR  56  -0.765 -11.843  10.288
    5   HG23  THR  56          HG21      THR  56   0.422 -15.688  10.783
    6   HG22  THR  56          HG22      THR  56   1.256 -14.351  11.578
    7   HG21  THR  56          HG23      THR  56   1.457 -14.611   9.845

  No H/Q in entry =           7
  In of MODEL   30
    1    H    LYS  57           H        LYS  57  -3.147 -14.780   9.670
    2    HA   LYS  57           HA       LYS  57  -2.758 -17.584   9.414
    3    HB2  LYS  57           HB2      LYS  57  -4.547 -16.469  10.774
    4    HB3  LYS  57           HB3      LYS  57  -5.335 -15.987   9.280
    5    HG2  LYS  57           HG2      LYS  57  -5.609 -18.350   8.648
    6    HG3  LYS  57           HG3      LYS  57  -4.813 -18.846  10.139
    7    HD2  LYS  57           HD2      LYS  57  -7.282 -17.104  10.173
    8    HD3  LYS  57           HD3      LYS  57  -7.393 -18.863  10.132
    9    HE2  LYS  57           HE2      LYS  57  -5.888 -18.906  12.180
   10    HE3  LYS  57           HE3      LYS  57  -6.076 -17.156  12.280
   11    HZ3  LYS  57           HZ1      LYS  57  -7.859 -17.654  13.500
   12    HZ2  LYS  57           HZ2      LYS  57  -7.943 -19.253  12.931
   13    HZ1  LYS  57           HZ3      LYS  57  -8.616 -17.988  12.017

  No H/Q in entry =          13
  In of MODEL   30
    1    H    LEU  58           H        LEU  58  -4.052 -15.109   7.252
    2    HA   LEU  58           HA       LEU  58  -4.901 -16.912   5.245
    3    HB2  LEU  58           HB2      LEU  58  -4.237 -13.976   5.115
    4    HB3  LEU  58           HB3      LEU  58  -4.926 -14.896   3.776
    5    HG   LEU  58           HG       LEU  58  -6.187 -14.698   6.530
    6   HD11  LEU  58          HD11      LEU  58  -6.467 -13.039   4.045
    7   HD13  LEU  58          HD12      LEU  58  -6.438 -12.536   5.735
    8   HD12  LEU  58          HD13      LEU  58  -7.880 -13.299   5.069
    9   HD22  LEU  58          HD21      LEU  58  -7.192 -16.585   5.661
   10   HD21  LEU  58          HD22      LEU  58  -6.853 -16.136   3.990
   11   HD23  LEU  58          HD23      LEU  58  -8.197 -15.385   4.850

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  59           H        ILE  59  -1.738 -15.767   6.093
    2    HA   ILE  59           HA       ILE  59  -0.668 -16.509   3.449
    3    HB   ILE  59           HB       ILE  59   0.149 -14.463   5.014
    4   HG12  ILE  59          HG12      ILE  59   2.200 -16.162   3.577
    5   HG13  ILE  59          HG13      ILE  59   1.028 -15.189   2.728
    6   HG21  ILE  59          HG21      ILE  59   0.858 -16.224   6.786
    7   HG23  ILE  59          HG22      ILE  59   2.012 -14.972   6.387
    8   HG22  ILE  59          HG23      ILE  59   2.182 -16.589   5.705
    9   HD12  ILE  59          HD11      ILE  59   3.016 -14.156   4.748
   10   HD11  ILE  59          HD12      ILE  59   1.827 -13.169   3.902
   11   HD13  ILE  59          HD13      ILE  59   3.130 -13.945   3.003

  No H/Q in entry =          11
  In of MODEL   30
    1    H    GLU  60           H        GLU  60  -0.684 -17.624   6.814
    2    HA   GLU  60           HA       GLU  60   1.305 -19.642   6.534
    3    HB2  GLU  60           HB2      GLU  60   0.585 -18.862   8.731
    4    HB3  GLU  60           HB3      GLU  60  -1.048 -19.454   8.433
    5    HG2  GLU  60           HG2      GLU  60   1.318 -21.320   8.285
    6    HG3  GLU  60           HG3      GLU  60   0.556 -20.946   9.830

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLY  61           H        GLY  61  -2.210 -19.668   6.065
    2    HA3  GLY  61           HA2      GLY  61  -2.023 -22.462   5.099
    3    HA2  GLY  61           HA3      GLY  61  -3.490 -21.698   5.701

  No H/Q in entry =           3
  In of MODEL   30
    1    H    ASP  62           H        ASP  62  -1.240 -20.157   3.492
    2    HA   ASP  62           HA       ASP  62  -3.342 -19.609   1.612
    3    HB2  ASP  62           HB2      ASP  62  -1.492 -18.508   0.340
    4    HB3  ASP  62           HB3      ASP  62  -1.640 -17.945   2.001

  No H/Q in entry =           4
  In of MODEL   30
    1    H    ALA  63           H        ALA  63  -2.093 -22.491   2.082
    2    HA   ALA  63           HA       ALA  63  -0.859 -23.399  -0.254
    3    HB2  ALA  63           HB1      ALA  63  -2.933 -25.086   1.074
    4    HB1  ALA  63           HB2      ALA  63  -1.478 -24.634   1.962
    5    HB3  ALA  63           HB3      ALA  63  -1.343 -25.540   0.454

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLY  64           H        GLY  64  -4.326 -23.189   0.520
    2    HA3  GLY  64           HA2      GLY  64  -6.203 -23.147  -0.792
    3    HA2  GLY  64           HA3      GLY  64  -5.193 -22.403  -2.020

  No H/Q in entry =           3
  In of MODEL   30
    1    H    GLU  65           H        GLU  65  -5.498 -23.454  -3.905
    2    HA   GLU  65           HA       GLU  65  -6.490 -26.069  -4.115
    3    HB2  GLU  65           HB2      GLU  65  -5.019 -24.359  -6.117
    4    HB3  GLU  65           HB3      GLU  65  -5.767 -25.908  -6.511
    5    HG2  GLU  65           HG2      GLU  65  -7.948 -25.079  -5.792
    6    HG3  GLU  65           HG3      GLU  65  -7.229 -23.555  -5.283

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLY  66           H        GLY  66  -5.307 -27.641  -5.649
    2    HA3  GLY  66           HA2      GLY  66  -3.255 -28.921  -4.205
    3    HA2  GLY  66           HA3      GLY  66  -3.820 -29.356  -5.805

  No H/Q in entry =           3
  In of MODEL   30
    1    H    LYS  67           H        LYS  67  -3.164 -26.822  -7.005
    2    HA   LYS  67           HA       LYS  67  -0.465 -27.381  -7.721
    3    HB2  LYS  67           HB2      LYS  67  -2.379 -25.195  -8.522
    4    HB3  LYS  67           HB3      LYS  67  -0.772 -25.401  -9.229
    5    HG2  LYS  67           HG2      LYS  67  -1.336 -27.705  -9.883
    6    HG3  LYS  67           HG3      LYS  67  -2.932 -27.530  -9.158
    7    HD2  LYS  67           HD2      LYS  67  -3.464 -25.724 -10.750
    8    HD3  LYS  67           HD3      LYS  67  -1.863 -25.892 -11.474
    9    HE2  LYS  67           HE2      LYS  67  -2.371 -28.233 -12.065
   10    HE3  LYS  67           HE3      LYS  67  -3.972 -28.067 -11.345
   11    HZ3  LYS  67           HZ1      LYS  67  -4.113 -27.747 -13.704
   12    HZ2  LYS  67           HZ2      LYS  67  -2.910 -26.548 -13.664
   13    HZ1  LYS  67           HZ3      LYS  67  -4.417 -26.268 -12.934

  No H/Q in entry =          13
  In of MODEL   30
    1    H    MET  68           H        MET  68   1.319 -26.046  -7.708
    2    HA   MET  68           HA       MET  68   2.155 -25.044  -5.295
    3    HB2  MET  68           HB2      MET  68   3.092 -24.345  -8.078
    4    HB3  MET  68           HB3      MET  68   3.968 -23.930  -6.603
    5    HG2  MET  68           HG2      MET  68   3.171 -26.748  -7.385
    6    HG3  MET  68           HG3      MET  68   4.773 -26.056  -7.649
    7    HE3  MET  68           HE1      MET  68   6.446 -25.675  -4.446
    8    HE2  MET  68           HE2      MET  68   5.383 -24.332  -4.862
    9    HE1  MET  68           HE3      MET  68   6.230 -25.204  -6.138

  No H/Q in entry =           9
  In of MODEL   30
    1    H    LYS  69           H        LYS  69  -0.121 -23.527  -7.257
    2    HA   LYS  69           HA       LYS  69   0.632 -20.814  -6.800
    3    HB2  LYS  69           HB2      LYS  69  -1.918 -22.023  -7.823
    4    HB3  LYS  69           HB3      LYS  69  -1.650 -20.281  -7.680
    5    HG2  LYS  69           HG2      LYS  69   0.344 -20.450  -9.099
    6    HG3  LYS  69           HG3      LYS  69   0.119 -22.195  -9.229
    7    HD2  LYS  69           HD2      LYS  69  -2.092 -21.811 -10.288
    8    HD3  LYS  69           HD3      LYS  69  -1.807 -20.071 -10.213
    9    HE2  LYS  69           HE2      LYS  69   0.016 -22.034 -11.632
   10    HE3  LYS  69           HE3      LYS  69  -1.221 -21.070 -12.437
   11    HZ2  LYS  69           HZ1      LYS  69   1.151 -20.079 -10.962
   12    HZ1  LYS  69           HZ2      LYS  69  -0.118 -19.076 -11.483
   13    HZ3  LYS  69           HZ3      LYS  69   0.827 -19.916 -12.619

  No H/Q in entry =          13
  In of MODEL   30
    1    H    VAL  70           H        VAL  70  -0.646 -19.160  -5.726
    2    HA   VAL  70           HA       VAL  70  -1.959 -20.136  -3.249
    3    HB   VAL  70           HB       VAL  70  -1.029 -18.133  -2.125
    4   HG11  VAL  70          HG11      VAL  70   0.199 -20.395  -2.318
    5   HG13  VAL  70          HG12      VAL  70   1.155 -18.996  -1.826
    6   HG12  VAL  70          HG13      VAL  70   1.241 -19.582  -3.487
    7   HG22  VAL  70          HG21      VAL  70  -0.657 -16.458  -3.704
    8   HG21  VAL  70          HG22      VAL  70  -0.041 -17.592  -4.904
    9   HG23  VAL  70          HG23      VAL  70   0.983 -17.094  -3.562

  No H/Q in entry =           9
  In of MODEL   30
    1    H    SER  71           H        SER  71  -3.321 -18.364  -2.254
    2    HA   SER  71           HA       SER  71  -5.378 -17.555  -4.010
    3    HB2  SER  71           HB2      SER  71  -5.575 -17.852  -1.490
    4    HB3  SER  71           HB3      SER  71  -4.731 -16.319  -1.313
    5    HG   SER  71           HG       SER  71  -7.225 -16.836  -2.556

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU  72           H        LEU  72  -5.474 -15.934  -5.371
    2    HA   LEU  72           HA       LEU  72  -3.334 -14.162  -5.860
    3    HB2  LEU  72           HB2      LEU  72  -6.205 -14.152  -6.787
    4    HB3  LEU  72           HB3      LEU  72  -4.985 -13.023  -7.371
    5    HG   LEU  72           HG       LEU  72  -4.666 -16.041  -7.511
    6   HD12  LEU  72          HD11      LEU  72  -5.179 -15.717  -9.951
    7   HD11  LEU  72          HD12      LEU  72  -5.668 -14.063  -9.579
    8   HD13  LEU  72          HD13      LEU  72  -6.560 -15.422  -8.895
    9   HD21  LEU  72          HD21      LEU  72  -3.113 -13.664  -8.513
   10   HD23  LEU  72          HD22      LEU  72  -3.065 -15.157  -9.437
   11   HD22  LEU  72          HD23      LEU  72  -2.512 -15.140  -7.765

  No H/Q in entry =          11
  In of MODEL   30
    1    H    VAL  73           H        VAL  73  -6.410 -13.751  -4.210
    2    HA   VAL  73           HA       VAL  73  -6.400 -10.981  -3.850
    3    HB   VAL  73           HB       VAL  73  -8.136 -11.302  -2.306
    4   HG12  VAL  73          HG11      VAL  73  -8.182 -13.805  -4.009
    5   HG11  VAL  73          HG12      VAL  73  -8.532 -12.196  -4.637
    6   HG13  VAL  73          HG13      VAL  73  -9.569 -12.903  -3.398
    7   HG21  VAL  73          HG21      VAL  73  -6.817 -13.975  -1.801
    8   HG23  VAL  73          HG22      VAL  73  -8.469 -13.638  -1.283
    9   HG22  VAL  73          HG23      VAL  73  -7.132 -12.681  -0.645

  No H/Q in entry =           9
  In of MODEL   30
    1    H    LEU  74           H        LEU  74  -4.498 -13.391  -2.286
    2    HA   LEU  74           HA       LEU  74  -4.050 -12.266   0.238
    3    HB2  LEU  74           HB2      LEU  74  -3.312 -14.498  -0.272
    4    HB3  LEU  74           HB3      LEU  74  -2.255 -13.902  -1.552
    5    HG   LEU  74           HG       LEU  74  -0.907 -12.686   0.120
    6   HD13  LEU  74          HD11      LEU  74  -2.436 -12.143   1.851
    7   HD12  LEU  74          HD12      LEU  74  -1.401 -13.381   2.567
    8   HD11  LEU  74          HD13      LEU  74  -3.008 -13.805   1.978
    9   HD22  LEU  74          HD21      LEU  74   0.262 -14.560   0.743
   10   HD21  LEU  74          HD22      LEU  74  -0.802 -15.248  -0.463
   11   HD23  LEU  74          HD23      LEU  74  -1.189 -15.433   1.232

  No H/Q in entry =          11
  In of MODEL   30
    1    H    VAL  75           H        VAL  75  -2.170 -11.899  -2.730
    2    HA   VAL  75           HA       VAL  75  -0.330 -10.013  -1.724
    3    HB   VAL  75           HB       VAL  75  -1.313 -10.462  -4.545
    4   HG12  VAL  75          HG11      VAL  75   0.784  -9.203  -5.165
    5   HG11  VAL  75          HG12      VAL  75   0.998  -8.809  -3.466
    6   HG13  VAL  75          HG13      VAL  75  -0.396  -8.195  -4.338
    7   HG23  VAL  75          HG21      VAL  75   1.312 -11.229  -3.234
    8   HG22  VAL  75          HG22      VAL  75   0.670 -11.794  -4.777
    9   HG21  VAL  75          HG23      VAL  75  -0.080 -12.313  -3.266

  No H/Q in entry =           9
  In of MODEL   30
    1    H    GLU  76           H        GLU  76  -3.484  -9.600  -3.361
    2    HA   GLU  76           HA       GLU  76  -3.482  -6.784  -3.453
    3    HB2  GLU  76           HB2      GLU  76  -5.177  -8.168  -4.615
    4    HB3  GLU  76           HB3      GLU  76  -5.820  -8.691  -3.067
    5    HG2  GLU  76           HG2      GLU  76  -7.262  -6.945  -3.899
    6    HG3  GLU  76           HG3      GLU  76  -6.363  -6.271  -2.552

  No H/Q in entry =           6
  In of MODEL   30
    1    H    ALA  77           H        ALA  77  -4.619  -9.000  -0.914
    2    HA   ALA  77           HA       ALA  77  -5.526  -6.986   0.858
    3    HB2  ALA  77           HB1      ALA  77  -5.087  -8.839   2.613
    4    HB1  ALA  77           HB2      ALA  77  -4.666  -9.846   1.228
    5    HB3  ALA  77           HB3      ALA  77  -6.281  -9.152   1.354

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLN  78           H        GLN  78  -2.412  -8.594   0.468
    2    HA   GLN  78           HA       GLN  78  -1.117  -7.467   2.714
    3    HB2  GLN  78           HB2      GLN  78  -0.303  -9.419   1.346
    4    HB3  GLN  78           HB3      GLN  78   0.149  -8.276   0.083
    5    HG2  GLN  78           HG2      GLN  78   1.641  -7.117   1.660
    6    HG3  GLN  78           HG3      GLN  78   1.192  -8.255   2.928
    7   HE21  GLN  78          HE21      GLN  78   3.913  -8.040   2.091
    8   HE22  GLN  78          HE22      GLN  78   4.344  -9.471   1.285

  No H/Q in entry =           8
  In of MODEL   30
    1    H    LEU  79           H        LEU  79  -1.484  -6.387  -0.627
    2    HA   LEU  79           HA       LEU  79   0.246  -4.194  -0.616
    3    HB2  LEU  79           HB2      LEU  79  -0.810  -4.973  -2.666
    4    HB3  LEU  79           HB3      LEU  79  -2.401  -4.551  -2.046
    5    HG   LEU  79           HG       LEU  79  -1.809  -2.176  -2.016
    6   HD13  LEU  79          HD11      LEU  79   0.438  -1.979  -1.517
    7   HD12  LEU  79          HD12      LEU  79   0.482  -1.686  -3.255
    8   HD11  LEU  79          HD13      LEU  79   0.909  -3.275  -2.617
    9   HD23  LEU  79          HD21      LEU  79  -1.187  -1.981  -4.572
   10   HD22  LEU  79          HD22      LEU  79  -2.726  -2.700  -4.105
   11   HD21  LEU  79          HD23      LEU  79  -1.376  -3.734  -4.562

  No H/Q in entry =          11
  In of MODEL   30
    1    H    HIS  80           H        HIS  80  -3.218  -4.289   0.231
    2    HA   HIS  80           HA       HIS  80  -3.349  -1.532   0.905
    3    HB2  HIS  80           HB2      HIS  80  -5.097  -3.907   1.227
    4    HB3  HIS  80           HB3      HIS  80  -5.384  -2.564   2.337
    5    HD1  HIS  80           HD1      HIS  80  -6.973  -0.892   1.446
    6    HD2  HIS  80           HD2      HIS  80  -4.837  -2.738  -1.622
    7    HE1  HIS  80           HE1      HIS  80  -7.806   0.130  -0.725
    8    HE2  HIS  80           HE2      HIS  80  -6.510  -0.990  -2.604

  No H/Q in entry =           8
  In of MODEL   30
    1    H    LEU  81           H        LEU  81  -2.907  -4.443   2.886
    2    HA   LEU  81           HA       LEU  81  -2.851  -3.105   5.374
    3    HB2  LEU  81           HB2      LEU  81  -1.693  -5.743   4.478
    4    HB3  LEU  81           HB3      LEU  81  -1.645  -5.191   6.153
    5    HG   LEU  81           HG       LEU  81  -4.205  -5.385   4.541
    6   HD12  LEU  81          HD11      LEU  81  -4.541  -7.449   6.083
    7   HD11  LEU  81          HD12      LEU  81  -2.786  -7.415   6.258
    8   HD13  LEU  81          HD13      LEU  81  -3.510  -7.625   4.663
    9   HD23  LEU  81          HD21      LEU  81  -5.036  -5.579   7.047
   10   HD22  LEU  81          HD22      LEU  81  -4.683  -3.995   6.360
   11   HD21  LEU  81          HD23      LEU  81  -3.506  -4.783   7.410

  No H/Q in entry =          11
  In of MODEL   30
    1    H    MET  82           H        MET  82  -0.203  -4.057   3.183
    2    HA   MET  82           HA       MET  82   1.908  -3.212   4.856
    3    HB2  MET  82           HB2      MET  82   1.667  -3.538   1.865
    4    HB3  MET  82           HB3      MET  82   3.166  -3.002   2.620
    5    HG2  MET  82           HG2      MET  82   1.709  -5.563   3.345
    6    HG3  MET  82           HG3      MET  82   3.076  -5.479   2.237
    7    HE3  MET  82           HE1      MET  82   6.119  -4.813   4.203
    8    HE2  MET  82           HE2      MET  82   5.221  -3.425   3.596
    9    HE1  MET  82           HE3      MET  82   5.272  -4.913   2.654

  No H/Q in entry =           9
  In of MODEL   30
    1    H    THR  83           H        THR  83   0.105  -1.523   2.317
    2    HA   THR  83           HA       THR  83   1.569   0.894   2.402
    3    HB   THR  83           HB       THR  83  -0.593   1.869   1.433
    4    HG1  THR  83           HG1      THR  83  -2.271   0.607   1.333
    5   HG22  THR  83          HG21      THR  83  -0.374   0.052  -0.575
    6   HG21  THR  83          HG22      THR  83   1.125  -0.275   0.291
    7   HG23  THR  83          HG23      THR  83   0.795   1.348  -0.316

  No H/Q in entry =           7
  In of MODEL   30
    1    H    SER  84           H        SER  84  -1.448  -0.079   4.020
    2    HA   SER  84           HA       SER  84  -1.883   2.356   5.375
    3    HB2  SER  84           HB2      SER  84  -2.773  -0.465   5.936
    4    HB3  SER  84           HB3      SER  84  -3.231   0.883   6.977
    5    HG   SER  84           HG       SER  84  -3.714   0.588   4.186

  No H/Q in entry =           5
  In of MODEL   30
    1    H    MET  85           H        MET  85  -0.229  -0.615   6.484
    2    HA   MET  85           HA       MET  85   0.327   0.291   9.088
    3    HB2  MET  85           HB2      MET  85   0.564  -2.056   8.400
    4    HB3  MET  85           HB3      MET  85   1.950  -1.619   7.400
    5    HG2  MET  85           HG2      MET  85   3.140  -0.799   9.406
    6    HG3  MET  85           HG3      MET  85   1.755  -1.242  10.404
    7    HE1  MET  85           HE1      MET  85   0.752  -3.624  10.515
    8    HE3  MET  85           HE2      MET  85   1.904  -3.275  11.802
    9    HE2  MET  85           HE3      MET  85   1.917  -4.852  11.021

  No H/Q in entry =           9
  In of MODEL   30
    1    H    LEU  86           H        LEU  86   2.248   0.514   6.125
    2    HA   LEU  86           HA       LEU  86   4.497   1.773   7.270
    3    HB2  LEU  86           HB2      LEU  86   4.267   0.702   4.959
    4    HB3  LEU  86           HB3      LEU  86   3.489   2.203   4.457
    5    HG   LEU  86           HG       LEU  86   5.550   3.401   5.428
    6   HD11  LEU  86          HD11      LEU  86   6.203   0.772   6.215
    7   HD13  LEU  86          HD12      LEU  86   7.238   2.195   6.310
    8   HD12  LEU  86          HD13      LEU  86   7.315   1.149   4.894
    9   HD23  LEU  86          HD21      LEU  86   6.212   1.631   3.067
   10   HD22  LEU  86          HD22      LEU  86   6.645   3.318   3.332
   11   HD21  LEU  86          HD23      LEU  86   4.980   2.887   2.943

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ALA  87           H        ALA  87   1.603   3.085   5.709
    2    HA   ALA  87           HA       ALA  87   2.257   5.801   5.797
    3    HB1  ALA  87           HB1      ALA  87  -0.091   4.226   5.266
    4    HB3  ALA  87           HB2      ALA  87   0.253   5.881   4.769
    5    HB2  ALA  87           HB3      ALA  87  -0.537   5.572   6.317

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ARG  88           H        ARG  88   0.539   3.829   8.192
    2    HA   ARG  88           HA       ARG  88   0.085   5.883  10.048
    3    HB2  ARG  88           HB2      ARG  88  -0.904   3.552  10.114
    4    HB3  ARG  88           HB3      ARG  88   0.630   3.016  10.808
    5    HG2  ARG  88           HG2      ARG  88   0.209   5.095  12.437
    6    HG3  ARG  88           HG3      ARG  88  -1.467   4.808  11.991
    7    HD2  ARG  88           HD2      ARG  88  -1.607   2.958  13.233
    8    HD3  ARG  88           HD3      ARG  88  -0.034   2.343  12.690
    9    HE   ARG  88           HE       ARG  88  -0.524   3.610  15.151
   10   HH21  ARG  88          HH11      ARG  88   1.064   4.584  16.382
   11   HH22  ARG  88          HH12      ARG  88   2.588   4.980  15.669
   12   HH11  ARG  88          HH21      ARG  88   1.743   3.750  12.560
   13   HH12  ARG  88          HH22      ARG  88   2.980   4.491  13.516

  No H/Q in entry =          13
  In of MODEL   30
    1    H    GLU  89           H        GLU  89   2.831   3.605   9.800
    2    HA   GLU  89           HA       GLU  89   4.127   4.459  12.138
    3    HB2  GLU  89           HB2      GLU  89   4.733   2.431  10.784
    4    HB3  GLU  89           HB3      GLU  89   5.525   3.512   9.636
    5    HG2  GLU  89           HG2      GLU  89   7.039   4.321  11.372
    6    HG3  GLU  89           HG3      GLU  89   6.192   3.379  12.595

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LEU  90           H        LEU  90   4.447   5.620   8.812
    2    HA   LEU  90           HA       LEU  90   6.423   7.577   9.390
    3    HB2  LEU  90           HB2      LEU  90   4.396   7.295   7.175
    4    HB3  LEU  90           HB3      LEU  90   5.654   8.539   7.192
    5    HG   LEU  90           HG       LEU  90   6.267   5.588   7.513
    6   HD12  LEU  90          HD11      LEU  90   7.004   5.813   5.069
    7   HD11  LEU  90          HD12      LEU  90   6.019   7.274   5.031
    8   HD13  LEU  90          HD13      LEU  90   5.269   5.716   5.375
    9   HD22  LEU  90          HD21      LEU  90   8.192   6.695   8.186
   10   HD21  LEU  90          HD22      LEU  90   7.866   8.110   7.185
   11   HD23  LEU  90          HD23      LEU  90   8.490   6.634   6.450

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  91           H        ILE  91   2.885   7.667   9.265
    2    HA   ILE  91           HA       ILE  91   2.603  10.445   9.726
    3    HB   ILE  91           HB       ILE  91   0.767   8.106  10.273
    4   HG12  ILE  91          HG12      ILE  91   0.553  10.398   8.296
    5   HG13  ILE  91          HG13      ILE  91   1.379   8.887   7.914
    6   HG22  ILE  91          HG21      ILE  91  -0.922  10.199  10.354
    7   HG21  ILE  91          HG22      ILE  91   0.501  10.998  11.020
    8   HG23  ILE  91          HG23      ILE  91  -0.161   9.572  11.816
    9   HD13  ILE  91          HD11      ILE  91  -0.591   7.640   7.968
   10   HD12  ILE  91          HD12      ILE  91  -1.153   9.169   7.294
   11   HD11  ILE  91          HD13      ILE  91  -1.421   8.806   8.999

  No H/Q in entry =          11
  In of MODEL   30
    1    H    THR  92           H        THR  92   2.964   7.689  11.916
    2    HA   THR  92           HA       THR  92   2.564   9.065  14.347
    3    HB   THR  92           HB       THR  92   4.320   6.695  13.664
    4    HG1  THR  92           HG1      THR  92   2.336   5.979  13.574
    5   HG22  THR  92          HG21      THR  92   3.948   6.411  16.299
    6   HG21  THR  92          HG22      THR  92   3.919   8.172  16.231
    7   HG23  THR  92          HG23      THR  92   5.330   7.289  15.647

  No H/Q in entry =           7
  In of MODEL   30
    1    H    GLU  93           H        GLU  93   5.493   8.562  12.393
    2    HA   GLU  93           HA       GLU  93   7.286   9.948  14.083
    3    HB2  GLU  93           HB2      GLU  93   7.349   9.640  11.066
    4    HB3  GLU  93           HB3      GLU  93   8.706  10.141  12.074
    5    HG2  GLU  93           HG2      GLU  93   7.247   7.532  12.523
    6    HG3  GLU  93           HG3      GLU  93   8.627   7.659  11.439

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LEU  94           H        LEU  94   5.241  11.011  11.386
    2    HA   LEU  94           HA       LEU  94   6.099  13.699  11.287
    3    HB2  LEU  94           HB2      LEU  94   3.478  12.387  10.546
    4    HB3  LEU  94           HB3      LEU  94   3.768  14.110  10.308
    5    HG   LEU  94           HG       LEU  94   5.740  12.086   9.240
    6   HD11  LEU  94          HD11      LEU  94   3.003  12.693   8.196
    7   HD13  LEU  94          HD12      LEU  94   3.956  11.218   8.061
    8   HD12  LEU  94          HD13      LEU  94   4.312  12.594   7.018
    9   HD23  LEU  94          HD21      LEU  94   6.015  13.921   7.520
   10   HD22  LEU  94          HD22      LEU  94   6.450  14.401   9.161
   11   HD21  LEU  94          HD23      LEU  94   4.904  14.901   8.473

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  95           H        ILE  95   3.542  12.127  13.190
    2    HA   ILE  95           HA       ILE  95   2.552  14.493  14.398
    3    HB   ILE  95           HB       ILE  95   2.519  11.609  15.315
    4   HG12  ILE  95          HG12      ILE  95   0.327  13.428  14.284
    5   HG13  ILE  95          HG13      ILE  95   1.256  12.353  13.243
    6   HG21  ILE  95          HG21      ILE  95   1.292  14.102  16.531
    7   HG23  ILE  95          HG22      ILE  95   2.322  12.912  17.326
    8   HG22  ILE  95          HG23      ILE  95   0.676  12.483  16.860
    9   HD13  ILE  95          HD11      ILE  95   0.322  10.430  14.163
   10   HD12  ILE  95          HD12      ILE  95  -1.039  11.545  14.250
   11   HD11  ILE  95          HD13      ILE  95  -0.071  11.225  15.689

  No H/Q in entry =          11
  In of MODEL   30
    1    H    GLU  96           H        GLU  96   5.110  12.223  15.372
    2    HA   GLU  96           HA       GLU  96   5.703  13.404  17.863
    3    HB2  GLU  96           HB2      GLU  96   6.606  11.229  17.204
    4    HB3  GLU  96           HB3      GLU  96   7.546  11.988  15.921
    5    HG2  GLU  96           HG2      GLU  96   9.213  12.502  17.375
    6    HG3  GLU  96           HG3      GLU  96   8.089  13.334  18.439

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LEU  97           H        LEU  97   6.772  14.164  14.573
    2    HA   LEU  97           HA       LEU  97   8.699  16.124  15.278
    3    HB2  LEU  97           HB2      LEU  97   7.083  15.610  12.791
    4    HB3  LEU  97           HB3      LEU  97   8.129  17.022  12.911
    5    HG   LEU  97           HG       LEU  97   9.110  14.205  13.457
    6   HD12  LEU  97          HD11      LEU  97  10.096  14.387  11.135
    7   HD11  LEU  97          HD12      LEU  97   9.069  15.797  10.881
    8   HD13  LEU  97          HD13      LEU  97   8.342  14.217  11.176
    9   HD23  LEU  97          HD21      LEU  97  11.298  15.446  12.705
   10   HD22  LEU  97          HD22      LEU  97  10.693  15.722  14.338
   11   HD21  LEU  97          HD23      LEU  97  10.393  16.914  13.075

  No H/Q in entry =          11
  In of MODEL   30
    1    H    HIS  98           H        HIS  98   5.207  16.324  14.645
    2    HA   HIS  98           HA       HIS  98   4.959  19.129  14.789
    3    HB2  HIS  98           HB2      HIS  98   3.033  16.911  15.521
    4    HB3  HIS  98           HB3      HIS  98   2.597  18.619  15.584
    5    HD1  HIS  98           HD1      HIS  98   3.555  15.893  13.166
    6    HD2  HIS  98           HD2      HIS  98   2.250  19.851  13.062
    7    HE1  HIS  98           HE1      HIS  98   2.990  16.398  10.746
    8    HE2  HIS  98           HE2      HIS  98   2.199  18.802  10.662

  No H/Q in entry =           8
  In of MODEL   30
    1    H    GLU  99           H        GLU  99   5.062  16.632  17.281
    2    HA   GLU  99           HA       GLU  99   4.498  18.331  19.487
    3    HB2  GLU  99           HB2      GLU  99   4.365  15.851  19.578
    4    HB3  GLU  99           HB3      GLU  99   6.123  15.774  19.459
    5    HG2  GLU  99           HG2      GLU  99   6.347  17.057  21.536
    6    HG3  GLU  99           HG3      GLU  99   4.598  17.230  21.642

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LYS 100           H        LYS 100   7.525  17.349  17.901
    2    HA   LYS 100           HA       LYS 100   9.216  18.715  19.752
    3    HB2  LYS 100           HB2      LYS 100   9.681  17.789  16.908
    4    HB3  LYS 100           HB3      LYS 100  10.931  18.534  17.910
    5    HG2  LYS 100           HG2      LYS 100  10.533  16.786  19.649
    6    HG3  LYS 100           HG3      LYS 100   9.380  16.006  18.563
    7    HD2  LYS 100           HD2      LYS 100  11.159  15.695  16.884
    8    HD3  LYS 100           HD3      LYS 100  12.317  16.487  17.956
    9    HE2  LYS 100           HE2      LYS 100  11.899  14.734  19.672
   10    HE3  LYS 100           HE3      LYS 100  10.803  13.921  18.551
   11    HZ1  LYS 100           HZ1      LYS 100  13.631  14.541  17.880
   12    HZ3  LYS 100           HZ2      LYS 100  12.563  13.508  17.056
   13    HZ2  LYS 100           HZ3      LYS 100  13.153  13.074  18.589

  No H/Q in entry =          13
  In of MODEL   30
    1    H    LEU 101           H        LEU 101   7.522  19.680  16.809
    2    HA   LEU 101           HA       LEU 101   8.780  22.216  16.473
    3    HB2  LEU 101           HB2      LEU 101   6.158  21.032  15.599
    4    HB3  LEU 101           HB3      LEU 101   6.439  22.758  15.394
    5    HG   LEU 101           HG       LEU 101   8.432  20.708  14.411
    6   HD12  LEU 101          HD11      LEU 101   7.275  21.241  12.134
    7   HD11  LEU 101          HD12      LEU 101   5.889  21.694  13.124
    8   HD13  LEU 101          HD13      LEU 101   6.524  20.051  13.198
    9   HD21  LEU 101          HD21      LEU 101   7.854  23.633  13.867
   10   HD23  LEU 101          HD22      LEU 101   8.810  22.658  12.752
   11   HD22  LEU 101          HD23      LEU 101   9.367  22.901  14.407

  No H/Q in entry =          11
  In of MODEL   30
    1    H    LYS 102           H        LYS 102   7.238  21.099  19.095
    2    HA   LYS 102           HA       LYS 102   6.638  22.197  21.034
    3    HB2  LYS 102           HB2      LYS 102   7.950  24.166  19.907
    4    HB3  LYS 102           HB3      LYS 102   6.360  24.801  19.542
    5    HG2  LYS 102           HG2      LYS 102   7.748  24.513  22.185
    6    HG3  LYS 102           HG3      LYS 102   6.816  25.860  21.566
    7    HD2  LYS 102           HD2      LYS 102   5.530  23.245  22.445
    8    HD3  LYS 102           HD3      LYS 102   5.809  24.598  23.530
    9    HE2  LYS 102           HE2      LYS 102   3.514  24.241  22.054
   10    HE3  LYS 102           HE3      LYS 102   4.050  25.776  22.737
   11    HZ2  LYS 102           HZ1      LYS 102   3.507  25.900  20.361
   12    HZ1  LYS 102           HZ2      LYS 102   4.746  24.796  20.028
   13    HZ3  LYS 102           HZ3      LYS 102   5.121  26.318  20.673

  No H/Q in entry =          13
  In of MODEL   30
    1    H    ALA 103           H        ALA 103   5.012  23.777  18.280
    2    HA   ALA 103           HA       ALA 103   2.574  24.396  19.182
    3    HB1  ALA 103           HB1      ALA 103   1.647  23.578  16.943
    4    HB2  ALA 103           HB2      ALA 103   3.282  23.011  16.602
    5    HB3  ALA 103           HB3      ALA 103   2.980  24.728  16.875

  No H/Q in entry =           5
  In of MODEL   30
    1    H1   ALA   1           H3       ALA   1  10.193 -20.184  -6.264
    2    H2   ALA   1           H2       ALA   1   9.217 -20.368  -7.645
    3    H3   ALA   1           H1       ALA   1   8.774 -21.110  -6.181
    4    HA   ALA   1           HA       ALA   1   9.775 -22.936  -6.932
    5    HB1  ALA   1           HB1      ALA   1   9.863 -22.573  -9.207
    6    HB2  ALA   1           HB2      ALA   1  11.595 -22.456  -8.889
    7    HB3  ALA   1           HB3      ALA   1  10.623 -20.990  -9.029

  No H/Q in entry =           7
  In of MODEL   30
    1    H    GLU   2           H        GLU   2  12.039 -23.930  -7.007
    2    HA   GLU   2           HA       GLU   2  13.436 -23.882  -4.804
    3    HB2  GLU   2           HB2      GLU   2  14.777 -23.768  -7.511
    4    HB3  GLU   2           HB3      GLU   2  15.503 -24.398  -6.032
    5    HG2  GLU   2           HG2      GLU   2  14.446 -26.394  -6.272
    6    HG3  GLU   2           HG3      GLU   2  12.888 -25.617  -6.519

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLU   3           H        GLU   3  15.228 -22.045  -7.211
    2    HA   GLU   3           HA       GLU   3  16.426 -20.386  -5.254
    3    HB2  GLU   3           HB2      GLU   3  16.351 -20.374  -8.264
    4    HB3  GLU   3           HB3      GLU   3  17.128 -19.062  -7.378
    5    HG2  GLU   3           HG2      GLU   3  18.769 -20.471  -6.470
    6    HG3  GLU   3           HG3      GLU   3  17.793 -21.919  -6.688

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LEU   4           H        LEU   4  14.144 -19.486  -7.868
    2    HA   LEU   4           HA       LEU   4  13.732 -16.871  -7.246
    3    HB2  LEU   4           HB2      LEU   4  11.514 -18.800  -7.968
    4    HB3  LEU   4           HB3      LEU   4  11.472 -17.050  -8.161
    5    HG   LEU   4           HG       LEU   4  13.391 -18.947  -9.552
    6   HD13  LEU   4          HD11      LEU   4  12.080 -18.767 -11.453
    7   HD12  LEU   4          HD12      LEU   4  11.406 -17.210 -10.977
    8   HD11  LEU   4          HD13      LEU   4  10.828 -18.692 -10.216
    9   HD23  LEU   4          HD21      LEU   4  13.763 -16.705 -10.900
   10   HD22  LEU   4          HD22      LEU   4  14.627 -16.968  -9.386
   11   HD21  LEU   4          HD23      LEU   4  13.194 -15.944  -9.413

  No H/Q in entry =          11
  In of MODEL   30
    1    H    GLU   5           H        GLU   5  12.204 -19.630  -5.602
    2    HA   GLU   5           HA       GLU   5  10.568 -18.031  -3.884
    3    HB2  GLU   5           HB2      GLU   5  10.122 -20.416  -4.426
    4    HB3  GLU   5           HB3      GLU   5  11.526 -20.859  -3.452
    5    HG2  GLU   5           HG2      GLU   5   9.590 -21.056  -2.035
    6    HG3  GLU   5           HG3      GLU   5  10.473 -19.617  -1.526

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLU   6           H        GLU   6  13.686 -19.673  -3.466
    2    HA   GLU   6           HA       GLU   6  14.073 -18.831  -0.768
    3    HB2  GLU   6           HB2      GLU   6  15.255 -20.766  -1.771
    4    HB3  GLU   6           HB3      GLU   6  16.132 -19.660  -2.831
    5    HG2  GLU   6           HG2      GLU   6  17.110 -18.533  -0.888
    6    HG3  GLU   6           HG3      GLU   6  16.192 -19.574   0.200

  No H/Q in entry =           6
  In of MODEL   30
    1    H    VAL   7           H        VAL   7  14.843 -17.510  -3.919
    2    HA   VAL   7           HA       VAL   7  16.575 -15.419  -3.059
    3    HB   VAL   7           HB       VAL   7  14.847 -15.743  -5.526
    4   HG11  VAL   7          HG11      VAL   7  16.787 -13.568  -4.720
    5   HG13  VAL   7          HG12      VAL   7  15.144 -13.393  -5.333
    6   HG12  VAL   7          HG13      VAL   7  16.437 -13.917  -6.413
    7   HG21  VAL   7          HG21      VAL   7  16.929 -17.241  -4.975
    8   HG23  VAL   7          HG22      VAL   7  17.860 -15.796  -5.375
    9   HG22  VAL   7          HG23      VAL   7  16.801 -16.522  -6.582

  No H/Q in entry =           9
  In of MODEL   30
    1    H    VAL   8           H        VAL   8  13.075 -15.621  -3.594
    2    HA   VAL   8           HA       VAL   8  12.463 -12.902  -3.111
    3    HB   VAL   8           HB       VAL   8  10.855 -15.441  -2.800
    4   HG13  VAL   8          HG11      VAL   8   9.846 -14.026  -1.197
    5   HG12  VAL   8          HG12      VAL   8   8.893 -13.750  -2.655
    6   HG11  VAL   8          HG13      VAL   8  10.120 -12.581  -2.170
    7   HG23  VAL   8          HG21      VAL   8   9.747 -13.597  -4.676
    8   HG22  VAL   8          HG22      VAL   8  10.552 -15.124  -5.026
    9   HG21  VAL   8          HG23      VAL   8  11.483 -13.631  -4.980

  No H/Q in entry =           9
  In of MODEL   30
    1    H    MET   9           H        MET   9  12.692 -15.719  -0.940
    2    HA   MET   9           HA       MET   9  11.915 -14.439   1.439
    3    HB2  MET   9           HB2      MET   9  13.773 -16.748   0.878
    4    HB3  MET   9           HB3      MET   9  13.501 -16.165   2.520
    5    HG2  MET   9           HG2      MET   9  11.088 -16.533   2.278
    6    HG3  MET   9           HG3      MET   9  11.322 -17.054   0.609
    7    HE1  MET   9           HE1      MET   9  12.075 -17.427   4.191
    8    HE3  MET   9           HE2      MET   9  13.685 -18.046   3.836
    9    HE2  MET   9           HE3      MET   9  12.460 -19.124   4.498

  No H/Q in entry =           9
  In of MODEL   30
    1    H    GLY  10           H        GLY  10  15.082 -14.717  -0.139
    2    HA3  GLY  10           HA2      GLY  10  16.579 -13.329   1.826
    3    HA2  GLY  10           HA3      GLY  10  17.028 -13.498   0.129

  No H/Q in entry =           3
  In of MODEL   30
    1    H    LEU  11           H        LEU  11  14.875 -12.234  -1.093
    2    HA   LEU  11           HA       LEU  11  15.610  -9.502  -0.927
    3    HB2  LEU  11           HB2      LEU  11  13.209 -10.866  -2.150
    4    HB3  LEU  11           HB3      LEU  11  13.520  -9.136  -2.307
    5    HG   LEU  11           HG       LEU  11  15.504 -11.278  -3.114
    6   HD13  LEU  11          HD11      LEU  11  13.743 -11.609  -4.624
    7   HD12  LEU  11          HD12      LEU  11  14.761 -10.444  -5.467
    8   HD11  LEU  11          HD13      LEU  11  13.302  -9.901  -4.638
    9   HD22  LEU  11          HD21      LEU  11  16.772  -9.338  -2.890
   10   HD21  LEU  11          HD22      LEU  11  15.413  -8.276  -3.257
   11   HD23  LEU  11          HD23      LEU  11  16.221  -9.155  -4.554

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  12           H        ILE  12  12.817 -11.282   0.353
    2    HA   ILE  12           HA       ILE  12  11.470  -9.038   1.428
    3    HB   ILE  12           HB       ILE  12  11.462 -11.921   2.373
    4   HG12  ILE  12          HG12      ILE  12  10.776 -11.270  -0.073
    5   HG13  ILE  12          HG13      ILE  12   9.740 -12.351   0.840
    6   HG23  ILE  12          HG21      ILE  12  10.542 -10.515   4.115
    7   HG22  ILE  12          HG22      ILE  12   9.190 -11.295   3.293
    8   HG21  ILE  12          HG23      ILE  12   9.582  -9.612   2.944
    9   HD11  ILE  12          HD11      ILE  12   9.351  -9.355   0.622
   10   HD13  ILE  12          HD12      ILE  12   8.248 -10.511   1.367
   11   HD12  ILE  12          HD13      ILE  12   8.510 -10.539  -0.363

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  13           H        ILE  13  13.833 -11.287   2.812
    2    HA   ILE  13           HA       ILE  13  13.905 -10.116   5.396
    3    HB   ILE  13           HB       ILE  13  15.934 -11.714   3.814
    4   HG12  ILE  13          HG12      ILE  13  13.667 -12.682   4.609
    5   HG13  ILE  13          HG13      ILE  13  15.128 -13.598   4.964
    6   HG23  ILE  13          HG21      ILE  13  17.270 -10.521   5.378
    7   HG22  ILE  13          HG22      ILE  13  17.002 -12.093   6.121
    8   HG21  ILE  13          HG23      ILE  13  16.076 -10.692   6.663
    9   HD11  ILE  13          HD11      ILE  13  14.344 -11.616   7.038
   10   HD13  ILE  13          HD12      ILE  13  14.949 -13.259   7.213
   11   HD12  ILE  13          HD13      ILE  13  13.254 -12.985   6.836

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ASN  14           H        ASN  14  15.849  -9.609   2.466
    2    HA   ASN  14           HA       ASN  14  17.631  -7.699   3.523
    3    HB2  ASN  14           HB2      ASN  14  17.574  -8.958   1.204
    4    HB3  ASN  14           HB3      ASN  14  16.701  -7.526   0.676
    5   HD21  ASN  14          HD21      ASN  14  19.128  -7.901  -0.526
    6   HD22  ASN  14          HD22      ASN  14  20.292  -6.838   0.098

  No H/Q in entry =           6
  In of MODEL   30
    1    H    SER  15           H        SER  15  14.516  -7.298   1.850
    2    HA   SER  15           HA       SER  15  14.449  -4.476   1.915
    3    HB2  SER  15           HB2      SER  15  12.111  -4.684   1.432
    4    HB3  SER  15           HB3      SER  15  12.880  -6.062   0.655
    5    HG   SER  15           HG       SER  15  10.944  -6.133   2.385

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLY  16           H        GLY  16  13.331  -6.925   4.219
    2    HA3  GLY  16           HA2      GLY  16  12.148  -5.163   6.089
    3    HA2  GLY  16           HA3      GLY  16  12.740  -6.782   6.442

  No H/Q in entry =           3
  In of MODEL   30
    1    H    GLN  17           H        GLN  17  15.453  -6.489   5.834
    2    HA   GLN  17           HA       GLN  17  16.442  -5.289   8.213
    3    HB2  GLN  17           HB2      GLN  17  17.639  -7.095   7.014
    4    HB3  GLN  17           HB3      GLN  17  17.949  -5.990   5.674
    5    HG2  GLN  17           HG2      GLN  17  19.174  -4.486   7.219
    6    HG3  GLN  17           HG3      GLN  17  18.906  -5.635   8.529
    7   HE21  GLN  17          HE21      GLN  17  20.665  -6.993   8.852
    8   HE22  GLN  17          HE22      GLN  17  21.743  -7.497   7.642

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ALA  18           H        ALA  18  16.250  -4.199   4.857
    2    HA   ALA  18           HA       ALA  18  17.723  -1.829   5.082
    3    HB1  ALA  18           HB1      ALA  18  16.574  -3.021   3.018
    4    HB3  ALA  18           HB2      ALA  18  16.865  -1.282   3.005
    5    HB2  ALA  18           HB3      ALA  18  15.258  -1.905   3.383

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ARG  19           H        ARG  19  14.217  -2.366   5.498
    2    HA   ARG  19           HA       ARG  19  13.592   0.292   6.224
    3    HB2  ARG  19           HB2      ARG  19  11.882  -1.433   5.643
    4    HB3  ARG  19           HB3      ARG  19  12.221  -2.240   7.175
    5    HG2  ARG  19           HG2      ARG  19  11.548  -0.242   8.425
    6    HG3  ARG  19           HG3      ARG  19  11.302   0.642   6.920
    7    HD2  ARG  19           HD2      ARG  19   9.153  -0.125   7.750
    8    HD3  ARG  19           HD3      ARG  19   9.551  -1.006   6.269
    9    HE   ARG  19           HE       ARG  19  10.499  -2.569   8.364
   10   HH21  ARG  19          HH11      ARG  19   9.231  -4.193   9.306
   11   HH22  ARG  19          HH12      ARG  19   7.510  -4.139   9.146
   12   HH11  ARG  19          HH21      ARG  19   7.517  -1.229   7.291
   13   HH12  ARG  19          HH22      ARG  19   6.541  -2.461   8.000

  No H/Q in entry =          13
  In of MODEL   30
    1    H    SER  20           H        SER  20  14.420  -2.556   8.171
    2    HA   SER  20           HA       SER  20  14.168  -1.460  10.712
    3    HB2  SER  20           HB2      SER  20  14.598  -3.791  10.582
    4    HB3  SER  20           HB3      SER  20  16.047  -3.547   9.610
    5    HG   SER  20           HG       SER  20  15.653  -3.324  12.346

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU  21           H        LEU  21  16.999  -1.435   8.560
    2    HA   LEU  21           HA       LEU  21  18.705   0.022  10.292
    3    HB2  LEU  21           HB2      LEU  21  18.662  -0.243   7.278
    4    HB3  LEU  21           HB3      LEU  21  19.933   0.598   8.161
    5    HG   LEU  21           HG       LEU  21  19.158  -2.284   8.696
    6   HD11  LEU  21          HD11      LEU  21  21.220  -1.079   6.846
    7   HD13  LEU  21          HD12      LEU  21  20.005  -2.302   6.479
    8   HD12  LEU  21          HD13      LEU  21  21.391  -2.714   7.488
    9   HD23  LEU  21          HD21      LEU  21  21.660  -2.142   9.572
   10   HD22  LEU  21          HD22      LEU  21  20.351  -1.578  10.604
   11   HD21  LEU  21          HD23      LEU  21  21.313  -0.421   9.700

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ALA  22           H        ALA  22  16.441   1.031   7.752
    2    HA   ALA  22           HA       ALA  22  17.021   3.781   7.771
    3    HB3  ALA  22           HB1      ALA  22  15.590   2.565   6.097
    4    HB2  ALA  22           HB2      ALA  22  14.910   4.086   6.672
    5    HB1  ALA  22           HB3      ALA  22  14.300   2.554   7.299

  No H/Q in entry =           5
  In of MODEL   30
    1    H    TYR  23           H        TYR  23  14.508   1.998   9.615
    2    HA   TYR  23           HA       TYR  23  13.587   4.245  11.076
    3    HB2  TYR  23           HB2      TYR  23  12.319   2.151  11.057
    4    HB3  TYR  23           HB3      TYR  23  13.643   1.317  11.870
    5    HD1  TYR  23           HD1      TYR  23  11.200   4.111  12.263
    6    HD2  TYR  23           HD2      TYR  23  13.843   1.351  14.224
    7    HE1  TYR  23           HE1      TYR  23  10.297   4.810  14.466
    8    HE2  TYR  23           HE2      TYR  23  12.942   2.050  16.425
    9    HH   TYR  23           HH       TYR  23  10.115   4.006  16.715

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ALA  24           H        ALA  24  16.201   1.927  11.692
    2    HA   ALA  24           HA       ALA  24  16.901   2.905  14.254
    3    HB1  ALA  24           HB1      ALA  24  18.229   1.092  14.076
    4    HB3  ALA  24           HB2      ALA  24  19.264   2.001  12.974
    5    HB2  ALA  24           HB3      ALA  24  17.951   1.014  12.337

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA  25           H        ALA  25  17.854   3.829  10.973
    2    HA   ALA  25           HA       ALA  25  19.832   5.731  11.612
    3    HB1  ALA  25           HB1      ALA  25  19.088   4.801   9.299
    4    HB3  ALA  25           HB2      ALA  25  19.616   6.480   9.394
    5    HB2  ALA  25           HB3      ALA  25  17.895   6.100   9.333

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU  26           H        LEU  26  16.319   6.016  11.272
    2    HA   LEU  26           HA       LEU  26  16.141   8.799  11.732
    3    HB2  LEU  26           HB2      LEU  26  14.255   7.596  10.811
    4    HB3  LEU  26           HB3      LEU  26  14.156   6.565  12.234
    5    HG   LEU  26           HG       LEU  26  13.589   8.528  13.624
    6   HD12  LEU  26          HD11      LEU  26  12.954  10.643  12.308
    7   HD11  LEU  26          HD12      LEU  26  13.917   9.978  10.991
    8   HD13  LEU  26          HD13      LEU  26  14.676  10.347  12.540
    9   HD21  LEU  26          HD21      LEU  26  11.895   8.249  11.123
   10   HD23  LEU  26          HD22      LEU  26  11.354   8.951  12.644
   11   HD22  LEU  26          HD23      LEU  26  11.778   7.243  12.567

  No H/Q in entry =          11
  In of MODEL   30
    1    H    LYS  27           H        LYS  27  16.001   6.015  13.918
    2    HA   LYS  27           HA       LYS  27  15.444   7.383  16.293
    3    HB2  LYS  27           HB2      LYS  27  15.431   4.909  16.021
    4    HB3  LYS  27           HB3      LYS  27  17.194   4.933  15.968
    5    HG2  LYS  27           HG2      LYS  27  17.273   5.911  18.220
    6    HG3  LYS  27           HG3      LYS  27  15.507   5.958  18.276
    7    HD2  LYS  27           HD2      LYS  27  15.440   3.492  18.032
    8    HD3  LYS  27           HD3      LYS  27  17.205   3.453  18.010
    9    HE2  LYS  27           HE2      LYS  27  17.267   4.435  20.269
   10    HE3  LYS  27           HE3      LYS  27  15.503   4.504  20.294
   11    HZ3  LYS  27           HZ1      LYS  27  16.265   2.535  21.435
   12    HZ2  LYS  27           HZ2      LYS  27  17.165   2.045  20.077
   13    HZ1  LYS  27           HZ3      LYS  27  15.467   2.079  20.007

  No H/Q in entry =          13
  In of MODEL   30
    1    H    GLN  28           H        GLN  28  18.541   6.755  14.682
    2    HA   GLN  28           HA       GLN  28  20.254   7.804  16.666
    3    HB2  GLN  28           HB2      GLN  28  20.525   7.766  13.649
    4    HB3  GLN  28           HB3      GLN  28  21.826   8.206  14.756
    5    HG2  GLN  28           HG2      GLN  28  20.355   5.557  14.793
    6    HG3  GLN  28           HG3      GLN  28  21.936   5.816  14.060
    7   HE21  GLN  28          HE21      GLN  28  20.605   4.584  16.806
    8   HE22  GLN  28          HE22      GLN  28  21.836   4.947  17.916

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ALA  29           H        ALA  29  18.513   9.324  13.988
    2    HA   ALA  29           HA       ALA  29  19.558  11.927  14.243
    3    HB2  ALA  29           HB1      ALA  29  17.862  12.597  12.783
    4    HB1  ALA  29           HB2      ALA  29  16.702  11.442  13.437
    5    HB3  ALA  29           HB3      ALA  29  18.017  10.880  12.405

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LYS  30           H        LYS  30  16.763  10.371  15.775
    2    HA   LYS  30           HA       LYS  30  15.796  12.638  17.145
    3    HB2  LYS  30           HB2      LYS  30  15.636   9.697  17.840
    4    HB3  LYS  30           HB3      LYS  30  14.798  10.960  18.743
    5    HG2  LYS  30           HG2      LYS  30  13.673  11.672  16.633
    6    HG3  LYS  30           HG3      LYS  30  14.449  10.324  15.797
    7    HD2  LYS  30           HD2      LYS  30  13.358   8.731  17.327
    8    HD3  LYS  30           HD3      LYS  30  12.592  10.068  18.187
    9    HE2  LYS  30           HE2      LYS  30  11.423  10.728  16.103
   10    HE3  LYS  30           HE3      LYS  30  12.169   9.363  15.263
   11    HZ2  LYS  30           HZ1      LYS  30   9.858   8.992  16.156
   12    HZ1  LYS  30           HZ2      LYS  30  10.536   9.028  17.719
   13    HZ3  LYS  30           HZ3      LYS  30  11.016   7.838  16.602

  No H/Q in entry =          13
  In of MODEL   30
    1    H    GLN  31           H        GLN  31  18.422  10.419  17.860
    2    HA   GLN  31           HA       GLN  31  18.783  11.419  20.555
    3    HB2  GLN  31           HB2      GLN  31  20.768   9.817  18.934
    4    HB3  GLN  31           HB3      GLN  31  20.646   9.938  20.690
    5    HG2  GLN  31           HG2      GLN  31  18.111   9.034  19.933
    6    HG3  GLN  31           HG3      GLN  31  19.191   8.173  18.844
    7   HE21  GLN  31          HE21      GLN  31  17.641   7.048  21.125
    8   HE22  GLN  31          HE22      GLN  31  18.791   6.363  22.167

  No H/Q in entry =           8
  In of MODEL   30
    1    H    GLY  32           H        GLY  32  19.308  12.736  17.590
    2    HA3  GLY  32           HA2      GLY  32  20.326  14.764  17.076
    3    HA2  GLY  32           HA3      GLY  32  21.093  14.751  18.660

  No H/Q in entry =           3
  In of MODEL   30
    1    H    ASP  33           H        ASP  33  21.453  11.857  16.871
    2    HA   ASP  33           HA       ASP  33  24.287  12.482  16.391
    3    HB2  ASP  33           HB2      ASP  33  22.732   9.894  16.508
    4    HB3  ASP  33           HB3      ASP  33  24.418   9.981  16.004

  No H/Q in entry =           4
  In of MODEL   30
    1    H    PHE  34           H        PHE  34  23.819  13.820  14.516
    2    HA   PHE  34           HA       PHE  34  22.439  12.867  12.234
    3    HB2  PHE  34           HB2      PHE  34  24.609  14.962  12.458
    4    HB3  PHE  34           HB3      PHE  34  23.610  14.694  11.031
    5    HD1  PHE  34           HD1      PHE  34  23.913  16.614  13.949
    6    HD2  PHE  34           HD2      PHE  34  20.984  14.558  11.574
    7    HE1  PHE  34           HE1      PHE  34  22.127  18.041  14.911
    8    HE2  PHE  34           HE2      PHE  34  19.202  15.984  12.539
    9    HZ   PHE  34           HZ       PHE  34  19.777  17.727  14.203

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ALA  35           H        ALA  35  25.815  12.617  13.222
    2    HA   ALA  35           HA       ALA  35  26.892  11.784  10.756
    3    HB3  ALA  35           HB1      ALA  35  28.561  10.580  12.462
    4    HB2  ALA  35           HB2      ALA  35  27.722  11.617  13.616
    5    HB1  ALA  35           HB3      ALA  35  28.564  12.329  12.241

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA  36           H        ALA  36  25.758   9.839  13.522
    2    HA   ALA  36           HA       ALA  36  26.191   7.348  12.236
    3    HB2  ALA  36           HB1      ALA  36  25.760   6.602  14.312
    4    HB3  ALA  36           HB2      ALA  36  24.080   7.127  14.173
    5    HB1  ALA  36           HB3      ALA  36  25.304   8.236  14.792

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA  37           H        ALA  37  23.408   9.522  12.392
    2    HA   ALA  37           HA       ALA  37  21.515   7.788  11.222
    3    HB3  ALA  37           HB1      ALA  37  21.792  10.746  11.522
    4    HB1  ALA  37           HB2      ALA  37  20.465   9.688  11.999
    5    HB2  ALA  37           HB3      ALA  37  20.652  10.162  10.310

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LYS  38           H        LYS  38  23.647  10.218   9.739
    2    HA   LYS  38           HA       LYS  38  22.985   9.809   7.064
    3    HB2  LYS  38           HB2      LYS  38  24.829  11.331   8.503
    4    HB3  LYS  38           HB3      LYS  38  25.839  10.328   7.468
    5    HG2  LYS  38           HG2      LYS  38  24.676  11.124   5.481
    6    HG3  LYS  38           HG3      LYS  38  23.502  11.995   6.472
    7    HD2  LYS  38           HD2      LYS  38  25.127  13.565   7.220
    8    HD3  LYS  38           HD3      LYS  38  26.468  12.558   6.673
    9    HE2  LYS  38           HE2      LYS  38  26.133  14.440   5.130
   10    HE3  LYS  38           HE3      LYS  38  25.768  12.910   4.323
   11    HZ3  LYS  38           HZ1      LYS  38  23.578  13.392   4.207
   12    HZ2  LYS  38           HZ2      LYS  38  24.128  14.998   4.296
   13    HZ1  LYS  38           HZ3      LYS  38  23.549  14.219   5.689

  No H/Q in entry =          13
  In of MODEL   30
    1    H    ALA  39           H        ALA  39  25.483   8.164   9.000
    2    HA   ALA  39           HA       ALA  39  26.515   6.565   6.920
    3    HB2  ALA  39           HB1      ALA  39  26.427   5.594   9.761
    4    HB1  ALA  39           HB2      ALA  39  27.400   7.005   9.343
    5    HB3  ALA  39           HB3      ALA  39  27.722   5.452   8.573

  No H/Q in entry =           5
  In of MODEL   30
    1    H    MET  40           H        MET  40  23.905   5.984   9.231
    2    HA   MET  40           HA       MET  40  23.414   3.289   8.491
    3    HB2  MET  40           HB2      MET  40  21.639   5.358   9.800
    4    HB3  MET  40           HB3      MET  40  21.203   3.656   9.623
    5    HG2  MET  40           HG2      MET  40  23.776   4.552  10.952
    6    HG3  MET  40           HG3      MET  40  22.282   4.297  11.853
    7    HE3  MET  40           HE1      MET  40  21.661   0.673  12.020
    8    HE2  MET  40           HE2      MET  40  20.809   1.992  11.222
    9    HE1  MET  40           HE3      MET  40  21.563   2.262  12.791

  No H/Q in entry =           9
  In of MODEL   30
    1    H    MET  41           H        MET  41  22.043   6.368   7.322
    2    HA   MET  41           HA       MET  41  20.057   5.210   5.657
    3    HB2  MET  41           HB2      MET  41  21.576   7.778   5.143
    4    HB3  MET  41           HB3      MET  41  20.036   7.310   4.432
    5    HG2  MET  41           HG2      MET  41  19.302   7.126   6.988
    6    HG3  MET  41           HG3      MET  41  20.631   8.262   7.205
    7    HE2  MET  41           HE1      MET  41  20.069   9.569   3.876
    8    HE1  MET  41           HE2      MET  41  21.040   9.989   5.283
    9    HE3  MET  41           HE3      MET  41  19.782  11.090   4.730

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ASP  42           H        ASP  42  23.440   6.081   5.087
    2    HA   ASP  42           HA       ASP  42  23.509   5.614   2.328
    3    HB2  ASP  42           HB2      ASP  42  25.286   6.579   4.090
    4    HB3  ASP  42           HB3      ASP  42  25.916   4.943   3.953

  No H/Q in entry =           4
  In of MODEL   30
    1    H    GLN  43           H        GLN  43  24.215   3.440   5.037
    2    HA   GLN  43           HA       GLN  43  24.835   1.177   3.444
    3    HB2  GLN  43           HB2      GLN  43  23.832   1.368   6.294
    4    HB3  GLN  43           HB3      GLN  43  24.383  -0.128   5.531
    5    HG2  GLN  43           HG2      GLN  43  26.562   1.051   5.011
    6    HG3  GLN  43           HG3      GLN  43  26.006   2.384   6.018
    7   HE21  GLN  43          HE21      GLN  43  28.229   1.373   7.038
    8   HE22  GLN  43          HE22      GLN  43  27.945   0.290   8.313

  No H/Q in entry =           8
  In of MODEL   30
    1    H    SER  44           H        SER  44  21.805   2.354   4.850
    2    HA   SER  44           HA       SER  44  20.197   0.138   4.180
    3    HB2  SER  44           HB2      SER  44  19.802   2.670   5.336
    4    HB3  SER  44           HB3      SER  44  18.759   2.647   3.917
    5    HG   SER  44           HG       SER  44  17.661   1.716   5.644

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ARG  45           H        ARG  45  20.976   3.096   2.380
    2    HA   ARG  45           HA       ARG  45  19.430   2.642   0.083
    3    HB2  ARG  45           HB2      ARG  45  20.610   4.758   0.667
    4    HB3  ARG  45           HB3      ARG  45  22.141   3.980   0.270
    5    HG2  ARG  45           HG2      ARG  45  21.337   3.594  -2.041
    6    HG3  ARG  45           HG3      ARG  45  19.819   4.395  -1.643
    7    HD2  ARG  45           HD2      ARG  45  21.106   6.470  -1.060
    8    HD3  ARG  45           HD3      ARG  45  22.587   5.674  -1.640
    9    HE   ARG  45           HE       ARG  45  20.641   5.473  -3.665
   10   HH21  ARG  45          HH11      ARG  45  20.645   6.848  -5.424
   11   HH22  ARG  45          HH12      ARG  45  21.427   8.386  -5.319
   12   HH11  ARG  45          HH21      ARG  45  22.420   7.939  -2.041
   13   HH12  ARG  45          HH22      ARG  45  22.431   9.003  -3.401

  No H/Q in entry =          13
  In of MODEL   30
    1    H    MET  46           H        MET  46  22.784   1.711   0.807
    2    HA   MET  46           HA       MET  46  23.355   0.516  -1.684
    3    HB2  MET  46           HB2      MET  46  24.473   0.148   1.097
    4    HB3  MET  46           HB3      MET  46  25.113  -0.728  -0.298
    5    HG2  MET  46           HG2      MET  46  25.554   1.403  -1.450
    6    HG3  MET  46           HG3      MET  46  24.889   2.291  -0.085
    7    HE2  MET  46           HE1      MET  46  26.975   3.742   0.597
    8    HE1  MET  46           HE2      MET  46  27.429   3.209  -1.018
    9    HE3  MET  46           HE3      MET  46  28.612   3.152   0.287

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ALA  47           H        ALA  47  21.969  -0.803   1.296
    2    HA   ALA  47           HA       ALA  47  21.866  -3.512   0.486
    3    HB2  ALA  47           HB1      ALA  47  21.509  -3.053   2.794
    4    HB3  ALA  47           HB2      ALA  47  19.959  -3.628   2.184
    5    HB1  ALA  47           HB3      ALA  47  20.219  -1.902   2.446

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU  48           H        LEU  48  19.555  -0.846   0.152
    2    HA   LEU  48           HA       LEU  48  17.476  -2.341  -1.089
    3    HB2  LEU  48           HB2      LEU  48  18.180   0.602  -1.200
    4    HB3  LEU  48           HB3      LEU  48  16.692  -0.081  -1.859
    5    HG   LEU  48           HG       LEU  48  17.560  -0.406   1.023
    6   HD13  LEU  48          HD11      LEU  48  17.180   1.902   0.845
    7   HD12  LEU  48          HD12      LEU  48  15.614   1.280   1.363
    8   HD11  LEU  48          HD13      LEU  48  15.881   1.702  -0.328
    9   HD22  LEU  48          HD21      LEU  48  16.000  -2.093   0.648
   10   HD21  LEU  48          HD22      LEU  48  15.133  -1.172  -0.582
   11   HD23  LEU  48          HD23      LEU  48  14.939  -0.769   1.124

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ASN  49           H        ASN  49  20.188  -0.455  -2.333
    2    HA   ASN  49           HA       ASN  49  19.518  -0.520  -5.053
    3    HB2  ASN  49           HB2      ASN  49  21.232   0.961  -4.123
    4    HB3  ASN  49           HB3      ASN  49  22.243  -0.423  -3.727
    5   HD21  ASN  49          HD21      ASN  49  23.232   1.606  -5.406
    6   HD22  ASN  49          HD22      ASN  49  23.387   1.001  -6.983

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLU  50           H        GLU  50  21.477  -2.754  -3.110
    2    HA   GLU  50           HA       GLU  50  22.134  -4.516  -5.245
    3    HB2  GLU  50           HB2      GLU  50  23.347  -4.517  -3.087
    4    HB3  GLU  50           HB3      GLU  50  21.899  -5.122  -2.283
    5    HG2  GLU  50           HG2      GLU  50  21.944  -7.152  -3.647
    6    HG3  GLU  50           HG3      GLU  50  23.324  -6.541  -4.556

  No H/Q in entry =           6
  In of MODEL   30
    1    H    ALA  51           H        ALA  51  19.495  -4.410  -2.900
    2    HA   ALA  51           HA       ALA  51  18.281  -6.861  -3.655
    3    HB3  ALA  51           HB1      ALA  51  16.709  -6.332  -2.087
    4    HB1  ALA  51           HB2      ALA  51  16.520  -4.680  -2.680
    5    HB2  ALA  51           HB3      ALA  51  17.880  -5.093  -1.635

  No H/Q in entry =           5
  In of MODEL   30
    1    H    HIS  52           H        HIS  52  17.746  -3.501  -4.678
    2    HA   HIS  52           HA       HIS  52  15.611  -3.986  -6.463
    3    HB2  HIS  52           HB2      HIS  52  16.300  -1.735  -5.664
    4    HB3  HIS  52           HB3      HIS  52  17.751  -1.854  -6.658
    5    HD1  HIS  52           HD1      HIS  52  17.445  -1.763  -9.250
    6    HD2  HIS  52           HD2      HIS  52  13.904  -1.252  -7.109
    7    HE1  HIS  52           HE1      HIS  52  15.726  -0.907 -10.901
    8    HE2  HIS  52           HE2      HIS  52  13.562  -0.590  -9.611

  No H/Q in entry =           8
  In of MODEL   30
    1    H    LEU  53           H        LEU  53  19.126  -4.051  -6.922
    2    HA   LEU  53           HA       LEU  53  19.157  -4.361  -9.723
    3    HB2  LEU  53           HB2      LEU  53  21.092  -5.161  -7.564
    4    HB3  LEU  53           HB3      LEU  53  21.390  -5.549  -9.257
    5    HG   LEU  53           HG       LEU  53  20.778  -2.731  -8.309
    6   HD12  LEU  53          HD11      LEU  53  23.501  -3.943  -8.869
    7   HD11  LEU  53          HD12      LEU  53  22.856  -3.669  -7.250
    8   HD13  LEU  53          HD13      LEU  53  23.163  -2.304  -8.317
    9   HD22  LEU  53          HD21      LEU  53  20.487  -2.769 -10.647
   10   HD21  LEU  53          HD22      LEU  53  21.740  -3.986 -10.876
   11   HD23  LEU  53          HD23      LEU  53  22.186  -2.328 -10.513

  No H/Q in entry =          11
  In of MODEL   30
    1    H    VAL  54           H        VAL  54  19.023  -6.752  -7.102
    2    HA   VAL  54           HA       VAL  54  19.096  -9.044  -8.767
    3    HB   VAL  54           HB       VAL  54  17.968  -8.607  -5.991
    4   HG12  VAL  54          HG11      VAL  54  18.249 -11.230  -5.995
    5   HG11  VAL  54          HG12      VAL  54  18.054 -11.055  -7.738
    6   HG13  VAL  54          HG13      VAL  54  16.782 -10.505  -6.649
    7   HG22  VAL  54          HG21      VAL  54  20.289  -8.436  -5.784
    8   HG21  VAL  54          HG22      VAL  54  20.598  -9.530  -7.130
    9   HG23  VAL  54          HG23      VAL  54  20.069 -10.172  -5.575

  No H/Q in entry =           9
  In of MODEL   30
    1    H    GLN  55           H        GLN  55  16.409  -7.099  -7.461
    2    HA   GLN  55           HA       GLN  55  14.353  -8.727  -8.523
    3    HB2  GLN  55           HB2      GLN  55  13.642  -7.193  -6.888
    4    HB3  GLN  55           HB3      GLN  55  14.452  -5.836  -7.667
    5    HG2  GLN  55           HG2      GLN  55  12.722  -5.480  -9.143
    6    HG3  GLN  55           HG3      GLN  55  12.371  -7.194  -9.315
    7   HE21  GLN  55          HE21      GLN  55  10.361  -7.712  -8.496
    8   HE22  GLN  55          HE22      GLN  55   9.609  -6.948  -7.181

  No H/Q in entry =           8
  In of MODEL   30
    1    H    THR  56           H        THR  56  16.128  -5.953  -9.890
    2    HA   THR  56           HA       THR  56  14.679  -5.562 -12.227
    3    HB   THR  56           HB       THR  56  17.701  -5.523 -12.082
    4    HG1  THR  56           HG1      THR  56  16.586  -4.374 -10.360
    5   HG23  THR  56          HG21      THR  56  16.982  -5.166 -14.316
    6   HG22  THR  56          HG22      THR  56  17.257  -3.551 -13.666
    7   HG21  THR  56          HG23      THR  56  15.613  -4.179 -13.799

  No H/Q in entry =           7
  In of MODEL   30
    1    H    LYS  57           H        LYS  57  17.296  -7.903 -11.639
    2    HA   LYS  57           HA       LYS  57  17.258  -9.092 -14.220
    3    HB2  LYS  57           HB2      LYS  57  19.056  -9.376 -12.484
    4    HB3  LYS  57           HB3      LYS  57  17.942 -10.360 -11.546
    5    HG2  LYS  57           HG2      LYS  57  17.791 -11.975 -13.399
    6    HG3  LYS  57           HG3      LYS  57  18.899 -10.996 -14.354
    7    HD2  LYS  57           HD2      LYS  57  19.677 -12.026 -11.624
    8    HD3  LYS  57           HD3      LYS  57  19.899 -13.009 -13.071
    9    HE2  LYS  57           HE2      LYS  57  21.188 -11.075 -14.082
   10    HE3  LYS  57           HE3      LYS  57  21.125 -10.281 -12.509
   11    HZ3  LYS  57           HZ1      LYS  57  22.995 -11.405 -12.128
   12    HZ2  LYS  57           HZ2      LYS  57  22.720 -12.516 -13.383
   13    HZ1  LYS  57           HZ3      LYS  57  21.986 -12.742 -11.868

  No H/Q in entry =          13
  In of MODEL   30
    1    H    LEU  58           H        LEU  58  15.489  -9.737 -11.233
    2    HA   LEU  58           HA       LEU  58  14.223 -12.089 -12.163
    3    HB2  LEU  58           HB2      LEU  58  13.475 -10.176  -9.958
    4    HB3  LEU  58           HB3      LEU  58  12.641 -11.700 -10.271
    5    HG   LEU  58           HG       LEU  58  15.622 -11.470  -9.738
    6   HD11  LEU  58          HD11      LEU  58  13.258 -11.854  -7.929
    7   HD13  LEU  58          HD12      LEU  58  14.729 -10.914  -7.675
    8   HD12  LEU  58          HD13      LEU  58  14.774 -12.671  -7.544
    9   HD22  LEU  58          HD21      LEU  58  15.465 -13.528 -10.769
   10   HD21  LEU  58          HD22      LEU  58  13.751 -13.711 -10.396
   11   HD23  LEU  58          HD23      LEU  58  14.963 -14.033  -9.156

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  59           H        ILE  59  13.599  -8.741 -12.834
    2    HA   ILE  59           HA       ILE  59  10.867  -9.345 -13.755
    3    HB   ILE  59           HB       ILE  59  11.710  -7.080 -12.549
    4   HG12  ILE  59          HG12      ILE  59   9.802  -6.930 -14.896
    5   HG13  ILE  59          HG13      ILE  59   9.373  -7.675 -13.378
    6   HG21  ILE  59          HG21      ILE  59  13.260  -6.698 -14.604
    7   HG23  ILE  59          HG22      ILE  59  12.302  -5.346 -14.044
    8   HG22  ILE  59          HG23      ILE  59  11.796  -6.270 -15.456
    9   HD12  ILE  59          HD11      ILE  59  10.299  -4.823 -13.723
   10   HD11  ILE  59          HD12      ILE  59   9.883  -5.574 -12.184
   11   HD13  ILE  59          HD13      ILE  59   8.638  -5.331 -13.410

  No H/Q in entry =          11
  In of MODEL   30
    1    H    GLU  60           H        GLU  60  14.075  -8.541 -15.036
    2    HA   GLU  60           HA       GLU  60  13.281  -8.123 -17.737
    3    HB2  GLU  60           HB2      GLU  60  15.476  -7.421 -16.915
    4    HB3  GLU  60           HB3      GLU  60  15.915  -9.096 -16.594
    5    HG2  GLU  60           HG2      GLU  60  15.074  -8.233 -19.359
    6    HG3  GLU  60           HG3      GLU  60  16.737  -8.021 -18.815

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLY  61           H        GLY  61  14.227 -11.023 -15.935
    2    HA3  GLY  61           HA2      GLY  61  13.642 -12.657 -18.335
    3    HA2  GLY  61           HA3      GLY  61  14.676 -13.157 -17.002

  No H/Q in entry =           3
  In of MODEL   30
    1    H    ASP  62           H        ASP  62  11.583 -11.563 -16.604
    2    HA   ASP  62           HA       ASP  62  10.642 -13.656 -14.880
    3    HB2  ASP  62           HB2      ASP  62   8.613 -12.214 -14.733
    4    HB3  ASP  62           HB3      ASP  62  10.109 -11.371 -14.342

  No H/Q in entry =           4
  In of MODEL   30
    1    H    ALA  63           H        ALA  63  10.925 -13.945 -18.041
    2    HA   ALA  63           HA       ALA  63   8.425 -14.406 -19.198
    3    HB1  ALA  63           HB1      ALA  63  10.684 -16.315 -19.702
    4    HB3  ALA  63           HB2      ALA  63  10.861 -14.623 -20.164
    5    HB2  ALA  63           HB3      ALA  63   9.558 -15.593 -20.851

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLY  64           H        GLY  64  10.471 -16.664 -17.374
    2    HA3  GLY  64           HA2      GLY  64  10.011 -18.611 -16.258
    3    HA2  GLY  64           HA3      GLY  64   8.400 -17.956 -16.004

  No H/Q in entry =           3
  In of MODEL   30
    1    H    GLU  65           H        GLU  65   6.952 -19.485 -16.563
    2    HA   GLU  65           HA       GLU  65   7.468 -21.609 -18.313
    3    HB2  GLU  65           HB2      GLU  65   4.853 -20.436 -17.377
    4    HB3  GLU  65           HB3      GLU  65   4.983 -21.934 -18.300
    5    HG2  GLU  65           HG2      GLU  65   6.401 -22.915 -16.568
    6    HG3  GLU  65           HG3      GLU  65   6.373 -21.407 -15.657

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLY  66           H        GLY  66   5.808 -22.081 -20.109
    2    HA3  GLY  66           HA2      GLY  66   6.463 -20.537 -22.371
    3    HA2  GLY  66           HA3      GLY  66   5.281 -21.829 -22.309

  No H/Q in entry =           3
  In of MODEL   30
    1    H    LYS  67           H        LYS  67   3.572 -20.626 -20.380
    2    HA   LYS  67           HA       LYS  67   1.947 -19.070 -22.106
    3    HB2  LYS  67           HB2      LYS  67   1.698 -19.788 -19.188
    4    HB3  LYS  67           HB3      LYS  67   0.445 -18.943 -20.105
    5    HG2  LYS  67           HG2      LYS  67   0.396 -20.791 -21.745
    6    HG3  LYS  67           HG3      LYS  67   1.636 -21.639 -20.826
    7    HD2  LYS  67           HD2      LYS  67   0.121 -21.756 -18.883
    8    HD3  LYS  67           HD3      LYS  67  -1.125 -20.912 -19.807
    9    HE2  LYS  67           HE2      LYS  67  -1.144 -22.727 -21.467
   10    HE3  LYS  67           HE3      LYS  67   0.121 -23.569 -20.573
   11    HZ3  LYS  67           HZ1      LYS  67  -2.015 -24.473 -20.003
   12    HZ2  LYS  67           HZ2      LYS  67  -2.609 -22.936 -19.592
   13    HZ1  LYS  67           HZ3      LYS  67  -1.385 -23.656 -18.658

  No H/Q in entry =          13
  In of MODEL   30
    1    H    MET  68           H        MET  68   1.110 -17.034 -21.861
    2    HA   MET  68           HA       MET  68   2.834 -14.923 -21.639
    3    HB2  MET  68           HB2      MET  68  -0.153 -14.978 -21.212
    4    HB3  MET  68           HB3      MET  68   0.790 -13.507 -21.445
    5    HG2  MET  68           HG2      MET  68   0.715 -15.820 -23.400
    6    HG3  MET  68           HG3      MET  68  -0.227 -14.338 -23.566
    7    HE3  MET  68           HE1      MET  68   2.012 -11.590 -24.376
    8    HE2  MET  68           HE2      MET  68   1.904 -11.934 -22.652
    9    HE1  MET  68           HE3      MET  68   0.498 -12.187 -23.682

  No H/Q in entry =           9
  In of MODEL   30
    1    H    LYS  69           H        LYS  69   1.748 -16.700 -18.960
    2    HA   LYS  69           HA       LYS  69   1.543 -14.562 -17.077
    3    HB2  LYS  69           HB2      LYS  69   1.773 -17.549 -16.733
    4    HB3  LYS  69           HB3      LYS  69   1.564 -16.429 -15.385
    5    HG2  LYS  69           HG2      LYS  69  -0.495 -15.554 -16.418
    6    HG3  LYS  69           HG3      LYS  69  -0.289 -16.663 -17.773
    7    HD2  LYS  69           HD2      LYS  69  -0.440 -18.579 -16.210
    8    HD3  LYS  69           HD3      LYS  69  -0.701 -17.454 -14.875
    9    HE2  LYS  69           HE2      LYS  69  -2.466 -17.601 -17.334
   10    HE3  LYS  69           HE3      LYS  69  -2.830 -18.408 -15.811
   11    HZ2  LYS  69           HZ1      LYS  69  -2.569 -15.497 -16.287
   12    HZ1  LYS  69           HZ2      LYS  69  -2.642 -16.184 -14.737
   13    HZ3  LYS  69           HZ3      LYS  69  -3.955 -16.341 -15.801

  No H/Q in entry =          13
  In of MODEL   30
    1    H    VAL  70           H        VAL  70   2.835 -14.324 -15.077
    2    HA   VAL  70           HA       VAL  70   5.727 -14.820 -15.526
    3    HB   VAL  70           HB       VAL  70   6.136 -12.657 -14.390
    4   HG11  VAL  70          HG11      VAL  70   5.770 -12.949 -16.935
    5   HG13  VAL  70          HG12      VAL  70   5.686 -11.311 -16.285
    6   HG12  VAL  70          HG13      VAL  70   4.203 -12.188 -16.659
    7   HG22  VAL  70          HG21      VAL  70   4.328 -12.162 -13.004
    8   HG21  VAL  70          HG22      VAL  70   3.149 -12.739 -14.181
    9   HG23  VAL  70          HG23      VAL  70   3.911 -11.165 -14.398

  No H/Q in entry =           9
  In of MODEL   30
    1    H    SER  71           H        SER  71   6.969 -14.616 -13.422
    2    HA   SER  71           HA       SER  71   6.092 -16.512 -11.529
    3    HB2  SER  71           HB2      SER  71   8.481 -15.795 -11.944
    4    HB3  SER  71           HB3      SER  71   8.122 -14.321 -11.048
    5    HG   SER  71           HG       SER  71   8.032 -17.010 -10.155

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU  72           H        LEU  72   4.673 -16.343  -9.942
    2    HA   LEU  72           HA       LEU  72   3.163 -14.006  -9.482
    3    HB2  LEU  72           HB2      LEU  72   3.421 -16.572  -7.921
    4    HB3  LEU  72           HB3      LEU  72   2.277 -15.298  -7.508
    5    HG   LEU  72           HG       LEU  72   2.393 -16.599 -10.248
    6   HD12  LEU  72          HD11      LEU  72   0.321 -17.802  -9.465
    7   HD11  LEU  72          HD12      LEU  72   0.675 -17.235  -7.834
    8   HD13  LEU  72          HD13      LEU  72   1.799 -18.318  -8.653
    9   HD21  LEU  72          HD21      LEU  72   0.578 -14.631  -8.873
   10   HD23  LEU  72          HD22      LEU  72  -0.098 -15.696 -10.096
   11   HD22  LEU  72          HD23      LEU  72   1.206 -14.589 -10.517

  No H/Q in entry =          11
  In of MODEL   30
    1    H    VAL  73           H        VAL  73   5.808 -15.489  -7.730
    2    HA   VAL  73           HA       VAL  73   5.787 -13.962  -5.393
    3    HB   VAL  73           HB       VAL  73   7.922 -14.840  -4.957
    4   HG12  VAL  73          HG11      VAL  73   6.720 -16.818  -6.908
    5   HG11  VAL  73          HG12      VAL  73   6.045 -16.514  -5.307
    6   HG13  VAL  73          HG13      VAL  73   7.675 -17.169  -5.469
    7   HG21  VAL  73          HG21      VAL  73   8.181 -14.970  -7.966
    8   HG23  VAL  73          HG22      VAL  73   9.273 -15.847  -6.895
    9   HG22  VAL  73          HG23      VAL  73   9.196 -14.086  -6.826

  No H/Q in entry =           9
  In of MODEL   30
    1    H    LEU  74           H        LEU  74   6.770 -13.075  -8.574
    2    HA   LEU  74           HA       LEU  74   8.749 -11.159  -8.088
    3    HB2  LEU  74           HB2      LEU  74   8.269 -11.894 -10.326
    4    HB3  LEU  74           HB3      LEU  74   6.612 -11.303 -10.213
    5    HG   LEU  74           HG       LEU  74   7.449  -8.989 -10.001
    6   HD13  LEU  74          HD11      LEU  74   9.567  -9.225  -8.948
    7   HD12  LEU  74          HD12      LEU  74   9.948  -8.714 -10.591
    8   HD11  LEU  74          HD13      LEU  74  10.115 -10.408 -10.134
    9   HD22  LEU  74          HD21      LEU  74   7.767  -8.759 -12.258
   10   HD21  LEU  74          HD22      LEU  74   7.188 -10.408 -12.204
   11   HD23  LEU  74          HD23      LEU  74   8.905 -10.102 -12.344

  No H/Q in entry =          11
  In of MODEL   30
    1    H    VAL  75           H        VAL  75   5.258 -10.718  -8.419
    2    HA   VAL  75           HA       VAL  75   5.209  -7.962  -7.825
    3    HB   VAL  75           HB       VAL  75   3.087 -10.071  -7.426
    4   HG12  VAL  75          HG11      VAL  75   1.539  -8.087  -7.321
    5   HG11  VAL  75          HG12      VAL  75   2.949  -7.038  -7.281
    6   HG13  VAL  75          HG13      VAL  75   2.649  -8.151  -5.955
    7   HG23  VAL  75          HG21      VAL  75   3.333  -7.906  -9.530
    8   HG22  VAL  75          HG22      VAL  75   2.256  -9.301  -9.539
    9   HG21  VAL  75          HG23      VAL  75   3.991  -9.524  -9.764

  No H/Q in entry =           9
  In of MODEL   30
    1    H    GLU  76           H        GLU  76   4.923 -10.840  -5.721
    2    HA   GLU  76           HA       GLU  76   4.488  -9.478  -3.293
    3    HB2  GLU  76           HB2      GLU  76   4.265 -11.934  -3.513
    4    HB3  GLU  76           HB3      GLU  76   5.992 -12.072  -3.798
    5    HG2  GLU  76           HG2      GLU  76   5.606 -12.650  -1.493
    6    HG3  GLU  76           HG3      GLU  76   6.374 -11.073  -1.495

  No H/Q in entry =           6
  In of MODEL   30
    1    H    ALA  77           H        ALA  77   7.524 -10.430  -4.876
    2    HA   ALA  77           HA       ALA  77   9.241  -9.419  -2.868
    3    HB2  ALA  77           HB1      ALA  77  10.908  -9.309  -4.836
    4    HB3  ALA  77           HB2      ALA  77   9.604 -10.005  -5.798
    5    HB1  ALA  77           HB3      ALA  77  10.243 -10.886  -4.410

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLN  78           H        GLN  78   7.856  -7.972  -5.770
    2    HA   GLN  78           HA       GLN  78   9.249  -5.515  -5.667
    3    HB2  GLN  78           HB2      GLN  78   7.929  -6.401  -7.621
    4    HB3  GLN  78           HB3      GLN  78   6.456  -6.006  -6.736
    5    HG2  GLN  78           HG2      GLN  78   7.134  -3.646  -6.639
    6    HG3  GLN  78           HG3      GLN  78   8.619  -4.029  -7.510
    7   HE21  GLN  78          HE21      GLN  78   6.725  -2.181  -8.601
    8   HE22  GLN  78          HE22      GLN  78   6.028  -2.882  -9.981

  No H/Q in entry =           8
  In of MODEL   30
    1    H    LEU  79           H        LEU  79   6.219  -6.607  -4.224
    2    HA   LEU  79           HA       LEU  79   5.271  -4.186  -3.203
    3    HB2  LEU  79           HB2      LEU  79   3.923  -6.216  -3.145
    4    HB3  LEU  79           HB3      LEU  79   5.061  -6.977  -2.038
    5    HG   LEU  79           HG       LEU  79   4.545  -5.330  -0.304
    6   HD13  LEU  79          HD11      LEU  79   4.108  -3.306  -1.347
    7   HD12  LEU  79          HD12      LEU  79   2.476  -3.805  -0.901
    8   HD11  LEU  79          HD13      LEU  79   3.044  -4.033  -2.553
    9   HD23  LEU  79          HD21      LEU  79   1.951  -5.780  -0.202
   10   HD22  LEU  79          HD22      LEU  79   3.069  -7.138  -0.102
   11   HD21  LEU  79          HD23      LEU  79   2.253  -6.784  -1.622

  No H/Q in entry =          11
  In of MODEL   30
    1    H    HIS  80           H        HIS  80   7.422  -6.561  -1.637
    2    HA   HIS  80           HA       HIS  80   7.748  -5.030   0.734
    3    HB2  HIS  80           HB2      HIS  80   9.040  -7.413  -0.477
    4    HB3  HIS  80           HB3      HIS  80   9.972  -6.535   0.737
    5    HD1  HIS  80           HD1      HIS  80   9.482  -7.169   3.081
    6    HD2  HIS  80           HD2      HIS  80   6.239  -7.958   0.583
    7    HE1  HIS  80           HE1      HIS  80   7.699  -8.246   4.535
    8    HE2  HIS  80           HE2      HIS  80   5.716  -8.731   3.021

  No H/Q in entry =           8
  In of MODEL   30
    1    H    LEU  81           H        LEU  81   9.734  -5.333  -2.189
    2    HA   LEU  81           HA       LEU  81  11.812  -3.629  -1.316
    3    HB2  LEU  81           HB2      LEU  81  10.864  -4.399  -4.076
    4    HB3  LEU  81           HB3      LEU  81  12.303  -3.418  -3.790
    5    HG   LEU  81           HG       LEU  81  11.869  -6.135  -2.522
    6   HD12  LEU  81          HD11      LEU  81  13.666  -6.788  -4.281
    7   HD11  LEU  81          HD12      LEU  81  13.121  -5.352  -5.147
    8   HD13  LEU  81          HD13      LEU  81  11.988  -6.658  -4.807
    9   HD23  LEU  81          HD21      LEU  81  14.503  -5.865  -2.519
   10   HD22  LEU  81          HD22      LEU  81  13.540  -5.091  -1.262
   11   HD21  LEU  81          HD23      LEU  81  14.128  -4.146  -2.630

  No H/Q in entry =          11
  In of MODEL   30
    1    H    MET  82           H        MET  82   8.891  -2.937  -3.237
    2    HA   MET  82           HA       MET  82   9.476  -0.220  -3.734
    3    HB2  MET  82           HB2      MET  82   6.890  -1.769  -3.601
    4    HB3  MET  82           HB3      MET  82   6.918  -0.044  -3.960
    5    HG2  MET  82           HG2      MET  82   8.475  -2.141  -5.508
    6    HG3  MET  82           HG3      MET  82   6.917  -1.490  -6.012
    7    HE3  MET  82           HE1      MET  82   7.420   1.960  -7.177
    8    HE2  MET  82           HE2      MET  82   7.050   1.736  -5.470
    9    HE1  MET  82           HE3      MET  82   6.360   0.641  -6.664

  No H/Q in entry =           9
  In of MODEL   30
    1    H    THR  83           H        THR  83   7.669  -1.793  -1.124
    2    HA   THR  83           HA       THR  83   6.865   0.567   0.212
    3    HB   THR  83           HB       THR  83   6.712  -1.011   2.227
    4    HG1  THR  83           HG1      THR  83   7.434  -2.973   1.989
    5   HG22  THR  83          HG21      THR  83   5.025  -2.543   0.762
    6   HG21  THR  83          HG22      THR  83   5.270  -1.216  -0.367
    7   HG23  THR  83          HG23      THR  83   4.643  -0.893   1.250

  No H/Q in entry =           7
  In of MODEL   30
    1    H    SER  84           H        SER  84   9.654  -1.583   0.715
    2    HA   SER  84           HA       SER  84  10.749  -0.177   2.902
    3    HB2  SER  84           HB2      SER  84  11.959  -2.037   0.866
    4    HB3  SER  84           HB3      SER  84  12.925  -1.304   2.145
    5    HG   SER  84           HG       SER  84  10.621  -2.953   2.411

  No H/Q in entry =           5
  In of MODEL   30
    1    H    MET  85           H        MET  85  11.490   0.079  -0.589
    2    HA   MET  85           HA       MET  85  13.525   2.007  -0.343
    3    HB2  MET  85           HB2      MET  85  13.096   0.738  -2.409
    4    HB3  MET  85           HB3      MET  85  11.584   1.620  -2.630
    5    HG2  MET  85           HG2      MET  85  12.838   3.747  -2.730
    6    HG3  MET  85           HG3      MET  85  14.347   2.865  -2.518
    7    HE1  MET  85           HE1      MET  85  15.119   0.922  -4.090
    8    HE3  MET  85           HE2      MET  85  15.808   2.504  -4.449
    9    HE2  MET  85           HE3      MET  85  15.295   1.460  -5.768

  No H/Q in entry =           9
  In of MODEL   30
    1    H    LEU  86           H        LEU  86  10.040   2.407  -0.834
    2    HA   LEU  86           HA       LEU  86  10.027   5.221  -1.009
    3    HB2  LEU  86           HB2      LEU  86   8.150   3.597  -1.581
    4    HB3  LEU  86           HB3      LEU  86   7.826   3.509   0.151
    5    HG   LEU  86           HG       LEU  86   7.712   6.072   0.105
    6   HD11  LEU  86          HD11      LEU  86   8.468   5.629  -2.601
    7   HD13  LEU  86          HD12      LEU  86   8.063   7.162  -1.835
    8   HD12  LEU  86          HD13      LEU  86   6.806   6.225  -2.636
    9   HD23  LEU  86          HD21      LEU  86   5.546   4.764  -1.551
   10   HD22  LEU  86          HD22      LEU  86   5.385   6.024  -0.330
   11   HD21  LEU  86          HD23      LEU  86   5.756   4.371   0.157

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ALA  87           H        ALA  87   9.533   3.045   1.734
    2    HA   ALA  87           HA       ALA  87   9.029   4.963   3.710
    3    HB1  ALA  87           HB1      ALA  87   9.783   2.129   3.613
    4    HB3  ALA  87           HB2      ALA  87   8.679   2.959   4.706
    5    HB2  ALA  87           HB3      ALA  87  10.409   2.957   5.042

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ARG  88           H        ARG  88  12.081   3.484   2.712
    2    HA   ARG  88           HA       ARG  88  13.724   4.827   4.540
    3    HB2  ARG  88           HB2      ARG  88  14.349   2.845   3.128
    4    HB3  ARG  88           HB3      ARG  88  14.516   3.939   1.757
    5    HG2  ARG  88           HG2      ARG  88  16.022   5.220   3.700
    6    HG3  ARG  88           HG3      ARG  88  16.313   3.524   4.073
    7    HD2  ARG  88           HD2      ARG  88  17.565   3.208   2.220
    8    HD3  ARG  88           HD3      ARG  88  16.440   4.104   1.194
    9    HE   ARG  88           HE       ARG  88  18.859   5.120   2.233
   10   HH21  ARG  88          HH11      ARG  88  19.245   7.332   2.042
   11   HH22  ARG  88          HH12      ARG  88  17.914   8.429   1.908
   12   HH11  ARG  88          HH21      ARG  88  15.533   5.936   1.973
   13   HH12  ARG  88          HH22      ARG  88  15.811   7.636   1.844

  No H/Q in entry =          13
  In of MODEL   30
    1    H    GLU  89           H        GLU  89  12.752   5.752   1.224
    2    HA   GLU  89           HA       GLU  89  14.342   8.083   1.066
    3    HB2  GLU  89           HB2      GLU  89  13.169   7.069  -0.879
    4    HB3  GLU  89           HB3      GLU  89  11.638   7.637  -0.212
    5    HG2  GLU  89           HG2      GLU  89  12.383   9.961  -0.372
    6    HG3  GLU  89           HG3      GLU  89  13.975   9.442  -0.918

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LEU  90           H        LEU  90  11.009   7.633   2.210
    2    HA   LEU  90           HA       LEU  90  10.548  10.374   2.795
    3    HB2  LEU  90           HB2      LEU  90   9.311   7.820   3.822
    4    HB3  LEU  90           HB3      LEU  90   8.712   9.426   4.252
    5    HG   LEU  90           HG       LEU  90   9.100   8.546   1.379
    6   HD12  LEU  90          HD11      LEU  90   6.560   8.264   1.453
    7   HD11  LEU  90          HD12      LEU  90   6.724   8.246   3.209
    8   HD13  LEU  90          HD13      LEU  90   7.514   7.004   2.237
    9   HD22  LEU  90          HD21      LEU  90   8.848  10.859   1.312
   10   HD21  LEU  90          HD22      LEU  90   7.870  10.906   2.777
   11   HD23  LEU  90          HD23      LEU  90   7.155  10.368   1.258

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  91           H        ILE  91  11.770   7.664   4.704
    2    HA   ILE  91           HA       ILE  91  11.949   9.020   7.175
    3    HB   ILE  91           HB       ILE  91  13.453   6.656   6.038
    4   HG12  ILE  91          HG12      ILE  91  11.451   6.854   8.308
    5   HG13  ILE  91          HG13      ILE  91  10.967   6.587   6.634
    6   HG22  ILE  91          HG21      ILE  91  13.932   6.426   8.676
    7   HG21  ILE  91          HG22      ILE  91  13.888   8.186   8.579
    8   HG23  ILE  91          HG23      ILE  91  15.045   7.279   7.607
    9   HD13  ILE  91          HD11      ILE  91  11.930   4.467   6.553
   10   HD12  ILE  91          HD12      ILE  91  11.347   4.532   8.216
   11   HD11  ILE  91          HD13      ILE  91  13.052   4.814   7.870

  No H/Q in entry =          11
  In of MODEL   30
    1    H    THR  92           H        THR  92  14.148   8.817   4.412
    2    HA   THR  92           HA       THR  92  16.345  10.166   5.564
    3    HB   THR  92           HB       THR  92  15.342  10.067   2.708
    4    HG1  THR  92           HG1      THR  92  16.140   8.154   3.104
    5   HG22  THR  92          HG21      THR  92  17.923  10.710   2.403
    6   HG21  THR  92          HG22      THR  92  17.638  11.533   3.936
    7   HG23  THR  92          HG23      THR  92  16.668  11.942   2.522

  No H/Q in entry =           7
  In of MODEL   30
    1    H    GLU  93           H        GLU  93  13.471  11.378   3.853
    2    HA   GLU  93           HA       GLU  93  14.117  14.127   3.971
    3    HB2  GLU  93           HB2      GLU  93  11.388  12.804   3.995
    4    HB3  GLU  93           HB3      GLU  93  11.706  14.499   3.627
    5    HG2  GLU  93           HG2      GLU  93  12.994  12.237   2.086
    6    HG3  GLU  93           HG3      GLU  93  11.458  12.949   1.609

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LEU  94           H        LEU  94  12.346  11.997   6.185
    2    HA   LEU  94           HA       LEU  94  11.583  13.953   8.071
    3    HB2  LEU  94           HB2      LEU  94  12.105  10.987   8.334
    4    HB3  LEU  94           HB3      LEU  94  11.558  11.970   9.690
    5    HG   LEU  94           HG       LEU  94  10.062  12.056   7.069
    6   HD11  LEU  94          HD11      LEU  94  10.114   9.828   9.067
    7   HD13  LEU  94          HD12      LEU  94   9.802   9.777   7.334
    8   HD12  LEU  94          HD13      LEU  94   8.539  10.315   8.440
    9   HD23  LEU  94          HD21      LEU  94   8.159  12.487   8.680
   10   HD22  LEU  94          HD22      LEU  94   9.421  13.718   8.714
   11   HD21  LEU  94          HD23      LEU  94   9.342  12.499   9.985

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  95           H        ILE  95  14.519  11.969   7.814
    2    HA   ILE  95           HA       ILE  95  15.716  12.863  10.224
    3    HB   ILE  95           HB       ILE  95  16.921  11.778   7.666
    4   HG12  ILE  95          HG12      ILE  95  16.618  10.576  10.432
    5   HG13  ILE  95          HG13      ILE  95  15.440  10.342   9.142
    6   HG21  ILE  95          HG21      ILE  95  18.205  12.555  10.304
    7   HG23  ILE  95          HG22      ILE  95  18.669  13.078   8.684
    8   HG22  ILE  95          HG23      ILE  95  18.947  11.411   9.186
    9   HD13  ILE  95          HD11      ILE  95  16.889   9.040   7.868
   10   HD12  ILE  95          HD12      ILE  95  17.362   8.578   9.501
   11   HD11  ILE  95          HD13      ILE  95  18.332   9.742   8.600

  No H/Q in entry =          11
  In of MODEL   30
    1    H    GLU  96           H        GLU  96  15.876  14.103   6.892
    2    HA   GLU  96           HA       GLU  96  17.763  16.145   7.364
    3    HB2  GLU  96           HB2      GLU  96  17.075  15.501   5.107
    4    HB3  GLU  96           HB3      GLU  96  15.444  16.088   5.417
    5    HG2  GLU  96           HG2      GLU  96  16.047  18.208   4.878
    6    HG3  GLU  96           HG3      GLU  96  17.351  18.181   6.053

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LEU  97           H        LEU  97  14.251  16.022   7.812
    2    HA   LEU  97           HA       LEU  97  13.890  18.762   8.463
    3    HB2  LEU  97           HB2      LEU  97  12.328  16.263   9.079
    4    HB3  LEU  97           HB3      LEU  97  11.847  17.817   9.757
    5    HG   LEU  97           HG       LEU  97  12.307  17.400   6.788
    6   HD12  LEU  97          HD11      LEU  97   9.781  17.320   6.684
    7   HD11  LEU  97          HD12      LEU  97   9.780  17.116   8.433
    8   HD13  LEU  97          HD13      LEU  97  10.532  15.897   7.404
    9   HD23  LEU  97          HD21      LEU  97  10.606  19.397   6.835
   10   HD22  LEU  97          HD22      LEU  97  12.296  19.723   7.220
   11   HD21  LEU  97          HD23      LEU  97  11.111  19.572   8.516

  No H/Q in entry =          11
  In of MODEL   30
    1    H    HIS  98           H        HIS  98  14.669  15.915  10.447
    2    HA   HIS  98           HA       HIS  98  14.548  17.172  12.967
    3    HB2  HIS  98           HB2      HIS  98  16.250  14.885  11.950
    4    HB3  HIS  98           HB3      HIS  98  16.268  15.419  13.632
    5    HD1  HIS  98           HD1      HIS  98  14.025  13.838  11.048
    6    HD2  HIS  98           HD2      HIS  98  13.957  14.748  15.115
    7    HE1  HIS  98           HE1      HIS  98  11.983  12.679  12.008
    8    HE2  HIS  98           HE2      HIS  98  11.921  13.225  14.481

  No H/Q in entry =           8
  In of MODEL   30
    1    H    GLU  99           H        GLU  99  17.086  17.016  10.518
    2    HA   GLU  99           HA       GLU  99  19.105  18.305  12.040
    3    HB2  GLU  99           HB2      GLU  99  19.548  17.015   9.964
    4    HB3  GLU  99           HB3      GLU  99  18.757  18.287   9.031
    5    HG2  GLU  99           HG2      GLU  99  20.401  19.925   9.817
    6    HG3  GLU  99           HG3      GLU  99  21.162  18.706  10.833

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LYS 100           H        LYS 100  16.591  19.521   9.840
    2    HA   LYS 100           HA       LYS 100  17.441  22.243   9.987
    3    HB2  LYS 100           HB2      LYS 100  14.780  21.006   9.244
    4    HB3  LYS 100           HB3      LYS 100  15.112  22.739   9.156
    5    HG2  LYS 100           HG2      LYS 100  17.067  22.257   7.677
    6    HG3  LYS 100           HG3      LYS 100  16.621  20.548   7.693
    7    HD2  LYS 100           HD2      LYS 100  14.431  21.102   6.706
    8    HD3  LYS 100           HD3      LYS 100  14.860  22.813   6.698
    9    HE2  LYS 100           HE2      LYS 100  16.801  22.299   5.226
   10    HE3  LYS 100           HE3      LYS 100  16.303  20.604   5.191
   11    HZ1  LYS 100           HZ1      LYS 100  14.516  22.834   4.372
   12    HZ3  LYS 100           HZ2      LYS 100  14.299  21.169   4.106
   13    HZ2  LYS 100           HZ3      LYS 100  15.521  22.010   3.281

  No H/Q in entry =          13
  In of MODEL   30
    1    H    LEU 101           H        LEU 101  15.316  20.232  11.958
    2    HA   LEU 101           HA       LEU 101  14.198  22.317  13.549
    3    HB2  LEU 101           HB2      LEU 101  14.585  19.358  13.922
    4    HB3  LEU 101           HB3      LEU 101  14.076  20.345  15.289
    5    HG   LEU 101           HG       LEU 101  12.645  20.468  12.628
    6   HD12  LEU 101          HD11      LEU 101  10.963  18.933  13.901
    7   HD11  LEU 101          HD12      LEU 101  12.355  18.490  14.887
    8   HD13  LEU 101          HD13      LEU 101  12.373  18.188  13.149
    9   HD21  LEU 101          HD21      LEU 101  12.019  21.265  15.486
   10   HD23  LEU 101          HD22      LEU 101  10.748  21.068  14.282
   11   HD22  LEU 101          HD23      LEU 101  12.005  22.279  14.040

  No H/Q in entry =          11
  In of MODEL   30
    1    H    LYS 102           H        LYS 102  17.331  21.650  13.093
    2    HA   LYS 102           HA       LYS 102  19.200  22.482  14.158
    3    HB2  LYS 102           HB2      LYS 102  17.422  24.028  15.305
    4    HB3  LYS 102           HB3      LYS 102  17.616  22.958  16.678
    5    HG2  LYS 102           HG2      LYS 102  19.541  24.935  15.504
    6    HG3  LYS 102           HG3      LYS 102  19.162  24.624  17.184
    7    HD2  LYS 102           HD2      LYS 102  20.782  22.684  15.484
    8    HD3  LYS 102           HD3      LYS 102  21.502  23.990  16.416
    9    HE2  LYS 102           HE2      LYS 102  21.060  21.446  17.380
   10    HE3  LYS 102           HE3      LYS 102  21.312  22.881  18.374
   11    HZ2  LYS 102           HZ1      LYS 102  19.322  21.634  18.999
   12    HZ1  LYS 102           HZ2      LYS 102  18.674  21.881  17.455
   13    HZ3  LYS 102           HZ3      LYS 102  18.936  23.203  18.483

  No H/Q in entry =          13
  In of MODEL   30
    1    H    ALA 103           H        ALA 103  17.111  20.910  16.587
    2    HA   ALA 103           HA       ALA 103  18.823  19.661  18.228
    3    HB2  ALA 103           HB1      ALA 103  17.200  17.685  18.226
    4    HB1  ALA 103           HB2      ALA 103  16.314  18.559  16.976
    5    HB3  ALA 103           HB3      ALA 103  16.515  19.272  18.575

  No H/Q in entry =           5
  In of MODEL   30
    1    H1   ALA   1           H3       ALA   1  -1.847  -6.682 -21.355
    2    H2   ALA   1           H2       ALA   1  -2.667  -8.103 -20.902
    3    H3   ALA   1           H1       ALA   1  -1.064  -8.183 -21.466
    4    HA   ALA   1           HA       ALA   1  -1.918  -8.630 -23.459
    5    HB1  ALA   1           HB1      ALA   1  -4.066  -9.306 -22.976
    6    HB2  ALA   1           HB2      ALA   1  -4.479  -7.785 -23.766
    7    HB3  ALA   1           HB3      ALA   1  -4.410  -7.872 -22.008

  No H/Q in entry =           7
  In of MODEL   30
    1    H    GLU   2           H        GLU   2  -2.735  -7.417 -25.440
    2    HA   GLU   2           HA       GLU   2  -1.301  -5.429 -26.319
    3    HB2  GLU   2           HB2      GLU   2  -4.310  -5.435 -26.621
    4    HB3  GLU   2           HB3      GLU   2  -3.178  -4.591 -27.674
    5    HG2  GLU   2           HG2      GLU   2  -2.719  -6.487 -28.837
    6    HG3  GLU   2           HG3      GLU   2  -2.432  -7.403 -27.364

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLU   3           H        GLU   3  -4.430  -4.111 -25.398
    2    HA   GLU   3           HA       GLU   3  -3.330  -1.579 -24.768
    3    HB2  GLU   3           HB2      GLU   3  -6.042  -2.840 -24.426
    4    HB3  GLU   3           HB3      GLU   3  -5.708  -1.234 -23.776
    5    HG2  GLU   3           HG2      GLU   3  -5.344  -0.307 -25.901
    6    HG3  GLU   3           HG3      GLU   3  -4.984  -1.868 -26.632

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LEU   4           H        LEU   4  -4.955  -3.912 -22.587
    2    HA   LEU   4           HA       LEU   4  -4.554  -2.699 -20.194
    3    HB2  LEU   4           HB2      LEU   4  -4.072  -5.649 -20.675
    4    HB3  LEU   4           HB3      LEU   4  -4.455  -4.900 -19.127
    5    HG   LEU   4           HG       LEU   4  -6.242  -4.930 -21.582
    6   HD13  LEU   4          HD11      LEU   4  -7.464  -6.626 -20.583
    7   HD12  LEU   4          HD12      LEU   4  -6.961  -6.182 -18.953
    8   HD11  LEU   4          HD13      LEU   4  -5.848  -7.044 -20.013
    9   HD23  LEU   4          HD21      LEU   4  -7.900  -4.091 -19.703
   10   HD22  LEU   4          HD22      LEU   4  -6.842  -2.938 -20.515
   11   HD21  LEU   4          HD23      LEU   4  -6.420  -3.542 -18.914

  No H/Q in entry =          11
  In of MODEL   30
    1    H    GLU   5           H        GLU   5  -2.102  -4.586 -21.944
    2    HA   GLU   5           HA       GLU   5  -0.103  -4.349 -19.917
    3    HB2  GLU   5           HB2      GLU   5  -0.097  -6.110 -21.690
    4    HB3  GLU   5           HB3      GLU   5   0.269  -4.862 -22.882
    5    HG2  GLU   5           HG2      GLU   5   2.357  -5.871 -22.242
    6    HG3  GLU   5           HG3      GLU   5   2.306  -4.271 -21.505

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLU   6           H        GLU   6  -0.719  -2.613 -22.953
    2    HA   GLU   6           HA       GLU   6   1.488  -0.826 -22.691
    3    HB2  GLU   6           HB2      GLU   6   0.353  -1.271 -24.850
    4    HB3  GLU   6           HB3      GLU   6  -1.093  -0.470 -24.236
    5    HG2  GLU   6           HG2      GLU   6   0.156   1.618 -23.947
    6    HG3  GLU   6           HG3      GLU   6   1.633   0.829 -24.493

  No H/Q in entry =           6
  In of MODEL   30
    1    H    VAL   7           H        VAL   7  -1.845  -0.834 -21.629
    2    HA   VAL   7           HA       VAL   7  -2.007   1.880 -20.783
    3    HB   VAL   7           HB       VAL   7  -3.516  -0.611 -19.947
    4   HG11  VAL   7          HG11      VAL   7  -3.828   2.283 -19.122
    5   HG13  VAL   7          HG12      VAL   7  -3.752   0.853 -18.091
    6   HG12  VAL   7          HG13      VAL   7  -5.184   1.154 -19.075
    7   HG21  VAL   7          HG21      VAL   7  -3.664   0.476 -22.331
    8   HG23  VAL   7          HG22      VAL   7  -4.580   1.741 -21.510
    9   HG22  VAL   7          HG23      VAL   7  -5.159   0.075 -21.485

  No H/Q in entry =           9
  In of MODEL   30
    1    H    VAL   8           H        VAL   8  -1.072  -1.130 -19.154
    2    HA   VAL   8           HA       VAL   8  -0.718  -0.065 -16.557
    3    HB   VAL   8           HB       VAL   8   0.562  -2.423 -17.955
    4   HG13  VAL   8          HG11      VAL   8   2.143  -1.866 -16.290
    5   HG12  VAL   8          HG12      VAL   8   1.114  -3.063 -15.504
    6   HG11  VAL   8          HG13      VAL   8   0.898  -1.349 -15.154
    7   HG22  VAL   8          HG21      VAL   8  -1.097  -3.732 -16.901
    8   HG21  VAL   8          HG22      VAL   8  -1.990  -2.257 -17.259
    9   HG23  VAL   8          HG23      VAL   8  -1.376  -2.538 -15.635

  No H/Q in entry =           9
  In of MODEL   30
    1    H    MET   9           H        MET   9   1.510  -0.403 -19.318
    2    HA   MET   9           HA       MET   9   3.823   0.589 -18.066
    3    HB2  MET   9           HB2      MET   9   2.861   0.648 -20.925
    4    HB3  MET   9           HB3      MET   9   4.395   1.377 -20.452
    5    HG2  MET   9           HG2      MET   9   5.158  -0.766 -19.533
    6    HG3  MET   9           HG3      MET   9   3.606  -1.505 -19.932
    7    HE1  MET   9           HE1      MET   9   6.620   0.321 -20.988
    8    HE3  MET   9           HE2      MET   9   5.742   1.111 -22.294
    9    HE2  MET   9           HE3      MET   9   6.960  -0.104 -22.670

  No H/Q in entry =           9
  In of MODEL   30
    1    H    GLY  10           H        GLY  10   1.164   2.252 -19.723
    2    HA3  GLY  10           HA2      GLY  10   2.183   4.884 -19.476
    3    HA2  GLY  10           HA3      GLY  10   0.484   4.460 -19.673

  No H/Q in entry =           3
  In of MODEL   30
    1    H    LEU  11           H        LEU  11   0.065   2.934 -17.389
    2    HA   LEU  11           HA       LEU  11  -0.412   4.915 -15.420
    3    HB2  LEU  11           HB2      LEU  11  -0.408   1.899 -15.274
    4    HB3  LEU  11           HB3      LEU  11  -0.887   2.927 -13.925
    5    HG   LEU  11           HG       LEU  11  -2.139   3.076 -16.681
    6   HD13  LEU  11          HD11      LEU  11  -2.764   0.944 -15.930
    7   HD12  LEU  11          HD12      LEU  11  -4.090   1.962 -15.373
    8   HD11  LEU  11          HD13      LEU  11  -2.838   1.451 -14.242
    9   HD22  LEU  11          HD21      LEU  11  -2.681   5.101 -15.665
   10   HD21  LEU  11          HD22      LEU  11  -2.611   4.428 -14.036
   11   HD23  LEU  11          HD23      LEU  11  -4.000   4.095 -15.072

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  12           H        ILE  12   2.076   2.396 -15.685
    2    HA   ILE  12           HA       ILE  12   3.308   2.900 -13.187
    3    HB   ILE  12           HB       ILE  12   4.529   1.845 -15.759
    4   HG12  ILE  12          HG12      ILE  12   2.490   0.654 -14.612
    5   HG13  ILE  12          HG13      ILE  12   3.864  -0.311 -15.116
    6   HG23  ILE  12          HG21      ILE  12   6.302   2.529 -14.263
    7   HG22  ILE  12          HG22      ILE  12   6.182   0.771 -14.178
    8   HG21  ILE  12          HG23      ILE  12   5.505   1.765 -12.890
    9   HD11  ILE  12          HD11      ILE  12   3.451   0.782 -12.321
   10   HD13  ILE  12          HD12      ILE  12   4.701  -0.349 -12.839
   11   HD12  ILE  12          HD13      ILE  12   3.023  -0.843 -12.822

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  13           H        ILE  13   3.916   4.161 -16.444
    2    HA   ILE  13           HA       ILE  13   6.094   5.832 -15.726
    3    HB   ILE  13           HB       ILE  13   4.052   5.966 -17.959
    4   HG12  ILE  13          HG12      ILE  13   5.793   4.065 -17.741
    5   HG13  ILE  13          HG13      ILE  13   5.656   4.885 -19.292
    6   HG23  ILE  13          HG21      ILE  13   4.797   8.217 -17.748
    7   HG22  ILE  13          HG22      ILE  13   5.766   7.537 -19.050
    8   HG21  ILE  13          HG23      ILE  13   6.464   7.728 -17.443
    9   HD11  ILE  13          HD11      ILE  13   7.607   6.069 -17.378
   10   HD13  ILE  13          HD12      ILE  13   7.726   5.841 -19.118
   11   HD12  ILE  13          HD13      ILE  13   8.021   4.486 -18.034

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ASN  14           H        ASN  14   2.597   6.403 -15.971
    2    HA   ASN  14           HA       ASN  14   2.618   9.147 -15.325
    3    HB2  ASN  14           HB2      ASN  14   0.685   7.549 -16.149
    4    HB3  ASN  14           HB3      ASN  14   0.370   7.372 -14.428
    5   HD21  ASN  14          HD21      ASN  14  -1.633   8.575 -15.844
    6   HD22  ASN  14          HD22      ASN  14  -1.658  10.249 -15.571

  No H/Q in entry =           6
  In of MODEL   30
    1    H    SER  15           H        SER  15   2.274   6.270 -13.256
    2    HA   SER  15           HA       SER  15   2.011   7.639 -10.801
    3    HB2  SER  15           HB2      SER  15   2.514   5.540  -9.763
    4    HB3  SER  15           HB3      SER  15   1.679   5.139 -11.260
    5    HG   SER  15           HG       SER  15   4.024   4.308 -10.517

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLY  16           H        GLY  16   4.852   6.487 -12.582
    2    HA3  GLY  16           HA2      GLY  16   6.805   7.197 -10.660
    3    HA2  GLY  16           HA3      GLY  16   7.093   6.994 -12.386

  No H/Q in entry =           3
  In of MODEL   30
    1    H    GLN  17           H        GLN  17   5.438   8.990 -13.433
    2    HA   GLN  17           HA       GLN  17   7.066  11.297 -13.127
    3    HB2  GLN  17           HB2      GLN  17   5.722  10.851 -15.162
    4    HB3  GLN  17           HB3      GLN  17   4.246  11.099 -14.229
    5    HG2  GLN  17           HG2      GLN  17   4.975  13.408 -13.706
    6    HG3  GLN  17           HG3      GLN  17   6.422  13.159 -14.681
    7   HE21  GLN  17          HE21      GLN  17   6.203  13.984 -16.759
    8   HE22  GLN  17          HE22      GLN  17   4.744  14.072 -17.623

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ALA  18           H        ALA  18   3.953  10.338 -11.762
    2    HA   ALA  18           HA       ALA  18   3.285  12.737 -10.484
    3    HB1  ALA  18           HB1      ALA  18   2.104  10.305 -10.707
    4    HB2  ALA  18           HB2      ALA  18   1.588  11.532  -9.553
    5    HB3  ALA  18           HB3      ALA  18   2.655  10.226  -9.034

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ARG  19           H        ARG  19   5.110   9.933  -9.225
    2    HA   ARG  19           HA       ARG  19   5.681  11.072  -6.703
    3    HB2  ARG  19           HB2      ARG  19   6.044   8.663  -7.240
    4    HB3  ARG  19           HB3      ARG  19   7.403   9.125  -8.268
    5    HG2  ARG  19           HG2      ARG  19   8.555  10.136  -6.349
    6    HG3  ARG  19           HG3      ARG  19   7.178   9.772  -5.310
    7    HD2  ARG  19           HD2      ARG  19   8.909   8.101  -4.969
    8    HD3  ARG  19           HD3      ARG  19   7.515   7.349  -5.748
    9    HE   ARG  19           HE       ARG  19   9.223   8.140  -7.803
   10   HH21  ARG  19          HH11      ARG  19  10.750   6.707  -8.668
   11   HH22  ARG  19          HH12      ARG  19  11.274   5.346  -7.740
   12   HH11  ARG  19          HH21      ARG  19   9.271   6.100  -5.032
   13   HH12  ARG  19          HH22      ARG  19  10.434   5.001  -5.680

  No H/Q in entry =          13
  In of MODEL   30
    1    H    SER  20           H        SER  20   7.480  11.075  -9.763
    2    HA   SER  20           HA       SER  20   9.757  12.444  -8.948
    3    HB2  SER  20           HB2      SER  20   9.755  11.573 -11.156
    4    HB3  SER  20           HB3      SER  20   8.273  12.425 -11.572
    5    HG   SER  20           HG       SER  20  10.895  13.324 -11.443

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU  21           H        LEU  21   6.676  13.777 -10.122
    2    HA   LEU  21           HA       LEU  21   7.401  16.508  -9.893
    3    HB2  LEU  21           HB2      LEU  21   4.707  15.135  -9.803
    4    HB3  LEU  21           HB3      LEU  21   4.906  16.885  -9.800
    5    HG   LEU  21           HG       LEU  21   6.061  15.082 -11.946
    6   HD11  LEU  21          HD11      LEU  21   3.404  16.506 -11.754
    7   HD13  LEU  21          HD12      LEU  21   3.717  14.819 -12.168
    8   HD12  LEU  21          HD13      LEU  21   4.126  16.098 -13.311
    9   HD23  LEU  21          HD21      LEU  21   5.863  17.413 -13.175
   10   HD22  LEU  21          HD22      LEU  21   7.226  17.137 -12.094
   11   HD21  LEU  21          HD23      LEU  21   5.846  18.073 -11.541

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ALA  22           H        ALA  22   5.859  14.241  -7.643
    2    HA   ALA  22           HA       ALA  22   5.302  16.053  -5.567
    3    HB3  ALA  22           HB1      ALA  22   4.496  13.676  -5.733
    4    HB2  ALA  22           HB2      ALA  22   5.102  14.131  -4.140
    5    HB1  ALA  22           HB3      ALA  22   6.101  13.157  -5.221

  No H/Q in entry =           5
  In of MODEL   30
    1    H    TYR  23           H        TYR  23   8.195  13.974  -6.030
    2    HA   TYR  23           HA       TYR  23   9.611  14.960  -3.782
    3    HB2  TYR  23           HB2      TYR  23  10.355  12.943  -4.949
    4    HB3  TYR  23           HB3      TYR  23  10.673  13.877  -6.410
    5    HD1  TYR  23           HD1      TYR  23  11.655  13.531  -2.823
    6    HD2  TYR  23           HD2      TYR  23  12.731  15.002  -6.715
    7    HE1  TYR  23           HE1      TYR  23  13.930  14.068  -1.993
    8    HE2  TYR  23           HE2      TYR  23  15.004  15.539  -5.883
    9    HH   TYR  23           HH       TYR  23  16.143  14.445  -2.810

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ALA  24           H        ALA  24   9.428  16.081  -7.144
    2    HA   ALA  24           HA       ALA  24  11.362  18.131  -6.903
    3    HB2  ALA  24           HB1      ALA  24  10.907  18.209  -9.109
    4    HB3  ALA  24           HB2      ALA  24   9.368  18.985  -8.738
    5    HB1  ALA  24           HB3      ALA  24   9.461  17.230  -8.874

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA  25           H        ALA  25   7.884  18.007  -6.261
    2    HA   ALA  25           HA       ALA  25   7.456  20.731  -5.681
    3    HB1  ALA  25           HB1      ALA  25   5.758  18.763  -5.878
    4    HB2  ALA  25           HB2      ALA  25   5.420  20.054  -4.723
    5    HB3  ALA  25           HB3      ALA  25   6.087  18.519  -4.161

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU  26           H        LEU  26   8.490  18.027  -3.646
    2    HA   LEU  26           HA       LEU  26   8.634  19.448  -1.205
    3    HB2  LEU  26           HB2      LEU  26   8.688  17.030  -1.207
    4    HB3  LEU  26           HB3      LEU  26  10.152  17.016  -2.187
    5    HG   LEU  26           HG       LEU  26  11.397  18.107  -0.351
    6   HD12  LEU  26          HD11      LEU  26  10.185  18.129   1.916
    7   HD11  LEU  26          HD12      LEU  26   8.689  18.019   0.990
    8   HD13  LEU  26          HD13      LEU  26   9.756  19.408   0.779
    9   HD21  LEU  26          HD21      LEU  26   9.827  15.663   0.524
   10   HD23  LEU  26          HD22      LEU  26  11.356  16.198   1.214
   11   HD22  LEU  26          HD23      LEU  26  11.291  15.645  -0.458

  No H/Q in entry =          11
  In of MODEL   30
    1    H    LYS  27           H        LYS  27  11.025  18.843  -3.746
    2    HA   LYS  27           HA       LYS  27  13.237  20.043  -2.528
    3    HB2  LYS  27           HB2      LYS  27  13.303  18.701  -4.622
    4    HB3  LYS  27           HB3      LYS  27  12.555  20.048  -5.479
    5    HG2  LYS  27           HG2      LYS  27  14.449  21.501  -4.909
    6    HG3  LYS  27           HG3      LYS  27  15.193  20.193  -3.981
    7    HD2  LYS  27           HD2      LYS  27  15.301  18.810  -6.040
    8    HD3  LYS  27           HD3      LYS  27  14.602  20.142  -6.960
    9    HE2  LYS  27           HE2      LYS  27  16.517  21.575  -6.354
   10    HE3  LYS  27           HE3      LYS  27  17.220  20.246  -5.425
   11    HZ3  LYS  27           HZ1      LYS  27  18.198  20.336  -7.618
   12    HZ2  LYS  27           HZ2      LYS  27  16.665  20.245  -8.349
   13    HZ1  LYS  27           HZ3      LYS  27  17.272  18.922  -7.472

  No H/Q in entry =          13
  In of MODEL   30
    1    H    GLN  28           H        GLN  28  10.626  21.473  -4.457
    2    HA   GLN  28           HA       GLN  28  11.627  24.110  -4.608
    3    HB2  GLN  28           HB2      GLN  28   8.778  23.086  -4.481
    4    HB3  GLN  28           HB3      GLN  28   9.216  24.752  -4.855
    5    HG2  GLN  28           HG2      GLN  28  10.159  22.327  -6.411
    6    HG3  GLN  28           HG3      GLN  28   8.842  23.388  -6.906
    7   HE21  GLN  28          HE21      GLN  28  12.003  22.839  -7.593
    8   HE22  GLN  28          HE22      GLN  28  12.502  24.413  -7.987

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ALA  29           H        ALA  29   9.683  22.442  -2.165
    2    HA   ALA  29           HA       ALA  29   9.180  24.638  -0.473
    3    HB2  ALA  29           HB1      ALA  29   8.435  23.077   1.095
    4    HB1  ALA  29           HB2      ALA  29   9.635  21.874   0.619
    5    HB3  ALA  29           HB3      ALA  29   8.247  22.193  -0.420

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LYS  30           H        LYS  30  11.873  22.328  -0.566
    2    HA   LYS  30           HA       LYS  30  13.220  23.254   1.731
    3    HB2  LYS  30           HB2      LYS  30  14.280  21.958  -0.790
    4    HB3  LYS  30           HB3      LYS  30  15.277  22.297   0.627
    5    HG2  LYS  30           HG2      LYS  30  13.711  20.935   2.012
    6    HG3  LYS  30           HG3      LYS  30  12.810  20.532   0.547
    7    HD2  LYS  30           HD2      LYS  30  14.833  19.516  -0.430
    8    HD3  LYS  30           HD3      LYS  30  15.753  19.933   1.017
    9    HE2  LYS  30           HE2      LYS  30  14.234  18.521   2.377
   10    HE3  LYS  30           HE3      LYS  30  13.343  18.084   0.913
   11    HZ2  LYS  30           HZ1      LYS  30  15.115  16.475   1.658
   12    HZ1  LYS  30           HZ2      LYS  30  16.267  17.646   1.203
   13    HZ3  LYS  30           HZ3      LYS  30  15.214  16.982   0.043

  No H/Q in entry =          13
  In of MODEL   30
    1    H    GLN  31           H        GLN  31  13.110  24.470  -1.561
    2    HA   GLN  31           HA       GLN  31  15.295  26.327  -1.148
    3    HB2  GLN  31           HB2      GLN  31  13.239  26.413  -3.359
    4    HB3  GLN  31           HB3      GLN  31  14.870  27.083  -3.368
    5    HG2  GLN  31           HG2      GLN  31  15.293  24.378  -2.804
    6    HG3  GLN  31           HG3      GLN  31  13.981  24.348  -3.974
    7   HE21  GLN  31          HE21      GLN  31  16.809  23.512  -4.398
    8   HE22  GLN  31          HE22      GLN  31  17.388  24.479  -5.665

  No H/Q in entry =           8
  In of MODEL   30
    1    H    GLY  32           H        GLY  32  12.225  26.190   0.016
    2    HA3  GLY  32           HA2      GLY  32  11.102  27.773   1.301
    3    HA2  GLY  32           HA3      GLY  32  12.243  28.992   0.748

  No H/Q in entry =           3
  In of MODEL   30
    1    H    ASP  33           H        ASP  33  10.833  27.117  -1.741
    2    HA   ASP  33           HA       ASP  33   9.200  29.418  -2.580
    3    HB2  ASP  33           HB2      ASP  33  10.246  26.986  -4.036
    4    HB3  ASP  33           HB3      ASP  33   9.108  28.122  -4.756

  No H/Q in entry =           4
  In of MODEL   30
    1    H    PHE  34           H        PHE  34   7.514  28.965  -1.007
    2    HA   PHE  34           HA       PHE  34   6.096  26.514  -0.910
    3    HB2  PHE  34           HB2      PHE  34   5.184  29.314  -0.216
    4    HB3  PHE  34           HB3      PHE  34   4.314  27.836   0.197
    5    HD1  PHE  34           HD1      PHE  34   6.609  30.195   1.404
    6    HD2  PHE  34           HD2      PHE  34   5.862  25.965   1.342
    7    HE1  PHE  34           HE1      PHE  34   8.008  29.916   3.431
    8    HE2  PHE  34           HE2      PHE  34   7.263  25.691   3.367
    9    HZ   PHE  34           HZ       PHE  34   8.331  27.668   4.411

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ALA  35           H        ALA  35   5.698  29.390  -2.909
    2    HA   ALA  35           HA       ALA  35   3.131  28.819  -3.920
    3    HB1  ALA  35           HB1      ALA  35   4.192  30.201  -5.960
    4    HB3  ALA  35           HB2      ALA  35   5.423  30.539  -4.743
    5    HB2  ALA  35           HB3      ALA  35   3.741  30.974  -4.441

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA  36           H        ALA  36   6.340  28.100  -5.297
    2    HA   ALA  36           HA       ALA  36   5.315  26.693  -7.538
    3    HB3  ALA  36           HB1      ALA  36   7.472  26.785  -8.167
    4    HB2  ALA  36           HB2      ALA  36   7.945  25.745  -6.823
    5    HB1  ALA  36           HB3      ALA  36   7.869  27.494  -6.602

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA  37           H        ALA  37   6.276  25.674  -4.292
    2    HA   ALA  37           HA       ALA  37   6.171  22.888  -4.729
    3    HB2  ALA  37           HB1      ALA  37   5.953  24.676  -2.344
    4    HB1  ALA  37           HB2      ALA  37   7.063  23.342  -2.647
    5    HB3  ALA  37           HB3      ALA  37   5.400  23.012  -2.167

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LYS  38           H        LYS  38   3.680  25.132  -3.539
    2    HA   LYS  38           HA       LYS  38   1.554  23.351  -3.308
    3    HB2  LYS  38           HB2      LYS  38   1.950  26.101  -3.051
    4    HB3  LYS  38           HB3      LYS  38   0.741  25.976  -4.323
    5    HG2  LYS  38           HG2      LYS  38  -0.720  24.671  -2.875
    6    HG3  LYS  38           HG3      LYS  38   0.531  24.588  -1.627
    7    HD2  LYS  38           HD2      LYS  38   0.384  26.926  -1.171
    8    HD3  LYS  38           HD3      LYS  38  -0.532  27.233  -2.647
    9    HE2  LYS  38           HE2      LYS  38  -2.023  27.285  -0.698
   10    HE3  LYS  38           HE3      LYS  38  -2.425  25.918  -1.742
   11    HZ3  LYS  38           HZ1      LYS  38  -1.713  24.431  -0.217
   12    HZ2  LYS  38           HZ2      LYS  38  -2.037  25.691   0.878
   13    HZ1  LYS  38           HZ3      LYS  38  -0.450  25.417   0.342

  No H/Q in entry =          13
  In of MODEL   30
    1    H    ALA  39           H        ALA  39   2.545  25.247  -6.157
    2    HA   ALA  39           HA       ALA  39   0.446  24.417  -7.850
    3    HB2  ALA  39           HB1      ALA  39   3.185  25.026  -8.919
    4    HB1  ALA  39           HB2      ALA  39   2.243  26.299  -8.144
    5    HB3  ALA  39           HB3      ALA  39   1.608  25.476  -9.568

  No H/Q in entry =           5
  In of MODEL   30
    1    H    MET  40           H        MET  40   3.666  23.066  -7.294
    2    HA   MET  40           HA       MET  40   3.525  21.054  -9.291
    3    HB2  MET  40           HB2      MET  40   5.156  21.245  -6.752
    4    HB3  MET  40           HB3      MET  40   5.379  19.989  -7.972
    5    HG2  MET  40           HG2      MET  40   5.478  22.945  -8.629
    6    HG3  MET  40           HG3      MET  40   6.913  22.019  -8.191
    7    HE3  MET  40           HE1      MET  40   7.733  19.799 -11.012
    8    HE2  MET  40           HE2      MET  40   7.175  19.484  -9.372
    9    HE1  MET  40           HE3      MET  40   8.290  20.815  -9.674

  No H/Q in entry =           9
  In of MODEL   30
    1    H    MET  41           H        MET  41   2.632  21.100  -5.861
    2    HA   MET  41           HA       MET  41   2.059  18.343  -5.588
    3    HB2  MET  41           HB2      MET  41   0.771  20.716  -4.222
    4    HB3  MET  41           HB3      MET  41   0.593  19.040  -3.718
    5    HG2  MET  41           HG2      MET  41   3.306  19.221  -3.771
    6    HG3  MET  41           HG3      MET  41   2.894  20.885  -3.368
    7    HE2  MET  41           HE1      MET  41  -0.154  19.673  -1.627
    8    HE1  MET  41           HE2      MET  41   0.684  21.175  -2.005
    9    HE3  MET  41           HE3      MET  41   0.626  20.600  -0.338

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ASP  42           H        ASP  42   0.057  21.101  -6.541
    2    HA   ASP  42           HA       ASP  42  -2.405  19.778  -6.666
    3    HB2  ASP  42           HB2      ASP  42  -1.661  22.338  -6.920
    4    HB3  ASP  42           HB3      ASP  42  -1.829  21.951  -8.628

  No H/Q in entry =           4
  In of MODEL   30
    1    H    GLN  43           H        GLN  43   0.028  20.339  -9.182
    2    HA   GLN  43           HA       GLN  43  -1.392  19.047 -11.266
    3    HB2  GLN  43           HB2      GLN  43   1.576  19.518 -10.902
    4    HB3  GLN  43           HB3      GLN  43   0.844  18.893 -12.381
    5    HG2  GLN  43           HG2      GLN  43  -0.637  20.943 -12.407
    6    HG3  GLN  43           HG3      GLN  43   0.334  21.580 -11.084
    7   HE21  GLN  43          HE21      GLN  43   0.506  23.205 -13.166
    8   HE22  GLN  43          HE22      GLN  43   1.912  22.965 -14.083

  No H/Q in entry =           8
  In of MODEL   30
    1    H    SER  44           H        SER  44   0.957  17.865  -8.894
    2    HA   SER  44           HA       SER  44   1.246  15.257  -9.929
    3    HB2  SER  44           HB2      SER  44   2.176  16.675  -7.694
    4    HB3  SER  44           HB3      SER  44   1.298  15.303  -7.022
    5    HG   SER  44           HG       SER  44   3.396  14.653  -7.463

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ARG  45           H        ARG  45  -1.039  16.602  -7.572
    2    HA   ARG  45           HA       ARG  45  -2.456  14.260  -6.935
    3    HB2  ARG  45           HB2      ARG  45  -2.615  16.428  -5.736
    4    HB3  ARG  45           HB3      ARG  45  -3.470  17.111  -7.116
    5    HG2  ARG  45           HG2      ARG  45  -5.260  15.411  -6.826
    6    HG3  ARG  45           HG3      ARG  45  -4.416  14.782  -5.410
    7    HD2  ARG  45           HD2      ARG  45  -4.582  17.048  -4.346
    8    HD3  ARG  45           HD3      ARG  45  -5.570  17.587  -5.721
    9    HE   ARG  45           HE       ARG  45  -6.708  15.224  -4.681
   10   HH21  ARG  45          HH11      ARG  45  -8.535  15.322  -3.399
   11   HH22  ARG  45          HH12      ARG  45  -8.903  16.765  -2.523
   12   HH11  ARG  45          HH21      ARG  45  -6.109  18.459  -3.651
   13   HH12  ARG  45          HH22      ARG  45  -7.524  18.542  -2.664

  No H/Q in entry =          13
  In of MODEL   30
    1    H    MET  46           H        MET  46  -3.022  16.681  -9.475
    2    HA   MET  46           HA       MET  46  -5.384  15.545 -10.526
    3    HB2  MET  46           HB2      MET  46  -3.262  17.338 -11.718
    4    HB3  MET  46           HB3      MET  46  -4.670  16.814 -12.647
    5    HG2  MET  46           HG2      MET  46  -6.166  17.762 -10.947
    6    HG3  MET  46           HG3      MET  46  -4.781  18.252  -9.977
    7    HE2  MET  46           HE1      MET  46  -5.153  20.845  -9.862
    8    HE1  MET  46           HE2      MET  46  -6.742  20.302 -10.391
    9    HE3  MET  46           HE3      MET  46  -5.991  21.694 -11.168

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ALA  47           H        ALA  47  -1.967  15.019 -11.306
    2    HA   ALA  47           HA       ALA  47  -2.351  13.303 -13.520
    3    HB3  ALA  47           HB1      ALA  47  -0.159  14.161 -13.179
    4    HB2  ALA  47           HB2      ALA  47  -0.040  12.430 -12.851
    5    HB1  ALA  47           HB3      ALA  47  -0.108  13.579 -11.514

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU  48           H        LEU  48  -2.069  12.654 -10.049
    2    HA   LEU  48           HA       LEU  48  -2.204   9.816 -10.215
    3    HB2  LEU  48           HB2      LEU  48  -2.928  11.738  -7.991
    4    HB3  LEU  48           HB3      LEU  48  -2.857   9.985  -7.796
    5    HG   LEU  48           HG       LEU  48  -0.541  11.655  -8.803
    6   HD13  LEU  48          HD11      LEU  48  -0.799  12.423  -6.608
    7   HD12  LEU  48          HD12      LEU  48   0.347  11.098  -6.421
    8   HD11  LEU  48          HD13      LEU  48  -1.352  10.859  -6.013
    9   HD22  LEU  48          HD21      LEU  48  -0.077   9.465  -9.453
   10   HD21  LEU  48          HD22      LEU  48  -0.948   8.758  -8.093
   11   HD23  LEU  48          HD23      LEU  48   0.637   9.488  -7.841

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ASN  49           H        ASN  49  -4.630  12.341  -9.791
    2    HA   ASN  49           HA       ASN  49  -6.835  10.706  -9.243
    3    HB2  ASN  49           HB2      ASN  49  -6.846  13.133  -8.917
    4    HB3  ASN  49           HB3      ASN  49  -6.712  13.388 -10.652
    5   HD21  ASN  49          HD21      ASN  49  -8.880  14.499  -9.267
    6   HD22  ASN  49          HD22      ASN  49 -10.303  13.683  -9.701

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLU  50           H        GLU  50  -5.558  11.894 -12.335
    2    HA   GLU  50           HA       GLU  50  -7.540  10.671 -13.972
    3    HB2  GLU  50           HB2      GLU  50  -6.053  12.471 -14.790
    4    HB3  GLU  50           HB3      GLU  50  -4.674  11.379 -14.664
    5    HG2  GLU  50           HG2      GLU  50  -5.679   9.862 -16.299
    6    HG3  GLU  50           HG3      GLU  50  -7.126  10.862 -16.375

  No H/Q in entry =           6
  In of MODEL   30
    1    H    ALA  51           H        ALA  51  -4.376   9.630 -12.789
    2    HA   ALA  51           HA       ALA  51  -4.280   7.180 -14.215
    3    HB2  ALA  51           HB1      ALA  51  -2.297   6.861 -13.127
    4    HB1  ALA  51           HB2      ALA  51  -2.969   7.288 -11.554
    5    HB3  ALA  51           HB3      ALA  51  -2.503   8.556 -12.688

  No H/Q in entry =           5
  In of MODEL   30
    1    H    HIS  52           H        HIS  52  -5.421   8.019 -10.956
    2    HA   HIS  52           HA       HIS  52  -6.139   5.416 -10.128
    3    HB2  HIS  52           HB2      HIS  52  -5.962   7.383  -8.620
    4    HB3  HIS  52           HB3      HIS  52  -7.428   8.041  -9.347
    5    HD1  HIS  52           HD1      HIS  52  -9.673   6.805  -8.853
    6    HD2  HIS  52           HD2      HIS  52  -6.385   5.199  -6.859
    7    HE1  HIS  52           HE1      HIS  52 -10.599   5.240  -7.090
    8    HE2  HIS  52           HE2      HIS  52  -8.605   4.253  -5.865

  No H/Q in entry =           8
  In of MODEL   30
    1    H    LEU  53           H        LEU  53  -7.934   7.905 -11.898
    2    HA   LEU  53           HA       LEU  53 -10.458   6.650 -11.900
    3    HB2  LEU  53           HB2      LEU  53  -9.156   8.618 -13.770
    4    HB3  LEU  53           HB3      LEU  53 -10.767   7.976 -14.086
    5    HG   LEU  53           HG       LEU  53 -10.016   9.278 -11.448
    6   HD12  LEU  53          HD11      LEU  53 -11.439  10.555 -13.801
    7   HD11  LEU  53          HD12      LEU  53  -9.747  10.845 -13.392
    8   HD13  LEU  53          HD13      LEU  53 -11.021  11.326 -12.276
    9   HD22  LEU  53          HD21      LEU  53 -12.029   8.109 -11.101
   10   HD21  LEU  53          HD22      LEU  53 -12.570   8.362 -12.756
   11   HD23  LEU  53          HD23      LEU  53 -12.631   9.682 -11.605

  No H/Q in entry =          11
  In of MODEL   30
    1    H    VAL  54           H        VAL  54  -7.724   6.419 -14.153
    2    HA   VAL  54           HA       VAL  54  -8.983   4.672 -15.995
    3    HB   VAL  54           HB       VAL  54  -6.064   5.133 -15.328
    4   HG12  VAL  54          HG11      VAL  54  -5.847   4.052 -17.721
    5   HG11  VAL  54          HG12      VAL  54  -7.384   3.292 -17.311
    6   HG13  VAL  54          HG13      VAL  54  -5.967   3.014 -16.301
    7   HG22  VAL  54          HG21      VAL  54  -6.811   7.091 -16.362
    8   HG21  VAL  54          HG22      VAL  54  -8.023   6.248 -17.326
    9   HG23  VAL  54          HG23      VAL  54  -6.320   6.144 -17.767

  No H/Q in entry =           9
  In of MODEL   30
    1    H    GLN  55           H        GLN  55  -6.976   4.087 -13.108
    2    HA   GLN  55           HA       GLN  55  -6.929   1.270 -13.373
    3    HB2  GLN  55           HB2      GLN  55  -5.352   2.139 -11.860
    4    HB3  GLN  55           HB3      GLN  55  -6.549   3.121 -11.021
    5    HG2  GLN  55           HG2      GLN  55  -7.256   1.370  -9.704
    6    HG3  GLN  55           HG3      GLN  55  -7.057   0.184 -10.987
    7   HE21  GLN  55          HE21      GLN  55  -5.452  -1.292 -10.506
    8   HE22  GLN  55          HE22      GLN  55  -4.057  -0.964  -9.601

  No H/Q in entry =           8
  In of MODEL   30
    1    H    THR  56           H        THR  56  -9.219   3.463 -11.739
    2    HA   THR  56           HA       THR  56 -10.824   1.600 -10.446
    3    HB   THR  56           HB       THR  56 -11.892   4.008 -11.940
    4    HG1  THR  56           HG1      THR  56 -10.023   4.423 -10.582
    5   HG23  THR  56          HG21      THR  56 -13.693   2.769 -11.045
    6   HG22  THR  56          HG22      THR  56 -13.377   4.005  -9.826
    7   HG21  THR  56          HG23      THR  56 -12.796   2.356  -9.585

  No H/Q in entry =           7
  In of MODEL   30
    1    H    LYS  57           H        LYS  57 -11.028   2.696 -13.827
    2    HA   LYS  57           HA       LYS  57 -13.214   1.043 -14.574
    3    HB2  LYS  57           HB2      LYS  57 -12.312   2.986 -15.889
    4    HB3  LYS  57           HB3      LYS  57 -10.894   2.020 -16.271
    5    HG2  LYS  57           HG2      LYS  57 -12.316   0.360 -17.404
    6    HG3  LYS  57           HG3      LYS  57 -13.745   1.311 -17.019
    7    HD2  LYS  57           HD2      LYS  57 -11.442   2.503 -18.567
    8    HD3  LYS  57           HD3      LYS  57 -12.725   1.608 -19.380
    9    HE2  LYS  57           HE2      LYS  57 -14.390   3.153 -18.233
   10    HE3  LYS  57           HE3      LYS  57 -13.022   4.136 -17.714
   11    HZ3  LYS  57           HZ1      LYS  57 -13.305   5.150 -19.662
   12    HZ2  LYS  57           HZ2      LYS  57 -14.229   3.882 -20.316
   13    HZ1  LYS  57           HZ3      LYS  57 -12.532   3.801 -20.338

  No H/Q in entry =          13
  In of MODEL   30
    1    H    LEU  58           H        LEU  58  -9.716   0.559 -14.537
    2    HA   LEU  58           HA       LEU  58  -9.770  -1.954 -15.833
    3    HB2  LEU  58           HB2      LEU  58  -7.706  -0.698 -14.032
    4    HB3  LEU  58           HB3      LEU  58  -7.473  -2.221 -14.892
    5    HG   LEU  58           HG       LEU  58  -8.195   0.398 -16.244
    6   HD11  LEU  58          HD11      LEU  58  -5.564  -0.880 -15.571
    7   HD13  LEU  58          HD12      LEU  58  -6.033   0.818 -15.515
    8   HD12  LEU  58          HD13      LEU  58  -5.714   0.046 -17.065
    9   HD22  LEU  58          HD21      LEU  58  -8.803  -1.151 -17.836
   10   HD21  LEU  58          HD22      LEU  58  -7.777  -2.416 -17.163
   11   HD23  LEU  58          HD23      LEU  58  -7.073  -1.150 -18.169

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  59           H        ILE  59 -10.560  -1.048 -12.575
    2    HA   ILE  59           HA       ILE  59 -10.245  -3.822 -11.636
    3    HB   ILE  59           HB       ILE  59  -9.760  -1.565 -10.234
    4   HG12  ILE  59          HG12      ILE  59 -11.155  -3.903  -8.912
    5   HG13  ILE  59          HG13      ILE  59  -9.514  -3.999  -9.501
    6   HG21  ILE  59          HG21      ILE  59 -12.280  -0.998 -10.467
    7   HG23  ILE  59          HG22      ILE  59 -11.567  -0.865  -8.877
    8   HG22  ILE  59          HG23      ILE  59 -12.542  -2.270  -9.298
    9   HD12  ILE  59          HD11      ILE  59 -10.533  -2.019  -7.475
   10   HD11  ILE  59          HD12      ILE  59  -8.883  -2.071  -8.082
   11   HD13  ILE  59          HD13      ILE  59  -9.513  -3.410  -7.120

  No H/Q in entry =          11
  In of MODEL   30
    1    H    GLU  60           H        GLU  60 -12.772  -1.467 -12.425
    2    HA   GLU  60           HA       GLU  60 -14.974  -2.953 -11.403
    3    HB2  GLU  60           HB2      GLU  60 -15.172  -0.583 -11.983
    4    HB3  GLU  60           HB3      GLU  60 -14.835  -0.946 -13.672
    5    HG2  GLU  60           HG2      GLU  60 -17.143  -2.270 -12.260
    6    HG3  GLU  60           HG3      GLU  60 -17.318  -0.671 -12.952

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLY  61           H        GLY  61 -13.317  -2.955 -14.527
    2    HA3  GLY  61           HA2      GLY  61 -15.068  -5.172 -15.414
    3    HA2  GLY  61           HA3      GLY  61 -14.213  -4.077 -16.493

  No H/Q in entry =           3
  In of MODEL   30
    1    H    ASP  62           H        ASP  62 -12.844  -5.551 -13.620
    2    HA   ASP  62           HA       ASP  62 -10.638  -6.599 -15.144
    3    HB2  ASP  62           HB2      ASP  62  -9.865  -7.368 -12.889
    4    HB3  ASP  62           HB3      ASP  62 -10.218  -5.646 -12.965

  No H/Q in entry =           4
  In of MODEL   30
    1    H    ALA  63           H        ALA  63 -13.590  -7.795 -15.198
    2    HA   ALA  63           HA       ALA  63 -13.607 -10.421 -14.244
    3    HB1  ALA  63           HB1      ALA  63 -14.685  -9.835 -16.986
    4    HB2  ALA  63           HB2      ALA  63 -15.380  -8.978 -15.612
    5    HB3  ALA  63           HB3      ALA  63 -15.429 -10.741 -15.669

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLY  64           H        GLY  64 -12.465  -9.199 -17.369
    2    HA3  GLY  64           HA2      GLY  64 -11.043 -10.057 -18.947
    3    HA2  GLY  64           HA3      GLY  64 -10.243 -10.878 -17.613

  No H/Q in entry =           3
  In of MODEL   30
    1    H    GLU  65           H        GLU  65 -10.003 -12.973 -18.134
    2    HA   GLU  65           HA       GLU  65 -11.541 -14.332 -20.039
    3    HB2  GLU  65           HB2      GLU  65  -9.795 -15.394 -17.820
    4    HB3  GLU  65           HB3      GLU  65 -10.499 -16.401 -19.085
    5    HG2  GLU  65           HG2      GLU  65  -9.358 -15.106 -20.808
    6    HG3  GLU  65           HG3      GLU  65  -8.724 -13.998 -19.591

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLY  66           H        GLY  66 -12.464 -16.561 -19.435
    2    HA3  GLY  66           HA2      GLY  66 -14.969 -16.195 -18.203
    3    HA2  GLY  66           HA3      GLY  66 -14.292 -17.720 -18.736

  No H/Q in entry =           3
  In of MODEL   30
    1    H    LYS  67           H        LYS  67 -11.996 -17.640 -17.033
    2    HA   LYS  67           HA       LYS  67 -13.120 -18.844 -14.719
    3    HB2  LYS  67           HB2      LYS  67 -10.280 -18.221 -15.510
    4    HB3  LYS  67           HB3      LYS  67 -10.720 -19.139 -14.064
    5    HG2  LYS  67           HG2      LYS  67 -11.968 -20.748 -15.459
    6    HG3  LYS  67           HG3      LYS  67 -11.530 -19.837 -16.903
    7    HD2  LYS  67           HD2      LYS  67  -9.145 -20.285 -16.473
    8    HD3  LYS  67           HD3      LYS  67  -9.576 -21.185 -15.016
    9    HE2  LYS  67           HE2      LYS  67 -10.883 -22.777 -16.374
   10    HE3  LYS  67           HE3      LYS  67 -10.467 -21.876 -17.834
   11    HZ3  LYS  67           HZ1      LYS  67  -8.995 -23.735 -17.600
   12    HZ2  LYS  67           HZ2      LYS  67  -8.582 -23.277 -16.017
   13    HZ1  LYS  67           HZ3      LYS  67  -8.112 -22.312 -17.334

  No H/Q in entry =          13
  In of MODEL   30
    1    H    MET  68           H        MET  68 -12.847 -18.391 -12.578
    2    HA   MET  68           HA       MET  68 -13.575 -15.939 -11.630
    3    HB2  MET  68           HB2      MET  68 -11.986 -18.096 -10.242
    4    HB3  MET  68           HB3      MET  68 -12.748 -16.738  -9.415
    5    HG2  MET  68           HG2      MET  68 -14.220 -18.726 -11.168
    6    HG3  MET  68           HG3      MET  68 -14.173 -18.784  -9.405
    7    HE3  MET  68           HE1      MET  68 -16.159 -16.064  -8.066
    8    HE2  MET  68           HE2      MET  68 -14.510 -15.592  -8.471
    9    HE1  MET  68           HE3      MET  68 -14.836 -17.229  -7.905

  No H/Q in entry =           9
  In of MODEL   30
    1    H    LYS  69           H        LYS  69 -10.487 -16.558 -12.899
    2    HA   LYS  69           HA       LYS  69  -8.967 -14.901 -11.139
    3    HB2  LYS  69           HB2      LYS  69  -8.376 -16.073 -13.855
    4    HB3  LYS  69           HB3      LYS  69  -7.201 -15.125 -12.940
    5    HG2  LYS  69           HG2      LYS  69  -7.409 -16.687 -11.040
    6    HG3  LYS  69           HG3      LYS  69  -8.590 -17.633 -11.946
    7    HD2  LYS  69           HD2      LYS  69  -6.878 -18.060 -13.694
    8    HD3  LYS  69           HD3      LYS  69  -5.696 -17.175 -12.727
    9    HE2  LYS  69           HE2      LYS  69  -7.219 -19.603 -11.739
   10    HE3  LYS  69           HE3      LYS  69  -5.588 -19.664 -12.403
   11    HZ2  LYS  69           HZ1      LYS  69  -6.493 -18.230  -9.970
   12    HZ1  LYS  69           HZ2      LYS  69  -4.963 -18.004 -10.672
   13    HZ3  LYS  69           HZ3      LYS  69  -5.403 -19.526 -10.059

  No H/Q in entry =          13
  In of MODEL   30
    1    H    VAL  70           H        VAL  70  -7.660 -13.003 -11.798
    2    HA   VAL  70           HA       VAL  70  -9.149 -11.171 -13.596
    3    HB   VAL  70           HB       VAL  70  -8.536  -9.354 -12.036
    4   HG11  VAL  70          HG11      VAL  70 -10.667 -10.830 -11.860
    5   HG13  VAL  70          HG12      VAL  70 -10.258  -9.805 -10.483
    6   HG12  VAL  70          HG13      VAL  70  -9.885 -11.528 -10.441
    7   HG22  VAL  70          HG21      VAL  70  -6.637  -9.929 -10.831
    8   HG21  VAL  70          HG22      VAL  70  -7.121 -11.618 -10.696
    9   HG23  VAL  70          HG23      VAL  70  -7.856 -10.406  -9.648

  No H/Q in entry =           9
  In of MODEL   30
    1    H    SER  71           H        SER  71  -7.741  -9.278 -14.240
    2    HA   SER  71           HA       SER  71  -5.444 -10.152 -15.628
    3    HB2  SER  71           HB2      SER  71  -6.851  -8.121 -16.178
    4    HB3  SER  71           HB3      SER  71  -6.078  -7.306 -14.820
    5    HG   SER  71           HG       SER  71  -4.888  -8.357 -17.169

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU  72           H        LEU  72  -3.474 -10.533 -14.932
    2    HA   LEU  72           HA       LEU  72  -2.737 -10.336 -12.224
    3    HB2  LEU  72           HB2      LEU  72  -1.097 -10.779 -14.714
    4    HB3  LEU  72           HB3      LEU  72  -0.436 -10.876 -13.085
    5    HG   LEU  72           HG       LEU  72  -2.816 -12.520 -14.008
    6   HD12  LEU  72          HD11      LEU  72  -1.151 -14.401 -14.113
    7   HD11  LEU  72          HD12      LEU  72   0.135 -13.210 -13.923
    8   HD13  LEU  72          HD13      LEU  72  -0.900 -13.167 -15.350
    9   HD21  LEU  72          HD21      LEU  72  -1.095 -12.414 -11.541
   10   HD23  LEU  72          HD22      LEU  72  -1.806 -13.950 -12.010
   11   HD22  LEU  72          HD23      LEU  72  -2.844 -12.571 -11.660

  No H/Q in entry =          11
  In of MODEL   30
    1    H    VAL  73           H        VAL  73  -2.004  -8.325 -15.004
    2    HA   VAL  73           HA       VAL  73  -0.050  -6.659 -13.907
    3    HB   VAL  73           HB       VAL  73  -0.388  -5.268 -15.772
    4   HG12  VAL  73          HG11      VAL  73  -1.441  -7.958 -16.676
    5   HG11  VAL  73          HG12      VAL  73   0.245  -7.682 -16.241
    6   HG13  VAL  73          HG13      VAL  73  -0.466  -6.817 -17.602
    7   HG21  VAL  73          HG21      VAL  73  -3.212  -6.345 -15.722
    8   HG23  VAL  73          HG22      VAL  73  -2.556  -5.497 -17.120
    9   HG22  VAL  73          HG23      VAL  73  -2.688  -4.668 -15.569

  No H/Q in entry =           9
  In of MODEL   30
    1    H    LEU  74           H        LEU  74  -3.446  -6.722 -13.332
    2    HA   LEU  74           HA       LEU  74  -4.019  -4.058 -12.711
    3    HB2  LEU  74           HB2      LEU  74  -5.774  -5.699 -12.880
    4    HB3  LEU  74           HB3      LEU  74  -5.092  -6.632 -11.551
    5    HG   LEU  74           HG       LEU  74  -5.522  -4.755 -10.005
    6   HD13  LEU  74          HD11      LEU  74  -5.370  -2.816 -11.361
    7   HD12  LEU  74          HD12      LEU  74  -7.085  -2.938 -10.970
    8   HD11  LEU  74          HD13      LEU  74  -6.502  -3.459 -12.551
    9   HD22  LEU  74          HD21      LEU  74  -7.735  -5.294  -9.747
   10   HD21  LEU  74          HD22      LEU  74  -7.248  -6.541 -10.875
   11   HD23  LEU  74          HD23      LEU  74  -8.086  -5.126 -11.464

  No H/Q in entry =          11
  In of MODEL   30
    1    H    VAL  75           H        VAL  75  -3.008  -6.666 -10.560
    2    HA   VAL  75           HA       VAL  75  -2.773  -5.123  -8.214
    3    HB   VAL  75           HB       VAL  75  -1.312  -7.636  -9.013
    4   HG12  VAL  75          HG11      VAL  75  -0.883  -7.800  -6.527
    5   HG11  VAL  75          HG12      VAL  75  -1.506  -6.166  -6.360
    6   HG13  VAL  75          HG13      VAL  75  -0.040  -6.452  -7.283
    7   HG23  VAL  75          HG21      VAL  75  -3.602  -7.220  -7.073
    8   HG22  VAL  75          HG22      VAL  75  -3.011  -8.746  -7.732
    9   HG21  VAL  75          HG23      VAL  75  -3.869  -7.609  -8.773

  No H/Q in entry =           9
  In of MODEL   30
    1    H    GLU  76           H        GLU  76  -0.390  -5.916 -10.764
    2    HA   GLU  76           HA       GLU  76   1.823  -4.606  -9.616
    3    HB2  GLU  76           HB2      GLU  76   2.009  -6.077 -11.597
    4    HB3  GLU  76           HB3      GLU  76   1.089  -4.923 -12.549
    5    HG2  GLU  76           HG2      GLU  76   3.417  -4.590 -13.074
    6    HG3  GLU  76           HG3      GLU  76   2.915  -3.215 -12.110

  No H/Q in entry =           6
  In of MODEL   30
    1    H    ALA  77           H        ALA  77  -0.701  -3.360 -11.789
    2    HA   ALA  77           HA       ALA  77   0.331  -0.730 -11.965
    3    HB2  ALA  77           HB1      ALA  77  -2.129  -0.178 -12.521
    4    HB3  ALA  77           HB2      ALA  77  -2.415  -1.912 -12.361
    5    HB1  ALA  77           HB3      ALA  77  -1.289  -1.313 -13.579

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLN  78           H        GLN  78  -1.951  -2.254  -9.745
    2    HA   GLN  78           HA       GLN  78  -2.714   0.074  -8.335
    3    HB2  GLN  78           HB2      GLN  78  -3.857  -2.170  -8.250
    4    HB3  GLN  78           HB3      GLN  78  -2.525  -2.750  -7.252
    5    HG2  GLN  78           HG2      GLN  78  -3.012  -1.006  -5.586
    6    HG3  GLN  78           HG3      GLN  78  -4.344  -0.420  -6.582
    7   HE21  GLN  78          HE21      GLN  78  -4.815  -1.389  -3.926
    8   HE22  GLN  78          HE22      GLN  78  -5.700  -2.834  -4.038

  No H/Q in entry =           8
  In of MODEL   30
    1    H    LEU  79           H        LEU  79  -0.068  -2.223  -7.903
    2    HA   LEU  79           HA       LEU  79   0.934  -1.347  -5.449
    3    HB2  LEU  79           HB2      LEU  79   1.768  -3.366  -6.525
    4    HB3  LEU  79           HB3      LEU  79   2.421  -2.422  -7.860
    5    HG   LEU  79           HG       LEU  79   4.002  -1.309  -6.362
    6   HD13  LEU  79          HD11      LEU  79   3.011  -1.053  -4.289
    7   HD12  LEU  79          HD12      LEU  79   4.071  -2.420  -3.953
    8   HD11  LEU  79          HD13      LEU  79   2.360  -2.693  -4.275
    9   HD23  LEU  79          HD21      LEU  79   5.184  -3.477  -5.469
   10   HD22  LEU  79          HD22      LEU  79   4.975  -3.272  -7.205
   11   HD21  LEU  79          HD23      LEU  79   3.886  -4.327  -6.310

  No H/Q in entry =          11
  In of MODEL   30
    1    H    HIS  80           H        HIS  80   1.804  -0.236  -8.724
    2    HA   HIS  80           HA       HIS  80   3.645   1.722  -7.807
    3    HB2  HIS  80           HB2      HIS  80   2.333   1.052 -10.385
    4    HB3  HIS  80           HB3      HIS  80   2.953   2.695 -10.213
    5    HD1  HIS  80           HD1      HIS  80   5.356   2.962 -10.747
    6    HD2  HIS  80           HD2      HIS  80   4.486  -0.939  -9.559
    7    HE1  HIS  80           HE1      HIS  80   7.526   1.653 -10.926
    8    HE2  HIS  80           HE2      HIS  80   7.007  -0.728 -10.206

  No H/Q in entry =           8
  In of MODEL   30
    1    H    LEU  81           H        LEU  81   0.239   1.934  -8.769
    2    HA   LEU  81           HA       LEU  81   0.006   4.729  -8.432
    3    HB2  LEU  81           HB2      LEU  81  -2.040   2.512  -8.347
    4    HB3  LEU  81           HB3      LEU  81  -2.468   4.221  -8.249
    5    HG   LEU  81           HG       LEU  81  -0.802   3.053 -10.496
    6   HD12  LEU  81          HD11      LEU  81  -3.036   3.406 -11.784
    7   HD11  LEU  81          HD12      LEU  81  -3.785   3.345 -10.189
    8   HD13  LEU  81          HD13      LEU  81  -2.864   1.966 -10.783
    9   HD23  LEU  81          HD21      LEU  81  -1.874   5.214 -11.583
   10   HD22  LEU  81          HD22      LEU  81  -0.450   5.363 -10.557
   11   HD21  LEU  81          HD23      LEU  81  -2.047   5.732  -9.908

  No H/Q in entry =          11
  In of MODEL   30
    1    H    MET  82           H        MET  82  -0.680   2.047  -6.185
    2    HA   MET  82           HA       MET  82  -1.700   3.643  -4.090
    3    HB2  MET  82           HB2      MET  82  -0.363   0.937  -4.141
    4    HB3  MET  82           HB3      MET  82  -0.925   1.667  -2.639
    5    HG2  MET  82           HG2      MET  82  -2.676   1.203  -5.073
    6    HG3  MET  82           HG3      MET  82  -2.606   0.125  -3.680
    7    HE3  MET  82           HE1      MET  82  -4.292   1.792  -0.853
    8    HE2  MET  82           HE2      MET  82  -2.559   2.046  -1.046
    9    HE1  MET  82           HE3      MET  82  -3.271   0.499  -1.500

  No H/Q in entry =           9
  In of MODEL   30
    1    H    THR  83           H        THR  83   1.582   2.514  -4.797
    2    HA   THR  83           HA       THR  83   2.826   3.596  -2.500
    3    HB   THR  83           HB       THR  83   4.913   3.516  -3.984
    4    HG1  THR  83           HG1      THR  83   4.656   2.997  -6.008
    5   HG22  THR  83          HG21      THR  83   4.431   0.865  -4.320
    6   HG21  THR  83          HG22      THR  83   3.152   1.259  -3.173
    7   HG23  THR  83          HG23      THR  83   4.838   1.579  -2.760

  No H/Q in entry =           7
  In of MODEL   30
    1    H    SER  84           H        SER  84   2.457   4.888  -5.796
    2    HA   SER  84           HA       SER  84   3.831   7.309  -5.342
    3    HB2  SER  84           HB2      SER  84   1.740   6.509  -7.353
    4    HB3  SER  84           HB3      SER  84   2.441   8.127  -7.327
    5    HG   SER  84           HG       SER  84   3.778   5.634  -7.631

  No H/Q in entry =           5
  In of MODEL   30
    1    H    MET  85           H        MET  85   0.328   6.599  -5.155
    2    HA   MET  85           HA       MET  85  -0.495   9.220  -4.544
    3    HB2  MET  85           HB2      MET  85  -2.046   7.435  -5.210
    4    HB3  MET  85           HB3      MET  85  -1.760   6.619  -3.674
    5    HG2  MET  85           HG2      MET  85  -2.606   8.601  -2.463
    6    HG3  MET  85           HG3      MET  85  -2.894   9.413  -4.001
    7    HE1  MET  85           HE1      MET  85  -4.399   8.467  -5.883
    8    HE3  MET  85           HE2      MET  85  -5.214   9.603  -4.811
    9    HE2  MET  85           HE3      MET  85  -6.058   8.157  -5.356

  No H/Q in entry =           9
  In of MODEL   30
    1    H    LEU  86           H        LEU  86   0.398   6.540  -2.411
    2    HA   LEU  86           HA       LEU  86  -0.105   7.845   0.037
    3    HB2  LEU  86           HB2      LEU  86   0.322   5.368  -0.365
    4    HB3  LEU  86           HB3      LEU  86   2.035   5.774  -0.467
    5    HG   LEU  86           HG       LEU  86   1.738   6.934   1.805
    6   HD11  LEU  86          HD11      LEU  86  -0.970   6.208   1.345
    7   HD13  LEU  86          HD12      LEU  86  -0.286   6.942   2.794
    8   HD12  LEU  86          HD13      LEU  86  -0.403   5.187   2.671
    9   HD23  LEU  86          HD21      LEU  86   1.267   3.948   1.922
   10   HD22  LEU  86          HD22      LEU  86   2.288   4.940   2.960
   11   HD21  LEU  86          HD23      LEU  86   2.777   4.612   1.298

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ALA  87           H        ALA  87   2.862   7.512  -1.868
    2    HA   ALA  87           HA       ALA  87   4.597   8.892  -0.148
    3    HB3  ALA  87           HB1      ALA  87   4.664   7.885  -2.858
    4    HB2  ALA  87           HB2      ALA  87   6.008   8.193  -1.763
    5    HB1  ALA  87           HB3      ALA  87   5.408   9.485  -2.801

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ARG  88           H        ARG  88   2.654  10.064  -2.856
    2    HA   ARG  88           HA       ARG  88   3.469  12.741  -2.736
    3    HB2  ARG  88           HB2      ARG  88   2.188  11.613  -4.590
    4    HB3  ARG  88           HB3      ARG  88   0.739  11.776  -3.599
    5    HG2  ARG  88           HG2      ARG  88   1.798  14.340  -3.515
    6    HG3  ARG  88           HG3      ARG  88   2.206  13.824  -5.148
    7    HD2  ARG  88           HD2      ARG  88   0.063  13.938  -5.835
    8    HD3  ARG  88           HD3      ARG  88  -0.530  13.091  -4.406
    9    HE   ARG  88           HE       ARG  88  -0.678  15.872  -4.816
   10   HH21  ARG  88          HH11      ARG  88  -1.176  17.205  -3.072
   11   HH22  ARG  88          HH12      ARG  88  -0.880  16.659  -1.458
   12   HH11  ARG  88          HH21      ARG  88   0.314  13.588  -2.453
   13   HH12  ARG  88          HH22      ARG  88  -0.054  14.606  -1.107

  No H/Q in entry =          13
  In of MODEL   30
    1    H    GLU  89           H        GLU  89   0.748  11.105  -1.087
    2    HA   GLU  89           HA       GLU  89  -0.316  13.431   0.130
    3    HB2  GLU  89           HB2      GLU  89  -1.470  11.210   0.043
    4    HB3  GLU  89           HB3      GLU  89  -0.349  10.634   1.277
    5    HG2  GLU  89           HG2      GLU  89  -1.134  12.341   2.845
    6    HG3  GLU  89           HG3      GLU  89  -2.182  13.032   1.608

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LEU  90           H        LEU  90   2.104  11.097   1.285
    2    HA   LEU  90           HA       LEU  90   2.493  12.328   3.816
    3    HB2  LEU  90           HB2      LEU  90   4.228  10.530   2.125
    4    HB3  LEU  90           HB3      LEU  90   4.664  11.035   3.763
    5    HG   LEU  90           HG       LEU  90   2.004   9.735   3.112
    6   HD12  LEU  90          HD11      LEU  90   3.116   7.667   4.109
    7   HD11  LEU  90          HD12      LEU  90   4.651   8.499   3.861
    8   HD13  LEU  90          HD13      LEU  90   3.625   8.112   2.479
    9   HD22  LEU  90          HD21      LEU  90   1.766  10.656   5.238
   10   HD21  LEU  90          HD22      LEU  90   3.483  10.520   5.611
   11   HD23  LEU  90          HD23      LEU  90   2.454   9.089   5.660

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  91           H        ILE  91   4.086  12.693   0.682
    2    HA   ILE  91           HA       ILE  91   6.097  14.488   1.516
    3    HB   ILE  91           HB       ILE  91   4.764  14.027  -1.158
    4   HG12  ILE  91          HG12      ILE  91   7.593  13.490  -0.200
    5   HG13  ILE  91          HG13      ILE  91   6.292  12.314  -0.034
    6   HG22  ILE  91          HG21      ILE  91   7.006  15.339  -1.855
    7   HG21  ILE  91          HG22      ILE  91   6.717  16.140  -0.310
    8   HG23  ILE  91          HG23      ILE  91   5.489  16.193  -1.572
    9   HD13  ILE  91          HD11      ILE  91   6.101  12.000  -2.341
   10   HD12  ILE  91          HD12      ILE  91   7.841  12.213  -2.136
   11   HD11  ILE  91          HD13      ILE  91   6.850  13.554  -2.713

  No H/Q in entry =          11
  In of MODEL   30
    1    H    THR  92           H        THR  92   2.738  14.981   0.527
    2    HA   THR  92           HA       THR  92   2.760  17.804   0.475
    3    HB   THR  92           HB       THR  92   0.562  15.845   1.180
    4    HG1  THR  92           HG1      THR  92   0.853  15.667  -0.907
    5   HG22  THR  92          HG21      THR  92  -0.805  18.033   0.471
    6   HG21  THR  92          HG22      THR  92   0.605  18.832   1.163
    7   HG23  THR  92          HG23      THR  92  -0.350  17.724   2.146

  No H/Q in entry =           7
  In of MODEL   30
    1    H    GLU  93           H        GLU  93   2.186  15.506   3.125
    2    HA   GLU  93           HA       GLU  93   1.697  17.413   5.152
    3    HB2  GLU  93           HB2      GLU  93   2.965  14.665   5.373
    4    HB3  GLU  93           HB3      GLU  93   2.297  15.600   6.712
    5    HG2  GLU  93           HG2      GLU  93   0.659  14.857   4.280
    6    HG3  GLU  93           HG3      GLU  93   0.750  13.829   5.705

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LEU  94           H        LEU  94   4.672  15.883   3.982
    2    HA   LEU  94           HA       LEU  94   6.452  16.994   5.864
    3    HB2  LEU  94           HB2      LEU  94   6.822  16.028   3.028
    4    HB3  LEU  94           HB3      LEU  94   8.168  16.660   3.973
    5    HG   LEU  94           HG       LEU  94   6.396  14.492   5.111
    6   HD11  LEU  94          HD11      LEU  94   8.476  14.235   2.968
    7   HD13  LEU  94          HD12      LEU  94   7.015  13.286   3.234
    8   HD12  LEU  94          HD13      LEU  94   8.441  13.006   4.233
    9   HD23  LEU  94          HD21      LEU  94   8.582  13.914   6.250
   10   HD22  LEU  94          HD22      LEU  94   7.945  15.502   6.674
   11   HD21  LEU  94          HD23      LEU  94   9.275  15.362   5.525

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  95           H        ILE  95   5.317  18.194   2.723
    2    HA   ILE  95           HA       ILE  95   6.929  20.524   2.662
    3    HB   ILE  95           HB       ILE  95   4.267  19.890   1.369
    4   HG12  ILE  95          HG12      ILE  95   7.055  20.182   0.218
    5   HG13  ILE  95          HG13      ILE  95   6.382  18.639   0.732
    6   HG21  ILE  95          HG21      ILE  95   6.058  22.328   1.146
    7   HG23  ILE  95          HG22      ILE  95   4.334  22.289   1.511
    8   HG22  ILE  95          HG23      ILE  95   4.901  21.883  -0.109
    9   HD13  ILE  95          HD11      ILE  95   4.812  18.595  -0.989
   10   HD12  ILE  95          HD12      ILE  95   6.171  19.392  -1.782
   11   HD11  ILE  95          HD13      ILE  95   4.818  20.349  -1.180

  No H/Q in entry =          11
  In of MODEL   30
    1    H    GLU  96           H        GLU  96   3.676  19.925   3.972
    2    HA   GLU  96           HA       GLU  96   3.106  22.580   4.734
    3    HB2  GLU  96           HB2      GLU  96   1.401  20.827   4.750
    4    HB3  GLU  96           HB3      GLU  96   2.254  19.981   6.038
    5    HG2  GLU  96           HG2      GLU  96   1.265  21.277   7.617
    6    HG3  GLU  96           HG3      GLU  96   1.822  22.744   6.821

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LEU  97           H        LEU  97   4.912  19.993   6.343
    2    HA   LEU  97           HA       LEU  97   5.306  21.328   8.815
    3    HB2  LEU  97           HB2      LEU  97   6.797  19.136   7.387
    4    HB3  LEU  97           HB3      LEU  97   7.407  19.807   8.898
    5    HG   LEU  97           HG       LEU  97   4.577  18.764   8.599
    6   HD12  LEU  97          HD11      LEU  97   5.488  16.732   9.801
    7   HD11  LEU  97          HD12      LEU  97   7.108  17.335   9.450
    8   HD13  LEU  97          HD13      LEU  97   6.023  16.900   8.129
    9   HD23  LEU  97          HD21      LEU  97   5.038  18.454  11.160
   10   HD22  LEU  97          HD22      LEU  97   4.683  20.074  10.562
   11   HD21  LEU  97          HD23      LEU  97   6.349  19.604  10.897

  No H/Q in entry =          11
  In of MODEL   30
    1    H    HIS  98           H        HIS  98   7.161  21.319   5.780
    2    HA   HIS  98           HA       HIS  98   9.347  22.858   6.673
    3    HB2  HIS  98           HB2      HIS  98   8.036  22.634   3.953
    4    HB3  HIS  98           HB3      HIS  98   9.494  23.585   4.238
    5    HD1  HIS  98           HD1      HIS  98   8.219  20.037   4.254
    6    HD2  HIS  98           HD2      HIS  98  11.840  22.067   4.667
    7    HE1  HIS  98           HE1      HIS  98  10.042  18.275   4.183
    8    HE2  HIS  98           HE2      HIS  98  12.251  19.490   4.434

  No H/Q in entry =           8
  In of MODEL   30
    1    H    GLU  99           H        GLU  99   6.136  23.754   5.516
    2    HA   GLU  99           HA       GLU  99   6.566  26.562   5.464
    3    HB2  GLU  99           HB2      GLU  99   4.660  25.430   4.340
    4    HB3  GLU  99           HB3      GLU  99   3.965  25.077   5.922
    5    HG2  GLU  99           HG2      GLU  99   3.831  27.470   6.430
    6    HG3  GLU  99           HG3      GLU  99   4.607  27.860   4.898

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LYS 100           H        LYS 100   5.407  24.340   7.985
    2    HA   LYS 100           HA       LYS 100   4.868  26.399   9.888
    3    HB2  LYS 100           HB2      LYS 100   5.391  23.437  10.223
    4    HB3  LYS 100           HB3      LYS 100   4.970  24.513  11.560
    5    HG2  LYS 100           HG2      LYS 100   2.910  25.192  10.325
    6    HG3  LYS 100           HG3      LYS 100   3.309  24.019   9.067
    7    HD2  LYS 100           HD2      LYS 100   3.207  22.196  10.723
    8    HD3  LYS 100           HD3      LYS 100   2.825  23.362  11.992
    9    HE2  LYS 100           HE2      LYS 100   0.777  24.025  10.742
   10    HE3  LYS 100           HE3      LYS 100   1.148  22.801   9.520
   11    HZ1  LYS 100           HZ1      LYS 100   0.885  22.131  12.401
   12    HZ3  LYS 100           HZ2      LYS 100   0.843  21.081  11.063
   13    HZ2  LYS 100           HZ3      LYS 100  -0.451  22.144  11.353

  No H/Q in entry =          13
  In of MODEL   30
    1    H    LEU 101           H        LEU 101   7.754  24.552   9.034
    2    HA   LEU 101           HA       LEU 101   9.379  25.356  11.232
    3    HB2  LEU 101           HB2      LEU 101   9.941  24.367   8.448
    4    HB3  LEU 101           HB3      LEU 101  11.260  25.005   9.425
    5    HG   LEU 101           HG       LEU 101   9.394  22.880  10.492
    6   HD12  LEU 101          HD11      LEU 101  11.416  21.349   9.869
    7   HD11  LEU 101          HD12      LEU 101  11.801  22.608   8.698
    8   HD13  LEU 101          HD13      LEU 101  10.256  21.764   8.609
    9   HD21  LEU 101          HD21      LEU 101  12.142  23.935  11.208
   10   HD23  LEU 101          HD22      LEU 101  11.572  22.371  11.786
   11   HD22  LEU 101          HD23      LEU 101  10.709  23.843  12.233

  No H/Q in entry =          11
  In of MODEL   30
    1    H    LYS 102           H        LYS 102   7.820  27.255   9.105
    2    HA   LYS 102           HA       LYS 102   7.939  29.547   8.819
    3    HB2  LYS 102           HB2      LYS 102   9.511  29.396  10.909
    4    HB3  LYS 102           HB3      LYS 102  10.808  29.570   9.743
    5    HG2  LYS 102           HG2      LYS 102   8.744  31.560  10.622
    6    HG3  LYS 102           HG3      LYS 102  10.460  31.788  10.362
    7    HD2  LYS 102           HD2      LYS 102   8.490  31.408   8.071
    8    HD3  LYS 102           HD3      LYS 102   8.906  32.979   8.742
    9    HE2  LYS 102           HE2      LYS 102  10.245  31.775   6.658
   10    HE3  LYS 102           HE3      LYS 102  10.892  33.066   7.670
   11    HZ2  LYS 102           HZ1      LYS 102  12.375  31.134   7.481
   12    HZ1  LYS 102           HZ2      LYS 102  11.198  30.171   8.227
   13    HZ3  LYS 102           HZ3      LYS 102  11.919  31.443   9.086

  No H/Q in entry =          13
  In of MODEL   30
    1    H    ALA 103           H        ALA 103  11.167  28.149   8.234
    2    HA   ALA 103           HA       ALA 103  12.146  29.513   6.157
    3    HB2  ALA 103           HB1      ALA 103  12.984  27.285   5.218
    4    HB1  ALA 103           HB2      ALA 103  12.081  26.524   6.527
    5    HB3  ALA 103           HB3      ALA 103  13.394  27.643   6.896

  No H/Q in entry =           5
  In of MODEL   30
    1    H1   LYS   3           H1       LYS   3 -31.541   5.302 -20.087
    2    H2   LYS   3           H3       LYS   3 -30.514   5.061 -21.418
    3    H3   LYS   3           H2       LYS   3 -31.856   4.047 -21.186
    4    HA   LYS   3           HA       LYS   3 -30.800   2.730 -19.752
    5    HB2  LYS   3           HB2      LYS   3 -28.580   4.261 -21.057
    6    HB3  LYS   3           HB3      LYS   3 -28.208   3.084 -19.798
    7    HG2  LYS   3           HG2      LYS   3 -29.512   1.407 -21.159
    8    HG3  LYS   3           HG3      LYS   3 -29.513   2.597 -22.459
    9    HD2  LYS   3           HD2      LYS   3 -27.029   2.629 -22.364
   10    HD3  LYS   3           HD3      LYS   3 -27.094   1.335 -21.167
   11    HE2  LYS   3           HE2      LYS   3 -28.491   0.060 -22.900
   12    HE3  LYS   3           HE3      LYS   3 -27.919   1.262 -24.055
   13    HZ3  LYS   3           HZ1      LYS   3 -26.048   0.139 -24.282
   14    HZ2  LYS   3           HZ2      LYS   3 -26.629  -1.055 -23.223
   15    HZ1  LYS   3           HZ3      LYS   3 -25.724   0.248 -22.619

  No H/Q in entry =          15
  In of MODEL   30
    1    H    LYS   4           H        LYS   4 -30.882   2.601 -17.692
    2    HA   LYS   4           HA       LYS   4 -30.313   4.940 -16.050
    3    HB2  LYS   4           HB2      LYS   4 -31.371   2.188 -15.346
    4    HB3  LYS   4           HB3      LYS   4 -31.246   3.546 -14.228
    5    HG2  LYS   4           HG2      LYS   4 -33.004   3.362 -16.681
    6    HG3  LYS   4           HG3      LYS   4 -33.527   3.397 -14.998
    7    HD2  LYS   4           HD2      LYS   4 -32.963   5.658 -14.739
    8    HD3  LYS   4           HD3      LYS   4 -31.897   5.647 -16.144
    9    HE2  LYS   4           HE2      LYS   4 -33.889   6.906 -16.652
   10    HE3  LYS   4           HE3      LYS   4 -33.868   5.423 -17.608
   11    HZ3  LYS   4           HZ1      LYS   4 -35.416   4.435 -16.080
   12    HZ2  LYS   4           HZ2      LYS   4 -36.045   5.892 -16.688
   13    HZ1  LYS   4           HZ3      LYS   4 -35.411   5.831 -15.113

  No H/Q in entry =          13
  In of MODEL   30
    1    H    HIS   5           H        HIS   5 -28.880   5.120 -14.434
    2    HA   HIS   5           HA       HIS   5 -26.493   3.420 -14.708
    3    HB2  HIS   5           HB2      HIS   5 -26.922   6.165 -13.531
    4    HB3  HIS   5           HB3      HIS   5 -25.391   5.295 -13.480
    5    HD1  HIS   5           HD1      HIS   5 -23.961   6.562 -15.055
    6    HD2  HIS   5           HD2      HIS   5 -27.694   5.718 -16.669
    7    HE1  HIS   5           HE1      HIS   5 -23.783   7.131 -17.508
    8    HE2  HIS   5           HE2      HIS   5 -26.058   6.604 -18.460

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ILE   6           H        ILE   6 -26.200   1.872 -13.374
    2    HA   ILE   6           HA       ILE   6 -27.239   2.108 -10.630
    3    HB   ILE   6           HB       ILE   6 -26.251  -0.321 -12.130
    4   HG12  ILE   6          HG12      ILE   6 -29.057   0.469 -11.335
    5   HG13  ILE   6          HG13      ILE   6 -28.396   0.653 -12.960
    6   HG23  ILE   6          HG21      ILE   6 -26.588  -1.577 -10.265
    7   HG22  ILE   6          HG22      ILE   6 -27.819  -0.491  -9.617
    8   HG21  ILE   6          HG23      ILE   6 -26.113  -0.060  -9.500
    9   HD13  ILE   6          HD11      ILE   6 -28.729  -1.492 -13.448
   10   HD12  ILE   6          HD12      ILE   6 -29.769  -1.520 -12.024
   11   HD11  ILE   6          HD13      ILE   6 -28.086  -2.034 -11.897

  No H/Q in entry =          11
  In of MODEL   30
    1    H    TYR   7           H        TYR   7 -25.540   2.855  -9.318
    2    HA   TYR   7           HA       TYR   7 -22.769   2.043  -9.942
    3    HB2  TYR   7           HB2      TYR   7 -23.891   4.433  -8.500
    4    HB3  TYR   7           HB3      TYR   7 -22.181   4.010  -8.504
    5    HD1  TYR   7           HD1      TYR   7 -23.112   2.987 -11.604
    6    HD2  TYR   7           HD2      TYR   7 -22.678   6.610  -9.398
    7    HE1  TYR   7           HE1      TYR   7 -22.710   4.221 -13.698
    8    HE2  TYR   7           HE2      TYR   7 -22.319   7.847 -11.486
    9    HH   TYR   7           HH       TYR   7 -22.493   7.730 -13.720

  No H/Q in entry =           9
  In of MODEL   30
    1    H    LEU   8           H        LEU   8 -21.755   0.757  -8.584
    2    HA   LEU   8           HA       LEU   8 -22.905   0.223  -5.917
    3    HB2  LEU   8           HB2      LEU   8 -21.082  -1.359  -7.705
    4    HB3  LEU   8           HB3      LEU   8 -21.277  -1.737  -5.994
    5    HG   LEU   8           HG       LEU   8 -23.736  -2.048  -6.458
    6   HD13  LEU   8          HD11      LEU   8 -23.895  -0.858  -8.580
    7   HD12  LEU   8          HD12      LEU   8 -24.329  -2.551  -8.815
    8   HD11  LEU   8          HD13      LEU   8 -22.741  -1.970  -9.316
    9   HD23  LEU   8          HD21      LEU   8 -22.322  -4.030  -8.110
   10   HD22  LEU   8          HD22      LEU   8 -23.423  -4.246  -6.750
   11   HD21  LEU   8          HD23      LEU   8 -21.743  -3.798  -6.461

  No H/Q in entry =          11
  In of MODEL   30
    1    H    PHE   9           H        PHE   9 -21.686   0.696  -4.109
    2    HA   PHE   9           HA       PHE   9 -18.941   1.765  -4.574
    3    HB2  PHE   9           HB2      PHE   9 -21.036   2.755  -2.643
    4    HB3  PHE   9           HB3      PHE   9 -19.355   3.268  -2.628
    5    HD1  PHE   9           HD1      PHE   9 -18.437   4.648  -4.408
    6    HD2  PHE   9           HD2      PHE   9 -22.549   3.425  -4.463
    7    HE1  PHE   9           HE1      PHE   9 -18.905   6.294  -6.197
    8    HE2  PHE   9           HE2      PHE   9 -23.018   5.083  -6.247
    9    HZ   PHE   9           HZ       PHE   9 -21.193   6.515  -7.120

  No H/Q in entry =           9
  In of MODEL   30
    1    H    SER  10           H        SER  10 -17.322   0.920  -3.401
    2    HA   SER  10           HA       SER  10 -17.564   0.029  -0.712
    3    HB2  SER  10           HB2      SER  10 -18.652  -1.909  -1.780
    4    HB3  SER  10           HB3      SER  10 -17.255  -2.107  -2.825
    5    HG   SER  10           HG       SER  10 -16.077  -2.781  -1.168

  No H/Q in entry =           5
  In of MODEL   30
    1    H    SER  11           H        SER  11 -15.566   0.178   0.197
    2    HA   SER  11           HA       SER  11 -13.392   1.164  -1.287
    3    HB2  SER  11           HB2      SER  11 -13.994   1.136   1.319
    4    HB3  SER  11           HB3      SER  11 -12.820  -0.182   1.284
    5    HG   SER  11           HG       SER  11 -12.247   2.311   1.394

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA  12           H        ALA  12 -14.415  -1.539  -2.158
    2    HA   ALA  12           HA       ALA  12 -11.783  -2.689  -2.614
    3    HB1  ALA  12           HB1      ALA  12 -13.887  -4.055  -0.981
    4    HB2  ALA  12           HB2      ALA  12 -12.138  -4.024  -0.756
    5    HB3  ALA  12           HB3      ALA  12 -12.844  -5.020  -2.028

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLY  13           H        GLY  13 -12.654  -1.669  -4.654
    2    HA3  GLY  13           HA2      GLY  13 -14.803  -2.547  -6.153
    3    HA2  GLY  13           HA3      GLY  13 -13.277  -1.997  -6.858

  No H/Q in entry =           3
  In of MODEL   30
    1    H    MET  14           H        MET  14 -11.754  -4.255  -5.640
    2    HA   MET  14           HA       MET  14 -11.888  -6.048  -7.795
    3    HB2  MET  14           HB2      MET  14  -9.899  -5.942  -6.361
    4    HB3  MET  14           HB3      MET  14 -10.794  -6.674  -5.029
    5    HG2  MET  14           HG2      MET  14  -9.464  -8.380  -6.177
    6    HG3  MET  14           HG3      MET  14 -11.176  -8.693  -6.464
    7    HE3  MET  14           HE1      MET  14  -7.844  -7.220  -7.911
    8    HE2  MET  14           HE2      MET  14  -7.902  -8.147  -9.409
    9    HE1  MET  14           HE3      MET  14  -8.028  -8.980  -7.863

  No H/Q in entry =           9
  In of MODEL   30
    1    H    SER  15           H        SER  15 -13.277  -6.472  -4.552
    2    HA   SER  15           HA       SER  15 -14.452  -9.025  -5.243
    3    HB2  SER  15           HB2      SER  15 -14.945  -7.212  -2.872
    4    HB3  SER  15           HB3      SER  15 -15.829  -8.710  -3.144
    5    HG   SER  15           HG       SER  15 -13.085  -8.307  -2.608

  No H/Q in entry =           5
  In of MODEL   30
    1    H    THR  16           H        THR  16 -15.643  -5.683  -5.065
    2    HA   THR  16           HA       THR  16 -18.402  -6.294  -5.677
    3    HB   THR  16           HB       THR  16 -16.911  -3.694  -6.176
    4    HG1  THR  16           HG1      THR  16 -16.659  -3.639  -4.116
    5   HG23  THR  16          HG21      THR  16 -19.036  -2.673  -6.077
    6   HG22  THR  16          HG22      THR  16 -19.783  -4.097  -5.331
    7   HG21  THR  16          HG23      THR  16 -19.305  -4.124  -7.035

  No H/Q in entry =           7
  In of MODEL   30
    1    H    SER  17           H        SER  17 -15.501  -5.652  -7.463
    2    HA   SER  17           HA       SER  17 -16.620  -4.997  -9.992
    3    HB2  SER  17           HB2      SER  17 -13.935  -6.143  -9.209
    4    HB3  SER  17           HB3      SER  17 -14.363  -5.792 -10.884
    5    HG   SER  17           HG       SER  17 -14.725  -3.819  -8.930

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU  18           H        LEU  18 -15.906  -8.092  -8.504
    2    HA   LEU  18           HA       LEU  18 -16.364  -9.642 -10.855
    3    HB2  LEU  18           HB2      LEU  18 -15.129 -10.522  -8.926
    4    HB3  LEU  18           HB3      LEU  18 -16.579 -10.390  -7.934
    5    HG   LEU  18           HG       LEU  18 -17.712 -12.023  -9.394
    6   HD11  LEU  18          HD11      LEU  18 -15.110 -11.808 -10.862
    7   HD13  LEU  18          HD12      LEU  18 -16.752 -11.882 -11.501
    8   HD12  LEU  18          HD13      LEU  18 -15.983 -13.338 -10.875
    9   HD22  LEU  18          HD21      LEU  18 -16.697 -13.909  -8.483
   10   HD21  LEU  18          HD22      LEU  18 -16.331 -12.603  -7.355
   11   HD23  LEU  18          HD23      LEU  18 -15.099 -13.162  -8.487

  No H/Q in entry =          11
  In of MODEL   30
    1    H    LEU  19           H        LEU  19 -18.447  -8.523  -8.193
    2    HA   LEU  19           HA       LEU  19 -20.825  -9.849  -9.059
    3    HB2  LEU  19           HB2      LEU  19 -20.638  -8.978  -6.810
    4    HB3  LEU  19           HB3      LEU  19 -20.447  -7.340  -7.431
    5    HG   LEU  19           HG       LEU  19 -22.803  -7.476  -8.277
    6   HD13  LEU  19          HD11      LEU  19 -24.259  -9.192  -7.329
    7   HD12  LEU  19          HD12      LEU  19 -22.874  -9.951  -6.544
    8   HD11  LEU  19          HD13      LEU  19 -22.990  -9.935  -8.303
    9   HD21  LEU  19          HD21      LEU  19 -22.182  -6.310  -6.232
   10   HD23  LEU  19          HD22      LEU  19 -22.368  -7.804  -5.315
   11   HD22  LEU  19          HD23      LEU  19 -23.771  -7.059  -6.081

  No H/Q in entry =          11
  In of MODEL   30
    1    H    VAL  20           H        VAL  20 -19.493  -6.616  -9.756
    2    HA   VAL  20           HA       VAL  20 -21.630  -5.707 -11.374
    3    HB   VAL  20           HB       VAL  20 -18.677  -4.950 -11.436
    4   HG13  VAL  20          HG11      VAL  20 -19.429  -4.387 -13.612
    5   HG12  VAL  20          HG12      VAL  20 -19.573  -2.893 -12.686
    6   HG11  VAL  20          HG13      VAL  20 -21.006  -3.865 -13.019
    7   HG23  VAL  20          HG21      VAL  20 -19.680  -2.802 -10.489
    8   HG22  VAL  20          HG22      VAL  20 -19.598  -4.205  -9.426
    9   HG21  VAL  20          HG23      VAL  20 -21.128  -3.764 -10.184

  No H/Q in entry =           9
  In of MODEL   30
    1    H    SER  21           H        SER  21 -18.743  -7.608 -12.331
    2    HA   SER  21           HA       SER  21 -19.480  -7.564 -15.096
    3    HB2  SER  21           HB2      SER  21 -17.932  -9.451 -15.384
    4    HB3  SER  21           HB3      SER  21 -17.190  -8.153 -14.452
    5    HG   SER  21           HG       SER  21 -17.981 -10.695 -13.676

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LYS  22           H        LYS  22 -20.472  -9.783 -12.524
    2    HA   LYS  22           HA       LYS  22 -21.883 -11.501 -14.359
    3    HB2  LYS  22           HB2      LYS  22 -21.889 -11.171 -11.378
    4    HB3  LYS  22           HB3      LYS  22 -23.124 -12.149 -12.171
    5    HG2  LYS  22           HG2      LYS  22 -21.053 -13.334 -11.231
    6    HG3  LYS  22           HG3      LYS  22 -21.591 -13.758 -12.856
    7    HD2  LYS  22           HD2      LYS  22 -19.879 -12.341 -13.831
    8    HD3  LYS  22           HD3      LYS  22 -19.378 -11.804 -12.227
    9    HE2  LYS  22           HE2      LYS  22 -18.692 -14.095 -11.669
   10    HE3  LYS  22           HE3      LYS  22 -19.208 -14.644 -13.263
   11    HZ2  LYS  22           HZ1      LYS  22 -16.713 -13.852 -12.595
   12    HZ1  LYS  22           HZ2      LYS  22 -17.340 -12.471 -13.360
   13    HZ3  LYS  22           HZ3      LYS  22 -17.323 -13.961 -14.176

  No H/Q in entry =          13
  In of MODEL   30
    1    H    MET  23           H        MET  23 -22.801  -8.608 -12.532
    2    HA   MET  23           HA       MET  23 -25.590  -8.844 -13.089
    3    HB2  MET  23           HB2      MET  23 -23.883  -6.434 -12.504
    4    HB3  MET  23           HB3      MET  23 -25.631  -6.361 -12.715
    5    HG2  MET  23           HG2      MET  23 -25.989  -7.669 -10.742
    6    HG3  MET  23           HG3      MET  23 -24.261  -7.985 -10.581
    7    HE2  MET  23           HE1      MET  23 -26.776  -4.454  -9.469
    8    HE1  MET  23           HE2      MET  23 -26.950  -5.447 -10.915
    9    HE3  MET  23           HE3      MET  23 -25.993  -3.966 -10.972

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ARG  24           H        ARG  24 -22.884  -7.283 -14.835
    2    HA   ARG  24           HA       ARG  24 -24.411  -6.082 -16.873
    3    HB2  ARG  24           HB2      ARG  24 -21.537  -7.062 -16.843
    4    HB3  ARG  24           HB3      ARG  24 -22.233  -6.210 -18.199
    5    HG2  ARG  24           HG2      ARG  24 -22.556  -4.178 -16.850
    6    HG3  ARG  24           HG3      ARG  24 -22.001  -5.050 -15.396
    7    HD2  ARG  24           HD2      ARG  24 -20.108  -3.801 -16.279
    8    HD3  ARG  24           HD3      ARG  24 -19.852  -5.512 -16.598
    9    HE   ARG  24           HE       ARG  24 -20.976  -4.644 -18.887
   10   HH21  ARG  24          HH11      ARG  24 -19.506  -5.251 -20.476
   11   HH22  ARG  24          HH12      ARG  24 -17.863  -4.722 -20.370
   12   HH11  ARG  24          HH21      ARG  24 -18.349  -3.508 -17.081
   13   HH12  ARG  24          HH22      ARG  24 -17.190  -3.683 -18.362

  No H/Q in entry =          13
  In of MODEL   30
    1    H    ALA  25           H        ALA  25 -23.118  -9.353 -16.547
    2    HA   ALA  25           HA       ALA  25 -23.652 -10.237 -19.188
    3    HB1  ALA  25           HB1      ALA  25 -22.862 -12.224 -18.461
    4    HB3  ALA  25           HB2      ALA  25 -23.946 -12.248 -17.070
    5    HB2  ALA  25           HB3      ALA  25 -22.438 -11.339 -16.996

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLN  26           H        GLN  26 -25.532 -10.349 -16.198
    2    HA   GLN  26           HA       GLN  26 -27.788 -11.682 -17.249
    3    HB2  GLN  26           HB2      GLN  26 -27.414  -9.893 -14.867
    4    HB3  GLN  26           HB3      GLN  26 -28.930 -10.700 -15.241
    5    HG2  GLN  26           HG2      GLN  26 -26.281 -12.014 -14.711
    6    HG3  GLN  26           HG3      GLN  26 -27.666 -11.975 -13.628
    7   HE21  GLN  26          HE21      GLN  26 -26.311 -14.082 -14.863
    8   HE22  GLN  26          HE22      GLN  26 -27.282 -15.189 -15.670

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ALA  27           H        ALA  27 -27.041  -8.237 -16.869
    2    HA   ALA  27           HA       ALA  27 -29.569  -7.283 -17.708
    3    HB1  ALA  27           HB1      ALA  27 -27.853  -5.866 -16.569
    4    HB3  ALA  27           HB2      ALA  27 -28.455  -5.143 -18.063
    5    HB2  ALA  27           HB3      ALA  27 -26.876  -5.928 -18.037

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLU  28           H        GLU  28 -26.773  -8.375 -19.516
    2    HA   GLU  28           HA       GLU  28 -27.713  -7.403 -22.060
    3    HB2  GLU  28           HB2      GLU  28 -25.314  -7.956 -21.386
    4    HB3  GLU  28           HB3      GLU  28 -25.766  -9.648 -21.586
    5    HG2  GLU  28           HG2      GLU  28 -24.624  -8.826 -23.538
    6    HG3  GLU  28           HG3      GLU  28 -26.296  -9.240 -23.916

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LYS  29           H        LYS  29 -27.748 -10.502 -20.382
    2    HA   LYS  29           HA       LYS  29 -28.933 -12.053 -22.401
    3    HB2  LYS  29           HB2      LYS  29 -27.872 -12.966 -20.369
    4    HB3  LYS  29           HB3      LYS  29 -29.197 -12.320 -19.404
    5    HG2  LYS  29           HG2      LYS  29 -30.763 -13.785 -20.492
    6    HG3  LYS  29           HG3      LYS  29 -29.511 -14.364 -21.589
    7    HD2  LYS  29           HD2      LYS  29 -28.343 -15.457 -19.826
    8    HD3  LYS  29           HD3      LYS  29 -29.317 -14.657 -18.595
    9    HE2  LYS  29           HE2      LYS  29 -29.938 -17.044 -18.953
   10    HE3  LYS  29           HE3      LYS  29 -31.272 -15.922 -19.229
   11    HZ1  LYS  29           HZ1      LYS  29 -30.654 -16.042 -21.645
   12    HZ3  LYS  29           HZ2      LYS  29 -31.313 -17.461 -20.982
   13    HZ2  LYS  29           HZ3      LYS  29 -29.641 -17.346 -21.249

  No H/Q in entry =          13
  In of MODEL   30
    1    H    TYR  30           H        TYR  30 -30.481 -10.007 -19.939
    2    HA   TYR  30           HA       TYR  30 -33.092 -10.604 -21.227
    3    HB2  TYR  30           HB2      TYR  30 -32.553  -9.400 -18.503
    4    HB3  TYR  30           HB3      TYR  30 -34.142  -9.746 -19.185
    5    HD1  TYR  30           HD1      TYR  30 -34.927 -12.084 -19.398
    6    HD2  TYR  30           HD2      TYR  30 -31.168 -11.151 -17.628
    7    HE1  TYR  30           HE1      TYR  30 -34.730 -14.399 -18.582
    8    HE2  TYR  30           HE2      TYR  30 -30.974 -13.451 -16.816
    9    HH   TYR  30           HH       TYR  30 -32.466 -15.902 -17.922

  No H/Q in entry =           9
  In of MODEL   30
    1    H    GLU  31           H        GLU  31 -31.019  -8.506 -22.001
    2    HA   GLU  31           HA       GLU  31 -31.043  -6.354 -22.838
    3    HB2  GLU  31           HB2      GLU  31 -33.886  -7.224 -23.400
    4    HB3  GLU  31           HB3      GLU  31 -33.105  -5.818 -24.123
    5    HG2  GLU  31           HG2      GLU  31 -31.536  -7.184 -25.277
    6    HG3  GLU  31           HG3      GLU  31 -32.042  -8.621 -24.388

  No H/Q in entry =           6
  In of MODEL   30
    1    H    VAL  32           H        VAL  32 -31.300  -6.245 -20.112
    2    HA   VAL  32           HA       VAL  32 -33.284  -4.230 -19.503
    3    HB   VAL  32           HB       VAL  32 -30.873  -5.084 -17.870
    4   HG12  VAL  32          HG11      VAL  32 -32.487  -4.332 -16.010
    5   HG11  VAL  32          HG12      VAL  32 -33.342  -3.482 -17.296
    6   HG13  VAL  32          HG13      VAL  32 -31.660  -3.085 -16.947
    7   HG21  VAL  32          HG21      VAL  32 -32.533  -6.901 -18.579
    8   HG23  VAL  32          HG22      VAL  32 -33.638  -6.123 -17.445
    9   HG22  VAL  32          HG23      VAL  32 -32.096  -6.761 -16.876

  No H/Q in entry =           9
  In of MODEL   30
    1    HA   PRO  33           HA       PRO  33 -30.382  -1.154 -21.141
    2    HB2  PRO  33           HB2      PRO  33 -32.013   0.985 -21.062
    3    HB3  PRO  33           HB3      PRO  33 -32.390  -0.347 -22.154
    4    HG2  PRO  33           HG2      PRO  33 -33.439   0.134 -19.365
    5    HG3  PRO  33           HG3      PRO  33 -34.362  -0.136 -20.842
    6    HD2  PRO  33           HD2      PRO  33 -33.826  -2.170 -19.154
    7    HD3  PRO  33           HD3      PRO  33 -33.842  -2.425 -20.899

  No H/Q in entry =           7
  In of MODEL   30
    1    H    VAL  34           H        VAL  34 -29.128  -1.617 -19.165
    2    HA   VAL  34           HA       VAL  34 -29.008   0.831 -17.529
    3    HB   VAL  34           HB       VAL  34 -28.386  -0.586 -15.570
    4   HG12  VAL  34          HG11      VAL  34 -30.753  -1.586 -15.302
    5   HG11  VAL  34          HG12      VAL  34 -31.079  -0.854 -16.871
    6   HG13  VAL  34          HG13      VAL  34 -30.607   0.159 -15.507
    7   HG21  VAL  34          HG21      VAL  34 -28.422  -2.631 -17.568
    8   HG23  VAL  34          HG22      VAL  34 -29.484  -3.040 -16.219
    9   HG22  VAL  34          HG23      VAL  34 -27.789  -2.659 -15.921

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ILE  35           H        ILE  35 -27.075   1.378 -16.655
    2    HA   ILE  35           HA       ILE  35 -24.678   0.169 -17.865
    3    HB   ILE  35           HB       ILE  35 -25.250   3.038 -17.083
    4   HG12  ILE  35          HG12      ILE  35 -24.149   1.771 -19.599
    5   HG13  ILE  35          HG13      ILE  35 -25.816   2.303 -19.374
    6   HG21  ILE  35          HG21      ILE  35 -22.603   1.646 -17.333
    7   HG23  ILE  35          HG22      ILE  35 -23.144   2.806 -16.121
    8   HG22  ILE  35          HG23      ILE  35 -22.761   3.350 -17.754
    9   HD11  ILE  35          HD11      ILE  35 -24.548   4.575 -18.763
   10   HD13  ILE  35          HD12      ILE  35 -25.032   4.153 -20.406
   11   HD12  ILE  35          HD13      ILE  35 -23.372   3.878 -19.876

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ILE  36           H        ILE  36 -23.423  -0.775 -16.237
    2    HA   ILE  36           HA       ILE  36 -23.951  -0.168 -13.379
    3    HB   ILE  36           HB       ILE  36 -22.957  -2.828 -14.453
    4   HG12  ILE  36          HG12      ILE  36 -25.818  -2.174 -13.747
    5   HG13  ILE  36          HG13      ILE  36 -25.216  -2.132 -15.404
    6   HG23  ILE  36          HG21      ILE  36 -23.301  -3.663 -12.340
    7   HG22  ILE  36          HG22      ILE  36 -24.505  -2.440 -11.931
    8   HG21  ILE  36          HG23      ILE  36 -22.794  -2.013 -11.971
    9   HD13  ILE  36          HD11      ILE  36 -25.256  -4.352 -15.597
   10   HD12  ILE  36          HD12      ILE  36 -26.353  -4.280 -14.219
   11   HD11  ILE  36          HD13      ILE  36 -24.639  -4.605 -13.966

  No H/Q in entry =          11
  In of MODEL   30
    1    H    GLU  37           H        GLU  37 -22.229   0.565 -12.246
    2    HA   GLU  37           HA       GLU  37 -19.482  -0.087 -13.106
    3    HB2  GLU  37           HB2      GLU  37 -20.525   2.655 -12.417
    4    HB3  GLU  37           HB3      GLU  37 -18.818   2.243 -12.568
    5    HG2  GLU  37           HG2      GLU  37 -20.838   2.117 -14.788
    6    HG3  GLU  37           HG3      GLU  37 -19.698   3.434 -14.514

  No H/Q in entry =           6
  In of MODEL   30
    1    H    ALA  38           H        ALA  38 -18.016  -0.232 -11.395
    2    HA   ALA  38           HA       ALA  38 -19.108  -0.094  -8.645
    3    HB1  ALA  38           HB1      ALA  38 -17.262  -1.944 -10.025
    4    HB3  ALA  38           HB2      ALA  38 -18.324  -2.229  -8.645
    5    HB2  ALA  38           HB3      ALA  38 -16.756  -1.457  -8.407

  No H/Q in entry =           5
  In of MODEL   30
    1    H    PHE  39           H        PHE  39 -17.965   1.192  -7.157
    2    HA   PHE  39           HA       PHE  39 -15.495   2.528  -8.015
    3    HB2  PHE  39           HB2      PHE  39 -17.929   3.932  -6.910
    4    HB3  PHE  39           HB3      PHE  39 -16.338   4.670  -7.090
    5    HD1  PHE  39           HD1      PHE  39 -15.381   4.960  -9.370
    6    HD2  PHE  39           HD2      PHE  39 -19.428   3.798  -8.702
    7    HE1  PHE  39           HE1      PHE  39 -15.946   5.646 -11.682
    8    HE2  PHE  39           HE2      PHE  39 -20.007   4.473 -11.005
    9    HZ   PHE  39           HZ       PHE  39 -18.266   5.369 -12.513

  No H/Q in entry =           9
  In of MODEL   30
    1    HA   PRO  40           HA       PRO  40 -14.597   1.854  -3.707
    2    HB2  PRO  40           HB2      PRO  40 -12.959   3.971  -3.083
    3    HB3  PRO  40           HB3      PRO  40 -12.419   2.659  -4.130
    4    HG2  PRO  40           HG2      PRO  40 -13.580   5.327  -4.919
    5    HG3  PRO  40           HG3      PRO  40 -12.100   4.561  -5.494
    6    HD2  PRO  40           HD2      PRO  40 -14.287   4.342  -6.939
    7    HD3  PRO  40           HD3      PRO  40 -13.255   2.930  -6.721

  No H/Q in entry =           7
  In of MODEL   30
    1    H    GLU  41           H        GLU  41 -15.312   2.808  -1.596
    2    HA   GLU  41           HA       GLU  41 -17.651   4.379  -1.633
    3    HB2  GLU  41           HB2      GLU  41 -17.227   4.561   0.857
    4    HB3  GLU  41           HB3      GLU  41 -17.338   2.925   0.209
    5    HG2  GLU  41           HG2      GLU  41 -15.561   2.781   1.684
    6    HG3  GLU  41           HG3      GLU  41 -14.766   3.010   0.127

  No H/Q in entry =           6
  In of MODEL   30
    1    H    THR  42           H        THR  42 -14.377   5.486  -1.630
    2    HA   THR  42           HA       THR  42 -14.900   8.030  -0.443
    3    HB   THR  42           HB       THR  42 -12.761   8.720  -1.518
    4    HG1  THR  42           HG1      THR  42 -11.887   6.445  -2.443
    5   HG23  THR  42          HG21      THR  42 -11.368   7.312  -0.215
    6   HG22  THR  42          HG22      THR  42 -12.470   5.943  -0.379
    7   HG21  THR  42          HG23      THR  42 -12.919   7.318   0.626

  No H/Q in entry =           7
  In of MODEL   30
    1    H    LEU  43           H        LEU  43 -15.681   6.866  -3.551
    2    HA   LEU  43           HA       LEU  43 -16.075   9.613  -4.547
    3    HB2  LEU  43           HB2      LEU  43 -16.243   6.937  -5.921
    4    HB3  LEU  43           HB3      LEU  43 -16.559   8.488  -6.697
    5    HG   LEU  43           HG       LEU  43 -13.887   7.601  -5.637
    6   HD12  LEU  43          HD11      LEU  43 -14.640   7.946  -8.518
    7   HD11  LEU  43          HD12      LEU  43 -14.894   6.409  -7.694
    8   HD13  LEU  43          HD13      LEU  43 -13.269   7.079  -7.825
    9   HD21  LEU  43          HD21      LEU  43 -14.872  10.052  -7.084
   10   HD23  LEU  43          HD22      LEU  43 -13.175   9.570  -7.110
   11   HD22  LEU  43          HD23      LEU  43 -13.957   9.958  -5.579

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ALA  44           H        ALA  44 -17.947   7.690  -2.717
    2    HA   ALA  44           HA       ALA  44 -20.387   7.398  -4.083
    3    HB2  ALA  44           HB1      ALA  44 -20.224   6.304  -1.976
    4    HB3  ALA  44           HB2      ALA  44 -21.412   7.585  -1.734
    5    HB1  ALA  44           HB3      ALA  44 -19.761   7.793  -1.152

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLY  45           H        GLY  45 -19.161  10.285  -2.545
    2    HA3  GLY  45           HA2      GLY  45 -21.673  11.640  -2.963
    3    HA2  GLY  45           HA3      GLY  45 -20.179  12.356  -2.362

  No H/Q in entry =           3
  In of MODEL   30
    1    H    GLU  46           H        GLU  46 -18.553  11.496  -4.616
    2    HA   GLU  46           HA       GLU  46 -19.284  13.659  -6.414
    3    HB2  GLU  46           HB2      GLU  46 -16.971  11.715  -6.363
    4    HB3  GLU  46           HB3      GLU  46 -17.157  12.995  -7.562
    5    HG2  GLU  46           HG2      GLU  46 -16.970  14.681  -5.851
    6    HG3  GLU  46           HG3      GLU  46 -16.912  13.444  -4.596

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LYS  47           H        LYS  47 -18.953  10.150  -6.820
    2    HA   LYS  47           HA       LYS  47 -20.011  10.288  -9.517
    3    HB2  LYS  47           HB2      LYS  47 -18.731   8.285  -7.813
    4    HB3  LYS  47           HB3      LYS  47 -20.075   7.639  -8.756
    5    HG2  LYS  47           HG2      LYS  47 -18.066   7.310  -9.987
    6    HG3  LYS  47           HG3      LYS  47 -19.006   8.564 -10.792
    7    HD2  LYS  47           HD2      LYS  47 -17.649  10.286  -9.729
    8    HD3  LYS  47           HD3      LYS  47 -16.726   9.048  -8.881
    9    HE2  LYS  47           HE2      LYS  47 -15.940   8.161 -11.010
   10    HE3  LYS  47           HE3      LYS  47 -16.889   9.371 -11.872
   11    HZ1  LYS  47           HZ1      LYS  47 -14.892  10.158  -9.856
   12    HZ3  LYS  47           HZ2      LYS  47 -15.543  11.074 -11.130
   13    HZ2  LYS  47           HZ3      LYS  47 -14.434   9.829 -11.458

  No H/Q in entry =          13
  In of MODEL   30
    1    H    GLY  48           H        GLY  48 -21.347   9.477  -6.388
    2    HA3  GLY  48           HA2      GLY  48 -23.645   8.151  -7.164
    3    HA2  GLY  48           HA3      GLY  48 -23.505   9.164  -5.728

  No H/Q in entry =           3
  In of MODEL   30
    1    H    GLN  49           H        GLN  49 -23.033  11.607  -7.307
    2    HA   GLN  49           HA       GLN  49 -25.649  12.567  -7.506
    3    HB2  GLN  49           HB2      GLN  49 -23.135  13.569  -8.826
    4    HB3  GLN  49           HB3      GLN  49 -24.651  14.448  -8.776
    5    HG2  GLN  49           HG2      GLN  49 -24.540  14.497  -6.337
    6    HG3  GLN  49           HG3      GLN  49 -23.035  13.596  -6.385
    7   HE21  GLN  49          HE21      GLN  49 -23.071  15.836  -5.128
    8   HE22  GLN  49          HE22      GLN  49 -22.210  17.139  -5.767

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ASN  50           H        ASN  50 -23.820  10.773  -9.848
    2    HA   ASN  50           HA       ASN  50 -25.711  11.521 -11.971
    3    HB2  ASN  50           HB2      ASN  50 -23.042  10.131 -12.145
    4    HB3  ASN  50           HB3      ASN  50 -24.090  10.487 -13.511
    5   HD21  ASN  50          HD21      ASN  50 -21.538  11.494 -11.858
    6   HD22  ASN  50          HD22      ASN  50 -21.392  13.138 -12.209

  No H/Q in entry =           6
  In of MODEL   30
    1    H    ALA  51           H        ALA  51 -25.603   9.185  -9.707
    2    HA   ALA  51           HA       ALA  51 -26.229   6.986 -11.532
    3    HB2  ALA  51           HB1      ALA  51 -25.601   5.683  -9.824
    4    HB3  ALA  51           HB2      ALA  51 -26.788   6.433  -8.758
    5    HB1  ALA  51           HB3      ALA  51 -25.184   7.146  -8.931

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ASP  52           H        ASP  52 -28.173   5.819 -11.420
    2    HA   ASP  52           HA       ASP  52 -30.467   7.529 -10.809
    3    HB2  ASP  52           HB2      ASP  52 -30.102   5.028 -12.457
    4    HB3  ASP  52           HB3      ASP  52 -31.694   5.674 -12.057

  No H/Q in entry =           4
  In of MODEL   30
    1    H    VAL  53           H        VAL  53 -28.724   4.742  -9.742
    2    HA   VAL  53           HA       VAL  53 -30.216   4.804  -7.255
    3    HB   VAL  53           HB       VAL  53 -31.496   3.077  -8.512
    4   HG11  VAL  53          HG11      VAL  53 -29.675   2.308  -9.994
    5   HG13  VAL  53          HG12      VAL  53 -30.450   0.973  -9.141
    6   HG12  VAL  53          HG13      VAL  53 -28.881   1.570  -8.605
    7   HG23  VAL  53          HG21      VAL  53 -30.596   1.161  -6.789
    8   HG22  VAL  53          HG22      VAL  53 -31.804   2.401  -6.453
    9   HG21  VAL  53          HG23      VAL  53 -30.118   2.672  -6.016

  No H/Q in entry =           9
  In of MODEL   30
    1    H    VAL  54           H        VAL  54 -28.913   4.457  -5.572
    2    HA   VAL  54           HA       VAL  54 -26.098   3.760  -6.127
    3    HB   VAL  54           HB       VAL  54 -27.308   5.489  -3.910
    4   HG11  VAL  54          HG11      VAL  54 -24.650   4.216  -4.142
    5   HG13  VAL  54          HG12      VAL  54 -25.466   4.860  -2.720
    6   HG12  VAL  54          HG13      VAL  54 -24.600   5.947  -3.807
    7   HG22  VAL  54          HG21      VAL  54 -26.532   7.342  -5.008
    8   HG21  VAL  54          HG22      VAL  54 -26.997   6.314  -6.362
    9   HG23  VAL  54          HG23      VAL  54 -25.303   6.438  -5.893

  No H/Q in entry =           9
  In of MODEL   30
    1    H    LEU  55           H        LEU  55 -25.411   1.878  -5.458
    2    HA   LEU  55           HA       LEU  55 -26.885   0.500  -3.300
    3    HB2  LEU  55           HB2      LEU  55 -25.222  -0.594  -5.558
    4    HB3  LEU  55           HB3      LEU  55 -25.953  -1.562  -4.277
    5    HG   LEU  55           HG       LEU  55 -27.437  -0.070  -6.432
    6   HD13  LEU  55          HD11      LEU  55 -27.011  -1.911  -7.632
    7   HD12  LEU  55          HD12      LEU  55 -27.940  -2.831  -6.448
    8   HD11  LEU  55          HD13      LEU  55 -26.194  -2.667  -6.265
    9   HD23  LEU  55          HD21      LEU  55 -28.655  -2.074  -4.586
   10   HD22  LEU  55          HD22      LEU  55 -29.410  -0.739  -5.457
   11   HD21  LEU  55          HD23      LEU  55 -28.433  -0.417  -4.025

  No H/Q in entry =          11
  In of MODEL   30
    1    H    LEU  56           H        LEU  56 -25.735  -0.017  -1.471
    2    HA   LEU  56           HA       LEU  56 -22.828   0.541  -1.469
    3    HB2  LEU  56           HB2      LEU  56 -24.660   0.245   0.898
    4    HB3  LEU  56           HB3      LEU  56 -22.978   0.769   0.915
    5    HG   LEU  56           HG       LEU  56 -25.348   2.310  -0.104
    6   HD11  LEU  56          HD11      LEU  56 -24.261   2.008   2.439
    7   HD13  LEU  56          HD12      LEU  56 -25.316   3.317   1.905
    8   HD12  LEU  56          HD13      LEU  56 -23.566   3.518   1.849
    9   HD23  LEU  56          HD21      LEU  56 -23.497   4.114  -0.274
   10   HD22  LEU  56          HD22      LEU  56 -23.794   2.989  -1.600
   11   HD21  LEU  56          HD23      LEU  56 -22.444   2.719  -0.500

  No H/Q in entry =          11
  In of MODEL   30
    1    H    GLY  57           H        GLY  57 -21.369  -1.007  -0.897
    2    HA3  GLY  57           HA2      GLY  57 -22.138  -3.741  -1.092
    3    HA2  GLY  57           HA3      GLY  57 -20.555  -3.155  -0.588

  No H/Q in entry =           3
  In of MODEL   30
    1    HA   PRO  58           HA       PRO  58 -23.371  -4.323   3.080
    2    HB2  PRO  58           HB2      PRO  58 -22.554  -6.881   3.719
    3    HB3  PRO  58           HB3      PRO  58 -23.940  -6.557   2.677
    4    HG2  PRO  58           HG2      PRO  58 -21.153  -7.290   1.949
    5    HG3  PRO  58           HG3      PRO  58 -22.677  -7.841   1.252
    6    HD2  PRO  58           HD2      PRO  58 -21.149  -5.946   0.045
    7    HD3  PRO  58           HD3      PRO  58 -22.908  -5.958  -0.090

  No H/Q in entry =           7
  In of MODEL   30
    1    H    GLN  59           H        GLN  59 -19.968  -4.611   2.539
    2    HA   GLN  59           HA       GLN  59 -19.266  -4.569   5.313
    3    HB2  GLN  59           HB2      GLN  59 -17.825  -4.153   2.754
    4    HB3  GLN  59           HB3      GLN  59 -17.130  -3.402   4.176
    5    HG2  GLN  59           HG2      GLN  59 -16.152  -5.591   3.742
    6    HG3  GLN  59           HG3      GLN  59 -17.001  -5.565   5.279
    7   HE21  GLN  59          HE21      GLN  59 -17.620  -7.424   5.396
    8   HE22  GLN  59          HE22      GLN  59 -18.565  -8.541   4.605

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ILE  60           H        ILE  60 -20.297  -2.089   3.068
    2    HA   ILE  60           HA       ILE  60 -19.593  -0.074   5.114
    3    HB   ILE  60           HB       ILE  60 -19.897   1.626   3.264
    4   HG12  ILE  60          HG12      ILE  60 -19.512  -0.610   1.317
    5   HG13  ILE  60          HG13      ILE  60 -21.141  -0.153   1.815
    6   HG22  ILE  60          HG21      ILE  60 -17.732  -0.335   2.630
    7   HG21  ILE  60          HG22      ILE  60 -17.714   0.677   4.072
    8   HG23  ILE  60          HG23      ILE  60 -17.711   1.421   2.475
    9   HD11  ILE  60          HD11      ILE  60 -20.317   2.270   1.173
   10   HD13  ILE  60          HD12      ILE  60 -20.878   1.155  -0.072
   11   HD12  ILE  60          HD13      ILE  60 -19.151   1.382   0.193

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ALA  61           H        ALA  61 -21.957  -1.792   5.151
    2    HA   ALA  61           HA       ALA  61 -24.263  -0.255   4.637
    3    HB1  ALA  61           HB1      ALA  61 -25.419  -1.801   5.952
    4    HB2  ALA  61           HB2      ALA  61 -24.020  -2.106   6.984
    5    HB3  ALA  61           HB3      ALA  61 -24.052  -2.728   5.334

  No H/Q in entry =           5
  In of MODEL   30
    1    H    TYR  62           H        TYR  62 -22.105  -0.227   7.477
    2    HA   TYR  62           HA       TYR  62 -23.781   1.353   9.105
    3    HB2  TYR  62           HB2      TYR  62 -21.787   1.902  10.369
    4    HB3  TYR  62           HB3      TYR  62 -21.749   0.196   9.926
    5    HD1  TYR  62           HD1      TYR  62 -20.084  -0.650   8.332
    6    HD2  TYR  62           HD2      TYR  62 -20.149   3.479   9.429
    7    HE1  TYR  62           HE1      TYR  62 -17.866  -0.345   7.299
    8    HE2  TYR  62           HE2      TYR  62 -17.916   3.779   8.398
    9    HH   TYR  62           HH       TYR  62 -16.391   2.834   7.096

  No H/Q in entry =           9
  In of MODEL   30
    1    H    MET  63           H        MET  63 -22.134   2.282   6.273
    2    HA   MET  63           HA       MET  63 -22.135   5.124   6.949
    3    HB2  MET  63           HB2      MET  63 -21.404   3.626   4.431
    4    HB3  MET  63           HB3      MET  63 -21.299   5.378   4.614
    5    HG2  MET  63           HG2      MET  63 -19.603   5.115   6.323
    6    HG3  MET  63           HG3      MET  63 -19.730   3.361   6.198
    7    HE1  MET  63           HE1      MET  63 -19.341   6.536   4.523
    8    HE3  MET  63           HE2      MET  63 -19.275   6.053   2.829
    9    HE2  MET  63           HE3      MET  63 -17.783   6.402   3.704

  No H/Q in entry =           9
  In of MODEL   30
    1    H    LEU  64           H        LEU  64 -24.576   3.126   5.952
    2    HA   LEU  64           HA       LEU  64 -25.822   4.462   3.841
    3    HB2  LEU  64           HB2      LEU  64 -26.592   2.318   4.759
    4    HB3  LEU  64           HB3      LEU  64 -27.121   3.144   6.224
    5    HG   LEU  64           HG       LEU  64 -28.858   4.296   4.954
    6   HD13  LEU  64          HD11      LEU  64 -28.547   4.538   2.726
    7   HD12  LEU  64          HD12      LEU  64 -29.102   2.869   2.581
    8   HD11  LEU  64          HD13      LEU  64 -27.376   3.223   2.670
    9   HD23  LEU  64          HD21      LEU  64 -29.210   1.455   4.220
   10   HD22  LEU  64          HD22      LEU  64 -30.275   2.540   5.113
   11   HD21  LEU  64          HD23      LEU  64 -28.874   1.828   5.910

  No H/Q in entry =          11
  In of MODEL   30
    1    HA   PRO  65           HA       PRO  65 -28.220   7.512   6.527
    2    HB2  PRO  65           HB2      PRO  65 -26.272   7.793   8.815
    3    HB3  PRO  65           HB3      PRO  65 -28.024   7.980   8.828
    4    HG2  PRO  65           HG2      PRO  65 -26.993   5.785   9.788
    5    HG3  PRO  65           HG3      PRO  65 -28.389   5.669   8.719
    6    HD2  PRO  65           HD2      PRO  65 -25.476   5.205   8.072
    7    HD3  PRO  65           HD3      PRO  65 -26.875   4.239   7.606

  No H/Q in entry =           7
  In of MODEL   30
    1    H    GLU  66           H        GLU  66 -24.667   7.647   6.665
    2    HA   GLU  66           HA       GLU  66 -24.512  10.455   6.244
    3    HB2  GLU  66           HB2      GLU  66 -22.567   8.243   5.643
    4    HB3  GLU  66           HB3      GLU  66 -22.204   9.955   5.430
    5    HG2  GLU  66           HG2      GLU  66 -22.479  10.330   7.790
    6    HG3  GLU  66           HG3      GLU  66 -22.919   8.639   8.025

  No H/Q in entry =           6
  In of MODEL   30
    1    H    ILE  67           H        ILE  67 -24.427   7.692   4.011
    2    HA   ILE  67           HA       ILE  67 -24.060   9.405   1.713
    3    HB   ILE  67           HB       ILE  67 -24.807   6.456   1.899
    4   HG12  ILE  67          HG12      ILE  67 -22.225   7.756   1.015
    5   HG13  ILE  67          HG13      ILE  67 -22.530   7.333   2.698
    6   HG21  ILE  67          HG21      ILE  67 -24.808   8.320  -0.340
    7   HG23  ILE  67          HG22      ILE  67 -25.346   6.641  -0.287
    8   HG22  ILE  67          HG23      ILE  67 -23.650   7.013  -0.587
    9   HD12  ILE  67          HD11      ILE  67 -21.974   5.570   0.370
   10   HD11  ILE  67          HD12      ILE  67 -22.980   4.954   1.679
   11   HD13  ILE  67          HD13      ILE  67 -21.341   5.508   2.015

  No H/Q in entry =          11
  In of MODEL   30
    1    H    GLN  68           H        GLN  68 -26.900   8.214   3.303
    2    HA   GLN  68           HA       GLN  68 -28.739   9.035   1.289
    3    HB2  GLN  68           HB2      GLN  68 -29.030   8.684   4.269
    4    HB3  GLN  68           HB3      GLN  68 -30.361   9.203   3.249
    5    HG2  GLN  68           HG2      GLN  68 -30.260   7.166   1.987
    6    HG3  GLN  68           HG3      GLN  68 -28.798   6.670   2.821
    7   HE21  GLN  68          HE21      GLN  68 -30.901   5.201   2.656
    8   HE22  GLN  68          HE22      GLN  68 -31.731   4.713   4.060

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ARG  69           H        ARG  69 -27.271  10.799   4.042
    2    HA   ARG  69           HA       ARG  69 -28.753  13.206   3.592
    3    HB2  ARG  69           HB2      ARG  69 -26.393  12.407   5.229
    4    HB3  ARG  69           HB3      ARG  69 -26.552  14.118   4.857
    5    HG2  ARG  69           HG2      ARG  69 -28.885  14.050   5.787
    6    HG3  ARG  69           HG3      ARG  69 -28.600  12.376   6.277
    7    HD2  ARG  69           HD2      ARG  69 -27.046  14.820   7.203
    8    HD3  ARG  69           HD3      ARG  69 -28.146  13.864   8.184
    9    HE   ARG  69           HE       ARG  69 -25.473  13.060   7.287
   10   HH21  ARG  69          HH11      ARG  69 -24.598  11.348   8.511
   11   HH22  ARG  69          HH12      ARG  69 -25.604  10.488   9.627
   12   HH11  ARG  69          HH21      ARG  69 -28.428  12.375   8.937
   13   HH12  ARG  69          HH22      ARG  69 -27.773  11.068   9.867

  No H/Q in entry =          13
  In of MODEL   30
    1    H    LEU  70           H        LEU  70 -25.790  11.937   2.294
    2    HA   LEU  70           HA       LEU  70 -24.776  14.348   1.129
    3    HB2  LEU  70           HB2      LEU  70 -23.678  12.087   1.758
    4    HB3  LEU  70           HB3      LEU  70 -24.239  11.580   0.165
    5    HG   LEU  70           HG       LEU  70 -22.698  13.024  -0.901
    6   HD11  LEU  70          HD11      LEU  70 -21.969  13.926   1.893
    7   HD13  LEU  70          HD12      LEU  70 -22.693  14.915   0.626
    8   HD12  LEU  70          HD13      LEU  70 -21.046  14.315   0.439
    9   HD22  LEU  70          HD21      LEU  70 -21.185  11.383  -0.631
   10   HD21  LEU  70          HD22      LEU  70 -22.109  10.824   0.764
   11   HD23  LEU  70          HD23      LEU  70 -20.783  11.966   0.983

  No H/Q in entry =          11
  In of MODEL   30
    1    H    LEU  71           H        LEU  71 -26.780  11.693  -0.005
    2    HA   LEU  71           HA       LEU  71 -27.333  13.137  -2.542
    3    HB2  LEU  71           HB2      LEU  71 -27.400  10.149  -2.077
    4    HB3  LEU  71           HB3      LEU  71 -27.543  10.992  -3.619
    5    HG   LEU  71           HG       LEU  71 -25.057  11.139  -1.914
    6   HD12  LEU  71          HD11      LEU  71 -24.986   9.495  -4.334
    7   HD11  LEU  71          HD12      LEU  71 -25.988   8.831  -3.045
    8   HD13  LEU  71          HD13      LEU  71 -24.289   9.196  -2.742
    9   HD22  LEU  71          HD21      LEU  71 -25.221  12.939  -3.422
   10   HD21  LEU  71          HD22      LEU  71 -25.643  11.864  -4.756
   11   HD23  LEU  71          HD23      LEU  71 -24.029  11.801  -4.049

  No H/Q in entry =          11
  In of MODEL   30
    1    HA   PRO  72           HA       PRO  72 -31.219  12.517   0.014
    2    HB2  PRO  72           HB2      PRO  72 -32.196  15.034  -0.100
    3    HB3  PRO  72           HB3      PRO  72 -30.886  14.652   1.017
    4    HG2  PRO  72           HG2      PRO  72 -30.709  15.837  -1.742
    5    HG3  PRO  72           HG3      PRO  72 -29.996  16.435  -0.243
    6    HD2  PRO  72           HD2      PRO  72 -28.555  14.930  -1.975
    7    HD3  PRO  72           HD3      PRO  72 -28.323  14.787  -0.233

  No H/Q in entry =           7
  In of MODEL   30
    1    H    ASN  73           H        ASN  73 -30.584  13.481  -3.195
    2    HA   ASN  73           HA       ASN  73 -33.414  13.032  -3.875
    3    HB2  ASN  73           HB2      ASN  73 -32.965  14.145  -5.972
    4    HB3  ASN  73           HB3      ASN  73 -32.514  15.158  -4.609
    5   HD21  ASN  73          HD21      ASN  73 -31.673  15.223  -7.273
    6   HD22  ASN  73          HD22      ASN  73 -29.996  15.140  -7.435

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LYS  74           H        LYS  74 -31.339  10.876  -3.399
    2    HA   LYS  74           HA       LYS  74 -31.795   9.439  -5.946
    3    HB2  LYS  74           HB2      LYS  74 -29.281   9.276  -4.279
    4    HB3  LYS  74           HB3      LYS  74 -29.599   8.437  -5.797
    5    HG2  LYS  74           HG2      LYS  74 -29.476  11.417  -5.612
    6    HG3  LYS  74           HG3      LYS  74 -28.049  10.417  -5.885
    7    HD2  LYS  74           HD2      LYS  74 -29.087   9.425  -7.841
    8    HD3  LYS  74           HD3      LYS  74 -30.557  10.358  -7.553
    9    HE2  LYS  74           HE2      LYS  74 -29.418  12.416  -7.988
   10    HE3  LYS  74           HE3      LYS  74 -27.856  11.597  -8.047
   11    HZ2  LYS  74           HZ1      LYS  74 -29.314  12.117 -10.202
   12    HZ1  LYS  74           HZ2      LYS  74 -29.905  10.568  -9.830
   13    HZ3  LYS  74           HZ3      LYS  74 -28.245  10.803 -10.098

  No H/Q in entry =          13
  In of MODEL   30
    1    HA   PRO  75           HA       PRO  75 -33.103   6.412  -2.978
    2    HB2  PRO  75           HB2      PRO  75 -33.283   4.172  -4.549
    3    HB3  PRO  75           HB3      PRO  75 -34.469   5.472  -4.648
    4    HG2  PRO  75           HG2      PRO  75 -32.075   4.971  -6.373
    5    HG3  PRO  75           HG3      PRO  75 -33.733   5.329  -6.853
    6    HD2  PRO  75           HD2      PRO  75 -31.880   7.282  -6.790
    7    HD3  PRO  75           HD3      PRO  75 -33.538   7.610  -6.283

  No H/Q in entry =           7
  In of MODEL   30
    1    H    VAL  76           H        VAL  76 -31.629   5.434  -1.572
    2    HA   VAL  76           HA       VAL  76 -29.091   4.331  -2.626
    3    HB   VAL  76           HB       VAL  76 -29.494   5.800   0.015
    4   HG11  VAL  76          HG11      VAL  76 -27.057   4.613  -1.325
    5   HG13  VAL  76          HG12      VAL  76 -27.760   4.142   0.223
    6   HG12  VAL  76          HG13      VAL  76 -26.982   5.715   0.051
    7   HG22  VAL  76          HG21      VAL  76 -28.897   7.724  -0.875
    8   HG21  VAL  76          HG22      VAL  76 -29.380   6.994  -2.407
    9   HG23  VAL  76          HG23      VAL  76 -27.684   6.987  -1.921

  No H/Q in entry =           9
  In of MODEL   30
    1    H    GLU  77           H        GLU  77 -28.788   2.193  -1.993
    2    HA   GLU  77           HA       GLU  77 -29.585   1.389   0.652
    3    HB2  GLU  77           HB2      GLU  77 -31.106  -0.334   0.106
    4    HB3  GLU  77           HB3      GLU  77 -31.711   1.157  -0.617
    5    HG2  GLU  77           HG2      GLU  77 -31.029   0.413  -2.788
    6    HG3  GLU  77           HG3      GLU  77 -30.332  -1.048  -2.092

  No H/Q in entry =           6
  In of MODEL   30
    1    H    VAL  78           H        VAL  78 -29.175  -0.676   1.334
    2    HA   VAL  78           HA       VAL  78 -26.461  -1.330   0.499
    3    HB   VAL  78           HB       VAL  78 -28.169  -2.276   2.841
    4   HG11  VAL  78          HG11      VAL  78 -25.756  -3.403   1.767
    5   HG13  VAL  78          HG12      VAL  78 -26.668  -3.906   3.193
    6   HG12  VAL  78          HG13      VAL  78 -25.405  -2.684   3.338
    7   HG22  VAL  78          HG21      VAL  78 -26.798  -0.838   4.195
    8   HG21  VAL  78          HG22      VAL  78 -27.555   0.088   2.898
    9   HG23  VAL  78          HG23      VAL  78 -25.853  -0.363   2.783

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ILE  79           H        ILE  79 -25.820  -3.218  -0.381
    2    HA   ILE  79           HA       ILE  79 -27.786  -4.799  -1.754
    3    HB   ILE  79           HB       ILE  79 -24.779  -5.186  -1.475
    4   HG12  ILE  79          HG12      ILE  79 -26.424  -4.174  -3.801
    5   HG13  ILE  79          HG13      ILE  79 -25.618  -3.117  -2.641
    6   HG22  ILE  79          HG21      ILE  79 -25.783  -6.432  -3.805
    7   HG21  ILE  79          HG22      ILE  79 -26.768  -6.988  -2.450
    8   HG23  ILE  79          HG23      ILE  79 -25.016  -7.185  -2.407
    9   HD13  ILE  79          HD11      ILE  79 -24.167  -3.179  -4.433
   10   HD12  ILE  79          HD12      ILE  79 -24.422  -4.902  -4.706
   11   HD11  ILE  79          HD13      ILE  79 -23.487  -4.359  -3.311

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ASP  80           H        ASP  80 -28.572  -6.756  -1.171
    2    HA   ASP  80           HA       ASP  80 -28.526  -7.634   1.483
    3    HB2  ASP  80           HB2      ASP  80 -30.221  -8.301  -0.183
    4    HB3  ASP  80           HB3      ASP  80 -29.003  -9.260  -1.023

  No H/Q in entry =           4
  In of MODEL   30
    1    H    SER  81           H        SER  81 -26.961  -8.688   2.650
    2    HA   SER  81           HA       SER  81 -24.414  -9.263   1.508
    3    HB2  SER  81           HB2      SER  81 -23.856 -10.251   3.695
    4    HB3  SER  81           HB3      SER  81 -24.632  -8.679   3.883
    5    HG   SER  81           HG       SER  81 -26.386  -9.601   4.651

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU  82           H        LEU  82 -27.031 -11.475   1.799
    2    HA   LEU  82           HA       LEU  82 -25.367 -13.774   1.325
    3    HB2  LEU  82           HB2      LEU  82 -28.323 -13.292   1.016
    4    HB3  LEU  82           HB3      LEU  82 -27.546 -14.862   0.823
    5    HG   LEU  82           HG       LEU  82 -27.586 -13.276   3.372
    6   HD11  LEU  82          HD11      LEU  82 -29.339 -15.454   2.264
    7   HD13  LEU  82          HD12      LEU  82 -29.809 -13.960   3.077
    8   HD12  LEU  82          HD13      LEU  82 -29.106 -15.285   4.005
    9   HD21  LEU  82          HD21      LEU  82 -26.517 -15.943   2.491
   10   HD23  LEU  82          HD22      LEU  82 -26.911 -15.633   4.182
   11   HD22  LEU  82          HD23      LEU  82 -25.688 -14.656   3.370

  No H/Q in entry =          11
  In of MODEL   30
    1    H    LEU  83           H        LEU  83 -27.391 -11.654  -0.646
    2    HA   LEU  83           HA       LEU  83 -27.082 -13.020  -3.102
    3    HB2  LEU  83           HB2      LEU  83 -27.637 -10.130  -2.486
    4    HB3  LEU  83           HB3      LEU  83 -27.609 -10.788  -4.122
    5    HG   LEU  83           HG       LEU  83 -29.663 -11.251  -1.979
    6   HD13  LEU  83          HD11      LEU  83 -30.483  -9.448  -3.072
    7   HD12  LEU  83          HD12      LEU  83 -30.871 -10.592  -4.356
    8   HD11  LEU  83          HD13      LEU  83 -29.377  -9.656  -4.428
    9   HD23  LEU  83          HD21      LEU  83 -29.694 -12.535  -4.696
   10   HD22  LEU  83          HD22      LEU  83 -30.673 -12.919  -3.280
   11   HD21  LEU  83          HD23      LEU  83 -28.962 -13.344  -3.310

  No H/Q in entry =          11
  In of MODEL   30
    1    H    TYR  84           H        TYR  84 -25.271 -10.535  -1.412
    2    HA   TYR  84           HA       TYR  84 -23.395  -9.978  -3.513
    3    HB2  TYR  84           HB2      TYR  84 -23.985  -8.462  -1.573
    4    HB3  TYR  84           HB3      TYR  84 -23.043  -9.540  -0.545
    5    HD1  TYR  84           HD1      TYR  84 -20.574  -9.838  -1.040
    6    HD2  TYR  84           HD2      TYR  84 -22.927  -6.763  -2.840
    7    HE1  TYR  84           HE1      TYR  84 -18.506  -8.627  -1.645
    8    HE2  TYR  84           HE2      TYR  84 -20.869  -5.546  -3.460
    9    HH   TYR  84           HH       TYR  84 -18.386  -6.209  -3.865

  No H/Q in entry =           9
  In of MODEL   30
    1    H    GLY  85           H        GLY  85 -23.117 -11.946  -0.545
    2    HA3  GLY  85           HA2      GLY  85 -20.490 -12.773  -0.975
    3    HA2  GLY  85           HA3      GLY  85 -21.698 -13.668  -0.052

  No H/Q in entry =           3
  In of MODEL   30
    1    H    LYS  86           H        LYS  86 -23.489 -14.141  -2.142
    2    HA   LYS  86           HA       LYS  86 -22.304 -16.474  -3.362
    3    HB2  LYS  86           HB2      LYS  86 -25.011 -15.149  -3.500
    4    HB3  LYS  86           HB3      LYS  86 -24.626 -16.681  -4.283
    5    HG2  LYS  86           HG2      LYS  86 -24.264 -17.703  -2.128
    6    HG3  LYS  86           HG3      LYS  86 -24.617 -16.168  -1.332
    7    HD2  LYS  86           HD2      LYS  86 -26.841 -16.137  -2.360
    8    HD3  LYS  86           HD3      LYS  86 -26.490 -17.659  -3.180
    9    HE2  LYS  86           HE2      LYS  86 -26.257 -18.773  -1.015
   10    HE3  LYS  86           HE3      LYS  86 -26.602 -17.251  -0.194
   11    HZ2  LYS  86           HZ1      LYS  86 -28.404 -18.916  -1.835
   12    HZ1  LYS  86           HZ2      LYS  86 -28.719 -17.260  -1.622
   13    HZ3  LYS  86           HZ3      LYS  86 -28.654 -18.291  -0.276

  No H/Q in entry =          13
  In of MODEL   30
    1    H    VAL  87           H        VAL  87 -22.424 -13.269  -4.283
    2    HA   VAL  87           HA       VAL  87 -22.144 -12.098  -6.228
    3    HB   VAL  87           HB       VAL  87 -20.957 -14.530  -7.573
    4   HG12  VAL  87          HG11      VAL  87 -19.727 -11.802  -7.440
    5   HG11  VAL  87          HG12      VAL  87 -21.158 -12.033  -8.445
    6   HG13  VAL  87          HG13      VAL  87 -19.700 -12.975  -8.755
    7   HG23  VAL  87          HG21      VAL  87 -19.499 -12.942  -5.472
    8   HG22  VAL  87          HG22      VAL  87 -18.873 -14.291  -6.417
    9   HG21  VAL  87          HG23      VAL  87 -20.145 -14.563  -5.227

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ASP  88           H        ASP  88 -24.634 -12.852  -5.916
    2    HA   ASP  88           HA       ASP  88 -25.655 -14.138  -8.321
    3    HB2  ASP  88           HB2      ASP  88 -26.680 -14.411  -6.013
    4    HB3  ASP  88           HB3      ASP  88 -27.208 -12.733  -6.136

  No H/Q in entry =           4
  In of MODEL   30
    1    H    GLY  89           H        GLY  89 -24.980 -12.863  -9.961
    2    HA3  GLY  89           HA2      GLY  89 -25.286 -10.103 -10.189
    3    HA2  GLY  89           HA3      GLY  89 -25.186 -11.232 -11.540

  No H/Q in entry =           3
  In of MODEL   30
    1    H    LEU  90           H        LEU  90 -27.575 -12.692 -11.122
    2    HA   LEU  90           HA       LEU  90 -29.454 -10.852 -12.283
    3    HB2  LEU  90           HB2      LEU  90 -29.397 -13.254 -12.844
    4    HB3  LEU  90           HB3      LEU  90 -29.915 -13.630 -11.200
    5    HG   LEU  90           HG       LEU  90 -32.076 -12.615 -11.610
    6   HD13  LEU  90          HD11      LEU  90 -31.952 -10.880 -13.096
    7   HD12  LEU  90          HD12      LEU  90 -32.413 -12.150 -14.232
    8   HD11  LEU  90          HD13      LEU  90 -30.722 -11.674 -14.082
    9   HD23  LEU  90          HD21      LEU  90 -31.888 -14.259 -14.029
   10   HD22  LEU  90          HD22      LEU  90 -32.885 -14.458 -12.587
   11   HD21  LEU  90          HD23      LEU  90 -31.204 -14.994 -12.578

  No H/Q in entry =          11
  In of MODEL   30
    1    H    GLY  91           H        GLY  91 -29.271 -12.318  -9.084
    2    HA3  GLY  91           HA2      GLY  91 -31.678 -11.308  -8.094
    3    HA2  GLY  91           HA3      GLY  91 -30.279 -11.768  -7.123

  No H/Q in entry =           3
  In of MODEL   30
    1    H    VAL  92           H        VAL  92 -28.433  -9.860  -7.963
    2    HA   VAL  92           HA       VAL  92 -29.358  -7.586  -6.448
    3    HB   VAL  92           HB       VAL  92 -26.765  -7.950  -7.996
    4   HG12  VAL  92          HG11      VAL  92 -27.058  -6.055  -5.689
    5   HG11  VAL  92          HG12      VAL  92 -27.721  -5.555  -7.248
    6   HG13  VAL  92          HG13      VAL  92 -26.007  -5.943  -7.102
    7   HG22  VAL  92          HG21      VAL  92 -26.496  -9.511  -6.386
    8   HG21  VAL  92          HG22      VAL  92 -27.695  -8.777  -5.320
    9   HG23  VAL  92          HG23      VAL  92 -26.069  -8.100  -5.418

  No H/Q in entry =           9
  In of MODEL   30
    1    H    LEU  93           H        LEU  93 -28.861  -8.256  -9.855
    2    HA   LEU  93           HA       LEU  93 -29.313  -5.648 -10.814
    3    HB2  LEU  93           HB2      LEU  93 -28.559  -7.481 -12.248
    4    HB3  LEU  93           HB3      LEU  93 -30.119  -8.281 -12.046
    5    HG   LEU  93           HG       LEU  93 -31.202  -6.376 -13.204
    6   HD11  LEU  93          HD11      LEU  93 -29.436  -4.693 -12.683
    7   HD13  LEU  93          HD12      LEU  93 -29.844  -4.757 -14.398
    8   HD12  LEU  93          HD13      LEU  93 -28.365  -5.518 -13.815
    9   HD23  LEU  93          HD21      LEU  93 -30.098  -6.913 -15.468
   10   HD22  LEU  93          HD22      LEU  93 -30.896  -8.201 -14.566
   11   HD21  LEU  93          HD23      LEU  93 -29.136  -8.062 -14.538

  No H/Q in entry =          11
  In of MODEL   30
    1    H    LYS  94           H        LYS  94 -31.581  -8.295  -9.982
    2    HA   LYS  94           HA       LYS  94 -33.979  -6.970 -10.659
    3    HB2  LYS  94           HB2      LYS  94 -33.398  -9.112  -8.620
    4    HB3  LYS  94           HB3      LYS  94 -35.021  -8.495  -8.920
    5    HG2  LYS  94           HG2      LYS  94 -34.858  -9.283 -11.245
    6    HG3  LYS  94           HG3      LYS  94 -33.270  -9.958 -10.885
    7    HD2  LYS  94           HD2      LYS  94 -34.358 -11.328  -9.067
    8    HD3  LYS  94           HD3      LYS  94 -35.920 -10.759  -9.654
    9    HE2  LYS  94           HE2      LYS  94 -35.323 -11.681 -11.903
   10    HE3  LYS  94           HE3      LYS  94 -33.886 -12.391 -11.170
   11    HZ3  LYS  94           HZ1      LYS  94 -35.659 -13.999 -11.357
   12    HZ2  LYS  94           HZ2      LYS  94 -36.695 -13.012 -10.441
   13    HZ1  LYS  94           HZ3      LYS  94 -35.314 -13.691  -9.723

  No H/Q in entry =          13
  In of MODEL   30
    1    H    ALA  95           H        ALA  95 -32.204  -6.980  -7.579
    2    HA   ALA  95           HA       ALA  95 -34.151  -5.477  -6.145
    3    HB2  ALA  95           HB1      ALA  95 -31.723  -6.735  -5.556
    4    HB3  ALA  95           HB2      ALA  95 -32.763  -5.867  -4.427
    5    HB1  ALA  95           HB3      ALA  95 -31.439  -5.024  -5.233

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA  96           H        ALA  96 -31.516  -4.517  -8.205
    2    HA   ALA  96           HA       ALA  96 -31.561  -1.749  -7.454
    3    HB2  ALA  96           HB1      ALA  96 -30.176  -1.475  -9.542
    4    HB3  ALA  96           HB2      ALA  96 -30.394  -3.198  -9.851
    5    HB1  ALA  96           HB3      ALA  96 -29.527  -2.665  -8.412

  No H/Q in entry =           5
  In of MODEL   30
    1    H    VAL  97           H        VAL  97 -32.966  -3.553 -10.151
    2    HA   VAL  97           HA       VAL  97 -34.119  -1.315 -11.444
    3    HB   VAL  97           HB       VAL  97 -34.792  -4.275 -11.475
    4   HG11  VAL  97          HG11      VAL  97 -36.666  -2.358 -12.007
    5   HG13  VAL  97          HG12      VAL  97 -36.639  -3.957 -12.751
    6   HG12  VAL  97          HG13      VAL  97 -35.934  -2.581 -13.597
    7   HG21  VAL  97          HG21      VAL  97 -33.563  -2.406 -13.504
    8   HG23  VAL  97          HG22      VAL  97 -33.934  -4.108 -13.786
    9   HG22  VAL  97          HG23      VAL  97 -32.725  -3.655 -12.583

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ALA  98           H        ALA  98 -35.245  -3.527  -8.909
    2    HA   ALA  98           HA       ALA  98 -37.860  -2.493  -8.611
    3    HB1  ALA  98           HB1      ALA  98 -36.766  -4.636  -7.542
    4    HB3  ALA  98           HB2      ALA  98 -38.003  -3.759  -6.638
    5    HB2  ALA  98           HB3      ALA  98 -36.297  -3.529  -6.252

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA  99           H        ALA  99 -34.849  -1.544  -6.919
    2    HA   ALA  99           HA       ALA  99 -36.094   0.400  -5.293
    3    HB1  ALA  99           HB1      ALA  99 -33.396  -0.375  -5.988
    4    HB2  ALA  99           HB2      ALA  99 -34.005   0.361  -4.506
    5    HB3  ALA  99           HB3      ALA  99 -33.552   1.378  -5.873

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ILE 100           H        ILE 100 -35.004   0.552  -8.632
    2    HA   ILE 100           HA       ILE 100 -35.305   3.388  -8.876
    3    HB   ILE 100           HB       ILE 100 -35.268   1.217 -11.000
    4   HG12  ILE 100          HG12      ILE 100 -33.207   3.307 -10.308
    5   HG13  ILE 100          HG13      ILE 100 -33.180   1.665  -9.666
    6   HG21  ILE 100          HG21      ILE 100 -35.817   4.113 -11.161
    7   HG23  ILE 100          HG22      ILE 100 -36.248   2.815 -12.275
    8   HG22  ILE 100          HG23      ILE 100 -34.624   3.504 -12.307
    9   HD12  ILE 100          HD11      ILE 100 -32.644   2.624 -12.438
   10   HD11  ILE 100          HD12      ILE 100 -33.237   0.984 -12.181
   11   HD13  ILE 100          HD13      ILE 100 -31.724   1.501 -11.440

  No H/Q in entry =          11
  In of MODEL   30
    1    H    LYS 101           H        LYS 101 -37.468   0.675  -9.620
    2    HA   LYS 101           HA       LYS 101 -39.603   2.224 -10.667
    3    HB2  LYS 101           HB2      LYS 101 -39.384  -0.534  -9.516
    4    HB3  LYS 101           HB3      LYS 101 -40.962   0.156  -9.893
    5    HG2  LYS 101           HG2      LYS 101 -40.456   0.295 -12.184
    6    HG3  LYS 101           HG3      LYS 101 -38.748  -0.034 -11.898
    7    HD2  LYS 101           HD2      LYS 101 -39.897  -2.001 -12.789
    8    HD3  LYS 101           HD3      LYS 101 -39.284  -2.292 -11.161
    9    HE2  LYS 101           HE2      LYS 101 -41.323  -3.073 -10.685
   10    HE3  LYS 101           HE3      LYS 101 -41.854  -1.391 -10.708
   11    HZ3  LYS 101           HZ1      LYS 101 -42.701  -1.602 -12.839
   12    HZ2  LYS 101           HZ2      LYS 101 -43.109  -3.089 -12.128
   13    HZ1  LYS 101           HZ3      LYS 101 -41.788  -2.991 -13.189

  No H/Q in entry =          13
  In of MODEL   30
    1    H    LYS 102           H        LYS 102 -39.101   0.792  -7.440
    2    HA   LYS 102           HA       LYS 102 -41.419   1.896  -6.289
    3    HB2  LYS 102           HB2      LYS 102 -40.119   0.092  -5.239
    4    HB3  LYS 102           HB3      LYS 102 -38.781   1.209  -4.980
    5    HG2  LYS 102           HG2      LYS 102 -40.183   2.554  -3.516
    6    HG3  LYS 102           HG3      LYS 102 -41.525   1.442  -3.777
    7    HD2  LYS 102           HD2      LYS 102 -40.236  -0.362  -2.717
    8    HD3  LYS 102           HD3      LYS 102 -38.895   0.753  -2.453
    9    HE2  LYS 102           HE2      LYS 102 -40.336   2.179  -1.079
   10    HE3  LYS 102           HE3      LYS 102 -41.697   1.095  -1.364
   11    HZ1  LYS 102           HZ1      LYS 102 -39.918  -0.576  -0.318
   12    HZ3  LYS 102           HZ2      LYS 102 -41.082   0.265   0.586
   13    HZ2  LYS 102           HZ3      LYS 102 -39.494   0.860   0.483

  No H/Q in entry =          13
  In of MODEL   30
    1    H    ALA 103           H        ALA 103 -38.512   3.408  -7.262
    2    HA   ALA 103           HA       ALA 103 -38.867   5.723  -5.501
    3    HB2  ALA 103           HB1      ALA 103 -36.883   6.533  -7.048
    4    HB3  ALA 103           HB2      ALA 103 -36.765   4.817  -7.433
    5    HB1  ALA 103           HB3      ALA 103 -36.591   5.360  -5.765

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA 104           H        ALA 104 -39.397   4.943  -8.851
    2    HA   ALA 104           HA       ALA 104 -40.093   7.695  -9.504
    3    HB2  ALA 104           HB1      ALA 104 -40.068   7.012 -11.702
    4    HB1  ALA 104           HB2      ALA 104 -40.733   5.422 -11.325
    5    HB3  ALA 104           HB3      ALA 104 -39.029   5.762 -11.018

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA 105           H        ALA 105 -41.639   5.533  -7.712
    2    HA   ALA 105           HA       ALA 105 -44.122   6.820  -7.737
    3    HB2  ALA 105           HB1      ALA 105 -44.793   5.914  -9.781
    4    HB3  ALA 105           HB2      ALA 105 -45.396   4.707  -8.647
    5    HB1  ALA 105           HB3      ALA 105 -43.898   4.417  -9.528

  No H/Q in entry =           5
  In of MODEL   31
    1    H1   ALA   1           H3       ALA   1 -12.012 -16.196  -2.436
    2    H2   ALA   1           H2       ALA   1 -11.048 -17.324  -3.270
    3    H3   ALA   1           H1       ALA   1 -12.206 -16.403  -4.109
    4    HA   ALA   1           HA       ALA   1 -13.575 -18.127  -3.868
    5    HB3  ALA   1           HB1      ALA   1 -12.148 -19.872  -3.397
    6    HB1  ALA   1           HB2      ALA   1 -12.910 -19.768  -1.810
    7    HB2  ALA   1           HB3      ALA   1 -11.347 -19.000  -2.089

  No H/Q in entry =           7
  In of MODEL   31
    1    H    GLU   2           H        GLU   2 -15.186 -19.006  -2.215
    2    HA   GLU   2           HA       GLU   2 -16.868 -17.312  -1.166
    3    HB2  GLU   2           HB2      GLU   2 -15.889 -19.715   0.389
    4    HB3  GLU   2           HB3      GLU   2 -17.428 -18.892   0.637
    5    HG2  GLU   2           HG2      GLU   2 -18.384 -20.001  -1.097
    6    HG3  GLU   2           HG3      GLU   2 -17.066 -19.580  -2.179

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLU   3           H        GLU   3 -14.938 -18.622   1.467
    2    HA   GLU   3           HA       GLU   3 -15.206 -16.268   3.016
    3    HB2  GLU   3           HB2      GLU   3 -13.575 -18.785   3.278
    4    HB3  GLU   3           HB3      GLU   3 -13.371 -17.458   4.422
    5    HG2  GLU   3           HG2      GLU   3 -15.563 -17.647   5.235
    6    HG3  GLU   3           HG3      GLU   3 -16.140 -18.462   3.787

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LEU   4           H        LEU   4 -12.221 -17.698   1.637
    2    HA   LEU   4           HA       LEU   4 -10.423 -15.760   2.234
    3    HB2  LEU   4           HB2      LEU   4 -10.623 -17.070  -0.487
    4    HB3  LEU   4           HB3      LEU   4  -9.186 -16.322   0.199
    5    HG   LEU   4           HG       LEU   4 -10.640 -18.742   1.315
    6   HD13  LEU   4          HD11      LEU   4  -8.981 -20.071   0.395
    7   HD12  LEU   4          HD12      LEU   4  -7.794 -18.767   0.367
    8   HD11  LEU   4          HD13      LEU   4  -9.079 -18.816  -0.839
    9   HD23  LEU   4          HD21      LEU   4  -8.392 -18.761   2.703
   10   HD22  LEU   4          HD22      LEU   4  -9.732 -17.743   3.225
   11   HD21  LEU   4          HD23      LEU   4  -8.380 -17.033   2.344

  No H/Q in entry =          11
  In of MODEL   31
    1    H    GLU   5           H        GLU   5 -12.754 -15.604  -0.447
    2    HA   GLU   5           HA       GLU   5 -11.793 -13.106  -1.453
    3    HB2  GLU   5           HB2      GLU   5 -13.105 -14.716  -2.817
    4    HB3  GLU   5           HB3      GLU   5 -14.514 -14.384  -1.809
    5    HG2  GLU   5           HG2      GLU   5 -14.439 -12.015  -2.451
    6    HG3  GLU   5           HG3      GLU   5 -13.003 -12.316  -3.430

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLU   6           H        GLU   6 -14.507 -14.026   0.635
    2    HA   GLU   6           HA       GLU   6 -15.460 -11.365   1.023
    3    HB2  GLU   6           HB2      GLU   6 -15.827 -13.879   2.670
    4    HB3  GLU   6           HB3      GLU   6 -16.699 -12.371   2.943
    5    HG2  GLU   6           HG2      GLU   6 -16.702 -13.757   0.260
    6    HG3  GLU   6           HG3      GLU   6 -17.889 -14.132   1.506

  No H/Q in entry =           6
  In of MODEL   31
    1    H    VAL   7           H        VAL   7 -13.120 -13.429   2.608
    2    HA   VAL   7           HA       VAL   7 -12.688 -11.838   4.931
    3    HB   VAL   7           HB       VAL   7 -10.945 -13.856   3.493
    4   HG11  VAL   7          HG11      VAL   7 -10.511 -12.307   6.053
    5   HG13  VAL   7          HG12      VAL   7  -9.403 -12.506   4.696
    6   HG12  VAL   7          HG13      VAL   7  -9.735 -13.865   5.769
    7   HG21  VAL   7          HG21      VAL   7 -13.188 -14.456   4.708
    8   HG23  VAL   7          HG22      VAL   7 -12.270 -14.161   6.185
    9   HG22  VAL   7          HG23      VAL   7 -11.752 -15.416   5.061

  No H/Q in entry =           9
  In of MODEL   31
    1    H    VAL   8           H        VAL   8 -11.166 -11.936   1.726
    2    HA   VAL   8           HA       VAL   8  -9.138 -10.026   2.218
    3    HB   VAL   8           HB       VAL   8 -10.582 -10.752  -0.342
    4   HG12  VAL   8          HG11      VAL   8  -8.399  -9.712  -1.321
    5   HG11  VAL   8          HG12      VAL   8  -8.284  -8.885   0.233
    6   HG13  VAL   8          HG13      VAL   8  -9.689  -8.626  -0.802
    7   HG22  VAL   8          HG21      VAL   8  -9.011 -12.426  -0.598
    8   HG21  VAL   8          HG22      VAL   8  -8.881 -12.296   1.153
    9   HG23  VAL   8          HG23      VAL   8  -7.722 -11.462   0.125

  No H/Q in entry =           9
  In of MODEL   31
    1    H    MET   9           H        MET   9 -12.487  -9.699   1.048
    2    HA   MET   9           HA       MET   9 -12.472  -6.923   0.604
    3    HB2  MET   9           HB2      MET   9 -14.626  -8.880   1.364
    4    HB3  MET   9           HB3      MET   9 -14.976  -7.152   1.286
    5    HG2  MET   9           HG2      MET   9 -13.890  -7.222  -1.050
    6    HG3  MET   9           HG3      MET   9 -14.053  -8.974  -0.934
    7    HE1  MET   9           HE1      MET   9 -16.017 -10.284  -0.855
    8    HE3  MET   9           HE2      MET   9 -17.697  -9.757  -0.873
    9    HE2  MET   9           HE3      MET   9 -16.735  -9.551   0.587

  No H/Q in entry =           9
  In of MODEL   31
    1    H    GLY  10           H        GLY  10 -13.109  -8.816   3.536
    2    HA3  GLY  10           HA2      GLY  10 -13.701  -6.637   5.246
    3    HA2  GLY  10           HA3      GLY  10 -13.110  -8.213   5.767

  No H/Q in entry =           3
  In of MODEL   31
    1    H    LEU  11           H        LEU  11 -10.659  -8.297   4.459
    2    HA   LEU  11           HA       LEU  11  -8.990  -6.828   6.216
    3    HB2  LEU  11           HB2      LEU  11  -8.410  -8.249   3.615
    4    HB3  LEU  11           HB3      LEU  11  -7.155  -7.519   4.614
    5    HG   LEU  11           HG       LEU  11  -9.123  -9.585   5.632
    6   HD13  LEU  11          HD11      LEU  11  -7.875 -10.804   4.075
    7   HD12  LEU  11          HD12      LEU  11  -6.939 -11.021   5.554
    8   HD11  LEU  11          HD13      LEU  11  -6.417  -9.850   4.344
    9   HD22  LEU  11          HD21      LEU  11  -8.294  -8.550   7.548
   10   HD21  LEU  11          HD22      LEU  11  -6.762  -8.123   6.788
   11   HD23  LEU  11          HD23      LEU  11  -7.058  -9.783   7.302

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  12           H        ILE  12  -9.892  -6.308   2.822
    2    HA   ILE  12           HA       ILE  12  -8.240  -4.049   2.393
    3    HB   ILE  12           HB       ILE  12 -10.862  -4.825   1.093
    4   HG12  ILE  12          HG12      ILE  12  -8.770  -6.363   0.971
    5   HG13  ILE  12          HG13      ILE  12  -9.585  -5.968  -0.528
    6   HG21  ILE  12          HG21      ILE  12  -8.771  -2.780   0.280
    7   HG23  ILE  12          HG22      ILE  12 -10.453  -2.459   0.681
    8   HG22  ILE  12          HG23      ILE  12 -10.043  -3.355  -0.753
    9   HD13  ILE  12          HD11      ILE  12  -7.903  -4.273  -1.012
   10   HD12  ILE  12          HD12      ILE  12  -7.103  -5.806  -0.671
   11   HD11  ILE  12          HD13      ILE  12  -7.139  -4.548   0.542

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  13           H        ILE  13 -11.599  -4.375   3.477
    2    HA   ILE  13           HA       ILE  13 -12.112  -1.596   3.736
    3    HB   ILE  13           HB       ILE  13 -13.275  -4.035   5.101
    4   HG12  ILE  13          HG12      ILE  13 -13.500  -3.480   2.558
    5   HG13  ILE  13          HG13      ILE  13 -14.908  -3.998   3.459
    6   HG22  ILE  13          HG21      ILE  13 -15.217  -2.357   5.578
    7   HG21  ILE  13          HG22      ILE  13 -13.981  -1.117   5.419
    8   HG23  ILE  13          HG23      ILE  13 -13.825  -2.360   6.657
    9   HD13  ILE  13          HD11      ILE  13 -15.693  -1.718   3.689
   10   HD12  ILE  13          HD12      ILE  13 -15.319  -2.015   2.003
   11   HD11  ILE  13          HD13      ILE  13 -14.193  -1.104   2.986

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ASN  14           H        ASN  14 -10.960  -4.058   6.023
    2    HA   ASN  14           HA       ASN  14 -10.798  -2.408   8.303
    3    HB2  ASN  14           HB2      ASN  14 -10.494  -5.012   7.991
    4    HB3  ASN  14           HB3      ASN  14  -8.792  -4.592   7.837
    5   HD21  ASN  14          HD21      ASN  14  -9.405  -6.121  10.017
    6   HD22  ASN  14          HD22      ASN  14  -9.400  -5.196  11.438

  No H/Q in entry =           6
  In of MODEL   31
    1    H    SER  15           H        SER  15  -8.373  -3.193   5.821
    2    HA   SER  15           HA       SER  15  -6.262  -1.656   6.895
    3    HB2  SER  15           HB2      SER  15  -5.232  -1.856   4.739
    4    HB3  SER  15           HB3      SER  15  -6.155  -3.336   4.969
    5    HG   SER  15           HG       SER  15  -7.108  -2.798   3.187

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLY  16           H        GLY  16  -8.873  -0.848   4.637
    2    HA3  GLY  16           HA2      GLY  16  -8.066   1.808   4.079
    3    HA2  GLY  16           HA3      GLY  16  -9.704   1.179   3.914

  No H/Q in entry =           3
  In of MODEL   31
    1    H    GLN  17           H        GLN  17 -10.240   0.453   6.565
    2    HA   GLN  17           HA       GLN  17 -11.002   2.946   7.695
    3    HB2  GLN  17           HB2      GLN  17 -10.850   0.170   8.883
    4    HB3  GLN  17           HB3      GLN  17 -11.505   1.560   9.749
    5    HG2  GLN  17           HG2      GLN  17 -12.501   0.619   7.045
    6    HG3  GLN  17           HG3      GLN  17 -13.259   0.198   8.579
    7   HE21  GLN  17          HE21      GLN  17 -14.518   1.823   9.656
    8   HE22  GLN  17          HE22      GLN  17 -14.837   3.338   8.960

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ALA  18           H        ALA  18  -8.329   0.721   8.330
    2    HA   ALA  18           HA       ALA  18  -7.263   1.967  10.600
    3    HB2  ALA  18           HB1      ALA  18  -6.604  -0.241   9.242
    4    HB3  ALA  18           HB2      ALA  18  -5.461   0.570  10.313
    5    HB1  ALA  18           HB3      ALA  18  -5.384   0.844   8.572

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ARG  19           H        ARG  19  -6.492   2.495   7.151
    2    HA   ARG  19           HA       ARG  19  -4.638   4.582   7.579
    3    HB2  ARG  19           HB2      ARG  19  -4.935   3.428   5.386
    4    HB3  ARG  19           HB3      ARG  19  -6.494   4.235   5.202
    5    HG2  ARG  19           HG2      ARG  19  -5.411   6.430   5.266
    6    HG3  ARG  19           HG3      ARG  19  -3.847   5.678   5.578
    7    HD2  ARG  19           HD2      ARG  19  -3.977   6.258   3.232
    8    HD3  ARG  19           HD3      ARG  19  -4.026   4.497   3.383
    9    HE   ARG  19           HE       ARG  19  -6.678   5.350   3.365
   10   HH21  ARG  19          HH11      ARG  19  -7.870   5.475   1.442
   11   HH22  ARG  19          HH12      ARG  19  -7.045   5.564  -0.075
   12   HH11  ARG  19          HH21      ARG  19  -3.898   5.465   1.339
   13   HH12  ARG  19          HH22      ARG  19  -4.795   5.556  -0.133

  No H/Q in entry =          13
  In of MODEL   31
    1    H    SER  20           H        SER  20  -8.136   4.621   6.967
    2    HA   SER  20           HA       SER  20  -8.552   7.369   6.908
    3    HB2  SER  20           HB2      SER  20 -10.400   5.991   6.370
    4    HB3  SER  20           HB3      SER  20 -10.275   5.099   7.884
    5    HG   SER  20           HG       SER  20 -10.781   7.119   8.938

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU  21           H        LEU  21  -8.514   5.196   9.720
    2    HA   LEU  21           HA       LEU  21  -9.004   7.189  11.676
    3    HB2  LEU  21           HB2      LEU  21  -7.593   4.520  11.852
    4    HB3  LEU  21           HB3      LEU  21  -7.933   5.534  13.250
    5    HG   LEU  21           HG       LEU  21 -10.074   4.591  11.322
    6   HD12  LEU  21          HD11      LEU  21 -10.610   3.076  13.393
    7   HD11  LEU  21          HD12      LEU  21  -8.909   3.322  13.786
    8   HD13  LEU  21          HD13      LEU  21  -9.360   2.571  12.255
    9   HD22  LEU  21          HD21      LEU  21 -10.999   6.396  12.499
   10   HD21  LEU  21          HD22      LEU  21 -10.065   6.075  13.955
   11   HD23  LEU  21          HD23      LEU  21 -11.437   5.054  13.551

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ALA  22           H        ALA  22  -6.018   5.876  10.283
    2    HA   ALA  22           HA       ALA  22  -4.173   7.236  11.907
    3    HB2  ALA  22           HB1      ALA  22  -3.711   5.385  10.224
    4    HB1  ALA  22           HB2      ALA  22  -2.544   6.707  10.258
    5    HB3  ALA  22           HB3      ALA  22  -3.756   6.632   8.978

  No H/Q in entry =           5
  In of MODEL   31
    1    H    TYR  23           H        TYR  23  -5.501   8.212   8.716
    2    HA   TYR  23           HA       TYR  23  -4.220  10.736   8.641
    3    HB2  TYR  23           HB2      TYR  23  -5.273   9.795   6.649
    4    HB3  TYR  23           HB3      TYR  23  -6.856   9.868   7.424
    5    HD1  TYR  23           HD1      TYR  23  -3.998  11.973   6.273
    6    HD2  TYR  23           HD2      TYR  23  -8.141  11.850   7.399
    7    HE1  TYR  23           HE1      TYR  23  -4.275  14.315   5.505
    8    HE2  TYR  23           HE2      TYR  23  -8.418  14.192   6.629
    9    HH   TYR  23           HH       TYR  23  -5.898  16.254   6.072

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ALA  24           H        ALA  24  -7.322   9.696  10.013
    2    HA   ALA  24           HA       ALA  24  -8.218  12.269  10.772
    3    HB1  ALA  24           HB1      ALA  24 -10.010  10.980  11.238
    4    HB2  ALA  24           HB2      ALA  24  -9.177  10.432  12.691
    5    HB3  ALA  24           HB3      ALA  24  -9.026   9.518  11.191

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA  25           H        ALA  25  -6.168   9.861  12.362
    2    HA   ALA  25           HA       ALA  25  -5.867  11.130  14.861
    3    HB2  ALA  25           HB1      ALA  25  -5.045   8.793  14.051
    4    HB3  ALA  25           HB2      ALA  25  -4.053   9.677  15.212
    5    HB1  ALA  25           HB3      ALA  25  -3.611   9.663  13.505

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU  26           H        LEU  26  -4.072  11.457  11.825
    2    HA   LEU  26           HA       LEU  26  -2.157  13.323  12.742
    3    HB2  LEU  26           HB2      LEU  26  -1.823  12.171  10.643
    4    HB3  LEU  26           HB3      LEU  26  -3.309  12.844   9.981
    5    HG   LEU  26           HG       LEU  26  -2.344  15.116  10.111
    6   HD12  LEU  26          HD11      LEU  26   0.192  15.193  10.534
    7   HD11  LEU  26          HD12      LEU  26   0.000  13.611  11.284
    8   HD13  LEU  26          HD13      LEU  26  -0.841  15.010  11.952
    9   HD21  LEU  26          HD21      LEU  26  -0.552  13.095   8.730
   10   HD23  LEU  26          HD22      LEU  26  -0.631  14.814   8.353
   11   HD22  LEU  26          HD23      LEU  26  -2.031  13.785   8.064

  No H/Q in entry =          11
  In of MODEL   31
    1    H    LYS  27           H        LYS  27  -5.344  13.731  11.252
    2    HA   LYS  27           HA       LYS  27  -5.348  16.519  11.043
    3    HB2  LYS  27           HB2      LYS  27  -7.056  15.001  10.057
    4    HB3  LYS  27           HB3      LYS  27  -7.713  14.736  11.672
    5    HG2  LYS  27           HG2      LYS  27  -8.195  17.133  11.898
    6    HG3  LYS  27           HG3      LYS  27  -7.488  17.440  10.308
    7    HD2  LYS  27           HD2      LYS  27  -9.186  15.965   9.271
    8    HD3  LYS  27           HD3      LYS  27  -9.899  15.675  10.859
    9    HE2  LYS  27           HE2      LYS  27 -10.394  18.077  11.092
   10    HE3  LYS  27           HE3      LYS  27  -9.653  18.389   9.519
   11    HZ3  LYS  27           HZ1      LYS  27 -12.027  18.212   9.269
   12    HZ2  LYS  27           HZ2      LYS  27 -12.045  16.698  10.044
   13    HZ1  LYS  27           HZ3      LYS  27 -11.298  16.872   8.525

  No H/Q in entry =          13
  In of MODEL   31
    1    H    GLN  28           H        GLN  28  -6.202  14.425  13.775
    2    HA   GLN  28           HA       GLN  28  -7.146  16.415  15.541
    3    HB2  GLN  28           HB2      GLN  28  -5.690  13.817  16.098
    4    HB3  GLN  28           HB3      GLN  28  -6.457  14.809  17.339
    5    HG2  GLN  28           HG2      GLN  28  -7.882  13.642  14.931
    6    HG3  GLN  28           HG3      GLN  28  -7.938  12.968  16.559
    7   HE21  GLN  28          HE21      GLN  28  -9.770  14.796  14.529
    8   HE22  GLN  28          HE22      GLN  28 -10.572  15.777  15.658

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ALA  29           H        ALA  29  -3.898  15.184  14.867
    2    HA   ALA  29           HA       ALA  29  -2.496  16.618  16.845
    3    HB1  ALA  29           HB1      ALA  29  -0.547  15.963  15.735
    4    HB3  ALA  29           HB2      ALA  29  -1.299  16.066  14.143
    5    HB2  ALA  29           HB3      ALA  29  -1.697  14.729  15.221

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LYS  30           H        LYS  30  -3.360  17.468  13.509
    2    HA   LYS  30           HA       LYS  30  -1.997  19.935  13.405
    3    HB2  LYS  30           HB2      LYS  30  -4.506  19.007  11.991
    4    HB3  LYS  30           HB3      LYS  30  -3.700  20.537  11.644
    5    HG2  LYS  30           HG2      LYS  30  -1.604  19.281  11.142
    6    HG3  LYS  30           HG3      LYS  30  -2.483  17.769  11.389
    7    HD2  LYS  30           HD2      LYS  30  -4.053  18.374   9.588
    8    HD3  LYS  30           HD3      LYS  30  -3.197  19.897   9.342
    9    HE2  LYS  30           HE2      LYS  30  -1.139  18.641   8.774
   10    HE3  LYS  30           HE3      LYS  30  -2.014  17.122   8.988
   11    HZ2  LYS  30           HZ1      LYS  30  -1.846  17.988   6.644
   12    HZ1  LYS  30           HZ2      LYS  30  -2.914  19.233   7.104
   13    HZ3  LYS  30           HZ3      LYS  30  -3.409  17.606   7.179

  No H/Q in entry =          13
  In of MODEL   31
    1    H    GLN  31           H        GLN  31  -5.085  19.031  14.810
    2    HA   GLN  31           HA       GLN  31  -5.900  21.775  15.250
    3    HB2  GLN  31           HB2      GLN  31  -7.039  19.312  16.578
    4    HB3  GLN  31           HB3      GLN  31  -7.826  20.869  16.325
    5    HG2  GLN  31           HG2      GLN  31  -7.094  20.096  13.740
    6    HG3  GLN  31           HG3      GLN  31  -7.594  18.585  14.490
    7   HE21  GLN  31          HE21      GLN  31  -9.026  20.127  12.379
    8   HE22  GLN  31          HE22      GLN  31 -10.548  20.494  13.031

  No H/Q in entry =           8
  In of MODEL   31
    1    H    GLY  32           H        GLY  32  -3.558  19.893  16.584
    2    HA3  GLY  32           HA2      GLY  32  -2.171  20.385  18.389
    3    HA2  GLY  32           HA3      GLY  32  -3.323  21.610  18.905

  No H/Q in entry =           3
  In of MODEL   31
    1    H    ASP  33           H        ASP  33  -4.691  18.544  18.249
    2    HA   ASP  33           HA       ASP  33  -5.102  18.089  21.129
    3    HB2  ASP  33           HB2      ASP  33  -6.484  17.045  18.651
    4    HB3  ASP  33           HB3      ASP  33  -6.823  16.434  20.268

  No H/Q in entry =           4
  In of MODEL   31
    1    H    PHE  34           H        PHE  34  -2.920  17.276  21.444
    2    HA   PHE  34           HA       PHE  34  -1.877  15.040  20.053
    3    HB2  PHE  34           HB2      PHE  34  -1.286  16.044  22.846
    4    HB3  PHE  34           HB3      PHE  34  -0.334  14.834  21.985
    5    HD1  PHE  34           HD1      PHE  34  -0.567  18.259  22.709
    6    HD2  PHE  34           HD2      PHE  34   0.319  15.560  19.485
    7    HE1  PHE  34           HE1      PHE  34   0.701  20.048  21.553
    8    HE2  PHE  34           HE2      PHE  34   1.582  17.353  18.334
    9    HZ   PHE  34           HZ       PHE  34   1.776  19.594  19.373

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ALA  35           H        ALA  35  -3.930  15.291  22.909
    2    HA   ALA  35           HA       ALA  35  -3.675  12.636  23.814
    3    HB3  ALA  35           HB1      ALA  35  -6.146  13.222  24.663
    4    HB1  ALA  35           HB2      ALA  35  -5.639  14.848  24.203
    5    HB2  ALA  35           HB3      ALA  35  -4.713  13.944  25.400

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA  36           H        ALA  36  -6.145  14.104  21.703
    2    HA   ALA  36           HA       ALA  36  -7.517  11.667  21.228
    3    HB1  ALA  36           HB1      ALA  36  -8.994  13.062  20.264
    4    HB3  ALA  36           HB2      ALA  36  -7.825  13.499  19.017
    5    HB2  ALA  36           HB3      ALA  36  -7.870  14.390  20.538

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA  37           H        ALA  37  -4.859  13.295  19.563
    2    HA   ALA  37           HA       ALA  37  -4.790  11.654  17.271
    3    HB3  ALA  37           HB1      ALA  37  -2.831  13.403  18.694
    4    HB2  ALA  37           HB2      ALA  37  -3.357  13.445  17.012
    5    HB1  ALA  37           HB3      ALA  37  -2.185  12.237  17.540

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LYS  38           H        LYS  38  -3.037  11.387  20.355
    2    HA   LYS  38           HA       LYS  38  -1.669   9.009  19.877
    3    HB2  LYS  38           HB2      LYS  38  -2.029  10.772  22.016
    4    HB3  LYS  38           HB3      LYS  38  -2.623   9.234  22.635
    5    HG2  LYS  38           HG2      LYS  38  -0.508   8.147  22.108
    6    HG3  LYS  38           HG3      LYS  38   0.078   9.601  21.292
    7    HD2  LYS  38           HD2      LYS  38   0.220  10.828  23.324
    8    HD3  LYS  38           HD3      LYS  38  -0.782   9.663  24.191
    9    HE2  LYS  38           HE2      LYS  38   1.577   9.389  24.818
   10    HE3  LYS  38           HE3      LYS  38   0.999   7.960  23.956
   11    HZ3  LYS  38           HZ1      LYS  38   2.298   8.396  22.178
   12    HZ2  LYS  38           HZ2      LYS  38   3.235   9.244  23.315
   13    HZ1  LYS  38           HZ3      LYS  38   2.144  10.082  22.317

  No H/Q in entry =          13
  In of MODEL   31
    1    H    ALA  39           H        ALA  39  -4.920   9.452  21.268
    2    HA   ALA  39           HA       ALA  39  -5.435   6.725  21.779
    3    HB3  ALA  39           HB1      ALA  39  -7.624   8.630  21.000
    4    HB2  ALA  39           HB2      ALA  39  -6.735   8.877  22.503
    5    HB1  ALA  39           HB3      ALA  39  -7.625   7.376  22.242

  No H/Q in entry =           5
  In of MODEL   31
    1    H    MET  40           H        MET  40  -6.046   8.719  18.925
    2    HA   MET  40           HA       MET  40  -7.484   6.758  17.466
    3    HB2  MET  40           HB2      MET  40  -5.913   9.178  16.559
    4    HB3  MET  40           HB3      MET  40  -6.920   8.198  15.489
    5    HG2  MET  40           HG2      MET  40  -7.983   9.437  18.040
    6    HG3  MET  40           HG3      MET  40  -8.050  10.266  16.487
    7    HE3  MET  40           HE1      MET  40 -10.599   8.596  14.420
    8    HE2  MET  40           HE2      MET  40  -8.849   8.743  14.277
    9    HE1  MET  40           HE3      MET  40  -9.792  10.094  14.904

  No H/Q in entry =           9
  In of MODEL   31
    1    H    MET  41           H        MET  41  -4.007   7.556  17.597
    2    HA   MET  41           HA       MET  41  -3.212   5.809  15.504
    3    HB2  MET  41           HB2      MET  41  -1.615   6.511  17.979
    4    HB3  MET  41           HB3      MET  41  -0.981   5.870  16.467
    5    HG2  MET  41           HG2      MET  41  -2.173   8.029  15.454
    6    HG3  MET  41           HG3      MET  41  -1.952   8.626  17.097
    7    HE2  MET  41           HE1      MET  41   1.001   6.580  17.473
    8    HE1  MET  41           HE2      MET  41   0.187   7.862  18.366
    9    HE3  MET  41           HE3      MET  41   1.808   8.133  17.727

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ASP  42           H        ASP  42  -3.599   5.339  18.990
    2    HA   ASP  42           HA       ASP  42  -2.517   2.765  19.161
    3    HB2  ASP  42           HB2      ASP  42  -3.428   4.514  20.975
    4    HB3  ASP  42           HB3      ASP  42  -4.836   3.463  20.902

  No H/Q in entry =           4
  In of MODEL   31
    1    H    GLN  43           H        GLN  43  -5.869   3.808  18.647
    2    HA   GLN  43           HA       GLN  43  -6.965   1.200  18.456
    3    HB2  GLN  43           HB2      GLN  43  -7.932   3.832  17.317
    4    HB3  GLN  43           HB3      GLN  43  -8.868   2.335  17.296
    5    HG2  GLN  43           HG2      GLN  43  -8.580   2.227  19.805
    6    HG3  GLN  43           HG3      GLN  43  -7.884   3.844  19.731
    7   HE21  GLN  43          HE21      GLN  43 -10.070   3.889  21.225
    8   HE22  GLN  43          HE22      GLN  43 -11.438   4.438  20.387

  No H/Q in entry =           8
  In of MODEL   31
    1    H    SER  44           H        SER  44  -5.657   3.430  16.042
    2    HA   SER  44           HA       SER  44  -6.324   1.927  13.755
    3    HB2  SER  44           HB2      SER  44  -5.112   4.334  14.196
    4    HB3  SER  44           HB3      SER  44  -3.739   3.361  13.673
    5    HG   SER  44           HG       SER  44  -4.863   4.308  11.904

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ARG  45           H        ARG  45  -3.452   1.872  15.845
    2    HA   ARG  45           HA       ARG  45  -1.933  -0.059  14.473
    3    HB2  ARG  45           HB2      ARG  45  -1.122   1.382  16.340
    4    HB3  ARG  45           HB3      ARG  45  -2.101   0.437  17.460
    5    HG2  ARG  45           HG2      ARG  45  -0.830  -1.601  16.827
    6    HG3  ARG  45           HG3      ARG  45   0.172  -0.631  15.749
    7    HD2  ARG  45           HD2      ARG  45   0.875   0.768  17.703
    8    HD3  ARG  45           HD3      ARG  45  -0.031  -0.320  18.777
    9    HE   ARG  45           HE       ARG  45   1.701  -1.890  17.206
   10   HH21  ARG  45          HH11      ARG  45   3.613  -2.676  18.052
   11   HH22  ARG  45          HH12      ARG  45   4.368  -1.873  19.383
   12   HH11  ARG  45          HH21      ARG  45   1.953   0.588  19.590
   13   HH12  ARG  45          HH22      ARG  45   3.427  -0.022  20.252

  No H/Q in entry =          13
  In of MODEL   31
    1    H    MET  46           H        MET  46  -4.332  -0.415  17.066
    2    HA   MET  46           HA       MET  46  -4.116  -3.210  17.381
    3    HB2  MET  46           HB2      MET  46  -6.318  -1.238  17.972
    4    HB3  MET  46           HB3      MET  46  -6.503  -2.961  18.309
    5    HG2  MET  46           HG2      MET  46  -4.516  -2.928  19.734
    6    HG3  MET  46           HG3      MET  46  -4.236  -1.237  19.349
    7    HE3  MET  46           HE1      MET  46  -7.833  -3.077  20.321
    8    HE2  MET  46           HE2      MET  46  -7.367  -3.164  22.017
    9    HE1  MET  46           HE3      MET  46  -6.336  -3.893  20.789

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ALA  47           H        ALA  47  -6.164  -1.235  15.275
    2    HA   ALA  47           HA       ALA  47  -7.742  -3.317  14.209
    3    HB3  ALA  47           HB1      ALA  47  -8.460  -1.092  13.785
    4    HB1  ALA  47           HB2      ALA  47  -7.954  -1.722  12.217
    5    HB2  ALA  47           HB3      ALA  47  -6.896  -0.632  13.114

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU  48           H        LEU  48  -4.643  -1.957  13.165
    2    HA   LEU  48           HA       LEU  48  -4.327  -3.549  10.829
    3    HB2  LEU  48           HB2      LEU  48  -2.298  -2.231  12.641
    4    HB3  LEU  48           HB3      LEU  48  -1.912  -2.949  11.077
    5    HG   LEU  48           HG       LEU  48  -3.973  -0.765  11.454
    6   HD13  LEU  48          HD11      LEU  48  -1.869   0.148  12.124
    7   HD12  LEU  48          HD12      LEU  48  -2.148   0.693  10.470
    8   HD11  LEU  48          HD13      LEU  48  -1.029  -0.634  10.786
    9   HD22  LEU  48          HD21      LEU  48  -4.421  -1.763   9.379
   10   HD21  LEU  48          HD22      LEU  48  -2.730  -2.170   9.091
   11   HD23  LEU  48          HD23      LEU  48  -3.277  -0.500   8.925

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ASN  49           H        ASN  49  -3.287  -3.919  14.180
    2    HA   ASN  49           HA       ASN  49  -1.646  -6.157  13.861
    3    HB2  ASN  49           HB2      ASN  49  -1.704  -4.815  15.904
    4    HB3  ASN  49           HB3      ASN  49  -3.353  -5.331  16.226
    5   HD21  ASN  49          HD21      ASN  49  -1.412  -5.818  18.163
    6   HD22  ASN  49          HD22      ASN  49  -1.073  -7.479  18.232

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLU  50           H        GLU  50  -5.121  -5.936  14.520
    2    HA   GLU  50           HA       GLU  50  -5.589  -8.743  14.634
    3    HB2  GLU  50           HB2      GLU  50  -7.204  -7.079  15.500
    4    HB3  GLU  50           HB3      GLU  50  -7.501  -6.524  13.851
    5    HG2  GLU  50           HG2      GLU  50  -8.329  -8.735  13.215
    6    HG3  GLU  50           HG3      GLU  50  -7.943  -9.368  14.812

  No H/Q in entry =           6
  In of MODEL   31
    1    H    ALA  51           H        ALA  51  -5.685  -6.353  12.031
    2    HA   ALA  51           HA       ALA  51  -6.637  -8.100  10.010
    3    HB2  ALA  51           HB1      ALA  51  -6.440  -6.288   8.637
    4    HB1  ALA  51           HB2      ALA  51  -4.808  -5.912   9.191
    5    HB3  ALA  51           HB3      ALA  51  -6.203  -5.420  10.153

  No H/Q in entry =           5
  In of MODEL   31
    1    H    HIS  52           H        HIS  52  -3.364  -7.141  11.003
    2    HA   HIS  52           HA       HIS  52  -1.935  -8.613   9.063
    3    HB2  HIS  52           HB2      HIS  52  -0.906  -6.872  10.468
    4    HB3  HIS  52           HB3      HIS  52  -1.114  -7.896  11.888
    5    HD1  HIS  52           HD1      HIS  52   0.207 -10.244  11.825
    6    HD2  HIS  52           HD2      HIS  52   1.382  -7.433   8.979
    7    HE1  HIS  52           HE1      HIS  52   2.460 -11.005  10.953
    8    HE2  HIS  52           HE2      HIS  52   3.189  -9.302   9.217

  No H/Q in entry =           8
  In of MODEL   31
    1    H    LEU  53           H        LEU  53  -3.145  -9.501  12.273
    2    HA   LEU  53           HA       LEU  53  -1.911 -12.026  12.477
    3    HB2  LEU  53           HB2      LEU  53  -4.418 -10.880  13.679
    4    HB3  LEU  53           HB3      LEU  53  -3.934 -12.548  13.978
    5    HG   LEU  53           HG       LEU  53  -2.078 -10.194  14.456
    6   HD13  LEU  53          HD11      LEU  53  -3.990  -9.887  15.911
    7   HD12  LEU  53          HD12      LEU  53  -2.663 -10.532  16.876
    8   HD11  LEU  53          HD13      LEU  53  -3.973 -11.589  16.362
    9   HD23  LEU  53          HD21      LEU  53  -1.165 -11.992  16.139
   10   HD22  LEU  53          HD22      LEU  53  -0.752 -12.135  14.434
   11   HD21  LEU  53          HD23      LEU  53  -2.015 -13.144  15.115

  No H/Q in entry =          11
  In of MODEL   31
    1    H    VAL  54           H        VAL  54  -5.032 -11.046  11.101
    2    HA   VAL  54           HA       VAL  54  -5.906 -13.655  10.417
    3    HB   VAL  54           HB       VAL  54  -6.588 -10.934   9.274
    4   HG12  VAL  54          HG11      VAL  54  -8.666 -12.344   8.458
    5   HG11  VAL  54          HG12      VAL  54  -7.536 -13.694   8.537
    6   HG13  VAL  54          HG13      VAL  54  -7.192 -12.316   7.493
    7   HG22  VAL  54          HG21      VAL  54  -7.502 -10.980  11.422
    8   HG21  VAL  54          HG22      VAL  54  -7.731 -12.727  11.406
    9   HG23  VAL  54          HG23      VAL  54  -8.823 -11.687  10.493

  No H/Q in entry =           9
  In of MODEL   31
    1    H    GLN  55           H        GLN  55  -4.063 -11.181   8.629
    2    HA   GLN  55           HA       GLN  55  -3.903 -12.649   6.216
    3    HB2  GLN  55           HB2      GLN  55  -3.330 -10.377   6.022
    4    HB3  GLN  55           HB3      GLN  55  -2.224 -10.435   7.391
    5    HG2  GLN  55           HG2      GLN  55  -0.490 -11.259   6.124
    6    HG3  GLN  55           HG3      GLN  55  -1.546 -12.252   5.128
    7   HE21  GLN  55          HE21      GLN  55  -1.565 -11.567   3.005
    8   HE22  GLN  55          HE22      GLN  55  -1.387  -9.961   2.492

  No H/Q in entry =           8
  In of MODEL   31
    1    H    THR  56           H        THR  56  -1.808 -12.592   9.104
    2    HA   THR  56           HA       THR  56   0.296 -14.164   8.198
    3    HB   THR  56           HB       THR  56  -0.952 -14.428  10.942
    4    HG1  THR  56           HG1      THR  56   0.737 -12.453   9.829
    5   HG23  THR  56          HG21      THR  56   1.128 -15.209  11.641
    6   HG22  THR  56          HG22      THR  56   1.977 -14.450  10.296
    7   HG21  THR  56          HG23      THR  56   1.019 -15.906  10.026

  No H/Q in entry =           7
  In of MODEL   31
    1    H    LYS  57           H        LYS  57  -2.815 -15.240   9.552
    2    HA   LYS  57           HA       LYS  57  -2.330 -18.030   9.315
    3    HB2  LYS  57           HB2      LYS  57  -4.169 -16.957  10.650
    4    HB3  LYS  57           HB3      LYS  57  -4.961 -16.528   9.142
    5    HG2  LYS  57           HG2      LYS  57  -4.220 -19.384   9.447
    6    HG3  LYS  57           HG3      LYS  57  -5.504 -18.804  10.504
    7    HD2  LYS  57           HD2      LYS  57  -6.750 -17.964   8.544
    8    HD3  LYS  57           HD3      LYS  57  -5.466 -18.536   7.478
    9    HE2  LYS  57           HE2      LYS  57  -5.867 -20.857   8.234
   10    HE3  LYS  57           HE3      LYS  57  -7.147 -20.301   9.310
   11    HZ2  LYS  57           HZ1      LYS  57  -7.829 -21.176   7.051
   12    HZ1  LYS  57           HZ2      LYS  57  -7.193 -19.736   6.409
   13    HZ3  LYS  57           HZ3      LYS  57  -8.478 -19.678   7.520

  No H/Q in entry =          13
  In of MODEL   31
    1    H    LEU  58           H        LEU  58  -3.686 -15.611   7.128
    2    HA   LEU  58           HA       LEU  58  -4.456 -17.452   5.124
    3    HB2  LEU  58           HB2      LEU  58  -3.889 -14.496   4.983
    4    HB3  LEU  58           HB3      LEU  58  -4.535 -15.445   3.643
    5    HG   LEU  58           HG       LEU  58  -5.827 -15.276   6.385
    6   HD11  LEU  58          HD11      LEU  58  -6.140 -13.639   3.888
    7   HD13  LEU  58          HD12      LEU  58  -6.143 -13.127   5.576
    8   HD12  LEU  58          HD13      LEU  58  -7.553 -13.941   4.901
    9   HD22  LEU  58          HD21      LEU  58  -6.761 -17.200   5.517
   10   HD21  LEU  58          HD22      LEU  58  -6.421 -16.748   3.847
   11   HD23  LEU  58          HD23      LEU  58  -7.797 -16.038   4.690

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  59           H        ILE  59  -1.341 -16.197   5.994
    2    HA   ILE  59           HA       ILE  59  -0.223 -16.916   3.363
    3    HB   ILE  59           HB       ILE  59   0.512 -14.837   4.933
    4   HG12  ILE  59          HG12      ILE  59   2.611 -16.470   3.488
    5   HG13  ILE  59          HG13      ILE  59   1.420 -15.510   2.651
    6   HG23  ILE  59          HG21      ILE  59   2.356 -15.295   6.331
    7   HG22  ILE  59          HG22      ILE  59   2.632 -16.871   5.624
    8   HG21  ILE  59          HG23      ILE  59   1.262 -16.607   6.702
    9   HD13  ILE  59          HD11      ILE  59   2.178 -13.490   3.835
   10   HD12  ILE  59          HD12      ILE  59   3.507 -14.237   2.949
   11   HD11  ILE  59          HD13      ILE  59   3.376 -14.455   4.695

  No H/Q in entry =          11
  In of MODEL   31
    1    H    GLU  60           H        GLU  60  -0.232 -18.014   6.734
    2    HA   GLU  60           HA       GLU  60   1.826 -19.965   6.482
    3    HB2  GLU  60           HB2      GLU  60   1.009 -19.160   8.662
    4    HB3  GLU  60           HB3      GLU  60  -0.556 -19.911   8.355
    5    HG2  GLU  60           HG2      GLU  60   0.543 -22.130   8.227
    6    HG3  GLU  60           HG3      GLU  60   2.097 -21.368   8.563

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLY  61           H        GLY  61  -1.681 -20.111   5.982
    2    HA3  GLY  61           HA2      GLY  61  -1.392 -22.903   5.033
    3    HA2  GLY  61           HA3      GLY  61  -2.889 -22.185   5.618

  No H/Q in entry =           3
  In of MODEL   31
    1    H    ASP  62           H        ASP  62  -0.671 -20.583   3.420
    2    HA   ASP  62           HA       ASP  62  -2.775 -20.102   1.525
    3    HB2  ASP  62           HB2      ASP  62  -0.942 -18.962   0.255
    4    HB3  ASP  62           HB3      ASP  62  -1.122 -18.391   1.911

  No H/Q in entry =           4
  In of MODEL   31
    1    H    ALA  63           H        ALA  63  -1.407 -22.943   2.017
    2    HA   ALA  63           HA       ALA  63  -0.217 -23.768  -0.406
    3    HB2  ALA  63           HB1      ALA  63  -0.048 -25.220   1.456
    4    HB3  ALA  63           HB2      ALA  63  -1.050 -26.055   0.269
    5    HB1  ALA  63           HB3      ALA  63  -1.800 -25.278   1.664

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLY  64           H        GLY  64  -3.589 -23.585   0.635
    2    HA3  GLY  64           HA2      GLY  64  -5.573 -23.677  -0.510
    3    HA2  GLY  64           HA3      GLY  64  -4.666 -23.164  -1.923

  No H/Q in entry =           3
  In of MODEL   31
    1    H    GLU  65           H        GLU  65  -5.723 -24.492  -3.407
    2    HA   GLU  65           HA       GLU  65  -6.250 -27.234  -2.931
    3    HB2  GLU  65           HB2      GLU  65  -6.100 -25.671  -5.508
    4    HB3  GLU  65           HB3      GLU  65  -6.670 -27.337  -5.387
    5    HG2  GLU  65           HG2      GLU  65  -7.845 -25.004  -3.851
    6    HG3  GLU  65           HG3      GLU  65  -8.535 -25.678  -5.324

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLY  66           H        GLY  66  -3.671 -25.583  -4.609
    2    HA3  GLY  66           HA2      GLY  66  -2.245 -28.077  -5.163
    3    HA2  GLY  66           HA3      GLY  66  -1.882 -26.504  -5.844

  No H/Q in entry =           3
  In of MODEL   31
    1    H    LYS  67           H        LYS  67   0.243 -27.720  -5.124
    2    HA   LYS  67           HA       LYS  67   0.931 -27.375  -2.342
    3    HB2  LYS  67           HB2      LYS  67   2.461 -28.386  -4.733
    4    HB3  LYS  67           HB3      LYS  67   3.139 -28.301  -3.102
    5    HG2  LYS  67           HG2      LYS  67   1.298 -29.694  -2.248
    6    HG3  LYS  67           HG3      LYS  67   0.594 -29.768  -3.861
    7    HD2  LYS  67           HD2      LYS  67   2.610 -30.915  -4.696
    8    HD3  LYS  67           HD3      LYS  67   3.322 -30.837  -3.083
    9    HE2  LYS  67           HE2      LYS  67   1.441 -32.160  -2.184
   10    HE3  LYS  67           HE3      LYS  67   0.732 -32.245  -3.796
   11    HZ2  LYS  67           HZ1      LYS  67   2.915 -33.738  -2.673
   12    HZ1  LYS  67           HZ2      LYS  67   3.263 -33.090  -4.204
   13    HZ3  LYS  67           HZ3      LYS  67   1.917 -34.105  -3.993

  No H/Q in entry =          13
  In of MODEL   31
    1    H    MET  68           H        MET  68   2.838 -26.444  -5.139
    2    HA   MET  68           HA       MET  68   4.287 -24.405  -3.859
    3    HB2  MET  68           HB2      MET  68   3.877 -25.231  -6.709
    4    HB3  MET  68           HB3      MET  68   4.794 -23.773  -6.328
    5    HG2  MET  68           HG2      MET  68   6.351 -25.624  -6.467
    6    HG3  MET  68           HG3      MET  68   6.210 -25.152  -4.772
    7    HE3  MET  68           HE1      MET  68   6.720 -28.763  -4.182
    8    HE2  MET  68           HE2      MET  68   6.356 -27.399  -3.126
    9    HE1  MET  68           HE3      MET  68   7.441 -27.178  -4.497

  No H/Q in entry =           9
  In of MODEL   31
    1    H    LYS  69           H        LYS  69   1.401 -24.207  -5.928
    2    HA   LYS  69           HA       LYS  69   1.440 -21.383  -6.147
    3    HB2  LYS  69           HB2      LYS  69  -0.758 -23.363  -6.664
    4    HB3  LYS  69           HB3      LYS  69  -0.890 -21.633  -7.001
    5    HG2  LYS  69           HG2      LYS  69   1.147 -21.766  -8.409
    6    HG3  LYS  69           HG3      LYS  69   1.213 -23.505  -8.121
    7    HD2  LYS  69           HD2      LYS  69  -1.208 -22.141  -9.311
    8    HD3  LYS  69           HD3      LYS  69   0.098 -22.796 -10.300
    9    HE2  LYS  69           HE2      LYS  69  -0.238 -24.992  -9.018
   10    HE3  LYS  69           HE3      LYS  69  -1.745 -24.290  -8.428
   11    HZ2  LYS  69           HZ1      LYS  69  -1.364 -25.587 -10.816
   12    HZ1  LYS  69           HZ2      LYS  69  -1.468 -23.944 -11.236
   13    HZ3  LYS  69           HZ3      LYS  69  -2.724 -24.682 -10.362

  No H/Q in entry =          13
  In of MODEL   31
    1    H    VAL  70           H        VAL  70   0.044 -19.784  -5.326
    2    HA   VAL  70           HA       VAL  70  -1.291 -20.430  -2.759
    3    HB   VAL  70           HB       VAL  70  -0.491 -18.251  -1.895
    4   HG12  VAL  70          HG11      VAL  70   1.873 -19.831  -2.917
    5   HG11  VAL  70          HG12      VAL  70   0.812 -20.441  -1.645
    6   HG13  VAL  70          HG13      VAL  70   1.729 -18.956  -1.393
    7   HG23  VAL  70          HG21      VAL  70   1.576 -17.364  -3.367
    8   HG22  VAL  70          HG22      VAL  70  -0.070 -16.802  -3.652
    9   HG21  VAL  70          HG23      VAL  70   0.617 -18.062  -4.675

  No H/Q in entry =           9
  In of MODEL   31
    1    H    SER  71           H        SER  71  -2.863 -18.748  -2.126
    2    HA   SER  71           HA       SER  71  -4.746 -18.201  -4.167
    3    HB2  SER  71           HB2      SER  71  -5.302 -18.400  -1.722
    4    HB3  SER  71           HB3      SER  71  -4.500 -16.857  -1.452
    5    HG   SER  71           HG       SER  71  -6.954 -17.421  -2.555

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU  72           H        LEU  72  -4.965 -16.547  -5.503
    2    HA   LEU  72           HA       LEU  72  -2.881 -14.707  -5.982
    3    HB2  LEU  72           HB2      LEU  72  -5.741 -14.807  -6.937
    4    HB3  LEU  72           HB3      LEU  72  -4.564 -13.630  -7.509
    5    HG   LEU  72           HG       LEU  72  -4.099 -16.627  -7.636
    6   HD11  LEU  72          HD11      LEU  72  -5.207 -14.728  -9.724
    7   HD13  LEU  72          HD12      LEU  72  -6.032 -16.117  -9.015
    8   HD12  LEU  72          HD13      LEU  72  -4.640 -16.362 -10.071
    9   HD22  LEU  72          HD21      LEU  72  -2.004 -15.595  -7.890
   10   HD21  LEU  72          HD22      LEU  72  -2.670 -14.186  -8.697
   11   HD23  LEU  72          HD23      LEU  72  -2.552 -15.718  -9.558

  No H/Q in entry =          11
  In of MODEL   31
    1    H    VAL  73           H        VAL  73  -5.984 -14.391  -4.362
    2    HA   VAL  73           HA       VAL  73  -6.070 -11.620  -4.017
    3    HB   VAL  73           HB       VAL  73  -7.785 -12.001  -2.434
    4   HG13  VAL  73          HG11      VAL  73  -9.197 -13.586  -3.587
    5   HG12  VAL  73          HG12      VAL  73  -7.796 -14.417  -4.262
    6   HG11  VAL  73          HG13      VAL  73  -8.195 -12.784  -4.797
    7   HG23  VAL  73          HG21      VAL  73  -8.036 -14.511  -1.644
    8   HG22  VAL  73          HG22      VAL  73  -6.934 -13.425  -0.799
    9   HG21  VAL  73          HG23      VAL  73  -6.305 -14.574  -1.979

  No H/Q in entry =           9
  In of MODEL   31
    1    H    LEU  74           H        LEU  74  -4.103 -13.957  -2.423
    2    HA   LEU  74           HA       LEU  74  -3.715 -12.805   0.099
    3    HB2  LEU  74           HB2      LEU  74  -2.899 -15.014  -0.401
    4    HB3  LEU  74           HB3      LEU  74  -1.844 -14.385  -1.665
    5    HG   LEU  74           HG       LEU  74  -0.570 -13.117   0.032
    6   HD13  LEU  74          HD11      LEU  74  -2.135 -12.642   1.746
    7   HD12  LEU  74          HD12      LEU  74  -1.073 -13.852   2.467
    8   HD11  LEU  74          HD13      LEU  74  -2.656 -14.324   1.850
    9   HD23  LEU  74          HD21      LEU  74  -0.754 -15.875   1.128
   10   HD22  LEU  74          HD22      LEU  74   0.644 -14.933   0.659
   11   HD21  LEU  74          HD23      LEU  74  -0.340 -15.687  -0.575

  No H/Q in entry =          11
  In of MODEL   31
    1    H    VAL  75           H        VAL  75  -1.822 -12.390  -2.854
    2    HA   VAL  75           HA       VAL  75  -0.055 -10.438  -1.842
    3    HB   VAL  75           HB       VAL  75  -0.997 -10.933  -4.669
    4   HG11  VAL  75          HG11      VAL  75   1.253  -9.188  -3.574
    5   HG13  VAL  75          HG12      VAL  75  -0.155  -8.642  -4.471
    6   HG12  VAL  75          HG13      VAL  75   1.065  -9.620  -5.269
    7   HG23  VAL  75          HG21      VAL  75   1.688 -11.574  -3.445
    8   HG22  VAL  75          HG22      VAL  75   0.931 -12.284  -4.872
    9   HG21  VAL  75          HG23      VAL  75   0.333 -12.690  -3.262

  No H/Q in entry =           9
  In of MODEL   31
    1    H    GLU  76           H        GLU  76  -3.206 -10.140  -3.509
    2    HA   GLU  76           HA       GLU  76  -3.298  -7.326  -3.616
    3    HB2  GLU  76           HB2      GLU  76  -4.929  -8.841  -4.763
    4    HB3  GLU  76           HB3      GLU  76  -5.608  -9.259  -3.197
    5    HG2  GLU  76           HG2      GLU  76  -6.288  -6.927  -2.835
    6    HG3  GLU  76           HG3      GLU  76  -5.581  -6.449  -4.367

  No H/Q in entry =           6
  In of MODEL   31
    1    H    ALA  77           H        ALA  77  -4.384  -9.566  -1.075
    2    HA   ALA  77           HA       ALA  77  -5.374  -7.574   0.678
    3    HB1  ALA  77           HB1      ALA  77  -4.341 -10.371   1.169
    4    HB3  ALA  77           HB2      ALA  77  -6.018  -9.836   1.082
    5    HB2  ALA  77           HB3      ALA  77  -5.012  -9.360   2.448

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLN  78           H        GLN  78  -2.203  -9.079   0.324
    2    HA   GLN  78           HA       GLN  78  -0.968  -7.897   2.575
    3    HB2  GLN  78           HB2      GLN  78  -0.080  -9.828   1.217
    4    HB3  GLN  78           HB3      GLN  78   0.354  -8.670  -0.039
    5    HG2  GLN  78           HG2      GLN  78   1.795  -7.474   1.550
    6    HG3  GLN  78           HG3      GLN  78   1.350  -8.607   2.824
    7   HE21  GLN  78          HE21      GLN  78   4.085  -8.285   1.931
    8   HE22  GLN  78          HE22      GLN  78   4.560  -9.740   1.196

  No H/Q in entry =           8
  In of MODEL   31
    1    H    LEU  79           H        LEU  79  -1.341  -6.847  -0.774
    2    HA   LEU  79           HA       LEU  79   0.315  -4.598  -0.760
    3    HB2  LEU  79           HB2      LEU  79  -0.695  -5.422  -2.815
    4    HB3  LEU  79           HB3      LEU  79  -2.306  -5.051  -2.212
    5    HG   LEU  79           HG       LEU  79  -1.794  -2.657  -2.189
    6   HD13  LEU  79          HD11      LEU  79   0.441  -2.382  -1.671
    7   HD12  LEU  79          HD12      LEU  79   0.491  -2.097  -3.411
    8   HD11  LEU  79          HD13      LEU  79   0.965  -3.667  -2.760
    9   HD23  LEU  79          HD21      LEU  79  -1.156  -2.454  -4.740
   10   HD22  LEU  79          HD22      LEU  79  -2.673  -3.222  -4.284
   11   HD21  LEU  79          HD23      LEU  79  -1.286  -4.213  -4.723

  No H/Q in entry =          11
  In of MODEL   31
    1    H    HIS  80           H        HIS  80  -3.152  -4.805   0.057
    2    HA   HIS  80           HA       HIS  80  -3.381  -2.050   0.715
    3    HB2  HIS  80           HB2      HIS  80  -5.052  -4.481   1.034
    4    HB3  HIS  80           HB3      HIS  80  -5.393  -3.143   2.134
    5    HD1  HIS  80           HD1      HIS  80  -7.029  -1.529   1.220
    6    HD2  HIS  80           HD2      HIS  80  -4.805  -3.318  -1.819
    7    HE1  HIS  80           HE1      HIS  80  -7.877  -0.548  -0.964
    8    HE2  HIS  80           HE2      HIS  80  -6.527  -1.632  -2.825

  No H/Q in entry =           8
  In of MODEL   31
    1    H    LEU  81           H        LEU  81  -2.860  -4.935   2.715
    2    HA   LEU  81           HA       LEU  81  -2.872  -3.583   5.196
    3    HB2  LEU  81           HB2      LEU  81  -1.617  -6.185   4.325
    4    HB3  LEU  81           HB3      LEU  81  -1.603  -5.623   5.998
    5    HG   LEU  81           HG       LEU  81  -4.140  -5.911   4.364
    6   HD12  LEU  81          HD11      LEU  81  -4.421  -7.978   5.914
    7   HD11  LEU  81          HD12      LEU  81  -2.670  -7.884   6.104
    8   HD13  LEU  81          HD13      LEU  81  -3.371  -8.127   4.504
    9   HD23  LEU  81          HD21      LEU  81  -4.988  -6.121   6.863
   10   HD22  LEU  81          HD22      LEU  81  -4.681  -4.529   6.171
   11   HD21  LEU  81          HD23      LEU  81  -3.488  -5.272   7.235

  No H/Q in entry =          11
  In of MODEL   31
    1    H    MET  82           H        MET  82  -0.174  -4.456   3.034
    2    HA   MET  82           HA       MET  82   1.894  -3.533   4.722
    3    HB2  MET  82           HB2      MET  82   1.691  -3.882   1.730
    4    HB3  MET  82           HB3      MET  82   3.163  -3.292   2.496
    5    HG2  MET  82           HG2      MET  82   1.787  -5.897   3.221
    6    HG3  MET  82           HG3      MET  82   3.160  -5.772   2.125
    7    HE3  MET  82           HE1      MET  82   6.161  -4.995   4.115
    8    HE2  MET  82           HE2      MET  82   5.223  -3.640   3.492
    9    HE1  MET  82           HE3      MET  82   5.332  -5.131   2.559

  No H/Q in entry =           9
  In of MODEL   31
    1    H    THR  83           H        THR  83   0.058  -1.918   2.157
    2    HA   THR  83           HA       THR  83   1.439   0.547   2.243
    3    HB   THR  83           HB       THR  83  -0.746   1.444   1.249
    4    HG1  THR  83           HG1      THR  83  -2.380   0.126   1.141
    5   HG22  THR  83          HG21      THR  83  -0.448  -0.374  -0.747
    6   HG21  THR  83          HG22      THR  83   1.054  -0.647   0.134
    7   HG23  THR  83          HG23      THR  83   0.675   0.961  -0.485

  No H/Q in entry =           7
  In of MODEL   31
    1    H    SER  84           H        SER  84  -1.558  -0.518   3.838
    2    HA   SER  84           HA       SER  84  -2.087   1.908   5.177
    3    HB2  SER  84           HB2      SER  84  -2.887  -0.939   5.745
    4    HB3  SER  84           HB3      SER  84  -3.399   0.398   6.774
    5    HG   SER  84           HG       SER  84  -3.847   0.073   3.981

  No H/Q in entry =           5
  In of MODEL   31
    1    H    MET  85           H        MET  85  -0.345  -1.001   6.316
    2    HA   MET  85           HA       MET  85   0.157  -0.063   8.920
    3    HB2  MET  85           HB2      MET  85   0.479  -2.404   8.256
    4    HB3  MET  85           HB3      MET  85   1.852  -1.929   7.253
    5    HG2  MET  85           HG2      MET  85   3.030  -1.078   9.239
    6    HG3  MET  85           HG3      MET  85   1.648  -1.502  10.250
    7    HE3  MET  85           HE1      MET  85   4.355  -4.109  11.280
    8    HE2  MET  85           HE2      MET  85   3.191  -2.916  11.851
    9    HE1  MET  85           HE3      MET  85   4.549  -2.405  10.854

  No H/Q in entry =           9
  In of MODEL   31
    1    H    LEU  86           H        LEU  86   2.096   0.209   5.973
    2    HA   LEU  86           HA       LEU  86   4.292   1.548   7.132
    3    HB2  LEU  86           HB2      LEU  86   4.119   0.459   4.825
    4    HB3  LEU  86           HB3      LEU  86   3.295   1.930   4.307
    5    HG   LEU  86           HG       LEU  86   5.306   3.202   5.290
    6   HD11  LEU  86          HD11      LEU  86   6.039   0.600   6.097
    7   HD13  LEU  86          HD12      LEU  86   7.026   2.057   6.194
    8   HD12  LEU  86          HD13      LEU  86   7.151   1.007   4.785
    9   HD23  LEU  86          HD21      LEU  86   6.049   1.443   2.945
   10   HD22  LEU  86          HD22      LEU  86   6.422   3.145   3.204
   11   HD21  LEU  86          HD23      LEU  86   4.776   2.657   2.803

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ALA  87           H        ALA  87   1.369   2.755   5.537
    2    HA   ALA  87           HA       ALA  87   1.931   5.491   5.617
    3    HB1  ALA  87           HB1      ALA  87  -0.358   3.836   5.074
    4    HB3  ALA  87           HB2      ALA  87  -0.065   5.499   4.571
    5    HB2  ALA  87           HB3      ALA  87  -0.859   5.171   6.113

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ARG  88           H        ARG  88   0.259   3.475   8.007
    2    HA   ARG  88           HA       ARG  88  -0.281   5.523   9.848
    3    HB2  ARG  88           HB2      ARG  88  -1.192   3.159   9.917
    4    HB3  ARG  88           HB3      ARG  88   0.353   2.679  10.628
    5    HG2  ARG  88           HG2      ARG  88  -0.152   4.751  12.243
    6    HG3  ARG  88           HG3      ARG  88  -1.814   4.406  11.783
    7    HD2  ARG  88           HD2      ARG  88  -1.902   2.558  13.033
    8    HD3  ARG  88           HD3      ARG  88  -0.305   1.994  12.507
    9    HE   ARG  88           HE       ARG  88  -0.860   3.256  14.957
   10   HH21  ARG  88          HH11      ARG  88   0.684   4.289  16.197
   11   HH22  ARG  88          HH12      ARG  88   2.199   4.732  15.496
   12   HH11  ARG  88          HH21      ARG  88   1.425   3.459  12.386
   13   HH12  ARG  88          HH22      ARG  88   2.628   4.246  13.349

  No H/Q in entry =          13
  In of MODEL   31
    1    H    GLU  89           H        GLU  89   2.542   3.336   9.637
    2    HA   GLU  89           HA       GLU  89   3.787   4.245  11.982
    3    HB2  GLU  89           HB2      GLU  89   4.473   2.232  10.644
    4    HB3  GLU  89           HB3      GLU  89   5.239   3.333   9.497
    5    HG2  GLU  89           HG2      GLU  89   6.709   4.201  11.242
    6    HG3  GLU  89           HG3      GLU  89   5.883   3.238  12.463

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LEU  90           H        LEU  90   4.098   5.399   8.652
    2    HA   LEU  90           HA       LEU  90   6.003   7.424   9.237
    3    HB2  LEU  90           HB2      LEU  90   4.006   7.063   7.006
    4    HB3  LEU  90           HB3      LEU  90   5.221   8.349   7.027
    5    HG   LEU  90           HG       LEU  90   5.930   5.422   7.370
    6   HD12  LEU  90          HD11      LEU  90   6.682   5.659   4.931
    7   HD11  LEU  90          HD12      LEU  90   5.649   7.087   4.877
    8   HD13  LEU  90          HD13      LEU  90   4.947   5.506   5.222
    9   HD22  LEU  90          HD21      LEU  90   7.811   6.596   8.054
   10   HD21  LEU  90          HD22      LEU  90   7.446   7.994   7.043
   11   HD23  LEU  90          HD23      LEU  90   8.126   6.536   6.321

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  91           H        ILE  91   2.464   7.395   9.080
    2    HA   ILE  91           HA       ILE  91   2.086  10.165   9.523
    3    HB   ILE  91           HB       ILE  91   0.324   7.768  10.067
    4   HG12  ILE  91          HG12      ILE  91   0.051  10.041   8.076
    5   HG13  ILE  91          HG13      ILE  91   0.931   8.557   7.710
    6   HG22  ILE  91          HG21      ILE  91  -1.435   9.804  10.121
    7   HG21  ILE  91          HG22      ILE  91  -0.046  10.654  10.796
    8   HG23  ILE  91          HG23      ILE  91  -0.666   9.210  11.594
    9   HD13  ILE  91          HD11      ILE  91  -0.996   7.245   7.752
   10   HD12  ILE  91          HD12      ILE  91  -1.603   8.751   7.065
   11   HD11  ILE  91          HD13      ILE  91  -1.874   8.387   8.770

  No H/Q in entry =          11
  In of MODEL   31
    1    H    THR  92           H        THR  92   2.519   7.434  11.732
    2    HA   THR  92           HA       THR  92   2.051   8.807  14.151
    3    HB   THR  92           HB       THR  92   3.892   6.495  13.497
    4    HG1  THR  92           HG1      THR  92   1.933   5.711  13.393
    5   HG22  THR  92          HG21      THR  92   3.505   6.212  16.130
    6   HG21  THR  92          HG22      THR  92   3.417   7.970  16.052
    7   HG23  THR  92          HG23      THR  92   4.863   7.132  15.486

  No H/Q in entry =           7
  In of MODEL   31
    1    H    GLU  93           H        GLU  93   5.013   8.393  12.227
    2    HA   GLU  93           HA       GLU  93   6.743   9.847  13.925
    3    HB2  GLU  93           HB2      GLU  93   6.844   9.526  10.911
    4    HB3  GLU  93           HB3      GLU  93   8.174  10.077  11.927
    5    HG2  GLU  93           HG2      GLU  93   6.799   7.423  12.378
    6    HG3  GLU  93           HG3      GLU  93   8.183   7.591  11.305

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LEU  94           H        LEU  94   4.688  10.827  11.204
    2    HA   LEU  94           HA       LEU  94   5.456  13.542  11.099
    3    HB2  LEU  94           HB2      LEU  94   2.887  12.139  10.341
    4    HB3  LEU  94           HB3      LEU  94   3.122  13.869  10.096
    5    HG   LEU  94           HG       LEU  94   5.170  11.907   9.057
    6   HD11  LEU  94          HD11      LEU  94   2.424  12.417   7.985
    7   HD13  LEU  94          HD12      LEU  94   3.427  10.974   7.866
    8   HD12  LEU  94          HD13      LEU  94   3.746  12.356   6.819
    9   HD23  LEU  94          HD21      LEU  94   5.399  13.742   7.330
   10   HD22  LEU  94          HD22      LEU  94   5.802  14.245   8.972
   11   HD21  LEU  94          HD23      LEU  94   4.247  14.689   8.268

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  95           H        ILE  95   2.936  11.894  12.987
    2    HA   ILE  95           HA       ILE  95   1.856  14.232  14.173
    3    HB   ILE  95           HB       ILE  95   1.912  11.353  15.105
    4   HG12  ILE  95          HG12      ILE  95  -0.331  13.092  14.045
    5   HG13  ILE  95          HG13      ILE  95   0.644  12.044  13.018
    6   HG21  ILE  95          HG21      ILE  95   0.591  13.810  16.297
    7   HG23  ILE  95          HG22      ILE  95   1.653  12.659  17.107
    8   HG22  ILE  95          HG23      ILE  95   0.026  12.173  16.629
    9   HD13  ILE  95          HD11      ILE  95  -0.234  10.095  13.940
   10   HD12  ILE  95          HD12      ILE  95  -1.632  11.165  14.009
   11   HD11  ILE  95          HD13      ILE  95  -0.667  10.884  15.458

  No H/Q in entry =          11
  In of MODEL   31
    1    H    GLU  96           H        GLU  96   4.480  12.054  15.182
    2    HA   GLU  96           HA       GLU  96   5.010  13.267  17.672
    3    HB2  GLU  96           HB2      GLU  96   5.992  11.121  17.033
    4    HB3  GLU  96           HB3      GLU  96   6.918  11.904  15.754
    5    HG2  GLU  96           HG2      GLU  96   8.553  12.481  17.220
    6    HG3  GLU  96           HG3      GLU  96   7.392  13.280  18.269

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LEU  97           H        LEU  97   6.083  14.046  14.387
    2    HA   LEU  97           HA       LEU  97   7.937  16.073  15.100
    3    HB2  LEU  97           HB2      LEU  97   6.361  15.493  12.601
    4    HB3  LEU  97           HB3      LEU  97   7.359  16.940  12.722
    5    HG   LEU  97           HG       LEU  97   8.428  14.160  13.293
    6   HD12  LEU  97          HD11      LEU  97   9.429  14.363  10.978
    7   HD11  LEU  97          HD12      LEU  97   8.357  15.736  10.707
    8   HD13  LEU  97          HD13      LEU  97   7.681  14.135  11.004
    9   HD23  LEU  97          HD21      LEU  97  10.580  15.469  12.553
   10   HD22  LEU  97          HD22      LEU  97   9.952  15.734  14.179
   11   HD21  LEU  97          HD23      LEU  97   9.624  16.909  12.907

  No H/Q in entry =          11
  In of MODEL   31
    1    H    HIS  98           H        HIS  98   4.446  16.153  14.434
    2    HA   HIS  98           HA       HIS  98   4.103  18.948  14.561
    3    HB2  HIS  98           HB2      HIS  98   2.246  16.671  15.287
    4    HB3  HIS  98           HB3      HIS  98   1.752  18.364  15.337
    5    HD1  HIS  98           HD1      HIS  98   2.823  15.658  12.943
    6    HD2  HIS  98           HD2      HIS  98   1.387  19.570  12.805
    7    HE1  HIS  98           HE1      HIS  98   2.264  16.132  10.516
    8    HE2  HIS  98           HE2      HIS  98   1.393  18.508  10.411

  No H/Q in entry =           8
  In of MODEL   31
    1    H    GLU  99           H        GLU  99   4.267  16.468  17.067
    2    HA   GLU  99           HA       GLU  99   3.626  18.159  19.258
    3    HB2  GLU  99           HB2      GLU  99   3.575  15.676  19.362
    4    HB3  GLU  99           HB3      GLU  99   5.336  15.658  19.259
    5    HG2  GLU  99           HG2      GLU  99   5.498  16.959  21.330
    6    HG3  GLU  99           HG3      GLU  99   3.744  17.073  21.420

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LYS 100           H        LYS 100   6.699  17.272  17.705
    2    HA   LYS 100           HA       LYS 100   8.326  18.703  19.563
    3    HB2  LYS 100           HB2      LYS 100   8.848  17.779  16.729
    4    HB3  LYS 100           HB3      LYS 100  10.062  18.570  17.738
    5    HG2  LYS 100           HG2      LYS 100   9.708  16.818  19.483
    6    HG3  LYS 100           HG3      LYS 100   8.592  15.994  18.390
    7    HD2  LYS 100           HD2      LYS 100  10.395  15.735  16.730
    8    HD3  LYS 100           HD3      LYS 100  11.516  16.571  17.807
    9    HE2  LYS 100           HE2      LYS 100  11.142  14.814  19.529
   10    HE3  LYS 100           HE3      LYS 100  10.083  13.959  18.402
   11    HZ1  LYS 100           HZ1      LYS 100  12.895  14.670  17.754
   12    HZ3  LYS 100           HZ2      LYS 100  11.870  13.597  16.925
   13    HZ2  LYS 100           HZ3      LYS 100  12.460  13.191  18.466

  No H/Q in entry =          13
  In of MODEL   31
    1    H    LEU 101           H        LEU 101   6.627  19.595  16.600
    2    HA   LEU 101           HA       LEU 101   7.803  22.170  16.262
    3    HB2  LEU 101           HB2      LEU 101   5.229  20.894  15.371
    4    HB3  LEU 101           HB3      LEU 101   5.454  22.628  15.160
    5    HG   LEU 101           HG       LEU 101   7.524  20.641  14.205
    6   HD12  LEU 101          HD11      LEU 101   6.370  21.123  11.915
    7   HD11  LEU 101          HD12      LEU 101   4.961  21.534  12.891
    8   HD13  LEU 101          HD13      LEU 101   5.650  19.914  12.979
    9   HD21  LEU 101          HD21      LEU 101   6.853  23.542  13.640
   10   HD23  LEU 101          HD22      LEU 101   7.852  22.594  12.539
   11   HD22  LEU 101          HD23      LEU 101   8.385  22.865  14.198

  No H/Q in entry =          11
  In of MODEL   31
    1    H    LYS 102           H        LYS 102   6.275  21.015  18.876
    2    HA   LYS 102           HA       LYS 102   5.621  22.102  20.804
    3    HB2  LYS 102           HB2      LYS 102   6.876  24.109  19.678
    4    HB3  LYS 102           HB3      LYS 102   5.269  24.688  19.296
    5    HG2  LYS 102           HG2      LYS 102   6.642  24.460  21.953
    6    HG3  LYS 102           HG3      LYS 102   5.671  25.772  21.317
    7    HD2  LYS 102           HD2      LYS 102   4.465  23.120  22.199
    8    HD3  LYS 102           HD3      LYS 102   4.690  24.487  23.280
    9    HE2  LYS 102           HE2      LYS 102   2.421  24.046  21.785
   10    HE3  LYS 102           HE3      LYS 102   2.899  25.601  22.465
   11    HZ2  LYS 102           HZ1      LYS 102   2.374  25.695  20.083
   12    HZ1  LYS 102           HZ2      LYS 102   3.652  24.631  19.767
   13    HZ3  LYS 102           HZ3      LYS 102   3.970  26.168  20.407

  No H/Q in entry =          13
  In of MODEL   31
    1    H    ALA 103           H        ALA 103   3.968  23.613  18.028
    2    HA   ALA 103           HA       ALA 103   1.503  24.155  18.904
    3    HB1  ALA 103           HB1      ALA 103   0.624  23.294  16.661
    4    HB2  ALA 103           HB2      ALA 103   2.280  22.781  16.337
    5    HB3  ALA 103           HB3      ALA 103   1.919  24.489  16.599

  No H/Q in entry =           5
  In of MODEL   31
    1    H1   ALA   1           H3       ALA   1  10.844 -20.273  -6.233
    2    H2   ALA   1           H2       ALA   1   9.887 -20.497  -7.621
    3    H3   ALA   1           H1       ALA   1   9.456 -21.246  -6.158
    4    HA   ALA   1           HA       ALA   1  10.524 -23.041  -6.890
    5    HB1  ALA   1           HB1      ALA   1  10.620 -22.686  -9.166
    6    HB2  ALA   1           HB2      ALA   1  12.345 -22.510  -8.833
    7    HB3  ALA   1           HB3      ALA   1  11.326 -21.078  -8.990

  No H/Q in entry =           7
  In of MODEL   31
    1    H    GLU   2           H        GLU   2  12.821 -23.959  -6.939
    2    HA   GLU   2           HA       GLU   2  14.195 -23.852  -4.724
    3    HB2  GLU   2           HB2      GLU   2  15.557 -23.708  -7.420
    4    HB3  GLU   2           HB3      GLU   2  16.289 -24.305  -5.931
    5    HG2  GLU   2           HG2      GLU   2  15.302 -26.337  -6.170
    6    HG3  GLU   2           HG3      GLU   2  13.721 -25.614  -6.435

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLU   3           H        GLU   3  15.946 -21.968  -7.125
    2    HA   GLU   3           HA       GLU   3  17.070 -20.260  -5.167
    3    HB2  GLU   3           HB2      GLU   3  17.022 -20.266  -8.177
    4    HB3  GLU   3           HB3      GLU   3  17.747 -18.924  -7.291
    5    HG2  GLU   3           HG2      GLU   3  19.426 -20.273  -6.360
    6    HG3  GLU   3           HG3      GLU   3  18.501 -21.754  -6.580

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LEU   4           H        LEU   4  14.783 -19.451  -7.805
    2    HA   LEU   4           HA       LEU   4  14.278 -16.848  -7.201
    3    HB2  LEU   4           HB2      LEU   4  12.133 -18.855  -7.933
    4    HB3  LEU   4           HB3      LEU   4  12.034 -17.107  -8.136
    5    HG   LEU   4           HG       LEU   4  14.028 -18.946  -9.499
    6   HD13  LEU   4          HD11      LEU   4  12.729 -18.820 -11.413
    7   HD12  LEU   4          HD12      LEU   4  11.999 -17.284 -10.951
    8   HD11  LEU   4          HD13      LEU   4  11.464 -18.781 -10.187
    9   HD23  LEU   4          HD21      LEU   4  14.336 -16.699 -10.855
   10   HD22  LEU   4          HD22      LEU   4  15.196 -16.926  -9.333
   11   HD21  LEU   4          HD23      LEU   4  13.729 -15.950  -9.378

  No H/Q in entry =          11
  In of MODEL   31
    1    H    GLU   5           H        GLU   5  12.829 -19.648  -5.556
    2    HA   GLU   5           HA       GLU   5  11.125 -18.097  -3.862
    3    HB2  GLU   5           HB2      GLU   5  10.733 -20.481  -4.377
    4    HB3  GLU   5           HB3      GLU   5  12.172 -20.896  -3.445
    5    HG2  GLU   5           HG2      GLU   5  11.191 -19.881  -1.439
    6    HG3  GLU   5           HG3      GLU   5   9.762 -19.416  -2.361

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLU   6           H        GLU   6  14.292 -19.631  -3.407
    2    HA   GLU   6           HA       GLU   6  14.625 -18.763  -0.710
    3    HB2  GLU   6           HB2      GLU   6  16.659 -19.612  -2.789
    4    HB3  GLU   6           HB3      GLU   6  17.008 -19.374  -1.076
    5    HG2  GLU   6           HG2      GLU   6  14.814 -21.233  -1.983
    6    HG3  GLU   6           HG3      GLU   6  16.485 -21.781  -1.857

  No H/Q in entry =           6
  In of MODEL   31
    1    H    VAL   7           H        VAL   7  15.380 -17.433  -3.861
    2    HA   VAL   7           HA       VAL   7  17.033 -15.280  -2.997
    3    HB   VAL   7           HB       VAL   7  15.339 -15.674  -5.478
    4   HG11  VAL   7          HG11      VAL   7  17.198 -13.432  -4.666
    5   HG13  VAL   7          HG12      VAL   7  15.555 -13.315  -5.294
    6   HG12  VAL   7          HG13      VAL   7  16.875 -13.801  -6.360
    7   HG21  VAL   7          HG21      VAL   7  17.466 -17.099  -4.900
    8   HG23  VAL   7          HG22      VAL   7  18.350 -15.626  -5.300
    9   HG22  VAL   7          HG23      VAL   7  17.328 -16.393  -6.512

  No H/Q in entry =           9
  In of MODEL   31
    1    H    VAL   8           H        VAL   8  13.546 -15.602  -3.562
    2    HA   VAL   8           HA       VAL   8  12.840 -12.903  -3.099
    3    HB   VAL   8           HB       VAL   8  11.265 -15.454  -2.663
    4   HG12  VAL   8          HG11      VAL   8   9.319 -13.716  -2.894
    5   HG11  VAL   8          HG12      VAL   8  10.535 -12.544  -2.386
    6   HG13  VAL   8          HG13      VAL   8  10.122 -13.898  -1.335
    7   HG22  VAL   8          HG21      VAL   8  10.656 -15.310  -4.885
    8   HG21  VAL   8          HG22      VAL   8  12.139 -14.371  -5.030
    9   HG23  VAL   8          HG23      VAL   8  10.592 -13.547  -4.851

  No H/Q in entry =           9
  In of MODEL   31
    1    H    MET   9           H        MET   9  13.142 -15.699  -0.911
    2    HA   MET   9           HA       MET   9  12.302 -14.434   1.454
    3    HB2  MET   9           HB2      MET   9  14.195 -16.705   0.891
    4    HB3  MET   9           HB3      MET   9  13.989 -16.099   2.534
    5    HG2  MET   9           HG2      MET   9  11.452 -16.354   2.105
    6    HG3  MET   9           HG3      MET   9  11.924 -17.349   0.726
    7    HE1  MET   9           HE1      MET   9  13.031 -19.463   0.721
    8    HE3  MET   9           HE2      MET   9  13.665 -20.368   2.093
    9    HE2  MET   9           HE3      MET   9  14.486 -18.906   1.558

  No H/Q in entry =           9
  In of MODEL   31
    1    H    GLY  10           H        GLY  10  15.490 -14.614  -0.094
    2    HA3  GLY  10           HA2      GLY  10  16.922 -13.166   1.876
    3    HA2  GLY  10           HA3      GLY  10  17.392 -13.329   0.185

  No H/Q in entry =           3
  In of MODEL   31
    1    H    LEU  11           H        LEU  11  15.209 -12.144  -1.063
    2    HA   LEU  11           HA       LEU  11  15.850  -9.388  -0.905
    3    HB2  LEU  11           HB2      LEU  11  13.508 -10.838  -2.143
    4    HB3  LEU  11           HB3      LEU  11  13.762  -9.100  -2.306
    5    HG   LEU  11           HG       LEU  11  15.824 -11.178  -3.083
    6   HD13  LEU  11          HD11      LEU  11  14.089 -11.576  -4.607
    7   HD12  LEU  11          HD12      LEU  11  15.075 -10.381  -5.448
    8   HD11  LEU  11          HD13      LEU  11  13.591  -9.884  -4.634
    9   HD22  LEU  11          HD21      LEU  11  17.024  -9.195  -2.859
   10   HD21  LEU  11          HD22      LEU  11  15.634  -8.181  -3.244
   11   HD23  LEU  11          HD23      LEU  11  16.482  -9.039  -4.529

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  12           H        ILE  12  13.108 -11.255   0.359
    2    HA   ILE  12           HA       ILE  12  11.676  -9.051   1.410
    3    HB   ILE  12           HB       ILE  12  11.759 -11.945   2.318
    4   HG12  ILE  12          HG12      ILE  12  10.999 -11.301  -0.081
    5   HG13  ILE  12          HG13      ILE  12   9.950 -12.347   0.854
    6   HG21  ILE  12          HG21      ILE  12   9.826  -9.708   3.008
    7   HG23  ILE  12          HG22      ILE  12  10.861 -10.594   4.127
    8   HG22  ILE  12          HG23      ILE  12   9.517 -11.413   3.332
    9   HD13  ILE  12          HD11      ILE  12   8.540 -10.434   1.422
   10   HD12  ILE  12          HD12      ILE  12   8.723 -10.540  -0.328
   11   HD11  ILE  12          HD13      ILE  12   9.637  -9.353   0.577

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  13           H        ILE  13  14.101 -11.213   2.827
    2    HA   ILE  13           HA       ILE  13  14.110 -10.027   5.405
    3    HB   ILE  13           HB       ILE  13  16.205 -11.564   3.849
    4   HG12  ILE  13          HG12      ILE  13  13.933 -12.565   4.683
    5   HG13  ILE  13          HG13      ILE  13  15.421 -13.470   4.937
    6   HG22  ILE  13          HG21      ILE  13  17.153 -11.909   6.269
    7   HG21  ILE  13          HG22      ILE  13  16.312 -10.409   6.633
    8   HG23  ILE  13          HG23      ILE  13  17.566 -10.436   5.394
    9   HD13  ILE  13          HD11      ILE  13  15.543 -12.738   7.257
   10   HD12  ILE  13          HD12      ILE  13  13.921 -13.355   6.961
   11   HD11  ILE  13          HD13      ILE  13  14.204 -11.619   7.008

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ASN  14           H        ASN  14  16.062  -9.470   2.491
    2    HA   ASN  14           HA       ASN  14  17.770  -7.496   3.552
    3    HB2  ASN  14           HB2      ASN  14  17.776  -8.768   1.240
    4    HB3  ASN  14           HB3      ASN  14  16.860  -7.368   0.697
    5   HD21  ASN  14          HD21      ASN  14  19.309  -7.668  -0.481
    6   HD22  ASN  14          HD22      ASN  14  20.431  -6.563   0.146

  No H/Q in entry =           6
  In of MODEL   31
    1    H    SER  15           H        SER  15  14.658  -7.208   1.850
    2    HA   SER  15           HA       SER  15  14.495  -4.390   1.900
    3    HB2  SER  15           HB2      SER  15  12.169  -4.680   1.399
    4    HB3  SER  15           HB3      SER  15  12.993  -6.031   0.632
    5    HG   SER  15           HG       SER  15  11.691  -7.210   1.774

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLY  16           H        GLY  16  13.440  -6.864   4.206
    2    HA3  GLY  16           HA2      GLY  16  12.181  -5.133   6.056
    3    HA2  GLY  16           HA3      GLY  16  12.824  -6.729   6.423

  No H/Q in entry =           3
  In of MODEL   31
    1    H    GLN  17           H        GLN  17  15.531  -6.348   5.838
    2    HA   GLN  17           HA       GLN  17  16.458  -5.103   8.219
    3    HB2  GLN  17           HB2      GLN  17  17.905  -5.926   5.686
    4    HB3  GLN  17           HB3      GLN  17  18.730  -5.320   7.123
    5    HG2  GLN  17           HG2      GLN  17  16.860  -7.702   7.125
    6    HG3  GLN  17           HG3      GLN  17  18.614  -7.827   7.014
    7   HE21  GLN  17          HE21      GLN  17  19.856  -7.464   8.944
    8   HE22  GLN  17          HE22      GLN  17  19.133  -7.216  10.459

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ALA  18           H        ALA  18  16.259  -4.038   4.855
    2    HA   ALA  18           HA       ALA  18  17.650  -1.618   5.081
    3    HB2  ALA  18           HB1      ALA  18  16.561  -2.858   3.013
    4    HB3  ALA  18           HB2      ALA  18  16.793  -1.111   2.994
    5    HB1  ALA  18           HB3      ALA  18  15.205  -1.785   3.360

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ARG  19           H        ARG  19  14.160  -2.270   5.468
    2    HA   ARG  19           HA       ARG  19  13.440   0.369   6.175
    3    HB2  ARG  19           HB2      ARG  19  11.794  -1.416   5.587
    4    HB3  ARG  19           HB3      ARG  19  12.146  -2.203   7.127
    5    HG2  ARG  19           HG2      ARG  19  11.395  -0.223   8.360
    6    HG3  ARG  19           HG3      ARG  19  11.133   0.645   6.848
    7    HD2  ARG  19           HD2      ARG  19   9.004  -0.189   7.664
    8    HD3  ARG  19           HD3      ARG  19   9.444  -1.064   6.191
    9    HE   ARG  19           HE       ARG  19  10.425  -2.583   8.303
   10   HH21  ARG  19          HH11      ARG  19   9.204  -4.244   9.242
   11   HH22  ARG  19          HH12      ARG  19   7.484  -4.250   9.066
   12   HH11  ARG  19          HH21      ARG  19   7.410  -1.350   7.195
   13   HH12  ARG  19          HH22      ARG  19   6.469  -2.611   7.903

  No H/Q in entry =          13
  In of MODEL   31
    1    H    SER  20           H        SER  20  14.345  -2.440   8.144
    2    HA   SER  20           HA       SER  20  14.033  -1.340  10.677
    3    HB2  SER  20           HB2      SER  20  14.543  -3.656  10.564
    4    HB3  SER  20           HB3      SER  20  15.993  -3.369   9.603
    5    HG   SER  20           HG       SER  20  16.827  -2.245  11.464

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU  21           H        LEU  21  16.882  -1.231   8.550
    2    HA   LEU  21           HA       LEU  21  18.522   0.291  10.290
    3    HB2  LEU  21           HB2      LEU  21  18.515   0.007   7.277
    4    HB3  LEU  21           HB3      LEU  21  19.748   0.899   8.164
    5    HG   LEU  21           HG       LEU  21  19.072  -2.003   8.725
    6   HD12  LEU  21          HD11      LEU  21  21.395  -2.279   7.536
    7   HD11  LEU  21          HD12      LEU  21  20.991  -0.733   6.789
    8   HD13  LEU  21          HD13      LEU  21  19.936  -2.125   6.556
    9   HD22  LEU  21          HD21      LEU  21  20.219  -1.219  10.616
   10   HD21  LEU  21          HD22      LEU  21  21.181  -0.068   9.697
   11   HD23  LEU  21          HD23      LEU  21  21.560  -1.780   9.622

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ALA  22           H        ALA  22  16.249   1.211   7.724
    2    HA   ALA  22           HA       ALA  22  16.736   3.979   7.733
    3    HB3  ALA  22           HB1      ALA  22  15.362   2.707   6.053
    4    HB2  ALA  22           HB2      ALA  22  14.625   4.207   6.614
    5    HB1  ALA  22           HB3      ALA  22  14.062   2.659   7.243

  No H/Q in entry =           5
  In of MODEL   31
    1    H    TYR  23           H        TYR  23  14.267   2.121   9.564
    2    HA   TYR  23           HA       TYR  23  13.259   4.343  11.005
    3    HB2  TYR  23           HB2      TYR  23  12.064   2.206  10.985
    4    HB3  TYR  23           HB3      TYR  23  13.407   1.424  11.818
    5    HD1  TYR  23           HD1      TYR  23  10.854   4.125  12.163
    6    HD2  TYR  23           HD2      TYR  23  13.587   1.492  14.175
    7    HE1  TYR  23           HE1      TYR  23   9.904   4.808  14.351
    8    HE2  TYR  23           HE2      TYR  23  12.636   2.174  16.361
    9    HH   TYR  23           HH       TYR  23  10.809   4.861  16.811

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ALA  24           H        ALA  24  15.943   2.119  11.656
    2    HA   ALA  24           HA       ALA  24  16.586   3.132  14.220
    3    HB1  ALA  24           HB1      ALA  24  17.976   1.364  14.064
    4    HB3  ALA  24           HB2      ALA  24  18.990   2.301  12.966
    5    HB2  ALA  24           HB3      ALA  24  17.717   1.268  12.323

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA  25           H        ALA  25  17.537   4.071  10.942
    2    HA   ALA  25           HA       ALA  25  19.445   6.042  11.589
    3    HB1  ALA  25           HB1      ALA  25  18.753   5.075   9.274
    4    HB3  ALA  25           HB2      ALA  25  19.224   6.772   9.364
    5    HB2  ALA  25           HB3      ALA  25  17.517   6.334   9.291

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU  26           H        LEU  26  15.928   6.206  11.216
    2    HA   LEU  26           HA       LEU  26  15.652   8.985  11.659
    3    HB2  LEU  26           HB2      LEU  26  13.816   7.714  10.728
    4    HB3  LEU  26           HB3      LEU  26  13.739   6.688  12.156
    5    HG   LEU  26           HG       LEU  26  13.094   8.638  13.529
    6   HD12  LEU  26          HD11      LEU  26  12.400  10.723  12.197
    7   HD11  LEU  26          HD12      LEU  26  13.396  10.085  10.892
    8   HD13  LEU  26          HD13      LEU  26  14.129  10.486  12.446
    9   HD21  LEU  26          HD21      LEU  26  11.432   8.289  11.015
   10   HD23  LEU  26          HD22      LEU  26  10.854   8.980  12.528
   11   HD22  LEU  26          HD23      LEU  26  11.337   7.287  12.463

  No H/Q in entry =          11
  In of MODEL   31
    1    H    LYS  27           H        LYS  27  15.586   6.209  13.859
    2    HA   LYS  27           HA       LYS  27  14.961   7.569  16.222
    3    HB2  LYS  27           HB2      LYS  27  15.034   5.094  15.963
    4    HB3  LYS  27           HB3      LYS  27  16.796   5.177  15.925
    5    HG2  LYS  27           HG2      LYS  27  16.821   6.169  18.172
    6    HG3  LYS  27           HG3      LYS  27  15.054   6.157  18.212
    7    HD2  LYS  27           HD2      LYS  27  15.072   3.689  17.981
    8    HD3  LYS  27           HD3      LYS  27  16.837   3.709  17.975
    9    HE2  LYS  27           HE2      LYS  27  16.847   4.704  20.230
   10    HE3  LYS  27           HE3      LYS  27  15.080   4.714  20.238
   11    HZ3  LYS  27           HZ1      LYS  27  15.898   2.778  21.396
   12    HZ2  LYS  27           HZ2      LYS  27  16.827   2.311  20.049
   13    HZ1  LYS  27           HZ3      LYS  27  15.129   2.287  19.964

  No H/Q in entry =          13
  In of MODEL   31
    1    H    GLN  28           H        GLN  28  18.093   7.037  14.641
    2    HA   GLN  28           HA       GLN  28  19.752   8.153  16.635
    3    HB2  GLN  28           HB2      GLN  28  20.050   8.106  13.621
    4    HB3  GLN  28           HB3      GLN  28  21.325   8.601  14.734
    5    HG2  GLN  28           HG2      GLN  28  19.950   5.900  14.774
    6    HG3  GLN  28           HG3      GLN  28  21.531   6.212  14.061
    7   HE21  GLN  28          HE21      GLN  28  20.211   4.943  16.793
    8   HE22  GLN  28          HE22      GLN  28  21.410   5.360  17.919

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ALA  29           H        ALA  29  17.984   9.601  13.933
    2    HA   ALA  29           HA       ALA  29  18.939  12.238  14.184
    3    HB2  ALA  29           HB1      ALA  29  17.235  12.843  12.705
    4    HB1  ALA  29           HB2      ALA  29  16.108  11.653  13.355
    5    HB3  ALA  29           HB3      ALA  29  17.451  11.130  12.338

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LYS  30           H        LYS  30  16.184  10.597  15.699
    2    HA   LYS  30           HA       LYS  30  15.129  12.837  17.048
    3    HB2  LYS  30           HB2      LYS  30  15.062   9.896  17.758
    4    HB3  LYS  30           HB3      LYS  30  14.174  11.134  18.646
    5    HG2  LYS  30           HG2      LYS  30  13.045  11.797  16.522
    6    HG3  LYS  30           HG3      LYS  30  13.873  10.472  15.701
    7    HD2  LYS  30           HD2      LYS  30  12.822   8.852  17.230
    8    HD3  LYS  30           HD3      LYS  30  12.004  10.166  18.075
    9    HE2  LYS  30           HE2      LYS  30  10.833  10.776  15.977
   10    HE3  LYS  30           HE3      LYS  30  11.631   9.432  15.152
   11    HZ2  LYS  30           HZ1      LYS  30   9.327   8.989  16.026
   12    HZ1  LYS  30           HZ2      LYS  30   9.988   9.055  17.595
   13    HZ3  LYS  30           HZ3      LYS  30  10.519   7.876  16.489

  No H/Q in entry =          13
  In of MODEL   31
    1    H    GLN  31           H        GLN  31  17.821  10.711  17.798
    2    HA   GLN  31           HA       GLN  31  18.124  11.736  20.492
    3    HB2  GLN  31           HB2      GLN  31  20.176  10.193  18.897
    4    HB3  GLN  31           HB3      GLN  31  20.035  10.320  20.650
    5    HG2  GLN  31           HG2      GLN  31  17.539   9.327  19.876
    6    HG3  GLN  31           HG3      GLN  31  18.657   8.497  18.801
    7   HE21  GLN  31          HE21      GLN  31  17.125   7.332  21.075
    8   HE22  GLN  31          HE22      GLN  31  18.287   6.692  22.130

  No H/Q in entry =           8
  In of MODEL   31
    1    H    GLY  32           H        GLY  32  18.632  13.055  17.524
    2    HA3  GLY  32           HA2      GLY  32  19.586  15.114  17.008
    3    HA2  GLY  32           HA3      GLY  32  20.338  15.134  18.599

  No H/Q in entry =           3
  In of MODEL   31
    1    H    ASP  33           H        ASP  33  20.811  12.245  16.829
    2    HA   ASP  33           HA       ASP  33  23.627  12.963  16.371
    3    HB2  ASP  33           HB2      ASP  33  22.159  10.324  16.488
    4    HB3  ASP  33           HB3      ASP  33  23.845  10.466  15.998

  No H/Q in entry =           4
  In of MODEL   31
    1    H    PHE  34           H        PHE  34  23.131  14.275  14.485
    2    HA   PHE  34           HA       PHE  34  21.805  13.265  12.196
    3    HB2  PHE  34           HB2      PHE  34  23.902  15.432  12.428
    4    HB3  PHE  34           HB3      PHE  34  22.926  15.124  10.993
    5    HD1  PHE  34           HD1      PHE  34  23.137  17.068  13.904
    6    HD2  PHE  34           HD2      PHE  34  20.301  14.902  11.513
    7    HE1  PHE  34           HE1      PHE  34  21.295  18.438  14.842
    8    HE2  PHE  34           HE2      PHE  34  18.463  16.273  12.454
    9    HZ   PHE  34           HZ       PHE  34  18.964  18.042  14.114

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ALA  35           H        ALA  35  25.179  13.133  13.215
    2    HA   ALA  35           HA       ALA  35  26.305  12.324  10.763
    3    HB3  ALA  35           HB1      ALA  35  27.999  11.185  12.490
    4    HB2  ALA  35           HB2      ALA  35  27.115  12.199  13.631
    5    HB1  ALA  35           HB3      ALA  35  27.944  12.933  12.260

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA  36           H        ALA  36  25.212  10.356  13.529
    2    HA   ALA  36           HA       ALA  36  25.741   7.874  12.260
    3    HB2  ALA  36           HB1      ALA  36  25.315   7.125  14.336
    4    HB3  ALA  36           HB2      ALA  36  23.620   7.592  14.180
    5    HB1  ALA  36           HB3      ALA  36  24.800   8.745  14.804

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA  37           H        ALA  37  22.884   9.954  12.380
    2    HA   ALA  37           HA       ALA  37  21.061   8.152  11.203
    3    HB3  ALA  37           HB1      ALA  37  21.237  11.119  11.489
    4    HB1  ALA  37           HB2      ALA  37  19.941  10.019  11.960
    5    HB2  ALA  37           HB3      ALA  37  20.128  10.491  10.270

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LYS  38           H        LYS  38  23.124  10.644   9.725
    2    HA   LYS  38           HA       LYS  38  22.500  10.200   7.047
    3    HB2  LYS  38           HB2      LYS  38  24.279  11.791   8.494
    4    HB3  LYS  38           HB3      LYS  38  25.332  10.816   7.474
    5    HG2  LYS  38           HG2      LYS  38  24.161  11.563   5.472
    6    HG3  LYS  38           HG3      LYS  38  22.949  12.399   6.448
    7    HD2  LYS  38           HD2      LYS  38  24.514  14.026   7.202
    8    HD3  LYS  38           HD3      LYS  38  25.893  13.062   6.673
    9    HE2  LYS  38           HE2      LYS  38  25.509  14.924   5.116
   10    HE3  LYS  38           HE3      LYS  38  25.203  13.379   4.314
   11    HZ3  LYS  38           HZ1      LYS  38  22.999  13.786   4.176
   12    HZ2  LYS  38           HZ2      LYS  38  23.494  15.410   4.261
   13    HZ1  LYS  38           HZ3      LYS  38  22.929  14.619   5.654

  No H/Q in entry =          13
  In of MODEL   31
    1    H    ALA  39           H        ALA  39  25.035   8.650   9.014
    2    HA   ALA  39           HA       ALA  39  26.138   7.075   6.951
    3    HB2  ALA  39           HB1      ALA  39  26.057   6.117   9.797
    4    HB1  ALA  39           HB2      ALA  39  26.986   7.558   9.381
    5    HB3  ALA  39           HB3      ALA  39  27.367   6.012   8.622

  No H/Q in entry =           5
  In of MODEL   31
    1    H    MET  40           H        MET  40  23.529   6.419   9.243
    2    HA   MET  40           HA       MET  40  23.135   3.705   8.513
    3    HB2  MET  40           HB2      MET  40  21.279   5.720   9.795
    4    HB3  MET  40           HB3      MET  40  20.903   4.003   9.623
    5    HG2  MET  40           HG2      MET  40  23.432   4.992  10.970
    6    HG3  MET  40           HG3      MET  40  21.939   4.692  11.859
    7    HE3  MET  40           HE1      MET  40  21.439   1.050  12.041
    8    HE2  MET  40           HE2      MET  40  20.550   2.335  11.228
    9    HE1  MET  40           HE3      MET  40  21.281   2.639  12.802

  No H/Q in entry =           9
  In of MODEL   31
    1    H    MET  41           H        MET  41  21.672   6.731   7.315
    2    HA   MET  41           HA       MET  41  19.741   5.498   5.639
    3    HB2  MET  41           HB2      MET  41  21.178   8.113   5.125
    4    HB3  MET  41           HB3      MET  41  19.661   7.590   4.403
    5    HG2  MET  41           HG2      MET  41  18.911   7.394   6.952
    6    HG3  MET  41           HG3      MET  41  20.198   8.575   7.176
    7    HE2  MET  41           HE1      MET  41  19.623   9.846   3.834
    8    HE1  MET  41           HE2      MET  41  20.567  10.305   5.248
    9    HE3  MET  41           HE3      MET  41  19.277  11.361   4.677

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ASP  42           H        ASP  42  23.099   6.480   5.095
    2    HA   ASP  42           HA       ASP  42  23.208   6.001   2.338
    3    HB2  ASP  42           HB2      ASP  42  24.935   7.034   4.111
    4    HB3  ASP  42           HB3      ASP  42  25.622   5.420   3.989

  No H/Q in entry =           4
  In of MODEL   31
    1    H    GLN  43           H        GLN  43  23.962   3.866   5.066
    2    HA   GLN  43           HA       GLN  43  24.672   1.617   3.490
    3    HB2  GLN  43           HB2      GLN  43  23.637   1.788   6.330
    4    HB3  GLN  43           HB3      GLN  43  24.245   0.308   5.580
    5    HG2  GLN  43           HG2      GLN  43  26.388   1.556   5.073
    6    HG3  GLN  43           HG3      GLN  43  25.778   2.875   6.068
    7   HE21  GLN  43          HE21      GLN  43  28.025   1.944   7.113
    8   HE22  GLN  43          HE22      GLN  43  27.766   0.860   8.391

  No H/Q in entry =           8
  In of MODEL   31
    1    H    SER  44           H        SER  44  21.591   2.699   4.863
    2    HA   SER  44           HA       SER  44  20.065   0.426   4.191
    3    HB2  SER  44           HB2      SER  44  19.575   2.949   5.329
    4    HB3  SER  44           HB3      SER  44  18.546   2.884   3.901
    5    HG   SER  44           HG       SER  44  17.464   1.925   5.623

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ARG  45           H        ARG  45  20.760   3.400   2.381
    2    HA   ARG  45           HA       ARG  45  19.251   2.882   0.073
    3    HB2  ARG  45           HB2      ARG  45  20.355   5.039   0.656
    4    HB3  ARG  45           HB3      ARG  45  21.914   4.311   0.277
    5    HG2  ARG  45           HG2      ARG  45  21.145   3.887  -2.039
    6    HG3  ARG  45           HG3      ARG  45  19.598   4.638  -1.658
    7    HD2  ARG  45           HD2      ARG  45  20.809   6.758  -1.075
    8    HD3  ARG  45           HD3      ARG  45  22.320   6.010  -1.637
    9    HE   ARG  45           HE       ARG  45  20.401   5.733  -3.679
   10   HH21  ARG  45          HH11      ARG  45  20.375   7.098  -5.445
   11   HH22  ARG  45          HH12      ARG  45  21.104   8.662  -5.342
   12   HH11  ARG  45          HH21      ARG  45  22.082   8.266  -2.052
   13   HH12  ARG  45          HH22      ARG  45  22.069   9.322  -3.418

  No H/Q in entry =          13
  In of MODEL   31
    1    H    MET  46           H        MET  46  22.628   2.068   0.832
    2    HA   MET  46           HA       MET  46  23.262   0.881  -1.647
    3    HB2  MET  46           HB2      MET  46  24.366   0.581   1.146
    4    HB3  MET  46           HB3      MET  46  25.042  -0.305  -0.225
    5    HG2  MET  46           HG2      MET  46  25.455   1.803  -1.415
    6    HG3  MET  46           HG3      MET  46  24.726   2.709  -0.096
    7    HE3  MET  46           HE1      MET  46  27.392  -0.454   0.159
    8    HE2  MET  46           HE2      MET  46  28.737   0.584  -0.305
    9    HE1  MET  46           HE3      MET  46  27.336   0.441  -1.366

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ALA  47           H        ALA  47  21.894  -0.470   1.328
    2    HA   ALA  47           HA       ALA  47  21.889  -3.185   0.531
    3    HB2  ALA  47           HB1      ALA  47  21.496  -2.725   2.834
    4    HB3  ALA  47           HB2      ALA  47  19.971  -3.356   2.212
    5    HB1  ALA  47           HB3      ALA  47  20.171  -1.621   2.467

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU  48           H        LEU  48  19.493  -0.599   0.162
    2    HA   LEU  48           HA       LEU  48  17.477  -2.169  -1.090
    3    HB2  LEU  48           HB2      LEU  48  18.082   0.795  -1.210
    4    HB3  LEU  48           HB3      LEU  48  16.625   0.059  -1.878
    5    HG   LEU  48           HG       LEU  48  17.476  -0.222   1.013
    6   HD13  LEU  48          HD11      LEU  48  17.021   2.071   0.820
    7   HD12  LEU  48          HD12      LEU  48  15.472   1.399   1.327
    8   HD11  LEU  48          HD13      LEU  48  15.740   1.821  -0.365
    9   HD22  LEU  48          HD21      LEU  48  15.977  -1.962   0.633
   10   HD21  LEU  48          HD22      LEU  48  15.091  -1.077  -0.609
   11   HD23  LEU  48          HD23      LEU  48  14.868  -0.672   1.092

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ASN  49           H        ASN  49  20.135  -0.200  -2.319
    2    HA   ASN  49           HA       ASN  49  19.492  -0.301  -5.044
    3    HB2  ASN  49           HB2      ASN  49  21.143   1.246  -4.127
    4    HB3  ASN  49           HB3      ASN  49  22.192  -0.094  -3.681
    5   HD21  ASN  49          HD21      ASN  49  23.193   1.897  -5.363
    6   HD22  ASN  49          HD22      ASN  49  23.384   1.278  -6.930

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLU  50           H        GLU  50  21.508  -2.458  -3.072
    2    HA   GLU  50           HA       GLU  50  22.242  -4.207  -5.192
    3    HB2  GLU  50           HB2      GLU  50  23.435  -4.157  -3.023
    4    HB3  GLU  50           HB3      GLU  50  22.001  -4.806  -2.229
    5    HG2  GLU  50           HG2      GLU  50  22.127  -6.841  -3.582
    6    HG3  GLU  50           HG3      GLU  50  23.494  -6.189  -4.482

  No H/Q in entry =           6
  In of MODEL   31
    1    H    ALA  51           H        ALA  51  19.580  -4.179  -2.871
    2    HA   ALA  51           HA       ALA  51  18.456  -6.673  -3.624
    3    HB3  ALA  51           HB1      ALA  51  16.853  -6.189  -2.073
    4    HB1  ALA  51           HB2      ALA  51  16.614  -4.548  -2.676
    5    HB2  ALA  51           HB3      ALA  51  17.977  -4.909  -1.617

  No H/Q in entry =           5
  In of MODEL   31
    1    H    HIS  52           H        HIS  52  17.818  -3.338  -4.669
    2    HA   HIS  52           HA       HIS  52  15.717  -3.904  -6.471
    3    HB2  HIS  52           HB2      HIS  52  16.271  -1.627  -5.705
    4    HB3  HIS  52           HB3      HIS  52  17.788  -1.699  -6.601
    5    HD1  HIS  52           HD1      HIS  52  17.548  -1.966  -9.269
    6    HD2  HIS  52           HD2      HIS  52  14.059  -0.911  -7.245
    7    HE1  HIS  52           HE1      HIS  52  15.938  -1.097 -11.021
    8    HE2  HIS  52           HE2      HIS  52  13.807  -0.450  -9.802

  No H/Q in entry =           8
  In of MODEL   31
    1    H    LEU  53           H        LEU  53  19.236  -3.853  -6.898
    2    HA   LEU  53           HA       LEU  53  19.303  -4.176  -9.697
    3    HB2  LEU  53           HB2      LEU  53  21.244  -4.896  -7.516
    4    HB3  LEU  53           HB3      LEU  53  21.570  -5.287  -9.202
    5    HG   LEU  53           HG       LEU  53  20.849  -2.483  -8.295
    6   HD13  LEU  53          HD11      LEU  53  22.891  -3.103  -7.133
    7   HD12  LEU  53          HD12      LEU  53  23.309  -2.032  -8.470
    8   HD11  LEU  53          HD13      LEU  53  23.574  -3.766  -8.614
    9   HD23  LEU  53          HD21      LEU  53  22.273  -2.030 -10.448
   10   HD22  LEU  53          HD22      LEU  53  20.607  -2.569 -10.635
   11   HD21  LEU  53          HD23      LEU  53  21.923  -3.708 -10.844

  No H/Q in entry =          11
  In of MODEL   31
    1    H    VAL  54           H        VAL  54  19.225  -6.556  -7.064
    2    HA   VAL  54           HA       VAL  54  19.390  -8.853  -8.717
    3    HB   VAL  54           HB       VAL  54  18.224  -8.441  -5.953
    4   HG12  VAL  54          HG11      VAL  54  18.592 -11.053  -5.940
    5   HG11  VAL  54          HG12      VAL  54  18.407 -10.892  -7.686
    6   HG13  VAL  54          HG13      VAL  54  17.108 -10.380  -6.612
    7   HG22  VAL  54          HG21      VAL  54  20.535  -8.190  -5.726
    8   HG21  VAL  54          HG22      VAL  54  20.893  -9.280  -7.064
    9   HG23  VAL  54          HG23      VAL  54  20.371  -9.932  -5.510

  No H/Q in entry =           9
  In of MODEL   31
    1    H    GLN  55           H        GLN  55  16.628  -6.993  -7.445
    2    HA   GLN  55           HA       GLN  55  14.637  -8.694  -8.517
    3    HB2  GLN  55           HB2      GLN  55  13.860  -7.176  -6.896
    4    HB3  GLN  55           HB3      GLN  55  14.631  -5.797  -7.675
    5    HG2  GLN  55           HG2      GLN  55  12.904  -5.507  -9.169
    6    HG3  GLN  55           HG3      GLN  55  12.612  -7.233  -9.334
    7   HE21  GLN  55          HE21      GLN  55  10.613  -7.814  -8.531
    8   HE22  GLN  55          HE22      GLN  55   9.824  -7.069  -7.226

  No H/Q in entry =           8
  In of MODEL   31
    1    H    THR  56           H        THR  56  16.331  -5.869  -9.882
    2    HA   THR  56           HA       THR  56  14.891  -5.539 -12.234
    3    HB   THR  56           HB       THR  56  17.908  -5.397 -12.065
    4    HG1  THR  56           HG1      THR  56  15.890  -3.614 -11.206
    5   HG23  THR  56          HG21      THR  56  17.790  -3.990 -13.913
    6   HG22  THR  56          HG22      THR  56  16.116  -3.541 -13.591
    7   HG21  THR  56          HG23      THR  56  16.488  -5.128 -14.266

  No H/Q in entry =           7
  In of MODEL   31
    1    H    LYS  57           H        LYS  57  17.579  -7.788 -11.611
    2    HA   LYS  57           HA       LYS  57  17.605  -8.991 -14.185
    3    HB2  LYS  57           HB2      LYS  57  19.395  -9.206 -12.432
    4    HB3  LYS  57           HB3      LYS  57  18.306 -10.222 -11.500
    5    HG2  LYS  57           HG2      LYS  57  18.742 -11.024 -14.323
    6    HG3  LYS  57           HG3      LYS  57  20.115 -11.222 -13.242
    7    HD2  LYS  57           HD2      LYS  57  18.709 -12.538 -11.692
    8    HD3  LYS  57           HD3      LYS  57  17.335 -12.354 -12.781
    9    HE2  LYS  57           HE2      LYS  57  18.569 -13.538 -14.561
   10    HE3  LYS  57           HE3      LYS  57  19.965 -13.714 -13.498
   11    HZ2  LYS  57           HZ1      LYS  57  18.376 -15.657 -13.650
   12    HZ1  LYS  57           HZ2      LYS  57  17.295 -14.719 -12.737
   13    HZ3  LYS  57           HZ3      LYS  57  18.808 -15.142 -12.093

  No H/Q in entry =          13
  In of MODEL   31
    1    H    LEU  58           H        LEU  58  15.831  -9.680 -11.210
    2    HA   LEU  58           HA       LEU  58  14.653 -12.078 -12.139
    3    HB2  LEU  58           HB2      LEU  58  13.821 -10.179  -9.951
    4    HB3  LEU  58           HB3      LEU  58  13.042 -11.732 -10.264
    5    HG   LEU  58           HG       LEU  58  16.009 -11.400  -9.705
    6   HD11  LEU  58          HD11      LEU  58  13.643 -11.853  -7.915
    7   HD13  LEU  58          HD12      LEU  58  15.078 -10.863  -7.653
    8   HD12  LEU  58          HD13      LEU  58  15.182 -12.617  -7.512
    9   HD22  LEU  58          HD21      LEU  58  15.930 -13.466 -10.726
   10   HD21  LEU  58          HD22      LEU  58  14.219 -13.705 -10.368
   11   HD23  LEU  58          HD23      LEU  58  15.431 -13.980  -9.115

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  59           H        ILE  59  13.924  -8.755 -12.834
    2    HA   ILE  59           HA       ILE  59  11.222  -9.455 -13.776
    3    HB   ILE  59           HB       ILE  59  11.987  -7.155 -12.578
    4   HG12  ILE  59          HG12      ILE  59  10.072  -7.094 -14.923
    5   HG13  ILE  59          HG13      ILE  59   9.672  -7.838 -13.397
    6   HG23  ILE  59          HG21      ILE  59  12.537  -5.430 -14.089
    7   HG22  ILE  59          HG22      ILE  59  12.040  -6.355 -15.487
    8   HG21  ILE  59          HG23      ILE  59  13.533  -6.753 -14.642
    9   HD13  ILE  59          HD11      ILE  59  10.093  -5.719 -12.221
   10   HD12  ILE  59          HD12      ILE  59   8.859  -5.516 -13.462
   11   HD11  ILE  59          HD13      ILE  59  10.507  -4.958 -13.758

  No H/Q in entry =          11
  In of MODEL   31
    1    H    GLU  60           H        GLU  60  14.412  -8.551 -15.032
    2    HA   GLU  60           HA       GLU  60  13.630  -8.174 -17.743
    3    HB2  GLU  60           HB2      GLU  60  15.794  -7.400 -16.885
    4    HB3  GLU  60           HB3      GLU  60  16.286  -9.065 -16.587
    5    HG2  GLU  60           HG2      GLU  60  16.124  -9.561 -18.993
    6    HG3  GLU  60           HG3      GLU  60  15.592  -7.910 -19.306

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLY  61           H        GLY  61  14.655 -11.031 -15.917
    2    HA3  GLY  61           HA2      GLY  61  14.147 -12.696 -18.313
    3    HA2  GLY  61           HA3      GLY  61  15.186 -13.154 -16.968

  No H/Q in entry =           3
  In of MODEL   31
    1    H    ASP  62           H        ASP  62  12.038 -11.663 -16.607
    2    HA   ASP  62           HA       ASP  62  11.151 -13.773 -14.877
    3    HB2  ASP  62           HB2      ASP  62   9.071 -12.403 -14.764
    4    HB3  ASP  62           HB3      ASP  62  10.531 -11.506 -14.364

  No H/Q in entry =           4
  In of MODEL   31
    1    H    ALA  63           H        ALA  63  11.462 -14.045 -18.049
    2    HA   ALA  63           HA       ALA  63   8.933 -14.676 -19.128
    3    HB3  ALA  63           HB1      ALA  63  10.782 -14.529 -20.623
    4    HB2  ALA  63           HB2      ALA  63  10.291 -16.222 -20.642
    5    HB1  ALA  63           HB3      ALA  63  11.706 -15.725 -19.715

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLY  64           H        GLY  64  11.236 -16.607 -17.280
    2    HA3  GLY  64           HA2      GLY  64  11.042 -18.595 -16.157
    3    HA2  GLY  64           HA3      GLY  64   9.315 -18.274 -16.087

  No H/Q in entry =           3
  In of MODEL   31
    1    H    GLU  65           H        GLU  65   8.662 -20.400 -16.479
    2    HA   GLU  65           HA       GLU  65   9.745 -21.998 -18.551
    3    HB2  GLU  65           HB2      GLU  65   7.127 -22.211 -17.064
    4    HB3  GLU  65           HB3      GLU  65   7.748 -23.439 -18.167
    5    HG2  GLU  65           HG2      GLU  65   9.234 -22.410 -15.735
    6    HG3  GLU  65           HG3      GLU  65   8.312 -23.911 -15.778

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLY  66           H        GLY  66   6.895 -19.989 -18.371
    2    HA3  GLY  66           HA2      GLY  66   6.196 -20.484 -21.169
    3    HA2  GLY  66           HA3      GLY  66   5.186 -19.696 -19.974

  No H/Q in entry =           3
  In of MODEL   31
    1    H    LYS  67           H        LYS  67   5.148 -18.473 -22.226
    2    HA   LYS  67           HA       LYS  67   7.282 -16.569 -22.579
    3    HB2  LYS  67           HB2      LYS  67   4.660 -17.010 -24.000
    4    HB3  LYS  67           HB3      LYS  67   5.822 -15.759 -24.457
    5    HG2  LYS  67           HG2      LYS  67   7.576 -17.470 -24.725
    6    HG3  LYS  67           HG3      LYS  67   6.431 -18.724 -24.258
    7    HD2  LYS  67           HD2      LYS  67   5.034 -18.192 -26.214
    8    HD3  LYS  67           HD3      LYS  67   6.169 -16.925 -26.683
    9    HE2  LYS  67           HE2      LYS  67   7.965 -18.600 -26.895
   10    HE3  LYS  67           HE3      LYS  67   6.840 -19.871 -26.417
   11    HZ2  LYS  67           HZ1      LYS  67   7.140 -18.544 -28.953
   12    HZ1  LYS  67           HZ2      LYS  67   5.529 -18.646 -28.427
   13    HZ3  LYS  67           HZ3      LYS  67   6.462 -20.057 -28.593

  No H/Q in entry =          13
  In of MODEL   31
    1    H    MET  68           H        MET  68   3.842 -15.891 -22.550
    2    HA   MET  68           HA       MET  68   4.044 -13.217 -21.730
    3    HB2  MET  68           HB2      MET  68   1.806 -15.199 -21.910
    4    HB3  MET  68           HB3      MET  68   1.528 -13.604 -21.212
    5    HG2  MET  68           HG2      MET  68   1.033 -13.476 -23.577
    6    HG3  MET  68           HG3      MET  68   2.535 -12.598 -23.287
    7    HE3  MET  68           HE1      MET  68   3.444 -13.820 -26.642
    8    HE2  MET  68           HE2      MET  68   4.320 -12.942 -25.391
    9    HE1  MET  68           HE3      MET  68   2.611 -12.606 -25.660

  No H/Q in entry =           9
  In of MODEL   31
    1    H    LYS  69           H        LYS  69   3.384 -16.136 -19.772
    2    HA   LYS  69           HA       LYS  69   2.716 -14.694 -17.417
    3    HB2  LYS  69           HB2      LYS  69   3.478 -17.577 -17.866
    4    HB3  LYS  69           HB3      LYS  69   2.966 -16.937 -16.302
    5    HG2  LYS  69           HG2      LYS  69   0.869 -16.112 -17.349
    6    HG3  LYS  69           HG3      LYS  69   1.370 -16.834 -18.877
    7    HD2  LYS  69           HD2      LYS  69   1.097 -18.433 -16.324
    8    HD3  LYS  69           HD3      LYS  69  -0.222 -18.243 -17.482
    9    HE2  LYS  69           HE2      LYS  69   1.437 -19.065 -19.261
   10    HE3  LYS  69           HE3      LYS  69   2.461 -19.561 -17.916
   11    HZ2  LYS  69           HZ1      LYS  69   0.366 -20.972 -19.002
   12    HZ1  LYS  69           HZ2      LYS  69  -0.219 -20.398 -17.515
   13    HZ3  LYS  69           HZ3      LYS  69   1.198 -21.332 -17.569

  No H/Q in entry =          13
  In of MODEL   31
    1    H    VAL  70           H        VAL  70   3.789 -14.519 -15.387
    2    HA   VAL  70           HA       VAL  70   6.745 -14.725 -15.487
    3    HB   VAL  70           HB       VAL  70   6.841 -12.626 -14.181
    4   HG12  VAL  70          HG11      VAL  70   5.199 -12.222 -16.693
    5   HG11  VAL  70          HG12      VAL  70   6.897 -12.697 -16.727
    6   HG13  VAL  70          HG13      VAL  70   6.430 -11.148 -16.030
    7   HG23  VAL  70          HG21      VAL  70   4.530 -11.290 -14.391
    8   HG22  VAL  70          HG22      VAL  70   4.851 -12.349 -13.020
    9   HG21  VAL  70          HG23      VAL  70   3.858 -12.921 -14.360

  No H/Q in entry =           9
  In of MODEL   31
    1    H    SER  71           H        SER  71   7.723 -14.762 -13.304
    2    HA   SER  71           HA       SER  71   6.610 -16.753 -11.633
    3    HB2  SER  71           HB2      SER  71   9.039 -16.213 -11.752
    4    HB3  SER  71           HB3      SER  71   8.714 -14.689 -10.930
    5    HG   SER  71           HG       SER  71   8.844 -17.247  -9.950

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU  72           H        LEU  72   5.231 -16.638  -9.980
    2    HA   LEU  72           HA       LEU  72   3.640 -14.352  -9.546
    3    HB2  LEU  72           HB2      LEU  72   3.969 -16.900  -7.970
    4    HB3  LEU  72           HB3      LEU  72   2.779 -15.662  -7.572
    5    HG   LEU  72           HG       LEU  72   2.961 -16.953 -10.314
    6   HD11  LEU  72          HD11      LEU  72   1.276 -17.689  -7.904
    7   HD13  LEU  72          HD12      LEU  72   2.441 -18.714  -8.740
    8   HD12  LEU  72          HD13      LEU  72   0.941 -18.251  -9.542
    9   HD22  LEU  72          HD21      LEU  72   1.692 -14.994 -10.560
   10   HD21  LEU  72          HD22      LEU  72   1.026 -15.087  -8.937
   11   HD23  LEU  72          HD23      LEU  72   0.447 -16.181 -10.190

  No H/Q in entry =          11
  In of MODEL   31
    1    H    VAL  73           H        VAL  73   6.317 -15.736  -7.763
    2    HA   VAL  73           HA       VAL  73   6.224 -14.198  -5.435
    3    HB   VAL  73           HB       VAL  73   8.420 -14.967  -5.001
    4   HG13  VAL  73          HG11      VAL  73   8.230 -17.337  -5.460
    5   HG12  VAL  73          HG12      VAL  73   7.150 -17.031  -6.820
    6   HG11  VAL  73          HG13      VAL  73   6.610 -16.705  -5.173
    7   HG23  VAL  73          HG21      VAL  73   9.611 -16.132  -7.059
    8   HG22  VAL  73          HG22      VAL  73   9.758 -14.392  -6.812
    9   HG21  VAL  73          HG23      VAL  73   8.609 -15.020  -7.993

  No H/Q in entry =           9
  In of MODEL   31
    1    H    LEU  74           H        LEU  74   7.206 -13.295  -8.611
    2    HA   LEU  74           HA       LEU  74   9.115 -11.311  -8.119
    3    HB2  LEU  74           HB2      LEU  74   8.673 -12.078 -10.356
    4    HB3  LEU  74           HB3      LEU  74   7.001 -11.530 -10.261
    5    HG   LEU  74           HG       LEU  74   7.776  -9.193 -10.054
    6   HD13  LEU  74          HD11      LEU  74   9.888  -9.349  -8.988
    7   HD12  LEU  74          HD12      LEU  74  10.277  -8.871 -10.639
    8   HD11  LEU  74          HD13      LEU  74  10.475 -10.550 -10.139
    9   HD23  LEU  74          HD21      LEU  74   9.284 -10.262 -12.379
   10   HD22  LEU  74          HD22      LEU  74   8.099  -8.978 -12.290
   11   HD21  LEU  74          HD23      LEU  74   7.567 -10.645 -12.272

  No H/Q in entry =          11
  In of MODEL   31
    1    H    VAL  75           H        VAL  75   5.614 -10.989  -8.483
    2    HA   VAL  75           HA       VAL  75   5.467  -8.233  -7.904
    3    HB   VAL  75           HB       VAL  75   3.414 -10.411  -7.515
    4   HG11  VAL  75          HG11      VAL  75   3.168  -7.374  -7.374
    5   HG13  VAL  75          HG12      VAL  75   2.893  -8.505  -6.059
    6   HG12  VAL  75          HG13      VAL  75   1.803  -8.487  -7.436
    7   HG23  VAL  75          HG21      VAL  75   3.492  -8.241  -9.611
    8   HG22  VAL  75          HG22      VAL  75   2.626  -9.774  -9.652
    9   HG21  VAL  75          HG23      VAL  75   4.380  -9.746  -9.845

  No H/Q in entry =           9
  In of MODEL   31
    1    H    GLU  76           H        GLU  76   5.258 -11.109  -5.787
    2    HA   GLU  76           HA       GLU  76   4.756  -9.750  -3.371
    3    HB2  GLU  76           HB2      GLU  76   4.648 -12.236  -3.645
    4    HB3  GLU  76           HB3      GLU  76   6.397 -12.275  -3.791
    5    HG2  GLU  76           HG2      GLU  76   6.632 -11.389  -1.507
    6    HG3  GLU  76           HG3      GLU  76   4.890 -11.295  -1.333

  No H/Q in entry =           6
  In of MODEL   31
    1    H    ALA  77           H        ALA  77   7.836 -10.607  -4.922
    2    HA   ALA  77           HA       ALA  77   9.501  -9.529  -2.903
    3    HB3  ALA  77           HB1      ALA  77   9.946 -10.029  -5.848
    4    HB1  ALA  77           HB2      ALA  77  10.493 -11.006  -4.485
    5    HB2  ALA  77           HB3      ALA  77  11.214  -9.424  -4.780

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLN  78           H        GLN  78   8.094  -8.144  -5.826
    2    HA   GLN  78           HA       GLN  78   9.403  -5.641  -5.723
    3    HB2  GLN  78           HB2      GLN  78   8.129  -6.584  -7.683
    4    HB3  GLN  78           HB3      GLN  78   6.637  -6.228  -6.814
    5    HG2  GLN  78           HG2      GLN  78   7.238  -3.848  -6.732
    6    HG3  GLN  78           HG3      GLN  78   8.747  -4.190  -7.578
    7   HE21  GLN  78          HE21      GLN  78   6.793  -2.413  -8.700
    8   HE22  GLN  78          HE22      GLN  78   6.145  -3.145 -10.088

  No H/Q in entry =           8
  In of MODEL   31
    1    H    LEU  79           H        LEU  79   6.398  -6.827  -4.301
    2    HA   LEU  79           HA       LEU  79   5.360  -4.434  -3.302
    3    HB2  LEU  79           HB2      LEU  79   4.080  -6.508  -3.246
    4    HB3  LEU  79           HB3      LEU  79   5.233  -7.224  -2.124
    5    HG   LEU  79           HG       LEU  79   4.647  -5.587  -0.404
    6   HD13  LEU  79          HD11      LEU  79   4.151  -3.584  -1.462
    7   HD12  LEU  79          HD12      LEU  79   2.533  -4.136  -1.027
    8   HD11  LEU  79          HD13      LEU  79   3.124  -4.353  -2.673
    9   HD23  LEU  79          HD21      LEU  79   2.069  -6.123  -0.322
   10   HD22  LEU  79          HD22      LEU  79   3.230  -7.443  -0.205
   11   HD21  LEU  79          HD23      LEU  79   2.417  -7.123  -1.734

  No H/Q in entry =          11
  In of MODEL   31
    1    H    HIS  80           H        HIS  80   7.575  -6.728  -1.704
    2    HA   HIS  80           HA       HIS  80   7.828  -5.175   0.661
    3    HB2  HIS  80           HB2      HIS  80   9.210  -7.519  -0.525
    4    HB3  HIS  80           HB3      HIS  80  10.101  -6.604   0.692
    5    HD1  HIS  80           HD1      HIS  80   9.611  -7.242   3.035
    6    HD2  HIS  80           HD2      HIS  80   6.420  -8.153   0.512
    7    HE1  HIS  80           HE1      HIS  80   7.852  -8.371   4.479
    8    HE2  HIS  80           HE2      HIS  80   5.901  -8.930   2.950

  No H/Q in entry =           8
  In of MODEL   31
    1    H    LEU  81           H        LEU  81   9.850  -5.425  -2.242
    2    HA   LEU  81           HA       LEU  81  11.861  -3.648  -1.359
    3    HB2  LEU  81           HB2      LEU  81  10.965  -4.463  -4.124
    4    HB3  LEU  81           HB3      LEU  81  12.367  -3.433  -3.831
    5    HG   LEU  81           HG       LEU  81  12.014  -6.157  -2.551
    6   HD12  LEU  81          HD11      LEU  81  13.847  -6.758  -4.292
    7   HD11  LEU  81          HD12      LEU  81  13.262  -5.346  -5.169
    8   HD13  LEU  81          HD13      LEU  81  12.171  -6.687  -4.833
    9   HD23  LEU  81          HD21      LEU  81  14.636  -5.799  -2.527
   10   HD22  LEU  81          HD22      LEU  81  13.637  -5.051  -1.283
   11   HD21  LEU  81          HD23      LEU  81  14.205  -4.093  -2.650

  No H/Q in entry =          11
  In of MODEL   31
    1    H    MET  82           H        MET  82   8.937  -3.064  -3.310
    2    HA   MET  82           HA       MET  82   9.435  -0.332  -3.816
    3    HB2  MET  82           HB2      MET  82   6.901  -1.966  -3.698
    4    HB3  MET  82           HB3      MET  82   6.874  -0.243  -4.067
    5    HG2  MET  82           HG2      MET  82   8.514  -2.295  -5.590
    6    HG3  MET  82           HG3      MET  82   6.940  -1.699  -6.111
    7    HE3  MET  82           HE1      MET  82   7.338   1.760  -7.290
    8    HE2  MET  82           HE2      MET  82   6.960   1.532  -5.584
    9    HE1  MET  82           HE3      MET  82   6.318   0.409  -6.779

  No H/Q in entry =           9
  In of MODEL   31
    1    H    THR  83           H        THR  83   7.657  -1.951  -1.215
    2    HA   THR  83           HA       THR  83   6.763   0.387   0.102
    3    HB   THR  83           HB       THR  83   6.645  -1.185   2.123
    4    HG1  THR  83           HG1      THR  83   7.434  -3.123   1.902
    5   HG22  THR  83          HG21      THR  83   5.023  -2.780   0.652
    6   HG21  THR  83          HG22      THR  83   5.234  -1.451  -0.482
    7   HG23  THR  83          HG23      THR  83   4.581  -1.142   1.127

  No H/Q in entry =           7
  In of MODEL   31
    1    H    SER  84           H        SER  84   9.617  -1.665   0.640
    2    HA   SER  84           HA       SER  84  10.644  -0.213   2.829
    3    HB2  SER  84           HB2      SER  84  11.935  -2.041   0.815
    4    HB3  SER  84           HB3      SER  84  12.864  -1.269   2.099
    5    HG   SER  84           HG       SER  84  10.615  -2.994   2.353

  No H/Q in entry =           5
  In of MODEL   31
    1    H    MET  85           H        MET  85  11.409   0.051  -0.656
    2    HA   MET  85           HA       MET  85  13.375   2.047  -0.401
    3    HB2  MET  85           HB2      MET  85  13.011   0.755  -2.465
    4    HB3  MET  85           HB3      MET  85  11.470   1.580  -2.703
    5    HG2  MET  85           HG2      MET  85  12.629   3.747  -2.831
    6    HG3  MET  85           HG3      MET  85  14.172   2.944  -2.554
    7    HE3  MET  85           HE1      MET  85  14.369   4.006  -6.301
    8    HE2  MET  85           HE2      MET  85  15.166   4.043  -4.731
    9    HE1  MET  85           HE3      MET  85  13.624   4.864  -4.942

  No H/Q in entry =           9
  In of MODEL   31
    1    H    LEU  86           H        LEU  86   9.883   2.327  -0.927
    2    HA   LEU  86           HA       LEU  86   9.777   5.138  -1.116
    3    HB2  LEU  86           HB2      LEU  86   7.961   3.449  -1.696
    4    HB3  LEU  86           HB3      LEU  86   7.625   3.359   0.033
    5    HG   LEU  86           HG       LEU  86   7.426   5.917  -0.027
    6   HD11  LEU  86          HD11      LEU  86   8.220   5.486  -2.724
    7   HD13  LEU  86          HD12      LEU  86   7.757   7.009  -1.970
    8   HD12  LEU  86          HD13      LEU  86   6.540   6.025  -2.778
    9   HD23  LEU  86          HD21      LEU  86   5.320   4.528  -1.695
   10   HD22  LEU  86          HD22      LEU  86   5.105   5.788  -0.483
   11   HD21  LEU  86          HD23      LEU  86   5.527   4.151   0.016

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ALA  87           H        ALA  87   9.332   2.960   1.634
    2    HA   ALA  87           HA       ALA  87   8.746   4.871   3.595
    3    HB1  ALA  87           HB1      ALA  87   9.596   2.063   3.520
    4    HB3  ALA  87           HB2      ALA  87   8.454   2.861   4.599
    5    HB2  ALA  87           HB3      ALA  87  10.181   2.919   4.950

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ARG  88           H        ARG  88  11.855   3.490   2.632
    2    HA   ARG  88           HA       ARG  88  13.436   4.897   4.467
    3    HB2  ARG  88           HB2      ARG  88  14.139   2.930   3.072
    4    HB3  ARG  88           HB3      ARG  88  14.282   4.021   1.697
    5    HG2  ARG  88           HG2      ARG  88  15.727   5.362   3.646
    6    HG3  ARG  88           HG3      ARG  88  16.071   3.679   4.031
    7    HD2  ARG  88           HD2      ARG  88  17.350   3.396   2.190
    8    HD3  ARG  88           HD3      ARG  88  16.205   4.248   1.150
    9    HE   ARG  88           HE       ARG  88  18.578   5.350   2.204
   10   HH21  ARG  88          HH11      ARG  88  18.892   7.573   2.005
   11   HH22  ARG  88          HH12      ARG  88  17.525   8.624   1.854
   12   HH11  ARG  88          HH21      ARG  88  15.230   6.053   1.910
   13   HH12  ARG  88          HH22      ARG  88  15.451   7.761   1.775

  No H/Q in entry =          13
  In of MODEL   31
    1    H    GLU  89           H        GLU  89  12.463   5.772   1.138
    2    HA   GLU  89           HA       GLU  89  13.975   8.154   0.981
    3    HB2  GLU  89           HB2      GLU  89  12.855   7.091  -0.968
    4    HB3  GLU  89           HB3      GLU  89  11.300   7.611  -0.318
    5    HG2  GLU  89           HG2      GLU  89  11.967   9.958  -0.484
    6    HG3  GLU  89           HG3      GLU  89  13.580   9.490  -1.013

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LEU  90           H        LEU  90  10.649   7.598   2.099
    2    HA   LEU  90           HA       LEU  90  10.091  10.325   2.664
    3    HB2  LEU  90           HB2      LEU  90   8.931   7.736   3.694
    4    HB3  LEU  90           HB3      LEU  90   8.275   9.323   4.110
    5    HG   LEU  90           HG       LEU  90   8.718   8.442   1.245
    6   HD12  LEU  90          HD11      LEU  90   6.189   8.076   1.298
    7   HD11  LEU  90          HD12      LEU  90   6.337   8.072   3.055
    8   HD13  LEU  90          HD13      LEU  90   7.177   6.852   2.097
    9   HD22  LEU  90          HD21      LEU  90   8.390  10.745   1.164
   10   HD21  LEU  90          HD22      LEU  90   7.397  10.767   2.620
   11   HD23  LEU  90          HD23      LEU  90   6.714  10.197   1.097

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  91           H        ILE  91  11.386   7.668   4.599
    2    HA   ILE  91           HA       ILE  91  11.496   9.041   7.064
    3    HB   ILE  91           HB       ILE  91  13.089   6.723   5.953
    4   HG12  ILE  91          HG12      ILE  91  11.062   6.866   8.204
    5   HG13  ILE  91          HG13      ILE  91  10.602   6.574   6.527
    6   HG22  ILE  91          HG21      ILE  91  13.552   6.523   8.596
    7   HG21  ILE  91          HG22      ILE  91  13.450   8.280   8.490
    8   HG23  ILE  91          HG23      ILE  91  14.646   7.408   7.532
    9   HD13  ILE  91          HD11      ILE  91  11.636   4.487   6.467
   10   HD12  ILE  91          HD12      ILE  91  11.036   4.541   8.124
   11   HD11  ILE  91          HD13      ILE  91  12.734   4.878   7.791

  No H/Q in entry =          11
  In of MODEL   31
    1    H    THR  92           H        THR  92  13.726   8.898   4.322
    2    HA   THR  92           HA       THR  92  15.866  10.326   5.486
    3    HB   THR  92           HB       THR  92  14.893  10.179   2.622
    4    HG1  THR  92           HG1      THR  92  15.752   8.296   3.035
    5   HG22  THR  92          HG21      THR  92  17.454  10.907   2.336
    6   HG21  THR  92          HG22      THR  92  17.127  11.727   3.862
    7   HG23  THR  92          HG23      THR  92  16.157  12.096   2.437

  No H/Q in entry =           7
  In of MODEL   31
    1    H    GLU  93           H        GLU  93  12.969  11.432   3.743
    2    HA   GLU  93           HA       GLU  93  13.522  14.201   3.852
    3    HB2  GLU  93           HB2      GLU  93  10.838  12.788   3.859
    4    HB3  GLU  93           HB3      GLU  93  11.102  14.491   3.484
    5    HG2  GLU  93           HG2      GLU  93  12.479  12.265   1.967
    6    HG3  GLU  93           HG3      GLU  93  10.925  12.923   1.472

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LEU  94           H        LEU  94  11.803  12.025   6.062
    2    HA   LEU  94           HA       LEU  94  10.957  13.964   7.930
    3    HB2  LEU  94           HB2      LEU  94  11.576  11.018   8.214
    4    HB3  LEU  94           HB3      LEU  94  10.985  11.989   9.559
    5    HG   LEU  94           HG       LEU  94   9.510  12.012   6.925
    6   HD11  LEU  94          HD11      LEU  94   9.618   9.797   8.935
    7   HD13  LEU  94          HD12      LEU  94   9.325   9.727   7.199
    8   HD12  LEU  94          HD13      LEU  94   8.034  10.227   8.291
    9   HD23  LEU  94          HD21      LEU  94   7.579  12.386   8.517
   10   HD22  LEU  94          HD22      LEU  94   8.798  13.659   8.555
   11   HD21  LEU  94          HD23      LEU  94   8.749  12.445   9.832

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  95           H        ILE  95  13.960  12.079   7.709
    2    HA   ILE  95           HA       ILE  95  15.105  13.024  10.125
    3    HB   ILE  95           HB       ILE  95  16.369  11.967   7.585
    4   HG12  ILE  95          HG12      ILE  95  16.081  10.769  10.354
    5   HG13  ILE  95          HG13      ILE  95  14.923  10.490   9.055
    6   HG21  ILE  95          HG21      ILE  95  17.602  12.800  10.229
    7   HG23  ILE  95          HG22      ILE  95  18.063  13.330   8.610
    8   HG22  ILE  95          HG23      ILE  95  18.392  11.677   9.124
    9   HD13  ILE  95          HD11      ILE  95  16.427   9.231   7.801
   10   HD12  ILE  95          HD12      ILE  95  16.900   8.793   9.440
   11   HD11  ILE  95          HD13      ILE  95  17.839   9.985   8.541

  No H/Q in entry =          11
  In of MODEL   31
    1    H    GLU  96           H        GLU  96  15.253  14.251   6.788
    2    HA   GLU  96           HA       GLU  96  17.067  16.359   7.266
    3    HB2  GLU  96           HB2      GLU  96  16.421  15.681   5.006
    4    HB3  GLU  96           HB3      GLU  96  14.768  16.214   5.299
    5    HG2  GLU  96           HG2      GLU  96  15.305  18.350   4.754
    6    HG3  GLU  96           HG3      GLU  96  16.599  18.373   5.941

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LEU  97           H        LEU  97  13.557  16.120   7.683
    2    HA   LEU  97           HA       LEU  97  13.098  18.849   8.317
    3    HB2  LEU  97           HB2      LEU  97  11.615  16.302   8.932
    4    HB3  LEU  97           HB3      LEU  97  11.077  17.843   9.597
    5    HG   LEU  97           HG       LEU  97  11.577  17.427   6.635
    6   HD12  LEU  97          HD11      LEU  97   9.056  17.261   6.508
    7   HD11  LEU  97          HD12      LEU  97   9.046  17.066   8.259
    8   HD13  LEU  97          HD13      LEU  97   9.848  15.867   7.243
    9   HD23  LEU  97          HD21      LEU  97   9.809  19.365   6.656
   10   HD22  LEU  97          HD22      LEU  97  11.484  19.750   7.054
   11   HD21  LEU  97          HD23      LEU  97  10.293  19.566   8.340

  No H/Q in entry =          11
  In of MODEL   31
    1    H    HIS  98           H        HIS  98  13.954  16.040  10.323
    2    HA   HIS  98           HA       HIS  98  13.768  17.305  12.835
    3    HB2  HIS  98           HB2      HIS  98  15.555  15.072  11.845
    4    HB3  HIS  98           HB3      HIS  98  15.540  15.614  13.525
    5    HD1  HIS  98           HD1      HIS  98  13.374  13.946  10.929
    6    HD2  HIS  98           HD2      HIS  98  13.239  14.874  14.991
    7    HE1  HIS  98           HE1      HIS  98  11.364  12.723  11.877
    8    HE2  HIS  98           HE2      HIS  98  11.262  13.280  14.347

  No H/Q in entry =           8
  In of MODEL   31
    1    H    GLU  99           H        GLU  99  16.332  17.222  10.409
    2    HA   GLU  99           HA       GLU  99  18.292  18.586  11.942
    3    HB2  GLU  99           HB2      GLU  99  18.798  17.301   9.878
    4    HB3  GLU  99           HB3      GLU  99  17.973  18.541   8.931
    5    HG2  GLU  99           HG2      GLU  99  19.553  20.237   9.723
    6    HG3  GLU  99           HG3      GLU  99  20.346  19.049  10.752

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LYS 100           H        LYS 100  15.759  19.706   9.714
    2    HA   LYS 100           HA       LYS 100  16.516  22.455   9.854
    3    HB2  LYS 100           HB2      LYS 100  13.905  21.126   9.093
    4    HB3  LYS 100           HB3      LYS 100  14.180  22.868   8.999
    5    HG2  LYS 100           HG2      LYS 100  16.163  22.445   7.541
    6    HG3  LYS 100           HG3      LYS 100  15.775  20.722   7.561
    7    HD2  LYS 100           HD2      LYS 100  13.576  21.197   6.552
    8    HD3  LYS 100           HD3      LYS 100  13.948  22.922   6.539
    9    HE2  LYS 100           HE2      LYS 100  15.918  22.466   5.087
   10    HE3  LYS 100           HE3      LYS 100  15.478  20.755   5.056
   11    HZ1  LYS 100           HZ1      LYS 100  13.625  22.919   4.210
   12    HZ3  LYS 100           HZ2      LYS 100  13.465  21.246   3.951
   13    HZ2  LYS 100           HZ3      LYS 100  14.666  22.124   3.132

  No H/Q in entry =          13
  In of MODEL   31
    1    H    LEU 101           H        LEU 101  14.442  20.384  11.817
    2    HA   LEU 101           HA       LEU 101  13.241  22.439  13.386
    3    HB2  LEU 101           HB2      LEU 101  13.723  19.497  13.778
    4    HB3  LEU 101           HB3      LEU 101  13.169  20.472  15.135
    5    HG   LEU 101           HG       LEU 101  11.759  20.534  12.461
    6   HD12  LEU 101          HD11      LEU 101  10.118  18.950  13.728
    7   HD11  LEU 101          HD12      LEU 101  11.515  18.559  14.729
    8   HD13  LEU 101          HD13      LEU 101  11.559  18.249  12.992
    9   HD21  LEU 101          HD21      LEU 101  11.081  21.324  15.309
   10   HD23  LEU 101          HD22      LEU 101   9.827  21.078  14.095
   11   HD22  LEU 101          HD23      LEU 101  11.045  22.330  13.858

  No H/Q in entry =          11
  In of MODEL   31
    1    H    LYS 102           H        LYS 102  16.398  21.875  12.962
    2    HA   LYS 102           HA       LYS 102  18.228  22.774  14.038
    3    HB2  LYS 102           HB2      LYS 102  16.389  24.266  15.162
    4    HB3  LYS 102           HB3      LYS 102  16.606  23.210  16.542
    5    HG2  LYS 102           HG2      LYS 102  18.474  25.245  15.374
    6    HG3  LYS 102           HG3      LYS 102  18.091  24.929  17.053
    7    HD2  LYS 102           HD2      LYS 102  19.791  23.036  15.377
    8    HD3  LYS 102           HD3      LYS 102  20.458  24.370  16.309
    9    HE2  LYS 102           HE2      LYS 102  20.093  21.818  17.283
   10    HE3  LYS 102           HE3      LYS 102  20.287  23.265  18.271
   11    HZ2  LYS 102           HZ1      LYS 102  18.335  21.955  18.886
   12    HZ1  LYS 102           HZ2      LYS 102  17.693  22.173  17.334
   13    HZ3  LYS 102           HZ3      LYS 102  17.901  23.508  18.357

  No H/Q in entry =          13
  In of MODEL   31
    1    H    ALA 103           H        ALA 103  16.171  21.146  16.457
    2    HA   ALA 103           HA       ALA 103  17.909  19.963  18.121
    3    HB2  ALA 103           HB1      ALA 103  16.353  17.933  18.114
    4    HB1  ALA 103           HB2      ALA 103  15.450  18.771  16.852
    5    HB3  ALA 103           HB3      ALA 103  15.613  19.498  18.449

  No H/Q in entry =           5
  In of MODEL   31
    1    H1   ALA   1           H3       ALA   1  -1.505  -7.260 -21.503
    2    H2   ALA   1           H2       ALA   1  -2.281  -8.705 -21.050
    3    H3   ALA   1           H1       ALA   1  -0.671  -8.734 -21.599
    4    HA   ALA   1           HA       ALA   1  -1.491  -9.220 -23.597
    5    HB1  ALA   1           HB1      ALA   1  -3.620  -9.966 -23.129
    6    HB2  ALA   1           HB2      ALA   1  -4.077  -8.463 -23.932
    7    HB3  ALA   1           HB3      ALA   1  -4.021  -8.538 -22.173

  No H/Q in entry =           7
  In of MODEL   31
    1    H    GLU   2           H        GLU   2  -2.330  -8.045 -25.592
    2    HA   GLU   2           HA       GLU   2  -0.956  -6.014 -26.469
    3    HB2  GLU   2           HB2      GLU   2  -3.961  -6.123 -26.797
    4    HB3  GLU   2           HB3      GLU   2  -2.848  -5.247 -27.845
    5    HG2  GLU   2           HG2      GLU   2  -2.315  -7.132 -28.994
    6    HG3  GLU   2           HG3      GLU   2  -2.011  -8.031 -27.513

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLU   3           H        GLU   3  -4.136  -4.798 -25.583
    2    HA   GLU   3           HA       GLU   3  -3.127  -2.227 -24.957
    3    HB2  GLU   3           HB2      GLU   3  -5.798  -3.577 -24.632
    4    HB3  GLU   3           HB3      GLU   3  -5.524  -1.957 -23.988
    5    HG2  GLU   3           HG2      GLU   3  -5.173  -1.030 -26.114
    6    HG3  GLU   3           HG3      GLU   3  -4.754  -2.581 -26.834

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LEU   4           H        LEU   4  -4.693  -4.602 -22.778
    2    HA   LEU   4           HA       LEU   4  -4.354  -3.364 -20.388
    3    HB2  LEU   4           HB2      LEU   4  -3.770  -6.299 -20.849
    4    HB3  LEU   4           HB3      LEU   4  -4.191  -5.555 -19.308
    5    HG   LEU   4           HG       LEU   4  -5.954  -5.658 -21.779
    6   HD13  LEU   4          HD11      LEU   4  -7.127  -7.389 -20.781
    7   HD12  LEU   4          HD12      LEU   4  -6.655  -6.920 -19.149
    8   HD11  LEU   4          HD13      LEU   4  -5.504  -7.750 -20.195
    9   HD23  LEU   4          HD21      LEU   4  -7.656  -4.865 -19.919
   10   HD22  LEU   4          HD22      LEU   4  -6.631  -3.682 -20.728
   11   HD21  LEU   4          HD23      LEU   4  -6.202  -4.263 -19.120

  No H/Q in entry =          11
  In of MODEL   31
    1    H    GLU   5           H        GLU   5  -1.825  -5.177 -22.106
    2    HA   GLU   5           HA       GLU   5   0.147  -4.862 -20.062
    3    HB2  GLU   5           HB2      GLU   5   0.248  -6.637 -21.803
    4    HB3  GLU   5           HB3      GLU   5   0.535  -5.395 -23.022
    5    HG2  GLU   5           HG2      GLU   5   2.590  -4.708 -21.869
    6    HG3  GLU   5           HG3      GLU   5   2.301  -5.908 -20.609

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLU   6           H        GLU   6  -0.500  -3.164 -23.113
    2    HA   GLU   6           HA       GLU   6   1.644  -1.302 -22.841
    3    HB2  GLU   6           HB2      GLU   6  -0.928  -1.152 -24.435
    4    HB3  GLU   6           HB3      GLU   6   0.421  -0.029 -24.595
    5    HG2  GLU   6           HG2      GLU   6   0.813  -3.005 -24.885
    6    HG3  GLU   6           HG3      GLU   6   0.327  -2.006 -26.253

  No H/Q in entry =           6
  In of MODEL   31
    1    H    VAL   7           H        VAL   7  -1.697  -1.417 -21.808
    2    HA   VAL   7           HA       VAL   7  -1.958   1.294 -20.979
    3    HB   VAL   7           HB       VAL   7  -3.389  -1.241 -20.142
    4   HG11  VAL   7          HG11      VAL   7  -3.806   1.644 -19.336
    5   HG13  VAL   7          HG12      VAL   7  -3.691   0.223 -18.297
    6   HG12  VAL   7          HG13      VAL   7  -5.123   0.471 -19.295
    7   HG21  VAL   7          HG21      VAL   7  -3.552  -0.172 -22.533
    8   HG23  VAL   7          HG22      VAL   7  -4.517   1.066 -21.728
    9   HG22  VAL   7          HG23      VAL   7  -5.040  -0.619 -21.699

  No H/Q in entry =           9
  In of MODEL   31
    1    H    VAL   8           H        VAL   8  -0.936  -1.674 -19.325
    2    HA   VAL   8           HA       VAL   8  -0.642  -0.584 -16.731
    3    HB   VAL   8           HB       VAL   8   0.796  -2.885 -18.078
    4   HG12  VAL   8          HG11      VAL   8   1.128  -3.506 -15.556
    5   HG11  VAL   8          HG12      VAL   8   0.899  -1.779 -15.280
    6   HG13  VAL   8          HG13      VAL   8   2.223  -2.341 -16.300
    7   HG22  VAL   8          HG21      VAL   8  -0.962  -4.221 -17.393
    8   HG21  VAL   8          HG22      VAL   8  -1.854  -2.702 -17.391
    9   HG23  VAL   8          HG23      VAL   8  -1.181  -3.326 -15.889

  No H/Q in entry =           9
  In of MODEL   31
    1    H    MET   9           H        MET   9   1.621  -0.861 -19.470
    2    HA   MET   9           HA       MET   9   3.888   0.214 -18.202
    3    HB2  MET   9           HB2      MET   9   2.945   0.175 -21.062
    4    HB3  MET   9           HB3      MET   9   4.417   1.035 -20.610
    5    HG2  MET   9           HG2      MET   9   5.108  -1.154 -19.427
    6    HG3  MET   9           HG3      MET   9   3.820  -1.913 -20.364
    7    HE1  MET   9           HE1      MET   9   3.696  -2.239 -22.735
    8    HE3  MET   9           HE2      MET   9   4.779  -1.616 -23.976
    9    HE2  MET   9           HE3      MET   9   3.721  -0.510 -23.104

  No H/Q in entry =           9
  In of MODEL   31
    1    H    GLY  10           H        GLY  10   1.189   1.779 -19.893
    2    HA3  GLY  10           HA2      GLY  10   2.118   4.445 -19.650
    3    HA2  GLY  10           HA3      GLY  10   0.435   3.963 -19.860

  No H/Q in entry =           3
  In of MODEL   31
    1    H    LEU  11           H        LEU  11   0.048   2.435 -17.572
    2    HA   LEU  11           HA       LEU  11  -0.514   4.409 -15.618
    3    HB2  LEU  11           HB2      LEU  11  -0.409   1.395 -15.456
    4    HB3  LEU  11           HB3      LEU  11  -0.936   2.414 -14.117
    5    HG   LEU  11           HG       LEU  11  -2.167   2.507 -16.885
    6   HD13  LEU  11          HD11      LEU  11  -2.726   0.358 -16.127
    7   HD12  LEU  11          HD12      LEU  11  -4.091   1.334 -15.588
    8   HD11  LEU  11          HD13      LEU  11  -2.833   0.872 -14.443
    9   HD22  LEU  11          HD21      LEU  11  -2.786   4.517 -15.884
   10   HD21  LEU  11          HD22      LEU  11  -2.708   3.855 -14.251
   11   HD23  LEU  11          HD23      LEU  11  -4.075   3.470 -15.297

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  12           H        ILE  12   2.060   1.974 -15.848
    2    HA   ILE  12           HA       ILE  12   3.251   2.531 -13.341
    3    HB   ILE  12           HB       ILE  12   4.483   1.475 -15.907
    4   HG12  ILE  12          HG12      ILE  12   2.555   0.206 -14.712
    5   HG13  ILE  12          HG13      ILE  12   3.997  -0.701 -15.120
    6   HG21  ILE  12          HG21      ILE  12   5.559   1.515 -13.068
    7   HG23  ILE  12          HG22      ILE  12   6.259   2.311 -14.477
    8   HG22  ILE  12          HG23      ILE  12   6.249   0.552 -14.373
    9   HD13  ILE  12          HD11      ILE  12   4.785  -0.493 -12.820
   10   HD12  ILE  12          HD12      ILE  12   3.156  -1.165 -12.827
   11   HD11  ILE  12          HD13      ILE  12   3.409   0.517 -12.418

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  13           H        ILE  13   3.847   3.795 -16.599
    2    HA   ILE  13           HA       ILE  13   5.961   5.543 -15.871
    3    HB   ILE  13           HB       ILE  13   3.936   5.596 -18.122
    4   HG12  ILE  13          HG12      ILE  13   5.798   3.778 -17.830
    5   HG13  ILE  13          HG13      ILE  13   5.536   4.504 -19.412
    6   HG22  ILE  13          HG21      ILE  13   5.755   7.167 -19.169
    7   HG21  ILE  13          HG22      ILE  13   6.193   7.497 -17.496
    8   HG23  ILE  13          HG23      ILE  13   4.564   7.857 -18.064
    9   HD13  ILE  13          HD11      ILE  13   7.438   5.998 -19.105
   10   HD12  ILE  13          HD12      ILE  13   7.958   4.358 -18.736
   11   HD11  ILE  13          HD13      ILE  13   7.610   5.483 -17.428

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ASN  14           H        ASN  14   2.449   5.994 -16.150
    2    HA   ASN  14           HA       ASN  14   2.371   8.741 -15.519
    3    HB2  ASN  14           HB2      ASN  14   0.501   7.074 -16.352
    4    HB3  ASN  14           HB3      ASN  14   0.176   6.895 -14.632
    5   HD21  ASN  14          HD21      ASN  14  -1.853   8.024 -16.072
    6   HD22  ASN  14          HD22      ASN  14  -1.937   9.697 -15.809

  No H/Q in entry =           6
  In of MODEL   31
    1    H    SER  15           H        SER  15   2.105   5.865 -13.437
    2    HA   SER  15           HA       SER  15   1.775   7.236 -10.993
    3    HB2  SER  15           HB2      SER  15   2.354   5.159  -9.938
    4    HB3  SER  15           HB3      SER  15   1.523   4.729 -11.428
    5    HG   SER  15           HG       SER  15   3.266   3.665 -11.877

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLY  16           H        GLY  16   4.669   6.171 -12.741
    2    HA3  GLY  16           HA2      GLY  16   6.579   6.956 -10.807
    3    HA2  GLY  16           HA3      GLY  16   6.889   6.754 -12.529

  No H/Q in entry =           3
  In of MODEL   31
    1    H    GLN  17           H        GLN  17   5.178   8.688 -13.600
    2    HA   GLN  17           HA       GLN  17   6.724  11.050 -13.293
    3    HB2  GLN  17           HB2      GLN  17   3.984  10.582 -14.501
    4    HB3  GLN  17           HB3      GLN  17   4.822  12.133 -14.572
    5    HG2  GLN  17           HG2      GLN  17   5.985   9.529 -15.593
    6    HG3  GLN  17           HG3      GLN  17   5.175  10.718 -16.612
    7   HE21  GLN  17          HE21      GLN  17   6.335  12.649 -17.162
    8   HE22  GLN  17          HE22      GLN  17   7.951  12.904 -16.710

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ALA  18           H        ALA  18   3.634   9.994 -11.950
    2    HA   ALA  18           HA       ALA  18   2.873  12.376 -10.692
    3    HB1  ALA  18           HB1      ALA  18   1.777   9.904 -10.912
    4    HB2  ALA  18           HB2      ALA  18   1.210  11.119  -9.769
    5    HB3  ALA  18           HB3      ALA  18   2.315   9.852  -9.234

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ARG  19           H        ARG  19   4.780   9.641  -9.401
    2    HA   ARG  19           HA       ARG  19   5.290  10.811  -6.880
    3    HB2  ARG  19           HB2      ARG  19   5.738   8.412  -7.401
    4    HB3  ARG  19           HB3      ARG  19   7.090   8.915  -8.419
    5    HG2  ARG  19           HG2      ARG  19   8.190   9.974  -6.496
    6    HG3  ARG  19           HG3      ARG  19   6.816   9.569  -5.467
    7    HD2  ARG  19           HD2      ARG  19   8.600   7.959  -5.101
    8    HD3  ARG  19           HD3      ARG  19   7.239   7.156  -5.889
    9    HE   ARG  19           HE       ARG  19   8.938   7.994  -7.933
   10   HH21  ARG  19          HH11      ARG  19  10.520   6.609  -8.776
   11   HH22  ARG  19          HH12      ARG  19  11.081   5.270  -7.836
   12   HH11  ARG  19          HH21      ARG  19   9.030   5.971  -5.150
   13   HH12  ARG  19          HH22      ARG  19  10.234   4.909  -5.782

  No H/Q in entry =          13
  In of MODEL   31
    1    H    SER  20           H        SER  20   7.116  10.859  -9.924
    2    HA   SER  20           HA       SER  20   9.338  12.308  -9.096
    3    HB2  SER  20           HB2      SER  20   9.390  11.429 -11.298
    4    HB3  SER  20           HB3      SER  20   7.879  12.221 -11.732
    5    HG   SER  20           HG       SER  20   9.016  14.232 -11.416

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU  21           H        LEU  21   6.225  13.530 -10.305
    2    HA   LEU  21           HA       LEU  21   6.855  16.286 -10.085
    3    HB2  LEU  21           HB2      LEU  21   4.209  14.822 -10.012
    4    HB3  LEU  21           HB3      LEU  21   4.347  16.578 -10.014
    5    HG   LEU  21           HG       LEU  21   5.590  14.814 -12.143
    6   HD12  LEU  21          HD11      LEU  21   3.598  15.856 -13.497
    7   HD11  LEU  21          HD12      LEU  21   2.853  16.035 -11.908
    8   HD13  LEU  21          HD13      LEU  21   3.309  14.435 -12.491
    9   HD22  LEU  21          HD21      LEU  21   6.674  16.882 -12.310
   10   HD21  LEU  21          HD22      LEU  21   5.279  17.791 -11.737
   11   HD23  LEU  21          HD23      LEU  21   5.298  17.154 -13.375

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ALA  22           H        ALA  22   5.370  13.979  -7.836
    2    HA   ALA  22           HA       ALA  22   4.734  15.782  -5.775
    3    HB3  ALA  22           HB1      ALA  22   4.009  13.378  -5.935
    4    HB2  ALA  22           HB2      ALA  22   4.586  13.862  -4.339
    5    HB1  ALA  22           HB3      ALA  22   5.626  12.917  -5.406

  No H/Q in entry =           5
  In of MODEL   31
    1    H    TYR  23           H        TYR  23   7.699  13.800  -6.200
    2    HA   TYR  23           HA       TYR  23   9.060  14.844  -3.946
    3    HB2  TYR  23           HB2      TYR  23   9.879  12.846  -5.099
    4    HB3  TYR  23           HB3      TYR  23  10.186  13.788  -6.558
    5    HD1  TYR  23           HD1      TYR  23  11.138  13.472  -2.961
    6    HD2  TYR  23           HD2      TYR  23  12.206  14.984  -6.837
    7    HE1  TYR  23           HE1      TYR  23  13.383  14.083  -2.104
    8    HE2  TYR  23           HE2      TYR  23  14.451  15.597  -5.980
    9    HH   TYR  23           HH       TYR  23  15.194  15.845  -2.792

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ALA  24           H        ALA  24   8.870  15.941  -7.315
    2    HA   ALA  24           HA       ALA  24  10.732  18.056  -7.068
    3    HB2  ALA  24           HB1      ALA  24  10.295  18.107  -9.278
    4    HB3  ALA  24           HB2      ALA  24   8.728  18.833  -8.925
    5    HB1  ALA  24           HB3      ALA  24   8.881  17.082  -9.050

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA  25           H        ALA  25   7.255  17.818  -6.456
    2    HA   ALA  25           HA       ALA  25   6.730  20.529  -5.894
    3    HB1  ALA  25           HB1      ALA  25   5.102  18.504  -6.096
    4    HB2  ALA  25           HB2      ALA  25   4.710  19.789  -4.951
    5    HB3  ALA  25           HB3      ALA  25   5.422  18.281  -4.375

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU  26           H        LEU  26   7.836  17.872  -3.835
    2    HA   LEU  26           HA       LEU  26   7.910  19.310  -1.401
    3    HB2  LEU  26           HB2      LEU  26   8.045  16.895  -1.390
    4    HB3  LEU  26           HB3      LEU  26   9.518  16.925  -2.357
    5    HG   LEU  26           HG       LEU  26  10.708  18.067  -0.516
    6   HD12  LEU  26          HD11      LEU  26   9.476  18.059   1.741
    7   HD11  LEU  26          HD12      LEU  26   7.993  17.895   0.802
    8   HD13  LEU  26          HD13      LEU  26   9.015  19.317   0.593
    9   HD21  LEU  26          HD21      LEU  26   9.213  15.576   0.359
   10   HD23  LEU  26          HD22      LEU  26  10.717  16.165   1.059
   11   HD22  LEU  26          HD23      LEU  26  10.686  15.601  -0.610

  No H/Q in entry =          11
  In of MODEL   31
    1    H    LYS  27           H        LYS  27  10.343  18.772  -3.918
    2    HA   LYS  27           HA       LYS  27  12.502  20.052  -2.687
    3    HB2  LYS  27           HB2      LYS  27  12.633  18.702  -4.773
    4    HB3  LYS  27           HB3      LYS  27  11.848  20.019  -5.644
    5    HG2  LYS  27           HG2      LYS  27  13.686  21.537  -5.064
    6    HG3  LYS  27           HG3      LYS  27  14.465  20.260  -4.122
    7    HD2  LYS  27           HD2      LYS  27  14.638  18.871  -6.173
    8    HD3  LYS  27           HD3      LYS  27  13.903  20.174  -7.106
    9    HE2  LYS  27           HE2      LYS  27  15.764  21.674  -6.492
   10    HE3  LYS  27           HE3      LYS  27  16.503  20.374  -5.549
   11    HZ3  LYS  27           HZ1      LYS  27  17.497  20.486  -7.733
   12    HZ2  LYS  27           HZ2      LYS  27  15.975  20.340  -8.478
   13    HZ1  LYS  27           HZ3      LYS  27  16.618  19.042  -7.589

  No H/Q in entry =          13
  In of MODEL   31
    1    H    GLN  28           H        GLN  28   9.862  21.384  -4.646
    2    HA   GLN  28           HA       GLN  28  10.776  24.052  -4.803
    3    HB2  GLN  28           HB2      GLN  28   7.961  22.935  -4.694
    4    HB3  GLN  28           HB3      GLN  28   8.348  24.613  -5.076
    5    HG2  GLN  28           HG2      GLN  28   9.382  22.209  -6.607
    6    HG3  GLN  28           HG3      GLN  28   8.038  23.225  -7.121
    7   HE21  GLN  28          HE21      GLN  28  11.216  22.770  -7.784
    8   HE22  GLN  28          HE22      GLN  28  11.670  24.357  -8.181

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ALA  29           H        ALA  29   8.867  22.332  -2.368
    2    HA   ALA  29           HA       ALA  29   8.275  24.518  -0.692
    3    HB2  ALA  29           HB1      ALA  29   7.569  22.941   0.877
    4    HB1  ALA  29           HB2      ALA  29   8.812  21.777   0.419
    5    HB3  ALA  29           HB3      ALA  29   7.424  22.044  -0.634

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LYS  30           H        LYS  30  11.045  22.299  -0.749
    2    HA   LYS  30           HA       LYS  30  12.339  23.282   1.555
    3    HB2  LYS  30           HB2      LYS  30  13.465  22.009  -0.949
    4    HB3  LYS  30           HB3      LYS  30  14.437  22.389   0.474
    5    HG2  LYS  30           HG2      LYS  30  12.905  20.982   1.853
    6    HG3  LYS  30           HG3      LYS  30  12.031  20.542   0.382
    7    HD2  LYS  30           HD2      LYS  30  14.096  19.589  -0.571
    8    HD3  LYS  30           HD3      LYS  30  14.988  20.044   0.882
    9    HE2  LYS  30           HE2      LYS  30  13.505  18.590   2.236
   10    HE3  LYS  30           HE3      LYS  30  12.643  18.115   0.766
   11    HZ2  LYS  30           HZ1      LYS  30  14.460  16.571   1.536
   12    HZ1  LYS  30           HZ2      LYS  30  15.577  17.777   1.085
   13    HZ3  LYS  30           HZ3      LYS  30  14.557  17.072  -0.081

  No H/Q in entry =          13
  In of MODEL   31
    1    H    GLN  31           H        GLN  31  12.218  24.477  -1.745
    2    HA   GLN  31           HA       GLN  31  14.336  26.409  -1.322
    3    HB2  GLN  31           HB2      GLN  31  12.298  26.414  -3.552
    4    HB3  GLN  31           HB3      GLN  31  13.906  27.138  -3.550
    5    HG2  GLN  31           HG2      GLN  31  14.414  24.452  -2.967
    6    HG3  GLN  31           HG3      GLN  31  13.114  24.372  -4.149
    7   HE21  GLN  31          HE21      GLN  31  15.973  23.629  -4.544
    8   HE22  GLN  31          HE22      GLN  31  16.531  24.609  -5.811

  No H/Q in entry =           8
  In of MODEL   31
    1    H    GLY  32           H        GLY  32  11.262  26.174  -0.184
    2    HA3  GLY  32           HA2      GLY  32  10.074  27.725   1.082
    3    HA2  GLY  32           HA3      GLY  32  11.179  28.979   0.532

  No H/Q in entry =           3
  In of MODEL   31
    1    H    ASP  33           H        ASP  33   9.856  27.045  -1.959
    2    HA   ASP  33           HA       ASP  33   8.153  29.286  -2.825
    3    HB2  ASP  33           HB2      ASP  33   9.294  26.883  -4.258
    4    HB3  ASP  33           HB3      ASP  33   8.125  27.976  -4.994

  No H/Q in entry =           4
  In of MODEL   31
    1    H    PHE  34           H        PHE  34   6.470  28.784  -1.264
    2    HA   PHE  34           HA       PHE  34   5.134  26.288  -1.167
    3    HB2  PHE  34           HB2      PHE  34   4.122  29.059  -0.496
    4    HB3  PHE  34           HB3      PHE  34   3.298  27.554  -0.083
    5    HD1  PHE  34           HD1      PHE  34   5.502  29.995   1.131
    6    HD2  PHE  34           HD2      PHE  34   4.898  25.743   1.086
    7    HE1  PHE  34           HE1      PHE  34   6.891  29.774   3.172
    8    HE2  PHE  34           HE2      PHE  34   6.289  25.526   3.125
    9    HZ   PHE  34           HZ       PHE  34   7.280  27.543   4.168

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ALA  35           H        ALA  35   4.658  29.139  -3.185
    2    HA   ALA  35           HA       ALA  35   2.121  28.477  -4.216
    3    HB3  ALA  35           HB1      ALA  35   3.153  29.883  -6.254
    4    HB2  ALA  35           HB2      ALA  35   4.361  30.269  -5.028
    5    HB1  ALA  35           HB3      ALA  35   2.663  30.648  -4.742

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA  36           H        ALA  36   5.365  27.858  -5.560
    2    HA   ALA  36           HA       ALA  36   4.408  26.406  -7.803
    3    HB3  ALA  36           HB1      ALA  36   6.566  26.568  -8.413
    4    HB2  ALA  36           HB2      ALA  36   7.062  25.551  -7.059
    5    HB1  ALA  36           HB3      ALA  36   6.924  27.297  -6.848

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA  37           H        ALA  37   5.372  25.437  -4.543
    2    HA   ALA  37           HA       ALA  37   5.365  22.647  -4.966
    3    HB2  ALA  37           HB1      ALA  37   5.065  24.438  -2.592
    4    HB1  ALA  37           HB2      ALA  37   6.223  23.141  -2.878
    5    HB3  ALA  37           HB3      ALA  37   4.567  22.758  -2.411

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LYS  38           H        LYS  38   2.789  24.812  -3.810
    2    HA   LYS  38           HA       LYS  38   0.723  22.962  -3.588
    3    HB2  LYS  38           HB2      LYS  38   1.024  25.724  -3.343
    4    HB3  LYS  38           HB3      LYS  38  -0.169  25.553  -4.624
    5    HG2  LYS  38           HG2      LYS  38  -1.599  24.207  -3.183
    6    HG3  LYS  38           HG3      LYS  38  -0.357  24.172  -1.923
    7    HD2  LYS  38           HD2      LYS  38  -0.586  26.506  -1.481
    8    HD3  LYS  38           HD3      LYS  38  -1.499  26.775  -2.967
    9    HE2  LYS  38           HE2      LYS  38  -3.008  26.786  -1.031
   10    HE3  LYS  38           HE3      LYS  38  -3.354  25.401  -2.071
   11    HZ3  LYS  38           HZ1      LYS  38  -2.607  23.947  -0.533
   12    HZ2  LYS  38           HZ2      LYS  38  -2.983  25.201   0.553
   13    HZ1  LYS  38           HZ3      LYS  38  -1.383  24.977   0.032

  No H/Q in entry =          13
  In of MODEL   31
    1    H    ALA  39           H        ALA  39   1.675  24.875  -6.439
    2    HA   ALA  39           HA       ALA  39  -0.380  23.967  -8.145
    3    HB2  ALA  39           HB1      ALA  39   2.347  24.661  -9.193
    4    HB1  ALA  39           HB2      ALA  39   1.356  25.907  -8.433
    5    HB3  ALA  39           HB3      ALA  39   0.763  25.055  -9.859

  No H/Q in entry =           5
  In of MODEL   31
    1    H    MET  40           H        MET  40   2.880  22.728  -7.554
    2    HA   MET  40           HA       MET  40   2.824  20.701  -9.541
    3    HB2  MET  40           HB2      MET  40   4.424  20.960  -6.989
    4    HB3  MET  40           HB3      MET  40   4.701  19.706  -8.200
    5    HG2  MET  40           HG2      MET  40   4.706  22.661  -8.872
    6    HG3  MET  40           HG3      MET  40   6.168  21.786  -8.416
    7    HE3  MET  40           HE1      MET  40   7.087  19.580 -11.218
    8    HE2  MET  40           HE2      MET  40   6.525  19.254  -9.581
    9    HE1  MET  40           HE3      MET  40   7.597  20.621  -9.881

  No H/Q in entry =           9
  In of MODEL   31
    1    H    MET  41           H        MET  41   1.899  20.735  -6.120
    2    HA   MET  41           HA       MET  41   1.416  17.962  -5.837
    3    HB2  MET  41           HB2      MET  41   0.037  20.298  -4.495
    4    HB3  MET  41           HB3      MET  41  -0.089  18.618  -3.983
    5    HG2  MET  41           HG2      MET  41   2.617  18.891  -4.014
    6    HG3  MET  41           HG3      MET  41   2.145  20.542  -3.623
    7    HE2  MET  41           HE1      MET  41  -0.876  19.237  -1.903
    8    HE1  MET  41           HE2      MET  41  -0.086  20.764  -2.281
    9    HE3  MET  41           HE3      MET  41  -0.139  20.197  -0.612

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ASP  42           H        ASP  42  -0.669  20.646  -6.822
    2    HA   ASP  42           HA       ASP  42  -3.084  19.240  -6.962
    3    HB2  ASP  42           HB2      ASP  42  -2.424  21.823  -7.223
    4    HB3  ASP  42           HB3      ASP  42  -2.563  21.421  -8.931

  No H/Q in entry =           4
  In of MODEL   31
    1    H    GLN  43           H        GLN  43  -0.648  19.871  -9.459
    2    HA   GLN  43           HA       GLN  43  -2.005  18.521 -11.549
    3    HB2  GLN  43           HB2      GLN  43   0.943  19.093 -11.161
    4    HB3  GLN  43           HB3      GLN  43   0.245  18.436 -12.644
    5    HG2  GLN  43           HG2      GLN  43  -1.304  20.435 -12.694
    6    HG3  GLN  43           HG3      GLN  43  -0.367  21.112 -11.365
    7   HE21  GLN  43          HE21      GLN  43  -0.230  22.730 -13.454
    8   HE22  GLN  43          HE22      GLN  43   1.191  22.533 -14.357

  No H/Q in entry =           8
  In of MODEL   31
    1    H    SER  44           H        SER  44   0.360  17.430  -9.150
    2    HA   SER  44           HA       SER  44   0.746  14.828 -10.168
    3    HB2  SER  44           HB2      SER  44   1.608  16.288  -7.932
    4    HB3  SER  44           HB3      SER  44   0.770  14.890  -7.261
    5    HG   SER  44           HG       SER  44   2.893  14.309  -7.680

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ARG  45           H        ARG  45  -1.604  16.108  -7.839
    2    HA   ARG  45           HA       ARG  45  -2.948  13.723  -7.202
    3    HB2  ARG  45           HB2      ARG  45  -3.190  15.890  -6.016
    4    HB3  ARG  45           HB3      ARG  45  -4.055  16.537  -7.407
    5    HG2  ARG  45           HG2      ARG  45  -5.789  14.779  -7.124
    6    HG3  ARG  45           HG3      ARG  45  -4.937  14.186  -5.698
    7    HD2  ARG  45           HD2      ARG  45  -5.189  16.451  -4.647
    8    HD3  ARG  45           HD3      ARG  45  -6.182  16.949  -6.034
    9    HE   ARG  45           HE       ARG  45  -7.250  14.555  -4.991
   10   HH21  ARG  45          HH11      ARG  45  -9.090  14.598  -3.726
   11   HH22  ARG  45          HH12      ARG  45  -9.515  16.032  -2.861
   12   HH11  ARG  45          HH21      ARG  45  -6.768  17.814  -3.973
   13   HH12  ARG  45          HH22      ARG  45  -8.195  17.853  -3.000

  No H/Q in entry =          13
  In of MODEL   31
    1    H    MET  46           H        MET  46  -3.570  16.110  -9.760
    2    HA   MET  46           HA       MET  46  -5.884  14.891 -10.826
    3    HB2  MET  46           HB2      MET  46  -3.814  16.755 -11.998
    4    HB3  MET  46           HB3      MET  46  -5.182  16.170 -12.950
    5    HG2  MET  46           HG2      MET  46  -6.750  17.074 -11.303
    6    HG3  MET  46           HG3      MET  46  -5.416  17.601 -10.286
    7    HE3  MET  46           HE1      MET  46  -5.788  17.990 -14.409
    8    HE2  MET  46           HE2      MET  46  -6.962  19.285 -14.210
    9    HE1  MET  46           HE3      MET  46  -7.260  17.715 -13.467

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ALA  47           H        ALA  47  -2.444  14.476 -11.573
    2    HA   ALA  47           HA       ALA  47  -2.750  12.737 -13.780
    3    HB3  ALA  47           HB1      ALA  47  -0.591  13.669 -13.424
    4    HB2  ALA  47           HB2      ALA  47  -0.417  11.944 -13.086
    5    HB1  ALA  47           HB3      ALA  47  -0.536  13.097 -11.756

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU  48           H        LEU  48  -2.478  12.114 -10.304
    2    HA   LEU  48           HA       LEU  48  -2.517   9.273 -10.456
    3    HB2  LEU  48           HB2      LEU  48  -3.324  11.181  -8.249
    4    HB3  LEU  48           HB3      LEU  48  -3.197   9.433  -8.044
    5    HG   LEU  48           HG       LEU  48  -0.929  11.174  -9.039
    6   HD13  LEU  48          HD11      LEU  48  -1.232  11.944  -6.850
    7   HD12  LEU  48          HD12      LEU  48  -0.045  10.660  -6.646
    8   HD11  LEU  48          HD13      LEU  48  -1.738  10.365  -6.252
    9   HD22  LEU  48          HD21      LEU  48  -0.386   8.997  -9.673
   10   HD21  LEU  48          HD22      LEU  48  -1.245   8.268  -8.317
   11   HD23  LEU  48          HD23      LEU  48   0.312   9.053  -8.055

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ASN  49           H        ASN  49  -5.029  11.718 -10.067
    2    HA   ASN  49           HA       ASN  49  -7.184  10.012  -9.530
    3    HB2  ASN  49           HB2      ASN  49  -7.287  12.434  -9.212
    4    HB3  ASN  49           HB3      ASN  49  -7.128  12.694 -10.945
    5   HD21  ASN  49          HD21      ASN  49  -9.356  13.747  -9.638
    6   HD22  ASN  49          HD22      ASN  49 -10.743  12.880 -10.084

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLU  50           H        GLU  50  -5.919  11.226 -12.616
    2    HA   GLU  50           HA       GLU  50  -7.843   9.929 -14.265
    3    HB2  GLU  50           HB2      GLU  50  -6.411  11.775 -15.079
    4    HB3  GLU  50           HB3      GLU  50  -4.997  10.730 -14.934
    5    HG2  GLU  50           HG2      GLU  50  -5.935   9.172 -16.570
    6    HG3  GLU  50           HG3      GLU  50  -7.414  10.121 -16.664

  No H/Q in entry =           6
  In of MODEL   31
    1    H    ALA  51           H        ALA  51  -4.658   9.002 -13.048
    2    HA   ALA  51           HA       ALA  51  -4.466   6.549 -14.459
    3    HB2  ALA  51           HB1      ALA  51  -2.484   6.302 -13.353
    4    HB1  ALA  51           HB2      ALA  51  -3.184   6.714 -11.788
    5    HB3  ALA  51           HB3      ALA  51  -2.750   7.991 -12.924

  No H/Q in entry =           5
  In of MODEL   31
    1    H    HIS  52           H        HIS  52  -5.665   7.365 -11.216
    2    HA   HIS  52           HA       HIS  52  -6.302   4.744 -10.380
    3    HB2  HIS  52           HB2      HIS  52  -6.209   6.663  -8.845
    4    HB3  HIS  52           HB3      HIS  52  -7.624   7.363  -9.631
    5    HD1  HIS  52           HD1      HIS  52  -9.874   5.880  -9.485
    6    HD2  HIS  52           HD2      HIS  52  -6.807   4.774  -6.889
    7    HE1  HIS  52           HE1      HIS  52 -10.929   4.403  -7.718
    8    HE2  HIS  52           HE2      HIS  52  -9.071   3.720  -6.127

  No H/Q in entry =           8
  In of MODEL   31
    1    H    LEU  53           H        LEU  53  -8.164   7.163 -12.180
    2    HA   LEU  53           HA       LEU  53 -10.644   5.823 -12.197
    3    HB2  LEU  53           HB2      LEU  53  -9.393   7.822 -14.069
    4    HB3  LEU  53           HB3      LEU  53 -10.979   7.128 -14.391
    5    HG   LEU  53           HG       LEU  53 -10.291   8.465 -11.754
    6   HD13  LEU  53          HD11      LEU  53 -10.027  10.143 -13.484
    7   HD12  LEU  53          HD12      LEU  53 -11.572  10.419 -12.679
    8   HD11  LEU  53          HD13      LEU  53 -11.525   9.641 -14.258
    9   HD23  LEU  53          HD21      LEU  53 -12.888   8.804 -11.903
   10   HD22  LEU  53          HD22      LEU  53 -12.263   7.228 -11.431
   11   HD21  LEU  53          HD23      LEU  53 -12.833   7.488 -13.068

  No H/Q in entry =          11
  In of MODEL   31
    1    H    VAL  54           H        VAL  54  -7.883   5.673 -14.425
    2    HA   VAL  54           HA       VAL  54  -9.066   3.875 -16.268
    3    HB   VAL  54           HB       VAL  54  -6.171   4.437 -15.577
    4   HG12  VAL  54          HG11      VAL  54  -5.896   3.352 -17.963
    5   HG11  VAL  54          HG12      VAL  54  -7.410   2.543 -17.562
    6   HG13  VAL  54          HG13      VAL  54  -5.994   2.318 -16.538
    7   HG22  VAL  54          HG21      VAL  54  -6.974   6.363 -16.629
    8   HG21  VAL  54          HG22      VAL  54  -8.147   5.476 -17.599
    9   HG23  VAL  54          HG23      VAL  54  -6.438   5.426 -18.024

  No H/Q in entry =           9
  In of MODEL   31
    1    H    GLN  55           H        GLN  55  -7.067   3.373 -13.360
    2    HA   GLN  55           HA       GLN  55  -6.924   0.558 -13.609
    3    HB2  GLN  55           HB2      GLN  55  -5.390   1.486 -12.088
    4    HB3  GLN  55           HB3      GLN  55  -6.627   2.431 -11.264
    5    HG2  GLN  55           HG2      GLN  55  -7.287   0.665  -9.944
    6    HG3  GLN  55           HG3      GLN  55  -7.036  -0.521 -11.219
    7   HE21  GLN  55          HE21      GLN  55  -5.387  -1.939 -10.716
    8   HE22  GLN  55          HE22      GLN  55  -4.013  -1.560  -9.800

  No H/Q in entry =           8
  In of MODEL   31
    1    H    THR  56           H        THR  56  -9.300   2.681 -12.008
    2    HA   THR  56           HA       THR  56 -10.853   0.771 -10.719
    3    HB   THR  56           HB       THR  56 -11.987   3.136 -12.234
    4    HG1  THR  56           HG1      THR  56 -10.649   2.962  -9.749
    5   HG23  THR  56          HG21      THR  56 -13.807   2.989 -10.791
    6   HG22  THR  56          HG22      THR  56 -12.890   2.120  -9.559
    7   HG21  THR  56          HG23      THR  56 -13.411   1.287 -11.025

  No H/Q in entry =           7
  In of MODEL   31
    1    H    LYS  57           H        LYS  57 -11.064   1.842 -14.108
    2    HA   LYS  57           HA       LYS  57 -13.186   0.114 -14.865
    3    HB2  LYS  57           HB2      LYS  57 -12.331   2.081 -16.181
    4    HB3  LYS  57           HB3      LYS  57 -10.884   1.154 -16.551
    5    HG2  LYS  57           HG2      LYS  57 -13.466  -0.175 -17.160
    6    HG3  LYS  57           HG3      LYS  57 -13.058   1.212 -18.164
    7    HD2  LYS  57           HD2      LYS  57 -10.877   0.184 -18.707
    8    HD3  LYS  57           HD3      LYS  57 -11.280  -1.208 -17.705
    9    HE2  LYS  57           HE2      LYS  57 -13.226  -1.698 -19.154
   10    HE3  LYS  57           HE3      LYS  57 -12.837  -0.307 -20.165
   11    HZ2  LYS  57           HZ1      LYS  57 -12.011  -2.547 -20.936
   12    HZ1  LYS  57           HZ2      LYS  57 -10.890  -2.474 -19.660
   13    HZ3  LYS  57           HZ3      LYS  57 -10.866  -1.297 -20.887

  No H/Q in entry =          13
  In of MODEL   31
    1    H    LEU  58           H        LEU  58  -9.675  -0.253 -14.795
    2    HA   LEU  58           HA       LEU  58  -9.632  -2.773 -16.077
    3    HB2  LEU  58           HB2      LEU  58  -7.628  -1.439 -14.265
    4    HB3  LEU  58           HB3      LEU  58  -7.336  -2.958 -15.114
    5    HG   LEU  58           HG       LEU  58  -8.133  -0.371 -16.487
    6   HD11  LEU  58          HD11      LEU  58  -5.467  -1.557 -15.784
    7   HD13  LEU  58          HD12      LEU  58  -5.993   0.125 -15.741
    8   HD12  LEU  58          HD13      LEU  58  -5.634  -0.644 -17.284
    9   HD22  LEU  58          HD21      LEU  58  -8.674  -1.948 -18.076
   10   HD21  LEU  58          HD22      LEU  58  -7.613  -3.174 -17.387
   11   HD23  LEU  58          HD23      LEU  58  -6.942  -1.891 -18.394

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  59           H        ILE  59 -10.481  -1.877 -12.831
    2    HA   ILE  59           HA       ILE  59 -10.082  -4.635 -11.875
    3    HB   ILE  59           HB       ILE  59  -9.679  -2.362 -10.479
    4   HG12  ILE  59          HG12      ILE  59 -11.032  -4.723  -9.156
    5   HG13  ILE  59          HG13      ILE  59  -9.384  -4.786  -9.728
    6   HG23  ILE  59          HG21      ILE  59 -11.524  -1.662  -9.206
    7   HG22  ILE  59          HG22      ILE  59 -12.432  -3.121  -9.522
    8   HG21  ILE  59          HG23      ILE  59 -12.241  -1.903 -10.781
    9   HD11  ILE  59          HD11      ILE  59  -8.804  -2.855  -8.322
   10   HD13  ILE  59          HD12      ILE  59  -9.427  -4.182  -7.351
   11   HD12  ILE  59          HD13      ILE  59 -10.460  -2.801  -7.723

  No H/Q in entry =          11
  In of MODEL   31
    1    H    GLU  60           H        GLU  60 -12.680  -2.369 -12.699
    2    HA   GLU  60           HA       GLU  60 -14.840  -3.923 -11.689
    3    HB2  GLU  60           HB2      GLU  60 -15.073  -1.549 -12.304
    4    HB3  GLU  60           HB3      GLU  60 -14.777  -1.951 -13.991
    5    HG2  GLU  60           HG2      GLU  60 -16.795  -3.414 -13.968
    6    HG3  GLU  60           HG3      GLU  60 -17.113  -2.909 -12.322

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLY  61           H        GLY  61 -13.155  -3.885 -14.798
    2    HA3  GLY  61           HA2      GLY  61 -14.823  -6.164 -15.688
    3    HA2  GLY  61           HA3      GLY  61 -13.995  -5.047 -16.766

  No H/Q in entry =           3
  In of MODEL   31
    1    H    ASP  62           H        ASP  62 -12.604  -6.461 -13.873
    2    HA   ASP  62           HA       ASP  62 -10.345  -7.432 -15.365
    3    HB2  ASP  62           HB2      ASP  62  -9.590  -8.190 -13.095
    4    HB3  ASP  62           HB3      ASP  62  -9.978  -6.476 -13.184

  No H/Q in entry =           4
  In of MODEL   31
    1    H    ALA  63           H        ALA  63 -13.279  -8.733 -15.394
    2    HA   ALA  63           HA       ALA  63 -13.091 -11.397 -14.495
    3    HB2  ALA  63           HB1      ALA  63 -15.218 -10.561 -15.242
    4    HB1  ALA  63           HB2      ALA  63 -14.766 -11.824 -16.386
    5    HB3  ALA  63           HB3      ALA  63 -14.564 -10.125 -16.820

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLY  64           H        GLY  64 -12.089  -9.883 -17.514
    2    HA3  GLY  64           HA2      GLY  64 -10.692 -10.552 -19.201
    3    HA2  GLY  64           HA3      GLY  64  -9.955 -11.638 -18.030

  No H/Q in entry =           3
  In of MODEL   31
    1    H    GLU  65           H        GLU  65  -9.722 -13.398 -19.409
    2    HA   GLU  65           HA       GLU  65 -11.790 -14.320 -21.117
    3    HB2  GLU  65           HB2      GLU  65  -9.340 -15.738 -20.066
    4    HB3  GLU  65           HB3      GLU  65 -10.394 -16.362 -21.336
    5    HG2  GLU  65           HG2      GLU  65  -8.998 -13.675 -21.459
    6    HG3  GLU  65           HG3      GLU  65  -8.380 -15.145 -22.212

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLY  66           H        GLY  66 -10.728 -15.305 -17.939
    2    HA3  GLY  66           HA2      GLY  66 -12.858 -17.289 -17.679
    3    HA2  GLY  66           HA3      GLY  66 -11.489 -17.088 -16.601

  No H/Q in entry =           3
  In of MODEL   31
    1    H    LYS  67           H        LYS  67 -13.685 -17.463 -15.327
    2    HA   LYS  67           HA       LYS  67 -15.192 -15.056 -14.834
    3    HB2  LYS  67           HB2      LYS  67 -15.300 -17.825 -13.650
    4    HB3  LYS  67           HB3      LYS  67 -16.396 -16.517 -13.189
    5    HG2  LYS  67           HG2      LYS  67 -17.089 -16.253 -15.539
    6    HG3  LYS  67           HG3      LYS  67 -15.987 -17.543 -16.014
    7    HD2  LYS  67           HD2      LYS  67 -17.241 -19.139 -14.614
    8    HD3  LYS  67           HD3      LYS  67 -18.343 -17.847 -14.132
    9    HE2  LYS  67           HE2      LYS  67 -18.995 -17.515 -16.490
   10    HE3  LYS  67           HE3      LYS  67 -17.892 -18.803 -16.977
   11    HZ2  LYS  67           HZ1      LYS  67 -20.511 -18.976 -15.802
   12    HZ1  LYS  67           HZ2      LYS  67 -19.365 -19.967 -15.036
   13    HZ3  LYS  67           HZ3      LYS  67 -19.650 -20.126 -16.703

  No H/Q in entry =          13
  In of MODEL   31
    1    H    MET  68           H        MET  68 -13.846 -17.219 -12.427
    2    HA   MET  68           HA       MET  68 -13.608 -15.322 -10.378
    3    HB2  MET  68           HB2      MET  68 -12.519 -18.075 -10.829
    4    HB3  MET  68           HB3      MET  68 -12.027 -17.144  -9.415
    5    HG2  MET  68           HG2      MET  68 -13.957 -18.473  -8.799
    6    HG3  MET  68           HG3      MET  68 -14.460 -16.783  -8.891
    7    HE3  MET  68           HE1      MET  68 -17.660 -18.186 -10.065
    8    HE2  MET  68           HE2      MET  68 -17.028 -16.548  -9.916
    9    HE1  MET  68           HE3      MET  68 -16.622 -17.755  -8.697

  No H/Q in entry =           9
  In of MODEL   31
    1    H    LYS  69           H        LYS  69 -11.118 -16.471 -12.675
    2    HA   LYS  69           HA       LYS  69  -8.971 -15.170 -11.348
    3    HB2  LYS  69           HB2      LYS  69  -9.232 -16.320 -14.124
    4    HB3  LYS  69           HB3      LYS  69  -7.719 -15.676 -13.484
    5    HG2  LYS  69           HG2      LYS  69  -7.907 -17.243 -11.553
    6    HG3  LYS  69           HG3      LYS  69  -9.359 -17.926 -12.279
    7    HD2  LYS  69           HD2      LYS  69  -6.705 -17.828 -13.729
    8    HD3  LYS  69           HD3      LYS  69  -7.203 -19.201 -12.738
    9    HE2  LYS  69           HE2      LYS  69  -9.352 -19.237 -14.134
   10    HE3  LYS  69           HE3      LYS  69  -8.530 -18.136 -15.237
   11    HZ2  LYS  69           HZ1      LYS  69  -8.341 -20.878 -15.197
   12    HZ1  LYS  69           HZ2      LYS  69  -6.867 -20.333 -14.555
   13    HZ3  LYS  69           HZ3      LYS  69  -7.375 -19.806 -16.088

  No H/Q in entry =          13
  In of MODEL   31
    1    H    VAL  70           H        VAL  70  -7.616 -13.428 -12.006
    2    HA   VAL  70           HA       VAL  70  -8.906 -11.389 -13.726
    3    HB   VAL  70           HB       VAL  70  -8.106  -9.677 -12.136
    4   HG12  VAL  70          HG11      VAL  70  -9.712 -11.751 -10.636
    5   HG11  VAL  70          HG12      VAL  70 -10.392 -10.837 -11.982
    6   HG13  VAL  70          HG13      VAL  70  -9.842  -9.996 -10.533
    7   HG23  VAL  70          HG21      VAL  70  -7.545 -10.814  -9.766
    8   HG22  VAL  70          HG22      VAL  70  -6.286 -10.480 -10.953
    9   HG21  VAL  70          HG23      VAL  70  -6.953 -12.105 -10.811

  No H/Q in entry =           9
  In of MODEL   31
    1    H    SER  71           H        SER  71  -7.353  -9.749 -14.494
    2    HA   SER  71           HA       SER  71  -5.083 -10.889 -15.738
    3    HB2  SER  71           HB2      SER  71  -6.298  -8.873 -16.577
    4    HB3  SER  71           HB3      SER  71  -5.650  -7.960 -15.217
    5    HG   SER  71           HG       SER  71  -4.441  -8.808 -17.536

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU  72           H        LEU  72  -3.060 -11.131 -15.074
    2    HA   LEU  72           HA       LEU  72  -2.354 -10.895 -12.361
    3    HB2  LEU  72           HB2      LEU  72  -0.685 -11.303 -14.837
    4    HB3  LEU  72           HB3      LEU  72  -0.026 -11.355 -13.205
    5    HG   LEU  72           HG       LEU  72  -2.345 -13.095 -14.105
    6   HD11  LEU  72          HD11      LEU  72   0.629 -13.681 -14.032
    7   HD13  LEU  72          HD12      LEU  72  -0.416 -13.688 -15.452
    8   HD12  LEU  72          HD13      LEU  72  -0.620 -14.915 -14.203
    9   HD22  LEU  72          HD21      LEU  72  -2.349 -13.097 -11.755
   10   HD21  LEU  72          HD22      LEU  72  -0.603 -12.940 -11.641
   11   HD23  LEU  72          HD23      LEU  72  -1.319 -14.477 -12.118

  No H/Q in entry =          11
  In of MODEL   31
    1    H    VAL  73           H        VAL  73  -1.664  -8.875 -15.145
    2    HA   VAL  73           HA       VAL  73   0.222  -7.139 -14.040
    3    HB   VAL  73           HB       VAL  73  -0.188  -5.734 -15.902
    4   HG13  VAL  73          HG11      VAL  73  -0.124  -7.305 -17.736
    5   HG12  VAL  73          HG12      VAL  73  -0.961  -8.529 -16.782
    6   HG11  VAL  73          HG13      VAL  73   0.684  -8.057 -16.362
    7   HG23  VAL  73          HG21      VAL  73  -2.338  -6.339 -17.308
    8   HG22  VAL  73          HG22      VAL  73  -2.470  -5.256 -15.924
    9   HG21  VAL  73          HG23      VAL  73  -2.931  -6.950 -15.763

  No H/Q in entry =           9
  In of MODEL   31
    1    H    LEU  74           H        LEU  74  -3.175  -7.313 -13.494
    2    HA   LEU  74           HA       LEU  74  -3.842  -4.667 -12.893
    3    HB2  LEU  74           HB2      LEU  74  -5.535  -6.374 -13.069
    4    HB3  LEU  74           HB3      LEU  74  -4.839  -7.266 -11.720
    5    HG   LEU  74           HG       LEU  74  -5.356  -5.386 -10.204
    6   HD13  LEU  74          HD11      LEU  74  -5.258  -3.456 -11.569
    7   HD12  LEU  74          HD12      LEU  74  -6.976  -3.642 -11.224
    8   HD11  LEU  74          HD13      LEU  74  -6.329  -4.156 -12.784
    9   HD23  LEU  74          HD21      LEU  74  -7.890  -5.851 -11.685
   10   HD22  LEU  74          HD22      LEU  74  -7.527  -5.999  -9.979
   11   HD21  LEU  74          HD23      LEU  74  -7.022  -7.258 -11.078

  No H/Q in entry =          11
  In of MODEL   31
    1    H    VAL  75           H        VAL  75  -2.764  -7.228 -10.719
    2    HA   VAL  75           HA       VAL  75  -2.602  -5.666  -8.380
    3    HB   VAL  75           HB       VAL  75  -1.057  -8.136  -9.155
    4   HG11  VAL  75          HG11      VAL  75  -1.296  -6.649  -6.502
    5   HG13  VAL  75          HG12      VAL  75   0.172  -6.912  -7.430
    6   HG12  VAL  75          HG13      VAL  75  -0.638  -8.272  -6.673
    7   HG23  VAL  75          HG21      VAL  75  -3.307  -7.850  -7.160
    8   HG22  VAL  75          HG22      VAL  75  -2.743  -9.308  -7.976
    9   HG21  VAL  75          HG23      VAL  75  -3.653  -8.091  -8.872

  No H/Q in entry =           9
  In of MODEL   31
    1    H    GLU  76           H        GLU  76  -0.170  -6.392 -10.904
    2    HA   GLU  76           HA       GLU  76   1.987  -5.002  -9.743
    3    HB2  GLU  76           HB2      GLU  76   2.173  -6.493 -11.741
    4    HB3  GLU  76           HB3      GLU  76   1.318  -5.291 -12.694
    5    HG2  GLU  76           HG2      GLU  76   3.123  -3.665 -12.313
    6    HG3  GLU  76           HG3      GLU  76   3.989  -4.815 -11.313

  No H/Q in entry =           6
  In of MODEL   31
    1    H    ALA  77           H        ALA  77  -0.558  -3.853 -11.945
    2    HA   ALA  77           HA       ALA  77   0.386  -1.190 -12.126
    3    HB3  ALA  77           HB1      ALA  77  -2.362  -2.401 -12.484
    4    HB1  ALA  77           HB2      ALA  77  -1.214  -1.932 -13.739
    5    HB2  ALA  77           HB3      ALA  77  -2.021  -0.694 -12.776

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLN  78           H        GLN  78  -1.863  -2.779  -9.919
    2    HA   GLN  78           HA       GLN  78  -2.716  -0.471  -8.528
    3    HB2  GLN  78           HB2      GLN  78  -3.783  -2.753  -8.441
    4    HB3  GLN  78           HB3      GLN  78  -2.443  -3.280  -7.427
    5    HG2  GLN  78           HG2      GLN  78  -3.006  -1.555  -5.771
    6    HG3  GLN  78           HG3      GLN  78  -4.337  -1.003  -6.787
    7   HE21  GLN  78          HE21      GLN  78  -4.806  -1.992  -4.131
    8   HE22  GLN  78          HE22      GLN  78  -5.658  -3.454  -4.255

  No H/Q in entry =           8
  In of MODEL   31
    1    H    LEU  79           H        LEU  79   0.001  -2.676  -8.060
    2    HA   LEU  79           HA       LEU  79   0.950  -1.754  -5.602
    3    HB2  LEU  79           HB2      LEU  79   1.861  -3.750  -6.660
    4    HB3  LEU  79           HB3      LEU  79   2.495  -2.790  -7.993
    5    HG   LEU  79           HG       LEU  79   4.024  -1.618  -6.487
    6   HD13  LEU  79          HD11      LEU  79   3.007  -1.385  -4.425
    7   HD12  LEU  79          HD12      LEU  79   4.108  -2.713  -4.073
    8   HD11  LEU  79          HD13      LEU  79   2.410  -3.045  -4.408
    9   HD23  LEU  79          HD21      LEU  79   5.270  -3.740  -5.572
   10   HD22  LEU  79          HD22      LEU  79   5.070  -3.550  -7.312
   11   HD21  LEU  79          HD23      LEU  79   4.008  -4.637  -6.420

  No H/Q in entry =          11
  In of MODEL   31
    1    H    HIS  80           H        HIS  80   1.813  -0.631  -8.875
    2    HA   HIS  80           HA       HIS  80   3.579   1.393  -7.952
    3    HB2  HIS  80           HB2      HIS  80   2.314   0.666 -10.538
    4    HB3  HIS  80           HB3      HIS  80   2.876   2.330 -10.370
    5    HD1  HIS  80           HD1      HIS  80   5.274   2.674 -10.883
    6    HD2  HIS  80           HD2      HIS  80   4.524  -1.248  -9.682
    7    HE1  HIS  80           HE1      HIS  80   7.488   1.438 -11.036
    8    HE2  HIS  80           HE2      HIS  80   7.043  -0.955 -10.307

  No H/Q in entry =           8
  In of MODEL   31
    1    H    LEU  81           H        LEU  81   0.177   1.485  -8.946
    2    HA   LEU  81           HA       LEU  81  -0.153   4.272  -8.625
    3    HB2  LEU  81           HB2      LEU  81  -2.125   1.989  -8.547
    4    HB3  LEU  81           HB3      LEU  81  -2.610   3.683  -8.462
    5    HG   LEU  81           HG       LEU  81  -0.886   2.559 -10.688
    6   HD12  LEU  81          HD11      LEU  81  -3.118   2.831 -11.997
    7   HD11  LEU  81          HD12      LEU  81  -3.879   2.753 -10.408
    8   HD13  LEU  81          HD13      LEU  81  -2.907   1.402 -10.987
    9   HD23  LEU  81          HD21      LEU  81  -2.020   4.678 -11.796
   10   HD22  LEU  81          HD22      LEU  81  -0.611   4.880 -10.758
   11   HD21  LEU  81          HD23      LEU  81  -2.225   5.199 -10.125

  No H/Q in entry =          11
  In of MODEL   31
    1    H    MET  82           H        MET  82  -0.769   1.580  -6.371
    2    HA   MET  82           HA       MET  82  -1.861   3.151  -4.293
    3    HB2  MET  82           HB2      MET  82  -0.434   0.492  -4.318
    4    HB3  MET  82           HB3      MET  82  -1.033   1.210  -2.825
    5    HG2  MET  82           HG2      MET  82  -2.746   0.675  -5.272
    6    HG3  MET  82           HG3      MET  82  -2.652  -0.393  -3.873
    7    HE3  MET  82           HE1      MET  82  -4.419   1.231  -1.070
    8    HE2  MET  82           HE2      MET  82  -2.694   1.543  -1.248
    9    HE1  MET  82           HE3      MET  82  -3.349  -0.030  -1.700

  No H/Q in entry =           9
  In of MODEL   31
    1    H    THR  83           H        THR  83   1.463   2.130  -4.965
    2    HA   THR  83           HA       THR  83   2.649   3.265  -2.663
    3    HB   THR  83           HB       THR  83   4.751   3.247  -4.128
    4    HG1  THR  83           HG1      THR  83   4.530   2.710  -6.151
    5   HG22  THR  83          HG21      THR  83   4.361   0.580  -4.453
    6   HG21  THR  83          HG22      THR  83   3.060   0.937  -3.320
    7   HG23  THR  83          HG23      THR  83   4.730   1.315  -2.894

  No H/Q in entry =           7
  In of MODEL   31
    1    H    SER  84           H        SER  84   2.267   4.527  -5.969
    2    HA   SER  84           HA       SER  84   3.555   6.995  -5.516
    3    HB2  SER  84           HB2      SER  84   1.510   6.115  -7.541
    4    HB3  SER  84           HB3      SER  84   2.156   7.756  -7.518
    5    HG   SER  84           HG       SER  84   3.579   5.308  -7.796

  No H/Q in entry =           5
  In of MODEL   31
    1    H    MET  85           H        MET  85   0.076   6.169  -5.356
    2    HA   MET  85           HA       MET  85  -0.840   8.764  -4.766
    3    HB2  MET  85           HB2      MET  85  -2.328   6.932  -5.436
    4    HB3  MET  85           HB3      MET  85  -2.022   6.123  -3.900
    5    HG2  MET  85           HG2      MET  85  -2.951   8.058  -2.686
    6    HG3  MET  85           HG3      MET  85  -3.237   8.882  -4.216
    7    HE3  MET  85           HE1      MET  85  -6.835   7.967  -3.058
    8    HE2  MET  85           HE2      MET  85  -5.756   9.244  -3.617
    9    HE1  MET  85           HE3      MET  85  -5.455   8.459  -2.069

  No H/Q in entry =           9
  In of MODEL   31
    1    H    LEU  86           H        LEU  86   0.123   6.126  -2.611
    2    HA   LEU  86           HA       LEU  86  -0.446   7.425  -0.175
    3    HB2  LEU  86           HB2      LEU  86   0.068   4.963  -0.560
    4    HB3  LEU  86           HB3      LEU  86   1.767   5.425  -0.649
    5    HG   LEU  86           HG       LEU  86   1.410   6.586   1.615
    6   HD11  LEU  86          HD11      LEU  86  -1.267   5.767   1.134
    7   HD13  LEU  86          HD12      LEU  86  -0.621   6.531   2.585
    8   HD12  LEU  86          HD13      LEU  86  -0.678   4.773   2.471
    9   HD23  LEU  86          HD21      LEU  86   1.039   3.586   1.744
   10   HD22  LEU  86          HD22      LEU  86   2.017   4.618   2.785
   11   HD21  LEU  86          HD23      LEU  86   2.531   4.298   1.129

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ALA  87           H        ALA  87   2.548   7.183  -2.051
    2    HA   ALA  87           HA       ALA  87   4.220   8.629  -0.323
    3    HB3  ALA  87           HB1      ALA  87   4.345   7.611  -3.027
    4    HB2  ALA  87           HB2      ALA  87   5.669   7.970  -1.922
    5    HB1  ALA  87           HB3      ALA  87   5.035   9.235  -2.972

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ARG  88           H        ARG  88   2.263   9.722  -3.055
    2    HA   ARG  88           HA       ARG  88   2.987  12.425  -2.942
    3    HB2  ARG  88           HB2      ARG  88   1.762  11.245  -4.801
    4    HB3  ARG  88           HB3      ARG  88   0.299  11.364  -3.825
    5    HG2  ARG  88           HG2      ARG  88   1.270  13.963  -3.744
    6    HG3  ARG  88           HG3      ARG  88   1.710  13.452  -5.372
    7    HD2  ARG  88           HD2      ARG  88  -0.429  13.492  -6.078
    8    HD3  ARG  88           HD3      ARG  88  -1.006  12.632  -4.650
    9    HE   ARG  88           HE       ARG  88  -1.244  15.405  -5.076
   10   HH21  ARG  88          HH11      ARG  88  -1.802  16.729  -3.344
   11   HH22  ARG  88          HH12      ARG  88  -1.503  16.201  -1.724
   12   HH11  ARG  88          HH21      ARG  88  -0.197  13.167  -2.692
   13   HH12  ARG  88          HH22      ARG  88  -0.612  14.178  -1.355

  No H/Q in entry =          13
  In of MODEL   31
    1    H    GLU  89           H        GLU  89   0.308  10.707  -1.308
    2    HA   GLU  89           HA       GLU  89  -0.845  13.002  -0.114
    3    HB2  GLU  89           HB2      GLU  89  -1.923  10.743  -0.199
    4    HB3  GLU  89           HB3      GLU  89  -0.794  10.211   1.048
    5    HG2  GLU  89           HG2      GLU  89  -1.650  11.899   2.599
    6    HG3  GLU  89           HG3      GLU  89  -2.709  12.548   1.350

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LEU  90           H        LEU  90   1.641  10.756   1.076
    2    HA   LEU  90           HA       LEU  90   1.966  12.013   3.603
    3    HB2  LEU  90           HB2      LEU  90   3.776  10.265   1.937
    4    HB3  LEU  90           HB3      LEU  90   4.179  10.793   3.576
    5    HG   LEU  90           HG       LEU  90   1.571   9.401   2.909
    6   HD12  LEU  90          HD11      LEU  90   2.742   7.377   3.927
    7   HD11  LEU  90          HD12      LEU  90   4.250   8.259   3.688
    8   HD13  LEU  90          HD13      LEU  90   3.250   7.830   2.299
    9   HD22  LEU  90          HD21      LEU  90   1.282  10.325   5.027
   10   HD21  LEU  90          HD22      LEU  90   3.000  10.248   5.416
   11   HD23  LEU  90          HD23      LEU  90   2.018   8.784   5.464

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  91           H        ILE  91   3.574  12.415   0.482
    2    HA   ILE  91           HA       ILE  91   5.517  14.281   1.324
    3    HB   ILE  91           HB       ILE  91   4.224  13.762  -1.360
    4   HG12  ILE  91          HG12      ILE  91   7.060  13.325  -0.374
    5   HG13  ILE  91          HG13      ILE  91   5.798  12.106  -0.213
    6   HG22  ILE  91          HG21      ILE  91   6.427  15.144  -2.043
    7   HG21  ILE  91          HG22      ILE  91   6.097  15.944  -0.505
    8   HG23  ILE  91          HG23      ILE  91   4.879  15.949  -1.779
    9   HD13  ILE  91          HD11      ILE  91   5.639  11.774  -2.520
   10   HD12  ILE  91          HD12      ILE  91   7.368  12.047  -2.300
   11   HD11  ILE  91          HD13      ILE  91   6.339  13.351  -2.894

  No H/Q in entry =          11
  In of MODEL   31
    1    H    THR  92           H        THR  92   2.152  14.655   0.302
    2    HA   THR  92           HA       THR  92   2.080  17.478   0.235
    3    HB   THR  92           HB       THR  92  -0.058  15.449   0.931
    4    HG1  THR  92           HG1      THR  92   0.258  15.271  -1.153
    5   HG22  THR  92          HG21      THR  92  -1.491  17.586   0.198
    6   HG21  THR  92          HG22      THR  92  -0.115  18.436   0.898
    7   HG23  THR  92          HG23      THR  92  -1.042  17.301   1.879

  No H/Q in entry =           7
  In of MODEL   31
    1    H    GLU  93           H        GLU  93   1.559  15.175   2.892
    2    HA   GLU  93           HA       GLU  93   0.988  17.075   4.904
    3    HB2  GLU  93           HB2      GLU  93   2.345  14.372   5.152
    4    HB3  GLU  93           HB3      GLU  93   1.634  15.291   6.480
    5    HG2  GLU  93           HG2      GLU  93   0.044  14.481   4.037
    6    HG3  GLU  93           HG3      GLU  93   0.156  13.464   5.468

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LEU  94           H        LEU  94   4.023  15.639   3.769
    2    HA   LEU  94           HA       LEU  94   5.747  16.820   5.661
    3    HB2  LEU  94           HB2      LEU  94   6.175  15.852   2.834
    4    HB3  LEU  94           HB3      LEU  94   7.491  16.534   3.787
    5    HG   LEU  94           HG       LEU  94   5.782  14.313   4.921
    6   HD11  LEU  94          HD11      LEU  94   7.889  14.116   2.798
    7   HD13  LEU  94          HD12      LEU  94   6.458  13.119   3.056
    8   HD12  LEU  94          HD13      LEU  94   7.884  12.892   4.069
    9   HD23  LEU  94          HD21      LEU  94   7.976  13.814   6.083
   10   HD22  LEU  94          HD22      LEU  94   7.282  15.383   6.493
   11   HD21  LEU  94          HD23      LEU  94   8.627  15.281   5.356

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  95           H        ILE  95   4.601  17.965   2.504
    2    HA   ILE  95           HA       ILE  95   6.135  20.348   2.445
    3    HB   ILE  95           HB       ILE  95   3.507  19.618   1.131
    4   HG12  ILE  95          HG12      ILE  95   6.295  19.998   0.004
    5   HG13  ILE  95          HG13      ILE  95   5.669  18.435   0.520
    6   HG21  ILE  95          HG21      ILE  95   5.217  22.113   0.911
    7   HG23  ILE  95          HG22      ILE  95   3.492  22.018   1.261
    8   HG22  ILE  95          HG23      ILE  95   4.088  21.623  -0.352
    9   HD13  ILE  95          HD11      ILE  95   4.117  18.330  -1.215
   10   HD12  ILE  95          HD12      ILE  95   5.455  19.168  -2.000
   11   HD11  ILE  95          HD13      ILE  95   4.066  20.082  -1.415

  No H/Q in entry =          11
  In of MODEL   31
    1    H    GLU  96           H        GLU  96   2.892  19.646   3.729
    2    HA   GLU  96           HA       GLU  96   2.226  22.284   4.471
    3    HB2  GLU  96           HB2      GLU  96   0.581  20.475   4.481
    4    HB3  GLU  96           HB3      GLU  96   1.451  19.664   5.782
    5    HG2  GLU  96           HG2      GLU  96   0.404  20.935   7.344
    6    HG3  GLU  96           HG3      GLU  96   0.919  22.415   6.546

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LEU  97           H        LEU  97   4.104  19.768   6.110
    2    HA   LEU  97           HA       LEU  97   4.430  21.127   8.579
    3    HB2  LEU  97           HB2      LEU  97   6.007  18.980   7.176
    4    HB3  LEU  97           HB3      LEU  97   6.580  19.678   8.688
    5    HG   LEU  97           HG       LEU  97   3.789  18.539   8.369
    6   HD12  LEU  97          HD11      LEU  97   4.757  16.545   9.591
    7   HD11  LEU  97          HD12      LEU  97   6.359  17.200   9.251
    8   HD13  LEU  97          HD13      LEU  97   5.302  16.722   7.922
    9   HD23  LEU  97          HD21      LEU  97   4.237  18.258  10.936
   10   HD22  LEU  97          HD22      LEU  97   3.834  19.862  10.326
   11   HD21  LEU  97          HD23      LEU  97   5.511  19.450  10.679

  No H/Q in entry =          11
  In of MODEL   31
    1    H    HIS  98           H        HIS  98   6.312  21.166   5.560
    2    HA   HIS  98           HA       HIS  98   8.437  22.781   6.464
    3    HB2  HIS  98           HB2      HIS  98   7.159  22.499   3.734
    4    HB3  HIS  98           HB3      HIS  98   8.582  23.501   4.027
    5    HD1  HIS  98           HD1      HIS  98   7.426  19.912   4.051
    6    HD2  HIS  98           HD2      HIS  98  10.973  22.065   4.484
    7    HE1  HIS  98           HE1      HIS  98   9.308  18.211   4.005
    8    HE2  HIS  98           HE2      HIS  98  11.472  19.502   4.270

  No H/Q in entry =           8
  In of MODEL   31
    1    H    GLU  99           H        GLU  99   5.208  23.563   5.274
    2    HA   GLU  99           HA       GLU  99   5.544  26.383   5.211
    3    HB2  GLU  99           HB2      GLU  99   3.687  25.183   4.076
    4    HB3  GLU  99           HB3      GLU  99   2.991  24.814   5.653
    5    HG2  GLU  99           HG2      GLU  99   2.772  27.204   6.148
    6    HG3  GLU  99           HG3      GLU  99   3.548  27.612   4.620

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LYS 100           H        LYS 100   4.438  24.137   7.734
    2    HA   LYS 100           HA       LYS 100   3.813  26.186   9.620
    3    HB2  LYS 100           HB2      LYS 100   4.432  23.245   9.975
    4    HB3  LYS 100           HB3      LYS 100   3.963  24.314  11.303
    5    HG2  LYS 100           HG2      LYS 100   1.892  24.917  10.046
    6    HG3  LYS 100           HG3      LYS 100   2.342  23.751   8.798
    7    HD2  LYS 100           HD2      LYS 100   2.286  21.934  10.463
    8    HD3  LYS 100           HD3      LYS 100   1.853  23.093  11.722
    9    HE2  LYS 100           HE2      LYS 100  -0.204  23.680  10.450
   10    HE3  LYS 100           HE3      LYS 100   0.219  22.464   9.239
   11    HZ1  LYS 100           HZ1      LYS 100  -0.048  21.800  12.120
   12    HZ3  LYS 100           HZ2      LYS 100  -0.042  20.742  10.788
   13    HZ2  LYS 100           HZ3      LYS 100  -1.374  21.762  11.060

  No H/Q in entry =          13
  In of MODEL   31
    1    H    LEU 101           H        LEU 101   6.766  24.433   8.802
    2    HA   LEU 101           HA       LEU 101   8.343  25.302  11.010
    3    HB2  LEU 101           HB2      LEU 101   8.963  24.318   8.236
    4    HB3  LEU 101           HB3      LEU 101  10.251  25.005   9.221
    5    HG   LEU 101           HG       LEU 101   8.448  22.824  10.283
    6   HD12  LEU 101          HD11      LEU 101  10.526  21.359   9.686
    7   HD11  LEU 101          HD12      LEU 101  10.879  22.625   8.512
    8   HD13  LEU 101          HD13      LEU 101   9.364  21.729   8.414
    9   HD21  LEU 101          HD21      LEU 101  11.152  23.975  11.019
   10   HD23  LEU 101          HD22      LEU 101  10.630  22.396  11.600
   11   HD22  LEU 101          HD23      LEU 101   9.715  23.839  12.031

  No H/Q in entry =          11
  In of MODEL   31
    1    H    LYS 102           H        LYS 102   6.741  27.137   8.858
    2    HA   LYS 102           HA       LYS 102   6.785  29.430   8.562
    3    HB2  LYS 102           HB2      LYS 102   8.343  29.343  10.666
    4    HB3  LYS 102           HB3      LYS 102   9.644  29.554   9.511
    5    HG2  LYS 102           HG2      LYS 102   7.506  31.478  10.360
    6    HG3  LYS 102           HG3      LYS 102   9.216  31.762  10.115
    7    HD2  LYS 102           HD2      LYS 102   7.280  31.305   7.808
    8    HD3  LYS 102           HD3      LYS 102   7.637  32.892   8.475
    9    HE2  LYS 102           HE2      LYS 102   9.036  31.723   6.409
   10    HE3  LYS 102           HE3      LYS 102   9.629  33.041   7.420
   11    HZ2  LYS 102           HZ1      LYS 102  11.178  31.158   7.255
   12    HZ1  LYS 102           HZ2      LYS 102  10.028  30.161   7.995
   13    HZ3  LYS 102           HZ3      LYS 102  10.697  31.460   8.854

  No H/Q in entry =          13
  In of MODEL   31
    1    H    ALA 103           H        ALA 103  10.064  28.138   8.013
    2    HA   ALA 103           HA       ALA 103  11.015  29.524   5.937
    3    HB2  ALA 103           HB1      ALA 103  11.936  27.321   5.018
    4    HB1  ALA 103           HB2      ALA 103  11.048  26.537   6.323
    5    HB3  ALA 103           HB3      ALA 103  12.319  27.700   6.698

  No H/Q in entry =           5
  In of MODEL   31
    1    H1   LYS   3           H1       LYS   3 -30.962   6.585 -19.534
    2    H2   LYS   3           H3       LYS   3 -29.999   6.263 -20.894
    3    H3   LYS   3           H2       LYS   3 -31.419   5.371 -20.628
    4    HA   LYS   3           HA       LYS   3 -30.444   3.956 -19.232
    5    HB2  LYS   3           HB2      LYS   3 -28.135   5.293 -20.594
    6    HB3  LYS   3           HB3      LYS   3 -27.833   4.079 -19.351
    7    HG2  LYS   3           HG2      LYS   3 -29.318   2.534 -20.680
    8    HG3  LYS   3           HG3      LYS   3 -29.252   3.728 -21.974
    9    HD2  LYS   3           HD2      LYS   3 -26.773   3.538 -21.952
   10    HD3  LYS   3           HD3      LYS   3 -26.918   2.247 -20.760
   11    HE2  LYS   3           HE2      LYS   3 -28.472   1.114 -22.455
   12    HE3  LYS   3           HE3      LYS   3 -27.829   2.269 -23.622
   13    HZ3  LYS   3           HZ1      LYS   3 -26.073   0.985 -23.908
   14    HZ2  LYS   3           HZ2      LYS   3 -26.726  -0.161 -22.838
   15    HZ1  LYS   3           HZ3      LYS   3 -25.692   1.054 -22.255

  No H/Q in entry =          15
  In of MODEL   31
    1    H    LYS   4           H        LYS   4 -30.477   3.821 -17.169
    2    HA   LYS   4           HA       LYS   4 -29.656   6.087 -15.535
    3    HB2  LYS   4           HB2      LYS   4 -30.934   3.436 -14.813
    4    HB3  LYS   4           HB3      LYS   4 -30.657   4.769 -13.693
    5    HG2  LYS   4           HG2      LYS   4 -32.494   4.758 -16.094
    6    HG3  LYS   4           HG3      LYS   4 -32.963   4.828 -14.396
    7    HD2  LYS   4           HD2      LYS   4 -32.194   7.028 -14.145
    8    HD3  LYS   4           HD3      LYS   4 -31.173   6.933 -15.579
    9    HE2  LYS   4           HE2      LYS   4 -33.059   8.367 -16.024
   10    HE3  LYS   4           HE3      LYS   4 -33.198   6.895 -16.986
   11    HZ3  LYS   4           HZ1      LYS   4 -34.784   6.037 -15.419
   12    HZ2  LYS   4           HZ2      LYS   4 -35.298   7.548 -16.002
   13    HZ1  LYS   4           HZ3      LYS   4 -34.627   7.421 -14.446

  No H/Q in entry =          13
  In of MODEL   31
    1    H    HIS   5           H        HIS   5 -28.168   6.129 -13.960
    2    HA   HIS   5           HA       HIS   5 -25.950   4.226 -14.312
    3    HB2  HIS   5           HB2      HIS   5 -26.100   6.991 -13.112
    4    HB3  HIS   5           HB3      HIS   5 -24.650   5.989 -13.109
    5    HD1  HIS   5           HD1      HIS   5 -23.161   7.135 -14.719
    6    HD2  HIS   5           HD2      HIS   5 -26.998   6.635 -16.227
    7    HE1  HIS   5           HE1      HIS   5 -23.002   7.703 -17.172
    8    HE2  HIS   5           HE2      HIS   5 -25.342   7.386 -18.061

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ILE   6           H        ILE   6 -25.758   2.650 -12.993
    2    HA   ILE   6           HA       ILE   6 -26.692   2.958 -10.219
    3    HB   ILE   6           HB       ILE   6 -25.967   0.461 -11.758
    4   HG12  ILE   6          HG12      ILE   6 -28.668   1.491 -10.879
    5   HG13  ILE   6          HG13      ILE   6 -28.039   1.627 -12.520
    6   HG23  ILE   6          HG21      ILE   6 -26.360  -0.773  -9.890
    7   HG22  ILE   6          HG22      ILE   6 -27.471   0.413  -9.200
    8   HG21  ILE   6          HG23      ILE   6 -25.730   0.691  -9.132
    9   HD13  ILE   6          HD11      ILE   6 -28.576  -0.476 -13.009
   10   HD12  ILE   6          HD12      ILE   6 -29.573  -0.422 -11.555
   11   HD11  ILE   6          HD13      ILE   6 -27.940  -1.085 -11.480

  No H/Q in entry =          11
  In of MODEL   31
    1    H    TYR   7           H        TYR   7 -24.897   3.543  -8.954
    2    HA   TYR   7           HA       TYR   7 -22.228   2.492  -9.662
    3    HB2  TYR   7           HB2      TYR   7 -23.091   4.962  -8.178
    4    HB3  TYR   7           HB3      TYR   7 -21.426   4.390  -8.234
    5    HD1  TYR   7           HD1      TYR   7 -22.532   3.475 -11.309
    6    HD2  TYR   7           HD2      TYR   7 -21.715   7.029  -9.101
    7    HE1  TYR   7           HE1      TYR   7 -22.084   4.683 -13.409
    8    HE2  TYR   7           HE2      TYR   7 -21.309   8.244 -11.194
    9    HH   TYR   7           HH       TYR   7 -21.556   8.159 -13.422

  No H/Q in entry =           9
  In of MODEL   31
    1    H    LEU   8           H        LEU   8 -21.293   1.113  -8.340
    2    HA   LEU   8           HA       LEU   8 -22.409   0.664  -5.642
    3    HB2  LEU   8           HB2      LEU   8 -20.785  -1.061  -7.490
    4    HB3  LEU   8           HB3      LEU   8 -20.964  -1.432  -5.775
    5    HG   LEU   8           HG       LEU   8 -23.453  -1.521  -6.169
    6   HD13  LEU   8          HD11      LEU   8 -23.567  -0.307  -8.281
    7   HD12  LEU   8          HD12      LEU   8 -24.155  -1.952  -8.509
    8   HD11  LEU   8          HD13      LEU   8 -22.538  -1.511  -9.054
    9   HD23  LEU   8          HD21      LEU   8 -22.268  -3.609  -7.870
   10   HD22  LEU   8          HD22      LEU   8 -23.345  -3.735  -6.479
   11   HD21  LEU   8          HD23      LEU   8 -21.624  -3.440  -6.238

  No H/Q in entry =          11
  In of MODEL   31
    1    H    PHE   9           H        PHE   9 -21.110   1.050  -3.874
    2    HA   PHE   9           HA       PHE   9 -18.302   1.886  -4.431
    3    HB2  PHE   9           HB2      PHE   9 -20.271   3.031  -2.456
    4    HB3  PHE   9           HB3      PHE   9 -18.548   3.382  -2.430
    5    HD1  PHE   9           HD1      PHE   9 -17.491   4.662  -4.221
    6    HD2  PHE   9           HD2      PHE   9 -21.714   3.904  -4.230
    7    HE1  PHE   9           HE1      PHE   9 -17.795   6.373  -5.985
    8    HE2  PHE   9           HE2      PHE   9 -22.018   5.627  -5.990
    9    HZ   PHE   9           HZ       PHE   9 -20.056   6.858  -6.874

  No H/Q in entry =           9
  In of MODEL   31
    1    H    SER  10           H        SER  10 -16.733   0.871  -3.361
    2    HA   SER  10           HA       SER  10 -16.920  -0.012  -0.658
    3    HB2  SER  10           HB2      SER  10 -16.837  -2.386  -0.969
    4    HB3  SER  10           HB3      SER  10 -18.226  -1.793  -1.866
    5    HG   SER  10           HG       SER  10 -16.916  -1.814  -3.736

  No H/Q in entry =           5
  In of MODEL   31
    1    H    SER  11           H        SER  11 -14.899   0.103   0.127
    2    HA   SER  11           HA       SER  11 -12.715   0.859  -1.453
    3    HB2  SER  11           HB2      SER  11 -11.531   0.976   0.510
    4    HB3  SER  11           HB3      SER  11 -13.182   1.007   1.131
    5    HG   SER  11           HG       SER  11 -13.018  -1.237   1.466

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA  12           H        ALA  12 -14.023  -1.868  -2.103
    2    HA   ALA  12           HA       ALA  12 -11.478  -3.157  -2.698
    3    HB3  ALA  12           HB1      ALA  12 -12.436  -4.093  -0.487
    4    HB2  ALA  12           HB2      ALA  12 -11.932  -5.242  -1.726
    5    HB1  ALA  12           HB3      ALA  12 -13.643  -4.874  -1.514

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLY  13           H        GLY  13 -12.305  -2.192  -4.720
    2    HA3  GLY  13           HA2      GLY  13 -14.599  -2.970  -6.103
    3    HA2  GLY  13           HA3      GLY  13 -13.095  -2.446  -6.874

  No H/Q in entry =           3
  In of MODEL   31
    1    H    MET  14           H        MET  14 -11.556  -4.715  -5.778
    2    HA   MET  14           HA       MET  14 -11.708  -6.479  -7.908
    3    HB2  MET  14           HB2      MET  14  -9.795  -6.499  -6.366
    4    HB3  MET  14           HB3      MET  14 -10.790  -7.238  -5.112
    5    HG2  MET  14           HG2      MET  14  -9.489  -8.972  -6.227
    6    HG3  MET  14           HG3      MET  14 -11.185  -9.179  -6.667
    7    HE1  MET  14           HE1      MET  14  -7.912  -9.542  -7.856
    8    HE3  MET  14           HE2      MET  14  -7.696  -7.800  -7.706
    9    HE2  MET  14           HE3      MET  14  -7.631  -8.554  -9.296

  No H/Q in entry =           9
  In of MODEL   31
    1    H    SER  15           H        SER  15 -13.321  -6.896  -4.774
    2    HA   SER  15           HA       SER  15 -14.601  -9.344  -5.741
    3    HB2  SER  15           HB2      SER  15 -14.665  -7.938  -3.083
    4    HB3  SER  15           HB3      SER  15 -15.891  -9.133  -3.494
    5    HG   SER  15           HG       SER  15 -14.044 -10.522  -4.072

  No H/Q in entry =           5
  In of MODEL   31
    1    H    THR  16           H        THR  16 -15.557  -5.965  -5.071
    2    HA   THR  16           HA       THR  16 -18.381  -6.322  -5.508
    3    HB   THR  16           HB       THR  16 -16.727  -3.835  -6.067
    4    HG1  THR  16           HG1      THR  16 -16.206  -4.177  -4.036
    5   HG23  THR  16          HG21      THR  16 -19.043  -3.708  -6.812
    6   HG22  THR  16          HG22      THR  16 -18.847  -2.714  -5.357
    7   HG21  THR  16          HG23      THR  16 -19.604  -4.310  -5.258

  No H/Q in entry =           7
  In of MODEL   31
    1    H    SER  17           H        SER  17 -15.603  -5.833  -7.430
    2    HA   SER  17           HA       SER  17 -16.730  -5.063  -9.922
    3    HB2  SER  17           HB2      SER  17 -14.141  -6.474  -9.248
    4    HB3  SER  17           HB3      SER  17 -14.585  -6.015 -10.892
    5    HG   SER  17           HG       SER  17 -14.973  -3.863  -9.590

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU  18           H        LEU  18 -16.252  -8.221  -8.469
    2    HA   LEU  18           HA       LEU  18 -16.912  -9.708 -10.812
    3    HB2  LEU  18           HB2      LEU  18 -15.705 -10.694  -8.908
    4    HB3  LEU  18           HB3      LEU  18 -17.128 -10.464  -7.893
    5    HG   LEU  18           HG       LEU  18 -18.400 -12.011  -9.285
    6   HD11  LEU  18          HD11      LEU  18 -15.896 -11.920 -10.938
    7   HD13  LEU  18          HD12      LEU  18 -17.577 -11.804 -11.457
    8   HD12  LEU  18          HD13      LEU  18 -16.913 -13.359 -10.957
    9   HD23  LEU  18          HD21      LEU  18 -15.776 -13.278  -8.589
   10   HD22  LEU  18          HD22      LEU  18 -17.388 -13.999  -8.566
   11   HD21  LEU  18          HD23      LEU  18 -16.956 -12.765  -7.382

  No H/Q in entry =          11
  In of MODEL   31
    1    H    LEU  19           H        LEU  19 -18.812  -8.427  -8.085
    2    HA   LEU  19           HA       LEU  19 -21.322  -9.531  -8.888
    3    HB2  LEU  19           HB2      LEU  19 -20.967  -8.682  -6.639
    4    HB3  LEU  19           HB3      LEU  19 -20.698  -7.060  -7.275
    5    HG   LEU  19           HG       LEU  19 -23.023  -6.848  -7.864
    6   HD11  LEU  19          HD11      LEU  19 -23.054  -9.764  -7.249
    7   HD13  LEU  19          HD12      LEU  19 -23.874  -8.876  -8.533
    8   HD12  LEU  19          HD13      LEU  19 -24.500  -8.821  -6.886
    9   HD22  LEU  19          HD21      LEU  19 -22.563  -6.157  -5.674
   10   HD21  LEU  19          HD22      LEU  19 -22.436  -7.815  -5.086
   11   HD23  LEU  19          HD23      LEU  19 -24.008  -7.160  -5.544

  No H/Q in entry =          11
  In of MODEL   31
    1    H    VAL  20           H        VAL  20 -19.729  -6.424  -9.610
    2    HA   VAL  20           HA       VAL  20 -21.822  -5.318 -11.160
    3    HB   VAL  20           HB       VAL  20 -18.816  -4.825 -11.322
    4   HG13  VAL  20          HG11      VAL  20 -19.648  -4.181 -13.463
    5   HG12  VAL  20          HG12      VAL  20 -19.537  -2.694 -12.522
    6   HG11  VAL  20          HG13      VAL  20 -21.102  -3.470 -12.762
    7   HG23  VAL  20          HG21      VAL  20 -19.570  -2.620 -10.297
    8   HG22  VAL  20          HG22      VAL  20 -19.594  -4.045  -9.261
    9   HG21  VAL  20          HG23      VAL  20 -21.095  -3.436  -9.957

  No H/Q in entry =           9
  In of MODEL   31
    1    H    SER  21           H        SER  21 -19.144  -7.461 -12.209
    2    HA   SER  21           HA       SER  21 -19.953  -7.332 -14.952
    3    HB2  SER  21           HB2      SER  21 -18.588  -9.349 -15.291
    4    HB3  SER  21           HB3      SER  21 -17.708  -8.126 -14.379
    5    HG   SER  21           HG       SER  21 -18.194  -9.262 -12.496

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LYS  22           H        LYS  22 -21.063  -9.473 -12.361
    2    HA   LYS  22           HA       LYS  22 -22.674 -11.046 -14.162
    3    HB2  LYS  22           HB2      LYS  22 -21.914 -11.790 -11.869
    4    HB3  LYS  22           HB3      LYS  22 -23.114 -10.685 -11.202
    5    HG2  LYS  22           HG2      LYS  22 -24.175 -12.753 -11.151
    6    HG3  LYS  22           HG3      LYS  22 -24.817 -11.991 -12.604
    7    HD2  LYS  22           HD2      LYS  22 -23.287 -13.273 -13.990
    8    HD3  LYS  22           HD3      LYS  22 -22.556 -13.989 -12.553
    9    HE2  LYS  22           HE2      LYS  22 -25.459 -14.325 -13.329
   10    HE3  LYS  22           HE3      LYS  22 -24.188 -15.482 -13.725
   11    HZ1  LYS  22           HZ1      LYS  22 -23.973 -15.077 -11.026
   12    HZ3  LYS  22           HZ2      LYS  22 -24.638 -16.434 -11.802
   13    HZ2  LYS  22           HZ3      LYS  22 -25.646 -15.160 -11.309

  No H/Q in entry =          13
  In of MODEL   31
    1    H    MET  23           H        MET  23 -23.279  -8.096 -12.296
    2    HA   MET  23           HA       MET  23 -26.093  -8.081 -12.772
    3    HB2  MET  23           HB2      MET  23 -24.162  -5.835 -12.227
    4    HB3  MET  23           HB3      MET  23 -25.902  -5.607 -12.387
    5    HG2  MET  23           HG2      MET  23 -26.317  -6.890 -10.410
    6    HG3  MET  23           HG3      MET  23 -24.621  -7.359 -10.300
    7    HE2  MET  23           HE1      MET  23 -26.780  -3.627  -9.101
    8    HE1  MET  23           HE2      MET  23 -27.082  -4.591 -10.545
    9    HE3  MET  23           HE3      MET  23 -25.999  -3.201 -10.624

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ARG  24           H        ARG  24 -23.310  -6.753 -14.590
    2    HA   ARG  24           HA       ARG  24 -24.782  -5.407 -16.578
    3    HB2  ARG  24           HB2      ARG  24 -22.005  -6.630 -16.621
    4    HB3  ARG  24           HB3      ARG  24 -22.659  -5.733 -17.969
    5    HG2  ARG  24           HG2      ARG  24 -22.835  -3.686 -16.558
    6    HG3  ARG  24           HG3      ARG  24 -22.171  -4.610 -15.184
    7    HD2  ARG  24           HD2      ARG  24 -20.792  -4.265 -17.888
    8    HD3  ARG  24           HD3      ARG  24 -20.437  -3.314 -16.451
    9    HE   ARG  24           HE       ARG  24 -19.953  -5.662 -15.450
   10   HH21  ARG  24          HH11      ARG  24 -17.742  -5.743 -15.053
   11   HH22  ARG  24          HH12      ARG  24 -16.629  -5.596 -16.369
   12   HH11  ARG  24          HH21      ARG  24 -19.215  -4.659 -18.597
   13   HH12  ARG  24          HH22      ARG  24 -17.512  -4.965 -18.463

  No H/Q in entry =          13
  In of MODEL   31
    1    H    ALA  25           H        ALA  25 -23.775  -8.782 -16.303
    2    HA   ALA  25           HA       ALA  25 -24.460  -9.597 -18.931
    3    HB1  ALA  25           HB1      ALA  25 -23.829 -11.651 -18.237
    4    HB3  ALA  25           HB2      ALA  25 -24.871 -11.589 -16.815
    5    HB2  ALA  25           HB3      ALA  25 -23.288 -10.817 -16.780

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLN  26           H        GLN  26 -26.256  -9.563 -15.890
    2    HA   GLN  26           HA       GLN  26 -28.651 -10.683 -16.879
    3    HB2  GLN  26           HB2      GLN  26 -28.052  -8.950 -14.501
    4    HB3  GLN  26           HB3      GLN  26 -29.643  -9.617 -14.834
    5    HG2  GLN  26           HG2      GLN  26 -27.107 -11.165 -14.387
    6    HG3  GLN  26           HG3      GLN  26 -28.451 -11.011 -13.264
    7   HE21  GLN  26          HE21      GLN  26 -27.326 -13.220 -14.548
    8   HE22  GLN  26          HE22      GLN  26 -28.414 -14.231 -15.331

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ALA  27           H        ALA  27 -27.591  -7.321 -16.505
    2    HA   ALA  27           HA       ALA  27 -30.048  -6.141 -17.267
    3    HB1  ALA  27           HB1      ALA  27 -28.180  -4.890 -16.172
    4    HB3  ALA  27           HB2      ALA  27 -28.758  -4.106 -17.644
    5    HB2  ALA  27           HB3      ALA  27 -27.255  -5.027 -17.669

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLU  28           H        GLU  28 -27.412  -7.463 -19.160
    2    HA   GLU  28           HA       GLU  28 -28.334  -6.395 -21.672
    3    HB2  GLU  28           HB2      GLU  28 -25.975  -7.163 -21.071
    4    HB3  GLU  28           HB3      GLU  28 -26.582  -8.807 -21.264
    5    HG2  GLU  28           HG2      GLU  28 -25.429  -8.075 -23.245
    6    HG3  GLU  28           HG3      GLU  28 -27.140  -8.337 -23.576

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LYS  29           H        LYS  29 -28.596  -9.490 -20.008
    2    HA   LYS  29           HA       LYS  29 -29.971 -10.915 -21.997
    3    HB2  LYS  29           HB2      LYS  29 -28.938 -11.934 -20.001
    4    HB3  LYS  29           HB3      LYS  29 -30.173 -11.180 -18.995
    5    HG2  LYS  29           HG2      LYS  29 -31.893 -12.492 -20.043
    6    HG3  LYS  29           HG3      LYS  29 -30.730 -13.173 -21.179
    7    HD2  LYS  29           HD2      LYS  29 -29.613 -14.377 -19.455
    8    HD3  LYS  29           HD3      LYS  29 -30.476 -13.501 -18.192
    9    HE2  LYS  29           HE2      LYS  29 -31.316 -15.822 -18.542
   10    HE3  LYS  29           HE3      LYS  29 -32.552 -14.584 -18.775
   11    HZ1  LYS  29           HZ1      LYS  29 -32.017 -14.743 -21.208
   12    HZ3  LYS  29           HZ2      LYS  29 -32.780 -16.102 -20.533
   13    HZ2  LYS  29           HZ3      LYS  29 -31.114 -16.134 -20.848

  No H/Q in entry =          13
  In of MODEL   31
    1    H    TYR  30           H        TYR  30 -31.262  -8.758 -19.482
    2    HA   TYR  30           HA       TYR  30 -33.951  -9.112 -20.696
    3    HB2  TYR  30           HB2      TYR  30 -33.230  -7.979 -17.984
    4    HB3  TYR  30           HB3      TYR  30 -34.861  -8.180 -18.620
    5    HD1  TYR  30           HD1      TYR  30 -35.856 -10.438 -18.821
    6    HD2  TYR  30           HD2      TYR  30 -31.981  -9.852 -17.156
    7    HE1  TYR  30           HE1      TYR  30 -35.843 -12.766 -18.021
    8    HE2  TYR  30           HE2      TYR  30 -31.967 -12.166 -16.361
    9    HH   TYR  30           HH       TYR  30 -33.702 -14.468 -17.433

  No H/Q in entry =           9
  In of MODEL   31
    1    H    GLU  31           H        GLU  31 -31.723  -7.202 -21.521
    2    HA   GLU  31           HA       GLU  31 -31.580  -5.049 -22.348
    3    HB2  GLU  31           HB2      GLU  31 -34.504  -5.661 -22.830
    4    HB3  GLU  31           HB3      GLU  31 -33.622  -4.325 -23.570
    5    HG2  GLU  31           HG2      GLU  31 -32.214  -5.816 -24.775
    6    HG3  GLU  31           HG3      GLU  31 -32.820  -7.208 -23.878

  No H/Q in entry =           6
  In of MODEL   31
    1    H    VAL  32           H        VAL  32 -31.748  -4.937 -19.614
    2    HA   VAL  32           HA       VAL  32 -33.527  -2.759 -18.940
    3    HB   VAL  32           HB       VAL  32 -31.156  -3.835 -17.381
    4   HG12  VAL  32          HG11      VAL  32 -32.642  -2.955 -15.472
    5   HG11  VAL  32          HG12      VAL  32 -33.455  -2.023 -16.729
    6   HG13  VAL  32          HG13      VAL  32 -31.736  -1.780 -16.426
    7   HG21  VAL  32          HG21      VAL  32 -32.990  -5.492 -18.050
    8   HG23  VAL  32          HG22      VAL  32 -33.989  -4.627 -16.881
    9   HG22  VAL  32          HG23      VAL  32 -32.493  -5.403 -16.360

  No H/Q in entry =           9
  In of MODEL   31
    1    HA   PRO  33           HA       PRO  33 -30.412   0.059 -20.648
    2    HB2  PRO  33           HB2      PRO  33 -31.844   2.334 -20.512
    3    HB3  PRO  33           HB3      PRO  33 -32.368   1.047 -21.599
    4    HG2  PRO  33           HG2      PRO  33 -33.289   1.601 -18.778
    5    HG3  PRO  33           HG3      PRO  33 -34.275   1.424 -20.229
    6    HD2  PRO  33           HD2      PRO  33 -33.875  -0.662 -18.566
    7    HD3  PRO  33           HD3      PRO  33 -33.963  -0.902 -20.311

  No H/Q in entry =           7
  In of MODEL   31
    1    H    VAL  34           H        VAL  34 -29.148  -0.526 -18.711
    2    HA   VAL  34           HA       VAL  34 -28.765   1.890 -17.069
    3    HB   VAL  34           HB       VAL  34 -28.214   0.411 -15.136
    4   HG12  VAL  34          HG11      VAL  34 -30.652  -0.379 -14.803
    5   HG11  VAL  34          HG12      VAL  34 -30.957   0.391 -16.359
    6   HG13  VAL  34          HG13      VAL  34 -30.358   1.349 -15.005
    7   HG21  VAL  34          HG21      VAL  34 -28.489  -1.610 -17.139
    8   HG23  VAL  34          HG22      VAL  34 -29.544  -1.934 -15.763
    9   HG22  VAL  34          HG23      VAL  34 -27.814  -1.705 -15.513

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ILE  35           H        ILE  35 -26.766   2.258 -16.250
    2    HA   ILE  35           HA       ILE  35 -24.521   0.850 -17.535
    3    HB   ILE  35           HB       ILE  35 -24.814   3.753 -16.723
    4   HG12  ILE  35          HG12      ILE  35 -23.903   2.411 -19.276
    5   HG13  ILE  35          HG13      ILE  35 -25.508   3.086 -19.001
    6   HG21  ILE  35          HG21      ILE  35 -22.309   2.133 -17.057
    7   HG23  ILE  35          HG22      ILE  35 -22.710   3.328 -15.824
    8   HG22  ILE  35          HG23      ILE  35 -22.327   3.848 -17.465
    9   HD11  ILE  35          HD11      ILE  35 -24.027   5.232 -18.417
   10   HD13  ILE  35          HD12      ILE  35 -24.594   4.866 -20.047
   11   HD12  ILE  35          HD13      ILE  35 -22.950   4.441 -19.568

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ILE  36           H        ILE  36 -23.310  -0.214 -15.947
    2    HA   ILE  36           HA       ILE  36 -23.699   0.418 -13.073
    3    HB   ILE  36           HB       ILE  36 -22.975  -2.312 -14.186
    4   HG12  ILE  36          HG12      ILE  36 -25.746  -1.411 -13.395
    5   HG13  ILE  36          HG13      ILE  36 -25.191  -1.411 -15.069
    6   HG23  ILE  36          HG21      ILE  36 -23.333  -3.126 -12.069
    7   HG22  ILE  36          HG22      ILE  36 -24.411  -1.806 -11.619
    8   HG21  ILE  36          HG23      ILE  36 -22.671  -1.532 -11.707
    9   HD13  ILE  36          HD11      ILE  36 -25.433  -3.618 -15.270
   10   HD12  ILE  36          HD12      ILE  36 -26.479  -3.459 -13.860
   11   HD11  ILE  36          HD13      ILE  36 -24.794  -3.937 -13.658

  No H/Q in entry =          11
  In of MODEL   31
    1    H    GLU  37           H        GLU  37 -21.887   0.988 -11.987
    2    HA   GLU  37           HA       GLU  37 -19.234   0.101 -12.930
    3    HB2  GLU  37           HB2      GLU  37 -20.033   2.920 -12.226
    4    HB3  GLU  37           HB3      GLU  37 -18.363   2.372 -12.369
    5    HG2  GLU  37           HG2      GLU  37 -18.680   1.931 -14.721
    6    HG3  GLU  37           HG3      GLU  37 -20.377   2.393 -14.597

  No H/Q in entry =           6
  In of MODEL   31
    1    H    ALA  38           H        ALA  38 -17.739  -0.185 -11.263
    2    HA   ALA  38           HA       ALA  38 -18.735   0.030  -8.482
    3    HB1  ALA  38           HB1      ALA  38 -17.101  -1.966  -9.922
    4    HB3  ALA  38           HB2      ALA  38 -18.143  -2.166  -8.514
    5    HB2  ALA  38           HB3      ALA  38 -16.507  -1.536  -8.318

  No H/Q in entry =           5
  In of MODEL   31
    1    H    PHE  39           H        PHE  39 -17.440   1.199  -7.022
    2    HA   PHE  39           HA       PHE  39 -14.886   2.318  -7.946
    3    HB2  PHE  39           HB2      PHE  39 -17.239   3.884  -6.907
    4    HB3  PHE  39           HB3      PHE  39 -15.590   4.500  -6.836
    5    HD1  PHE  39           HD1      PHE  39 -14.295   4.459  -9.106
    6    HD2  PHE  39           HD2      PHE  39 -18.541   4.389  -8.720
    7    HE1  PHE  39           HE1      PHE  39 -14.508   5.338 -11.414
    8    HE2  PHE  39           HE2      PHE  39 -18.769   5.259 -11.020
    9    HZ   PHE  39           HZ       PHE  39 -16.759   5.707 -12.385

  No H/Q in entry =           9
  In of MODEL   31
    1    HA   PRO  40           HA       PRO  40 -13.929   1.538  -3.668
    2    HB2  PRO  40           HB2      PRO  40 -12.092   3.495  -3.082
    3    HB3  PRO  40           HB3      PRO  40 -11.701   2.150  -4.156
    4    HG2  PRO  40           HG2      PRO  40 -12.647   4.917  -4.890
    5    HG3  PRO  40           HG3      PRO  40 -11.255   4.032  -5.512
    6    HD2  PRO  40           HD2      PRO  40 -13.493   4.008  -6.900
    7    HD3  PRO  40           HD3      PRO  40 -12.582   2.512  -6.713

  No H/Q in entry =           7
  In of MODEL   31
    1    H    GLU  41           H        GLU  41 -14.497   2.536  -1.534
    2    HA   GLU  41           HA       GLU  41 -16.687   4.309  -1.496
    3    HB2  GLU  41           HB2      GLU  41 -16.651   4.086   0.815
    4    HB3  GLU  41           HB3      GLU  41 -15.885   2.591   0.273
    5    HG2  GLU  41           HG2      GLU  41 -14.512   5.032   1.395
    6    HG3  GLU  41           HG3      GLU  41 -14.710   3.468   2.186

  No H/Q in entry =           6
  In of MODEL   31
    1    H    THR  42           H        THR  42 -13.329   5.122  -1.583
    2    HA   THR  42           HA       THR  42 -13.590   7.693  -0.371
    3    HB   THR  42           HB       THR  42 -11.427   8.199  -1.471
    4    HG1  THR  42           HG1      THR  42 -10.594   6.171  -2.602
    5   HG21  THR  42          HG21      THR  42 -11.775   6.588   0.592
    6   HG23  THR  42          HG22      THR  42 -10.180   6.760  -0.146
    7   HG22  THR  42          HG23      THR  42 -11.187   5.366  -0.536

  No H/Q in entry =           7
  In of MODEL   31
    1    H    LEU  43           H        LEU  43 -14.560   6.625  -3.460
    2    HA   LEU  43           HA       LEU  43 -14.737   9.403  -4.431
    3    HB2  LEU  43           HB2      LEU  43 -15.207   6.770  -5.821
    4    HB3  LEU  43           HB3      LEU  43 -15.356   8.358  -6.575
    5    HG   LEU  43           HG       LEU  43 -12.789   7.142  -5.582
    6   HD13  LEU  43          HD11      LEU  43 -12.308   6.517  -7.744
    7   HD12  LEU  43          HD12      LEU  43 -13.420   7.691  -8.445
    8   HD11  LEU  43          HD13      LEU  43 -14.045   6.221  -7.702
    9   HD21  LEU  43          HD21      LEU  43 -13.528   9.758  -6.860
   10   HD23  LEU  43          HD22      LEU  43 -11.918   9.070  -7.082
   11   HD22  LEU  43          HD23      LEU  43 -12.497   9.455  -5.463

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ALA  44           H        ALA  44 -16.719   7.640  -2.556
    2    HA   ALA  44           HA       ALA  44 -19.214   7.575  -3.852
    3    HB2  ALA  44           HB1      ALA  44 -19.088   6.457  -1.755
    4    HB3  ALA  44           HB2      ALA  44 -20.150   7.836  -1.474
    5    HB1  ALA  44           HB3      ALA  44 -18.471   7.893  -0.938

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLY  45           H        GLY  45 -17.692  10.332  -2.338
    2    HA3  GLY  45           HA2      GLY  45 -20.086  11.906  -2.676
    3    HA2  GLY  45           HA3      GLY  45 -18.516  12.483  -2.116

  No H/Q in entry =           3
  In of MODEL   31
    1    H    GLU  46           H        GLU  46 -17.039  11.497  -4.420
    2    HA   GLU  46           HA       GLU  46 -17.626  13.730  -6.186
    3    HB2  GLU  46           HB2      GLU  46 -15.359  12.126  -5.519
    4    HB3  GLU  46           HB3      GLU  46 -15.629  12.013  -7.258
    5    HG2  GLU  46           HG2      GLU  46 -15.384  14.602  -5.744
    6    HG3  GLU  46           HG3      GLU  46 -14.046  13.803  -6.572

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LYS  47           H        LYS  47 -17.620  10.208  -6.618
    2    HA   LYS  47           HA       LYS  47 -18.738  10.458  -9.282
    3    HB2  LYS  47           HB2      LYS  47 -18.236   8.049  -7.527
    4    HB3  LYS  47           HB3      LYS  47 -18.810   7.980  -9.193
    5    HG2  LYS  47           HG2      LYS  47 -16.220   9.286  -8.450
    6    HG3  LYS  47           HG3      LYS  47 -16.343   7.562  -8.797
    7    HD2  LYS  47           HD2      LYS  47 -17.315   8.083 -10.990
    8    HD3  LYS  47           HD3      LYS  47 -17.151   9.804 -10.644
    9    HE2  LYS  47           HE2      LYS  47 -14.728   9.536 -10.469
   10    HE3  LYS  47           HE3      LYS  47 -14.893   7.815 -10.810
   11    HZ2  LYS  47           HZ1      LYS  47 -14.463   9.677 -12.662
   12    HZ1  LYS  47           HZ2      LYS  47 -16.157   9.579 -12.716
   13    HZ3  LYS  47           HZ3      LYS  47 -15.217   8.188 -12.972

  No H/Q in entry =          13
  In of MODEL   31
    1    H    GLY  48           H        GLY  48 -20.051   9.746  -6.119
    2    HA3  GLY  48           HA2      GLY  48 -22.479   8.634  -6.834
    3    HA2  GLY  48           HA3      GLY  48 -22.208   9.623  -5.397

  No H/Q in entry =           3
  In of MODEL   31
    1    H    GLN  49           H        GLN  49 -21.567  12.024  -6.978
    2    HA   GLN  49           HA       GLN  49 -24.092  13.214  -7.098
    3    HB2  GLN  49           HB2      GLN  49 -21.537  13.998  -8.486
    4    HB3  GLN  49           HB3      GLN  49 -22.968  15.008  -8.388
    5    HG2  GLN  49           HG2      GLN  49 -22.782  15.030  -5.953
    6    HG3  GLN  49           HG3      GLN  49 -21.366  13.999  -6.049
    7   HE21  GLN  49          HE21      GLN  49 -21.166  16.224  -4.782
    8   HE22  GLN  49          HE22      GLN  49 -20.212  17.450  -5.440

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ASN  50           H        ASN  50 -22.497  11.281  -9.499
    2    HA   ASN  50           HA       ASN  50 -24.374  12.208 -11.564
    3    HB2  ASN  50           HB2      ASN  50 -21.846  10.588 -11.821
    4    HB3  ASN  50           HB3      ASN  50 -22.896  11.044 -13.155
    5   HD21  ASN  50          HD21      ASN  50 -20.218  11.810 -11.573
    6   HD22  ASN  50          HD22      ASN  50 -19.937  13.437 -11.920

  No H/Q in entry =           6
  In of MODEL   31
    1    H    ALA  51           H        ALA  51 -24.409   9.855  -9.314
    2    HA   ALA  51           HA       ALA  51 -25.279   7.733 -11.129
    3    HB2  ALA  51           HB1      ALA  51 -24.721   6.369  -9.446
    4    HB3  ALA  51           HB2      ALA  51 -25.805   7.212  -8.343
    5    HB1  ALA  51           HB3      ALA  51 -24.150   7.782  -8.559

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ASP  52           H        ASP  52 -27.315   6.742 -10.967
    2    HA   ASP  52           HA       ASP  52 -29.431   8.644 -10.281
    3    HB2  ASP  52           HB2      ASP  52 -29.337   6.132 -11.949
    4    HB3  ASP  52           HB3      ASP  52 -30.853   6.914 -11.500

  No H/Q in entry =           4
  In of MODEL   31
    1    H    VAL  53           H        VAL  53 -27.912   5.706  -9.277
    2    HA   VAL  53           HA       VAL  53 -29.320   5.883  -6.747
    3    HB   VAL  53           HB       VAL  53 -30.785   4.285  -7.973
    4   HG11  VAL  53          HG11      VAL  53 -29.082   3.367  -9.512
    5   HG13  VAL  53          HG12      VAL  53 -29.947   2.101  -8.642
    6   HG12  VAL  53          HG13      VAL  53 -28.316   2.553  -8.149
    7   HG23  VAL  53          HG21      VAL  53 -30.008   2.285  -6.286
    8   HG22  VAL  53          HG22      VAL  53 -31.091   3.625  -5.910
    9   HG21  VAL  53          HG23      VAL  53 -29.376   3.743  -5.521

  No H/Q in entry =           9
  In of MODEL   31
    1    H    VAL  54           H        VAL  54 -28.005   5.410  -5.104
    2    HA   VAL  54           HA       VAL  54 -25.280   4.471  -5.743
    3    HB   VAL  54           HB       VAL  54 -26.269   6.286  -3.485
    4   HG11  VAL  54          HG11      VAL  54 -23.741   4.783  -3.801
    5   HG13  VAL  54          HG12      VAL  54 -24.456   5.489  -2.353
    6   HG12  VAL  54          HG13      VAL  54 -23.528   6.500  -3.459
    7   HG22  VAL  54          HG21      VAL  54 -25.363   8.070  -4.597
    8   HG21  VAL  54          HG22      VAL  54 -25.956   7.096  -5.942
    9   HG23  VAL  54          HG23      VAL  54 -24.245   7.066  -5.521

  No H/Q in entry =           9
  In of MODEL   31
    1    H    LEU  55           H        LEU  55 -24.745   2.532  -5.103
    2    HA   LEU  55           HA       LEU  55 -26.272   1.273  -2.911
    3    HB2  LEU  55           HB2      LEU  55 -24.778   0.052  -5.220
    4    HB3  LEU  55           HB3      LEU  55 -25.555  -0.855  -3.922
    5    HG   LEU  55           HG       LEU  55 -26.962   0.776  -6.027
    6   HD13  LEU  55          HD11      LEU  55 -26.736  -1.087  -7.246
    7   HD12  LEU  55          HD12      LEU  55 -27.708  -1.928  -6.040
    8   HD11  LEU  55          HD13      LEU  55 -25.950  -1.921  -5.908
    9   HD23  LEU  55          HD21      LEU  55 -28.300  -1.123  -4.155
   10   HD22  LEU  55          HD22      LEU  55 -28.958   0.279  -4.998
   11   HD21  LEU  55          HD23      LEU  55 -27.916   0.504  -3.594

  No H/Q in entry =          11
  In of MODEL   31
    1    H    LEU  56           H        LEU  56 -25.122   0.645  -1.116
    2    HA   LEU  56           HA       LEU  56 -22.176   0.943  -1.198
    3    HB2  LEU  56           HB2      LEU  56 -23.959   0.795   1.221
    4    HB3  LEU  56           HB3      LEU  56 -22.238   1.167   1.190
    5    HG   LEU  56           HG       LEU  56 -24.490   2.920   0.248
    6   HD11  LEU  56          HD11      LEU  56 -23.361   2.505   2.758
    7   HD13  LEU  56          HD12      LEU  56 -24.312   3.904   2.260
    8   HD12  LEU  56          HD13      LEU  56 -22.553   3.952   2.153
    9   HD23  LEU  56          HD21      LEU  56 -22.492   4.553   0.031
   10   HD22  LEU  56          HD22      LEU  56 -22.925   3.467  -1.290
   11   HD21  LEU  56          HD23      LEU  56 -21.572   3.071  -0.230

  No H/Q in entry =          11
  In of MODEL   31
    1    H    GLY  57           H        GLY  57 -20.845  -0.732  -0.676
    2    HA3  GLY  57           HA2      GLY  57 -21.857  -3.386  -0.857
    3    HA2  GLY  57           HA3      GLY  57 -20.215  -2.945  -0.396

  No H/Q in entry =           3
  In of MODEL   31
    1    HA   PRO  58           HA       PRO  58 -23.018  -3.885   3.345
    2    HB2  PRO  58           HB2      PRO  58 -22.413  -6.510   3.948
    3    HB3  PRO  58           HB3      PRO  58 -23.795  -6.057   2.948
    4    HG2  PRO  58           HG2      PRO  58 -21.106  -7.029   2.135
    5    HG3  PRO  58           HG3      PRO  58 -22.692  -7.438   1.481
    6    HD2  PRO  58           HD2      PRO  58 -21.036  -5.677   0.239
    7    HD3  PRO  58           HD3      PRO  58 -22.793  -5.532   0.155

  No H/Q in entry =           7
  In of MODEL   31
    1    H    GLN  59           H        GLN  59 -19.671  -4.470   2.703
    2    HA   GLN  59           HA       GLN  59 -18.889  -4.510   5.455
    3    HB2  GLN  59           HB2      GLN  59 -17.123  -3.469   3.264
    4    HB3  GLN  59           HB3      GLN  59 -16.675  -4.321   4.727
    5    HG2  GLN  59           HG2      GLN  59 -16.362  -5.956   3.161
    6    HG3  GLN  59           HG3      GLN  59 -18.021  -6.284   3.634
    7   HE21  GLN  59          HE21      GLN  59 -18.701  -6.959   1.904
    8   HE22  GLN  59          HE22      GLN  59 -18.993  -6.460   0.344

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ILE  60           H        ILE  60 -19.760  -1.932   3.253
    2    HA   ILE  60           HA       ILE  60 -18.821  -0.001   5.286
    3    HB   ILE  60           HB       ILE  60 -19.008   1.733   3.463
    4   HG12  ILE  60          HG12      ILE  60 -18.912  -0.478   1.461
    5   HG13  ILE  60          HG13      ILE  60 -20.477   0.079   2.051
    6   HG22  ILE  60          HG21      ILE  60 -17.081  -0.336   2.558
    7   HG21  ILE  60          HG22      ILE  60 -16.928   0.367   4.167
    8   HG23  ILE  60          HG23      ILE  60 -16.871   1.404   2.744
    9   HD12  ILE  60          HD11      ILE  60 -18.433   1.565   0.431
   10   HD11  ILE  60          HD12      ILE  60 -19.599   2.447   1.416
   11   HD13  ILE  60          HD13      ILE  60 -20.160   1.372   0.135

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ALA  61           H        ALA  61 -21.326  -1.503   5.384
    2    HA   ALA  61           HA       ALA  61 -23.501   0.234   4.945
    3    HB1  ALA  61           HB1      ALA  61 -24.751  -1.211   6.286
    4    HB2  ALA  61           HB2      ALA  61 -23.357  -1.646   7.274
    5    HB3  ALA  61           HB3      ALA  61 -23.490  -2.251   5.623

  No H/Q in entry =           5
  In of MODEL   31
    1    H    TYR  62           H        TYR  62 -21.269   0.053   7.720
    2    HA   TYR  62           HA       TYR  62 -22.750   1.764   9.404
    3    HB2  TYR  62           HB2      TYR  62 -20.621   2.182  10.560
    4    HB3  TYR  62           HB3      TYR  62 -20.855   0.465  10.234
    5    HD1  TYR  62           HD1      TYR  62 -19.371  -0.738   8.724
    6    HD2  TYR  62           HD2      TYR  62 -18.863   3.457   9.355
    7    HE1  TYR  62           HE1      TYR  62 -17.189  -0.836   7.582
    8    HE2  TYR  62           HE2      TYR  62 -16.667   3.354   8.215
    9    HH   TYR  62           HH       TYR  62 -15.683   0.566   6.469

  No H/Q in entry =           9
  In of MODEL   31
    1    H    MET  63           H        MET  63 -21.109   2.562   6.529
    2    HA   MET  63           HA       MET  63 -20.839   5.388   7.215
    3    HB2  MET  63           HB2      MET  63 -20.312   3.843   4.677
    4    HB3  MET  63           HB3      MET  63 -20.056   5.580   4.854
    5    HG2  MET  63           HG2      MET  63 -18.349   5.163   6.532
    6    HG3  MET  63           HG3      MET  63 -18.609   3.427   6.372
    7    HE2  MET  63           HE1      MET  63 -16.160   2.693   5.394
    8    HE1  MET  63           HE2      MET  63 -15.916   4.273   6.139
    9    HE3  MET  63           HE3      MET  63 -15.223   3.930   4.552

  No H/Q in entry =           9
  In of MODEL   31
    1    H    LEU  64           H        LEU  64 -23.474   3.621   6.282
    2    HA   LEU  64           HA       LEU  64 -24.658   5.077   4.213
    3    HB2  LEU  64           HB2      LEU  64 -25.588   3.003   5.145
    4    HB3  LEU  64           HB3      LEU  64 -26.000   3.864   6.628
    5    HG   LEU  64           HG       LEU  64 -27.664   5.174   5.415
    6   HD13  LEU  64          HD11      LEU  64 -27.397   5.402   3.179
    7   HD12  LEU  64          HD12      LEU  64 -28.100   3.789   3.044
    8   HD11  LEU  64          HD13      LEU  64 -26.348   3.988   3.083
    9   HD23  LEU  64          HD21      LEU  64 -28.287   2.380   4.679
   10   HD22  LEU  64          HD22      LEU  64 -29.225   3.549   5.608
   11   HD21  LEU  64          HD23      LEU  64 -27.870   2.709   6.361

  No H/Q in entry =          11
  In of MODEL   31
    1    HA   PRO  65           HA       PRO  65 -26.698   8.309   6.982
    2    HB2  PRO  65           HB2      PRO  65 -24.667   8.401   9.215
    3    HB3  PRO  65           HB3      PRO  65 -26.396   8.742   9.279
    4    HG2  PRO  65           HG2      PRO  65 -25.535   6.458  10.199
    5    HG3  PRO  65           HG3      PRO  65 -26.966   6.473   9.170
    6    HD2  PRO  65           HD2      PRO  65 -24.125   5.758   8.437
    7    HD3  PRO  65           HD3      PRO  65 -25.618   4.923   8.007

  No H/Q in entry =           7
  In of MODEL   31
    1    H    GLU  66           H        GLU  66 -23.144   8.129   7.017
    2    HA   GLU  66           HA       GLU  66 -22.753  10.914   6.604
    3    HB2  GLU  66           HB2      GLU  66 -21.030   8.542   5.937
    4    HB3  GLU  66           HB3      GLU  66 -20.523  10.218   5.721
    5    HG2  GLU  66           HG2      GLU  66 -20.696  10.599   8.090
    6    HG3  GLU  66           HG3      GLU  66 -21.277   8.951   8.331

  No H/Q in entry =           6
  In of MODEL   31
    1    H    ILE  67           H        ILE  67 -22.977   8.170   4.357
    2    HA   ILE  67           HA       ILE  67 -22.526   9.859   2.057
    3    HB   ILE  67           HB       ILE  67 -23.526   6.987   2.252
    4   HG12  ILE  67          HG12      ILE  67 -20.866   8.060   1.299
    5   HG13  ILE  67          HG13      ILE  67 -21.157   7.653   2.989
    6   HG21  ILE  67          HG21      ILE  67 -23.426   8.858   0.023
    7   HG23  ILE  67          HG22      ILE  67 -24.109   7.234   0.084
    8   HG22  ILE  67          HG23      ILE  67 -22.395   7.457  -0.264
    9   HD12  ILE  67          HD11      ILE  67 -20.827   5.864   0.638
   10   HD11  ILE  67          HD12      ILE  67 -21.847   5.330   1.973
   11   HD13  ILE  67          HD13      ILE  67 -20.155   5.735   2.264

  No H/Q in entry =          11
  In of MODEL   31
    1    H    GLN  68           H        GLN  68 -25.414   8.913   3.724
    2    HA   GLN  68           HA       GLN  68 -27.229   9.907   1.769
    3    HB2  GLN  68           HB2      GLN  68 -27.465   9.563   4.755
    4    HB3  GLN  68           HB3      GLN  68 -28.773  10.205   3.775
    5    HG2  GLN  68           HG2      GLN  68 -28.890   8.176   2.504
    6    HG3  GLN  68           HG3      GLN  68 -27.453   7.547   3.290
    7   HE21  GLN  68          HE21      GLN  68 -29.683   6.270   3.182
    8   HE22  GLN  68          HE22      GLN  68 -30.512   5.848   4.607

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ARG  69           H        ARG  69 -25.532  11.517   4.485
    2    HA   ARG  69           HA       ARG  69 -26.806  14.048   4.090
    3    HB2  ARG  69           HB2      ARG  69 -24.481  13.032   5.653
    4    HB3  ARG  69           HB3      ARG  69 -24.499  14.753   5.292
    5    HG2  ARG  69           HG2      ARG  69 -26.801  14.885   6.290
    6    HG3  ARG  69           HG3      ARG  69 -26.652  13.189   6.765
    7    HD2  ARG  69           HD2      ARG  69 -24.861  15.479   7.655
    8    HD3  ARG  69           HD3      ARG  69 -26.013  14.618   8.664
    9    HE   ARG  69           HE       ARG  69 -23.448  13.587   7.687
   10   HH21  ARG  69          HH11      ARG  69 -22.695  11.796   8.877
   11   HH22  ARG  69          HH12      ARG  69 -23.741  11.021  10.018
   12   HH11  ARG  69          HH21      ARG  69 -26.405  13.155   9.419
   13   HH12  ARG  69          HH22      ARG  69 -25.841  11.788  10.323

  No H/Q in entry =          13
  In of MODEL   31
    1    H    LEU  70           H        LEU  70 -24.007  12.531   2.700
    2    HA   LEU  70           HA       LEU  70 -22.817  14.850   1.516
    3    HB2  LEU  70           HB2      LEU  70 -21.906  12.497   2.103
    4    HB3  LEU  70           HB3      LEU  70 -22.556  12.053   0.526
    5    HG   LEU  70           HG       LEU  70 -20.924  13.361  -0.581
    6   HD11  LEU  70          HD11      LEU  70 -20.038  14.176   2.197
    7   HD13  LEU  70          HD12      LEU  70 -20.707  15.235   0.954
    8   HD12  LEU  70          HD13      LEU  70 -19.125  14.492   0.718
    9   HD22  LEU  70          HD21      LEU  70 -19.555  11.591  -0.361
   10   HD21  LEU  70          HD22      LEU  70 -20.485  11.107   1.058
   11   HD23  LEU  70          HD23      LEU  70 -19.057  12.125   1.244

  No H/Q in entry =          11
  In of MODEL   31
    1    H    LEU  71           H        LEU  71 -25.080  12.391   0.429
    2    HA   LEU  71           HA       LEU  71 -25.575  13.896  -2.084
    3    HB2  LEU  71           HB2      LEU  71 -25.894  10.922  -1.631
    4    HB3  LEU  71           HB3      LEU  71 -26.005  11.785  -3.164
    5    HG   LEU  71           HG       LEU  71 -23.468  11.700  -1.532
    6   HD12  LEU  71          HD11      LEU  71 -23.613  10.072  -3.960
    7   HD11  LEU  71          HD12      LEU  71 -24.633   9.491  -2.645
    8   HD13  LEU  71          HD13      LEU  71 -22.900   9.703  -2.390
    9   HD22  LEU  71          HD21      LEU  71 -23.515  13.517  -3.027
   10   HD21  LEU  71          HD22      LEU  71 -24.069  12.493  -4.351
   11   HD23  LEU  71          HD23      LEU  71 -22.448  12.283  -3.692

  No H/Q in entry =          11
  In of MODEL   31
    1    HA   PRO  72           HA       PRO  72 -29.426  13.605   0.582
    2    HB2  PRO  72           HB2      PRO  72 -30.179  16.199   0.506
    3    HB3  PRO  72           HB3      PRO  72 -28.878  15.696   1.583
    4    HG2  PRO  72           HG2      PRO  72 -28.674  16.878  -1.174
    5    HG3  PRO  72           HG3      PRO  72 -27.869  17.399   0.305
    6    HD2  PRO  72           HD2      PRO  72 -26.617  15.786  -1.474
    7    HD3  PRO  72           HD3      PRO  72 -26.349  15.611   0.260

  No H/Q in entry =           7
  In of MODEL   31
    1    H    ASN  73           H        ASN  73 -28.801  14.530  -2.641
    2    HA   ASN  73           HA       ASN  73 -31.678  14.339  -3.240
    3    HB2  ASN  73           HB2      ASN  73 -31.192  15.423  -5.344
    4    HB3  ASN  73           HB3      ASN  73 -30.613  16.382  -3.991
    5   HD21  ASN  73          HD21      ASN  73 -29.847  16.391  -6.678
    6   HD22  ASN  73          HD22      ASN  73 -28.190  16.160  -6.888

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LYS  74           H        LYS  74 -29.788  12.004  -2.834
    2    HA   LYS  74           HA       LYS  74 -30.443  10.630  -5.373
    3    HB2  LYS  74           HB2      LYS  74 -27.907  10.235  -3.781
    4    HB3  LYS  74           HB3      LYS  74 -28.342   9.436  -5.292
    5    HG2  LYS  74           HG2      LYS  74 -27.950  12.393  -5.099
    6    HG3  LYS  74           HG3      LYS  74 -26.626  11.273  -5.417
    7    HD2  LYS  74           HD2      LYS  74 -27.803  10.390  -7.345
    8    HD3  LYS  74           HD3      LYS  74 -29.175  11.448  -7.011
    9    HE2  LYS  74           HE2      LYS  74 -27.871  13.400  -7.471
   10    HE3  LYS  74           HE3      LYS  74 -26.390  12.446  -7.577
   11    HZ2  LYS  74           HZ1      LYS  74 -27.859  13.108  -9.688
   12    HZ1  LYS  74           HZ2      LYS  74 -28.573  11.615  -9.305
   13    HZ3  LYS  74           HZ3      LYS  74 -26.907  11.704  -9.621

  No H/Q in entry =          13
  In of MODEL   31
    1    HA   PRO  75           HA       PRO  75 -31.930   7.712  -2.380
    2    HB2  PRO  75           HB2      PRO  75 -32.353   5.507  -3.955
    3    HB3  PRO  75           HB3      PRO  75 -33.420   6.908  -4.015
    4    HG2  PRO  75           HG2      PRO  75 -31.130   6.209  -5.811
    5    HG3  PRO  75           HG3      PRO  75 -32.763   6.716  -6.240
    6    HD2  PRO  75           HD2      PRO  75 -30.743   8.496  -6.223
    7    HD3  PRO  75           HD3      PRO  75 -32.351   8.966  -5.666

  No H/Q in entry =           7
  In of MODEL   31
    1    H    VAL  76           H        VAL  76 -30.507   6.597  -1.022
    2    HA   VAL  76           HA       VAL  76 -28.110   5.281  -2.155
    3    HB   VAL  76           HB       VAL  76 -28.304   6.762   0.503
    4   HG11  VAL  76          HG11      VAL  76 -26.022   5.372  -0.913
    5   HG13  VAL  76          HG12      VAL  76 -26.719   4.955   0.653
    6   HG12  VAL  76          HG13      VAL  76 -25.810   6.454   0.465
    7   HG22  VAL  76          HG21      VAL  76 -27.565   8.631  -0.396
    8   HG21  VAL  76          HG22      VAL  76 -28.155   7.957  -1.915
    9   HG23  VAL  76          HG23      VAL  76 -26.453   7.797  -1.481

  No H/Q in entry =           9
  In of MODEL   31
    1    H    GLU  77           H        GLU  77 -27.978   3.120  -1.540
    2    HA   GLU  77           HA       GLU  77 -28.768   2.372   1.123
    3    HB2  GLU  77           HB2      GLU  77 -30.451   0.794   0.614
    4    HB3  GLU  77           HB3      GLU  77 -30.942   2.338  -0.084
    5    HG2  GLU  77           HG2      GLU  77 -30.390   1.552  -2.277
    6    HG3  GLU  77           HG3      GLU  77 -29.806   0.030  -1.609

  No H/Q in entry =           6
  In of MODEL   31
    1    H    VAL  78           H        VAL  78 -28.523   0.274   1.784
    2    HA   VAL  78           HA       VAL  78 -25.904  -0.613   0.868
    3    HB   VAL  78           HB       VAL  78 -27.621  -1.419   3.254
    4   HG11  VAL  78          HG11      VAL  78 -25.349  -2.748   2.106
    5   HG13  VAL  78          HG12      VAL  78 -26.260  -3.178   3.555
    6   HG12  VAL  78          HG13      VAL  78 -24.891  -2.074   3.668
    7   HG22  VAL  78          HG21      VAL  78 -26.090  -0.118   4.573
    8   HG21  VAL  78          HG22      VAL  78 -26.798   0.880   3.303
    9   HG23  VAL  78          HG23      VAL  78 -25.147   0.281   3.137

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ILE  79           H        ILE  79 -25.458  -2.544  -0.039
    2    HA   ILE  79           HA       ILE  79 -27.596  -3.935  -1.361
    3    HB   ILE  79           HB       ILE  79 -24.627  -4.588  -1.172
    4   HG12  ILE  79          HG12      ILE  79 -26.241  -3.419  -3.445
    5   HG13  ILE  79          HG13      ILE  79 -25.311  -2.445  -2.304
    6   HG22  ILE  79          HG21      ILE  79 -25.805  -5.724  -3.476
    7   HG21  ILE  79          HG22      ILE  79 -26.795  -6.200  -2.097
    8   HG23  ILE  79          HG23      ILE  79 -25.068  -6.553  -2.105
    9   HD13  ILE  79          HD11      ILE  79 -23.925  -2.622  -4.138
   10   HD12  ILE  79          HD12      ILE  79 -24.340  -4.315  -4.410
   11   HD11  ILE  79          HD13      ILE  79 -23.320  -3.867  -3.041

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ASP  80           H        ASP  80 -28.535  -5.818  -0.764
    2    HA   ASP  80           HA       ASP  80 -28.490  -6.715   1.884
    3    HB2  ASP  80           HB2      ASP  80 -30.286  -7.218   0.265
    4    HB3  ASP  80           HB3      ASP  80 -29.181  -8.276  -0.614

  No H/Q in entry =           4
  In of MODEL   31
    1    H    SER  81           H        SER  81 -26.992  -7.912   2.999
    2    HA   SER  81           HA       SER  81 -24.540  -8.703   1.782
    3    HB2  SER  81           HB2      SER  81 -24.006  -9.746   3.947
    4    HB3  SER  81           HB3      SER  81 -24.643  -8.117   4.166
    5    HG   SER  81           HG       SER  81 -26.017 -10.558   4.492

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU  82           H        LEU  82 -27.334 -10.676   2.139
    2    HA   LEU  82           HA       LEU  82 -25.895 -13.109   1.607
    3    HB2  LEU  82           HB2      LEU  82 -28.811 -12.498   1.191
    4    HB3  LEU  82           HB3      LEU  82 -28.072 -14.090   1.356
    5    HG   LEU  82           HG       LEU  82 -28.296 -12.030   3.531
    6   HD12  LEU  82          HD11      LEU  82 -29.719 -14.677   3.168
    7   HD11  LEU  82          HD12      LEU  82 -30.442 -13.104   2.824
    8   HD13  LEU  82          HD13      LEU  82 -29.964 -13.513   4.472
    9   HD22  LEU  82          HD21      LEU  82 -26.330 -13.314   3.869
   10   HD21  LEU  82          HD22      LEU  82 -27.122 -14.797   3.336
   11   HD23  LEU  82          HD23      LEU  82 -27.565 -14.068   4.880

  No H/Q in entry =          11
  In of MODEL   31
    1    H    LEU  83           H        LEU  83 -27.777 -10.806  -0.296
    2    HA   LEU  83           HA       LEU  83 -27.662 -12.176  -2.765
    3    HB2  LEU  83           HB2      LEU  83 -27.941  -9.253  -2.120
    4    HB3  LEU  83           HB3      LEU  83 -28.018  -9.899  -3.758
    5    HG   LEU  83           HG       LEU  83 -30.042 -10.194  -1.559
    6   HD13  LEU  83          HD11      LEU  83 -30.731  -8.318  -2.619
    7   HD12  LEU  83          HD12      LEU  83 -31.255  -9.414  -3.896
    8   HD11  LEU  83          HD13      LEU  83 -29.686  -8.615  -4.009
    9   HD23  LEU  83          HD21      LEU  83 -30.265 -11.451  -4.279
   10   HD22  LEU  83          HD22      LEU  83 -31.233 -11.756  -2.837
   11   HD21  LEU  83          HD23      LEU  83 -29.569 -12.331  -2.919

  No H/Q in entry =          11
  In of MODEL   31
    1    H    TYR  84           H        TYR  84 -25.589  -9.874  -1.117
    2    HA   TYR  84           HA       TYR  84 -23.732  -9.471  -3.270
    3    HB2  TYR  84           HB2      TYR  84 -24.174  -7.971  -1.226
    4    HB3  TYR  84           HB3      TYR  84 -23.159  -9.103  -0.335
    5    HD1  TYR  84           HD1      TYR  84 -20.806  -8.958  -0.429
    6    HD2  TYR  84           HD2      TYR  84 -23.166  -6.747  -3.217
    7    HE1  TYR  84           HE1      TYR  84 -18.772  -7.783  -1.200
    8    HE2  TYR  84           HE2      TYR  84 -21.142  -5.572  -4.004
    9    HH   TYR  84           HH       TYR  84 -18.267  -5.571  -2.290

  No H/Q in entry =           9
  In of MODEL   31
    1    H    GLY  85           H        GLY  85 -23.545 -11.474  -0.320
    2    HA3  GLY  85           HA2      GLY  85 -21.016 -12.529  -0.830
    3    HA2  GLY  85           HA3      GLY  85 -22.272 -13.320   0.124

  No H/Q in entry =           3
  In of MODEL   31
    1    H    LYS  86           H        LYS  86 -24.155 -13.618  -1.915
    2    HA   LYS  86           HA       LYS  86 -23.218 -16.038  -3.179
    3    HB2  LYS  86           HB2      LYS  86 -25.495 -15.517  -2.139
    4    HB3  LYS  86           HB3      LYS  86 -25.816 -14.576  -3.595
    5    HG2  LYS  86           HG2      LYS  86 -24.968 -17.298  -4.132
    6    HG3  LYS  86           HG3      LYS  86 -26.470 -17.176  -3.215
    7    HD2  LYS  86           HD2      LYS  86 -27.420 -15.686  -4.849
    8    HD3  LYS  86           HD3      LYS  86 -25.885 -15.573  -5.706
    9    HE2  LYS  86           HE2      LYS  86 -27.364 -17.072  -6.892
   10    HE3  LYS  86           HE3      LYS  86 -26.026 -17.991  -6.203
   11    HZ1  LYS  86           HZ1      LYS  86 -27.980 -17.907  -4.252
   12    HZ3  LYS  86           HZ2      LYS  86 -27.532 -19.246  -5.196
   13    HZ2  LYS  86           HZ3      LYS  86 -28.805 -18.241  -5.699

  No H/Q in entry =          13
  In of MODEL   31
    1    H    VAL  87           H        VAL  87 -23.080 -12.828  -4.082
    2    HA   VAL  87           HA       VAL  87 -22.753 -11.674  -6.030
    3    HB   VAL  87           HB       VAL  87 -21.825 -14.195  -7.415
    4   HG13  VAL  87          HG11      VAL  87 -20.469 -12.750  -8.630
    5   HG12  VAL  87          HG12      VAL  87 -20.368 -11.576  -7.317
    6   HG11  VAL  87          HG13      VAL  87 -21.837 -11.693  -8.284
    7   HG21  VAL  87          HG21      VAL  87 -20.343 -12.795  -5.200
    8   HG23  VAL  87          HG22      VAL  87 -19.605 -13.919  -6.338
    9   HG22  VAL  87          HG23      VAL  87 -20.865 -14.477  -5.239

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ASP  88           H        ASP  88 -25.290 -12.206  -5.647
    2    HA   ASP  88           HA       ASP  88 -26.490 -13.381  -8.028
    3    HB2  ASP  88           HB2      ASP  88 -27.467 -13.577  -5.693
    4    HB3  ASP  88           HB3      ASP  88 -27.849 -11.859  -5.791

  No H/Q in entry =           4
  In of MODEL   31
    1    H    GLY  89           H        GLY  89 -25.751 -12.158  -9.682
    2    HA3  GLY  89           HA2      GLY  89 -25.818  -9.381  -9.888
    3    HA2  GLY  89           HA3      GLY  89 -25.857 -10.505 -11.246

  No H/Q in entry =           3
  In of MODEL   31
    1    H    LEU  90           H        LEU  90 -28.353 -11.751 -10.765
    2    HA   LEU  90           HA       LEU  90 -30.094  -9.744 -11.863
    3    HB2  LEU  90           HB2      LEU  90 -30.267 -12.136 -12.435
    4    HB3  LEU  90           HB3      LEU  90 -30.768 -12.477 -10.779
    5    HG   LEU  90           HG       LEU  90 -32.842 -11.272 -11.121
    6   HD13  LEU  90          HD11      LEU  90 -32.607  -9.545 -12.604
    7   HD12  LEU  90          HD12      LEU  90 -33.211 -10.760 -13.730
    8   HD11  LEU  90          HD13      LEU  90 -31.481 -10.439 -13.628
    9   HD23  LEU  90          HD21      LEU  90 -32.870 -12.910 -13.552
   10   HD22  LEU  90          HD22      LEU  90 -33.838 -13.030 -12.083
   11   HD21  LEU  90          HD23      LEU  90 -32.212 -13.712 -12.125

  No H/Q in entry =          11
  In of MODEL   31
    1    H    GLY  91           H        GLY  91 -29.952 -11.242  -8.677
    2    HA3  GLY  91           HA2      GLY  91 -32.228 -10.029  -7.613
    3    HA2  GLY  91           HA3      GLY  91 -30.849 -10.618  -6.686

  No H/Q in entry =           3
  In of MODEL   31
    1    H    VAL  92           H        VAL  92 -28.866  -8.876  -7.571
    2    HA   VAL  92           HA       VAL  92 -29.542  -6.539  -6.020
    3    HB   VAL  92           HB       VAL  92 -27.037  -7.120  -7.644
    4   HG12  VAL  92          HG11      VAL  92 -27.094  -5.223  -5.322
    5   HG11  VAL  92          HG12      VAL  92 -27.754  -4.656  -6.857
    6   HG13  VAL  92          HG13      VAL  92 -26.078  -5.195  -6.763
    7   HG22  VAL  92          HG21      VAL  92 -26.861  -8.711  -6.048
    8   HG21  VAL  92          HG22      VAL  92 -27.959  -7.881  -4.945
    9   HG23  VAL  92          HG23      VAL  92 -26.283  -7.350  -5.088

  No H/Q in entry =           9
  In of MODEL   31
    1    H    LEU  93           H        LEU  93 -29.204  -7.227  -9.442
    2    HA   LEU  93           HA       LEU  93 -29.450  -4.582 -10.376
    3    HB2  LEU  93           HB2      LEU  93 -28.904  -6.466 -11.839
    4    HB3  LEU  93           HB3      LEU  93 -30.522  -7.126 -11.594
    5    HG   LEU  93           HG       LEU  93 -31.463  -5.125 -12.714
    6   HD11  LEU  93          HD11      LEU  93 -29.542  -3.607 -12.237
    7   HD13  LEU  93          HD12      LEU  93 -30.002  -3.623 -13.940
    8   HD12  LEU  93          HD13      LEU  93 -28.580  -4.516 -13.403
    9   HD23  LEU  93          HD21      LEU  93 -30.477  -5.741 -15.011
   10   HD22  LEU  93          HD22      LEU  93 -31.360  -6.960 -14.091
   11   HD21  LEU  93          HD23      LEU  93 -29.595  -6.978 -14.114

  No H/Q in entry =          11
  In of MODEL   31
    1    H    LYS  94           H        LYS  94 -31.919  -7.024  -9.489
    2    HA   LYS  94           HA       LYS  94 -34.208  -5.488 -10.091
    3    HB2  LYS  94           HB2      LYS  94 -33.762  -7.686  -8.079
    4    HB3  LYS  94           HB3      LYS  94 -35.331  -6.925  -8.329
    5    HG2  LYS  94           HG2      LYS  94 -35.306  -7.710 -10.661
    6    HG3  LYS  94           HG3      LYS  94 -33.774  -8.525 -10.350
    7    HD2  LYS  94           HD2      LYS  94 -34.927  -9.806  -8.507
    8    HD3  LYS  94           HD3      LYS  94 -36.448  -9.096  -9.047
    9    HE2  LYS  94           HE2      LYS  94 -36.000 -10.052 -11.316
   10    HE3  LYS  94           HE3      LYS  94 -34.611 -10.892 -10.628
   11    HZ3  LYS  94           HZ1      LYS  94 -36.525 -12.335 -10.770
   12    HZ2  LYS  94           HZ2      LYS  94 -37.443 -11.267  -9.820
   13    HZ1  LYS  94           HZ3      LYS  94 -36.107 -12.069  -9.146

  No H/Q in entry =          13
  In of MODEL   31
    1    H    ALA  95           H        ALA  95 -32.354  -5.676  -7.064
    2    HA   ALA  95           HA       ALA  95 -34.117  -4.016  -5.567
    3    HB2  ALA  95           HB1      ALA  95 -31.795  -5.488  -5.055
    4    HB3  ALA  95           HB2      ALA  95 -32.721  -4.540  -3.893
    5    HB1  ALA  95           HB3      ALA  95 -31.352  -3.812  -4.732

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA  96           H        ALA  96 -31.469  -3.280  -7.699
    2    HA   ALA  96           HA       ALA  96 -31.247  -0.523  -6.935
    3    HB2  ALA  96           HB1      ALA  96 -29.902  -0.359  -9.062
    4    HB3  ALA  96           HB2      ALA  96 -30.282  -2.053  -9.372
    5    HB1  ALA  96           HB3      ALA  96 -29.330  -1.608  -7.956

  No H/Q in entry =           5
  In of MODEL   31
    1    H    VAL  97           H        VAL  97 -32.882  -2.177  -9.598
    2    HA   VAL  97           HA       VAL  97 -33.869   0.163 -10.847
    3    HB   VAL  97           HB       VAL  97 -34.803  -2.726 -10.870
    4   HG11  VAL  97          HG11      VAL  97 -36.513  -0.646 -11.341
    5   HG13  VAL  97          HG12      VAL  97 -36.650  -2.237 -12.091
    6   HG12  VAL  97          HG13      VAL  97 -35.850  -0.922 -12.952
    7   HG21  VAL  97          HG21      VAL  97 -33.472  -0.959 -12.926
    8   HG23  VAL  97          HG22      VAL  97 -34.000  -2.619 -13.205
    9   HG22  VAL  97          HG23      VAL  97 -32.721  -2.283 -12.037

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ALA  98           H        ALA  98 -35.113  -1.957  -8.289
    2    HA   ALA  98           HA       ALA  98 -37.617  -0.699  -7.911
    3    HB1  ALA  98           HB1      ALA  98 -36.687  -2.937  -6.884
    4    HB3  ALA  98           HB2      ALA  98 -37.815  -1.961  -5.941
    5    HB2  ALA  98           HB3      ALA  98 -36.085  -1.885  -5.603

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA  99           H        ALA  99 -34.487  -0.030  -6.304
    2    HA   ALA  99           HA       ALA  99 -35.507   2.005  -4.633
    3    HB1  ALA  99           HB1      ALA  99 -32.910   0.997  -5.411
    4    HB2  ALA  99           HB2      ALA  99 -33.407   1.775  -3.907
    5    HB3  ALA  99           HB3      ALA  99 -32.905   2.756  -5.283

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ILE 100           H        ILE 100 -34.504   2.082  -8.002
    2    HA   ILE 100           HA       ILE 100 -34.558   4.936  -8.226
    3    HB   ILE 100           HB       ILE 100 -34.776   2.783 -10.358
    4   HG12  ILE 100          HG12      ILE 100 -32.517   4.678  -9.719
    5   HG13  ILE 100          HG13      ILE 100 -32.620   3.036  -9.084
    6   HG21  ILE 100          HG21      ILE 100 -35.071   5.718 -10.490
    7   HG23  ILE 100          HG22      ILE 100 -35.645   4.471 -11.598
    8   HG22  ILE 100          HG23      ILE 100 -33.969   5.013 -11.674
    9   HD12  ILE 100          HD11      ILE 100 -32.079   3.964 -11.867
   10   HD11  ILE 100          HD12      ILE 100 -32.808   2.380 -11.600
   11   HD13  ILE 100          HD13      ILE 100 -31.235   2.755 -10.901

  No H/Q in entry =          11
  In of MODEL   31
    1    H    LYS 101           H        LYS 101 -36.975   2.429  -8.917
    2    HA   LYS 101           HA       LYS 101 -38.993   4.168  -9.895
    3    HB2  LYS 101           HB2      LYS 101 -38.987   1.393  -8.764
    4    HB3  LYS 101           HB3      LYS 101 -40.508   2.223  -9.091
    5    HG2  LYS 101           HG2      LYS 101 -40.056   2.333 -11.395
    6    HG3  LYS 101           HG3      LYS 101 -38.377   1.853 -11.160
    7    HD2  LYS 101           HD2      LYS 101 -39.721   0.000 -12.027
    8    HD3  LYS 101           HD3      LYS 101 -39.090  -0.355 -10.418
    9    HE2  LYS 101           HE2      LYS 101 -41.175  -0.956  -9.885
   10    HE3  LYS 101           HE3      LYS 101 -41.556   0.767  -9.886
   11    HZ3  LYS 101           HZ1      LYS 101 -42.479   0.647 -11.992
   12    HZ2  LYS 101           HZ2      LYS 101 -42.997  -0.804 -11.277
   13    HZ1  LYS 101           HZ3      LYS 101 -41.704  -0.816 -12.376

  No H/Q in entry =          13
  In of MODEL   31
    1    H    LYS 102           H        LYS 102 -38.528   2.675  -6.690
    2    HA   LYS 102           HA       LYS 102 -40.705   3.972  -5.467
    3    HB2  LYS 102           HB2      LYS 102 -39.541   2.053  -4.463
    4    HB3  LYS 102           HB3      LYS 102 -38.102   3.045  -4.239
    5    HG2  LYS 102           HG2      LYS 102 -39.336   4.500  -2.729
    6    HG3  LYS 102           HG3      LYS 102 -40.779   3.512  -2.955
    7    HD2  LYS 102           HD2      LYS 102 -39.625   1.594  -1.941
    8    HD3  LYS 102           HD3      LYS 102 -38.183   2.584  -1.713
    9    HE2  LYS 102           HE2      LYS 102 -39.453   4.122  -0.290
   10    HE3  LYS 102           HE3      LYS 102 -40.911   3.164  -0.540
   11    HZ1  LYS 102           HZ1      LYS 102 -39.259   1.335   0.447
   12    HZ3  LYS 102           HZ2      LYS 102 -40.317   2.271   1.389
   13    HZ2  LYS 102           HZ3      LYS 102 -38.686   2.723   1.241

  No H/Q in entry =          13
  In of MODEL   31
    1    H    ALA 103           H        ALA 103 -37.704   5.228  -6.518
    2    HA   ALA 103           HA       ALA 103 -37.801   7.553  -4.738
    3    HB2  ALA 103           HB1      ALA 103 -35.799   8.195  -6.338
    4    HB3  ALA 103           HB2      ALA 103 -35.845   6.476  -6.734
    5    HB1  ALA 103           HB3      ALA 103 -35.574   6.992  -5.069

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA 104           H        ALA 104 -38.495   6.846  -8.075
    2    HA   ALA 104           HA       ALA 104 -38.962   9.653  -8.695
    3    HB2  ALA 104           HB1      ALA 104 -39.062   8.986 -10.895
    4    HB1  ALA 104           HB2      ALA 104 -39.854   7.459 -10.506
    5    HB3  ALA 104           HB3      ALA 104 -38.118   7.644 -10.248

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA 105           H        ALA 105 -40.642   7.625  -6.867
    2    HA   ALA 105           HA       ALA 105 -43.001   9.125  -6.815
    3    HB2  ALA 105           HB1      ALA 105 -43.807   8.297  -8.842
    4    HB3  ALA 105           HB2      ALA 105 -44.483   7.140  -7.697
    5    HB1  ALA 105           HB3      ALA 105 -43.041   6.725  -8.622

  No H/Q in entry =           5
  In of MODEL   32
    1    H1   ALA   1           H3       ALA   1 -12.110 -15.978  -2.204
    2    H2   ALA   1           H2       ALA   1 -11.166 -17.108  -3.058
    3    H3   ALA   1           H1       ALA   1 -12.329 -16.173  -3.876
    4    HA   ALA   1           HA       ALA   1 -13.707 -17.889  -3.624
    5    HB3  ALA   1           HB1      ALA   1 -12.288 -19.647  -3.182
    6    HB1  ALA   1           HB2      ALA   1 -13.027 -19.546  -1.584
    7    HB2  ALA   1           HB3      ALA   1 -11.462 -18.788  -1.881

  No H/Q in entry =           7
  In of MODEL   32
    1    H    GLU   2           H        GLU   2 -15.302 -18.764  -1.953
    2    HA   GLU   2           HA       GLU   2 -16.956 -17.063  -0.871
    3    HB2  GLU   2           HB2      GLU   2 -15.974 -19.482   0.657
    4    HB3  GLU   2           HB3      GLU   2 -17.503 -18.648   0.930
    5    HG2  GLU   2           HG2      GLU   2 -18.492 -19.741  -0.795
    6    HG3  GLU   2           HG3      GLU   2 -17.185 -19.324  -1.894

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLU   3           H        GLU   3 -14.999 -18.402   1.727
    2    HA   GLU   3           HA       GLU   3 -15.227 -16.054   3.292
    3    HB2  GLU   3           HB2      GLU   3 -13.613 -18.585   3.518
    4    HB3  GLU   3           HB3      GLU   3 -13.382 -17.266   4.665
    5    HG2  GLU   3           HG2      GLU   3 -15.564 -17.441   5.508
    6    HG3  GLU   3           HG3      GLU   3 -16.167 -18.244   4.065

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LEU   4           H        LEU   4 -12.274 -17.499   1.863
    2    HA   LEU   4           HA       LEU   4 -10.452 -15.578   2.445
    3    HB2  LEU   4           HB2      LEU   4 -10.701 -16.872  -0.280
    4    HB3  LEU   4           HB3      LEU   4  -9.248 -16.139   0.390
    5    HG   LEU   4           HG       LEU   4 -10.705 -18.553   1.514
    6   HD13  LEU   4          HD11      LEU   4  -9.069 -19.890   0.563
    7   HD12  LEU   4          HD12      LEU   4  -7.873 -18.595   0.526
    8   HD11  LEU   4          HD13      LEU   4  -9.175 -18.628  -0.662
    9   HD23  LEU   4          HD21      LEU   4  -8.438 -18.597   2.870
   10   HD22  LEU   4          HD22      LEU   4  -9.763 -17.572   3.416
   11   HD21  LEU   4          HD23      LEU   4  -8.418 -16.868   2.520

  No H/Q in entry =          11
  In of MODEL   32
    1    H    GLU   5           H        GLU   5 -12.819 -15.390  -0.202
    2    HA   GLU   5           HA       GLU   5 -11.853 -12.894  -1.208
    3    HB2  GLU   5           HB2      GLU   5 -13.208 -14.509  -2.544
    4    HB3  GLU   5           HB3      GLU   5 -14.599 -14.121  -1.532
    5    HG2  GLU   5           HG2      GLU   5 -14.759 -12.751  -3.503
    6    HG3  GLU   5           HG3      GLU   5 -14.281 -11.700  -2.171

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLU   6           H        GLU   6 -14.545 -13.804   0.913
    2    HA   GLU   6           HA       GLU   6 -15.472 -11.138   1.329
    3    HB2  GLU   6           HB2      GLU   6 -16.874 -13.145   1.739
    4    HB3  GLU   6           HB3      GLU   6 -15.822 -13.583   3.085
    5    HG2  GLU   6           HG2      GLU   6 -16.354 -11.454   4.205
    6    HG3  GLU   6           HG3      GLU   6 -17.400 -11.003   2.860

  No H/Q in entry =           6
  In of MODEL   32
    1    H    VAL   7           H        VAL   7 -13.126 -13.228   2.869
    2    HA   VAL   7           HA       VAL   7 -12.649 -11.654   5.194
    3    HB   VAL   7           HB       VAL   7 -10.941 -13.677   3.721
    4   HG11  VAL   7          HG11      VAL   7 -10.460 -12.145   6.283
    5   HG13  VAL   7          HG12      VAL   7  -9.373 -12.345   4.910
    6   HG12  VAL   7          HG13      VAL   7  -9.700 -13.708   5.980
    7   HG21  VAL   7          HG21      VAL   7 -13.172 -14.267   4.965
    8   HG23  VAL   7          HG22      VAL   7 -12.231 -13.986   6.431
    9   HG22  VAL   7          HG23      VAL   7 -11.738 -15.239   5.293

  No H/Q in entry =           9
  In of MODEL   32
    1    H    VAL   8           H        VAL   8 -11.173 -11.746   1.967
    2    HA   VAL   8           HA       VAL   8  -9.124  -9.854   2.441
    3    HB   VAL   8           HB       VAL   8 -10.609 -10.553  -0.103
    4   HG13  VAL   8          HG11      VAL   8  -9.691  -8.401  -0.499
    5   HG12  VAL   8          HG12      VAL   8  -8.484  -9.515  -1.144
    6   HG11  VAL   8          HG13      VAL   8  -8.234  -8.761   0.430
    7   HG23  VAL   8          HG21      VAL   8  -7.753 -11.294   0.301
    8   HG22  VAL   8          HG22      VAL   8  -9.072 -12.240  -0.381
    9   HG21  VAL   8          HG23      VAL   8  -8.888 -12.126   1.366

  No H/Q in entry =           9
  In of MODEL   32
    1    H    MET   9           H        MET   9 -12.486  -9.495   1.320
    2    HA   MET   9           HA       MET   9 -12.455  -6.717   0.891
    3    HB2  MET   9           HB2      MET   9 -14.619  -8.653   1.687
    4    HB3  MET   9           HB3      MET   9 -14.950  -6.921   1.591
    5    HG2  MET   9           HG2      MET   9 -13.886  -7.035  -0.757
    6    HG3  MET   9           HG3      MET   9 -14.074  -8.783  -0.616
    7    HE1  MET   9           HE1      MET   9 -15.956 -10.060  -0.605
    8    HE3  MET   9           HE2      MET   9 -17.646  -9.588  -0.754
    9    HE2  MET   9           HE3      MET   9 -16.824  -9.412   0.793

  No H/Q in entry =           9
  In of MODEL   32
    1    H    GLY  10           H        GLY  10 -13.066  -8.621   3.821
    2    HA3  GLY  10           HA2      GLY  10 -13.617  -6.446   5.551
    3    HA2  GLY  10           HA3      GLY  10 -13.031  -8.030   6.055

  No H/Q in entry =           3
  In of MODEL   32
    1    H    LEU  11           H        LEU  11 -10.599  -8.126   4.712
    2    HA   LEU  11           HA       LEU  11  -8.894  -6.678   6.453
    3    HB2  LEU  11           HB2      LEU  11  -8.362  -8.091   3.837
    4    HB3  LEU  11           HB3      LEU  11  -7.088  -7.375   4.822
    5    HG   LEU  11           HG       LEU  11  -9.057  -9.431   5.857
    6   HD13  LEU  11          HD11      LEU  11  -7.840 -10.652   4.276
    7   HD12  LEU  11          HD12      LEU  11  -6.886 -10.883   5.740
    8   HD11  LEU  11          HD13      LEU  11  -6.371  -9.710   4.529
    9   HD22  LEU  11          HD21      LEU  11  -8.193  -8.413   7.766
   10   HD21  LEU  11          HD22      LEU  11  -6.668  -7.994   6.987
   11   HD23  LEU  11          HD23      LEU  11  -6.971  -9.654   7.496

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  12           H        ILE  12  -9.840  -6.134   3.075
    2    HA   ILE  12           HA       ILE  12  -8.177  -3.885   2.634
    3    HB   ILE  12           HB       ILE  12 -10.824  -4.630   1.367
    4   HG12  ILE  12          HG12      ILE  12  -8.749  -6.190   1.214
    5   HG13  ILE  12          HG13      ILE  12  -9.586  -5.787  -0.270
    6   HG21  ILE  12          HG21      ILE  12  -8.716  -2.615   0.520
    7   HG23  ILE  12          HG22      ILE  12 -10.379  -2.262   0.967
    8   HG22  ILE  12          HG23      ILE  12 -10.027  -3.160  -0.480
    9   HD11  ILE  12          HD11      ILE  12  -7.110  -4.380   0.772
   10   HD13  ILE  12          HD12      ILE  12  -7.898  -4.108  -0.781
   11   HD12  ILE  12          HD13      ILE  12  -7.104  -5.631  -0.457

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  13           H        ILE  13 -11.522  -4.191   3.764
    2    HA   ILE  13           HA       ILE  13 -12.010  -1.410   4.045
    3    HB   ILE  13           HB       ILE  13 -13.174  -3.863   5.378
    4   HG12  ILE  13          HG12      ILE  13 -13.485  -3.319   2.890
    5   HG13  ILE  13          HG13      ILE  13 -14.926  -3.654   3.825
    6   HG21  ILE  13          HG21      ILE  13 -13.708  -0.965   5.898
    7   HG23  ILE  13          HG22      ILE  13 -13.746  -2.317   7.020
    8   HG22  ILE  13          HG23      ILE  13 -15.081  -2.066   5.900
    9   HD11  ILE  13          HD11      ILE  13 -14.128  -0.809   3.784
   10   HD13  ILE  13          HD12      ILE  13 -15.709  -1.548   3.626
   11   HD12  ILE  13          HD13      ILE  13 -14.652  -1.476   2.235

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ASN  14           H        ASN  14 -10.846  -3.892   6.302
    2    HA   ASN  14           HA       ASN  14 -10.639  -2.257   8.589
    3    HB2  ASN  14           HB2      ASN  14 -10.359  -4.860   8.258
    4    HB3  ASN  14           HB3      ASN  14  -8.657  -4.453   8.083
    5   HD21  ASN  14          HD21      ASN  14  -9.251  -5.989  10.263
    6   HD22  ASN  14          HD22      ASN  14  -9.218  -5.071  11.689

  No H/Q in entry =           6
  In of MODEL   32
    1    H    SER  15           H        SER  15  -8.255  -3.047   6.069
    2    HA   SER  15           HA       SER  15  -6.117  -1.531   7.120
    3    HB2  SER  15           HB2      SER  15  -5.121  -1.724   4.946
    4    HB3  SER  15           HB3      SER  15  -6.047  -3.202   5.187
    5    HG   SER  15           HG       SER  15  -6.400  -1.174   3.390

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLY  16           H        GLY  16  -8.754  -0.691   4.904
    2    HA3  GLY  16           HA2      GLY  16  -7.934   1.961   4.348
    3    HA2  GLY  16           HA3      GLY  16  -9.579   1.346   4.203

  No H/Q in entry =           3
  In of MODEL   32
    1    H    GLN  17           H        GLN  17 -10.084   0.609   6.857
    2    HA   GLN  17           HA       GLN  17 -10.810   3.103   8.011
    3    HB2  GLN  17           HB2      GLN  17 -10.670   0.313   9.169
    4    HB3  GLN  17           HB3      GLN  17 -11.281   1.701  10.071
    5    HG2  GLN  17           HG2      GLN  17 -12.992   2.091   8.357
    6    HG3  GLN  17           HG3      GLN  17 -12.361   0.751   7.401
    7   HE21  GLN  17          HE21      GLN  17 -14.761   1.512   9.614
    8   HE22  GLN  17          HE22      GLN  17 -15.052  -0.043  10.230

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ALA  18           H        ALA  18  -8.146   0.854   8.597
    2    HA   ALA  18           HA       ALA  18  -7.039   2.079  10.858
    3    HB2  ALA  18           HB1      ALA  18  -6.416  -0.126   9.479
    4    HB3  ALA  18           HB2      ALA  18  -5.251   0.670  10.539
    5    HB1  ALA  18           HB3      ALA  18  -5.197   0.953   8.798

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ARG  19           H        ARG  19  -6.312   2.619   7.402
    2    HA   ARG  19           HA       ARG  19  -4.436   4.691   7.814
    3    HB2  ARG  19           HB2      ARG  19  -4.773   3.550   5.620
    4    HB3  ARG  19           HB3      ARG  19  -6.328   4.370   5.462
    5    HG2  ARG  19           HG2      ARG  19  -5.227   6.557   5.522
    6    HG3  ARG  19           HG3      ARG  19  -3.665   5.791   5.808
    7    HD2  ARG  19           HD2      ARG  19  -3.823   6.384   3.467
    8    HD3  ARG  19           HD3      ARG  19  -3.883   4.623   3.610
    9    HE   ARG  19           HE       ARG  19  -6.529   5.497   3.633
   10   HH21  ARG  19          HH11      ARG  19  -7.746   5.640   1.728
   11   HH22  ARG  19          HH12      ARG  19  -6.943   5.732   0.200
   12   HH11  ARG  19          HH21      ARG  19  -3.777   5.601   1.569
   13   HH12  ARG  19          HH22      ARG  19  -4.693   5.707   0.110

  No H/Q in entry =          13
  In of MODEL   32
    1    H    SER  20           H        SER  20  -7.942   4.760   7.252
    2    HA   SER  20           HA       SER  20  -8.337   7.510   7.213
    3    HB2  SER  20           HB2      SER  20 -10.201   6.145   6.694
    4    HB3  SER  20           HB3      SER  20 -10.065   5.250   8.206
    5    HG   SER  20           HG       SER  20 -11.009   7.855   7.723

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU  21           H        LEU  21  -8.277   5.323  10.013
    2    HA   LEU  21           HA       LEU  21  -8.724   7.309  11.986
    3    HB2  LEU  21           HB2      LEU  21  -7.333   4.627  12.127
    4    HB3  LEU  21           HB3      LEU  21  -7.641   5.637  13.535
    5    HG   LEU  21           HG       LEU  21  -9.815   4.706  11.637
    6   HD13  LEU  21          HD11      LEU  21  -8.896   2.733  12.662
    7   HD12  LEU  21          HD12      LEU  21 -10.381   3.120  13.530
    8   HD11  LEU  21          HD13      LEU  21  -8.816   3.521  14.239
    9   HD23  LEU  21          HD21      LEU  21 -11.141   5.194  13.874
   10   HD22  LEU  21          HD22      LEU  21 -10.724   6.539  12.816
   11   HD21  LEU  21          HD23      LEU  21  -9.760   6.222  14.250

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ALA  22           H        ALA  22  -5.768   5.980  10.545
    2    HA   ALA  22           HA       ALA  22  -3.890   7.317  12.149
    3    HB2  ALA  22           HB1      ALA  22  -3.466   5.472  10.450
    4    HB1  ALA  22           HB2      ALA  22  -2.288   6.785  10.474
    5    HB3  ALA  22           HB3      ALA  22  -3.518   6.726   9.212

  No H/Q in entry =           5
  In of MODEL   32
    1    H    TYR  23           H        TYR  23  -5.255   8.321   8.982
    2    HA   TYR  23           HA       TYR  23  -3.955  10.836   8.902
    3    HB2  TYR  23           HB2      TYR  23  -5.043   9.912   6.920
    4    HB3  TYR  23           HB3      TYR  23  -6.615   9.994   7.718
    5    HD1  TYR  23           HD1      TYR  23  -3.754  12.086   6.549
    6    HD2  TYR  23           HD2      TYR  23  -7.888  11.983   7.709
    7    HE1  TYR  23           HE1      TYR  23  -4.023  14.434   5.797
    8    HE2  TYR  23           HE2      TYR  23  -8.157  14.331   6.956
    9    HH   TYR  23           HH       TYR  23  -5.489  16.074   5.387

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ALA  24           H        ALA  24  -7.046   9.811  10.313
    2    HA   ALA  24           HA       ALA  24  -7.911  12.388  11.097
    3    HB1  ALA  24           HB1      ALA  24  -9.707  11.110  11.582
    4    HB2  ALA  24           HB2      ALA  24  -8.857  10.548  13.020
    5    HB3  ALA  24           HB3      ALA  24  -8.735   9.640  11.513

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA  25           H        ALA  25  -5.858   9.956  12.646
    2    HA   ALA  25           HA       ALA  25  -5.511  11.209  15.147
    3    HB2  ALA  25           HB1      ALA  25  -4.720   8.869  14.313
    4    HB3  ALA  25           HB2      ALA  25  -3.705   9.740  15.465
    5    HB1  ALA  25           HB3      ALA  25  -3.286   9.732  13.751

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU  26           H        LEU  26  -3.757  11.538  12.088
    2    HA   LEU  26           HA       LEU  26  -1.815  13.385  12.987
    3    HB2  LEU  26           HB2      LEU  26  -1.520  12.241  10.878
    4    HB3  LEU  26           HB3      LEU  26  -3.010  12.929  10.240
    5    HG   LEU  26           HG       LEU  26  -2.026  15.193  10.369
    6   HD12  LEU  26          HD11      LEU  26   0.516  15.248  10.756
    7   HD11  LEU  26          HD12      LEU  26   0.323  13.663  11.500
    8   HD13  LEU  26          HD13      LEU  26  -0.497  15.065  12.188
    9   HD21  LEU  26          HD21      LEU  26  -0.269  13.166   8.952
   10   HD23  LEU  26          HD22      LEU  26  -0.340  14.887   8.585
   11   HD22  LEU  26          HD23      LEU  26  -1.752  13.870   8.310

  No H/Q in entry =          11
  In of MODEL   32
    1    H    LYS  27           H        LYS  27  -5.019  13.825  11.544
    2    HA   LYS  27           HA       LYS  27  -5.005  16.614  11.350
    3    HB2  LYS  27           HB2      LYS  27  -6.739  15.114  10.380
    4    HB3  LYS  27           HB3      LYS  27  -7.375  14.846  12.003
    5    HG2  LYS  27           HG2      LYS  27  -7.835  17.245  12.248
    6    HG3  LYS  27           HG3      LYS  27  -7.148  17.555  10.650
    7    HD2  LYS  27           HD2      LYS  27  -8.871  16.098   9.629
    8    HD3  LYS  27           HD3      LYS  27  -9.564  15.806  11.226
    9    HE2  LYS  27           HE2      LYS  27 -10.038  18.210  11.478
   10    HE3  LYS  27           HE3      LYS  27  -9.317  18.525   9.896
   11    HZ3  LYS  27           HZ1      LYS  27 -11.695  18.367   9.680
   12    HZ2  LYS  27           HZ2      LYS  27 -11.714  16.849  10.447
   13    HZ1  LYS  27           HZ3      LYS  27 -10.987  17.025   8.918

  No H/Q in entry =          13
  In of MODEL   32
    1    H    GLN  28           H        GLN  28  -5.836  14.511  14.083
    2    HA   GLN  28           HA       GLN  28  -6.740  16.500  15.872
    3    HB2  GLN  28           HB2      GLN  28  -5.299  13.885  16.392
    4    HB3  GLN  28           HB3      GLN  28  -6.034  14.879  17.652
    5    HG2  GLN  28           HG2      GLN  28  -7.517  13.750  15.261
    6    HG3  GLN  28           HG3      GLN  28  -7.543  13.053  16.880
    7   HE21  GLN  28          HE21      GLN  28  -9.540  14.732  14.999
    8   HE22  GLN  28          HE22      GLN  28 -10.252  15.783  16.125

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ALA  29           H        ALA  29  -3.512  15.247  15.146
    2    HA   ALA  29           HA       ALA  29  -2.071  16.660  17.112
    3    HB1  ALA  29           HB1      ALA  29  -0.143  15.996  15.971
    4    HB3  ALA  29           HB2      ALA  29  -0.916  16.113  14.390
    5    HB2  ALA  29           HB3      ALA  29  -1.310  14.773  15.467

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LYS  30           H        LYS  30  -2.975  17.534  13.793
    2    HA   LYS  30           HA       LYS  30  -1.595  19.991  13.682
    3    HB2  LYS  30           HB2      LYS  30  -4.130  19.091  12.299
    4    HB3  LYS  30           HB3      LYS  30  -3.318  20.615  11.949
    5    HG2  LYS  30           HG2      LYS  30  -1.239  19.347  11.411
    6    HG3  LYS  30           HG3      LYS  30  -2.126  17.840  11.663
    7    HD2  LYS  30           HD2      LYS  30  -3.716  18.466   9.886
    8    HD3  LYS  30           HD3      LYS  30  -2.852  19.985   9.637
    9    HE2  LYS  30           HE2      LYS  30  -0.812  18.715   9.033
   10    HE3  LYS  30           HE3      LYS  30  -1.696  17.202   9.252
   11    HZ2  LYS  30           HZ1      LYS  30  -1.554  18.079   6.910
   12    HZ1  LYS  30           HZ2      LYS  30  -2.606  19.330   7.392
   13    HZ3  LYS  30           HZ3      LYS  30  -3.112  17.707   7.465

  No H/Q in entry =          13
  In of MODEL   32
    1    H    GLN  31           H        GLN  31  -4.670  19.104  15.126
    2    HA   GLN  31           HA       GLN  31  -5.457  21.851  15.592
    3    HB2  GLN  31           HB2      GLN  31  -6.597  19.390  16.923
    4    HB3  GLN  31           HB3      GLN  31  -7.375  20.955  16.689
    5    HG2  GLN  31           HG2      GLN  31  -6.685  20.190  14.090
    6    HG3  GLN  31           HG3      GLN  31  -7.187  18.679  14.839
    7   HE21  GLN  31          HE21      GLN  31  -8.636  20.243  12.756
    8   HE22  GLN  31          HE22      GLN  31 -10.146  20.618  13.432

  No H/Q in entry =           8
  In of MODEL   32
    1    H    GLY  32           H        GLY  32  -3.111  19.944  16.883
    2    HA3  GLY  32           HA2      GLY  32  -1.696  20.416  18.671
    3    HA2  GLY  32           HA3      GLY  32  -2.831  21.647  19.209

  No H/Q in entry =           3
  In of MODEL   32
    1    H    ASP  33           H        ASP  33  -4.231  18.596  18.557
    2    HA   ASP  33           HA       ASP  33  -4.606  18.128  21.440
    3    HB2  ASP  33           HB2      ASP  33  -6.030  17.108  18.976
    4    HB3  ASP  33           HB3      ASP  33  -6.351  16.491  20.594

  No H/Q in entry =           4
  In of MODEL   32
    1    H    PHE  34           H        PHE  34  -2.426  17.297  21.719
    2    HA   PHE  34           HA       PHE  34  -1.420  15.061  20.302
    3    HB2  PHE  34           HB2      PHE  34  -0.781  16.045  23.092
    4    HB3  PHE  34           HB3      PHE  34   0.149  14.832  22.212
    5    HD1  PHE  34           HD1      PHE  34  -0.047  18.255  22.956
    6    HD2  PHE  34           HD2      PHE  34   0.773  15.567  19.706
    7    HE1  PHE  34           HE1      PHE  34   1.218  20.041  21.792
    8    HE2  PHE  34           HE2      PHE  34   2.033  17.356  18.547
    9    HZ   PHE  34           HZ       PHE  34   2.258  19.590  19.595

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ALA  35           H        ALA  35  -3.430  15.312  23.188
    2    HA   ALA  35           HA       ALA  35  -3.183  12.650  24.076
    3    HB3  ALA  35           HB1      ALA  35  -5.637  13.251  24.962
    4    HB1  ALA  35           HB2      ALA  35  -5.124  14.875  24.504
    5    HB2  ALA  35           HB3      ALA  35  -4.188  13.957  25.683

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA  36           H        ALA  36  -5.671  14.148  22.007
    2    HA   ALA  36           HA       ALA  36  -7.068  11.725  21.540
    3    HB1  ALA  36           HB1      ALA  36  -8.548  13.136  20.603
    4    HB3  ALA  36           HB2      ALA  36  -7.394  13.570  19.342
    5    HB2  ALA  36           HB3      ALA  36  -7.410  14.454  20.868

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA  37           H        ALA  37  -4.422  13.341  19.845
    2    HA   ALA  37           HA       ALA  37  -4.397  11.711  17.544
    3    HB3  ALA  37           HB1      ALA  37  -2.405  13.438  18.948
    4    HB2  ALA  37           HB2      ALA  37  -2.955  13.493  17.275
    5    HB1  ALA  37           HB3      ALA  37  -1.784  12.273  17.780

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LYS  38           H        LYS  38  -2.603  11.415  20.601
    2    HA   LYS  38           HA       LYS  38  -1.261   9.028  20.092
    3    HB2  LYS  38           HB2      LYS  38  -1.576  10.783  22.245
    4    HB3  LYS  38           HB3      LYS  38  -2.174   9.246  22.864
    5    HG2  LYS  38           HG2      LYS  38  -0.075   8.147  22.302
    6    HG3  LYS  38           HG3      LYS  38   0.510   9.600  21.485
    7    HD2  LYS  38           HD2      LYS  38   0.691  10.815  23.521
    8    HD3  LYS  38           HD3      LYS  38  -0.308   9.653  24.397
    9    HE2  LYS  38           HE2      LYS  38   2.057   9.358  24.989
   10    HE3  LYS  38           HE3      LYS  38   1.457   7.938  24.128
   11    HZ3  LYS  38           HZ1      LYS  38   2.733   8.373  22.334
   12    HZ2  LYS  38           HZ2      LYS  38   3.693   9.208  23.462
   13    HZ1  LYS  38           HZ3      LYS  38   2.595  10.060  22.484

  No H/Q in entry =          13
  In of MODEL   32
    1    H    ALA  39           H        ALA  39  -4.488   9.489  21.531
    2    HA   ALA  39           HA       ALA  39  -5.017   6.764  22.035
    3    HB3  ALA  39           HB1      ALA  39  -7.202   8.690  21.297
    4    HB2  ALA  39           HB2      ALA  39  -6.290   8.921  22.789
    5    HB1  ALA  39           HB3      ALA  39  -7.195   7.429  22.532

  No H/Q in entry =           5
  In of MODEL   32
    1    H    MET  40           H        MET  40  -5.653   8.778  19.200
    2    HA   MET  40           HA       MET  40  -7.126   6.835  17.752
    3    HB2  MET  40           HB2      MET  40  -5.550   9.248  16.835
    4    HB3  MET  40           HB3      MET  40  -6.578   8.282  15.774
    5    HG2  MET  40           HG2      MET  40  -7.596   9.515  18.347
    6    HG3  MET  40           HG3      MET  40  -7.679  10.353  16.799
    7    HE3  MET  40           HE1      MET  40 -10.269   8.713  14.760
    8    HE2  MET  40           HE2      MET  40  -8.520   8.848  14.592
    9    HE1  MET  40           HE3      MET  40  -9.443  10.202  15.239

  No H/Q in entry =           9
  In of MODEL   32
    1    H    MET  41           H        MET  41  -3.641   7.606  17.837
    2    HA   MET  41           HA       MET  41  -2.889   5.865  15.724
    3    HB2  MET  41           HB2      MET  41  -1.252   6.541  18.181
    4    HB3  MET  41           HB3      MET  41  -0.645   5.903  16.657
    5    HG2  MET  41           HG2      MET  41  -1.834   8.076  15.671
    6    HG3  MET  41           HG3      MET  41  -1.586   8.663  17.315
    7    HE2  MET  41           HE1      MET  41   1.357   6.593  17.639
    8    HE1  MET  41           HE2      MET  41   0.566   7.876  18.549
    9    HE3  MET  41           HE3      MET  41   2.179   8.138  17.889

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ASP  42           H        ASP  42  -3.231   5.379  19.213
    2    HA   ASP  42           HA       ASP  42  -2.167   2.795  19.356
    3    HB2  ASP  42           HB2      ASP  42  -3.038   4.542  21.192
    4    HB3  ASP  42           HB3      ASP  42  -4.456   3.502  21.133

  No H/Q in entry =           4
  In of MODEL   32
    1    H    GLN  43           H        GLN  43  -5.517   3.866  18.894
    2    HA   GLN  43           HA       GLN  43  -6.636   1.268  18.706
    3    HB2  GLN  43           HB2      GLN  43  -7.599   3.913  17.594
    4    HB3  GLN  43           HB3      GLN  43  -8.546   2.424  17.578
    5    HG2  GLN  43           HG2      GLN  43  -8.224   2.300  20.082
    6    HG3  GLN  43           HG3      GLN  43  -7.517   3.913  20.007
    7   HE21  GLN  43          HE21      GLN  43  -9.681   3.966  21.531
    8   HE22  GLN  43          HE22      GLN  43 -11.056   4.530  20.716

  No H/Q in entry =           8
  In of MODEL   32
    1    H    SER  44           H        SER  44  -5.345   3.501  16.285
    2    HA   SER  44           HA       SER  44  -6.056   2.016  14.000
    3    HB2  SER  44           HB2      SER  44  -4.819   4.411  14.436
    4    HB3  SER  44           HB3      SER  44  -3.461   3.430  13.889
    5    HG   SER  44           HG       SER  44  -4.602   4.395  12.140

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ARG  45           H        ARG  45  -3.155   1.927  16.048
    2    HA   ARG  45           HA       ARG  45  -1.670  -0.008  14.645
    3    HB2  ARG  45           HB2      ARG  45  -0.822   1.417  16.508
    4    HB3  ARG  45           HB3      ARG  45  -1.792   0.473  17.637
    5    HG2  ARG  45           HG2      ARG  45  -0.547  -1.571  16.976
    6    HG3  ARG  45           HG3      ARG  45   0.447  -0.603  15.889
    7    HD2  ARG  45           HD2      ARG  45   1.189   0.780  17.840
    8    HD3  ARG  45           HD3      ARG  45   0.290  -0.307  18.921
    9    HE   ARG  45           HE       ARG  45   1.988  -1.881  17.318
   10   HH21  ARG  45          HH11      ARG  45   3.905  -2.686  18.132
   11   HH22  ARG  45          HH12      ARG  45   4.685  -1.896  19.457
   12   HH11  ARG  45          HH21      ARG  45   2.292   0.583  19.711
   13   HH12  ARG  45          HH22      ARG  45   3.770  -0.042  20.348

  No H/Q in entry =          13
  In of MODEL   32
    1    H    MET  46           H        MET  46  -4.036  -0.360  17.270
    2    HA   MET  46           HA       MET  46  -3.836  -3.158  17.567
    3    HB2  MET  46           HB2      MET  46  -6.024  -1.179  18.194
    4    HB3  MET  46           HB3      MET  46  -6.200  -2.901  18.538
    5    HG2  MET  46           HG2      MET  46  -4.165  -2.852  19.913
    6    HG3  MET  46           HG3      MET  46  -3.939  -1.148  19.546
    7    HE2  MET  46           HE1      MET  46  -3.960  -0.142  21.886
    8    HE1  MET  46           HE2      MET  46  -3.798  -1.819  22.396
    9    HE3  MET  46           HE3      MET  46  -4.951  -0.766  23.210

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ALA  47           H        ALA  47  -5.899  -1.156  15.500
    2    HA   ALA  47           HA       ALA  47  -7.508  -3.220  14.446
    3    HB3  ALA  47           HB1      ALA  47  -8.214  -0.988  14.044
    4    HB1  ALA  47           HB2      ALA  47  -7.735  -1.612  12.465
    5    HB2  ALA  47           HB3      ALA  47  -6.656  -0.536  13.354

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU  48           H        LEU  48  -4.413  -1.878  13.366
    2    HA   LEU  48           HA       LEU  48  -4.142  -3.460  11.017
    3    HB2  LEU  48           HB2      LEU  48  -2.078  -2.167  12.807
    4    HB3  LEU  48           HB3      LEU  48  -1.719  -2.880  11.234
    5    HG   LEU  48           HG       LEU  48  -3.758  -0.682  11.651
    6   HD13  LEU  48          HD11      LEU  48  -1.638   0.211  12.297
    7   HD12  LEU  48          HD12      LEU  48  -1.935   0.767  10.650
    8   HD11  LEU  48          HD13      LEU  48  -0.822  -0.570  10.943
    9   HD22  LEU  48          HD21      LEU  48  -4.243  -1.665   9.578
   10   HD21  LEU  48          HD22      LEU  48  -2.559  -2.084   9.264
   11   HD23  LEU  48          HD23      LEU  48  -3.095  -0.410   9.115

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ASN  49           H        ASN  49  -3.058  -3.856  14.351
    2    HA   ASN  49           HA       ASN  49  -1.439  -6.104  13.997
    3    HB2  ASN  49           HB2      ASN  49  -1.468  -4.764  16.049
    4    HB3  ASN  49           HB3      ASN  49  -3.109  -5.291  16.393
    5   HD21  ASN  49          HD21      ASN  49  -2.435  -6.299  18.404
    6   HD22  ASN  49          HD22      ASN  49  -1.541  -7.741  18.411

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLU  50           H        GLU  50  -4.902  -5.860  14.706
    2    HA   GLU  50           HA       GLU  50  -5.390  -8.664  14.812
    3    HB2  GLU  50           HB2      GLU  50  -6.981  -6.993  15.710
    4    HB3  GLU  50           HB3      GLU  50  -7.296  -6.426  14.068
    5    HG2  GLU  50           HG2      GLU  50  -8.150  -8.628  13.433
    6    HG3  GLU  50           HG3      GLU  50  -7.747  -9.273  15.020

  No H/Q in entry =           6
  In of MODEL   32
    1    H    ALA  51           H        ALA  51  -5.505  -6.259  12.224
    2    HA   ALA  51           HA       ALA  51  -6.498  -7.989  10.207
    3    HB2  ALA  51           HB1      ALA  51  -6.307  -6.171   8.841
    4    HB1  ALA  51           HB2      ALA  51  -4.664  -5.811   9.373
    5    HB3  ALA  51           HB3      ALA  51  -6.042  -5.313  10.358

  No H/Q in entry =           5
  In of MODEL   32
    1    H    HIS  52           H        HIS  52  -3.204  -7.060  11.159
    2    HA   HIS  52           HA       HIS  52  -1.815  -8.533   9.191
    3    HB2  HIS  52           HB2      HIS  52  -0.752  -6.807  10.591
    4    HB3  HIS  52           HB3      HIS  52  -0.948  -7.837  12.008
    5    HD1  HIS  52           HD1      HIS  52   0.214 -10.340  11.680
    6    HD2  HIS  52           HD2      HIS  52   1.649  -7.233   9.299
    7    HE1  HIS  52           HE1      HIS  52   2.484 -11.077  10.834
    8    HE2  HIS  52           HE2      HIS  52   3.373  -9.193   9.380

  No H/Q in entry =           8
  In of MODEL   32
    1    H    LEU  53           H        LEU  53  -2.986  -9.428  12.413
    2    HA   LEU  53           HA       LEU  53  -1.769 -11.964  12.587
    3    HB2  LEU  53           HB2      LEU  53  -4.247 -10.802  13.831
    4    HB3  LEU  53           HB3      LEU  53  -3.778 -12.477  14.111
    5    HG   LEU  53           HG       LEU  53  -1.882 -10.152  14.577
    6   HD13  LEU  53          HD11      LEU  53  -3.822  -9.857  16.036
    7   HD12  LEU  53          HD12      LEU  53  -2.448 -10.423  16.985
    8   HD11  LEU  53          HD13      LEU  53  -3.730 -11.543  16.537
    9   HD21  LEU  53          HD21      LEU  53  -1.894 -13.094  15.276
   10   HD23  LEU  53          HD22      LEU  53  -0.961 -11.948  16.233
   11   HD22  LEU  53          HD23      LEU  53  -0.602 -12.160  14.529

  No H/Q in entry =          11
  In of MODEL   32
    1    H    VAL  54           H        VAL  54  -4.901 -10.953  11.260
    2    HA   VAL  54           HA       VAL  54  -5.804 -13.551  10.575
    3    HB   VAL  54           HB       VAL  54  -6.481 -10.819   9.455
    4   HG12  VAL  54          HG11      VAL  54  -8.582 -12.209   8.661
    5   HG11  VAL  54          HG12      VAL  54  -7.461 -13.568   8.718
    6   HG13  VAL  54          HG13      VAL  54  -7.121 -12.187   7.676
    7   HG22  VAL  54          HG21      VAL  54  -7.365 -10.869  11.616
    8   HG21  VAL  54          HG22      VAL  54  -7.608 -12.614  11.594
    9   HG23  VAL  54          HG23      VAL  54  -8.705 -11.562  10.702

  No H/Q in entry =           9
  In of MODEL   32
    1    H    GLN  55           H        GLN  55  -3.967 -11.082   8.774
    2    HA   GLN  55           HA       GLN  55  -3.853 -12.539   6.351
    3    HB2  GLN  55           HB2      GLN  55  -3.266 -10.270   6.161
    4    HB3  GLN  55           HB3      GLN  55  -2.140 -10.343   7.514
    5    HG2  GLN  55           HG2      GLN  55  -0.431 -11.174   6.218
    6    HG3  GLN  55           HG3      GLN  55  -1.509 -12.153   5.232
    7   HE21  GLN  55          HE21      GLN  55  -1.552 -11.457   3.113
    8   HE22  GLN  55          HE22      GLN  55  -1.369  -9.850   2.606

  No H/Q in entry =           8
  In of MODEL   32
    1    H    THR  56           H        THR  56  -1.717 -12.513   9.210
    2    HA   THR  56           HA       THR  56   0.361 -14.096   8.266
    3    HB   THR  56           HB       THR  56  -0.909 -14.133  11.017
    4    HG1  THR  56           HG1      THR  56   1.388 -12.919  11.010
    5   HG23  THR  56          HG21      THR  56   0.418 -16.091  10.896
    6   HG22  THR  56          HG22      THR  56   1.477 -14.889  11.633
    7   HG21  THR  56          HG23      THR  56   1.653 -15.291   9.925

  No H/Q in entry =           7
  In of MODEL   32
    1    H    LYS  57           H        LYS  57  -2.738 -15.155   9.658
    2    HA   LYS  57           HA       LYS  57  -2.278 -17.948   9.400
    3    HB2  LYS  57           HB2      LYS  57  -4.089 -16.871  10.767
    4    HB3  LYS  57           HB3      LYS  57  -4.899 -16.423   9.274
    5    HG2  LYS  57           HG2      LYS  57  -5.119 -18.792   8.659
    6    HG3  LYS  57           HG3      LYS  57  -4.282 -19.263  10.135
    7    HD2  LYS  57           HD2      LYS  57  -6.796 -17.590  10.223
    8    HD3  LYS  57           HD3      LYS  57  -6.865 -19.351  10.166
    9    HE2  LYS  57           HE2      LYS  57  -5.330 -19.381  12.187
   10    HE3  LYS  57           HE3      LYS  57  -5.546 -17.637  12.306
   11    HZ2  LYS  57           HZ1      LYS  57  -7.147 -19.487  13.441
   12    HZ1  LYS  57           HZ2      LYS  57  -8.008 -19.094  12.030
   13    HZ3  LYS  57           HZ3      LYS  57  -7.582 -17.875  13.134

  No H/Q in entry =          13
  In of MODEL   32
    1    H    LEU  58           H        LEU  58  -3.646 -15.507   7.245
    2    HA   LEU  58           HA       LEU  58  -4.459 -17.331   5.242
    3    HB2  LEU  58           HB2      LEU  58  -3.871 -14.379   5.109
    4    HB3  LEU  58           HB3      LEU  58  -4.542 -15.316   3.773
    5    HG   LEU  58           HG       LEU  58  -5.795 -15.151   6.534
    6   HD11  LEU  58          HD11      LEU  58  -6.130 -13.499   4.050
    7   HD13  LEU  58          HD12      LEU  58  -6.106 -12.996   5.741
    8   HD12  LEU  58          HD13      LEU  58  -7.531 -13.796   5.081
    9   HD22  LEU  58          HD21      LEU  58  -6.755 -17.063   5.669
   10   HD21  LEU  58          HD22      LEU  58  -6.436 -16.605   3.996
   11   HD23  LEU  58          HD23      LEU  58  -7.794 -15.889   4.863

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  59           H        ILE  59  -1.321 -16.104   6.074
    2    HA   ILE  59           HA       ILE  59  -0.246 -16.818   3.425
    3    HB   ILE  59           HB       ILE  59   0.526 -14.754   5.001
    4   HG12  ILE  59          HG12      ILE  59   2.598 -16.382   3.512
    5   HG13  ILE  59          HG13      ILE  59   1.389 -15.428   2.694
    6   HG23  ILE  59          HG21      ILE  59   2.403 -15.240   6.351
    7   HG22  ILE  59          HG22      ILE  59   2.635 -16.820   5.638
    8   HG21  ILE  59          HG23      ILE  59   1.295 -16.531   6.746
    9   HD11  ILE  59          HD11      ILE  59   2.156 -13.427   4.009
   10   HD13  ILE  59          HD12      ILE  59   3.366 -14.061   2.897
   11   HD12  ILE  59          HD13      ILE  59   3.478 -14.419   4.621

  No H/Q in entry =          11
  In of MODEL   32
    1    H    GLU  60           H        GLU  60  -0.217 -17.934   6.789
    2    HA   GLU  60           HA       GLU  60   1.823 -19.899   6.499
    3    HB2  GLU  60           HB2      GLU  60   1.169 -19.206   8.708
    4    HB3  GLU  60           HB3      GLU  60  -0.505 -19.674   8.418
    5    HG2  GLU  60           HG2      GLU  60   1.690 -21.721   8.181
    6    HG3  GLU  60           HG3      GLU  60   1.047 -21.293   9.765

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLY  61           H        GLY  61  -1.692 -20.016   6.048
    2    HA3  GLY  61           HA2      GLY  61  -1.438 -22.804   5.079
    3    HA2  GLY  61           HA3      GLY  61  -2.921 -22.079   5.689

  No H/Q in entry =           3
  In of MODEL   32
    1    H    ASP  62           H        ASP  62  -0.722 -20.483   3.468
    2    HA   ASP  62           HA       ASP  62  -2.789 -19.823   1.646
    3    HB2  ASP  62           HB2      ASP  62  -0.884 -19.016   0.234
    4    HB3  ASP  62           HB3      ASP  62  -0.867 -18.391   1.879

  No H/Q in entry =           4
  In of MODEL   32
    1    H    ALA  63           H        ALA  63  -1.217 -22.777   2.052
    2    HA   ALA  63           HA       ALA  63  -1.104 -23.551  -0.754
    3    HB1  ALA  63           HB1      ALA  63  -0.723 -25.057   1.823
    4    HB3  ALA  63           HB2      ALA  63   0.498 -24.592   0.639
    5    HB2  ALA  63           HB3      ALA  63  -0.684 -25.840   0.243

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLY  64           H        GLY  64  -2.327 -25.552  -1.425
    2    HA3  GLY  64           HA2      GLY  64  -4.356 -26.932  -0.823
    3    HA2  GLY  64           HA3      GLY  64  -5.114 -25.391  -0.453

  No H/Q in entry =           3
  In of MODEL   32
    1    H    GLU  65           H        GLU  65  -4.217 -23.869  -2.651
    2    HA   GLU  65           HA       GLU  65  -6.106 -24.653  -4.599
    3    HB2  GLU  65           HB2      GLU  65  -3.888 -22.610  -4.695
    4    HB3  GLU  65           HB3      GLU  65  -5.095 -22.811  -5.967
    5    HG2  GLU  65           HG2      GLU  65  -6.897 -22.366  -4.377
    6    HG3  GLU  65           HG3      GLU  65  -5.734 -22.248  -3.059

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLY  66           H        GLY  66  -2.663 -25.034  -4.393
    2    HA3  GLY  66           HA2      GLY  66  -2.591 -27.205  -6.231
    3    HA2  GLY  66           HA3      GLY  66  -1.905 -25.755  -6.937

  No H/Q in entry =           3
  In of MODEL   32
    1    H    LYS  67           H        LYS  67  -0.044 -27.257  -7.065
    2    HA   LYS  67           HA       LYS  67   1.345 -28.299  -4.919
    3    HB2  LYS  67           HB2      LYS  67   2.337 -27.307  -7.587
    4    HB3  LYS  67           HB3      LYS  67   3.322 -28.244  -6.456
    5    HG2  LYS  67           HG2      LYS  67   1.646 -30.048  -6.470
    6    HG3  LYS  67           HG3      LYS  67   0.642 -29.117  -7.579
    7    HD2  LYS  67           HD2      LYS  67   2.429 -29.197  -9.276
    8    HD3  LYS  67           HD3      LYS  67   3.443 -30.120  -8.164
    9    HE2  LYS  67           HE2      LYS  67   1.756 -31.915  -8.097
   10    HE3  LYS  67           HE3      LYS  67   0.725 -30.993  -9.191
   11    HZ3  LYS  67           HZ1      LYS  67   1.923 -31.612 -10.943
   12    HZ2  LYS  67           HZ2      LYS  67   2.602 -32.800  -9.936
   13    HZ1  LYS  67           HZ3      LYS  67   3.402 -31.319 -10.168

  No H/Q in entry =          13
  In of MODEL   32
    1    H    MET  68           H        MET  68   2.646 -25.550  -6.672
    2    HA   MET  68           HA       MET  68   3.803 -24.475  -4.188
    3    HB2  MET  68           HB2      MET  68   4.565 -24.068  -7.081
    4    HB3  MET  68           HB3      MET  68   5.368 -23.303  -5.709
    5    HG2  MET  68           HG2      MET  68   5.098 -26.297  -6.115
    6    HG3  MET  68           HG3      MET  68   6.555 -25.358  -6.452
    7    HE1  MET  68           HE1      MET  68   7.858 -24.157  -5.044
    8    HE3  MET  68           HE2      MET  68   8.056 -24.328  -3.300
    9    HE2  MET  68           HE3      MET  68   6.816 -23.251  -3.938

  No H/Q in entry =           9
  In of MODEL   32
    1    H    LYS  69           H        LYS  69   1.193 -23.864  -6.162
    2    HA   LYS  69           HA       LYS  69   1.398 -20.996  -6.244
    3    HB2  LYS  69           HB2      LYS  69   0.294 -22.214  -8.048
    4    HB3  LYS  69           HB3      LYS  69  -0.974 -22.719  -6.925
    5    HG2  LYS  69           HG2      LYS  69  -1.576 -20.402  -6.486
    6    HG3  LYS  69           HG3      LYS  69  -0.243 -19.833  -7.491
    7    HD2  LYS  69           HD2      LYS  69  -1.266 -20.920  -9.460
    8    HD3  LYS  69           HD3      LYS  69  -2.606 -21.470  -8.453
    9    HE2  LYS  69           HE2      LYS  69  -3.176 -19.132  -7.918
   10    HE3  LYS  69           HE3      LYS  69  -1.830 -18.575  -8.912
   11    HZ2  LYS  69           HZ1      LYS  69  -4.015 -18.549 -10.050
   12    HZ1  LYS  69           HZ2      LYS  69  -4.060 -20.243  -9.933
   13    HZ3  LYS  69           HZ3      LYS  69  -2.843 -19.484 -10.845

  No H/Q in entry =          13
  In of MODEL   32
    1    H    VAL  70           H        VAL  70   0.027 -19.443  -5.311
    2    HA   VAL  70           HA       VAL  70  -1.357 -20.295  -2.828
    3    HB   VAL  70           HB       VAL  70  -0.618 -18.118  -1.848
    4   HG13  VAL  70          HG11      VAL  70   1.655 -18.819  -1.378
    5   HG12  VAL  70          HG12      VAL  70   1.694 -19.804  -2.842
    6   HG11  VAL  70          HG13      VAL  70   0.644 -20.260  -1.500
    7   HG23  VAL  70          HG21      VAL  70   1.331 -16.975  -3.048
    8   HG22  VAL  70          HG22      VAL  70  -0.244 -16.775  -3.813
    9   HG21  VAL  70          HG23      VAL  70   0.910 -17.933  -4.470

  No H/Q in entry =           9
  In of MODEL   32
    1    H    SER  71           H        SER  71  -2.926 -18.626  -2.077
    2    HA   SER  71           HA       SER  71  -4.864 -18.034  -4.041
    3    HB2  SER  71           HB2      SER  71  -5.347 -18.257  -1.588
    4    HB3  SER  71           HB3      SER  71  -4.518 -16.729  -1.317
    5    HG   SER  71           HG       SER  71  -6.787 -16.476  -1.556

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU  72           H        LEU  72  -5.109 -16.366  -5.372
    2    HA   LEU  72           HA       LEU  72  -3.019 -14.539  -5.871
    3    HB2  LEU  72           HB2      LEU  72  -5.894 -14.604  -6.783
    4    HB3  LEU  72           HB3      LEU  72  -4.706 -13.443  -7.373
    5    HG   LEU  72           HG       LEU  72  -4.296 -16.449  -7.510
    6   HD13  LEU  72          HD11      LEU  72  -4.985 -16.324  -9.836
    7   HD12  LEU  72          HD12      LEU  72  -5.215 -14.580  -9.714
    8   HD11  LEU  72          HD13      LEU  72  -6.283 -15.673  -8.835
    9   HD22  LEU  72          HD21      LEU  72  -2.184 -15.453  -7.781
   10   HD21  LEU  72          HD22      LEU  72  -2.833 -14.032  -8.584
   11   HD23  LEU  72          HD23      LEU  72  -2.750 -15.566  -9.444

  No H/Q in entry =          11
  In of MODEL   32
    1    H    VAL  73           H        VAL  73  -6.096 -14.208  -4.205
    2    HA   VAL  73           HA       VAL  73  -6.156 -11.439  -3.844
    3    HB   VAL  73           HB       VAL  73  -7.846 -11.816  -2.231
    4   HG12  VAL  73          HG11      VAL  73  -7.901 -14.190  -4.114
    5   HG11  VAL  73          HG12      VAL  73  -8.326 -12.546  -4.584
    6   HG13  VAL  73          HG13      VAL  73  -9.290 -13.394  -3.375
    7   HG22  VAL  73          HG21      VAL  73  -7.012 -13.271  -0.624
    8   HG21  VAL  73          HG22      VAL  73  -6.373 -14.394  -1.824
    9   HG23  VAL  73          HG23      VAL  73  -8.104 -14.351  -1.488

  No H/Q in entry =           9
  In of MODEL   32
    1    H    LEU  74           H        LEU  74  -4.184 -13.799  -2.291
    2    HA   LEU  74           HA       LEU  74  -3.753 -12.664   0.231
    3    HB2  LEU  74           HB2      LEU  74  -2.961 -14.876  -0.290
    4    HB3  LEU  74           HB3      LEU  74  -1.919 -14.248  -1.566
    5    HG   LEU  74           HG       LEU  74  -0.607 -13.002   0.113
    6   HD11  LEU  74          HD11      LEU  74  -2.680 -14.190   1.962
    7   HD13  LEU  74          HD12      LEU  74  -2.143 -12.512   1.852
    8   HD12  LEU  74          HD13      LEU  74  -1.083 -13.734   2.556
    9   HD23  LEU  74          HD21      LEU  74  -0.808 -15.760   1.209
   10   HD22  LEU  74          HD22      LEU  74   0.593 -14.833   0.724
   11   HD21  LEU  74          HD23      LEU  74  -0.413 -15.573  -0.498

  No H/Q in entry =          11
  In of MODEL   32
    1    H    VAL  75           H        VAL  75  -1.898 -12.247  -2.746
    2    HA   VAL  75           HA       VAL  75  -0.102 -10.314  -1.749
    3    HB   VAL  75           HB       VAL  75  -1.086 -10.798  -4.562
    4   HG11  VAL  75          HG11      VAL  75   1.181  -9.052  -3.506
    5   HG13  VAL  75          HG12      VAL  75  -0.248  -8.503  -4.369
    6   HG12  VAL  75          HG13      VAL  75   0.955  -9.477  -5.198
    7   HG21  VAL  75          HG21      VAL  75   1.362 -11.629  -2.969
    8   HG23  VAL  75          HG22      VAL  75   1.239 -11.810  -4.719
    9   HG22  VAL  75          HG23      VAL  75   0.133 -12.688  -3.662

  No H/Q in entry =           9
  In of MODEL   32
    1    H    GLU  76           H        GLU  76  -3.274  -9.983  -3.370
    2    HA   GLU  76           HA       GLU  76  -3.346  -7.168  -3.460
    3    HB2  GLU  76           HB2      GLU  76  -5.004  -8.659  -4.594
    4    HB3  GLU  76           HB3      GLU  76  -5.661  -9.091  -3.023
    5    HG2  GLU  76           HG2      GLU  76  -6.262  -6.712  -2.630
    6    HG3  GLU  76           HG3      GLU  76  -5.670  -6.295  -4.226

  No H/Q in entry =           6
  In of MODEL   32
    1    H    ALA  77           H        ALA  77  -4.412  -9.413  -0.916
    2    HA   ALA  77           HA       ALA  77  -5.362  -7.423   0.861
    3    HB2  ALA  77           HB1      ALA  77  -5.758  -9.944   0.979
    4    HB3  ALA  77           HB2      ALA  77  -5.431  -9.131   2.509
    5    HB1  ALA  77           HB3      ALA  77  -4.159 -10.058   1.715

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLN  78           H        GLN  78  -2.209  -8.950   0.455
    2    HA   GLN  78           HA       GLN  78  -0.933  -7.790   2.695
    3    HB2  GLN  78           HB2      GLN  78  -0.076  -9.720   1.319
    4    HB3  GLN  78           HB3      GLN  78   0.341  -8.565   0.057
    5    HG2  GLN  78           HG2      GLN  78   1.806  -7.368   1.638
    6    HG3  GLN  78           HG3      GLN  78   1.396  -8.531   2.898
    7   HE21  GLN  78          HE21      GLN  78   4.106  -8.225   2.039
    8   HE22  GLN  78          HE22      GLN  78   4.574  -9.639   1.226

  No H/Q in entry =           8
  In of MODEL   32
    1    H    LEU  79           H        LEU  79  -1.344  -6.720  -0.644
    2    HA   LEU  79           HA       LEU  79   0.328  -4.482  -0.642
    3    HB2  LEU  79           HB2      LEU  79  -0.717  -5.288  -2.687
    4    HB3  LEU  79           HB3      LEU  79  -2.316  -4.908  -2.058
    5    HG   LEU  79           HG       LEU  79  -1.786  -2.518  -2.031
    6   HD13  LEU  79          HD11      LEU  79   0.459  -2.263  -1.543
    7   HD12  LEU  79          HD12      LEU  79   0.486  -1.969  -3.281
    8   HD11  LEU  79          HD13      LEU  79   0.957  -3.546  -2.646
    9   HD23  LEU  79          HD21      LEU  79  -1.182  -2.306  -4.589
   10   HD22  LEU  79          HD22      LEU  79  -2.698  -3.065  -4.115
   11   HD21  LEU  79          HD23      LEU  79  -1.325  -4.064  -4.579

  No H/Q in entry =          11
  In of MODEL   32
    1    H    HIS  80           H        HIS  80  -3.128  -4.668   0.223
    2    HA   HIS  80           HA       HIS  80  -3.327  -1.915   0.899
    3    HB2  HIS  80           HB2      HIS  80  -5.011  -4.334   1.228
    4    HB3  HIS  80           HB3      HIS  80  -5.327  -3.000   2.341
    5    HD1  HIS  80           HD1      HIS  80  -6.963  -1.369   1.457
    6    HD2  HIS  80           HD2      HIS  80  -4.796  -3.158  -1.622
    7    HE1  HIS  80           HE1      HIS  80  -7.834  -0.369  -0.709
    8    HE2  HIS  80           HE2      HIS  80  -6.519  -1.454  -2.594

  No H/Q in entry =           8
  In of MODEL   32
    1    H    LEU  81           H        LEU  81  -2.800  -4.814   2.876
    2    HA   LEU  81           HA       LEU  81  -2.766  -3.475   5.365
    3    HB2  LEU  81           HB2      LEU  81  -1.544  -6.082   4.462
    4    HB3  LEU  81           HB3      LEU  81  -1.502  -5.529   6.137
    5    HG   LEU  81           HG       LEU  81  -4.065  -5.789   4.538
    6   HD12  LEU  81          HD11      LEU  81  -4.339  -7.862   6.081
    7   HD11  LEU  81          HD12      LEU  81  -2.585  -7.783   6.247
    8   HD13  LEU  81          HD13      LEU  81  -3.311  -8.011   4.656
    9   HD23  LEU  81          HD21      LEU  81  -4.878  -6.005   7.047
   10   HD22  LEU  81          HD22      LEU  81  -4.569  -4.413   6.359
   11   HD21  LEU  81          HD23      LEU  81  -3.367  -5.170   7.403

  No H/Q in entry =          11
  In of MODEL   32
    1    H    MET  82           H        MET  82  -0.106  -4.358   3.160
    2    HA   MET  82           HA       MET  82   1.992  -3.459   4.823
    3    HB2  MET  82           HB2      MET  82   1.745  -3.791   1.832
    4    HB3  MET  82           HB3      MET  82   3.232  -3.216   2.581
    5    HG2  MET  82           HG2      MET  82   1.846  -5.814   3.312
    6    HG3  MET  82           HG3      MET  82   3.205  -5.694   2.197
    7    HE3  MET  82           HE1      MET  82   6.239  -4.951   4.148
    8    HE2  MET  82           HE2      MET  82   5.303  -3.585   3.546
    9    HE1  MET  82           HE3      MET  82   5.388  -5.072   2.604

  No H/Q in entry =           9
  In of MODEL   32
    1    H    THR  83           H        THR  83   0.133  -1.817   2.293
    2    HA   THR  83           HA       THR  83   1.535   0.638   2.372
    3    HB   THR  83           HB       THR  83  -0.657   1.556   1.414
    4    HG1  THR  83           HG1      THR  83  -2.303   0.252   1.322
    5   HG22  THR  83          HG21      THR  83  -0.401  -0.254  -0.596
    6   HG21  THR  83          HG22      THR  83   1.110  -0.542   0.263
    7   HG23  THR  83          HG23      THR  83   0.735   1.071  -0.342

  No H/Q in entry =           7
  In of MODEL   32
    1    H    SER  84           H        SER  84  -1.448  -0.414   4.004
    2    HA   SER  84           HA       SER  84  -1.940   2.009   5.363
    3    HB2  SER  84           HB2      SER  84  -2.753  -0.834   5.927
    4    HB3  SER  84           HB3      SER  84  -3.241   0.501   6.970
    5    HG   SER  84           HG       SER  84  -3.730   0.195   4.182

  No H/Q in entry =           5
  In of MODEL   32
    1    H    MET  85           H        MET  85  -0.204  -0.919   6.462
    2    HA   MET  85           HA       MET  85   0.342   0.001   9.064
    3    HB2  MET  85           HB2      MET  85   0.636  -2.338   8.380
    4    HB3  MET  85           HB3      MET  85   2.000  -1.868   7.364
    5    HG2  MET  85           HG2      MET  85   3.211  -1.042   9.339
    6    HG3  MET  85           HG3      MET  85   1.836  -1.452  10.365
    7    HE2  MET  85           HE1      MET  85   4.884  -4.060   8.300
    8    HE1  MET  85           HE2      MET  85   4.284  -2.467   7.844
    9    HE3  MET  85           HE3      MET  85   3.417  -3.909   7.328

  No H/Q in entry =           9
  In of MODEL   32
    1    H    LEU  86           H        LEU  86   2.241   0.275   6.091
    2    HA   LEU  86           HA       LEU  86   4.463   1.591   7.225
    3    HB2  LEU  86           HB2      LEU  86   4.249   0.515   4.916
    4    HB3  LEU  86           HB3      LEU  86   3.429   1.995   4.417
    5    HG   LEU  86           HG       LEU  86   5.464   3.246   5.378
    6   HD11  LEU  86          HD11      LEU  86   6.189   0.635   6.161
    7   HD13  LEU  86          HD12      LEU  86   7.188   2.084   6.252
    8   HD12  LEU  86          HD13      LEU  86   7.284   1.040   4.836
    9   HD23  LEU  86          HD21      LEU  86   6.160   1.494   3.014
   10   HD22  LEU  86          HD22      LEU  86   6.550   3.192   3.277
   11   HD21  LEU  86          HD23      LEU  86   4.895   2.718   2.896

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ALA  87           H        ALA  87   1.528   2.828   5.679
    2    HA   ALA  87           HA       ALA  87   2.112   5.560   5.764
    3    HB1  ALA  87           HB1      ALA  87  -0.197   3.924   5.245
    4    HB3  ALA  87           HB2      ALA  87   0.102   5.588   4.747
    5    HB2  ALA  87           HB3      ALA  87  -0.673   5.259   6.298

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ARG  88           H        ARG  88   0.458   3.544   8.168
    2    HA   ARG  88           HA       ARG  88  -0.040   5.585  10.027
    3    HB2  ARG  88           HB2      ARG  88  -0.969   3.229  10.096
    4    HB3  ARG  88           HB3      ARG  88   0.582   2.733  10.783
    5    HG2  ARG  88           HG2      ARG  88   0.116   4.800  12.415
    6    HG3  ARG  88           HG3      ARG  88  -1.554   4.470  11.977
    7    HD2  ARG  88           HD2      ARG  88  -1.640   2.616  13.219
    8    HD3  ARG  88           HD3      ARG  88  -0.054   2.043  12.668
    9    HE   ARG  88           HE       ARG  88  -0.565   3.296  15.132
   10   HH21  ARG  88          HH11      ARG  88   1.004   4.311  16.355
   11   HH22  ARG  88          HH12      ARG  88   2.513   4.746  15.634
   12   HH11  ARG  88          HH21      ARG  88   1.685   3.495  12.529
   13   HH12  ARG  88          HH22      ARG  88   2.907   4.268  13.480

  No H/Q in entry =          13
  In of MODEL   32
    1    H    GLU  89           H        GLU  89   2.762   3.379   9.764
    2    HA   GLU  89           HA       GLU  89   4.047   4.266  12.096
    3    HB2  GLU  89           HB2      GLU  89   4.699   2.254  10.739
    4    HB3  GLU  89           HB3      GLU  89   5.457   3.355   9.586
    5    HG2  GLU  89           HG2      GLU  89   6.958   4.203  11.316
    6    HG3  GLU  89           HG3      GLU  89   6.142   3.240  12.542

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LEU  90           H        LEU  90   4.321   5.435   8.769
    2    HA   LEU  90           HA       LEU  90   6.249   7.442   9.338
    3    HB2  LEU  90           HB2      LEU  90   4.219   7.109   7.133
    4    HB3  LEU  90           HB3      LEU  90   5.443   8.385   7.144
    5    HG   LEU  90           HG       LEU  90   6.134   5.450   7.461
    6   HD12  LEU  90          HD11      LEU  90   6.853   5.695   5.013
    7   HD11  LEU  90          HD12      LEU  90   5.831   7.131   4.981
    8   HD13  LEU  90          HD13      LEU  90   5.122   5.553   5.327
    9   HD22  LEU  90          HD21      LEU  90   8.034   6.607   8.124
   10   HD21  LEU  90          HD22      LEU  90   7.666   8.013   7.126
   11   HD23  LEU  90          HD23      LEU  90   8.324   6.554   6.387

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  91           H        ILE  91   2.708   7.441   9.230
    2    HA   ILE  91           HA       ILE  91   2.357  10.211   9.693
    3    HB   ILE  91           HB       ILE  91   0.585   7.825  10.249
    4   HG12  ILE  91          HG12      ILE  91   0.302  10.111   8.274
    5   HG13  ILE  91          HG13      ILE  91   1.165   8.622   7.887
    6   HG22  ILE  91          HG21      ILE  91  -1.157   9.874  10.338
    7   HG21  ILE  91          HG22      ILE  91   0.247  10.709  10.997
    8   HG23  ILE  91          HG23      ILE  91  -0.373   9.266  11.797
    9   HD13  ILE  91          HD11      ILE  91  -0.772   7.324   7.950
   10   HD12  ILE  91          HD12      ILE  91  -1.377   8.838   7.280
   11   HD11  ILE  91          HD13      ILE  91  -1.626   8.468   8.986

  No H/Q in entry =          11
  In of MODEL   32
    1    H    THR  92           H        THR  92   2.800   7.465  11.881
    2    HA   THR  92           HA       THR  92   2.377   8.829  14.314
    3    HB   THR  92           HB       THR  92   4.190   6.506  13.621
    4    HG1  THR  92           HG1      THR  92   2.225   5.739  13.541
    5   HG22  THR  92          HG21      THR  92   3.839   6.212  16.259
    6   HG21  THR  92          HG22      THR  92   3.763   7.971  16.191
    7   HG23  THR  92          HG23      THR  92   5.195   7.125  15.600

  No H/Q in entry =           7
  In of MODEL   32
    1    H    GLU  93           H        GLU  93   5.308   8.402  12.346
    2    HA   GLU  93           HA       GLU  93   7.073   9.835  14.027
    3    HB2  GLU  93           HB2      GLU  93   7.129   9.529  11.010
    4    HB3  GLU  93           HB3      GLU  93   8.478  10.064  12.011
    5    HG2  GLU  93           HG2      GLU  93   7.089   7.418  12.466
    6    HG3  GLU  93           HG3      GLU  93   8.459   7.581  11.375

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LEU  94           H        LEU  94   4.988  10.845  11.340
    2    HA   LEU  94           HA       LEU  94   5.775  13.554  11.238
    3    HB2  LEU  94           HB2      LEU  94   3.185  12.175  10.510
    4    HB3  LEU  94           HB3      LEU  94   3.430  13.905  10.270
    5    HG   LEU  94           HG       LEU  94   5.448  11.932   9.192
    6   HD11  LEU  94          HD11      LEU  94   2.691  12.468   8.162
    7   HD13  LEU  94          HD12      LEU  94   3.682  11.019   8.021
    8   HD12  LEU  94          HD13      LEU  94   3.996  12.404   6.977
    9   HD23  LEU  94          HD21      LEU  94   5.667  13.775   7.472
   10   HD22  LEU  94          HD22      LEU  94   6.097  14.265   9.110
   11   HD21  LEU  94          HD23      LEU  94   4.535  14.725   8.430

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  95           H        ILE  95   3.269  11.916  13.153
    2    HA   ILE  95           HA       ILE  95   2.224  14.255  14.366
    3    HB   ILE  95           HB       ILE  95   2.271  11.371  15.283
    4   HG12  ILE  95          HG12      ILE  95   0.027  13.133  14.263
    5   HG13  ILE  95          HG13      ILE  95   0.979  12.083  13.218
    6   HG21  ILE  95          HG21      ILE  95   0.986  13.832  16.505
    7   HG23  ILE  95          HG22      ILE  95   2.050  12.668  17.295
    8   HG22  ILE  95          HG23      ILE  95   0.413  12.197  16.837
    9   HD13  ILE  95          HD11      ILE  95   0.099  10.136  14.142
   10   HD12  ILE  95          HD12      ILE  95  -1.289  11.215  14.236
   11   HD11  ILE  95          HD13      ILE  95  -0.306  10.920  15.669

  No H/Q in entry =          11
  In of MODEL   32
    1    H    GLU  96           H        GLU  96   4.846  12.052  15.327
    2    HA   GLU  96           HA       GLU  96   5.420  13.248  17.816
    3    HB2  GLU  96           HB2      GLU  96   6.376  11.097  17.152
    4    HB3  GLU  96           HB3      GLU  96   7.289  11.881  15.864
    5    HG2  GLU  96           HG2      GLU  96   8.950  12.437  17.309
    6    HG3  GLU  96           HG3      GLU  96   7.809  13.239  18.379

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LEU  97           H        LEU  97   6.452  14.036  14.520
    2    HA   LEU  97           HA       LEU  97   8.332  16.044  15.217
    3    HB2  LEU  97           HB2      LEU  97   6.717  15.490  12.738
    4    HB3  LEU  97           HB3      LEU  97   7.727  16.929  12.852
    5    HG   LEU  97           HG       LEU  97   8.783  14.137  13.393
    6   HD12  LEU  97          HD11      LEU  97   9.752  14.345  11.066
    7   HD11  LEU  97          HD12      LEU  97   8.688  15.728  10.818
    8   HD13  LEU  97          HD13      LEU  97   8.004  14.130  11.116
    9   HD23  LEU  97          HD21      LEU  97  10.934  15.434  12.630
   10   HD22  LEU  97          HD22      LEU  97  10.331  15.695  14.266
   11   HD21  LEU  97          HD23      LEU  97   9.994  16.879  13.005

  No H/Q in entry =          11
  In of MODEL   32
    1    H    HIS  98           H        HIS  98   4.832  16.155  14.601
    2    HA   HIS  98           HA       HIS  98   4.513  18.952  14.747
    3    HB2  HIS  98           HB2      HIS  98   2.648  16.685  15.488
    4    HB3  HIS  98           HB3      HIS  98   2.169  18.381  15.553
    5    HD1  HIS  98           HD1      HIS  98   3.185  15.681  13.130
    6    HD2  HIS  98           HD2      HIS  98   1.777  19.603  13.033
    7    HE1  HIS  98           HE1      HIS  98   2.595  16.171  10.714
    8    HE2  HIS  98           HE2      HIS  98   1.741  18.554  10.634

  No H/Q in entry =           8
  In of MODEL   32
    1    H    GLU  99           H        GLU  99   4.693  16.458  17.238
    2    HA   GLU  99           HA       GLU  99   4.096  18.141  19.447
    3    HB2  GLU  99           HB2      GLU  99   4.027  15.659  19.538
    4    HB3  GLU  99           HB3      GLU  99   5.786  15.628  19.411
    5    HG2  GLU  99           HG2      GLU  99   5.988  16.916  21.486
    6    HG3  GLU  99           HG3      GLU  99   4.235  17.043  21.601

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LYS 100           H        LYS 100   7.139  17.239  17.846
    2    HA   LYS 100           HA       LYS 100   8.804  18.648  19.688
    3    HB2  LYS 100           HB2      LYS 100   9.278  17.735  16.842
    4    HB3  LYS 100           HB3      LYS 100  10.513  18.511  17.838
    5    HG2  LYS 100           HG2      LYS 100  10.170  16.753  19.579
    6    HG3  LYS 100           HG3      LYS 100   9.032  15.943  18.498
    7    HD2  LYS 100           HD2      LYS 100  10.810  15.679  16.810
    8    HD3  LYS 100           HD3      LYS 100  11.952  16.501  17.876
    9    HE2  LYS 100           HE2      LYS 100  11.589  14.738  19.594
   10    HE3  LYS 100           HE3      LYS 100  10.508  13.897  18.478
   11    HZ1  LYS 100           HZ1      LYS 100  13.316  14.590  17.794
   12    HZ3  LYS 100           HZ2      LYS 100  12.271  13.529  16.974
   13    HZ2  LYS 100           HZ3      LYS 100  12.880  13.110  18.505

  No H/Q in entry =          13
  In of MODEL   32
    1    H    LEU 101           H        LEU 101   7.070  19.569  16.754
    2    HA   LEU 101           HA       LEU 101   8.261  22.136  16.413
    3    HB2  LEU 101           HB2      LEU 101   5.665  20.885  15.551
    4    HB3  LEU 101           HB3      LEU 101   5.901  22.618  15.346
    5    HG   LEU 101           HG       LEU 101   7.942  20.621  14.352
    6   HD12  LEU 101          HD11      LEU 101   6.759  21.124  12.082
    7   HD11  LEU 101          HD12      LEU 101   5.367  21.540  13.079
    8   HD13  LEU 101          HD13      LEU 101   6.045  19.915  13.148
    9   HD21  LEU 101          HD21      LEU 101   7.285  23.529  13.812
   10   HD23  LEU 101          HD22      LEU 101   8.261  22.580  12.692
   11   HD22  LEU 101          HD23      LEU 101   8.819  22.837  14.344

  No H/Q in entry =          11
  In of MODEL   32
    1    H    LYS 102           H        LYS 102   6.762  20.979  19.042
    2    HA   LYS 102           HA       LYS 102   6.142  22.061  20.984
    3    HB2  LYS 102           HB2      LYS 102   7.397  24.064  19.852
    4    HB3  LYS 102           HB3      LYS 102   5.790  24.657  19.495
    5    HG2  LYS 102           HG2      LYS 102   7.198  24.405  22.131
    6    HG3  LYS 102           HG3      LYS 102   6.228  25.728  21.517
    7    HD2  LYS 102           HD2      LYS 102   5.014  23.080  22.402
    8    HD3  LYS 102           HD3      LYS 102   5.265  24.440  23.486
    9    HE2  LYS 102           HE2      LYS 102   2.972  24.024  22.021
   10    HE3  LYS 102           HE3      LYS 102   3.471  25.571  22.702
   11    HZ2  LYS 102           HZ1      LYS 102   2.913  25.682  20.329
   12    HZ1  LYS 102           HZ2      LYS 102   4.179  24.610  19.989
   13    HZ3  LYS 102           HZ3      LYS 102   4.518  26.142  20.632

  No H/Q in entry =          13
  In of MODEL   32
    1    H    ALA 103           H        ALA 103   4.462  23.599  18.240
    2    HA   ALA 103           HA       ALA 103   2.014  24.155  19.153
    3    HB1  ALA 103           HB1      ALA 103   1.097  23.313  16.919
    4    HB2  ALA 103           HB2      ALA 103   2.744  22.789  16.569
    5    HB3  ALA 103           HB3      ALA 103   2.400  24.498  16.844

  No H/Q in entry =           5
  In of MODEL   32
    1    H1   ALA   1           H3       ALA   1  10.658 -20.209  -6.344
    2    H2   ALA   1           H2       ALA   1   9.680 -20.418  -7.720
    3    H3   ALA   1           H1       ALA   1   9.264 -21.171  -6.254
    4    HA   ALA   1           HA       ALA   1  10.308 -22.971  -7.010
    5    HB1  ALA   1           HB1      ALA   1  10.375 -22.604  -9.286
    6    HB2  ALA   1           HB2      ALA   1  12.105 -22.443  -8.976
    7    HB3  ALA   1           HB3      ALA   1  11.095 -21.003  -9.111

  No H/Q in entry =           7
  In of MODEL   32
    1    H    GLU   2           H        GLU   2  12.597 -23.906  -7.097
    2    HA   GLU   2           HA       GLU   2  14.003 -23.821  -4.900
    3    HB2  GLU   2           HB2      GLU   2  15.327 -23.673  -7.614
    4    HB3  GLU   2           HB3      GLU   2  16.076 -24.283  -6.139
    5    HG2  GLU   2           HG2      GLU   2  15.070 -26.306  -6.375
    6    HG3  GLU   2           HG3      GLU   2  13.491 -25.570  -6.614

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLU   3           H        GLU   3  15.734 -21.938  -7.316
    2    HA   GLU   3           HA       GLU   3  16.899 -20.249  -5.365
    3    HB2  GLU   3           HB2      GLU   3  16.809 -20.238  -8.374
    4    HB3  GLU   3           HB3      GLU   3  17.556 -18.907  -7.491
    5    HG2  GLU   3           HG2      GLU   3  19.237 -20.273  -6.592
    6    HG3  GLU   3           HG3      GLU   3  18.298 -21.746  -6.806

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LEU   4           H        LEU   4  14.581 -19.408  -7.967
    2    HA   LEU   4           HA       LEU   4  14.105 -16.805  -7.342
    3    HB2  LEU   4           HB2      LEU   4  11.935 -18.791  -8.054
    4    HB3  LEU   4           HB3      LEU   4  11.846 -17.042  -8.246
    5    HG   LEU   4           HG       LEU   4  13.807 -18.889  -9.647
    6   HD13  LEU   4          HD11      LEU   4  12.482 -18.742 -11.542
    7   HD12  LEU   4          HD12      LEU   4  11.770 -17.204 -11.062
    8   HD11  LEU   4          HD13      LEU   4  11.234 -18.700 -10.299
    9   HD23  LEU   4          HD21      LEU   4  14.113 -16.637 -10.996
   10   HD22  LEU   4          HD22      LEU   4  14.992 -16.879  -9.487
   11   HD21  LEU   4          HD23      LEU   4  13.532 -15.892  -9.506

  No H/Q in entry =          11
  In of MODEL   32
    1    H    GLU   5           H        GLU   5  12.657 -19.603  -5.692
    2    HA   GLU   5           HA       GLU   5  10.989 -18.047  -3.965
    3    HB2  GLU   5           HB2      GLU   5  10.598 -20.440  -4.503
    4    HB3  GLU   5           HB3      GLU   5  12.022 -20.851  -3.545
    5    HG2  GLU   5           HG2      GLU   5  10.109 -21.098  -2.106
    6    HG3  GLU   5           HG3      GLU   5  10.957 -19.636  -1.605

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLU   6           H        GLU   6  14.151 -19.608  -3.563
    2    HA   GLU   6           HA       GLU   6  14.529 -18.757  -0.866
    3    HB2  GLU   6           HB2      GLU   6  15.754 -20.661  -1.890
    4    HB3  GLU   6           HB3      GLU   6  16.606 -19.521  -2.934
    5    HG2  GLU   6           HG2      GLU   6  17.513 -18.376  -0.947
    6    HG3  GLU   6           HG3      GLU   6  16.665 -19.513   0.098

  No H/Q in entry =           6
  In of MODEL   32
    1    H    VAL   7           H        VAL   7  15.249 -17.416  -4.021
    2    HA   VAL   7           HA       VAL   7  16.931 -15.280  -3.169
    3    HB   VAL   7           HB       VAL   7  15.199 -15.648  -5.628
    4   HG11  VAL   7          HG11      VAL   7  17.086 -13.425  -4.831
    5   HG13  VAL   7          HG12      VAL   7  15.436 -13.292  -5.435
    6   HG12  VAL   7          HG13      VAL   7  16.736 -13.782  -6.521
    7   HG21  VAL   7          HG21      VAL   7  17.322 -17.092  -5.088
    8   HG23  VAL   7          HG22      VAL   7  18.213 -15.624  -5.492
    9   HG22  VAL   7          HG23      VAL   7  17.168 -16.377  -6.693

  No H/Q in entry =           9
  In of MODEL   32
    1    H    VAL   8           H        VAL   8  13.434 -15.573  -3.687
    2    HA   VAL   8           HA       VAL   8  12.755 -12.871  -3.199
    3    HB   VAL   8           HB       VAL   8  11.170 -15.416  -2.765
    4   HG13  VAL   8          HG11      VAL   8  10.130 -13.805  -1.367
    5   HG12  VAL   8          HG12      VAL   8   9.210 -13.738  -2.871
    6   HG11  VAL   8          HG13      VAL   8  10.414 -12.500  -2.520
    7   HG23  VAL   8          HG21      VAL   8  10.449 -13.487  -4.912
    8   HG22  VAL   8          HG22      VAL   8  10.538 -15.245  -4.965
    9   HG21  VAL   8          HG23      VAL   8  12.004 -14.287  -5.138

  No H/Q in entry =           9
  In of MODEL   32
    1    H    MET   9           H        MET   9  13.067 -15.681  -1.031
    2    HA   MET   9           HA       MET   9  12.269 -14.422   1.352
    3    HB2  MET   9           HB2      MET   9  14.148 -16.699   0.757
    4    HB3  MET   9           HB3      MET   9  13.945 -16.106   2.406
    5    HG2  MET   9           HG2      MET   9  11.410 -16.353   1.986
    6    HG3  MET   9           HG3      MET   9  11.870 -17.329   0.590
    7    HE1  MET   9           HE1      MET   9  12.837 -19.393   0.496
    8    HE3  MET   9           HE2      MET   9  13.338 -20.469   1.798
    9    HE2  MET   9           HE3      MET   9  14.354 -19.099   1.356

  No H/Q in entry =           9
  In of MODEL   32
    1    H    GLY  10           H        GLY  10  15.434 -14.618  -0.241
    2    HA3  GLY  10           HA2      GLY  10  16.904 -13.192   1.716
    3    HA2  GLY  10           HA3      GLY  10  17.349 -13.349   0.017

  No H/Q in entry =           3
  In of MODEL   32
    1    H    LEU  11           H        LEU  11  15.158 -12.141  -1.194
    2    HA   LEU  11           HA       LEU  11  15.823  -9.391  -1.030
    3    HB2  LEU  11           HB2      LEU  11  13.453 -10.816  -2.242
    4    HB3  LEU  11           HB3      LEU  11  13.717  -9.079  -2.400
    5    HG   LEU  11           HG       LEU  11  15.752 -11.169  -3.217
    6   HD13  LEU  11          HD11      LEU  11  13.992 -11.545  -4.718
    7   HD12  LEU  11          HD12      LEU  11  14.976 -10.353  -5.566
    8   HD11  LEU  11          HD13      LEU  11  13.508  -9.849  -4.730
    9   HD22  LEU  11          HD21      LEU  11  16.971  -9.196  -2.999
   10   HD21  LEU  11          HD22      LEU  11  15.583  -8.170  -3.359
   11   HD23  LEU  11          HD23      LEU  11  16.407  -9.027  -4.660

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  12           H        ILE  12  13.084 -11.243   0.263
    2    HA   ILE  12           HA       ILE  12  11.684  -9.034   1.345
    3    HB   ILE  12           HB       ILE  12  11.757 -11.934   2.235
    4   HG12  ILE  12          HG12      ILE  12  10.967 -11.272  -0.148
    5   HG13  ILE  12          HG13      ILE  12   9.918 -12.309   0.799
    6   HG21  ILE  12          HG21      ILE  12   9.849  -9.690   2.966
    7   HG23  ILE  12          HG22      ILE  12  10.901 -10.582   4.065
    8   HG22  ILE  12          HG23      ILE  12   9.541 -11.394   3.291
    9   HD11  ILE  12          HD11      ILE  12   9.651  -9.301   0.537
   10   HD13  ILE  12          HD12      ILE  12   8.550 -10.373   1.401
   11   HD12  ILE  12          HD13      ILE  12   8.692 -10.482  -0.339

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  13           H        ILE  13  14.112 -11.222   2.717
    2    HA   ILE  13           HA       ILE  13  14.166 -10.050   5.300
    3    HB   ILE  13           HB       ILE  13  16.210 -11.609   3.703
    4   HG12  ILE  13          HG12      ILE  13  13.999 -12.636   4.537
    5   HG13  ILE  13          HG13      ILE  13  15.488 -13.493   4.924
    6   HG21  ILE  13          HG21      ILE  13  16.435 -10.339   6.404
    7   HG23  ILE  13          HG22      ILE  13  17.674 -10.572   5.179
    8   HG22  ILE  13          HG23      ILE  13  17.159 -11.929   6.179
    9   HD11  ILE  13          HD11      ILE  13  14.689 -11.484   6.947
   10   HD13  ILE  13          HD12      ILE  13  15.252 -13.139   7.155
   11   HD12  ILE  13          HD13      ILE  13  13.565 -12.829   6.761

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ASN  14           H        ASN  14  16.082  -9.493   2.362
    2    HA   ASN  14           HA       ASN  14  17.819  -7.537   3.410
    3    HB2  ASN  14           HB2      ASN  14  17.783  -8.797   1.091
    4    HB3  ASN  14           HB3      ASN  14  16.870  -7.387   0.568
    5   HD21  ASN  14          HD21      ASN  14  19.300  -7.699  -0.646
    6   HD22  ASN  14          HD22      ASN  14  20.439  -6.606  -0.028

  No H/Q in entry =           6
  In of MODEL   32
    1    H    SER  15           H        SER  15  14.686  -7.216   1.753
    2    HA   SER  15           HA       SER  15  14.546  -4.397   1.819
    3    HB2  SER  15           HB2      SER  15  12.210  -4.667   1.352
    4    HB3  SER  15           HB3      SER  15  13.013  -6.018   0.564
    5    HG   SER  15           HG       SER  15  11.256  -5.989   2.663

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLY  16           H        GLY  16  13.504  -6.875   4.128
    2    HA3  GLY  16           HA2      GLY  16  12.285  -5.145   6.004
    3    HA2  GLY  16           HA3      GLY  16  12.921  -6.747   6.354

  No H/Q in entry =           3
  In of MODEL   32
    1    H    GLN  17           H        GLN  17  15.621  -6.384   5.733
    2    HA   GLN  17           HA       GLN  17  16.591  -5.159   8.106
    3    HB2  GLN  17           HB2      GLN  17  17.980  -6.008   5.552
    4    HB3  GLN  17           HB3      GLN  17  18.848  -5.371   6.950
    5    HG2  GLN  17           HG2      GLN  17  17.942  -7.165   8.356
    6    HG3  GLN  17           HG3      GLN  17  17.017  -7.787   6.992
    7   HE21  GLN  17          HE21      GLN  17  19.886  -8.250   8.669
    8   HE22  GLN  17          HE22      GLN  17  20.783  -9.014   7.447

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ALA  18           H        ALA  18  16.354  -4.074   4.752
    2    HA   ALA  18           HA       ALA  18  17.766  -1.667   4.970
    3    HB2  ALA  18           HB1      ALA  18  16.639  -2.888   2.911
    4    HB3  ALA  18           HB2      ALA  18  16.884  -1.141   2.898
    5    HB1  ALA  18           HB3      ALA  18  15.296  -1.806   3.283

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ARG  19           H        ARG  19  14.277  -2.294   5.403
    2    HA   ARG  19           HA       ARG  19  13.588   0.346   6.134
    3    HB2  ARG  19           HB2      ARG  19  11.920  -1.422   5.560
    4    HB3  ARG  19           HB3      ARG  19  12.287  -2.221   7.091
    5    HG2  ARG  19           HG2      ARG  19  11.569  -0.241   8.344
    6    HG3  ARG  19           HG3      ARG  19  11.292   0.637   6.841
    7    HD2  ARG  19           HD2      ARG  19   9.169  -0.186   7.682
    8    HD3  ARG  19           HD3      ARG  19   9.581  -1.056   6.198
    9    HE   ARG  19           HE       ARG  19  10.580  -2.594   8.288
   10   HH21  ARG  19          HH11      ARG  19   9.359  -4.250   9.236
   11   HH22  ARG  19          HH12      ARG  19   7.638  -4.241   9.084
   12   HH11  ARG  19          HH21      ARG  19   7.560  -1.331   7.230
   13   HH12  ARG  19          HH22      ARG  19   6.619  -2.589   7.944

  No H/Q in entry =          13
  In of MODEL   32
    1    H    SER  20           H        SER  20  14.499  -2.480   8.075
    2    HA   SER  20           HA       SER  20  14.231  -1.391  10.618
    3    HB2  SER  20           HB2      SER  20  14.721  -3.709  10.489
    4    HB3  SER  20           HB3      SER  20  16.156  -3.430   9.506
    5    HG   SER  20           HG       SER  20  15.744  -3.050  12.255

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU  21           H        LEU  21  17.050  -1.292   8.452
    2    HA   LEU  21           HA       LEU  21  18.726   0.208  10.176
    3    HB2  LEU  21           HB2      LEU  21  18.674  -0.058   7.163
    4    HB3  LEU  21           HB3      LEU  21  19.928   0.817   8.038
    5    HG   LEU  21           HG       LEU  21  19.233  -2.084   8.581
    6   HD13  LEU  21          HD11      LEU  21  20.055  -1.991   6.324
    7   HD12  LEU  21          HD12      LEU  21  21.399  -2.522   7.333
    8   HD11  LEU  21          HD13      LEU  21  21.327  -0.853   6.771
    9   HD23  LEU  21          HD21      LEU  21  21.731  -1.883   9.442
   10   HD22  LEU  21          HD22      LEU  21  20.420  -1.332  10.480
   11   HD21  LEU  21          HD23      LEU  21  21.355  -0.166   9.558

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ALA  22           H        ALA  22  16.424   1.159   7.648
    2    HA   ALA  22           HA       ALA  22  16.933   3.923   7.664
    3    HB3  ALA  22           HB1      ALA  22  15.526   2.670   5.998
    4    HB2  ALA  22           HB2      ALA  22  14.809   4.174   6.576
    5    HB1  ALA  22           HB3      ALA  22  14.242   2.626   7.205

  No H/Q in entry =           5
  In of MODEL   32
    1    H    TYR  23           H        TYR  23  14.476   2.075   9.520
    2    HA   TYR  23           HA       TYR  23  13.505   4.297  10.987
    3    HB2  TYR  23           HB2      TYR  23  12.293   2.169  10.972
    4    HB3  TYR  23           HB3      TYR  23  13.642   1.372  11.782
    5    HD1  TYR  23           HD1      TYR  23  11.103   4.078  12.176
    6    HD2  TYR  23           HD2      TYR  23  13.867   1.438  14.137
    7    HE1  TYR  23           HE1      TYR  23  10.189   4.756  14.381
    8    HE2  TYR  23           HE2      TYR  23  12.953   2.116  16.340
    9    HH   TYR  23           HH       TYR  23  10.177   4.321  16.576

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ALA  24           H        ALA  24  16.181   2.048  11.589
    2    HA   ALA  24           HA       ALA  24  16.868   3.043  14.148
    3    HB1  ALA  24           HB1      ALA  24  18.242   1.265  13.963
    4    HB3  ALA  24           HB2      ALA  24  19.247   2.200  12.856
    5    HB2  ALA  24           HB3      ALA  24  17.957   1.180  12.225

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA  25           H        ALA  25  17.780   3.991  10.862
    2    HA   ALA  25           HA       ALA  25  19.712   5.944  11.492
    3    HB1  ALA  25           HB1      ALA  25  18.980   4.996   9.182
    4    HB3  ALA  25           HB2      ALA  25  19.465   6.688   9.275
    5    HB2  ALA  25           HB3      ALA  25  17.754   6.263   9.223

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU  26           H        LEU  26  16.191   6.138  11.170
    2    HA   LEU  26           HA       LEU  26  15.943   8.916  11.632
    3    HB2  LEU  26           HB2      LEU  26  14.084   7.664  10.720
    4    HB3  LEU  26           HB3      LEU  26  14.019   6.631  12.143
    5    HG   LEU  26           HG       LEU  26  13.408   8.579  13.536
    6   HD12  LEU  26          HD11      LEU  26  12.712  10.676  12.224
    7   HD11  LEU  26          HD12      LEU  26  13.685  10.037  10.902
    8   HD13  LEU  26          HD13      LEU  26  14.443  10.425  12.447
    9   HD21  LEU  26          HD21      LEU  26  11.709   8.256  11.043
   10   HD23  LEU  26          HD22      LEU  26  11.158   8.944  12.568
   11   HD22  LEU  26          HD23      LEU  26  11.626   7.247  12.487

  No H/Q in entry =          11
  In of MODEL   32
    1    H    LYS  27           H        LYS  27  15.886   6.129  13.817
    2    HA   LYS  27           HA       LYS  27  15.305   7.482  16.196
    3    HB2  LYS  27           HB2      LYS  27  15.355   5.008  15.923
    4    HB3  LYS  27           HB3      LYS  27  17.117   5.078  15.861
    5    HG2  LYS  27           HG2      LYS  27  17.182   6.057  18.113
    6    HG3  LYS  27           HG3      LYS  27  15.415   6.058  18.177
    7    HD2  LYS  27           HD2      LYS  27  15.411   3.592  17.933
    8    HD3  LYS  27           HD3      LYS  27  17.176   3.598  17.902
    9    HE2  LYS  27           HE2      LYS  27  17.225   4.580  20.162
   10    HE3  LYS  27           HE3      LYS  27  15.459   4.604  20.195
   11    HZ3  LYS  27           HZ1      LYS  27  16.278   2.656  21.331
   12    HZ2  LYS  27           HZ2      LYS  27  17.184   2.189  19.969
   13    HZ1  LYS  27           HZ3      LYS  27  15.485   2.179  19.908

  No H/Q in entry =          13
  In of MODEL   32
    1    H    GLN  28           H        GLN  28  18.410   6.934  14.569
    2    HA   GLN  28           HA       GLN  28  20.105   8.027  16.544
    3    HB2  GLN  28           HB2      GLN  28  20.361   7.994  13.526
    4    HB3  GLN  28           HB3      GLN  28  21.655   8.472  14.625
    5    HG2  GLN  28           HG2      GLN  28  20.259   5.782  14.669
    6    HG3  GLN  28           HG3      GLN  28  21.833   6.086  13.935
    7   HE21  GLN  28          HE21      GLN  28  20.705   4.640  16.574
    8   HE22  GLN  28          HE22      GLN  28  21.854   5.114  17.730

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ALA  29           H        ALA  29  18.311   9.502  13.876
    2    HA   ALA  29           HA       ALA  29  19.290  12.130  14.126
    3    HB2  ALA  29           HB1      ALA  29  17.570  12.757  12.675
    4    HB1  ALA  29           HB2      ALA  29  16.444  11.572  13.335
    5    HB3  ALA  29           HB3      ALA  29  17.767  11.044  12.296

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LYS  30           H        LYS  30  16.544  10.503  15.672
    2    HA   LYS  30           HA       LYS  30  15.525  12.743  17.047
    3    HB2  LYS  30           HB2      LYS  30  15.446   9.799  17.742
    4    HB3  LYS  30           HB3      LYS  30  14.579  11.040  18.649
    5    HG2  LYS  30           HG2      LYS  30  13.426  11.723  16.545
    6    HG3  LYS  30           HG3      LYS  30  14.232  10.396  15.706
    7    HD2  LYS  30           HD2      LYS  30  13.190   8.775  17.241
    8    HD3  LYS  30           HD3      LYS  30  12.394  10.091  18.104
    9    HE2  LYS  30           HE2      LYS  30  11.198  10.721  16.026
   10    HE3  LYS  30           HE3      LYS  30  11.975   9.376  15.183
   11    HZ2  LYS  30           HZ1      LYS  30   9.680   8.945  16.086
   12    HZ1  LYS  30           HZ2      LYS  30  10.364   8.998  17.646
   13    HZ3  LYS  30           HZ3      LYS  30  10.869   7.821  16.527

  No H/Q in entry =          13
  In of MODEL   32
    1    H    GLN  31           H        GLN  31  18.211  10.593  17.748
    2    HA   GLN  31           HA       GLN  31  18.560  11.601  20.442
    3    HB2  GLN  31           HB2      GLN  31  20.578  10.052  18.811
    4    HB3  GLN  31           HB3      GLN  31  20.461  10.169  20.567
    5    HG2  GLN  31           HG2      GLN  31  17.947   9.200  19.822
    6    HG3  GLN  31           HG3      GLN  31  19.044   8.368  18.727
    7   HE21  GLN  31          HE21      GLN  31  17.535   7.202  21.017
    8   HE22  GLN  31          HE22      GLN  31  18.707   6.547  22.052

  No H/Q in entry =           8
  In of MODEL   32
    1    H    GLY  32           H        GLY  32  19.036  12.932  17.475
    2    HA3  GLY  32           HA2      GLY  32  19.999  14.987  16.956
    3    HA2  GLY  32           HA3      GLY  32  20.773  14.992  18.536

  No H/Q in entry =           3
  In of MODEL   32
    1    H    ASP  33           H        ASP  33  21.199  12.109  16.745
    2    HA   ASP  33           HA       ASP  33  24.014  12.808  16.251
    3    HB2  ASP  33           HB2      ASP  33  22.527  10.180  16.375
    4    HB3  ASP  33           HB3      ASP  33  24.207  10.311  15.862

  No H/Q in entry =           4
  In of MODEL   32
    1    H    PHE  34           H        PHE  34  23.502  14.133  14.379
    2    HA   PHE  34           HA       PHE  34  22.136  13.146  12.103
    3    HB2  PHE  34           HB2      PHE  34  24.252  15.296  12.317
    4    HB3  PHE  34           HB3      PHE  34  23.254  15.003  10.895
    5    HD1  PHE  34           HD1      PHE  34  23.520  16.929  13.812
    6    HD2  PHE  34           HD2      PHE  34  20.634  14.798  11.451
    7    HE1  PHE  34           HE1      PHE  34  21.703  18.309  14.783
    8    HE2  PHE  34           HE2      PHE  34  18.821  16.178  12.425
    9    HZ   PHE  34           HZ       PHE  34  19.359  17.934  14.087

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ALA  35           H        ALA  35  25.522  12.983  13.074
    2    HA   ALA  35           HA       ALA  35  26.608  12.178  10.603
    3    HB3  ALA  35           HB1      ALA  35  28.316  11.017  12.300
    4    HB2  ALA  35           HB2      ALA  35  27.457  12.032  13.458
    5    HB1  ALA  35           HB3      ALA  35  28.272  12.767  12.079

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA  36           H        ALA  36  25.538  10.205  13.374
    2    HA   ALA  36           HA       ALA  36  26.030   7.725  12.085
    3    HB2  ALA  36           HB1      ALA  36  25.628   6.969  14.162
    4    HB3  ALA  36           HB2      ALA  36  23.934   7.449  14.032
    5    HB1  ALA  36           HB3      ALA  36  25.132   8.589  14.645

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA  37           H        ALA  37  23.192   9.826  12.256
    2    HA   ALA  37           HA       ALA  37  21.338   8.044  11.094
    3    HB3  ALA  37           HB1      ALA  37  21.541  11.008  11.394
    4    HB1  ALA  37           HB2      ALA  37  20.244   9.916  11.877
    5    HB2  ALA  37           HB3      ALA  37  20.410  10.395  10.187

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LYS  38           H        LYS  38  23.399  10.529   9.601
    2    HA   LYS  38           HA       LYS  38  22.735  10.104   6.929
    3    HB2  LYS  38           HB2      LYS  38  24.546  11.673   8.360
    4    HB3  LYS  38           HB3      LYS  38  25.577  10.696   7.320
    5    HG2  LYS  38           HG2      LYS  38  24.384  11.462   5.339
    6    HG3  LYS  38           HG3      LYS  38  23.192  12.303   6.336
    7    HD2  LYS  38           HD2      LYS  38  24.780  13.913   7.076
    8    HD3  LYS  38           HD3      LYS  38  26.143  12.942   6.522
    9    HE2  LYS  38           HE2      LYS  38  25.753  14.814   4.981
   10    HE3  LYS  38           HE3      LYS  38  25.423  13.276   4.175
   11    HZ3  LYS  38           HZ1      LYS  38  23.221  13.701   4.070
   12    HZ2  LYS  38           HZ2      LYS  38  23.729  15.320   4.157
   13    HZ1  LYS  38           HZ3      LYS  38  23.178  14.527   5.553

  No H/Q in entry =          13
  In of MODEL   32
    1    H    ALA  39           H        ALA  39  25.285   8.523   8.853
    2    HA   ALA  39           HA       ALA  39  26.347   6.952   6.767
    3    HB2  ALA  39           HB1      ALA  39  26.298   5.979   9.608
    4    HB1  ALA  39           HB2      ALA  39  27.232   7.414   9.186
    5    HB3  ALA  39           HB3      ALA  39  27.591   5.870   8.414

  No H/Q in entry =           5
  In of MODEL   32
    1    H    MET  40           H        MET  40  23.765   6.303   9.091
    2    HA   MET  40           HA       MET  40  23.340   3.596   8.353
    3    HB2  MET  40           HB2      MET  40  21.518   5.618   9.671
    4    HB3  MET  40           HB3      MET  40  21.126   3.906   9.495
    5    HG2  MET  40           HG2      MET  40  23.681   4.868  10.812
    6    HG3  MET  40           HG3      MET  40  22.199   4.574  11.720
    7    HE3  MET  40           HE1      MET  40  21.673   0.935  11.890
    8    HE2  MET  40           HE2      MET  40  20.783   2.231  11.096
    9    HE1  MET  40           HE3      MET  40  21.538   2.521  12.662

  No H/Q in entry =           9
  In of MODEL   32
    1    H    MET  41           H        MET  41  21.883   6.639   7.191
    2    HA   MET  41           HA       MET  41  19.920   5.430   5.536
    3    HB2  MET  41           HB2      MET  41  21.370   8.037   5.015
    4    HB3  MET  41           HB3      MET  41  19.839   7.530   4.312
    5    HG2  MET  41           HG2      MET  41  19.123   7.326   6.871
    6    HG3  MET  41           HG3      MET  41  20.422   8.496   7.082
    7    HE2  MET  41           HE1      MET  41  19.810   9.788   3.756
    8    HE1  MET  41           HE2      MET  41  20.778  10.233   5.158
    9    HE3  MET  41           HE3      MET  41  19.488  11.301   4.612

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ASP  42           H        ASP  42  23.277   6.389   4.950
    2    HA   ASP  42           HA       ASP  42  23.344   5.925   2.190
    3    HB2  ASP  42           HB2      ASP  42  25.104   6.934   3.943
    4    HB3  ASP  42           HB3      ASP  42  25.776   5.316   3.803

  No H/Q in entry =           4
  In of MODEL   32
    1    H    GLN  43           H        GLN  43  24.120   3.769   4.895
    2    HA   GLN  43           HA       GLN  43  24.790   1.523   3.298
    3    HB2  GLN  43           HB2      GLN  43  23.796   1.687   6.153
    4    HB3  GLN  43           HB3      GLN  43  24.382   0.206   5.387
    5    HG2  GLN  43           HG2      GLN  43  26.527   1.441   4.856
    6    HG3  GLN  43           HG3      GLN  43  25.942   2.759   5.866
    7   HE21  GLN  43          HE21      GLN  43  28.196   1.806   6.875
    8   HE22  GLN  43          HE22      GLN  43  27.947   0.716   8.151

  No H/Q in entry =           8
  In of MODEL   32
    1    H    SER  44           H        SER  44  21.737   2.621   4.720
    2    HA   SER  44           HA       SER  44  20.185   0.364   4.057
    3    HB2  SER  44           HB2      SER  44  19.730   2.884   5.216
    4    HB3  SER  44           HB3      SER  44  18.680   2.835   3.802
    5    HG   SER  44           HG       SER  44  17.615   1.875   5.533

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ARG  45           H        ARG  45  20.877   3.342   2.254
    2    HA   ARG  45           HA       ARG  45  19.332   2.847  -0.036
    3    HB2  ARG  45           HB2      ARG  45  20.460   4.993   0.543
    4    HB3  ARG  45           HB3      ARG  45  22.008   4.256   0.138
    5    HG2  ARG  45           HG2      ARG  45  21.203   3.849  -2.169
    6    HG3  ARG  45           HG3      ARG  45  19.667   4.610  -1.763
    7    HD2  ARG  45           HD2      ARG  45  20.903   6.718  -1.186
    8    HD3  ARG  45           HD3      ARG  45  22.401   5.961  -1.773
    9    HE   ARG  45           HE       ARG  45  20.451   5.710  -3.788
   10   HH21  ARG  45          HH11      ARG  45  20.410   7.085  -5.547
   11   HH22  ARG  45          HH12      ARG  45  21.153   8.642  -5.446
   12   HH11  ARG  45          HH21      ARG  45  22.174   8.221  -2.173
   13   HH12  ARG  45          HH22      ARG  45  22.150   9.285  -3.533

  No H/Q in entry =          13
  In of MODEL   32
    1    H    MET  46           H        MET  46  22.713   2.004   0.671
    2    HA   MET  46           HA       MET  46  23.302   0.825  -1.823
    3    HB2  MET  46           HB2      MET  46  24.443   0.496   0.952
    4    HB3  MET  46           HB3      MET  46  25.095  -0.379  -0.437
    5    HG2  MET  46           HG2      MET  46  25.496   1.744  -1.610
    6    HG3  MET  46           HG3      MET  46  24.801   2.636  -0.263
    7    HE2  MET  46           HE1      MET  46  26.759   4.145   0.347
    8    HE1  MET  46           HE2      MET  46  27.419   3.589  -1.188
    9    HE3  MET  46           HE3      MET  46  28.451   3.643   0.239

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ALA  47           H        ALA  47  21.966  -0.531   1.164
    2    HA   ALA  47           HA       ALA  47  21.928  -3.241   0.353
    3    HB2  ALA  47           HB1      ALA  47  21.572  -2.791   2.664
    4    HB3  ALA  47           HB2      ALA  47  20.034  -3.407   2.060
    5    HB1  ALA  47           HB3      ALA  47  20.250  -1.675   2.321

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU  48           H        LEU  48  19.548  -0.635   0.032
    2    HA   LEU  48           HA       LEU  48  17.502  -2.184  -1.200
    3    HB2  LEU  48           HB2      LEU  48  18.129   0.777  -1.313
    4    HB3  LEU  48           HB3      LEU  48  16.656   0.055  -1.965
    5    HG   LEU  48           HG       LEU  48  17.546  -0.247   0.913
    6   HD13  LEU  48          HD11      LEU  48  17.106   2.050   0.738
    7   HD12  LEU  48          HD12      LEU  48  15.559   1.387   1.263
    8   HD11  LEU  48          HD13      LEU  48  15.807   1.816  -0.430
    9   HD22  LEU  48          HD21      LEU  48  16.029  -1.974   0.545
   10   HD21  LEU  48          HD22      LEU  48  15.132  -1.076  -0.680
   11   HD23  LEU  48          HD23      LEU  48  14.936  -0.678   1.027

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ASN  49           H        ASN  49  20.159  -0.228  -2.456
    2    HA   ASN  49           HA       ASN  49  19.476  -0.310  -5.173
    3    HB2  ASN  49           HB2      ASN  49  21.156   1.215  -4.250
    4    HB3  ASN  49           HB3      ASN  49  22.205  -0.142  -3.861
    5   HD21  ASN  49          HD21      ASN  49  23.891   0.668  -5.279
    6   HD22  ASN  49          HD22      ASN  49  23.739   0.590  -6.967

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLU  50           H        GLU  50  21.503  -2.492  -3.240
    2    HA   GLU  50           HA       GLU  50  22.194  -4.236  -5.380
    3    HB2  GLU  50           HB2      GLU  50  23.417  -4.206  -3.228
    4    HB3  GLU  50           HB3      GLU  50  21.990  -4.849  -2.416
    5    HG2  GLU  50           HG2      GLU  50  22.080  -6.877  -3.782
    6    HG3  GLU  50           HG3      GLU  50  23.440  -6.231  -4.697

  No H/Q in entry =           6
  In of MODEL   32
    1    H    ALA  51           H        ALA  51  19.565  -4.200  -3.021
    2    HA   ALA  51           HA       ALA  51  18.411  -6.681  -3.771
    3    HB3  ALA  51           HB1      ALA  51  16.834  -6.193  -2.195
    4    HB1  ALA  51           HB2      ALA  51  16.599  -4.547  -2.787
    5    HB2  ALA  51           HB3      ALA  51  17.974  -4.924  -1.748

  No H/Q in entry =           5
  In of MODEL   32
    1    H    HIS  52           H        HIS  52  17.784  -3.336  -4.790
    2    HA   HIS  52           HA       HIS  52  15.654  -3.876  -6.565
    3    HB2  HIS  52           HB2      HIS  52  16.232  -1.607  -5.796
    4    HB3  HIS  52           HB3      HIS  52  17.740  -1.685  -6.709
    5    HD1  HIS  52           HD1      HIS  52  17.341  -2.220  -9.402
    6    HD2  HIS  52           HD2      HIS  52  14.143  -0.587  -7.286
    7    HE1  HIS  52           HE1      HIS  52  15.756  -1.257 -11.128
    8    HE2  HIS  52           HE2      HIS  52  13.802  -0.258  -9.853

  No H/Q in entry =           8
  In of MODEL   32
    1    H    LEU  53           H        LEU  53  19.166  -3.850  -7.041
    2    HA   LEU  53           HA       LEU  53  19.192  -4.158  -9.842
    3    HB2  LEU  53           HB2      LEU  53  21.157  -4.903  -7.692
    4    HB3  LEU  53           HB3      LEU  53  21.457  -5.292  -9.384
    5    HG   LEU  53           HG       LEU  53  20.775  -2.485  -8.454
    6   HD13  LEU  53          HD11      LEU  53  22.842  -3.183  -7.342
    7   HD12  LEU  53          HD12      LEU  53  23.215  -2.036  -8.628
    8   HD11  LEU  53          HD13      LEU  53  23.494  -3.756  -8.875
    9   HD21  LEU  53          HD21      LEU  53  21.819  -3.714 -11.009
   10   HD23  LEU  53          HD22      LEU  53  22.158  -2.029 -10.625
   11   HD22  LEU  53          HD23      LEU  53  20.500  -2.568 -10.817

  No H/Q in entry =          11
  In of MODEL   32
    1    H    VAL  54           H        VAL  54  19.133  -6.552  -7.221
    2    HA   VAL  54           HA       VAL  54  19.256  -8.841  -8.888
    3    HB   VAL  54           HB       VAL  54  18.132  -8.435  -6.106
    4   HG12  VAL  54          HG11      VAL  54  18.480 -11.049  -6.112
    5   HG11  VAL  54          HG12      VAL  54  18.272 -10.878  -7.854
    6   HG13  VAL  54          HG13      VAL  54  16.992 -10.362  -6.759
    7   HG22  VAL  54          HG21      VAL  54  20.449  -8.203  -5.911
    8   HG21  VAL  54          HG22      VAL  54  20.779  -9.289  -7.258
    9   HG23  VAL  54          HG23      VAL  54  20.274  -9.944  -5.701

  No H/Q in entry =           9
  In of MODEL   32
    1    H    GLN  55           H        GLN  55  16.527  -6.967  -7.567
    2    HA   GLN  55           HA       GLN  55  14.508  -8.647  -8.620
    3    HB2  GLN  55           HB2      GLN  55  13.766  -7.132  -6.981
    4    HB3  GLN  55           HB3      GLN  55  14.536  -5.755  -7.763
    5    HG2  GLN  55           HG2      GLN  55  12.791  -5.443  -9.231
    6    HG3  GLN  55           HG3      GLN  55  12.483  -7.166  -9.401
    7   HE21  GLN  55          HE21      GLN  55  10.492  -7.736  -8.573
    8   HE22  GLN  55          HE22      GLN  55   9.727  -6.992  -7.253

  No H/Q in entry =           8
  In of MODEL   32
    1    H    THR  56           H        THR  56  16.204  -5.828  -9.994
    2    HA   THR  56           HA       THR  56  14.734  -5.474 -12.324
    3    HB   THR  56           HB       THR  56  17.737  -5.288 -11.975
    4    HG1  THR  56           HG1      THR  56  16.575  -2.953 -12.143
    5   HG23  THR  56          HG21      THR  56  17.366  -5.339 -14.310
    6   HG22  THR  56          HG22      THR  56  17.423  -3.623 -13.915
    7   HG21  THR  56          HG23      THR  56  15.868  -4.415 -14.175

  No H/Q in entry =           7
  In of MODEL   32
    1    H    LYS  57           H        LYS  57  17.413  -7.747 -11.751
    2    HA   LYS  57           HA       LYS  57  17.394  -8.936 -14.331
    3    HB2  LYS  57           HB2      LYS  57  19.208  -9.175 -12.609
    4    HB3  LYS  57           HB3      LYS  57  18.125 -10.183 -11.660
    5    HG2  LYS  57           HG2      LYS  57  18.005 -11.812 -13.496
    6    HG3  LYS  57           HG3      LYS  57  19.064 -10.805 -14.476
    7    HD2  LYS  57           HD2      LYS  57  19.919 -11.802 -11.756
    8    HD3  LYS  57           HD3      LYS  57  20.158 -12.772 -13.208
    9    HE2  LYS  57           HE2      LYS  57  21.347 -10.766 -14.227
   10    HE3  LYS  57           HE3      LYS  57  21.304 -10.016 -12.632
   11    HZ2  LYS  57           HZ1      LYS  57  23.228 -11.690 -13.530
   12    HZ1  LYS  57           HZ2      LYS  57  22.258 -12.719 -12.590
   13    HZ3  LYS  57           HZ3      LYS  57  22.929 -11.319 -11.902

  No H/Q in entry =          13
  In of MODEL   32
    1    H    LEU  58           H        LEU  58  15.657  -9.627 -11.336
    2    HA   LEU  58           HA       LEU  58  14.448 -12.011 -12.260
    3    HB2  LEU  58           HB2      LEU  58  13.661 -10.118 -10.051
    4    HB3  LEU  58           HB3      LEU  58  12.866 -11.663 -10.360
    5    HG   LEU  58           HG       LEU  58  15.842 -11.356  -9.842
    6   HD11  LEU  58          HD11      LEU  58  13.498 -11.801  -8.021
    7   HD13  LEU  58          HD12      LEU  58  14.945 -10.824  -7.774
    8   HD12  LEU  58          HD13      LEU  58  15.037 -12.579  -7.644
    9   HD22  LEU  58          HD21      LEU  58  15.733 -13.417 -10.872
   10   HD21  LEU  58          HD22      LEU  58  14.026 -13.645 -10.491
   11   HD23  LEU  58          HD23      LEU  58  15.253 -13.936  -9.257

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  59           H        ILE  59  13.734  -8.680 -12.927
    2    HA   ILE  59           HA       ILE  59  11.014  -9.354 -13.835
    3    HB   ILE  59           HB       ILE  59  11.820  -7.064 -12.637
    4   HG12  ILE  59          HG12      ILE  59   9.860  -6.970 -14.943
    5   HG13  ILE  59          HG13      ILE  59   9.484  -7.736 -13.421
    6   HG23  ILE  59          HG21      ILE  59  12.339  -5.333 -14.158
    7   HG22  ILE  59          HG22      ILE  59  11.826  -6.263 -15.548
    8   HG21  ILE  59          HG23      ILE  59  13.330  -6.657 -14.722
    9   HD11  ILE  59          HD11      ILE  59  10.058  -5.591 -12.252
   10   HD13  ILE  59          HD12      ILE  59   8.661  -5.467 -13.318
   11   HD12  ILE  59          HD13      ILE  59  10.225  -4.841 -13.840

  No H/Q in entry =          11
  In of MODEL   32
    1    H    GLU  60           H        GLU  60  14.193  -8.467 -15.131
    2    HA   GLU  60           HA       GLU  60  13.375  -8.070 -17.829
    3    HB2  GLU  60           HB2      GLU  60  15.541  -7.284 -17.109
    4    HB3  GLU  60           HB3      GLU  60  16.025  -8.908 -16.628
    5    HG2  GLU  60           HG2      GLU  60  15.195  -8.388 -19.472
    6    HG3  GLU  60           HG3      GLU  60  16.825  -7.972 -18.945

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLY  61           H        GLY  61  14.405 -10.944 -16.032
    2    HA3  GLY  61           HA2      GLY  61  13.850 -12.593 -18.430
    3    HA2  GLY  61           HA3      GLY  61  14.904 -13.066 -17.101

  No H/Q in entry =           3
  In of MODEL   32
    1    H    ASP  62           H        ASP  62  11.773 -11.553 -16.689
    2    HA   ASP  62           HA       ASP  62  10.885 -13.524 -14.861
    3    HB2  ASP  62           HB2      ASP  62   8.718 -12.298 -15.018
    4    HB3  ASP  62           HB3      ASP  62  10.097 -11.258 -14.677

  No H/Q in entry =           4
  In of MODEL   32
    1    H    ALA  63           H        ALA  63  11.027 -13.702 -18.233
    2    HA   ALA  63           HA       ALA  63   8.575 -15.230 -18.637
    3    HB2  ALA  63           HB1      ALA  63  10.957 -14.615 -20.396
    4    HB3  ALA  63           HB2      ALA  63   9.333 -13.939 -20.508
    5    HB1  ALA  63           HB3      ALA  63   9.613 -15.631 -20.920

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLY  64           H        GLY  64   8.733 -17.427 -19.610
    2    HA3  GLY  64           HA2      GLY  64  10.330 -19.387 -19.835
    3    HA2  GLY  64           HA3      GLY  64  10.750 -19.029 -18.166

  No H/Q in entry =           3
  In of MODEL   32
    1    H    GLU  65           H        GLU  65   8.173 -18.481 -17.145
    2    HA   GLU  65           HA       GLU  65   7.301 -21.116 -16.609
    3    HB2  GLU  65           HB2      GLU  65   6.033 -18.442 -16.034
    4    HB3  GLU  65           HB3      GLU  65   5.382 -19.974 -15.455
    5    HG2  GLU  65           HG2      GLU  65   7.469 -20.457 -14.281
    6    HG3  GLU  65           HG3      GLU  65   8.196 -18.982 -14.915

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLY  66           H        GLY  66   6.150 -18.662 -18.771
    2    HA3  GLY  66           HA2      GLY  66   4.782 -20.493 -20.459
    3    HA2  GLY  66           HA3      GLY  66   3.647 -19.550 -19.515

  No H/Q in entry =           3
  In of MODEL   32
    1    H    LYS  67           H        LYS  67   2.992 -18.979 -21.752
    2    HA   LYS  67           HA       LYS  67   4.491 -17.552 -23.568
    3    HB2  LYS  67           HB2      LYS  67   1.540 -17.420 -22.963
    4    HB3  LYS  67           HB3      LYS  67   2.289 -16.692 -24.389
    5    HG2  LYS  67           HG2      LYS  67   3.214 -18.883 -25.036
    6    HG3  LYS  67           HG3      LYS  67   2.484 -19.618 -23.610
    7    HD2  LYS  67           HD2      LYS  67   0.243 -19.019 -24.441
    8    HD3  LYS  67           HD3      LYS  67   0.970 -18.278 -25.869
    9    HE2  LYS  67           HE2      LYS  67   1.962 -20.446 -26.497
   10    HE3  LYS  67           HE3      LYS  67   1.246 -21.192 -25.069
   11    HZ3  LYS  67           HZ1      LYS  67  -0.715 -21.354 -26.070
   12    HZ2  LYS  67           HZ2      LYS  67   0.086 -20.991 -27.521
   13    HZ1  LYS  67           HZ3      LYS  67  -0.669 -19.755 -26.633

  No H/Q in entry =          13
  In of MODEL   32
    1    H    MET  68           H        MET  68   1.981 -15.912 -21.753
    2    HA   MET  68           HA       MET  68   3.588 -13.450 -21.682
    3    HB2  MET  68           HB2      MET  68   0.613 -13.901 -21.433
    4    HB3  MET  68           HB3      MET  68   1.406 -12.329 -21.333
    5    HG2  MET  68           HG2      MET  68   1.576 -14.208 -23.706
    6    HG3  MET  68           HG3      MET  68   0.540 -12.783 -23.615
    7    HE1  MET  68           HE1      MET  68   1.097 -10.597 -23.417
    8    HE3  MET  68           HE2      MET  68   2.612  -9.797 -23.825
    9    HE2  MET  68           HE3      MET  68   2.383 -10.462 -22.210

  No H/Q in entry =           9
  In of MODEL   32
    1    H    LYS  69           H        LYS  69   2.787 -15.918 -19.557
    2    HA   LYS  69           HA       LYS  69   2.225 -14.285 -17.251
    3    HB2  LYS  69           HB2      LYS  69   1.202 -16.494 -17.509
    4    HB3  LYS  69           HB3      LYS  69   2.796 -17.246 -17.411
    5    HG2  LYS  69           HG2      LYS  69   3.126 -16.349 -15.165
    6    HG3  LYS  69           HG3      LYS  69   1.593 -15.484 -15.258
    7    HD2  LYS  69           HD2      LYS  69   0.396 -17.635 -15.464
    8    HD3  LYS  69           HD3      LYS  69   1.932 -18.496 -15.350
    9    HE2  LYS  69           HE2      LYS  69   2.320 -17.532 -13.118
   10    HE3  LYS  69           HE3      LYS  69   0.798 -16.650 -13.229
   11    HZ2  LYS  69           HZ1      LYS  69   0.637 -18.753 -11.974
   12    HZ1  LYS  69           HZ2      LYS  69   1.031 -19.602 -13.391
   13    HZ3  LYS  69           HZ3      LYS  69  -0.404 -18.696 -13.312

  No H/Q in entry =          13
  In of MODEL   32
    1    H    VAL  70           H        VAL  70   3.412 -14.152 -15.272
    2    HA   VAL  70           HA       VAL  70   6.334 -14.585 -15.539
    3    HB   VAL  70           HB       VAL  70   6.611 -12.513 -14.176
    4   HG13  VAL  70          HG11      VAL  70   6.217 -10.977 -16.011
    5   HG12  VAL  70          HG12      VAL  70   5.004 -12.053 -16.704
    6   HG11  VAL  70          HG13      VAL  70   6.701 -12.528 -16.693
    7   HG23  VAL  70          HG21      VAL  70   4.573 -10.974 -14.096
    8   HG22  VAL  70          HG22      VAL  70   4.490 -12.383 -13.040
    9   HG21  VAL  70          HG23      VAL  70   3.599 -12.369 -14.561

  No H/Q in entry =           9
  In of MODEL   32
    1    H    SER  71           H        SER  71   7.425 -14.610 -13.373
    2    HA   SER  71           HA       SER  71   6.365 -16.608 -11.682
    3    HB2  SER  71           HB2      SER  71   8.790 -16.052 -11.874
    4    HB3  SER  71           HB3      SER  71   8.482 -14.546 -11.013
    5    HG   SER  71           HG       SER  71   9.139 -16.197  -9.591

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU  72           H        LEU  72   5.022 -16.511  -9.993
    2    HA   LEU  72           HA       LEU  72   3.454 -14.215  -9.524
    3    HB2  LEU  72           HB2      LEU  72   3.786 -16.772  -7.964
    4    HB3  LEU  72           HB3      LEU  72   2.610 -15.528  -7.547
    5    HG   LEU  72           HG       LEU  72   2.749 -16.808 -10.296
    6   HD13  LEU  72          HD11      LEU  72   0.924 -18.253  -9.601
    7   HD12  LEU  72          HD12      LEU  72   0.881 -17.497  -8.010
    8   HD11  LEU  72          HD13      LEU  72   2.270 -18.475  -8.482
    9   HD22  LEU  72          HD21      LEU  72   1.490 -14.838 -10.512
   10   HD21  LEU  72          HD22      LEU  72   0.838 -14.944  -8.884
   11   HD23  LEU  72          HD23      LEU  72   0.243 -16.024 -10.141

  No H/Q in entry =          11
  In of MODEL   32
    1    H    VAL  73           H        VAL  73   6.146 -15.629  -7.786
    2    HA   VAL  73           HA       VAL  73   6.097 -14.103  -5.449
    3    HB   VAL  73           HB       VAL  73   8.300 -14.885  -5.055
    4   HG12  VAL  73          HG11      VAL  73   6.985 -16.947  -6.843
    5   HG11  VAL  73          HG12      VAL  73   6.461 -16.603  -5.194
    6   HG13  VAL  73          HG13      VAL  73   8.075 -17.249  -5.492
    7   HG22  VAL  73          HG21      VAL  73   9.608 -14.328  -6.890
    8   HG21  VAL  73          HG22      VAL  73   8.428 -14.939  -8.048
    9   HG23  VAL  73          HG23      VAL  73   9.435 -16.065  -7.139

  No H/Q in entry =           9
  In of MODEL   32
    1    H    LEU  74           H        LEU  74   7.041 -13.190  -8.634
    2    HA   LEU  74           HA       LEU  74   8.972 -11.223  -8.158
    3    HB2  LEU  74           HB2      LEU  74   8.491 -11.978 -10.393
    4    HB3  LEU  74           HB3      LEU  74   6.826 -11.411 -10.272
    5    HG   LEU  74           HG       LEU  74   7.630  -9.084 -10.065
    6   HD11  LEU  74          HD11      LEU  74  10.314 -10.464 -10.206
    7   HD13  LEU  74          HD12      LEU  74   9.755  -9.283  -9.023
    8   HD12  LEU  74          HD13      LEU  74  10.122  -8.774 -10.671
    9   HD23  LEU  74          HD21      LEU  74   9.103 -10.143 -12.413
   10   HD22  LEU  74          HD22      LEU  74   7.910  -8.867 -12.302
   11   HD21  LEU  74          HD23      LEU  74   7.389 -10.538 -12.287

  No H/Q in entry =          11
  In of MODEL   32
    1    H    VAL  75           H        VAL  75   5.469 -10.873  -8.471
    2    HA   VAL  75           HA       VAL  75   5.352  -8.119  -7.876
    3    HB   VAL  75           HB       VAL  75   3.291 -10.289  -7.480
    4   HG11  VAL  75          HG11      VAL  75   3.065  -7.253  -7.283
    5   HG13  VAL  75          HG12      VAL  75   2.799  -8.407  -5.984
    6   HG12  VAL  75          HG13      VAL  75   1.692  -8.353  -7.348
    7   HG21  VAL  75          HG21      VAL  75   3.850  -8.210  -9.618
    8   HG23  VAL  75          HG22      VAL  75   2.337  -9.110  -9.524
    9   HG22  VAL  75          HG23      VAL  75   3.856  -9.963  -9.808

  No H/Q in entry =           9
  In of MODEL   32
    1    H    GLU  76           H        GLU  76   5.150 -11.004  -5.771
    2    HA   GLU  76           HA       GLU  76   4.693  -9.654  -3.341
    3    HB2  GLU  76           HB2      GLU  76   4.558 -12.136  -3.621
    4    HB3  GLU  76           HB3      GLU  76   6.303 -12.192  -3.803
    5    HG2  GLU  76           HG2      GLU  76   6.587 -11.303  -1.519
    6    HG3  GLU  76           HG3      GLU  76   4.848 -11.226  -1.309

  No H/Q in entry =           6
  In of MODEL   32
    1    H    ALA  77           H        ALA  77   7.744 -10.527  -4.940
    2    HA   ALA  77           HA       ALA  77   9.445  -9.472  -2.939
    3    HB1  ALA  77           HB1      ALA  77  10.075 -11.011  -4.876
    4    HB2  ALA  77           HB2      ALA  77  11.205  -9.705  -4.516
    5    HB3  ALA  77           HB3      ALA  77  10.101  -9.564  -5.884

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLN  78           H        GLN  78   8.008  -8.061  -5.834
    2    HA   GLN  78           HA       GLN  78   9.337  -5.569  -5.738
    3    HB2  GLN  78           HB2      GLN  78   8.030  -6.489  -7.684
    4    HB3  GLN  78           HB3      GLN  78   6.553  -6.132  -6.793
    5    HG2  GLN  78           HG2      GLN  78   7.182  -3.753  -6.696
    6    HG3  GLN  78           HG3      GLN  78   8.662  -4.105  -7.588
    7   HE21  GLN  78          HE21      GLN  78   6.768  -2.293  -8.682
    8   HE22  GLN  78          HE22      GLN  78   6.042  -3.011 -10.038

  No H/Q in entry =           8
  In of MODEL   32
    1    H    LEU  79           H        LEU  79   6.344  -6.739  -4.279
    2    HA   LEU  79           HA       LEU  79   5.338  -4.344  -3.253
    3    HB2  LEU  79           HB2      LEU  79   4.044  -6.408  -3.190
    4    HB3  LEU  79           HB3      LEU  79   5.207  -7.139  -2.088
    5    HG   LEU  79           HG       LEU  79   4.657  -5.507  -0.351
    6   HD13  LEU  79          HD11      LEU  79   4.162  -3.494  -1.391
    7   HD12  LEU  79          HD12      LEU  79   2.546  -4.036  -0.937
    8   HD11  LEU  79          HD13      LEU  79   3.112  -4.249  -2.592
    9   HD23  LEU  79          HD21      LEU  79   2.076  -6.024  -0.236
   10   HD22  LEU  79          HD22      LEU  79   3.229  -7.353  -0.143
   11   HD21  LEU  79          HD23      LEU  79   2.397  -7.019  -1.658

  No H/Q in entry =          11
  In of MODEL   32
    1    H    HIS  80           H        HIS  80   7.558  -6.663  -1.699
    2    HA   HIS  80           HA       HIS  80   7.856  -5.125   0.671
    3    HB2  HIS  80           HB2      HIS  80   9.204  -7.473  -0.547
    4    HB3  HIS  80           HB3      HIS  80  10.118  -6.571   0.663
    5    HD1  HIS  80           HD1      HIS  80   9.657  -7.218   3.009
    6    HD2  HIS  80           HD2      HIS  80   6.423  -8.091   0.526
    7    HE1  HIS  80           HE1      HIS  80   7.909  -8.341   4.472
    8    HE2  HIS  80           HE2      HIS  80   5.932  -8.877   2.967

  No H/Q in entry =           8
  In of MODEL   32
    1    H    LEU  81           H        LEU  81   9.835  -5.375  -2.262
    2    HA   LEU  81           HA       LEU  81  11.872  -3.618  -1.398
    3    HB2  LEU  81           HB2      LEU  81  10.931  -4.412  -4.154
    4    HB3  LEU  81           HB3      LEU  81  12.345  -3.394  -3.875
    5    HG   LEU  81           HG       LEU  81  11.988  -6.122  -2.605
    6   HD12  LEU  81          HD11      LEU  81  13.793  -6.727  -4.374
    7   HD11  LEU  81          HD12      LEU  81  13.206  -5.306  -5.236
    8   HD13  LEU  81          HD13      LEU  81  12.110  -6.641  -4.891
    9   HD23  LEU  81          HD21      LEU  81  14.614  -5.783  -2.616
   10   HD22  LEU  81          HD22      LEU  81  13.638  -5.035  -1.354
   11   HD21  LEU  81          HD23      LEU  81  14.195  -4.074  -2.724

  No H/Q in entry =          11
  In of MODEL   32
    1    H    MET  82           H        MET  82   8.925  -3.002  -3.305
    2    HA   MET  82           HA       MET  82   9.437  -0.270  -3.804
    3    HB2  MET  82           HB2      MET  82   6.892  -1.886  -3.658
    4    HB3  MET  82           HB3      MET  82   6.874  -0.160  -4.018
    5    HG2  MET  82           HG2      MET  82   8.477  -2.216  -5.574
    6    HG3  MET  82           HG3      MET  82   6.900  -1.606  -6.070
    7    HE3  MET  82           HE1      MET  82   7.308   1.856  -7.236
    8    HE2  MET  82           HE2      MET  82   6.952   1.622  -5.527
    9    HE1  MET  82           HE3      MET  82   6.285   0.510  -6.718

  No H/Q in entry =           9
  In of MODEL   32
    1    H    THR  83           H        THR  83   7.684  -1.890  -1.186
    2    HA   THR  83           HA       THR  83   6.826   0.448   0.155
    3    HB   THR  83           HB       THR  83   6.724  -1.133   2.170
    4    HG1  THR  83           HG1      THR  83   7.495  -3.076   1.928
    5   HG22  THR  83          HG21      THR  83   5.070  -2.709   0.714
    6   HG21  THR  83          HG22      THR  83   5.275  -1.375  -0.417
    7   HG23  THR  83          HG23      THR  83   4.647  -1.069   1.203

  No H/Q in entry =           7
  In of MODEL   32
    1    H    SER  84           H        SER  84   9.672  -1.629   0.643
    2    HA   SER  84           HA       SER  84  10.741  -0.196   2.825
    3    HB2  SER  84           HB2      SER  84  11.989  -2.023   0.783
    4    HB3  SER  84           HB3      SER  84  12.942  -1.265   2.058
    5    HG   SER  84           HG       SER  84  10.683  -2.974   2.334

  No H/Q in entry =           5
  In of MODEL   32
    1    H    MET  85           H        MET  85  11.458   0.081  -0.669
    2    HA   MET  85           HA       MET  85  13.444   2.060  -0.432
    3    HB2  MET  85           HB2      MET  85  13.031   0.777  -2.497
    4    HB3  MET  85           HB3      MET  85  11.502   1.629  -2.711
    5    HG2  MET  85           HG2      MET  85  12.694   3.775  -2.847
    6    HG3  MET  85           HG3      MET  85  14.227   2.952  -2.582
    7    HE2  MET  85           HE1      MET  85  11.491   3.064  -6.165
    8    HE1  MET  85           HE2      MET  85  11.098   3.221  -4.456
    9    HE3  MET  85           HE3      MET  85  11.184   1.622  -5.184

  No H/Q in entry =           9
  In of MODEL   32
    1    H    LEU  86           H        LEU  86   9.947   2.370  -0.907
    2    HA   LEU  86           HA       LEU  86   9.860   5.183  -1.080
    3    HB2  LEU  86           HB2      LEU  86   8.023   3.511  -1.643
    4    HB3  LEU  86           HB3      LEU  86   7.710   3.414   0.090
    5    HG   LEU  86           HG       LEU  86   7.530   5.974   0.046
    6   HD11  LEU  86          HD11      LEU  86   8.283   5.551  -2.664
    7   HD13  LEU  86          HD12      LEU  86   7.843   7.073  -1.895
    8   HD12  LEU  86          HD13      LEU  86   6.606   6.103  -2.691
    9   HD23  LEU  86          HD21      LEU  86   5.390   4.609  -1.600
   10   HD22  LEU  86          HD22      LEU  86   5.202   5.865  -0.378
   11   HD21  LEU  86          HD23      LEU  86   5.619   4.222   0.107

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ALA  87           H        ALA  87   9.436   2.994   1.664
    2    HA   ALA  87           HA       ALA  87   8.893   4.898   3.644
    3    HB1  ALA  87           HB1      ALA  87   9.720   2.084   3.542
    4    HB3  ALA  87           HB2      ALA  87   8.599   2.885   4.641
    5    HB2  ALA  87           HB3      ALA  87  10.331   2.928   4.968

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ARG  88           H        ARG  88  11.977   3.499   2.630
    2    HA   ARG  88           HA       ARG  88  13.594   4.884   4.450
    3    HB2  ARG  88           HB2      ARG  88  14.263   2.919   3.035
    4    HB3  ARG  88           HB3      ARG  88  14.394   4.016   1.664
    5    HG2  ARG  88           HG2      ARG  88  15.877   5.336   3.599
    6    HG3  ARG  88           HG3      ARG  88  16.213   3.648   3.970
    7    HD2  ARG  88           HD2      ARG  88  17.464   3.365   2.110
    8    HD3  ARG  88           HD3      ARG  88  16.311   4.231   1.091
    9    HE   ARG  88           HE       ARG  88  18.708   5.310   2.118
   10   HH21  ARG  88          HH11      ARG  88  19.036   7.531   1.926
   11   HH22  ARG  88          HH12      ARG  88  17.676   8.593   1.799
   12   HH11  ARG  88          HH21      ARG  88  15.361   6.039   1.874
   13   HH12  ARG  88          HH22      ARG  88  15.593   7.746   1.745

  No H/Q in entry =          13
  In of MODEL   32
    1    H    GLU  89           H        GLU  89  12.582   5.783   1.139
    2    HA   GLU  89           HA       GLU  89  14.110   8.155   0.974
    3    HB2  GLU  89           HB2      GLU  89  12.954   7.111  -0.965
    4    HB3  GLU  89           HB3      GLU  89  11.412   7.639  -0.291
    5    HG2  GLU  89           HG2      GLU  89  12.095   9.982  -0.454
    6    HG3  GLU  89           HG3      GLU  89  13.697   9.504  -1.008

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LEU  90           H        LEU  90  10.796   7.618   2.135
    2    HA   LEU  90           HA       LEU  90  10.267  10.346   2.723
    3    HB2  LEU  90           HB2      LEU  90   9.101   7.761   3.755
    4    HB3  LEU  90           HB3      LEU  90   8.463   9.351   4.188
    5    HG   LEU  90           HG       LEU  90   8.859   8.482   1.313
    6   HD12  LEU  90          HD11      LEU  90   6.328   8.135   1.400
    7   HD11  LEU  90          HD12      LEU  90   6.501   8.121   3.155
    8   HD13  LEU  90          HD13      LEU  90   7.318   6.899   2.179
    9   HD22  LEU  90          HD21      LEU  90   8.547  10.788   1.249
   10   HD21  LEU  90          HD22      LEU  90   7.575  10.809   2.719
   11   HD23  LEU  90          HD23      LEU  90   6.867  10.253   1.203

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  91           H        ILE  91  11.568   7.669   4.625
    2    HA   ILE  91           HA       ILE  91  11.723   9.028   7.096
    3    HB   ILE  91           HB       ILE  91  13.283   6.704   5.950
    4   HG12  ILE  91          HG12      ILE  91  11.288   6.851   8.230
    5   HG13  ILE  91          HG13      ILE  91  10.803   6.571   6.558
    6   HG22  ILE  91          HG21      ILE  91  13.781   6.487   8.585
    7   HG21  ILE  91          HG22      ILE  91  13.691   8.245   8.490
    8   HG23  ILE  91          HG23      ILE  91  14.866   7.369   7.511
    9   HD13  ILE  91          HD11      ILE  91  11.820   4.477   6.472
   10   HD12  ILE  91          HD12      ILE  91  11.243   4.526   8.138
   11   HD11  ILE  91          HD13      ILE  91  12.939   4.853   7.784

  No H/Q in entry =          11
  In of MODEL   32
    1    H    THR  92           H        THR  92  13.914   8.883   4.321
    2    HA   THR  92           HA       THR  92  16.080  10.288   5.463
    3    HB   THR  92           HB       THR  92  15.067  10.164   2.612
    4    HG1  THR  92           HG1      THR  92  15.916   8.272   3.003
    5   HG22  THR  92          HG21      THR  92  17.628  10.874   2.294
    6   HG21  THR  92          HG22      THR  92  17.330  11.689   3.829
    7   HG23  THR  92          HG23      THR  92  16.342  12.073   2.419

  No H/Q in entry =           7
  In of MODEL   32
    1    H    GLU  93           H        GLU  93  13.168  11.426   3.766
    2    HA   GLU  93           HA       GLU  93  13.743  14.190   3.882
    3    HB2  GLU  93           HB2      GLU  93  11.049  12.798   3.920
    4    HB3  GLU  93           HB3      GLU  93  11.321  14.500   3.550
    5    HG2  GLU  93           HG2      GLU  93  12.660  12.272   2.002
    6    HG3  GLU  93           HG3      GLU  93  11.104  12.945   1.533

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LEU  94           H        LEU  94  12.039  12.015   6.105
    2    HA   LEU  94           HA       LEU  94  11.234  13.950   7.994
    3    HB2  LEU  94           HB2      LEU  94  11.835  10.999   8.254
    4    HB3  LEU  94           HB3      LEU  94  11.270  11.967   9.613
    5    HG   LEU  94           HG       LEU  94   9.759  12.015   7.000
    6   HD11  LEU  94          HD11      LEU  94   9.878   9.789   8.997
    7   HD13  LEU  94          HD12      LEU  94   9.559   9.730   7.265
    8   HD12  LEU  94          HD13      LEU  94   8.288  10.234   8.377
    9   HD23  LEU  94          HD21      LEU  94   7.853  12.396   8.621
   10   HD22  LEU  94          HD22      LEU  94   9.083  13.659   8.648
   11   HD21  LEU  94          HD23      LEU  94   9.042  12.438   9.920

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  95           H        ILE  95  14.220  12.044   7.722
    2    HA   ILE  95           HA       ILE  95  15.405  12.968  10.126
    3    HB   ILE  95           HB       ILE  95  16.626  11.915   7.563
    4   HG12  ILE  95          HG12      ILE  95  16.367  10.704  10.330
    5   HG13  ILE  95          HG13      ILE  95  15.189  10.441   9.046
    6   HG21  ILE  95          HG21      ILE  95  17.902  12.724  10.194
    7   HG23  ILE  95          HG22      ILE  95  18.344  13.259   8.572
    8   HG22  ILE  95          HG23      ILE  95  18.668  11.600   9.072
    9   HD13  ILE  95          HD11      ILE  95  16.666   9.177   7.764
   10   HD12  ILE  95          HD12      ILE  95  17.158   8.727   9.394
   11   HD11  ILE  95          HD13      ILE  95  18.093   9.916   8.488

  No H/Q in entry =          11
  In of MODEL   32
    1    H    GLU  96           H        GLU  96  15.516  14.211   6.794
    2    HA   GLU  96           HA       GLU  96  17.353  16.302   7.257
    3    HB2  GLU  96           HB2      GLU  96  16.670  15.641   5.003
    4    HB3  GLU  96           HB3      GLU  96  15.026  16.185   5.322
    5    HG2  GLU  96           HG2      GLU  96  15.571  18.320   4.780
    6    HG3  GLU  96           HG3      GLU  96  16.882  18.327   5.949

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LEU  97           H        LEU  97  13.847  16.088   7.723
    2    HA   LEU  97           HA       LEU  97  13.418  18.817   8.377
    3    HB2  LEU  97           HB2      LEU  97  11.925  16.279   8.999
    4    HB3  LEU  97           HB3      LEU  97  11.407  17.820   9.680
    5    HG   LEU  97           HG       LEU  97  11.862  17.416   6.709
    6   HD12  LEU  97          HD11      LEU  97   9.339  17.270   6.617
    7   HD11  LEU  97          HD12      LEU  97   9.352  17.065   8.367
    8   HD13  LEU  97          HD13      LEU  97  10.131  15.866   7.333
    9   HD23  LEU  97          HD21      LEU  97  10.111  19.367   6.766
   10   HD22  LEU  97          HD22      LEU  97  11.793  19.738   7.141
   11   HD21  LEU  97          HD23      LEU  97  10.619  19.555   8.443

  No H/Q in entry =          11
  In of MODEL   32
    1    H    HIS  98           H        HIS  98  14.281  15.992  10.356
    2    HA   HIS  98           HA       HIS  98  14.140  17.244  12.877
    3    HB2  HIS  98           HB2      HIS  98  15.896  15.002  11.850
    4    HB3  HIS  98           HB3      HIS  98  15.908  15.536  13.533
    5    HD1  HIS  98           HD1      HIS  98  13.693  13.898  10.959
    6    HD2  HIS  98           HD2      HIS  98  13.622  14.806  15.027
    7    HE1  HIS  98           HE1      HIS  98  11.687  12.686  11.929
    8    HE2  HIS  98           HE2      HIS  98  11.624  13.230  14.403

  No H/Q in entry =           8
  In of MODEL   32
    1    H    GLU  99           H        GLU  99  16.669  17.154  10.415
    2    HA   GLU  99           HA       GLU  99  18.661  18.496  11.927
    3    HB2  GLU  99           HB2      GLU  99  19.127  17.217   9.849
    4    HB3  GLU  99           HB3      GLU  99  18.299  18.469   8.921
    5    HG2  GLU  99           HG2      GLU  99  19.903  20.149   9.699
    6    HG3  GLU  99           HG3      GLU  99  20.702  18.949  10.710

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LYS 100           H        LYS 100  16.106  19.646   9.741
    2    HA   LYS 100           HA       LYS 100  16.886  22.389   9.884
    3    HB2  LYS 100           HB2      LYS 100  14.254  21.084   9.153
    4    HB3  LYS 100           HB3      LYS 100  14.540  22.824   9.065
    5    HG2  LYS 100           HG2      LYS 100  16.500  22.394   7.576
    6    HG3  LYS 100           HG3      LYS 100  16.099  20.674   7.593
    7    HD2  LYS 100           HD2      LYS 100  13.890  21.171   6.618
    8    HD3  LYS 100           HD3      LYS 100  14.274  22.893   6.608
    9    HE2  LYS 100           HE2      LYS 100  16.221  22.430   5.126
   10    HE3  LYS 100           HE3      LYS 100  15.767  20.722   5.093
   11    HZ1  LYS 100           HZ1      LYS 100  13.919  22.905   4.284
   12    HZ3  LYS 100           HZ2      LYS 100  13.743  21.235   4.019
   13    HZ2  LYS 100           HZ3      LYS 100  14.939  22.107   3.187

  No H/Q in entry =          13
  In of MODEL   32
    1    H    LEU 101           H        LEU 101  14.823  20.323  11.865
    2    HA   LEU 101           HA       LEU 101  13.660  22.379  13.462
    3    HB2  LEU 101           HB2      LEU 101  14.125  19.431  13.832
    4    HB3  LEU 101           HB3      LEU 101  13.597  20.404  15.202
    5    HG   LEU 101           HG       LEU 101  12.151  20.490  12.548
    6   HD12  LEU 101          HD11      LEU 101  10.515  18.912  13.830
    7   HD11  LEU 101          HD12      LEU 101  11.923  18.505  14.809
    8   HD13  LEU 101          HD13      LEU 101  11.940  18.204  13.070
    9   HD21  LEU 101          HD21      LEU 101  11.519  21.271  15.409
   10   HD23  LEU 101          HD22      LEU 101  10.246  21.040  14.212
   11   HD22  LEU 101          HD23      LEU 101  11.470  22.284  13.964

  No H/Q in entry =          11
  In of MODEL   32
    1    H    LYS 102           H        LYS 102  16.806  21.793  12.990
    2    HA   LYS 102           HA       LYS 102  18.658  22.673  14.046
    3    HB2  LYS 102           HB2      LYS 102  16.846  24.172  15.203
    4    HB3  LYS 102           HB3      LYS 102  17.075  23.107  16.574
    5    HG2  LYS 102           HG2      LYS 102  18.943  25.134  15.391
    6    HG3  LYS 102           HG3      LYS 102  18.580  24.812  17.073
    7    HD2  LYS 102           HD2      LYS 102  20.242  22.915  15.364
    8    HD3  LYS 102           HD3      LYS 102  20.932  24.239  16.293
    9    HE2  LYS 102           HE2      LYS 102  20.561  21.685  17.258
   10    HE3  LYS 102           HE3      LYS 102  20.781  23.126  18.252
   11    HZ2  LYS 102           HZ1      LYS 102  18.827  21.827  18.887
   12    HZ1  LYS 102           HZ2      LYS 102  18.165  22.058  17.345
   13    HZ3  LYS 102           HZ3      LYS 102  18.398  23.386  18.373

  No H/Q in entry =          13
  In of MODEL   32
    1    H    ALA 103           H        ALA 103  16.623  21.047  16.485
    2    HA   ALA 103           HA       ALA 103  18.375  19.842  18.117
    3    HB2  ALA 103           HB1      ALA 103  16.804  17.825  18.122
    4    HB1  ALA 103           HB2      ALA 103  15.889  18.676  16.877
    5    HB3  ALA 103           HB3      ALA 103  16.080  19.393  18.476

  No H/Q in entry =           5
  In of MODEL   32
    1    H1   ALA   1           H3       ALA   1  -1.803  -7.021 -21.371
    2    H2   ALA   1           H2       ALA   1  -2.584  -8.462 -20.914
    3    H3   ALA   1           H1       ALA   1  -0.982  -8.500 -21.486
    4    HA   ALA   1           HA       ALA   1  -1.834  -8.969 -23.474
    5    HB1  ALA   1           HB1      ALA   1  -3.961  -9.701 -22.981
    6    HB2  ALA   1           HB2      ALA   1  -4.418  -8.191 -23.769
    7    HB3  ALA   1           HB3      ALA   1  -4.338  -8.276 -22.011

  No H/Q in entry =           7
  In of MODEL   32
    1    H    GLU   2           H        GLU   2  -2.692  -7.777 -25.451
    2    HA   GLU   2           HA       GLU   2  -1.314  -5.753 -26.337
    3    HB2  GLU   2           HB2      GLU   2  -4.324  -5.836 -26.623
    4    HB3  GLU   2           HB3      GLU   2  -3.219  -4.964 -27.682
    5    HG2  GLU   2           HG2      GLU   2  -2.717  -6.847 -28.848
    6    HG3  GLU   2           HG3      GLU   2  -2.399  -7.755 -27.376

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLU   3           H        GLU   3  -4.472  -4.517 -25.400
    2    HA   GLU   3           HA       GLU   3  -3.434  -1.957 -24.775
    3    HB2  GLU   3           HB2      GLU   3  -6.111  -3.288 -24.419
    4    HB3  GLU   3           HB3      GLU   3  -5.815  -1.673 -23.770
    5    HG2  GLU   3           HG2      GLU   3  -5.487  -0.738 -25.897
    6    HG3  GLU   3           HG3      GLU   3  -5.090  -2.288 -26.631

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LEU   4           H        LEU   4  -4.988  -4.332 -22.586
    2    HA   LEU   4           HA       LEU   4  -4.606  -3.109 -20.195
    3    HB2  LEU   4           HB2      LEU   4  -4.051  -6.046 -20.679
    4    HB3  LEU   4           HB3      LEU   4  -4.445  -5.307 -19.129
    5    HG   LEU   4           HG       LEU   4  -6.243  -5.383 -21.575
    6   HD13  LEU   4          HD11      LEU   4  -7.415  -7.110 -20.570
    7   HD12  LEU   4          HD12      LEU   4  -6.916  -6.653 -18.943
    8   HD11  LEU   4          HD13      LEU   4  -5.786  -7.486 -20.009
    9   HD23  LEU   4          HD21      LEU   4  -7.912  -4.587 -19.687
   10   HD22  LEU   4          HD22      LEU   4  -6.889  -3.408 -20.505
   11   HD21  LEU   4          HD23      LEU   4  -6.443  -4.000 -18.905

  No H/Q in entry =          11
  In of MODEL   32
    1    H    GLU   5           H        GLU   5  -2.115  -4.932 -21.957
    2    HA   GLU   5           HA       GLU   5  -0.112  -4.643 -19.940
    3    HB2  GLU   5           HB2      GLU   5  -0.068  -6.404 -21.713
    4    HB3  GLU   5           HB3      GLU   5   0.255  -5.147 -22.907
    5    HG2  GLU   5           HG2      GLU   5   2.375  -6.094 -22.284
    6    HG3  GLU   5           HG3      GLU   5   2.284  -4.499 -21.538

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLU   6           H        GLU   6  -0.789  -2.924 -22.973
    2    HA   GLU   6           HA       GLU   6   1.373  -1.080 -22.722
    3    HB2  GLU   6           HB2      GLU   6   0.234  -1.557 -24.873
    4    HB3  GLU   6           HB3      GLU   6  -1.224  -0.786 -24.251
    5    HG2  GLU   6           HG2      GLU   6   0.012   1.324 -23.950
    6    HG3  GLU   6           HG3      GLU   6   1.475   0.559 -24.563

  No H/Q in entry =           6
  In of MODEL   32
    1    H    VAL   7           H        VAL   7  -1.954  -1.174 -21.642
    2    HA   VAL   7           HA       VAL   7  -2.182   1.534 -20.795
    3    HB   VAL   7           HB       VAL   7  -3.621  -0.995 -19.952
    4   HG11  VAL   7          HG11      VAL   7  -4.004   1.889 -19.124
    5   HG13  VAL   7          HG12      VAL   7  -3.886   0.462 -18.095
    6   HG12  VAL   7          HG13      VAL   7  -5.330   0.727 -19.071
    7   HG21  VAL   7          HG21      VAL   7  -3.809   0.089 -22.335
    8   HG23  VAL   7          HG22      VAL   7  -4.753   1.329 -21.509
    9   HG22  VAL   7          HG23      VAL   7  -5.289  -0.351 -21.482

  No H/Q in entry =           9
  In of MODEL   32
    1    H    VAL   8           H        VAL   8  -1.161  -1.450 -19.172
    2    HA   VAL   8           HA       VAL   8  -0.822  -0.377 -16.576
    3    HB   VAL   8           HB       VAL   8   0.579  -2.681 -17.955
    4   HG13  VAL   8          HG11      VAL   8   2.021  -2.069 -16.179
    5   HG12  VAL   8          HG12      VAL   8   1.012  -3.343 -15.494
    6   HG11  VAL   8          HG13      VAL   8   0.677  -1.655 -15.116
    7   HG23  VAL   8          HG21      VAL   8  -1.364  -3.130 -15.741
    8   HG22  VAL   8          HG22      VAL   8  -1.173  -3.998 -17.261
    9   HG21  VAL   8          HG23      VAL   8  -2.069  -2.483 -17.222

  No H/Q in entry =           9
  In of MODEL   32
    1    H    MET   9           H        MET   9   1.400  -0.656 -19.348
    2    HA   MET   9           HA       MET   9   3.694   0.395 -18.107
    3    HB2  MET   9           HB2      MET   9   2.710   0.377 -20.954
    4    HB3  MET   9           HB3      MET   9   4.194   1.225 -20.517
    5    HG2  MET   9           HG2      MET   9   4.888  -0.975 -19.355
    6    HG3  MET   9           HG3      MET   9   3.581  -1.720 -20.277
    7    HE1  MET   9           HE1      MET   9   3.392  -2.085 -22.525
    8    HE3  MET   9           HE2      MET   9   4.508  -1.702 -23.832
    9    HE2  MET   9           HE3      MET   9   3.504  -0.432 -23.140

  No H/Q in entry =           9
  In of MODEL   32
    1    H    GLY  10           H        GLY  10   0.984   1.989 -19.751
    2    HA3  GLY  10           HA2      GLY  10   1.936   4.646 -19.508
    3    HA2  GLY  10           HA3      GLY  10   0.247   4.178 -19.696

  No H/Q in entry =           3
  In of MODEL   32
    1    H    LEU  11           H        LEU  11  -0.121   2.641 -17.411
    2    HA   LEU  11           HA       LEU  11  -0.639   4.609 -15.439
    3    HB2  LEU  11           HB2      LEU  11  -0.556   1.593 -15.294
    4    HB3  LEU  11           HB3      LEU  11  -1.055   2.609 -13.943
    5    HG   LEU  11           HG       LEU  11  -2.324   2.726 -16.692
    6   HD13  LEU  11          HD11      LEU  11  -2.890   0.578 -15.938
    7   HD12  LEU  11          HD12      LEU  11  -4.239   1.562 -15.375
    8   HD11  LEU  11          HD13      LEU  11  -2.968   1.083 -14.250
    9   HD22  LEU  11          HD21      LEU  11  -2.914   4.736 -15.672
   10   HD21  LEU  11          HD22      LEU  11  -2.818   4.065 -14.045
   11   HD23  LEU  11          HD23      LEU  11  -4.203   3.696 -15.073

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  12           H        ILE  12   1.912   2.156 -15.718
    2    HA   ILE  12           HA       ILE  12   3.142   2.690 -13.225
    3    HB   ILE  12           HB       ILE  12   4.331   1.638 -15.814
    4   HG12  ILE  12          HG12      ILE  12   2.409   0.378 -14.601
    5   HG13  ILE  12          HG13      ILE  12   3.839  -0.538 -15.031
    6   HG21  ILE  12          HG21      ILE  12   5.447   1.650 -12.989
    7   HG23  ILE  12          HG22      ILE  12   6.131   2.457 -14.399
    8   HG22  ILE  12          HG23      ILE  12   6.112   0.697 -14.313
    9   HD11  ILE  12          HD11      ILE  12   3.291   0.687 -12.313
   10   HD13  ILE  12          HD12      ILE  12   4.660  -0.341 -12.739
   11   HD12  ILE  12          HD13      ILE  12   3.039  -1.000 -12.727

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  13           H        ILE  13   3.702   3.967 -16.484
    2    HA   ILE  13           HA       ILE  13   5.840   5.695 -15.778
    3    HB   ILE  13           HB       ILE  13   3.788   5.754 -18.003
    4   HG12  ILE  13          HG12      ILE  13   5.598   3.930 -17.809
    5   HG13  ILE  13          HG13      ILE  13   5.457   4.772 -19.348
    6   HG21  ILE  13          HG21      ILE  13   5.933   7.719 -17.307
    7   HG23  ILE  13          HG22      ILE  13   4.361   8.002 -18.046
    8   HG22  ILE  13          HG23      ILE  13   5.682   7.349 -19.014
    9   HD11  ILE  13          HD11      ILE  13   7.318   6.053 -17.430
   10   HD13  ILE  13          HD12      ILE  13   7.511   5.727 -19.149
   11   HD12  ILE  13          HD13      ILE  13   7.805   4.448 -17.977

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ASN  14           H        ASN  14   2.328   6.174 -16.005
    2    HA   ASN  14           HA       ASN  14   2.280   8.918 -15.358
    3    HB2  ASN  14           HB2      ASN  14   0.385   7.270 -16.173
    4    HB3  ASN  14           HB3      ASN  14   0.084   7.085 -14.450
    5   HD21  ASN  14          HD21      ASN  14  -1.956   8.237 -15.856
    6   HD22  ASN  14          HD22      ASN  14  -2.024   9.908 -15.582

  No H/Q in entry =           6
  In of MODEL   32
    1    H    SER  15           H        SER  15   2.021   6.033 -13.288
    2    HA   SER  15           HA       SER  15   1.736   7.394 -10.832
    3    HB2  SER  15           HB2      SER  15   2.300   5.308  -9.796
    4    HB3  SER  15           HB3      SER  15   1.465   4.886 -11.287
    5    HG   SER  15           HG       SER  15   4.067   4.477 -10.543

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLY  16           H        GLY  16   4.597   6.316 -12.626
    2    HA3  GLY  16           HA2      GLY  16   6.540   7.076 -10.715
    3    HA2  GLY  16           HA3      GLY  16   6.824   6.881 -12.442

  No H/Q in entry =           3
  In of MODEL   32
    1    H    GLN  17           H        GLN  17   5.114   8.833 -13.480
    2    HA   GLN  17           HA       GLN  17   6.682  11.182 -13.181
    3    HB2  GLN  17           HB2      GLN  17   3.929  10.727 -14.361
    4    HB3  GLN  17           HB3      GLN  17   4.755  12.285 -14.419
    5    HG2  GLN  17           HG2      GLN  17   6.634  11.277 -15.623
    6    HG3  GLN  17           HG3      GLN  17   5.872   9.691 -15.519
    7   HE21  GLN  17          HE21      GLN  17   6.257  12.309 -17.587
    8   HE22  GLN  17          HE22      GLN  17   4.892  12.067 -18.566

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ALA  18           H        ALA  18   3.602  10.143 -11.801
    2    HA   ALA  18           HA       ALA  18   2.878  12.523 -10.519
    3    HB1  ALA  18           HB1      ALA  18   1.760  10.061 -10.737
    4    HB2  ALA  18           HB2      ALA  18   1.218  11.274  -9.580
    5    HB3  ALA  18           HB3      ALA  18   2.321   9.996  -9.067

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ARG  19           H        ARG  19   4.782   9.767  -9.270
    2    HA   ARG  19           HA       ARG  19   5.336  10.920  -6.751
    3    HB2  ARG  19           HB2      ARG  19   5.758   8.521  -7.290
    4    HB3  ARG  19           HB3      ARG  19   7.100   9.018  -8.325
    5    HG2  ARG  19           HG2      ARG  19   8.234  10.059  -6.411
    6    HG3  ARG  19           HG3      ARG  19   6.872   9.659  -5.366
    7    HD2  ARG  19           HD2      ARG  19   8.648   8.033  -5.033
    8    HD3  ARG  19           HD3      ARG  19   7.270   7.245  -5.806
    9    HE   ARG  19           HE       ARG  19   8.947   8.081  -7.869
   10   HH21  ARG  19          HH11      ARG  19  10.506   6.688  -8.742
   11   HH22  ARG  19          HH12      ARG  19  11.070   5.341  -7.817
   12   HH11  ARG  19          HH21      ARG  19   9.062   6.042  -5.099
   13   HH12  ARG  19          HH22      ARG  19  10.249   4.974  -5.753

  No H/Q in entry =          13
  In of MODEL   32
    1    H    SER  20           H        SER  20   7.119  10.971  -9.819
    2    HA   SER  20           HA       SER  20   9.364  12.398  -9.016
    3    HB2  SER  20           HB2      SER  20   9.379  11.530 -11.223
    4    HB3  SER  20           HB3      SER  20   7.867  12.335 -11.631
    5    HG   SER  20           HG       SER  20  10.457  13.384 -11.356

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU  21           H        LEU  21   6.243  13.650 -10.174
    2    HA   LEU  21           HA       LEU  21   6.898  16.400  -9.948
    3    HB2  LEU  21           HB2      LEU  21   4.239  14.960  -9.841
    4    HB3  LEU  21           HB3      LEU  21   4.397  16.714  -9.845
    5    HG   LEU  21           HG       LEU  21   5.581  14.929 -11.991
    6   HD13  LEU  21          HD11      LEU  21   3.192  14.650 -12.099
    7   HD12  LEU  21          HD12      LEU  21   3.638  15.789 -13.370
    8   HD11  LEU  21          HD13      LEU  21   2.924  16.379 -11.871
    9   HD23  LEU  21          HD21      LEU  21   5.320  17.256 -13.223
   10   HD22  LEU  21          HD22      LEU  21   6.703  17.003 -12.163
   11   HD21  LEU  21          HD23      LEU  21   5.317  17.915 -11.589

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ALA  22           H        ALA  22   5.427  14.092  -7.691
    2    HA   ALA  22           HA       ALA  22   4.834  15.889  -5.611
    3    HB3  ALA  22           HB1      ALA  22   4.088  13.492  -5.774
    4    HB2  ALA  22           HB2      ALA  22   4.691  13.963  -4.184
    5    HB1  ALA  22           HB3      ALA  22   5.709  13.015  -5.270

  No H/Q in entry =           5
  In of MODEL   32
    1    H    TYR  23           H        TYR  23   7.778  13.887  -6.089
    2    HA   TYR  23           HA       TYR  23   9.178  14.909  -3.849
    3    HB2  TYR  23           HB2      TYR  23   9.968  12.911  -5.021
    4    HB3  TYR  23           HB3      TYR  23  10.257  13.856  -6.482
    5    HD1  TYR  23           HD1      TYR  23  11.266  13.512  -2.904
    6    HD2  TYR  23           HD2      TYR  23  12.277  15.048  -6.787
    7    HE1  TYR  23           HE1      TYR  23  13.530  14.105  -2.081
    8    HE2  TYR  23           HE2      TYR  23  14.540  15.642  -5.963
    9    HH   TYR  23           HH       TYR  23  15.578  14.795  -2.673

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ALA  24           H        ALA  24   8.949  16.025  -7.209
    2    HA   ALA  24           HA       ALA  24  10.831  18.124  -6.977
    3    HB2  ALA  24           HB1      ALA  24  10.363  18.190  -9.180
    4    HB3  ALA  24           HB2      ALA  24   8.806  18.926  -8.801
    5    HB1  ALA  24           HB3      ALA  24   8.944  17.175  -8.938

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA  25           H        ALA  25   7.361  17.909  -6.318
    2    HA   ALA  25           HA       ALA  25   6.865  20.622  -5.734
    3    HB1  ALA  25           HB1      ALA  25   5.218  18.610  -5.924
    4    HB2  ALA  25           HB2      ALA  25   4.852  19.892  -4.767
    5    HB3  ALA  25           HB3      ALA  25   5.561  18.375  -4.209

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU  26           H        LEU  26   7.978  17.945  -3.705
    2    HA   LEU  26           HA       LEU  26   8.098  19.369  -1.265
    3    HB2  LEU  26           HB2      LEU  26   8.214  16.953  -1.268
    4    HB3  LEU  26           HB3      LEU  26   9.674  16.977  -2.255
    5    HG   LEU  26           HG       LEU  26  10.899  18.100  -0.425
    6   HD12  LEU  26          HD11      LEU  26   9.698  18.090   1.848
    7   HD11  LEU  26          HD12      LEU  26   8.201  17.942   0.930
    8   HD13  LEU  26          HD13      LEU  26   9.231  19.358   0.714
    9   HD21  LEU  26          HD21      LEU  26   9.397  15.616   0.457
   10   HD23  LEU  26          HD22      LEU  26  10.915  16.190   1.139
   11   HD22  LEU  26          HD23      LEU  26  10.856  15.636  -0.532

  No H/Q in entry =          11
  In of MODEL   32
    1    H    LYS  27           H        LYS  27  10.492  18.826  -3.818
    2    HA   LYS  27           HA       LYS  27  12.678  20.083  -2.611
    3    HB2  LYS  27           HB2      LYS  27  12.768  18.743  -4.706
    4    HB3  LYS  27           HB3      LYS  27  11.981  20.071  -5.558
    5    HG2  LYS  27           HG2      LYS  27  13.839  21.572  -4.997
    6    HG3  LYS  27           HG3      LYS  27  14.622  20.284  -4.073
    7    HD2  LYS  27           HD2      LYS  27  14.755  18.904  -6.133
    8    HD3  LYS  27           HD3      LYS  27  14.017  20.218  -7.049
    9    HE2  LYS  27           HE2      LYS  27  15.898  21.700  -6.453
   10    HE3  LYS  27           HE3      LYS  27  16.640  20.390  -5.528
   11    HZ3  LYS  27           HZ1      LYS  27  17.604  20.506  -7.725
   12    HZ2  LYS  27           HZ2      LYS  27  16.070  20.375  -8.449
   13    HZ1  LYS  27           HZ3      LYS  27  16.716  19.068  -7.575

  No H/Q in entry =          13
  In of MODEL   32
    1    H    GLN  28           H        GLN  28  10.021  21.446  -4.526
    2    HA   GLN  28           HA       GLN  28  10.953  24.108  -4.681
    3    HB2  GLN  28           HB2      GLN  28   8.132  23.010  -4.541
    4    HB3  GLN  28           HB3      GLN  28   8.524  24.687  -4.916
    5    HG2  GLN  28           HG2      GLN  28   9.533  22.291  -6.477
    6    HG3  GLN  28           HG3      GLN  28   8.174  23.303  -6.963
    7   HE21  GLN  28          HE21      GLN  28  11.239  22.859  -7.849
    8   HE22  GLN  28          HE22      GLN  28  11.724  24.453  -8.175

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ALA  29           H        ALA  29   9.065  22.390  -2.229
    2    HA   ALA  29           HA       ALA  29   8.513  24.571  -0.534
    3    HB2  ALA  29           HB1      ALA  29   7.817  22.991   1.037
    4    HB1  ALA  29           HB2      ALA  29   9.045  21.820   0.555
    5    HB3  ALA  29           HB3      ALA  29   7.644  22.103  -0.477

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LYS  30           H        LYS  30  11.265  22.331  -0.641
    2    HA   LYS  30           HA       LYS  30  12.599  23.292   1.650
    3    HB2  LYS  30           HB2      LYS  30  13.680  22.024  -0.877
    4    HB3  LYS  30           HB3      LYS  30  14.675  22.389   0.535
    5    HG2  LYS  30           HG2      LYS  30  13.151  20.986   1.927
    6    HG3  LYS  30           HG3      LYS  30  12.253  20.560   0.466
    7    HD2  LYS  30           HD2      LYS  30  14.297  19.597  -0.521
    8    HD3  LYS  30           HD3      LYS  30  15.213  20.037   0.922
    9    HE2  LYS  30           HE2      LYS  30  13.738  18.587   2.289
   10    HE3  LYS  30           HE3      LYS  30  12.852  18.127   0.830
   11    HZ2  LYS  30           HZ1      LYS  30  14.668  16.565   1.565
   12    HZ1  LYS  30           HZ2      LYS  30  15.788  17.764   1.105
   13    HZ3  LYS  30           HZ3      LYS  30  14.746  17.074  -0.050

  No H/Q in entry =          13
  In of MODEL   32
    1    H    GLN  31           H        GLN  31  12.440  24.505  -1.642
    2    HA   GLN  31           HA       GLN  31  14.579  26.418  -1.239
    3    HB2  GLN  31           HB2      GLN  31  12.510  26.451  -3.440
    4    HB3  GLN  31           HB3      GLN  31  14.123  27.163  -3.457
    5    HG2  GLN  31           HG2      GLN  31  14.619  24.470  -2.895
    6    HG3  GLN  31           HG3      GLN  31  13.302  24.407  -4.059
    7   HE21  GLN  31          HE21      GLN  31  16.149  23.643  -4.498
    8   HE22  GLN  31          HE22      GLN  31  16.697  24.626  -5.767

  No H/Q in entry =           8
  In of MODEL   32
    1    H    GLY  32           H        GLY  32  11.520  26.202  -0.059
    2    HA3  GLY  32           HA2      GLY  32  10.362  27.754   1.232
    3    HA2  GLY  32           HA3      GLY  32  11.469  29.003   0.673

  No H/Q in entry =           3
  In of MODEL   32
    1    H    ASP  33           H        ASP  33  10.095  27.092  -1.810
    2    HA   ASP  33           HA       ASP  33   8.399  29.351  -2.639
    3    HB2  ASP  33           HB2      ASP  33   9.500  26.947  -4.102
    4    HB3  ASP  33           HB3      ASP  33   8.329  28.053  -4.815

  No H/Q in entry =           4
  In of MODEL   32
    1    H    PHE  34           H        PHE  34   6.733  28.853  -1.058
    2    HA   PHE  34           HA       PHE  34   5.380  26.367  -0.955
    3    HB2  PHE  34           HB2      PHE  34   4.398  29.142  -0.256
    4    HB3  PHE  34           HB3      PHE  34   3.569  27.642   0.161
    5    HD1  PHE  34           HD1      PHE  34   5.808  30.059   1.357
    6    HD2  PHE  34           HD2      PHE  34   5.171  25.812   1.298
    7    HE1  PHE  34           HE1      PHE  34   7.225  29.817   3.377
    8    HE2  PHE  34           HE2      PHE  34   6.589  25.573   3.316
    9    HZ   PHE  34           HZ       PHE  34   7.610  27.577   4.355

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ALA  35           H        ALA  35   4.897  29.232  -2.952
    2    HA   ALA  35           HA       ALA  35   2.341  28.595  -3.950
    3    HB3  ALA  35           HB1      ALA  35   3.356  30.004  -5.995
    4    HB2  ALA  35           HB2      ALA  35   4.583  30.374  -4.784
    5    HB1  ALA  35           HB3      ALA  35   2.892  30.765  -4.473

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA  36           H        ALA  36   5.561  27.959  -5.343
    2    HA   ALA  36           HA       ALA  36   4.561  26.526  -7.579
    3    HB3  ALA  36           HB1      ALA  36   6.711  26.675  -8.219
    4    HB2  ALA  36           HB2      ALA  36   7.219  25.647  -6.877
    5    HB1  ALA  36           HB3      ALA  36   7.098  27.393  -6.655

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA  37           H        ALA  37   5.564  25.532  -4.339
    2    HA   ALA  37           HA       ALA  37   5.529  22.745  -4.776
    3    HB2  ALA  37           HB1      ALA  37   5.277  24.526  -2.389
    4    HB1  ALA  37           HB2      ALA  37   6.420  23.221  -2.698
    5    HB3  ALA  37           HB3      ALA  37   4.768  22.848  -2.209

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LYS  38           H        LYS  38   2.987  24.923  -3.572
    2    HA   LYS  38           HA       LYS  38   0.909  23.088  -3.331
    3    HB2  LYS  38           HB2      LYS  38   1.235  25.846  -3.076
    4    HB3  LYS  38           HB3      LYS  38   0.023  25.691  -4.341
    5    HG2  LYS  38           HG2      LYS  38  -1.397  24.348  -2.887
    6    HG3  LYS  38           HG3      LYS  38  -0.138  24.297  -1.645
    7    HD2  LYS  38           HD2      LYS  38  -0.343  26.630  -1.188
    8    HD3  LYS  38           HD3      LYS  38  -1.274  26.914  -2.659
    9    HE2  LYS  38           HE2      LYS  38  -2.756  26.927  -0.702
   10    HE3  LYS  38           HE3      LYS  38  -3.127  25.550  -1.744
   11    HZ3  LYS  38           HZ1      LYS  38  -2.369  24.082  -0.224
   12    HZ2  LYS  38           HZ2      LYS  38  -2.720  25.333   0.873
   13    HZ1  LYS  38           HZ3      LYS  38  -1.129  25.100   0.329

  No H/Q in entry =          13
  In of MODEL   32
    1    H    ALA  39           H        ALA  39   1.837  25.009  -6.185
    2    HA   ALA  39           HA       ALA  39  -0.249  24.125  -7.867
    3    HB2  ALA  39           HB1      ALA  39   2.468  24.805  -8.950
    4    HB1  ALA  39           HB2      ALA  39   1.497  26.053  -8.170
    5    HB3  ALA  39           HB3      ALA  39   0.877  25.214  -9.591

  No H/Q in entry =           5
  In of MODEL   32
    1    H    MET  40           H        MET  40   3.008  22.858  -7.328
    2    HA   MET  40           HA       MET  40   2.909  20.843  -9.325
    3    HB2  MET  40           HB2      MET  40   4.547  21.076  -6.794
    4    HB3  MET  40           HB3      MET  40   4.797  19.826  -8.015
    5    HG2  MET  40           HG2      MET  40   4.816  22.785  -8.672
    6    HG3  MET  40           HG3      MET  40   6.277  21.896  -8.242
    7    HE3  MET  40           HE1      MET  40   7.140  19.698 -11.067
    8    HE2  MET  40           HE2      MET  40   6.598  19.368  -9.424
    9    HE1  MET  40           HE3      MET  40   7.676  20.728  -9.732

  No H/Q in entry =           9
  In of MODEL   32
    1    H    MET  41           H        MET  41   2.033  20.865  -5.891
    2    HA   MET  41           HA       MET  41   1.532  18.094  -5.615
    3    HB2  MET  41           HB2      MET  41   0.190  20.434  -4.242
    4    HB3  MET  41           HB3      MET  41   0.058  18.753  -3.738
    5    HG2  MET  41           HG2      MET  41   2.765  19.005  -3.805
    6    HG3  MET  41           HG3      MET  41   2.312  20.657  -3.399
    7    HE2  MET  41           HE1      MET  41  -0.695  19.367  -1.643
    8    HE1  MET  41           HE2      MET  41   0.102  20.890  -2.025
    9    HE3  MET  41           HE3      MET  41   0.068  20.313  -0.358

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ASP  42           H        ASP  42  -0.546  20.800  -6.558
    2    HA   ASP  42           HA       ASP  42  -2.973  19.414  -6.671
    3    HB2  ASP  42           HB2      ASP  42  -2.297  21.992  -6.927
    4    HB3  ASP  42           HB3      ASP  42  -2.463  21.601  -8.635

  No H/Q in entry =           4
  In of MODEL   32
    1    H    GLN  43           H        GLN  43  -0.567  20.038  -9.199
    2    HA   GLN  43           HA       GLN  43  -1.964  18.710 -11.276
    3    HB2  GLN  43           HB2      GLN  43   0.993  19.257 -10.926
    4    HB3  GLN  43           HB3      GLN  43   0.269  18.614 -12.403
    5    HG2  GLN  43           HG2      GLN  43  -1.264  20.625 -12.420
    6    HG3  GLN  43           HG3      GLN  43  -0.304  21.287 -11.101
    7   HE21  GLN  43          HE21      GLN  43  -0.184  22.916 -13.184
    8   HE22  GLN  43          HE22      GLN  43   1.223  22.713 -14.108

  No H/Q in entry =           8
  In of MODEL   32
    1    H    SER  44           H        SER  44   0.426  17.589  -8.916
    2    HA   SER  44           HA       SER  44   0.778  14.989  -9.953
    3    HB2  SER  44           HB2      SER  44   1.682  16.431  -7.722
    4    HB3  SER  44           HB3      SER  44   0.843  15.036  -7.046
    5    HG   SER  44           HG       SER  44   2.955  14.441  -7.498

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ARG  45           H        ARG  45  -1.530  16.275  -7.585
    2    HA   ARG  45           HA       ARG  45  -2.883  13.897  -6.941
    3    HB2  ARG  45           HB2      ARG  45  -3.092  16.059  -5.741
    4    HB3  ARG  45           HB3      ARG  45  -3.971  16.720  -7.116
    5    HG2  ARG  45           HG2      ARG  45  -5.714  14.974  -6.818
    6    HG3  ARG  45           HG3      ARG  45  -4.847  14.367  -5.407
    7    HD2  ARG  45           HD2      ARG  45  -5.067  16.628  -4.341
    8    HD3  ARG  45           HD3      ARG  45  -6.075  17.141  -5.711
    9    HE   ARG  45           HE       ARG  45  -7.147  14.750  -4.666
   10   HH21  ARG  45          HH11      ARG  45  -8.969  14.800  -3.374
   11   HH22  ARG  45          HH12      ARG  45  -9.370  16.233  -2.496
   12   HH11  ARG  45          HH21      ARG  45  -6.626  17.999  -3.638
   13   HH12  ARG  45          HH22      ARG  45  -8.038  18.045  -2.644

  No H/Q in entry =          13
  In of MODEL   32
    1    H    MET  46           H        MET  46  -3.523  16.302  -9.478
    2    HA   MET  46           HA       MET  46  -5.860  15.106 -10.517
    3    HB2  MET  46           HB2      MET  46  -3.791  16.955 -11.719
    4    HB3  MET  46           HB3      MET  46  -5.189  16.393 -12.641
    5    HG2  MET  46           HG2      MET  46  -6.702  17.304 -10.938
    6    HG3  MET  46           HG3      MET  46  -5.330  17.824  -9.969
    7    HE2  MET  46           HE1      MET  46  -5.795  20.329  -9.805
    8    HE1  MET  46           HE2      MET  46  -7.375  19.880 -10.439
    9    HE3  MET  46           HE3      MET  46  -6.526  21.271 -11.112

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ALA  47           H        ALA  47  -2.435  14.669 -11.315
    2    HA   ALA  47           HA       ALA  47  -2.785  12.944 -13.526
    3    HB3  ALA  47           HB1      ALA  47  -0.614  13.858 -13.196
    4    HB2  ALA  47           HB2      ALA  47  -0.449  12.130 -12.869
    5    HB1  ALA  47           HB3      ALA  47  -0.540  13.277 -11.532

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU  48           H        LEU  48  -2.469  12.301 -10.058
    2    HA   LEU  48           HA       LEU  48  -2.532   9.461 -10.224
    3    HB2  LEU  48           HB2      LEU  48  -3.293  11.363  -7.996
    4    HB3  LEU  48           HB3      LEU  48  -3.177   9.613  -7.802
    5    HG   LEU  48           HG       LEU  48  -0.909  11.342  -8.819
    6   HD13  LEU  48          HD11      LEU  48  -1.176  12.103  -6.623
    7   HD12  LEU  48          HD12      LEU  48   0.004  10.808  -6.442
    8   HD11  LEU  48          HD13      LEU  48  -1.686  10.524  -6.026
    9   HD22  LEU  48          HD21      LEU  48  -0.392   9.165  -9.472
   10   HD21  LEU  48          HD22      LEU  48  -1.238   8.435  -8.109
   11   HD23  LEU  48          HD23      LEU  48   0.328   9.206  -7.864

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ASN  49           H        ASN  49  -5.020  11.922  -9.787
    2    HA   ASN  49           HA       ASN  49  -7.179  10.231  -9.229
    3    HB2  ASN  49           HB2      ASN  49  -7.244  12.660  -8.905
    4    HB3  ASN  49           HB3      ASN  49  -7.138  12.913 -10.642
    5   HD21  ASN  49          HD21      ASN  49  -9.224  14.005 -10.658
    6   HD22  ASN  49          HD22      ASN  49 -10.670  13.136 -10.474

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLU  50           H        GLU  50  -5.949  11.451 -12.326
    2    HA   GLU  50           HA       GLU  50  -7.906  10.178 -13.954
    3    HB2  GLU  50           HB2      GLU  50  -6.471  12.017 -14.779
    4    HB3  GLU  50           HB3      GLU  50  -5.063  10.961 -14.659
    5    HG2  GLU  50           HG2      GLU  50  -6.037   9.418 -16.290
    6    HG3  GLU  50           HG3      GLU  50  -7.510  10.380 -16.358

  No H/Q in entry =           6
  In of MODEL   32
    1    H    ALA  51           H        ALA  51  -4.711   9.220 -12.787
    2    HA   ALA  51           HA       ALA  51  -4.558   6.773 -14.214
    3    HB2  ALA  51           HB1      ALA  51  -2.562   6.505 -13.136
    4    HB1  ALA  51           HB2      ALA  51  -3.238   6.915 -11.560
    5    HB3  ALA  51           HB3      ALA  51  -2.810   8.194 -12.695

  No H/Q in entry =           5
  In of MODEL   32
    1    H    HIS  52           H        HIS  52  -5.705   7.581 -10.949
    2    HA   HIS  52           HA       HIS  52  -6.351   4.961 -10.119
    3    HB2  HIS  52           HB2      HIS  52  -6.221   6.869  -8.573
    4    HB3  HIS  52           HB3      HIS  52  -7.639   7.586  -9.337
    5    HD1  HIS  52           HD1      HIS  52  -9.828   5.863  -9.337
    6    HD2  HIS  52           HD2      HIS  52  -6.886   5.233  -6.455
    7    HE1  HIS  52           HE1      HIS  52 -10.893   4.454  -7.523
    8    HE2  HIS  52           HE2      HIS  52  -9.111   4.061  -5.757

  No H/Q in entry =           8
  In of MODEL   32
    1    H    LEU  53           H        LEU  53  -8.219   7.403 -11.879
    2    HA   LEU  53           HA       LEU  53 -10.709   6.082 -11.868
    3    HB2  LEU  53           HB2      LEU  53  -9.468   8.084 -13.743
    4    HB3  LEU  53           HB3      LEU  53 -11.061   7.400 -14.054
    5    HG   LEU  53           HG       LEU  53 -10.337   8.718 -11.417
    6   HD13  LEU  53          HD11      LEU  53 -10.090  10.376 -13.203
    7   HD12  LEU  53          HD12      LEU  53 -11.562  10.701 -12.287
    8   HD11  LEU  53          HD13      LEU  53 -11.655   9.925 -13.866
    9   HD21  LEU  53          HD21      LEU  53 -12.894   7.784 -12.729
   10   HD23  LEU  53          HD22      LEU  53 -12.928   9.071 -11.530
   11   HD22  LEU  53          HD23      LEU  53 -12.341   7.480 -11.088

  No H/Q in entry =          11
  In of MODEL   32
    1    H    VAL  54           H        VAL  54  -7.981   5.923 -14.136
    2    HA   VAL  54           HA       VAL  54  -9.204   4.144 -15.971
    3    HB   VAL  54           HB       VAL  54  -6.295   4.681 -15.318
    4   HG12  VAL  54          HG11      VAL  54  -6.061   3.606 -17.713
    5   HG11  VAL  54          HG12      VAL  54  -7.577   2.806 -17.296
    6   HG13  VAL  54          HG13      VAL  54  -6.147   2.565 -16.293
    7   HG22  VAL  54          HG21      VAL  54  -7.097   6.618 -16.349
    8   HG21  VAL  54          HG22      VAL  54  -8.291   5.745 -17.307
    9   HG23  VAL  54          HG23      VAL  54  -6.589   5.685 -17.756

  No H/Q in entry =           9
  In of MODEL   32
    1    H    GLN  55           H        GLN  55  -7.168   3.611 -13.095
    2    HA   GLN  55           HA       GLN  55  -7.050   0.796 -13.361
    3    HB2  GLN  55           HB2      GLN  55  -5.488   1.705 -11.856
    4    HB3  GLN  55           HB3      GLN  55  -6.706   2.655 -11.010
    5    HG2  GLN  55           HG2      GLN  55  -7.361   0.887  -9.690
    6    HG3  GLN  55           HG3      GLN  55  -7.137  -0.294 -10.975
    7   HE21  GLN  55          HE21      GLN  55  -5.492  -1.727 -10.502
    8   HE22  GLN  55          HE22      GLN  55  -4.102  -1.363  -9.604

  No H/Q in entry =           8
  In of MODEL   32
    1    H    THR  56           H        THR  56  -9.387   2.929 -11.715
    2    HA   THR  56           HA       THR  56 -10.936   1.024 -10.414
    3    HB   THR  56           HB       THR  56 -11.872   3.523 -11.856
    4    HG1  THR  56           HG1      THR  56 -11.897   3.793  -9.264
    5   HG23  THR  56          HG21      THR  56 -13.822   2.244 -11.476
    6   HG22  THR  56          HG22      THR  56 -13.733   3.320 -10.080
    7   HG21  THR  56          HG23      THR  56 -13.225   1.637  -9.933

  No H/Q in entry =           7
  In of MODEL   32
    1    H    LYS  57           H        LYS  57 -11.186   2.115 -13.794
    2    HA   LYS  57           HA       LYS  57 -13.332   0.407 -14.530
    3    HB2  LYS  57           HB2      LYS  57 -12.490   2.371 -15.850
    4    HB3  LYS  57           HB3      LYS  57 -11.046   1.447 -16.237
    5    HG2  LYS  57           HG2      LYS  57 -12.415  -0.248 -17.375
    6    HG3  LYS  57           HG3      LYS  57 -13.877   0.644 -16.969
    7    HD2  LYS  57           HD2      LYS  57 -11.635   1.927 -18.536
    8    HD3  LYS  57           HD3      LYS  57 -12.901   0.998 -19.336
    9    HE2  LYS  57           HE2      LYS  57 -14.595   2.483 -18.150
   10    HE3  LYS  57           HE3      LYS  57 -13.249   3.505 -17.651
   11    HZ2  LYS  57           HZ1      LYS  57 -14.605   3.704 -19.987
   12    HZ1  LYS  57           HZ2      LYS  57 -13.201   2.865 -20.444
   13    HZ3  LYS  57           HZ3      LYS  57 -13.080   4.374 -19.673

  No H/Q in entry =          13
  In of MODEL   32
    1    H    LEU  58           H        LEU  58  -9.823   0.013 -14.511
    2    HA   LEU  58           HA       LEU  58  -9.818  -2.500 -15.807
    3    HB2  LEU  58           HB2      LEU  58  -7.778  -1.191 -14.017
    4    HB3  LEU  58           HB3      LEU  58  -7.510  -2.708 -14.878
    5    HG   LEU  58           HG       LEU  58  -8.306  -0.108 -16.226
    6   HD11  LEU  58          HD11      LEU  58  -5.640  -1.318 -15.566
    7   HD13  LEU  58          HD12      LEU  58  -6.152   0.367 -15.507
    8   HD12  LEU  58          HD13      LEU  58  -5.821  -0.396 -17.059
    9   HD22  LEU  58          HD21      LEU  58  -8.882  -1.672 -17.815
   10   HD21  LEU  58          HD22      LEU  58  -7.821  -2.910 -17.148
   11   HD23  LEU  58          HD23      LEU  58  -7.154  -1.626 -18.157

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  59           H        ILE  59 -10.615  -1.615 -12.545
    2    HA   ILE  59           HA       ILE  59 -10.224  -4.381 -11.609
    3    HB   ILE  59           HB       ILE  59  -9.795  -2.106 -10.210
    4   HG12  ILE  59          HG12      ILE  59 -11.099  -4.493  -8.882
    5   HG13  ILE  59          HG13      ILE  59  -9.460  -4.530  -9.483
    6   HG23  ILE  59          HG21      ILE  59 -11.621  -1.453  -8.871
    7   HG22  ILE  59          HG22      ILE  59 -12.535  -2.899  -9.230
    8   HG21  ILE  59          HG23      ILE  59 -12.351  -1.639 -10.448
    9   HD11  ILE  59          HD11      ILE  59  -8.951  -2.521  -8.087
   10   HD13  ILE  59          HD12      ILE  59  -9.368  -3.944  -7.142
   11   HD12  ILE  59          HD13      ILE  59 -10.557  -2.663  -7.382

  No H/Q in entry =          11
  In of MODEL   32
    1    H    GLU  60           H        GLU  60 -12.815  -2.091 -12.384
    2    HA   GLU  60           HA       GLU  60 -14.972  -3.634 -11.352
    3    HB2  GLU  60           HB2      GLU  60 -15.319  -1.307 -11.891
    4    HB3  GLU  60           HB3      GLU  60 -14.835  -1.570 -13.564
    5    HG2  GLU  60           HG2      GLU  60 -17.157  -3.102 -12.420
    6    HG3  GLU  60           HG3      GLU  60 -17.385  -1.463 -12.994

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLY  61           H        GLY  61 -13.332  -3.593 -14.484
    2    HA3  GLY  61           HA2      GLY  61 -15.029  -5.854 -15.363
    3    HA2  GLY  61           HA3      GLY  61 -14.207  -4.737 -16.446

  No H/Q in entry =           3
  In of MODEL   32
    1    H    ASP  62           H        ASP  62 -12.789  -6.178 -13.580
    2    HA   ASP  62           HA       ASP  62 -10.484  -7.049 -14.995
    3    HB2  ASP  62           HB2      ASP  62  -9.918  -8.112 -12.793
    4    HB3  ASP  62           HB3      ASP  62 -10.318  -6.402 -12.679

  No H/Q in entry =           4
  In of MODEL   32
    1    H    ALA  63           H        ALA  63 -13.555  -8.470 -14.852
    2    HA   ALA  63           HA       ALA  63 -12.688 -11.261 -14.877
    3    HB3  ALA  63           HB1      ALA  63 -15.340  -9.872 -15.391
    4    HB2  ALA  63           HB2      ALA  63 -14.877 -10.788 -13.958
    5    HB1  ALA  63           HB3      ALA  63 -15.135 -11.620 -15.493

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLY  64           H        GLY  64 -13.290 -12.657 -16.707
    2    HA3  GLY  64           HA2      GLY  64 -13.923 -12.552 -19.168
    3    HA2  GLY  64           HA3      GLY  64 -12.646 -11.347 -19.272

  No H/Q in entry =           3
  In of MODEL   32
    1    H    GLU  65           H        GLU  65 -10.755 -12.556 -17.550
    2    HA   GLU  65           HA       GLU  65  -9.511 -14.328 -19.368
    3    HB2  GLU  65           HB2      GLU  65  -8.884 -13.651 -16.497
    4    HB3  GLU  65           HB3      GLU  65  -7.863 -14.682 -17.501
    5    HG2  GLU  65           HG2      GLU  65  -7.599 -12.876 -19.134
    6    HG3  GLU  65           HG3      GLU  65  -8.668 -11.843 -18.189

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLY  66           H        GLY  66 -11.364 -14.844 -16.482
    2    HA3  GLY  66           HA2      GLY  66 -12.045 -17.521 -17.138
    3    HA2  GLY  66           HA3      GLY  66 -10.869 -17.481 -15.839

  No H/Q in entry =           3
  In of MODEL   32
    1    H    LYS  67           H        LYS  67 -12.701 -18.631 -14.798
    2    HA   LYS  67           HA       LYS  67 -15.156 -17.544 -14.183
    3    HB2  LYS  67           HB2      LYS  67 -13.426 -19.432 -12.593
    4    HB3  LYS  67           HB3      LYS  67 -15.125 -19.102 -12.230
    5    HG2  LYS  67           HG2      LYS  67 -15.761 -19.804 -14.505
    6    HG3  LYS  67           HG3      LYS  67 -14.069 -20.117 -14.887
    7    HD2  LYS  67           HD2      LYS  67 -13.982 -21.848 -13.136
    8    HD3  LYS  67           HD3      LYS  67 -15.672 -21.528 -12.735
    9    HE2  LYS  67           HE2      LYS  67 -16.339 -22.147 -15.032
   10    HE3  LYS  67           HE3      LYS  67 -14.652 -22.470 -15.433
   11    HZ3  LYS  67           HZ1      LYS  67 -14.748 -24.447 -14.454
   12    HZ2  LYS  67           HZ2      LYS  67 -16.434 -24.258 -14.401
   13    HZ1  LYS  67           HZ3      LYS  67 -15.484 -23.827 -13.059

  No H/Q in entry =          13
  In of MODEL   32
    1    H    MET  68           H        MET  68 -12.730 -17.824 -11.672
    2    HA   MET  68           HA       MET  68 -13.677 -15.333 -10.429
    3    HB2  MET  68           HB2      MET  68 -12.166 -17.683  -9.284
    4    HB3  MET  68           HB3      MET  68 -12.640 -16.247  -8.376
    5    HG2  MET  68           HG2      MET  68 -14.555 -18.099  -9.823
    6    HG3  MET  68           HG3      MET  68 -14.268 -18.094  -8.081
    7    HE1  MET  68           HE1      MET  68 -14.692 -16.482  -6.546
    8    HE3  MET  68           HE2      MET  68 -15.779 -15.098  -6.648
    9    HE2  MET  68           HE3      MET  68 -14.119 -14.950  -7.223

  No H/Q in entry =           9
  In of MODEL   32
    1    H    LYS  69           H        LYS  69 -11.075 -16.302 -12.316
    2    HA   LYS  69           HA       LYS  69  -9.014 -14.900 -10.874
    3    HB2  LYS  69           HB2      LYS  69  -8.504 -16.909 -12.176
    4    HB3  LYS  69           HB3      LYS  69  -8.959 -16.068 -13.660
    5    HG2  LYS  69           HG2      LYS  69  -7.189 -14.413 -13.301
    6    HG3  LYS  69           HG3      LYS  69  -6.766 -15.169 -11.767
    7    HD2  LYS  69           HD2      LYS  69  -6.170 -17.250 -12.959
    8    HD3  LYS  69           HD3      LYS  69  -6.572 -16.480 -14.494
    9    HE2  LYS  69           HE2      LYS  69  -4.840 -14.776 -14.112
   10    HE3  LYS  69           HE3      LYS  69  -4.452 -15.507 -12.556
   11    HZ2  LYS  69           HZ1      LYS  69  -2.957 -16.189 -14.384
   12    HZ1  LYS  69           HZ2      LYS  69  -4.278 -16.929 -15.154
   13    HZ3  LYS  69           HZ3      LYS  69  -3.747 -17.493 -13.642

  No H/Q in entry =          13
  In of MODEL   32
    1    H    VAL  70           H        VAL  70  -7.733 -13.119 -11.575
    2    HA   VAL  70           HA       VAL  70  -9.097 -11.249 -13.432
    3    HB   VAL  70           HB       VAL  70  -8.274  -9.427 -11.945
    4   HG13  VAL  70          HG11      VAL  70  -9.999  -9.711 -10.270
    5   HG12  VAL  70          HG12      VAL  70  -9.966 -11.463 -10.471
    6   HG11  VAL  70          HG13      VAL  70 -10.579 -10.438 -11.768
    7   HG23  VAL  70          HG21      VAL  70  -7.601 -10.161  -9.589
    8   HG22  VAL  70          HG22      VAL  70  -6.407 -10.476 -10.846
    9   HG21  VAL  70          HG23      VAL  70  -7.414 -11.789 -10.238

  No H/Q in entry =           9
  In of MODEL   32
    1    H    SER  71           H        SER  71  -7.584  -9.545 -14.238
    2    HA   SER  71           HA       SER  71  -5.346 -10.663 -15.546
    3    HB2  SER  71           HB2      SER  71  -6.581  -8.647 -16.342
    4    HB3  SER  71           HB3      SER  71  -5.917  -7.740 -14.986
    5    HG   SER  71           HG       SER  71  -4.637  -7.477 -16.842

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU  72           H        LEU  72  -3.298 -10.914 -14.940
    2    HA   LEU  72           HA       LEU  72  -2.552 -10.698 -12.236
    3    HB2  LEU  72           HB2      LEU  72  -0.919 -11.103 -14.737
    4    HB3  LEU  72           HB3      LEU  72  -0.240 -11.174 -13.114
    5    HG   LEU  72           HG       LEU  72  -2.588 -12.885 -13.993
    6   HD13  LEU  72          HD11      LEU  72  -1.010 -14.693 -14.343
    7   HD12  LEU  72          HD12      LEU  72   0.333 -13.678 -13.819
    8   HD11  LEU  72          HD13      LEU  72  -0.502 -13.323 -15.331
    9   HD22  LEU  72          HD21      LEU  72  -2.546 -12.898 -11.640
   10   HD21  LEU  72          HD22      LEU  72  -0.796 -12.778 -11.560
   11   HD23  LEU  72          HD23      LEU  72  -1.552 -14.295 -12.038

  No H/Q in entry =          11
  In of MODEL   32
    1    H    VAL  73           H        VAL  73  -1.885  -8.668 -15.019
    2    HA   VAL  73           HA       VAL  73   0.030  -6.952 -13.932
    3    HB   VAL  73           HB       VAL  73  -0.402  -5.531 -15.780
    4   HG12  VAL  73          HG11      VAL  73  -1.180  -8.327 -16.652
    5   HG11  VAL  73          HG12      VAL  73   0.472  -7.838 -16.273
    6   HG13  VAL  73          HG13      VAL  73  -0.378  -7.096 -17.627
    7   HG22  VAL  73          HG21      VAL  73  -2.675  -5.039 -15.796
    8   HG21  VAL  73          HG22      VAL  73  -3.144  -6.727 -15.592
    9   HG23  VAL  73          HG23      VAL  73  -2.575  -6.153 -17.160

  No H/Q in entry =           9
  In of MODEL   32
    1    H    LEU  74           H        LEU  74  -3.360  -7.104 -13.339
    2    HA   LEU  74           HA       LEU  74  -3.999  -4.455 -12.715
    3    HB2  LEU  74           HB2      LEU  74  -5.713  -6.138 -12.875
    4    HB3  LEU  74           HB3      LEU  74  -4.999  -7.057 -11.552
    5    HG   LEU  74           HG       LEU  74  -5.467  -5.190 -10.001
    6   HD11  LEU  74          HD11      LEU  74  -6.503  -3.928 -12.542
    7   HD13  LEU  74          HD12      LEU  74  -5.381  -3.249 -11.363
    8   HD12  LEU  74          HD13      LEU  74  -7.089  -3.419 -10.958
    9   HD23  LEU  74          HD21      LEU  74  -8.029  -5.637 -11.444
   10   HD22  LEU  74          HD22      LEU  74  -7.647  -5.776  -9.742
   11   HD21  LEU  74          HD23      LEU  74  -7.160  -7.044 -10.841

  No H/Q in entry =          11
  In of MODEL   32
    1    H    VAL  75           H        VAL  75  -2.910  -7.036 -10.570
    2    HA   VAL  75           HA       VAL  75  -2.703  -5.488  -8.225
    3    HB   VAL  75           HB       VAL  75  -1.189  -7.966  -9.036
    4   HG11  VAL  75          HG11      VAL  75  -1.383  -6.501  -6.366
    5   HG13  VAL  75          HG12      VAL  75   0.071  -6.748  -7.321
    6   HG12  VAL  75          HG13      VAL  75  -0.722  -8.121  -6.568
    7   HG21  VAL  75          HG21      VAL  75  -3.644  -7.406  -7.338
    8   HG23  VAL  75          HG22      VAL  75  -2.824  -8.966  -7.378
    9   HG22  VAL  75          HG23      VAL  75  -3.586  -8.331  -8.839

  No H/Q in entry =           9
  In of MODEL   32
    1    H    GLU  76           H        GLU  76  -0.313  -6.219 -10.787
    2    HA   GLU  76           HA       GLU  76   1.871  -4.852  -9.649
    3    HB2  GLU  76           HB2      GLU  76   2.024  -6.332 -11.655
    4    HB3  GLU  76           HB3      GLU  76   1.155  -5.127 -12.591
    5    HG2  GLU  76           HG2      GLU  76   2.972  -3.499 -12.208
    6    HG3  GLU  76           HG3      GLU  76   3.860  -4.681 -11.266

  No H/Q in entry =           6
  In of MODEL   32
    1    H    ALA  77           H        ALA  77  -0.695  -3.671 -11.809
    2    HA   ALA  77           HA       ALA  77   0.267  -1.015 -11.989
    3    HB1  ALA  77           HB1      ALA  77  -1.527  -2.163 -13.422
    4    HB2  ALA  77           HB2      ALA  77  -1.827  -0.484 -12.968
    5    HB3  ALA  77           HB3      ALA  77  -2.649  -1.789 -12.112

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLN  78           H        GLN  78  -1.963  -2.598  -9.759
    2    HA   GLN  78           HA       GLN  78  -2.780  -0.291  -8.344
    3    HB2  GLN  78           HB2      GLN  78  -3.865  -2.563  -8.253
    4    HB3  GLN  78           HB3      GLN  78  -2.513  -3.110  -7.265
    5    HG2  GLN  78           HG2      GLN  78  -3.033  -1.377  -5.595
    6    HG3  GLN  78           HG3      GLN  78  -4.388  -0.831  -6.580
    7   HE21  GLN  78          HE21      GLN  78  -4.840  -1.793  -3.933
    8   HE22  GLN  78          HE22      GLN  78  -5.671  -3.270  -4.031

  No H/Q in entry =           8
  In of MODEL   32
    1    H    LEU  79           H        LEU  79  -0.073  -2.520  -7.926
    2    HA   LEU  79           HA       LEU  79   0.918  -1.618  -5.477
    3    HB2  LEU  79           HB2      LEU  79   1.799  -3.615  -6.558
    4    HB3  LEU  79           HB3      LEU  79   2.421  -2.653  -7.895
    5    HG   LEU  79           HG       LEU  79   3.979  -1.501  -6.405
    6   HD13  LEU  79          HD11      LEU  79   2.993  -1.271  -4.327
    7   HD12  LEU  79          HD12      LEU  79   4.090  -2.609  -3.997
    8   HD11  LEU  79          HD13      LEU  79   2.384  -2.926  -4.310
    9   HD23  LEU  79          HD21      LEU  79   5.222  -3.637  -5.518
   10   HD22  LEU  79          HD22      LEU  79   4.999  -3.437  -7.254
   11   HD21  LEU  79          HD23      LEU  79   3.942  -4.520  -6.353

  No H/Q in entry =          11
  In of MODEL   32
    1    H    HIS  80           H        HIS  80   1.743  -0.484  -8.756
    2    HA   HIS  80           HA       HIS  80   3.538   1.521  -7.847
    3    HB2  HIS  80           HB2      HIS  80   2.230   0.818 -10.418
    4    HB3  HIS  80           HB3      HIS  80   2.808   2.476 -10.250
    5    HD1  HIS  80           HD1      HIS  80   5.201   2.805 -10.795
    6    HD2  HIS  80           HD2      HIS  80   4.438  -1.118  -9.605
    7    HE1  HIS  80           HE1      HIS  80   7.403   1.553 -10.986
    8    HE2  HIS  80           HE2      HIS  80   6.949  -0.841 -10.263

  No H/Q in entry =           8
  In of MODEL   32
    1    H    LEU  81           H        LEU  81   0.122   1.644  -8.793
    2    HA   LEU  81           HA       LEU  81  -0.182   4.433  -8.453
    3    HB2  LEU  81           HB2      LEU  81  -2.169   2.164  -8.359
    4    HB3  LEU  81           HB3      LEU  81  -2.640   3.861  -8.259
    5    HG   LEU  81           HG       LEU  81  -0.956   2.736 -10.514
    6   HD12  LEU  81          HD11      LEU  81  -3.205   3.032 -11.790
    7   HD11  LEU  81          HD12      LEU  81  -3.944   2.951 -10.191
    8   HD13  LEU  81          HD13      LEU  81  -2.991   1.596 -10.791
    9   HD23  LEU  81          HD21      LEU  81  -2.089   4.870 -11.595
   10   HD22  LEU  81          HD22      LEU  81  -0.665   5.055 -10.576
   11   HD21  LEU  81          HD23      LEU  81  -2.267   5.383  -9.919

  No H/Q in entry =          11
  In of MODEL   32
    1    H    MET  82           H        MET  82  -0.787   1.733  -6.204
    2    HA   MET  82           HA       MET  82  -1.837   3.302  -4.103
    3    HB2  MET  82           HB2      MET  82  -0.431   0.632  -4.162
    4    HB3  MET  82           HB3      MET  82  -1.004   1.347  -2.657
    5    HG2  MET  82           HG2      MET  82  -2.754   0.837  -5.082
    6    HG3  MET  82           HG3      MET  82  -2.650  -0.239  -3.690
    7    HE3  MET  82           HE1      MET  82  -4.364   1.383  -0.854
    8    HE2  MET  82           HE2      MET  82  -2.640   1.683  -1.055
    9    HE1  MET  82           HE3      MET  82  -3.313   0.118  -1.506

  No H/Q in entry =           9
  In of MODEL   32
    1    H    THR  83           H        THR  83   1.470   2.258  -4.827
    2    HA   THR  83           HA       THR  83   2.696   3.372  -2.536
    3    HB   THR  83           HB       THR  83   4.777   3.346  -4.030
    4    HG1  THR  83           HG1      THR  83   4.524   2.821  -6.053
    5   HG22  THR  83          HG21      THR  83   4.363   0.683  -4.364
    6   HG21  THR  83          HG22      THR  83   3.080   1.044  -3.211
    7   HG23  THR  83          HG23      THR  83   4.759   1.408  -2.807

  No H/Q in entry =           7
  In of MODEL   32
    1    H    SER  84           H        SER  84   2.277   4.655  -5.829
    2    HA   SER  84           HA       SER  84   3.591   7.110  -5.382
    3    HB2  SER  84           HB2      SER  84   1.511   6.257  -7.382
    4    HB3  SER  84           HB3      SER  84   2.170   7.892  -7.360
    5    HG   SER  84           HG       SER  84   3.570   5.435  -7.671

  No H/Q in entry =           5
  In of MODEL   32
    1    H    MET  85           H        MET  85   0.108   6.310  -5.177
    2    HA   MET  85           HA       MET  85  -0.779   8.908  -4.561
    3    HB2  MET  85           HB2      MET  85  -2.288   7.086  -5.220
    4    HB3  MET  85           HB3      MET  85  -1.971   6.275  -3.688
    5    HG2  MET  85           HG2      MET  85  -2.880   8.202  -2.459
    6    HG3  MET  85           HG3      MET  85  -3.154   9.052  -3.978
    7    HE2  MET  85           HE1      MET  85  -5.290   5.556  -2.095
    8    HE1  MET  85           HE2      MET  85  -3.608   6.058  -1.929
    9    HE3  MET  85           HE3      MET  85  -4.076   4.996  -3.253

  No H/Q in entry =           9
  In of MODEL   32
    1    H    LEU  86           H        LEU  86   0.194   6.252  -2.433
    2    HA   LEU  86           HA       LEU  86  -0.331   7.543   0.017
    3    HB2  LEU  86           HB2      LEU  86   0.158   5.078  -0.388
    4    HB3  LEU  86           HB3      LEU  86   1.859   5.528  -0.498
    5    HG   LEU  86           HG       LEU  86   1.543   6.680   1.776
    6   HD11  LEU  86          HD11      LEU  86  -1.146   5.884   1.329
    7   HD13  LEU  86          HD12      LEU  86  -0.475   6.635   2.775
    8   HD12  LEU  86          HD13      LEU  86  -0.547   4.878   2.652
    9   HD23  LEU  86          HD21      LEU  86   1.150   3.682   1.894
   10   HD22  LEU  86          HD22      LEU  86   2.151   4.701   2.927
   11   HD21  LEU  86          HD23      LEU  86   2.640   4.386   1.263

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ALA  87           H        ALA  87   2.634   7.287  -1.903
    2    HA   ALA  87           HA       ALA  87   4.341   8.712  -0.191
    3    HB3  ALA  87           HB1      ALA  87   4.421   7.707  -2.902
    4    HB2  ALA  87           HB2      ALA  87   5.762   8.050  -1.813
    5    HB1  ALA  87           HB3      ALA  87   5.123   9.326  -2.848

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ARG  88           H        ARG  88   2.355   9.833  -2.889
    2    HA   ARG  88           HA       ARG  88   3.101  12.531  -2.772
    3    HB2  ARG  88           HB2      ARG  88   1.841  11.370  -4.620
    4    HB3  ARG  88           HB3      ARG  88   0.392  11.495  -3.622
    5    HG2  ARG  88           HG2      ARG  88   1.385  14.086  -3.542
    6    HG3  ARG  88           HG3      ARG  88   1.798  13.580  -5.178
    7    HD2  ARG  88           HD2      ARG  88  -0.350  13.640  -5.854
    8    HD3  ARG  88           HD3      ARG  88  -0.914  12.777  -4.422
    9    HE   ARG  88           HE       ARG  88  -1.136  15.554  -4.831
   10   HH21  ARG  88          HH11      ARG  88  -1.660  16.873  -3.084
   11   HH22  ARG  88          HH12      ARG  88  -1.342  16.335  -1.471
   12   HH11  ARG  88          HH21      ARG  88  -0.074  13.296  -2.473
   13   HH12  ARG  88          HH22      ARG  88  -0.461  14.303  -1.125

  No H/Q in entry =          13
  In of MODEL   32
    1    H    GLU  89           H        GLU  89   0.432  10.825  -1.110
    2    HA   GLU  89           HA       GLU  89  -0.687  13.122   0.113
    3    HB2  GLU  89           HB2      GLU  89  -1.783  10.872   0.031
    4    HB3  GLU  89           HB3      GLU  89  -0.641  10.324   1.259
    5    HG2  GLU  89           HG2      GLU  89  -1.462  12.010   2.831
    6    HG3  GLU  89           HG3      GLU  89  -2.533  12.674   1.600

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LEU  90           H        LEU  90   1.799  10.851   1.255
    2    HA   LEU  90           HA       LEU  90   2.168  12.091   3.785
    3    HB2  LEU  90           HB2      LEU  90   3.941  10.339   2.085
    4    HB3  LEU  90           HB3      LEU  90   4.372  10.855   3.720
    5    HG   LEU  90           HG       LEU  90   1.744   9.486   3.082
    6   HD12  LEU  90          HD11      LEU  90   2.913   7.448   4.073
    7   HD11  LEU  90          HD12      LEU  90   4.425   8.319   3.818
    8   HD13  LEU  90          HD13      LEU  90   3.402   7.906   2.440
    9   HD22  LEU  90          HD21      LEU  90   1.492  10.401   5.209
   10   HD21  LEU  90          HD22      LEU  90   3.215  10.309   5.574
   11   HD23  LEU  90          HD23      LEU  90   2.222   8.852   5.628

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  91           H        ILE  91   3.736  12.498   0.643
    2    HA   ILE  91           HA       ILE  91   5.705  14.345   1.468
    3    HB   ILE  91           HB       ILE  91   4.370  13.850  -1.200
    4   HG12  ILE  91          HG12      ILE  91   7.217  13.385  -0.257
    5   HG13  ILE  91          HG13      ILE  91   5.948  12.176  -0.085
    6   HG22  ILE  91          HG21      ILE  91   6.574  15.219  -1.908
    7   HG21  ILE  91          HG22      ILE  91   6.272  16.012  -0.361
    8   HG23  ILE  91          HG23      ILE  91   5.036  16.033  -1.617
    9   HD13  ILE  91          HD11      ILE  91   5.754  11.857  -2.391
   10   HD12  ILE  91          HD12      ILE  91   7.488  12.115  -2.194
   11   HD11  ILE  91          HD13      ILE  91   6.460  13.431  -2.766

  No H/Q in entry =          11
  In of MODEL   32
    1    H    THR  92           H        THR  92   2.329  14.750   0.495
    2    HA   THR  92           HA       THR  92   2.277  17.573   0.444
    3    HB   THR  92           HB       THR  92   0.135  15.557   1.159
    4    HG1  THR  92           HG1      THR  92   0.419  15.387  -0.930
    5   HG22  THR  92          HG21      THR  92  -1.292  17.709   0.458
    6   HG21  THR  92          HG22      THR  92   0.100  18.544   1.143
    7   HG23  THR  92          HG23      THR  92  -0.822  17.412   2.131

  No H/Q in entry =           7
  In of MODEL   32
    1    H    GLU  93           H        GLU  93   1.776  15.260   3.096
    2    HA   GLU  93           HA       GLU  93   1.248  17.154   5.125
    3    HB2  GLU  93           HB2      GLU  93   2.587  14.440   5.340
    4    HB3  GLU  93           HB3      GLU  93   1.902  15.357   6.683
    5    HG2  GLU  93           HG2      GLU  93   0.272  14.572   4.258
    6    HG3  GLU  93           HG3      GLU  93   0.397  13.546   5.682

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LEU  94           H        LEU  94   4.256  15.701   3.941
    2    HA   LEU  94           HA       LEU  94   6.016  16.858   5.814
    3    HB2  LEU  94           HB2      LEU  94   6.396  15.903   2.976
    4    HB3  LEU  94           HB3      LEU  94   7.730  16.569   3.914
    5    HG   LEU  94           HG       LEU  94   6.021  14.355   5.060
    6   HD11  LEU  94          HD11      LEU  94   8.096  14.153   2.907
    7   HD13  LEU  94          HD12      LEU  94   6.661  13.166   3.180
    8   HD12  LEU  94          HD13      LEU  94   8.099  12.923   4.172
    9   HD23  LEU  94          HD21      LEU  94   8.227  13.834   6.189
   10   HD22  LEU  94          HD22      LEU  94   7.551  15.405   6.617
   11   HD21  LEU  94          HD23      LEU  94   8.879  15.299   5.460

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  95           H        ILE  95   4.834  18.029   2.680
    2    HA   ILE  95           HA       ILE  95   6.385  20.400   2.611
    3    HB   ILE  95           HB       ILE  95   3.734  19.697   1.331
    4   HG12  ILE  95          HG12      ILE  95   6.508  20.062   0.166
    5   HG13  ILE  95          HG13      ILE  95   5.877  18.502   0.683
    6   HG21  ILE  95          HG21      ILE  95   5.460  22.180   1.100
    7   HG23  ILE  95          HG22      ILE  95   3.739  22.097   1.473
    8   HG22  ILE  95          HG23      ILE  95   4.309  21.706  -0.150
    9   HD13  ILE  95          HD11      ILE  95   4.301  18.418  -1.030
   10   HD12  ILE  95          HD12      ILE  95   5.634  19.249  -1.830
   11   HD11  ILE  95          HD13      ILE  95   4.260  20.171  -1.220

  No H/Q in entry =          11
  In of MODEL   32
    1    H    GLU  96           H        GLU  96   3.156  19.717   3.937
    2    HA   GLU  96           HA       GLU  96   2.521  22.356   4.703
    3    HB2  GLU  96           HB2      GLU  96   0.861  20.559   4.726
    4    HB3  GLU  96           HB3      GLU  96   1.743  19.735   6.010
    5    HG2  GLU  96           HG2      GLU  96   0.728  21.005   7.594
    6    HG3  GLU  96           HG3      GLU  96   1.243  22.486   6.796

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LEU  97           H        LEU  97   4.401  19.816   6.301
    2    HA   LEU  97           HA       LEU  97   4.773  21.160   8.772
    3    HB2  LEU  97           HB2      LEU  97   6.313  19.008   7.336
    4    HB3  LEU  97           HB3      LEU  97   6.913  19.694   8.844
    5    HG   LEU  97           HG       LEU  97   4.109  18.578   8.559
    6   HD12  LEU  97          HD11      LEU  97   5.078  16.570   9.756
    7   HD11  LEU  97          HD12      LEU  97   6.681  17.215   9.397
    8   HD13  LEU  97          HD13      LEU  97   5.601  16.752   8.081
    9   HD23  LEU  97          HD21      LEU  97   4.591  18.280  11.118
   10   HD22  LEU  97          HD22      LEU  97   4.191  19.890  10.522
   11   HD21  LEU  97          HD23      LEU  97   5.870  19.463  10.848

  No H/Q in entry =          11
  In of MODEL   32
    1    H    HIS  98           H        HIS  98   6.612  21.200   5.728
    2    HA   HIS  98           HA       HIS  98   8.762  22.795   6.610
    3    HB2  HIS  98           HB2      HIS  98   7.443  22.537   3.897
    4    HB3  HIS  98           HB3      HIS  98   8.878  23.526   4.175
    5    HD1  HIS  98           HD1      HIS  98   7.696  19.946   4.197
    6    HD2  HIS  98           HD2      HIS  98  11.264  22.069   4.591
    7    HE1  HIS  98           HE1      HIS  98   9.563  18.231   4.116
    8    HE2  HIS  98           HE2      HIS  98  11.741  19.504   4.356

  No H/Q in entry =           8
  In of MODEL   32
    1    H    GLU  99           H        GLU  99   5.523  23.608   5.470
    2    HA   GLU  99           HA       GLU  99   5.879  26.426   5.417
    3    HB2  GLU  99           HB2      GLU  99   3.998  25.245   4.302
    4    HB3  GLU  99           HB3      GLU  99   3.321  24.874   5.887
    5    HG2  GLU  99           HG2      GLU  99   3.127  27.262   6.397
    6    HG3  GLU  99           HG3      GLU  99   3.885  27.673   4.861

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LYS 100           H        LYS 100   4.792  24.174   7.943
    2    HA   LYS 100           HA       LYS 100   4.209  26.218   9.849
    3    HB2  LYS 100           HB2      LYS 100   4.810  23.270  10.180
    4    HB3  LYS 100           HB3      LYS 100   4.368  24.336  11.520
    5    HG2  LYS 100           HG2      LYS 100   2.285  24.961  10.295
    6    HG3  LYS 100           HG3      LYS 100   2.708  23.799   9.035
    7    HD2  LYS 100           HD2      LYS 100   2.661  21.973  10.691
    8    HD3  LYS 100           HD3      LYS 100   2.255  23.129  11.962
    9    HE2  LYS 100           HE2      LYS 100   0.185  23.738  10.722
   10    HE3  LYS 100           HE3      LYS 100   0.582  22.525   9.499
   11    HZ1  LYS 100           HZ1      LYS 100   0.350  21.848  12.380
   12    HZ3  LYS 100           HZ2      LYS 100   0.329  20.798  11.042
   13    HZ2  LYS 100           HZ3      LYS 100  -0.991  21.826  11.339

  No H/Q in entry =          13
  In of MODEL   32
    1    H    LEU 101           H        LEU 101   7.137  24.447   8.980
    2    HA   LEU 101           HA       LEU 101   8.752  25.292  11.170
    3    HB2  LEU 101           HB2      LEU 101   9.325  24.318   8.383
    4    HB3  LEU 101           HB3      LEU 101  10.632  24.990   9.353
    5    HG   LEU 101           HG       LEU 101   8.827  22.817  10.429
    6   HD12  LEU 101          HD11      LEU 101  10.886  21.339   9.795
    7   HD11  LEU 101          HD12      LEU 101  11.231  22.609   8.623
    8   HD13  LEU 101          HD13      LEU 101   9.708  21.725   8.542
    9   HD21  LEU 101          HD21      LEU 101  11.550  23.943  11.132
   10   HD23  LEU 101          HD22      LEU 101  11.024  22.365  11.713
   11   HD22  LEU 101          HD23      LEU 101  10.126  23.813  12.164

  No H/Q in entry =          11
  In of MODEL   32
    1    H    LYS 102           H        LYS 102   7.133  27.151   9.051
    2    HA   LYS 102           HA       LYS 102   7.191  29.445   8.765
    3    HB2  LYS 102           HB2      LYS 102   8.778  29.335  10.847
    4    HB3  LYS 102           HB3      LYS 102  10.064  29.542   9.675
    5    HG2  LYS 102           HG2      LYS 102   7.954  31.477  10.565
    6    HG3  LYS 102           HG3      LYS 102   9.662  31.750  10.297
    7    HD2  LYS 102           HD2      LYS 102   7.690  31.320   8.015
    8    HD3  LYS 102           HD3      LYS 102   8.069  32.900   8.685
    9    HE2  LYS 102           HE2      LYS 102   9.429  31.732   6.594
   10    HE3  LYS 102           HE3      LYS 102  10.047  33.040   7.603
   11    HZ2  LYS 102           HZ1      LYS 102  11.579  31.146   7.406
   12    HZ1  LYS 102           HZ2      LYS 102  10.431  30.153   8.157
   13    HZ3  LYS 102           HZ3      LYS 102  11.123  31.443   9.013

  No H/Q in entry =          13
  In of MODEL   32
    1    H    ALA 103           H        ALA 103  10.452  28.130   8.164
    2    HA   ALA 103           HA       ALA 103  11.385  29.520   6.082
    3    HB2  ALA 103           HB1      ALA 103  12.276  27.315   5.139
    4    HB1  ALA 103           HB2      ALA 103  11.400  26.531   6.452
    5    HB3  ALA 103           HB3      ALA 103  12.685  27.683   6.815

  No H/Q in entry =           5
  In of MODEL   32
    1    H1   LYS   3           H1       LYS   3 -30.848   5.879 -20.183
    2    H2   LYS   3           H3       LYS   3 -29.831   5.539 -21.500
    3    H3   LYS   3           H2       LYS   3 -31.239   4.624 -21.256
    4    HA   LYS   3           HA       LYS   3 -30.284   3.271 -19.787
    5    HB2  LYS   3           HB2      LYS   3 -27.959   4.619 -21.107
    6    HB3  LYS   3           HB3      LYS   3 -27.675   3.448 -19.819
    7    HG2  LYS   3           HG2      LYS   3 -29.080   1.833 -21.153
    8    HG3  LYS   3           HG3      LYS   3 -28.993   2.992 -22.479
    9    HD2  LYS   3           HD2      LYS   3 -26.513   2.857 -22.365
   10    HD3  LYS   3           HD3      LYS   3 -26.673   1.597 -21.142
   11    HE2  LYS   3           HE2      LYS   3 -28.142   0.382 -22.857
   12    HE3  LYS   3           HE3      LYS   3 -27.484   1.518 -24.033
   13    HZ3  LYS   3           HZ1      LYS   3 -25.691   0.264 -24.220
   14    HZ2  LYS   3           HZ2      LYS   3 -26.358  -0.864 -23.140
   15    HZ1  LYS   3           HZ3      LYS   3 -25.370   0.389 -22.558

  No H/Q in entry =          15
  In of MODEL   32
    1    H    LYS   4           H        LYS   4 -30.388   3.194 -17.724
    2    HA   LYS   4           HA       LYS   4 -29.673   5.524 -16.128
    3    HB2  LYS   4           HB2      LYS   4 -30.919   2.867 -15.374
    4    HB3  LYS   4           HB3      LYS   4 -30.710   4.237 -14.285
    5    HG2  LYS   4           HG2      LYS   4 -32.461   4.117 -16.747
    6    HG3  LYS   4           HG3      LYS   4 -32.991   4.226 -15.069
    7    HD2  LYS   4           HD2      LYS   4 -32.277   6.449 -14.855
    8    HD3  LYS   4           HD3      LYS   4 -31.205   6.334 -16.250
    9    HE2  LYS   4           HE2      LYS   4 -33.104   7.713 -16.802
   10    HE3  LYS   4           HE3      LYS   4 -33.177   6.212 -17.725
   11    HZ3  LYS   4           HZ1      LYS   4 -34.799   5.365 -16.189
   12    HZ2  LYS   4           HZ2      LYS   4 -35.324   6.847 -16.832
   13    HZ1  LYS   4           HZ3      LYS   4 -34.705   6.779 -15.251

  No H/Q in entry =          13
  In of MODEL   32
    1    H    HIS   5           H        HIS   5 -28.241   5.643 -14.505
    2    HA   HIS   5           HA       HIS   5 -25.974   3.779 -14.724
    3    HB2  HIS   5           HB2      HIS   5 -26.224   6.574 -13.611
    4    HB3  HIS   5           HB3      HIS   5 -24.754   5.603 -13.529
    5    HD1  HIS   5           HD1      HIS   5 -23.232   6.735 -15.119
    6    HD2  HIS   5           HD2      HIS   5 -27.004   6.110 -16.744
    7    HE1  HIS   5           HE1      HIS   5 -23.001   7.237 -17.582
    8    HE2  HIS   5           HE2      HIS   5 -25.300   6.844 -18.541

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ILE   6           H        ILE   6 -25.795   2.247 -13.354
    2    HA   ILE   6           HA       ILE   6 -26.833   2.612 -10.624
    3    HB   ILE   6           HB       ILE   6 -26.003   0.089 -12.064
    4   HG12  ILE   6          HG12      ILE   6 -28.753   1.085 -11.308
    5   HG13  ILE   6          HG13      ILE   6 -28.070   1.187 -12.931
    6   HG23  ILE   6          HG21      ILE   6 -26.436  -1.099 -10.175
    7   HG22  ILE   6          HG22      ILE   6 -27.594   0.081  -9.559
    8   HG21  ILE   6          HG23      ILE   6 -25.863   0.399  -9.439
    9   HD13  ILE   6          HD11      ILE   6 -28.545  -0.941 -13.376
   10   HD12  ILE   6          HD12      ILE   6 -29.594  -0.866 -11.960
   11   HD11  ILE   6          HD13      ILE   6 -27.951  -1.491 -11.809

  No H/Q in entry =          11
  In of MODEL   32
    1    H    TYR   7           H        TYR   7 -25.096   3.272  -9.316
    2    HA   TYR   7           HA       TYR   7 -22.383   2.261  -9.900
    3    HB2  TYR   7           HB2      TYR   7 -23.348   4.752  -8.519
    4    HB3  TYR   7           HB3      TYR   7 -21.671   4.216  -8.501
    5    HD1  TYR   7           HD1      TYR   7 -22.649   3.189 -11.585
    6    HD2  TYR   7           HD2      TYR   7 -21.985   6.821  -9.456
    7    HE1  TYR   7           HE1      TYR   7 -22.152   4.346 -13.702
    8    HE2  TYR   7           HE2      TYR   7 -21.530   7.985 -11.566
    9    HH   TYR   7           HH       TYR   7 -21.696   7.831 -13.799

  No H/Q in entry =           9
  In of MODEL   32
    1    H    LEU   8           H        LEU   8 -21.467   0.940  -8.506
    2    HA   LEU   8           HA       LEU   8 -22.667   0.544  -5.837
    3    HB2  LEU   8           HB2      LEU   8 -20.944  -1.197  -7.577
    4    HB3  LEU   8           HB3      LEU   8 -21.174  -1.523  -5.860
    5    HG   LEU   8           HG       LEU   8 -23.646  -1.677  -6.335
    6   HD13  LEU   8          HD11      LEU   8 -23.711  -0.527  -8.485
    7   HD12  LEU   8          HD12      LEU   8 -24.257  -2.191  -8.685
    8   HD11  LEU   8          HD13      LEU   8 -22.630  -1.730  -9.187
    9   HD23  LEU   8          HD21      LEU   8 -22.359  -3.787  -7.934
   10   HD22  LEU   8          HD22      LEU   8 -23.481  -3.897  -6.578
   11   HD21  LEU   8          HD23      LEU   8 -21.776  -3.558  -6.285

  No H/Q in entry =          11
  In of MODEL   32
    1    H    PHE   9           H        PHE   9 -21.420   0.961  -4.028
    2    HA   PHE   9           HA       PHE   9 -18.610   1.836  -4.505
    3    HB2  PHE   9           HB2      PHE   9 -20.608   2.996  -2.564
    4    HB3  PHE   9           HB3      PHE   9 -18.903   3.420  -2.626
    5    HD1  PHE   9           HD1      PHE   9 -17.991   4.728  -4.449
    6    HD2  PHE   9           HD2      PHE   9 -22.146   3.661  -4.374
    7    HE1  PHE   9           HE1      PHE   9 -18.440   6.347  -6.270
    8    HE2  PHE   9           HE2      PHE   9 -22.597   5.292  -6.190
    9    HZ   PHE   9           HZ       PHE   9 -20.741   6.630  -7.144

  No H/Q in entry =           9
  In of MODEL   32
    1    H    SER  10           H        SER  10 -17.062   0.893  -3.322
    2    HA   SER  10           HA       SER  10 -17.360   0.066  -0.616
    3    HB2  SER  10           HB2      SER  10 -17.392  -2.270  -0.797
    4    HB3  SER  10           HB3      SER  10 -18.557  -1.757  -2.009
    5    HG   SER  10           HG       SER  10 -16.546  -1.743  -3.410

  No H/Q in entry =           5
  In of MODEL   32
    1    H    SER  11           H        SER  11 -15.357   0.097   0.283
    2    HA   SER  11           HA       SER  11 -13.121   0.913  -1.209
    3    HB2  SER  11           HB2      SER  11 -12.786  -0.438   1.432
    4    HB3  SER  11           HB3      SER  11 -11.992   1.003   0.791
    5    HG   SER  11           HG       SER  11 -14.739   0.777   1.507

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA  12           H        ALA  12 -14.327  -1.733  -2.049
    2    HA   ALA  12           HA       ALA  12 -11.768  -3.045  -2.491
    3    HB3  ALA  12           HB1      ALA  12 -12.880  -5.306  -1.889
    4    HB1  ALA  12           HB2      ALA  12 -14.004  -4.331  -0.943
    5    HB2  ALA  12           HB3      ALA  12 -12.280  -4.290  -0.575

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLY  13           H        GLY  13 -12.435  -2.066  -4.561
    2    HA3  GLY  13           HA2      GLY  13 -14.679  -2.728  -6.056
    3    HA2  GLY  13           HA3      GLY  13 -13.110  -2.304  -6.758

  No H/Q in entry =           3
  In of MODEL   32
    1    H    MET  14           H        MET  14 -11.584  -4.571  -5.918
    2    HA   MET  14           HA       MET  14 -12.103  -6.333  -7.993
    3    HB2  MET  14           HB2      MET  14  -9.964  -6.381  -6.790
    4    HB3  MET  14           HB3      MET  14 -10.748  -7.094  -5.382
    5    HG2  MET  14           HG2      MET  14 -11.312  -9.092  -6.668
    6    HG3  MET  14           HG3      MET  14 -10.683  -8.359  -8.145
    7    HE2  MET  14           HE1      MET  14  -7.800  -6.974  -7.239
    8    HE1  MET  14           HE2      MET  14  -8.581  -7.705  -8.640
    9    HE3  MET  14           HE3      MET  14  -7.065  -8.371  -8.038

  No H/Q in entry =           9
  In of MODEL   32
    1    H    SER  15           H        SER  15 -13.237  -6.711  -4.636
    2    HA   SER  15           HA       SER  15 -14.554  -9.212  -5.251
    3    HB2  SER  15           HB2      SER  15 -14.751  -7.407  -2.836
    4    HB3  SER  15           HB3      SER  15 -15.778  -8.823  -3.048
    5    HG   SER  15           HG       SER  15 -12.924  -8.770  -3.054

  No H/Q in entry =           5
  In of MODEL   32
    1    H    THR  16           H        THR  16 -15.687  -5.834  -4.843
    2    HA   THR  16           HA       THR  16 -18.470  -6.370  -5.353
    3    HB   THR  16           HB       THR  16 -16.936  -3.810  -5.925
    4    HG1  THR  16           HG1      THR  16 -16.859  -4.930  -3.707
    5   HG21  THR  16          HG21      THR  16 -19.823  -4.421  -5.247
    6   HG23  THR  16          HG22      THR  16 -19.210  -3.809  -6.793
    7   HG22  THR  16          HG23      THR  16 -19.145  -2.801  -5.341

  No H/Q in entry =           7
  In of MODEL   32
    1    H    SER  17           H        SER  17 -15.667  -5.851  -7.198
    2    HA   SER  17           HA       SER  17 -16.723  -5.177  -9.749
    3    HB2  SER  17           HB2      SER  17 -14.129  -6.503  -8.936
    4    HB3  SER  17           HB3      SER  17 -14.523  -6.121 -10.613
    5    HG   SER  17           HG       SER  17 -13.472  -4.366  -9.944

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU  18           H        LEU  18 -16.231  -8.281  -8.189
    2    HA   LEU  18           HA       LEU  18 -16.777  -9.848 -10.509
    3    HB2  LEU  18           HB2      LEU  18 -15.617 -10.761  -8.545
    4    HB3  LEU  18           HB3      LEU  18 -17.070 -10.520  -7.576
    5    HG   LEU  18           HG       LEU  18 -18.282 -12.116  -8.991
    6   HD13  LEU  18          HD11      LEU  18 -17.313 -11.998 -11.114
    7   HD12  LEU  18          HD12      LEU  18 -16.700 -13.535 -10.504
    8   HD11  LEU  18          HD13      LEU  18 -15.674 -12.102 -10.476
    9   HD22  LEU  18          HD21      LEU  18 -17.213 -12.922  -7.005
   10   HD21  LEU  18          HD22      LEU  18 -15.688 -13.130  -7.869
   11   HD23  LEU  18          HD23      LEU  18 -17.080 -14.131  -8.283

  No H/Q in entry =          11
  In of MODEL   32
    1    H    LEU  19           H        LEU  19 -18.798  -8.532  -7.888
    2    HA   LEU  19           HA       LEU  19 -21.253  -9.712  -8.744
    3    HB2  LEU  19           HB2      LEU  19 -20.989  -8.790  -6.510
    4    HB3  LEU  19           HB3      LEU  19 -20.745  -7.181  -7.187
    5    HG   LEU  19           HG       LEU  19 -23.057  -7.062  -7.865
    6   HD13  LEU  19          HD11      LEU  19 -23.858  -9.122  -8.465
    7   HD12  LEU  19          HD12      LEU  19 -24.490  -9.051  -6.821
    8   HD11  LEU  19          HD13      LEU  19 -23.011  -9.948  -7.157
    9   HD22  LEU  19          HD21      LEU  19 -22.546  -6.329  -5.643
   10   HD21  LEU  19          HD22      LEU  19 -22.661  -7.977  -5.025
   11   HD23  LEU  19          HD23      LEU  19 -24.104  -7.157  -5.619

  No H/Q in entry =          11
  In of MODEL   32
    1    H    VAL  20           H        VAL  20 -19.703  -6.594  -9.501
    2    HA   VAL  20           HA       VAL  20 -21.761  -5.578 -11.154
    3    HB   VAL  20           HB       VAL  20 -18.763  -5.026 -11.231
    4   HG11  VAL  20          HG11      VAL  20 -21.022  -3.891 -12.858
    5   HG13  VAL  20          HG12      VAL  20 -19.411  -4.375 -13.383
    6   HG12  VAL  20          HG13      VAL  20 -19.626  -2.889 -12.458
    7   HG22  VAL  20          HG21      VAL  20 -19.639  -4.218  -9.214
    8   HG21  VAL  20          HG22      VAL  20 -21.111  -3.636  -9.988
    9   HG23  VAL  20          HG23      VAL  20 -19.577  -2.816 -10.282

  No H/Q in entry =           9
  In of MODEL   32
    1    H    SER  21           H        SER  21 -19.004  -7.692 -12.047
    2    HA   SER  21           HA       SER  21 -19.719  -7.658 -14.819
    3    HB2  SER  21           HB2      SER  21 -18.299  -9.652 -15.054
    4    HB3  SER  21           HB3      SER  21 -17.479  -8.386 -14.143
    5    HG   SER  21           HG       SER  21 -17.738  -9.501 -12.315

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LYS  22           H        LYS  22 -20.875  -9.749 -12.207
    2    HA   LYS  22           HA       LYS  22 -22.388 -11.407 -14.015
    3    HB2  LYS  22           HB2      LYS  22 -21.699 -12.089 -11.691
    4    HB3  LYS  22           HB3      LYS  22 -22.915 -10.969 -11.078
    5    HG2  LYS  22           HG2      LYS  22 -24.014 -12.998 -10.993
    6    HG3  LYS  22           HG3      LYS  22 -24.566 -12.330 -12.529
    7    HD2  LYS  22           HD2      LYS  22 -22.986 -13.704 -13.744
    8    HD3  LYS  22           HD3      LYS  22 -22.303 -14.306 -12.232
    9    HE2  LYS  22           HE2      LYS  22 -24.463 -15.358 -11.683
   10    HE3  LYS  22           HE3      LYS  22 -25.133 -14.771 -13.205
   11    HZ3  LYS  22           HZ1      LYS  22 -24.548 -16.999 -13.540
   12    HZ2  LYS  22           HZ2      LYS  22 -23.025 -16.809 -12.812
   13    HZ1  LYS  22           HZ3      LYS  22 -23.340 -16.093 -14.319

  No H/Q in entry =          13
  In of MODEL   32
    1    H    MET  23           H        MET  23 -23.119  -8.419 -12.258
    2    HA   MET  23           HA       MET  23 -25.915  -8.479 -12.833
    3    HB2  MET  23           HB2      MET  23 -24.051  -6.176 -12.286
    4    HB3  MET  23           HB3      MET  23 -25.790  -5.991 -12.514
    5    HG2  MET  23           HG2      MET  23 -26.246  -7.226 -10.515
    6    HG3  MET  23           HG3      MET  23 -24.546  -7.655 -10.332
    7    HE2  MET  23           HE1      MET  23 -26.823  -3.939  -9.318
    8    HE1  MET  23           HE2      MET  23 -27.055  -4.949 -10.743
    9    HE3  MET  23           HE3      MET  23 -25.999  -3.538 -10.825

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ARG  24           H        ARG  24 -23.097  -7.143 -14.590
    2    HA   ARG  24           HA       ARG  24 -24.527  -5.886 -16.666
    3    HB2  ARG  24           HB2      ARG  24 -21.726  -7.058 -16.594
    4    HB3  ARG  24           HB3      ARG  24 -22.354  -6.188 -17.972
    5    HG2  ARG  24           HG2      ARG  24 -22.642  -4.138 -16.546
    6    HG3  ARG  24           HG3      ARG  24 -21.912  -5.041 -15.191
    7    HD2  ARG  24           HD2      ARG  24 -20.611  -4.599 -17.920
    8    HD3  ARG  24           HD3      ARG  24 -20.249  -3.679 -16.465
    9    HE   ARG  24           HE       ARG  24 -19.681  -6.067 -15.567
   10   HH21  ARG  24          HH11      ARG  24 -17.469  -6.069 -15.166
   11   HH22  ARG  24          HH12      ARG  24 -16.362  -5.792 -16.467
   12   HH11  ARG  24          HH21      ARG  24 -18.987  -4.844 -18.645
   13   HH12  ARG  24          HH22      ARG  24 -17.271  -5.077 -18.522

  No H/Q in entry =          13
  In of MODEL   32
    1    H    ALA  25           H        ALA  25 -23.461  -9.229 -16.259
    2    HA   ALA  25           HA       ALA  25 -24.035 -10.133 -18.884
    3    HB1  ALA  25           HB1      ALA  25 -23.387 -12.153 -18.108
    4    HB3  ALA  25           HB2      ALA  25 -24.479 -12.073 -16.726
    5    HB2  ALA  25           HB3      ALA  25 -22.914 -11.267 -16.660

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLN  26           H        GLN  26 -25.937 -10.052 -15.908
    2    HA   GLN  26           HA       GLN  26 -28.272 -11.252 -16.947
    3    HB2  GLN  26           HB2      GLN  26 -27.793  -9.440 -14.602
    4    HB3  GLN  26           HB3      GLN  26 -29.358 -10.151 -14.970
    5    HG2  GLN  26           HG2      GLN  26 -26.807 -11.629 -14.391
    6    HG3  GLN  26           HG3      GLN  26 -28.193 -11.473 -13.319
    7   HE21  GLN  26          HE21      GLN  26 -26.977 -13.693 -14.498
    8   HE22  GLN  26          HE22      GLN  26 -28.015 -14.749 -15.288

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ALA  27           H        ALA  27 -27.296  -7.858 -16.635
    2    HA   ALA  27           HA       ALA  27 -29.749  -6.754 -17.516
    3    HB1  ALA  27           HB1      ALA  27 -27.948  -5.432 -16.395
    4    HB3  ALA  27           HB2      ALA  27 -28.489  -4.703 -17.908
    5    HB2  ALA  27           HB3      ALA  27 -26.967  -5.591 -17.853

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLU  28           H        GLU  28 -27.020  -8.072 -19.277
    2    HA   GLU  28           HA       GLU  28 -27.876  -7.097 -21.850
    3    HB2  GLU  28           HB2      GLU  28 -25.525  -7.795 -21.144
    4    HB3  GLU  28           HB3      GLU  28 -26.090  -9.456 -21.310
    5    HG2  GLU  28           HG2      GLU  28 -24.882  -8.757 -23.271
    6    HG3  GLU  28           HG3      GLU  28 -26.575  -9.065 -23.653

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LYS  29           H        LYS  29 -28.132 -10.149 -20.105
    2    HA   LYS  29           HA       LYS  29 -29.406 -11.659 -22.098
    3    HB2  LYS  29           HB2      LYS  29 -28.423 -12.597 -20.039
    4    HB3  LYS  29           HB3      LYS  29 -29.708 -11.842 -19.099
    5    HG2  LYS  29           HG2      LYS  29 -31.362 -13.221 -20.168
    6    HG3  LYS  29           HG3      LYS  29 -30.145 -13.908 -21.241
    7    HD2  LYS  29           HD2      LYS  29 -29.066 -15.038 -19.446
    8    HD3  LYS  29           HD3      LYS  29 -29.990 -14.146 -18.240
    9    HE2  LYS  29           HE2      LYS  29 -30.770 -16.494 -18.551
   10    HE3  LYS  29           HE3      LYS  29 -32.022 -15.290 -18.862
   11    HZ1  LYS  29           HZ1      LYS  29 -31.399 -15.506 -21.269
   12    HZ3  LYS  29           HZ2      LYS  29 -32.157 -16.861 -20.582
   13    HZ2  LYS  29           HZ3      LYS  29 -30.479 -16.866 -20.837

  No H/Q in entry =          13
  In of MODEL   32
    1    H    TYR  30           H        TYR  30 -30.828  -9.460 -19.694
    2    HA   TYR  30           HA       TYR  30 -33.466  -9.907 -20.990
    3    HB2  TYR  30           HB2      TYR  30 -32.863  -8.681 -18.288
    4    HB3  TYR  30           HB3      TYR  30 -34.468  -8.936 -18.974
    5    HD1  TYR  30           HD1      TYR  30 -35.408 -11.219 -19.143
    6    HD2  TYR  30           HD2      TYR  30 -31.606 -10.502 -17.364
    7    HE1  TYR  30           HE1      TYR  30 -35.374 -13.523 -18.276
    8    HE2  TYR  30           HE2      TYR  30 -31.573 -12.792 -16.501
    9    HH   TYR  30           HH       TYR  30 -33.221 -15.160 -17.566

  No H/Q in entry =           9
  In of MODEL   32
    1    H    GLU  31           H        GLU  31 -31.251  -7.971 -21.792
    2    HA   GLU  31           HA       GLU  31 -31.123  -5.841 -22.676
    3    HB2  GLU  31           HB2      GLU  31 -34.015  -6.530 -23.241
    4    HB3  GLU  31           HB3      GLU  31 -33.136  -5.198 -23.989
    5    HG2  GLU  31           HG2      GLU  31 -31.656  -6.691 -25.100
    6    HG3  GLU  31           HG3      GLU  31 -32.264  -8.070 -24.185

  No H/Q in entry =           6
  In of MODEL   32
    1    H    VAL  32           H        VAL  32 -31.389  -5.655 -19.954
    2    HA   VAL  32           HA       VAL  32 -33.237  -3.498 -19.406
    3    HB   VAL  32           HB       VAL  32 -30.900  -4.477 -17.736
    4   HG12  VAL  32          HG11      VAL  32 -32.471  -3.575 -15.905
    5   HG11  VAL  32          HG12      VAL  32 -33.258  -2.699 -17.216
    6   HG13  VAL  32          HG13      VAL  32 -31.555  -2.409 -16.862
    7   HG21  VAL  32          HG21      VAL  32 -32.674  -6.193 -18.418
    8   HG23  VAL  32          HG22      VAL  32 -33.731  -5.317 -17.309
    9   HG22  VAL  32          HG23      VAL  32 -32.239  -6.045 -16.715

  No H/Q in entry =           9
  In of MODEL   32
    1    HA   PRO  33           HA       PRO  33 -30.122  -0.662 -21.086
    2    HB2  PRO  33           HB2      PRO  33 -31.605   1.584 -21.067
    3    HB3  PRO  33           HB3      PRO  33 -32.064   0.256 -22.134
    4    HG2  PRO  33           HG2      PRO  33 -33.096   0.868 -19.363
    5    HG3  PRO  33           HG3      PRO  33 -34.026   0.629 -20.842
    6    HD2  PRO  33           HD2      PRO  33 -33.640  -1.399 -19.105
    7    HD3  PRO  33           HD3      PRO  33 -33.662  -1.692 -20.844

  No H/Q in entry =           7
  In of MODEL   32
    1    H    VAL  34           H        VAL  34 -28.916  -1.164 -19.091
    2    HA   VAL  34           HA       VAL  34 -28.640   1.304 -17.509
    3    HB   VAL  34           HB       VAL  34 -28.128  -0.107 -15.514
    4   HG12  VAL  34          HG11      VAL  34 -30.559  -0.939 -15.243
    5   HG11  VAL  34          HG12      VAL  34 -30.825  -0.221 -16.830
    6   HG13  VAL  34          HG13      VAL  34 -30.294   0.788 -15.486
    7   HG21  VAL  34          HG21      VAL  34 -28.290  -2.188 -17.466
    8   HG23  VAL  34          HG22      VAL  34 -29.385  -2.495 -16.118
    9   HG22  VAL  34          HG23      VAL  34 -27.671  -2.223 -15.815

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ILE  35           H        ILE  35 -26.680   1.740 -16.631
    2    HA   ILE  35           HA       ILE  35 -24.362   0.345 -17.796
    3    HB   ILE  35           HB       ILE  35 -24.744   3.262 -17.081
    4   HG12  ILE  35          HG12      ILE  35 -23.716   1.869 -19.560
    5   HG13  ILE  35          HG13      ILE  35 -25.344   2.517 -19.360
    6   HG21  ILE  35          HG21      ILE  35 -22.196   1.689 -17.279
    7   HG23  ILE  35          HG22      ILE  35 -22.665   2.910 -16.097
    8   HG22  ILE  35          HG23      ILE  35 -22.235   3.391 -17.738
    9   HD11  ILE  35          HD11      ILE  35 -23.929   4.711 -18.788
   10   HD13  ILE  35          HD12      ILE  35 -24.430   4.286 -20.426
   11   HD12  ILE  35          HD13      ILE  35 -22.796   3.911 -19.877

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ILE  36           H        ILE  36 -23.185  -0.646 -16.136
    2    HA   ILE  36           HA       ILE  36 -23.689   0.058 -13.298
    3    HB   ILE  36           HB       ILE  36 -22.870  -2.686 -14.305
    4   HG12  ILE  36          HG12      ILE  36 -25.685  -1.823 -13.636
    5   HG13  ILE  36          HG13      ILE  36 -25.071  -1.859 -15.290
    6   HG23  ILE  36          HG21      ILE  36 -23.284  -3.448 -12.178
    7   HG22  ILE  36          HG22      ILE  36 -24.405  -2.138 -11.805
    8   HG21  ILE  36          HG23      ILE  36 -22.669  -1.829 -11.842
    9   HD13  ILE  36          HD11      ILE  36 -25.260  -4.076 -15.435
   10   HD12  ILE  36          HD12      ILE  36 -26.359  -3.900 -14.068
   11   HD11  ILE  36          HD13      ILE  36 -24.672  -4.334 -13.793

  No H/Q in entry =          11
  In of MODEL   32
    1    H    GLU  37           H        GLU  37 -21.928   0.699 -12.167
    2    HA   GLU  37           HA       GLU  37 -19.226  -0.157 -12.992
    3    HB2  GLU  37           HB2      GLU  37 -20.087   2.664 -12.370
    4    HB3  GLU  37           HB3      GLU  37 -18.410   2.135 -12.497
    5    HG2  GLU  37           HG2      GLU  37 -18.897   1.505 -14.869
    6    HG3  GLU  37           HG3      GLU  37 -20.454   2.312 -14.684

  No H/Q in entry =           6
  In of MODEL   32
    1    H    ALA  38           H        ALA  38 -17.784  -0.363 -11.266
    2    HA   ALA  38           HA       ALA  38 -18.883  -0.090  -8.529
    3    HB1  ALA  38           HB1      ALA  38 -17.157  -2.090  -9.853
    4    HB3  ALA  38           HB2      ALA  38 -18.245  -2.272  -8.476
    5    HB2  ALA  38           HB3      ALA  38 -16.630  -1.603  -8.242

  No H/Q in entry =           5
  In of MODEL   32
    1    H    PHE  39           H        PHE  39 -17.665   1.148  -7.060
    2    HA   PHE  39           HA       PHE  39 -15.104   2.296  -7.927
    3    HB2  PHE  39           HB2      PHE  39 -17.225   3.996  -6.638
    4    HB3  PHE  39           HB3      PHE  39 -15.712   4.512  -7.382
    5    HD1  PHE  39           HD1      PHE  39 -15.581   5.020  -9.661
    6    HD2  PHE  39           HD2      PHE  39 -19.070   3.151  -8.079
    7    HE1  PHE  39           HE1      PHE  39 -16.763   5.449 -11.797
    8    HE2  PHE  39           HE2      PHE  39 -20.262   3.566 -10.201
    9    HZ   PHE  39           HZ       PHE  39 -19.106   4.686 -12.077

  No H/Q in entry =           9
  In of MODEL   32
    1    HA   PRO  40           HA       PRO  40 -14.281   1.658  -3.598
    2    HB2  PRO  40           HB2      PRO  40 -12.507   3.670  -3.006
    3    HB3  PRO  40           HB3      PRO  40 -12.052   2.305  -4.026
    4    HG2  PRO  40           HG2      PRO  40 -13.032   5.028  -4.873
    5    HG3  PRO  40           HG3      PRO  40 -11.597   4.161  -5.417
    6    HD2  PRO  40           HD2      PRO  40 -13.784   4.049  -6.880
    7    HD3  PRO  40           HD3      PRO  40 -12.852   2.574  -6.625

  No H/Q in entry =           7
  In of MODEL   32
    1    H    GLU  41           H        GLU  41 -14.945   2.705  -1.514
    2    HA   GLU  41           HA       GLU  41 -17.171   4.429  -1.604
    3    HB2  GLU  41           HB2      GLU  41 -17.115   4.395   0.765
    4    HB3  GLU  41           HB3      GLU  41 -16.560   2.806   0.237
    5    HG2  GLU  41           HG2      GLU  41 -14.238   3.490   0.655
    6    HG3  GLU  41           HG3      GLU  41 -14.811   5.062   1.213

  No H/Q in entry =           6
  In of MODEL   32
    1    H    THR  42           H        THR  42 -13.830   5.313  -1.599
    2    HA   THR  42           HA       THR  42 -14.187   7.911  -0.472
    3    HB   THR  42           HB       THR  42 -11.997   8.432  -1.513
    4    HG1  THR  42           HG1      THR  42 -12.736   6.682  -3.259
    5   HG23  THR  42          HG21      THR  42 -10.707   6.884  -0.239
    6   HG22  THR  42          HG22      THR  42 -11.944   5.634  -0.379
    7   HG21  THR  42          HG23      THR  42 -12.237   7.056   0.621

  No H/Q in entry =           7
  In of MODEL   32
    1    H    LEU  43           H        LEU  43 -15.025   6.734  -3.561
    2    HA   LEU  43           HA       LEU  43 -15.226   9.479  -4.617
    3    HB2  LEU  43           HB2      LEU  43 -15.596   6.800  -5.948
    4    HB3  LEU  43           HB3      LEU  43 -15.744   8.363  -6.750
    5    HG   LEU  43           HG       LEU  43 -13.204   7.179  -5.654
    6   HD13  LEU  43          HD11      LEU  43 -12.629   6.609  -7.812
    7   HD12  LEU  43          HD12      LEU  43 -13.742   7.773  -8.529
    8   HD11  LEU  43          HD13      LEU  43 -14.361   6.278  -7.829
    9   HD22  LEU  43          HD21      LEU  43 -13.054   9.543  -5.478
   10   HD21  LEU  43          HD22      LEU  43 -13.844   9.782  -7.037
   11   HD23  LEU  43          HD23      LEU  43 -12.213   9.115  -6.968

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ALA  44           H        ALA  44 -17.235   7.727  -2.761
    2    HA   ALA  44           HA       ALA  44 -19.681   7.571  -4.140
    3    HB2  ALA  44           HB1      ALA  44 -19.605   6.516  -2.008
    4    HB3  ALA  44           HB2      ALA  44 -20.706   7.879  -1.804
    5    HB1  ALA  44           HB3      ALA  44 -19.049   7.989  -1.214

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLY  45           H        GLY  45 -18.272  10.402  -2.657
    2    HA3  GLY  45           HA2      GLY  45 -20.683  11.913  -3.122
    3    HA2  GLY  45           HA3      GLY  45 -19.148  12.541  -2.525

  No H/Q in entry =           3
  In of MODEL   32
    1    H    GLU  46           H        GLU  46 -17.569  11.522  -4.748
    2    HA   GLU  46           HA       GLU  46 -18.140  13.689  -6.598
    3    HB2  GLU  46           HB2      GLU  46 -15.965  11.597  -6.482
    4    HB3  GLU  46           HB3      GLU  46 -16.058  12.853  -7.716
    5    HG2  GLU  46           HG2      GLU  46 -15.791  14.567  -6.027
    6    HG3  GLU  46           HG3      GLU  46 -15.777  13.343  -4.758

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LYS  47           H        LYS  47 -18.046  10.159  -6.925
    2    HA   LYS  47           HA       LYS  47 -19.075  10.308  -9.633
    3    HB2  LYS  47           HB2      LYS  47 -17.475   8.521  -8.580
    4    HB3  LYS  47           HB3      LYS  47 -18.975   7.796  -8.005
    5    HG2  LYS  47           HG2      LYS  47 -18.769   6.674  -9.954
    6    HG3  LYS  47           HG3      LYS  47 -19.634   8.088 -10.554
    7    HD2  LYS  47           HD2      LYS  47 -17.316   9.111 -10.932
    8    HD3  LYS  47           HD3      LYS  47 -16.703   7.472 -10.728
    9    HE2  LYS  47           HE2      LYS  47 -18.411   6.810 -12.514
   10    HE3  LYS  47           HE3      LYS  47 -18.532   8.537 -12.850
   11    HZ2  LYS  47           HZ1      LYS  47 -16.642   6.778 -13.799
   12    HZ1  LYS  47           HZ2      LYS  47 -15.826   7.746 -12.667
   13    HZ3  LYS  47           HZ3      LYS  47 -16.650   8.468 -13.966

  No H/Q in entry =          13
  In of MODEL   32
    1    H    GLY  48           H        GLY  48 -20.483   9.659  -6.497
    2    HA3  GLY  48           HA2      GLY  48 -22.860   8.474  -7.262
    3    HA2  GLY  48           HA3      GLY  48 -22.661   9.507  -5.848

  No H/Q in entry =           3
  In of MODEL   32
    1    H    GLN  49           H        GLN  49 -22.015  11.877  -7.475
    2    HA   GLN  49           HA       GLN  49 -24.559  13.008  -7.716
    3    HB2  GLN  49           HB2      GLN  49 -21.974  13.806  -9.038
    4    HB3  GLN  49           HB3      GLN  49 -23.428  14.787  -9.019
    5    HG2  GLN  49           HG2      GLN  49 -23.328  14.883  -6.581
    6    HG3  GLN  49           HG3      GLN  49 -21.887  13.881  -6.597
    7   HE21  GLN  49          HE21      GLN  49 -21.779  16.145  -5.389
    8   HE22  GLN  49          HE22      GLN  49 -20.828  17.373  -6.050

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ASN  50           H        ASN  50 -22.841  11.041 -10.004
    2    HA   ASN  50           HA       ASN  50 -24.662  11.869 -12.157
    3    HB2  ASN  50           HB2      ASN  50 -22.093  10.297 -12.281
    4    HB3  ASN  50           HB3      ASN  50 -23.105  10.693 -13.662
    5   HD21  ASN  50          HD21      ASN  50 -20.502  11.562 -12.011
    6   HD22  ASN  50          HD22      ASN  50 -20.243  13.184 -12.396

  No H/Q in entry =           6
  In of MODEL   32
    1    H    ALA  51           H        ALA  51 -24.728   9.580  -9.842
    2    HA   ALA  51           HA       ALA  51 -25.489   7.390 -11.624
    3    HB2  ALA  51           HB1      ALA  51 -24.961   6.086  -9.884
    4    HB3  ALA  51           HB2      ALA  51 -26.103   6.938  -8.845
    5    HB1  ALA  51           HB3      ALA  51 -24.453   7.537  -9.019

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ASP  52           H        ASP  52 -27.508   6.358 -11.503
    2    HA   ASP  52           HA       ASP  52 -29.685   8.233 -10.948
    3    HB2  ASP  52           HB2      ASP  52 -29.480   5.677 -12.537
    4    HB3  ASP  52           HB3      ASP  52 -31.027   6.438 -12.163

  No H/Q in entry =           4
  In of MODEL   32
    1    H    VAL  53           H        VAL  53 -28.143   5.359  -9.807
    2    HA   VAL  53           HA       VAL  53 -29.642   5.578  -7.331
    3    HB   VAL  53           HB       VAL  53 -31.029   3.913  -8.561
    4   HG11  VAL  53          HG11      VAL  53 -29.255   2.990 -10.013
    5   HG13  VAL  53          HG12      VAL  53 -30.123   1.731  -9.137
    6   HG12  VAL  53          HG13      VAL  53 -28.520   2.231  -8.601
    7   HG23  VAL  53          HG21      VAL  53 -30.271   1.979  -6.791
    8   HG22  VAL  53          HG22      VAL  53 -31.395   3.306  -6.492
    9   HG21  VAL  53          HG23      VAL  53 -29.696   3.472  -6.047

  No H/Q in entry =           9
  In of MODEL   32
    1    H    VAL  54           H        VAL  54 -28.376   5.180  -5.632
    2    HA   VAL  54           HA       VAL  54 -25.612   4.283  -6.149
    3    HB   VAL  54           HB       VAL  54 -26.717   6.139  -3.981
    4   HG11  VAL  54          HG11      VAL  54 -24.148   4.684  -4.165
    5   HG13  VAL  54          HG12      VAL  54 -24.928   5.414  -2.762
    6   HG12  VAL  54          HG13      VAL  54 -23.984   6.414  -3.866
    7   HG22  VAL  54          HG21      VAL  54 -25.809   7.910  -5.111
    8   HG21  VAL  54          HG22      VAL  54 -26.335   6.886  -6.447
    9   HG23  VAL  54          HG23      VAL  54 -24.639   6.906  -5.967

  No H/Q in entry =           9
  In of MODEL   32
    1    H    LEU  55           H        LEU  55 -25.058   2.375  -5.435
    2    HA   LEU  55           HA       LEU  55 -26.635   1.147  -3.260
    3    HB2  LEU  55           HB2      LEU  55 -25.036  -0.106  -5.480
    4    HB3  LEU  55           HB3      LEU  55 -25.839  -0.993  -4.183
    5    HG   LEU  55           HG       LEU  55 -27.204   0.545  -6.382
    6   HD13  LEU  55          HD11      LEU  55 -26.897  -1.346  -7.538
    7   HD12  LEU  55          HD12      LEU  55 -27.893  -2.174  -6.343
    8   HD11  LEU  55          HD13      LEU  55 -26.142  -2.125  -6.150
    9   HD23  LEU  55          HD21      LEU  55 -28.568  -1.329  -4.503
   10   HD22  LEU  55          HD22      LEU  55 -29.226   0.035  -5.408
   11   HD21  LEU  55          HD23      LEU  55 -28.238   0.321  -3.976

  No H/Q in entry =          11
  In of MODEL   32
    1    H    LEU  56           H        LEU  56 -25.536   0.594  -1.409
    2    HA   LEU  56           HA       LEU  56 -22.597   0.955  -1.397
    3    HB2  LEU  56           HB2      LEU  56 -24.461   0.836   0.961
    4    HB3  LEU  56           HB3      LEU  56 -22.746   1.245   0.980
    5    HG   LEU  56           HG       LEU  56 -25.000   2.920  -0.092
    6   HD11  LEU  56          HD11      LEU  56 -23.952   2.601   2.467
    7   HD13  LEU  56          HD12      LEU  56 -24.913   3.966   1.896
    8   HD12  LEU  56          HD13      LEU  56 -23.153   4.048   1.850
    9   HD23  LEU  56          HD21      LEU  56 -23.030   4.590  -0.286
   10   HD22  LEU  56          HD22      LEU  56 -23.394   3.458  -1.589
   11   HD21  LEU  56          HD23      LEU  56 -22.072   3.122  -0.473

  No H/Q in entry =          11
  In of MODEL   32
    1    H    GLY  57           H        GLY  57 -21.250  -0.675  -0.780
    2    HA3  GLY  57           HA2      GLY  57 -22.200  -3.355  -0.921
    3    HA2  GLY  57           HA3      GLY  57 -20.585  -2.866  -0.417

  No H/Q in entry =           3
  In of MODEL   32
    1    HA   PRO  58           HA       PRO  58 -23.497  -3.759   3.252
    2    HB2  PRO  58           HB2      PRO  58 -22.860  -6.352   3.953
    3    HB3  PRO  58           HB3      PRO  58 -24.213  -5.959   2.893
    4    HG2  PRO  58           HG2      PRO  58 -21.479  -6.895   2.202
    5    HG3  PRO  58           HG3      PRO  58 -23.032  -7.356   1.506
    6    HD2  PRO  58           HD2      PRO  58 -21.371  -5.595   0.270
    7    HD3  PRO  58           HD3      PRO  58 -23.126  -5.492   0.121

  No H/Q in entry =           7
  In of MODEL   32
    1    H    GLN  59           H        GLN  59 -20.118  -4.290   2.744
    2    HA   GLN  59           HA       GLN  59 -19.431  -4.233   5.522
    3    HB2  GLN  59           HB2      GLN  59 -17.834  -3.608   3.042
    4    HB3  GLN  59           HB3      GLN  59 -17.164  -3.505   4.657
    5    HG2  GLN  59           HG2      GLN  59 -17.550  -5.873   4.999
    6    HG3  GLN  59           HG3      GLN  59 -18.343  -5.996   3.436
    7   HE21  GLN  59          HE21      GLN  59 -16.035  -7.099   4.532
    8   HE22  GLN  59          HE22      GLN  59 -14.657  -7.118   3.600

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ILE  60           H        ILE  60 -20.278  -1.738   3.216
    2    HA   ILE  60           HA       ILE  60 -19.452   0.269   5.223
    3    HB   ILE  60           HB       ILE  60 -19.626   1.945   3.336
    4   HG12  ILE  60          HG12      ILE  60 -19.397  -0.358   1.441
    5   HG13  ILE  60          HG13      ILE  60 -20.988   0.235   1.916
    6   HG22  ILE  60          HG21      ILE  60 -17.500   1.020   2.182
    7   HG21  ILE  60          HG22      ILE  60 -17.608  -0.231   3.419
    8   HG23  ILE  60          HG23      ILE  60 -17.469   1.462   3.889
    9   HD12  ILE  60          HD11      ILE  60 -18.869   1.585   0.288
   10   HD11  ILE  60          HD12      ILE  60 -19.998   2.569   1.219
   11   HD13  ILE  60          HD13      ILE  60 -20.602   1.462  -0.013

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ALA  61           H        ALA  61 -21.929  -1.284   5.278
    2    HA   ALA  61           HA       ALA  61 -24.121   0.393   4.714
    3    HB1  ALA  61           HB1      ALA  61 -25.388  -1.042   6.052
    4    HB2  ALA  61           HB2      ALA  61 -24.020  -1.418   7.102
    5    HB3  ALA  61           HB3      ALA  61 -24.083  -2.073   5.465

  No H/Q in entry =           5
  In of MODEL   32
    1    H    TYR  62           H        TYR  62 -21.985   0.338   7.569
    2    HA   TYR  62           HA       TYR  62 -23.560   2.064   9.149
    3    HB2  TYR  62           HB2      TYR  62 -21.541   2.504  10.417
    4    HB3  TYR  62           HB3      TYR  62 -21.617   0.790  10.010
    5    HD1  TYR  62           HD1      TYR  62 -20.094  -0.131   8.236
    6    HD2  TYR  62           HD2      TYR  62 -19.702   3.877   9.667
    7    HE1  TYR  62           HE1      TYR  62 -17.854   0.010   7.216
    8    HE2  TYR  62           HE2      TYR  62 -17.449   4.012   8.648
    9    HH   TYR  62           HH       TYR  62 -16.247   2.898   6.787

  No H/Q in entry =           9
  In of MODEL   32
    1    H    MET  63           H        MET  63 -21.836   2.816   6.310
    2    HA   MET  63           HA       MET  63 -21.648   5.665   6.923
    3    HB2  MET  63           HB2      MET  63 -21.003   4.062   4.448
    4    HB3  MET  63           HB3      MET  63 -20.787   5.808   4.587
    5    HG2  MET  63           HG2      MET  63 -19.122   5.483   6.316
    6    HG3  MET  63           HG3      MET  63 -19.359   3.738   6.234
    7    HE2  MET  63           HE1      MET  63 -17.285   6.416   3.203
    8    HE1  MET  63           HE2      MET  63 -18.071   6.865   4.717
    9    HE3  MET  63           HE3      MET  63 -19.046   6.519   3.288

  No H/Q in entry =           9
  In of MODEL   32
    1    H    LEU  64           H        LEU  64 -24.213   3.815   5.951
    2    HA   LEU  64           HA       LEU  64 -25.352   5.186   3.802
    3    HB2  LEU  64           HB2      LEU  64 -26.272   3.119   4.760
    4    HB3  LEU  64           HB3      LEU  64 -26.753   4.012   6.202
    5    HG   LEU  64           HG       LEU  64 -28.400   5.251   4.896
    6   HD13  LEU  64          HD11      LEU  64 -28.060   5.421   2.665
    7   HD12  LEU  64          HD12      LEU  64 -28.724   3.790   2.552
    8   HD11  LEU  64          HD13      LEU  64 -26.979   4.029   2.646
    9   HD23  LEU  64          HD21      LEU  64 -28.939   2.424   4.219
   10   HD22  LEU  64          HD22      LEU  64 -29.933   3.598   5.081
   11   HD21  LEU  64          HD23      LEU  64 -28.589   2.810   5.905

  No H/Q in entry =          11
  In of MODEL   32
    1    HA   PRO  65           HA       PRO  65 -27.555   8.449   6.403
    2    HB2  PRO  65           HB2      PRO  65 -25.608   8.649   8.700
    3    HB3  PRO  65           HB3      PRO  65 -27.343   8.955   8.695
    4    HG2  PRO  65           HG2      PRO  65 -26.469   6.717   9.710
    5    HG3  PRO  65           HG3      PRO  65 -27.862   6.672   8.632
    6    HD2  PRO  65           HD2      PRO  65 -24.983   5.997   8.019
    7    HD3  PRO  65           HD3      PRO  65 -26.442   5.118   7.562

  No H/Q in entry =           7
  In of MODEL   32
    1    H    GLU  66           H        GLU  66 -24.003   8.347   6.565
    2    HA   GLU  66           HA       GLU  66 -23.655  11.128   6.084
    3    HB2  GLU  66           HB2      GLU  66 -21.861   8.777   5.547
    4    HB3  GLU  66           HB3      GLU  66 -21.382  10.456   5.301
    5    HG2  GLU  66           HG2      GLU  66 -21.645  10.901   7.650
    6    HG3  GLU  66           HG3      GLU  66 -22.200   9.249   7.918

  No H/Q in entry =           6
  In of MODEL   32
    1    H    ILE  67           H        ILE  67 -23.743   8.318   3.914
    2    HA   ILE  67           HA       ILE  67 -23.246   9.949   1.581
    3    HB   ILE  67           HB       ILE  67 -24.193   7.063   1.825
    4   HG12  ILE  67          HG12      ILE  67 -21.523   8.166   0.934
    5   HG13  ILE  67          HG13      ILE  67 -21.866   7.802   2.624
    6   HG21  ILE  67          HG21      ILE  67 -24.052   8.872  -0.453
    7   HG23  ILE  67          HG22      ILE  67 -24.703   7.235  -0.368
    8   HG22  ILE  67          HG23      ILE  67 -22.984   7.485  -0.663
    9   HD12  ILE  67          HD11      ILE  67 -21.416   5.954   0.339
   10   HD11  ILE  67          HD12      ILE  67 -22.470   5.436   1.653
   11   HD13  ILE  67          HD13      ILE  67 -20.799   5.886   1.990

  No H/Q in entry =          11
  In of MODEL   32
    1    H    GLN  68           H        GLN  68 -26.170   8.989   3.174
    2    HA   GLN  68           HA       GLN  68 -27.937   9.887   1.129
    3    HB2  GLN  68           HB2      GLN  68 -28.270   9.624   4.114
    4    HB3  GLN  68           HB3      GLN  68 -29.556  10.208   3.071
    5    HG2  GLN  68           HG2      GLN  68 -29.585   8.141   1.857
    6    HG3  GLN  68           HG3      GLN  68 -28.165   7.566   2.710
    7   HE21  GLN  68          HE21      GLN  68 -30.361   6.239   2.563
    8   HE22  GLN  68          HE22      GLN  68 -31.232   5.839   3.970

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ARG  69           H        ARG  69 -26.370  11.609   3.854
    2    HA   ARG  69           HA       ARG  69 -27.682  14.100   3.341
    3    HB2  ARG  69           HB2      ARG  69 -25.393  13.181   5.014
    4    HB3  ARG  69           HB3      ARG  69 -25.434  14.889   4.603
    5    HG2  ARG  69           HG2      ARG  69 -27.771  14.999   5.515
    6    HG3  ARG  69           HG3      ARG  69 -27.604  13.322   6.044
    7    HD2  ARG  69           HD2      ARG  69 -25.893  15.675   6.929
    8    HD3  ARG  69           HD3      ARG  69 -27.062  14.817   7.922
    9    HE   ARG  69           HE       ARG  69 -24.444  13.815   7.065
   10   HH21  ARG  69          HH11      ARG  69 -23.694  12.076   8.331
   11   HH22  ARG  69          HH12      ARG  69 -24.764  11.311   9.458
   12   HH11  ARG  69          HH21      ARG  69 -27.449  13.369   8.705
   13   HH12  ARG  69          HH22      ARG  69 -26.890  12.040   9.667

  No H/Q in entry =          13
  In of MODEL   32
    1    H    LEU  70           H        LEU  70 -24.804  12.606   2.094
    2    HA   LEU  70           HA       LEU  70 -23.621  14.916   0.885
    3    HB2  LEU  70           HB2      LEU  70 -22.683  12.600   1.572
    4    HB3  LEU  70           HB3      LEU  70 -23.268  12.098  -0.014
    5    HG   LEU  70           HG       LEU  70 -21.625  13.409  -1.101
    6   HD11  LEU  70          HD11      LEU  70 -20.855  14.322   1.680
    7   HD13  LEU  70          HD12      LEU  70 -21.501  15.330   0.386
    8   HD12  LEU  70          HD13      LEU  70 -19.897  14.616   0.225
    9   HD22  LEU  70          HD21      LEU  70 -20.229  11.677  -0.782
   10   HD21  LEU  70          HD22      LEU  70 -21.197  11.212   0.616
   11   HD23  LEU  70          HD23      LEU  70 -19.798  12.266   0.823

  No H/Q in entry =          11
  In of MODEL   32
    1    H    LEU  71           H        LEU  71 -25.794  12.379  -0.207
    2    HA   LEU  71           HA       LEU  71 -26.231  13.799  -2.779
    3    HB2  LEU  71           HB2      LEU  71 -26.503  10.833  -2.250
    4    HB3  LEU  71           HB3      LEU  71 -26.579  11.649  -3.811
    5    HG   LEU  71           HG       LEU  71 -24.099  11.666  -2.090
    6   HD12  LEU  71          HD11      LEU  71 -24.125   9.967  -4.473
    7   HD11  LEU  71          HD12      LEU  71 -25.178   9.402  -3.178
    8   HD13  LEU  71          HD13      LEU  71 -23.460   9.658  -2.869
    9   HD22  LEU  71          HD21      LEU  71 -24.132  13.439  -3.638
   10   HD21  LEU  71          HD22      LEU  71 -24.618  12.366  -4.951
   11   HD23  LEU  71          HD23      LEU  71 -23.016  12.210  -4.230

  No H/Q in entry =          11
  In of MODEL   32
    1    HA   PRO  72           HA       PRO  72 -30.166  13.501  -0.240
    2    HB2  PRO  72           HB2      PRO  72 -30.970  16.075  -0.418
    3    HB3  PRO  72           HB3      PRO  72 -29.697  15.630   0.718
    4    HG2  PRO  72           HG2      PRO  72 -29.422  16.738  -2.065
    5    HG3  PRO  72           HG3      PRO  72 -28.680  17.319  -0.574
    6    HD2  PRO  72           HD2      PRO  72 -27.332  15.683  -2.260
    7    HD3  PRO  72           HD3      PRO  72 -27.123  15.563  -0.515

  No H/Q in entry =           7
  In of MODEL   32
    1    H    ASN  73           H        ASN  73 -29.448  14.347  -3.465
    2    HA   ASN  73           HA       ASN  73 -32.298  14.076  -4.158
    3    HB2  ASN  73           HB2      ASN  73 -31.759  15.110  -6.274
    4    HB3  ASN  73           HB3      ASN  73 -31.249  16.119  -4.931
    5   HD21  ASN  73          HD21      ASN  73 -30.390  16.069  -7.588
    6   HD22  ASN  73          HD22      ASN  73 -28.722  15.868  -7.735

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LYS  74           H        LYS  74 -30.375  11.795  -3.618
    2    HA   LYS  74           HA       LYS  74 -30.912  10.337  -6.137
    3    HB2  LYS  74           HB2      LYS  74 -28.426  10.041  -4.447
    4    HB3  LYS  74           HB3      LYS  74 -28.789   9.191  -5.949
    5    HG2  LYS  74           HG2      LYS  74 -28.467  12.160  -5.829
    6    HG3  LYS  74           HG3      LYS  74 -27.109  11.060  -6.068
    7    HD2  LYS  74           HD2      LYS  74 -28.199  10.098  -8.010
    8    HD3  LYS  74           HD3      LYS  74 -29.604  11.134  -7.754
    9    HE2  LYS  74           HE2      LYS  74 -28.325  13.100  -8.225
   10    HE3  LYS  74           HE3      LYS  74 -26.822  12.177  -8.253
   11    HZ2  LYS  74           HZ1      LYS  74 -28.229  12.745 -10.431
   12    HZ1  LYS  74           HZ2      LYS  74 -28.925  11.249 -10.029
   13    HZ3  LYS  74           HZ3      LYS  74 -27.250  11.365 -10.290

  No H/Q in entry =          13
  In of MODEL   32
    1    HA   PRO  75           HA       PRO  75 -32.441   7.472  -3.114
    2    HB2  PRO  75           HB2      PRO  75 -32.762   5.215  -4.637
    3    HB3  PRO  75           HB3      PRO  75 -33.856   6.590  -4.774
    4    HG2  PRO  75           HG2      PRO  75 -31.490   5.890  -6.469
    5    HG3  PRO  75           HG3      PRO  75 -33.118   6.349  -6.969
    6    HD2  PRO  75           HD2      PRO  75 -31.137   8.172  -6.934
    7    HD3  PRO  75           HD3      PRO  75 -32.773   8.623  -6.448

  No H/Q in entry =           7
  In of MODEL   32
    1    H    VAL  76           H        VAL  76 -31.045   6.427  -1.676
    2    HA   VAL  76           HA       VAL  76 -28.582   5.132  -2.686
    3    HB   VAL  76           HB       VAL  76 -28.900   6.685  -0.081
    4   HG11  VAL  76          HG11      VAL  76 -26.540   5.305  -1.376
    5   HG13  VAL  76          HG12      VAL  76 -27.284   4.917   0.177
    6   HG12  VAL  76          HG13      VAL  76 -26.400   6.430  -0.023
    7   HG22  VAL  76          HG21      VAL  76 -28.169   8.543  -1.008
    8   HG21  VAL  76          HG22      VAL  76 -28.691   7.813  -2.527
    9   HG23  VAL  76          HG23      VAL  76 -27.002   7.702  -2.028

  No H/Q in entry =           9
  In of MODEL   32
    1    H    GLU  77           H        GLU  77 -28.428   2.993  -2.004
    2    HA   GLU  77           HA       GLU  77 -29.295   2.304   0.652
    3    HB2  GLU  77           HB2      GLU  77 -30.925   0.677   0.131
    4    HB3  GLU  77           HB3      GLU  77 -31.423   2.189  -0.629
    5    HG2  GLU  77           HG2      GLU  77 -30.779   1.353  -2.777
    6    HG3  GLU  77           HG3      GLU  77 -30.187  -0.137  -2.045

  No H/Q in entry =           6
  In of MODEL   32
    1    H    VAL  78           H        VAL  78 -29.030   0.231   1.381
    2    HA   VAL  78           HA       VAL  78 -26.361  -0.623   0.582
    3    HB   VAL  78           HB       VAL  78 -28.145  -1.398   2.930
    4   HG11  VAL  78          HG11      VAL  78 -25.806  -2.710   1.900
    5   HG13  VAL  78          HG12      VAL  78 -26.759  -3.118   3.329
    6   HG12  VAL  78          HG13      VAL  78 -25.417  -1.982   3.458
    7   HG22  VAL  78          HG21      VAL  78 -26.688  -0.027   4.263
    8   HG21  VAL  78          HG22      VAL  78 -27.372   0.919   2.942
    9   HG23  VAL  78          HG23      VAL  78 -25.704   0.351   2.849

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ILE  79           H        ILE  79 -25.844  -2.569  -0.253
    2    HA   ILE  79           HA       ILE  79 -27.904  -4.043  -1.606
    3    HB   ILE  79           HB       ILE  79 -24.931  -4.626  -1.295
    4   HG12  ILE  79          HG12      ILE  79 -26.488  -3.558  -3.655
    5   HG13  ILE  79          HG13      ILE  79 -25.619  -2.532  -2.511
    6   HG22  ILE  79          HG21      ILE  79 -26.003  -5.852  -3.604
    7   HG21  ILE  79          HG22      ILE  79 -27.032  -6.311  -2.246
    8   HG23  ILE  79          HG23      ILE  79 -25.297  -6.626  -2.184
    9   HD13  ILE  79          HD11      ILE  79 -24.166  -2.731  -4.290
   10   HD12  ILE  79          HD12      ILE  79 -24.535  -4.439  -4.528
   11   HD11  ILE  79          HD13      ILE  79 -23.574  -3.930  -3.139

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ASP  80           H        ASP  80 -28.824  -5.929  -0.986
    2    HA   ASP  80           HA       ASP  80 -28.855  -6.748   1.686
    3    HB2  ASP  80           HB2      ASP  80 -30.580  -7.337   0.022
    4    HB3  ASP  80           HB3      ASP  80 -29.424  -8.395  -0.788

  No H/Q in entry =           4
  In of MODEL   32
    1    H    SER  81           H        SER  81 -27.371  -7.881   2.888
    2    HA   SER  81           HA       SER  81 -24.863  -8.651   1.780
    3    HB2  SER  81           HB2      SER  81 -24.387  -9.625   3.991
    4    HB3  SER  81           HB3      SER  81 -25.057  -8.001   4.139
    5    HG   SER  81           HG       SER  81 -26.545 -10.388   4.354

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU  82           H        LEU  82 -27.625 -10.674   2.097
    2    HA   LEU  82           HA       LEU  82 -26.118 -13.090   1.686
    3    HB2  LEU  82           HB2      LEU  82 -29.031 -12.556   1.152
    4    HB3  LEU  82           HB3      LEU  82 -28.263 -14.124   1.390
    5    HG   LEU  82           HG       LEU  82 -28.602 -12.008   3.495
    6   HD12  LEU  82          HD11      LEU  82 -29.941 -14.707   3.296
    7   HD11  LEU  82          HD12      LEU  82 -30.676 -13.239   2.649
    8   HD13  LEU  82          HD13      LEU  82 -30.340 -13.369   4.375
    9   HD23  LEU  82          HD21      LEU  82 -27.881 -13.981   4.932
   10   HD22  LEU  82          HD22      LEU  82 -26.628 -13.260   3.923
   11   HD21  LEU  82          HD23      LEU  82 -27.394 -14.770   3.430

  No H/Q in entry =          11
  In of MODEL   32
    1    H    LEU  83           H        LEU  83 -27.980 -10.883  -0.347
    2    HA   LEU  83           HA       LEU  83 -27.750 -12.321  -2.770
    3    HB2  LEU  83           HB2      LEU  83 -28.111  -9.387  -2.221
    4    HB3  LEU  83           HB3      LEU  83 -28.117 -10.082  -3.841
    5    HG   LEU  83           HG       LEU  83 -30.212 -10.358  -1.705
    6   HD13  LEU  83          HD11      LEU  83 -30.901  -8.528  -2.843
    7   HD12  LEU  83          HD12      LEU  83 -31.357  -9.670  -4.105
    8   HD11  LEU  83          HD13      LEU  83 -29.802  -8.840  -4.186
    9   HD23  LEU  83          HD21      LEU  83 -30.312 -11.696  -4.393
   10   HD22  LEU  83          HD22      LEU  83 -31.324 -11.981  -2.977
   11   HD21  LEU  83          HD23      LEU  83 -29.645 -12.522  -2.986

  No H/Q in entry =          11
  In of MODEL   32
    1    H    TYR  84           H        TYR  84 -25.785  -9.927  -1.119
    2    HA   TYR  84           HA       TYR  84 -23.862  -9.546  -3.217
    3    HB2  TYR  84           HB2      TYR  84 -24.397  -7.989  -1.251
    4    HB3  TYR  84           HB3      TYR  84 -23.419  -9.080  -0.271
    5    HD1  TYR  84           HD1      TYR  84 -21.058  -8.943  -0.279
    6    HD2  TYR  84           HD2      TYR  84 -23.310  -6.795  -3.204
    7    HE1  TYR  84           HE1      TYR  84 -18.999  -7.774  -0.988
    8    HE2  TYR  84           HE2      TYR  84 -21.258  -5.627  -3.930
    9    HH   TYR  84           HH       TYR  84 -18.099  -6.548  -2.674

  No H/Q in entry =           9
  In of MODEL   32
    1    H    GLY  85           H        GLY  85 -23.737 -11.460  -0.205
    2    HA3  GLY  85           HA2      GLY  85 -21.170 -12.473  -0.595
    3    HA2  GLY  85           HA3      GLY  85 -22.441 -13.264   0.336

  No H/Q in entry =           3
  In of MODEL   32
    1    H    LYS  86           H        LYS  86 -24.246 -13.660  -1.756
    2    HA   LYS  86           HA       LYS  86 -23.215 -16.095  -2.916
    3    HB2  LYS  86           HB2      LYS  86 -25.825 -14.594  -3.106
    4    HB3  LYS  86           HB3      LYS  86 -25.539 -16.166  -3.850
    5    HG2  LYS  86           HG2      LYS  86 -25.275 -17.167  -1.677
    6    HG3  LYS  86           HG3      LYS  86 -25.499 -15.594  -0.911
    7    HD2  LYS  86           HD2      LYS  86 -27.715 -15.402  -1.951
    8    HD3  LYS  86           HD3      LYS  86 -27.489 -16.970  -2.725
    9    HE2  LYS  86           HE2      LYS  86 -27.340 -18.030  -0.521
   10    HE3  LYS  86           HE3      LYS  86 -27.580 -16.461   0.246
   11    HZ3  LYS  86           HZ1      LYS  86 -29.741 -16.927   0.126
   12    HZ2  LYS  86           HZ2      LYS  86 -29.504 -18.216  -0.956
   13    HZ1  LYS  86           HZ3      LYS  86 -29.624 -16.627  -1.542

  No H/Q in entry =          13
  In of MODEL   32
    1    H    VAL  87           H        VAL  87 -23.111 -12.910  -3.907
    2    HA   VAL  87           HA       VAL  87 -22.741 -11.805  -5.876
    3    HB   VAL  87           HB       VAL  87 -21.690 -14.392  -7.066
    4   HG11  VAL  87          HG11      VAL  87 -21.859 -12.037  -8.237
    5   HG13  VAL  87          HG12      VAL  87 -20.393 -13.003  -8.422
    6   HG12  VAL  87          HG13      VAL  87 -20.432 -11.672  -7.266
    7   HG21  VAL  87          HG21      VAL  87 -20.426 -12.723  -4.920
    8   HG23  VAL  87          HG22      VAL  87 -19.464 -13.682  -6.043
    9   HG22  VAL  87          HG23      VAL  87 -20.630 -14.473  -4.984

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ASP  88           H        ASP  88 -25.277 -12.381  -5.566
    2    HA   ASP  88           HA       ASP  88 -26.368 -13.649  -7.952
    3    HB2  ASP  88           HB2      ASP  88 -27.423 -13.800  -5.647
    4    HB3  ASP  88           HB3      ASP  88 -27.836 -12.093  -5.809

  No H/Q in entry =           4
  In of MODEL   32
    1    H    GLY  89           H        GLY  89 -25.597 -12.458  -9.613
    2    HA3  GLY  89           HA2      GLY  89 -25.714  -9.690  -9.904
    3    HA2  GLY  89           HA3      GLY  89 -25.682 -10.852 -11.228

  No H/Q in entry =           3
  In of MODEL   32
    1    H    LEU  90           H        LEU  90 -28.168 -12.139 -10.798
    2    HA   LEU  90           HA       LEU  90 -29.910 -10.203 -12.014
    3    HB2  LEU  90           HB2      LEU  90 -30.013 -12.614 -12.521
    4    HB3  LEU  90           HB3      LEU  90 -30.564 -12.917 -10.875
    5    HG   LEU  90           HG       LEU  90 -32.649 -11.769 -11.323
    6   HD13  LEU  90          HD11      LEU  90 -32.398 -10.079 -12.846
    7   HD12  LEU  90          HD12      LEU  90 -32.937 -11.340 -13.957
    8   HD11  LEU  90          HD13      LEU  90 -31.219 -10.977 -13.804
    9   HD23  LEU  90          HD21      LEU  90 -32.558 -13.475 -13.705
   10   HD22  LEU  90          HD22      LEU  90 -33.574 -13.574 -12.267
   11   HD21  LEU  90          HD23      LEU  90 -31.934 -14.221 -12.232

  No H/Q in entry =          11
  In of MODEL   32
    1    H    GLY  91           H        GLY  91 -29.848 -11.606  -8.782
    2    HA3  GLY  91           HA2      GLY  91 -32.186 -10.413  -7.833
    3    HA2  GLY  91           HA3      GLY  91 -30.829 -10.945  -6.841

  No H/Q in entry =           3
  In of MODEL   32
    1    H    VAL  92           H        VAL  92 -28.851  -9.186  -7.708
    2    HA   VAL  92           HA       VAL  92 -29.631  -6.822  -6.250
    3    HB   VAL  92           HB       VAL  92 -27.058  -7.393  -7.769
    4   HG12  VAL  92          HG11      VAL  92 -27.237  -5.433  -5.506
    5   HG11  VAL  92          HG12      VAL  92 -27.854  -4.924  -7.080
    6   HG13  VAL  92          HG13      VAL  92 -26.172  -5.423  -6.913
    7   HG22  VAL  92          HG21      VAL  92 -26.906  -8.934  -6.123
    8   HG21  VAL  92          HG22      VAL  92 -28.059  -8.096  -5.083
    9   HG23  VAL  92          HG23      VAL  92 -26.391  -7.533  -5.183

  No H/Q in entry =           9
  In of MODEL   32
    1    H    LEU  93           H        LEU  93 -29.158  -7.598  -9.638
    2    HA   LEU  93           HA       LEU  93 -29.426  -4.988 -10.657
    3    HB2  LEU  93           HB2      LEU  93 -28.790  -6.900 -12.045
    4    HB3  LEU  93           HB3      LEU  93 -30.401  -7.588 -11.836
    5    HG   LEU  93           HG       LEU  93 -31.344  -5.641 -13.045
    6   HD11  LEU  93          HD11      LEU  93 -29.473  -4.068 -12.546
    7   HD13  LEU  93          HD12      LEU  93 -29.873  -4.142 -14.264
    8   HD12  LEU  93          HD13      LEU  93 -28.453  -4.989 -13.652
    9   HD23  LEU  93          HD21      LEU  93 -30.265  -6.300 -15.289
   10   HD22  LEU  93          HD22      LEU  93 -31.154  -7.510 -14.364
   11   HD21  LEU  93          HD23      LEU  93 -29.389  -7.491 -14.326

  No H/Q in entry =          11
  In of MODEL   32
    1    H    LYS  94           H        LYS  94 -31.873  -7.457  -9.785
    2    HA   LYS  94           HA       LYS  94 -34.171  -5.987 -10.510
    3    HB2  LYS  94           HB2      LYS  94 -33.750  -8.119  -8.420
    4    HB3  LYS  94           HB3      LYS  94 -35.326  -7.400  -8.747
    5    HG2  LYS  94           HG2      LYS  94 -35.203  -8.249 -11.053
    6    HG3  LYS  94           HG3      LYS  94 -33.666  -9.021 -10.665
    7    HD2  LYS  94           HD2      LYS  94 -34.856 -10.275  -8.827
    8    HD3  LYS  94           HD3      LYS  94 -36.371  -9.614  -9.438
    9    HE2  LYS  94           HE2      LYS  94 -35.824 -10.624 -11.663
   10    HE3  LYS  94           HE3      LYS  94 -34.442 -11.413 -10.902
   11    HZ3  LYS  94           HZ1      LYS  94 -36.319 -12.901 -11.068
   12    HZ2  LYS  94           HZ2      LYS  94 -37.293 -11.826 -10.182
   13    HZ1  LYS  94           HZ3      LYS  94 -35.965 -12.580  -9.439

  No H/Q in entry =          13
  In of MODEL   32
    1    H    ALA  95           H        ALA  95 -32.422  -6.050  -7.417
    2    HA   ALA  95           HA       ALA  95 -34.271  -4.387  -6.031
    3    HB2  ALA  95           HB1      ALA  95 -31.938  -5.792  -5.396
    4    HB3  ALA  95           HB2      ALA  95 -32.924  -4.832  -4.294
    5    HB1  ALA  95           HB3      ALA  95 -31.541  -4.098  -5.107

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA  96           H        ALA  96 -31.564  -3.654  -8.090
    2    HA   ALA  96           HA       ALA  96 -31.427  -0.872  -7.399
    3    HB2  ALA  96           HB1      ALA  96 -30.012  -0.740  -9.482
    4    HB3  ALA  96           HB2      ALA  96 -30.345  -2.449  -9.756
    5    HB1  ALA  96           HB3      ALA  96 -29.453  -1.944  -8.321

  No H/Q in entry =           5
  In of MODEL   32
    1    H    VAL  97           H        VAL  97 -32.933  -2.637 -10.068
    2    HA   VAL  97           HA       VAL  97 -33.923  -0.355 -11.419
    3    HB   VAL  97           HB       VAL  97 -34.796  -3.263 -11.390
    4   HG11  VAL  97          HG11      VAL  97 -36.532  -1.235 -11.980
    5   HG13  VAL  97          HG12      VAL  97 -36.609  -2.849 -12.688
    6   HG12  VAL  97          HG13      VAL  97 -35.807  -1.543 -13.558
    7   HG21  VAL  97          HG21      VAL  97 -33.431  -1.527 -13.449
    8   HG23  VAL  97          HG22      VAL  97 -33.913  -3.205 -13.698
    9   HG22  VAL  97          HG23      VAL  97 -32.685  -2.809 -12.496

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ALA  98           H        ALA  98 -35.212  -2.429  -8.845
    2    HA   ALA  98           HA       ALA  98 -37.754  -1.214  -8.590
    3    HB1  ALA  98           HB1      ALA  98 -36.814  -3.402  -7.467
    4    HB3  ALA  98           HB2      ALA  98 -37.995  -2.423  -6.592
    5    HB2  ALA  98           HB3      ALA  98 -36.280  -2.301  -6.197

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA  99           H        ALA  99 -34.696  -0.433  -6.895
    2    HA   ALA  99           HA       ALA  99 -35.818   1.626  -5.322
    3    HB1  ALA  99           HB1      ALA  99 -33.174   0.655  -5.979
    4    HB2  ALA  99           HB2      ALA  99 -33.741   1.463  -4.517
    5    HB3  ALA  99           HB3      ALA  99 -33.210   2.416  -5.902

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ILE 100           H        ILE 100 -34.697   1.630  -8.654
    2    HA   ILE 100           HA       ILE 100 -34.804   4.474  -8.963
    3    HB   ILE 100           HB       ILE 100 -34.901   2.257 -11.038
    4   HG12  ILE 100          HG12      ILE 100 -32.707   4.219 -10.377
    5   HG13  ILE 100          HG13      ILE 100 -32.797   2.593  -9.698
    6   HG21  ILE 100          HG21      ILE 100 -35.252   5.180 -11.267
    7   HG23  ILE 100          HG22      ILE 100 -35.762   3.890 -12.356
    8   HG22  ILE 100          HG23      ILE 100 -34.096   4.466 -12.390
    9   HD12  ILE 100          HD11      ILE 100 -32.179   3.452 -12.486
   10   HD11  ILE 100          HD12      ILE 100 -32.883   1.861 -12.199
   11   HD13  ILE 100          HD13      ILE 100 -31.344   2.291 -11.457

  No H/Q in entry =          11
  In of MODEL   32
    1    H    LYS 101           H        LYS 101 -37.142   1.897  -9.664
    2    HA   LYS 101           HA       LYS 101 -39.160   3.563 -10.762
    3    HB2  LYS 101           HB2      LYS 101 -39.136   0.822  -9.549
    4    HB3  LYS 101           HB3      LYS 101 -40.661   1.609  -9.954
    5    HG2  LYS 101           HG2      LYS 101 -40.131   1.662 -12.242
    6    HG3  LYS 101           HG3      LYS 101 -38.452   1.226 -11.936
    7    HD2  LYS 101           HD2      LYS 101 -39.726  -0.678 -12.794
    8    HD3  LYS 101           HD3      LYS 101 -39.145  -0.974 -11.156
    9    HE2  LYS 101           HE2      LYS 101 -41.234  -1.606 -10.677
   10    HE3  LYS 101           HE3      LYS 101 -41.650   0.108 -10.742
   11    HZ3  LYS 101           HZ1      LYS 101 -42.497  -0.092 -12.875
   12    HZ2  LYS 101           HZ2      LYS 101 -43.009  -1.533 -12.134
   13    HZ1  LYS 101           HZ3      LYS 101 -41.677  -1.548 -13.188

  No H/Q in entry =          13
  In of MODEL   32
    1    H    LYS 102           H        LYS 102 -38.777   2.171  -7.500
    2    HA   LYS 102           HA       LYS 102 -41.023   3.455  -6.392
    3    HB2  LYS 102           HB2      LYS 102 -39.855   1.591  -5.293
    4    HB3  LYS 102           HB3      LYS 102 -38.445   2.622  -5.048
    5    HG2  LYS 102           HG2      LYS 102 -39.762   4.090  -3.624
    6    HG3  LYS 102           HG3      LYS 102 -41.175   3.064  -3.872
    7    HD2  LYS 102           HD2      LYS 102 -40.018   1.203  -2.763
    8    HD3  LYS 102           HD3      LYS 102 -38.606   2.230  -2.513
    9    HE2  LYS 102           HE2      LYS 102 -39.957   3.781  -1.181
   10    HE3  LYS 102           HE3      LYS 102 -41.385   2.784  -1.453
   11    HZ1  LYS 102           HZ1      LYS 102 -39.731   1.021  -0.358
   12    HZ3  LYS 102           HZ2      LYS 102 -40.840   1.959   0.520
   13    HZ2  LYS 102           HZ3      LYS 102 -39.215   2.442   0.415

  No H/Q in entry =          13
  In of MODEL   32
    1    H    ALA 103           H        ALA 103 -38.013   4.746  -7.375
    2    HA   ALA 103           HA       ALA 103 -38.222   7.118  -5.668
    3    HB2  ALA 103           HB1      ALA 103 -36.178   7.758  -7.216
    4    HB3  ALA 103           HB2      ALA 103 -36.174   6.029  -7.562
    5    HB1  ALA 103           HB3      ALA 103 -35.973   6.597  -5.905

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA 104           H        ALA 104 -38.782   6.302  -9.004
    2    HA   ALA 104           HA       ALA 104 -39.286   9.079  -9.722
    3    HB2  ALA 104           HB1      ALA 104 -39.294   8.347 -11.904
    4    HB1  ALA 104           HB2      ALA 104 -40.067   6.815 -11.498
    5    HB3  ALA 104           HB3      ALA 104 -38.346   7.046 -11.185

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA 105           H        ALA 105 -40.986   7.067  -7.896
    2    HA   ALA 105           HA       ALA 105 -43.376   8.516  -7.968
    3    HB2  ALA 105           HB1      ALA 105 -44.093   7.614  -9.997
    4    HB3  ALA 105           HB2      ALA 105 -44.785   6.475  -8.842
    5    HB1  ALA 105           HB3      ALA 105 -43.303   6.065  -9.705

  No H/Q in entry =           5
  In of MODEL   33
    1    H1   ALA   1           H3       ALA   1 -12.298 -15.711  -2.309
    2    H2   ALA   1           H2       ALA   1 -11.364 -16.854  -3.156
    3    H3   ALA   1           H1       ALA   1 -12.510 -15.906  -3.982
    4    HA   ALA   1           HA       ALA   1 -13.911 -17.604  -3.737
    5    HB3  ALA   1           HB1      ALA   1 -12.516 -19.379  -3.284
    6    HB1  ALA   1           HB2      ALA   1 -13.263 -19.267  -1.691
    7    HB2  ALA   1           HB3      ALA   1 -11.688 -18.529  -1.980

  No H/Q in entry =           7
  In of MODEL   33
    1    H    GLU   2           H        GLU   2 -15.527 -18.457  -2.075
    2    HA   GLU   2           HA       GLU   2 -17.166 -16.734  -1.005
    3    HB2  GLU   2           HB2      GLU   2 -16.223 -19.163   0.532
    4    HB3  GLU   2           HB3      GLU   2 -17.744 -18.310   0.795
    5    HG2  GLU   2           HG2      GLU   2 -18.735 -19.393  -0.935
    6    HG3  GLU   2           HG3      GLU   2 -17.417 -18.994  -2.026

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLU   3           H        GLU   3 -15.242 -18.094   1.606
    2    HA   GLU   3           HA       GLU   3 -15.450 -15.742   3.167
    3    HB2  GLU   3           HB2      GLU   3 -13.869 -18.292   3.406
    4    HB3  GLU   3           HB3      GLU   3 -13.628 -16.974   4.554
    5    HG2  GLU   3           HG2      GLU   3 -15.817 -17.122   5.383
    6    HG3  GLU   3           HG3      GLU   3 -16.422 -17.919   3.937

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LEU   4           H        LEU   4 -12.506 -17.225   1.759
    2    HA   LEU   4           HA       LEU   4 -10.664 -15.327   2.349
    3    HB2  LEU   4           HB2      LEU   4 -10.912 -16.621  -0.376
    4    HB3  LEU   4           HB3      LEU   4  -9.455 -15.904   0.302
    5    HG   LEU   4           HG       LEU   4 -10.948 -18.299   1.420
    6   HD13  LEU   4          HD11      LEU   4  -9.324 -19.658   0.481
    7   HD12  LEU   4          HD12      LEU   4  -8.111 -18.377   0.449
    8   HD11  LEU   4          HD13      LEU   4  -9.407 -18.395  -0.747
    9   HD23  LEU   4          HD21      LEU   4  -8.690 -18.369   2.790
   10   HD22  LEU   4          HD22      LEU   4 -10.006 -17.328   3.327
   11   HD21  LEU   4          HD23      LEU   4  -8.647 -16.641   2.438

  No H/Q in entry =          11
  In of MODEL   33
    1    H    GLU   5           H        GLU   5 -13.013 -15.112  -0.312
    2    HA   GLU   5           HA       GLU   5 -12.009 -12.630  -1.316
    3    HB2  GLU   5           HB2      GLU   5 -13.359 -14.199  -2.682
    4    HB3  GLU   5           HB3      GLU   5 -14.753 -13.861  -1.655
    5    HG2  GLU   5           HG2      GLU   5 -14.667 -11.490  -2.277
    6    HG3  GLU   5           HG3      GLU   5 -13.235 -11.788  -3.262

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLU   6           H        GLU   6 -14.725 -13.504   0.790
    2    HA   GLU   6           HA       GLU   6 -15.621 -10.825   1.197
    3    HB2  GLU   6           HB2      GLU   6 -17.053 -12.810   1.601
    4    HB3  GLU   6           HB3      GLU   6 -16.013 -13.266   2.949
    5    HG2  GLU   6           HG2      GLU   6 -16.522 -11.144   4.081
    6    HG3  GLU   6           HG3      GLU   6 -17.541 -10.657   2.727

  No H/Q in entry =           6
  In of MODEL   33
    1    H    VAL   7           H        VAL   7 -13.311 -12.943   2.754
    2    HA   VAL   7           HA       VAL   7 -12.829 -11.372   5.080
    3    HB   VAL   7           HB       VAL   7 -11.137 -13.418   3.620
    4   HG11  VAL   7          HG11      VAL   7 -10.652 -11.888   6.183
    5   HG13  VAL   7          HG12      VAL   7  -9.560 -12.104   4.817
    6   HG12  VAL   7          HG13      VAL   7  -9.911 -13.461   5.887
    7   HG21  VAL   7          HG21      VAL   7 -13.383 -13.978   4.851
    8   HG23  VAL   7          HG22      VAL   7 -12.448 -13.708   6.322
    9   HG22  VAL   7          HG23      VAL   7 -11.964 -14.967   5.189

  No H/Q in entry =           9
  In of MODEL   33
    1    H    VAL   8           H        VAL   8 -11.334 -11.486   1.862
    2    HA   VAL   8           HA       VAL   8  -9.265  -9.619   2.347
    3    HB   VAL   8           HB       VAL   8 -10.743 -10.297  -0.207
    4   HG13  VAL   8          HG11      VAL   8  -9.765  -8.125  -0.515
    5   HG12  VAL   8          HG12      VAL   8  -8.667  -9.276  -1.277
    6   HG11  VAL   8          HG13      VAL   8  -8.281  -8.608   0.308
    7   HG23  VAL   8          HG21      VAL   8  -7.904 -11.091   0.220
    8   HG22  VAL   8          HG22      VAL   8  -9.235 -12.011  -0.477
    9   HG21  VAL   8          HG23      VAL   8  -9.065 -11.902   1.273

  No H/Q in entry =           9
  In of MODEL   33
    1    H    MET   9           H        MET   9 -12.615  -9.220   1.204
    2    HA   MET   9           HA       MET   9 -12.547  -6.443   0.772
    3    HB2  MET   9           HB2      MET   9 -14.755  -8.326   1.594
    4    HB3  MET   9           HB3      MET   9 -15.042  -6.593   1.415
    5    HG2  MET   9           HG2      MET   9 -14.184  -6.702  -0.906
    6    HG3  MET   9           HG3      MET   9 -13.944  -8.440  -0.724
    7    HE2  MET   9           HE1      MET   9 -16.554  -5.755  -1.920
    8    HE1  MET   9           HE2      MET   9 -16.257  -5.575  -0.193
    9    HE3  MET   9           HE3      MET   9 -17.848  -6.074  -0.758

  No H/Q in entry =           9
  In of MODEL   33
    1    H    GLY  10           H        GLY  10 -13.200  -8.336   3.701
    2    HA3  GLY  10           HA2      GLY  10 -13.734  -6.152   5.424
    3    HA2  GLY  10           HA3      GLY  10 -13.171  -7.742   5.934

  No H/Q in entry =           3
  In of MODEL   33
    1    H    LEU  11           H        LEU  11 -10.732  -7.870   4.606
    2    HA   LEU  11           HA       LEU  11  -9.020  -6.442   6.356
    3    HB2  LEU  11           HB2      LEU  11  -8.489  -7.864   3.745
    4    HB3  LEU  11           HB3      LEU  11  -7.213  -7.163   4.737
    5    HG   LEU  11           HG       LEU  11  -9.213  -9.193   5.762
    6   HD13  LEU  11          HD11      LEU  11  -8.002 -10.430   4.190
    7   HD12  LEU  11          HD12      LEU  11  -7.060 -10.672   5.660
    8   HD11  LEU  11          HD13      LEU  11  -6.523  -9.507   4.451
    9   HD22  LEU  11          HD21      LEU  11  -8.349  -8.183   7.675
   10   HD21  LEU  11          HD22      LEU  11  -6.814  -7.784   6.905
   11   HD23  LEU  11          HD23      LEU  11  -7.140  -9.440   7.415

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  12           H        ILE  12  -9.938  -5.890   2.971
    2    HA   ILE  12           HA       ILE  12  -8.245  -3.662   2.538
    3    HB   ILE  12           HB       ILE  12 -10.911  -4.309   1.255
    4   HG12  ILE  12          HG12      ILE  12  -8.902  -5.997   1.185
    5   HG13  ILE  12          HG13      ILE  12  -9.766  -5.637  -0.295
    6   HG23  ILE  12          HG21      ILE  12 -10.218  -1.975   0.858
    7   HG22  ILE  12          HG22      ILE  12 -10.056  -2.911  -0.622
    8   HG21  ILE  12          HG23      ILE  12  -8.656  -2.533   0.341
    9   HD11  ILE  12          HD11      ILE  12  -7.228  -4.233   0.578
   10   HD13  ILE  12          HD12      ILE  12  -8.023  -4.123  -0.990
   11   HD12  ILE  12          HD13      ILE  12  -7.255  -5.614  -0.501

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  13           H        ILE  13 -11.601  -3.926   3.648
    2    HA   ILE  13           HA       ILE  13 -12.056  -1.138   3.923
    3    HB   ILE  13           HB       ILE  13 -13.257  -3.562   5.281
    4   HG12  ILE  13          HG12      ILE  13 -13.500  -3.001   2.751
    5   HG13  ILE  13          HG13      ILE  13 -14.922  -3.458   3.664
    6   HG23  ILE  13          HG21      ILE  13 -13.840  -1.981   6.861
    7   HG22  ILE  13          HG22      ILE  13 -15.163  -1.747   5.727
    8   HG21  ILE  13          HG23      ILE  13 -13.791  -0.644   5.715
    9   HD13  ILE  13          HD11      ILE  13 -15.782  -1.289   3.686
   10   HD12  ILE  13          HD12      ILE  13 -14.989  -1.349   2.125
   11   HD11  ILE  13          HD13      ILE  13 -14.185  -0.565   3.465

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ASN  14           H        ASN  14 -10.936  -3.632   6.190
    2    HA   ASN  14           HA       ASN  14 -10.722  -1.996   8.476
    3    HB2  ASN  14           HB2      ASN  14 -10.473  -4.603   8.150
    4    HB3  ASN  14           HB3      ASN  14  -8.765  -4.217   7.985
    5   HD21  ASN  14          HD21      ASN  14  -9.392  -5.743  10.163
    6   HD22  ASN  14          HD22      ASN  14  -9.356  -4.824  11.588

  No H/Q in entry =           6
  In of MODEL   33
    1    H    SER  15           H        SER  15  -8.333  -2.819   5.972
    2    HA   SER  15           HA       SER  15  -6.184  -1.328   7.034
    3    HB2  SER  15           HB2      SER  15  -5.174  -1.543   4.871
    4    HB3  SER  15           HB3      SER  15  -6.129  -3.002   5.099
    5    HG   SER  15           HG       SER  15  -6.304  -1.369   3.116

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLY  16           H        GLY  16  -8.796  -0.459   4.801
    2    HA3  GLY  16           HA2      GLY  16  -7.940   2.182   4.247
    3    HA2  GLY  16           HA3      GLY  16  -9.591   1.588   4.093

  No H/Q in entry =           3
  In of MODEL   33
    1    H    GLN  17           H        GLN  17 -10.121   0.861   6.744
    2    HA   GLN  17           HA       GLN  17 -10.823   3.364   7.891
    3    HB2  GLN  17           HB2      GLN  17 -12.053   1.280   8.381
    4    HB3  GLN  17           HB3      GLN  17 -10.642   0.655   9.235
    5    HG2  GLN  17           HG2      GLN  17 -10.761   2.552  10.814
    6    HG3  GLN  17           HG3      GLN  17 -12.177   3.167   9.964
    7   HE21  GLN  17          HE21      GLN  17 -14.097   2.578  10.967
    8   HE22  GLN  17          HE22      GLN  17 -14.337   1.150  11.852

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ALA  18           H        ALA  18  -8.191   1.083   8.495
    2    HA   ALA  18           HA       ALA  18  -7.083   2.298  10.762
    3    HB2  ALA  18           HB1      ALA  18  -6.479   0.083   9.390
    4    HB3  ALA  18           HB2      ALA  18  -5.311   0.866  10.455
    5    HB1  ALA  18           HB3      ALA  18  -5.242   1.146   8.714

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ARG  19           H        ARG  19  -6.328   2.825   7.310
    2    HA   ARG  19           HA       ARG  19  -4.429   4.873   7.731
    3    HB2  ARG  19           HB2      ARG  19  -4.766   3.733   5.536
    4    HB3  ARG  19           HB3      ARG  19  -6.311   4.573   5.367
    5    HG2  ARG  19           HG2      ARG  19  -5.183   6.746   5.432
    6    HG3  ARG  19           HG3      ARG  19  -3.632   5.961   5.728
    7    HD2  ARG  19           HD2      ARG  19  -3.769   6.553   3.386
    8    HD3  ARG  19           HD3      ARG  19  -3.852   4.793   3.531
    9    HE   ARG  19           HE       ARG  19  -6.486   5.700   3.536
   10   HH21  ARG  19          HH11      ARG  19  -7.690   5.856   1.624
   11   HH22  ARG  19          HH12      ARG  19  -6.876   5.936   0.100
   12   HH11  ARG  19          HH21      ARG  19  -3.721   5.767   1.489
   13   HH12  ARG  19          HH22      ARG  19  -4.627   5.882   0.024

  No H/Q in entry =          13
  In of MODEL   33
    1    H    SER  20           H        SER  20  -7.931   4.985   7.147
    2    HA   SER  20           HA       SER  20  -8.291   7.740   7.102
    3    HB2  SER  20           HB2      SER  20 -10.014   5.850   6.746
    4    HB3  SER  20           HB3      SER  20 -10.227   5.905   8.495
    5    HG   SER  20           HG       SER  20 -10.589   7.994   6.609

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU  21           H        LEU  21  -8.275   5.556   9.905
    2    HA   LEU  21           HA       LEU  21  -8.709   7.550  11.873
    3    HB2  LEU  21           HB2      LEU  21  -7.349   4.852  12.029
    4    HB3  LEU  21           HB3      LEU  21  -7.662   5.867  13.433
    5    HG   LEU  21           HG       LEU  21  -9.829   4.966  11.514
    6   HD12  LEU  21          HD11      LEU  21 -10.417   3.389  13.434
    7   HD11  LEU  21          HD12      LEU  21  -8.812   3.728  14.080
    8   HD13  LEU  21          HD13      LEU  21  -8.983   2.962  12.500
    9   HD23  LEU  21          HD21      LEU  21 -11.167   5.445  13.743
   10   HD22  LEU  21          HD22      LEU  21 -10.722   6.799  12.709
   11   HD21  LEU  21          HD23      LEU  21  -9.776   6.448  14.148

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ALA  22           H        ALA  22  -5.761   6.182  10.452
    2    HA   ALA  22           HA       ALA  22  -3.877   7.498  12.066
    3    HB2  ALA  22           HB1      ALA  22  -3.465   5.646  10.372
    4    HB1  ALA  22           HB2      ALA  22  -2.271   6.944  10.402
    5    HB3  ALA  22           HB3      ALA  22  -3.495   6.899   9.132

  No H/Q in entry =           5
  In of MODEL   33
    1    H    TYR  23           H        TYR  23  -5.210   8.514   8.890
    2    HA   TYR  23           HA       TYR  23  -3.879  11.013   8.815
    3    HB2  TYR  23           HB2      TYR  23  -4.967  10.099   6.828
    4    HB3  TYR  23           HB3      TYR  23  -6.542  10.204   7.616
    5    HD1  TYR  23           HD1      TYR  23  -3.649  12.249   6.446
    6    HD2  TYR  23           HD2      TYR  23  -7.783  12.215   7.609
    7    HE1  TYR  23           HE1      TYR  23  -3.881  14.599   5.688
    8    HE2  TYR  23           HE2      TYR  23  -8.016  14.566   6.850
    9    HH   TYR  23           HH       TYR  23  -5.572  16.147   4.999

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ALA  24           H        ALA  24  -6.990  10.029  10.208
    2    HA   ALA  24           HA       ALA  24  -7.828  12.616  10.984
    3    HB1  ALA  24           HB1      ALA  24  -9.642  11.362  11.459
    4    HB2  ALA  24           HB2      ALA  24  -8.809  10.791  12.903
    5    HB3  ALA  24           HB3      ALA  24  -8.689   9.880  11.398

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA  25           H        ALA  25  -5.815  10.161  12.548
    2    HA   ALA  25           HA       ALA  25  -5.468  11.413  15.049
    3    HB2  ALA  25           HB1      ALA  25  -4.700   9.063  14.223
    4    HB3  ALA  25           HB2      ALA  25  -3.682   9.922  15.380
    5    HB1  ALA  25           HB3      ALA  25  -3.253   9.907  13.669

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU  26           H        LEU  26  -3.691  11.717  12.001
    2    HA   LEU  26           HA       LEU  26  -1.732  13.540  12.910
    3    HB2  LEU  26           HB2      LEU  26  -1.438  12.390  10.804
    4    HB3  LEU  26           HB3      LEU  26  -2.915  13.096  10.156
    5    HG   LEU  26           HG       LEU  26  -1.904  15.348  10.288
    6   HD12  LEU  26          HD11      LEU  26   0.636  15.372  10.691
    7   HD11  LEU  26          HD12      LEU  26   0.419  13.790  11.435
    8   HD13  LEU  26          HD13      LEU  26  -0.388  15.203  12.116
    9   HD21  LEU  26          HD21      LEU  26  -0.164  13.297   8.884
   10   HD23  LEU  26          HD22      LEU  26  -0.211  15.018   8.515
   11   HD22  LEU  26          HD23      LEU  26  -1.634  14.019   8.233

  No H/Q in entry =          11
  In of MODEL   33
    1    H    LYS  27           H        LYS  27  -4.921  14.018  11.447
    2    HA   LYS  27           HA       LYS  27  -4.872  16.807  11.250
    3    HB2  LYS  27           HB2      LYS  27  -6.618  15.327  10.271
    4    HB3  LYS  27           HB3      LYS  27  -7.267  15.069  11.890
    5    HG2  LYS  27           HG2      LYS  27  -7.699  17.474  12.129
    6    HG3  LYS  27           HG3      LYS  27  -6.998  17.773  10.535
    7    HD2  LYS  27           HD2      LYS  27  -8.733  16.337   9.506
    8    HD3  LYS  27           HD3      LYS  27  -9.440  16.055  11.099
    9    HE2  LYS  27           HE2      LYS  27  -9.885  18.466  11.345
   10    HE3  LYS  27           HE3      LYS  27  -9.150  18.769   9.767
   11    HZ3  LYS  27           HZ1      LYS  27 -11.528  18.641   9.536
   12    HZ2  LYS  27           HZ2      LYS  27 -11.571  17.124  10.305
   13    HZ1  LYS  27           HZ3      LYS  27 -10.833  17.289   8.780

  No H/Q in entry =          13
  In of MODEL   33
    1    H    GLN  28           H        GLN  28  -5.745  14.718  13.979
    2    HA   GLN  28           HA       GLN  28  -6.635  16.720  15.761
    3    HB2  GLN  28           HB2      GLN  28  -5.229  14.089  16.294
    4    HB3  GLN  28           HB3      GLN  28  -5.962  15.092  17.547
    5    HG2  GLN  28           HG2      GLN  28  -7.442  13.984  15.145
    6    HG3  GLN  28           HG3      GLN  28  -7.483  13.278  16.760
    7   HE21  GLN  28          HE21      GLN  28  -9.351  15.130  14.816
    8   HE22  GLN  28          HE22      GLN  28 -10.101  16.122  15.970

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ALA  29           H        ALA  29  -3.418  15.426  15.056
    2    HA   ALA  29           HA       ALA  29  -1.972  16.824  17.029
    3    HB1  ALA  29           HB1      ALA  29  -0.046  16.134  15.901
    4    HB3  ALA  29           HB2      ALA  29  -0.808  16.259  14.315
    5    HB2  ALA  29           HB3      ALA  29  -1.225  14.925  15.391

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LYS  30           H        LYS  30  -2.845  17.705  13.704
    2    HA   LYS  30           HA       LYS  30  -1.434  20.144  13.598
    3    HB2  LYS  30           HB2      LYS  30  -3.972  19.273  12.201
    4    HB3  LYS  30           HB3      LYS  30  -3.138  20.788  11.854
    5    HG2  LYS  30           HG2      LYS  30  -1.072  19.492  11.330
    6    HG3  LYS  30           HG3      LYS  30  -1.979  17.997  11.578
    7    HD2  LYS  30           HD2      LYS  30  -3.551  18.641   9.791
    8    HD3  LYS  30           HD3      LYS  30  -2.666  20.148   9.545
    9    HE2  LYS  30           HE2      LYS  30  -0.639  18.853   8.955
   10    HE3  LYS  30           HE3      LYS  30  -1.542  17.351   9.170
   11    HZ2  LYS  30           HZ1      LYS  30  -1.375  18.223   6.828
   12    HZ1  LYS  30           HZ2      LYS  30  -2.415  19.487   7.302
   13    HZ3  LYS  30           HZ3      LYS  30  -2.942  17.871   7.375

  No H/Q in entry =          13
  In of MODEL   33
    1    H    GLN  31           H        GLN  31  -4.529  19.297  15.025
    2    HA   GLN  31           HA       GLN  31  -5.284  22.054  15.483
    3    HB2  GLN  31           HB2      GLN  31  -6.463  19.610  16.809
    4    HB3  GLN  31           HB3      GLN  31  -7.220  21.183  16.568
    5    HG2  GLN  31           HG2      GLN  31  -6.524  20.407  13.974
    6    HG3  GLN  31           HG3      GLN  31  -7.049  18.903  14.723
    7   HE21  GLN  31          HE21      GLN  31  -8.465  20.482  12.629
    8   HE22  GLN  31          HE22      GLN  31  -9.974  20.877  13.295

  No H/Q in entry =           8
  In of MODEL   33
    1    H    GLY  32           H        GLY  32  -2.970  20.120  16.790
    2    HA3  GLY  32           HA2      GLY  32  -1.560  20.577  18.585
    3    HA2  GLY  32           HA3      GLY  32  -2.683  21.822  19.116

  No H/Q in entry =           3
  In of MODEL   33
    1    H    ASP  33           H        ASP  33  -4.117  18.787  18.458
    2    HA   ASP  33           HA       ASP  33  -4.515  18.328  21.340
    3    HB2  ASP  33           HB2      ASP  33  -5.936  17.323  18.868
    4    HB3  ASP  33           HB3      ASP  33  -6.275  16.712  20.485

  No H/Q in entry =           4
  In of MODEL   33
    1    H    PHE  34           H        PHE  34  -2.347  17.471  21.633
    2    HA   PHE  34           HA       PHE  34  -1.360  15.220  20.225
    3    HB2  PHE  34           HB2      PHE  34  -0.727  16.200  23.018
    4    HB3  PHE  34           HB3      PHE  34   0.194  14.975  22.144
    5    HD1  PHE  34           HD1      PHE  34   0.036  18.400  22.884
    6    HD2  PHE  34           HD2      PHE  34   0.842  15.698  19.642
    7    HE1  PHE  34           HE1      PHE  34   1.330  20.169  21.725
    8    HE2  PHE  34           HE2      PHE  34   2.132  17.470  18.489
    9    HZ   PHE  34           HZ       PHE  34   2.378  19.702  19.535

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ALA  35           H        ALA  35  -3.385  15.500  23.099
    2    HA   ALA  35           HA       ALA  35  -3.177  12.836  23.991
    3    HB3  ALA  35           HB1      ALA  35  -5.628  13.469  24.861
    4    HB1  ALA  35           HB2      ALA  35  -5.092  15.086  24.405
    5    HB2  ALA  35           HB3      ALA  35  -4.175  14.158  25.590

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA  36           H        ALA  36  -5.632  14.363  21.905
    2    HA   ALA  36           HA       ALA  36  -7.058  11.956  21.432
    3    HB1  ALA  36           HB1      ALA  36  -8.514  13.384  20.485
    4    HB3  ALA  36           HB2      ALA  36  -7.346  13.803  19.230
    5    HB2  ALA  36           HB3      ALA  36  -7.361  14.688  20.755

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA  37           H        ALA  37  -4.381  13.537  19.752
    2    HA   ALA  37           HA       ALA  37  -4.362  11.905  17.452
    3    HB3  ALA  37           HB1      ALA  37  -2.357  13.609  18.867
    4    HB2  ALA  37           HB2      ALA  37  -2.896  13.668  17.190
    5    HB1  ALA  37           HB3      ALA  37  -1.744  12.434  17.704

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LYS  38           H        LYS  38  -2.591  11.589  20.521
    2    HA   LYS  38           HA       LYS  38  -1.275   9.186  20.023
    3    HB2  LYS  38           HB2      LYS  38  -1.582  10.947  22.172
    4    HB3  LYS  38           HB3      LYS  38  -2.202   9.419  22.789
    5    HG2  LYS  38           HG2      LYS  38  -0.114   8.293  22.241
    6    HG3  LYS  38           HG3      LYS  38   0.495   9.737  21.426
    7    HD2  LYS  38           HD2      LYS  38   0.678  10.952  23.462
    8    HD3  LYS  38           HD3      LYS  38  -0.341   9.804  24.333
    9    HE2  LYS  38           HE2      LYS  38   2.017   9.480  24.939
   10    HE3  LYS  38           HE3      LYS  38   1.404   8.067  24.077
   11    HZ3  LYS  38           HZ1      LYS  38   2.697   8.484  22.290
   12    HZ2  LYS  38           HZ2      LYS  38   3.660   9.308  23.422
   13    HZ1  LYS  38           HZ3      LYS  38   2.578  10.172  22.437

  No H/Q in entry =          13
  In of MODEL   33
    1    H    ALA  39           H        ALA  39  -4.505   9.689  21.442
    2    HA   ALA  39           HA       ALA  39  -5.071   6.971  21.946
    3    HB3  ALA  39           HB1      ALA  39  -7.228   8.923  21.192
    4    HB2  ALA  39           HB2      ALA  39  -6.321   9.145  22.689
    5    HB1  ALA  39           HB3      ALA  39  -7.244   7.664  22.428

  No H/Q in entry =           5
  In of MODEL   33
    1    H    MET  40           H        MET  40  -5.664   8.989  19.105
    2    HA   MET  40           HA       MET  40  -7.153   7.063  17.649
    3    HB2  MET  40           HB2      MET  40  -5.541   9.455  16.740
    4    HB3  MET  40           HB3      MET  40  -6.575   8.500  15.673
    5    HG2  MET  40           HG2      MET  40  -7.593   9.749  18.238
    6    HG3  MET  40           HG3      MET  40  -7.656  10.586  16.689
    7    HE3  MET  40           HE1      MET  40 -10.254   8.976  14.636
    8    HE2  MET  40           HE2      MET  40  -8.502   9.089  14.479
    9    HE1  MET  40           HE3      MET  40  -9.413  10.456  15.119

  No H/Q in entry =           9
  In of MODEL   33
    1    H    MET  41           H        MET  41  -3.659   7.791  17.755
    2    HA   MET  41           HA       MET  41  -2.916   6.037  15.649
    3    HB2  MET  41           HB2      MET  41  -1.286   6.697  18.115
    4    HB3  MET  41           HB3      MET  41  -0.677   6.049  16.595
    5    HG2  MET  41           HG2      MET  41  -1.833   8.236  15.600
    6    HG3  MET  41           HG3      MET  41  -1.587   8.821  17.244
    7    HE2  MET  41           HE1      MET  41   1.327   6.715  17.588
    8    HE1  MET  41           HE2      MET  41   0.546   8.009  18.492
    9    HE3  MET  41           HE3      MET  41   2.167   8.250  17.842

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ASP  42           H        ASP  42  -3.285   5.560  19.136
    2    HA   ASP  42           HA       ASP  42  -2.254   2.964  19.288
    3    HB2  ASP  42           HB2      ASP  42  -3.115   4.723  21.117
    4    HB3  ASP  42           HB3      ASP  42  -4.545   3.701  21.050

  No H/Q in entry =           4
  In of MODEL   33
    1    H    GLN  43           H        GLN  43  -5.588   4.076  18.805
    2    HA   GLN  43           HA       GLN  43  -6.738   1.491  18.613
    3    HB2  GLN  43           HB2      GLN  43  -7.661   4.147  17.492
    4    HB3  GLN  43           HB3      GLN  43  -8.627   2.670  17.472
    5    HG2  GLN  43           HG2      GLN  43  -8.322   2.545  19.978
    6    HG3  GLN  43           HG3      GLN  43  -7.594   4.148  19.906
    7   HE21  GLN  43          HE21      GLN  43  -9.766   4.231  21.417
    8   HE22  GLN  43          HE22      GLN  43 -11.129   4.811  20.592

  No H/Q in entry =           8
  In of MODEL   33
    1    H    SER  44           H        SER  44  -5.405   3.706  16.197
    2    HA   SER  44           HA       SER  44  -6.120   2.226  13.910
    3    HB2  SER  44           HB2      SER  44  -4.856   4.606  14.351
    4    HB3  SER  44           HB3      SER  44  -3.507   3.608  13.813
    5    HG   SER  44           HG       SER  44  -4.626   4.585  12.056

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ARG  45           H        ARG  45  -3.233   2.104  15.976
    2    HA   ARG  45           HA       ARG  45  -1.763   0.148  14.584
    3    HB2  ARG  45           HB2      ARG  45  -0.910   1.565  16.451
    4    HB3  ARG  45           HB3      ARG  45  -1.898   0.635  17.575
    5    HG2  ARG  45           HG2      ARG  45  -0.674  -1.425  16.923
    6    HG3  ARG  45           HG3      ARG  45   0.339  -0.471  15.842
    7    HD2  ARG  45           HD2      ARG  45   1.086   0.906  17.796
    8    HD3  ARG  45           HD3      ARG  45   0.166  -0.169  18.872
    9    HE   ARG  45           HE       ARG  45   1.854  -1.766  17.281
   10   HH21  ARG  45          HH11      ARG  45   3.757  -2.594  18.109
   11   HH22  ARG  45          HH12      ARG  45   4.538  -1.812  19.437
   12   HH11  ARG  45          HH21      ARG  45   2.174   0.696  19.673
   13   HH12  ARG  45          HH22      ARG  45   3.641   0.054  20.321

  No H/Q in entry =          13
  In of MODEL   33
    1    H    MET  46           H        MET  46  -4.149  -0.170  17.195
    2    HA   MET  46           HA       MET  46  -3.987  -2.970  17.497
    3    HB2  MET  46           HB2      MET  46  -6.145  -0.957  18.113
    4    HB3  MET  46           HB3      MET  46  -6.361  -2.678  18.446
    5    HG2  MET  46           HG2      MET  46  -4.348  -2.684  19.845
    6    HG3  MET  46           HG3      MET  46  -4.063  -0.989  19.479
    7    HE1  MET  46           HE1      MET  46  -6.291  -3.602  20.605
    8    HE3  MET  46           HE2      MET  46  -7.806  -2.713  20.705
    9    HE2  MET  46           HE3      MET  46  -6.919  -3.093  22.178

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ALA  47           H        ALA  47  -6.012  -0.945  15.415
    2    HA   ALA  47           HA       ALA  47  -7.640  -2.990  14.354
    3    HB3  ALA  47           HB1      ALA  47  -8.315  -0.750  13.944
    4    HB1  ALA  47           HB2      ALA  47  -7.835  -1.383  12.369
    5    HB2  ALA  47           HB3      ALA  47  -6.748  -0.319  13.263

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU  48           H        LEU  48  -4.522  -1.689  13.291
    2    HA   LEU  48           HA       LEU  48  -4.256  -3.277  10.945
    3    HB2  LEU  48           HB2      LEU  48  -2.187  -2.007  12.746
    4    HB3  LEU  48           HB3      LEU  48  -1.828  -2.727  11.177
    5    HG   LEU  48           HG       LEU  48  -3.842  -0.503  11.579
    6   HD13  LEU  48          HD11      LEU  48  -1.714   0.365  12.236
    7   HD12  LEU  48          HD12      LEU  48  -1.995   0.922  10.587
    8   HD11  LEU  48          HD13      LEU  48  -0.900  -0.429  10.888
    9   HD22  LEU  48          HD21      LEU  48  -4.326  -1.483   9.504
   10   HD21  LEU  48          HD22      LEU  48  -2.646  -1.923   9.200
   11   HD23  LEU  48          HD23      LEU  48  -3.160  -0.242   9.046

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ASN  49           H        ASN  49  -3.197  -3.682  14.286
    2    HA   ASN  49           HA       ASN  49  -1.604  -5.951  13.945
    3    HB2  ASN  49           HB2      ASN  49  -1.602  -4.634  15.995
    4    HB3  ASN  49           HB3      ASN  49  -3.271  -5.078  16.322
    5   HD21  ASN  49          HD21      ASN  49  -0.009  -6.503  15.958
    6   HD22  ASN  49          HD22      ASN  49  -0.304  -7.821  16.985

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLU  50           H        GLU  50  -5.069  -5.663  14.632
    2    HA   GLU  50           HA       GLU  50  -5.592  -8.460  14.739
    3    HB2  GLU  50           HB2      GLU  50  -7.167  -6.768  15.625
    4    HB3  GLU  50           HB3      GLU  50  -7.466  -6.200  13.980
    5    HG2  GLU  50           HG2      GLU  50  -8.343  -8.391  13.342
    6    HG3  GLU  50           HG3      GLU  50  -7.957  -9.039  14.933

  No H/Q in entry =           6
  In of MODEL   33
    1    H    ALA  51           H        ALA  51  -5.661  -6.058  12.147
    2    HA   ALA  51           HA       ALA  51  -6.663  -7.778  10.126
    3    HB2  ALA  51           HB1      ALA  51  -6.441  -5.964   8.759
    4    HB1  ALA  51           HB2      ALA  51  -4.798  -5.623   9.301
    5    HB3  ALA  51           HB3      ALA  51  -6.175  -5.107  10.277

  No H/Q in entry =           5
  In of MODEL   33
    1    H    HIS  52           H        HIS  52  -3.364  -6.888  11.097
    2    HA   HIS  52           HA       HIS  52  -1.981  -8.381   9.139
    3    HB2  HIS  52           HB2      HIS  52  -0.933  -6.654  10.577
    4    HB3  HIS  52           HB3      HIS  52  -1.101  -7.730  11.964
    5    HD1  HIS  52           HD1      HIS  52   0.204 -10.088  11.755
    6    HD2  HIS  52           HD2      HIS  52   1.324  -7.145   9.022
    7    HE1  HIS  52           HE1      HIS  52   2.434 -10.811  10.797
    8    HE2  HIS  52           HE2      HIS  52   3.129  -9.029   9.128

  No H/Q in entry =           8
  In of MODEL   33
    1    H    LEU  53           H        LEU  53  -3.183  -9.257  12.355
    2    HA   LEU  53           HA       LEU  53  -1.998 -11.808  12.540
    3    HB2  LEU  53           HB2      LEU  53  -4.469 -10.612  13.768
    4    HB3  LEU  53           HB3      LEU  53  -4.025 -12.293  14.051
    5    HG   LEU  53           HG       LEU  53  -2.110  -9.988  14.534
    6   HD12  LEU  53          HD11      LEU  53  -2.681 -10.275  16.941
    7   HD11  LEU  53          HD12      LEU  53  -3.962 -11.396  16.479
    8   HD13  LEU  53          HD13      LEU  53  -4.053  -9.707  15.994
    9   HD22  LEU  53          HD21      LEU  53  -0.824 -11.960  14.480
   10   HD21  LEU  53          HD22      LEU  53  -2.127 -12.939  15.145
   11   HD23  LEU  53          HD23      LEU  53  -1.227 -11.856  16.190

  No H/Q in entry =          11
  In of MODEL   33
    1    H    VAL  54           H        VAL  54  -5.109 -10.759  11.193
    2    HA   VAL  54           HA       VAL  54  -6.041 -13.347  10.505
    3    HB   VAL  54           HB       VAL  54  -6.677 -10.608   9.378
    4   HG12  VAL  54          HG11      VAL  54  -8.790 -11.973   8.573
    5   HG11  VAL  54          HG12      VAL  54  -7.686 -13.345   8.638
    6   HG13  VAL  54          HG13      VAL  54  -7.323 -11.971   7.597
    7   HG22  VAL  54          HG21      VAL  54  -7.575 -10.645  11.533
    8   HG21  VAL  54          HG22      VAL  54  -7.839 -12.387  11.512
    9   HG23  VAL  54          HG23      VAL  54  -8.918 -11.322  10.612

  No H/Q in entry =           9
  In of MODEL   33
    1    H    GLN  55           H        GLN  55  -4.163 -10.903   8.712
    2    HA   GLN  55           HA       GLN  55  -4.051 -12.364   6.291
    3    HB2  GLN  55           HB2      GLN  55  -3.435 -10.103   6.103
    4    HB3  GLN  55           HB3      GLN  55  -2.319 -10.189   7.463
    5    HG2  GLN  55           HG2      GLN  55  -0.612 -11.043   6.178
    6    HG3  GLN  55           HG3      GLN  55  -1.696 -12.010   5.187
    7   HE21  GLN  55          HE21      GLN  55  -1.718 -11.316   3.067
    8   HE22  GLN  55          HE22      GLN  55  -1.512  -9.712   2.559

  No H/Q in entry =           8
  In of MODEL   33
    1    H    THR  56           H        THR  56  -1.933 -12.361   9.163
    2    HA   THR  56           HA       THR  56   0.131 -13.971   8.234
    3    HB   THR  56           HB       THR  56  -1.103 -14.215  10.987
    4    HG1  THR  56           HG1      THR  56  -0.162 -12.067   9.790
    5   HG21  THR  56          HG21      THR  56   0.796 -15.766  10.097
    6   HG23  THR  56          HG22      THR  56   0.995 -15.003  11.676
    7   HG22  THR  56          HG23      THR  56   1.814 -14.337  10.263

  No H/Q in entry =           7
  In of MODEL   33
    1    H    LYS  57           H        LYS  57  -2.990 -14.990   9.609
    2    HA   LYS  57           HA       LYS  57  -2.563 -17.788   9.357
    3    HB2  LYS  57           HB2      LYS  57  -4.371 -16.671  10.708
    4    HB3  LYS  57           HB3      LYS  57  -5.170 -16.244   9.202
    5    HG2  LYS  57           HG2      LYS  57  -5.353 -18.644   8.624
    6    HG3  LYS  57           HG3      LYS  57  -4.590 -19.062  10.157
    7    HD2  LYS  57           HD2      LYS  57  -7.106 -17.390  10.039
    8    HD3  LYS  57           HD3      LYS  57  -7.163 -19.151  10.085
    9    HE2  LYS  57           HE2      LYS  57  -5.717 -19.039  12.175
   10    HE3  LYS  57           HE3      LYS  57  -5.967 -17.296  12.180
   11    HZ3  LYS  57           HZ1      LYS  57  -8.295 -17.596  12.406
   12    HZ2  LYS  57           HZ2      LYS  57  -7.547 -18.576  13.577
   13    HZ1  LYS  57           HZ3      LYS  57  -8.176 -19.272  12.160

  No H/Q in entry =          13
  In of MODEL   33
    1    H    LEU  58           H        LEU  58  -3.887 -15.334   7.190
    2    HA   LEU  58           HA       LEU  58  -4.710 -17.150   5.184
    3    HB2  LEU  58           HB2      LEU  58  -4.085 -14.205   5.051
    4    HB3  LEU  58           HB3      LEU  58  -4.760 -15.136   3.713
    5    HG   LEU  58           HG       LEU  58  -6.027 -14.952   6.466
    6   HD11  LEU  58          HD11      LEU  58  -6.327 -13.299   3.978
    7   HD13  LEU  58          HD12      LEU  58  -6.306 -12.794   5.668
    8   HD12  LEU  58          HD13      LEU  58  -7.737 -13.577   5.001
    9   HD22  LEU  58          HD21      LEU  58  -7.006 -16.853   5.597
   10   HD21  LEU  58          HD22      LEU  58  -6.670 -16.401   3.926
   11   HD23  LEU  58          HD23      LEU  58  -8.025 -15.668   4.784

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  59           H        ILE  59  -1.563 -15.961   6.035
    2    HA   ILE  59           HA       ILE  59  -0.481 -16.692   3.392
    3    HB   ILE  59           HB       ILE  59   0.308 -14.636   4.968
    4   HG12  ILE  59          HG12      ILE  59   2.368 -16.295   3.500
    5   HG13  ILE  59          HG13      ILE  59   1.180 -15.324   2.671
    6   HG23  ILE  59          HG21      ILE  59   2.161 -15.139   6.340
    7   HG22  ILE  59          HG22      ILE  59   2.390 -16.720   5.626
    8   HG21  ILE  59          HG23      ILE  59   1.041 -16.425   6.722
    9   HD11  ILE  59          HD11      ILE  59   1.970 -13.341   4.026
   10   HD13  ILE  59          HD12      ILE  59   3.148 -13.966   2.875
   11   HD12  ILE  59          HD13      ILE  59   3.294 -14.357   4.589

  No H/Q in entry =          11
  In of MODEL   33
    1    H    GLU  60           H        GLU  60  -0.486 -17.803   6.758
    2    HA   GLU  60           HA       GLU  60   1.531 -19.795   6.483
    3    HB2  GLU  60           HB2      GLU  60   0.739 -18.977   8.671
    4    HB3  GLU  60           HB3      GLU  60  -0.835 -19.709   8.374
    5    HG2  GLU  60           HG2      GLU  60   1.688 -21.362   8.270
    6    HG3  GLU  60           HG3      GLU  60   0.869 -21.047   9.799

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLY  61           H        GLY  61  -1.982 -19.868   6.010
    2    HA3  GLY  61           HA2      GLY  61  -1.757 -22.661   5.047
    3    HA2  GLY  61           HA3      GLY  61  -3.235 -21.916   5.647

  No H/Q in entry =           3
  In of MODEL   33
    1    H    ASP  62           H        ASP  62  -1.004 -20.347   3.438
    2    HA   ASP  62           HA       ASP  62  -3.103 -19.807   1.563
    3    HB2  ASP  62           HB2      ASP  62  -1.296 -18.686   0.290
    4    HB3  ASP  62           HB3      ASP  62  -1.343 -18.177   1.975

  No H/Q in entry =           4
  In of MODEL   33
    1    H    ALA  63           H        ALA  63  -3.341 -22.404   1.451
    2    HA   ALA  63           HA       ALA  63  -1.564 -23.862  -0.225
    3    HB1  ALA  63           HB1      ALA  63  -3.160 -25.010   1.184
    4    HB3  ALA  63           HB2      ALA  63  -3.454 -25.425  -0.505
    5    HB2  ALA  63           HB3      ALA  63  -4.507 -24.271   0.315

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLY  64           H        GLY  64  -4.417 -21.878  -0.843
    2    HA3  GLY  64           HA2      GLY  64  -5.166 -20.845  -2.757
    3    HA2  GLY  64           HA3      GLY  64  -3.649 -21.283  -3.526

  No H/Q in entry =           3
  In of MODEL   33
    1    H    GLU  65           H        GLU  65  -5.196 -21.563  -5.404
    2    HA   GLU  65           HA       GLU  65  -7.109 -23.629  -5.411
    3    HB2  GLU  65           HB2      GLU  65  -5.579 -22.334  -7.664
    4    HB3  GLU  65           HB3      GLU  65  -6.882 -23.497  -7.910
    5    HG2  GLU  65           HG2      GLU  65  -8.440 -22.061  -6.685
    6    HG3  GLU  65           HG3      GLU  65  -7.145 -20.914  -6.348

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLY  66           H        GLY  66  -3.736 -23.600  -6.310
    2    HA3  GLY  66           HA2      GLY  66  -3.732 -26.534  -6.587
    3    HA2  GLY  66           HA3      GLY  66  -2.647 -25.466  -7.453

  No H/Q in entry =           3
  In of MODEL   33
    1    H    LYS  67           H        LYS  67  -1.367 -27.371  -6.354
    2    HA   LYS  67           HA       LYS  67  -0.745 -27.321  -3.638
    3    HB2  LYS  67           HB2      LYS  67   0.829 -28.288  -6.019
    4    HB3  LYS  67           HB3      LYS  67   1.299 -28.593  -4.342
    5    HG2  LYS  67           HG2      LYS  67  -0.869 -29.663  -3.906
    6    HG3  LYS  67           HG3      LYS  67  -1.380 -29.329  -5.560
    7    HD2  LYS  67           HD2      LYS  67   0.500 -30.732  -6.393
    8    HD3  LYS  67           HD3      LYS  67   0.918 -31.119  -4.722
    9    HE2  LYS  67           HE2      LYS  67  -1.798 -31.653  -5.956
   10    HE3  LYS  67           HE3      LYS  67  -0.523 -32.862  -5.812
   11    HZ3  LYS  67           HZ1      LYS  67  -1.825 -33.174  -3.932
   12    HZ2  LYS  67           HZ2      LYS  67  -2.028 -31.509  -3.663
   13    HZ1  LYS  67           HZ3      LYS  67  -0.527 -32.246  -3.357

  No H/Q in entry =          13
  In of MODEL   33
    1    H    MET  68           H        MET  68   1.540 -26.351  -6.134
    2    HA   MET  68           HA       MET  68   3.269 -24.922  -4.432
    3    HB2  MET  68           HB2      MET  68   2.924 -25.059  -7.413
    4    HB3  MET  68           HB3      MET  68   4.144 -24.024  -6.671
    5    HG2  MET  68           HG2      MET  68   3.872 -26.988  -6.106
    6    HG3  MET  68           HG3      MET  68   4.997 -26.309  -7.283
    7    HE3  MET  68           HE1      MET  68   6.337 -28.073  -5.157
    8    HE2  MET  68           HE2      MET  68   7.700 -27.002  -4.833
    9    HE1  MET  68           HE3      MET  68   7.040 -27.110  -6.464

  No H/Q in entry =           9
  In of MODEL   33
    1    H    LYS  69           H        LYS  69   0.666 -23.768  -6.568
    2    HA   LYS  69           HA       LYS  69   1.273 -21.018  -6.221
    3    HB2  LYS  69           HB2      LYS  69  -1.186 -22.379  -7.278
    4    HB3  LYS  69           HB3      LYS  69  -0.972 -20.625  -7.250
    5    HG2  LYS  69           HG2      LYS  69   1.094 -20.833  -8.555
    6    HG3  LYS  69           HG3      LYS  69   0.926 -22.589  -8.564
    7    HD2  LYS  69           HD2      LYS  69  -1.249 -22.345  -9.747
    8    HD3  LYS  69           HD3      LYS  69  -0.993 -20.600  -9.807
    9    HE2  LYS  69           HE2      LYS  69   0.927 -22.640 -10.966
   10    HE3  LYS  69           HE3      LYS  69  -0.285 -21.773 -11.908
   11    HZ1  LYS  69           HZ1      LYS  69   0.737 -19.683 -11.106
   12    HZ3  LYS  69           HZ2      LYS  69   1.770 -20.614 -12.081
   13    HZ2  LYS  69           HZ3      LYS  69   1.977 -20.594 -10.394

  No H/Q in entry =          13
  In of MODEL   33
    1    H    VAL  70           H        VAL  70  -0.261 -19.357  -5.413
    2    HA   VAL  70           HA       VAL  70  -1.628 -20.200  -2.919
    3    HB   VAL  70           HB       VAL  70  -0.835 -18.088  -1.890
    4   HG13  VAL  70          HG11      VAL  70   0.545 -19.873  -1.288
    5   HG12  VAL  70          HG12      VAL  70   1.705 -18.744  -1.991
    6   HG11  VAL  70          HG13      VAL  70   1.121 -20.112  -2.938
    7   HG22  VAL  70          HG21      VAL  70  -0.449 -16.555  -3.632
    8   HG21  VAL  70          HG22      VAL  70   0.401 -17.746  -4.615
    9   HG23  VAL  70          HG23      VAL  70   1.199 -17.031  -3.217

  No H/Q in entry =           9
  In of MODEL   33
    1    H    SER  71           H        SER  71  -3.157 -18.496  -2.151
    2    HA   SER  71           HA       SER  71  -5.087 -17.853  -4.108
    3    HB2  SER  71           HB2      SER  71  -5.536 -18.083  -1.634
    4    HB3  SER  71           HB3      SER  71  -4.724 -16.540  -1.391
    5    HG   SER  71           HG       SER  71  -7.155 -17.123  -2.670

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU  72           H        LEU  72  -5.284 -16.190  -5.434
    2    HA   LEU  72           HA       LEU  72  -3.168 -14.390  -5.922
    3    HB2  LEU  72           HB2      LEU  72  -6.037 -14.427  -6.854
    4    HB3  LEU  72           HB3      LEU  72  -4.839 -13.273  -7.432
    5    HG   LEU  72           HG       LEU  72  -4.441 -16.280  -7.574
    6   HD12  LEU  72          HD11      LEU  72  -5.345 -14.407  -9.781
    7   HD11  LEU  72          HD12      LEU  72  -6.420 -15.498  -8.907
    8   HD13  LEU  72          HD13      LEU  72  -5.118 -16.152  -9.901
    9   HD21  LEU  72          HD21      LEU  72  -2.983 -13.860  -8.616
   10   HD23  LEU  72          HD22      LEU  72  -2.884 -15.367  -9.512
   11   HD22  LEU  72          HD23      LEU  72  -2.321 -15.298  -7.845

  No H/Q in entry =          11
  In of MODEL   33
    1    H    VAL  73           H        VAL  73  -6.251 -14.019  -4.276
    2    HA   VAL  73           HA       VAL  73  -6.278 -11.248  -3.919
    3    HB   VAL  73           HB       VAL  73  -7.976 -11.607  -2.301
    4   HG12  VAL  73          HG11      VAL  73  -8.090 -13.969  -4.193
    5   HG11  VAL  73          HG12      VAL  73  -8.438 -12.311  -4.677
    6   HG13  VAL  73          HG13      VAL  73  -9.455 -13.109  -3.478
    7   HG23  VAL  73          HG21      VAL  73  -8.292 -14.131  -1.579
    8   HG22  VAL  73          HG22      VAL  73  -7.147 -13.102  -0.718
    9   HG21  VAL  73          HG23      VAL  73  -6.568 -14.235  -1.939

  No H/Q in entry =           9
  In of MODEL   33
    1    H    LEU  74           H        LEU  74  -4.346 -13.631  -2.350
    2    HA   LEU  74           HA       LEU  74  -3.916 -12.498   0.173
    3    HB2  LEU  74           HB2      LEU  74  -3.145 -14.718  -0.327
    4    HB3  LEU  74           HB3      LEU  74  -2.102 -14.115  -1.615
    5    HG   LEU  74           HG       LEU  74  -0.768 -12.868   0.050
    6   HD13  LEU  74          HD11      LEU  74  -2.305 -12.358   1.787
    7   HD12  LEU  74          HD12      LEU  74  -1.232 -13.565   2.497
    8   HD11  LEU  74          HD13      LEU  74  -2.831 -14.037   1.922
    9   HD21  LEU  74          HD21      LEU  74  -0.621 -15.454  -0.542
   10   HD23  LEU  74          HD22      LEU  74  -0.986 -15.590   1.163
   11   HD22  LEU  74          HD23      LEU  74   0.443 -14.720   0.655

  No H/Q in entry =          11
  In of MODEL   33
    1    H    VAL  75           H        VAL  75  -2.038 -12.108  -2.793
    2    HA   VAL  75           HA       VAL  75  -0.224 -10.197  -1.787
    3    HB   VAL  75           HB       VAL  75  -1.198 -10.663  -4.607
    4   HG12  VAL  75          HG11      VAL  75   0.864  -9.368  -5.239
    5   HG11  VAL  75          HG12      VAL  75   1.103  -8.989  -3.541
    6   HG13  VAL  75          HG13      VAL  75  -0.312  -8.378  -4.382
    7   HG21  VAL  75          HG21      VAL  75   1.308 -11.482  -3.093
    8   HG23  VAL  75          HG22      VAL  75   1.002 -11.807  -4.799
    9   HG22  VAL  75          HG23      VAL  75  -0.008 -12.560  -3.562

  No H/Q in entry =           9
  In of MODEL   33
    1    H    GLU  76           H        GLU  76  -3.381  -9.828  -3.428
    2    HA   GLU  76           HA       GLU  76  -3.418  -7.013  -3.523
    3    HB2  GLU  76           HB2      GLU  76  -5.091  -8.428  -4.683
    4    HB3  GLU  76           HB3      GLU  76  -5.733  -8.946  -3.133
    5    HG2  GLU  76           HG2      GLU  76  -7.193  -7.222  -3.974
    6    HG3  GLU  76           HG3      GLU  76  -6.298  -6.524  -2.639

  No H/Q in entry =           6
  In of MODEL   33
    1    H    ALA  77           H        ALA  77  -4.528  -9.241  -0.982
    2    HA   ALA  77           HA       ALA  77  -5.464  -7.237   0.786
    3    HB2  ALA  77           HB1      ALA  77  -5.970  -9.689   0.962
    4    HB3  ALA  77           HB2      ALA  77  -5.456  -8.955   2.480
    5    HB1  ALA  77           HB3      ALA  77  -4.326  -9.936   1.550

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLN  78           H        GLN  78  -2.327  -8.804   0.401
    2    HA   GLN  78           HA       GLN  78  -1.051  -7.657   2.648
    3    HB2  GLN  78           HB2      GLN  78  -0.209  -9.599   1.281
    4    HB3  GLN  78           HB3      GLN  78   0.230  -8.451   0.019
    5    HG2  GLN  78           HG2      GLN  78   1.703  -7.272   1.601
    6    HG3  GLN  78           HG3      GLN  78   1.268  -8.419   2.866
    7   HE21  GLN  78          HE21      GLN  78   3.989  -8.140   1.991
    8   HE22  GLN  78          HE22      GLN  78   4.440  -9.575   1.203

  No H/Q in entry =           8
  In of MODEL   33
    1    H    LEU  79           H        LEU  79  -1.428  -6.585  -0.695
    2    HA   LEU  79           HA       LEU  79   0.272  -4.369  -0.685
    3    HB2  LEU  79           HB2      LEU  79  -0.771  -5.165  -2.735
    4    HB3  LEU  79           HB3      LEU  79  -2.368  -4.764  -2.117
    5    HG   LEU  79           HG       LEU  79  -1.809  -2.381  -2.089
    6   HD13  LEU  79          HD11      LEU  79   0.436  -2.153  -1.587
    7   HD12  LEU  79          HD12      LEU  79   0.478  -1.862  -3.326
    8   HD11  LEU  79          HD13      LEU  79   0.925  -3.444  -2.686
    9   HD23  LEU  79          HD21      LEU  79  -1.187  -2.180  -4.644
   10   HD22  LEU  79          HD22      LEU  79  -2.715  -2.919  -4.178
   11   HD21  LEU  79          HD23      LEU  79  -1.352  -3.936  -4.633

  No H/Q in entry =          11
  In of MODEL   33
    1    H    HIS  80           H        HIS  80  -3.191  -4.511   0.159
    2    HA   HIS  80           HA       HIS  80  -3.360  -1.755   0.830
    3    HB2  HIS  80           HB2      HIS  80  -5.076  -4.152   1.152
    4    HB3  HIS  80           HB3      HIS  80  -5.382  -2.813   2.261
    5    HD1  HIS  80           HD1      HIS  80  -6.993  -1.163   1.366
    6    HD2  HIS  80           HD2      HIS  80  -4.829  -2.983  -1.698
    7    HE1  HIS  80           HE1      HIS  80  -7.837  -0.155  -0.806
    8    HE2  HIS  80           HE2      HIS  80  -6.525  -1.259  -2.683

  No H/Q in entry =           8
  In of MODEL   33
    1    H    LEU  81           H        LEU  81  -2.881  -4.658   2.814
    2    HA   LEU  81           HA       LEU  81  -2.846  -3.316   5.301
    3    HB2  LEU  81           HB2      LEU  81  -1.651  -5.939   4.409
    4    HB3  LEU  81           HB3      LEU  81  -1.612  -5.385   6.084
    5    HG   LEU  81           HG       LEU  81  -4.168  -5.615   4.469
    6   HD12  LEU  81          HD11      LEU  81  -4.478  -7.682   6.013
    7   HD11  LEU  81          HD12      LEU  81  -2.724  -7.624   6.190
    8   HD13  LEU  81          HD13      LEU  81  -3.443  -7.846   4.594
    9   HD23  LEU  81          HD21      LEU  81  -5.000  -5.818   6.974
   10   HD22  LEU  81          HD22      LEU  81  -4.667  -4.230   6.286
   11   HD21  LEU  81          HD23      LEU  81  -3.480  -5.001   7.338

  No H/Q in entry =          11
  In of MODEL   33
    1    H    MET  82           H        MET  82  -0.183  -4.234   3.114
    2    HA   MET  82           HA       MET  82   1.915  -3.360   4.789
    3    HB2  MET  82           HB2      MET  82   1.682  -3.692   1.797
    4    HB3  MET  82           HB3      MET  82   3.172  -3.135   2.554
    5    HG2  MET  82           HG2      MET  82   1.749  -5.715   3.280
    6    HG3  MET  82           HG3      MET  82   3.116  -5.613   2.173
    7    HE3  MET  82           HE1      MET  82   6.147  -4.905   4.142
    8    HE2  MET  82           HE2      MET  82   5.232  -3.529   3.532
    9    HE1  MET  82           HE3      MET  82   5.304  -5.018   2.592

  No H/Q in entry =           9
  In of MODEL   33
    1    H    THR  83           H        THR  83   0.092  -1.698   2.246
    2    HA   THR  83           HA       THR  83   1.524   0.739   2.330
    3    HB   THR  83           HB       THR  83  -0.651   1.683   1.358
    4    HG1  THR  83           HG1      THR  83  -2.312   0.399   1.257
    5   HG22  THR  83          HG21      THR  83  -0.405  -0.132  -0.648
    6   HG21  THR  83          HG22      THR  83   1.098  -0.438   0.220
    7   HG23  THR  83          HG23      THR  83   0.746   1.179  -0.390

  No H/Q in entry =           7
  In of MODEL   33
    1    H    SER  84           H        SER  84  -1.482  -0.273   3.945
    2    HA   SER  84           HA       SER  84  -1.951   2.158   5.298
    3    HB2  SER  84           HB2      SER  84  -2.804  -0.675   5.861
    4    HB3  SER  84           HB3      SER  84  -3.281   0.668   6.899
    5    HG   SER  84           HG       SER  84  -3.757   0.364   4.109

  No H/Q in entry =           5
  In of MODEL   33
    1    H    MET  85           H        MET  85  -0.259  -0.791   6.412
    2    HA   MET  85           HA       MET  85   0.282   0.126   9.015
    3    HB2  MET  85           HB2      MET  85   0.551  -2.227   8.225
    4    HB3  MET  85           HB3      MET  85   2.018  -1.727   7.380
    5    HG2  MET  85           HG2      MET  85   2.730  -0.758   9.701
    6    HG3  MET  85           HG3      MET  85   1.490  -1.835  10.342
    7    HE2  MET  85           HE1      MET  85   2.109  -3.929   7.495
    8    HE1  MET  85           HE2      MET  85   1.220  -4.184   8.995
    9    HE3  MET  85           HE3      MET  85   2.592  -5.217   8.605

  No H/Q in entry =           9
  In of MODEL   33
    1    H    LEU  86           H        LEU  86   2.203   0.372   6.054
    2    HA   LEU  86           HA       LEU  86   4.434   1.662   7.200
    3    HB2  LEU  86           HB2      LEU  86   4.221   0.586   4.890
    4    HB3  LEU  86           HB3      LEU  86   3.423   2.075   4.385
    5    HG   LEU  86           HG       LEU  86   5.467   3.302   5.357
    6   HD11  LEU  86          HD11      LEU  86   6.154   0.683   6.148
    7   HD13  LEU  86          HD12      LEU  86   7.170   2.120   6.243
    8   HD12  LEU  86          HD13      LEU  86   7.263   1.073   4.828
    9   HD23  LEU  86          HD21      LEU  86   6.156   1.539   2.999
   10   HD22  LEU  86          HD22      LEU  86   6.565   3.232   3.262
   11   HD21  LEU  86          HD23      LEU  86   4.906   2.779   2.872

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ALA  87           H        ALA  87   1.524   2.933   5.634
    2    HA   ALA  87           HA       ALA  87   2.141   5.658   5.720
    3    HB1  ALA  87           HB1      ALA  87  -0.184   4.051   5.189
    4    HB3  ALA  87           HB2      ALA  87   0.138   5.710   4.690
    5    HB2  ALA  87           HB3      ALA  87  -0.650   5.392   6.237

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ARG  88           H        ARG  88   0.448   3.666   8.116
    2    HA   ARG  88           HA       ARG  88  -0.036   5.716   9.969
    3    HB2  ARG  88           HB2      ARG  88  -0.994   3.371  10.036
    4    HB3  ARG  88           HB3      ARG  88   0.546   2.857  10.733
    5    HG2  ARG  88           HG2      ARG  88   0.096   4.931  12.359
    6    HG3  ARG  88           HG3      ARG  88  -1.576   4.622  11.912
    7    HD2  ARG  88           HD2      ARG  88  -1.692   2.771  13.155
    8    HD3  ARG  88           HD3      ARG  88  -0.110   2.177  12.614
    9    HE   ARG  88           HE       ARG  88  -0.620   3.439  15.074
   10   HH21  ARG  88          HH11      ARG  88   0.953   4.436  16.306
   11   HH22  ARG  88          HH12      ARG  88   2.472   4.851  15.594
   12   HH11  ARG  88          HH21      ARG  88   1.648   3.607  12.485
   13   HH12  ARG  88          HH22      ARG  88   2.874   4.366  13.442

  No H/Q in entry =          13
  In of MODEL   33
    1    H    GLU  89           H        GLU  89   2.740   3.474   9.727
    2    HA   GLU  89           HA       GLU  89   4.022   4.348  12.065
    3    HB2  GLU  89           HB2      GLU  89   4.657   2.327  10.714
    4    HB3  GLU  89           HB3      GLU  89   5.435   3.417   9.565
    5    HG2  GLU  89           HG2      GLU  89   6.936   4.248  11.302
    6    HG3  GLU  89           HG3      GLU  89   6.101   3.296  12.525

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LEU  90           H        LEU  90   4.330   5.509   8.738
    2    HA   LEU  90           HA       LEU  90   6.279   7.493   9.316
    3    HB2  LEU  90           HB2      LEU  90   4.259   7.182   7.099
    4    HB3  LEU  90           HB3      LEU  90   5.499   8.443   7.116
    5    HG   LEU  90           HG       LEU  90   6.152   5.501   7.441
    6   HD12  LEU  90          HD11      LEU  90   6.889   5.733   4.998
    7   HD11  LEU  90          HD12      LEU  90   5.884   7.181   4.958
    8   HD13  LEU  90          HD13      LEU  90   5.154   5.613   5.301
    9   HD22  LEU  90          HD21      LEU  90   8.061   6.634   8.115
   10   HD21  LEU  90          HD22      LEU  90   7.717   8.044   7.112
   11   HD23  LEU  90          HD23      LEU  90   8.361   6.575   6.379

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  91           H        ILE  91   2.740   7.536   9.187
    2    HA   ILE  91           HA       ILE  91   2.421  10.310   9.645
    3    HB   ILE  91           HB       ILE  91   0.615   7.947  10.192
    4   HG12  ILE  91          HG12      ILE  91   0.373  10.234   8.213
    5   HG13  ILE  91          HG13      ILE  91   1.220   8.734   7.834
    6   HG22  ILE  91          HG21      ILE  91  -1.102  10.018  10.269
    7   HG21  ILE  91          HG22      ILE  91   0.309  10.837  10.936
    8   HG23  ILE  91          HG23      ILE  91  -0.334   9.403  11.733
    9   HD13  ILE  91          HD11      ILE  91  -0.733   7.461   7.886
   10   HD12  ILE  91          HD12      ILE  91  -1.315   8.981   7.210
   11   HD11  ILE  91          HD13      ILE  91  -1.580   8.616   8.916

  No H/Q in entry =          11
  In of MODEL   33
    1    H    THR  92           H        THR  92   2.816   7.562  11.839
    2    HA   THR  92           HA       THR  92   2.395   8.934  14.267
    3    HB   THR  92           HB       THR  92   4.184   6.588  13.589
    4    HG1  THR  92           HG1      THR  92   2.209   5.845  13.497
    5   HG22  THR  92          HG21      THR  92   3.812   6.302  16.224
    6   HG21  THR  92          HG22      THR  92   3.759   8.062  16.154
    7   HG23  THR  92          HG23      THR  92   5.183   7.197  15.572

  No H/Q in entry =           7
  In of MODEL   33
    1    H    GLU  93           H        GLU  93   5.333   8.469  12.317
    2    HA   GLU  93           HA       GLU  93   7.105   9.881  14.008
    3    HB2  GLU  93           HB2      GLU  93   7.176   9.571  10.992
    4    HB3  GLU  93           HB3      GLU  93   8.525  10.090  12.000
    5    HG2  GLU  93           HG2      GLU  93   7.100   7.463  12.450
    6    HG3  GLU  93           HG3      GLU  93   8.479   7.607  11.367

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LEU  94           H        LEU  94   5.049  10.914  11.307
    2    HA   LEU  94           HA       LEU  94   5.871  13.613  11.207
    3    HB2  LEU  94           HB2      LEU  94   3.268  12.265  10.464
    4    HB3  LEU  94           HB3      LEU  94   3.536  13.991  10.224
    5    HG   LEU  94           HG       LEU  94   5.535  11.993   9.161
    6   HD11  LEU  94          HD11      LEU  94   2.792  12.562   8.113
    7   HD13  LEU  94          HD12      LEU  94   3.765  11.099   7.980
    8   HD12  LEU  94          HD13      LEU  94   4.103  12.479   6.936
    9   HD23  LEU  94          HD21      LEU  94   5.788  13.830   7.440
   10   HD22  LEU  94          HD22      LEU  94   6.214  14.318   9.080
   11   HD21  LEU  94          HD23      LEU  94   4.662  14.796   8.390

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  95           H        ILE  95   3.333  12.008  13.109
    2    HA   ILE  95           HA       ILE  95   2.310  14.362  14.312
    3    HB   ILE  95           HB       ILE  95   2.315  11.479  15.233
    4   HG12  ILE  95          HG12      ILE  95   0.099  13.267  14.197
    5   HG13  ILE  95          HG13      ILE  95   1.044  12.204  13.159
    6   HG21  ILE  95          HG21      ILE  95   1.053  13.957  16.444
    7   HG23  ILE  95          HG22      ILE  95   2.098  12.781  17.242
    8   HG22  ILE  95          HG23      ILE  95   0.458  12.330  16.774
    9   HD13  ILE  95          HD11      ILE  95   0.135  10.269  14.080
   10   HD12  ILE  95          HD12      ILE  95  -1.241  11.366  14.164
   11   HD11  ILE  95          HD13      ILE  95  -0.270  11.060  15.604

  No H/Q in entry =          11
  In of MODEL   33
    1    H    GLU  96           H        GLU  96   4.897  12.127  15.292
    2    HA   GLU  96           HA       GLU  96   5.471  13.319  17.783
    3    HB2  GLU  96           HB2      GLU  96   6.404  11.156  17.127
    4    HB3  GLU  96           HB3      GLU  96   7.336  11.926  15.844
    5    HG2  GLU  96           HG2      GLU  96   8.994  12.464  17.299
    6    HG3  GLU  96           HG3      GLU  96   7.857  13.281  18.361

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LEU  97           H        LEU  97   6.534  14.090  14.493
    2    HA   LEU  97           HA       LEU  97   8.433  16.076  15.198
    3    HB2  LEU  97           HB2      LEU  97   6.827  15.539  12.710
    4    HB3  LEU  97           HB3      LEU  97   7.854  16.965  12.829
    5    HG   LEU  97           HG       LEU  97   8.872  14.161  13.380
    6   HD12  LEU  97          HD11      LEU  97   9.858  14.354  11.058
    7   HD11  LEU  97          HD12      LEU  97   8.812  15.750  10.801
    8   HD13  LEU  97          HD13      LEU  97   8.107  14.161  11.097
    9   HD23  LEU  97          HD21      LEU  97  11.044  15.431  12.628
   10   HD22  LEU  97          HD22      LEU  97  10.434  15.701  14.260
   11   HD21  LEU  97          HD23      LEU  97  10.119  16.887  12.995

  No H/Q in entry =          11
  In of MODEL   33
    1    H    HIS  98           H        HIS  98   4.939  16.229  14.561
    2    HA   HIS  98           HA       HIS  98   4.654  19.030  14.702
    3    HB2  HIS  98           HB2      HIS  98   2.757  16.787  15.434
    4    HB3  HIS  98           HB3      HIS  98   2.298  18.490  15.494
    5    HD1  HIS  98           HD1      HIS  98   3.295  15.774  13.080
    6    HD2  HIS  98           HD2      HIS  98   1.937  19.714  12.971
    7    HE1  HIS  98           HE1      HIS  98   2.726  16.269  10.660
    8    HE2  HIS  98           HE2      HIS  98   1.903  18.662  10.572

  No H/Q in entry =           8
  In of MODEL   33
    1    H    GLU  99           H        GLU  99   4.788  16.537  17.196
    2    HA   GLU  99           HA       GLU  99   4.198  18.231  19.400
    3    HB2  GLU  99           HB2      GLU  99   4.099  15.749  19.494
    4    HB3  GLU  99           HB3      GLU  99   5.858  15.696  19.377
    5    HG2  GLU  99           HG2      GLU  99   6.062  16.985  21.452
    6    HG3  GLU  99           HG3      GLU  99   4.311  17.133  21.556

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LYS 100           H        LYS 100   7.240  17.289  17.819
    2    HA   LYS 100           HA       LYS 100   8.911  18.679  19.669
    3    HB2  LYS 100           HB2      LYS 100   9.391  17.756  16.827
    4    HB3  LYS 100           HB3      LYS 100  10.629  18.519  17.830
    5    HG2  LYS 100           HG2      LYS 100  10.253  16.767  19.570
    6    HG3  LYS 100           HG3      LYS 100   9.113  15.971  18.483
    7    HD2  LYS 100           HD2      LYS 100  10.897  15.682  16.807
    8    HD3  LYS 100           HD3      LYS 100  12.043  16.491  17.879
    9    HE2  LYS 100           HE2      LYS 100  11.647  14.735  19.596
   10    HE3  LYS 100           HE3      LYS 100  10.563  13.906  18.475
   11    HZ1  LYS 100           HZ1      LYS 100  13.383  14.563  17.807
   12    HZ3  LYS 100           HZ2      LYS 100  12.330  13.514  16.982
   13    HZ2  LYS 100           HZ3      LYS 100  12.924  13.090  18.517

  No H/Q in entry =          13
  In of MODEL   33
    1    H    LEU 101           H        LEU 101   7.207  19.618  16.724
    2    HA   LEU 101           HA       LEU 101   8.431  22.170  16.387
    3    HB2  LEU 101           HB2      LEU 101   5.826  20.950  15.511
    4    HB3  LEU 101           HB3      LEU 101   6.084  22.680  15.305
    5    HG   LEU 101           HG       LEU 101   8.106  20.656  14.326
    6   HD12  LEU 101          HD11      LEU 101   6.944  21.171  12.047
    7   HD11  LEU 101          HD12      LEU 101   5.551  21.606  13.035
    8   HD13  LEU 101          HD13      LEU 101   6.208  19.972  13.111
    9   HD21  LEU 101          HD21      LEU 101   7.489  23.572  13.778
   10   HD23  LEU 101          HD22      LEU 101   8.459  22.609  12.665
   11   HD22  LEU 101          HD23      LEU 101   9.011  22.861  14.321

  No H/Q in entry =          11
  In of MODEL   33
    1    H    LYS 102           H        LYS 102   6.902  21.035  19.008
    2    HA   LYS 102           HA       LYS 102   6.284  22.127  20.945
    3    HB2  LYS 102           HB2      LYS 102   7.571  24.112  19.818
    4    HB3  LYS 102           HB3      LYS 102   5.973  24.726  19.451
    5    HG2  LYS 102           HG2      LYS 102   7.362  24.459  22.096
    6    HG3  LYS 102           HG3      LYS 102   6.412  25.793  21.474
    7    HD2  LYS 102           HD2      LYS 102   5.160  23.161  22.354
    8    HD3  LYS 102           HD3      LYS 102   5.421  24.519  23.438
    9    HE2  LYS 102           HE2      LYS 102   3.132  24.130  21.960
   10    HE3  LYS 102           HE3      LYS 102   3.646  25.672  22.642
   11    HZ2  LYS 102           HZ1      LYS 102   3.104  25.787  20.265
   12    HZ1  LYS 102           HZ2      LYS 102   4.359  24.699  19.934
   13    HZ3  LYS 102           HZ3      LYS 102   4.713  26.227  20.578

  No H/Q in entry =          13
  In of MODEL   33
    1    H    ALA 103           H        ALA 103   4.640  23.682  18.188
    2    HA   ALA 103           HA       ALA 103   2.193  24.270  19.087
    3    HB1  ALA 103           HB1      ALA 103   1.279  23.436  16.847
    4    HB2  ALA 103           HB2      ALA 103   2.922  22.892  16.508
    5    HB3  ALA 103           HB3      ALA 103   2.598  24.605  16.779

  No H/Q in entry =           5
  In of MODEL   33
    1    H1   ALA   1           H3       ALA   1  10.440 -20.230  -6.305
    2    H2   ALA   1           H2       ALA   1   9.468 -20.429  -7.687
    3    H3   ALA   1           H1       ALA   1   9.034 -21.175  -6.223
    4    HA   ALA   1           HA       ALA   1  10.059 -22.988  -6.971
    5    HB1  ALA   1           HB1      ALA   1  10.145 -22.626  -9.246
    6    HB2  ALA   1           HB2      ALA   1  11.875 -22.486  -8.926
    7    HB3  ALA   1           HB3      ALA   1  10.884 -21.033  -9.069

  No H/Q in entry =           7
  In of MODEL   33
    1    H    GLU   2           H        GLU   2  12.337 -23.952  -7.042
    2    HA   GLU   2           HA       GLU   2  13.731 -23.882  -4.837
    3    HB2  GLU   2           HB2      GLU   2  15.074 -23.753  -7.543
    4    HB3  GLU   2           HB3      GLU   2  15.806 -24.372  -6.063
    5    HG2  GLU   2           HG2      GLU   2  14.776 -26.382  -6.302
    6    HG3  GLU   2           HG3      GLU   2  13.208 -25.627  -6.551

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLU   3           H        GLU   3  15.500 -22.024  -7.245
    2    HA   GLU   3           HA       GLU   3  16.673 -20.347  -5.288
    3    HB2  GLU   3           HB2      GLU   3  16.602 -20.339  -8.298
    4    HB3  GLU   3           HB3      GLU   3  17.360 -19.016  -7.412
    5    HG2  GLU   3           HG2      GLU   3  19.019 -20.401  -6.501
    6    HG3  GLU   3           HG3      GLU   3  18.063 -21.862  -6.719

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LEU   4           H        LEU   4  14.383 -19.481  -7.905
    2    HA   LEU   4           HA       LEU   4  13.935 -16.870  -7.287
    3    HB2  LEU   4           HB2      LEU   4  11.744 -18.830  -8.009
    4    HB3  LEU   4           HB3      LEU   4  11.679 -17.081  -8.204
    5    HG   LEU   4           HG       LEU   4  13.625 -18.953  -9.591
    6   HD13  LEU   4          HD11      LEU   4  12.314 -18.793 -11.494
    7   HD12  LEU   4          HD12      LEU   4  11.618 -17.245 -11.020
    8   HD11  LEU   4          HD13      LEU   4  11.059 -18.734 -10.258
    9   HD23  LEU   4          HD21      LEU   4  13.967 -16.708 -10.940
   10   HD22  LEU   4          HD22      LEU   4  14.834 -16.958  -9.426
   11   HD21  LEU   4          HD23      LEU   4  13.387 -15.953  -9.455

  No H/Q in entry =          11
  In of MODEL   33
    1    H    GLU   5           H        GLU   5  12.442 -19.648  -5.642
    2    HA   GLU   5           HA       GLU   5  10.784 -18.070  -3.927
    3    HB2  GLU   5           HB2      GLU   5  10.339 -20.443  -4.449
    4    HB3  GLU   5           HB3      GLU   5  11.777 -20.892  -3.531
    5    HG2  GLU   5           HG2      GLU   5  10.837 -19.880  -1.509
    6    HG3  GLU   5           HG3      GLU   5   9.416 -19.358  -2.414

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLU   6           H        GLU   6  13.923 -19.669  -3.504
    2    HA   GLU   6           HA       GLU   6  14.295 -18.820  -0.806
    3    HB2  GLU   6           HB2      GLU   6  15.506 -20.739  -1.792
    4    HB3  GLU   6           HB3      GLU   6  16.358 -19.631  -2.871
    5    HG2  GLU   6           HG2      GLU   6  17.322 -18.463  -0.938
    6    HG3  GLU   6           HG3      GLU   6  16.445 -19.528   0.159

  No H/Q in entry =           6
  In of MODEL   33
    1    H    VAL   7           H        VAL   7  15.051 -17.492  -3.958
    2    HA   VAL   7           HA       VAL   7  16.754 -15.376  -3.098
    3    HB   VAL   7           HB       VAL   7  15.033 -15.726  -5.567
    4   HG11  VAL   7          HG11      VAL   7  16.943 -13.524  -4.761
    5   HG13  VAL   7          HG12      VAL   7  15.298 -13.372  -5.375
    6   HG12  VAL   7          HG13      VAL   7  16.599 -13.879  -6.453
    7   HG21  VAL   7          HG21      VAL   7  17.135 -17.195  -5.012
    8   HG23  VAL   7          HG22      VAL   7  18.046 -15.738  -5.412
    9   HG22  VAL   7          HG23      VAL   7  16.999 -16.480  -6.620

  No H/Q in entry =           9
  In of MODEL   33
    1    H    VAL   8           H        VAL   8  13.257 -15.625  -3.637
    2    HA   VAL   8           HA       VAL   8  12.609 -12.915  -3.157
    3    HB   VAL   8           HB       VAL   8  10.984 -15.434  -2.715
    4   HG13  VAL   8          HG11      VAL   8  10.002 -13.734  -1.344
    5   HG12  VAL   8          HG12      VAL   8   9.042 -13.776  -2.823
    6   HG11  VAL   8          HG13      VAL   8  10.237 -12.502  -2.585
    7   HG23  VAL   8          HG21      VAL   8  10.311 -13.534  -4.900
    8   HG22  VAL   8          HG22      VAL   8  10.390 -15.294  -4.925
    9   HG21  VAL   8          HG23      VAL   8  11.864 -14.346  -5.095

  No H/Q in entry =           9
  In of MODEL   33
    1    H    MET   9           H        MET   9  12.872 -15.726  -0.983
    2    HA   MET   9           HA       MET   9  12.076 -14.454   1.394
    3    HB2  MET   9           HB2      MET   9  13.967 -16.739   0.838
    4    HB3  MET   9           HB3      MET   9  13.682 -16.158   2.479
    5    HG2  MET   9           HG2      MET   9  11.254 -16.528   2.184
    6    HG3  MET   9           HG3      MET   9  11.551 -17.130   0.553
    7    HE2  MET   9           HE1      MET   9  11.171 -18.300   4.294
    8    HE1  MET   9           HE2      MET   9  12.577 -17.252   4.117
    9    HE3  MET   9           HE3      MET   9  12.797 -18.945   4.549

  No H/Q in entry =           9
  In of MODEL   33
    1    H    GLY  10           H        GLY  10  15.248 -14.692  -0.180
    2    HA3  GLY  10           HA2      GLY  10  16.724 -13.281   1.785
    3    HA2  GLY  10           HA3      GLY  10  17.177 -13.446   0.088

  No H/Q in entry =           3
  In of MODEL   33
    1    H    LEU  11           H        LEU  11  15.008 -12.212  -1.137
    2    HA   LEU  11           HA       LEU  11  15.707  -9.471  -0.973
    3    HB2  LEU  11           HB2      LEU  11  13.326 -10.868  -2.198
    4    HB3  LEU  11           HB3      LEU  11  13.613  -9.134  -2.356
    5    HG   LEU  11           HG       LEU  11  15.627 -11.250  -3.158
    6   HD13  LEU  11          HD11      LEU  11  13.872 -11.607  -4.670
    7   HD12  LEU  11          HD12      LEU  11  14.875 -10.428  -5.513
    8   HD11  LEU  11          HD13      LEU  11  13.409  -9.905  -4.686
    9   HD22  LEU  11          HD21      LEU  11  16.868  -9.293  -2.935
   10   HD21  LEU  11          HD22      LEU  11  15.496  -8.249  -3.305
   11   HD23  LEU  11          HD23      LEU  11  16.317  -9.119  -4.600

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  12           H        ILE  12  12.937 -11.287   0.306
    2    HA   ILE  12           HA       ILE  12  11.558  -9.060   1.377
    3    HB   ILE  12           HB       ILE  12  11.588 -11.942   2.327
    4   HG12  ILE  12          HG12      ILE  12  10.900 -11.316  -0.121
    5   HG13  ILE  12          HG13      ILE  12   9.868 -12.395   0.795
    6   HG21  ILE  12          HG21      ILE  12   9.647  -9.672   2.876
    7   HG23  ILE  12          HG22      ILE  12  10.648 -10.514   4.058
    8   HG22  ILE  12          HG23      ILE  12   9.326 -11.363   3.257
    9   HD11  ILE  12          HD11      ILE  12   9.461  -9.402   0.558
   10   HD13  ILE  12          HD12      ILE  12   8.360 -10.562   1.299
   11   HD12  ILE  12          HD13      ILE  12   8.636 -10.596  -0.429

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  13           H        ILE  13  13.950 -11.276   2.766
    2    HA   ILE  13           HA       ILE  13  14.003 -10.101   5.348
    3    HB   ILE  13           HB       ILE  13  16.047 -11.681   3.768
    4   HG12  ILE  13          HG12      ILE  13  13.776 -12.641   4.624
    5   HG13  ILE  13          HG13      ILE  13  15.250 -13.566   4.891
    6   HG23  ILE  13          HG21      ILE  13  17.492 -10.663   5.260
    7   HG22  ILE  13          HG22      ILE  13  16.970 -12.027   6.241
    8   HG21  ILE  13          HG23      ILE  13  16.251 -10.436   6.491
    9   HD13  ILE  13          HD11      ILE  13  15.279 -13.102   7.189
   10   HD12  ILE  13          HD12      ILE  13  13.548 -13.159   6.873
   11   HD11  ILE  13          HD13      ILE  13  14.367 -11.607   6.987

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ASN  14           H        ASN  14  15.943  -9.571   2.421
    2    HA   ASN  14           HA       ASN  14  17.698  -7.636   3.477
    3    HB2  ASN  14           HB2      ASN  14  17.661  -8.898   1.159
    4    HB3  ASN  14           HB3      ASN  14  16.769  -7.478   0.629
    5   HD21  ASN  14          HD21      ASN  14  19.202  -7.822  -0.570
    6   HD22  ASN  14          HD22      ASN  14  20.351  -6.742   0.054

  No H/Q in entry =           6
  In of MODEL   33
    1    H    SER  15           H        SER  15  14.580  -7.279   1.801
    2    HA   SER  15           HA       SER  15  14.474  -4.458   1.863
    3    HB2  SER  15           HB2      SER  15  12.139  -4.698   1.379
    4    HB3  SER  15           HB3      SER  15  12.929  -6.064   0.602
    5    HG   SER  15           HG       SER  15  10.978  -6.211   2.261

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLY  16           H        GLY  16  13.387  -6.920   4.168
    2    HA3  GLY  16           HA2      GLY  16  12.179  -5.172   6.034
    3    HA2  GLY  16           HA3      GLY  16  12.792  -6.782   6.390

  No H/Q in entry =           3
  In of MODEL   33
    1    H    GLN  17           H        GLN  17  15.501  -6.453   5.785
    2    HA   GLN  17           HA       GLN  17  16.472  -5.238   8.163
    3    HB2  GLN  17           HB2      GLN  17  17.703  -7.024   6.985
    4    HB3  GLN  17           HB3      GLN  17  17.980  -5.936   5.625
    5    HG2  GLN  17           HG2      GLN  17  19.214  -4.395   7.101
    6    HG3  GLN  17           HG3      GLN  17  18.939  -5.479   8.464
    7   HE21  GLN  17          HE21      GLN  17  20.691  -6.827   8.862
    8   HE22  GLN  17          HE22      GLN  17  21.777  -7.387   7.685

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ALA  18           H        ALA  18  16.268  -4.154   4.806
    2    HA   ALA  18           HA       ALA  18  17.709  -1.764   5.030
    3    HB2  ALA  18           HB1      ALA  18  16.579  -2.973   2.966
    4    HB3  ALA  18           HB2      ALA  18  16.846  -1.230   2.952
    5    HB1  ALA  18           HB3      ALA  18  15.248  -1.874   3.328

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ARG  19           H        ARG  19  14.210  -2.347   5.443
    2    HA   ARG  19           HA       ARG  19  13.549   0.303   6.166
    3    HB2  ARG  19           HB2      ARG  19  11.863  -1.446   5.584
    4    HB3  ARG  19           HB3      ARG  19  12.211  -2.247   7.118
    5    HG2  ARG  19           HG2      ARG  19  11.509  -0.257   8.365
    6    HG3  ARG  19           HG3      ARG  19  11.253   0.623   6.859
    7    HD2  ARG  19           HD2      ARG  19   9.115  -0.172   7.688
    8    HD3  ARG  19           HD3      ARG  19   9.525  -1.050   6.208
    9    HE   ARG  19           HE       ARG  19  10.492  -2.597   8.306
   10   HH21  ARG  19          HH11      ARG  19   9.245  -4.237   9.248
   11   HH22  ARG  19          HH12      ARG  19   7.524  -4.207   9.085
   12   HH11  ARG  19          HH21      ARG  19   7.494  -1.299   7.227
   13   HH12  ARG  19          HH22      ARG  19   6.533  -2.544   7.937

  No H/Q in entry =          13
  In of MODEL   33
    1    H    SER  20           H        SER  20  14.413  -2.532   8.116
    2    HA   SER  20           HA       SER  20  14.143  -1.437  10.656
    3    HB2  SER  20           HB2      SER  20  14.773  -3.850   9.969
    4    HB3  SER  20           HB3      SER  20  16.434  -3.262   9.950
    5    HG   SER  20           HG       SER  20  14.591  -3.273  12.106

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU  21           H        LEU  21  16.976  -1.375   8.507
    2    HA   LEU  21           HA       LEU  21  18.661   0.105  10.240
    3    HB2  LEU  21           HB2      LEU  21  18.625  -0.157   7.225
    4    HB3  LEU  21           HB3      LEU  21  19.887   0.693   8.113
    5    HG   LEU  21           HG       LEU  21  19.136  -2.195   8.648
    6   HD12  LEU  21          HD11      LEU  21  21.349  -2.625   7.418
    7   HD11  LEU  21          HD12      LEU  21  21.195  -0.983   6.796
    8   HD13  LEU  21          HD13      LEU  21  19.964  -2.186   6.417
    9   HD23  LEU  21          HD21      LEU  21  21.633  -2.046   9.516
   10   HD22  LEU  21          HD22      LEU  21  20.334  -1.460  10.548
   11   HD21  LEU  21          HD23      LEU  21  21.300  -0.321   9.624

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ALA  22           H        ALA  22  16.386   1.082   7.696
    2    HA   ALA  22           HA       ALA  22  16.929   3.840   7.713
    3    HB3  ALA  22           HB1      ALA  22  15.517   2.602   6.039
    4    HB2  ALA  22           HB2      ALA  22  14.815   4.115   6.611
    5    HB1  ALA  22           HB3      ALA  22  14.225   2.575   7.239

  No H/Q in entry =           5
  In of MODEL   33
    1    H    TYR  23           H        TYR  23  14.438   2.024   9.556
    2    HA   TYR  23           HA       TYR  23  13.485   4.260  11.014
    3    HB2  TYR  23           HB2      TYR  23  12.248   2.147  10.994
    4    HB3  TYR  23           HB3      TYR  23  13.581   1.335  11.813
    5    HD1  TYR  23           HD1      TYR  23  11.084   4.082  12.189
    6    HD2  TYR  23           HD2      TYR  23  13.784   1.391  14.169
    7    HE1  TYR  23           HE1      TYR  23  10.164   4.775  14.388
    8    HE2  TYR  23           HE2      TYR  23  12.865   2.083  16.365
    9    HH   TYR  23           HH       TYR  23   9.992   3.950  16.648

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ALA  24           H        ALA  24  16.130   1.979  11.634
    2    HA   ALA  24           HA       ALA  24  16.814   2.968  14.197
    3    HB1  ALA  24           HB1      ALA  24  18.166   1.173  14.022
    4    HB3  ALA  24           HB2      ALA  24  19.190   2.095  12.920
    5    HB2  ALA  24           HB3      ALA  24  17.891   1.090  12.283

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA  25           H        ALA  25  17.757   3.901  10.915
    2    HA   ALA  25           HA       ALA  25  19.709   5.831  11.555
    3    HB1  ALA  25           HB1      ALA  25  18.980   4.888   9.242
    4    HB3  ALA  25           HB2      ALA  25  19.485   6.575   9.335
    5    HB2  ALA  25           HB3      ALA  25  17.770   6.171   9.273

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU  26           H        LEU  26  16.193   6.068  11.211
    2    HA   LEU  26           HA       LEU  26  15.977   8.849  11.668
    3    HB2  LEU  26           HB2      LEU  26  14.109   7.619  10.746
    4    HB3  LEU  26           HB3      LEU  26  14.022   6.589  12.170
    5    HG   LEU  26           HG       LEU  26  13.427   8.546  13.557
    6   HD12  LEU  26          HD11      LEU  26  12.765  10.650  12.238
    7   HD11  LEU  26          HD12      LEU  26  13.738   9.998  10.923
    8   HD13  LEU  26          HD13      LEU  26  14.491  10.378  12.473
    9   HD21  LEU  26          HD21      LEU  26  11.739   8.241  11.054
   10   HD23  LEU  26          HD22      LEU  26  11.187   8.937  12.575
   11   HD22  LEU  26          HD23      LEU  26  11.635   7.235  12.499

  No H/Q in entry =          11
  In of MODEL   33
    1    H    LYS  27           H        LYS  27  15.872   6.066  13.856
    2    HA   LYS  27           HA       LYS  27  15.294   7.429  16.230
    3    HB2  LYS  27           HB2      LYS  27  15.314   4.954  15.960
    4    HB3  LYS  27           HB3      LYS  27  17.078   5.002  15.909
    5    HG2  LYS  27           HG2      LYS  27  17.141   5.983  18.160
    6    HG3  LYS  27           HG3      LYS  27  15.374   6.006  18.213
    7    HD2  LYS  27           HD2      LYS  27  15.341   3.540  17.972
    8    HD3  LYS  27           HD3      LYS  27  17.106   3.524  17.952
    9    HE2  LYS  27           HE2      LYS  27  17.153   4.509  20.211
   10    HE3  LYS  27           HE3      LYS  27  15.387   4.554  20.233
   11    HZ3  LYS  27           HZ1      LYS  27  16.175   2.597  21.377
   12    HZ2  LYS  27           HZ2      LYS  27  17.083   2.118  20.021
   13    HZ1  LYS  27           HZ3      LYS  27  15.385   2.128  19.949

  No H/Q in entry =          13
  In of MODEL   33
    1    H    GLN  28           H        GLN  28  18.401   6.840  14.622
    2    HA   GLN  28           HA       GLN  28  20.098   7.914  16.607
    3    HB2  GLN  28           HB2      GLN  28  20.374   7.878  13.590
    4    HB3  GLN  28           HB3      GLN  28  21.667   8.335  14.700
    5    HG2  GLN  28           HG2      GLN  28  20.228   5.667  14.736
    6    HG3  GLN  28           HG3      GLN  28  21.806   5.945  14.003
    7   HE21  GLN  28          HE21      GLN  28  20.546   4.631  16.711
    8   HE22  GLN  28          HE22      GLN  28  21.748   5.038  17.837

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ALA  29           H        ALA  29  18.339   9.408  13.926
    2    HA   ALA  29           HA       ALA  29  19.349  12.025  14.179
    3    HB2  ALA  29           HB1      ALA  29  17.646  12.671  12.717
    4    HB1  ALA  29           HB2      ALA  29  16.500  11.501  13.371
    5    HB3  ALA  29           HB3      ALA  29  17.824  10.955  12.341

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LYS  30           H        LYS  30  16.573  10.433  15.710
    2    HA   LYS  30           HA       LYS  30  15.574  12.688  17.076
    3    HB2  LYS  30           HB2      LYS  30  15.453   9.746  17.775
    4    HB3  LYS  30           HB3      LYS  30  14.597  10.998  18.675
    5    HG2  LYS  30           HG2      LYS  30  13.465  11.693  16.563
    6    HG3  LYS  30           HG3      LYS  30  14.260  10.355  15.730
    7    HD2  LYS  30           HD2      LYS  30  13.189   8.749  17.260
    8    HD3  LYS  30           HD3      LYS  30  12.404  10.076  18.117
    9    HE2  LYS  30           HE2      LYS  30  11.229  10.718  16.031
   10    HE3  LYS  30           HE3      LYS  30  11.994   9.363  15.194
   11    HZ2  LYS  30           HZ1      LYS  30   9.688   8.962  16.084
   12    HZ1  LYS  30           HZ2      LYS  30  10.363   9.009  17.648
   13    HZ3  LYS  30           HZ3      LYS  30  10.860   7.823  16.533

  No H/Q in entry =          13
  In of MODEL   33
    1    H    GLN  31           H        GLN  31  18.229  10.505  17.796
    2    HA   GLN  31           HA       GLN  31  18.573  11.513  20.491
    3    HB2  GLN  31           HB2      GLN  31  20.582   9.936  18.874
    4    HB3  GLN  31           HB3      GLN  31  20.456  10.058  20.629
    5    HG2  GLN  31           HG2      GLN  31  17.935   9.118  19.870
    6    HG3  GLN  31           HG3      GLN  31  19.028   8.271  18.783
    7   HE21  GLN  31          HE21      GLN  31  17.490   7.127  21.064
    8   HE22  GLN  31          HE22      GLN  31  18.648   6.459  22.108

  No H/Q in entry =           8
  In of MODEL   33
    1    H    GLY  32           H        GLY  32  19.085  12.834  17.525
    2    HA3  GLY  32           HA2      GLY  32  20.076  14.876  17.010
    3    HA2  GLY  32           HA3      GLY  32  20.841  14.874  18.595

  No H/Q in entry =           3
  In of MODEL   33
    1    H    ASP  33           H        ASP  33  21.241  11.983  16.810
    2    HA   ASP  33           HA       ASP  33  24.068  12.646  16.332
    3    HB2  ASP  33           HB2      ASP  33  22.548  10.037  16.450
    4    HB3  ASP  33           HB3      ASP  33  24.232  10.147  15.947

  No H/Q in entry =           4
  In of MODEL   33
    1    H    PHE  34           H        PHE  34  23.583  13.976  14.455
    2    HA   PHE  34           HA       PHE  34  22.219  13.002  12.172
    3    HB2  PHE  34           HB2      PHE  34  24.361  15.127  12.397
    4    HB3  PHE  34           HB3      PHE  34  23.367  14.843  10.969
    5    HD1  PHE  34           HD1      PHE  34  23.640  16.770  13.885
    6    HD2  PHE  34           HD2      PHE  34  20.742  14.672  11.509
    7    HE1  PHE  34           HE1      PHE  34  21.834  18.174  14.844
    8    HE2  PHE  34           HE2      PHE  34  18.940  16.076  12.470
    9    HZ   PHE  34           HZ       PHE  34  19.490  17.827  14.133

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ALA  35           H        ALA  35  25.597  12.798  13.164
    2    HA   ALA  35           HA       ALA  35  26.688  11.978  10.700
    3    HB3  ALA  35           HB1      ALA  35  28.371  10.797  12.410
    4    HB2  ALA  35           HB2      ALA  35  27.517  11.824  13.561
    5    HB1  ALA  35           HB3      ALA  35  28.351  12.547  12.186

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA  36           H        ALA  36  25.577  10.020  13.467
    2    HA   ALA  36           HA       ALA  36  26.046   7.534  12.184
    3    HB2  ALA  36           HB1      ALA  36  25.622   6.785  14.260
    4    HB3  ALA  36           HB2      ALA  36  23.935   7.286  14.119
    5    HB1  ALA  36           HB3      ALA  36  25.143   8.412  14.738

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA  37           H        ALA  37  23.233   9.670  12.335
    2    HA   ALA  37           HA       ALA  37  21.364   7.910  11.165
    3    HB3  ALA  37           HB1      ALA  37  21.602  10.871  11.462
    4    HB1  ALA  37           HB2      ALA  37  20.289   9.796  11.938
    5    HB2  ALA  37           HB3      ALA  37  20.471  10.271  10.249

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LYS  38           H        LYS  38  23.465  10.366   9.681
    2    HA   LYS  38           HA       LYS  38  22.812   9.946   7.006
    3    HB2  LYS  38           HB2      LYS  38  24.634  11.495   8.445
    4    HB3  LYS  38           HB3      LYS  38  25.658  10.504   7.413
    5    HG2  LYS  38           HG2      LYS  38  24.487  11.282   5.424
    6    HG3  LYS  38           HG3      LYS  38  23.300  12.139   6.412
    7    HD2  LYS  38           HD2      LYS  38  24.904  13.731   7.160
    8    HD3  LYS  38           HD3      LYS  38  26.258  12.741   6.616
    9    HE2  LYS  38           HE2      LYS  38  25.900  14.617   5.070
   10    HE3  LYS  38           HE3      LYS  38  25.556  13.082   4.265
   11    HZ3  LYS  38           HZ1      LYS  38  23.360  13.534   4.146
   12    HZ2  LYS  38           HZ2      LYS  38  23.888  15.147   4.234
   13    HZ1  LYS  38           HZ3      LYS  38  23.318  14.362   5.627

  No H/Q in entry =          13
  In of MODEL   33
    1    H    ALA  39           H        ALA  39  25.330   8.337   8.947
    2    HA   ALA  39           HA       ALA  39  26.385   6.750   6.869
    3    HB2  ALA  39           HB1      ALA  39  26.307   5.781   9.711
    4    HB1  ALA  39           HB2      ALA  39  27.262   7.204   9.293
    5    HB3  ALA  39           HB3      ALA  39  27.605   5.655   8.525

  No H/Q in entry =           5
  In of MODEL   33
    1    H    MET  40           H        MET  40  23.781   6.136   9.178
    2    HA   MET  40           HA       MET  40  23.328   3.434   8.440
    3    HB2  MET  40           HB2      MET  40  21.523   5.480   9.745
    4    HB3  MET  40           HB3      MET  40  21.111   3.772   9.569
    5    HG2  MET  40           HG2      MET  40  23.669   4.704  10.900
    6    HG3  MET  40           HG3      MET  40  22.178   4.430  11.800
    7    HE3  MET  40           HE1      MET  40  21.606   0.798  11.970
    8    HE2  MET  40           HE2      MET  40  20.737   2.104  11.170
    9    HE1  MET  40           HE3      MET  40  21.486   2.387  12.740

  No H/Q in entry =           9
  In of MODEL   33
    1    H    MET  41           H        MET  41  21.916   6.493   7.266
    2    HA   MET  41           HA       MET  41  19.948   5.306   5.601
    3    HB2  MET  41           HB2      MET  41  21.433   7.894   5.086
    4    HB3  MET  41           HB3      MET  41  19.900   7.405   4.374
    5    HG2  MET  41           HG2      MET  41  19.166   7.214   6.928
    6    HG3  MET  41           HG3      MET  41  20.478   8.368   7.146
    7    HE2  MET  41           HE1      MET  41  19.903   9.664   3.815
    8    HE1  MET  41           HE2      MET  41  20.867  10.098   5.223
    9    HE3  MET  41           HE3      MET  41  19.594  11.182   4.667

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ASP  42           H        ASP  42  23.320   6.223   5.034
    2    HA   ASP  42           HA       ASP  42  23.397   5.754   2.275
    3    HB2  ASP  42           HB2      ASP  42  25.159   6.744   4.038
    4    HB3  ASP  42           HB3      ASP  42  25.812   5.117   3.904

  No H/Q in entry =           4
  In of MODEL   33
    1    H    GLN  43           H        GLN  43  24.130   3.592   4.987
    2    HA   GLN  43           HA       GLN  43  24.782   1.336   3.397
    3    HB2  GLN  43           HB2      GLN  43  23.773   1.516   6.246
    4    HB3  GLN  43           HB3      GLN  43  24.345   0.028   5.485
    5    HG2  GLN  43           HG2      GLN  43  26.509   1.235   4.966
    6    HG3  GLN  43           HG3      GLN  43  25.933   2.561   5.971
    7   HE21  GLN  43          HE21      GLN  43  28.170   1.581   6.995
    8   HE22  GLN  43          HE22      GLN  43  27.899   0.496   8.270

  No H/Q in entry =           8
  In of MODEL   33
    1    H    SER  44           H        SER  44  21.735   2.474   4.799
    2    HA   SER  44           HA       SER  44  20.158   0.235   4.129
    3    HB2  SER  44           HB2      SER  44  19.727   2.763   5.282
    4    HB3  SER  44           HB3      SER  44  18.686   2.725   3.862
    5    HG   SER  44           HG       SER  44  17.599   1.780   5.588

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ARG  45           H        ARG  45  20.899   3.202   2.327
    2    HA   ARG  45           HA       ARG  45  19.361   2.724   0.029
    3    HB2  ARG  45           HB2      ARG  45  20.513   4.857   0.612
    4    HB3  ARG  45           HB3      ARG  45  22.054   4.099   0.217
    5    HG2  ARG  45           HG2      ARG  45  21.258   3.700  -2.094
    6    HG3  ARG  45           HG3      ARG  45  19.729   4.481  -1.699
    7    HD2  ARG  45           HD2      ARG  45  20.987   6.573  -1.116
    8    HD3  ARG  45           HD3      ARG  45  22.479   5.797  -1.694
    9    HE   ARG  45           HE       ARG  45  20.538   5.568  -3.721
   10   HH21  ARG  45          HH11      ARG  45  20.526   6.941  -5.481
   11   HH22  ARG  45          HH12      ARG  45  21.287   8.489  -5.377
   12   HH11  ARG  45          HH21      ARG  45  22.283   8.059  -2.097
   13   HH12  ARG  45          HH22      ARG  45  22.281   9.122  -3.459

  No H/Q in entry =          13
  In of MODEL   33
    1    H    MET  46           H        MET  46  22.727   1.840   0.757
    2    HA   MET  46           HA       MET  46  23.317   0.650  -1.732
    3    HB2  MET  46           HB2      MET  46  24.437   0.319   1.051
    4    HB3  MET  46           HB3      MET  46  25.083  -0.578  -0.327
    5    HG2  MET  46           HG2      MET  46  25.521   1.529  -1.517
    6    HG3  MET  46           HG3      MET  46  24.837   2.443  -0.178
    7    HE1  MET  46           HE1      MET  46  27.138  -0.086  -1.368
    8    HE3  MET  46           HE2      MET  46  27.675  -0.747   0.173
    9    HE2  MET  46           HE3      MET  46  28.735   0.333  -0.730

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ALA  47           H        ALA  47  21.946  -0.685   1.248
    2    HA   ALA  47           HA       ALA  47  21.879  -3.396   0.441
    3    HB2  ALA  47           HB1      ALA  47  21.514  -2.938   2.748
    4    HB3  ALA  47           HB2      ALA  47  19.973  -3.535   2.136
    5    HB1  ALA  47           HB3      ALA  47  20.209  -1.806   2.397

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU  48           H        LEU  48  19.533  -0.761   0.102
    2    HA   LEU  48           HA       LEU  48  17.477  -2.285  -1.141
    3    HB2  LEU  48           HB2      LEU  48  18.140   0.667  -1.254
    4    HB3  LEU  48           HB3      LEU  48  16.663  -0.037  -1.914
    5    HG   LEU  48           HG       LEU  48  17.532  -0.347   0.970
    6   HD13  LEU  48          HD11      LEU  48  17.121   1.956   0.789
    7   HD12  LEU  48          HD12      LEU  48  15.563   1.313   1.306
    8   HD11  LEU  48          HD13      LEU  48  15.826   1.737  -0.386
    9   HD22  LEU  48          HD21      LEU  48  15.995  -2.055   0.595
   10   HD21  LEU  48          HD22      LEU  48  15.117  -1.147  -0.637
   11   HD23  LEU  48          HD23      LEU  48  14.916  -0.745   1.068

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ASN  49           H        ASN  49  20.164  -0.364  -2.383
    2    HA   ASN  49           HA       ASN  49  19.497  -0.441  -5.104
    3    HB2  ASN  49           HB2      ASN  49  21.183   1.072  -4.210
    4    HB3  ASN  49           HB3      ASN  49  22.204  -0.284  -3.748
    5   HD21  ASN  49          HD21      ASN  49  20.778   1.313  -6.612
    6   HD22  ASN  49          HD22      ASN  49  21.996   0.819  -7.686

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLU  50           H        GLU  50  21.485  -2.646  -3.156
    2    HA   GLU  50           HA       GLU  50  22.167  -4.401  -5.289
    3    HB2  GLU  50           HB2      GLU  50  23.378  -4.384  -3.130
    4    HB3  GLU  50           HB3      GLU  50  21.938  -5.007  -2.326
    5    HG2  GLU  50           HG2      GLU  50  22.011  -7.039  -3.689
    6    HG3  GLU  50           HG3      GLU  50  23.384  -6.410  -4.597

  No H/Q in entry =           6
  In of MODEL   33
    1    H    ALA  51           H        ALA  51  19.525  -4.329  -2.947
    2    HA   ALA  51           HA       ALA  51  18.345  -6.796  -3.701
    3    HB3  ALA  51           HB1      ALA  51  16.764  -6.287  -2.135
    4    HB1  ALA  51           HB2      ALA  51  16.554  -4.639  -2.730
    5    HB2  ALA  51           HB3      ALA  51  17.917  -5.032  -1.683

  No H/Q in entry =           5
  In of MODEL   33
    1    H    HIS  52           H        HIS  52  17.766  -3.445  -4.728
    2    HA   HIS  52           HA       HIS  52  15.640  -3.961  -6.515
    3    HB2  HIS  52           HB2      HIS  52  16.284  -1.699  -5.724
    4    HB3  HIS  52           HB3      HIS  52  17.751  -1.799  -6.696
    5    HD1  HIS  52           HD1      HIS  52  17.352  -2.095  -9.355
    6    HD2  HIS  52           HD2      HIS  52  14.035  -0.877  -7.143
    7    HE1  HIS  52           HE1      HIS  52  15.681  -1.168 -11.018
    8    HE2  HIS  52           HE2      HIS  52  13.654  -0.421  -9.684

  No H/Q in entry =           8
  In of MODEL   33
    1    H    LEU  53           H        LEU  53  19.155  -3.979  -6.969
    2    HA   LEU  53           HA       LEU  53  19.194  -4.291  -9.770
    3    HB2  LEU  53           HB2      LEU  53  21.137  -5.062  -7.609
    4    HB3  LEU  53           HB3      LEU  53  21.442  -5.449  -9.300
    5    HG   LEU  53           HG       LEU  53  20.798  -2.638  -8.350
    6   HD12  LEU  53          HD11      LEU  53  23.248  -2.228  -8.556
    7   HD11  LEU  53          HD12      LEU  53  23.490  -3.957  -8.801
    8   HD13  LEU  53          HD13      LEU  53  22.864  -3.365  -7.267
    9   HD22  LEU  53          HD21      LEU  53  20.493  -2.664 -10.684
   10   HD21  LEU  53          HD22      LEU  53  21.741  -3.882 -10.927
   11   HD23  LEU  53          HD23      LEU  53  22.192  -2.226 -10.567

  No H/Q in entry =          11
  In of MODEL   33
    1    H    VAL  54           H        VAL  54  19.089  -6.681  -7.147
    2    HA   VAL  54           HA       VAL  54  19.194  -8.974  -8.810
    3    HB   VAL  54           HB       VAL  54  18.058  -8.549  -6.035
    4   HG12  VAL  54          HG11      VAL  54  18.374 -11.168  -6.036
    5   HG11  VAL  54          HG12      VAL  54  18.179 -10.997  -7.780
    6   HG13  VAL  54          HG13      VAL  54  16.898 -10.463  -6.693
    7   HG22  VAL  54          HG21      VAL  54  20.376  -8.347  -5.826
    8   HG21  VAL  54          HG22      VAL  54  20.702  -9.438  -7.171
    9   HG23  VAL  54          HG23      VAL  54  20.179 -10.085  -5.616

  No H/Q in entry =           9
  In of MODEL   33
    1    H    GLN  55           H        GLN  55  16.480  -7.063  -7.508
    2    HA   GLN  55           HA       GLN  55  14.447  -8.720  -8.572
    3    HB2  GLN  55           HB2      GLN  55  13.714  -7.194  -6.939
    4    HB3  GLN  55           HB3      GLN  55  14.506  -5.827  -7.718
    5    HG2  GLN  55           HG2      GLN  55  12.774  -5.496  -9.197
    6    HG3  GLN  55           HG3      GLN  55  12.446  -7.215  -9.367
    7   HE21  GLN  55          HE21      GLN  55  10.442  -7.759  -8.550
    8   HE22  GLN  55          HE22      GLN  55   9.679  -7.004  -7.236

  No H/Q in entry =           8
  In of MODEL   33
    1    H    THR  56           H        THR  56  16.187  -5.924  -9.939
    2    HA   THR  56           HA       THR  56  14.735  -5.555 -12.278
    3    HB   THR  56           HB       THR  56  17.756  -5.476 -12.135
    4    HG1  THR  56           HG1      THR  56  16.013  -4.184 -10.647
    5   HG21  THR  56          HG21      THR  56  16.402  -5.179 -14.336
    6   HG23  THR  56          HG22      THR  56  17.632  -3.980 -13.939
    7   HG22  THR  56          HG23      THR  56  15.928  -3.625 -13.648

  No H/Q in entry =           7
  In of MODEL   33
    1    H    LYS  57           H        LYS  57  17.382  -7.860 -11.685
    2    HA   LYS  57           HA       LYS  57  17.364  -9.052 -14.265
    3    HB2  LYS  57           HB2      LYS  57  19.163  -9.310 -12.528
    4    HB3  LYS  57           HB3      LYS  57  18.062 -10.307 -11.589
    5    HG2  LYS  57           HG2      LYS  57  17.927 -11.914 -13.463
    6    HG3  LYS  57           HG3      LYS  57  19.056 -10.930 -14.386
    7    HD2  LYS  57           HD2      LYS  57  19.747 -12.028 -11.654
    8    HD3  LYS  57           HD3      LYS  57  20.062 -12.931 -13.135
    9    HE2  LYS  57           HE2      LYS  57  21.337 -10.904 -13.983
   10    HE3  LYS  57           HE3      LYS  57  21.199 -10.218 -12.366
   11    HZ3  LYS  57           HZ1      LYS  57  22.402 -12.022 -11.455
   12    HZ2  LYS  57           HZ2      LYS  57  23.283 -11.473 -12.799
   13    HZ1  LYS  57           HZ3      LYS  57  22.354 -12.890 -12.911

  No H/Q in entry =          13
  In of MODEL   33
    1    H    LEU  58           H        LEU  58  15.600  -9.718 -11.279
    2    HA   LEU  58           HA       LEU  58  14.367 -12.088 -12.208
    3    HB2  LEU  58           HB2      LEU  58  13.590 -10.182 -10.006
    4    HB3  LEU  58           HB3      LEU  58  12.778 -11.718 -10.318
    5    HG   LEU  58           HG       LEU  58  15.755 -11.447  -9.782
    6   HD11  LEU  58          HD11      LEU  58  13.395 -11.861  -7.975
    7   HD13  LEU  58          HD12      LEU  58  14.852 -10.901  -7.721
    8   HD12  LEU  58          HD13      LEU  58  14.921 -12.657  -7.587
    9   HD22  LEU  58          HD21      LEU  58  15.626 -13.508 -10.811
   10   HD21  LEU  58          HD22      LEU  58  13.914 -13.714 -10.439
   11   HD23  LEU  58          HD23      LEU  58  15.130 -14.018  -9.198

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  59           H        ILE  59  13.699  -8.748 -12.883
    2    HA   ILE  59           HA       ILE  59  10.976  -9.390 -13.807
    3    HB   ILE  59           HB       ILE  59  11.799  -7.109 -12.606
    4   HG12  ILE  59          HG12      ILE  59   9.863  -7.001 -14.932
    5   HG13  ILE  59          HG13      ILE  59   9.464  -7.745 -13.406
    6   HG23  ILE  59          HG21      ILE  59  12.339  -5.382 -14.130
    7   HG22  ILE  59          HG22      ILE  59  11.859  -6.326 -15.522
    8   HG21  ILE  59          HG23      ILE  59  13.342  -6.714 -14.656
    9   HD11  ILE  59          HD11      ILE  59  10.103  -5.580 -12.268
   10   HD13  ILE  59          HD12      ILE  59   8.669  -5.483 -13.288
   11   HD12  ILE  59          HD13      ILE  59  10.211  -4.863 -13.877

  No H/Q in entry =          11
  In of MODEL   33
    1    H    GLU  60           H        GLU  60  14.174  -8.544 -15.084
    2    HA   GLU  60           HA       GLU  60  13.378  -8.140 -17.787
    3    HB2  GLU  60           HB2      GLU  60  15.570  -7.428 -16.906
    4    HB3  GLU  60           HB3      GLU  60  16.030  -9.115 -16.688
    5    HG2  GLU  60           HG2      GLU  60  15.148  -8.092 -19.385
    6    HG3  GLU  60           HG3      GLU  60  16.818  -7.917 -18.852

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLY  61           H        GLY  61  14.360 -11.025 -15.981
    2    HA3  GLY  61           HA2      GLY  61  13.800 -12.669 -18.380
    3    HA2  GLY  61           HA3      GLY  61  14.840 -13.154 -17.045

  No H/Q in entry =           3
  In of MODEL   33
    1    H    ASP  62           H        ASP  62  11.726 -11.601 -16.650
    2    HA   ASP  62           HA       ASP  62  10.808 -13.695 -14.922
    3    HB2  ASP  62           HB2      ASP  62   8.781 -12.299 -14.744
    4    HB3  ASP  62           HB3      ASP  62  10.253 -11.374 -14.462

  No H/Q in entry =           4
  In of MODEL   33
    1    H    ALA  63           H        ALA  63  11.140 -15.249 -16.988
    2    HA   ALA  63           HA       ALA  63   9.099 -15.326 -18.977
    3    HB1  ALA  63           HB1      ALA  63  11.162 -16.552 -19.301
    4    HB3  ALA  63           HB2      ALA  63   9.833 -17.709 -19.257
    5    HB2  ALA  63           HB3      ALA  63  10.873 -17.508 -17.847

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLY  64           H        GLY  64   9.419 -16.744 -15.771
    2    HA3  GLY  64           HA2      GLY  64   7.846 -17.573 -14.312
    3    HA2  GLY  64           HA3      GLY  64   6.599 -16.972 -15.397

  No H/Q in entry =           3
  In of MODEL   33
    1    H    GLU  65           H        GLU  65   5.570 -19.066 -14.665
    2    HA   GLU  65           HA       GLU  65   6.639 -21.555 -15.443
    3    HB2  GLU  65           HB2      GLU  65   3.800 -20.702 -14.897
    4    HB3  GLU  65           HB3      GLU  65   4.279 -22.373 -15.192
    5    HG2  GLU  65           HG2      GLU  65   5.806 -22.312 -13.290
    6    HG3  GLU  65           HG3      GLU  65   5.443 -20.609 -13.019

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLY  66           H        GLY  66   4.437 -19.375 -17.051
    2    HA3  GLY  66           HA2      GLY  66   4.591 -20.965 -19.528
    3    HA2  GLY  66           HA3      GLY  66   3.220 -19.969 -19.084

  No H/Q in entry =           3
  In of MODEL   33
    1    H    LYS  67           H        LYS  67   3.982 -19.522 -21.486
    2    HA   LYS  67           HA       LYS  67   6.164 -17.892 -22.034
    3    HB2  LYS  67           HB2      LYS  67   3.503 -18.168 -23.422
    4    HB3  LYS  67           HB3      LYS  67   4.872 -17.271 -24.093
    5    HG2  LYS  67           HG2      LYS  67   6.285 -19.276 -23.942
    6    HG3  LYS  67           HG3      LYS  67   4.951 -20.180 -23.231
    7    HD2  LYS  67           HD2      LYS  67   3.626 -19.810 -25.301
    8    HD3  LYS  67           HD3      LYS  67   5.014 -18.984 -26.015
    9    HE2  LYS  67           HE2      LYS  67   5.081 -21.828 -24.970
   10    HE3  LYS  67           HE3      LYS  67   4.861 -21.402 -26.667
   11    HZ3  LYS  67           HZ1      LYS  67   7.138 -21.778 -26.422
   12    HZ2  LYS  67           HZ2      LYS  67   7.221 -20.935 -24.951
   13    HZ1  LYS  67           HZ3      LYS  67   6.992 -20.088 -26.406

  No H/Q in entry =          13
  In of MODEL   33
    1    H    MET  68           H        MET  68   2.857 -16.701 -22.130
    2    HA   MET  68           HA       MET  68   3.500 -13.969 -21.954
    3    HB2  MET  68           HB2      MET  68   0.960 -15.537 -21.608
    4    HB3  MET  68           HB3      MET  68   0.998 -13.784 -21.415
    5    HG2  MET  68           HG2      MET  68   2.039 -15.220 -23.869
    6    HG3  MET  68           HG3      MET  68   0.415 -14.543 -23.746
    7    HE3  MET  68           HE1      MET  68   2.028 -13.505 -26.137
    8    HE2  MET  68           HE2      MET  68   1.606 -11.804 -25.956
    9    HE1  MET  68           HE3      MET  68   0.421 -13.046 -25.556

  No H/Q in entry =           9
  In of MODEL   33
    1    H    LYS  69           H        LYS  69   2.483 -16.248 -19.394
    2    HA   LYS  69           HA       LYS  69   2.160 -14.224 -17.416
    3    HB2  LYS  69           HB2      LYS  69   2.373 -17.226 -17.222
    4    HB3  LYS  69           HB3      LYS  69   2.061 -16.182 -15.833
    5    HG2  LYS  69           HG2      LYS  69   0.080 -15.251 -16.958
    6    HG3  LYS  69           HG3      LYS  69   0.392 -16.272 -18.362
    7    HD2  LYS  69           HD2      LYS  69   0.144 -18.284 -16.927
    8    HD3  LYS  69           HD3      LYS  69  -0.244 -17.237 -15.559
    9    HE2  LYS  69           HE2      LYS  69  -1.790 -17.262 -18.167
   10    HE3  LYS  69           HE3      LYS  69  -2.274 -18.151 -16.725
   11    HZ1  LYS  69           HZ1      LYS  69  -2.261 -16.017 -15.515
   12    HZ3  LYS  69           HZ2      LYS  69  -3.412 -16.070 -16.763
   13    HZ2  LYS  69           HZ3      LYS  69  -1.963 -15.211 -16.976

  No H/Q in entry =          13
  In of MODEL   33
    1    H    VAL  70           H        VAL  70   3.288 -14.182 -15.275
    2    HA   VAL  70           HA       VAL  70   6.210 -14.623 -15.544
    3    HB   VAL  70           HB       VAL  70   6.524 -12.537 -14.243
    4   HG13  VAL  70          HG11      VAL  70   6.775 -12.121 -16.523
    5   HG12  VAL  70          HG12      VAL  70   5.476 -10.999 -16.116
    6   HG11  VAL  70          HG13      VAL  70   5.102 -12.540 -16.886
    7   HG22  VAL  70          HG21      VAL  70   4.570 -12.204 -12.977
    8   HG21  VAL  70          HG22      VAL  70   3.516 -12.572 -14.342
    9   HG23  VAL  70          HG23      VAL  70   4.354 -11.022 -14.269

  No H/Q in entry =           9
  In of MODEL   33
    1    H    SER  71           H        SER  71   7.301 -14.627 -13.378
    2    HA   SER  71           HA       SER  71   6.230 -16.596 -11.660
    3    HB2  SER  71           HB2      SER  71   8.661 -16.039 -11.872
    4    HB3  SER  71           HB3      SER  71   8.354 -14.539 -10.999
    5    HG   SER  71           HG       SER  71   8.223 -17.207 -10.122

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU  72           H        LEU  72   4.873 -16.467  -9.993
    2    HA   LEU  72           HA       LEU  72   3.331 -14.151  -9.537
    3    HB2  LEU  72           HB2      LEU  72   3.621 -16.714  -7.977
    4    HB3  LEU  72           HB3      LEU  72   2.463 -15.453  -7.559
    5    HG   LEU  72           HG       LEU  72   2.588 -16.736 -10.308
    6   HD12  LEU  72          HD11      LEU  72   0.695 -17.379  -8.027
    7   HD11  LEU  72          HD12      LEU  72   2.061 -18.389  -8.495
    8   HD13  LEU  72          HD13      LEU  72   0.728 -18.136  -9.621
    9   HD21  LEU  72          HD21      LEU  72   0.738 -14.823  -8.899
   10   HD23  LEU  72          HD22      LEU  72   0.081 -15.887 -10.132
   11   HD22  LEU  72          HD23      LEU  72   1.358 -14.746 -10.544

  No H/Q in entry =          11
  In of MODEL   33
    1    H    VAL  73           H        VAL  73   5.994 -15.596  -7.780
    2    HA   VAL  73           HA       VAL  73   5.950 -14.067  -5.446
    3    HB   VAL  73           HB       VAL  73   8.145 -14.871  -5.041
    4   HG12  VAL  73          HG11      VAL  73   6.824 -16.936  -6.818
    5   HG11  VAL  73          HG12      VAL  73   6.268 -16.559  -5.188
    6   HG13  VAL  73          HG13      VAL  73   7.880 -17.230  -5.437
    7   HG23  VAL  73          HG21      VAL  73   9.273 -16.080  -7.105
    8   HG22  VAL  73          HG22      VAL  73   9.456 -14.340  -6.888
    9   HG21  VAL  73          HG23      VAL  73   8.273 -14.966  -8.037

  No H/Q in entry =           9
  In of MODEL   33
    1    H    LEU  74           H        LEU  74   6.924 -13.170  -8.626
    2    HA   LEU  74           HA       LEU  74   8.877 -11.227  -8.140
    3    HB2  LEU  74           HB2      LEU  74   8.413 -11.967 -10.377
    4    HB3  LEU  74           HB3      LEU  74   6.745 -11.407 -10.267
    5    HG   LEU  74           HG       LEU  74   7.534  -9.078 -10.061
    6   HD13  LEU  74          HD11      LEU  74   9.648  -9.268  -8.991
    7   HD12  LEU  74          HD12      LEU  74  10.029  -8.751 -10.632
    8   HD11  LEU  74          HD13      LEU  74  10.230 -10.441 -10.172
    9   HD21  LEU  74          HD21      LEU  74   7.318 -10.522 -12.281
   10   HD23  LEU  74          HD22      LEU  74   9.025 -10.153 -12.368
   11   HD22  LEU  74          HD23      LEU  74   7.862  -8.847 -12.317

  No H/Q in entry =          11
  In of MODEL   33
    1    H    VAL  75           H        VAL  75   5.380 -10.833  -8.475
    2    HA   VAL  75           HA       VAL  75   5.294  -8.078  -7.884
    3    HB   VAL  75           HB       VAL  75   3.203 -10.220  -7.497
    4   HG12  VAL  75          HG11      VAL  75   1.624  -8.260  -7.371
    5   HG11  VAL  75          HG12      VAL  75   3.018  -7.192  -7.314
    6   HG13  VAL  75          HG13      VAL  75   2.732  -8.326  -6.004
    7   HG21  VAL  75          HG21      VAL  75   3.672  -8.091  -9.614
    8   HG23  VAL  75          HG22      VAL  75   2.287  -9.180  -9.566
    9   HG22  VAL  75          HG23      VAL  75   3.908  -9.825  -9.828

  No H/Q in entry =           9
  In of MODEL   33
    1    H    GLU  76           H        GLU  76   5.043 -10.957  -5.777
    2    HA   GLU  76           HA       GLU  76   4.588  -9.599  -3.352
    3    HB2  GLU  76           HB2      GLU  76   4.404 -12.063  -3.583
    4    HB3  GLU  76           HB3      GLU  76   6.137 -12.169  -3.840
    5    HG2  GLU  76           HG2      GLU  76   5.720 -12.751  -1.539
    6    HG3  GLU  76           HG3      GLU  76   6.468 -11.164  -1.533

  No H/Q in entry =           6
  In of MODEL   33
    1    H    ALA  77           H        ALA  77   7.638 -10.511  -4.930
    2    HA   ALA  77           HA       ALA  77   9.340  -9.475  -2.921
    3    HB1  ALA  77           HB1      ALA  77  10.037 -11.028  -4.763
    4    HB2  ALA  77           HB2      ALA  77  11.104  -9.639  -4.556
    5    HB3  ALA  77           HB3      ALA  77   9.940  -9.667  -5.880

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLN  78           H        GLN  78   7.938  -8.050  -5.826
    2    HA   GLN  78           HA       GLN  78   9.298  -5.574  -5.724
    3    HB2  GLN  78           HB2      GLN  78   7.989  -6.485  -7.677
    4    HB3  GLN  78           HB3      GLN  78   6.512  -6.098  -6.795
    5    HG2  GLN  78           HG2      GLN  78   7.179  -3.731  -6.703
    6    HG3  GLN  78           HG3      GLN  78   8.659  -4.110  -7.583
    7   HE21  GLN  78          HE21      GLN  78   6.742  -2.276  -8.664
    8   HE22  GLN  78          HE22      GLN  78   6.040  -2.986 -10.037

  No H/Q in entry =           8
  In of MODEL   33
    1    H    LEU  79           H        LEU  79   6.282  -6.705  -4.283
    2    HA   LEU  79           HA       LEU  79   5.299  -4.297  -3.266
    3    HB2  LEU  79           HB2      LEU  79   3.979  -6.344  -3.208
    4    HB3  LEU  79           HB3      LEU  79   5.126  -7.089  -2.098
    5    HG   LEU  79           HG       LEU  79   4.586  -5.448  -0.367
    6   HD13  LEU  79          HD11      LEU  79   4.122  -3.430  -1.412
    7   HD12  LEU  79          HD12      LEU  79   2.497  -3.951  -0.967
    8   HD11  LEU  79          HD13      LEU  79   3.070  -4.173  -2.618
    9   HD23  LEU  79          HD21      LEU  79   1.998  -5.932  -0.267
   10   HD22  LEU  79          HD22      LEU  79   3.134  -7.275  -0.165
   11   HD21  LEU  79          HD23      LEU  79   2.315  -6.933  -1.686

  No H/Q in entry =          11
  In of MODEL   33
    1    H    HIS  80           H        HIS  80   7.481  -6.641  -1.695
    2    HA   HIS  80           HA       HIS  80   7.783  -5.103   0.675
    3    HB2  HIS  80           HB2      HIS  80   9.109  -7.470  -0.533
    4    HB3  HIS  80           HB3      HIS  80  10.027  -6.578   0.682
    5    HD1  HIS  80           HD1      HIS  80   9.543  -7.216   3.026
    6    HD2  HIS  80           HD2      HIS  80   6.314  -8.052   0.525
    7    HE1  HIS  80           HE1      HIS  80   7.773  -8.315   4.479
    8    HE2  HIS  80           HE2      HIS  80   5.799  -8.829   2.963

  No H/Q in entry =           8
  In of MODEL   33
    1    H    LEU  81           H        LEU  81   9.777  -5.382  -2.245
    2    HA   LEU  81           HA       LEU  81  11.830  -3.650  -1.372
    3    HB2  LEU  81           HB2      LEU  81  10.896  -4.435  -4.133
    4    HB3  LEU  81           HB3      LEU  81  12.321  -3.434  -3.846
    5    HG   LEU  81           HG       LEU  81  11.923  -6.156  -2.575
    6   HD12  LEU  81          HD11      LEU  81  13.730  -6.786  -4.332
    7   HD11  LEU  81          HD12      LEU  81  13.166  -5.359  -5.200
    8   HD13  LEU  81          HD13      LEU  81  12.051  -6.679  -4.860
    9   HD23  LEU  81          HD21      LEU  81  14.552  -5.850  -2.570
   10   HD22  LEU  81          HD22      LEU  81  13.578  -5.088  -1.315
   11   HD21  LEU  81          HD23      LEU  81  14.155  -4.136  -2.683

  No H/Q in entry =          11
  In of MODEL   33
    1    H    MET  82           H        MET  82   8.903  -2.999  -3.297
    2    HA   MET  82           HA       MET  82   9.452  -0.275  -3.796
    3    HB2  MET  82           HB2      MET  82   6.886  -1.858  -3.664
    4    HB3  MET  82           HB3      MET  82   6.892  -0.133  -4.026
    5    HG2  MET  82           HG2      MET  82   8.478  -2.211  -5.570
    6    HG3  MET  82           HG3      MET  82   6.912  -1.581  -6.076
    7    HE3  MET  82           HE1      MET  82   7.370   1.873  -7.244
    8    HE2  MET  82           HE2      MET  82   7.001   1.646  -5.537
    9    HE1  MET  82           HE3      MET  82   6.327   0.541  -6.730

  No H/Q in entry =           9
  In of MODEL   33
    1    H    THR  83           H        THR  83   7.662  -1.869  -1.187
    2    HA   THR  83           HA       THR  83   6.826   0.481   0.146
    3    HB   THR  83           HB       THR  83   6.692  -1.096   2.162
    4    HG1  THR  83           HG1      THR  83   7.440  -3.049   1.927
    5   HG22  THR  83          HG21      THR  83   5.027  -2.653   0.698
    6   HG21  THR  83          HG22      THR  83   5.255  -1.324  -0.433
    7   HG23  THR  83          HG23      THR  83   4.622  -1.008   1.183

  No H/Q in entry =           7
  In of MODEL   33
    1    H    SER  84           H        SER  84   9.642  -1.630   0.654
    2    HA   SER  84           HA       SER  84  10.716  -0.208   2.840
    3    HB2  SER  84           HB2      SER  84  11.954  -2.053   0.808
    4    HB3  SER  84           HB3      SER  84  12.908  -1.306   2.088
    5    HG   SER  84           HG       SER  84  10.627  -2.986   2.353

  No H/Q in entry =           5
  In of MODEL   33
    1    H    MET  85           H        MET  85  11.458   0.055  -0.650
    2    HA   MET  85           HA       MET  85  13.466   2.010  -0.403
    3    HB2  MET  85           HB2      MET  85  12.959   0.683  -2.465
    4    HB3  MET  85           HB3      MET  85  11.539   1.701  -2.710
    5    HG2  MET  85           HG2      MET  85  13.229   3.684  -2.490
    6    HG3  MET  85           HG3      MET  85  14.447   2.462  -2.838
    7    HE2  MET  85           HE1      MET  85  11.884   0.707  -4.644
    8    HE1  MET  85           HE2      MET  85  13.632   0.512  -4.555
    9    HE3  MET  85           HE3      MET  85  12.876   0.869  -6.102

  No H/Q in entry =           9
  In of MODEL   33
    1    H    LEU  86           H        LEU  86   9.976   2.362  -0.899
    2    HA   LEU  86           HA       LEU  86   9.926   5.176  -1.076
    3    HB2  LEU  86           HB2      LEU  86   8.071   3.526  -1.648
    4    HB3  LEU  86           HB3      LEU  86   7.747   3.435   0.083
    5    HG   LEU  86           HG       LEU  86   7.599   5.997   0.035
    6   HD11  LEU  86          HD11      LEU  86   8.363   5.561  -2.671
    7   HD13  LEU  86          HD12      LEU  86   7.937   7.090  -1.906
    8   HD12  LEU  86          HD13      LEU  86   6.693   6.134  -2.708
    9   HD23  LEU  86          HD21      LEU  86   5.453   4.658  -1.622
   10   HD22  LEU  86          HD22      LEU  86   5.273   5.917  -0.404
   11   HD21  LEU  86          HD23      LEU  86   5.666   4.270   0.085

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ALA  87           H        ALA  87   9.458   2.996   1.668
    2    HA   ALA  87           HA       ALA  87   8.926   4.909   3.642
    3    HB1  ALA  87           HB1      ALA  87   9.719   2.085   3.549
    4    HB3  ALA  87           HB2      ALA  87   8.602   2.902   4.640
    5    HB2  ALA  87           HB3      ALA  87  10.332   2.924   4.978

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ARG  88           H        ARG  88  11.999   3.471   2.648
    2    HA   ARG  88           HA       ARG  88  13.622   4.837   4.477
    3    HB2  ARG  88           HB2      ARG  88  14.275   2.863   3.068
    4    HB3  ARG  88           HB3      ARG  88  14.428   3.957   1.696
    5    HG2  ARG  88           HG2      ARG  88  15.916   5.260   3.639
    6    HG3  ARG  88           HG3      ARG  88  16.229   3.568   4.015
    7    HD2  ARG  88           HD2      ARG  88  17.487   3.268   2.163
    8    HD3  ARG  88           HD3      ARG  88  16.351   4.147   1.135
    9    HE   ARG  88           HE       ARG  88  18.755   5.197   2.175
   10   HH21  ARG  88          HH11      ARG  88  19.111   7.414   1.983
   11   HH22  ARG  88          HH12      ARG  88  17.765   8.493   1.846
   12   HH11  ARG  88          HH21      ARG  88  15.419   5.968   1.911
   13   HH12  ARG  88          HH22      ARG  88  15.673   7.671   1.781

  No H/Q in entry =          13
  In of MODEL   33
    1    H    GLU  89           H        GLU  89  12.641   5.746   1.159
    2    HA   GLU  89           HA       GLU  89  14.200   8.098   1.000
    3    HB2  GLU  89           HB2      GLU  89  13.043   7.066  -0.945
    4    HB3  GLU  89           HB3      GLU  89  11.504   7.614  -0.281
    5    HG2  GLU  89           HG2      GLU  89  12.217   9.948  -0.442
    6    HG3  GLU  89           HG3      GLU  89  13.816   9.450  -0.986

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LEU  90           H        LEU  90  10.872   7.604   2.142
    2    HA   LEU  90           HA       LEU  90  10.373  10.339   2.723
    3    HB2  LEU  90           HB2      LEU  90   9.169   7.770   3.751
    4    HB3  LEU  90           HB3      LEU  90   8.549   9.368   4.179
    5    HG   LEU  90           HG       LEU  90   8.951   8.490   1.307
    6   HD12  LEU  90          HD11      LEU  90   6.416   8.175   1.378
    7   HD11  LEU  90          HD12      LEU  90   6.577   8.161   3.134
    8   HD13  LEU  90          HD13      LEU  90   7.386   6.928   2.165
    9   HD22  LEU  90          HD21      LEU  90   8.669  10.800   1.238
   10   HD21  LEU  90          HD22      LEU  90   7.688  10.835   2.702
   11   HD23  LEU  90          HD23      LEU  90   6.982  10.286   1.182

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  91           H        ILE  91  11.630   7.648   4.636
    2    HA   ILE  91           HA       ILE  91  11.787   9.008   7.106
    3    HB   ILE  91           HB       ILE  91  13.324   6.664   5.973
    4   HG12  ILE  91          HG12      ILE  91  11.318   6.838   8.240
    5   HG13  ILE  91          HG13      ILE  91  10.839   6.562   6.566
    6   HG22  ILE  91          HG21      ILE  91  13.804   6.443   8.611
    7   HG21  ILE  91          HG22      ILE  91  13.736   8.203   8.513
    8   HG23  ILE  91          HG23      ILE  91  14.906   7.310   7.543
    9   HD13  ILE  91          HD11      ILE  91  11.831   4.455   6.489
   10   HD12  ILE  91          HD12      ILE  91  11.244   4.514   8.151
   11   HD11  ILE  91          HD13      ILE  91  12.946   4.819   7.806

  No H/Q in entry =          11
  In of MODEL   33
    1    H    THR  92           H        THR  92  13.992   8.832   4.345
    2    HA   THR  92           HA       THR  92  16.169  10.212   5.498
    3    HB   THR  92           HB       THR  92  15.171  10.097   2.641
    4    HG1  THR  92           HG1      THR  92  15.995   8.195   3.040
    5   HG22  THR  92          HG21      THR  92  17.743  10.774   2.339
    6   HG21  THR  92          HG22      THR  92  17.446  11.595   3.871
    7   HG23  THR  92          HG23      THR  92  16.472  11.989   2.454

  No H/Q in entry =           7
  In of MODEL   33
    1    H    GLU  93           H        GLU  93  13.281  11.383   3.783
    2    HA   GLU  93           HA       GLU  93  13.891  14.141   3.899
    3    HB2  GLU  93           HB2      GLU  93  11.179  12.782   3.922
    4    HB3  GLU  93           HB3      GLU  93  11.474  14.480   3.551
    5    HG2  GLU  93           HG2      GLU  93  12.795  12.234   2.015
    6    HG3  GLU  93           HG3      GLU  93  11.250  12.925   1.535

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LEU  94           H        LEU  94  12.146  11.990   6.114
    2    HA   LEU  94           HA       LEU  94  11.354  13.937   7.996
    3    HB2  LEU  94           HB2      LEU  94  11.916  10.979   8.263
    4    HB3  LEU  94           HB3      LEU  94  11.354  11.955   9.617
    5    HG   LEU  94           HG       LEU  94   9.860  12.019   6.995
    6   HD11  LEU  94          HD11      LEU  94   9.940   9.794   8.995
    7   HD13  LEU  94          HD12      LEU  94   9.631   9.737   7.261
    8   HD12  LEU  94          HD13      LEU  94   8.359  10.259   8.365
    9   HD23  LEU  94          HD21      LEU  94   7.949  12.426   8.603
   10   HD22  LEU  94          HD22      LEU  94   9.195  13.673   8.637
   11   HD21  LEU  94          HD23      LEU  94   9.131  12.455   9.910

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  95           H        ILE  95  14.317  11.993   7.744
    2    HA   ILE  95           HA       ILE  95  15.499  12.905  10.154
    3    HB   ILE  95           HB       ILE  95  16.722  11.834   7.600
    4   HG12  ILE  95          HG12      ILE  95  16.432  10.630  10.366
    5   HG13  ILE  95          HG13      ILE  95  15.258  10.380   9.076
    6   HG21  ILE  95          HG21      ILE  95  17.992  12.630  10.238
    7   HG23  ILE  95          HG22      ILE  95  18.451  13.159   8.617
    8   HG22  ILE  95          HG23      ILE  95  18.751  11.496   9.122
    9   HD13  ILE  95          HD11      ILE  95  16.726   9.096   7.805
   10   HD12  ILE  95          HD12      ILE  95  17.204   8.642   9.438
   11   HD11  ILE  95          HD13      ILE  95  18.159   9.818   8.537

  No H/Q in entry =          11
  In of MODEL   33
    1    H    GLU  96           H        GLU  96  15.646  14.143   6.821
    2    HA   GLU  96           HA       GLU  96  17.505  16.212   7.294
    3    HB2  GLU  96           HB2      GLU  96  16.828  15.556   5.036
    4    HB3  GLU  96           HB3      GLU  96  15.189  16.121   5.344
    5    HG2  GLU  96           HG2      GLU  96  15.764  18.249   4.803
    6    HG3  GLU  96           HG3      GLU  96  17.067  18.241   5.980

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LEU  97           H        LEU  97  13.995  16.042   7.738
    2    HA   LEU  97           HA       LEU  97  13.595  18.777   8.386
    3    HB2  LEU  97           HB2      LEU  97  12.067  16.258   9.002
    4    HB3  LEU  97           HB3      LEU  97  11.565  17.807   9.678
    5    HG   LEU  97           HG       LEU  97  12.033  17.393   6.711
    6   HD12  LEU  97          HD11      LEU  97   9.508  17.278   6.603
    7   HD11  LEU  97          HD12      LEU  97   9.508  17.076   8.353
    8   HD13  LEU  97          HD13      LEU  97  10.278  15.866   7.326
    9   HD23  LEU  97          HD21      LEU  97  10.305  19.366   6.754
   10   HD22  LEU  97          HD22      LEU  97  11.990  19.716   7.140
   11   HD21  LEU  97          HD23      LEU  97  10.806  19.550   8.435

  No H/Q in entry =          11
  In of MODEL   33
    1    H    HIS  98           H        HIS  98  14.411  15.943  10.373
    2    HA   HIS  98           HA       HIS  98  14.271  17.201  12.892
    3    HB2  HIS  98           HB2      HIS  98  16.004  14.936  11.879
    4    HB3  HIS  98           HB3      HIS  98  16.013  15.472  13.561
    5    HD1  HIS  98           HD1      HIS  98  13.794  13.858  10.976
    6    HD2  HIS  98           HD2      HIS  98  13.709  14.772  15.042
    7    HE1  HIS  98           HE1      HIS  98  11.767  12.672  11.935
    8    HE2  HIS  98           HE2      HIS  98  11.695  13.220  14.408

  No H/Q in entry =           8
  In of MODEL   33
    1    H    GLU  99           H        GLU  99  16.813  17.076  10.446
    2    HA   GLU  99           HA       GLU  99  18.812  18.395  11.969
    3    HB2  GLU  99           HB2      GLU  99  19.275  17.108   9.895
    4    HB3  GLU  99           HB3      GLU  99  18.468  18.369   8.960
    5    HG2  GLU  99           HG2      GLU  99  20.089  20.029   9.746
    6    HG3  GLU  99           HG3      GLU  99  20.866  18.821  10.764

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LYS 100           H        LYS 100  16.285  19.574   9.765
    2    HA   LYS 100           HA       LYS 100  17.098  22.307   9.910
    3    HB2  LYS 100           HB2      LYS 100  14.455  21.034   9.165
    4    HB3  LYS 100           HB3      LYS 100  14.763  22.771   9.076
    5    HG2  LYS 100           HG2      LYS 100  16.727  22.314   7.600
    6    HG3  LYS 100           HG3      LYS 100  16.304  20.599   7.617
    7    HD2  LYS 100           HD2      LYS 100  14.107  21.122   6.627
    8    HD3  LYS 100           HD3      LYS 100  14.513  22.839   6.618
    9    HE2  LYS 100           HE2      LYS 100  16.463  22.350   5.148
   10    HE3  LYS 100           HE3      LYS 100  15.988  20.648   5.114
   11    HZ1  LYS 100           HZ1      LYS 100  14.172  22.853   4.291
   12    HZ3  LYS 100           HZ2      LYS 100  13.977  21.185   4.027
   13    HZ2  LYS 100           HZ3      LYS 100  15.189  22.041   3.202

  No H/Q in entry =          13
  In of MODEL   33
    1    H    LEU 101           H        LEU 101  14.998  20.269  11.881
    2    HA   LEU 101           HA       LEU 101  13.850  22.341  13.468
    3    HB2  LEU 101           HB2      LEU 101  14.277  19.389  13.845
    4    HB3  LEU 101           HB3      LEU 101  13.753  20.370  15.210
    5    HG   LEU 101           HG       LEU 101  12.324  20.471  12.547
    6   HD12  LEU 101          HD11      LEU 101  10.661  18.914  13.821
    7   HD11  LEU 101          HD12      LEU 101  12.057  18.492  14.809
    8   HD13  LEU 101          HD13      LEU 101  12.081  18.188  13.071
    9   HD21  LEU 101          HD21      LEU 101  11.684  21.263  15.404
   10   HD23  LEU 101          HD22      LEU 101  10.416  21.046  14.199
   11   HD22  LEU 101          HD23      LEU 101  11.657  22.275  13.958

  No H/Q in entry =          11
  In of MODEL   33
    1    H    LYS 102           H        LYS 102  16.992  21.716  13.017
    2    HA   LYS 102           HA       LYS 102  18.849  22.574  14.082
    3    HB2  LYS 102           HB2      LYS 102  17.049  24.098  15.226
    4    HB3  LYS 102           HB3      LYS 102  17.256  23.031  16.601
    5    HG2  LYS 102           HG2      LYS 102  19.155  25.033  15.426
    6    HG3  LYS 102           HG3      LYS 102  18.779  24.718  17.107
    7    HD2  LYS 102           HD2      LYS 102  20.427  22.799  15.410
    8    HD3  LYS 102           HD3      LYS 102  21.128  24.115  16.342
    9    HE2  LYS 102           HE2      LYS 102  20.719  21.567  17.308
   10    HE3  LYS 102           HE3      LYS 102  20.951  23.006  18.301
   11    HZ2  LYS 102           HZ1      LYS 102  18.977  21.733  18.925
   12    HZ1  LYS 102           HZ2      LYS 102  18.328  21.969  17.380
   13    HZ3  LYS 102           HZ3      LYS 102  18.571  23.296  18.407

  No H/Q in entry =          13
  In of MODEL   33
    1    H    ALA 103           H        ALA 103  16.778  20.977  16.511
    2    HA   ALA 103           HA       ALA 103  18.505  19.752  18.156
    3    HB2  ALA 103           HB1      ALA 103  16.909  17.754  18.153
    4    HB1  ALA 103           HB2      ALA 103  16.013  18.616  16.901
    5    HB3  ALA 103           HB3      ALA 103  16.203  19.332  18.501

  No H/Q in entry =           5
  In of MODEL   33
    1    H1   ALA   1           H3       ALA   1  -1.764  -6.907 -21.423
    2    H2   ALA   1           H2       ALA   1  -2.566  -8.338 -20.969
    3    H3   ALA   1           H1       ALA   1  -0.961  -8.397 -21.531
    4    HA   ALA   1           HA       ALA   1  -1.807  -8.857 -23.525
    5    HB1  ALA   1           HB1      ALA   1  -3.946  -9.562 -23.043
    6    HB2  ALA   1           HB2      ALA   1  -4.379  -8.047 -23.836
    7    HB3  ALA   1           HB3      ALA   1  -4.311  -8.131 -22.078

  No H/Q in entry =           7
  In of MODEL   33
    1    H    GLU   2           H        GLU   2  -2.637  -7.657 -25.508
    2    HA   GLU   2           HA       GLU   2  -1.229  -5.651 -26.388
    3    HB2  GLU   2           HB2      GLU   2  -4.238  -5.698 -26.693
    4    HB3  GLU   2           HB3      GLU   2  -3.116  -4.840 -27.746
    5    HG2  GLU   2           HG2      GLU   2  -2.631  -6.731 -28.906
    6    HG3  GLU   2           HG3      GLU   2  -2.333  -7.641 -27.432

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLU   3           H        GLU   3  -4.378  -4.375 -25.472
    2    HA   GLU   3           HA       GLU   3  -3.312  -1.827 -24.843
    3    HB2  GLU   3           HB2      GLU   3  -6.007  -3.125 -24.502
    4    HB3  GLU   3           HB3      GLU   3  -5.695  -1.513 -23.854
    5    HG2  GLU   3           HG2      GLU   3  -5.342  -0.584 -25.980
    6    HG3  GLU   3           HG3      GLU   3  -4.960  -2.141 -26.709

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LEU   4           H        LEU   4  -4.908  -4.180 -22.661
    2    HA   LEU   4           HA       LEU   4  -4.525  -2.959 -20.269
    3    HB2  LEU   4           HB2      LEU   4  -4.004  -5.903 -20.747
    4    HB3  LEU   4           HB3      LEU   4  -4.398  -5.157 -19.200
    5    HG   LEU   4           HG       LEU   4  -6.182  -5.214 -21.657
    6   HD13  LEU   4          HD11      LEU   4  -7.382  -6.926 -20.657
    7   HD12  LEU   4          HD12      LEU   4  -6.887  -6.473 -19.027
    8   HD11  LEU   4          HD13      LEU   4  -5.761  -7.321 -20.085
    9   HD23  LEU   4          HD21      LEU   4  -7.853  -4.396 -19.780
   10   HD22  LEU   4          HD22      LEU   4  -6.810  -3.230 -20.593
   11   HD21  LEU   4          HD23      LEU   4  -6.381  -3.826 -18.990

  No H/Q in entry =          11
  In of MODEL   33
    1    H    GLU   5           H        GLU   5  -2.047  -4.815 -22.015
    2    HA   GLU   5           HA       GLU   5  -0.053  -4.549 -19.986
    3    HB2  GLU   5           HB2      GLU   5  -0.005  -6.316 -21.739
    4    HB3  GLU   5           HB3      GLU   5   0.307  -5.072 -22.950
    5    HG2  GLU   5           HG2      GLU   5   2.384  -4.447 -21.811
    6    HG3  GLU   5           HG3      GLU   5   2.069  -5.633 -20.546

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLU   6           H        GLU   6  -0.690  -2.825 -23.024
    2    HA   GLU   6           HA       GLU   6   1.494  -1.008 -22.762
    3    HB2  GLU   6           HB2      GLU   6   0.370  -1.468 -24.922
    4    HB3  GLU   6           HB3      GLU   6  -1.091  -0.691 -24.310
    5    HG2  GLU   6           HG2      GLU   6   0.128   1.417 -24.014
    6    HG3  GLU   6           HG3      GLU   6   1.615   0.650 -24.569

  No H/Q in entry =           6
  In of MODEL   33
    1    H    VAL   7           H        VAL   7  -1.841  -1.059 -21.703
    2    HA   VAL   7           HA       VAL   7  -2.041   1.653 -20.860
    3    HB   VAL   7           HB       VAL   7  -3.516  -0.857 -20.023
    4   HG11  VAL   7          HG11      VAL   7  -3.868   2.033 -19.201
    5   HG13  VAL   7          HG12      VAL   7  -3.774   0.605 -18.169
    6   HG12  VAL   7          HG13      VAL   7  -5.209   0.886 -19.155
    7   HG21  VAL   7          HG21      VAL   7  -3.676   0.226 -22.408
    8   HG23  VAL   7          HG22      VAL   7  -4.610   1.479 -21.590
    9   HG22  VAL   7          HG23      VAL   7  -5.166  -0.195 -21.564

  No H/Q in entry =           9
  In of MODEL   33
    1    H    VAL   8           H        VAL   8  -1.066  -1.342 -19.227
    2    HA   VAL   8           HA       VAL   8  -0.730  -0.270 -16.631
    3    HB   VAL   8           HB       VAL   8   0.656  -2.592 -17.996
    4   HG13  VAL   8          HG11      VAL   8   2.069  -1.927 -16.186
    5   HG12  VAL   8          HG12      VAL   8   1.109  -3.273 -15.574
    6   HG11  VAL   8          HG13      VAL   8   0.691  -1.620 -15.130
    7   HG23  VAL   8          HG21      VAL   8  -1.302  -3.045 -15.806
    8   HG22  VAL   8          HG22      VAL   8  -1.132  -3.876 -17.349
    9   HG21  VAL   8          HG23      VAL   8  -2.002  -2.348 -17.267

  No H/Q in entry =           9
  In of MODEL   33
    1    H    MET   9           H        MET   9   1.506  -0.580 -19.389
    2    HA   MET   9           HA       MET   9   3.804   0.444 -18.135
    3    HB2  MET   9           HB2      MET   9   2.843   0.486 -20.994
    4    HB3  MET   9           HB3      MET   9   4.368   1.236 -20.522
    5    HG2  MET   9           HG2      MET   9   5.119  -0.915 -19.555
    6    HG3  MET   9           HG3      MET   9   3.603  -1.662 -20.061
    7    HE2  MET   9           HE1      MET   9   7.304  -1.029 -21.220
    8    HE1  MET   9           HE2      MET   9   6.456   0.503 -21.033
    9    HE3  MET   9           HE3      MET   9   6.989  -0.011 -22.631

  No H/Q in entry =           9
  In of MODEL   33
    1    H    GLY  10           H        GLY  10   1.124   2.069 -19.797
    2    HA3  GLY  10           HA2      GLY  10   2.108   4.715 -19.551
    3    HA2  GLY  10           HA3      GLY  10   0.414   4.268 -19.750

  No H/Q in entry =           3
  In of MODEL   33
    1    H    LEU  11           H        LEU  11   0.014   2.738 -17.465
    2    HA   LEU  11           HA       LEU  11  -0.492   4.715 -15.499
    3    HB2  LEU  11           HB2      LEU  11  -0.447   1.699 -15.349
    4    HB3  LEU  11           HB3      LEU  11  -0.942   2.722 -14.002
    5    HG   LEU  11           HG       LEU  11  -2.193   2.852 -16.760
    6   HD13  LEU  11          HD11      LEU  11  -2.790   0.711 -16.007
    7   HD12  LEU  11          HD12      LEU  11  -4.130   1.712 -15.453
    8   HD11  LEU  11          HD13      LEU  11  -2.872   1.220 -14.319
    9   HD22  LEU  11          HD21      LEU  11  -2.763   4.870 -15.746
   10   HD21  LEU  11          HD22      LEU  11  -2.686   4.199 -14.117
   11   HD23  LEU  11          HD23      LEU  11  -4.069   3.846 -15.153

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  12           H        ILE  12   2.030   2.230 -15.759
    2    HA   ILE  12           HA       ILE  12   3.252   2.752 -13.260
    3    HB   ILE  12           HB       ILE  12   4.481   1.705 -15.831
    4   HG12  ILE  12          HG12      ILE  12   2.473   0.481 -14.688
    5   HG13  ILE  12          HG13      ILE  12   3.874  -0.463 -15.151
    6   HG22  ILE  12          HG21      ILE  12   5.904   0.571 -13.786
    7   HG21  ILE  12          HG22      ILE  12   5.579   2.172 -13.123
    8   HG23  ILE  12          HG23      ILE  12   6.413   2.010 -14.667
    9   HD11  ILE  12          HD11      ILE  12   3.409   0.680 -12.386
   10   HD13  ILE  12          HD12      ILE  12   4.674  -0.451 -12.865
   11   HD12  ILE  12          HD13      ILE  12   2.999  -0.960 -12.858

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  13           H        ILE  13   3.847   4.018 -16.517
    2    HA   ILE  13           HA       ILE  13   6.002   5.719 -15.799
    3    HB   ILE  13           HB       ILE  13   3.961   5.821 -18.033
    4   HG12  ILE  13          HG12      ILE  13   5.780   3.964 -17.771
    5   HG13  ILE  13          HG13      ILE  13   5.540   4.715 -19.345
    6   HG23  ILE  13          HG21      ILE  13   4.604   8.046 -18.043
    7   HG22  ILE  13          HG22      ILE  13   5.866   7.362 -19.061
    8   HG21  ILE  13          HG23      ILE  13   6.198   7.710 -17.365
    9   HD13  ILE  13          HD11      ILE  13   7.544   5.931 -19.213
   10   HD12  ILE  13          HD12      ILE  13   7.973   4.454 -18.358
   11   HD11  ILE  13          HD13      ILE  13   7.547   5.900 -17.451

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ASN  14           H        ASN  14   2.498   6.243 -16.048
    2    HA   ASN  14           HA       ASN  14   2.480   8.987 -15.405
    3    HB2  ASN  14           HB2      ASN  14   0.570   7.362 -16.229
    4    HB3  ASN  14           HB3      ASN  14   0.256   7.183 -14.508
    5   HD21  ASN  14          HD21      ASN  14  -1.762   8.358 -15.928
    6   HD22  ASN  14          HD22      ASN  14  -1.810  10.031 -15.656

  No H/Q in entry =           6
  In of MODEL   33
    1    H    SER  15           H        SER  15   2.173   6.108 -13.333
    2    HA   SER  15           HA       SER  15   1.889   7.475 -10.880
    3    HB2  SER  15           HB2      SER  15   2.434   5.383  -9.838
    4    HB3  SER  15           HB3      SER  15   1.583   4.976 -11.324
    5    HG   SER  15           HG       SER  15   3.908   4.119 -10.629

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLY  16           H        GLY  16   4.747   6.361 -12.656
    2    HA3  GLY  16           HA2      GLY  16   6.688   7.098 -10.733
    3    HA2  GLY  16           HA3      GLY  16   6.981   6.897 -12.459

  No H/Q in entry =           3
  In of MODEL   33
    1    H    GLN  17           H        GLN  17   5.301   8.870 -13.509
    2    HA   GLN  17           HA       GLN  17   6.896  11.199 -13.204
    3    HB2  GLN  17           HB2      GLN  17   5.567  10.739 -15.241
    4    HB3  GLN  17           HB3      GLN  17   4.083  10.955 -14.313
    5    HG2  GLN  17           HG2      GLN  17   4.743  13.275 -13.789
    6    HG3  GLN  17           HG3      GLN  17   6.219  13.063 -14.729
    7   HE21  GLN  17          HE21      GLN  17   6.038  13.849 -16.827
    8   HE22  GLN  17          HE22      GLN  17   4.596  13.921 -17.719

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ALA  18           H        ALA  18   3.796  10.200 -11.841
    2    HA   ALA  18           HA       ALA  18   3.094  12.591 -10.567
    3    HB1  ALA  18           HB1      ALA  18   1.946  10.143 -10.789
    4    HB2  ALA  18           HB2      ALA  18   1.412  11.364  -9.636
    5    HB3  ALA  18           HB3      ALA  18   2.496  10.073  -9.115

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ARG  19           H        ARG  19   4.955   9.813  -9.303
    2    HA   ARG  19           HA       ARG  19   5.508  10.962  -6.781
    3    HB2  ARG  19           HB2      ARG  19   5.904   8.557  -7.315
    4    HB3  ARG  19           HB3      ARG  19   7.258   9.037  -8.342
    5    HG2  ARG  19           HG2      ARG  19   8.393  10.065  -6.423
    6    HG3  ARG  19           HG3      ARG  19   7.020   9.683  -5.386
    7    HD2  ARG  19           HD2      ARG  19   8.774   8.036  -5.040
    8    HD3  ARG  19           HD3      ARG  19   7.390   7.265  -5.821
    9    HE   ARG  19           HE       ARG  19   9.090   8.077  -7.874
   10   HH21  ARG  19          HH11      ARG  19  10.637   6.664  -8.736
   11   HH22  ARG  19          HH12      ARG  19  11.179   5.310  -7.806
   12   HH11  ARG  19          HH21      ARG  19   9.163   6.040  -5.101
   13   HH12  ARG  19          HH22      ARG  19  10.341   4.957  -5.747

  No H/Q in entry =          13
  In of MODEL   33
    1    H    SER  20           H        SER  20   7.310  10.986  -9.839
    2    HA   SER  20           HA       SER  20   9.568  12.387  -9.023
    3    HB2  SER  20           HB2      SER  20   9.023  11.366 -11.334
    4    HB3  SER  20           HB3      SER  20   8.252  12.910 -11.678
    5    HG   SER  20           HG       SER  20  10.950  12.392 -10.989

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU  21           H        LEU  21   6.470  13.676 -10.202
    2    HA   LEU  21           HA       LEU  21   7.158  16.418  -9.975
    3    HB2  LEU  21           HB2      LEU  21   4.480  15.012  -9.880
    4    HB3  LEU  21           HB3      LEU  21   4.661  16.765  -9.891
    5    HG   LEU  21           HG       LEU  21   5.837  14.958 -12.023
    6   HD12  LEU  21          HD11      LEU  21   3.900  15.888 -13.409
    7   HD11  LEU  21          HD12      LEU  21   3.177  16.391 -11.879
    8   HD13  LEU  21          HD13      LEU  21   3.472  14.681 -12.195
    9   HD23  LEU  21          HD21      LEU  21   5.607  17.280 -13.266
   10   HD22  LEU  21          HD22      LEU  21   6.979  17.021 -12.194
   11   HD21  LEU  21          HD23      LEU  21   5.594  17.948 -11.636

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ALA  22           H        ALA  22   5.644  14.132  -7.725
    2    HA   ALA  22           HA       ALA  22   5.061  15.938  -5.651
    3    HB3  ALA  22           HB1      ALA  22   4.287  13.550  -5.815
    4    HB2  ALA  22           HB2      ALA  22   4.885  14.016  -4.222
    5    HB1  ALA  22           HB3      ALA  22   5.898  13.054  -5.301

  No H/Q in entry =           5
  In of MODEL   33
    1    H    TYR  23           H        TYR  23   7.982  13.899  -6.108
    2    HA   TYR  23           HA       TYR  23   9.382  14.906  -3.860
    3    HB2  TYR  23           HB2      TYR  23  10.152  12.897  -5.027
    4    HB3  TYR  23           HB3      TYR  23  10.464  13.837  -6.485
    5    HD1  TYR  23           HD1      TYR  23  11.444  13.478  -2.901
    6    HD2  TYR  23           HD2      TYR  23  12.502  15.006  -6.775
    7    HE1  TYR  23           HE1      TYR  23  13.709  14.042  -2.061
    8    HE2  TYR  23           HE2      TYR  23  14.766  15.570  -5.934
    9    HH   TYR  23           HH       TYR  23  15.930  14.446  -2.896

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ALA  24           H        ALA  24   9.187  16.021  -7.223
    2    HA   ALA  24           HA       ALA  24  11.094  18.097  -6.982
    3    HB2  ALA  24           HB1      ALA  24  10.640  18.166  -9.189
    4    HB3  ALA  24           HB2      ALA  24   9.090  18.922  -8.820
    5    HB1  ALA  24           HB3      ALA  24   9.207  17.168  -8.954

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA  25           H        ALA  25   7.617  17.926  -6.344
    2    HA   ALA  25           HA       ALA  25   7.151  20.645  -5.767
    3    HB1  ALA  25           HB1      ALA  25   5.481  18.654  -5.964
    4    HB2  ALA  25           HB2      ALA  25   5.124  19.941  -4.811
    5    HB3  ALA  25           HB3      ALA  25   5.810  18.417  -4.247

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU  26           H        LEU  26   8.219  17.957  -3.728
    2    HA   LEU  26           HA       LEU  26   8.342  19.383  -1.289
    3    HB2  LEU  26           HB2      LEU  26   8.428  16.966  -1.288
    4    HB3  LEU  26           HB3      LEU  26   9.893  16.970  -2.266
    5    HG   LEU  26           HG       LEU  26  11.121  18.080  -0.430
    6   HD12  LEU  26          HD11      LEU  26   9.907  18.088   1.836
    7   HD11  LEU  26          HD12      LEU  26   8.414  17.957   0.908
    8   HD13  LEU  26          HD13      LEU  26   9.462  19.360   0.697
    9   HD21  LEU  26          HD21      LEU  26   9.583  15.616   0.446
   10   HD23  LEU  26          HD22      LEU  26  11.104  16.172   1.136
   11   HD22  LEU  26          HD23      LEU  26  11.049  15.616  -0.534

  No H/Q in entry =          11
  In of MODEL   33
    1    H    LYS  27           H        LYS  27  10.744  18.807  -3.826
    2    HA   LYS  27           HA       LYS  27  12.938  20.038  -2.607
    3    HB2  LYS  27           HB2      LYS  27  13.025  18.695  -4.700
    4    HB3  LYS  27           HB3      LYS  27  12.259  20.031  -5.559
    5    HG2  LYS  27           HG2      LYS  27  14.132  21.510  -4.988
    6    HG3  LYS  27           HG3      LYS  27  14.893  20.213  -4.058
    7    HD2  LYS  27           HD2      LYS  27  15.022  18.829  -6.115
    8    HD3  LYS  27           HD3      LYS  27  14.306  20.151  -7.037
    9    HE2  LYS  27           HE2      LYS  27  16.201  21.610  -6.432
   10    HE3  LYS  27           HE3      LYS  27  16.921  20.292  -5.500
   11    HZ3  LYS  27           HZ1      LYS  27  17.900  20.393  -7.692
   12    HZ2  LYS  27           HZ2      LYS  27  16.370  20.281  -8.425
   13    HZ1  LYS  27           HZ3      LYS  27  16.993  18.967  -7.546

  No H/Q in entry =          13
  In of MODEL   33
    1    H    GLN  28           H        GLN  28  10.310  21.431  -4.540
    2    HA   GLN  28           HA       GLN  28  11.276  24.081  -4.693
    3    HB2  GLN  28           HB2      GLN  28   8.439  23.022  -4.566
    4    HB3  GLN  28           HB3      GLN  28   8.858  24.692  -4.947
    5    HG2  GLN  28           HG2      GLN  28   9.838  22.273  -6.490
    6    HG3  GLN  28           HG3      GLN  28   8.500  23.306  -6.990
    7   HE21  GLN  28          HE21      GLN  28  11.639  22.810  -7.731
    8   HE22  GLN  28          HE22      GLN  28  12.120  24.392  -8.113

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ALA  29           H        ALA  29   9.352  22.390  -2.250
    2    HA   ALA  29           HA       ALA  29   8.817  24.580  -0.561
    3    HB2  ALA  29           HB1      ALA  29   8.092  23.011   1.008
    4    HB1  ALA  29           HB2      ALA  29   9.308  21.824   0.534
    5    HB3  ALA  29           HB3      ALA  29   7.917  22.123  -0.507

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LYS  30           H        LYS  30  11.541  22.306  -0.649
    2    HA   LYS  30           HA       LYS  30  12.873  23.253   1.649
    3    HB2  LYS  30           HB2      LYS  30  13.953  21.969  -0.870
    4    HB3  LYS  30           HB3      LYS  30  14.944  22.323   0.548
    5    HG2  LYS  30           HG2      LYS  30  13.394  20.941   1.933
    6    HG3  LYS  30           HG3      LYS  30  12.501  20.524   0.467
    7    HD2  LYS  30           HD2      LYS  30  14.538  19.535  -0.507
    8    HD3  LYS  30           HD3      LYS  30  15.451  19.965   0.941
    9    HE2  LYS  30           HE2      LYS  30  13.950  18.535   2.301
   10    HE3  LYS  30           HE3      LYS  30  13.067  18.084   0.836
   11    HZ2  LYS  30           HZ1      LYS  30  14.859  16.501   1.585
   12    HZ1  LYS  30           HZ2      LYS  30  15.996  17.686   1.130
   13    HZ3  LYS  30           HZ3      LYS  30  14.953  17.007  -0.031

  No H/Q in entry =          13
  In of MODEL   33
    1    H    GLN  31           H        GLN  31  12.750  24.464  -1.645
    2    HA   GLN  31           HA       GLN  31  14.909  26.351  -1.231
    3    HB2  GLN  31           HB2      GLN  31  12.855  26.407  -3.445
    4    HB3  GLN  31           HB3      GLN  31  14.477  27.099  -3.453
    5    HG2  GLN  31           HG2      GLN  31  14.935  24.401  -2.885
    6    HG3  GLN  31           HG3      GLN  31  13.625  24.352  -4.057
    7   HE21  GLN  31          HE21      GLN  31  16.465  23.553  -4.477
    8   HE22  GLN  31          HE22      GLN  31  17.032  24.527  -5.745

  No H/Q in entry =           8
  In of MODEL   33
    1    H    GLY  32           H        GLY  32  11.840  26.174  -0.070
    2    HA3  GLY  32           HA2      GLY  32  10.695  27.742   1.212
    3    HA2  GLY  32           HA3      GLY  32  11.820  28.976   0.658

  No H/Q in entry =           3
  In of MODEL   33
    1    H    ASP  33           H        ASP  33  10.438  27.080  -1.831
    2    HA   ASP  33           HA       ASP  33   8.775  29.358  -2.673
    3    HB2  ASP  33           HB2      ASP  33   9.855  26.939  -4.126
    4    HB3  ASP  33           HB3      ASP  33   8.702  28.059  -4.848

  No H/Q in entry =           4
  In of MODEL   33
    1    H    PHE  34           H        PHE  34   7.093  28.883  -1.101
    2    HA   PHE  34           HA       PHE  34   5.709  26.414  -1.003
    3    HB2  PHE  34           HB2      PHE  34   4.758  29.202  -0.313
    4    HB3  PHE  34           HB3      PHE  34   3.908  27.713   0.100
    5    HD1  PHE  34           HD1      PHE  34   6.169  30.104   1.307
    6    HD2  PHE  34           HD2      PHE  34   5.479  25.865   1.249
    7    HE1  PHE  34           HE1      PHE  34   7.570  29.846   3.336
    8    HE2  PHE  34           HE2      PHE  34   6.882  25.611   3.276
    9    HZ   PHE  34           HZ       PHE  34   7.921  27.603   4.319

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ALA  35           H        ALA  35   5.274  29.283  -3.006
    2    HA   ALA  35           HA       ALA  35   2.716  28.676  -4.019
    3    HB1  ALA  35           HB1      ALA  35   3.761  30.070  -6.060
    4    HB3  ALA  35           HB2      ALA  35   4.986  30.426  -4.842
    5    HB2  ALA  35           HB3      ALA  35   3.297  30.838  -4.541

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA  36           H        ALA  36   5.936  27.998  -5.392
    2    HA   ALA  36           HA       ALA  36   4.932  26.576  -7.633
    3    HB3  ALA  36           HB1      ALA  36   7.088  26.696  -8.260
    4    HB2  ALA  36           HB2      ALA  36   7.575  25.664  -6.914
    5    HB1  ALA  36           HB3      ALA  36   7.474  27.412  -6.695

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA  37           H        ALA  37   5.903  25.573  -4.385
    2    HA   ALA  37           HA       ALA  37   5.836  22.786  -4.819
    3    HB2  ALA  37           HB1      ALA  37   5.591  24.573  -2.436
    4    HB1  ALA  37           HB2      ALA  37   6.720  23.253  -2.737
    5    HB3  ALA  37           HB3      ALA  37   5.061  22.902  -2.257

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LYS  38           H        LYS  38   3.314  24.997  -3.634
    2    HA   LYS  38           HA       LYS  38   1.212  23.188  -3.403
    3    HB2  LYS  38           HB2      LYS  38   1.571  25.943  -3.149
    4    HB3  LYS  38           HB3      LYS  38   0.365  25.801  -4.422
    5    HG2  LYS  38           HG2      LYS  38  -1.080  24.478  -2.974
    6    HG3  LYS  38           HG3      LYS  38   0.170  24.412  -1.724
    7    HD2  LYS  38           HD2      LYS  38  -0.008  26.749  -1.272
    8    HD3  LYS  38           HD3      LYS  38  -0.927  27.042  -2.749
    9    HE2  LYS  38           HE2      LYS  38  -2.420  27.076  -0.801
   10    HE3  LYS  38           HE3      LYS  38  -2.803  25.703  -1.844
   11    HZ3  LYS  38           HZ1      LYS  38  -2.072  24.227  -0.318
   12    HZ2  LYS  38           HZ2      LYS  38  -2.415  25.483   0.776
   13    HZ1  LYS  38           HZ3      LYS  38  -0.823  25.230   0.242

  No H/Q in entry =          13
  In of MODEL   33
    1    H    ALA  39           H        ALA  39   2.181  25.094  -6.254
    2    HA   ALA  39           HA       ALA  39   0.095  24.234  -7.947
    3    HB2  ALA  39           HB1      ALA  39   2.827  24.878  -9.014
    4    HB1  ALA  39           HB2      ALA  39   1.867  26.140  -8.241
    5    HB3  ALA  39           HB3      ALA  39   1.245  25.307  -9.666

  No H/Q in entry =           5
  In of MODEL   33
    1    H    MET  40           H        MET  40   3.333  22.927  -7.387
    2    HA   MET  40           HA       MET  40   3.220  20.911  -9.382
    3    HB2  MET  40           HB2      MET  40   4.846  21.127  -6.841
    4    HB3  MET  40           HB3      MET  40   5.087  19.872  -8.059
    5    HG2  MET  40           HG2      MET  40   5.147  22.830  -8.719
    6    HG3  MET  40           HG3      MET  40   6.594  21.923  -8.279
    7    HE3  MET  40           HE1      MET  40   7.447  19.712 -11.097
    8    HE2  MET  40           HE2      MET  40   6.892  19.390  -9.457
    9    HE1  MET  40           HE3      MET  40   7.988  20.736  -9.760

  No H/Q in entry =           9
  In of MODEL   33
    1    H    MET  41           H        MET  41   2.323  20.949  -5.953
    2    HA   MET  41           HA       MET  41   1.787  18.184  -5.678
    3    HB2  MET  41           HB2      MET  41   0.466  20.542  -4.315
    4    HB3  MET  41           HB3      MET  41   0.310  18.863  -3.810
    5    HG2  MET  41           HG2      MET  41   3.020  19.081  -3.861
    6    HG3  MET  41           HG3      MET  41   2.585  20.740  -3.459
    7    HE2  MET  41           HE1      MET  41  -0.448  19.489  -1.720
    8    HE1  MET  41           HE2      MET  41   0.370  21.002  -2.099
    9    HE3  MET  41           HE3      MET  41   0.318  20.428  -0.432

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ASP  42           H        ASP  42  -0.251  20.915  -6.636
    2    HA   ASP  42           HA       ASP  42  -2.695  19.558  -6.762
    3    HB2  ASP  42           HB2      ASP  42  -1.985  22.128  -7.018
    4    HB3  ASP  42           HB3      ASP  42  -2.146  21.737  -8.726

  No H/Q in entry =           4
  In of MODEL   33
    1    H    GLN  43           H        GLN  43  -0.266  20.150  -9.276
    2    HA   GLN  43           HA       GLN  43  -1.666  18.837 -11.360
    3    HB2  GLN  43           HB2      GLN  43   1.295  19.348 -10.993
    4    HB3  GLN  43           HB3      GLN  43   0.572  18.711 -12.473
    5    HG2  GLN  43           HG2      GLN  43  -0.936  20.741 -12.502
    6    HG3  GLN  43           HG3      GLN  43   0.024  21.393 -11.179
    7   HE21  GLN  43          HE21      GLN  43   0.178  23.017 -13.262
    8   HE22  GLN  43          HE22      GLN  43   1.587  22.796 -14.178

  No H/Q in entry =           8
  In of MODEL   33
    1    H    SER  44           H        SER  44   0.695  17.688  -8.984
    2    HA   SER  44           HA       SER  44   1.021  15.083 -10.016
    3    HB2  SER  44           HB2      SER  44   1.929  16.517  -7.781
    4    HB3  SER  44           HB3      SER  44   1.068  15.133  -7.109
    5    HG   SER  44           HG       SER  44   3.176  14.511  -7.547

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ARG  45           H        ARG  45  -1.285  16.400  -7.663
    2    HA   ARG  45           HA       ARG  45  -2.672  14.040  -7.026
    3    HB2  ARG  45           HB2      ARG  45  -2.861  16.206  -5.829
    4    HB3  ARG  45           HB3      ARG  45  -3.723  16.877  -7.210
    5    HG2  ARG  45           HG2      ARG  45  -5.490  15.153  -6.921
    6    HG3  ARG  45           HG3      ARG  45  -4.639  14.537  -5.503
    7    HD2  ARG  45           HD2      ARG  45  -4.837  16.802  -4.442
    8    HD3  ARG  45           HD3      ARG  45  -5.831  17.326  -5.818
    9    HE   ARG  45           HE       ARG  45  -6.938  14.949  -4.777
   10   HH21  ARG  45          HH11      ARG  45  -8.767  15.024  -3.497
   11   HH22  ARG  45          HH12      ARG  45  -9.156  16.463  -2.623
   12   HH11  ARG  45          HH21      ARG  45  -6.384  18.193  -3.750
   13   HH12  ARG  45          HH22      ARG  45  -7.801  18.257  -2.765

  No H/Q in entry =          13
  In of MODEL   33
    1    H    MET  46           H        MET  46  -3.266  16.450  -9.569
    2    HA   MET  46           HA       MET  46  -5.612  15.282 -10.621
    3    HB2  MET  46           HB2      MET  46  -3.516  17.112 -11.798
    4    HB3  MET  46           HB3      MET  46  -4.897  16.555 -12.747
    5    HG2  MET  46           HG2      MET  46  -6.441  17.476 -11.084
    6    HG3  MET  46           HG3      MET  46  -5.089  17.985 -10.078
    7    HE1  MET  46           HE1      MET  46  -6.730  17.922 -13.304
    8    HE3  MET  46           HE2      MET  46  -5.481  18.654 -14.306
    9    HE2  MET  46           HE3      MET  46  -6.883  19.606 -13.822

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ALA  47           H        ALA  47  -2.188  14.801 -11.397
    2    HA   ALA  47           HA       ALA  47  -2.546  13.078 -13.609
    3    HB3  ALA  47           HB1      ALA  47  -0.366  13.965 -13.266
    4    HB2  ALA  47           HB2      ALA  47  -0.224  12.236 -12.937
    5    HB1  ALA  47           HB3      ALA  47  -0.309  13.386 -11.601

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU  48           H        LEU  48  -2.259  12.436 -10.138
    2    HA   LEU  48           HA       LEU  48  -2.356   9.596 -10.301
    3    HB2  LEU  48           HB2      LEU  48  -3.107  11.510  -8.080
    4    HB3  LEU  48           HB3      LEU  48  -3.014   9.759  -7.883
    5    HG   LEU  48           HG       LEU  48  -0.719  11.459  -8.888
    6   HD13  LEU  48          HD11      LEU  48  -0.990  12.225  -6.695
    7   HD12  LEU  48          HD12      LEU  48   0.174  10.917  -6.505
    8   HD11  LEU  48          HD13      LEU  48  -1.523  10.655  -6.099
    9   HD22  LEU  48          HD21      LEU  48  -0.225   9.275  -9.536
   10   HD21  LEU  48          HD22      LEU  48  -1.088   8.557  -8.176
   11   HD23  LEU  48          HD23      LEU  48   0.487   9.309  -7.923

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ASN  49           H        ASN  49  -4.816  12.089  -9.882
    2    HA   ASN  49           HA       ASN  49  -7.000  10.425  -9.335
    3    HB2  ASN  49           HB2      ASN  49  -7.076  12.835  -8.996
    4    HB3  ASN  49           HB3      ASN  49  -6.881  13.118 -10.721
    5   HD21  ASN  49          HD21      ASN  49  -9.120  11.653  -8.348
    6   HD22  ASN  49          HD22      ASN  49 -10.514  11.890  -9.284

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLU  50           H        GLU  50  -5.735  11.627 -12.426
    2    HA   GLU  50           HA       GLU  50  -7.698  10.376 -14.065
    3    HB2  GLU  50           HB2      GLU  50  -6.235  12.195 -14.883
    4    HB3  GLU  50           HB3      GLU  50  -4.841  11.122 -14.753
    5    HG2  GLU  50           HG2      GLU  50  -5.824   9.590 -16.388
    6    HG3  GLU  50           HG3      GLU  50  -7.284  10.569 -16.467

  No H/Q in entry =           6
  In of MODEL   33
    1    H    ALA  51           H        ALA  51  -4.522   9.379 -12.876
    2    HA   ALA  51           HA       ALA  51  -4.391   6.929 -14.300
    3    HB2  ALA  51           HB1      ALA  51  -2.405   6.637 -13.210
    4    HB1  ALA  51           HB2      ALA  51  -3.085   7.057 -11.638
    5    HB3  ALA  51           HB3      ALA  51  -2.634   8.330 -12.772

  No H/Q in entry =           5
  In of MODEL   33
    1    H    HIS  52           H        HIS  52  -5.548   7.755 -11.043
    2    HA   HIS  52           HA       HIS  52  -6.231   5.144 -10.213
    3    HB2  HIS  52           HB2      HIS  52  -6.084   7.097  -8.696
    4    HB3  HIS  52           HB3      HIS  52  -7.538   7.762  -9.439
    5    HD1  HIS  52           HD1      HIS  52  -9.745   6.209  -9.228
    6    HD2  HIS  52           HD2      HIS  52  -6.583   5.233  -6.694
    7    HE1  HIS  52           HE1      HIS  52 -10.711   4.727  -7.416
    8    HE2  HIS  52           HE2      HIS  52  -8.795   4.124  -5.861

  No H/Q in entry =           8
  In of MODEL   33
    1    H    LEU  53           H        LEU  53  -8.058   7.607 -11.988
    2    HA   LEU  53           HA       LEU  53 -10.564   6.318 -11.991
    3    HB2  LEU  53           HB2      LEU  53  -9.287   8.300 -13.862
    4    HB3  LEU  53           HB3      LEU  53 -10.888   7.637 -14.179
    5    HG   LEU  53           HG       LEU  53 -10.154   8.959 -11.546
    6   HD12  LEU  53          HD11      LEU  53 -11.399  10.935 -12.442
    7   HD11  LEU  53          HD12      LEU  53 -11.444  10.147 -14.019
    8   HD13  LEU  53          HD13      LEU  53  -9.903  10.620 -13.312
    9   HD22  LEU  53          HD21      LEU  53 -12.141   7.752 -11.182
   10   HD21  LEU  53          HD22      LEU  53 -12.695   7.988 -12.836
   11   HD23  LEU  53          HD23      LEU  53 -12.775   9.311 -11.690

  No H/Q in entry =          11
  In of MODEL   33
    1    H    VAL  54           H        VAL  54  -7.825   6.121 -14.241
    2    HA   VAL  54           HA       VAL  54  -9.058   4.355 -16.082
    3    HB   VAL  54           HB       VAL  54  -6.147   4.857 -15.412
    4   HG12  VAL  54          HG11      VAL  54  -5.912   3.776 -17.805
    5   HG11  VAL  54          HG12      VAL  54  -7.440   2.996 -17.395
    6   HG13  VAL  54          HG13      VAL  54  -6.020   2.738 -16.384
    7   HG22  VAL  54          HG21      VAL  54  -6.919   6.803 -16.450
    8   HG21  VAL  54          HG22      VAL  54  -8.118   5.943 -17.414
    9   HG23  VAL  54          HG23      VAL  54  -6.414   5.861 -17.853

  No H/Q in entry =           9
  In of MODEL   33
    1    H    GLN  55           H        GLN  55  -7.047   3.801 -13.193
    2    HA   GLN  55           HA       GLN  55  -6.962   0.985 -13.455
    3    HB2  GLN  55           HB2      GLN  55  -5.398   1.876 -11.941
    4    HB3  GLN  55           HB3      GLN  55  -6.609   2.842 -11.104
    5    HG2  GLN  55           HG2      GLN  55  -7.294   1.084  -9.786
    6    HG3  GLN  55           HG3      GLN  55  -7.077  -0.101 -11.068
    7   HE21  GLN  55          HE21      GLN  55  -5.454  -1.554 -10.584
    8   HE22  GLN  55          HE22      GLN  55  -4.064  -1.207  -9.678

  No H/Q in entry =           8
  In of MODEL   33
    1    H    THR  56           H        THR  56  -9.282   3.148 -11.826
    2    HA   THR  56           HA       THR  56 -10.864   1.265 -10.532
    3    HB   THR  56           HB       THR  56 -11.955   3.661 -12.029
    4    HG1  THR  56           HG1      THR  56 -10.103   3.583 -10.150
    5   HG21  THR  56          HG21      THR  56 -13.443   1.864 -10.866
    6   HG23  THR  56          HG22      THR  56 -13.758   3.568 -10.535
    7   HG22  THR  56          HG23      THR  56 -12.863   2.591  -9.369

  No H/Q in entry =           7
  In of MODEL   33
    1    H    LYS  57           H        LYS  57 -11.079   2.354 -13.915
    2    HA   LYS  57           HA       LYS  57 -13.242   0.672 -14.662
    3    HB2  LYS  57           HB2      LYS  57 -12.367   2.624 -15.980
    4    HB3  LYS  57           HB3      LYS  57 -10.933   1.681 -16.357
    5    HG2  LYS  57           HG2      LYS  57 -12.343  -0.013 -17.474
    6    HG3  LYS  57           HG3      LYS  57 -13.774   0.949 -17.121
    7    HD2  LYS  57           HD2      LYS  57 -11.436   2.070 -18.678
    8    HD3  LYS  57           HD3      LYS  57 -12.763   1.223 -19.470
    9    HE2  LYS  57           HE2      LYS  57 -14.350   2.845 -18.322
   10    HE3  LYS  57           HE3      LYS  57 -12.938   3.773 -17.820
   11    HZ3  LYS  57           HZ1      LYS  57 -12.340   4.140 -20.072
   12    HZ2  LYS  57           HZ2      LYS  57 -13.985   4.538 -19.915
   13    HZ1  LYS  57           HZ3      LYS  57 -13.525   3.069 -20.639

  No H/Q in entry =          13
  In of MODEL   33
    1    H    LEU  58           H        LEU  58  -9.738   0.235 -14.621
    2    HA   LEU  58           HA       LEU  58  -9.756  -2.280 -15.914
    3    HB2  LEU  58           HB2      LEU  58  -7.711  -0.995 -14.113
    4    HB3  LEU  58           HB3      LEU  58  -7.457  -2.515 -14.971
    5    HG   LEU  58           HG       LEU  58  -8.212   0.093 -16.327
    6   HD11  LEU  58          HD11      LEU  58  -5.565  -1.150 -15.649
    7   HD13  LEU  58          HD12      LEU  58  -6.057   0.542 -15.596
    8   HD12  LEU  58          HD13      LEU  58  -5.726  -0.227 -17.144
    9   HD22  LEU  58          HD21      LEU  58  -8.798  -1.466 -17.917
   10   HD21  LEU  58          HD22      LEU  58  -7.756  -2.716 -17.242
   11   HD23  LEU  58          HD23      LEU  58  -7.067  -1.442 -18.249

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  59           H        ILE  59 -10.562  -1.381 -12.658
    2    HA   ILE  59           HA       ILE  59 -10.211  -4.150 -11.716
    3    HB   ILE  59           HB       ILE  59  -9.760  -1.882 -10.317
    4   HG12  ILE  59          HG12      ILE  59 -11.108  -4.252  -9.001
    5   HG13  ILE  59          HG13      ILE  59  -9.462  -4.303  -9.580
    6   HG23  ILE  59          HG21      ILE  59 -11.588  -1.216  -8.976
    7   HG22  ILE  59          HG22      ILE  59 -12.529  -2.633  -9.378
    8   HG21  ILE  59          HG23      ILE  59 -12.293  -1.356 -10.569
    9   HD11  ILE  59          HD11      ILE  59  -8.995  -2.255  -8.184
   10   HD13  ILE  59          HD12      ILE  59  -9.339  -3.713  -7.262
   11   HD12  ILE  59          HD13      ILE  59 -10.584  -2.478  -7.461

  No H/Q in entry =          11
  In of MODEL   33
    1    H    GLU  60           H        GLU  60 -12.769  -1.830 -12.510
    2    HA   GLU  60           HA       GLU  60 -14.951  -3.345 -11.490
    3    HB2  GLU  60           HB2      GLU  60 -15.133  -0.960 -12.098
    4    HB3  GLU  60           HB3      GLU  60 -14.874  -1.370 -13.790
    5    HG2  GLU  60           HG2      GLU  60 -17.124  -2.619 -12.216
    6    HG3  GLU  60           HG3      GLU  60 -17.318  -1.064 -12.999

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLY  61           H        GLY  61 -13.291  -3.327 -14.612
    2    HA3  GLY  61           HA2      GLY  61 -15.011  -5.568 -15.498
    3    HA2  GLY  61           HA3      GLY  61 -14.169  -4.463 -16.578

  No H/Q in entry =           3
  In of MODEL   33
    1    H    ASP  62           H        ASP  62 -12.784  -5.916 -13.701
    2    HA   ASP  62           HA       ASP  62 -10.555  -6.927 -15.213
    3    HB2  ASP  62           HB2      ASP  62  -9.756  -7.665 -12.985
    4    HB3  ASP  62           HB3      ASP  62 -10.226  -5.969 -12.997

  No H/Q in entry =           4
  In of MODEL   33
    1    H    ALA  63           H        ALA  63 -12.375  -8.314 -16.478
    2    HA   ALA  63           HA       ALA  63 -13.335 -10.729 -15.317
    3    HB1  ALA  63           HB1      ALA  63 -14.245  -9.893 -17.419
    4    HB2  ALA  63           HB2      ALA  63 -13.513 -11.468 -17.723
    5    HB3  ALA  63           HB3      ALA  63 -12.661  -9.994 -18.186

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLY  64           H        GLY  64 -10.362  -9.870 -16.986
    2    HA3  GLY  64           HA2      GLY  64  -8.290 -10.864 -17.021
    3    HA2  GLY  64           HA3      GLY  64  -8.849 -11.961 -15.765

  No H/Q in entry =           3
  In of MODEL   33
    1    H    GLU  65           H        GLU  65  -7.484 -13.482 -17.111
    2    HA   GLU  65           HA       GLU  65  -8.289 -14.245 -19.702
    3    HB2  GLU  65           HB2      GLU  65  -6.747 -15.737 -17.584
    4    HB3  GLU  65           HB3      GLU  65  -6.989 -16.342 -19.223
    5    HG2  GLU  65           HG2      GLU  65  -5.906 -14.362 -20.153
    6    HG3  GLU  65           HG3      GLU  65  -5.736 -13.668 -18.541

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLY  66           H        GLY  66  -9.167 -15.449 -16.551
    2    HA3  GLY  66           HA2      GLY  66 -11.240 -17.181 -17.733
    3    HA2  GLY  66           HA3      GLY  66 -10.415 -17.531 -16.227

  No H/Q in entry =           3
  In of MODEL   33
    1    H    LYS  67           H        LYS  67 -12.964 -17.725 -16.008
    2    HA   LYS  67           HA       LYS  67 -14.562 -15.480 -15.665
    3    HB2  LYS  67           HB2      LYS  67 -14.700 -18.214 -14.408
    4    HB3  LYS  67           HB3      LYS  67 -15.982 -17.004 -14.267
    5    HG2  LYS  67           HG2      LYS  67 -16.154 -16.870 -16.714
    6    HG3  LYS  67           HG3      LYS  67 -14.847 -18.040 -16.882
    7    HD2  LYS  67           HD2      LYS  67 -16.230 -19.723 -15.684
    8    HD3  LYS  67           HD3      LYS  67 -17.548 -18.553 -15.605
    9    HE2  LYS  67           HE2      LYS  67 -16.256 -19.490 -18.184
   10    HE3  LYS  67           HE3      LYS  67 -17.761 -20.141 -17.534
   11    HZ3  LYS  67           HZ1      LYS  67 -18.430 -18.497 -19.014
   12    HZ2  LYS  67           HZ2      LYS  67 -17.213 -17.415 -18.531
   13    HZ1  LYS  67           HZ3      LYS  67 -18.529 -17.730 -17.504

  No H/Q in entry =          13
  In of MODEL   33
    1    H    MET  68           H        MET  68 -13.483 -17.433 -12.950
    2    HA   MET  68           HA       MET  68 -13.944 -15.499 -10.963
    3    HB2  MET  68           HB2      MET  68 -12.385 -18.067 -11.041
    4    HB3  MET  68           HB3      MET  68 -12.466 -17.077  -9.584
    5    HG2  MET  68           HG2      MET  68 -14.904 -18.051 -11.098
    6    HG3  MET  68           HG3      MET  68 -14.228 -18.868  -9.686
    7    HE3  MET  68           HE1      MET  68 -17.211 -18.101  -9.416
    8    HE2  MET  68           HE2      MET  68 -17.097 -17.498  -7.764
    9    HE1  MET  68           HE3      MET  68 -16.094 -18.857  -8.269

  No H/Q in entry =           9
  In of MODEL   33
    1    H    LYS  69           H        LYS  69 -10.908 -16.344 -12.654
    2    HA   LYS  69           HA       LYS  69  -9.277 -14.742 -10.957
    3    HB2  LYS  69           HB2      LYS  69  -8.774 -16.028 -13.637
    4    HB3  LYS  69           HB3      LYS  69  -7.531 -15.150 -12.744
    5    HG2  LYS  69           HG2      LYS  69  -7.855 -16.641 -10.807
    6    HG3  LYS  69           HG3      LYS  69  -9.115 -17.511 -11.683
    7    HD2  LYS  69           HD2      LYS  69  -7.446 -18.118 -13.426
    8    HD3  LYS  69           HD3      LYS  69  -6.194 -17.318 -12.475
    9    HE2  LYS  69           HE2      LYS  69  -7.921 -19.581 -11.434
   10    HE3  LYS  69           HE3      LYS  69  -6.304 -19.801 -12.099
   11    HZ1  LYS  69           HZ1      LYS  69  -5.490 -18.223 -10.408
   12    HZ3  LYS  69           HZ2      LYS  69  -6.159 -19.630  -9.734
   13    HZ2  LYS  69           HZ3      LYS  69  -7.043 -18.178  -9.726

  No H/Q in entry =          13
  In of MODEL   33
    1    H    VAL  70           H        VAL  70  -7.783 -12.998 -11.729
    2    HA   VAL  70           HA       VAL  70  -9.142 -11.095 -13.554
    3    HB   VAL  70           HB       VAL  70  -8.363  -9.289 -12.050
    4   HG13  VAL  70          HG11      VAL  70 -10.599  -9.848 -11.636
    5   HG12  VAL  70          HG12      VAL  70  -9.873 -10.062 -10.042
    6   HG11  VAL  70          HG13      VAL  70 -10.187 -11.464 -11.063
    7   HG22  VAL  70          HG21      VAL  70  -6.493 -10.091 -10.879
    8   HG21  VAL  70          HG22      VAL  70  -7.251 -11.649 -10.557
    9   HG23  VAL  70          HG23      VAL  70  -7.746 -10.224  -9.645

  No H/Q in entry =           9
  In of MODEL   33
    1    H    SER  71           H        SER  71  -7.622  -9.389 -14.337
    2    HA   SER  71           HA       SER  71  -5.371 -10.497 -15.633
    3    HB2  SER  71           HB2      SER  71  -6.618  -8.465 -16.405
    4    HB3  SER  71           HB3      SER  71  -5.921  -7.574 -15.055
    5    HG   SER  71           HG       SER  71  -4.705  -8.624 -17.353

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU  72           H        LEU  72  -3.347 -10.773 -14.998
    2    HA   LEU  72           HA       LEU  72  -2.615 -10.563 -12.289
    3    HB2  LEU  72           HB2      LEU  72  -0.975 -10.996 -14.782
    4    HB3  LEU  72           HB3      LEU  72  -0.302 -11.064 -13.156
    5    HG   LEU  72           HG       LEU  72  -2.661 -12.758 -14.039
    6   HD12  LEU  72          HD11      LEU  72   0.260 -13.551 -13.851
    7   HD11  LEU  72          HD12      LEU  72  -0.598 -13.253 -15.362
    8   HD13  LEU  72          HD13      LEU  72  -1.083 -14.592 -14.323
    9   HD21  LEU  72          HD21      LEU  72  -0.895 -12.623 -11.602
   10   HD23  LEU  72          HD22      LEU  72  -1.628 -14.156 -12.046
   11   HD22  LEU  72          HD23      LEU  72  -2.648 -12.766 -11.684

  No H/Q in entry =          11
  In of MODEL   33
    1    H    VAL  73           H        VAL  73  -1.906  -8.545 -15.071
    2    HA   VAL  73           HA       VAL  73   0.024  -6.852 -13.974
    3    HB   VAL  73           HB       VAL  73  -0.396  -5.416 -15.822
    4   HG12  VAL  73          HG11      VAL  73  -1.161  -8.199 -16.734
    5   HG11  VAL  73          HG12      VAL  73   0.481  -7.746 -16.279
    6   HG13  VAL  73          HG13      VAL  73  -0.298  -6.970 -17.656
    7   HG23  VAL  73          HG21      VAL  73  -2.546  -6.051 -17.228
    8   HG22  VAL  73          HG22      VAL  73  -2.671  -4.941 -15.865
    9   HG21  VAL  73          HG23      VAL  73  -3.133  -6.632 -15.670

  No H/Q in entry =           9
  In of MODEL   33
    1    H    LEU  74           H        LEU  74  -3.372  -6.960 -13.402
    2    HA   LEU  74           HA       LEU  74  -3.981  -4.304 -12.784
    3    HB2  LEU  74           HB2      LEU  74  -5.715  -5.964 -12.952
    4    HB3  LEU  74           HB3      LEU  74  -5.020  -6.892 -11.626
    5    HG   LEU  74           HG       LEU  74  -5.474  -5.023 -10.075
    6   HD13  LEU  74          HD11      LEU  74  -5.347  -3.083 -11.434
    7   HD12  LEU  74          HD12      LEU  74  -7.058  -3.224 -11.030
    8   HD11  LEU  74          HD13      LEU  74  -6.480  -3.737 -12.617
    9   HD21  LEU  74          HD21      LEU  74  -7.197  -6.846 -10.978
   10   HD23  LEU  74          HD22      LEU  74  -8.021  -5.394 -11.505
   11   HD22  LEU  74          HD23      LEU  74  -7.664  -5.616  -9.809

  No H/Q in entry =          11
  In of MODEL   33
    1    H    VAL  75           H        VAL  75  -2.937  -6.895 -10.629
    2    HA   VAL  75           HA       VAL  75  -2.725  -5.346  -8.285
    3    HB   VAL  75           HB       VAL  75  -1.246  -7.847  -9.087
    4   HG12  VAL  75          HG11      VAL  75  -0.760  -8.001  -6.619
    5   HG11  VAL  75          HG12      VAL  75  -1.420  -6.383  -6.428
    6   HG13  VAL  75          HG13      VAL  75   0.036  -6.626  -7.378
    7   HG21  VAL  75          HG21      VAL  75  -3.633  -7.294  -7.288
    8   HG23  VAL  75          HG22      VAL  75  -2.893  -8.875  -7.531
    9   HG22  VAL  75          HG23      VAL  75  -3.700  -8.063  -8.874

  No H/Q in entry =           9
  In of MODEL   33
    1    H    GLU  76           H        GLU  76  -0.329  -6.110 -10.832
    2    HA   GLU  76           HA       GLU  76   1.865  -4.769  -9.682
    3    HB2  GLU  76           HB2      GLU  76   2.067  -6.240 -11.663
    4    HB3  GLU  76           HB3      GLU  76   1.140  -5.094 -12.616
    5    HG2  GLU  76           HG2      GLU  76   3.468  -4.741 -13.134
    6    HG3  GLU  76           HG3      GLU  76   2.949  -3.371 -12.171

  No H/Q in entry =           6
  In of MODEL   33
    1    H    ALA  77           H        ALA  77  -0.673  -3.560 -11.859
    2    HA   ALA  77           HA       ALA  77   0.323  -0.916 -12.036
    3    HB1  ALA  77           HB1      ALA  77  -1.429  -1.963 -13.526
    4    HB2  ALA  77           HB2      ALA  77  -1.824  -0.343 -12.952
    5    HB3  ALA  77           HB3      ALA  77  -2.582  -1.750 -12.207

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLN  78           H        GLN  78  -1.940  -2.468  -9.818
    2    HA   GLN  78           HA       GLN  78  -2.736  -0.149  -8.411
    3    HB2  GLN  78           HB2      GLN  78  -3.848  -2.411  -8.326
    4    HB3  GLN  78           HB3      GLN  78  -2.511  -2.967  -7.322
    5    HG2  GLN  78           HG2      GLN  78  -3.028  -1.222  -5.665
    6    HG3  GLN  78           HG3      GLN  78  -4.369  -0.667  -6.665
    7   HE21  GLN  78          HE21      GLN  78  -4.837  -1.624  -4.011
    8   HE22  GLN  78          HE22      GLN  78  -5.690  -3.089  -4.113

  No H/Q in entry =           8
  In of MODEL   33
    1    H    LEU  79           H        LEU  79  -0.061  -2.411  -7.974
    2    HA   LEU  79           HA       LEU  79   0.927  -1.518  -5.519
    3    HB2  LEU  79           HB2      LEU  79   1.789  -3.528  -6.593
    4    HB3  LEU  79           HB3      LEU  79   2.431  -2.576  -7.928
    5    HG   LEU  79           HG       LEU  79   3.995  -1.441  -6.429
    6   HD13  LEU  79          HD11      LEU  79   2.999  -1.196  -4.358
    7   HD12  LEU  79          HD12      LEU  79   4.077  -2.547  -4.019
    8   HD11  LEU  79          HD13      LEU  79   2.370  -2.844  -4.343
    9   HD23  LEU  79          HD21      LEU  79   5.206  -3.591  -5.533
   10   HD22  LEU  79          HD22      LEU  79   4.996  -3.390  -7.270
   11   HD21  LEU  79          HD23      LEU  79   3.920  -4.459  -6.374

  No H/Q in entry =          11
  In of MODEL   33
    1    H    HIS  80           H        HIS  80   1.786  -0.399  -8.795
    2    HA   HIS  80           HA       HIS  80   3.600   1.585  -7.877
    3    HB2  HIS  80           HB2      HIS  80   2.299   0.894 -10.456
    4    HB3  HIS  80           HB3      HIS  80   2.897   2.546 -10.286
    5    HD1  HIS  80           HD1      HIS  80   5.297   2.844 -10.817
    6    HD2  HIS  80           HD2      HIS  80   4.477  -1.067  -9.626
    7    HE1  HIS  80           HE1      HIS  80   7.484   1.565 -10.992
    8    HE2  HIS  80           HE2      HIS  80   6.996  -0.822 -10.270

  No H/Q in entry =           8
  In of MODEL   33
    1    H    LEU  81           H        LEU  81   0.192   1.749  -8.844
    2    HA   LEU  81           HA       LEU  81  -0.079   4.542  -8.509
    3    HB2  LEU  81           HB2      LEU  81  -2.095   2.298  -8.425
    4    HB3  LEU  81           HB3      LEU  81  -2.546   4.001  -8.329
    5    HG   LEU  81           HG       LEU  81  -0.862   2.852 -10.573
    6   HD12  LEU  81          HD11      LEU  81  -3.099   3.175 -11.863
    7   HD11  LEU  81          HD12      LEU  81  -3.849   3.105 -10.269
    8   HD13  LEU  81          HD13      LEU  81  -2.909   1.737 -10.861
    9   HD23  LEU  81          HD21      LEU  81  -1.962   4.998 -11.664
   10   HD22  LEU  81          HD22      LEU  81  -0.542   5.167 -10.636
   11   HD21  LEU  81          HD23      LEU  81  -2.144   5.516  -9.989

  No H/Q in entry =          11
  In of MODEL   33
    1    H    MET  82           H        MET  82  -0.731   1.853  -6.261
    2    HA   MET  82           HA       MET  82  -1.775   3.437  -4.168
    3    HB2  MET  82           HB2      MET  82  -0.402   0.750  -4.216
    4    HB3  MET  82           HB3      MET  82  -0.975   1.473  -2.715
    5    HG2  MET  82           HG2      MET  82  -2.717   0.983  -5.150
    6    HG3  MET  82           HG3      MET  82  -2.634  -0.093  -3.756
    7    HE3  MET  82           HE1      MET  82  -4.346   1.554  -0.933
    8    HE2  MET  82           HE2      MET  82  -2.617   1.832  -1.124
    9    HE1  MET  82           HE3      MET  82  -3.307   0.275  -1.577

  No H/Q in entry =           9
  In of MODEL   33
    1    H    THR  83           H        THR  83   1.523   2.351  -4.871
    2    HA   THR  83           HA       THR  83   2.749   3.453  -2.574
    3    HB   THR  83           HB       THR  83   4.838   3.399  -4.055
    4    HG1  THR  83           HG1      THR  83   4.591   2.875  -6.079
    5   HG22  THR  83          HG21      THR  83   4.393   0.741  -4.389
    6   HG21  THR  83          HG22      THR  83   3.108   1.120  -3.244
    7   HG23  THR  83          HG23      THR  83   4.788   1.462  -2.830

  No H/Q in entry =           7
  In of MODEL   33
    1    H    SER  84           H        SER  84   2.366   4.736  -5.871
    2    HA   SER  84           HA       SER  84   3.707   7.176  -5.418
    3    HB2  SER  84           HB2      SER  84   1.630   6.346  -7.431
    4    HB3  SER  84           HB3      SER  84   2.308   7.973  -7.406
    5    HG   SER  84           HG       SER  84   3.680   5.498  -7.705

  No H/Q in entry =           5
  In of MODEL   33
    1    H    MET  85           H        MET  85   0.214   6.419  -5.234
    2    HA   MET  85           HA       MET  85  -0.645   9.029  -4.627
    3    HB2  MET  85           HB2      MET  85  -2.173   7.226  -5.292
    4    HB3  MET  85           HB3      MET  85  -1.875   6.411  -3.758
    5    HG2  MET  85           HG2      MET  85  -2.983   8.063  -2.516
    6    HG3  MET  85           HG3      MET  85  -2.796   9.273  -3.783
    7    HE1  MET  85           HE1      MET  85  -3.809   5.649  -3.560
    8    HE3  MET  85           HE2      MET  85  -3.798   5.809  -5.314
    9    HE2  MET  85           HE3      MET  85  -5.317   5.513  -4.475

  No H/Q in entry =           9
  In of MODEL   33
    1    H    LEU  86           H        LEU  86   0.282   6.364  -2.490
    2    HA   LEU  86           HA       LEU  86  -0.241   7.664  -0.044
    3    HB2  LEU  86           HB2      LEU  86   0.219   5.193  -0.443
    4    HB3  LEU  86           HB3      LEU  86   1.927   5.622  -0.544
    5    HG   LEU  86           HG       LEU  86   1.611   6.780   1.727
    6   HD11  LEU  86          HD11      LEU  86  -1.086   6.017   1.265
    7   HD13  LEU  86          HD12      LEU  86  -0.413   6.761   2.714
    8   HD12  LEU  86          HD13      LEU  86  -0.506   5.006   2.592
    9   HD23  LEU  86          HD21      LEU  86   1.180   3.788   1.847
   10   HD22  LEU  86          HD22      LEU  86   2.188   4.795   2.884
   11   HD21  LEU  86          HD23      LEU  86   2.682   4.472   1.223

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ALA  87           H        ALA  87   2.732   7.369  -1.945
    2    HA   ALA  87           HA       ALA  87   4.446   8.774  -0.225
    3    HB3  ALA  87           HB1      ALA  87   4.529   7.765  -2.934
    4    HB2  ALA  87           HB2      ALA  87   5.869   8.093  -1.838
    5    HB1  ALA  87           HB3      ALA  87   5.252   9.375  -2.878

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ARG  88           H        ARG  88   2.490   9.917  -2.936
    2    HA   ARG  88           HA       ARG  88   3.270  12.605  -2.818
    3    HB2  ARG  88           HB2      ARG  88   2.006  11.458  -4.672
    4    HB3  ARG  88           HB3      ARG  88   0.553  11.602  -3.684
    5    HG2  ARG  88           HG2      ARG  88   1.578  14.181  -3.600
    6    HG3  ARG  88           HG3      ARG  88   1.994  13.668  -5.233
    7    HD2  ARG  88           HD2      ARG  88  -0.149  13.753  -5.922
    8    HD3  ARG  88           HD3      ARG  88  -0.732  12.899  -4.493
    9    HE   ARG  88           HE       ARG  88  -0.918  15.678  -4.906
   10   HH21  ARG  88          HH11      ARG  88  -1.435  17.006  -3.164
   11   HH22  ARG  88          HH12      ARG  88  -1.134  16.466  -1.549
   12   HH11  ARG  88          HH21      ARG  88   0.102  13.410  -2.539
   13   HH12  ARG  88          HH22      ARG  88  -0.281  14.424  -1.195

  No H/Q in entry =          13
  In of MODEL   33
    1    H    GLU  89           H        GLU  89   0.569  10.935  -1.170
    2    HA   GLU  89           HA       GLU  89  -0.528  13.247   0.043
    3    HB2  GLU  89           HB2      GLU  89  -1.652  11.011  -0.043
    4    HB3  GLU  89           HB3      GLU  89  -0.525  10.451   1.192
    5    HG2  GLU  89           HG2      GLU  89  -1.334  12.149   2.758
    6    HG3  GLU  89           HG3      GLU  89  -2.390  12.824   1.519

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LEU  90           H        LEU  90   1.922  10.947   1.203
    2    HA   LEU  90           HA       LEU  90   2.291  12.186   3.733
    3    HB2  LEU  90           HB2      LEU  90   4.052  10.409   2.046
    4    HB3  LEU  90           HB3      LEU  90   4.480  10.922   3.684
    5    HG   LEU  90           HG       LEU  90   1.838   9.585   3.031
    6   HD12  LEU  90          HD11      LEU  90   2.977   7.534   4.032
    7   HD11  LEU  90          HD12      LEU  90   4.500   8.386   3.785
    8   HD13  LEU  90          HD13      LEU  90   3.481   7.984   2.401
    9   HD22  LEU  90          HD21      LEU  90   1.585  10.506   5.156
   10   HD21  LEU  90          HD22      LEU  90   3.304  10.393   5.531
   11   HD23  LEU  90          HD23      LEU  90   2.294   8.949   5.581

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  91           H        ILE  91   3.883  12.569   0.601
    2    HA   ILE  91           HA       ILE  91   5.869  14.392   1.435
    3    HB   ILE  91           HB       ILE  91   4.545  13.910  -1.240
    4   HG12  ILE  91          HG12      ILE  91   7.380  13.412  -0.279
    5   HG13  ILE  91          HG13      ILE  91   6.095  12.218  -0.113
    6   HG22  ILE  91          HG21      ILE  91   6.770  15.251  -1.936
    7   HG21  ILE  91          HG22      ILE  91   6.469  16.050  -0.392
    8   HG23  ILE  91          HG23      ILE  91   5.241  16.085  -1.656
    9   HD13  ILE  91          HD11      ILE  91   5.911  11.900  -2.420
   10   HD12  ILE  91          HD12      ILE  91   7.647  12.136  -2.213
   11   HD11  ILE  91          HD13      ILE  91   6.639  13.464  -2.793

  No H/Q in entry =          11
  In of MODEL   33
    1    H    THR  92           H        THR  92   2.505  14.838   0.442
    2    HA   THR  92           HA       THR  92   2.489  17.662   0.386
    3    HB   THR  92           HB       THR  92   0.317  15.674   1.091
    4    HG1  THR  92           HG1      THR  92   0.612  15.497  -0.995
    5   HG22  THR  92          HG21      THR  92  -1.079  17.842   0.379
    6   HG21  THR  92          HG22      THR  92   0.319  18.661   1.071
    7   HG23  THR  92          HG23      THR  92  -0.622  17.541   2.055

  No H/Q in entry =           7
  In of MODEL   33
    1    H    GLU  93           H        GLU  93   1.943  15.359   3.038
    2    HA   GLU  93           HA       GLU  93   1.426  17.261   5.062
    3    HB2  GLU  93           HB2      GLU  93   2.730  14.531   5.288
    4    HB3  GLU  93           HB3      GLU  93   2.048  15.458   6.626
    5    HG2  GLU  93           HG2      GLU  93   0.423  14.691   4.192
    6    HG3  GLU  93           HG3      GLU  93   0.526  13.665   5.618

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LEU  94           H        LEU  94   4.422  15.770   3.898
    2    HA   LEU  94           HA       LEU  94   6.185  16.907   5.780
    3    HB2  LEU  94           HB2      LEU  94   6.571  15.943   2.946
    4    HB3  LEU  94           HB3      LEU  94   7.907  16.594   3.891
    5    HG   LEU  94           HG       LEU  94   6.164  14.403   5.030
    6   HD11  LEU  94          HD11      LEU  94   8.250  14.173   2.889
    7   HD13  LEU  94          HD12      LEU  94   6.801  13.204   3.155
    8   HD12  LEU  94          HD13      LEU  94   8.230  12.944   4.156
    9   HD23  LEU  94          HD21      LEU  94   8.356  13.856   6.172
   10   HD22  LEU  94          HD22      LEU  94   7.697  15.436   6.594
   11   HD21  LEU  94          HD23      LEU  94   9.030  15.312   5.446

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  95           H        ILE  95   5.037  18.088   2.637
    2    HA   ILE  95           HA       ILE  95   6.618  20.440   2.576
    3    HB   ILE  95           HB       ILE  95   3.966  19.769   1.280
    4   HG12  ILE  95          HG12      ILE  95   6.751  20.097   0.132
    5   HG13  ILE  95          HG13      ILE  95   6.098  18.546   0.647
    6   HG21  ILE  95          HG21      ILE  95   5.724  22.230   1.057
    7   HG23  ILE  95          HG22      ILE  95   4.001  22.168   1.420
    8   HG22  ILE  95          HG23      ILE  95   4.575  21.768  -0.199
    9   HD13  ILE  95          HD11      ILE  95   4.531  18.479  -1.076
   10   HD12  ILE  95          HD12      ILE  95   5.880  19.293  -1.868
   11   HD11  ILE  95          HD13      ILE  95   4.514  20.232  -1.268

  No H/Q in entry =          11
  In of MODEL   33
    1    H    GLU  96           H        GLU  96   3.372  19.798   3.883
    2    HA   GLU  96           HA       GLU  96   2.766  22.446   4.641
    3    HB2  GLU  96           HB2      GLU  96   1.084  20.670   4.657
    4    HB3  GLU  96           HB3      GLU  96   1.948  19.837   5.947
    5    HG2  GLU  96           HG2      GLU  96   0.939  21.122   7.523
    6    HG3  GLU  96           HG3      GLU  96   1.477  22.595   6.726

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LEU  97           H        LEU  97   4.605  19.885   6.254
    2    HA   LEU  97           HA       LEU  97   4.978  21.228   8.726
    3    HB2  LEU  97           HB2      LEU  97   6.500  19.055   7.302
    4    HB3  LEU  97           HB3      LEU  97   7.099  19.735   8.813
    5    HG   LEU  97           HG       LEU  97   4.284  18.654   8.511
    6   HD12  LEU  97          HD11      LEU  97   5.220  16.635   9.717
    7   HD11  LEU  97          HD12      LEU  97   6.832  17.260   9.367
    8   HD13  LEU  97          HD13      LEU  97   5.755  16.809   8.045
    9   HD23  LEU  97          HD21      LEU  97   4.746  18.353  11.073
   10   HD22  LEU  97          HD22      LEU  97   4.370  19.967  10.473
   11   HD21  LEU  97          HD23      LEU  97   6.041  19.520  10.811

  No H/Q in entry =          11
  In of MODEL   33
    1    H    HIS  98           H        HIS  98   6.836  21.241   5.693
    2    HA   HIS  98           HA       HIS  98   9.000  22.810   6.586
    3    HB2  HIS  98           HB2      HIS  98   7.695  22.565   3.865
    4    HB3  HIS  98           HB3      HIS  98   9.140  23.537   4.151
    5    HD1  HIS  98           HD1      HIS  98   7.913  19.972   4.170
    6    HD2  HIS  98           HD2      HIS  98  11.505  22.051   4.584
    7    HE1  HIS  98           HE1      HIS  98   9.760  18.234   4.102
    8    HE2  HIS  98           HE2      HIS  98  11.951  19.479   4.355

  No H/Q in entry =           8
  In of MODEL   33
    1    H    GLU  99           H        GLU  99   5.779  23.661   5.425
    2    HA   GLU  99           HA       GLU  99   6.170  26.475   5.371
    3    HB2  GLU  99           HB2      GLU  99   4.281  25.316   4.246
    4    HB3  GLU  99           HB3      GLU  99   3.590  24.955   5.827
    5    HG2  GLU  99           HG2      GLU  99   3.423  27.347   6.333
    6    HG3  GLU  99           HG3      GLU  99   4.195  27.746   4.802

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LYS 100           H        LYS 100   5.039  24.240   7.893
    2    HA   LYS 100           HA       LYS 100   4.470  26.294   9.793
    3    HB2  LYS 100           HB2      LYS 100   5.033  23.339  10.131
    4    HB3  LYS 100           HB3      LYS 100   4.596  24.411  11.467
    5    HG2  LYS 100           HG2      LYS 100   2.528  25.061  10.229
    6    HG3  LYS 100           HG3      LYS 100   2.945  23.892   8.973
    7    HD2  LYS 100           HD2      LYS 100   2.865  22.069  10.631
    8    HD3  LYS 100           HD3      LYS 100   2.466  23.231  11.898
    9    HE2  LYS 100           HE2      LYS 100   0.410  23.865  10.645
   10    HE3  LYS 100           HE3      LYS 100   0.800  22.646   9.425
   11    HZ1  LYS 100           HZ1      LYS 100   0.542  21.975  12.306
   12    HZ3  LYS 100           HZ2      LYS 100   0.516  20.923  10.969
   13    HZ2  LYS 100           HZ3      LYS 100  -0.793  21.969  11.256

  No H/Q in entry =          13
  In of MODEL   33
    1    H    LEU 101           H        LEU 101   7.382  24.485   8.944
    2    HA   LEU 101           HA       LEU 101   8.993  25.313  11.143
    3    HB2  LEU 101           HB2      LEU 101   9.571  24.328   8.361
    4    HB3  LEU 101           HB3      LEU 101  10.881  24.985   9.338
    5    HG   LEU 101           HG       LEU 101   9.042  22.837  10.405
    6   HD12  LEU 101          HD11      LEU 101  11.086  21.332   9.786
    7   HD11  LEU 101          HD12      LEU 101  11.455  22.595   8.614
    8   HD13  LEU 101          HD13      LEU 101   9.921  21.730   8.525
    9   HD21  LEU 101          HD21      LEU 101  11.775  23.929  11.124
   10   HD23  LEU 101          HD22      LEU 101  11.226  22.359  11.703
   11   HD22  LEU 101          HD23      LEU 101  10.343  23.818  12.147

  No H/Q in entry =          11
  In of MODEL   33
    1    H    LYS 102           H        LYS 102   7.411  27.189   9.012
    2    HA   LYS 102           HA       LYS 102   7.499  29.482   8.724
    3    HB2  LYS 102           HB2      LYS 102   9.072  29.354  10.816
    4    HB3  LYS 102           HB3      LYS 102  10.368  29.544   9.652
    5    HG2  LYS 102           HG2      LYS 102   8.276  31.507  10.526
    6    HG3  LYS 102           HG3      LYS 102   9.989  31.758  10.268
    7    HD2  LYS 102           HD2      LYS 102   8.026  31.350   7.975
    8    HD3  LYS 102           HD3      LYS 102   8.420  32.926   8.645
    9    HE2  LYS 102           HE2      LYS 102   9.778  31.738   6.563
   10    HE3  LYS 102           HE3      LYS 102  10.406  33.039   7.575
   11    HZ2  LYS 102           HZ1      LYS 102  11.915  31.127   7.390
   12    HZ1  LYS 102           HZ2      LYS 102  10.751  30.149   8.135
   13    HZ3  LYS 102           HZ3      LYS 102  11.454  31.431   8.994

  No H/Q in entry =          13
  In of MODEL   33
    1    H    ALA 103           H        ALA 103  10.747  28.126   8.144
    2    HA   ALA 103           HA       ALA 103  11.710  29.502   6.067
    3    HB2  ALA 103           HB1      ALA 103  12.579  27.284   5.131
    4    HB1  ALA 103           HB2      ALA 103  11.685  26.513   6.439
    5    HB3  ALA 103           HB3      ALA 103  12.982  27.649   6.809

  No H/Q in entry =           5
  In of MODEL   33
    1    H1   LYS   3           H1       LYS   3 -31.296   5.770 -19.907
    2    H2   LYS   3           H3       LYS   3 -30.288   5.492 -21.246
    3    H3   LYS   3           H2       LYS   3 -31.665   4.529 -21.005
    4    HA   LYS   3           HA       LYS   3 -30.647   3.172 -19.581
    5    HB2  LYS   3           HB2      LYS   3 -28.384   4.621 -20.903
    6    HB3  LYS   3           HB3      LYS   3 -28.045   3.430 -19.648
    7    HG2  LYS   3           HG2      LYS   3 -29.421   1.804 -21.000
    8    HG3  LYS   3           HG3      LYS   3 -29.389   2.995 -22.299
    9    HD2  LYS   3           HD2      LYS   3 -26.905   2.934 -22.226
   10    HD3  LYS   3           HD3      LYS   3 -27.008   1.642 -21.030
   11    HE2  LYS   3           HE2      LYS   3 -28.466   0.423 -22.751
   12    HE3  LYS   3           HE3      LYS   3 -27.860   1.605 -23.910
   13    HZ3  LYS   3           HZ1      LYS   3 -26.034   0.413 -24.154
   14    HZ2  LYS   3           HZ2      LYS   3 -26.649  -0.760 -23.091
   15    HZ1  LYS   3           HZ3      LYS   3 -25.692   0.508 -22.494

  No H/Q in entry =          15
  In of MODEL   33
    1    H    LYS   4           H        LYS   4 -30.716   3.043 -17.519
    2    HA   LYS   4           HA       LYS   4 -30.047   5.356 -15.880
    3    HB2  LYS   4           HB2      LYS   4 -31.201   2.645 -15.171
    4    HB3  LYS   4           HB3      LYS   4 -31.016   3.996 -14.053
    5    HG2  LYS   4           HG2      LYS   4 -32.800   3.880 -16.491
    6    HG3  LYS   4           HG3      LYS   4 -33.308   3.933 -14.803
    7    HD2  LYS   4           HD2      LYS   4 -32.658   6.170 -14.547
    8    HD3  LYS   4           HD3      LYS   4 -31.604   6.122 -15.960
    9    HE2  LYS   4           HE2      LYS   4 -33.553   7.455 -16.449
   10    HE3  LYS   4           HE3      LYS   4 -33.595   5.973 -17.407
   11    HZ3  LYS   4           HZ1      LYS   4 -35.167   5.042 -15.868
   12    HZ2  LYS   4           HZ2      LYS   4 -35.745   6.522 -16.468
   13    HZ1  LYS   4           HZ3      LYS   4 -35.101   6.435 -14.899

  No H/Q in entry =          13
  In of MODEL   33
    1    H    HIS   5           H        HIS   5 -28.595   5.481 -14.276
    2    HA   HIS   5           HA       HIS   5 -26.275   3.694 -14.573
    3    HB2  HIS   5           HB2      HIS   5 -26.593   6.452 -13.390
    4    HB3  HIS   5           HB3      HIS   5 -25.094   5.525 -13.353
    5    HD1  HIS   5           HD1      HIS   5 -23.632   6.741 -14.937
    6    HD2  HIS   5           HD2      HIS   5 -27.407   6.038 -16.521
    7    HE1  HIS   5           HE1      HIS   5 -23.452   7.306 -17.390
    8    HE2  HIS   5           HE2      HIS   5 -25.755   6.866 -18.324

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ILE   6           H        ILE   6 -26.029   2.135 -13.243
    2    HA   ILE   6           HA       ILE   6 -27.035   2.404 -10.490
    3    HB   ILE   6           HB       ILE   6 -26.151  -0.058 -12.001
    4   HG12  ILE   6          HG12      ILE   6 -28.919   0.836 -11.182
    5   HG13  ILE   6          HG13      ILE   6 -28.265   0.997 -12.811
    6   HG23  ILE   6          HG21      ILE   6 -26.518  -1.303 -10.135
    7   HG22  ILE   6          HG22      ILE   6 -27.703  -0.173  -9.474
    8   HG21  ILE   6          HG23      ILE   6 -25.980   0.195  -9.373
    9   HD13  ILE   6          HD11      ILE   6 -28.682  -1.134 -13.300
   10   HD12  ILE   6          HD12      ILE   6 -29.710  -1.125 -11.867
   11   HD11  ILE   6          HD13      ILE   6 -28.047  -1.702 -11.755

  No H/Q in entry =          11
  In of MODEL   33
    1    H    TYR   7           H        TYR   7 -25.299   3.086  -9.192
    2    HA   TYR   7           HA       TYR   7 -22.565   2.173  -9.840
    3    HB2  TYR   7           HB2      TYR   7 -23.585   4.600  -8.386
    4    HB3  TYR   7           HB3      TYR   7 -21.891   4.115  -8.406
    5    HD1  TYR   7           HD1      TYR   7 -22.887   3.132 -11.498
    6    HD2  TYR   7           HD2      TYR   7 -22.299   6.731  -9.293
    7    HE1  TYR   7           HE1      TYR   7 -22.457   4.353 -13.594
    8    HE2  TYR   7           HE2      TYR   7 -21.912   7.958 -11.381
    9    HH   TYR   7           HH       TYR   7 -22.109   7.851 -13.615

  No H/Q in entry =           9
  In of MODEL   33
    1    H    LEU   8           H        LEU   8 -21.589   0.848  -8.492
    2    HA   LEU   8           HA       LEU   8 -22.735   0.353  -5.816
    3    HB2  LEU   8           HB2      LEU   8 -20.987  -1.294  -7.622
    4    HB3  LEU   8           HB3      LEU   8 -21.180  -1.667  -5.909
    5    HG   LEU   8           HG       LEU   8 -23.653  -1.885  -6.352
    6   HD13  LEU   8          HD11      LEU   8 -23.786  -0.687  -8.472
    7   HD12  LEU   8          HD12      LEU   8 -24.285  -2.361  -8.705
    8   HD11  LEU   8          HD13      LEU   8 -22.681  -1.839  -9.219
    9   HD23  LEU   8          HD21      LEU   8 -22.328  -3.916  -8.019
   10   HD22  LEU   8          HD22      LEU   8 -23.425  -4.092  -6.650
   11   HD21  LEU   8          HD23      LEU   8 -21.727  -3.708  -6.376

  No H/Q in entry =          11
  In of MODEL   33
    1    H    PHE   9           H        PHE   9 -21.497   0.798  -4.028
    2    HA   PHE   9           HA       PHE   9 -18.717   1.767  -4.504
    3    HB2  PHE   9           HB2      PHE   9 -20.788   2.840  -2.594
    4    HB3  PHE   9           HB3      PHE   9 -19.085   3.277  -2.542
    5    HD1  PHE   9           HD1      PHE   9 -18.067   4.610  -4.305
    6    HD2  PHE   9           HD2      PHE   9 -22.232   3.590  -4.434
    7    HE1  PHE   9           HE1      PHE   9 -18.421   6.281  -6.099
    8    HE2  PHE   9           HE2      PHE   9 -22.588   5.273  -6.223
    9    HZ   PHE   9           HZ       PHE   9 -20.680   6.614  -7.061

  No H/Q in entry =           9
  In of MODEL   33
    1    H    SER  10           H        SER  10 -17.125   0.901  -3.310
    2    HA   SER  10           HA       SER  10 -17.388   0.023  -0.624
    3    HB2  SER  10           HB2      SER  10 -17.100  -2.367  -0.933
    4    HB3  SER  10           HB3      SER  10 -18.564  -1.846  -1.752
    5    HG   SER  10           HG       SER  10 -16.608  -3.171  -2.788

  No H/Q in entry =           5
  In of MODEL   33
    1    H    SER  11           H        SER  11 -15.380   0.177   0.262
    2    HA   SER  11           HA       SER  11 -13.185   1.037  -1.255
    3    HB2  SER  11           HB2      SER  11 -13.724   1.143   1.325
    4    HB3  SER  11           HB3      SER  11 -12.726  -0.313   1.358
    5    HG   SER  11           HG       SER  11 -11.823   2.065   1.405

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA  12           H        ALA  12 -14.332  -1.653  -2.067
    2    HA   ALA  12           HA       ALA  12 -11.748  -2.901  -2.550
    3    HB1  ALA  12           HB1      ALA  12 -13.974  -4.367  -1.119
    4    HB3  ALA  12           HB2      ALA  12 -12.358  -4.027  -0.502
    5    HB2  ALA  12           HB3      ALA  12 -12.567  -5.153  -1.841

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLY  13           H        GLY  13 -12.623  -1.855  -4.573
    2    HA3  GLY  13           HA2      GLY  13 -14.821  -2.694  -6.036
    3    HA2  GLY  13           HA3      GLY  13 -13.307  -2.138  -6.762

  No H/Q in entry =           3
  In of MODEL   33
    1    H    MET  14           H        MET  14 -11.739  -4.381  -5.657
    2    HA   MET  14           HA       MET  14 -11.871  -6.134  -7.813
    3    HB2  MET  14           HB2      MET  14  -9.921  -6.071  -6.301
    4    HB3  MET  14           HB3      MET  14 -10.857  -6.884  -5.048
    5    HG2  MET  14           HG2      MET  14  -9.565  -8.579  -6.158
    6    HG3  MET  14           HG3      MET  14 -11.220  -8.772  -6.736
    7    HE1  MET  14           HE1      MET  14  -7.866  -9.068  -7.681
    8    HE3  MET  14           HE2      MET  14  -7.671  -7.332  -7.447
    9    HE2  MET  14           HE3      MET  14  -7.482  -8.021  -9.056

  No H/Q in entry =           9
  In of MODEL   33
    1    H    SER  15           H        SER  15 -13.290  -6.699  -4.599
    2    HA   SER  15           HA       SER  15 -14.494  -9.192  -5.445
    3    HB2  SER  15           HB2      SER  15 -14.815  -7.560  -2.930
    4    HB3  SER  15           HB3      SER  15 -15.877  -8.919  -3.290
    5    HG   SER  15           HG       SER  15 -13.340  -8.932  -2.368

  No H/Q in entry =           5
  In of MODEL   33
    1    H    THR  16           H        THR  16 -15.638  -5.854  -5.047
    2    HA   THR  16           HA       THR  16 -18.420  -6.372  -5.605
    3    HB   THR  16           HB       THR  16 -16.865  -3.813  -6.116
    4    HG1  THR  16           HG1      THR  16 -18.185  -3.816  -3.802
    5   HG21  THR  16          HG21      THR  16 -19.762  -4.388  -5.449
    6   HG23  THR  16          HG22      THR  16 -19.146  -3.844  -7.019
    7   HG22  THR  16          HG23      THR  16 -19.060  -2.783  -5.606

  No H/Q in entry =           7
  In of MODEL   33
    1    H    SER  17           H        SER  17 -15.566  -5.791  -7.433
    2    HA   SER  17           HA       SER  17 -16.682  -5.090  -9.951
    3    HB2  SER  17           HB2      SER  17 -14.037  -6.355  -9.210
    4    HB3  SER  17           HB3      SER  17 -14.468  -5.944 -10.869
    5    HG   SER  17           HG       SER  17 -13.621  -4.347  -8.847

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU  18           H        LEU  18 -16.071  -8.213  -8.473
    2    HA   LEU  18           HA       LEU  18 -16.605  -9.741 -10.822
    3    HB2  LEU  18           HB2      LEU  18 -15.389 -10.641  -8.870
    4    HB3  LEU  18           HB3      LEU  18 -16.862 -10.510  -7.910
    5    HG   LEU  18           HG       LEU  18 -17.975 -12.123  -9.375
    6   HD13  LEU  18          HD11      LEU  18 -17.046 -11.892 -11.497
    7   HD12  LEU  18          HD12      LEU  18 -16.293 -13.386 -10.939
    8   HD11  LEU  18          HD13      LEU  18 -15.395 -11.870 -10.881
    9   HD23  LEU  18          HD21      LEU  18 -15.352 -13.314  -8.591
   10   HD22  LEU  18          HD22      LEU  18 -16.969 -14.014  -8.510
   11   HD21  LEU  18          HD23      LEU  18 -16.504 -12.738  -7.386

  No H/Q in entry =          11
  In of MODEL   33
    1    H    LEU  19           H        LEU  19 -18.624  -8.549  -8.140
    2    HA   LEU  19           HA       LEU  19 -21.056  -9.784  -8.988
    3    HB2  LEU  19           HB2      LEU  19 -20.832  -8.932  -6.742
    4    HB3  LEU  19           HB3      LEU  19 -20.561  -7.301  -7.353
    5    HG   LEU  19           HG       LEU  19 -22.914  -7.281  -8.173
    6   HD12  LEU  19          HD11      LEU  19 -24.461  -8.960  -7.257
    7   HD11  LEU  19          HD12      LEU  19 -23.096  -9.842  -6.576
    8   HD13  LEU  19          HD13      LEU  19 -23.268  -9.701  -8.324
    9   HD21  LEU  19          HD21      LEU  19 -22.134  -6.320  -6.011
   10   HD23  LEU  19          HD22      LEU  19 -22.653  -7.809  -5.222
   11   HD22  LEU  19          HD23      LEU  19 -23.836  -6.782  -6.031

  No H/Q in entry =          11
  In of MODEL   33
    1    H    VAL  20           H        VAL  20 -19.612  -6.602  -9.693
    2    HA   VAL  20           HA       VAL  20 -21.726  -5.611 -11.291
    3    HB   VAL  20           HB       VAL  20 -18.747  -4.968 -11.448
    4   HG12  VAL  20          HG11      VAL  20 -21.093  -3.491 -12.674
    5   HG11  VAL  20          HG12      VAL  20 -19.878  -4.404 -13.567
    6   HG13  VAL  20          HG13      VAL  20 -19.416  -2.948 -12.686
    7   HG23  VAL  20          HG21      VAL  20 -19.649  -2.811 -10.370
    8   HG22  VAL  20          HG22      VAL  20 -19.460  -4.246  -9.366
    9   HG21  VAL  20          HG23      VAL  20 -21.058  -3.790  -9.958

  No H/Q in entry =           9
  In of MODEL   33
    1    H    SER  21           H        SER  21 -18.921  -7.618 -12.275
    2    HA   SER  21           HA       SER  21 -19.679  -7.542 -15.034
    3    HB2  SER  21           HB2      SER  21 -18.205  -9.488 -15.336
    4    HB3  SER  21           HB3      SER  21 -17.407  -8.216 -14.413
    5    HG   SER  21           HG       SER  21 -18.470 -10.658 -13.520

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LYS  22           H        LYS  22 -20.730  -9.727 -12.456
    2    HA   LYS  22           HA       LYS  22 -22.221 -11.389 -14.281
    3    HB2  LYS  22           HB2      LYS  22 -22.320 -11.034 -11.290
    4    HB3  LYS  22           HB3      LYS  22 -23.426 -12.100 -12.157
    5    HG2  LYS  22           HG2      LYS  22 -20.998 -12.947 -13.075
    6    HG3  LYS  22           HG3      LYS  22 -20.627 -12.499 -11.410
    7    HD2  LYS  22           HD2      LYS  22 -21.235 -14.714 -11.177
    8    HD3  LYS  22           HD3      LYS  22 -22.757 -13.886 -10.841
    9    HE2  LYS  22           HE2      LYS  22 -23.706 -15.141 -12.425
   10    HE3  LYS  22           HE3      LYS  22 -22.737 -14.271 -13.615
   11    HZ2  LYS  22           HZ1      LYS  22 -22.686 -16.917 -13.255
   12    HZ1  LYS  22           HZ2      LYS  22 -21.370 -16.441 -12.292
   13    HZ3  LYS  22           HZ3      LYS  22 -21.416 -16.019 -13.936

  No H/Q in entry =          13
  In of MODEL   33
    1    H    MET  23           H        MET  23 -23.015  -8.466 -12.442
    2    HA   MET  23           HA       MET  23 -25.815  -8.598 -12.976
    3    HB2  MET  23           HB2      MET  23 -24.015  -6.253 -12.403
    4    HB3  MET  23           HB3      MET  23 -25.761  -6.116 -12.600
    5    HG2  MET  23           HG2      MET  23 -26.150  -7.412 -10.625
    6    HG3  MET  23           HG3      MET  23 -24.434  -7.792 -10.478
    7    HE2  MET  23           HE1      MET  23 -26.806  -4.172  -9.341
    8    HE1  MET  23           HE2      MET  23 -27.029  -5.155 -10.786
    9    HE3  MET  23           HE3      MET  23 -26.019  -3.711 -10.850

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ARG  24           H        ARG  24 -23.067  -7.135 -14.743
    2    HA   ARG  24           HA       ARG  24 -24.566  -5.876 -16.767
    3    HB2  ARG  24           HB2      ARG  24 -21.731  -6.961 -16.764
    4    HB3  ARG  24           HB3      ARG  24 -22.406  -6.080 -18.112
    5    HG2  ARG  24           HG2      ARG  24 -22.643  -4.043 -16.752
    6    HG3  ARG  24           HG3      ARG  24 -22.103  -4.939 -15.308
    7    HD2  ARG  24           HD2      ARG  24 -20.171  -3.768 -16.196
    8    HD3  ARG  24           HD3      ARG  24 -19.990  -5.482 -16.551
    9    HE   ARG  24           HE       ARG  24 -21.104  -4.542 -18.809
   10   HH21  ARG  24          HH11      ARG  24 -19.663  -5.147 -20.424
   11   HH22  ARG  24          HH12      ARG  24 -18.009  -4.649 -20.328
   12   HH11  ARG  24          HH21      ARG  24 -18.437  -3.481 -17.015
   13   HH12  ARG  24          HH22      ARG  24 -17.297  -3.655 -18.311

  No H/Q in entry =          13
  In of MODEL   33
    1    H    ALA  25           H        ALA  25 -23.394  -9.192 -16.455
    2    HA   ALA  25           HA       ALA  25 -23.981 -10.052 -19.093
    3    HB1  ALA  25           HB1      ALA  25 -23.260 -12.068 -18.375
    4    HB3  ALA  25           HB2      ALA  25 -24.332 -12.054 -16.975
    5    HB2  ALA  25           HB3      ALA  25 -22.790 -11.202 -16.913

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLN  26           H        GLN  26 -25.838 -10.099 -16.088
    2    HA   GLN  26           HA       GLN  26 -28.152 -11.346 -17.121
    3    HB2  GLN  26           HB2      GLN  26 -27.692  -9.575 -14.740
    4    HB3  GLN  26           HB3      GLN  26 -29.240 -10.324 -15.102
    5    HG2  GLN  26           HG2      GLN  26 -26.636 -11.737 -14.596
    6    HG3  GLN  26           HG3      GLN  26 -28.010 -11.649 -13.501
    7   HE21  GLN  26          HE21      GLN  26 -26.745 -13.802 -14.750
    8   HE22  GLN  26          HE22      GLN  26 -27.763 -14.871 -15.550

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ALA  27           H        ALA  27 -27.275  -7.931 -16.742
    2    HA   ALA  27           HA       ALA  27 -29.772  -6.883 -17.558
    3    HB1  ALA  27           HB1      ALA  27 -27.995  -5.533 -16.434
    4    HB3  ALA  27           HB2      ALA  27 -28.582  -4.786 -17.921
    5    HB2  ALA  27           HB3      ALA  27 -27.033  -5.628 -17.910

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLU  28           H        GLU  28 -27.033  -8.076 -19.392
    2    HA   GLU  28           HA       GLU  28 -27.957  -7.066 -21.927
    3    HB2  GLU  28           HB2      GLU  28 -25.575  -7.708 -21.274
    4    HB3  GLU  28           HB3      GLU  28 -26.093  -9.382 -21.471
    5    HG2  GLU  28           HG2      GLU  28 -24.938  -8.600 -23.432
    6    HG3  GLU  28           HG3      GLU  28 -26.627  -8.951 -23.797

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LYS  29           H        LYS  29 -28.093 -10.163 -20.254
    2    HA   LYS  29           HA       LYS  29 -29.353 -11.666 -22.263
    3    HB2  LYS  29           HB2      LYS  29 -28.310 -12.622 -20.242
    4    HB3  LYS  29           HB3      LYS  29 -29.602 -11.928 -19.264
    5    HG2  LYS  29           HG2      LYS  29 -31.231 -13.332 -20.341
    6    HG3  LYS  29           HG3      LYS  29 -30.010 -13.955 -21.449
    7    HD2  LYS  29           HD2      LYS  29 -28.868 -15.094 -19.697
    8    HD3  LYS  29           HD3      LYS  29 -29.801 -14.259 -18.456
    9    HE2  LYS  29           HE2      LYS  29 -30.513 -16.622 -18.812
   10    HE3  LYS  29           HE3      LYS  29 -31.807 -15.450 -19.077
   11    HZ1  LYS  29           HZ1      LYS  29 -31.214 -15.590 -21.496
   12    HZ3  LYS  29           HZ2      LYS  29 -31.920 -16.984 -20.831
   13    HZ2  LYS  29           HZ3      LYS  29 -30.248 -16.931 -21.111

  No H/Q in entry =          13
  In of MODEL   33
    1    H    TYR  30           H        TYR  30 -30.803  -9.568 -19.785
    2    HA   TYR  30           HA       TYR  30 -33.446 -10.065 -21.052
    3    HB2  TYR  30           HB2      TYR  30 -32.839  -8.886 -18.332
    4    HB3  TYR  30           HB3      TYR  30 -34.445  -9.172 -18.999
    5    HD1  TYR  30           HD1      TYR  30 -35.318 -11.480 -19.209
    6    HD2  TYR  30           HD2      TYR  30 -31.513 -10.688 -17.470
    7    HE1  TYR  30           HE1      TYR  30 -35.201 -13.801 -18.398
    8    HE2  TYR  30           HE2      TYR  30 -31.397 -12.996 -16.662
    9    HH   TYR  30           HH       TYR  30 -32.988 -15.388 -17.758

  No H/Q in entry =           9
  In of MODEL   33
    1    H    GLU  31           H        GLU  31 -31.303  -8.045 -21.841
    2    HA   GLU  31           HA       GLU  31 -31.253  -5.891 -22.676
    3    HB2  GLU  31           HB2      GLU  31 -34.131  -6.655 -23.214
    4    HB3  GLU  31           HB3      GLU  31 -33.305  -5.279 -23.943
    5    HG2  GLU  31           HG2      GLU  31 -31.798  -6.700 -25.111
    6    HG3  GLU  31           HG3      GLU  31 -32.349  -8.118 -24.220

  No H/Q in entry =           6
  In of MODEL   33
    1    H    VAL  32           H        VAL  32 -31.483  -5.778 -19.946
    2    HA   VAL  32           HA       VAL  32 -33.386  -3.692 -19.319
    3    HB   VAL  32           HB       VAL  32 -30.995  -4.637 -17.707
    4   HG12  VAL  32          HG11      VAL  32 -32.563  -3.828 -15.833
    5   HG11  VAL  32          HG12      VAL  32 -33.398  -2.944 -17.111
    6   HG13  VAL  32          HG13      VAL  32 -31.700  -2.611 -16.775
    7   HG21  VAL  32          HG21      VAL  32 -32.728  -6.390 -18.404
    8   HG23  VAL  32          HG22      VAL  32 -33.792  -5.574 -17.260
    9   HG22  VAL  32          HG23      VAL  32 -32.270  -6.269 -16.706

  No H/Q in entry =           9
  In of MODEL   33
    1    HA   PRO  33           HA       PRO  33 -30.386  -0.722 -20.978
    2    HB2  PRO  33           HB2      PRO  33 -31.935   1.475 -20.882
    3    HB3  PRO  33           HB3      PRO  33 -32.371   0.160 -21.973
    4    HG2  PRO  33           HG2      PRO  33 -33.377   0.675 -19.175
    5    HG3  PRO  33           HG3      PRO  33 -34.322   0.442 -20.644
    6    HD2  PRO  33           HD2      PRO  33 -33.849  -1.614 -18.963
    7    HD3  PRO  33           HD3      PRO  33 -33.889  -1.866 -20.708

  No H/Q in entry =           7
  In of MODEL   33
    1    H    VAL  34           H        VAL  34 -29.133  -1.234 -19.013
    2    HA   VAL  34           HA       VAL  34 -28.908   1.204 -17.376
    3    HB   VAL  34           HB       VAL  34 -28.323  -0.237 -15.424
    4   HG12  VAL  34          HG11      VAL  34 -30.723  -1.150 -15.137
    5   HG11  VAL  34          HG12      VAL  34 -31.035  -0.404 -16.703
    6   HG13  VAL  34          HG13      VAL  34 -30.515   0.589 -15.342
    7   HG21  VAL  34          HG21      VAL  34 -28.452  -2.277 -17.423
    8   HG23  VAL  34          HG22      VAL  34 -29.517  -2.649 -16.065
    9   HG22  VAL  34          HG23      VAL  34 -27.806  -2.331 -15.782

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ILE  35           H        ILE  35 -26.949   1.678 -16.518
    2    HA   ILE  35           HA       ILE  35 -24.609   0.383 -17.750
    3    HB   ILE  35           HB       ILE  35 -25.067   3.270 -16.959
    4   HG12  ILE  35          HG12      ILE  35 -24.036   1.967 -19.486
    5   HG13  ILE  35          HG13      ILE  35 -25.679   2.560 -19.246
    6   HG21  ILE  35          HG21      ILE  35 -22.476   1.781 -17.233
    7   HG23  ILE  35          HG22      ILE  35 -22.964   2.958 -16.015
    8   HG22  ILE  35          HG23      ILE  35 -22.574   3.490 -17.650
    9   HD11  ILE  35          HD11      ILE  35 -24.323   4.782 -18.643
   10   HD13  ILE  35          HD12      ILE  35 -24.836   4.381 -20.283
   11   HD12  ILE  35          HD13      ILE  35 -23.184   4.043 -19.767

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ILE  36           H        ILE  36 -23.377  -0.610 -16.132
    2    HA   ILE  36           HA       ILE  36 -23.858   0.011 -13.270
    3    HB   ILE  36           HB       ILE  36 -22.971  -2.681 -14.355
    4   HG12  ILE  36          HG12      ILE  36 -25.799  -1.922 -13.624
    5   HG13  ILE  36          HG13      ILE  36 -25.211  -1.900 -15.286
    6   HG23  ILE  36          HG21      ILE  36 -23.329  -3.506 -12.240
    7   HG22  ILE  36          HG22      ILE  36 -24.483  -2.239 -11.819
    8   HG21  ILE  36          HG23      ILE  36 -22.758  -1.877 -11.875
    9   HD13  ILE  36          HD11      ILE  36 -25.336  -4.118 -15.483
   10   HD12  ILE  36          HD12      ILE  36 -26.417  -4.007 -14.095
   11   HD11  ILE  36          HD13      ILE  36 -24.714  -4.396 -13.856

  No H/Q in entry =          11
  In of MODEL   33
    1    H    GLU  37           H        GLU  37 -22.099   0.679 -12.150
    2    HA   GLU  37           HA       GLU  37 -19.386  -0.074 -13.035
    3    HB2  GLU  37           HB2      GLU  37 -20.338   2.704 -12.355
    4    HB3  GLU  37           HB3      GLU  37 -18.641   2.239 -12.474
    5    HG2  GLU  37           HG2      GLU  37 -18.899   1.783 -14.828
    6    HG3  GLU  37           HG3      GLU  37 -20.621   2.147 -14.731

  No H/Q in entry =           6
  In of MODEL   33
    1    H    ALA  38           H        ALA  38 -17.911  -0.276 -11.335
    2    HA   ALA  38           HA       ALA  38 -18.975  -0.101  -8.577
    3    HB1  ALA  38           HB1      ALA  38 -17.211  -2.016  -9.974
    4    HB3  ALA  38           HB2      ALA  38 -18.270  -2.264  -8.587
    5    HB2  ALA  38           HB3      ALA  38 -16.673  -1.550  -8.360

  No H/Q in entry =           5
  In of MODEL   33
    1    H    PHE  39           H        PHE  39 -17.772   1.139  -7.097
    2    HA   PHE  39           HA       PHE  39 -15.261   2.384  -7.975
    3    HB2  PHE  39           HB2      PHE  39 -17.731   3.820  -7.033
    4    HB3  PHE  39           HB3      PHE  39 -16.124   4.523  -6.853
    5    HD1  PHE  39           HD1      PHE  39 -14.725   4.843  -8.937
    6    HD2  PHE  39           HD2      PHE  39 -18.908   4.021  -9.020
    7    HE1  PHE  39           HE1      PHE  39 -14.843   5.742 -11.243
    8    HE2  PHE  39           HE2      PHE  39 -19.041   4.909 -11.320
    9    HZ   PHE  39           HZ       PHE  39 -17.009   5.743 -12.451

  No H/Q in entry =           9
  In of MODEL   33
    1    HA   PRO  40           HA       PRO  40 -14.353   1.671  -3.675
    2    HB2  PRO  40           HB2      PRO  40 -12.631   3.723  -3.061
    3    HB3  PRO  40           HB3      PRO  40 -12.151   2.396  -4.120
    4    HG2  PRO  40           HG2      PRO  40 -13.225   5.107  -4.888
    5    HG3  PRO  40           HG3      PRO  40 -11.773   4.294  -5.474
    6    HD2  PRO  40           HD2      PRO  40 -13.978   4.149  -6.909
    7    HD3  PRO  40           HD3      PRO  40 -12.996   2.701  -6.697

  No H/Q in entry =           7
  In of MODEL   33
    1    H    GLU  41           H        GLU  41 -15.016   2.647  -1.557
    2    HA   GLU  41           HA       GLU  41 -17.293   4.305  -1.572
    3    HB2  GLU  41           HB2      GLU  41 -17.119   4.296   0.830
    4    HB3  GLU  41           HB3      GLU  41 -16.720   2.687   0.224
    5    HG2  GLU  41           HG2      GLU  41 -15.115   2.970   1.837
    6    HG3  GLU  41           HG3      GLU  41 -14.261   3.529   0.400

  No H/Q in entry =           6
  In of MODEL   33
    1    H    THR  42           H        THR  42 -13.981   5.290  -1.596
    2    HA   THR  42           HA       THR  42 -14.399   7.849  -0.402
    3    HB   THR  42           HB       THR  42 -12.243   8.461  -1.475
    4    HG1  THR  42           HG1      THR  42 -12.892   6.875  -3.300
    5   HG23  THR  42          HG21      THR  42 -12.017   7.344   0.611
    6   HG22  THR  42          HG22      THR  42 -10.902   6.522  -0.483
    7   HG21  THR  42          HG23      THR  42 -12.457   5.787  -0.093

  No H/Q in entry =           7
  In of MODEL   33
    1    H    LEU  43           H        LEU  43 -15.249   6.720  -3.505
    2    HA   LEU  43           HA       LEU  43 -15.549   9.481  -4.493
    3    HB2  LEU  43           HB2      LEU  43 -15.724   6.790  -5.829
    4    HB3  LEU  43           HB3      LEU  43 -16.173   8.298  -6.627
    5    HG   LEU  43           HG       LEU  43 -13.399   7.622  -5.680
    6   HD13  LEU  43          HD11      LEU  43 -13.470   6.256  -7.483
    7   HD12  LEU  43          HD12      LEU  43 -13.253   7.765  -8.368
    8   HD11  LEU  43          HD13      LEU  43 -14.866   7.077  -8.183
    9   HD22  LEU  43          HD21      LEU  43 -13.678   9.979  -5.718
   10   HD21  LEU  43          HD22      LEU  43 -14.599   9.921  -7.221
   11   HD23  LEU  43          HD23      LEU  43 -12.872   9.566  -7.230

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ALA  44           H        ALA  44 -17.476   7.626  -2.649
    2    HA   ALA  44           HA       ALA  44 -19.937   7.427  -3.995
    3    HB2  ALA  44           HB1      ALA  44 -19.796   6.324  -1.891
    4    HB3  ALA  44           HB2      ALA  44 -20.934   7.647  -1.638
    5    HB1  ALA  44           HB3      ALA  44 -19.271   7.794  -1.069

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLY  45           H        GLY  45 -18.591  10.265  -2.465
    2    HA3  GLY  45           HA2      GLY  45 -21.055  11.711  -2.859
    3    HA2  GLY  45           HA3      GLY  45 -19.530  12.371  -2.270

  No H/Q in entry =           3
  In of MODEL   33
    1    H    GLU  46           H        GLU  46 -17.956  11.454  -4.540
    2    HA   GLU  46           HA       GLU  46 -18.621  13.645  -6.328
    3    HB2  GLU  46           HB2      GLU  46 -16.388  11.607  -6.348
    4    HB3  GLU  46           HB3      GLU  46 -16.528  12.951  -7.481
    5    HG2  GLU  46           HG2      GLU  46 -16.209  13.215  -4.499
    6    HG3  GLU  46           HG3      GLU  46 -14.912  13.382  -5.682

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LYS  47           H        LYS  47 -18.424  10.128  -6.741
    2    HA   LYS  47           HA       LYS  47 -19.500  10.309  -9.429
    3    HB2  LYS  47           HB2      LYS  47 -18.911   7.936  -7.652
    4    HB3  LYS  47           HB3      LYS  47 -19.444   7.831  -9.331
    5    HG2  LYS  47           HG2      LYS  47 -16.938   9.261  -8.526
    6    HG3  LYS  47           HG3      LYS  47 -16.973   7.537  -8.892
    7    HD2  LYS  47           HD2      LYS  47 -17.918   8.035 -11.102
    8    HD3  LYS  47           HD3      LYS  47 -17.847   9.758 -10.735
    9    HE2  LYS  47           HE2      LYS  47 -15.423   9.622 -10.519
   10    HE3  LYS  47           HE3      LYS  47 -15.485   7.892 -10.855
   11    HZ3  LYS  47           HZ1      LYS  47 -15.839   8.234 -13.028
   12    HZ2  LYS  47           HZ2      LYS  47 -15.081   9.720 -12.714
   13    HZ1  LYS  47           HZ3      LYS  47 -16.776   9.630 -12.788

  No H/Q in entry =          13
  In of MODEL   33
    1    H    GLY  48           H        GLY  48 -20.839   9.543  -6.289
    2    HA3  GLY  48           HA2      GLY  48 -23.190   8.304  -7.048
    3    HA2  GLY  48           HA3      GLY  48 -23.000   9.310  -5.612

  No H/Q in entry =           3
  In of MODEL   33
    1    H    GLN  49           H        GLN  49 -22.452  11.736  -7.191
    2    HA   GLN  49           HA       GLN  49 -25.032  12.794  -7.368
    3    HB2  GLN  49           HB2      GLN  49 -22.493  13.702  -8.708
    4    HB3  GLN  49           HB3      GLN  49 -23.976  14.638  -8.644
    5    HG2  GLN  49           HG2      GLN  49 -23.841  14.679  -6.206
    6    HG3  GLN  49           HG3      GLN  49 -22.371  13.722  -6.268
    7   HE21  GLN  49          HE21      GLN  49 -22.313  15.960  -5.008
    8   HE22  GLN  49          HE22      GLN  49 -21.410  17.231  -5.653

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ASN  50           H        ASN  50 -23.290  10.935  -9.727
    2    HA   ASN  50           HA       ASN  50 -25.170  11.757 -11.833
    3    HB2  ASN  50           HB2      ASN  50 -22.557  10.269 -12.031
    4    HB3  ASN  50           HB3      ASN  50 -23.601  10.665 -13.388
    5   HD21  ASN  50          HD21      ASN  50 -21.000  11.574 -11.756
    6   HD22  ASN  50          HD22      ASN  50 -20.796  13.212 -12.106

  No H/Q in entry =           6
  In of MODEL   33
    1    H    ALA  51           H        ALA  51 -25.130   9.414  -9.573
    2    HA   ALA  51           HA       ALA  51 -25.853   7.243 -11.395
    3    HB2  ALA  51           HB1      ALA  51 -25.258   5.916  -9.695
    4    HB3  ALA  51           HB2      ALA  51 -26.408   6.707  -8.618
    5    HB1  ALA  51           HB3      ALA  51 -24.780   7.360  -8.802

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ASP  52           H        ASP  52 -27.837   6.149 -11.268
    2    HA   ASP  52           HA       ASP  52 -30.061   7.941 -10.636
    3    HB2  ASP  52           HB2      ASP  52 -29.803   5.431 -12.290
    4    HB3  ASP  52           HB3      ASP  52 -31.366   6.136 -11.874

  No H/Q in entry =           4
  In of MODEL   33
    1    H    VAL  53           H        VAL  53 -28.414   5.090  -9.587
    2    HA   VAL  53           HA       VAL  53 -29.881   5.203  -7.086
    3    HB   VAL  53           HB       VAL  53 -31.235   3.527  -8.334
    4   HG11  VAL  53          HG11      VAL  53 -29.457   2.694  -9.833
    5   HG13  VAL  53          HG12      VAL  53 -30.273   1.388  -8.975
    6   HG12  VAL  53          HG13      VAL  53 -28.679   1.924  -8.451
    7   HG23  VAL  53          HG21      VAL  53 -30.393   1.577  -6.622
    8   HG22  VAL  53          HG22      VAL  53 -31.551   2.861  -6.274
    9   HG21  VAL  53          HG23      VAL  53 -29.852   3.068  -5.851

  No H/Q in entry =           9
  In of MODEL   33
    1    H    VAL  54           H        VAL  54 -28.577   4.806  -5.416
    2    HA   VAL  54           HA       VAL  54 -25.796   4.006  -5.995
    3    HB   VAL  54           HB       VAL  54 -26.922   5.776  -3.765
    4   HG11  VAL  54          HG11      VAL  54 -24.314   4.405  -4.023
    5   HG13  VAL  54          HG12      VAL  54 -25.094   5.078  -2.592
    6   HG12  VAL  54          HG13      VAL  54 -24.198   6.132  -3.686
    7   HG22  VAL  54          HG21      VAL  54 -26.087   7.600  -4.867
    8   HG21  VAL  54          HG22      VAL  54 -26.602   6.592  -6.220
    9   HG23  VAL  54          HG23      VAL  54 -24.900   6.652  -5.764

  No H/Q in entry =           9
  In of MODEL   33
    1    H    LEU  55           H        LEU  55 -25.174   2.100  -5.334
    2    HA   LEU  55           HA       LEU  55 -26.678   0.774  -3.166
    3    HB2  LEU  55           HB2      LEU  55 -25.077  -0.378  -5.439
    4    HB3  LEU  55           HB3      LEU  55 -25.833  -1.319  -4.153
    5    HG   LEU  55           HG       LEU  55 -27.278   0.229  -6.293
    6   HD13  LEU  55          HD11      LEU  55 -26.931  -1.625  -7.499
    7   HD12  LEU  55          HD12      LEU  55 -27.884  -2.511  -6.308
    8   HD11  LEU  55          HD13      LEU  55 -26.131  -2.413  -6.140
    9   HD23  LEU  55          HD21      LEU  55 -28.554  -1.731  -4.440
   10   HD22  LEU  55          HD22      LEU  55 -29.266  -0.367  -5.303
   11   HD21  LEU  55          HD23      LEU  55 -28.266  -0.084  -3.878

  No H/Q in entry =          11
  In of MODEL   33
    1    H    LEU  56           H        LEU  56 -25.534   0.211  -1.346
    2    HA   LEU  56           HA       LEU  56 -22.607   0.661  -1.368
    3    HB2  LEU  56           HB2      LEU  56 -24.430   0.430   1.013
    4    HB3  LEU  56           HB3      LEU  56 -22.729   0.891   1.017
    5    HG   LEU  56           HG       LEU  56 -25.049   2.521   0.020
    6   HD11  LEU  56          HD11      LEU  56 -23.953   2.175   2.554
    7   HD13  LEU  56          HD12      LEU  56 -24.963   3.522   2.030
    8   HD12  LEU  56          HD13      LEU  56 -23.207   3.659   1.959
    9   HD23  LEU  56          HD21      LEU  56 -23.134   4.254  -0.165
   10   HD22  LEU  56          HD22      LEU  56 -23.483   3.143  -1.489
   11   HD21  LEU  56          HD23      LEU  56 -22.134   2.821  -0.401

  No H/Q in entry =          11
  In of MODEL   33
    1    H    GLY  57           H        GLY  57 -21.203  -0.940  -0.812
    2    HA3  GLY  57           HA2      GLY  57 -22.072  -3.644  -1.002
    3    HA2  GLY  57           HA3      GLY  57 -20.465  -3.116  -0.506

  No H/Q in entry =           3
  In of MODEL   33
    1    HA   PRO  58           HA       PRO  58 -23.293  -4.186   3.179
    2    HB2  PRO  58           HB2      PRO  58 -22.566  -6.775   3.808
    3    HB3  PRO  58           HB3      PRO  58 -23.948  -6.398   2.779
    4    HG2  PRO  58           HG2      PRO  58 -21.196  -7.232   2.025
    5    HG3  PRO  58           HG3      PRO  58 -22.746  -7.725   1.340
    6    HD2  PRO  58           HD2      PRO  58 -21.157  -5.885   0.123
    7    HD3  PRO  58           HD3      PRO  58 -22.918  -5.832   0.003

  No H/Q in entry =           7
  In of MODEL   33
    1    H    GLN  59           H        GLN  59 -19.908  -4.600   2.609
    2    HA   GLN  59           HA       GLN  59 -19.180  -4.588   5.376
    3    HB2  GLN  59           HB2      GLN  59 -17.581  -3.715   2.966
    4    HB3  GLN  59           HB3      GLN  59 -16.940  -3.920   4.583
    5    HG2  GLN  59           HG2      GLN  59 -18.133  -6.095   2.872
    6    HG3  GLN  59           HG3      GLN  59 -16.418  -5.814   3.123
    7   HE21  GLN  59          HE21      GLN  59 -18.649  -7.621   3.934
    8   HE22  GLN  59          HE22      GLN  59 -18.452  -8.340   5.420

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ILE  60           H        ILE  60 -20.137  -2.068   3.144
    2    HA   ILE  60           HA       ILE  60 -19.341  -0.083   5.186
    3    HB   ILE  60           HB       ILE  60 -19.585   1.632   3.348
    4   HG12  ILE  60          HG12      ILE  60 -19.313  -0.577   1.361
    5   HG13  ILE  60          HG13      ILE  60 -20.923  -0.119   1.916
    6   HG21  ILE  60          HG21      ILE  60 -17.444   0.452   4.116
    7   HG23  ILE  60          HG22      ILE  60 -17.419   1.390   2.623
    8   HG22  ILE  60          HG23      ILE  60 -17.527  -0.369   2.558
    9   HD11  ILE  60          HD11      ILE  60 -20.177   2.300   1.293
   10   HD13  ILE  60          HD12      ILE  60 -20.651   1.191   0.007
   11   HD12  ILE  60          HD13      ILE  60 -18.944   1.487   0.329

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ALA  61           H        ALA  61 -21.768  -1.713   5.240
    2    HA   ALA  61           HA       ALA  61 -24.020  -0.090   4.750
    3    HB1  ALA  61           HB1      ALA  61 -25.221  -1.595   6.071
    4    HB2  ALA  61           HB2      ALA  61 -23.826  -1.953   7.090
    5    HB3  ALA  61           HB3      ALA  61 -23.894  -2.570   5.440

  No H/Q in entry =           5
  In of MODEL   33
    1    H    TYR  62           H        TYR  62 -21.838  -0.147   7.570
    2    HA   TYR  62           HA       TYR  62 -23.440   1.493   9.214
    3    HB2  TYR  62           HB2      TYR  62 -21.420   1.961  10.464
    4    HB3  TYR  62           HB3      TYR  62 -21.443   0.258  10.012
    5    HD1  TYR  62           HD1      TYR  62 -19.822  -0.635   8.395
    6    HD2  TYR  62           HD2      TYR  62 -19.734   3.486   9.524
    7    HE1  TYR  62           HE1      TYR  62 -17.603  -0.400   7.348
    8    HE2  TYR  62           HE2      TYR  62 -17.501   3.716   8.477
    9    HH   TYR  62           HH       TYR  62 -15.820   2.626   7.551

  No H/Q in entry =           9
  In of MODEL   33
    1    H    MET  63           H        MET  63 -21.784   2.364   6.369
    2    HA   MET  63           HA       MET  63 -21.674   5.202   7.047
    3    HB2  MET  63           HB2      MET  63 -21.017   3.677   4.527
    4    HB3  MET  63           HB3      MET  63 -20.853   5.425   4.701
    5    HG2  MET  63           HG2      MET  63 -19.159   5.106   6.411
    6    HG3  MET  63           HG3      MET  63 -19.332   3.358   6.266
    7    HE1  MET  63           HE1      MET  63 -18.413   6.584   4.836
    8    HE3  MET  63           HE2      MET  63 -19.045   6.208   3.233
    9    HE2  MET  63           HE3      MET  63 -17.301   6.267   3.502

  No H/Q in entry =           9
  In of MODEL   33
    1    H    LEU  64           H        LEU  64 -24.195   3.298   6.069
    2    HA   LEU  64           HA       LEU  64 -25.409   4.683   3.970
    3    HB2  LEU  64           HB2      LEU  64 -26.250   2.567   4.893
    4    HB3  LEU  64           HB3      LEU  64 -26.736   3.410   6.363
    5    HG   LEU  64           HG       LEU  64 -28.440   4.628   5.111
    6   HD13  LEU  64          HD11      LEU  64 -28.139   4.861   2.880
    7   HD12  LEU  64          HD12      LEU  64 -28.756   3.215   2.738
    8   HD11  LEU  64          HD13      LEU  64 -27.018   3.503   2.811
    9   HD23  LEU  64          HD21      LEU  64 -28.903   1.803   4.375
   10   HD22  LEU  64          HD22      LEU  64 -29.920   2.925   5.279
   11   HD21  LEU  64          HD23      LEU  64 -28.539   2.161   6.063

  No H/Q in entry =          11
  In of MODEL   33
    1    HA   PRO  65           HA       PRO  65 -27.670   7.815   6.681
    2    HB2  PRO  65           HB2      PRO  65 -25.693   8.021   8.953
    3    HB3  PRO  65           HB3      PRO  65 -27.438   8.273   8.981
    4    HG2  PRO  65           HG2      PRO  65 -26.479   6.040   9.930
    5    HG3  PRO  65           HG3      PRO  65 -27.888   5.977   8.872
    6    HD2  PRO  65           HD2      PRO  65 -25.000   5.406   8.200
    7    HD3  PRO  65           HD3      PRO  65 -26.438   4.493   7.745

  No H/Q in entry =           7
  In of MODEL   33
    1    H    GLU  66           H        GLU  66 -24.114   7.819   6.788
    2    HA   GLU  66           HA       GLU  66 -23.858  10.619   6.369
    3    HB2  GLU  66           HB2      GLU  66 -22.002   8.337   5.749
    4    HB3  GLU  66           HB3      GLU  66 -21.577  10.036   5.535
    5    HG2  GLU  66           HG2      GLU  66 -21.817  10.417   7.899
    6    HG3  GLU  66           HG3      GLU  66 -22.319   8.743   8.136

  No H/Q in entry =           6
  In of MODEL   33
    1    H    ILE  67           H        ILE  67 -23.893   7.859   4.134
    2    HA   ILE  67           HA       ILE  67 -23.483   9.560   1.834
    3    HB   ILE  67           HB       ILE  67 -24.338   6.640   2.022
    4   HG12  ILE  67          HG12      ILE  67 -21.717   7.846   1.118
    5   HG13  ILE  67          HG13      ILE  67 -22.022   7.431   2.804
    6   HG21  ILE  67          HG21      ILE  67 -24.288   8.506  -0.213
    7   HG23  ILE  67          HG22      ILE  67 -24.888   6.849  -0.158
    8   HG22  ILE  67          HG23      ILE  67 -23.181   7.158  -0.473
    9   HD12  ILE  67          HD11      ILE  67 -21.551   5.652   0.469
   10   HD11  ILE  67          HD12      ILE  67 -22.570   5.072   1.786
   11   HD13  ILE  67          HD13      ILE  67 -20.907   5.565   2.108

  No H/Q in entry =          11
  In of MODEL   33
    1    H    GLN  68           H        GLN  68 -26.352   8.472   3.446
    2    HA   GLN  68           HA       GLN  68 -28.175   9.364   1.449
    3    HB2  GLN  68           HB2      GLN  68 -28.455   9.020   4.432
    4    HB3  GLN  68           HB3      GLN  68 -29.773   9.590   3.423
    5    HG2  GLN  68           HG2      GLN  68 -29.760   7.551   2.159
    6    HG3  GLN  68           HG3      GLN  68 -28.309   7.001   2.978
    7   HE21  GLN  68          HE21      GLN  68 -30.467   5.611   2.831
    8   HE22  GLN  68          HE22      GLN  68 -31.302   5.151   4.241

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ARG  69           H        ARG  69 -26.620  11.070   4.191
    2    HA   ARG  69           HA       ARG  69 -28.015  13.529   3.758
    3    HB2  ARG  69           HB2      ARG  69 -25.672  12.641   5.373
    4    HB3  ARG  69           HB3      ARG  69 -25.771  14.358   5.004
    5    HG2  ARG  69           HG2      ARG  69 -28.097  14.375   5.954
    6    HG3  ARG  69           HG3      ARG  69 -27.871  12.691   6.440
    7    HD2  ARG  69           HD2      ARG  69 -26.219  15.074   7.355
    8    HD3  ARG  69           HD3      ARG  69 -27.345  14.158   8.345
    9    HE   ARG  69           HE       ARG  69 -24.712  13.257   7.425
   10   HH21  ARG  69          HH11      ARG  69 -23.891  11.512   8.639
   11   HH22  ARG  69          HH12      ARG  69 -24.919  10.688   9.762
   12   HH11  ARG  69          HH21      ARG  69 -27.677  12.680   9.098
   13   HH12  ARG  69          HH22      ARG  69 -27.062  11.347  10.020

  No H/Q in entry =          13
  In of MODEL   33
    1    H    LEU  70           H        LEU  70 -25.113  12.154   2.433
    2    HA   LEU  70           HA       LEU  70 -24.020  14.527   1.261
    3    HB2  LEU  70           HB2      LEU  70 -23.001  12.226   1.879
    4    HB3  LEU  70           HB3      LEU  70 -23.594  11.743   0.290
    5    HG   LEU  70           HG       LEU  70 -22.009  13.130  -0.788
    6   HD11  LEU  70          HD11      LEU  70 -21.224  14.000   2.002
    7   HD13  LEU  70          HD12      LEU  70 -21.921  15.018   0.741
    8   HD12  LEU  70          HD13      LEU  70 -20.299  14.357   0.541
    9   HD22  LEU  70          HD21      LEU  70 -20.556  11.434  -0.532
   10   HD21  LEU  70          HD22      LEU  70 -21.488  10.908   0.870
   11   HD23  LEU  70          HD23      LEU  70 -20.119  11.998   1.080

  No H/Q in entry =          11
  In of MODEL   33
    1    H    LEU  71           H        LEU  71 -26.131  11.951   0.141
    2    HA   LEU  71           HA       LEU  71 -26.651  13.417  -2.389
    3    HB2  LEU  71           HB2      LEU  71 -26.824  10.433  -1.926
    4    HB3  LEU  71           HB3      LEU  71 -26.949  11.283  -3.466
    5    HG   LEU  71           HG       LEU  71 -24.445  11.335  -1.782
    6   HD12  LEU  71          HD11      LEU  71 -24.456   9.692  -4.206
    7   HD11  LEU  71          HD12      LEU  71 -25.471   9.065  -2.908
    8   HD13  LEU  71          HD13      LEU  71 -23.757   9.366  -2.619
    9   HD22  LEU  71          HD21      LEU  71 -24.556  13.141  -3.287
   10   HD21  LEU  71          HD22      LEU  71 -25.029  12.086  -4.618
   11   HD23  LEU  71          HD23      LEU  71 -23.411  11.961  -3.924

  No H/Q in entry =          11
  In of MODEL   33
    1    HA   PRO  72           HA       PRO  72 -30.535  12.940   0.201
    2    HB2  PRO  72           HB2      PRO  72 -31.419  15.489   0.096
    3    HB3  PRO  72           HB3      PRO  72 -30.115  15.059   1.202
    4    HG2  PRO  72           HG2      PRO  72 -29.918  16.239  -1.556
    5    HG3  PRO  72           HG3      PRO  72 -29.170  16.808  -0.064
    6    HD2  PRO  72           HD2      PRO  72 -27.801  15.253  -1.809
    7    HD3  PRO  72           HD3      PRO  72 -27.560  15.100  -0.069

  No H/Q in entry =           7
  In of MODEL   33
    1    H    ASN  73           H        ASN  73 -29.892  13.882  -3.015
    2    HA   ASN  73           HA       ASN  73 -32.744  13.541  -3.670
    3    HB2  ASN  73           HB2      ASN  73 -32.270  14.639  -5.770
    4    HB3  ASN  73           HB3      ASN  73 -31.770  15.633  -4.410
    5   HD21  ASN  73          HD21      ASN  73 -30.951  15.670  -7.080
    6   HD22  ASN  73          HD22      ASN  73 -29.280  15.525  -7.257

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LYS  74           H        LYS  74 -30.745  11.308  -3.215
    2    HA   LYS  74           HA       LYS  74 -31.276   9.892  -5.759
    3    HB2  LYS  74           HB2      LYS  74 -28.756   9.634  -4.113
    4    HB3  LYS  74           HB3      LYS  74 -29.118   8.809  -5.630
    5    HG2  LYS  74           HG2      LYS  74 -28.882  11.783  -5.443
    6    HG3  LYS  74           HG3      LYS  74 -27.495  10.731  -5.728
    7    HD2  LYS  74           HD2      LYS  74 -28.587   9.781  -7.676
    8    HD3  LYS  74           HD3      LYS  74 -30.018  10.767  -7.375
    9    HE2  LYS  74           HE2      LYS  74 -28.807  12.782  -7.818
   10    HE3  LYS  74           HE3      LYS  74 -27.277  11.906  -7.890
   11    HZ2  LYS  74           HZ1      LYS  74 -28.734  12.482 -10.033
   12    HZ1  LYS  74           HZ2      LYS  74 -29.378  10.957  -9.657
   13    HZ3  LYS  74           HZ3      LYS  74 -27.713  11.130  -9.939

  No H/Q in entry =          13
  In of MODEL   33
    1    HA   PRO  75           HA       PRO  75 -32.670   6.912  -2.783
    2    HB2  PRO  75           HB2      PRO  75 -32.946   4.682  -4.355
    3    HB3  PRO  75           HB3      PRO  75 -34.084   6.027  -4.442
    4    HG2  PRO  75           HG2      PRO  75 -31.725   5.440  -6.189
    5    HG3  PRO  75           HG3      PRO  75 -33.373   5.860  -6.654
    6    HD2  PRO  75           HD2      PRO  75 -31.448   7.742  -6.604
    7    HD3  PRO  75           HD3      PRO  75 -33.089   8.130  -6.083

  No H/Q in entry =           7
  In of MODEL   33
    1    H    VAL  76           H        VAL  76 -31.221   5.877  -1.391
    2    HA   VAL  76           HA       VAL  76 -28.736   4.683  -2.469
    3    HB   VAL  76           HB       VAL  76 -29.061   6.162   0.177
    4   HG11  VAL  76          HG11      VAL  76 -26.681   4.887  -1.184
    5   HG13  VAL  76          HG12      VAL  76 -27.388   4.440   0.370
    6   HG12  VAL  76          HG13      VAL  76 -26.553   5.984   0.192
    7   HG22  VAL  76          HG21      VAL  76 -28.401   8.064  -0.715
    8   HG21  VAL  76          HG22      VAL  76 -28.923   7.354  -2.243
    9   HG23  VAL  76          HG23      VAL  76 -27.225   7.284  -1.773

  No H/Q in entry =           9
  In of MODEL   33
    1    H    GLU  77           H        GLU  77 -28.506   2.534  -1.840
    2    HA   GLU  77           HA       GLU  77 -29.311   1.757   0.811
    3    HB2  GLU  77           HB2      GLU  77 -30.899   0.092   0.276
    4    HB3  GLU  77           HB3      GLU  77 -31.454   1.606  -0.440
    5    HG2  GLU  77           HG2      GLU  77 -30.818   0.841  -2.618
    6    HG3  GLU  77           HG3      GLU  77 -30.170  -0.648  -1.930

  No H/Q in entry =           6
  In of MODEL   33
    1    H    VAL  78           H        VAL  78 -28.972  -0.324   1.486
    2    HA   VAL  78           HA       VAL  78 -26.291  -1.077   0.628
    3    HB   VAL  78           HB       VAL  78 -28.014  -1.962   2.983
    4   HG11  VAL  78          HG11      VAL  78 -25.653  -3.177   1.887
    5   HG13  VAL  78          HG12      VAL  78 -26.570  -3.647   3.320
    6   HG12  VAL  78          HG13      VAL  78 -25.262  -2.473   3.456
    7   HG22  VAL  78          HG21      VAL  78 -26.579  -0.578   4.326
    8   HG21  VAL  78          HG22      VAL  78 -27.311   0.377   3.038
    9   HG23  VAL  78          HG23      VAL  78 -25.629  -0.136   2.908

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ILE  79           H        ILE  79 -25.729  -2.986  -0.260
    2    HA   ILE  79           HA       ILE  79 -27.764  -4.490  -1.618
    3    HB   ILE  79           HB       ILE  79 -24.771  -4.989  -1.366
    4   HG12  ILE  79          HG12      ILE  79 -26.395  -3.914  -3.676
    5   HG13  ILE  79          HG13      ILE  79 -25.541  -2.889  -2.521
    6   HG22  ILE  79          HG21      ILE  79 -25.840  -6.193  -3.687
    7   HG21  ILE  79          HG22      ILE  79 -26.833  -6.715  -2.326
    8   HG23  ILE  79          HG23      ILE  79 -25.089  -6.978  -2.297
    9   HD13  ILE  79          HD11      ILE  79 -24.109  -3.001  -4.325
   10   HD12  ILE  79          HD12      ILE  79 -24.431  -4.714  -4.598
   11   HD11  ILE  79          HD13      ILE  79 -23.464  -4.209  -3.212

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ASP  80           H        ASP  80 -28.617  -6.417  -1.031
    2    HA   ASP  80           HA       ASP  80 -28.580  -7.300   1.622
    3    HB2  ASP  80           HB2      ASP  80 -30.313  -7.903  -0.030
    4    HB3  ASP  80           HB3      ASP  80 -29.138  -8.905  -0.882

  No H/Q in entry =           4
  In of MODEL   33
    1    H    SER  81           H        SER  81 -27.045  -8.414   2.774
    2    HA   SER  81           HA       SER  81 -24.532  -9.082   1.610
    3    HB2  SER  81           HB2      SER  81 -23.993 -10.093   3.792
    4    HB3  SER  81           HB3      SER  81 -24.708  -8.493   3.987
    5    HG   SER  81           HG       SER  81 -25.552 -10.868   4.895

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU  82           H        LEU  82 -27.226 -11.195   1.920
    2    HA   LEU  82           HA       LEU  82 -25.653 -13.554   1.430
    3    HB2  LEU  82           HB2      LEU  82 -28.589 -13.097   0.950
    4    HB3  LEU  82           HB3      LEU  82 -27.770 -14.646   1.141
    5    HG   LEU  82           HG       LEU  82 -28.138 -12.590   3.300
    6   HD13  LEU  82          HD11      LEU  82 -30.263 -13.538   2.924
    7   HD12  LEU  82          HD12      LEU  82 -29.577 -14.534   4.210
    8   HD11  LEU  82          HD13      LEU  82 -29.584 -15.122   2.548
    9   HD21  LEU  82          HD21      LEU  82 -26.861 -15.319   3.154
   10   HD23  LEU  82          HD22      LEU  82 -27.341 -14.573   4.677
   11   HD22  LEU  82          HD23      LEU  82 -26.122 -13.800   3.665

  No H/Q in entry =          11
  In of MODEL   33
    1    H    LEU  83           H        LEU  83 -27.613 -11.358  -0.522
    2    HA   LEU  83           HA       LEU  83 -27.377 -12.730  -2.983
    3    HB2  LEU  83           HB2      LEU  83 -27.818  -9.823  -2.358
    4    HB3  LEU  83           HB3      LEU  83 -27.828 -10.478  -3.994
    5    HG   LEU  83           HG       LEU  83 -29.879 -10.869  -1.834
    6   HD13  LEU  83          HD11      LEU  83 -30.642  -9.035  -2.919
    7   HD12  LEU  83          HD12      LEU  83 -31.083 -10.161  -4.201
    8   HD11  LEU  83          HD13      LEU  83 -29.555  -9.282  -4.284
    9   HD23  LEU  83          HD21      LEU  83 -29.982 -12.146  -4.552
   10   HD22  LEU  83          HD22      LEU  83 -30.962 -12.495  -3.129
   11   HD21  LEU  83          HD23      LEU  83 -29.269 -12.984  -3.174

  No H/Q in entry =          11
  In of MODEL   33
    1    H    TYR  84           H        TYR  84 -25.460 -10.317  -1.304
    2    HA   TYR  84           HA       TYR  84 -23.582  -9.827  -3.420
    3    HB2  TYR  84           HB2      TYR  84 -24.111  -8.306  -1.453
    4    HB3  TYR  84           HB3      TYR  84 -23.162  -9.410  -0.460
    5    HD1  TYR  84           HD1      TYR  84 -20.730  -9.596  -0.772
    6    HD2  TYR  84           HD2      TYR  84 -23.042  -6.778  -2.996
    7    HE1  TYR  84           HE1      TYR  84 -18.653  -8.424  -1.422
    8    HE2  TYR  84           HE2      TYR  84 -20.974  -5.603  -3.663
    9    HH   TYR  84           HH       TYR  84 -18.016  -6.872  -3.513

  No H/Q in entry =           9
  In of MODEL   33
    1    H    GLY  85           H        GLY  85 -23.353 -11.807  -0.458
    2    HA3  GLY  85           HA2      GLY  85 -20.762 -12.732  -0.911
    3    HA2  GLY  85           HA3      GLY  85 -21.995 -13.582   0.022

  No H/Q in entry =           3
  In of MODEL   33
    1    H    LYS  86           H        LYS  86 -23.818 -13.986  -2.054
    2    HA   LYS  86           HA       LYS  86 -22.733 -16.359  -3.286
    3    HB2  LYS  86           HB2      LYS  86 -25.394 -14.955  -3.532
    4    HB3  LYS  86           HB3      LYS  86 -25.036 -16.581  -4.109
    5    HG2  LYS  86           HG2      LYS  86 -24.780 -15.903  -1.226
    6    HG3  LYS  86           HG3      LYS  86 -26.346 -16.293  -1.940
    7    HD2  LYS  86           HD2      LYS  86 -24.031 -18.046  -2.598
    8    HD3  LYS  86           HD3      LYS  86 -24.739 -18.188  -0.989
    9    HE2  LYS  86           HE2      LYS  86 -26.946 -18.553  -2.015
   10    HE3  LYS  86           HE3      LYS  86 -26.202 -18.469  -3.611
   11    HZ3  LYS  86           HZ1      LYS  86 -25.624 -20.588  -3.436
   12    HZ2  LYS  86           HZ2      LYS  86 -26.390 -20.683  -1.922
   13    HZ1  LYS  86           HZ3      LYS  86 -24.746 -20.270  -2.018

  No H/Q in entry =          13
  In of MODEL   33
    1    H    VAL  87           H        VAL  87 -22.741 -13.150  -4.203
    2    HA   VAL  87           HA       VAL  87 -22.434 -11.988  -6.149
    3    HB   VAL  87           HB       VAL  87 -21.161 -14.627  -7.001
    4   HG12  VAL  87          HG11      VAL  87 -20.026 -12.703  -8.576
    5   HG11  VAL  87          HG12      VAL  87 -21.689 -12.123  -8.482
    6   HG13  VAL  87          HG13      VAL  87 -21.352 -13.743  -9.094
    7   HG21  VAL  87          HG21      VAL  87 -19.989 -12.044  -5.992
    8   HG23  VAL  87          HG22      VAL  87 -19.050 -13.373  -6.666
    9   HG22  VAL  87          HG23      VAL  87 -19.973 -13.609  -5.182

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ASP  88           H        ASP  88 -24.947 -12.650  -5.816
    2    HA   ASP  88           HA       ASP  88 -26.036 -13.893  -8.215
    3    HB2  ASP  88           HB2      ASP  88 -27.051 -14.130  -5.898
    4    HB3  ASP  88           HB3      ASP  88 -27.517 -12.434  -6.013

  No H/Q in entry =           4
  In of MODEL   33
    1    H    GLY  89           H        GLY  89 -25.328 -12.641  -9.858
    2    HA3  GLY  89           HA2      GLY  89 -25.533  -9.871 -10.080
    3    HA2  GLY  89           HA3      GLY  89 -25.486 -11.001 -11.433

  No H/Q in entry =           3
  In of MODEL   33
    1    H    LEU  90           H        LEU  90 -27.924 -12.372 -10.996
    2    HA   LEU  90           HA       LEU  90 -29.743 -10.462 -12.140
    3    HB2  LEU  90           HB2      LEU  90 -29.781 -12.863 -12.703
    4    HB3  LEU  90           HB3      LEU  90 -30.298 -13.222 -11.056
    5    HG   LEU  90           HG       LEU  90 -32.424 -12.128 -11.446
    6   HD13  LEU  90          HD11      LEU  90 -32.248 -10.395 -12.932
    7   HD12  LEU  90          HD12      LEU  90 -32.766 -11.646 -14.065
    8   HD11  LEU  90          HD13      LEU  90 -31.056 -11.234 -13.929
    9   HD23  LEU  90          HD21      LEU  90 -32.317 -13.775 -13.869
   10   HD22  LEU  90          HD22      LEU  90 -33.308 -13.938 -12.419
   11   HD21  LEU  90          HD23      LEU  90 -31.648 -14.535 -12.425

  No H/Q in entry =          11
  In of MODEL   33
    1    H    GLY  91           H        GLY  91 -29.589 -11.939  -8.944
    2    HA3  GLY  91           HA2      GLY  91 -31.947 -10.841  -7.932
    3    HA2  GLY  91           HA3      GLY  91 -30.558 -11.354  -6.974

  No H/Q in entry =           3
  In of MODEL   33
    1    H    VAL  92           H        VAL  92 -28.650  -9.515  -7.827
    2    HA   VAL  92           HA       VAL  92 -29.477  -7.211  -6.301
    3    HB   VAL  92           HB       VAL  92 -26.912  -7.667  -7.872
    4   HG12  VAL  92          HG11      VAL  92 -27.116  -5.767  -5.561
    5   HG11  VAL  92          HG12      VAL  92 -27.772  -5.241  -7.113
    6   HG13  VAL  92          HG13      VAL  92 -26.073  -5.692  -6.983
    7   HG22  VAL  92          HG21      VAL  92 -26.688  -9.241  -6.266
    8   HG21  VAL  92          HG22      VAL  92 -27.850  -8.464  -5.189
    9   HG23  VAL  92          HG23      VAL  92 -26.201  -7.848  -5.300

  No H/Q in entry =           9
  In of MODEL   33
    1    H    LEU  93           H        LEU  93 -29.034  -7.893  -9.713
    2    HA   LEU  93           HA       LEU  93 -29.397  -5.269 -10.665
    3    HB2  LEU  93           HB2      LEU  93 -28.725  -7.127 -12.108
    4    HB3  LEU  93           HB3      LEU  93 -30.311  -7.868 -11.893
    5    HG   LEU  93           HG       LEU  93 -31.332  -5.924 -13.040
    6   HD11  LEU  93          HD11      LEU  93 -29.501  -4.306 -12.532
    7   HD13  LEU  93          HD12      LEU  93 -29.926  -4.354 -14.245
    8   HD12  LEU  93          HD13      LEU  93 -28.470  -5.170 -13.674
    9   HD23  LEU  93          HD21      LEU  93 -30.267  -6.497 -15.315
   10   HD22  LEU  93          HD22      LEU  93 -31.105  -7.755 -14.407
   11   HD21  LEU  93          HD23      LEU  93 -29.342  -7.683 -14.394

  No H/Q in entry =          11
  In of MODEL   33
    1    H    LYS  94           H        LYS  94 -31.754  -7.831  -9.818
    2    HA   LYS  94           HA       LYS  94 -34.107  -6.417 -10.473
    3    HB2  LYS  94           HB2      LYS  94 -33.589  -8.582  -8.440
    4    HB3  LYS  94           HB3      LYS  94 -35.191  -7.905  -8.727
    5    HG2  LYS  94           HG2      LYS  94 -35.077  -8.695 -11.054
    6    HG3  LYS  94           HG3      LYS  94 -33.512  -9.430 -10.708
    7    HD2  LYS  94           HD2      LYS  94 -34.634 -10.761  -8.883
    8    HD3  LYS  94           HD3      LYS  94 -36.180 -10.133  -9.456
    9    HE2  LYS  94           HE2      LYS  94 -35.635 -11.073 -11.711
   10    HE3  LYS  94           HE3      LYS  94 -34.219 -11.836 -10.990
   11    HZ3  LYS  94           HZ1      LYS  94 -36.053 -13.378 -11.164
   12    HZ2  LYS  94           HZ2      LYS  94 -37.045 -12.354 -10.238
   13    HZ1  LYS  94           HZ3      LYS  94 -35.683 -13.084  -9.534

  No H/Q in entry =          13
  In of MODEL   33
    1    H    ALA  95           H        ALA  95 -32.308  -6.497  -7.408
    2    HA   ALA  95           HA       ALA  95 -34.185  -4.926  -5.955
    3    HB2  ALA  95           HB1      ALA  95 -31.801  -6.274  -5.389
    4    HB3  ALA  95           HB2      ALA  95 -32.798  -5.370  -4.250
    5    HB1  ALA  95           HB3      ALA  95 -31.452  -4.575  -5.065

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA  96           H        ALA  96 -31.535  -4.061  -8.037
    2    HA   ALA  96           HA       ALA  96 -31.471  -1.294  -7.281
    3    HB2  ALA  96           HB1      ALA  96 -30.093  -1.069  -9.382
    4    HB3  ALA  96           HB2      ALA  96 -30.378  -2.782  -9.691
    5    HB1  ALA  96           HB3      ALA  96 -29.480  -2.283  -8.258

  No H/Q in entry =           5
  In of MODEL   33
    1    H    VAL  97           H        VAL  97 -32.964  -3.041  -9.969
    2    HA   VAL  97           HA       VAL  97 -34.044  -0.760 -11.250
    3    HB   VAL  97           HB       VAL  97 -34.827  -3.693 -11.278
    4   HG11  VAL  97          HG11      VAL  97 -36.633  -1.706 -11.793
    5   HG13  VAL  97          HG12      VAL  97 -36.672  -3.305 -12.538
    6   HG12  VAL  97          HG13      VAL  97 -35.923  -1.954 -13.389
    7   HG21  VAL  97          HG21      VAL  97 -33.547  -1.868 -13.315
    8   HG23  VAL  97          HG22      VAL  97 -33.983  -3.554 -13.597
    9   HG22  VAL  97          HG23      VAL  97 -32.748  -3.147 -12.403

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ALA  98           H        ALA  98 -35.229  -2.931  -8.708
    2    HA   ALA  98           HA       ALA  98 -37.802  -1.802  -8.385
    3    HB1  ALA  98           HB1      ALA  98 -36.779  -3.985  -7.329
    4    HB3  ALA  98           HB2      ALA  98 -37.975  -3.064  -6.414
    5    HB2  ALA  98           HB3      ALA  98 -36.259  -2.899  -6.042

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA  99           H        ALA  99 -34.743  -0.967  -6.719
    2    HA   ALA  99           HA       ALA  99 -35.902   1.019  -5.080
    3    HB1  ALA  99           HB1      ALA  99 -33.241   0.145  -5.800
    4    HB2  ALA  99           HB2      ALA  99 -33.809   0.900  -4.310
    5    HB3  ALA  99           HB3      ALA  99 -33.330   1.902  -5.680

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ILE 100           H        ILE 100 -34.834   1.135  -8.428
    2    HA   ILE 100           HA       ILE 100 -35.032   3.981  -8.667
    3    HB   ILE 100           HB       ILE 100 -35.094   1.812 -10.793
    4   HG12  ILE 100          HG12      ILE 100 -32.951   3.824 -10.116
    5   HG13  ILE 100          HG13      ILE 100 -32.981   2.181  -9.476
    6   HG21  ILE 100          HG21      ILE 100 -35.537   4.728 -10.946
    7   HG23  ILE 100          HG22      ILE 100 -36.024   3.448 -12.057
    8   HG22  ILE 100          HG23      ILE 100 -34.376   4.076 -12.103
    9   HD12  ILE 100          HD11      ILE 100 -32.433   3.124 -12.251
   10   HD11  ILE 100          HD12      ILE 100 -33.084   1.506 -11.992
   11   HD13  ILE 100          HD13      ILE 100 -31.546   1.965 -11.262

  No H/Q in entry =          11
  In of MODEL   33
    1    H    LYS 101           H        LYS 101 -37.302   1.351  -9.395
    2    HA   LYS 101           HA       LYS 101 -39.386   2.980 -10.423
    3    HB2  LYS 101           HB2      LYS 101 -39.260   0.213  -9.276
    4    HB3  LYS 101           HB3      LYS 101 -40.814   0.962  -9.640
    5    HG2  LYS 101           HG2      LYS 101 -40.322   1.085 -11.933
    6    HG3  LYS 101           HG3      LYS 101 -38.626   0.694 -11.663
    7    HD2  LYS 101           HD2      LYS 101 -39.855  -1.228 -12.546
    8    HD3  LYS 101           HD3      LYS 101 -39.239  -1.544 -10.924
    9    HE2  LYS 101           HE2      LYS 101 -41.301  -2.251 -10.431
   10    HE3  LYS 101           HE3      LYS 101 -41.769  -0.550 -10.448
   11    HZ3  LYS 101           HZ1      LYS 101 -42.642  -0.725 -12.572
   12    HZ2  LYS 101           HZ2      LYS 101 -43.100  -2.197 -11.859
   13    HZ1  LYS 101           HZ3      LYS 101 -41.785  -2.147 -12.932

  No H/Q in entry =          13
  In of MODEL   33
    1    H    LYS 102           H        LYS 102 -38.910   1.525  -7.201
    2    HA   LYS 102           HA       LYS 102 -41.176   2.711  -6.028
    3    HB2  LYS 102           HB2      LYS 102 -39.936   0.859  -4.992
    4    HB3  LYS 102           HB3      LYS 102 -38.554   1.927  -4.743
    5    HG2  LYS 102           HG2      LYS 102 -39.893   3.321  -3.266
    6    HG3  LYS 102           HG3      LYS 102 -41.278   2.258  -3.517
    7    HD2  LYS 102           HD2      LYS 102 -40.047   0.407  -2.469
    8    HD3  LYS 102           HD3      LYS 102 -38.663   1.471  -2.216
    9    HE2  LYS 102           HE2      LYS 102 -40.040   2.948  -0.828
   10    HE3  LYS 102           HE3      LYS 102 -41.442   1.915  -1.102
   11    HZ1  LYS 102           HZ1      LYS 102 -39.718   0.178  -0.074
   12    HZ3  LYS 102           HZ2      LYS 102 -40.842   1.061   0.841
   13    HZ2  LYS 102           HZ3      LYS 102 -39.234   1.596   0.725

  No H/Q in entry =          13
  In of MODEL   33
    1    H    ALA 103           H        ALA 103 -38.223   4.118  -7.025
    2    HA   ALA 103           HA       ALA 103 -38.477   6.441  -5.258
    3    HB2  ALA 103           HB1      ALA 103 -36.477   7.179  -6.820
    4    HB3  ALA 103           HB2      ALA 103 -36.426   5.460  -7.209
    5    HB1  ALA 103           HB3      ALA 103 -36.218   5.994  -5.541

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA 104           H        ALA 104 -39.064   5.686  -8.605
    2    HA   ALA 104           HA       ALA 104 -39.663   8.464  -9.248
    3    HB2  ALA 104           HB1      ALA 104 -39.683   7.783 -11.447
    4    HB1  ALA 104           HB2      ALA 104 -40.402   6.219 -11.066
    5    HB3  ALA 104           HB3      ALA 104 -38.684   6.495 -10.774

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA 105           H        ALA 105 -41.272   6.358  -7.446
    2    HA   ALA 105           HA       ALA 105 -43.706   7.735  -7.447
    3    HB2  ALA 105           HB1      ALA 105 -44.427   6.859  -9.488
    4    HB3  ALA 105           HB2      ALA 105 -45.065   5.672  -8.350
    5    HB1  ALA 105           HB3      ALA 105 -43.587   5.329  -9.244

  No H/Q in entry =           5
  In of MODEL   34
    1    H1   ALA   1           H3       ALA   1 -12.272 -15.600  -2.419
    2    H2   ALA   1           H2       ALA   1 -11.336 -16.747  -3.258
    3    H3   ALA   1           H1       ALA   1 -12.473 -15.796  -4.093
    4    HA   ALA   1           HA       ALA   1 -13.881 -17.489  -3.856
    5    HB3  ALA   1           HB1      ALA   1 -12.496 -19.268  -3.393
    6    HB1  ALA   1           HB2      ALA   1 -13.253 -19.152  -1.805
    7    HB2  ALA   1           HB3      ALA   1 -11.673 -18.420  -2.083

  No H/Q in entry =           7
  In of MODEL   34
    1    H    GLU   2           H        GLU   2 -15.511 -18.335  -2.204
    2    HA   GLU   2           HA       GLU   2 -17.151 -16.606  -1.147
    3    HB2  GLU   2           HB2      GLU   2 -16.227 -19.038   0.398
    4    HB3  GLU   2           HB3      GLU   2 -17.747 -18.179   0.651
    5    HG2  GLU   2           HG2      GLU   2 -18.730 -19.260  -1.086
    6    HG3  GLU   2           HG3      GLU   2 -17.404 -18.866  -2.168

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLU   3           H        GLU   3 -15.250 -17.971   1.478
    2    HA   GLU   3           HA       GLU   3 -15.461 -15.617   3.036
    3    HB2  GLU   3           HB2      GLU   3 -13.890 -18.173   3.288
    4    HB3  GLU   3           HB3      GLU   3 -13.653 -16.855   4.436
    5    HG2  GLU   3           HG2      GLU   3 -15.848 -16.995   5.251
    6    HG3  GLU   3           HG3      GLU   3 -16.445 -17.791   3.801

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LEU   4           H        LEU   4 -12.512 -17.112   1.649
    2    HA   LEU   4           HA       LEU   4 -10.668 -15.219   2.250
    3    HB2  LEU   4           HB2      LEU   4 -10.902 -16.514  -0.475
    4    HB3  LEU   4           HB3      LEU   4  -9.447 -15.802   0.212
    5    HG   LEU   4           HG       LEU   4 -10.956 -18.191   1.322
    6   HD13  LEU   4          HD11      LEU   4  -9.330 -19.555   0.394
    7   HD12  LEU   4          HD12      LEU   4  -8.113 -18.279   0.370
    8   HD11  LEU   4          HD13      LEU   4  -9.400 -18.293  -0.835
    9   HD23  LEU   4          HD21      LEU   4  -8.707 -18.268   2.707
   10   HD22  LEU   4          HD22      LEU   4 -10.023 -17.221   3.234
   11   HD21  LEU   4          HD23      LEU   4  -8.656 -16.539   2.354

  No H/Q in entry =          11
  In of MODEL   34
    1    H    GLU   5           H        GLU   5 -12.998 -14.998  -0.427
    2    HA   GLU   5           HA       GLU   5 -11.979 -12.519  -1.425
    3    HB2  GLU   5           HB2      GLU   5 -13.329 -14.092  -2.793
    4    HB3  GLU   5           HB3      GLU   5 -14.729 -13.733  -1.782
    5    HG2  GLU   5           HG2      GLU   5 -14.609 -11.366  -2.417
    6    HG3  GLU   5           HG3      GLU   5 -13.174 -11.688  -3.391

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLU   6           H        GLU   6 -14.713 -13.383   0.663
    2    HA   GLU   6           HA       GLU   6 -15.602 -10.702   1.062
    3    HB2  GLU   6           HB2      GLU   6 -17.027 -12.706   1.457
    4    HB3  GLU   6           HB3      GLU   6 -16.013 -13.122   2.838
    5    HG2  GLU   6           HG2      GLU   6 -17.926 -11.920   3.683
    6    HG3  GLU   6           HG3      GLU   6 -16.532 -10.846   3.795

  No H/Q in entry =           6
  In of MODEL   34
    1    H    VAL   7           H        VAL   7 -13.310 -12.826   2.636
    2    HA   VAL   7           HA       VAL   7 -12.838 -11.254   4.964
    3    HB   VAL   7           HB       VAL   7 -11.144 -13.307   3.517
    4   HG11  VAL   7          HG11      VAL   7 -10.671 -11.778   6.082
    5   HG13  VAL   7          HG12      VAL   7  -9.570 -11.998   4.723
    6   HG12  VAL   7          HG13      VAL   7  -9.932 -13.353   5.792
    7   HG21  VAL   7          HG21      VAL   7 -13.400 -13.859   4.733
    8   HG23  VAL   7          HG22      VAL   7 -12.473 -13.591   6.210
    9   HG22  VAL   7          HG23      VAL   7 -11.986 -14.853   5.081

  No H/Q in entry =           9
  In of MODEL   34
    1    H    VAL   8           H        VAL   8 -11.322 -11.376   1.757
    2    HA   VAL   8           HA       VAL   8  -9.250  -9.515   2.254
    3    HB   VAL   8           HB       VAL   8 -10.713 -10.199  -0.307
    4   HG11  VAL   8          HG11      VAL   8  -8.417  -8.349   0.289
    5   HG13  VAL   8          HG12      VAL   8  -9.771  -8.122  -0.820
    6   HG12  VAL   8          HG13      VAL   8  -8.458  -9.219  -1.246
    7   HG23  VAL   8          HG21      VAL   8  -7.873 -10.978   0.119
    8   HG22  VAL   8          HG22      VAL   8  -9.204 -11.913  -0.556
    9   HG21  VAL   8          HG23      VAL   8  -9.022 -11.783   1.190

  No H/Q in entry =           9
  In of MODEL   34
    1    H    MET   9           H        MET   9 -12.591  -9.106   1.088
    2    HA   MET   9           HA       MET   9 -12.511  -6.330   0.655
    3    HB2  MET   9           HB2      MET   9 -14.728  -8.206   1.460
    4    HB3  MET   9           HB3      MET   9 -15.011  -6.473   1.285
    5    HG2  MET   9           HG2      MET   9 -14.140  -6.576  -1.031
    6    HG3  MET   9           HG3      MET   9 -13.904  -8.315  -0.854
    7    HE3  MET   9           HE1      MET   9 -17.809  -5.950  -0.861
    8    HE2  MET   9           HE2      MET   9 -16.536  -5.615  -2.031
    9    HE1  MET   9           HE3      MET   9 -16.203  -5.452  -0.309

  No H/Q in entry =           9
  In of MODEL   34
    1    H    GLY  10           H        GLY  10 -13.189  -8.218   3.580
    2    HA3  GLY  10           HA2      GLY  10 -13.728  -6.031   5.299
    3    HA2  GLY  10           HA3      GLY  10 -13.174  -7.623   5.813

  No H/Q in entry =           3
  In of MODEL   34
    1    H    LEU  11           H        LEU  11 -10.727  -7.760   4.502
    2    HA   LEU  11           HA       LEU  11  -9.021  -6.336   6.263
    3    HB2  LEU  11           HB2      LEU  11  -8.478  -7.762   3.656
    4    HB3  LEU  11           HB3      LEU  11  -7.206  -7.064   4.657
    5    HG   LEU  11           HG       LEU  11  -9.220  -9.087   5.669
    6   HD13  LEU  11          HD11      LEU  11  -8.002 -10.330   4.106
    7   HD12  LEU  11          HD12      LEU  11  -7.071 -10.574   5.583
    8   HD11  LEU  11          HD13      LEU  11  -6.522  -9.411   4.377
    9   HD22  LEU  11          HD21      LEU  11  -8.365  -8.079   7.587
   10   HD21  LEU  11          HD22      LEU  11  -6.824  -7.685   6.827
   11   HD23  LEU  11          HD23      LEU  11  -7.159  -9.340   7.336

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  12           H        ILE  12  -9.915  -5.783   2.871
    2    HA   ILE  12           HA       ILE  12  -8.211  -3.562   2.448
    3    HB   ILE  12           HB       ILE  12 -10.866  -4.220   1.148
    4   HG12  ILE  12          HG12      ILE  12  -8.837  -5.881   1.075
    5   HG13  ILE  12          HG13      ILE  12  -9.693  -5.518  -0.409
    6   HG21  ILE  12          HG21      ILE  12  -8.625  -2.352   0.304
    7   HG23  ILE  12          HG22      ILE  12 -10.274  -1.892   0.712
    8   HG22  ILE  12          HG23      ILE  12  -9.948  -2.837  -0.711
    9   HD11  ILE  12          HD11      ILE  12  -7.173  -4.104   0.504
   10   HD13  ILE  12          HD12      ILE  12  -7.962  -3.964  -1.065
   11   HD12  ILE  12          HD13      ILE  12  -7.187  -5.462  -0.606

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  13           H        ILE  13 -11.575  -3.813   3.536
    2    HA   ILE  13           HA       ILE  13 -12.023  -1.024   3.805
    3    HB   ILE  13           HB       ILE  13 -13.241  -3.441   5.160
    4   HG12  ILE  13          HG12      ILE  13 -13.463  -2.894   2.628
    5   HG13  ILE  13          HG13      ILE  13 -14.896  -3.335   3.531
    6   HG22  ILE  13          HG21      ILE  13 -15.131  -1.787   5.722
    7   HG21  ILE  13          HG22      ILE  13 -13.955  -0.510   5.440
    8   HG23  ILE  13          HG23      ILE  13 -13.680  -1.694   6.716
    9   HD11  ILE  13          HD11      ILE  13 -14.167  -0.435   3.362
   10   HD13  ILE  13          HD12      ILE  13 -15.739  -1.195   3.521
   11   HD12  ILE  13          HD13      ILE  13 -14.928  -1.217   1.972

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ASN  14           H        ASN  14 -10.927  -3.520   6.081
    2    HA   ASN  14           HA       ASN  14 -10.723  -1.883   8.368
    3    HB2  ASN  14           HB2      ASN  14 -10.481  -4.492   8.046
    4    HB3  ASN  14           HB3      ASN  14  -8.770  -4.112   7.892
    5   HD21  ASN  14          HD21      ASN  14  -9.417  -5.634  10.066
    6   HD22  ASN  14          HD22      ASN  14  -9.388  -4.714  11.491

  No H/Q in entry =           6
  In of MODEL   34
    1    H    SER  15           H        SER  15  -8.320  -2.716   5.880
    2    HA   SER  15           HA       SER  15  -6.173  -1.232   6.957
    3    HB2  SER  15           HB2      SER  15  -5.148  -1.453   4.803
    4    HB3  SER  15           HB3      SER  15  -6.113  -2.908   5.022
    5    HG   SER  15           HG       SER  15  -7.276  -2.328   3.386

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLY  16           H        GLY  16  -8.767  -0.355   4.705
    2    HA3  GLY  16           HA2      GLY  16  -7.898   2.283   4.155
    3    HA2  GLY  16           HA3      GLY  16  -9.551   1.694   3.990

  No H/Q in entry =           3
  In of MODEL   34
    1    H    GLN  17           H        GLN  17 -10.101   0.970   6.639
    2    HA   GLN  17           HA       GLN  17 -10.802   3.477   7.778
    3    HB2  GLN  17           HB2      GLN  17 -12.062   1.431   8.277
    4    HB3  GLN  17           HB3      GLN  17 -10.653   0.749   9.091
    5    HG2  GLN  17           HG2      GLN  17 -10.700   2.555  10.743
    6    HG3  GLN  17           HG3      GLN  17 -12.056   3.310   9.908
    7   HE21  GLN  17          HE21      GLN  17 -12.243   2.452  12.650
    8   HE22  GLN  17          HE22      GLN  17 -13.354   1.169  12.720

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ALA  18           H        ALA  18  -8.182   1.187   8.403
    2    HA   ALA  18           HA       ALA  18  -7.085   2.400  10.675
    3    HB2  ALA  18           HB1      ALA  18  -6.479   0.182   9.309
    4    HB3  ALA  18           HB2      ALA  18  -5.316   0.962  10.382
    5    HB1  ALA  18           HB3      ALA  18  -5.234   1.240   8.641

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ARG  19           H        ARG  19  -6.305   2.922   7.228
    2    HA   ARG  19           HA       ARG  19  -4.403   4.964   7.661
    3    HB2  ARG  19           HB2      ARG  19  -4.729   3.824   5.465
    4    HB3  ARG  19           HB3      ARG  19  -6.269   4.669   5.285
    5    HG2  ARG  19           HG2      ARG  19  -5.135   6.837   5.356
    6    HG3  ARG  19           HG3      ARG  19  -3.588   6.048   5.663
    7    HD2  ARG  19           HD2      ARG  19  -3.707   6.639   3.319
    8    HD3  ARG  19           HD3      ARG  19  -3.797   4.879   3.465
    9    HE   ARG  19           HE       ARG  19  -6.428   5.794   3.452
   10   HH21  ARG  19          HH11      ARG  19  -7.619   5.954   1.531
   11   HH22  ARG  19          HH12      ARG  19  -6.794   6.029   0.013
   12   HH11  ARG  19          HH21      ARG  19  -3.649   5.851   1.424
   13   HH12  ARG  19          HH22      ARG  19  -4.544   5.969  -0.048

  No H/Q in entry =          13
  In of MODEL   34
    1    H    SER  20           H        SER  20  -7.899   5.087   7.054
    2    HA   SER  20           HA       SER  20  -8.250   7.843   7.004
    3    HB2  SER  20           HB2      SER  20 -10.129   6.506   6.464
    4    HB3  SER  20           HB3      SER  20 -10.026   5.614   7.980
    5    HG   SER  20           HG       SER  20 -10.998   8.182   7.450

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU  21           H        LEU  21  -8.261   5.661   9.809
    2    HA   LEU  21           HA       LEU  21  -8.702   7.658  11.773
    3    HB2  LEU  21           HB2      LEU  21  -7.347   4.957  11.941
    4    HB3  LEU  21           HB3      LEU  21  -7.675   5.974  13.342
    5    HG   LEU  21           HG       LEU  21  -9.821   5.068  11.400
    6   HD13  LEU  21          HD11      LEU  21  -8.921   3.084  12.440
    7   HD12  LEU  21          HD12      LEU  21 -10.438   3.468  13.253
    8   HD11  LEU  21          HD13      LEU  21  -8.899   3.863  14.023
    9   HD23  LEU  21          HD21      LEU  21 -11.188   5.561  13.606
   10   HD22  LEU  21          HD22      LEU  21 -10.723   6.911  12.576
   11   HD21  LEU  21          HD23      LEU  21  -9.800   6.560  14.030

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ALA  22           H        ALA  22  -5.749   6.279  10.372
    2    HA   ALA  22           HA       ALA  22  -3.870   7.590  11.998
    3    HB2  ALA  22           HB1      ALA  22  -3.454   5.735  10.308
    4    HB1  ALA  22           HB2      ALA  22  -2.256   7.029  10.345
    5    HB3  ALA  22           HB3      ALA  22  -3.471   6.987   9.067

  No H/Q in entry =           5
  In of MODEL   34
    1    H    TYR  23           H        TYR  23  -5.179   8.608   8.812
    2    HA   TYR  23           HA       TYR  23  -3.839  11.102   8.745
    3    HB2  TYR  23           HB2      TYR  23  -4.916  10.193   6.750
    4    HB3  TYR  23           HB3      TYR  23  -6.496  10.300   7.528
    5    HD1  TYR  23           HD1      TYR  23  -3.598  12.335   6.359
    6    HD2  TYR  23           HD2      TYR  23  -7.729  12.319   7.534
    7    HE1  TYR  23           HE1      TYR  23  -3.823  14.686   5.600
    8    HE2  TYR  23           HE2      TYR  23  -7.954  14.670   6.774
    9    HH   TYR  23           HH       TYR  23  -5.589  16.699   6.355

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ALA  24           H        ALA  24  -6.963  10.130  10.117
    2    HA   ALA  24           HA       ALA  24  -7.797  12.721  10.886
    3    HB1  ALA  24           HB1      ALA  24  -9.619  11.472  11.349
    4    HB2  ALA  24           HB2      ALA  24  -8.797  10.900  12.799
    5    HB3  ALA  24           HB3      ALA  24  -8.670   9.988  11.296

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA  25           H        ALA  25  -5.803  10.260  12.465
    2    HA   ALA  25           HA       ALA  25  -5.469  11.512  14.968
    3    HB2  ALA  25           HB1      ALA  25  -4.703   9.159  14.149
    4    HB3  ALA  25           HB2      ALA  25  -3.690  10.016  15.312
    5    HB1  ALA  25           HB3      ALA  25  -3.250   9.998  13.604

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU  26           H        LEU  26  -3.671  11.808  11.931
    2    HA   LEU  26           HA       LEU  26  -1.711  13.625  12.852
    3    HB2  LEU  26           HB2      LEU  26  -1.407  12.473  10.749
    4    HB3  LEU  26           HB3      LEU  26  -2.877  13.183  10.091
    5    HG   LEU  26           HG       LEU  26  -1.860  15.432  10.228
    6   HD12  LEU  26          HD11      LEU  26   0.678  15.448  10.648
    7   HD11  LEU  26          HD12      LEU  26   0.450  13.867  11.392
    8   HD13  LEU  26          HD13      LEU  26  -0.357  15.284  12.067
    9   HD21  LEU  26          HD21      LEU  26  -0.117  13.374   8.838
   10   HD23  LEU  26          HD22      LEU  26  -0.156  15.096   8.467
   11   HD22  LEU  26          HD23      LEU  26  -1.580  14.100   8.176

  No H/Q in entry =          11
  In of MODEL   34
    1    H    LYS  27           H        LYS  27  -4.889  14.113  11.367
    2    HA   LYS  27           HA       LYS  27  -4.829  16.902  11.169
    3    HB2  LYS  27           HB2      LYS  27  -6.573  15.427  10.179
    4    HB3  LYS  27           HB3      LYS  27  -7.234  15.172  11.794
    5    HG2  LYS  27           HG2      LYS  27  -7.660  17.579  12.029
    6    HG3  LYS  27           HG3      LYS  27  -6.947  17.875  10.439
    7    HD2  LYS  27           HD2      LYS  27  -8.680  16.443   9.399
    8    HD3  LYS  27           HD3      LYS  27  -9.398  16.165  10.987
    9    HE2  LYS  27           HE2      LYS  27  -9.837  18.577  11.229
   10    HE3  LYS  27           HE3      LYS  27  -9.090  18.877   9.656
   11    HZ3  LYS  27           HZ1      LYS  27 -11.467  18.757   9.409
   12    HZ2  LYS  27           HZ2      LYS  27 -11.520  17.240  10.178
   13    HZ1  LYS  27           HZ3      LYS  27 -10.771  17.402   8.659

  No H/Q in entry =          13
  In of MODEL   34
    1    H    GLN  28           H        GLN  28  -5.728  14.818  13.894
    2    HA   GLN  28           HA       GLN  28  -6.623  16.823  15.668
    3    HB2  GLN  28           HB2      GLN  28  -5.232  14.187  16.208
    4    HB3  GLN  28           HB3      GLN  28  -5.962  15.194  17.459
    5    HG2  GLN  28           HG2      GLN  28  -7.440  14.087  15.056
    6    HG3  GLN  28           HG3      GLN  28  -7.496  13.394  16.676
    7   HE21  GLN  28          HE21      GLN  28  -9.377  15.194  14.729
    8   HE22  GLN  28          HE22      GLN  28 -10.109  16.224  15.862

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ALA  29           H        ALA  29  -3.406  15.519  14.986
    2    HA   ALA  29           HA       ALA  29  -1.968  16.913  16.967
    3    HB1  ALA  29           HB1      ALA  29  -0.037  16.216  15.853
    4    HB3  ALA  29           HB2      ALA  29  -0.788  16.342  14.262
    5    HB2  ALA  29           HB3      ALA  29  -1.216  15.011  15.336

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LYS  30           H        LYS  30  -2.816  17.794  13.636
    2    HA   LYS  30           HA       LYS  30  -1.395  20.229  13.539
    3    HB2  LYS  30           HB2      LYS  30  -3.927  19.366  12.124
    4    HB3  LYS  30           HB3      LYS  30  -3.086  20.877  11.782
    5    HG2  LYS  30           HG2      LYS  30  -1.021  19.574  11.273
    6    HG3  LYS  30           HG3      LYS  30  -1.934  18.083  11.516
    7    HD2  LYS  30           HD2      LYS  30  -3.492  18.730   9.718
    8    HD3  LYS  30           HD3      LYS  30  -2.601  20.234   9.477
    9    HE2  LYS  30           HE2      LYS  30  -0.574  18.932   8.902
   10    HE3  LYS  30           HE3      LYS  30  -1.483  17.433   9.112
   11    HZ2  LYS  30           HZ1      LYS  30  -1.298  18.303   6.770
   12    HZ1  LYS  30           HZ2      LYS  30  -2.336  19.571   7.236
   13    HZ3  LYS  30           HZ3      LYS  30  -2.869  17.957   7.307

  No H/Q in entry =          13
  In of MODEL   34
    1    H    GLN  31           H        GLN  31  -4.503  19.393  14.944
    2    HA   GLN  31           HA       GLN  31  -5.252  22.153  15.395
    3    HB2  GLN  31           HB2      GLN  31  -6.448  19.714  16.715
    4    HB3  GLN  31           HB3      GLN  31  -7.198  21.290  16.468
    5    HG2  GLN  31           HG2      GLN  31  -6.487  20.509  13.880
    6    HG3  GLN  31           HG3      GLN  31  -7.022  19.007  14.626
    7   HE21  GLN  31          HE21      GLN  31  -8.419  20.590  12.522
    8   HE22  GLN  31          HE22      GLN  31  -9.932  20.990  13.177

  No H/Q in entry =           8
  In of MODEL   34
    1    H    GLY  32           H        GLY  32  -2.954  20.212  16.719
    2    HA3  GLY  32           HA2      GLY  32  -1.554  20.666  18.524
    3    HA2  GLY  32           HA3      GLY  32  -2.676  21.915  19.046

  No H/Q in entry =           3
  In of MODEL   34
    1    H    ASP  33           H        ASP  33  -4.116  18.885  18.381
    2    HA   ASP  33           HA       ASP  33  -4.535  18.428  21.260
    3    HB2  ASP  33           HB2      ASP  33  -5.943  17.427  18.779
    4    HB3  ASP  33           HB3      ASP  33  -6.295  16.818  20.395

  No H/Q in entry =           4
  In of MODEL   34
    1    H    PHE  34           H        PHE  34  -2.372  17.564  21.569
    2    HA   PHE  34           HA       PHE  34  -1.384  15.309  20.169
    3    HB2  PHE  34           HB2      PHE  34  -0.766  16.289  22.965
    4    HB3  PHE  34           HB3      PHE  34   0.157  15.060  22.099
    5    HD1  PHE  34           HD1      PHE  34   0.005  18.487  22.835
    6    HD2  PHE  34           HD2      PHE  34   0.824  15.780  19.600
    7    HE1  PHE  34           HE1      PHE  34   1.314  20.250  21.684
    8    HE2  PHE  34           HE2      PHE  34   2.128  17.546  18.454
    9    HZ   PHE  34           HZ       PHE  34   2.374  19.778  19.501

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ALA  35           H        ALA  35  -3.427  15.598  23.028
    2    HA   ALA  35           HA       ALA  35  -3.233  12.934  23.924
    3    HB3  ALA  35           HB1      ALA  35  -5.689  13.575  24.777
    4    HB1  ALA  35           HB2      ALA  35  -5.144  15.190  24.323
    5    HB2  ALA  35           HB3      ALA  35  -4.238  14.260  25.515

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA  36           H        ALA  36  -5.670  14.467  21.821
    2    HA   ALA  36           HA       ALA  36  -7.100  12.065  21.339
    3    HB1  ALA  36           HB1      ALA  36  -8.544  13.497  20.381
    4    HB3  ALA  36           HB2      ALA  36  -7.367  13.911  19.135
    5    HB2  ALA  36           HB3      ALA  36  -7.389  14.798  20.659

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA  37           H        ALA  37  -4.406  13.636  19.676
    2    HA   ALA  37           HA       ALA  37  -4.378  12.002  17.378
    3    HB3  ALA  37           HB1      ALA  37  -2.377  13.700  18.805
    4    HB2  ALA  37           HB2      ALA  37  -2.904  13.760  17.124
    5    HB1  ALA  37           HB3      ALA  37  -1.759  12.522  17.647

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LYS  38           H        LYS  38  -2.628  11.683  20.459
    2    HA   LYS  38           HA       LYS  38  -1.317   9.275  19.971
    3    HB2  LYS  38           HB2      LYS  38  -1.632  11.038  22.117
    4    HB3  LYS  38           HB3      LYS  38  -2.262   9.512  22.731
    5    HG2  LYS  38           HG2      LYS  38  -0.174   8.379  22.198
    6    HG3  LYS  38           HG3      LYS  38   0.445   9.821  21.386
    7    HD2  LYS  38           HD2      LYS  38   0.618  11.037  23.422
    8    HD3  LYS  38           HD3      LYS  38  -0.410   9.893  24.287
    9    HE2  LYS  38           HE2      LYS  38   1.942   9.561  24.910
   10    HE3  LYS  38           HE3      LYS  38   1.331   8.150  24.044
   11    HZ3  LYS  38           HZ1      LYS  38   2.637   8.561  22.265
   12    HZ2  LYS  38           HZ2      LYS  38   3.595   9.383  23.404
   13    HZ1  LYS  38           HZ3      LYS  38   2.523  10.250  22.411

  No H/Q in entry =          13
  In of MODEL   34
    1    H    ALA  39           H        ALA  39  -4.555   9.789  21.368
    2    HA   ALA  39           HA       ALA  39  -5.133   7.073  21.870
    3    HB3  ALA  39           HB1      ALA  39  -7.278   9.032  21.100
    4    HB2  ALA  39           HB2      ALA  39  -6.381   9.252  22.603
    5    HB1  ALA  39           HB3      ALA  39  -7.307   7.774  22.337

  No H/Q in entry =           5
  In of MODEL   34
    1    H    MET  40           H        MET  40  -5.700   9.092  19.024
    2    HA   MET  40           HA       MET  40  -7.186   7.170  17.559
    3    HB2  MET  40           HB2      MET  40  -5.560   9.556  16.659
    4    HB3  MET  40           HB3      MET  40  -6.590   8.604  15.586
    5    HG2  MET  40           HG2      MET  40  -7.621   9.857  18.144
    6    HG3  MET  40           HG3      MET  40  -7.670  10.694  16.593
    7    HE3  MET  40           HE1      MET  40 -10.260   9.091  14.524
    8    HE2  MET  40           HE2      MET  40  -8.507   9.198  14.379
    9    HE1  MET  40           HE3      MET  40  -9.417  10.568  15.011

  No H/Q in entry =           9
  In of MODEL   34
    1    H    MET  41           H        MET  41  -3.691   7.886  17.689
    2    HA   MET  41           HA       MET  41  -2.939   6.129  15.589
    3    HB2  MET  41           HB2      MET  41  -1.323   6.784  18.065
    4    HB3  MET  41           HB3      MET  41  -0.706   6.133  16.550
    5    HG2  MET  41           HG2      MET  41  -1.848   8.323  15.545
    6    HG3  MET  41           HG3      MET  41  -1.612   8.909  17.191
    7    HE2  MET  41           HE1      MET  41   1.293   6.793  17.556
    8    HE1  MET  41           HE2      MET  41   0.511   8.091  18.454
    9    HE3  MET  41           HE3      MET  41   2.137   8.325  17.814

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ASP  42           H        ASP  42  -3.333   5.655  19.074
    2    HA   ASP  42           HA       ASP  42  -2.312   3.055  19.234
    3    HB2  ASP  42           HB2      ASP  42  -3.179   4.819  21.056
    4    HB3  ASP  42           HB3      ASP  42  -4.612   3.802  20.980

  No H/Q in entry =           4
  In of MODEL   34
    1    H    GLN  43           H        GLN  43  -5.638   4.178  18.728
    2    HA   GLN  43           HA       GLN  43  -6.796   1.597  18.529
    3    HB2  GLN  43           HB2      GLN  43  -7.702   4.255  17.400
    4    HB3  GLN  43           HB3      GLN  43  -8.673   2.782  17.375
    5    HG2  GLN  43           HG2      GLN  43  -8.385   2.657  19.883
    6    HG3  GLN  43           HG3      GLN  43  -7.652   4.258  19.814
    7   HE21  GLN  43          HE21      GLN  43  -9.834   4.349  21.311
    8   HE22  GLN  43          HE22      GLN  43 -11.189   4.933  20.477

  No H/Q in entry =           8
  In of MODEL   34
    1    H    SER  44           H        SER  44  -5.439   3.806  16.122
    2    HA   SER  44           HA       SER  44  -6.144   2.327  13.830
    3    HB2  SER  44           HB2      SER  44  -4.875   4.703  14.278
    4    HB3  SER  44           HB3      SER  44  -3.525   3.700  13.750
    5    HG   SER  44           HG       SER  44  -4.629   4.679  11.985

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ARG  45           H        ARG  45  -3.271   2.196  15.916
    2    HA   ARG  45           HA       ARG  45  -1.799   0.235  14.535
    3    HB2  ARG  45           HB2      ARG  45  -0.953   1.650  16.407
    4    HB3  ARG  45           HB3      ARG  45  -1.952   0.724  17.524
    5    HG2  ARG  45           HG2      ARG  45  -0.730  -1.341  16.883
    6    HG3  ARG  45           HG3      ARG  45   0.293  -0.390  15.807
    7    HD2  ARG  45           HD2      ARG  45   1.031   0.985  17.765
    8    HD3  ARG  45           HD3      ARG  45   0.101  -0.086  18.837
    9    HE   ARG  45           HE       ARG  45   1.794  -1.690  17.258
   10   HH21  ARG  45          HH11      ARG  45   3.688  -2.524  18.099
   11   HH22  ARG  45          HH12      ARG  45   4.463  -1.743  19.432
   12   HH11  ARG  45          HH21      ARG  45   2.106   0.773  19.651
   13   HH12  ARG  45          HH22      ARG  45   3.567   0.126  20.308

  No H/Q in entry =          13
  In of MODEL   34
    1    H    MET  46           H        MET  46  -4.203  -0.074  17.130
    2    HA   MET  46           HA       MET  46  -4.052  -2.874  17.435
    3    HB2  MET  46           HB2      MET  46  -6.205  -0.852  18.037
    4    HB3  MET  46           HB3      MET  46  -6.434  -2.571  18.366
    5    HG2  MET  46           HG2      MET  46  -4.450  -2.597  19.793
    6    HG3  MET  46           HG3      MET  46  -4.119  -0.915  19.411
    7    HE3  MET  46           HE1      MET  46  -7.856  -2.580  20.498
    8    HE2  MET  46           HE2      MET  46  -7.173  -2.835  22.100
    9    HE1  MET  46           HE3      MET  46  -6.355  -3.495  20.688

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ALA  47           H        ALA  47  -6.056  -0.844  15.338
    2    HA   ALA  47           HA       ALA  47  -7.684  -2.884  14.267
    3    HB3  ALA  47           HB1      ALA  47  -8.349  -0.642  13.851
    4    HB1  ALA  47           HB2      ALA  47  -7.860  -1.277  12.280
    5    HB2  ALA  47           HB3      ALA  47  -6.776  -0.216  13.181

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU  48           H        LEU  48  -4.555  -1.594  13.224
    2    HA   LEU  48           HA       LEU  48  -4.278  -3.184  10.882
    3    HB2  LEU  48           HB2      LEU  48  -2.217  -1.920  12.696
    4    HB3  LEU  48           HB3      LEU  48  -1.850  -2.642  11.129
    5    HG   LEU  48           HG       LEU  48  -3.859  -0.412  11.516
    6   HD13  LEU  48          HD11      LEU  48  -1.733   0.450  12.187
    7   HD12  LEU  48          HD12      LEU  48  -2.000   1.007  10.536
    8   HD11  LEU  48          HD13      LEU  48  -0.912  -0.347  10.845
    9   HD22  LEU  48          HD21      LEU  48  -4.332  -1.391   9.439
   10   HD21  LEU  48          HD22      LEU  48  -2.652  -1.837   9.147
   11   HD23  LEU  48          HD23      LEU  48  -3.159  -0.154   8.988

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ASN  49           H        ASN  49  -3.243  -3.591  14.230
    2    HA   ASN  49           HA       ASN  49  -1.656  -5.865  13.901
    3    HB2  ASN  49           HB2      ASN  49  -1.690  -4.520  15.950
    4    HB3  ASN  49           HB3      ASN  49  -3.344  -5.020  16.274
    5   HD21  ASN  49          HD21      ASN  49  -1.293  -5.522  18.154
    6   HD22  ASN  49          HD22      ASN  49  -1.021  -7.195  18.234

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLU  50           H        GLU  50  -5.124  -5.565  14.565
    2    HA   GLU  50           HA       GLU  50  -5.657  -8.361  14.669
    3    HB2  GLU  50           HB2      GLU  50  -7.233  -6.663  15.544
    4    HB3  GLU  50           HB3      GLU  50  -7.518  -6.094  13.897
    5    HG2  GLU  50           HG2      GLU  50  -8.398  -8.283  13.254
    6    HG3  GLU  50           HG3      GLU  50  -8.025  -8.931  14.848

  No H/Q in entry =           6
  In of MODEL   34
    1    H    ALA  51           H        ALA  51  -5.701  -5.960  12.076
    2    HA   ALA  51           HA       ALA  51  -6.695  -7.677  10.050
    3    HB2  ALA  51           HB1      ALA  51  -6.457  -5.865   8.683
    4    HB1  ALA  51           HB2      ALA  51  -4.816  -5.530   9.236
    5    HB3  ALA  51           HB3      ALA  51  -6.198  -5.009  10.201

  No H/Q in entry =           5
  In of MODEL   34
    1    H    HIS  52           H        HIS  52  -3.399  -6.798  11.042
    2    HA   HIS  52           HA       HIS  52  -2.008  -8.297   9.095
    3    HB2  HIS  52           HB2      HIS  52  -0.981  -6.566  10.560
    4    HB3  HIS  52           HB3      HIS  52  -1.131  -7.673  11.924
    5    HD1  HIS  52           HD1      HIS  52   0.319  -9.877  11.839
    6    HD2  HIS  52           HD2      HIS  52   1.146  -7.140   8.804
    7    HE1  HIS  52           HE1      HIS  52   2.517 -10.594  10.805
    8    HE2  HIS  52           HE2      HIS  52   3.035  -8.936   8.954

  No H/Q in entry =           8
  In of MODEL   34
    1    H    LEU  53           H        LEU  53  -3.235  -9.167  12.303
    2    HA   LEU  53           HA       LEU  53  -2.060 -11.722  12.497
    3    HB2  LEU  53           HB2      LEU  53  -4.537 -10.520  13.707
    4    HB3  LEU  53           HB3      LEU  53  -4.094 -12.200  13.997
    5    HG   LEU  53           HG       LEU  53  -2.173  -9.901  14.481
    6   HD13  LEU  53          HD11      LEU  53  -3.958  -9.455  15.980
    7   HD12  LEU  53          HD12      LEU  53  -2.785 -10.364  16.933
    8   HD11  LEU  53          HD13      LEU  53  -4.220 -11.166  16.303
    9   HD21  LEU  53          HD21      LEU  53  -2.238 -12.839  15.198
   10   HD23  LEU  53          HD22      LEU  53  -1.293 -11.700  16.151
   11   HD22  LEU  53          HD23      LEU  53  -0.926 -11.934  14.452

  No H/Q in entry =          11
  In of MODEL   34
    1    H    VAL  54           H        VAL  54  -5.158 -10.664  11.128
    2    HA   VAL  54           HA       VAL  54  -6.094 -13.249  10.436
    3    HB   VAL  54           HB       VAL  54  -6.713 -10.509   9.303
    4   HG12  VAL  54          HG11      VAL  54  -8.825 -11.867   8.484
    5   HG11  VAL  54          HG12      VAL  54  -7.726 -13.243   8.558
    6   HG13  VAL  54          HG13      VAL  54  -7.351 -11.870   7.518
    7   HG22  VAL  54          HG21      VAL  54  -7.626 -10.541  11.452
    8   HG21  VAL  54          HG22      VAL  54  -7.896 -12.282  11.430
    9   HG23  VAL  54          HG23      VAL  54  -8.965 -11.214  10.522

  No H/Q in entry =           9
  In of MODEL   34
    1    H    GLN  55           H        GLN  55  -4.195 -10.813   8.654
    2    HA   GLN  55           HA       GLN  55  -4.073 -12.276   6.235
    3    HB2  GLN  55           HB2      GLN  55  -3.447 -10.017   6.050
    4    HB3  GLN  55           HB3      GLN  55  -2.341 -10.105   7.417
    5    HG2  GLN  55           HG2      GLN  55  -0.628 -10.966   6.144
    6    HG3  GLN  55           HG3      GLN  55  -1.708 -11.929   5.147
    7   HE21  GLN  55          HE21      GLN  55  -1.713 -11.237   3.026
    8   HE22  GLN  55          HE22      GLN  55  -1.499  -9.634   2.518

  No H/Q in entry =           8
  In of MODEL   34
    1    H    THR  56           H        THR  56  -1.974 -12.278   9.122
    2    HA   THR  56           HA       THR  56   0.091 -13.895   8.208
    3    HB   THR  56           HB       THR  56  -1.162 -14.133  10.952
    4    HG1  THR  56           HG1      THR  56  -0.202 -11.990   9.758
    5   HG23  THR  56          HG21      THR  56   0.943 -14.909  11.660
    6   HG22  THR  56          HG22      THR  56   1.756 -14.279  10.226
    7   HG21  THR  56          HG23      THR  56   0.722 -15.702  10.101

  No H/Q in entry =           7
  In of MODEL   34
    1    H    LYS  57           H        LYS  57  -3.042 -14.903   9.562
    2    HA   LYS  57           HA       LYS  57  -2.623 -17.703   9.314
    3    HB2  LYS  57           HB2      LYS  57  -4.434 -16.596  10.656
    4    HB3  LYS  57           HB3      LYS  57  -5.218 -16.137   9.152
    5    HG2  LYS  57           HG2      LYS  57  -5.479 -18.496   8.538
    6    HG3  LYS  57           HG3      LYS  57  -4.651 -18.988  10.014
    7    HD2  LYS  57           HD2      LYS  57  -6.437 -17.942  11.367
    8    HD3  LYS  57           HD3      LYS  57  -7.271 -17.454   9.891
    9    HE2  LYS  57           HE2      LYS  57  -8.268 -19.524  10.760
   10    HE3  LYS  57           HE3      LYS  57  -7.455 -19.867   9.235
   11    HZ3  LYS  57           HZ1      LYS  57  -5.676 -20.866  10.322
   12    HZ2  LYS  57           HZ2      LYS  57  -7.035 -21.428  11.172
   13    HZ1  LYS  57           HZ3      LYS  57  -6.076 -20.187  11.827

  No H/Q in entry =          13
  In of MODEL   34
    1    H    LEU  58           H        LEU  58  -3.924 -15.245   7.137
    2    HA   LEU  58           HA       LEU  58  -4.740 -17.060   5.127
    3    HB2  LEU  58           HB2      LEU  58  -4.103 -14.117   4.997
    4    HB3  LEU  58           HB3      LEU  58  -4.773 -15.046   3.654
    5    HG   LEU  58           HG       LEU  58  -6.058 -14.857   6.398
    6   HD11  LEU  58          HD11      LEU  58  -6.335 -13.204   3.908
    7   HD13  LEU  58          HD12      LEU  58  -6.324 -12.699   5.597
    8   HD12  LEU  58          HD13      LEU  58  -7.753 -13.477   4.921
    9   HD22  LEU  58          HD21      LEU  58  -7.037 -16.755   5.524
   10   HD21  LEU  58          HD22      LEU  58  -6.689 -16.305   3.855
   11   HD23  LEU  58          HD23      LEU  58  -8.047 -15.567   4.703

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  59           H        ILE  59  -1.594 -15.881   5.998
    2    HA   ILE  59           HA       ILE  59  -0.497 -16.617   3.363
    3    HB   ILE  59           HB       ILE  59   0.288 -14.562   4.941
    4   HG12  ILE  59          HG12      ILE  59   2.358 -16.230   3.497
    5   HG13  ILE  59          HG13      ILE  59   1.176 -15.264   2.651
    6   HG21  ILE  59          HG21      ILE  59   1.019 -16.343   6.696
    7   HG23  ILE  59          HG22      ILE  59   2.140 -15.052   6.325
    8   HG22  ILE  59          HG23      ILE  59   2.359 -16.652   5.617
    9   HD13  ILE  59          HD11      ILE  59   1.967 -13.233   3.707
   10   HD12  ILE  59          HD12      ILE  59   3.348 -14.069   3.003
   11   HD11  ILE  59          HD13      ILE  59   3.053 -14.158   4.740

  No H/Q in entry =          11
  In of MODEL   34
    1    H    GLU  60           H        GLU  60  -0.528 -17.726   6.730
    2    HA   GLU  60           HA       GLU  60   1.484 -19.724   6.469
    3    HB2  GLU  60           HB2      GLU  60   0.715 -18.929   8.657
    4    HB3  GLU  60           HB3      GLU  60  -0.891 -19.586   8.347
    5    HG2  GLU  60           HG2      GLU  60   0.076 -21.863   8.200
    6    HG3  GLU  60           HG3      GLU  60   1.674 -21.198   8.529

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLY  61           H        GLY  61  -2.026 -19.786   5.973
    2    HA3  GLY  61           HA2      GLY  61  -1.804 -22.581   5.013
    3    HA2  GLY  61           HA3      GLY  61  -3.283 -21.830   5.603

  No H/Q in entry =           3
  In of MODEL   34
    1    H    ASP  62           H        ASP  62  -1.030 -20.274   3.407
    2    HA   ASP  62           HA       ASP  62  -2.935 -19.384   1.603
    3    HB2  ASP  62           HB2      ASP  62  -1.036 -18.992   0.087
    4    HB3  ASP  62           HB3      ASP  62  -0.651 -18.505   1.735

  No H/Q in entry =           4
  In of MODEL   34
    1    H    ALA  63           H        ALA  63  -4.230 -20.415   0.176
    2    HA   ALA  63           HA       ALA  63  -3.204 -22.583  -1.475
    3    HB3  ALA  63           HB1      ALA  63  -5.532 -23.134   0.363
    4    HB2  ALA  63           HB2      ALA  63  -3.896 -23.750   0.599
    5    HB1  ALA  63           HB3      ALA  63  -4.826 -24.241  -0.817

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLY  64           H        GLY  64  -6.411 -23.086  -1.268
    2    HA3  GLY  64           HA2      GLY  64  -8.310 -22.191  -2.298
    3    HA2  GLY  64           HA3      GLY  64  -7.344 -20.840  -2.867

  No H/Q in entry =           3
  In of MODEL   34
    1    H    GLU  65           H        GLU  65  -5.530 -23.420  -3.693
    2    HA   GLU  65           HA       GLU  65  -7.018 -23.998  -6.162
    3    HB2  GLU  65           HB2      GLU  65  -4.188 -22.948  -6.054
    4    HB3  GLU  65           HB3      GLU  65  -4.953 -23.617  -7.496
    5    HG2  GLU  65           HG2      GLU  65  -6.029 -21.270  -5.908
    6    HG3  GLU  65           HG3      GLU  65  -5.111 -21.130  -7.405

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLY  66           H        GLY  66  -6.284 -25.754  -7.368
    2    HA3  GLY  66           HA2      GLY  66  -5.695 -28.080  -5.906
    3    HA2  GLY  66           HA3      GLY  66  -5.725 -27.940  -7.652

  No H/Q in entry =           3
  In of MODEL   34
    1    H    LYS  67           H        LYS  67  -3.643 -26.013  -7.867
    2    HA   LYS  67           HA       LYS  67  -1.372 -27.801  -7.629
    3    HB2  LYS  67           HB2      LYS  67  -1.795 -25.187  -9.068
    4    HB3  LYS  67           HB3      LYS  67  -0.261 -26.067  -9.071
    5    HG2  LYS  67           HG2      LYS  67  -1.397 -28.065  -9.958
    6    HG3  LYS  67           HG3      LYS  67  -2.934 -27.205  -9.946
    7    HD2  LYS  67           HD2      LYS  67  -2.002 -25.553 -11.546
    8    HD3  LYS  67           HD3      LYS  67  -0.495 -26.472 -11.590
    9    HE2  LYS  67           HE2      LYS  67  -3.202 -27.646 -12.283
   10    HE3  LYS  67           HE3      LYS  67  -2.072 -27.015 -13.480
   11    HZ1  LYS  67           HZ1      LYS  67  -0.410 -28.594 -12.382
   12    HZ3  LYS  67           HZ2      LYS  67  -1.593 -29.264 -13.399
   13    HZ2  LYS  67           HZ3      LYS  67  -1.768 -29.356 -11.712

  No H/Q in entry =          13
  In of MODEL   34
    1    H    MET  68           H        MET  68   0.762 -26.259  -7.564
    2    HA   MET  68           HA       MET  68   1.252 -25.838  -4.828
    3    HB2  MET  68           HB2      MET  68   2.809 -24.971  -7.265
    4    HB3  MET  68           HB3      MET  68   3.423 -24.928  -5.612
    5    HG2  MET  68           HG2      MET  68   2.406 -27.417  -7.014
    6    HG3  MET  68           HG3      MET  68   4.109 -26.997  -6.821
    7    HE3  MET  68           HE1      MET  68   5.116 -27.373  -3.443
    8    HE2  MET  68           HE2      MET  68   4.178 -25.881  -3.498
    9    HE1  MET  68           HE3      MET  68   5.138 -26.363  -4.895

  No H/Q in entry =           9
  In of MODEL   34
    1    H    LYS  69           H        LYS  69   0.522 -23.514  -7.410
    2    HA   LYS  69           HA       LYS  69   1.260 -21.139  -6.419
    3    HB2  LYS  69           HB2      LYS  69  -1.348 -21.792  -7.752
    4    HB3  LYS  69           HB3      LYS  69  -0.808 -20.141  -7.430
    5    HG2  LYS  69           HG2      LYS  69   1.259 -20.543  -8.684
    6    HG3  LYS  69           HG3      LYS  69   0.771 -22.211  -8.980
    7    HD2  LYS  69           HD2      LYS  69  -1.237 -21.386 -10.189
    8    HD3  LYS  69           HD3      LYS  69  -0.677 -19.730  -9.947
    9    HE2  LYS  69           HE2      LYS  69   0.947 -21.872 -11.347
   10    HE3  LYS  69           HE3      LYS  69  -0.054 -20.689 -12.190
   11    HZ1  LYS  69           HZ1      LYS  69   1.738 -19.564 -10.228
   12    HZ3  LYS  69           HZ2      LYS  69   1.411 -19.064 -11.818
   13    HZ2  LYS  69           HZ3      LYS  69   2.523 -20.315 -11.531

  No H/Q in entry =          13
  In of MODEL   34
    1    H    VAL  70           H        VAL  70  -0.357 -19.314  -5.644
    2    HA   VAL  70           HA       VAL  70  -1.686 -20.223  -3.153
    3    HB   VAL  70           HB       VAL  70  -0.832 -18.164  -2.065
    4   HG11  VAL  70          HG11      VAL  70   1.271 -19.966  -3.298
    5   HG13  VAL  70          HG12      VAL  70   0.437 -20.215  -1.763
    6   HG12  VAL  70          HG13      VAL  70   1.568 -18.874  -1.946
    7   HG23  VAL  70          HG21      VAL  70   1.234 -17.155  -3.436
    8   HG22  VAL  70          HG22      VAL  70  -0.404 -16.555  -3.686
    9   HG21  VAL  70          HG23      VAL  70   0.288 -17.715  -4.816

  No H/Q in entry =           9
  In of MODEL   34
    1    H    SER  71           H        SER  71  -3.134 -18.475  -2.280
    2    HA   SER  71           HA       SER  71  -5.110 -17.741  -4.160
    3    HB2  SER  71           HB2      SER  71  -5.481 -18.011  -1.675
    4    HB3  SER  71           HB3      SER  71  -4.625 -16.491  -1.433
    5    HG   SER  71           HG       SER  71  -6.744 -15.955  -1.589

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU  72           H        LEU  72  -5.239 -16.106  -5.495
    2    HA   LEU  72           HA       LEU  72  -3.113 -14.313  -5.971
    3    HB2  LEU  72           HB2      LEU  72  -5.947 -14.487  -6.951
    4    HB3  LEU  72           HB3      LEU  72  -4.896 -13.153  -7.418
    5    HG   LEU  72           HG       LEU  72  -4.134 -16.071  -7.768
    6   HD11  LEU  72          HD11      LEU  72  -6.160 -15.424  -9.102
    7   HD13  LEU  72          HD12      LEU  72  -4.766 -15.833 -10.103
    8   HD12  LEU  72          HD13      LEU  72  -5.205 -14.143  -9.849
    9   HD21  LEU  72          HD21      LEU  72  -2.932 -13.425  -8.536
   10   HD23  LEU  72          HD22      LEU  72  -2.673 -14.798  -9.599
   11   HD22  LEU  72          HD23      LEU  72  -2.131 -14.868  -7.924

  No H/Q in entry =          11
  In of MODEL   34
    1    H    VAL  73           H        VAL  73  -6.206 -13.930  -4.346
    2    HA   VAL  73           HA       VAL  73  -6.227 -11.159  -3.990
    3    HB   VAL  73           HB       VAL  73  -7.944 -11.507  -2.400
    4   HG11  VAL  73          HG11      VAL  73  -8.370 -12.262  -4.774
    5   HG13  VAL  73          HG12      VAL  73  -9.405 -13.025  -3.569
    6   HG12  VAL  73          HG13      VAL  73  -8.037 -13.910  -4.242
    7   HG22  VAL  73          HG21      VAL  73  -7.136 -12.967  -0.780
    8   HG21  VAL  73          HG22      VAL  73  -6.526 -14.116  -1.972
    9   HG23  VAL  73          HG23      VAL  73  -8.256 -14.023  -1.639

  No H/Q in entry =           9
  In of MODEL   34
    1    H    LEU  74           H        LEU  74  -4.313 -13.547  -2.407
    2    HA   LEU  74           HA       LEU  74  -3.896 -12.414   0.118
    3    HB2  LEU  74           HB2      LEU  74  -3.132 -14.639  -0.388
    4    HB3  LEU  74           HB3      LEU  74  -2.065 -14.031  -1.653
    5    HG   LEU  74           HG       LEU  74  -0.758 -12.798   0.044
    6   HD13  LEU  74          HD11      LEU  74  -2.321 -12.297   1.759
    7   HD12  LEU  74          HD12      LEU  74  -1.268 -13.517   2.478
    8   HD11  LEU  74          HD13      LEU  74  -2.859 -13.973   1.869
    9   HD23  LEU  74          HD21      LEU  74  -0.984 -15.543   1.152
   10   HD22  LEU  74          HD22      LEU  74   0.422 -14.640   0.633
   11   HD21  LEU  74          HD23      LEU  74  -0.612 -15.386  -0.564

  No H/Q in entry =          11
  In of MODEL   34
    1    H    VAL  75           H        VAL  75  -1.997 -12.032  -2.835
    2    HA   VAL  75           HA       VAL  75  -0.183 -10.126  -1.819
    3    HB   VAL  75           HB       VAL  75  -1.139 -10.599  -4.644
    4   HG11  VAL  75          HG11      VAL  75   1.142  -8.889  -3.558
    5   HG13  VAL  75          HG12      VAL  75  -0.264  -8.318  -4.445
    6   HG12  VAL  75          HG13      VAL  75   0.937  -9.314  -5.253
    7   HG22  VAL  75          HG21      VAL  75   0.989 -11.799  -4.843
    8   HG21  VAL  75          HG22      VAL  75   0.068 -12.465  -3.495
    9   HG23  VAL  75          HG23      VAL  75   1.416 -11.370  -3.186

  No H/Q in entry =           9
  In of MODEL   34
    1    H    GLU  76           H        GLU  76  -3.328  -9.748  -3.481
    2    HA   GLU  76           HA       GLU  76  -3.354  -6.933  -3.577
    3    HB2  GLU  76           HB2      GLU  76  -5.026  -8.338  -4.751
    4    HB3  GLU  76           HB3      GLU  76  -5.676  -8.861  -3.205
    5    HG2  GLU  76           HG2      GLU  76  -7.131  -7.134  -4.045
    6    HG3  GLU  76           HG3      GLU  76  -6.240  -6.439  -2.705

  No H/Q in entry =           6
  In of MODEL   34
    1    H    ALA  77           H        ALA  77  -4.489  -9.155  -1.043
    2    HA   ALA  77           HA       ALA  77  -5.430  -7.148   0.718
    3    HB1  ALA  77           HB1      ALA  77  -4.349  -9.897   1.386
    4    HB2  ALA  77           HB2      ALA  77  -6.019  -9.529   0.960
    5    HB3  ALA  77           HB3      ALA  77  -5.328  -8.884   2.447

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLN  78           H        GLN  78  -2.296  -8.725   0.355
    2    HA   GLN  78           HA       GLN  78  -1.031  -7.581   2.609
    3    HB2  GLN  78           HB2      GLN  78  -0.225  -9.528   1.164
    4    HB3  GLN  78           HB3      GLN  78   0.329  -8.318   0.010
    5    HG2  GLN  78           HG2      GLN  78   1.806  -7.339   1.650
    6    HG3  GLN  78           HG3      GLN  78   1.153  -8.366   2.923
    7   HE21  GLN  78          HE21      GLN  78   1.202 -10.893   2.021
    8   HE22  GLN  78          HE22      GLN  78   2.737 -11.349   1.456

  No H/Q in entry =           8
  In of MODEL   34
    1    H    LEU  79           H        LEU  79  -1.383  -6.510  -0.737
    2    HA   LEU  79           HA       LEU  79   0.325  -4.300  -0.717
    3    HB2  LEU  79           HB2      LEU  79  -0.707  -5.093  -2.773
    4    HB3  LEU  79           HB3      LEU  79  -2.307  -4.687  -2.167
    5    HG   LEU  79           HG       LEU  79  -1.740  -2.305  -2.136
    6   HD13  LEU  79          HD11      LEU  79   0.502  -2.084  -1.620
    7   HD12  LEU  79          HD12      LEU  79   0.557  -1.795  -3.358
    8   HD11  LEU  79          HD13      LEU  79   0.994  -3.378  -2.714
    9   HD23  LEU  79          HD21      LEU  79  -1.100  -2.108  -4.687
   10   HD22  LEU  79          HD22      LEU  79  -2.634  -2.842  -4.231
   11   HD21  LEU  79          HD23      LEU  79  -1.271  -3.863  -4.676

  No H/Q in entry =          11
  In of MODEL   34
    1    H    HIS  80           H        HIS  80  -3.145  -4.429   0.104
    2    HA   HIS  80           HA       HIS  80  -3.309  -1.672   0.772
    3    HB2  HIS  80           HB2      HIS  80  -5.035  -4.064   1.084
    4    HB3  HIS  80           HB3      HIS  80  -5.344  -2.723   2.190
    5    HD1  HIS  80           HD1      HIS  80  -6.943  -1.068   1.283
    6    HD2  HIS  80           HD2      HIS  80  -4.764  -2.897  -1.765
    7    HE1  HIS  80           HE1      HIS  80  -7.770  -0.058  -0.896
    8    HE2  HIS  80           HE2      HIS  80  -6.448  -1.168  -2.763

  No H/Q in entry =           8
  In of MODEL   34
    1    H    LEU  81           H        LEU  81  -2.853  -4.575   2.761
    2    HA   LEU  81           HA       LEU  81  -2.830  -3.232   5.247
    3    HB2  LEU  81           HB2      LEU  81  -1.638  -5.860   4.365
    4    HB3  LEU  81           HB3      LEU  81  -1.609  -5.304   6.040
    5    HG   LEU  81           HG       LEU  81  -4.154  -5.527   4.408
    6   HD12  LEU  81          HD11      LEU  81  -4.481  -7.592   5.951
    7   HD11  LEU  81          HD12      LEU  81  -2.729  -7.540   6.140
    8   HD13  LEU  81          HD13      LEU  81  -3.437  -7.760   4.539
    9   HD23  LEU  81          HD21      LEU  81  -5.003  -5.726   6.907
   10   HD22  LEU  81          HD22      LEU  81  -4.661  -4.139   6.221
   11   HD21  LEU  81          HD23      LEU  81  -3.484  -4.914   7.281

  No H/Q in entry =          11
  In of MODEL   34
    1    H    MET  82           H        MET  82  -0.156  -4.161   3.079
    2    HA   MET  82           HA       MET  82   1.934  -3.292   4.767
    3    HB2  MET  82           HB2      MET  82   1.720  -3.626   1.774
    4    HB3  MET  82           HB3      MET  82   3.207  -3.073   2.541
    5    HG2  MET  82           HG2      MET  82   1.771  -5.648   3.259
    6    HG3  MET  82           HG3      MET  82   3.145  -5.551   2.161
    7    HE3  MET  82           HE1      MET  82   6.166  -4.852   4.150
    8    HE2  MET  82           HE2      MET  82   5.259  -3.473   3.533
    9    HE1  MET  82           HE3      MET  82   5.332  -4.963   2.595

  No H/Q in entry =           9
  In of MODEL   34
    1    H    THR  83           H        THR  83   0.134  -1.626   2.211
    2    HA   THR  83           HA       THR  83   1.573   0.807   2.303
    3    HB   THR  83           HB       THR  83  -0.591   1.757   1.316
    4    HG1  THR  83           HG1      THR  83  -2.256   0.479   1.204
    5   HG22  THR  83          HG21      THR  83  -0.338  -0.060  -0.687
    6   HG21  THR  83          HG22      THR  83   1.157  -0.371   0.191
    7   HG23  THR  83          HG23      THR  83   0.815   1.247  -0.422

  No H/Q in entry =           7
  In of MODEL   34
    1    H    SER  84           H        SER  84  -1.447  -0.195   3.899
    2    HA   SER  84           HA       SER  84  -1.917   2.239   5.247
    3    HB2  SER  84           HB2      SER  84  -2.783  -0.590   5.805
    4    HB3  SER  84           HB3      SER  84  -3.262   0.754   6.840
    5    HG   SER  84           HG       SER  84  -3.721   0.450   4.047

  No H/Q in entry =           5
  In of MODEL   34
    1    H    MET  85           H        MET  85  -0.242  -0.714   6.374
    2    HA   MET  85           HA       MET  85   0.284   0.202   8.980
    3    HB2  MET  85           HB2      MET  85   0.551  -2.144   8.297
    4    HB3  MET  85           HB3      MET  85   1.941  -1.694   7.308
    5    HG2  MET  85           HG2      MET  85   3.120  -0.879   9.311
    6    HG3  MET  85           HG3      MET  85   1.723  -1.288  10.307
    7    HE2  MET  85           HE1      MET  85   2.062  -4.761  11.257
    8    HE1  MET  85           HE2      MET  85   0.970  -3.398  11.019
    9    HE3  MET  85           HE3      MET  85   2.454  -3.180  11.940

  No H/Q in entry =           9
  In of MODEL   34
    1    H    LEU  86           H        LEU  86   2.226   0.440   6.032
    2    HA   LEU  86           HA       LEU  86   4.454   1.723   7.192
    3    HB2  LEU  86           HB2      LEU  86   4.253   0.646   4.882
    4    HB3  LEU  86           HB3      LEU  86   3.463   2.138   4.371
    5    HG   LEU  86           HG       LEU  86   5.504   3.359   5.355
    6   HD11  LEU  86          HD11      LEU  86   6.177   0.738   6.152
    7   HD13  LEU  86          HD12      LEU  86   7.198   2.171   6.253
    8   HD12  LEU  86          HD13      LEU  86   7.296   1.123   4.840
    9   HD23  LEU  86          HD21      LEU  86   6.203   1.591   3.003
   10   HD22  LEU  86          HD22      LEU  86   6.616   3.283   3.268
   11   HD21  LEU  86          HD23      LEU  86   4.959   2.835   2.867

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ALA  87           H        ALA  87   1.558   3.003   5.606
    2    HA   ALA  87           HA       ALA  87   2.184   5.725   5.694
    3    HB1  ALA  87           HB1      ALA  87  -0.143   4.126   5.148
    4    HB3  ALA  87           HB2      ALA  87   0.188   5.783   4.651
    5    HB2  ALA  87           HB3      ALA  87  -0.612   5.469   6.193

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ARG  88           H        ARG  88   0.468   3.741   8.080
    2    HA   ARG  88           HA       ARG  88  -0.022   5.793   9.929
    3    HB2  ARG  88           HB2      ARG  88  -0.988   3.452   9.990
    4    HB3  ARG  88           HB3      ARG  88   0.546   2.933  10.698
    5    HG2  ARG  88           HG2      ARG  88   0.092   5.010  12.320
    6    HG3  ARG  88           HG3      ARG  88  -1.578   4.706  11.861
    7    HD2  ARG  88           HD2      ARG  88  -1.709   2.856  13.105
    8    HD3  ARG  88           HD3      ARG  88  -0.126   2.256  12.575
    9    HE   ARG  88           HE       ARG  88  -0.648   3.523  15.030
   10   HH21  ARG  88          HH11      ARG  88   0.920   4.515  16.272
   11   HH22  ARG  88          HH12      ARG  88   2.446   4.925  15.570
   12   HH11  ARG  88          HH21      ARG  88   1.638   3.681  12.457
   13   HH12  ARG  88          HH22      ARG  88   2.860   4.436  13.422

  No H/Q in entry =          13
  In of MODEL   34
    1    H    GLU  89           H        GLU  89   2.749   3.542   9.706
    2    HA   GLU  89           HA       GLU  89   4.017   4.413  12.053
    3    HB2  GLU  89           HB2      GLU  89   4.655   2.389  10.707
    4    HB3  GLU  89           HB3      GLU  89   5.444   3.476   9.563
    5    HG2  GLU  89           HG2      GLU  89   6.937   4.303  11.310
    6    HG3  GLU  89           HG3      GLU  89   6.090   3.355  12.528

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LEU  90           H        LEU  90   4.352   5.572   8.727
    2    HA   LEU  90           HA       LEU  90   6.304   7.550   9.317
    3    HB2  LEU  90           HB2      LEU  90   4.297   7.243   7.087
    4    HB3  LEU  90           HB3      LEU  90   5.542   8.500   7.111
    5    HG   LEU  90           HG       LEU  90   6.182   5.556   7.442
    6   HD12  LEU  90          HD11      LEU  90   6.937   5.784   5.004
    7   HD11  LEU  90          HD12      LEU  90   5.937   7.236   4.956
    8   HD13  LEU  90          HD13      LEU  90   5.200   5.671   5.296
    9   HD22  LEU  90          HD21      LEU  90   8.091   6.684   8.128
   10   HD21  LEU  90          HD22      LEU  90   7.758   8.094   7.123
   11   HD23  LEU  90          HD23      LEU  90   8.403   6.623   6.395

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  91           H        ILE  91   2.766   7.604   9.164
    2    HA   ILE  91           HA       ILE  91   2.453  10.380   9.617
    3    HB   ILE  91           HB       ILE  91   0.635   8.023  10.155
    4   HG12  ILE  91          HG12      ILE  91   0.414  10.309   8.172
    5   HG13  ILE  91          HG13      ILE  91   1.259   8.806   7.799
    6   HG22  ILE  91          HG21      ILE  91  -1.075  10.099  10.218
    7   HG21  ILE  91          HG22      ILE  91   0.334  10.914  10.894
    8   HG23  ILE  91          HG23      ILE  91  -0.319   9.483  11.688
    9   HD13  ILE  91          HD11      ILE  91  -0.699   7.539   7.840
   10   HD12  ILE  91          HD12      ILE  91  -1.271   9.061   7.159
   11   HD11  ILE  91          HD13      ILE  91  -1.549   8.698   8.863

  No H/Q in entry =          11
  In of MODEL   34
    1    H    THR  92           H        THR  92   2.824   7.632  11.816
    2    HA   THR  92           HA       THR  92   2.391   9.007  14.241
    3    HB   THR  92           HB       THR  92   4.176   6.654  13.576
    4    HG1  THR  92           HG1      THR  92   2.200   5.918  13.471
    5   HG22  THR  92          HG21      THR  92   3.786   6.371  16.209
    6   HG21  THR  92          HG22      THR  92   3.740   8.131  16.137
    7   HG23  THR  92          HG23      THR  92   5.165   7.261  15.566

  No H/Q in entry =           7
  In of MODEL   34
    1    H    GLU  93           H        GLU  93   5.340   8.530  12.311
    2    HA   GLU  93           HA       GLU  93   7.106   9.938  14.012
    3    HB2  GLU  93           HB2      GLU  93   7.196   9.625  10.997
    4    HB3  GLU  93           HB3      GLU  93   8.540  10.141  12.014
    5    HG2  GLU  93           HG2      GLU  93   7.104   7.518  12.457
    6    HG3  GLU  93           HG3      GLU  93   8.490   7.657  11.383

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LEU  94           H        LEU  94   5.072  10.975  11.297
    2    HA   LEU  94           HA       LEU  94   5.903  13.672  11.201
    3    HB2  LEU  94           HB2      LEU  94   3.301  12.332  10.441
    4    HB3  LEU  94           HB3      LEU  94   3.576  14.057  10.202
    5    HG   LEU  94           HG       LEU  94   5.576  12.051   9.153
    6   HD11  LEU  94          HD11      LEU  94   2.841  12.629   8.087
    7   HD13  LEU  94          HD12      LEU  94   3.811  11.163   7.962
    8   HD12  LEU  94          HD13      LEU  94   4.161  12.541   6.919
    9   HD23  LEU  94          HD21      LEU  94   5.846  13.886   7.433
   10   HD22  LEU  94          HD22      LEU  94   6.263  14.374   9.076
   11   HD21  LEU  94          HD23      LEU  94   4.718  14.857   8.375

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  95           H        ILE  95   3.347  12.077  13.086
    2    HA   ILE  95           HA       ILE  95   2.324  14.435  14.282
    3    HB   ILE  95           HB       ILE  95   2.313  11.552  15.204
    4   HG12  ILE  95          HG12      ILE  95   0.110  13.347  14.152
    5   HG13  ILE  95          HG13      ILE  95   1.059  12.280  13.121
    6   HG21  ILE  95          HG21      ILE  95   1.051  14.035  16.405
    7   HG23  ILE  95          HG22      ILE  95   2.087  12.856  17.211
    8   HG22  ILE  95          HG23      ILE  95   0.449  12.410  16.732
    9   HD13  ILE  95          HD11      ILE  95   0.137  10.349  14.037
   10   HD12  ILE  95          HD12      ILE  95  -1.236  11.451  14.111
   11   HD11  ILE  95          HD13      ILE  95  -0.276  11.142  15.558

  No H/Q in entry =          11
  In of MODEL   34
    1    H    GLU  96           H        GLU  96   4.897  12.192  15.280
    2    HA   GLU  96           HA       GLU  96   5.458  13.384  17.774
    3    HB2  GLU  96           HB2      GLU  96   6.388  11.217  17.126
    4    HB3  GLU  96           HB3      GLU  96   7.331  11.983  15.849
    5    HG2  GLU  96           HG2      GLU  96   8.981  12.516  17.314
    6    HG3  GLU  96           HG3      GLU  96   7.840  13.339  18.368

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LEU  97           H        LEU  97   6.545  14.149  14.491
    2    HA   LEU  97           HA       LEU  97   8.447  16.129  15.208
    3    HB2  LEU  97           HB2      LEU  97   6.855  15.595  12.709
    4    HB3  LEU  97           HB3      LEU  97   7.887  17.018  12.834
    5    HG   LEU  97           HG       LEU  97   8.891  14.212  13.393
    6   HD12  LEU  97          HD11      LEU  97   9.894  14.399  11.078
    7   HD11  LEU  97          HD12      LEU  97   8.854  15.799  10.814
    8   HD13  LEU  97          HD13      LEU  97   8.141  14.212  11.106
    9   HD23  LEU  97          HD21      LEU  97  11.072  15.473  12.656
   10   HD22  LEU  97          HD22      LEU  97  10.452  15.746  14.284
   11   HD21  LEU  97          HD23      LEU  97  10.150  16.933  13.016

  No H/Q in entry =          11
  In of MODEL   34
    1    H    HIS  98           H        HIS  98   4.958  16.293  14.547
    2    HA   HIS  98           HA       HIS  98   4.681  19.095  14.684
    3    HB2  HIS  98           HB2      HIS  98   2.772  16.860  15.404
    4    HB3  HIS  98           HB3      HIS  98   2.318  18.564  15.461
    5    HD1  HIS  98           HD1      HIS  98   3.322  15.842  13.055
    6    HD2  HIS  98           HD2      HIS  98   1.978  19.787  12.934
    7    HE1  HIS  98           HE1      HIS  98   2.771  16.338  10.631
    8    HE2  HIS  98           HE2      HIS  98   1.956  18.734  10.536

  No H/Q in entry =           8
  In of MODEL   34
    1    H    GLU  99           H        GLU  99   4.789  16.604  17.181
    2    HA   GLU  99           HA       GLU  99   4.191  18.301  19.379
    3    HB2  GLU  99           HB2      GLU  99   4.082  15.820  19.474
    4    HB3  GLU  99           HB3      GLU  99   5.842  15.761  19.369
    5    HG2  GLU  99           HG2      GLU  99   6.037  17.050  21.445
    6    HG3  GLU  99           HG3      GLU  99   4.285  17.204  21.537

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LYS 100           H        LYS 100   7.240  17.347  17.819
    2    HA   LYS 100           HA       LYS 100   8.902  18.733  19.680
    3    HB2  LYS 100           HB2      LYS 100   9.399  17.807  16.842
    4    HB3  LYS 100           HB3      LYS 100  10.633  18.566  17.853
    5    HG2  LYS 100           HG2      LYS 100  10.240  16.817  19.592
    6    HG3  LYS 100           HG3      LYS 100   9.103  16.024  18.498
    7    HD2  LYS 100           HD2      LYS 100  10.898  15.728  16.834
    8    HD3  LYS 100           HD3      LYS 100  12.040  16.534  17.913
    9    HE2  LYS 100           HE2      LYS 100  11.626  14.780  19.628
   10    HE3  LYS 100           HE3      LYS 100  10.547  13.954  18.500
   11    HZ1  LYS 100           HZ1      LYS 100  13.374  14.601  17.851
   12    HZ3  LYS 100           HZ2      LYS 100  12.323  13.555  17.020
   13    HZ2  LYS 100           HZ3      LYS 100  12.905  13.130  18.559

  No H/Q in entry =          13
  In of MODEL   34
    1    H    LEU 101           H        LEU 101   7.222  19.676  16.723
    2    HA   LEU 101           HA       LEU 101   8.457  22.224  16.392
    3    HB2  LEU 101           HB2      LEU 101   5.853  21.012  15.499
    4    HB3  LEU 101           HB3      LEU 101   6.119  22.741  15.294
    5    HG   LEU 101           HG       LEU 101   8.140  20.709  14.330
    6   HD12  LEU 101          HD11      LEU 101   6.995  21.226  12.044
    7   HD11  LEU 101          HD12      LEU 101   5.598  21.667  13.022
    8   HD13  LEU 101          HD13      LEU 101   6.249  20.031  13.103
    9   HD21  LEU 101          HD21      LEU 101   7.537  23.627  13.776
   10   HD23  LEU 101          HD22      LEU 101   8.512  22.660  12.670
   11   HD22  LEU 101          HD23      LEU 101   9.053  22.912  14.330

  No H/Q in entry =          11
  In of MODEL   34
    1    H    LYS 102           H        LYS 102   6.906  21.096  19.004
    2    HA   LYS 102           HA       LYS 102   6.279  22.191  20.936
    3    HB2  LYS 102           HB2      LYS 102   7.580  24.171  19.816
    4    HB3  LYS 102           HB3      LYS 102   5.987  24.790  19.438
    5    HG2  LYS 102           HG2      LYS 102   7.357  24.520  22.092
    6    HG3  LYS 102           HG3      LYS 102   6.416  25.857  21.463
    7    HD2  LYS 102           HD2      LYS 102   5.149  23.230  22.337
    8    HD3  LYS 102           HD3      LYS 102   5.407  24.588  23.422
    9    HE2  LYS 102           HE2      LYS 102   3.127  24.205  21.929
   10    HE3  LYS 102           HE3      LYS 102   3.641  25.746  22.613
   11    HZ2  LYS 102           HZ1      LYS 102   3.116  25.861  20.232
   12    HZ1  LYS 102           HZ2      LYS 102   4.369  24.769  19.911
   13    HZ3  LYS 102           HZ3      LYS 102   4.724  26.296  20.556

  No H/Q in entry =          13
  In of MODEL   34
    1    H    ALA 103           H        ALA 103   4.659  23.750  18.167
    2    HA   ALA 103           HA       ALA 103   2.208  24.346  19.048
    3    HB1  ALA 103           HB1      ALA 103   1.306  23.514  16.804
    4    HB2  ALA 103           HB2      ALA 103   2.950  22.964  16.476
    5    HB3  ALA 103           HB3      ALA 103   2.629  24.678  16.744

  No H/Q in entry =           5
  In of MODEL   34
    1    H1   ALA   1           H3       ALA   1  10.478 -20.198  -6.258
    2    H2   ALA   1           H2       ALA   1   9.514 -20.394  -7.646
    3    H3   ALA   1           H1       ALA   1   9.068 -21.138  -6.184
    4    HA   ALA   1           HA       ALA   1  10.092 -22.956  -6.924
    5    HB1  ALA   1           HB1      ALA   1  10.195 -22.595  -9.199
    6    HB2  ALA   1           HB2      ALA   1  11.923 -22.460  -8.867
    7    HB3  ALA   1           HB3      ALA   1  10.938 -21.004  -9.018

  No H/Q in entry =           7
  In of MODEL   34
    1    H    GLU   2           H        GLU   2  12.367 -23.927  -6.979
    2    HA   GLU   2           HA       GLU   2  13.746 -23.860  -4.765
    3    HB2  GLU   2           HB2      GLU   2  15.107 -23.738  -7.462
    4    HB3  GLU   2           HB3      GLU   2  15.828 -24.357  -5.976
    5    HG2  GLU   2           HG2      GLU   2  14.793 -26.365  -6.221
    6    HG3  GLU   2           HG3      GLU   2  13.229 -25.604  -6.482

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLU   3           H        GLU   3  15.538 -22.009  -7.162
    2    HA   GLU   3           HA       GLU   3  16.703 -20.335  -5.198
    3    HB2  GLU   3           HB2      GLU   3  16.652 -20.329  -8.208
    4    HB3  GLU   3           HB3      GLU   3  17.409 -19.008  -7.319
    5    HG2  GLU   3           HG2      GLU   3  19.057 -20.398  -6.395
    6    HG3  GLU   3           HG3      GLU   3  18.098 -21.856  -6.619

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LEU   4           H        LEU   4  14.433 -19.463  -7.832
    2    HA   LEU   4           HA       LEU   4  13.990 -16.851  -7.218
    3    HB2  LEU   4           HB2      LEU   4  11.798 -18.804  -7.953
    4    HB3  LEU   4           HB3      LEU   4  11.740 -17.054  -8.150
    5    HG   LEU   4           HG       LEU   4  13.689 -18.934  -9.522
    6   HD13  LEU   4          HD11      LEU   4  12.391 -18.771 -11.434
    7   HD12  LEU   4          HD12      LEU   4  11.697 -17.220 -10.966
    8   HD11  LEU   4          HD13      LEU   4  11.128 -18.706 -10.207
    9   HD23  LEU   4          HD21      LEU   4  14.048 -16.691 -10.871
   10   HD22  LEU   4          HD22      LEU   4  14.903 -16.943  -9.351
   11   HD21  LEU   4          HD23      LEU   4  13.460 -15.933  -9.390

  No H/Q in entry =          11
  In of MODEL   34
    1    H    GLU   5           H        GLU   5  12.477 -19.622  -5.581
    2    HA   GLU   5           HA       GLU   5  10.812 -18.037  -3.879
    3    HB2  GLU   5           HB2      GLU   5  10.366 -20.412  -4.404
    4    HB3  GLU   5           HB3      GLU   5  11.794 -20.862  -3.469
    5    HG2  GLU   5           HG2      GLU   5  10.832 -19.830  -1.462
    6    HG3  GLU   5           HG3      GLU   5   9.417 -19.328  -2.387

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLU   6           H        GLU   6  13.943 -19.647  -3.433
    2    HA   GLU   6           HA       GLU   6  14.300 -18.797  -0.734
    3    HB2  GLU   6           HB2      GLU   6  15.506 -20.722  -1.750
    4    HB3  GLU   6           HB3      GLU   6  16.399 -19.590  -2.767
    5    HG2  GLU   6           HG2      GLU   6  17.777 -20.076  -0.850
    6    HG3  GLU   6           HG3      GLU   6  17.166 -18.434  -0.658

  No H/Q in entry =           6
  In of MODEL   34
    1    H    VAL   7           H        VAL   7  15.082 -17.474  -3.881
    2    HA   VAL   7           HA       VAL   7  16.786 -15.363  -3.011
    3    HB   VAL   7           HB       VAL   7  15.080 -15.709  -5.491
    4   HG11  VAL   7          HG11      VAL   7  16.992 -13.513  -4.674
    5   HG13  VAL   7          HG12      VAL   7  15.352 -13.355  -5.299
    6   HG12  VAL   7          HG13      VAL   7  16.658 -13.868  -6.368
    7   HG21  VAL   7          HG21      VAL   7  17.173 -17.185  -4.921
    8   HG23  VAL   7          HG22      VAL   7  18.092 -15.731  -5.316
    9   HG22  VAL   7          HG23      VAL   7  17.051 -16.470  -6.530

  No H/Q in entry =           9
  In of MODEL   34
    1    H    VAL   8           H        VAL   8  13.292 -15.601  -3.573
    2    HA   VAL   8           HA       VAL   8  12.649 -12.888  -3.099
    3    HB   VAL   8           HB       VAL   8  11.017 -15.404  -2.675
    4   HG11  VAL   8          HG11      VAL   8  10.377 -12.488  -2.333
    5   HG13  VAL   8          HG12      VAL   8   9.874 -13.862  -1.347
    6   HG12  VAL   8          HG13      VAL   8   9.125 -13.583  -2.917
    7   HG23  VAL   8          HG21      VAL   8  10.377 -13.472  -4.849
    8   HG22  VAL   8          HG22      VAL   8  10.406 -15.234  -4.883
    9   HG21  VAL   8          HG23      VAL   8  11.907 -14.327  -5.044

  No H/Q in entry =           9
  In of MODEL   34
    1    H    MET   9           H        MET   9  12.889 -15.698  -0.922
    2    HA   MET   9           HA       MET   9  12.081 -14.423   1.448
    3    HB2  MET   9           HB2      MET   9  13.972 -16.711   0.910
    4    HB3  MET   9           HB3      MET   9  13.667 -16.131   2.548
    5    HG2  MET   9           HG2      MET   9  11.242 -16.499   2.223
    6    HG3  MET   9           HG3      MET   9  11.561 -17.100   0.594
    7    HE3  MET   9           HE1      MET   9  12.813 -18.890   4.593
    8    HE2  MET   9           HE2      MET   9  11.165 -18.317   4.355
    9    HE1  MET   9           HE3      MET   9  12.515 -17.202   4.159

  No H/Q in entry =           9
  In of MODEL   34
    1    H    GLY  10           H        GLY  10  15.262 -14.672  -0.104
    2    HA3  GLY  10           HA2      GLY  10  16.730 -13.265   1.870
    3    HA2  GLY  10           HA3      GLY  10  17.194 -13.432   0.177

  No H/Q in entry =           3
  In of MODEL   34
    1    H    LEU  11           H        LEU  11  15.037 -12.192  -1.064
    2    HA   LEU  11           HA       LEU  11  15.744  -9.453  -0.897
    3    HB2  LEU  11           HB2      LEU  11  13.367 -10.843  -2.137
    4    HB3  LEU  11           HB3      LEU  11  13.661  -9.110  -2.294
    5    HG   LEU  11           HG       LEU  11  15.673 -11.234  -3.081
    6   HD13  LEU  11          HD11      LEU  11  13.927 -11.585  -4.605
    7   HD12  LEU  11          HD12      LEU  11  14.940 -10.411  -5.442
    8   HD11  LEU  11          HD13      LEU  11  13.470  -9.882  -4.625
    9   HD22  LEU  11          HD21      LEU  11  16.920  -9.280  -2.852
   10   HD21  LEU  11          HD22      LEU  11  15.553  -8.232  -3.231
   11   HD23  LEU  11          HD23      LEU  11  16.380  -9.106  -4.520

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  12           H        ILE  12  12.959 -11.259   0.364
    2    HA   ILE  12           HA       ILE  12  11.581  -9.026   1.424
    3    HB   ILE  12           HB       ILE  12  11.595 -11.909   2.372
    4   HG12  ILE  12          HG12      ILE  12  10.919 -11.269  -0.078
    5   HG13  ILE  12          HG13      ILE  12   9.887 -12.356   0.830
    6   HG21  ILE  12          HG21      ILE  12   9.681  -9.620   2.930
    7   HG23  ILE  12          HG22      ILE  12  10.648 -10.507   4.107
    8   HG22  ILE  12          HG23      ILE  12   9.316 -11.308   3.276
    9   HD11  ILE  12          HD11      ILE  12   9.473  -9.363   0.612
   10   HD13  ILE  12          HD12      ILE  12   8.372 -10.532   1.338
   11   HD12  ILE  12          HD13      ILE  12   8.655 -10.551  -0.389

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  13           H        ILE  13  13.956 -11.250   2.831
    2    HA   ILE  13           HA       ILE  13  13.996 -10.073   5.413
    3    HB   ILE  13           HB       ILE  13  16.043 -11.661   3.847
    4   HG12  ILE  13          HG12      ILE  13  13.766 -12.613   4.687
    5   HG13  ILE  13          HG13      ILE  13  15.235 -13.543   4.970
    6   HG22  ILE  13          HG21      ILE  13  17.087 -12.020   6.175
    7   HG21  ILE  13          HG22      ILE  13  16.183 -10.599   6.681
    8   HG23  ILE  13          HG23      ILE  13  17.391 -10.466   5.403
    9   HD11  ILE  13          HD11      ILE  13  14.363 -11.581   7.075
   10   HD13  ILE  13          HD12      ILE  13  15.245 -13.095   7.245
   11   HD12  ILE  13          HD13      ILE  13  13.514 -13.119   6.939

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ASN  14           H        ASN  14  15.957  -9.552   2.498
    2    HA   ASN  14           HA       ASN  14  17.712  -7.622   3.565
    3    HB2  ASN  14           HB2      ASN  14  17.685  -8.886   1.248
    4    HB3  ASN  14           HB3      ASN  14  16.802  -7.463   0.711
    5   HD21  ASN  14          HD21      ASN  14  19.242  -7.815  -0.471
    6   HD22  ASN  14          HD22      ASN  14  20.390  -6.739   0.159

  No H/Q in entry =           6
  In of MODEL   34
    1    H    SER  15           H        SER  15  14.606  -7.255   1.868
    2    HA   SER  15           HA       SER  15  14.509  -4.434   1.927
    3    HB2  SER  15           HB2      SER  15  12.177  -4.667   1.426
    4    HB3  SER  15           HB3      SER  15  12.967  -6.038   0.657
    5    HG   SER  15           HG       SER  15  11.859  -7.301   1.899

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLY  16           H        GLY  16  13.399  -6.891   4.226
    2    HA3  GLY  16           HA2      GLY  16  12.183  -5.137   6.083
    3    HA2  GLY  16           HA3      GLY  16  12.789  -6.749   6.445

  No H/Q in entry =           3
  In of MODEL   34
    1    H    GLN  17           H        GLN  17  15.503  -6.430   5.858
    2    HA   GLN  17           HA       GLN  17  16.461  -5.216   8.241
    3    HB2  GLN  17           HB2      GLN  17  17.704  -7.004   7.093
    4    HB3  GLN  17           HB3      GLN  17  17.971  -5.940   5.711
    5    HG2  GLN  17           HG2      GLN  17  19.242  -4.389   7.108
    6    HG3  GLN  17           HG3      GLN  17  18.919  -5.373   8.533
    7   HE21  GLN  17          HE21      GLN  17  21.602  -4.842   7.656
    8   HE22  GLN  17          HE22      GLN  17  22.281  -6.304   7.126

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ALA  18           H        ALA  18  16.284  -4.134   4.882
    2    HA   ALA  18           HA       ALA  18  17.731  -1.748   5.114
    3    HB1  ALA  18           HB1      ALA  18  16.611  -2.956   3.043
    4    HB3  ALA  18           HB2      ALA  18  16.884  -1.213   3.030
    5    HB2  ALA  18           HB3      ALA  18  15.281  -1.852   3.396

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ARG  19           H        ARG  19  14.228  -2.320   5.504
    2    HA   ARG  19           HA       ARG  19  13.571   0.332   6.220
    3    HB2  ARG  19           HB2      ARG  19  11.883  -1.410   5.629
    4    HB3  ARG  19           HB3      ARG  19  12.218  -2.212   7.166
    5    HG2  ARG  19           HG2      ARG  19  11.514  -0.219   8.406
    6    HG3  ARG  19           HG3      ARG  19  11.271   0.661   6.898
    7    HD2  ARG  19           HD2      ARG  19   9.125  -0.127   7.713
    8    HD3  ARG  19           HD3      ARG  19   9.542  -1.006   6.236
    9    HE   ARG  19           HE       ARG  19  10.490  -2.556   8.342
   10   HH21  ARG  19          HH11      ARG  19   9.231  -4.191   9.276
   11   HH22  ARG  19          HH12      ARG  19   7.511  -4.155   9.102
   12   HH11  ARG  19          HH21      ARG  19   7.503  -1.248   7.242
   13   HH12  ARG  19          HH22      ARG  19   6.534  -2.489   7.946

  No H/Q in entry =          13
  In of MODEL   34
    1    H    SER  20           H        SER  20  14.412  -2.504   8.178
    2    HA   SER  20           HA       SER  20  14.129  -1.406  10.716
    3    HB2  SER  20           HB2      SER  20  14.584  -3.733  10.594
    4    HB3  SER  20           HB3      SER  20  16.039  -3.476   9.633
    5    HG   SER  20           HG       SER  20  15.597  -3.151  12.374

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU  21           H        LEU  21  16.976  -1.355   8.586
    2    HA   LEU  21           HA       LEU  21  18.654   0.121  10.329
    3    HB2  LEU  21           HB2      LEU  21  18.639  -0.139   7.314
    4    HB3  LEU  21           HB3      LEU  21  19.899   0.702   8.212
    5    HG   LEU  21           HG       LEU  21  19.127  -2.187   8.720
    6   HD13  LEU  21          HD11      LEU  21  20.003  -2.063   6.475
    7   HD12  LEU  21          HD12      LEU  21  21.292  -2.678   7.510
    8   HD11  LEU  21          HD13      LEU  21  21.310  -0.995   6.990
    9   HD23  LEU  21          HD21      LEU  21  21.597  -2.062   9.651
   10   HD22  LEU  21          HD22      LEU  21  20.281  -1.462  10.654
   11   HD21  LEU  21          HD23      LEU  21  21.281  -0.333   9.755

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ALA  22           H        ALA  22  16.400   1.103   7.770
    2    HA   ALA  22           HA       ALA  22  16.952   3.859   7.788
    3    HB3  ALA  22           HB1      ALA  22  15.547   2.625   6.105
    4    HB2  ALA  22           HB2      ALA  22  14.846   4.141   6.672
    5    HB1  ALA  22           HB3      ALA  22  14.247   2.604   7.297

  No H/Q in entry =           5
  In of MODEL   34
    1    H    TYR  23           H        TYR  23  14.443   2.053   9.615
    2    HA   TYR  23           HA       TYR  23  13.488   4.293  11.065
    3    HB2  TYR  23           HB2      TYR  23  12.241   2.186  11.040
    4    HB3  TYR  23           HB3      TYR  23  13.567   1.367  11.864
    5    HD1  TYR  23           HD1      TYR  23  11.056   4.100  12.229
    6    HD2  TYR  23           HD2      TYR  23  13.782   1.446  14.223
    7    HE1  TYR  23           HE1      TYR  23  10.128   4.795  14.422
    8    HE2  TYR  23           HE2      TYR  23  12.855   2.140  16.416
    9    HH   TYR  23           HH       TYR  23  11.275   4.763  16.994

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ALA  24           H        ALA  24  16.120   2.004  11.705
    2    HA   ALA  24           HA       ALA  24  16.790   2.992  14.272
    3    HB1  ALA  24           HB1      ALA  24  18.137   1.193  14.107
    4    HB3  ALA  24           HB2      ALA  24  19.172   2.110  13.012
    5    HB2  ALA  24           HB3      ALA  24  17.874   1.109  12.367

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA  25           H        ALA  25  17.759   3.920  10.996
    2    HA   ALA  25           HA       ALA  25  19.713   5.844  11.648
    3    HB1  ALA  25           HB1      ALA  25  18.996   4.902   9.330
    4    HB3  ALA  25           HB2      ALA  25  19.506   6.587   9.426
    5    HB2  ALA  25           HB3      ALA  25  17.790   6.189   9.353

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU  26           H        LEU  26  16.200   6.092  11.279
    2    HA   LEU  26           HA       LEU  26  15.990   8.874  11.733
    3    HB2  LEU  26           HB2      LEU  26  14.124   7.650  10.800
    4    HB3  LEU  26           HB3      LEU  26  14.024   6.622  12.224
    5    HG   LEU  26           HG       LEU  26  13.426   8.581  13.605
    6   HD12  LEU  26          HD11      LEU  26  12.780  10.687  12.281
    7   HD11  LEU  26          HD12      LEU  26  13.760  10.030  10.973
    8   HD13  LEU  26          HD13      LEU  26  14.503  10.409  12.527
    9   HD21  LEU  26          HD21      LEU  26  11.754   8.280  11.091
   10   HD23  LEU  26          HD22      LEU  26  11.195   8.979  12.608
   11   HD22  LEU  26          HD23      LEU  26  11.637   7.276  12.536

  No H/Q in entry =          11
  In of MODEL   34
    1    H    LYS  27           H        LYS  27  15.861   6.093  13.923
    2    HA   LYS  27           HA       LYS  27  15.271   7.460  16.291
    3    HB2  LYS  27           HB2      LYS  27  15.285   4.984  16.023
    4    HB3  LYS  27           HB3      LYS  27  17.049   5.026  15.984
    5    HG2  LYS  27           HG2      LYS  27  17.100   6.009  18.235
    6    HG3  LYS  27           HG3      LYS  27  15.333   6.038  18.276
    7    HD2  LYS  27           HD2      LYS  27  15.293   3.572  18.037
    8    HD3  LYS  27           HD3      LYS  27  17.058   3.550  18.029
    9    HE2  LYS  27           HE2      LYS  27  17.093   4.536  20.287
   10    HE3  LYS  27           HE3      LYS  27  15.328   4.587  20.298
   11    HZ3  LYS  27           HZ1      LYS  27  16.101   2.629  21.448
   12    HZ2  LYS  27           HZ2      LYS  27  17.017   2.146  20.098
   13    HZ1  LYS  27           HZ3      LYS  27  15.319   2.162  20.015

  No H/Q in entry =          13
  In of MODEL   34
    1    H    GLN  28           H        GLN  28  18.388   6.859  14.705
    2    HA   GLN  28           HA       GLN  28  20.074   7.929  16.701
    3    HB2  GLN  28           HB2      GLN  28  20.369   7.886  13.686
    4    HB3  GLN  28           HB3      GLN  28  21.656   8.347  14.800
    5    HG2  GLN  28           HG2      GLN  28  20.218   5.679  14.843
    6    HG3  GLN  28           HG3      GLN  28  21.798   5.954  14.113
    7   HE21  GLN  28          HE21      GLN  28  20.555   4.625  16.809
    8   HE22  GLN  28          HE22      GLN  28  21.744   5.050  17.943

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ALA  29           H        ALA  29  18.339   9.427  14.007
    2    HA   ALA  29           HA       ALA  29  19.355  12.041  14.265
    3    HB2  ALA  29           HB1      ALA  29  17.664  12.691  12.791
    4    HB1  ALA  29           HB2      ALA  29  16.511  11.525  13.438
    5    HB3  ALA  29           HB3      ALA  29  17.839  10.975  12.417

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LYS  30           H        LYS  30  16.564  10.459  15.778
    2    HA   LYS  30           HA       LYS  30  15.563  12.719  17.136
    3    HB2  LYS  30           HB2      LYS  30  15.428   9.777  17.836
    4    HB3  LYS  30           HB3      LYS  30  14.570  11.033  18.729
    5    HG2  LYS  30           HG2      LYS  30  13.455  11.730  16.609
    6    HG3  LYS  30           HG3      LYS  30  14.251  10.389  15.782
    7    HD2  LYS  30           HD2      LYS  30  13.164   8.788  17.307
    8    HD3  LYS  30           HD3      LYS  30  12.377  10.118  18.157
    9    HE2  LYS  30           HE2      LYS  30  11.219  10.763  16.063
   10    HE3  LYS  30           HE3      LYS  30  11.985   9.404  15.232
   11    HZ2  LYS  30           HZ1      LYS  30   9.671   9.011  16.107
   12    HZ1  LYS  30           HZ2      LYS  30  10.336   9.057  17.675
   13    HZ3  LYS  30           HZ3      LYS  30  10.837   7.869  16.565

  No H/Q in entry =          13
  In of MODEL   34
    1    H    GLN  31           H        GLN  31  18.206  10.527  17.876
    2    HA   GLN  31           HA       GLN  31  18.536  11.536  20.572
    3    HB2  GLN  31           HB2      GLN  31  20.549   9.951  18.969
    4    HB3  GLN  31           HB3      GLN  31  20.413  10.074  20.724
    5    HG2  GLN  31           HG2      GLN  31  17.893   9.143  19.948
    6    HG3  GLN  31           HG3      GLN  31  18.990   8.291  18.869
    7   HE21  GLN  31          HE21      GLN  31  17.434   7.154  21.141
    8   HE22  GLN  31          HE22      GLN  31  18.582   6.483  22.193

  No H/Q in entry =           8
  In of MODEL   34
    1    H    GLY  32           H        GLY  32  19.071  12.853  17.609
    2    HA3  GLY  32           HA2      GLY  32  20.073  14.891  17.099
    3    HA2  GLY  32           HA3      GLY  32  20.827  14.888  18.689

  No H/Q in entry =           3
  In of MODEL   34
    1    H    ASP  33           H        ASP  33  21.230  11.994  16.909
    2    HA   ASP  33           HA       ASP  33  24.061  12.648  16.449
    3    HB2  ASP  33           HB2      ASP  33  22.532  10.044  16.559
    4    HB3  ASP  33           HB3      ASP  33  24.220  10.148  16.067

  No H/Q in entry =           4
  In of MODEL   34
    1    H    PHE  34           H        PHE  34  23.594  13.978  14.569
    2    HA   PHE  34           HA       PHE  34  22.242  13.007  12.277
    3    HB2  PHE  34           HB2      PHE  34  24.389  15.124  12.515
    4    HB3  PHE  34           HB3      PHE  34  23.405  14.844  11.080
    5    HD1  PHE  34           HD1      PHE  34  23.665  16.772  13.997
    6    HD2  PHE  34           HD2      PHE  34  20.776  14.681  11.603
    7    HE1  PHE  34           HE1      PHE  34  21.857  18.182  14.943
    8    HE2  PHE  34           HE2      PHE  34  18.972  16.092  12.551
    9    HZ   PHE  34           HZ       PHE  34  19.516  17.843  14.216

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ALA  35           H        ALA  35  25.613  12.792  13.292
    2    HA   ALA  35           HA       ALA  35  26.717  11.967  10.836
    3    HB3  ALA  35           HB1      ALA  35  28.386  10.782  12.558
    4    HB2  ALA  35           HB2      ALA  35  27.527  11.812  13.703
    5    HB1  ALA  35           HB3      ALA  35  28.372  12.531  12.333

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA  36           H        ALA  36  25.582  10.015  13.596
    2    HA   ALA  36           HA       ALA  36  26.050   7.526  12.318
    3    HB2  ALA  36           HB1      ALA  36  25.610   6.780  14.392
    4    HB3  ALA  36           HB2      ALA  36  23.926   7.287  14.239
    5    HB1  ALA  36           HB3      ALA  36  25.134   8.409  14.866

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA  37           H        ALA  37  23.244   9.672  12.449
    2    HA   ALA  37           HA       ALA  37  21.377   7.917  11.267
    3    HB3  ALA  37           HB1      ALA  37  21.623  10.878  11.564
    4    HB1  ALA  37           HB2      ALA  37  20.303   9.807  12.032
    5    HB2  ALA  37           HB3      ALA  37  20.498  10.280  10.344

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LYS  38           H        LYS  38  23.497  10.366   9.796
    2    HA   LYS  38           HA       LYS  38  22.860   9.946   7.117
    3    HB2  LYS  38           HB2      LYS  38  24.677  11.489   8.568
    4    HB3  LYS  38           HB3      LYS  38  25.705  10.494   7.543
    5    HG2  LYS  38           HG2      LYS  38  24.550  11.275   5.545
    6    HG3  LYS  38           HG3      LYS  38  23.359  12.136   6.525
    7    HD2  LYS  38           HD2      LYS  38  24.963  13.723   7.283
    8    HD3  LYS  38           HD3      LYS  38  26.318  12.729   6.749
    9    HE2  LYS  38           HE2      LYS  38  25.976  14.605   5.199
   10    HE3  LYS  38           HE3      LYS  38  25.633  13.070   4.392
   11    HZ3  LYS  38           HZ1      LYS  38  23.439  13.529   4.258
   12    HZ2  LYS  38           HZ2      LYS  38  23.972  15.141   4.349
   13    HZ1  LYS  38           HZ3      LYS  38  23.390  14.359   5.739

  No H/Q in entry =          13
  In of MODEL   34
    1    H    ALA  39           H        ALA  39  25.360   8.329   9.076
    2    HA   ALA  39           HA       ALA  39  26.423   6.737   7.006
    3    HB2  ALA  39           HB1      ALA  39  26.323   5.770   9.848
    4    HB1  ALA  39           HB2      ALA  39  27.285   7.190   9.436
    5    HB3  ALA  39           HB3      ALA  39  27.629   5.639   8.671

  No H/Q in entry =           5
  In of MODEL   34
    1    H    MET  40           H        MET  40  23.802   6.134   9.298
    2    HA   MET  40           HA       MET  40  23.344   3.433   8.559
    3    HB2  MET  40           HB2      MET  40  21.537   5.485   9.851
    4    HB3  MET  40           HB3      MET  40  21.121   3.779   9.673
    5    HG2  MET  40           HG2      MET  40  23.673   4.703  11.020
    6    HG3  MET  40           HG3      MET  40  22.175   4.435  11.910
    7    HE3  MET  40           HE1      MET  40  21.590   0.805  12.079
    8    HE2  MET  40           HE2      MET  40  20.731   2.114  11.272
    9    HE1  MET  40           HE3      MET  40  21.470   2.394  12.847

  No H/Q in entry =           9
  In of MODEL   34
    1    H    MET  41           H        MET  41  21.950   6.496   7.373
    2    HA   MET  41           HA       MET  41  19.990   5.314   5.696
    3    HB2  MET  41           HB2      MET  41  21.487   7.897   5.189
    4    HB3  MET  41           HB3      MET  41  19.957   7.413   4.467
    5    HG2  MET  41           HG2      MET  41  19.205   7.225   7.017
    6    HG3  MET  41           HG3      MET  41  20.520   8.375   7.243
    7    HE2  MET  41           HE1      MET  41  19.971   9.671   3.907
    8    HE1  MET  41           HE2      MET  41  20.928  10.103   5.321
    9    HE3  MET  41           HE3      MET  41  19.662  11.190   4.756

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ASP  42           H        ASP  42  23.369   6.219   5.151
    2    HA   ASP  42           HA       ASP  42  23.463   5.748   2.393
    3    HB2  ASP  42           HB2      ASP  42  25.216   6.734   4.167
    4    HB3  ASP  42           HB3      ASP  42  25.865   5.105   4.038

  No H/Q in entry =           4
  In of MODEL   34
    1    H    GLN  43           H        GLN  43  24.170   3.586   5.112
    2    HA   GLN  43           HA       GLN  43  24.825   1.327   3.527
    3    HB2  GLN  43           HB2      GLN  43  23.798   1.512   6.369
    4    HB3  GLN  43           HB3      GLN  43  24.370   0.021   5.613
    5    HG2  GLN  43           HG2      GLN  43  26.541   1.220   5.108
    6    HG3  GLN  43           HG3      GLN  43  25.964   2.549   6.108
    7   HE21  GLN  43          HE21      GLN  43  28.189   1.563   7.148
    8   HE22  GLN  43          HE22      GLN  43  27.907   0.480   8.422

  No H/Q in entry =           8
  In of MODEL   34
    1    H    SER  44           H        SER  44  21.773   2.475   4.908
    2    HA   SER  44           HA       SER  44  20.193   0.242   4.229
    3    HB2  SER  44           HB2      SER  44  19.763   2.771   5.377
    4    HB3  SER  44           HB3      SER  44  18.731   2.736   3.950
    5    HG   SER  44           HG       SER  44  17.629   1.796   5.669

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ARG  45           H        ARG  45  20.956   3.205   2.429
    2    HA   ARG  45           HA       ARG  45  19.433   2.731   0.121
    3    HB2  ARG  45           HB2      ARG  45  20.587   4.860   0.711
    4    HB3  ARG  45           HB3      ARG  45  22.128   4.097   0.327
    5    HG2  ARG  45           HG2      ARG  45  21.347   3.699  -1.989
    6    HG3  ARG  45           HG3      ARG  45  19.818   4.485  -1.605
    7    HD2  ARG  45           HD2      ARG  45  21.079   6.573  -1.015
    8    HD3  ARG  45           HD3      ARG  45  22.572   5.792  -1.582
    9    HE   ARG  45           HE       ARG  45  20.644   5.568  -3.622
   10   HH21  ARG  45          HH11      ARG  45  20.648   6.940  -5.383
   11   HH22  ARG  45          HH12      ARG  45  21.414   8.485  -5.275
   12   HH11  ARG  45          HH21      ARG  45  22.386   8.054  -1.988
   13   HH12  ARG  45          HH22      ARG  45  22.397   9.116  -3.350

  No H/Q in entry =          13
  In of MODEL   34
    1    H    MET  46           H        MET  46  22.790   1.835   0.873
    2    HA   MET  46           HA       MET  46  23.393   0.642  -1.611
    3    HB2  MET  46           HB2      MET  46  24.493   0.310   1.179
    4    HB3  MET  46           HB3      MET  46  25.144  -0.592  -0.193
    5    HG2  MET  46           HG2      MET  46  25.615   1.504  -1.380
    6    HG3  MET  46           HG3      MET  46  24.902   2.429  -0.066
    7    HE3  MET  46           HE1      MET  46  27.630  -0.777   0.325
    8    HE2  MET  46           HE2      MET  46  28.838   0.277  -0.402
    9    HE1  MET  46           HE3      MET  46  27.321  -0.028  -1.247

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ALA  47           H        ALA  47  21.997  -0.686   1.361
    2    HA   ALA  47           HA       ALA  47  21.927  -3.398   0.554
    3    HB2  ALA  47           HB1      ALA  47  21.548  -2.937   2.859
    4    HB3  ALA  47           HB2      ALA  47  20.008  -3.530   2.237
    5    HB1  ALA  47           HB3      ALA  47  20.249  -1.801   2.498

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU  48           H        LEU  48  19.592  -0.755   0.198
    2    HA   LEU  48           HA       LEU  48  17.539  -2.273  -1.058
    3    HB2  LEU  48           HB2      LEU  48  18.213   0.677  -1.168
    4    HB3  LEU  48           HB3      LEU  48  16.738  -0.023  -1.837
    5    HG   LEU  48           HG       LEU  48  17.586  -0.334   1.052
    6   HD13  LEU  48          HD11      LEU  48  17.184   1.970   0.867
    7   HD12  LEU  48          HD12      LEU  48  15.621   1.332   1.374
    8   HD11  LEU  48          HD13      LEU  48  15.897   1.754  -0.316
    9   HD22  LEU  48          HD21      LEU  48  16.046  -2.037   0.668
   10   HD21  LEU  48          HD22      LEU  48  15.180  -1.127  -0.571
   11   HD23  LEU  48          HD23      LEU  48  14.969  -0.723   1.133

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ASN  49           H        ASN  49  20.241  -0.362  -2.283
    2    HA   ASN  49           HA       ASN  49  19.593  -0.439  -5.008
    3    HB2  ASN  49           HB2      ASN  49  21.284   1.061  -4.067
    4    HB3  ASN  49           HB3      ASN  49  22.307  -0.311  -3.661
    5   HD21  ASN  49          HD21      ASN  49  23.239   1.762  -5.357
    6   HD22  ASN  49          HD22      ASN  49  23.434   1.139  -6.923

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLU  50           H        GLU  50  21.560  -2.649  -3.046
    2    HA   GLU  50           HA       GLU  50  22.250  -4.408  -5.173
    3    HB2  GLU  50           HB2      GLU  50  23.447  -4.393  -3.005
    4    HB3  GLU  50           HB3      GLU  50  21.999  -5.011  -2.211
    5    HG2  GLU  50           HG2      GLU  50  22.075  -7.044  -3.572
    6    HG3  GLU  50           HG3      GLU  50  23.456  -6.420  -4.471

  No H/Q in entry =           6
  In of MODEL   34
    1    H    ALA  51           H        ALA  51  19.593  -4.325  -2.849
    2    HA   ALA  51           HA       ALA  51  18.410  -6.789  -3.609
    3    HB3  ALA  51           HB1      ALA  51  16.820  -6.273  -2.054
    4    HB1  ALA  51           HB2      ALA  51  16.619  -4.625  -2.652
    5    HB2  ALA  51           HB3      ALA  51  17.974  -5.022  -1.595

  No H/Q in entry =           5
  In of MODEL   34
    1    H    HIS  52           H        HIS  52  17.848  -3.437  -4.642
    2    HA   HIS  52           HA       HIS  52  15.733  -3.947  -6.443
    3    HB2  HIS  52           HB2      HIS  52  16.401  -1.687  -5.638
    4    HB3  HIS  52           HB3      HIS  52  17.852  -1.793  -6.636
    5    HD1  HIS  52           HD1      HIS  52  17.496  -1.851  -9.254
    6    HD2  HIS  52           HD2      HIS  52  14.041  -1.089  -7.050
    7    HE1  HIS  52           HE1      HIS  52  15.776  -0.977 -10.896
    8    HE2  HIS  52           HE2      HIS  52  13.665  -0.506  -9.568

  No H/Q in entry =           8
  In of MODEL   34
    1    H    LEU  53           H        LEU  53  19.251  -3.977  -6.874
    2    HA   LEU  53           HA       LEU  53  19.308  -4.291  -9.674
    3    HB2  LEU  53           HB2      LEU  53  21.234  -5.068  -7.499
    4    HB3  LEU  53           HB3      LEU  53  21.549  -5.455  -9.188
    5    HG   LEU  53           HG       LEU  53  20.897  -2.641  -8.255
    6   HD13  LEU  53          HD11      LEU  53  22.918  -3.148  -7.114
    7   HD12  LEU  53          HD12      LEU  53  23.430  -2.328  -8.589
    8   HD11  LEU  53          HD13      LEU  53  23.542  -4.080  -8.472
    9   HD21  LEU  53          HD21      LEU  53  21.966  -3.873 -10.803
   10   HD23  LEU  53          HD22      LEU  53  22.301  -2.190 -10.408
   11   HD22  LEU  53          HD23      LEU  53  20.646  -2.725 -10.625

  No H/Q in entry =          11
  In of MODEL   34
    1    H    VAL  54           H        VAL  54  19.178  -6.678  -7.050
    2    HA   VAL  54           HA       VAL  54  19.286  -8.973  -8.711
    3    HB   VAL  54           HB       VAL  54  18.133  -8.543  -5.944
    4   HG12  VAL  54          HG11      VAL  54  18.440 -11.163  -5.941
    5   HG11  VAL  54          HG12      VAL  54  18.257 -10.992  -7.686
    6   HG13  VAL  54          HG13      VAL  54  16.971 -10.453  -6.608
    7   HG22  VAL  54          HG21      VAL  54  20.450  -8.348  -5.719
    8   HG21  VAL  54          HG22      VAL  54  20.781  -9.441  -7.061
    9   HG23  VAL  54          HG23      VAL  54  20.245 -10.085  -5.509

  No H/Q in entry =           9
  In of MODEL   34
    1    H    GLN  55           H        GLN  55  16.570  -7.053  -7.429
    2    HA   GLN  55           HA       GLN  55  14.539  -8.703  -8.504
    3    HB2  GLN  55           HB2      GLN  55  13.799  -7.173  -6.878
    4    HB3  GLN  55           HB3      GLN  55  14.601  -5.810  -7.652
    5    HG2  GLN  55           HG2      GLN  55  12.880  -5.474  -9.143
    6    HG3  GLN  55           HG3      GLN  55  12.547  -7.192  -9.314
    7   HE21  GLN  55          HE21      GLN  55  10.537  -7.729  -8.511
    8   HE22  GLN  55          HE22      GLN  55   9.767  -6.970  -7.202

  No H/Q in entry =           8
  In of MODEL   34
    1    H    THR  56           H        THR  56  16.296  -5.914  -9.862
    2    HA   THR  56           HA       THR  56  14.862  -5.542 -12.211
    3    HB   THR  56           HB       THR  56  17.882  -5.472 -12.045
    4    HG1  THR  56           HG1      THR  56  16.113  -4.159 -10.592
    5   HG23  THR  56          HG21      THR  56  17.774  -3.975 -13.854
    6   HG22  THR  56          HG22      THR  56  16.068  -3.625 -13.580
    7   HG21  THR  56          HG23      THR  56  16.550  -5.181 -14.258

  No H/Q in entry =           7
  In of MODEL   34
    1    H    LYS  57           H        LYS  57  17.497  -7.855 -11.599
    2    HA   LYS  57           HA       LYS  57  17.492  -9.049 -14.178
    3    HB2  LYS  57           HB2      LYS  57  19.282  -9.315 -12.437
    4    HB3  LYS  57           HB3      LYS  57  18.171 -10.296 -11.493
    5    HG2  LYS  57           HG2      LYS  57  18.045 -11.942 -13.306
    6    HG3  LYS  57           HG3      LYS  57  19.114 -10.958 -14.299
    7    HD2  LYS  57           HD2      LYS  57  20.911 -11.214 -12.618
    8    HD3  LYS  57           HD3      LYS  57  19.846 -12.217 -11.635
    9    HE2  LYS  57           HE2      LYS  57  21.329 -13.646 -12.976
   10    HE3  LYS  57           HE3      LYS  57  19.668 -13.843 -13.529
   11    HZ3  LYS  57           HZ1      LYS  57  20.058 -12.520 -15.392
   12    HZ2  LYS  57           HZ2      LYS  57  21.433 -13.508 -15.283
   13    HZ1  LYS  57           HZ3      LYS  57  21.505 -11.891 -14.771

  No H/Q in entry =          13
  In of MODEL   34
    1    H    LEU  58           H        LEU  58  15.706  -9.707 -11.203
    2    HA   LEU  58           HA       LEU  58  14.472 -12.073 -12.139
    3    HB2  LEU  58           HB2      LEU  58  13.686 -10.163  -9.943
    4    HB3  LEU  58           HB3      LEU  58  12.871 -11.697 -10.260
    5    HG   LEU  58           HG       LEU  58  15.845 -11.436  -9.704
    6   HD11  LEU  58          HD11      LEU  58  13.471 -11.840  -7.913
    7   HD13  LEU  58          HD12      LEU  58  14.930 -10.885  -7.649
    8   HD12  LEU  58          HD13      LEU  58  14.992 -12.641  -7.515
    9   HD22  LEU  58          HD21      LEU  58  15.717 -13.496 -10.732
   10   HD21  LEU  58          HD22      LEU  58  14.002 -13.696 -10.373
   11   HD23  LEU  58          HD23      LEU  58  15.208 -14.004  -9.123

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  59           H        ILE  59  13.819  -8.732 -12.821
    2    HA   ILE  59           HA       ILE  59  11.101  -9.365 -13.762
    3    HB   ILE  59           HB       ILE  59  11.913  -7.089 -12.555
    4   HG12  ILE  59          HG12      ILE  59  10.023  -6.944 -14.913
    5   HG13  ILE  59          HG13      ILE  59   9.588  -7.722 -13.413
    6   HG21  ILE  59          HG21      ILE  59  13.474  -6.687 -14.589
    7   HG23  ILE  59          HG22      ILE  59  12.482  -5.349 -14.058
    8   HG22  ILE  59          HG23      ILE  59  12.016  -6.297 -15.468
    9   HD13  ILE  59          HD11      ILE  59   9.955  -5.672 -12.162
   10   HD12  ILE  59          HD12      ILE  59   8.851  -5.342 -13.496
   11   HD11  ILE  59          HD13      ILE  59  10.546  -4.867 -13.617

  No H/Q in entry =          11
  In of MODEL   34
    1    H    GLU  60           H        GLU  60  14.310  -8.531 -15.019
    2    HA   GLU  60           HA       GLU  60  13.534  -8.126 -17.728
    3    HB2  GLU  60           HB2      GLU  60  15.714  -7.401 -16.884
    4    HB3  GLU  60           HB3      GLU  60  16.168  -9.073 -16.566
    5    HG2  GLU  60           HG2      GLU  60  15.972  -9.587 -18.977
    6    HG3  GLU  60           HG3      GLU  60  15.529  -7.911 -19.295

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLY  61           H        GLY  61  14.494 -11.013 -15.913
    2    HA3  GLY  61           HA2      GLY  61  13.944 -12.657 -18.315
    3    HA2  GLY  61           HA3      GLY  61  14.973 -13.144 -16.972

  No H/Q in entry =           3
  In of MODEL   34
    1    H    ASP  62           H        ASP  62  11.861 -11.581 -16.603
    2    HA   ASP  62           HA       ASP  62  10.878 -13.314 -14.684
    3    HB2  ASP  62           HB2      ASP  62   8.684 -12.334 -15.178
    4    HB3  ASP  62           HB3      ASP  62   9.939 -11.099 -15.121

  No H/Q in entry =           4
  In of MODEL   34
    1    H    ALA  63           H        ALA  63  10.222 -15.408 -14.731
    2    HA   ALA  63           HA       ALA  63   8.615 -16.434 -16.926
    3    HB2  ALA  63           HB1      ALA  63  11.308 -17.713 -16.399
    4    HB1  ALA  63           HB2      ALA  63  10.970 -16.661 -17.772
    5    HB3  ALA  63           HB3      ALA  63  10.121 -18.199 -17.611

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLY  64           H        GLY  64  10.146 -19.044 -15.836
    2    HA3  GLY  64           HA2      GLY  64   9.935 -20.469 -13.985
    3    HA2  GLY  64           HA3      GLY  64   8.845 -19.308 -13.239

  No H/Q in entry =           3
  In of MODEL   34
    1    H    GLU  65           H        GLU  65   7.716 -19.555 -16.294
    2    HA   GLU  65           HA       GLU  65   6.143 -21.985 -15.785
    3    HB2  GLU  65           HB2      GLU  65   4.980 -19.258 -16.342
    4    HB3  GLU  65           HB3      GLU  65   4.062 -20.762 -16.397
    5    HG2  GLU  65           HG2      GLU  65   5.599 -19.763 -13.984
    6    HG3  GLU  65           HG3      GLU  65   3.856 -19.611 -14.198

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLY  66           H        GLY  66   5.006 -22.814 -17.539
    2    HA3  GLY  66           HA2      GLY  66   6.411 -22.925 -19.971
    3    HA2  GLY  66           HA3      GLY  66   4.828 -23.610 -19.662

  No H/Q in entry =           3
  In of MODEL   34
    1    H    LYS  67           H        LYS  67   3.537 -21.137 -19.050
    2    HA   LYS  67           HA       LYS  67   3.068 -20.226 -21.764
    3    HB2  LYS  67           HB2      LYS  67   1.577 -19.845 -19.173
    4    HB3  LYS  67           HB3      LYS  67   1.076 -19.110 -20.702
    5    HG2  LYS  67           HG2      LYS  67   0.999 -21.331 -21.761
    6    HG3  LYS  67           HG3      LYS  67   1.525 -22.077 -20.254
    7    HD2  LYS  67           HD2      LYS  67  -0.521 -21.210 -19.139
    8    HD3  LYS  67           HD3      LYS  67  -1.057 -20.549 -20.686
    9    HE2  LYS  67           HE2      LYS  67  -0.414 -23.476 -20.232
   10    HE3  LYS  67           HE3      LYS  67  -2.042 -22.805 -20.155
   11    HZ1  LYS  67           HZ1      LYS  67  -1.503 -21.886 -22.464
   12    HZ3  LYS  67           HZ2      LYS  67  -1.855 -23.541 -22.325
   13    HZ2  LYS  67           HZ3      LYS  67  -0.243 -23.021 -22.482

  No H/Q in entry =          13
  In of MODEL   34
    1    H    MET  68           H        MET  68   2.050 -17.817 -21.563
    2    HA   MET  68           HA       MET  68   4.251 -16.078 -21.705
    3    HB2  MET  68           HB2      MET  68   1.295 -15.487 -21.530
    4    HB3  MET  68           HB3      MET  68   2.534 -14.316 -21.982
    5    HG2  MET  68           HG2      MET  68   2.020 -16.928 -23.431
    6    HG3  MET  68           HG3      MET  68   1.447 -15.349 -23.969
    7    HE3  MET  68           HE1      MET  68   4.133 -13.373 -25.156
    8    HE2  MET  68           HE2      MET  68   4.276 -13.351 -23.401
    9    HE1  MET  68           HE3      MET  68   2.682 -13.449 -24.146

  No H/Q in entry =           9
  In of MODEL   34
    1    H    LYS  69           H        LYS  69   1.878 -16.529 -19.075
    2    HA   LYS  69           HA       LYS  69   2.152 -14.339 -17.546
    3    HB2  LYS  69           HB2      LYS  69   2.094 -17.216 -16.649
    4    HB3  LYS  69           HB3      LYS  69   1.925 -15.856 -15.535
    5    HG2  LYS  69           HG2      LYS  69   0.010 -15.014 -16.832
    6    HG3  LYS  69           HG3      LYS  69   0.180 -16.356 -17.964
    7    HD2  LYS  69           HD2      LYS  69  -0.221 -17.950 -16.105
    8    HD3  LYS  69           HD3      LYS  69  -0.458 -16.587 -15.009
    9    HE2  LYS  69           HE2      LYS  69  -2.083 -17.026 -17.529
   10    HE3  LYS  69           HE3      LYS  69  -2.603 -17.538 -15.924
   11    HZ1  LYS  69           HZ1      LYS  69  -1.718 -14.806 -16.036
   12    HZ3  LYS  69           HZ2      LYS  69  -3.124 -15.465 -15.349
   13    HZ2  LYS  69           HZ3      LYS  69  -3.072 -15.109 -17.009

  No H/Q in entry =          13
  In of MODEL   34
    1    H    VAL  70           H        VAL  70   3.269 -14.380 -15.186
    2    HA   VAL  70           HA       VAL  70   6.181 -14.785 -15.556
    3    HB   VAL  70           HB       VAL  70   6.539 -12.652 -14.348
    4   HG11  VAL  70          HG11      VAL  70   4.811 -12.489 -16.837
    5   HG13  VAL  70          HG12      VAL  70   6.569 -12.622 -16.786
    6   HG12  VAL  70          HG13      VAL  70   5.778 -11.155 -16.208
    7   HG23  VAL  70          HG21      VAL  70   4.315 -11.161 -14.421
    8   HG22  VAL  70          HG22      VAL  70   4.679 -12.190 -13.037
    9   HG21  VAL  70          HG23      VAL  70   3.537 -12.737 -14.264

  No H/Q in entry =           9
  In of MODEL   34
    1    H    SER  71           H        SER  71   7.332 -14.647 -13.400
    2    HA   SER  71           HA       SER  71   6.349 -16.579 -11.589
    3    HB2  SER  71           HB2      SER  71   8.761 -15.959 -11.878
    4    HB3  SER  71           HB3      SER  71   8.427 -14.444 -11.042
    5    HG   SER  71           HG       SER  71   9.072 -15.855  -9.487

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU  72           H        LEU  72   4.948 -16.419  -9.985
    2    HA   LEU  72           HA       LEU  72   3.411 -14.097  -9.541
    3    HB2  LEU  72           HB2      LEU  72   3.664 -16.725  -8.117
    4    HB3  LEU  72           HB3      LEU  72   2.640 -15.443  -7.476
    5    HG   LEU  72           HG       LEU  72   2.417 -16.470 -10.324
    6   HD11  LEU  72          HD11      LEU  72   1.947 -18.235  -8.584
    7   HD13  LEU  72          HD12      LEU  72   0.555 -17.828  -9.586
    8   HD12  LEU  72          HD13      LEU  72   0.679 -17.187  -7.947
    9   HD21  LEU  72          HD21      LEU  72   0.892 -14.546  -8.598
   10   HD23  LEU  72          HD22      LEU  72  -0.010 -15.489  -9.773
   11   HD22  LEU  72          HD23      LEU  72   1.286 -14.425 -10.309

  No H/Q in entry =          11
  In of MODEL   34
    1    H    VAL  73           H        VAL  73   6.057 -15.551  -7.766
    2    HA   VAL  73           HA       VAL  73   6.002 -14.019  -5.433
    3    HB   VAL  73           HB       VAL  73   8.184 -14.837  -5.006
    4   HG11  VAL  73          HG11      VAL  73   6.311 -16.526  -5.193
    5   HG13  VAL  73          HG12      VAL  73   7.926 -17.196  -5.430
    6   HG12  VAL  73          HG13      VAL  73   6.886 -16.884  -6.820
    7   HG22  VAL  73          HG21      VAL  73   9.527 -14.296  -6.824
    8   HG21  VAL  73          HG22      VAL  73   8.357 -14.896  -7.998
    9   HG23  VAL  73          HG23      VAL  73   9.336 -16.032  -7.071

  No H/Q in entry =           9
  In of MODEL   34
    1    H    LEU  74           H        LEU  74   7.001 -13.128  -8.606
    2    HA   LEU  74           HA       LEU  74   8.957 -11.191  -8.109
    3    HB2  LEU  74           HB2      LEU  74   8.495 -11.940 -10.349
    4    HB3  LEU  74           HB3      LEU  74   6.837 -11.353 -10.250
    5    HG   LEU  74           HG       LEU  74   7.669  -9.035 -10.031
    6   HD13  LEU  74          HD11      LEU  74   9.784  -9.253  -8.978
    7   HD12  LEU  74          HD12      LEU  74  10.174  -8.771 -10.628
    8   HD11  LEU  74          HD13      LEU  74  10.333 -10.458 -10.143
    9   HD23  LEU  74          HD21      LEU  74   9.128 -10.148 -12.370
   10   HD22  LEU  74          HD22      LEU  74   8.003  -8.814 -12.269
   11   HD21  LEU  74          HD23      LEU  74   7.396 -10.454 -12.253

  No H/Q in entry =          11
  In of MODEL   34
    1    H    VAL  75           H        VAL  75   5.464 -10.786  -8.468
    2    HA   VAL  75           HA       VAL  75   5.383  -8.030  -7.879
    3    HB   VAL  75           HB       VAL  75   3.280 -10.162  -7.497
    4   HG11  VAL  75          HG11      VAL  75   3.108  -7.120  -7.335
    5   HG13  VAL  75          HG12      VAL  75   2.800  -8.256  -6.030
    6   HG12  VAL  75          HG13      VAL  75   1.716  -8.196  -7.411
    7   HG22  VAL  75          HG21      VAL  75   2.406  -9.242  -9.594
    8   HG21  VAL  75          HG22      VAL  75   4.085  -9.724  -9.825
    9   HG23  VAL  75          HG23      VAL  75   3.677  -8.022  -9.619

  No H/Q in entry =           9
  In of MODEL   34
    1    H    GLU  76           H        GLU  76   5.108 -10.907  -5.772
    2    HA   GLU  76           HA       GLU  76   4.642  -9.545  -3.351
    3    HB2  GLU  76           HB2      GLU  76   4.447 -12.006  -3.573
    4    HB3  GLU  76           HB3      GLU  76   6.178 -12.124  -3.835
    5    HG2  GLU  76           HG2      GLU  76   5.769 -12.701  -1.534
    6    HG3  GLU  76           HG3      GLU  76   6.518 -11.116  -1.529

  No H/Q in entry =           6
  In of MODEL   34
    1    H    ALA  77           H        ALA  77   7.699 -10.469  -4.908
    2    HA   ALA  77           HA       ALA  77   9.390  -9.437  -2.888
    3    HB3  ALA  77           HB1      ALA  77   9.927  -9.749  -5.851
    4    HB1  ALA  77           HB2      ALA  77  10.192 -10.982  -4.619
    5    HB2  ALA  77           HB3      ALA  77  11.153  -9.503  -4.607

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLN  78           H        GLN  78   8.013  -8.009  -5.804
    2    HA   GLN  78           HA       GLN  78   9.380  -5.538  -5.694
    3    HB2  GLN  78           HB2      GLN  78   8.024  -6.506  -7.629
    4    HB3  GLN  78           HB3      GLN  78   6.584  -5.970  -6.765
    5    HG2  GLN  78           HG2      GLN  78   7.309  -3.672  -6.846
    6    HG3  GLN  78           HG3      GLN  78   8.878  -4.136  -7.503
    7   HE21  GLN  78          HE21      GLN  78   8.418  -5.750  -9.599
    8   HE22  GLN  78          HE22      GLN  78   7.353  -5.058 -10.727

  No H/Q in entry =           8
  In of MODEL   34
    1    H    LEU  79           H        LEU  79   6.351  -6.658  -4.272
    2    HA   LEU  79           HA       LEU  79   5.370  -4.246  -3.264
    3    HB2  LEU  79           HB2      LEU  79   4.042  -6.289  -3.213
    4    HB3  LEU  79           HB3      LEU  79   5.179  -7.036  -2.095
    5    HG   LEU  79           HG       LEU  79   4.633  -5.392  -0.369
    6   HD13  LEU  79          HD11      LEU  79   4.183  -3.374  -1.419
    7   HD12  LEU  79          HD12      LEU  79   2.553  -3.889  -0.984
    8   HD11  LEU  79          HD13      LEU  79   3.137  -4.114  -2.631
    9   HD23  LEU  79          HD21      LEU  79   2.043  -5.868  -0.286
   10   HD22  LEU  79          HD22      LEU  79   3.173  -7.215  -0.175
   11   HD21  LEU  79          HD23      LEU  79   2.366  -6.871  -1.702

  No H/Q in entry =          11
  In of MODEL   34
    1    H    HIS  80           H        HIS  80   7.533  -6.596  -1.677
    2    HA   HIS  80           HA       HIS  80   7.824  -5.058   0.694
    3    HB2  HIS  80           HB2      HIS  80   9.150  -7.430  -0.503
    4    HB3  HIS  80           HB3      HIS  80  10.063  -6.540   0.717
    5    HD1  HIS  80           HD1      HIS  80   9.561  -7.175   3.058
    6    HD2  HIS  80           HD2      HIS  80   6.346  -8.002   0.536
    7    HE1  HIS  80           HE1      HIS  80   7.778  -8.267   4.501
    8    HE2  HIS  80           HE2      HIS  80   5.812  -8.775   2.971

  No H/Q in entry =           8
  In of MODEL   34
    1    H    LEU  81           H        LEU  81   9.836  -5.345  -2.212
    2    HA   LEU  81           HA       LEU  81  11.890  -3.619  -1.326
    3    HB2  LEU  81           HB2      LEU  81  10.972  -4.403  -4.093
    4    HB3  LEU  81           HB3      LEU  81  12.398  -3.407  -3.797
    5    HG   LEU  81           HG       LEU  81  11.982  -6.126  -2.527
    6   HD12  LEU  81          HD11      LEU  81  13.799  -6.764  -4.272
    7   HD11  LEU  81          HD12      LEU  81  13.246  -5.335  -5.144
    8   HD13  LEU  81          HD13      LEU  81  12.124  -6.652  -4.810
    9   HD23  LEU  81          HD21      LEU  81  14.612  -5.830  -2.504
   10   HD22  LEU  81          HD22      LEU  81  13.632  -5.064  -1.257
   11   HD21  LEU  81          HD23      LEU  81  14.221  -4.115  -2.621

  No H/Q in entry =          11
  In of MODEL   34
    1    H    MET  82           H        MET  82   8.978  -2.960  -3.271
    2    HA   MET  82           HA       MET  82   9.539  -0.238  -3.768
    3    HB2  MET  82           HB2      MET  82   6.967  -1.813  -3.653
    4    HB3  MET  82           HB3      MET  82   6.981  -0.088  -4.016
    5    HG2  MET  82           HG2      MET  82   8.571  -2.172  -5.547
    6    HG3  MET  82           HG3      MET  82   7.010  -1.538  -6.064
    7    HE3  MET  82           HE1      MET  82   7.488   1.915  -7.232
    8    HE2  MET  82           HE2      MET  82   7.106   1.690  -5.527
    9    HE1  MET  82           HE3      MET  82   6.437   0.586  -6.724

  No H/Q in entry =           9
  In of MODEL   34
    1    H    THR  83           H        THR  83   7.727  -1.825  -1.170
    2    HA   THR  83           HA       THR  83   6.889   0.529   0.155
    3    HB   THR  83           HB       THR  83   6.736  -1.046   2.171
    4    HG1  THR  83           HG1      THR  83   7.479  -3.002   1.942
    5   HG22  THR  83          HG21      THR  83   5.076  -2.598   0.697
    6   HG21  THR  83          HG22      THR  83   5.316  -1.270  -0.433
    7   HG23  THR  83          HG23      THR  83   4.673  -0.952   1.178

  No H/Q in entry =           7
  In of MODEL   34
    1    H    SER  84           H        SER  84   9.695  -1.591   0.684
    2    HA   SER  84           HA       SER  84  10.758  -0.171   2.876
    3    HB2  SER  84           HB2      SER  84  12.004  -2.022   0.854
    4    HB3  SER  84           HB3      SER  84  12.952  -1.277   2.139
    5    HG   SER  84           HG       SER  84  10.663  -2.949   2.390

  No H/Q in entry =           5
  In of MODEL   34
    1    H    MET  85           H        MET  85  11.525   0.087  -0.609
    2    HA   MET  85           HA       MET  85  13.538   2.036  -0.350
    3    HB2  MET  85           HB2      MET  85  13.134   0.756  -2.418
    4    HB3  MET  85           HB3      MET  85  11.619   1.629  -2.652
    5    HG2  MET  85           HG2      MET  85  12.844   3.760  -2.772
    6    HG3  MET  85           HG3      MET  85  14.362   2.911  -2.496
    7    HE2  MET  85           HE1      MET  85  15.569   1.791  -5.716
    8    HE1  MET  85           HE2      MET  85  15.613   1.586  -3.968
    9    HE3  MET  85           HE3      MET  85  15.805   3.192  -4.660

  No H/Q in entry =           9
  In of MODEL   34
    1    H    LEU  86           H        LEU  86  10.053   2.399  -0.870
    2    HA   LEU  86           HA       LEU  86  10.013   5.213  -1.049
    3    HB2  LEU  86           HB2      LEU  86   8.157   3.569  -1.633
    4    HB3  LEU  86           HB3      LEU  86   7.820   3.480   0.096
    5    HG   LEU  86           HG       LEU  86   7.681   6.043   0.045
    6   HD11  LEU  86          HD11      LEU  86   8.462   5.603  -2.654
    7   HD13  LEU  86          HD12      LEU  86   8.036   7.133  -1.894
    8   HD12  LEU  86          HD13      LEU  86   6.795   6.181  -2.704
    9   HD23  LEU  86          HD21      LEU  86   5.542   4.709  -1.625
   10   HD22  LEU  86          HD22      LEU  86   5.358   5.969  -0.408
   11   HD21  LEU  86          HD23      LEU  86   5.742   4.322   0.084

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ALA  87           H        ALA  87   9.519   3.036   1.694
    2    HA   ALA  87           HA       ALA  87   8.981   4.953   3.663
    3    HB1  ALA  87           HB1      ALA  87   9.764   2.126   3.577
    4    HB3  ALA  87           HB2      ALA  87   8.643   2.947   4.659
    5    HB2  ALA  87           HB3      ALA  87  10.370   2.963   5.009

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ARG  88           H        ARG  88  12.055   3.503   2.691
    2    HA   ARG  88           HA       ARG  88  13.670   4.866   4.529
    3    HB2  ARG  88           HB2      ARG  88  14.326   2.888   3.126
    4    HB3  ARG  88           HB3      ARG  88  14.493   3.981   1.755
    5    HG2  ARG  88           HG2      ARG  88  15.971   5.280   3.707
    6    HG3  ARG  88           HG3      ARG  88  16.276   3.588   4.085
    7    HD2  ARG  88           HD2      ARG  88  17.546   3.282   2.242
    8    HD3  ARG  88           HD3      ARG  88  16.420   4.164   1.206
    9    HE   ARG  88           HE       ARG  88  18.820   5.206   2.262
   10   HH21  ARG  88          HH11      ARG  88  19.185   7.422   2.070
   11   HH22  ARG  88          HH12      ARG  88  17.844   8.506   1.924
   12   HH11  ARG  88          HH21      ARG  88  15.488   5.988   1.974
   13   HH12  ARG  88          HH22      ARG  88  15.749   7.691   1.845

  No H/Q in entry =          13
  In of MODEL   34
    1    H    GLU  89           H        GLU  89  12.715   5.775   1.204
    2    HA   GLU  89           HA       GLU  89  14.283   8.122   1.054
    3    HB2  GLU  89           HB2      GLU  89  13.135   7.092  -0.898
    4    HB3  GLU  89           HB3      GLU  89  11.593   7.646  -0.244
    5    HG2  GLU  89           HG2      GLU  89  12.316   9.978  -0.403
    6    HG3  GLU  89           HG3      GLU  89  13.917   9.474  -0.935

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LEU  90           H        LEU  90  10.946   7.640   2.174
    2    HA   LEU  90           HA       LEU  90  10.452  10.377   2.750
    3    HB2  LEU  90           HB2      LEU  90   9.233   7.813   3.771
    4    HB3  LEU  90           HB3      LEU  90   8.614   9.413   4.194
    5    HG   LEU  90           HG       LEU  90   9.033   8.532   1.325
    6   HD12  LEU  90          HD11      LEU  90   6.497   8.225   1.380
    7   HD11  LEU  90          HD12      LEU  90   6.646   8.212   3.137
    8   HD13  LEU  90          HD13      LEU  90   7.457   6.976   2.174
    9   HD22  LEU  90          HD21      LEU  90   8.759  10.843   1.253
   10   HD21  LEU  90          HD22      LEU  90   7.769  10.882   2.710
   11   HD23  LEU  90          HD23      LEU  90   7.071  10.334   1.186

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  91           H        ILE  91  11.687   7.683   4.673
    2    HA   ILE  91           HA       ILE  91  11.832   9.045   7.143
    3    HB   ILE  91           HB       ILE  91  13.369   6.694   6.022
    4   HG12  ILE  91          HG12      ILE  91  11.347   6.877   8.276
    5   HG13  ILE  91          HG13      ILE  91  10.879   6.601   6.598
    6   HG22  ILE  91          HG21      ILE  91  13.829   6.474   8.664
    7   HG21  ILE  91          HG22      ILE  91  13.769   8.233   8.564
    8   HG23  ILE  91          HG23      ILE  91  14.942   7.336   7.602
    9   HD13  ILE  91          HD11      ILE  91  11.864   4.491   6.529
   10   HD12  ILE  91          HD12      ILE  91  11.267   4.553   8.187
   11   HD11  ILE  91          HD13      ILE  91  12.972   4.852   7.854

  No H/Q in entry =          11
  In of MODEL   34
    1    H    THR  92           H        THR  92  14.055   8.859   4.397
    2    HA   THR  92           HA       THR  92  16.229  10.233   5.564
    3    HB   THR  92           HB       THR  92  15.250  10.119   2.701
    4    HG1  THR  92           HG1      THR  92  16.064   8.214   3.106
    5   HG22  THR  92          HG21      THR  92  17.826  10.788   2.415
    6   HG21  THR  92          HG22      THR  92  17.521  11.610   3.944
    7   HG23  THR  92          HG23      THR  92  16.558  12.007   2.521

  No H/Q in entry =           7
  In of MODEL   34
    1    H    GLU  93           H        GLU  93  13.356  11.412   3.828
    2    HA   GLU  93           HA       GLU  93  13.974  14.168   3.947
    3    HB2  GLU  93           HB2      GLU  93  11.258  12.818   3.952
    4    HB3  GLU  93           HB3      GLU  93  11.561  14.515   3.583
    5    HG2  GLU  93           HG2      GLU  93  12.884  12.263   2.057
    6    HG3  GLU  93           HG3      GLU  93  11.345  12.960   1.566

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LEU  94           H        LEU  94  12.207  12.024   6.151
    2    HA   LEU  94           HA       LEU  94  11.409  13.976   8.027
    3    HB2  LEU  94           HB2      LEU  94  11.959  11.016   8.300
    4    HB3  LEU  94           HB3      LEU  94  11.392  11.995   9.649
    5    HG   LEU  94           HG       LEU  94   9.915  12.062   7.017
    6   HD11  LEU  94          HD11      LEU  94   9.974   9.838   9.019
    7   HD13  LEU  94          HD12      LEU  94   9.677   9.781   7.283
    8   HD12  LEU  94          HD13      LEU  94   8.400  10.307   8.379
    9   HD23  LEU  94          HD21      LEU  94   7.995  12.476   8.612
   10   HD22  LEU  94          HD22      LEU  94   9.244  13.719   8.654
   11   HD21  LEU  94          HD23      LEU  94   9.168  12.502   9.927

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  95           H        ILE  95  14.367  12.021   7.796
    2    HA   ILE  95           HA       ILE  95  15.536  12.931  10.214
    3    HB   ILE  95           HB       ILE  95  16.772  11.854   7.668
    4   HG12  ILE  95          HG12      ILE  95  16.459  10.653  10.434
    5   HG13  ILE  95          HG13      ILE  95  15.294  10.406   9.135
    6   HG21  ILE  95          HG21      ILE  95  18.028  12.648  10.314
    7   HG23  ILE  95          HG22      ILE  95  18.499  13.174   8.697
    8   HG22  ILE  95          HG23      ILE  95  18.790  11.511   9.204
    9   HD13  ILE  95          HD11      ILE  95  16.766   9.116   7.875
   10   HD12  ILE  95          HD12      ILE  95  17.231   8.662   9.512
   11   HD11  ILE  95          HD13      ILE  95  18.196   9.834   8.616

  No H/Q in entry =          11
  In of MODEL   34
    1    H    GLU  96           H        GLU  96  15.709  14.167   6.881
    2    HA   GLU  96           HA       GLU  96  17.572  16.229   7.365
    3    HB2  GLU  96           HB2      GLU  96  16.908  15.575   5.103
    4    HB3  GLU  96           HB3      GLU  96  15.269  16.145   5.400
    5    HG2  GLU  96           HG2      GLU  96  15.854  18.270   4.861
    6    HG3  GLU  96           HG3      GLU  96  17.150  18.258   6.047

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LEU  97           H        LEU  97  14.058  16.071   7.785
    2    HA   LEU  97           HA       LEU  97  13.664  18.808   8.429
    3    HB2  LEU  97           HB2      LEU  97  12.123  16.295   9.037
    4    HB3  LEU  97           HB3      LEU  97  11.621  17.845   9.708
    5    HG   LEU  97           HG       LEU  97  12.108  17.428   6.744
    6   HD12  LEU  97          HD11      LEU  97   9.584  17.322   6.620
    7   HD11  LEU  97          HD12      LEU  97   9.571  17.120   8.370
    8   HD13  LEU  97          HD13      LEU  97  10.344  15.907   7.348
    9   HD23  LEU  97          HD21      LEU  97  10.387  19.407   6.774
   10   HD22  LEU  97          HD22      LEU  97  12.070  19.752   7.171
   11   HD21  LEU  97          HD23      LEU  97  10.877  19.590   8.458

  No H/Q in entry =          11
  In of MODEL   34
    1    H    HIS  98           H        HIS  98  14.456  15.973  10.424
    2    HA   HIS  98           HA       HIS  98  14.303  17.233  12.940
    3    HB2  HIS  98           HB2      HIS  98  16.036  14.961  11.941
    4    HB3  HIS  98           HB3      HIS  98  16.035  15.498  13.622
    5    HD1  HIS  98           HD1      HIS  98  13.828  13.890  11.023
    6    HD2  HIS  98           HD2      HIS  98  13.719  14.807  15.089
    7    HE1  HIS  98           HE1      HIS  98  11.791  12.712  11.970
    8    HE2  HIS  98           HE2      HIS  98  11.704  13.262  14.441

  No H/Q in entry =           8
  In of MODEL   34
    1    H    GLU  99           H        GLU  99  16.861  17.098  10.512
    2    HA   GLU  99           HA       GLU  99  18.855  18.411  12.047
    3    HB2  GLU  99           HB2      GLU  99  19.328  17.121   9.978
    4    HB3  GLU  99           HB3      GLU  99  18.531  18.384   9.036
    5    HG2  GLU  99           HG2      GLU  99  20.152  20.040   9.832
    6    HG3  GLU  99           HG3      GLU  99  20.918  18.830  10.856

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LYS 100           H        LYS 100  16.346  19.597   9.826
    2    HA   LYS 100           HA       LYS 100  17.168  22.327   9.974
    3    HB2  LYS 100           HB2      LYS 100  14.525  21.062   9.212
    4    HB3  LYS 100           HB3      LYS 100  14.841  22.798   9.124
    5    HG2  LYS 100           HG2      LYS 100  16.812  22.334   7.662
    6    HG3  LYS 100           HG3      LYS 100  16.383  20.620   7.677
    7    HD2  LYS 100           HD2      LYS 100  14.195  21.151   6.672
    8    HD3  LYS 100           HD3      LYS 100  14.607  22.866   6.664
    9    HE2  LYS 100           HE2      LYS 100  16.565  22.369   5.208
   10    HE3  LYS 100           HE3      LYS 100  16.085  20.669   5.172
   11    HZ1  LYS 100           HZ1      LYS 100  14.281  22.879   4.335
   12    HZ3  LYS 100           HZ2      LYS 100  14.083  21.212   4.071
   13    HZ2  LYS 100           HZ3      LYS 100  15.303  22.063   3.254

  No H/Q in entry =          13
  In of MODEL   34
    1    H    LEU 101           H        LEU 101  15.047  20.298  11.933
    2    HA   LEU 101           HA       LEU 101  13.896  22.375  13.510
    3    HB2  LEU 101           HB2      LEU 101  14.311  19.421  13.892
    4    HB3  LEU 101           HB3      LEU 101  13.780  20.405  15.253
    5    HG   LEU 101           HG       LEU 101  12.370  20.509  12.580
    6   HD12  LEU 101          HD11      LEU 101  10.693  18.959  13.844
    7   HD11  LEU 101          HD12      LEU 101  12.081  18.532  14.841
    8   HD13  LEU 101          HD13      LEU 101  12.116  18.227  13.104
    9   HD21  LEU 101          HD21      LEU 101  11.713  21.305  15.432
   10   HD23  LEU 101          HD22      LEU 101  10.453  21.092  14.219
   11   HD22  LEU 101          HD23      LEU 101  11.700  22.316  13.985

  No H/Q in entry =          11
  In of MODEL   34
    1    H    LYS 102           H        LYS 102  17.039  21.739  13.080
    2    HA   LYS 102           HA       LYS 102  18.891  22.591  14.158
    3    HB2  LYS 102           HB2      LYS 102  17.088  24.122  15.289
    4    HB3  LYS 102           HB3      LYS 102  17.283  23.056  16.665
    5    HG2  LYS 102           HG2      LYS 102  19.197  25.051  15.503
    6    HG3  LYS 102           HG3      LYS 102  18.808  24.738  17.180
    7    HD2  LYS 102           HD2      LYS 102  20.461  22.812  15.496
    8    HD3  LYS 102           HD3      LYS 102  21.161  24.126  16.432
    9    HE2  LYS 102           HE2      LYS 102  20.736  21.580  17.397
   10    HE3  LYS 102           HE3      LYS 102  20.966  23.019  18.390
   11    HZ2  LYS 102           HZ1      LYS 102  18.984  21.753  19.002
   12    HZ1  LYS 102           HZ2      LYS 102  18.346  21.991  17.452
   13    HZ3  LYS 102           HZ3      LYS 102  18.586  23.317  18.480

  No H/Q in entry =          13
  In of MODEL   34
    1    H    ALA 103           H        ALA 103  16.799  21.003  16.573
    2    HA   ALA 103           HA       ALA 103  18.511  19.774  18.231
    3    HB2  ALA 103           HB1      ALA 103  16.908  17.781  18.219
    4    HB1  ALA 103           HB2      ALA 103  16.023  18.645  16.961
    5    HB3  ALA 103           HB3      ALA 103  16.204  19.362  18.560

  No H/Q in entry =           5
  In of MODEL   34
    1    H1   ALA   1           H3       ALA   1  -1.580  -6.845 -21.467
    2    H2   ALA   1           H2       ALA   1  -2.389  -8.273 -21.017
    3    H3   ALA   1           H1       ALA   1  -0.781  -8.337 -21.569
    4    HA   ALA   1           HA       ALA   1  -1.614  -8.796 -23.567
    5    HB1  ALA   1           HB1      ALA   1  -3.759  -9.494 -23.100
    6    HB2  ALA   1           HB2      ALA   1  -4.181  -7.978 -23.896
    7    HB3  ALA   1           HB3      ALA   1  -4.126  -8.061 -22.138

  No H/Q in entry =           7
  In of MODEL   34
    1    H    GLU   2           H        GLU   2  -2.428  -7.595 -25.557
    2    HA   GLU   2           HA       GLU   2  -1.007  -5.594 -26.429
    3    HB2  GLU   2           HB2      GLU   2  -4.014  -5.631 -26.754
    4    HB3  GLU   2           HB3      GLU   2  -2.882  -4.778 -27.800
    5    HG2  GLU   2           HG2      GLU   2  -2.395  -6.671 -28.956
    6    HG3  GLU   2           HG3      GLU   2  -2.110  -7.581 -27.479

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLU   3           H        GLU   3  -4.157  -4.307 -25.535
    2    HA   GLU   3           HA       GLU   3  -3.087  -1.762 -24.900
    3    HB2  GLU   3           HB2      GLU   3  -5.788  -3.051 -24.577
    4    HB3  GLU   3           HB3      GLU   3  -5.476  -1.439 -23.927
    5    HG2  GLU   3           HG2      GLU   3  -5.105  -0.513 -26.051
    6    HG3  GLU   3           HG3      GLU   3  -4.724  -2.071 -26.777

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LEU   4           H        LEU   4  -4.706  -4.108 -22.728
    2    HA   LEU   4           HA       LEU   4  -4.335  -2.887 -20.334
    3    HB2  LEU   4           HB2      LEU   4  -3.820  -5.833 -20.806
    4    HB3  LEU   4           HB3      LEU   4  -4.223  -5.085 -19.262
    5    HG   LEU   4           HG       LEU   4  -5.990  -5.137 -21.731
    6   HD13  LEU   4          HD11      LEU   4  -7.202  -6.844 -20.739
    7   HD12  LEU   4          HD12      LEU   4  -6.717  -6.392 -19.106
    8   HD11  LEU   4          HD13      LEU   4  -5.587  -7.245 -20.156
    9   HD23  LEU   4          HD21      LEU   4  -7.671  -4.312 -19.866
   10   HD22  LEU   4          HD22      LEU   4  -6.619  -3.150 -20.673
   11   HD21  LEU   4          HD23      LEU   4  -6.203  -3.747 -19.067

  No H/Q in entry =          11
  In of MODEL   34
    1    H    GLU   5           H        GLU   5  -1.852  -4.752 -22.061
    2    HA   GLU   5           HA       GLU   5   0.130  -4.491 -20.019
    3    HB2  GLU   5           HB2      GLU   5   0.192  -6.262 -21.763
    4    HB3  GLU   5           HB3      GLU   5   0.498  -5.024 -22.981
    5    HG2  GLU   5           HG2      GLU   5   2.574  -4.384 -21.846
    6    HG3  GLU   5           HG3      GLU   5   2.265  -5.567 -20.575

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLU   6           H        GLU   6  -0.481  -2.767 -23.063
    2    HA   GLU   6           HA       GLU   6   1.707  -0.958 -22.787
    3    HB2  GLU   6           HB2      GLU   6   0.570  -1.432 -24.950
    4    HB3  GLU   6           HB3      GLU   6  -0.865  -0.603 -24.346
    5    HG2  GLU   6           HG2      GLU   6   0.390   0.983 -25.661
    6    HG3  GLU   6           HG3      GLU   6   0.571   1.434 -23.968

  No H/Q in entry =           6
  In of MODEL   34
    1    H    VAL   7           H        VAL   7  -1.635  -0.997 -21.751
    2    HA   VAL   7           HA       VAL   7  -1.831   1.716 -20.911
    3    HB   VAL   7           HB       VAL   7  -3.321  -0.788 -20.082
    4   HG11  VAL   7          HG11      VAL   7  -3.669   2.103 -19.265
    5   HG13  VAL   7          HG12      VAL   7  -3.586   0.676 -18.231
    6   HG12  VAL   7          HG13      VAL   7  -5.013   0.962 -19.227
    7   HG21  VAL   7          HG21      VAL   7  -3.461   0.293 -22.469
    8   HG23  VAL   7          HG22      VAL   7  -4.396   1.550 -21.658
    9   HG22  VAL   7          HG23      VAL   7  -4.958  -0.121 -21.635

  No H/Q in entry =           9
  In of MODEL   34
    1    H    VAL   8           H        VAL   8  -0.878  -1.281 -19.270
    2    HA   VAL   8           HA       VAL   8  -0.555  -0.208 -16.672
    3    HB   VAL   8           HB       VAL   8   0.829  -2.537 -18.027
    4   HG11  VAL   8          HG11      VAL   8   0.977  -1.421 -15.241
    5   HG13  VAL   8          HG12      VAL   8   2.270  -2.068 -16.251
    6   HG12  VAL   8          HG13      VAL   8   1.119  -3.161 -15.486
    7   HG23  VAL   8          HG21      VAL   8  -1.153  -2.953 -15.843
    8   HG22  VAL   8          HG22      VAL   8  -0.955  -3.823 -17.360
    9   HG21  VAL   8          HG23      VAL   8  -1.827  -2.295 -17.333

  No H/Q in entry =           9
  In of MODEL   34
    1    H    MET   9           H        MET   9   1.697  -0.528 -19.414
    2    HA   MET   9           HA       MET   9   3.991   0.490 -18.146
    3    HB2  MET   9           HB2      MET   9   3.050   0.532 -21.011
    4    HB3  MET   9           HB3      MET   9   4.573   1.280 -20.530
    5    HG2  MET   9           HG2      MET   9   5.319  -0.869 -19.562
    6    HG3  MET   9           HG3      MET   9   3.800  -1.616 -20.060
    7    HE3  MET   9           HE1      MET   9   7.153   0.064 -22.643
    8    HE2  MET   9           HE2      MET   9   7.520  -1.001 -21.289
    9    HE1  MET   9           HE3      MET   9   6.660   0.510 -21.004

  No H/Q in entry =           9
  In of MODEL   34
    1    H    GLY  10           H        GLY  10   1.328   2.123 -19.827
    2    HA3  GLY  10           HA2      GLY  10   2.319   4.765 -19.576
    3    HA2  GLY  10           HA3      GLY  10   0.625   4.324 -19.786

  No H/Q in entry =           3
  In of MODEL   34
    1    H    LEU  11           H        LEU  11   0.204   2.797 -17.503
    2    HA   LEU  11           HA       LEU  11  -0.309   4.777 -15.541
    3    HB2  LEU  11           HB2      LEU  11  -0.275   1.761 -15.390
    4    HB3  LEU  11           HB3      LEU  11  -0.776   2.787 -14.047
    5    HG   LEU  11           HG       LEU  11  -2.007   2.919 -16.813
    6   HD13  LEU  11          HD11      LEU  11  -2.616   0.781 -16.062
    7   HD12  LEU  11          HD12      LEU  11  -3.957   1.787 -15.518
    8   HD11  LEU  11          HD13      LEU  11  -2.708   1.291 -14.376
    9   HD22  LEU  11          HD21      LEU  11  -2.578   4.939 -15.804
   10   HD21  LEU  11          HD22      LEU  11  -2.513   4.270 -14.174
   11   HD23  LEU  11          HD23      LEU  11  -3.891   3.921 -15.219

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  12           H        ILE  12   2.207   2.283 -15.782
    2    HA   ILE  12           HA       ILE  12   3.413   2.803 -13.276
    3    HB   ILE  12           HB       ILE  12   4.660   1.753 -15.837
    4   HG12  ILE  12          HG12      ILE  12   2.632   0.544 -14.693
    5   HG13  ILE  12          HG13      ILE  12   4.019  -0.407 -15.186
    6   HG21  ILE  12          HG21      ILE  12   5.628   1.678 -12.961
    7   HG23  ILE  12          HG22      ILE  12   6.415   2.472 -14.324
    8   HG22  ILE  12          HG23      ILE  12   6.325   0.713 -14.260
    9   HD11  ILE  12          HD11      ILE  12   3.577   0.693 -12.398
   10   HD13  ILE  12          HD12      ILE  12   4.848  -0.420 -12.904
   11   HD12  ILE  12          HD13      ILE  12   3.178  -0.942 -12.895

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  13           H        ILE  13   4.035   4.065 -16.529
    2    HA   ILE  13           HA       ILE  13   6.190   5.759 -15.798
    3    HB   ILE  13           HB       ILE  13   4.166   5.864 -18.047
    4   HG12  ILE  13          HG12      ILE  13   5.966   4.001 -17.784
    5   HG13  ILE  13          HG13      ILE  13   5.769   4.772 -19.353
    6   HG22  ILE  13          HG21      ILE  13   5.897   7.435 -19.123
    7   HG21  ILE  13          HG22      ILE  13   6.534   7.672 -17.499
    8   HG23  ILE  13          HG23      ILE  13   4.872   8.130 -17.866
    9   HD11  ILE  13          HD11      ILE  13   7.749   5.966 -17.435
   10   HD13  ILE  13          HD12      ILE  13   7.772   5.922 -19.194
   11   HD12  ILE  13          HD13      ILE  13   8.177   4.477 -18.274

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ASN  14           H        ASN  14   2.690   6.294 -16.071
    2    HA   ASN  14           HA       ASN  14   2.677   9.039 -15.430
    3    HB2  ASN  14           HB2      ASN  14   0.767   7.420 -16.266
    4    HB3  ASN  14           HB3      ASN  14   0.441   7.243 -14.547
    5   HD21  ASN  14          HD21      ASN  14  -1.563   8.424 -15.981
    6   HD22  ASN  14          HD22      ASN  14  -1.607  10.097 -15.711

  No H/Q in entry =           6
  In of MODEL   34
    1    H    SER  15           H        SER  15   2.346   6.163 -13.358
    2    HA   SER  15           HA       SER  15   2.050   7.533 -10.908
    3    HB2  SER  15           HB2      SER  15   2.575   5.439  -9.861
    4    HB3  SER  15           HB3      SER  15   1.743   5.032 -11.358
    5    HG   SER  15           HG       SER  15   3.484   4.075 -12.002

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLY  16           H        GLY  16   4.917   6.407 -12.664
    2    HA3  GLY  16           HA2      GLY  16   6.847   7.139 -10.729
    3    HA2  GLY  16           HA3      GLY  16   7.151   6.936 -12.452

  No H/Q in entry =           3
  In of MODEL   34
    1    H    GLN  17           H        GLN  17   5.484   8.914 -13.515
    2    HA   GLN  17           HA       GLN  17   7.086  11.238 -13.201
    3    HB2  GLN  17           HB2      GLN  17   5.788  10.806 -15.250
    4    HB3  GLN  17           HB3      GLN  17   4.286  10.975 -14.341
    5    HG2  GLN  17           HG2      GLN  17   4.831  13.298 -13.807
    6    HG3  GLN  17           HG3      GLN  17   6.380  13.145 -14.633
    7   HE21  GLN  17          HE21      GLN  17   4.394  15.076 -15.442
    8   HE22  GLN  17          HE22      GLN  17   3.845  14.638 -16.987

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ALA  18           H        ALA  18   3.973  10.250 -11.859
    2    HA   ALA  18           HA       ALA  18   3.270  12.644 -10.590
    3    HB1  ALA  18           HB1      ALA  18   2.116  10.200 -10.818
    4    HB2  ALA  18           HB2      ALA  18   1.578  11.423  -9.671
    5    HB3  ALA  18           HB3      ALA  18   2.654  10.129  -9.141

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ARG  19           H        ARG  19   5.113   9.861  -9.312
    2    HA   ARG  19           HA       ARG  19   5.653  11.009  -6.788
    3    HB2  ARG  19           HB2      ARG  19   6.044   8.603  -7.317
    4    HB3  ARG  19           HB3      ARG  19   7.407   9.078  -8.336
    5    HG2  ARG  19           HG2      ARG  19   8.533  10.103  -6.409
    6    HG3  ARG  19           HG3      ARG  19   7.152   9.727  -5.381
    7    HD2  ARG  19           HD2      ARG  19   8.897   8.074  -5.022
    8    HD3  ARG  19           HD3      ARG  19   7.517   7.307  -5.812
    9    HE   ARG  19           HE       ARG  19   9.233   8.112  -7.855
   10   HH21  ARG  19          HH11      ARG  19  10.781   6.693  -8.705
   11   HH22  ARG  19          HH12      ARG  19  11.312   5.339  -7.770
   12   HH11  ARG  19          HH21      ARG  19   9.280   6.077  -5.079
   13   HH12  ARG  19          HH22      ARG  19  10.459   4.989  -5.716

  No H/Q in entry =          13
  In of MODEL   34
    1    H    SER  20           H        SER  20   7.476  11.026  -9.833
    2    HA   SER  20           HA       SER  20   9.733  12.419  -9.003
    3    HB2  SER  20           HB2      SER  20   9.763  11.548 -11.208
    4    HB3  SER  20           HB3      SER  20   8.269  12.375 -11.637
    5    HG   SER  20           HG       SER  20  10.876  13.358 -11.388

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU  21           H        LEU  21   6.648  13.719 -10.204
    2    HA   LEU  21           HA       LEU  21   7.343  16.458  -9.974
    3    HB2  LEU  21           HB2      LEU  21   4.657  15.065  -9.890
    4    HB3  LEU  21           HB3      LEU  21   4.850  16.816  -9.913
    5    HG   LEU  21           HG       LEU  21   6.018  14.980 -12.025
    6   HD13  LEU  21          HD11      LEU  21   3.619  14.767 -12.150
    7   HD12  LEU  21          HD12      LEU  21   4.116  15.868 -13.437
    8   HD11  LEU  21          HD13      LEU  21   3.401  16.507 -11.958
    9   HD23  LEU  21          HD21      LEU  21   5.841  17.294 -13.286
   10   HD22  LEU  21          HD22      LEU  21   7.197  17.024 -12.197
   11   HD21  LEU  21          HD23      LEU  21   5.821  17.978 -11.663

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ALA  22           H        ALA  22   5.806  14.178  -7.732
    2    HA   ALA  22           HA       ALA  22   5.215  15.988  -5.663
    3    HB3  ALA  22           HB1      ALA  22   4.434  13.603  -5.831
    4    HB2  ALA  22           HB2      ALA  22   5.023  14.068  -4.235
    5    HB1  ALA  22           HB3      ALA  22   6.040  13.102  -5.306

  No H/Q in entry =           5
  In of MODEL   34
    1    H    TYR  23           H        TYR  23   8.133  13.939  -6.100
    2    HA   TYR  23           HA       TYR  23   9.520  14.943  -3.843
    3    HB2  TYR  23           HB2      TYR  23  10.292  12.930  -5.002
    4    HB3  TYR  23           HB3      TYR  23  10.617  13.869  -6.460
    5    HD1  TYR  23           HD1      TYR  23  11.578  13.498  -2.873
    6    HD2  TYR  23           HD2      TYR  23  12.654  15.044  -6.735
    7    HE1  TYR  23           HE1      TYR  23  13.839  14.055  -2.021
    8    HE2  TYR  23           HE2      TYR  23  14.915  15.602  -5.882
    9    HH   TYR  23           HH       TYR  23  15.704  15.955  -2.867

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ALA  24           H        ALA  24   9.352  16.056  -7.208
    2    HA   ALA  24           HA       ALA  24  11.264  18.126  -6.955
    3    HB2  ALA  24           HB1      ALA  24  10.826  18.195  -9.165
    4    HB3  ALA  24           HB2      ALA  24   9.276  18.956  -8.807
    5    HB1  ALA  24           HB3      ALA  24   9.388  17.202  -8.940

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA  25           H        ALA  25   7.782  17.967  -6.341
    2    HA   ALA  25           HA       ALA  25   7.322  20.688  -5.769
    3    HB1  ALA  25           HB1      ALA  25   5.646  18.702  -5.975
    4    HB2  ALA  25           HB2      ALA  25   5.286  19.992  -4.826
    5    HB3  ALA  25           HB3      ALA  25   5.963  18.465  -4.256

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU  26           H        LEU  26   8.367  17.998  -3.721
    2    HA   LEU  26           HA       LEU  26   8.478  19.425  -1.281
    3    HB2  LEU  26           HB2      LEU  26   8.556  17.008  -1.279
    4    HB3  LEU  26           HB3      LEU  26  10.028  17.006  -2.247
    5    HG   LEU  26           HG       LEU  26  11.247  18.114  -0.403
    6   HD12  LEU  26          HD11      LEU  26  10.017  18.127   1.854
    7   HD11  LEU  26          HD12      LEU  26   8.530  18.000   0.917
    8   HD13  LEU  26          HD13      LEU  26   9.585  19.399   0.712
    9   HD21  LEU  26          HD21      LEU  26   9.695  15.655   0.464
   10   HD23  LEU  26          HD22      LEU  26  11.213  16.206   1.164
   11   HD22  LEU  26          HD23      LEU  26  11.167  15.650  -0.506

  No H/Q in entry =          11
  In of MODEL   34
    1    H    LYS  27           H        LYS  27  10.895  18.839  -3.803
    2    HA   LYS  27           HA       LYS  27  13.085  20.064  -2.570
    3    HB2  LYS  27           HB2      LYS  27  13.181  18.719  -4.661
    4    HB3  LYS  27           HB3      LYS  27  12.426  20.057  -5.526
    5    HG2  LYS  27           HG2      LYS  27  14.300  21.530  -4.943
    6    HG3  LYS  27           HG3      LYS  27  15.051  20.231  -4.007
    7    HD2  LYS  27           HD2      LYS  27  15.189  18.846  -6.062
    8    HD3  LYS  27           HD3      LYS  27  14.483  20.169  -6.990
    9    HE2  LYS  27           HE2      LYS  27  16.379  21.623  -6.373
   10    HE3  LYS  27           HE3      LYS  27  17.088  20.303  -5.436
   11    HZ3  LYS  27           HZ1      LYS  27  18.083  20.399  -7.620
   12    HZ2  LYS  27           HZ2      LYS  27  16.557  20.291  -8.364
   13    HZ1  LYS  27           HZ3      LYS  27  17.170  18.976  -7.480

  No H/Q in entry =          13
  In of MODEL   34
    1    H    GLN  28           H        GLN  28  10.475  21.465  -4.521
    2    HA   GLN  28           HA       GLN  28  11.450  24.111  -4.669
    3    HB2  GLN  28           HB2      GLN  28   8.609  23.061  -4.561
    4    HB3  GLN  28           HB3      GLN  28   9.037  24.730  -4.939
    5    HG2  GLN  28           HG2      GLN  28  10.026  22.309  -6.476
    6    HG3  GLN  28           HG3      GLN  28   8.687  23.338  -6.982
    7   HE21  GLN  28          HE21      GLN  28  11.823  22.850  -7.723
    8   HE22  GLN  28          HE22      GLN  28  12.305  24.434  -8.097

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ALA  29           H        ALA  29   9.504  22.428  -2.238
    2    HA   ALA  29           HA       ALA  29   8.965  24.621  -0.554
    3    HB2  ALA  29           HB1      ALA  29   8.224  23.055   1.011
    4    HB1  ALA  29           HB2      ALA  29   9.440  21.864   0.546
    5    HB3  ALA  29           HB3      ALA  29   8.057  22.167  -0.504

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LYS  30           H        LYS  30  11.682  22.338  -0.622
    2    HA   LYS  30           HA       LYS  30  13.002  23.282   1.684
    3    HB2  LYS  30           HB2      LYS  30  14.095  21.992  -0.826
    4    HB3  LYS  30           HB3      LYS  30  15.077  22.344   0.597
    5    HG2  LYS  30           HG2      LYS  30  13.514  20.968   1.973
    6    HG3  LYS  30           HG3      LYS  30  12.629  20.553   0.501
    7    HD2  LYS  30           HD2      LYS  30  14.669  19.557  -0.458
    8    HD3  LYS  30           HD3      LYS  30  15.573  19.985   0.996
    9    HE2  LYS  30           HE2      LYS  30  14.058  18.561   2.346
   10    HE3  LYS  30           HE3      LYS  30  13.184  18.112   0.876
   11    HZ2  LYS  30           HZ1      LYS  30  14.965  16.523   1.638
   12    HZ1  LYS  30           HZ2      LYS  30  16.110  17.704   1.190
   13    HZ3  LYS  30           HZ3      LYS  30  15.072  17.027   0.023

  No H/Q in entry =          13
  In of MODEL   34
    1    H    GLN  31           H        GLN  31  12.905  24.491  -1.611
    2    HA   GLN  31           HA       GLN  31  15.068  26.371  -1.184
    3    HB2  GLN  31           HB2      GLN  31  13.029  26.432  -3.412
    4    HB3  GLN  31           HB3      GLN  31  14.653  27.119  -3.409
    5    HG2  GLN  31           HG2      GLN  31  15.099  24.420  -2.837
    6    HG3  GLN  31           HG3      GLN  31  13.796  24.374  -4.017
    7   HE21  GLN  31          HE21      GLN  31  16.636  23.565  -4.418
    8   HE22  GLN  31          HE22      GLN  31  17.216  24.537  -5.682

  No H/Q in entry =           8
  In of MODEL   34
    1    H    GLY  32           H        GLY  32  11.991  26.205  -0.044
    2    HA3  GLY  32           HA2      GLY  32  10.842  27.778   1.229
    3    HA2  GLY  32           HA3      GLY  32  11.975  29.008   0.683

  No H/Q in entry =           3
  In of MODEL   34
    1    H    ASP  33           H        ASP  33  10.604  27.115  -1.814
    2    HA   ASP  33           HA       ASP  33   8.953  29.398  -2.669
    3    HB2  ASP  33           HB2      ASP  33  10.035  26.974  -4.113
    4    HB3  ASP  33           HB3      ASP  33   8.891  28.097  -4.844

  No H/Q in entry =           4
  In of MODEL   34
    1    H    PHE  34           H        PHE  34   7.260  28.930  -1.109
    2    HA   PHE  34           HA       PHE  34   5.866  26.465  -1.019
    3    HB2  PHE  34           HB2      PHE  34   4.920  29.257  -0.337
    4    HB3  PHE  34           HB3      PHE  34   4.062  27.771   0.071
    5    HD1  PHE  34           HD1      PHE  34   6.323  30.155   1.292
    6    HD2  PHE  34           HD2      PHE  34   5.620  25.918   1.232
    7    HE1  PHE  34           HE1      PHE  34   7.710  29.894   3.331
    8    HE2  PHE  34           HE2      PHE  34   7.008  25.661   3.269
    9    HZ   PHE  34           HZ       PHE  34   8.047  27.650   4.317

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ALA  35           H        ALA  35   5.455  29.334  -3.027
    2    HA   ALA  35           HA       ALA  35   2.902  28.735  -4.056
    3    HB1  ALA  35           HB1      ALA  35   3.965  30.124  -6.091
    4    HB3  ALA  35           HB2      ALA  35   5.183  30.477  -4.865
    5    HB2  ALA  35           HB3      ALA  35   3.494  30.895  -4.576

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA  36           H        ALA  36   6.129  28.046  -5.407
    2    HA   ALA  36           HA       ALA  36   5.136  26.625  -7.653
    3    HB3  ALA  36           HB1      ALA  36   7.296  26.738  -8.266
    4    HB2  ALA  36           HB2      ALA  36   7.770  25.705  -6.916
    5    HB1  ALA  36           HB3      ALA  36   7.673  27.453  -6.698

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA  37           H        ALA  37   6.081  25.621  -4.398
    2    HA   ALA  37           HA       ALA  37   6.008  22.834  -4.831
    3    HB2  ALA  37           HB1      ALA  37   5.753  24.623  -2.451
    4    HB1  ALA  37           HB2      ALA  37   6.879  23.300  -2.743
    5    HB3  ALA  37           HB3      ALA  37   5.215  22.954  -2.275

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LYS  38           H        LYS  38   3.485  25.054  -3.664
    2    HA   LYS  38           HA       LYS  38   1.375  23.252  -3.447
    3    HB2  LYS  38           HB2      LYS  38   1.742  26.006  -3.192
    4    HB3  LYS  38           HB3      LYS  38   0.543  25.867  -4.473
    5    HG2  LYS  38           HG2      LYS  38  -0.915  24.550  -3.034
    6    HG3  LYS  38           HG3      LYS  38   0.326  24.481  -1.776
    7    HD2  LYS  38           HD2      LYS  38   0.153  26.818  -1.326
    8    HD3  LYS  38           HD3      LYS  38  -0.755  27.114  -2.809
    9    HE2  LYS  38           HE2      LYS  38  -2.262  27.154  -0.872
   10    HE3  LYS  38           HE3      LYS  38  -2.642  25.781  -1.916
   11    HZ3  LYS  38           HZ1      LYS  38  -1.926  24.305  -0.384
   12    HZ2  LYS  38           HZ2      LYS  38  -2.272  25.562   0.706
   13    HZ1  LYS  38           HZ3      LYS  38  -0.678  25.304   0.183

  No H/Q in entry =          13
  In of MODEL   34
    1    H    ALA  39           H        ALA  39   2.370  25.153  -6.292
    2    HA   ALA  39           HA       ALA  39   0.292  24.299  -7.999
    3    HB2  ALA  39           HB1      ALA  39   3.033  24.934  -9.048
    4    HB1  ALA  39           HB2      ALA  39   2.073  26.199  -8.282
    5    HB3  ALA  39           HB3      ALA  39   1.458  25.367  -9.711

  No H/Q in entry =           5
  In of MODEL   34
    1    H    MET  40           H        MET  40   3.522  22.982  -7.416
    2    HA   MET  40           HA       MET  40   3.416  20.965  -9.410
    3    HB2  MET  40           HB2      MET  40   5.025  21.177  -6.859
    4    HB3  MET  40           HB3      MET  40   5.271  19.921  -8.074
    5    HG2  MET  40           HG2      MET  40   5.345  22.877  -8.736
    6    HG3  MET  40           HG3      MET  40   6.786  21.966  -8.286
    7    HE3  MET  40           HE1      MET  40   7.651  19.750 -11.096
    8    HE2  MET  40           HE2      MET  40   7.083  19.432  -9.459
    9    HE1  MET  40           HE3      MET  40   8.186  20.773  -9.756

  No H/Q in entry =           9
  In of MODEL   34
    1    H    MET  41           H        MET  41   2.496  21.008  -5.987
    2    HA   MET  41           HA       MET  41   1.949  18.245  -5.714
    3    HB2  MET  41           HB2      MET  41   0.627  20.608  -4.362
    4    HB3  MET  41           HB3      MET  41   0.461  18.931  -3.856
    5    HG2  MET  41           HG2      MET  41   3.173  19.140  -3.889
    6    HG3  MET  41           HG3      MET  41   2.740  20.800  -3.492
    7    HE2  MET  41           HE1      MET  41  -0.308  19.560  -1.773
    8    HE1  MET  41           HE2      MET  41   0.517  21.070  -2.147
    9    HE3  MET  41           HE3      MET  41   0.452  20.497  -0.480

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ASP  42           H        ASP  42  -0.074  20.982  -6.688
    2    HA   ASP  42           HA       ASP  42  -2.521  19.633  -6.830
    3    HB2  ASP  42           HB2      ASP  42  -1.801  22.201  -7.082
    4    HB3  ASP  42           HB3      ASP  42  -1.951  21.808  -8.791

  No H/Q in entry =           4
  In of MODEL   34
    1    H    GLN  43           H        GLN  43  -0.074  20.215  -9.327
    2    HA   GLN  43           HA       GLN  43  -1.464  18.905 -11.420
    3    HB2  GLN  43           HB2      GLN  43   1.496  19.406 -11.033
    4    HB3  GLN  43           HB3      GLN  43   0.782  18.772 -12.518
    5    HG2  GLN  43           HG2      GLN  43  -0.720  20.806 -12.559
    6    HG3  GLN  43           HG3      GLN  43   0.234  21.456 -11.229
    7   HE21  GLN  43          HE21      GLN  43   0.407  23.078 -13.313
    8   HE22  GLN  43          HE22      GLN  43   1.822  22.851 -14.218

  No H/Q in entry =           8
  In of MODEL   34
    1    H    SER  44           H        SER  44   0.878  17.751  -9.027
    2    HA   SER  44           HA       SER  44   1.201  15.144 -10.055
    3    HB2  SER  44           HB2      SER  44   2.100  16.576  -7.816
    4    HB3  SER  44           HB3      SER  44   1.230  15.195  -7.148
    5    HG   SER  44           HG       SER  44   3.338  14.566  -7.572

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ARG  45           H        ARG  45  -1.116  16.470  -7.719
    2    HA   ARG  45           HA       ARG  45  -2.514  14.115  -7.089
    3    HB2  ARG  45           HB2      ARG  45  -2.705  16.283  -5.895
    4    HB3  ARG  45           HB3      ARG  45  -3.555  16.955  -7.283
    5    HG2  ARG  45           HG2      ARG  45  -5.330  15.237  -7.004
    6    HG3  ARG  45           HG3      ARG  45  -4.490  14.620  -5.581
    7    HD2  ARG  45           HD2      ARG  45  -4.688  16.886  -4.522
    8    HD3  ARG  45           HD3      ARG  45  -5.671  17.412  -5.906
    9    HE   ARG  45           HE       ARG  45  -6.793  15.040  -4.870
   10   HH21  ARG  45          HH11      ARG  45  -8.631  15.122  -3.602
   11   HH22  ARG  45          HH12      ARG  45  -9.021  16.562  -2.732
   12   HH11  ARG  45          HH21      ARG  45  -6.235  18.283  -3.841
   13   HH12  ARG  45          HH22      ARG  45  -7.659  18.352  -2.866

  No H/Q in entry =          13
  In of MODEL   34
    1    H    MET  46           H        MET  46  -3.084  16.525  -9.638
    2    HA   MET  46           HA       MET  46  -5.426  15.364 -10.705
    3    HB2  MET  46           HB2      MET  46  -3.315  17.185 -11.871
    4    HB3  MET  46           HB3      MET  46  -4.696  16.633 -12.827
    5    HG2  MET  46           HG2      MET  46  -6.246  17.575 -11.192
    6    HG3  MET  46           HG3      MET  46  -4.908  18.049 -10.152
    7    HE3  MET  46           HE1      MET  46  -5.183  18.642 -14.332
    8    HE2  MET  46           HE2      MET  46  -6.474  19.791 -13.997
    9    HE1  MET  46           HE3      MET  46  -6.590  18.142 -13.385

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ALA  47           H        ALA  47  -1.998  14.871 -11.458
    2    HA   ALA  47           HA       ALA  47  -2.347  13.148 -13.671
    3    HB3  ALA  47           HB1      ALA  47  -0.166  14.028 -13.314
    4    HB2  ALA  47           HB2      ALA  47  -0.033  12.299 -12.982
    5    HB1  ALA  47           HB3      ALA  47  -0.123  13.450 -11.648

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU  48           H        LEU  48  -2.086  12.507 -10.197
    2    HA   LEU  48           HA       LEU  48  -2.191   9.668 -10.359
    3    HB2  LEU  48           HB2      LEU  48  -2.951  11.586  -8.144
    4    HB3  LEU  48           HB3      LEU  48  -2.865   9.835  -7.946
    5    HG   LEU  48           HG       LEU  48  -0.557  11.526  -8.937
    6   HD13  LEU  48          HD11      LEU  48  -0.841  12.295  -6.746
    7   HD12  LEU  48          HD12      LEU  48   0.317  10.983  -6.547
    8   HD11  LEU  48          HD13      LEU  48  -1.383  10.726  -6.153
    9   HD22  LEU  48          HD21      LEU  48  -0.066   9.340  -9.580
   10   HD21  LEU  48          HD22      LEU  48  -0.941   8.626  -8.226
   11   HD23  LEU  48          HD23      LEU  48   0.634   9.373  -7.962

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ASN  49           H        ASN  49  -4.645  12.169  -9.959
    2    HA   ASN  49           HA       ASN  49  -6.839  10.513  -9.425
    3    HB2  ASN  49           HB2      ASN  49  -6.872  12.943  -9.106
    4    HB3  ASN  49           HB3      ASN  49  -6.735  13.193 -10.841
    5   HD21  ASN  49          HD21      ASN  49  -8.925  14.248  -9.385
    6   HD22  ASN  49          HD22      ASN  49 -10.335  13.431  -9.853

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLU  50           H        GLU  50  -5.549  11.708 -12.509
    2    HA   GLU  50           HA       GLU  50  -7.505  10.463 -14.160
    3    HB2  GLU  50           HB2      GLU  50  -6.031  12.277 -14.969
    4    HB3  GLU  50           HB3      GLU  50  -4.641  11.199 -14.830
    5    HG2  GLU  50           HG2      GLU  50  -5.618   9.669 -16.470
    6    HG3  GLU  50           HG3      GLU  50  -7.075  10.653 -16.559

  No H/Q in entry =           6
  In of MODEL   34
    1    H    ALA  51           H        ALA  51  -4.341   9.456 -12.949
    2    HA   ALA  51           HA       ALA  51  -4.209   7.004 -14.370
    3    HB2  ALA  51           HB1      ALA  51  -2.231   6.707 -13.267
    4    HB1  ALA  51           HB2      ALA  51  -2.920   7.131 -11.700
    5    HB3  ALA  51           HB3      ALA  51  -2.457   8.401 -12.832

  No H/Q in entry =           5
  In of MODEL   34
    1    H    HIS  52           H        HIS  52  -5.384   7.837 -11.122
    2    HA   HIS  52           HA       HIS  52  -6.082   5.229 -10.295
    3    HB2  HIS  52           HB2      HIS  52  -5.937   7.207  -8.793
    4    HB3  HIS  52           HB3      HIS  52  -7.411   7.838  -9.528
    5    HD1  HIS  52           HD1      HIS  52  -9.624   6.447  -9.137
    6    HD2  HIS  52           HD2      HIS  52  -6.340   5.141  -6.928
    7    HE1  HIS  52           HE1      HIS  52 -10.533   4.903  -7.346
    8    HE2  HIS  52           HE2      HIS  52  -8.542   4.098  -5.991

  No H/Q in entry =           8
  In of MODEL   34
    1    H    LEU  53           H        LEU  53  -7.888   7.697 -12.084
    2    HA   LEU  53           HA       LEU  53 -10.399   6.416 -12.103
    3    HB2  LEU  53           HB2      LEU  53  -9.103   8.394 -13.966
    4    HB3  LEU  53           HB3      LEU  53 -10.703   7.735 -14.295
    5    HG   LEU  53           HG       LEU  53  -9.994   9.041 -11.648
    6   HD13  LEU  53          HD11      LEU  53  -9.696  10.792 -13.226
    7   HD12  LEU  53          HD12      LEU  53 -11.349  10.988 -12.645
    8   HD11  LEU  53          HD13      LEU  53 -11.045  10.242 -14.212
    9   HD21  LEU  53          HD21      LEU  53 -12.550   8.173 -13.008
   10   HD23  LEU  53          HD22      LEU  53 -12.570   9.446 -11.793
   11   HD22  LEU  53          HD23      LEU  53 -12.027   7.836 -11.363

  No H/Q in entry =          11
  In of MODEL   34
    1    H    VAL  54           H        VAL  54  -7.645   6.209 -14.335
    2    HA   VAL  54           HA       VAL  54  -8.872   4.446 -16.182
    3    HB   VAL  54           HB       VAL  54  -5.963   4.938 -15.493
    4   HG12  VAL  54          HG11      VAL  54  -5.716   3.854 -17.883
    5   HG11  VAL  54          HG12      VAL  54  -7.249   3.080 -17.484
    6   HG13  VAL  54          HG13      VAL  54  -5.837   2.818 -16.462
    7   HG22  VAL  54          HG21      VAL  54  -6.722   6.886 -16.538
    8   HG21  VAL  54          HG22      VAL  54  -7.917   6.029 -17.509
    9   HG23  VAL  54          HG23      VAL  54  -6.210   5.942 -17.936

  No H/Q in entry =           9
  In of MODEL   34
    1    H    GLN  55           H        GLN  55  -6.882   3.887 -13.279
    2    HA   GLN  55           HA       GLN  55  -6.805   1.070 -13.539
    3    HB2  GLN  55           HB2      GLN  55  -5.248   1.957 -12.015
    4    HB3  GLN  55           HB3      GLN  55  -6.462   2.928 -11.187
    5    HG2  GLN  55           HG2      GLN  55  -7.162   1.172  -9.873
    6    HG3  GLN  55           HG3      GLN  55  -6.940  -0.014 -11.152
    7   HE21  GLN  55          HE21      GLN  55  -5.324  -1.472 -10.656
    8   HE22  GLN  55          HE22      GLN  55  -3.940  -1.129  -9.741

  No H/Q in entry =           8
  In of MODEL   34
    1    H    THR  56           H        THR  56  -9.129   3.242 -11.927
    2    HA   THR  56           HA       THR  56 -10.725   1.365 -10.643
    3    HB   THR  56           HB       THR  56 -11.802   3.762 -12.148
    4    HG1  THR  56           HG1      THR  56  -9.963   3.675 -10.249
    5   HG23  THR  56          HG21      THR  56 -13.601   3.687 -10.639
    6   HG22  THR  56          HG22      THR  56 -12.718   2.675  -9.494
    7   HG21  THR  56          HG23      THR  56 -13.313   1.987 -11.006

  No H/Q in entry =           7
  In of MODEL   34
    1    H    LYS  57           H        LYS  57 -10.914   2.453 -14.028
    2    HA   LYS  57           HA       LYS  57 -13.077   0.777 -14.788
    3    HB2  LYS  57           HB2      LYS  57 -12.181   2.727 -16.098
    4    HB3  LYS  57           HB3      LYS  57 -10.753   1.771 -16.472
    5    HG2  LYS  57           HG2      LYS  57 -12.143   0.108 -17.625
    6    HG3  LYS  57           HG3      LYS  57 -13.593   1.021 -17.226
    7    HD2  LYS  57           HD2      LYS  57 -12.754   2.938 -18.540
    8    HD3  LYS  57           HD3      LYS  57 -11.299   2.030 -18.944
    9    HE2  LYS  57           HE2      LYS  57 -12.918   1.887 -20.792
   10    HE3  LYS  57           HE3      LYS  57 -12.715   0.295 -20.060
   11    HZ3  LYS  57           HZ1      LYS  57 -14.739   0.476 -18.941
   12    HZ2  LYS  57           HZ2      LYS  57 -15.062   1.066 -20.502
   13    HZ1  LYS  57           HZ3      LYS  57 -14.854   2.148 -19.207

  No H/Q in entry =          13
  In of MODEL   34
    1    H    LEU  58           H        LEU  58  -9.575   0.328 -14.724
    2    HA   LEU  58           HA       LEU  58  -9.593  -2.187 -16.015
    3    HB2  LEU  58           HB2      LEU  58  -7.556  -0.908 -14.201
    4    HB3  LEU  58           HB3      LEU  58  -7.301  -2.429 -15.056
    5    HG   LEU  58           HG       LEU  58  -8.039   0.180 -16.418
    6   HD11  LEU  58          HD11      LEU  58  -5.400  -1.071 -15.722
    7   HD13  LEU  58          HD12      LEU  58  -5.887   0.622 -15.673
    8   HD12  LEU  58          HD13      LEU  58  -5.548  -0.149 -17.219
    9   HD22  LEU  58          HD21      LEU  58  -8.619  -1.378 -18.012
   10   HD21  LEU  58          HD22      LEU  58  -7.585  -2.631 -17.329
   11   HD23  LEU  58          HD23      LEU  58  -6.886  -1.360 -18.332

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  59           H        ILE  59 -10.418  -1.284 -12.765
    2    HA   ILE  59           HA       ILE  59 -10.082  -4.053 -11.819
    3    HB   ILE  59           HB       ILE  59  -9.632  -1.788 -10.418
    4   HG12  ILE  59          HG12      ILE  59 -11.010  -4.135  -9.096
    5   HG13  ILE  59          HG13      ILE  59  -9.368  -4.222  -9.682
    6   HG21  ILE  59          HG21      ILE  59 -12.179  -1.282 -10.678
    7   HG23  ILE  59          HG22      ILE  59 -11.452  -1.078  -9.101
    8   HG22  ILE  59          HG23      ILE  59 -12.396  -2.521  -9.464
    9   HD13  ILE  59          HD11      ILE  59  -8.665  -2.432  -8.237
   10   HD12  ILE  59          HD12      ILE  59  -9.524  -3.613  -7.256
   11   HD11  ILE  59          HD13      ILE  59 -10.328  -2.120  -7.744

  No H/Q in entry =          11
  In of MODEL   34
    1    H    GLU  60           H        GLU  60 -12.627  -1.725 -12.631
    2    HA   GLU  60           HA       GLU  60 -14.821  -3.232 -11.625
    3    HB2  GLU  60           HB2      GLU  60 -15.058  -0.873 -12.200
    4    HB3  GLU  60           HB3      GLU  60 -14.670  -1.214 -13.883
    5    HG2  GLU  60           HG2      GLU  60 -16.690  -2.656 -14.037
    6    HG3  GLU  60           HG3      GLU  60 -17.095  -2.237 -12.386

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLY  61           H        GLY  61 -13.140  -3.222 -14.736
    2    HA3  GLY  61           HA2      GLY  61 -14.862  -5.458 -15.632
    3    HA2  GLY  61           HA3      GLY  61 -14.009  -4.356 -16.707

  No H/Q in entry =           3
  In of MODEL   34
    1    H    ASP  62           H        ASP  62 -12.654  -5.820 -13.820
    2    HA   ASP  62           HA       ASP  62 -10.265  -6.593 -15.010
    3    HB2  ASP  62           HB2      ASP  62  -9.944  -7.955 -12.977
    4    HB3  ASP  62           HB3      ASP  62 -10.572  -6.356 -12.593

  No H/Q in entry =           4
  In of MODEL   34
    1    H    ALA  63           H        ALA  63  -9.735  -8.179 -16.437
    2    HA   ALA  63           HA       ALA  63 -10.906 -10.835 -16.267
    3    HB1  ALA  63           HB1      ALA  63 -11.357  -9.183 -18.779
    4    HB3  ALA  63           HB2      ALA  63 -12.611  -9.521 -17.586
    5    HB2  ALA  63           HB3      ALA  63 -11.887 -10.843 -18.504

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLY  64           H        GLY  64 -10.228 -10.531 -19.386
    2    HA3  GLY  64           HA2      GLY  64  -8.302 -10.622 -20.716
    3    HA2  GLY  64           HA3      GLY  64  -7.315 -10.535 -19.263

  No H/Q in entry =           3
  In of MODEL   34
    1    H    GLU  65           H        GLU  65  -9.587 -12.778 -18.551
    2    HA   GLU  65           HA       GLU  65  -8.157 -14.999 -19.839
    3    HB2  GLU  65           HB2      GLU  65  -8.579 -14.709 -16.864
    4    HB3  GLU  65           HB3      GLU  65  -8.045 -16.192 -17.656
    5    HG2  GLU  65           HG2      GLU  65  -6.623 -13.523 -17.859
    6    HG3  GLU  65           HG3      GLU  65  -6.142 -14.838 -16.788

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLY  66           H        GLY  66  -9.182 -16.986 -19.814
    2    HA3  GLY  66           HA2      GLY  66 -11.932 -16.985 -20.377
    3    HA2  GLY  66           HA3      GLY  66 -10.921 -18.404 -20.183

  No H/Q in entry =           3
  In of MODEL   34
    1    H    LYS  67           H        LYS  67 -10.180 -17.916 -17.480
    2    HA   LYS  67           HA       LYS  67 -12.574 -18.922 -16.186
    3    HB2  LYS  67           HB2      LYS  67  -9.681 -18.789 -15.356
    4    HB3  LYS  67           HB3      LYS  67 -10.963 -19.433 -14.322
    5    HG2  LYS  67           HG2      LYS  67 -11.589 -21.042 -16.082
    6    HG3  LYS  67           HG3      LYS  67 -10.323 -20.399 -17.126
    7    HD2  LYS  67           HD2      LYS  67  -8.623 -21.063 -15.437
    8    HD3  LYS  67           HD3      LYS  67  -9.908 -21.769 -14.454
    9    HE2  LYS  67           HE2      LYS  67  -9.350 -22.573 -17.324
   10    HE3  LYS  67           HE3      LYS  67  -8.720 -23.440 -15.923
   11    HZ1  LYS  67           HZ1      LYS  67 -11.143 -23.530 -15.183
   12    HZ3  LYS  67           HZ2      LYS  67 -10.670 -24.553 -16.454
   13    HZ2  LYS  67           HZ3      LYS  67 -11.527 -23.123 -16.784

  No H/Q in entry =          13
  In of MODEL   34
    1    H    MET  68           H        MET  68 -12.310 -18.397 -13.633
    2    HA   MET  68           HA       MET  68 -13.566 -15.913 -13.267
    3    HB2  MET  68           HB2      MET  68 -12.297 -17.781 -11.265
    4    HB3  MET  68           HB3      MET  68 -13.358 -16.435 -10.854
    5    HG2  MET  68           HG2      MET  68 -14.120 -18.738 -12.674
    6    HG3  MET  68           HG3      MET  68 -14.583 -18.601 -10.977
    7    HE3  MET  68           HE1      MET  68 -17.016 -16.066 -10.538
    8    HE2  MET  68           HE2      MET  68 -15.479 -15.226 -10.749
    9    HE1  MET  68           HE3      MET  68 -15.513 -16.803  -9.961

  No H/Q in entry =           9
  In of MODEL   34
    1    H    LYS  69           H        LYS  69 -10.164 -16.835 -12.696
    2    HA   LYS  69           HA       LYS  69  -9.209 -14.884 -11.121
    3    HB2  LYS  69           HB2      LYS  69  -7.964 -16.006 -13.627
    4    HB3  LYS  69           HB3      LYS  69  -7.078 -14.986 -12.492
    5    HG2  LYS  69           HG2      LYS  69  -7.594 -16.560 -10.663
    6    HG3  LYS  69           HG3      LYS  69  -8.497 -17.575 -11.787
    7    HD2  LYS  69           HD2      LYS  69  -6.434 -17.915 -13.120
    8    HD3  LYS  69           HD3      LYS  69  -5.536 -16.941 -11.954
    9    HE2  LYS  69           HE2      LYS  69  -7.082 -19.443 -11.221
   10    HE3  LYS  69           HE3      LYS  69  -5.352 -19.421 -11.558
   11    HZ1  LYS  69           HZ1      LYS  69  -6.207 -17.417  -9.674
   12    HZ3  LYS  69           HZ2      LYS  69  -4.905 -18.504  -9.590
   13    HZ2  LYS  69           HZ3      LYS  69  -6.464 -19.006  -9.138

  No H/Q in entry =          13
  In of MODEL   34
    1    H    VAL  70           H        VAL  70  -7.521 -13.084 -11.948
    2    HA   VAL  70           HA       VAL  70  -8.962 -11.220 -13.747
    3    HB   VAL  70           HB       VAL  70  -8.310  -9.392 -12.213
    4   HG11  VAL  70          HG11      VAL  70  -9.889 -11.655 -10.954
    5   HG13  VAL  70          HG12      VAL  70 -10.534 -10.384 -11.993
    6   HG12  VAL  70          HG13      VAL  70  -9.914  -9.984 -10.392
    7   HG23  VAL  70          HG21      VAL  70  -7.682 -10.335  -9.805
    8   HG22  VAL  70          HG22      VAL  70  -6.428 -10.074 -11.016
    9   HG21  VAL  70          HG23      VAL  70  -7.058 -11.696 -10.736

  No H/Q in entry =           9
  In of MODEL   34
    1    H    SER  71           H        SER  71  -7.499  -9.404 -14.438
    2    HA   SER  71           HA       SER  71  -5.193 -10.380 -15.744
    3    HB2  SER  71           HB2      SER  71  -6.513  -8.362 -16.445
    4    HB3  SER  71           HB3      SER  71  -5.840  -7.501 -15.063
    5    HG   SER  71           HG       SER  71  -4.485  -7.077 -16.735

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU  72           H        LEU  72  -3.218 -10.701 -15.050
    2    HA   LEU  72           HA       LEU  72  -2.504 -10.491 -12.336
    3    HB2  LEU  72           HB2      LEU  72  -0.958 -11.036 -14.850
    4    HB3  LEU  72           HB3      LEU  72  -0.144 -10.900 -13.295
    5    HG   LEU  72           HG       LEU  72  -2.483 -12.774 -13.782
    6   HD11  LEU  72          HD11      LEU  72  -0.476 -13.304 -15.209
    7   HD13  LEU  72          HD12      LEU  72  -0.861 -14.559 -14.032
    8   HD12  LEU  72          HD13      LEU  72   0.474 -13.445 -13.729
    9   HD21  LEU  72          HD21      LEU  72  -0.575 -12.250 -11.522
   10   HD23  LEU  72          HD22      LEU  72  -1.164 -13.889 -11.747
   11   HD22  LEU  72          HD23      LEU  72  -2.303 -12.576 -11.458

  No H/Q in entry =          11
  In of MODEL   34
    1    H    VAL  73           H        VAL  73  -1.770  -8.478 -15.114
    2    HA   VAL  73           HA       VAL  73   0.158  -6.791 -14.005
    3    HB   VAL  73           HB       VAL  73  -0.226  -5.367 -15.861
    4   HG11  VAL  73          HG11      VAL  73   0.605  -7.703 -16.331
    5   HG13  VAL  73          HG12      VAL  73  -0.192  -6.932 -17.702
    6   HG12  VAL  73          HG13      VAL  73  -1.050  -8.144 -16.751
    7   HG22  VAL  73          HG21      VAL  73  -2.489  -4.836 -15.909
    8   HG21  VAL  73          HG22      VAL  73  -2.991  -6.513 -15.704
    9   HG23  VAL  73          HG23      VAL  73  -2.393  -5.957 -17.267

  No H/Q in entry =           9
  In of MODEL   34
    1    H    LEU  74           H        LEU  74  -3.241  -6.887 -13.456
    2    HA   LEU  74           HA       LEU  74  -3.846  -4.228 -12.845
    3    HB2  LEU  74           HB2      LEU  74  -5.581  -5.890 -13.025
    4    HB3  LEU  74           HB3      LEU  74  -4.902  -6.809 -11.684
    5    HG   LEU  74           HG       LEU  74  -5.361  -4.914 -10.158
    6   HD13  LEU  74          HD11      LEU  74  -5.250  -2.990 -11.533
    7   HD12  LEU  74          HD12      LEU  74  -6.965  -3.148 -11.157
    8   HD11  LEU  74          HD13      LEU  74  -6.354  -3.676 -12.727
    9   HD23  LEU  74          HD21      LEU  74  -7.914  -5.359 -11.619
   10   HD22  LEU  74          HD22      LEU  74  -7.546  -5.483  -9.912
   11   HD21  LEU  74          HD23      LEU  74  -7.060  -6.766 -10.992

  No H/Q in entry =          11
  In of MODEL   34
    1    H    VAL  75           H        VAL  75  -2.826  -6.822 -10.681
    2    HA   VAL  75           HA       VAL  75  -2.624  -5.272  -8.336
    3    HB   VAL  75           HB       VAL  75  -1.141  -7.776  -9.123
    4   HG11  VAL  75          HG11      VAL  75  -1.344  -6.304  -6.458
    5   HG13  VAL  75          HG12      VAL  75   0.117  -6.572  -7.396
    6   HG12  VAL  75          HG13      VAL  75  -0.704  -7.933  -6.650
    7   HG22  VAL  75          HG21      VAL  75  -2.811  -8.846  -7.689
    8   HG21  VAL  75          HG22      VAL  75  -3.637  -7.904  -8.930
    9   HG23  VAL  75          HG23      VAL  75  -3.511  -7.278  -7.285

  No H/Q in entry =           9
  In of MODEL   34
    1    H    GLU  76           H        GLU  76  -0.213  -6.046 -10.866
    2    HA   GLU  76           HA       GLU  76   1.977  -4.711  -9.703
    3    HB2  GLU  76           HB2      GLU  76   2.193  -6.183 -11.679
    4    HB3  GLU  76           HB3      GLU  76   1.269  -5.040 -12.641
    5    HG2  GLU  76           HG2      GLU  76   3.603  -4.690 -13.144
    6    HG3  GLU  76           HG3      GLU  76   3.073  -3.315 -12.196

  No H/Q in entry =           6
  In of MODEL   34
    1    H    ALA  77           H        ALA  77  -0.542  -3.495 -11.898
    2    HA   ALA  77           HA       ALA  77   0.464  -0.854 -12.070
    3    HB3  ALA  77           HB1      ALA  77  -2.393  -1.837 -12.326
    4    HB1  ALA  77           HB2      ALA  77  -1.214  -1.746 -13.634
    5    HB2  ALA  77           HB3      ALA  77  -1.793  -0.268 -12.867

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLN  78           H        GLN  78  -1.819  -2.398  -9.866
    2    HA   GLN  78           HA       GLN  78  -2.617  -0.075  -8.466
    3    HB2  GLN  78           HB2      GLN  78  -3.677  -2.401  -8.413
    4    HB3  GLN  78           HB3      GLN  78  -2.397  -2.853  -7.289
    5    HG2  GLN  78           HG2      GLN  78  -3.101  -1.169  -5.712
    6    HG3  GLN  78           HG3      GLN  78  -4.259  -0.504  -6.863
    7   HE21  GLN  78          HE21      GLN  78  -5.743  -2.532  -7.784
    8   HE22  GLN  78          HE22      GLN  78  -6.424  -3.460  -6.536

  No H/Q in entry =           8
  In of MODEL   34
    1    H    LEU  79           H        LEU  79   0.048  -2.345  -8.009
    2    HA   LEU  79           HA       LEU  79   1.022  -1.454  -5.549
    3    HB2  LEU  79           HB2      LEU  79   1.885  -3.467  -6.615
    4    HB3  LEU  79           HB3      LEU  79   2.539  -2.518  -7.946
    5    HG   LEU  79           HG       LEU  79   4.096  -1.387  -6.437
    6   HD13  LEU  79          HD11      LEU  79   3.087  -1.138  -4.373
    7   HD12  LEU  79          HD12      LEU  79   4.158  -2.493  -4.027
    8   HD11  LEU  79          HD13      LEU  79   2.452  -2.784  -4.361
    9   HD23  LEU  79          HD21      LEU  79   5.294  -3.542  -5.531
   10   HD22  LEU  79          HD22      LEU  79   5.096  -3.341  -7.270
   11   HD21  LEU  79          HD23      LEU  79   4.010  -4.406  -6.381

  No H/Q in entry =          11
  In of MODEL   34
    1    H    HIS  80           H        HIS  80   1.907  -0.341  -8.819
    2    HA   HIS  80           HA       HIS  80   3.721   1.638  -7.891
    3    HB2  HIS  80           HB2      HIS  80   2.436   0.951 -10.477
    4    HB3  HIS  80           HB3      HIS  80   3.037   2.600 -10.304
    5    HD1  HIS  80           HD1      HIS  80   5.442   2.890 -10.819
    6    HD2  HIS  80           HD2      HIS  80   4.602  -1.018  -9.632
    7    HE1  HIS  80           HE1      HIS  80   7.627   1.603 -10.979
    8    HE2  HIS  80           HE2      HIS  80   7.126  -0.782 -10.259

  No H/Q in entry =           8
  In of MODEL   34
    1    H    LEU  81           H        LEU  81   0.321   1.813  -8.880
    2    HA   LEU  81           HA       LEU  81   0.056   4.607  -8.549
    3    HB2  LEU  81           HB2      LEU  81  -1.968   2.370  -8.477
    4    HB3  LEU  81           HB3      LEU  81  -2.414   4.074  -8.386
    5    HG   LEU  81           HG       LEU  81  -0.719   2.919 -10.617
    6   HD12  LEU  81          HD11      LEU  81  -2.945   3.248 -11.923
    7   HD11  LEU  81          HD12      LEU  81  -3.706   3.182 -10.333
    8   HD13  LEU  81          HD13      LEU  81  -2.767   1.811 -10.918
    9   HD23  LEU  81          HD21      LEU  81  -1.804   5.068 -11.717
   10   HD22  LEU  81          HD22      LEU  81  -0.390   5.232 -10.679
   11   HD21  LEU  81          HD23      LEU  81  -1.995   5.587 -10.044

  No H/Q in entry =          11
  In of MODEL   34
    1    H    MET  82           H        MET  82  -0.620   1.922  -6.304
    2    HA   MET  82           HA       MET  82  -1.673   3.511  -4.219
    3    HB2  MET  82           HB2      MET  82  -0.309   0.819  -4.255
    4    HB3  MET  82           HB3      MET  82  -0.889   1.545  -2.759
    5    HG2  MET  82           HG2      MET  82  -2.616   1.059  -5.206
    6    HG3  MET  82           HG3      MET  82  -2.546  -0.015  -3.811
    7    HE3  MET  82           HE1      MET  82  -4.272   1.639  -1.000
    8    HE2  MET  82           HE2      MET  82  -2.540   1.911  -1.179
    9    HE1  MET  82           HE3      MET  82  -3.232   0.356  -1.636

  No H/Q in entry =           9
  In of MODEL   34
    1    H    THR  83           H        THR  83   1.626   2.414  -4.899
    2    HA   THR  83           HA       THR  83   2.840   3.513  -2.594
    3    HB   THR  83           HB       THR  83   4.940   3.451  -4.061
    4    HG1  THR  83           HG1      THR  83   4.704   2.926  -6.086
    5   HG22  THR  83          HG21      THR  83   4.488   0.794  -4.396
    6   HG21  THR  83          HG22      THR  83   3.196   1.178  -3.260
    7   HG23  THR  83          HG23      THR  83   4.875   1.515  -2.835

  No H/Q in entry =           7
  In of MODEL   34
    1    H    SER  84           H        SER  84   2.484   4.795  -5.895
    2    HA   SER  84           HA       SER  84   3.831   7.231  -5.434
    3    HB2  SER  84           HB2      SER  84   1.764   6.406  -7.460
    4    HB3  SER  84           HB3      SER  84   2.448   8.031  -7.432
    5    HG   SER  84           HG       SER  84   3.813   5.552  -7.720

  No H/Q in entry =           5
  In of MODEL   34
    1    H    MET  85           H        MET  85   0.334   6.486  -5.274
    2    HA   MET  85           HA       MET  85  -0.520   9.099  -4.674
    3    HB2  MET  85           HB2      MET  85  -2.050   7.301  -5.348
    4    HB3  MET  85           HB3      MET  85  -1.765   6.485  -3.812
    5    HG2  MET  85           HG2      MET  85  -2.654   8.433  -2.596
    6    HG3  MET  85           HG3      MET  85  -2.906   9.277  -4.122
    7    HE2  MET  85           HE1      MET  85  -6.153   8.289  -5.377
    8    HE1  MET  85           HE2      MET  85  -4.559   8.945  -5.749
    9    HE3  MET  85           HE3      MET  85  -5.486   9.611  -4.409

  No H/Q in entry =           9
  In of MODEL   34
    1    H    LEU  86           H        LEU  86   0.383   6.432  -2.529
    2    HA   LEU  86           HA       LEU  86  -0.153   7.736  -0.088
    3    HB2  LEU  86           HB2      LEU  86   0.303   5.263  -0.482
    4    HB3  LEU  86           HB3      LEU  86   2.012   5.686  -0.571
    5    HG   LEU  86           HG       LEU  86   1.685   6.847   1.697
    6   HD11  LEU  86          HD11      LEU  86  -1.011   6.092   1.217
    7   HD13  LEU  86          HD12      LEU  86  -0.346   6.835   2.670
    8   HD12  LEU  86          HD13      LEU  86  -0.444   5.080   2.549
    9   HD23  LEU  86          HD21      LEU  86   1.243   3.856   1.816
   10   HD22  LEU  86          HD22      LEU  86   2.247   4.860   2.859
   11   HD21  LEU  86          HD23      LEU  86   2.751   4.535   1.202

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ALA  87           H        ALA  87   2.832   7.429  -1.968
    2    HA   ALA  87           HA       ALA  87   4.539   8.830  -0.237
    3    HB3  ALA  87           HB1      ALA  87   4.638   7.819  -2.945
    4    HB2  ALA  87           HB2      ALA  87   5.971   8.143  -1.840
    5    HB1  ALA  87           HB3      ALA  87   5.365   9.427  -2.885

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ARG  88           H        ARG  88   2.606   9.978  -2.962
    2    HA   ARG  88           HA       ARG  88   3.393  12.663  -2.841
    3    HB2  ARG  88           HB2      ARG  88   2.139  11.519  -4.703
    4    HB3  ARG  88           HB3      ARG  88   0.679  11.669  -3.724
    5    HG2  ARG  88           HG2      ARG  88   1.712  14.244  -3.636
    6    HG3  ARG  88           HG3      ARG  88   2.138  13.729  -5.265
    7    HD2  ARG  88           HD2      ARG  88  -0.001  13.821  -5.969
    8    HD3  ARG  88           HD3      ARG  88  -0.596  12.970  -4.543
    9    HE   ARG  88           HE       ARG  88  -0.769  15.749  -4.959
   10   HH21  ARG  88          HH11      ARG  88  -1.294  17.080  -3.222
   11   HH22  ARG  88          HH12      ARG  88  -1.006  16.539  -1.604
   12   HH11  ARG  88          HH21      ARG  88   0.227  13.479  -2.584
   13   HH12  ARG  88          HH22      ARG  88  -0.162  14.495  -1.243

  No H/Q in entry =          13
  In of MODEL   34
    1    H    GLU  89           H        GLU  89   0.676  11.003  -1.210
    2    HA   GLU  89           HA       GLU  89  -0.422  13.320  -0.006
    3    HB2  GLU  89           HB2      GLU  89  -1.552  11.087  -0.098
    4    HB3  GLU  89           HB3      GLU  89  -0.435  10.524   1.145
    5    HG2  GLU  89           HG2      GLU  89  -1.249  12.226   2.704
    6    HG3  GLU  89           HG3      GLU  89  -2.294  12.904   1.458

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LEU  90           H        LEU  90   2.013  11.012   1.172
    2    HA   LEU  90           HA       LEU  90   2.369  12.251   3.704
    3    HB2  LEU  90           HB2      LEU  90   4.136  10.468   2.030
    4    HB3  LEU  90           HB3      LEU  90   4.554  10.980   3.670
    5    HG   LEU  90           HG       LEU  90   1.913   9.652   3.001
    6   HD12  LEU  90          HD11      LEU  90   3.037   7.598   4.010
    7   HD11  LEU  90          HD12      LEU  90   4.565   8.445   3.773
    8   HD13  LEU  90          HD13      LEU  90   3.554   8.045   2.383
    9   HD22  LEU  90          HD21      LEU  90   1.648  10.575   5.123
   10   HD21  LEU  90          HD22      LEU  90   3.364  10.456   5.509
   11   HD23  LEU  90          HD23      LEU  90   2.349   9.015   5.554

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  91           H        ILE  91   3.984  12.627   0.582
    2    HA   ILE  91           HA       ILE  91   5.970  14.444   1.429
    3    HB   ILE  91           HB       ILE  91   4.663  13.965  -1.255
    4   HG12  ILE  91          HG12      ILE  91   7.489  13.458  -0.274
    5   HG13  ILE  91          HG13      ILE  91   6.199  12.269  -0.116
    6   HG22  ILE  91          HG21      ILE  91   6.896  15.298  -1.936
    7   HG21  ILE  91          HG22      ILE  91   6.588  16.099  -0.395
    8   HG23  ILE  91          HG23      ILE  91   5.368  16.137  -1.667
    9   HD13  ILE  91          HD11      ILE  91   6.030  11.949  -2.424
   10   HD12  ILE  91          HD12      ILE  91   7.765  12.180  -2.206
   11   HD11  ILE  91          HD13      ILE  91   6.765  13.510  -2.793

  No H/Q in entry =          11
  In of MODEL   34
    1    H    THR  92           H        THR  92   2.614  14.901   0.412
    2    HA   THR  92           HA       THR  92   2.608  17.724   0.355
    3    HB   THR  92           HB       THR  92   0.424  15.744   1.046
    4    HG1  THR  92           HG1      THR  92   0.733  15.566  -1.038
    5   HG22  THR  92          HG21      THR  92  -0.959  17.917   0.323
    6   HG21  THR  92          HG22      THR  92   0.437  18.731   1.025
    7   HG23  THR  92          HG23      THR  92  -0.515  17.615   2.002

  No H/Q in entry =           7
  In of MODEL   34
    1    H    GLU  93           H        GLU  93   2.036  15.425   3.005
    2    HA   GLU  93           HA       GLU  93   1.512  17.330   5.024
    3    HB2  GLU  93           HB2      GLU  93   2.805  14.596   5.260
    4    HB3  GLU  93           HB3      GLU  93   2.118  15.527   6.593
    5    HG2  GLU  93           HG2      GLU  93   0.506  14.763   4.149
    6    HG3  GLU  93           HG3      GLU  93   0.597  13.738   5.576

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LEU  94           H        LEU  94   4.511  15.828   3.881
    2    HA   LEU  94           HA       LEU  94   6.265  16.961   5.774
    3    HB2  LEU  94           HB2      LEU  94   6.667  15.994   2.944
    4    HB3  LEU  94           HB3      LEU  94   7.999  16.641   3.897
    5    HG   LEU  94           HG       LEU  94   6.241  14.457   5.025
    6   HD11  LEU  94          HD11      LEU  94   8.340  14.218   2.899
    7   HD13  LEU  94          HD12      LEU  94   6.886  13.254   3.156
    8   HD12  LEU  94          HD13      LEU  94   8.307  12.990   4.166
    9   HD23  LEU  94          HD21      LEU  94   8.423  13.903   6.183
   10   HD22  LEU  94          HD22      LEU  94   7.767  15.486   6.599
   11   HD21  LEU  94          HD23      LEU  94   9.107  15.357   5.460

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  95           H        ILE  95   5.142  18.144   2.623
    2    HA   ILE  95           HA       ILE  95   6.732  20.490   2.570
    3    HB   ILE  95           HB       ILE  95   4.086  19.827   1.257
    4   HG12  ILE  95          HG12      ILE  95   6.880  20.145   0.128
    5   HG13  ILE  95          HG13      ILE  95   6.218  18.596   0.639
    6   HG21  ILE  95          HG21      ILE  95   5.854  22.282   1.044
    7   HG23  ILE  95          HG22      ILE  95   4.128  22.226   1.396
    8   HG22  ILE  95          HG23      ILE  95   4.712  21.823  -0.219
    9   HD13  ILE  95          HD11      ILE  95   4.663  18.534  -1.094
   10   HD12  ILE  95          HD12      ILE  95   6.020  19.343  -1.878
   11   HD11  ILE  95          HD13      ILE  95   4.652  20.287  -1.288

  No H/Q in entry =          11
  In of MODEL   34
    1    H    GLU  96           H        GLU  96   3.475  19.861   3.856
    2    HA   GLU  96           HA       GLU  96   2.872  22.511   4.609
    3    HB2  GLU  96           HB2      GLU  96   1.184  20.740   4.614
    4    HB3  GLU  96           HB3      GLU  96   2.036  19.905   5.910
    5    HG2  GLU  96           HG2      GLU  96   1.021  21.194   7.479
    6    HG3  GLU  96           HG3      GLU  96   1.570  22.665   6.685

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LEU  97           H        LEU  97   4.691  19.945   6.236
    2    HA   LEU  97           HA       LEU  97   5.052  21.288   8.709
    3    HB2  LEU  97           HB2      LEU  97   6.577  19.109   7.296
    4    HB3  LEU  97           HB3      LEU  97   7.168  19.788   8.811
    5    HG   LEU  97           HG       LEU  97   4.351  18.716   8.491
    6   HD12  LEU  97          HD11      LEU  97   5.272  16.695   9.704
    7   HD11  LEU  97          HD12      LEU  97   6.889  17.314   9.365
    8   HD13  LEU  97          HD13      LEU  97   5.820  16.866   8.036
    9   HD23  LEU  97          HD21      LEU  97   4.795  18.415  11.057
   10   HD22  LEU  97          HD22      LEU  97   4.428  20.031  10.453
   11   HD21  LEU  97          HD23      LEU  97   6.096  19.578  10.802

  No H/Q in entry =          11
  In of MODEL   34
    1    H    HIS  98           H        HIS  98   6.931  21.293   5.689
    2    HA   HIS  98           HA       HIS  98   9.095  22.855   6.595
    3    HB2  HIS  98           HB2      HIS  98   7.807  22.613   3.866
    4    HB3  HIS  98           HB3      HIS  98   9.254  23.580   4.161
    5    HD1  HIS  98           HD1      HIS  98   8.014  20.019   4.174
    6    HD2  HIS  98           HD2      HIS  98  11.611  22.086   4.610
    7    HE1  HIS  98           HE1      HIS  98   9.855  18.275   4.120
    8    HE2  HIS  98           HE2      HIS  98  12.049  19.513   4.386

  No H/Q in entry =           8
  In of MODEL   34
    1    H    GLU  99           H        GLU  99   5.884  23.717   5.412
    2    HA   GLU  99           HA       GLU  99   6.285  26.528   5.359
    3    HB2  GLU  99           HB2      GLU  99   4.400  25.376   4.221
    4    HB3  GLU  99           HB3      GLU  99   3.697  25.018   5.798
    5    HG2  GLU  99           HG2      GLU  99   3.534  27.411   6.302
    6    HG3  GLU  99           HG3      GLU  99   4.318  27.806   4.775

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LYS 100           H        LYS 100   5.130  24.299   7.875
    2    HA   LYS 100           HA       LYS 100   4.555  26.356   9.770
    3    HB2  LYS 100           HB2      LYS 100   5.105  23.400  10.113
    4    HB3  LYS 100           HB3      LYS 100   4.663  24.475  11.446
    5    HG2  LYS 100           HG2      LYS 100   2.606  25.130  10.193
    6    HG3  LYS 100           HG3      LYS 100   3.026  23.959   8.940
    7    HD2  LYS 100           HD2      LYS 100   2.929  22.137  10.599
    8    HD3  LYS 100           HD3      LYS 100   2.525  23.302  11.863
    9    HE2  LYS 100           HE2      LYS 100   0.481  23.942  10.595
   10    HE3  LYS 100           HE3      LYS 100   0.874  22.720   9.379
   11    HZ1  LYS 100           HZ1      LYS 100   0.595  22.052  12.258
   12    HZ3  LYS 100           HZ2      LYS 100   0.574  21.000  10.922
   13    HZ2  LYS 100           HZ3      LYS 100  -0.733  22.050  11.200

  No H/Q in entry =          13
  In of MODEL   34
    1    H    LEU 101           H        LEU 101   7.465  24.537   8.941
    2    HA   LEU 101           HA       LEU 101   9.065  25.361  11.150
    3    HB2  LEU 101           HB2      LEU 101   9.659  24.373   8.373
    4    HB3  LEU 101           HB3      LEU 101  10.964  25.026   9.358
    5    HG   LEU 101           HG       LEU 101   9.111  22.884  10.415
    6   HD12  LEU 101          HD11      LEU 101  11.154  21.372   9.810
    7   HD11  LEU 101          HD12      LEU 101  11.534  22.634   8.640
    8   HD13  LEU 101          HD13      LEU 101   9.999  21.774   8.541
    9   HD21  LEU 101          HD21      LEU 101  11.842  23.968  11.151
   10   HD23  LEU 101          HD22      LEU 101  11.284  22.400  11.727
   11   HD22  LEU 101          HD23      LEU 101  10.403  23.863  12.165

  No H/Q in entry =          11
  In of MODEL   34
    1    H    LYS 102           H        LYS 102   7.503  27.241   9.007
    2    HA   LYS 102           HA       LYS 102   7.601  29.533   8.719
    3    HB2  LYS 102           HB2      LYS 102   9.159  29.402  10.821
    4    HB3  LYS 102           HB3      LYS 102  10.463  29.587   9.666
    5    HG2  LYS 102           HG2      LYS 102   8.372  31.557  10.524
    6    HG3  LYS 102           HG3      LYS 102  10.088  31.802  10.277
    7    HD2  LYS 102           HD2      LYS 102   8.139  31.399   7.972
    8    HD3  LYS 102           HD3      LYS 102   8.534  32.974   8.643
    9    HE2  LYS 102           HE2      LYS 102   9.903  31.780   6.572
   10    HE3  LYS 102           HE3      LYS 102  10.528  33.080   7.586
   11    HZ2  LYS 102           HZ1      LYS 102  12.032  31.163   7.413
   12    HZ1  LYS 102           HZ2      LYS 102  10.859  30.190   8.151
   13    HZ3  LYS 102           HZ3      LYS 102  11.560  31.469   9.014

  No H/Q in entry =          13
  In of MODEL   34
    1    H    ALA 103           H        ALA 103  10.848  28.166   8.161
    2    HA   ALA 103           HA       ALA 103  11.830  29.537   6.090
    3    HB2  ALA 103           HB1      ALA 103  12.698  27.317   5.162
    4    HB1  ALA 103           HB2      ALA 103  11.793  26.549   6.464
    5    HB3  ALA 103           HB3      ALA 103  13.091  27.681   6.842

  No H/Q in entry =           5
  In of MODEL   34
    1    H1   LYS   3           H1       LYS   3 -31.825   5.717 -19.622
    2    H2   LYS   3           H3       LYS   3 -30.831   5.483 -20.979
    3    H3   LYS   3           H2       LYS   3 -32.175   4.477 -20.727
    4    HA   LYS   3           HA       LYS   3 -31.097   3.135 -19.334
    5    HB2  LYS   3           HB2      LYS   3 -28.895   4.664 -20.673
    6    HB3  LYS   3           HB3      LYS   3 -28.505   3.469 -19.436
    7    HG2  LYS   3           HG2      LYS   3 -29.852   1.818 -20.785
    8    HG3  LYS   3           HG3      LYS   3 -29.875   3.024 -22.071
    9    HD2  LYS   3           HD2      LYS   3 -27.389   3.034 -22.035
   10    HD3  LYS   3           HD3      LYS   3 -27.436   1.728 -20.852
   11    HE2  LYS   3           HE2      LYS   3 -28.884   0.485 -22.564
   12    HE3  LYS   3           HE3      LYS   3 -28.330   1.696 -23.719
   13    HZ3  LYS   3           HZ1      LYS   3 -26.474   0.560 -24.003
   14    HZ2  LYS   3           HZ2      LYS   3 -27.039  -0.642 -22.944
   15    HZ1  LYS   3           HZ3      LYS   3 -26.109   0.648 -22.347

  No H/Q in entry =          15
  In of MODEL   34
    1    H    LYS   4           H        LYS   4 -31.130   2.984 -17.273
    2    HA   LYS   4           HA       LYS   4 -30.505   5.298 -15.618
    3    HB2  LYS   4           HB2      LYS   4 -31.568   2.547 -14.921
    4    HB3  LYS   4           HB3      LYS   4 -31.406   3.891 -13.792
    5    HG2  LYS   4           HG2      LYS   4 -33.223   3.748 -16.204
    6    HG3  LYS   4           HG3      LYS   4 -33.706   3.768 -14.509
    7    HD2  LYS   4           HD2      LYS   4 -33.118   6.022 -14.238
    8    HD3  LYS   4           HD3      LYS   4 -32.084   6.019 -15.667
    9    HE2  LYS   4           HE2      LYS   4 -34.078   7.299 -16.114
   10    HE3  LYS   4           HE3      LYS   4 -34.091   5.828 -17.087
   11    HZ3  LYS   4           HZ1      LYS   4 -35.612   4.834 -15.534
   12    HZ2  LYS   4           HZ2      LYS   4 -36.243   6.303 -16.110
   13    HZ1  LYS   4           HZ3      LYS   4 -35.572   6.218 -14.552

  No H/Q in entry =          13
  In of MODEL   34
    1    H    HIS   5           H        HIS   5 -29.033   5.448 -14.035
    2    HA   HIS   5           HA       HIS   5 -26.667   3.733 -14.385
    3    HB2  HIS   5           HB2      HIS   5 -27.047   6.468 -13.168
    4    HB3  HIS   5           HB3      HIS   5 -25.521   5.587 -13.162
    5    HD1  HIS   5           HD1      HIS   5 -24.119   6.859 -14.755
    6    HD2  HIS   5           HD2      HIS   5 -27.895   6.063 -16.290
    7    HE1  HIS   5           HE1      HIS   5 -23.993   7.456 -17.205
    8    HE2  HIS   5           HE2      HIS   5 -26.295   6.958 -18.109

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ILE   6           H        ILE   6 -26.355   2.169 -13.075
    2    HA   ILE   6           HA       ILE   6 -27.327   2.381 -10.305
    3    HB   ILE   6           HB       ILE   6 -26.395  -0.039 -11.856
    4   HG12  ILE   6          HG12      ILE   6 -29.175   0.764 -10.986
    5   HG13  ILE   6          HG13      ILE   6 -28.550   0.962 -12.623
    6   HG23  ILE   6          HG21      ILE   6 -26.698  -1.313  -9.998
    7   HG22  ILE   6          HG22      ILE   6 -27.904  -0.226  -9.308
    8   HG21  ILE   6          HG23      ILE   6 -26.192   0.191  -9.227
    9   HD13  ILE   6          HD11      ILE   6 -28.912  -1.175 -13.128
   10   HD12  ILE   6          HD12      ILE   6 -29.919  -1.211 -11.680
   11   HD11  ILE   6          HD13      ILE   6 -28.238  -1.740 -11.600

  No H/Q in entry =          11
  In of MODEL   34
    1    H    TYR   7           H        TYR   7 -25.593   3.099  -9.026
    2    HA   TYR   7           HA       TYR   7 -22.843   2.273  -9.724
    3    HB2  TYR   7           HB2      TYR   7 -23.912   4.654  -8.228
    4    HB3  TYR   7           HB3      TYR   7 -22.205   4.219  -8.278
    5    HD1  TYR   7           HD1      TYR   7 -23.217   3.239 -11.366
    6    HD2  TYR   7           HD2      TYR   7 -22.703   6.832  -9.131
    7    HE1  TYR   7           HE1      TYR   7 -22.856   4.494 -13.455
    8    HE2  TYR   7           HE2      TYR   7 -22.382   8.090 -11.212
    9    HH   TYR   7           HH       TYR   7 -22.609   8.001 -13.443

  No H/Q in entry =           9
  In of MODEL   34
    1    H    LEU   8           H        LEU   8 -21.809   0.963  -8.405
    2    HA   LEU   8           HA       LEU   8 -22.899   0.408  -5.717
    3    HB2  LEU   8           HB2      LEU   8 -21.132  -1.168  -7.566
    4    HB3  LEU   8           HB3      LEU   8 -21.290  -1.564  -5.855
    5    HG   LEU   8           HG       LEU   8 -23.760  -1.850  -6.264
    6   HD13  LEU   8          HD11      LEU   8 -23.959  -0.635  -8.369
    7   HD12  LEU   8          HD12      LEU   8 -24.413  -2.322  -8.612
    8   HD11  LEU   8          HD13      LEU   8 -22.834  -1.747  -9.144
    9   HD23  LEU   8          HD21      LEU   8 -22.403  -3.825  -7.972
   10   HD22  LEU   8          HD22      LEU   8 -23.473  -4.047  -6.589
   11   HD21  LEU   8          HD23      LEU   8 -21.782  -3.616  -6.335

  No H/Q in entry =          11
  In of MODEL   34
    1    H    PHE   9           H        PHE   9 -21.637   0.852  -3.937
    2    HA   PHE   9           HA       PHE   9 -18.895   1.908  -4.442
    3    HB2  PHE   9           HB2      PHE   9 -20.950   2.888  -2.464
    4    HB3  PHE   9           HB3      PHE   9 -19.263   3.383  -2.462
    5    HD1  PHE   9           HD1      PHE   9 -18.348   4.771  -4.241
    6    HD2  PHE   9           HD2      PHE   9 -22.480   3.612  -4.245
    7    HE1  PHE   9           HE1      PHE   9 -18.819   6.450  -5.999
    8    HE2  PHE   9           HE2      PHE   9 -22.952   5.304  -5.997
    9    HZ   PHE   9           HZ       PHE   9 -21.119   6.719  -6.881

  No H/Q in entry =           9
  In of MODEL   34
    1    H    SER  10           H        SER  10 -17.265   1.026  -3.321
    2    HA   SER  10           HA       SER  10 -17.442   0.115  -0.635
    3    HB2  SER  10           HB2      SER  10 -18.596  -1.794  -1.702
    4    HB3  SER  10           HB3      SER  10 -17.213  -2.015  -2.764
    5    HG   SER  10           HG       SER  10 -16.021  -2.695  -1.110

  No H/Q in entry =           5
  In of MODEL   34
    1    H    SER  11           H        SER  11 -15.419   0.204   0.217
    2    HA   SER  11           HA       SER  11 -13.265   1.156  -1.328
    3    HB2  SER  11           HB2      SER  11 -12.060   1.222   0.658
    4    HB3  SER  11           HB3      SER  11 -13.733   1.337   1.210
    5    HG   SER  11           HG       SER  11 -12.581  -1.197   0.878

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA  12           H        ALA  12 -14.383  -1.550  -2.132
    2    HA   ALA  12           HA       ALA  12 -11.780  -2.754  -2.644
    3    HB2  ALA  12           HB1      ALA  12 -12.683  -5.047  -2.012
    4    HB1  ALA  12           HB2      ALA  12 -13.971  -4.202  -1.156
    5    HB3  ALA  12           HB3      ALA  12 -12.293  -3.971  -0.668

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLY  13           H        GLY  13 -12.593  -1.730  -4.673
    2    HA3  GLY  13           HA2      GLY  13 -14.803  -2.544  -6.144
    3    HA2  GLY  13           HA3      GLY  13 -13.287  -1.979  -6.863

  No H/Q in entry =           3
  In of MODEL   34
    1    H    MET  14           H        MET  14 -11.688  -4.227  -5.835
    2    HA   MET  14           HA       MET  14 -11.901  -5.953  -8.009
    3    HB2  MET  14           HB2      MET  14  -9.885  -5.928  -6.621
    4    HB3  MET  14           HB3      MET  14 -10.758  -6.687  -5.292
    5    HG2  MET  14           HG2      MET  14 -11.167  -8.675  -6.712
    6    HG3  MET  14           HG3      MET  14 -10.291  -7.906  -8.037
    7    HE2  MET  14           HE1      MET  14  -6.738  -7.708  -7.089
    8    HE1  MET  14           HE2      MET  14  -8.116  -6.896  -7.829
    9    HE3  MET  14           HE3      MET  14  -7.659  -8.509  -8.370

  No H/Q in entry =           9
  In of MODEL   34
    1    H    SER  15           H        SER  15 -13.246  -6.505  -4.762
    2    HA   SER  15           HA       SER  15 -14.467  -9.004  -5.587
    3    HB2  SER  15           HB2      SER  15 -14.744  -7.383  -3.056
    4    HB3  SER  15           HB3      SER  15 -15.781  -8.766  -3.398
    5    HG   SER  15           HG       SER  15 -14.021  -9.547  -2.308

  No H/Q in entry =           5
  In of MODEL   34
    1    H    THR  16           H        THR  16 -15.598  -5.659  -5.126
    2    HA   THR  16           HA       THR  16 -18.390  -6.182  -5.632
    3    HB   THR  16           HB       THR  16 -16.856  -3.610  -6.140
    4    HG1  THR  16           HG1      THR  16 -16.398  -4.072  -4.076
    5   HG21  THR  16          HG21      THR  16 -19.189  -3.721  -6.976
    6   HG23  THR  16          HG22      THR  16 -19.022  -2.564  -5.643
    7   HG22  THR  16          HG23      THR  16 -19.728  -4.161  -5.360

  No H/Q in entry =           7
  In of MODEL   34
    1    H    SER  17           H        SER  17 -15.580  -5.507  -7.505
    2    HA   SER  17           HA       SER  17 -16.754  -4.813  -9.999
    3    HB2  SER  17           HB2      SER  17 -14.065  -6.040  -9.343
    4    HB3  SER  17           HB3      SER  17 -14.540  -5.548 -10.970
    5    HG   SER  17           HG       SER  17 -15.070  -3.465  -9.686

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU  18           H        LEU  18 -16.030  -7.932  -8.563
    2    HA   LEU  18           HA       LEU  18 -16.555  -9.450 -10.920
    3    HB2  LEU  18           HB2      LEU  18 -15.283 -10.357  -9.024
    4    HB3  LEU  18           HB3      LEU  18 -16.716 -10.237  -8.005
    5    HG   LEU  18           HG       LEU  18 -17.873 -11.867  -9.402
    6   HD13  LEU  18          HD11      LEU  18 -17.074 -11.613 -11.575
    7   HD12  LEU  18          HD12      LEU  18 -16.271 -13.100 -11.069
    8   HD11  LEU  18          HD13      LEU  18 -15.390 -11.574 -11.056
    9   HD22  LEU  18          HD21      LEU  18 -16.822 -12.875  -7.623
   10   HD21  LEU  18          HD22      LEU  18 -15.208 -12.565  -8.267
   11   HD23  LEU  18          HD23      LEU  18 -16.230 -13.798  -9.006

  No H/Q in entry =          11
  In of MODEL   34
    1    H    LEU  19           H        LEU  19 -18.567  -8.346  -8.197
    2    HA   LEU  19           HA       LEU  19 -20.975  -9.643  -9.023
    3    HB2  LEU  19           HB2      LEU  19 -20.727  -8.799  -6.768
    4    HB3  LEU  19           HB3      LEU  19 -20.539  -7.156  -7.376
    5    HG   LEU  19           HG       LEU  19 -22.913  -7.256  -8.162
    6   HD12  LEU  19          HD11      LEU  19 -22.967  -9.768  -6.478
    7   HD11  LEU  19          HD12      LEU  19 -23.122  -9.714  -8.234
    8   HD13  LEU  19          HD13      LEU  19 -24.362  -8.980  -7.217
    9   HD22  LEU  19          HD21      LEU  19 -22.427  -6.061  -6.187
   10   HD21  LEU  19          HD22      LEU  19 -22.228  -7.541  -5.251
   11   HD23  LEU  19          HD23      LEU  19 -23.828  -7.067  -5.821

  No H/Q in entry =          11
  In of MODEL   34
    1    H    VAL  20           H        VAL  20 -19.634  -6.413  -9.714
    2    HA   VAL  20           HA       VAL  20 -21.800  -5.468 -11.270
    3    HB   VAL  20           HB       VAL  20 -18.843  -4.734 -11.404
    4   HG13  VAL  20          HG11      VAL  20 -19.717  -4.161 -13.555
    5   HG12  VAL  20          HG12      VAL  20 -19.705  -2.670 -12.614
    6   HG11  VAL  20          HG13      VAL  20 -21.215  -3.548 -12.856
    7   HG23  VAL  20          HG21      VAL  20 -19.732  -2.618 -10.355
    8   HG22  VAL  20          HG22      VAL  20 -19.756  -4.058  -9.339
    9   HG21  VAL  20          HG23      VAL  20 -21.244  -3.489 -10.097

  No H/Q in entry =           9
  In of MODEL   34
    1    H    SER  21           H        SER  21 -18.952  -7.382 -12.316
    2    HA   SER  21           HA       SER  21 -19.754  -7.299 -15.063
    3    HB2  SER  21           HB2      SER  21 -18.226  -9.192 -15.410
    4    HB3  SER  21           HB3      SER  21 -17.454  -7.914 -14.476
    5    HG   SER  21           HG       SER  21 -17.546 -10.375 -13.836

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LYS  22           H        LYS  22 -20.703  -9.541 -12.494
    2    HA   LYS  22           HA       LYS  22 -22.171 -11.226 -14.314
    3    HB2  LYS  22           HB2      LYS  22 -21.373 -11.946 -12.039
    4    HB3  LYS  22           HB3      LYS  22 -22.627 -10.917 -11.349
    5    HG2  LYS  22           HG2      LYS  22 -23.611 -13.005 -11.301
    6    HG3  LYS  22           HG3      LYS  22 -24.246 -12.321 -12.798
    7    HD2  LYS  22           HD2      LYS  22 -22.612 -13.563 -14.097
    8    HD3  LYS  22           HD3      LYS  22 -21.878 -14.186 -12.618
    9    HE2  LYS  22           HE2      LYS  22 -23.980 -15.358 -12.080
   10    HE3  LYS  22           HE3      LYS  22 -24.697 -14.748 -13.572
   11    HZ3  LYS  22           HZ1      LYS  22 -23.789 -16.384 -14.715
   12    HZ2  LYS  22           HZ2      LYS  22 -23.332 -17.099 -13.242
   13    HZ1  LYS  22           HZ3      LYS  22 -22.245 -16.092 -14.072

  No H/Q in entry =          13
  In of MODEL   34
    1    H    MET  23           H        MET  23 -23.022  -8.348 -12.432
    2    HA   MET  23           HA       MET  23 -25.825  -8.555 -12.927
    3    HB2  MET  23           HB2      MET  23 -24.086  -6.166 -12.355
    4    HB3  MET  23           HB3      MET  23 -25.837  -6.077 -12.524
    5    HG2  MET  23           HG2      MET  23 -26.158  -7.403 -10.558
    6    HG3  MET  23           HG3      MET  23 -24.430  -7.735 -10.441
    7    HE2  MET  23           HE1      MET  23 -26.890  -4.198  -9.230
    8    HE1  MET  23           HE2      MET  23 -27.106  -5.173 -10.682
    9    HE3  MET  23           HE3      MET  23 -26.138  -3.699 -10.746

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ARG  24           H        ARG  24 -23.149  -6.995 -14.718
    2    HA   ARG  24           HA       ARG  24 -24.713  -5.758 -16.706
    3    HB2  ARG  24           HB2      ARG  24 -22.286  -5.256 -16.328
    4    HB3  ARG  24           HB3      ARG  24 -21.885  -6.828 -16.973
    5    HG2  ARG  24           HG2      ARG  24 -22.784  -6.184 -19.202
    6    HG3  ARG  24           HG3      ARG  24 -23.226  -4.588 -18.538
    7    HD2  ARG  24           HD2      ARG  24 -21.065  -4.343 -19.611
    8    HD3  ARG  24           HD3      ARG  24 -20.818  -4.310 -17.871
    9    HE   ARG  24           HE       ARG  24 -20.373  -6.887 -18.431
   10   HH21  ARG  24          HH11      ARG  24 -18.285  -7.267 -17.692
   11   HH22  ARG  24          HH12      ARG  24 -16.974  -6.318 -18.301
   12   HH11  ARG  24          HH21      ARG  24 -19.196  -4.075 -19.903
   13   HH12  ARG  24          HH22      ARG  24 -17.523  -4.438 -19.616

  No H/Q in entry =          13
  In of MODEL   34
    1    H    ALA  25           H        ALA  25 -23.440  -9.043 -16.448
    2    HA   ALA  25           HA       ALA  25 -24.041  -9.893 -19.085
    3    HB1  ALA  25           HB1      ALA  25 -23.251 -11.893 -18.400
    4    HB3  ALA  25           HB2      ALA  25 -24.302 -11.926 -16.984
    5    HB2  ALA  25           HB3      ALA  25 -22.786 -11.030 -16.935

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLN  26           H        GLN  26 -25.851 -10.025 -16.054
    2    HA   GLN  26           HA       GLN  26 -28.143 -11.327 -17.066
    3    HB2  GLN  26           HB2      GLN  26 -27.699  -9.568 -14.673
    4    HB3  GLN  26           HB3      GLN  26 -29.229 -10.360 -15.020
    5    HG2  GLN  26           HG2      GLN  26 -26.578 -11.701 -14.569
    6    HG3  GLN  26           HG3      GLN  26 -27.938 -11.663 -13.452
    7   HE21  GLN  26          HE21      GLN  26 -26.630 -13.766 -14.743
    8   HE22  GLN  26          HE22      GLN  26 -27.628 -14.856 -15.540

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ALA  27           H        ALA  27 -27.360  -7.893 -16.664
    2    HA   ALA  27           HA       ALA  27 -29.899  -6.910 -17.433
    3    HB1  ALA  27           HB1      ALA  27 -28.145  -5.520 -16.319
    4    HB3  ALA  27           HB2      ALA  27 -28.776  -4.774 -17.789
    5    HB2  ALA  27           HB3      ALA  27 -27.203  -5.572 -17.810

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLU  28           H        GLU  28 -27.155  -8.003 -19.318
    2    HA   GLU  28           HA       GLU  28 -28.146  -6.994 -21.829
    3    HB2  GLU  28           HB2      GLU  28 -25.736  -7.574 -21.218
    4    HB3  GLU  28           HB3      GLU  28 -26.207  -9.259 -21.425
    5    HG2  GLU  28           HG2      GLU  28 -25.105  -8.423 -23.395
    6    HG3  GLU  28           HG3      GLU  28 -26.788  -8.820 -23.738

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LYS  29           H        LYS  29 -28.167 -10.112 -20.186
    2    HA   LYS  29           HA       LYS  29 -29.411 -11.630 -22.193
    3    HB2  LYS  29           HB2      LYS  29 -28.310 -12.575 -20.198
    4    HB3  LYS  29           HB3      LYS  29 -29.608 -11.930 -19.194
    5    HG2  LYS  29           HG2      LYS  29 -31.210 -13.370 -20.262
    6    HG3  LYS  29           HG3      LYS  29 -29.989 -13.945 -21.394
    7    HD2  LYS  29           HD2      LYS  29 -28.789 -15.069 -19.671
    8    HD3  LYS  29           HD3      LYS  29 -29.727 -14.275 -18.408
    9    HE2  LYS  29           HE2      LYS  29 -30.375 -16.653 -18.779
   10    HE3  LYS  29           HE3      LYS  29 -31.705 -15.517 -19.012
   11    HZ1  LYS  29           HZ1      LYS  29 -31.146 -15.614 -21.441
   12    HZ3  LYS  29           HZ2      LYS  29 -31.801 -17.036 -20.780
   13    HZ2  LYS  29           HZ3      LYS  29 -30.135 -16.930 -21.085

  No H/Q in entry =          13
  In of MODEL   34
    1    H    TYR  30           H        TYR  30 -30.885  -9.601 -19.672
    2    HA   TYR  30           HA       TYR  30 -33.530 -10.162 -20.906
    3    HB2  TYR  30           HB2      TYR  30 -32.918  -8.994 -18.181
    4    HB3  TYR  30           HB3      TYR  30 -34.524  -9.320 -18.828
    5    HD1  TYR  30           HD1      TYR  30 -35.333 -11.649 -19.050
    6    HD2  TYR  30           HD2      TYR  30 -31.527 -10.765 -17.359
    7    HE1  TYR  30           HE1      TYR  30 -35.136 -13.974 -18.266
    8    HE2  TYR  30           HE2      TYR  30 -31.332 -13.076 -16.578
    9    HH   TYR  30           HH       TYR  30 -32.869 -15.502 -17.676

  No H/Q in entry =           9
  In of MODEL   34
    1    H    GLU  31           H        GLU  31 -31.458  -8.071 -21.705
    2    HA   GLU  31           HA       GLU  31 -31.485  -5.909 -22.516
    3    HB2  GLU  31           HB2      GLU  31 -34.348  -6.752 -23.021
    4    HB3  GLU  31           HB3      GLU  31 -33.572  -5.344 -23.747
    5    HG2  GLU  31           HG2      GLU  31 -32.042  -6.708 -24.951
    6    HG3  GLU  31           HG3      GLU  31 -32.539  -8.151 -24.068

  No H/Q in entry =           6
  In of MODEL   34
    1    H    VAL  32           H        VAL  32 -31.677  -5.830 -19.782
    2    HA   VAL  32           HA       VAL  32 -33.630  -3.808 -19.105
    3    HB   VAL  32           HB       VAL  32 -31.188  -4.700 -17.539
    4   HG12  VAL  32          HG11      VAL  32 -32.752  -3.956 -15.633
    5   HG11  VAL  32          HG12      VAL  32 -33.631  -3.084 -16.889
    6   HG13  VAL  32          HG13      VAL  32 -31.938  -2.704 -16.575
    7   HG21  VAL  32          HG21      VAL  32 -32.880  -6.495 -18.229
    8   HG23  VAL  32          HG22      VAL  32 -33.951  -5.722 -17.060
    9   HG22  VAL  32          HG23      VAL  32 -32.401  -6.378 -16.536

  No H/Q in entry =           9
  In of MODEL   34
    1    HA   PRO  33           HA       PRO  33 -30.743  -0.735 -20.776
    2    HB2  PRO  33           HB2      PRO  33 -32.354   1.415 -20.634
    3    HB3  PRO  33           HB3      PRO  33 -32.767   0.098 -21.733
    4    HG2  PRO  33           HG2      PRO  33 -33.746   0.555 -18.913
    5    HG3  PRO  33           HG3      PRO  33 -34.706   0.310 -20.372
    6    HD2  PRO  33           HD2      PRO  33 -34.147  -1.747 -18.719
    7    HD3  PRO  33           HD3      PRO  33 -34.207  -1.982 -20.466

  No H/Q in entry =           7
  In of MODEL   34
    1    H    VAL  34           H        VAL  34 -29.447  -1.230 -18.835
    2    HA   VAL  34           HA       VAL  34 -29.268   1.197 -17.176
    3    HB   VAL  34           HB       VAL  34 -28.611  -0.247 -15.247
    4   HG12  VAL  34          HG11      VAL  34 -30.979  -1.232 -14.936
    5   HG11  VAL  34          HG12      VAL  34 -31.338  -0.480 -16.488
    6   HG13  VAL  34          HG13      VAL  34 -30.825   0.514 -15.124
    7   HG21  VAL  34          HG21      VAL  34 -28.712  -2.269 -17.266
    8   HG23  VAL  34          HG22      VAL  34 -29.744  -2.686 -15.898
    9   HG22  VAL  34          HG23      VAL  34 -28.040  -2.321 -15.636

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ILE  35           H        ILE  35 -27.311   1.719 -16.341
    2    HA   ILE  35           HA       ILE  35 -24.952   0.505 -17.621
    3    HB   ILE  35           HB       ILE  35 -25.483   3.369 -16.793
    4   HG12  ILE  35          HG12      ILE  35 -24.452   2.123 -19.348
    5   HG13  ILE  35          HG13      ILE  35 -26.108   2.665 -19.078
    6   HG21  ILE  35          HG21      ILE  35 -22.854   1.960 -17.120
    7   HG23  ILE  35          HG22      ILE  35 -23.357   3.110 -15.883
    8   HG22  ILE  35          HG23      ILE  35 -23.007   3.670 -17.519
    9   HD11  ILE  35          HD11      ILE  35 -24.808   4.920 -18.471
   10   HD13  ILE  35          HD12      ILE  35 -25.335   4.521 -20.107
   11   HD12  ILE  35          HD13      ILE  35 -23.665   4.227 -19.620

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ILE  36           H        ILE  36 -23.668  -0.468 -16.033
    2    HA   ILE  36           HA       ILE  36 -24.124   0.110 -13.157
    3    HB   ILE  36           HB       ILE  36 -23.175  -2.544 -14.284
    4   HG12  ILE  36          HG12      ILE  36 -26.014  -1.875 -13.503
    5   HG13  ILE  36          HG13      ILE  36 -25.451  -1.819 -15.174
    6   HG23  ILE  36          HG21      ILE  36 -23.477  -3.400 -12.173
    7   HG22  ILE  36          HG22      ILE  36 -24.662  -2.174 -11.722
    8   HG21  ILE  36          HG23      ILE  36 -22.949  -1.760 -11.799
    9   HD13  ILE  36          HD11      ILE  36 -25.513  -4.037 -15.392
   10   HD12  ILE  36          HD12      ILE  36 -26.577  -3.973 -13.987
   11   HD11  ILE  36          HD13      ILE  36 -24.861  -4.315 -13.778

  No H/Q in entry =          11
  In of MODEL   34
    1    H    GLU  37           H        GLU  37 -22.369   0.817 -12.056
    2    HA   GLU  37           HA       GLU  37 -19.648   0.153 -12.989
    3    HB2  GLU  37           HB2      GLU  37 -20.671   2.894 -12.265
    4    HB3  GLU  37           HB3      GLU  37 -18.962   2.480 -12.415
    5    HG2  GLU  37           HG2      GLU  37 -19.242   2.044 -14.768
    6    HG3  GLU  37           HG3      GLU  37 -20.973   2.352 -14.643

  No H/Q in entry =           6
  In of MODEL   34
    1    H    ALA  38           H        ALA  38 -18.144  -0.023 -11.314
    2    HA   ALA  38           HA       ALA  38 -19.170   0.092  -8.538
    3    HB1  ALA  38           HB1      ALA  38 -17.373  -1.756  -9.982
    4    HB3  ALA  38           HB2      ALA  38 -18.403  -2.049  -8.581
    5    HB2  ALA  38           HB3      ALA  38 -16.824  -1.291  -8.371

  No H/Q in entry =           5
  In of MODEL   34
    1    H    PHE  39           H        PHE  39 -17.982   1.351  -7.063
    2    HA   PHE  39           HA       PHE  39 -15.522   2.678  -7.964
    3    HB2  PHE  39           HB2      PHE  39 -17.995   4.046  -6.920
    4    HB3  PHE  39           HB3      PHE  39 -16.399   4.791  -6.853
    5    HD1  PHE  39           HD1      PHE  39 -15.114   4.862  -9.127
    6    HD2  PHE  39           HD2      PHE  39 -19.340   4.447  -8.728
    7    HE1  PHE  39           HE1      PHE  39 -15.405   5.727 -11.432
    8    HE2  PHE  39           HE2      PHE  39 -19.646   5.302 -11.024
    9    HZ   PHE  39           HZ       PHE  39 -17.683   5.915 -12.394

  No H/Q in entry =           9
  In of MODEL   34
    1    HA   PRO  40           HA       PRO  40 -14.528   1.948  -3.685
    2    HB2  PRO  40           HB2      PRO  40 -12.860   4.046  -3.077
    3    HB3  PRO  40           HB3      PRO  40 -12.356   2.741  -4.151
    4    HG2  PRO  40           HG2      PRO  40 -13.512   5.426  -4.883
    5    HG3  PRO  40           HG3      PRO  40 -12.053   4.655  -5.500
    6    HD2  PRO  40           HD2      PRO  40 -14.276   4.471  -6.897
    7    HD3  PRO  40           HD3      PRO  40 -13.248   3.049  -6.718

  No H/Q in entry =           7
  In of MODEL   34
    1    H    GLU  41           H        GLU  41 -15.187   2.883  -1.548
    2    HA   GLU  41           HA       GLU  41 -17.513   4.473  -1.512
    3    HB2  GLU  41           HB2      GLU  41 -17.378   4.367   0.853
    4    HB3  GLU  41           HB3      GLU  41 -16.755   2.830   0.252
    5    HG2  GLU  41           HG2      GLU  41 -14.460   3.629   0.621
    6    HG3  GLU  41           HG3      GLU  41 -15.100   5.145   1.254

  No H/Q in entry =           6
  In of MODEL   34
    1    H    THR  42           H        THR  42 -14.231   5.555  -1.573
    2    HA   THR  42           HA       THR  42 -14.705   8.088  -0.346
    3    HB   THR  42           HB       THR  42 -12.586   8.774  -1.453
    4    HG1  THR  42           HG1      THR  42 -11.792   7.621  -3.045
    5   HG23  THR  42          HG21      THR  42 -11.204   7.405  -0.150
    6   HG22  THR  42          HG22      THR  42 -12.198   5.975  -0.431
    7   HG21  THR  42          HG23      THR  42 -12.768   7.245   0.651

  No H/Q in entry =           7
  In of MODEL   34
    1    H    LEU  43           H        LEU  43 -15.568   6.966  -3.448
    2    HA   LEU  43           HA       LEU  43 -15.964   9.728  -4.403
    3    HB2  LEU  43           HB2      LEU  43 -16.210   7.075  -5.811
    4    HB3  LEU  43           HB3      LEU  43 -16.487   8.649  -6.556
    5    HG   LEU  43           HG       LEU  43 -13.830   7.660  -5.550
    6   HD12  LEU  43          HD11      LEU  43 -14.604   8.090  -8.415
    7   HD11  LEU  43          HD12      LEU  43 -14.908   6.546  -7.620
    8   HD13  LEU  43          HD13      LEU  43 -13.261   7.157  -7.754
    9   HD23  LEU  43          HD21      LEU  43 -13.153   9.650  -7.101
   10   HD22  LEU  43          HD22      LEU  43 -13.705   9.976  -5.456
   11   HD21  LEU  43          HD23      LEU  43 -14.806  10.197  -6.814

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ALA  44           H        ALA  44 -17.808   7.798  -2.550
    2    HA   ALA  44           HA       ALA  44 -20.281   7.541  -3.862
    3    HB2  ALA  44           HB1      ALA  44 -20.078   6.422  -1.772
    4    HB3  ALA  44           HB2      ALA  44 -21.250   7.708  -1.488
    5    HB1  ALA  44           HB3      ALA  44 -19.584   7.897  -0.942

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLY  45           H        GLY  45 -18.996  10.401  -2.321
    2    HA3  GLY  45           HA2      GLY  45 -21.507  11.779  -2.663
    3    HA2  GLY  45           HA3      GLY  45 -19.993  12.477  -2.090

  No H/Q in entry =           3
  In of MODEL   34
    1    H    GLU  46           H        GLU  46 -18.427  11.630  -4.392
    2    HA   GLU  46           HA       GLU  46 -19.183  13.819  -6.147
    3    HB2  GLU  46           HB2      GLU  46 -16.884  11.858  -6.167
    4    HB3  GLU  46           HB3      GLU  46 -17.089  13.145  -7.355
    5    HG2  GLU  46           HG2      GLU  46 -15.595  14.088  -5.894
    6    HG3  GLU  46           HG3      GLU  46 -17.131  14.700  -5.280

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LYS  47           H        LYS  47 -18.889  10.313  -6.600
    2    HA   LYS  47           HA       LYS  47 -20.010  10.491  -9.271
    3    HB2  LYS  47           HB2      LYS  47 -18.730   8.444  -7.607
    4    HB3  LYS  47           HB3      LYS  47 -20.078   7.837  -8.568
    5    HG2  LYS  47           HG2      LYS  47 -18.023   7.532  -9.769
    6    HG3  LYS  47           HG3      LYS  47 -19.009   8.747 -10.584
    7    HD2  LYS  47           HD2      LYS  47 -17.712  10.516  -9.463
    8    HD3  LYS  47           HD3      LYS  47 -16.700   9.280  -8.720
    9    HE2  LYS  47           HE2      LYS  47 -17.030   9.673 -11.687
   10    HE3  LYS  47           HE3      LYS  47 -15.684  10.293 -10.732
   11    HZ1  LYS  47           HZ1      LYS  47 -16.191   7.499 -10.335
   12    HZ3  LYS  47           HZ2      LYS  47 -14.733   8.307 -10.655
   13    HZ2  LYS  47           HZ3      LYS  47 -15.769   7.884 -11.934

  No H/Q in entry =          13
  In of MODEL   34
    1    H    GLY  48           H        GLY  48 -21.279   9.653  -6.120
    2    HA3  GLY  48           HA2      GLY  48 -23.605   8.354  -6.857
    3    HA2  GLY  48           HA3      GLY  48 -23.423   9.351  -5.414

  No H/Q in entry =           3
  In of MODEL   34
    1    H    GLN  49           H        GLN  49 -22.968  11.808  -6.974
    2    HA   GLN  49           HA       GLN  49 -25.581  12.791  -7.101
    3    HB2  GLN  49           HB2      GLN  49 -23.090  13.788  -8.469
    4    HB3  GLN  49           HB3      GLN  49 -24.598  14.678  -8.373
    5    HG2  GLN  49           HG2      GLN  49 -24.428  14.698  -5.937
    6    HG3  GLN  49           HG3      GLN  49 -22.932  13.785  -6.030
    7   HE21  GLN  49          HE21      GLN  49 -22.920  16.011  -4.748
    8   HE22  GLN  49          HE22      GLN  49 -22.064  17.314  -5.393

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ASN  50           H        ASN  50 -23.822  11.009  -9.506
    2    HA   ASN  50           HA       ASN  50 -25.755  11.796 -11.576
    3    HB2  ASN  50           HB2      ASN  50 -23.104  10.388 -11.828
    4    HB3  ASN  50           HB3      ASN  50 -24.180  10.767 -13.165
    5   HD21  ASN  50          HD21      ASN  50 -21.582  11.735 -11.561
    6   HD22  ASN  50          HD22      ASN  50 -21.431  13.382 -11.897

  No H/Q in entry =           6
  In of MODEL   34
    1    H    ALA  51           H        ALA  51 -25.614   9.433  -9.341
    2    HA   ALA  51           HA       ALA  51 -26.299   7.260 -11.176
    3    HB2  ALA  51           HB1      ALA  51 -25.643   5.933  -9.499
    4    HB3  ALA  51           HB2      ALA  51 -26.798   6.680  -8.396
    5    HB1  ALA  51           HB3      ALA  51 -25.193   7.382  -8.598

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ASP  52           H        ASP  52 -28.250   6.107 -11.032
    2    HA   ASP  52           HA       ASP  52 -30.515   7.828 -10.347
    3    HB2  ASP  52           HB2      ASP  52 -30.209   5.343 -12.031
    4    HB3  ASP  52           HB3      ASP  52 -31.786   5.997 -11.585

  No H/Q in entry =           4
  In of MODEL   34
    1    H    VAL  53           H        VAL  53 -28.771   5.016  -9.353
    2    HA   VAL  53           HA       VAL  53 -30.203   5.060  -6.830
    3    HB   VAL  53           HB       VAL  53 -31.526   3.358  -8.075
    4   HG11  VAL  53          HG11      VAL  53 -29.746   2.592  -9.611
    5   HG13  VAL  53          HG12      VAL  53 -30.511   1.254  -8.754
    6   HG12  VAL  53          HG13      VAL  53 -28.925   1.831  -8.248
    7   HG23  VAL  53          HG21      VAL  53 -30.601   1.415  -6.397
    8   HG22  VAL  53          HG22      VAL  53 -31.790   2.661  -6.019
    9   HG21  VAL  53          HG23      VAL  53 -30.092   2.914  -5.619

  No H/Q in entry =           9
  In of MODEL   34
    1    H    VAL  54           H        VAL  54 -28.863   4.684  -5.183
    2    HA   VAL  54           HA       VAL  54 -26.068   3.971  -5.812
    3    HB   VAL  54           HB       VAL  54 -27.212   5.685  -3.548
    4   HG11  VAL  54          HG11      VAL  54 -24.569   4.393  -3.857
    5   HG13  VAL  54          HG12      VAL  54 -25.347   5.028  -2.408
    6   HG12  VAL  54          HG13      VAL  54 -24.499   6.119  -3.503
    7   HG22  VAL  54          HG21      VAL  54 -26.446   7.543  -4.641
    8   HG21  VAL  54          HG22      VAL  54 -26.952   6.535  -5.996
    9   HG23  VAL  54          HG23      VAL  54 -25.246   6.640  -5.565

  No H/Q in entry =           9
  In of MODEL   34
    1    H    LEU  55           H        LEU  55 -25.381   2.077  -5.181
    2    HA   LEU  55           HA       LEU  55 -26.813   0.685  -3.005
    3    HB2  LEU  55           HB2      LEU  55 -25.213  -0.396  -5.313
    4    HB3  LEU  55           HB3      LEU  55 -25.922  -1.371  -4.026
    5    HG   LEU  55           HG       LEU  55 -27.444   0.155  -6.129
    6   HD13  LEU  55          HD11      LEU  55 -27.061  -1.675  -7.359
    7   HD12  LEU  55          HD12      LEU  55 -27.969  -2.601  -6.164
    8   HD11  LEU  55          HD13      LEU  55 -26.219  -2.452  -6.021
    9   HD23  LEU  55          HD21      LEU  55 -28.634  -1.860  -4.278
   10   HD22  LEU  55          HD22      LEU  55 -29.399  -0.508  -5.115
   11   HD21  LEU  55          HD23      LEU  55 -28.386  -0.210  -3.703

  No H/Q in entry =          11
  In of MODEL   34
    1    H    LEU  56           H        LEU  56 -25.627   0.138  -1.208
    2    HA   LEU  56           HA       LEU  56 -22.714   0.674  -1.269
    3    HB2  LEU  56           HB2      LEU  56 -24.494   0.365   1.137
    4    HB3  LEU  56           HB3      LEU  56 -22.808   0.876   1.120
    5    HG   LEU  56           HG       LEU  56 -25.188   2.447   0.175
    6   HD11  LEU  56          HD11      LEU  56 -24.044   2.107   2.688
    7   HD13  LEU  56          HD12      LEU  56 -25.101   3.429   2.194
    8   HD12  LEU  56          HD13      LEU  56 -23.351   3.619   2.099
    9   HD23  LEU  56          HD21      LEU  56 -23.328   4.238  -0.019
   10   HD22  LEU  56          HD22      LEU  56 -23.664   3.130  -1.350
   11   HD21  LEU  56          HD23      LEU  56 -22.290   2.837  -0.285

  No H/Q in entry =          11
  In of MODEL   34
    1    H    GLY  57           H        GLY  57 -21.255  -0.892  -0.750
    2    HA3  GLY  57           HA2      GLY  57 -22.048  -3.618  -0.958
    3    HA2  GLY  57           HA3      GLY  57 -20.451  -3.049  -0.480

  No H/Q in entry =           3
  In of MODEL   34
    1    HA   PRO  58           HA       PRO  58 -23.190  -4.238   3.235
    2    HB2  PRO  58           HB2      PRO  58 -22.379  -6.811   3.826
    3    HB3  PRO  58           HB3      PRO  58 -23.786  -6.464   2.821
    4    HG2  PRO  58           HG2      PRO  58 -21.023  -7.210   2.018
    5    HG3  PRO  58           HG3      PRO  58 -22.567  -7.741   1.352
    6    HD2  PRO  58           HD2      PRO  58 -21.053  -5.843   0.131
    7    HD3  PRO  58           HD3      PRO  58 -22.815  -5.840   0.037

  No H/Q in entry =           7
  In of MODEL   34
    1    H    GLN  59           H        GLN  59 -19.804  -4.547   2.611
    2    HA   GLN  59           HA       GLN  59 -19.035  -4.542   5.368
    3    HB2  GLN  59           HB2      GLN  59 -17.494  -3.588   2.950
    4    HB3  GLN  59           HB3      GLN  59 -16.828  -3.811   4.555
    5    HG2  GLN  59           HG2      GLN  59 -16.603  -5.637   2.650
    6    HG3  GLN  59           HG3      GLN  59 -16.734  -6.068   4.347
    7   HE21  GLN  59          HE21      GLN  59 -17.900  -6.507   1.504
    8   HE22  GLN  59          HE22      GLN  59 -19.337  -7.346   1.522

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ILE  60           H        ILE  60 -20.099  -2.027   3.177
    2    HA   ILE  60           HA       ILE  60 -19.331  -0.042   5.228
    3    HB   ILE  60           HB       ILE  60 -19.655   1.683   3.411
    4   HG12  ILE  60          HG12      ILE  60 -19.358  -0.522   1.416
    5   HG13  ILE  60          HG13      ILE  60 -20.967  -0.064   1.975
    6   HG22  ILE  60          HG21      ILE  60 -17.544  -0.245   2.579
    7   HG21  ILE  60          HG22      ILE  60 -17.468   0.569   4.141
    8   HG23  ILE  60          HG23      ILE  60 -17.493   1.516   2.654
    9   HD13  ILE  60          HD11      ILE  60 -20.732   1.258   0.081
   10   HD12  ILE  60          HD12      ILE  60 -19.009   1.514   0.348
   11   HD11  ILE  60          HD13      ILE  60 -20.190   2.360   1.346

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ALA  61           H        ALA  61 -21.708  -1.742   5.301
    2    HA   ALA  61           HA       ALA  61 -24.012  -0.182   4.860
    3    HB1  ALA  61           HB1      ALA  61 -25.149  -1.734   6.184
    4    HB2  ALA  61           HB2      ALA  61 -23.730  -2.062   7.179
    5    HB3  ALA  61           HB3      ALA  61 -23.805  -2.664   5.523

  No H/Q in entry =           5
  In of MODEL   34
    1    H    TYR  62           H        TYR  62 -21.788  -0.203   7.647
    2    HA   TYR  62           HA       TYR  62 -23.412   1.371   9.333
    3    HB2  TYR  62           HB2      TYR  62 -21.397   1.874  10.567
    4    HB3  TYR  62           HB3      TYR  62 -21.358   0.182  10.074
    5    HD1  TYR  62           HD1      TYR  62 -19.756  -0.586   8.354
    6    HD2  TYR  62           HD2      TYR  62 -19.753   3.466   9.710
    7    HE1  TYR  62           HE1      TYR  62 -17.562  -0.235   7.286
    8    HE2  TYR  62           HE2      TYR  62 -17.544   3.812   8.644
    9    HH   TYR  62           HH       TYR  62 -16.163   2.911   7.028

  No H/Q in entry =           9
  In of MODEL   34
    1    H    MET  63           H        MET  63 -21.825   2.319   6.474
    2    HA   MET  63           HA       MET  63 -21.788   5.153   7.180
    3    HB2  MET  63           HB2      MET  63 -21.126   3.676   4.632
    4    HB3  MET  63           HB3      MET  63 -21.008   5.426   4.827
    5    HG2  MET  63           HG2      MET  63 -19.275   5.139   6.497
    6    HG3  MET  63           HG3      MET  63 -19.409   3.388   6.353
    7    HE1  MET  63           HE1      MET  63 -19.040   6.586   4.721
    8    HE3  MET  63           HE2      MET  63 -19.013   6.132   3.017
    9    HE2  MET  63           HE3      MET  63 -17.501   6.454   3.867

  No H/Q in entry =           9
  In of MODEL   34
    1    H    LEU  64           H        LEU  64 -24.267   3.186   6.219
    2    HA   LEU  64           HA       LEU  64 -25.552   4.556   4.153
    3    HB2  LEU  64           HB2      LEU  64 -26.317   2.407   5.065
    4    HB3  LEU  64           HB3      LEU  64 -26.805   3.221   6.551
    5    HG   LEU  64           HG       LEU  64 -28.562   4.402   5.338
    6   HD13  LEU  64          HD11      LEU  64 -28.302   4.666   3.104
    7   HD12  LEU  64          HD12      LEU  64 -28.873   3.003   2.954
    8   HD11  LEU  64          HD13      LEU  64 -27.143   3.342   3.005
    9   HD23  LEU  64          HD21      LEU  64 -28.955   1.571   4.578
   10   HD22  LEU  64          HD22      LEU  64 -29.989   2.655   5.508
   11   HD21  LEU  64          HD23      LEU  64 -28.575   1.922   6.265

  No H/Q in entry =          11
  In of MODEL   34
    1    HA   PRO  65           HA       PRO  65 -27.861   7.594   6.930
    2    HB2  PRO  65           HB2      PRO  65 -25.858   7.834   9.175
    3    HB3  PRO  65           HB3      PRO  65 -27.608   8.034   9.231
    4    HG2  PRO  65           HG2      PRO  65 -26.572   5.820  10.142
    5    HG3  PRO  65           HG3      PRO  65 -27.993   5.727   9.104
    6    HD2  PRO  65           HD2      PRO  65 -25.100   5.248   8.383
    7    HD3  PRO  65           HD3      PRO  65 -26.518   4.298   7.939

  No H/Q in entry =           7
  In of MODEL   34
    1    H    GLU  66           H        GLU  66 -24.306   7.699   6.986
    2    HA   GLU  66           HA       GLU  66 -24.138  10.511   6.593
    3    HB2  GLU  66           HB2      GLU  66 -22.225   8.291   5.921
    4    HB3  GLU  66           HB3      GLU  66 -21.854  10.002   5.720
    5    HG2  GLU  66           HG2      GLU  66 -22.069  10.352   8.090
    6    HG3  GLU  66           HG3      GLU  66 -22.518   8.661   8.316

  No H/Q in entry =           6
  In of MODEL   34
    1    H    ILE  67           H        ILE  67 -24.127   7.773   4.327
    2    HA   ILE  67           HA       ILE  67 -23.800   9.510   2.040
    3    HB   ILE  67           HB       ILE  67 -24.567   6.564   2.211
    4   HG12  ILE  67          HG12      ILE  67 -21.996   7.854   1.281
    5   HG13  ILE  67          HG13      ILE  67 -22.264   7.414   2.967
    6   HG21  ILE  67          HG21      ILE  67 -24.605   8.454  -0.005
    7   HG23  ILE  67          HG22      ILE  67 -25.156   6.779   0.041
    8   HG22  ILE  67          HG23      ILE  67 -23.464   7.141  -0.295
    9   HD12  ILE  67          HD11      ILE  67 -21.777   5.674   0.607
   10   HD11  ILE  67          HD12      ILE  67 -22.758   5.051   1.932
   11   HD13  ILE  67          HD13      ILE  67 -21.106   5.588   2.235

  No H/Q in entry =          11
  In of MODEL   34
    1    H    GLN  68           H        GLN  68 -26.612   8.322   3.683
    2    HA   GLN  68           HA       GLN  68 -28.490   9.180   1.724
    3    HB2  GLN  68           HB2      GLN  68 -28.714   8.797   4.706
    4    HB3  GLN  68           HB3      GLN  68 -30.064   9.339   3.722
    5    HG2  GLN  68           HG2      GLN  68 -30.010   7.315   2.437
    6    HG3  GLN  68           HG3      GLN  68 -28.533   6.799   3.229
    7   HE21  GLN  68          HE21      GLN  68 -30.651   5.348   3.098
    8   HE22  GLN  68          HE22      GLN  68 -31.452   4.849   4.515

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ARG  69           H        ARG  69 -26.945  10.902   4.461
    2    HA   ARG  69           HA       ARG  69 -28.417  13.325   4.074
    3    HB2  ARG  69           HB2      ARG  69 -26.026  12.489   5.645
    4    HB3  ARG  69           HB3      ARG  69 -26.180  14.206   5.296
    5    HG2  ARG  69           HG2      ARG  69 -28.491  14.145   6.280
    6    HG3  ARG  69           HG3      ARG  69 -28.208  12.463   6.744
    7    HD2  ARG  69           HD2      ARG  69 -26.613  14.884   7.661
    8    HD3  ARG  69           HD3      ARG  69 -27.697  13.926   8.657
    9    HE   ARG  69           HE       ARG  69 -25.052  13.111   7.689
   10   HH21  ARG  69          HH11      ARG  69 -24.163  11.378   8.872
   11   HH22  ARG  69          HH12      ARG  69 -25.149  10.514  10.002
   12   HH11  ARG  69          HH21      ARG  69 -27.974  12.430   9.399
   13   HH12  ARG  69          HH22      ARG  69 -27.307  11.107  10.298

  No H/Q in entry =          13
  In of MODEL   34
    1    H    LEU  70           H        LEU  70 -25.496  12.048   2.691
    2    HA   LEU  70           HA       LEU  70 -24.490  14.464   1.530
    3    HB2  LEU  70           HB2      LEU  70 -23.396  12.188   2.108
    4    HB3  LEU  70           HB3      LEU  70 -23.999  11.704   0.524
    5    HG   LEU  70           HG       LEU  70 -22.471  13.148  -0.564
    6   HD11  LEU  70          HD11      LEU  70 -21.669  14.012   2.224
    7   HD13  LEU  70          HD12      LEU  70 -22.414  15.021   0.985
    8   HD12  LEU  70          HD13      LEU  70 -20.777  14.410   0.753
    9   HD22  LEU  70          HD21      LEU  70 -20.965  11.492  -0.348
   10   HD21  LEU  70          HD22      LEU  70 -21.861  10.924   1.062
   11   HD23  LEU  70          HD23      LEU  70 -20.521  12.053   1.264

  No H/Q in entry =          11
  In of MODEL   34
    1    H    LEU  71           H        LEU  71 -26.541  11.839   0.413
    2    HA   LEU  71           HA       LEU  71 -27.143  13.315  -2.093
    3    HB2  LEU  71           HB2      LEU  71 -27.222  10.323  -1.660
    4    HB3  LEU  71           HB3      LEU  71 -27.395  11.185  -3.189
    5    HG   LEU  71           HG       LEU  71 -24.868  11.293  -1.541
    6   HD12  LEU  71          HD11      LEU  71 -24.868   9.676  -3.981
    7   HD11  LEU  71          HD12      LEU  71 -25.844   9.005  -2.676
    8   HD13  LEU  71          HD13      LEU  71 -24.136   9.354  -2.409
    9   HD22  LEU  71          HD21      LEU  71 -25.053  13.111  -3.025
   10   HD21  LEU  71          HD22      LEU  71 -25.516  12.056  -4.360
   11   HD23  LEU  71          HD23      LEU  71 -23.886  11.972  -3.692

  No H/Q in entry =          11
  In of MODEL   34
    1    HA   PRO  72           HA       PRO  72 -30.972  12.698   0.548
    2    HB2  PRO  72           HB2      PRO  72 -31.932  15.222   0.484
    3    HB3  PRO  72           HB3      PRO  72 -30.599  14.818   1.566
    4    HG2  PRO  72           HG2      PRO  72 -30.477  16.033  -1.183
    5    HG3  PRO  72           HG3      PRO  72 -29.724  16.607   0.305
    6    HD2  PRO  72           HD2      PRO  72 -28.336  15.111  -1.476
    7    HD3  PRO  72           HD3      PRO  72 -28.065  14.947   0.257

  No H/Q in entry =           7
  In of MODEL   34
    1    H    ASN  73           H        ASN  73 -30.405  13.692  -2.665
    2    HA   ASN  73           HA       ASN  73 -33.254  13.274  -3.283
    3    HB2  ASN  73           HB2      ASN  73 -32.845  14.408  -5.378
    4    HB3  ASN  73           HB3      ASN  73 -32.353  15.401  -4.014
    5   HD21  ASN  73          HD21      ASN  73 -31.576  15.490  -6.696
    6   HD22  ASN  73          HD22      ASN  73 -29.904  15.396  -6.898

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LYS  74           H        LYS  74 -31.185  11.096  -2.880
    2    HA   LYS  74           HA       LYS  74 -31.713   9.692  -5.432
    3    HB2  LYS  74           HB2      LYS  74 -29.161   9.491  -3.827
    4    HB3  LYS  74           HB3      LYS  74 -29.522   8.671  -5.347
    5    HG2  LYS  74           HG2      LYS  74 -29.371  11.648  -5.131
    6    HG3  LYS  74           HG3      LYS  74 -27.959  10.641  -5.448
    7    HD2  LYS  74           HD2      LYS  74 -29.051   9.680  -7.390
    8    HD3  LYS  74           HD3      LYS  74 -30.505  10.620  -7.057
    9    HE2  LYS  74           HE2      LYS  74 -29.360  12.674  -7.496
   10    HE3  LYS  74           HE3      LYS  74 -27.807  11.844  -7.600
   11    HZ2  LYS  74           HZ1      LYS  74 -29.312  12.399  -9.715
   12    HZ1  LYS  74           HZ2      LYS  74 -29.905  10.851  -9.346
   13    HZ3  LYS  74           HZ3      LYS  74 -28.250  11.077  -9.652

  No H/Q in entry =          13
  In of MODEL   34
    1    HA   PRO  75           HA       PRO  75 -32.975   6.642  -2.468
    2    HB2  PRO  75           HB2      PRO  75 -33.210   4.421  -4.060
    3    HB3  PRO  75           HB3      PRO  75 -34.387   5.732  -4.116
    4    HG2  PRO  75           HG2      PRO  75 -32.039   5.233  -5.903
    5    HG3  PRO  75           HG3      PRO  75 -33.705   5.609  -6.340
    6    HD2  PRO  75           HD2      PRO  75 -31.834   7.546  -6.298
    7    HD3  PRO  75           HD3      PRO  75 -33.478   7.881  -5.748

  No H/Q in entry =           7
  In of MODEL   34
    1    H    VAL  76           H        VAL  76 -31.476   5.636  -1.109
    2    HA   VAL  76           HA       VAL  76 -28.974   4.526  -2.236
    3    HB   VAL  76           HB       VAL  76 -29.301   5.968   0.431
    4   HG11  VAL  76          HG11      VAL  76 -26.906   4.777  -0.981
    5   HG13  VAL  76          HG12      VAL  76 -27.577   4.293   0.580
    6   HG12  VAL  76          HG13      VAL  76 -26.790   5.862   0.407
    7   HG22  VAL  76          HG21      VAL  76 -28.710   7.896  -0.451
    8   HG21  VAL  76          HG22      VAL  76 -29.236   7.188  -1.979
    9   HG23  VAL  76          HG23      VAL  76 -27.529   7.162  -1.534

  No H/Q in entry =           9
  In of MODEL   34
    1    H    GLU  77           H        GLU  77 -28.672   2.378  -1.634
    2    HA   GLU  77           HA       GLU  77 -29.414   1.550   1.020
    3    HB2  GLU  77           HB2      GLU  77 -30.961  -0.154   0.491
    4    HB3  GLU  77           HB3      GLU  77 -31.570   1.349  -0.201
    5    HG2  GLU  77           HG2      GLU  77 -30.945   0.625  -2.395
    6    HG3  GLU  77           HG3      GLU  77 -30.244  -0.850  -1.733

  No H/Q in entry =           6
  In of MODEL   34
    1    H    VAL  78           H        VAL  78 -29.004  -0.526   1.669
    2    HA   VAL  78           HA       VAL  78 -26.316  -1.192   0.763
    3    HB   VAL  78           HB       VAL  78 -27.977  -2.150   3.133
    4   HG11  VAL  78          HG11      VAL  78 -25.598  -3.285   1.990
    5   HG13  VAL  78          HG12      VAL  78 -26.479  -3.796   3.431
    6   HG12  VAL  78          HG13      VAL  78 -25.204  -2.586   3.560
    7   HG22  VAL  78          HG21      VAL  78 -26.563  -0.740   4.470
    8   HG21  VAL  78          HG22      VAL  78 -27.342   0.207   3.203
    9   HG23  VAL  78          HG23      VAL  78 -25.647  -0.256   3.042

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ILE  79           H        ILE  79 -25.711  -3.075  -0.154
    2    HA   ILE  79           HA       ILE  79 -27.721  -4.624  -1.498
    3    HB   ILE  79           HB       ILE  79 -24.712  -5.037  -1.295
    4   HG12  ILE  79          HG12      ILE  79 -26.402  -3.986  -3.570
    5   HG13  ILE  79          HG13      ILE  79 -25.560  -2.949  -2.416
    6   HG22  ILE  79          HG21      ILE  79 -25.781  -6.248  -3.614
    7   HG21  ILE  79          HG22      ILE  79 -26.737  -6.812  -2.243
    8   HG23  ILE  79          HG23      ILE  79 -24.987  -7.024  -2.244
    9   HD13  ILE  79          HD11      ILE  79 -24.153  -3.001  -4.243
   10   HD12  ILE  79          HD12      ILE  79 -24.429  -4.719  -4.530
   11   HD11  ILE  79          HD13      ILE  79 -23.457  -4.200  -3.152

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ASP  80           H        ASP  80 -28.509  -6.581  -0.918
    2    HA   ASP  80           HA       ASP  80 -28.408  -7.490   1.723
    3    HB2  ASP  80           HB2      ASP  80 -30.147  -8.125   0.090
    4    HB3  ASP  80           HB3      ASP  80 -28.956  -9.084  -0.789

  No H/Q in entry =           4
  In of MODEL   34
    1    H    SER  81           H        SER  81 -26.824  -8.570   2.840
    2    HA   SER  81           HA       SER  81 -24.310  -9.152   1.632
    3    HB2  SER  81           HB2      SER  81 -23.705 -10.163   3.794
    4    HB3  SER  81           HB3      SER  81 -24.473  -8.593   4.020
    5    HG   SER  81           HG       SER  81 -26.400  -9.681   4.486

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU  82           H        LEU  82 -26.937 -11.346   1.960
    2    HA   LEU  82           HA       LEU  82 -25.303 -13.652   1.421
    3    HB2  LEU  82           HB2      LEU  82 -28.257 -13.279   0.987
    4    HB3  LEU  82           HB3      LEU  82 -27.391 -14.804   1.155
    5    HG   LEU  82           HG       LEU  82 -27.798 -12.776   3.332
    6   HD11  LEU  82          HD11      LEU  82 -29.123 -15.402   2.648
    7   HD13  LEU  82          HD12      LEU  82 -29.888 -13.831   2.900
    8   HD12  LEU  82          HD13      LEU  82 -29.187 -14.701   4.265
    9   HD23  LEU  82          HD21      LEU  82 -26.902 -14.721   4.694
   10   HD22  LEU  82          HD22      LEU  82 -25.731 -13.915   3.652
   11   HD21  LEU  82          HD23      LEU  82 -26.429 -15.458   3.161

  No H/Q in entry =          11
  In of MODEL   34
    1    H    LEU  83           H        LEU  83 -27.354 -11.494  -0.478
    2    HA   LEU  83           HA       LEU  83 -27.115 -12.834  -2.956
    3    HB2  LEU  83           HB2      LEU  83 -27.632  -9.948  -2.294
    4    HB3  LEU  83           HB3      LEU  83 -27.649 -10.587  -3.937
    5    HG   LEU  83           HG       LEU  83 -29.654 -11.058  -1.752
    6   HD13  LEU  83          HD11      LEU  83 -30.485  -9.236  -2.804
    7   HD12  LEU  83          HD12      LEU  83 -30.913 -10.362  -4.092
    8   HD11  LEU  83          HD13      LEU  83 -29.413  -9.438  -4.189
    9   HD23  LEU  83          HD21      LEU  83 -29.761 -12.311  -4.481
   10   HD22  LEU  83          HD22      LEU  83 -30.708 -12.703  -3.047
   11   HD21  LEU  83          HD23      LEU  83 -29.003 -13.141  -3.123

  No H/Q in entry =          11
  In of MODEL   34
    1    H    TYR  84           H        TYR  84 -25.245 -10.383  -1.280
    2    HA   TYR  84           HA       TYR  84 -23.414  -9.817  -3.418
    3    HB2  TYR  84           HB2      TYR  84 -23.963  -8.339  -1.417
    4    HB3  TYR  84           HB3      TYR  84 -22.949  -9.420  -0.463
    5    HD1  TYR  84           HD1      TYR  84 -20.525  -9.816  -1.445
    6    HD2  TYR  84           HD2      TYR  84 -22.985  -6.447  -2.357
    7    HE1  TYR  84           HE1      TYR  84 -18.517  -8.553  -2.140
    8    HE2  TYR  84           HE2      TYR  84 -20.988  -5.177  -3.064
    9    HH   TYR  84           HH       TYR  84 -18.038  -6.608  -3.689

  No H/Q in entry =           9
  In of MODEL   34
    1    H    GLY  85           H        GLY  85 -23.083 -11.820  -0.481
    2    HA3  GLY  85           HA2      GLY  85 -20.474 -12.664  -0.982
    3    HA2  GLY  85           HA3      GLY  85 -21.667 -13.560  -0.041

  No H/Q in entry =           3
  In of MODEL   34
    1    H    LYS  86           H        LYS  86 -23.509 -13.994  -2.093
    2    HA   LYS  86           HA       LYS  86 -22.373 -16.323  -3.368
    3    HB2  LYS  86           HB2      LYS  86 -24.792 -15.644  -2.383
    4    HB3  LYS  86           HB3      LYS  86 -25.045 -15.281  -4.090
    5    HG2  LYS  86           HG2      LYS  86 -24.639 -17.540  -4.692
    6    HG3  LYS  86           HG3      LYS  86 -24.167 -17.943  -3.040
    7    HD2  LYS  86           HD2      LYS  86 -26.469 -18.597  -3.347
    8    HD3  LYS  86           HD3      LYS  86 -26.425 -17.196  -2.278
    9    HE2  LYS  86           HE2      LYS  86 -27.245 -15.764  -3.913
   10    HE3  LYS  86           HE3      LYS  86 -26.781 -16.844  -5.228
   11    HZ2  LYS  86           HZ1      LYS  86 -29.120 -16.938  -3.480
   12    HZ1  LYS  86           HZ2      LYS  86 -28.444 -18.428  -3.941
   13    HZ3  LYS  86           HZ3      LYS  86 -28.977 -17.334  -5.125

  No H/Q in entry =          13
  In of MODEL   34
    1    H    VAL  87           H        VAL  87 -22.489 -13.106  -4.249
    2    HA   VAL  87           HA       VAL  87 -22.245 -11.915  -6.187
    3    HB   VAL  87           HB       VAL  87 -21.093 -14.373  -7.536
    4   HG11  VAL  87          HG11      VAL  87 -21.376 -11.972  -8.553
    5   HG13  VAL  87          HG12      VAL  87 -19.854 -12.830  -8.789
    6   HG12  VAL  87          HG13      VAL  87 -19.979 -11.580  -7.552
    7   HG23  VAL  87          HG21      VAL  87 -19.504 -12.662  -5.646
    8   HG22  VAL  87          HG22      VAL  87 -19.012 -14.150  -6.451
    9   HG21  VAL  87          HG23      VAL  87 -20.222 -14.199  -5.170

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ASP  88           H        ASP  88 -24.733 -12.653  -5.824
    2    HA   ASP  88           HA       ASP  88 -25.821 -13.903  -8.220
    3    HB2  ASP  88           HB2      ASP  88 -26.792 -14.194  -5.891
    4    HB3  ASP  88           HB3      ASP  88 -27.311 -12.511  -5.982

  No H/Q in entry =           4
  In of MODEL   34
    1    H    GLY  89           H        GLY  89 -25.174 -12.614  -9.860
    2    HA3  GLY  89           HA2      GLY  89 -25.462  -9.849 -10.049
    3    HA2  GLY  89           HA3      GLY  89 -25.404 -10.963 -11.415

  No H/Q in entry =           3
  In of MODEL   34
    1    H    LEU  90           H        LEU  90 -27.794 -12.410 -10.957
    2    HA   LEU  90           HA       LEU  90 -29.684 -10.543 -12.053
    3    HB2  LEU  90           HB2      LEU  90 -29.660 -12.937 -12.641
    4    HB3  LEU  90           HB3      LEU  90 -30.142 -13.328 -10.991
    5    HG   LEU  90           HG       LEU  90 -32.305 -12.292 -11.337
    6   HD13  LEU  90          HD11      LEU  90 -32.201 -10.540 -12.808
    7   HD12  LEU  90          HD12      LEU  90 -32.699 -11.794 -13.946
    8   HD11  LEU  90          HD13      LEU  90 -31.001 -11.334 -13.830
    9   HD23  LEU  90          HD21      LEU  90 -32.187 -13.910 -13.779
   10   HD22  LEU  90          HD22      LEU  90 -33.150 -14.118 -12.317
   11   HD21  LEU  90          HD23      LEU  90 -31.474 -14.666 -12.353

  No H/Q in entry =          11
  In of MODEL   34
    1    H    GLY  91           H        GLY  91 -29.439 -12.047  -8.876
    2    HA3  GLY  91           HA2      GLY  91 -31.813 -11.029  -7.818
    3    HA2  GLY  91           HA3      GLY  91 -30.396 -11.511  -6.886

  No H/Q in entry =           3
  In of MODEL   34
    1    H    VAL  92           H        VAL  92 -28.555  -9.609  -7.747
    2    HA   VAL  92           HA       VAL  92 -29.425  -7.345  -6.185
    3    HB   VAL  92           HB       VAL  92 -26.873  -7.710  -7.798
    4   HG12  VAL  92          HG11      VAL  92 -27.096  -5.840  -5.463
    5   HG11  VAL  92          HG12      VAL  92 -27.791  -5.318  -6.999
    6   HG13  VAL  92          HG13      VAL  92 -26.078  -5.720  -6.899
    7   HG22  VAL  92          HG21      VAL  92 -26.578  -9.293  -6.212
    8   HG21  VAL  92          HG22      VAL  92 -27.746  -8.562  -5.110
    9   HG23  VAL  92          HG23      VAL  92 -26.118  -7.897  -5.238

  No H/Q in entry =           9
  In of MODEL   34
    1    H    LEU  93           H        LEU  93 -29.014  -7.978  -9.610
    2    HA   LEU  93           HA       LEU  93 -29.467  -5.355 -10.528
    3    HB2  LEU  93           HB2      LEU  93 -28.763  -7.179 -12.000
    4    HB3  LEU  93           HB3      LEU  93 -30.324  -7.969 -11.770
    5    HG   LEU  93           HG       LEU  93 -31.418  -6.043 -12.882
    6   HD11  LEU  93          HD11      LEU  93 -29.627  -4.378 -12.383
    7   HD13  LEU  93          HD12      LEU  93 -30.076  -4.420 -14.089
    8   HD12  LEU  93          HD13      LEU  93 -28.589  -5.199 -13.549
    9   HD23  LEU  93          HD21      LEU  93 -30.372  -6.562 -15.177
   10   HD22  LEU  93          HD22      LEU  93 -31.159  -7.853 -14.270
   11   HD21  LEU  93          HD23      LEU  93 -29.398  -7.729 -14.283

  No H/Q in entry =          11
  In of MODEL   34
    1    H    LYS  94           H        LYS  94 -31.736  -7.996  -9.674
    2    HA   LYS  94           HA       LYS  94 -34.139  -6.644 -10.279
    3    HB2  LYS  94           HB2      LYS  94 -33.527  -8.814  -8.278
    4    HB3  LYS  94           HB3      LYS  94 -35.153  -8.181  -8.533
    5    HG2  LYS  94           HG2      LYS  94 -35.050  -8.944 -10.871
    6    HG3  LYS  94           HG3      LYS  94 -33.460  -9.635 -10.555
    7    HD2  LYS  94           HD2      LYS  94 -34.516 -11.017  -8.727
    8    HD3  LYS  94           HD3      LYS  94 -36.086 -10.429  -9.271
    9    HE2  LYS  94           HE2      LYS  94 -35.549 -11.329 -11.544
   10    HE3  LYS  94           HE3      LYS  94 -34.101 -12.059 -10.853
   11    HZ3  LYS  94           HZ1      LYS  94 -35.891 -13.652 -11.016
   12    HZ2  LYS  94           HZ2      LYS  94 -36.899 -12.667 -10.065
   13    HZ1  LYS  94           HZ3      LYS  94 -35.506 -13.364  -9.388

  No H/Q in entry =          13
  In of MODEL   34
    1    H    ALA  95           H        ALA  95 -32.293  -6.704  -7.241
    2    HA   ALA  95           HA       ALA  95 -34.193  -5.202  -5.745
    3    HB2  ALA  95           HB1      ALA  95 -31.762  -6.485  -5.228
    4    HB3  ALA  95           HB2      ALA  95 -32.767  -5.623  -4.065
    5    HB1  ALA  95           HB3      ALA  95 -31.457  -4.781  -4.891

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA  96           H        ALA  96 -31.599  -4.239  -7.855
    2    HA   ALA  96           HA       ALA  96 -31.605  -1.478  -7.072
    3    HB2  ALA  96           HB1      ALA  96 -30.267  -1.192  -9.189
    4    HB3  ALA  96           HB2      ALA  96 -30.506  -2.909  -9.513
    5    HB1  ALA  96           HB3      ALA  96 -29.602  -2.399  -8.088

  No H/Q in entry =           5
  In of MODEL   34
    1    H    VAL  97           H        VAL  97 -33.086  -3.241  -9.755
    2    HA   VAL  97           HA       VAL  97 -34.252  -0.980 -10.996
    3    HB   VAL  97           HB       VAL  97 -34.950  -3.934 -11.044
    4   HG11  VAL  97          HG11      VAL  97 -36.820  -1.996 -11.510
    5   HG13  VAL  97          HG12      VAL  97 -36.824  -3.587 -12.273
    6   HG12  VAL  97          HG13      VAL  97 -36.127  -2.207 -13.120
    7   HG21  VAL  97          HG21      VAL  97 -33.754  -2.051 -13.080
    8   HG23  VAL  97          HG22      VAL  97 -34.144  -3.747 -13.373
    9   HG22  VAL  97          HG23      VAL  97 -32.904  -3.317 -12.194

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ALA  98           H        ALA  98 -35.336  -3.211  -8.460
    2    HA   ALA  98           HA       ALA  98 -37.935  -2.160  -8.088
    3    HB1  ALA  98           HB1      ALA  98 -36.833  -4.324  -7.071
    4    HB3  ALA  98           HB2      ALA  98 -38.041  -3.448  -6.128
    5    HB2  ALA  98           HB3      ALA  98 -36.325  -3.236  -5.779

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA  99           H        ALA  99 -34.877  -1.254  -6.457
    2    HA   ALA  99           HA       ALA  99 -36.069   0.680  -4.781
    3    HB1  ALA  99           HB1      ALA  99 -33.394  -0.108  -5.549
    4    HB2  ALA  99           HB2      ALA  99 -33.962   0.615  -4.043
    5    HB3  ALA  99           HB3      ALA  99 -33.532   1.644  -5.408

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ILE 100           H        ILE 100 -35.055   0.863  -8.142
    2    HA   ILE 100           HA       ILE 100 -35.339   3.703  -8.348
    3    HB   ILE 100           HB       ILE 100 -35.370   1.555 -10.496
    4   HG12  ILE 100          HG12      ILE 100 -33.276   3.622  -9.830
    5   HG13  ILE 100          HG13      ILE 100 -33.248   1.972  -9.206
    6   HG21  ILE 100          HG21      ILE 100 -35.899   4.459 -10.611
    7   HG23  ILE 100          HG22      ILE 100 -36.366   3.177 -11.729
    8   HG22  ILE 100          HG23      ILE 100 -34.738   3.852 -11.791
    9   HD12  ILE 100          HD11      ILE 100 -32.770   2.960 -11.980
   10   HD11  ILE 100          HD12      ILE 100 -33.369   1.321 -11.728
   11   HD13  ILE 100          HD13      ILE 100 -31.836   1.817 -11.015

  No H/Q in entry =          11
  In of MODEL   34
    1    H    LYS 101           H        LYS 101 -37.542   1.016  -9.071
    2    HA   LYS 101           HA       LYS 101 -39.688   2.593 -10.050
    3    HB2  LYS 101           HB2      LYS 101 -39.464  -0.181  -8.936
    4    HB3  LYS 101           HB3      LYS 101 -41.044   0.526  -9.267
    5    HG2  LYS 101           HG2      LYS 101 -40.591   0.688 -11.567
    6    HG3  LYS 101           HG3      LYS 101 -38.879   0.343 -11.325
    7    HD2  LYS 101           HD2      LYS 101 -40.065  -1.605 -12.212
    8    HD3  LYS 101           HD3      LYS 101 -39.417  -1.919 -10.603
    9    HE2  LYS 101           HE2      LYS 101 -41.450  -2.690 -10.086
   10    HE3  LYS 101           HE3      LYS 101 -41.968  -1.003 -10.079
   11    HZ3  LYS 101           HZ1      LYS 101 -42.867  -1.184 -12.191
   12    HZ2  LYS 101           HZ2      LYS 101 -43.270  -2.676 -11.487
   13    HZ1  LYS 101           HZ3      LYS 101 -41.973  -2.575 -12.579

  No H/Q in entry =          13
  In of MODEL   34
    1    H    LYS 102           H        LYS 102 -39.122   1.120  -6.851
    2    HA   LYS 102           HA       LYS 102 -41.404   2.228  -5.634
    3    HB2  LYS 102           HB2      LYS 102 -40.093   0.403  -4.635
    4    HB3  LYS 102           HB3      LYS 102 -38.740   1.506  -4.395
    5    HG2  LYS 102           HG2      LYS 102 -40.097   2.846  -2.883
    6    HG3  LYS 102           HG3      LYS 102 -41.454   1.746  -3.125
    7    HD2  LYS 102           HD2      LYS 102 -40.155  -0.080  -2.117
    8    HD3  LYS 102           HD3      LYS 102 -38.798   1.022  -1.873
    9    HE2  LYS 102           HE2      LYS 102 -40.196   2.443  -0.447
   10    HE3  LYS 102           HE3      LYS 102 -41.571   1.372  -0.712
   11    HZ1  LYS 102           HZ1      LYS 102 -39.782  -0.324   0.272
   12    HZ3  LYS 102           HZ2      LYS 102 -40.917   0.516   1.213
   13    HZ2  LYS 102           HZ3      LYS 102 -39.328   1.099   1.079

  No H/Q in entry =          13
  In of MODEL   34
    1    H    ALA 103           H        ALA 103 -38.507   3.730  -6.658
    2    HA   ALA 103           HA       ALA 103 -38.802   6.027  -4.863
    3    HB2  ALA 103           HB1      ALA 103 -36.849   6.839  -6.447
    4    HB3  ALA 103           HB2      ALA 103 -36.754   5.126  -6.854
    5    HB1  ALA 103           HB3      ALA 103 -36.536   5.649  -5.184

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA 104           H        ALA 104 -39.417   5.290  -8.208
    2    HA   ALA 104           HA       ALA 104 -40.106   8.054  -8.813
    3    HB2  ALA 104           HB1      ALA 104 -40.139   7.396 -11.019
    4    HB1  ALA 104           HB2      ALA 104 -40.807   5.807 -10.645
    5    HB3  ALA 104           HB3      ALA 104 -39.094   6.131 -10.374

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA 105           H        ALA 105 -41.627   5.885  -7.010
    2    HA   ALA 105           HA       ALA 105 -44.099   7.190  -6.961
    3    HB2  ALA 105           HB1      ALA 105 -44.825   6.313  -9.000
    4    HB3  ALA 105           HB2      ALA 105 -45.412   5.097  -7.866
    5    HB1  ALA 105           HB3      ALA 105 -43.936   4.807  -8.784

  No H/Q in entry =           5
  In of MODEL   35
    1    H1   ALA   1           H3       ALA   1 -12.438 -15.419  -2.451
    2    H2   ALA   1           H2       ALA   1 -11.511 -16.575  -3.288
    3    H3   ALA   1           H1       ALA   1 -12.638 -15.613  -4.125
    4    HA   ALA   1           HA       ALA   1 -14.062 -17.293  -3.891
    5    HB3  ALA   1           HB1      ALA   1 -12.694 -19.085  -3.424
    6    HB1  ALA   1           HB2      ALA   1 -13.453 -18.961  -1.837
    7    HB2  ALA   1           HB3      ALA   1 -11.866 -18.244  -2.113

  No H/Q in entry =           7
  In of MODEL   35
    1    H    GLU   2           H        GLU   2 -15.703 -18.124  -2.242
    2    HA   GLU   2           HA       GLU   2 -17.329 -16.379  -1.188
    3    HB2  GLU   2           HB2      GLU   2 -16.431 -18.818   0.359
    4    HB3  GLU   2           HB3      GLU   2 -17.943 -17.946   0.608
    5    HG2  GLU   2           HG2      GLU   2 -18.932 -19.018  -1.129
    6    HG3  GLU   2           HG3      GLU   2 -17.600 -18.636  -2.209

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLU   3           H        GLU   3 -15.445 -17.760   1.441
    2    HA   GLU   3           HA       GLU   3 -15.638 -15.404   2.998
    3    HB2  GLU   3           HB2      GLU   3 -14.091 -17.974   3.253
    4    HB3  GLU   3           HB3      GLU   3 -13.844 -16.658   4.401
    5    HG2  GLU   3           HG2      GLU   3 -16.042 -16.777   5.212
    6    HG3  GLU   3           HG3      GLU   3 -16.644 -17.568   3.761

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LEU   4           H        LEU   4 -12.700 -16.926   1.617
    2    HA   LEU   4           HA       LEU   4 -10.840 -15.050   2.221
    3    HB2  LEU   4           HB2      LEU   4 -11.081 -16.344  -0.504
    4    HB3  LEU   4           HB3      LEU   4  -9.620 -15.645   0.185
    5    HG   LEU   4           HG       LEU   4 -11.153 -18.020   1.293
    6   HD13  LEU   4          HD11      LEU   4  -9.538 -19.400   0.369
    7   HD12  LEU   4          HD12      LEU   4  -8.309 -18.135   0.347
    8   HD11  LEU   4          HD13      LEU   4  -9.594 -18.138  -0.860
    9   HD23  LEU   4          HD21      LEU   4  -8.908 -18.117   2.682
   10   HD22  LEU   4          HD22      LEU   4 -10.216 -17.058   3.207
   11   HD21  LEU   4          HD23      LEU   4  -8.840 -16.389   2.329

  No H/Q in entry =          11
  In of MODEL   35
    1    H    GLU   5           H        GLU   5 -13.162 -14.809  -0.461
    2    HA   GLU   5           HA       GLU   5 -12.119 -12.340  -1.458
    3    HB2  GLU   5           HB2      GLU   5 -13.482 -13.905  -2.826
    4    HB3  GLU   5           HB3      GLU   5 -14.881 -13.524  -1.820
    5    HG2  GLU   5           HG2      GLU   5 -14.710 -11.154  -2.456
    6    HG3  GLU   5           HG3      GLU   5 -13.297 -11.517  -3.447

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLU   6           H        GLU   6 -14.864 -13.178   0.624
    2    HA   GLU   6           HA       GLU   6 -15.730 -10.488   1.021
    3    HB2  GLU   6           HB2      GLU   6 -17.186 -12.461   1.414
    4    HB3  GLU   6           HB3      GLU   6 -16.167 -12.916   2.779
    5    HG2  GLU   6           HG2      GLU   6 -16.669 -10.775   3.884
    6    HG3  GLU   6           HG3      GLU   6 -17.673 -10.298   2.517

  No H/Q in entry =           6
  In of MODEL   35
    1    H    VAL   7           H        VAL   7 -13.460 -12.633   2.600
    2    HA   VAL   7           HA       VAL   7 -12.978 -11.065   4.929
    3    HB   VAL   7           HB       VAL   7 -11.300 -13.133   3.486
    4   HG11  VAL   7          HG11      VAL   7 -10.819 -11.608   6.052
    5   HG13  VAL   7          HG12      VAL   7  -9.717 -11.838   4.695
    6   HG12  VAL   7          HG13      VAL   7 -10.094 -13.190   5.763
    7   HG21  VAL   7          HG21      VAL   7 -13.564 -13.664   4.698
    8   HG23  VAL   7          HG22      VAL   7 -12.638 -13.404   6.176
    9   HG22  VAL   7          HG23      VAL   7 -12.160 -14.671   5.049

  No H/Q in entry =           9
  In of MODEL   35
    1    H    VAL   8           H        VAL   8 -11.457 -11.202   1.725
    2    HA   VAL   8           HA       VAL   8  -9.369  -9.360   2.225
    3    HB   VAL   8           HB       VAL   8 -10.819 -10.158  -0.300
    4   HG11  VAL   8          HG11      VAL   8  -8.604  -8.138   0.112
    5   HG13  VAL   8          HG12      VAL   8 -10.124  -7.924  -0.757
    6   HG12  VAL   8          HG13      VAL   8  -8.860  -8.949  -1.434
    7   HG23  VAL   8          HG21      VAL   8  -8.030 -10.722  -0.370
    8   HG22  VAL   8          HG22      VAL   8  -9.343 -11.879  -0.182
    9   HG21  VAL   8          HG23      VAL   8  -8.575 -11.188   1.243

  No H/Q in entry =           9
  In of MODEL   35
    1    H    MET   9           H        MET   9 -12.704  -8.920   1.053
    2    HA   MET   9           HA       MET   9 -12.597  -6.145   0.618
    3    HB2  MET   9           HB2      MET   9 -14.833  -8.004   1.416
    4    HB3  MET   9           HB3      MET   9 -15.101  -6.267   1.248
    5    HG2  MET   9           HG2      MET   9 -14.199  -6.380  -1.068
    6    HG3  MET   9           HG3      MET   9 -14.032  -8.127  -0.894
    7    HE3  MET   9           HE1      MET   9 -17.836  -5.608  -0.915
    8    HE2  MET   9           HE2      MET   9 -16.557  -5.334  -2.094
    9    HE1  MET   9           HE3      MET   9 -16.209  -5.172  -0.375

  No H/Q in entry =           9
  In of MODEL   35
    1    H    GLY  10           H        GLY  10 -13.299  -8.026   3.543
    2    HA3  GLY  10           HA2      GLY  10 -13.821  -5.833   5.260
    3    HA2  GLY  10           HA3      GLY  10 -13.282  -7.430   5.776

  No H/Q in entry =           3
  In of MODEL   35
    1    H    LEU  11           H        LEU  11 -10.834  -7.590   4.470
    2    HA   LEU  11           HA       LEU  11  -9.119  -6.181   6.233
    3    HB2  LEU  11           HB2      LEU  11  -8.584  -7.613   3.628
    4    HB3  LEU  11           HB3      LEU  11  -7.307  -6.927   4.631
    5    HG   LEU  11           HG       LEU  11  -9.342  -8.931   5.640
    6   HD13  LEU  11          HD11      LEU  11  -8.133 -10.185   4.080
    7   HD12  LEU  11          HD12      LEU  11  -7.206 -10.437   5.559
    8   HD11  LEU  11          HD13      LEU  11  -6.645  -9.280   4.353
    9   HD22  LEU  11          HD21      LEU  11  -8.481  -7.930   7.560
   10   HD21  LEU  11          HD22      LEU  11  -6.935  -7.551   6.803
   11   HD23  LEU  11          HD23      LEU  11  -7.287  -9.202   7.311

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  12           H        ILE  12 -10.000  -5.622   2.840
    2    HA   ILE  12           HA       ILE  12  -8.276  -3.416   2.420
    3    HB   ILE  12           HB       ILE  12 -10.934  -4.046   1.114
    4   HG12  ILE  12          HG12      ILE  12  -8.926  -5.732   1.050
    5   HG13  ILE  12          HG13      ILE  12  -9.775  -5.364  -0.436
    6   HG22  ILE  12          HG21      ILE  12 -10.002  -2.668  -0.769
    7   HG21  ILE  12          HG22      ILE  12  -8.673  -2.194   0.281
    8   HG23  ILE  12          HG23      ILE  12 -10.310  -1.758   0.679
    9   HD11  ILE  12          HD11      ILE  12  -7.241  -3.975   0.473
   10   HD13  ILE  12          HD12      ILE  12  -8.026  -3.836  -1.098
   11   HD12  ILE  12          HD13      ILE  12  -7.269  -5.339  -0.629

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  13           H        ILE  13 -11.644  -3.636   3.500
    2    HA   ILE  13           HA       ILE  13 -12.066  -0.843   3.768
    3    HB   ILE  13           HB       ILE  13 -13.310  -3.252   5.114
    4   HG12  ILE  13          HG12      ILE  13 -13.526  -2.673   2.582
    5   HG13  ILE  13          HG13      ILE  13 -14.957  -3.125   3.482
    6   HG22  ILE  13          HG21      ILE  13 -15.189  -1.538   5.644
    7   HG21  ILE  13          HG22      ILE  13 -13.942  -0.313   5.449
    8   HG23  ILE  13          HG23      ILE  13 -13.772  -1.553   6.690
    9   HD13  ILE  13          HD11      ILE  13 -15.619  -0.802   3.733
   10   HD12  ILE  13          HD12      ILE  13 -15.285  -1.124   2.043
   11   HD11  ILE  13          HD13      ILE  13 -14.100  -0.270   3.005

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ASN  14           H        ASN  14 -10.998  -3.348   6.047
    2    HA   ASN  14           HA       ASN  14 -10.784  -1.712   8.333
    3    HB2  ASN  14           HB2      ASN  14 -10.565  -4.323   8.013
    4    HB3  ASN  14           HB3      ASN  14  -8.850  -3.959   7.862
    5   HD21  ASN  14          HD21      ASN  14  -9.515  -5.474  10.036
    6   HD22  ASN  14          HD22      ASN  14  -9.481  -4.554  11.460

  No H/Q in entry =           6
  In of MODEL   35
    1    H    SER  15           H        SER  15  -8.383  -2.568   5.851
    2    HA   SER  15           HA       SER  15  -6.225  -1.104   6.931
    3    HB2  SER  15           HB2      SER  15  -5.199  -1.333   4.777
    4    HB3  SER  15           HB3      SER  15  -6.175  -2.780   4.998
    5    HG   SER  15           HG       SER  15  -6.875  -0.438   3.560

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLY  16           H        GLY  16  -8.806  -0.204   4.674
    2    HA3  GLY  16           HA2      GLY  16  -7.912   2.426   4.125
    3    HA2  GLY  16           HA3      GLY  16  -9.569   1.852   3.957

  No H/Q in entry =           3
  In of MODEL   35
    1    H    GLN  17           H        GLN  17 -10.132   1.135   6.604
    2    HA   GLN  17           HA       GLN  17 -10.812   3.648   7.742
    3    HB2  GLN  17           HB2      GLN  17 -12.061   1.560   8.215
    4    HB3  GLN  17           HB3      GLN  17 -10.669   0.949   9.110
    5    HG2  GLN  17           HG2      GLN  17 -12.253   1.915  10.687
    6    HG3  GLN  17           HG3      GLN  17 -10.822   2.941  10.613
    7   HE21  GLN  17          HE21      GLN  17 -11.769   4.992  11.020
    8   HE22  GLN  17          HE22      GLN  17 -12.976   5.672  10.039

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ALA  18           H        ALA  18  -8.214   1.335   8.372
    2    HA   ALA  18           HA       ALA  18  -7.111   2.538  10.646
    3    HB2  ALA  18           HB1      ALA  18  -6.522   0.314   9.282
    4    HB3  ALA  18           HB2      ALA  18  -5.354   1.084  10.357
    5    HB1  ALA  18           HB3      ALA  18  -5.267   1.361   8.617

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ARG  19           H        ARG  19  -6.319   3.051   7.201
    2    HA   ARG  19           HA       ARG  19  -4.399   5.076   7.636
    3    HB2  ARG  19           HB2      ARG  19  -4.731   3.938   5.440
    4    HB3  ARG  19           HB3      ARG  19  -6.263   4.797   5.257
    5    HG2  ARG  19           HG2      ARG  19  -5.109   6.955   5.329
    6    HG3  ARG  19           HG3      ARG  19  -3.570   6.152   5.639
    7    HD2  ARG  19           HD2      ARG  19  -3.679   6.743   3.295
    8    HD3  ARG  19           HD3      ARG  19  -3.785   4.984   3.441
    9    HE   ARG  19           HE       ARG  19  -6.408   5.924   3.423
   10   HH21  ARG  19          HH11      ARG  19  -7.593   6.093   1.500
   11   HH22  ARG  19          HH12      ARG  19  -6.765   6.160  -0.016
   12   HH11  ARG  19          HH21      ARG  19  -3.624   5.954   1.400
   13   HH12  ARG  19          HH22      ARG  19  -4.516   6.079  -0.073

  No H/Q in entry =          13
  In of MODEL   35
    1    H    SER  20           H        SER  20  -7.893   5.231   7.022
    2    HA   SER  20           HA       SER  20  -8.218   7.991   6.971
    3    HB2  SER  20           HB2      SER  20 -10.108   6.669   6.428
    4    HB3  SER  20           HB3      SER  20 -10.016   5.778   7.945
    5    HG   SER  20           HG       SER  20 -10.604   8.540   7.623

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU  21           H        LEU  21  -8.254   5.809   9.776
    2    HA   LEU  21           HA       LEU  21  -8.681   7.811  11.738
    3    HB2  LEU  21           HB2      LEU  21  -7.356   5.096  11.907
    4    HB3  LEU  21           HB3      LEU  21  -7.666   6.116  13.308
    5    HG   LEU  21           HG       LEU  21  -9.830   5.236  11.375
    6   HD13  LEU  21          HD11      LEU  21 -10.436   3.540  13.012
    7   HD12  LEU  21          HD12      LEU  21  -9.147   4.071  14.090
    8   HD11  LEU  21          HD13      LEU  21  -8.749   3.310  12.548
    9   HD21  LEU  21          HD21      LEU  21  -9.763   6.755  13.973
   10   HD23  LEU  21          HD22      LEU  21 -11.176   5.769  13.610
   11   HD22  LEU  21          HD23      LEU  21 -10.723   7.081  12.533

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ALA  22           H        ALA  22  -5.738   6.405  10.344
    2    HA   ALA  22           HA       ALA  22  -3.851   7.699  11.973
    3    HB2  ALA  22           HB1      ALA  22  -3.448   5.839  10.285
    4    HB1  ALA  22           HB2      ALA  22  -2.238   7.122  10.324
    5    HB3  ALA  22           HB3      ALA  22  -3.451   7.091   9.043

  No H/Q in entry =           5
  In of MODEL   35
    1    H    TYR  23           H        TYR  23  -5.143   8.728   8.784
    2    HA   TYR  23           HA       TYR  23  -3.780  11.209   8.719
    3    HB2  TYR  23           HB2      TYR  23  -4.862  10.308   6.723
    4    HB3  TYR  23           HB3      TYR  23  -6.443  10.433   7.498
    5    HD1  TYR  23           HD1      TYR  23  -3.515  12.438   6.346
    6    HD2  TYR  23           HD2      TYR  23  -7.656  12.462   7.483
    7    HE1  TYR  23           HE1      TYR  23  -3.710  14.790   5.583
    8    HE2  TYR  23           HE2      TYR  23  -7.852  14.814   6.718
    9    HH   TYR  23           HH       TYR  23  -5.760  16.832   6.433

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ALA  24           H        ALA  24  -6.916  10.266  10.085
    2    HA   ALA  24           HA       ALA  24  -7.728  12.865  10.851
    3    HB1  ALA  24           HB1      ALA  24  -9.562  11.634  11.312
    4    HB2  ALA  24           HB2      ALA  24  -8.748  11.055  12.763
    5    HB3  ALA  24           HB3      ALA  24  -8.626  10.140  11.261

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA  25           H        ALA  25  -5.759  10.387  12.435
    2    HA   ALA  25           HA       ALA  25  -5.419  11.637  14.938
    3    HB2  ALA  25           HB1      ALA  25  -4.674   9.276  14.122
    4    HB3  ALA  25           HB2      ALA  25  -3.654  10.124  15.287
    5    HB1  ALA  25           HB3      ALA  25  -3.211  10.102  13.579

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU  26           H        LEU  26  -3.612  11.915  11.906
    2    HA   LEU  26           HA       LEU  26  -1.638  13.714  12.829
    3    HB2  LEU  26           HB2      LEU  26  -1.339  12.558  10.727
    4    HB3  LEU  26           HB3      LEU  26  -2.802  13.282  10.066
    5    HG   LEU  26           HG       LEU  26  -1.764  15.521  10.205
    6   HD12  LEU  26          HD11      LEU  26   0.773  15.513  10.630
    7   HD11  LEU  26          HD12      LEU  26   0.529  13.936  11.374
    8   HD13  LEU  26          HD13      LEU  26  -0.266  15.360  12.046
    9   HD21  LEU  26          HD21      LEU  26  -0.037  13.447   8.818
   10   HD23  LEU  26          HD22      LEU  26  -0.060  15.168   8.447
   11   HD22  LEU  26          HD23      LEU  26  -1.493  14.186   8.153

  No H/Q in entry =          11
  In of MODEL   35
    1    H    LYS  27           H        LYS  27  -4.808  14.231  11.338
    2    HA   LYS  27           HA       LYS  27  -4.721  17.019  11.139
    3    HB2  LYS  27           HB2      LYS  27  -6.477  15.560  10.146
    4    HB3  LYS  27           HB3      LYS  27  -7.143  15.312  11.759
    5    HG2  LYS  27           HG2      LYS  27  -7.547  17.723  11.992
    6    HG3  LYS  27           HG3      LYS  27  -6.829  18.011  10.405
    7    HD2  LYS  27           HD2      LYS  27  -8.573  16.595   9.361
    8    HD3  LYS  27           HD3      LYS  27  -9.297  16.324  10.948
    9    HE2  LYS  27           HE2      LYS  27  -9.714  18.740  11.188
   10    HE3  LYS  27           HE3      LYS  27  -8.961  19.033   9.617
   11    HZ3  LYS  27           HZ1      LYS  27 -11.339  18.934   9.365
   12    HZ2  LYS  27           HZ2      LYS  27 -11.407  17.419  10.135
   13    HZ1  LYS  27           HZ3      LYS  27 -10.654  17.573   8.616

  No H/Q in entry =          13
  In of MODEL   35
    1    H    GLN  28           H        GLN  28  -5.645  14.944  13.863
    2    HA   GLN  28           HA       GLN  28  -6.525  16.959  15.634
    3    HB2  GLN  28           HB2      GLN  28  -5.159  14.309  16.179
    4    HB3  GLN  28           HB3      GLN  28  -5.884  15.324  17.428
    5    HG2  GLN  28           HG2      GLN  28  -7.370  14.243  15.018
    6    HG3  GLN  28           HG3      GLN  28  -7.425  13.529  16.630
    7   HE21  GLN  28          HE21      GLN  28  -9.289  15.381  14.703
    8   HE22  GLN  28          HE22      GLN  28 -10.017  16.393  15.855

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ALA  29           H        ALA  29  -3.319  15.624  14.959
    2    HA   ALA  29           HA       ALA  29  -1.872  17.005  16.943
    3    HB1  ALA  29           HB1      ALA  29   0.055  16.290  15.832
    4    HB3  ALA  29           HB2      ALA  29  -0.692  16.423  14.240
    5    HB2  ALA  29           HB3      ALA  29  -1.134  15.096  15.313

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LYS  30           H        LYS  30  -2.705  17.894  13.609
    2    HA   LYS  30           HA       LYS  30  -1.262  20.315  13.514
    3    HB2  LYS  30           HB2      LYS  30  -3.799  19.475  12.095
    4    HB3  LYS  30           HB3      LYS  30  -2.943  20.978  11.754
    5    HG2  LYS  30           HG2      LYS  30  -0.889  19.656  11.249
    6    HG3  LYS  30           HG3      LYS  30  -1.817  18.173  11.491
    7    HD2  LYS  30           HD2      LYS  30  -3.364  18.834   9.690
    8    HD3  LYS  30           HD3      LYS  30  -2.459  20.330   9.450
    9    HE2  LYS  30           HE2      LYS  30  -0.443  19.008   8.879
   10    HE3  LYS  30           HE3      LYS  30  -1.367  17.518   9.088
   11    HZ2  LYS  30           HZ1      LYS  30  -1.169  18.386   6.747
   12    HZ1  LYS  30           HZ2      LYS  30  -2.196  19.663   7.210
   13    HZ3  LYS  30           HZ3      LYS  30  -2.744  18.054   7.280

  No H/Q in entry =          13
  In of MODEL   35
    1    H    GLN  31           H        GLN  31  -4.380  19.508  14.914
    2    HA   GLN  31           HA       GLN  31  -5.104  22.276  15.362
    3    HB2  GLN  31           HB2      GLN  31  -6.325  19.848  16.681
    4    HB3  GLN  31           HB3      GLN  31  -7.060  21.430  16.432
    5    HG2  GLN  31           HG2      GLN  31  -6.352  20.642  13.845
    6    HG3  GLN  31           HG3      GLN  31  -6.902  19.146  14.590
    7   HE21  GLN  31          HE21      GLN  31  -8.280  20.740  12.483
    8   HE22  GLN  31          HE22      GLN  31  -9.790  21.155  13.135

  No H/Q in entry =           8
  In of MODEL   35
    1    H    GLY  32           H        GLY  32  -2.827  20.314  16.692
    2    HA3  GLY  32           HA2      GLY  32  -1.426  20.755  18.499
    3    HA2  GLY  32           HA3      GLY  32  -2.538  22.015  19.018

  No H/Q in entry =           3
  In of MODEL   35
    1    H    ASP  33           H        ASP  33  -4.005  18.998  18.351
    2    HA   ASP  33           HA       ASP  33  -4.433  18.547  21.230
    3    HB2  ASP  33           HB2      ASP  33  -5.846  17.557  18.747
    4    HB3  ASP  33           HB3      ASP  33  -6.207  16.952  20.362

  No H/Q in entry =           4
  In of MODEL   35
    1    H    PHE  34           H        PHE  34  -2.280  17.662  21.543
    2    HA   PHE  34           HA       PHE  34  -1.309  15.398  20.146
    3    HB2  PHE  34           HB2      PHE  34  -0.687  16.373  22.943
    4    HB3  PHE  34           HB3      PHE  34   0.225  15.135  22.079
    5    HD1  PHE  34           HD1      PHE  34   0.104  18.563  22.814
    6    HD2  PHE  34           HD2      PHE  34   0.904  15.848  19.582
    7    HE1  PHE  34           HE1      PHE  34   1.431  20.314  21.665
    8    HE2  PHE  34           HE2      PHE  34   2.226  17.602  18.438
    9    HZ   PHE  34           HZ       PHE  34   2.492  19.832  19.484

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ALA  35           H        ALA  35  -3.355  15.707  23.001
    2    HA   ALA  35           HA       ALA  35  -3.188  13.042  23.898
    3    HB3  ALA  35           HB1      ALA  35  -5.639  13.706  24.747
    4    HB1  ALA  35           HB2      ALA  35  -5.079  15.316  24.293
    5    HB2  ALA  35           HB3      ALA  35  -4.184  14.378  25.487

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA  36           H        ALA  36  -5.606  14.597  21.790
    2    HA   ALA  36           HA       ALA  36  -7.057  12.207  21.306
    3    HB1  ALA  36           HB1      ALA  36  -8.487  13.653  20.345
    4    HB3  ALA  36           HB2      ALA  36  -7.303  14.055  19.100
    5    HB2  ALA  36           HB3      ALA  36  -7.320  14.943  20.624

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA  37           H        ALA  37  -4.346  13.753  19.648
    2    HA   ALA  37           HA       ALA  37  -4.328  12.117  17.351
    3    HB3  ALA  37           HB1      ALA  37  -2.314  13.798  18.781
    4    HB2  ALA  37           HB2      ALA  37  -2.837  13.862  17.099
    5    HB1  ALA  37           HB3      ALA  37  -1.705  12.614  17.624

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LYS  38           H        LYS  38  -2.587  11.783  20.435
    2    HA   LYS  38           HA       LYS  38  -1.298   9.363  19.951
    3    HB2  LYS  38           HB2      LYS  38  -1.601  11.130  22.095
    4    HB3  LYS  38           HB3      LYS  38  -2.246   9.611  22.709
    5    HG2  LYS  38           HG2      LYS  38  -0.168   8.458  22.180
    6    HG3  LYS  38           HG3      LYS  38   0.466   9.893  21.369
    7    HD2  LYS  38           HD2      LYS  38   0.647  11.109  23.405
    8    HD3  LYS  38           HD3      LYS  38  -0.393   9.974  24.268
    9    HE2  LYS  38           HE2      LYS  38   1.954   9.622  24.896
   10    HE3  LYS  38           HE3      LYS  38   1.331   8.215  24.029
   11    HZ3  LYS  38           HZ1      LYS  38   2.645   8.614  22.253
   12    HZ2  LYS  38           HZ2      LYS  38   3.608   9.427  23.394
   13    HZ1  LYS  38           HZ3      LYS  38   2.546  10.304  22.398

  No H/Q in entry =          13
  In of MODEL   35
    1    H    ALA  39           H        ALA  39  -4.533   9.908  21.341
    2    HA   ALA  39           HA       ALA  39  -5.138   7.198  21.843
    3    HB3  ALA  39           HB1      ALA  39  -7.263   9.176  21.068
    4    HB2  ALA  39           HB2      ALA  39  -6.367   9.389  22.573
    5    HB1  ALA  39           HB3      ALA  39  -7.306   7.919  22.306

  No H/Q in entry =           5
  In of MODEL   35
    1    H    MET  40           H        MET  40  -5.681   9.221  18.995
    2    HA   MET  40           HA       MET  40  -7.181   7.312  17.528
    3    HB2  MET  40           HB2      MET  40  -5.531   9.682  16.630
    4    HB3  MET  40           HB3      MET  40  -6.568   8.739  15.556
    5    HG2  MET  40           HG2      MET  40  -7.593  10.003  18.110
    6    HG3  MET  40           HG3      MET  40  -7.631  10.839  16.560
    7    HE3  MET  40           HE1      MET  40 -10.232   9.260  14.486
    8    HE2  MET  40           HE2      MET  40  -8.477   9.350  14.344
    9    HE1  MET  40           HE3      MET  40  -9.376  10.730  14.975

  No H/Q in entry =           9
  In of MODEL   35
    1    H    MET  41           H        MET  41  -3.680   7.996  17.664
    2    HA   MET  41           HA       MET  41  -2.940   6.230  15.566
    3    HB2  MET  41           HB2      MET  41  -1.323   6.872  18.046
    4    HB3  MET  41           HB3      MET  41  -0.710   6.215  16.532
    5    HG2  MET  41           HG2      MET  41  -1.829   8.415  15.524
    6    HG3  MET  41           HG3      MET  41  -1.590   8.999  17.170
    7    HE2  MET  41           HE1      MET  41   1.294   6.857  17.542
    8    HE1  MET  41           HE2      MET  41   0.522   8.162  18.438
    9    HE3  MET  41           HE3      MET  41   2.151   8.381  17.801

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ASP  42           H        ASP  42  -3.345   5.762  19.051
    2    HA   ASP  42           HA       ASP  42  -2.349   3.153  19.214
    3    HB2  ASP  42           HB2      ASP  42  -3.203   4.925  21.034
    4    HB3  ASP  42           HB3      ASP  42  -4.645   3.921  20.956

  No H/Q in entry =           4
  In of MODEL   35
    1    H    GLN  43           H        GLN  43  -5.664   4.306  18.701
    2    HA   GLN  43           HA       GLN  43  -6.845   1.736  18.501
    3    HB2  GLN  43           HB2      GLN  43  -7.724   4.402  17.369
    4    HB3  GLN  43           HB3      GLN  43  -8.709   2.937  17.343
    5    HG2  GLN  43           HG2      GLN  43  -8.427   2.811  19.852
    6    HG3  GLN  43           HG3      GLN  43  -7.678   4.405  19.784
    7   HE21  GLN  43          HE21      GLN  43  -9.862   4.517  21.275
    8   HE22  GLN  43          HE22      GLN  43 -11.211   5.113  20.439

  No H/Q in entry =           8
  In of MODEL   35
    1    H    SER  44           H        SER  44  -5.462   3.931  16.095
    2    HA   SER  44           HA       SER  44  -6.176   2.458  13.803
    3    HB2  SER  44           HB2      SER  44  -4.887   4.822  14.252
    4    HB3  SER  44           HB3      SER  44  -3.545   3.807  13.727
    5    HG   SER  44           HG       SER  44  -4.636   4.795  11.960

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ARG  45           H        ARG  45  -3.309   2.302  15.895
    2    HA   ARG  45           HA       ARG  45  -1.852   0.326  14.518
    3    HB2  ARG  45           HB2      ARG  45  -0.997   1.734  16.390
    4    HB3  ARG  45           HB3      ARG  45  -2.007   0.818  17.506
    5    HG2  ARG  45           HG2      ARG  45  -0.803  -1.259  16.868
    6    HG3  ARG  45           HG3      ARG  45   0.231  -0.318  15.794
    7    HD2  ARG  45           HD2      ARG  45   0.978   1.051  17.753
    8    HD3  ARG  45           HD3      ARG  45   0.035  -0.010  18.823
    9    HE   ARG  45           HE       ARG  45   1.717  -1.631  17.248
   10   HH21  ARG  45          HH11      ARG  45   3.602  -2.482  18.093
   11   HH22  ARG  45          HH12      ARG  45   4.381  -1.708  19.428
   12   HH11  ARG  45          HH21      ARG  45   2.047   0.830  19.641
   13   HH12  ARG  45          HH22      ARG  45   3.500   0.170  20.301

  No H/Q in entry =          13
  In of MODEL   35
    1    H    MET  46           H        MET  46  -4.265   0.041  17.108
    2    HA   MET  46           HA       MET  46  -4.140  -2.761  17.414
    3    HB2  MET  46           HB2      MET  46  -6.292  -0.730  18.000
    4    HB3  MET  46           HB3      MET  46  -6.508  -2.446  18.353
    5    HG2  MET  46           HG2      MET  46  -4.494  -2.430  19.757
    6    HG3  MET  46           HG3      MET  46  -4.223  -0.736  19.381
    7    HE3  MET  46           HE1      MET  46  -5.284  -0.411  23.057
    8    HE2  MET  46           HE2      MET  46  -4.255   0.243  21.787
    9    HE1  MET  46           HE3      MET  46  -4.132  -1.458  22.219

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ALA  47           H        ALA  47  -6.121  -0.713  15.312
    2    HA   ALA  47           HA       ALA  47  -7.765  -2.739  14.239
    3    HB3  ALA  47           HB1      ALA  47  -8.409  -0.491  13.821
    4    HB1  ALA  47           HB2      ALA  47  -7.923  -1.131  12.251
    5    HB2  ALA  47           HB3      ALA  47  -6.831  -0.080  13.153

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU  48           H        LEU  48  -4.622  -1.478  13.202
    2    HA   LEU  48           HA       LEU  48  -4.356  -3.071  10.861
    3    HB2  LEU  48           HB2      LEU  48  -2.287  -1.826  12.679
    4    HB3  LEU  48           HB3      LEU  48  -1.923  -2.552  11.113
    5    HG   LEU  48           HG       LEU  48  -3.912  -0.303  11.495
    6   HD13  LEU  48          HD11      LEU  48  -1.780   0.539  12.170
    7   HD12  LEU  48          HD12      LEU  48  -2.039   1.098  10.517
    8   HD11  LEU  48          HD13      LEU  48  -0.964  -0.266  10.830
    9   HD22  LEU  48          HD21      LEU  48  -4.391  -1.279   9.416
   10   HD21  LEU  48          HD22      LEU  48  -2.714  -1.740   9.128
   11   HD23  LEU  48          HD23      LEU  48  -3.205  -0.053   8.968

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ASN  49           H        ASN  49  -3.332  -3.487  14.211
    2    HA   ASN  49           HA       ASN  49  -1.765  -5.775  13.886
    3    HB2  ASN  49           HB2      ASN  49  -1.769  -4.449  15.935
    4    HB3  ASN  49           HB3      ASN  49  -3.443  -4.887  16.249
    5   HD21  ASN  49          HD21      ASN  49  -0.476  -5.568  17.362
    6   HD22  ASN  49          HD22      ASN  49  -0.662  -7.202  17.778

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLU  50           H        GLU  50  -5.231  -5.443  14.543
    2    HA   GLU  50           HA       GLU  50  -5.791  -8.234  14.647
    3    HB2  GLU  50           HB2      GLU  50  -7.352  -6.521  15.518
    4    HB3  GLU  50           HB3      GLU  50  -7.629  -5.951  13.870
    5    HG2  GLU  50           HG2      GLU  50  -8.528  -8.131  13.227
    6    HG3  GLU  50           HG3      GLU  50  -8.164  -8.782  14.822

  No H/Q in entry =           6
  In of MODEL   35
    1    H    ALA  51           H        ALA  51  -5.807  -5.833  12.053
    2    HA   ALA  51           HA       ALA  51  -6.813  -7.543  10.025
    3    HB1  ALA  51           HB1      ALA  51  -6.556  -5.733   8.658
    4    HB3  ALA  51           HB2      ALA  51  -4.913  -5.413   9.214
    5    HB2  ALA  51           HB3      ALA  51  -6.292  -4.879  10.177

  No H/Q in entry =           5
  In of MODEL   35
    1    H    HIS  52           H        HIS  52  -3.511  -6.693  11.024
    2    HA   HIS  52           HA       HIS  52  -2.130  -8.206   9.080
    3    HB2  HIS  52           HB2      HIS  52  -1.079  -6.488  10.535
    4    HB3  HIS  52           HB3      HIS  52  -1.260  -7.574  11.911
    5    HD1  HIS  52           HD1      HIS  52   0.162  -9.794  11.874
    6    HD2  HIS  52           HD2      HIS  52   1.046  -7.125   8.796
    7    HE1  HIS  52           HE1      HIS  52   2.354 -10.562  10.867
    8    HE2  HIS  52           HE2      HIS  52   2.906  -8.945   8.989

  No H/Q in entry =           8
  In of MODEL   35
    1    H    LEU  53           H        LEU  53  -3.371  -9.064  12.286
    2    HA   LEU  53           HA       LEU  53  -2.220 -11.629  12.484
    3    HB2  LEU  53           HB2      LEU  53  -4.691 -10.407  13.687
    4    HB3  LEU  53           HB3      LEU  53  -4.258 -12.088  13.982
    5    HG   LEU  53           HG       LEU  53  -2.338  -9.788  14.470
    6   HD13  LEU  53          HD11      LEU  53  -2.933 -10.007  16.855
    7   HD12  LEU  53          HD12      LEU  53  -4.161 -11.202  16.438
    8   HD11  LEU  53          HD13      LEU  53  -4.335  -9.536  15.900
    9   HD22  LEU  53          HD21      LEU  53  -1.058 -11.766  14.433
   10   HD21  LEU  53          HD22      LEU  53  -2.368 -12.738  15.092
   11   HD23  LEU  53          HD23      LEU  53  -1.473 -11.653  16.139

  No H/Q in entry =          11
  In of MODEL   35
    1    H    VAL  54           H        VAL  54  -5.306 -10.542  11.108
    2    HA   VAL  54           HA       VAL  54  -6.264 -13.119  10.415
    3    HB   VAL  54           HB       VAL  54  -6.856 -10.374   9.280
    4   HG12  VAL  54          HG11      VAL  54  -8.979 -11.713   8.457
    5   HG11  VAL  54          HG12      VAL  54  -7.892 -13.099   8.534
    6   HG13  VAL  54          HG13      VAL  54  -7.503 -11.730   7.494
    7   HG22  VAL  54          HG21      VAL  54  -7.773 -10.397  11.427
    8   HG21  VAL  54          HG22      VAL  54  -8.059 -12.135  11.405
    9   HG23  VAL  54          HG23      VAL  54  -9.116 -11.058  10.495

  No H/Q in entry =           9
  In of MODEL   35
    1    H    GLN  55           H        GLN  55  -4.339 -10.701   8.636
    2    HA   GLN  55           HA       GLN  55  -4.225 -12.166   6.218
    3    HB2  GLN  55           HB2      GLN  55  -3.579  -9.913   6.033
    4    HB3  GLN  55           HB3      GLN  55  -2.476 -10.011   7.403
    5    HG2  GLN  55           HG2      GLN  55  -0.769 -10.888   6.134
    6    HG3  GLN  55           HG3      GLN  55  -1.856 -11.843   5.134
    7   HE21  GLN  55          HE21      GLN  55  -1.850 -11.151   3.013
    8   HE22  GLN  55          HE22      GLN  55  -1.620  -9.550   2.505

  No H/Q in entry =           8
  In of MODEL   35
    1    H    THR  56           H        THR  56  -2.132 -12.187   9.109
    2    HA   THR  56           HA       THR  56  -0.081 -13.824   8.200
    3    HB   THR  56           HB       THR  56  -1.341 -14.048  10.942
    4    HG1  THR  56           HG1      THR  56   0.386 -12.125   9.806
    5   HG21  THR  56          HG21      THR  56   0.474 -15.676  10.201
    6   HG23  THR  56          HG22      THR  56   0.832 -14.741  11.654
    7   HG22  THR  56          HG23      THR  56   1.555 -14.285  10.111

  No H/Q in entry =           7
  In of MODEL   35
    1    H    LYS  57           H        LYS  57  -3.226 -14.802   9.548
    2    HA   LYS  57           HA       LYS  57  -2.832 -17.605   9.302
    3    HB2  LYS  57           HB2      LYS  57  -4.636 -16.478  10.639
    4    HB3  LYS  57           HB3      LYS  57  -5.413 -16.018   9.132
    5    HG2  LYS  57           HG2      LYS  57  -5.725 -18.360   8.528
    6    HG3  LYS  57           HG3      LYS  57  -4.854 -18.877   9.969
    7    HD2  LYS  57           HD2      LYS  57  -6.590 -17.821  11.389
    8    HD3  LYS  57           HD3      LYS  57  -7.474 -17.339   9.942
    9    HE2  LYS  57           HE2      LYS  57  -6.789 -20.218  10.631
   10    HE3  LYS  57           HE3      LYS  57  -8.346 -19.473  10.986
   11    HZ2  LYS  57           HZ1      LYS  57  -7.610 -20.689   8.645
   12    HZ1  LYS  57           HZ2      LYS  57  -7.566 -19.029   8.287
   13    HZ3  LYS  57           HZ3      LYS  57  -8.987 -19.730   8.899

  No H/Q in entry =          13
  In of MODEL   35
    1    H    LEU  58           H        LEU  58  -4.107 -15.137   7.122
    2    HA   LEU  58           HA       LEU  58  -4.934 -16.945   5.110
    3    HB2  LEU  58           HB2      LEU  58  -4.271 -14.008   4.980
    4    HB3  LEU  58           HB3      LEU  58  -4.946 -14.931   3.636
    5    HG   LEU  58           HG       LEU  58  -6.235 -14.729   6.378
    6   HD11  LEU  58          HD11      LEU  58  -6.492 -13.075   3.886
    7   HD13  LEU  58          HD12      LEU  58  -6.480 -12.569   5.576
    8   HD12  LEU  58          HD13      LEU  58  -7.914 -13.334   4.896
    9   HD22  LEU  58          HD21      LEU  58  -7.230 -16.619   5.503
   10   HD21  LEU  58          HD22      LEU  58  -6.874 -16.173   3.834
   11   HD23  LEU  58          HD23      LEU  58  -8.227 -15.421   4.679

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  59           H        ILE  59  -1.780 -15.795   5.987
    2    HA   ILE  59           HA       ILE  59  -0.684 -16.542   3.355
    3    HB   ILE  59           HB       ILE  59   0.116 -14.493   4.932
    4   HG12  ILE  59          HG12      ILE  59   2.177 -16.181   3.499
    5   HG13  ILE  59          HG13      ILE  59   1.004 -15.211   2.646
    6   HG22  ILE  59          HG21      ILE  59   2.157 -16.587   5.632
    7   HG21  ILE  59          HG22      ILE  59   0.808 -16.279   6.702
    8   HG23  ILE  59          HG23      ILE  59   1.956 -14.995   6.323
    9   HD12  ILE  59          HD11      ILE  59   3.170 -14.022   2.989
   10   HD11  ILE  59          HD12      ILE  59   2.899 -14.122   4.728
   11   HD13  ILE  59          HD13      ILE  59   1.804 -13.179   3.717

  No H/Q in entry =          11
  In of MODEL   35
    1    H    GLU  60           H        GLU  60  -0.732 -17.649   6.722
    2    HA   GLU  60           HA       GLU  60   1.261 -19.666   6.466
    3    HB2  GLU  60           HB2      GLU  60   0.506 -18.872   8.653
    4    HB3  GLU  60           HB3      GLU  60  -1.113 -19.492   8.341
    5    HG2  GLU  60           HG2      GLU  60  -0.211 -21.788   8.203
    6    HG3  GLU  60           HG3      GLU  60   1.411 -21.168   8.506

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLY  61           H        GLY  61  -2.248 -19.696   5.963
    2    HA3  GLY  61           HA2      GLY  61  -2.050 -22.492   5.005
    3    HA2  GLY  61           HA3      GLY  61  -3.523 -21.728   5.591

  No H/Q in entry =           3
  In of MODEL   35
    1    H    ASP  62           H        ASP  62  -1.253 -20.190   3.401
    2    HA   ASP  62           HA       ASP  62  -3.325 -19.613   1.509
    3    HB2  ASP  62           HB2      ASP  62  -1.486 -18.542   0.242
    4    HB3  ASP  62           HB3      ASP  62  -1.521 -18.031   1.926

  No H/Q in entry =           4
  In of MODEL   35
    1    H    ALA  63           H        ALA  63  -3.743 -22.121   1.294
    2    HA   ALA  63           HA       ALA  63  -1.977 -23.697  -0.297
    3    HB2  ALA  63           HB1      ALA  63  -3.792 -24.643   1.088
    4    HB1  ALA  63           HB2      ALA  63  -3.849 -25.194  -0.587
    5    HB3  ALA  63           HB3      ALA  63  -4.973 -23.954  -0.028

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLY  64           H        GLY  64  -4.647 -21.509  -1.018
    2    HA3  GLY  64           HA2      GLY  64  -5.049 -20.303  -2.965
    3    HA2  GLY  64           HA3      GLY  64  -3.733 -21.165  -3.746

  No H/Q in entry =           3
  In of MODEL   35
    1    H    GLU  65           H        GLU  65  -5.873 -20.785  -5.291
    2    HA   GLU  65           HA       GLU  65  -7.940 -22.690  -5.049
    3    HB2  GLU  65           HB2      GLU  65  -6.904 -21.189  -7.451
    4    HB3  GLU  65           HB3      GLU  65  -8.353 -22.195  -7.470
    5    HG2  GLU  65           HG2      GLU  65  -9.359 -20.833  -5.701
    6    HG3  GLU  65           HG3      GLU  65  -7.897 -19.856  -5.596

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLY  66           H        GLY  66  -4.899 -22.758  -6.751
    2    HA3  GLY  66           HA2      GLY  66  -5.319 -25.536  -7.606
    3    HA2  GLY  66           HA3      GLY  66  -4.155 -24.423  -8.296

  No H/Q in entry =           3
  In of MODEL   35
    1    H    LYS  67           H        LYS  67  -3.315 -26.877  -7.719
    2    HA   LYS  67           HA       LYS  67  -2.475 -27.782  -5.368
    3    HB2  LYS  67           HB2      LYS  67  -0.244 -28.360  -6.636
    4    HB3  LYS  67           HB3      LYS  67  -1.784 -29.064  -7.147
    5    HG2  LYS  67           HG2      LYS  67  -2.068 -27.331  -8.837
    6    HG3  LYS  67           HG3      LYS  67  -0.614 -26.506  -8.283
    7    HD2  LYS  67           HD2      LYS  67   0.743 -28.467  -8.925
    8    HD3  LYS  67           HD3      LYS  67  -0.715 -29.285  -9.491
    9    HE2  LYS  67           HE2      LYS  67  -1.105 -27.494 -11.131
   10    HE3  LYS  67           HE3      LYS  67   0.325 -26.640 -10.551
   11    HZ2  LYS  67           HZ1      LYS  67   0.236 -28.545 -12.525
   12    HZ1  LYS  67           HZ2      LYS  67   0.922 -29.344 -11.193
   13    HZ3  LYS  67           HZ3      LYS  67   1.627 -27.917 -11.786

  No H/Q in entry =          13
  In of MODEL   35
    1    H    MET  68           H        MET  68   0.337 -26.582  -6.842
    2    HA   MET  68           HA       MET  68   1.518 -25.640  -4.473
    3    HB2  MET  68           HB2      MET  68   2.210 -25.373  -7.385
    4    HB3  MET  68           HB3      MET  68   3.210 -24.649  -6.125
    5    HG2  MET  68           HG2      MET  68   2.415 -27.573  -6.190
    6    HG3  MET  68           HG3      MET  68   3.955 -26.954  -6.791
    7    HE3  MET  68           HE1      MET  68   6.045 -25.955  -4.167
    8    HE2  MET  68           HE2      MET  68   4.853 -24.660  -4.265
    9    HE1  MET  68           HE3      MET  68   5.335 -25.517  -5.727

  No H/Q in entry =           9
  In of MODEL   35
    1    H    LYS  69           H        LYS  69  -0.054 -23.847  -7.115
    2    HA   LYS  69           HA       LYS  69   0.711 -21.293  -6.619
    3    HB2  LYS  69           HB2      LYS  69  -1.957 -22.332  -7.493
    4    HB3  LYS  69           HB3      LYS  69  -1.613 -20.603  -7.387
    5    HG2  LYS  69           HG2      LYS  69   0.289 -20.838  -8.884
    6    HG3  LYS  69           HG3      LYS  69   0.080 -22.589  -8.926
    7    HD2  LYS  69           HD2      LYS  69  -0.986 -21.914 -10.898
    8    HD3  LYS  69           HD3      LYS  69  -2.334 -22.021  -9.763
    9    HE2  LYS  69           HE2      LYS  69  -1.481 -19.463  -9.319
   10    HE3  LYS  69           HE3      LYS  69  -1.131 -19.643 -11.039
   11    HZ1  LYS  69           HZ1      LYS  69  -3.729 -20.514  -9.965
   12    HZ3  LYS  69           HZ2      LYS  69  -3.328 -20.023 -11.541
   13    HZ2  LYS  69           HZ3      LYS  69  -3.462 -18.872 -10.298

  No H/Q in entry =          13
  In of MODEL   35
    1    H    VAL  70           H        VAL  70  -0.793 -19.443  -5.827
    2    HA   VAL  70           HA       VAL  70  -1.848 -20.063  -3.128
    3    HB   VAL  70           HB       VAL  70  -0.830 -17.936  -2.336
    4   HG11  VAL  70          HG11      VAL  70   0.322 -20.229  -2.222
    5   HG13  VAL  70          HG12      VAL  70   1.357 -18.813  -2.029
    6   HG12  VAL  70          HG13      VAL  70   1.314 -19.669  -3.570
    7   HG23  VAL  70          HG21      VAL  70   1.134 -17.157  -3.965
    8   HG22  VAL  70          HG22      VAL  70  -0.502 -16.533  -4.165
    9   HG21  VAL  70          HG23      VAL  70   0.074 -17.835  -5.203

  No H/Q in entry =           9
  In of MODEL   35
    1    H    SER  71           H        SER  71  -3.268 -18.353  -2.307
    2    HA   SER  71           HA       SER  71  -5.300 -17.609  -4.123
    3    HB2  SER  71           HB2      SER  71  -5.526 -17.854  -1.591
    4    HB3  SER  71           HB3      SER  71  -4.733 -16.288  -1.450
    5    HG   SER  71           HG       SER  71  -7.020 -16.737  -3.065

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU  72           H        LEU  72  -5.403 -15.990  -5.513
    2    HA   LEU  72           HA       LEU  72  -3.260 -14.217  -5.985
    3    HB2  LEU  72           HB2      LEU  72  -6.121 -14.220  -6.942
    4    HB3  LEU  72           HB3      LEU  72  -4.904 -13.081  -7.511
    5    HG   LEU  72           HG       LEU  72  -4.551 -16.093  -7.649
    6   HD12  LEU  72          HD11      LEU  72  -5.410 -14.190  -9.849
    7   HD11  LEU  72          HD12      LEU  72  -6.492 -15.304  -9.012
    8   HD13  LEU  72          HD13      LEU  72  -5.173 -15.931  -9.999
    9   HD22  LEU  72          HD21      LEU  72  -2.413 -15.152  -7.881
   10   HD21  LEU  72          HD22      LEU  72  -3.014 -13.706  -8.677
   11   HD23  LEU  72          HD23      LEU  72  -2.954 -15.232  -9.554

  No H/Q in entry =          11
  In of MODEL   35
    1    H    VAL  73           H        VAL  73  -6.353 -13.805  -4.367
    2    HA   VAL  73           HA       VAL  73  -6.349 -11.034  -4.012
    3    HB   VAL  73           HB       VAL  73  -8.098 -11.355  -2.480
    4   HG11  VAL  73          HG11      VAL  73  -8.397 -12.298  -4.847
    5   HG13  VAL  73          HG12      VAL  73  -9.537 -12.859  -3.626
    6   HG12  VAL  73          HG13      VAL  73  -8.195 -13.892  -4.118
    7   HG21  VAL  73          HG21      VAL  73  -6.804 -14.044  -1.979
    8   HG23  VAL  73          HG22      VAL  73  -8.446 -13.675  -1.449
    9   HG22  VAL  73          HG23      VAL  73  -7.086 -12.744  -0.821

  No H/Q in entry =           9
  In of MODEL   35
    1    H    LEU  74           H        LEU  74  -4.460 -13.439  -2.424
    2    HA   LEU  74           HA       LEU  74  -4.037 -12.309   0.101
    3    HB2  LEU  74           HB2      LEU  74  -3.294 -14.542  -0.403
    4    HB3  LEU  74           HB3      LEU  74  -2.219 -13.944  -1.666
    5    HG   LEU  74           HG       LEU  74  -0.896 -12.729   0.027
    6   HD13  LEU  74          HD11      LEU  74  -2.446 -12.185   1.736
    7   HD12  LEU  74          HD12      LEU  74  -1.427 -13.428   2.466
    8   HD11  LEU  74          HD13      LEU  74  -3.027 -13.846   1.852
    9   HD23  LEU  74          HD21      LEU  74  -1.180 -15.466   1.148
   10   HD22  LEU  74          HD22      LEU  74   0.248 -14.587   0.648
   11   HD21  LEU  74          HD23      LEU  74  -0.782 -15.317  -0.562

  No H/Q in entry =          11
  In of MODEL   35
    1    H    VAL  75           H        VAL  75  -2.129 -11.946  -2.849
    2    HA   VAL  75           HA       VAL  75  -0.300 -10.056  -1.829
    3    HB   VAL  75           HB       VAL  75  -1.254 -10.524  -4.656
    4   HG11  VAL  75          HG11      VAL  75   1.040  -8.831  -3.571
    5   HG13  VAL  75          HG12      VAL  75  -0.363  -8.248  -4.452
    6   HG12  VAL  75          HG13      VAL  75   0.826  -9.253  -5.266
    7   HG23  VAL  75          HG21      VAL  75   1.048 -11.591  -4.778
    8   HG22  VAL  75          HG22      VAL  75  -0.098 -12.440  -3.740
    9   HG21  VAL  75          HG23      VAL  75   1.148 -11.414  -3.025

  No H/Q in entry =           9
  In of MODEL   35
    1    H    GLU  76           H        GLU  76  -3.438  -9.650  -3.498
    2    HA   GLU  76           HA       GLU  76  -3.438  -6.835  -3.595
    3    HB2  GLU  76           HB2      GLU  76  -5.119  -8.238  -4.767
    4    HB3  GLU  76           HB3      GLU  76  -5.785  -8.733  -3.219
    5    HG2  GLU  76           HG2      GLU  76  -7.206  -6.991  -4.094
    6    HG3  GLU  76           HG3      GLU  76  -6.320  -6.301  -2.748

  No H/Q in entry =           6
  In of MODEL   35
    1    H    ALA  77           H        ALA  77  -4.598  -9.045  -1.063
    2    HA   ALA  77           HA       ALA  77  -5.524  -7.029   0.696
    3    HB1  ALA  77           HB1      ALA  77  -4.463  -9.780   1.384
    4    HB2  ALA  77           HB2      ALA  77  -6.125  -9.415   0.926
    5    HB3  ALA  77           HB3      ALA  77  -5.460  -8.762   2.421

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLN  78           H        GLN  78  -2.405  -8.635   0.340
    2    HA   GLN  78           HA       GLN  78  -1.134  -7.501   2.596
    3    HB2  GLN  78           HB2      GLN  78  -0.302  -9.456   1.245
    4    HB3  GLN  78           HB3      GLN  78   0.155  -8.320  -0.022
    5    HG2  GLN  78           HG2      GLN  78   1.632  -7.147   1.561
    6    HG3  GLN  78           HG3      GLN  78   1.181  -8.282   2.830
    7   HE21  GLN  78          HE21      GLN  78   3.905  -8.068   2.024
    8   HE22  GLN  78          HE22      GLN  78   4.345  -9.498   1.221

  No H/Q in entry =           8
  In of MODEL   35
    1    H    LEU  79           H        LEU  79  -1.468  -6.429  -0.751
    2    HA   LEU  79           HA       LEU  79   0.260  -4.235  -0.728
    3    HB2  LEU  79           HB2      LEU  79  -0.775  -5.019  -2.787
    4    HB3  LEU  79           HB3      LEU  79  -2.373  -4.598  -2.183
    5    HG   LEU  79           HG       LEU  79  -1.784  -2.221  -2.152
    6   HD13  LEU  79          HD11      LEU  79   0.459  -2.021  -1.632
    7   HD12  LEU  79          HD12      LEU  79   0.520  -1.733  -3.370
    8   HD11  LEU  79          HD13      LEU  79   0.941  -3.320  -2.724
    9   HD23  LEU  79          HD21      LEU  79  -1.137  -2.031  -4.702
   10   HD22  LEU  79          HD22      LEU  79  -2.679  -2.751  -4.249
   11   HD21  LEU  79          HD23      LEU  79  -1.324  -3.785  -4.691

  No H/Q in entry =          11
  In of MODEL   35
    1    H    HIS  80           H        HIS  80  -3.212  -4.331   0.086
    2    HA   HIS  80           HA       HIS  80  -3.353  -1.573   0.752
    3    HB2  HIS  80           HB2      HIS  80  -5.102  -3.948   1.062
    4    HB3  HIS  80           HB3      HIS  80  -5.400  -2.604   2.167
    5    HD1  HIS  80           HD1      HIS  80  -6.982  -0.934   1.256
    6    HD2  HIS  80           HD2      HIS  80  -4.814  -2.785  -1.787
    7    HE1  HIS  80           HE1      HIS  80  -7.795   0.081  -0.925
    8    HE2  HIS  80           HE2      HIS  80  -6.480  -1.041  -2.789

  No H/Q in entry =           8
  In of MODEL   35
    1    H    LEU  81           H        LEU  81  -2.928  -4.479   2.743
    2    HA   LEU  81           HA       LEU  81  -2.898  -3.135   5.229
    3    HB2  LEU  81           HB2      LEU  81  -1.728  -5.774   4.350
    4    HB3  LEU  81           HB3      LEU  81  -1.697  -5.218   6.025
    5    HG   LEU  81           HG       LEU  81  -4.241  -5.418   4.388
    6   HD12  LEU  81          HD11      LEU  81  -4.590  -7.479   5.931
    7   HD11  LEU  81          HD12      LEU  81  -2.837  -7.444   6.124
    8   HD13  LEU  81          HD13      LEU  81  -3.545  -7.658   4.522
    9   HD23  LEU  81          HD21      LEU  81  -5.097  -5.608   6.886
   10   HD22  LEU  81          HD22      LEU  81  -4.738  -4.025   6.199
   11   HD21  LEU  81          HD23      LEU  81  -3.570  -4.810   7.262

  No H/Q in entry =          11
  In of MODEL   35
    1    H    MET  82           H        MET  82  -0.227  -4.089   3.067
    2    HA   MET  82           HA       MET  82   1.867  -3.239   4.759
    3    HB2  MET  82           HB2      MET  82   1.656  -3.573   1.765
    4    HB3  MET  82           HB3      MET  82   3.146  -3.033   2.535
    5    HG2  MET  82           HG2      MET  82   1.685  -5.594   3.251
    6    HG3  MET  82           HG3      MET  82   3.062  -5.511   2.155
    7    HE3  MET  82           HE1      MET  82   6.085  -4.839   4.150
    8    HE2  MET  82           HE2      MET  82   5.192  -3.452   3.531
    9    HE1  MET  82           HE3      MET  82   5.254  -4.942   2.594

  No H/Q in entry =           9
  In of MODEL   35
    1    H    THR  83           H        THR  83   0.088  -1.558   2.198
    2    HA   THR  83           HA       THR  83   1.549   0.861   2.292
    3    HB   THR  83           HB       THR  83  -0.605   1.832   1.300
    4    HG1  THR  83           HG1      THR  83  -2.281   0.569   1.186
    5   HG22  THR  83          HG21      THR  83  -0.365   0.011  -0.702
    6   HG21  THR  83          HG22      THR  83   1.127  -0.313   0.180
    7   HG23  THR  83          HG23      THR  83   0.801   1.308  -0.435

  No H/Q in entry =           7
  In of MODEL   35
    1    H    SER  84           H        SER  84  -1.483  -0.111   3.882
    2    HA   SER  84           HA       SER  84  -1.934   2.327   5.228
    3    HB2  SER  84           HB2      SER  84  -2.827  -0.494   5.786
    4    HB3  SER  84           HB3      SER  84  -3.296   0.856   6.819
    5    HG   SER  84           HG       SER  84  -3.751   0.554   4.025

  No H/Q in entry =           5
  In of MODEL   35
    1    H    MET  85           H        MET  85  -0.288  -0.641   6.360
    2    HA   MET  85           HA       MET  85   0.241   0.271   8.967
    3    HB2  MET  85           HB2      MET  85   0.487  -2.077   8.284
    4    HB3  MET  85           HB3      MET  85   1.885  -1.640   7.300
    5    HG2  MET  85           HG2      MET  85   3.075  -0.850   9.298
    6    HG3  MET  85           HG3      MET  85   1.667  -1.213  10.295
    7    HE2  MET  85           HE1      MET  85   4.664  -3.971   8.317
    8    HE1  MET  85           HE2      MET  85   4.233  -2.310   7.913
    9    HE3  MET  85           HE3      MET  85   3.264  -3.642   7.291

  No H/Q in entry =           9
  In of MODEL   35
    1    H    LEU  86           H        LEU  86   2.191   0.490   6.022
    2    HA   LEU  86           HA       LEU  86   4.428   1.753   7.187
    3    HB2  LEU  86           HB2      LEU  86   4.222   0.677   4.876
    4    HB3  LEU  86           HB3      LEU  86   3.447   2.176   4.363
    5    HG   LEU  86           HG       LEU  86   5.497   3.378   5.351
    6   HD11  LEU  86          HD11      LEU  86   6.145   0.752   6.150
    7   HD13  LEU  86          HD12      LEU  86   7.178   2.175   6.253
    8   HD12  LEU  86          HD13      LEU  86   7.270   1.126   4.840
    9   HD23  LEU  86          HD21      LEU  86   6.185   1.603   3.001
   10   HD22  LEU  86          HD22      LEU  86   6.613   3.291   3.266
   11   HD21  LEU  86          HD23      LEU  86   4.952   2.858   2.862

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ALA  87           H        ALA  87   1.548   3.059   5.594
    2    HA   ALA  87           HA       ALA  87   2.199   5.776   5.683
    3    HB1  ALA  87           HB1      ALA  87  -0.142   4.197   5.132
    4    HB3  ALA  87           HB2      ALA  87   0.205   5.852   4.635
    5    HB2  ALA  87           HB3      ALA  87  -0.600   5.546   6.175

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ARG  88           H        ARG  88   0.460   3.808   8.065
    2    HA   ARG  88           HA       ARG  88  -0.015   5.866   9.912
    3    HB2  ARG  88           HB2      ARG  88  -1.003   3.533   9.973
    4    HB3  ARG  88           HB3      ARG  88   0.525   3.000  10.684
    5    HG2  ARG  88           HG2      ARG  88   0.086   5.083  12.304
    6    HG3  ARG  88           HG3      ARG  88  -1.585   4.793  11.842
    7    HD2  ARG  88           HD2      ARG  88  -1.735   2.946  13.087
    8    HD3  ARG  88           HD3      ARG  88  -0.157   2.331  12.560
    9    HE   ARG  88           HE       ARG  88  -0.672   3.603  15.014
   10   HH21  ARG  88          HH11      ARG  88   0.903   4.581  16.258
   11   HH22  ARG  88          HH12      ARG  88   2.433   4.976  15.559
   12   HH11  ARG  88          HH21      ARG  88   1.620   3.739  12.444
   13   HH12  ARG  88          HH22      ARG  88   2.847   4.483  13.412

  No H/Q in entry =          13
  In of MODEL   35
    1    H    GLU  89           H        GLU  89   2.735   3.589   9.696
    2    HA   GLU  89           HA       GLU  89   4.007   4.449  12.045
    3    HB2  GLU  89           HB2      GLU  89   4.628   2.419  10.702
    4    HB3  GLU  89           HB3      GLU  89   5.430   3.498   9.559
    5    HG2  GLU  89           HG2      GLU  89   6.927   4.312  11.308
    6    HG3  GLU  89           HG3      GLU  89   6.068   3.372  12.525

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LEU  90           H        LEU  90   4.359   5.603   8.719
    2    HA   LEU  90           HA       LEU  90   6.328   7.563   9.313
    3    HB2  LEU  90           HB2      LEU  90   4.323   7.275   7.079
    4    HB3  LEU  90           HB3      LEU  90   5.579   8.520   7.105
    5    HG   LEU  90           HG       LEU  90   6.192   5.570   7.439
    6   HD12  LEU  90          HD11      LEU  90   6.953   5.790   5.002
    7   HD11  LEU  90          HD12      LEU  90   5.967   7.251   4.951
    8   HD13  LEU  90          HD13      LEU  90   5.215   5.693   5.290
    9   HD22  LEU  90          HD21      LEU  90   8.110   6.680   8.128
   10   HD21  LEU  90          HD22      LEU  90   7.792   8.093   7.121
   11   HD23  LEU  90          HD23      LEU  90   8.424   6.615   6.395

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  91           H        ILE  91   2.791   7.650   9.152
    2    HA   ILE  91           HA       ILE  91   2.503  10.429   9.604
    3    HB   ILE  91           HB       ILE  91   0.662   8.089  10.139
    4   HG12  ILE  91          HG12      ILE  91   0.467  10.377   8.155
    5   HG13  ILE  91          HG13      ILE  91   1.298   8.866   7.785
    6   HG22  ILE  91          HG21      ILE  91  -1.029  10.182  10.198
    7   HG21  ILE  91          HG22      ILE  91   0.387  10.983  10.876
    8   HG23  ILE  91          HG23      ILE  91  -0.281   9.558  11.669
    9   HD13  ILE  91          HD11      ILE  91  -0.672   7.617   7.821
   10   HD12  ILE  91          HD12      ILE  91  -1.228   9.144   7.139
   11   HD11  ILE  91          HD13      ILE  91  -1.513   8.784   8.842

  No H/Q in entry =          11
  In of MODEL   35
    1    H    THR  92           H        THR  92   2.844   7.678  11.805
    2    HA   THR  92           HA       THR  92   2.419   9.059  14.228
    3    HB   THR  92           HB       THR  92   4.184   6.689  13.568
    4    HG1  THR  92           HG1      THR  92   2.201   5.971  13.460
    5   HG22  THR  92          HG21      THR  92   3.786   6.411  16.200
    6   HG21  THR  92          HG22      THR  92   3.756   8.171  16.128
    7   HG23  THR  92          HG23      THR  92   5.174   7.288  15.559

  No H/Q in entry =           7
  In of MODEL   35
    1    H    GLU  93           H        GLU  93   5.368   8.554  12.305
    2    HA   GLU  93           HA       GLU  93   7.142   9.946  14.009
    3    HB2  GLU  93           HB2      GLU  93   7.236   9.631  10.994
    4    HB3  GLU  93           HB3      GLU  93   8.582  10.135  12.013
    5    HG2  GLU  93           HG2      GLU  93   7.121   7.526  12.454
    6    HG3  GLU  93           HG3      GLU  93   8.511   7.652  11.383

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LEU  94           H        LEU  94   5.124  11.001  11.289
    2    HA   LEU  94           HA       LEU  94   5.980  13.689  11.194
    3    HB2  LEU  94           HB2      LEU  94   3.367  12.374  10.429
    4    HB3  LEU  94           HB3      LEU  94   3.659  14.096  10.190
    5    HG   LEU  94           HG       LEU  94   5.642  12.071   9.146
    6   HD11  LEU  94          HD11      LEU  94   2.915  12.674   8.074
    7   HD13  LEU  94          HD12      LEU  94   3.871  11.199   7.951
    8   HD12  LEU  94          HD13      LEU  94   4.236  12.573   6.909
    9   HD23  LEU  94          HD21      LEU  94   5.933  13.903   7.425
   10   HD22  LEU  94          HD22      LEU  94   6.351  14.387   9.069
   11   HD21  LEU  94          HD23      LEU  94   4.811  14.885   8.365

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  95           H        ILE  95   3.405  12.119  13.074
    2    HA   ILE  95           HA       ILE  95   2.402  14.487  14.267
    3    HB   ILE  95           HB       ILE  95   2.362  11.605  15.190
    4   HG12  ILE  95          HG12      ILE  95   0.179  13.420  14.133
    5   HG13  ILE  95          HG13      ILE  95   1.119  12.343  13.104
    6   HG21  ILE  95          HG21      ILE  95   1.121  14.100  16.388
    7   HG23  ILE  95          HG22      ILE  95   2.145  12.912  17.196
    8   HG22  ILE  95          HG23      ILE  95   0.503  12.481  16.715
    9   HD13  ILE  95          HD11      ILE  95   0.178  10.421  14.019
   10   HD12  ILE  95          HD12      ILE  95  -1.185  11.536  14.091
   11   HD11  ILE  95          HD13      ILE  95  -0.231  11.219  15.539

  No H/Q in entry =          11
  In of MODEL   35
    1    H    GLU  96           H        GLU  96   4.952  12.221  15.271
    2    HA   GLU  96           HA       GLU  96   5.519  13.408  17.766
    3    HB2  GLU  96           HB2      GLU  96   6.431  11.233  17.121
    4    HB3  GLU  96           HB3      GLU  96   7.383  11.990  15.845
    5    HG2  GLU  96           HG2      GLU  96   9.035  12.508  17.314
    6    HG3  GLU  96           HG3      GLU  96   7.899  13.341  18.365

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LEU  97           H        LEU  97   6.620  14.162  14.484
    2    HA   LEU  97           HA       LEU  97   8.539  16.125  15.204
    3    HB2  LEU  97           HB2      LEU  97   6.947  15.605  12.703
    4    HB3  LEU  97           HB3      LEU  97   7.991  17.018  12.829
    5    HG   LEU  97           HG       LEU  97   8.969  14.203  13.392
    6   HD12  LEU  97          HD11      LEU  97   9.978  14.380  11.078
    7   HD11  LEU  97          HD12      LEU  97   8.952  15.789  10.812
    8   HD13  LEU  97          HD13      LEU  97   8.224  14.209  11.103
    9   HD23  LEU  97          HD21      LEU  97  11.163  15.444  12.658
   10   HD22  LEU  97          HD22      LEU  97  10.542  15.723  14.285
   11   HD21  LEU  97          HD23      LEU  97  10.254  16.912  13.016

  No H/Q in entry =          11
  In of MODEL   35
    1    H    HIS  98           H        HIS  98   5.052  16.321  14.536
    2    HA   HIS  98           HA       HIS  98   4.801  19.125  14.672
    3    HB2  HIS  98           HB2      HIS  98   2.870  16.908  15.389
    4    HB3  HIS  98           HB3      HIS  98   2.432  18.616  15.444
    5    HD1  HIS  98           HD1      HIS  98   3.416  15.885  13.042
    6    HD2  HIS  98           HD2      HIS  98   2.108  19.841  12.916
    7    HE1  HIS  98           HE1      HIS  98   2.874  16.384  10.616
    8    HE2  HIS  98           HE2      HIS  98   2.082  18.787  10.518

  No H/Q in entry =           8
  In of MODEL   35
    1    H    GLU  99           H        GLU  99   4.882  16.634  17.170
    2    HA   GLU  99           HA       GLU  99   4.294  18.338  19.366
    3    HB2  GLU  99           HB2      GLU  99   4.162  15.858  19.462
    4    HB3  GLU  99           HB3      GLU  99   5.922  15.782  19.361
    5    HG2  GLU  99           HG2      GLU  99   6.124  17.070  21.436
    6    HG3  GLU  99           HG3      GLU  99   4.374  17.241  21.525

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LYS 100           H        LYS 100   7.338  17.355  17.813
    2    HA   LYS 100           HA       LYS 100   9.009  18.727  19.677
    3    HB2  LYS 100           HB2      LYS 100   9.503  17.795  16.840
    4    HB3  LYS 100           HB3      LYS 100  10.742  18.543  17.853
    5    HG2  LYS 100           HG2      LYS 100  10.329  16.798  19.592
    6    HG3  LYS 100           HG3      LYS 100   9.188  16.015  18.496
    7    HD2  LYS 100           HD2      LYS 100  10.983  15.702  16.835
    8    HD3  LYS 100           HD3      LYS 100  12.130  16.497  17.916
    9    HE2  LYS 100           HE2      LYS 100  11.696  14.748  19.632
   10    HE3  LYS 100           HE3      LYS 100  10.612  13.932  18.502
   11    HZ1  LYS 100           HZ1      LYS 100  13.446  14.553  17.858
   12    HZ3  LYS 100           HZ2      LYS 100  12.387  13.516  17.025
   13    HZ2  LYS 100           HZ3      LYS 100  12.962  13.086  18.566

  No H/Q in entry =          13
  In of MODEL   35
    1    H    LEU 101           H        LEU 101   7.343  19.684  16.715
    2    HA   LEU 101           HA       LEU 101   8.603  22.220  16.386
    3    HB2  LEU 101           HB2      LEU 101   5.990  21.032  15.489
    4    HB3  LEU 101           HB3      LEU 101   6.272  22.758  15.284
    5    HG   LEU 101           HG       LEU 101   8.276  20.707  14.325
    6   HD12  LEU 101          HD11      LEU 101   7.141  21.234  12.035
    7   HD11  LEU 101          HD12      LEU 101   5.745  21.688  13.011
    8   HD13  LEU 101          HD13      LEU 101   6.381  20.046  13.094
    9   HD21  LEU 101          HD21      LEU 101   7.701  23.630  13.768
   10   HD23  LEU 101          HD22      LEU 101   8.669  22.654  12.665
   11   HD22  LEU 101          HD23      LEU 101   9.209  22.901  14.325

  No H/Q in entry =          11
  In of MODEL   35
    1    H    LYS 102           H        LYS 102   7.036  21.107  18.995
    2    HA   LYS 102           HA       LYS 102   6.415  22.209  20.926
    3    HB2  LYS 102           HB2      LYS 102   7.737  24.177  19.808
    4    HB3  LYS 102           HB3      LYS 102   6.150  24.809  19.426
    5    HG2  LYS 102           HG2      LYS 102   7.512  24.528  22.083
    6    HG3  LYS 102           HG3      LYS 102   6.585  25.874  21.452
    7    HD2  LYS 102           HD2      LYS 102   5.292  23.259  22.324
    8    HD3  LYS 102           HD3      LYS 102   5.560  24.615  23.409
    9    HE2  LYS 102           HE2      LYS 102   3.280  24.253  21.911
   10    HE3  LYS 102           HE3      LYS 102   3.808  25.789  22.596
   11    HZ2  LYS 102           HZ1      LYS 102   3.288  25.908  20.215
   12    HZ1  LYS 102           HZ2      LYS 102   4.532  24.804  19.896
   13    HZ3  LYS 102           HZ3      LYS 102   4.899  26.328  20.541

  No H/Q in entry =          13
  In of MODEL   35
    1    H    ALA 103           H        ALA 103   4.815  23.782  18.153
    2    HA   ALA 103           HA       ALA 103   2.368  24.401  19.029
    3    HB1  ALA 103           HB1      ALA 103   1.464  23.576  16.783
    4    HB2  ALA 103           HB2      ALA 103   3.103  23.011  16.459
    5    HB3  ALA 103           HB3      ALA 103   2.797  24.728  16.725

  No H/Q in entry =           5
  In of MODEL   35
    1    H1   ALA   1           H3       ALA   1  10.276 -20.229  -6.243
    2    H2   ALA   1           H2       ALA   1   9.313 -20.416  -7.632
    3    H3   ALA   1           H1       ALA   1   8.857 -21.156  -6.171
    4    HA   ALA   1           HA       ALA   1   9.866 -22.983  -6.908
    5    HB1  ALA   1           HB1      ALA   1   9.976 -22.624  -9.183
    6    HB2  ALA   1           HB2      ALA   1  11.705 -22.505  -8.848
    7    HB3  ALA   1           HB3      ALA   1  10.734 -21.040  -9.001

  No H/Q in entry =           7
  In of MODEL   35
    1    H    GLU   2           H        GLU   2  12.132 -23.975  -6.959
    2    HA   GLU   2           HA       GLU   2  13.507 -23.920  -4.742
    3    HB2  GLU   2           HB2      GLU   2  14.875 -23.811  -7.436
    4    HB3  GLU   2           HB3      GLU   2  15.586 -24.437  -5.949
    5    HG2  GLU   2           HG2      GLU   2  14.534 -26.435  -6.195
    6    HG3  GLU   2           HG3      GLU   2  12.977 -25.660  -6.459

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLU   3           H        GLU   3  15.321 -22.087  -7.136
    2    HA   GLU   3           HA       GLU   3  16.498 -20.423  -5.171
    3    HB2  GLU   3           HB2      GLU   3  16.453 -20.417  -8.181
    4    HB3  GLU   3           HB3      GLU   3  17.220 -19.103  -7.290
    5    HG2  GLU   3           HG2      GLU   3  18.853 -20.508  -6.363
    6    HG3  GLU   3           HG3      GLU   3  17.881 -21.957  -6.588

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LEU   4           H        LEU   4  14.241 -19.531  -7.809
    2    HA   LEU   4           HA       LEU   4  13.821 -16.914  -7.197
    3    HB2  LEU   4           HB2      LEU   4  11.612 -18.847  -7.936
    4    HB3  LEU   4           HB3      LEU   4  11.571 -17.097  -8.134
    5    HG   LEU   4           HG       LEU   4  13.505 -18.996  -9.501
    6   HD13  LEU   4          HD11      LEU   4  12.213 -18.821 -11.416
    7   HD12  LEU   4          HD12      LEU   4  11.532 -17.264 -10.950
    8   HD11  LEU   4          HD13      LEU   4  10.948 -18.744 -10.192
    9   HD23  LEU   4          HD21      LEU   4  13.888 -16.756 -10.850
   10   HD22  LEU   4          HD22      LEU   4  14.738 -17.016  -9.328
   11   HD21  LEU   4          HD23      LEU   4  13.304 -15.992  -9.371

  No H/Q in entry =          11
  In of MODEL   35
    1    H    GLU   5           H        GLU   5  12.279 -19.671  -5.562
    2    HA   GLU   5           HA       GLU   5  10.625 -18.070  -3.864
    3    HB2  GLU   5           HB2      GLU   5  10.152 -20.436  -4.385
    4    HB3  GLU   5           HB3      GLU   5  11.580 -20.904  -3.459
    5    HG2  GLU   5           HG2      GLU   5  10.637 -19.858  -1.447
    6    HG3  GLU   5           HG3      GLU   5   9.219 -19.356  -2.364

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLU   6           H        GLU   6  13.740 -19.708  -3.412
    2    HA   GLU   6           HA       GLU   6  14.100 -18.860  -0.711
    3    HB2  GLU   6           HB2      GLU   6  15.295 -20.796  -1.684
    4    HB3  GLU   6           HB3      GLU   6  16.171 -19.701  -2.757
    5    HG2  GLU   6           HG2      GLU   6  17.138 -18.545  -0.823
    6    HG3  GLU   6           HG3      GLU   6  16.231 -19.586   0.273

  No H/Q in entry =           6
  In of MODEL   35
    1    H    VAL   7           H        VAL   7  14.900 -17.546  -3.857
    2    HA   VAL   7           HA       VAL   7  16.622 -15.451  -2.985
    3    HB   VAL   7           HB       VAL   7  14.918 -15.781  -5.469
    4   HG11  VAL   7          HG11      VAL   7  16.849 -13.604  -4.648
    5   HG13  VAL   7          HG12      VAL   7  15.211 -13.431  -5.277
    6   HG12  VAL   7          HG13      VAL   7  16.515 -13.956  -6.343
    7   HG21  VAL   7          HG21      VAL   7  16.996 -17.276  -4.894
    8   HG23  VAL   7          HG22      VAL   7  17.929 -15.832  -5.288
    9   HG22  VAL   7          HG23      VAL   7  16.883 -16.562  -6.503

  No H/Q in entry =           9
  In of MODEL   35
    1    H    VAL   8           H        VAL   8  13.127 -15.657  -3.554
    2    HA   VAL   8           HA       VAL   8  12.509 -12.937  -3.083
    3    HB   VAL   8           HB       VAL   8  10.899 -15.477  -2.781
    4   HG11  VAL   8          HG11      VAL   8  10.127 -12.608  -2.210
    5   HG13  VAL   8          HG12      VAL   8   9.903 -14.023  -1.180
    6   HG12  VAL   8          HG13      VAL   8   8.929 -13.829  -2.636
    7   HG23  VAL   8          HG21      VAL   8   9.796 -13.661  -4.676
    8   HG22  VAL   8          HG22      VAL   8  10.644 -15.168  -5.015
    9   HG21  VAL   8          HG23      VAL   8  11.537 -13.651  -4.955

  No H/Q in entry =           9
  In of MODEL   35
    1    H    MET   9           H        MET   9  12.718 -15.749  -0.904
    2    HA   MET   9           HA       MET   9  11.917 -14.465   1.464
    3    HB2  MET   9           HB2      MET   9  13.784 -16.774   0.928
    4    HB3  MET   9           HB3      MET   9  13.491 -16.188   2.565
    5    HG2  MET   9           HG2      MET   9  11.056 -16.520   2.238
    6    HG3  MET   9           HG3      MET   9  11.373 -17.148   0.620
    7    HE3  MET   9           HE1      MET   9  12.547 -18.903   4.657
    8    HE2  MET   9           HE2      MET   9  10.913 -18.310   4.375
    9    HE1  MET   9           HE3      MET   9  12.282 -17.216   4.199

  No H/Q in entry =           9
  In of MODEL   35
    1    H    GLY  10           H        GLY  10  15.099 -14.744  -0.081
    2    HA3  GLY  10           HA2      GLY  10  16.576 -13.350   1.895
    3    HA2  GLY  10           HA3      GLY  10  17.042 -13.522   0.203

  No H/Q in entry =           3
  In of MODEL   35
    1    H    LEU  11           H        LEU  11  14.899 -12.263  -1.043
    2    HA   LEU  11           HA       LEU  11  15.630  -9.530  -0.875
    3    HB2  LEU  11           HB2      LEU  11  13.243 -10.898  -2.120
    4    HB3  LEU  11           HB3      LEU  11  13.554  -9.169  -2.277
    5    HG   LEU  11           HG       LEU  11  15.548 -11.311  -3.060
    6   HD13  LEU  11          HD11      LEU  11  13.801 -11.647  -4.586
    7   HD12  LEU  11          HD12      LEU  11  14.827 -10.482  -5.422
    8   HD11  LEU  11          HD13      LEU  11  13.360  -9.940  -4.608
    9   HD22  LEU  11          HD21      LEU  11  16.812  -9.369  -2.828
   10   HD21  LEU  11          HD22      LEU  11  15.456  -8.309  -3.211
   11   HD23  LEU  11          HD23      LEU  11  16.277  -9.190  -4.497

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  12           H        ILE  12  12.827 -11.310   0.381
    2    HA   ILE  12           HA       ILE  12  11.467  -9.064   1.437
    3    HB   ILE  12           HB       ILE  12  11.453 -11.947   2.387
    4   HG12  ILE  12          HG12      ILE  12  10.789 -11.307  -0.065
    5   HG13  ILE  12          HG13      ILE  12   9.738 -12.375   0.843
    6   HG22  ILE  12          HG21      ILE  12   9.182 -11.329   3.296
    7   HG21  ILE  12          HG22      ILE  12   9.550  -9.643   2.936
    8   HG23  ILE  12          HG23      ILE  12  10.522 -10.526   4.113
    9   HD11  ILE  12          HD11      ILE  12   9.367  -9.378   0.616
   10   HD13  ILE  12          HD12      ILE  12   8.246 -10.530   1.339
   11   HD12  ILE  12          HD13      ILE  12   8.538 -10.555  -0.387

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  13           H        ILE  13  13.819 -11.309   2.850
    2    HA   ILE  13           HA       ILE  13  13.864 -10.132   5.431
    3    HB   ILE  13           HB       ILE  13  15.903 -11.737   3.871
    4   HG12  ILE  13          HG12      ILE  13  13.607 -12.664   4.708
    5   HG13  ILE  13          HG13      ILE  13  15.067 -13.614   4.975
    6   HG22  ILE  13          HG21      ILE  13  16.902 -12.111   6.235
    7   HG21  ILE  13          HG22      ILE  13  16.046 -10.643   6.688
    8   HG23  ILE  13          HG23      ILE  13  17.275 -10.592   5.424
    9   HD13  ILE  13          HD11      ILE  13  15.205 -12.854   7.290
   10   HD12  ILE  13          HD12      ILE  13  13.575 -13.449   6.992
   11   HD11  ILE  13          HD13      ILE  13  13.884 -11.717   7.025

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ASN  14           H        ASN  14  15.836  -9.630   2.520
    2    HA   ASN  14           HA       ASN  14  17.606  -7.716   3.590
    3    HB2  ASN  14           HB2      ASN  14  17.573  -8.980   1.273
    4    HB3  ASN  14           HB3      ASN  14  16.704  -7.549   0.734
    5   HD21  ASN  14          HD21      ASN  14  19.143  -7.925  -0.443
    6   HD22  ASN  14          HD22      ASN  14  20.300  -6.859   0.189

  No H/Q in entry =           6
  In of MODEL   35
    1    H    SER  15           H        SER  15  14.507  -7.321   1.886
    2    HA   SER  15           HA       SER  15  14.437  -4.499   1.944
    3    HB2  SER  15           HB2      SER  15  12.102  -4.711   1.442
    4    HB3  SER  15           HB3      SER  15  12.882  -6.085   0.670
    5    HG   SER  15           HG       SER  15  11.546  -6.045   3.173

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLY  16           H        GLY  16  13.299  -6.944   4.242
    2    HA3  GLY  16           HA2      GLY  16  12.096  -5.179   6.096
    3    HA2  GLY  16           HA3      GLY  16  12.686  -6.796   6.459

  No H/Q in entry =           3
  In of MODEL   35
    1    H    GLN  17           H        GLN  17  15.404  -6.502   5.877
    2    HA   GLN  17           HA       GLN  17  16.369  -5.297   8.262
    3    HB2  GLN  17           HB2      GLN  17  17.569  -7.108   7.056
    4    HB3  GLN  17           HB3      GLN  17  17.917  -5.981   5.744
    5    HG2  GLN  17           HG2      GLN  17  19.844  -6.088   7.229
    6    HG3  GLN  17           HG3      GLN  17  19.090  -4.503   7.378
    7   HE21  GLN  17          HE21      GLN  17  19.587  -4.045   9.577
    8   HE22  GLN  17          HE22      GLN  17  19.062  -5.011  10.869

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ALA  18           H        ALA  18  16.209  -4.214   4.902
    2    HA   ALA  18           HA       ALA  18  17.677  -1.842   5.137
    3    HB1  ALA  18           HB1      ALA  18  16.550  -3.040   3.064
    4    HB3  ALA  18           HB2      ALA  18  16.840  -1.300   3.051
    5    HB2  ALA  18           HB3      ALA  18  15.230  -1.923   3.414

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ARG  19           H        ARG  19  14.168  -2.381   5.519
    2    HA   ARG  19           HA       ARG  19  13.534   0.278   6.234
    3    HB2  ARG  19           HB2      ARG  19  11.831  -1.450   5.639
    4    HB3  ARG  19           HB3      ARG  19  12.156  -2.254   7.177
    5    HG2  ARG  19           HG2      ARG  19  11.468  -0.253   8.415
    6    HG3  ARG  19           HG3      ARG  19  11.236   0.627   6.906
    7    HD2  ARG  19           HD2      ARG  19   9.081  -0.140   7.717
    8    HD3  ARG  19           HD3      ARG  19   9.493  -1.024   6.242
    9    HE   ARG  19           HE       ARG  19  10.422  -2.581   8.350
   10   HH21  ARG  19          HH11      ARG  19   9.146  -4.204   9.282
   11   HH22  ARG  19          HH12      ARG  19   7.428  -4.152   9.105
   12   HH11  ARG  19          HH21      ARG  19   7.450  -1.246   7.244
   13   HH12  ARG  19          HH22      ARG  19   6.468  -2.478   7.946

  No H/Q in entry =          13
  In of MODEL   35
    1    H    SER  20           H        SER  20  14.345  -2.566   8.194
    2    HA   SER  20           HA       SER  20  14.067  -1.464  10.731
    3    HB2  SER  20           HB2      SER  20  14.501  -3.795  10.611
    4    HB3  SER  20           HB3      SER  20  15.959  -3.552   9.652
    5    HG   SER  20           HG       SER  20  15.536  -2.781  12.356

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU  21           H        LEU  21  16.919  -1.441   8.607
    2    HA   LEU  21           HA       LEU  21  18.607   0.021  10.353
    3    HB2  LEU  21           HB2      LEU  21  18.594  -0.246   7.338
    4    HB3  LEU  21           HB3      LEU  21  19.858   0.591   8.235
    5    HG   LEU  21           HG       LEU  21  19.070  -2.287   8.767
    6   HD13  LEU  21          HD11      LEU  21  21.000  -2.944   7.443
    7   HD12  LEU  21          HD12      LEU  21  21.422  -1.257   7.152
    8   HD11  LEU  21          HD13      LEU  21  19.954  -1.931   6.447
    9   HD21  LEU  21          HD21      LEU  21  21.210  -0.422   9.771
   10   HD23  LEU  21          HD22      LEU  21  21.577  -2.139   9.668
   11   HD22  LEU  21          HD23      LEU  21  20.252  -1.588  10.679

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ALA  22           H        ALA  22  16.367   1.023   7.788
    2    HA   ALA  22           HA       ALA  22  16.944   3.774   7.806
    3    HB3  ALA  22           HB1      ALA  22  15.531   2.552   6.121
    4    HB2  ALA  22           HB2      ALA  22  14.844   4.074   6.686
    5    HB1  ALA  22           HB3      ALA  22  14.229   2.543   7.310

  No H/Q in entry =           5
  In of MODEL   35
    1    H    TYR  23           H        TYR  23  14.415   1.992   9.630
    2    HA   TYR  23           HA       TYR  23  13.478   4.241  11.077
    3    HB2  TYR  23           HB2      TYR  23  12.214   2.144  11.049
    4    HB3  TYR  23           HB3      TYR  23  13.530   1.316  11.880
    5    HD1  TYR  23           HD1      TYR  23  11.060   4.090  12.231
    6    HD2  TYR  23           HD2      TYR  23  13.717   1.377  14.238
    7    HE1  TYR  23           HE1      TYR  23  10.129   4.797  14.420
    8    HE2  TYR  23           HE2      TYR  23  12.787   2.084  16.425
    9    HH   TYR  23           HH       TYR  23  11.438   4.578  17.128

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ALA  24           H        ALA  24  16.088   1.927  11.723
    2    HA   ALA  24           HA       ALA  24  16.761   2.911  14.290
    3    HB1  ALA  24           HB1      ALA  24  18.093   1.099  14.129
    4    HB3  ALA  24           HB2      ALA  24  19.138   2.006  13.036
    5    HB2  ALA  24           HB3      ALA  24  17.832   1.017  12.388

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA  25           H        ALA  25  17.745   3.829  11.016
    2    HA   ALA  25           HA       ALA  25  19.716   5.734  11.671
    3    HB1  ALA  25           HB1      ALA  25  18.995   4.798   9.352
    4    HB3  ALA  25           HB2      ALA  25  19.521   6.478   9.449
    5    HB2  ALA  25           HB3      ALA  25  17.801   6.096   9.372

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU  26           H        LEU  26  16.206   6.015  11.295
    2    HA   LEU  26           HA       LEU  26  16.021   8.799  11.748
    3    HB2  LEU  26           HB2      LEU  26  14.146   7.592  10.811
    4    HB3  LEU  26           HB3      LEU  26  14.034   6.565  12.235
    5    HG   LEU  26           HG       LEU  26  13.451   8.530  13.615
    6   HD12  LEU  26          HD11      LEU  26  12.827  10.642  12.288
    7   HD11  LEU  26          HD12      LEU  26  13.803   9.975  10.982
    8   HD13  LEU  26          HD13      LEU  26  14.547  10.348  12.538
    9   HD21  LEU  26          HD21      LEU  26  11.781   8.244  11.098
   10   HD23  LEU  26          HD22      LEU  26  11.225   8.949  12.613
   11   HD22  LEU  26          HD23      LEU  26  11.652   7.241  12.543

  No H/Q in entry =          11
  In of MODEL   35
    1    H    LYS  27           H        LYS  27  15.862   6.020  13.938
    2    HA   LYS  27           HA       LYS  27  15.280   7.393  16.305
    3    HB2  LYS  27           HB2      LYS  27  15.272   4.918  16.038
    4    HB3  LYS  27           HB3      LYS  27  17.036   4.943  16.002
    5    HG2  LYS  27           HG2      LYS  27  17.092   5.926  18.253
    6    HG3  LYS  27           HG3      LYS  27  15.325   5.972  18.291
    7    HD2  LYS  27           HD2      LYS  27  15.263   3.506  18.052
    8    HD3  LYS  27           HD3      LYS  27  17.027   3.468  18.048
    9    HE2  LYS  27           HE2      LYS  27  17.067   4.454  20.305
   10    HE3  LYS  27           HE3      LYS  27  15.302   4.522  20.312
   11    HZ3  LYS  27           HZ1      LYS  27  16.055   2.557  21.465
   12    HZ2  LYS  27           HZ2      LYS  27  16.969   2.065  20.117
   13    HZ1  LYS  27           HZ3      LYS  27  15.272   2.096  20.031

  No H/Q in entry =          13
  In of MODEL   35
    1    H    GLN  28           H        GLN  28  18.394   6.763  14.726
    2    HA   GLN  28           HA       GLN  28  20.087   7.818  16.724
    3    HB2  GLN  28           HB2      GLN  28  20.385   7.771  13.710
    4    HB3  GLN  28           HB3      GLN  28  21.675   8.221  14.826
    5    HG2  GLN  28           HG2      GLN  28  20.212   5.568  14.879
    6    HG3  GLN  28           HG3      GLN  28  21.789   5.823  14.134
    7   HE21  GLN  28          HE21      GLN  28  20.540   4.535  16.856
    8   HE22  GLN  28          HE22      GLN  28  21.749   4.943  17.974

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ALA  29           H        ALA  29  18.370   9.331  14.026
    2    HA   ALA  29           HA       ALA  29  19.410  11.935  14.285
    3    HB2  ALA  29           HB1      ALA  29  17.729  12.601  12.807
    4    HB1  ALA  29           HB2      ALA  29  16.563  11.446  13.453
    5    HB3  ALA  29           HB3      ALA  29  17.888  10.883  12.435

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LYS  30           H        LYS  30  16.602  10.380  15.793
    2    HA   LYS  30           HA       LYS  30  15.619  12.649  17.148
    3    HB2  LYS  30           HB2      LYS  30  15.456   9.710  17.849
    4    HB3  LYS  30           HB3      LYS  30  14.607  10.974  18.740
    5    HG2  LYS  30           HG2      LYS  30  13.503  11.680  16.618
    6    HG3  LYS  30           HG3      LYS  30  14.288  10.331  15.793
    7    HD2  LYS  30           HD2      LYS  30  13.183   8.741  17.316
    8    HD3  LYS  30           HD3      LYS  30  12.407  10.079  18.164
    9    HE2  LYS  30           HE2      LYS  30  11.259  10.733  16.068
   10    HE3  LYS  30           HE3      LYS  30  12.014   9.367  15.239
   11    HZ2  LYS  30           HZ1      LYS  30   9.695   8.996  16.109
   12    HZ1  LYS  30           HZ2      LYS  30  10.357   9.036  17.679
   13    HZ3  LYS  30           HZ3      LYS  30  10.850   7.844  16.569

  No H/Q in entry =          13
  In of MODEL   35
    1    H    GLN  31           H        GLN  31  18.240  10.434  17.894
    2    HA   GLN  31           HA       GLN  31  18.574  11.440  20.591
    3    HB2  GLN  31           HB2      GLN  31  20.576   9.837  18.993
    4    HB3  GLN  31           HB3      GLN  31  20.437   9.962  20.747
    5    HG2  GLN  31           HG2      GLN  31  17.910   9.053  19.967
    6    HG3  GLN  31           HG3      GLN  31  19.002   8.191  18.890
    7   HE21  GLN  31          HE21      GLN  31  17.430   7.070  21.159
    8   HE22  GLN  31          HE22      GLN  31  18.570   6.388  22.214

  No H/Q in entry =           8
  In of MODEL   35
    1    H    GLY  32           H        GLY  32  19.127  12.751  17.628
    2    HA3  GLY  32           HA2      GLY  32  20.149  14.780  17.120
    3    HA2  GLY  32           HA3      GLY  32  20.900  14.770  18.711

  No H/Q in entry =           3
  In of MODEL   35
    1    H    ASP  33           H        ASP  33  21.279  11.873  16.932
    2    HA   ASP  33           HA       ASP  33  24.118  12.500  16.478
    3    HB2  ASP  33           HB2      ASP  33  22.564   9.910  16.586
    4    HB3  ASP  33           HB3      ASP  33  24.254   9.998  16.098

  No H/Q in entry =           4
  In of MODEL   35
    1    H    PHE  34           H        PHE  34  23.667  13.833  14.597
    2    HA   PHE  34           HA       PHE  34  22.310  12.874  12.303
    3    HB2  PHE  34           HB2      PHE  34  24.476  14.972  12.544
    4    HB3  PHE  34           HB3      PHE  34  23.492  14.699  11.108
    5    HD1  PHE  34           HD1      PHE  34  23.764  16.626  14.024
    6    HD2  PHE  34           HD2      PHE  34  20.861  14.562  11.625
    7    HE1  PHE  34           HE1      PHE  34  21.968  18.053  14.965
    8    HE2  PHE  34           HE2      PHE  34  19.068  15.989  12.569
    9    HZ   PHE  34           HZ       PHE  34  19.625  17.735  14.235

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ALA  35           H        ALA  35  25.677  12.629  13.324
    2    HA   ALA  35           HA       ALA  35  26.778  11.792  10.871
    3    HB3  ALA  35           HB1      ALA  35  28.432  10.592  12.596
    4    HB2  ALA  35           HB2      ALA  35  27.581  11.631  13.739
    5    HB1  ALA  35           HB3      ALA  35  28.435  12.342  12.371

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA  36           H        ALA  36  25.619   9.852  13.630
    2    HA   ALA  36           HA       ALA  36  26.067   7.358  12.354
    3    HB2  ALA  36           HB1      ALA  36  25.616   6.617  14.427
    4    HB3  ALA  36           HB2      ALA  36  23.937   7.139  14.270
    5    HB1  ALA  36           HB3      ALA  36  25.154   8.250  14.899

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA  37           H        ALA  37  23.280   9.529  12.478
    2    HA   ALA  37           HA       ALA  37  21.400   7.791  11.293
    3    HB3  ALA  37           HB1      ALA  37  21.673  10.750  11.589
    4    HB1  ALA  37           HB2      ALA  37  20.342   9.692  12.055
    5    HB2  ALA  37           HB3      ALA  37  20.545  10.163  10.367

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LYS  38           H        LYS  38  23.545  10.220   9.825
    2    HA   LYS  38           HA       LYS  38  22.910   9.805   7.145
    3    HB2  LYS  38           HB2      LYS  38  24.738  11.332   8.599
    4    HB3  LYS  38           HB3      LYS  38  25.760  10.327   7.576
    5    HG2  LYS  38           HG2      LYS  38  24.615  11.118   5.576
    6    HG3  LYS  38           HG3      LYS  38  23.431  11.990   6.553
    7    HD2  LYS  38           HD2      LYS  38  25.048  13.563   7.314
    8    HD3  LYS  38           HD3      LYS  38  26.394  12.556   6.783
    9    HE2  LYS  38           HE2      LYS  38  26.073  14.434   5.232
   10    HE3  LYS  38           HE3      LYS  38  25.717  12.903   4.424
   11    HZ3  LYS  38           HZ1      LYS  38  23.528  13.382   4.286
   12    HZ2  LYS  38           HZ2      LYS  38  24.075  14.988   4.377
   13    HZ1  LYS  38           HZ3      LYS  38  23.484  14.212   5.766

  No H/Q in entry =          13
  In of MODEL   35
    1    H    ALA  39           H        ALA  39  25.391   8.166   9.109
    2    HA   ALA  39           HA       ALA  39  26.444   6.563   7.043
    3    HB2  ALA  39           HB1      ALA  39  26.328   5.599   9.885
    4    HB1  ALA  39           HB2      ALA  39  27.305   7.010   9.474
    5    HB3  ALA  39           HB3      ALA  39  27.635   5.455   8.710

  No H/Q in entry =           5
  In of MODEL   35
    1    H    MET  40           H        MET  40  23.812   5.986   9.330
    2    HA   MET  40           HA       MET  40  23.331   3.288   8.591
    3    HB2  MET  40           HB2      MET  40  21.540   5.358   9.878
    4    HB3  MET  40           HB3      MET  40  21.109   3.656   9.700
    5    HG2  MET  40           HG2      MET  40  23.667   4.557  11.052
    6    HG3  MET  40           HG3      MET  40  22.165   4.303  11.939
    7    HE3  MET  40           HE1      MET  40  21.545   0.678  12.108
    8    HE2  MET  40           HE2      MET  40  20.700   1.995  11.299
    9    HE1  MET  40           HE3      MET  40  21.439   2.269  12.875

  No H/Q in entry =           9
  In of MODEL   35
    1    H    MET  41           H        MET  41  21.968   6.364   7.401
    2    HA   MET  41           HA       MET  41  20.000   5.200   5.720
    3    HB2  MET  41           HB2      MET  41  21.522   7.768   5.215
    4    HB3  MET  41           HB3      MET  41  19.989   7.298   4.490
    5    HG2  MET  41           HG2      MET  41  19.230   7.118   7.038
    6    HG3  MET  41           HG3      MET  41  20.556   8.256   7.267
    7    HE2  MET  41           HE1      MET  41  20.025   9.555   3.929
    8    HE1  MET  41           HE2      MET  41  20.983   9.979   5.345
    9    HE3  MET  41           HE3      MET  41  19.729  11.078   4.777

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ASP  42           H        ASP  42  23.388   6.073   5.181
    2    HA   ASP  42           HA       ASP  42  23.484   5.600   2.423
    3    HB2  ASP  42           HB2      ASP  42  25.242   6.570   4.201
    4    HB3  ASP  42           HB3      ASP  42  25.876   4.935   4.074

  No H/Q in entry =           4
  In of MODEL   35
    1    H    GLN  43           H        GLN  43  24.165   3.432   5.145
    2    HA   GLN  43           HA       GLN  43  24.803   1.167   3.562
    3    HB2  GLN  43           HB2      GLN  43  23.771   1.363   6.402
    4    HB3  GLN  43           HB3      GLN  43  24.331  -0.134   5.648
    5    HG2  GLN  43           HG2      GLN  43  26.514   1.045   5.147
    6    HG3  GLN  43           HG3      GLN  43  25.947   2.380   6.145
    7   HE21  GLN  43          HE21      GLN  43  28.162   1.373   7.190
    8   HE22  GLN  43          HE22      GLN  43  27.866   0.293   8.464

  No H/Q in entry =           8
  In of MODEL   35
    1    H    SER  44           H        SER  44  21.758   2.344   4.936
    2    HA   SER  44           HA       SER  44  20.159   0.125   4.255
    3    HB2  SER  44           HB2      SER  44  19.750   2.659   5.402
    4    HB3  SER  44           HB3      SER  44  18.721   2.633   3.972
    5    HG   SER  44           HG       SER  44  17.607   1.704   5.690

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ARG  45           H        ARG  45  20.953   3.080   2.456
    2    HA   ARG  45           HA       ARG  45  19.430   2.619   0.145
    3    HB2  ARG  45           HB2      ARG  45  20.603   4.737   0.736
    4    HB3  ARG  45           HB3      ARG  45  22.137   3.960   0.356
    5    HG2  ARG  45           HG2      ARG  45  21.357   3.569  -1.962
    6    HG3  ARG  45           HG3      ARG  45  19.835   4.369  -1.581
    7    HD2  ARG  45           HD2      ARG  45  21.114   6.446  -0.989
    8    HD3  ARG  45           HD3      ARG  45  22.601   5.650  -1.553
    9    HE   ARG  45           HE       ARG  45  20.675   5.444  -3.597
   10   HH21  ARG  45          HH11      ARG  45  20.696   6.814  -5.358
   11   HH22  ARG  45          HH12      ARG  45  21.475   8.353  -5.250
   12   HH11  ARG  45          HH21      ARG  45  22.437   7.914  -1.961
   13   HH12  ARG  45          HH22      ARG  45  22.460   8.975  -3.323

  No H/Q in entry =          13
  In of MODEL   35
    1    H    MET  46           H        MET  46  22.777   1.693   0.904
    2    HA   MET  46           HA       MET  46  23.374   0.493  -1.579
    3    HB2  MET  46           HB2      MET  46  24.465   0.133   1.214
    4    HB3  MET  46           HB3      MET  46  25.119  -0.747  -0.171
    5    HG2  MET  46           HG2      MET  46  25.571   1.381  -1.326
    6    HG3  MET  46           HG3      MET  46  24.892   2.272   0.029
    7    HE3  MET  46           HE1      MET  46  28.603   3.139   0.467
    8    HE2  MET  46           HE2      MET  46  26.958   3.729   0.681
    9    HE1  MET  46           HE3      MET  46  27.486   3.167  -0.904

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ALA  47           H        ALA  47  21.960  -0.821   1.391
    2    HA   ALA  47           HA       ALA  47  21.867  -3.532   0.586
    3    HB2  ALA  47           HB1      ALA  47  21.487  -3.067   2.889
    4    HB3  ALA  47           HB2      ALA  47  19.944  -3.646   2.265
    5    HB1  ALA  47           HB3      ALA  47  20.199  -1.919   2.525

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU  48           H        LEU  48  19.557  -0.868   0.223
    2    HA   LEU  48           HA       LEU  48  17.492  -2.368  -1.035
    3    HB2  LEU  48           HB2      LEU  48  18.194   0.576  -1.146
    4    HB3  LEU  48           HB3      LEU  48  16.714  -0.110  -1.818
    5    HG   LEU  48           HG       LEU  48  17.553  -0.428   1.073
    6   HD13  LEU  48          HD11      LEU  48  17.173   1.879   0.887
    7   HD12  LEU  48          HD12      LEU  48  15.603   1.257   1.391
    8   HD11  LEU  48          HD13      LEU  48  15.886   1.675  -0.299
    9   HD22  LEU  48          HD21      LEU  48  15.999  -2.117   0.687
   10   HD21  LEU  48          HD22      LEU  48  15.143  -1.200  -0.554
   11   HD23  LEU  48          HD23      LEU  48  14.932  -0.793   1.149

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ASN  49           H        ASN  49  20.215  -0.482  -2.256
    2    HA   ASN  49           HA       ASN  49  19.571  -0.554  -4.982
    3    HB2  ASN  49           HB2      ASN  49  21.270   0.937  -4.068
    4    HB3  ASN  49           HB3      ASN  49  22.272  -0.434  -3.609
    5   HD21  ASN  49          HD21      ASN  49  22.210   1.925  -5.827
    6   HD22  ASN  49          HD22      ASN  49  22.868   1.120  -7.167

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLU  50           H        GLU  50  21.513  -2.781  -3.015
    2    HA   GLU  50           HA       GLU  50  22.192  -4.547  -5.140
    3    HB2  GLU  50           HB2      GLU  50  23.384  -4.543  -2.971
    4    HB3  GLU  50           HB3      GLU  50  21.929  -5.147  -2.179
    5    HG2  GLU  50           HG2      GLU  50  21.989  -7.181  -3.539
    6    HG3  GLU  50           HG3      GLU  50  23.378  -6.571  -4.436

  No H/Q in entry =           6
  In of MODEL   35
    1    H    ALA  51           H        ALA  51  19.531  -4.439  -2.821
    2    HA   ALA  51           HA       ALA  51  18.326  -6.893  -3.583
    3    HB3  ALA  51           HB1      ALA  51  16.738  -6.361  -2.032
    4    HB1  ALA  51           HB2      ALA  51  16.554  -4.712  -2.631
    5    HB2  ALA  51           HB3      ALA  51  17.903  -5.120  -1.571

  No H/Q in entry =           5
  In of MODEL   35
    1    H    HIS  52           H        HIS  52  17.798  -3.535  -4.618
    2    HA   HIS  52           HA       HIS  52  15.681  -4.026  -6.424
    3    HB2  HIS  52           HB2      HIS  52  16.354  -1.772  -5.625
    4    HB3  HIS  52           HB3      HIS  52  17.822  -1.891  -6.596
    5    HD1  HIS  52           HD1      HIS  52  17.523  -1.921  -9.216
    6    HD2  HIS  52           HD2      HIS  52  14.016  -1.185  -7.087
    7    HE1  HIS  52           HE1      HIS  52  15.840  -1.042 -10.891
    8    HE2  HIS  52           HE2      HIS  52  13.696  -0.588  -9.609

  No H/Q in entry =           8
  In of MODEL   35
    1    H    LEU  53           H        LEU  53  19.201  -4.089  -6.847
    2    HA   LEU  53           HA       LEU  53  19.260  -4.405  -9.648
    3    HB2  LEU  53           HB2      LEU  53  21.174  -5.201  -7.469
    4    HB3  LEU  53           HB3      LEU  53  21.489  -5.589  -9.158
    5    HG   LEU  53           HG       LEU  53  20.869  -2.772  -8.212
    6   HD12  LEU  53          HD11      LEU  53  23.304  -2.371  -8.335
    7   HD11  LEU  53          HD12      LEU  53  23.565  -4.080  -8.677
    8   HD13  LEU  53          HD13      LEU  53  22.923  -3.582  -7.116
    9   HD22  LEU  53          HD21      LEU  53  20.591  -2.788 -10.548
   10   HD21  LEU  53          HD22      LEU  53  21.823  -4.025 -10.779
   11   HD23  LEU  53          HD23      LEU  53  22.297  -2.377 -10.413

  No H/Q in entry =          11
  In of MODEL   35
    1    H    VAL  54           H        VAL  54  19.102  -6.790  -7.023
    2    HA   VAL  54           HA       VAL  54  19.193  -9.086  -8.682
    3    HB   VAL  54           HB       VAL  54  18.038  -8.645  -5.918
    4   HG12  VAL  54          HG11      VAL  54  18.321 -11.267  -5.913
    5   HG11  VAL  54          HG12      VAL  54  18.143 -11.095  -7.659
    6   HG13  VAL  54          HG13      VAL  54  16.860 -10.545  -6.584
    7   HG22  VAL  54          HG21      VAL  54  20.356  -8.471  -5.689
    8   HG21  VAL  54          HG22      VAL  54  20.680  -9.568  -7.030
    9   HG23  VAL  54          HG23      VAL  54  20.135 -10.206  -5.478

  No H/Q in entry =           9
  In of MODEL   35
    1    H    GLN  55           H        GLN  55  16.492  -7.140  -7.407
    2    HA   GLN  55           HA       GLN  55  14.448  -8.773  -8.486
    3    HB2  GLN  55           HB2      GLN  55  13.719  -7.235  -6.861
    4    HB3  GLN  55           HB3      GLN  55  14.535  -5.879  -7.635
    5    HG2  GLN  55           HG2      GLN  55  12.820  -5.528  -9.129
    6    HG3  GLN  55           HG3      GLN  55  12.472  -7.244  -9.300
    7   HE21  GLN  55          HE21      GLN  55  10.455  -7.761  -8.500
    8   HE22  GLN  55          HE22      GLN  55   9.689  -6.995  -7.194

  No H/Q in entry =           8
  In of MODEL   35
    1    H    THR  56           H        THR  56  16.234  -6.000  -9.841
    2    HA   THR  56           HA       THR  56  14.808  -5.616 -12.193
    3    HB   THR  56           HB       THR  56  17.827  -5.575 -12.026
    4    HG1  THR  56           HG1      THR  56  15.864  -3.764 -11.113
    5   HG21  THR  56          HG21      THR  56  16.640  -5.280 -14.256
    6   HG23  THR  56          HG22      THR  56  17.685  -3.946 -13.772
    7   HG22  THR  56          HG23      THR  56  15.936  -3.806 -13.587

  No H/Q in entry =           7
  In of MODEL   35
    1    H    LYS  57           H        LYS  57  17.420  -7.953 -11.574
    2    HA   LYS  57           HA       LYS  57  17.409  -9.148 -14.153
    3    HB2  LYS  57           HB2      LYS  57  19.192  -9.429 -12.405
    4    HB3  LYS  57           HB3      LYS  57  18.070 -10.404 -11.468
    5    HG2  LYS  57           HG2      LYS  57  17.946 -12.052 -13.268
    6    HG3  LYS  57           HG3      LYS  57  18.997 -11.068 -14.278
    7    HD2  LYS  57           HD2      LYS  57  20.811 -11.305 -12.601
    8    HD3  LYS  57           HD3      LYS  57  19.764 -12.337 -11.628
    9    HE2  LYS  57           HE2      LYS  57  20.529 -12.945 -14.504
   10    HE3  LYS  57           HE3      LYS  57  21.362 -13.627 -13.109
   11    HZ2  LYS  57           HZ1      LYS  57  19.116 -14.621 -14.317
   12    HZ1  LYS  57           HZ2      LYS  57  18.544 -13.916 -12.882
   13    HZ3  LYS  57           HZ3      LYS  57  19.758 -15.102 -12.824

  No H/Q in entry =          13
  In of MODEL   35
    1    H    LEU  58           H        LEU  58  15.611  -9.788 -11.182
    2    HA   LEU  58           HA       LEU  58  14.357 -12.143 -12.119
    3    HB2  LEU  58           HB2      LEU  58  13.585 -10.225  -9.926
    4    HB3  LEU  58           HB3      LEU  58  12.756 -11.751 -10.244
    5    HG   LEU  58           HG       LEU  58  15.731 -11.517  -9.682
    6   HD11  LEU  58          HD11      LEU  58  13.350 -11.899  -7.895
    7   HD13  LEU  58          HD12      LEU  58  14.817 -10.958  -7.629
    8   HD12  LEU  58          HD13      LEU  58  14.863 -12.714  -7.493
    9   HD22  LEU  58          HD21      LEU  58  15.586 -13.577 -10.709
   10   HD21  LEU  58          HD22      LEU  58  13.868 -13.761 -10.353
   11   HD23  LEU  58          HD23      LEU  58  15.069 -14.080  -9.101

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  59           H        ILE  59  13.737  -8.796 -12.804
    2    HA   ILE  59           HA       ILE  59  11.014  -9.405 -13.750
    3    HB   ILE  59           HB       ILE  59  11.854  -7.134 -12.544
    4   HG12  ILE  59          HG12      ILE  59   9.944  -6.997 -14.890
    5   HG13  ILE  59          HG13      ILE  59   9.518  -7.743 -13.371
    6   HG22  ILE  59          HG21      ILE  59  11.946  -6.326 -15.438
    7   HG21  ILE  59          HG22      ILE  59  13.416  -6.764 -14.596
    8   HG23  ILE  59          HG23      ILE  59  12.444  -5.405 -14.039
    9   HD12  ILE  59          HD11      ILE  59   8.804  -5.360 -13.496
   10   HD11  ILE  59          HD12      ILE  59  10.499  -4.902 -13.640
   11   HD13  ILE  59          HD13      ILE  59   9.916  -5.669 -12.162

  No H/Q in entry =          11
  In of MODEL   35
    1    H    GLU  60           H        GLU  60  14.233  -8.601 -15.001
    2    HA   GLU  60           HA       GLU  60  13.466  -8.190 -17.711
    3    HB2  GLU  60           HB2      GLU  60  15.652  -7.484 -16.867
    4    HB3  GLU  60           HB3      GLU  60  16.089  -9.159 -16.541
    5    HG2  GLU  60           HG2      GLU  60  15.909  -9.682 -18.946
    6    HG3  GLU  60           HG3      GLU  60  15.458  -8.011 -19.279

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLY  61           H        GLY  61  14.396 -11.085 -15.893
    2    HA3  GLY  61           HA2      GLY  61  13.836 -12.725 -18.296
    3    HA2  GLY  61           HA3      GLY  61  14.858 -13.221 -16.951

  No H/Q in entry =           3
  In of MODEL   35
    1    H    ASP  62           H        ASP  62  11.761 -11.628 -16.585
    2    HA   ASP  62           HA       ASP  62  10.800 -13.696 -14.853
    3    HB2  ASP  62           HB2      ASP  62   8.780 -12.286 -14.723
    4    HB3  ASP  62           HB3      ASP  62  10.253 -11.363 -14.436

  No H/Q in entry =           4
  In of MODEL   35
    1    H    ALA  63           H        ALA  63  11.089 -15.367 -16.757
    2    HA   ALA  63           HA       ALA  63   9.143 -15.455 -18.847
    3    HB1  ALA  63           HB1      ALA  63  11.244 -16.767 -18.875
    4    HB3  ALA  63           HB2      ALA  63   9.828 -17.793 -19.099
    5    HB2  ALA  63           HB3      ALA  63  10.640 -17.742 -17.535

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLY  64           H        GLY  64   9.259 -16.700 -15.558
    2    HA3  GLY  64           HA2      GLY  64   7.485 -17.189 -14.134
    3    HA2  GLY  64           HA3      GLY  64   6.372 -16.950 -15.473

  No H/Q in entry =           3
  In of MODEL   35
    1    H    GLU  65           H        GLU  65   5.765 -19.027 -13.932
    2    HA   GLU  65           HA       GLU  65   7.095 -21.449 -14.528
    3    HB2  GLU  65           HB2      GLU  65   4.302 -20.909 -13.530
    4    HB3  GLU  65           HB3      GLU  65   4.998 -22.523 -13.666
    5    HG2  GLU  65           HG2      GLU  65   6.817 -21.908 -12.159
    6    HG3  GLU  65           HG3      GLU  65   6.218 -20.252 -12.071

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLY  66           H        GLY  66   4.327 -19.884 -15.958
    2    HA3  GLY  66           HA2      GLY  66   4.116 -21.937 -18.048
    3    HA2  GLY  66           HA3      GLY  66   2.864 -20.791 -17.617

  No H/Q in entry =           3
  In of MODEL   35
    1    H    LYS  67           H        LYS  67   3.378 -21.116 -20.199
    2    HA   LYS  67           HA       LYS  67   5.285 -19.952 -21.628
    3    HB2  LYS  67           HB2      LYS  67   3.315 -19.048 -23.119
    4    HB3  LYS  67           HB3      LYS  67   3.562 -20.785 -22.901
    5    HG2  LYS  67           HG2      LYS  67   1.914 -20.844 -21.109
    6    HG3  LYS  67           HG3      LYS  67   1.729 -19.093 -21.177
    7    HD2  LYS  67           HD2      LYS  67   0.861 -19.274 -23.481
    8    HD3  LYS  67           HD3      LYS  67   1.035 -21.028 -23.405
    9    HE2  LYS  67           HE2      LYS  67  -0.529 -21.115 -21.507
   10    HE3  LYS  67           HE3      LYS  67  -0.695 -19.361 -21.554
   11    HZ2  LYS  67           HZ1      LYS  67  -2.196 -21.182 -22.947
   12    HZ1  LYS  67           HZ2      LYS  67  -1.150 -20.522 -24.110
   13    HZ3  LYS  67           HZ3      LYS  67  -2.157 -19.504 -23.194

  No H/Q in entry =          13
  In of MODEL   35
    1    H    MET  68           H        MET  68   2.673 -17.811 -21.885
    2    HA   MET  68           HA       MET  68   4.211 -15.467 -21.884
    3    HB2  MET  68           HB2      MET  68   1.261 -16.010 -21.735
    4    HB3  MET  68           HB3      MET  68   1.900 -14.366 -21.727
    5    HG2  MET  68           HG2      MET  68   2.554 -16.430 -23.845
    6    HG3  MET  68           HG3      MET  68   1.316 -15.187 -24.021
    7    HE3  MET  68           HE1      MET  68   2.724 -12.015 -24.428
    8    HE2  MET  68           HE2      MET  68   2.964 -12.340 -22.713
    9    HE1  MET  68           HE3      MET  68   1.546 -12.988 -23.535

  No H/Q in entry =           9
  In of MODEL   35
    1    H    LYS  69           H        LYS  69   2.210 -16.858 -19.268
    2    HA   LYS  69           HA       LYS  69   2.015 -14.768 -17.536
    3    HB2  LYS  69           HB2      LYS  69   2.420 -17.700 -17.008
    4    HB3  LYS  69           HB3      LYS  69   2.148 -16.549 -15.697
    5    HG2  LYS  69           HG2      LYS  69   0.059 -15.810 -16.728
    6    HG3  LYS  69           HG3      LYS  69   0.340 -16.871 -18.109
    7    HD2  LYS  69           HD2      LYS  69  -1.125 -18.132 -16.779
    8    HD3  LYS  69           HD3      LYS  69   0.456 -18.767 -16.317
    9    HE2  LYS  69           HE2      LYS  69   0.200 -16.642 -14.604
   10    HE3  LYS  69           HE3      LYS  69  -1.471 -17.190 -14.736
   11    HZ1  LYS  69           HZ1      LYS  69   0.671 -19.156 -14.312
   12    HZ3  LYS  69           HZ2      LYS  69  -0.970 -19.243 -13.883
   13    HZ2  LYS  69           HZ3      LYS  69   0.094 -18.259 -12.995

  No H/Q in entry =          13
  In of MODEL   35
    1    H    VAL  70           H        VAL  70   3.107 -14.670 -15.241
    2    HA   VAL  70           HA       VAL  70   6.055 -14.695 -15.519
    3    HB   VAL  70           HB       VAL  70   6.099 -12.534 -14.296
    4   HG11  VAL  70          HG11      VAL  70   6.036 -12.772 -16.858
    5   HG13  VAL  70          HG12      VAL  70   5.630 -11.187 -16.199
    6   HG12  VAL  70          HG13      VAL  70   4.350 -12.269 -16.745
    7   HG23  VAL  70          HG21      VAL  70   3.747 -11.304 -14.458
    8   HG22  VAL  70          HG22      VAL  70   4.116 -12.344 -13.083
    9   HG21  VAL  70          HG23      VAL  70   3.119 -12.953 -14.404

  No H/Q in entry =           9
  In of MODEL   35
    1    H    SER  71           H        SER  71   7.156 -14.587 -13.403
    2    HA   SER  71           HA       SER  71   6.238 -16.543 -11.580
    3    HB2  SER  71           HB2      SER  71   8.637 -15.804 -11.923
    4    HB3  SER  71           HB3      SER  71   8.249 -14.360 -10.991
    5    HG   SER  71           HG       SER  71   7.739 -16.993 -10.073

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU  72           H        LEU  72   4.789 -16.400  -9.983
    2    HA   LEU  72           HA       LEU  72   3.272 -14.064  -9.543
    3    HB2  LEU  72           HB2      LEU  72   3.517 -16.627  -7.976
    4    HB3  LEU  72           HB3      LEU  72   2.369 -15.352  -7.573
    5    HG   LEU  72           HG       LEU  72   2.508 -16.646 -10.316
    6   HD12  LEU  72          HD11      LEU  72   0.587 -17.255  -8.049
    7   HD11  LEU  72          HD12      LEU  72   1.938 -18.289  -8.509
    8   HD13  LEU  72          HD13      LEU  72   0.614 -18.013  -9.641
    9   HD22  LEU  72          HD21      LEU  72   1.319 -14.640 -10.570
   10   HD21  LEU  72          HD22      LEU  72   0.645 -14.702  -8.949
   11   HD23  LEU  72          HD23      LEU  72   0.025 -15.775 -10.200

  No H/Q in entry =          11
  In of MODEL   35
    1    H    VAL  73           H        VAL  73   5.901 -15.541  -7.762
    2    HA   VAL  73           HA       VAL  73   5.856 -14.008  -5.429
    3    HB   VAL  73           HB       VAL  73   7.986 -14.883  -4.969
    4   HG11  VAL  73          HG11      VAL  73   6.083 -16.551  -5.392
    5   HG13  VAL  73          HG12      VAL  73   7.721 -17.203  -5.422
    6   HG12  VAL  73          HG13      VAL  73   6.869 -16.888  -6.934
    7   HG21  VAL  73          HG21      VAL  73   8.278 -15.026  -7.976
    8   HG23  VAL  73          HG22      VAL  73   9.362 -15.889  -6.886
    9   HG22  VAL  73          HG23      VAL  73   9.274 -14.128  -6.831

  No H/Q in entry =           9
  In of MODEL   35
    1    H    LEU  74           H        LEU  74   6.870 -13.128  -8.601
    2    HA   LEU  74           HA       LEU  74   8.842 -11.208  -8.101
    3    HB2  LEU  74           HB2      LEU  74   8.380 -11.952 -10.341
    4    HB3  LEU  74           HB3      LEU  74   6.725 -11.354 -10.246
    5    HG   LEU  74           HG       LEU  74   7.567  -9.043 -10.033
    6   HD13  LEU  74          HD11      LEU  74   9.670  -9.270  -8.956
    7   HD12  LEU  74          HD12      LEU  74  10.077  -8.786 -10.601
    8   HD11  LEU  74          HD13      LEU  74  10.228 -10.475 -10.116
    9   HD23  LEU  74          HD21      LEU  74   9.052 -10.158 -12.353
   10   HD22  LEU  74          HD22      LEU  74   7.915  -8.832 -12.267
   11   HD21  LEU  74          HD23      LEU  74   7.321 -10.477 -12.255

  No H/Q in entry =          11
  In of MODEL   35
    1    H    VAL  75           H        VAL  75   5.354 -10.771  -8.467
    2    HA   VAL  75           HA       VAL  75   5.297  -8.014  -7.879
    3    HB   VAL  75           HB       VAL  75   3.175 -10.127  -7.503
    4   HG11  VAL  75          HG11      VAL  75   3.036  -7.085  -7.326
    5   HG13  VAL  75          HG12      VAL  75   2.700  -8.227  -6.033
    6   HG12  VAL  75          HG13      VAL  75   1.630  -8.141  -7.423
    7   HG23  VAL  75          HG21      VAL  75   2.285  -8.962  -9.573
    8   HG22  VAL  75          HG22      VAL  75   3.796  -9.834  -9.822
    9   HG21  VAL  75          HG23      VAL  75   3.808  -8.077  -9.651

  No H/Q in entry =           9
  In of MODEL   35
    1    H    GLU  76           H        GLU  76   4.992 -10.888  -5.772
    2    HA   GLU  76           HA       GLU  76   4.533  -9.521  -3.351
    3    HB2  GLU  76           HB2      GLU  76   4.320 -11.984  -3.584
    4    HB3  GLU  76           HB3      GLU  76   6.054 -12.110  -3.822
    5    HG2  GLU  76           HG2      GLU  76   5.600 -12.685  -1.525
    6    HG3  GLU  76           HG3      GLU  76   6.375 -11.112  -1.513

  No H/Q in entry =           6
  In of MODEL   35
    1    H    ALA  77           H        ALA  77   7.585 -10.473  -4.903
    2    HA   ALA  77           HA       ALA  77   9.281  -9.456  -2.879
    3    HB3  ALA  77           HB1      ALA  77   9.849  -9.734  -5.840
    4    HB1  ALA  77           HB2      ALA  77  10.039 -11.015  -4.643
    5    HB2  ALA  77           HB3      ALA  77  11.053  -9.575  -4.561

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLN  78           H        GLN  78   7.923  -8.017  -5.798
    2    HA   GLN  78           HA       GLN  78   9.313  -5.559  -5.687
    3    HB2  GLN  78           HB2      GLN  78   8.013  -6.450  -7.651
    4    HB3  GLN  78           HB3      GLN  78   6.532  -6.055  -6.782
    5    HG2  GLN  78           HG2      GLN  78   7.207  -3.694  -6.685
    6    HG3  GLN  78           HG3      GLN  78   8.701  -4.078  -7.539
    7   HE21  GLN  78          HE21      GLN  78   6.851  -2.231  -8.672
    8   HE22  GLN  78          HE22      GLN  78   6.155  -2.937 -10.050

  No H/Q in entry =           8
  In of MODEL   35
    1    H    LEU  79           H        LEU  79   6.270  -6.650  -4.271
    2    HA   LEU  79           HA       LEU  79   5.310  -4.228  -3.265
    3    HB2  LEU  79           HB2      LEU  79   3.963  -6.259  -3.216
    4    HB3  LEU  79           HB3      LEU  79   5.091  -7.016  -2.096
    5    HG   LEU  79           HG       LEU  79   4.557  -5.367  -0.371
    6   HD13  LEU  79          HD11      LEU  79   4.128  -3.345  -1.423
    7   HD12  LEU  79          HD12      LEU  79   2.492  -3.845  -0.992
    8   HD11  LEU  79          HD13      LEU  79   3.077  -4.076  -2.637
    9   HD23  LEU  79          HD21      LEU  79   1.962  -5.818  -0.293
   10   HD22  LEU  79          HD22      LEU  79   3.080  -7.175  -0.180
   11   HD21  LEU  79          HD23      LEU  79   2.279  -6.825  -1.709

  No H/Q in entry =          11
  In of MODEL   35
    1    H    HIS  80           H        HIS  80   7.448  -6.598  -1.673
    2    HA   HIS  80           HA       HIS  80   7.748  -5.062   0.698
    3    HB2  HIS  80           HB2      HIS  80   9.055  -7.446  -0.495
    4    HB3  HIS  80           HB3      HIS  80   9.974  -6.564   0.726
    5    HD1  HIS  80           HD1      HIS  80   9.461  -7.193   3.066
    6    HD2  HIS  80           HD2      HIS  80   6.244  -7.991   0.538
    7    HE1  HIS  80           HE1      HIS  80   7.665  -8.269   4.506
    8    HE2  HIS  80           HE2      HIS  80   5.697  -8.759   2.973

  No H/Q in entry =           8
  In of MODEL   35
    1    H    LEU  81           H        LEU  81   9.764  -5.369  -2.204
    2    HA   LEU  81           HA       LEU  81  11.831  -3.661  -1.315
    3    HB2  LEU  81           HB2      LEU  81  10.912  -4.438  -4.083
    4    HB3  LEU  81           HB3      LEU  81  12.346  -3.455  -3.785
    5    HG   LEU  81           HG       LEU  81  11.903  -6.170  -2.514
    6   HD12  LEU  81          HD11      LEU  81  13.717  -6.825  -4.255
    7   HD11  LEU  81          HD12      LEU  81  13.179  -5.391  -5.129
    8   HD13  LEU  81          HD13      LEU  81  12.045  -6.698  -4.797
    9   HD23  LEU  81          HD21      LEU  81  14.536  -5.898  -2.487
   10   HD22  LEU  81          HD22      LEU  81  13.560  -5.122  -1.241
   11   HD21  LEU  81          HD23      LEU  81  14.161  -4.179  -2.605

  No H/Q in entry =          11
  In of MODEL   35
    1    H    MET  82           H        MET  82   8.929  -2.976  -3.266
    2    HA   MET  82           HA       MET  82   9.517  -0.259  -3.763
    3    HB2  MET  82           HB2      MET  82   6.931  -1.810  -3.652
    4    HB3  MET  82           HB3      MET  82   6.961  -0.086  -4.015
    5    HG2  MET  82           HG2      MET  82   8.535  -2.185  -5.543
    6    HG3  MET  82           HG3      MET  82   6.981  -1.537  -6.064
    7    HE3  MET  82           HE1      MET  82   7.493   1.911  -7.232
    8    HE2  MET  82           HE2      MET  82   7.106   1.690  -5.527
    9    HE1  MET  82           HE3      MET  82   6.428   0.592  -6.726

  No H/Q in entry =           9
  In of MODEL   35
    1    H    THR  83           H        THR  83   7.685  -1.828  -1.168
    2    HA   THR  83           HA       THR  83   6.867   0.533   0.155
    3    HB   THR  83           HB       THR  83   6.695  -1.039   2.171
    4    HG1  THR  83           HG1      THR  83   7.420  -3.002   1.945
    5   HG22  THR  83          HG21      THR  83   5.023  -2.577   0.694
    6   HG21  THR  83          HG22      THR  83   5.278  -1.251  -0.436
    7   HG23  THR  83          HG23      THR  83   4.635  -0.926   1.174

  No H/Q in entry =           7
  In of MODEL   35
    1    H    SER  84           H        SER  84   9.652  -1.612   0.690
    2    HA   SER  84           HA       SER  84  10.724  -0.201   2.884
    3    HB2  SER  84           HB2      SER  84  11.956  -2.064   0.865
    4    HB3  SER  84           HB3      SER  84  12.909  -1.327   2.152
    5    HG   SER  84           HG       SER  84  10.604  -2.978   2.399

  No H/Q in entry =           5
  In of MODEL   35
    1    H    MET  85           H        MET  85  11.500   0.048  -0.600
    2    HA   MET  85           HA       MET  85  13.530   1.979  -0.337
    3    HB2  MET  85           HB2      MET  85  13.116   0.701  -2.405
    4    HB3  MET  85           HB3      MET  85  11.613   1.591  -2.643
    5    HG2  MET  85           HG2      MET  85  12.859   3.707  -2.764
    6    HG3  MET  85           HG3      MET  85  14.368   2.844  -2.478
    7    HE2  MET  85           HE1      MET  85  11.700   2.961  -6.141
    8    HE1  MET  85           HE2      MET  85  11.306   3.303  -4.458
    9    HE3  MET  85           HE3      MET  85  11.293   1.642  -5.033

  No H/Q in entry =           9
  In of MODEL   35
    1    H    LEU  86           H        LEU  86  10.050   2.374  -0.864
    2    HA   LEU  86           HA       LEU  86  10.036   5.188  -1.045
    3    HB2  LEU  86           HB2      LEU  86   8.166   3.561  -1.632
    4    HB3  LEU  86           HB3      LEU  86   7.825   3.476   0.097
    5    HG   LEU  86           HG       LEU  86   7.710   6.040   0.045
    6   HD11  LEU  86          HD11      LEU  86   8.492   5.591  -2.653
    7   HD13  LEU  86          HD12      LEU  86   8.079   7.126  -1.894
    8   HD12  LEU  86          HD13      LEU  86   6.830   6.185  -2.706
    9   HD23  LEU  86          HD21      LEU  86   5.561   4.725  -1.630
   10   HD22  LEU  86          HD22      LEU  86   5.387   5.988  -0.414
   11   HD21  LEU  86          HD23      LEU  86   5.755   4.337   0.080

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ALA  87           H        ALA  87   9.517   3.017   1.698
    2    HA   ALA  87           HA       ALA  87   8.992   4.939   3.665
    3    HB1  ALA  87           HB1      ALA  87   9.750   2.105   3.581
    4    HB3  ALA  87           HB2      ALA  87   8.633   2.937   4.662
    5    HB2  ALA  87           HB3      ALA  87  10.360   2.938   5.015

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ARG  88           H        ARG  88  12.055   3.461   2.700
    2    HA   ARG  88           HA       ARG  88  13.679   4.809   4.541
    3    HB2  ARG  88           HB2      ARG  88  14.319   2.825   3.140
    4    HB3  ARG  88           HB3      ARG  88  14.498   3.915   1.768
    5    HG2  ARG  88           HG2      ARG  88  15.985   5.202   3.723
    6    HG3  ARG  88           HG3      ARG  88  16.273   3.507   4.103
    7    HD2  ARG  88           HD2      ARG  88  17.544   3.189   2.262
    8    HD3  ARG  88           HD3      ARG  88  16.428   4.081   1.224
    9    HE   ARG  88           HE       ARG  88  18.836   5.101   2.284
   10   HH21  ARG  88          HH11      ARG  88  19.222   7.314   2.092
   11   HH22  ARG  88          HH12      ARG  88  17.891   8.409   1.943
   12   HH11  ARG  88          HH21      ARG  88  15.512   5.914   1.989
   13   HH12  ARG  88          HH22      ARG  88  15.789   7.614   1.860

  No H/Q in entry =          13
  In of MODEL   35
    1    H    GLU  89           H        GLU  89  12.739   5.726   1.213
    2    HA   GLU  89           HA       GLU  89  14.328   8.058   1.066
    3    HB2  GLU  89           HB2      GLU  89  13.175   7.038  -0.888
    4    HB3  GLU  89           HB3      GLU  89  11.637   7.607  -0.238
    5    HG2  GLU  89           HG2      GLU  89  12.381   9.931  -0.396
    6    HG3  GLU  89           HG3      GLU  89  13.979   9.412  -0.925

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LEU  90           H        LEU  90  10.985   7.607   2.179
    2    HA   LEU  90           HA       LEU  90  10.515  10.349   2.753
    3    HB2  LEU  90           HB2      LEU  90   9.270   7.797   3.773
    4    HB3  LEU  90           HB3      LEU  90   8.666   9.403   4.193
    5    HG   LEU  90           HG       LEU  90   9.082   8.517   1.326
    6   HD12  LEU  90          HD11      LEU  90   6.543   8.233   1.376
    7   HD11  LEU  90          HD12      LEU  90   6.689   8.219   3.133
    8   HD13  LEU  90          HD13      LEU  90   7.490   6.976   2.172
    9   HD22  LEU  90          HD21      LEU  90   8.830  10.830   1.252
   10   HD21  LEU  90          HD22      LEU  90   7.837  10.879   2.707
   11   HD23  LEU  90          HD23      LEU  90   7.137  10.337   1.182

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  91           H        ILE  91  11.721   7.645   4.680
    2    HA   ILE  91           HA       ILE  91  11.874   9.006   7.149
    3    HB   ILE  91           HB       ILE  91  13.391   6.641   6.032
    4   HG12  ILE  91          HG12      ILE  91  11.367   6.843   8.282
    5   HG13  ILE  91          HG13      ILE  91  10.900   6.571   6.604
    6   HG22  ILE  91          HG21      ILE  91  13.844   6.418   8.675
    7   HG21  ILE  91          HG22      ILE  91  13.800   8.177   8.574
    8   HG23  ILE  91          HG23      ILE  91  14.967   7.269   7.615
    9   HD13  ILE  91          HD11      ILE  91  11.865   4.452   6.537
   10   HD12  ILE  91          HD12      ILE  91  11.265   4.520   8.194
   11   HD11  ILE  91          HD13      ILE  91  12.974   4.803   7.864

  No H/Q in entry =          11
  In of MODEL   35
    1    H    THR  92           H        THR  92  14.100   8.799   4.408
    2    HA   THR  92           HA       THR  92  16.285  10.153   5.579
    3    HB   THR  92           HB       THR  92  15.310  10.047   2.713
    4    HG1  THR  92           HG1      THR  92  16.106   8.135   3.121
    5   HG22  THR  92          HG21      THR  92  17.893  10.691   2.433
    6   HG21  THR  92          HG22      THR  92  17.592  11.517   3.961
    7   HG23  THR  92          HG23      THR  92  16.636  11.922   2.536

  No H/Q in entry =           7
  In of MODEL   35
    1    H    GLU  93           H        GLU  93  13.427  11.358   3.837
    2    HA   GLU  93           HA       GLU  93  14.070  14.108   3.955
    3    HB2  GLU  93           HB2      GLU  93  11.341  12.783   3.956
    4    HB3  GLU  93           HB3      GLU  93  11.661  14.478   3.586
    5    HG2  GLU  93           HG2      GLU  93  12.966  12.213   2.064
    6    HG3  GLU  93           HG3      GLU  93  11.435  12.923   1.570

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LEU  94           H        LEU  94  12.278  11.982   6.157
    2    HA   LEU  94           HA       LEU  94  11.495  13.941   8.030
    3    HB2  LEU  94           HB2      LEU  94  12.017  10.976   8.306
    4    HB3  LEU  94           HB3      LEU  94  11.456  11.961   9.654
    5    HG   LEU  94           HG       LEU  94   9.986  12.040   7.018
    6   HD11  LEU  94          HD11      LEU  94  10.020   9.817   9.022
    7   HD13  LEU  94          HD12      LEU  94   9.725   9.762   7.285
    8   HD12  LEU  94          HD13      LEU  94   8.451  10.301   8.377
    9   HD23  LEU  94          HD21      LEU  94   8.066  12.473   8.609
   10   HD22  LEU  94          HD22      LEU  94   9.327  13.705   8.653
   11   HD21  LEU  94          HD23      LEU  94   9.237  12.489   9.926

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  95           H        ILE  95  14.435  11.960   7.806
    2    HA   ILE  95           HA       ILE  95  15.608  12.860  10.226
    3    HB   ILE  95           HB       ILE  95  16.839  11.770   7.683
    4   HG12  ILE  95          HG12      ILE  95  16.509  10.573  10.449
    5   HG13  ILE  95          HG13      ILE  95  15.344  10.336   9.148
    6   HG21  ILE  95          HG21      ILE  95  18.096  12.553  10.332
    7   HG23  ILE  95          HG22      ILE  95  18.576  13.074   8.715
    8   HG22  ILE  95          HG23      ILE  95  18.850  11.408   9.224
    9   HD13  ILE  95          HD11      ILE  95  16.807   9.032   7.891
   10   HD12  ILE  95          HD12      ILE  95  17.265   8.574   9.529
   11   HD11  ILE  95          HD13      ILE  95  18.242   9.737   8.635

  No H/Q in entry =          11
  In of MODEL   35
    1    H    GLU  96           H        GLU  96  15.799  14.092   6.893
    2    HA   GLU  96           HA       GLU  96  17.680  16.137   7.380
    3    HB2  GLU  96           HB2      GLU  96  17.014  15.488   5.117
    4    HB3  GLU  96           HB3      GLU  96  15.380  16.074   5.410
    5    HG2  GLU  96           HG2      GLU  96  15.986  18.193   4.872
    6    HG3  GLU  96           HG3      GLU  96  17.280  18.170   6.060

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LEU  97           H        LEU  97  14.164  16.012   7.793
    2    HA   LEU  97           HA       LEU  97  13.794  18.753   8.435
    3    HB2  LEU  97           HB2      LEU  97  12.228  16.254   9.041
    4    HB3  LEU  97           HB3      LEU  97  11.740  17.809   9.710
    5    HG   LEU  97           HG       LEU  97  12.228  17.386   6.748
    6   HD12  LEU  97          HD11      LEU  97   9.704  17.303   6.618
    7   HD11  LEU  97          HD12      LEU  97   9.686  17.103   8.368
    8   HD13  LEU  97          HD13      LEU  97  10.449  15.882   7.349
    9   HD23  LEU  97          HD21      LEU  97  10.525  19.381   6.773
   10   HD22  LEU  97          HD22      LEU  97  12.211  19.710   7.174
   11   HD21  LEU  97          HD23      LEU  97  11.014  19.560   8.458

  No H/Q in entry =          11
  In of MODEL   35
    1    H    HIS  98           H        HIS  98  14.556  15.911  10.432
    2    HA   HIS  98           HA       HIS  98  14.409  17.173  12.948
    3    HB2  HIS  98           HB2      HIS  98  16.123  14.886  11.953
    4    HB3  HIS  98           HB3      HIS  98  16.124  15.423  13.634
    5    HD1  HIS  98           HD1      HIS  98  13.907  13.834  11.032
    6    HD2  HIS  98           HD2      HIS  98  13.799  14.754  15.096
    7    HE1  HIS  98           HE1      HIS  98  11.857  12.676  11.974
    8    HE2  HIS  98           HE2      HIS  98  11.771  13.227  14.446

  No H/Q in entry =           8
  In of MODEL   35
    1    H    GLU  99           H        GLU  99  16.971  17.014  10.525
    2    HA   GLU  99           HA       GLU  99  18.973  18.309  12.063
    3    HB2  GLU  99           HB2      GLU  99  19.439  17.014   9.996
    4    HB3  GLU  99           HB3      GLU  99  18.656  18.284   9.052
    5    HG2  GLU  99           HG2      GLU  99  20.290  19.925   9.851
    6    HG3  GLU  99           HG3      GLU  99  21.043  18.708  10.876

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LYS 100           H        LYS 100  16.481  19.518   9.837
    2    HA   LYS 100           HA       LYS 100  17.327  22.240   9.986
    3    HB2  LYS 100           HB2      LYS 100  14.674  20.999   9.219
    4    HB3  LYS 100           HB3      LYS 100  15.006  22.732   9.131
    5    HG2  LYS 100           HG2      LYS 100  16.976  22.249   7.673
    6    HG3  LYS 100           HG3      LYS 100  16.531  20.539   7.687
    7    HD2  LYS 100           HD2      LYS 100  14.350  21.089   6.678
    8    HD3  LYS 100           HD3      LYS 100  14.778  22.801   6.670
    9    HE2  LYS 100           HE2      LYS 100  16.734  22.286   5.219
   10    HE3  LYS 100           HE3      LYS 100  16.238  20.590   5.182
   11    HZ1  LYS 100           HZ1      LYS 100  14.457  22.816   4.341
   12    HZ3  LYS 100           HZ2      LYS 100  14.243  21.150   4.077
   13    HZ2  LYS 100           HZ3      LYS 100  15.473  21.991   3.262

  No H/Q in entry =          13
  In of MODEL   35
    1    H    LEU 101           H        LEU 101  15.184  20.231  11.941
    2    HA   LEU 101           HA       LEU 101  14.049  22.319  13.516
    3    HB2  LEU 101           HB2      LEU 101  14.435  19.362  13.899
    4    HB3  LEU 101           HB3      LEU 101  13.911  20.351  15.258
    5    HG   LEU 101           HG       LEU 101  12.507  20.467  12.583
    6   HD12  LEU 101          HD11      LEU 101  10.814  18.933  13.844
    7   HD11  LEU 101          HD12      LEU 101  12.196  18.494  14.844
    8   HD13  LEU 101          HD13      LEU 101  12.231  18.188  13.107
    9   HD21  LEU 101          HD21      LEU 101  11.852  21.270  15.433
   10   HD23  LEU 101          HD22      LEU 101  10.593  21.069  14.217
   11   HD22  LEU 101          HD23      LEU 101  11.851  22.281  13.986

  No H/Q in entry =          11
  In of MODEL   35
    1    H    LYS 102           H        LYS 102  17.187  21.654  13.092
    2    HA   LYS 102           HA       LYS 102  19.044  22.490  14.173
    3    HB2  LYS 102           HB2      LYS 102  17.254  24.037  15.300
    4    HB3  LYS 102           HB3      LYS 102  17.435  22.970  16.677
    5    HG2  LYS 102           HG2      LYS 102  19.370  24.947  15.517
    6    HG3  LYS 102           HG3      LYS 102  18.975  24.638  17.194
    7    HD2  LYS 102           HD2      LYS 102  20.614  22.696  15.514
    8    HD3  LYS 102           HD3      LYS 102  21.323  24.005  16.451
    9    HE2  LYS 102           HE2      LYS 102  20.874  21.463  17.416
   10    HE3  LYS 102           HE3      LYS 102  21.115  22.900  18.409
   11    HZ2  LYS 102           HZ1      LYS 102  19.120  21.652  19.018
   12    HZ1  LYS 102           HZ2      LYS 102  18.487  21.895  17.466
   13    HZ3  LYS 102           HZ3      LYS 102  18.737  23.220  18.494

  No H/Q in entry =          13
  In of MODEL   35
    1    H    ALA 103           H        ALA 103  16.933  20.921  16.585
    2    HA   ALA 103           HA       ALA 103  18.630  19.677  18.246
    3    HB2  ALA 103           HB1      ALA 103  17.008  17.700  18.232
    4    HB1  ALA 103           HB2      ALA 103  16.134  18.571  16.971
    5    HB3  ALA 103           HB3      ALA 103  16.319  19.287  18.571

  No H/Q in entry =           5
  In of MODEL   35
    1    H1   ALA   1           H3       ALA   1  -1.627  -6.770 -21.481
    2    H2   ALA   1           H2       ALA   1  -2.450  -8.190 -21.033
    3    H3   ALA   1           H1       ALA   1  -0.842  -8.270 -21.581
    4    HA   ALA   1           HA       ALA   1  -1.675  -8.722 -23.581
    5    HB1  ALA   1           HB1      ALA   1  -3.828  -9.400 -23.118
    6    HB2  ALA   1           HB2      ALA   1  -4.234  -7.880 -23.915
    7    HB3  ALA   1           HB3      ALA   1  -4.183  -7.963 -22.157

  No H/Q in entry =           7
  In of MODEL   35
    1    H    GLU   2           H        GLU   2  -2.474  -7.514 -25.573
    2    HA   GLU   2           HA       GLU   2  -1.033  -5.527 -26.442
    3    HB2  GLU   2           HB2      GLU   2  -4.039  -5.536 -26.773
    4    HB3  GLU   2           HB3      GLU   2  -2.898  -4.694 -27.817
    5    HG2  GLU   2           HG2      GLU   2  -2.425  -6.592 -28.972
    6    HG3  GLU   2           HG3      GLU   2  -2.152  -7.505 -27.494

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLU   3           H        GLU   3  -4.173  -4.211 -25.555
    2    HA   GLU   3           HA       GLU   3  -3.080  -1.675 -24.920
    3    HB2  GLU   3           HB2      GLU   3  -5.794  -2.939 -24.601
    4    HB3  GLU   3           HB3      GLU   3  -5.468  -1.330 -23.952
    5    HG2  GLU   3           HG2      GLU   3  -5.085  -0.408 -26.075
    6    HG3  GLU   3           HG3      GLU   3  -4.716  -1.970 -26.799

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LEU   4           H        LEU   4  -4.725  -4.006 -22.749
    2    HA   LEU   4           HA       LEU   4  -4.348  -2.787 -20.355
    3    HB2  LEU   4           HB2      LEU   4  -3.860  -5.738 -20.826
    4    HB3  LEU   4           HB3      LEU   4  -4.258  -4.985 -19.283
    5    HG   LEU   4           HG       LEU   4  -6.021  -5.022 -21.755
    6   HD13  LEU   4          HD11      LEU   4  -7.251  -6.718 -20.764
    7   HD12  LEU   4          HD12      LEU   4  -6.765  -6.269 -19.130
    8   HD11  LEU   4          HD13      LEU   4  -5.640  -7.133 -20.178
    9   HD23  LEU   4          HD21      LEU   4  -7.698  -4.181 -19.894
   10   HD22  LEU   4          HD22      LEU   4  -6.633  -3.029 -20.699
   11   HD21  LEU   4          HD23      LEU   4  -6.226  -3.629 -19.092

  No H/Q in entry =          11
  In of MODEL   35
    1    H    GLU   5           H        GLU   5  -1.878  -4.676 -22.077
    2    HA   GLU   5           HA       GLU   5   0.101  -4.432 -20.031
    3    HB2  GLU   5           HB2      GLU   5   0.143  -6.202 -21.781
    4    HB3  GLU   5           HB3      GLU   5   0.479  -4.965 -22.992
    5    HG2  GLU   5           HG2      GLU   5   2.549  -4.354 -21.818
    6    HG3  GLU   5           HG3      GLU   5   2.216  -5.562 -20.578

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLU   6           H        GLU   6  -0.487  -2.704 -23.077
    2    HA   GLU   6           HA       GLU   6   1.717  -0.914 -22.797
    3    HB2  GLU   6           HB2      GLU   6   0.620  -1.354 -24.969
    4    HB3  GLU   6           HB3      GLU   6  -0.850  -0.583 -24.372
    5    HG2  GLU   6           HG2      GLU   6   0.356   1.528 -24.060
    6    HG3  GLU   6           HG3      GLU   6   1.855   0.767 -24.586

  No H/Q in entry =           6
  In of MODEL   35
    1    H    VAL   7           H        VAL   7  -1.627  -0.923 -21.768
    2    HA   VAL   7           HA       VAL   7  -1.800   1.793 -20.929
    3    HB   VAL   7           HB       VAL   7  -3.315  -0.697 -20.102
    4   HG11  VAL   7          HG11      VAL   7  -3.638   2.198 -19.287
    5   HG13  VAL   7          HG12      VAL   7  -3.570   0.770 -18.253
    6   HG12  VAL   7          HG13      VAL   7  -4.993   1.068 -19.251
    7   HG21  VAL   7          HG21      VAL   7  -3.440   0.385 -22.490
    8   HG23  VAL   7          HG22      VAL   7  -4.365   1.650 -21.681
    9   HG22  VAL   7          HG23      VAL   7  -4.943  -0.016 -21.659

  No H/Q in entry =           9
  In of MODEL   35
    1    H    VAL   8           H        VAL   8  -0.878  -1.212 -19.285
    2    HA   VAL   8           HA       VAL   8  -0.551  -0.141 -16.687
    3    HB   VAL   8           HB       VAL   8   0.743  -2.502 -18.067
    4   HG11  VAL   8          HG11      VAL   8   1.029  -1.453 -15.246
    5   HG13  VAL   8          HG12      VAL   8   2.304  -1.896 -16.380
    6   HG12  VAL   8          HG13      VAL   8   1.309  -3.148 -15.639
    7   HG22  VAL   8          HG21      VAL   8  -0.925  -3.810 -17.024
    8   HG21  VAL   8          HG22      VAL   8  -1.815  -2.335 -17.391
    9   HG23  VAL   8          HG23      VAL   8  -1.213  -2.614 -15.761

  No H/Q in entry =           9
  In of MODEL   35
    1    H    MET   9           H        MET   9   1.704  -0.483 -19.424
    2    HA   MET   9           HA       MET   9   4.005   0.514 -18.152
    3    HB2  MET   9           HB2      MET   9   3.070   0.565 -21.019
    4    HB3  MET   9           HB3      MET   9   4.598   1.296 -20.535
    5    HG2  MET   9           HG2      MET   9   5.310  -0.865 -19.553
    6    HG3  MET   9           HG3      MET   9   3.792  -1.593 -20.085
    7    HE3  MET   9           HE1      MET   9   7.219   0.060 -22.586
    8    HE2  MET   9           HE2      MET   9   7.539  -1.020 -21.231
    9    HE1  MET   9           HE3      MET   9   6.698   0.502 -20.956

  No H/Q in entry =           9
  In of MODEL   35
    1    H    GLY  10           H        GLY  10   1.360   2.170 -19.839
    2    HA3  GLY  10           HA2      GLY  10   2.375   4.804 -19.587
    3    HA2  GLY  10           HA3      GLY  10   0.678   4.378 -19.800

  No H/Q in entry =           3
  In of MODEL   35
    1    H    LEU  11           H        LEU  11   0.238   2.857 -17.517
    2    HA   LEU  11           HA       LEU  11  -0.260   4.842 -15.558
    3    HB2  LEU  11           HB2      LEU  11  -0.255   1.825 -15.405
    4    HB3  LEU  11           HB3      LEU  11  -0.749   2.857 -14.063
    5    HG   LEU  11           HG       LEU  11  -1.973   2.998 -16.832
    6   HD13  LEU  11          HD11      LEU  11  -2.603   0.867 -16.081
    7   HD12  LEU  11          HD12      LEU  11  -3.936   1.885 -15.540
    8   HD11  LEU  11          HD13      LEU  11  -2.694   1.378 -14.396
    9   HD22  LEU  11          HD21      LEU  11  -2.527   5.025 -15.825
   10   HD21  LEU  11          HD22      LEU  11  -2.472   4.355 -14.195
   11   HD23  LEU  11          HD23      LEU  11  -3.851   4.019 -15.243

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  12           H        ILE  12   2.233   2.324 -15.793
    2    HA   ILE  12           HA       ILE  12   3.439   2.834 -13.284
    3    HB   ILE  12           HB       ILE  12   4.684   1.772 -15.842
    4   HG12  ILE  12          HG12      ILE  12   2.637   0.585 -14.703
    5   HG13  ILE  12          HG13      ILE  12   4.014  -0.379 -15.200
    6   HG22  ILE  12          HG21      ILE  12   6.335   0.715 -14.261
    7   HG21  ILE  12          HG22      ILE  12   5.640   1.685 -12.961
    8   HG23  ILE  12          HG23      ILE  12   6.436   2.473 -14.322
    9   HD11  ILE  12          HD11      ILE  12   3.596   0.717 -12.407
   10   HD13  ILE  12          HD12      ILE  12   4.839  -0.421 -12.920
   11   HD12  ILE  12          HD13      ILE  12   3.159  -0.907 -12.907

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  13           H        ILE  13   4.079   4.089 -16.537
    2    HA   ILE  13           HA       ILE  13   6.248   5.764 -15.802
    3    HB   ILE  13           HB       ILE  13   4.229   5.884 -18.055
    4   HG12  ILE  13          HG12      ILE  13   6.032   4.014 -17.773
    5   HG13  ILE  13          HG13      ILE  13   5.812   4.764 -19.350
    6   HG22  ILE  13          HG21      ILE  13   6.036   7.424 -19.110
    7   HG21  ILE  13          HG22      ILE  13   6.571   7.701 -17.457
    8   HG23  ILE  13          HG23      ILE  13   4.930   8.136 -17.935
    9   HD13  ILE  13          HD11      ILE  13   7.757   6.190 -19.011
   10   HD12  ILE  13          HD12      ILE  13   8.221   4.533 -18.642
   11   HD11  ILE  13          HD13      ILE  13   7.890   5.662 -17.335

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ASN  14           H        ASN  14   2.753   6.331 -16.082
    2    HA   ASN  14           HA       ASN  14   2.765   9.076 -15.442
    3    HB2  ASN  14           HB2      ASN  14   0.841   7.475 -16.282
    4    HB3  ASN  14           HB3      ASN  14   0.510   7.301 -14.563
    5   HD21  ASN  14          HD21      ASN  14  -1.480   8.500 -16.001
    6   HD22  ASN  14          HD22      ASN  14  -1.509  10.173 -15.732

  No H/Q in entry =           6
  In of MODEL   35
    1    H    SER  15           H        SER  15   2.403   6.204 -13.370
    2    HA   SER  15           HA       SER  15   2.115   7.577 -10.921
    3    HB2  SER  15           HB2      SER  15   2.619   5.479  -9.872
    4    HB3  SER  15           HB3      SER  15   1.785   5.079 -11.369
    5    HG   SER  15           HG       SER  15   4.584   5.097 -10.911

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLY  16           H        GLY  16   4.974   6.424 -12.671
    2    HA3  GLY  16           HA2      GLY  16   6.907   7.140 -10.732
    3    HA2  GLY  16           HA3      GLY  16   7.213   6.933 -12.455

  No H/Q in entry =           3
  In of MODEL   35
    1    H    GLN  17           H        GLN  17   5.567   8.925 -13.521
    2    HA   GLN  17           HA       GLN  17   7.189  11.235 -13.205
    3    HB2  GLN  17           HB2      GLN  17   5.850  10.764 -15.248
    4    HB3  GLN  17           HB3      GLN  17   4.375  11.056 -14.325
    5    HG2  GLN  17           HG2      GLN  17   4.960  13.083 -15.537
    6    HG3  GLN  17           HG3      GLN  17   5.199  13.355 -13.812
    7   HE21  GLN  17          HE21      GLN  17   6.946  14.841 -13.858
    8   HE22  GLN  17          HE22      GLN  17   8.447  14.495 -14.572

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ALA  18           H        ALA  18   4.064  10.277 -11.869
    2    HA   ALA  18           HA       ALA  18   3.381  12.678 -10.603
    3    HB1  ALA  18           HB1      ALA  18   2.205  10.243 -10.832
    4    HB2  ALA  18           HB2      ALA  18   1.676  11.473  -9.686
    5    HB3  ALA  18           HB3      ALA  18   2.739  10.169  -9.153

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ARG  19           H        ARG  19   5.196   9.878  -9.320
    2    HA   ARG  19           HA       ARG  19   5.741  11.022  -6.794
    3    HB2  ARG  19           HB2      ARG  19   6.111   8.612  -7.323
    4    HB3  ARG  19           HB3      ARG  19   7.480   9.074  -8.338
    5    HG2  ARG  19           HG2      ARG  19   8.612  10.090  -6.410
    6    HG3  ARG  19           HG3      ARG  19   7.225   9.727  -5.384
    7    HD2  ARG  19           HD2      ARG  19   8.955   8.058  -5.022
    8    HD3  ARG  19           HD3      ARG  19   7.569   7.303  -5.814
    9    HE   ARG  19           HE       ARG  19   9.296   8.091  -7.853
   10   HH21  ARG  19          HH11      ARG  19  10.833   6.658  -8.699
   11   HH22  ARG  19          HH12      ARG  19  11.349   5.299  -7.763
   12   HH11  ARG  19          HH21      ARG  19   9.319   6.057  -5.077
   13   HH12  ARG  19          HH22      ARG  19  10.489   4.958  -5.711

  No H/Q in entry =          13
  In of MODEL   35
    1    H    SER  20           H        SER  20   7.571  11.021  -9.836
    2    HA   SER  20           HA       SER  20   9.838  12.393  -9.002
    3    HB2  SER  20           HB2      SER  20   9.868  11.522 -11.206
    4    HB3  SER  20           HB3      SER  20   8.379  12.357 -11.638
    5    HG   SER  20           HG       SER  20  10.887  13.544 -11.024

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU  21           H        LEU  21   6.768  13.721 -10.210
    2    HA   LEU  21           HA       LEU  21   7.488  16.453  -9.980
    3    HB2  LEU  21           HB2      LEU  21   4.794  15.079  -9.911
    4    HB3  LEU  21           HB3      LEU  21   4.992  16.829  -9.913
    5    HG   LEU  21           HG       LEU  21   6.168  15.018 -12.041
    6   HD13  LEU  21          HD11      LEU  21   4.286  15.649 -13.452
    7   HD12  LEU  21          HD12      LEU  21   3.626  16.666 -12.171
    8   HD11  LEU  21          HD13      LEU  21   3.670  14.915 -11.971
    9   HD21  LEU  21          HD21      LEU  21   5.990  17.990 -11.606
   10   HD23  LEU  21          HD22      LEU  21   5.961  17.387 -13.260
   11   HD22  LEU  21          HD23      LEU  21   7.341  17.048 -12.229

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ALA  22           H        ALA  22   5.926  14.189  -7.740
    2    HA   ALA  22           HA       ALA  22   5.347  16.005  -5.673
    3    HB3  ALA  22           HB1      ALA  22   4.544  13.627  -5.842
    4    HB2  ALA  22           HB2      ALA  22   5.135  14.087  -4.244
    5    HB1  ALA  22           HB3      ALA  22   6.145  13.112  -5.313

  No H/Q in entry =           5
  In of MODEL   35
    1    H    TYR  23           H        TYR  23   8.247  13.929  -6.103
    2    HA   TYR  23           HA       TYR  23   9.639  14.921  -3.844
    3    HB2  TYR  23           HB2      TYR  23  10.394  12.901  -5.002
    4    HB3  TYR  23           HB3      TYR  23  10.731  13.836  -6.458
    5    HD1  TYR  23           HD1      TYR  23  11.680  13.453  -2.870
    6    HD2  TYR  23           HD2      TYR  23  12.780  14.994  -6.727
    7    HE1  TYR  23           HE1      TYR  23  13.944  13.989  -2.011
    8    HE2  TYR  23           HE2      TYR  23  15.043  15.531  -5.867
    9    HH   TYR  23           HH       TYR  23  15.892  16.000  -3.093

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ALA  24           H        ALA  24   9.488  16.034  -7.210
    2    HA   ALA  24           HA       ALA  24  11.418  18.087  -6.954
    3    HB2  ALA  24           HB1      ALA  24  10.985  18.158  -9.164
    4    HB3  ALA  24           HB2      ALA  24   9.441  18.934  -8.810
    5    HB1  ALA  24           HB3      ALA  24   9.537  17.179  -8.941

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA  25           H        ALA  25   7.934  17.960  -6.346
    2    HA   ALA  25           HA       ALA  25   7.498  20.685  -5.776
    3    HB1  ALA  25           HB1      ALA  25   5.804  18.715  -5.985
    4    HB2  ALA  25           HB2      ALA  25   5.453  20.008  -4.837
    5    HB3  ALA  25           HB3      ALA  25   6.115  18.476  -4.265

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU  26           H        LEU  26   8.514  17.986  -3.725
    2    HA   LEU  26           HA       LEU  26   8.633  19.413  -1.286
    3    HB2  LEU  26           HB2      LEU  26   8.689  16.996  -1.282
    4    HB3  LEU  26           HB3      LEU  26  10.162  16.980  -2.248
    5    HG   LEU  26           HG       LEU  26  11.388  18.077  -0.402
    6   HD12  LEU  26          HD11      LEU  26  10.154  18.102   1.853
    7   HD11  LEU  26          HD12      LEU  26   8.668  17.989   0.913
    8   HD13  LEU  26          HD13      LEU  26   9.736  19.379   0.709
    9   HD21  LEU  26          HD21      LEU  26   9.812  15.633   0.463
   10   HD23  LEU  26          HD22      LEU  26  11.334  16.171   1.167
   11   HD22  LEU  26          HD23      LEU  26  11.286  15.614  -0.504

  No H/Q in entry =          11
  In of MODEL   35
    1    H    LYS  27           H        LYS  27  11.050  18.804  -3.802
    2    HA   LYS  27           HA       LYS  27  13.248  20.009  -2.565
    3    HB2  LYS  27           HB2      LYS  27  13.336  18.663  -4.656
    4    HB3  LYS  27           HB3      LYS  27  12.596  20.007  -5.523
    5    HG2  LYS  27           HG2      LYS  27  14.482  21.463  -4.937
    6    HG3  LYS  27           HG3      LYS  27  15.218  20.158  -3.999
    7    HD2  LYS  27           HD2      LYS  27  15.348  18.770  -6.053
    8    HD3  LYS  27           HD3      LYS  27  14.657  20.100  -6.983
    9    HE2  LYS  27           HE2      LYS  27  16.565  21.536  -6.362
   10    HE3  LYS  27           HE3      LYS  27  17.259  20.210  -5.423
   11    HZ3  LYS  27           HZ1      LYS  27  18.259  20.296  -7.606
   12    HZ2  LYS  27           HZ2      LYS  27  16.734  20.202  -8.352
   13    HZ1  LYS  27           HZ3      LYS  27  17.333  18.881  -7.467

  No H/Q in entry =          13
  In of MODEL   35
    1    H    GLN  28           H        GLN  28  10.655  21.433  -4.522
    2    HA   GLN  28           HA       GLN  28  11.656  24.071  -4.670
    3    HB2  GLN  28           HB2      GLN  28   8.809  23.035  -4.575
    4    HB3  GLN  28           HB3      GLN  28   9.239  24.708  -4.931
    5    HG2  GLN  28           HG2      GLN  28  10.238  22.309  -6.494
    6    HG3  GLN  28           HG3      GLN  28   8.895  23.335  -6.992
    7   HE21  GLN  28          HE21      GLN  28  12.031  22.873  -7.737
    8   HE22  GLN  28          HE22      GLN  28  12.505  24.465  -8.091

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ALA  29           H        ALA  29   9.689  22.406  -2.242
    2    HA   ALA  29           HA       ALA  29   9.167  24.605  -0.560
    3    HB2  ALA  29           HB1      ALA  29   8.409  23.047   1.004
    4    HB1  ALA  29           HB2      ALA  29   9.614  21.844   0.543
    5    HB3  ALA  29           HB3      ALA  29   8.236  22.160  -0.511

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LYS  30           H        LYS  30  11.863  22.297  -0.622
    2    HA   LYS  30           HA       LYS  30  13.187  23.229   1.687
    3    HB2  LYS  30           HB2      LYS  30  14.273  21.929  -0.821
    4    HB3  LYS  30           HB3      LYS  30  15.255  22.272   0.605
    5    HG2  LYS  30           HG2      LYS  30  13.677  20.911   1.978
    6    HG3  LYS  30           HG3      LYS  30  12.791  20.504   0.504
    7    HD2  LYS  30           HD2      LYS  30  14.824  19.488  -0.450
    8    HD3  LYS  30           HD3      LYS  30  15.729  19.909   1.005
    9    HE2  LYS  30           HE2      LYS  30  14.198  18.499   2.353
   10    HE3  LYS  30           HE3      LYS  30  13.322  18.058   0.882
   11    HZ2  LYS  30           HZ1      LYS  30  15.087  16.453   1.648
   12    HZ1  LYS  30           HZ2      LYS  30  16.244  17.623   1.201
   13    HZ3  LYS  30           HZ3      LYS  30  15.202  16.956   0.032

  No H/Q in entry =          13
  In of MODEL   35
    1    H    GLN  31           H        GLN  31  13.108  24.438  -1.609
    2    HA   GLN  31           HA       GLN  31  15.287  26.298  -1.178
    3    HB2  GLN  31           HB2      GLN  31  13.253  26.378  -3.410
    4    HB3  GLN  31           HB3      GLN  31  14.883  27.049  -3.405
    5    HG2  GLN  31           HG2      GLN  31  15.303  24.346  -2.830
    6    HG3  GLN  31           HG3      GLN  31  14.003  24.312  -4.013
    7   HE21  GLN  31          HE21      GLN  31  16.835  23.477  -4.408
    8   HE22  GLN  31          HE22      GLN  31  17.426  24.443  -5.671

  No H/Q in entry =           8
  In of MODEL   35
    1    H    GLY  32           H        GLY  32  12.206  26.161  -0.044
    2    HA3  GLY  32           HA2      GLY  32  11.069  27.745   1.226
    3    HA2  GLY  32           HA3      GLY  32  12.215  28.964   0.681

  No H/Q in entry =           3
  In of MODEL   35
    1    H    ASP  33           H        ASP  33  10.831  27.083  -1.818
    2    HA   ASP  33           HA       ASP  33   9.204  29.381  -2.677
    3    HB2  ASP  33           HB2      ASP  33  10.266  26.947  -4.117
    4    HB3  ASP  33           HB3      ASP  33   9.134  28.080  -4.851

  No H/Q in entry =           4
  In of MODEL   35
    1    H    PHE  34           H        PHE  34   7.503  28.929  -1.120
    2    HA   PHE  34           HA       PHE  34   6.086  26.478  -1.031
    3    HB2  PHE  34           HB2      PHE  34   5.165  29.278  -0.352
    4    HB3  PHE  34           HB3      PHE  34   4.292  27.800   0.055
    5    HD1  PHE  34           HD1      PHE  34   6.573  30.164   1.279
    6    HD2  PHE  34           HD2      PHE  34   5.830  25.934   1.220
    7    HE1  PHE  34           HE1      PHE  34   7.953  29.891   3.320
    8    HE2  PHE  34           HE2      PHE  34   7.212  25.665   3.259
    9    HZ   PHE  34           HZ       PHE  34   8.267  27.645   4.309

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ALA  35           H        ALA  35   5.706  29.349  -3.041
    2    HA   ALA  35           HA       ALA  35   3.149  28.774  -4.076
    3    HB1  ALA  35           HB1      ALA  35   4.229  30.152  -6.108
    4    HB3  ALA  35           HB2      ALA  35   5.447  30.494  -4.880
    5    HB2  ALA  35           HB3      ALA  35   3.762  30.928  -4.595

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA  36           H        ALA  36   6.372  28.054  -5.419
    2    HA   ALA  36           HA       ALA  36   5.370  26.641  -7.667
    3    HB3  ALA  36           HB1      ALA  36   7.533  26.734  -8.275
    4    HB2  ALA  36           HB2      ALA  36   7.994  25.697  -6.924
    5    HB1  ALA  36           HB3      ALA  36   7.914  27.446  -6.708

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA  37           H        ALA  37   6.300  25.630  -4.410
    2    HA   ALA  37           HA       ALA  37   6.201  22.844  -4.842
    3    HB2  ALA  37           HB1      ALA  37   5.958  24.636  -2.463
    4    HB1  ALA  37           HB2      ALA  37   7.073  23.302  -2.752
    5    HB3  ALA  37           HB3      ALA  37   5.405  22.973  -2.287

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LYS  38           H        LYS  38   3.697  25.088  -3.681
    2    HA   LYS  38           HA       LYS  38   1.571  23.306  -3.467
    3    HB2  LYS  38           HB2      LYS  38   1.962  26.056  -3.212
    4    HB3  LYS  38           HB3      LYS  38   0.765  25.928  -4.496
    5    HG2  LYS  38           HG2      LYS  38  -0.709  24.624  -3.059
    6    HG3  LYS  38           HG3      LYS  38   0.530  24.545  -1.799
    7    HD2  LYS  38           HD2      LYS  38   0.377  26.884  -1.350
    8    HD3  LYS  38           HD3      LYS  38  -0.526  27.187  -2.835
    9    HE2  LYS  38           HE2      LYS  38  -2.035  27.242  -0.901
   10    HE3  LYS  38           HE3      LYS  38  -2.426  25.872  -1.946
   11    HZ3  LYS  38           HZ1      LYS  38  -1.727  24.390  -0.411
   12    HZ2  LYS  38           HZ2      LYS  38  -2.063  25.651   0.678
   13    HZ1  LYS  38           HZ3      LYS  38  -0.471  25.377   0.158

  No H/Q in entry =          13
  In of MODEL   35
    1    H    ALA  39           H        ALA  39   2.588  25.196  -6.311
    2    HA   ALA  39           HA       ALA  39   0.506  24.360  -8.022
    3    HB2  ALA  39           HB1      ALA  39   3.255  24.969  -9.065
    4    HB1  ALA  39           HB2      ALA  39   2.305  26.244  -8.302
    5    HB3  ALA  39           HB3      ALA  39   1.685  25.417  -9.731

  No H/Q in entry =           5
  In of MODEL   35
    1    H    MET  40           H        MET  40   3.723  23.014  -7.432
    2    HA   MET  40           HA       MET  40   3.602  20.997  -9.425
    3    HB2  MET  40           HB2      MET  40   5.208  21.195  -6.871
    4    HB3  MET  40           HB3      MET  40   5.445  19.936  -8.086
    5    HG2  MET  40           HG2      MET  40   5.548  22.892  -8.748
    6    HG3  MET  40           HG3      MET  40   6.979  21.968  -8.295
    7    HE3  MET  40           HE1      MET  40   7.829  19.742 -11.102
    8    HE2  MET  40           HE2      MET  40   7.255  19.430  -9.467
    9    HE1  MET  40           HE3      MET  40   8.371  20.761  -9.761

  No H/Q in entry =           9
  In of MODEL   35
    1    H    MET  41           H        MET  41   2.676  21.050  -6.005
    2    HA   MET  41           HA       MET  41   2.102  18.293  -5.731
    3    HB2  MET  41           HB2      MET  41   0.799  20.668  -4.383
    4    HB3  MET  41           HB3      MET  41   0.617  18.992  -3.877
    5    HG2  MET  41           HG2      MET  41   3.331  19.176  -3.904
    6    HG3  MET  41           HG3      MET  41   2.913  20.840  -3.509
    7    HE2  MET  41           HE1      MET  41  -0.151  19.630  -1.795
    8    HE1  MET  41           HE2      MET  41   0.689  21.132  -2.168
    9    HE3  MET  41           HE3      MET  41   0.616  20.561  -0.501

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ASP  42           H        ASP  42   0.107  21.047  -6.710
    2    HA   ASP  42           HA       ASP  42  -2.352  19.721  -6.856
    3    HB2  ASP  42           HB2      ASP  42  -1.608  22.282  -7.108
    4    HB3  ASP  42           HB3      ASP  42  -1.759  21.890  -8.818

  No H/Q in entry =           4
  In of MODEL   35
    1    H    GLN  43           H        GLN  43   0.105  20.280  -9.349
    2    HA   GLN  43           HA       GLN  43  -1.293  18.982 -11.445
    3    HB2  GLN  43           HB2      GLN  43   1.671  19.456 -11.052
    4    HB3  GLN  43           HB3      GLN  43   0.954  18.827 -12.537
    5    HG2  GLN  43           HG2      GLN  43  -0.529  20.875 -12.582
    6    HG3  GLN  43           HG3      GLN  43   0.429  21.517 -11.251
    7   HE21  GLN  43          HE21      GLN  43   0.620  23.136 -13.335
    8   HE22  GLN  43          HE22      GLN  43   2.035  22.896 -14.237

  No H/Q in entry =           8
  In of MODEL   35
    1    H    SER  44           H        SER  44   1.033  17.807  -9.046
    2    HA   SER  44           HA       SER  44   1.335  15.196 -10.073
    3    HB2  SER  44           HB2      SER  44   2.242  16.621  -7.832
    4    HB3  SER  44           HB3      SER  44   1.358  15.249  -7.165
    5    HG   SER  44           HG       SER  44   3.461  14.600  -7.585

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ARG  45           H        ARG  45  -0.975  16.545  -7.742
    2    HA   ARG  45           HA       ARG  45  -2.396  14.203  -7.114
    3    HB2  ARG  45           HB2      ARG  45  -2.569  16.373  -5.921
    4    HB3  ARG  45           HB3      ARG  45  -3.410  17.053  -7.310
    5    HG2  ARG  45           HG2      ARG  45  -5.201  15.351  -7.035
    6    HG3  ARG  45           HG3      ARG  45  -4.371  14.727  -5.609
    7    HD2  ARG  45           HD2      ARG  45  -4.550  16.995  -4.552
    8    HD3  ARG  45           HD3      ARG  45  -5.524  17.530  -5.938
    9    HE   ARG  45           HE       ARG  45  -6.671  15.168  -4.904
   10   HH21  ARG  45          HH11      ARG  45  -8.510  15.268  -3.639
   11   HH22  ARG  45          HH12      ARG  45  -8.888  16.712  -2.771
   12   HH11  ARG  45          HH21      ARG  45  -6.084  18.406  -3.875
   13   HH12  ARG  45          HH22      ARG  45  -7.510  18.490  -2.902

  No H/Q in entry =          13
  In of MODEL   35
    1    H    MET  46           H        MET  46  -2.938  16.617  -9.664
    2    HA   MET  46           HA       MET  46  -5.289  15.478 -10.736
    3    HB2  MET  46           HB2      MET  46  -3.157  17.268 -11.914
    4    HB3  MET  46           HB3      MET  46  -4.559  16.743 -12.851
    5    HG2  MET  46           HG2      MET  46  -6.064  17.694 -11.157
    6    HG3  MET  46           HG3      MET  46  -4.683  18.192 -10.187
    7    HE3  MET  46           HE1      MET  46  -5.884  21.629 -11.404
    8    HE2  MET  46           HE2      MET  46  -5.114  20.762 -10.079
    9    HE1  MET  46           HE3      MET  46  -6.691  20.238 -10.667

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ALA  47           H        ALA  47  -1.864  14.953 -11.482
    2    HA   ALA  47           HA       ALA  47  -2.225  13.232 -13.695
    3    HB3  ALA  47           HB1      ALA  47  -0.037  14.092 -13.334
    4    HB2  ALA  47           HB2      ALA  47   0.080  12.362 -13.001
    5    HB1  ALA  47           HB3      ALA  47  -0.002  13.514 -11.667

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU  48           H        LEU  48  -1.977  12.590 -10.220
    2    HA   LEU  48           HA       LEU  48  -2.108   9.752 -10.381
    3    HB2  LEU  48           HB2      LEU  48  -2.855  11.678  -8.169
    4    HB3  LEU  48           HB3      LEU  48  -2.785   9.926  -7.969
    5    HG   LEU  48           HG       LEU  48  -0.460  11.596  -8.957
    6   HD13  LEU  48          HD11      LEU  48  -0.740  12.368  -6.766
    7   HD12  LEU  48          HD12      LEU  48   0.405  11.045  -6.565
    8   HD11  LEU  48          HD13      LEU  48  -1.298  10.804  -6.173
    9   HD22  LEU  48          HD21      LEU  48   0.012   9.404  -9.597
   10   HD21  LEU  48          HD22      LEU  48  -0.872   8.699  -8.245
   11   HD23  LEU  48          HD23      LEU  48   0.710   9.432  -7.978

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ASN  49           H        ASN  49  -4.540  12.276  -9.987
    2    HA   ASN  49           HA       ASN  49  -6.749  10.640  -9.457
    3    HB2  ASN  49           HB2      ASN  49  -6.788  13.057  -9.125
    4    HB3  ASN  49           HB3      ASN  49  -6.594  13.327 -10.853
    5   HD21  ASN  49          HD21      ASN  49  -8.887  13.571  -8.587
    6   HD22  ASN  49          HD22      ASN  49 -10.261  13.121  -9.472

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLU  50           H        GLU  50  -5.442  11.822 -12.539
    2    HA   GLU  50           HA       GLU  50  -7.407  10.594 -14.193
    3    HB2  GLU  50           HB2      GLU  50  -5.914  12.394 -15.000
    4    HB3  GLU  50           HB3      GLU  50  -4.535  11.304 -14.857
    5    HG2  GLU  50           HG2      GLU  50  -5.522   9.782 -16.499
    6    HG3  GLU  50           HG3      GLU  50  -6.969  10.780 -16.591

  No H/Q in entry =           6
  In of MODEL   35
    1    H    ALA  51           H        ALA  51  -4.254   9.559 -12.976
    2    HA   ALA  51           HA       ALA  51  -4.142   7.105 -14.395
    3    HB2  ALA  51           HB1      ALA  51  -2.169   6.790 -13.288
    4    HB1  ALA  51           HB2      ALA  51  -2.857   7.221 -11.722
    5    HB3  ALA  51           HB3      ALA  51  -2.381   8.486 -12.854

  No H/Q in entry =           5
  In of MODEL   35
    1    H    HIS  52           H        HIS  52  -5.316   7.951 -11.150
    2    HA   HIS  52           HA       HIS  52  -6.039   5.349 -10.323
    3    HB2  HIS  52           HB2      HIS  52  -5.879   7.314  -8.814
    4    HB3  HIS  52           HB3      HIS  52  -7.332   7.978  -9.562
    5    HD1  HIS  52           HD1      HIS  52  -9.583   6.667  -9.171
    6    HD2  HIS  52           HD2      HIS  52  -6.343   5.220  -6.984
    7    HE1  HIS  52           HE1      HIS  52 -10.542   5.131  -7.400
    8    HE2  HIS  52           HE2      HIS  52  -8.580   4.241  -6.058

  No H/Q in entry =           8
  In of MODEL   35
    1    H    LEU  53           H        LEU  53  -7.819   7.833 -12.117
    2    HA   LEU  53           HA       LEU  53 -10.342   6.575 -12.140
    3    HB2  LEU  53           HB2      LEU  53  -9.024   8.540 -14.002
    4    HB3  LEU  53           HB3      LEU  53 -10.629   7.896 -14.333
    5    HG   LEU  53           HG       LEU  53  -9.902   9.211 -11.695
    6   HD12  LEU  53          HD11      LEU  53 -11.043  11.222 -12.572
    7   HD11  LEU  53          HD12      LEU  53 -11.225  10.428 -14.138
    8   HD13  LEU  53          HD13      LEU  53  -9.622  10.830 -13.533
    9   HD22  LEU  53          HD21      LEU  53 -11.906   8.023 -11.352
   10   HD21  LEU  53          HD22      LEU  53 -12.447   8.276 -13.007
   11   HD23  LEU  53          HD23      LEU  53 -12.517   9.595 -11.854

  No H/Q in entry =          11
  In of MODEL   35
    1    H    VAL  54           H        VAL  54  -7.586   6.342 -14.366
    2    HA   VAL  54           HA       VAL  54  -8.825   4.589 -16.216
    3    HB   VAL  54           HB       VAL  54  -5.913   5.055 -15.521
    4   HG12  VAL  54          HG11      VAL  54  -5.672   3.968 -17.910
    5   HG11  VAL  54          HG12      VAL  54  -7.212   3.208 -17.513
    6   HG13  VAL  54          HG13      VAL  54  -5.805   2.933 -16.489
    7   HG22  VAL  54          HG21      VAL  54  -6.652   7.009 -16.568
    8   HG21  VAL  54          HG22      VAL  54  -7.853   6.163 -17.541
    9   HG23  VAL  54          HG23      VAL  54  -6.146   6.060 -17.965

  No H/Q in entry =           9
  In of MODEL   35
    1    H    GLN  55           H        GLN  55  -6.846   4.013 -13.308
    2    HA   GLN  55           HA       GLN  55  -6.794   1.196 -13.567
    3    HB2  GLN  55           HB2      GLN  55  -5.233   2.068 -12.041
    4    HB3  GLN  55           HB3      GLN  55  -6.439   3.051 -11.215
    5    HG2  GLN  55           HG2      GLN  55  -7.157   1.303  -9.902
    6    HG3  GLN  55           HG3      GLN  55  -6.944   0.114 -11.180
    7   HE21  GLN  55          HE21      GLN  55  -5.343  -1.359 -10.680
    8   HE22  GLN  55          HE22      GLN  55  -3.958  -1.028  -9.762

  No H/Q in entry =           8
  In of MODEL   35
    1    H    THR  56           H        THR  56  -9.102   3.390 -11.960
    2    HA   THR  56           HA       THR  56 -10.718   1.528 -10.679
    3    HB   THR  56           HB       THR  56 -11.772   3.933 -12.187
    4    HG1  THR  56           HG1      THR  56 -10.395   3.698  -9.736
    5   HG21  THR  56          HG21      THR  56 -13.358   2.252 -11.117
    6   HG23  THR  56          HG22      THR  56 -13.525   3.919 -10.565
    7   HG22  THR  56          HG23      THR  56 -12.680   2.738  -9.564

  No H/Q in entry =           7
  In of MODEL   35
    1    H    LYS  57           H        LYS  57 -10.890   2.616 -14.065
    2    HA   LYS  57           HA       LYS  57 -13.067   0.960 -14.829
    3    HB2  LYS  57           HB2      LYS  57 -12.153   2.901 -16.139
    4    HB3  LYS  57           HB3      LYS  57 -10.730   1.936 -16.506
    5    HG2  LYS  57           HG2      LYS  57 -12.105   0.292 -17.681
    6    HG3  LYS  57           HG3      LYS  57 -13.567   1.176 -17.259
    7    HD2  LYS  57           HD2      LYS  57 -12.744   3.132 -18.546
    8    HD3  LYS  57           HD3      LYS  57 -11.305   2.220 -18.998
    9    HE2  LYS  57           HE2      LYS  57 -14.142   1.329 -19.627
   10    HE3  LYS  57           HE3      LYS  57 -13.111   2.188 -20.770
   11    HZ2  LYS  57           HZ1      LYS  57 -13.202  -0.511 -20.380
   12    HZ1  LYS  57           HZ2      LYS  57 -11.775  -0.035 -19.588
   13    HZ3  LYS  57           HZ3      LYS  57 -12.006   0.340 -21.229

  No H/Q in entry =          13
  In of MODEL   35
    1    H    LEU  58           H        LEU  58  -9.569   0.479 -14.757
    2    HA   LEU  58           HA       LEU  58  -9.608  -2.037 -16.047
    3    HB2  LEU  58           HB2      LEU  58  -7.563  -0.775 -14.229
    4    HB3  LEU  58           HB3      LEU  58  -7.320  -2.300 -15.083
    5    HG   LEU  58           HG       LEU  58  -8.031   0.316 -16.448
    6   HD11  LEU  58          HD11      LEU  58  -5.405  -0.959 -15.747
    7   HD13  LEU  58          HD12      LEU  58  -5.876   0.739 -15.699
    8   HD12  LEU  58          HD13      LEU  58  -5.541  -0.036 -17.244
    9   HD22  LEU  58          HD21      LEU  58  -8.622  -1.237 -18.043
   10   HD21  LEU  58          HD22      LEU  58  -7.602  -2.500 -17.357
   11   HD23  LEU  58          HD23      LEU  58  -6.888  -1.236 -18.359

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  59           H        ILE  59 -10.430  -1.124 -12.799
    2    HA   ILE  59           HA       ILE  59 -10.123  -3.896 -11.851
    3    HB   ILE  59           HB       ILE  59  -9.659  -1.630 -10.451
    4   HG12  ILE  59          HG12      ILE  59 -11.041  -3.976  -9.134
    5   HG13  ILE  59          HG13      ILE  59  -9.397  -4.061  -9.716
    6   HG22  ILE  59          HG21      ILE  59 -12.424  -2.337  -9.512
    7   HG21  ILE  59          HG22      ILE  59 -12.195  -1.095 -10.722
    8   HG23  ILE  59          HG23      ILE  59 -11.474  -0.922  -9.124
    9   HD12  ILE  59          HD11      ILE  59  -9.528  -3.466  -7.309
   10   HD11  ILE  59          HD12      ILE  59 -10.391  -2.000  -7.751
   11   HD13  ILE  59          HD13      ILE  59  -8.720  -2.229  -8.266

  No H/Q in entry =          11
  In of MODEL   35
    1    H    GLU  60           H        GLU  60 -12.644  -1.545 -12.670
    2    HA   GLU  60           HA       GLU  60 -14.854  -3.031 -11.667
    3    HB2  GLU  60           HB2      GLU  60 -15.065  -0.669 -12.246
    4    HB3  GLU  60           HB3      GLU  60 -14.682  -1.019 -13.928
    5    HG2  GLU  60           HG2      GLU  60 -16.717  -2.446 -14.070
    6    HG3  GLU  60           HG3      GLU  60 -17.118  -2.002 -12.424

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLY  61           H        GLY  61 -13.167  -3.038 -14.775
    2    HA3  GLY  61           HA2      GLY  61 -14.907  -5.258 -15.673
    3    HA2  GLY  61           HA3      GLY  61 -14.042  -4.165 -16.747

  No H/Q in entry =           3
  In of MODEL   35
    1    H    ASP  62           H        ASP  62 -12.700  -5.633 -13.857
    2    HA   ASP  62           HA       ASP  62 -10.465  -6.659 -15.338
    3    HB2  ASP  62           HB2      ASP  62  -9.709  -7.428 -13.105
    4    HB3  ASP  62           HB3      ASP  62 -10.170  -5.729 -13.103

  No H/Q in entry =           4
  In of MODEL   35
    1    H    ALA  63           H        ALA  63 -12.108  -8.052 -16.710
    2    HA   ALA  63           HA       ALA  63 -13.208 -10.445 -15.609
    3    HB1  ALA  63           HB1      ALA  63 -13.843  -9.460 -17.821
    4    HB2  ALA  63           HB2      ALA  63 -13.391 -11.159 -17.953
    5    HB3  ALA  63           HB3      ALA  63 -12.253  -9.901 -18.443

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLY  64           H        GLY  64 -10.103  -9.619 -17.028
    2    HA3  GLY  64           HA2      GLY  64  -8.035 -10.623 -16.694
    3    HA2  GLY  64           HA3      GLY  64  -8.827 -11.909 -15.794

  No H/Q in entry =           3
  In of MODEL   35
    1    H    GLU  65           H        GLU  65  -6.922 -12.765 -17.435
    2    HA   GLU  65           HA       GLU  65  -7.679 -13.193 -20.121
    3    HB2  GLU  65           HB2      GLU  65  -5.732 -14.664 -18.349
    4    HB3  GLU  65           HB3      GLU  65  -5.924 -14.987 -20.072
    5    HG2  GLU  65           HG2      GLU  65  -5.350 -12.679 -20.612
    6    HG3  GLU  65           HG3      GLU  65  -5.259 -12.275 -18.899

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLY  66           H        GLY  66  -8.077 -15.126 -17.246
    2    HA3  GLY  66           HA2      GLY  66  -9.620 -17.159 -18.699
    3    HA2  GLY  66           HA3      GLY  66  -8.884 -17.369 -17.123

  No H/Q in entry =           3
  In of MODEL   35
    1    H    LYS  67           H        LYS  67 -11.389 -18.194 -17.417
    2    HA   LYS  67           HA       LYS  67 -13.600 -16.741 -17.242
    3    HB2  LYS  67           HB2      LYS  67 -14.288 -18.404 -15.327
    4    HB3  LYS  67           HB3      LYS  67 -13.954 -18.996 -16.959
    5    HG2  LYS  67           HG2      LYS  67 -11.665 -19.552 -16.343
    6    HG3  LYS  67           HG3      LYS  67 -11.887 -18.840 -14.746
    7    HD2  LYS  67           HD2      LYS  67 -13.608 -20.536 -14.230
    8    HD3  LYS  67           HD3      LYS  67 -13.373 -21.251 -15.826
    9    HE2  LYS  67           HE2      LYS  67 -11.008 -21.701 -15.288
   10    HE3  LYS  67           HE3      LYS  67 -11.232 -20.980 -13.695
   11    HZ2  LYS  67           HZ1      LYS  67 -11.662 -23.606 -14.399
   12    HZ1  LYS  67           HZ2      LYS  67 -13.213 -22.944 -14.203
   13    HZ3  LYS  67           HZ3      LYS  67 -12.086 -22.862 -12.935

  No H/Q in entry =          13
  In of MODEL   35
    1    H    MET  68           H        MET  68 -13.068 -17.778 -14.062
    2    HA   MET  68           HA       MET  68 -13.992 -15.434 -12.830
    3    HB2  MET  68           HB2      MET  68 -12.601 -17.895 -11.817
    4    HB3  MET  68           HB3      MET  68 -13.067 -16.584 -10.734
    5    HG2  MET  68           HG2      MET  68 -14.979 -17.980 -12.625
    6    HG3  MET  68           HG3      MET  68 -14.801 -18.389 -10.917
    7    HE3  MET  68           HE1      MET  68 -16.179 -15.955  -8.855
    8    HE2  MET  68           HE2      MET  68 -14.689 -15.186  -9.399
    9    HE1  MET  68           HE3      MET  68 -14.746 -16.936  -9.193

  No H/Q in entry =           9
  In of MODEL   35
    1    H    LYS  69           H        LYS  69 -10.630 -16.583 -13.255
    2    HA   LYS  69           HA       LYS  69  -9.274 -14.971 -11.538
    3    HB2  LYS  69           HB2      LYS  69  -8.556 -15.912 -14.303
    4    HB3  LYS  69           HB3      LYS  69  -7.411 -15.008 -13.310
    5    HG2  LYS  69           HG2      LYS  69  -7.608 -16.665 -11.517
    6    HG3  LYS  69           HG3      LYS  69  -8.829 -17.545 -12.435
    7    HD2  LYS  69           HD2      LYS  69  -6.871 -18.747 -12.906
    8    HD3  LYS  69           HD3      LYS  69  -6.995 -17.661 -14.291
    9    HE2  LYS  69           HE2      LYS  69  -5.618 -16.103 -12.508
   10    HE3  LYS  69           HE3      LYS  69  -5.005 -17.707 -12.112
   11    HZ1  LYS  69           HZ1      LYS  69  -5.201 -16.869 -14.926
   12    HZ3  LYS  69           HZ2      LYS  69  -4.159 -18.005 -14.211
   13    HZ2  LYS  69           HZ3      LYS  69  -3.893 -16.342 -13.984

  No H/Q in entry =          13
  In of MODEL   35
    1    H    VAL  70           H        VAL  70  -7.631 -13.161 -12.233
    2    HA   VAL  70           HA       VAL  70  -9.048 -11.018 -13.707
    3    HB   VAL  70           HB       VAL  70  -8.236  -9.428 -11.987
    4   HG11  VAL  70          HG11      VAL  70 -10.507 -10.623 -11.917
    5   HG13  VAL  70          HG12      VAL  70  -9.949  -9.915 -10.401
    6   HG12  VAL  70          HG13      VAL  70  -9.803 -11.651 -10.668
    7   HG23  VAL  70          HG21      VAL  70  -7.617 -10.720  -9.735
    8   HG22  VAL  70          HG22      VAL  70  -6.377 -10.349 -10.932
    9   HG21  VAL  70          HG23      VAL  70  -7.078 -11.965 -10.863

  No H/Q in entry =           9
  In of MODEL   35
    1    H    SER  71           H        SER  71  -7.581  -9.276 -14.387
    2    HA   SER  71           HA       SER  71  -5.301 -10.220 -15.767
    3    HB2  SER  71           HB2      SER  71  -6.667  -8.160 -16.335
    4    HB3  SER  71           HB3      SER  71  -5.865  -7.351 -14.990
    5    HG   SER  71           HG       SER  71  -4.479  -8.672 -17.083

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU  72           H        LEU  72  -3.314 -10.609 -15.066
    2    HA   LEU  72           HA       LEU  72  -2.603 -10.405 -12.351
    3    HB2  LEU  72           HB2      LEU  72  -0.945 -10.858 -14.826
    4    HB3  LEU  72           HB3      LEU  72  -0.291 -10.940 -13.194
    5    HG   LEU  72           HG       LEU  72  -2.662 -12.598 -14.111
    6   HD12  LEU  72          HD11      LEU  72   0.240 -13.444 -13.873
    7   HD11  LEU  72          HD12      LEU  72  -0.574 -13.111 -15.401
    8   HD13  LEU  72          HD13      LEU  72  -1.114 -14.450 -14.389
    9   HD22  LEU  72          HD21      LEU  72  -2.689 -12.615 -11.764
   10   HD21  LEU  72          HD22      LEU  72  -0.942 -12.498 -11.630
   11   HD23  LEU  72          HD23      LEU  72  -1.687 -14.017 -12.120

  No H/Q in entry =          11
  In of MODEL   35
    1    H    VAL  73           H        VAL  73  -1.845  -8.399 -15.128
    2    HA   VAL  73           HA       VAL  73   0.096  -6.729 -14.016
    3    HB   VAL  73           HB       VAL  73  -0.221  -5.345 -15.887
    4   HG11  VAL  73          HG11      VAL  73   0.371  -7.803 -16.315
    5   HG13  VAL  73          HG12      VAL  73  -0.230  -6.891 -17.698
    6   HG12  VAL  73          HG13      VAL  73  -1.299  -8.002 -16.842
    7   HG21  VAL  73          HG21      VAL  73  -3.048  -6.420 -15.871
    8   HG23  VAL  73          HG22      VAL  73  -2.373  -5.557 -17.252
    9   HG22  VAL  73          HG23      VAL  73  -2.526  -4.744 -15.695

  No H/Q in entry =           9
  In of MODEL   35
    1    H    LEU  74           H        LEU  74  -3.305  -6.794 -13.474
    2    HA   LEU  74           HA       LEU  74  -3.886  -4.129 -12.864
    3    HB2  LEU  74           HB2      LEU  74  -5.635  -5.777 -13.048
    4    HB3  LEU  74           HB3      LEU  74  -4.968  -6.699 -11.703
    5    HG   LEU  74           HG       LEU  74  -5.422  -4.810 -10.177
    6   HD13  LEU  74          HD11      LEU  74  -5.255  -2.884 -11.553
    7   HD12  LEU  74          HD12      LEU  74  -6.972  -3.001 -11.174
    8   HD11  LEU  74          HD13      LEU  74  -6.377  -3.538 -12.747
    9   HD23  LEU  74          HD21      LEU  74  -7.977  -5.168 -11.644
   10   HD22  LEU  74          HD22      LEU  74  -7.602  -5.370  -9.947
   11   HD21  LEU  74          HD23      LEU  74  -7.155  -6.620 -11.081

  No H/Q in entry =          11
  In of MODEL   35
    1    H    VAL  75           H        VAL  75  -2.894  -6.731 -10.698
    2    HA   VAL  75           HA       VAL  75  -2.683  -5.183  -8.353
    3    HB   VAL  75           HB       VAL  75  -1.224  -7.701  -9.137
    4   HG11  VAL  75          HG11      VAL  75  -1.411  -6.226  -6.473
    5   HG13  VAL  75          HG12      VAL  75   0.047  -6.508  -7.412
    6   HG12  VAL  75          HG13      VAL  75  -0.786  -7.860  -6.665
    7   HG23  VAL  75          HG21      VAL  75  -2.901  -8.640  -7.478
    8   HG22  VAL  75          HG22      VAL  75  -3.616  -8.027  -8.968
    9   HG21  VAL  75          HG23      VAL  75  -3.696  -7.066  -7.490

  No H/Q in entry =           9
  In of MODEL   35
    1    H    GLU  76           H        GLU  76  -0.274  -5.980 -10.878
    2    HA   GLU  76           HA       GLU  76   1.926  -4.665  -9.711
    3    HB2  GLU  76           HB2      GLU  76   2.118  -6.144 -11.692
    4    HB3  GLU  76           HB3      GLU  76   1.227  -4.975 -12.653
    5    HG2  GLU  76           HG2      GLU  76   3.570  -4.672 -13.138
    6    HG3  GLU  76           HG3      GLU  76   3.065  -3.291 -12.182

  No H/Q in entry =           6
  In of MODEL   35
    1    H    ALA  77           H        ALA  77  -0.577  -3.426 -11.911
    2    HA   ALA  77           HA       ALA  77   0.453  -0.795 -12.082
    3    HB3  ALA  77           HB1      ALA  77  -2.427  -1.713 -12.326
    4    HB1  ALA  77           HB2      ALA  77  -1.245  -1.711 -13.636
    5    HB2  ALA  77           HB3      ALA  77  -1.767  -0.188 -12.919

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLN  78           H        GLN  78  -1.849  -2.316  -9.882
    2    HA   GLN  78           HA       GLN  78  -2.628   0.014  -8.485
    3    HB2  GLN  78           HB2      GLN  78  -3.767  -2.234  -8.408
    4    HB3  GLN  78           HB3      GLN  78  -2.447  -2.805  -7.390
    5    HG2  GLN  78           HG2      GLN  78  -2.959  -1.060  -5.736
    6    HG3  GLN  78           HG3      GLN  78  -4.275  -0.475  -6.753
    7   HE21  GLN  78          HE21      GLN  78  -4.803  -1.426  -4.110
    8   HE22  GLN  78          HE22      GLN  78  -5.681  -2.874  -4.227

  No H/Q in entry =           8
  In of MODEL   35
    1    H    LEU  79           H        LEU  79   0.015  -2.280  -8.022
    2    HA   LEU  79           HA       LEU  79   0.992  -1.398  -5.560
    3    HB2  LEU  79           HB2      LEU  79   1.839  -3.419  -6.623
    4    HB3  LEU  79           HB3      LEU  79   2.505  -2.477  -7.954
    5    HG   LEU  79           HG       LEU  79   4.069  -1.360  -6.443
    6   HD13  LEU  79          HD11      LEU  79   3.058  -1.100  -4.380
    7   HD12  LEU  79          HD12      LEU  79   4.116  -2.465  -4.031
    8   HD11  LEU  79          HD13      LEU  79   2.408  -2.740  -4.369
    9   HD23  LEU  79          HD21      LEU  79   5.245  -3.524  -5.533
   10   HD22  LEU  79          HD22      LEU  79   5.053  -3.323  -7.272
   11   HD21  LEU  79          HD23      LEU  79   3.955  -4.377  -6.385

  No H/Q in entry =          11
  In of MODEL   35
    1    H    HIS  80           H        HIS  80   1.894  -0.293  -8.829
    2    HA   HIS  80           HA       HIS  80   3.725   1.669  -7.898
    3    HB2  HIS  80           HB2      HIS  80   2.439   0.992 -10.487
    4    HB3  HIS  80           HB3      HIS  80   3.055   2.636 -10.313
    5    HD1  HIS  80           HD1      HIS  80   5.463   2.903 -10.823
    6    HD2  HIS  80           HD2      HIS  80   4.584  -0.996  -9.636
    7    HE1  HIS  80           HE1      HIS  80   7.636   1.596 -10.978
    8    HE2  HIS  80           HE2      HIS  80   7.112  -0.783 -10.258

  No H/Q in entry =           8
  In of MODEL   35
    1    H    LEU  81           H        LEU  81   0.328   1.875  -8.894
    2    HA   LEU  81           HA       LEU  81   0.089   4.671  -8.565
    3    HB2  LEU  81           HB2      LEU  81  -1.956   2.453  -8.496
    4    HB3  LEU  81           HB3      LEU  81  -2.386   4.162  -8.406
    5    HG   LEU  81           HG       LEU  81  -0.697   2.989 -10.633
    6   HD12  LEU  81          HD11      LEU  81  -2.918   3.338 -11.944
    7   HD11  LEU  81          HD12      LEU  81  -3.683   3.280 -10.356
    8   HD13  LEU  81          HD13      LEU  81  -2.755   1.900 -10.938
    9   HD23  LEU  81          HD21      LEU  81  -1.760   5.148 -11.736
   10   HD22  LEU  81          HD22      LEU  81  -0.347   5.300 -10.696
   11   HD21  LEU  81          HD23      LEU  81  -1.950   5.669 -10.064

  No H/Q in entry =          11
  In of MODEL   35
    1    H    MET  82           H        MET  82  -0.617   1.993  -6.319
    2    HA   MET  82           HA       MET  82  -1.659   3.593  -4.237
    3    HB2  MET  82           HB2      MET  82  -0.319   0.888  -4.270
    4    HB3  MET  82           HB3      MET  82  -0.896   1.621  -2.775
    5    HG2  MET  82           HG2      MET  82  -2.623   1.150  -5.225
    6    HG3  MET  82           HG3      MET  82  -2.566   0.075  -3.830
    7    HE3  MET  82           HE1      MET  82  -4.281   1.746  -1.023
    8    HE2  MET  82           HE2      MET  82  -2.547   2.002  -1.199
    9    HE1  MET  82           HE3      MET  82  -3.252   0.454  -1.657

  No H/Q in entry =           9
  In of MODEL   35
    1    H    THR  83           H        THR  83   1.631   2.465  -4.910
    2    HA   THR  83           HA       THR  83   2.851   3.554  -2.604
    3    HB   THR  83           HB       THR  83   4.953   3.472  -4.067
    4    HG1  THR  83           HG1      THR  83   4.717   2.948  -6.092
    5   HG22  THR  83          HG21      THR  83   4.477   0.819  -4.401
    6   HG21  THR  83          HG22      THR  83   3.186   1.215  -3.268
    7   HG23  THR  83          HG23      THR  83   4.868   1.537  -2.840

  No H/Q in entry =           7
  In of MODEL   35
    1    H    SER  84           H        SER  84   2.514   4.838  -5.905
    2    HA   SER  84           HA       SER  84   3.882   7.261  -5.443
    3    HB2  SER  84           HB2      SER  84   1.811   6.455  -7.473
    4    HB3  SER  84           HB3      SER  84   2.510   8.073  -7.444
    5    HG   SER  84           HG       SER  84   3.852   5.581  -7.729

  No H/Q in entry =           5
  In of MODEL   35
    1    H    MET  85           H        MET  85   0.377   6.549  -5.289
    2    HA   MET  85           HA       MET  85  -0.454   9.170  -4.692
    3    HB2  MET  85           HB2      MET  85  -1.997   7.383  -5.369
    4    HB3  MET  85           HB3      MET  85  -1.725   6.570  -3.828
    5    HG2  MET  85           HG2      MET  85  -2.607   8.521  -2.622
    6    HG3  MET  85           HG3      MET  85  -2.830   9.376  -4.147
    7    HE2  MET  85           HE1      MET  85  -5.123   5.921  -2.335
    8    HE1  MET  85           HE2      MET  85  -3.468   6.446  -2.035
    9    HE3  MET  85           HE3      MET  85  -3.812   5.373  -3.388

  No H/Q in entry =           9
  In of MODEL   35
    1    H    LEU  86           H        LEU  86   0.421   6.496  -2.544
    2    HA   LEU  86           HA       LEU  86  -0.108   7.805  -0.105
    3    HB2  LEU  86           HB2      LEU  86   0.325   5.328  -0.497
    4    HB3  LEU  86           HB3      LEU  86   2.039   5.735  -0.583
    5    HG   LEU  86           HG       LEU  86   1.718   6.900   1.684
    6   HD11  LEU  86          HD11      LEU  86  -0.984   6.170   1.199
    7   HD13  LEU  86          HD12      LEU  86  -0.315   6.908   2.653
    8   HD12  LEU  86          HD13      LEU  86  -0.429   5.153   2.532
    9   HD23  LEU  86          HD21      LEU  86   1.248   3.913   1.803
   10   HD22  LEU  86          HD22      LEU  86   2.259   4.909   2.848
   11   HD21  LEU  86          HD23      LEU  86   2.764   4.578   1.192

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ALA  87           H        ALA  87   2.878   7.470  -1.979
    2    HA   ALA  87           HA       ALA  87   4.595   8.856  -0.245
    3    HB3  ALA  87           HB1      ALA  87   4.689   7.843  -2.953
    4    HB2  ALA  87           HB2      ALA  87   6.023   8.155  -1.845
    5    HB1  ALA  87           HB3      ALA  87   5.431   9.444  -2.892

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ARG  88           H        ARG  88   2.677  10.020  -2.975
    2    HA   ARG  88           HA       ARG  88   3.489  12.699  -2.853
    3    HB2  ARG  88           HB2      ARG  88   2.228  11.565  -4.717
    4    HB3  ARG  88           HB3      ARG  88   0.768  11.729  -3.741
    5    HG2  ARG  88           HG2      ARG  88   1.824  14.294  -3.652
    6    HG3  ARG  88           HG3      ARG  88   2.249  13.775  -5.280
    7    HD2  ARG  88           HD2      ARG  88   0.112  13.886  -5.988
    8    HD3  ARG  88           HD3      ARG  88  -0.494  13.041  -4.563
    9    HE   ARG  88           HE       ARG  88  -0.640  15.822  -4.981
   10   HH21  ARG  88          HH11      ARG  88  -1.157  17.158  -3.245
   11   HH22  ARG  88          HH12      ARG  88  -0.876  16.616  -1.626
   12   HH11  ARG  88          HH21      ARG  88   0.330  13.543  -2.603
   13   HH12  ARG  88          HH22      ARG  88  -0.052  14.563  -1.263

  No H/Q in entry =          13
  In of MODEL   35
    1    H    GLU  89           H        GLU  89   0.753  11.064  -1.227
    2    HA   GLU  89           HA       GLU  89  -0.325  13.391  -0.026
    3    HB2  GLU  89           HB2      GLU  89  -1.476  11.169  -0.119
    4    HB3  GLU  89           HB3      GLU  89  -0.367  10.596   1.127
    5    HG2  GLU  89           HG2      GLU  89  -1.168  12.307   2.683
    6    HG3  GLU  89           HG3      GLU  89  -2.204  12.994   1.435

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LEU  90           H        LEU  90   2.085  11.061   1.158
    2    HA   LEU  90           HA       LEU  90   2.448  12.299   3.690
    3    HB2  LEU  90           HB2      LEU  90   4.202  10.499   2.020
    4    HB3  LEU  90           HB3      LEU  90   4.621  11.008   3.661
    5    HG   LEU  90           HG       LEU  90   1.969   9.703   2.987
    6   HD12  LEU  90          HD11      LEU  90   3.073   7.640   3.999
    7   HD11  LEU  90          HD12      LEU  90   4.609   8.472   3.765
    8   HD13  LEU  90          HD13      LEU  90   3.597   8.081   2.373
    9   HD22  LEU  90          HD21      LEU  90   1.709  10.630   5.108
   10   HD21  LEU  90          HD22      LEU  90   3.423  10.495   5.498
   11   HD23  LEU  90          HD23      LEU  90   2.394   9.064   5.541

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  91           H        ILE  91   4.072  12.658   0.571
    2    HA   ILE  91           HA       ILE  91   6.074  14.457   1.421
    3    HB   ILE  91           HB       ILE  91   4.767  13.989  -1.265
    4   HG12  ILE  91          HG12      ILE  91   7.587  13.456  -0.278
    5   HG13  ILE  91          HG13      ILE  91   6.286  12.279  -0.123
    6   HG22  ILE  91          HG21      ILE  91   7.015  15.301  -1.943
    7   HG21  ILE  91          HG22      ILE  91   6.710  16.106  -0.402
    8   HG23  ILE  91          HG23      ILE  91   5.494  16.155  -1.677
    9   HD13  ILE  91          HD11      ILE  91   6.118  11.960  -2.431
   10   HD12  ILE  91          HD12      ILE  91   7.855  12.175  -2.209
   11   HD11  ILE  91          HD13      ILE  91   6.869  13.514  -2.799

  No H/Q in entry =          11
  In of MODEL   35
    1    H    THR  92           H        THR  92   2.724  14.945   0.398
    2    HA   THR  92           HA       THR  92   2.744  17.768   0.339
    3    HB   THR  92           HB       THR  92   0.541  15.808   1.027
    4    HG1  THR  92           HG1      THR  92   0.853  15.626  -1.057
    5   HG22  THR  92          HG21      THR  92  -0.821  17.993   0.300
    6   HG21  THR  92          HG22      THR  92   0.581  18.795   1.004
    7   HG23  THR  92          HG23      THR  92  -0.383  17.689   1.981

  No H/Q in entry =           7
  In of MODEL   35
    1    H    GLU  93           H        GLU  93   2.146  15.475   2.989
    2    HA   GLU  93           HA       GLU  93   1.636  17.386   5.006
    3    HB2  GLU  93           HB2      GLU  93   2.903  14.640   5.246
    4    HB3  GLU  93           HB3      GLU  93   2.221  15.577   6.577
    5    HG2  GLU  93           HG2      GLU  93   0.608  14.828   4.130
    6    HG3  GLU  93           HG3      GLU  93   0.686  13.802   5.558

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LEU  94           H        LEU  94   4.623  15.856   3.869
    2    HA   LEU  94           HA       LEU  94   6.383  16.973   5.766
    3    HB2  LEU  94           HB2      LEU  94   6.782  16.001   2.937
    4    HB3  LEU  94           HB3      LEU  94   8.118  16.636   3.893
    5    HG   LEU  94           HG       LEU  94   6.337  14.469   5.018
    6   HD11  LEU  94          HD11      LEU  94   8.439  14.210   2.896
    7   HD13  LEU  94          HD12      LEU  94   6.975  13.260   3.150
    8   HD12  LEU  94          HD13      LEU  94   8.392  12.983   4.164
    9   HD23  LEU  94          HD21      LEU  94   8.512  13.895   6.180
   10   HD22  LEU  94          HD22      LEU  94   7.870  15.484   6.595
   11   HD21  LEU  94          HD23      LEU  94   9.211  15.342   5.459

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  95           H        ILE  95   5.278  18.165   2.612
    2    HA   ILE  95           HA       ILE  95   6.889  20.497   2.562
    3    HB   ILE  95           HB       ILE  95   4.240  19.857   1.243
    4   HG12  ILE  95          HG12      ILE  95   7.039  20.149   0.120
    5   HG13  ILE  95          HG13      ILE  95   6.362  18.607   0.630
    6   HG21  ILE  95          HG21      ILE  95   6.031  22.296   1.033
    7   HG23  ILE  95          HG22      ILE  95   4.304  22.256   1.381
    8   HG22  ILE  95          HG23      ILE  95   4.888  21.847  -0.232
    9   HD13  ILE  95          HD11      ILE  95   4.810  18.558  -1.106
   10   HD12  ILE  95          HD12      ILE  95   6.176  19.354  -1.887
   11   HD11  ILE  95          HD13      ILE  95   4.816  20.311  -1.300

  No H/Q in entry =          11
  In of MODEL   35
    1    H    GLU  96           H        GLU  96   3.624  19.898   3.841
    2    HA   GLU  96           HA       GLU  96   3.044  22.554   4.592
    3    HB2  GLU  96           HB2      GLU  96   1.340  20.799   4.594
    4    HB3  GLU  96           HB3      GLU  96   2.182  19.956   5.893
    5    HG2  GLU  96           HG2      GLU  96   1.176  21.255   7.459
    6    HG3  GLU  96           HG3      GLU  96   1.739  22.721   6.665

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LEU  97           H        LEU  97   4.837  19.972   6.223
    2    HA   LEU  97           HA       LEU  97   5.205  21.312   8.697
    3    HB2  LEU  97           HB2      LEU  97   6.712  19.119   7.288
    4    HB3  LEU  97           HB3      LEU  97   7.306  19.793   8.804
    5    HG   LEU  97           HG       LEU  97   4.480  18.747   8.479
    6   HD12  LEU  97          HD11      LEU  97   5.381  16.718   9.694
    7   HD11  LEU  97          HD12      LEU  97   7.004  17.322   9.358
    8   HD13  LEU  97          HD13      LEU  97   5.933  16.883   8.027
    9   HD23  LEU  97          HD21      LEU  97   4.916  18.443  11.045
   10   HD22  LEU  97          HD22      LEU  97   4.566  20.061  10.440
   11   HD21  LEU  97          HD23      LEU  97   6.228  19.593  10.792

  No H/Q in entry =          11
  In of MODEL   35
    1    H    HIS  98           H        HIS  98   7.090  21.299   5.680
    2    HA   HIS  98           HA       HIS  98   9.266  22.841   6.591
    3    HB2  HIS  98           HB2      HIS  98   7.981  22.610   3.859
    4    HB3  HIS  98           HB3      HIS  98   9.436  23.563   4.156
    5    HD1  HIS  98           HD1      HIS  98   8.164  20.014   4.168
    6    HD2  HIS  98           HD2      HIS  98  11.778  22.048   4.611
    7    HE1  HIS  98           HE1      HIS  98   9.989  18.253   4.118
    8    HE2  HIS  98           HE2      HIS  98  12.194  19.471   4.388

  No H/Q in entry =           8
  In of MODEL   35
    1    H    GLU  99           H        GLU  99   6.065  23.732   5.401
    2    HA   GLU  99           HA       GLU  99   6.493  26.540   5.347
    3    HB2  GLU  99           HB2      GLU  99   4.599  25.404   4.206
    4    HB3  GLU  99           HB3      GLU  99   3.890  25.053   5.782
    5    HG2  GLU  99           HG2      GLU  99   3.748  27.448   6.284
    6    HG3  GLU  99           HG3      GLU  99   4.539  27.835   4.759

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LYS 100           H        LYS 100   5.312  24.323   7.861
    2    HA   LYS 100           HA       LYS 100   4.752  26.385   9.754
    3    HB2  LYS 100           HB2      LYS 100   5.274  23.424  10.100
    4    HB3  LYS 100           HB3      LYS 100   4.839  24.503  11.431
    5    HG2  LYS 100           HG2      LYS 100   2.791  25.178  10.174
    6    HG3  LYS 100           HG3      LYS 100   3.203  24.002   8.923
    7    HD2  LYS 100           HD2      LYS 100   3.086  22.182  10.582
    8    HD3  LYS 100           HD3      LYS 100   2.690  23.351  11.845
    9    HE2  LYS 100           HE2      LYS 100   0.655  24.009  10.573
   10    HE3  LYS 100           HE3      LYS 100   1.039  22.783   9.358
   11    HZ1  LYS 100           HZ1      LYS 100   0.748  22.119  12.237
   12    HZ3  LYS 100           HZ2      LYS 100   0.720  21.067  10.901
   13    HZ2  LYS 100           HZ3      LYS 100  -0.578  22.128  11.175

  No H/Q in entry =          13
  In of MODEL   35
    1    H    LEU 101           H        LEU 101   7.648  24.539   8.933
    2    HA   LEU 101           HA       LEU 101   9.250  25.349  11.145
    3    HB2  LEU 101           HB2      LEU 101   9.840  24.354   8.369
    4    HB3  LEU 101           HB3      LEU 101  11.149  24.996   9.357
    5    HG   LEU 101           HG       LEU 101   9.275  22.871  10.410
    6   HD12  LEU 101          HD11      LEU 101  11.304  21.341   9.810
    7   HD11  LEU 101          HD12      LEU 101  11.699  22.598   8.640
    8   HD13  LEU 101          HD13      LEU 101  10.156  21.752   8.538
    9   HD21  LEU 101          HD21      LEU 101  12.014  23.931  11.151
   10   HD23  LEU 101          HD22      LEU 101  11.440  22.368  11.727
   11   HD22  LEU 101          HD23      LEU 101  10.572  23.839  12.162

  No H/Q in entry =          11
  In of MODEL   35
    1    H    LYS 102           H        LYS 102   7.710  27.242   8.998
    2    HA   LYS 102           HA       LYS 102   7.830  29.534   8.708
    3    HB2  LYS 102           HB2      LYS 102   9.382  29.389  10.814
    4    HB3  LYS 102           HB3      LYS 102  10.691  29.561   9.661
    5    HG2  LYS 102           HG2      LYS 102   8.616  31.551  10.514
    6    HG3  LYS 102           HG3      LYS 102  10.334  31.780  10.271
    7    HD2  LYS 102           HD2      LYS 102   8.387  31.394   7.962
    8    HD3  LYS 102           HD3      LYS 102   8.795  32.966   8.633
    9    HE2  LYS 102           HE2      LYS 102  10.156  31.758   6.565
   10    HE3  LYS 102           HE3      LYS 102  10.791  33.053   7.581
   11    HZ2  LYS 102           HZ1      LYS 102  12.278  31.121   7.411
   12    HZ1  LYS 102           HZ2      LYS 102  11.095  30.159   8.147
   13    HZ3  LYS 102           HZ3      LYS 102  11.806  31.433   9.011

  No H/Q in entry =          13
  In of MODEL   35
    1    H    ALA 103           H        ALA 103  11.065  28.137   8.158
    2    HA   ALA 103           HA       ALA 103  12.064  29.497   6.088
    3    HB2  ALA 103           HB1      ALA 103  12.913  27.268   5.163
    4    HB1  ALA 103           HB2      ALA 103  11.998  26.509   6.464
    5    HB3  ALA 103           HB3      ALA 103  13.306  27.630   6.844

  No H/Q in entry =           5
  In of MODEL   35
    1    H1   LYS   3           H1       LYS   3 -31.881   5.552 -19.617
    2    H2   LYS   3           H3       LYS   3 -30.884   5.339 -20.974
    3    H3   LYS   3           H2       LYS   3 -32.217   4.317 -20.731
    4    HA   LYS   3           HA       LYS   3 -31.126   2.977 -19.347
    5    HB2  LYS   3           HB2      LYS   3 -28.941   4.539 -20.674
    6    HB3  LYS   3           HB3      LYS   3 -28.537   3.340 -19.445
    7    HG2  LYS   3           HG2      LYS   3 -29.867   1.684 -20.806
    8    HG3  LYS   3           HG3      LYS   3 -29.901   2.899 -22.084
    9    HD2  LYS   3           HD2      LYS   3 -27.416   2.935 -22.045
   10    HD3  LYS   3           HD3      LYS   3 -27.450   1.620 -20.872
   11    HE2  LYS   3           HE2      LYS   3 -28.882   0.373 -22.595
   12    HE3  LYS   3           HE3      LYS   3 -28.340   1.599 -23.741
   13    HZ3  LYS   3           HZ1      LYS   3 -26.473   0.485 -24.030
   14    HZ2  LYS   3           HZ2      LYS   3 -27.025  -0.731 -22.981
   15    HZ1  LYS   3           HZ3      LYS   3 -26.111   0.565 -22.373

  No H/Q in entry =          15
  In of MODEL   35
    1    H    LYS   4           H        LYS   4 -31.160   2.810 -17.287
    2    HA   LYS   4           HA       LYS   4 -30.560   5.119 -15.616
    3    HB2  LYS   4           HB2      LYS   4 -31.595   2.352 -14.940
    4    HB3  LYS   4           HB3      LYS   4 -31.449   3.689 -13.800
    5    HG2  LYS   4           HG2      LYS   4 -33.261   3.544 -16.215
    6    HG3  LYS   4           HG3      LYS   4 -33.746   3.548 -14.519
    7    HD2  LYS   4           HD2      LYS   4 -33.182   5.804 -14.232
    8    HD3  LYS   4           HD3      LYS   4 -32.148   5.823 -15.660
    9    HE2  LYS   4           HE2      LYS   4 -34.154   7.085 -16.100
   10    HE3  LYS   4           HE3      LYS   4 -34.152   5.620 -17.083
   11    HZ3  LYS   4           HZ1      LYS   4 -35.662   4.600 -15.539
   12    HZ2  LYS   4           HZ2      LYS   4 -36.308   6.066 -16.106
   13    HZ1  LYS   4           HZ3      LYS   4 -35.639   5.978 -14.547

  No H/Q in entry =          13
  In of MODEL   35
    1    H    HIS   5           H        HIS   5 -29.092   5.274 -14.029
    2    HA   HIS   5           HA       HIS   5 -26.707   3.586 -14.390
    3    HB2  HIS   5           HB2      HIS   5 -27.117   6.309 -13.153
    4    HB3  HIS   5           HB3      HIS   5 -25.582   5.443 -13.153
    5    HD1  HIS   5           HD1      HIS   5 -24.192   6.743 -14.735
    6    HD2  HIS   5           HD2      HIS   5 -27.958   5.917 -16.280
    7    HE1  HIS   5           HE1      HIS   5 -24.071   7.358 -17.180
    8    HE2  HIS   5           HE2      HIS   5 -26.367   6.841 -18.091

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ILE   6           H        ILE   6 -26.381   2.016 -13.092
    2    HA   ILE   6           HA       ILE   6 -27.356   2.198 -10.321
    3    HB   ILE   6           HB       ILE   6 -26.397  -0.200 -11.888
    4   HG12  ILE   6          HG12      ILE   6 -29.186   0.566 -11.015
    5   HG13  ILE   6          HG13      ILE   6 -28.562   0.782 -12.650
    6   HG23  ILE   6          HG21      ILE   6 -26.688  -1.492 -10.039
    7   HG22  ILE   6          HG22      ILE   6 -27.906  -0.422  -9.343
    8   HG21  ILE   6          HG23      ILE   6 -26.199   0.013  -9.258
    9   HD13  ILE   6          HD11      ILE   6 -28.901  -1.355 -13.171
   10   HD12  ILE   6          HD12      ILE   6 -29.909  -1.411 -11.725
   11   HD11  ILE   6          HD13      ILE   6 -28.222  -1.924 -11.645

  No H/Q in entry =          11
  In of MODEL   35
    1    H    TYR   7           H        TYR   7 -25.631   2.926  -9.035
    2    HA   TYR   7           HA       TYR   7 -22.872   2.133  -9.736
    3    HB2  TYR   7           HB2      TYR   7 -23.967   4.493  -8.225
    4    HB3  TYR   7           HB3      TYR   7 -22.256   4.076  -8.276
    5    HD1  TYR   7           HD1      TYR   7 -23.255   3.107 -11.372
    6    HD2  TYR   7           HD2      TYR   7 -22.780   6.689  -9.110
    7    HE1  TYR   7           HE1      TYR   7 -22.905   4.381 -13.452
    8    HE2  TYR   7           HE2      TYR   7 -22.472   7.966 -11.181
    9    HH   TYR   7           HH       TYR   7 -22.696   7.890 -13.413

  No H/Q in entry =           9
  In of MODEL   35
    1    H    LEU   8           H        LEU   8 -21.824   0.825  -8.426
    2    HA   LEU   8           HA       LEU   8 -22.911   0.239  -5.743
    3    HB2  LEU   8           HB2      LEU   8 -21.126  -1.305  -7.602
    4    HB3  LEU   8           HB3      LEU   8 -21.280  -1.715  -5.894
    5    HG   LEU   8           HG       LEU   8 -23.748  -2.025  -6.307
    6   HD13  LEU   8          HD11      LEU   8 -23.959  -0.796  -8.404
    7   HD12  LEU   8          HD12      LEU   8 -24.394  -2.485  -8.659
    8   HD11  LEU   8          HD13      LEU   8 -22.819  -1.890  -9.186
    9   HD23  LEU   8          HD21      LEU   8 -22.368  -3.972  -8.028
   10   HD22  LEU   8          HD22      LEU   8 -23.436  -4.215  -6.647
   11   HD21  LEU   8          HD23      LEU   8 -21.752  -3.768  -6.389

  No H/Q in entry =          11
  In of MODEL   35
    1    H    PHE   9           H        PHE   9 -21.656   0.695  -3.959
    2    HA   PHE   9           HA       PHE   9 -18.931   1.791  -4.475
    3    HB2  PHE   9           HB2      PHE   9 -21.001   2.733  -2.495
    4    HB3  PHE   9           HB3      PHE   9 -19.319   3.244  -2.474
    5    HD1  PHE   9           HD1      PHE   9 -18.402   4.651  -4.239
    6    HD2  PHE   9           HD2      PHE   9 -22.524   3.461  -4.276
    7    HE1  PHE   9           HE1      PHE   9 -18.875   6.339  -5.989
    8    HE2  PHE   9           HE2      PHE   9 -22.999   5.162  -6.019
    9    HZ   PHE   9           HZ       PHE   9 -21.171   6.597  -6.882

  No H/Q in entry =           9
  In of MODEL   35
    1    H    SER  10           H        SER  10 -17.283   0.926  -3.375
    2    HA   SER  10           HA       SER  10 -17.426  -0.002  -0.691
    3    HB2  SER  10           HB2      SER  10 -17.264  -2.334  -0.957
    4    HB3  SER  10           HB3      SER  10 -18.549  -1.867  -2.058
    5    HG   SER  10           HG       SER  10 -15.838  -2.063  -2.827

  No H/Q in entry =           5
  In of MODEL   35
    1    H    SER  11           H        SER  11 -15.405   0.204   0.133
    2    HA   SER  11           HA       SER  11 -13.281   1.185  -1.414
    3    HB2  SER  11           HB2      SER  11 -13.766   1.223   1.179
    4    HB3  SER  11           HB3      SER  11 -12.712  -0.192   1.162
    5    HG   SER  11           HG       SER  11 -11.072   1.024   0.463

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA  12           H        ALA  12 -14.335  -1.533  -2.253
    2    HA   ALA  12           HA       ALA  12 -11.704  -2.654  -2.801
    3    HB1  ALA  12           HB1      ALA  12 -13.797  -4.108  -1.208
    4    HB2  ALA  12           HB2      ALA  12 -12.065  -3.975  -0.904
    5    HB3  ALA  12           HB3      ALA  12 -12.652  -4.996  -2.217

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLY  13           H        GLY  13 -12.588  -1.625  -4.803
    2    HA3  GLY  13           HA2      GLY  13 -14.779  -2.444  -6.272
    3    HA2  GLY  13           HA3      GLY  13 -13.262  -1.897  -6.998

  No H/Q in entry =           3
  In of MODEL   35
    1    H    MET  14           H        MET  14 -11.660  -4.135  -6.012
    2    HA   MET  14           HA       MET  14 -11.963  -5.884  -8.171
    3    HB2  MET  14           HB2      MET  14  -9.869  -5.824  -6.915
    4    HB3  MET  14           HB3      MET  14 -10.652  -6.548  -5.512
    5    HG2  MET  14           HG2      MET  14 -11.121  -8.584  -6.827
    6    HG3  MET  14           HG3      MET  14 -10.373  -7.849  -8.245
    7    HE1  MET  14           HE1      MET  14  -7.947  -6.738  -8.072
    8    HE3  MET  14           HE2      MET  14  -8.087  -8.291  -8.893
    9    HE2  MET  14           HE3      MET  14  -6.728  -7.995  -7.813

  No H/Q in entry =           9
  In of MODEL   35
    1    H    SER  15           H        SER  15 -13.146  -6.393  -4.849
    2    HA   SER  15           HA       SER  15 -14.320  -8.946  -5.526
    3    HB2  SER  15           HB2      SER  15 -14.807  -7.179  -3.113
    4    HB3  SER  15           HB3      SER  15 -15.560  -8.751  -3.363
    5    HG   SER  15           HG       SER  15 -12.767  -8.496  -3.618

  No H/Q in entry =           5
  In of MODEL   35
    1    H    THR  16           H        THR  16 -15.595  -5.638  -5.180
    2    HA   THR  16           HA       THR  16 -18.348  -6.314  -5.724
    3    HB   THR  16           HB       THR  16 -16.953  -3.658  -6.202
    4    HG1  THR  16           HG1      THR  16 -18.034  -3.452  -3.943
    5   HG23  THR  16          HG21      THR  16 -19.115  -2.706  -5.954
    6   HG22  THR  16          HG22      THR  16 -19.789  -4.212  -5.306
    7   HG21  THR  16          HG23      THR  16 -19.340  -4.092  -7.014

  No H/Q in entry =           7
  In of MODEL   35
    1    H    SER  17           H        SER  17 -15.529  -5.585  -7.567
    2    HA   SER  17           HA       SER  17 -16.707  -4.885 -10.057
    3    HB2  SER  17           HB2      SER  17 -14.003  -6.051  -9.370
    4    HB3  SER  17           HB3      SER  17 -14.473  -5.640 -11.019
    5    HG   SER  17           HG       SER  17 -13.536  -4.045  -9.114

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU  18           H        LEU  18 -15.952  -8.005  -8.643
    2    HA   LEU  18           HA       LEU  18 -16.458  -9.514 -11.012
    3    HB2  LEU  18           HB2      LEU  18 -15.177 -10.440  -9.146
    4    HB3  LEU  18           HB3      LEU  18 -16.587 -10.304  -8.097
    5    HG   LEU  18           HG       LEU  18 -17.790 -11.880  -9.625
    6   HD11  LEU  18          HD11      LEU  18 -15.072 -11.889 -10.918
    7   HD13  LEU  18          HD12      LEU  18 -16.655 -11.719 -11.676
    8   HD12  LEU  18          HD13      LEU  18 -16.145 -13.282 -11.041
    9   HD23  LEU  18          HD21      LEU  18 -15.264 -13.064  -8.535
   10   HD22  LEU  18          HD22      LEU  18 -16.863 -13.801  -8.660
   11   HD21  LEU  18          HD23      LEU  18 -16.583 -12.493  -7.511

  No H/Q in entry =          11
  In of MODEL   35
    1    H    LEU  19           H        LEU  19 -18.484  -8.450  -8.282
    2    HA   LEU  19           HA       LEU  19 -20.877  -9.766  -9.120
    3    HB2  LEU  19           HB2      LEU  19 -20.656  -8.946  -6.861
    4    HB3  LEU  19           HB3      LEU  19 -20.456  -7.295  -7.446
    5    HG   LEU  19           HG       LEU  19 -22.794  -7.254  -8.157
    6   HD12  LEU  19          HD11      LEU  19 -24.302  -9.086  -7.476
    7   HD11  LEU  19          HD12      LEU  19 -22.905 -10.023  -6.951
    8   HD13  LEU  19          HD13      LEU  19 -23.106  -9.623  -8.656
    9   HD23  LEU  19          HD21      LEU  19 -22.635  -8.203  -5.313
   10   HD22  LEU  19          HD22      LEU  19 -23.713  -6.993  -6.009
   11   HD21  LEU  19          HD23      LEU  19 -21.992  -6.647  -5.838

  No H/Q in entry =          11
  In of MODEL   35
    1    H    VAL  20           H        VAL  20 -19.570  -6.517  -9.786
    2    HA   VAL  20           HA       VAL  20 -21.745  -5.585 -11.338
    3    HB   VAL  20           HB       VAL  20 -18.796  -4.818 -11.464
    4   HG11  VAL  20          HG11      VAL  20 -21.180  -3.606 -12.882
    5   HG13  VAL  20          HG12      VAL  20 -19.717  -4.261 -13.617
    6   HG12  VAL  20          HG13      VAL  20 -19.641  -2.771 -12.677
    7   HG22  VAL  20          HG21      VAL  20 -19.657  -4.130  -9.406
    8   HG21  VAL  20          HG22      VAL  20 -21.206  -3.667 -10.106
    9   HG23  VAL  20          HG23      VAL  20 -19.768  -2.698 -10.430

  No H/Q in entry =           9
  In of MODEL   35
    1    H    SER  21           H        SER  21 -18.876  -7.460 -12.395
    2    HA   SER  21           HA       SER  21 -19.677  -7.366 -15.141
    3    HB2  SER  21           HB2      SER  21 -18.129  -9.242 -15.501
    4    HB3  SER  21           HB3      SER  21 -17.371  -7.961 -14.559
    5    HG   SER  21           HG       SER  21 -16.984  -9.423 -13.154

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LYS  22           H        LYS  22 -20.603  -9.637 -12.589
    2    HA   LYS  22           HA       LYS  22 -22.052 -11.325 -14.423
    3    HB2  LYS  22           HB2      LYS  22 -22.345 -11.019 -11.431
    4    HB3  LYS  22           HB3      LYS  22 -23.095 -12.278 -12.411
    5    HG2  LYS  22           HG2      LYS  22 -20.116 -11.910 -12.152
    6    HG3  LYS  22           HG3      LYS  22 -21.067 -12.998 -11.141
    7    HD2  LYS  22           HD2      LYS  22 -21.772 -14.237 -13.138
    8    HD3  LYS  22           HD3      LYS  22 -20.816 -13.150 -14.146
    9    HE2  LYS  22           HE2      LYS  22 -18.766 -13.898 -13.033
   10    HE3  LYS  22           HE3      LYS  22 -19.709 -14.960 -11.988
   11    HZ1  LYS  22           HZ1      LYS  22 -19.604 -15.204 -14.940
   12    HZ3  LYS  22           HZ2      LYS  22 -20.308 -16.294 -13.842
   13    HZ2  LYS  22           HZ3      LYS  22 -18.622 -16.090 -13.875

  No H/Q in entry =          13
  In of MODEL   35
    1    H    MET  23           H        MET  23 -22.936  -8.468 -12.522
    2    HA   MET  23           HA       MET  23 -25.735  -8.702 -13.020
    3    HB2  MET  23           HB2      MET  23 -24.021  -6.299 -12.429
    4    HB3  MET  23           HB3      MET  23 -25.775  -6.227 -12.600
    5    HG2  MET  23           HG2      MET  23 -26.083  -7.571 -10.643
    6    HG3  MET  23           HG3      MET  23 -24.352  -7.886 -10.527
    7    HE2  MET  23           HE1      MET  23 -26.850  -4.383  -9.293
    8    HE1  MET  23           HE2      MET  23 -27.054  -5.350 -10.752
    9    HE3  MET  23           HE3      MET  23 -26.103  -3.866 -10.805

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ARG  24           H        ARG  24 -23.075  -7.101 -14.798
    2    HA   ARG  24           HA       ARG  24 -24.651  -5.867 -16.778
    3    HB2  ARG  24           HB2      ARG  24 -21.774  -6.837 -16.829
    4    HB3  ARG  24           HB3      ARG  24 -22.502  -5.965 -18.157
    5    HG2  ARG  24           HG2      ARG  24 -22.803  -3.958 -16.766
    6    HG3  ARG  24           HG3      ARG  24 -22.212  -4.851 -15.340
    7    HD2  ARG  24           HD2      ARG  24 -20.347  -3.575 -16.251
    8    HD3  ARG  24           HD3      ARG  24 -20.087  -5.281 -16.590
    9    HE   ARG  24           HE       ARG  24 -21.256  -4.427 -18.850
   10   HH21  ARG  24          HH11      ARG  24 -19.791  -4.972 -20.466
   11   HH22  ARG  24          HH12      ARG  24 -18.167  -4.382 -20.385
   12   HH11  ARG  24          HH21      ARG  24 -18.643  -3.200 -17.083
   13   HH12  ARG  24          HH22      ARG  24 -17.501  -3.327 -18.384

  No H/Q in entry =          13
  In of MODEL   35
    1    H    ALA  25           H        ALA  25 -23.342  -9.139 -16.542
    2    HA   ALA  25           HA       ALA  25 -23.933  -9.976 -19.186
    3    HB1  ALA  25           HB1      ALA  25 -23.121 -11.973 -18.515
    4    HB3  ALA  25           HB2      ALA  25 -24.173 -12.027 -17.101
    5    HB2  ALA  25           HB3      ALA  25 -22.666 -11.115 -17.044

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLN  26           H        GLN  26 -25.743 -10.149 -16.158
    2    HA   GLN  26           HA       GLN  26 -28.020 -11.469 -17.182
    3    HB2  GLN  26           HB2      GLN  26 -27.597  -9.723 -14.776
    4    HB3  GLN  26           HB3      GLN  26 -29.119 -10.528 -15.130
    5    HG2  GLN  26           HG2      GLN  26 -26.454 -11.844 -14.685
    6    HG3  GLN  26           HG3      GLN  26 -27.815 -11.829 -13.570
    7   HE21  GLN  26          HE21      GLN  26 -26.484 -13.908 -14.874
    8   HE22  GLN  26          HE22      GLN  26 -27.468 -15.002 -15.680

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ALA  27           H        ALA  27 -27.274  -8.030 -16.754
    2    HA   ALA  27           HA       ALA  27 -29.823  -7.068 -17.518
    3    HB1  ALA  27           HB1      ALA  27 -28.085  -5.667 -16.392
    4    HB3  ALA  27           HB2      ALA  27 -28.722  -4.918 -17.858
    5    HB2  ALA  27           HB3      ALA  27 -27.141  -5.698 -17.883

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLU  28           H        GLU  28 -27.066  -8.118 -19.408
    2    HA   GLU  28           HA       GLU  28 -28.065  -7.102 -21.913
    3    HB2  GLU  28           HB2      GLU  28 -25.651  -7.659 -21.304
    4    HB3  GLU  28           HB3      GLU  28 -26.103  -9.349 -21.524
    5    HG2  GLU  28           HG2      GLU  28 -25.008  -8.487 -23.486
    6    HG3  GLU  28           HG3      GLU  28 -26.687  -8.900 -23.833

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LYS  29           H        LYS  29 -28.053 -10.232 -20.292
    2    HA   LYS  29           HA       LYS  29 -29.280 -11.747 -22.311
    3    HB2  LYS  29           HB2      LYS  29 -28.172 -12.696 -20.322
    4    HB3  LYS  29           HB3      LYS  29 -29.477 -12.072 -19.315
    5    HG2  LYS  29           HG2      LYS  29 -31.063 -13.521 -20.395
    6    HG3  LYS  29           HG3      LYS  29 -29.835 -14.076 -21.529
    7    HD2  LYS  29           HD2      LYS  29 -28.624 -15.198 -19.815
    8    HD3  LYS  29           HD3      LYS  29 -29.571 -14.423 -18.546
    9    HE2  LYS  29           HE2      LYS  29 -30.194 -16.806 -18.935
   10    HE3  LYS  29           HE3      LYS  29 -31.536 -15.683 -19.160
   11    HZ1  LYS  29           HZ1      LYS  29 -30.974 -15.756 -21.590
   12    HZ3  LYS  29           HZ2      LYS  29 -31.613 -17.188 -20.940
   13    HZ2  LYS  29           HZ3      LYS  29 -29.949 -17.064 -21.243

  No H/Q in entry =          13
  In of MODEL   35
    1    H    TYR  30           H        TYR  30 -30.778  -9.753 -19.777
    2    HA   TYR  30           HA       TYR  30 -33.416 -10.334 -21.017
    3    HB2  TYR  30           HB2      TYR  30 -32.818  -9.178 -18.284
    4    HB3  TYR  30           HB3      TYR  30 -34.421  -9.517 -18.936
    5    HD1  TYR  30           HD1      TYR  30 -35.204 -11.853 -19.174
    6    HD2  TYR  30           HD2      TYR  30 -31.409 -10.941 -17.473
    7    HE1  TYR  30           HE1      TYR  30 -34.983 -14.182 -18.406
    8    HE2  TYR  30           HE2      TYR  30 -31.190 -13.255 -16.709
    9    HH   TYR  30           HH       TYR  30 -32.701 -15.690 -17.826

  No H/Q in entry =           9
  In of MODEL   35
    1    H    GLU  31           H        GLU  31 -31.366  -8.216 -21.799
    2    HA   GLU  31           HA       GLU  31 -31.416  -6.048 -22.594
    3    HB2  GLU  31           HB2      GLU  31 -34.268  -6.917 -23.108
    4    HB3  GLU  31           HB3      GLU  31 -33.508  -5.496 -23.822
    5    HG2  GLU  31           HG2      GLU  31 -31.962  -6.834 -25.036
    6    HG3  GLU  31           HG3      GLU  31 -32.444  -8.289 -24.163

  No H/Q in entry =           6
  In of MODEL   35
    1    H    VAL  32           H        VAL  32 -31.611  -5.991 -19.861
    2    HA   VAL  32           HA       VAL  32 -33.586  -3.993 -19.171
    3    HB   VAL  32           HB       VAL  32 -31.136  -4.870 -17.609
    4   HG12  VAL  32          HG11      VAL  32 -32.709  -4.158 -15.699
    5   HG11  VAL  32          HG12      VAL  32 -33.595  -3.287 -16.950
    6   HG13  VAL  32          HG13      VAL  32 -31.907  -2.891 -16.630
    7   HG21  VAL  32          HG21      VAL  32 -32.807  -6.679 -18.314
    8   HG23  VAL  32          HG22      VAL  32 -33.888  -5.926 -17.141
    9   HG22  VAL  32          HG23      VAL  32 -32.331  -6.569 -16.619

  No H/Q in entry =           9
  In of MODEL   35
    1    HA   PRO  33           HA       PRO  33 -30.730  -0.879 -20.816
    2    HB2  PRO  33           HB2      PRO  33 -32.364   1.253 -20.660
    3    HB3  PRO  33           HB3      PRO  33 -32.762  -0.060 -21.770
    4    HG2  PRO  33           HG2      PRO  33 -33.749   0.366 -18.948
    5    HG3  PRO  33           HG3      PRO  33 -34.704   0.121 -20.409
    6    HD2  PRO  33           HD2      PRO  33 -34.125  -1.942 -18.771
    7    HD3  PRO  33           HD3      PRO  33 -34.180  -2.166 -20.519

  No H/Q in entry =           7
  In of MODEL   35
    1    H    VAL  34           H        VAL  34 -29.430  -1.374 -18.878
    2    HA   VAL  34           HA       VAL  34 -29.279   1.043 -17.201
    3    HB   VAL  34           HB       VAL  34 -28.609  -0.407 -15.283
    4   HG12  VAL  34          HG11      VAL  34 -30.967  -1.421 -14.980
    5   HG11  VAL  34          HG12      VAL  34 -31.331  -0.660 -16.527
    6   HG13  VAL  34          HG13      VAL  34 -30.830   0.328 -15.156
    7   HG21  VAL  34          HG21      VAL  34 -28.685  -2.416 -17.317
    8   HG23  VAL  34          HG22      VAL  34 -29.715  -2.854 -15.953
    9   HG22  VAL  34          HG23      VAL  34 -28.015  -2.472 -15.686

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ILE  35           H        ILE  35 -27.328   1.579 -16.362
    2    HA   ILE  35           HA       ILE  35 -24.955   0.401 -17.647
    3    HB   ILE  35           HB       ILE  35 -25.518   3.252 -16.799
    4   HG12  ILE  35          HG12      ILE  35 -24.471   2.036 -19.363
    5   HG13  ILE  35          HG13      ILE  35 -26.134   2.559 -19.091
    6   HG21  ILE  35          HG21      ILE  35 -22.873   1.873 -17.135
    7   HG23  ILE  35          HG22      ILE  35 -23.389   3.009 -15.890
    8   HG22  ILE  35          HG23      ILE  35 -23.045   3.585 -17.521
    9   HD11  ILE  35          HD11      ILE  35 -24.858   4.822 -18.466
   10   HD13  ILE  35          HD12      ILE  35 -25.379   4.429 -20.105
   11   HD12  ILE  35          HD13      ILE  35 -23.706   4.149 -19.619

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ILE  36           H        ILE  36 -23.662  -0.570 -16.065
    2    HA   ILE  36           HA       ILE  36 -24.127  -0.018 -13.186
    3    HB   ILE  36           HB       ILE  36 -23.149  -2.654 -14.332
    4   HG12  ILE  36          HG12      ILE  36 -25.996  -2.021 -13.548
    5   HG13  ILE  36          HG13      ILE  36 -25.431  -1.947 -15.218
    6   HG23  ILE  36          HG21      ILE  36 -23.443  -3.528 -12.227
    7   HG22  ILE  36          HG22      ILE  36 -24.641  -2.318 -11.768
    8   HG21  ILE  36          HG23      ILE  36 -22.933  -1.886 -11.840
    9   HD13  ILE  36          HD11      ILE  36 -25.471  -4.164 -15.451
   10   HD12  ILE  36          HD12      ILE  36 -26.535  -4.122 -14.048
   11   HD11  ILE  36          HD13      ILE  36 -24.816  -4.445 -13.839

  No H/Q in entry =          11
  In of MODEL   35
    1    H    GLU  37           H        GLU  37 -22.380   0.699 -12.079
    2    HA   GLU  37           HA       GLU  37 -19.652   0.072 -13.014
    3    HB2  GLU  37           HB2      GLU  37 -20.713   2.795 -12.282
    4    HB3  GLU  37           HB3      GLU  37 -18.997   2.406 -12.410
    5    HG2  GLU  37           HG2      GLU  37 -19.237   1.976 -14.769
    6    HG3  GLU  37           HG3      GLU  37 -20.974   2.260 -14.666

  No H/Q in entry =           6
  In of MODEL   35
    1    H    ALA  38           H        ALA  38 -18.148  -0.101 -11.338
    2    HA   ALA  38           HA       ALA  38 -19.177  -0.017  -8.563
    3    HB1  ALA  38           HB1      ALA  38 -17.358  -1.835 -10.018
    4    HB3  ALA  38           HB2      ALA  38 -18.387  -2.149  -8.620
    5    HB2  ALA  38           HB3      ALA  38 -16.816  -1.376  -8.404

  No H/Q in entry =           5
  In of MODEL   35
    1    H    PHE  39           H        PHE  39 -18.003   1.244  -7.078
    2    HA   PHE  39           HA       PHE  39 -15.557   2.604  -7.966
    3    HB2  PHE  39           HB2      PHE  39 -18.050   3.934  -6.924
    4    HB3  PHE  39           HB3      PHE  39 -16.463   4.697  -6.833
    5    HD1  PHE  39           HD1      PHE  39 -15.156   4.805  -9.094
    6    HD2  PHE  39           HD2      PHE  39 -19.380   4.347  -8.740
    7    HE1  PHE  39           HE1      PHE  39 -15.432   5.693 -11.391
    8    HE2  PHE  39           HE2      PHE  39 -19.672   5.225 -11.029
    9    HZ   PHE  39           HZ       PHE  39 -17.702   5.872 -12.373

  No H/Q in entry =           9
  In of MODEL   35
    1    HA   PRO  40           HA       PRO  40 -14.559   1.854  -3.692
    2    HB2  PRO  40           HB2      PRO  40 -12.913   3.963  -3.067
    3    HB3  PRO  40           HB3      PRO  40 -12.394   2.673  -4.152
    4    HG2  PRO  40           HG2      PRO  40 -13.582   5.351  -4.862
    5    HG3  PRO  40           HG3      PRO  40 -12.111   4.604  -5.484
    6    HD2  PRO  40           HD2      PRO  40 -14.330   4.401  -6.885
    7    HD3  PRO  40           HD3      PRO  40 -13.288   2.990  -6.715

  No H/Q in entry =           7
  In of MODEL   35
    1    H    GLU  41           H        GLU  41 -15.229   2.766  -1.549
    2    HA   GLU  41           HA       GLU  41 -17.572   4.330  -1.503
    3    HB2  GLU  41           HB2      GLU  41 -17.409   4.242   0.875
    4    HB3  GLU  41           HB3      GLU  41 -16.844   2.692   0.251
    5    HG2  GLU  41           HG2      GLU  41 -14.521   3.406   0.595
    6    HG3  GLU  41           HG3      GLU  41 -15.097   4.945   1.236

  No H/Q in entry =           6
  In of MODEL   35
    1    H    THR  42           H        THR  42 -14.302   5.448  -1.555
    2    HA   THR  42           HA       THR  42 -14.805   7.967  -0.308
    3    HB   THR  42           HB       THR  42 -12.691   8.684  -1.402
    4    HG1  THR  42           HG1      THR  42 -12.031   7.648  -3.102
    5   HG22  THR  42          HG21      THR  42 -11.256   6.796  -0.455
    6   HG21  THR  42          HG22      THR  42 -12.771   5.975  -0.070
    7   HG23  THR  42          HG23      THR  42 -12.402   7.535   0.664

  No H/Q in entry =           7
  In of MODEL   35
    1    H    LEU  43           H        LEU  43 -15.653   6.858  -3.420
    2    HA   LEU  43           HA       LEU  43 -16.077   9.622  -4.354
    3    HB2  LEU  43           HB2      LEU  43 -16.306   6.982  -5.788
    4    HB3  LEU  43           HB3      LEU  43 -16.576   8.564  -6.517
    5    HG   LEU  43           HG       LEU  43 -13.932   7.529  -5.522
    6   HD13  LEU  43          HD11      LEU  43 -13.371   7.046  -7.711
    7   HD12  LEU  43          HD12      LEU  43 -14.609   8.113  -8.373
    8   HD11  LEU  43          HD13      LEU  43 -15.067   6.562  -7.673
    9   HD22  LEU  43          HD21      LEU  43 -14.009   9.914  -5.318
   10   HD21  LEU  43          HD22      LEU  43 -14.767  10.083  -6.902
   11   HD23  LEU  43          HD23      LEU  43 -13.095   9.543  -6.780

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ALA  44           H        ALA  44 -17.901   7.660  -2.518
    2    HA   ALA  44           HA       ALA  44 -20.372   7.386  -3.834
    3    HB2  ALA  44           HB1      ALA  44 -20.157   6.254  -1.752
    4    HB3  ALA  44           HB2      ALA  44 -21.343   7.526  -1.459
    5    HB1  ALA  44           HB3      ALA  44 -19.680   7.729  -0.911

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLY  45           H        GLY  45 -19.118  10.248  -2.272
    2    HA3  GLY  45           HA2      GLY  45 -21.643  11.602  -2.606
    3    HA2  GLY  45           HA3      GLY  45 -20.137  12.311  -2.026

  No H/Q in entry =           3
  In of MODEL   35
    1    H    GLU  46           H        GLU  46 -18.561  11.498  -4.333
    2    HA   GLU  46           HA       GLU  46 -19.338  13.692  -6.072
    3    HB2  GLU  46           HB2      GLU  46 -17.024  11.747  -6.146
    4    HB3  GLU  46           HB3      GLU  46 -17.236  13.090  -7.271
    5    HG2  GLU  46           HG2      GLU  46 -16.893  13.356  -4.291
    6    HG3  GLU  46           HG3      GLU  46 -15.615  13.573  -5.486

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LYS  47           H        LYS  47 -19.007  10.193  -6.552
    2    HA   LYS  47           HA       LYS  47 -20.126  10.378  -9.220
    3    HB2  LYS  47           HB2      LYS  47 -19.436   7.990  -7.500
    4    HB3  LYS  47           HB3      LYS  47 -19.962   7.910  -9.181
    5    HG2  LYS  47           HG2      LYS  47 -17.541   9.474  -8.401
    6    HG3  LYS  47           HG3      LYS  47 -17.457   7.732  -8.658
    7    HD2  LYS  47           HD2      LYS  47 -18.250   7.955 -10.904
    8    HD3  LYS  47           HD3      LYS  47 -18.597   9.666 -10.664
    9    HE2  LYS  47           HE2      LYS  47 -16.550   9.447 -11.902
   10    HE3  LYS  47           HE3      LYS  47 -16.183  10.059 -10.290
   11    HZ1  LYS  47           HZ1      LYS  47 -15.986   7.457  -9.871
   12    HZ3  LYS  47           HZ2      LYS  47 -14.675   8.424 -10.351
   13    HZ2  LYS  47           HZ3      LYS  47 -15.525   7.510 -11.505

  No H/Q in entry =          13
  In of MODEL   35
    1    H    GLY  48           H        GLY  48 -21.389   9.504  -6.078
    2    HA3  GLY  48           HA2      GLY  48 -23.701   8.185  -6.826
    3    HA2  GLY  48           HA3      GLY  48 -23.530   9.173  -5.375

  No H/Q in entry =           3
  In of MODEL   35
    1    H    GLN  49           H        GLN  49 -23.102  11.646  -6.918
    2    HA   GLN  49           HA       GLN  49 -25.724  12.602  -7.041
    3    HB2  GLN  49           HB2      GLN  49 -23.243  13.635  -8.398
    4    HB3  GLN  49           HB3      GLN  49 -24.760  14.509  -8.297
    5    HG2  GLN  49           HG2      GLN  49 -24.593  14.513  -5.861
    6    HG3  GLN  49           HG3      GLN  49 -23.087  13.618  -5.960
    7   HE21  GLN  49          HE21      GLN  49 -23.100  15.834  -4.661
    8   HE22  GLN  49          HE22      GLN  49 -22.257  17.150  -5.295

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ASN  50           H        ASN  50 -23.943  10.856  -9.455
    2    HA   ASN  50           HA       ASN  50 -25.885  11.638 -11.522
    3    HB2  ASN  50           HB2      ASN  50 -23.217  10.260 -11.782
    4    HB3  ASN  50           HB3      ASN  50 -24.296  10.638 -13.117
    5   HD21  ASN  50          HD21      ASN  50 -21.710  11.621 -11.504
    6   HD22  ASN  50          HD22      ASN  50 -21.576  13.272 -11.827

  No H/Q in entry =           6
  In of MODEL   35
    1    H    ALA  51           H        ALA  51 -25.719   9.260  -9.304
    2    HA   ALA  51           HA       ALA  51 -26.381   7.094 -11.155
    3    HB2  ALA  51           HB1      ALA  51 -25.711   5.762  -9.487
    4    HB3  ALA  51           HB2      ALA  51 -26.875   6.488  -8.380
    5    HB1  ALA  51           HB3      ALA  51 -25.277   7.209  -8.576

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ASP  52           H        ASP  52 -28.318   5.919 -11.021
    2    HA   ASP  52           HA       ASP  52 -30.602   7.610 -10.326
    3    HB2  ASP  52           HB2      ASP  52 -30.269   5.141 -12.028
    4    HB3  ASP  52           HB3      ASP  52 -31.853   5.775 -11.579

  No H/Q in entry =           4
  In of MODEL   35
    1    H    VAL  53           H        VAL  53 -28.829   4.810  -9.351
    2    HA   VAL  53           HA       VAL  53 -30.263   4.820  -6.829
    3    HB   VAL  53           HB       VAL  53 -31.567   3.114  -8.089
    4   HG11  VAL  53          HG11      VAL  53 -29.778   2.377  -9.627
    5   HG13  VAL  53          HG12      VAL  53 -30.530   1.025  -8.781
    6   HG12  VAL  53          HG13      VAL  53 -28.950   1.616  -8.269
    7   HG23  VAL  53          HG21      VAL  53 -30.623   1.168  -6.423
    8   HG22  VAL  53          HG22      VAL  53 -31.826   2.399  -6.037
    9   HG21  VAL  53          HG23      VAL  53 -30.131   2.667  -5.633

  No H/Q in entry =           9
  In of MODEL   35
    1    H    VAL  54           H        VAL  54 -28.921   4.446  -5.183
    2    HA   VAL  54           HA       VAL  54 -26.117   3.769  -5.814
    3    HB   VAL  54           HB       VAL  54 -27.282   5.453  -3.539
    4   HG11  VAL  54          HG11      VAL  54 -24.626   4.192  -3.856
    5   HG13  VAL  54          HG12      VAL  54 -25.411   4.809  -2.404
    6   HG12  VAL  54          HG13      VAL  54 -24.573   5.917  -3.489
    7   HG22  VAL  54          HG21      VAL  54 -26.535   7.328  -4.619
    8   HG21  VAL  54          HG22      VAL  54 -27.029   6.324  -5.981
    9   HG23  VAL  54          HG23      VAL  54 -25.325   6.445  -5.549

  No H/Q in entry =           9
  In of MODEL   35
    1    H    LEU  55           H        LEU  55 -25.411   1.878  -5.197
    2    HA   LEU  55           HA       LEU  55 -26.831   0.454  -3.033
    3    HB2  LEU  55           HB2      LEU  55 -25.218  -0.592  -5.348
    4    HB3  LEU  55           HB3      LEU  55 -25.916  -1.586  -4.068
    5    HG   LEU  55           HG       LEU  55 -27.453  -0.059  -6.161
    6   HD13  LEU  55          HD11      LEU  55 -27.050  -1.876  -7.405
    7   HD12  LEU  55          HD12      LEU  55 -27.949  -2.820  -6.217
    8   HD11  LEU  55          HD13      LEU  55 -26.200  -2.655  -6.071
    9   HD23  LEU  55          HD21      LEU  55 -28.624  -2.100  -4.326
   10   HD22  LEU  55          HD22      LEU  55 -29.402  -0.751  -5.154
   11   HD21  LEU  55          HD23      LEU  55 -28.394  -0.453  -3.739

  No H/Q in entry =          11
  In of MODEL   35
    1    H    LEU  56           H        LEU  56 -25.639  -0.093  -1.239
    2    HA   LEU  56           HA       LEU  56 -22.734   0.474  -1.293
    3    HB2  LEU  56           HB2      LEU  56 -24.511   0.129   1.109
    4    HB3  LEU  56           HB3      LEU  56 -22.830   0.658   1.098
    5    HG   LEU  56           HG       LEU  56 -25.227   2.211   0.161
    6   HD11  LEU  56          HD11      LEU  56 -24.081   1.865   2.673
    7   HD13  LEU  56          HD12      LEU  56 -25.151   3.180   2.187
    8   HD12  LEU  56          HD13      LEU  56 -23.404   3.388   2.095
    9   HD23  LEU  56          HD21      LEU  56 -23.385   4.022  -0.018
   10   HD22  LEU  56          HD22      LEU  56 -23.709   2.920  -1.357
   11   HD21  LEU  56          HD23      LEU  56 -22.332   2.635  -0.293

  No H/Q in entry =          11
  In of MODEL   35
    1    H    GLY  57           H        GLY  57 -21.259  -1.079  -0.784
    2    HA3  GLY  57           HA2      GLY  57 -22.024  -3.813  -1.010
    3    HA2  GLY  57           HA3      GLY  57 -20.431  -3.230  -0.532

  No H/Q in entry =           3
  In of MODEL   35
    1    HA   PRO  58           HA       PRO  58 -23.160  -4.475   3.176
    2    HB2  PRO  58           HB2      PRO  58 -22.322  -7.042   3.748
    3    HB3  PRO  58           HB3      PRO  58 -23.733  -6.704   2.745
    4    HG2  PRO  58           HG2      PRO  58 -20.962  -7.415   1.939
    5    HG3  PRO  58           HG3      PRO  58 -22.499  -7.956   1.267
    6    HD2  PRO  58           HD2      PRO  58 -21.004  -6.034   0.061
    7    HD3  PRO  58           HD3      PRO  58 -22.765  -6.049  -0.034

  No H/Q in entry =           7
  In of MODEL   35
    1    H    GLN  59           H        GLN  59 -19.769  -4.743   2.552
    2    HA   GLN  59           HA       GLN  59 -19.004  -4.750   5.310
    3    HB2  GLN  59           HB2      GLN  59 -17.509  -3.855   2.844
    4    HB3  GLN  59           HB3      GLN  59 -16.812  -3.888   4.451
    5    HG2  GLN  59           HG2      GLN  59 -17.837  -6.256   2.894
    6    HG3  GLN  59           HG3      GLN  59 -16.153  -5.841   3.169
    7   HE21  GLN  59          HE21      GLN  59 -18.203  -7.795   4.007
    8   HE22  GLN  59          HE22      GLN  59 -18.014  -8.399   5.545

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ILE  60           H        ILE  60 -20.092  -2.231   3.136
    2    HA   ILE  60           HA       ILE  60 -19.347  -0.252   5.202
    3    HB   ILE  60           HB       ILE  60 -19.690   1.482   3.396
    4   HG12  ILE  60          HG12      ILE  60 -19.372  -0.716   1.393
    5   HG13  ILE  60          HG13      ILE  60 -20.983  -0.258   1.944
    6   HG21  ILE  60          HG21      ILE  60 -17.490   0.457   4.124
    7   HG23  ILE  60          HG22      ILE  60 -17.527   1.313   2.584
    8   HG22  ILE  60          HG23      ILE  60 -17.554  -0.449   2.613
    9   HD13  ILE  60          HD11      ILE  60 -20.747   1.074   0.062
   10   HD12  ILE  60          HD12      ILE  60 -19.020   1.312   0.320
   11   HD11  ILE  60          HD13      ILE  60 -20.187   2.169   1.326

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ALA  61           H        ALA  61 -21.706  -1.978   5.260
    2    HA   ALA  61           HA       ALA  61 -24.027  -0.439   4.829
    3    HB1  ALA  61           HB1      ALA  61 -25.149  -2.013   6.141
    4    HB2  ALA  61           HB2      ALA  61 -23.727  -2.332   7.134
    5    HB3  ALA  61           HB3      ALA  61 -23.794  -2.925   5.473

  No H/Q in entry =           5
  In of MODEL   35
    1    H    TYR  62           H        TYR  62 -21.805  -0.457   7.618
    2    HA   TYR  62           HA       TYR  62 -23.447   1.087   9.313
    3    HB2  TYR  62           HB2      TYR  62 -21.443   1.598  10.557
    4    HB3  TYR  62           HB3      TYR  62 -21.377  -0.088  10.041
    5    HD1  TYR  62           HD1      TYR  62 -19.760  -0.808   8.313
    6    HD2  TYR  62           HD2      TYR  62 -19.822   3.225   9.725
    7    HE1  TYR  62           HE1      TYR  62 -17.569  -0.408   7.256
    8    HE2  TYR  62           HE2      TYR  62 -17.616   3.620   8.668
    9    HH   TYR  62           HH       TYR  62 -16.001   2.749   7.483

  No H/Q in entry =           9
  In of MODEL   35
    1    H    MET  63           H        MET  63 -21.868   2.073   6.462
    2    HA   MET  63           HA       MET  63 -21.861   4.902   7.190
    3    HB2  MET  63           HB2      MET  63 -21.179   3.448   4.632
    4    HB3  MET  63           HB3      MET  63 -21.084   5.199   4.837
    5    HG2  MET  63           HG2      MET  63 -19.347   4.930   6.499
    6    HG3  MET  63           HG3      MET  63 -19.464   3.177   6.362
    7    HE3  MET  63           HE1      MET  63 -19.108   5.906   3.017
    8    HE2  MET  63           HE2      MET  63 -17.590   6.249   3.849
    9    HE1  MET  63           HE3      MET  63 -19.121   6.372   4.719

  No H/Q in entry =           9
  In of MODEL   35
    1    H    LEU  64           H        LEU  64 -24.318   2.915   6.212
    2    HA   LEU  64           HA       LEU  64 -25.616   4.287   4.154
    3    HB2  LEU  64           HB2      LEU  64 -26.359   2.124   5.050
    4    HB3  LEU  64           HB3      LEU  64 -26.857   2.921   6.542
    5    HG   LEU  64           HG       LEU  64 -28.626   4.092   5.335
    6   HD13  LEU  64          HD11      LEU  64 -28.367   4.375   3.104
    7   HD12  LEU  64          HD12      LEU  64 -28.919   2.707   2.941
    8   HD11  LEU  64          HD13      LEU  64 -27.193   3.064   2.997
    9   HD23  LEU  64          HD21      LEU  64 -28.987   1.263   4.555
   10   HD22  LEU  64          HD22      LEU  64 -30.034   2.328   5.492
   11   HD21  LEU  64          HD23      LEU  64 -28.613   1.605   6.244

  No H/Q in entry =          11
  In of MODEL   35
    1    HA   PRO  65           HA       PRO  65 -27.960   7.280   6.951
    2    HB2  PRO  65           HB2      PRO  65 -25.962   7.524   9.200
    3    HB3  PRO  65           HB3      PRO  65 -27.713   7.705   9.256
    4    HG2  PRO  65           HG2      PRO  65 -26.655   5.497  10.152
    5    HG3  PRO  65           HG3      PRO  65 -28.075   5.396   9.112
    6    HD2  PRO  65           HD2      PRO  65 -25.176   4.953   8.390
    7    HD3  PRO  65           HD3      PRO  65 -26.583   3.991   7.938

  No H/Q in entry =           7
  In of MODEL   35
    1    H    GLU  66           H        GLU  66 -24.406   7.423   7.011
    2    HA   GLU  66           HA       GLU  66 -24.268  10.238   6.638
    3    HB2  GLU  66           HB2      GLU  66 -22.331   8.044   5.952
    4    HB3  GLU  66           HB3      GLU  66 -21.978   9.761   5.764
    5    HG2  GLU  66           HG2      GLU  66 -22.199  10.091   8.136
    6    HG3  GLU  66           HG3      GLU  66 -22.630   8.395   8.349

  No H/Q in entry =           6
  In of MODEL   35
    1    H    ILE  67           H        ILE  67 -24.226   7.518   4.354
    2    HA   ILE  67           HA       ILE  67 -23.916   9.274   2.079
    3    HB   ILE  67           HB       ILE  67 -24.651   6.320   2.228
    4   HG12  ILE  67          HG12      ILE  67 -22.095   7.644   1.310
    5   HG13  ILE  67          HG13      ILE  67 -22.358   7.189   2.992
    6   HG21  ILE  67          HG21      ILE  67 -24.708   8.224   0.025
    7   HG23  ILE  67          HG22      ILE  67 -25.240   6.544   0.059
    8   HG22  ILE  67          HG23      ILE  67 -23.552   6.926  -0.273
    9   HD12  ILE  67          HD11      ILE  67 -21.851   5.471   0.620
   10   HD11  ILE  67          HD12      ILE  67 -22.826   4.828   1.939
   11   HD13  ILE  67          HD13      ILE  67 -21.180   5.380   2.248

  No H/Q in entry =          11
  In of MODEL   35
    1    H    GLN  68           H        GLN  68 -26.717   8.044   3.712
    2    HA   GLN  68           HA       GLN  68 -28.603   8.896   1.756
    3    HB2  GLN  68           HB2      GLN  68 -28.825   8.491   4.735
    4    HB3  GLN  68           HB3      GLN  68 -30.179   9.024   3.754
    5    HG2  GLN  68           HG2      GLN  68 -30.103   7.010   2.455
    6    HG3  GLN  68           HG3      GLN  68 -28.620   6.505   3.244
    7   HE21  GLN  68          HE21      GLN  68 -30.723   5.032   3.100
    8   HE22  GLN  68          HE22      GLN  68 -31.519   4.515   4.514

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ARG  69           H        ARG  69 -27.076  10.615   4.506
    2    HA   ARG  69           HA       ARG  69 -28.574  13.025   4.136
    3    HB2  ARG  69           HB2      ARG  69 -26.176  12.203   5.704
    4    HB3  ARG  69           HB3      ARG  69 -26.349  13.921   5.367
    5    HG2  ARG  69           HG2      ARG  69 -28.660  13.828   6.348
    6    HG3  ARG  69           HG3      ARG  69 -28.360  12.146   6.801
    7    HD2  ARG  69           HD2      ARG  69 -26.791  14.577   7.736
    8    HD3  ARG  69           HD3      ARG  69 -27.865  13.600   8.724
    9    HE   ARG  69           HE       ARG  69 -25.212  12.821   7.753
   10   HH21  ARG  69          HH11      ARG  69 -24.304  11.089   8.924
   11   HH22  ARG  69          HH12      ARG  69 -25.283  10.206  10.047
   12   HH11  ARG  69          HH21      ARG  69 -28.127  12.096   9.456
   13   HH12  ARG  69          HH22      ARG  69 -27.447  10.773  10.346

  No H/Q in entry =          13
  In of MODEL   35
    1    H    LEU  70           H        LEU  70 -25.640  11.789   2.747
    2    HA   LEU  70           HA       LEU  70 -24.659  14.224   1.604
    3    HB2  LEU  70           HB2      LEU  70 -23.540  11.956   2.166
    4    HB3  LEU  70           HB3      LEU  70 -24.137  11.478   0.578
    5    HG   LEU  70           HG       LEU  70 -22.624  12.945  -0.497
    6   HD11  LEU  70          HD11      LEU  70 -21.833  13.798   2.297
    7   HD13  LEU  70          HD12      LEU  70 -22.589  14.808   1.065
    8   HD12  LEU  70          HD13      LEU  70 -20.944  14.216   0.830
    9   HD22  LEU  70          HD21      LEU  70 -21.101  11.303  -0.292
   10   HD21  LEU  70          HD22      LEU  70 -21.991  10.717   1.113
   11   HD23  LEU  70          HD23      LEU  70 -20.664  11.857   1.324

  No H/Q in entry =          11
  In of MODEL   35
    1    H    LEU  71           H        LEU  71 -26.680  11.586   0.466
    2    HA   LEU  71           HA       LEU  71 -27.295  13.073  -2.029
    3    HB2  LEU  71           HB2      LEU  71 -27.343  10.078  -1.618
    4    HB3  LEU  71           HB3      LEU  71 -27.524  10.948  -3.141
    5    HG   LEU  71           HG       LEU  71 -24.999  11.072  -1.490
    6   HD12  LEU  71          HD11      LEU  71 -24.980   9.473  -3.942
    7   HD11  LEU  71          HD12      LEU  71 -25.950   8.782  -2.642
    8   HD13  LEU  71          HD13      LEU  71 -24.247   9.147  -2.372
    9   HD22  LEU  71          HD21      LEU  71 -25.203  12.898  -2.961
   10   HD21  LEU  71          HD22      LEU  71 -25.653  11.847  -4.304
   11   HD23  LEU  71          HD23      LEU  71 -24.023  11.776  -3.635

  No H/Q in entry =          11
  In of MODEL   35
    1    HA   PRO  72           HA       PRO  72 -31.120  12.396   0.603
    2    HB2  PRO  72           HB2      PRO  72 -32.107  14.911   0.557
    3    HB3  PRO  72           HB3      PRO  72 -30.771  14.512   1.637
    4    HG2  PRO  72           HG2      PRO  72 -30.660  15.749  -1.102
    5    HG3  PRO  72           HG3      PRO  72 -29.914  16.320   0.390
    6    HD2  PRO  72           HD2      PRO  72 -28.509  14.852  -1.401
    7    HD3  PRO  72           HD3      PRO  72 -28.237  14.678   0.332

  No H/Q in entry =           7
  In of MODEL   35
    1    H    ASN  73           H        ASN  73 -30.561  13.420  -2.602
    2    HA   ASN  73           HA       ASN  73 -33.406  12.975  -3.225
    3    HB2  ASN  73           HB2      ASN  73 -33.007  14.129  -5.311
    4    HB3  ASN  73           HB3      ASN  73 -32.526  15.118  -3.941
    5   HD21  ASN  73          HD21      ASN  73 -31.748  15.234  -6.620
    6   HD22  ASN  73          HD22      ASN  73 -30.075  15.159  -6.822

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LYS  74           H        LYS  74 -31.314  10.817  -2.837
    2    HA   LYS  74           HA       LYS  74 -31.824   9.425  -5.399
    3    HB2  LYS  74           HB2      LYS  74 -29.272   9.240  -3.793
    4    HB3  LYS  74           HB3      LYS  74 -29.622   8.428  -5.319
    5    HG2  LYS  74           HG2      LYS  74 -29.503  11.404  -5.082
    6    HG3  LYS  74           HG3      LYS  74 -28.080  10.415  -5.406
    7    HD2  LYS  74           HD2      LYS  74 -29.160   9.456  -7.355
    8    HD3  LYS  74           HD3      LYS  74 -30.625  10.379  -7.017
    9    HE2  LYS  74           HE2      LYS  74 -29.501  12.448  -7.439
   10    HE3  LYS  74           HE3      LYS  74 -27.940  11.635  -7.548
   11    HZ2  LYS  74           HZ1      LYS  74 -29.448  12.190  -9.660
   12    HZ1  LYS  74           HZ2      LYS  74 -30.026  10.633  -9.302
   13    HZ3  LYS  74           HZ3      LYS  74 -28.372  10.878  -9.605

  No H/Q in entry =          13
  In of MODEL   35
    1    HA   PRO  75           HA       PRO  75 -33.056   6.341  -2.458
    2    HB2  PRO  75           HB2      PRO  75 -33.266   4.129  -4.067
    3    HB3  PRO  75           HB3      PRO  75 -34.456   5.429  -4.114
    4    HG2  PRO  75           HG2      PRO  75 -32.101   4.967  -5.903
    5    HG3  PRO  75           HG3      PRO  75 -33.772   5.328  -6.338
    6    HD2  PRO  75           HD2      PRO  75 -31.923   7.285  -6.280
    7    HD3  PRO  75           HD3      PRO  75 -33.570   7.599  -5.730

  No H/Q in entry =           7
  In of MODEL   35
    1    H    VAL  76           H        VAL  76 -31.547   5.342  -1.105
    2    HA   VAL  76           HA       VAL  76 -29.033   4.266  -2.237
    3    HB   VAL  76           HB       VAL  76 -29.378   5.685   0.440
    4   HG11  VAL  76          HG11      VAL  76 -26.968   4.530  -0.978
    5   HG13  VAL  76          HG12      VAL  76 -27.635   4.029   0.577
    6   HG12  VAL  76          HG13      VAL  76 -26.866   5.607   0.416
    7   HG22  VAL  76          HG21      VAL  76 -28.807   7.626  -0.428
    8   HG21  VAL  76          HG22      VAL  76 -29.322   6.924  -1.962
    9   HG23  VAL  76          HG23      VAL  76 -27.616   6.912  -1.515

  No H/Q in entry =           9
  In of MODEL   35
    1    H    GLU  77           H        GLU  77 -28.708   2.117  -1.651
    2    HA   GLU  77           HA       GLU  77 -29.444   1.263   0.997
    3    HB2  GLU  77           HB2      GLU  77 -30.972  -0.455   0.453
    4    HB3  GLU  77           HB3      GLU  77 -31.597   1.048  -0.229
    5    HG2  GLU  77           HG2      GLU  77 -30.963   0.346  -2.427
    6    HG3  GLU  77           HG3      GLU  77 -30.246  -1.126  -1.775

  No H/Q in entry =           6
  In of MODEL   35
    1    H    VAL  78           H        VAL  78 -29.012  -0.814   1.630
    2    HA   VAL  78           HA       VAL  78 -26.316  -1.445   0.721
    3    HB   VAL  78           HB       VAL  78 -27.968  -2.438   3.084
    4   HG11  VAL  78          HG11      VAL  78 -25.577  -3.538   1.934
    5   HG13  VAL  78          HG12      VAL  78 -26.454  -4.069   3.371
    6   HG12  VAL  78          HG13      VAL  78 -25.192  -2.847   3.510
    7   HG22  VAL  78          HG21      VAL  78 -26.571  -1.022   4.432
    8   HG21  VAL  78          HG22      VAL  78 -27.359  -0.074   3.171
    9   HG23  VAL  78          HG23      VAL  78 -25.660  -0.517   3.009

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ILE  79           H        ILE  79 -25.691  -3.314  -0.208
    2    HA   ILE  79           HA       ILE  79 -27.684  -4.875  -1.565
    3    HB   ILE  79           HB       ILE  79 -24.670  -5.257  -1.362
    4   HG12  ILE  79          HG12      ILE  79 -26.369  -4.208  -3.630
    5   HG13  ILE  79          HG13      ILE  79 -25.539  -3.170  -2.469
    6   HG22  ILE  79          HG21      ILE  79 -25.724  -6.462  -3.690
    7   HG21  ILE  79          HG22      ILE  79 -26.676  -7.047  -2.325
    8   HG23  ILE  79          HG23      ILE  79 -24.922  -7.240  -2.325
    9   HD13  ILE  79          HD11      ILE  79 -24.130  -3.194  -4.295
   10   HD12  ILE  79          HD12      ILE  79 -24.387  -4.913  -4.594
   11   HD11  ILE  79          HD13      ILE  79 -23.421  -4.393  -3.212

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ASP  80           H        ASP  80 -28.451  -6.844  -1.001
    2    HA   ASP  80           HA       ASP  80 -28.342  -7.771   1.635
    3    HB2  ASP  80           HB2      ASP  80 -30.073  -8.413  -0.004
    4    HB3  ASP  80           HB3      ASP  80 -28.871  -9.353  -0.889

  No H/Q in entry =           4
  In of MODEL   35
    1    H    SER  81           H        SER  81 -26.747  -8.842   2.745
    2    HA   SER  81           HA       SER  81 -24.226  -9.389   1.536
    3    HB2  SER  81           HB2      SER  81 -23.616 -10.415   3.692
    4    HB3  SER  81           HB3      SER  81 -24.391  -8.849   3.926
    5    HG   SER  81           HG       SER  81 -26.337  -9.997   4.320

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU  82           H        LEU  82 -26.830 -11.613   1.845
    2    HA   LEU  82           HA       LEU  82 -25.171 -13.897   1.291
    3    HB2  LEU  82           HB2      LEU  82 -28.135 -13.423   1.053
    4    HB3  LEU  82           HB3      LEU  82 -27.354 -14.987   0.824
    5    HG   LEU  82           HG       LEU  82 -27.361 -13.431   3.393
    6   HD13  LEU  82          HD11      LEU  82 -29.600 -14.172   2.959
    7   HD12  LEU  82          HD12      LEU  82 -28.891 -15.318   4.097
    8   HD11  LEU  82          HD13      LEU  82 -29.030 -15.743   2.391
    9   HD22  LEU  82          HD21      LEU  82 -25.447 -14.781   3.359
   10   HD21  LEU  82          HD22      LEU  82 -26.255 -16.059   2.454
   11   HD23  LEU  82          HD23      LEU  82 -26.647 -15.801   4.154

  No H/Q in entry =          11
  In of MODEL   35
    1    H    LEU  83           H        LEU  83 -27.244 -11.748  -0.595
    2    HA   LEU  83           HA       LEU  83 -26.988 -13.067  -3.082
    3    HB2  LEU  83           HB2      LEU  83 -27.537 -10.190  -2.399
    4    HB3  LEU  83           HB3      LEU  83 -27.545 -10.818  -4.047
    5    HG   LEU  83           HG       LEU  83 -29.547 -11.327  -1.867
    6   HD13  LEU  83          HD11      LEU  83 -30.397  -9.507  -2.907
    7   HD12  LEU  83          HD12      LEU  83 -30.811 -10.627  -4.203
    8   HD11  LEU  83          HD13      LEU  83 -29.322  -9.687  -4.292
    9   HD23  LEU  83          HD21      LEU  83 -29.637 -12.560  -4.606
   10   HD22  LEU  83          HD22      LEU  83 -30.582 -12.973  -3.175
   11   HD21  LEU  83          HD23      LEU  83 -28.872 -13.393  -3.252

  No H/Q in entry =          11
  In of MODEL   35
    1    H    TYR  84           H        TYR  84 -25.146 -10.609  -1.386
    2    HA   TYR  84           HA       TYR  84 -23.319 -10.008  -3.519
    3    HB2  TYR  84           HB2      TYR  84 -23.875  -8.536  -1.528
    4    HB3  TYR  84           HB3      TYR  84 -22.887  -9.624  -0.555
    5    HD1  TYR  84           HD1      TYR  84 -20.437  -9.987  -1.369
    6    HD2  TYR  84           HD2      TYR  84 -22.876  -6.692  -2.562
    7    HE1  TYR  84           HE1      TYR  84 -18.407  -8.736  -2.019
    8    HE2  TYR  84           HE2      TYR  84 -20.856  -5.434  -3.225
    9    HH   TYR  84           HH       TYR  84 -17.868  -6.858  -3.636

  No H/Q in entry =           9
  In of MODEL   35
    1    H    GLY  85           H        GLY  85 -22.969 -12.028  -0.596
    2    HA3  GLY  85           HA2      GLY  85 -20.350 -12.840  -1.100
    3    HA2  GLY  85           HA3      GLY  85 -21.534 -13.756  -0.167

  No H/Q in entry =           3
  In of MODEL   35
    1    H    LYS  86           H        LYS  86 -23.371 -14.195  -2.224
    2    HA   LYS  86           HA       LYS  86 -22.209 -16.501  -3.513
    3    HB2  LYS  86           HB2      LYS  86 -24.921 -15.182  -3.554
    4    HB3  LYS  86           HB3      LYS  86 -24.553 -16.689  -4.392
    5    HG2  LYS  86           HG2      LYS  86 -24.126 -17.767  -2.271
    6    HG3  LYS  86           HG3      LYS  86 -24.478 -16.259  -1.429
    7    HD2  LYS  86           HD2      LYS  86 -26.724 -16.226  -2.404
    8    HD3  LYS  86           HD3      LYS  86 -26.374 -17.715  -3.279
    9    HE2  LYS  86           HE2      LYS  86 -26.088 -18.899  -1.162
   10    HE3  LYS  86           HE3      LYS  86 -26.419 -17.409  -0.280
   11    HZ3  LYS  86           HZ1      LYS  86 -28.593 -17.679  -0.557
   12    HZ2  LYS  86           HZ2      LYS  86 -28.270 -19.241  -1.144
   13    HZ1  LYS  86           HZ3      LYS  86 -28.430 -17.943  -2.227

  No H/Q in entry =          13
  In of MODEL   35
    1    H    VAL  87           H        VAL  87 -22.357 -13.280  -4.372
    2    HA   VAL  87           HA       VAL  87 -22.126 -12.073  -6.302
    3    HB   VAL  87           HB       VAL  87 -20.937 -14.524  -7.639
    4   HG12  VAL  87          HG11      VAL  87 -19.850 -11.729  -7.732
    5   HG11  VAL  87          HG12      VAL  87 -21.291 -12.119  -8.672
    6   HG13  VAL  87          HG13      VAL  87 -19.786 -12.992  -8.961
    7   HG23  VAL  87          HG21      VAL  87 -19.527 -12.765  -5.639
    8   HG22  VAL  87          HG22      VAL  87 -18.782 -14.021  -6.625
    9   HG21  VAL  87          HG23      VAL  87 -19.970 -14.453  -5.398

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ASP  88           H        ASP  88 -24.605 -12.840  -5.946
    2    HA   ASP  88           HA       ASP  88 -25.677 -14.084  -8.352
    3    HB2  ASP  88           HB2      ASP  88 -26.648 -14.403  -6.026
    4    HB3  ASP  88           HB3      ASP  88 -27.184 -12.725  -6.105

  No H/Q in entry =           4
  In of MODEL   35
    1    H    GLY  89           H        GLY  89 -25.044 -12.776  -9.982
    2    HA3  GLY  89           HA2      GLY  89 -25.362 -10.014 -10.152
    3    HA2  GLY  89           HA3      GLY  89 -25.289 -11.117 -11.525

  No H/Q in entry =           3
  In of MODEL   35
    1    H    LEU  90           H        LEU  90 -27.664 -12.592 -11.080
    2    HA   LEU  90           HA       LEU  90 -29.574 -10.737 -12.165
    3    HB2  LEU  90           HB2      LEU  90 -29.524 -13.127 -12.770
    4    HB3  LEU  90           HB3      LEU  90 -30.003 -13.536 -11.123
    5    HG   LEU  90           HG       LEU  90 -32.176 -12.520 -11.464
    6   HD13  LEU  90          HD11      LEU  90 -32.090 -10.757 -12.921
    7   HD12  LEU  90          HD12      LEU  90 -32.574 -12.007 -14.069
    8   HD11  LEU  90          HD13      LEU  90 -30.881 -11.530 -13.948
    9   HD23  LEU  90          HD21      LEU  90 -32.039 -14.119 -13.917
   10   HD22  LEU  90          HD22      LEU  90 -33.002 -14.347 -12.457
   11   HD21  LEU  90          HD23      LEU  90 -31.319 -14.877 -12.497

  No H/Q in entry =          11
  In of MODEL   35
    1    H    GLY  91           H        GLY  91 -29.316 -12.261  -8.997
    2    HA3  GLY  91           HA2      GLY  91 -31.701 -11.277  -7.934
    3    HA2  GLY  91           HA3      GLY  91 -30.279 -11.750  -7.005

  No H/Q in entry =           3
  In of MODEL   35
    1    H    VAL  92           H        VAL  92 -28.458  -9.822  -7.850
    2    HA   VAL  92           HA       VAL  92 -29.354  -7.580  -6.273
    3    HB   VAL  92           HB       VAL  92 -26.796  -7.906  -7.886
    4   HG12  VAL  92          HG11      VAL  92 -27.042  -6.055  -5.538
    5   HG11  VAL  92          HG12      VAL  92 -27.741  -5.529  -7.071
    6   HG13  VAL  92          HG13      VAL  92 -26.023  -5.913  -6.972
    7   HG22  VAL  92          HG21      VAL  92 -26.486  -9.497  -6.312
    8   HG21  VAL  92          HG22      VAL  92 -27.663  -8.786  -5.205
    9   HG23  VAL  92          HG23      VAL  92 -26.041  -8.103  -5.328

  No H/Q in entry =           9
  In of MODEL   35
    1    H    LEU  93           H        LEU  93 -28.933  -8.184  -9.702
    2    HA   LEU  93           HA       LEU  93 -29.413  -5.560 -10.602
    3    HB2  LEU  93           HB2      LEU  93 -28.689  -7.364 -12.086
    4    HB3  LEU  93           HB3      LEU  93 -30.241  -8.172 -11.863
    5    HG   LEU  93           HG       LEU  93 -31.354  -6.251 -12.962
    6   HD11  LEU  93          HD11      LEU  93 -29.582  -4.571 -12.450
    7   HD13  LEU  93          HD12      LEU  93 -30.029  -4.605 -14.156
    8   HD12  LEU  93          HD13      LEU  93 -28.534  -5.371 -13.621
    9   HD23  LEU  93          HD21      LEU  93 -30.301  -6.742 -15.260
   10   HD22  LEU  93          HD22      LEU  93 -31.075  -8.048 -14.363
   11   HD21  LEU  93          HD23      LEU  93 -29.315  -7.904 -14.373

  No H/Q in entry =          11
  In of MODEL   35
    1    H    LYS  94           H        LYS  94 -31.655  -8.229  -9.768
    2    HA   LYS  94           HA       LYS  94 -34.071  -6.899 -10.366
    3    HB2  LYS  94           HB2      LYS  94 -33.439  -9.077  -8.380
    4    HB3  LYS  94           HB3      LYS  94 -35.069  -8.459  -8.632
    5    HG2  LYS  94           HG2      LYS  94 -34.958  -9.205 -10.975
    6    HG3  LYS  94           HG3      LYS  94 -33.360  -9.880 -10.663
    7    HD2  LYS  94           HD2      LYS  94 -34.402 -11.287  -8.846
    8    HD3  LYS  94           HD3      LYS  94 -35.980 -10.712  -9.387
    9    HE2  LYS  94           HE2      LYS  94 -35.431 -11.590 -11.667
   10    HE3  LYS  94           HE3      LYS  94 -33.975 -12.310 -10.978
   11    HZ3  LYS  94           HZ1      LYS  94 -35.748 -13.920 -11.155
   12    HZ2  LYS  94           HZ2      LYS  94 -36.766 -12.952 -10.198
   13    HZ1  LYS  94           HZ3      LYS  94 -35.367 -13.640  -9.524

  No H/Q in entry =          13
  In of MODEL   35
    1    H    ALA  95           H        ALA  95 -32.227  -6.961  -7.327
    2    HA   ALA  95           HA       ALA  95 -34.145  -5.491  -5.822
    3    HB2  ALA  95           HB1      ALA  95 -31.700  -6.752  -5.311
    4    HB3  ALA  95           HB2      ALA  95 -32.716  -5.908  -4.144
    5    HB1  ALA  95           HB3      ALA  95 -31.414  -5.047  -4.963

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA  96           H        ALA  96 -31.560  -4.485  -7.923
    2    HA   ALA  96           HA       ALA  96 -31.596  -1.730  -7.119
    3    HB2  ALA  96           HB1      ALA  96 -30.258  -1.414  -9.233
    4    HB3  ALA  96           HB2      ALA  96 -30.479  -3.132  -9.570
    5    HB1  ALA  96           HB3      ALA  96 -29.581  -2.623  -8.140

  No H/Q in entry =           5
  In of MODEL   35
    1    H    VAL  97           H        VAL  97 -33.056  -3.489  -9.817
    2    HA   VAL  97           HA       VAL  97 -34.245  -1.231 -11.041
    3    HB   VAL  97           HB       VAL  97 -34.910  -4.193 -11.112
    4   HG11  VAL  97          HG11      VAL  97 -36.801  -2.271 -11.566
    5   HG13  VAL  97          HG12      VAL  97 -36.787  -3.856 -12.340
    6   HG12  VAL  97          HG13      VAL  97 -36.104  -2.463 -13.176
    7   HG21  VAL  97          HG21      VAL  97 -33.733  -2.283 -13.133
    8   HG23  VAL  97          HG22      VAL  97 -34.106  -3.980 -13.439
    9   HG22  VAL  97          HG23      VAL  97 -32.871  -3.545 -12.256

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ALA  98           H        ALA  98 -35.306  -3.492  -8.523
    2    HA   ALA  98           HA       ALA  98 -37.917  -2.472  -8.146
    3    HB1  ALA  98           HB1      ALA  98 -36.793  -4.632  -7.143
    4    HB3  ALA  98           HB2      ALA  98 -38.011  -3.775  -6.195
    5    HB2  ALA  98           HB3      ALA  98 -36.298  -3.548  -5.844

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA  99           H        ALA  99 -34.870  -1.546  -6.506
    2    HA   ALA  99           HA       ALA  99 -36.083   0.364  -4.817
    3    HB1  ALA  99           HB1      ALA  99 -33.400  -0.390  -5.587
    4    HB2  ALA  99           HB2      ALA  99 -33.977   0.316  -4.077
    5    HB3  ALA  99           HB3      ALA  99 -33.557   1.360  -5.435

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ILE 100           H        ILE 100 -35.069   0.581  -8.176
    2    HA   ILE 100           HA       ILE 100 -35.384   3.420  -8.361
    3    HB   ILE 100           HB       ILE 100 -35.390   1.288 -10.524
    4   HG12  ILE 100          HG12      ILE 100 -33.319   3.372  -9.841
    5   HG13  ILE 100          HG13      ILE 100 -33.273   1.718  -9.231
    6   HG21  ILE 100          HG21      ILE 100 -35.950   4.186 -10.618
    7   HG23  ILE 100          HG22      ILE 100 -36.402   2.907 -11.747
    8   HG22  ILE 100          HG23      ILE 100 -34.782   3.600 -11.803
    9   HD12  ILE 100          HD11      ILE 100 -32.803   2.731 -11.995
   10   HD11  ILE 100          HD12      ILE 100 -33.386   1.083 -11.757
   11   HD13  ILE 100          HD13      ILE 100 -31.858   1.591 -11.039

  No H/Q in entry =          11
  In of MODEL   35
    1    H    LYS 101           H        LYS 101 -37.557   0.715  -9.106
    2    HA   LYS 101           HA       LYS 101 -39.719   2.276 -10.075
    3    HB2  LYS 101           HB2      LYS 101 -39.467  -0.503  -8.981
    4    HB3  LYS 101           HB3      LYS 101 -41.054   0.190  -9.309
    5    HG2  LYS 101           HG2      LYS 101 -40.600   0.372 -11.607
    6    HG3  LYS 101           HG3      LYS 101 -38.886   0.045 -11.366
    7    HD2  LYS 101           HD2      LYS 101 -40.050  -1.910 -12.267
    8    HD3  LYS 101           HD3      LYS 101 -39.399  -2.229 -10.660
    9    HE2  LYS 101           HE2      LYS 101 -41.424  -3.026 -10.151
   10    HE3  LYS 101           HE3      LYS 101 -41.960  -1.344 -10.132
   11    HZ3  LYS 101           HZ1      LYS 101 -42.856  -1.518 -12.246
   12    HZ2  LYS 101           HZ2      LYS 101 -43.243  -3.020 -11.554
   13    HZ1  LYS 101           HZ3      LYS 101 -41.947  -2.898 -12.643

  No H/Q in entry =          13
  In of MODEL   35
    1    H    LYS 102           H        LYS 102 -39.140   0.786  -6.887
    2    HA   LYS 102           HA       LYS 102 -41.434   1.861  -5.663
    3    HB2  LYS 102           HB2      LYS 102 -40.106   0.042  -4.677
    4    HB3  LYS 102           HB3      LYS 102 -38.765   1.158  -4.428
    5    HG2  LYS 102           HG2      LYS 102 -40.137   2.472  -2.907
    6    HG3  LYS 102           HG3      LYS 102 -41.481   1.360  -3.159
    7    HD2  LYS 102           HD2      LYS 102 -40.164  -0.459  -2.161
    8    HD3  LYS 102           HD3      LYS 102 -38.819   0.655  -1.908
    9    HE2  LYS 102           HE2      LYS 102 -40.233   2.051  -0.475
   10    HE3  LYS 102           HE3      LYS 102 -41.597   0.968  -0.749
   11    HZ1  LYS 102           HZ1      LYS 102 -39.790  -0.717   0.225
   12    HZ3  LYS 102           HZ2      LYS 102 -40.936   0.105   1.171
   13    HZ2  LYS 102           HZ3      LYS 102 -39.352   0.706   1.042

  No H/Q in entry =          13
  In of MODEL   35
    1    H    ALA 103           H        ALA 103 -38.553   3.401  -6.673
    2    HA   ALA 103           HA       ALA 103 -38.874   5.681  -4.862
    3    HB2  ALA 103           HB1      ALA 103 -36.928   6.526  -6.439
    4    HB3  ALA 103           HB2      ALA 103 -36.815   4.817  -6.858
    5    HB1  ALA 103           HB3      ALA 103 -36.603   5.330  -5.185

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA 104           H        ALA 104 -39.478   4.962  -8.214
    2    HA   ALA 104           HA       ALA 104 -40.197   7.723  -8.800
    3    HB2  ALA 104           HB1      ALA 104 -40.220   7.080 -11.010
    4    HB1  ALA 104           HB2      ALA 104 -40.872   5.482 -10.647
    5    HB3  ALA 104           HB3      ALA 104 -39.162   5.822 -10.373

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA 105           H        ALA 105 -41.696   5.524  -7.013
    2    HA   ALA 105           HA       ALA 105 -44.182   6.802  -6.957
    3    HB2  ALA 105           HB1      ALA 105 -44.896   5.933  -9.002
    4    HB3  ALA 105           HB2      ALA 105 -45.471   4.703  -7.878
    5    HB1  ALA 105           HB3      ALA 105 -43.992   4.434  -8.798

  No H/Q in entry =           5
  In of MODEL   36
    1    H1   ALA   1           H3       ALA   1 -12.353 -15.583  -2.268
    2    H2   ALA   1           H2       ALA   1 -11.426 -16.727  -3.122
    3    H3   ALA   1           H1       ALA   1 -12.571 -15.771  -3.941
    4    HA   ALA   1           HA       ALA   1 -13.979 -17.464  -3.696
    5    HB3  ALA   1           HB1      ALA   1 -12.591 -19.246  -3.255
    6    HB1  ALA   1           HB2      ALA   1 -13.332 -19.136  -1.658
    7    HB2  ALA   1           HB3      ALA   1 -11.754 -18.405  -1.950

  No H/Q in entry =           7
  In of MODEL   36
    1    H    GLU   2           H        GLU   2 -15.593 -18.315  -2.031
    2    HA   GLU   2           HA       GLU   2 -17.220 -16.589  -0.949
    3    HB2  GLU   2           HB2      GLU   2 -16.282 -19.027   0.576
    4    HB3  GLU   2           HB3      GLU   2 -17.798 -18.168   0.847
    5    HG2  GLU   2           HG2      GLU   2 -18.801 -19.240  -0.883
    6    HG3  GLU   2           HG3      GLU   2 -17.485 -18.843  -1.978

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLU   3           H        GLU   3 -15.293 -17.966   1.650
    2    HA   GLU   3           HA       GLU   3 -15.485 -15.618   3.220
    3    HB2  GLU   3           HB2      GLU   3 -13.914 -18.177   3.445
    4    HB3  GLU   3           HB3      GLU   3 -13.663 -16.864   4.595
    5    HG2  GLU   3           HG2      GLU   3 -15.850 -17.005   5.433
    6    HG3  GLU   3           HG3      GLU   3 -16.464 -17.794   3.986

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LEU   4           H        LEU   4 -12.552 -17.110   1.796
    2    HA   LEU   4           HA       LEU   4 -10.700 -15.222   2.386
    3    HB2  LEU   4           HB2      LEU   4 -10.964 -16.506  -0.343
    4    HB3  LEU   4           HB3      LEU   4  -9.501 -15.798   0.333
    5    HG   LEU   4           HG       LEU   4 -11.001 -18.190   1.448
    6   HD13  LEU   4          HD11      LEU   4  -9.386 -19.553   0.498
    7   HD12  LEU   4          HD12      LEU   4  -8.168 -18.278   0.466
    8   HD11  LEU   4          HD13      LEU   4  -9.467 -18.286  -0.725
    9   HD23  LEU   4          HD21      LEU   4  -8.738 -18.275   2.809
   10   HD22  LEU   4          HD22      LEU   4 -10.047 -17.229   3.355
   11   HD21  LEU   4          HD23      LEU   4  -8.688 -16.545   2.463

  No H/Q in entry =          11
  In of MODEL   36
    1    H    GLU   5           H        GLU   5 -13.057 -14.987  -0.266
    2    HA   GLU   5           HA       GLU   5 -12.046 -12.506  -1.265
    3    HB2  GLU   5           HB2      GLU   5 -13.417 -14.082  -2.618
    4    HB3  GLU   5           HB3      GLU   5 -14.806 -13.703  -1.598
    5    HG2  GLU   5           HG2      GLU   5 -14.955 -12.310  -3.559
    6    HG3  GLU   5           HG3      GLU   5 -14.490 -11.278  -2.207

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLU   6           H        GLU   6 -14.758 -13.375   0.848
    2    HA   GLU   6           HA       GLU   6 -15.641 -10.695   1.267
    3    HB2  GLU   6           HB2      GLU   6 -17.069 -12.691   1.669
    4    HB3  GLU   6           HB3      GLU   6 -16.036 -13.127   3.030
    5    HG2  GLU   6           HG2      GLU   6 -17.930 -11.925   3.916
    6    HG3  GLU   6           HG3      GLU   6 -16.530 -10.862   4.022

  No H/Q in entry =           6
  In of MODEL   36
    1    H    VAL   7           H        VAL   7 -13.335 -12.828   2.809
    2    HA   VAL   7           HA       VAL   7 -12.837 -11.267   5.139
    3    HB   VAL   7           HB       VAL   7 -11.160 -13.315   3.665
    4   HG11  VAL   7          HG11      VAL   7 -10.659 -11.797   6.232
    5   HG13  VAL   7          HG12      VAL   7  -9.572 -12.013   4.860
    6   HG12  VAL   7          HG13      VAL   7  -9.925 -13.372   5.927
    7   HG21  VAL   7          HG21      VAL   7 -13.404 -13.870   4.902
    8   HG23  VAL   7          HG22      VAL   7 -12.462 -13.609   6.371
    9   HG22  VAL   7          HG23      VAL   7 -11.987 -14.867   5.231

  No H/Q in entry =           9
  In of MODEL   36
    1    H    VAL   8           H        VAL   8 -11.355 -11.377   1.915
    2    HA   VAL   8           HA       VAL   8  -9.275  -9.521   2.398
    3    HB   VAL   8           HB       VAL   8 -10.758 -10.262  -0.130
    4   HG13  VAL   8          HG11      VAL   8  -9.960  -8.058  -0.547
    5   HG12  VAL   8          HG12      VAL   8  -8.735  -9.124  -1.235
    6   HG11  VAL   8          HG13      VAL   8  -8.457  -8.355   0.326
    7   HG23  VAL   8          HG21      VAL   8  -7.856 -10.840   0.492
    8   HG22  VAL   8          HG22      VAL   8  -8.968 -11.730  -0.544
    9   HG21  VAL   8          HG23      VAL   8  -9.106 -11.859   1.207

  No H/Q in entry =           9
  In of MODEL   36
    1    H    MET   9           H        MET   9 -12.627  -9.103   1.269
    2    HA   MET   9           HA       MET   9 -12.549  -6.325   0.846
    3    HB2  MET   9           HB2      MET   9 -14.766  -8.193   1.681
    4    HB3  MET   9           HB3      MET   9 -15.039  -6.460   1.486
    5    HG2  MET   9           HG2      MET   9 -14.228  -6.579  -0.833
    6    HG3  MET   9           HG3      MET   9 -13.924  -8.306  -0.644
    7    HE1  MET   9           HE1      MET   9 -16.175  -5.475  -0.332
    8    HE3  MET   9           HE2      MET   9 -17.381  -6.266   0.680
    9    HE2  MET   9           HE3      MET   9 -17.735  -5.950  -1.017

  No H/Q in entry =           9
  In of MODEL   36
    1    H    GLY  10           H        GLY  10 -13.199  -8.225   3.771
    2    HA3  GLY  10           HA2      GLY  10 -13.718  -6.044   5.504
    3    HA2  GLY  10           HA3      GLY  10 -13.159  -7.639   6.006

  No H/Q in entry =           3
  In of MODEL   36
    1    H    LEU  11           H        LEU  11 -10.726  -7.773   4.669
    2    HA   LEU  11           HA       LEU  11  -9.001  -6.358   6.417
    3    HB2  LEU  11           HB2      LEU  11  -8.486  -7.774   3.799
    4    HB3  LEU  11           HB3      LEU  11  -7.203  -7.082   4.790
    5    HG   LEU  11           HG       LEU  11  -9.209  -9.107   5.815
    6   HD13  LEU  11          HD11      LEU  11  -8.009 -10.344   4.234
    7   HD12  LEU  11          HD12      LEU  11  -7.063 -10.595   5.700
    8   HD11  LEU  11          HD13      LEU  11  -6.525  -9.428   4.493
    9   HD22  LEU  11          HD21      LEU  11  -8.333  -8.108   7.728
   10   HD21  LEU  11          HD22      LEU  11  -6.800  -7.712   6.954
   11   HD23  LEU  11          HD23      LEU  11  -7.131  -9.369   7.459

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  12           H        ILE  12  -9.929  -5.790   3.038
    2    HA   ILE  12           HA       ILE  12  -8.227  -3.569   2.607
    3    HB   ILE  12           HB       ILE  12 -10.883  -4.267   1.332
    4   HG12  ILE  12          HG12      ILE  12  -8.837  -5.863   1.178
    5   HG13  ILE  12          HG13      ILE  12  -9.659  -5.437  -0.309
    6   HG22  ILE  12          HG21      ILE  12 -10.010  -2.806  -0.547
    7   HG21  ILE  12          HG22      ILE  12  -8.760  -2.241   0.554
    8   HG23  ILE  12          HG23      ILE  12 -10.440  -1.956   0.906
    9   HD13  ILE  12          HD11      ILE  12  -7.935  -3.805  -0.822
   10   HD12  ILE  12          HD12      ILE  12  -7.163  -5.347  -0.458
   11   HD11  ILE  12          HD13      ILE  12  -7.173  -4.069   0.734

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  13           H        ILE  13 -11.580  -3.821   3.728
    2    HA   ILE  13           HA       ILE  13 -12.022  -1.033   4.014
    3    HB   ILE  13           HB       ILE  13 -13.229  -3.455   5.370
    4   HG12  ILE  13          HG12      ILE  13 -13.474  -2.877   2.838
    5   HG13  ILE  13          HG13      ILE  13 -14.890  -3.350   3.753
    6   HG22  ILE  13          HG21      ILE  13 -15.124  -1.716   5.875
    7   HG21  ILE  13          HG22      ILE  13 -13.839  -0.523   5.742
    8   HG23  ILE  13          HG23      ILE  13 -13.733  -1.798   6.953
    9   HD11  ILE  13          HD11      ILE  13 -14.098  -0.459   3.337
   10   HD13  ILE  13          HD12      ILE  13 -15.598  -1.084   3.995
   11   HD12  ILE  13          HD13      ILE  13 -15.236  -1.327   2.301

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ASN  14           H        ASN  14 -10.905  -3.539   6.268
    2    HA   ASN  14           HA       ASN  14 -10.676  -1.912   8.559
    3    HB2  ASN  14           HB2      ASN  14 -10.440  -4.520   8.223
    4    HB3  ASN  14           HB3      ASN  14  -8.730  -4.141   8.053
    5   HD21  ASN  14          HD21      ASN  14  -9.356  -5.671  10.228
    6   HD22  ASN  14          HD22      ASN  14  -9.311  -4.758  11.656

  No H/Q in entry =           6
  In of MODEL   36
    1    H    SER  15           H        SER  15  -8.299  -2.737   6.043
    2    HA   SER  15           HA       SER  15  -6.139  -1.260   7.103
    3    HB2  SER  15           HB2      SER  15  -5.139  -1.471   4.935
    4    HB3  SER  15           HB3      SER  15  -6.098  -2.928   5.163
    5    HG   SER  15           HG       SER  15  -6.868  -2.293   3.289

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLY  16           H        GLY  16  -8.755  -0.371   4.882
    2    HA3  GLY  16           HA2      GLY  16  -7.890   2.268   4.334
    3    HA2  GLY  16           HA3      GLY  16  -9.545   1.681   4.184

  No H/Q in entry =           3
  In of MODEL   36
    1    H    GLN  17           H        GLN  17 -10.068   0.947   6.835
    2    HA   GLN  17           HA       GLN  17 -10.755   3.450   7.992
    3    HB2  GLN  17           HB2      GLN  17 -11.978   1.346   8.470
    4    HB3  GLN  17           HB3      GLN  17 -10.572   0.749   9.351
    5    HG2  GLN  17           HG2      GLN  17 -12.145   1.694  10.948
    6    HG3  GLN  17           HG3      GLN  17 -10.732   2.745  10.854
    7   HE21  GLN  17          HE21      GLN  17 -11.800   4.737  11.355
    8   HE22  GLN  17          HE22      GLN  17 -12.994   5.413  10.354

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ALA  18           H        ALA  18  -8.130   1.155   8.580
    2    HA   ALA  18           HA       ALA  18  -7.009   2.357  10.846
    3    HB2  ALA  18           HB1      ALA  18  -6.419   0.145   9.464
    4    HB3  ALA  18           HB2      ALA  18  -5.244   0.918  10.528
    5    HB1  ALA  18           HB3      ALA  18  -5.181   1.204   8.788

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ARG  19           H        ARG  19  -6.264   2.892   7.393
    2    HA   ARG  19           HA       ARG  19  -4.355   4.930   7.815
    3    HB2  ARG  19           HB2      ARG  19  -4.705   3.800   5.617
    4    HB3  ARG  19           HB3      ARG  19  -6.246   4.647   5.457
    5    HG2  ARG  19           HG2      ARG  19  -5.109   6.815   5.525
    6    HG3  ARG  19           HG3      ARG  19  -3.560   6.022   5.813
    7    HD2  ARG  19           HD2      ARG  19  -3.702   6.623   3.473
    8    HD3  ARG  19           HD3      ARG  19  -3.793   4.863   3.612
    9    HE   ARG  19           HE       ARG  19  -6.423   5.781   3.630
   10   HH21  ARG  19          HH11      ARG  19  -7.633   5.949   1.723
   11   HH22  ARG  19          HH12      ARG  19  -6.824   6.031   0.197
   12   HH11  ARG  19          HH21      ARG  19  -3.665   5.843   1.573
   13   HH12  ARG  19          HH22      ARG  19  -4.576   5.968   0.112

  No H/Q in entry =          13
  In of MODEL   36
    1    H    SER  20           H        SER  20  -7.857   5.060   7.244
    2    HA   SER  20           HA       SER  20  -8.206   7.817   7.210
    3    HB2  SER  20           HB2      SER  20 -10.091   6.485   6.684
    4    HB3  SER  20           HB3      SER  20  -9.974   5.585   8.194
    5    HG   SER  20           HG       SER  20 -10.295   7.782   9.170

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU  21           H        LEU  21  -8.190   5.623  10.005
    2    HA   LEU  21           HA       LEU  21  -8.608   7.612  11.982
    3    HB2  LEU  21           HB2      LEU  21  -7.262   4.906  12.120
    4    HB3  LEU  21           HB3      LEU  21  -7.558   5.919  13.531
    5    HG   LEU  21           HG       LEU  21  -9.743   5.033  11.623
    6   HD11  LEU  21          HD11      LEU  21  -8.651   3.770  14.134
    7   HD13  LEU  21          HD12      LEU  21  -8.993   3.010  12.580
    8   HD12  LEU  21          HD13      LEU  21 -10.321   3.506  13.631
    9   HD23  LEU  21          HD21      LEU  21 -11.063   5.526  13.862
   10   HD22  LEU  21          HD22      LEU  21 -10.621   6.873  12.818
   11   HD21  LEU  21          HD23      LEU  21  -9.666   6.525  14.251

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ALA  22           H        ALA  22  -5.671   6.236  10.545
    2    HA   ALA  22           HA       ALA  22  -3.774   7.538  12.156
    3    HB2  ALA  22           HB1      ALA  22  -3.377   5.690  10.454
    4    HB1  ALA  22           HB2      ALA  22  -2.178   6.982  10.485
    5    HB3  ALA  22           HB3      ALA  22  -3.406   6.947   9.219

  No H/Q in entry =           5
  In of MODEL   36
    1    H    TYR  23           H        TYR  23  -5.115   8.571   8.989
    2    HA   TYR  23           HA       TYR  23  -3.773  11.064   8.918
    3    HB2  TYR  23           HB2      TYR  23  -4.872  10.163   6.931
    4    HB3  TYR  23           HB3      TYR  23  -6.444  10.272   7.725
    5    HD1  TYR  23           HD1      TYR  23  -3.545  12.311   6.559
    6    HD2  TYR  23           HD2      TYR  23  -7.678  12.285   7.726
    7    HE1  TYR  23           HE1      TYR  23  -3.770  14.665   5.810
    8    HE2  TYR  23           HE2      TYR  23  -7.903  14.639   6.976
    9    HH   TYR  23           HH       TYR  23  -5.152  16.373   5.515

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ALA  24           H        ALA  24  -6.883  10.089  10.318
    2    HA   ALA  24           HA       ALA  24  -7.707  12.678  11.107
    3    HB1  ALA  24           HB1      ALA  24  -9.525  11.430  11.584
    4    HB2  ALA  24           HB2      ALA  24  -8.689  10.850  13.023
    5    HB3  ALA  24           HB3      ALA  24  -8.578   9.944  11.515

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA  25           H        ALA  25  -5.699  10.208  12.655
    2    HA   ALA  25           HA       ALA  25  -5.337  11.450  15.159
    3    HB2  ALA  25           HB1      ALA  25  -4.583   9.099  14.322
    4    HB3  ALA  25           HB2      ALA  25  -3.556   9.950  15.478
    5    HB1  ALA  25           HB3      ALA  25  -3.134   9.939  13.766

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU  26           H        LEU  26  -3.570  11.756  12.106
    2    HA   LEU  26           HA       LEU  26  -1.600  13.567  13.013
    3    HB2  LEU  26           HB2      LEU  26  -1.318  12.423  10.902
    4    HB3  LEU  26           HB3      LEU  26  -2.795  13.138  10.262
    5    HG   LEU  26           HG       LEU  26  -1.773  15.385  10.399
    6   HD12  LEU  26          HD11      LEU  26   0.769  15.396  10.792
    7   HD11  LEU  26          HD12      LEU  26   0.547  13.813  11.532
    8   HD13  LEU  26          HD13      LEU  26  -0.251  15.227  12.221
    9   HD21  LEU  26          HD21      LEU  26  -0.047  13.331   8.982
   10   HD23  LEU  26          HD22      LEU  26  -0.088  15.054   8.618
   11   HD22  LEU  26          HD23      LEU  26  -1.516  14.062   8.338

  No H/Q in entry =          11
  In of MODEL   36
    1    H    LYS  27           H        LYS  27  -4.792  14.065  11.564
    2    HA   LYS  27           HA       LYS  27  -4.730  16.854  11.376
    3    HB2  LYS  27           HB2      LYS  27  -6.486  15.386  10.399
    4    HB3  LYS  27           HB3      LYS  27  -7.131  15.125  12.019
    5    HG2  LYS  27           HG2      LYS  27  -7.551  17.531  12.268
    6    HG3  LYS  27           HG3      LYS  27  -6.855  17.833  10.673
    7    HD2  LYS  27           HD2      LYS  27  -8.600  16.408   9.645
    8    HD3  LYS  27           HD3      LYS  27  -9.302  16.123  11.239
    9    HE2  LYS  27           HE2      LYS  27  -9.736  18.535  11.495
   10    HE3  LYS  27           HE3      LYS  27  -9.005  18.841   9.916
   11    HZ3  LYS  27           HZ1      LYS  27 -11.385  18.724   9.693
   12    HZ2  LYS  27           HZ2      LYS  27 -11.432  17.205  10.457
   13    HZ1  LYS  27           HZ3      LYS  27 -10.698  17.372   8.930

  No H/Q in entry =          13
  In of MODEL   36
    1    H    GLN  28           H        GLN  28  -5.604  14.760  14.102
    2    HA   GLN  28           HA       GLN  28  -6.478  16.759  15.893
    3    HB2  GLN  28           HB2      GLN  28  -5.085  14.119  16.408
    4    HB3  GLN  28           HB3      GLN  28  -5.800  15.122  17.671
    5    HG2  GLN  28           HG2      GLN  28  -7.305  14.028  15.278
    6    HG3  GLN  28           HG3      GLN  28  -7.343  13.326  16.895
    7   HE21  GLN  28          HE21      GLN  28  -9.198  15.201  14.953
    8   HE22  GLN  28          HE22      GLN  28  -9.937  16.197  16.111

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ALA  29           H        ALA  29  -3.269  15.454  15.172
    2    HA   ALA  29           HA       ALA  29  -1.810  16.838  17.145
    3    HB1  ALA  29           HB1      ALA  29   0.109  16.143  16.007
    4    HB3  ALA  29           HB2      ALA  29  -0.658  16.277  14.425
    5    HB2  ALA  29           HB3      ALA  29  -1.077  14.942  15.497

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LYS  30           H        LYS  30  -2.691  17.735  13.826
    2    HA   LYS  30           HA       LYS  30  -1.269  20.168  13.724
    3    HB2  LYS  30           HB2      LYS  30  -3.816  19.313  12.332
    4    HB3  LYS  30           HB3      LYS  30  -2.977  20.825  11.988
    5    HG2  LYS  30           HG2      LYS  30  -0.918  19.522  11.452
    6    HG3  LYS  30           HG3      LYS  30  -1.831  18.030  11.698
    7    HD2  LYS  30           HD2      LYS  30  -3.406  18.687   9.919
    8    HD3  LYS  30           HD3      LYS  30  -2.516  20.191   9.675
    9    HE2  LYS  30           HE2      LYS  30  -0.497  18.889   9.073
   10    HE3  LYS  30           HE3      LYS  30  -1.406  17.390   9.287
   11    HZ2  LYS  30           HZ1      LYS  30  -1.244  18.270   6.947
   12    HZ1  LYS  30           HZ2      LYS  30  -2.276  19.537   7.429
   13    HZ3  LYS  30           HZ3      LYS  30  -2.810  17.923   7.498

  No H/Q in entry =          13
  In of MODEL   36
    1    H    GLN  31           H        GLN  31  -4.363  19.329  15.158
    2    HA   GLN  31           HA       GLN  31  -5.104  22.089  15.628
    3    HB2  GLN  31           HB2      GLN  31  -6.288  19.645  16.951
    4    HB3  GLN  31           HB3      GLN  31  -7.040  21.223  16.718
    5    HG2  GLN  31           HG2      GLN  31  -6.356  20.452  14.119
    6    HG3  GLN  31           HG3      GLN  31  -6.885  18.948  14.864
    7   HE21  GLN  31          HE21      GLN  31  -8.302  20.541  12.781
    8   HE22  GLN  31          HE22      GLN  31  -9.807  20.940  13.454

  No H/Q in entry =           8
  In of MODEL   36
    1    H    GLY  32           H        GLY  32  -2.794  20.140  16.921
    2    HA3  GLY  32           HA2      GLY  32  -1.375  20.584  18.713
    3    HA2  GLY  32           HA3      GLY  32  -2.491  21.832  19.251

  No H/Q in entry =           3
  In of MODEL   36
    1    H    ASP  33           H        ASP  33  -3.941  18.806  18.588
    2    HA   ASP  33           HA       ASP  33  -4.330  18.339  21.470
    3    HB2  ASP  33           HB2      ASP  33  -5.765  17.349  19.000
    4    HB3  ASP  33           HB3      ASP  33  -6.101  16.734  20.616

  No H/Q in entry =           4
  In of MODEL   36
    1    H    PHE  34           H        PHE  34  -2.165  17.471  21.753
    2    HA   PHE  34           HA       PHE  34  -1.194  15.220  20.333
    3    HB2  PHE  34           HB2      PHE  34  -0.546  16.188  23.127
    4    HB3  PHE  34           HB3      PHE  34   0.366  14.962  22.246
    5    HD1  PHE  34           HD1      PHE  34   0.226  18.385  22.998
    6    HD2  PHE  34           HD2      PHE  34   1.008  15.691  19.744
    7    HE1  PHE  34           HE1      PHE  34   1.525  20.152  21.841
    8    HE2  PHE  34           HE2      PHE  34   2.302  17.461  18.592
    9    HZ   PHE  34           HZ       PHE  34   2.562  19.688  19.644

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ALA  35           H        ALA  35  -3.207  15.500  23.215
    2    HA   ALA  35           HA       ALA  35  -3.007  12.832  24.097
    3    HB3  ALA  35           HB1      ALA  35  -5.453  13.472  24.979
    4    HB1  ALA  35           HB2      ALA  35  -4.911  15.089  24.526
    5    HB2  ALA  35           HB3      ALA  35  -3.994  14.152  25.705

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA  36           H        ALA  36  -5.464  14.377  22.026
    2    HA   ALA  36           HA       ALA  36  -6.901  11.978  21.549
    3    HB1  ALA  36           HB1      ALA  36  -8.354  13.416  20.612
    4    HB3  ALA  36           HB2      ALA  36  -7.190  13.833  19.355
    5    HB2  ALA  36           HB3      ALA  36  -7.194  14.714  20.883

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA  37           H        ALA  37  -4.223  13.553  19.865
    2    HA   ALA  37           HA       ALA  37  -4.221  11.928  17.560
    3    HB3  ALA  37           HB1      ALA  37  -2.203  13.618  18.973
    4    HB2  ALA  37           HB2      ALA  37  -2.747  13.686  17.298
    5    HB1  ALA  37           HB3      ALA  37  -1.599  12.445  17.803

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LYS  38           H        LYS  38  -2.440  11.594  20.621
    2    HA   LYS  38           HA       LYS  38  -1.136   9.187  20.110
    3    HB2  LYS  38           HB2      LYS  38  -1.428  10.942  22.266
    4    HB3  LYS  38           HB3      LYS  38  -2.053   9.414  22.881
    5    HG2  LYS  38           HG2      LYS  38   0.028   8.280  22.321
    6    HG3  LYS  38           HG3      LYS  38   0.641   9.725  21.508
    7    HD2  LYS  38           HD2      LYS  38   0.837  10.933  23.548
    8    HD3  LYS  38           HD3      LYS  38  -0.184   9.786  24.418
    9    HE2  LYS  38           HE2      LYS  38   2.174   9.449  25.015
   10    HE3  LYS  38           HE3      LYS  38   1.552   8.042  24.150
   11    HZ3  LYS  38           HZ1      LYS  38   2.840   8.459  22.360
   12    HZ2  LYS  38           HZ2      LYS  38   3.811   9.275  23.492
   13    HZ1  LYS  38           HZ3      LYS  38   2.730  10.148  22.514

  No H/Q in entry =          13
  In of MODEL   36
    1    H    ALA  39           H        ALA  39  -4.359   9.699  21.542
    2    HA   ALA  39           HA       ALA  39  -4.935   6.982  22.039
    3    HB3  ALA  39           HB1      ALA  39  -7.086   8.946  21.300
    4    HB2  ALA  39           HB2      ALA  39  -6.173   9.159  22.794
    5    HB1  ALA  39           HB3      ALA  39  -7.103   7.683  22.532

  No H/Q in entry =           5
  In of MODEL   36
    1    H    MET  40           H        MET  40  -5.530   9.013  19.207
    2    HA   MET  40           HA       MET  40  -7.033   7.099  17.750
    3    HB2  MET  40           HB2      MET  40  -5.413   9.486  16.843
    4    HB3  MET  40           HB3      MET  40  -6.455   8.540  15.777
    5    HG2  MET  40           HG2      MET  40  -7.458   9.784  18.350
    6    HG3  MET  40           HG3      MET  40  -7.523  10.627  16.804
    7    HE3  MET  40           HE1      MET  40 -10.136   9.036  14.755
    8    HE2  MET  40           HE2      MET  40  -8.384   9.141  14.592
    9    HE1  MET  40           HE3      MET  40  -9.286  10.510  15.240

  No H/Q in entry =           9
  In of MODEL   36
    1    H    MET  41           H        MET  41  -3.535   7.810  17.846
    2    HA   MET  41           HA       MET  41  -2.807   6.061  15.731
    3    HB2  MET  41           HB2      MET  41  -1.165   6.704  18.193
    4    HB3  MET  41           HB3      MET  41  -0.565   6.059  16.669
    5    HG2  MET  41           HG2      MET  41  -1.715   8.254  15.686
    6    HG3  MET  41           HG3      MET  41  -1.461   8.833  17.331
    7    HE2  MET  41           HE1      MET  41   1.446   6.713  17.657
    8    HE1  MET  41           HE2      MET  41   0.674   8.007  18.569
    9    HE3  MET  41           HE3      MET  41   2.293   8.243  17.913

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ASP  42           H        ASP  42  -3.166   5.573  19.218
    2    HA   ASP  42           HA       ASP  42  -2.146   2.972  19.357
    3    HB2  ASP  42           HB2      ASP  42  -2.993   4.728  21.195
    4    HB3  ASP  42           HB3      ASP  42  -4.427   3.713  21.130

  No H/Q in entry =           4
  In of MODEL   36
    1    H    GLN  43           H        GLN  43  -5.477   4.100  18.890
    2    HA   GLN  43           HA       GLN  43  -6.639   1.522  18.693
    3    HB2  GLN  43           HB2      GLN  43  -7.554   4.186  17.585
    4    HB3  GLN  43           HB3      GLN  43  -8.527   2.713  17.564
    5    HG2  GLN  43           HG2      GLN  43  -8.213   2.578  20.068
    6    HG3  GLN  43           HG3      GLN  43  -7.478   4.178  19.998
    7   HE21  GLN  43          HE21      GLN  43  -9.644   4.265  21.517
    8   HE22  GLN  43          HE22      GLN  43 -11.008   4.854  20.700

  No H/Q in entry =           8
  In of MODEL   36
    1    H    SER  44           H        SER  44  -5.304   3.738  16.281
    2    HA   SER  44           HA       SER  44  -6.035   2.270  13.990
    3    HB2  SER  44           HB2      SER  44  -4.759   4.643  14.435
    4    HB3  SER  44           HB3      SER  44  -3.416   3.641  13.889
    5    HG   SER  44           HG       SER  44  -4.537   4.628  12.140

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ARG  45           H        ARG  45  -3.141   2.128  16.046
    2    HA   ARG  45           HA       ARG  45  -1.685   0.170  14.642
    3    HB2  ARG  45           HB2      ARG  45  -0.818   1.577  16.510
    4    HB3  ARG  45           HB3      ARG  45  -1.807   0.647  17.634
    5    HG2  ARG  45           HG2      ARG  45  -0.594  -1.416  16.972
    6    HG3  ARG  45           HG3      ARG  45   0.419  -0.463  15.890
    7    HD2  ARG  45           HD2      ARG  45   1.179   0.904  17.845
    8    HD3  ARG  45           HD3      ARG  45   0.258  -0.170  18.922
    9    HE   ARG  45           HE       ARG  45   1.933  -1.770  17.319
   10   HH21  ARG  45          HH11      ARG  45   3.835  -2.609  18.137
   11   HH22  ARG  45          HH12      ARG  45   4.624  -1.835  19.465
   12   HH11  ARG  45          HH21      ARG  45   2.273   0.683  19.718
   13   HH12  ARG  45          HH22      ARG  45   3.740   0.032  20.358

  No H/Q in entry =          13
  In of MODEL   36
    1    H    MET  46           H        MET  46  -4.063  -0.147  17.260
    2    HA   MET  46           HA       MET  46  -3.912  -2.948  17.552
    3    HB2  MET  46           HB2      MET  46  -6.069  -0.935  18.176
    4    HB3  MET  46           HB3      MET  46  -6.273  -2.655  18.519
    5    HG2  MET  46           HG2      MET  46  -4.231  -2.636  19.892
    6    HG3  MET  46           HG3      MET  46  -3.994  -0.932  19.538
    7    HE2  MET  46           HE1      MET  46  -4.485   0.246  22.341
    8    HE1  MET  46           HE2      MET  46  -3.595  -1.217  21.935
    9    HE3  MET  46           HE3      MET  46  -4.793  -1.254  23.225

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ALA  47           H        ALA  47  -5.935  -0.907  15.484
    2    HA   ALA  47           HA       ALA  47  -7.576  -2.941  14.422
    3    HB3  ALA  47           HB1      ALA  47  -8.243  -0.697  14.022
    4    HB1  ALA  47           HB2      ALA  47  -7.772  -1.326  12.444
    5    HB2  ALA  47           HB3      ALA  47  -6.677  -0.270  13.337

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU  48           H        LEU  48  -4.457  -1.650  13.352
    2    HA   LEU  48           HA       LEU  48  -4.207  -3.231  11.000
    3    HB2  LEU  48           HB2      LEU  48  -2.125  -1.977  12.798
    4    HB3  LEU  48           HB3      LEU  48  -1.775  -2.693  11.225
    5    HG   LEU  48           HG       LEU  48  -3.777  -0.461  11.642
    6   HD13  LEU  48          HD11      LEU  48  -1.644   0.395  12.294
    7   HD12  LEU  48          HD12      LEU  48  -1.928   0.959  10.648
    8   HD11  LEU  48          HD13      LEU  48  -0.838  -0.398  10.940
    9   HD22  LEU  48          HD21      LEU  48  -4.273  -1.432   9.565
   10   HD21  LEU  48          HD22      LEU  48  -2.596  -1.879   9.254
   11   HD23  LEU  48          HD23      LEU  48  -3.103  -0.195   9.107

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ASN  49           H        ASN  49  -3.137  -3.653  14.336
    2    HA   ASN  49           HA       ASN  49  -1.556  -5.927  13.981
    3    HB2  ASN  49           HB2      ASN  49  -1.548  -4.609  16.036
    4    HB3  ASN  49           HB3      ASN  49  -3.212  -5.065  16.369
    5   HD21  ASN  49          HD21      ASN  49  -1.235  -5.631  18.268
    6   HD22  ASN  49          HD22      ASN  49  -0.976  -7.307  18.333

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLU  50           H        GLU  50  -5.017  -5.626  14.682
    2    HA   GLU  50           HA       GLU  50  -5.552  -8.422  14.780
    3    HB2  GLU  50           HB2      GLU  50  -7.116  -6.725  15.678
    4    HB3  GLU  50           HB3      GLU  50  -7.418  -6.150  14.037
    5    HG2  GLU  50           HG2      GLU  50  -8.307  -8.335  13.394
    6    HG3  GLU  50           HG3      GLU  50  -7.919  -8.990  14.981

  No H/Q in entry =           6
  In of MODEL   36
    1    H    ALA  51           H        ALA  51  -5.620  -6.010  12.197
    2    HA   ALA  51           HA       ALA  51  -6.637  -7.718  10.175
    3    HB2  ALA  51           HB1      ALA  51  -6.412  -5.900   8.813
    4    HB1  ALA  51           HB2      ALA  51  -4.765  -5.569   9.350
    5    HB3  ALA  51           HB3      ALA  51  -6.136  -5.050  10.332

  No H/Q in entry =           5
  In of MODEL   36
    1    H    HIS  52           H        HIS  52  -3.330  -6.846  11.137
    2    HA   HIS  52           HA       HIS  52  -1.961  -8.339   9.168
    3    HB2  HIS  52           HB2      HIS  52  -0.875  -6.633  10.578
    4    HB3  HIS  52           HB3      HIS  52  -1.088  -7.667  11.990
    5    HD1  HIS  52           HD1      HIS  52   0.004 -10.213  11.590
    6    HD2  HIS  52           HD2      HIS  52   1.551  -7.061   9.343
    7    HE1  HIS  52           HE1      HIS  52   2.272 -10.973  10.757
    8    HE2  HIS  52           HE2      HIS  52   3.228  -9.063   9.385

  No H/Q in entry =           8
  In of MODEL   36
    1    H    LEU  53           H        LEU  53  -3.156  -9.221  12.386
    2    HA   LEU  53           HA       LEU  53  -1.981 -11.778  12.557
    3    HB2  LEU  53           HB2      LEU  53  -4.444 -10.576  13.798
    4    HB3  LEU  53           HB3      LEU  53  -4.003 -12.260  14.076
    5    HG   LEU  53           HG       LEU  53  -2.069  -9.968  14.550
    6   HD11  LEU  53          HD11      LEU  53  -3.931 -11.342  16.513
    7   HD13  LEU  53          HD12      LEU  53  -4.024  -9.659  15.997
    8   HD12  LEU  53          HD13      LEU  53  -2.654 -10.212  16.951
    9   HD21  LEU  53          HD21      LEU  53  -2.132 -12.911  15.239
   10   HD23  LEU  53          HD22      LEU  53  -1.187 -11.784  16.208
   11   HD22  LEU  53          HD23      LEU  53  -0.821 -11.995  14.505

  No H/Q in entry =          11
  In of MODEL   36
    1    H    VAL  54           H        VAL  54  -5.093 -10.710  11.225
    2    HA   VAL  54           HA       VAL  54  -6.038 -13.291  10.532
    3    HB   VAL  54           HB       VAL  54  -6.666 -10.546   9.416
    4   HG12  VAL  54          HG11      VAL  54  -8.789 -11.898   8.614
    5   HG11  VAL  54          HG12      VAL  54  -7.690 -13.276   8.670
    6   HG13  VAL  54          HG13      VAL  54  -7.325 -11.899   7.633
    7   HG22  VAL  54          HG21      VAL  54  -7.556 -10.586  11.575
    8   HG21  VAL  54          HG22      VAL  54  -7.829 -12.326  11.548
    9   HG23  VAL  54          HG23      VAL  54  -8.906 -11.254  10.656

  No H/Q in entry =           9
  In of MODEL   36
    1    H    GLN  55           H        GLN  55  -4.156 -10.850   8.740
    2    HA   GLN  55           HA       GLN  55  -4.060 -12.303   6.314
    3    HB2  GLN  55           HB2      GLN  55  -3.434 -10.044   6.131
    4    HB3  GLN  55           HB3      GLN  55  -2.313 -10.139   7.487
    5    HG2  GLN  55           HG2      GLN  55  -0.615 -10.997   6.193
    6    HG3  GLN  55           HG3      GLN  55  -1.707 -11.955   5.203
    7   HE21  GLN  55          HE21      GLN  55  -1.733 -11.254   3.085
    8   HE22  GLN  55          HE22      GLN  55  -1.522  -9.649   2.581

  No H/Q in entry =           8
  In of MODEL   36
    1    H    THR  56           H        THR  56  -1.931 -12.320   9.178
    2    HA   THR  56           HA       THR  56   0.122 -13.936   8.237
    3    HB   THR  56           HB       THR  56  -1.105 -14.175  10.993
    4    HG1  THR  56           HG1      THR  56  -0.600 -11.984  10.190
    5   HG23  THR  56          HG21      THR  56   0.558 -15.813  10.814
    6   HG22  THR  56          HG22      THR  56   1.451 -14.440  11.469
    7   HG21  THR  56          HG23      THR  56   1.553 -14.822   9.751

  No H/Q in entry =           7
  In of MODEL   36
    1    H    LYS  57           H        LYS  57  -2.998 -14.945   9.619
    2    HA   LYS  57           HA       LYS  57  -2.585 -17.744   9.355
    3    HB2  LYS  57           HB2      LYS  57  -4.381 -16.639  10.721
    4    HB3  LYS  57           HB3      LYS  57  -5.180 -16.176   9.225
    5    HG2  LYS  57           HG2      LYS  57  -5.484 -18.516   8.612
    6    HG3  LYS  57           HG3      LYS  57  -4.589 -19.036  10.038
    7    HD2  LYS  57           HD2      LYS  57  -6.313 -18.000  11.488
    8    HD3  LYS  57           HD3      LYS  57  -7.221 -17.520  10.056
    9    HE2  LYS  57           HE2      LYS  57  -6.497 -20.397  10.705
   10    HE3  LYS  57           HE3      LYS  57  -8.048 -19.671  11.114
   11    HZ3  LYS  57           HZ1      LYS  57  -8.678 -20.295   9.094
   12    HZ2  LYS  57           HZ2      LYS  57  -7.087 -20.620   8.594
   13    HZ1  LYS  57           HZ3      LYS  57  -7.704 -19.040   8.494

  No H/Q in entry =          13
  In of MODEL   36
    1    H    LEU  58           H        LEU  58  -3.906 -15.276   7.202
    2    HA   LEU  58           HA       LEU  58  -4.744 -17.082   5.193
    3    HB2  LEU  58           HB2      LEU  58  -4.106 -14.140   5.068
    4    HB3  LEU  58           HB3      LEU  58  -4.790 -15.062   3.729
    5    HG   LEU  58           HG       LEU  58  -6.046 -14.883   6.487
    6   HD11  LEU  58          HD11      LEU  58  -6.347 -13.220   4.006
    7   HD13  LEU  58          HD12      LEU  58  -6.319 -12.721   5.698
    8   HD12  LEU  58          HD13      LEU  58  -7.755 -13.495   5.033
    9   HD22  LEU  58          HD21      LEU  58  -7.037 -16.776   5.615
   10   HD21  LEU  58          HD22      LEU  58  -6.705 -16.320   3.945
   11   HD23  LEU  58          HD23      LEU  58  -8.054 -15.583   4.810

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  59           H        ILE  59  -1.589 -15.911   6.036
    2    HA   ILE  59           HA       ILE  59  -0.519 -16.637   3.387
    3    HB   ILE  59           HB       ILE  59   0.284 -14.590   4.967
    4   HG12  ILE  59          HG12      ILE  59   2.343 -16.247   3.496
    5   HG13  ILE  59          HG13      ILE  59   1.146 -15.289   2.662
    6   HG22  ILE  59          HG21      ILE  59   2.349 -16.675   5.625
    7   HG21  ILE  59          HG22      ILE  59   1.016 -16.374   6.717
    8   HG23  ILE  59          HG23      ILE  59   2.153 -15.086   6.324
    9   HD11  ILE  59          HD11      ILE  59   2.991 -14.147   4.752
   10   HD13  ILE  59          HD12      ILE  59   1.945 -13.248   3.656
   11   HD12  ILE  59          HD13      ILE  59   3.350 -14.111   3.028

  No H/Q in entry =          11
  In of MODEL   36
    1    H    GLU  60           H        GLU  60  -0.517 -17.760   6.750
    2    HA   GLU  60           HA       GLU  60   1.490 -19.759   6.460
    3    HB2  GLU  60           HB2      GLU  60   0.808 -19.026   8.665
    4    HB3  GLU  60           HB3      GLU  60  -0.851 -19.545   8.369
    5    HG2  GLU  60           HG2      GLU  60   1.422 -21.515   8.174
    6    HG3  GLU  60           HG3      GLU  60   0.716 -21.115   9.738

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLY  61           H        GLY  61  -2.025 -19.815   6.000
    2    HA3  GLY  61           HA2      GLY  61  -1.816 -22.605   5.026
    3    HA2  GLY  61           HA3      GLY  61  -3.289 -21.856   5.634

  No H/Q in entry =           3
  In of MODEL   36
    1    H    ASP  62           H        ASP  62  -1.060 -20.286   3.424
    2    HA   ASP  62           HA       ASP  62  -3.169 -19.770   1.542
    3    HB2  ASP  62           HB2      ASP  62  -1.397 -18.583   0.297
    4    HB3  ASP  62           HB3      ASP  62  -1.438 -18.107   1.992

  No H/Q in entry =           4
  In of MODEL   36
    1    H    ALA  63           H        ALA  63  -2.901 -22.559   1.714
    2    HA   ALA  63           HA       ALA  63  -1.202 -23.717  -0.246
    3    HB2  ALA  63           HB1      ALA  63  -3.804 -24.627   0.963
    4    HB1  ALA  63           HB2      ALA  63  -2.170 -25.160   1.361
    5    HB3  ALA  63           HB3      ALA  63  -2.887 -25.600  -0.190

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLY  64           H        GLY  64  -4.485 -22.410  -0.353
    2    HA3  GLY  64           HA2      GLY  64  -5.785 -21.683  -2.103
    3    HA2  GLY  64           HA3      GLY  64  -4.351 -21.740  -3.115

  No H/Q in entry =           3
  In of MODEL   36
    1    H    GLU  65           H        GLU  65  -5.928 -22.478  -4.776
    2    HA   GLU  65           HA       GLU  65  -7.308 -24.926  -4.507
    3    HB2  GLU  65           HB2      GLU  65  -6.414 -23.409  -6.956
    4    HB3  GLU  65           HB3      GLU  65  -7.439 -24.843  -7.013
    5    HG2  GLU  65           HG2      GLU  65  -9.116 -23.744  -5.617
    6    HG3  GLU  65           HG3      GLU  65  -8.082 -22.328  -5.449

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLY  66           H        GLY  66  -4.172 -24.150  -5.831
    2    HA3  GLY  66           HA2      GLY  66  -3.545 -26.988  -6.266
    3    HA2  GLY  66           HA3      GLY  66  -2.710 -25.636  -7.006

  No H/Q in entry =           3
  In of MODEL   36
    1    H    LYS  67           H        LYS  67  -1.115 -27.434  -6.053
    2    HA   LYS  67           HA       LYS  67  -0.476 -27.408  -3.326
    3    HB2  LYS  67           HB2      LYS  67   1.175 -28.097  -5.752
    4    HB3  LYS  67           HB3      LYS  67   1.689 -28.403  -4.088
    5    HG2  LYS  67           HG2      LYS  67  -0.357 -29.726  -3.693
    6    HG3  LYS  67           HG3      LYS  67  -0.873 -29.427  -5.351
    7    HD2  LYS  67           HD2      LYS  67   1.122 -30.603  -6.193
    8    HD3  LYS  67           HD3      LYS  67   1.652 -30.894  -4.533
    9    HE2  LYS  67           HE2      LYS  67  -0.401 -32.176  -4.087
   10    HE3  LYS  67           HE3      LYS  67  -0.961 -31.867  -5.729
   11    HZ2  LYS  67           HZ1      LYS  67   1.440 -33.410  -4.922
   12    HZ1  LYS  67           HZ2      LYS  67   1.077 -32.988  -6.527
   13    HZ3  LYS  67           HZ3      LYS  67   0.038 -34.014  -5.659

  No H/Q in entry =          13
  In of MODEL   36
    1    H    MET  68           H        MET  68   1.786 -26.226  -5.726
    2    HA   MET  68           HA       MET  68   3.212 -24.544  -3.974
    3    HB2  MET  68           HB2      MET  68   3.119 -24.617  -6.991
    4    HB3  MET  68           HB3      MET  68   4.324 -23.751  -6.038
    5    HG2  MET  68           HG2      MET  68   3.795 -26.733  -5.881
    6    HG3  MET  68           HG3      MET  68   5.142 -25.987  -6.744
    7    HE1  MET  68           HE1      MET  68   6.663 -24.496  -5.928
    8    HE3  MET  68           HE2      MET  68   7.498 -24.633  -4.381
    9    HE2  MET  68           HE3      MET  68   6.125 -23.540  -4.539

  No H/Q in entry =           9
  In of MODEL   36
    1    H    LYS  69           H        LYS  69   0.671 -23.786  -6.345
    2    HA   LYS  69           HA       LYS  69   0.946 -20.992  -6.225
    3    HB2  LYS  69           HB2      LYS  69  -0.209 -22.142  -8.047
    4    HB3  LYS  69           HB3      LYS  69  -1.536 -22.533  -6.946
    5    HG2  LYS  69           HG2      LYS  69  -1.950 -20.167  -6.534
    6    HG3  LYS  69           HG3      LYS  69  -0.566 -19.723  -7.532
    7    HD2  LYS  69           HD2      LYS  69  -1.656 -20.759  -9.495
    8    HD3  LYS  69           HD3      LYS  69  -3.050 -21.170  -8.493
    9    HE2  LYS  69           HE2      LYS  69  -3.415 -18.780  -8.006
   10    HE3  LYS  69           HE3      LYS  69  -2.017 -18.363  -8.996
   11    HZ2  LYS  69           HZ1      LYS  69  -4.600 -19.511  -9.855
   12    HZ1  LYS  69           HZ2      LYS  69  -3.213 -19.622 -10.831
   13    HZ3  LYS  69           HZ3      LYS  69  -3.835 -18.099 -10.404

  No H/Q in entry =          13
  In of MODEL   36
    1    H    VAL  70           H        VAL  70  -0.239 -19.338  -5.268
    2    HA   VAL  70           HA       VAL  70  -1.718 -20.082  -2.805
    3    HB   VAL  70           HB       VAL  70  -0.894 -17.952  -1.849
    4   HG13  VAL  70          HG11      VAL  70   1.223 -18.764  -1.277
    5   HG12  VAL  70          HG12      VAL  70   1.529 -19.386  -2.899
    6   HG11  VAL  70          HG13      VAL  70   0.406 -20.226  -1.829
    7   HG22  VAL  70          HG21      VAL  70  -0.483 -16.450  -3.594
    8   HG21  VAL  70          HG22      VAL  70   0.264 -17.684  -4.607
    9   HG23  VAL  70          HG23      VAL  70   1.163 -16.993  -3.260

  No H/Q in entry =           9
  In of MODEL   36
    1    H    SER  71           H        SER  71  -3.256 -18.381  -2.104
    2    HA   SER  71           HA       SER  71  -5.153 -17.754  -4.099
    3    HB2  SER  71           HB2      SER  71  -5.645 -17.962  -1.632
    4    HB3  SER  71           HB3      SER  71  -4.833 -16.419  -1.389
    5    HG   SER  71           HG       SER  71  -7.333 -16.931  -2.263

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU  72           H        LEU  72  -5.352 -16.083  -5.420
    2    HA   LEU  72           HA       LEU  72  -3.229 -14.291  -5.909
    3    HB2  LEU  72           HB2      LEU  72  -6.104 -14.300  -6.829
    4    HB3  LEU  72           HB3      LEU  72  -4.890 -13.165  -7.415
    5    HG   LEU  72           HG       LEU  72  -4.547 -16.178  -7.553
    6   HD11  LEU  72          HD11      LEU  72  -6.516 -15.265  -8.886
    7   HD13  LEU  72          HD12      LEU  72  -5.277 -16.087  -9.837
    8   HD12  LEU  72          HD13      LEU  72  -5.344 -14.324  -9.809
    9   HD22  LEU  72          HD21      LEU  72  -2.412 -15.232  -7.813
   10   HD21  LEU  72          HD22      LEU  72  -3.022 -13.796  -8.617
   11   HD23  LEU  72          HD23      LEU  72  -2.972 -15.331  -9.478

  No H/Q in entry =          11
  In of MODEL   36
    1    H    VAL  73           H        VAL  73  -6.305 -13.911  -4.251
    2    HA   VAL  73           HA       VAL  73  -6.319 -11.142  -3.884
    3    HB   VAL  73           HB       VAL  73  -8.048 -11.482  -2.335
    4   HG11  VAL  73          HG11      VAL  73  -8.378 -12.416  -4.694
    5   HG13  VAL  73          HG12      VAL  73  -9.483 -13.015  -3.459
    6   HG12  VAL  73          HG13      VAL  73  -8.128 -14.013  -3.987
    7   HG23  VAL  73          HG21      VAL  73  -8.360 -13.822  -1.317
    8   HG22  VAL  73          HG22      VAL  73  -7.023 -12.860  -0.685
    9   HG21  VAL  73          HG23      VAL  73  -6.710 -14.151  -1.845

  No H/Q in entry =           9
  In of MODEL   36
    1    H    LEU  74           H        LEU  74  -4.391 -13.538  -2.331
    2    HA   LEU  74           HA       LEU  74  -3.947 -12.416   0.195
    3    HB2  LEU  74           HB2      LEU  74  -3.190 -14.640  -0.326
    4    HB3  LEU  74           HB3      LEU  74  -2.138 -14.030  -1.603
    5    HG   LEU  74           HG       LEU  74  -0.808 -12.803   0.081
    6   HD13  LEU  74          HD11      LEU  74  -2.338 -12.299   1.820
    7   HD12  LEU  74          HD12      LEU  74  -1.293 -13.537   2.521
    8   HD11  LEU  74          HD13      LEU  74  -2.895 -13.969   1.925
    9   HD23  LEU  74          HD21      LEU  74  -1.040 -15.558   1.172
   10   HD22  LEU  74          HD22      LEU  74   0.371 -14.652   0.671
   11   HD21  LEU  74          HD23      LEU  74  -0.659 -15.381  -0.539

  No H/Q in entry =          11
  In of MODEL   36
    1    H    VAL  75           H        VAL  75  -2.078 -12.025  -2.777
    2    HA   VAL  75           HA       VAL  75  -0.252 -10.125  -1.771
    3    HB   VAL  75           HB       VAL  75  -1.237 -10.583  -4.588
    4   HG13  VAL  75          HG11      VAL  75  -0.351  -8.293  -4.385
    5   HG12  VAL  75          HG12      VAL  75   0.827  -9.299  -5.213
    6   HG11  VAL  75          HG13      VAL  75   1.058  -8.895  -3.519
    7   HG22  VAL  75          HG21      VAL  75   0.829 -11.833  -4.825
    8   HG21  VAL  75          HG22      VAL  75  -0.003 -12.439  -3.393
    9   HG23  VAL  75          HG23      VAL  75   1.365 -11.341  -3.217

  No H/Q in entry =           9
  In of MODEL   36
    1    H    GLU  76           H        GLU  76  -3.413  -9.736  -3.399
    2    HA   GLU  76           HA       GLU  76  -3.437  -6.921  -3.483
    3    HB2  GLU  76           HB2      GLU  76  -5.121  -8.331  -4.641
    4    HB3  GLU  76           HB3      GLU  76  -5.763  -8.840  -3.087
    5    HG2  GLU  76           HG2      GLU  76  -7.212  -7.107  -3.931
    6    HG3  GLU  76           HG3      GLU  76  -6.310  -6.413  -2.598

  No H/Q in entry =           6
  In of MODEL   36
    1    H    ALA  77           H        ALA  77  -4.548  -9.152  -0.947
    2    HA   ALA  77           HA       ALA  77  -5.469  -7.151   0.832
    3    HB3  ALA  77           HB1      ALA  77  -6.209  -9.306   1.350
    4    HB2  ALA  77           HB2      ALA  77  -4.979  -9.017   2.579
    5    HB1  ALA  77           HB3      ALA  77  -4.601 -10.009   1.173

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLN  78           H        GLN  78  -2.341  -8.730   0.430
    2    HA   GLN  78           HA       GLN  78  -1.051  -7.597   2.676
    3    HB2  GLN  78           HB2      GLN  78  -0.220  -9.538   1.304
    4    HB3  GLN  78           HB3      GLN  78   0.213  -8.391   0.039
    5    HG2  GLN  78           HG2      GLN  78   1.699  -7.215   1.612
    6    HG3  GLN  78           HG3      GLN  78   1.271  -8.362   2.878
    7   HE21  GLN  78          HE21      GLN  78   3.196  -9.571   3.125
    8   HE22  GLN  78          HE22      GLN  78   3.975 -10.375   1.848

  No H/Q in entry =           8
  In of MODEL   36
    1    H    LEU  79           H        LEU  79  -1.436  -6.512  -0.661
    2    HA   LEU  79           HA       LEU  79   0.274  -4.304  -0.650
    3    HB2  LEU  79           HB2      LEU  79  -0.779  -5.087  -2.699
    4    HB3  LEU  79           HB3      LEU  79  -2.373  -4.681  -2.074
    5    HG   LEU  79           HG       LEU  79  -1.802  -2.301  -2.040
    6   HD13  LEU  79          HD11      LEU  79   0.445  -2.085  -1.546
    7   HD12  LEU  79          HD12      LEU  79   0.482  -1.788  -3.283
    8   HD11  LEU  79          HD13      LEU  79   0.924  -3.374  -2.650
    9   HD23  LEU  79          HD21      LEU  79  -1.189  -2.094  -4.596
   10   HD22  LEU  79          HD22      LEU  79  -2.719  -2.827  -4.128
   11   HD21  LEU  79          HD23      LEU  79  -1.362  -3.849  -4.590

  No H/Q in entry =          11
  In of MODEL   36
    1    H    HIS  80           H        HIS  80  -3.186  -4.432   0.206
    2    HA   HIS  80           HA       HIS  80  -3.341  -1.678   0.887
    3    HB2  HIS  80           HB2      HIS  80  -5.066  -4.069   1.207
    4    HB3  HIS  80           HB3      HIS  80  -5.362  -2.732   2.322
    5    HD1  HIS  80           HD1      HIS  80  -6.969  -1.071   1.438
    6    HD2  HIS  80           HD2      HIS  80  -4.824  -2.891  -1.639
    7    HE1  HIS  80           HE1      HIS  80  -7.816  -0.052  -0.728
    8    HE2  HIS  80           HE2      HIS  80  -6.515  -1.155  -2.613

  No H/Q in entry =           8
  In of MODEL   36
    1    H    LEU  81           H        LEU  81  -2.868  -4.590   2.859
    2    HA   LEU  81           HA       LEU  81  -2.817  -3.257   5.351
    3    HB2  LEU  81           HB2      LEU  81  -1.637  -5.883   4.445
    4    HB3  LEU  81           HB3      LEU  81  -1.590  -5.334   6.122
    5    HG   LEU  81           HG       LEU  81  -4.153  -5.547   4.516
    6   HD12  LEU  81          HD11      LEU  81  -4.466  -7.618   6.054
    7   HD11  LEU  81          HD12      LEU  81  -2.711  -7.569   6.224
    8   HD13  LEU  81          HD13      LEU  81  -3.437  -7.782   4.631
    9   HD23  LEU  81          HD21      LEU  81  -4.976  -5.755   7.023
   10   HD22  LEU  81          HD22      LEU  81  -4.639  -4.166   6.339
   11   HD21  LEU  81          HD23      LEU  81  -3.451  -4.946   7.384

  No H/Q in entry =          11
  In of MODEL   36
    1    H    MET  82           H        MET  82  -0.167  -4.180   3.151
    2    HA   MET  82           HA       MET  82   1.942  -3.320   4.821
    3    HB2  MET  82           HB2      MET  82   1.696  -3.642   1.829
    4    HB3  MET  82           HB3      MET  82   3.192  -3.093   2.582
    5    HG2  MET  82           HG2      MET  82   1.760  -5.670   3.305
    6    HG3  MET  82           HG3      MET  82   3.123  -5.570   2.193
    7    HE3  MET  82           HE1      MET  82   6.165  -4.882   4.153
    8    HE2  MET  82           HE2      MET  82   5.253  -3.500   3.551
    9    HE1  MET  82           HE3      MET  82   5.315  -4.986   2.607

  No H/Q in entry =           9
  In of MODEL   36
    1    H    THR  83           H        THR  83   0.117  -1.641   2.290
    2    HA   THR  83           HA       THR  83   1.560   0.789   2.378
    3    HB   THR  83           HB       THR  83  -0.613   1.746   1.417
    4    HG1  THR  83           HG1      THR  83  -2.281   0.470   1.318
    5   HG22  THR  83          HG21      THR  83  -0.384  -0.063  -0.596
    6   HG21  THR  83          HG22      THR  83   1.121  -0.379   0.265
    7   HG23  THR  83          HG23      THR  83   0.774   1.242  -0.337

  No H/Q in entry =           7
  In of MODEL   36
    1    H    SER  84           H        SER  84  -1.444  -0.215   4.001
    2    HA   SER  84           HA       SER  84  -1.898   2.213   5.363
    3    HB2  SER  84           HB2      SER  84  -2.761  -0.618   5.919
    4    HB3  SER  84           HB3      SER  84  -3.228   0.723   6.964
    5    HG   SER  84           HG       SER  84  -3.716   0.431   4.175

  No H/Q in entry =           5
  In of MODEL   36
    1    H    MET  85           H        MET  85  -0.215  -0.747   6.461
    2    HA   MET  85           HA       MET  85   0.340   0.158   9.065
    3    HB2  MET  85           HB2      MET  85   0.596  -2.185   8.372
    4    HB3  MET  85           HB3      MET  85   1.975  -1.733   7.368
    5    HG2  MET  85           HG2      MET  85   3.189  -0.942   9.351
    6    HG3  MET  85           HG3      MET  85   1.799  -1.319  10.368
    7    HE2  MET  85           HE1      MET  85   4.836  -3.960   8.362
    8    HE1  MET  85           HE2      MET  85   4.231  -2.380   7.866
    9    HE3  MET  85           HE3      MET  85   3.387  -3.839   7.358

  No H/Q in entry =           9
  In of MODEL   36
    1    H    LEU  86           H        LEU  86   2.251   0.406   6.098
    2    HA   LEU  86           HA       LEU  86   4.492   1.681   7.241
    3    HB2  LEU  86           HB2      LEU  86   4.266   0.615   4.928
    4    HB3  LEU  86           HB3      LEU  86   3.472   2.109   4.431
    5    HG   LEU  86           HG       LEU  86   5.525   3.324   5.400
    6   HD11  LEU  86          HD11      LEU  86   6.204   0.699   6.178
    7   HD13  LEU  86          HD12      LEU  86   7.227   2.130   6.275
    8   HD12  LEU  86          HD13      LEU  86   7.310   1.089   4.856
    9   HD23  LEU  86          HD21      LEU  86   6.198   1.565   3.033
   10   HD22  LEU  86          HD22      LEU  86   6.616   3.256   3.301
   11   HD21  LEU  86          HD23      LEU  86   4.954   2.811   2.915

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ALA  87           H        ALA  87   1.582   2.971   5.690
    2    HA   ALA  87           HA       ALA  87   2.212   5.693   5.783
    3    HB1  ALA  87           HB1      ALA  87  -0.123   4.098   5.254
    4    HB3  ALA  87           HB2      ALA  87   0.205   5.758   4.760
    5    HB2  ALA  87           HB3      ALA  87  -0.579   5.438   6.309

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ARG  88           H        ARG  88   0.518   3.700   8.177
    2    HA   ARG  88           HA       ARG  88   0.050   5.746  10.040
    3    HB2  ARG  88           HB2      ARG  88  -0.918   3.405  10.102
    4    HB3  ARG  88           HB3      ARG  88   0.622   2.881  10.791
    5    HG2  ARG  88           HG2      ARG  88   0.188   4.953  12.427
    6    HG3  ARG  88           HG3      ARG  88  -1.487   4.652  11.984
    7    HD2  ARG  88           HD2      ARG  88  -1.607   2.797  13.222
    8    HD3  ARG  88           HD3      ARG  88  -0.030   2.198  12.673
    9    HE   ARG  88           HE       ARG  88  -0.525   3.455  15.139
   10   HH21  ARG  88          HH11      ARG  88   1.057   4.440  16.368
   11   HH22  ARG  88          HH12      ARG  88   2.575   4.851  15.652
   12   HH11  ARG  88          HH21      ARG  88   1.734   3.621  12.542
   13   HH12  ARG  88          HH22      ARG  88   2.967   4.371  13.497

  No H/Q in entry =          13
  In of MODEL   36
    1    H    GLU  89           H        GLU  89   2.816   3.493   9.779
    2    HA   GLU  89           HA       GLU  89   4.110   4.352  12.116
    3    HB2  GLU  89           HB2      GLU  89   4.731   2.333  10.756
    4    HB3  GLU  89           HB3      GLU  89   5.510   3.424   9.608
    5    HG2  GLU  89           HG2      GLU  89   7.021   4.242  11.343
    6    HG3  GLU  89           HG3      GLU  89   6.185   3.290  12.565

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LEU  90           H        LEU  90   4.411   5.524   8.792
    2    HA   LEU  90           HA       LEU  90   6.371   7.497   9.370
    3    HB2  LEU  90           HB2      LEU  90   4.341   7.203   7.159
    4    HB3  LEU  90           HB3      LEU  90   5.588   8.458   7.176
    5    HG   LEU  90           HG       LEU  90   6.228   5.512   7.488
    6   HD12  LEU  90          HD11      LEU  90   6.957   5.749   5.043
    7   HD11  LEU  90          HD12      LEU  90   5.959   7.202   5.012
    8   HD13  LEU  90          HD13      LEU  90   5.223   5.636   5.353
    9   HD22  LEU  90          HD21      LEU  90   8.145   6.634   8.159
   10   HD21  LEU  90          HD22      LEU  90   7.804   8.049   7.163
   11   HD23  LEU  90          HD23      LEU  90   8.439   6.580   6.422

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  91           H        ILE  91   2.832   7.556   9.254
    2    HA   ILE  91           HA       ILE  91   2.527  10.331   9.722
    3    HB   ILE  91           HB       ILE  91   0.712   7.974  10.268
    4   HG12  ILE  91          HG12      ILE  91   0.474  10.268   8.298
    5   HG13  ILE  91          HG13      ILE  91   1.312   8.766   7.910
    6   HG22  ILE  91          HG21      ILE  91  -0.995  10.052  10.358
    7   HG21  ILE  91          HG22      ILE  91   0.422  10.862  11.023
    8   HG23  ILE  91          HG23      ILE  91  -0.224   9.428  11.817
    9   HD13  ILE  91          HD11      ILE  91  -0.646   7.501   7.965
   10   HD12  ILE  91          HD12      ILE  91  -1.224   9.027   7.297
   11   HD11  ILE  91          HD13      ILE  91  -1.484   8.657   9.002

  No H/Q in entry =          11
  In of MODEL   36
    1    H    THR  92           H        THR  92   2.918   7.573  11.905
    2    HA   THR  92           HA       THR  92   2.512   8.939  14.340
    3    HB   THR  92           HB       THR  92   4.287   6.587  13.647
    4    HG1  THR  92           HG1      THR  92   2.309   5.853  13.560
    5   HG22  THR  92          HG21      THR  92   3.924   6.293  16.283
    6   HG21  THR  92          HG22      THR  92   3.879   8.053  16.219
    7   HG23  THR  92          HG23      THR  92   5.297   7.185  15.629

  No H/Q in entry =           7
  In of MODEL   36
    1    H    GLU  93           H        GLU  93   5.440   8.467  12.378
    2    HA   GLU  93           HA       GLU  93   7.225   9.865  14.067
    3    HB2  GLU  93           HB2      GLU  93   7.283   9.565  11.049
    4    HB3  GLU  93           HB3      GLU  93   8.638  10.075  12.054
    5    HG2  GLU  93           HG2      GLU  93   7.204   7.452  12.501
    6    HG3  GLU  93           HG3      GLU  93   8.579   7.594  11.414

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LEU  94           H        LEU  94   5.164  10.916  11.377
    2    HA   LEU  94           HA       LEU  94   5.997  13.612  11.283
    3    HB2  LEU  94           HB2      LEU  94   3.386  12.279  10.545
    4    HB3  LEU  94           HB3      LEU  94   3.660  14.004  10.310
    5    HG   LEU  94           HG       LEU  94   5.647  12.000   9.233
    6   HD11  LEU  94          HD11      LEU  94   2.902  12.586   8.197
    7   HD13  LEU  94          HD12      LEU  94   3.869  11.119   8.056
    8   HD12  LEU  94          HD13      LEU  94   4.209  12.501   7.015
    9   HD23  LEU  94          HD21      LEU  94   5.902  13.843   7.517
   10   HD22  LEU  94          HD22      LEU  94   6.336  14.322   9.158
   11   HD21  LEU  94          HD23      LEU  94   4.784  14.810   8.475

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  95           H        ILE  95   3.459  12.012  13.189
    2    HA   ILE  95           HA       ILE  95   2.451  14.366  14.404
    3    HB   ILE  95           HB       ILE  95   2.446  11.480  15.314
    4   HG12  ILE  95          HG12      ILE  95   0.235  13.282  14.293
    5   HG13  ILE  95          HG13      ILE  95   1.172  12.218  13.248
    6   HG21  ILE  95          HG21      ILE  95   1.200  13.959  16.539
    7   HG23  ILE  95          HG22      ILE  95   2.243  12.776  17.329
    8   HG22  ILE  95          HG23      ILE  95   0.599  12.334  16.866
    9   HD13  ILE  95          HD11      ILE  95   0.257  10.284  14.165
   10   HD12  ILE  95          HD12      ILE  95  -1.113  11.387  14.259
   11   HD11  ILE  95          HD13      ILE  95  -0.139  11.072  15.694

  No H/Q in entry =          11
  In of MODEL   36
    1    H    GLU  96           H        GLU  96   5.032  12.117  15.366
    2    HA   GLU  96           HA       GLU  96   5.620  13.297  17.859
    3    HB2  GLU  96           HB2      GLU  96   6.541  11.132  17.193
    4    HB3  GLU  96           HB3      GLU  96   7.471  11.903  15.909
    5    HG2  GLU  96           HG2      GLU  96   9.137  12.428  17.360
    6    HG3  GLU  96           HG3      GLU  96   8.008  13.247  18.429

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LEU  97           H        LEU  97   6.674  14.075  14.568
    2    HA   LEU  97           HA       LEU  97   8.585  16.050  15.274
    3    HB2  LEU  97           HB2      LEU  97   6.967  15.528  12.789
    4    HB3  LEU  97           HB3      LEU  97   8.002  16.949  12.909
    5    HG   LEU  97           HG       LEU  97   9.009  14.139  13.447
    6   HD12  LEU  97          HD11      LEU  97   9.987  14.336  11.122
    7   HD11  LEU  97          HD12      LEU  97   8.947  15.737  10.874
    8   HD13  LEU  97          HD13      LEU  97   8.235  14.150  11.167
    9   HD23  LEU  97          HD21      LEU  97  11.183  15.402  12.692
   10   HD22  LEU  97          HD22      LEU  97  10.581  15.669  14.327
   11   HD21  LEU  97          HD23      LEU  97  10.267  16.861  13.068

  No H/Q in entry =          11
  In of MODEL   36
    1    H    HIS  98           H        HIS  98   5.090  16.221  14.650
    2    HA   HIS  98           HA       HIS  98   4.818  19.022  14.801
    3    HB2  HIS  98           HB2      HIS  98   2.913  16.786  15.532
    4    HB3  HIS  98           HB3      HIS  98   2.462  18.490  15.600
    5    HD1  HIS  98           HD1      HIS  98   3.438  15.778  13.174
    6    HD2  HIS  98           HD2      HIS  98   2.097  19.724  13.082
    7    HE1  HIS  98           HE1      HIS  98   2.863  16.284  10.757
    8    HE2  HIS  98           HE2      HIS  98   2.050  18.681  10.680

  No H/Q in entry =           8
  In of MODEL   36
    1    H    GLU  99           H        GLU  99   4.949  16.520  17.287
    2    HA   GLU  99           HA       GLU  99   4.375  18.209  19.498
    3    HB2  GLU  99           HB2      GLU  99   4.265  15.728  19.584
    4    HB3  GLU  99           HB3      GLU  99   6.023  15.667  19.460
    5    HG2  GLU  99           HG2      GLU  99   6.241  16.947  21.539
    6    HG3  GLU  99           HG3      GLU  99   4.491  17.104  21.650

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LYS 100           H        LYS 100   7.407  17.259  17.903
    2    HA   LYS 100           HA       LYS 100   9.091  18.635  19.752
    3    HB2  LYS 100           HB2      LYS 100   9.557  17.720  16.905
    4    HB3  LYS 100           HB3      LYS 100  10.802  18.474  17.906
    5    HG2  LYS 100           HG2      LYS 100  10.424  16.718  19.641
    6    HG3  LYS 100           HG3      LYS 100   9.276  15.930  18.556
    7    HD2  LYS 100           HD2      LYS 100  11.053  15.639  16.872
    8    HD3  LYS 100           HD3      LYS 100  12.207  16.439  17.943
    9    HE2  LYS 100           HE2      LYS 100  11.809  14.679  19.655
   10    HE3  LYS 100           HE3      LYS 100  10.717  13.859  18.535
   11    HZ1  LYS 100           HZ1      LYS 100  13.538  14.506  17.859
   12    HZ3  LYS 100           HZ2      LYS 100  12.477  13.464  17.035
   13    HZ2  LYS 100           HZ3      LYS 100  13.075  13.032  18.566

  No H/Q in entry =          13
  In of MODEL   36
    1    H    LEU 101           H        LEU 101   7.380  19.592  16.816
    2    HA   LEU 101           HA       LEU 101   8.615  22.139  16.483
    3    HB2  LEU 101           HB2      LEU 101   6.001  20.934  15.612
    4    HB3  LEU 101           HB3      LEU 101   6.266  22.664  15.412
    5    HG   LEU 101           HG       LEU 101   8.275  20.634  14.418
    6   HD12  LEU 101          HD11      LEU 101   7.107  21.162  12.146
    7   HD11  LEU 101          HD12      LEU 101   5.720  21.600  13.140
    8   HD13  LEU 101          HD13      LEU 101   6.370  19.963  13.208
    9   HD21  LEU 101          HD21      LEU 101   7.669  23.555  13.883
   10   HD23  LEU 101          HD22      LEU 101   8.632  22.591  12.763
   11   HD22  LEU 101          HD23      LEU 101   9.190  22.836  14.417

  No H/Q in entry =          11
  In of MODEL   36
    1    H    LYS 102           H        LYS 102   7.090  21.003  19.106
    2    HA   LYS 102           HA       LYS 102   6.484  22.090  21.049
    3    HB2  LYS 102           HB2      LYS 102   7.776  24.074  19.924
    4    HB3  LYS 102           HB3      LYS 102   6.179  24.695  19.565
    5    HG2  LYS 102           HG2      LYS 102   7.577  24.413  22.204
    6    HG3  LYS 102           HG3      LYS 102   6.631  25.754  21.590
    7    HD2  LYS 102           HD2      LYS 102   5.370  23.125  22.466
    8    HD3  LYS 102           HD3      LYS 102   5.641  24.478  23.554
    9    HE2  LYS 102           HE2      LYS 102   3.345  24.104  22.083
   10    HE3  LYS 102           HE3      LYS 102   3.869  25.642  22.768
   11    HZ2  LYS 102           HZ1      LYS 102   3.319  25.767  20.394
   12    HZ1  LYS 102           HZ2      LYS 102   4.567  24.675  20.054
   13    HZ3  LYS 102           HZ3      LYS 102   4.930  26.199  20.702

  No H/Q in entry =          13
  In of MODEL   36
    1    H    ALA 103           H        ALA 103   4.837  23.663  18.304
    2    HA   ALA 103           HA       ALA 103   2.396  24.258  19.213
    3    HB1  ALA 103           HB1      ALA 103   1.471  23.436  16.974
    4    HB2  ALA 103           HB2      ALA 103   3.110  22.885  16.627
    5    HB3  ALA 103           HB3      ALA 103   2.794  24.599  16.905

  No H/Q in entry =           5
  In of MODEL   36
    1    H1   ALA   1           H3       ALA   1  10.351 -20.190  -6.362
    2    H2   ALA   1           H2       ALA   1   9.372 -20.380  -7.741
    3    H3   ALA   1           H1       ALA   1   8.940 -21.129  -6.278
    4    HA   ALA   1           HA       ALA   1   9.955 -22.945  -7.035
    5    HB1  ALA   1           HB1      ALA   1  10.034 -22.574  -9.310
    6    HB2  ALA   1           HB2      ALA   1  11.766 -22.443  -8.995
    7    HB3  ALA   1           HB3      ALA   1  10.781 -20.985  -9.130

  No H/Q in entry =           7
  In of MODEL   36
    1    H    GLU   2           H        GLU   2  12.228 -23.918  -7.118
    2    HA   GLU   2           HA       GLU   2  13.630 -23.862  -4.919
    3    HB2  GLU   2           HB2      GLU   2  14.963 -23.730  -7.629
    4    HB3  GLU   2           HB3      GLU   2  15.698 -24.357  -6.154
    5    HG2  GLU   2           HG2      GLU   2  14.659 -26.362  -6.396
    6    HG3  GLU   2           HG3      GLU   2  13.093 -25.598  -6.637

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLU   3           H        GLU   3  15.399 -22.003  -7.326
    2    HA   GLU   3           HA       GLU   3  16.587 -20.339  -5.368
    3    HB2  GLU   3           HB2      GLU   3  16.504 -20.320  -8.377
    4    HB3  GLU   3           HB3      GLU   3  17.272 -19.003  -7.490
    5    HG2  GLU   3           HG2      GLU   3  18.928 -20.400  -6.589
    6    HG3  GLU   3           HG3      GLU   3  17.964 -21.855  -6.809

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LEU   4           H        LEU   4  14.291 -19.453  -7.974
    2    HA   LEU   4           HA       LEU   4  13.857 -16.843  -7.345
    3    HB2  LEU   4           HB2      LEU   4  11.655 -18.791  -8.066
    4    HB3  LEU   4           HB3      LEU   4  11.596 -17.040  -8.254
    5    HG   LEU   4           HG       LEU   4  13.529 -18.916  -9.655
    6   HD13  LEU   4          HD11      LEU   4  12.212 -18.744 -11.552
    7   HD12  LEU   4          HD12      LEU   4  11.524 -17.194 -11.070
    8   HD11  LEU   4          HD13      LEU   4  10.962 -18.683 -10.312
    9   HD23  LEU   4          HD21      LEU   4  13.877 -16.668 -10.998
   10   HD22  LEU   4          HD22      LEU   4  14.748 -16.927  -9.487
   11   HD21  LEU   4          HD23      LEU   4  13.305 -15.915  -9.508

  No H/Q in entry =          11
  In of MODEL   36
    1    H    GLU   5           H        GLU   5  12.358 -19.620  -5.704
    2    HA   GLU   5           HA       GLU   5  10.712 -18.040  -3.978
    3    HB2  GLU   5           HB2      GLU   5  10.263 -20.414  -4.511
    4    HB3  GLU   5           HB3      GLU   5  11.695 -20.866  -3.584
    5    HG2  GLU   5           HG2      GLU   5   9.812 -21.090  -2.107
    6    HG3  GLU   5           HG3      GLU   5  10.690 -19.643  -1.615

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLU   6           H        GLU   6  13.846 -19.654  -3.572
    2    HA   GLU   6           HA       GLU   6  14.231 -18.816  -0.872
    3    HB2  GLU   6           HB2      GLU   6  15.426 -20.738  -1.904
    4    HB3  GLU   6           HB3      GLU   6  16.306 -19.607  -2.933
    5    HG2  GLU   6           HG2      GLU   6  17.709 -20.096  -1.034
    6    HG3  GLU   6           HG3      GLU   6  17.105 -18.452  -0.837

  No H/Q in entry =           6
  In of MODEL   36
    1    H    VAL   7           H        VAL   7  14.982 -17.481  -4.022
    2    HA   VAL   7           HA       VAL   7  16.698 -15.376  -3.161
    3    HB   VAL   7           HB       VAL   7  14.966 -15.709  -5.625
    4   HG11  VAL   7          HG11      VAL   7  16.889 -13.519  -4.818
    5   HG13  VAL   7          HG12      VAL   7  15.243 -13.357  -5.426
    6   HG12  VAL   7          HG13      VAL   7  16.537 -13.867  -6.511
    7   HG21  VAL   7          HG21      VAL   7  17.063 -17.190  -5.083
    8   HG23  VAL   7          HG22      VAL   7  17.979 -15.736  -5.481
    9   HG22  VAL   7          HG23      VAL   7  16.925 -16.469  -6.687

  No H/Q in entry =           9
  In of MODEL   36
    1    H    VAL   8           H        VAL   8  13.198 -15.608  -3.688
    2    HA   VAL   8           HA       VAL   8  12.563 -12.896  -3.196
    3    HB   VAL   8           HB       VAL   8  10.978 -15.449  -2.889
    4   HG13  VAL   8          HG11      VAL   8  10.019 -13.991  -1.257
    5   HG12  VAL   8          HG12      VAL   8   8.992 -13.845  -2.684
    6   HG11  VAL   8          HG13      VAL   8  10.172 -12.589  -2.316
    7   HG21  VAL   8          HG21      VAL   8  11.564 -13.595  -5.059
    8   HG23  VAL   8          HG22      VAL   8   9.832 -13.638  -4.746
    9   HG22  VAL   8          HG23      VAL   8  10.693 -15.126  -5.125

  No H/Q in entry =           9
  In of MODEL   36
    1    H    MET   9           H        MET   9  12.822 -15.715  -1.033
    2    HA   MET   9           HA       MET   9  12.040 -14.448   1.351
    3    HB2  MET   9           HB2      MET   9  13.917 -16.740   0.779
    4    HB3  MET   9           HB3      MET   9  13.644 -16.164   2.423
    5    HG2  MET   9           HG2      MET   9  11.232 -16.548   2.182
    6    HG3  MET   9           HG3      MET   9  11.471 -17.074   0.515
    7    HE1  MET   9           HE1      MET   9  12.220 -17.361   4.057
    8    HE3  MET   9           HE2      MET   9  13.774 -18.166   3.856
    9    HE2  MET   9           HE3      MET   9  12.387 -19.078   4.445

  No H/Q in entry =           9
  In of MODEL   36
    1    H    GLY  10           H        GLY  10  15.205 -14.695  -0.235
    2    HA3  GLY  10           HA2      GLY  10  16.695 -13.298   1.729
    3    HA2  GLY  10           HA3      GLY  10  17.141 -13.459   0.030

  No H/Q in entry =           3
  In of MODEL   36
    1    H    LEU  11           H        LEU  11  14.973 -12.211  -1.183
    2    HA   LEU  11           HA       LEU  11  15.685  -9.473  -1.012
    3    HB2  LEU  11           HB2      LEU  11  13.293 -10.855  -2.233
    4    HB3  LEU  11           HB3      LEU  11  13.588  -9.122  -2.386
    5    HG   LEU  11           HG       LEU  11  15.589 -11.245  -3.203
    6   HD13  LEU  11          HD11      LEU  11  13.827 -11.588  -4.709
    7   HD12  LEU  11          HD12      LEU  11  14.833 -10.411  -5.552
    8   HD11  LEU  11          HD13      LEU  11  13.371  -9.884  -4.718
    9   HD22  LEU  11          HD21      LEU  11  16.840  -9.294  -2.978
   10   HD21  LEU  11          HD22      LEU  11  15.471  -8.243  -3.339
   11   HD23  LEU  11          HD23      LEU  11  16.283  -9.112  -4.640

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  12           H        ILE  12  12.911 -11.282   0.271
    2    HA   ILE  12           HA       ILE  12  11.547  -9.052   1.354
    3    HB   ILE  12           HB       ILE  12  11.569 -11.954   2.237
    4   HG12  ILE  12          HG12      ILE  12  10.794 -11.272  -0.145
    5   HG13  ILE  12          HG13      ILE  12   9.727 -12.295   0.797
    6   HG22  ILE  12          HG21      ILE  12   9.322 -11.345   3.256
    7   HG21  ILE  12          HG22      ILE  12   9.745  -9.652   3.002
    8   HG23  ILE  12          HG23      ILE  12  10.723 -10.654   4.074
    9   HD13  ILE  12          HD11      ILE  12   8.370 -10.359   1.386
   10   HD12  ILE  12          HD12      ILE  12   8.548 -10.434  -0.365
   11   HD11  ILE  12          HD13      ILE  12   9.495  -9.291   0.563

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  13           H        ILE  13  13.934 -11.283   2.727
    2    HA   ILE  13           HA       ILE  13  14.001 -10.118   5.313
    3    HB   ILE  13           HB       ILE  13  16.032 -11.700   3.720
    4   HG12  ILE  13          HG12      ILE  13  13.755 -12.647   4.590
    5   HG13  ILE  13          HG13      ILE  13  15.224 -13.587   4.827
    6   HG22  ILE  13          HG21      ILE  13  17.026 -12.075   6.110
    7   HG21  ILE  13          HG22      ILE  13  16.219 -10.564   6.510
    8   HG23  ILE  13          HG23      ILE  13  17.446 -10.599   5.242
    9   HD11  ILE  13          HD11      ILE  13  14.132 -11.690   6.934
   10   HD13  ILE  13          HD12      ILE  13  15.393 -12.904   7.121
   11   HD12  ILE  13          HD13      ILE  13  13.726 -13.404   6.869

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ASN  14           H        ASN  14  15.933  -9.587   2.381
    2    HA   ASN  14           HA       ASN  14  17.701  -7.663   3.437
    3    HB2  ASN  14           HB2      ASN  14  17.649  -8.917   1.115
    4    HB3  ASN  14           HB3      ASN  14  16.762  -7.491   0.593
    5   HD21  ASN  14          HD21      ASN  14  19.189  -7.841  -0.615
    6   HD22  ASN  14          HD22      ASN  14  20.345  -6.769   0.007

  No H/Q in entry =           6
  In of MODEL   36
    1    H    SER  15           H        SER  15  14.578  -7.286   1.774
    2    HA   SER  15           HA       SER  15  14.485  -4.465   1.846
    3    HB2  SER  15           HB2      SER  15  12.152  -4.692   1.360
    4    HB3  SER  15           HB3      SER  15  12.927  -6.070   0.589
    5    HG   SER  15           HG       SER  15  11.441  -7.088   1.713

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLY  16           H        GLY  16  13.396  -6.930   4.146
    2    HA3  GLY  16           HA2      GLY  16  12.202  -5.183   6.023
    3    HA2  GLY  16           HA3      GLY  16  12.809  -6.797   6.371

  No H/Q in entry =           3
  In of MODEL   36
    1    H    GLN  17           H        GLN  17  15.517  -6.478   5.757
    2    HA   GLN  17           HA       GLN  17  16.502  -5.275   8.136
    3    HB2  GLN  17           HB2      GLN  17  17.701  -7.072   6.905
    4    HB3  GLN  17           HB3      GLN  17  18.025  -5.934   5.596
    5    HG2  GLN  17           HG2      GLN  17  19.972  -6.027   7.049
    6    HG3  GLN  17           HG3      GLN  17  19.198  -4.455   7.236
    7   HE21  GLN  17          HE21      GLN  17  19.775  -4.052   9.436
    8   HE22  GLN  17          HE22      GLN  17  19.261  -5.036  10.720

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ALA  18           H        ALA  18  16.291  -4.179   4.783
    2    HA   ALA  18           HA       ALA  18  17.744  -1.796   5.010
    3    HB2  ALA  18           HB1      ALA  18  16.601  -2.993   2.946
    4    HB3  ALA  18           HB2      ALA  18  16.876  -1.252   2.937
    5    HB1  ALA  18           HB3      ALA  18  15.276  -1.890   3.317

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ARG  19           H        ARG  19  14.244  -2.365   5.434
    2    HA   ARG  19           HA       ARG  19  13.597   0.285   6.168
    3    HB2  ARG  19           HB2      ARG  19  11.901  -1.454   5.587
    4    HB3  ARG  19           HB3      ARG  19  12.251  -2.262   7.117
    5    HG2  ARG  19           HG2      ARG  19  11.563  -0.273   8.373
    6    HG3  ARG  19           HG3      ARG  19  11.305   0.613   6.871
    7    HD2  ARG  19           HD2      ARG  19   9.166  -0.175   7.705
    8    HD3  ARG  19           HD3      ARG  19   9.568  -1.049   6.220
    9    HE   ARG  19           HE       ARG  19  10.535  -2.609   8.309
   10   HH21  ARG  19          HH11      ARG  19   9.284  -4.246   9.250
   11   HH22  ARG  19          HH12      ARG  19   7.563  -4.208   9.094
   12   HH11  ARG  19          HH21      ARG  19   7.539  -1.293   7.246
   13   HH12  ARG  19          HH22      ARG  19   6.575  -2.536   7.955

  No H/Q in entry =          13
  In of MODEL   36
    1    H    SER  20           H        SER  20  14.455  -2.561   8.106
    2    HA   SER  20           HA       SER  20  14.200  -1.473  10.651
    3    HB2  SER  20           HB2      SER  20  14.651  -3.799  10.515
    4    HB3  SER  20           HB3      SER  20  16.095  -3.540   9.539
    5    HG   SER  20           HG       SER  20  16.814  -2.293  11.496

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU  21           H        LEU  21  17.025  -1.417   8.491
    2    HA   LEU  21           HA       LEU  21  18.723   0.051  10.223
    3    HB2  LEU  21           HB2      LEU  21  18.674  -0.208   7.209
    4    HB3  LEU  21           HB3      LEU  21  19.940   0.644   8.089
    5    HG   LEU  21           HG       LEU  21  19.194  -2.246   8.625
    6   HD11  LEU  21          HD11      LEU  21  21.212  -1.018   6.747
    7   HD13  LEU  21          HD12      LEU  21  20.029  -2.282   6.414
    8   HD12  LEU  21          HD13      LEU  21  21.440  -2.637   7.408
    9   HD23  LEU  21          HD21      LEU  21  21.684  -2.101   9.500
   10   HD22  LEU  21          HD22      LEU  21  20.388  -1.501  10.527
   11   HD21  LEU  21          HD23      LEU  21  21.361  -0.373   9.598

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ALA  22           H        ALA  22  16.443   1.046   7.691
    2    HA   ALA  22           HA       ALA  22  16.999   3.801   7.715
    3    HB3  ALA  22           HB1      ALA  22  15.575   2.576   6.042
    4    HB2  ALA  22           HB2      ALA  22  14.882   4.090   6.622
    5    HB1  ALA  22           HB3      ALA  22  14.287   2.551   7.247

  No H/Q in entry =           5
  In of MODEL   36
    1    H    TYR  23           H        TYR  23  14.506   1.990   9.561
    2    HA   TYR  23           HA       TYR  23  13.569   4.226  11.030
    3    HB2  TYR  23           HB2      TYR  23  12.321   2.119  11.008
    4    HB3  TYR  23           HB3      TYR  23  13.654   1.296  11.817
    5    HD1  TYR  23           HD1      TYR  23  11.165   4.047  12.217
    6    HD2  TYR  23           HD2      TYR  23  13.876   1.350  14.173
    7    HE1  TYR  23           HE1      TYR  23  10.258   4.734  14.423
    8    HE2  TYR  23           HE2      TYR  23  12.971   2.037  16.377
    9    HH   TYR  23           HH       TYR  23  10.299   4.387  16.614

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ALA  24           H        ALA  24  16.205   1.930  11.633
    2    HA   ALA  24           HA       ALA  24  16.903   2.908  14.196
    3    HB1  ALA  24           HB1      ALA  24  18.247   1.107  14.011
    4    HB3  ALA  24           HB2      ALA  24  19.271   2.028  12.908
    5    HB2  ALA  24           HB3      ALA  24  17.965   1.031  12.272

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA  25           H        ALA  25  17.839   3.848  10.915
    2    HA   ALA  25           HA       ALA  25  19.802   5.767  11.554
    3    HB1  ALA  25           HB1      ALA  25  19.060   4.836   9.240
    4    HB3  ALA  25           HB2      ALA  25  19.573   6.519   9.338
    5    HB2  ALA  25           HB3      ALA  25  17.856   6.124   9.281

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU  26           H        LEU  26  16.286   6.020  11.223
    2    HA   LEU  26           HA       LEU  26  16.084   8.801  11.691
    3    HB2  LEU  26           HB2      LEU  26  14.206   7.583  10.772
    4    HB3  LEU  26           HB3      LEU  26  14.120   6.548  12.192
    5    HG   LEU  26           HG       LEU  26  13.539   8.503  13.588
    6   HD12  LEU  26          HD11      LEU  26  12.881  10.615  12.279
    7   HD11  LEU  26          HD12      LEU  26  13.847   9.962  10.958
    8   HD13  LEU  26          HD13      LEU  26  14.607  10.334  12.506
    9   HD21  LEU  26          HD21      LEU  26  11.841   8.214  11.091
   10   HD23  LEU  26          HD22      LEU  26  11.298   8.908  12.615
   11   HD22  LEU  26          HD23      LEU  26  11.737   7.204  12.532

  No H/Q in entry =          11
  In of MODEL   36
    1    H    LYS  27           H        LYS  27  15.974   6.011  13.870
    2    HA   LYS  27           HA       LYS  27  15.411   7.368  16.250
    3    HB2  LYS  27           HB2      LYS  27  15.419   4.894  15.972
    4    HB3  LYS  27           HB3      LYS  27  17.182   4.934  15.914
    5    HG2  LYS  27           HG2      LYS  27  17.258   5.907  18.169
    6    HG3  LYS  27           HG3      LYS  27  15.491   5.938  18.229
    7    HD2  LYS  27           HD2      LYS  27  15.446   3.473  17.979
    8    HD3  LYS  27           HD3      LYS  27  17.211   3.450  17.953
    9    HE2  LYS  27           HE2      LYS  27  17.271   4.426  20.214
   10    HE3  LYS  27           HE3      LYS  27  15.505   4.479  20.244
   11    HZ3  LYS  27           HZ1      LYS  27  16.288   2.515  21.378
   12    HZ2  LYS  27           HZ2      LYS  27  17.190   2.036  20.017
   13    HZ1  LYS  27           HZ3      LYS  27  15.491   2.055  19.951

  No H/Q in entry =          13
  In of MODEL   36
    1    H    GLN  28           H        GLN  28  18.510   6.771  14.630
    2    HA   GLN  28           HA       GLN  28  20.218   7.831  16.612
    3    HB2  GLN  28           HB2      GLN  28  20.477   7.791  13.594
    4    HB3  GLN  28           HB3      GLN  28  21.776   8.261  14.690
    5    HG2  GLN  28           HG2      GLN  28  20.354   5.585  14.747
    6    HG3  GLN  28           HG3      GLN  28  21.930   5.870  14.012
    7   HE21  GLN  28          HE21      GLN  28  20.645   4.597  16.748
    8   HE22  GLN  28          HE22      GLN  28  21.859   5.001  17.864

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ALA  29           H        ALA  29  18.456   9.342  13.942
    2    HA   ALA  29           HA       ALA  29  19.479  11.953  14.201
    3    HB2  ALA  29           HB1      ALA  29  17.773  12.612  12.747
    4    HB1  ALA  29           HB2      ALA  29  16.625  11.444  13.401
    5    HB3  ALA  29           HB3      ALA  29  17.942  10.897  12.364

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LYS  30           H        LYS  30  16.701  10.369  15.736
    2    HA   LYS  30           HA       LYS  30  15.718  12.623  17.114
    3    HB2  LYS  30           HB2      LYS  30  15.586   9.679  17.803
    4    HB3  LYS  30           HB3      LYS  30  14.739  10.932  18.710
    5    HG2  LYS  30           HG2      LYS  30  13.603  11.640  16.605
    6    HG3  LYS  30           HG3      LYS  30  14.389  10.301  15.764
    7    HD2  LYS  30           HD2      LYS  30  13.315   8.695  17.293
    8    HD3  LYS  30           HD3      LYS  30  12.539  10.022  18.157
    9    HE2  LYS  30           HE2      LYS  30  11.360  10.677  16.078
   10    HE3  LYS  30           HE3      LYS  30  12.115   9.320  15.233
   11    HZ2  LYS  30           HZ1      LYS  30   9.811   8.927  16.130
   12    HZ1  LYS  30           HZ2      LYS  30  10.492   8.965  17.692
   13    HZ3  LYS  30           HZ3      LYS  30  10.980   7.782  16.571

  No H/Q in entry =          13
  In of MODEL   36
    1    H    GLN  31           H        GLN  31  18.365  10.426  17.817
    2    HA   GLN  31           HA       GLN  31  18.724  11.423  20.514
    3    HB2  GLN  31           HB2      GLN  31  20.719   9.843  18.884
    4    HB3  GLN  31           HB3      GLN  31  20.601   9.958  20.640
    5    HG2  GLN  31           HG2      GLN  31  18.072   9.033  19.887
    6    HG3  GLN  31           HG3      GLN  31  19.157   8.185  18.793
    7   HE21  GLN  31          HE21      GLN  31  17.623   7.040  21.076
    8   HE22  GLN  31          HE22      GLN  31  18.781   6.363  22.113

  No H/Q in entry =           8
  In of MODEL   36
    1    H    GLY  32           H        GLY  32  19.230  12.752  17.550
    2    HA3  GLY  32           HA2      GLY  32  20.229  14.791  17.039
    3    HA2  GLY  32           HA3      GLY  32  20.999  14.780  18.621

  No H/Q in entry =           3
  In of MODEL   36
    1    H    ASP  33           H        ASP  33  21.381  11.894  16.824
    2    HA   ASP  33           HA       ASP  33  24.208  12.546  16.338
    3    HB2  ASP  33           HB2      ASP  33  22.677   9.943  16.453
    4    HB3  ASP  33           HB3      ASP  33  24.360  10.047  15.945

  No H/Q in entry =           4
  In of MODEL   36
    1    H    PHE  34           H        PHE  34  23.723  13.884  14.468
    2    HA   PHE  34           HA       PHE  34  22.346  12.925  12.187
    3    HB2  PHE  34           HB2      PHE  34  24.498  15.038  12.411
    4    HB3  PHE  34           HB3      PHE  34  23.498  14.765  10.986
    5    HD1  PHE  34           HD1      PHE  34  23.791  16.680  13.908
    6    HD2  PHE  34           HD2      PHE  34  20.875  14.603  11.535
    7    HE1  PHE  34           HE1      PHE  34  21.994  18.089  14.878
    8    HE2  PHE  34           HE2      PHE  34  19.083  16.012  12.507
    9    HZ   PHE  34           HZ       PHE  34  19.646  17.755  14.174

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ALA  35           H        ALA  35  25.727  12.702  13.166
    2    HA   ALA  35           HA       ALA  35  26.805  11.885  10.695
    3    HB3  ALA  35           HB1      ALA  35  28.489  10.691  12.394
    4    HB2  ALA  35           HB2      ALA  35  27.644  11.718  13.553
    5    HB1  ALA  35           HB3      ALA  35  28.476  12.441  12.177

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA  36           H        ALA  36  25.695   9.923  13.459
    2    HA   ALA  36           HA       ALA  36  26.148   7.439  12.166
    3    HB2  ALA  36           HB1      ALA  36  25.728   6.684  14.241
    4    HB3  ALA  36           HB2      ALA  36  24.043   7.194  14.108
    5    HB1  ALA  36           HB3      ALA  36  25.259   8.312  14.726

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA  37           H        ALA  37  23.345   9.587  12.335
    2    HA   ALA  37           HA       ALA  37  21.465   7.839  11.165
    3    HB3  ALA  37           HB1      ALA  37  21.717  10.799  11.471
    4    HB1  ALA  37           HB2      ALA  37  20.400   9.728  11.949
    5    HB2  ALA  37           HB3      ALA  37  20.579  10.208  10.261

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LYS  38           H        LYS  38  23.571  10.292   9.682
    2    HA   LYS  38           HA       LYS  38  22.906   9.884   7.008
    3    HB2  LYS  38           HB2      LYS  38  24.740  11.419   8.446
    4    HB3  LYS  38           HB3      LYS  38  25.757  10.427   7.407
    5    HG2  LYS  38           HG2      LYS  38  24.582  11.218   5.424
    6    HG3  LYS  38           HG3      LYS  38  23.402  12.076   6.420
    7    HD2  LYS  38           HD2      LYS  38  25.016  13.658   7.168
    8    HD3  LYS  38           HD3      LYS  38  26.364  12.665   6.615
    9    HE2  LYS  38           HE2      LYS  38  26.008  14.547   5.077
   10    HE3  LYS  38           HE3      LYS  38  25.655  13.017   4.267
   11    HZ3  LYS  38           HZ1      LYS  38  23.460  13.479   4.158
   12    HZ2  LYS  38           HZ2      LYS  38  23.996  15.089   4.250
   13    HZ1  LYS  38           HZ3      LYS  38  23.428  14.302   5.643

  No H/Q in entry =          13
  In of MODEL   36
    1    H    ALA  39           H        ALA  39  25.424   8.257   8.934
    2    HA   ALA  39           HA       ALA  39  26.465   6.672   6.847
    3    HB2  ALA  39           HB1      ALA  39  26.393   5.693   9.686
    4    HB1  ALA  39           HB2      ALA  39  27.352   7.114   9.269
    5    HB3  ALA  39           HB3      ALA  39  27.686   5.565   8.495

  No H/Q in entry =           5
  In of MODEL   36
    1    H    MET  40           H        MET  40  23.866   6.062   9.163
    2    HA   MET  40           HA       MET  40  23.398   3.364   8.418
    3    HB2  MET  40           HB2      MET  40  21.607   5.414   9.737
    4    HB3  MET  40           HB3      MET  40  21.187   3.708   9.556
    5    HG2  MET  40           HG2      MET  40  23.754   4.624  10.881
    6    HG3  MET  40           HG3      MET  40  22.265   4.354  11.785
    7    HE3  MET  40           HE1      MET  40  21.677   0.724  11.945
    8    HE2  MET  40           HE2      MET  40  20.811   2.037  11.152
    9    HE1  MET  40           HE3      MET  40  21.567   2.310  12.721

  No H/Q in entry =           9
  In of MODEL   36
    1    H    MET  41           H        MET  41  21.996   6.434   7.259
    2    HA   MET  41           HA       MET  41  20.016   5.262   5.598
    3    HB2  MET  41           HB2      MET  41  21.511   7.844   5.086
    4    HB3  MET  41           HB3      MET  41  19.974   7.365   4.378
    5    HG2  MET  41           HG2      MET  41  19.248   7.168   6.934
    6    HG3  MET  41           HG3      MET  41  20.566   8.315   7.151
    7    HE2  MET  41           HE1      MET  41  19.984   9.625   3.827
    8    HE1  MET  41           HE2      MET  41  20.956  10.051   5.233
    9    HE3  MET  41           HE3      MET  41  19.686  11.142   4.685

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ASP  42           H        ASP  42  23.390   6.165   5.021
    2    HA   ASP  42           HA       ASP  42  23.456   5.705   2.260
    3    HB2  ASP  42           HB2      ASP  42  25.228   6.681   4.020
    4    HB3  ASP  42           HB3      ASP  42  25.874   5.052   3.878

  No H/Q in entry =           4
  In of MODEL   36
    1    H    GLN  43           H        GLN  43  24.188   3.531   4.963
    2    HA   GLN  43           HA       GLN  43  24.824   1.278   3.362
    3    HB2  GLN  43           HB2      GLN  43  23.827   1.452   6.215
    4    HB3  GLN  43           HB3      GLN  43  24.389  -0.036   5.447
    5    HG2  GLN  43           HG2      GLN  43  26.556   1.163   4.924
    6    HG3  GLN  43           HG3      GLN  43  25.991   2.488   5.936
    7   HE21  GLN  43          HE21      GLN  43  28.226   1.495   6.949
    8   HE22  GLN  43          HE22      GLN  43  27.955   0.407   8.221

  No H/Q in entry =           8
  In of MODEL   36
    1    H    SER  44           H        SER  44  21.788   2.424   4.779
    2    HA   SER  44           HA       SER  44  20.198   0.195   4.107
    3    HB2  SER  44           HB2      SER  44  19.783   2.720   5.271
    4    HB3  SER  44           HB3      SER  44  18.737   2.692   3.854
    5    HG   SER  44           HG       SER  44  17.651   1.747   5.581

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ARG  45           H        ARG  45  20.946   3.165   2.313
    2    HA   ARG  45           HA       ARG  45  19.398   2.702   0.018
    3    HB2  ARG  45           HB2      ARG  45  20.561   4.827   0.605
    4    HB3  ARG  45           HB3      ARG  45  22.097   4.064   0.202
    5    HG2  ARG  45           HG2      ARG  45  21.291   3.677  -2.108
    6    HG3  ARG  45           HG3      ARG  45  19.768   4.462  -1.704
    7    HD2  ARG  45           HD2      ARG  45  21.037   6.547  -1.119
    8    HD3  ARG  45           HD3      ARG  45  22.524   5.767  -1.705
    9    HE   ARG  45           HE       ARG  45  20.574   5.553  -3.725
   10   HH21  ARG  45          HH11      ARG  45  20.562   6.932  -5.481
   11   HH22  ARG  45          HH12      ARG  45  21.330   8.477  -5.375
   12   HH11  ARG  45          HH21      ARG  45  22.336   8.031  -2.100
   13   HH12  ARG  45          HH22      ARG  45  22.334   9.098  -3.457

  No H/Q in entry =          13
  In of MODEL   36
    1    H    MET  46           H        MET  46  22.762   1.799   0.732
    2    HA   MET  46           HA       MET  46  23.338   0.616  -1.764
    3    HB2  MET  46           HB2      MET  46  24.466   0.255   1.014
    4    HB3  MET  46           HB3      MET  46  25.109  -0.618  -0.382
    5    HG2  MET  46           HG2      MET  46  25.521   1.522  -1.538
    6    HG3  MET  46           HG3      MET  46  24.869   2.400  -0.160
    7    HE2  MET  46           HE1      MET  46  27.444   3.776   0.807
    8    HE1  MET  46           HE2      MET  46  26.924   3.542  -0.859
    9    HE3  MET  46           HE3      MET  46  28.577   3.143  -0.395

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ALA  47           H        ALA  47  21.971  -0.723   1.217
    2    HA   ALA  47           HA       ALA  47  21.890  -3.431   0.400
    3    HB2  ALA  47           HB1      ALA  47  21.535  -2.980   2.711
    4    HB3  ALA  47           HB2      ALA  47  19.989  -3.568   2.102
    5    HB1  ALA  47           HB3      ALA  47  20.234  -1.840   2.368

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU  48           H        LEU  48  19.554  -0.784   0.079
    2    HA   LEU  48           HA       LEU  48  17.486  -2.295  -1.161
    3    HB2  LEU  48           HB2      LEU  48  18.163   0.655  -1.267
    4    HB3  LEU  48           HB3      LEU  48  16.680  -0.041  -1.923
    5    HG   LEU  48           HG       LEU  48  17.558  -0.365   0.955
    6   HD13  LEU  48          HD11      LEU  48  17.157   1.940   0.785
    7   HD12  LEU  48          HD12      LEU  48  15.598   1.303   1.305
    8   HD11  LEU  48          HD13      LEU  48  15.857   1.731  -0.386
    9   HD22  LEU  48          HD21      LEU  48  16.012  -2.065   0.580
   10   HD21  LEU  48          HD22      LEU  48  15.134  -1.149  -0.645
   11   HD23  LEU  48          HD23      LEU  48  14.941  -0.751   1.062

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ASN  49           H        ASN  49  20.178  -0.382  -2.407
    2    HA   ASN  49           HA       ASN  49  19.501  -0.446  -5.125
    3    HB2  ASN  49           HB2      ASN  49  21.201   1.051  -4.210
    4    HB3  ASN  49           HB3      ASN  49  22.224  -0.320  -3.795
    5   HD21  ASN  49          HD21      ASN  49  23.215   1.695  -5.483
    6   HD22  ASN  49          HD22      ASN  49  23.378   1.079  -7.056

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLU  50           H        GLU  50  21.486  -2.667  -3.193
    2    HA   GLU  50           HA       GLU  50  22.152  -4.418  -5.334
    3    HB2  GLU  50           HB2      GLU  50  23.371  -4.413  -3.179
    4    HB3  GLU  50           HB3      GLU  50  21.931  -5.033  -2.373
    5    HG2  GLU  50           HG2      GLU  50  21.991  -7.060  -3.742
    6    HG3  GLU  50           HG3      GLU  50  23.363  -6.435  -4.653

  No H/Q in entry =           6
  In of MODEL   36
    1    H    ALA  51           H        ALA  51  19.519  -4.342  -2.982
    2    HA   ALA  51           HA       ALA  51  18.325  -6.801  -3.740
    3    HB3  ALA  51           HB1      ALA  51  16.752  -6.290  -2.167
    4    HB1  ALA  51           HB2      ALA  51  16.547  -4.639  -2.756
    5    HB2  ALA  51           HB3      ALA  51  17.913  -5.042  -1.715

  No H/Q in entry =           5
  In of MODEL   36
    1    H    HIS  52           H        HIS  52  17.757  -3.444  -4.753
    2    HA   HIS  52           HA       HIS  52  15.622  -3.944  -6.535
    3    HB2  HIS  52           HB2      HIS  52  16.242  -1.687  -5.758
    4    HB3  HIS  52           HB3      HIS  52  17.746  -1.789  -6.672
    5    HD1  HIS  52           HD1      HIS  52  17.280  -2.398  -9.370
    6    HD2  HIS  52           HD2      HIS  52  14.218  -0.540  -7.236
    7    HE1  HIS  52           HE1      HIS  52  15.722  -1.382 -11.090
    8    HE2  HIS  52           HE2      HIS  52  13.851  -0.245  -9.804

  No H/Q in entry =           8
  In of MODEL   36
    1    H    LEU  53           H        LEU  53  19.136  -3.977  -7.002
    2    HA   LEU  53           HA       LEU  53  19.164  -4.279  -9.804
    3    HB2  LEU  53           HB2      LEU  53  21.111  -5.067  -7.652
    4    HB3  LEU  53           HB3      LEU  53  21.408  -5.448  -9.346
    5    HG   LEU  53           HG       LEU  53  20.768  -2.637  -8.401
    6   HD11  LEU  53          HD11      LEU  53  23.474  -3.940  -8.827
    7   HD13  LEU  53          HD12      LEU  53  22.817  -3.394  -7.285
    8   HD12  LEU  53          HD13      LEU  53  23.209  -2.223  -8.538
    9   HD21  LEU  53          HD21      LEU  53  21.818  -3.865 -10.957
   10   HD23  LEU  53          HD22      LEU  53  22.162  -2.184 -10.560
   11   HD22  LEU  53          HD23      LEU  53  20.502  -2.712 -10.768

  No H/Q in entry =          11
  In of MODEL   36
    1    H    VAL  54           H        VAL  54  19.058  -6.677  -7.188
    2    HA   VAL  54           HA       VAL  54  19.146  -8.965  -8.860
    3    HB   VAL  54           HB       VAL  54  18.022  -8.545  -6.079
    4   HG12  VAL  54          HG11      VAL  54  18.326 -11.165  -6.090
    5   HG11  VAL  54          HG12      VAL  54  18.125 -10.987  -7.833
    6   HG13  VAL  54          HG13      VAL  54  16.851 -10.452  -6.740
    7   HG22  VAL  54          HG21      VAL  54  20.342  -8.353  -5.878
    8   HG21  VAL  54          HG22      VAL  54  20.657  -9.442  -7.228
    9   HG23  VAL  54          HG23      VAL  54  20.137 -10.092  -5.673

  No H/Q in entry =           9
  In of MODEL   36
    1    H    GLN  55           H        GLN  55  16.446  -7.047  -7.542
    2    HA   GLN  55           HA       GLN  55  14.401  -8.691  -8.603
    3    HB2  GLN  55           HB2      GLN  55  13.681  -7.167  -6.962
    4    HB3  GLN  55           HB3      GLN  55  14.476  -5.801  -7.740
    5    HG2  GLN  55           HG2      GLN  55  12.740  -5.457  -9.211
    6    HG3  GLN  55           HG3      GLN  55  12.404  -7.174  -9.386
    7   HE21  GLN  55          HE21      GLN  55  10.401  -7.712  -8.564
    8   HE22  GLN  55          HE22      GLN  55   9.645  -6.958  -7.244

  No H/Q in entry =           8
  In of MODEL   36
    1    H    THR  56           H        THR  56  16.148  -5.897  -9.967
    2    HA   THR  56           HA       THR  56  14.690  -5.514 -12.299
    3    HB   THR  56           HB       THR  56  17.712  -5.445 -12.148
    4    HG1  THR  56           HG1      THR  56  16.451  -4.292 -10.460
    5   HG23  THR  56          HG21      THR  56  17.111  -5.065 -14.377
    6   HG22  THR  56          HG22      THR  56  17.159  -3.430 -13.719
    7   HG21  THR  56          HG23      THR  56  15.611  -4.249 -13.934

  No H/Q in entry =           7
  In of MODEL   36
    1    H    LYS  57           H        LYS  57  17.329  -7.833 -11.725
    2    HA   LYS  57           HA       LYS  57  17.296  -9.016 -14.308
    3    HB2  LYS  57           HB2      LYS  57  19.101  -9.289 -12.582
    4    HB3  LYS  57           HB3      LYS  57  17.999 -10.281 -11.638
    5    HG2  LYS  57           HG2      LYS  57  17.875 -11.926 -13.433
    6    HG3  LYS  57           HG3      LYS  57  18.885 -10.922 -14.467
    7    HD2  LYS  57           HD2      LYS  57  20.743 -11.132 -12.838
    8    HD3  LYS  57           HD3      LYS  57  19.737 -12.178 -11.837
    9    HE2  LYS  57           HE2      LYS  57  20.441 -12.778 -14.730
   10    HE3  LYS  57           HE3      LYS  57  21.315 -13.449 -13.355
   11    HZ3  LYS  57           HZ1      LYS  57  19.808 -15.052 -13.370
   12    HZ2  LYS  57           HZ2      LYS  57  18.799 -14.218 -14.452
   13    HZ1  LYS  57           HZ3      LYS  57  18.691 -13.919 -12.785

  No H/Q in entry =          13
  In of MODEL   36
    1    H    LEU  58           H        LEU  58  15.540  -9.684 -11.318
    2    HA   LEU  58           HA       LEU  58  14.293 -12.045 -12.251
    3    HB2  LEU  58           HB2      LEU  58  13.533 -10.144 -10.039
    4    HB3  LEU  58           HB3      LEU  58  12.712 -11.675 -10.354
    5    HG   LEU  58           HG       LEU  58  15.693 -11.420  -9.828
    6   HD11  LEU  58          HD11      LEU  58  13.337 -11.829  -8.013
    7   HD13  LEU  58          HD12      LEU  58  14.799 -10.876  -7.761
    8   HD12  LEU  58          HD13      LEU  58  14.861 -12.634  -7.634
    9   HD22  LEU  58          HD21      LEU  58  15.551 -13.476 -10.863
   10   HD21  LEU  58          HD22      LEU  58  13.839 -13.675 -10.486
   11   HD23  LEU  58          HD23      LEU  58  15.058 -13.990  -9.250

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  59           H        ILE  59  13.637  -8.701 -12.912
    2    HA   ILE  59           HA       ILE  59  10.908  -9.327 -13.828
    3    HB   ILE  59           HB       ILE  59  11.745  -7.054 -12.622
    4   HG12  ILE  59          HG12      ILE  59   9.808  -6.898 -14.941
    5   HG13  ILE  59          HG13      ILE  59   9.405  -7.693 -13.441
    6   HG22  ILE  59          HG21      ILE  59  11.786  -6.226 -15.511
    7   HG21  ILE  59          HG22      ILE  59  13.273  -6.668 -14.702
    8   HG23  ILE  59          HG23      ILE  59  12.309  -5.317 -14.113
    9   HD11  ILE  59          HD11      ILE  59  10.410  -4.855 -13.564
   10   HD13  ILE  59          HD12      ILE  59   9.700  -5.674 -12.173
   11   HD12  ILE  59          HD13      ILE  59   8.695  -5.269 -13.566

  No H/Q in entry =          11
  In of MODEL   36
    1    H    GLU  60           H        GLU  60  14.105  -8.491 -15.114
    2    HA   GLU  60           HA       GLU  60  13.301  -8.074 -17.813
    3    HB2  GLU  60           HB2      GLU  60  15.483  -7.337 -17.048
    4    HB3  GLU  60           HB3      GLU  60  15.939  -8.989 -16.637
    5    HG2  GLU  60           HG2      GLU  60  15.110  -8.304 -19.451
    6    HG3  GLU  60           HG3      GLU  60  16.759  -7.998 -18.909

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLY  61           H        GLY  61  14.277 -10.970 -16.020
    2    HA3  GLY  61           HA2      GLY  61  13.701 -12.603 -18.423
    3    HA2  GLY  61           HA3      GLY  61  14.743 -13.097 -17.093

  No H/Q in entry =           3
  In of MODEL   36
    1    H    ASP  62           H        ASP  62  11.640 -11.530 -16.678
    2    HA   ASP  62           HA       ASP  62  10.710 -13.651 -14.980
    3    HB2  ASP  62           HB2      ASP  62   8.714 -12.230 -14.735
    4    HB3  ASP  62           HB3      ASP  62  10.200 -11.324 -14.465

  No H/Q in entry =           4
  In of MODEL   36
    1    H    ALA  63           H        ALA  63  11.130 -14.784 -17.517
    2    HA   ALA  63           HA       ALA  63   8.836 -14.875 -19.188
    3    HB3  ALA  63           HB1      ALA  63  11.092 -16.825 -18.700
    4    HB2  ALA  63           HB2      ALA  63  10.881 -15.729 -20.065
    5    HB1  ALA  63           HB3      ALA  63   9.820 -17.127 -19.885

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLY  64           H        GLY  64   9.842 -16.795 -16.403
    2    HA3  GLY  64           HA2      GLY  64   8.644 -18.101 -14.939
    3    HA2  GLY  64           HA3      GLY  64   7.173 -17.449 -15.648

  No H/Q in entry =           3
  In of MODEL   36
    1    H    GLU  65           H        GLU  65   6.408 -19.714 -15.304
    2    HA   GLU  65           HA       GLU  65   7.539 -21.874 -16.727
    3    HB2  GLU  65           HB2      GLU  65   4.761 -21.450 -15.637
    4    HB3  GLU  65           HB3      GLU  65   5.309 -22.967 -16.349
    5    HG2  GLU  65           HG2      GLU  65   7.101 -23.136 -14.701
    6    HG3  GLU  65           HG3      GLU  65   6.658 -21.573 -14.019

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLY  66           H        GLY  66   4.986 -19.636 -17.528
    2    HA3  GLY  66           HA2      GLY  66   4.722 -20.756 -20.233
    3    HA2  GLY  66           HA3      GLY  66   3.532 -19.752 -19.428

  No H/Q in entry =           3
  In of MODEL   36
    1    H    LYS  67           H        LYS  67   4.000 -19.034 -21.866
    2    HA   LYS  67           HA       LYS  67   6.215 -17.418 -22.430
    3    HB2  LYS  67           HB2      LYS  67   3.446 -17.493 -23.624
    4    HB3  LYS  67           HB3      LYS  67   4.789 -16.566 -24.305
    5    HG2  LYS  67           HG2      LYS  67   6.144 -18.621 -24.451
    6    HG3  LYS  67           HG3      LYS  67   4.816 -19.552 -23.765
    7    HD2  LYS  67           HD2      LYS  67   3.397 -18.952 -25.693
    8    HD3  LYS  67           HD3      LYS  67   4.733 -18.028 -26.384
    9    HE2  LYS  67           HE2      LYS  67   6.113 -20.069 -26.467
   10    HE3  LYS  67           HE3      LYS  67   4.785 -20.998 -25.772
   11    HZ2  LYS  67           HZ1      LYS  67   4.759 -19.568 -28.372
   12    HZ1  LYS  67           HZ2      LYS  67   3.423 -20.360 -27.688
   13    HZ3  LYS  67           HZ3      LYS  67   4.797 -21.248 -28.146

  No H/Q in entry =          13
  In of MODEL   36
    1    H    MET  68           H        MET  68   2.981 -16.083 -22.336
    2    HA   MET  68           HA       MET  68   3.765 -13.438 -21.785
    3    HB2  MET  68           HB2      MET  68   1.080 -14.790 -21.503
    4    HB3  MET  68           HB3      MET  68   1.343 -13.047 -21.461
    5    HG2  MET  68           HG2      MET  68   2.091 -14.859 -23.773
    6    HG3  MET  68           HG3      MET  68   0.670 -13.816 -23.720
    7    HE1  MET  68           HE1      MET  68   0.597 -11.572 -23.297
    8    HE3  MET  68           HE2      MET  68   1.693 -10.364 -23.960
    9    HE2  MET  68           HE3      MET  68   1.939 -10.959 -22.319

  No H/Q in entry =           9
  In of MODEL   36
    1    H    LYS  69           H        LYS  69   2.530 -15.965 -19.574
    2    HA   LYS  69           HA       LYS  69   2.166 -14.268 -17.355
    3    HB2  LYS  69           HB2      LYS  69   1.106 -16.470 -17.571
    4    HB3  LYS  69           HB3      LYS  69   2.678 -17.244 -17.356
    5    HG2  LYS  69           HG2      LYS  69   2.915 -16.231 -15.143
    6    HG3  LYS  69           HG3      LYS  69   1.395 -15.362 -15.356
    7    HD2  LYS  69           HD2      LYS  69   0.190 -17.512 -15.514
    8    HD3  LYS  69           HD3      LYS  69   1.710 -18.377 -15.279
    9    HE2  LYS  69           HE2      LYS  69   1.995 -17.305 -13.082
   10    HE3  LYS  69           HE3      LYS  69   0.490 -16.417 -13.314
   11    HZ2  LYS  69           HZ1      LYS  69   0.876 -19.310 -12.912
   12    HZ1  LYS  69           HZ2      LYS  69  -0.530 -18.720 -13.657
   13    HZ3  LYS  69           HZ3      LYS  69  -0.143 -18.249 -12.070

  No H/Q in entry =          13
  In of MODEL   36
    1    H    VAL  70           H        VAL  70   3.297 -13.984 -15.388
    2    HA   VAL  70           HA       VAL  70   6.220 -14.480 -15.542
    3    HB   VAL  70           HB       VAL  70   6.482 -12.401 -14.226
    4   HG13  VAL  70          HG11      VAL  70   6.251 -10.955 -16.059
    5   HG12  VAL  70          HG12      VAL  70   4.750 -11.715 -16.588
    6   HG11  VAL  70          HG13      VAL  70   6.289 -12.539 -16.834
    7   HG22  VAL  70          HG21      VAL  70   4.531 -12.061 -12.981
    8   HG21  VAL  70          HG22      VAL  70   3.484 -12.508 -14.327
    9   HG23  VAL  70          HG23      VAL  70   4.262 -10.926 -14.305

  No H/Q in entry =           9
  In of MODEL   36
    1    H    SER  71           H        SER  71   7.263 -14.542 -13.372
    2    HA   SER  71           HA       SER  71   6.142 -16.517 -11.694
    3    HB2  SER  71           HB2      SER  71   8.584 -15.986 -11.870
    4    HB3  SER  71           HB3      SER  71   8.284 -14.500 -10.973
    5    HG   SER  71           HG       SER  71   8.543 -17.035 -10.080

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU  72           H        LEU  72   4.787 -16.390 -10.016
    2    HA   LEU  72           HA       LEU  72   3.257 -14.068  -9.546
    3    HB2  LEU  72           HB2      LEU  72   3.543 -16.630  -7.983
    4    HB3  LEU  72           HB3      LEU  72   2.379 -15.369  -7.581
    5    HG   LEU  72           HG       LEU  72   2.525 -16.665 -10.322
    6   HD11  LEU  72          HD11      LEU  72   1.991 -18.281  -8.439
    7   HD13  LEU  72          HD12      LEU  72   0.724 -18.113  -9.652
    8   HD12  LEU  72          HD13      LEU  72   0.569 -17.295  -8.099
    9   HD22  LEU  72          HD21      LEU  72   1.301 -14.675 -10.562
   10   HD21  LEU  72          HD22      LEU  72   0.631 -14.760  -8.942
   11   HD23  LEU  72          HD23      LEU  72   0.032 -15.838 -10.199

  No H/Q in entry =          11
  In of MODEL   36
    1    H    VAL  73           H        VAL  73   5.920 -15.531  -7.805
    2    HA   VAL  73           HA       VAL  73   5.891 -14.010  -5.465
    3    HB   VAL  73           HB       VAL  73   8.033 -14.872  -5.035
    4   HG11  VAL  73          HG11      VAL  73   6.146 -16.555  -5.436
    5   HG13  VAL  73          HG12      VAL  73   7.788 -17.194  -5.512
    6   HG12  VAL  73          HG13      VAL  73   6.898 -16.867  -6.999
    7   HG23  VAL  73          HG21      VAL  73   9.393 -15.857  -6.974
    8   HG22  VAL  73          HG22      VAL  73   9.299 -14.098  -6.899
    9   HG21  VAL  73          HG23      VAL  73   8.295 -14.987  -8.045

  No H/Q in entry =           9
  In of MODEL   36
    1    H    LEU  74           H        LEU  74   6.858 -13.107  -8.645
    2    HA   LEU  74           HA       LEU  74   8.821 -11.174  -8.160
    3    HB2  LEU  74           HB2      LEU  74   8.337 -11.912 -10.398
    4    HB3  LEU  74           HB3      LEU  74   6.679 -11.325 -10.280
    5    HG   LEU  74           HG       LEU  74   7.514  -9.009 -10.061
    6   HD13  LEU  74          HD11      LEU  74   9.636  -9.227  -9.029
    7   HD12  LEU  74          HD12      LEU  74  10.013  -8.744 -10.682
    8   HD11  LEU  74          HD13      LEU  74  10.175 -10.432 -10.198
    9   HD23  LEU  74          HD21      LEU  74   8.954 -10.110 -12.416
   10   HD22  LEU  74          HD22      LEU  74   7.824  -8.780 -12.300
   11   HD21  LEU  74          HD23      LEU  74   7.224 -10.423 -12.286

  No H/Q in entry =          11
  In of MODEL   36
    1    H    VAL  75           H        VAL  75   5.325 -10.763  -8.481
    2    HA   VAL  75           HA       VAL  75   5.253  -8.009  -7.880
    3    HB   VAL  75           HB       VAL  75   3.152 -10.140  -7.485
    4   HG13  VAL  75          HG11      VAL  75   2.689  -8.232  -5.995
    5   HG12  VAL  75          HG12      VAL  75   1.595  -8.174  -7.369
    6   HG11  VAL  75          HG13      VAL  75   2.989  -7.106  -7.316
    7   HG22  VAL  75          HG21      VAL  75   2.275  -9.279  -9.578
    8   HG21  VAL  75          HG22      VAL  75   3.983  -9.643  -9.820
    9   HG23  VAL  75          HG23      VAL  75   3.461  -7.973  -9.592

  No H/Q in entry =           9
  In of MODEL   36
    1    H    GLU  76           H        GLU  76   4.998 -10.895  -5.782
    2    HA   GLU  76           HA       GLU  76   4.557  -9.543  -3.350
    3    HB2  GLU  76           HB2      GLU  76   4.363 -12.008  -3.596
    4    HB3  GLU  76           HB3      GLU  76   6.097 -12.116  -3.848
    5    HG2  GLU  76           HG2      GLU  76   5.669 -12.706  -1.551
    6    HG3  GLU  76           HG3      GLU  76   6.426 -11.124  -1.538

  No H/Q in entry =           6
  In of MODEL   36
    1    H    ALA  77           H        ALA  77   7.598 -10.464  -4.943
    2    HA   ALA  77           HA       ALA  77   9.311  -9.442  -2.937
    3    HB1  ALA  77           HB1      ALA  77  10.364 -10.871  -4.454
    4    HB2  ALA  77           HB2      ALA  77  10.948  -9.285  -4.956
    5    HB3  ALA  77           HB3      ALA  77   9.651 -10.071  -5.854

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLN  78           H        GLN  78   7.905  -8.000  -5.832
    2    HA   GLN  78           HA       GLN  78   9.276  -5.531  -5.726
    3    HB2  GLN  78           HB2      GLN  78   7.957  -6.427  -7.677
    4    HB3  GLN  78           HB3      GLN  78   6.485  -6.042  -6.788
    5    HG2  GLN  78           HG2      GLN  78   7.156  -3.677  -6.691
    6    HG3  GLN  78           HG3      GLN  78   8.635  -4.055  -7.574
    7   HE21  GLN  78          HE21      GLN  78   8.271  -3.116  -9.621
    8   HE22  GLN  78          HE22      GLN  78   6.907  -3.432 -10.581

  No H/Q in entry =           8
  In of MODEL   36
    1    H    LEU  79           H        LEU  79   6.260  -6.654  -4.278
    2    HA   LEU  79           HA       LEU  79   5.292  -4.244  -3.249
    3    HB2  LEU  79           HB2      LEU  79   3.963  -6.286  -3.193
    4    HB3  LEU  79           HB3      LEU  79   5.111  -7.040  -2.090
    5    HG   LEU  79           HG       LEU  79   4.585  -5.402  -0.351
    6   HD13  LEU  79          HD11      LEU  79   4.126  -3.379  -1.388
    7   HD12  LEU  79          HD12      LEU  79   2.500  -3.894  -0.939
    8   HD11  LEU  79          HD13      LEU  79   3.067  -4.113  -2.593
    9   HD23  LEU  79          HD21      LEU  79   1.995  -5.875  -0.244
   10   HD22  LEU  79          HD22      LEU  79   3.125  -7.224  -0.150
   11   HD21  LEU  79          HD23      LEU  79   2.302  -6.873  -1.667

  No H/Q in entry =          11
  In of MODEL   36
    1    H    HIS  80           H        HIS  80   7.469  -6.604  -1.694
    2    HA   HIS  80           HA       HIS  80   7.787  -5.076   0.680
    3    HB2  HIS  80           HB2      HIS  80   9.098  -7.444  -0.541
    4    HB3  HIS  80           HB3      HIS  80  10.024  -6.561   0.674
    5    HD1  HIS  80           HD1      HIS  80   9.546  -7.205   3.017
    6    HD2  HIS  80           HD2      HIS  80   6.304  -8.017   0.525
    7    HE1  HIS  80           HE1      HIS  80   7.777  -8.301   4.473
    8    HE2  HIS  80           HE2      HIS  80   5.794  -8.800   2.962

  No H/Q in entry =           8
  In of MODEL   36
    1    H    LEU  81           H        LEU  81   9.769  -5.354  -2.249
    2    HA   LEU  81           HA       LEU  81  11.833  -3.633  -1.377
    3    HB2  LEU  81           HB2      LEU  81  10.886  -4.405  -4.137
    4    HB3  LEU  81           HB3      LEU  81  12.316  -3.412  -3.852
    5    HG   LEU  81           HG       LEU  81  11.910  -6.136  -2.589
    6   HD12  LEU  81          HD11      LEU  81  13.708  -6.768  -4.355
    7   HD11  LEU  81          HD12      LEU  81  13.148  -5.335  -5.215
    8   HD13  LEU  81          HD13      LEU  81  12.028  -6.652  -4.876
    9   HD23  LEU  81          HD21      LEU  81  14.541  -5.842  -2.592
   10   HD22  LEU  81          HD22      LEU  81  13.574  -5.080  -1.331
   11   HD21  LEU  81          HD23      LEU  81  14.151  -4.126  -2.698

  No H/Q in entry =          11
  In of MODEL   36
    1    H    MET  82           H        MET  82   8.902  -2.963  -3.289
    2    HA   MET  82           HA       MET  82   9.461  -0.239  -3.780
    3    HB2  MET  82           HB2      MET  82   6.889  -1.812  -3.645
    4    HB3  MET  82           HB3      MET  82   6.901  -0.086  -4.000
    5    HG2  MET  82           HG2      MET  82   8.472  -2.165  -5.557
    6    HG3  MET  82           HG3      MET  82   6.907  -1.527  -6.056
    7    HE3  MET  82           HE1      MET  82   7.377   1.930  -7.214
    8    HE2  MET  82           HE2      MET  82   7.013   1.698  -5.505
    9    HE1  MET  82           HE3      MET  82   6.329   0.600  -6.701

  No H/Q in entry =           9
  In of MODEL   36
    1    H    THR  83           H        THR  83   7.674  -1.835  -1.170
    2    HA   THR  83           HA       THR  83   6.853   0.514   0.174
    3    HB   THR  83           HB       THR  83   6.719  -1.069   2.185
    4    HG1  THR  83           HG1      THR  83   7.458  -3.025   1.940
    5   HG22  THR  83          HG21      THR  83   5.042  -2.613   0.721
    6   HG21  THR  83          HG22      THR  83   5.272  -1.281  -0.406
    7   HG23  THR  83          HG23      THR  83   4.646  -0.968   1.213

  No H/Q in entry =           7
  In of MODEL   36
    1    H    SER  84           H        SER  84   9.662  -1.612   0.664
    2    HA   SER  84           HA       SER  84  10.750  -0.202   2.852
    3    HB2  SER  84           HB2      SER  84  11.972  -2.045   0.809
    4    HB3  SER  84           HB3      SER  84  12.934  -1.307   2.087
    5    HG   SER  84           HG       SER  84  10.646  -2.977   2.355

  No H/Q in entry =           5
  In of MODEL   36
    1    H    MET  85           H        MET  85  11.480   0.070  -0.640
    2    HA   MET  85           HA       MET  85  13.498   2.015  -0.394
    3    HB2  MET  85           HB2      MET  85  13.073   0.746  -2.463
    4    HB3  MET  85           HB3      MET  85  11.555   1.618  -2.677
    5    HG2  MET  85           HG2      MET  85  12.768   3.747  -2.815
    6    HG3  MET  85           HG3      MET  85  14.293   2.912  -2.535
    7    HE2  MET  85           HE1      MET  85  11.605   3.088  -6.139
    8    HE1  MET  85           HE2      MET  85  11.191   3.220  -4.432
    9    HE3  MET  85           HE3      MET  85  11.257   1.633  -5.191

  No H/Q in entry =           9
  In of MODEL   36
    1    H    LEU  86           H        LEU  86  10.008   2.385  -0.876
    2    HA   LEU  86           HA       LEU  86   9.970   5.200  -1.044
    3    HB2  LEU  86           HB2      LEU  86   8.106   3.560  -1.615
    4    HB3  LEU  86           HB3      LEU  86   7.787   3.465   0.117
    5    HG   LEU  86           HG       LEU  86   7.650   6.027   0.078
    6   HD11  LEU  86          HD11      LEU  86   8.403   5.598  -2.631
    7   HD13  LEU  86          HD12      LEU  86   7.987   7.125  -1.860
    8   HD12  LEU  86          HD13      LEU  86   6.736   6.178  -2.661
    9   HD23  LEU  86          HD21      LEU  86   5.492   4.703  -1.575
   10   HD22  LEU  86          HD22      LEU  86   5.323   5.959  -0.352
   11   HD21  LEU  86          HD23      LEU  86   5.710   4.308   0.130

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ALA  87           H        ALA  87   9.502   3.012   1.695
    2    HA   ALA  87           HA       ALA  87   8.986   4.921   3.678
    3    HB1  ALA  87           HB1      ALA  87   9.766   2.094   3.572
    4    HB3  ALA  87           HB2      ALA  87   8.656   2.911   4.669
    5    HB2  ALA  87           HB3      ALA  87  10.387   2.924   5.001

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ARG  88           H        ARG  88  12.049   3.472   2.668
    2    HA   ARG  88           HA       ARG  88  13.685   4.825   4.495
    3    HB2  ARG  88           HB2      ARG  88  14.324   2.852   3.077
    4    HB3  ARG  88           HB3      ARG  88  14.477   3.951   1.708
    5    HG2  ARG  88           HG2      ARG  88  15.977   5.240   3.650
    6    HG3  ARG  88           HG3      ARG  88  16.284   3.546   4.019
    7    HD2  ARG  88           HD2      ARG  88  17.534   3.247   2.161
    8    HD3  ARG  88           HD3      ARG  88  16.398   4.134   1.141
    9    HE   ARG  88           HE       ARG  88  18.811   5.169   2.176
   10   HH21  ARG  88          HH11      ARG  88  19.176   7.386   1.989
   11   HH22  ARG  88          HH12      ARG  88  17.835   8.471   1.861
   12   HH11  ARG  88          HH21      ARG  88  15.477   5.956   1.926
   13   HH12  ARG  88          HH22      ARG  88  15.739   7.659   1.801

  No H/Q in entry =          13
  In of MODEL   36
    1    H    GLU  89           H        GLU  89  12.696   5.749   1.183
    2    HA   GLU  89           HA       GLU  89  14.264   8.095   1.027
    3    HB2  GLU  89           HB2      GLU  89  13.096   7.075  -0.917
    4    HB3  GLU  89           HB3      GLU  89  11.561   7.627  -0.245
    5    HG2  GLU  89           HG2      GLU  89  12.285   9.959  -0.401
    6    HG3  GLU  89           HG3      GLU  89  13.880   9.455  -0.952

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LEU  90           H        LEU  90  10.939   7.612   2.179
    2    HA   LEU  90           HA       LEU  90  10.454  10.347   2.772
    3    HB2  LEU  90           HB2      LEU  90   9.243   7.780   3.795
    4    HB3  LEU  90           HB3      LEU  90   8.630   9.379   4.231
    5    HG   LEU  90           HG       LEU  90   9.019   8.510   1.354
    6   HD12  LEU  90          HD11      LEU  90   6.482   8.205   1.434
    7   HD11  LEU  90          HD12      LEU  90   6.650   8.185   3.189
    8   HD13  LEU  90          HD13      LEU  90   7.449   6.952   2.213
    9   HD22  LEU  90          HD21      LEU  90   8.747  10.821   1.294
   10   HD21  LEU  90          HD22      LEU  90   7.771  10.855   2.762
   11   HD23  LEU  90          HD23      LEU  90   7.058  10.315   1.243

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  91           H        ILE  91  11.706   7.644   4.671
    2    HA   ILE  91           HA       ILE  91  11.878   8.995   7.145
    3    HB   ILE  91           HB       ILE  91  13.401   6.648   5.998
    4   HG12  ILE  91          HG12      ILE  91  11.403   6.823   8.274
    5   HG13  ILE  91          HG13      ILE  91  10.917   6.555   6.600
    6   HG22  ILE  91          HG21      ILE  91  13.888   6.416   8.634
    7   HG21  ILE  91          HG22      ILE  91  13.829   8.176   8.542
    8   HG23  ILE  91          HG23      ILE  91  14.991   7.282   7.564
    9   HD13  ILE  91          HD11      ILE  91  11.899   4.444   6.512
   10   HD12  ILE  91          HD12      ILE  91  11.319   4.500   8.176
   11   HD11  ILE  91          HD13      ILE  91  13.021   4.798   7.827

  No H/Q in entry =          11
  In of MODEL   36
    1    H    THR  92           H        THR  92  14.072   8.819   4.376
    2    HA   THR  92           HA       THR  92  16.260  10.185   5.525
    3    HB   THR  92           HB       THR  92  15.251  10.084   2.672
    4    HG1  THR  92           HG1      THR  92  16.067   8.177   3.061
    5   HG22  THR  92          HG21      THR  92  17.825  10.751   2.362
    6   HG21  THR  92          HG22      THR  92  17.536  11.567   3.898
    7   HG23  THR  92          HG23      THR  92  16.559  11.971   2.487

  No H/Q in entry =           7
  In of MODEL   36
    1    H    GLU  93           H        GLU  93  13.371  11.375   3.824
    2    HA   GLU  93           HA       GLU  93  13.993  14.129   3.948
    3    HB2  GLU  93           HB2      GLU  93  11.276  12.782   3.976
    4    HB3  GLU  93           HB3      GLU  93  11.577  14.481   3.610
    5    HG2  GLU  93           HG2      GLU  93  12.882  12.234   2.061
    6    HG3  GLU  93           HG3      GLU  93  11.338  12.934   1.589

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LEU  94           H        LEU  94  12.246  11.978   6.161
    2    HA   LEU  94           HA       LEU  94  11.470  13.923   8.054
    3    HB2  LEU  94           HB2      LEU  94  12.020  10.961   8.308
    4    HB3  LEU  94           HB3      LEU  94  11.468  11.935   9.668
    5    HG   LEU  94           HG       LEU  94   9.964  12.015   7.051
    6   HD11  LEU  94          HD11      LEU  94  10.041   9.783   9.044
    7   HD13  LEU  94          HD12      LEU  94   9.725   9.733   7.311
    8   HD12  LEU  94          HD13      LEU  94   8.460  10.256   8.421
    9   HD23  LEU  94          HD21      LEU  94   8.061  12.425   8.668
   10   HD22  LEU  94          HD22      LEU  94   9.312  13.667   8.702
   11   HD21  LEU  94          HD23      LEU  94   9.247  12.444   9.970

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  95           H        ILE  95  14.423  11.966   7.784
    2    HA   ILE  95           HA       ILE  95  15.618  12.865  10.193
    3    HB   ILE  95           HB       ILE  95  16.827  11.797   7.630
    4   HG12  ILE  95          HG12      ILE  95  16.541  10.585  10.394
    5   HG13  ILE  95          HG13      ILE  95  15.362  10.344   9.107
    6   HG21  ILE  95          HG21      ILE  95  18.111  12.578  10.267
    7   HG23  ILE  95          HG22      ILE  95  18.566  13.110   8.646
    8   HG22  ILE  95          HG23      ILE  95  18.860  11.445   9.144
    9   HD13  ILE  95          HD11      ILE  95  16.820   9.058   7.826
   10   HD12  ILE  95          HD12      ILE  95  17.301   8.596   9.456
   11   HD11  ILE  95          HD13      ILE  95  18.259   9.771   8.555

  No H/Q in entry =          11
  In of MODEL   36
    1    H    GLU  96           H        GLU  96  15.759  14.114   6.864
    2    HA   GLU  96           HA       GLU  96  17.629  16.172   7.337
    3    HB2  GLU  96           HB2      GLU  96  16.941  15.528   5.080
    4    HB3  GLU  96           HB3      GLU  96  15.305  16.099   5.396
    5    HG2  GLU  96           HG2      GLU  96  15.888  18.225   4.860
    6    HG3  GLU  96           HG3      GLU  96  17.196  18.207   6.032

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LEU  97           H        LEU  97  14.120  16.017   7.793
    2    HA   LEU  97           HA       LEU  97  13.735  18.751   8.452
    3    HB2  LEU  97           HB2      LEU  97  12.197  16.237   9.065
    4    HB3  LEU  97           HB3      LEU  97  11.704  17.785   9.748
    5    HG   LEU  97           HG       LEU  97  12.160  17.380   6.778
    6   HD12  LEU  97          HD11      LEU  97   9.635  17.277   6.679
    7   HD11  LEU  97          HD12      LEU  97   9.640  17.068   8.428
    8   HD13  LEU  97          HD13      LEU  97  10.401  15.859   7.394
    9   HD23  LEU  97          HD21      LEU  97  10.441  19.360   6.834
   10   HD22  LEU  97          HD22      LEU  97  12.129  19.702   7.215
   11   HD21  LEU  97          HD23      LEU  97  10.949  19.536   8.513

  No H/Q in entry =          11
  In of MODEL   36
    1    H    HIS  98           H        HIS  98  14.545  15.907  10.427
    2    HA   HIS  98           HA       HIS  98  14.419  17.156  12.950
    3    HB2  HIS  98           HB2      HIS  98  16.139  14.887  11.923
    4    HB3  HIS  98           HB3      HIS  98  16.156  15.417  13.607
    5    HD1  HIS  98           HD1      HIS  98  13.920  13.822  11.024
    6    HD2  HIS  98           HD2      HIS  98  13.855  14.722  15.094
    7    HE1  HIS  98           HE1      HIS  98  11.892  12.642  11.987
    8    HE2  HIS  98           HE2      HIS  98  11.832  13.182  14.461

  No H/Q in entry =           8
  In of MODEL   36
    1    H    GLU  99           H        GLU  99  16.952  17.029  10.494
    2    HA   GLU  99           HA       GLU  99  18.963  18.333  12.014
    3    HB2  GLU  99           HB2      GLU  99  19.413  17.051   9.935
    4    HB3  GLU  99           HB3      GLU  99  18.608  18.319   9.007
    5    HG2  GLU  99           HG2      GLU  99  20.239  19.969   9.793
    6    HG3  GLU  99           HG3      GLU  99  21.014  18.754  10.804

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LYS 100           H        LYS 100  16.433  19.532   9.824
    2    HA   LYS 100           HA       LYS 100  17.259  22.260   9.976
    3    HB2  LYS 100           HB2      LYS 100  14.607  21.001   9.236
    4    HB3  LYS 100           HB3      LYS 100  14.923  22.737   9.152
    5    HG2  LYS 100           HG2      LYS 100  16.879  22.276   7.667
    6    HG3  LYS 100           HG3      LYS 100  16.449  20.564   7.679
    7    HD2  LYS 100           HD2      LYS 100  14.251  21.100   6.699
    8    HD3  LYS 100           HD3      LYS 100  14.664  22.815   6.694
    9    HE2  LYS 100           HE2      LYS 100  16.607  22.323   5.216
   10    HE3  LYS 100           HE3      LYS 100  16.124  20.623   5.178
   11    HZ1  LYS 100           HZ1      LYS 100  14.315  22.838   4.369
   12    HZ3  LYS 100           HZ2      LYS 100  14.111  21.172   4.100
   13    HZ2  LYS 100           HZ3      LYS 100  15.324  22.026   3.273

  No H/Q in entry =          13
  In of MODEL   36
    1    H    LEU 101           H        LEU 101  15.157  20.225  11.947
    2    HA   LEU 101           HA       LEU 101  14.024  22.297  13.546
    3    HB2  LEU 101           HB2      LEU 101  14.439  19.341  13.911
    4    HB3  LEU 101           HB3      LEU 101  13.924  20.319  15.281
    5    HG   LEU 101           HG       LEU 101  12.486  20.436  12.624
    6   HD12  LEU 101          HD11      LEU 101  10.821  18.883  13.898
    7   HD11  LEU 101          HD12      LEU 101  12.219  18.450  14.879
    8   HD13  LEU 101          HD13      LEU 101  12.235  18.152  13.141
    9   HD21  LEU 101          HD21      LEU 101  11.860  21.221  15.485
   10   HD23  LEU 101          HD22      LEU 101  10.587  21.015  14.284
   11   HD22  LEU 101          HD23      LEU 101  11.833  22.238  14.043

  No H/Q in entry =          11
  In of MODEL   36
    1    H    LYS 102           H        LYS 102  17.162  21.659  13.080
    2    HA   LYS 102           HA       LYS 102  19.026  22.505  14.142
    3    HB2  LYS 102           HB2      LYS 102  17.237  24.032  15.298
    4    HB3  LYS 102           HB3      LYS 102  17.444  22.960  16.668
    5    HG2  LYS 102           HG2      LYS 102  19.348  24.958  15.494
    6    HG3  LYS 102           HG3      LYS 102  18.977  24.639  17.174
    7    HD2  LYS 102           HD2      LYS 102  20.610  22.718  15.465
    8    HD3  LYS 102           HD3      LYS 102  21.321  24.028  16.399
    9    HE2  LYS 102           HE2      LYS 102  20.903  21.478  17.357
   10    HE3  LYS 102           HE3      LYS 102  21.145  22.912  18.354
   11    HZ2  LYS 102           HZ1      LYS 102  19.168  21.646  18.982
   12    HZ1  LYS 102           HZ2      LYS 102  18.514  21.891  17.439
   13    HZ3  LYS 102           HZ3      LYS 102  18.767  23.213  18.470

  No H/Q in entry =          13
  In of MODEL   36
    1    H    ALA 103           H        ALA 103  16.957  20.908  16.573
    2    HA   ALA 103           HA       ALA 103  18.685  19.671  18.207
    3    HB2  ALA 103           HB1      ALA 103  17.079  17.680  18.204
    4    HB1  ALA 103           HB2      ALA 103  16.182  18.549  16.958
    5    HB3  ALA 103           HB3      ALA 103  16.381  19.260  18.559

  No H/Q in entry =           5
  In of MODEL   36
    1    H1   ALA   1           H3       ALA   1  -1.848  -6.760 -21.390
    2    H2   ALA   1           H2       ALA   1  -2.655  -8.189 -20.938
    3    H3   ALA   1           H1       ALA   1  -1.052  -8.253 -21.506
    4    HA   ALA   1           HA       ALA   1  -1.907  -8.703 -23.498
    5    HB1  ALA   1           HB1      ALA   1  -4.048  -9.400 -23.011
    6    HB2  ALA   1           HB2      ALA   1  -4.477  -7.880 -23.797
    7    HB3  ALA   1           HB3      ALA   1  -4.403  -7.971 -22.039

  No H/Q in entry =           7
  In of MODEL   36
    1    H    GLU   2           H        GLU   2  -2.740  -7.493 -25.474
    2    HA   GLU   2           HA       GLU   2  -1.326  -5.490 -26.352
    3    HB2  GLU   2           HB2      GLU   2  -4.336  -5.522 -26.646
    4    HB3  GLU   2           HB3      GLU   2  -3.214  -4.665 -27.700
    5    HG2  GLU   2           HG2      GLU   2  -2.741  -6.554 -28.869
    6    HG3  GLU   2           HG3      GLU   2  -2.442  -7.471 -27.398

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLU   3           H        GLU   3  -4.465  -4.203 -25.420
    2    HA   GLU   3           HA       GLU   3  -3.385  -1.662 -24.786
    3    HB2  GLU   3           HB2      GLU   3  -6.085  -2.949 -24.440
    4    HB3  GLU   3           HB3      GLU   3  -5.764  -1.340 -23.787
    5    HG2  GLU   3           HG2      GLU   3  -5.414  -0.406 -25.911
    6    HG3  GLU   3           HG3      GLU   3  -5.042  -1.961 -26.647

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LEU   4           H        LEU   4  -4.984  -4.015 -22.607
    2    HA   LEU   4           HA       LEU   4  -4.588  -2.804 -20.212
    3    HB2  LEU   4           HB2      LEU   4  -4.081  -5.749 -20.702
    4    HB3  LEU   4           HB3      LEU   4  -4.466  -5.006 -19.151
    5    HG   LEU   4           HG       LEU   4  -6.259  -5.047 -21.601
    6   HD13  LEU   4          HD11      LEU   4  -7.463  -6.756 -20.603
    7   HD12  LEU   4          HD12      LEU   4  -6.961  -6.311 -18.973
    8   HD11  LEU   4          HD13      LEU   4  -5.842  -7.161 -20.038
    9   HD23  LEU   4          HD21      LEU   4  -7.920  -4.227 -19.716
   10   HD22  LEU   4          HD22      LEU   4  -6.875  -3.063 -20.528
   11   HD21  LEU   4          HD23      LEU   4  -6.443  -3.667 -18.929

  No H/Q in entry =          11
  In of MODEL   36
    1    H    GLU   5           H        GLU   5  -2.124  -4.665 -21.973
    2    HA   GLU   5           HA       GLU   5  -0.121  -4.414 -19.950
    3    HB2  GLU   5           HB2      GLU   5  -0.095  -6.174 -21.717
    4    HB3  GLU   5           HB3      GLU   5   0.234  -4.925 -22.918
    5    HG2  GLU   5           HG2      GLU   5   2.347  -5.900 -22.296
    6    HG3  GLU   5           HG3      GLU   5   2.280  -4.294 -21.573

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLU   6           H        GLU   6  -0.761  -2.677 -22.980
    2    HA   GLU   6           HA       GLU   6   1.431  -0.871 -22.720
    3    HB2  GLU   6           HB2      GLU   6   0.285  -1.327 -24.874
    4    HB3  GLU   6           HB3      GLU   6  -1.157  -0.523 -24.254
    5    HG2  GLU   6           HG2      GLU   6   0.063   1.095 -25.561
    6    HG3  GLU   6           HG3      GLU   6   0.261   1.529 -23.864

  No H/Q in entry =           6
  In of MODEL   36
    1    H    VAL   7           H        VAL   7  -1.900  -0.911 -21.649
    2    HA   VAL   7           HA       VAL   7  -2.084   1.799 -20.796
    3    HB   VAL   7           HB       VAL   7  -3.568  -0.707 -19.962
    4   HG11  VAL   7          HG11      VAL   7  -3.904   2.181 -19.129
    5   HG13  VAL   7          HG12      VAL   7  -3.812   0.750 -18.102
    6   HG12  VAL   7          HG13      VAL   7  -5.249   1.041 -19.082
    7   HG21  VAL   7          HG21      VAL   7  -3.731   0.384 -22.343
    8   HG23  VAL   7          HG22      VAL   7  -4.657   1.639 -21.517
    9   HG22  VAL   7          HG23      VAL   7  -5.221  -0.032 -21.495

  No H/Q in entry =           9
  In of MODEL   36
    1    H    VAL   8           H        VAL   8  -1.117  -1.206 -19.177
    2    HA   VAL   8           HA       VAL   8  -0.766  -0.145 -16.578
    3    HB   VAL   8           HB       VAL   8   0.478  -2.501 -18.001
    4   HG13  VAL   8          HG11      VAL   8   2.136  -1.832 -16.408
    5   HG12  VAL   8          HG12      VAL   8   1.240  -3.151 -15.654
    6   HG11  VAL   8          HG13      VAL   8   0.917  -1.483 -15.183
    7   HG21  VAL   8          HG21      VAL   8  -1.979  -2.014 -16.508
    8   HG23  VAL   8          HG22      VAL   8  -1.006  -3.238 -15.698
    9   HG22  VAL   8          HG23      VAL   8  -1.490  -3.470 -17.374

  No H/Q in entry =           9
  In of MODEL   36
    1    H    MET   9           H        MET   9   1.457  -0.455 -19.345
    2    HA   MET   9           HA       MET   9   3.765   0.554 -18.096
    3    HB2  MET   9           HB2      MET   9   2.795   0.612 -20.953
    4    HB3  MET   9           HB3      MET   9   4.324   1.352 -20.482
    5    HG2  MET   9           HG2      MET   9   5.102  -0.789 -19.563
    6    HG3  MET   9           HG3      MET   9   3.558  -1.540 -19.978
    7    HE1  MET   9           HE1      MET   9   6.533   0.318 -20.943
    8    HE3  MET   9           HE2      MET   9   5.818   1.048 -22.377
    9    HE2  MET   9           HE3      MET   9   7.022  -0.224 -22.552

  No H/Q in entry =           9
  In of MODEL   36
    1    H    GLY  10           H        GLY  10   1.086   2.197 -19.743
    2    HA3  GLY  10           HA2      GLY  10   2.083   4.837 -19.492
    3    HA2  GLY  10           HA3      GLY  10   0.387   4.399 -19.685

  No H/Q in entry =           3
  In of MODEL   36
    1    H    LEU  11           H        LEU  11  -0.012   2.863 -17.405
    2    HA   LEU  11           HA       LEU  11  -0.502   4.835 -15.430
    3    HB2  LEU  11           HB2      LEU  11  -0.470   1.818 -15.291
    4    HB3  LEU  11           HB3      LEU  11  -0.956   2.840 -13.939
    5    HG   LEU  11           HG       LEU  11  -2.216   2.984 -16.691
    6   HD13  LEU  11          HD11      LEU  11  -2.820   0.844 -15.943
    7   HD12  LEU  11          HD12      LEU  11  -4.153   1.849 -15.381
    8   HD11  LEU  11          HD13      LEU  11  -2.894   1.347 -14.254
    9   HD22  LEU  11          HD21      LEU  11  -2.774   5.001 -15.668
   10   HD21  LEU  11          HD22      LEU  11  -2.693   4.325 -14.042
   11   HD23  LEU  11          HD23      LEU  11  -4.082   3.982 -15.074

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  12           H        ILE  12   2.008   2.340 -15.707
    2    HA   ILE  12           HA       ILE  12   3.241   2.848 -13.211
    3    HB   ILE  12           HB       ILE  12   4.415   1.781 -15.799
    4   HG12  ILE  12          HG12      ILE  12   2.473   0.552 -14.588
    5   HG13  ILE  12          HG13      ILE  12   3.887  -0.388 -15.020
    6   HG22  ILE  12          HG21      ILE  12   6.154   0.778 -14.241
    7   HG21  ILE  12          HG22      ILE  12   5.534   1.841 -12.979
    8   HG23  ILE  12          HG23      ILE  12   6.251   2.527 -14.436
    9   HD13  ILE  12          HD11      ILE  12   4.711  -0.207 -12.727
   10   HD12  ILE  12          HD12      ILE  12   3.071  -0.852 -12.722
   11   HD11  ILE  12          HD13      ILE  12   3.356   0.823 -12.303

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  13           H        ILE  13   3.830   4.122 -16.466
    2    HA   ILE  13           HA       ILE  13   5.995   5.812 -15.750
    3    HB   ILE  13           HB       ILE  13   3.946   5.930 -17.976
    4   HG12  ILE  13          HG12      ILE  13   5.764   4.067 -17.724
    5   HG13  ILE  13          HG13      ILE  13   5.512   4.817 -19.295
    6   HG22  ILE  13          HG21      ILE  13   5.775   7.472 -19.036
    7   HG21  ILE  13          HG22      ILE  13   6.263   7.769 -17.373
    8   HG23  ILE  13          HG23      ILE  13   4.630   8.178 -17.895
    9   HD11  ILE  13          HD11      ILE  13   7.623   5.783 -17.335
   10   HD13  ILE  13          HD12      ILE  13   7.442   6.218 -19.031
   11   HD12  ILE  13          HD13      ILE  13   7.939   4.589 -18.591

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ASN  14           H        ASN  14   2.492   6.351 -15.984
    2    HA   ASN  14           HA       ASN  14   2.490   9.094 -15.332
    3    HB2  ASN  14           HB2      ASN  14   0.569   7.481 -16.155
    4    HB3  ASN  14           HB3      ASN  14   0.260   7.296 -14.433
    5   HD21  ASN  14          HD21      ASN  14  -1.757   8.485 -15.841
    6   HD22  ASN  14          HD22      ASN  14  -1.796  10.158 -15.564

  No H/Q in entry =           6
  In of MODEL   36
    1    H    SER  15           H        SER  15   2.177   6.209 -13.269
    2    HA   SER  15           HA       SER  15   1.908   7.569 -10.810
    3    HB2  SER  15           HB2      SER  15   2.441   5.471  -9.777
    4    HB3  SER  15           HB3      SER  15   1.593   5.071 -11.267
    5    HG   SER  15           HG       SER  15   3.332   3.881 -11.524

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLY  16           H        GLY  16   4.755   6.448 -12.600
    2    HA3  GLY  16           HA2      GLY  16   6.706   7.170 -10.682
    3    HA2  GLY  16           HA3      GLY  16   6.991   6.973 -12.409

  No H/Q in entry =           3
  In of MODEL   36
    1    H    GLN  17           H        GLN  17   5.316   8.957 -13.447
    2    HA   GLN  17           HA       GLN  17   6.924  11.278 -13.139
    3    HB2  GLN  17           HB2      GLN  17   5.560  10.803 -15.167
    4    HB3  GLN  17           HB3      GLN  17   4.097  11.085 -14.224
    5    HG2  GLN  17           HG2      GLN  17   4.643  13.121 -15.428
    6    HG3  GLN  17           HG3      GLN  17   4.929  13.387 -13.709
    7   HE21  GLN  17          HE21      GLN  17   6.635  14.939 -13.902
    8   HE22  GLN  17          HE22      GLN  17   8.132  14.573 -14.615

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ALA  18           H        ALA  18   3.823  10.289 -11.769
    2    HA   ALA  18           HA       ALA  18   3.137  12.678 -10.484
    3    HB1  ALA  18           HB1      ALA  18   1.978  10.236 -10.710
    4    HB2  ALA  18           HB2      ALA  18   1.453  11.455  -9.551
    5    HB3  ALA  18           HB3      ALA  18   2.533  10.158  -9.038

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ARG  19           H        ARG  19   4.990   9.887  -9.236
    2    HA   ARG  19           HA       ARG  19   5.557  11.025  -6.713
    3    HB2  ARG  19           HB2      ARG  19   5.940   8.620  -7.256
    4    HB3  ARG  19           HB3      ARG  19   7.293   9.097  -8.287
    5    HG2  ARG  19           HG2      ARG  19   8.440  10.114  -6.368
    6    HG3  ARG  19           HG3      ARG  19   7.069   9.735  -5.327
    7    HD2  ARG  19           HD2      ARG  19   8.816   8.079  -4.993
    8    HD3  ARG  19           HD3      ARG  19   7.427   7.316  -5.772
    9    HE   ARG  19           HE       ARG  19   9.122   8.128  -7.829
   10   HH21  ARG  19          HH11      ARG  19  10.660   6.711  -8.701
   11   HH22  ARG  19          HH12      ARG  19  11.199   5.352  -7.777
   12   HH11  ARG  19          HH21      ARG  19   9.196   6.081  -5.063
   13   HH12  ARG  19          HH22      ARG  19  10.367   4.995  -5.716

  No H/Q in entry =          13
  In of MODEL   36
    1    H    SER  20           H        SER  20   7.349  11.052  -9.777
    2    HA   SER  20           HA       SER  20   9.615  12.439  -8.964
    3    HB2  SER  20           HB2      SER  20   9.621  11.577 -11.173
    4    HB3  SER  20           HB3      SER  20   8.124  12.408 -11.583
    5    HG   SER  20           HG       SER  20   9.443  14.381 -11.068

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU  21           H        LEU  21   6.520  13.747 -10.128
    2    HA   LEU  21           HA       LEU  21   7.220  16.484  -9.894
    3    HB2  LEU  21           HB2      LEU  21   4.539  15.086  -9.802
    4    HB3  LEU  21           HB3      LEU  21   4.721  16.837  -9.792
    5    HG   LEU  21           HG       LEU  21   5.890  15.055 -11.949
    6   HD11  LEU  21          HD11      LEU  21   3.216  16.442 -11.736
    7   HD13  LEU  21          HD12      LEU  21   3.553  14.768 -12.178
    8   HD12  LEU  21          HD13      LEU  21   3.939  16.071 -13.301
    9   HD23  LEU  21          HD21      LEU  21   5.653  17.397 -13.160
   10   HD22  LEU  21          HD22      LEU  21   7.034  17.117 -12.105
   11   HD21  LEU  21          HD23      LEU  21   5.659  18.040 -11.520

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ALA  22           H        ALA  22   5.704  14.197  -7.645
    2    HA   ALA  22           HA       ALA  22   5.137  15.999  -5.563
    3    HB3  ALA  22           HB1      ALA  22   4.351  13.616  -5.733
    4    HB2  ALA  22           HB2      ALA  22   4.958  14.073  -4.141
    5    HB1  ALA  22           HB3      ALA  22   5.962  13.111  -5.226

  No H/Q in entry =           5
  In of MODEL   36
    1    H    TYR  23           H        TYR  23   8.047  13.948  -6.038
    2    HA   TYR  23           HA       TYR  23   9.459  14.942  -3.792
    3    HB2  TYR  23           HB2      TYR  23  10.218  12.933  -4.968
    4    HB3  TYR  23           HB3      TYR  23  10.526  13.876  -6.425
    5    HD1  TYR  23           HD1      TYR  23  11.520  13.512  -2.844
    6    HD2  TYR  23           HD2      TYR  23  12.570  15.031  -6.724
    7    HE1  TYR  23           HE1      TYR  23  13.791  14.064  -2.014
    8    HE2  TYR  23           HE2      TYR  23  14.839  15.585  -5.893
    9    HH   TYR  23           HH       TYR  23  15.814  14.806  -2.553

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ALA  24           H        ALA  24   9.258  16.069  -7.151
    2    HA   ALA  24           HA       ALA  24  11.174  18.136  -6.909
    3    HB2  ALA  24           HB1      ALA  24  10.713  18.214  -9.114
    4    HB3  ALA  24           HB2      ALA  24   9.168  18.976  -8.737
    5    HB1  ALA  24           HB3      ALA  24   9.277  17.222  -8.878

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA  25           H        ALA  25   7.699  17.978  -6.259
    2    HA   ALA  25           HA       ALA  25   7.248  20.697  -5.671
    3    HB1  ALA  25           HB1      ALA  25   5.568  18.714  -5.869
    4    HB2  ALA  25           HB2      ALA  25   5.221  19.999  -4.710
    5    HB3  ALA  25           HB3      ALA  25   5.902  18.469  -4.153

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU  26           H        LEU  26   8.311  17.997  -3.645
    2    HA   LEU  26           HA       LEU  26   8.449  19.414  -1.201
    3    HB2  LEU  26           HB2      LEU  26   8.524  16.997  -1.210
    4    HB3  LEU  26           HB3      LEU  26   9.986  16.998  -2.193
    5    HG   LEU  26           HG       LEU  26  11.226  18.096  -0.358
    6   HD12  LEU  26          HD11      LEU  26  10.019  18.101   1.913
    7   HD11  LEU  26          HD12      LEU  26   8.523  17.980   0.990
    8   HD13  LEU  26          HD13      LEU  26   9.577  19.379   0.780
    9   HD21  LEU  26          HD21      LEU  26   9.680  15.636   0.516
   10   HD23  LEU  26          HD22      LEU  26  11.206  16.182   1.203
   11   HD22  LEU  26          HD23      LEU  26  11.142  15.633  -0.470

  No H/Q in entry =          11
  In of MODEL   36
    1    H    LYS  27           H        LYS  27  10.839  18.836  -3.750
    2    HA   LYS  27           HA       LYS  27  13.043  20.053  -2.534
    3    HB2  LYS  27           HB2      LYS  27  13.116  18.717  -4.632
    4    HB3  LYS  27           HB3      LYS  27  12.354  20.059  -5.484
    5    HG2  LYS  27           HG2      LYS  27  14.236  21.527  -4.914
    6    HG3  LYS  27           HG3      LYS  27  14.994  20.224  -3.992
    7    HD2  LYS  27           HD2      LYS  27  15.109  18.847  -6.054
    8    HD3  LYS  27           HD3      LYS  27  14.396  20.175  -6.969
    9    HE2  LYS  27           HE2      LYS  27  16.300  21.624  -6.365
   10    HE3  LYS  27           HE3      LYS  27  17.017  20.300  -5.441
   11    HZ3  LYS  27           HZ1      LYS  27  17.989  20.404  -7.635
   12    HZ2  LYS  27           HZ2      LYS  27  16.455  20.301  -8.363
   13    HZ1  LYS  27           HZ3      LYS  27  17.076  18.981  -7.492

  No H/Q in entry =          13
  In of MODEL   36
    1    H    GLN  28           H        GLN  28  10.414  21.465  -4.453
    2    HA   GLN  28           HA       GLN  28  11.392  24.111  -4.600
    3    HB2  GLN  28           HB2      GLN  28   8.553  23.058  -4.471
    4    HB3  GLN  28           HB3      GLN  28   8.972  24.732  -4.836
    5    HG2  GLN  28           HG2      GLN  28   9.946  22.327  -6.407
    6    HG3  GLN  28           HG3      GLN  28   8.607  23.368  -6.893
    7   HE21  GLN  28          HE21      GLN  28  11.763  22.877  -7.616
    8   HE22  GLN  28          HE22      GLN  28  12.236  24.462  -7.996

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ALA  29           H        ALA  29   9.469  22.420  -2.156
    2    HA   ALA  29           HA       ALA  29   8.950  24.607  -0.458
    3    HB2  ALA  29           HB1      ALA  29   8.224  23.035   1.108
    4    HB1  ALA  29           HB2      ALA  29   9.433  21.845   0.626
    5    HB3  ALA  29           HB3      ALA  29   8.039  22.154  -0.408

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LYS  30           H        LYS  30  11.664  22.321  -0.563
    2    HA   LYS  30           HA       LYS  30  13.008  23.253   1.733
    3    HB2  LYS  30           HB2      LYS  30  14.074  21.973  -0.794
    4    HB3  LYS  30           HB3      LYS  30  15.071  22.318   0.621
    5    HG2  LYS  30           HG2      LYS  30  13.520  20.938   2.007
    6    HG3  LYS  30           HG3      LYS  30  12.620  20.531   0.543
    7    HD2  LYS  30           HD2      LYS  30  14.649  19.535  -0.442
    8    HD3  LYS  30           HD3      LYS  30  15.569  19.957   1.005
    9    HE2  LYS  30           HE2      LYS  30  14.066  18.529   2.365
   10    HE3  LYS  30           HE3      LYS  30  13.176  18.087   0.902
   11    HZ2  LYS  30           HZ1      LYS  30  14.963  16.492   1.639
   12    HZ1  LYS  30           HZ2      LYS  30  16.104  17.674   1.184
   13    HZ3  LYS  30           HZ3      LYS  30  15.054  17.004   0.024

  No H/Q in entry =          13
  In of MODEL   36
    1    H    GLN  31           H        GLN  31  12.879  24.476  -1.556
    2    HA   GLN  31           HA       GLN  31  15.048  26.352  -1.144
    3    HB2  GLN  31           HB2      GLN  31  12.986  26.425  -3.350
    4    HB3  GLN  31           HB3      GLN  31  14.611  27.110  -3.361
    5    HG2  GLN  31           HG2      GLN  31  15.059  24.408  -2.804
    6    HG3  GLN  31           HG3      GLN  31  13.745  24.369  -3.972
    7   HE21  GLN  31          HE21      GLN  31  16.579  23.558  -4.405
    8   HE22  GLN  31          HE22      GLN  31  17.147  24.534  -5.671

  No H/Q in entry =           8
  In of MODEL   36
    1    H    GLY  32           H        GLY  32  11.983  26.185   0.028
    2    HA3  GLY  32           HA2      GLY  32  10.848  27.754   1.319
    3    HA2  GLY  32           HA3      GLY  32  11.977  28.985   0.766

  No H/Q in entry =           3
  In of MODEL   36
    1    H    ASP  33           H        ASP  33  10.578  27.103  -1.724
    2    HA   ASP  33           HA       ASP  33   8.922  29.392  -2.553
    3    HB2  ASP  33           HB2      ASP  33   9.986  26.973  -4.018
    4    HB3  ASP  33           HB3      ASP  33   8.836  28.100  -4.732

  No H/Q in entry =           4
  In of MODEL   36
    1    H    PHE  34           H        PHE  34   7.244  28.920  -0.977
    2    HA   PHE  34           HA       PHE  34   5.849  26.456  -0.882
    3    HB2  PHE  34           HB2      PHE  34   4.913  29.246  -0.179
    4    HB3  PHE  34           HB3      PHE  34   4.057  27.759   0.232
    5    HD1  PHE  34           HD1      PHE  34   6.334  30.136   1.439
    6    HD2  PHE  34           HD2      PHE  34   5.625  25.900   1.369
    7    HE1  PHE  34           HE1      PHE  34   7.741  29.865   3.462
    8    HE2  PHE  34           HE2      PHE  34   7.034  25.633   3.390
    9    HZ   PHE  34           HZ       PHE  34   8.086  27.617   4.436

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ALA  35           H        ALA  35   5.420  29.334  -2.874
    2    HA   ALA  35           HA       ALA  35   2.856  28.742  -3.880
    3    HB1  ALA  35           HB1      ALA  35   3.899  30.138  -5.919
    4    HB3  ALA  35           HB2      ALA  35   5.130  30.485  -4.704
    5    HB2  ALA  35           HB3      ALA  35   3.445  30.903  -4.396

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA  36           H        ALA  36   6.067  28.054  -5.266
    2    HA   ALA  36           HA       ALA  36   5.049  26.644  -7.508
    3    HB3  ALA  36           HB1      ALA  36   7.203  26.757  -8.142
    4    HB2  ALA  36           HB2      ALA  36   7.690  25.718  -6.802
    5    HB1  ALA  36           HB3      ALA  36   7.598  27.465  -6.576

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA  37           H        ALA  37   6.027  25.626  -4.267
    2    HA   ALA  37           HA       ALA  37   5.946  22.840  -4.711
    3    HB2  ALA  37           HB1      ALA  37   5.718  24.620  -2.321
    4    HB1  ALA  37           HB2      ALA  37   6.840  23.297  -2.630
    5    HB3  ALA  37           HB3      ALA  37   5.180  22.951  -2.146

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LYS  38           H        LYS  38   3.438  25.059  -3.508
    2    HA   LYS  38           HA       LYS  38   1.329  23.259  -3.277
    3    HB2  LYS  38           HB2      LYS  38   1.701  26.011  -3.014
    4    HB3  LYS  38           HB3      LYS  38   0.490  25.879  -4.283
    5    HG2  LYS  38           HG2      LYS  38  -0.956  24.557  -2.835
    6    HG3  LYS  38           HG3      LYS  38   0.299  24.482  -1.590
    7    HD2  LYS  38           HD2      LYS  38   0.132  26.817  -1.129
    8    HD3  LYS  38           HD3      LYS  38  -0.790  27.120  -2.601
    9    HE2  LYS  38           HE2      LYS  38  -2.276  27.154  -0.648
   10    HE3  LYS  38           HE3      LYS  38  -2.669  25.786  -1.694
   11    HZ3  LYS  38           HZ1      LYS  38  -1.940  24.302  -0.176
   12    HZ2  LYS  38           HZ2      LYS  38  -2.272  25.555   0.924
   13    HZ1  LYS  38           HZ3      LYS  38  -0.684  25.297   0.383

  No H/Q in entry =          13
  In of MODEL   36
    1    H    ALA  39           H        ALA  39   2.296  25.170  -6.124
    2    HA   ALA  39           HA       ALA  39   0.200  24.325  -7.813
    3    HB2  ALA  39           HB1      ALA  39   2.931  24.961  -8.887
    4    HB1  ALA  39           HB2      ALA  39   1.979  26.224  -8.107
    5    HB3  ALA  39           HB3      ALA  39   1.349  25.399  -9.532

  No H/Q in entry =           5
  In of MODEL   36
    1    H    MET  40           H        MET  40   3.434  23.002  -7.269
    2    HA   MET  40           HA       MET  40   3.305  20.993  -9.270
    3    HB2  MET  40           HB2      MET  40   4.941  21.193  -6.735
    4    HB3  MET  40           HB3      MET  40   5.172  19.942  -7.958
    5    HG2  MET  40           HG2      MET  40   5.243  22.901  -8.608
    6    HG3  MET  40           HG3      MET  40   6.688  21.987  -8.177
    7    HE3  MET  40           HE1      MET  40   7.521  19.781 -11.005
    8    HE2  MET  40           HE2      MET  40   6.970  19.456  -9.364
    9    HE1  MET  40           HE3      MET  40   8.071  20.798  -9.666

  No H/Q in entry =           9
  In of MODEL   36
    1    H    MET  41           H        MET  41   2.421  21.023  -5.838
    2    HA   MET  41           HA       MET  41   1.873  18.260  -5.570
    3    HB2  MET  41           HB2      MET  41   0.568  20.619  -4.195
    4    HB3  MET  41           HB3      MET  41   0.406  18.940  -3.695
    5    HG2  MET  41           HG2      MET  41   3.117  19.146  -3.755
    6    HG3  MET  41           HG3      MET  41   2.691  20.805  -3.346
    7    HE2  MET  41           HE1      MET  41  -0.342  19.562  -1.601
    8    HE1  MET  41           HE2      MET  41   0.481  21.072  -1.977
    9    HE3  MET  41           HE3      MET  41   0.433  20.492  -0.312

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ASP  42           H        ASP  42  -0.156  21.003  -6.512
    2    HA   ASP  42           HA       ASP  42  -2.607  19.658  -6.634
    3    HB2  ASP  42           HB2      ASP  42  -1.886  22.225  -6.883
    4    HB3  ASP  42           HB3      ASP  42  -2.055  21.841  -8.592

  No H/Q in entry =           4
  In of MODEL   36
    1    H    GLN  43           H        GLN  43  -0.185  20.248  -9.154
    2    HA   GLN  43           HA       GLN  43  -1.598  18.948 -11.238
    3    HB2  GLN  43           HB2      GLN  43   1.367  19.444 -10.880
    4    HB3  GLN  43           HB3      GLN  43   0.636  18.816 -12.360
    5    HG2  GLN  43           HG2      GLN  43  -0.864  20.853 -12.377
    6    HG3  GLN  43           HG3      GLN  43   0.105  21.496 -11.054
    7   HE21  GLN  43          HE21      GLN  43   0.258  23.127 -13.133
    8   HE22  GLN  43          HE22      GLN  43   1.663  22.902 -14.054

  No H/Q in entry =           8
  In of MODEL   36
    1    H    SER  44           H        SER  44   0.767  17.781  -8.875
    2    HA   SER  44           HA       SER  44   1.077  15.178  -9.917
    3    HB2  SER  44           HB2      SER  44   2.000  16.599  -7.681
    4    HB3  SER  44           HB3      SER  44   1.135  15.217  -7.010
    5    HG   SER  44           HG       SER  44   3.239  14.587  -7.458

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ARG  45           H        ARG  45  -1.214  16.497  -7.551
    2    HA   ARG  45           HA       ARG  45  -2.609  14.141  -6.917
    3    HB2  ARG  45           HB2      ARG  45  -2.784  16.304  -5.712
    4    HB3  ARG  45           HB3      ARG  45  -3.649  16.983  -7.087
    5    HG2  ARG  45           HG2      ARG  45  -5.422  15.266  -6.798
    6    HG3  ARG  45           HG3      ARG  45  -4.569  14.641  -5.385
    7    HD2  ARG  45           HD2      ARG  45  -4.753  16.903  -4.316
    8    HD3  ARG  45           HD3      ARG  45  -5.749  17.436  -5.686
    9    HE   ARG  45           HE       ARG  45  -6.863  15.061  -4.649
   10   HH21  ARG  45          HH11      ARG  45  -8.688  15.140  -3.362
   11   HH22  ARG  45          HH12      ARG  45  -9.067  16.577  -2.482
   12   HH11  ARG  45          HH21      ARG  45  -6.290  18.299  -3.613
   13   HH12  ARG  45          HH22      ARG  45  -7.704  18.366  -2.622

  No H/Q in entry =          13
  In of MODEL   36
    1    H    MET  46           H        MET  46  -3.202  16.562  -9.449
    2    HA   MET  46           HA       MET  46  -5.557  15.408 -10.497
    3    HB2  MET  46           HB2      MET  46  -3.455  17.226 -11.684
    4    HB3  MET  46           HB3      MET  46  -4.855  16.687 -12.617
    5    HG2  MET  46           HG2      MET  46  -6.363  17.609 -10.908
    6    HG3  MET  46           HG3      MET  46  -4.981  18.127  -9.950
    7    HE2  MET  46           HE1      MET  46  -5.301  21.170 -10.191
    8    HE1  MET  46           HE2      MET  46  -6.587  19.987  -9.966
    9    HE3  MET  46           HE3      MET  46  -6.754  21.237 -11.198

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ALA  47           H        ALA  47  -2.138  14.915 -11.287
    2    HA   ALA  47           HA       ALA  47  -2.511  13.201 -13.503
    3    HB3  ALA  47           HB1      ALA  47  -0.326  14.077 -13.166
    4    HB2  ALA  47           HB2      ALA  47  -0.191  12.346 -12.843
    5    HB1  ALA  47           HB3      ALA  47  -0.266  13.492 -11.503

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU  48           H        LEU  48  -2.215  12.545 -10.036
    2    HA   LEU  48           HA       LEU  48  -2.325   9.707 -10.208
    3    HB2  LEU  48           HB2      LEU  48  -3.060  11.617  -7.978
    4    HB3  LEU  48           HB3      LEU  48  -2.974   9.865  -7.787
    5    HG   LEU  48           HG       LEU  48  -0.675  11.558  -8.795
    6   HD13  LEU  48          HD11      LEU  48  -0.934  12.318  -6.598
    7   HD12  LEU  48          HD12      LEU  48   0.224  11.003  -6.417
    8   HD11  LEU  48          HD13      LEU  48  -1.472  10.747  -6.006
    9   HD22  LEU  48          HD21      LEU  48  -0.193   9.373  -9.452
   10   HD21  LEU  48          HD22      LEU  48  -1.054   8.655  -8.092
   11   HD23  LEU  48          HD23      LEU  48   0.524   9.399  -7.842

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ASN  49           H        ASN  49  -4.772  12.210  -9.772
    2    HA   ASN  49           HA       ASN  49  -6.962  10.553  -9.222
    3    HB2  ASN  49           HB2      ASN  49  -7.009  12.971  -8.882
    4    HB3  ASN  49           HB3      ASN  49  -6.851  13.246 -10.613
    5   HD21  ASN  49          HD21      ASN  49  -9.047  14.327  -9.253
    6   HD22  ASN  49          HD22      ASN  49 -10.458  13.505  -9.711

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLU  50           H        GLU  50  -5.703  11.760 -12.314
    2    HA   GLU  50           HA       GLU  50  -7.678  10.523 -13.950
    3    HB2  GLU  50           HB2      GLU  50  -6.209  12.339 -14.767
    4    HB3  GLU  50           HB3      GLU  50  -4.820  11.259 -14.646
    5    HG2  GLU  50           HG2      GLU  50  -5.815   9.737 -16.283
    6    HG3  GLU  50           HG3      GLU  50  -7.272  10.724 -16.353

  No H/Q in entry =           6
  In of MODEL   36
    1    H    ALA  51           H        ALA  51  -4.502   9.508 -12.777
    2    HA   ALA  51           HA       ALA  51  -4.387   7.062 -14.209
    3    HB2  ALA  51           HB1      ALA  51  -2.399   6.758 -13.127
    4    HB1  ALA  51           HB2      ALA  51  -3.071   7.176 -11.552
    5    HB3  ALA  51           HB3      ALA  51  -2.618   8.450 -12.683

  No H/Q in entry =           5
  In of MODEL   36
    1    H    HIS  52           H        HIS  52  -5.528   7.883 -10.945
    2    HA   HIS  52           HA       HIS  52  -6.220   5.272 -10.122
    3    HB2  HIS  52           HB2      HIS  52  -6.062   7.178  -8.575
    4    HB3  HIS  52           HB3      HIS  52  -7.470   7.916  -9.338
    5    HD1  HIS  52           HD1      HIS  52  -9.652   6.140  -9.387
    6    HD2  HIS  52           HD2      HIS  52  -6.778   5.632  -6.412
    7    HE1  HIS  52           HE1      HIS  52 -10.744   4.763  -7.563
    8    HE2  HIS  52           HE2      HIS  52  -9.004   4.445  -5.741

  No H/Q in entry =           8
  In of MODEL   36
    1    H    LEU  53           H        LEU  53  -8.042   7.749 -11.881
    2    HA   LEU  53           HA       LEU  53 -10.555   6.471 -11.880
    3    HB2  LEU  53           HB2      LEU  53  -9.275   8.457 -13.747
    4    HB3  LEU  53           HB3      LEU  53 -10.878   7.800 -14.064
    5    HG   LEU  53           HG       LEU  53 -10.144   9.095 -11.420
    6   HD11  LEU  53          HD11      LEU  53 -11.445  10.343 -13.860
    7   HD13  LEU  53          HD12      LEU  53  -9.852  10.743 -13.217
    8   HD12  LEU  53          HD13      LEU  53 -11.299  11.112 -12.285
    9   HD21  LEU  53          HD21      LEU  53 -12.719   8.244 -12.758
   10   HD23  LEU  53          HD22      LEU  53 -12.716   9.495 -11.520
   11   HD22  LEU  53          HD23      LEU  53 -12.172   7.875 -11.127

  No H/Q in entry =          11
  In of MODEL   36
    1    H    VAL  54           H        VAL  54  -7.824   6.270 -14.141
    2    HA   VAL  54           HA       VAL  54  -9.072   4.516 -15.983
    3    HB   VAL  54           HB       VAL  54  -6.156   5.002 -15.322
    4   HG12  VAL  54          HG11      VAL  54  -5.935   3.929 -17.719
    5   HG11  VAL  54          HG12      VAL  54  -7.465   3.155 -17.307
    6   HG13  VAL  54          HG13      VAL  54  -6.042   2.886 -16.301
    7   HG22  VAL  54          HG21      VAL  54  -6.923   6.956 -16.350
    8   HG21  VAL  54          HG22      VAL  54  -8.129   6.104 -17.313
    9   HG23  VAL  54          HG23      VAL  54  -6.427   6.017 -17.758

  No H/Q in entry =           9
  In of MODEL   36
    1    H    GLN  55           H        GLN  55  -7.053   3.943 -13.103
    2    HA   GLN  55           HA       GLN  55  -6.982   1.127 -13.375
    3    HB2  GLN  55           HB2      GLN  55  -5.408   2.006 -11.864
    4    HB3  GLN  55           HB3      GLN  55  -6.612   2.975 -11.019
    5    HG2  GLN  55           HG2      GLN  55  -7.300   1.215  -9.705
    6    HG3  GLN  55           HG3      GLN  55  -7.093   0.033 -10.992
    7   HE21  GLN  55          HE21      GLN  55  -5.474  -1.429 -10.518
    8   HE22  GLN  55          HE22      GLN  55  -4.080  -1.090  -9.616

  No H/Q in entry =           8
  In of MODEL   36
    1    H    THR  56           H        THR  56  -9.286   3.295 -11.730
    2    HA   THR  56           HA       THR  56 -10.871   1.415 -10.437
    3    HB   THR  56           HB       THR  56 -11.960   3.820 -11.922
    4    HG1  THR  56           HG1      THR  56 -10.059   4.129 -10.481
    5   HG23  THR  56          HG21      THR  56 -13.800   2.711 -11.050
    6   HG22  THR  56          HG22      THR  56 -13.370   3.745  -9.687
    7   HG21  THR  56          HG23      THR  56 -12.889   2.048  -9.695

  No H/Q in entry =           7
  In of MODEL   36
    1    H    LYS  57           H        LYS  57 -11.094   2.517 -13.816
    2    HA   LYS  57           HA       LYS  57 -13.267   0.847 -14.560
    3    HB2  LYS  57           HB2      LYS  57 -12.386   2.800 -15.873
    4    HB3  LYS  57           HB3      LYS  57 -10.960   1.850 -16.261
    5    HG2  LYS  57           HG2      LYS  57 -12.325   0.203 -17.434
    6    HG3  LYS  57           HG3      LYS  57 -13.795   1.056 -16.980
    7    HD2  LYS  57           HD2      LYS  57 -13.031   3.039 -18.261
    8    HD3  LYS  57           HD3      LYS  57 -11.582   2.160 -18.744
    9    HE2  LYS  57           HE2      LYS  57 -14.408   1.216 -19.338
   10    HE3  LYS  57           HE3      LYS  57 -13.418   2.111 -20.487
   11    HZ3  LYS  57           HZ1      LYS  57 -12.630   0.148 -21.098
   12    HZ2  LYS  57           HZ2      LYS  57 -13.308  -0.646 -19.756
   13    HZ1  LYS  57           HZ3      LYS  57 -11.790   0.107 -19.625

  No H/Q in entry =          13
  In of MODEL   36
    1    H    LEU  58           H        LEU  58  -9.765   0.394 -14.534
    2    HA   LEU  58           HA       LEU  58  -9.799  -2.116 -15.835
    3    HB2  LEU  58           HB2      LEU  58  -7.742  -0.846 -14.037
    4    HB3  LEU  58           HB3      LEU  58  -7.498  -2.365 -14.901
    5    HG   LEU  58           HG       LEU  58  -8.246   0.251 -16.245
    6   HD11  LEU  58          HD11      LEU  58  -5.602  -1.006 -15.582
    7   HD13  LEU  58          HD12      LEU  58  -6.086   0.688 -15.521
    8   HD12  LEU  58          HD13      LEU  58  -5.764  -0.078 -17.073
    9   HD22  LEU  58          HD21      LEU  58  -8.845  -1.300 -17.839
   10   HD21  LEU  58          HD22      LEU  58  -7.806  -2.557 -17.172
   11   HD23  LEU  58          HD23      LEU  58  -7.115  -1.283 -18.177

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  59           H        ILE  59 -10.589  -1.225 -12.574
    2    HA   ILE  59           HA       ILE  59 -10.247  -3.999 -11.642
    3    HB   ILE  59           HB       ILE  59  -9.780  -1.739 -10.237
    4   HG12  ILE  59          HG12      ILE  59 -11.146  -4.083  -8.899
    5   HG13  ILE  59          HG13      ILE  59  -9.518  -4.184  -9.521
    6   HG22  ILE  59          HG21      ILE  59 -12.537  -2.459  -9.278
    7   HG21  ILE  59          HG22      ILE  59 -12.318  -1.207 -10.479
    8   HG23  ILE  59          HG23      ILE  59 -11.585  -1.047  -8.884
    9   HD11  ILE  59          HD11      ILE  59 -10.422  -2.081  -7.570
   10   HD13  ILE  59          HD12      ILE  59  -8.768  -2.392  -8.081
   11   HD12  ILE  59          HD13      ILE  59  -9.622  -3.573  -7.087

  No H/Q in entry =          11
  In of MODEL   36
    1    H    GLU  60           H        GLU  60 -12.797  -1.664 -12.419
    2    HA   GLU  60           HA       GLU  60 -14.983  -3.173 -11.396
    3    HB2  GLU  60           HB2      GLU  60 -15.243  -0.820 -11.950
    4    HB3  GLU  60           HB3      GLU  60 -14.838  -1.135 -13.634
    5    HG2  GLU  60           HG2      GLU  60 -17.163  -2.551 -12.347
    6    HG3  GLU  60           HG3      GLU  60 -17.354  -0.930 -12.985

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLY  61           H        GLY  61 -13.334  -3.152 -14.524
    2    HA3  GLY  61           HA2      GLY  61 -15.067  -5.382 -15.411
    3    HA2  GLY  61           HA3      GLY  61 -14.225  -4.277 -16.490

  No H/Q in entry =           3
  In of MODEL   36
    1    H    ASP  62           H        ASP  62 -12.832  -5.743 -13.625
    2    HA   ASP  62           HA       ASP  62 -10.633  -6.787 -15.162
    3    HB2  ASP  62           HB2      ASP  62  -9.785  -7.486 -12.946
    4    HB3  ASP  62           HB3      ASP  62 -10.268  -5.792 -12.960

  No H/Q in entry =           4
  In of MODEL   36
    1    H    ALA  63           H        ALA  63 -12.976  -8.069 -16.062
    2    HA   ALA  63           HA       ALA  63 -13.553 -10.562 -14.837
    3    HB2  ALA  63           HB1      ALA  63 -13.708  -9.580 -17.704
    4    HB3  ALA  63           HB2      ALA  63 -15.031  -9.744 -16.551
    5    HB1  ALA  63           HB3      ALA  63 -14.263 -11.183 -17.224

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLY  64           H        GLY  64 -11.166  -9.578 -17.232
    2    HA3  GLY  64           HA2      GLY  64  -9.192 -10.533 -17.915
    3    HA2  GLY  64           HA3      GLY  64  -9.319 -11.631 -16.548

  No H/Q in entry =           3
  In of MODEL   36
    1    H    GLU  65           H        GLU  65  -8.422 -13.199 -18.145
    2    HA   GLU  65           HA       GLU  65  -9.890 -13.987 -20.421
    3    HB2  GLU  65           HB2      GLU  65  -7.849 -15.466 -18.765
    4    HB3  GLU  65           HB3      GLU  65  -8.520 -16.087 -20.274
    5    HG2  GLU  65           HG2      GLU  65  -7.704 -14.137 -21.488
    6    HG3  GLU  65           HG3      GLU  65  -7.124 -13.413 -19.991

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLY  66           H        GLY  66  -9.870 -15.175 -17.138
    2    HA3  GLY  66           HA2      GLY  66 -12.081 -17.028 -17.689
    3    HA2  GLY  66           HA3      GLY  66 -11.003 -17.108 -16.310

  No H/Q in entry =           3
  In of MODEL   36
    1    H    LYS  67           H        LYS  67 -13.515 -17.387 -15.711
    2    HA   LYS  67           HA       LYS  67 -15.112 -15.117 -15.374
    3    HB2  LYS  67           HB2      LYS  67 -15.083 -17.760 -13.926
    4    HB3  LYS  67           HB3      LYS  67 -16.358 -16.547 -13.742
    5    HG2  LYS  67           HG2      LYS  67 -16.766 -16.592 -16.172
    6    HG3  LYS  67           HG3      LYS  67 -15.488 -17.789 -16.371
    7    HD2  LYS  67           HD2      LYS  67 -16.745 -19.373 -14.958
    8    HD3  LYS  67           HD3      LYS  67 -18.025 -18.174 -14.756
    9    HE2  LYS  67           HE2      LYS  67 -18.401 -18.152 -17.195
   10    HE3  LYS  67           HE3      LYS  67 -17.115 -19.342 -17.405
   11    HZ2  LYS  67           HZ1      LYS  67 -19.666 -19.714 -15.936
   12    HZ1  LYS  67           HZ2      LYS  67 -18.396 -20.841 -15.941
   13    HZ3  LYS  67           HZ3      LYS  67 -19.206 -20.464 -17.385

  No H/Q in entry =          13
  In of MODEL   36
    1    H    MET  68           H        MET  68 -13.908 -16.893 -12.611
    2    HA   MET  68           HA       MET  68 -14.066 -14.753 -10.792
    3    HB2  MET  68           HB2      MET  68 -12.561 -17.364 -10.625
    4    HB3  MET  68           HB3      MET  68 -12.856 -16.278  -9.266
    5    HG2  MET  68           HG2      MET  68 -15.013 -17.557 -10.972
    6    HG3  MET  68           HG3      MET  68 -14.534 -18.101  -9.363
    7    HE1  MET  68           HE1      MET  68 -14.426 -16.865  -7.443
    8    HE3  MET  68           HE2      MET  68 -15.618 -15.685  -6.902
    9    HE2  MET  68           HE3      MET  68 -14.145 -15.136  -7.699

  No H/Q in entry =           9
  In of MODEL   36
    1    H    LYS  69           H        LYS  69 -11.237 -16.040 -12.562
    2    HA   LYS  69           HA       LYS  69  -9.312 -14.554 -11.134
    3    HB2  LYS  69           HB2      LYS  69  -8.786 -16.561 -12.445
    4    HB3  LYS  69           HB3      LYS  69  -9.109 -15.671 -13.935
    5    HG2  LYS  69           HG2      LYS  69  -7.321 -14.077 -13.399
    6    HG3  LYS  69           HG3      LYS  69  -7.023 -14.901 -11.870
    7    HD2  LYS  69           HD2      LYS  69  -6.413 -16.958 -13.098
    8    HD3  LYS  69           HD3      LYS  69  -6.694 -16.122 -14.626
    9    HE2  LYS  69           HE2      LYS  69  -4.943 -14.481 -14.061
   10    HE3  LYS  69           HE3      LYS  69  -4.667 -15.299 -12.525
   11    HZ2  LYS  69           HZ1      LYS  69  -4.116 -16.278 -15.256
   12    HZ1  LYS  69           HZ2      LYS  69  -4.265 -17.352 -13.951
   13    HZ3  LYS  69           HZ3      LYS  69  -3.054 -16.161 -13.939

  No H/Q in entry =          13
  In of MODEL   36
    1    H    VAL  70           H        VAL  70  -8.026 -12.749 -11.635
    2    HA   VAL  70           HA       VAL  70  -9.248 -10.816 -13.527
    3    HB   VAL  70           HB       VAL  70  -8.433  -9.060 -11.997
    4   HG13  VAL  70          HG11      VAL  70 -10.204  -9.272 -10.476
    5   HG12  VAL  70          HG12      VAL  70  -9.974 -11.013 -10.308
    6   HG11  VAL  70          HG13      VAL  70 -10.702 -10.356 -11.774
    7   HG22  VAL  70          HG21      VAL  70  -6.567  -9.890 -10.850
    8   HG21  VAL  70          HG22      VAL  70  -7.324 -11.457 -10.569
    9   HG23  VAL  70          HG23      VAL  70  -7.810 -10.060  -9.610

  No H/Q in entry =           9
  In of MODEL   36
    1    H    SER  71           H        SER  71  -7.682  -9.171 -14.312
    2    HA   SER  71           HA       SER  71  -5.458 -10.342 -15.600
    3    HB2  SER  71           HB2      SER  71  -6.662  -8.277 -16.371
    4    HB3  SER  71           HB3      SER  71  -5.916  -7.403 -15.037
    5    HG   SER  71           HG       SER  71  -4.881  -8.132 -17.430

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU  72           H        LEU  72  -3.425 -10.641 -14.972
    2    HA   LEU  72           HA       LEU  72  -2.682 -10.444 -12.265
    3    HB2  LEU  72           HB2      LEU  72  -1.047 -10.868 -14.762
    4    HB3  LEU  72           HB3      LEU  72  -0.378 -10.959 -13.135
    5    HG   LEU  72           HG       LEU  72  -2.746 -12.626 -14.046
    6   HD11  LEU  72          HD11      LEU  72  -0.586 -13.064 -15.322
    7   HD13  LEU  72          HD12      LEU  72  -1.227 -14.444 -14.432
    8   HD12  LEU  72          HD13      LEU  72   0.132 -13.528 -13.780
    9   HD22  LEU  72          HD21      LEU  72  -2.748 -12.646 -11.695
   10   HD21  LEU  72          HD22      LEU  72  -0.998 -12.547 -11.582
   11   HD23  LEU  72          HD23      LEU  72  -1.764 -14.055 -12.074

  No H/Q in entry =          11
  In of MODEL   36
    1    H    VAL  73           H        VAL  73  -1.974  -8.420 -15.042
    2    HA   VAL  73           HA       VAL  73  -0.033  -6.739 -13.946
    3    HB   VAL  73           HB       VAL  73  -0.383  -5.350 -15.808
    4   HG11  VAL  73          HG11      VAL  73   0.224  -7.797 -16.259
    5   HG13  VAL  73          HG12      VAL  73  -0.417  -6.890 -17.629
    6   HG12  VAL  73          HG13      VAL  73  -1.455  -8.014 -16.753
    7   HG23  VAL  73          HG21      VAL  73  -2.556  -5.577 -17.146
    8   HG22  VAL  73          HG22      VAL  73  -2.684  -4.761 -15.589
    9   HG21  VAL  73          HG23      VAL  73  -3.205  -6.438 -15.749

  No H/Q in entry =           9
  In of MODEL   36
    1    H    LEU  74           H        LEU  74  -3.427  -6.834 -13.362
    2    HA   LEU  74           HA       LEU  74  -4.022  -4.177 -12.733
    3    HB2  LEU  74           HB2      LEU  74  -5.763  -5.831 -12.902
    4    HB3  LEU  74           HB3      LEU  74  -5.069  -6.763 -11.578
    5    HG   LEU  74           HG       LEU  74  -5.506  -4.884 -10.028
    6   HD13  LEU  74          HD11      LEU  74  -5.401  -2.948 -11.392
    7   HD12  LEU  74          HD12      LEU  74  -7.110  -3.098 -10.988
    8   HD11  LEU  74          HD13      LEU  74  -6.529  -3.615 -12.571
    9   HD23  LEU  74          HD21      LEU  74  -8.075  -5.307 -11.468
   10   HD22  LEU  74          HD22      LEU  74  -7.694  -5.442  -9.766
   11   HD21  LEU  74          HD23      LEU  74  -7.220  -6.721 -10.857

  No H/Q in entry =          11
  In of MODEL   36
    1    H    VAL  75           H        VAL  75  -2.982  -6.780 -10.591
    2    HA   VAL  75           HA       VAL  75  -2.755  -5.241  -8.242
    3    HB   VAL  75           HB       VAL  75  -1.288  -7.745  -9.057
    4   HG13  VAL  75          HG11      VAL  75   0.007  -6.533  -7.338
    5   HG12  VAL  75          HG12      VAL  75  -0.804  -7.908  -6.601
    6   HG11  VAL  75          HG13      VAL  75  -1.455  -6.291  -6.387
    7   HG22  VAL  75          HG21      VAL  75  -2.949  -8.841  -7.679
    8   HG21  VAL  75          HG22      VAL  75  -3.813  -7.789  -8.800
    9   HG23  VAL  75          HG23      VAL  75  -3.585  -7.293  -7.122

  No H/Q in entry =           9
  In of MODEL   36
    1    H    GLU  76           H        GLU  76  -0.371  -6.007 -10.801
    2    HA   GLU  76           HA       GLU  76   1.833  -4.680  -9.654
    3    HB2  GLU  76           HB2      GLU  76   2.011  -6.147 -11.645
    4    HB3  GLU  76           HB3      GLU  76   1.100  -4.980 -12.590
    5    HG2  GLU  76           HG2      GLU  76   3.430  -4.651 -13.105
    6    HG3  GLU  76           HG3      GLU  76   2.934  -3.286 -12.123

  No H/Q in entry =           6
  In of MODEL   36
    1    H    ALA  77           H        ALA  77  -0.707  -3.451 -11.818
    2    HA   ALA  77           HA       ALA  77   0.300  -0.811 -11.990
    3    HB1  ALA  77           HB1      ALA  77  -1.310  -1.341 -13.607
    4    HB2  ALA  77           HB2      ALA  77  -2.206  -0.306 -12.495
    5    HB3  ALA  77           HB3      ALA  77  -2.405  -2.056 -12.422

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLN  78           H        GLN  78  -1.962  -2.361  -9.768
    2    HA   GLN  78           HA       GLN  78  -2.743  -0.043  -8.351
    3    HB2  GLN  78           HB2      GLN  78  -3.867  -2.296  -8.268
    4    HB3  GLN  78           HB3      GLN  78  -2.526  -2.869  -7.277
    5    HG2  GLN  78           HG2      GLN  78  -3.020  -1.135  -5.602
    6    HG3  GLN  78           HG3      GLN  78  -4.361  -0.556  -6.591
    7   HE21  GLN  78          HE21      GLN  78  -6.188  -1.198  -5.379
    8   HE22  GLN  78          HE22      GLN  78  -6.477  -2.794  -4.877

  No H/Q in entry =           8
  In of MODEL   36
    1    H    LEU  79           H        LEU  79  -0.076  -2.318  -7.931
    2    HA   LEU  79           HA       LEU  79   0.924  -1.439  -5.477
    3    HB2  LEU  79           HB2      LEU  79   1.774  -3.448  -6.560
    4    HB3  LEU  79           HB3      LEU  79   2.416  -2.494  -7.894
    5    HG   LEU  79           HG       LEU  79   3.990  -1.372  -6.397
    6   HD13  LEU  79          HD11      LEU  79   3.002  -1.129  -4.322
    7   HD12  LEU  79          HD12      LEU  79   4.075  -2.487  -3.992
    8   HD11  LEU  79          HD13      LEU  79   2.366  -2.775  -4.310
    9   HD23  LEU  79          HD21      LEU  79   5.194  -3.531  -5.513
   10   HD22  LEU  79          HD22      LEU  79   4.979  -3.323  -7.248
   11   HD21  LEU  79          HD23      LEU  79   3.901  -4.390  -6.353

  No H/Q in entry =          11
  In of MODEL   36
    1    H    HIS  80           H        HIS  80   1.777  -0.312  -8.751
    2    HA   HIS  80           HA       HIS  80   3.603   1.660  -7.834
    3    HB2  HIS  80           HB2      HIS  80   2.290   0.985 -10.410
    4    HB3  HIS  80           HB3      HIS  80   2.896   2.633 -10.237
    5    HD1  HIS  80           HD1      HIS  80   5.295   2.922 -10.775
    6    HD2  HIS  80           HD2      HIS  80   4.462  -0.989  -9.595
    7    HE1  HIS  80           HE1      HIS  80   7.476   1.634 -10.963
    8    HE2  HIS  80           HE2      HIS  80   6.980  -0.754 -10.248

  No H/Q in entry =           8
  In of MODEL   36
    1    H    LEU  81           H        LEU  81   0.193   1.843  -8.788
    2    HA   LEU  81           HA       LEU  81  -0.065   4.636  -8.443
    3    HB2  LEU  81           HB2      LEU  81  -2.091   2.401  -8.358
    4    HB3  LEU  81           HB3      LEU  81  -2.534   4.106  -8.255
    5    HG   LEU  81           HG       LEU  81  -0.863   2.957 -10.509
    6   HD12  LEU  81          HD11      LEU  81  -3.103   3.294 -11.790
    7   HD11  LEU  81          HD12      LEU  81  -3.847   3.222 -10.193
    8   HD13  LEU  81          HD13      LEU  81  -2.916   1.853 -10.794
    9   HD23  LEU  81          HD21      LEU  81  -1.957   5.112 -11.588
   10   HD22  LEU  81          HD22      LEU  81  -0.532   5.271 -10.565
   11   HD21  LEU  81          HD23      LEU  81  -2.130   5.624  -9.911

  No H/Q in entry =          11
  In of MODEL   36
    1    H    MET  82           H        MET  82  -0.721   1.942  -6.201
    2    HA   MET  82           HA       MET  82  -1.750   3.524  -4.099
    3    HB2  MET  82           HB2      MET  82  -0.390   0.831  -4.161
    4    HB3  MET  82           HB3      MET  82  -0.954   1.552  -2.655
    5    HG2  MET  82           HG2      MET  82  -2.707   1.077  -5.086
    6    HG3  MET  82           HG3      MET  82  -2.624  -0.003  -3.696
    7    HE3  MET  82           HE1      MET  82  -4.318   1.641  -0.861
    8    HE2  MET  82           HE2      MET  82  -2.588   1.912  -1.057
    9    HE1  MET  82           HE3      MET  82  -3.286   0.360  -1.513

  No H/Q in entry =           9
  In of MODEL   36
    1    H    THR  83           H        THR  83   1.540   2.426  -4.818
    2    HA   THR  83           HA       THR  83   2.780   3.514  -2.521
    3    HB   THR  83           HB       THR  83   4.863   3.456  -4.010
    4    HG1  THR  83           HG1      THR  83   4.607   2.940  -6.035
    5   HG22  THR  83          HG21      THR  83   4.405   0.801  -4.351
    6   HG21  THR  83          HG22      THR  83   3.125   1.181  -3.200
    7   HG23  THR  83          HG23      THR  83   4.809   1.515  -2.791

  No H/Q in entry =           7
  In of MODEL   36
    1    H    SER  84           H        SER  84   2.391   4.810  -5.812
    2    HA   SER  84           HA       SER  84   3.745   7.242  -5.356
    3    HB2  SER  84           HB2      SER  84   1.656   6.429  -7.364
    4    HB3  SER  84           HB3      SER  84   2.342   8.053  -7.336
    5    HG   SER  84           HG       SER  84   3.701   5.573  -7.649

  No H/Q in entry =           5
  In of MODEL   36
    1    H    MET  85           H        MET  85   0.249   6.501  -5.162
    2    HA   MET  85           HA       MET  85  -0.596   9.113  -4.543
    3    HB2  MET  85           HB2      MET  85  -2.132   7.313  -5.209
    4    HB3  MET  85           HB3      MET  85  -1.837   6.499  -3.672
    5    HG2  MET  85           HG2      MET  85  -2.722   8.437  -2.451
    6    HG3  MET  85           HG3      MET  85  -2.964   9.299  -3.970
    7    HE2  MET  85           HE1      MET  85  -5.191   5.867  -2.096
    8    HE1  MET  85           HE2      MET  85  -3.493   6.311  -1.940
    9    HE3  MET  85           HE3      MET  85  -4.003   5.257  -3.255

  No H/Q in entry =           9
  In of MODEL   36
    1    H    LEU  86           H        LEU  86   0.326   6.436  -2.418
    2    HA   LEU  86           HA       LEU  86  -0.182   7.730   0.034
    3    HB2  LEU  86           HB2      LEU  86   0.266   5.258  -0.375
    4    HB3  LEU  86           HB3      LEU  86   1.974   5.679  -0.481
    5    HG   LEU  86           HG       LEU  86   1.673   6.831   1.795
    6   HD11  LEU  86          HD11      LEU  86  -1.029   6.082   1.340
    7   HD13  LEU  86          HD12      LEU  86  -0.348   6.818   2.789
    8   HD12  LEU  86          HD13      LEU  86  -0.450   5.063   2.662
    9   HD23  LEU  86          HD21      LEU  86   1.229   3.841   1.906
   10   HD22  LEU  86          HD22      LEU  86   2.244   4.840   2.944
   11   HD21  LEU  86          HD23      LEU  86   2.731   4.520   1.280

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ALA  87           H        ALA  87   2.783   7.428  -1.879
    2    HA   ALA  87           HA       ALA  87   4.509   8.820  -0.160
    3    HB3  ALA  87           HB1      ALA  87   4.578   7.820  -2.873
    4    HB2  ALA  87           HB2      ALA  87   5.923   8.137  -1.780
    5    HB1  ALA  87           HB3      ALA  87   5.308   9.426  -2.813

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ARG  88           H        ARG  88   2.549   9.981  -2.860
    2    HA   ARG  88           HA       ARG  88   3.341  12.665  -2.736
    3    HB2  ARG  88           HB2      ARG  88   2.065  11.529  -4.589
    4    HB3  ARG  88           HB3      ARG  88   0.617  11.677  -3.595
    5    HG2  ARG  88           HG2      ARG  88   1.653  14.250  -3.506
    6    HG3  ARG  88           HG3      ARG  88   2.062  13.742  -5.143
    7    HD2  ARG  88           HD2      ARG  88  -0.084  13.839  -5.824
    8    HD3  ARG  88           HD3      ARG  88  -0.666  12.983  -4.395
    9    HE   ARG  88           HE       ARG  88  -0.840  15.764  -4.798
   10   HH21  ARG  88          HH11      ARG  88  -1.345  17.088  -3.050
   11   HH22  ARG  88          HH12      ARG  88  -1.041  16.541  -1.437
   12   HH11  ARG  88          HH21      ARG  88   0.178  13.483  -2.443
   13   HH12  ARG  88          HH22      ARG  88  -0.195  14.494  -1.093

  No H/Q in entry =          13
  In of MODEL   36
    1    H    GLU  89           H        GLU  89   0.639  11.000  -1.084
    2    HA   GLU  89           HA       GLU  89  -0.444  13.314   0.141
    3    HB2  GLU  89           HB2      GLU  89  -1.578  11.083   0.052
    4    HB3  GLU  89           HB3      GLU  89  -0.449  10.513   1.281
    5    HG2  GLU  89           HG2      GLU  89  -1.245  12.210   2.855
    6    HG3  GLU  89           HG3      GLU  89  -2.302  12.894   1.623

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LEU  90           H        LEU  90   2.000  10.998   1.285
    2    HA   LEU  90           HA       LEU  90   2.384  12.227   3.818
    3    HB2  LEU  90           HB2      LEU  90   4.131  10.449   2.118
    4    HB3  LEU  90           HB3      LEU  90   4.567  10.954   3.756
    5    HG   LEU  90           HG       LEU  90   1.917   9.631   3.108
    6   HD12  LEU  90          HD11      LEU  90   3.050   7.571   4.097
    7   HD11  LEU  90          HD12      LEU  90   4.577   8.417   3.848
    8   HD13  LEU  90          HD13      LEU  90   3.551   8.025   2.467
    9   HD22  LEU  90          HD21      LEU  90   1.676  10.545   5.237
   10   HD21  LEU  90          HD22      LEU  90   3.396  10.423   5.605
   11   HD23  LEU  90          HD23      LEU  90   2.379   8.983   5.654

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  91           H        ILE  91   3.966  12.614   0.681
    2    HA   ILE  91           HA       ILE  91   5.964  14.425   1.514
    3    HB   ILE  91           HB       ILE  91   4.628  13.959  -1.158
    4   HG12  ILE  91          HG12      ILE  91   7.464  13.444  -0.208
    5   HG13  ILE  91          HG13      ILE  91   6.174  12.256  -0.042
    6   HG22  ILE  91          HG21      ILE  91   6.856  15.292  -1.857
    7   HG21  ILE  91          HG22      ILE  91   6.564  16.087  -0.309
    8   HG23  ILE  91          HG23      ILE  91   5.332  16.132  -1.568
    9   HD13  ILE  91          HD11      ILE  91   5.980  11.946  -2.350
   10   HD12  ILE  91          HD12      ILE  91   7.718  12.174  -2.148
   11   HD11  ILE  91          HD13      ILE  91   6.714  13.508  -2.720

  No H/Q in entry =          11
  In of MODEL   36
    1    H    THR  92           H        THR  92   2.598  14.890   0.535
    2    HA   THR  92           HA       THR  92   2.594  17.713   0.489
    3    HB   THR  92           HB       THR  92   0.416  15.733   1.195
    4    HG1  THR  92           HG1      THR  92   0.703  15.562  -0.893
    5   HG22  THR  92          HG21      THR  92  -0.973  17.910   0.495
    6   HG21  THR  92          HG22      THR  92   0.432  18.720   1.185
    7   HG23  THR  92          HG23      THR  92  -0.511  17.601   2.168

  No H/Q in entry =           7
  In of MODEL   36
    1    H    GLU  93           H        GLU  93   2.048  15.404   3.135
    2    HA   GLU  93           HA       GLU  93   1.547  17.301   5.168
    3    HB2  GLU  93           HB2      GLU  93   2.839  14.565   5.379
    4    HB3  GLU  93           HB3      GLU  93   2.166  15.490   6.722
    5    HG2  GLU  93           HG2      GLU  93   0.529  14.739   4.292
    6    HG3  GLU  93           HG3      GLU  93   0.633  13.708   5.714

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LEU  94           H        LEU  94   4.532  15.800   3.987
    2    HA   LEU  94           HA       LEU  94   6.307  16.923   5.867
    3    HB2  LEU  94           HB2      LEU  94   6.678  15.968   3.028
    4    HB3  LEU  94           HB3      LEU  94   8.021  16.609   3.971
    5    HG   LEU  94           HG       LEU  94   6.272  14.422   5.108
    6   HD11  LEU  94          HD11      LEU  94   8.348  14.190   2.959
    7   HD13  LEU  94          HD12      LEU  94   6.896  13.227   3.227
    8   HD12  LEU  94          HD13      LEU  94   8.328  12.957   4.221
    9   HD23  LEU  94          HD21      LEU  94   8.465  13.861   6.240
   10   HD22  LEU  94          HD22      LEU  94   7.815  15.443   6.670
   11   HD21  LEU  94          HD23      LEU  94   9.144  15.317   5.517

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  95           H        ILE  95   5.153  18.121   2.732
    2    HA   ILE  95           HA       ILE  95   6.744  20.466   2.673
    3    HB   ILE  95           HB       ILE  95   4.085  19.811   1.384
    4   HG12  ILE  95          HG12      ILE  95   6.867  20.131   0.228
    5   HG13  ILE  95          HG13      ILE  95   6.209  18.580   0.739
    6   HG21  ILE  95          HG21      ILE  95   5.853  22.264   1.163
    7   HG23  ILE  95          HG22      ILE  95   4.130  22.209   1.532
    8   HG22  ILE  95          HG23      ILE  95   4.697  21.812  -0.090
    9   HD13  ILE  95          HD11      ILE  95   4.635  18.527  -0.978
   10   HD12  ILE  95          HD12      ILE  95   5.985  19.337  -1.772
   11   HD11  ILE  95          HD13      ILE  95   4.625  20.280  -1.164

  No H/Q in entry =          11
  In of MODEL   36
    1    H    GLU  96           H        GLU  96   3.500  19.834   3.990
    2    HA   GLU  96           HA       GLU  96   2.908  22.482   4.759
    3    HB2  GLU  96           HB2      GLU  96   1.219  20.713   4.775
    4    HB3  GLU  96           HB3      GLU  96   2.083  19.872   6.059
    5    HG2  GLU  96           HG2      GLU  96   1.086  21.156   7.643
    6    HG3  GLU  96           HG3      GLU  96   1.628  22.629   6.850

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LEU  97           H        LEU  97   4.742  19.907   6.357
    2    HA   LEU  97           HA       LEU  97   5.130  21.240   8.832
    3    HB2  LEU  97           HB2      LEU  97   6.637  19.065   7.395
    4    HB3  LEU  97           HB3      LEU  97   7.244  19.737   8.906
    5    HG   LEU  97           HG       LEU  97   4.423  18.669   8.611
    6   HD12  LEU  97          HD11      LEU  97   5.355  16.643   9.806
    7   HD11  LEU  97          HD12      LEU  97   6.969  17.261   9.453
    8   HD13  LEU  97          HD13      LEU  97   5.885  16.820   8.133
    9   HD23  LEU  97          HD21      LEU  97   4.893  18.358  11.170
   10   HD22  LEU  97          HD22      LEU  97   4.522  19.976  10.577
   11   HD21  LEU  97          HD23      LEU  97   6.193  19.519  10.907

  No H/Q in entry =          11
  In of MODEL   36
    1    H    HIS  98           H        HIS  98   6.977  21.255   5.792
    2    HA   HIS  98           HA       HIS  98   9.152  22.811   6.683
    3    HB2  HIS  98           HB2      HIS  98   7.835  22.581   3.966
    4    HB3  HIS  98           HB3      HIS  98   9.286  23.546   4.250
    5    HD1  HIS  98           HD1      HIS  98   8.043  19.986   4.261
    6    HD2  HIS  98           HD2      HIS  98  11.646  22.048   4.669
    7    HE1  HIS  98           HE1      HIS  98   9.881  18.240   4.180
    8    HE2  HIS  98           HE2      HIS  98  12.079  19.475   4.429

  No H/Q in entry =           8
  In of MODEL   36
    1    H    GLU  99           H        GLU  99   5.929  23.681   5.537
    2    HA   GLU  99           HA       GLU  99   6.334  26.492   5.491
    3    HB2  GLU  99           HB2      GLU  99   4.435  25.346   4.368
    4    HB3  GLU  99           HB3      GLU  99   3.748  24.983   5.951
    5    HG2  GLU  99           HG2      GLU  99   3.594  27.374   6.466
    6    HG3  GLU  99           HG3      GLU  99   4.362  27.775   4.933

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LYS 100           H        LYS 100   5.202  24.254   8.009
    2    HA   LYS 100           HA       LYS 100   4.649  26.304   9.918
    3    HB2  LYS 100           HB2      LYS 100   5.199  23.345  10.244
    4    HB3  LYS 100           HB3      LYS 100   4.772  24.415  11.586
    5    HG2  LYS 100           HG2      LYS 100   2.703  25.078  10.357
    6    HG3  LYS 100           HG3      LYS 100   3.109  23.912   9.095
    7    HD2  LYS 100           HD2      LYS 100   3.027  22.083  10.747
    8    HD3  LYS 100           HD3      LYS 100   2.638  23.243  12.020
    9    HE2  LYS 100           HE2      LYS 100   0.581  23.891  10.776
   10    HE3  LYS 100           HE3      LYS 100   0.960  22.673   9.551
   11    HZ1  LYS 100           HZ1      LYS 100   0.710  21.994  12.430
   12    HZ3  LYS 100           HZ2      LYS 100   0.675  20.947  11.090
   13    HZ2  LYS 100           HZ3      LYS 100  -0.629  21.997  11.386

  No H/Q in entry =          13
  In of MODEL   36
    1    H    LEU 101           H        LEU 101   7.549  24.485   9.053
    2    HA   LEU 101           HA       LEU 101   9.172  25.298  11.248
    3    HB2  LEU 101           HB2      LEU 101   9.736  24.321   8.461
    4    HB3  LEU 101           HB3      LEU 101  11.052  24.968   9.435
    5    HG   LEU 101           HG       LEU 101   9.207  22.824  10.502
    6   HD12  LEU 101          HD11      LEU 101  11.242  21.313   9.870
    7   HD11  LEU 101          HD12      LEU 101  11.612  22.578   8.701
    8   HD13  LEU 101          HD13      LEU 101  10.074  21.721   8.614
    9   HD21  LEU 101          HD21      LEU 101  11.948  23.902  11.214
   10   HD23  LEU 101          HD22      LEU 101  11.394  22.332  11.790
   11   HD22  LEU 101          HD23      LEU 101  10.519  23.794  12.243

  No H/Q in entry =          11
  In of MODEL   36
    1    H    LYS 102           H        LYS 102   7.591  27.188   9.129
    2    HA   LYS 102           HA       LYS 102   7.688  29.482   8.849
    3    HB2  LYS 102           HB2      LYS 102   9.268  29.340  10.935
    4    HB3  LYS 102           HB3      LYS 102  10.560  29.528   9.766
    5    HG2  LYS 102           HG2      LYS 102   8.481  31.497  10.655
    6    HG3  LYS 102           HG3      LYS 102  10.194  31.742  10.391
    7    HD2  LYS 102           HD2      LYS 102   8.221  31.350   8.104
    8    HD3  LYS 102           HD3      LYS 102   8.625  32.922   8.778
    9    HE2  LYS 102           HE2      LYS 102   9.970  31.735   6.688
   10    HE3  LYS 102           HE3      LYS 102  10.607  33.030   7.701
   11    HZ2  LYS 102           HZ1      LYS 102  12.107  31.112   7.504
   12    HZ1  LYS 102           HZ2      LYS 102  10.941  30.137   8.251
   13    HZ3  LYS 102           HZ3      LYS 102  11.653  31.412   9.111

  No H/Q in entry =          13
  In of MODEL   36
    1    H    ALA 103           H        ALA 103  10.927  28.114   8.253
    2    HA   ALA 103           HA       ALA 103  11.889  29.492   6.177
    3    HB2  ALA 103           HB1      ALA 103  12.745  27.274   5.230
    4    HB1  ALA 103           HB2      ALA 103  11.852  26.502   6.539
    5    HB3  ALA 103           HB3      ALA 103  13.156  27.631   6.908

  No H/Q in entry =           5
  In of MODEL   36
    1    H1   LYS   3           H1       LYS   3 -31.454   5.312 -20.152
    2    H2   LYS   3           H3       LYS   3 -30.449   5.010 -21.487
    3    H3   LYS   3           H2       LYS   3 -31.819   4.044 -21.221
    4    HA   LYS   3           HA       LYS   3 -30.789   2.724 -19.770
    5    HB2  LYS   3           HB2      LYS   3 -28.537   4.159 -21.128
    6    HB3  LYS   3           HB3      LYS   3 -28.189   2.997 -19.848
    7    HG2  LYS   3           HG2      LYS   3 -29.557   1.334 -21.160
    8    HG3  LYS   3           HG3      LYS   3 -29.535   2.497 -22.485
    9    HD2  LYS   3           HD2      LYS   3 -27.051   2.452 -22.414
   10    HD3  LYS   3           HD3      LYS   3 -27.142   1.186 -21.191
   11    HE2  LYS   3           HE2      LYS   3 -28.596  -0.080 -22.881
   12    HE3  LYS   3           HE3      LYS   3 -27.999   1.080 -24.068
   13    HZ3  LYS   3           HZ1      LYS   3 -26.166  -0.107 -24.288
   14    HZ2  LYS   3           HZ2      LYS   3 -26.772  -1.260 -23.198
   15    HZ1  LYS   3           HZ3      LYS   3 -25.822   0.028 -22.631

  No H/Q in entry =          15
  In of MODEL   36
    1    H    LYS   4           H        LYS   4 -30.854   2.642 -17.706
    2    HA   LYS   4           HA       LYS   4 -30.197   4.995 -16.119
    3    HB2  LYS   4           HB2      LYS   4 -31.333   2.293 -15.348
    4    HB3  LYS   4           HB3      LYS   4 -31.155   3.669 -14.261
    5    HG2  LYS   4           HG2      LYS   4 -32.942   3.489 -16.692
    6    HG3  LYS   4           HG3      LYS   4 -33.447   3.575 -15.005
    7    HD2  LYS   4           HD2      LYS   4 -32.810   5.823 -14.800
    8    HD3  LYS   4           HD3      LYS   4 -31.759   5.750 -16.213
    9    HE2  LYS   4           HE2      LYS   4 -33.716   7.058 -16.729
   10    HE3  LYS   4           HE3      LYS   4 -33.751   5.556 -17.653
   11    HZ3  LYS   4           HZ1      LYS   4 -35.315   4.649 -16.091
   12    HZ2  LYS   4           HZ2      LYS   4 -35.903   6.112 -16.723
   13    HZ1  LYS   4           HZ3      LYS   4 -35.256   6.064 -15.154

  No H/Q in entry =          13
  In of MODEL   36
    1    H    HIS   5           H        HIS   5 -28.743   5.165 -14.521
    2    HA   HIS   5           HA       HIS   5 -26.412   3.386 -14.783
    3    HB2  HIS   5           HB2      HIS   5 -26.745   6.167 -13.660
    4    HB3  HIS   5           HB3      HIS   5 -25.240   5.252 -13.605
    5    HD1  HIS   5           HD1      HIS   5 -23.789   6.440 -15.219
    6    HD2  HIS   5           HD2      HIS   5 -27.561   5.679 -16.781
    7    HE1  HIS   5           HE1      HIS   5 -23.618   6.952 -17.685
    8    HE2  HIS   5           HE2      HIS   5 -25.918   6.477 -18.604

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ILE   6           H        ILE   6 -26.155   1.859 -13.418
    2    HA   ILE   6           HA       ILE   6 -27.157   2.184 -10.670
    3    HB   ILE   6           HB       ILE   6 -26.260  -0.306 -12.128
    4   HG12  ILE   6          HG12      ILE   6 -29.032   0.588 -11.323
    5   HG13  ILE   6          HG13      ILE   6 -28.382   0.717 -12.958
    6   HG23  ILE   6          HG21      ILE   6 -26.617  -1.512 -10.234
    7   HG22  ILE   6          HG22      ILE   6 -27.807  -0.375  -9.596
    8   HG21  ILE   6          HG23      ILE   6 -26.087   0.006  -9.505
    9   HD13  ILE   6          HD11      ILE   6 -28.786  -1.427 -13.398
   10   HD12  ILE   6          HD12      ILE   6 -29.812  -1.393 -11.964
   11   HD11  ILE   6          HD13      ILE   6 -28.145  -1.956 -11.842

  No H/Q in entry =          11
  In of MODEL   36
    1    H    TYR   7           H        TYR   7 -25.424   2.905  -9.391
    2    HA   TYR   7           HA       TYR   7 -22.686   1.995 -10.023
    3    HB2  TYR   7           HB2      TYR   7 -23.718   4.448  -8.622
    4    HB3  TYR   7           HB3      TYR   7 -22.022   3.972  -8.634
    5    HD1  TYR   7           HD1      TYR   7 -23.015   2.914 -11.701
    6    HD2  TYR   7           HD2      TYR   7 -22.447   6.565  -9.578
    7    HE1  TYR   7           HE1      TYR   7 -22.597   4.092 -13.825
    8    HE2  TYR   7           HE2      TYR   7 -22.071   7.747 -11.694
    9    HH   TYR   7           HH       TYR   7 -22.271   7.590 -13.924

  No H/Q in entry =           9
  In of MODEL   36
    1    H    LEU   8           H        LEU   8 -21.698   0.706  -8.648
    2    HA   LEU   8           HA       LEU   8 -22.836   0.264  -5.959
    3    HB2  LEU   8           HB2      LEU   8 -21.081  -1.411  -7.731
    4    HB3  LEU   8           HB3      LEU   8 -21.270  -1.747  -6.010
    5    HG   LEU   8           HG       LEU   8 -23.742  -1.991  -6.444
    6   HD13  LEU   8          HD11      LEU   8 -23.886  -0.841  -8.590
    7   HD12  LEU   8          HD12      LEU   8 -24.374  -2.524  -8.784
    8   HD11  LEU   8          HD13      LEU   8 -22.774  -2.004  -9.312
    9   HD23  LEU   8          HD21      LEU   8 -22.407  -4.050  -8.068
   10   HD22  LEU   8          HD22      LEU   8 -23.500  -4.203  -6.693
   11   HD21  LEU   8          HD23      LEU   8 -21.804  -3.802  -6.429

  No H/Q in entry =          11
  In of MODEL   36
    1    H    PHE   9           H        PHE   9 -21.594   0.740  -4.178
    2    HA   PHE   9           HA       PHE   9 -18.821   1.717  -4.673
    3    HB2  PHE   9           HB2      PHE   9 -20.895   2.819  -2.782
    4    HB3  PHE   9           HB3      PHE   9 -19.196   3.267  -2.745
    5    HD1  PHE   9           HD1      PHE   9 -18.188   4.556  -4.551
    6    HD2  PHE   9           HD2      PHE   9 -22.354   3.533  -4.621
    7    HE1  PHE   9           HE1      PHE   9 -18.558   6.187  -6.377
    8    HE2  PHE   9           HE2      PHE   9 -22.726   5.176  -6.443
    9    HZ   PHE   9           HZ       PHE   9 -20.825   6.499  -7.327

  No H/Q in entry =           9
  In of MODEL   36
    1    H    SER  10           H        SER  10 -17.222   0.863  -3.470
    2    HA   SER  10           HA       SER  10 -17.490   0.053  -0.761
    3    HB2  SER  10           HB2      SER  10 -18.642  -1.878  -1.797
    4    HB3  SER  10           HB3      SER  10 -17.226  -2.160  -2.798
    5    HG   SER  10           HG       SER  10 -17.617  -2.549  -0.066

  No H/Q in entry =           5
  In of MODEL   36
    1    H    SER  11           H        SER  11 -15.475   0.124   0.150
    2    HA   SER  11           HA       SER  11 -13.276   1.015  -1.363
    3    HB2  SER  11           HB2      SER  11 -13.040  -0.296   1.330
    4    HB3  SER  11           HB3      SER  11 -12.059   0.999   0.642
    5    HG   SER  11           HG       SER  11 -13.854   1.515   2.216

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA  12           H        ALA  12 -14.407  -1.663  -2.189
    2    HA   ALA  12           HA       ALA  12 -11.823  -2.904  -2.661
    3    HB3  ALA  12           HB1      ALA  12 -12.295  -4.102  -0.683
    4    HB2  ALA  12           HB2      ALA  12 -12.773  -5.187  -1.988
    5    HB1  ALA  12           HB3      ALA  12 -14.000  -4.284  -1.101

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLY  13           H        GLY  13 -12.698  -1.879  -4.683
    2    HA3  GLY  13           HA2      GLY  13 -14.893  -2.703  -6.145
    3    HA2  GLY  13           HA3      GLY  13 -13.367  -2.186  -6.874

  No H/Q in entry =           3
  In of MODEL   36
    1    H    MET  14           H        MET  14 -11.815  -4.448  -5.781
    2    HA   MET  14           HA       MET  14 -12.086  -6.215  -7.926
    3    HB2  MET  14           HB2      MET  14 -10.035  -6.187  -6.600
    4    HB3  MET  14           HB3      MET  14 -10.881  -6.878  -5.217
    5    HG2  MET  14           HG2      MET  14 -11.363  -8.913  -6.546
    6    HG3  MET  14           HG3      MET  14 -10.513  -8.211  -7.924
    7    HE2  MET  14           HE1      MET  14  -7.873  -6.837  -6.845
    8    HE1  MET  14           HE2      MET  14  -8.293  -7.835  -8.236
    9    HE3  MET  14           HE3      MET  14  -6.917  -8.277  -7.228

  No H/Q in entry =           9
  In of MODEL   36
    1    H    SER  15           H        SER  15 -13.308  -6.739  -4.615
    2    HA   SER  15           HA       SER  15 -14.564  -9.234  -5.316
    3    HB2  SER  15           HB2      SER  15 -14.161  -9.010  -2.986
    4    HB3  SER  15           HB3      SER  15 -14.905  -7.414  -2.934
    5    HG   SER  15           HG       SER  15 -16.046  -9.868  -2.692

  No H/Q in entry =           5
  In of MODEL   36
    1    H    THR  16           H        THR  16 -15.729  -5.879  -5.054
    2    HA   THR  16           HA       THR  16 -18.501  -6.448  -5.622
    3    HB   THR  16           HB       THR  16 -16.977  -3.876  -6.165
    4    HG1  THR  16           HG1      THR  16 -16.583  -4.332  -4.067
    5   HG23  THR  16          HG21      THR  16 -19.124  -2.824  -5.896
    6   HG22  THR  16          HG22      THR  16 -19.865  -4.344  -5.365
    7   HG21  THR  16          HG23      THR  16 -19.328  -4.146  -7.039

  No H/Q in entry =           7
  In of MODEL   36
    1    H    SER  17           H        SER  17 -15.632  -5.869  -7.451
    2    HA   SER  17           HA       SER  17 -16.756  -5.232  -9.982
    3    HB2  SER  17           HB2      SER  17 -14.101  -6.454  -9.210
    4    HB3  SER  17           HB3      SER  17 -14.537  -6.103 -10.882
    5    HG   SER  17           HG       SER  17 -13.365  -4.463  -9.432

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU  18           H        LEU  18 -16.123  -8.316  -8.436
    2    HA   LEU  18           HA       LEU  18 -16.652  -9.900 -10.749
    3    HB2  LEU  18           HB2      LEU  18 -15.426 -10.791  -8.828
    4    HB3  LEU  18           HB3      LEU  18 -16.846 -10.571  -7.808
    5    HG   LEU  18           HG       LEU  18 -18.074 -12.164  -9.301
    6   HD11  LEU  18          HD11      LEU  18 -15.347 -12.263 -10.553
    7   HD13  LEU  18          HD12      LEU  18 -16.928 -12.179 -11.333
    8   HD12  LEU  18          HD13      LEU  18 -16.389 -13.684 -10.590
    9   HD22  LEU  18          HD21      LEU  18 -17.202 -14.090  -8.260
   10   HD21  LEU  18          HD22      LEU  18 -16.975 -12.745  -7.140
   11   HD23  LEU  18          HD23      LEU  18 -15.610 -13.351  -8.077

  No H/Q in entry =          11
  In of MODEL   36
    1    H    LEU  19           H        LEU  19 -18.674  -8.662  -8.092
    2    HA   LEU  19           HA       LEU  19 -21.099  -9.931  -8.908
    3    HB2  LEU  19           HB2      LEU  19 -20.874  -9.026  -6.680
    4    HB3  LEU  19           HB3      LEU  19 -20.619  -7.408  -7.330
    5    HG   LEU  19           HG       LEU  19 -22.944  -7.318  -8.064
    6   HD12  LEU  19          HD11      LEU  19 -24.516  -9.083  -7.333
    7   HD11  LEU  19          HD12      LEU  19 -23.148 -10.049  -6.781
    8   HD13  LEU  19          HD13      LEU  19 -23.334  -9.685  -8.496
    9   HD22  LEU  19          HD21      LEU  19 -23.952  -7.185  -5.848
   10   HD21  LEU  19          HD22      LEU  19 -22.324  -6.510  -5.855
   11   HD23  LEU  19          HD23      LEU  19 -22.610  -8.112  -5.177

  No H/Q in entry =          11
  In of MODEL   36
    1    H    VAL  20           H        VAL  20 -19.676  -6.756  -9.685
    2    HA   VAL  20           HA       VAL  20 -21.799  -5.815 -11.302
    3    HB   VAL  20           HB       VAL  20 -18.826  -5.153 -11.422
    4   HG12  VAL  20          HG11      VAL  20 -19.754  -3.060 -12.653
    5   HG11  VAL  20          HG12      VAL  20 -21.147  -4.080 -13.009
    6   HG13  VAL  20          HG13      VAL  20 -19.545  -4.549 -13.574
    7   HG23  VAL  20          HG21      VAL  20 -19.789  -2.948 -10.504
    8   HG22  VAL  20          HG22      VAL  20 -19.631  -4.325  -9.415
    9   HG21  VAL  20          HG23      VAL  20 -21.205  -3.918 -10.098

  No H/Q in entry =           9
  In of MODEL   36
    1    H    SER  21           H        SER  21 -18.983  -7.825 -12.245
    2    HA   SER  21           HA       SER  21 -19.746  -7.816 -15.004
    3    HB2  SER  21           HB2      SER  21 -18.258  -9.753 -15.267
    4    HB3  SER  21           HB3      SER  21 -17.469  -8.461 -14.365
    5    HG   SER  21           HG       SER  21 -17.450  -9.648 -12.634

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LYS  22           H        LYS  22 -20.779  -9.949 -12.376
    2    HA   LYS  22           HA       LYS  22 -22.262 -11.661 -14.161
    3    HB2  LYS  22           HB2      LYS  22 -22.610 -11.226 -11.191
    4    HB3  LYS  22           HB3      LYS  22 -23.345 -12.519 -12.138
    5    HG2  LYS  22           HG2      LYS  22 -20.378 -12.157 -11.739
    6    HG3  LYS  22           HG3      LYS  22 -21.395 -13.259 -10.810
    7    HD2  LYS  22           HD2      LYS  22 -21.972 -14.451 -12.889
    8    HD3  LYS  22           HD3      LYS  22 -20.906 -13.370 -13.788
    9    HE2  LYS  22           HE2      LYS  22 -18.984 -14.179 -12.494
   10    HE3  LYS  22           HE3      LYS  22 -20.044 -15.246 -11.573
   11    HZ1  LYS  22           HZ1      LYS  22 -20.472 -15.817 -14.244
   12    HZ3  LYS  22           HZ2      LYS  22 -19.677 -16.780 -13.091
   13    HZ2  LYS  22           HZ3      LYS  22 -18.788 -15.700 -14.055

  No H/Q in entry =          13
  In of MODEL   36
    1    H    MET  23           H        MET  23 -23.071  -8.703 -12.386
    2    HA   MET  23           HA       MET  23 -25.872  -8.863 -12.912
    3    HB2  MET  23           HB2      MET  23 -24.086  -6.495 -12.395
    4    HB3  MET  23           HB3      MET  23 -25.833  -6.373 -12.591
    5    HG2  MET  23           HG2      MET  23 -26.210  -7.627 -10.587
    6    HG3  MET  23           HG3      MET  23 -24.492  -7.994 -10.436
    7    HE2  MET  23           HE1      MET  23 -26.885  -4.364  -9.375
    8    HE1  MET  23           HE2      MET  23 -27.104  -5.381 -10.797
    9    HE3  MET  23           HE3      MET  23 -26.103  -3.932 -10.896

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ARG  24           H        ARG  24 -23.137  -7.424 -14.716
    2    HA   ARG  24           HA       ARG  24 -24.647  -6.218 -16.765
    3    HB2  ARG  24           HB2      ARG  24 -21.806  -7.290 -16.751
    4    HB3  ARG  24           HB3      ARG  24 -22.490  -6.432 -18.108
    5    HG2  ARG  24           HG2      ARG  24 -22.731  -4.376 -16.777
    6    HG3  ARG  24           HG3      ARG  24 -22.178  -5.249 -15.323
    7    HD2  ARG  24           HD2      ARG  24 -20.261  -4.075 -16.247
    8    HD3  ARG  24           HD3      ARG  24 -20.067  -5.794 -16.563
    9    HE   ARG  24           HE       ARG  24 -21.191  -4.944 -18.839
   10   HH21  ARG  24          HH11      ARG  24 -19.725  -5.535 -20.438
   11   HH22  ARG  24          HH12      ARG  24 -18.094  -4.965 -20.356
   12   HH11  ARG  24          HH21      ARG  24 -18.571  -3.724 -17.077
   13   HH12  ARG  24          HH22      ARG  24 -17.424  -3.887 -18.369

  No H/Q in entry =          13
  In of MODEL   36
    1    H    ALA  25           H        ALA  25 -23.452  -9.521 -16.382
    2    HA   ALA  25           HA       ALA  25 -24.038 -10.443 -18.998
    3    HB1  ALA  25           HB1      ALA  25 -23.304 -12.437 -18.237
    4    HB3  ALA  25           HB2      ALA  25 -24.374 -12.399 -16.837
    5    HB2  ALA  25           HB3      ALA  25 -22.838 -11.536 -16.795

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLN  26           H        GLN  26 -25.891 -10.434 -15.990
    2    HA   GLN  26           HA       GLN  26 -28.199 -11.718 -16.990
    3    HB2  GLN  26           HB2      GLN  26 -27.745  -9.891 -14.651
    4    HB3  GLN  26           HB3      GLN  26 -29.288 -10.659 -14.992
    5    HG2  GLN  26           HG2      GLN  26 -26.676 -12.044 -14.461
    6    HG3  GLN  26           HG3      GLN  26 -28.048 -11.939 -13.365
    7   HE21  GLN  26          HE21      GLN  26 -26.772 -14.112 -14.568
    8   HE22  GLN  26          HE22      GLN  26 -27.785 -15.204 -15.343

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ALA  27           H        ALA  27 -27.342  -8.290 -16.690
    2    HA   ALA  27           HA       ALA  27 -29.848  -7.277 -17.526
    3    HB1  ALA  27           HB1      ALA  27 -28.077  -5.890 -16.434
    4    HB3  ALA  27           HB2      ALA  27 -28.671  -5.180 -17.936
    5    HB2  ALA  27           HB3      ALA  27 -27.117  -6.013 -17.909

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLU  28           H        GLU  28 -27.104  -8.492 -19.336
    2    HA   GLU  28           HA       GLU  28 -28.039  -7.545 -21.892
    3    HB2  GLU  28           HB2      GLU  28 -25.652  -8.157 -21.229
    4    HB3  GLU  28           HB3      GLU  28 -26.158  -9.839 -21.388
    5    HG2  GLU  28           HG2      GLU  28 -25.012  -9.094 -23.368
    6    HG3  GLU  28           HG3      GLU  28 -26.699  -9.463 -23.721

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LYS  29           H        LYS  29 -28.153 -10.605 -20.149
    2    HA   LYS  29           HA       LYS  29 -29.405 -12.160 -22.121
    3    HB2  LYS  29           HB2      LYS  29 -28.353 -13.064 -20.082
    4    HB3  LYS  29           HB3      LYS  29 -29.648 -12.358 -19.118
    5    HG2  LYS  29           HG2      LYS  29 -31.269 -13.795 -20.160
    6    HG3  LYS  29           HG3      LYS  29 -30.047 -14.435 -21.256
    7    HD2  LYS  29           HD2      LYS  29 -28.895 -15.527 -19.481
    8    HD3  LYS  29           HD3      LYS  29 -29.831 -14.671 -18.258
    9    HE2  LYS  29           HE2      LYS  29 -30.529 -17.045 -18.559
   10    HE3  LYS  29           HE3      LYS  29 -31.830 -15.889 -18.847
   11    HZ1  LYS  29           HZ1      LYS  29 -31.241 -16.078 -21.265
   12    HZ3  LYS  29           HZ2      LYS  29 -31.936 -17.461 -20.567
   13    HZ2  LYS  29           HZ3      LYS  29 -30.265 -17.404 -20.852

  No H/Q in entry =          13
  In of MODEL   36
    1    H    TYR  30           H        TYR  30 -30.865 -10.017 -19.690
    2    HA   TYR  30           HA       TYR  30 -33.506 -10.559 -20.940
    3    HB2  TYR  30           HB2      TYR  30 -32.903  -9.316 -18.247
    4    HB3  TYR  30           HB3      TYR  30 -34.508  -9.626 -18.906
    5    HD1  TYR  30           HD1      TYR  30 -35.367 -11.943 -19.063
    6    HD2  TYR  30           HD2      TYR  30 -31.564 -11.090 -17.348
    7    HE1  TYR  30           HE1      TYR  30 -35.234 -14.246 -18.201
    8    HE2  TYR  30           HE2      TYR  30 -31.432 -13.377 -16.490
    9    HH   TYR  30           HH       TYR  30 -33.010 -15.803 -17.529

  No H/Q in entry =           9
  In of MODEL   36
    1    H    GLU  31           H        GLU  31 -31.378  -8.544 -21.778
    2    HA   GLU  31           HA       GLU  31 -31.343  -6.409 -22.660
    3    HB2  GLU  31           HB2      GLU  31 -34.217  -7.203 -23.176
    4    HB3  GLU  31           HB3      GLU  31 -33.401  -5.837 -23.937
    5    HG2  GLU  31           HG2      GLU  31 -31.886  -7.275 -25.076
    6    HG3  GLU  31           HG3      GLU  31 -32.428  -8.675 -24.153

  No H/Q in entry =           6
  In of MODEL   36
    1    H    VAL  32           H        VAL  32 -31.569  -6.235 -19.934
    2    HA   VAL  32           HA       VAL  32 -33.485  -4.148 -19.350
    3    HB   VAL  32           HB       VAL  32 -31.085  -5.042 -17.722
    4   HG12  VAL  32          HG11      VAL  32 -32.655  -4.201 -15.863
    5   HG11  VAL  32          HG12      VAL  32 -33.498  -3.352 -17.158
    6   HG13  VAL  32          HG13      VAL  32 -31.800  -3.000 -16.833
    7   HG21  VAL  32          HG21      VAL  32 -32.807  -6.821 -18.377
    8   HG23  VAL  32          HG22      VAL  32 -33.876  -5.986 -17.249
    9   HG22  VAL  32          HG23      VAL  32 -32.347  -6.659 -16.681

  No H/Q in entry =           9
  In of MODEL   36
    1    HA   PRO  33           HA       PRO  33 -30.506  -1.198 -21.080
    2    HB2  PRO  33           HB2      PRO  33 -32.069   0.992 -21.030
    3    HB3  PRO  33           HB3      PRO  33 -32.497  -0.351 -22.091
    4    HG2  PRO  33           HG2      PRO  33 -33.503   0.221 -19.303
    5    HG3  PRO  33           HG3      PRO  33 -34.449  -0.051 -20.766
    6    HD2  PRO  33           HD2      PRO  33 -33.960  -2.065 -19.039
    7    HD3  PRO  33           HD3      PRO  33 -34.000  -2.356 -20.779

  No H/Q in entry =           7
  In of MODEL   36
    1    H    VAL  34           H        VAL  34 -29.246  -1.658 -19.105
    2    HA   VAL  34           HA       VAL  34 -29.035   0.818 -17.524
    3    HB   VAL  34           HB       VAL  34 -28.436  -0.575 -15.541
    4   HG12  VAL  34          HG11      VAL  34 -30.830  -1.497 -15.230
    5   HG11  VAL  34          HG12      VAL  34 -31.150  -0.788 -16.811
    6   HG13  VAL  34          HG13      VAL  34 -30.633   0.239 -15.473
    7   HG21  VAL  34          HG21      VAL  34 -28.556  -2.660 -17.494
    8   HG23  VAL  34          HG22      VAL  34 -29.616  -3.008 -16.127
    9   HG22  VAL  34          HG23      VAL  34 -27.907  -2.674 -15.854

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ILE  35           H        ILE  35 -27.077   1.324 -16.681
    2    HA   ILE  35           HA       ILE  35 -24.730   0.015 -17.887
    3    HB   ILE  35           HB       ILE  35 -25.206   2.916 -17.160
    4   HG12  ILE  35          HG12      ILE  35 -24.170   1.564 -19.659
    5   HG13  ILE  35          HG13      ILE  35 -25.818   2.152 -19.430
    6   HG21  ILE  35          HG21      ILE  35 -22.605   1.438 -17.406
    7   HG23  ILE  35          HG22      ILE  35 -23.099   2.639 -16.213
    8   HG22  ILE  35          HG23      ILE  35 -22.715   3.138 -17.861
    9   HD11  ILE  35          HD11      ILE  35 -24.474   4.395 -18.878
   10   HD13  ILE  35          HD12      ILE  35 -24.988   3.954 -20.508
   11   HD12  ILE  35          HD13      ILE  35 -23.331   3.639 -19.989

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ILE  36           H        ILE  36 -23.489  -0.933 -16.250
    2    HA   ILE  36           HA       ILE  36 -23.969  -0.250 -13.402
    3    HB   ILE  36           HB       ILE  36 -23.067  -2.962 -14.428
    4   HG12  ILE  36          HG12      ILE  36 -25.900  -2.204 -13.709
    5   HG13  ILE  36          HG13      ILE  36 -25.314  -2.216 -15.372
    6   HG23  ILE  36          HG21      ILE  36 -23.417  -3.740 -12.295
    7   HG22  ILE  36          HG22      ILE  36 -24.579  -2.473 -11.901
    8   HG21  ILE  36          HG23      ILE  36 -22.855  -2.101 -11.967
    9   HD13  ILE  36          HD11      ILE  36 -25.425  -4.437 -15.518
   10   HD12  ILE  36          HD12      ILE  36 -26.505  -4.303 -14.132
   11   HD11  ILE  36          HD13      ILE  36 -24.799  -4.676 -13.888

  No H/Q in entry =          11
  In of MODEL   36
    1    H    GLU  37           H        GLU  37 -22.214   0.453 -12.300
    2    HA   GLU  37           HA       GLU  37 -19.497  -0.303 -13.173
    3    HB2  GLU  37           HB2      GLU  37 -20.473   2.482 -12.563
    4    HB3  GLU  37           HB3      GLU  37 -18.770   2.030 -12.656
    5    HG2  GLU  37           HG2      GLU  37 -18.995   1.524 -14.997
    6    HG3  GLU  37           HG3      GLU  37 -20.725   1.852 -14.928

  No H/Q in entry =           6
  In of MODEL   36
    1    H    ALA  38           H        ALA  38 -18.019  -0.457 -11.472
    2    HA   ALA  38           HA       ALA  38 -19.078  -0.228  -8.716
    3    HB1  ALA  38           HB1      ALA  38 -17.305  -2.163 -10.074
    4    HB3  ALA  38           HB2      ALA  38 -18.360  -2.386  -8.678
    5    HB2  ALA  38           HB3      ALA  38 -16.768  -1.658  -8.472

  No H/Q in entry =           5
  In of MODEL   36
    1    H    PHE  39           H        PHE  39 -17.882   1.052  -7.267
    2    HA   PHE  39           HA       PHE  39 -15.380   2.293  -8.176
    3    HB2  PHE  39           HB2      PHE  39 -17.711   3.822  -7.013
    4    HB3  PHE  39           HB3      PHE  39 -16.117   4.485  -7.367
    5    HD1  PHE  39           HD1      PHE  39 -15.379   4.773  -9.681
    6    HD2  PHE  39           HD2      PHE  39 -19.329   3.494  -8.714
    7    HE1  PHE  39           HE1      PHE  39 -16.116   5.359 -11.974
    8    HE2  PHE  39           HE2      PHE  39 -20.079   4.066 -10.996
    9    HZ   PHE  39           HZ       PHE  39 -18.473   4.971 -12.642

  No H/Q in entry =           9
  In of MODEL   36
    1    HA   PRO  40           HA       PRO  40 -14.459   1.682  -3.863
    2    HB2  PRO  40           HB2      PRO  40 -12.750   3.757  -3.298
    3    HB3  PRO  40           HB3      PRO  40 -12.264   2.411  -4.328
    4    HG2  PRO  40           HG2      PRO  40 -13.357   5.097  -5.153
    5    HG3  PRO  40           HG3      PRO  40 -11.901   4.283  -5.724
    6    HD2  PRO  40           HD2      PRO  40 -14.107   4.089  -7.152
    7    HD3  PRO  40           HD3      PRO  40 -13.115   2.653  -6.909

  No H/Q in entry =           7
  In of MODEL   36
    1    H    GLU  41           H        GLU  41 -15.125   2.701  -1.766
    2    HA   GLU  41           HA       GLU  41 -17.414   4.343  -1.814
    3    HB2  GLU  41           HB2      GLU  41 -17.344   4.275   0.539
    4    HB3  GLU  41           HB3      GLU  41 -16.668   2.734   0.012
    5    HG2  GLU  41           HG2      GLU  41 -14.402   3.611   0.416
    6    HG3  GLU  41           HG3      GLU  41 -15.106   5.121   0.994

  No H/Q in entry =           6
  In of MODEL   36
    1    H    THR  42           H        THR  42 -14.108   5.349  -1.865
    2    HA   THR  42           HA       THR  42 -14.540   7.931  -0.728
    3    HB   THR  42           HB       THR  42 -12.391   8.533  -1.827
    4    HG1  THR  42           HG1      THR  42 -11.416   7.073  -3.169
    5   HG23  THR  42          HG21      THR  42 -12.345   7.366   0.329
    6   HG22  THR  42          HG22      THR  42 -11.002   6.834  -0.684
    7   HG21  THR  42          HG23      THR  42 -12.425   5.811  -0.499

  No H/Q in entry =           7
  In of MODEL   36
    1    H    LEU  43           H        LEU  43 -15.388   6.727  -3.804
    2    HA   LEU  43           HA       LEU  43 -15.707   9.464  -4.853
    3    HB2  LEU  43           HB2      LEU  43 -16.005   6.776  -6.182
    4    HB3  LEU  43           HB3      LEU  43 -16.219   8.334  -6.978
    5    HG   LEU  43           HG       LEU  43 -13.613   7.281  -5.902
    6   HD12  LEU  43          HD11      LEU  43 -14.293   7.697  -8.788
    7   HD11  LEU  43          HD12      LEU  43 -14.718   6.187  -7.984
    8   HD13  LEU  43          HD13      LEU  43 -13.032   6.692  -8.072
    9   HD22  LEU  43          HD21      LEU  43 -13.587   9.659  -5.838
   10   HD21  LEU  43          HD22      LEU  43 -14.400   9.781  -7.399
   11   HD23  LEU  43          HD23      LEU  43 -12.738   9.199  -7.313

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ALA  44           H        ALA  44 -17.619   7.638  -2.965
    2    HA   ALA  44           HA       ALA  44 -20.080   7.394  -4.301
    3    HB2  ALA  44           HB1      ALA  44 -19.930   6.341  -2.174
    4    HB3  ALA  44           HB2      ALA  44 -21.076   7.661  -1.948
    5    HB1  ALA  44           HB3      ALA  44 -19.413   7.831  -1.386

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLY  45           H        GLY  45 -18.750  10.274  -2.838
    2    HA3  GLY  45           HA2      GLY  45 -21.224  11.695  -3.259
    3    HA2  GLY  45           HA3      GLY  45 -19.702  12.378  -2.688

  No H/Q in entry =           3
  In of MODEL   36
    1    H    GLU  46           H        GLU  46 -18.126  11.421  -4.939
    2    HA   GLU  46           HA       GLU  46 -18.808  13.568  -6.775
    3    HB2  GLU  46           HB2      GLU  46 -16.472  13.119  -6.099
    4    HB3  GLU  46           HB3      GLU  46 -16.575  11.530  -6.857
    5    HG2  GLU  46           HG2      GLU  46 -16.877  12.570  -9.032
    6    HG3  GLU  46           HG3      GLU  46 -16.821  14.168  -8.288

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LYS  47           H        LYS  47 -18.589  10.043  -7.109
    2    HA   LYS  47           HA       LYS  47 -19.670  10.157  -9.799
    3    HB2  LYS  47           HB2      LYS  47 -19.053   7.833  -7.968
    4    HB3  LYS  47           HB3      LYS  47 -19.606   7.678  -9.635
    5    HG2  LYS  47           HG2      LYS  47 -17.102   9.152  -8.909
    6    HG3  LYS  47           HG3      LYS  47 -17.126   7.416  -9.217
    7    HD2  LYS  47           HD2      LYS  47 -18.169   7.875 -11.423
    8    HD3  LYS  47           HD3      LYS  47 -17.974   9.599 -11.113
    9    HE2  LYS  47           HE2      LYS  47 -15.723   7.601 -11.184
   10    HE3  LYS  47           HE3      LYS  47 -16.178   8.654 -12.523
   11    HZ2  LYS  47           HZ1      LYS  47 -14.450   9.241 -10.486
   12    HZ1  LYS  47           HZ2      LYS  47 -15.856  10.113 -10.109
   13    HZ3  LYS  47           HZ3      LYS  47 -15.098  10.332 -11.614

  No H/Q in entry =          13
  In of MODEL   36
    1    H    GLY  48           H        GLY  48 -20.999   9.453  -6.641
    2    HA3  GLY  48           HA2      GLY  48 -23.345   8.182  -7.367
    3    HA2  GLY  48           HA3      GLY  48 -23.158   9.222  -5.955

  No H/Q in entry =           3
  In of MODEL   36
    1    H    GLN  49           H        GLN  49 -22.628  11.615  -7.589
    2    HA   GLN  49           HA       GLN  49 -25.215  12.651  -7.784
    3    HB2  GLN  49           HB2      GLN  49 -22.684  13.546  -9.149
    4    HB3  GLN  49           HB3      GLN  49 -24.172  14.474  -9.103
    5    HG2  GLN  49           HG2      GLN  49 -24.035  14.570  -6.666
    6    HG3  GLN  49           HG3      GLN  49 -22.559  13.621  -6.710
    7   HE21  GLN  49          HE21      GLN  49 -22.513  15.887  -5.500
    8   HE22  GLN  49          HE22      GLN  49 -21.619  17.149  -6.175

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ASN  50           H        ASN  50 -23.466  10.752 -10.104
    2    HA   ASN  50           HA       ASN  50 -25.353  11.514 -12.224
    3    HB2  ASN  50           HB2      ASN  50 -22.731  10.039 -12.395
    4    HB3  ASN  50           HB3      ASN  50 -23.781  10.399 -13.758
    5   HD21  ASN  50          HD21      ASN  50 -21.182  11.361 -12.151
    6   HD22  ASN  50          HD22      ASN  50 -20.990  12.992 -12.537

  No H/Q in entry =           6
  In of MODEL   36
    1    H    ALA  51           H        ALA  51 -25.296   9.224  -9.913
    2    HA   ALA  51           HA       ALA  51 -26.007   7.008 -11.684
    3    HB2  ALA  51           HB1      ALA  51 -25.402   5.722  -9.956
    4    HB3  ALA  51           HB2      ALA  51 -26.555   6.531  -8.895
    5    HB1  ALA  51           HB3      ALA  51 -24.931   7.190  -9.098

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ASP  52           H        ASP  52 -27.985   5.904 -11.531
    2    HA   ASP  52           HA       ASP  52 -30.219   7.696 -10.935
    3    HB2  ASP  52           HB2      ASP  52 -29.948   5.152 -12.532
    4    HB3  ASP  52           HB3      ASP  52 -31.515   5.855 -12.129

  No H/Q in entry =           4
  In of MODEL   36
    1    H    VAL  53           H        VAL  53 -28.552   4.880  -9.825
    2    HA   VAL  53           HA       VAL  53 -30.016   5.041  -7.325
    3    HB   VAL  53           HB       VAL  53 -31.362   3.328  -8.532
    4   HG11  VAL  53          HG11      VAL  53 -29.580   2.472 -10.016
    5   HG13  VAL  53          HG12      VAL  53 -30.386   1.180  -9.127
    6   HG12  VAL  53          HG13      VAL  53 -28.795   1.738  -8.619
    7   HG23  VAL  53          HG21      VAL  53 -30.503   1.422  -6.779
    8   HG22  VAL  53          HG22      VAL  53 -31.669   2.706  -6.458
    9   HG21  VAL  53          HG23      VAL  53 -29.971   2.933  -6.042

  No H/Q in entry =           9
  In of MODEL   36
    1    H    VAL  54           H        VAL  54 -28.707   4.688  -5.648
    2    HA   VAL  54           HA       VAL  54 -25.920   3.893  -6.214
    3    HB   VAL  54           HB       VAL  54 -27.055   5.705  -4.024
    4   HG11  VAL  54          HG11      VAL  54 -24.439   4.345  -4.254
    5   HG13  VAL  54          HG12      VAL  54 -25.221   5.045  -2.837
    6   HG12  VAL  54          HG13      VAL  54 -24.333   6.080  -3.955
    7   HG22  VAL  54          HG21      VAL  54 -26.233   7.510  -5.166
    8   HG21  VAL  54          HG22      VAL  54 -26.743   6.468  -6.495
    9   HG23  VAL  54          HG23      VAL  54 -25.041   6.549  -6.044

  No H/Q in entry =           9
  In of MODEL   36
    1    H    LEU  55           H        LEU  55 -25.286   2.006  -5.512
    2    HA   LEU  55           HA       LEU  55 -26.779   0.718  -3.313
    3    HB2  LEU  55           HB2      LEU  55 -25.174  -0.473  -5.562
    4    HB3  LEU  55           HB3      LEU  55 -25.922  -1.391  -4.253
    5    HG   LEU  55           HG       LEU  55 -27.379   0.100  -6.425
    6   HD13  LEU  55          HD11      LEU  55 -27.023  -1.777  -7.590
    7   HD12  LEU  55          HD12      LEU  55 -27.968  -2.643  -6.378
    8   HD11  LEU  55          HD13      LEU  55 -26.216  -2.530  -6.216
    9   HD23  LEU  55          HD21      LEU  55 -28.641  -1.825  -4.527
   10   HD22  LEU  55          HD22      LEU  55 -29.364  -0.485  -5.418
   11   HD21  LEU  55          HD23      LEU  55 -28.362  -0.165  -4.002

  No H/Q in entry =          11
  In of MODEL   36
    1    H    LEU  56           H        LEU  56 -25.628   0.204  -1.482
    2    HA   LEU  56           HA       LEU  56 -22.704   0.671  -1.520
    3    HB2  LEU  56           HB2      LEU  56 -24.521   0.483   0.869
    4    HB3  LEU  56           HB3      LEU  56 -22.824   0.955   0.859
    5    HG   LEU  56           HG       LEU  56 -25.155   2.547  -0.170
    6   HD11  LEU  56          HD11      LEU  56 -24.052   2.264   2.370
    7   HD13  LEU  56          HD12      LEU  56 -25.072   3.593   1.817
    8   HD12  LEU  56          HD13      LEU  56 -23.317   3.740   1.741
    9   HD23  LEU  56          HD21      LEU  56 -23.251   4.288  -0.395
   10   HD22  LEU  56          HD22      LEU  56 -23.596   3.145  -1.695
   11   HD21  LEU  56          HD23      LEU  56 -22.243   2.857  -0.601

  No H/Q in entry =          11
  In of MODEL   36
    1    H    GLY  57           H        GLY  57 -21.288  -0.908  -0.929
    2    HA3  GLY  57           HA2      GLY  57 -22.141  -3.620  -1.059
    3    HA2  GLY  57           HA3      GLY  57 -20.537  -3.072  -0.578

  No H/Q in entry =           3
  In of MODEL   36
    1    HA   PRO  58           HA       PRO  58 -23.351  -4.076   3.136
    2    HB2  PRO  58           HB2      PRO  58 -22.608  -6.645   3.821
    3    HB3  PRO  58           HB3      PRO  58 -23.992  -6.300   2.786
    4    HG2  PRO  58           HG2      PRO  58 -21.238  -7.135   2.047
    5    HG3  PRO  58           HG3      PRO  58 -22.784  -7.652   1.376
    6    HD2  PRO  58           HD2      PRO  58 -21.211  -5.830   0.115
    7    HD3  PRO  58           HD3      PRO  58 -22.971  -5.790  -0.003

  No H/Q in entry =           7
  In of MODEL   36
    1    H    GLN  59           H        GLN  59 -19.965  -4.482   2.569
    2    HA   GLN  59           HA       GLN  59 -19.233  -4.403   5.334
    3    HB2  GLN  59           HB2      GLN  59 -17.652  -3.594   2.889
    4    HB3  GLN  59           HB3      GLN  59 -16.999  -3.715   4.511
    5    HG2  GLN  59           HG2      GLN  59 -18.179  -5.992   2.927
    6    HG3  GLN  59           HG3      GLN  59 -16.464  -5.665   3.114
    7   HE21  GLN  59          HE21      GLN  59 -18.626  -7.477   4.075
    8   HE22  GLN  59          HE22      GLN  59 -18.375  -8.116   5.590

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ILE  60           H        ILE  60 -20.209  -1.939   3.048
    2    HA   ILE  60           HA       ILE  60 -19.422   0.094   5.043
    3    HB   ILE  60           HB       ILE  60 -19.684   1.767   3.166
    4   HG12  ILE  60          HG12      ILE  60 -19.404  -0.503   1.244
    5   HG13  ILE  60          HG13      ILE  60 -21.012  -0.008   1.772
    6   HG21  ILE  60          HG21      ILE  60 -17.598  -0.352   3.169
    7   HG23  ILE  60          HG22      ILE  60 -17.503   1.328   3.695
    8   HG22  ILE  60          HG23      ILE  60 -17.555   0.945   1.975
    9   HD12  ILE  60          HD11      ILE  60 -19.016   1.494   0.118
   10   HD11  ILE  60          HD12      ILE  60 -20.193   2.385   1.081
   11   HD13  ILE  60          HD13      ILE  60 -20.741   1.255  -0.157

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ALA  61           H        ALA  61 -21.840  -1.548   5.139
    2    HA   ALA  61           HA       ALA  61 -24.101   0.048   4.615
    3    HB1  ALA  61           HB1      ALA  61 -25.292  -1.433   5.973
    4    HB2  ALA  61           HB2      ALA  61 -23.893  -1.760   6.998
    5    HB3  ALA  61           HB3      ALA  61 -23.960  -2.415   5.361

  No H/Q in entry =           5
  In of MODEL   36
    1    H    TYR  62           H        TYR  62 -21.916   0.069   7.432
    2    HA   TYR  62           HA       TYR  62 -23.525   1.734   9.043
    3    HB2  TYR  62           HB2      TYR  62 -21.525   2.220  10.297
    4    HB3  TYR  62           HB3      TYR  62 -21.498   0.518   9.837
    5    HD1  TYR  62           HD1      TYR  62 -19.862  -0.311   8.191
    6    HD2  TYR  62           HD2      TYR  62 -19.863   3.786   9.404
    7    HE1  TYR  62           HE1      TYR  62 -17.646  -0.008   7.153
    8    HE2  TYR  62           HE2      TYR  62 -17.633   4.085   8.368
    9    HH   TYR  62           HH       TYR  62 -16.077   3.151   7.137

  No H/Q in entry =           9
  In of MODEL   36
    1    H    MET  63           H        MET  63 -21.879   2.552   6.176
    2    HA   MET  63           HA       MET  63 -21.786   5.406   6.791
    3    HB2  MET  63           HB2      MET  63 -21.127   3.833   4.299
    4    HB3  MET  63           HB3      MET  63 -20.965   5.585   4.444
    5    HG2  MET  63           HG2      MET  63 -19.265   5.301   6.150
    6    HG3  MET  63           HG3      MET  63 -19.441   3.550   6.048
    7    HE1  MET  63           HE1      MET  63 -18.982   6.693   4.331
    8    HE3  MET  63           HE2      MET  63 -18.948   6.186   2.642
    9    HE2  MET  63           HE3      MET  63 -17.437   6.506   3.496

  No H/Q in entry =           9
  In of MODEL   36
    1    H    LEU  64           H        LEU  64 -24.296   3.464   5.860
    2    HA   LEU  64           HA       LEU  64 -25.523   4.793   3.733
    3    HB2  LEU  64           HB2      LEU  64 -26.348   2.695   4.704
    4    HB3  LEU  64           HB3      LEU  64 -26.838   3.567   6.155
    5    HG   LEU  64           HG       LEU  64 -28.551   4.747   4.879
    6   HD13  LEU  64          HD11      LEU  64 -28.256   4.931   2.643
    7   HD12  LEU  64          HD12      LEU  64 -28.862   3.277   2.539
    8   HD11  LEU  64          HD13      LEU  64 -27.126   3.579   2.603
    9   HD23  LEU  64          HD21      LEU  64 -28.998   1.902   4.207
   10   HD22  LEU  64          HD22      LEU  64 -30.019   3.038   5.088
   11   HD21  LEU  64          HD23      LEU  64 -28.632   2.300   5.887

  No H/Q in entry =          11
  In of MODEL   36
    1    HA   PRO  65           HA       PRO  65 -27.798   7.972   6.377
    2    HB2  PRO  65           HB2      PRO  65 -25.819   8.241   8.641
    3    HB3  PRO  65           HB3      PRO  65 -27.565   8.483   8.666
    4    HG2  PRO  65           HG2      PRO  65 -26.591   6.278   9.663
    5    HG3  PRO  65           HG3      PRO  65 -28.002   6.182   8.609
    6    HD2  PRO  65           HD2      PRO  65 -25.110   5.615   7.944
    7    HD3  PRO  65           HD3      PRO  65 -26.544   4.683   7.512

  No H/Q in entry =           7
  In of MODEL   36
    1    H    GLU  66           H        GLU  66 -24.242   8.000   6.478
    2    HA   GLU  66           HA       GLU  66 -24.004  10.793   5.996
    3    HB2  GLU  66           HB2      GLU  66 -22.135   8.510   5.424
    4    HB3  GLU  66           HB3      GLU  66 -21.722  10.205   5.171
    5    HG2  GLU  66           HG2      GLU  66 -21.961  10.637   7.525
    6    HG3  GLU  66           HG3      GLU  66 -22.451   8.966   7.801

  No H/Q in entry =           6
  In of MODEL   36
    1    H    ILE  67           H        ILE  67 -24.028   7.983   3.822
    2    HA   ILE  67           HA       ILE  67 -23.631   9.635   1.484
    3    HB   ILE  67           HB       ILE  67 -24.466   6.715   1.740
    4   HG12  ILE  67          HG12      ILE  67 -21.855   7.916   0.804
    5   HG13  ILE  67          HG13      ILE  67 -22.154   7.538   2.499
    6   HG21  ILE  67          HG21      ILE  67 -24.432   8.530  -0.537
    7   HG23  ILE  67          HG22      ILE  67 -25.021   6.871  -0.444
    8   HG22  ILE  67          HG23      ILE  67 -23.317   7.183  -0.768
    9   HD12  ILE  67          HD11      ILE  67 -21.677   5.710   0.204
   10   HD11  ILE  67          HD12      ILE  67 -22.689   5.153   1.535
   11   HD13  ILE  67          HD13      ILE  67 -21.030   5.662   1.844

  No H/Q in entry =          11
  In of MODEL   36
    1    H    GLN  68           H        GLN  68 -26.489   8.565   3.126
    2    HA   GLN  68           HA       GLN  68 -28.322   9.401   1.113
    3    HB2  GLN  68           HB2      GLN  68 -28.594   9.122   4.103
    4    HB3  GLN  68           HB3      GLN  68 -29.918   9.660   3.084
    5    HG2  GLN  68           HG2      GLN  68 -29.894   7.595   1.866
    6    HG3  GLN  68           HG3      GLN  68 -28.439   7.072   2.695
    7   HE21  GLN  68          HE21      GLN  68 -30.588   5.665   2.582
    8   HE22  GLN  68          HE22      GLN  68 -31.419   5.232   4.004

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ARG  69           H        ARG  69 -26.774  11.176   3.814
    2    HA   ARG  69           HA       ARG  69 -28.184  13.618   3.327
    3    HB2  ARG  69           HB2      ARG  69 -25.834  12.780   4.959
    4    HB3  ARG  69           HB3      ARG  69 -25.944  14.488   4.551
    5    HG2  ARG  69           HG2      ARG  69 -28.269  14.511   5.504
    6    HG3  ARG  69           HG3      ARG  69 -28.031  12.840   6.027
    7    HD2  ARG  69           HD2      ARG  69 -26.393  15.253   6.886
    8    HD3  ARG  69           HD3      ARG  69 -27.511  14.353   7.898
    9    HE   ARG  69           HE       ARG  69 -24.874  13.447   6.994
   10   HH21  ARG  69          HH11      ARG  69 -24.040  11.735   8.245
   11   HH22  ARG  69          HH12      ARG  69 -25.061  10.930   9.388
   12   HH11  ARG  69          HH21      ARG  69 -27.832  12.889   8.685
   13   HH12  ARG  69          HH22      ARG  69 -27.208  11.581   9.635

  No H/Q in entry =          13
  In of MODEL   36
    1    H    LEU  70           H        LEU  70 -25.276  12.231   2.028
    2    HA   LEU  70           HA       LEU  70 -24.200  14.584   0.802
    3    HB2  LEU  70           HB2      LEU  70 -23.165  12.304   1.469
    4    HB3  LEU  70           HB3      LEU  70 -23.759  11.782  -0.107
    5    HG   LEU  70           HG       LEU  70 -22.184  13.155  -1.219
    6   HD11  LEU  70          HD11      LEU  70 -21.399  14.091   1.550
    7   HD13  LEU  70          HD12      LEU  70 -22.105  15.077   0.268
    8   HD12  LEU  70          HD13      LEU  70 -20.479  14.421   0.079
    9   HD22  LEU  70          HD21      LEU  70 -20.720  11.473  -0.928
   10   HD21  LEU  70          HD22      LEU  70 -21.647  10.972   0.486
   11   HD23  LEU  70          HD23      LEU  70 -20.284  12.077   0.671

  No H/Q in entry =          11
  In of MODEL   36
    1    H    LEU  71           H        LEU  71 -26.296  11.970  -0.257
    2    HA   LEU  71           HA       LEU  71 -26.829  13.376  -2.818
    3    HB2  LEU  71           HB2      LEU  71 -26.984  10.402  -2.289
    4    HB3  LEU  71           HB3      LEU  71 -27.117  11.217  -3.847
    5    HG   LEU  71           HG       LEU  71 -24.610  11.323  -2.169
    6   HD12  LEU  71          HD11      LEU  71 -24.614   9.627  -4.554
    7   HD11  LEU  71          HD12      LEU  71 -25.623   9.021  -3.242
    8   HD13  LEU  71          HD13      LEU  71 -23.911   9.340  -2.962
    9   HD22  LEU  71          HD21      LEU  71 -24.733  13.094  -3.713
   10   HD21  LEU  71          HD22      LEU  71 -25.202  12.006  -5.019
   11   HD23  LEU  71          HD23      LEU  71 -23.584  11.908  -4.326

  No H/Q in entry =          11
  In of MODEL   36
    1    HA   PRO  72           HA       PRO  72 -30.707  12.932  -0.212
    2    HB2  PRO  72           HB2      PRO  72 -31.607  15.474  -0.371
    3    HB3  PRO  72           HB3      PRO  72 -30.299  15.076   0.742
    4    HG2  PRO  72           HG2      PRO  72 -30.113  16.196  -2.043
    5    HG3  PRO  72           HG3      PRO  72 -29.367  16.802  -0.564
    6    HD2  PRO  72           HD2      PRO  72 -27.991  15.218  -2.276
    7    HD3  PRO  72           HD3      PRO  72 -27.746  15.104  -0.534

  No H/Q in entry =           7
  In of MODEL   36
    1    H    ASN  73           H        ASN  73 -30.076  13.807  -3.447
    2    HA   ASN  73           HA       ASN  73 -32.925  13.433  -4.091
    3    HB2  ASN  73           HB2      ASN  73 -32.462  14.488  -6.214
    4    HB3  ASN  73           HB3      ASN  73 -31.966  15.514  -4.878
    5   HD21  ASN  73          HD21      ASN  73 -31.152  15.497  -7.549
    6   HD22  ASN  73          HD22      ASN  73 -29.480  15.359  -7.726

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LYS  74           H        LYS  74 -30.912  11.223  -3.589
    2    HA   LYS  74           HA       LYS  74 -31.438   9.748  -6.100
    3    HB2  LYS  74           HB2      LYS  74 -28.913   9.543  -4.454
    4    HB3  LYS  74           HB3      LYS  74 -29.272   8.681  -5.950
    5    HG2  LYS  74           HG2      LYS  74 -29.056  11.660  -5.830
    6    HG3  LYS  74           HG3      LYS  74 -27.663  10.611  -6.095
    7    HD2  LYS  74           HD2      LYS  74 -28.751   9.612  -8.020
    8    HD3  LYS  74           HD3      LYS  74 -30.188  10.595  -7.738
    9    HE2  LYS  74           HE2      LYS  74 -28.991  12.607  -8.228
   10    HE3  LYS  74           HE3      LYS  74 -27.455  11.739  -8.282
   11    HZ2  LYS  74           HZ1      LYS  74 -28.919  12.259 -10.435
   12    HZ1  LYS  74           HZ2      LYS  74 -29.553  10.737 -10.024
   13    HZ3  LYS  74           HZ3      LYS  74 -27.889  10.915 -10.313

  No H/Q in entry =          13
  In of MODEL   36
    1    HA   PRO  75           HA       PRO  75 -32.809   6.827  -3.056
    2    HB2  PRO  75           HB2      PRO  75 -33.073   4.560  -4.577
    3    HB3  PRO  75           HB3      PRO  75 -34.219   5.895  -4.692
    4    HG2  PRO  75           HG2      PRO  75 -31.859   5.284  -6.430
    5    HG3  PRO  75           HG3      PRO  75 -33.511   5.683  -6.901
    6    HD2  PRO  75           HD2      PRO  75 -31.597   7.578  -6.897
    7    HD3  PRO  75           HD3      PRO  75 -33.239   7.968  -6.381

  No H/Q in entry =           7
  In of MODEL   36
    1    H    VAL  76           H        VAL  76 -31.350   5.832  -1.643
    2    HA   VAL  76           HA       VAL  76 -28.859   4.630  -2.698
    3    HB   VAL  76           HB       VAL  76 -29.190   6.166  -0.085
    4   HG11  VAL  76          HG11      VAL  76 -26.804   4.875  -1.423
    5   HG13  VAL  76          HG12      VAL  76 -27.505   4.459   0.141
    6   HG12  VAL  76          HG13      VAL  76 -26.681   6.003  -0.072
    7   HG22  VAL  76          HG21      VAL  76 -28.543   8.051  -1.021
    8   HG21  VAL  76          HG22      VAL  76 -29.064   7.304  -2.532
    9   HG23  VAL  76          HG23      VAL  76 -27.365   7.254  -2.063

  No H/Q in entry =           9
  In of MODEL   36
    1    H    GLU  77           H        GLU  77 -28.616   2.497  -2.023
    2    HA   GLU  77           HA       GLU  77 -29.411   1.774   0.646
    3    HB2  GLU  77           HB2      GLU  77 -30.990   0.088   0.152
    4    HB3  GLU  77           HB3      GLU  77 -31.555   1.582  -0.597
    5    HG2  GLU  77           HG2      GLU  77 -30.918   0.772  -2.758
    6    HG3  GLU  77           HG3      GLU  77 -30.259  -0.696  -2.039

  No H/Q in entry =           6
  In of MODEL   36
    1    H    VAL  78           H        VAL  78 -29.058  -0.288   1.368
    2    HA   VAL  78           HA       VAL  78 -26.373  -1.044   0.521
    3    HB   VAL  78           HB       VAL  78 -28.087  -1.886   2.899
    4   HG11  VAL  78          HG11      VAL  78 -25.720  -3.111   1.826
    5   HG13  VAL  78          HG12      VAL  78 -26.632  -3.554   3.270
    6   HG12  VAL  78          HG13      VAL  78 -25.331  -2.370   3.378
    7   HG22  VAL  78          HG21      VAL  78 -26.659  -0.465   4.208
    8   HG21  VAL  78          HG22      VAL  78 -27.399   0.457   2.900
    9   HG23  VAL  78          HG23      VAL  78 -25.713  -0.048   2.778

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ILE  79           H        ILE  79 -25.800  -2.969  -0.325
    2    HA   ILE  79           HA       ILE  79 -27.828  -4.516  -1.646
    3    HB   ILE  79           HB       ILE  79 -24.832  -4.990  -1.387
    4   HG12  ILE  79          HG12      ILE  79 -26.467  -3.977  -3.718
    5   HG13  ILE  79          HG13      ILE  79 -25.617  -2.921  -2.588
    6   HG22  ILE  79          HG21      ILE  79 -25.897  -6.253  -3.680
    7   HG21  ILE  79          HG22      ILE  79 -26.885  -6.749  -2.305
    8   HG23  ILE  79          HG23      ILE  79 -25.140  -7.001  -2.274
    9   HD13  ILE  79          HD11      ILE  79 -24.188  -3.065  -4.392
   10   HD12  ILE  79          HD12      ILE  79 -24.499  -4.786  -4.626
   11   HD11  ILE  79          HD13      ILE  79 -23.533  -4.242  -3.253

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ASP  80           H        ASP  80 -28.668  -6.435  -1.014
    2    HA   ASP  80           HA       ASP  80 -28.622  -7.258   1.658
    3    HB2  ASP  80           HB2      ASP  80 -30.353  -7.908   0.022
    4    HB3  ASP  80           HB3      ASP  80 -29.174  -8.922  -0.809

  No H/Q in entry =           4
  In of MODEL   36
    1    H    SER  81           H        SER  81 -27.078  -8.336   2.831
    2    HA   SER  81           HA       SER  81 -24.562  -9.013   1.679
    3    HB2  SER  81           HB2      SER  81 -24.011  -9.971   3.881
    4    HB3  SER  81           HB3      SER  81 -24.740  -8.373   4.043
    5    HG   SER  81           HG       SER  81 -26.687  -9.372   4.547

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU  82           H        LEU  82 -27.243 -11.137   2.040
    2    HA   LEU  82           HA       LEU  82 -25.656 -13.495   1.600
    3    HB2  LEU  82           HB2      LEU  82 -28.598 -12.925   1.316
    4    HB3  LEU  82           HB3      LEU  82 -27.875 -14.523   1.136
    5    HG   LEU  82           HG       LEU  82 -27.826 -12.899   3.662
    6   HD13  LEU  82          HD11      LEU  82 -30.094 -13.527   3.280
    7   HD12  LEU  82          HD12      LEU  82 -29.440 -14.728   4.395
    8   HD11  LEU  82          HD13      LEU  82 -29.624 -15.120   2.685
    9   HD22  LEU  82          HD21      LEU  82 -25.981 -14.346   3.665
   10   HD21  LEU  82          HD22      LEU  82 -26.858 -15.609   2.802
   11   HD23  LEU  82          HD23      LEU  82 -27.231 -15.276   4.493

  No H/Q in entry =          11
  In of MODEL   36
    1    H    LEU  83           H        LEU  83 -27.632 -11.356  -0.397
    2    HA   LEU  83           HA       LEU  83 -27.391 -12.782  -2.827
    3    HB2  LEU  83           HB2      LEU  83 -27.850  -9.864  -2.265
    4    HB3  LEU  83           HB3      LEU  83 -27.859 -10.555  -3.888
    5    HG   LEU  83           HG       LEU  83 -29.904 -10.910  -1.715
    6   HD13  LEU  83          HD11      LEU  83 -30.680  -9.106  -2.839
    7   HD12  LEU  83          HD12      LEU  83 -31.115 -10.264  -4.095
    8   HD11  LEU  83          HD13      LEU  83 -29.594  -9.377  -4.201
    9   HD23  LEU  83          HD21      LEU  83 -30.003 -12.250  -4.404
   10   HD22  LEU  83          HD22      LEU  83 -30.978 -12.572  -2.971
   11   HD21  LEU  83          HD23      LEU  83 -29.282 -13.051  -3.009

  No H/Q in entry =          11
  In of MODEL   36
    1    H    TYR  84           H        TYR  84 -25.487 -10.319  -1.205
    2    HA   TYR  84           HA       TYR  84 -23.616  -9.865  -3.335
    3    HB2  TYR  84           HB2      TYR  84 -24.173  -8.330  -1.360
    4    HB3  TYR  84           HB3      TYR  84 -23.142  -9.387  -0.397
    5    HD1  TYR  84           HD1      TYR  84 -20.769  -9.230  -0.505
    6    HD2  TYR  84           HD2      TYR  84 -23.176  -7.032  -3.264
    7    HE1  TYR  84           HE1      TYR  84 -18.765  -7.989  -1.247
    8    HE2  TYR  84           HE2      TYR  84 -21.180  -5.792  -4.021
    9    HH   TYR  84           HH       TYR  84 -18.872  -5.802  -3.971

  No H/Q in entry =           9
  In of MODEL   36
    1    H    GLY  85           H        GLY  85 -23.369 -11.777  -0.330
    2    HA3  GLY  85           HA2      GLY  85 -20.773 -12.695  -0.767
    3    HA2  GLY  85           HA3      GLY  85 -21.999 -13.532   0.186

  No H/Q in entry =           3
  In of MODEL   36
    1    H    LYS  86           H        LYS  86 -23.824 -13.993  -1.875
    2    HA   LYS  86           HA       LYS  86 -22.725 -16.387  -3.057
    3    HB2  LYS  86           HB2      LYS  86 -25.395 -15.000  -3.309
    4    HB3  LYS  86           HB3      LYS  86 -25.033 -16.627  -3.884
    5    HG2  LYS  86           HG2      LYS  86 -24.866 -15.855  -1.003
    6    HG3  LYS  86           HG3      LYS  86 -26.340 -16.457  -1.762
    7    HD2  LYS  86           HD2      LYS  86 -25.088 -18.443  -2.551
    8    HD3  LYS  86           HD3      LYS  86 -23.658 -17.850  -1.706
    9    HE2  LYS  86           HE2      LYS  86 -26.285 -18.448  -0.359
   10    HE3  LYS  86           HE3      LYS  86 -24.939 -19.583  -0.451
   11    HZ1  LYS  86           HZ1      LYS  86 -24.674 -16.845   0.661
   12    HZ3  LYS  86           HZ2      LYS  86 -23.562 -18.125   0.776
   13    HZ2  LYS  86           HZ3      LYS  86 -25.034 -18.202   1.618

  No H/Q in entry =          13
  In of MODEL   36
    1    H    VAL  87           H        VAL  87 -22.755 -13.199  -4.045
    2    HA   VAL  87           HA       VAL  87 -22.459 -12.079  -6.017
    3    HB   VAL  87           HB       VAL  87 -21.349 -14.599  -7.280
    4   HG13  VAL  87          HG11      VAL  87 -20.050 -13.123  -8.548
    5   HG12  VAL  87          HG12      VAL  87 -20.152 -11.841  -7.339
    6   HG11  VAL  87          HG13      VAL  87 -21.547 -12.211  -8.351
    7   HG21  VAL  87          HG21      VAL  87 -20.460 -14.534  -4.985
    8   HG23  VAL  87          HG22      VAL  87 -19.862 -12.904  -5.283
    9   HG22  VAL  87          HG23      VAL  87 -19.216 -14.262  -6.202

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ASP  88           H        ASP  88 -24.966 -12.749  -5.665
    2    HA   ASP  88           HA       ASP  88 -26.051 -14.052  -8.034
    3    HB2  ASP  88           HB2      ASP  88 -27.061 -14.245  -5.710
    4    HB3  ASP  88           HB3      ASP  88 -27.539 -12.554  -5.862

  No H/Q in entry =           4
  In of MODEL   36
    1    H    GLY  89           H        GLY  89 -25.354 -12.833  -9.706
    2    HA3  GLY  89           HA2      GLY  89 -25.578 -10.070  -9.989
    3    HA2  GLY  89           HA3      GLY  89 -25.526 -11.229 -11.317

  No H/Q in entry =           3
  In of MODEL   36
    1    H    LEU  90           H        LEU  90 -27.954 -12.607 -10.845
    2    HA   LEU  90           HA       LEU  90 -29.787 -10.734 -12.028
    3    HB2  LEU  90           HB2      LEU  90 -29.811 -13.146 -12.537
    4    HB3  LEU  90           HB3      LEU  90 -30.322 -13.472 -10.882
    5    HG   LEU  90           HG       LEU  90 -32.456 -12.400 -11.292
    6   HD13  LEU  90          HD11      LEU  90 -32.293 -10.701 -12.816
    7   HD12  LEU  90          HD12      LEU  90 -32.804 -11.978 -13.920
    8   HD11  LEU  90          HD13      LEU  90 -31.098 -11.554 -13.796
    9   HD23  LEU  90          HD21      LEU  90 -32.343 -14.100 -13.677
   10   HD22  LEU  90          HD22      LEU  90 -33.330 -14.237 -12.223
   11   HD21  LEU  90          HD23      LEU  90 -31.667 -14.823 -12.218

  No H/Q in entry =          11
  In of MODEL   36
    1    H    GLY  91           H        GLY  91 -29.618 -12.137  -8.799
    2    HA3  GLY  91           HA2      GLY  91 -31.982 -11.032  -7.809
    3    HA2  GLY  91           HA3      GLY  91 -30.589 -11.515  -6.841

  No H/Q in entry =           3
  In of MODEL   36
    1    H    VAL  92           H        VAL  92 -28.693  -9.683  -7.739
    2    HA   VAL  92           HA       VAL  92 -29.532  -7.351  -6.264
    3    HB   VAL  92           HB       VAL  92 -26.967  -7.826  -7.828
    4   HG12  VAL  92          HG11      VAL  92 -27.178  -5.876  -5.560
    5   HG11  VAL  92          HG12      VAL  92 -27.841  -5.389  -7.122
    6   HG13  VAL  92          HG13      VAL  92 -26.138  -5.826  -6.984
    7   HG22  VAL  92          HG21      VAL  92 -26.730  -9.362  -6.188
    8   HG21  VAL  92          HG22      VAL  92 -27.895  -8.569  -5.127
    9   HG23  VAL  92          HG23      VAL  92 -26.250  -7.945  -5.254

  No H/Q in entry =           9
  In of MODEL   36
    1    H    LEU  93           H        LEU  93 -29.090  -8.106  -9.661
    2    HA   LEU  93           HA       LEU  93 -29.471  -5.506 -10.670
    3    HB2  LEU  93           HB2      LEU  93 -28.790  -7.392 -12.072
    4    HB3  LEU  93           HB3      LEU  93 -30.370  -8.138 -11.837
    5    HG   LEU  93           HG       LEU  93 -31.406  -6.227 -13.027
    6   HD11  LEU  93          HD11      LEU  93 -29.584  -4.587 -12.558
    7   HD13  LEU  93          HD12      LEU  93 -30.011  -4.674 -14.268
    8   HD12  LEU  93          HD13      LEU  93 -28.550  -5.468 -13.682
    9   HD23  LEU  93          HD21      LEU  93 -30.342  -6.844 -15.289
   10   HD22  LEU  93          HD22      LEU  93 -31.169  -8.087 -14.351
   11   HD21  LEU  93          HD23      LEU  93 -29.407  -8.003 -14.345

  No H/Q in entry =          11
  In of MODEL   36
    1    H    LYS  94           H        LYS  94 -31.811  -8.065  -9.761
    2    HA   LYS  94           HA       LYS  94 -34.174  -6.679 -10.443
    3    HB2  LYS  94           HB2      LYS  94 -33.638  -8.796  -8.364
    4    HB3  LYS  94           HB3      LYS  94 -35.245  -8.135  -8.663
    5    HG2  LYS  94           HG2      LYS  94 -35.130  -8.977 -10.973
    6    HG3  LYS  94           HG3      LYS  94 -33.560  -9.693 -10.612
    7    HD2  LYS  94           HD2      LYS  94 -34.671 -10.990  -8.755
    8    HD3  LYS  94           HD3      LYS  94 -36.220 -10.384  -9.340
    9    HE2  LYS  94           HE2      LYS  94 -35.675 -11.372 -11.575
   10    HE3  LYS  94           HE3      LYS  94 -34.253 -12.110 -10.839
   11    HZ3  LYS  94           HZ1      LYS  94 -36.076 -13.666 -10.976
   12    HZ2  LYS  94           HZ2      LYS  94 -37.073 -12.628 -10.072
   13    HZ1  LYS  94           HZ3      LYS  94 -35.706 -13.334  -9.353

  No H/Q in entry =          13
  In of MODEL   36
    1    H    ALA  95           H        ALA  95 -32.369  -6.680  -7.381
    2    HA   ALA  95           HA       ALA  95 -34.254  -5.088  -5.961
    3    HB2  ALA  95           HB1      ALA  95 -31.860  -6.408  -5.368
    4    HB3  ALA  95           HB2      ALA  95 -32.861  -5.485  -4.248
    5    HB1  ALA  95           HB3      ALA  95 -31.520  -4.701  -5.083

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA  96           H        ALA  96 -31.612  -4.254  -8.065
    2    HA   ALA  96           HA       ALA  96 -31.564  -1.470  -7.372
    3    HB2  ALA  96           HB1      ALA  96 -30.191  -1.284  -9.479
    4    HB3  ALA  96           HB2      ALA  96 -30.467  -3.004  -9.749
    5    HB1  ALA  96           HB3      ALA  96 -29.570  -2.468  -8.330

  No H/Q in entry =           5
  In of MODEL   36
    1    H    VAL  97           H        VAL  97 -33.051  -3.286 -10.017
    2    HA   VAL  97           HA       VAL  97 -34.148  -1.041 -11.347
    3    HB   VAL  97           HB       VAL  97 -34.912  -3.979 -11.308
    4   HG11  VAL  97          HG11      VAL  97 -36.731  -2.015 -11.864
    5   HG13  VAL  97          HG12      VAL  97 -36.761  -3.630 -12.573
    6   HG12  VAL  97          HG13      VAL  97 -36.023  -2.294 -13.455
    7   HG21  VAL  97          HG21      VAL  97 -33.647  -2.191 -13.388
    8   HG23  VAL  97          HG22      VAL  97 -34.072  -3.886 -13.630
    9   HG22  VAL  97          HG23      VAL  97 -32.838  -3.446 -12.449

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ALA  98           H        ALA  98 -35.315  -3.162  -8.755
    2    HA   ALA  98           HA       ALA  98 -37.894  -2.042  -8.454
    3    HB1  ALA  98           HB1      ALA  98 -36.856  -4.195  -7.351
    4    HB3  ALA  98           HB2      ALA  98 -38.056  -3.262  -6.454
    5    HB2  ALA  98           HB3      ALA  98 -36.340  -3.077  -6.088

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA  99           H        ALA  99 -34.839  -1.151  -6.811
    2    HA   ALA  99           HA       ALA  99 -36.006   0.864  -5.215
    3    HB1  ALA  99           HB1      ALA  99 -33.341  -0.010  -5.919
    4    HB2  ALA  99           HB2      ALA  99 -33.912   0.775  -4.446
    5    HB3  ALA  99           HB3      ALA  99 -33.441   1.750  -5.839

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ILE 100           H        ILE 100 -34.945   0.912  -8.566
    2    HA   ILE 100           HA       ILE 100 -35.162   3.750  -8.868
    3    HB   ILE 100           HB       ILE 100 -35.214   1.533 -10.945
    4   HG12  ILE 100          HG12      ILE 100 -33.081   3.574 -10.318
    5   HG13  ILE 100          HG13      ILE 100 -33.100   1.945  -9.641
    6   HG21  ILE 100          HG21      ILE 100 -35.675   4.443 -11.162
    7   HG23  ILE 100          HG22      ILE 100 -36.156   3.135 -12.244
    8   HG22  ILE 100          HG23      ILE 100 -34.512   3.772 -12.307
    9   HD12  ILE 100          HD11      ILE 100 -32.562   2.830 -12.438
   10   HD11  ILE 100          HD12      ILE 100 -33.203   1.213 -12.141
   11   HD13  ILE 100          HD13      ILE 100 -31.668   1.699 -11.424

  No H/Q in entry =          11
  In of MODEL   36
    1    H    LYS 101           H        LYS 101 -37.416   1.090  -9.534
    2    HA   LYS 101           HA       LYS 101 -39.512   2.682 -10.593
    3    HB2  LYS 101           HB2      LYS 101 -39.366  -0.057  -9.386
    4    HB3  LYS 101           HB3      LYS 101 -40.926   0.674  -9.763
    5    HG2  LYS 101           HG2      LYS 101 -40.438   0.749 -12.060
    6    HG3  LYS 101           HG3      LYS 101 -38.739   0.374 -11.783
    7    HD2  LYS 101           HD2      LYS 101 -39.958  -1.575 -12.623
    8    HD3  LYS 101           HD3      LYS 101 -39.337  -1.851 -10.995
    9    HE2  LYS 101           HE2      LYS 101 -41.395  -2.558 -10.481
   10    HE3  LYS 101           HE3      LYS 101 -41.873  -0.862 -10.536
   11    HZ3  LYS 101           HZ1      LYS 101 -42.749  -1.091 -12.654
   12    HZ2  LYS 101           HZ2      LYS 101 -43.195  -2.549 -11.908
   13    HZ1  LYS 101           HZ3      LYS 101 -41.881  -2.514 -12.984

  No H/Q in entry =          13
  In of MODEL   36
    1    H    LYS 102           H        LYS 102 -39.022   1.303  -7.340
    2    HA   LYS 102           HA       LYS 102 -41.293   2.502  -6.191
    3    HB2  LYS 102           HB2      LYS 102 -40.039   0.681  -5.116
    4    HB3  LYS 102           HB3      LYS 102 -38.664   1.762  -4.894
    5    HG2  LYS 102           HG2      LYS 102 -40.009   3.179  -3.446
    6    HG3  LYS 102           HG3      LYS 102 -41.387   2.104  -3.670
    7    HD2  LYS 102           HD2      LYS 102 -40.144   0.284  -2.584
    8    HD3  LYS 102           HD3      LYS 102 -38.766   1.362  -2.358
    9    HE2  LYS 102           HE2      LYS 102 -40.150   2.860  -0.999
   10    HE3  LYS 102           HE3      LYS 102 -41.545   1.812  -1.248
   11    HZ1  LYS 102           HZ1      LYS 102 -39.808   0.110  -0.185
   12    HZ3  LYS 102           HZ2      LYS 102 -40.936   1.006   0.713
   13    HZ2  LYS 102           HZ3      LYS 102 -39.333   1.549   0.582

  No H/Q in entry =          13
  In of MODEL   36
    1    H    ALA 103           H        ALA 103 -38.350   3.904  -7.224
    2    HA   ALA 103           HA       ALA 103 -38.616   6.263  -5.509
    3    HB2  ALA 103           HB1      ALA 103 -36.624   6.980  -7.092
    4    HB3  ALA 103           HB2      ALA 103 -36.563   5.252  -7.442
    5    HB1  ALA 103           HB3      ALA 103 -36.355   5.826  -5.787

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA 104           H        ALA 104 -39.204   5.431  -8.838
    2    HA   ALA 104           HA       ALA 104 -39.821   8.190  -9.542
    3    HB2  ALA 104           HB1      ALA 104 -39.840   7.459 -11.724
    4    HB1  ALA 104           HB2      ALA 104 -40.549   5.899 -11.307
    5    HB3  ALA 104           HB3      ALA 104 -38.833   6.193 -11.024

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA 105           H        ALA 105 -41.415   6.114  -7.690
    2    HA   ALA 105           HA       ALA 105 -43.857   7.476  -7.718
    3    HB2  ALA 105           HB1      ALA 105 -44.576   6.550  -9.736
    4    HB3  ALA 105           HB2      ALA 105 -45.205   5.385  -8.572
    5    HB1  ALA 105           HB3      ALA 105 -43.725   5.031  -9.460

  No H/Q in entry =           5
  In of MODEL   37
    1    H1   ALA   1           H3       ALA   1 -12.425 -15.511  -2.225
    2    H2   ALA   1           H2       ALA   1 -11.502 -16.661  -3.075
    3    H3   ALA   1           H1       ALA   1 -12.645 -15.703  -3.897
    4    HA   ALA   1           HA       ALA   1 -14.057 -17.391  -3.647
    5    HB3  ALA   1           HB1      ALA   1 -12.675 -19.177  -3.201
    6    HB1  ALA   1           HB2      ALA   1 -13.415 -19.059  -1.604
    7    HB2  ALA   1           HB3      ALA   1 -11.835 -18.334  -1.899

  No H/Q in entry =           7
  In of MODEL   37
    1    H    GLU   2           H        GLU   2 -15.674 -18.232  -1.979
    2    HA   GLU   2           HA       GLU   2 -17.295 -16.497  -0.903
    3    HB2  GLU   2           HB2      GLU   2 -16.365 -18.934   0.630
    4    HB3  GLU   2           HB3      GLU   2 -17.878 -18.069   0.899
    5    HG2  GLU   2           HG2      GLU   2 -18.885 -19.143  -0.828
    6    HG3  GLU   2           HG3      GLU   2 -17.568 -18.754  -1.924

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLU   3           H        GLU   3 -15.372 -17.873   1.701
    2    HA   GLU   3           HA       GLU   3 -15.556 -15.520   3.264
    3    HB2  GLU   3           HB2      GLU   3 -13.993 -18.083   3.496
    4    HB3  GLU   3           HB3      GLU   3 -13.739 -16.767   4.642
    5    HG2  GLU   3           HG2      GLU   3 -15.926 -16.898   5.481
    6    HG3  GLU   3           HG3      GLU   3 -16.542 -17.690   4.036

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LEU   4           H        LEU   4 -12.629 -17.026   1.843
    2    HA   LEU   4           HA       LEU   4 -10.770 -15.141   2.428
    3    HB2  LEU   4           HB2      LEU   4 -11.039 -16.432  -0.297
    4    HB3  LEU   4           HB3      LEU   4  -9.573 -15.728   0.376
    5    HG   LEU   4           HG       LEU   4 -11.081 -18.111   1.498
    6   HD13  LEU   4          HD11      LEU   4  -9.471 -19.482   0.552
    7   HD12  LEU   4          HD12      LEU   4  -8.248 -18.211   0.516
    8   HD11  LEU   4          HD13      LEU   4  -9.548 -18.218  -0.674
    9   HD23  LEU   4          HD21      LEU   4  -8.818 -18.200   2.860
   10   HD22  LEU   4          HD22      LEU   4 -10.124 -17.148   3.402
   11   HD21  LEU   4          HD23      LEU   4  -8.763 -16.471   2.508

  No H/Q in entry =          11
  In of MODEL   37
    1    H    GLU   5           H        GLU   5 -13.127 -14.907  -0.225
    2    HA   GLU   5           HA       GLU   5 -12.108 -12.432  -1.231
    3    HB2  GLU   5           HB2      GLU   5 -13.481 -14.002  -2.584
    4    HB3  GLU   5           HB3      GLU   5 -14.869 -13.629  -1.560
    5    HG2  GLU   5           HG2      GLU   5 -14.732 -11.263  -2.199
    6    HG3  GLU   5           HG3      GLU   5 -13.313 -11.601  -3.190

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLU   6           H        GLU   6 -14.823 -13.286   0.885
    2    HA   GLU   6           HA       GLU   6 -15.697 -10.601   1.296
    3    HB2  GLU   6           HB2      GLU   6 -16.129 -13.149   2.869
    4    HB3  GLU   6           HB3      GLU   6 -16.892 -11.613   3.278
    5    HG2  GLU   6           HG2      GLU   6 -17.961 -11.520   1.082
    6    HG3  GLU   6           HG3      GLU   6 -17.142 -13.003   0.595

  No H/Q in entry =           6
  In of MODEL   37
    1    H    VAL   7           H        VAL   7 -13.397 -12.738   2.844
    2    HA   VAL   7           HA       VAL   7 -12.894 -11.171   5.169
    3    HB   VAL   7           HB       VAL   7 -11.224 -13.229   3.701
    4   HG11  VAL   7          HG11      VAL   7 -10.717 -11.705   6.263
    5   HG13  VAL   7          HG12      VAL   7  -9.632 -11.929   4.892
    6   HG12  VAL   7          HG13      VAL   7  -9.989 -13.283   5.963
    7   HG21  VAL   7          HG21      VAL   7 -13.469 -13.773   4.940
    8   HG23  VAL   7          HG22      VAL   7 -12.526 -13.511   6.408
    9   HG22  VAL   7          HG23      VAL   7 -12.056 -14.774   5.272

  No H/Q in entry =           9
  In of MODEL   37
    1    H    VAL   8           H        VAL   8 -11.413 -11.296   1.945
    2    HA   VAL   8           HA       VAL   8  -9.327  -9.445   2.423
    3    HB   VAL   8           HB       VAL   8 -10.804 -10.245  -0.086
    4   HG12  VAL   8          HG11      VAL   8  -8.861  -9.024  -1.240
    5   HG11  VAL   8          HG12      VAL   8  -8.598  -8.211   0.304
    6   HG13  VAL   8          HG13      VAL   8 -10.130  -8.011  -0.548
    7   HG21  VAL   8          HG21      VAL   8  -8.539 -11.268   1.428
    8   HG23  VAL   8          HG22      VAL   8  -8.014 -10.785  -0.182
    9   HG22  VAL   8          HG23      VAL   8  -9.308 -11.965   0.001

  No H/Q in entry =           9
  In of MODEL   37
    1    H    MET   9           H        MET   9 -12.678  -9.019   1.293
    2    HA   MET   9           HA       MET   9 -12.591  -6.243   0.862
    3    HB2  MET   9           HB2      MET   9 -14.820  -8.090   1.719
    4    HB3  MET   9           HB3      MET   9 -15.079  -6.360   1.483
    5    HG2  MET   9           HG2      MET   9 -14.292  -6.527  -0.829
    6    HG3  MET   9           HG3      MET   9 -13.945  -8.241  -0.605
    7    HE2  MET   9           HE1      MET   9 -16.687  -5.751  -1.857
    8    HE1  MET   9           HE2      MET   9 -16.445  -5.511  -0.130
    9    HE3  MET   9           HE3      MET   9 -17.988  -6.121  -0.718

  No H/Q in entry =           9
  In of MODEL   37
    1    H    GLY  10           H        GLY  10 -13.246  -8.132   3.792
    2    HA3  GLY  10           HA2      GLY  10 -13.758  -5.945   5.519
    3    HA2  GLY  10           HA3      GLY  10 -13.205  -7.540   6.025

  No H/Q in entry =           3
  In of MODEL   37
    1    H    LEU  11           H        LEU  11 -10.772  -7.686   4.689
    2    HA   LEU  11           HA       LEU  11  -9.042  -6.271   6.432
    3    HB2  LEU  11           HB2      LEU  11  -8.532  -7.696   3.818
    4    HB3  LEU  11           HB3      LEU  11  -7.247  -7.005   4.806
    5    HG   LEU  11           HG       LEU  11  -9.259  -9.021   5.838
    6   HD13  LEU  11          HD11      LEU  11  -8.063 -10.267   4.261
    7   HD12  LEU  11          HD12      LEU  11  -7.118 -10.516   5.727
    8   HD11  LEU  11          HD13      LEU  11  -6.577  -9.355   4.517
    9   HD22  LEU  11          HD21      LEU  11  -8.380  -8.019   7.748
   10   HD21  LEU  11          HD22      LEU  11  -6.845  -7.631   6.972
   11   HD23  LEU  11          HD23      LEU  11  -7.182  -9.285   7.482

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  12           H        ILE  12  -9.969  -5.711   3.052
    2    HA   ILE  12           HA       ILE  12  -8.260  -3.496   2.613
    3    HB   ILE  12           HB       ILE  12 -10.934  -4.131   1.340
    4   HG12  ILE  12          HG12      ILE  12  -8.917  -5.814   1.255
    5   HG13  ILE  12          HG13      ILE  12  -9.797  -5.456  -0.217
    6   HG21  ILE  12          HG21      ILE  12  -8.684  -2.272   0.506
    7   HG23  ILE  12          HG22      ILE  12 -10.347  -1.824   0.867
    8   HG22  ILE  12          HG23      ILE  12  -9.975  -2.777  -0.541
    9   HD11  ILE  12          HD11      ILE  12  -7.242  -4.071   0.642
   10   HD13  ILE  12          HD12      ILE  12  -8.067  -3.907  -0.907
   11   HD12  ILE  12          HD13      ILE  12  -7.304  -5.420  -0.477

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  13           H        ILE  13 -11.614  -3.734   3.736
    2    HA   ILE  13           HA       ILE  13 -12.046  -0.943   4.013
    3    HB   ILE  13           HB       ILE  13 -13.261  -3.357   5.376
    4   HG12  ILE  13          HG12      ILE  13 -13.517  -2.840   2.856
    5   HG13  ILE  13          HG13      ILE  13 -14.958  -3.210   3.778
    6   HG23  ILE  13          HG21      ILE  13 -13.683  -1.640   6.942
    7   HG22  ILE  13          HG22      ILE  13 -15.141  -1.668   5.959
    8   HG21  ILE  13          HG23      ILE  13 -13.924  -0.424   5.691
    9   HD11  ILE  13          HD11      ILE  13 -14.169  -0.342   3.634
   10   HD13  ILE  13          HD12      ILE  13 -15.758  -1.080   3.661
   11   HD12  ILE  13          HD13      ILE  13 -14.835  -1.083   2.175

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ASN  14           H        ASN  14 -10.937  -3.447   6.275
    2    HA   ASN  14           HA       ASN  14 -10.702  -1.814   8.561
    3    HB2  ASN  14           HB2      ASN  14 -10.474  -4.423   8.233
    4    HB3  ASN  14           HB3      ASN  14  -8.764  -4.050   8.061
    5   HD21  ASN  14          HD21      ASN  14  -9.394  -5.572  10.241
    6   HD22  ASN  14          HD22      ASN  14  -9.346  -4.654  11.666

  No H/Q in entry =           6
  In of MODEL   37
    1    H    SER  15           H        SER  15  -8.329  -2.654   6.047
    2    HA   SER  15           HA       SER  15  -6.164  -1.180   7.102
    3    HB2  SER  15           HB2      SER  15  -5.164  -1.402   4.935
    4    HB3  SER  15           HB3      SER  15  -6.129  -2.854   5.166
    5    HG   SER  15           HG       SER  15  -7.258  -2.279   3.508

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLY  16           H        GLY  16  -8.777  -0.290   4.879
    2    HA3  GLY  16           HA2      GLY  16  -7.903   2.345   4.323
    3    HA2  GLY  16           HA3      GLY  16  -9.560   1.763   4.175

  No H/Q in entry =           3
  In of MODEL   37
    1    H    GLN  17           H        GLN  17 -10.086   1.039   6.828
    2    HA   GLN  17           HA       GLN  17 -10.764   3.548   7.978
    3    HB2  GLN  17           HB2      GLN  17 -11.998   1.456   8.465
    4    HB3  GLN  17           HB3      GLN  17 -10.592   0.845   9.338
    5    HG2  GLN  17           HG2      GLN  17 -12.174   1.808  10.930
    6    HG3  GLN  17           HG3      GLN  17 -10.728   2.812  10.863
    7   HE21  GLN  17          HE21      GLN  17 -11.705   4.845  11.353
    8   HE22  GLN  17          HE22      GLN  17 -12.877   5.567  10.360

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ALA  18           H        ALA  18  -8.147   1.246   8.572
    2    HA   ALA  18           HA       ALA  18  -7.021   2.451  10.835
    3    HB2  ALA  18           HB1      ALA  18  -6.439   0.232   9.459
    4    HB3  ALA  18           HB2      ALA  18  -5.261   1.005  10.521
    5    HB1  ALA  18           HB3      ALA  18  -5.197   1.286   8.780

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ARG  19           H        ARG  19  -6.275   2.973   7.380
    2    HA   ARG  19           HA       ARG  19  -4.359   5.007   7.795
    3    HB2  ARG  19           HB2      ARG  19  -4.713   3.871   5.601
    4    HB3  ARG  19           HB3      ARG  19  -6.251   4.723   5.438
    5    HG2  ARG  19           HG2      ARG  19  -5.107   6.886   5.500
    6    HG3  ARG  19           HG3      ARG  19  -3.561   6.090   5.790
    7    HD2  ARG  19           HD2      ARG  19  -3.702   6.684   3.448
    8    HD3  ARG  19           HD3      ARG  19  -3.798   4.924   3.592
    9    HE   ARG  19           HE       ARG  19  -6.425   5.851   3.609
   10   HH21  ARG  19          HH11      ARG  19  -7.635   6.018   1.701
   11   HH22  ARG  19          HH12      ARG  19  -6.826   6.092   0.174
   12   HH11  ARG  19          HH21      ARG  19  -3.667   5.898   1.551
   13   HH12  ARG  19          HH22      ARG  19  -4.578   6.021   0.090

  No H/Q in entry =          13
  In of MODEL   37
    1    H    SER  20           H        SER  20  -7.861   5.146   7.225
    2    HA   SER  20           HA       SER  20  -8.201   7.904   7.182
    3    HB2  SER  20           HB2      SER  20  -9.941   6.030   6.830
    4    HB3  SER  20           HB3      SER  20 -10.145   6.082   8.579
    5    HG   SER  20           HG       SER  20 -10.768   8.203   8.426

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU  21           H        LEU  21  -8.191   5.718   9.984
    2    HA   LEU  21           HA       LEU  21  -8.603   7.714  11.955
    3    HB2  LEU  21           HB2      LEU  21  -7.264   5.006  12.102
    4    HB3  LEU  21           HB3      LEU  21  -7.559   6.022  13.509
    5    HG   LEU  21           HG       LEU  21  -9.753   5.156  11.603
    6   HD12  LEU  21          HD11      LEU  21  -8.976   3.928  14.266
    7   HD11  LEU  21          HD12      LEU  21  -8.670   3.197  12.689
    8   HD13  LEU  21          HD13      LEU  21 -10.329   3.437  13.244
    9   HD22  LEU  21          HD21      LEU  21 -10.619   6.965  12.812
   10   HD21  LEU  21          HD22      LEU  21  -9.657   6.618  14.246
   11   HD23  LEU  21          HD23      LEU  21 -11.060   5.628  13.870

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ALA  22           H        ALA  22  -5.671   6.325  10.521
    2    HA   ALA  22           HA       ALA  22  -3.770   7.625  12.129
    3    HB2  ALA  22           HB1      ALA  22  -3.379   5.771  10.432
    4    HB1  ALA  22           HB2      ALA  22  -2.175   7.059  10.459
    5    HB3  ALA  22           HB3      ALA  22  -3.404   7.024   9.193

  No H/Q in entry =           5
  In of MODEL   37
    1    H    TYR  23           H        TYR  23  -5.107   8.653   8.958
    2    HA   TYR  23           HA       TYR  23  -3.757  11.141   8.880
    3    HB2  TYR  23           HB2      TYR  23  -4.860  10.239   6.896
    4    HB3  TYR  23           HB3      TYR  23  -6.431  10.354   7.690
    5    HD1  TYR  23           HD1      TYR  23  -3.528  12.378   6.509
    6    HD2  TYR  23           HD2      TYR  23  -7.656  12.375   7.693
    7    HE1  TYR  23           HE1      TYR  23  -3.746  14.730   5.753
    8    HE2  TYR  23           HE2      TYR  23  -7.874  14.726   6.936
    9    HH   TYR  23           HH       TYR  23  -5.699  16.225   4.948

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ALA  24           H        ALA  24  -6.871  10.181  10.284
    2    HA   ALA  24           HA       ALA  24  -7.686  12.775  11.064
    3    HB1  ALA  24           HB1      ALA  24  -9.508  11.534  11.546
    4    HB2  ALA  24           HB2      ALA  24  -8.673  10.956  12.986
    5    HB3  ALA  24           HB3      ALA  24  -8.566  10.045  11.481

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA  25           H        ALA  25  -5.685  10.303  12.620
    2    HA   ALA  25           HA       ALA  25  -5.320  11.551  15.120
    3    HB2  ALA  25           HB1      ALA  25  -4.573   9.195  14.290
    4    HB3  ALA  25           HB2      ALA  25  -3.543  10.046  15.444
    5    HB1  ALA  25           HB3      ALA  25  -3.122  10.029  13.731

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU  26           H        LEU  26  -3.552  11.843  12.065
    2    HA   LEU  26           HA       LEU  26  -1.575  13.650  12.967
    3    HB2  LEU  26           HB2      LEU  26  -1.298  12.499  10.860
    4    HB3  LEU  26           HB3      LEU  26  -2.772  13.216  10.218
    5    HG   LEU  26           HG       LEU  26  -1.743  15.460  10.348
    6   HD12  LEU  26          HD11      LEU  26   0.799  15.464  10.741
    7   HD11  LEU  26          HD12      LEU  26   0.572  13.884  11.485
    8   HD13  LEU  26          HD13      LEU  26  -0.222  15.303  12.170
    9   HD21  LEU  26          HD21      LEU  26  -0.024  13.397   8.936
   10   HD23  LEU  26          HD22      LEU  26  -0.060  15.119   8.568
   11   HD22  LEU  26          HD23      LEU  26  -1.491  14.130   8.290

  No H/Q in entry =          11
  In of MODEL   37
    1    H    LYS  27           H        LYS  27  -4.766  14.154  11.517
    2    HA   LYS  27           HA       LYS  27  -4.696  16.942  11.321
    3    HB2  LYS  27           HB2      LYS  27  -6.457  15.477  10.348
    4    HB3  LYS  27           HB3      LYS  27  -7.102  15.222  11.969
    5    HG2  LYS  27           HG2      LYS  27  -7.514  17.631  12.211
    6    HG3  LYS  27           HG3      LYS  27  -6.817  17.925  10.615
    7    HD2  LYS  27           HD2      LYS  27  -8.567  16.503   9.591
    8    HD3  LYS  27           HD3      LYS  27  -9.270  16.226  11.187
    9    HE2  LYS  27           HE2      LYS  27  -9.695  18.639  11.436
   10    HE3  LYS  27           HE3      LYS  27  -8.964  18.938   9.855
   11    HZ3  LYS  27           HZ1      LYS  27 -11.344  18.828   9.633
   12    HZ2  LYS  27           HZ2      LYS  27 -11.396  17.311  10.401
   13    HZ1  LYS  27           HZ3      LYS  27 -10.662  17.472   8.874

  No H/Q in entry =          13
  In of MODEL   37
    1    H    GLN  28           H        GLN  28  -5.575  14.859  14.053
    2    HA   GLN  28           HA       GLN  28  -6.443  16.866  15.839
    3    HB2  GLN  28           HB2      GLN  28  -5.056  14.224  16.363
    4    HB3  GLN  28           HB3      GLN  28  -5.773  15.233  17.621
    5    HG2  GLN  28           HG2      GLN  28  -7.276  14.135  15.228
    6    HG3  GLN  28           HG3      GLN  28  -7.317  13.435  16.847
    7   HE21  GLN  28          HE21      GLN  28  -9.162  15.315  14.897
    8   HE22  GLN  28          HE22      GLN  28  -9.902  16.312  16.053

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ALA  29           H        ALA  29  -3.239  15.548  15.121
    2    HA   ALA  29           HA       ALA  29  -1.774  16.933  17.089
    3    HB1  ALA  29           HB1      ALA  29   0.142  16.229  15.953
    4    HB3  ALA  29           HB2      ALA  29  -0.625  16.361  14.371
    5    HB2  ALA  29           HB3      ALA  29  -1.048  15.030  15.447

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LYS  30           H        LYS  30  -2.653  17.823  13.768
    2    HA   LYS  30           HA       LYS  30  -1.223  20.251  13.658
    3    HB2  LYS  30           HB2      LYS  30  -3.773  19.401  12.270
    4    HB3  LYS  30           HB3      LYS  30  -2.929  20.909  11.921
    5    HG2  LYS  30           HG2      LYS  30  -0.875  19.598  11.388
    6    HG3  LYS  30           HG3      LYS  30  -1.793  18.110  11.639
    7    HD2  LYS  30           HD2      LYS  30  -3.366  18.767   9.858
    8    HD3  LYS  30           HD3      LYS  30  -2.471  20.267   9.610
    9    HE2  LYS  30           HE2      LYS  30  -0.456  18.956   9.011
   10    HE3  LYS  30           HE3      LYS  30  -1.370  17.461   9.229
   11    HZ2  LYS  30           HZ1      LYS  30  -1.205  18.333   6.887
   12    HZ1  LYS  30           HZ2      LYS  30  -2.233  19.605   7.365
   13    HZ3  LYS  30           HZ3      LYS  30  -2.772  17.993   7.439

  No H/Q in entry =          13
  In of MODEL   37
    1    H    GLN  31           H        GLN  31  -4.319  19.427  15.096
    2    HA   GLN  31           HA       GLN  31  -5.051  22.191  15.558
    3    HB2  GLN  31           HB2      GLN  31  -6.244  19.754  16.887
    4    HB3  GLN  31           HB3      GLN  31  -6.990  21.334  16.650
    5    HG2  GLN  31           HG2      GLN  31  -6.310  20.553  14.054
    6    HG3  GLN  31           HG3      GLN  31  -6.843  19.053  14.803
    7   HE21  GLN  31          HE21      GLN  31  -8.255  20.644  12.716
    8   HE22  GLN  31          HE22      GLN  31  -9.759  21.050  13.387

  No H/Q in entry =           8
  In of MODEL   37
    1    H    GLY  32           H        GLY  32  -2.748  20.238  16.855
    2    HA3  GLY  32           HA2      GLY  32  -1.327  20.683  18.646
    3    HA2  GLY  32           HA3      GLY  32  -2.439  21.937  19.181

  No H/Q in entry =           3
  In of MODEL   37
    1    H    ASP  33           H        ASP  33  -3.899  18.913  18.527
    2    HA   ASP  33           HA       ASP  33  -4.289  18.455  21.410
    3    HB2  ASP  33           HB2      ASP  33  -5.727  17.463  18.943
    4    HB3  ASP  33           HB3      ASP  33  -6.065  16.854  20.562

  No H/Q in entry =           4
  In of MODEL   37
    1    H    PHE  34           H        PHE  34  -2.127  17.581  21.695
    2    HA   PHE  34           HA       PHE  34  -1.163  15.324  20.282
    3    HB2  PHE  34           HB2      PHE  34  -0.511  16.297  23.073
    4    HB3  PHE  34           HB3      PHE  34   0.397  15.066  22.195
    5    HD1  PHE  34           HD1      PHE  34   0.268  18.492  22.937
    6    HD2  PHE  34           HD2      PHE  34   1.040  15.785  19.691
    7    HE1  PHE  34           HE1      PHE  34   1.572  20.251  21.775
    8    HE2  PHE  34           HE2      PHE  34   2.340  17.547  18.534
    9    HZ   PHE  34           HZ       PHE  34   2.607  19.777  19.580

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ALA  35           H        ALA  35  -3.175  15.618  23.163
    2    HA   ALA  35           HA       ALA  35  -2.983  12.952  24.054
    3    HB3  ALA  35           HB1      ALA  35  -5.427  13.603  24.934
    4    HB1  ALA  35           HB2      ALA  35  -4.880  15.216  24.476
    5    HB2  ALA  35           HB3      ALA  35  -3.966  14.281  25.657

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA  36           H        ALA  36  -5.435  14.499  21.978
    2    HA   ALA  36           HA       ALA  36  -6.881  12.103  21.509
    3    HB1  ALA  36           HB1      ALA  36  -8.329  13.543  20.568
    4    HB3  ALA  36           HB2      ALA  36  -7.163  13.953  19.309
    5    HB2  ALA  36           HB3      ALA  36  -7.165  14.838  20.835

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA  37           H        ALA  37  -4.198  13.665  19.819
    2    HA   ALA  37           HA       ALA  37  -4.201  12.033  17.519
    3    HB3  ALA  37           HB1      ALA  37  -2.178  13.721  18.927
    4    HB2  ALA  37           HB2      ALA  37  -2.722  13.785  17.252
    5    HB1  ALA  37           HB3      ALA  37  -1.577  12.542  17.761

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LYS  38           H        LYS  38  -2.420  11.703  20.581
    2    HA   LYS  38           HA       LYS  38  -1.125   9.289  20.077
    3    HB2  LYS  38           HB2      LYS  38  -1.410  11.052  22.228
    4    HB3  LYS  38           HB3      LYS  38  -2.040   9.528  22.847
    5    HG2  LYS  38           HG2      LYS  38   0.037   8.386  22.290
    6    HG3  LYS  38           HG3      LYS  38   0.654   9.826  21.474
    7    HD2  LYS  38           HD2      LYS  38   0.854  11.039  23.509
    8    HD3  LYS  38           HD3      LYS  38  -0.170   9.898  24.383
    9    HE2  LYS  38           HE2      LYS  38   2.187   9.556  24.981
   10    HE3  LYS  38           HE3      LYS  38   1.560   8.148  24.120
   11    HZ3  LYS  38           HZ1      LYS  38   2.850   8.556  22.328
   12    HZ2  LYS  38           HZ2      LYS  38   3.824   9.372  23.458
   13    HZ1  LYS  38           HZ3      LYS  38   2.745  10.245  22.477

  No H/Q in entry =          13
  In of MODEL   37
    1    H    ALA  39           H        ALA  39  -4.346   9.817  21.509
    2    HA   ALA  39           HA       ALA  39  -4.931   7.103  22.013
    3    HB3  ALA  39           HB1      ALA  39  -7.075   9.071  21.268
    4    HB2  ALA  39           HB2      ALA  39  -6.162   9.286  22.762
    5    HB1  ALA  39           HB3      ALA  39  -7.096   7.812  22.504

  No H/Q in entry =           5
  In of MODEL   37
    1    H    MET  40           H        MET  40  -5.519   9.127  19.175
    2    HA   MET  40           HA       MET  40  -7.028   7.213  17.725
    3    HB2  MET  40           HB2      MET  40  -5.401   9.593  16.810
    4    HB3  MET  40           HB3      MET  40  -6.447   8.647  15.747
    5    HG2  MET  40           HG2      MET  40  -7.445   9.902  18.317
    6    HG3  MET  40           HG3      MET  40  -7.508  10.740  16.768
    7    HE3  MET  40           HE1      MET  40 -10.126   9.152  14.724
    8    HE2  MET  40           HE2      MET  40  -8.374   9.251  14.560
    9    HE1  MET  40           HE3      MET  40  -9.271  10.624  15.204

  No H/Q in entry =           9
  In of MODEL   37
    1    H    MET  41           H        MET  41  -3.529   7.914  17.818
    2    HA   MET  41           HA       MET  41  -2.807   6.156  15.708
    3    HB2  MET  41           HB2      MET  41  -1.162   6.801  18.168
    4    HB3  MET  41           HB3      MET  41  -0.565   6.149  16.646
    5    HG2  MET  41           HG2      MET  41  -1.707   8.346  15.656
    6    HG3  MET  41           HG3      MET  41  -1.451   8.928  17.299
    7    HE2  MET  41           HE1      MET  41   1.449   6.799  17.632
    8    HE1  MET  41           HE2      MET  41   0.681   8.099  18.539
    9    HE3  MET  41           HE3      MET  41   2.301   8.328  17.882

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ASP  42           H        ASP  42  -3.166   5.680  19.196
    2    HA   ASP  42           HA       ASP  42  -2.155   3.075  19.343
    3    HB2  ASP  42           HB2      ASP  42  -2.996   4.840  21.176
    4    HB3  ASP  42           HB3      ASP  42  -4.433   3.829  21.114

  No H/Q in entry =           4
  In of MODEL   37
    1    H    GLN  43           H        GLN  43  -5.482   4.213  18.874
    2    HA   GLN  43           HA       GLN  43  -6.653   1.638  18.684
    3    HB2  GLN  43           HB2      GLN  43  -7.559   4.301  17.568
    4    HB3  GLN  43           HB3      GLN  43  -8.537   2.832  17.551
    5    HG2  GLN  43           HG2      GLN  43  -8.223   2.703  20.056
    6    HG3  GLN  43           HG3      GLN  43  -7.483   4.301  19.981
    7   HE21  GLN  43          HE21      GLN  43  -9.649   4.399  21.501
    8   HE22  GLN  43          HE22      GLN  43 -11.011   4.990  20.682

  No H/Q in entry =           8
  In of MODEL   37
    1    H    SER  44           H        SER  44  -5.311   3.843  16.265
    2    HA   SER  44           HA       SER  44  -6.047   2.370  13.979
    3    HB2  SER  44           HB2      SER  44  -4.763   4.740  14.416
    4    HB3  SER  44           HB3      SER  44  -3.424   3.732  13.873
    5    HG   SER  44           HG       SER  44  -4.541   4.718  12.121

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ARG  45           H        ARG  45  -3.153   2.225  16.034
    2    HA   ARG  45           HA       ARG  45  -1.704   0.258  14.636
    3    HB2  ARG  45           HB2      ARG  45  -0.832   1.668  16.500
    4    HB3  ARG  45           HB3      ARG  45  -1.823   0.745  17.627
    5    HG2  ARG  45           HG2      ARG  45  -0.618  -1.325  16.970
    6    HG3  ARG  45           HG3      ARG  45   0.398  -0.378  15.885
    7    HD2  ARG  45           HD2      ARG  45   1.163   0.992  17.837
    8    HD3  ARG  45           HD3      ARG  45   0.239  -0.076  18.917
    9    HE   ARG  45           HE       ARG  45   1.909  -1.685  17.319
   10   HH21  ARG  45          HH11      ARG  45   3.808  -2.529  18.138
   11   HH22  ARG  45          HH12      ARG  45   4.600  -1.753  19.464
   12   HH11  ARG  45          HH21      ARG  45   2.257   0.773  19.711
   13   HH12  ARG  45          HH22      ARG  45   3.721   0.119  20.352

  No H/Q in entry =          13
  In of MODEL   37
    1    H    MET  46           H        MET  46  -4.082  -0.043  17.256
    2    HA   MET  46           HA       MET  46  -3.940  -2.845  17.556
    3    HB2  MET  46           HB2      MET  46  -6.083  -0.817  18.179
    4    HB3  MET  46           HB3      MET  46  -6.307  -2.535  18.516
    5    HG2  MET  46           HG2      MET  46  -4.308  -2.557  19.921
    6    HG3  MET  46           HG3      MET  46  -3.979  -0.876  19.528
    7    HE2  MET  46           HE1      MET  46  -6.874  -2.868  22.249
    8    HE1  MET  46           HE2      MET  46  -6.304  -3.401  20.671
    9    HE3  MET  46           HE3      MET  46  -7.786  -2.458  20.791

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ALA  47           H        ALA  47  -5.957  -0.803  15.482
    2    HA   ALA  47           HA       ALA  47  -7.605  -2.835  14.426
    3    HB3  ALA  47           HB1      ALA  47  -8.265  -0.589  14.020
    4    HB1  ALA  47           HB2      ALA  47  -7.796  -1.225  12.443
    5    HB2  ALA  47           HB3      ALA  47  -6.697  -0.169  13.333

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU  48           H        LEU  48  -4.481  -1.557  13.352
    2    HA   LEU  48           HA       LEU  48  -4.237  -3.145  11.005
    3    HB2  LEU  48           HB2      LEU  48  -2.151  -1.893  12.799
    4    HB3  LEU  48           HB3      LEU  48  -1.803  -2.614  11.228
    5    HG   LEU  48           HG       LEU  48  -3.798  -0.376  11.638
    6   HD13  LEU  48          HD11      LEU  48  -1.662   0.475  12.288
    7   HD12  LEU  48          HD12      LEU  48  -1.944   1.036  10.640
    8   HD11  LEU  48          HD13      LEU  48  -0.859  -0.324  10.936
    9   HD22  LEU  48          HD21      LEU  48  -4.298  -1.351   9.564
   10   HD21  LEU  48          HD22      LEU  48  -2.623  -1.804   9.254
   11   HD23  LEU  48          HD23      LEU  48  -3.124  -0.119   9.103

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ASN  49           H        ASN  49  -3.169  -3.561  14.342
    2    HA   ASN  49           HA       ASN  49  -1.595  -5.842  13.993
    3    HB2  ASN  49           HB2      ASN  49  -1.609  -4.492  16.044
    4    HB3  ASN  49           HB3      ASN  49  -3.256  -5.003  16.387
    5   HD21  ASN  49          HD21      ASN  49  -2.593  -6.019  18.397
    6   HD22  ASN  49          HD22      ASN  49  -1.715  -7.472  18.403

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLU  50           H        GLU  50  -5.054  -5.527  14.694
    2    HA   GLU  50           HA       GLU  50  -5.599  -8.321  14.801
    3    HB2  GLU  50           HB2      GLU  50  -7.157  -6.617  15.694
    4    HB3  GLU  50           HB3      GLU  50  -7.457  -6.045  14.051
    5    HG2  GLU  50           HG2      GLU  50  -8.354  -8.230  13.415
    6    HG3  GLU  50           HG3      GLU  50  -7.967  -8.881  15.004

  No H/Q in entry =           6
  In of MODEL   37
    1    H    ALA  51           H        ALA  51  -5.659  -5.916  12.211
    2    HA   ALA  51           HA       ALA  51  -6.682  -7.627  10.193
    3    HB2  ALA  51           HB1      ALA  51  -6.451  -5.815   8.826
    4    HB1  ALA  51           HB2      ALA  51  -4.803  -5.487   9.362
    5    HB3  ALA  51           HB3      ALA  51  -6.172  -4.961  10.343

  No H/Q in entry =           5
  In of MODEL   37
    1    H    HIS  52           H        HIS  52  -3.372  -6.764  11.152
    2    HA   HIS  52           HA       HIS  52  -2.008  -8.266   9.188
    3    HB2  HIS  52           HB2      HIS  52  -0.954  -6.543  10.640
    4    HB3  HIS  52           HB3      HIS  52  -1.101  -7.643  12.009
    5    HD1  HIS  52           HD1      HIS  52   0.376  -9.807  11.977
    6    HD2  HIS  52           HD2      HIS  52   1.110  -7.190   8.815
    7    HE1  HIS  52           HE1      HIS  52   2.549 -10.557  10.915
    8    HE2  HIS  52           HE2      HIS  52   3.011  -8.973   8.986

  No H/Q in entry =           8
  In of MODEL   37
    1    H    LEU  53           H        LEU  53  -3.205  -9.135  12.408
    2    HA   LEU  53           HA       LEU  53  -2.039 -11.695  12.587
    3    HB2  LEU  53           HB2      LEU  53  -4.498 -10.484  13.824
    4    HB3  LEU  53           HB3      LEU  53  -4.060 -12.166  14.109
    5    HG   LEU  53           HG       LEU  53  -2.120  -9.879  14.571
    6   HD12  LEU  53          HD11      LEU  53  -2.708 -10.279  17.022
    7   HD11  LEU  53          HD12      LEU  53  -4.122 -11.157  16.442
    8   HD13  LEU  53          HD13      LEU  53  -3.933  -9.447  16.070
    9   HD21  LEU  53          HD21      LEU  53  -2.200 -12.815  15.291
   10   HD23  LEU  53          HD22      LEU  53  -1.243 -11.683  16.240
   11   HD22  LEU  53          HD23      LEU  53  -0.886 -11.918  14.540

  No H/Q in entry =          11
  In of MODEL   37
    1    H    VAL  54           H        VAL  54  -5.147 -10.621  11.252
    2    HA   VAL  54           HA       VAL  54  -6.101 -13.202  10.567
    3    HB   VAL  54           HB       VAL  54  -6.720 -10.458   9.443
    4   HG12  VAL  54          HG11      VAL  54  -8.847 -11.805   8.646
    5   HG11  VAL  54          HG12      VAL  54  -7.753 -13.186   8.706
    6   HG13  VAL  54          HG13      VAL  54  -7.383 -11.814   7.664
    7   HG22  VAL  54          HG21      VAL  54  -7.610 -10.488  11.602
    8   HG21  VAL  54          HG22      VAL  54  -7.888 -12.228  11.581
    9   HG23  VAL  54          HG23      VAL  54  -8.962 -11.154  10.686

  No H/Q in entry =           9
  In of MODEL   37
    1    H    GLN  55           H        GLN  55  -4.211 -10.772   8.768
    2    HA   GLN  55           HA       GLN  55  -4.120 -12.232   6.346
    3    HB2  GLN  55           HB2      GLN  55  -3.487  -9.976   6.156
    4    HB3  GLN  55           HB3      GLN  55  -2.366 -10.071   7.512
    5    HG2  GLN  55           HG2      GLN  55  -0.671 -10.937   6.221
    6    HG3  GLN  55           HG3      GLN  55  -1.766 -11.895   5.233
    7   HE21  GLN  55          HE21      GLN  55  -1.790 -11.200   3.113
    8   HE22  GLN  55          HE22      GLN  55  -1.574  -9.598   2.605

  No H/Q in entry =           8
  In of MODEL   37
    1    H    THR  56           H        THR  56  -1.991 -12.247   9.210
    2    HA   THR  56           HA       THR  56   0.057 -13.872   8.273
    3    HB   THR  56           HB       THR  56  -1.169 -14.105  11.030
    4    HG1  THR  56           HG1      THR  56   0.710 -12.245  10.005
    5   HG21  THR  56          HG21      THR  56   0.752 -15.641  10.066
    6   HG23  THR  56          HG22      THR  56   0.871 -14.988  11.700
    7   HG22  THR  56          HG23      THR  56   1.752 -14.224  10.377

  No H/Q in entry =           7
  In of MODEL   37
    1    H    LYS  57           H        LYS  57  -3.066 -14.868   9.659
    2    HA   LYS  57           HA       LYS  57  -2.662 -17.669   9.403
    3    HB2  LYS  57           HB2      LYS  57  -4.503 -16.287  10.659
    4    HB3  LYS  57           HB3      LYS  57  -5.342 -16.324   9.116
    5    HG2  LYS  57           HG2      LYS  57  -5.369 -18.746   9.116
    6    HG3  LYS  57           HG3      LYS  57  -4.368 -18.799  10.565
    7    HD2  LYS  57           HD2      LYS  57  -6.618 -19.173  11.296
    8    HD3  LYS  57           HD3      LYS  57  -6.229 -17.515  11.751
    9    HE2  LYS  57           HE2      LYS  57  -7.456 -16.626   9.877
   10    HE3  LYS  57           HE3      LYS  57  -7.652 -18.223   9.158
   11    HZ3  LYS  57           HZ1      LYS  57  -9.177 -18.848  10.752
   12    HZ2  LYS  57           HZ2      LYS  57  -9.579 -17.219  10.487
   13    HZ1  LYS  57           HZ3      LYS  57  -8.680 -17.662  11.860

  No H/Q in entry =          13
  In of MODEL   37
    1    H    LEU  58           H        LEU  58  -3.976 -15.203   7.243
    2    HA   LEU  58           HA       LEU  58  -4.820 -17.012   5.240
    3    HB2  LEU  58           HB2      LEU  58  -4.172 -14.072   5.106
    4    HB3  LEU  58           HB3      LEU  58  -4.860 -14.997   3.769
    5    HG   LEU  58           HG       LEU  58  -6.115 -14.805   6.527
    6   HD11  LEU  58          HD11      LEU  58  -6.411 -13.148   4.041
    7   HD13  LEU  58          HD12      LEU  58  -6.380 -12.645   5.731
    8   HD12  LEU  58          HD13      LEU  58  -7.820 -13.416   5.069
    9   HD22  LEU  58          HD21      LEU  58  -7.112 -16.698   5.661
   10   HD21  LEU  58          HD22      LEU  58  -6.779 -16.248   3.989
   11   HD23  LEU  58          HD23      LEU  58  -8.125 -15.504   4.852

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  59           H        ILE  59  -1.661 -15.848   6.078
    2    HA   ILE  59           HA       ILE  59  -0.594 -16.586   3.432
    3    HB   ILE  59           HB       ILE  59   0.216 -14.536   5.000
    4   HG12  ILE  59          HG12      ILE  59   2.266 -16.214   3.540
    5   HG13  ILE  59          HG13      ILE  59   1.081 -15.244   2.704
    6   HG21  ILE  59          HG21      ILE  59   0.956 -16.333   6.744
    7   HG23  ILE  59          HG22      ILE  59   2.065 -15.031   6.379
    8   HG22  ILE  59          HG23      ILE  59   2.293 -16.623   5.657
    9   HD13  ILE  59          HD11      ILE  59   1.882 -13.219   3.806
   10   HD12  ILE  59          HD12      ILE  59   3.226 -14.029   3.004
   11   HD11  ILE  59          HD13      ILE  59   3.024 -14.170   4.750

  No H/Q in entry =          11
  In of MODEL   37
    1    H    GLU  60           H        GLU  60  -0.595 -17.699   6.797
    2    HA   GLU  60           HA       GLU  60   1.405 -19.706   6.513
    3    HB2  GLU  60           HB2      GLU  60   0.866 -20.311   8.668
    4    HB3  GLU  60           HB3      GLU  60   0.153 -18.700   8.638
    5    HG2  GLU  60           HG2      GLU  60  -2.024 -19.783   7.917
    6    HG3  GLU  60           HG3      GLU  60  -1.270 -21.343   8.235

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLY  61           H        GLY  61  -2.110 -19.752   6.054
    2    HA3  GLY  61           HA2      GLY  61  -1.910 -22.546   5.088
    3    HA2  GLY  61           HA3      GLY  61  -3.380 -21.790   5.695

  No H/Q in entry =           3
  In of MODEL   37
    1    H    ASP  62           H        ASP  62  -1.141 -20.244   3.475
    2    HA   ASP  62           HA       ASP  62  -3.180 -19.503   1.664
    3    HB2  ASP  62           HB2      ASP  62  -1.260 -18.787   0.234
    4    HB3  ASP  62           HB3      ASP  62  -1.171 -18.181   1.884

  No H/Q in entry =           4
  In of MODEL   37
    1    H    ALA  63           H        ALA  63  -1.734 -22.531   2.053
    2    HA   ALA  63           HA       ALA  63  -1.371 -23.455  -0.585
    3    HB1  ALA  63           HB1      ALA  63  -2.396 -25.048   1.762
    4    HB2  ALA  63           HB2      ALA  63  -0.698 -24.690   1.453
    5    HB3  ALA  63           HB3      ALA  63  -1.611 -25.681   0.314

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLY  64           H        GLY  64  -4.234 -23.538   1.527
    2    HA3  GLY  64           HA2      GLY  64  -6.459 -23.905   1.097
    3    HA2  GLY  64           HA3      GLY  64  -6.173 -22.940  -0.342

  No H/Q in entry =           3
  In of MODEL   37
    1    H    GLU  65           H        GLU  65  -7.540 -24.102  -1.708
    2    HA   GLU  65           HA       GLU  65  -7.554 -26.932  -1.844
    3    HB2  GLU  65           HB2      GLU  65  -8.525 -24.837  -3.784
    4    HB3  GLU  65           HB3      GLU  65  -8.788 -26.569  -3.997
    5    HG2  GLU  65           HG2      GLU  65  -9.966 -26.688  -1.858
    6    HG3  GLU  65           HG3      GLU  65  -9.649 -24.979  -1.565

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLY  66           H        GLY  66  -5.884 -24.482  -3.671
    2    HA3  GLY  66           HA2      GLY  66  -4.731 -26.157  -5.655
    3    HA2  GLY  66           HA3      GLY  66  -4.255 -24.516  -5.268

  No H/Q in entry =           3
  In of MODEL   37
    1    H    LYS  67           H        LYS  67  -2.438 -26.439  -6.013
    2    HA   LYS  67           HA       LYS  67  -1.212 -27.754  -3.815
    3    HB2  LYS  67           HB2      LYS  67  -0.273 -27.166  -6.618
    4    HB3  LYS  67           HB3      LYS  67   0.632 -28.158  -5.467
    5    HG2  LYS  67           HG2      LYS  67  -1.317 -29.645  -5.202
    6    HG3  LYS  67           HG3      LYS  67  -2.231 -28.657  -6.340
    7    HD2  LYS  67           HD2      LYS  67  -0.621 -29.193  -8.120
    8    HD3  LYS  67           HD3      LYS  67   0.324 -30.159  -6.983
    9    HE2  LYS  67           HE2      LYS  67  -1.133 -31.635  -8.278
   10    HE3  LYS  67           HE3      LYS  67  -1.668 -31.603  -6.599
   11    HZ1  LYS  67           HZ1      LYS  67  -2.869 -29.551  -8.201
   12    HZ3  LYS  67           HZ2      LYS  67  -3.595 -30.682  -7.163
   13    HZ2  LYS  67           HZ3      LYS  67  -3.225 -31.111  -8.764

  No H/Q in entry =          13
  In of MODEL   37
    1    H    MET  68           H        MET  68   1.218 -26.375  -5.554
    2    HA   MET  68           HA       MET  68   2.512 -25.186  -3.356
    3    HB2  MET  68           HB2      MET  68   2.991 -25.136  -6.323
    4    HB3  MET  68           HB3      MET  68   4.041 -24.274  -5.196
    5    HG2  MET  68           HG2      MET  68   4.489 -26.356  -3.983
    6    HG3  MET  68           HG3      MET  68   3.392 -27.234  -5.050
    7    HE3  MET  68           HE1      MET  68   6.156 -24.370  -6.067
    8    HE2  MET  68           HE2      MET  68   7.505 -25.488  -5.871
    9    HE1  MET  68           HE3      MET  68   6.402 -25.202  -4.526

  No H/Q in entry =           9
  In of MODEL   37
    1    H    LYS  69           H        LYS  69   0.704 -23.697  -6.039
    2    HA   LYS  69           HA       LYS  69   1.398 -21.051  -5.582
    3    HB2  LYS  69           HB2      LYS  69  -0.598 -20.429  -6.832
    4    HB3  LYS  69           HB3      LYS  69   0.251 -21.780  -7.595
    5    HG2  LYS  69           HG2      LYS  69  -1.287 -23.366  -6.478
    6    HG3  LYS  69           HG3      LYS  69  -2.159 -22.006  -5.770
    7    HD2  LYS  69           HD2      LYS  69  -2.614 -21.163  -8.084
    8    HD3  LYS  69           HD3      LYS  69  -1.873 -22.633  -8.720
    9    HE2  LYS  69           HE2      LYS  69  -4.215 -22.612  -6.796
   10    HE3  LYS  69           HE3      LYS  69  -4.375 -22.774  -8.545
   11    HZ3  LYS  69           HZ1      LYS  69  -3.295 -24.813  -8.535
   12    HZ2  LYS  69           HZ2      LYS  69  -4.280 -24.890  -7.152
   13    HZ1  LYS  69           HZ3      LYS  69  -2.618 -24.573  -6.998

  No H/Q in entry =          13
  In of MODEL   37
    1    H    VAL  70           H        VAL  70  -0.343 -19.288  -5.083
    2    HA   VAL  70           HA       VAL  70  -1.710 -19.917  -2.530
    3    HB   VAL  70           HB       VAL  70  -0.977 -17.669  -1.714
    4   HG13  VAL  70          HG11      VAL  70   1.198 -18.379  -1.038
    5   HG12  VAL  70          HG12      VAL  70   1.409 -19.353  -2.494
    6   HG11  VAL  70          HG13      VAL  70   0.260 -19.858  -1.254
    7   HG21  VAL  70          HG21      VAL  70   0.664 -17.721  -4.276
    8   HG23  VAL  70          HG22      VAL  70   0.989 -16.627  -2.933
    9   HG22  VAL  70          HG23      VAL  70  -0.537 -16.516  -3.806

  No H/Q in entry =           9
  In of MODEL   37
    1    H    SER  71           H        SER  71  -3.322 -18.251  -1.960
    2    HA   SER  71           HA       SER  71  -5.159 -17.742  -4.047
    3    HB2  SER  71           HB2      SER  71  -5.775 -17.902  -1.618
    4    HB3  SER  71           HB3      SER  71  -4.974 -16.358  -1.348
    5    HG   SER  71           HG       SER  71  -7.212 -16.908  -3.004

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU  72           H        LEU  72  -5.427 -16.043  -5.376
    2    HA   LEU  72           HA       LEU  72  -3.298 -14.259  -5.872
    3    HB2  LEU  72           HB2      LEU  72  -6.171 -14.277  -6.793
    4    HB3  LEU  72           HB3      LEU  72  -4.968 -13.127  -7.374
    5    HG   LEU  72           HG       LEU  72  -4.580 -16.134  -7.519
    6   HD12  LEU  72          HD11      LEU  72  -5.081 -15.701 -10.009
    7   HD11  LEU  72          HD12      LEU  72  -5.813 -14.189  -9.474
    8   HD13  LEU  72          HD13      LEU  72  -6.460 -15.730  -8.909
    9   HD23  LEU  72          HD21      LEU  72  -3.042 -15.271  -9.455
   10   HD22  LEU  72          HD22      LEU  72  -2.454 -15.121  -7.808
   11   HD21  LEU  72          HD23      LEU  72  -3.139 -13.721  -8.626

  No H/Q in entry =          11
  In of MODEL   37
    1    H    VAL  73           H        VAL  73  -6.372 -13.864  -4.214
    2    HA   VAL  73           HA       VAL  73  -6.377 -11.094  -3.855
    3    HB   VAL  73           HB       VAL  73  -8.108 -11.425  -2.307
    4   HG12  VAL  73          HG11      VAL  73  -8.249 -13.987  -3.886
    5   HG11  VAL  73          HG12      VAL  73  -8.370 -12.423  -4.686
    6   HG13  VAL  73          HG13      VAL  73  -9.556 -12.881  -3.463
    7   HG21  VAL  73          HG21      VAL  73  -6.791 -14.104  -1.811
    8   HG23  VAL  73          HG22      VAL  73  -8.428 -13.741  -1.261
    9   HG22  VAL  73          HG23      VAL  73  -7.064 -12.800  -0.655

  No H/Q in entry =           9
  In of MODEL   37
    1    H    LEU  74           H        LEU  74  -4.457 -13.492  -2.295
    2    HA   LEU  74           HA       LEU  74  -4.008 -12.364   0.227
    3    HB2  LEU  74           HB2      LEU  74  -3.260 -14.592  -0.291
    4    HB3  LEU  74           HB3      LEU  74  -2.203 -13.987  -1.565
    5    HG   LEU  74           HG       LEU  74  -0.885 -12.749   0.130
    6   HD12  LEU  74          HD11      LEU  74  -1.359 -13.517   2.560
    7   HD11  LEU  74          HD12      LEU  74  -2.957 -13.964   1.961
    8   HD13  LEU  74          HD13      LEU  74  -2.420 -12.286   1.876
    9   HD23  LEU  74          HD21      LEU  74  -1.106 -15.533   1.163
   10   HD22  LEU  74          HD22      LEU  74   0.306 -14.598   0.726
   11   HD21  LEU  74          HD23      LEU  74  -0.684 -15.300  -0.532

  No H/Q in entry =          11
  In of MODEL   37
    1    H    VAL  75           H        VAL  75  -2.139 -11.987  -2.746
    2    HA   VAL  75           HA       VAL  75  -0.307 -10.090  -1.746
    3    HB   VAL  75           HB       VAL  75  -1.293 -10.556  -4.561
    4   HG11  VAL  75          HG11      VAL  75   1.008  -8.859  -3.501
    5   HG13  VAL  75          HG12      VAL  75  -0.406  -8.278  -4.365
    6   HG12  VAL  75          HG13      VAL  75   0.776  -9.277  -5.194
    7   HG21  VAL  75          HG21      VAL  75  -0.019 -12.367  -3.242
    8   HG23  VAL  75          HG22      VAL  75   1.362 -11.271  -3.293
    9   HG22  VAL  75          HG23      VAL  75   0.674 -11.892  -4.794

  No H/Q in entry =           9
  In of MODEL   37
    1    H    GLU  76           H        GLU  76  -3.467  -9.696  -3.375
    2    HA   GLU  76           HA       GLU  76  -3.482  -6.881  -3.468
    3    HB2  GLU  76           HB2      GLU  76  -5.167  -8.339  -4.604
    4    HB3  GLU  76           HB3      GLU  76  -5.836  -8.756  -3.035
    5    HG2  GLU  76           HG2      GLU  76  -6.388  -6.364  -2.644
    6    HG3  GLU  76           HG3      GLU  76  -5.787  -5.962  -4.241

  No H/Q in entry =           6
  In of MODEL   37
    1    H    ALA  77           H        ALA  77  -4.599  -9.101  -0.924
    2    HA   ALA  77           HA       ALA  77  -5.513  -7.092   0.849
    3    HB2  ALA  77           HB1      ALA  77  -5.236  -8.876   2.603
    4    HB1  ALA  77           HB2      ALA  77  -4.519  -9.903   1.361
    5    HB3  ALA  77           HB3      ALA  77  -6.192  -9.372   1.207

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLN  78           H        GLN  78  -2.390  -8.683   0.451
    2    HA   GLN  78           HA       GLN  78  -1.097  -7.546   2.693
    3    HB2  GLN  78           HB2      GLN  78  -0.276  -9.495   1.320
    4    HB3  GLN  78           HB3      GLN  78   0.170  -8.347   0.061
    5    HG2  GLN  78           HG2      GLN  78   1.654  -7.185   1.645
    6    HG3  GLN  78           HG3      GLN  78   1.214  -8.334   2.906
    7   HE21  GLN  78          HE21      GLN  78   3.932  -8.104   2.080
    8   HE22  GLN  78          HE22      GLN  78   4.371  -9.525   1.261

  No H/Q in entry =           8
  In of MODEL   37
    1    H    LEU  79           H        LEU  79  -1.479  -6.471  -0.647
    2    HA   LEU  79           HA       LEU  79   0.239  -4.268  -0.643
    3    HB2  LEU  79           HB2      LEU  79  -0.818  -5.054  -2.689
    4    HB3  LEU  79           HB3      LEU  79  -2.410  -4.641  -2.065
    5    HG   LEU  79           HG       LEU  79  -1.832  -2.262  -2.038
    6   HD13  LEU  79          HD11      LEU  79   0.416  -2.052  -1.545
    7   HD12  LEU  79          HD12      LEU  79   0.454  -1.760  -3.284
    8   HD11  LEU  79          HD13      LEU  79   0.891  -3.346  -2.646
    9   HD23  LEU  79          HD21      LEU  79  -1.218  -2.065  -4.595
   10   HD22  LEU  79          HD22      LEU  79  -2.750  -2.792  -4.124
   11   HD21  LEU  79          HD23      LEU  79  -1.396  -3.819  -4.584

  No H/Q in entry =          11
  In of MODEL   37
    1    H    HIS  80           H        HIS  80  -3.222  -4.382   0.214
    2    HA   HIS  80           HA       HIS  80  -3.367  -1.626   0.887
    3    HB2  HIS  80           HB2      HIS  80  -5.101  -4.010   1.215
    4    HB3  HIS  80           HB3      HIS  80  -5.392  -2.669   2.325
    5    HD1  HIS  80           HD1      HIS  80  -6.993  -1.006   1.437
    6    HD2  HIS  80           HD2      HIS  80  -4.855  -2.841  -1.635
    7    HE1  HIS  80           HE1      HIS  80  -7.838   0.009  -0.732
    8    HE2  HIS  80           HE2      HIS  80  -6.541  -1.103  -2.614

  No H/Q in entry =           8
  In of MODEL   37
    1    H    LEU  81           H        LEU  81  -2.903  -4.533   2.868
    2    HA   LEU  81           HA       LEU  81  -2.849  -3.193   5.356
    3    HB2  LEU  81           HB2      LEU  81  -1.677  -5.825   4.458
    4    HB3  LEU  81           HB3      LEU  81  -1.628  -5.272   6.133
    5    HG   LEU  81           HG       LEU  81  -4.191  -5.481   4.527
    6   HD12  LEU  81          HD11      LEU  81  -4.511  -7.547   6.072
    7   HD11  LEU  81          HD12      LEU  81  -2.756  -7.503   6.242
    8   HD13  LEU  81          HD13      LEU  81  -3.483  -7.718   4.649
    9   HD23  LEU  81          HD21      LEU  81  -5.015  -5.679   7.035
   10   HD22  LEU  81          HD22      LEU  81  -4.673  -4.093   6.347
   11   HD21  LEU  81          HD23      LEU  81  -3.488  -4.874   7.394

  No H/Q in entry =          11
  In of MODEL   37
    1    H    MET  82           H        MET  82  -0.201  -4.131   3.158
    2    HA   MET  82           HA       MET  82   1.910  -3.273   4.825
    3    HB2  MET  82           HB2      MET  82   1.663  -3.603   1.834
    4    HB3  MET  82           HB3      MET  82   3.161  -3.057   2.586
    5    HG2  MET  82           HG2      MET  82   1.721  -5.627   3.316
    6    HG3  MET  82           HG3      MET  82   3.084  -5.535   2.204
    7    HE3  MET  82           HE1      MET  82   6.128  -4.851   4.162
    8    HE2  MET  82           HE2      MET  82   5.221  -3.468   3.556
    9    HE1  MET  82           HE3      MET  82   5.278  -4.956   2.615

  No H/Q in entry =           9
  In of MODEL   37
    1    H    THR  83           H        THR  83   0.091  -1.596   2.290
    2    HA   THR  83           HA       THR  83   1.541   0.830   2.370
    3    HB   THR  83           HB       THR  83  -0.629   1.791   1.406
    4    HG1  THR  83           HG1      THR  83  -2.300   0.520   1.311
    5   HG22  THR  83          HG21      THR  83  -0.405  -0.025  -0.602
    6   HG21  THR  83          HG22      THR  83   1.098  -0.343   0.261
    7   HG23  THR  83          HG23      THR  83   0.757   1.277  -0.347

  No H/Q in entry =           7
  In of MODEL   37
    1    H    SER  84           H        SER  84  -1.466  -0.160   3.996
    2    HA   SER  84           HA       SER  84  -1.911   2.273   5.351
    3    HB2  SER  84           HB2      SER  84  -2.784  -0.552   5.916
    4    HB3  SER  84           HB3      SER  84  -3.246   0.793   6.957
    5    HG   SER  84           HG       SER  84  -3.735   0.494   4.168

  No H/Q in entry =           5
  In of MODEL   37
    1    H    MET  85           H        MET  85  -0.238  -0.688   6.457
    2    HA   MET  85           HA       MET  85   0.320   0.223   9.059
    3    HB2  MET  85           HB2      MET  85   0.569  -2.123   8.382
    4    HB3  MET  85           HB3      MET  85   1.942  -1.682   7.364
    5    HG2  MET  85           HG2      MET  85   3.169  -0.874   9.337
    6    HG3  MET  85           HG3      MET  85   1.788  -1.262  10.364
    7    HE3  MET  85           HE1      MET  85   4.814  -4.094   8.438
    8    HE2  MET  85           HE2      MET  85   5.013  -2.389   8.834
    9    HE1  MET  85           HE3      MET  85   3.957  -2.861   7.507

  No H/Q in entry =           9
  In of MODEL   37
    1    H    LEU  86           H        LEU  86   2.232   0.456   6.091
    2    HA   LEU  86           HA       LEU  86   4.477   1.727   7.230
    3    HB2  LEU  86           HB2      LEU  86   4.247   0.654   4.920
    4    HB3  LEU  86           HB3      LEU  86   3.458   2.150   4.419
    5    HG   LEU  86           HG       LEU  86   5.515   3.361   5.383
    6   HD11  LEU  86          HD11      LEU  86   6.186   0.736   6.170
    7   HD13  LEU  86          HD12      LEU  86   7.213   2.164   6.262
    8   HD12  LEU  86          HD13      LEU  86   7.292   1.118   4.847
    9   HD23  LEU  86          HD21      LEU  86   6.182   1.593   3.022
   10   HD22  LEU  86          HD22      LEU  86   6.605   3.283   3.284
   11   HD21  LEU  86          HD23      LEU  86   4.941   2.843   2.900

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ALA  87           H        ALA  87   1.571   3.022   5.675
    2    HA   ALA  87           HA       ALA  87   2.210   5.742   5.760
    3    HB1  ALA  87           HB1      ALA  87  -0.130   4.153   5.236
    4    HB3  ALA  87           HB2      ALA  87   0.203   5.810   4.738
    5    HB2  ALA  87           HB3      ALA  87  -0.582   5.497   6.287

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ARG  88           H        ARG  88   0.510   3.762   8.161
    2    HA   ARG  88           HA       ARG  88   0.049   5.814  10.017
    3    HB2  ARG  88           HB2      ARG  88  -0.927   3.477  10.087
    4    HB3  ARG  88           HB3      ARG  88   0.612   2.950  10.777
    5    HG2  ARG  88           HG2      ARG  88   0.184   5.028  12.406
    6    HG3  ARG  88           HG3      ARG  88  -1.492   4.731  11.965
    7    HD2  ARG  88           HD2      ARG  88  -1.618   2.881  13.208
    8    HD3  ARG  88           HD3      ARG  88  -0.043   2.275  12.661
    9    HE   ARG  88           HE       ARG  88  -0.533   3.540  15.123
   10   HH21  ARG  88          HH11      ARG  88   1.052   4.524  16.349
   11   HH22  ARG  88          HH12      ARG  88   2.572   4.928  15.632
   12   HH11  ARG  88          HH21      ARG  88   1.726   3.691  12.525
   13   HH12  ARG  88          HH22      ARG  88   2.961   4.440  13.478

  No H/Q in entry =          13
  In of MODEL   37
    1    H    GLU  89           H        GLU  89   2.807   3.551   9.763
    2    HA   GLU  89           HA       GLU  89   4.104   4.414  12.097
    3    HB2  GLU  89           HB2      GLU  89   4.718   2.389  10.743
    4    HB3  GLU  89           HB3      GLU  89   5.501   3.473   9.591
    5    HG2  GLU  89           HG2      GLU  89   7.015   4.292  11.323
    6    HG3  GLU  89           HG3      GLU  89   6.176   3.346  12.549

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LEU  90           H        LEU  90   4.409   5.575   8.769
    2    HA   LEU  90           HA       LEU  90   6.375   7.543   9.341
    3    HB2  LEU  90           HB2      LEU  90   4.344   7.249   7.132
    4    HB3  LEU  90           HB3      LEU  90   5.594   8.500   7.145
    5    HG   LEU  90           HG       LEU  90   6.225   5.553   7.466
    6   HD12  LEU  90          HD11      LEU  90   6.955   5.780   5.019
    7   HD11  LEU  90          HD12      LEU  90   5.962   7.237   4.984
    8   HD13  LEU  90          HD13      LEU  90   5.221   5.674   5.330
    9   HD22  LEU  90          HD21      LEU  90   8.146   6.671   8.133
   10   HD21  LEU  90          HD22      LEU  90   7.809   8.084   7.132
   11   HD23  LEU  90          HD23      LEU  90   8.439   6.611   6.396

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  91           H        ILE  91   2.836   7.614   9.225
    2    HA   ILE  91           HA       ILE  91   2.540  10.390   9.685
    3    HB   ILE  91           HB       ILE  91   0.718   8.041  10.239
    4   HG12  ILE  91          HG12      ILE  91   0.486  10.330   8.261
    5   HG13  ILE  91          HG13      ILE  91   1.320   8.824   7.878
    6   HG22  ILE  91          HG21      ILE  91  -0.982  10.125  10.323
    7   HG21  ILE  91          HG22      ILE  91   0.438  10.932  10.985
    8   HG23  ILE  91          HG23      ILE  91  -0.213   9.503  11.784
    9   HD13  ILE  91          HD11      ILE  91  -0.643   7.566   7.938
   10   HD12  ILE  91          HD12      ILE  91  -1.215   9.091   7.265
   11   HD11  ILE  91          HD13      ILE  91  -1.476   8.727   8.971

  No H/Q in entry =          11
  In of MODEL   37
    1    H    THR  92           H        THR  92   2.922   7.638  11.877
    2    HA   THR  92           HA       THR  92   2.521   9.012  14.307
    3    HB   THR  92           HB       THR  92   4.289   6.653  13.621
    4    HG1  THR  92           HG1      THR  92   2.308   5.925  13.537
    5   HG22  THR  92          HG21      THR  92   3.925   6.368  16.258
    6   HG21  THR  92          HG22      THR  92   3.886   8.128  16.189
    7   HG23  THR  92          HG23      THR  92   5.301   7.253  15.601

  No H/Q in entry =           7
  In of MODEL   37
    1    H    GLU  93           H        GLU  93   5.448   8.525  12.346
    2    HA   GLU  93           HA       GLU  93   7.237   9.923  14.030
    3    HB2  GLU  93           HB2      GLU  93   7.294   9.613  11.014
    4    HB3  GLU  93           HB3      GLU  93   8.651  10.122  12.017
    5    HG2  GLU  93           HG2      GLU  93   7.208   7.505  12.472
    6    HG3  GLU  93           HG3      GLU  93   8.584   7.639  11.384

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LEU  94           H        LEU  94   5.179  10.972  11.338
    2    HA   LEU  94           HA       LEU  94   6.021  13.665  11.236
    3    HB2  LEU  94           HB2      LEU  94   3.405  12.338  10.503
    4    HB3  LEU  94           HB3      LEU  94   3.686  14.062  10.263
    5    HG   LEU  94           HG       LEU  94   5.666  12.048   9.190
    6   HD11  LEU  94          HD11      LEU  94   2.923  12.639   8.153
    7   HD13  LEU  94          HD12      LEU  94   3.884  11.170   8.016
    8   HD12  LEU  94          HD13      LEU  94   4.229  12.547   6.972
    9   HD23  LEU  94          HD21      LEU  94   5.926  13.885   7.469
   10   HD22  LEU  94          HD22      LEU  94   6.362  14.368   9.108
   11   HD21  LEU  94          HD23      LEU  94   4.812  14.859   8.425

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  95           H        ILE  95   3.478  12.079  13.147
    2    HA   ILE  95           HA       ILE  95   2.478  14.440  14.355
    3    HB   ILE  95           HB       ILE  95   2.464  11.557  15.274
    4   HG12  ILE  95          HG12      ILE  95   0.259  13.362  14.248
    5   HG13  ILE  95          HG13      ILE  95   1.192  12.292  13.205
    6   HG21  ILE  95          HG21      ILE  95   1.226  14.044  16.492
    7   HG23  ILE  95          HG22      ILE  95   2.265  12.859  17.285
    8   HG22  ILE  95          HG23      ILE  95   0.620  12.421  16.823
    9   HD13  ILE  95          HD11      ILE  95   0.271  10.364  14.129
   10   HD12  ILE  95          HD12      ILE  95  -1.096  11.472  14.219
   11   HD11  ILE  95          HD13      ILE  95  -0.122  11.158  15.655

  No H/Q in entry =          11
  In of MODEL   37
    1    H    GLU  96           H        GLU  96   5.052  12.185  15.324
    2    HA   GLU  96           HA       GLU  96   5.645  13.371  17.813
    3    HB2  GLU  96           HB2      GLU  96   6.558  11.201  17.153
    4    HB3  GLU  96           HB3      GLU  96   7.491  11.965  15.867
    5    HG2  GLU  96           HG2      GLU  96   9.159  12.489  17.316
    6    HG3  GLU  96           HG3      GLU  96   8.032  13.315  18.382

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LEU  97           H        LEU  97   6.700  14.136  14.519
    2    HA   LEU  97           HA       LEU  97   8.618  16.106  15.219
    3    HB2  LEU  97           HB2      LEU  97   6.998  15.583  12.736
    4    HB3  LEU  97           HB3      LEU  97   8.037  17.001  12.852
    5    HG   LEU  97           HG       LEU  97   9.035  14.189  13.398
    6   HD12  LEU  97          HD11      LEU  97  10.014  14.375  11.072
    7   HD11  LEU  97          HD12      LEU  97   8.978  15.779  10.821
    8   HD13  LEU  97          HD13      LEU  97   8.261  14.196  11.118
    9   HD23  LEU  97          HD21      LEU  97  11.214  15.442  12.638
   10   HD22  LEU  97          HD22      LEU  97  10.612  15.716  14.273
   11   HD21  LEU  97          HD23      LEU  97  10.302  16.906  13.010

  No H/Q in entry =          11
  In of MODEL   37
    1    H    HIS  98           H        HIS  98   5.123  16.287  14.595
    2    HA   HIS  98           HA       HIS  98   4.860  19.090  14.738
    3    HB2  HIS  98           HB2      HIS  98   2.948  16.862  15.476
    4    HB3  HIS  98           HB3      HIS  98   2.503  18.568  15.539
    5    HD1  HIS  98           HD1      HIS  98   3.470  15.845  13.120
    6    HD2  HIS  98           HD2      HIS  98   2.142  19.795  13.017
    7    HE1  HIS  98           HE1      HIS  98   2.896  16.345  10.702
    8    HE2  HIS  98           HE2      HIS  98   2.090  18.745  10.618

  No H/Q in entry =           8
  In of MODEL   37
    1    H    GLU  99           H        GLU  99   4.984  16.595  17.231
    2    HA   GLU  99           HA       GLU  99   4.416  18.292  19.437
    3    HB2  GLU  99           HB2      GLU  99   4.297  15.811  19.530
    4    HB3  GLU  99           HB3      GLU  99   6.055  15.745  19.407
    5    HG2  GLU  99           HG2      GLU  99   6.278  17.030  21.482
    6    HG3  GLU  99           HG3      GLU  99   4.528  17.192  21.593

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LYS 100           H        LYS 100   7.444  17.327  17.844
    2    HA   LYS 100           HA       LYS 100   9.132  18.703  19.689
    3    HB2  LYS 100           HB2      LYS 100   9.595  17.779  16.845
    4    HB3  LYS 100           HB3      LYS 100  10.843  18.531  17.843
    5    HG2  LYS 100           HG2      LYS 100  10.460  16.781  19.584
    6    HG3  LYS 100           HG3      LYS 100   9.309  15.994  18.501
    7    HD2  LYS 100           HD2      LYS 100  11.085  15.693  16.818
    8    HD3  LYS 100           HD3      LYS 100  12.241  16.492  17.886
    9    HE2  LYS 100           HE2      LYS 100  11.838  14.738  19.604
   10    HE3  LYS 100           HE3      LYS 100  10.743  13.918  18.487
   11    HZ1  LYS 100           HZ1      LYS 100  13.566  14.554  17.808
   12    HZ3  LYS 100           HZ2      LYS 100  12.502  13.514  16.987
   13    HZ2  LYS 100           HZ3      LYS 100  13.098  13.084  18.519

  No H/Q in entry =          13
  In of MODEL   37
    1    H    LEU 101           H        LEU 101   7.425  19.657  16.750
    2    HA   LEU 101           HA       LEU 101   8.667  22.200  16.410
    3    HB2  LEU 101           HB2      LEU 101   6.049  21.000  15.543
    4    HB3  LEU 101           HB3      LEU 101   6.320  22.728  15.337
    5    HG   LEU 101           HG       LEU 101   8.322  20.689  14.350
    6   HD12  LEU 101          HD11      LEU 101   7.156  21.214  12.076
    7   HD11  LEU 101          HD12      LEU 101   5.770  21.659  13.069
    8   HD13  LEU 101          HD13      LEU 101   6.415  20.020  13.142
    9   HD21  LEU 101          HD21      LEU 101   7.726  23.610  13.805
   10   HD23  LEU 101          HD22      LEU 101   8.685  22.640  12.688
   11   HD22  LEU 101          HD23      LEU 101   9.244  22.888  14.342

  No H/Q in entry =          11
  In of MODEL   37
    1    H    LYS 102           H        LYS 102   7.139  21.075  19.037
    2    HA   LYS 102           HA       LYS 102   6.537  22.171  20.976
    3    HB2  LYS 102           HB2      LYS 102   7.835  24.147  19.845
    4    HB3  LYS 102           HB3      LYS 102   6.241  24.773  19.485
    5    HG2  LYS 102           HG2      LYS 102   7.637  24.494  22.124
    6    HG3  LYS 102           HG3      LYS 102   6.696  25.836  21.506
    7    HD2  LYS 102           HD2      LYS 102   5.427  23.213  22.390
    8    HD3  LYS 102           HD3      LYS 102   5.702  24.569  23.474
    9    HE2  LYS 102           HE2      LYS 102   3.405  24.198  22.005
   10    HE3  LYS 102           HE3      LYS 102   3.933  25.736  22.685
   11    HZ2  LYS 102           HZ1      LYS 102   3.383  25.856  20.311
   12    HZ1  LYS 102           HZ2      LYS 102   4.628  24.758  19.974
   13    HZ3  LYS 102           HZ3      LYS 102   4.996  26.283  20.617

  No H/Q in entry =          13
  In of MODEL   37
    1    H    ALA 103           H        ALA 103   4.895  23.740  18.227
    2    HA   ALA 103           HA       ALA 103   2.456  24.346  19.134
    3    HB1  ALA 103           HB1      ALA 103   1.527  23.521  16.898
    4    HB2  ALA 103           HB2      ALA 103   3.165  22.964  16.553
    5    HB3  ALA 103           HB3      ALA 103   2.854  24.679  16.826

  No H/Q in entry =           5
  In of MODEL   37
    1    H1   ALA   1           H3       ALA   1  10.263 -20.204  -6.309
    2    H2   ALA   1           H2       ALA   1   9.284 -20.394  -7.686
    3    H3   ALA   1           H1       ALA   1   8.849 -21.138  -6.221
    4    HA   ALA   1           HA       ALA   1   9.858 -22.959  -6.974
    5    HB1  ALA   1           HB1      ALA   1   9.938 -22.596  -9.249
    6    HB2  ALA   1           HB2      ALA   1  11.670 -22.469  -8.935
    7    HB3  ALA   1           HB3      ALA   1  10.690 -21.008  -9.074

  No H/Q in entry =           7
  In of MODEL   37
    1    H    GLU   2           H        GLU   2  12.128 -23.940  -7.054
    2    HA   GLU   2           HA       GLU   2  13.530 -23.882  -4.855
    3    HB2  GLU   2           HB2      GLU   2  14.864 -23.762  -7.566
    4    HB3  GLU   2           HB3      GLU   2  15.597 -24.387  -6.089
    5    HG2  GLU   2           HG2      GLU   2  14.551 -26.389  -6.325
    6    HG3  GLU   2           HG3      GLU   2  12.988 -25.621  -6.568

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLU   3           H        GLU   3  15.305 -22.036  -7.268
    2    HA   GLU   3           HA       GLU   3  16.499 -20.369  -5.315
    3    HB2  GLU   3           HB2      GLU   3  16.416 -20.359  -8.324
    4    HB3  GLU   3           HB3      GLU   3  17.187 -19.042  -7.441
    5    HG2  GLU   3           HG2      GLU   3  18.839 -20.441  -6.537
    6    HG3  GLU   3           HG3      GLU   3  17.871 -21.895  -6.752

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LEU   4           H        LEU   4  14.205 -19.484  -7.923
    2    HA   LEU   4           HA       LEU   4  13.780 -16.871  -7.302
    3    HB2  LEU   4           HB2      LEU   4  11.571 -18.813  -8.017
    4    HB3  LEU   4           HB3      LEU   4  11.518 -17.063  -8.211
    5    HG   LEU   4           HG       LEU   4  13.445 -18.950  -9.606
    6   HD13  LEU   4          HD11      LEU   4  12.128 -18.779 -11.503
    7   HD12  LEU   4          HD12      LEU   4  11.445 -17.225 -11.026
    8   HD11  LEU   4          HD13      LEU   4  10.878 -18.710 -10.263
    9   HD23  LEU   4          HD21      LEU   4  13.800 -16.706 -10.955
   10   HD22  LEU   4          HD22      LEU   4  14.670 -16.964  -9.444
   11   HD21  LEU   4          HD23      LEU   4  13.231 -15.948  -9.468

  No H/Q in entry =          11
  In of MODEL   37
    1    H    GLU   5           H        GLU   5  12.272 -19.638  -5.652
    2    HA   GLU   5           HA       GLU   5  10.632 -18.047  -3.931
    3    HB2  GLU   5           HB2      GLU   5  10.174 -20.421  -4.457
    4    HB3  GLU   5           HB3      GLU   5  11.605 -20.876  -3.529
    5    HG2  GLU   5           HG2      GLU   5  10.657 -19.838  -1.519
    6    HG3  GLU   5           HG3      GLU   5   9.239 -19.333  -2.436

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLU   6           H        GLU   6  13.760 -19.671  -3.520
    2    HA   GLU   6           HA       GLU   6  14.149 -18.826  -0.823
    3    HB2  GLU   6           HB2      GLU   6  16.065 -19.796  -2.954
    4    HB3  GLU   6           HB3      GLU   6  16.552 -19.443  -1.295
    5    HG2  GLU   6           HG2      GLU   6  14.982 -21.105  -0.441
    6    HG3  GLU   6           HG3      GLU   6  14.380 -21.412  -2.070

  No H/Q in entry =           6
  In of MODEL   37
    1    H    VAL   7           H        VAL   7  14.904 -17.502  -3.977
    2    HA   VAL   7           HA       VAL   7  16.626 -15.400  -3.123
    3    HB   VAL   7           HB       VAL   7  14.893 -15.735  -5.585
    4   HG11  VAL   7          HG11      VAL   7  16.823 -13.549  -4.786
    5   HG13  VAL   7          HG12      VAL   7  15.177 -13.384  -5.394
    6   HG12  VAL   7          HG13      VAL   7  16.470 -13.901  -6.477
    7   HG21  VAL   7          HG21      VAL   7  16.985 -17.221  -5.039
    8   HG23  VAL   7          HG22      VAL   7  17.906 -15.771  -5.443
    9   HG22  VAL   7          HG23      VAL   7  16.849 -16.504  -6.646

  No H/Q in entry =           9
  In of MODEL   37
    1    H    VAL   8           H        VAL   8  13.125 -15.622  -3.649
    2    HA   VAL   8           HA       VAL   8  12.499 -12.907  -3.165
    3    HB   VAL   8           HB       VAL   8  10.906 -15.455  -2.849
    4   HG12  VAL   8          HG11      VAL   8   8.927 -13.838  -2.657
    5   HG11  VAL   8          HG12      VAL   8  10.113 -12.590  -2.274
    6   HG13  VAL   8          HG13      VAL   8   9.945 -13.997  -1.225
    7   HG21  VAL   8          HG21      VAL   8  11.503 -13.617  -5.028
    8   HG23  VAL   8          HG22      VAL   8   9.771 -13.637  -4.711
    9   HG22  VAL   8          HG23      VAL   8  10.612 -15.137  -5.085

  No H/Q in entry =           9
  In of MODEL   37
    1    H    MET   9           H        MET   9  12.750 -15.721  -0.994
    2    HA   MET   9           HA       MET   9  11.972 -14.444   1.387
    3    HB2  MET   9           HB2      MET   9  13.867 -16.732   0.840
    4    HB3  MET   9           HB3      MET   9  13.540 -16.163   2.477
    5    HG2  MET   9           HG2      MET   9  11.145 -16.575   2.175
    6    HG3  MET   9           HG3      MET   9  11.424 -17.071   0.506
    7    HE2  MET   9           HE1      MET   9  11.074 -18.463   4.157
    8    HE1  MET   9           HE2      MET   9  12.496 -17.430   4.047
    9    HE3  MET   9           HE3      MET   9  12.689 -19.151   4.365

  No H/Q in entry =           9
  In of MODEL   37
    1    H    GLY  10           H        GLY  10  15.136 -14.706  -0.199
    2    HA3  GLY  10           HA2      GLY  10  16.630 -13.308   1.761
    3    HA2  GLY  10           HA3      GLY  10  17.076 -13.475   0.063

  No H/Q in entry =           3
  In of MODEL   37
    1    H    LEU  11           H        LEU  11  14.912 -12.224  -1.154
    2    HA   LEU  11           HA       LEU  11  15.632  -9.488  -0.991
    3    HB2  LEU  11           HB2      LEU  11  13.236 -10.866  -2.208
    4    HB3  LEU  11           HB3      LEU  11  13.537  -9.135  -2.366
    5    HG   LEU  11           HG       LEU  11  15.531 -11.266  -3.177
    6   HD13  LEU  11          HD11      LEU  11  13.767 -11.608  -4.682
    7   HD12  LEU  11          HD12      LEU  11  14.777 -10.437  -5.529
    8   HD11  LEU  11          HD13      LEU  11  13.317  -9.902  -4.696
    9   HD22  LEU  11          HD21      LEU  11  16.788  -9.318  -2.958
   10   HD21  LEU  11          HD22      LEU  11  15.422  -8.264  -3.322
   11   HD23  LEU  11          HD23      LEU  11  16.231  -9.139  -4.620

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  12           H        ILE  12  12.853 -11.284   0.297
    2    HA   ILE  12           HA       ILE  12  11.496  -9.046   1.374
    3    HB   ILE  12           HB       ILE  12  11.507 -11.930   2.318
    4   HG12  ILE  12          HG12      ILE  12  10.806 -11.282  -0.123
    5   HG13  ILE  12          HG13      ILE  12   9.778 -12.365   0.794
    6   HG21  ILE  12          HG21      ILE  12   9.614  -9.632   2.903
    7   HG23  ILE  12          HG22      ILE  12  10.587 -10.530   4.067
    8   HG22  ILE  12          HG23      ILE  12   9.241 -11.320   3.247
    9   HD11  ILE  12          HD11      ILE  12   9.375  -9.370   0.606
   10   HD13  ILE  12          HD12      ILE  12   8.269 -10.547   1.311
   11   HD12  ILE  12          HD13      ILE  12   8.556 -10.537  -0.416

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  13           H        ILE  13  13.876 -11.281   2.753
    2    HA   ILE  13           HA       ILE  13  13.948 -10.108   5.336
    3    HB   ILE  13           HB       ILE  13  15.976 -11.700   3.748
    4   HG12  ILE  13          HG12      ILE  13  13.719 -12.675   4.566
    5   HG13  ILE  13          HG13      ILE  13  15.188 -13.582   4.912
    6   HG23  ILE  13          HG21      ILE  13  17.331 -10.512   5.290
    7   HG22  ILE  13          HG22      ILE  13  17.048 -12.065   6.067
    8   HG21  ILE  13          HG23      ILE  13  16.140 -10.644   6.581
    9   HD11  ILE  13          HD11      ILE  13  14.398 -11.594   6.981
   10   HD13  ILE  13          HD12      ILE  13  15.036 -13.224   7.162
   11   HD12  ILE  13          HD13      ILE  13  13.332 -12.985   6.798

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ASN  14           H        ASN  14  15.881  -9.592   2.401
    2    HA   ASN  14           HA       ASN  14  17.655  -7.671   3.452
    3    HB2  ASN  14           HB2      ASN  14  17.599  -8.932   1.134
    4    HB3  ASN  14           HB3      ASN  14  16.716  -7.505   0.608
    5   HD21  ASN  14          HD21      ASN  14  19.142  -7.866  -0.600
    6   HD22  ASN  14          HD22      ASN  14  20.302  -6.796   0.019

  No H/Q in entry =           6
  In of MODEL   37
    1    H    SER  15           H        SER  15  14.533  -7.289   1.788
    2    HA   SER  15           HA       SER  15  14.450  -4.467   1.851
    3    HB2  SER  15           HB2      SER  15  12.112  -4.689   1.374
    4    HB3  SER  15           HB3      SER  15  12.887  -6.063   0.596
    5    HG   SER  15           HG       SER  15  11.734  -7.299   1.820

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLY  16           H        GLY  16  13.352  -6.922   4.159
    2    HA3  GLY  16           HA2      GLY  16  12.164  -5.165   6.031
    3    HA2  GLY  16           HA3      GLY  16  12.767  -6.780   6.384

  No H/Q in entry =           3
  In of MODEL   37
    1    H    GLN  17           H        GLN  17  15.476  -6.472   5.769
    2    HA   GLN  17           HA       GLN  17  16.465  -5.265   8.144
    3    HB2  GLN  17           HB2      GLN  17  17.664  -7.068   6.932
    4    HB3  GLN  17           HB3      GLN  17  17.976  -5.949   5.603
    5    HG2  GLN  17           HG2      GLN  17  19.934  -6.027   7.049
    6    HG3  GLN  17           HG3      GLN  17  19.168  -4.446   7.200
    7   HE21  GLN  17          HE21      GLN  17  19.766  -3.996   9.387
    8   HE22  GLN  17          HE22      GLN  17  19.250  -4.943  10.697

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ALA  18           H        ALA  18  16.257  -4.178   4.788
    2    HA   ALA  18           HA       ALA  18  17.717  -1.800   5.008
    3    HB1  ALA  18           HB1      ALA  18  16.570  -2.999   2.947
    4    HB3  ALA  18           HB2      ALA  18  16.850  -1.258   2.933
    5    HB2  ALA  18           HB3      ALA  18  15.248  -1.890   3.315

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ARG  19           H        ARG  19  14.215  -2.356   5.433
    2    HA   ARG  19           HA       ARG  19  13.578   0.298   6.160
    3    HB2  ARG  19           HB2      ARG  19  11.876  -1.437   5.584
    4    HB3  ARG  19           HB3      ARG  19  12.223  -2.241   7.116
    5    HG2  ARG  19           HG2      ARG  19  11.542  -0.246   8.366
    6    HG3  ARG  19           HG3      ARG  19  11.287   0.636   6.862
    7    HD2  ARG  19           HD2      ARG  19   9.145  -0.143   7.698
    8    HD3  ARG  19           HD3      ARG  19   9.543  -1.023   6.216
    9    HE   ARG  19           HE       ARG  19  10.506  -2.579   8.310
   10   HH21  ARG  19          HH11      ARG  19   9.250  -4.210   9.256
   11   HH22  ARG  19          HH12      ARG  19   7.529  -4.166   9.100
   12   HH11  ARG  19          HH21      ARG  19   7.514  -1.257   7.244
   13   HH12  ARG  19          HH22      ARG  19   6.547  -2.495   7.956

  No H/Q in entry =          13
  In of MODEL   37
    1    H    SER  20           H        SER  20  14.426  -2.544   8.106
    2    HA   SER  20           HA       SER  20  14.175  -1.448  10.647
    3    HB2  SER  20           HB2      SER  20  14.784  -3.866   9.958
    4    HB3  SER  20           HB3      SER  20  16.448  -3.290   9.931
    5    HG   SER  20           HG       SER  20  16.294  -2.784  12.078

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU  21           H        LEU  21  17.000  -1.407   8.487
    2    HA   LEU  21           HA       LEU  21  18.703   0.059  10.215
    3    HB2  LEU  21           HB2      LEU  21  18.652  -0.209   7.201
    4    HB3  LEU  21           HB3      LEU  21  19.921   0.643   8.079
    5    HG   LEU  21           HG       LEU  21  19.168  -2.241   8.632
    6   HD12  LEU  21          HD11      LEU  21  21.453  -1.173   6.946
    7   HD11  LEU  21          HD12      LEU  21  19.999  -1.937   6.304
    8   HD13  LEU  21          HD13      LEU  21  21.117  -2.869   7.297
    9   HD22  LEU  21          HD21      LEU  21  20.358  -1.496  10.513
   10   HD21  LEU  21          HD22      LEU  21  21.347  -0.375   9.585
   11   HD23  LEU  21          HD23      LEU  21  21.668  -2.100   9.504

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ALA  22           H        ALA  22  16.426   1.055   7.680
    2    HA   ALA  22           HA       ALA  22  16.990   3.808   7.696
    3    HB3  ALA  22           HB1      ALA  22  15.562   2.583   6.026
    4    HB2  ALA  22           HB2      ALA  22  14.874   4.100   6.603
    5    HB1  ALA  22           HB3      ALA  22  14.275   2.565   7.231

  No H/Q in entry =           5
  In of MODEL   37
    1    H    TYR  23           H        TYR  23  14.492   2.011   9.547
    2    HA   TYR  23           HA       TYR  23  13.563   4.253  11.010
    3    HB2  TYR  23           HB2      TYR  23  12.308   2.150  10.994
    4    HB3  TYR  23           HB3      TYR  23  13.639   1.327  11.808
    5    HD1  TYR  23           HD1      TYR  23  11.150   4.078  12.194
    6    HD2  TYR  23           HD2      TYR  23  13.867   1.397  14.163
    7    HE1  TYR  23           HE1      TYR  23  10.244   4.777  14.396
    8    HE2  TYR  23           HE2      TYR  23  12.961   2.094  16.363
    9    HH   TYR  23           HH       TYR  23  10.091   3.720  16.738

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ALA  24           H        ALA  24  16.192   1.952  11.620
    2    HA   ALA  24           HA       ALA  24  16.893   2.934  14.180
    3    HB3  ALA  24           HB1      ALA  24  18.231   1.129  13.999
    4    HB2  ALA  24           HB2      ALA  24  19.258   2.043  12.894
    5    HB1  ALA  24           HB3      ALA  24  17.948   1.049  12.261

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA  25           H        ALA  25  17.831   3.862  10.895
    2    HA   ALA  25           HA       ALA  25  19.800   5.776  11.529
    3    HB1  ALA  25           HB1      ALA  25  19.055   4.840   9.217
    4    HB3  ALA  25           HB2      ALA  25  19.574   6.523   9.310
    5    HB2  ALA  25           HB3      ALA  25  17.855   6.132   9.254

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU  26           H        LEU  26  16.285   6.040  11.197
    2    HA   LEU  26           HA       LEU  26  16.092   8.823  11.657
    3    HB2  LEU  26           HB2      LEU  26  14.211   7.608  10.742
    4    HB3  LEU  26           HB3      LEU  26  14.122   6.578  12.165
    5    HG   LEU  26           HG       LEU  26  13.547   8.538  13.555
    6   HD12  LEU  26          HD11      LEU  26  12.896  10.649  12.240
    7   HD11  LEU  26          HD12      LEU  26  13.859   9.989  10.921
    8   HD13  LEU  26          HD13      LEU  26  14.621  10.363  12.468
    9   HD21  LEU  26          HD21      LEU  26  11.847   8.248  11.059
   10   HD23  LEU  26          HD22      LEU  26  11.307   8.948  12.582
   11   HD22  LEU  26          HD23      LEU  26  11.741   7.242  12.504

  No H/Q in entry =          11
  In of MODEL   37
    1    H    LYS  27           H        LYS  27  15.974   6.040  13.844
    2    HA   LYS  27           HA       LYS  27  15.415   7.406  16.220
    3    HB2  LYS  27           HB2      LYS  27  15.416   4.931  15.949
    4    HB3  LYS  27           HB3      LYS  27  17.179   4.965  15.891
    5    HG2  LYS  27           HG2      LYS  27  17.258   5.945  18.143
    6    HG3  LYS  27           HG3      LYS  27  15.492   5.982  18.203
    7    HD2  LYS  27           HD2      LYS  27  15.439   3.516  17.961
    8    HD3  LYS  27           HD3      LYS  27  17.203   3.487  17.934
    9    HE2  LYS  27           HE2      LYS  27  17.266   4.469  20.193
   10    HE3  LYS  27           HE3      LYS  27  15.501   4.528  20.222
   11    HZ3  LYS  27           HZ1      LYS  27  16.278   2.565  21.362
   12    HZ2  LYS  27           HZ2      LYS  27  17.178   2.080  20.002
   13    HZ1  LYS  27           HZ3      LYS  27  15.479   2.103  19.937

  No H/Q in entry =          13
  In of MODEL   37
    1    H    GLN  28           H        GLN  28  18.512   6.794  14.601
    2    HA   GLN  28           HA       GLN  28  20.224   7.854  16.580
    3    HB2  GLN  28           HB2      GLN  28  20.487   7.812  13.562
    4    HB3  GLN  28           HB3      GLN  28  21.788   8.267  14.663
    5    HG2  GLN  28           HG2      GLN  28  20.338   5.606  14.718
    6    HG3  GLN  28           HG3      GLN  28  21.912   5.874  13.971
    7   HE21  GLN  28          HE21      GLN  28  20.668   4.574  16.694
    8   HE22  GLN  28          HE22      GLN  28  21.880   4.981  17.810

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ALA  29           H        ALA  29  18.467   9.363  13.906
    2    HA   ALA  29           HA       ALA  29  19.498  11.971  14.157
    3    HB2  ALA  29           HB1      ALA  29  17.794  12.631  12.701
    4    HB1  ALA  29           HB2      ALA  29  16.642  11.470  13.359
    5    HB3  ALA  29           HB3      ALA  29  17.958  10.915  12.323

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LYS  30           H        LYS  30  16.716  10.400  15.697
    2    HA   LYS  30           HA       LYS  30  15.739  12.662  17.068
    3    HB2  LYS  30           HB2      LYS  30  15.599   9.721  17.766
    4    HB3  LYS  30           HB3      LYS  30  14.755  10.979  18.670
    5    HG2  LYS  30           HG2      LYS  30  13.621  11.684  16.562
    6    HG3  LYS  30           HG3      LYS  30  14.403  10.340  15.726
    7    HD2  LYS  30           HD2      LYS  30  13.324   8.742  17.259
    8    HD3  LYS  30           HD3      LYS  30  12.553  10.075  18.120
    9    HE2  LYS  30           HE2      LYS  30  11.375  10.727  16.039
   10    HE3  LYS  30           HE3      LYS  30  12.126   9.366  15.198
   11    HZ2  LYS  30           HZ1      LYS  30   9.820   8.982  16.097
   12    HZ1  LYS  30           HZ2      LYS  30  10.502   9.023  17.658
   13    HZ3  LYS  30           HZ3      LYS  30  10.986   7.835  16.541

  No H/Q in entry =          13
  In of MODEL   37
    1    H    GLN  31           H        GLN  31  18.380  10.459  17.777
    2    HA   GLN  31           HA       GLN  31  18.742  11.462  20.471
    3    HB2  GLN  31           HB2      GLN  31  20.732   9.871  18.846
    4    HB3  GLN  31           HB3      GLN  31  20.614   9.992  20.601
    5    HG2  GLN  31           HG2      GLN  31  18.083   9.073  19.852
    6    HG3  GLN  31           HG3      GLN  31  19.165   8.218  18.760
    7   HE21  GLN  31          HE21      GLN  31  17.627   7.085  21.047
    8   HE22  GLN  31          HE22      GLN  31  18.784   6.407  22.086

  No H/Q in entry =           8
  In of MODEL   37
    1    H    GLY  32           H        GLY  32  19.253  12.781  17.504
    2    HA3  GLY  32           HA2      GLY  32  20.258  14.815  16.986
    3    HA2  GLY  32           HA3      GLY  32  21.028  14.806  18.568

  No H/Q in entry =           3
  In of MODEL   37
    1    H    ASP  33           H        ASP  33  21.400  11.914  16.780
    2    HA   ASP  33           HA       ASP  33  24.229  12.555  16.292
    3    HB2  ASP  33           HB2      ASP  33  22.690   9.958  16.414
    4    HB3  ASP  33           HB3      ASP  33  24.373  10.055  15.905

  No H/Q in entry =           4
  In of MODEL   37
    1    H    PHE  34           H        PHE  34  23.748  13.889  14.418
    2    HA   PHE  34           HA       PHE  34  22.368  12.927  12.140
    3    HB2  PHE  34           HB2      PHE  34  24.527  15.035  12.357
    4    HB3  PHE  34           HB3      PHE  34  23.526  14.760  10.933
    5    HD1  PHE  34           HD1      PHE  34  23.825  16.684  13.849
    6    HD2  PHE  34           HD2      PHE  34  20.902  14.609  11.482
    7    HE1  PHE  34           HE1      PHE  34  22.033  18.101  14.815
    8    HE2  PHE  34           HE2      PHE  34  19.114  16.026  12.451
    9    HZ   PHE  34           HZ       PHE  34  19.684  17.772  14.113

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ALA  35           H        ALA  35  25.748  12.697  13.118
    2    HA   ALA  35           HA       ALA  35  26.823  11.869  10.650
    3    HB3  ALA  35           HB1      ALA  35  28.504  10.675  12.352
    4    HB2  ALA  35           HB2      ALA  35  27.662  11.708  13.508
    5    HB1  ALA  35           HB3      ALA  35  28.496  12.425  12.130

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA  36           H        ALA  36  25.708   9.919  13.420
    2    HA   ALA  36           HA       ALA  36  26.152   7.429  12.134
    3    HB2  ALA  36           HB1      ALA  36  25.730   6.683  14.211
    4    HB3  ALA  36           HB2      ALA  36  24.047   7.197  14.077
    5    HB1  ALA  36           HB3      ALA  36  25.266   8.314  14.692

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA  37           H        ALA  37  23.356   9.587  12.297
    2    HA   ALA  37           HA       ALA  37  21.470   7.842  11.133
    3    HB3  ALA  37           HB1      ALA  37  21.732  10.801  11.430
    4    HB1  ALA  37           HB2      ALA  37  20.412   9.737  11.911
    5    HB2  ALA  37           HB3      ALA  37  20.592  10.211  10.221

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LYS  38           H        LYS  38  23.584  10.283   9.642
    2    HA   LYS  38           HA       LYS  38  22.918   9.870   6.969
    3    HB2  LYS  38           HB2      LYS  38  24.757  11.403   8.403
    4    HB3  LYS  38           HB3      LYS  38  25.770  10.405   7.366
    5    HG2  LYS  38           HG2      LYS  38  24.597  11.193   5.382
    6    HG3  LYS  38           HG3      LYS  38  23.420  12.058   6.375
    7    HD2  LYS  38           HD2      LYS  38  25.039  13.637   7.118
    8    HD3  LYS  38           HD3      LYS  38  26.384  12.638   6.568
    9    HE2  LYS  38           HE2      LYS  38  26.034  14.517   5.024
   10    HE3  LYS  38           HE3      LYS  38  25.676  12.985   4.219
   11    HZ3  LYS  38           HZ1      LYS  38  23.483  13.454   4.109
   12    HZ2  LYS  38           HZ2      LYS  38  24.023  15.063   4.196
   13    HZ1  LYS  38           HZ3      LYS  38  23.453  14.282   5.591

  No H/Q in entry =          13
  In of MODEL   37
    1    H    ALA  39           H        ALA  39  25.431   8.240   8.900
    2    HA   ALA  39           HA       ALA  39  26.466   6.645   6.817
    3    HB2  ALA  39           HB1      ALA  39  26.391   5.676   9.659
    4    HB1  ALA  39           HB2      ALA  39  27.355   7.092   9.239
    5    HB3  ALA  39           HB3      ALA  39  27.683   5.540   8.468

  No H/Q in entry =           5
  In of MODEL   37
    1    H    MET  40           H        MET  40  23.866   6.051   9.136
    2    HA   MET  40           HA       MET  40  23.388   3.353   8.399
    3    HB2  MET  40           HB2      MET  40  21.604   5.412   9.712
    4    HB3  MET  40           HB3      MET  40  21.178   3.707   9.536
    5    HG2  MET  40           HG2      MET  40  23.749   4.619  10.858
    6    HG3  MET  40           HG3      MET  40  22.259   4.356  11.763
    7    HE3  MET  40           HE1      MET  40  21.660   0.728  11.934
    8    HE2  MET  40           HE2      MET  40  20.798   2.042  11.138
    9    HE1  MET  40           HE3      MET  40  21.555   2.318  12.705

  No H/Q in entry =           9
  In of MODEL   37
    1    H    MET  41           H        MET  41  21.996   6.423   7.231
    2    HA   MET  41           HA       MET  41  20.013   5.253   5.573
    3    HB2  MET  41           HB2      MET  41  21.515   7.829   5.054
    4    HB3  MET  41           HB3      MET  41  19.976   7.353   4.347
    5    HG2  MET  41           HG2      MET  41  19.250   7.165   6.904
    6    HG3  MET  41           HG3      MET  41  20.573   8.309   7.118
    7    HE2  MET  41           HE1      MET  41  19.994   9.611   3.790
    8    HE1  MET  41           HE2      MET  41  20.968  10.037   5.194
    9    HE3  MET  41           HE3      MET  41  19.701  11.131   4.643

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ASP  42           H        ASP  42  23.389   6.143   4.994
    2    HA   ASP  42           HA       ASP  42  23.453   5.675   2.234
    3    HB2  ASP  42           HB2      ASP  42  25.229   6.651   3.991
    4    HB3  ASP  42           HB3      ASP  42  25.869   5.019   3.854

  No H/Q in entry =           4
  In of MODEL   37
    1    H    GLN  43           H        GLN  43  24.179   3.506   4.943
    2    HA   GLN  43           HA       GLN  43  24.807   1.246   3.349
    3    HB2  GLN  43           HB2      GLN  43  23.811   1.433   6.202
    4    HB3  GLN  43           HB3      GLN  43  24.368  -0.060   5.438
    5    HG2  GLN  43           HG2      GLN  43  26.539   1.131   4.912
    6    HG3  GLN  43           HG3      GLN  43  25.978   2.461   5.919
    7   HE21  GLN  43          HE21      GLN  43  28.210   1.463   6.934
    8   HE22  GLN  43          HE22      GLN  43  27.936   0.380   8.210

  No H/Q in entry =           8
  In of MODEL   37
    1    H    SER  44           H        SER  44  21.774   2.407   4.763
    2    HA   SER  44           HA       SER  44  20.178   0.181   4.098
    3    HB2  SER  44           HB2      SER  44  19.771   2.711   5.254
    4    HB3  SER  44           HB3      SER  44  18.724   2.682   3.838
    5    HG   SER  44           HG       SER  44  17.636   1.745   5.568

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ARG  45           H        ARG  45  20.935   3.143   2.295
    2    HA   ARG  45           HA       ARG  45  19.385   2.678   0.002
    3    HB2  ARG  45           HB2      ARG  45  20.555   4.801   0.582
    4    HB3  ARG  45           HB3      ARG  45  22.089   4.032   0.181
    5    HG2  ARG  45           HG2      ARG  45  21.281   3.640  -2.128
    6    HG3  ARG  45           HG3      ARG  45  19.760   4.432  -1.726
    7    HD2  ARG  45           HD2      ARG  45  21.036   6.515  -1.147
    8    HD3  ARG  45           HD3      ARG  45  22.520   5.727  -1.731
    9    HE   ARG  45           HE       ARG  45  20.570   5.514  -3.750
   10   HH21  ARG  45          HH11      ARG  45  20.561   6.888  -5.510
   11   HH22  ARG  45          HH12      ARG  45  21.335   8.430  -5.409
   12   HH11  ARG  45          HH21      ARG  45  22.340   7.991  -2.133
   13   HH12  ARG  45          HH22      ARG  45  22.341   9.054  -3.493

  No H/Q in entry =          13
  In of MODEL   37
    1    H    MET  46           H        MET  46  22.746   1.767   0.718
    2    HA   MET  46           HA       MET  46  23.318   0.574  -1.775
    3    HB2  MET  46           HB2      MET  46  24.446   0.231   1.004
    4    HB3  MET  46           HB3      MET  46  25.079  -0.668  -0.378
    5    HG2  MET  46           HG2      MET  46  25.541   1.432  -1.563
    6    HG3  MET  46           HG3      MET  46  24.851   2.354  -0.234
    7    HE2  MET  46           HE1      MET  46  28.725   0.244  -0.783
    8    HE1  MET  46           HE2      MET  46  27.130  -0.216  -1.369
    9    HE3  MET  46           HE3      MET  46  27.707  -0.841   0.174

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ALA  47           H        ALA  47  21.947  -0.752   1.210
    2    HA   ALA  47           HA       ALA  47  21.857  -3.462   0.402
    3    HB2  ALA  47           HB1      ALA  47  21.505  -3.003   2.711
    4    HB3  ALA  47           HB2      ALA  47  19.956  -3.587   2.105
    5    HB1  ALA  47           HB3      ALA  47  20.207  -1.860   2.365

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU  48           H        LEU  48  19.530  -0.808   0.073
    2    HA   LEU  48           HA       LEU  48  17.457  -2.316  -1.163
    3    HB2  LEU  48           HB2      LEU  48  18.143   0.631  -1.277
    4    HB3  LEU  48           HB3      LEU  48  16.658  -0.062  -1.931
    5    HG   LEU  48           HG       LEU  48  17.535  -0.380   0.948
    6   HD13  LEU  48          HD11      LEU  48  17.141   1.926   0.771
    7   HD12  LEU  48          HD12      LEU  48  15.581   1.295   1.293
    8   HD11  LEU  48          HD13      LEU  48  15.841   1.718  -0.399
    9   HD22  LEU  48          HD21      LEU  48  15.984  -2.076   0.579
   10   HD21  LEU  48          HD22      LEU  48  15.109  -1.161  -0.649
   11   HD23  LEU  48          HD23      LEU  48  14.917  -0.757   1.057

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ASN  49           H        ASN  49  20.155  -0.416  -2.414
    2    HA   ASN  49           HA       ASN  49  19.477  -0.486  -5.132
    3    HB2  ASN  49           HB2      ASN  49  21.187   1.004  -4.198
    4    HB3  ASN  49           HB3      ASN  49  22.210  -0.378  -3.822
    5   HD21  ASN  49          HD21      ASN  49  23.905   0.424  -5.240
    6   HD22  ASN  49          HD22      ASN  49  23.747   0.354  -6.928

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLU  50           H        GLU  50  21.455  -2.707  -3.193
    2    HA   GLU  50           HA       GLU  50  22.116  -4.466  -5.330
    3    HB2  GLU  50           HB2      GLU  50  23.335  -4.460  -3.175
    4    HB3  GLU  50           HB3      GLU  50  21.893  -5.072  -2.366
    5    HG2  GLU  50           HG2      GLU  50  21.945  -7.103  -3.730
    6    HG3  GLU  50           HG3      GLU  50  23.320  -6.485  -4.643

  No H/Q in entry =           6
  In of MODEL   37
    1    H    ALA  51           H        ALA  51  19.483  -4.375  -2.977
    2    HA   ALA  51           HA       ALA  51  18.281  -6.833  -3.728
    3    HB3  ALA  51           HB1      ALA  51  16.710  -6.312  -2.156
    4    HB1  ALA  51           HB2      ALA  51  16.510  -4.662  -2.750
    5    HB2  ALA  51           HB3      ALA  51  17.875  -5.066  -1.708

  No H/Q in entry =           5
  In of MODEL   37
    1    H    HIS  52           H        HIS  52  17.724  -3.477  -4.751
    2    HA   HIS  52           HA       HIS  52  15.587  -3.975  -6.531
    3    HB2  HIS  52           HB2      HIS  52  16.271  -1.719  -5.731
    4    HB3  HIS  52           HB3      HIS  52  17.714  -1.831  -6.739
    5    HD1  HIS  52           HD1      HIS  52  17.370  -1.791  -9.337
    6    HD2  HIS  52           HD2      HIS  52  13.873  -1.203  -7.144
    7    HE1  HIS  52           HE1      HIS  52  15.634  -0.932 -10.971
    8    HE2  HIS  52           HE2      HIS  52  13.497  -0.568  -9.649

  No H/Q in entry =           8
  In of MODEL   37
    1    H    LEU  53           H        LEU  53  19.101  -4.020  -6.998
    2    HA   LEU  53           HA       LEU  53  19.126  -4.331  -9.800
    3    HB2  LEU  53           HB2      LEU  53  21.072  -5.122  -7.647
    4    HB3  LEU  53           HB3      LEU  53  21.367  -5.504  -9.341
    5    HG   LEU  53           HG       LEU  53  20.733  -2.691  -8.396
    6   HD12  LEU  53          HD11      LEU  53  23.248  -2.357  -8.695
    7   HD11  LEU  53          HD12      LEU  53  23.386  -4.115  -8.669
    8   HD13  LEU  53          HD13      LEU  53  22.760  -3.260  -7.264
    9   HD21  LEU  53          HD21      LEU  53  21.783  -3.923 -10.949
   10   HD23  LEU  53          HD22      LEU  53  22.136  -2.245 -10.553
   11   HD22  LEU  53          HD23      LEU  53  20.474  -2.763 -10.764

  No H/Q in entry =          11
  In of MODEL   37
    1    H    VAL  54           H        VAL  54  19.013  -6.721  -7.177
    2    HA   VAL  54           HA       VAL  54  19.094  -9.014  -8.841
    3    HB   VAL  54           HB       VAL  54  17.972  -8.583  -6.062
    4   HG12  VAL  54          HG11      VAL  54  18.267 -11.204  -6.065
    5   HG11  VAL  54          HG12      VAL  54  18.067 -11.030  -7.809
    6   HG13  VAL  54          HG13      VAL  54  16.795 -10.487  -6.716
    7   HG22  VAL  54          HG21      VAL  54  20.292  -8.398  -5.862
    8   HG21  VAL  54          HG22      VAL  54  20.604  -9.491  -7.208
    9   HG23  VAL  54          HG23      VAL  54  20.082 -10.135  -5.651

  No H/Q in entry =           9
  In of MODEL   37
    1    H    GLN  55           H        GLN  55  16.400  -7.084  -7.529
    2    HA   GLN  55           HA       GLN  55  14.350  -8.724  -8.585
    3    HB2  GLN  55           HB2      GLN  55  13.635  -7.193  -6.948
    4    HB3  GLN  55           HB3      GLN  55  14.435  -5.832  -7.730
    5    HG2  GLN  55           HG2      GLN  55  12.699  -5.487  -9.202
    6    HG3  GLN  55           HG3      GLN  55  12.357  -7.203  -9.372
    7   HE21  GLN  55          HE21      GLN  55  10.353  -7.732  -8.548
    8   HE22  GLN  55          HE22      GLN  55   9.600  -6.972  -7.231

  No H/Q in entry =           8
  In of MODEL   37
    1    H    THR  56           H        THR  56  16.106  -5.941  -9.957
    2    HA   THR  56           HA       THR  56  14.649  -5.560 -12.291
    3    HB   THR  56           HB       THR  56  17.670  -5.503 -12.153
    4    HG1  THR  56           HG1      THR  56  15.739  -3.589 -11.353
    5   HG21  THR  56          HG21      THR  56  16.212  -5.176 -14.335
    6   HG23  THR  56          HG22      THR  56  17.581  -4.115 -14.007
    7   HG22  THR  56          HG23      THR  56  15.940  -3.573 -13.652

  No H/Q in entry =           7
  In of MODEL   37
    1    H    LYS  57           H        LYS  57  17.280  -7.885 -11.709
    2    HA   LYS  57           HA       LYS  57  17.243  -9.076 -14.289
    3    HB2  LYS  57           HB2      LYS  57  18.938  -9.297 -12.301
    4    HB3  LYS  57           HB3      LYS  57  17.868 -10.579 -11.751
    5    HG2  LYS  57           HG2      LYS  57  18.185 -11.812 -13.813
    6    HG3  LYS  57           HG3      LYS  57  19.116 -10.493 -14.512
    7    HD2  LYS  57           HD2      LYS  57  20.716 -12.109 -13.764
    8    HD3  LYS  57           HD3      LYS  57  20.764 -10.798 -12.587
    9    HE2  LYS  57           HE2      LYS  57  19.431 -12.045 -11.015
   10    HE3  LYS  57           HE3      LYS  57  19.053 -13.282 -12.212
   11    HZ3  LYS  57           HZ1      LYS  57  21.183 -14.127 -12.139
   12    HZ2  LYS  57           HZ2      LYS  57  20.899 -13.728 -10.513
   13    HZ1  LYS  57           HZ3      LYS  57  21.850 -12.712 -11.486

  No H/Q in entry =          13
  In of MODEL   37
    1    H    LEU  58           H        LEU  58  15.485  -9.729 -11.297
    2    HA   LEU  58           HA       LEU  58  14.230 -12.089 -12.222
    3    HB2  LEU  58           HB2      LEU  58  13.477 -10.179 -10.016
    4    HB3  LEU  58           HB3      LEU  58  12.651 -11.708 -10.326
    5    HG   LEU  58           HG       LEU  58  15.632 -11.461  -9.801
    6   HD11  LEU  58          HD11      LEU  58  13.275 -11.857  -7.985
    7   HD13  LEU  58          HD12      LEU  58  14.741 -10.908  -7.736
    8   HD12  LEU  58          HD13      LEU  58  14.797 -12.665  -7.604
    9   HD22  LEU  58          HD21      LEU  58  15.484 -13.520 -10.831
   10   HD21  LEU  58          HD22      LEU  58  13.772 -13.712 -10.453
   11   HD23  LEU  58          HD23      LEU  58  14.990 -14.027  -9.216

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  59           H        ILE  59  13.586  -8.744 -12.894
    2    HA   ILE  59           HA       ILE  59  10.854  -9.365 -13.807
    3    HB   ILE  59           HB       ILE  59  11.692  -7.093 -12.606
    4   HG12  ILE  59          HG12      ILE  59   9.770  -6.946 -14.939
    5   HG13  ILE  59          HG13      ILE  59   9.354  -7.714 -13.428
    6   HG21  ILE  59          HG21      ILE  59  13.225  -6.702 -14.669
    7   HG23  ILE  59          HG22      ILE  59  12.258  -5.357 -14.110
    8   HG22  ILE  59          HG23      ILE  59  11.753  -6.290 -15.515
    9   HD13  ILE  59          HD11      ILE  59   9.785  -5.646 -12.199
   10   HD12  ILE  59          HD12      ILE  59   8.616  -5.346 -13.484
   11   HD11  ILE  59          HD13      ILE  59  10.298  -4.857 -13.691

  No H/Q in entry =          11
  In of MODEL   37
    1    H    GLU  60           H        GLU  60  14.054  -8.543 -15.097
    2    HA   GLU  60           HA       GLU  60  13.251  -8.131 -17.796
    3    HB2  GLU  60           HB2      GLU  60  15.501  -7.978 -18.258
    4    HB3  GLU  60           HB3      GLU  60  15.557  -7.741 -16.513
    5    HG2  GLU  60           HG2      GLU  60  15.887 -10.246 -16.281
    6    HG3  GLU  60           HG3      GLU  60  16.081 -10.309 -18.031

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLY  61           H        GLY  61  14.217 -11.025 -15.995
    2    HA3  GLY  61           HA2      GLY  61  13.635 -12.664 -18.393
    3    HA2  GLY  61           HA3      GLY  61  14.676 -13.157 -17.062

  No H/Q in entry =           3
  In of MODEL   37
    1    H    ASP  62           H        ASP  62  11.573 -11.582 -16.663
    2    HA   ASP  62           HA       ASP  62  10.648 -13.500 -14.808
    3    HB2  ASP  62           HB2      ASP  62   8.497 -12.265 -15.003
    4    HB3  ASP  62           HB3      ASP  62   9.881 -11.215 -14.711

  No H/Q in entry =           4
  In of MODEL   37
    1    H    ALA  63           H        ALA  63  10.802 -13.759 -18.180
    2    HA   ALA  63           HA       ALA  63   8.384 -15.026 -18.882
    3    HB1  ALA  63           HB1      ALA  63  11.150 -15.675 -19.934
    4    HB3  ALA  63           HB2      ALA  63  10.166 -14.320 -20.486
    5    HB2  ALA  63           HB3      ALA  63   9.616 -15.974 -20.750

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLY  64           H        GLY  64  11.441 -16.405 -17.718
    2    HA3  GLY  64           HA2      GLY  64  11.976 -18.460 -16.846
    3    HA2  GLY  64           HA3      GLY  64  10.422 -18.342 -16.034

  No H/Q in entry =           3
  In of MODEL   37
    1    H    GLU  65           H        GLU  65   9.868 -20.518 -16.214
    2    HA   GLU  65           HA       GLU  65  10.125 -21.987 -18.624
    3    HB2  GLU  65           HB2      GLU  65   8.479 -22.486 -16.150
    4    HB3  GLU  65           HB3      GLU  65   8.607 -23.629 -17.485
    5    HG2  GLU  65           HG2      GLU  65  11.027 -23.745 -17.206
    6    HG3  GLU  65           HG3      GLU  65  10.967 -22.521 -15.939

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLY  66           H        GLY  66   7.479 -20.242 -17.185
    2    HA3  GLY  66           HA2      GLY  66   5.440 -21.005 -19.011
    3    HA2  GLY  66           HA3      GLY  66   5.381 -19.671 -17.877

  No H/Q in entry =           3
  In of MODEL   37
    1    H    LYS  67           H        LYS  67   4.234 -19.538 -20.372
    2    HA   LYS  67           HA       LYS  67   5.907 -18.356 -22.334
    3    HB2  LYS  67           HB2      LYS  67   2.910 -18.465 -22.023
    4    HB3  LYS  67           HB3      LYS  67   3.730 -17.813 -23.448
    5    HG2  LYS  67           HG2      LYS  67   4.924 -19.954 -23.744
    6    HG3  LYS  67           HG3      LYS  67   4.106 -20.608 -22.327
    7    HD2  LYS  67           HD2      LYS  67   1.932 -20.350 -23.440
    8    HD3  LYS  67           HD3      LYS  67   2.729 -19.653 -24.853
    9    HE2  LYS  67           HE2      LYS  67   2.295 -22.031 -25.247
   10    HE3  LYS  67           HE3      LYS  67   4.032 -21.755 -25.124
   11    HZ1  LYS  67           HZ1      LYS  67   2.817 -22.281 -22.587
   12    HZ3  LYS  67           HZ2      LYS  67   4.163 -23.014 -23.317
   13    HZ2  LYS  67           HZ3      LYS  67   2.594 -23.558 -23.681

  No H/Q in entry =          13
  In of MODEL   37
    1    H    MET  68           H        MET  68   3.197 -16.508 -22.218
    2    HA   MET  68           HA       MET  68   4.518 -14.034 -22.057
    3    HB2  MET  68           HB2      MET  68   1.629 -14.853 -21.967
    4    HB3  MET  68           HB3      MET  68   2.117 -13.162 -21.851
    5    HG2  MET  68           HG2      MET  68   3.300 -13.326 -23.988
    6    HG3  MET  68           HG3      MET  68   2.902 -15.041 -24.098
    7    HE3  MET  68           HE1      MET  68   0.474 -11.929 -22.927
    8    HE2  MET  68           HE2      MET  68   0.275 -11.377 -24.588
    9    HE1  MET  68           HE3      MET  68   1.892 -11.527 -23.906

  No H/Q in entry =           9
  In of MODEL   37
    1    H    LYS  69           H        LYS  69   2.628 -15.767 -19.562
    2    HA   LYS  69           HA       LYS  69   2.426 -13.690 -17.718
    3    HB2  LYS  69           HB2      LYS  69   1.976 -15.434 -16.050
    4    HB3  LYS  69           HB3      LYS  69   1.136 -15.758 -17.569
    5    HG2  LYS  69           HG2      LYS  69   2.963 -17.284 -18.246
    6    HG3  LYS  69           HG3      LYS  69   3.772 -16.984 -16.707
    7    HD2  LYS  69           HD2      LYS  69   1.743 -17.851 -15.529
    8    HD3  LYS  69           HD3      LYS  69   1.056 -18.271 -17.101
    9    HE2  LYS  69           HE2      LYS  69   3.727 -19.284 -16.088
   10    HE3  LYS  69           HE3      LYS  69   2.221 -20.193 -15.983
   11    HZ3  LYS  69           HZ1      LYS  69   2.086 -20.399 -18.266
   12    HZ2  LYS  69           HZ2      LYS  69   3.749 -20.584 -17.982
   13    HZ1  LYS  69           HZ3      LYS  69   3.144 -19.108 -18.564

  No H/Q in entry =          13
  In of MODEL   37
    1    H    VAL  70           H        VAL  70   3.351 -13.958 -15.341
    2    HA   VAL  70           HA       VAL  70   6.292 -14.284 -15.461
    3    HB   VAL  70           HB       VAL  70   6.460 -12.268 -13.995
    4   HG13  VAL  70          HG11      VAL  70   6.319 -10.704 -15.788
    5   HG12  VAL  70          HG12      VAL  70   5.010 -11.598 -16.560
    6   HG11  VAL  70          HG13      VAL  70   6.646 -12.257 -16.556
    7   HG21  VAL  70          HG21      VAL  70   3.490 -12.085 -14.619
    8   HG23  VAL  70          HG22      VAL  70   4.437 -10.742 -13.981
    9   HG22  VAL  70          HG23      VAL  70   4.231 -12.208 -13.024

  No H/Q in entry =           9
  In of MODEL   37
    1    H    SER  71           H        SER  71   7.255 -14.481 -13.278
    2    HA   SER  71           HA       SER  71   6.031 -16.493 -11.714
    3    HB2  SER  71           HB2      SER  71   8.482 -16.082 -11.789
    4    HB3  SER  71           HB3      SER  71   8.235 -14.576 -10.908
    5    HG   SER  71           HG       SER  71   7.697 -17.231 -10.067

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU  72           H        LEU  72   4.711 -16.396  -9.973
    2    HA   LEU  72           HA       LEU  72   3.188 -14.068  -9.510
    3    HB2  LEU  72           HB2      LEU  72   3.465 -16.632  -7.950
    4    HB3  LEU  72           HB3      LEU  72   2.316 -15.364  -7.532
    5    HG   LEU  72           HG       LEU  72   2.426 -16.638 -10.284
    6   HD12  LEU  72          HD11      LEU  72   0.299 -17.810  -9.409
    7   HD11  LEU  72          HD12      LEU  72   0.894 -17.408  -7.800
    8   HD13  LEU  72          HD13      LEU  72   1.852 -18.441  -8.860
    9   HD23  LEU  72          HD21      LEU  72  -0.058 -15.816 -10.131
   10   HD22  LEU  72          HD22      LEU  72   1.188 -14.627 -10.474
   11   HD21  LEU  72          HD23      LEU  72   0.537 -14.774  -8.844

  No H/Q in entry =          11
  In of MODEL   37
    1    H    VAL  73           H        VAL  73   5.847 -15.535  -7.765
    2    HA   VAL  73           HA       VAL  73   5.823 -14.006  -5.429
    3    HB   VAL  73           HB       VAL  73   7.958 -14.878  -4.994
    4   HG12  VAL  73          HG11      VAL  73   6.908 -16.904  -6.964
    5   HG11  VAL  73          HG12      VAL  73   6.028 -16.539  -5.479
    6   HG13  VAL  73          HG13      VAL  73   7.668 -17.179  -5.398
    7   HG21  VAL  73          HG21      VAL  73   8.229 -15.004  -8.004
    8   HG23  VAL  73          HG22      VAL  73   9.331 -15.854  -6.924
    9   HG22  VAL  73          HG23      VAL  73   9.222 -14.095  -6.865

  No H/Q in entry =           9
  In of MODEL   37
    1    H    LEU  74           H        LEU  74   6.793 -13.116  -8.612
    2    HA   LEU  74           HA       LEU  74   8.762 -11.188  -8.134
    3    HB2  LEU  74           HB2      LEU  74   8.273 -11.933 -10.369
    4    HB3  LEU  74           HB3      LEU  74   6.618 -11.336 -10.252
    5    HG   LEU  74           HG       LEU  74   7.471  -9.024 -10.037
    6   HD12  LEU  74          HD11      LEU  74   9.968  -8.778 -10.671
    7   HD11  LEU  74          HD12      LEU  74  10.120 -10.465 -10.185
    8   HD13  LEU  74          HD13      LEU  74   9.598  -9.254  -9.014
    9   HD23  LEU  74          HD21      LEU  74   8.883 -10.158 -12.398
   10   HD22  LEU  74          HD22      LEU  74   7.791  -8.797 -12.279
   11   HD21  LEU  74          HD23      LEU  74   7.145 -10.422 -12.256

  No H/Q in entry =          11
  In of MODEL   37
    1    H    VAL  75           H        VAL  75   5.267 -10.767  -8.455
    2    HA   VAL  75           HA       VAL  75   5.204  -8.011  -7.862
    3    HB   VAL  75           HB       VAL  75   3.097 -10.134  -7.462
    4   HG11  VAL  75          HG11      VAL  75   2.937  -7.093  -7.296
    5   HG13  VAL  75          HG12      VAL  75   2.645  -8.227  -5.985
    6   HG12  VAL  75          HG13      VAL  75   1.541  -8.165  -7.351
    7   HG21  VAL  75          HG21      VAL  75   4.013  -9.541  -9.796
    8   HG23  VAL  75          HG22      VAL  75   3.285  -7.954  -9.553
    9   HG22  VAL  75          HG23      VAL  75   2.270  -9.396  -9.577

  No H/Q in entry =           9
  In of MODEL   37
    1    H    GLU  76           H        GLU  76   4.940 -10.890  -5.756
    2    HA   GLU  76           HA       GLU  76   4.505  -9.529  -3.328
    3    HB2  GLU  76           HB2      GLU  76   4.323 -12.009  -3.609
    4    HB3  GLU  76           HB3      GLU  76   6.067 -12.097  -3.781
    5    HG2  GLU  76           HG2      GLU  76   6.349 -11.203  -1.495
    6    HG3  GLU  76           HG3      GLU  76   4.609 -11.110  -1.297

  No H/Q in entry =           6
  In of MODEL   37
    1    H    ALA  77           H        ALA  77   7.541 -10.464  -4.919
    2    HA   ALA  77           HA       ALA  77   9.258  -9.442  -2.915
    3    HB2  ALA  77           HB1      ALA  77  10.963  -9.398  -4.783
    4    HB3  ALA  77           HB2      ALA  77   9.672  -9.907  -5.872
    5    HB1  ALA  77           HB3      ALA  77  10.163 -10.951  -4.538

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLN  78           H        GLN  78   7.857  -8.004  -5.815
    2    HA   GLN  78           HA       GLN  78   9.236  -5.540  -5.717
    3    HB2  GLN  78           HB2      GLN  78   7.913  -6.438  -7.665
    4    HB3  GLN  78           HB3      GLN  78   6.442  -6.043  -6.777
    5    HG2  GLN  78           HG2      GLN  78   7.116  -3.682  -6.691
    6    HG3  GLN  78           HG3      GLN  78   8.601  -4.065  -7.560
    7   HE21  GLN  78          HE21      GLN  78   6.742  -2.222  -8.679
    8   HE22  GLN  78          HE22      GLN  78   6.029  -2.930 -10.048

  No H/Q in entry =           8
  In of MODEL   37
    1    H    LEU  79           H        LEU  79   6.217  -6.648  -4.264
    2    HA   LEU  79           HA       LEU  79   5.257  -4.232  -3.243
    3    HB2  LEU  79           HB2      LEU  79   3.921  -6.270  -3.180
    4    HB3  LEU  79           HB3      LEU  79   5.066  -7.024  -2.076
    5    HG   LEU  79           HG       LEU  79   4.545  -5.379  -0.341
    6   HD13  LEU  79          HD11      LEU  79   4.094  -3.358  -1.384
    7   HD12  LEU  79          HD12      LEU  79   2.466  -3.866  -0.933
    8   HD11  LEU  79          HD13      LEU  79   3.031  -4.092  -2.587
    9   HD23  LEU  79          HD21      LEU  79   1.955  -5.844  -0.232
   10   HD22  LEU  79          HD22      LEU  79   3.080  -7.195  -0.135
   11   HD21  LEU  79          HD23      LEU  79   2.258  -6.846  -1.652

  No H/Q in entry =          11
  In of MODEL   37
    1    H    HIS  80           H        HIS  80   7.426  -6.595  -1.681
    2    HA   HIS  80           HA       HIS  80   7.749  -5.060   0.688
    3    HB2  HIS  80           HB2      HIS  80   9.052  -7.436  -0.525
    4    HB3  HIS  80           HB3      HIS  80   9.982  -6.552   0.686
    5    HD1  HIS  80           HD1      HIS  80   9.502  -7.188   3.032
    6    HD2  HIS  80           HD2      HIS  80   6.257  -7.997   0.542
    7    HE1  HIS  80           HE1      HIS  80   7.729  -8.274   4.491
    8    HE2  HIS  80           HE2      HIS  80   5.744  -8.771   2.982

  No H/Q in entry =           8
  In of MODEL   37
    1    H    LEU  81           H        LEU  81   9.729  -5.353  -2.240
    2    HA   LEU  81           HA       LEU  81  11.799  -3.637  -1.373
    3    HB2  LEU  81           HB2      LEU  81  10.849  -4.414  -4.131
    4    HB3  LEU  81           HB3      LEU  81  12.282  -3.424  -3.849
    5    HG   LEU  81           HG       LEU  81  11.868  -6.143  -2.578
    6   HD12  LEU  81          HD11      LEU  81  13.664  -6.787  -4.342
    7   HD11  LEU  81          HD12      LEU  81  13.108  -5.354  -5.207
    8   HD13  LEU  81          HD13      LEU  81  11.984  -6.667  -4.863
    9   HD23  LEU  81          HD21      LEU  81  14.500  -5.858  -2.583
   10   HD22  LEU  81          HD22      LEU  81  13.536  -5.089  -1.324
   11   HD21  LEU  81          HD23      LEU  81  14.115  -4.141  -2.693

  No H/Q in entry =          11
  In of MODEL   37
    1    H    MET  82           H        MET  82   8.870  -2.963  -3.287
    2    HA   MET  82           HA       MET  82   9.438  -0.242  -3.786
    3    HB2  MET  82           HB2      MET  82   6.861  -1.806  -3.646
    4    HB3  MET  82           HB3      MET  82   6.878  -0.081  -4.007
    5    HG2  MET  82           HG2      MET  82   8.443  -2.170  -5.558
    6    HG3  MET  82           HG3      MET  82   6.880  -1.528  -6.057
    7    HE3  MET  82           HE1      MET  82   7.360   1.923  -7.226
    8    HE2  MET  82           HE2      MET  82   6.996   1.698  -5.517
    9    HE1  MET  82           HE3      MET  82   6.309   0.599  -6.709

  No H/Q in entry =           9
  In of MODEL   37
    1    H    THR  83           H        THR  83   7.646  -1.824  -1.171
    2    HA   THR  83           HA       THR  83   6.833   0.531   0.166
    3    HB   THR  83           HB       THR  83   6.695  -1.046   2.182
    4    HG1  THR  83           HG1      THR  83   7.427  -3.004   1.942
    5   HG22  THR  83          HG21      THR  83   5.012  -2.589   0.723
    6   HG21  THR  83          HG22      THR  83   5.247  -1.261  -0.408
    7   HG23  THR  83          HG23      THR  83   4.622  -0.941   1.210

  No H/Q in entry =           7
  In of MODEL   37
    1    H    SER  84           H        SER  84   9.635  -1.602   0.662
    2    HA   SER  84           HA       SER  84  10.728  -0.189   2.845
    3    HB2  SER  84           HB2      SER  84  11.944  -2.043   0.807
    4    HB3  SER  84           HB3      SER  84  12.909  -1.304   2.084
    5    HG   SER  84           HG       SER  84  10.615  -2.966   2.356

  No H/Q in entry =           5
  In of MODEL   37
    1    H    MET  85           H        MET  85  11.459   0.070  -0.648
    2    HA   MET  85           HA       MET  85  13.483   2.009  -0.407
    3    HB2  MET  85           HB2      MET  85  13.058   0.738  -2.473
    4    HB3  MET  85           HB3      MET  85  11.538   1.607  -2.688
    5    HG2  MET  85           HG2      MET  85  12.755   3.739  -2.824
    6    HG3  MET  85           HG3      MET  85  14.279   2.897  -2.562
    7    HE2  MET  85           HE1      MET  85  11.694   3.045  -6.328
    8    HE1  MET  85           HE2      MET  85  11.734   4.175  -4.978
    9    HE3  MET  85           HE3      MET  85  11.020   2.583  -4.757

  No H/Q in entry =           9
  In of MODEL   37
    1    H    LEU  86           H        LEU  86   9.994   2.389  -0.890
    2    HA   LEU  86           HA       LEU  86   9.964   5.203  -1.066
    3    HB2  LEU  86           HB2      LEU  86   8.095   3.568  -1.632
    4    HB3  LEU  86           HB3      LEU  86   7.777   3.479   0.100
    5    HG   LEU  86           HG       LEU  86   7.648   6.041   0.054
    6   HD11  LEU  86          HD11      LEU  86   8.399   5.601  -2.654
    7   HD13  LEU  86          HD12      LEU  86   7.988   7.133  -1.888
    8   HD12  LEU  86          HD13      LEU  86   6.734   6.187  -2.686
    9   HD23  LEU  86          HD21      LEU  86   5.485   4.719  -1.596
   10   HD22  LEU  86          HD22      LEU  86   5.320   5.979  -0.376
   11   HD21  LEU  86          HD23      LEU  86   5.702   4.329   0.111

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ALA  87           H        ALA  87   9.491   3.025   1.679
    2    HA   ALA  87           HA       ALA  87   8.981   4.942   3.656
    3    HB1  ALA  87           HB1      ALA  87   9.751   2.112   3.558
    4    HB3  ALA  87           HB2      ALA  87   8.645   2.936   4.654
    5    HB2  ALA  87           HB3      ALA  87  10.376   2.945   4.985

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ARG  88           H        ARG  88  12.039   3.480   2.650
    2    HA   ARG  88           HA       ARG  88  13.679   4.833   4.473
    3    HB2  ARG  88           HB2      ARG  88  14.312   2.854   3.061
    4    HB3  ARG  88           HB3      ARG  88  14.468   3.948   1.689
    5    HG2  ARG  88           HG2      ARG  88  15.973   5.238   3.627
    6    HG3  ARG  88           HG3      ARG  88  16.274   3.544   4.000
    7    HD2  ARG  88           HD2      ARG  88  17.523   3.235   2.143
    8    HD3  ARG  88           HD3      ARG  88  16.390   4.123   1.120
    9    HE   ARG  88           HE       ARG  88  18.806   5.154   2.152
   10   HH21  ARG  88          HH11      ARG  88  19.179   7.368   1.959
   11   HH22  ARG  88          HH12      ARG  88  17.841   8.458   1.828
   12   HH11  ARG  88          HH21      ARG  88  15.475   5.951   1.900
   13   HH12  ARG  88          HH22      ARG  88  15.742   7.652   1.770

  No H/Q in entry =          13
  In of MODEL   37
    1    H    GLU  89           H        GLU  89  12.693   5.750   1.159
    2    HA   GLU  89           HA       GLU  89  14.269   8.091   0.995
    3    HB2  GLU  89           HB2      GLU  89  13.097   7.068  -0.946
    4    HB3  GLU  89           HB3      GLU  89  11.564   7.628  -0.275
    5    HG2  GLU  89           HG2      GLU  89  12.295   9.957  -0.439
    6    HG3  GLU  89           HG3      GLU  89  13.888   9.446  -0.988

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LEU  90           H        LEU  90  10.942   7.622   2.149
    2    HA   LEU  90           HA       LEU  90  10.467  10.360   2.734
    3    HB2  LEU  90           HB2      LEU  90   9.247   7.800   3.765
    4    HB3  LEU  90           HB3      LEU  90   8.640   9.403   4.196
    5    HG   LEU  90           HG       LEU  90   9.025   8.523   1.322
    6   HD12  LEU  90          HD11      LEU  90   6.487   8.227   1.403
    7   HD11  LEU  90          HD12      LEU  90   6.655   8.211   3.159
    8   HD13  LEU  90          HD13      LEU  90   7.450   6.973   2.185
    9   HD22  LEU  90          HD21      LEU  90   8.760  10.835   1.255
   10   HD21  LEU  90          HD22      LEU  90   7.785  10.877   2.723
   11   HD23  LEU  90          HD23      LEU  90   7.069  10.335   1.206

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  91           H        ILE  91  11.709   7.659   4.641
    2    HA   ILE  91           HA       ILE  91  11.886   9.017   7.111
    3    HB   ILE  91           HB       ILE  91  13.401   6.661   5.971
    4   HG12  ILE  91          HG12      ILE  91  11.405   6.850   8.246
    5   HG13  ILE  91          HG13      ILE  91  10.918   6.578   6.573
    6   HG22  ILE  91          HG21      ILE  91  13.889   6.436   8.607
    7   HG21  ILE  91          HG22      ILE  91  13.835   8.195   8.510
    8   HG23  ILE  91          HG23      ILE  91  14.994   7.294   7.535
    9   HD13  ILE  91          HD11      ILE  91  11.893   4.464   6.491
   10   HD12  ILE  91          HD12      ILE  91  11.313   4.526   8.156
   11   HD11  ILE  91          HD13      ILE  91  13.016   4.818   7.805

  No H/Q in entry =          11
  In of MODEL   37
    1    H    THR  92           H        THR  92  14.080   8.825   4.342
    2    HA   THR  92           HA       THR  92  16.272  10.187   5.487
    3    HB   THR  92           HB       THR  92  15.262  10.081   2.634
    4    HG1  THR  92           HG1      THR  92  16.072   8.173   3.029
    5   HG22  THR  92          HG21      THR  92  17.838  10.739   2.322
    6   HG21  THR  92          HG22      THR  92  17.553  11.561   3.855
    7   HG23  THR  92          HG23      THR  92  16.577  11.964   2.443

  No H/Q in entry =           7
  In of MODEL   37
    1    H    GLU  93           H        GLU  93  13.386  11.382   3.783
    2    HA   GLU  93           HA       GLU  93  14.017  14.134   3.898
    3    HB2  GLU  93           HB2      GLU  93  11.296  12.796   3.930
    4    HB3  GLU  93           HB3      GLU  93  11.603  14.493   3.560
    5    HG2  GLU  93           HG2      GLU  93  12.900  12.237   2.017
    6    HG3  GLU  93           HG3      GLU  93  11.358  12.940   1.544

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LEU  94           H        LEU  94  12.264  11.996   6.118
    2    HA   LEU  94           HA       LEU  94  11.495  13.949   8.005
    3    HB2  LEU  94           HB2      LEU  94  12.035  10.986   8.268
    4    HB3  LEU  94           HB3      LEU  94  11.486  11.966   9.625
    5    HG   LEU  94           HG       LEU  94   9.982  12.042   7.008
    6   HD11  LEU  94          HD11      LEU  94  10.052   9.816   9.007
    7   HD13  LEU  94          HD12      LEU  94   9.736   9.762   7.275
    8   HD12  LEU  94          HD13      LEU  94   8.473  10.293   8.384
    9   HD23  LEU  94          HD21      LEU  94   8.081  12.463   8.624
   10   HD22  LEU  94          HD22      LEU  94   9.336  13.701   8.654
   11   HD21  LEU  94          HD23      LEU  94   9.268  12.483   9.926

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  95           H        ILE  95  14.441  11.982   7.741
    2    HA   ILE  95           HA       ILE  95  15.640  12.884  10.147
    3    HB   ILE  95           HB       ILE  95  16.845  11.804   7.587
    4   HG12  ILE  95          HG12      ILE  95  16.556  10.601  10.354
    5   HG13  ILE  95          HG13      ILE  95  15.375  10.361   9.068
    6   HG21  ILE  95          HG21      ILE  95  18.131  12.589  10.221
    7   HG23  ILE  95          HG22      ILE  95  18.588  13.115   8.599
    8   HG22  ILE  95          HG23      ILE  95  18.877  11.450   9.101
    9   HD13  ILE  95          HD11      ILE  95  16.829   9.066   7.791
   10   HD12  ILE  95          HD12      ILE  95  17.309   8.608   9.422
   11   HD11  ILE  95          HD13      ILE  95  18.270   9.777   8.518

  No H/Q in entry =          11
  In of MODEL   37
    1    H    GLU  96           H        GLU  96  15.784  14.122   6.814
    2    HA   GLU  96           HA       GLU  96  17.661  16.176   7.280
    3    HB2  GLU  96           HB2      GLU  96  16.970  15.527   5.025
    4    HB3  GLU  96           HB3      GLU  96  15.336  16.104   5.340
    5    HG2  GLU  96           HG2      GLU  96  15.926  18.227   4.797
    6    HG3  GLU  96           HG3      GLU  96  17.234  18.208   5.969

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LEU  97           H        LEU  97  14.151  16.033   7.738
    2    HA   LEU  97           HA       LEU  97  13.775  18.771   8.388
    3    HB2  LEU  97           HB2      LEU  97  12.229  16.263   9.009
    4    HB3  LEU  97           HB3      LEU  97  11.742  17.815   9.688
    5    HG   LEU  97           HG       LEU  97  12.195  17.399   6.718
    6   HD12  LEU  97          HD11      LEU  97   9.670  17.304   6.621
    7   HD11  LEU  97          HD12      LEU  97   9.675  17.101   8.370
    8   HD13  LEU  97          HD13      LEU  97  10.431  15.886   7.339
    9   HD23  LEU  97          HD21      LEU  97  10.483  19.386   6.769
   10   HD22  LEU  97          HD22      LEU  97  12.172  19.723   7.149
   11   HD21  LEU  97          HD23      LEU  97  10.992  19.565   8.448

  No H/Q in entry =          11
  In of MODEL   37
    1    H    HIS  98           H        HIS  98  14.576  15.930  10.371
    2    HA   HIS  98           HA       HIS  98  14.455  17.187  12.891
    3    HB2  HIS  98           HB2      HIS  98  16.167  14.909  11.871
    4    HB3  HIS  98           HB3      HIS  98  16.186  15.444  13.553
    5    HD1  HIS  98           HD1      HIS  98  13.945  13.849  10.975
    6    HD2  HIS  98           HD2      HIS  98  13.883  14.761  15.043
    7    HE1  HIS  98           HE1      HIS  98  11.913  12.679  11.942
    8    HE2  HIS  98           HE2      HIS  98  11.855  13.226  14.415

  No H/Q in entry =           8
  In of MODEL   37
    1    H    GLU  99           H        GLU  99  16.987  17.044  10.435
    2    HA   GLU  99           HA       GLU  99  19.002  18.346  11.951
    3    HB2  GLU  99           HB2      GLU  99  19.448  17.057   9.875
    4    HB3  GLU  99           HB3      GLU  99  18.647  18.324   8.944
    5    HG2  GLU  99           HG2      GLU  99  20.283  19.972   9.725
    6    HG3  GLU  99           HG3      GLU  99  21.054  18.758  10.739

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LYS 100           H        LYS 100  16.476  19.547   9.758
    2    HA   LYS 100           HA       LYS 100  17.310  22.273   9.901
    3    HB2  LYS 100           HB2      LYS 100  14.655  21.020   9.165
    4    HB3  LYS 100           HB3      LYS 100  14.977  22.755   9.076
    5    HG2  LYS 100           HG2      LYS 100  16.931  22.283   7.592
    6    HG3  LYS 100           HG3      LYS 100  16.494  20.572   7.610
    7    HD2  LYS 100           HD2      LYS 100  14.298  21.113   6.629
    8    HD3  LYS 100           HD3      LYS 100  14.717  22.826   6.618
    9    HE2  LYS 100           HE2      LYS 100  16.658  22.323   5.142
   10    HE3  LYS 100           HE3      LYS 100  16.170  20.625   5.109
   11    HZ1  LYS 100           HZ1      LYS 100  14.367  22.844   4.293
   12    HZ3  LYS 100           HZ2      LYS 100  14.159  21.177   4.029
   13    HZ2  LYS 100           HZ3      LYS 100  15.374  22.025   3.200

  No H/Q in entry =          13
  In of MODEL   37
    1    H    LEU 101           H        LEU 101  15.202  20.250  11.879
    2    HA   LEU 101           HA       LEU 101  14.077  22.330  13.471
    3    HB2  LEU 101           HB2      LEU 101  14.482  19.374  13.845
    4    HB3  LEU 101           HB3      LEU 101  13.971  20.359  15.212
    5    HG   LEU 101           HG       LEU 101  12.532  20.472  12.555
    6   HD12  LEU 101          HD11      LEU 101  10.862  18.928  13.834
    7   HD11  LEU 101          HD12      LEU 101  12.259  18.494  14.817
    8   HD13  LEU 101          HD13      LEU 101  12.274  18.191  13.079
    9   HD21  LEU 101          HD21      LEU 101  11.909  21.267  15.415
   10   HD23  LEU 101          HD22      LEU 101  10.636  21.062  14.214
   11   HD22  LEU 101          HD23      LEU 101  11.885  22.280  13.969

  No H/Q in entry =          11
  In of MODEL   37
    1    H    LYS 102           H        LYS 102  17.212  21.681  13.007
    2    HA   LYS 102           HA       LYS 102  19.079  22.524  14.067
    3    HB2  LYS 102           HB2      LYS 102  17.295  24.061  15.218
    4    HB3  LYS 102           HB3      LYS 102  17.499  22.993  16.591
    5    HG2  LYS 102           HG2      LYS 102  19.410  24.980  15.411
    6    HG3  LYS 102           HG3      LYS 102  19.037  24.667  17.092
    7    HD2  LYS 102           HD2      LYS 102  20.664  22.736  15.388
    8    HD3  LYS 102           HD3      LYS 102  21.379  24.046  16.318
    9    HE2  LYS 102           HE2      LYS 102  20.954  21.501  17.285
   10    HE3  LYS 102           HE3      LYS 102  21.200  22.938  18.277
   11    HZ2  LYS 102           HZ1      LYS 102  19.219  21.679  18.909
   12    HZ1  LYS 102           HZ2      LYS 102  18.566  21.922  17.366
   13    HZ3  LYS 102           HZ3      LYS 102  18.823  23.246  18.392

  No H/Q in entry =          13
  In of MODEL   37
    1    H    ALA 103           H        ALA 103  17.005  20.942  16.502
    2    HA   ALA 103           HA       ALA 103  18.729  19.703  18.140
    3    HB2  ALA 103           HB1      ALA 103  17.117  17.718  18.143
    4    HB1  ALA 103           HB2      ALA 103  16.223  18.586  16.895
    5    HB3  ALA 103           HB3      ALA 103  16.425  19.301  18.493

  No H/Q in entry =           5
  In of MODEL   37
    1    H1   ALA   1           H3       ALA   1  -1.895  -6.779 -21.375
    2    H2   ALA   1           H2       ALA   1  -2.706  -8.204 -20.918
    3    H3   ALA   1           H1       ALA   1  -1.104  -8.275 -21.486
    4    HA   ALA   1           HA       ALA   1  -1.961  -8.728 -23.477
    5    HB1  ALA   1           HB1      ALA   1  -4.104  -9.417 -22.988
    6    HB2  ALA   1           HB2      ALA   1  -4.527  -7.898 -23.778
    7    HB3  ALA   1           HB3      ALA   1  -4.453  -7.984 -22.020

  No H/Q in entry =           7
  In of MODEL   37
    1    H    GLU   2           H        GLU   2  -2.790  -7.521 -25.457
    2    HA   GLU   2           HA       GLU   2  -1.369  -5.525 -26.341
    3    HB2  GLU   2           HB2      GLU   2  -4.380  -5.548 -26.634
    4    HB3  GLU   2           HB3      GLU   2  -3.255  -4.699 -27.691
    5    HG2  GLU   2           HG2      GLU   2  -2.788  -6.593 -28.854
    6    HG3  GLU   2           HG3      GLU   2  -2.492  -7.507 -27.381

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLU   3           H        GLU   3  -4.504  -4.225 -25.412
    2    HA   GLU   3           HA       GLU   3  -3.416  -1.686 -24.786
    3    HB2  GLU   3           HB2      GLU   3  -6.120  -2.963 -24.436
    4    HB3  GLU   3           HB3      GLU   3  -5.794  -1.354 -23.788
    5    HG2  GLU   3           HG2      GLU   3  -5.441  -0.427 -25.914
    6    HG3  GLU   3           HG3      GLU   3  -5.074  -1.986 -26.646

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LEU   4           H        LEU   4  -5.023  -4.028 -22.599
    2    HA   LEU   4           HA       LEU   4  -4.621  -2.811 -20.208
    3    HB2  LEU   4           HB2      LEU   4  -4.124  -5.758 -20.689
    4    HB3  LEU   4           HB3      LEU   4  -4.507  -5.010 -19.140
    5    HG   LEU   4           HG       LEU   4  -6.300  -5.052 -21.590
    6   HD13  LEU   4          HD11      LEU   4  -7.510  -6.755 -20.587
    7   HD12  LEU   4          HD12      LEU   4  -7.006  -6.307 -18.959
    8   HD11  LEU   4          HD13      LEU   4  -5.890  -7.163 -20.021
    9   HD23  LEU   4          HD21      LEU   4  -7.958  -4.222 -19.707
   10   HD22  LEU   4          HD22      LEU   4  -6.910  -3.064 -20.523
   11   HD21  LEU   4          HD23      LEU   4  -6.479  -3.664 -18.922

  No H/Q in entry =          11
  In of MODEL   37
    1    H    GLU   5           H        GLU   5  -2.164  -4.685 -21.964
    2    HA   GLU   5           HA       GLU   5  -0.160  -4.435 -19.942
    3    HB2  GLU   5           HB2      GLU   5  -0.131  -6.202 -21.693
    4    HB3  GLU   5           HB3      GLU   5   0.181  -4.962 -22.908
    5    HG2  GLU   5           HG2      GLU   5   2.266  -4.343 -21.772
    6    HG3  GLU   5           HG3      GLU   5   1.955  -5.542 -20.517

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLU   6           H        GLU   6  -0.795  -2.705 -22.978
    2    HA   GLU   6           HA       GLU   6   1.403  -0.905 -22.723
    3    HB2  GLU   6           HB2      GLU   6  -1.170  -0.766 -24.310
    4    HB3  GLU   6           HB3      GLU   6   0.112   0.440 -24.425
    5    HG2  GLU   6           HG2      GLU   6   1.707  -1.279 -25.125
    6    HG3  GLU   6           HG3      GLU   6   0.476  -2.526 -24.936

  No H/Q in entry =           6
  In of MODEL   37
    1    H    VAL   7           H        VAL   7  -1.928  -0.931 -21.651
    2    HA   VAL   7           HA       VAL   7  -2.103   1.782 -20.806
    3    HB   VAL   7           HB       VAL   7  -3.595  -0.716 -19.964
    4   HG11  VAL   7          HG11      VAL   7  -3.922   2.175 -19.140
    5   HG13  VAL   7          HG12      VAL   7  -3.835   0.747 -18.109
    6   HG12  VAL   7          HG13      VAL   7  -5.271   1.039 -19.089
    7   HG21  VAL   7          HG21      VAL   7  -3.755   0.368 -22.349
    8   HG23  VAL   7          HG22      VAL   7  -4.676   1.628 -21.526
    9   HG22  VAL   7          HG23      VAL   7  -5.246  -0.041 -21.499

  No H/Q in entry =           9
  In of MODEL   37
    1    H    VAL   8           H        VAL   8  -1.146  -1.221 -19.178
    2    HA   VAL   8           HA       VAL   8  -0.791  -0.153 -16.583
    3    HB   VAL   8           HB       VAL   8   0.488  -2.507 -17.986
    4   HG12  VAL   8          HG11      VAL   8   1.108  -3.153 -15.573
    5   HG11  VAL   8          HG12      VAL   8   0.831  -1.458 -15.171
    6   HG13  VAL   8          HG13      VAL   8   2.083  -1.895 -16.332
    7   HG23  VAL   8          HG21      VAL   8  -1.429  -2.607 -15.643
    8   HG22  VAL   8          HG22      VAL   8  -1.135  -3.818 -16.887
    9   HG21  VAL   8          HG23      VAL   8  -2.060  -2.371 -17.272

  No H/Q in entry =           9
  In of MODEL   37
    1    H    MET   9           H        MET   9   1.431  -0.479 -19.349
    2    HA   MET   9           HA       MET   9   3.742   0.527 -18.104
    3    HB2  MET   9           HB2      MET   9   2.774   0.595 -20.962
    4    HB3  MET   9           HB3      MET   9   4.315   1.307 -20.486
    5    HG2  MET   9           HG2      MET   9   5.061  -0.846 -19.582
    6    HG3  MET   9           HG3      MET   9   3.502  -1.571 -19.976
    7    HE2  MET   9           HE1      MET   9   7.131  -1.063 -21.352
    8    HE1  MET   9           HE2      MET   9   6.343   0.502 -21.181
    9    HE3  MET   9           HE3      MET   9   6.777  -0.087 -22.783

  No H/Q in entry =           9
  In of MODEL   37
    1    H    GLY  10           H        GLY  10   1.069   2.173 -19.755
    2    HA3  GLY  10           HA2      GLY  10   2.074   4.811 -19.512
    3    HA2  GLY  10           HA3      GLY  10   0.376   4.377 -19.704

  No H/Q in entry =           3
  In of MODEL   37
    1    H    LEU  11           H        LEU  11  -0.027   2.850 -17.418
    2    HA   LEU  11           HA       LEU  11  -0.511   4.830 -15.449
    3    HB2  LEU  11           HB2      LEU  11  -0.489   1.813 -15.302
    4    HB3  LEU  11           HB3      LEU  11  -0.971   2.840 -13.952
    5    HG   LEU  11           HG       LEU  11  -2.231   2.980 -16.705
    6   HD13  LEU  11          HD11      LEU  11  -2.841   0.844 -15.950
    7   HD12  LEU  11          HD12      LEU  11  -4.171   1.855 -15.391
    8   HD11  LEU  11          HD13      LEU  11  -2.913   1.352 -14.263
    9   HD22  LEU  11          HD21      LEU  11  -2.782   5.002 -15.688
   10   HD21  LEU  11          HD22      LEU  11  -2.703   4.330 -14.059
   11   HD23  LEU  11          HD23      LEU  11  -4.093   3.989 -15.091

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  12           H        ILE  12   1.991   2.325 -15.720
    2    HA   ILE  12           HA       ILE  12   3.226   2.837 -13.225
    3    HB   ILE  12           HB       ILE  12   4.446   1.787 -15.800
    4   HG12  ILE  12          HG12      ILE  12   2.417   0.587 -14.640
    5   HG13  ILE  12          HG13      ILE  12   3.790  -0.370 -15.159
    6   HG21  ILE  12          HG21      ILE  12   5.433   1.719 -12.931
    7   HG23  ILE  12          HG22      ILE  12   6.224   2.476 -14.313
    8   HG22  ILE  12          HG23      ILE  12   6.103   0.719 -14.218
    9   HD11  ILE  12          HD11      ILE  12   3.404   0.712 -12.356
   10   HD13  ILE  12          HD12      ILE  12   4.647  -0.418 -12.892
   11   HD12  ILE  12          HD13      ILE  12   2.968  -0.911 -12.859

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  13           H        ILE  13   3.819   4.099 -16.484
    2    HA   ILE  13           HA       ILE  13   5.990   5.784 -15.773
    3    HB   ILE  13           HB       ILE  13   3.942   5.900 -18.001
    4   HG12  ILE  13          HG12      ILE  13   5.713   4.020 -17.777
    5   HG13  ILE  13          HG13      ILE  13   5.544   4.824 -19.334
    6   HG23  ILE  13          HG21      ILE  13   4.637   8.150 -17.858
    7   HG22  ILE  13          HG22      ILE  13   5.702   7.469 -19.083
    8   HG21  ILE  13          HG23      ILE  13   6.296   7.714 -17.441
    9   HD11  ILE  13          HD11      ILE  13   7.499   6.058 -17.454
   10   HD13  ILE  13          HD12      ILE  13   7.600   5.815 -19.194
   11   HD12  ILE  13          HD13      ILE  13   7.930   4.476 -18.101

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ASN  14           H        ASN  14   2.489   6.334 -16.009
    2    HA   ASN  14           HA       ASN  14   2.495   9.079 -15.365
    3    HB2  ASN  14           HB2      ASN  14   0.569   7.469 -16.183
    4    HB3  ASN  14           HB3      ASN  14   0.260   7.291 -14.460
    5   HD21  ASN  14          HD21      ASN  14  -1.754   8.482 -15.872
    6   HD22  ASN  14          HD22      ASN  14  -1.788  10.156 -15.599

  No H/Q in entry =           6
  In of MODEL   37
    1    H    SER  15           H        SER  15   2.173   6.201 -13.293
    2    HA   SER  15           HA       SER  15   1.909   7.569 -10.838
    3    HB2  SER  15           HB2      SER  15   2.434   5.472  -9.799
    4    HB3  SER  15           HB3      SER  15   1.587   5.070 -11.289
    5    HG   SER  15           HG       SER  15   3.317   4.101 -11.942

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLY  16           H        GLY  16   4.752   6.433 -12.626
    2    HA3  GLY  16           HA2      GLY  16   6.705   7.155 -10.710
    3    HA2  GLY  16           HA3      GLY  16   6.990   6.952 -12.437

  No H/Q in entry =           3
  In of MODEL   37
    1    H    GLN  17           H        GLN  17   5.322   8.938 -13.480
    2    HA   GLN  17           HA       GLN  17   6.936  11.255 -13.179
    3    HB2  GLN  17           HB2      GLN  17   5.579  10.787 -15.208
    4    HB3  GLN  17           HB3      GLN  17   4.111  11.058 -14.267
    5    HG2  GLN  17           HG2      GLN  17   4.667  13.096 -15.480
    6    HG3  GLN  17           HG3      GLN  17   4.905  13.363 -13.753
    7   HE21  GLN  17          HE21      GLN  17   6.605  14.922 -13.884
    8   HE22  GLN  17          HE22      GLN  17   8.121  14.577 -14.564

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ALA  18           H        ALA  18   3.833  10.280 -11.806
    2    HA   ALA  18           HA       ALA  18   3.154  12.675 -10.527
    3    HB1  ALA  18           HB1      ALA  18   1.987  10.236 -10.746
    4    HB2  ALA  18           HB2      ALA  18   1.467  11.461  -9.591
    5    HB3  ALA  18           HB3      ALA  18   2.543  10.161  -9.074

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ARG  19           H        ARG  19   4.999   9.882  -9.272
    2    HA   ARG  19           HA       ARG  19   5.570  11.025  -6.752
    3    HB2  ARG  19           HB2      ARG  19   5.945   8.618  -7.288
    4    HB3  ARG  19           HB3      ARG  19   7.299   9.088  -8.320
    5    HG2  ARG  19           HG2      ARG  19   8.450  10.106  -6.405
    6    HG3  ARG  19           HG3      ARG  19   7.078   9.735  -5.362
    7    HD2  ARG  19           HD2      ARG  19   8.820   8.074  -5.024
    8    HD3  ARG  19           HD3      ARG  19   7.428   7.314  -5.800
    9    HE   ARG  19           HE       ARG  19   9.126   8.114  -7.860
   10   HH21  ARG  19          HH11      ARG  19  10.659   6.689  -8.728
   11   HH22  ARG  19          HH12      ARG  19  11.193   5.331  -7.800
   12   HH11  ARG  19          HH21      ARG  19   9.193   6.075  -5.088
   13   HH12  ARG  19          HH22      ARG  19  10.361   4.983  -5.738

  No H/Q in entry =          13
  In of MODEL   37
    1    H    SER  20           H        SER  20   7.361  11.038  -9.816
    2    HA   SER  20           HA       SER  20   9.632  12.420  -9.008
    3    HB2  SER  20           HB2      SER  20   9.072  11.404 -11.318
    4    HB3  SER  20           HB3      SER  20   8.310  12.954 -11.659
    5    HG   SER  20           HG       SER  20  10.256  13.962 -11.367

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU  21           H        LEU  21   6.541  13.734 -10.175
    2    HA   LEU  21           HA       LEU  21   7.250  16.470  -9.950
    3    HB2  LEU  21           HB2      LEU  21   4.565  15.081  -9.852
    4    HB3  LEU  21           HB3      LEU  21   4.754  16.832  -9.849
    5    HG   LEU  21           HG       LEU  21   5.921  15.040 -11.998
    6   HD12  LEU  21          HD11      LEU  21   3.341  16.638 -12.064
    7   HD11  LEU  21          HD12      LEU  21   3.438  14.882 -11.923
    8   HD13  LEU  21          HD13      LEU  21   4.010  15.681 -13.386
    9   HD22  LEU  21          HD21      LEU  21   7.059  17.086 -12.155
   10   HD21  LEU  21          HD22      LEU  21   5.681  18.027 -11.593
   11   HD23  LEU  21          HD23      LEU  21   5.693  17.381 -13.227

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ALA  22           H        ALA  22   5.727  14.195  -7.694
    2    HA   ALA  22           HA       ALA  22   5.166  16.005  -5.617
    3    HB3  ALA  22           HB1      ALA  22   4.373  13.623  -5.780
    4    HB2  ALA  22           HB2      ALA  22   4.981  14.083  -4.189
    5    HB1  ALA  22           HB3      ALA  22   5.982  13.114  -5.272

  No H/Q in entry =           5
  In of MODEL   37
    1    H    TYR  23           H        TYR  23   8.070  13.943  -6.087
    2    HA   TYR  23           HA       TYR  23   9.485  14.938  -3.844
    3    HB2  TYR  23           HB2      TYR  23  10.236  12.924  -5.013
    4    HB3  TYR  23           HB3      TYR  23  10.550  13.863  -6.473
    5    HD1  TYR  23           HD1      TYR  23  11.549  13.478  -2.899
    6    HD2  TYR  23           HD2      TYR  23  12.587  15.034  -6.767
    7    HE1  TYR  23           HE1      TYR  23  13.821  14.025  -2.069
    8    HE2  TYR  23           HE2      TYR  23  14.859  15.582  -5.936
    9    HH   TYR  23           HH       TYR  23  16.136  14.341  -3.126

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ALA  24           H        ALA  24   9.287  16.056  -7.205
    2    HA   ALA  24           HA       ALA  24  11.210  18.118  -6.971
    3    HB2  ALA  24           HB1      ALA  24  10.749  18.191  -9.175
    4    HB3  ALA  24           HB2      ALA  24   9.206  18.958  -8.800
    5    HB1  ALA  24           HB3      ALA  24   9.309  17.204  -8.936

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA  25           H        ALA  25   7.735  17.973  -6.320
    2    HA   ALA  25           HA       ALA  25   7.292  20.695  -5.739
    3    HB1  ALA  25           HB1      ALA  25   5.606  18.717  -5.931
    4    HB2  ALA  25           HB2      ALA  25   5.263  20.007  -4.776
    5    HB3  ALA  25           HB3      ALA  25   5.940  18.477  -4.215

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU  26           H        LEU  26   8.347  17.998  -3.706
    2    HA   LEU  26           HA       LEU  26   8.490  19.422  -1.266
    3    HB2  LEU  26           HB2      LEU  26   8.557  17.004  -1.267
    4    HB3  LEU  26           HB3      LEU  26  10.019  16.998  -2.251
    5    HG   LEU  26           HG       LEU  26  11.263  18.097  -0.419
    6   HD12  LEU  26          HD11      LEU  26  10.056  18.113   1.852
    7   HD11  LEU  26          HD12      LEU  26   8.559  17.995   0.930
    8   HD13  LEU  26          HD13      LEU  26   9.618  19.389   0.715
    9   HD21  LEU  26          HD21      LEU  26   9.709  15.645   0.462
   10   HD23  LEU  26          HD22      LEU  26  11.237  16.188   1.147
   11   HD22  LEU  26          HD23      LEU  26  11.170  15.634  -0.524

  No H/Q in entry =          11
  In of MODEL   37
    1    H    LYS  27           H        LYS  27  10.878  18.828  -3.813
    2    HA   LYS  27           HA       LYS  27  13.086  20.042  -2.602
    3    HB2  LYS  27           HB2      LYS  27  13.154  18.699  -4.696
    4    HB3  LYS  27           HB3      LYS  27  12.396  20.042  -5.551
    5    HG2  LYS  27           HG2      LYS  27  14.283  21.505  -4.986
    6    HG3  LYS  27           HG3      LYS  27  15.037  20.203  -4.060
    7    HD2  LYS  27           HD2      LYS  27  15.147  18.819  -6.118
    8    HD3  LYS  27           HD3      LYS  27  14.438  20.147  -7.037
    9    HE2  LYS  27           HE2      LYS  27  16.347  21.591  -6.438
   10    HE3  LYS  27           HE3      LYS  27  17.060  20.267  -5.510
   11    HZ3  LYS  27           HZ1      LYS  27  18.031  20.361  -7.705
   12    HZ2  LYS  27           HZ2      LYS  27  16.497  20.261  -8.432
   13    HZ1  LYS  27           HZ3      LYS  27  17.114  18.942  -7.556

  No H/Q in entry =          13
  In of MODEL   37
    1    H    GLN  28           H        GLN  28  10.461  21.457  -4.524
    2    HA   GLN  28           HA       GLN  28  11.447  24.099  -4.680
    3    HB2  GLN  28           HB2      GLN  28   8.604  23.058  -4.545
    4    HB3  GLN  28           HB3      GLN  28   9.031  24.727  -4.919
    5    HG2  GLN  28           HG2      GLN  28  10.002  22.316  -6.479
    6    HG3  GLN  28           HG3      GLN  28   8.658  23.347  -6.966
    7   HE21  GLN  28          HE21      GLN  28  11.800  22.864  -7.718
    8   HE22  GLN  28          HE22      GLN  28  12.271  24.450  -8.099

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ALA  29           H        ALA  29   9.519  22.421  -2.230
    2    HA   ALA  29           HA       ALA  29   9.008  24.615  -0.538
    3    HB2  ALA  29           HB1      ALA  29   8.276  23.050   1.033
    4    HB1  ALA  29           HB2      ALA  29   9.481  21.855   0.554
    5    HB3  ALA  29           HB3      ALA  29   8.089  22.165  -0.481

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LYS  30           H        LYS  30  11.714  22.320  -0.637
    2    HA   LYS  30           HA       LYS  30  13.062  23.255   1.656
    3    HB2  LYS  30           HB2      LYS  30  14.123  21.964  -0.867
    4    HB3  LYS  30           HB3      LYS  30  15.122  22.310   0.546
    5    HG2  LYS  30           HG2      LYS  30  13.567  20.939   1.937
    6    HG3  LYS  30           HG3      LYS  30  12.664  20.530   0.474
    7    HD2  LYS  30           HD2      LYS  30  14.690  19.525  -0.508
    8    HD3  LYS  30           HD3      LYS  30  15.611  19.948   0.937
    9    HE2  LYS  30           HE2      LYS  30  14.104  18.529   2.302
   10    HE3  LYS  30           HE3      LYS  30  13.213  18.086   0.841
   11    HZ2  LYS  30           HZ1      LYS  30  14.995  16.488   1.582
   12    HZ1  LYS  30           HZ2      LYS  30  16.140  17.664   1.123
   13    HZ3  LYS  30           HZ3      LYS  30  15.087  16.994  -0.034

  No H/Q in entry =          13
  In of MODEL   37
    1    H    GLN  31           H        GLN  31  12.936  24.469  -1.637
    2    HA   GLN  31           HA       GLN  31  15.111  26.339  -1.230
    3    HB2  GLN  31           HB2      GLN  31  13.049  26.412  -3.436
    4    HB3  GLN  31           HB3      GLN  31  14.676  27.091  -3.450
    5    HG2  GLN  31           HG2      GLN  31  15.116  24.389  -2.885
    6    HG3  GLN  31           HG3      GLN  31  13.801  24.351  -4.052
    7   HE21  GLN  31          HE21      GLN  31  16.633  23.530  -4.483
    8   HE22  GLN  31          HE22      GLN  31  17.203  24.501  -5.753

  No H/Q in entry =           8
  In of MODEL   37
    1    H    GLY  32           H        GLY  32  12.046  26.185  -0.058
    2    HA3  GLY  32           HA2      GLY  32  10.917  27.762   1.229
    3    HA2  GLY  32           HA3      GLY  32  12.049  28.987   0.672

  No H/Q in entry =           3
  In of MODEL   37
    1    H    ASP  33           H        ASP  33  10.644  27.103  -1.812
    2    HA   ASP  33           HA       ASP  33   8.995  29.394  -2.648
    3    HB2  ASP  33           HB2      ASP  33  10.051  26.968  -4.105
    4    HB3  ASP  33           HB3      ASP  33   8.904  28.096  -4.823

  No H/Q in entry =           4
  In of MODEL   37
    1    H    PHE  34           H        PHE  34   7.316  28.932  -1.070
    2    HA   PHE  34           HA       PHE  34   5.912  26.473  -0.968
    3    HB2  PHE  34           HB2      PHE  34   4.986  29.268  -0.273
    4    HB3  PHE  34           HB3      PHE  34   4.125  27.785   0.143
    5    HD1  PHE  34           HD1      PHE  34   6.410  30.158   1.342
    6    HD2  PHE  34           HD2      PHE  34   5.687  25.924   1.285
    7    HE1  PHE  34           HE1      PHE  34   7.816  29.889   3.366
    8    HE2  PHE  34           HE2      PHE  34   7.096  25.659   3.307
    9    HZ   PHE  34           HZ       PHE  34   8.154  27.642   4.347

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ALA  35           H        ALA  35   5.493  29.346  -2.968
    2    HA   ALA  35           HA       ALA  35   2.926  28.760  -3.971
    3    HB1  ALA  35           HB1      ALA  35   3.974  30.146  -6.015
    4    HB3  ALA  35           HB2      ALA  35   5.206  30.493  -4.802
    5    HB2  ALA  35           HB3      ALA  35   3.522  30.918  -4.495

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA  36           H        ALA  36   6.135  28.058  -5.356
    2    HA   ALA  36           HA       ALA  36   5.112  26.644  -7.594
    3    HB3  ALA  36           HB1      ALA  36   7.267  26.748  -8.229
    4    HB2  ALA  36           HB2      ALA  36   7.750  25.711  -6.885
    5    HB1  ALA  36           HB3      ALA  36   7.664  27.460  -6.665

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA  37           H        ALA  37   6.087  25.632  -4.350
    2    HA   ALA  37           HA       ALA  37   5.997  22.846  -4.785
    3    HB2  ALA  37           HB1      ALA  37   5.775  24.633  -2.401
    4    HB1  ALA  37           HB2      ALA  37   6.893  23.305  -2.706
    5    HB3  ALA  37           HB3      ALA  37   5.232  22.967  -2.221

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LYS  38           H        LYS  38   3.497  25.076  -3.589
    2    HA   LYS  38           HA       LYS  38   1.382  23.283  -3.352
    3    HB2  LYS  38           HB2      LYS  38   1.763  26.035  -3.098
    4    HB3  LYS  38           HB3      LYS  38   0.551  25.903  -4.366
    5    HG2  LYS  38           HG2      LYS  38  -0.899  24.590  -2.914
    6    HG3  LYS  38           HG3      LYS  38   0.356  24.515  -1.669
    7    HD2  LYS  38           HD2      LYS  38   0.197  26.852  -1.214
    8    HD3  LYS  38           HD3      LYS  38  -0.725  27.153  -2.688
    9    HE2  LYS  38           HE2      LYS  38  -2.211  27.198  -0.735
   10    HE3  LYS  38           HE3      LYS  38  -2.607  25.828  -1.776
   11    HZ3  LYS  38           HZ1      LYS  38  -1.883  24.346  -0.253
   12    HZ2  LYS  38           HZ2      LYS  38  -2.211  25.604   0.842
   13    HZ1  LYS  38           HZ3      LYS  38  -0.624  25.339   0.302

  No H/Q in entry =          13
  In of MODEL   37
    1    H    ALA  39           H        ALA  39   2.355  25.183  -6.205
    2    HA   ALA  39           HA       ALA  39   0.255  24.340  -7.891
    3    HB2  ALA  39           HB1      ALA  39   2.988  24.964  -8.968
    4    HB1  ALA  39           HB2      ALA  39   2.041  26.232  -8.191
    5    HB3  ALA  39           HB3      ALA  39   1.407  25.405  -9.614

  No H/Q in entry =           5
  In of MODEL   37
    1    H    MET  40           H        MET  40   3.485  23.008  -7.344
    2    HA   MET  40           HA       MET  40   3.350  20.993  -9.339
    3    HB2  MET  40           HB2      MET  40   4.986  21.195  -6.805
    4    HB3  MET  40           HB3      MET  40   5.214  19.940  -8.024
    5    HG2  MET  40           HG2      MET  40   5.294  22.897  -8.683
    6    HG3  MET  40           HG3      MET  40   6.736  21.979  -8.249
    7    HE3  MET  40           HE1      MET  40   7.561  19.762 -11.071
    8    HE2  MET  40           HE2      MET  40   7.009  19.444  -9.429
    9    HE1  MET  40           HE3      MET  40   8.115  20.782  -9.735

  No H/Q in entry =           9
  In of MODEL   37
    1    H    MET  41           H        MET  41   2.466  21.036  -5.907
    2    HA   MET  41           HA       MET  41   1.910  18.276  -5.631
    3    HB2  MET  41           HB2      MET  41   0.612  20.643  -4.262
    4    HB3  MET  41           HB3      MET  41   0.445  18.966  -3.757
    5    HG2  MET  41           HG2      MET  41   3.157  19.163  -3.818
    6    HG3  MET  41           HG3      MET  41   2.736  20.824  -3.414
    7    HE2  MET  41           HE1      MET  41  -0.300  19.596  -1.665
    8    HE1  MET  41           HE2      MET  41   0.527  21.103  -2.046
    9    HE3  MET  41           HE3      MET  41   0.478  20.529  -0.379

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ASP  42           H        ASP  42  -0.111  21.022  -6.580
    2    HA   ASP  42           HA       ASP  42  -2.566  19.685  -6.698
    3    HB2  ASP  42           HB2      ASP  42  -1.837  22.249  -6.955
    4    HB3  ASP  42           HB3      ASP  42  -2.007  21.860  -8.663

  No H/Q in entry =           4
  In of MODEL   37
    1    H    GLN  43           H        GLN  43  -0.142  20.259  -9.220
    2    HA   GLN  43           HA       GLN  43  -1.560  18.958 -11.300
    3    HB2  GLN  43           HB2      GLN  43   1.406  19.446 -10.944
    4    HB3  GLN  43           HB3      GLN  43   0.673  18.816 -12.421
    5    HG2  GLN  43           HG2      GLN  43  -0.820  20.857 -12.444
    6    HG3  GLN  43           HG3      GLN  43   0.151  21.501 -11.124
    7   HE21  GLN  43          HE21      GLN  43   0.309  23.125 -13.207
    8   HE22  GLN  43          HE22      GLN  43   1.713  22.893 -14.128

  No H/Q in entry =           8
  In of MODEL   37
    1    H    SER  44           H        SER  44   0.801  17.790  -8.933
    2    HA   SER  44           HA       SER  44   1.103  15.183  -9.968
    3    HB2  SER  44           HB2      SER  44   2.031  16.608  -7.736
    4    HB3  SER  44           HB3      SER  44   1.162  15.231  -7.061
    5    HG   SER  44           HG       SER  44   3.263  14.593  -7.508

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ARG  45           H        ARG  45  -1.184  16.517  -7.606
    2    HA   ARG  45           HA       ARG  45  -2.586  14.167  -6.964
    3    HB2  ARG  45           HB2      ARG  45  -2.754  16.334  -5.765
    4    HB3  ARG  45           HB3      ARG  45  -3.617  17.012  -7.143
    5    HG2  ARG  45           HG2      ARG  45  -5.395  15.302  -6.848
    6    HG3  ARG  45           HG3      ARG  45  -4.544  14.679  -5.434
    7    HD2  ARG  45           HD2      ARG  45  -4.721  16.945  -4.371
    8    HD3  ARG  45           HD3      ARG  45  -5.715  17.477  -5.743
    9    HE   ARG  45           HE       ARG  45  -6.837  15.108  -4.699
   10   HH21  ARG  45          HH11      ARG  45  -8.661  15.197  -3.411
   11   HH22  ARG  45          HH12      ARG  45  -9.035  16.638  -2.536
   12   HH11  ARG  45          HH21      ARG  45  -6.254  18.347  -3.672
   13   HH12  ARG  45          HH22      ARG  45  -7.667  18.422  -2.682

  No H/Q in entry =          13
  In of MODEL   37
    1    H    MET  46           H        MET  46  -3.172  16.583  -9.504
    2    HA   MET  46           HA       MET  46  -5.530  15.433 -10.547
    3    HB2  MET  46           HB2      MET  46  -3.424  17.246 -11.735
    4    HB3  MET  46           HB3      MET  46  -4.817  16.702 -12.675
    5    HG2  MET  46           HG2      MET  46  -6.344  17.647 -11.018
    6    HG3  MET  46           HG3      MET  46  -4.990  18.119  -9.998
    7    HE2  MET  46           HE1      MET  46  -6.746  19.795 -13.719
    8    HE1  MET  46           HE2      MET  46  -6.581  18.106 -13.248
    9    HE3  MET  46           HE3      MET  46  -5.330  18.866 -14.230

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ALA  47           H        ALA  47  -2.113  14.926 -11.337
    2    HA   ALA  47           HA       ALA  47  -2.492  13.207 -13.548
    3    HB3  ALA  47           HB1      ALA  47  -0.304  14.078 -13.213
    4    HB2  ALA  47           HB2      ALA  47  -0.175  12.347 -12.885
    5    HB1  ALA  47           HB3      ALA  47  -0.246  13.497 -11.548

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU  48           H        LEU  48  -2.198  12.561 -10.078
    2    HA   LEU  48           HA       LEU  48  -2.317   9.723 -10.242
    3    HB2  LEU  48           HB2      LEU  48  -3.045  11.641  -8.017
    4    HB3  LEU  48           HB3      LEU  48  -2.965   9.890  -7.821
    5    HG   LEU  48           HG       LEU  48  -0.660  11.572  -8.835
    6   HD13  LEU  48          HD11      LEU  48  -0.917  12.339  -6.640
    7   HD12  LEU  48          HD12      LEU  48   0.237  11.022  -6.455
    8   HD11  LEU  48          HD13      LEU  48  -1.460  10.772  -6.043
    9   HD22  LEU  48          HD21      LEU  48  -0.186   9.384  -9.485
   10   HD21  LEU  48          HD22      LEU  48  -1.049   8.673  -8.123
   11   HD23  LEU  48          HD23      LEU  48   0.532   9.412  -7.875

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ASN  49           H        ASN  49  -4.756  12.234  -9.813
    2    HA   ASN  49           HA       ASN  49  -6.951  10.587  -9.258
    3    HB2  ASN  49           HB2      ASN  49  -6.965  13.019  -8.937
    4    HB3  ASN  49           HB3      ASN  49  -6.853  13.266 -10.675
    5   HD21  ASN  49          HD21      ASN  49  -8.917  14.395 -10.703
    6   HD22  ASN  49          HD22      ASN  49 -10.379  13.557 -10.517

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLU  50           H        GLU  50  -5.688  11.780 -12.354
    2    HA   GLU  50           HA       GLU  50  -7.667  10.545 -13.985
    3    HB2  GLU  50           HB2      GLU  50  -6.194  12.354 -14.808
    4    HB3  GLU  50           HB3      GLU  50  -4.808  11.270 -14.685
    5    HG2  GLU  50           HG2      GLU  50  -5.808   9.746 -16.316
    6    HG3  GLU  50           HG3      GLU  50  -7.261  10.737 -16.389

  No H/Q in entry =           6
  In of MODEL   37
    1    H    ALA  51           H        ALA  51  -4.495   9.523 -12.810
    2    HA   ALA  51           HA       ALA  51  -4.388   7.073 -14.235
    3    HB2  ALA  51           HB1      ALA  51  -2.401   6.766 -13.152
    4    HB1  ALA  51           HB2      ALA  51  -3.071   7.190 -11.578
    5    HB3  ALA  51           HB3      ALA  51  -2.615   8.460 -12.713

  No H/Q in entry =           5
  In of MODEL   37
    1    H    HIS  52           H        HIS  52  -5.526   7.907 -10.974
    2    HA   HIS  52           HA       HIS  52  -6.226   5.301 -10.142
    3    HB2  HIS  52           HB2      HIS  52  -6.057   7.272  -8.637
    4    HB3  HIS  52           HB3      HIS  52  -7.531   7.917  -9.359
    5    HD1  HIS  52           HD1      HIS  52  -9.761   6.626  -8.887
    6    HD2  HIS  52           HD2      HIS  52  -6.457   5.124  -6.839
    7    HE1  HIS  52           HE1      HIS  52 -10.668   5.065  -7.110
    8    HE2  HIS  52           HE2      HIS  52  -8.665   4.141  -5.852

  No H/Q in entry =           8
  In of MODEL   37
    1    H    LEU  53           H        LEU  53  -8.041   7.778 -11.909
    2    HA   LEU  53           HA       LEU  53 -10.557   6.508 -11.903
    3    HB2  LEU  53           HB2      LEU  53  -9.272   8.484 -13.776
    4    HB3  LEU  53           HB3      LEU  53 -10.877   7.832 -14.091
    5    HG   LEU  53           HG       LEU  53 -10.139   9.130 -11.449
    6   HD12  LEU  53          HD11      LEU  53 -11.448  11.102 -12.402
    7   HD11  LEU  53          HD12      LEU  53 -11.262  10.342 -13.983
    8   HD13  LEU  53          HD13      LEU  53  -9.843  10.859 -13.078
    9   HD21  LEU  53          HD21      LEU  53 -12.721   8.305 -12.795
   10   HD23  LEU  53          HD22      LEU  53 -12.705   9.540 -11.541
   11   HD22  LEU  53          HD23      LEU  53 -12.175   7.910 -11.171

  No H/Q in entry =          11
  In of MODEL   37
    1    H    VAL  54           H        VAL  54  -7.828   6.292 -14.164
    2    HA   VAL  54           HA       VAL  54  -9.082   4.537 -16.001
    3    HB   VAL  54           HB       VAL  54  -6.164   5.015 -15.342
    4   HG12  VAL  54          HG11      VAL  54  -5.947   3.934 -17.735
    5   HG11  VAL  54          HG12      VAL  54  -7.479   3.166 -17.321
    6   HG13  VAL  54          HG13      VAL  54  -6.057   2.896 -16.314
    7   HG22  VAL  54          HG21      VAL  54  -6.925   6.968 -16.375
    8   HG21  VAL  54          HG22      VAL  54  -8.134   6.118 -17.335
    9   HG23  VAL  54          HG23      VAL  54  -6.432   6.023 -17.780

  No H/Q in entry =           9
  In of MODEL   37
    1    H    GLN  55           H        GLN  55  -7.064   3.965 -13.119
    2    HA   GLN  55           HA       GLN  55  -7.002   1.149 -13.383
    3    HB2  GLN  55           HB2      GLN  55  -5.425   2.027 -11.875
    4    HB3  GLN  55           HB3      GLN  55  -6.626   3.002 -11.033
    5    HG2  GLN  55           HG2      GLN  55  -7.319   1.248  -9.713
    6    HG3  GLN  55           HG3      GLN  55  -7.116   0.062 -10.996
    7   HE21  GLN  55          HE21      GLN  55  -5.502  -1.404 -10.519
    8   HE22  GLN  55          HE22      GLN  55  -4.107  -1.067  -9.618

  No H/Q in entry =           8
  In of MODEL   37
    1    H    THR  56           H        THR  56  -9.299   3.329 -11.744
    2    HA   THR  56           HA       THR  56 -10.890   1.457 -10.445
    3    HB   THR  56           HB       THR  56 -11.967   3.865 -11.937
    4    HG1  THR  56           HG1      THR  56 -10.742   3.662  -9.387
    5   HG21  THR  56          HG21      THR  56 -13.426   2.035 -10.719
    6   HG23  THR  56          HG22      THR  56 -13.793   3.746 -10.508
    7   HG22  THR  56          HG23      THR  56 -12.893   2.877  -9.264

  No H/Q in entry =           7
  In of MODEL   37
    1    H    LYS  57           H        LYS  57 -11.110   2.550 -13.827
    2    HA   LYS  57           HA       LYS  57 -13.288   0.885 -14.566
    3    HB2  LYS  57           HB2      LYS  57 -12.129   2.879 -15.812
    4    HB3  LYS  57           HB3      LYS  57 -11.040   1.644 -16.428
    5    HG2  LYS  57           HG2      LYS  57 -12.881   0.437 -17.440
    6    HG3  LYS  57           HG3      LYS  57 -14.056   1.521 -16.702
    7    HD2  LYS  57           HD2      LYS  57 -13.814   2.253 -18.969
    8    HD3  LYS  57           HD3      LYS  57 -12.924   3.419 -17.990
    9    HE2  LYS  57           HE2      LYS  57 -10.811   2.416 -18.559
   10    HE3  LYS  57           HE3      LYS  57 -11.591   1.017 -19.295
   11    HZ3  LYS  57           HZ1      LYS  57 -12.286   2.248 -21.103
   12    HZ2  LYS  57           HZ2      LYS  57 -10.737   2.879 -20.801
   13    HZ1  LYS  57           HZ3      LYS  57 -12.119   3.734 -20.304

  No H/Q in entry =          13
  In of MODEL   37
    1    H    LEU  58           H        LEU  58  -9.788   0.421 -14.539
    2    HA   LEU  58           HA       LEU  58  -9.830  -2.093 -15.833
    3    HB2  LEU  58           HB2      LEU  58  -7.769  -0.825 -14.039
    4    HB3  LEU  58           HB3      LEU  58  -7.530  -2.347 -14.898
    5    HG   LEU  58           HG       LEU  58  -8.270   0.268 -16.250
    6   HD11  LEU  58          HD11      LEU  58  -5.630  -0.996 -15.583
    7   HD13  LEU  58          HD12      LEU  58  -6.108   0.700 -15.527
    8   HD12  LEU  58          HD13      LEU  58  -5.789  -0.071 -17.078
    9   HD22  LEU  58          HD21      LEU  58  -8.873  -1.286 -17.839
   10   HD21  LEU  58          HD22      LEU  58  -7.838  -2.544 -17.169
   11   HD23  LEU  58          HD23      LEU  58  -7.144  -1.275 -18.177

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  59           H        ILE  59 -10.616  -1.190 -12.574
    2    HA   ILE  59           HA       ILE  59 -10.283  -3.962 -11.634
    3    HB   ILE  59           HB       ILE  59  -9.808  -1.701 -10.236
    4   HG12  ILE  59          HG12      ILE  59 -11.184  -4.042  -8.901
    5   HG13  ILE  59          HG13      ILE  59  -9.550  -4.137  -9.505
    6   HG21  ILE  59          HG21      ILE  59 -12.348  -1.175 -10.467
    7   HG23  ILE  59          HG22      ILE  59 -11.613  -0.991  -8.892
    8   HG22  ILE  59          HG23      ILE  59 -12.571  -2.422  -9.264
    9   HD13  ILE  59          HD11      ILE  59  -8.866  -2.276  -8.088
   10   HD12  ILE  59          HD12      ILE  59  -9.590  -3.542  -7.104
   11   HD11  ILE  59          HD13      ILE  59 -10.517  -2.094  -7.505

  No H/Q in entry =          11
  In of MODEL   37
    1    H    GLU  60           H        GLU  60 -12.826  -1.622 -12.417
    2    HA   GLU  60           HA       GLU  60 -15.017  -3.120 -11.389
    3    HB2  GLU  60           HB2      GLU  60 -16.331  -1.487 -12.329
    4    HB3  GLU  60           HB3      GLU  60 -14.790  -0.637 -12.378
    5    HG2  GLU  60           HG2      GLU  60 -14.455  -1.569 -14.709
    6    HG3  GLU  60           HG3      GLU  60 -16.107  -2.143 -14.644

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLY  61           H        GLY  61 -13.368  -3.114 -14.518
    2    HA3  GLY  61           HA2      GLY  61 -15.109  -5.341 -15.398
    3    HA2  GLY  61           HA3      GLY  61 -14.263  -4.242 -16.481

  No H/Q in entry =           3
  In of MODEL   37
    1    H    ASP  62           H        ASP  62 -12.882  -5.713 -13.610
    2    HA   ASP  62           HA       ASP  62 -10.578  -6.603 -14.997
    3    HB2  ASP  62           HB2      ASP  62 -10.051  -7.703 -12.815
    4    HB3  ASP  62           HB3      ASP  62 -10.471  -6.001 -12.658

  No H/Q in entry =           4
  In of MODEL   37
    1    H    ALA  63           H        ALA  63 -13.669  -7.981 -14.950
    2    HA   ALA  63           HA       ALA  63 -13.191 -10.757 -14.758
    3    HB1  ALA  63           HB1      ALA  63 -15.143  -9.347 -16.614
    4    HB2  ALA  63           HB2      ALA  63 -15.447  -9.634 -14.902
    5    HB3  ALA  63           HB3      ALA  63 -15.276 -10.998 -16.010

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLY  64           H        GLY  64 -13.180  -8.607 -17.575
    2    HA3  GLY  64           HA2      GLY  64 -12.372  -8.853 -19.708
    3    HA2  GLY  64           HA3      GLY  64 -11.013  -9.648 -18.924

  No H/Q in entry =           3
  In of MODEL   37
    1    H    GLU  65           H        GLU  65 -10.686 -11.236 -20.479
    2    HA   GLU  65           HA       GLU  65 -12.784 -12.762 -21.616
    3    HB2  GLU  65           HB2      GLU  65  -9.816 -13.267 -21.452
    4    HB3  GLU  65           HB3      GLU  65 -10.933 -14.284 -22.362
    5    HG2  GLU  65           HG2      GLU  65 -11.623 -12.381 -23.722
    6    HG3  GLU  65           HG3      GLU  65 -10.608 -11.300 -22.769

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLY  66           H        GLY  66 -10.643 -13.321 -18.927
    2    HA3  GLY  66           HA2      GLY  66 -11.385 -16.002 -18.354
    3    HA2  GLY  66           HA3      GLY  66 -10.508 -14.913 -17.297

  No H/Q in entry =           3
  In of MODEL   37
    1    H    LYS  67           H        LYS  67 -12.346 -16.751 -16.371
    2    HA   LYS  67           HA       LYS  67 -14.940 -15.673 -15.997
    3    HB2  LYS  67           HB2      LYS  67 -13.453 -17.896 -14.608
    4    HB3  LYS  67           HB3      LYS  67 -15.158 -17.521 -14.325
    5    HG2  LYS  67           HG2      LYS  67 -15.620 -17.792 -16.737
    6    HG3  LYS  67           HG3      LYS  67 -13.923 -18.176 -17.018
    7    HD2  LYS  67           HD2      LYS  67 -14.116 -20.164 -15.589
    8    HD3  LYS  67           HD3      LYS  67 -15.804 -19.770 -15.254
    9    HE2  LYS  67           HE2      LYS  67 -15.692 -21.449 -17.036
   10    HE3  LYS  67           HE3      LYS  67 -16.301 -19.927 -17.686
   11    HZ1  LYS  67           HZ1      LYS  67 -13.449 -20.093 -17.777
   12    HZ3  LYS  67           HZ2      LYS  67 -14.552 -19.734 -19.017
   13    HZ2  LYS  67           HZ3      LYS  67 -14.185 -21.350 -18.645

  No H/Q in entry =          13
  In of MODEL   37
    1    H    MET  68           H        MET  68 -13.991 -16.781 -13.059
    2    HA   MET  68           HA       MET  68 -14.683 -14.470 -11.620
    3    HB2  MET  68           HB2      MET  68 -13.339 -17.051 -10.865
    4    HB3  MET  68           HB3      MET  68 -13.663 -15.787  -9.679
    5    HG2  MET  68           HG2      MET  68 -16.050 -15.848 -10.232
    6    HG3  MET  68           HG3      MET  68 -15.747 -17.062 -11.478
    7    HE3  MET  68           HE1      MET  68 -14.140 -16.857  -7.695
    8    HE2  MET  68           HE2      MET  68 -15.638 -17.412  -6.950
    9    HE1  MET  68           HE3      MET  68 -15.650 -15.977  -7.973

  No H/Q in entry =           9
  In of MODEL   37
    1    H    LYS  69           H        LYS  69 -11.440 -15.771 -12.399
    2    HA   LYS  69           HA       LYS  69  -9.958 -14.133 -10.707
    3    HB2  LYS  69           HB2      LYS  69  -8.037 -14.666 -12.153
    4    HB3  LYS  69           HB3      LYS  69  -9.033 -16.090 -11.839
    5    HG2  LYS  69           HG2      LYS  69 -10.190 -15.739 -14.008
    6    HG3  LYS  69           HG3      LYS  69  -9.150 -14.353 -14.324
    7    HD2  LYS  69           HD2      LYS  69  -7.163 -15.872 -14.147
    8    HD3  LYS  69           HD3      LYS  69  -8.274 -17.236 -14.005
    9    HE2  LYS  69           HE2      LYS  69  -8.272 -15.288 -16.328
   10    HE3  LYS  69           HE3      LYS  69  -7.458 -16.851 -16.351
   11    HZ3  LYS  69           HZ1      LYS  69  -9.453 -17.987 -16.242
   12    HZ2  LYS  69           HZ2      LYS  69  -9.829 -16.687 -17.269
   13    HZ1  LYS  69           HZ3      LYS  69 -10.312 -16.655 -15.639

  No H/Q in entry =          13
  In of MODEL   37
    1    H    VAL  70           H        VAL  70  -8.122 -12.613 -11.659
    2    HA   VAL  70           HA       VAL  70  -9.349 -10.551 -13.394
    3    HB   VAL  70           HB       VAL  70  -8.326  -8.844 -11.887
    4   HG13  VAL  70          HG11      VAL  70 -10.116  -8.883 -10.320
    5   HG12  VAL  70          HG12      VAL  70 -10.185 -10.646 -10.332
    6   HG11  VAL  70          HG13      VAL  70 -10.737  -9.733 -11.735
    7   HG21  VAL  70          HG21      VAL  70  -7.758 -11.301 -10.190
    8   HG23  VAL  70          HG22      VAL  70  -7.732  -9.657  -9.556
    9   HG22  VAL  70          HG23      VAL  70  -6.583 -10.138 -10.803

  No H/Q in entry =           9
  In of MODEL   37
    1    H    SER  71           H        SER  71  -7.716  -9.038 -14.260
    2    HA   SER  71           HA       SER  71  -5.557 -10.365 -15.520
    3    HB2  SER  71           HB2      SER  71  -6.646  -8.311 -16.415
    4    HB3  SER  71           HB3      SER  71  -5.946  -7.391 -15.086
    5    HG   SER  71           HG       SER  71  -4.604  -8.806 -17.147

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU  72           H        LEU  72  -3.483 -10.636 -14.945
    2    HA   LEU  72           HA       LEU  72  -2.739 -10.433 -12.239
    3    HB2  LEU  72           HB2      LEU  72  -1.118 -10.881 -14.738
    4    HB3  LEU  72           HB3      LEU  72  -0.432 -10.948 -13.119
    5    HG   LEU  72           HG       LEU  72  -2.814 -12.627 -13.962
    6   HD12  LEU  72          HD11      LEU  72  -1.029 -14.482 -13.993
    7   HD11  LEU  72          HD12      LEU  72   0.152 -13.179 -14.103
    8   HD13  LEU  72          HD13      LEU  72  -1.057 -13.381 -15.371
    9   HD23  LEU  72          HD21      LEU  72  -1.777 -14.042 -12.018
   10   HD22  LEU  72          HD22      LEU  72  -2.733 -12.632 -11.593
   11   HD21  LEU  72          HD23      LEU  72  -0.974 -12.541 -11.570

  No H/Q in entry =          11
  In of MODEL   37
    1    H    VAL  73           H        VAL  73  -2.025  -8.420 -15.022
    2    HA   VAL  73           HA       VAL  73  -0.079  -6.742 -13.931
    3    HB   VAL  73           HB       VAL  73  -0.423  -5.357 -15.797
    4   HG12  VAL  73          HG11      VAL  73  -1.530  -7.979 -16.797
    5   HG11  VAL  73          HG12      VAL  73   0.126  -7.856 -16.204
    6   HG13  VAL  73          HG13      VAL  73  -0.389  -6.894 -17.589
    7   HG21  VAL  73          HG21      VAL  73  -3.249  -6.434 -15.735
    8   HG23  VAL  73          HG22      VAL  73  -2.598  -5.584 -17.134
    9   HG22  VAL  73          HG23      VAL  73  -2.723  -4.757 -15.581

  No H/Q in entry =           9
  In of MODEL   37
    1    H    LEU  74           H        LEU  74  -3.473  -6.824 -13.347
    2    HA   LEU  74           HA       LEU  74  -4.059  -4.163 -12.726
    3    HB2  LEU  74           HB2      LEU  74  -5.803  -5.818 -12.890
    4    HB3  LEU  74           HB3      LEU  74  -5.114  -6.740 -11.556
    5    HG   LEU  74           HG       LEU  74  -5.546  -4.835 -10.029
    6   HD12  LEU  74          HD11      LEU  74  -7.172  -3.081 -11.014
    7   HD11  LEU  74          HD12      LEU  74  -6.582  -3.613 -12.588
    8   HD13  LEU  74          HD13      LEU  74  -5.463  -2.915 -11.416
    9   HD23  LEU  74          HD21      LEU  74  -8.115  -5.305 -11.456
   10   HD22  LEU  74          HD22      LEU  74  -7.732  -5.396  -9.750
   11   HD21  LEU  74          HD23      LEU  74  -7.249  -6.697 -10.812

  No H/Q in entry =          11
  In of MODEL   37
    1    H    VAL  75           H        VAL  75  -3.028  -6.764 -10.576
    2    HA   VAL  75           HA       VAL  75  -2.795  -5.218  -8.232
    3    HB   VAL  75           HB       VAL  75  -1.335  -7.729  -9.039
    4   HG11  VAL  75          HG11      VAL  75  -1.490  -6.262  -6.368
    5   HG13  VAL  75          HG12      VAL  75  -0.044  -6.527  -7.332
    6   HG12  VAL  75          HG13      VAL  75  -0.853  -7.890  -6.578
    7   HG21  VAL  75          HG21      VAL  75  -3.902  -7.650  -8.737
    8   HG23  VAL  75          HG22      VAL  75  -3.569  -7.341  -7.033
    9   HG22  VAL  75          HG23      VAL  75  -3.025  -8.844  -7.779

  No H/Q in entry =           9
  In of MODEL   37
    1    H    GLU  76           H        GLU  76  -0.414  -5.999 -10.788
    2    HA   GLU  76           HA       GLU  76   1.795  -4.676  -9.646
    3    HB2  GLU  76           HB2      GLU  76   1.907  -6.163 -11.656
    4    HB3  GLU  76           HB3      GLU  76   1.087  -4.923 -12.592
    5    HG2  GLU  76           HG2      GLU  76   2.957  -3.359 -12.172
    6    HG3  GLU  76           HG3      GLU  76   3.799  -4.588 -11.249

  No H/Q in entry =           6
  In of MODEL   37
    1    H    ALA  77           H        ALA  77  -0.742  -3.445 -11.813
    2    HA   ALA  77           HA       ALA  77   0.273  -0.809 -11.993
    3    HB2  ALA  77           HB1      ALA  77  -2.108  -0.236 -12.632
    4    HB3  ALA  77           HB2      ALA  77  -2.523  -1.920 -12.309
    5    HB1  ALA  77           HB3      ALA  77  -1.372  -1.526 -13.585

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLN  78           H        GLN  78  -1.993  -2.345  -9.766
    2    HA   GLN  78           HA       GLN  78  -2.766  -0.021  -8.356
    3    HB2  GLN  78           HB2      GLN  78  -3.892  -2.276  -8.268
    4    HB3  GLN  78           HB3      GLN  78  -2.557  -2.841  -7.266
    5    HG2  GLN  78           HG2      GLN  78  -3.059  -1.098  -5.606
    6    HG3  GLN  78           HG3      GLN  78  -4.391  -0.520  -6.606
    7   HE21  GLN  78          HE21      GLN  78  -4.875  -1.480  -3.954
    8   HE22  GLN  78          HE22      GLN  78  -5.749  -2.933  -4.062

  No H/Q in entry =           8
  In of MODEL   37
    1    H    LEU  79           H        LEU  79  -0.106  -2.303  -7.929
    2    HA   LEU  79           HA       LEU  79   0.897  -1.419  -5.478
    3    HB2  LEU  79           HB2      LEU  79   1.740  -3.435  -6.556
    4    HB3  LEU  79           HB3      LEU  79   2.385  -2.487  -7.893
    5    HG   LEU  79           HG       LEU  79   3.963  -1.365  -6.399
    6   HD13  LEU  79          HD11      LEU  79   2.977  -1.113  -4.324
    7   HD12  LEU  79          HD12      LEU  79   4.045  -2.473  -3.991
    8   HD11  LEU  79          HD13      LEU  79   2.334  -2.756  -4.308
    9   HD23  LEU  79          HD21      LEU  79   5.160  -3.526  -5.509
   10   HD22  LEU  79          HD22      LEU  79   4.945  -3.322  -7.245
   11   HD21  LEU  79          HD23      LEU  79   3.864  -4.383  -6.346

  No H/Q in entry =          11
  In of MODEL   37
    1    H    HIS  80           H        HIS  80   1.753  -0.306  -8.756
    2    HA   HIS  80           HA       HIS  80   3.585   1.664  -7.845
    3    HB2  HIS  80           HB2      HIS  80   2.270   0.985 -10.419
    4    HB3  HIS  80           HB3      HIS  80   2.881   2.632 -10.250
    5    HD1  HIS  80           HD1      HIS  80   5.281   2.911 -10.790
    6    HD2  HIS  80           HD2      HIS  80   4.436  -0.994  -9.598
    7    HE1  HIS  80           HE1      HIS  80   7.458   1.616 -10.975
    8    HE2  HIS  80           HE2      HIS  80   6.954  -0.768 -10.252

  No H/Q in entry =           8
  In of MODEL   37
    1    H    LEU  81           H        LEU  81   0.176   1.855  -8.799
    2    HA   LEU  81           HA       LEU  81  -0.073   4.650  -8.462
    3    HB2  LEU  81           HB2      LEU  81  -2.106   2.421  -8.371
    4    HB3  LEU  81           HB3      LEU  81  -2.543   4.128  -8.273
    5    HG   LEU  81           HG       LEU  81  -0.877   2.967 -10.523
    6   HD12  LEU  81          HD11      LEU  81  -3.116   3.308 -11.805
    7   HD11  LEU  81          HD12      LEU  81  -3.860   3.243 -10.208
    8   HD13  LEU  81          HD13      LEU  81  -2.933   1.869 -10.804
    9   HD23  LEU  81          HD21      LEU  81  -1.964   5.122 -11.609
   10   HD22  LEU  81          HD22      LEU  81  -0.539   5.280 -10.586
   11   HD21  LEU  81          HD23      LEU  81  -2.135   5.640  -9.933

  No H/Q in entry =          11
  In of MODEL   37
    1    H    MET  82           H        MET  82  -0.737   1.965  -6.212
    2    HA   MET  82           HA       MET  82  -1.761   3.556  -4.115
    3    HB2  MET  82           HB2      MET  82  -0.409   0.858  -4.168
    4    HB3  MET  82           HB3      MET  82  -0.971   1.585  -2.665
    5    HG2  MET  82           HG2      MET  82  -2.726   1.110  -5.094
    6    HG3  MET  82           HG3      MET  82  -2.646   0.033  -3.701
    7    HE3  MET  82           HE1      MET  82  -4.334   1.692  -0.871
    8    HE2  MET  82           HE2      MET  82  -2.603   1.956  -1.068
    9    HE1  MET  82           HE3      MET  82  -3.307   0.405  -1.519

  No H/Q in entry =           9
  In of MODEL   37
    1    H    THR  83           H        THR  83   1.526   2.445  -4.831
    2    HA   THR  83           HA       THR  83   2.769   3.536  -2.538
    3    HB   THR  83           HB       THR  83   4.852   3.467  -4.027
    4    HG1  THR  83           HG1      THR  83   4.593   2.946  -6.050
    5   HG22  THR  83          HG21      THR  83   4.385   0.813  -4.360
    6   HG21  THR  83          HG22      THR  83   3.107   1.200  -3.209
    7   HG23  THR  83          HG23      THR  83   4.792   1.530  -2.802

  No H/Q in entry =           7
  In of MODEL   37
    1    H    SER  84           H        SER  84   2.384   4.824  -5.833
    2    HA   SER  84           HA       SER  84   3.746   7.253  -5.384
    3    HB2  SER  84           HB2      SER  84   1.654   6.440  -7.389
    4    HB3  SER  84           HB3      SER  84   2.345   8.062  -7.366
    5    HG   SER  84           HG       SER  84   3.696   5.577  -7.671

  No H/Q in entry =           5
  In of MODEL   37
    1    H    MET  85           H        MET  85   0.247   6.523  -5.187
    2    HA   MET  85           HA       MET  85  -0.589   9.140  -4.575
    3    HB2  MET  85           HB2      MET  85  -2.131   7.344  -5.236
    4    HB3  MET  85           HB3      MET  85  -1.837   6.533  -3.698
    5    HG2  MET  85           HG2      MET  85  -2.706   8.492  -2.484
    6    HG3  MET  85           HG3      MET  85  -2.971   9.327  -4.014
    7    HE2  MET  85           HE1      MET  85  -5.363   5.888  -2.177
    8    HE1  MET  85           HE2      MET  85  -4.324   7.054  -1.359
    9    HE3  MET  85           HE3      MET  85  -3.607   5.808  -2.376

  No H/Q in entry =           9
  In of MODEL   37
    1    H    LEU  86           H        LEU  86   0.325   6.466  -2.443
    2    HA   LEU  86           HA       LEU  86  -0.179   7.769   0.005
    3    HB2  LEU  86           HB2      LEU  86   0.261   5.295  -0.396
    4    HB3  LEU  86           HB3      LEU  86   1.971   5.710  -0.503
    5    HG   LEU  86           HG       LEU  86   1.673   6.870   1.769
    6   HD11  LEU  86          HD11      LEU  86  -1.031   6.128   1.317
    7   HD13  LEU  86          HD12      LEU  86  -0.348   6.866   2.764
    8   HD12  LEU  86          HD13      LEU  86  -0.455   5.112   2.642
    9   HD23  LEU  86          HD21      LEU  86   1.220   3.881   1.889
   10   HD22  LEU  86          HD22      LEU  86   2.239   4.880   2.923
   11   HD21  LEU  86          HD23      LEU  86   2.724   4.554   1.260

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ALA  87           H        ALA  87   2.785   7.452  -1.907
    2    HA   ALA  87           HA       ALA  87   4.516   8.843  -0.192
    3    HB3  ALA  87           HB1      ALA  87   4.582   7.835  -2.902
    4    HB2  ALA  87           HB2      ALA  87   5.927   8.151  -1.811
    5    HB1  ALA  87           HB3      ALA  87   5.317   9.439  -2.848

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ARG  88           H        ARG  88   2.559  10.003  -2.896
    2    HA   ARG  88           HA       ARG  88   3.360  12.685  -2.780
    3    HB2  ARG  88           HB2      ARG  88   2.080  11.548  -4.630
    4    HB3  ARG  88           HB3      ARG  88   0.632  11.703  -3.635
    5    HG2  ARG  88           HG2      ARG  88   1.677  14.273  -3.555
    6    HG3  ARG  88           HG3      ARG  88   2.084  13.758  -5.189
    7    HD2  ARG  88           HD2      ARG  88  -0.062  13.860  -5.870
    8    HD3  ARG  88           HD3      ARG  88  -0.646  13.010  -4.439
    9    HE   ARG  88           HE       ARG  88  -0.812  15.791  -4.850
   10   HH21  ARG  88          HH11      ARG  88  -1.312  17.122  -3.106
   11   HH22  ARG  88          HH12      ARG  88  -1.009  16.578  -1.492
   12   HH11  ARG  88          HH21      ARG  88   0.200  13.513  -2.489
   13   HH12  ARG  88          HH22      ARG  88  -0.170  14.530  -1.142

  No H/Q in entry =          13
  In of MODEL   37
    1    H    GLU  89           H        GLU  89   0.652  11.034  -1.122
    2    HA   GLU  89           HA       GLU  89  -0.422  13.354   0.096
    3    HB2  GLU  89           HB2      GLU  89  -1.564  11.127   0.013
    4    HB3  GLU  89           HB3      GLU  89  -0.436  10.557   1.244
    5    HG2  GLU  89           HG2      GLU  89  -1.226  12.261   2.813
    6    HG3  GLU  89           HG3      GLU  89  -2.281  12.945   1.580

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LEU  90           H        LEU  90   2.014  11.034   1.246
    2    HA   LEU  90           HA       LEU  90   2.403  12.269   3.775
    3    HB2  LEU  90           HB2      LEU  90   4.144  10.480   2.081
    4    HB3  LEU  90           HB3      LEU  90   4.581  10.989   3.717
    5    HG   LEU  90           HG       LEU  90   1.927   9.673   3.074
    6   HD12  LEU  90          HD11      LEU  90   3.053   7.612   4.069
    7   HD11  LEU  90          HD12      LEU  90   4.583   8.453   3.817
    8   HD13  LEU  90          HD13      LEU  90   3.555   8.059   2.437
    9   HD22  LEU  90          HD21      LEU  90   1.689  10.594   5.200
   10   HD21  LEU  90          HD22      LEU  90   3.409  10.467   5.568
   11   HD23  LEU  90          HD23      LEU  90   2.387   9.031   5.621

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  91           H        ILE  91   3.986  12.641   0.637
    2    HA   ILE  91           HA       ILE  91   5.989  14.449   1.465
    3    HB   ILE  91           HB       ILE  91   4.651  13.979  -1.206
    4   HG12  ILE  91          HG12      ILE  91   7.485  13.458  -0.255
    5   HG13  ILE  91          HG13      ILE  91   6.192  12.274  -0.085
    6   HG22  ILE  91          HG21      ILE  91   6.883  15.303  -1.909
    7   HG21  ILE  91          HG22      ILE  91   6.595  16.103  -0.364
    8   HG23  ILE  91          HG23      ILE  91   5.362  16.148  -1.623
    9   HD13  ILE  91          HD11      ILE  91   5.997  11.958  -2.392
   10   HD12  ILE  91          HD12      ILE  91   7.735  12.181  -2.191
   11   HD11  ILE  91          HD13      ILE  91   6.736  13.517  -2.767

  No H/Q in entry =          11
  In of MODEL   37
    1    H    THR  92           H        THR  92   2.624  14.921   0.484
    2    HA   THR  92           HA       THR  92   2.630  17.745   0.430
    3    HB   THR  92           HB       THR  92   0.445  15.773   1.142
    4    HG1  THR  92           HG1      THR  92   0.731  15.596  -0.945
    5   HG22  THR  92          HG21      THR  92  -0.936  17.953   0.436
    6   HG21  THR  92          HG22      THR  92   0.471  18.761   1.124
    7   HG23  THR  92          HG23      THR  92  -0.476  17.648   2.110

  No H/Q in entry =           7
  In of MODEL   37
    1    H    GLU  93           H        GLU  93   2.076  15.445   3.083
    2    HA   GLU  93           HA       GLU  93   1.582  17.350   5.110
    3    HB2  GLU  93           HB2      GLU  93   2.866  14.610   5.330
    4    HB3  GLU  93           HB3      GLU  93   2.196  15.542   6.670
    5    HG2  GLU  93           HG2      GLU  93   0.556  14.788   4.242
    6    HG3  GLU  93           HG3      GLU  93   0.657  13.761   5.667

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LEU  94           H        LEU  94   4.562  15.836   3.933
    2    HA   LEU  94           HA       LEU  94   6.341  16.959   5.810
    3    HB2  LEU  94           HB2      LEU  94   6.709  15.994   2.974
    4    HB3  LEU  94           HB3      LEU  94   8.053  16.634   3.914
    5    HG   LEU  94           HG       LEU  94   6.297  14.456   5.058
    6   HD11  LEU  94          HD11      LEU  94   8.373  14.210   2.910
    7   HD13  LEU  94          HD12      LEU  94   6.918  13.253   3.181
    8   HD12  LEU  94          HD13      LEU  94   8.348  12.981   4.176
    9   HD23  LEU  94          HD21      LEU  94   8.489  13.891   6.192
   10   HD22  LEU  94          HD22      LEU  94   7.844  15.476   6.617
   11   HD21  LEU  94          HD23      LEU  94   9.172  15.343   5.464

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  95           H        ILE  95   5.190  18.151   2.672
    2    HA   ILE  95           HA       ILE  95   6.789  20.490   2.605
    3    HB   ILE  95           HB       ILE  95   4.127  19.840   1.319
    4   HG12  ILE  95          HG12      ILE  95   6.910  20.148   0.161
    5   HG13  ILE  95          HG13      ILE  95   6.247  18.601   0.677
    6   HG21  ILE  95          HG21      ILE  95   5.903  22.288   1.090
    7   HG23  ILE  95          HG22      ILE  95   4.181  22.239   1.460
    8   HG22  ILE  95          HG23      ILE  95   4.746  21.835  -0.161
    9   HD13  ILE  95          HD11      ILE  95   4.673  18.547  -1.040
   10   HD12  ILE  95          HD12      ILE  95   6.025  19.351  -1.836
   11   HD11  ILE  95          HD13      ILE  95   4.668  20.301  -1.231

  No H/Q in entry =          11
  In of MODEL   37
    1    H    GLU  96           H        GLU  96   3.543  19.873   3.924
    2    HA   GLU  96           HA       GLU  96   2.960  22.526   4.686
    3    HB2  GLU  96           HB2      GLU  96   1.265  20.762   4.707
    4    HB3  GLU  96           HB3      GLU  96   2.127  19.922   5.994
    5    HG2  GLU  96           HG2      GLU  96   1.134  21.214   7.574
    6    HG3  GLU  96           HG3      GLU  96   1.680  22.683   6.776

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LEU  97           H        LEU  97   4.785  19.950   6.291
    2    HA   LEU  97           HA       LEU  97   5.178  21.288   8.762
    3    HB2  LEU  97           HB2      LEU  97   6.678  19.104   7.331
    4    HB3  LEU  97           HB3      LEU  97   7.288  19.779   8.840
    5    HG   LEU  97           HG       LEU  97   4.463  18.719   8.549
    6   HD12  LEU  97          HD11      LEU  97   5.388  16.693   9.750
    7   HD11  LEU  97          HD12      LEU  97   7.004  17.306   9.395
    8   HD13  LEU  97          HD13      LEU  97   5.919  16.864   8.076
    9   HD23  LEU  97          HD21      LEU  97   4.933  18.414  11.109
   10   HD22  LEU  97          HD22      LEU  97   4.567  20.031  10.511
   11   HD21  LEU  97          HD23      LEU  97   6.236  19.571  10.842

  No H/Q in entry =          11
  In of MODEL   37
    1    H    HIS  98           H        HIS  98   7.025  21.288   5.722
    2    HA   HIS  98           HA       HIS  98   9.205  22.840   6.608
    3    HB2  HIS  98           HB2      HIS  98   7.887  22.607   3.892
    4    HB3  HIS  98           HB3      HIS  98   9.341  23.567   4.173
    5    HD1  HIS  98           HD1      HIS  98   8.086  20.011   4.194
    6    HD2  HIS  98           HD2      HIS  98  11.696  22.062   4.596
    7    HE1  HIS  98           HE1      HIS  98   9.919  18.259   4.119
    8    HE2  HIS  98           HE2      HIS  98  12.121  19.488   4.363

  No H/Q in entry =           8
  In of MODEL   37
    1    H    GLU  99           H        GLU  99   5.985  23.717   5.460
    2    HA   GLU  99           HA       GLU  99   6.398  26.527   5.405
    3    HB2  GLU  99           HB2      GLU  99   4.496  25.384   4.286
    4    HB3  GLU  99           HB3      GLU  99   3.808  25.027   5.870
    5    HG2  GLU  99           HG2      GLU  99   3.662  27.420   6.378
    6    HG3  GLU  99           HG3      GLU  99   4.431  27.814   4.844

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LYS 100           H        LYS 100   5.260  24.300   7.930
    2    HA   LYS 100           HA       LYS 100   4.714  26.357   9.834
    3    HB2  LYS 100           HB2      LYS 100   5.255  23.398  10.168
    4    HB3  LYS 100           HB3      LYS 100   4.831  24.473  11.506
    5    HG2  LYS 100           HG2      LYS 100   2.764  25.139  10.276
    6    HG3  LYS 100           HG3      LYS 100   3.166  23.968   9.017
    7    HD2  LYS 100           HD2      LYS 100   3.079  22.144  10.675
    8    HD3  LYS 100           HD3      LYS 100   2.693  23.309  11.945
    9    HE2  LYS 100           HE2      LYS 100   0.639  23.959  10.699
   10    HE3  LYS 100           HE3      LYS 100   1.014  22.737   9.478
   11    HZ1  LYS 100           HZ1      LYS 100   0.762  22.067  12.359
   12    HZ3  LYS 100           HZ2      LYS 100   0.722  21.017  11.022
   13    HZ2  LYS 100           HZ3      LYS 100  -0.577  22.072  11.314

  No H/Q in entry =          13
  In of MODEL   37
    1    H    LEU 101           H        LEU 101   7.608  24.526   8.973
    2    HA   LEU 101           HA       LEU 101   9.234  25.341  11.166
    3    HB2  LEU 101           HB2      LEU 101   9.794  24.353   8.381
    4    HB3  LEU 101           HB3      LEU 101  11.112  24.999   9.354
    5    HG   LEU 101           HG       LEU 101   9.261  22.864  10.427
    6   HD12  LEU 101          HD11      LEU 101  11.291  21.344   9.799
    7   HD11  LEU 101          HD12      LEU 101  11.665  22.605   8.626
    8   HD13  LEU 101          HD13      LEU 101  10.124  21.752   8.542
    9   HD21  LEU 101          HD21      LEU 101  12.005  23.935  11.136
   10   HD23  LEU 101          HD22      LEU 101  11.446  22.369  11.716
   11   HD22  LEU 101          HD23      LEU 101  10.576  23.835  12.164

  No H/Q in entry =          11
  In of MODEL   37
    1    H    LYS 102           H        LYS 102   7.658  27.230   9.042
    2    HA   LYS 102           HA       LYS 102   7.763  29.522   8.754
    3    HB2  LYS 102           HB2      LYS 102   9.342  29.381  10.840
    4    HB3  LYS 102           HB3      LYS 102  10.635  29.562   9.671
    5    HG2  LYS 102           HG2      LYS 102   8.562  31.540  10.554
    6    HG3  LYS 102           HG3      LYS 102  10.276  31.778  10.289
    7    HD2  LYS 102           HD2      LYS 102   8.302  31.386   8.004
    8    HD3  LYS 102           HD3      LYS 102   8.710  32.959   8.673
    9    HE2  LYS 102           HE2      LYS 102  10.052  31.761   6.586
   10    HE3  LYS 102           HE3      LYS 102  10.693  33.057   7.595
   11    HZ2  LYS 102           HZ1      LYS 102  12.187  31.133   7.404
   12    HZ1  LYS 102           HZ2      LYS 102  11.018  30.165   8.153
   13    HZ3  LYS 102           HZ3      LYS 102  11.734  31.440   9.010

  No H/Q in entry =          13
  In of MODEL   37
    1    H    ALA 103           H        ALA 103  10.998  28.142   8.161
    2    HA   ALA 103           HA       ALA 103  11.964  29.511   6.081
    3    HB2  ALA 103           HB1      ALA 103  12.812  27.287   5.141
    4    HB1  ALA 103           HB2      ALA 103  11.917  26.522   6.453
    5    HB3  ALA 103           HB3      ALA 103  13.225  27.648   6.818

  No H/Q in entry =           5
  In of MODEL   37
    1    H1   LYS   3           H1       LYS   3 -31.293   5.619 -19.989
    2    H2   LYS   3           H3       LYS   3 -30.270   5.366 -21.321
    3    H3   LYS   3           H2       LYS   3 -31.638   4.385 -21.102
    4    HA   LYS   3           HA       LYS   3 -30.618   3.025 -19.682
    5    HB2  LYS   3           HB2      LYS   3 -28.358   4.514 -20.968
    6    HB3  LYS   3           HB3      LYS   3 -28.019   3.314 -19.721
    7    HG2  LYS   3           HG2      LYS   3 -29.363   1.686 -21.101
    8    HG3  LYS   3           HG3      LYS   3 -29.332   2.890 -22.389
    9    HD2  LYS   3           HD2      LYS   3 -26.848   2.857 -22.291
   10    HD3  LYS   3           HD3      LYS   3 -26.948   1.551 -21.110
   11    HE2  LYS   3           HE2      LYS   3 -28.374   0.333 -22.857
   12    HE3  LYS   3           HE3      LYS   3 -27.771   1.534 -23.998
   13    HZ3  LYS   3           HZ1      LYS   3 -25.929   0.364 -24.236
   14    HZ2  LYS   3           HZ2      LYS   3 -26.541  -0.826 -23.190
   15    HZ1  LYS   3           HZ3      LYS   3 -25.604   0.447 -22.571

  No H/Q in entry =          15
  In of MODEL   37
    1    H    LYS   4           H        LYS   4 -30.706   2.876 -17.622
    2    HA   LYS   4           HA       LYS   4 -30.080   5.180 -15.954
    3    HB2  LYS   4           HB2      LYS   4 -31.208   2.449 -15.282
    4    HB3  LYS   4           HB3      LYS   4 -31.051   3.790 -14.149
    5    HG2  LYS   4           HG2      LYS   4 -32.810   3.678 -16.605
    6    HG3  LYS   4           HG3      LYS   4 -33.334   3.708 -14.922
    7    HD2  LYS   4           HD2      LYS   4 -32.713   5.951 -14.638
    8    HD3  LYS   4           HD3      LYS   4 -31.645   5.929 -16.042
    9    HE2  LYS   4           HE2      LYS   4 -33.603   7.244 -16.538
   10    HE3  LYS   4           HE3      LYS   4 -33.619   5.771 -17.511
   11    HZ3  LYS   4           HZ1      LYS   4 -35.195   4.807 -15.996
   12    HZ2  LYS   4           HZ2      LYS   4 -35.785   6.286 -16.587
   13    HZ1  LYS   4           HZ3      LYS   4 -35.155   6.191 -15.013

  No H/Q in entry =          13
  In of MODEL   37
    1    H    HIS   5           H        HIS   5 -28.645   5.306 -14.335
    2    HA   HIS   5           HA       HIS   5 -26.301   3.548 -14.627
    3    HB2  HIS   5           HB2      HIS   5 -26.663   6.291 -13.419
    4    HB3  HIS   5           HB3      HIS   5 -25.153   5.382 -13.376
    5    HD1  HIS   5           HD1      HIS   5 -23.691   6.630 -14.936
    6    HD2  HIS   5           HD2      HIS   5 -27.441   5.899 -16.563
    7    HE1  HIS   5           HE1      HIS   5 -23.494   7.221 -17.381
    8    HE2  HIS   5           HE2      HIS   5 -25.781   6.763 -18.342

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ILE   6           H        ILE   6 -26.051   1.980 -13.308
    2    HA   ILE   6           HA       ILE   6 -27.086   2.212 -10.563
    3    HB   ILE   6           HB       ILE   6 -26.159  -0.225 -12.089
    4   HG12  ILE   6          HG12      ILE   6 -28.944   0.628 -11.288
    5   HG13  ILE   6          HG13      ILE   6 -28.276   0.812 -12.910
    6   HG23  ILE   6          HG21      ILE   6 -26.531  -1.492 -10.239
    7   HG22  ILE   6          HG22      ILE   6 -27.733  -0.383  -9.580
    8   HG21  ILE   6          HG23      ILE   6 -26.017   0.003  -9.457
    9   HD13  ILE   6          HD11      ILE   6 -28.664  -1.318 -13.424
   10   HD12  ILE   6          HD12      ILE   6 -29.706  -1.335 -12.001
   11   HD11  ILE   6          HD13      ILE   6 -28.037  -1.894 -11.878

  No H/Q in entry =          11
  In of MODEL   37
    1    H    TYR   7           H        TYR   7 -25.371   2.901  -9.242
    2    HA   TYR   7           HA       TYR   7 -22.621   2.025  -9.871
    3    HB2  TYR   7           HB2      TYR   7 -23.683   4.426  -8.405
    4    HB3  TYR   7           HB3      TYR   7 -21.983   3.961  -8.412
    5    HD1  TYR   7           HD1      TYR   7 -22.937   2.996 -11.524
    6    HD2  TYR   7           HD2      TYR   7 -22.413   6.580  -9.278
    7    HE1  TYR   7           HE1      TYR   7 -22.502   4.243 -13.603
    8    HE2  TYR   7           HE2      TYR   7 -22.020   7.831 -11.351
    9    HH   TYR   7           HH       TYR   7 -22.194   7.744 -13.587

  No H/Q in entry =           9
  In of MODEL   37
    1    H    LEU   8           H        LEU   8 -21.641   0.698  -8.527
    2    HA   LEU   8           HA       LEU   8 -22.808   0.165  -5.867
    3    HB2  LEU   8           HB2      LEU   8 -21.023  -1.444  -7.672
    4    HB3  LEU   8           HB3      LEU   8 -21.230  -1.836  -5.965
    5    HG   LEU   8           HG       LEU   8 -23.696  -2.079  -6.434
    6   HD13  LEU   8          HD11      LEU   8 -23.821  -0.862  -8.544
    7   HD12  LEU   8          HD12      LEU   8 -24.298  -2.540  -8.797
    8   HD11  LEU   8          HD13      LEU   8 -22.696  -1.994  -9.291
    9   HD23  LEU   8          HD21      LEU   8 -22.331  -4.077  -8.107
   10   HD22  LEU   8          HD22      LEU   8 -23.438  -4.281  -6.751
   11   HD21  LEU   8          HD23      LEU   8 -21.748  -3.878  -6.455

  No H/Q in entry =          11
  In of MODEL   37
    1    H    PHE   9           H        PHE   9 -21.590   0.603  -4.058
    2    HA   PHE   9           HA       PHE   9 -18.822   1.619  -4.507
    3    HB2  PHE   9           HB2      PHE   9 -20.924   2.631  -2.597
    4    HB3  PHE   9           HB3      PHE   9 -19.228   3.087  -2.516
    5    HD1  PHE   9           HD1      PHE   9 -18.197   4.440  -4.267
    6    HD2  PHE   9           HD2      PHE   9 -22.362   3.420  -4.414
    7    HE1  PHE   9           HE1      PHE   9 -18.551   6.139  -6.035
    8    HE2  PHE   9           HE2      PHE   9 -22.718   5.131  -6.176
    9    HZ   PHE   9           HZ       PHE   9 -20.811   6.485  -6.993

  No H/Q in entry =           9
  In of MODEL   37
    1    H    SER  10           H        SER  10 -17.231   0.727  -3.355
    2    HA   SER  10           HA       SER  10 -17.473  -0.173  -0.671
    3    HB2  SER  10           HB2      SER  10 -18.609  -2.081  -1.769
    4    HB3  SER  10           HB3      SER  10 -17.194  -2.314  -2.782
    5    HG   SER  10           HG       SER  10 -17.648  -3.033  -0.199

  No H/Q in entry =           5
  In of MODEL   37
    1    H    SER  11           H        SER  11 -15.480   0.023   0.206
    2    HA   SER  11           HA       SER  11 -13.295   0.945  -1.278
    3    HB2  SER  11           HB2      SER  11 -12.828  -0.447   1.312
    4    HB3  SER  11           HB3      SER  11 -12.179   1.081   0.713
    5    HG   SER  11           HG       SER  11 -14.670   1.556   0.798

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA  12           H        ALA  12 -14.392  -1.781  -2.130
    2    HA   ALA  12           HA       ALA  12 -11.763  -2.931  -2.630
    3    HB2  ALA  12           HB1      ALA  12 -12.116  -4.304  -0.809
    4    HB3  ALA  12           HB2      ALA  12 -12.865  -5.265  -2.084
    5    HB1  ALA  12           HB3      ALA  12 -13.870  -4.297  -1.007

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLY  13           H        GLY  13 -12.435  -1.997  -4.691
    2    HA3  GLY  13           HA2      GLY  13 -14.647  -2.669  -6.212
    3    HA2  GLY  13           HA3      GLY  13 -13.069  -2.262  -6.899

  No H/Q in entry =           3
  In of MODEL   37
    1    H    MET  14           H        MET  14 -11.625  -4.576  -5.914
    2    HA   MET  14           HA       MET  14 -12.102  -6.323  -8.036
    3    HB2  MET  14           HB2      MET  14  -9.978  -6.373  -6.807
    4    HB3  MET  14           HB3      MET  14 -10.781  -7.079  -5.406
    5    HG2  MET  14           HG2      MET  14 -11.372  -9.065  -6.740
    6    HG3  MET  14           HG3      MET  14 -10.624  -8.344  -8.166
    7    HE2  MET  14           HE1      MET  14  -7.782  -7.015  -6.963
    8    HE1  MET  14           HE2      MET  14  -8.469  -7.659  -8.452
    9    HE3  MET  14           HE3      MET  14  -7.018  -8.392  -7.772

  No H/Q in entry =           9
  In of MODEL   37
    1    H    SER  15           H        SER  15 -13.207  -6.764  -4.667
    2    HA   SER  15           HA       SER  15 -14.521  -9.245  -5.248
    3    HB2  SER  15           HB2      SER  15 -15.034  -7.330  -2.956
    4    HB3  SER  15           HB3      SER  15 -15.777  -8.917  -3.131
    5    HG   SER  15           HG       SER  15 -12.965  -8.452  -3.125

  No H/Q in entry =           5
  In of MODEL   37
    1    H    THR  16           H        THR  16 -15.696  -5.883  -5.079
    2    HA   THR  16           HA       THR  16 -18.451  -6.506  -5.696
    3    HB   THR  16           HB       THR  16 -16.985  -3.888  -6.167
    4    HG1  THR  16           HG1      THR  16 -18.278  -4.779  -3.805
    5   HG21  THR  16          HG21      THR  16 -19.400  -4.358  -6.998
    6   HG23  THR  16          HG22      THR  16 -19.113  -2.880  -6.063
    7   HG22  THR  16          HG23      THR  16 -19.832  -4.302  -5.294

  No H/Q in entry =           7
  In of MODEL   37
    1    H    SER  17           H        SER  17 -15.554  -5.880  -7.472
    2    HA   SER  17           HA       SER  17 -16.652  -5.168  -9.995
    3    HB2  SER  17           HB2      SER  17 -14.000  -6.410  -9.240
    4    HB3  SER  17           HB3      SER  17 -14.421  -5.986 -10.900
    5    HG   SER  17           HG       SER  17 -14.668  -4.095  -8.835

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU  18           H        LEU  18 -16.019  -8.297  -8.540
    2    HA   LEU  18           HA       LEU  18 -16.513  -9.809 -10.909
    3    HB2  LEU  18           HB2      LEU  18 -15.307 -10.808  -9.067
    4    HB3  LEU  18           HB3      LEU  18 -16.666 -10.532  -7.980
    5    HG   LEU  18           HG       LEU  18 -18.034 -12.086  -9.325
    6   HD11  LEU  18          HD11      LEU  18 -15.467 -12.289 -10.894
    7   HD13  LEU  18          HD12      LEU  18 -17.090 -11.947 -11.492
    8   HD12  LEU  18          HD13      LEU  18 -16.682 -13.565 -10.923
    9   HD23  LEU  18          HD21      LEU  18 -15.428 -13.218  -8.348
   10   HD22  LEU  18          HD22      LEU  18 -16.923 -14.119  -8.605
   11   HD21  LEU  18          HD23      LEU  18 -16.852 -12.866  -7.367

  No H/Q in entry =          11
  In of MODEL   37
    1    H    LEU  19           H        LEU  19 -18.571  -8.666  -8.236
    2    HA   LEU  19           HA       LEU  19 -20.981  -9.922  -9.120
    3    HB2  LEU  19           HB2      LEU  19 -20.784  -9.087  -6.863
    4    HB3  LEU  19           HB3      LEU  19 -20.533  -7.446  -7.459
    5    HG   LEU  19           HG       LEU  19 -22.846  -7.330  -8.193
    6   HD12  LEU  19          HD11      LEU  19 -24.340  -9.260  -7.282
    7   HD11  LEU  19          HD12      LEU  19 -22.854 -10.205  -7.350
    8   HD13  LEU  19          HD13      LEU  19 -23.500  -9.474  -8.818
    9   HD22  LEU  19          HD21      LEU  19 -22.292  -6.634  -5.944
   10   HD21  LEU  19          HD22      LEU  19 -22.523  -8.280  -5.354
   11   HD23  LEU  19          HD23      LEU  19 -23.895  -7.365  -5.978

  No H/Q in entry =          11
  In of MODEL   37
    1    H    VAL  20           H        VAL  20 -19.567  -6.716  -9.780
    2    HA   VAL  20           HA       VAL  20 -21.677  -5.735 -11.389
    3    HB   VAL  20           HB       VAL  20 -18.706  -5.054 -11.450
    4   HG13  VAL  20          HG11      VAL  20 -19.471  -4.441 -13.613
    5   HG12  VAL  20          HG12      VAL  20 -19.546  -2.957 -12.663
    6   HG11  VAL  20          HG13      VAL  20 -21.018  -3.871 -12.990
    7   HG22  VAL  20          HG21      VAL  20 -19.636  -4.348  -9.412
    8   HG21  VAL  20          HG22      VAL  20 -21.113  -3.784 -10.189
    9   HG23  VAL  20          HG23      VAL  20 -19.600  -2.912 -10.436

  No H/Q in entry =           9
  In of MODEL   37
    1    H    SER  21           H        SER  21 -18.839  -7.699 -12.364
    2    HA   SER  21           HA       SER  21 -19.571  -7.605 -15.130
    3    HB2  SER  21           HB2      SER  21 -18.073  -9.535 -15.433
    4    HB3  SER  21           HB3      SER  21 -17.299  -8.258 -14.498
    5    HG   SER  21           HG       SER  21 -17.545  -9.423 -12.679

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LYS  22           H        LYS  22 -20.622  -9.827 -12.584
    2    HA   LYS  22           HA       LYS  22 -22.074 -11.488 -14.438
    3    HB2  LYS  22           HB2      LYS  22 -22.386 -11.150 -11.452
    4    HB3  LYS  22           HB3      LYS  22 -23.215 -12.365 -12.424
    5    HG2  LYS  22           HG2      LYS  22 -20.220 -12.217 -12.335
    6    HG3  LYS  22           HG3      LYS  22 -21.139 -13.076 -11.099
    7    HD2  LYS  22           HD2      LYS  22 -21.582 -13.657 -14.007
    8    HD3  LYS  22           HD3      LYS  22 -20.233 -14.392 -13.138
    9    HE2  LYS  22           HE2      LYS  22 -21.826 -15.334 -11.498
   10    HE3  LYS  22           HE3      LYS  22 -23.162 -14.634 -12.412
   11    HZ1  LYS  22           HZ1      LYS  22 -21.309 -16.413 -13.810
   12    HZ3  LYS  22           HZ2      LYS  22 -22.974 -16.170 -14.050
   13    HZ2  LYS  22           HZ3      LYS  22 -22.432 -17.106 -12.741

  No H/Q in entry =          13
  In of MODEL   37
    1    H    MET  23           H        MET  23 -22.921  -8.592 -12.581
    2    HA   MET  23           HA       MET  23 -25.714  -8.752 -13.143
    3    HB2  MET  23           HB2      MET  23 -23.946  -6.392 -12.530
    4    HB3  MET  23           HB3      MET  23 -25.692  -6.273 -12.742
    5    HG2  MET  23           HG2      MET  23 -26.085  -7.591 -10.783
    6    HG3  MET  23           HG3      MET  23 -24.366  -7.954 -10.623
    7    HE2  MET  23           HE1      MET  23 -26.792  -4.373  -9.475
    8    HE1  MET  23           HE2      MET  23 -26.989  -5.345 -10.932
    9    HE3  MET  23           HE3      MET  23 -25.995  -3.888 -10.972

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ARG  24           H        ARG  24 -22.967  -7.240 -14.868
    2    HA   ARG  24           HA       ARG  24 -24.460  -5.978 -16.895
    3    HB2  ARG  24           HB2      ARG  24 -21.613  -7.034 -16.879
    4    HB3  ARG  24           HB3      ARG  24 -22.286  -6.140 -18.220
    5    HG2  ARG  24           HG2      ARG  24 -22.580  -4.131 -16.805
    6    HG3  ARG  24           HG3      ARG  24 -21.981  -5.047 -15.396
    7    HD2  ARG  24           HD2      ARG  24 -20.430  -4.630 -17.994
    8    HD3  ARG  24           HD3      ARG  24 -20.211  -3.678 -16.531
    9    HE   ARG  24           HE       ARG  24 -19.450  -5.641 -15.368
   10   HH21  ARG  24          HH11      ARG  24 -17.247  -6.057 -15.527
   11   HH22  ARG  24          HH12      ARG  24 -16.584  -6.603 -17.028
   12   HH11  ARG  24          HH21      ARG  24 -19.611  -5.935 -18.735
   13   HH12  ARG  24          HH22      ARG  24 -17.994  -6.537 -18.918

  No H/Q in entry =          13
  In of MODEL   37
    1    H    ALA  25           H        ALA  25 -23.251  -9.285 -16.604
    2    HA   ALA  25           HA       ALA  25 -23.804 -10.125 -19.255
    3    HB1  ALA  25           HB1      ALA  25 -23.066 -12.140 -18.550
    4    HB3  ALA  25           HB2      ALA  25 -24.152 -12.151 -17.161
    5    HB2  ALA  25           HB3      ALA  25 -22.621 -11.282 -17.075

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLN  26           H        GLN  26 -25.690 -10.223 -16.269
    2    HA   GLN  26           HA       GLN  26 -27.978 -11.486 -17.337
    3    HB2  GLN  26           HB2      GLN  26 -27.562  -9.733 -14.935
    4    HB3  GLN  26           HB3      GLN  26 -29.097 -10.497 -15.318
    5    HG2  GLN  26           HG2      GLN  26 -26.483 -11.884 -14.801
    6    HG3  GLN  26           HG3      GLN  26 -27.867 -11.822 -13.719
    7   HE21  GLN  26          HE21      GLN  26 -26.566 -13.949 -14.976
    8   HE22  GLN  26          HE22      GLN  26 -27.563 -15.021 -15.797

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ALA  27           H        ALA  27 -27.144  -8.065 -16.916
    2    HA   ALA  27           HA       ALA  27 -29.647  -7.037 -17.748
    3    HB1  ALA  27           HB1      ALA  27 -27.896  -5.678 -16.593
    4    HB3  ALA  27           HB2      ALA  27 -28.477  -4.923 -18.077
    5    HB2  ALA  27           HB3      ALA  27 -26.918  -5.748 -18.059

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLU  28           H        GLU  28 -26.876  -8.180 -19.566
    2    HA   GLU  28           HA       GLU  28 -27.787  -7.158 -22.100
    3    HB2  GLU  28           HB2      GLU  28 -25.404  -7.779 -21.430
    4    HB3  GLU  28           HB3      GLU  28 -25.899  -9.456 -21.648
    5    HG2  GLU  28           HG2      GLU  28 -24.735  -8.642 -23.590
    6    HG3  GLU  28           HG3      GLU  28 -26.415  -9.009 -23.974

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LYS  29           H        LYS  29 -27.903 -10.273 -20.456
    2    HA   LYS  29           HA       LYS  29 -29.125 -11.770 -22.493
    3    HB2  LYS  29           HB2      LYS  29 -28.091 -12.733 -20.471
    4    HB3  LYS  29           HB3      LYS  29 -29.401 -12.064 -19.499
    5    HG2  LYS  29           HG2      LYS  29 -31.002 -13.476 -20.606
    6    HG3  LYS  29           HG3      LYS  29 -29.764 -14.074 -21.707
    7    HD2  LYS  29           HD2      LYS  29 -28.626 -15.217 -19.956
    8    HD3  LYS  29           HD3      LYS  29 -29.580 -14.405 -18.716
    9    HE2  LYS  29           HE2      LYS  29 -30.261 -16.772 -19.102
   10    HE3  LYS  29           HE3      LYS  29 -31.565 -15.614 -19.367
   11    HZ1  LYS  29           HZ1      LYS  29 -30.948 -15.722 -21.783
   12    HZ3  LYS  29           HZ2      LYS  29 -31.644 -17.131 -21.138
   13    HZ2  LYS  29           HZ3      LYS  29 -29.970 -17.056 -21.401

  No H/Q in entry =          13
  In of MODEL   37
    1    H    TYR  30           H        TYR  30 -30.624  -9.713 -20.010
    2    HA   TYR  30           HA       TYR  30 -33.248 -10.228 -21.307
    3    HB2  TYR  30           HB2      TYR  30 -32.681  -9.068 -18.569
    4    HB3  TYR  30           HB3      TYR  30 -34.278  -9.367 -19.256
    5    HD1  TYR  30           HD1      TYR  30 -35.122 -11.681 -19.497
    6    HD2  TYR  30           HD2      TYR  30 -31.343 -10.864 -17.712
    7    HE1  TYR  30           HE1      TYR  30 -34.986 -14.010 -18.707
    8    HE2  TYR  30           HE2      TYR  30 -31.208 -13.177 -16.926
    9    HH   TYR  30           HH       TYR  30 -32.761 -15.577 -18.061

  No H/Q in entry =           9
  In of MODEL   37
    1    H    GLU  31           H        GLU  31 -31.121  -8.176 -22.056
    2    HA   GLU  31           HA       GLU  31 -31.089  -6.014 -22.870
    3    HB2  GLU  31           HB2      GLU  31 -33.953  -6.805 -23.444
    4    HB3  GLU  31           HB3      GLU  31 -33.135  -5.413 -24.150
    5    HG2  GLU  31           HG2      GLU  31 -31.600  -6.805 -25.317
    6    HG3  GLU  31           HG3      GLU  31 -32.143  -8.237 -24.446

  No H/Q in entry =           6
  In of MODEL   37
    1    H    VAL  32           H        VAL  32 -31.346  -5.929 -20.142
    2    HA   VAL  32           HA       VAL  32 -33.280  -3.872 -19.513
    3    HB   VAL  32           HB       VAL  32 -30.893  -4.805 -17.887
    4   HG12  VAL  32          HG11      VAL  32 -32.489  -4.032 -16.020
    5   HG11  VAL  32          HG12      VAL  32 -33.321  -3.146 -17.298
    6   HG13  VAL  32          HG13      VAL  32 -31.630  -2.797 -16.941
    7   HG21  VAL  32          HG21      VAL  32 -32.598  -6.571 -18.618
    8   HG23  VAL  32          HG22      VAL  32 -33.685  -5.777 -17.476
    9   HG22  VAL  32          HG23      VAL  32 -32.160  -6.461 -16.913

  No H/Q in entry =           9
  In of MODEL   37
    1    HA   PRO  33           HA       PRO  33 -30.298  -0.851 -21.113
    2    HB2  PRO  33           HB2      PRO  33 -31.874   1.327 -21.012
    3    HB3  PRO  33           HB3      PRO  33 -32.283   0.016 -22.120
    4    HG2  PRO  33           HG2      PRO  33 -33.323   0.493 -19.326
    5    HG3  PRO  33           HG3      PRO  33 -34.251   0.264 -20.808
    6    HD2  PRO  33           HD2      PRO  33 -33.770  -1.803 -19.141
    7    HD3  PRO  33           HD3      PRO  33 -33.790  -2.038 -20.889

  No H/Q in entry =           7
  In of MODEL   37
    1    H    VAL  34           H        VAL  34 -29.059  -1.369 -19.141
    2    HA   VAL  34           HA       VAL  34 -28.878   1.057 -17.479
    3    HB   VAL  34           HB       VAL  34 -28.294  -0.397 -15.534
    4   HG12  VAL  34          HG11      VAL  34 -30.687  -1.339 -15.281
    5   HG11  VAL  34          HG12      VAL  34 -30.993  -0.582 -16.841
    6   HG13  VAL  34          HG13      VAL  34 -30.496   0.404 -15.466
    7   HG21  VAL  34          HG21      VAL  34 -28.381  -2.418 -17.554
    8   HG23  VAL  34          HG22      VAL  34 -29.455  -2.816 -16.212
    9   HG22  VAL  34          HG23      VAL  34 -27.751  -2.481 -15.909

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ILE  35           H        ILE  35 -26.934   1.545 -16.596
    2    HA   ILE  35           HA       ILE  35 -24.566   0.289 -17.817
    3    HB   ILE  35           HB       ILE  35 -25.066   3.162 -17.004
    4   HG12  ILE  35          HG12      ILE  35 -23.995   1.895 -19.533
    5   HG13  ILE  35          HG13      ILE  35 -25.647   2.467 -19.304
    6   HG21  ILE  35          HG21      ILE  35 -22.455   1.706 -17.267
    7   HG23  ILE  35          HG22      ILE  35 -22.968   2.865 -16.043
    8   HG22  ILE  35          HG23      ILE  35 -22.568   3.419 -17.669
    9   HD11  ILE  35          HD11      ILE  35 -24.323   4.699 -18.666
   10   HD13  ILE  35          HD12      ILE  35 -24.815   4.308 -20.314
   11   HD12  ILE  35          HD13      ILE  35 -23.164   3.985 -19.786

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ILE  36           H        ILE  36 -23.338  -0.706 -16.198
    2    HA   ILE  36           HA       ILE  36 -23.854  -0.117 -13.335
    3    HB   ILE  36           HB       ILE  36 -22.926  -2.790 -14.437
    4   HG12  ILE  36          HG12      ILE  36 -25.770  -2.070 -13.726
    5   HG13  ILE  36          HG13      ILE  36 -25.166  -2.025 -15.383
    6   HG23  ILE  36          HG21      ILE  36 -23.294  -3.638 -12.334
    7   HG22  ILE  36          HG22      ILE  36 -24.467  -2.390 -11.913
    8   HG21  ILE  36          HG23      ILE  36 -22.746  -2.007 -11.946
    9   HD13  ILE  36          HD11      ILE  36 -25.262  -4.242 -15.602
   10   HD12  ILE  36          HD12      ILE  36 -26.359  -4.157 -14.224
   11   HD11  ILE  36          HD13      ILE  36 -24.653  -4.529 -13.971

  No H/Q in entry =          11
  In of MODEL   37
    1    H    GLU  37           H        GLU  37 -22.115   0.559 -12.191
    2    HA   GLU  37           HA       GLU  37 -19.385  -0.154 -13.056
    3    HB2  GLU  37           HB2      GLU  37 -20.378   2.605 -12.362
    4    HB3  GLU  37           HB3      GLU  37 -18.673   2.163 -12.463
    5    HG2  GLU  37           HG2      GLU  37 -18.893   1.728 -14.823
    6    HG3  GLU  37           HG3      GLU  37 -20.621   2.064 -14.747

  No H/Q in entry =           6
  In of MODEL   37
    1    H    ALA  38           H        ALA  38 -17.925  -0.355 -11.345
    2    HA   ALA  38           HA       ALA  38 -19.016  -0.220  -8.595
    3    HB1  ALA  38           HB1      ALA  38 -17.217  -2.100  -9.993
    4    HB3  ALA  38           HB2      ALA  38 -18.286  -2.374  -8.619
    5    HB2  ALA  38           HB3      ALA  38 -16.700  -1.644  -8.370

  No H/Q in entry =           5
  In of MODEL   37
    1    H    PHE  39           H        PHE  39 -17.843   1.020  -7.092
    2    HA   PHE  39           HA       PHE  39 -15.338   2.302  -7.932
    3    HB2  PHE  39           HB2      PHE  39 -17.832   3.700  -7.001
    4    HB3  PHE  39           HB3      PHE  39 -16.237   4.420  -6.798
    5    HD1  PHE  39           HD1      PHE  39 -14.847   4.882  -8.823
    6    HD2  PHE  39           HD2      PHE  39 -18.967   3.801  -9.040
    7    HE1  PHE  39           HE1      PHE  39 -14.954   5.802 -11.121
    8    HE2  PHE  39           HE2      PHE  39 -19.089   4.709 -11.332
    9    HZ   PHE  39           HZ       PHE  39 -17.081   5.683 -12.394

  No H/Q in entry =           9
  In of MODEL   37
    1    HA   PRO  40           HA       PRO  40 -14.463   1.558  -3.631
    2    HB2  PRO  40           HB2      PRO  40 -12.773   3.625  -2.982
    3    HB3  PRO  40           HB3      PRO  40 -12.266   2.312  -4.045
    4    HG2  PRO  40           HG2      PRO  40 -13.359   5.018  -4.801
    5    HG3  PRO  40           HG3      PRO  40 -11.896   4.222  -5.384
    6    HD2  PRO  40           HD2      PRO  40 -14.087   4.071  -6.838
    7    HD3  PRO  40           HD3      PRO  40 -13.088   2.633  -6.628

  No H/Q in entry =           7
  In of MODEL   37
    1    H    GLU  41           H        GLU  41 -15.157   2.506  -1.510
    2    HA   GLU  41           HA       GLU  41 -17.455   4.137  -1.532
    3    HB2  GLU  41           HB2      GLU  41 -17.460   3.927   0.789
    4    HB3  GLU  41           HB3      GLU  41 -16.632   2.464   0.253
    5    HG2  GLU  41           HG2      GLU  41 -15.300   3.098   2.001
    6    HG3  GLU  41           HG3      GLU  41 -14.476   3.883   0.654

  No H/Q in entry =           6
  In of MODEL   37
    1    H    THR  42           H        THR  42 -14.155   5.161  -1.514
    2    HA   THR  42           HA       THR  42 -14.613   7.703  -0.299
    3    HB   THR  42           HB       THR  42 -12.457   8.351  -1.369
    4    HG1  THR  42           HG1      THR  42 -12.795   7.076  -3.277
    5   HG21  THR  42          HG21      THR  42 -12.526   7.071   0.774
    6   HG23  THR  42          HG22      THR  42 -11.073   6.750  -0.174
    7   HG22  THR  42          HG23      THR  42 -12.389   5.579  -0.154

  No H/Q in entry =           7
  In of MODEL   37
    1    H    LEU  43           H        LEU  43 -15.420   6.594  -3.421
    2    HA   LEU  43           HA       LEU  43 -15.743   9.362  -4.386
    3    HB2  LEU  43           HB2      LEU  43 -15.802   6.674  -5.726
    4    HB3  LEU  43           HB3      LEU  43 -16.380   8.135  -6.525
    5    HG   LEU  43           HG       LEU  43 -13.546   7.705  -5.615
    6   HD13  LEU  43          HD11      LEU  43 -13.671   6.210  -7.356
    7   HD12  LEU  43          HD12      LEU  43 -13.320   7.695  -8.238
    8   HD11  LEU  43          HD13      LEU  43 -14.973   7.089  -8.157
    9   HD21  LEU  43          HD21      LEU  43 -14.984   9.854  -7.159
   10   HD23  LEU  43          HD22      LEU  43 -13.240   9.625  -7.287
   11   HD22  LEU  43          HD23      LEU  43 -13.964  10.021  -5.729

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ALA  44           H        ALA  44 -17.665   7.466  -2.579
    2    HA   ALA  44           HA       ALA  44 -20.110   7.251  -3.951
    3    HB2  ALA  44           HB1      ALA  44 -19.978   6.131  -1.857
    4    HB3  ALA  44           HB2      ALA  44 -21.134   7.439  -1.601
    5    HB1  ALA  44           HB3      ALA  44 -19.478   7.598  -1.015

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLY  45           H        GLY  45 -18.813  10.090  -2.380
    2    HA3  GLY  45           HA2      GLY  45 -21.289  11.512  -2.784
    3    HA2  GLY  45           HA3      GLY  45 -19.778  12.183  -2.174

  No H/Q in entry =           3
  In of MODEL   37
    1    H    GLU  46           H        GLU  46 -18.171  11.307  -4.437
    2    HA   GLU  46           HA       GLU  46 -18.845  13.508  -6.210
    3    HB2  GLU  46           HB2      GLU  46 -16.585  11.499  -6.208
    4    HB3  GLU  46           HB3      GLU  46 -16.733  12.830  -7.357
    5    HG2  GLU  46           HG2      GLU  46 -16.441  13.122  -4.373
    6    HG3  GLU  46           HG3      GLU  46 -15.142  13.308  -5.552

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LYS  47           H        LYS  47 -18.602   9.997  -6.656
    2    HA   LYS  47           HA       LYS  47 -19.654  10.192  -9.352
    3    HB2  LYS  47           HB2      LYS  47 -19.055   7.808  -7.593
    4    HB3  LYS  47           HB3      LYS  47 -19.571   7.714  -9.277
    5    HG2  LYS  47           HG2      LYS  47 -17.087   9.158  -8.426
    6    HG3  LYS  47           HG3      LYS  47 -17.104   7.441  -8.827
    7    HD2  LYS  47           HD2      LYS  47 -18.101   8.023 -11.027
    8    HD3  LYS  47           HD3      LYS  47 -17.904   9.727 -10.620
    9    HE2  LYS  47           HE2      LYS  47 -15.487   8.101 -10.293
   10    HE3  LYS  47           HE3      LYS  47 -16.070   8.232 -11.951
   11    HZ2  LYS  47           HZ1      LYS  47 -14.503   9.994 -11.288
   12    HZ1  LYS  47           HZ2      LYS  47 -15.638  10.544 -10.151
   13    HZ3  LYS  47           HZ3      LYS  47 -16.006  10.588 -11.809

  No H/Q in entry =          13
  In of MODEL   37
    1    H    GLY  48           H        GLY  48 -21.014   9.380  -6.234
    2    HA3  GLY  48           HA2      GLY  48 -23.344   8.121  -7.026
    3    HA2  GLY  48           HA3      GLY  48 -23.180   9.116  -5.580

  No H/Q in entry =           3
  In of MODEL   37
    1    H    GLN  49           H        GLN  49 -22.644  11.563  -7.131
    2    HA   GLN  49           HA       GLN  49 -25.235  12.592  -7.322
    3    HB2  GLN  49           HB2      GLN  49 -22.694  13.543  -8.627
    4    HB3  GLN  49           HB3      GLN  49 -24.188  14.461  -8.570
    5    HG2  GLN  49           HG2      GLN  49 -24.077  14.480  -6.130
    6    HG3  GLN  49           HG3      GLN  49 -22.596  13.540  -6.187
    7   HE21  GLN  49          HE21      GLN  49 -22.576  15.767  -4.905
    8   HE22  GLN  49          HE22      GLN  49 -21.682  17.054  -5.529

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ASN  50           H        ASN  50 -23.449  10.777  -9.681
    2    HA   ASN  50           HA       ASN  50 -25.317  11.597 -11.798
    3    HB2  ASN  50           HB2      ASN  50 -22.685  10.141 -11.985
    4    HB3  ASN  50           HB3      ASN  50 -23.721  10.539 -13.348
    5   HD21  ASN  50          HD21      ASN  50 -21.146  11.462 -11.681
    6   HD22  ASN  50          HD22      ASN  50 -20.959  13.105 -12.013

  No H/Q in entry =           6
  In of MODEL   37
    1    H    ALA  51           H        ALA  51 -25.272   9.233  -9.560
    2    HA   ALA  51           HA       ALA  51 -25.951   7.071 -11.409
    3    HB2  ALA  51           HB1      ALA  51 -25.359   5.735  -9.716
    4    HB3  ALA  51           HB2      ALA  51 -26.528   6.502  -8.644
    5    HB1  ALA  51           HB3      ALA  51 -24.906   7.176  -8.806

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ASP  52           H        ASP  52 -27.924   5.953 -11.313
    2    HA   ASP  52           HA       ASP  52 -30.175   7.714 -10.686
    3    HB2  ASP  52           HB2      ASP  52 -29.872   5.223 -12.361
    4    HB3  ASP  52           HB3      ASP  52 -31.448   5.905 -11.954

  No H/Q in entry =           4
  In of MODEL   37
    1    H    VAL  53           H        VAL  53 -28.506   4.873  -9.648
    2    HA   VAL  53           HA       VAL  53 -29.998   4.945  -7.161
    3    HB   VAL  53           HB       VAL  53 -31.320   3.265  -8.438
    4   HG11  VAL  53          HG11      VAL  53 -29.517   2.466  -9.928
    5   HG13  VAL  53          HG12      VAL  53 -30.327   1.143  -9.090
    6   HG12  VAL  53          HG13      VAL  53 -28.744   1.692  -8.546
    7   HG23  VAL  53          HG21      VAL  53 -30.471   1.307  -6.737
    8   HG22  VAL  53          HG22      VAL  53 -31.647   2.574  -6.388
    9   HG21  VAL  53          HG23      VAL  53 -29.955   2.798  -5.946

  No H/Q in entry =           9
  In of MODEL   37
    1    H    VAL  54           H        VAL  54 -28.706   4.545  -5.482
    2    HA   VAL  54           HA       VAL  54 -25.909   3.784  -6.040
    3    HB   VAL  54           HB       VAL  54 -27.078   5.519  -3.807
    4   HG11  VAL  54          HG11      VAL  54 -24.452   4.180  -4.050
    5   HG13  VAL  54          HG12      VAL  54 -25.254   4.830  -2.621
    6   HG12  VAL  54          HG13      VAL  54 -24.359   5.906  -3.696
    7   HG22  VAL  54          HG21      VAL  54 -26.253   7.363  -4.882
    8   HG21  VAL  54          HG22      VAL  54 -26.743   6.362  -6.249
    9   HG23  VAL  54          HG23      VAL  54 -25.046   6.437  -5.776

  No H/Q in entry =           9
  In of MODEL   37
    1    H    LEU  55           H        LEU  55 -25.272   1.878  -5.393
    2    HA   LEU  55           HA       LEU  55 -26.782   0.513  -3.252
    3    HB2  LEU  55           HB2      LEU  55 -25.145  -0.598  -5.520
    4    HB3  LEU  55           HB3      LEU  55 -25.903  -1.560  -4.250
    5    HG   LEU  55           HG       LEU  55 -27.345  -0.008  -6.391
    6   HD13  LEU  55          HD11      LEU  55 -26.965  -1.846  -7.610
    7   HD12  LEU  55          HD12      LEU  55 -27.918  -2.754  -6.437
    8   HD11  LEU  55          HD13      LEU  55 -26.169  -2.637  -6.252
    9   HD23  LEU  55          HD21      LEU  55 -28.616  -2.000  -4.569
   10   HD22  LEU  55          HD22      LEU  55 -29.336  -0.636  -5.424
   11   HD21  LEU  55          HD23      LEU  55 -28.353  -0.355  -3.988

  No H/Q in entry =          11
  In of MODEL   37
    1    H    LEU  56           H        LEU  56 -25.649  -0.053  -1.426
    2    HA   LEU  56           HA       LEU  56 -22.728   0.430  -1.416
    3    HB2  LEU  56           HB2      LEU  56 -24.571   0.156   0.946
    4    HB3  LEU  56           HB3      LEU  56 -22.875   0.637   0.970
    5    HG   LEU  56           HG       LEU  56 -25.204   2.249  -0.034
    6   HD11  LEU  56          HD11      LEU  56 -24.129   1.891   2.507
    7   HD13  LEU  56          HD12      LEU  56 -25.149   3.231   1.986
    8   HD12  LEU  56          HD13      LEU  56 -23.395   3.389   1.934
    9   HD23  LEU  56          HD21      LEU  56 -23.307   4.006  -0.183
   10   HD22  LEU  56          HD22      LEU  56 -23.631   2.904  -1.521
   11   HD21  LEU  56          HD23      LEU  56 -22.289   2.587  -0.422

  No H/Q in entry =          11
  In of MODEL   37
    1    H    GLY  57           H        GLY  57 -21.310  -1.160  -0.861
    2    HA3  GLY  57           HA2      GLY  57 -22.144  -3.872  -1.086
    3    HA2  GLY  57           HA3      GLY  57 -20.550  -3.330  -0.568

  No H/Q in entry =           3
  In of MODEL   37
    1    HA   PRO  58           HA       PRO  58 -23.400  -4.468   3.078
    2    HB2  PRO  58           HB2      PRO  58 -22.651  -7.054   3.689
    3    HB3  PRO  58           HB3      PRO  58 -24.026  -6.683   2.650
    4    HG2  PRO  58           HG2      PRO  58 -21.259  -7.479   1.916
    5    HG3  PRO  58           HG3      PRO  58 -22.794  -7.982   1.211
    6    HD2  PRO  58           HD2      PRO  58 -21.216  -6.113   0.027
    7    HD3  PRO  58           HD3      PRO  58 -22.975  -6.078  -0.110

  No H/Q in entry =           7
  In of MODEL   37
    1    H    GLN  59           H        GLN  59 -20.006  -4.837   2.537
    2    HA   GLN  59           HA       GLN  59 -19.306  -4.844   5.312
    3    HB2  GLN  59           HB2      GLN  59 -17.776  -4.145   2.816
    4    HB3  GLN  59           HB3      GLN  59 -17.085  -3.925   4.410
    5    HG2  GLN  59           HG2      GLN  59 -16.280  -5.995   3.790
    6    HG3  GLN  59           HG3      GLN  59 -17.683  -6.416   4.757
    7   HE21  GLN  59          HE21      GLN  59 -17.962  -8.164   3.768
    8   HE22  GLN  59          HE22      GLN  59 -18.557  -8.700   2.310

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ILE  60           H        ILE  60 -20.270  -2.313   3.094
    2    HA   ILE  60           HA       ILE  60 -19.518  -0.340   5.163
    3    HB   ILE  60           HB       ILE  60 -19.768   1.389   3.336
    4   HG12  ILE  60          HG12      ILE  60 -19.452  -0.818   1.349
    5   HG13  ILE  60          HG13      ILE  60 -21.069  -0.345   1.870
    6   HG22  ILE  60          HG21      ILE  60 -17.669  -0.572   2.558
    7   HG21  ILE  60          HG22      ILE  60 -17.620   0.238   4.124
    8   HG23  ILE  60          HG23      ILE  60 -17.590   1.188   2.638
    9   HD11  ILE  60          HD11      ILE  60 -20.236   2.073   1.265
   10   HD13  ILE  60          HD12      ILE  60 -20.783   0.983  -0.009
   11   HD12  ILE  60          HD13      ILE  60 -19.057   1.206   0.282

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ALA  61           H        ALA  61 -21.925  -1.997   5.178
    2    HA   ALA  61           HA       ALA  61 -24.190  -0.397   4.681
    3    HB1  ALA  61           HB1      ALA  61 -25.388  -1.927   5.976
    4    HB2  ALA  61           HB2      ALA  61 -23.999  -2.279   7.006
    5    HB3  ALA  61           HB3      ALA  61 -24.043  -2.882   5.348

  No H/Q in entry =           5
  In of MODEL   37
    1    H    TYR  62           H        TYR  62 -22.036  -0.455   7.521
    2    HA   TYR  62           HA       TYR  62 -23.673   1.149   9.166
    3    HB2  TYR  62           HB2      TYR  62 -21.695   1.600  10.461
    4    HB3  TYR  62           HB3      TYR  62 -21.644  -0.083   9.938
    5    HD1  TYR  62           HD1      TYR  62 -19.984  -0.830   8.271
    6    HD2  TYR  62           HD2      TYR  62 -20.034   3.212   9.660
    7    HE1  TYR  62           HE1      TYR  62 -17.759  -0.464   7.274
    8    HE2  TYR  62           HE2      TYR  62 -17.795   3.572   8.665
    9    HH   TYR  62           HH       TYR  62 -16.494   2.490   6.725

  No H/Q in entry =           9
  In of MODEL   37
    1    H    MET  63           H        MET  63 -22.000   2.066   6.346
    2    HA   MET  63           HA       MET  63 -21.929   4.900   7.052
    3    HB2  MET  63           HB2      MET  63 -21.226   3.403   4.527
    4    HB3  MET  63           HB3      MET  63 -21.093   5.153   4.712
    5    HG2  MET  63           HG2      MET  63 -19.403   4.865   6.419
    6    HG3  MET  63           HG3      MET  63 -19.560   3.114   6.301
    7    HE3  MET  63           HE1      MET  63 -19.031   5.798   2.929
    8    HE2  MET  63           HE2      MET  63 -17.543   6.111   3.823
    9    HE1  MET  63           HE3      MET  63 -19.105   6.276   4.627

  No H/Q in entry =           9
  In of MODEL   37
    1    H    LEU  64           H        LEU  64 -24.419   2.976   6.031
    2    HA   LEU  64           HA       LEU  64 -25.628   4.367   3.933
    3    HB2  LEU  64           HB2      LEU  64 -26.454   2.233   4.827
    4    HB3  LEU  64           HB3      LEU  64 -26.964   3.057   6.300
    5    HG   LEU  64           HG       LEU  64 -28.669   4.267   5.043
    6   HD13  LEU  64          HD11      LEU  64 -28.350   4.525   2.818
    7   HD12  LEU  64          HD12      LEU  64 -28.946   2.872   2.654
    8   HD11  LEU  64          HD13      LEU  64 -27.212   3.181   2.747
    9   HD23  LEU  64          HD21      LEU  64 -29.092   1.444   4.276
   10   HD22  LEU  64          HD22      LEU  64 -30.130   2.545   5.180
   11   HD21  LEU  64          HD23      LEU  64 -28.748   1.789   5.971

  No H/Q in entry =          11
  In of MODEL   37
    1    HA   PRO  65           HA       PRO  65 -27.951   7.447   6.652
    2    HB2  PRO  65           HB2      PRO  65 -26.000   7.654   8.946
    3    HB3  PRO  65           HB3      PRO  65 -27.746   7.886   8.958
    4    HG2  PRO  65           HG2      PRO  65 -26.772   5.654   9.895
    5    HG3  PRO  65           HG3      PRO  65 -28.170   5.586   8.823
    6    HD2  PRO  65           HD2      PRO  65 -25.269   5.054   8.174
    7    HD3  PRO  65           HD3      PRO  65 -26.692   4.130   7.695

  No H/Q in entry =           7
  In of MODEL   37
    1    H    GLU  66           H        GLU  66 -24.397   7.491   6.794
    2    HA   GLU  66           HA       GLU  66 -24.169  10.298   6.405
    3    HB2  GLU  66           HB2      GLU  66 -22.280   8.044   5.781
    4    HB3  GLU  66           HB3      GLU  66 -21.874   9.749   5.588
    5    HG2  GLU  66           HG2      GLU  66 -22.142  10.104   7.952
    6    HG3  GLU  66           HG3      GLU  66 -22.626   8.423   8.168

  No H/Q in entry =           6
  In of MODEL   37
    1    H    ILE  67           H        ILE  67 -24.151   7.559   4.142
    2    HA   ILE  67           HA       ILE  67 -23.738   9.287   1.863
    3    HB   ILE  67           HB       ILE  67 -24.560   6.356   2.015
    4   HG12  ILE  67          HG12      ILE  67 -21.945   7.600   1.148
    5   HG13  ILE  67          HG13      ILE  67 -22.262   7.166   2.827
    6   HG21  ILE  67          HG21      ILE  67 -24.510   8.244  -0.202
    7   HG23  ILE  67          HG22      ILE  67 -25.092   6.580  -0.169
    8   HG22  ILE  67          HG23      ILE  67 -23.386   6.911  -0.463
    9   HD12  ILE  67          HD11      ILE  67 -21.748   5.415   0.480
   10   HD11  ILE  67          HD12      ILE  67 -22.772   4.811   1.781
   11   HD13  ILE  67          HD13      ILE  67 -21.119   5.320   2.124

  No H/Q in entry =          11
  In of MODEL   37
    1    H    GLN  68           H        GLN  68 -26.610   8.151   3.437
    2    HA   GLN  68           HA       GLN  68 -28.424   9.041   1.430
    3    HB2  GLN  68           HB2      GLN  68 -28.728   8.665   4.407
    4    HB3  GLN  68           HB3      GLN  68 -30.043   9.229   3.390
    5    HG2  GLN  68           HG2      GLN  68 -29.994   7.204   2.107
    6    HG3  GLN  68           HG3      GLN  68 -28.546   6.662   2.935
    7   HE21  GLN  68          HE21      GLN  68 -30.685   5.249   2.753
    8   HE22  GLN  68          HE22      GLN  68 -31.529   4.766   4.150

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ARG  69           H        ARG  69 -26.915  10.737   4.204
    2    HA   ARG  69           HA       ARG  69 -28.335  13.185   3.781
    3    HB2  ARG  69           HB2      ARG  69 -25.998  12.309   5.411
    4    HB3  ARG  69           HB3      ARG  69 -26.113  14.027   5.057
    5    HG2  ARG  69           HG2      ARG  69 -28.449  14.008   5.984
    6    HG3  ARG  69           HG3      ARG  69 -28.207  12.322   6.455
    7    HD2  ARG  69           HD2      ARG  69 -26.592  14.715   7.410
    8    HD3  ARG  69           HD3      ARG  69 -27.716  13.777   8.379
    9    HE   ARG  69           HE       ARG  69 -25.064  12.915   7.477
   10   HH21  ARG  69          HH11      ARG  69 -24.235  11.168   8.682
   11   HH22  ARG  69          HH12      ARG  69 -25.265  10.321   9.787
   12   HH11  ARG  69          HH21      ARG  69 -28.039  12.287   9.116
   13   HH12  ARG  69          HH22      ARG  69 -27.418  10.953  10.031

  No H/Q in entry =          13
  In of MODEL   37
    1    H    LEU  70           H        LEU  70 -25.404  11.856   2.470
    2    HA   LEU  70           HA       LEU  70 -24.327  14.253   1.333
    3    HB2  LEU  70           HB2      LEU  70 -23.287  11.958   1.939
    4    HB3  LEU  70           HB3      LEU  70 -23.860  11.484   0.340
    5    HG   LEU  70           HG       LEU  70 -22.280  12.899  -0.709
    6   HD11  LEU  70          HD11      LEU  70 -21.532  13.752   2.097
    7   HD13  LEU  70          HD12      LEU  70 -22.229  14.773   0.839
    8   HD12  LEU  70          HD13      LEU  70 -20.598  14.132   0.648
    9   HD22  LEU  70          HD21      LEU  70 -20.811  11.218  -0.456
   10   HD21  LEU  70          HD22      LEU  70 -21.750  10.666   0.931
   11   HD23  LEU  70          HD23      LEU  70 -20.396  11.772   1.166

  No H/Q in entry =          11
  In of MODEL   37
    1    H    LEU  71           H        LEU  71 -26.396  11.663   0.168
    2    HA   LEU  71           HA       LEU  71 -26.909  13.148  -2.353
    3    HB2  LEU  71           HB2      LEU  71 -27.052  10.158  -1.922
    4    HB3  LEU  71           HB3      LEU  71 -27.173  11.022  -3.454
    5    HG   LEU  71           HG       LEU  71 -24.685  11.086  -1.745
    6   HD12  LEU  71          HD11      LEU  71 -24.653   9.468  -4.184
    7   HD11  LEU  71          HD12      LEU  71 -25.674   8.815  -2.903
    8   HD13  LEU  71          HD13      LEU  71 -23.967   9.134  -2.595
    9   HD22  LEU  71          HD21      LEU  71 -24.801  12.906  -3.234
   10   HD21  LEU  71          HD22      LEU  71 -25.250  11.858  -4.579
   11   HD23  LEU  71          HD23      LEU  71 -23.638  11.746  -3.871

  No H/Q in entry =          11
  In of MODEL   37
    1    HA   PRO  72           HA       PRO  72 -30.813  12.601   0.192
    2    HB2  PRO  72           HB2      PRO  72 -31.726  15.141   0.104
    3    HB3  PRO  72           HB3      PRO  72 -30.428  14.715   1.219
    4    HG2  PRO  72           HG2      PRO  72 -30.216  15.925  -1.526
    5    HG3  PRO  72           HG3      PRO  72 -29.490  16.486  -0.021
    6    HD2  PRO  72           HD2      PRO  72 -28.086  14.966  -1.767
    7    HD3  PRO  72           HD3      PRO  72 -27.861  14.797  -0.027

  No H/Q in entry =           7
  In of MODEL   37
    1    H    ASN  73           H        ASN  73 -30.151  13.582  -3.006
    2    HA   ASN  73           HA       ASN  73 -32.990  13.213  -3.694
    3    HB2  ASN  73           HB2      ASN  73 -32.509  14.338  -5.777
    4    HB3  ASN  73           HB3      ASN  73 -32.034  15.324  -4.403
    5   HD21  ASN  73          HD21      ASN  73 -31.189  15.397  -7.064
    6   HD22  ASN  73          HD22      ASN  73 -29.515  15.273  -7.225

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LYS  74           H        LYS  74 -30.970  10.999  -3.239
    2    HA   LYS  74           HA       LYS  74 -31.459   9.604  -5.803
    3    HB2  LYS  74           HB2      LYS  74 -28.952   9.358  -4.136
    4    HB3  LYS  74           HB3      LYS  74 -29.291   8.544  -5.663
    5    HG2  LYS  74           HG2      LYS  74 -29.091  11.518  -5.445
    6    HG3  LYS  74           HG3      LYS  74 -27.690  10.485  -5.727
    7    HD2  LYS  74           HD2      LYS  74 -28.751   9.543  -7.694
    8    HD3  LYS  74           HD3      LYS  74 -30.197  10.509  -7.398
    9    HE2  LYS  74           HE2      LYS  74 -29.005  12.542  -7.809
   10    HE3  LYS  74           HE3      LYS  74 -27.465  11.683  -7.875
   11    HZ2  LYS  74           HZ1      LYS  74 -28.906  12.264 -10.026
   12    HZ1  LYS  74           HZ2      LYS  74 -29.537  10.728  -9.672
   13    HZ3  LYS  74           HZ3      LYS  74 -27.871  10.923  -9.936

  No H/Q in entry =          13
  In of MODEL   37
    1    HA   PRO  75           HA       PRO  75 -32.848   6.578  -2.870
    2    HB2  PRO  75           HB2      PRO  75 -33.083   4.361  -4.465
    3    HB3  PRO  75           HB3      PRO  75 -34.235   5.692  -4.551
    4    HG2  PRO  75           HG2      PRO  75 -31.852   5.150  -6.280
    5    HG3  PRO  75           HG3      PRO  75 -33.500   5.555  -6.756
    6    HD2  PRO  75           HD2      PRO  75 -31.599   7.459  -6.669
    7    HD3  PRO  75           HD3      PRO  75 -33.248   7.824  -6.161

  No H/Q in entry =           7
  In of MODEL   37
    1    H    VAL  76           H        VAL  76 -31.401   5.547  -1.473
    2    HA   VAL  76           HA       VAL  76 -28.892   4.392  -2.537
    3    HB   VAL  76           HB       VAL  76 -29.260   5.842   0.119
    4   HG11  VAL  76          HG11      VAL  76 -26.851   4.607  -1.232
    5   HG13  VAL  76          HG12      VAL  76 -27.569   4.137   0.312
    6   HG12  VAL  76          HG13      VAL  76 -26.750   5.691   0.157
    7   HG22  VAL  76          HG21      VAL  76 -28.613   7.759  -0.748
    8   HG21  VAL  76          HG22      VAL  76 -29.112   7.058  -2.289
    9   HG23  VAL  76          HG23      VAL  76 -27.418   7.002  -1.802

  No H/Q in entry =           9
  In of MODEL   37
    1    H    GLU  77           H        GLU  77 -28.643   2.240  -1.928
    2    HA   GLU  77           HA       GLU  77 -29.465   1.428   0.708
    3    HB2  GLU  77           HB2      GLU  77 -31.028  -0.250   0.141
    4    HB3  GLU  77           HB3      GLU  77 -31.594   1.264  -0.566
    5    HG2  GLU  77           HG2      GLU  77 -30.928   0.527  -2.745
    6    HG3  GLU  77           HG3      GLU  77 -30.269  -0.960  -2.064

  No H/Q in entry =           6
  In of MODEL   37
    1    H    VAL  78           H        VAL  78 -29.108  -0.655   1.367
    2    HA   VAL  78           HA       VAL  78 -26.410  -1.370   0.527
    3    HB   VAL  78           HB       VAL  78 -28.145  -2.297   2.857
    4   HG11  VAL  78          HG11      VAL  78 -25.760  -3.474   1.773
    5   HG13  VAL  78          HG12      VAL  78 -26.686  -3.968   3.192
    6   HG12  VAL  78          HG13      VAL  78 -25.392  -2.781   3.352
    7   HG22  VAL  78          HG21      VAL  78 -26.740  -0.910   4.227
    8   HG21  VAL  78          HG22      VAL  78 -27.471   0.049   2.941
    9   HG23  VAL  78          HG23      VAL  78 -25.782  -0.443   2.823

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ILE  79           H        ILE  79 -25.817  -3.263  -0.374
    2    HA   ILE  79           HA       ILE  79 -27.821  -4.777  -1.766
    3    HB   ILE  79           HB       ILE  79 -24.825  -5.244  -1.488
    4   HG12  ILE  79          HG12      ILE  79 -26.439  -4.165  -3.804
    5   HG13  ILE  79          HG13      ILE  79 -25.609  -3.142  -2.631
    6   HG22  ILE  79          HG21      ILE  79 -25.858  -6.438  -3.832
    7   HG21  ILE  79          HG22      ILE  79 -26.858  -6.984  -2.486
    8   HG23  ILE  79          HG23      ILE  79 -25.112  -7.227  -2.442
    9   HD13  ILE  79          HD11      ILE  79 -24.157  -3.220  -4.422
   10   HD12  ILE  79          HD12      ILE  79 -24.457  -4.934  -4.715
   11   HD11  ILE  79          HD13      ILE  79 -23.510  -4.431  -3.314

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ASP  80           H        ASP  80 -28.657  -6.720  -1.205
    2    HA   ASP  80           HA       ASP  80 -28.636  -7.628   1.439
    3    HB2  ASP  80           HB2      ASP  80 -30.346  -8.234  -0.236
    4    HB3  ASP  80           HB3      ASP  80 -29.152  -9.214  -1.085

  No H/Q in entry =           4
  In of MODEL   37
    1    H    SER  81           H        SER  81 -27.100  -8.736   2.595
    2    HA   SER  81           HA       SER  81 -24.568  -9.363   1.450
    3    HB2  SER  81           HB2      SER  81 -24.038 -10.388   3.626
    4    HB3  SER  81           HB3      SER  81 -24.775  -8.799   3.831
    5    HG   SER  81           HG       SER  81 -26.346 -11.111   3.843

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU  82           H        LEU  82 -27.241 -11.510   1.713
    2    HA   LEU  82           HA       LEU  82 -25.635 -13.845   1.216
    3    HB2  LEU  82           HB2      LEU  82 -28.578 -13.287   0.906
    4    HB3  LEU  82           HB3      LEU  82 -27.838 -14.874   0.704
    5    HG   LEU  82           HG       LEU  82 -27.867 -13.301   3.261
    6   HD11  LEU  82          HD11      LEU  82 -29.591 -15.529   2.180
    7   HD13  LEU  82          HD12      LEU  82 -30.101 -13.982   2.861
    8   HD12  LEU  82          HD13      LEU  82 -29.427 -15.229   3.911
    9   HD23  LEU  82          HD21      LEU  82 -27.223 -15.684   4.054
   10   HD22  LEU  82          HD22      LEU  82 -25.984 -14.689   3.291
   11   HD21  LEU  82          HD23      LEU  82 -26.789 -15.955   2.365

  No H/Q in entry =          11
  In of MODEL   37
    1    H    LEU  83           H        LEU  83 -27.601 -11.653  -0.734
    2    HA   LEU  83           HA       LEU  83 -27.325 -12.999  -3.206
    3    HB2  LEU  83           HB2      LEU  83 -27.806 -10.102  -2.557
    4    HB3  LEU  83           HB3      LEU  83 -27.794 -10.742  -4.200
    5    HG   LEU  83           HG       LEU  83 -29.860 -11.178  -2.064
    6   HD13  LEU  83          HD11      LEU  83 -30.634  -9.342  -3.137
    7   HD12  LEU  83          HD12      LEU  83 -31.049 -10.461  -4.435
    8   HD11  LEU  83          HD13      LEU  83 -29.531  -9.563  -4.495
    9   HD23  LEU  83          HD21      LEU  83 -29.921 -12.429  -4.795
   10   HD22  LEU  83          HD22      LEU  83 -30.911 -12.803  -3.385
   11   HD21  LEU  83          HD23      LEU  83 -29.211 -13.272  -3.418

  No H/Q in entry =          11
  In of MODEL   37
    1    H    TYR  84           H        TYR  84 -25.453 -10.579  -1.485
    2    HA   TYR  84           HA       TYR  84 -23.561 -10.047  -3.577
    3    HB2  TYR  84           HB2      TYR  84 -24.147  -8.577  -1.563
    4    HB3  TYR  84           HB3      TYR  84 -23.126  -9.660  -0.620
    5    HD1  TYR  84           HD1      TYR  84 -20.758  -9.479  -0.671
    6    HD2  TYR  84           HD2      TYR  84 -23.122  -7.234  -3.428
    7    HE1  TYR  84           HE1      TYR  84 -18.746  -8.211  -1.344
    8    HE2  TYR  84           HE2      TYR  84 -21.118  -5.965  -4.119
    9    HH   TYR  84           HH       TYR  84 -18.547  -5.606  -2.488

  No H/Q in entry =           9
  In of MODEL   37
    1    H    GLY  85           H        GLY  85 -23.337 -12.053  -0.632
    2    HA3  GLY  85           HA2      GLY  85 -20.731 -12.944  -1.068
    3    HA2  GLY  85           HA3      GLY  85 -21.963 -13.817  -0.156

  No H/Q in entry =           3
  In of MODEL   37
    1    H    LYS  86           H        LYS  86 -23.762 -14.221  -2.254
    2    HA   LYS  86           HA       LYS  86 -22.636 -16.570  -3.498
    3    HB2  LYS  86           HB2      LYS  86 -24.928 -16.373  -2.551
    4    HB3  LYS  86           HB3      LYS  86 -25.312 -15.211  -3.819
    5    HG2  LYS  86           HG2      LYS  86 -25.042 -16.934  -5.491
    6    HG3  LYS  86           HG3      LYS  86 -24.637 -18.098  -4.229
    7    HD2  LYS  86           HD2      LYS  86 -26.807 -17.658  -3.145
    8    HD3  LYS  86           HD3      LYS  86 -27.213 -16.528  -4.436
    9    HE2  LYS  86           HE2      LYS  86 -27.068 -18.347  -6.069
   10    HE3  LYS  86           HE3      LYS  86 -26.671 -19.476  -4.774
   11    HZ3  LYS  86           HZ1      LYS  86 -28.841 -19.746  -4.478
   12    HZ2  LYS  86           HZ2      LYS  86 -29.214 -18.509  -5.583
   13    HZ1  LYS  86           HZ3      LYS  86 -28.941 -18.134  -3.950

  No H/Q in entry =          13
  In of MODEL   37
    1    H    VAL  87           H        VAL  87 -22.673 -13.353  -4.384
    2    HA   VAL  87           HA       VAL  87 -22.361 -12.169  -6.316
    3    HB   VAL  87           HB       VAL  87 -21.214 -14.660  -7.611
    4   HG12  VAL  87          HG11      VAL  87 -20.023 -11.910  -7.684
    5   HG11  VAL  87          HG12      VAL  87 -21.466 -12.236  -8.646
    6   HG13  VAL  87          HG13      VAL  87 -19.995 -13.169  -8.916
    7   HG23  VAL  87          HG21      VAL  87 -19.772 -12.933  -5.607
    8   HG22  VAL  87          HG22      VAL  87 -19.083 -14.260  -6.538
    9   HG21  VAL  87          HG23      VAL  87 -20.318 -14.585  -5.325

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ASP  88           H        ASP  88 -24.869 -12.862  -6.013
    2    HA   ASP  88           HA       ASP  88 -25.919 -14.095  -8.435
    3    HB2  ASP  88           HB2      ASP  88 -26.954 -14.367  -6.130
    4    HB3  ASP  88           HB3      ASP  88 -27.439 -12.675  -6.235

  No H/Q in entry =           4
  In of MODEL   37
    1    H    GLY  89           H        GLY  89 -25.210 -12.818 -10.059
    2    HA3  GLY  89           HA2      GLY  89 -25.446 -10.049 -10.258
    3    HA2  GLY  89           HA3      GLY  89 -25.372 -11.165 -11.620

  No H/Q in entry =           3
  In of MODEL   37
    1    H    LEU  90           H        LEU  90 -27.799 -12.569 -11.221
    2    HA   LEU  90           HA       LEU  90 -29.629 -10.669 -12.363
    3    HB2  LEU  90           HB2      LEU  90 -29.633 -13.065 -12.950
    4    HB3  LEU  90           HB3      LEU  90 -30.161 -13.446 -11.312
    5    HG   LEU  90           HG       LEU  90 -32.296 -12.372 -11.712
    6   HD13  LEU  90          HD11      LEU  90 -32.125 -10.623 -13.179
    7   HD12  LEU  90          HD12      LEU  90 -32.617 -11.869 -14.329
    8   HD11  LEU  90          HD13      LEU  90 -30.915 -11.439 -14.172
    9   HD23  LEU  90          HD21      LEU  90 -32.146 -13.994 -14.149
   10   HD22  LEU  90          HD22      LEU  90 -33.149 -14.183 -12.711
   11   HD21  LEU  90          HD23      LEU  90 -31.483 -14.761 -12.706

  No H/Q in entry =          11
  In of MODEL   37
    1    H    GLY  91           H        GLY  91 -29.488 -12.175  -9.181
    2    HA3  GLY  91           HA2      GLY  91 -31.869 -11.115  -8.182
    3    HA2  GLY  91           HA3      GLY  91 -30.483 -11.621  -7.215

  No H/Q in entry =           3
  In of MODEL   37
    1    H    VAL  92           H        VAL  92 -28.588  -9.752  -8.031
    2    HA   VAL  92           HA       VAL  92 -29.457  -7.472  -6.492
    3    HB   VAL  92           HB       VAL  92 -26.872  -7.883  -8.041
    4   HG12  VAL  92          HG11      VAL  92 -27.119  -6.008  -5.714
    5   HG11  VAL  92          HG12      VAL  92 -27.767  -5.475  -7.267
    6   HG13  VAL  92          HG13      VAL  92 -26.064  -5.907  -7.124
    7   HG22  VAL  92          HG21      VAL  92 -26.645  -9.470  -6.449
    8   HG21  VAL  92          HG22      VAL  92 -27.826  -8.716  -5.375
    9   HG23  VAL  92          HG23      VAL  92 -26.183  -8.081  -5.464

  No H/Q in entry =           9
  In of MODEL   37
    1    H    LEU  93           H        LEU  93 -28.973  -8.115  -9.906
    2    HA   LEU  93           HA       LEU  93 -29.357  -5.485 -10.836
    3    HB2  LEU  93           HB2      LEU  93 -28.649  -7.322 -12.289
    4    HB3  LEU  93           HB3      LEU  93 -30.228  -8.084 -12.097
    5    HG   LEU  93           HG       LEU  93 -31.260  -6.140 -13.236
    6   HD11  LEU  93          HD11      LEU  93 -29.453  -4.507 -12.694
    7   HD13  LEU  93          HD12      LEU  93 -29.861  -4.542 -14.411
    8   HD12  LEU  93          HD13      LEU  93 -28.402  -5.347 -13.834
    9   HD23  LEU  93          HD21      LEU  93 -30.167  -6.679 -15.505
   10   HD22  LEU  93          HD22      LEU  93 -30.999  -7.956 -14.618
   11   HD21  LEU  93          HD23      LEU  93 -29.237  -7.863 -14.587

  No H/Q in entry =          11
  In of MODEL   37
    1    H    LYS  94           H        LYS  94 -31.693  -8.084 -10.036
    2    HA   LYS  94           HA       LYS  94 -34.055  -6.691 -10.701
    3    HB2  LYS  94           HB2      LYS  94 -33.532  -8.870  -8.684
    4    HB3  LYS  94           HB3      LYS  94 -35.138  -8.207  -8.980
    5    HG2  LYS  94           HG2      LYS  94 -34.992  -8.975 -11.314
    6    HG3  LYS  94           HG3      LYS  94 -33.423  -9.693 -10.959
    7    HD2  LYS  94           HD2      LYS  94 -34.547 -11.055  -9.157
    8    HD3  LYS  94           HD3      LYS  94 -36.093 -10.440  -9.740
    9    HE2  LYS  94           HE2      LYS  94 -35.517 -11.352 -11.998
   10    HE3  LYS  94           HE3      LYS  94 -34.099 -12.106 -11.271
   11    HZ3  LYS  94           HZ1      LYS  94 -35.913 -13.667 -11.479
   12    HZ2  LYS  94           HZ2      LYS  94 -36.925 -12.664 -10.552
   13    HZ1  LYS  94           HZ3      LYS  94 -35.562 -13.384  -9.841

  No H/Q in entry =          13
  In of MODEL   37
    1    H    ALA  95           H        ALA  95 -32.285  -6.781  -7.619
    2    HA   ALA  95           HA       ALA  95 -34.194  -5.245  -6.170
    3    HB2  ALA  95           HB1      ALA  95 -31.801  -6.570  -5.593
    4    HB3  ALA  95           HB2      ALA  95 -32.819  -5.689  -4.456
    5    HB1  ALA  95           HB3      ALA  95 -31.474  -4.871  -5.250

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA  96           H        ALA  96 -31.534  -4.330  -8.217
    2    HA   ALA  96           HA       ALA  96 -31.509  -1.568  -7.434
    3    HB2  ALA  96           HB1      ALA  96 -30.114  -1.307  -9.519
    4    HB3  ALA  96           HB2      ALA  96 -30.376  -3.021  -9.847
    5    HB1  ALA  96           HB3      ALA  96 -29.499  -2.525  -8.400

  No H/Q in entry =           5
  In of MODEL   37
    1    H    VAL  97           H        VAL  97 -32.956  -3.307 -10.153
    2    HA   VAL  97           HA       VAL  97 -34.050  -1.026 -11.423
    3    HB   VAL  97           HB       VAL  97 -34.799  -3.967 -11.487
    4   HG11  VAL  97          HG11      VAL  97 -36.623  -1.997 -12.000
    5   HG13  VAL  97          HG12      VAL  97 -36.636  -3.589 -12.761
    6   HG12  VAL  97          HG13      VAL  97 -35.894  -2.221 -13.592
    7   HG21  VAL  97          HG21      VAL  97 -33.520  -2.108 -13.494
    8   HG23  VAL  97          HG22      VAL  97 -33.933  -3.797 -13.795
    9   HG22  VAL  97          HG23      VAL  97 -32.715  -3.388 -12.586

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ALA  98           H        ALA  98 -35.235  -3.236  -8.914
    2    HA   ALA  98           HA       ALA  98 -37.824  -2.139  -8.606
    3    HB1  ALA  98           HB1      ALA  98 -36.786  -4.321  -7.561
    4    HB3  ALA  98           HB2      ALA  98 -38.001  -3.423  -6.649
    5    HB2  ALA  98           HB3      ALA  98 -36.291  -3.241  -6.257

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA  99           H        ALA  99 -34.792  -1.285  -6.901
    2    HA   ALA  99           HA       ALA  99 -35.989   0.671  -5.254
    3    HB1  ALA  99           HB1      ALA  99 -33.310  -0.165  -5.956
    4    HB2  ALA  99           HB2      ALA  99 -33.902   0.570  -4.466
    5    HB3  ALA  99           HB3      ALA  99 -33.421   1.590  -5.821

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ILE 100           H        ILE 100 -34.891   0.833  -8.590
    2    HA   ILE 100           HA       ILE 100 -35.118   3.677  -8.804
    3    HB   ILE 100           HB       ILE 100 -35.135   1.529 -10.951
    4   HG12  ILE 100          HG12      ILE 100 -33.021   3.559 -10.235
    5   HG13  ILE 100          HG13      ILE 100 -33.038   1.909  -9.611
    6   HG21  ILE 100          HG21      ILE 100 -35.610   4.440 -11.080
    7   HG23  ILE 100          HG22      ILE 100 -36.072   3.166 -12.209
    8   HG22  ILE 100          HG23      ILE 100 -34.431   3.813 -12.232
    9   HD12  ILE 100          HD11      ILE 100 -32.474   2.886 -12.371
   10   HD11  ILE 100          HD12      ILE 100 -33.109   1.257 -12.133
   11   HD13  ILE 100          HD13      ILE 100 -31.584   1.727 -11.384

  No H/Q in entry =          11
  In of MODEL   37
    1    H    LYS 101           H        LYS 101 -37.351   1.029  -9.580
    2    HA   LYS 101           HA       LYS 101 -39.443   2.642 -10.611
    3    HB2  LYS 101           HB2      LYS 101 -39.297  -0.133  -9.491
    4    HB3  LYS 101           HB3      LYS 101 -40.855   0.601  -9.862
    5    HG2  LYS 101           HG2      LYS 101 -40.343   0.754 -12.150
    6    HG3  LYS 101           HG3      LYS 101 -38.644   0.378 -11.867
    7    HD2  LYS 101           HD2      LYS 101 -39.843  -1.549 -12.781
    8    HD3  LYS 101           HD3      LYS 101 -39.239  -1.874 -11.156
    9    HE2  LYS 101           HE2      LYS 101 -41.298  -2.608 -10.689
   10    HE3  LYS 101           HE3      LYS 101 -41.785  -0.913 -10.695
   11    HZ3  LYS 101           HZ1      LYS 101 -42.635  -1.078 -12.829
   12    HZ2  LYS 101           HZ2      LYS 101 -43.082  -2.562 -12.135
   13    HZ1  LYS 101           HZ3      LYS 101 -41.757  -2.486 -13.194

  No H/Q in entry =          13
  In of MODEL   37
    1    H    LYS 102           H        LYS 102 -38.983   1.163  -7.400
    2    HA   LYS 102           HA       LYS 102 -41.273   2.312  -6.239
    3    HB2  LYS 102           HB2      LYS 102 -40.021   0.465  -5.208
    4    HB3  LYS 102           HB3      LYS 102 -38.654   1.544  -4.935
    5    HG2  LYS 102           HG2      LYS 102 -40.024   2.909  -3.458
    6    HG3  LYS 102           HG3      LYS 102 -41.394   1.833  -3.733
    7    HD2  LYS 102           HD2      LYS 102 -40.152  -0.014  -2.691
    8    HD3  LYS 102           HD3      LYS 102 -38.783   1.064  -2.414
    9    HE2  LYS 102           HE2      LYS 102 -40.189   2.510  -1.025
   10    HE3  LYS 102           HE3      LYS 102 -41.577   1.464  -1.323
   11    HZ1  LYS 102           HZ1      LYS 102 -39.843  -0.263  -0.295
   12    HZ3  LYS 102           HZ2      LYS 102 -40.987   0.598   0.618
   13    HZ2  LYS 102           HZ3      LYS 102 -39.383   1.153   0.523

  No H/Q in entry =          13
  In of MODEL   37
    1    H    ALA 103           H        ALA 103 -38.327   3.762  -7.192
    2    HA   ALA 103           HA       ALA 103 -38.624   6.064  -5.405
    3    HB2  ALA 103           HB1      ALA 103 -36.619   6.841  -6.942
    4    HB3  ALA 103           HB2      ALA 103 -36.544   5.126  -7.346
    5    HB1  ALA 103           HB3      ALA 103 -36.358   5.647  -5.671

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA 104           H        ALA 104 -39.170   5.336  -8.765
    2    HA   ALA 104           HA       ALA 104 -39.796   8.112  -9.388
    3    HB2  ALA 104           HB1      ALA 104 -39.785   7.452 -11.593
    4    HB1  ALA 104           HB2      ALA 104 -40.490   5.875 -11.235
    5    HB3  ALA 104           HB3      ALA 104 -38.779   6.169 -10.923

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA 105           H        ALA 105 -41.398   5.971  -7.621
    2    HA   ALA 105           HA       ALA 105 -43.848   7.319  -7.634
    3    HB2  ALA 105           HB1      ALA 105 -44.538   6.454  -9.690
    4    HB3  ALA 105           HB2      ALA 105 -45.174   5.249  -8.570
    5    HB1  ALA 105           HB3      ALA 105 -43.681   4.932  -9.452

  No H/Q in entry =           5
  In of MODEL   38
    1    H1   ALA   1           H3       ALA   1 -12.212 -15.854  -2.260
    2    H2   ALA   1           H2       ALA   1 -11.272 -16.989  -3.111
    3    H3   ALA   1           H1       ALA   1 -12.429 -16.049  -3.932
    4    HA   ALA   1           HA       ALA   1 -13.816 -17.758  -3.683
    5    HB3  ALA   1           HB1      ALA   1 -12.406 -19.523  -3.237
    6    HB1  ALA   1           HB2      ALA   1 -13.149 -19.417  -1.640
    7    HB2  ALA   1           HB3      ALA   1 -11.580 -18.667  -1.934

  No H/Q in entry =           7
  In of MODEL   38
    1    H    GLU   2           H        GLU   2 -15.419 -18.623  -2.015
    2    HA   GLU   2           HA       GLU   2 -17.067 -16.914  -0.938
    3    HB2  GLU   2           HB2      GLU   2 -16.100 -19.337   0.594
    4    HB3  GLU   2           HB3      GLU   2 -17.626 -18.495   0.863
    5    HG2  GLU   2           HG2      GLU   2 -18.616 -19.584  -0.864
    6    HG3  GLU   2           HG3      GLU   2 -17.305 -19.174  -1.960

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLU   3           H        GLU   3 -15.123 -18.261   1.665
    2    HA   GLU   3           HA       GLU   3 -15.343 -15.912   3.228
    3    HB2  GLU   3           HB2      GLU   3 -13.742 -18.451   3.460
    4    HB3  GLU   3           HB3      GLU   3 -13.507 -17.132   4.607
    5    HG2  GLU   3           HG2      GLU   3 -15.692 -17.296   5.445
    6    HG3  GLU   3           HG3      GLU   3 -16.296 -18.097   4.000

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LEU   4           H        LEU   4 -12.393 -17.373   1.808
    2    HA   LEU   4           HA       LEU   4 -10.564 -15.461   2.393
    3    HB2  LEU   4           HB2      LEU   4 -10.812 -16.755  -0.332
    4    HB3  LEU   4           HB3      LEU   4  -9.358 -16.028   0.341
    5    HG   LEU   4           HG       LEU   4 -10.829 -18.435   1.463
    6   HD13  LEU   4          HD11      LEU   4  -9.198 -19.781   0.516
    7   HD12  LEU   4          HD12      LEU   4  -7.995 -18.491   0.481
    8   HD11  LEU   4          HD13      LEU   4  -9.295 -18.518  -0.710
    9   HD23  LEU   4          HD21      LEU   4  -8.565 -18.489   2.824
   10   HD22  LEU   4          HD22      LEU   4  -9.887 -17.457   3.367
   11   HD21  LEU   4          HD23      LEU   4  -8.536 -16.760   2.473

  No H/Q in entry =          11
  In of MODEL   38
    1    H    GLU   5           H        GLU   5 -12.923 -15.261  -0.260
    2    HA   GLU   5           HA       GLU   5 -11.942 -12.771  -1.265
    3    HB2  GLU   5           HB2      GLU   5 -13.296 -14.369  -2.612
    4    HB3  GLU   5           HB3      GLU   5 -14.689 -13.999  -1.595
    5    HG2  GLU   5           HG2      GLU   5 -14.556 -11.632  -2.248
    6    HG3  GLU   5           HG3      GLU   5 -13.142 -11.978  -3.243

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLU   6           H        GLU   6 -14.643 -13.667   0.850
    2    HA   GLU   6           HA       GLU   6 -15.558 -10.995   1.262
    3    HB2  GLU   6           HB2      GLU   6 -16.965 -13.004   1.670
    4    HB3  GLU   6           HB3      GLU   6 -15.924 -13.431   3.026
    5    HG2  GLU   6           HG2      GLU   6 -17.824 -12.249   3.924
    6    HG3  GLU   6           HG3      GLU   6 -16.436 -11.167   4.021

  No H/Q in entry =           6
  In of MODEL   38
    1    H    VAL   7           H        VAL   7 -13.226 -13.097   2.809
    2    HA   VAL   7           HA       VAL   7 -12.747 -11.524   5.135
    3    HB   VAL   7           HB       VAL   7 -11.046 -13.556   3.667
    4   HG11  VAL   7          HG11      VAL   7 -10.563 -12.025   6.229
    5   HG13  VAL   7          HG12      VAL   7  -9.474 -12.232   4.858
    6   HG12  VAL   7          HG13      VAL   7  -9.810 -13.592   5.929
    7   HG21  VAL   7          HG21      VAL   7 -13.283 -14.134   4.906
    8   HG23  VAL   7          HG22      VAL   7 -12.344 -13.858   6.373
    9   HG22  VAL   7          HG23      VAL   7 -11.855 -15.113   5.237

  No H/Q in entry =           9
  In of MODEL   38
    1    H    VAL   8           H        VAL   8 -11.263 -11.625   1.911
    2    HA   VAL   8           HA       VAL   8  -9.206  -9.743   2.389
    3    HB   VAL   8           HB       VAL   8 -10.688 -10.436  -0.158
    4   HG12  VAL   8          HG11      VAL   8  -8.498  -9.425  -1.154
    5   HG11  VAL   8          HG12      VAL   8  -8.358  -8.605   0.402
    6   HG13  VAL   8          HG13      VAL   8  -9.768  -8.323  -0.618
    7   HG22  VAL   8          HG21      VAL   8  -9.157 -12.140  -0.430
    8   HG21  VAL   8          HG22      VAL   8  -8.983 -12.005   1.317
    9   HG23  VAL   8          HG23      VAL   8  -7.835 -11.193   0.256

  No H/Q in entry =           9
  In of MODEL   38
    1    H    MET   9           H        MET   9 -12.563  -9.368   1.259
    2    HA   MET   9           HA       MET   9 -12.518  -6.590   0.829
    3    HB2  MET   9           HB2      MET   9 -14.706  -8.492   1.654
    4    HB3  MET   9           HB3      MET   9 -15.009  -6.762   1.486
    5    HG2  MET   9           HG2      MET   9 -14.256  -6.816  -0.834
    6    HG3  MET   9           HG3      MET   9 -13.831  -8.521  -0.683
    7    HE1  MET   9           HE1      MET   9 -16.377  -5.854  -0.352
    8    HE3  MET   9           HE2      MET   9 -17.193  -6.790   0.897
    9    HE2  MET   9           HE3      MET   9 -17.960  -6.575  -0.674

  No H/Q in entry =           9
  In of MODEL   38
    1    H    GLY  10           H        GLY  10 -13.145  -8.490   3.759
    2    HA3  GLY  10           HA2      GLY  10 -13.689  -6.311   5.486
    3    HA2  GLY  10           HA3      GLY  10 -13.112  -7.897   5.992

  No H/Q in entry =           3
  In of MODEL   38
    1    H    LEU  11           H        LEU  11 -10.678  -8.006   4.656
    2    HA   LEU  11           HA       LEU  11  -8.969  -6.567   6.400
    3    HB2  LEU  11           HB2      LEU  11  -8.438  -7.983   3.786
    4    HB3  LEU  11           HB3      LEU  11  -7.163  -7.273   4.774
    5    HG   LEU  11           HG       LEU  11  -9.145  -9.319   5.805
    6   HD13  LEU  11          HD11      LEU  11  -7.930 -10.546   4.227
    7   HD12  LEU  11          HD12      LEU  11  -6.981 -10.782   5.694
    8   HD11  LEU  11          HD13      LEU  11  -6.457  -9.612   4.484
    9   HD22  LEU  11          HD21      LEU  11  -8.281  -8.304   7.715
   10   HD21  LEU  11          HD22      LEU  11  -6.752  -7.893   6.940
   11   HD23  LEU  11          HD23      LEU  11  -7.064  -9.552   7.449

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  12           H        ILE  12  -9.904  -6.019   3.019
    2    HA   ILE  12           HA       ILE  12  -8.229  -3.779   2.581
    3    HB   ILE  12           HB       ILE  12 -10.891  -4.462   1.308
    4   HG12  ILE  12          HG12      ILE  12  -8.847  -6.103   1.213
    5   HG13  ILE  12          HG13      ILE  12  -9.722  -5.749  -0.261
    6   HG22  ILE  12          HG21      ILE  12  -9.997  -3.063  -0.587
    7   HG21  ILE  12          HG22      ILE  12  -8.684  -2.548   0.466
    8   HG23  ILE  12          HG23      ILE  12 -10.335  -2.164   0.861
    9   HD11  ILE  12          HD11      ILE  12  -7.207  -4.309   0.622
   10   HD13  ILE  12          HD12      ILE  12  -8.015  -4.180  -0.939
   11   HD12  ILE  12          HD13      ILE  12  -7.219  -5.669  -0.485

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  13           H        ILE  13 -11.579  -4.068   3.704
    2    HA   ILE  13           HA       ILE  13 -12.053  -1.284   3.982
    3    HB   ILE  13           HB       ILE  13 -13.230  -3.711   5.356
    4   HG12  ILE  13          HG12      ILE  13 -13.478  -3.190   2.820
    5   HG13  ILE  13          HG13      ILE  13 -14.899  -3.638   3.738
    6   HG23  ILE  13          HG21      ILE  13 -13.617  -1.902   6.879
    7   HG22  ILE  13          HG22      ILE  13 -15.121  -2.123   5.995
    8   HG21  ILE  13          HG23      ILE  13 -14.041  -0.796   5.575
    9   HD12  ILE  13          HD11      ILE  13 -14.900  -1.487   2.151
   10   HD11  ILE  13          HD12      ILE  13 -14.216  -0.757   3.590
   11   HD13  ILE  13          HD13      ILE  13 -15.790  -1.515   3.677

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ASN  14           H        ASN  14 -10.907  -3.771   6.243
    2    HA   ASN  14           HA       ASN  14 -10.696  -2.135   8.529
    3    HB2  ASN  14           HB2      ASN  14 -10.429  -4.740   8.201
    4    HB3  ASN  14           HB3      ASN  14  -8.725  -4.342   8.030
    5   HD21  ASN  14          HD21      ASN  14  -9.332  -5.874  10.209
    6   HD22  ASN  14          HD22      ASN  14  -9.298  -4.955  11.634

  No H/Q in entry =           6
  In of MODEL   38
    1    H    SER  15           H        SER  15  -8.311  -2.939   6.016
    2    HA   SER  15           HA       SER  15  -6.168  -1.433   7.071
    3    HB2  SER  15           HB2      SER  15  -5.168  -1.633   4.899
    4    HB3  SER  15           HB3      SER  15  -6.101  -3.105   5.138
    5    HG   SER  15           HG       SER  15  -6.620  -0.889   3.506

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLY  16           H        GLY  16  -8.795  -0.581   4.848
    2    HA3  GLY  16           HA2      GLY  16  -7.960   2.067   4.293
    3    HA2  GLY  16           HA3      GLY  16  -9.608   1.460   4.145

  No H/Q in entry =           3
  In of MODEL   38
    1    H    GLN  17           H        GLN  17 -10.123   0.727   6.798
    2    HA   GLN  17           HA       GLN  17 -10.839   3.225   7.948
    3    HB2  GLN  17           HB2      GLN  17 -12.044   1.118   8.436
    4    HB3  GLN  17           HB3      GLN  17 -10.628   0.523   9.304
    5    HG2  GLN  17           HG2      GLN  17 -12.219   1.461  10.901
    6    HG3  GLN  17           HG3      GLN  17 -10.785   2.484  10.833
    7   HE21  GLN  17          HE21      GLN  17 -11.780   4.507  11.324
    8   HE22  GLN  17          HE22      GLN  17 -12.967   5.214  10.338

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ALA  18           H        ALA  18  -8.188   0.963   8.542
    2    HA   ALA  18           HA       ALA  18  -7.080   2.184  10.805
    3    HB2  ALA  18           HB1      ALA  18  -6.465  -0.025   9.429
    4    HB3  ALA  18           HB2      ALA  18  -5.299   0.765  10.491
    5    HB1  ALA  18           HB3      ALA  18  -5.239   1.047   8.750

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ARG  19           H        ARG  19  -6.342   2.718   7.350
    2    HA   ARG  19           HA       ARG  19  -4.457   4.780   7.766
    3    HB2  ARG  19           HB2      ARG  19  -4.794   3.640   5.572
    4    HB3  ARG  19           HB3      ARG  19  -6.345   4.468   5.409
    5    HG2  ARG  19           HG2      ARG  19  -5.233   6.649   5.471
    6    HG3  ARG  19           HG3      ARG  19  -3.675   5.876   5.761
    7    HD2  ARG  19           HD2      ARG  19  -3.825   6.468   3.420
    8    HD3  ARG  19           HD3      ARG  19  -3.894   4.708   3.563
    9    HE   ARG  19           HE       ARG  19  -6.536   5.595   3.580
   10   HH21  ARG  19          HH11      ARG  19  -7.748   5.744   1.672
   11   HH22  ARG  19          HH12      ARG  19  -6.940   5.830   0.145
   12   HH11  ARG  19          HH21      ARG  19  -3.778   5.684   1.522
   13   HH12  ARG  19          HH22      ARG  19  -4.691   5.794   0.061

  No H/Q in entry =          13
  In of MODEL   38
    1    H    SER  20           H        SER  20  -7.961   4.867   7.196
    2    HA   SER  20           HA       SER  20  -8.342   7.620   7.154
    3    HB2  SER  20           HB2      SER  20 -10.211   6.259   6.631
    4    HB3  SER  20           HB3      SER  20 -10.084   5.371   8.147
    5    HG   SER  20           HG       SER  20 -10.768   8.107   7.801

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU  21           H        LEU  21  -8.300   5.433   9.955
    2    HA   LEU  21           HA       LEU  21  -8.741   7.423  11.926
    3    HB2  LEU  21           HB2      LEU  21  -7.368   4.731  12.069
    4    HB3  LEU  21           HB3      LEU  21  -7.665   5.745  13.478
    5    HG   LEU  21           HG       LEU  21  -9.860   4.857  11.585
    6   HD11  LEU  21          HD11      LEU  21  -8.953   3.617  14.199
    7   HD13  LEU  21          HD12      LEU  21  -8.839   2.878  12.602
    8   HD12  LEU  21          HD13      LEU  21 -10.421   3.174  13.326
    9   HD23  LEU  21          HD21      LEU  21 -11.167   5.305  13.832
   10   HD22  LEU  21          HD22      LEU  21 -10.720   6.680  12.828
   11   HD21  LEU  21          HD23      LEU  21  -9.765   6.286  14.249

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ALA  22           H        ALA  22  -5.789   6.078  10.492
    2    HA   ALA  22           HA       ALA  22  -3.907   7.406  12.100
    3    HB2  ALA  22           HB1      ALA  22  -3.489   5.558  10.403
    4    HB1  ALA  22           HB2      ALA  22  -2.304   6.865  10.430
    5    HB3  ALA  22           HB3      ALA  22  -3.532   6.812   9.164

  No H/Q in entry =           5
  In of MODEL   38
    1    H    TYR  23           H        TYR  23  -5.260   8.415   8.930
    2    HA   TYR  23           HA       TYR  23  -3.948  10.923   8.852
    3    HB2  TYR  23           HB2      TYR  23  -5.036  10.003   6.869
    4    HB3  TYR  23           HB3      TYR  23  -6.610  10.096   7.662
    5    HD1  TYR  23           HD1      TYR  23  -3.737  12.163   6.480
    6    HD2  TYR  23           HD2      TYR  23  -7.864  12.099   7.667
    7    HE1  TYR  23           HE1      TYR  23  -3.990  14.511   5.723
    8    HE2  TYR  23           HE2      TYR  23  -8.117  14.448   6.910
    9    HH   TYR  23           HH       TYR  23  -5.432  16.170   5.338

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ALA  24           H        ALA  24  -7.046   9.915  10.256
    2    HA   ALA  24           HA       ALA  24  -7.901  12.496  11.037
    3    HB1  ALA  24           HB1      ALA  24  -9.704  11.228  11.518
    4    HB2  ALA  24           HB2      ALA  24  -8.861  10.662  12.958
    5    HB3  ALA  24           HB3      ALA  24  -8.739   9.754  11.452

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA  25           H        ALA  25  -5.863  10.055  12.592
    2    HA   ALA  25           HA       ALA  25  -5.517  11.307  15.092
    3    HB2  ALA  25           HB1      ALA  25  -4.735   8.964  14.262
    4    HB3  ALA  25           HB2      ALA  25  -3.718   9.830  15.416
    5    HB1  ALA  25           HB3      ALA  25  -3.296   9.819  13.703

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU  26           H        LEU  26  -3.754  11.627  12.038
    2    HA   LEU  26           HA       LEU  26  -1.804  13.463  12.941
    3    HB2  LEU  26           HB2      LEU  26  -1.509  12.317  10.833
    4    HB3  LEU  26           HB3      LEU  26  -2.994  13.012  10.191
    5    HG   LEU  26           HG       LEU  26  -1.999  15.272  10.321
    6   HD12  LEU  26          HD11      LEU  26   0.542  15.314  10.715
    7   HD11  LEU  26          HD12      LEU  26   0.339  13.731  11.459
    8   HD13  LEU  26          HD13      LEU  26  -0.476  15.137  12.143
    9   HD21  LEU  26          HD21      LEU  26  -0.249  13.235   8.910
   10   HD23  LEU  26          HD22      LEU  26  -0.311  14.956   8.542
   11   HD22  LEU  26          HD23      LEU  26  -1.727  13.946   8.264

  No H/Q in entry =          11
  In of MODEL   38
    1    H    LYS  27           H        LYS  27  -5.002  13.919  11.490
    2    HA   LYS  27           HA       LYS  27  -4.974  16.708  11.295
    3    HB2  LYS  27           HB2      LYS  27  -6.712  15.217  10.321
    4    HB3  LYS  27           HB3      LYS  27  -7.354  14.952  11.942
    5    HG2  LYS  27           HG2      LYS  27  -7.803  17.354  12.185
    6    HG3  LYS  27           HG3      LYS  27  -7.110  17.660  10.589
    7    HD2  LYS  27           HD2      LYS  27  -8.838  16.211   9.565
    8    HD3  LYS  27           HD3      LYS  27  -9.537  15.923  11.160
    9    HE2  LYS  27           HE2      LYS  27  -9.999  18.330  11.410
   10    HE3  LYS  27           HE3      LYS  27  -9.272  18.640   9.830
   11    HZ3  LYS  27           HZ1      LYS  27 -11.650  18.495   9.607
   12    HZ2  LYS  27           HZ2      LYS  27 -11.679  16.977  10.375
   13    HZ1  LYS  27           HZ3      LYS  27 -10.948  17.149   8.848

  No H/Q in entry =          13
  In of MODEL   38
    1    H    GLN  28           H        GLN  28  -5.822  14.611  14.026
    2    HA   GLN  28           HA       GLN  28  -6.720  16.605  15.812
    3    HB2  GLN  28           HB2      GLN  28  -5.307  13.975  16.321
    4    HB3  GLN  28           HB3      GLN  28  -6.004  14.978  17.594
    5    HG2  GLN  28           HG2      GLN  28  -7.552  13.901  15.221
    6    HG3  GLN  28           HG3      GLN  28  -7.548  13.168  16.824
    7   HE21  GLN  28          HE21      GLN  28  -7.712  15.413  18.494
    8   HE22  GLN  28          HE22      GLN  28  -9.165  16.239  18.197

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ALA  29           H        ALA  29  -3.496  15.336  15.095
    2    HA   ALA  29           HA       ALA  29  -2.053  16.742  17.063
    3    HB1  ALA  29           HB1      ALA  29  -0.126  16.068  15.927
    4    HB3  ALA  29           HB2      ALA  29  -0.895  16.188  14.345
    5    HB2  ALA  29           HB3      ALA  29  -1.298  14.851  15.421

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LYS  30           H        LYS  30  -2.945  17.620  13.742
    2    HA   LYS  30           HA       LYS  30  -1.552  20.069  13.633
    3    HB2  LYS  30           HB2      LYS  30  -4.088  19.181  12.244
    4    HB3  LYS  30           HB3      LYS  30  -3.267  20.701  11.896
    5    HG2  LYS  30           HG2      LYS  30  -1.194  19.422  11.363
    6    HG3  LYS  30           HG3      LYS  30  -2.089  17.920  11.613
    7    HD2  LYS  30           HD2      LYS  30  -3.672  18.553   9.833
    8    HD3  LYS  30           HD3      LYS  30  -2.800  20.067   9.585
    9    HE2  LYS  30           HE2      LYS  30  -0.765  18.787   8.986
   10    HE3  LYS  30           HE3      LYS  30  -1.656  17.278   9.204
   11    HZ2  LYS  30           HZ1      LYS  30  -1.505  18.153   6.861
   12    HZ1  LYS  30           HZ2      LYS  30  -2.551  19.409   7.340
   13    HZ3  LYS  30           HZ3      LYS  30  -3.066  17.789   7.414

  No H/Q in entry =          13
  In of MODEL   38
    1    H    GLN  31           H        GLN  31  -4.635  19.198  15.070
    2    HA   GLN  31           HA       GLN  31  -5.409  21.950  15.533
    3    HB2  GLN  31           HB2      GLN  31  -6.564  19.496  16.862
    4    HB3  GLN  31           HB3      GLN  31  -7.334  21.064  16.625
    5    HG2  GLN  31           HG2      GLN  31  -6.642  20.294  14.028
    6    HG3  GLN  31           HG3      GLN  31  -7.153  18.786  14.777
    7   HE21  GLN  31          HE21      GLN  31  -8.589  20.356  12.690
    8   HE22  GLN  31          HE22      GLN  31 -10.099  20.739  13.362

  No H/Q in entry =           8
  In of MODEL   38
    1    H    GLY  32           H        GLY  32  -3.076  20.032  16.830
    2    HA3  GLY  32           HA2      GLY  32  -1.662  20.497  18.621
    3    HA2  GLY  32           HA3      GLY  32  -2.793  21.734  19.156

  No H/Q in entry =           3
  In of MODEL   38
    1    H    ASP  33           H        ASP  33  -4.207  18.689  18.502
    2    HA   ASP  33           HA       ASP  33  -4.590  18.225  21.384
    3    HB2  ASP  33           HB2      ASP  33  -6.014  17.211  18.917
    4    HB3  ASP  33           HB3      ASP  33  -6.342  16.597  20.535

  No H/Q in entry =           4
  In of MODEL   38
    1    H    PHE  34           H        PHE  34  -2.416  17.383  21.669
    2    HA   PHE  34           HA       PHE  34  -1.418  15.141  20.256
    3    HB2  PHE  34           HB2      PHE  34  -0.781  16.123  23.047
    4    HB3  PHE  34           HB3      PHE  34   0.146  14.906  22.169
    5    HD1  PHE  34           HD1      PHE  34  -0.035  18.330  22.912
    6    HD2  PHE  34           HD2      PHE  34   0.779  15.636  19.665
    7    HE1  PHE  34           HE1      PHE  34   1.242  20.109  21.750
    8    HE2  PHE  34           HE2      PHE  34   2.051  17.418  18.508
    9    HZ   PHE  34           HZ       PHE  34   2.285  19.651  19.555

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ALA  35           H        ALA  35  -3.434  15.404  23.137
    2    HA   ALA  35           HA       ALA  35  -3.202  12.742  24.027
    3    HB3  ALA  35           HB1      ALA  35  -5.655  13.355  24.907
    4    HB1  ALA  35           HB2      ALA  35  -5.133  14.977  24.449
    5    HB2  ALA  35           HB3      ALA  35  -4.204  14.055  25.631

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA  36           H        ALA  36  -5.677  14.252  21.951
    2    HA   ALA  36           HA       ALA  36  -7.086  11.835  21.482
    3    HB1  ALA  36           HB1      ALA  36  -8.556  13.253  20.541
    4    HB3  ALA  36           HB2      ALA  36  -7.397  13.680  19.282
    5    HB2  ALA  36           HB3      ALA  36  -7.412  14.565  20.808

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA  37           H        ALA  37  -4.427  13.437  19.792
    2    HA   ALA  37           HA       ALA  37  -4.405  11.806  17.492
    3    HB3  ALA  37           HB1      ALA  37  -2.408  13.523  18.901
    4    HB2  ALA  37           HB2      ALA  37  -2.953  13.580  17.225
    5    HB1  ALA  37           HB3      ALA  37  -1.790  12.354  17.734

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LYS  38           H        LYS  38  -2.620  11.501  20.554
    2    HA   LYS  38           HA       LYS  38  -1.288   9.108  20.049
    3    HB2  LYS  38           HB2      LYS  38  -1.600  10.865  22.200
    4    HB3  LYS  38           HB3      LYS  38  -2.207   9.332  22.819
    5    HG2  LYS  38           HG2      LYS  38  -0.113   8.222  22.262
    6    HG3  LYS  38           HG3      LYS  38   0.482   9.671  21.446
    7    HD2  LYS  38           HD2      LYS  38   0.664  10.886  23.482
    8    HD3  LYS  38           HD3      LYS  38  -0.343   9.730  24.356
    9    HE2  LYS  38           HE2      LYS  38   2.019   9.423  24.954
   10    HE3  LYS  38           HE3      LYS  38   1.414   8.006  24.092
   11    HZ3  LYS  38           HZ1      LYS  38   2.696   8.434  22.300
   12    HZ2  LYS  38           HZ2      LYS  38   3.658   9.264  23.430
   13    HZ1  LYS  38           HZ3      LYS  38   2.566  10.121  22.450

  No H/Q in entry =          13
  In of MODEL   38
    1    H    ALA  39           H        ALA  39  -4.517   9.586  21.481
    2    HA   ALA  39           HA       ALA  39  -5.061   6.864  21.985
    3    HB3  ALA  39           HB1      ALA  39  -7.235   8.800  21.240
    4    HB2  ALA  39           HB2      ALA  39  -6.325   9.028  22.734
    5    HB1  ALA  39           HB3      ALA  39  -7.237   7.541  22.476

  No H/Q in entry =           5
  In of MODEL   38
    1    H    MET  40           H        MET  40  -5.680   8.880  19.147
    2    HA   MET  40           HA       MET  40  -7.160   6.944  17.696
    3    HB2  MET  40           HB2      MET  40  -5.569   9.348  16.782
    4    HB3  MET  40           HB3      MET  40  -6.600   8.386  15.719
    5    HG2  MET  40           HG2      MET  40  -7.617   9.626  18.288
    6    HG3  MET  40           HG3      MET  40  -7.692  10.463  16.740
    7    HE3  MET  40           HE1      MET  40 -10.286   8.836  14.695
    8    HE2  MET  40           HE2      MET  40  -8.535   8.961  14.532
    9    HE1  MET  40           HE3      MET  40  -9.454  10.321  15.176

  No H/Q in entry =           9
  In of MODEL   38
    1    H    MET  41           H        MET  41  -3.671   7.697  17.790
    2    HA   MET  41           HA       MET  41  -2.923   5.950  15.679
    3    HB2  MET  41           HB2      MET  41  -1.288   6.620  18.139
    4    HB3  MET  41           HB3      MET  41  -0.681   5.978  16.617
    5    HG2  MET  41           HG2      MET  41  -1.856   8.157  15.628
    6    HG3  MET  41           HG3      MET  41  -1.609   8.743  17.271
    7    HE2  MET  41           HE1      MET  41   1.322   6.658  17.603
    8    HE1  MET  41           HE2      MET  41   0.535   7.946  18.511
    9    HE3  MET  41           HE3      MET  41   2.152   8.199  17.854

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ASP  42           H        ASP  42  -3.275   5.468  19.168
    2    HA   ASP  42           HA       ASP  42  -2.225   2.879  19.314
    3    HB2  ASP  42           HB2      ASP  42  -3.092   4.631  21.147
    4    HB3  ASP  42           HB3      ASP  42  -4.514   3.599  21.085

  No H/Q in entry =           4
  In of MODEL   38
    1    H    GLN  43           H        GLN  43  -5.568   3.967  18.844
    2    HA   GLN  43           HA       GLN  43  -6.700   1.374  18.654
    3    HB2  GLN  43           HB2      GLN  43  -7.647   4.024  17.538
    4    HB3  GLN  43           HB3      GLN  43  -8.602   2.540  17.521
    5    HG2  GLN  43           HG2      GLN  43  -8.287   2.415  20.026
    6    HG3  GLN  43           HG3      GLN  43  -7.571   4.024  19.952
    7   HE21  GLN  43          HE21      GLN  43  -9.738   4.090  21.471
    8   HE22  GLN  43          HE22      GLN  43 -11.108   4.660  20.652

  No H/Q in entry =           8
  In of MODEL   38
    1    H    SER  44           H        SER  44  -5.392   3.600  16.235
    2    HA   SER  44           HA       SER  44  -6.105   2.117  13.949
    3    HB2  SER  44           HB2      SER  44  -4.857   4.506  14.387
    4    HB3  SER  44           HB3      SER  44  -3.503   3.518  13.843
    5    HG   SER  44           HG       SER  44  -4.635   4.488  12.092

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ARG  45           H        ARG  45  -3.209   2.015  16.005
    2    HA   ARG  45           HA       ARG  45  -1.731   0.071  14.606
    3    HB2  ARG  45           HB2      ARG  45  -0.881   1.493  16.470
    4    HB3  ARG  45           HB3      ARG  45  -1.858   0.555  17.597
    5    HG2  ARG  45           HG2      ARG  45  -0.621  -1.497  16.940
    6    HG3  ARG  45           HG3      ARG  45   0.380  -0.534  15.855
    7    HD2  ARG  45           HD2      ARG  45   1.124   0.847  17.807
    8    HD3  ARG  45           HD3      ARG  45   0.217  -0.235  18.886
    9    HE   ARG  45           HE       ARG  45   1.911  -1.819  17.288
   10   HH21  ARG  45          HH11      ARG  45   3.822  -2.634  18.108
   11   HH22  ARG  45          HH12      ARG  45   4.602  -1.846  19.434
   12   HH11  ARG  45          HH21      ARG  45   2.221   0.644  19.681
   13   HH12  ARG  45          HH22      ARG  45   3.695   0.012  20.322

  No H/Q in entry =          13
  In of MODEL   38
    1    H    MET  46           H        MET  46  -4.105  -0.267  17.225
    2    HA   MET  46           HA       MET  46  -3.921  -3.066  17.525
    3    HB2  MET  46           HB2      MET  46  -6.090  -1.069  18.151
    4    HB3  MET  46           HB3      MET  46  -6.294  -2.791  18.482
    5    HG2  MET  46           HG2      MET  46  -4.293  -2.792  19.885
    6    HG3  MET  46           HG3      MET  46  -3.991  -1.104  19.503
    7    HE1  MET  46           HE1      MET  46  -6.123  -3.728  20.952
    8    HE3  MET  46           HE2      MET  46  -7.596  -2.893  20.475
    9    HE2  MET  46           HE3      MET  46  -7.157  -2.987  22.178

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ALA  47           H        ALA  47  -5.968  -1.055  15.451
    2    HA   ALA  47           HA       ALA  47  -7.585  -3.111  14.395
    3    HB3  ALA  47           HB1      ALA  47  -8.278  -0.876  13.989
    4    HB1  ALA  47           HB2      ALA  47  -7.799  -1.503  12.412
    5    HB2  ALA  47           HB3      ALA  47  -6.717  -0.432  13.303

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU  48           H        LEU  48  -4.481  -1.786  13.321
    2    HA   LEU  48           HA       LEU  48  -4.212  -3.370  10.974
    3    HB2  LEU  48           HB2      LEU  48  -2.146  -2.087  12.768
    4    HB3  LEU  48           HB3      LEU  48  -1.787  -2.802  11.196
    5    HG   LEU  48           HG       LEU  48  -3.815  -0.594  11.608
    6   HD13  LEU  48          HD11      LEU  48  -1.692   0.289  12.258
    7   HD12  LEU  48          HD12      LEU  48  -1.983   0.846  10.610
    8   HD11  LEU  48          HD13      LEU  48  -0.877  -0.497  10.906
    9   HD22  LEU  48          HD21      LEU  48  -4.300  -1.576   9.534
   10   HD21  LEU  48          HD22      LEU  48  -2.618  -2.003   9.223
   11   HD23  LEU  48          HD23      LEU  48  -3.145  -0.326   9.072

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ASN  49           H        ASN  49  -3.138  -3.770  14.310
    2    HA   ASN  49           HA       ASN  49  -1.530  -6.027  13.962
    3    HB2  ASN  49           HB2      ASN  49  -1.545  -4.696  16.013
    4    HB3  ASN  49           HB3      ASN  49  -3.197  -5.188  16.349
    5   HD21  ASN  49          HD21      ASN  49  -1.198  -5.707  18.244
    6   HD22  ASN  49          HD22      ASN  49  -0.902  -7.376  18.309

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLU  50           H        GLU  50  -4.993  -5.765  14.662
    2    HA   GLU  50           HA       GLU  50  -5.496  -8.566  14.768
    3    HB2  GLU  50           HB2      GLU  50  -7.080  -6.886  15.661
    4    HB3  GLU  50           HB3      GLU  50  -7.389  -6.319  14.018
    5    HG2  GLU  50           HG2      GLU  50  -8.252  -8.516  13.382
    6    HG3  GLU  50           HG3      GLU  50  -7.856  -9.162  14.971

  No H/Q in entry =           6
  In of MODEL   38
    1    H    ALA  51           H        ALA  51  -5.592  -6.162  12.179
    2    HA   ALA  51           HA       ALA  51  -6.589  -7.888  10.161
    3    HB2  ALA  51           HB1      ALA  51  -6.385  -6.072   8.794
    4    HB1  ALA  51           HB2      ALA  51  -4.742  -5.719   9.330
    5    HB3  ALA  51           HB3      ALA  51  -6.120  -5.214  10.311

  No H/Q in entry =           5
  In of MODEL   38
    1    H    HIS  52           H        HIS  52  -3.293  -6.975  11.120
    2    HA   HIS  52           HA       HIS  52  -1.906  -8.456   9.156
    3    HB2  HIS  52           HB2      HIS  52  -0.829  -6.739  10.545
    4    HB3  HIS  52           HB3      HIS  52  -1.050  -7.749  11.974
    5    HD1  HIS  52           HD1      HIS  52   0.222 -10.125  11.920
    6    HD2  HIS  52           HD2      HIS  52   1.441  -7.355   9.052
    7    HE1  HIS  52           HE1      HIS  52   2.456 -10.935  11.044
    8    HE2  HIS  52           HE2      HIS  52   3.213  -9.258   9.294

  No H/Q in entry =           8
  In of MODEL   38
    1    H    LEU  53           H        LEU  53  -3.090  -9.344  12.376
    2    HA   LEU  53           HA       LEU  53  -1.886 -11.886  12.554
    3    HB2  LEU  53           HB2      LEU  53  -4.365 -10.714  13.790
    4    HB3  LEU  53           HB3      LEU  53  -3.896 -12.388  14.076
    5    HG   LEU  53           HG       LEU  53  -1.998 -10.066  14.536
    6   HD12  LEU  53          HD11      LEU  53  -2.590 -10.561  17.004
    7   HD11  LEU  53          HD12      LEU  53  -4.037 -11.334  16.361
    8   HD13  LEU  53          HD13      LEU  53  -3.748  -9.624  16.067
    9   HD23  LEU  53          HD21      LEU  53  -1.097 -11.865  16.213
   10   HD22  LEU  53          HD22      LEU  53  -0.724 -12.048  14.503
   11   HD21  LEU  53          HD23      LEU  53  -1.997 -13.012  15.228

  No H/Q in entry =          11
  In of MODEL   38
    1    H    VAL  54           H        VAL  54  -5.009 -10.859  11.219
    2    HA   VAL  54           HA       VAL  54  -5.925 -13.453  10.533
    3    HB   VAL  54           HB       VAL  54  -6.585 -10.718   9.410
    4   HG12  VAL  54          HG11      VAL  54  -8.691 -12.097   8.612
    5   HG11  VAL  54          HG12      VAL  54  -7.577 -13.462   8.672
    6   HG13  VAL  54          HG13      VAL  54  -7.227 -12.084   7.630
    7   HG22  VAL  54          HG21      VAL  54  -7.474 -10.763  11.569
    8   HG21  VAL  54          HG22      VAL  54  -7.726 -12.506  11.547
    9   HG23  VAL  54          HG23      VAL  54  -8.816 -11.449  10.652

  No H/Q in entry =           9
  In of MODEL   38
    1    H    GLN  55           H        GLN  55  -4.071 -10.994   8.735
    2    HA   GLN  55           HA       GLN  55  -3.958 -12.453   6.313
    3    HB2  GLN  55           HB2      GLN  55  -3.359 -10.187   6.123
    4    HB3  GLN  55           HB3      GLN  55  -2.237 -10.265   7.479
    5    HG2  GLN  55           HG2      GLN  55  -0.529 -11.106   6.187
    6    HG3  GLN  55           HG3      GLN  55  -1.609 -12.080   5.200
    7   HE21  GLN  55          HE21      GLN  55  -1.644 -11.385   3.080
    8   HE22  GLN  55          HE22      GLN  55  -1.452  -9.779   2.572

  No H/Q in entry =           8
  In of MODEL   38
    1    H    THR  56           H        THR  56  -1.829 -12.436   9.177
    2    HA   THR  56           HA       THR  56   0.243 -14.030   8.239
    3    HB   THR  56           HB       THR  56  -1.033 -14.063  10.988
    4    HG1  THR  56           HG1      THR  56   1.069 -12.790  11.235
    5   HG21  THR  56          HG21      THR  56   1.465 -15.297   9.863
    6   HG23  THR  56          HG22      THR  56   0.282 -15.995  10.971
    7   HG22  THR  56          HG23      THR  56   1.421 -14.778  11.547

  No H/Q in entry =           7
  In of MODEL   38
    1    H    LYS  57           H        LYS  57  -2.865 -15.073   9.624
    2    HA   LYS  57           HA       LYS  57  -2.418 -17.868   9.368
    3    HB2  LYS  57           HB2      LYS  57  -4.228 -16.775  10.729
    4    HB3  LYS  57           HB3      LYS  57  -5.034 -16.335   9.231
    5    HG2  LYS  57           HG2      LYS  57  -4.319 -19.199   9.530
    6    HG3  LYS  57           HG3      LYS  57  -5.592 -18.604  10.593
    7    HD2  LYS  57           HD2      LYS  57  -6.826 -17.740   8.626
    8    HD3  LYS  57           HD3      LYS  57  -5.562 -18.362   7.565
    9    HE2  LYS  57           HE2      LYS  57  -6.018 -20.662   8.382
   10    HE3  LYS  57           HE3      LYS  57  -7.301 -20.044   9.420
   11    HZ2  LYS  57           HZ1      LYS  57  -7.290 -20.496   6.572
   12    HZ1  LYS  57           HZ2      LYS  57  -7.953 -19.002   7.034
   13    HZ3  LYS  57           HZ3      LYS  57  -8.589 -20.447   7.664

  No H/Q in entry =          13
  In of MODEL   38
    1    H    LEU  58           H        LEU  58  -3.769 -15.421   7.209
    2    HA   LEU  58           HA       LEU  58  -4.586 -17.242   5.205
    3    HB2  LEU  58           HB2      LEU  58  -3.982 -14.293   5.071
    4    HB3  LEU  58           HB3      LEU  58  -4.656 -15.227   3.734
    5    HG   LEU  58           HG       LEU  58  -5.914 -15.055   6.493
    6   HD11  LEU  58          HD11      LEU  58  -6.235 -13.402   4.007
    7   HD13  LEU  58          HD12      LEU  58  -6.212 -12.899   5.697
    8   HD12  LEU  58          HD13      LEU  58  -7.639 -13.692   5.035
    9   HD22  LEU  58          HD21      LEU  58  -6.882 -16.963   5.626
   10   HD21  LEU  58          HD22      LEU  58  -6.556 -16.507   3.954
   11   HD23  LEU  58          HD23      LEU  58  -7.913 -15.784   4.817

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  59           H        ILE  59  -1.444 -16.031   6.044
    2    HA   ILE  59           HA       ILE  59  -0.367 -16.752   3.397
    3    HB   ILE  59           HB       ILE  59   0.413 -14.690   4.967
    4   HG12  ILE  59          HG12      ILE  59   2.495 -16.331   3.511
    5   HG13  ILE  59          HG13      ILE  59   1.287 -15.394   2.668
    6   HG22  ILE  59          HG21      ILE  59   2.503 -16.743   5.640
    7   HG21  ILE  59          HG22      ILE  59   1.161 -16.465   6.726
    8   HG23  ILE  59          HG23      ILE  59   2.278 -15.157   6.337
    9   HD13  ILE  59          HD11      ILE  59   2.038 -13.346   3.786
   10   HD12  ILE  59          HD12      ILE  59   3.385 -14.114   2.948
   11   HD11  ILE  59          HD13      ILE  59   3.225 -14.276   4.697

  No H/Q in entry =          11
  In of MODEL   38
    1    H    GLU  60           H        GLU  60  -0.350 -17.866   6.762
    2    HA   GLU  60           HA       GLU  60   1.679 -19.842   6.478
    3    HB2  GLU  60           HB2      GLU  60   1.016 -19.136   8.684
    4    HB3  GLU  60           HB3      GLU  60  -0.654 -19.614   8.391
    5    HG2  GLU  60           HG2      GLU  60   1.550 -21.651   8.161
    6    HG3  GLU  60           HG3      GLU  60   0.907 -21.221   9.745

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLY  61           H        GLY  61  -1.835 -19.941   6.018
    2    HA3  GLY  61           HA2      GLY  61  -1.592 -22.731   5.052
    3    HA2  GLY  61           HA3      GLY  61  -3.074 -21.998   5.658

  No H/Q in entry =           3
  In of MODEL   38
    1    H    ASP  62           H        ASP  62  -0.862 -20.412   3.442
    2    HA   ASP  62           HA       ASP  62  -2.663 -19.415   1.673
    3    HB2  ASP  62           HB2      ASP  62  -0.829 -19.385   0.024
    4    HB3  ASP  62           HB3      ASP  62  -0.275 -18.895   1.621

  No H/Q in entry =           4
  In of MODEL   38
    1    H    ALA  63           H        ALA  63  -4.382 -20.532   0.827
    2    HA   ALA  63           HA       ALA  63  -4.316 -23.276   0.057
    3    HB2  ALA  63           HB1      ALA  63  -6.214 -21.038  -0.626
    4    HB3  ALA  63           HB2      ALA  63  -6.422 -22.303   0.584
    5    HB1  ALA  63           HB3      ALA  63  -6.459 -22.712  -1.132

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLY  64           H        GLY  64  -5.452 -21.053  -2.344
    2    HA3  GLY  64           HA2      GLY  64  -4.259 -20.328  -4.320
    3    HA2  GLY  64           HA3      GLY  64  -3.203 -21.718  -4.135

  No H/Q in entry =           3
  In of MODEL   38
    1    H    GLU  65           H        GLU  65  -4.329 -21.233  -6.591
    2    HA   GLU  65           HA       GLU  65  -6.736 -22.860  -6.805
    3    HB2  GLU  65           HB2      GLU  65  -5.165 -21.277  -8.836
    4    HB3  GLU  65           HB3      GLU  65  -6.583 -22.247  -9.238
    5    HG2  GLU  65           HG2      GLU  65  -7.945 -20.956  -7.661
    6    HG3  GLU  65           HG3      GLU  65  -6.534 -20.012  -7.190

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLY  66           H        GLY  66  -3.577 -23.514  -6.631
    2    HA3  GLY  66           HA2      GLY  66  -3.845 -26.180  -7.666
    3    HA2  GLY  66           HA3      GLY  66  -2.733 -25.190  -8.591

  No H/Q in entry =           3
  In of MODEL   38
    1    H    LYS  67           H        LYS  67  -1.716 -27.384  -7.581
    2    HA   LYS  67           HA       LYS  67  -0.836 -27.901  -5.173
    3    HB2  LYS  67           HB2      LYS  67   1.484 -28.359  -6.201
    4    HB3  LYS  67           HB3      LYS  67   0.081 -29.178  -6.898
    5    HG2  LYS  67           HG2      LYS  67   0.561 -26.513  -8.035
    6    HG3  LYS  67           HG3      LYS  67   1.882 -27.642  -8.323
    7    HD2  LYS  67           HD2      LYS  67   0.290 -29.274  -9.263
    8    HD3  LYS  67           HD3      LYS  67  -1.036 -28.145  -8.974
    9    HE2  LYS  67           HE2      LYS  67  -0.316 -27.950 -11.299
   10    HE3  LYS  67           HE3      LYS  67   0.112 -26.477 -10.430
   11    HZ1  LYS  67           HZ1      LYS  67   2.259 -28.122 -10.077
   12    HZ3  LYS  67           HZ2      LYS  67   2.163 -26.821 -11.164
   13    HZ2  LYS  67           HZ3      LYS  67   1.810 -28.399 -11.688

  No H/Q in entry =          13
  In of MODEL   38
    1    H    MET  68           H        MET  68   1.747 -26.269  -6.749
    2    HA   MET  68           HA       MET  68   2.765 -25.047  -4.430
    3    HB2  MET  68           HB2      MET  68   3.335 -24.501  -7.346
    4    HB3  MET  68           HB3      MET  68   4.312 -23.917  -5.999
    5    HG2  MET  68           HG2      MET  68   3.720 -26.836  -6.568
    6    HG3  MET  68           HG3      MET  68   5.225 -26.013  -6.985
    7    HE1  MET  68           HE1      MET  68   6.520 -24.746  -5.611
    8    HE3  MET  68           HE2      MET  68   7.106 -25.300  -4.044
    9    HE2  MET  68           HE3      MET  68   5.802 -24.118  -4.122

  No H/Q in entry =           9
  In of MODEL   38
    1    H    LYS  69           H        LYS  69   0.804 -23.685  -7.066
    2    HA   LYS  69           HA       LYS  69   1.071 -21.002  -6.546
    3    HB2  LYS  69           HB2      LYS  69  -0.114 -21.906  -8.483
    4    HB3  LYS  69           HB3      LYS  69  -1.474 -22.336  -7.439
    5    HG2  LYS  69           HG2      LYS  69  -1.765 -20.000  -6.791
    6    HG3  LYS  69           HG3      LYS  69  -0.356 -19.536  -7.745
    7    HD2  LYS  69           HD2      LYS  69  -1.490 -20.317  -9.797
    8    HD3  LYS  69           HD3      LYS  69  -2.905 -20.756  -8.838
    9    HE2  LYS  69           HE2      LYS  69  -3.153 -18.410  -8.118
   10    HE3  LYS  69           HE3      LYS  69  -1.737 -17.967  -9.069
   11    HZ2  LYS  69           HZ1      LYS  69  -4.350 -18.955 -10.045
   12    HZ1  LYS  69           HZ2      LYS  69  -2.964 -18.929 -11.025
   13    HZ3  LYS  69           HZ3      LYS  69  -3.591 -17.481 -10.399

  No H/Q in entry =          13
  In of MODEL   38
    1    H    VAL  70           H        VAL  70  -0.072 -19.393  -5.455
    2    HA   VAL  70           HA       VAL  70  -1.537 -20.311  -3.042
    3    HB   VAL  70           HB       VAL  70  -0.730 -18.200  -1.992
    4   HG12  VAL  70          HG11      VAL  70   1.484 -19.919  -3.151
    5   HG11  VAL  70          HG12      VAL  70   0.526 -20.321  -1.725
    6   HG13  VAL  70          HG13      VAL  70   1.598 -18.920  -1.701
    7   HG23  VAL  70          HG21      VAL  70   1.182 -17.010  -3.199
    8   HG22  VAL  70          HG22      VAL  70  -0.413 -16.772  -3.909
    9   HG21  VAL  70          HG23      VAL  70   0.718 -17.902  -4.650

  No H/Q in entry =           9
  In of MODEL   38
    1    H    SER  71           H        SER  71  -3.033 -18.606  -2.186
    2    HA   SER  71           HA       SER  71  -5.025 -17.923  -4.061
    3    HB2  SER  71           HB2      SER  71  -5.383 -18.173  -1.575
    4    HB3  SER  71           HB3      SER  71  -4.551 -16.639  -1.348
    5    HG   SER  71           HG       SER  71  -6.955 -17.146  -2.766

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU  72           H        LEU  72  -5.206 -16.280  -5.411
    2    HA   LEU  72           HA       LEU  72  -3.105 -14.463  -5.906
    3    HB2  LEU  72           HB2      LEU  72  -5.977 -14.525  -6.827
    4    HB3  LEU  72           HB3      LEU  72  -4.793 -13.357  -7.406
    5    HG   LEU  72           HG       LEU  72  -4.352 -16.355  -7.554
    6   HD12  LEU  72          HD11      LEU  72  -4.908 -16.022 -10.007
    7   HD11  LEU  72          HD12      LEU  72  -5.549 -14.438  -9.569
    8   HD13  LEU  72          HD13      LEU  72  -6.284 -15.899  -8.910
    9   HD23  LEU  72          HD21      LEU  72  -2.840 -15.458  -9.498
   10   HD22  LEU  72          HD22      LEU  72  -2.245 -15.309  -7.853
   11   HD21  LEU  72          HD23      LEU  72  -2.958 -13.915  -8.659

  No H/Q in entry =          11
  In of MODEL   38
    1    H    VAL  73           H        VAL  73  -6.184 -14.116  -4.248
    2    HA   VAL  73           HA       VAL  73  -6.231 -11.346  -3.889
    3    HB   VAL  73           HB       VAL  73  -7.933 -11.712  -2.290
    4   HG13  VAL  73          HG11      VAL  73  -9.405 -13.083  -3.507
    5   HG12  VAL  73          HG12      VAL  73  -8.126 -14.200  -3.976
    6   HG11  VAL  73          HG13      VAL  73  -8.217 -12.603  -4.720
    7   HG22  VAL  73          HG21      VAL  73  -7.092 -13.147  -0.664
    8   HG21  VAL  73          HG22      VAL  73  -6.473 -14.294  -1.852
    9   HG23  VAL  73          HG23      VAL  73  -8.201 -14.228  -1.508

  No H/Q in entry =           9
  In of MODEL   38
    1    H    LEU  74           H        LEU  74  -4.275 -13.715  -2.329
    2    HA   LEU  74           HA       LEU  74  -3.844 -12.581   0.194
    3    HB2  LEU  74           HB2      LEU  74  -3.060 -14.796  -0.317
    4    HB3  LEU  74           HB3      LEU  74  -2.022 -14.181  -1.601
    5    HG   LEU  74           HG       LEU  74  -0.696 -12.931   0.067
    6   HD12  LEU  74          HD11      LEU  74  -1.159 -13.644   2.514
    7   HD11  LEU  74          HD12      LEU  74  -2.760 -14.108   1.934
    8   HD13  LEU  74          HD13      LEU  74  -2.228 -12.431   1.808
    9   HD23  LEU  74          HD21      LEU  74  -0.901 -15.684   1.175
   10   HD22  LEU  74          HD22      LEU  74   0.502 -14.765   0.677
   11   HD21  LEU  74          HD23      LEU  74  -0.517 -15.508  -0.535

  No H/Q in entry =          11
  In of MODEL   38
    1    H    VAL  75           H        VAL  75  -1.980 -12.176  -2.779
    2    HA   VAL  75           HA       VAL  75  -0.177 -10.251  -1.779
    3    HB   VAL  75           HB       VAL  75  -1.156 -10.725  -4.595
    4   HG11  VAL  75          HG11      VAL  75   1.127  -9.008  -3.529
    5   HG13  VAL  75          HG12      VAL  75  -0.293  -8.439  -4.393
    6   HG12  VAL  75          HG13      VAL  75   0.900  -9.425  -5.222
    7   HG22  VAL  75          HG21      VAL  75   0.038 -12.621  -3.625
    8   HG21  VAL  75          HG22      VAL  75   1.317 -11.557  -3.040
    9   HG23  VAL  75          HG23      VAL  75   1.105 -11.810  -4.774

  No H/Q in entry =           9
  In of MODEL   38
    1    H    GLU  76           H        GLU  76  -3.343  -9.904  -3.408
    2    HA   GLU  76           HA       GLU  76  -3.400  -7.090  -3.500
    3    HB2  GLU  76           HB2      GLU  76  -5.068  -8.514  -4.656
    4    HB3  GLU  76           HB3      GLU  76  -5.698  -9.041  -3.104
    5    HG2  GLU  76           HG2      GLU  76  -7.174  -7.326  -3.942
    6    HG3  GLU  76           HG3      GLU  76  -6.288  -6.630  -2.600

  No H/Q in entry =           6
  In of MODEL   38
    1    H    ALA  77           H        ALA  77  -4.484  -9.327  -0.957
    2    HA   ALA  77           HA       ALA  77  -5.428  -7.332   0.816
    3    HB3  ALA  77           HB1      ALA  77  -6.131  -9.523   1.302
    4    HB2  ALA  77           HB2      ALA  77  -4.961  -9.170   2.573
    5    HB1  ALA  77           HB3      ALA  77  -4.493 -10.171   1.200

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLN  78           H        GLN  78  -2.282  -8.876   0.419
    2    HA   GLN  78           HA       GLN  78  -1.005  -7.721   2.661
    3    HB2  GLN  78           HB2      GLN  78  -0.193  -9.658   1.206
    4    HB3  GLN  78           HB3      GLN  78   0.335  -8.440   0.047
    5    HG2  GLN  78           HG2      GLN  78   1.821  -7.449   1.668
    6    HG3  GLN  78           HG3      GLN  78   1.191  -8.477   2.951
    7   HE21  GLN  78          HE21      GLN  78   1.252 -11.007   2.054
    8   HE22  GLN  78          HE22      GLN  78   2.784 -11.451   1.475

  No H/Q in entry =           8
  In of MODEL   38
    1    H    LEU  79           H        LEU  79  -1.403  -6.650  -0.679
    2    HA   LEU  79           HA       LEU  79   0.281  -4.421  -0.674
    3    HB2  LEU  79           HB2      LEU  79  -0.764  -5.223  -2.721
    4    HB3  LEU  79           HB3      LEU  79  -2.362  -4.834  -2.097
    5    HG   LEU  79           HG       LEU  79  -1.820  -2.447  -2.069
    6   HD13  LEU  79          HD11      LEU  79   0.425  -2.203  -1.576
    7   HD12  LEU  79          HD12      LEU  79   0.458  -1.910  -3.314
    8   HD11  LEU  79          HD13      LEU  79   0.919  -3.490  -2.677
    9   HD23  LEU  79          HD21      LEU  79  -1.209  -2.240  -4.626
   10   HD22  LEU  79          HD22      LEU  79  -2.730  -2.990  -4.155
   11   HD21  LEU  79          HD23      LEU  79  -1.361  -3.997  -4.615

  No H/Q in entry =          11
  In of MODEL   38
    1    H    HIS  80           H        HIS  80  -3.178  -4.589   0.183
    2    HA   HIS  80           HA       HIS  80  -3.365  -1.834   0.856
    3    HB2  HIS  80           HB2      HIS  80  -5.062  -4.245   1.183
    4    HB3  HIS  80           HB3      HIS  80  -5.374  -2.909   2.294
    5    HD1  HIS  80           HD1      HIS  80  -7.000  -1.270   1.406
    6    HD2  HIS  80           HD2      HIS  80  -4.834  -3.072  -1.667
    7    HE1  HIS  80           HE1      HIS  80  -7.860  -0.267  -0.762
    8    HE2  HIS  80           HE2      HIS  80  -6.546  -1.359  -2.644

  No H/Q in entry =           8
  In of MODEL   38
    1    H    LEU  81           H        LEU  81  -2.857  -4.735   2.836
    2    HA   LEU  81           HA       LEU  81  -2.823  -3.395   5.324
    3    HB2  LEU  81           HB2      LEU  81  -1.612  -6.009   4.426
    4    HB3  LEU  81           HB3      LEU  81  -1.571  -5.455   6.101
    5    HG   LEU  81           HG       LEU  81  -4.131  -5.703   4.495
    6   HD12  LEU  81          HD11      LEU  81  -4.419  -7.773   6.039
    7   HD11  LEU  81          HD12      LEU  81  -2.666  -7.703   6.210
    8   HD13  LEU  81          HD13      LEU  81  -3.389  -7.929   4.616
    9   HD23  LEU  81          HD21      LEU  81  -4.952  -5.914   7.003
   10   HD22  LEU  81          HD22      LEU  81  -4.633  -4.323   6.315
   11   HD21  LEU  81          HD23      LEU  81  -3.437  -5.086   7.362

  No H/Q in entry =          11
  In of MODEL   38
    1    H    MET  82           H        MET  82  -0.161  -4.292   3.127
    2    HA   MET  82           HA       MET  82   1.937  -3.403   4.794
    3    HB2  MET  82           HB2      MET  82   1.695  -3.736   1.803
    4    HB3  MET  82           HB3      MET  82   3.184  -3.168   2.555
    5    HG2  MET  82           HG2      MET  82   1.783  -5.759   3.284
    6    HG3  MET  82           HG3      MET  82   3.144  -5.646   2.172
    7    HE3  MET  82           HE1      MET  82   6.178  -4.917   4.131
    8    HE2  MET  82           HE2      MET  82   5.250  -3.548   3.525
    9    HE1  MET  82           HE3      MET  82   5.329  -5.035   2.584

  No H/Q in entry =           9
  In of MODEL   38
    1    H    THR  83           H        THR  83   0.092  -1.753   2.259
    2    HA   THR  83           HA       THR  83   1.506   0.694   2.340
    3    HB   THR  83           HB       THR  83  -0.679   1.623   1.377
    4    HG1  THR  83           HG1      THR  83  -2.331   0.327   1.281
    5   HG22  THR  83          HG21      THR  83  -0.427  -0.189  -0.632
    6   HG21  THR  83          HG22      THR  83   1.081  -0.485   0.230
    7   HG23  THR  83          HG23      THR  83   0.715   1.131  -0.377

  No H/Q in entry =           7
  In of MODEL   38
    1    H    SER  84           H        SER  84  -1.486  -0.341   3.966
    2    HA   SER  84           HA       SER  84  -1.968   2.085   5.322
    3    HB2  SER  84           HB2      SER  84  -2.798  -0.754   5.885
    4    HB3  SER  84           HB3      SER  84  -3.281   0.584   6.927
    5    HG   SER  84           HG       SER  84  -3.765   0.279   4.138

  No H/Q in entry =           5
  In of MODEL   38
    1    H    MET  85           H        MET  85  -0.250  -0.851   6.427
    2    HA   MET  85           HA       MET  85   0.294   0.067   9.029
    3    HB2  MET  85           HB2      MET  85   0.578  -2.275   8.341
    4    HB3  MET  85           HB3      MET  85   1.952  -1.809   7.337
    5    HG2  MET  85           HG2      MET  85   3.146  -0.984   9.326
    6    HG3  MET  85           HG3      MET  85   1.765  -1.407  10.338
    7    HE2  MET  85           HE1      MET  85   2.193  -4.884  11.295
    8    HE1  MET  85           HE2      MET  85   0.908  -3.781  10.805
    9    HE3  MET  85           HE3      MET  85   2.189  -3.214  11.872

  No H/Q in entry =           9
  In of MODEL   38
    1    H    LEU  86           H        LEU  86   2.202   0.330   6.061
    2    HA   LEU  86           HA       LEU  86   4.428   1.635   7.200
    3    HB2  LEU  86           HB2      LEU  86   4.214   0.559   4.890
    4    HB3  LEU  86           HB3      LEU  86   3.403   2.043   4.389
    5    HG   LEU  86           HG       LEU  86   5.441   3.284   5.354
    6   HD11  LEU  86          HD11      LEU  86   6.151   0.670   6.140
    7   HD13  LEU  86          HD12      LEU  86   7.157   2.113   6.232
    8   HD12  LEU  86          HD13      LEU  86   7.252   1.069   4.817
    9   HD23  LEU  86          HD21      LEU  86   6.134   1.527   2.992
   10   HD22  LEU  86          HD22      LEU  86   6.532   3.223   3.255
   11   HD21  LEU  86          HD23      LEU  86   4.875   2.758   2.871

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ALA  87           H        ALA  87   1.502   2.886   5.646
    2    HA   ALA  87           HA       ALA  87   2.100   5.615   5.731
    3    HB1  ALA  87           HB1      ALA  87  -0.216   3.991   5.207
    4    HB3  ALA  87           HB2      ALA  87   0.092   5.653   4.709
    5    HB2  ALA  87           HB3      ALA  87  -0.687   5.328   6.259

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ARG  88           H        ARG  88   0.430   3.609   8.132
    2    HA   ARG  88           HA       ARG  88  -0.062   5.654   9.988
    3    HB2  ARG  88           HB2      ARG  88  -1.002   3.302  10.057
    4    HB3  ARG  88           HB3      ARG  88   0.544   2.798  10.748
    5    HG2  ARG  88           HG2      ARG  88   0.085   4.869  12.378
    6    HG3  ARG  88           HG3      ARG  88  -1.586   4.547  11.936
    7    HD2  ARG  88           HD2      ARG  88  -1.684   2.695  13.178
    8    HD3  ARG  88           HD3      ARG  88  -0.100   2.112  12.631
    9    HE   ARG  88           HE       ARG  88  -0.610   3.370  15.093
   10   HH21  ARG  88          HH11      ARG  88   0.961   4.377  16.320
   11   HH22  ARG  88          HH12      ARG  88   2.474   4.804  15.603
   12   HH11  ARG  88          HH21      ARG  88   1.647   3.556  12.496
   13   HH12  ARG  88          HH22      ARG  88   2.871   4.323  13.449

  No H/Q in entry =          13
  In of MODEL   38
    1    H    GLU  89           H        GLU  89   2.730   3.433   9.734
    2    HA   GLU  89           HA       GLU  89   4.014   4.314  12.068
    3    HB2  GLU  89           HB2      GLU  89   4.659   2.299  10.713
    4    HB3  GLU  89           HB3      GLU  89   5.425   3.395   9.562
    5    HG2  GLU  89           HG2      GLU  89   6.926   4.236  11.295
    6    HG3  GLU  89           HG3      GLU  89   6.102   3.278  12.520

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LEU  90           H        LEU  90   4.301   5.481   8.741
    2    HA   LEU  90           HA       LEU  90   6.238   7.478   9.313
    3    HB2  LEU  90           HB2      LEU  90   4.212   7.154   7.104
    4    HB3  LEU  90           HB3      LEU  90   5.443   8.424   7.117
    5    HG   LEU  90           HG       LEU  90   6.118   5.486   7.437
    6   HD12  LEU  90          HD11      LEU  90   6.844   5.725   4.991
    7   HD11  LEU  90          HD12      LEU  90   5.829   7.166   4.956
    8   HD13  LEU  90          HD13      LEU  90   5.112   5.593   5.301
    9   HD22  LEU  90          HD21      LEU  90   8.022   6.633   8.105
   10   HD21  LEU  90          HD22      LEU  90   7.663   8.041   7.104
   11   HD23  LEU  90          HD23      LEU  90   8.316   6.578   6.368

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  91           H        ILE  91   2.698   7.495   9.197
    2    HA   ILE  91           HA       ILE  91   2.360  10.267   9.658
    3    HB   ILE  91           HB       ILE  91   0.574   7.890  10.211
    4   HG12  ILE  91          HG12      ILE  91   0.308  10.176   8.234
    5   HG13  ILE  91          HG13      ILE  91   1.164   8.683   7.850
    6   HG22  ILE  91          HG21      ILE  91  -1.158   9.948  10.295
    7   HG21  ILE  91          HG22      ILE  91   0.250  10.777  10.957
    8   HG23  ILE  91          HG23      ILE  91  -0.380   9.337  11.756
    9   HD13  ILE  91          HD11      ILE  91  -0.780   7.395   7.909
   10   HD12  ILE  91          HD12      ILE  91  -1.375   8.912   7.237
   11   HD11  ILE  91          HD13      ILE  91  -1.631   8.544   8.943

  No H/Q in entry =          11
  In of MODEL   38
    1    H    THR  92           H        THR  92   2.784   7.520  11.849
    2    HA   THR  92           HA       THR  92   2.362   8.887  14.280
    3    HB   THR  92           HB       THR  92   4.165   6.555  13.593
    4    HG1  THR  92           HG1      THR  92   2.196   5.797  13.508
    5   HG22  THR  92          HG21      THR  92   3.805   6.264  16.229
    6   HG21  THR  92          HG22      THR  92   3.739   8.024  16.161
    7   HG23  THR  92          HG23      THR  92   5.168   7.170  15.573

  No H/Q in entry =           7
  In of MODEL   38
    1    H    GLU  93           H        GLU  93   5.296   8.445  12.319
    2    HA   GLU  93           HA       GLU  93   7.063   9.869  14.003
    3    HB2  GLU  93           HB2      GLU  93   7.125   9.561  10.987
    4    HB3  GLU  93           HB3      GLU  93   8.474  10.090  11.990
    5    HG2  GLU  93           HG2      GLU  93   7.071   7.451  12.444
    6    HG3  GLU  93           HG3      GLU  93   8.445   7.607  11.356

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LEU  94           H        LEU  94   4.990  10.888  11.311
    2    HA   LEU  94           HA       LEU  94   5.791  13.593  11.210
    3    HB2  LEU  94           HB2      LEU  94   3.196  12.227  10.476
    4    HB3  LEU  94           HB3      LEU  94   3.450  13.955  10.236
    5    HG   LEU  94           HG       LEU  94   5.460  11.972   9.164
    6   HD11  LEU  94          HD11      LEU  94   2.709  12.522   8.127
    7   HD13  LEU  94          HD12      LEU  94   3.692  11.067   7.989
    8   HD12  LEU  94          HD13      LEU  94   4.017  12.450   6.945
    9   HD23  LEU  94          HD21      LEU  94   5.693  13.812   7.443
   10   HD22  LEU  94          HD22      LEU  94   6.122  14.302   9.082
   11   HD21  LEU  94          HD23      LEU  94   4.564  14.770   8.399

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  95           H        ILE  95   3.272  11.969  13.120
    2    HA   ILE  95           HA       ILE  95   2.237  14.314  14.329
    3    HB   ILE  95           HB       ILE  95   2.266  11.431  15.247
    4   HG12  ILE  95          HG12      ILE  95   0.034  13.203  14.221
    5   HG13  ILE  95          HG13      ILE  95   0.983  12.147  13.179
    6   HG21  ILE  95          HG21      ILE  95   0.991  13.898  16.465
    7   HG23  ILE  95          HG22      ILE  95   2.048  12.729  17.258
    8   HG22  ILE  95          HG23      ILE  95   0.409  12.267  16.796
    9   HD13  ILE  95          HD11      ILE  95   0.091  10.205  14.101
   10   HD12  ILE  95          HD12      ILE  95  -1.292  11.292  14.192
   11   HD11  ILE  95          HD13      ILE  95  -0.314  10.992  15.628

  No H/Q in entry =          11
  In of MODEL   38
    1    H    GLU  96           H        GLU  96   4.844  12.098  15.297
    2    HA   GLU  96           HA       GLU  96   5.419  13.292  17.787
    3    HB2  GLU  96           HB2      GLU  96   6.365  11.136  17.126
    4    HB3  GLU  96           HB3      GLU  96   7.286  11.914  15.840
    5    HG2  GLU  96           HG2      GLU  96   8.946  12.463  17.289
    6    HG3  GLU  96           HG3      GLU  96   7.807  13.272  18.356

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LEU  97           H        LEU  97   6.463  14.073  14.493
    2    HA   LEU  97           HA       LEU  97   8.351  16.073  15.193
    3    HB2  LEU  97           HB2      LEU  97   6.739  15.525  12.711
    4    HB3  LEU  97           HB3      LEU  97   7.756  16.959  12.827
    5    HG   LEU  97           HG       LEU  97   8.797  14.162  13.372
    6   HD12  LEU  97          HD11      LEU  97   9.773  14.364  11.046
    7   HD11  LEU  97          HD12      LEU  97   8.716  15.752  10.795
    8   HD13  LEU  97          HD13      LEU  97   8.023  14.158  11.092
    9   HD23  LEU  97          HD21      LEU  97  10.956  15.448  12.613
   10   HD22  LEU  97          HD22      LEU  97  10.350  15.713  14.248
   11   HD21  LEU  97          HD23      LEU  97  10.023  16.898  12.985

  No H/Q in entry =          11
  In of MODEL   38
    1    H    HIS  98           H        HIS  98   4.853  16.200  14.569
    2    HA   HIS  98           HA       HIS  98   4.548  18.999  14.713
    3    HB2  HIS  98           HB2      HIS  98   2.670  16.742  15.450
    4    HB3  HIS  98           HB3      HIS  98   2.199  18.441  15.514
    5    HD1  HIS  98           HD1      HIS  98   3.207  15.734  13.094
    6    HD2  HIS  98           HD2      HIS  98   1.820  19.664  12.992
    7    HE1  HIS  98           HE1      HIS  98   2.626  16.226  10.676
    8    HE2  HIS  98           HE2      HIS  98   1.784  18.614  10.593

  No H/Q in entry =           8
  In of MODEL   38
    1    H    GLU  99           H        GLU  99   4.709  16.505  17.205
    2    HA   GLU  99           HA       GLU  99   4.116  18.193  19.412
    3    HB2  GLU  99           HB2      GLU  99   4.035  15.711  19.505
    4    HB3  GLU  99           HB3      GLU  99   5.794  15.671  19.381
    5    HG2  GLU  99           HG2      GLU  99   5.996  16.959  21.456
    6    HG3  GLU  99           HG3      GLU  99   4.244  17.095  21.567

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LYS 100           H        LYS 100   7.158  17.275  17.819
    2    HA   LYS 100           HA       LYS 100   8.826  18.676  19.664
    3    HB2  LYS 100           HB2      LYS 100   9.302  17.759  16.820
    4    HB3  LYS 100           HB3      LYS 100  10.539  18.530  17.819
    5    HG2  LYS 100           HG2      LYS 100  10.182  16.774  19.559
    6    HG3  LYS 100           HG3      LYS 100   9.043  15.970  18.476
    7    HD2  LYS 100           HD2      LYS 100  10.823  15.696  16.793
    8    HD3  LYS 100           HD3      LYS 100  11.967  16.512  17.861
    9    HE2  LYS 100           HE2      LYS 100  11.591  14.752  19.579
   10    HE3  LYS 100           HE3      LYS 100  10.508  13.916  18.461
   11    HZ1  LYS 100           HZ1      LYS 100  13.321  14.594  17.783
   12    HZ3  LYS 100           HZ2      LYS 100  12.273  13.538  16.961
   13    HZ2  LYS 100           HZ3      LYS 100  12.876  13.117  18.493

  No H/Q in entry =          13
  In of MODEL   38
    1    H    LEU 101           H        LEU 101   7.104  19.604  16.726
    2    HA   LEU 101           HA       LEU 101   8.308  22.165  16.386
    3    HB2  LEU 101           HB2      LEU 101   5.709  20.927  15.519
    4    HB3  LEU 101           HB3      LEU 101   5.953  22.659  15.313
    5    HG   LEU 101           HG       LEU 101   7.986  20.650  14.326
    6   HD12  LEU 101          HD11      LEU 101   6.812  21.158  12.052
    7   HD11  LEU 101          HD12      LEU 101   5.420  21.582  13.045
    8   HD13  LEU 101          HD13      LEU 101   6.089  19.953  13.118
    9   HD21  LEU 101          HD21      LEU 101   7.346  23.562  13.782
   10   HD23  LEU 101          HD22      LEU 101   8.320  22.607  12.665
   11   HD22  LEU 101          HD23      LEU 101   8.875  22.863  14.318

  No H/Q in entry =          11
  In of MODEL   38
    1    H    LYS 102           H        LYS 102   6.797  21.018  19.012
    2    HA   LYS 102           HA       LYS 102   6.178  22.103  20.952
    3    HB2  LYS 102           HB2      LYS 102   7.446  24.099  19.822
    4    HB3  LYS 102           HB3      LYS 102   5.843  24.701  19.461
    5    HG2  LYS 102           HG2      LYS 102   7.243  24.442  22.101
    6    HG3  LYS 102           HG3      LYS 102   6.282  25.770  21.483
    7    HD2  LYS 102           HD2      LYS 102   5.052  23.129  22.366
    8    HD3  LYS 102           HD3      LYS 102   5.307  24.488  23.451
    9    HE2  LYS 102           HE2      LYS 102   3.016  24.083  21.981
   10    HE3  LYS 102           HE3      LYS 102   3.521  25.628  22.662
   11    HZ2  LYS 102           HZ1      LYS 102   2.970  25.740  20.287
   12    HZ1  LYS 102           HZ2      LYS 102   4.231  24.662  19.951
   13    HZ3  LYS 102           HZ3      LYS 102   4.576  26.192  20.594

  No H/Q in entry =          13
  In of MODEL   38
    1    H    ALA 103           H        ALA 103   4.513  23.649  18.203
    2    HA   ALA 103           HA       ALA 103   2.065  24.217  19.111
    3    HB1  ALA 103           HB1      ALA 103   1.149  23.379  16.874
    4    HB2  ALA 103           HB2      ALA 103   2.795  22.846  16.529
    5    HB3  ALA 103           HB3      ALA 103   2.459  24.557  16.802

  No H/Q in entry =           5
  In of MODEL   38
    1    H1   ALA   1           H3       ALA   1  10.544 -20.203  -6.344
    2    H2   ALA   1           H2       ALA   1   9.568 -20.408  -7.721
    3    H3   ALA   1           H1       ALA   1   9.145 -21.158  -6.256
    4    HA   ALA   1           HA       ALA   1  10.181 -22.964  -7.009
    5    HB1  ALA   1           HB1      ALA   1  10.256 -22.599  -9.285
    6    HB2  ALA   1           HB2      ALA   1  11.986 -22.446  -8.971
    7    HB3  ALA   1           HB3      ALA   1  10.984 -21.000  -9.109

  No H/Q in entry =           7
  In of MODEL   38
    1    H    GLU   2           H        GLU   2  12.466 -23.910  -7.090
    2    HA   GLU   2           HA       GLU   2  13.867 -23.832  -4.890
    3    HB2  GLU   2           HB2      GLU   2  15.198 -23.692  -7.601
    4    HB3  GLU   2           HB3      GLU   2  15.941 -24.305  -6.124
    5    HG2  GLU   2           HG2      GLU   2  14.925 -26.323  -6.361
    6    HG3  GLU   2           HG3      GLU   2  13.350 -25.579  -6.604

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLU   3           H        GLU   3  15.614 -21.959  -7.303
    2    HA   GLU   3           HA       GLU   3  16.782 -20.275  -5.350
    3    HB2  GLU   3           HB2      GLU   3  16.699 -20.265  -8.359
    4    HB3  GLU   3           HB3      GLU   3  17.451 -18.937  -7.475
    5    HG2  GLU   3           HG2      GLU   3  19.123 -20.311  -6.571
    6    HG3  GLU   3           HG3      GLU   3  18.177 -21.779  -6.787

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LEU   4           H        LEU   4  14.475 -19.424  -7.958
    2    HA   LEU   4           HA       LEU   4  14.010 -16.817  -7.336
    3    HB2  LEU   4           HB2      LEU   4  11.832 -18.793  -8.051
    4    HB3  LEU   4           HB3      LEU   4  11.752 -17.043  -8.245
    5    HG   LEU   4           HG       LEU   4  13.707 -18.901  -9.640
    6   HD13  LEU   4          HD11      LEU   4  12.388 -18.749 -11.538
    7   HD12  LEU   4          HD12      LEU   4  11.682 -17.206 -11.060
    8   HD11  LEU   4          HD13      LEU   4  11.137 -18.699 -10.298
    9   HD23  LEU   4          HD21      LEU   4  14.028 -16.652 -10.989
   10   HD22  LEU   4          HD22      LEU   4  14.902 -16.897  -9.478
   11   HD21  LEU   4          HD23      LEU   4  13.448 -15.902  -9.501

  No H/Q in entry =          11
  In of MODEL   38
    1    H    GLU   5           H        GLU   5  12.544 -19.607  -5.687
    2    HA   GLU   5           HA       GLU   5  10.880 -18.042  -3.965
    3    HB2  GLU   5           HB2      GLU   5  10.460 -20.423  -4.492
    4    HB3  GLU   5           HB3      GLU   5  11.897 -20.854  -3.563
    5    HG2  GLU   5           HG2      GLU   5  10.929 -19.820  -1.555
    6    HG3  GLU   5           HG3      GLU   5   9.498 -19.357  -2.477

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLU   6           H        GLU   6  14.033 -19.618  -3.555
    2    HA   GLU   6           HA       GLU   6  14.409 -18.768  -0.858
    3    HB2  GLU   6           HB2      GLU   6  15.625 -20.679  -1.886
    4    HB3  GLU   6           HB3      GLU   6  16.493 -19.538  -2.915
    5    HG2  GLU   6           HG2      GLU   6  17.897 -20.013  -1.011
    6    HG3  GLU   6           HG3      GLU   6  17.280 -18.373  -0.823

  No H/Q in entry =           6
  In of MODEL   38
    1    H    VAL   7           H        VAL   7  15.144 -17.432  -4.011
    2    HA   VAL   7           HA       VAL   7  16.834 -15.305  -3.156
    3    HB   VAL   7           HB       VAL   7  15.106 -15.665  -5.619
    4   HG11  VAL   7          HG11      VAL   7  17.003 -13.451  -4.819
    5   HG13  VAL   7          HG12      VAL   7  15.355 -13.310  -5.427
    6   HG12  VAL   7          HG13      VAL   7  16.655 -13.807  -6.510
    7   HG21  VAL   7          HG21      VAL   7  17.221 -17.120  -5.073
    8   HG23  VAL   7          HG22      VAL   7  18.120 -15.656  -5.476
    9   HG22  VAL   7          HG23      VAL   7  17.074 -16.405  -6.679

  No H/Q in entry =           9
  In of MODEL   38
    1    H    VAL   8           H        VAL   8  13.337 -15.580  -3.682
    2    HA   VAL   8           HA       VAL   8  12.670 -12.874  -3.198
    3    HB   VAL   8           HB       VAL   8  11.067 -15.406  -2.753
    4   HG12  VAL   8          HG11      VAL   8   9.136 -13.666  -2.941
    5   HG11  VAL   8          HG12      VAL   8  10.365 -12.484  -2.490
    6   HG13  VAL   8          HG13      VAL   8   9.982 -13.816  -1.401
    7   HG22  VAL   8          HG21      VAL   8  10.467 -15.265  -4.972
    8   HG21  VAL   8          HG22      VAL   8  11.930 -14.295  -5.125
    9   HG23  VAL   8          HG23      VAL   8  10.368 -13.505  -4.927

  No H/Q in entry =           9
  In of MODEL   38
    1    H    MET   9           H        MET   9  12.963 -15.685  -1.027
    2    HA   MET   9           HA       MET   9  12.166 -14.421   1.353
    3    HB2  MET   9           HB2      MET   9  14.065 -16.694   0.784
    4    HB3  MET   9           HB3      MET   9  13.796 -16.114   2.428
    5    HG2  MET   9           HG2      MET   9  11.403 -16.546   2.235
    6    HG3  MET   9           HG3      MET   9  11.598 -17.015   0.545
    7    HE1  MET   9           HE1      MET   9  12.516 -17.461   4.082
    8    HE3  MET   9           HE2      MET   9  14.107 -18.074   3.641
    9    HE2  MET   9           HE3      MET   9  12.911 -19.165   4.336

  No H/Q in entry =           9
  In of MODEL   38
    1    H    GLY  10           H        GLY  10  15.334 -14.634  -0.232
    2    HA3  GLY  10           HA2      GLY  10  16.807 -13.214   1.728
    3    HA2  GLY  10           HA3      GLY  10  17.255 -13.374   0.030

  No H/Q in entry =           3
  In of MODEL   38
    1    H    LEU  11           H        LEU  11  15.072 -12.156  -1.187
    2    HA   LEU  11           HA       LEU  11  15.751  -9.409  -1.023
    3    HB2  LEU  11           HB2      LEU  11  13.376 -10.823  -2.240
    4    HB3  LEU  11           HB3      LEU  11  13.650  -9.087  -2.398
    5    HG   LEU  11           HG       LEU  11  15.677 -11.188  -3.209
    6   HD13  LEU  11          HD11      LEU  11  13.918 -11.556  -4.714
    7   HD12  LEU  11          HD12      LEU  11  14.910 -10.370  -5.561
    8   HD11  LEU  11          HD13      LEU  11  13.443  -9.857  -4.728
    9   HD22  LEU  11          HD21      LEU  11  16.904  -9.221  -2.990
   10   HD21  LEU  11          HD22      LEU  11  15.523  -8.188  -3.353
   11   HD23  LEU  11          HD23      LEU  11  16.345  -9.050  -4.652

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  12           H        ILE  12  13.000 -11.247   0.265
    2    HA   ILE  12           HA       ILE  12  11.609  -9.030   1.342
    3    HB   ILE  12           HB       ILE  12  11.663 -11.914   2.286
    4   HG12  ILE  12          HG12      ILE  12  10.955 -11.280  -0.156
    5   HG13  ILE  12          HG13      ILE  12   9.941 -12.375   0.762
    6   HG22  ILE  12          HG21      ILE  12   9.383 -11.334   3.214
    7   HG21  ILE  12          HG22      ILE  12   9.736  -9.642   2.873
    8   HG23  ILE  12          HG23      ILE  12  10.724 -10.533   4.031
    9   HD11  ILE  12          HD11      ILE  12   9.499  -9.385   0.556
   10   HD13  ILE  12          HD12      ILE  12   8.413 -10.569   1.281
   11   HD12  ILE  12          HD13      ILE  12   8.687 -10.574  -0.447

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  13           H        ILE  13  14.022 -11.230   2.721
    2    HA   ILE  13           HA       ILE  13  14.076 -10.056   5.304
    3    HB   ILE  13           HB       ILE  13  16.135 -11.611   3.718
    4   HG12  ILE  13          HG12      ILE  13  13.875 -12.609   4.538
    5   HG13  ILE  13          HG13      ILE  13  15.356 -13.514   4.836
    6   HG23  ILE  13          HG21      ILE  13  17.409 -10.339   5.306
    7   HG22  ILE  13          HG22      ILE  13  17.258 -11.958   5.975
    8   HG21  ILE  13          HG23      ILE  13  16.250 -10.652   6.596
    9   HD12  ILE  13          HD11      ILE  13  13.559 -13.033   6.792
   10   HD11  ILE  13          HD12      ILE  13  14.521 -11.565   6.930
   11   HD13  ILE  13          HD13      ILE  13  15.290 -13.137   7.109

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ASN  14           H        ASN  14  16.001  -9.510   2.370
    2    HA   ASN  14           HA       ASN  14  17.746  -7.563   3.421
    3    HB2  ASN  14           HB2      ASN  14  17.709  -8.824   1.102
    4    HB3  ASN  14           HB3      ASN  14  16.805  -7.410   0.576
    5   HD21  ASN  14          HD21      ASN  14  19.236  -7.735  -0.632
    6   HD22  ASN  14          HD22      ASN  14  20.379  -6.647  -0.012

  No H/Q in entry =           6
  In of MODEL   38
    1    H    SER  15           H        SER  15  14.619  -7.227   1.757
    2    HA   SER  15           HA       SER  15  14.493  -4.407   1.821
    3    HB2  SER  15           HB2      SER  15  12.157  -4.664   1.345
    4    HB3  SER  15           HB3      SER  15  12.955  -6.024   0.564
    5    HG   SER  15           HG       SER  15  11.410  -5.950   2.908

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLY  16           H        GLY  16  13.433  -6.879   4.128
    2    HA3  GLY  16           HA2      GLY  16  12.218  -5.141   6.000
    3    HA2  GLY  16           HA3      GLY  16  12.845  -6.747   6.353

  No H/Q in entry =           3
  In of MODEL   38
    1    H    GLN  17           H        GLN  17  15.549  -6.397   5.738
    2    HA   GLN  17           HA       GLN  17  16.519  -5.177   8.113
    3    HB2  GLN  17           HB2      GLN  17  17.749  -6.959   6.905
    4    HB3  GLN  17           HB3      GLN  17  18.038  -5.841   5.572
    5    HG2  GLN  17           HG2      GLN  17  20.000  -5.878   7.011
    6    HG3  GLN  17           HG3      GLN  17  19.208  -4.311   7.161
    7   HE21  GLN  17          HE21      GLN  17  19.790  -3.837   9.344
    8   HE22  GLN  17          HE22      GLN  17  19.302  -4.794  10.658

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ALA  18           H        ALA  18  16.295  -4.092   4.757
    2    HA   ALA  18           HA       ALA  18  17.719  -1.691   4.978
    3    HB2  ALA  18           HB1      ALA  18  16.591  -2.908   2.917
    4    HB3  ALA  18           HB2      ALA  18  16.845  -1.163   2.904
    5    HB1  ALA  18           HB3      ALA  18  15.253  -1.819   3.285

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ARG  19           H        ARG  19  14.226  -2.301   5.403
    2    HA   ARG  19           HA       ARG  19  13.549   0.343   6.130
    3    HB2  ARG  19           HB2      ARG  19  11.873  -1.417   5.554
    4    HB3  ARG  19           HB3      ARG  19  12.233  -2.217   7.086
    5    HG2  ARG  19           HG2      ARG  19  11.521  -0.233   8.336
    6    HG3  ARG  19           HG3      ARG  19  11.253   0.646   6.832
    7    HD2  ARG  19           HD2      ARG  19   9.123  -0.165   7.669
    8    HD3  ARG  19           HD3      ARG  19   9.535  -1.039   6.187
    9    HE   ARG  19           HE       ARG  19  10.521  -2.580   8.280
   10   HH21  ARG  19          HH11      ARG  19   9.289  -4.230   9.225
   11   HH22  ARG  19          HH12      ARG  19   7.568  -4.213   9.069
   12   HH11  ARG  19          HH21      ARG  19   7.510  -1.303   7.213
   13   HH12  ARG  19          HH22      ARG  19   6.561  -2.556   7.926

  No H/Q in entry =          13
  In of MODEL   38
    1    H    SER  20           H        SER  20  14.440  -2.487   8.076
    2    HA   SER  20           HA       SER  20  14.172  -1.395  10.618
    3    HB2  SER  20           HB2      SER  20  14.651  -3.717  10.487
    4    HB3  SER  20           HB3      SER  20  16.092  -3.443   9.511
    5    HG   SER  20           HG       SER  20  15.682  -2.714  12.228

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU  21           H        LEU  21  16.997  -1.311   8.458
    2    HA   LEU  21           HA       LEU  21  18.677   0.181  10.186
    3    HB2  LEU  21           HB2      LEU  21  18.631  -0.090   7.172
    4    HB3  LEU  21           HB3      LEU  21  19.885   0.785   8.048
    5    HG   LEU  21           HG       LEU  21  19.181  -2.110   8.612
    6   HD11  LEU  21          HD11      LEU  21  21.363  -0.960   6.845
    7   HD13  LEU  21          HD12      LEU  21  19.981  -1.911   6.304
    8   HD12  LEU  21          HD13      LEU  21  21.224  -2.657   7.306
    9   HD23  LEU  21          HD21      LEU  21  21.675  -1.931   9.459
   10   HD22  LEU  21          HD22      LEU  21  20.387  -1.321  10.491
   11   HD21  LEU  21          HD23      LEU  21  21.344  -0.204   9.531

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ALA  22           H        ALA  22  16.386   1.142   7.651
    2    HA   ALA  22           HA       ALA  22  16.908   3.904   7.667
    3    HB3  ALA  22           HB1      ALA  22  15.499   2.657   5.998
    4    HB2  ALA  22           HB2      ALA  22  14.788   4.164   6.574
    5    HB1  ALA  22           HB3      ALA  22  14.212   2.620   7.203

  No H/Q in entry =           5
  In of MODEL   38
    1    H    TYR  23           H        TYR  23  14.437   2.069   9.519
    2    HA   TYR  23           HA       TYR  23  13.474   4.297  10.982
    3    HB2  TYR  23           HB2      TYR  23  12.251   2.176  10.965
    4    HB3  TYR  23           HB3      TYR  23  13.593   1.371  11.778
    5    HD1  TYR  23           HD1      TYR  23  11.078   4.099  12.169
    6    HD2  TYR  23           HD2      TYR  23  13.809   1.428  14.132
    7    HE1  TYR  23           HE1      TYR  23  10.163   4.782  14.372
    8    HE2  TYR  23           HE2      TYR  23  12.894   2.110  16.334
    9    HH   TYR  23           HH       TYR  23  10.135   4.334  16.567

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ALA  24           H        ALA  24  16.137   2.034  11.591
    2    HA   ALA  24           HA       ALA  24  16.823   3.027  14.151
    3    HB1  ALA  24           HB1      ALA  24  18.188   1.242  13.970
    4    HB3  ALA  24           HB2      ALA  24  19.202   2.172  12.865
    5    HB2  ALA  24           HB3      ALA  24  17.907   1.158  12.232

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA  25           H        ALA  25  17.748   3.969  10.867
    2    HA   ALA  25           HA       ALA  25  19.688   5.913  11.501
    3    HB1  ALA  25           HB1      ALA  25  18.957   4.967   9.189
    4    HB3  ALA  25           HB2      ALA  25  19.450   6.657   9.283
    5    HB2  ALA  25           HB3      ALA  25  17.738   6.241   9.227

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU  26           H        LEU  26  16.169   6.124  11.170
    2    HA   LEU  26           HA       LEU  26  15.934   8.904  11.630
    3    HB2  LEU  26           HB2      LEU  26  14.071   7.661  10.714
    4    HB3  LEU  26           HB3      LEU  26  13.998   6.629  12.138
    5    HG   LEU  26           HG       LEU  26  13.393   8.580  13.528
    6   HD12  LEU  26          HD11      LEU  26  12.711  10.681  12.213
    7   HD11  LEU  26          HD12      LEU  26  13.684  10.036  10.894
    8   HD13  LEU  26          HD13      LEU  26  14.440  10.421  12.441
    9   HD21  LEU  26          HD21      LEU  26  11.699   8.265  11.031
   10   HD23  LEU  26          HD22      LEU  26  11.147   8.956  12.554
   11   HD22  LEU  26          HD23      LEU  26  11.607   7.257  12.476

  No H/Q in entry =          11
  In of MODEL   38
    1    H    LYS  27           H        LYS  27  15.858   6.118  13.816
    2    HA   LYS  27           HA       LYS  27  15.279   7.475  16.193
    3    HB2  LYS  27           HB2      LYS  27  15.316   5.001  15.921
    4    HB3  LYS  27           HB3      LYS  27  17.079   5.061  15.864
    5    HG2  LYS  27           HG2      LYS  27  17.143   6.042  18.115
    6    HG3  LYS  27           HG3      LYS  27  15.376   6.052  18.175
    7    HD2  LYS  27           HD2      LYS  27  15.360   3.585  17.932
    8    HD3  LYS  27           HD3      LYS  27  17.125   3.583  17.906
    9    HE2  LYS  27           HE2      LYS  27  17.173   4.566  20.165
   10    HE3  LYS  27           HE3      LYS  27  15.408   4.598  20.194
   11    HZ3  LYS  27           HZ1      LYS  27  16.214   2.647  21.333
   12    HZ2  LYS  27           HZ2      LYS  27  17.121   2.175  19.974
   13    HZ1  LYS  27           HZ3      LYS  27  15.422   2.173  19.908

  No H/Q in entry =          13
  In of MODEL   38
    1    H    GLN  28           H        GLN  28  18.384   6.910  14.574
    2    HA   GLN  28           HA       GLN  28  20.080   7.996  16.553
    3    HB2  GLN  28           HB2      GLN  28  20.335   7.938  13.536
    4    HB3  GLN  28           HB3      GLN  28  21.628   8.448  14.621
    5    HG2  GLN  28           HG2      GLN  28  20.259   5.747  14.742
    6    HG3  GLN  28           HG3      GLN  28  21.807   6.045  13.956
    7   HE21  GLN  28          HE21      GLN  28  23.075   7.754  15.782
    8   HE22  GLN  28          HE22      GLN  28  23.276   6.953  17.265

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ALA  29           H        ALA  29  18.300   9.479  13.879
    2    HA   ALA  29           HA       ALA  29  19.292  12.102  14.131
    3    HB2  ALA  29           HB1      ALA  29  17.579  12.737  12.675
    4    HB1  ALA  29           HB2      ALA  29  16.444  11.558  13.333
    5    HB3  ALA  29           HB3      ALA  29  17.768  11.023  12.297

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LYS  30           H        LYS  30  16.534  10.489  15.671
    2    HA   LYS  30           HA       LYS  30  15.523  12.736  17.042
    3    HB2  LYS  30           HB2      LYS  30  15.427   9.793  17.739
    4    HB3  LYS  30           HB3      LYS  30  14.565  11.038  18.643
    5    HG2  LYS  30           HG2      LYS  30  13.420  11.726  16.536
    6    HG3  LYS  30           HG3      LYS  30  14.222  10.394  15.699
    7    HD2  LYS  30           HD2      LYS  30  13.168   8.780  17.232
    8    HD3  LYS  30           HD3      LYS  30  12.376  10.100  18.093
    9    HE2  LYS  30           HE2      LYS  30  11.189  10.735  16.012
   10    HE3  LYS  30           HE3      LYS  30  11.960   9.385  15.171
   11    HZ2  LYS  30           HZ1      LYS  30   9.661   8.967  16.069
   12    HZ1  LYS  30           HZ2      LYS  30  10.341   9.018  17.631
   13    HZ3  LYS  30           HZ3      LYS  30  10.843   7.837  16.513

  No H/Q in entry =          13
  In of MODEL   38
    1    H    GLN  31           H        GLN  31  18.197  10.572  17.751
    2    HA   GLN  31           HA       GLN  31  18.544  11.580  20.445
    3    HB2  GLN  31           HB2      GLN  31  20.557  10.019  18.819
    4    HB3  GLN  31           HB3      GLN  31  20.438  10.139  20.575
    5    HG2  GLN  31           HG2      GLN  31  17.920   9.181  19.825
    6    HG3  GLN  31           HG3      GLN  31  19.015   8.343  18.733
    7   HE21  GLN  31          HE21      GLN  31  17.495   7.187  21.019
    8   HE22  GLN  31          HE22      GLN  31  18.661   6.526  22.058

  No H/Q in entry =           8
  In of MODEL   38
    1    H    GLY  32           H        GLY  32  19.034  12.907  17.478
    2    HA3  GLY  32           HA2      GLY  32  20.009  14.956  16.961
    3    HA2  GLY  32           HA3      GLY  32  20.779  14.959  18.543

  No H/Q in entry =           3
  In of MODEL   38
    1    H    ASP  33           H        ASP  33  21.194  12.072  16.754
    2    HA   ASP  33           HA       ASP  33  24.014  12.757  16.266
    3    HB2  ASP  33           HB2      ASP  33  22.514  10.137  16.388
    4    HB3  ASP  33           HB3      ASP  33  24.195  10.259  15.879

  No H/Q in entry =           4
  In of MODEL   38
    1    H    PHE  34           H        PHE  34  23.513  14.084  14.392
    2    HA   PHE  34           HA       PHE  34  22.147  13.102  12.114
    3    HB2  PHE  34           HB2      PHE  34  24.274  15.242  12.332
    4    HB3  PHE  34           HB3      PHE  34  23.278  14.953  10.908
    5    HD1  PHE  34           HD1      PHE  34  23.547  16.879  13.824
    6    HD2  PHE  34           HD2      PHE  34  20.656  14.761  11.457
    7    HE1  PHE  34           HE1      PHE  34  21.735  18.269  14.791
    8    HE2  PHE  34           HE2      PHE  34  18.847  16.151  12.426
    9    HZ   PHE  34           HZ       PHE  34  19.390  17.906  14.088

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ALA  35           H        ALA  35  25.531  12.922  13.093
    2    HA   ALA  35           HA       ALA  35  26.618  12.111  10.624
    3    HB3  ALA  35           HB1      ALA  35  28.317  10.942  12.327
    4    HB2  ALA  35           HB2      ALA  35  27.459  11.962  13.482
    5    HB1  ALA  35           HB3      ALA  35  28.282  12.692  12.105

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA  36           H        ALA  36  25.532  10.144  13.394
    2    HA   ALA  36           HA       ALA  36  26.014   7.662  12.107
    3    HB2  ALA  36           HB1      ALA  36  25.603   6.908  14.184
    4    HB3  ALA  36           HB2      ALA  36  23.912   7.398  14.050
    5    HB1  ALA  36           HB3      ALA  36  25.115   8.532  14.666

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA  37           H        ALA  37  23.186   9.777  12.271
    2    HA   ALA  37           HA       ALA  37  21.326   8.004  11.106
    3    HB3  ALA  37           HB1      ALA  37  21.543  10.967  11.404
    4    HB1  ALA  37           HB2      ALA  37  20.240   9.882  11.885
    5    HB2  ALA  37           HB3      ALA  37  20.412  10.359  10.195

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LYS  38           H        LYS  38  23.404  10.477   9.616
    2    HA   LYS  38           HA       LYS  38  22.743  10.054   6.943
    3    HB2  LYS  38           HB2      LYS  38  24.559  11.615   8.377
    4    HB3  LYS  38           HB3      LYS  38  25.587  10.632   7.340
    5    HG2  LYS  38           HG2      LYS  38  24.403  11.404   5.356
    6    HG3  LYS  38           HG3      LYS  38  23.213  12.251   6.349
    7    HD2  LYS  38           HD2      LYS  38  24.808  13.854   7.093
    8    HD3  LYS  38           HD3      LYS  38  26.167  12.875   6.543
    9    HE2  LYS  38           HE2      LYS  38  25.790  14.749   4.999
   10    HE3  LYS  38           HE3      LYS  38  25.454  13.212   4.194
   11    HZ3  LYS  38           HZ1      LYS  38  23.255  13.647   4.083
   12    HZ2  LYS  38           HZ2      LYS  38  23.771  15.264   4.171
   13    HZ1  LYS  38           HZ3      LYS  38  23.212  14.474   5.566

  No H/Q in entry =          13
  In of MODEL   38
    1    H    ALA  39           H        ALA  39  25.281   8.462   8.873
    2    HA   ALA  39           HA       ALA  39  26.339   6.884   6.791
    3    HB2  ALA  39           HB1      ALA  39  26.279   5.913   9.632
    4    HB1  ALA  39           HB2      ALA  39  27.222   7.343   9.212
    5    HB3  ALA  39           HB3      ALA  39  27.574   5.797   8.441

  No H/Q in entry =           5
  In of MODEL   38
    1    H    MET  40           H        MET  40  23.749   6.250   9.109
    2    HA   MET  40           HA       MET  40  23.312   3.545   8.371
    3    HB2  MET  40           HB2      MET  40  21.497   5.576   9.684
    4    HB3  MET  40           HB3      MET  40  21.097   3.866   9.508
    5    HG2  MET  40           HG2      MET  40  23.653   4.815  10.830
    6    HG3  MET  40           HG3      MET  40  22.168   4.530  11.735
    7    HE3  MET  40           HE1      MET  40  21.623   0.894  11.906
    8    HE2  MET  40           HE2      MET  40  20.742   2.194  11.109
    9    HE1  MET  40           HE3      MET  40  21.494   2.481  12.677

  No H/Q in entry =           9
  In of MODEL   38
    1    H    MET  41           H        MET  41  21.874   6.594   7.204
    2    HA   MET  41           HA       MET  41  19.908   5.394   5.546
    3    HB2  MET  41           HB2      MET  41  21.372   7.993   5.027
    4    HB3  MET  41           HB3      MET  41  19.840   7.494   4.320
    5    HG2  MET  41           HG2      MET  41  19.117   7.295   6.877
    6    HG3  MET  41           HG3      MET  41  20.422   8.458   7.091
    7    HE2  MET  41           HE1      MET  41  19.825   9.752   3.763
    8    HE1  MET  41           HE2      MET  41  20.791  10.193   5.168
    9    HE3  MET  41           HE3      MET  41  19.508  11.267   4.617

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ASP  42           H        ASP  42  23.271   6.336   4.966
    2    HA   ASP  42           HA       ASP  42  23.342   5.870   2.207
    3    HB2  ASP  42           HB2      ASP  42  25.103   6.871   3.964
    4    HB3  ASP  42           HB3      ASP  42  25.768   5.250   3.826

  No H/Q in entry =           4
  In of MODEL   38
    1    H    GLN  43           H        GLN  43  24.101   3.711   4.915
    2    HA   GLN  43           HA       GLN  43  24.763   1.461   3.321
    3    HB2  GLN  43           HB2      GLN  43  23.764   1.632   6.173
    4    HB3  GLN  43           HB3      GLN  43  24.344   0.148   5.409
    5    HG2  GLN  43           HG2      GLN  43  26.496   1.371   4.883
    6    HG3  GLN  43           HG3      GLN  43  25.915   2.693   5.891
    7   HE21  GLN  43          HE21      GLN  43  28.162   1.728   6.906
    8   HE22  GLN  43          HE22      GLN  43  27.904   0.641   8.182

  No H/Q in entry =           8
  In of MODEL   38
    1    H    SER  44           H        SER  44  21.713   2.576   4.735
    2    HA   SER  44           HA       SER  44  20.150   0.326   4.069
    3    HB2  SER  44           HB2      SER  44  19.705   2.849   5.226
    4    HB3  SER  44           HB3      SER  44  18.659   2.805   3.809
    5    HG   SER  44           HG       SER  44  17.585   1.851   5.539

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ARG  45           H        ARG  45  20.862   3.299   2.266
    2    HA   ARG  45           HA       ARG  45  19.320   2.812  -0.026
    3    HB2  ARG  45           HB2      ARG  45  20.458   4.952   0.554
    4    HB3  ARG  45           HB3      ARG  45  22.003   4.206   0.153
    5    HG2  ARG  45           HG2      ARG  45  21.202   3.803  -2.156
    6    HG3  ARG  45           HG3      ARG  45  19.669   4.572  -1.754
    7    HD2  ARG  45           HD2      ARG  45  20.913   6.674  -1.174
    8    HD3  ARG  45           HD3      ARG  45  22.409   5.909  -1.758
    9    HE   ARG  45           HE       ARG  45  20.462   5.667  -3.778
   10   HH21  ARG  45          HH11      ARG  45  20.433   7.041  -5.537
   11   HH22  ARG  45          HH12      ARG  45  21.183   8.595  -5.435
   12   HH11  ARG  45          HH21      ARG  45  22.194   8.170  -2.159
   13   HH12  ARG  45          HH22      ARG  45  22.179   9.233  -3.520

  No H/Q in entry =          13
  In of MODEL   38
    1    H    MET  46           H        MET  46  22.695   1.951   0.689
    2    HA   MET  46           HA       MET  46  23.284   0.768  -1.803
    3    HB2  MET  46           HB2      MET  46  24.418   0.446   0.975
    4    HB3  MET  46           HB3      MET  46  25.062  -0.450  -0.403
    5    HG2  MET  46           HG2      MET  46  25.493   1.652  -1.598
    6    HG3  MET  46           HG3      MET  46  24.796   2.569  -0.268
    7    HE1  MET  46           HE1      MET  46  27.320   0.228  -1.551
    8    HE3  MET  46           HE2      MET  46  27.414  -0.639  -0.022
    9    HE2  MET  46           HE3      MET  46  28.764   0.370  -0.540

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ALA  47           H        ALA  47  21.934  -0.579   1.181
    2    HA   ALA  47           HA       ALA  47  21.884  -3.290   0.372
    3    HB2  ALA  47           HB1      ALA  47  21.525  -2.837   2.681
    4    HB3  ALA  47           HB2      ALA  47  19.985  -3.445   2.075
    5    HB1  ALA  47           HB3      ALA  47  20.210  -1.713   2.335

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU  48           H        LEU  48  19.518  -0.672   0.043
    2    HA   LEU  48           HA       LEU  48  17.468  -2.210  -1.192
    3    HB2  LEU  48           HB2      LEU  48  18.109   0.747  -1.306
    4    HB3  LEU  48           HB3      LEU  48  16.635   0.032  -1.960
    5    HG   LEU  48           HG       LEU  48  17.517  -0.273   0.919
    6   HD13  LEU  48          HD11      LEU  48  17.088   2.026   0.742
    7   HD12  LEU  48          HD12      LEU  48  15.537   1.371   1.264
    8   HD11  LEU  48          HD13      LEU  48  15.791   1.798  -0.428
    9   HD22  LEU  48          HD21      LEU  48  15.991  -1.993   0.549
   10   HD21  LEU  48          HD22      LEU  48  15.102  -1.090  -0.679
   11   HD23  LEU  48          HD23      LEU  48  14.904  -0.691   1.027

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ASN  49           H        ASN  49  20.137  -0.269  -2.444
    2    HA   ASN  49           HA       ASN  49  19.460  -0.349  -5.161
    3    HB2  ASN  49           HB2      ASN  49  21.145   1.168  -4.235
    4    HB3  ASN  49           HB3      ASN  49  22.187  -0.195  -3.844
    5   HD21  ASN  49          HD21      ASN  49  23.122   1.859  -5.527
    6   HD22  ASN  49          HD22      ASN  49  23.290   1.254  -7.104

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLU  50           H        GLU  50  21.471  -2.541  -3.223
    2    HA   GLU  50           HA       GLU  50  22.158  -4.289  -5.360
    3    HB2  GLU  50           HB2      GLU  50  23.377  -4.264  -3.205
    4    HB3  GLU  50           HB3      GLU  50  21.944  -4.899  -2.397
    5    HG2  GLU  50           HG2      GLU  50  22.028  -6.929  -3.761
    6    HG3  GLU  50           HG3      GLU  50  23.393  -6.289  -4.674

  No H/Q in entry =           6
  In of MODEL   38
    1    H    ALA  51           H        ALA  51  19.524  -4.238  -3.008
    2    HA   ALA  51           HA       ALA  51  18.360  -6.714  -3.759
    3    HB3  ALA  51           HB1      ALA  51  16.781  -6.217  -2.187
    4    HB1  ALA  51           HB2      ALA  51  16.556  -4.570  -2.780
    5    HB2  ALA  51           HB3      ALA  51  17.927  -4.954  -1.738

  No H/Q in entry =           5
  In of MODEL   38
    1    H    HIS  52           H        HIS  52  17.752  -3.366  -4.781
    2    HA   HIS  52           HA       HIS  52  15.623  -3.896  -6.561
    3    HB2  HIS  52           HB2      HIS  52  16.198  -1.630  -5.800
    4    HB3  HIS  52           HB3      HIS  52  17.721  -1.715  -6.685
    5    HD1  HIS  52           HD1      HIS  52  17.495  -1.981  -9.358
    6    HD2  HIS  52           HD2      HIS  52  14.012  -0.870  -7.354
    7    HE1  HIS  52           HE1      HIS  52  15.910  -1.083 -11.118
    8    HE2  HIS  52           HE2      HIS  52  13.783  -0.401  -9.912

  No H/Q in entry =           8
  In of MODEL   38
    1    H    LEU  53           H        LEU  53  19.137  -3.888  -7.028
    2    HA   LEU  53           HA       LEU  53  19.168  -4.198  -9.830
    3    HB2  LEU  53           HB2      LEU  53  21.125  -4.959  -7.677
    4    HB3  LEU  53           HB3      LEU  53  21.426  -5.337  -9.371
    5    HG   LEU  53           HG       LEU  53  20.749  -2.534  -8.426
    6   HD12  LEU  53          HD11      LEU  53  23.288  -2.205  -8.791
    7   HD11  LEU  53          HD12      LEU  53  23.401  -3.957  -8.633
    8   HD13  LEU  53          HD13      LEU  53  22.780  -2.992  -7.300
    9   HD23  LEU  53          HD21      LEU  53  22.154  -2.078 -10.592
   10   HD22  LEU  53          HD22      LEU  53  20.478  -2.589 -10.763
   11   HD21  LEU  53          HD23      LEU  53  21.774  -3.746 -11.001

  No H/Q in entry =          11
  In of MODEL   38
    1    H    VAL  54           H        VAL  54  19.090  -6.590  -7.208
    2    HA   VAL  54           HA       VAL  54  19.206  -8.881  -8.873
    3    HB   VAL  54           HB       VAL  54  18.077  -8.467  -6.093
    4   HG12  VAL  54          HG11      VAL  54  18.412 -11.083  -6.097
    5   HG11  VAL  54          HG12      VAL  54  18.209 -10.912  -7.841
    6   HG13  VAL  54          HG13      VAL  54  16.929 -10.389  -6.748
    7   HG22  VAL  54          HG21      VAL  54  20.394  -8.247  -5.893
    8   HG21  VAL  54          HG22      VAL  54  20.723  -9.335  -7.240
    9   HG23  VAL  54          HG23      VAL  54  20.211  -9.987  -5.683

  No H/Q in entry =           9
  In of MODEL   38
    1    H    GLN  55           H        GLN  55  16.483  -6.992  -7.560
    2    HA   GLN  55           HA       GLN  55  14.458  -8.662  -8.617
    3    HB2  GLN  55           HB2      GLN  55  13.720  -7.143  -6.980
    4    HB3  GLN  55           HB3      GLN  55  14.499  -5.770  -7.761
    5    HG2  GLN  55           HG2      GLN  55  12.759  -5.450  -9.233
    6    HG3  GLN  55           HG3      GLN  55  12.443  -7.172  -9.403
    7   HE21  GLN  55          HE21      GLN  55  10.446  -7.731  -8.579
    8   HE22  GLN  55          HE22      GLN  55   9.682  -6.982  -7.262

  No H/Q in entry =           8
  In of MODEL   38
    1    H    THR  56           H        THR  56  16.172  -5.852  -9.988
    2    HA   THR  56           HA       THR  56  14.709  -5.493 -12.321
    3    HB   THR  56           HB       THR  56  17.713  -5.323 -11.967
    4    HG1  THR  56           HG1      THR  56  16.917  -2.993 -11.981
    5   HG21  THR  56          HG21      THR  56  15.854  -4.508 -14.186
    6   HG23  THR  56          HG22      THR  56  17.406  -5.336 -14.291
    7   HG22  THR  56          HG23      THR  56  17.349  -3.616 -13.900

  No H/Q in entry =           7
  In of MODEL   38
    1    H    LYS  57           H        LYS  57  17.375  -7.779 -11.740
    2    HA   LYS  57           HA       LYS  57  17.356  -8.969 -14.321
    3    HB2  LYS  57           HB2      LYS  57  19.164  -9.215 -12.592
    4    HB3  LYS  57           HB3      LYS  57  18.073 -10.220 -11.648
    5    HG2  LYS  57           HG2      LYS  57  18.459 -11.021 -14.479
    6    HG3  LYS  57           HG3      LYS  57  19.847 -11.237 -13.419
    7    HD2  LYS  57           HD2      LYS  57  18.450 -12.540 -11.851
    8    HD3  LYS  57           HD3      LYS  57  17.061 -12.338 -12.919
    9    HE2  LYS  57           HE2      LYS  57  18.266 -13.525 -14.723
   10    HE3  LYS  57           HE3      LYS  57  19.664 -13.733 -13.670
   11    HZ2  LYS  57           HZ1      LYS  57  17.182 -15.178 -13.726
   12    HZ1  LYS  57           HZ2      LYS  57  17.636 -14.681 -12.167
   13    HZ3  LYS  57           HZ3      LYS  57  18.690 -15.633 -13.098

  No H/Q in entry =          13
  In of MODEL   38
    1    H    LEU  58           H        LEU  58  15.608  -9.650 -11.329
    2    HA   LEU  58           HA       LEU  58  14.389 -12.028 -12.255
    3    HB2  LEU  58           HB2      LEU  58  13.607 -10.130 -10.048
    4    HB3  LEU  58           HB3      LEU  58  12.805 -11.671 -10.359
    5    HG   LEU  58           HG       LEU  58  15.782 -11.379  -9.834
    6   HD11  LEU  58          HD11      LEU  58  13.431 -11.811  -8.018
    7   HD13  LEU  58          HD12      LEU  58  14.882 -10.841  -7.768
    8   HD12  LEU  58          HD13      LEU  58  14.964 -12.597  -7.637
    9   HD22  LEU  58          HD21      LEU  58  15.664 -13.440 -10.863
   10   HD21  LEU  58          HD22      LEU  58  13.955 -13.659 -10.486
   11   HD23  LEU  58          HD23      LEU  58  15.177 -13.955  -9.249

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  59           H        ILE  59  13.694  -8.693 -12.925
    2    HA   ILE  59           HA       ILE  59  10.973  -9.354 -13.839
    3    HB   ILE  59           HB       ILE  59  11.780  -7.069 -12.639
    4   HG12  ILE  59          HG12      ILE  59   9.846  -6.952 -14.964
    5   HG13  ILE  59          HG13      ILE  59   9.448  -7.730 -13.453
    6   HG22  ILE  59          HG21      ILE  59  11.833  -6.265 -15.537
    7   HG21  ILE  59          HG22      ILE  59  13.316  -6.658 -14.696
    8   HG23  ILE  59          HG23      ILE  59  12.308  -5.323 -14.143
    9   HD13  ILE  59          HD11      ILE  59   9.854  -5.658 -12.221
   10   HD12  ILE  59          HD12      ILE  59   8.670  -5.377 -13.496
   11   HD11  ILE  59          HD13      ILE  59  10.341  -4.857 -13.714

  No H/Q in entry =          11
  In of MODEL   38
    1    H    GLU  60           H        GLU  60  14.159  -8.484 -15.128
    2    HA   GLU  60           HA       GLU  60  13.350  -8.084 -17.828
    3    HB2  GLU  60           HB2      GLU  60  15.517  -7.308 -17.111
    4    HB3  GLU  60           HB3      GLU  60  15.992  -8.931 -16.616
    5    HG2  GLU  60           HG2      GLU  60  15.183  -8.406 -19.468
    6    HG3  GLU  60           HG3      GLU  60  16.817  -8.028 -18.928

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLY  61           H        GLY  61  14.360 -10.963 -16.027
    2    HA3  GLY  61           HA2      GLY  61  13.803 -12.610 -18.426
    3    HA2  GLY  61           HA3      GLY  61  14.852 -13.088 -17.095

  No H/Q in entry =           3
  In of MODEL   38
    1    H    ASP  62           H        ASP  62  11.728 -11.557 -16.688
    2    HA   ASP  62           HA       ASP  62  10.731 -13.153 -14.727
    3    HB2  ASP  62           HB2      ASP  62   8.497 -12.435 -15.445
    4    HB3  ASP  62           HB3      ASP  62   9.646 -11.101 -15.494

  No H/Q in entry =           4
  In of MODEL   38
    1    H    ALA  63           H        ALA  63  10.799 -15.374 -14.706
    2    HA   ALA  63           HA       ALA  63  10.450 -17.031 -17.003
    3    HB2  ALA  63           HB1      ALA  63  10.262 -17.607 -14.038
    4    HB1  ALA  63           HB2      ALA  63  11.633 -17.910 -15.102
    5    HB3  ALA  63           HB3      ALA  63  10.155 -18.857 -15.276

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLY  64           H        GLY  64   8.439 -17.764 -14.292
    2    HA3  GLY  64           HA2      GLY  64   6.069 -17.316 -14.092
    3    HA2  GLY  64           HA3      GLY  64   6.001 -17.168 -15.842

  No H/Q in entry =           3
  In of MODEL   38
    1    H    GLU  65           H        GLU  65   4.186 -18.801 -14.600
    2    HA   GLU  65           HA       GLU  65   5.220 -21.523 -14.704
    3    HB2  GLU  65           HB2      GLU  65   2.521 -20.405 -13.962
    4    HB3  GLU  65           HB3      GLU  65   2.884 -22.130 -14.010
    5    HG2  GLU  65           HG2      GLU  65   4.665 -21.839 -12.364
    6    HG3  GLU  65           HG3      GLU  65   4.406 -20.095 -12.357

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLY  66           H        GLY  66   4.145 -19.412 -16.906
    2    HA3  GLY  66           HA2      GLY  66   3.708 -21.411 -18.926
    3    HA2  GLY  66           HA3      GLY  66   2.281 -20.461 -18.569

  No H/Q in entry =           3
  In of MODEL   38
    1    H    LYS  67           H        LYS  67   3.108 -20.401 -21.064
    2    HA   LYS  67           HA       LYS  67   4.986 -18.994 -22.202
    3    HB2  LYS  67           HB2      LYS  67   3.182 -17.912 -23.694
    4    HB3  LYS  67           HB3      LYS  67   3.233 -19.677 -23.585
    5    HG2  LYS  67           HG2      LYS  67   1.633 -18.415 -21.466
    6    HG3  LYS  67           HG3      LYS  67   1.000 -18.129 -23.085
    7    HD2  LYS  67           HD2      LYS  67   1.025 -20.553 -23.531
    8    HD3  LYS  67           HD3      LYS  67   1.663 -20.844 -21.910
    9    HE2  LYS  67           HE2      LYS  67  -0.755 -21.176 -21.885
   10    HE3  LYS  67           HE3      LYS  67  -0.356 -19.732 -20.955
   11    HZ1  LYS  67           HZ1      LYS  67  -0.670 -18.806 -23.491
   12    HZ3  LYS  67           HZ2      LYS  67  -1.819 -18.701 -22.246
   13    HZ2  LYS  67           HZ3      LYS  67  -1.885 -19.982 -23.361

  No H/Q in entry =          13
  In of MODEL   38
    1    H    MET  68           H        MET  68   2.286 -16.880 -22.001
    2    HA   MET  68           HA       MET  68   3.788 -14.523 -21.730
    3    HB2  MET  68           HB2      MET  68   0.848 -15.045 -21.284
    4    HB3  MET  68           HB3      MET  68   1.578 -13.444 -21.407
    5    HG2  MET  68           HG2      MET  68   1.734 -15.583 -23.548
    6    HG3  MET  68           HG3      MET  68   0.632 -14.205 -23.575
    7    HE1  MET  68           HE1      MET  68   1.154 -12.003 -23.334
    8    HE3  MET  68           HE2      MET  68   2.465 -11.181 -24.176
    9    HE2  MET  68           HE3      MET  68   2.666 -11.643 -22.488

  No H/Q in entry =           9
  In of MODEL   38
    1    H    LYS  69           H        LYS  69   2.024 -16.392 -19.247
    2    HA   LYS  69           HA       LYS  69   2.005 -14.554 -17.194
    3    HB2  LYS  69           HB2      LYS  69   0.846 -16.714 -17.133
    4    HB3  LYS  69           HB3      LYS  69   2.394 -17.536 -16.918
    5    HG2  LYS  69           HG2      LYS  69   2.790 -16.314 -14.834
    6    HG3  LYS  69           HG3      LYS  69   1.290 -15.414 -15.056
    7    HD2  LYS  69           HD2      LYS  69   0.013 -17.530 -14.942
    8    HD3  LYS  69           HD3      LYS  69   1.517 -18.416 -14.685
    9    HE2  LYS  69           HE2      LYS  69   1.935 -17.137 -12.626
   10    HE3  LYS  69           HE3      LYS  69   0.452 -16.221 -12.885
   11    HZ2  LYS  69           HZ1      LYS  69   0.728 -19.107 -12.293
   12    HZ1  LYS  69           HZ2      LYS  69  -0.713 -18.434 -12.888
   13    HZ3  LYS  69           HZ3      LYS  69  -0.092 -17.930 -11.389

  No H/Q in entry =          13
  In of MODEL   38
    1    H    VAL  70           H        VAL  70   3.234 -14.168 -15.291
    2    HA   VAL  70           HA       VAL  70   6.135 -14.725 -15.574
    3    HB   VAL  70           HB       VAL  70   6.461 -12.607 -14.307
    4   HG12  VAL  70          HG11      VAL  70   4.758 -12.305 -16.801
    5   HG11  VAL  70          HG12      VAL  70   6.487 -12.656 -16.796
    6   HG13  VAL  70          HG13      VAL  70   5.900 -11.115 -16.173
    7   HG23  VAL  70          HG21      VAL  70   4.438 -11.069 -14.161
    8   HG22  VAL  70          HG22      VAL  70   4.379 -12.463 -13.084
    9   HG21  VAL  70          HG23      VAL  70   3.433 -12.460 -14.572

  No H/Q in entry =           9
  In of MODEL   38
    1    H    SER  71           H        SER  71   7.291 -14.644 -13.433
    2    HA   SER  71           HA       SER  71   6.321 -16.601 -11.649
    3    HB2  SER  71           HB2      SER  71   8.727 -15.963 -11.924
    4    HB3  SER  71           HB3      SER  71   8.385 -14.459 -11.072
    5    HG   SER  71           HG       SER  71   8.145 -17.124 -10.126

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU  72           H        LEU  72   4.935 -16.478 -10.008
    2    HA   LEU  72           HA       LEU  72   3.378 -14.174  -9.544
    3    HB2  LEU  72           HB2      LEU  72   3.694 -16.734  -7.985
    4    HB3  LEU  72           HB3      LEU  72   2.525 -15.483  -7.566
    5    HG   LEU  72           HG       LEU  72   2.652 -16.744 -10.324
    6   HD12  LEU  72          HD11      LEU  72   0.599 -18.013  -9.491
    7   HD11  LEU  72          HD12      LEU  72   1.086 -17.545  -7.863
    8   HD13  LEU  72          HD13      LEU  72   2.149 -18.553  -8.844
    9   HD23  LEU  72          HD21      LEU  72   0.159 -15.977 -10.174
   10   HD22  LEU  72          HD22      LEU  72   1.375 -14.745 -10.472
   11   HD21  LEU  72          HD23      LEU  72   0.709 -14.952  -8.855

  No H/Q in entry =          11
  In of MODEL   38
    1    H    VAL  73           H        VAL  73   6.058 -15.601  -7.799
    2    HA   VAL  73           HA       VAL  73   6.012 -14.073  -5.463
    3    HB   VAL  73           HB       VAL  73   8.202 -14.873  -5.057
    4   HG13  VAL  73          HG11      VAL  73   7.898 -17.194  -5.340
    5   HG12  VAL  73          HG12      VAL  73   7.078 -16.988  -6.889
    6   HG11  VAL  73          HG13      VAL  73   6.256 -16.555  -5.390
    7   HG22  VAL  73          HG21      VAL  73   9.517 -14.292  -6.887
    8   HG21  VAL  73          HG22      VAL  73   8.356 -14.926  -8.052
    9   HG23  VAL  73          HG23      VAL  73   9.368 -16.033  -7.125

  No H/Q in entry =           9
  In of MODEL   38
    1    H    LEU  74           H        LEU  74   6.968 -13.168  -8.646
    2    HA   LEU  74           HA       LEU  74   8.908 -11.210  -8.166
    3    HB2  LEU  74           HB2      LEU  74   8.436 -11.957 -10.402
    4    HB3  LEU  74           HB3      LEU  74   6.768 -11.397 -10.285
    5    HG   LEU  74           HG       LEU  74   7.567  -9.066 -10.069
    6   HD12  LEU  74          HD11      LEU  74  10.053  -8.751 -10.687
    7   HD11  LEU  74          HD12      LEU  74  10.253 -10.442 -10.233
    8   HD13  LEU  74          HD13      LEU  74   9.701  -9.269  -9.039
    9   HD23  LEU  74          HD21      LEU  74   9.012 -10.154 -12.429
   10   HD22  LEU  74          HD22      LEU  74   7.871  -8.834 -12.310
   11   HD21  LEU  74          HD23      LEU  74   7.286 -10.482 -12.290

  No H/Q in entry =          11
  In of MODEL   38
    1    H    VAL  75           H        VAL  75   5.407 -10.842  -8.488
    2    HA   VAL  75           HA       VAL  75   5.303  -8.088  -7.894
    3    HB   VAL  75           HB       VAL  75   3.225 -10.240  -7.488
    4   HG11  VAL  75          HG11      VAL  75   3.030  -7.201  -7.332
    5   HG13  VAL  75          HG12      VAL  75   2.737  -8.338  -6.024
    6   HG12  VAL  75          HG13      VAL  75   1.645  -8.285  -7.399
    7   HG22  VAL  75          HG21      VAL  75   3.900  -9.893  -9.820
    8   HG21  VAL  75          HG22      VAL  75   3.713  -8.150  -9.639
    9   HG23  VAL  75          HG23      VAL  75   2.299  -9.202  -9.569

  No H/Q in entry =           9
  In of MODEL   38
    1    H    GLU  76           H        GLU  76   5.081 -10.970  -5.789
    2    HA   GLU  76           HA       GLU  76   4.625  -9.617  -3.360
    3    HB2  GLU  76           HB2      GLU  76   4.456 -12.081  -3.589
    4    HB3  GLU  76           HB3      GLU  76   6.188 -12.176  -3.860
    5    HG2  GLU  76           HG2      GLU  76   5.786 -12.763  -1.556
    6    HG3  GLU  76           HG3      GLU  76   6.534 -11.177  -1.555

  No H/Q in entry =           6
  In of MODEL   38
    1    H    ALA  77           H        ALA  77   7.676 -10.506  -4.951
    2    HA   ALA  77           HA       ALA  77   9.377  -9.459  -2.947
    3    HB1  ALA  77           HB1      ALA  77  10.385 -10.916  -4.507
    4    HB2  ALA  77           HB2      ALA  77  11.046  -9.328  -4.900
    5    HB3  ALA  77           HB3      ALA  77   9.754 -10.014  -5.885

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLN  78           H        GLN  78   7.954  -8.042  -5.847
    2    HA   GLN  78           HA       GLN  78   9.296  -5.556  -5.748
    3    HB2  GLN  78           HB2      GLN  78   7.921  -6.546  -7.666
    4    HB3  GLN  78           HB3      GLN  78   6.492  -6.003  -6.787
    5    HG2  GLN  78           HG2      GLN  78   7.233  -3.704  -6.880
    6    HG3  GLN  78           HG3      GLN  78   8.780  -4.184  -7.579
    7   HE21  GLN  78          HE21      GLN  78   8.272  -5.775  -9.665
    8   HE22  GLN  78          HE22      GLN  78   7.171  -5.090 -10.760

  No H/Q in entry =           8
  In of MODEL   38
    1    H    LEU  79           H        LEU  79   6.294  -6.711  -4.296
    2    HA   LEU  79           HA       LEU  79   5.298  -4.310  -3.274
    3    HB2  LEU  79           HB2      LEU  79   3.992  -6.367  -3.212
    4    HB3  LEU  79           HB3      LEU  79   5.149  -7.104  -2.107
    5    HG   LEU  79           HG       LEU  79   4.604  -5.468  -0.373
    6   HD13  LEU  79          HD11      LEU  79   4.121  -3.453  -1.415
    7   HD12  LEU  79          HD12      LEU  79   2.502  -3.987  -0.964
    8   HD11  LEU  79          HD13      LEU  79   3.070  -4.203  -2.618
    9   HD23  LEU  79          HD21      LEU  79   2.020  -5.971  -0.263
   10   HD22  LEU  79          HD22      LEU  79   3.166  -7.306  -0.166
   11   HD21  LEU  79          HD23      LEU  79   2.339  -6.969  -1.684

  No H/Q in entry =          11
  In of MODEL   38
    1    H    HIS  80           H        HIS  80   7.502  -6.639  -1.713
    2    HA   HIS  80           HA       HIS  80   7.802  -5.101   0.657
    3    HB2  HIS  80           HB2      HIS  80   9.141  -7.457  -0.557
    4    HB3  HIS  80           HB3      HIS  80  10.057  -6.559   0.655
    5    HD1  HIS  80           HD1      HIS  80   9.586  -7.202   3.000
    6    HD2  HIS  80           HD2      HIS  80   6.354  -8.060   0.510
    7    HE1  HIS  80           HE1      HIS  80   7.830  -8.316   4.459
    8    HE2  HIS  80           HE2      HIS  80   5.853  -8.843   2.950

  No H/Q in entry =           8
  In of MODEL   38
    1    H    LEU  81           H        LEU  81   9.787  -5.363  -2.271
    2    HA   LEU  81           HA       LEU  81  11.831  -3.616  -1.403
    3    HB2  LEU  81           HB2      LEU  81  10.892  -4.406  -4.161
    4    HB3  LEU  81           HB3      LEU  81  12.310  -3.395  -3.879
    5    HG   LEU  81           HG       LEU  81  11.937  -6.121  -2.609
    6   HD12  LEU  81          HD11      LEU  81  13.742  -6.737  -4.373
    7   HD11  LEU  81          HD12      LEU  81  13.165  -5.313  -5.238
    8   HD13  LEU  81          HD13      LEU  81  12.061  -6.642  -4.894
    9   HD23  LEU  81          HD21      LEU  81  14.564  -5.796  -2.613
   10   HD22  LEU  81          HD22      LEU  81  13.589  -5.042  -1.354
   11   HD21  LEU  81          HD23      LEU  81  14.154  -4.085  -2.723

  No H/Q in entry =          11
  In of MODEL   38
    1    H    MET  82           H        MET  82   8.891  -2.986  -3.317
    2    HA   MET  82           HA       MET  82   9.418  -0.257  -3.816
    3    HB2  MET  82           HB2      MET  82   6.865  -1.860  -3.676
    4    HB3  MET  82           HB3      MET  82   6.857  -0.135  -4.036
    5    HG2  MET  82           HG2      MET  82   8.453  -2.199  -5.588
    6    HG3  MET  82           HG3      MET  82   6.880  -1.581  -6.088
    7    HE3  MET  82           HE1      MET  82   7.309   1.878  -7.255
    8    HE2  MET  82           HE2      MET  82   6.947   1.647  -5.546
    9    HE1  MET  82           HE3      MET  82   6.277   0.538  -6.738

  No H/Q in entry =           9
  In of MODEL   38
    1    H    THR  83           H        THR  83   7.651  -1.867  -1.202
    2    HA   THR  83           HA       THR  83   6.802   0.476   0.136
    3    HB   THR  83           HB       THR  83   6.687  -1.103   2.151
    4    HG1  THR  83           HG1      THR  83   7.448  -3.051   1.912
    5   HG22  THR  83          HG21      THR  83   5.028  -2.671   0.692
    6   HG21  THR  83          HG22      THR  83   5.242  -1.339  -0.439
    7   HG23  THR  83          HG23      THR  83   4.613  -1.030   1.180

  No H/Q in entry =           7
  In of MODEL   38
    1    H    SER  84           H        SER  84   9.636  -1.615   0.632
    2    HA   SER  84           HA       SER  84  10.707  -0.186   2.815
    3    HB2  SER  84           HB2      SER  84  11.951  -2.021   0.777
    4    HB3  SER  84           HB3      SER  84  12.904  -1.267   2.054
    5    HG   SER  84           HG       SER  84  10.636  -2.964   2.326

  No H/Q in entry =           5
  In of MODEL   38
    1    H    MET  85           H        MET  85  11.434   0.085  -0.677
    2    HA   MET  85           HA       MET  85  13.429   2.055  -0.436
    3    HB2  MET  85           HB2      MET  85  13.024   0.778  -2.502
    4    HB3  MET  85           HB3      MET  85  11.491   1.623  -2.717
    5    HG2  MET  85           HG2      MET  85  12.675   3.775  -2.849
    6    HG3  MET  85           HG3      MET  85  14.211   2.954  -2.593
    7    HE3  MET  85           HE1      MET  85  15.396   1.908  -5.866
    8    HE2  MET  85           HE2      MET  85  15.321   1.285  -4.220
    9    HE1  MET  85           HE3      MET  85  15.676   2.987  -4.490

  No H/Q in entry =           9
  In of MODEL   38
    1    H    LEU  86           H        LEU  86   9.935   2.382  -0.919
    2    HA   LEU  86           HA       LEU  86   9.862   5.195  -1.094
    3    HB2  LEU  86           HB2      LEU  86   8.018   3.532  -1.661
    4    HB3  LEU  86           HB3      LEU  86   7.701   3.438   0.071
    5    HG   LEU  86           HG       LEU  86   7.534   5.998   0.026
    6   HD11  LEU  86          HD11      LEU  86   8.291   5.570  -2.683
    7   HD13  LEU  86          HD12      LEU  86   7.857   7.095  -1.916
    8   HD12  LEU  86          HD13      LEU  86   6.617   6.131  -2.714
    9   HD23  LEU  86          HD21      LEU  86   5.391   4.644  -1.624
   10   HD22  LEU  86          HD22      LEU  86   5.207   5.901  -0.404
   11   HD21  LEU  86          HD23      LEU  86   5.614   4.256   0.082

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ALA  87           H        ALA  87   9.421   3.009   1.650
    2    HA   ALA  87           HA       ALA  87   8.883   4.918   3.628
    3    HB1  ALA  87           HB1      ALA  87   9.696   2.100   3.529
    4    HB3  ALA  87           HB2      ALA  87   8.577   2.907   4.625
    5    HB2  ALA  87           HB3      ALA  87  10.308   2.941   4.956

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ARG  88           H        ARG  88  11.962   3.502   2.621
    2    HA   ARG  88           HA       ARG  88  13.582   4.880   4.445
    3    HB2  ARG  88           HB2      ARG  88  14.244   2.911   3.032
    4    HB3  ARG  88           HB3      ARG  88  14.384   4.007   1.661
    5    HG2  ARG  88           HG2      ARG  88  15.869   5.320   3.599
    6    HG3  ARG  88           HG3      ARG  88  16.196   3.630   3.972
    7    HD2  ARG  88           HD2      ARG  88  17.450   3.340   2.115
    8    HD3  ARG  88           HD3      ARG  88  16.304   4.212   1.092
    9    HE   ARG  88           HE       ARG  88  18.704   5.278   2.124
   10   HH21  ARG  88          HH11      ARG  88  19.043   7.498   1.932
   11   HH22  ARG  88          HH12      ARG  88  17.689   8.567   1.801
   12   HH11  ARG  88          HH21      ARG  88  15.361   6.025   1.872
   13   HH12  ARG  88          HH22      ARG  88  15.602   7.730   1.743

  No H/Q in entry =          13
  In of MODEL   38
    1    H    GLU  89           H        GLU  89  12.582   5.783   1.131
    2    HA   GLU  89           HA       GLU  89  14.123   8.147   0.968
    3    HB2  GLU  89           HB2      GLU  89  12.966   7.107  -0.973
    4    HB3  GLU  89           HB3      GLU  89  11.425   7.644  -0.303
    5    HG2  GLU  89           HG2      GLU  89  12.121   9.983  -0.465
    6    HG3  GLU  89           HG3      GLU  89  13.722   9.497  -1.015

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LEU  90           H        LEU  90  10.803   7.627   2.122
    2    HA   LEU  90           HA       LEU  90  10.287  10.358   2.707
    3    HB2  LEU  90           HB2      LEU  90   9.105   7.780   3.737
    4    HB3  LEU  90           HB3      LEU  90   8.474   9.373   4.168
    5    HG   LEU  90           HG       LEU  90   8.873   8.500   1.295
    6   HD12  LEU  90          HD11      LEU  90   6.340   8.166   1.375
    7   HD11  LEU  90          HD12      LEU  90   6.508   8.152   3.131
    8   HD13  LEU  90          HD13      LEU  90   7.322   6.926   2.157
    9   HD22  LEU  90          HD21      LEU  90   8.573  10.808   1.228
   10   HD21  LEU  90          HD22      LEU  90   7.598  10.835   2.696
   11   HD23  LEU  90          HD23      LEU  90   6.890  10.282   1.179

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  91           H        ILE  91  11.570   7.675   4.613
    2    HA   ILE  91           HA       ILE  91  11.726   9.035   7.084
    3    HB   ILE  91           HB       ILE  91  13.277   6.703   5.943
    4   HG12  ILE  91          HG12      ILE  91  11.277   6.861   8.218
    5   HG13  ILE  91          HG13      ILE  91  10.795   6.582   6.546
    6   HG22  ILE  91          HG21      ILE  91  13.767   6.484   8.579
    7   HG21  ILE  91          HG22      ILE  91  13.687   8.243   8.483
    8   HG23  ILE  91          HG23      ILE  91  14.860   7.360   7.507
    9   HD13  ILE  91          HD11      ILE  91  11.801   4.483   6.463
   10   HD12  ILE  91          HD12      ILE  91  11.220   4.536   8.127
   11   HD11  ILE  91          HD13      ILE  91  12.919   4.854   7.777

  No H/Q in entry =          11
  In of MODEL   38
    1    H    THR  92           H        THR  92  13.922   8.877   4.315
    2    HA   THR  92           HA       THR  92  16.093  10.272   5.460
    3    HB   THR  92           HB       THR  92  15.086  10.152   2.607
    4    HG1  THR  92           HG1      THR  92  15.925   8.255   3.001
    5   HG22  THR  92          HG21      THR  92  17.652  10.848   2.295
    6   HG21  THR  92          HG22      THR  92  17.354  11.665   3.829
    7   HG23  THR  92          HG23      THR  92  16.372  12.054   2.417

  No H/Q in entry =           7
  In of MODEL   38
    1    H    GLU  93           H        GLU  93  13.191  11.423   3.756
    2    HA   GLU  93           HA       GLU  93  13.780  14.185   3.872
    3    HB2  GLU  93           HB2      GLU  93  11.079  12.806   3.904
    4    HB3  GLU  93           HB3      GLU  93  11.360  14.507   3.534
    5    HG2  GLU  93           HG2      GLU  93  12.691  12.272   1.991
    6    HG3  GLU  93           HG3      GLU  93  11.140  12.952   1.517

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LEU  94           H        LEU  94  12.059  12.020   6.092
    2    HA   LEU  94           HA       LEU  94  11.260  13.960   7.979
    3    HB2  LEU  94           HB2      LEU  94  11.845  11.006   8.242
    4    HB3  LEU  94           HB3      LEU  94  11.281  11.977   9.599
    5    HG   LEU  94           HG       LEU  94   9.777  12.032   6.982
    6   HD11  LEU  94          HD11      LEU  94   9.880   9.806   8.980
    7   HD13  LEU  94          HD12      LEU  94   9.565   9.748   7.248
    8   HD12  LEU  94          HD13      LEU  94   8.294  10.259   8.357
    9   HD23  LEU  94          HD21      LEU  94   7.869  12.423   8.598
   10   HD22  LEU  94          HD22      LEU  94   9.105  13.680   8.628
   11   HD21  LEU  94          HD23      LEU  94   9.055  12.460   9.900

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  95           H        ILE  95  14.236  12.038   7.714
    2    HA   ILE  95           HA       ILE  95  15.421  12.957  10.121
    3    HB   ILE  95           HB       ILE  95  16.642  11.897   7.561
    4   HG12  ILE  95          HG12      ILE  95  16.371  10.689  10.328
    5   HG13  ILE  95          HG13      ILE  95  15.194  10.431   9.041
    6   HG21  ILE  95          HG21      ILE  95  17.916  12.701  10.195
    7   HG23  ILE  95          HG22      ILE  95  18.365  13.233   8.573
    8   HG22  ILE  95          HG23      ILE  95  18.679  11.573   9.075
    9   HD13  ILE  95          HD11      ILE  95  16.667   9.159   7.764
   10   HD12  ILE  95          HD12      ILE  95  17.154   8.707   9.395
   11   HD11  ILE  95          HD13      ILE  95  18.097   9.891   8.491

  No H/Q in entry =          11
  In of MODEL   38
    1    H    GLU  96           H        GLU  96  15.546  14.199   6.788
    2    HA   GLU  96           HA       GLU  96  17.392  16.280   7.255
    3    HB2  GLU  96           HB2      GLU  96  16.711  15.622   5.000
    4    HB3  GLU  96           HB3      GLU  96  15.069  16.174   5.315
    5    HG2  GLU  96           HG2      GLU  96  15.626  18.306   4.773
    6    HG3  GLU  96           HG3      GLU  96  16.934  18.307   5.945

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LEU  97           H        LEU  97  13.885  16.085   7.712
    2    HA   LEU  97           HA       LEU  97  13.467  18.816   8.364
    3    HB2  LEU  97           HB2      LEU  97  11.960  16.285   8.984
    4    HB3  LEU  97           HB3      LEU  97  11.449  17.830   9.663
    5    HG   LEU  97           HG       LEU  97  11.909  17.422   6.693
    6   HD12  LEU  97          HD11      LEU  97   9.385  17.288   6.595
    7   HD11  LEU  97          HD12      LEU  97   9.393  17.085   8.345
    8   HD13  LEU  97          HD13      LEU  97  10.168  15.881   7.314
    9   HD23  LEU  97          HD21      LEU  97  10.167  19.382   6.745
   10   HD22  LEU  97          HD22      LEU  97  11.851  19.744   7.124
   11   HD21  LEU  97          HD23      LEU  97  10.673  19.568   8.423

  No H/Q in entry =          11
  In of MODEL   38
    1    H    HIS  98           H        HIS  98  14.311  15.987  10.346
    2    HA   HIS  98           HA       HIS  98  14.171  17.242  12.866
    3    HB2  HIS  98           HB2      HIS  98  15.917  14.990  11.845
    4    HB3  HIS  98           HB3      HIS  98  15.928  15.525  13.528
    5    HD1  HIS  98           HD1      HIS  98  13.712  13.897  10.950
    6    HD2  HIS  98           HD2      HIS  98  13.635  14.807  15.017
    7    HE1  HIS  98           HE1      HIS  98  11.697  12.696  11.916
    8    HE2  HIS  98           HE2      HIS  98  11.631  13.242  14.389

  No H/Q in entry =           8
  In of MODEL   38
    1    H    GLU  99           H        GLU  99  16.705  17.137  10.411
    2    HA   GLU  99           HA       GLU  99  18.700  18.469  11.927
    3    HB2  GLU  99           HB2      GLU  99  19.165  17.188   9.851
    4    HB3  GLU  99           HB3      GLU  99  18.345  18.443   8.919
    5    HG2  GLU  99           HG2      GLU  99  19.956  20.115   9.701
    6    HG3  GLU  99           HG3      GLU  99  20.746  18.912  10.715

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LYS 100           H        LYS 100  16.156  19.632   9.734
    2    HA   LYS 100           HA       LYS 100  16.950  22.371   9.878
    3    HB2  LYS 100           HB2      LYS 100  14.313  21.078   9.141
    4    HB3  LYS 100           HB3      LYS 100  14.609  22.818   9.053
    5    HG2  LYS 100           HG2      LYS 100  16.570  22.376   7.569
    6    HG3  LYS 100           HG3      LYS 100  16.159  20.658   7.586
    7    HD2  LYS 100           HD2      LYS 100  13.955  21.166   6.605
    8    HD3  LYS 100           HD3      LYS 100  14.349  22.886   6.595
    9    HE2  LYS 100           HE2      LYS 100  16.297  22.412   5.118
   10    HE3  LYS 100           HE3      LYS 100  15.834  20.707   5.085
   11    HZ1  LYS 100           HZ1      LYS 100  13.999  22.899   4.270
   12    HZ3  LYS 100           HZ2      LYS 100  13.815  21.229   4.005
   13    HZ2  LYS 100           HZ3      LYS 100  15.018  22.095   3.176

  No H/Q in entry =          13
  In of MODEL   38
    1    H    LEU 101           H        LEU 101  14.872  20.316  11.855
    2    HA   LEU 101           HA       LEU 101  13.715  22.379  13.448
    3    HB2  LEU 101           HB2      LEU 101  14.165  19.429  13.821
    4    HB3  LEU 101           HB3      LEU 101  13.639  20.405  15.188
    5    HG   LEU 101           HG       LEU 101  12.199  20.498  12.531
    6   HD12  LEU 101          HD11      LEU 101  10.552  18.928  13.810
    7   HD11  LEU 101          HD12      LEU 101  11.956  18.515  14.792
    8   HD13  LEU 101          HD13      LEU 101  11.975  18.212  13.054
    9   HD21  LEU 101          HD21      LEU 101  11.564  21.283  15.391
   10   HD23  LEU 101          HD22      LEU 101  10.293  21.058  14.190
   11   HD22  LEU 101          HD23      LEU 101  11.524  22.295  13.945

  No H/Q in entry =          11
  In of MODEL   38
    1    H    LYS 102           H        LYS 102  16.860  21.777  12.984
    2    HA   LYS 102           HA       LYS 102  18.714  22.648  14.043
    3    HB2  LYS 102           HB2      LYS 102  16.907  24.157  15.195
    4    HB3  LYS 102           HB3      LYS 102  17.127  23.091  16.568
    5    HG2  LYS 102           HG2      LYS 102  19.007  25.108  15.388
    6    HG3  LYS 102           HG3      LYS 102  18.640  24.789  17.069
    7    HD2  LYS 102           HD2      LYS 102  20.295  22.883  15.365
    8    HD3  LYS 102           HD3      LYS 102  20.991  24.204  16.295
    9    HE2  LYS 102           HE2      LYS 102  20.604  21.652  17.261
   10    HE3  LYS 102           HE3      LYS 102  20.829  23.092  18.254
   11    HZ2  LYS 102           HZ1      LYS 102  18.867  21.804  18.885
   12    HZ1  LYS 102           HZ2      LYS 102  18.210  22.037  17.342
   13    HZ3  LYS 102           HZ3      LYS 102  18.447  23.364  18.369

  No H/Q in entry =          13
  In of MODEL   38
    1    H    ALA 103           H        ALA 103  16.664  21.033  16.478
    2    HA   ALA 103           HA       ALA 103  18.407  19.821  18.116
    3    HB2  ALA 103           HB1      ALA 103  16.825  17.811  18.118
    4    HB1  ALA 103           HB2      ALA 103  15.918  18.667  16.870
    5    HB3  ALA 103           HB3      ALA 103  16.108  19.384  18.469

  No H/Q in entry =           5
  In of MODEL   38
    1    H1   ALA   1           H3       ALA   1  -1.814  -6.959 -21.407
    2    H2   ALA   1           H2       ALA   1  -2.603  -8.397 -20.951
    3    H3   ALA   1           H1       ALA   1  -1.000  -8.443 -21.519
    4    HA   ALA   1           HA       ALA   1  -1.850  -8.908 -23.509
    5    HB1  ALA   1           HB1      ALA   1  -3.982  -9.630 -23.020
    6    HB2  ALA   1           HB2      ALA   1  -4.429  -8.117 -23.810
    7    HB3  ALA   1           HB3      ALA   1  -4.354  -8.202 -22.052

  No H/Q in entry =           7
  In of MODEL   38
    1    H    GLU   2           H        GLU   2  -2.697  -7.714 -25.489
    2    HA   GLU   2           HA       GLU   2  -1.307  -5.696 -26.373
    3    HB2  GLU   2           HB2      GLU   2  -4.317  -5.765 -26.666
    4    HB3  GLU   2           HB3      GLU   2  -3.205  -4.898 -27.722
    5    HG2  GLU   2           HG2      GLU   2  -2.709  -6.785 -28.886
    6    HG3  GLU   2           HG3      GLU   2  -2.400  -7.694 -27.413

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLU   3           H        GLU   3  -4.461  -4.444 -25.444
    2    HA   GLU   3           HA       GLU   3  -3.411  -1.889 -24.817
    3    HB2  GLU   3           HB2      GLU   3  -6.096  -3.207 -24.467
    4    HB3  GLU   3           HB3      GLU   3  -5.794  -1.593 -23.819
    5    HG2  GLU   3           HG2      GLU   3  -5.455  -0.660 -25.945
    6    HG3  GLU   3           HG3      GLU   3  -5.065  -2.213 -26.677

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LEU   4           H        LEU   4  -4.983  -4.255 -22.631
    2    HA   LEU   4           HA       LEU   4  -4.600  -3.033 -20.239
    3    HB2  LEU   4           HB2      LEU   4  -4.058  -5.973 -20.721
    4    HB3  LEU   4           HB3      LEU   4  -4.453  -5.231 -19.172
    5    HG   LEU   4           HG       LEU   4  -6.245  -5.299 -21.622
    6   HD13  LEU   4          HD11      LEU   4  -7.429  -7.020 -20.620
    7   HD12  LEU   4          HD12      LEU   4  -6.931  -6.565 -18.991
    8   HD11  LEU   4          HD13      LEU   4  -5.803  -7.404 -20.054
    9   HD23  LEU   4          HD21      LEU   4  -7.915  -4.494 -19.739
   10   HD22  LEU   4          HD22      LEU   4  -6.884  -3.320 -20.555
   11   HD21  LEU   4          HD23      LEU   4  -6.445  -3.914 -18.954

  No H/Q in entry =          11
  In of MODEL   38
    1    H    GLU   5           H        GLU   5  -2.114  -4.869 -21.995
    2    HA   GLU   5           HA       GLU   5  -0.115  -4.590 -19.974
    3    HB2  GLU   5           HB2      GLU   5  -0.069  -6.353 -21.738
    4    HB3  GLU   5           HB3      GLU   5   0.249  -5.102 -22.939
    5    HG2  GLU   5           HG2      GLU   5   2.317  -4.480 -21.771
    6    HG3  GLU   5           HG3      GLU   5   1.999  -5.694 -20.533

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLU   6           H        GLU   6  -0.775  -2.868 -23.009
    2    HA   GLU   6           HA       GLU   6   1.395  -1.036 -22.753
    3    HB2  GLU   6           HB2      GLU   6   0.249  -1.515 -24.906
    4    HB3  GLU   6           HB3      GLU   6  -1.197  -0.716 -24.287
    5    HG2  GLU   6           HG2      GLU   6   0.022   0.896 -25.609
    6    HG3  GLU   6           HG3      GLU   6   0.196   1.349 -23.916

  No H/Q in entry =           6
  In of MODEL   38
    1    H    VAL   7           H        VAL   7  -1.935  -1.112 -21.682
    2    HA   VAL   7           HA       VAL   7  -2.151   1.598 -20.836
    3    HB   VAL   7           HB       VAL   7  -3.605  -0.923 -19.995
    4   HG11  VAL   7          HG11      VAL   7  -3.975   1.963 -19.170
    5   HG13  VAL   7          HG12      VAL   7  -3.867   0.536 -18.140
    6   HG12  VAL   7          HG13      VAL   7  -5.307   0.807 -19.120
    7   HG21  VAL   7          HG21      VAL   7  -3.782   0.159 -22.379
    8   HG23  VAL   7          HG22      VAL   7  -4.722   1.405 -21.556
    9   HG22  VAL   7          HG23      VAL   7  -5.266  -0.272 -21.530

  No H/Q in entry =           9
  In of MODEL   38
    1    H    VAL   8           H        VAL   8  -1.149  -1.391 -19.209
    2    HA   VAL   8           HA       VAL   8  -0.810  -0.319 -16.613
    3    HB   VAL   8           HB       VAL   8   0.578  -2.631 -17.989
    4   HG12  VAL   8          HG11      VAL   8   0.980  -3.282 -15.504
    5   HG11  VAL   8          HG12      VAL   8   0.711  -1.572 -15.168
    6   HG13  VAL   8          HG13      VAL   8   2.035  -2.066 -16.223
    7   HG22  VAL   8          HG21      VAL   8  -1.191  -3.941 -17.291
    8   HG21  VAL   8          HG22      VAL   8  -2.059  -2.411 -17.250
    9   HG23  VAL   8          HG23      VAL   8  -1.363  -3.065 -15.771

  No H/Q in entry =           9
  In of MODEL   38
    1    H    MET   9           H        MET   9   1.417  -0.611 -19.379
    2    HA   MET   9           HA       MET   9   3.712   0.430 -18.134
    3    HB2  MET   9           HB2      MET   9   2.741   0.461 -20.989
    4    HB3  MET   9           HB3      MET   9   4.258   1.231 -20.525
    5    HG2  MET   9           HG2      MET   9   5.097  -0.879 -19.625
    6    HG3  MET   9           HG3      MET   9   3.554  -1.666 -19.967
    7    HE1  MET   9           HE1      MET   9   6.486   0.234 -21.156
    8    HE3  MET   9           HE2      MET   9   5.510   0.985 -22.415
    9    HE2  MET   9           HE3      MET   9   6.754  -0.181 -22.853

  No H/Q in entry =           9
  In of MODEL   38
    1    H    GLY  10           H        GLY  10   1.014   2.036 -19.785
    2    HA3  GLY  10           HA2      GLY  10   1.980   4.689 -19.541
    3    HA2  GLY  10           HA3      GLY  10   0.289   4.230 -19.733

  No H/Q in entry =           3
  In of MODEL   38
    1    H    LEU  11           H        LEU  11  -0.092   2.696 -17.448
    2    HA   LEU  11           HA       LEU  11  -0.605   4.667 -15.478
    3    HB2  LEU  11           HB2      LEU  11  -0.538   1.651 -15.331
    4    HB3  LEU  11           HB3      LEU  11  -1.035   2.671 -13.982
    5    HG   LEU  11           HG       LEU  11  -2.297   2.793 -16.734
    6   HD13  LEU  11          HD11      LEU  11  -2.875   0.647 -15.980
    7   HD12  LEU  11          HD12      LEU  11  -4.220   1.638 -15.421
    8   HD11  LEU  11          HD13      LEU  11  -2.955   1.154 -14.293
    9   HD22  LEU  11          HD21      LEU  11  -2.878   4.806 -15.717
   10   HD21  LEU  11          HD22      LEU  11  -2.790   4.135 -14.089
   11   HD23  LEU  11          HD23      LEU  11  -4.174   3.772 -15.120

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  12           H        ILE  12   1.934   2.201 -15.749
    2    HA   ILE  12           HA       ILE  12   3.161   2.730 -13.255
    3    HB   ILE  12           HB       ILE  12   4.393   1.697 -15.831
    4   HG12  ILE  12          HG12      ILE  12   2.389   0.464 -14.672
    5   HG13  ILE  12          HG13      ILE  12   3.783  -0.471 -15.174
    6   HG22  ILE  12          HG21      ILE  12   6.082   0.667 -14.262
    7   HG21  ILE  12          HG22      ILE  12   5.393   1.642 -12.964
    8   HG23  ILE  12          HG23      ILE  12   6.158   2.425 -14.346
    9   HD11  ILE  12          HD11      ILE  12   3.360   0.627 -12.383
   10   HD13  ILE  12          HD12      ILE  12   4.625  -0.485 -12.902
   11   HD12  ILE  12          HD13      ILE  12   2.956  -1.008 -12.875

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  13           H        ILE  13   3.735   4.003 -16.513
    2    HA   ILE  13           HA       ILE  13   5.880   5.720 -15.802
    3    HB   ILE  13           HB       ILE  13   3.829   5.814 -18.029
    4   HG12  ILE  13          HG12      ILE  13   5.630   3.952 -17.792
    5   HG13  ILE  13          HG13      ILE  13   5.422   4.732 -19.356
    6   HG23  ILE  13          HG21      ILE  13   4.563   8.084 -17.763
    7   HG22  ILE  13          HG22      ILE  13   5.453   7.430 -19.134
    8   HG21  ILE  13          HG23      ILE  13   6.246   7.592 -17.568
    9   HD12  ILE  13          HD11      ILE  13   7.853   4.445 -18.215
   10   HD11  ILE  13          HD12      ILE  13   7.379   5.975 -17.486
   11   HD13  ILE  13          HD13      ILE  13   7.446   5.821 -19.237

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ASN  14           H        ASN  14   2.371   6.217 -16.037
    2    HA   ASN  14           HA       ASN  14   2.336   8.961 -15.392
    3    HB2  ASN  14           HB2      ASN  14   0.435   7.323 -16.211
    4    HB3  ASN  14           HB3      ASN  14   0.128   7.140 -14.488
    5   HD21  ASN  14          HD21      ASN  14  -1.903   8.301 -15.900
    6   HD22  ASN  14          HD22      ASN  14  -1.962   9.974 -15.627

  No H/Q in entry =           6
  In of MODEL   38
    1    H    SER  15           H        SER  15   2.058   6.079 -13.321
    2    HA   SER  15           HA       SER  15   1.773   7.442 -10.867
    3    HB2  SER  15           HB2      SER  15   2.334   5.353  -9.828
    4    HB3  SER  15           HB3      SER  15   1.486   4.940 -11.313
    5    HG   SER  15           HG       SER  15   4.215   4.770 -10.694

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLY  16           H        GLY  16   4.633   6.349 -12.654
    2    HA3  GLY  16           HA2      GLY  16   6.575   7.100 -10.738
    3    HA2  GLY  16           HA3      GLY  16   6.863   6.902 -12.465

  No H/Q in entry =           3
  In of MODEL   38
    1    H    GLN  17           H        GLN  17   5.164   8.863 -13.507
    2    HA   GLN  17           HA       GLN  17   6.744  11.204 -13.206
    3    HB2  GLN  17           HB2      GLN  17   5.400  10.724 -15.237
    4    HB3  GLN  17           HB3      GLN  17   3.924  10.954 -14.299
    5    HG2  GLN  17           HG2      GLN  17   4.436  13.012 -15.499
    6    HG3  GLN  17           HG3      GLN  17   4.662  13.275 -13.771
    7   HE21  GLN  17          HE21      GLN  17   6.315  14.892 -13.915
    8   HE22  GLN  17          HE22      GLN  17   7.845  14.579 -14.580

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ALA  18           H        ALA  18   3.656  10.181 -11.833
    2    HA   ALA  18           HA       ALA  18   2.941  12.566 -10.554
    3    HB1  ALA  18           HB1      ALA  18   1.811  10.110 -10.773
    4    HB2  ALA  18           HB2      ALA  18   1.272  11.326  -9.618
    5    HB3  ALA  18           HB3      ALA  18   2.367  10.043  -9.102

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ARG  19           H        ARG  19   4.827   9.801  -9.299
    2    HA   ARG  19           HA       ARG  19   5.381  10.952  -6.779
    3    HB2  ARG  19           HB2      ARG  19   5.793   8.551  -7.316
    4    HB3  ARG  19           HB3      ARG  19   7.139   9.041  -8.348
    5    HG2  ARG  19           HG2      ARG  19   8.275  10.076  -6.432
    6    HG3  ARG  19           HG3      ARG  19   6.908   9.684  -5.390
    7    HD2  ARG  19           HD2      ARG  19   8.675   8.049  -5.052
    8    HD3  ARG  19           HD3      ARG  19   7.294   7.268  -5.828
    9    HE   ARG  19           HE       ARG  19   8.980   8.094  -7.887
   10   HH21  ARG  19          HH11      ARG  19  10.535   6.693  -8.755
   11   HH22  ARG  19          HH12      ARG  19  11.090   5.343  -7.828
   12   HH11  ARG  19          HH21      ARG  19   9.079   6.056  -5.116
   13   HH12  ARG  19          HH22      ARG  19  10.262   4.982  -5.766

  No H/Q in entry =          13
  In of MODEL   38
    1    H    SER  20           H        SER  20   7.172  10.992  -9.843
    2    HA   SER  20           HA       SER  20   9.422  12.408  -9.035
    3    HB2  SER  20           HB2      SER  20   9.436  11.539 -11.241
    4    HB3  SER  20           HB3      SER  20   7.931  12.354 -11.653
    5    HG   SER  20           HG       SER  20  10.440  13.559 -11.084

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU  21           H        LEU  21   6.311  13.676 -10.201
    2    HA   LEU  21           HA       LEU  21   6.979  16.422  -9.975
    3    HB2  LEU  21           HB2      LEU  21   4.317  14.990  -9.882
    4    HB3  LEU  21           HB3      LEU  21   4.474  16.744  -9.871
    5    HG   LEU  21           HG       LEU  21   5.679  14.988 -12.028
    6   HD11  LEU  21          HD11      LEU  21   3.028  16.464 -11.990
    7   HD13  LEU  21          HD12      LEU  21   3.249  14.715 -12.049
    8   HD12  LEU  21          HD13      LEU  21   3.743  15.712 -13.416
    9   HD23  LEU  21          HD21      LEU  21   5.387  17.319 -13.242
   10   HD22  LEU  21          HD22      LEU  21   6.768  17.083 -12.175
   11   HD21  LEU  21          HD23      LEU  21   5.360  17.967 -11.605

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ALA  22           H        ALA  22   5.491  14.124  -7.720
    2    HA   ALA  22           HA       ALA  22   4.902  15.924  -5.643
    3    HB3  ALA  22           HB1      ALA  22   4.145  13.531  -5.806
    4    HB2  ALA  22           HB2      ALA  22   4.746  14.000  -4.215
    5    HB1  ALA  22           HB3      ALA  22   5.762  13.046  -5.298

  No H/Q in entry =           5
  In of MODEL   38
    1    H    TYR  23           H        TYR  23   7.836  13.907  -6.113
    2    HA   TYR  23           HA       TYR  23   9.237  14.923  -3.869
    3    HB2  TYR  23           HB2      TYR  23  10.017  12.920  -5.042
    4    HB3  TYR  23           HB3      TYR  23  10.318  13.865  -6.499
    5    HD1  TYR  23           HD1      TYR  23  11.314  13.502  -2.920
    6    HD2  TYR  23           HD2      TYR  23  12.344  15.054  -6.793
    7    HE1  TYR  23           HE1      TYR  23  13.576  14.081  -2.087
    8    HE2  TYR  23           HE2      TYR  23  14.606  15.633  -5.957
    9    HH   TYR  23           HH       TYR  23  15.624  14.776  -2.661

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ALA  24           H        ALA  24   9.022  16.038  -7.231
    2    HA   ALA  24           HA       ALA  24  10.913  18.128  -6.995
    3    HB2  ALA  24           HB1      ALA  24  10.452  18.195  -9.200
    4    HB3  ALA  24           HB2      ALA  24   8.897  18.939  -8.825
    5    HB1  ALA  24           HB3      ALA  24   9.027  17.187  -8.961

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA  25           H        ALA  25   7.441  17.931  -6.345
    2    HA   ALA  25           HA       ALA  25   6.957  20.646  -5.764
    3    HB1  ALA  25           HB1      ALA  25   5.301  18.643  -5.956
    4    HB2  ALA  25           HB2      ALA  25   4.939  19.927  -4.801
    5    HB3  ALA  25           HB3      ALA  25   5.638  18.407  -4.240

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU  26           H        LEU  26   8.052  17.965  -3.731
    2    HA   LEU  26           HA       LEU  26   8.174  19.390  -1.291
    3    HB2  LEU  26           HB2      LEU  26   8.278  16.974  -1.292
    4    HB3  LEU  26           HB3      LEU  26   9.739  16.989  -2.276
    5    HG   LEU  26           HG       LEU  26  10.966  18.107  -0.444
    6   HD12  LEU  26          HD11      LEU  26   9.759  18.104   1.827
    7   HD11  LEU  26          HD12      LEU  26   8.264  17.963   0.905
    8   HD13  LEU  26          HD13      LEU  26   9.302  19.374   0.691
    9   HD21  LEU  26          HD21      LEU  26   9.449  15.631   0.436
   10   HD23  LEU  26          HD22      LEU  26  10.969  16.198   1.122
   11   HD22  LEU  26          HD23      LEU  26  10.911  15.643  -0.549

  No H/Q in entry =          11
  In of MODEL   38
    1    H    LYS  27           H        LYS  27  10.570  18.833  -3.838
    2    HA   LYS  27           HA       LYS  27  12.760  20.080  -2.626
    3    HB2  LYS  27           HB2      LYS  27  12.849  18.739  -4.720
    4    HB3  LYS  27           HB3      LYS  27  12.070  20.070  -5.575
    5    HG2  LYS  27           HG2      LYS  27  13.935  21.562  -5.010
    6    HG3  LYS  27           HG3      LYS  27  14.709  20.270  -4.084
    7    HD2  LYS  27           HD2      LYS  27  14.840  18.889  -6.142
    8    HD3  LYS  27           HD3      LYS  27  14.111  20.206  -7.061
    9    HE2  LYS  27           HE2      LYS  27  15.997  21.679  -6.461
   10    HE3  LYS  27           HE3      LYS  27  16.730  20.365  -5.534
   11    HZ3  LYS  27           HZ1      LYS  27  17.700  20.475  -7.728
   12    HZ2  LYS  27           HZ2      LYS  27  16.168  20.352  -8.456
   13    HZ1  LYS  27           HZ3      LYS  27  16.804  19.042  -7.581

  No H/Q in entry =          13
  In of MODEL   38
    1    H    GLN  28           H        GLN  28  10.114  21.455  -4.548
    2    HA   GLN  28           HA       GLN  28  11.060  24.112  -4.703
    3    HB2  GLN  28           HB2      GLN  28   8.240  23.012  -4.582
    4    HB3  GLN  28           HB3      GLN  28   8.624  24.699  -4.924
    5    HG2  GLN  28           HG2      GLN  28   9.673  22.348  -6.525
    6    HG3  GLN  28           HG3      GLN  28   8.289  23.332  -6.994
    7   HE21  GLN  28          HE21      GLN  28   9.183  25.919  -6.372
    8   HE22  GLN  28          HE22      GLN  28  10.550  26.289  -7.310

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ALA  29           H        ALA  29   9.158  22.405  -2.254
    2    HA   ALA  29           HA       ALA  29   8.613  24.590  -0.562
    3    HB2  ALA  29           HB1      ALA  29   7.905  23.014   1.009
    4    HB1  ALA  29           HB2      ALA  29   9.128  21.837   0.530
    5    HB3  ALA  29           HB3      ALA  29   7.732  22.126  -0.505

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LYS  30           H        LYS  30  11.354  22.336  -0.661
    2    HA   LYS  30           HA       LYS  30  12.687  23.291   1.633
    3    HB2  LYS  30           HB2      LYS  30  13.767  22.016  -0.891
    4    HB3  LYS  30           HB3      LYS  30  14.761  22.377   0.523
    5    HG2  LYS  30           HG2      LYS  30  13.227  20.983   1.913
    6    HG3  LYS  30           HG3      LYS  30  12.331  20.561   0.450
    7    HD2  LYS  30           HD2      LYS  30  14.372  19.587  -0.532
    8    HD3  LYS  30           HD3      LYS  30  15.286  20.023   0.913
    9    HE2  LYS  30           HE2      LYS  30  13.801  18.581   2.277
   10    HE3  LYS  30           HE3      LYS  30  12.916  18.125   0.816
   11    HZ2  LYS  30           HZ1      LYS  30  14.722  16.554   1.557
   12    HZ1  LYS  30           HZ2      LYS  30  15.849  17.747   1.098
   13    HZ3  LYS  30           HZ3      LYS  30  14.807  17.061  -0.059

  No H/Q in entry =          13
  In of MODEL   38
    1    H    GLN  31           H        GLN  31  12.543  24.503  -1.660
    2    HA   GLN  31           HA       GLN  31  14.690  26.406  -1.253
    3    HB2  GLN  31           HB2      GLN  31  12.627  26.448  -3.459
    4    HB3  GLN  31           HB3      GLN  31  14.244  27.152  -3.472
    5    HG2  GLN  31           HG2      GLN  31  14.724  24.457  -2.908
    6    HG3  GLN  31           HG3      GLN  31  13.410  24.399  -4.075
    7   HE21  GLN  31          HE21      GLN  31  16.254  23.621  -4.506
    8   HE22  GLN  31          HE22      GLN  31  16.810  24.601  -5.775

  No H/Q in entry =           8
  In of MODEL   38
    1    H    GLY  32           H        GLY  32  11.627  26.206  -0.081
    2    HA3  GLY  32           HA2      GLY  32  10.474  27.765   1.207
    3    HA2  GLY  32           HA3      GLY  32  11.588  29.007   0.650

  No H/Q in entry =           3
  In of MODEL   38
    1    H    ASP  33           H        ASP  33  10.211  27.103  -1.835
    2    HA   ASP  33           HA       ASP  33   8.528  29.369  -2.670
    3    HB2  ASP  33           HB2      ASP  33   9.621  26.959  -4.128
    4    HB3  ASP  33           HB3      ASP  33   8.457  28.071  -4.845

  No H/Q in entry =           4
  In of MODEL   38
    1    H    PHE  34           H        PHE  34   6.856  28.881  -1.092
    2    HA   PHE  34           HA       PHE  34   5.490  26.402  -0.991
    3    HB2  PHE  34           HB2      PHE  34   4.521  29.182  -0.295
    4    HB3  PHE  34           HB3      PHE  34   3.684  27.686   0.120
    5    HD1  PHE  34           HD1      PHE  34   5.932  30.093   1.320
    6    HD2  PHE  34           HD2      PHE  34   5.273  25.849   1.262
    7    HE1  PHE  34           HE1      PHE  34   7.342  29.844   3.344
    8    HE2  PHE  34           HE2      PHE  34   6.685  25.604   3.284
    9    HZ   PHE  34           HZ       PHE  34   7.714  27.603   4.324

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ALA  35           H        ALA  35   5.027  29.268  -2.990
    2    HA   ALA  35           HA       ALA  35   2.470  28.644  -3.994
    3    HB3  ALA  35           HB1      ALA  35   3.496  30.046  -6.037
    4    HB2  ALA  35           HB2      ALA  35   4.723  30.411  -4.824
    5    HB1  ALA  35           HB3      ALA  35   3.033  30.810  -4.516

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA  36           H        ALA  36   5.689  27.990  -5.379
    2    HA   ALA  36           HA       ALA  36   4.688  26.562  -7.617
    3    HB3  ALA  36           HB1      ALA  36   6.841  26.699  -8.252
    4    HB2  ALA  36           HB2      ALA  36   7.339  25.669  -6.908
    5    HB1  ALA  36           HB3      ALA  36   7.227  27.416  -6.688

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA  37           H        ALA  37   5.678  25.564  -4.373
    2    HA   ALA  37           HA       ALA  37   5.630  22.777  -4.809
    3    HB2  ALA  37           HB1      ALA  37   5.381  24.560  -2.424
    4    HB1  ALA  37           HB2      ALA  37   6.518  23.249  -2.730
    5    HB3  ALA  37           HB3      ALA  37   4.863  22.886  -2.245

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LYS  38           H        LYS  38   3.096  24.969  -3.613
    2    HA   LYS  38           HA       LYS  38   1.008  23.144  -3.376
    3    HB2  LYS  38           HB2      LYS  38   1.348  25.901  -3.121
    4    HB3  LYS  38           HB3      LYS  38   0.138  25.751  -4.390
    5    HG2  LYS  38           HG2      LYS  38  -1.292  24.416  -2.937
    6    HG3  LYS  38           HG3      LYS  38  -0.036  24.360  -1.693
    7    HD2  LYS  38           HD2      LYS  38  -0.230  26.694  -1.237
    8    HD3  LYS  38           HD3      LYS  38  -1.157  26.982  -2.711
    9    HE2  LYS  38           HE2      LYS  38  -2.643  27.003  -0.758
   10    HE3  LYS  38           HE3      LYS  38  -3.019  25.628  -1.800
   11    HZ3  LYS  38           HZ1      LYS  38  -2.272  24.157  -0.277
   12    HZ2  LYS  38           HZ2      LYS  38  -2.620  25.410   0.818
   13    HZ1  LYS  38           HZ3      LYS  38  -1.028  25.169   0.278

  No H/Q in entry =          13
  In of MODEL   38
    1    H    ALA  39           H        ALA  39   1.953  25.059  -6.229
    2    HA   ALA  39           HA       ALA  39  -0.134  24.185  -7.915
    3    HB2  ALA  39           HB1      ALA  39   2.590  24.850  -8.992
    4    HB1  ALA  39           HB2      ALA  39   1.623  26.104  -8.214
    5    HB3  ALA  39           HB3      ALA  39   1.002  25.268  -9.637

  No H/Q in entry =           5
  In of MODEL   38
    1    H    MET  40           H        MET  40   3.116  22.902  -7.368
    2    HA   MET  40           HA       MET  40   3.011  20.886  -9.364
    3    HB2  MET  40           HB2      MET  40   4.644  21.112  -6.829
    4    HB3  MET  40           HB3      MET  40   4.891  19.860  -8.049
    5    HG2  MET  40           HG2      MET  40   4.926  22.818  -8.707
    6    HG3  MET  40           HG3      MET  40   6.381  21.922  -8.273
    7    HE3  MET  40           HE1      MET  40   7.240  19.719 -11.095
    8    HE2  MET  40           HE2      MET  40   6.693  19.392  -9.453
    9    HE1  MET  40           HE3      MET  40   7.779  20.746  -9.759

  No H/Q in entry =           9
  In of MODEL   38
    1    H    MET  41           H        MET  41   2.127  20.915  -5.932
    2    HA   MET  41           HA       MET  41   1.612  18.146  -5.656
    3    HB2  MET  41           HB2      MET  41   0.278  20.493  -4.287
    4    HB3  MET  41           HB3      MET  41   0.136  18.813  -3.782
    5    HG2  MET  41           HG2      MET  41   2.845  19.051  -3.843
    6    HG3  MET  41           HG3      MET  41   2.399  20.706  -3.439
    7    HE2  MET  41           HE1      MET  41  -0.618  19.432  -1.690
    8    HE1  MET  41           HE2      MET  41   0.187  20.951  -2.070
    9    HE3  MET  41           HE3      MET  41   0.146  20.376  -0.403

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ASP  42           H        ASP  42  -0.450  20.862  -6.605
    2    HA   ASP  42           HA       ASP  42  -2.885  19.488  -6.723
    3    HB2  ASP  42           HB2      ASP  42  -2.195  22.063  -6.979
    4    HB3  ASP  42           HB3      ASP  42  -2.359  21.672  -8.687

  No H/Q in entry =           4
  In of MODEL   38
    1    H    GLN  43           H        GLN  43  -0.470  20.099  -9.245
    2    HA   GLN  43           HA       GLN  43  -1.868  18.777 -11.326
    3    HB2  GLN  43           HB2      GLN  43   1.091  19.310 -10.969
    4    HB3  GLN  43           HB3      GLN  43   0.368  18.669 -12.447
    5    HG2  GLN  43           HG2      GLN  43  -1.156  20.688 -12.469
    6    HG3  GLN  43           HG3      GLN  43  -0.195  21.346 -11.148
    7   HE21  GLN  43          HE21      GLN  43  -0.062  22.972 -13.231
    8   HE22  GLN  43          HE22      GLN  43   1.346  22.762 -14.152

  No H/Q in entry =           8
  In of MODEL   38
    1    H    SER  44           H        SER  44   0.511  17.645  -8.959
    2    HA   SER  44           HA       SER  44   0.852  15.043  -9.994
    3    HB2  SER  44           HB2      SER  44   1.758  16.481  -7.762
    4    HB3  SER  44           HB3      SER  44   0.910  15.091  -7.087
    5    HG   SER  44           HG       SER  44   3.021  14.485  -7.534

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ARG  45           H        ARG  45  -1.455  16.341  -7.632
    2    HA   ARG  45           HA       ARG  45  -2.821  13.970  -6.991
    3    HB2  ARG  45           HB2      ARG  45  -3.022  16.134  -5.792
    4    HB3  ARG  45           HB3      ARG  45  -3.895  16.800  -7.169
    5    HG2  ARG  45           HG2      ARG  45  -5.648  15.062  -6.875
    6    HG3  ARG  45           HG3      ARG  45  -4.787  14.452  -5.461
    7    HD2  ARG  45           HD2      ARG  45  -4.998  16.715  -4.397
    8    HD3  ARG  45           HD3      ARG  45  -6.000  17.232  -5.769
    9    HE   ARG  45           HE       ARG  45  -7.086  14.846  -4.725
   10   HH21  ARG  45          HH11      ARG  45  -8.911  14.907  -3.438
   11   HH22  ARG  45          HH12      ARG  45  -9.308  16.342  -2.562
   12   HH11  ARG  45          HH21      ARG  45  -6.552  18.094  -3.698
   13   HH12  ARG  45          HH22      ARG  45  -7.966  18.147  -2.707

  No H/Q in entry =          13
  In of MODEL   38
    1    H    MET  46           H        MET  46  -3.443  16.378  -9.530
    2    HA   MET  46           HA       MET  46  -5.784  15.193 -10.574
    3    HB2  MET  46           HB2      MET  46  -3.706  17.039 -11.759
    4    HB3  MET  46           HB3      MET  46  -5.089  16.473 -12.701
    5    HG2  MET  46           HG2      MET  46  -6.633  17.392 -11.044
    6    HG3  MET  46           HG3      MET  46  -5.286  17.887 -10.025
    7    HE1  MET  46           HE1      MET  46  -7.123  18.054 -13.206
    8    HE3  MET  46           HE2      MET  46  -5.653  18.312 -14.139
    9    HE2  MET  46           HE3      MET  46  -6.805  19.632 -13.940

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ALA  47           H        ALA  47  -2.359  14.738 -11.363
    2    HA   ALA  47           HA       ALA  47  -2.713  13.014 -13.575
    3    HB3  ALA  47           HB1      ALA  47  -0.538  13.917 -13.240
    4    HB2  ALA  47           HB2      ALA  47  -0.383  12.189 -12.912
    5    HB1  ALA  47           HB3      ALA  47  -0.471  13.337 -11.575

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU  48           H        LEU  48  -2.409  12.371 -10.105
    2    HA   LEU  48           HA       LEU  48  -2.485   9.531 -10.270
    3    HB2  LEU  48           HB2      LEU  48  -3.243  11.438  -8.045
    4    HB3  LEU  48           HB3      LEU  48  -3.135   9.688  -7.849
    5    HG   LEU  48           HG       LEU  48  -0.857  11.405  -8.862
    6   HD13  LEU  48          HD11      LEU  48  -1.125  12.168  -6.667
    7   HD12  LEU  48          HD12      LEU  48   0.048  10.868  -6.482
    8   HD11  LEU  48          HD13      LEU  48  -1.644  10.593  -6.070
    9   HD22  LEU  48          HD21      LEU  48  -0.349   9.225  -9.513
   10   HD21  LEU  48          HD22      LEU  48  -1.202   8.500  -8.151
   11   HD23  LEU  48          HD23      LEU  48   0.368   9.263  -7.903

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ASN  49           H        ASN  49  -4.962  12.006  -9.840
    2    HA   ASN  49           HA       ASN  49  -7.131  10.325  -9.286
    3    HB2  ASN  49           HB2      ASN  49  -7.198  12.748  -8.958
    4    HB3  ASN  49           HB3      ASN  49  -7.061  13.012 -10.691
    5   HD21  ASN  49          HD21      ASN  49  -9.259  14.064  -9.292
    6   HD22  ASN  49          HD22      ASN  49 -10.663  13.225  -9.742

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLU  50           H        GLU  50  -5.887  11.538 -12.381
    2    HA   GLU  50           HA       GLU  50  -7.847  10.274 -14.013
    3    HB2  GLU  50           HB2      GLU  50  -6.401  12.105 -14.836
    4    HB3  GLU  50           HB3      GLU  50  -4.999  11.042 -14.712
    5    HG2  GLU  50           HG2      GLU  50  -5.976   9.504 -16.344
    6    HG3  GLU  50           HG3      GLU  50  -7.444  10.472 -16.417

  No H/Q in entry =           6
  In of MODEL   38
    1    H    ALA  51           H        ALA  51  -4.660   9.300 -12.838
    2    HA   ALA  51           HA       ALA  51  -4.516   6.851 -14.263
    3    HB2  ALA  51           HB1      ALA  51  -2.524   6.574 -13.181
    4    HB1  ALA  51           HB2      ALA  51  -3.201   6.988 -11.606
    5    HB3  ALA  51           HB3      ALA  51  -2.764   8.265 -12.741

  No H/Q in entry =           5
  In of MODEL   38
    1    H    HIS  52           H        HIS  52  -5.666   7.668 -11.002
    2    HA   HIS  52           HA       HIS  52  -6.327   5.051 -10.171
    3    HB2  HIS  52           HB2      HIS  52  -6.193   6.950  -8.622
    4    HB3  HIS  52           HB3      HIS  52  -7.596   7.687  -9.395
    5    HD1  HIS  52           HD1      HIS  52  -9.880   6.260  -9.244
    6    HD2  HIS  52           HD2      HIS  52  -6.822   5.057  -6.679
    7    HE1  HIS  52           HE1      HIS  52 -10.958   4.794  -7.483
    8    HE2  HIS  52           HE2      HIS  52  -9.107   4.051  -5.911

  No H/Q in entry =           8
  In of MODEL   38
    1    H    LEU  53           H        LEU  53  -8.179   7.501 -11.938
    2    HA   LEU  53           HA       LEU  53 -10.676   6.194 -11.932
    3    HB2  LEU  53           HB2      LEU  53  -9.420   8.187 -13.808
    4    HB3  LEU  53           HB3      LEU  53 -11.019   7.512 -14.118
    5    HG   LEU  53           HG       LEU  53 -10.297   8.815 -11.473
    6   HD12  LEU  53          HD11      LEU  53 -11.667  10.762 -12.461
    7   HD11  LEU  53          HD12      LEU  53 -11.351  10.022 -14.032
    8   HD13  LEU  53          HD13      LEU  53 -10.013  10.580 -13.033
    9   HD23  LEU  53          HD21      LEU  53 -12.885   9.215 -11.620
   10   HD22  LEU  53          HD22      LEU  53 -12.298   7.619 -11.166
   11   HD21  LEU  53          HD23      LEU  53 -12.859   7.912 -12.802

  No H/Q in entry =          11
  In of MODEL   38
    1    H    VAL  54           H        VAL  54  -7.943   6.019 -14.193
    2    HA   VAL  54           HA       VAL  54  -9.171   4.245 -16.030
    3    HB   VAL  54           HB       VAL  54  -6.260   4.768 -15.371
    4   HG12  VAL  54          HG11      VAL  54  -6.027   3.690 -17.765
    5   HG11  VAL  54          HG12      VAL  54  -7.547   2.899 -17.351
    6   HG13  VAL  54          HG13      VAL  54  -6.122   2.651 -16.344
    7   HG22  VAL  54          HG21      VAL  54  -7.051   6.709 -16.404
    8   HG21  VAL  54          HG22      VAL  54  -8.247   5.841 -17.364
    9   HG23  VAL  54          HG23      VAL  54  -6.544   5.772 -17.810

  No H/Q in entry =           9
  In of MODEL   38
    1    H    GLN  55           H        GLN  55  -7.144   3.704 -13.149
    2    HA   GLN  55           HA       GLN  55  -7.040   0.888 -13.413
    3    HB2  GLN  55           HB2      GLN  55  -5.477   1.790 -11.905
    4    HB3  GLN  55           HB3      GLN  55  -6.692   2.747 -11.062
    5    HG2  GLN  55           HG2      GLN  55  -7.359   0.982  -9.743
    6    HG3  GLN  55           HG3      GLN  55  -7.138  -0.200 -11.027
    7   HE21  GLN  55          HE21      GLN  55  -5.502  -1.642 -10.550
    8   HE22  GLN  55          HE22      GLN  55  -4.112  -1.284  -9.648

  No H/Q in entry =           8
  In of MODEL   38
    1    H    THR  56           H        THR  56  -9.370   3.033 -11.774
    2    HA   THR  56           HA       THR  56 -10.933   1.138 -10.476
    3    HB   THR  56           HB       THR  56 -11.858   3.638 -11.924
    4    HG1  THR  56           HG1      THR  56 -11.880   4.195  -9.511
    5   HG21  THR  56          HG21      THR  56 -13.218   1.708 -10.068
    6   HG23  THR  56          HG22      THR  56 -13.840   2.464 -11.536
    7   HG22  THR  56          HG23      THR  56 -13.678   3.410 -10.055

  No H/Q in entry =           7
  In of MODEL   38
    1    H    LYS  57           H        LYS  57 -11.169   2.228 -13.857
    2    HA   LYS  57           HA       LYS  57 -13.322   0.530 -14.597
    3    HB2  LYS  57           HB2      LYS  57 -12.460   2.492 -15.914
    4    HB3  LYS  57           HB3      LYS  57 -11.026   1.552 -16.304
    5    HG2  LYS  57           HG2      LYS  57 -13.630   0.255 -16.892
    6    HG3  LYS  57           HG3      LYS  57 -13.214   1.639 -17.894
    7    HD2  LYS  57           HD2      LYS  57 -11.047   0.585 -18.456
    8    HD3  LYS  57           HD3      LYS  57 -11.468  -0.809 -17.464
    9    HE2  LYS  57           HE2      LYS  57 -13.434  -1.245 -18.908
   10    HE3  LYS  57           HE3      LYS  57 -13.012   0.141 -19.914
   11    HZ2  LYS  57           HZ1      LYS  57 -11.850  -2.495 -19.825
   12    HZ1  LYS  57           HZ2      LYS  57 -10.707  -1.237 -19.844
   13    HZ3  LYS  57           HZ3      LYS  57 -11.867  -1.355 -21.081

  No H/Q in entry =          13
  In of MODEL   38
    1    H    LEU  58           H        LEU  58  -9.815   0.119 -14.570
    2    HA   LEU  58           HA       LEU  58  -9.819  -2.395 -15.864
    3    HB2  LEU  58           HB2      LEU  58  -7.777  -1.096 -14.070
    4    HB3  LEU  58           HB3      LEU  58  -7.515  -2.614 -14.930
    5    HG   LEU  58           HG       LEU  58  -8.294  -0.011 -16.281
    6   HD11  LEU  58          HD11      LEU  58  -5.636  -1.234 -15.614
    7   HD13  LEU  58          HD12      LEU  58  -6.140   0.454 -15.558
    8   HD12  LEU  58          HD13      LEU  58  -5.809  -0.312 -17.108
    9   HD22  LEU  58          HD21      LEU  58  -8.874  -1.573 -17.871
   10   HD21  LEU  58          HD22      LEU  58  -7.821  -2.816 -17.200
   11   HD23  LEU  58          HD23      LEU  58  -7.145  -1.536 -18.208

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  59           H        ILE  59 -10.619  -1.504 -12.605
    2    HA   ILE  59           HA       ILE  59 -10.244  -4.272 -11.666
    3    HB   ILE  59           HB       ILE  59  -9.803  -2.004 -10.267
    4   HG12  ILE  59          HG12      ILE  59 -11.143  -4.365  -8.932
    5   HG13  ILE  59          HG13      ILE  59  -9.508  -4.436  -9.538
    6   HG22  ILE  59          HG21      ILE  59 -12.549  -2.748  -9.300
    7   HG21  ILE  59          HG22      ILE  59 -12.350  -1.505 -10.513
    8   HG23  ILE  59          HG23      ILE  59 -11.614  -1.320  -8.923
    9   HD13  ILE  59          HD11      ILE  59  -8.844  -2.575  -8.119
   10   HD12  ILE  59          HD12      ILE  59  -9.565  -3.841  -7.134
   11   HD11  ILE  59          HD13      ILE  59 -10.499  -2.401  -7.542

  No H/Q in entry =          11
  In of MODEL   38
    1    H    GLU  60           H        GLU  60 -12.822  -1.969 -12.449
    2    HA   GLU  60           HA       GLU  60 -14.990  -3.501 -11.421
    3    HB2  GLU  60           HB2      GLU  60 -15.315  -1.169 -11.965
    4    HB3  GLU  60           HB3      GLU  60 -14.843  -1.443 -13.639
    5    HG2  GLU  60           HG2      GLU  60 -17.171  -2.949 -12.473
    6    HG3  GLU  60           HG3      GLU  60 -17.387  -1.314 -13.059

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLY  61           H        GLY  61 -13.342  -3.469 -14.550
    2    HA3  GLY  61           HA2      GLY  61 -15.048  -5.722 -15.431
    3    HA2  GLY  61           HA3      GLY  61 -14.218  -4.610 -16.513

  No H/Q in entry =           3
  In of MODEL   38
    1    H    ASP  62           H        ASP  62 -12.812  -6.055 -13.643
    2    HA   ASP  62           HA       ASP  62 -10.402  -6.768 -14.709
    3    HB2  ASP  62           HB2      ASP  62 -10.232  -8.370 -12.844
    4    HB3  ASP  62           HB3      ASP  62 -10.930  -6.843 -12.318

  No H/Q in entry =           4
  In of MODEL   38
    1    H    ALA  63           H        ALA  63 -10.121  -7.842 -16.637
    2    HA   ALA  63           HA       ALA  63 -11.810  -9.921 -17.623
    3    HB3  ALA  63           HB1      ALA  63  -8.966  -9.082 -18.272
    4    HB1  ALA  63           HB2      ALA  63 -10.428  -8.690 -19.176
    5    HB2  ALA  63           HB3      ALA  63  -9.816 -10.345 -19.160

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLY  64           H        GLY  64  -8.434 -10.628 -17.443
    2    HA3  GLY  64           HA2      GLY  64  -7.331 -12.096 -15.884
    3    HA2  GLY  64           HA3      GLY  64  -8.895 -12.813 -15.518

  No H/Q in entry =           3
  In of MODEL   38
    1    H    GLU  65           H        GLU  65  -6.839 -14.498 -16.118
    2    HA   GLU  65           HA       GLU  65  -6.982 -15.131 -18.959
    3    HB2  GLU  65           HB2      GLU  65  -5.366 -16.306 -16.701
    4    HB3  GLU  65           HB3      GLU  65  -5.320 -16.916 -18.355
    5    HG2  GLU  65           HG2      GLU  65  -4.591 -14.740 -19.180
    6    HG3  GLU  65           HG3      GLU  65  -4.727 -14.053 -17.563

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLY  66           H        GLY  66  -8.838 -15.781 -16.400
    2    HA3  GLY  66           HA2      GLY  66 -10.204 -17.970 -17.662
    3    HA2  GLY  66           HA3      GLY  66  -9.429 -18.416 -16.155

  No H/Q in entry =           3
  In of MODEL   38
    1    H    LYS  67           H        LYS  67 -12.017 -18.813 -16.251
    2    HA   LYS  67           HA       LYS  67 -14.007 -17.153 -15.910
    3    HB2  LYS  67           HB2      LYS  67 -14.768 -18.587 -13.909
    4    HB3  LYS  67           HB3      LYS  67 -14.446 -19.402 -15.445
    5    HG2  LYS  67           HG2      LYS  67 -12.054 -19.078 -13.768
    6    HG3  LYS  67           HG3      LYS  67 -13.298 -20.081 -13.025
    7    HD2  LYS  67           HD2      LYS  67 -13.380 -21.490 -15.046
    8    HD3  LYS  67           HD3      LYS  67 -12.141 -20.483 -15.798
    9    HE2  LYS  67           HE2      LYS  67 -11.075 -22.454 -14.828
   10    HE3  LYS  67           HE3      LYS  67 -10.604 -21.026 -13.904
   11    HZ1  LYS  67           HZ1      LYS  67 -12.907 -21.883 -12.713
   12    HZ3  LYS  67           HZ2      LYS  67 -11.329 -22.119 -12.131
   13    HZ2  LYS  67           HZ3      LYS  67 -12.081 -23.322 -13.066

  No H/Q in entry =          13
  In of MODEL   38
    1    H    MET  68           H        MET  68 -13.057 -18.037 -12.737
    2    HA   MET  68           HA       MET  68 -13.729 -15.596 -11.535
    3    HB2  MET  68           HB2      MET  68 -12.043 -17.879 -10.507
    4    HB3  MET  68           HB3      MET  68 -12.691 -16.576  -9.511
    5    HG2  MET  68           HG2      MET  68 -14.363 -18.458 -11.203
    6    HG3  MET  68           HG3      MET  68 -14.134 -18.601  -9.458
    7    HE1  MET  68           HE1      MET  68 -14.441 -16.975  -7.888
    8    HE3  MET  68           HE2      MET  68 -15.870 -15.949  -7.775
    9    HE2  MET  68           HE3      MET  68 -14.378 -15.299  -8.453

  No H/Q in entry =           9
  In of MODEL   38
    1    H    LYS  69           H        LYS  69 -10.509 -16.828 -12.481
    2    HA   LYS  69           HA       LYS  69  -8.913 -15.040 -11.119
    3    HB2  LYS  69           HB2      LYS  69  -8.083 -16.990 -12.358
    4    HB3  LYS  69           HB3      LYS  69  -8.399 -16.156 -13.880
    5    HG2  LYS  69           HG2      LYS  69  -6.832 -14.375 -13.267
    6    HG3  LYS  69           HG3      LYS  69  -6.559 -15.130 -11.697
    7    HD2  LYS  69           HD2      LYS  69  -5.645 -17.132 -12.822
    8    HD3  LYS  69           HD3      LYS  69  -5.898 -16.361 -14.388
    9    HE2  LYS  69           HE2      LYS  69  -4.380 -14.530 -13.743
   10    HE3  LYS  69           HE3      LYS  69  -4.134 -15.283 -12.168
   11    HZ2  LYS  69           HZ1      LYS  69  -3.330 -16.315 -14.825
   12    HZ1  LYS  69           HZ2      LYS  69  -3.361 -17.292 -13.436
   13    HZ3  LYS  69           HZ3      LYS  69  -2.333 -15.941 -13.505

  No H/Q in entry =          13
  In of MODEL   38
    1    H    VAL  70           H        VAL  70  -7.731 -13.140 -11.632
    2    HA   VAL  70           HA       VAL  70  -9.087 -11.339 -13.561
    3    HB   VAL  70           HB       VAL  70  -8.363  -9.506 -12.045
    4   HG12  VAL  70          HG11      VAL  70  -9.976 -11.676 -10.670
    5   HG11  VAL  70          HG12      VAL  70 -10.618 -10.553 -11.869
    6   HG13  VAL  70          HG13      VAL  70 -10.041  -9.949 -10.316
    7   HG23  VAL  70          HG21      VAL  70  -7.639 -10.216  -9.707
    8   HG22  VAL  70          HG22      VAL  70  -6.442 -10.498 -10.969
    9   HG21  VAL  70          HG23      VAL  70  -7.403 -11.841 -10.351

  No H/Q in entry =           9
  In of MODEL   38
    1    H    SER  71           H        SER  71  -7.630  -9.542 -14.301
    2    HA   SER  71           HA       SER  71  -5.352 -10.536 -15.635
    3    HB2  SER  71           HB2      SER  71  -6.664  -8.517 -16.333
    4    HB3  SER  71           HB3      SER  71  -5.981  -7.650 -14.960
    5    HG   SER  71           HG       SER  71  -4.630  -8.788 -17.179

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU  72           H        LEU  72  -3.344 -10.842 -14.978
    2    HA   LEU  72           HA       LEU  72  -2.604 -10.628 -12.272
    3    HB2  LEU  72           HB2      LEU  72  -0.972 -11.049 -14.771
    4    HB3  LEU  72           HB3      LEU  72  -0.289 -11.110 -13.150
    5    HG   LEU  72           HG       LEU  72  -2.646 -12.820 -14.003
    6   HD12  LEU  72          HD11      LEU  72  -0.883 -14.657 -14.088
    7   HD11  LEU  72          HD12      LEU  72   0.328 -13.376 -14.082
    8   HD13  LEU  72          HD13      LEU  72  -0.826 -13.492 -15.411
    9   HD23  LEU  72          HD21      LEU  72  -1.596 -14.226 -12.060
   10   HD22  LEU  72          HD22      LEU  72  -2.570 -12.828 -11.633
   11   HD21  LEU  72          HD23      LEU  72  -0.811 -12.717 -11.606

  No H/Q in entry =          11
  In of MODEL   38
    1    H    VAL  73           H        VAL  73  -1.920  -8.603 -15.054
    2    HA   VAL  73           HA       VAL  73   0.001  -6.897 -13.963
    3    HB   VAL  73           HB       VAL  73  -0.407  -5.483 -15.816
    4   HG13  VAL  73          HG11      VAL  73  -0.200  -7.007 -17.593
    5   HG12  VAL  73          HG12      VAL  73  -1.327  -8.152 -16.865
    6   HG11  VAL  73          HG13      VAL  73   0.292  -7.962 -16.196
    7   HG22  VAL  73          HG21      VAL  73  -2.670  -4.948 -15.830
    8   HG21  VAL  73          HG22      VAL  73  -3.171  -6.625 -15.620
    9   HG23  VAL  73          HG23      VAL  73  -2.596  -6.067 -17.191

  No H/Q in entry =           9
  In of MODEL   38
    1    H    LEU  74           H        LEU  74  -3.391  -7.030 -13.379
    2    HA   LEU  74           HA       LEU  74  -4.018  -4.378 -12.757
    3    HB2  LEU  74           HB2      LEU  74  -5.740  -6.050 -12.920
    4    HB3  LEU  74           HB3      LEU  74  -5.034  -6.976 -11.598
    5    HG   LEU  74           HG       LEU  74  -5.489  -5.104 -10.046
    6   HD12  LEU  74          HD11      LEU  74  -7.118  -3.337 -11.002
    7   HD11  LEU  74          HD12      LEU  74  -6.530  -3.842 -12.585
    8   HD13  LEU  74          HD13      LEU  74  -5.409  -3.161 -11.404
    9   HD23  LEU  74          HD21      LEU  74  -8.058  -5.546 -11.477
   10   HD22  LEU  74          HD22      LEU  74  -7.666  -5.692  -9.778
   11   HD21  LEU  74          HD23      LEU  74  -7.187  -6.957 -10.884

  No H/Q in entry =          11
  In of MODEL   38
    1    H    VAL  75           H        VAL  75  -2.947  -6.964 -10.608
    2    HA   VAL  75           HA       VAL  75  -2.738  -5.415  -8.263
    3    HB   VAL  75           HB       VAL  75  -1.234  -7.901  -9.069
    4   HG11  VAL  75          HG11      VAL  75  -1.438  -6.447  -6.393
    5   HG13  VAL  75          HG12      VAL  75   0.020  -6.673  -7.348
    6   HG12  VAL  75          HG13      VAL  75  -0.764  -8.059  -6.608
    7   HG22  VAL  75          HG21      VAL  75  -3.656  -8.197  -8.882
    8   HG21  VAL  75          HG22      VAL  75  -3.668  -7.356  -7.331
    9   HG23  VAL  75          HG23      VAL  75  -2.879  -8.928  -7.477

  No H/Q in entry =           9
  In of MODEL   38
    1    H    GLU  76           H        GLU  76  -0.345  -6.160 -10.820
    2    HA   GLU  76           HA       GLU  76   1.843  -4.804  -9.677
    3    HB2  GLU  76           HB2      GLU  76   2.042  -6.274 -11.663
    4    HB3  GLU  76           HB3      GLU  76   1.112  -5.124 -12.611
    5    HG2  GLU  76           HG2      GLU  76   3.448  -4.778 -13.122
    6    HG3  GLU  76           HG3      GLU  76   2.918  -3.402 -12.174

  No H/Q in entry =           6
  In of MODEL   38
    1    H    ALA  77           H        ALA  77  -0.712  -3.611 -11.844
    2    HA   ALA  77           HA       ALA  77   0.264  -0.960 -12.023
    3    HB1  ALA  77           HB1      ALA  77  -1.349  -1.589 -13.633
    4    HB2  ALA  77           HB2      ALA  77  -2.200  -0.456 -12.583
    5    HB3  ALA  77           HB3      ALA  77  -2.465  -2.190 -12.404

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLN  78           H        GLN  78  -1.979  -2.530  -9.797
    2    HA   GLN  78           HA       GLN  78  -2.787  -0.218  -8.386
    3    HB2  GLN  78           HB2      GLN  78  -3.823  -2.555  -8.326
    4    HB3  GLN  78           HB3      GLN  78  -2.526  -2.995  -7.217
    5    HG2  GLN  78           HG2      GLN  78  -3.228  -1.320  -5.630
    6    HG3  GLN  78           HG3      GLN  78  -4.409  -0.669  -6.765
    7   HE21  GLN  78          HE21      GLN  78  -5.850  -2.749  -7.679
    8   HE22  GLN  78          HE22      GLN  78  -6.516  -3.672  -6.419

  No H/Q in entry =           8
  In of MODEL   38
    1    H    LEU  79           H        LEU  79  -0.093  -2.460  -7.960
    2    HA   LEU  79           HA       LEU  79   0.896  -1.562  -5.509
    3    HB2  LEU  79           HB2      LEU  79   1.770  -3.564  -6.587
    4    HB3  LEU  79           HB3      LEU  79   2.400  -2.607  -7.923
    5    HG   LEU  79           HG       LEU  79   3.961  -1.461  -6.430
    6   HD13  LEU  79          HD11      LEU  79   2.971  -1.225  -4.355
    7   HD12  LEU  79          HD12      LEU  79   4.060  -2.569  -4.021
    8   HD11  LEU  79          HD13      LEU  79   2.353  -2.878  -4.339
    9   HD23  LEU  79          HD21      LEU  79   5.191  -3.604  -5.539
   10   HD22  LEU  79          HD22      LEU  79   4.973  -3.403  -7.275
   11   HD21  LEU  79          HD23      LEU  79   3.908  -4.481  -6.377

  No H/Q in entry =          11
  In of MODEL   38
    1    H    HIS  80           H        HIS  80   1.735  -0.435  -8.786
    2    HA   HIS  80           HA       HIS  80   3.538   1.562  -7.875
    3    HB2  HIS  80           HB2      HIS  80   2.233   0.864 -10.449
    4    HB3  HIS  80           HB3      HIS  80   2.819   2.519 -10.280
    5    HD1  HIS  80           HD1      HIS  80   5.215   2.836 -10.819
    6    HD2  HIS  80           HD2      HIS  80   4.428  -1.082  -9.629
    7    HE1  HIS  80           HE1      HIS  80   7.411   1.573 -11.004
    8    HE2  HIS  80           HE2      HIS  80   6.943  -0.818 -10.282

  No H/Q in entry =           8
  In of MODEL   38
    1    H    LEU  81           H        LEU  81   0.126   1.702  -8.828
    2    HA   LEU  81           HA       LEU  81  -0.165   4.492  -8.491
    3    HB2  LEU  81           HB2      LEU  81  -2.164   2.233  -8.400
    4    HB3  LEU  81           HB3      LEU  81  -2.627   3.933  -8.302
    5    HG   LEU  81           HG       LEU  81  -0.943   2.798 -10.553
    6   HD12  LEU  81          HD11      LEU  81  -3.187   3.105 -11.834
    7   HD11  LEU  81          HD12      LEU  81  -3.931   3.029 -10.237
    8   HD13  LEU  81          HD13      LEU  81  -2.983   1.669 -10.834
    9   HD23  LEU  81          HD21      LEU  81  -2.063   4.937 -11.638
   10   HD22  LEU  81          HD22      LEU  81  -0.640   5.116 -10.615
   11   HD21  LEU  81          HD23      LEU  81  -2.242   5.452  -9.962

  No H/Q in entry =          11
  In of MODEL   38
    1    H    MET  82           H        MET  82  -0.789   1.797  -6.242
    2    HA   MET  82           HA       MET  82  -1.837   3.372  -4.144
    3    HB2  MET  82           HB2      MET  82  -0.444   0.695  -4.198
    4    HB3  MET  82           HB3      MET  82  -1.017   1.413  -2.695
    5    HG2  MET  82           HG2      MET  82  -2.764   0.912  -5.124
    6    HG3  MET  82           HG3      MET  82  -2.668  -0.164  -3.732
    7    HE3  MET  82           HE1      MET  82  -4.382   1.468  -0.901
    8    HE2  MET  82           HE2      MET  82  -2.655   1.759  -1.098
    9    HE1  MET  82           HE3      MET  82  -3.335   0.197  -1.549

  No H/Q in entry =           9
  In of MODEL   38
    1    H    THR  83           H        THR  83   1.466   2.311  -4.860
    2    HA   THR  83           HA       THR  83   2.693   3.420  -2.567
    3    HB   THR  83           HB       THR  83   4.777   3.383  -4.056
    4    HG1  THR  83           HG1      THR  83   4.526   2.858  -6.079
    5   HG22  THR  83          HG21      THR  83   4.350   0.722  -4.390
    6   HG21  THR  83          HG22      THR  83   3.066   1.090  -3.239
    7   HG23  THR  83          HG23      THR  83   4.746   1.445  -2.831

  No H/Q in entry =           7
  In of MODEL   38
    1    H    SER  84           H        SER  84   2.289   4.703  -5.861
    2    HA   SER  84           HA       SER  84   3.614   7.152  -5.412
    3    HB2  SER  84           HB2      SER  84   1.535   6.308  -7.417
    4    HB3  SER  84           HB3      SER  84   2.201   7.940  -7.394
    5    HG   SER  84           HG       SER  84   3.590   5.476  -7.700

  No H/Q in entry =           5
  In of MODEL   38
    1    H    MET  85           H        MET  85   0.127   6.370  -5.216
    2    HA   MET  85           HA       MET  85  -0.749   8.973  -4.603
    3    HB2  MET  85           HB2      MET  85  -2.262   7.152  -5.264
    4    HB3  MET  85           HB3      MET  85  -1.959   6.349  -3.725
    5    HG2  MET  85           HG2      MET  85  -2.859   8.296  -2.515
    6    HG3  MET  85           HG3      MET  85  -3.131   9.127  -4.046
    7    HE3  MET  85           HE1      MET  85  -6.435   8.133  -5.180
    8    HE2  MET  85           HE2      MET  85  -4.838   8.409  -5.870
    9    HE1  MET  85           HE3      MET  85  -5.426   9.457  -4.584

  No H/Q in entry =           9
  In of MODEL   38
    1    H    LEU  86           H        LEU  86   0.205   6.313  -2.471
    2    HA   LEU  86           HA       LEU  86  -0.319   7.607  -0.023
    3    HB2  LEU  86           HB2      LEU  86   0.159   5.140  -0.425
    4    HB3  LEU  86           HB3      LEU  86   1.862   5.582  -0.532
    5    HG   LEU  86           HG       LEU  86   1.547   6.736   1.741
    6   HD11  LEU  86          HD11      LEU  86  -1.146   5.953   1.288
    7   HD13  LEU  86          HD12      LEU  86  -0.474   6.702   2.735
    8   HD12  LEU  86          HD13      LEU  86  -0.554   4.945   2.613
    9   HD23  LEU  86          HD21      LEU  86   1.138   3.740   1.860
   10   HD22  LEU  86          HD22      LEU  86   2.142   4.754   2.895
   11   HD21  LEU  86          HD23      LEU  86   2.633   4.436   1.231

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ALA  87           H        ALA  87   2.650   7.335  -1.935
    2    HA   ALA  87           HA       ALA  87   4.360   8.752  -0.220
    3    HB3  ALA  87           HB1      ALA  87   4.441   7.746  -2.930
    4    HB2  ALA  87           HB2      ALA  87   5.781   8.082  -1.839
    5    HB1  ALA  87           HB3      ALA  87   5.151   9.361  -2.875

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ARG  88           H        ARG  88   2.385   9.883  -2.923
    2    HA   ARG  88           HA       ARG  88   3.146  12.576  -2.806
    3    HB2  ARG  88           HB2      ARG  88   1.884  11.421  -4.657
    4    HB3  ARG  88           HB3      ARG  88   0.433  11.554  -3.662
    5    HG2  ARG  88           HG2      ARG  88   1.439  14.140  -3.581
    6    HG3  ARG  88           HG3      ARG  88   1.854  13.631  -5.216
    7    HD2  ARG  88           HD2      ARG  88  -0.293  13.702  -5.897
    8    HD3  ARG  88           HD3      ARG  88  -0.865  12.842  -4.466
    9    HE   ARG  88           HE       ARG  88  -1.072  15.620  -4.876
   10   HH21  ARG  88          HH11      ARG  88  -1.593  16.943  -3.132
   11   HH22  ARG  88          HH12      ARG  88  -1.281  16.404  -1.518
   12   HH11  ARG  88          HH21      ARG  88  -0.026  13.358  -2.515
   13   HH12  ARG  88          HH22      ARG  88  -0.412  14.368  -1.169

  No H/Q in entry =          13
  In of MODEL   38
    1    H    GLU  89           H        GLU  89   0.463  10.885  -1.150
    2    HA   GLU  89           HA       GLU  89  -0.646  13.188   0.069
    3    HB2  GLU  89           HB2      GLU  89  -1.754  10.944  -0.014
    4    HB3  GLU  89           HB3      GLU  89  -0.618  10.391   1.217
    5    HG2  GLU  89           HG2      GLU  89  -1.434  12.082   2.786
    6    HG3  GLU  89           HG3      GLU  89  -2.499  12.751   1.553

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LEU  90           H        LEU  90   1.825  10.905   1.219
    2    HA   LEU  90           HA       LEU  90   2.195  12.145   3.749
    3    HB2  LEU  90           HB2      LEU  90   3.963  10.383   2.053
    4    HB3  LEU  90           HB3      LEU  90   4.392  10.898   3.690
    5    HG   LEU  90           HG       LEU  90   1.758   9.542   3.046
    6   HD12  LEU  90          HD11      LEU  90   2.915   7.499   4.041
    7   HD11  LEU  90          HD12      LEU  90   4.432   8.362   3.789
    8   HD13  LEU  90          HD13      LEU  90   3.411   7.953   2.409
    9   HD22  LEU  90          HD21      LEU  90   1.507  10.459   5.172
   10   HD21  LEU  90          HD22      LEU  90   3.228  10.358   5.541
   11   HD23  LEU  90          HD23      LEU  90   2.228   8.907   5.593

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  91           H        ILE  91   3.772  12.542   0.610
    2    HA   ILE  91           HA       ILE  91   5.748  14.379   1.439
    3    HB   ILE  91           HB       ILE  91   4.417  13.890  -1.232
    4   HG12  ILE  91          HG12      ILE  91   7.259  13.411  -0.281
    5   HG13  ILE  91          HG13      ILE  91   5.984  12.208  -0.112
    6   HG22  ILE  91          HG21      ILE  91   6.630  15.247  -1.935
    7   HG21  ILE  91          HG22      ILE  91   6.328  16.043  -0.389
    8   HG23  ILE  91          HG23      ILE  91   5.096  16.070  -1.649
    9   HD13  ILE  91          HD11      ILE  91   5.794  11.890  -2.418
   10   HD12  ILE  91          HD12      ILE  91   7.529  12.139  -2.218
   11   HD11  ILE  91          HD13      ILE  91   6.509  13.459  -2.793

  No H/Q in entry =          11
  In of MODEL   38
    1    H    THR  92           H        THR  92   2.377  14.801   0.458
    2    HA   THR  92           HA       THR  92   2.340  17.625   0.405
    3    HB   THR  92           HB       THR  92   0.185  15.620   1.116
    4    HG1  THR  92           HG1      THR  92   0.474  15.448  -0.972
    5   HG22  THR  92          HG21      THR  92  -1.229  17.779   0.410
    6   HG21  THR  92          HG22      THR  92   0.165  18.607   1.099
    7   HG23  THR  92          HG23      THR  92  -0.764  17.480   2.085

  No H/Q in entry =           7
  In of MODEL   38
    1    H    GLU  93           H        GLU  93   1.820  15.316   3.057
    2    HA   GLU  93           HA       GLU  93   1.297  17.213   5.084
    3    HB2  GLU  93           HB2      GLU  93   2.622  14.492   5.303
    4    HB3  GLU  93           HB3      GLU  93   1.938  15.414   6.644
    5    HG2  GLU  93           HG2      GLU  93   0.310  14.636   4.216
    6    HG3  GLU  93           HG3      GLU  93   0.426  13.610   5.641

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LEU  94           H        LEU  94   4.300  15.744   3.908
    2    HA   LEU  94           HA       LEU  94   6.061  16.893   5.785
    3    HB2  LEU  94           HB2      LEU  94   6.444  15.934   2.948
    4    HB3  LEU  94           HB3      LEU  94   7.779  16.594   3.889
    5    HG   LEU  94           HG       LEU  94   6.056  14.390   5.032
    6   HD11  LEU  94          HD11      LEU  94   8.135  14.176   2.884
    7   HD13  LEU  94          HD12      LEU  94   6.695  13.197   3.154
    8   HD12  LEU  94          HD13      LEU  94   8.129  12.946   4.149
    9   HD23  LEU  94          HD21      LEU  94   8.256  13.858   6.166
   10   HD22  LEU  94          HD22      LEU  94   7.587  15.433   6.591
   11   HD21  LEU  94          HD23      LEU  94   8.917  15.320   5.438

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  95           H        ILE  95   4.893  18.069   2.647
    2    HA   ILE  95           HA       ILE  95   6.457  20.432   2.581
    3    HB   ILE  95           HB       ILE  95   3.805  19.742   1.294
    4   HG12  ILE  95          HG12      ILE  95   6.583  20.092   0.136
    5   HG13  ILE  95          HG13      ILE  95   5.944  18.535   0.652
    6   HG21  ILE  95          HG21      ILE  95   5.544  22.216   1.066
    7   HG23  ILE  95          HG22      ILE  95   3.822  22.141   1.436
    8   HG22  ILE  95          HG23      ILE  95   4.394  21.746  -0.186
    9   HD13  ILE  95          HD11      ILE  95   4.371  18.458  -1.065
   10   HD12  ILE  95          HD12      ILE  95   5.710  19.283  -1.861
   11   HD11  ILE  95          HD13      ILE  95   4.339  20.211  -1.256

  No H/Q in entry =          11
  In of MODEL   38
    1    H    GLU  96           H        GLU  96   3.220  19.765   3.900
    2    HA   GLU  96           HA       GLU  96   2.597  22.408   4.662
    3    HB2  GLU  96           HB2      GLU  96   0.929  20.620   4.683
    4    HB3  GLU  96           HB3      GLU  96   1.803  19.792   5.969
    5    HG2  GLU  96           HG2      GLU  96   0.791  21.068   7.550
    6    HG3  GLU  96           HG3      GLU  96   1.315  22.546   6.752

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LEU  97           H        LEU  97   4.461  19.860   6.267
    2    HA   LEU  97           HA       LEU  97   4.833  21.203   8.738
    3    HB2  LEU  97           HB2      LEU  97   6.366  19.043   7.306
    4    HB3  LEU  97           HB3      LEU  97   6.966  19.726   8.815
    5    HG   LEU  97           HG       LEU  97   4.157  18.624   8.524
    6   HD12  LEU  97          HD11      LEU  97   5.113  16.612   9.724
    7   HD11  LEU  97          HD12      LEU  97   6.720  17.249   9.369
    8   HD13  LEU  97          HD13      LEU  97   5.641  16.791   8.051
    9   HD23  LEU  97          HD21      LEU  97   4.631  18.325  11.084
   10   HD22  LEU  97          HD22      LEU  97   4.241  19.937  10.486
   11   HD21  LEU  97          HD23      LEU  97   5.917  19.502  10.817

  No H/Q in entry =          11
  In of MODEL   38
    1    H    HIS  98           H        HIS  98   6.680  21.232   5.698
    2    HA   HIS  98           HA       HIS  98   8.836  22.816   6.584
    3    HB2  HIS  98           HB2      HIS  98   7.523  22.564   3.868
    4    HB3  HIS  98           HB3      HIS  98   8.962  23.546   4.149
    5    HD1  HIS  98           HD1      HIS  98   7.761  19.972   4.170
    6    HD2  HIS  98           HD2      HIS  98  11.339  22.077   4.572
    7    HE1  HIS  98           HE1      HIS  98   9.620  18.248   4.094
    8    HE2  HIS  98           HE2      HIS  98  11.803  19.509   4.339

  No H/Q in entry =           8
  In of MODEL   38
    1    H    GLU  99           H        GLU  99   5.604  23.645   5.436
    2    HA   GLU  99           HA       GLU  99   5.975  26.461   5.382
    3    HB2  GLU  99           HB2      GLU  99   4.090  25.290   4.263
    4    HB3  GLU  99           HB3      GLU  99   3.408  24.922   5.847
    5    HG2  GLU  99           HG2      GLU  99   3.225  27.313   6.355
    6    HG3  GLU  99           HG3      GLU  99   3.988  27.718   4.821

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LYS 100           H        LYS 100   4.870  24.216   7.907
    2    HA   LYS 100           HA       LYS 100   4.293  26.264   9.811
    3    HB2  LYS 100           HB2      LYS 100   4.878  23.314  10.144
    4    HB3  LYS 100           HB3      LYS 100   4.439  24.382  11.483
    5    HG2  LYS 100           HG2      LYS 100   2.362  25.017  10.253
    6    HG3  LYS 100           HG3      LYS 100   2.782  23.853   8.994
    7    HD2  LYS 100           HD2      LYS 100   2.721  22.028  10.651
    8    HD3  LYS 100           HD3      LYS 100   2.318  23.186  11.921
    9    HE2  LYS 100           HE2      LYS 100   0.254  23.806  10.675
   10    HE3  LYS 100           HE3      LYS 100   0.648  22.590   9.453
   11    HZ1  LYS 100           HZ1      LYS 100   0.406  21.915  12.334
   12    HZ3  LYS 100           HZ2      LYS 100   0.382  20.864  10.997
   13    HZ2  LYS 100           HZ3      LYS 100  -0.933  21.900  11.290

  No H/Q in entry =          13
  In of MODEL   38
    1    H    LEU 101           H        LEU 101   7.214  24.478   8.949
    2    HA   LEU 101           HA       LEU 101   8.828  25.316  11.143
    3    HB2  LEU 101           HB2      LEU 101   9.403  24.338   8.358
    4    HB3  LEU 101           HB3      LEU 101  10.711  25.004   9.331
    5    HG   LEU 101           HG       LEU 101   8.892  22.841  10.403
    6   HD12  LEU 101          HD11      LEU 101  10.945  21.352   9.775
    7   HD11  LEU 101          HD12      LEU 101  11.300  22.618   8.603
    8   HD13  LEU 101          HD13      LEU 101   9.772  21.742   8.519
    9   HD21  LEU 101          HD21      LEU 101  11.619  23.953  11.112
   10   HD23  LEU 101          HD22      LEU 101  11.084  22.378  11.692
   11   HD22  LEU 101          HD23      LEU 101  10.192  23.831  12.141

  No H/Q in entry =          11
  In of MODEL   38
    1    H    LYS 102           H        LYS 102   7.224  27.182   9.019
    2    HA   LYS 102           HA       LYS 102   7.294  29.475   8.732
    3    HB2  LYS 102           HB2      LYS 102   8.875  29.358  10.818
    4    HB3  LYS 102           HB3      LYS 102  10.165  29.558   9.649
    5    HG2  LYS 102           HG2      LYS 102   8.063  31.505  10.532
    6    HG3  LYS 102           HG3      LYS 102   9.773  31.769  10.268
    7    HD2  LYS 102           HD2      LYS 102   7.804  31.348   7.982
    8    HD3  LYS 102           HD3      LYS 102   8.190  32.926   8.652
    9    HE2  LYS 102           HE2      LYS 102   9.549  31.750   6.565
   10    HE3  LYS 102           HE3      LYS 102  10.170  33.055   7.575
   11    HZ2  LYS 102           HZ1      LYS 102  11.693  31.154   7.383
   12    HZ1  LYS 102           HZ2      LYS 102  10.539  30.167   8.132
   13    HZ3  LYS 102           HZ3      LYS 102  11.235  31.453   8.989

  No H/Q in entry =          13
  In of MODEL   38
    1    H    ALA 103           H        ALA 103  10.549  28.144   8.139
    2    HA   ALA 103           HA       ALA 103  11.495  29.528   6.059
    3    HB2  ALA 103           HB1      ALA 103  12.377  27.318   5.119
    4    HB1  ALA 103           HB2      ALA 103  11.493  26.539   6.430
    5    HB3  ALA 103           HB3      ALA 103  12.783  27.684   6.796

  No H/Q in entry =           5
  In of MODEL   38
    1    H1   LYS   3           H1       LYS   3 -31.037   5.902 -19.938
    2    H2   LYS   3           H3       LYS   3 -30.031   5.599 -21.272
    3    H3   LYS   3           H2       LYS   3 -31.423   4.660 -21.028
    4    HA   LYS   3           HA       LYS   3 -30.432   3.295 -19.594
    5    HB2  LYS   3           HB2      LYS   3 -28.140   4.700 -20.916
    6    HB3  LYS   3           HB3      LYS   3 -27.825   3.510 -19.653
    7    HG2  LYS   3           HG2      LYS   3 -29.223   1.900 -21.000
    8    HG3  LYS   3           HG3      LYS   3 -29.168   3.083 -22.305
    9    HD2  LYS   3           HD2      LYS   3 -26.685   2.982 -22.223
   10    HD3  LYS   3           HD3      LYS   3 -26.813   1.699 -21.020
   11    HE2  LYS   3           HE2      LYS   3 -28.283   0.492 -22.739
   12    HE3  LYS   3           HE3      LYS   3 -27.654   1.658 -23.903
   13    HZ3  LYS   3           HZ1      LYS   3 -25.847   0.435 -24.133
   14    HZ2  LYS   3           HZ2      LYS   3 -26.485  -0.722 -23.066
   15    HZ1  LYS   3           HZ3      LYS   3 -25.509   0.534 -22.473

  No H/Q in entry =          15
  In of MODEL   38
    1    H    LYS   4           H        LYS   4 -30.509   3.181 -17.532
    2    HA   LYS   4           HA       LYS   4 -29.809   5.492 -15.904
    3    HB2  LYS   4           HB2      LYS   4 -31.008   2.804 -15.182
    4    HB3  LYS   4           HB3      LYS   4 -30.807   4.158 -14.071
    5    HG2  LYS   4           HG2      LYS   4 -32.584   4.056 -16.515
    6    HG3  LYS   4           HG3      LYS   4 -33.095   4.127 -14.830
    7    HD2  LYS   4           HD2      LYS   4 -32.411   6.356 -14.584
    8    HD3  LYS   4           HD3      LYS   4 -31.354   6.283 -15.994
    9    HE2  LYS   4           HE2      LYS   4 -33.279   7.643 -16.499
   10    HE3  LYS   4           HE3      LYS   4 -33.341   6.157 -17.447
   11    HZ3  LYS   4           HZ1      LYS   4 -34.933   5.260 -15.908
   12    HZ2  LYS   4           HZ2      LYS   4 -35.486   6.746 -16.519
   13    HZ1  LYS   4           HZ3      LYS   4 -34.848   6.658 -14.947

  No H/Q in entry =          13
  In of MODEL   38
    1    H    HIS   5           H        HIS   5 -28.361   5.604 -14.295
    2    HA   HIS   5           HA       HIS   5 -26.069   3.777 -14.573
    3    HB2  HIS   5           HB2      HIS   5 -26.347   6.547 -13.408
    4    HB3  HIS   5           HB3      HIS   5 -24.862   5.597 -13.360
    5    HD1  HIS   5           HD1      HIS   5 -23.376   6.779 -14.947
    6    HD2  HIS   5           HD2      HIS   5 -27.156   6.128 -16.540
    7    HE1  HIS   5           HE1      HIS   5 -23.179   7.327 -17.403
    8    HE2  HIS   5           HE2      HIS   5 -25.484   6.918 -18.342

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ILE   6           H        ILE   6 -25.853   2.223 -13.233
    2    HA   ILE   6           HA       ILE   6 -26.863   2.525 -10.485
    3    HB   ILE   6           HB       ILE   6 -26.014   0.040 -11.979
    4   HG12  ILE   6          HG12      ILE   6 -28.769   0.982 -11.174
    5   HG13  ILE   6          HG13      ILE   6 -28.107   1.123 -12.803
    6   HG23  ILE   6          HG21      ILE   6 -26.408  -1.188 -10.107
    7   HG22  ILE   6          HG22      ILE   6 -27.575  -0.035  -9.458
    8   HG21  ILE   6          HG23      ILE   6 -25.848   0.305  -9.350
    9   HD13  ILE   6          HD11      ILE   6 -28.556  -1.003 -13.280
   10   HD12  ILE   6          HD12      ILE   6 -29.590  -0.969 -11.851
   11   HD11  ILE   6          HD13      ILE   6 -27.936  -1.571 -11.730

  No H/Q in entry =          11
  In of MODEL   38
    1    H    TYR   7           H        TYR   7 -25.121   3.188  -9.186
    2    HA   TYR   7           HA       TYR   7 -22.400   2.226  -9.818
    3    HB2  TYR   7           HB2      TYR   7 -23.386   4.678  -8.383
    4    HB3  TYR   7           HB3      TYR   7 -21.700   4.166  -8.393
    5    HD1  TYR   7           HD1      TYR   7 -22.700   3.180 -11.483
    6    HD2  TYR   7           HD2      TYR   7 -22.063   6.783  -9.297
    7    HE1  TYR   7           HE1      TYR   7 -22.244   4.381 -13.585
    8    HE2  TYR   7           HE2      TYR   7 -21.649   7.990 -11.391
    9    HH   TYR   7           HH       TYR   7 -21.839   7.873 -13.625

  No H/Q in entry =           9
  In of MODEL   38
    1    H    LEU   8           H        LEU   8 -21.450   0.894  -8.460
    2    HA   LEU   8           HA       LEU   8 -22.612   0.433  -5.784
    3    HB2  LEU   8           HB2      LEU   8 -20.885  -1.252  -7.574
    4    HB3  LEU   8           HB3      LEU   8 -21.091  -1.611  -5.860
    5    HG   LEU   8           HG       LEU   8 -23.566  -1.793  -6.311
    6   HD13  LEU   8          HD11      LEU   8 -23.671  -0.605  -8.438
    7   HD12  LEU   8          HD12      LEU   8 -24.196  -2.274  -8.662
    8   HD11  LEU   8          HD13      LEU   8 -22.582  -1.780  -9.173
    9   HD23  LEU   8          HD21      LEU   8 -22.267  -3.855  -7.961
   10   HD22  LEU   8          HD22      LEU   8 -23.372  -4.005  -6.594
   11   HD21  LEU   8          HD23      LEU   8 -21.668  -3.646  -6.315

  No H/Q in entry =          11
  In of MODEL   38
    1    H    PHE   9           H        PHE   9 -21.364   0.859  -3.988
    2    HA   PHE   9           HA       PHE   9 -18.575   1.798  -4.469
    3    HB2  PHE   9           HB2      PHE   9 -20.649   2.878  -2.571
    4    HB3  PHE   9           HB3      PHE   9 -18.939   3.268  -2.453
    5    HD1  PHE   9           HD1      PHE   9 -17.812   4.549  -4.217
    6    HD2  PHE   9           HD2      PHE   9 -22.027   3.767  -4.376
    7    HE1  PHE   9           HE1      PHE   9 -18.064   6.265  -5.985
    8    HE2  PHE   9           HE2      PHE   9 -22.281   5.495  -6.138
    9    HZ   PHE   9           HZ       PHE   9 -20.297   6.740  -6.949

  No H/Q in entry =           9
  In of MODEL   38
    1    H    SER  10           H        SER  10 -16.987   0.859  -3.328
    2    HA   SER  10           HA       SER  10 -17.232  -0.012  -0.634
    3    HB2  SER  10           HB2      SER  10 -17.101  -2.380  -0.892
    4    HB3  SER  10           HB3      SER  10 -18.448  -1.845  -1.885
    5    HG   SER  10           HG       SER  10 -15.861  -2.021  -2.957

  No H/Q in entry =           5
  In of MODEL   38
    1    H    SER  11           H        SER  11 -15.220   0.118   0.217
    2    HA   SER  11           HA       SER  11 -13.025   0.949  -1.306
    3    HB2  SER  11           HB2      SER  11 -12.538  -0.402   1.293
    4    HB3  SER  11           HB3      SER  11 -11.909   1.124   0.671
    5    HG   SER  11           HG       SER  11 -13.659   1.089   2.393

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA  12           H        ALA  12 -14.206  -1.739  -2.104
    2    HA   ALA  12           HA       ALA  12 -11.625  -2.994  -2.598
    3    HB1  ALA  12           HB1      ALA  12 -13.842  -4.381  -1.092
    4    HB3  ALA  12           HB2      ALA  12 -12.155  -4.194  -0.618
    5    HB2  ALA  12           HB3      ALA  12 -12.579  -5.266  -1.951

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLY  13           H        GLY  13 -12.427  -1.968  -4.635
    2    HA3  GLY  13           HA2      GLY  13 -14.640  -2.706  -6.114
    3    HA2  GLY  13           HA3      GLY  13 -13.088  -2.251  -6.832

  No H/Q in entry =           3
  In of MODEL   38
    1    H    MET  14           H        MET  14 -11.586  -4.530  -5.829
    2    HA   MET  14           HA       MET  14 -11.950  -6.303  -7.941
    3    HB2  MET  14           HB2      MET  14  -9.888  -6.335  -6.623
    4    HB3  MET  14           HB3      MET  14 -10.747  -7.012  -5.241
    5    HG2  MET  14           HG2      MET  14 -11.305  -9.017  -6.597
    6    HG3  MET  14           HG3      MET  14 -10.417  -8.332  -7.959
    7    HE3  MET  14           HE1      MET  14  -6.965  -8.467  -7.434
    8    HE2  MET  14           HE2      MET  14  -7.475  -7.144  -6.385
    9    HE1  MET  14           HE3      MET  14  -8.337  -7.446  -7.893

  No H/Q in entry =           9
  In of MODEL   38
    1    H    SER  15           H        SER  15 -13.163  -6.786  -4.612
    2    HA   SER  15           HA       SER  15 -14.492  -9.240  -5.324
    3    HB2  SER  15           HB2      SER  15 -13.903  -8.793  -2.959
    4    HB3  SER  15           HB3      SER  15 -15.053  -7.458  -2.939
    5    HG   SER  15           HG       SER  15 -15.629  -9.844  -2.294

  No H/Q in entry =           5
  In of MODEL   38
    1    H    THR  16           H        THR  16 -15.594  -5.870  -4.956
    2    HA   THR  16           HA       THR  16 -18.378  -6.378  -5.498
    3    HB   THR  16           HB       THR  16 -16.817  -3.826  -6.030
    4    HG1  THR  16           HG1      THR  16 -16.397  -4.116  -3.966
    5   HG23  THR  16          HG21      THR  16 -19.118  -3.886  -6.903
    6   HG22  THR  16          HG22      THR  16 -18.998  -2.769  -5.532
    7   HG21  THR  16          HG23      THR  16 -19.707  -4.376  -5.320

  No H/Q in entry =           7
  In of MODEL   38
    1    H    SER  17           H        SER  17 -15.538  -5.833  -7.339
    2    HA   SER  17           HA       SER  17 -16.634  -5.131  -9.865
    3    HB2  SER  17           HB2      SER  17 -14.010  -6.415  -9.089
    4    HB3  SER  17           HB3      SER  17 -14.427  -6.050 -10.763
    5    HG   SER  17           HG       SER  17 -14.857  -3.958  -9.066

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU  18           H        LEU  18 -16.078  -8.254  -8.366
    2    HA   LEU  18           HA       LEU  18 -16.629  -9.788 -10.708
    3    HB2  LEU  18           HB2      LEU  18 -15.433 -10.719  -8.774
    4    HB3  LEU  18           HB3      LEU  18 -16.877 -10.515  -7.783
    5    HG   LEU  18           HG       LEU  18 -18.085 -12.106  -9.204
    6   HD13  LEU  18          HD11      LEU  18 -17.165 -11.940 -11.342
    7   HD12  LEU  18          HD12      LEU  18 -16.497 -13.469 -10.770
    8   HD11  LEU  18          HD13      LEU  18 -15.510 -12.010 -10.742
    9   HD23  LEU  18          HD21      LEU  18 -15.457 -13.229  -8.285
   10   HD22  LEU  18          HD22      LEU  18 -16.992 -14.083  -8.454
   11   HD21  LEU  18          HD23      LEU  18 -16.810 -12.832  -7.225

  No H/Q in entry =          11
  In of MODEL   38
    1    H    LEU  19           H        LEU  19 -18.637  -8.547  -8.040
    2    HA   LEU  19           HA       LEU  19 -21.086  -9.748  -8.889
    3    HB2  LEU  19           HB2      LEU  19 -20.838  -8.878  -6.645
    4    HB3  LEU  19           HB3      LEU  19 -20.570  -7.254  -7.277
    5    HG   LEU  19           HG       LEU  19 -22.934  -7.272  -8.105
    6   HD13  LEU  19          HD11      LEU  19 -24.471  -8.913  -7.162
    7   HD12  LEU  19          HD12      LEU  19 -23.131  -9.734  -6.362
    8   HD11  LEU  19          HD13      LEU  19 -23.235  -9.726  -8.121
    9   HD22  LEU  19          HD21      LEU  19 -22.336  -6.090  -6.110
   10   HD21  LEU  19          HD22      LEU  19 -22.398  -7.574  -5.158
   11   HD23  LEU  19          HD23      LEU  19 -23.879  -6.902  -5.843

  No H/Q in entry =          11
  In of MODEL   38
    1    H    VAL  20           H        VAL  20 -19.589  -6.594  -9.608
    2    HA   VAL  20           HA       VAL  20 -21.682  -5.579 -11.220
    3    HB   VAL  20           HB       VAL  20 -18.692  -4.984 -11.342
    4   HG12  VAL  20          HG11      VAL  20 -19.572  -2.837 -12.495
    5   HG11  VAL  20          HG12      VAL  20 -21.015  -3.790 -12.842
    6   HG13  VAL  20          HG13      VAL  20 -19.448  -4.305 -13.465
    7   HG21  VAL  20          HG21      VAL  20 -21.016  -3.764  -9.919
    8   HG23  VAL  20          HG22      VAL  20 -19.618  -2.781 -10.348
    9   HG22  VAL  20          HG23      VAL  20 -19.418  -4.187  -9.301

  No H/Q in entry =           9
  In of MODEL   38
    1    H    SER  21           H        SER  21 -18.905  -7.637 -12.181
    2    HA   SER  21           HA       SER  21 -19.653  -7.565 -14.943
    3    HB2  SER  21           HB2      SER  21 -18.207  -9.532 -15.231
    4    HB3  SER  21           HB3      SER  21 -17.394  -8.272 -14.304
    5    HG   SER  21           HG       SER  21 -17.730  -9.412 -12.460

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LYS  22           H        LYS  22 -20.747  -9.718 -12.356
    2    HA   LYS  22           HA       LYS  22 -22.258 -11.367 -14.176
    3    HB2  LYS  22           HB2      LYS  22 -21.498 -11.889 -11.735
    4    HB3  LYS  22           HB3      LYS  22 -22.977 -11.042 -11.288
    5    HG2  LYS  22           HG2      LYS  22 -24.322 -12.725 -11.984
    6    HG3  LYS  22           HG3      LYS  22 -23.249 -13.184 -13.306
    7    HD2  LYS  22           HD2      LYS  22 -21.749 -14.289 -11.739
    8    HD3  LYS  22           HD3      LYS  22 -22.759 -13.779 -10.386
    9    HE2  LYS  22           HE2      LYS  22 -24.618 -15.127 -11.261
   10    HE3  LYS  22           HE3      LYS  22 -23.616 -15.632 -12.622
   11    HZ1  LYS  22           HZ1      LYS  22 -22.093 -16.651 -10.989
   12    HZ3  LYS  22           HZ2      LYS  22 -23.640 -17.355 -11.010
   13    HZ2  LYS  22           HZ3      LYS  22 -23.209 -16.289  -9.760

  No H/Q in entry =          13
  In of MODEL   38
    1    H    MET  23           H        MET  23 -23.011  -8.420 -12.359
    2    HA   MET  23           HA       MET  23 -25.812  -8.510 -12.901
    3    HB2  MET  23           HB2      MET  23 -23.975  -6.191 -12.336
    4    HB3  MET  23           HB3      MET  23 -25.719  -6.028 -12.540
    5    HG2  MET  23           HG2      MET  23 -26.135  -7.304 -10.558
    6    HG3  MET  23           HG3      MET  23 -24.426  -7.712 -10.403
    7    HE2  MET  23           HE1      MET  23 -26.744  -4.047  -9.295
    8    HE1  MET  23           HE2      MET  23 -26.978  -5.035 -10.736
    9    HE3  MET  23           HE3      MET  23 -25.944  -3.608 -10.806

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ARG  24           H        ARG  24 -23.035  -7.103 -14.667
    2    HA   ARG  24           HA       ARG  24 -24.507  -5.831 -16.703
    3    HB2  ARG  24           HB2      ARG  24 -21.844  -5.949 -16.080
    4    HB3  ARG  24           HB3      ARG  24 -21.892  -7.005 -17.471
    5    HG2  ARG  24           HG2      ARG  24 -23.048  -4.191 -17.570
    6    HG3  ARG  24           HG3      ARG  24 -21.347  -4.555 -17.965
    7    HD2  ARG  24           HD2      ARG  24 -22.175  -6.308 -19.589
    8    HD3  ARG  24           HD3      ARG  24 -23.807  -5.743 -19.266
    9    HE   ARG  24           HE       ARG  24 -22.445  -3.524 -20.095
   10   HH21  ARG  24          HH11      ARG  24 -23.781  -2.661 -21.683
   11   HH22  ARG  24          HH12      ARG  24 -24.306  -3.657 -22.996
   12   HH11  ARG  24          HH21      ARG  24 -23.060  -6.574 -21.426
   13   HH12  ARG  24          HH22      ARG  24 -23.865  -5.969 -22.839

  No H/Q in entry =          13
  In of MODEL   38
    1    H    ALA  25           H        ALA  25 -23.387  -9.165 -16.368
    2    HA   ALA  25           HA       ALA  25 -23.980 -10.030 -19.002
    3    HB1  ALA  25           HB1      ALA  25 -23.294 -12.054 -18.271
    4    HB3  ALA  25           HB2      ALA  25 -24.370 -12.014 -16.874
    5    HB2  ALA  25           HB3      ALA  25 -22.816 -11.187 -16.811

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLN  26           H        GLN  26 -25.848 -10.029 -16.004
    2    HA   GLN  26           HA       GLN  26 -28.178 -11.245 -17.038
    3    HB2  GLN  26           HB2      GLN  26 -27.697  -9.468 -14.666
    4    HB3  GLN  26           HB3      GLN  26 -29.256 -10.194 -15.028
    5    HG2  GLN  26           HG2      GLN  26 -26.678 -11.646 -14.505
    6    HG3  GLN  26           HG3      GLN  26 -28.053 -11.528 -13.415
    7   HE21  GLN  26          HE21      GLN  26 -26.819 -13.710 -14.647
    8   HE22  GLN  26          HE22      GLN  26 -27.851 -14.767 -15.444

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ALA  27           H        ALA  27 -27.247  -7.843 -16.676
    2    HA   ALA  27           HA       ALA  27 -29.725  -6.759 -17.508
    3    HB1  ALA  27           HB1      ALA  27 -27.931  -5.431 -16.385
    4    HB3  ALA  27           HB2      ALA  27 -28.500  -4.683 -17.878
    5    HB2  ALA  27           HB3      ALA  27 -26.965  -5.551 -17.857

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLU  28           H        GLU  28 -26.999  -8.007 -19.324
    2    HA   GLU  28           HA       GLU  28 -27.898  -6.998 -21.869
    3    HB2  GLU  28           HB2      GLU  28 -25.529  -7.675 -21.204
    4    HB3  GLU  28           HB3      GLU  28 -26.073  -9.341 -21.392
    5    HG2  GLU  28           HG2      GLU  28 -24.898  -8.589 -23.354
    6    HG3  GLU  28           HG3      GLU  28 -26.592  -8.916 -23.722

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LYS  29           H        LYS  29 -28.090 -10.084 -20.176
    2    HA   LYS  29           HA       LYS  29 -29.367 -11.577 -22.182
    3    HB2  LYS  29           HB2      LYS  29 -28.346 -12.538 -20.151
    4    HB3  LYS  29           HB3      LYS  29 -29.630 -11.817 -19.183
    5    HG2  LYS  29           HG2      LYS  29 -31.277 -13.201 -20.256
    6    HG3  LYS  29           HG3      LYS  29 -30.063 -13.851 -21.357
    7    HD2  LYS  29           HD2      LYS  29 -28.945 -14.998 -19.593
    8    HD3  LYS  29           HD3      LYS  29 -29.869 -14.140 -18.361
    9    HE2  LYS  29           HE2      LYS  29 -30.618 -16.494 -18.705
   10    HE3  LYS  29           HE3      LYS  29 -31.891 -15.303 -18.981
   11    HZ1  LYS  29           HZ1      LYS  29 -31.293 -15.466 -21.399
   12    HZ3  LYS  29           HZ2      LYS  29 -32.024 -16.845 -20.727
   13    HZ2  LYS  29           HZ3      LYS  29 -30.349 -16.821 -21.001

  No H/Q in entry =          13
  In of MODEL   38
    1    H    TYR  30           H        TYR  30 -30.791  -9.441 -19.722
    2    HA   TYR  30           HA       TYR  30 -33.437  -9.904 -20.995
    3    HB2  TYR  30           HB2      TYR  30 -32.821  -8.718 -18.279
    4    HB3  TYR  30           HB3      TYR  30 -34.429  -8.982 -18.952
    5    HD1  TYR  30           HD1      TYR  30 -35.338 -11.277 -19.150
    6    HD2  TYR  30           HD2      TYR  30 -31.527 -10.537 -17.403
    7    HE1  TYR  30           HE1      TYR  30 -35.261 -13.595 -18.325
    8    HE2  TYR  30           HE2      TYR  30 -31.451 -12.840 -16.581
    9    HH   TYR  30           HH       TYR  30 -33.076 -15.213 -17.669

  No H/Q in entry =           9
  In of MODEL   38
    1    H    GLU  31           H        GLU  31 -31.259  -7.923 -21.789
    2    HA   GLU  31           HA       GLU  31 -31.173  -5.776 -22.636
    3    HB2  GLU  31           HB2      GLU  31 -34.061  -6.497 -23.180
    4    HB3  GLU  31           HB3      GLU  31 -33.209  -5.138 -23.914
    5    HG2  GLU  31           HG2      GLU  31 -31.721  -6.590 -25.068
    6    HG3  GLU  31           HG3      GLU  31 -32.299  -7.993 -24.171

  No H/Q in entry =           6
  In of MODEL   38
    1    H    VAL  32           H        VAL  32 -31.409  -5.642 -19.909
    2    HA   VAL  32           HA       VAL  32 -33.281  -3.521 -19.300
    3    HB   VAL  32           HB       VAL  32 -30.911  -4.495 -17.675
    4   HG12  VAL  32          HG11      VAL  32 -32.473  -3.650 -15.810
    5   HG11  VAL  32          HG12      VAL  32 -33.289  -2.762 -17.097
    6   HG13  VAL  32          HG13      VAL  32 -31.586  -2.453 -16.756
    7   HG21  VAL  32          HG21      VAL  32 -32.668  -6.225 -18.367
    8   HG23  VAL  32          HG22      VAL  32 -33.725  -5.385 -17.231
    9   HG22  VAL  32          HG23      VAL  32 -32.216  -6.100 -16.667

  No H/Q in entry =           9
  In of MODEL   38
    1    HA   PRO  33           HA       PRO  33 -30.228  -0.611 -20.966
    2    HB2  PRO  33           HB2      PRO  33 -31.743   1.611 -20.889
    3    HB3  PRO  33           HB3      PRO  33 -32.195   0.296 -21.974
    4    HG2  PRO  33           HG2      PRO  33 -33.203   0.845 -19.181
    5    HG3  PRO  33           HG3      PRO  33 -34.147   0.618 -20.654
    6    HD2  PRO  33           HD2      PRO  33 -33.712  -1.434 -18.958
    7    HD3  PRO  33           HD3      PRO  33 -33.750  -1.696 -20.701

  No H/Q in entry =           7
  In of MODEL   38
    1    H    VAL  34           H        VAL  34 -28.990  -1.131 -18.994
    2    HA   VAL  34           HA       VAL  34 -28.732   1.313 -17.371
    3    HB   VAL  34           HB       VAL  34 -28.177  -0.126 -15.407
    4   HG12  VAL  34          HG11      VAL  34 -30.592  -0.997 -15.124
    5   HG11  VAL  34          HG12      VAL  34 -30.887  -0.256 -16.695
    6   HG13  VAL  34          HG13      VAL  34 -30.354   0.737 -15.338
    7   HG21  VAL  34          HG21      VAL  34 -28.332  -2.174 -17.395
    8   HG23  VAL  34          HG22      VAL  34 -29.407  -2.522 -16.039
    9   HG22  VAL  34          HG23      VAL  34 -27.692  -2.229 -15.751

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ILE  35           H        ILE  35 -26.769   1.761 -16.508
    2    HA   ILE  35           HA       ILE  35 -24.444   0.421 -17.724
    3    HB   ILE  35           HB       ILE  35 -24.860   3.319 -16.952
    4   HG12  ILE  35          HG12      ILE  35 -23.841   1.984 -19.468
    5   HG13  ILE  35          HG13      ILE  35 -25.475   2.606 -19.238
    6   HG21  ILE  35          HG21      ILE  35 -22.291   1.787 -17.208
    7   HG23  ILE  35          HG22      ILE  35 -22.765   2.980 -15.999
    8   HG22  ILE  35          HG23      ILE  35 -22.361   3.496 -17.636
    9   HD11  ILE  35          HD11      ILE  35 -24.086   4.810 -18.642
   10   HD13  ILE  35          HD12      ILE  35 -24.600   4.406 -20.282
   11   HD12  ILE  35          HD13      ILE  35 -22.955   4.046 -19.759

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ILE  36           H        ILE  36 -23.235  -0.582 -16.097
    2    HA   ILE  36           HA       ILE  36 -23.715   0.065 -13.239
    3    HB   ILE  36           HB       ILE  36 -22.868  -2.648 -14.305
    4   HG12  ILE  36          HG12      ILE  36 -25.687  -1.839 -13.589
    5   HG13  ILE  36          HG13      ILE  36 -25.093  -1.837 -15.249
    6   HG23  ILE  36          HG21      ILE  36 -23.247  -3.454 -12.187
    7   HG22  ILE  36          HG22      ILE  36 -24.382  -2.167 -11.778
    8   HG21  ILE  36          HG23      ILE  36 -22.651  -1.834 -11.829
    9   HD13  ILE  36          HD11      ILE  36 -25.251  -4.053 -15.433
   10   HD12  ILE  36          HD12      ILE  36 -26.336  -3.918 -14.049
   11   HD11  ILE  36          HD13      ILE  36 -24.640  -4.332 -13.802

  No H/Q in entry =          11
  In of MODEL   38
    1    H    GLU  37           H        GLU  37 -21.950   0.711 -12.118
    2    HA   GLU  37           HA       GLU  37 -19.247  -0.091 -12.988
    3    HB2  GLU  37           HB2      GLU  37 -20.161   2.705 -12.334
    4    HB3  GLU  37           HB3      GLU  37 -18.469   2.216 -12.433
    5    HG2  GLU  37           HG2      GLU  37 -18.713   1.743 -14.786
    6    HG3  GLU  37           HG3      GLU  37 -20.430   2.138 -14.708

  No H/Q in entry =           6
  In of MODEL   38
    1    H    ALA  38           H        ALA  38 -17.782  -0.306 -11.283
    2    HA   ALA  38           HA       ALA  38 -18.851  -0.098  -8.529
    3    HB1  ALA  38           HB1      ALA  38 -17.114  -2.049  -9.909
    4    HB3  ALA  38           HB2      ALA  38 -18.182  -2.272  -8.523
    5    HB2  ALA  38           HB3      ALA  38 -16.574  -1.583  -8.296

  No H/Q in entry =           5
  In of MODEL   38
    1    H    PHE  39           H        PHE  39 -17.634   1.132  -7.053
    2    HA   PHE  39           HA       PHE  39 -15.101   2.331  -7.928
    3    HB2  PHE  39           HB2      PHE  39 -17.252   3.968  -6.602
    4    HB3  PHE  39           HB3      PHE  39 -15.739   4.531  -7.307
    5    HD1  PHE  39           HD1      PHE  39 -15.584   5.113  -9.566
    6    HD2  PHE  39           HD2      PHE  39 -19.059   3.124  -8.098
    7    HE1  PHE  39           HE1      PHE  39 -16.743   5.584 -11.706
    8    HE2  PHE  39           HE2      PHE  39 -20.224   3.580 -10.227
    9    HZ   PHE  39           HZ       PHE  39 -19.063   4.782 -12.047

  No H/Q in entry =           9
  In of MODEL   38
    1    HA   PRO  40           HA       PRO  40 -14.218   1.630  -3.621
    2    HB2  PRO  40           HB2      PRO  40 -12.466   3.657  -3.014
    3    HB3  PRO  40           HB3      PRO  40 -12.003   2.316  -4.061
    4    HG2  PRO  40           HG2      PRO  40 -13.029   5.039  -4.851
    5    HG3  PRO  40           HG3      PRO  40 -11.591   4.198  -5.429
    6    HD2  PRO  40           HD2      PRO  40 -13.793   4.084  -6.867
    7    HD3  PRO  40           HD3      PRO  40 -12.836   2.620  -6.647

  No H/Q in entry =           7
  In of MODEL   38
    1    H    GLU  41           H        GLU  41 -14.872   2.629  -1.511
    2    HA   GLU  41           HA       GLU  41 -17.123   4.323  -1.545
    3    HB2  GLU  41           HB2      GLU  41 -17.135   4.124   0.768
    4    HB3  GLU  41           HB3      GLU  41 -16.304   2.653   0.261
    5    HG2  GLU  41           HG2      GLU  41 -15.025   5.156   1.359
    6    HG3  GLU  41           HG3      GLU  41 -15.223   3.620   2.203

  No H/Q in entry =           6
  In of MODEL   38
    1    H    THR  42           H        THR  42 -13.796   5.255  -1.562
    2    HA   THR  42           HA       THR  42 -14.177   7.828  -0.385
    3    HB   THR  42           HB       THR  42 -12.010   8.399  -1.477
    4    HG1  THR  42           HG1      THR  42 -12.560   6.946  -3.325
    5   HG22  THR  42          HG21      THR  42 -11.949   5.628  -0.264
    6   HG21  THR  42          HG22      THR  42 -12.157   7.103   0.685
    7   HG23  THR  42          HG23      THR  42 -10.670   6.843  -0.225

  No H/Q in entry =           7
  In of MODEL   38
    1    H    LEU  43           H        LEU  43 -15.034   6.694  -3.485
    2    HA   LEU  43           HA       LEU  43 -15.286   9.453  -4.491
    3    HB2  LEU  43           HB2      LEU  43 -15.609   6.785  -5.854
    4    HB3  LEU  43           HB3      LEU  43 -15.835   8.350  -6.633
    5    HG   LEU  43           HG       LEU  43 -13.223   7.270  -5.600
    6   HD11  LEU  43          HD11      LEU  43 -14.332   6.249  -7.707
    7   HD13  LEU  43          HD12      LEU  43 -12.653   6.779  -7.801
    8   HD12  LEU  43          HD13      LEU  43 -13.934   7.792  -8.463
    9   HD22  LEU  43          HD21      LEU  43 -13.103   9.614  -5.446
   10   HD21  LEU  43          HD22      LEU  43 -14.043   9.848  -6.920
   11   HD23  LEU  43          HD23      LEU  43 -12.389   9.246  -7.015

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ALA  44           H        ALA  44 -17.249   7.641  -2.642
    2    HA   ALA  44           HA       ALA  44 -19.708   7.472  -3.996
    3    HB2  ALA  44           HB1      ALA  44 -19.592   6.381  -1.885
    4    HB3  ALA  44           HB2      ALA  44 -20.709   7.723  -1.644
    5    HB1  ALA  44           HB3      ALA  44 -19.047   7.846  -1.070

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLY  45           H        GLY  45 -18.322  10.298  -2.478
    2    HA3  GLY  45           HA2      GLY  45 -20.761  11.781  -2.889
    3    HA2  GLY  45           HA3      GLY  45 -19.227  12.420  -2.299

  No H/Q in entry =           3
  In of MODEL   38
    1    H    GLU  46           H        GLU  46 -17.661  11.464  -4.557
    2    HA   GLU  46           HA       GLU  46 -18.284  13.655  -6.361
    3    HB2  GLU  46           HB2      GLU  46 -15.963  12.355  -5.546
    4    HB3  GLU  46           HB3      GLU  46 -16.188  11.829  -7.215
    5    HG2  GLU  46           HG2      GLU  46 -16.194  14.716  -6.376
    6    HG3  GLU  46           HG3      GLU  46 -14.741  13.855  -6.887

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LYS  47           H        LYS  47 -18.142  10.132  -6.752
    2    HA   LYS  47           HA       LYS  47 -19.205  10.315  -9.445
    3    HB2  LYS  47           HB2      LYS  47 -18.130   8.199  -7.687
    4    HB3  LYS  47           HB3      LYS  47 -19.401   7.689  -8.799
    5    HG2  LYS  47           HG2      LYS  47 -17.133   7.351  -9.688
    6    HG3  LYS  47           HG3      LYS  47 -18.112   8.427 -10.682
    7    HD2  LYS  47           HD2      LYS  47 -17.016  10.356  -9.812
    8    HD3  LYS  47           HD3      LYS  47 -16.190   9.402  -8.582
    9    HE2  LYS  47           HE2      LYS  47 -14.607   9.850 -10.289
   10    HE3  LYS  47           HE3      LYS  47 -15.067   8.156 -10.450
   11    HZ1  LYS  47           HZ1      LYS  47 -16.844   9.235 -12.044
   12    HZ3  LYS  47           HZ2      LYS  47 -15.295   8.794 -12.581
   13    HZ2  LYS  47           HZ3      LYS  47 -15.632  10.415 -12.197

  No H/Q in entry =          13
  In of MODEL   38
    1    H    GLY  48           H        GLY  48 -20.567   9.589  -6.306
    2    HA3  GLY  48           HA2      GLY  48 -22.937   8.383  -7.065
    3    HA2  GLY  48           HA3      GLY  48 -22.735   9.395  -5.635

  No H/Q in entry =           3
  In of MODEL   38
    1    H    GLN  49           H        GLN  49 -22.142  11.802  -7.227
    2    HA   GLN  49           HA       GLN  49 -24.705  12.900  -7.419
    3    HB2  GLN  49           HB2      GLN  49 -22.147  13.759  -8.755
    4    HB3  GLN  49           HB3      GLN  49 -23.614  14.718  -8.702
    5    HG2  GLN  49           HG2      GLN  49 -23.488  14.772  -6.264
    6    HG3  GLN  49           HG3      GLN  49 -22.034  13.791  -6.314
    7   HE21  GLN  49          HE21      GLN  49 -21.944  16.036  -5.067
    8   HE22  GLN  49          HE22      GLN  49 -21.018  17.289  -5.717

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ASN  50           H        ASN  50 -22.985  10.999  -9.760
    2    HA   ASN  50           HA       ASN  50 -24.844  11.838 -11.878
    3    HB2  ASN  50           HB2      ASN  50 -22.254  10.307 -12.058
    4    HB3  ASN  50           HB3      ASN  50 -23.287  10.712 -13.421
    5   HD21  ASN  50          HD21      ASN  50 -20.677  11.589 -11.785
    6   HD22  ASN  50          HD22      ASN  50 -20.446  13.222 -12.144

  No H/Q in entry =           6
  In of MODEL   38
    1    H    ALA  51           H        ALA  51 -24.850   9.509  -9.603
    2    HA   ALA  51           HA       ALA  51 -25.600   7.339 -11.414
    3    HB2  ALA  51           HB1      ALA  51 -25.033   6.012  -9.704
    4    HB3  ALA  51           HB2      ALA  51 -26.173   6.828  -8.636
    5    HB1  ALA  51           HB3      ALA  51 -24.535   7.454  -8.820

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ASP  52           H        ASP  52 -27.603   6.277 -11.289
    2    HA   ASP  52           HA       ASP  52 -29.800   8.109 -10.676
    3    HB2  ASP  52           HB2      ASP  52 -29.576   5.585 -12.312
    4    HB3  ASP  52           HB3      ASP  52 -31.130   6.317 -11.907

  No H/Q in entry =           4
  In of MODEL   38
    1    H    VAL  53           H        VAL  53 -28.202   5.238  -9.603
    2    HA   VAL  53           HA       VAL  53 -29.677   5.390  -7.108
    3    HB   VAL  53           HB       VAL  53 -31.053   3.729  -8.351
    4   HG11  VAL  53          HG11      VAL  53 -29.282   2.857  -9.839
    5   HG13  VAL  53          HG12      VAL  53 -30.123   1.570  -8.976
    6   HG12  VAL  53          HG13      VAL  53 -28.522   2.083  -8.450
    7   HG23  VAL  53          HG21      VAL  53 -30.247   1.774  -6.624
    8   HG22  VAL  53          HG22      VAL  53 -31.386   3.079  -6.289
    9   HG21  VAL  53          HG23      VAL  53 -29.685   3.262  -5.861

  No H/Q in entry =           9
  In of MODEL   38
    1    H    VAL  54           H        VAL  54 -28.384   4.981  -5.431
    2    HA   VAL  54           HA       VAL  54 -25.614   4.134  -5.995
    3    HB   VAL  54           HB       VAL  54 -26.719   5.935  -3.781
    4   HG11  VAL  54          HG11      VAL  54 -24.133   4.521  -4.020
    5   HG13  VAL  54          HG12      VAL  54 -24.908   5.215  -2.597
    6   HG12  VAL  54          HG13      VAL  54 -23.990   6.248  -3.693
    7   HG22  VAL  54          HG21      VAL  54 -25.851   7.739  -4.890
    8   HG21  VAL  54          HG22      VAL  54 -26.378   6.731  -6.238
    9   HG23  VAL  54          HG23      VAL  54 -24.677   6.766  -5.778

  No H/Q in entry =           9
  In of MODEL   38
    1    H    LEU  55           H        LEU  55 -25.025   2.222  -5.321
    2    HA   LEU  55           HA       LEU  55 -26.558   0.933  -3.151
    3    HB2  LEU  55           HB2      LEU  55 -24.968  -0.258  -5.411
    4    HB3  LEU  55           HB3      LEU  55 -25.743  -1.179  -4.121
    5    HG   LEU  55           HG       LEU  55 -27.156   0.378  -6.277
    6   HD13  LEU  55          HD11      LEU  55 -26.834  -1.488  -7.470
    7   HD12  LEU  55          HD12      LEU  55 -27.805  -2.351  -6.278
    8   HD11  LEU  55          HD13      LEU  55 -26.052  -2.280  -6.103
    9   HD23  LEU  55          HD21      LEU  55 -28.470  -1.549  -4.416
   10   HD22  LEU  55          HD22      LEU  55 -29.157  -0.179  -5.289
   11   HD21  LEU  55          HD23      LEU  55 -28.157   0.097  -3.863

  No H/Q in entry =          11
  In of MODEL   38
    1    H    LEU  56           H        LEU  56 -25.430   0.364  -1.323
    2    HA   LEU  56           HA       LEU  56 -22.496   0.766  -1.338
    3    HB2  LEU  56           HB2      LEU  56 -24.330   0.579   1.039
    4    HB3  LEU  56           HB3      LEU  56 -22.622   1.013   1.045
    5    HG   LEU  56           HG       LEU  56 -24.912   2.674   0.031
    6   HD11  LEU  56          HD11      LEU  56 -23.830   2.325   2.570
    7   HD13  LEU  56          HD12      LEU  56 -24.817   3.685   2.034
    8   HD12  LEU  56          HD13      LEU  56 -23.059   3.793   1.970
    9   HD23  LEU  56          HD21      LEU  56 -22.968   4.375  -0.158
   10   HD22  LEU  56          HD22      LEU  56 -23.331   3.261  -1.476
   11   HD21  LEU  56          HD23      LEU  56 -21.991   2.925  -0.381

  No H/Q in entry =          11
  In of MODEL   38
    1    H    GLY  57           H        GLY  57 -21.119  -0.854  -0.766
    2    HA3  GLY  57           HA2      GLY  57 -22.035  -3.545  -0.942
    3    HA2  GLY  57           HA3      GLY  57 -20.418  -3.041  -0.453

  No H/Q in entry =           3
  In of MODEL   38
    1    HA   PRO  58           HA       PRO  58 -23.274  -4.041   3.235
    2    HB2  PRO  58           HB2      PRO  58 -22.592  -6.637   3.883
    3    HB3  PRO  58           HB3      PRO  58 -23.963  -6.244   2.847
    4    HG2  PRO  58           HG2      PRO  58 -21.223  -7.128   2.108
    5    HG3  PRO  58           HG3      PRO  58 -22.778  -7.600   1.421
    6    HD2  PRO  58           HD2      PRO  58 -21.157  -5.794   0.198
    7    HD3  PRO  58           HD3      PRO  58 -22.915  -5.712   0.071

  No H/Q in entry =           7
  In of MODEL   38
    1    H    GLN  59           H        GLN  59 -19.894  -4.513   2.680
    2    HA   GLN  59           HA       GLN  59 -19.176  -4.496   5.451
    3    HB2  GLN  59           HB2      GLN  59 -17.565  -3.685   3.026
    4    HB3  GLN  59           HB3      GLN  59 -16.924  -3.844   4.648
    5    HG2  GLN  59           HG2      GLN  59 -18.144  -6.071   3.026
    6    HG3  GLN  59           HG3      GLN  59 -16.423  -5.783   3.225
    7   HE21  GLN  59          HE21      GLN  59 -18.749  -7.458   4.216
    8   HE22  GLN  59          HE22      GLN  59 -18.494  -8.145   5.709

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ILE  60           H        ILE  60 -20.086  -1.974   3.200
    2    HA   ILE  60           HA       ILE  60 -19.264   0.010   5.232
    3    HB   ILE  60           HB       ILE  60 -19.485   1.715   3.377
    4   HG12  ILE  60          HG12      ILE  60 -19.242  -0.549   1.439
    5   HG13  ILE  60          HG13      ILE  60 -20.837   0.008   1.942
    6   HG23  ILE  60          HG21      ILE  60 -17.314   1.436   2.650
    7   HG22  ILE  60          HG22      ILE  60 -17.435  -0.323   2.655
    8   HG21  ILE  60          HG23      ILE  60 -17.360   0.559   4.179
    9   HD13  ILE  60          HD11      ILE  60 -20.499   1.282   0.039
   10   HD12  ILE  60          HD12      ILE  60 -18.763   1.418   0.311
   11   HD11  ILE  60          HD13      ILE  60 -19.885   2.373   1.280

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ALA  61           H        ALA  61 -21.717  -1.580   5.287
    2    HA   ALA  61           HA       ALA  61 -23.940   0.074   4.779
    3    HB1  ALA  61           HB1      ALA  61 -25.171  -1.402   6.106
    4    HB2  ALA  61           HB2      ALA  61 -23.786  -1.776   7.132
    5    HB3  ALA  61           HB3      ALA  61 -23.858  -2.403   5.486

  No H/Q in entry =           5
  In of MODEL   38
    1    H    TYR  62           H        TYR  62 -21.771   0.001   7.608
    2    HA   TYR  62           HA       TYR  62 -23.352   1.675   9.237
    3    HB2  TYR  62           HB2      TYR  62 -21.342   2.102  10.504
    4    HB3  TYR  62           HB3      TYR  62 -21.363   0.404  10.029
    5    HD1  TYR  62           HD1      TYR  62 -19.705  -0.481   8.464
    6    HD2  TYR  62           HD2      TYR  62 -19.673   3.653   9.548
    7    HE1  TYR  62           HE1      TYR  62 -17.478  -0.233   7.437
    8    HE2  TYR  62           HE2      TYR  62 -17.431   3.895   8.522
    9    HH   TYR  62           HH       TYR  62 -16.135   1.564   6.477

  No H/Q in entry =           9
  In of MODEL   38
    1    H    MET  63           H        MET  63 -21.672   2.502   6.392
    2    HA   MET  63           HA       MET  63 -21.518   5.343   7.054
    3    HB2  MET  63           HB2      MET  63 -20.874   3.789   4.547
    4    HB3  MET  63           HB3      MET  63 -20.689   5.536   4.706
    5    HG2  MET  63           HG2      MET  63 -18.998   5.223   6.409
    6    HG3  MET  63           HG3      MET  63 -19.204   3.475   6.312
    7    HE3  MET  63           HE1      MET  63 -18.620   6.106   2.906
    8    HE2  MET  63           HE2      MET  63 -17.121   6.389   3.792
    9    HE1  MET  63           HE3      MET  63 -18.676   6.604   4.598

  No H/Q in entry =           9
  In of MODEL   38
    1    H    LEU  64           H        LEU  64 -24.067   3.473   6.078
    2    HA   LEU  64           HA       LEU  64 -25.251   4.864   3.966
    3    HB2  LEU  64           HB2      LEU  64 -26.129   2.769   4.899
    4    HB3  LEU  64           HB3      LEU  64 -26.607   3.629   6.362
    5    HG   LEU  64           HG       LEU  64 -28.286   4.866   5.096
    6   HD13  LEU  64          HD11      LEU  64 -27.975   5.080   2.865
    7   HD12  LEU  64          HD12      LEU  64 -28.616   3.443   2.731
    8   HD11  LEU  64          HD13      LEU  64 -26.875   3.704   2.809
    9   HD23  LEU  64          HD21      LEU  64 -28.792   2.044   4.376
   10   HD22  LEU  64          HD22      LEU  64 -29.794   3.188   5.269
   11   HD21  LEU  64          HD23      LEU  64 -28.428   2.405   6.064

  No H/Q in entry =          11
  In of MODEL   38
    1    HA   PRO  65           HA       PRO  65 -27.470   8.050   6.650
    2    HB2  PRO  65           HB2      PRO  65 -25.499   8.237   8.928
    3    HB3  PRO  65           HB3      PRO  65 -27.239   8.517   8.948
    4    HG2  PRO  65           HG2      PRO  65 -26.320   6.275   9.914
    5    HG3  PRO  65           HG3      PRO  65 -27.725   6.228   8.851
    6    HD2  PRO  65           HD2      PRO  65 -24.844   5.607   8.194
    7    HD3  PRO  65           HD3      PRO  65 -26.295   4.715   7.737

  No H/Q in entry =           7
  In of MODEL   38
    1    H    GLU  66           H        GLU  66 -23.915   7.997   6.770
    2    HA   GLU  66           HA       GLU  66 -23.613  10.790   6.336
    3    HB2  GLU  66           HB2      GLU  66 -21.791   8.475   5.736
    4    HB3  GLU  66           HB3      GLU  66 -21.339  10.164   5.513
    5    HG2  GLU  66           HG2      GLU  66 -21.581  10.564   7.873
    6    HG3  GLU  66           HG3      GLU  66 -22.109   8.900   8.118

  No H/Q in entry =           6
  In of MODEL   38
    1    H    ILE  67           H        ILE  67 -23.686   8.017   4.116
    2    HA   ILE  67           HA       ILE  67 -23.239   9.698   1.807
    3    HB   ILE  67           HB       ILE  67 -24.142   6.793   2.011
    4   HG12  ILE  67          HG12      ILE  67 -21.499   7.950   1.109
    5   HG13  ILE  67          HG13      ILE  67 -21.816   7.551   2.796
    6   HG21  ILE  67          HG21      ILE  67 -24.055   8.644  -0.236
    7   HG23  ILE  67          HG22      ILE  67 -24.680   6.997  -0.173
    8   HG22  ILE  67          HG23      ILE  67 -22.968   7.276  -0.483
    9   HD12  ILE  67          HD11      ILE  67 -21.367   5.751   0.473
   10   HD11  ILE  67          HD12      ILE  67 -22.398   5.195   1.790
   11   HD13  ILE  67          HD13      ILE  67 -20.730   5.662   2.115

  No H/Q in entry =          11
  In of MODEL   38
    1    H    GLN  68           H        GLN  68 -26.131   8.665   3.416
    2    HA   GLN  68           HA       GLN  68 -27.934   9.574   1.408
    3    HB2  GLN  68           HB2      GLN  68 -28.228   9.253   4.392
    4    HB3  GLN  68           HB3      GLN  68 -29.534   9.838   3.375
    5    HG2  GLN  68           HG2      GLN  68 -29.548   7.791   2.123
    6    HG3  GLN  68           HG3      GLN  68 -28.110   7.223   2.950
    7   HE21  GLN  68          HE21      GLN  68 -30.289   5.867   2.804
    8   HE22  GLN  68          HE22      GLN  68 -31.137   5.430   4.213

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ARG  69           H        ARG  69 -26.360  11.271   4.145
    2    HA   ARG  69           HA       ARG  69 -27.714  13.751   3.692
    3    HB2  ARG  69           HB2      ARG  69 -25.391  12.835   5.321
    4    HB3  ARG  69           HB3      ARG  69 -25.462  14.550   4.942
    5    HG2  ARG  69           HG2      ARG  69 -27.791  14.611   5.883
    6    HG3  ARG  69           HG3      ARG  69 -27.592  12.925   6.379
    7    HD2  ARG  69           HD2      ARG  69 -25.905  15.287   7.286
    8    HD3  ARG  69           HD3      ARG  69 -27.049  14.396   8.277
    9    HE   ARG  69           HE       ARG  69 -24.428  13.448   7.372
   10   HH21  ARG  69          HH11      ARG  69 -23.640  11.696   8.600
   11   HH22  ARG  69          HH12      ARG  69 -24.685  10.896   9.725
   12   HH11  ARG  69          HH21      ARG  69 -27.408  12.928   9.039
   13   HH12  ARG  69          HH22      ARG  69 -26.818  11.592   9.971

  No H/Q in entry =          13
  In of MODEL   38
    1    H    LEU  70           H        LEU  70 -24.830  12.321   2.385
    2    HA   LEU  70           HA       LEU  70 -23.694  14.669   1.204
    3    HB2  LEU  70           HB2      LEU  70 -22.714  12.356   1.838
    4    HB3  LEU  70           HB3      LEU  70 -23.311  11.872   0.251
    5    HG   LEU  70           HG       LEU  70 -21.700  13.227  -0.830
    6   HD11  LEU  70          HD11      LEU  70 -20.910  14.102   1.957
    7   HD13  LEU  70          HD12      LEU  70 -21.586  15.123   0.688
    8   HD12  LEU  70          HD13      LEU  70 -19.974  14.434   0.497
    9   HD22  LEU  70          HD21      LEU  70 -20.275  11.510  -0.559
   10   HD21  LEU  70          HD22      LEU  70 -21.220  11.007   0.842
   11   HD23  LEU  70          HD23      LEU  70 -19.834  12.077   1.051

  No H/Q in entry =          11
  In of MODEL   38
    1    H    LEU  71           H        LEU  71 -25.842  12.119   0.092
    2    HA   LEU  71           HA       LEU  71 -26.331  13.579  -2.449
    3    HB2  LEU  71           HB2      LEU  71 -26.554  10.601  -1.970
    4    HB3  LEU  71           HB3      LEU  71 -26.660  11.443  -3.515
    5    HG   LEU  71           HG       LEU  71 -24.160  11.466  -1.822
    6   HD12  LEU  71          HD11      LEU  71 -24.189   9.810  -4.236
    7   HD11  LEU  71          HD12      LEU  71 -25.218   9.205  -2.938
    8   HD13  LEU  71          HD13      LEU  71 -23.502   9.481  -2.645
    9   HD22  LEU  71          HD21      LEU  71 -24.236  13.265  -3.338
   10   HD21  LEU  71          HD22      LEU  71 -24.722  12.209  -4.665
   11   HD23  LEU  71          HD23      LEU  71 -23.110  12.063  -3.964

  No H/Q in entry =          11
  In of MODEL   38
    1    HA   PRO  72           HA       PRO  72 -30.231  13.179   0.129
    2    HB2  PRO  72           HB2      PRO  72 -31.074  15.743   0.007
    3    HB3  PRO  72           HB3      PRO  72 -29.780  15.298   1.120
    4    HG2  PRO  72           HG2      PRO  72 -29.554  16.459  -1.646
    5    HG3  PRO  72           HG3      PRO  72 -28.803  17.024  -0.154
    6    HD2  PRO  72           HD2      PRO  72 -27.453  15.437  -1.884
    7    HD3  PRO  72           HD3      PRO  72 -27.220  15.289  -0.143

  No H/Q in entry =           7
  In of MODEL   38
    1    H    ASN  73           H        ASN  73 -29.563  14.092  -3.088
    2    HA   ASN  73           HA       ASN  73 -32.416  13.792  -3.753
    3    HB2  ASN  73           HB2      ASN  73 -31.918  14.870  -5.857
    4    HB3  ASN  73           HB3      ASN  73 -31.407  15.864  -4.501
    5   HD21  ASN  73          HD21      ASN  73 -30.577  15.872  -7.169
    6   HD22  ASN  73          HD22      ASN  73 -28.908  15.699  -7.338

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LYS  74           H        LYS  74 -30.455  11.530  -3.276
    2    HA   LYS  74           HA       LYS  74 -31.000  10.108  -5.815
    3    HB2  LYS  74           HB2      LYS  74 -28.489   9.820  -4.159
    4    HB3  LYS  74           HB3      LYS  74 -28.859   8.991  -5.672
    5    HG2  LYS  74           HG2      LYS  74 -28.577  11.962  -5.501
    6    HG3  LYS  74           HG3      LYS  74 -27.206  10.887  -5.776
    7    HD2  LYS  74           HD2      LYS  74 -28.306   9.944  -7.722
    8    HD3  LYS  74           HD3      LYS  74 -29.723  10.954  -7.432
    9    HE2  LYS  74           HE2      LYS  74 -28.478  12.946  -7.882
   10    HE3  LYS  74           HE3      LYS  74 -26.962  12.045  -7.944
   11    HZ2  LYS  74           HZ1      LYS  74 -28.402  12.632 -10.095
   12    HZ1  LYS  74           HZ2      LYS  74 -29.072  11.118  -9.712
   13    HZ3  LYS  74           HZ3      LYS  74 -27.402  11.264  -9.990

  No H/Q in entry =          13
  In of MODEL   38
    1    HA   PRO  75           HA       PRO  75 -32.452   7.169  -2.826
    2    HB2  PRO  75           HB2      PRO  75 -32.759   4.934  -4.385
    3    HB3  PRO  75           HB3      PRO  75 -33.873   6.296  -4.485
    4    HG2  PRO  75           HG2      PRO  75 -31.519   5.661  -6.219
    5    HG3  PRO  75           HG3      PRO  75 -33.158   6.104  -6.693
    6    HD2  PRO  75           HD2      PRO  75 -31.204   7.955  -6.647
    7    HD3  PRO  75           HD3      PRO  75 -32.839   8.374  -6.134

  No H/Q in entry =           7
  In of MODEL   38
    1    H    VAL  76           H        VAL  76 -31.025   6.120  -1.422
    2    HA   VAL  76           HA       VAL  76 -28.555   4.879  -2.484
    3    HB   VAL  76           HB       VAL  76 -28.865   6.380   0.152
    4   HG11  VAL  76          HG11      VAL  76 -26.502   5.058  -1.194
    5   HG13  VAL  76          HG12      VAL  76 -27.221   4.632   0.361
    6   HG12  VAL  76          HG13      VAL  76 -26.361   6.160   0.177
    7   HG22  VAL  76          HG21      VAL  76 -28.171   8.265  -0.749
    8   HG21  VAL  76          HG22      VAL  76 -28.700   7.554  -2.275
    9   HG23  VAL  76          HG23      VAL  76 -27.005   7.459  -1.798

  No H/Q in entry =           9
  In of MODEL   38
    1    H    GLU  77           H        GLU  77 -28.362   2.731  -1.841
    2    HA   GLU  77           HA       GLU  77 -29.188   1.982   0.811
    3    HB2  GLU  77           HB2      GLU  77 -30.801   0.340   0.280
    4    HB3  GLU  77           HB3      GLU  77 -31.329   1.858  -0.447
    5    HG2  GLU  77           HG2      GLU  77 -30.699   1.069  -2.618
    6    HG3  GLU  77           HG3      GLU  77 -30.077  -0.424  -1.918

  No H/Q in entry =           6
  In of MODEL   38
    1    H    VAL  78           H        VAL  78 -28.885  -0.099   1.501
    2    HA   VAL  78           HA       VAL  78 -26.214  -0.901   0.656
    3    HB   VAL  78           HB       VAL  78 -27.958  -1.743   3.010
    4   HG11  VAL  78          HG11      VAL  78 -25.614  -3.002   1.930
    5   HG13  VAL  78          HG12      VAL  78 -26.543  -3.449   3.362
    6   HG12  VAL  78          HG13      VAL  78 -25.217  -2.295   3.496
    7   HG22  VAL  78          HG21      VAL  78 -26.507  -0.374   4.350
    8   HG21  VAL  78          HG22      VAL  78 -27.219   0.584   3.053
    9   HG23  VAL  78          HG23      VAL  78 -25.544   0.044   2.932

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ILE  79           H        ILE  79 -25.679  -2.823  -0.219
    2    HA   ILE  79           HA       ILE  79 -27.733  -4.303  -1.575
    3    HB   ILE  79           HB       ILE  79 -24.749  -4.848  -1.309
    4   HG12  ILE  79          HG12      ILE  79 -26.348  -3.762  -3.632
    5   HG13  ILE  79          HG13      ILE  79 -25.481  -2.743  -2.480
    6   HG22  ILE  79          HG21      ILE  79 -25.830  -6.049  -3.627
    7   HG21  ILE  79          HG22      ILE  79 -26.836  -6.547  -2.266
    8   HG23  ILE  79          HG23      ILE  79 -25.097  -6.837  -2.230
    9   HD13  ILE  79          HD11      ILE  79 -24.046  -2.890  -4.278
   10   HD12  ILE  79          HD12      ILE  79 -24.394  -4.599  -4.542
   11   HD11  ILE  79          HD13      ILE  79 -23.424  -4.100  -3.155

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ASP  80           H        ASP  80 -28.619  -6.213  -0.979
    2    HA   ASP  80           HA       ASP  80 -28.605  -7.080   1.679
    3    HB2  ASP  80           HB2      ASP  80 -30.342  -7.664   0.024
    4    HB3  ASP  80           HB3      ASP  80 -29.181  -8.691  -0.817

  No H/Q in entry =           4
  In of MODEL   38
    1    H    SER  81           H        SER  81 -27.093  -8.212   2.843
    2    HA   SER  81           HA       SER  81 -24.587  -8.926   1.692
    3    HB2  SER  81           HB2      SER  81 -24.072  -9.933   3.881
    4    HB3  SER  81           HB3      SER  81 -24.761  -8.320   4.065
    5    HG   SER  81           HG       SER  81 -26.079 -10.794   4.380

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU  82           H        LEU  82 -27.316 -10.994   2.005
    2    HA   LEU  82           HA       LEU  82 -25.779 -13.380   1.535
    3    HB2  LEU  82           HB2      LEU  82 -28.707 -12.745   1.235
    4    HB3  LEU  82           HB3      LEU  82 -28.013 -14.356   1.052
    5    HG   LEU  82           HG       LEU  82 -27.966 -12.748   3.587
    6   HD13  LEU  82          HD11      LEU  82 -30.247 -13.393   3.026
    7   HD12  LEU  82          HD12      LEU  82 -29.653 -14.419   4.334
    8   HD11  LEU  82          HD13      LEU  82 -29.722 -15.044   2.685
    9   HD23  LEU  82          HD21      LEU  82 -27.410 -15.140   4.410
   10   HD22  LEU  82          HD22      LEU  82 -26.141 -14.214   3.610
   11   HD21  LEU  82          HD23      LEU  82 -27.014 -15.462   2.720

  No H/Q in entry =          11
  In of MODEL   38
    1    H    LEU  83           H        LEU  83 -27.696 -11.165  -0.437
    2    HA   LEU  83           HA       LEU  83 -27.473 -12.556  -2.888
    3    HB2  LEU  83           HB2      LEU  83 -27.871  -9.639  -2.283
    4    HB3  LEU  83           HB3      LEU  83 -27.886 -10.304  -3.916
    5    HG   LEU  83           HG       LEU  83 -29.950 -10.648  -1.761
    6   HD13  LEU  83          HD11      LEU  83 -30.679  -8.809  -2.858
    7   HD12  LEU  83          HD12      LEU  83 -31.134  -9.935  -4.134
    8   HD11  LEU  83          HD13      LEU  83 -29.592  -9.082  -4.219
    9   HD23  LEU  83          HD21      LEU  83 -30.063 -11.940  -4.471
   10   HD22  LEU  83          HD22      LEU  83 -31.054 -12.264  -3.049
   11   HD21  LEU  83          HD23      LEU  83 -29.369 -12.780  -3.085

  No H/Q in entry =          11
  In of MODEL   38
    1    H    TYR  84           H        TYR  84 -25.524 -10.164  -1.218
    2    HA   TYR  84           HA       TYR  84 -23.632  -9.717  -3.330
    3    HB2  TYR  84           HB2      TYR  84 -24.139  -8.172  -1.380
    4    HB3  TYR  84           HB3      TYR  84 -23.223  -9.287  -0.369
    5    HD1  TYR  84           HD1      TYR  84 -20.782  -9.782  -1.108
    6    HD2  TYR  84           HD2      TYR  84 -23.034  -6.422  -2.475
    7    HE1  TYR  84           HE1      TYR  84 -18.682  -8.654  -1.757
    8    HE2  TYR  84           HE2      TYR  84 -20.943  -5.286  -3.138
    9    HH   TYR  84           HH       TYR  84 -18.629  -5.333  -2.751

  No H/Q in entry =           9
  In of MODEL   38
    1    H    GLY  85           H        GLY  85 -23.445 -11.682  -0.355
    2    HA3  GLY  85           HA2      GLY  85 -20.867 -12.651  -0.793
    3    HA2  GLY  85           HA3      GLY  85 -22.116 -13.477   0.139

  No H/Q in entry =           3
  In of MODEL   38
    1    H    LYS  86           H        LYS  86 -23.939 -13.862  -1.939
    2    HA   LYS  86           HA       LYS  86 -22.887 -16.261  -3.154
    3    HB2  LYS  86           HB2      LYS  86 -25.318 -15.348  -2.272
    4    HB3  LYS  86           HB3      LYS  86 -25.480 -15.205  -4.022
    5    HG2  LYS  86           HG2      LYS  86 -24.836 -17.715  -2.517
    6    HG3  LYS  86           HG3      LYS  86 -26.402 -17.280  -3.205
    7    HD2  LYS  86           HD2      LYS  86 -25.317 -17.076  -5.432
    8    HD3  LYS  86           HD3      LYS  86 -23.807 -17.635  -4.716
    9    HE2  LYS  86           HE2      LYS  86 -24.850 -19.749  -4.120
   10    HE3  LYS  86           HE3      LYS  86 -26.391 -19.189  -4.765
   11    HZ1  LYS  86           HZ1      LYS  86 -23.895 -19.397  -6.364
   12    HZ3  LYS  86           HZ2      LYS  86 -25.454 -19.049  -6.944
   13    HZ2  LYS  86           HZ3      LYS  86 -25.102 -20.591  -6.327

  No H/Q in entry =          13
  In of MODEL   38
    1    H    VAL  87           H        VAL  87 -22.841 -13.058  -4.089
    2    HA   VAL  87           HA       VAL  87 -22.509 -11.912  -6.042
    3    HB   VAL  87           HB       VAL  87 -21.438 -14.459  -7.299
    4   HG11  VAL  87          HG11      VAL  87 -21.636 -12.135  -8.459
    5   HG13  VAL  87          HG12      VAL  87 -20.102 -13.001  -8.582
    6   HG12  VAL  87          HG13      VAL  87 -20.280 -11.679  -7.429
    7   HG23  VAL  87          HG21      VAL  87 -19.791 -12.714  -5.495
    8   HG22  VAL  87          HG22      VAL  87 -19.371 -14.274  -6.200
    9   HG21  VAL  87          HG23      VAL  87 -20.586 -14.180  -4.925

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ASP  88           H        ASP  88 -25.033 -12.532  -5.714
    2    HA   ASP  88           HA       ASP  88 -26.134 -13.771  -8.108
    3    HB2  ASP  88           HB2      ASP  88 -27.159 -13.979  -5.795
    4    HB3  ASP  88           HB3      ASP  88 -27.599 -12.277  -5.921

  No H/Q in entry =           4
  In of MODEL   38
    1    H    GLY  89           H        GLY  89 -25.400 -12.541  -9.757
    2    HA3  GLY  89           HA2      GLY  89 -25.560  -9.770  -9.997
    3    HA2  GLY  89           HA3      GLY  89 -25.527 -10.909 -11.342

  No H/Q in entry =           3
  In of MODEL   38
    1    H    LEU  90           H        LEU  90 -27.988 -12.239 -10.906
    2    HA   LEU  90           HA       LEU  90 -29.772 -10.307 -12.068
    3    HB2  LEU  90           HB2      LEU  90 -29.846 -12.709 -12.617
    4    HB3  LEU  90           HB3      LEU  90 -30.374 -13.050 -10.970
    5    HG   LEU  90           HG       LEU  90 -32.481 -11.925 -11.373
    6   HD13  LEU  90          HD11      LEU  90 -32.271 -10.204 -12.869
    7   HD12  LEU  90          HD12      LEU  90 -32.806 -11.453 -13.996
    8   HD11  LEU  90          HD13      LEU  90 -31.091 -11.068 -13.856
    9   HD23  LEU  90          HD21      LEU  90 -32.393 -13.587 -13.786
   10   HD22  LEU  90          HD22      LEU  90 -33.391 -13.726 -12.339
   11   HD21  LEU  90          HD23      LEU  90 -31.741 -14.350 -12.335

  No H/Q in entry =          11
  In of MODEL   38
    1    H    GLY  91           H        GLY  91 -29.652 -11.766  -8.862
    2    HA3  GLY  91           HA2      GLY  91 -31.997 -10.625  -7.865
    3    HA2  GLY  91           HA3      GLY  91 -30.620 -11.154  -6.900

  No H/Q in entry =           3
  In of MODEL   38
    1    H    VAL  92           H        VAL  92 -28.679  -9.351  -7.756
    2    HA   VAL  92           HA       VAL  92 -29.474  -7.024  -6.248
    3    HB   VAL  92           HB       VAL  92 -26.911  -7.532  -7.806
    4   HG12  VAL  92          HG11      VAL  92 -27.092  -5.613  -5.508
    5   HG11  VAL  92          HG12      VAL  92 -27.735  -5.086  -7.064
    6   HG13  VAL  92          HG13      VAL  92 -26.043  -5.564  -6.926
    7   HG22  VAL  92          HG21      VAL  92 -26.718  -9.099  -6.190
    8   HG21  VAL  92          HG22      VAL  92 -27.871  -8.296  -5.122
    9   HG23  VAL  92          HG23      VAL  92 -26.211  -7.708  -5.231

  No H/Q in entry =           9
  In of MODEL   38
    1    H    LEU  93           H        LEU  93 -29.030  -7.734  -9.654
    2    HA   LEU  93           HA       LEU  93 -29.348  -5.109 -10.624
    3    HB2  LEU  93           HB2      LEU  93 -28.701  -6.988 -12.052
    4    HB3  LEU  93           HB3      LEU  93 -30.298  -7.703 -11.838
    5    HG   LEU  93           HG       LEU  93 -31.284  -5.749 -13.001
    6   HD11  LEU  93          HD11      LEU  93 -29.429  -4.157 -12.496
    7   HD13  LEU  93          HD12      LEU  93 -29.849  -4.208 -14.209
    8   HD12  LEU  93          HD13      LEU  93 -28.409  -5.044 -13.629
    9   HD23  LEU  93          HD21      LEU  93 -30.222  -6.353 -15.268
   10   HD22  LEU  93          HD22      LEU  93 -31.083  -7.592 -14.355
   11   HD21  LEU  93          HD23      LEU  93 -29.318  -7.547 -14.337

  No H/Q in entry =          11
  In of MODEL   38
    1    H    LYS  94           H        LYS  94 -31.749  -7.629  -9.768
    2    HA   LYS  94           HA       LYS  94 -34.076  -6.182 -10.439
    3    HB2  LYS  94           HB2      LYS  94 -33.600  -8.342  -8.393
    4    HB3  LYS  94           HB3      LYS  94 -35.189  -7.641  -8.690
    5    HG2  LYS  94           HG2      LYS  94 -35.080  -8.448 -11.012
    6    HG3  LYS  94           HG3      LYS  94 -33.529  -9.204 -10.655
    7    HD2  LYS  94           HD2      LYS  94 -34.679 -10.506  -8.826
    8    HD3  LYS  94           HD3      LYS  94 -36.211  -9.857  -9.408
    9    HE2  LYS  94           HE2      LYS  94 -35.675 -10.819 -11.656
   10    HE3  LYS  94           HE3      LYS  94 -34.274 -11.602 -10.925
   11    HZ3  LYS  94           HZ1      LYS  94 -36.131 -13.114 -11.096
   12    HZ2  LYS  94           HZ2      LYS  94 -37.109 -12.070 -10.180
   13    HZ1  LYS  94           HZ3      LYS  94 -35.762 -12.817  -9.467

  No H/Q in entry =          13
  In of MODEL   38
    1    H    ALA  95           H        ALA  95 -32.290  -6.272  -7.368
    2    HA   ALA  95           HA       ALA  95 -34.146  -4.662  -5.932
    3    HB2  ALA  95           HB1      ALA  95 -31.786  -6.044  -5.349
    4    HB3  ALA  95           HB2      ALA  95 -32.772  -5.117  -4.219
    5    HB1  ALA  95           HB3      ALA  95 -31.410  -4.350  -5.035

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA  96           H        ALA  96 -31.474  -3.852  -8.009
    2    HA   ALA  96           HA       ALA  96 -31.369  -1.082  -7.270
    3    HB2  ALA  96           HB1      ALA  96 -29.980  -0.892  -9.367
    4    HB3  ALA  96           HB2      ALA  96 -30.292  -2.602  -9.667
    5    HB1  ALA  96           HB3      ALA  96 -29.391  -2.109  -8.234

  No H/Q in entry =           5
  In of MODEL   38
    1    H    VAL  97           H        VAL  97 -32.880  -2.821  -9.952
    2    HA   VAL  97           HA       VAL  97 -33.919  -0.531 -11.251
    3    HB   VAL  97           HB       VAL  97 -34.750  -3.451 -11.264
    4   HG11  VAL  97          HG11      VAL  97 -36.521  -1.439 -11.797
    5   HG13  VAL  97          HG12      VAL  97 -36.584  -3.041 -12.534
    6   HG12  VAL  97          HG13      VAL  97 -35.810  -1.708 -13.389
    7   HG21  VAL  97          HG21      VAL  97 -33.433  -1.659 -13.307
    8   HG23  VAL  97          HG22      VAL  97 -33.895  -3.340 -13.581
    9   HG22  VAL  97          HG23      VAL  97 -32.658  -2.946 -12.386

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ALA  98           H        ALA  98 -35.148  -2.668  -8.700
    2    HA   ALA  98           HA       ALA  98 -37.704  -1.495  -8.394
    3    HB1  ALA  98           HB1      ALA  98 -36.720  -3.689  -7.321
    4    HB3  ALA  98           HB2      ALA  98 -37.904  -2.743  -6.415
    5    HB2  ALA  98           HB3      ALA  98 -36.186  -2.603  -6.038

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA  99           H        ALA  99 -34.638  -0.700  -6.722
    2    HA   ALA  99           HA       ALA  99 -35.770   1.315  -5.099
    3    HB1  ALA  99           HB1      ALA  99 -33.121   0.394  -5.803
    4    HB2  ALA  99           HB2      ALA  99 -33.682   1.167  -4.320
    5    HB3  ALA  99           HB3      ALA  99 -33.182   2.153  -5.695

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ILE 100           H        ILE 100 -34.690   1.393  -8.443
    2    HA   ILE 100           HA       ILE 100 -34.841   4.240  -8.700
    3    HB   ILE 100           HB       ILE 100 -34.931   2.060 -10.812
    4   HG12  ILE 100          HG12      ILE 100 -32.757   4.041 -10.141
    5   HG13  ILE 100          HG13      ILE 100 -32.816   2.403  -9.492
    6   HG21  ILE 100          HG21      ILE 100 -35.326   4.982 -10.984
    7   HG23  ILE 100          HG22      ILE 100 -35.829   3.703 -12.091
    8   HG22  ILE 100          HG23      ILE 100 -34.172   4.304 -12.133
    9   HD12  ILE 100          HD11      ILE 100 -32.242   3.321 -12.270
   10   HD11  ILE 100          HD12      ILE 100 -32.920   1.715 -12.003
   11   HD13  ILE 100          HD13      ILE 100 -31.378   2.153 -11.271

  No H/Q in entry =          11
  In of MODEL   38
    1    H    LYS 101           H        LYS 101 -37.149   1.643  -9.421
    2    HA   LYS 101           HA       LYS 101 -39.204   3.298 -10.464
    3    HB2  LYS 101           HB2      LYS 101 -39.126   0.538  -9.302
    4    HB3  LYS 101           HB3      LYS 101 -40.668   1.308  -9.675
    5    HG2  LYS 101           HG2      LYS 101 -40.165   1.411 -11.967
    6    HG3  LYS 101           HG3      LYS 101 -38.476   0.993 -11.689
    7    HD2  LYS 101           HD2      LYS 101 -39.733  -0.915 -12.565
    8    HD3  LYS 101           HD3      LYS 101 -39.128  -1.230 -10.940
    9    HE2  LYS 101           HE2      LYS 101 -41.203  -1.900 -10.449
   10    HE3  LYS 101           HE3      LYS 101 -41.644  -0.192 -10.477
   11    HZ3  LYS 101           HZ1      LYS 101 -42.512  -0.367 -12.603
   12    HZ2  LYS 101           HZ2      LYS 101 -42.995  -1.827 -11.884
   13    HZ1  LYS 101           HZ3      LYS 101 -41.675  -1.805 -12.952

  No H/Q in entry =          13
  In of MODEL   38
    1    H    LYS 102           H        LYS 102 -38.763   1.856  -7.233
    2    HA   LYS 102           HA       LYS 102 -41.013   3.086  -6.076
    3    HB2  LYS 102           HB2      LYS 102 -39.807   1.221  -5.023
    4    HB3  LYS 102           HB3      LYS 102 -38.409   2.266  -4.777
    5    HG2  LYS 102           HG2      LYS 102 -39.730   3.691  -3.313
    6    HG3  LYS 102           HG3      LYS 102 -41.131   2.649  -3.562
    7    HD2  LYS 102           HD2      LYS 102 -39.934   0.785  -2.499
    8    HD3  LYS 102           HD3      LYS 102 -38.534   1.828  -2.247
    9    HE2  LYS 102           HE2      LYS 102 -39.891   3.335  -0.872
   10    HE3  LYS 102           HE3      LYS 102 -41.308   2.323  -1.145
   11    HZ1  LYS 102           HZ1      LYS 102 -39.616   0.565  -0.101
   12    HZ3  LYS 102           HZ2      LYS 102 -40.729   1.471   0.805
   13    HZ2  LYS 102           HZ3      LYS 102 -39.112   1.979   0.691

  No H/Q in entry =          13
  In of MODEL   38
    1    H    ALA 103           H        ALA 103 -38.034   4.438  -7.070
    2    HA   ALA 103           HA       ALA 103 -38.257   6.776  -5.319
    3    HB2  ALA 103           HB1      ALA 103 -36.240   7.473  -6.879
    4    HB3  ALA 103           HB2      ALA 103 -36.216   5.751  -7.256
    5    HB1  ALA 103           HB3      ALA 103 -36.004   6.292  -5.591

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA 104           H        ALA 104 -38.845   6.011  -8.662
    2    HA   ALA 104           HA       ALA 104 -39.397   8.793  -9.325
    3    HB2  ALA 104           HB1      ALA 104 -39.420   8.100 -11.519
    4    HB1  ALA 104           HB2      ALA 104 -40.166   6.549 -11.132
    5    HB3  ALA 104           HB3      ALA 104 -38.445   6.800 -10.835

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA 105           H        ALA 105 -41.046   6.725  -7.515
    2    HA   ALA 105           HA       ALA 105 -43.458   8.141  -7.534
    3    HB2  ALA 105           HB1      ALA 105 -44.186   7.263  -9.571
    4    HB3  ALA 105           HB2      ALA 105 -44.847   6.095  -8.428
    5    HB1  ALA 105           HB3      ALA 105 -43.370   5.722  -9.315

  No H/Q in entry =           5
  In of MODEL   39
    1    H1   ALA   1           H3       ALA   1 -12.113 -16.084  -2.275
    2    H2   ALA   1           H2       ALA   1 -11.163 -17.213  -3.123
    3    H3   ALA   1           H1       ALA   1 -12.326 -16.284  -3.947
    4    HA   ALA   1           HA       ALA   1 -13.699 -18.004  -3.697
    5    HB3  ALA   1           HB1      ALA   1 -12.275 -19.756  -3.246
    6    HB1  ALA   1           HB2      ALA   1 -13.020 -19.654  -1.651
    7    HB2  ALA   1           HB3      ALA   1 -11.457 -18.891  -1.945

  No H/Q in entry =           7
  In of MODEL   39
    1    H    GLU   2           H        GLU   2 -15.297 -18.881  -2.029
    2    HA   GLU   2           HA       GLU   2 -16.960 -17.184  -0.957
    3    HB2  GLU   2           HB2      GLU   2 -15.975 -19.596   0.580
    4    HB3  GLU   2           HB3      GLU   2 -17.508 -18.767   0.846
    5    HG2  GLU   2           HG2      GLU   2 -18.487 -19.867  -0.881
    6    HG3  GLU   2           HG3      GLU   2 -17.178 -19.448  -1.976

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLU   3           H        GLU   3 -15.008 -18.511   1.650
    2    HA   GLU   3           HA       GLU   3 -15.250 -16.161   3.210
    3    HB2  GLU   3           HB2      GLU   3 -13.627 -18.686   3.447
    4    HB3  GLU   3           HB3      GLU   3 -13.405 -17.363   4.593
    5    HG2  GLU   3           HG2      GLU   3 -15.589 -17.545   5.428
    6    HG3  GLU   3           HG3      GLU   3 -16.185 -18.353   3.984

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LEU   4           H        LEU   4 -12.286 -17.598   1.795
    2    HA   LEU   4           HA       LEU   4 -10.473 -15.670   2.379
    3    HB2  LEU   4           HB2      LEU   4 -10.708 -16.970  -0.344
    4    HB3  LEU   4           HB3      LEU   4  -9.260 -16.230   0.329
    5    HG   LEU   4           HG       LEU   4 -10.712 -18.648   1.453
    6   HD13  LEU   4          HD11      LEU   4  -9.069 -19.980   0.510
    7   HD12  LEU   4          HD12      LEU   4  -7.877 -18.681   0.474
    8   HD11  LEU   4          HD13      LEU   4  -9.175 -18.721  -0.718
    9   HD23  LEU   4          HD21      LEU   4  -8.450 -18.680   2.817
   10   HD22  LEU   4          HD22      LEU   4  -9.780 -17.659   3.357
   11   HD21  LEU   4          HD23      LEU   4  -8.435 -16.952   2.464

  No H/Q in entry =          11
  In of MODEL   39
    1    H    GLU   5           H        GLU   5 -12.832 -15.495  -0.276
    2    HA   GLU   5           HA       GLU   5 -11.871 -12.998  -1.284
    3    HB2  GLU   5           HB2      GLU   5 -13.206 -14.603  -2.635
    4    HB3  GLU   5           HB3      GLU   5 -14.603 -14.256  -1.615
    5    HG2  GLU   5           HG2      GLU   5 -14.517 -11.891  -2.262
    6    HG3  GLU   5           HG3      GLU   5 -13.087 -12.201  -3.247

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLU   6           H        GLU   6 -14.567 -13.913   0.829
    2    HA   GLU   6           HA       GLU   6 -15.505 -11.249   1.237
    3    HB2  GLU   6           HB2      GLU   6 -16.094 -13.931   2.275
    4    HB3  GLU   6           HB3      GLU   6 -16.287 -12.653   3.473
    5    HG2  GLU   6           HG2      GLU   6 -18.390 -12.965   2.268
    6    HG3  GLU   6           HG3      GLU   6 -17.703 -11.393   1.862

  No H/Q in entry =           6
  In of MODEL   39
    1    H    VAL   7           H        VAL   7 -13.157 -13.329   2.789
    2    HA   VAL   7           HA       VAL   7 -12.693 -11.748   5.113
    3    HB   VAL   7           HB       VAL   7 -10.974 -13.768   3.650
    4   HG11  VAL   7          HG11      VAL   7 -10.506 -12.229   6.210
    5   HG13  VAL   7          HG12      VAL   7  -9.414 -12.428   4.841
    6   HG12  VAL   7          HG13      VAL   7  -9.740 -13.790   5.913
    7   HG21  VAL   7          HG21      VAL   7 -13.207 -14.363   4.887
    8   HG23  VAL   7          HG22      VAL   7 -12.272 -14.076   6.355
    9   HG22  VAL   7          HG23      VAL   7 -11.771 -15.329   5.222

  No H/Q in entry =           9
  In of MODEL   39
    1    H    VAL   8           H        VAL   8 -11.206 -11.841   1.891
    2    HA   VAL   8           HA       VAL   8  -9.165  -9.941   2.369
    3    HB   VAL   8           HB       VAL   8 -10.639 -10.643  -0.182
    4   HG12  VAL   8          HG11      VAL   8  -8.500  -9.617  -1.206
    5   HG11  VAL   8          HG12      VAL   8  -8.270  -8.848   0.366
    6   HG13  VAL   8          HG13      VAL   8  -9.716  -8.500  -0.583
    7   HG21  VAL   8          HG21      VAL   8  -8.924 -12.213   1.301
    8   HG23  VAL   8          HG22      VAL   8  -7.794 -11.386   0.233
    9   HG22  VAL   8          HG23      VAL   8  -9.103 -12.345  -0.450

  No H/Q in entry =           9
  In of MODEL   39
    1    H    MET   9           H        MET   9 -12.524  -9.596   1.235
    2    HA   MET   9           HA       MET   9 -12.502  -6.819   0.800
    3    HB2  MET   9           HB2      MET   9 -14.653  -8.774   1.569
    4    HB3  MET   9           HB3      MET   9 -15.001  -7.045   1.516
    5    HG2  MET   9           HG2      MET   9 -13.957  -7.080  -0.834
    6    HG3  MET   9           HG3      MET   9 -14.095  -8.835  -0.739
    7    HE3  MET   9           HE1      MET   9 -17.636  -9.745  -0.901
    8    HE2  MET   9           HE2      MET   9 -16.850  -9.564   0.665
    9    HE1  MET   9           HE3      MET   9 -15.927 -10.163  -0.711

  No H/Q in entry =           9
  In of MODEL   39
    1    H    GLY  10           H        GLY  10 -13.116  -8.719   3.732
    2    HA3  GLY  10           HA2      GLY  10 -13.681  -6.543   5.456
    3    HA2  GLY  10           HA3      GLY  10 -13.091  -8.124   5.965

  No H/Q in entry =           3
  In of MODEL   39
    1    H    LEU  11           H        LEU  11 -10.655  -8.214   4.631
    2    HA   LEU  11           HA       LEU  11  -8.961  -6.757   6.375
    3    HB2  LEU  11           HB2      LEU  11  -8.414  -8.172   3.763
    4    HB3  LEU  11           HB3      LEU  11  -7.146  -7.450   4.752
    5    HG   LEU  11           HG       LEU  11  -9.112  -9.511   5.783
    6   HD13  LEU  11          HD11      LEU  11  -7.885 -10.730   4.209
    7   HD12  LEU  11          HD12      LEU  11  -6.935 -10.956   5.677
    8   HD11  LEU  11          HD13      LEU  11  -6.420  -9.783   4.466
    9   HD22  LEU  11          HD21      LEU  11  -8.258  -8.486   7.694
   10   HD21  LEU  11          HD22      LEU  11  -6.732  -8.063   6.919
   11   HD23  LEU  11          HD23      LEU  11  -7.030  -9.724   7.431

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  12           H        ILE  12  -9.896  -6.222   2.992
    2    HA   ILE  12           HA       ILE  12  -8.240  -3.968   2.553
    3    HB   ILE  12           HB       ILE  12 -10.895  -4.672   1.278
    4   HG12  ILE  12          HG12      ILE  12  -8.841  -6.302   1.191
    5   HG13  ILE  12          HG13      ILE  12  -9.718  -5.958  -0.286
    6   HG23  ILE  12          HG21      ILE  12 -10.361  -2.348   0.824
    7   HG22  ILE  12          HG22      ILE  12  -9.983  -3.271  -0.626
    8   HG21  ILE  12          HG23      ILE  12  -8.716  -2.769   0.455
    9   HD11  ILE  12          HD11      ILE  12  -7.211  -4.504   0.597
   10   HD13  ILE  12          HD12      ILE  12  -8.018  -4.379  -0.965
   11   HD12  ILE  12          HD13      ILE  12  -7.216  -5.864  -0.511

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  13           H        ILE  13 -11.588  -4.284   3.672
    2    HA   ILE  13           HA       ILE  13 -12.087  -1.504   3.946
    3    HB   ILE  13           HB       ILE  13 -13.245  -3.942   5.317
    4   HG12  ILE  13          HG12      ILE  13 -13.490  -3.366   2.773
    5   HG13  ILE  13          HG13      ILE  13 -14.882  -3.911   3.684
    6   HG21  ILE  13          HG21      ILE  13 -13.856  -1.028   5.686
    7   HG23  ILE  13          HG22      ILE  13 -13.832  -2.313   6.887
    8   HG22  ILE  13          HG23      ILE  13 -15.183  -2.184   5.764
    9   HD12  ILE  13          HD11      ILE  13 -15.304  -1.874   2.229
   10   HD11  ILE  13          HD12      ILE  13 -14.214  -1.008   3.293
   11   HD13  ILE  13          HD13      ILE  13 -15.700  -1.667   3.938

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ASN  14           H        ASN  14 -10.922  -3.978   6.212
    2    HA   ASN  14           HA       ASN  14 -10.728  -2.337   8.496
    3    HB2  ASN  14           HB2      ASN  14 -10.438  -4.940   8.172
    4    HB3  ASN  14           HB3      ASN  14  -8.737  -4.527   8.002
    5   HD21  ASN  14          HD21      ASN  14  -9.333  -6.061  10.182
    6   HD22  ASN  14          HD22      ASN  14  -9.309  -5.141  11.606

  No H/Q in entry =           6
  In of MODEL   39
    1    H    SER  15           H        SER  15  -8.333  -3.124   5.986
    2    HA   SER  15           HA       SER  15  -6.205  -1.598   7.042
    3    HB2  SER  15           HB2      SER  15  -5.196  -1.799   4.877
    4    HB3  SER  15           HB3      SER  15  -6.129  -3.274   5.107
    5    HG   SER  15           HG       SER  15  -6.422  -1.310   3.269

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLY  16           H        GLY  16  -8.836  -0.772   4.814
    2    HA3  GLY  16           HA2      GLY  16  -8.024   1.882   4.257
    3    HA2  GLY  16           HA3      GLY  16  -9.666   1.261   4.107

  No H/Q in entry =           3
  In of MODEL   39
    1    H    GLN  17           H        GLN  17 -10.177   0.528   6.761
    2    HA   GLN  17           HA       GLN  17 -10.916   3.021   7.907
    3    HB2  GLN  17           HB2      GLN  17 -12.094   0.891   8.391
    4    HB3  GLN  17           HB3      GLN  17 -10.678   0.331   9.281
    5    HG2  GLN  17           HG2      GLN  17 -12.307   1.259  10.848
    6    HG3  GLN  17           HG3      GLN  17 -10.888   2.302  10.788
    7   HE21  GLN  17          HE21      GLN  17 -11.872   4.336  11.203
    8   HE22  GLN  17          HE22      GLN  17 -13.076   5.007  10.212

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ALA  18           H        ALA  18  -8.246   0.782   8.506
    2    HA   ALA  18           HA       ALA  18  -7.152   2.016  10.769
    3    HB2  ALA  18           HB1      ALA  18  -6.516  -0.189   9.397
    4    HB3  ALA  18           HB2      ALA  18  -5.358   0.613  10.459
    5    HB1  ALA  18           HB3      ALA  18  -5.298   0.892   8.717

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ARG  19           H        ARG  19  -6.415   2.552   7.315
    2    HA   ARG  19           HA       ARG  19  -4.548   4.631   7.729
    3    HB2  ARG  19           HB2      ARG  19  -4.872   3.485   5.536
    4    HB3  ARG  19           HB3      ARG  19  -6.430   4.299   5.371
    5    HG2  ARG  19           HG2      ARG  19  -5.338   6.490   5.431
    6    HG3  ARG  19           HG3      ARG  19  -3.773   5.730   5.723
    7    HD2  ARG  19           HD2      ARG  19  -3.926   6.318   3.381
    8    HD3  ARG  19           HD3      ARG  19  -3.980   4.557   3.527
    9    HE   ARG  19           HE       ARG  19  -6.629   5.421   3.539
   10   HH21  ARG  19          HH11      ARG  19  -7.840   5.557   1.630
   11   HH22  ARG  19          HH12      ARG  19  -7.031   5.648   0.104
   12   HH11  ARG  19          HH21      ARG  19  -3.870   5.531   1.485
   13   HH12  ARG  19          HH22      ARG  19  -4.782   5.631   0.022

  No H/Q in entry =          13
  In of MODEL   39
    1    H    SER  20           H        SER  20  -8.052   4.686   7.155
    2    HA   SER  20           HA       SER  20  -8.457   7.436   7.109
    3    HB2  SER  20           HB2      SER  20 -10.316   6.067   6.586
    4    HB3  SER  20           HB3      SER  20 -10.179   5.169   8.096
    5    HG   SER  20           HG       SER  20 -10.824   7.924   7.825

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU  21           H        LEU  21  -8.398   5.254   9.913
    2    HA   LEU  21           HA       LEU  21  -8.859   7.242  11.881
    3    HB2  LEU  21           HB2      LEU  21  -7.455   4.566  12.034
    4    HB3  LEU  21           HB3      LEU  21  -7.780   5.578  13.439
    5    HG   LEU  21           HG       LEU  21  -9.936   4.633  11.526
    6   HD12  LEU  21          HD11      LEU  21 -10.466   3.142  13.617
    7   HD11  LEU  21          HD12      LEU  21  -8.761   3.386  13.995
    8   HD13  LEU  21          HD13      LEU  21  -9.227   2.620  12.475
    9   HD21  LEU  21          HD21      LEU  21  -9.891   6.149  14.130
   10   HD23  LEU  21          HD22      LEU  21 -11.278   5.126  13.771
   11   HD22  LEU  21          HD23      LEU  21 -10.867   6.455  12.697

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ALA  22           H        ALA  22  -5.893   5.921  10.452
    2    HA   ALA  22           HA       ALA  22  -4.026   7.268  12.060
    3    HB2  ALA  22           HB1      ALA  22  -3.589   5.421  10.366
    4    HB1  ALA  22           HB2      ALA  22  -2.416   6.738  10.393
    5    HB3  ALA  22           HB3      ALA  22  -3.642   6.672   9.126

  No H/Q in entry =           5
  In of MODEL   39
    1    H    TYR  23           H        TYR  23  -5.383   8.260   8.887
    2    HA   TYR  23           HA       TYR  23  -4.093  10.780   8.807
    3    HB2  TYR  23           HB2      TYR  23  -5.173   9.845   6.824
    4    HB3  TYR  23           HB3      TYR  23  -6.747   9.931   7.616
    5    HD1  TYR  23           HD1      TYR  23  -3.876  12.023   6.467
    6    HD2  TYR  23           HD2      TYR  23  -8.024  11.913   7.577
    7    HE1  TYR  23           HE1      TYR  23  -4.142  14.369   5.705
    8    HE2  TYR  23           HE2      TYR  23  -8.290  14.257   6.814
    9    HH   TYR  23           HH       TYR  23  -5.632  15.986   5.228

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ALA  24           H        ALA  24  -7.184   9.747  10.209
    2    HA   ALA  24           HA       ALA  24  -8.061  12.322  10.985
    3    HB1  ALA  24           HB1      ALA  24  -9.854  11.038  11.466
    4    HB2  ALA  24           HB2      ALA  24  -9.008  10.482  12.908
    5    HB3  ALA  24           HB3      ALA  24  -8.877   9.572  11.404

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA  25           H        ALA  25  -6.005   9.900  12.546
    2    HA   ALA  25           HA       ALA  25  -5.672  11.159  15.045
    3    HB2  ALA  25           HB1      ALA  25  -4.868   8.821  14.219
    4    HB3  ALA  25           HB2      ALA  25  -3.861   9.698  15.373
    5    HB1  ALA  25           HB3      ALA  25  -3.436   9.688  13.660

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU  26           H        LEU  26  -3.908  11.489  11.992
    2    HA   LEU  26           HA       LEU  26  -1.976  13.344  12.894
    3    HB2  LEU  26           HB2      LEU  26  -1.669  12.197  10.788
    4    HB3  LEU  26           HB3      LEU  26  -3.159  12.879  10.144
    5    HG   LEU  26           HG       LEU  26  -2.183  15.147  10.272
    6   HD12  LEU  26          HD11      LEU  26   0.357  15.212  10.668
    7   HD11  LEU  26          HD12      LEU  26   0.167  13.628  11.414
    8   HD13  LEU  26          HD13      LEU  26  -0.661  15.028  12.096
    9   HD21  LEU  26          HD21      LEU  26  -0.414  13.123   8.865
   10   HD23  LEU  26          HD22      LEU  26  -0.490  14.843   8.494
   11   HD22  LEU  26          HD23      LEU  26  -1.898  13.820   8.216

  No H/Q in entry =          11
  In of MODEL   39
    1    H    LYS  27           H        LYS  27  -5.176  13.770  11.439
    2    HA   LYS  27           HA       LYS  27  -5.171  16.559  11.240
    3    HB2  LYS  27           HB2      LYS  27  -6.896  15.051  10.267
    4    HB3  LYS  27           HB3      LYS  27  -7.537  14.784  11.888
    5    HG2  LYS  27           HG2      LYS  27  -8.007  17.182  12.126
    6    HG3  LYS  27           HG3      LYS  27  -7.315  17.491  10.531
    7    HD2  LYS  27           HD2      LYS  27  -9.029  16.026   9.507
    8    HD3  LYS  27           HD3      LYS  27  -9.727  15.734  11.102
    9    HE2  LYS  27           HE2      LYS  27 -10.210  18.138  11.347
   10    HE3  LYS  27           HE3      LYS  27  -9.484  18.452   9.767
   11    HZ3  LYS  27           HZ1      LYS  27 -11.861  18.285   9.543
   12    HZ2  LYS  27           HZ2      LYS  27 -11.877  16.768  10.313
   13    HZ1  LYS  27           HZ3      LYS  27 -11.146  16.944   8.786

  No H/Q in entry =          13
  In of MODEL   39
    1    H    GLN  28           H        GLN  28  -6.004  14.459  13.974
    2    HA   GLN  28           HA       GLN  28  -6.921  16.447  15.756
    3    HB2  GLN  28           HB2      GLN  28  -5.472  13.840  16.287
    4    HB3  GLN  28           HB3      GLN  28  -6.218  14.832  17.541
    5    HG2  GLN  28           HG2      GLN  28  -7.688  13.703  15.143
    6    HG3  GLN  28           HG3      GLN  28  -7.708  12.989  16.755
    7   HE21  GLN  28          HE21      GLN  28  -8.050  15.116  18.452
    8   HE22  GLN  28          HE22      GLN  28  -9.473  15.964  18.085

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ALA  29           H        ALA  29  -3.686  15.205  15.044
    2    HA   ALA  29           HA       ALA  29  -2.257  16.627  17.011
    3    HB1  ALA  29           HB1      ALA  29  -0.323  15.967  15.879
    4    HB3  ALA  29           HB2      ALA  29  -1.091  16.078  14.295
    5    HB2  ALA  29           HB3      ALA  29  -1.484  14.739  15.373

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LYS  30           H        LYS  30  -3.153  17.491  13.688
    2    HA   LYS  30           HA       LYS  30  -1.781  19.953  13.577
    3    HB2  LYS  30           HB2      LYS  30  -4.308  19.040  12.187
    4    HB3  LYS  30           HB3      LYS  30  -3.500  20.567  11.837
    5    HG2  LYS  30           HG2      LYS  30  -1.415  19.305  11.308
    6    HG3  LYS  30           HG3      LYS  30  -2.297  17.796  11.560
    7    HD2  LYS  30           HD2      LYS  30  -3.884  18.413   9.777
    8    HD3  LYS  30           HD3      LYS  30  -3.024  19.934   9.527
    9    HE2  LYS  30           HE2      LYS  30  -0.978  18.670   8.933
   10    HE3  LYS  30           HE3      LYS  30  -1.856  17.155   9.151
   11    HZ2  LYS  30           HZ1      LYS  30  -1.710  18.028   6.808
   12    HZ1  LYS  30           HZ2      LYS  30  -2.768  19.275   7.284
   13    HZ3  LYS  30           HZ3      LYS  30  -3.269  17.651   7.359

  No H/Q in entry =          13
  In of MODEL   39
    1    H    GLN  31           H        GLN  31  -4.858  19.057  15.012
    2    HA   GLN  31           HA       GLN  31  -5.656  21.803  15.470
    3    HB2  GLN  31           HB2      GLN  31  -6.792  19.341  16.801
    4    HB3  GLN  31           HB3      GLN  31  -7.575  20.902  16.561
    5    HG2  GLN  31           HG2      GLN  31  -6.874  20.134  13.966
    6    HG3  GLN  31           HG3      GLN  31  -7.372  18.623  14.717
    7   HE21  GLN  31          HE21      GLN  31  -8.819  20.177  12.626
    8   HE22  GLN  31          HE22      GLN  31 -10.333  20.549  13.296

  No H/Q in entry =           8
  In of MODEL   39
    1    H    GLY  32           H        GLY  32  -3.308  19.907  16.773
    2    HA3  GLY  32           HA2      GLY  32  -1.901  20.387  18.564
    3    HA2  GLY  32           HA3      GLY  32  -3.042  21.615  19.096

  No H/Q in entry =           3
  In of MODEL   39
    1    H    ASP  33           H        ASP  33  -4.429  18.557  18.445
    2    HA   ASP  33           HA       ASP  33  -4.812  18.094  21.328
    3    HB2  ASP  33           HB2      ASP  33  -6.224  17.064  18.861
    4    HB3  ASP  33           HB3      ASP  33  -6.549  16.449  20.479

  No H/Q in entry =           4
  In of MODEL   39
    1    H    PHE  34           H        PHE  34  -2.630  17.271  21.616
    2    HA   PHE  34           HA       PHE  34  -1.612  15.036  20.207
    3    HB2  PHE  34           HB2      PHE  34  -0.986  16.028  22.997
    4    HB3  PHE  34           HB3      PHE  34  -0.048  14.817  22.122
    5    HD1  PHE  34           HD1      PHE  34  -0.259  18.240  22.860
    6    HD2  PHE  34           HD2      PHE  34   0.581  15.548  19.618
    7    HE1  PHE  34           HE1      PHE  34   1.004  20.028  21.697
    8    HE2  PHE  34           HE2      PHE  34   1.840  17.340  18.460
    9    HZ   PHE  34           HZ       PHE  34   2.053  19.577  19.503

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ALA  35           H        ALA  35  -3.633  15.286  23.086
    2    HA   ALA  35           HA       ALA  35  -3.379  12.626  23.980
    3    HB3  ALA  35           HB1      ALA  35  -5.839  13.220  24.856
    4    HB1  ALA  35           HB2      ALA  35  -5.330  14.845  24.397
    5    HB2  ALA  35           HB3      ALA  35  -4.395  13.933  25.581

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA  36           H        ALA  36  -5.865  14.112  21.899
    2    HA   ALA  36           HA       ALA  36  -7.252  11.682  21.432
    3    HB1  ALA  36           HB1      ALA  36  -8.734  13.086  20.487
    4    HB3  ALA  36           HB2      ALA  36  -7.576  13.522  19.230
    5    HB2  ALA  36           HB3      ALA  36  -7.601  14.409  20.754

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA  37           H        ALA  37  -4.606  13.305  19.743
    2    HA   ALA  37           HA       ALA  37  -4.567  11.671  17.445
    3    HB3  ALA  37           HB1      ALA  37  -2.586  13.407  18.853
    4    HB2  ALA  37           HB2      ALA  37  -3.130  13.457  17.177
    5    HB1  ALA  37           HB3      ALA  37  -1.957  12.242  17.689

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LYS  38           H        LYS  38  -2.783  11.386  20.509
    2    HA   LYS  38           HA       LYS  38  -1.430   9.004  20.009
    3    HB2  LYS  38           HB2      LYS  38  -1.759  10.761  22.158
    4    HB3  LYS  38           HB3      LYS  38  -2.354   9.224  22.778
    5    HG2  LYS  38           HG2      LYS  38  -0.249   8.131  22.225
    6    HG3  LYS  38           HG3      LYS  38   0.334   9.584  21.407
    7    HD2  LYS  38           HD2      LYS  38   0.503  10.804  23.442
    8    HD3  LYS  38           HD3      LYS  38  -0.494   9.640  24.316
    9    HE2  LYS  38           HE2      LYS  38   1.870   9.354  24.917
   10    HE3  LYS  38           HE3      LYS  38   1.277   7.931  24.057
   11    HZ3  LYS  38           HZ1      LYS  38   2.558   8.367  22.266
   12    HZ2  LYS  38           HZ2      LYS  38   3.511   9.207  23.396
   13    HZ1  LYS  38           HZ3      LYS  38   2.413  10.053  22.413

  No H/Q in entry =          13
  In of MODEL   39
    1    H    ALA  39           H        ALA  39  -4.664   9.456  21.437
    2    HA   ALA  39           HA       ALA  39  -5.185   6.729  21.944
    3    HB3  ALA  39           HB1      ALA  39  -7.375   8.646  21.195
    4    HB2  ALA  39           HB2      ALA  39  -6.468   8.884  22.689
    5    HB1  ALA  39           HB3      ALA  39  -7.367   7.388  22.432

  No H/Q in entry =           5
  In of MODEL   39
    1    H    MET  40           H        MET  40  -5.818   8.736  19.103
    2    HA   MET  40           HA       MET  40  -7.280   6.785  17.653
    3    HB2  MET  40           HB2      MET  40  -5.709   9.202  16.737
    4    HB3  MET  40           HB3      MET  40  -6.730   8.230  15.675
    5    HG2  MET  40           HG2      MET  40  -7.761   9.464  18.241
    6    HG3  MET  40           HG3      MET  40  -7.842  10.299  16.692
    7    HE3  MET  40           HE1      MET  40 -10.419   8.646  14.646
    8    HE2  MET  40           HE2      MET  40  -8.669   8.786  14.485
    9    HE1  MET  40           HE3      MET  40  -9.600  10.139  15.126

  No H/Q in entry =           9
  In of MODEL   39
    1    H    MET  41           H        MET  41  -3.798   7.569  17.749
    2    HA   MET  41           HA       MET  41  -3.032   5.826  15.642
    3    HB2  MET  41           HB2      MET  41  -1.406   6.513  18.103
    4    HB3  MET  41           HB3      MET  41  -0.791   5.874  16.583
    5    HG2  MET  41           HG2      MET  41  -1.985   8.041  15.589
    6    HG3  MET  41           HG3      MET  41  -1.744   8.631  17.232
    7    HE2  MET  41           HE1      MET  41   1.205   6.572  17.570
    8    HE1  MET  41           HE2      MET  41   0.405   7.855  18.475
    9    HE3  MET  41           HE3      MET  41   2.021   8.121  17.820

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ASP  42           H        ASP  42  -3.384   5.346  19.131
    2    HA   ASP  42           HA       ASP  42  -2.312   2.766  19.282
    3    HB2  ASP  42           HB2      ASP  42  -3.196   4.513  21.112
    4    HB3  ASP  42           HB3      ASP  42  -4.609   3.468  21.050

  No H/Q in entry =           4
  In of MODEL   39
    1    H    GLN  43           H        GLN  43  -5.664   3.824  18.807
    2    HA   GLN  43           HA       GLN  43  -6.773   1.221  18.620
    3    HB2  GLN  43           HB2      GLN  43  -7.741   3.861  17.499
    4    HB3  GLN  43           HB3      GLN  43  -8.684   2.369  17.483
    5    HG2  GLN  43           HG2      GLN  43  -8.370   2.251  19.989
    6    HG3  GLN  43           HG3      GLN  43  -7.668   3.866  19.913
    7   HE21  GLN  43          HE21      GLN  43  -9.837   3.915  21.429
    8   HE22  GLN  43          HE22      GLN  43 -11.212   4.472  20.608

  No H/Q in entry =           8
  In of MODEL   39
    1    H    SER  44           H        SER  44  -5.482   3.455  16.199
    2    HA   SER  44           HA       SER  44  -6.179   1.962  13.914
    3    HB2  SER  44           HB2      SER  44  -4.953   4.363  14.350
    4    HB3  SER  44           HB3      SER  44  -3.589   3.386  13.809
    5    HG   SER  44           HG       SER  44  -4.728   4.343  12.055

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ARG  45           H        ARG  45  -3.285   1.888  15.973
    2    HA   ARG  45           HA       ARG  45  -1.789  -0.045  14.579
    3    HB2  ARG  45           HB2      ARG  45  -0.953   1.387  16.442
    4    HB3  ARG  45           HB3      ARG  45  -1.923   0.442  17.569
    5    HG2  ARG  45           HG2      ARG  45  -0.668  -1.599  16.916
    6    HG3  ARG  45           HG3      ARG  45   0.327  -0.629  15.831
    7    HD2  ARG  45           HD2      ARG  45   1.057   0.760  17.782
    8    HD3  ARG  45           HD3      ARG  45   0.157  -0.328  18.862
    9    HE   ARG  45           HE       ARG  45   1.866  -1.899  17.268
   10   HH21  ARG  45          HH11      ARG  45   3.784  -2.696  18.090
   11   HH22  ARG  45          HH12      ARG  45   4.556  -1.900  19.416
   12   HH11  ARG  45          HH21      ARG  45   2.153   0.570  19.657
   13   HH12  ARG  45          HH22      ARG  45   3.632  -0.049  20.301

  No H/Q in entry =          13
  In of MODEL   39
    1    H    MET  46           H        MET  46  -4.162  -0.400  17.196
    2    HA   MET  46           HA       MET  46  -3.954  -3.197  17.500
    3    HB2  MET  46           HB2      MET  46  -6.140  -1.216  18.122
    4    HB3  MET  46           HB3      MET  46  -6.332  -2.939  18.452
    5    HG2  MET  46           HG2      MET  46  -4.331  -2.926  19.857
    6    HG3  MET  46           HG3      MET  46  -4.043  -1.234  19.479
    7    HE2  MET  46           HE1      MET  46  -7.085  -3.201  22.181
    8    HE1  MET  46           HE2      MET  46  -6.183  -3.872  20.827
    9    HE3  MET  46           HE3      MET  46  -7.697  -3.022  20.531

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ALA  47           H        ALA  47  -6.016  -1.206  15.422
    2    HA   ALA  47           HA       ALA  47  -7.614  -3.277  14.366
    3    HB3  ALA  47           HB1      ALA  47  -8.327  -1.049  13.957
    4    HB1  ALA  47           HB2      ALA  47  -7.841  -1.675  12.381
    5    HB2  ALA  47           HB3      ALA  47  -6.768  -0.593  13.271

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU  48           H        LEU  48  -4.521  -1.927  13.294
    2    HA   LEU  48           HA       LEU  48  -4.236  -3.512  10.949
    3    HB2  LEU  48           HB2      LEU  48  -2.183  -2.209  12.744
    4    HB3  LEU  48           HB3      LEU  48  -1.816  -2.923  11.174
    5    HG   LEU  48           HG       LEU  48  -3.864  -0.732  11.579
    6   HD13  LEU  48          HD11      LEU  48  -1.749   0.170  12.230
    7   HD12  LEU  48          HD12      LEU  48  -2.043   0.722  10.581
    8   HD11  LEU  48          HD13      LEU  48  -0.926  -0.611  10.880
    9   HD22  LEU  48          HD21      LEU  48  -4.338  -1.721   9.506
   10   HD21  LEU  48          HD22      LEU  48  -2.652  -2.135   9.198
   11   HD23  LEU  48          HD23      LEU  48  -3.193  -0.462   9.044

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ASN  49           H        ASN  49  -3.162  -3.898  14.287
    2    HA   ASN  49           HA       ASN  49  -1.534  -6.141  13.944
    3    HB2  ASN  49           HB2      ASN  49  -1.560  -4.810  15.993
    4    HB3  ASN  49           HB3      ASN  49  -3.211  -5.310  16.328
    5   HD21  ASN  49          HD21      ASN  49  -1.199  -5.813  18.220
    6   HD22  ASN  49          HD22      ASN  49  -0.903  -7.482  18.294

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLU  50           H        GLU  50  -5.001  -5.908  14.640
    2    HA   GLU  50           HA       GLU  50  -5.479  -8.714  14.750
    3    HB2  GLU  50           HB2      GLU  50  -7.078  -7.046  15.639
    4    HB3  GLU  50           HB3      GLU  50  -7.390  -6.484  13.994
    5    HG2  GLU  50           HG2      GLU  50  -8.234  -8.690  13.361
    6    HG3  GLU  50           HG3      GLU  50  -7.834  -9.330  14.951

  No H/Q in entry =           6
  In of MODEL   39
    1    H    ALA  51           H        ALA  51  -5.593  -6.314  12.157
    2    HA   ALA  51           HA       ALA  51  -6.573  -8.052  10.140
    3    HB2  ALA  51           HB1      ALA  51  -6.383  -6.236   8.771
    4    HB1  ALA  51           HB2      ALA  51  -4.744  -5.869   9.308
    5    HB3  ALA  51           HB3      ALA  51  -6.127  -5.374  10.287

  No H/Q in entry =           5
  In of MODEL   39
    1    H    HIS  52           H        HIS  52  -3.286  -7.109  11.101
    2    HA   HIS  52           HA       HIS  52  -1.884  -8.581   9.141
    3    HB2  HIS  52           HB2      HIS  52  -0.822  -6.853  10.529
    4    HB3  HIS  52           HB3      HIS  52  -1.038  -7.861  11.959
    5    HD1  HIS  52           HD1      HIS  52   0.218 -10.268  11.855
    6    HD2  HIS  52           HD2      HIS  52   1.492  -7.413   9.097
    7    HE1  HIS  52           HE1      HIS  52   2.468 -11.053  11.000
    8    HE2  HIS  52           HE2      HIS  52   3.258  -9.323   9.316

  No H/Q in entry =           8
  In of MODEL   39
    1    H    LEU  53           H        LEU  53  -3.064  -9.474  12.361
    2    HA   LEU  53           HA       LEU  53  -1.838 -12.005  12.544
    3    HB2  LEU  53           HB2      LEU  53  -4.330 -10.855  13.775
    4    HB3  LEU  53           HB3      LEU  53  -3.843 -12.523  14.066
    5    HG   LEU  53           HG       LEU  53  -1.967 -10.183  14.520
    6   HD11  LEU  53          HD11      LEU  53  -3.995 -11.462  16.355
    7   HD13  LEU  53          HD12      LEU  53  -3.736  -9.748  16.032
    8   HD12  LEU  53          HD13      LEU  53  -2.565 -10.653  16.985
    9   HD21  LEU  53          HD21      LEU  53  -1.975 -13.116  15.259
   10   HD23  LEU  53          HD22      LEU  53  -1.048 -11.954  16.203
   11   HD22  LEU  53          HD23      LEU  53  -0.681 -12.190  14.505

  No H/Q in entry =          11
  In of MODEL   39
    1    H    VAL  54           H        VAL  54  -4.969 -11.007  11.204
    2    HA   VAL  54           HA       VAL  54  -5.861 -13.610  10.521
    3    HB   VAL  54           HB       VAL  54  -6.544 -10.883   9.394
    4   HG12  VAL  54          HG11      VAL  54  -8.637 -12.282   8.595
    5   HG11  VAL  54          HG12      VAL  54  -7.511 -13.636   8.658
    6   HG13  VAL  54          HG13      VAL  54  -7.172 -12.257   7.615
    7   HG22  VAL  54          HG21      VAL  54  -7.435 -10.932  11.551
    8   HG21  VAL  54          HG22      VAL  54  -7.671 -12.678  11.532
    9   HG23  VAL  54          HG23      VAL  54  -8.769 -11.631  10.634

  No H/Q in entry =           9
  In of MODEL   39
    1    H    GLN  55           H        GLN  55  -4.026 -11.138   8.721
    2    HA   GLN  55           HA       GLN  55  -3.898 -12.599   6.301
    3    HB2  GLN  55           HB2      GLN  55  -3.318 -10.329   6.110
    4    HB3  GLN  55           HB3      GLN  55  -2.198 -10.395   7.467
    5    HG2  GLN  55           HG2      GLN  55  -0.481 -11.223   6.178
    6    HG3  GLN  55           HG3      GLN  55  -1.552 -12.208   5.190
    7   HE21  GLN  55          HE21      GLN  55  -1.590 -11.516   3.070
    8   HE22  GLN  55          HE22      GLN  55  -1.411  -9.909   2.560

  No H/Q in entry =           8
  In of MODEL   39
    1    H    THR  56           H        THR  56  -1.773 -12.560   9.168
    2    HA   THR  56           HA       THR  56   0.314 -14.138   8.234
    3    HB   THR  56           HB       THR  56  -0.908 -14.400  10.991
    4    HG1  THR  56           HG1      THR  56   0.424 -12.329   9.732
    5   HG23  THR  56          HG21      THR  56   1.160 -15.220  11.665
    6   HG22  THR  56          HG22      THR  56   2.016 -14.440  10.334
    7   HG21  THR  56          HG23      THR  56   1.051 -15.886  10.036

  No H/Q in entry =           7
  In of MODEL   39
    1    H    LYS  57           H        LYS  57  -2.786 -15.205   9.618
    2    HA   LYS  57           HA       LYS  57  -2.315 -17.996   9.367
    3    HB2  LYS  57           HB2      LYS  57  -4.134 -16.930  10.727
    4    HB3  LYS  57           HB3      LYS  57  -4.939 -16.477   9.233
    5    HG2  LYS  57           HG2      LYS  57  -5.161 -18.840   8.609
    6    HG3  LYS  57           HG3      LYS  57  -4.319 -19.321  10.080
    7    HD2  LYS  57           HD2      LYS  57  -6.116 -18.301  11.441
    8    HD3  LYS  57           HD3      LYS  57  -6.967 -17.835   9.969
    9    HE2  LYS  57           HE2      LYS  57  -7.152 -20.219   9.322
   10    HE3  LYS  57           HE3      LYS  57  -6.308 -20.694  10.793
   11    HZ2  LYS  57           HZ1      LYS  57  -9.003 -19.567  10.481
   12    HZ1  LYS  57           HZ2      LYS  57  -8.155 -19.316  11.932
   13    HZ3  LYS  57           HZ3      LYS  57  -8.489 -20.896  11.404

  No H/Q in entry =          13
  In of MODEL   39
    1    H    LEU  58           H        LEU  58  -3.684 -15.565   7.202
    2    HA   LEU  58           HA       LEU  58  -4.483 -17.396   5.200
    3    HB2  LEU  58           HB2      LEU  58  -3.905 -14.442   5.063
    4    HB3  LEU  58           HB3      LEU  58  -4.569 -15.383   3.727
    5    HG   LEU  58           HG       LEU  58  -5.832 -15.218   6.483
    6   HD11  LEU  58          HD11      LEU  58  -6.164 -13.572   3.995
    7   HD13  LEU  58          HD12      LEU  58  -6.147 -13.066   5.684
    8   HD12  LEU  58          HD13      LEU  58  -7.567 -13.872   5.021
    9   HD22  LEU  58          HD21      LEU  58  -6.782 -17.136   5.618
   10   HD21  LEU  58          HD22      LEU  58  -6.458 -16.679   3.946
   11   HD23  LEU  58          HD23      LEU  58  -7.823 -15.967   4.807

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  59           H        ILE  59  -1.353 -16.156   6.041
    2    HA   ILE  59           HA       ILE  59  -0.267 -16.872   3.396
    3    HB   ILE  59           HB       ILE  59   0.493 -14.801   4.966
    4   HG12  ILE  59          HG12      ILE  59   2.577 -16.432   3.499
    5   HG13  ILE  59          HG13      ILE  59   1.373 -15.479   2.669
    6   HG22  ILE  59          HG21      ILE  59   2.603 -16.835   5.638
    7   HG21  ILE  59          HG22      ILE  59   1.258 -16.569   6.724
    8   HG23  ILE  59          HG23      ILE  59   2.362 -15.251   6.336
    9   HD12  ILE  59          HD11      ILE  59   3.469 -14.480   4.588
   10   HD11  ILE  59          HD12      ILE  59   2.136 -13.481   4.017
   11   HD13  ILE  59          HD13      ILE  59   3.330 -14.097   2.874

  No H/Q in entry =          11
  In of MODEL   39
    1    H    GLU  60           H        GLU  60  -0.245 -17.980   6.763
    2    HA   GLU  60           HA       GLU  60   1.803 -19.939   6.483
    3    HB2  GLU  60           HB2      GLU  60   1.170 -19.276   8.692
    4    HB3  GLU  60           HB3      GLU  60  -0.521 -19.674   8.399
    5    HG2  GLU  60           HG2      GLU  60   1.583 -21.812   8.145
    6    HG3  GLU  60           HG3      GLU  60   0.974 -21.362   9.737

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLY  61           H        GLY  61  -1.710 -20.069   6.020
    2    HA3  GLY  61           HA2      GLY  61  -1.443 -22.859   5.058
    3    HA2  GLY  61           HA3      GLY  61  -2.931 -22.137   5.662

  No H/Q in entry =           3
  In of MODEL   39
    1    H    ASP  62           H        ASP  62  -0.729 -20.540   3.445
    2    HA   ASP  62           HA       ASP  62  -2.826 -19.959   1.599
    3    HB2  ASP  62           HB2      ASP  62  -0.949 -18.988   0.249
    4    HB3  ASP  62           HB3      ASP  62  -1.032 -18.384   1.901

  No H/Q in entry =           4
  In of MODEL   39
    1    H    ALA  63           H        ALA  63  -1.155 -22.819   2.033
    2    HA   ALA  63           HA       ALA  63  -0.310 -23.776  -0.394
    3    HB3  ALA  63           HB1      ALA  63  -2.113 -25.310   1.475
    4    HB1  ALA  63           HB2      ALA  63  -0.381 -25.078   1.719
    5    HB2  ALA  63           HB3      ALA  63  -0.960 -25.983   0.319

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLY  64           H        GLY  64  -3.676 -23.740   0.773
    2    HA3  GLY  64           HA2      GLY  64  -5.687 -23.706  -0.331
    3    HA2  GLY  64           HA3      GLY  64  -4.826 -23.050  -1.713

  No H/Q in entry =           3
  In of MODEL   39
    1    H    GLU  65           H        GLU  65  -5.625 -24.235  -3.397
    2    HA   GLU  65           HA       GLU  65  -6.335 -26.964  -3.199
    3    HB2  GLU  65           HB2      GLU  65  -5.787 -25.222  -5.600
    4    HB3  GLU  65           HB3      GLU  65  -6.403 -26.872  -5.705
    5    HG2  GLU  65           HG2      GLU  65  -8.351 -26.265  -4.356
    6    HG3  GLU  65           HG3      GLU  65  -7.727 -24.631  -4.150

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLY  66           H        GLY  66  -3.496 -25.378  -4.493
    2    HA3  GLY  66           HA2      GLY  66  -2.122 -27.948  -4.866
    3    HA2  GLY  66           HA3      GLY  66  -1.678 -26.435  -5.631

  No H/Q in entry =           3
  In of MODEL   39
    1    H    LYS  67           H        LYS  67   0.289 -27.833  -4.569
    2    HA   LYS  67           HA       LYS  67   0.840 -27.387  -1.834
    3    HB2  LYS  67           HB2      LYS  67   2.610 -28.138  -4.155
    4    HB3  LYS  67           HB3      LYS  67   3.151 -28.114  -2.472
    5    HG2  LYS  67           HG2      LYS  67   1.358 -29.685  -1.858
    6    HG3  LYS  67           HG3      LYS  67   0.790 -29.703  -3.526
    7    HD2  LYS  67           HD2      LYS  67   2.948 -30.648  -4.254
    8    HD3  LYS  67           HD3      LYS  67   3.520 -30.627  -2.584
    9    HE2  LYS  67           HE2      LYS  67   1.689 -32.140  -1.927
   10    HE3  LYS  67           HE3      LYS  67   1.102 -32.156  -3.589
   11    HZ1  LYS  67           HZ1      LYS  67   3.674 -32.815  -3.917
   12    HZ3  LYS  67           HZ2      LYS  67   2.412 -33.942  -3.768
   13    HZ2  LYS  67           HZ3      LYS  67   3.354 -33.534  -2.415

  No H/Q in entry =          13
  In of MODEL   39
    1    H    MET  68           H        MET  68   2.955 -26.220  -4.365
    2    HA   MET  68           HA       MET  68   4.037 -24.089  -2.873
    3    HB2  MET  68           HB2      MET  68   4.101 -24.823  -5.788
    4    HB3  MET  68           HB3      MET  68   4.938 -23.401  -5.164
    5    HG2  MET  68           HG2      MET  68   6.171 -24.821  -3.570
    6    HG3  MET  68           HG3      MET  68   5.333 -26.246  -4.188
    7    HE1  MET  68           HE1      MET  68   8.056 -26.513  -3.952
    8    HE3  MET  68           HE2      MET  68   8.898 -26.762  -5.480
    9    HE2  MET  68           HE3      MET  68   7.428 -27.671  -5.131

  No H/Q in entry =           9
  In of MODEL   39
    1    H    LYS  69           H        LYS  69   1.507 -24.102  -5.376
    2    HA   LYS  69           HA       LYS  69   1.326 -21.345  -5.742
    3    HB2  LYS  69           HB2      LYS  69   0.315 -22.990  -7.250
    4    HB3  LYS  69           HB3      LYS  69  -0.925 -23.321  -6.035
    5    HG2  LYS  69           HG2      LYS  69  -1.639 -20.985  -6.075
    6    HG3  LYS  69           HG3      LYS  69  -0.360 -20.590  -7.223
    7    HD2  LYS  69           HD2      LYS  69  -1.363 -22.136  -8.867
    8    HD3  LYS  69           HD3      LYS  69  -2.652 -22.510  -7.721
    9    HE2  LYS  69           HE2      LYS  69  -3.605 -20.830  -9.074
   10    HE3  LYS  69           HE3      LYS  69  -3.046 -19.947  -7.654
   11    HZ1  LYS  69           HZ1      LYS  69  -0.918 -20.106  -9.440
   12    HZ3  LYS  69           HZ2      LYS  69  -1.789 -18.724  -8.973
   13    HZ2  LYS  69           HZ3      LYS  69  -2.274 -19.617 -10.335

  No H/Q in entry =          13
  In of MODEL   39
    1    H    VAL  70           H        VAL  70   0.186 -19.674  -4.906
    2    HA   VAL  70           HA       VAL  70  -1.323 -20.171  -2.397
    3    HB   VAL  70           HB       VAL  70  -0.586 -17.895  -1.709
    4   HG12  VAL  70          HG11      VAL  70   1.775 -19.626  -2.480
    5   HG11  VAL  70          HG12      VAL  70   0.700 -19.994  -1.130
    6   HG13  VAL  70          HG13      VAL  70   1.663 -18.517  -1.113
    7   HG23  VAL  70          HG21      VAL  70   1.200 -18.014  -4.174
    8   HG22  VAL  70          HG22      VAL  70   1.137 -16.716  -2.984
    9   HG21  VAL  70          HG23      VAL  70  -0.244 -17.008  -4.038

  No H/Q in entry =           9
  In of MODEL   39
    1    H    SER  71           H        SER  71  -2.988 -18.568  -1.943
    2    HA   SER  71           HA       SER  71  -4.782 -18.153  -4.096
    3    HB2  SER  71           HB2      SER  71  -5.483 -18.304  -1.697
    4    HB3  SER  71           HB3      SER  71  -4.715 -16.749  -1.399
    5    HG   SER  71           HG       SER  71  -7.086 -17.360  -2.665

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU  72           H        LEU  72  -5.101 -16.454  -5.418
    2    HA   LEU  72           HA       LEU  72  -3.015 -14.620  -5.913
    3    HB2  LEU  72           HB2      LEU  72  -5.886 -14.701  -6.837
    4    HB3  LEU  72           HB3      LEU  72  -4.705 -13.532  -7.420
    5    HG   LEU  72           HG       LEU  72  -4.268 -16.533  -7.556
    6   HD11  LEU  72          HD11      LEU  72  -6.252 -15.831  -8.893
    7   HD13  LEU  72          HD12      LEU  72  -4.920 -16.381  -9.911
    8   HD12  LEU  72          HD13      LEU  72  -5.239 -14.657  -9.732
    9   HD22  LEU  72          HD21      LEU  72  -2.165 -15.526  -7.829
   10   HD21  LEU  72          HD22      LEU  72  -2.824 -14.104  -8.621
   11   HD23  LEU  72          HD23      LEU  72  -2.732 -15.631  -9.493

  No H/Q in entry =          11
  In of MODEL   39
    1    H    VAL  73           H        VAL  73  -6.099 -14.297  -4.259
    2    HA   VAL  73           HA       VAL  73  -6.170 -11.527  -3.904
    3    HB   VAL  73           HB       VAL  73  -7.854 -11.913  -2.275
    4   HG12  VAL  73          HG11      VAL  73  -7.964 -14.282  -4.156
    5   HG11  VAL  73          HG12      VAL  73  -8.290 -12.627  -4.667
    6   HG13  VAL  73          HG13      VAL  73  -9.324 -13.397  -3.462
    7   HG23  VAL  73          HG21      VAL  73  -8.133 -14.445  -1.564
    8   HG22  VAL  73          HG22      VAL  73  -6.999 -13.404  -0.703
    9   HG21  VAL  73          HG23      VAL  73  -6.410 -14.523  -1.933

  No H/Q in entry =           9
  In of MODEL   39
    1    H    LEU  74           H        LEU  74  -4.196 -13.877  -2.339
    2    HA   LEU  74           HA       LEU  74  -3.776 -12.736   0.183
    3    HB2  LEU  74           HB2      LEU  74  -2.975 -14.947  -0.334
    4    HB3  LEU  74           HB3      LEU  74  -1.930 -14.316  -1.605
    5    HG   LEU  74           HG       LEU  74  -0.636 -13.057   0.086
    6   HD12  LEU  74          HD11      LEU  74  -1.114 -13.810   2.522
    7   HD11  LEU  74          HD12      LEU  74  -2.705 -14.276   1.919
    8   HD13  LEU  74          HD13      LEU  74  -2.183 -12.594   1.821
    9   HD23  LEU  74          HD21      LEU  74  -0.807 -15.819   1.170
   10   HD22  LEU  74          HD22      LEU  74   0.583 -14.878   0.679
   11   HD21  LEU  74          HD23      LEU  74  -0.422 -15.628  -0.539

  No H/Q in entry =          11
  In of MODEL   39
    1    H    VAL  75           H        VAL  75  -1.913 -12.318  -2.789
    2    HA   VAL  75           HA       VAL  75  -0.127 -10.377  -1.789
    3    HB   VAL  75           HB       VAL  75  -1.100 -10.868  -4.605
    4   HG11  VAL  75          HG11      VAL  75   1.157  -9.115  -3.539
    5   HG13  VAL  75          HG12      VAL  75  -0.266  -8.573  -4.417
    6   HG12  VAL  75          HG13      VAL  75   0.947  -9.547  -5.232
    7   HG22  VAL  75          HG21      VAL  75   1.099 -11.984  -4.811
    8   HG21  VAL  75          HG22      VAL  75   0.137 -12.728  -3.534
    9   HG23  VAL  75          HG23      VAL  75   1.445 -11.620  -3.119

  No H/Q in entry =           9
  In of MODEL   39
    1    H    GLU  76           H        GLU  76  -3.294 -10.060  -3.422
    2    HA   GLU  76           HA       GLU  76  -3.376  -7.246  -3.518
    3    HB2  GLU  76           HB2      GLU  76  -5.030  -8.688  -4.673
    4    HB3  GLU  76           HB3      GLU  76  -5.659  -9.216  -3.121
    5    HG2  GLU  76           HG2      GLU  76  -7.145  -7.512  -3.977
    6    HG3  GLU  76           HG3      GLU  76  -6.276  -6.814  -2.623

  No H/Q in entry =           6
  In of MODEL   39
    1    H    ALA  77           H        ALA  77  -4.444  -9.489  -0.973
    2    HA   ALA  77           HA       ALA  77  -5.407  -7.500   0.796
    3    HB1  ALA  77           HB1      ALA  77  -4.186 -10.089   1.730
    4    HB2  ALA  77           HB2      ALA  77  -5.733 -10.064   0.884
    5    HB3  ALA  77           HB3      ALA  77  -5.550  -9.202   2.411

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLN  78           H        GLN  78  -2.247  -9.017   0.404
    2    HA   GLN  78           HA       GLN  78  -0.983  -7.847   2.646
    3    HB2  GLN  78           HB2      GLN  78  -0.112  -9.777   1.284
    4    HB3  GLN  78           HB3      GLN  78   0.300  -8.627   0.014
    5    HG2  GLN  78           HG2      GLN  78   1.763  -7.416   1.579
    6    HG3  GLN  78           HG3      GLN  78   1.352  -8.560   2.855
    7   HE21  GLN  78          HE21      GLN  78   4.064  -8.258   1.988
    8   HE22  GLN  78          HE22      GLN  78   4.534  -9.687   1.199

  No H/Q in entry =           8
  In of MODEL   39
    1    H    LEU  79           H        LEU  79  -1.386  -6.785  -0.696
    2    HA   LEU  79           HA       LEU  79   0.278  -4.542  -0.692
    3    HB2  LEU  79           HB2      LEU  79  -0.757  -5.355  -2.739
    4    HB3  LEU  79           HB3      LEU  79  -2.359  -4.980  -2.117
    5    HG   LEU  79           HG       LEU  79  -1.838  -2.588  -2.092
    6   HD13  LEU  79          HD11      LEU  79   0.404  -2.323  -1.597
    7   HD12  LEU  79          HD12      LEU  79   0.437  -2.033  -3.336
    8   HD11  LEU  79          HD13      LEU  79   0.911  -3.607  -2.696
    9   HD23  LEU  79          HD21      LEU  79  -1.225  -2.379  -4.649
   10   HD22  LEU  79          HD22      LEU  79  -2.741  -3.142  -4.179
   11   HD21  LEU  79          HD23      LEU  79  -1.363  -4.137  -4.636

  No H/Q in entry =          11
  In of MODEL   39
    1    H    HIS  80           H        HIS  80  -3.180  -4.738   0.161
    2    HA   HIS  80           HA       HIS  80  -3.391  -1.984   0.830
    3    HB2  HIS  80           HB2      HIS  80  -5.068  -4.409   1.159
    4    HB3  HIS  80           HB3      HIS  80  -5.392  -3.073   2.268
    5    HD1  HIS  80           HD1      HIS  80  -7.032  -1.450   1.376
    6    HD2  HIS  80           HD2      HIS  80  -4.847  -3.238  -1.692
    7    HE1  HIS  80           HE1      HIS  80  -7.898  -0.457  -0.795
    8    HE2  HIS  80           HE2      HIS  80  -6.572  -1.541  -2.675

  No H/Q in entry =           8
  In of MODEL   39
    1    H    LEU  81           H        LEU  81  -2.861  -4.878   2.815
    2    HA   LEU  81           HA       LEU  81  -2.840  -3.534   5.301
    3    HB2  LEU  81           HB2      LEU  81  -1.606  -6.138   4.408
    4    HB3  LEU  81           HB3      LEU  81  -1.572  -5.582   6.082
    5    HG   LEU  81           HG       LEU  81  -4.128  -5.854   4.474
    6   HD12  LEU  81          HD11      LEU  81  -4.400  -7.925   6.021
    7   HD11  LEU  81          HD12      LEU  81  -2.647  -7.839   6.193
    8   HD13  LEU  81          HD13      LEU  81  -3.366  -8.073   4.599
    9   HD23  LEU  81          HD21      LEU  81  -4.949  -6.068   6.982
   10   HD22  LEU  81          HD22      LEU  81  -4.644  -4.476   6.292
   11   HD21  LEU  81          HD23      LEU  81  -3.442  -5.227   7.341

  No H/Q in entry =          11
  In of MODEL   39
    1    H    MET  82           H        MET  82  -0.169  -4.411   3.108
    2    HA   MET  82           HA       MET  82   1.920  -3.502   4.776
    3    HB2  MET  82           HB2      MET  82   1.684  -3.840   1.785
    4    HB3  MET  82           HB3      MET  82   3.167  -3.258   2.538
    5    HG2  MET  82           HG2      MET  82   1.788  -5.861   3.269
    6    HG3  MET  82           HG3      MET  82   3.149  -5.738   2.159
    7    HE3  MET  82           HE1      MET  82   6.174  -4.980   4.119
    8    HE2  MET  82           HE2      MET  82   5.235  -3.619   3.511
    9    HE1  MET  82           HE3      MET  82   5.329  -5.107   2.572

  No H/Q in entry =           9
  In of MODEL   39
    1    H    THR  83           H        THR  83   0.064  -1.871   2.237
    2    HA   THR  83           HA       THR  83   1.456   0.589   2.316
    3    HB   THR  83           HB       THR  83  -0.735   1.497   1.348
    4    HG1  THR  83           HG1      THR  83  -2.376   0.187   1.253
    5   HG22  THR  83          HG21      THR  83  -0.466  -0.316  -0.657
    6   HG21  THR  83          HG22      THR  83   1.043  -0.597   0.207
    7   HG23  THR  83          HG23      THR  83   0.664   1.014  -0.403

  No H/Q in entry =           7
  In of MODEL   39
    1    H    SER  84           H        SER  84  -1.529  -0.470   3.939
    2    HA   SER  84           HA       SER  84  -2.033   1.954   5.291
    3    HB2  SER  84           HB2      SER  84  -2.839  -0.891   5.858
    4    HB3  SER  84           HB3      SER  84  -3.334   0.444   6.897
    5    HG   SER  84           HG       SER  84  -3.813   0.130   4.109

  No H/Q in entry =           5
  In of MODEL   39
    1    H    MET  85           H        MET  85  -0.291  -0.966   6.403
    2    HA   MET  85           HA       MET  85   0.242  -0.039   9.004
    3    HB2  MET  85           HB2      MET  85   0.548  -2.379   8.329
    4    HB3  MET  85           HB3      MET  85   1.911  -1.906   7.313
    5    HG2  MET  85           HG2      MET  85   3.109  -1.059   9.294
    6    HG3  MET  85           HG3      MET  85   1.739  -1.498  10.314
    7    HE2  MET  85           HE1      MET  85   4.009  -4.142  11.597
    8    HE1  MET  85           HE2      MET  85   3.420  -2.486  11.721
    9    HE3  MET  85           HE3      MET  85   4.890  -2.826  10.814

  No H/Q in entry =           9
  In of MODEL   39
    1    H    LEU  86           H        LEU  86   2.151   0.236   6.038
    2    HA   LEU  86           HA       LEU  86   4.364   1.561   7.177
    3    HB2  LEU  86           HB2      LEU  86   4.162   0.481   4.869
    4    HB3  LEU  86           HB3      LEU  86   3.339   1.957   4.365
    5    HG   LEU  86           HG       LEU  86   5.366   3.217   5.330
    6   HD11  LEU  86          HD11      LEU  86   6.097   0.610   6.121
    7   HD13  LEU  86          HD12      LEU  86   7.090   2.062   6.212
    8   HD12  LEU  86          HD13      LEU  86   7.196   1.016   4.798
    9   HD23  LEU  86          HD21      LEU  86   6.077   1.462   2.972
   10   HD22  LEU  86          HD22      LEU  86   6.459   3.162   3.233
   11   HD21  LEU  86          HD23      LEU  86   4.807   2.682   2.847

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ALA  87           H        ALA  87   1.430   2.785   5.618
    2    HA   ALA  87           HA       ALA  87   2.004   5.519   5.700
    3    HB1  ALA  87           HB1      ALA  87  -0.297   3.875   5.176
    4    HB3  ALA  87           HB2      ALA  87  -0.003   5.538   4.676
    5    HB2  ALA  87           HB3      ALA  87  -0.781   5.209   6.225

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ARG  88           H        ARG  88   0.349   3.502   8.102
    2    HA   ARG  88           HA       ARG  88  -0.163   5.545   9.955
    3    HB2  ARG  88           HB2      ARG  88  -1.083   3.186  10.026
    4    HB3  ARG  88           HB3      ARG  88   0.467   2.697  10.719
    5    HG2  ARG  88           HG2      ARG  88  -0.012   4.765  12.345
    6    HG3  ARG  88           HG3      ARG  88  -1.680   4.429  11.902
    7    HD2  ARG  88           HD2      ARG  88  -1.763   2.577  13.148
    8    HD3  ARG  88           HD3      ARG  88  -0.173   2.008  12.603
    9    HE   ARG  88           HE       ARG  88  -0.697   3.264  15.063
   10   HH21  ARG  88          HH11      ARG  88   0.864   4.287  16.290
   11   HH22  ARG  88          HH12      ARG  88   2.374   4.726  15.573
   12   HH11  ARG  88          HH21      ARG  88   1.561   3.466  12.467
   13   HH12  ARG  88          HH22      ARG  88   2.778   4.245  13.421

  No H/Q in entry =          13
  In of MODEL   39
    1    H    GLU  89           H        GLU  89   2.649   3.348   9.707
    2    HA   GLU  89           HA       GLU  89   3.922   4.244  12.041
    3    HB2  GLU  89           HB2      GLU  89   4.586   2.233  10.690
    4    HB3  GLU  89           HB3      GLU  89   5.344   3.334   9.538
    5    HG2  GLU  89           HG2      GLU  89   6.836   4.191  11.271
    6    HG3  GLU  89           HG3      GLU  89   6.019   3.226  12.497

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LEU  90           H        LEU  90   4.203   5.408   8.712
    2    HA   LEU  90           HA       LEU  90   6.122   7.423   9.284
    3    HB2  LEU  90           HB2      LEU  90   4.101   7.078   7.073
    4    HB3  LEU  90           HB3      LEU  90   5.321   8.359   7.085
    5    HG   LEU  90           HG       LEU  90   6.021   5.427   7.411
    6   HD12  LEU  90          HD11      LEU  90   6.748   5.669   4.965
    7   HD11  LEU  90          HD12      LEU  90   5.720   7.102   4.926
    8   HD13  LEU  90          HD13      LEU  90   5.016   5.523   5.273
    9   HD22  LEU  90          HD21      LEU  90   7.914   6.592   8.079
   10   HD21  LEU  90          HD22      LEU  90   7.545   7.995   7.076
   11   HD23  LEU  90          HD23      LEU  90   8.211   6.536   6.342

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  91           H        ILE  91   2.582   7.410   9.164
    2    HA   ILE  91           HA       ILE  91   2.220  10.179   9.620
    3    HB   ILE  91           HB       ILE  91   0.453   7.787  10.175
    4   HG12  ILE  91          HG12      ILE  91   0.170  10.068   8.194
    5   HG13  ILE  91          HG13      ILE  91   1.039   8.582   7.814
    6   HG22  ILE  91          HG21      ILE  91  -1.296   9.830  10.254
    7   HG21  ILE  91          HG22      ILE  91   0.103  10.672  10.917
    8   HG23  ILE  91          HG23      ILE  91  -0.514   9.229  11.717
    9   HD13  ILE  91          HD11      ILE  91  -0.893   7.278   7.873
   10   HD12  ILE  91          HD12      ILE  91  -1.501   8.788   7.197
   11   HD11  ILE  91          HD13      ILE  91  -1.755   8.420   8.903

  No H/Q in entry =          11
  In of MODEL   39
    1    H    THR  92           H        THR  92   2.665   7.439  11.815
    2    HA   THR  92           HA       THR  92   2.228   8.806  14.244
    3    HB   THR  92           HB       THR  92   4.052   6.488  13.563
    4    HG1  THR  92           HG1      THR  92   2.090   5.713  13.477
    5   HG22  THR  92          HG21      THR  92   3.692   6.198  16.199
    6   HG21  THR  92          HG22      THR  92   3.611   7.957  16.128
    7   HG23  THR  92          HG23      THR  92   5.047   7.115  15.543

  No H/Q in entry =           7
  In of MODEL   39
    1    H    GLU  93           H        GLU  93   5.168   8.386  12.287
    2    HA   GLU  93           HA       GLU  93   6.921   9.828  13.971
    3    HB2  GLU  93           HB2      GLU  93   6.989   9.516  10.955
    4    HB3  GLU  93           HB3      GLU  93   8.333  10.058  11.960
    5    HG2  GLU  93           HG2      GLU  93   6.952   7.408  12.416
    6    HG3  GLU  93           HG3      GLU  93   8.325   7.574  11.329

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LEU  94           H        LEU  94   4.842  10.825  11.276
    2    HA   LEU  94           HA       LEU  94   5.620  13.537  11.171
    3    HB2  LEU  94           HB2      LEU  94   3.038  12.147  10.436
    4    HB3  LEU  94           HB3      LEU  94   3.277  13.877  10.194
    5    HG   LEU  94           HG       LEU  94   5.306  11.910   9.127
    6   HD11  LEU  94          HD11      LEU  94   2.550  12.435   8.086
    7   HD13  LEU  94          HD12      LEU  94   3.547  10.988   7.952
    8   HD12  LEU  94          HD13      LEU  94   3.860  12.372   6.906
    9   HD23  LEU  94          HD21      LEU  94   5.524  13.750   7.404
   10   HD22  LEU  94          HD22      LEU  94   5.947  14.245   9.043
   11   HD21  LEU  94          HD23      LEU  94   4.386  14.699   8.357

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  95           H        ILE  95   3.113  11.894  13.081
    2    HA   ILE  95           HA       ILE  95   2.056  14.232  14.286
    3    HB   ILE  95           HB       ILE  95   2.110  11.350  15.208
    4   HG12  ILE  95          HG12      ILE  95  -0.137  13.101  14.177
    5   HG13  ILE  95          HG13      ILE  95   0.822  12.052  13.137
    6   HG21  ILE  95          HG21      ILE  95   0.812  13.808  16.421
    7   HG23  ILE  95          HG22      ILE  95   1.878  12.650  17.217
    8   HG22  ILE  95          HG23      ILE  95   0.244  12.172  16.754
    9   HD13  ILE  95          HD11      ILE  95  -0.053  10.104  14.061
   10   HD12  ILE  95          HD12      ILE  95  -1.446  11.179  14.149
   11   HD11  ILE  95          HD13      ILE  95  -0.467  10.890  15.586

  No H/Q in entry =          11
  In of MODEL   39
    1    H    GLU  96           H        GLU  96   4.682  12.039  15.260
    2    HA   GLU  96           HA       GLU  96   5.243  13.242  17.748
    3    HB2  GLU  96           HB2      GLU  96   6.209  11.094  17.092
    4    HB3  GLU  96           HB3      GLU  96   7.124  11.878  15.805
    5    HG2  GLU  96           HG2      GLU  96   8.778  12.443  17.255
    6    HG3  GLU  96           HG3      GLU  96   7.631  13.243  18.320

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LEU  97           H        LEU  97   6.284  14.028  14.455
    2    HA   LEU  97           HA       LEU  97   8.154  16.044  15.154
    3    HB2  LEU  97           HB2      LEU  97   6.550  15.479  12.670
    4    HB3  LEU  97           HB3      LEU  97   7.554  16.922  12.785
    5    HG   LEU  97           HG       LEU  97   8.618  14.135  13.335
    6   HD12  LEU  97          HD11      LEU  97   9.595  14.342  11.011
    7   HD11  LEU  97          HD12      LEU  97   8.526  15.721  10.756
    8   HD13  LEU  97          HD13      LEU  97   7.847  14.121  11.055
    9   HD23  LEU  97          HD21      LEU  97  10.767  15.438  12.577
   10   HD22  LEU  97          HD22      LEU  97  10.158  15.700  14.211
   11   HD21  LEU  97          HD23      LEU  97   9.821  16.880  12.946

  No H/Q in entry =          11
  In of MODEL   39
    1    H    HIS  98           H        HIS  98   4.656  16.141  14.526
    2    HA   HIS  98           HA       HIS  98   4.327  18.937  14.665
    3    HB2  HIS  98           HB2      HIS  98   2.468  16.665  15.404
    4    HB3  HIS  98           HB3      HIS  98   1.982  18.360  15.464
    5    HD1  HIS  98           HD1      HIS  98   3.016  15.658  13.050
    6    HD2  HIS  98           HD2      HIS  98   1.594  19.576  12.941
    7    HE1  HIS  98           HE1      HIS  98   2.433  16.142  10.630
    8    HE2  HIS  98           HE2      HIS  98   1.571  18.522  10.543

  No H/Q in entry =           8
  In of MODEL   39
    1    H    GLU  99           H        GLU  99   4.507  16.448  17.161
    2    HA   GLU  99           HA       GLU  99   3.896  18.134  19.365
    3    HB2  GLU  99           HB2      GLU  99   3.836  15.651  19.461
    4    HB3  GLU  99           HB3      GLU  99   5.596  15.627  19.339
    5    HG2  GLU  99           HG2      GLU  99   5.785  16.919  21.413
    6    HG3  GLU  99           HG3      GLU  99   4.032  17.040  21.522

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LYS 100           H        LYS 100   6.948  17.240  17.776
    2    HA   LYS 100           HA       LYS 100   8.601  18.658  19.622
    3    HB2  LYS 100           HB2      LYS 100   9.089  17.741  16.778
    4    HB3  LYS 100           HB3      LYS 100  10.318  18.524  17.778
    5    HG2  LYS 100           HG2      LYS 100   9.974  16.768  19.520
    6    HG3  LYS 100           HG3      LYS 100   8.844  15.952  18.437
    7    HD2  LYS 100           HD2      LYS 100  10.628  15.691  16.756
    8    HD3  LYS 100           HD3      LYS 100  11.764  16.519  17.825
    9    HE2  LYS 100           HE2      LYS 100  11.400  14.758  19.544
   10    HE3  LYS 100           HE3      LYS 100  10.327  13.911  18.426
   11    HZ1  LYS 100           HZ1      LYS 100  13.134  14.612  17.750
   12    HZ3  LYS 100           HZ2      LYS 100  12.096  13.546  16.929
   13    HZ2  LYS 100           HZ3      LYS 100  12.701  13.133  18.463

  No H/Q in entry =          13
  In of MODEL   39
    1    H    LEU 101           H        LEU 101   6.875  19.567  16.680
    2    HA   LEU 101           HA       LEU 101   8.058  22.138  16.338
    3    HB2  LEU 101           HB2      LEU 101   5.470  20.876  15.469
    4    HB3  LEU 101           HB3      LEU 101   5.700  22.610  15.262
    5    HG   LEU 101           HG       LEU 101   7.751  20.617  14.279
    6   HD12  LEU 101          HD11      LEU 101   6.575  21.112  12.003
    7   HD11  LEU 101          HD12      LEU 101   5.178  21.525  12.994
    8   HD13  LEU 101          HD13      LEU 101   5.861  19.902  13.070
    9   HD21  LEU 101          HD21      LEU 101   7.086  23.523  13.730
   10   HD23  LEU 101          HD22      LEU 101   8.069  22.575  12.615
   11   HD22  LEU 101          HD23      LEU 101   8.620  22.837  14.269

  No H/Q in entry =          11
  In of MODEL   39
    1    H    LYS 102           H        LYS 102   6.553  20.981  18.964
    2    HA   LYS 102           HA       LYS 102   5.923  22.064  20.902
    3    HB2  LYS 102           HB2      LYS 102   7.175  24.069  19.769
    4    HB3  LYS 102           HB3      LYS 102   5.567  24.656  19.406
    5    HG2  LYS 102           HG2      LYS 102   6.967  24.414  22.048
    6    HG3  LYS 102           HG3      LYS 102   5.995  25.732  21.427
    7    HD2  LYS 102           HD2      LYS 102   4.787  23.082  22.313
    8    HD3  LYS 102           HD3      LYS 102   5.029  24.445  23.395
    9    HE2  LYS 102           HE2      LYS 102   2.743  24.018  21.924
   10    HE3  LYS 102           HE3      LYS 102   3.234  25.568  22.603
   11    HZ2  LYS 102           HZ1      LYS 102   2.684  25.672  20.228
   12    HZ1  LYS 102           HZ2      LYS 102   3.955  24.605  19.894
   13    HZ3  LYS 102           HZ3      LYS 102   4.286  26.138  20.536

  No H/Q in entry =          13
  In of MODEL   39
    1    H    ALA 103           H        ALA 103   4.248  23.591  18.148
    2    HA   ALA 103           HA       ALA 103   1.794  24.140  19.052
    3    HB1  ALA 103           HB1      ALA 103   0.888  23.290  16.816
    4    HB2  ALA 103           HB2      ALA 103   2.538  22.772  16.473
    5    HB3  ALA 103           HB3      ALA 103   2.187  24.480  16.744

  No H/Q in entry =           5
  In of MODEL   39
    1    H1   ALA   1           H3       ALA   1  10.684 -20.242  -6.328
    2    H2   ALA   1           H2       ALA   1   9.711 -20.457  -7.707
    3    H3   ALA   1           H1       ALA   1   9.293 -21.210  -6.241
    4    HA   ALA   1           HA       ALA   1  10.345 -23.007  -6.990
    5    HB1  ALA   1           HB1      ALA   1  10.419 -22.645  -9.266
    6    HB2  ALA   1           HB2      ALA   1  12.147 -22.477  -8.950
    7    HB3  ALA   1           HB3      ALA   1  11.133 -21.040  -9.092

  No H/Q in entry =           7
  In of MODEL   39
    1    H    GLU   2           H        GLU   2  12.638 -23.934  -7.067
    2    HA   GLU   2           HA       GLU   2  14.036 -23.840  -4.866
    3    HB2  GLU   2           HB2      GLU   2  15.369 -23.692  -7.575
    4    HB3  GLU   2           HB3      GLU   2  16.115 -24.297  -6.097
    5    HG2  GLU   2           HG2      GLU   2  15.117 -26.324  -6.332
    6    HG3  GLU   2           HG3      GLU   2  13.537 -25.594  -6.577

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLU   3           H        GLU   3  15.769 -21.956  -7.279
    2    HA   GLU   3           HA       GLU   3  16.921 -20.259  -5.327
    3    HB2  GLU   3           HB2      GLU   3  16.841 -20.254  -8.337
    4    HB3  GLU   3           HB3      GLU   3  17.580 -18.919  -7.454
    5    HG2  GLU   3           HG2      GLU   3  19.264 -20.277  -6.546
    6    HG3  GLU   3           HG3      GLU   3  18.331 -21.753  -6.761

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LEU   4           H        LEU   4  14.609 -19.431  -7.939
    2    HA   LEU   4           HA       LEU   4  14.122 -16.828  -7.321
    3    HB2  LEU   4           HB2      LEU   4  11.961 -18.823  -8.036
    4    HB3  LEU   4           HB3      LEU   4  11.867 -17.075  -8.232
    5    HG   LEU   4           HG       LEU   4  13.839 -18.917  -9.623
    6   HD13  LEU   4          HD11      LEU   4  12.520 -18.780 -11.522
    7   HD12  LEU   4          HD12      LEU   4  11.801 -17.242 -11.048
    8   HD11  LEU   4          HD13      LEU   4  11.268 -18.739 -10.284
    9   HD23  LEU   4          HD21      LEU   4  14.142 -16.668 -10.975
   10   HD22  LEU   4          HD22      LEU   4  15.016 -16.903  -9.462
   11   HD21  LEU   4          HD23      LEU   4  13.553 -15.921  -9.489

  No H/Q in entry =          11
  In of MODEL   39
    1    H    GLU   5           H        GLU   5  12.678 -19.628  -5.670
    2    HA   GLU   5           HA       GLU   5  10.999 -18.075  -3.952
    3    HB2  GLU   5           HB2      GLU   5  10.591 -20.457  -4.472
    4    HB3  GLU   5           HB3      GLU   5  12.039 -20.880  -3.555
    5    HG2  GLU   5           HG2      GLU   5  11.081 -19.867  -1.536
    6    HG3  GLU   5           HG3      GLU   5   9.645 -19.394  -2.443

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLU   6           H        GLU   6  14.164 -19.623  -3.536
    2    HA   GLU   6           HA       GLU   6  14.530 -18.766  -0.840
    3    HB2  GLU   6           HB2      GLU   6  16.099 -20.143  -2.904
    4    HB3  GLU   6           HB3      GLU   6  17.068 -19.119  -1.843
    5    HG2  GLU   6           HG2      GLU   6  16.901 -21.352  -0.875
    6    HG3  GLU   6           HG3      GLU   6  16.003 -20.212   0.127

  No H/Q in entry =           6
  In of MODEL   39
    1    H    VAL   7           H        VAL   7  15.257 -17.429  -3.995
    2    HA   VAL   7           HA       VAL   7  16.928 -15.286  -3.141
    3    HB   VAL   7           HB       VAL   7  15.206 -15.664  -5.605
    4   HG11  VAL   7          HG11      VAL   7  17.083 -13.433  -4.806
    5   HG13  VAL   7          HG12      VAL   7  15.434 -13.306  -5.416
    6   HG12  VAL   7          HG13      VAL   7  16.740 -13.794  -6.497
    7   HG21  VAL   7          HG21      VAL   7  17.332 -17.100  -5.055
    8   HG23  VAL   7          HG22      VAL   7  18.219 -15.629  -5.459
    9   HG22  VAL   7          HG23      VAL   7  17.181 -16.388  -6.662

  No H/Q in entry =           9
  In of MODEL   39
    1    H    VAL   8           H        VAL   8  13.434 -15.591  -3.670
    2    HA   VAL   8           HA       VAL   8  12.743 -12.891  -3.190
    3    HB   VAL   8           HB       VAL   8  11.159 -15.434  -2.740
    4   HG12  VAL   8          HG11      VAL   8   9.199 -13.774  -2.887
    5   HG11  VAL   8          HG12      VAL   8  10.392 -12.513  -2.571
    6   HG13  VAL   8          HG13      VAL   8  10.119 -13.785  -1.382
    7   HG21  VAL   8          HG21      VAL   8  12.017 -14.355  -5.128
    8   HG23  VAL   8          HG22      VAL   8  10.471 -13.539  -4.919
    9   HG22  VAL   8          HG23      VAL   8  10.538 -15.298  -4.956

  No H/Q in entry =           9
  In of MODEL   39
    1    H    MET   9           H        MET   9  13.058 -15.696  -1.016
    2    HA   MET   9           HA       MET   9  12.248 -14.435   1.362
    3    HB2  MET   9           HB2      MET   9  14.128 -16.711   0.774
    4    HB3  MET   9           HB3      MET   9  13.936 -16.110   2.421
    5    HG2  MET   9           HG2      MET   9  11.400 -16.361   2.023
    6    HG3  MET   9           HG3      MET   9  11.846 -17.335   0.621
    7    HE3  MET   9           HE1      MET   9  13.331 -20.476   1.814
    8    HE2  MET   9           HE2      MET   9  14.343 -19.103   1.376
    9    HE1  MET   9           HE3      MET   9  12.835 -19.389   0.512

  No H/Q in entry =           9
  In of MODEL   39
    1    H    GLY  10           H        GLY  10  15.418 -14.623  -0.220
    2    HA3  GLY  10           HA2      GLY  10  16.877 -13.188   1.740
    3    HA2  GLY  10           HA3      GLY  10  17.328 -13.346   0.043

  No H/Q in entry =           3
  In of MODEL   39
    1    H    LEU  11           H        LEU  11  15.137 -12.149  -1.178
    2    HA   LEU  11           HA       LEU  11  15.792  -9.396  -1.017
    3    HB2  LEU  11           HB2      LEU  11  13.430 -10.832  -2.235
    4    HB3  LEU  11           HB3      LEU  11  13.690  -9.094  -2.395
    5    HG   LEU  11           HG       LEU  11  15.735 -11.178  -3.201
    6   HD13  LEU  11          HD11      LEU  11  13.982 -11.564  -4.708
    7   HD12  LEU  11          HD12      LEU  11  14.964 -10.370  -5.555
    8   HD11  LEU  11          HD13      LEU  11  13.491  -9.870  -4.724
    9   HD22  LEU  11          HD21      LEU  11  16.945  -9.201  -2.983
   10   HD21  LEU  11          HD22      LEU  11  15.556  -8.180  -3.350
   11   HD23  LEU  11          HD23      LEU  11  16.386  -9.038  -4.646

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  12           H        ILE  12  13.055 -11.255   0.270
    2    HA   ILE  12           HA       ILE  12  11.643  -9.049   1.343
    3    HB   ILE  12           HB       ILE  12  11.722 -11.931   2.291
    4   HG12  ILE  12          HG12      ILE  12  11.010 -11.303  -0.154
    5   HG13  ILE  12          HG13      ILE  12  10.008 -12.410   0.764
    6   HG23  ILE  12          HG21      ILE  12  10.763 -10.570   4.039
    7   HG22  ILE  12          HG22      ILE  12   9.424 -11.360   3.206
    8   HG21  ILE  12          HG23      ILE  12   9.792  -9.668   2.876
    9   HD11  ILE  12          HD11      ILE  12   9.530  -9.427   0.560
   10   HD13  ILE  12          HD12      ILE  12   8.459 -10.623   1.285
   11   HD12  ILE  12          HD13      ILE  12   8.733 -10.626  -0.443

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  13           H        ILE  13  14.074 -11.226   2.727
    2    HA   ILE  13           HA       ILE  13  14.115 -10.049   5.309
    3    HB   ILE  13           HB       ILE  13  16.186 -11.590   3.726
    4   HG12  ILE  13          HG12      ILE  13  13.916 -12.576   4.593
    5   HG13  ILE  13          HG13      ILE  13  15.402 -13.496   4.808
    6   HG21  ILE  13          HG21      ILE  13  16.338 -10.384   6.469
    7   HG23  ILE  13          HG22      ILE  13  17.595 -10.517   5.247
    8   HG22  ILE  13          HG23      ILE  13  17.123 -11.936   6.183
    9   HD12  ILE  13          HD11      ILE  13  13.925 -13.361   6.883
   10   HD11  ILE  13          HD12      ILE  13  14.281 -11.637   6.921
   11   HD13  ILE  13          HD13      ILE  13  15.582 -12.806   7.114

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ASN  14           H        ASN  14  16.039  -9.490   2.375
    2    HA   ASN  14           HA       ASN  14  17.766  -7.526   3.425
    3    HB2  ASN  14           HB2      ASN  14  17.742  -8.791   1.109
    4    HB3  ASN  14           HB3      ASN  14  16.826  -7.385   0.580
    5   HD21  ASN  14          HD21      ASN  14  19.262  -7.691  -0.625
    6   HD22  ASN  14          HD22      ASN  14  20.395  -6.593  -0.005

  No H/Q in entry =           6
  In of MODEL   39
    1    H    SER  15           H        SER  15  14.638  -7.220   1.758
    2    HA   SER  15           HA       SER  15  14.487  -4.401   1.818
    3    HB2  SER  15           HB2      SER  15  12.157  -4.679   1.335
    4    HB3  SER  15           HB3      SER  15  12.964  -6.038   0.565
    5    HG   SER  15           HG       SER  15  11.139  -6.017   2.562

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLY  16           H        GLY  16  13.446  -6.878   4.127
    2    HA3  GLY  16           HA2      GLY  16  12.214  -5.148   5.996
    3    HA2  GLY  16           HA3      GLY  16  12.854  -6.748   6.351

  No H/Q in entry =           3
  In of MODEL   39
    1    H    GLN  17           H        GLN  17  15.556  -6.376   5.739
    2    HA   GLN  17           HA       GLN  17  16.513  -5.144   8.113
    3    HB2  GLN  17           HB2      GLN  17  17.749  -6.922   6.888
    4    HB3  GLN  17           HB3      GLN  17  18.054  -5.779   5.578
    5    HG2  GLN  17           HG2      GLN  17  19.996  -5.845   7.049
    6    HG3  GLN  17           HG3      GLN  17  19.204  -4.278   7.204
    7   HE21  GLN  17          HE21      GLN  17  19.692  -3.802   9.399
    8   HE22  GLN  17          HE22      GLN  17  19.204  -4.783  10.695

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ALA  18           H        ALA  18  16.284  -4.066   4.756
    2    HA   ALA  18           HA       ALA  18  17.687  -1.653   4.974
    3    HB2  ALA  18           HB1      ALA  18  16.571  -2.882   2.914
    4    HB3  ALA  18           HB2      ALA  18  16.810  -1.135   2.898
    5    HB1  ALA  18           HB3      ALA  18  15.223  -1.804   3.279

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ARG  19           H        ARG  19  14.199  -2.292   5.397
    2    HA   ARG  19           HA       ARG  19  13.497   0.347   6.119
    3    HB2  ARG  19           HB2      ARG  19  11.838  -1.428   5.544
    4    HB3  ARG  19           HB3      ARG  19  12.203  -2.223   7.077
    5    HG2  ARG  19           HG2      ARG  19  11.473  -0.243   8.324
    6    HG3  ARG  19           HG3      ARG  19  11.198   0.631   6.818
    7    HD2  ARG  19           HD2      ARG  19   9.075  -0.197   7.653
    8    HD3  ARG  19           HD3      ARG  19   9.496  -1.069   6.173
    9    HE   ARG  19           HE       ARG  19  10.492  -2.599   8.270
   10   HH21  ARG  19          HH11      ARG  19   9.274  -4.258   9.216
   11   HH22  ARG  19          HH12      ARG  19   7.553  -4.256   9.058
   12   HH11  ARG  19          HH21      ARG  19   7.471  -1.350   7.198
   13   HH12  ARG  19          HH22      ARG  19   6.533  -2.609   7.912

  No H/Q in entry =          13
  In of MODEL   39
    1    H    SER  20           H        SER  20  14.411  -2.472   8.069
    2    HA   SER  20           HA       SER  20  14.131  -1.379  10.610
    3    HB2  SER  20           HB2      SER  20  14.630  -3.696  10.484
    4    HB3  SER  20           HB3      SER  20  16.069  -3.412   9.509
    5    HG   SER  20           HG       SER  20  15.673  -2.592  12.201

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU  21           H        LEU  21  16.957  -1.274   8.453
    2    HA   LEU  21           HA       LEU  21  18.622   0.235  10.180
    3    HB2  LEU  21           HB2      LEU  21  18.583  -0.032   7.166
    4    HB3  LEU  21           HB3      LEU  21  19.832   0.842   8.048
    5    HG   LEU  21           HG       LEU  21  19.134  -2.062   8.577
    6   HD12  LEU  21          HD11      LEU  21  21.461  -2.331   7.395
    7   HD11  LEU  21          HD12      LEU  21  21.069  -0.774   6.669
    8   HD13  LEU  21          HD13      LEU  21  20.008  -2.157   6.409
    9   HD21  LEU  21          HD21      LEU  21  21.216  -0.137   9.590
   10   HD23  LEU  21          HD22      LEU  21  21.633  -1.843   9.481
   11   HD22  LEU  21          HD23      LEU  21  20.292  -1.334  10.492

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ALA  22           H        ALA  22  16.326   1.173   7.642
    2    HA   ALA  22           HA       ALA  22  16.824   3.939   7.655
    3    HB3  ALA  22           HB1      ALA  22  15.427   2.678   5.985
    4    HB2  ALA  22           HB2      ALA  22  14.703   4.180   6.559
    5    HB1  ALA  22           HB3      ALA  22  14.140   2.631   7.189

  No H/Q in entry =           5
  In of MODEL   39
    1    H    TYR  23           H        TYR  23  14.368   2.085   9.506
    2    HA   TYR  23           HA       TYR  23  13.383   4.307  10.965
    3    HB2  TYR  23           HB2      TYR  23  12.180   2.174  10.950
    4    HB3  TYR  23           HB3      TYR  23  13.528   1.384  11.766
    5    HD1  TYR  23           HD1      TYR  23  10.993   4.097  12.147
    6    HD2  TYR  23           HD2      TYR  23  13.731   1.441  14.121
    7    HE1  TYR  23           HE1      TYR  23  10.068   4.776  14.347
    8    HE2  TYR  23           HE2      TYR  23  12.807   2.119  16.319
    9    HH   TYR  23           HH       TYR  23  10.016   4.296  16.545

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ALA  24           H        ALA  24  16.065   2.069  11.580
    2    HA   ALA  24           HA       ALA  24  16.740   3.071  14.140
    3    HB1  ALA  24           HB1      ALA  24  18.121   1.297  13.963
    4    HB3  ALA  24           HB2      ALA  24  19.127   2.234  12.858
    5    HB2  ALA  24           HB3      ALA  24  17.842   1.208  12.225

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA  25           H        ALA  25  17.660   4.016  10.855
    2    HA   ALA  25           HA       ALA  25  19.582   5.977  11.488
    3    HB1  ALA  25           HB1      ALA  25  18.862   5.022   9.177
    4    HB3  ALA  25           HB2      ALA  25  19.341   6.716   9.269
    5    HB2  ALA  25           HB3      ALA  25  17.632   6.285   9.211

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU  26           H        LEU  26  16.062   6.158  11.153
    2    HA   LEU  26           HA       LEU  26  15.803   8.936  11.609
    3    HB2  LEU  26           HB2      LEU  26  13.952   7.676  10.693
    4    HB3  LEU  26           HB3      LEU  26  13.886   6.645  12.118
    5    HG   LEU  26           HG       LEU  26  13.263   8.593  13.504
    6   HD12  LEU  26          HD11      LEU  26  12.564  10.686  12.186
    7   HD11  LEU  26          HD12      LEU  26  13.544  10.048  10.869
    8   HD13  LEU  26          HD13      LEU  26  14.294  10.441  12.416
    9   HD21  LEU  26          HD21      LEU  26  11.574   8.260  11.007
   10   HD23  LEU  26          HD22      LEU  26  11.015   8.948  12.528
   11   HD22  LEU  26          HD23      LEU  26  11.489   7.253  12.453

  No H/Q in entry =          11
  In of MODEL   39
    1    H    LYS  27           H        LYS  27  15.748   6.153  13.799
    2    HA   LYS  27           HA       LYS  27  15.155   7.508  16.173
    3    HB2  LYS  27           HB2      LYS  27  15.214   5.034  15.905
    4    HB3  LYS  27           HB3      LYS  27  16.976   5.110  15.849
    5    HG2  LYS  27           HG2      LYS  27  17.029   6.094  18.100
    6    HG3  LYS  27           HG3      LYS  27  15.263   6.089  18.158
    7    HD2  LYS  27           HD2      LYS  27  15.268   3.622  17.918
    8    HD3  LYS  27           HD3      LYS  27  17.033   3.635  17.894
    9    HE2  LYS  27           HE2      LYS  27  17.070   4.621  20.151
   10    HE3  LYS  27           HE3      LYS  27  15.304   4.639  20.179
   11    HZ3  LYS  27           HZ1      LYS  27  16.126   2.696  21.322
   12    HZ2  LYS  27           HZ2      LYS  27  17.039   2.230  19.964
   13    HZ1  LYS  27           HZ3      LYS  27  15.340   2.213  19.896

  No H/Q in entry =          13
  In of MODEL   39
    1    H    GLN  28           H        GLN  28  18.267   6.968  14.558
    2    HA   GLN  28           HA       GLN  28  19.951   8.071  16.537
    3    HB2  GLN  28           HB2      GLN  28  20.220   8.038  13.520
    4    HB3  GLN  28           HB3      GLN  28  21.509   8.515  14.626
    5    HG2  GLN  28           HG2      GLN  28  20.111   5.827  14.683
    6    HG3  GLN  28           HG3      GLN  28  21.672   6.123  13.920
    7   HE21  GLN  28          HE21      GLN  28  23.023   7.694  15.735
    8   HE22  GLN  28          HE22      GLN  28  23.160   6.902  17.230

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ALA  29           H        ALA  29  18.162   9.534  13.860
    2    HA   ALA  29           HA       ALA  29  19.130  12.167  14.108
    3    HB2  ALA  29           HB1      ALA  29  17.413  12.784  12.650
    4    HB1  ALA  29           HB2      ALA  29  16.288  11.597  13.308
    5    HB3  ALA  29           HB3      ALA  29  17.618  11.072  12.275

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LYS  30           H        LYS  30  16.384  10.532  15.648
    2    HA   LYS  30           HA       LYS  30  15.353  12.772  17.015
    3    HB2  LYS  30           HB2      LYS  30  15.281   9.829  17.716
    4    HB3  LYS  30           HB3      LYS  30  14.407  11.068  18.617
    5    HG2  LYS  30           HG2      LYS  30  13.259  11.743  16.508
    6    HG3  LYS  30           HG3      LYS  30  14.073  10.417  15.674
    7    HD2  LYS  30           HD2      LYS  30  13.031   8.796  17.208
    8    HD3  LYS  30           HD3      LYS  30  12.228  10.111  18.066
    9    HE2  LYS  30           HE2      LYS  30  11.037  10.732  15.983
   10    HE3  LYS  30           HE3      LYS  30  11.821   9.388  15.145
   11    HZ2  LYS  30           HZ1      LYS  30   9.524   8.951  16.042
   12    HZ1  LYS  30           HZ2      LYS  30  10.202   9.010  17.604
   13    HZ3  LYS  30           HZ3      LYS  30  10.716   7.832  16.488

  No H/Q in entry =          13
  In of MODEL   39
    1    H    GLN  31           H        GLN  31  18.044  10.633  17.730
    2    HA   GLN  31           HA       GLN  31  18.380  11.648  20.423
    3    HB2  GLN  31           HB2      GLN  31  20.409  10.102  18.801
    4    HB3  GLN  31           HB3      GLN  31  20.286  10.223  20.557
    5    HG2  GLN  31           HG2      GLN  31  17.778   9.243  19.805
    6    HG3  GLN  31           HG3      GLN  31  18.881   8.412  18.716
    7   HE21  GLN  31          HE21      GLN  31  17.368   7.246  21.002
    8   HE22  GLN  31          HE22      GLN  31  18.539   6.597  22.044

  No H/Q in entry =           8
  In of MODEL   39
    1    H    GLY  32           H        GLY  32  18.862  12.974  17.454
    2    HA3  GLY  32           HA2      GLY  32  19.819  15.031  16.936
    3    HA2  GLY  32           HA3      GLY  32  20.588  15.043  18.518

  No H/Q in entry =           3
  In of MODEL   39
    1    H    ASP  33           H        ASP  33  21.030  12.157  16.734
    2    HA   ASP  33           HA       ASP  33  23.844  12.866  16.248
    3    HB2  ASP  33           HB2      ASP  33  22.366  10.232  16.372
    4    HB3  ASP  33           HB3      ASP  33  24.048  10.369  15.865

  No H/Q in entry =           4
  In of MODEL   39
    1    H    PHE  34           H        PHE  34  23.334  14.185  14.372
    2    HA   PHE  34           HA       PHE  34  21.979  13.188  12.094
    3    HB2  PHE  34           HB2      PHE  34  24.087  15.347  12.310
    4    HB3  PHE  34           HB3      PHE  34  23.094  15.047  10.886
    5    HD1  PHE  34           HD1      PHE  34  23.344  16.980  13.800
    6    HD2  PHE  34           HD2      PHE  34  20.474  14.834  11.432
    7    HE1  PHE  34           HE1      PHE  34  21.519  18.356  14.762
    8    HE2  PHE  34           HE2      PHE  34  18.653  16.209  12.398
    9    HZ   PHE  34           HZ       PHE  34  19.178  17.971  14.058

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ALA  35           H        ALA  35  25.363  13.039  13.076
    2    HA   ALA  35           HA       ALA  35  26.460  12.234  10.610
    3    HB3  ALA  35           HB1      ALA  35  28.166  11.082  12.316
    4    HB2  ALA  35           HB2      ALA  35  27.299  12.096  13.469
    5    HB1  ALA  35           HB3      ALA  35  28.117  12.831  12.091

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA  36           H        ALA  36  25.388  10.262  13.381
    2    HA   ALA  36           HA       ALA  36  25.892   7.782  12.099
    3    HB2  ALA  36           HB1      ALA  36  25.486   7.028  14.177
    4    HB3  ALA  36           HB2      ALA  36  23.791   7.502  14.040
    5    HB1  ALA  36           HB3      ALA  36  24.983   8.648  14.655

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA  37           H        ALA  37  23.046   9.873  12.256
    2    HA   ALA  37           HA       ALA  37  21.203   8.082  11.092
    3    HB3  ALA  37           HB1      ALA  37  21.394  11.047  11.386
    4    HB1  ALA  37           HB2      ALA  37  20.099   9.952  11.867
    5    HB2  ALA  37           HB3      ALA  37  20.270  10.428  10.177

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LYS  38           H        LYS  38  23.261  10.571   9.601
    2    HA   LYS  38           HA       LYS  38  22.607  10.138   6.927
    3    HB2  LYS  38           HB2      LYS  38  24.407  11.717   8.361
    4    HB3  LYS  38           HB3      LYS  38  25.445  10.742   7.327
    5    HG2  LYS  38           HG2      LYS  38  24.256  11.500   5.340
    6    HG3  LYS  38           HG3      LYS  38  23.058  12.338   6.331
    7    HD2  LYS  38           HD2      LYS  38  24.638  13.956   7.074
    8    HD3  LYS  38           HD3      LYS  38  26.007  12.988   6.527
    9    HE2  LYS  38           HE2      LYS  38  25.615  14.856   4.980
   10    HE3  LYS  38           HE3      LYS  38  25.293  13.315   4.177
   11    HZ3  LYS  38           HZ1      LYS  38  23.090  13.732   4.063
   12    HZ2  LYS  38           HZ2      LYS  38  23.592  15.353   4.149
   13    HZ1  LYS  38           HZ3      LYS  38  23.039  14.560   5.545

  No H/Q in entry =          13
  In of MODEL   39
    1    H    ALA  39           H        ALA  39  25.156   8.571   8.863
    2    HA   ALA  39           HA       ALA  39  26.230   6.999   6.783
    3    HB2  ALA  39           HB1      ALA  39  26.175   6.031   9.627
    4    HB1  ALA  39           HB2      ALA  39  27.106   7.470   9.205
    5    HB3  ALA  39           HB3      ALA  39  27.472   5.925   8.437

  No H/Q in entry =           5
  In of MODEL   39
    1    H    MET  40           H        MET  40  23.643   6.346   9.100
    2    HA   MET  40           HA       MET  40  23.230   3.636   8.366
    3    HB2  MET  40           HB2      MET  40  21.396   5.654   9.674
    4    HB3  MET  40           HB3      MET  40  21.011   3.940   9.500
    5    HG2  MET  40           HG2      MET  40  23.558   4.913  10.823
    6    HG3  MET  40           HG3      MET  40  22.074   4.617  11.727
    7    HE3  MET  40           HE1      MET  40  21.561   0.976  11.902
    8    HE2  MET  40           HE2      MET  40  20.669   2.268  11.103
    9    HE1  MET  40           HE3      MET  40  21.417   2.563  12.671

  No H/Q in entry =           9
  In of MODEL   39
    1    H    MET  41           H        MET  41  21.767   6.671   7.193
    2    HA   MET  41           HA       MET  41  19.814   5.452   5.534
    3    HB2  MET  41           HB2      MET  41  21.255   8.063   5.013
    4    HB3  MET  41           HB3      MET  41  19.729   7.549   4.305
    5    HG2  MET  41           HG2      MET  41  19.005   7.348   6.862
    6    HG3  MET  41           HG3      MET  41  20.299   8.523   7.076
    7    HE2  MET  41           HE1      MET  41  19.694   9.807   3.745
    8    HE1  MET  41           HE2      MET  41  20.655  10.258   5.150
    9    HE3  MET  41           HE3      MET  41  19.364  11.320   4.596

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ASP  42           H        ASP  42  23.169   6.422   4.957
    2    HA   ASP  42           HA       ASP  42  23.247   5.952   2.198
    3    HB2  ASP  42           HB2      ASP  42  24.997   6.972   3.956
    4    HB3  ASP  42           HB3      ASP  42  25.676   5.356   3.821

  No H/Q in entry =           4
  In of MODEL   39
    1    H    GLN  43           H        GLN  43  24.021   3.805   4.910
    2    HA   GLN  43           HA       GLN  43  24.705   1.558   3.320
    3    HB2  GLN  43           HB2      GLN  43  23.701   1.724   6.171
    4    HB3  GLN  43           HB3      GLN  43  24.295   0.244   5.410
    5    HG2  GLN  43           HG2      GLN  43  26.437   1.485   4.884
    6    HG3  GLN  43           HG3      GLN  43  25.843   2.803   5.890
    7   HE21  GLN  43          HE21      GLN  43  28.097   1.860   6.909
    8   HE22  GLN  43          HE22      GLN  43  27.848   0.772   8.185

  No H/Q in entry =           8
  In of MODEL   39
    1    H    SER  44           H        SER  44  21.644   2.648   4.729
    2    HA   SER  44           HA       SER  44  20.101   0.384   4.065
    3    HB2  SER  44           HB2      SER  44  19.633   2.905   5.218
    4    HB3  SER  44           HB3      SER  44  18.589   2.850   3.800
    5    HG   SER  44           HG       SER  44  17.521   1.889   5.530

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ARG  45           H        ARG  45  20.789   3.361   2.259
    2    HA   ARG  45           HA       ARG  45  19.254   2.857  -0.035
    3    HB2  ARG  45           HB2      ARG  45  20.372   5.008   0.543
    4    HB3  ARG  45           HB3      ARG  45  21.924   4.275   0.145
    5    HG2  ARG  45           HG2      ARG  45  21.129   3.861  -2.164
    6    HG3  ARG  45           HG3      ARG  45  19.589   4.617  -1.764
    7    HD2  ARG  45           HD2      ARG  45  20.815   6.730  -1.187
    8    HD3  ARG  45           HD3      ARG  45  22.318   5.978  -1.768
    9    HE   ARG  45           HE       ARG  45  20.375   5.716  -3.789
   10   HH21  ARG  45          HH11      ARG  45  20.336   7.087  -5.551
   11   HH22  ARG  45          HH12      ARG  45  21.073   8.647  -5.450
   12   HH11  ARG  45          HH21      ARG  45  22.084   8.236  -2.173
   13   HH12  ARG  45          HH22      ARG  45  22.061   9.297  -3.535

  No H/Q in entry =          13
  In of MODEL   39
    1    H    MET  46           H        MET  46  22.635   2.026   0.686
    2    HA   MET  46           HA       MET  46  23.237   0.845  -1.805
    3    HB2  MET  46           HB2      MET  46  24.371   0.541   0.976
    4    HB3  MET  46           HB3      MET  46  25.023  -0.358  -0.398
    5    HG2  MET  46           HG2      MET  46  25.449   1.736  -1.600
    6    HG3  MET  46           HG3      MET  46  24.731   2.660  -0.287
    7    HE2  MET  46           HE1      MET  46  28.718   0.543  -0.565
    8    HE1  MET  46           HE2      MET  46  27.251   0.303  -1.508
    9    HE3  MET  46           HE3      MET  46  27.437  -0.515   0.042

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ALA  47           H        ALA  47  21.895  -0.510   1.180
    2    HA   ALA  47           HA       ALA  47  21.870  -3.222   0.375
    3    HB2  ALA  47           HB1      ALA  47  21.504  -2.769   2.683
    4    HB3  ALA  47           HB2      ALA  47  19.970  -3.391   2.076
    5    HB1  ALA  47           HB3      ALA  47  20.180  -1.657   2.334

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU  48           H        LEU  48  19.481  -0.625   0.040
    2    HA   LEU  48           HA       LEU  48  17.446  -2.183  -1.196
    3    HB2  LEU  48           HB2      LEU  48  18.062   0.779  -1.313
    4    HB3  LEU  48           HB3      LEU  48  16.595   0.051  -1.968
    5    HG   LEU  48           HG       LEU  48  17.476  -0.243   0.913
    6   HD13  LEU  48          HD11      LEU  48  17.028   2.053   0.732
    7   HD12  LEU  48          HD12      LEU  48  15.482   1.385   1.254
    8   HD11  LEU  48          HD13      LEU  48  15.734   1.812  -0.439
    9   HD22  LEU  48          HD21      LEU  48  15.966  -1.976   0.544
   10   HD21  LEU  48          HD22      LEU  48  15.070  -1.083  -0.687
   11   HD23  LEU  48          HD23      LEU  48  14.867  -0.682   1.019

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ASN  49           H        ASN  49  20.100  -0.221  -2.447
    2    HA   ASN  49           HA       ASN  49  19.427  -0.310  -5.165
    3    HB2  ASN  49           HB2      ASN  49  21.097   1.225  -4.248
    4    HB3  ASN  49           HB3      ASN  49  22.147  -0.126  -3.839
    5   HD21  ASN  49          HD21      ASN  49  23.082   1.917  -5.531
    6   HD22  ASN  49          HD22      ASN  49  23.259   1.306  -7.103

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLU  50           H        GLU  50  21.454  -2.482  -3.221
    2    HA   GLU  50           HA       GLU  50  22.159  -4.227  -5.355
    3    HB2  GLU  50           HB2      GLU  50  23.375  -4.189  -3.199
    4    HB3  GLU  50           HB3      GLU  50  21.947  -4.835  -2.391
    5    HG2  GLU  50           HG2      GLU  50  22.050  -6.866  -3.752
    6    HG3  GLU  50           HG3      GLU  50  23.410  -6.216  -4.665

  No H/Q in entry =           6
  In of MODEL   39
    1    H    ALA  51           H        ALA  51  19.522  -4.196  -3.006
    2    HA   ALA  51           HA       ALA  51  18.380  -6.682  -3.755
    3    HB3  ALA  51           HB1      ALA  51  16.795  -6.197  -2.185
    4    HB1  ALA  51           HB2      ALA  51  16.557  -4.553  -2.781
    5    HB2  ALA  51           HB3      ALA  51  17.929  -4.923  -1.737

  No H/Q in entry =           5
  In of MODEL   39
    1    H    HIS  52           H        HIS  52  17.744  -3.341  -4.782
    2    HA   HIS  52           HA       HIS  52  15.622  -3.892  -6.564
    3    HB2  HIS  52           HB2      HIS  52  16.173  -1.620  -5.808
    4    HB3  HIS  52           HB3      HIS  52  17.701  -1.693  -6.685
    5    HD1  HIS  52           HD1      HIS  52  17.457  -2.047  -9.368
    6    HD2  HIS  52           HD2      HIS  52  14.022  -0.801  -7.364
    7    HE1  HIS  52           HE1      HIS  52  15.883  -1.144 -11.135
    8    HE2  HIS  52           HE2      HIS  52  13.784  -0.381  -9.929

  No H/Q in entry =           8
  In of MODEL   39
    1    H    LEU  53           H        LEU  53  19.136  -3.855  -7.027
    2    HA   LEU  53           HA       LEU  53  19.173  -4.168  -9.828
    3    HB2  LEU  53           HB2      LEU  53  21.134  -4.905  -7.670
    4    HB3  LEU  53           HB3      LEU  53  21.440  -5.290  -9.363
    5    HG   LEU  53           HG       LEU  53  20.739  -2.487  -8.436
    6   HD11  LEU  53          HD11      LEU  53  23.407  -3.887  -8.629
    7   HD13  LEU  53          HD12      LEU  53  22.765  -2.927  -7.296
    8   HD12  LEU  53          HD13      LEU  53  23.272  -2.137  -8.785
    9   HD21  LEU  53          HD21      LEU  53  21.835  -3.707 -10.977
   10   HD23  LEU  53          HD22      LEU  53  22.128  -2.015 -10.592
   11   HD22  LEU  53          HD23      LEU  53  20.487  -2.592 -10.807

  No H/Q in entry =          11
  In of MODEL   39
    1    H    VAL  54           H        VAL  54  19.113  -6.557  -7.203
    2    HA   VAL  54           HA       VAL  54  19.250  -8.850  -8.864
    3    HB   VAL  54           HB       VAL  54  18.115  -8.441  -6.087
    4   HG12  VAL  54          HG11      VAL  54  18.472 -11.055  -6.087
    5   HG11  VAL  54          HG12      VAL  54  18.270 -10.888  -7.830
    6   HG13  VAL  54          HG13      VAL  54  16.984 -10.374  -6.740
    7   HG22  VAL  54          HG21      VAL  54  20.430  -8.201  -5.884
    8   HG21  VAL  54          HG22      VAL  54  20.769  -9.288  -7.229
    9   HG23  VAL  54          HG23      VAL  54  20.261  -9.943  -5.672

  No H/Q in entry =           9
  In of MODEL   39
    1    H    GLN  55           H        GLN  55  16.509  -6.982  -7.557
    2    HA   GLN  55           HA       GLN  55  14.501  -8.672  -8.614
    3    HB2  GLN  55           HB2      GLN  55  13.747  -7.156  -6.980
    4    HB3  GLN  55           HB3      GLN  55  14.515  -5.777  -7.762
    5    HG2  GLN  55           HG2      GLN  55  12.774  -5.475  -9.237
    6    HG3  GLN  55           HG3      GLN  55  12.473  -7.200  -9.404
    7   HE21  GLN  55          HE21      GLN  55  10.481  -7.775  -8.582
    8   HE22  GLN  55          HE22      GLN  55   9.709  -7.031  -7.267

  No H/Q in entry =           8
  In of MODEL   39
    1    H    THR  56           H        THR  56  16.191  -5.849  -9.987
    2    HA   THR  56           HA       THR  56  14.728  -5.505 -12.323
    3    HB   THR  56           HB       THR  56  17.747  -5.378 -12.186
    4    HG1  THR  56           HG1      THR  56  15.759  -3.844 -11.018
    5   HG23  THR  56          HG21      THR  56  17.618  -3.979 -14.036
    6   HG22  THR  56          HG22      THR  56  15.961  -3.493 -13.680
    7   HG21  THR  56          HG23      THR  56  16.285  -5.087 -14.366

  No H/Q in entry =           7
  In of MODEL   39
    1    H    LYS  57           H        LYS  57  17.413  -7.767 -11.736
    2    HA   LYS  57           HA       LYS  57  17.407  -8.961 -14.314
    3    HB2  LYS  57           HB2      LYS  57  19.216  -9.190 -12.586
    4    HB3  LYS  57           HB3      LYS  57  18.133 -10.199 -11.638
    5    HG2  LYS  57           HG2      LYS  57  18.024 -11.833 -13.472
    6    HG3  LYS  57           HG3      LYS  57  19.087 -10.827 -14.449
    7    HD2  LYS  57           HD2      LYS  57  20.873 -11.073 -12.754
    8    HD3  LYS  57           HD3      LYS  57  19.816 -12.105 -11.793
    9    HE2  LYS  57           HE2      LYS  57  19.693 -13.729 -13.649
   10    HE3  LYS  57           HE3      LYS  57  20.737 -12.705 -14.634
   11    HZ2  LYS  57           HZ1      LYS  57  21.404 -14.251 -12.223
   12    HZ1  LYS  57           HZ2      LYS  57  22.326 -12.888 -12.641
   13    HZ3  LYS  57           HZ3      LYS  57  22.204 -14.196 -13.717

  No H/Q in entry =          13
  In of MODEL   39
    1    H    LEU  58           H        LEU  58  15.662  -9.653 -11.323
    2    HA   LEU  58           HA       LEU  58  14.464 -12.043 -12.247
    3    HB2  LEU  58           HB2      LEU  58  13.663 -10.148 -10.044
    4    HB3  LEU  58           HB3      LEU  58  12.875 -11.697 -10.353
    5    HG   LEU  58           HG       LEU  58  15.849 -11.379  -9.825
    6   HD11  LEU  58          HD11      LEU  58  13.500 -11.828  -8.011
    7   HD13  LEU  58          HD12      LEU  58  14.942 -10.845  -7.762
    8   HD12  LEU  58          HD13      LEU  58  15.040 -12.600  -7.628
    9   HD22  LEU  58          HD21      LEU  58  15.750 -13.442 -10.852
   10   HD21  LEU  58          HD22      LEU  58  14.042 -13.675 -10.476
   11   HD23  LEU  58          HD23      LEU  58  15.266 -13.959  -9.238

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  59           H        ILE  59  13.741  -8.715 -12.923
    2    HA   ILE  59           HA       ILE  59  11.027  -9.401 -13.839
    3    HB   ILE  59           HB       ILE  59  11.815  -7.107 -12.641
    4   HG12  ILE  59          HG12      ILE  59   9.876  -7.024 -14.965
    5   HG13  ILE  59          HG13      ILE  59   9.488  -7.784 -13.443
    6   HG22  ILE  59          HG21      ILE  59  11.848  -6.293 -15.535
    7   HG21  ILE  59          HG22      ILE  59  13.340  -6.696 -14.716
    8   HG23  ILE  59          HG23      ILE  59  12.343  -5.364 -14.139
    9   HD12  ILE  59          HD11      ILE  59  10.189  -4.889 -13.902
   10   HD11  ILE  59          HD12      ILE  59  10.092  -5.609 -12.295
   11   HD13  ILE  59          HD13      ILE  59   8.654  -5.535 -13.315

  No H/Q in entry =          11
  In of MODEL   39
    1    H    GLU  60           H        GLU  60  14.207  -8.505 -15.126
    2    HA   GLU  60           HA       GLU  60  13.398  -8.116 -17.827
    3    HB2  GLU  60           HB2      GLU  60  15.552  -7.312 -17.152
    4    HB3  GLU  60           HB3      GLU  60  16.038  -8.906 -16.582
    5    HG2  GLU  60           HG2      GLU  60  15.255  -8.530 -19.461
    6    HG3  GLU  60           HG3      GLU  60  16.873  -8.083 -18.927

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLY  61           H        GLY  61  14.431 -10.984 -16.021
    2    HA3  GLY  61           HA2      GLY  61  13.890 -12.639 -18.418
    3    HA2  GLY  61           HA3      GLY  61  14.941 -13.106 -17.085

  No H/Q in entry =           3
  In of MODEL   39
    1    H    ASP  62           H        ASP  62  11.801 -11.604 -16.691
    2    HA   ASP  62           HA       ASP  62  10.931 -13.642 -14.896
    3    HB2  ASP  62           HB2      ASP  62   8.796 -12.335 -14.923
    4    HB3  ASP  62           HB3      ASP  62  10.222 -11.380 -14.528

  No H/Q in entry =           4
  In of MODEL   39
    1    H    ALA  63           H        ALA  63  11.042 -13.707 -18.240
    2    HA   ALA  63           HA       ALA  63   8.654 -14.618 -19.235
    3    HB1  ALA  63           HB1      ALA  63  11.320 -15.966 -19.739
    4    HB3  ALA  63           HB2      ALA  63  10.801 -14.469 -20.511
    5    HB2  ALA  63           HB3      ALA  63   9.919 -15.966 -20.811

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLY  64           H        GLY  64  11.076 -16.608 -17.559
    2    HA3  GLY  64           HA2      GLY  64  10.902 -18.546 -16.344
    3    HA2  GLY  64           HA3      GLY  64   9.203 -18.158 -16.117

  No H/Q in entry =           3
  In of MODEL   39
    1    H    GLU  65           H        GLU  65   8.211 -20.087 -16.531
    2    HA   GLU  65           HA       GLU  65   9.096 -21.926 -18.484
    3    HB2  GLU  65           HB2      GLU  65   6.444 -21.655 -17.075
    4    HB3  GLU  65           HB3      GLU  65   6.863 -23.005 -18.129
    5    HG2  GLU  65           HG2      GLU  65   8.776 -23.562 -16.715
    6    HG3  GLU  65           HG3      GLU  65   8.454 -22.167 -15.687

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLY  66           H        GLY  66   6.515 -19.563 -18.514
    2    HA3  GLY  66           HA2      GLY  66   6.011 -20.021 -21.371
    3    HA2  GLY  66           HA3      GLY  66   4.904 -19.252 -20.253

  No H/Q in entry =           3
  In of MODEL   39
    1    H    LYS  67           H        LYS  67   5.276 -18.056 -22.584
    2    HA   LYS  67           HA       LYS  67   7.424 -16.241 -22.763
    3    HB2  LYS  67           HB2      LYS  67   4.719 -16.297 -24.093
    4    HB3  LYS  67           HB3      LYS  67   6.007 -15.164 -24.526
    5    HG2  LYS  67           HG2      LYS  67   7.529 -17.045 -24.976
    6    HG3  LYS  67           HG3      LYS  67   6.266 -18.187 -24.526
    7    HD2  LYS  67           HD2      LYS  67   4.860 -17.370 -26.379
    8    HD3  LYS  67           HD3      LYS  67   6.127 -16.229 -26.835
    9    HE2  LYS  67           HE2      LYS  67   7.684 -18.094 -27.228
   10    HE3  LYS  67           HE3      LYS  67   6.438 -19.245 -26.749
   11    HZ1  LYS  67           HZ1      LYS  67   5.172 -17.802 -28.623
   12    HZ3  LYS  67           HZ2      LYS  67   5.968 -19.272 -28.918
   13    HZ2  LYS  67           HZ3      LYS  67   6.758 -17.799 -29.226

  No H/Q in entry =          13
  In of MODEL   39
    1    H    MET  68           H        MET  68   4.109 -15.143 -22.644
    2    HA   MET  68           HA       MET  68   4.674 -12.610 -21.559
    3    HB2  MET  68           HB2      MET  68   2.140 -14.191 -21.915
    4    HB3  MET  68           HB3      MET  68   2.142 -12.572 -21.218
    5    HG2  MET  68           HG2      MET  68   3.279 -11.705 -23.232
    6    HG3  MET  68           HG3      MET  68   3.264 -13.324 -23.933
    7    HE1  MET  68           HE1      MET  68   2.395 -11.309 -25.597
    8    HE3  MET  68           HE2      MET  68   0.710 -11.456 -26.086
    9    HE2  MET  68           HE3      MET  68   1.759 -12.870 -26.135

  No H/Q in entry =           9
  In of MODEL   39
    1    H    LYS  69           H        LYS  69   3.478 -15.571 -19.945
    2    HA   LYS  69           HA       LYS  69   2.806 -14.390 -17.499
    3    HB2  LYS  69           HB2      LYS  69   2.082 -16.633 -18.204
    4    HB3  LYS  69           HB3      LYS  69   3.728 -17.227 -17.963
    5    HG2  LYS  69           HG2      LYS  69   3.641 -16.586 -15.598
    6    HG3  LYS  69           HG3      LYS  69   2.021 -15.927 -15.822
    7    HD2  LYS  69           HD2      LYS  69   1.199 -18.168 -16.453
    8    HD3  LYS  69           HD3      LYS  69   2.818 -18.827 -16.207
    9    HE2  LYS  69           HE2      LYS  69   1.715 -19.269 -14.163
   10    HE3  LYS  69           HE3      LYS  69   2.655 -17.813 -13.833
   11    HZ1  LYS  69           HZ1      LYS  69   0.203 -17.026 -14.901
   12    HZ3  LYS  69           HZ2      LYS  69   0.789 -16.775 -13.327
   13    HZ2  LYS  69           HZ3      LYS  69  -0.125 -18.162 -13.686

  No H/Q in entry =          13
  In of MODEL   39
    1    H    VAL  70           H        VAL  70   3.788 -14.022 -15.546
    2    HA   VAL  70           HA       VAL  70   6.737 -14.347 -15.442
    3    HB   VAL  70           HB       VAL  70   6.717 -12.337 -13.975
    4   HG12  VAL  70          HG11      VAL  70   5.321 -11.797 -16.607
    5   HG11  VAL  70          HG12      VAL  70   7.022 -12.248 -16.496
    6   HG13  VAL  70          HG13      VAL  70   6.458 -10.747 -15.762
    7   HG23  VAL  70          HG21      VAL  70   3.794 -12.119 -14.795
    8   HG22  VAL  70          HG22      VAL  70   4.687 -10.992 -13.775
    9   HG21  VAL  70          HG23      VAL  70   4.337 -12.619 -13.194

  No H/Q in entry =           9
  In of MODEL   39
    1    H    SER  71           H        SER  71   7.612 -14.583 -13.255
    2    HA   SER  71           HA       SER  71   6.370 -16.636 -11.752
    3    HB2  SER  71           HB2      SER  71   8.815 -16.229 -11.758
    4    HB3  SER  71           HB3      SER  71   8.553 -14.716 -10.894
    5    HG   SER  71           HG       SER  71   8.478 -17.321 -10.006

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU  72           H        LEU  72   5.047 -16.572 -10.003
    2    HA   LEU  72           HA       LEU  72   3.470 -14.280  -9.545
    3    HB2  LEU  72           HB2      LEU  72   3.805 -16.834  -7.979
    4    HB3  LEU  72           HB3      LEU  72   2.624 -15.593  -7.567
    5    HG   LEU  72           HG       LEU  72   2.774 -16.877 -10.315
    6   HD11  LEU  72          HD11      LEU  72   2.290 -18.566  -8.548
    7   HD13  LEU  72          HD12      LEU  72   0.908 -18.294  -9.606
    8   HD12  LEU  72          HD13      LEU  72   0.942 -17.570  -7.998
    9   HD22  LEU  72          HD21      LEU  72   1.514 -14.903 -10.526
   10   HD21  LEU  72          HD22      LEU  72   0.845 -15.024  -8.907
   11   HD23  LEU  72          HD23      LEU  72   0.271 -16.098 -10.179

  No H/Q in entry =          11
  In of MODEL   39
    1    H    VAL  73           H        VAL  73   6.160 -15.681  -7.795
    2    HA   VAL  73           HA       VAL  73   6.098 -14.151  -5.461
    3    HB   VAL  73           HB       VAL  73   8.313 -14.913  -5.066
    4   HG12  VAL  73          HG11      VAL  73   7.024 -17.018  -6.819
    5   HG11  VAL  73          HG12      VAL  73   6.447 -16.626  -5.199
    6   HG13  VAL  73          HG13      VAL  73   8.070 -17.275  -5.425
    7   HG23  VAL  73          HG21      VAL  73   9.437 -16.125  -7.133
    8   HG22  VAL  73          HG22      VAL  73   9.604 -14.383  -6.927
    9   HG21  VAL  73          HG23      VAL  73   8.417 -15.026  -8.062

  No H/Q in entry =           9
  In of MODEL   39
    1    H    LEU  74           H        LEU  74   7.049 -13.241  -8.644
    2    HA   LEU  74           HA       LEU  74   8.972 -11.267  -8.166
    3    HB2  LEU  74           HB2      LEU  74   8.499 -12.029 -10.401
    4    HB3  LEU  74           HB3      LEU  74   6.833 -11.463 -10.286
    5    HG   LEU  74           HG       LEU  74   7.640  -9.135 -10.076
    6   HD12  LEU  74          HD11      LEU  74  10.133  -8.838 -10.697
    7   HD11  LEU  74          HD12      LEU  74  10.320 -10.523 -10.215
    8   HD13  LEU  74          HD13      LEU  74   9.768  -9.326  -9.043
    9   HD23  LEU  74          HD21      LEU  74   9.092 -10.223 -12.429
   10   HD22  LEU  74          HD22      LEU  74   7.940  -8.912 -12.316
   11   HD21  LEU  74          HD23      LEU  74   7.368 -10.565 -12.295

  No H/Q in entry =          11
  In of MODEL   39
    1    H    VAL  75           H        VAL  75   5.469 -10.929  -8.491
    2    HA   VAL  75           HA       VAL  75   5.340  -8.175  -7.902
    3    HB   VAL  75           HB       VAL  75   3.280 -10.345  -7.494
    4   HG11  VAL  75          HG11      VAL  75   3.052  -7.306  -7.354
    5   HG13  VAL  75          HG12      VAL  75   2.784  -8.435  -6.034
    6   HG12  VAL  75          HG13      VAL  75   1.681  -8.410  -7.402
    7   HG23  VAL  75          HG21      VAL  75   2.355  -9.378  -9.581
    8   HG22  VAL  75          HG22      VAL  75   4.000  -9.961  -9.829
    9   HG21  VAL  75          HG23      VAL  75   3.695  -8.234  -9.644

  No H/Q in entry =           9
  In of MODEL   39
    1    H    GLU  76           H        GLU  76   5.141 -11.056  -5.792
    2    HA   GLU  76           HA       GLU  76   4.671  -9.703  -3.367
    3    HB2  GLU  76           HB2      GLU  76   4.521 -12.168  -3.588
    4    HB3  GLU  76           HB3      GLU  76   6.253 -12.251  -3.864
    5    HG2  GLU  76           HG2      GLU  76   5.854 -12.839  -1.556
    6    HG3  GLU  76           HG3      GLU  76   6.605 -11.254  -1.564

  No H/Q in entry =           6
  In of MODEL   39
    1    H    ALA  77           H        ALA  77   7.731 -10.568  -4.953
    2    HA   ALA  77           HA       ALA  77   9.421  -9.503  -2.949
    3    HB3  ALA  77           HB1      ALA  77  10.140  -9.540  -5.871
    4    HB1  ALA  77           HB2      ALA  77  10.014 -11.034  -4.943
    5    HB2  ALA  77           HB3      ALA  77  11.184  -9.801  -4.474

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLN  78           H        GLN  78   7.989  -8.103  -5.851
    2    HA   GLN  78           HA       GLN  78   9.309  -5.606  -5.755
    3    HB2  GLN  78           HB2      GLN  78   8.011  -6.535  -7.704
    4    HB3  GLN  78           HB3      GLN  78   6.530  -6.181  -6.819
    5    HG2  GLN  78           HG2      GLN  78   7.151  -3.800  -6.724
    6    HG3  GLN  78           HG3      GLN  78   8.636  -4.149  -7.610
    7   HE21  GLN  78          HE21      GLN  78   6.678  -2.351  -8.681
    8   HE22  GLN  78          HE22      GLN  78   5.986  -3.072 -10.053

  No H/Q in entry =           8
  In of MODEL   39
    1    H    LEU  79           H        LEU  79   6.315  -6.784  -4.305
    2    HA   LEU  79           HA       LEU  79   5.297  -4.391  -3.287
    3    HB2  LEU  79           HB2      LEU  79   4.009  -6.459  -3.224
    4    HB3  LEU  79           HB3      LEU  79   5.171  -7.184  -2.117
    5    HG   LEU  79           HG       LEU  79   4.610  -5.551  -0.385
    6   HD13  LEU  79          HD11      LEU  79   4.111  -3.542  -1.431
    7   HD12  LEU  79          HD12      LEU  79   2.496  -4.088  -0.981
    8   HD11  LEU  79          HD13      LEU  79   3.068  -4.302  -2.633
    9   HD23  LEU  79          HD21      LEU  79   2.031  -6.076  -0.278
   10   HD22  LEU  79          HD22      LEU  79   3.188  -7.401  -0.178
   11   HD21  LEU  79          HD23      LEU  79   2.360  -7.073  -1.697

  No H/Q in entry =          11
  In of MODEL   39
    1    H    HIS  80           H        HIS  80   7.520  -6.699  -1.720
    2    HA   HIS  80           HA       HIS  80   7.804  -5.155   0.648
    3    HB2  HIS  80           HB2      HIS  80   9.164  -7.501  -0.561
    4    HB3  HIS  80           HB3      HIS  80  10.071  -6.593   0.650
    5    HD1  HIS  80           HD1      HIS  80   9.604  -7.237   2.996
    6    HD2  HIS  80           HD2      HIS  80   6.382  -8.126   0.504
    7    HE1  HIS  80           HE1      HIS  80   7.855  -8.363   4.455
    8    HE2  HIS  80           HE2      HIS  80   5.885  -8.909   2.944

  No H/Q in entry =           8
  In of MODEL   39
    1    H    LEU  81           H        LEU  81   9.794  -5.404  -2.277
    2    HA   LEU  81           HA       LEU  81  11.822  -3.638  -1.411
    3    HB2  LEU  81           HB2      LEU  81  10.893  -4.440  -4.168
    4    HB3  LEU  81           HB3      LEU  81  12.302  -3.417  -3.886
    5    HG   LEU  81           HG       LEU  81  11.951  -6.143  -2.612
    6   HD12  LEU  81          HD11      LEU  81  13.764  -6.746  -4.374
    7   HD11  LEU  81          HD12      LEU  81  13.175  -5.328  -5.241
    8   HD13  LEU  81          HD13      LEU  81  12.082  -6.667  -4.897
    9   HD23  LEU  81          HD21      LEU  81  14.575  -5.796  -2.615
   10   HD22  LEU  81          HD22      LEU  81  13.592  -5.048  -1.358
   11   HD21  LEU  81          HD23      LEU  81  14.150  -4.089  -2.727

  No H/Q in entry =          11
  In of MODEL   39
    1    H    MET  82           H        MET  82   8.879  -3.036  -3.329
    2    HA   MET  82           HA       MET  82   9.383  -0.303  -3.831
    3    HB2  MET  82           HB2      MET  82   6.844  -1.928  -3.691
    4    HB3  MET  82           HB3      MET  82   6.821  -0.203  -4.054
    5    HG2  MET  82           HG2      MET  82   8.436  -2.256  -5.601
    6    HG3  MET  82           HG3      MET  82   6.858  -1.652  -6.103
    7    HE3  MET  82           HE1      MET  82   7.259   1.808  -7.275
    8    HE2  MET  82           HE2      MET  82   6.897   1.577  -5.566
    9    HE1  MET  82           HE3      MET  82   6.238   0.460  -6.758

  No H/Q in entry =           9
  In of MODEL   39
    1    H    THR  83           H        THR  83   7.626  -1.924  -1.216
    2    HA   THR  83           HA       THR  83   6.756   0.413   0.117
    3    HB   THR  83           HB       THR  83   6.653  -1.164   2.135
    4    HG1  THR  83           HG1      THR  83   7.431  -3.105   1.899
    5   HG22  THR  83          HG21      THR  83   5.009  -2.748   0.676
    6   HG21  THR  83          HG22      THR  83   5.213  -1.416  -0.456
    7   HG23  THR  83          HG23      THR  83   4.579  -1.110   1.161

  No H/Q in entry =           7
  In of MODEL   39
    1    H    SER  84           H        SER  84   9.607  -1.652   0.619
    2    HA   SER  84           HA       SER  84  10.664  -0.211   2.802
    3    HB2  SER  84           HB2      SER  84  11.926  -2.038   0.768
    4    HB3  SER  84           HB3      SER  84  12.871  -1.275   2.044
    5    HG   SER  84           HG       SER  84  10.618  -2.991   2.317

  No H/Q in entry =           5
  In of MODEL   39
    1    H    MET  85           H        MET  85  11.392   0.061  -0.690
    2    HA   MET  85           HA       MET  85  13.370   2.048  -0.450
    3    HB2  MET  85           HB2      MET  85  12.974   0.762  -2.514
    4    HB3  MET  85           HB3      MET  85  11.438   1.601  -2.734
    5    HG2  MET  85           HG2      MET  85  12.611   3.757  -2.868
    6    HG3  MET  85           HG3      MET  85  14.151   2.945  -2.604
    7    HE2  MET  85           HE1      MET  85  14.687   3.844  -6.219
    8    HE1  MET  85           HE2      MET  85  14.897   4.268  -4.522
    9    HE3  MET  85           HE3      MET  85  13.467   4.820  -5.385

  No H/Q in entry =           9
  In of MODEL   39
    1    H    LEU  86           H        LEU  86   9.873   2.344  -0.937
    2    HA   LEU  86           HA       LEU  86   9.777   5.156  -1.117
    3    HB2  LEU  86           HB2      LEU  86   7.948   3.477  -1.682
    4    HB3  LEU  86           HB3      LEU  86   7.630   3.382   0.050
    5    HG   LEU  86           HG       LEU  86   7.440   5.941   0.000
    6   HD11  LEU  86          HD11      LEU  86   8.204   5.516  -2.707
    7   HD13  LEU  86          HD12      LEU  86   7.756   7.038  -1.943
    8   HD12  LEU  86          HD13      LEU  86   6.526   6.062  -2.741
    9   HD23  LEU  86          HD21      LEU  86   5.311   4.566  -1.650
   10   HD22  LEU  86          HD22      LEU  86   5.115   5.823  -0.432
   11   HD21  LEU  86          HD23      LEU  86   5.535   4.183   0.057

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ALA  87           H        ALA  87   9.352   2.971   1.631
    2    HA   ALA  87           HA       ALA  87   8.795   4.878   3.605
    3    HB1  ALA  87           HB1      ALA  87   9.632   2.066   3.511
    4    HB3  ALA  87           HB2      ALA  87   8.505   2.866   4.605
    5    HB2  ALA  87           HB3      ALA  87  10.235   2.915   4.938

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ARG  88           H        ARG  88  11.887   3.487   2.604
    2    HA   ARG  88           HA       ARG  88  13.493   4.881   4.427
    3    HB2  ARG  88           HB2      ARG  88  14.174   2.916   3.018
    4    HB3  ARG  88           HB3      ARG  88  14.306   4.011   1.645
    5    HG2  ARG  88           HG2      ARG  88  15.778   5.340   3.583
    6    HG3  ARG  88           HG3      ARG  88  16.119   3.654   3.959
    7    HD2  ARG  88           HD2      ARG  88  17.377   3.372   2.104
    8    HD3  ARG  88           HD3      ARG  88  16.224   4.232   1.078
    9    HE   ARG  88           HE       ARG  88  18.614   5.321   2.111
   10   HH21  ARG  88          HH11      ARG  88  18.934   7.543   1.916
   11   HH22  ARG  88          HH12      ARG  88  17.571   8.600   1.782
   12   HH11  ARG  88          HH21      ARG  88  15.265   6.038   1.855
   13   HH12  ARG  88          HH22      ARG  88  15.492   7.745   1.723

  No H/Q in entry =          13
  In of MODEL   39
    1    H    GLU  89           H        GLU  89  12.489   5.771   1.111
    2    HA   GLU  89           HA       GLU  89  14.010   8.148   0.946
    3    HB2  GLU  89           HB2      GLU  89  12.864   7.096  -0.995
    4    HB3  GLU  89           HB3      GLU  89  11.318   7.620  -0.327
    5    HG2  GLU  89           HG2      GLU  89  11.994   9.965  -0.492
    6    HG3  GLU  89           HG3      GLU  89  13.599   9.492  -1.040

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LEU  90           H        LEU  90  10.693   7.601   2.097
    2    HA   LEU  90           HA       LEU  90  10.153  10.329   2.678
    3    HB2  LEU  90           HB2      LEU  90   8.992   7.742   3.711
    4    HB3  LEU  90           HB3      LEU  90   8.347   9.330   4.139
    5    HG   LEU  90           HG       LEU  90   8.756   8.456   1.267
    6   HD12  LEU  90          HD11      LEU  90   6.227   8.100   1.345
    7   HD11  LEU  90          HD12      LEU  90   6.393   8.090   3.101
    8   HD13  LEU  90          HD13      LEU  90   7.218   6.870   2.130
    9   HD22  LEU  90          HD21      LEU  90   8.437  10.761   1.197
   10   HD21  LEU  90          HD22      LEU  90   7.460  10.782   2.663
   11   HD23  LEU  90          HD23      LEU  90   6.759  10.221   1.146

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  91           H        ILE  91  11.457   7.660   4.589
    2    HA   ILE  91           HA       ILE  91  11.599   9.024   7.058
    3    HB   ILE  91           HB       ILE  91  13.170   6.704   5.922
    4   HG12  ILE  91          HG12      ILE  91  11.167   6.848   8.195
    5   HG13  ILE  91          HG13      ILE  91  10.689   6.563   6.522
    6   HG22  ILE  91          HG21      ILE  91  13.660   6.493   8.560
    7   HG21  ILE  91          HG22      ILE  91  13.565   8.251   8.460
    8   HG23  ILE  91          HG23      ILE  91  14.746   7.377   7.487
    9   HD13  ILE  91          HD11      ILE  91  11.714   4.472   6.444
   10   HD12  ILE  91          HD12      ILE  91  11.131   4.523   8.108
   11   HD11  ILE  91          HD13      ILE  91  12.827   4.854   7.758

  No H/Q in entry =          11
  In of MODEL   39
    1    H    THR  92           H        THR  92  13.799   8.881   4.291
    2    HA   THR  92           HA       THR  92  15.957  10.297   5.438
    3    HB   THR  92           HB       THR  92  14.953  10.163   2.583
    4    HG1  THR  92           HG1      THR  92  15.808   8.275   2.981
    5   HG22  THR  92          HG21      THR  92  17.514  10.882   2.273
    6   HG21  THR  92          HG22      THR  92  17.207  11.698   3.805
    7   HG23  THR  92          HG23      THR  92  16.223  12.076   2.392

  No H/Q in entry =           7
  In of MODEL   39
    1    H    GLU  93           H        GLU  93  13.046  11.420   3.729
    2    HA   GLU  93           HA       GLU  93  13.611  14.187   3.841
    3    HB2  GLU  93           HB2      GLU  93  10.922  12.785   3.872
    4    HB3  GLU  93           HB3      GLU  93  11.189  14.488   3.500
    5    HG2  GLU  93           HG2      GLU  93  12.541  12.262   1.961
    6    HG3  GLU  93           HG3      GLU  93  10.984  12.928   1.485

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LEU  94           H        LEU  94  11.907  12.011   6.062
    2    HA   LEU  94           HA       LEU  94  11.089  13.946   7.945
    3    HB2  LEU  94           HB2      LEU  94  11.699  10.998   8.213
    4    HB3  LEU  94           HB3      LEU  94  11.126  11.966   9.568
    5    HG   LEU  94           HG       LEU  94   9.624  12.004   6.950
    6   HD11  LEU  94          HD11      LEU  94   9.744   9.782   8.951
    7   HD13  LEU  94          HD12      LEU  94   9.432   9.719   7.218
    8   HD12  LEU  94          HD13      LEU  94   8.155  10.221   8.326
    9   HD23  LEU  94          HD21      LEU  94   7.711  12.381   8.563
   10   HD22  LEU  94          HD22      LEU  94   8.936  13.649   8.592
   11   HD21  LEU  94          HD23      LEU  94   8.895  12.430   9.866

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  95           H        ILE  95  14.082  12.050   7.687
    2    HA   ILE  95           HA       ILE  95  15.256  12.983  10.093
    3    HB   ILE  95           HB       ILE  95  16.489  11.929   7.536
    4   HG12  ILE  95          HG12      ILE  95  16.225  10.723  10.305
    5   HG13  ILE  95          HG13      ILE  95  15.053  10.453   9.017
    6   HG21  ILE  95          HG21      ILE  95  17.754  12.748  10.170
    7   HG23  ILE  95          HG22      ILE  95  18.199  13.282   8.548
    8   HG22  ILE  95          HG23      ILE  95  18.527  11.625   9.053
    9   HD13  ILE  95          HD11      ILE  95  16.538   9.191   7.743
   10   HD12  ILE  95          HD12      ILE  95  17.027   8.747   9.375
   11   HD11  ILE  95          HD13      ILE  95  17.961   9.937   8.471

  No H/Q in entry =          11
  In of MODEL   39
    1    H    GLU  96           H        GLU  96  15.374  14.220   6.759
    2    HA   GLU  96           HA       GLU  96  17.202  16.318   7.225
    3    HB2  GLU  96           HB2      GLU  96  16.529  15.651   4.970
    4    HB3  GLU  96           HB3      GLU  96  14.882  16.189   5.282
    5    HG2  GLU  96           HG2      GLU  96  15.421  18.325   4.738
    6    HG3  GLU  96           HG3      GLU  96  16.728  18.339   5.911

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LEU  97           H        LEU  97  13.696  16.093   7.679
    2    HA   LEU  97           HA       LEU  97  13.254  18.822   8.326
    3    HB2  LEU  97           HB2      LEU  97  11.768  16.279   8.948
    4    HB3  LEU  97           HB3      LEU  97  11.243  17.820   9.624
    5    HG   LEU  97           HG       LEU  97  11.709  17.411   6.656
    6   HD12  LEU  97          HD11      LEU  97   9.187  17.256   6.555
    7   HD11  LEU  97          HD12      LEU  97   9.195  17.055   8.305
    8   HD13  LEU  97          HD13      LEU  97   9.981  15.857   7.277
    9   HD23  LEU  97          HD21      LEU  97   9.951  19.357   6.702
   10   HD22  LEU  97          HD22      LEU  97  11.631  19.734   7.083
   11   HD21  LEU  97          HD23      LEU  97  10.453  19.550   8.381

  No H/Q in entry =          11
  In of MODEL   39
    1    H    HIS  98           H        HIS  98  14.120  16.003  10.313
    2    HA   HIS  98           HA       HIS  98  13.966  17.260  12.831
    3    HB2  HIS  98           HB2      HIS  98  15.733  15.022  11.815
    4    HB3  HIS  98           HB3      HIS  98  15.738  15.560  13.497
    5    HD1  HIS  98           HD1      HIS  98  13.538  13.909  10.919
    6    HD2  HIS  98           HD2      HIS  98  13.450  14.824  14.985
    7    HE1  HIS  98           HE1      HIS  98  11.533  12.691  11.884
    8    HE2  HIS  98           HE2      HIS  98  11.459  13.240  14.357

  No H/Q in entry =           8
  In of MODEL   39
    1    H    GLU  99           H        GLU  99  16.504  17.174  10.378
    2    HA   GLU  99           HA       GLU  99  18.486  18.526  11.895
    3    HB2  GLU  99           HB2      GLU  99  18.964  17.245   9.821
    4    HB3  GLU  99           HB3      GLU  99  18.134  18.492   8.887
    5    HG2  GLU  99           HG2      GLU  99  19.730  20.179   9.668
    6    HG3  GLU  99           HG3      GLU  99  20.529  18.984  10.684

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LYS 100           H        LYS 100  15.934  19.663   9.697
    2    HA   LYS 100           HA       LYS 100  16.704  22.409   9.838
    3    HB2  LYS 100           HB2      LYS 100  14.079  21.093   9.101
    4    HB3  LYS 100           HB3      LYS 100  14.360  22.834   9.010
    5    HG2  LYS 100           HG2      LYS 100  16.326  22.407   7.529
    6    HG3  LYS 100           HG3      LYS 100  15.931  20.686   7.548
    7    HD2  LYS 100           HD2      LYS 100  13.724  21.174   6.564
    8    HD3  LYS 100           HD3      LYS 100  14.102  22.897   6.552
    9    HE2  LYS 100           HE2      LYS 100  16.056  22.438   5.078
   10    HE3  LYS 100           HE3      LYS 100  15.608  20.728   5.046
   11    HZ1  LYS 100           HZ1      LYS 100  13.754  22.903   4.226
   12    HZ3  LYS 100           HZ2      LYS 100  13.585  21.232   3.964
   13    HZ2  LYS 100           HZ3      LYS 100  14.781  22.107   3.135

  No H/Q in entry =          13
  In of MODEL   39
    1    H    LEU 101           H        LEU 101  14.642  20.339  11.816
    2    HA   LEU 101           HA       LEU 101  13.466  22.394  13.405
    3    HB2  LEU 101           HB2      LEU 101  13.941  19.449  13.782
    4    HB3  LEU 101           HB3      LEU 101  13.404  20.422  15.148
    5    HG   LEU 101           HG       LEU 101  11.966  20.498  12.489
    6   HD12  LEU 101          HD11      LEU 101  10.332  18.917  13.768
    7   HD11  LEU 101          HD12      LEU 101  11.738  18.517  14.753
    8   HD13  LEU 101          HD13      LEU 101  11.762  18.212  13.015
    9   HD21  LEU 101          HD21      LEU 101  11.322  21.282  15.347
   10   HD23  LEU 101          HD22      LEU 101  10.055  21.045  14.145
   11   HD22  LEU 101          HD23      LEU 101  11.275  22.292  13.900

  No H/Q in entry =          11
  In of MODEL   39
    1    H    LYS 102           H        LYS 102  16.616  21.818  12.945
    2    HA   LYS 102           HA       LYS 102  18.461  22.707  14.005
    3    HB2  LYS 102           HB2      LYS 102  16.640  24.202  15.153
    4    HB3  LYS 102           HB3      LYS 102  16.868  23.141  16.527
    5    HG2  LYS 102           HG2      LYS 102  18.732  25.172  15.347
    6    HG3  LYS 102           HG3      LYS 102  18.365  24.852  17.028
    7    HD2  LYS 102           HD2      LYS 102  20.039  22.958  15.328
    8    HD3  LYS 102           HD3      LYS 102  20.722  24.286  16.257
    9    HE2  LYS 102           HE2      LYS 102  20.356  21.732  17.226
   10    HE3  LYS 102           HE3      LYS 102  20.567  23.175  18.218
   11    HZ2  LYS 102           HZ1      LYS 102  18.616  21.871  18.848
   12    HZ1  LYS 102           HZ2      LYS 102  17.959  22.096  17.304
   13    HZ3  LYS 102           HZ3      LYS 102  18.183  23.427  18.330

  No H/Q in entry =          13
  In of MODEL   39
    1    H    ALA 103           H        ALA 103  16.423  21.078  16.440
    2    HA   ALA 103           HA       ALA 103  18.174  19.883  18.082
    3    HB2  ALA 103           HB1      ALA 103  16.610  17.860  18.085
    4    HB1  ALA 103           HB2      ALA 103  15.696  18.706  16.835
    5    HB3  ALA 103           HB3      ALA 103  15.879  19.427  18.433

  No H/Q in entry =           5
  In of MODEL   39
    1    H1   ALA   1           H3       ALA   1  -1.772  -7.128 -21.423
    2    H2   ALA   1           H2       ALA   1  -2.549  -8.571 -20.966
    3    H3   ALA   1           H1       ALA   1  -0.945  -8.605 -21.533
    4    HA   ALA   1           HA       ALA   1  -1.789  -9.080 -23.523
    5    HB1  ALA   1           HB1      ALA   1  -3.915  -9.819 -23.036
    6    HB2  ALA   1           HB2      ALA   1  -4.374  -8.312 -23.828
    7    HB3  ALA   1           HB3      ALA   1  -4.300  -8.393 -22.070

  No H/Q in entry =           7
  In of MODEL   39
    1    H    GLU   2           H        GLU   2  -2.644  -7.895 -25.506
    2    HA   GLU   2           HA       GLU   2  -1.270  -5.868 -26.391
    3    HB2  GLU   2           HB2      GLU   2  -4.279  -5.963 -26.687
    4    HB3  GLU   2           HB3      GLU   2  -3.174  -5.088 -27.744
    5    HG2  GLU   2           HG2      GLU   2  -2.661  -6.972 -28.904
    6    HG3  GLU   2           HG3      GLU   2  -2.345  -7.876 -27.430

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLU   3           H        GLU   3  -4.436  -4.641 -25.467
    2    HA   GLU   3           HA       GLU   3  -3.409  -2.076 -24.843
    3    HB2  GLU   3           HB2      GLU   3  -6.082  -3.417 -24.494
    4    HB3  GLU   3           HB3      GLU   3  -5.795  -1.799 -23.847
    5    HG2  GLU   3           HG2      GLU   3  -5.462  -0.867 -25.975
    6    HG3  GLU   3           HG3      GLU   3  -5.058  -2.417 -26.704

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LEU   4           H        LEU   4  -4.962  -4.453 -22.655
    2    HA   LEU   4           HA       LEU   4  -4.593  -3.224 -20.265
    3    HB2  LEU   4           HB2      LEU   4  -4.026  -6.159 -20.742
    4    HB3  LEU   4           HB3      LEU   4  -4.428  -5.419 -19.194
    5    HG   LEU   4           HG       LEU   4  -6.217  -5.506 -21.646
    6   HD13  LEU   4          HD11      LEU   4  -7.387  -7.236 -20.642
    7   HD12  LEU   4          HD12      LEU   4  -6.895  -6.774 -19.014
    8   HD11  LEU   4          HD13      LEU   4  -5.758  -7.605 -20.074
    9   HD23  LEU   4          HD21      LEU   4  -7.896  -4.713 -19.766
   10   HD22  LEU   4          HD22      LEU   4  -6.874  -3.531 -20.582
   11   HD21  LEU   4          HD23      LEU   4  -6.431  -4.119 -18.980

  No H/Q in entry =          11
  In of MODEL   39
    1    H    GLU   5           H        GLU   5  -2.090  -5.041 -22.015
    2    HA   GLU   5           HA       GLU   5  -0.095  -4.741 -19.992
    3    HB2  GLU   5           HB2      GLU   5  -0.027  -6.509 -21.748
    4    HB3  GLU   5           HB3      GLU   5   0.270  -5.260 -22.957
    5    HG2  GLU   5           HG2      GLU   5   2.335  -4.604 -21.802
    6    HG3  GLU   5           HG3      GLU   5   2.037  -5.814 -20.555

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLU   6           H        GLU   6  -0.767  -3.030 -23.030
    2    HA   GLU   6           HA       GLU   6   1.388  -1.179 -22.775
    3    HB2  GLU   6           HB2      GLU   6  -0.899  -1.601 -24.562
    4    HB3  GLU   6           HB3      GLU   6  -0.514   0.101 -24.309
    5    HG2  GLU   6           HG2      GLU   6   0.774  -0.734 -26.201
    6    HG3  GLU   6           HG3      GLU   6   1.869  -0.399 -24.861

  No H/Q in entry =           6
  In of MODEL   39
    1    H    VAL   7           H        VAL   7  -1.943  -1.283 -21.707
    2    HA   VAL   7           HA       VAL   7  -2.184   1.427 -20.866
    3    HB   VAL   7           HB       VAL   7  -3.617  -1.105 -20.023
    4   HG11  VAL   7          HG11      VAL   7  -4.013   1.779 -19.202
    5   HG13  VAL   7          HG12      VAL   7  -3.893   0.354 -18.170
    6   HG12  VAL   7          HG13      VAL   7  -5.334   0.611 -19.152
    7   HG21  VAL   7          HG21      VAL   7  -3.800  -0.028 -22.408
    8   HG23  VAL   7          HG22      VAL   7  -4.752   1.211 -21.588
    9   HG22  VAL   7          HG23      VAL   7  -5.281  -0.471 -21.560

  No H/Q in entry =           9
  In of MODEL   39
    1    H    VAL   8           H        VAL   8  -1.157  -1.551 -19.233
    2    HA   VAL   8           HA       VAL   8  -0.831  -0.472 -16.639
    3    HB   VAL   8           HB       VAL   8   0.590  -2.771 -18.006
    4   HG12  VAL   8          HG11      VAL   8   1.000  -3.431 -15.540
    5   HG11  VAL   8          HG12      VAL   8   0.653  -1.742 -15.166
    6   HG13  VAL   8          HG13      VAL   8   2.011  -2.153 -16.214
    7   HG21  VAL   8          HG21      VAL   8  -2.068  -2.583 -17.294
    8   HG23  VAL   8          HG22      VAL   8  -1.364  -3.225 -15.813
    9   HG22  VAL   8          HG23      VAL   8  -1.173  -4.101 -17.328

  No H/Q in entry =           9
  In of MODEL   39
    1    H    MET   9           H        MET   9   1.402  -0.748 -19.402
    2    HA   MET   9           HA       MET   9   3.687   0.314 -18.155
    3    HB2  MET   9           HB2      MET   9   2.713   0.272 -21.002
    4    HB3  MET   9           HB3      MET   9   4.180   1.148 -20.571
    5    HG2  MET   9           HG2      MET   9   4.914  -1.029 -19.395
    6    HG3  MET   9           HG3      MET   9   3.618  -1.806 -20.306
    7    HE3  MET   9           HE1      MET   9   4.544  -1.845 -23.849
    8    HE2  MET   9           HE2      MET   9   3.532  -0.555 -23.207
    9    HE1  MET   9           HE3      MET   9   3.411  -2.177 -22.534

  No H/Q in entry =           9
  In of MODEL   39
    1    H    GLY  10           H        GLY  10   0.977   1.894 -19.812
    2    HA3  GLY  10           HA2      GLY  10   1.919   4.556 -19.570
    3    HA2  GLY  10           HA3      GLY  10   0.232   4.081 -19.764

  No H/Q in entry =           3
  In of MODEL   39
    1    H    LEU  11           H        LEU  11  -0.138   2.548 -17.477
    2    HA   LEU  11           HA       LEU  11  -0.670   4.518 -15.511
    3    HB2  LEU  11           HB2      LEU  11  -0.577   1.502 -15.359
    4    HB3  LEU  11           HB3      LEU  11  -1.084   2.519 -14.012
    5    HG   LEU  11           HG       LEU  11  -2.344   2.626 -16.766
    6   HD13  LEU  11          HD11      LEU  11  -2.905   0.477 -16.010
    7   HD12  LEU  11          HD12      LEU  11  -4.259   1.457 -15.453
    8   HD11  LEU  11          HD13      LEU  11  -2.991   0.986 -14.322
    9   HD22  LEU  11          HD21      LEU  11  -2.944   4.636 -15.752
   10   HD21  LEU  11          HD22      LEU  11  -2.852   3.968 -14.123
   11   HD23  LEU  11          HD23      LEU  11  -4.231   3.592 -15.155

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  12           H        ILE  12   1.891   2.073 -15.776
    2    HA   ILE  12           HA       ILE  12   3.111   2.616 -13.280
    3    HB   ILE  12           HB       ILE  12   4.356   1.592 -15.853
    4   HG12  ILE  12          HG12      ILE  12   2.359   0.343 -14.696
    5   HG13  ILE  12          HG13      ILE  12   3.759  -0.581 -15.200
    6   HG23  ILE  12          HG21      ILE  12   6.115   2.331 -14.367
    7   HG22  ILE  12          HG22      ILE  12   6.045   0.572 -14.271
    8   HG21  ILE  12          HG23      ILE  12   5.344   1.554 -12.986
    9   HD11  ILE  12          HD11      ILE  12   3.332   0.512 -12.408
   10   HD13  ILE  12          HD12      ILE  12   4.600  -0.596 -12.928
   11   HD12  ILE  12          HD13      ILE  12   2.933  -1.125 -12.900

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  13           H        ILE  13   3.677   3.889 -16.540
    2    HA   ILE  13           HA       ILE  13   5.806   5.625 -15.829
    3    HB   ILE  13           HB       ILE  13   3.757   5.697 -18.058
    4   HG12  ILE  13          HG12      ILE  13   5.613   3.867 -17.790
    5   HG13  ILE  13          HG13      ILE  13   5.334   4.596 -19.367
    6   HG21  ILE  13          HG21      ILE  13   5.983   7.598 -17.396
    7   HG23  ILE  13          HG22      ILE  13   4.387   7.944 -18.053
    8   HG22  ILE  13          HG23      ILE  13   5.636   7.260 -19.093
    9   HD12  ILE  13          HD11      ILE  13   7.786   4.442 -18.693
   10   HD11  ILE  13          HD12      ILE  13   7.424   5.600 -17.418
   11   HD13  ILE  13          HD13      ILE  13   7.232   6.064 -19.105

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ASN  14           H        ASN  14   2.294   6.092 -16.069
    2    HA   ASN  14           HA       ASN  14   2.234   8.837 -15.428
    3    HB2  ASN  14           HB2      ASN  14   0.348   7.181 -16.246
    4    HB3  ASN  14           HB3      ASN  14   0.041   6.998 -14.524
    5   HD21  ASN  14          HD21      ASN  14  -1.999   8.139 -15.939
    6   HD22  ASN  14          HD22      ASN  14  -2.073   9.812 -15.669

  No H/Q in entry =           6
  In of MODEL   39
    1    H    SER  15           H        SER  15   1.978   5.955 -13.353
    2    HA   SER  15           HA       SER  15   1.679   7.319 -10.901
    3    HB2  SER  15           HB2      SER  15   2.249   5.237  -9.858
    4    HB3  SER  15           HB3      SER  15   1.418   4.811 -11.351
    5    HG   SER  15           HG       SER  15   3.971   4.323 -10.588

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLY  16           H        GLY  16   4.550   6.249 -12.683
    2    HA3  GLY  16           HA2      GLY  16   6.484   7.019 -10.766
    3    HA2  GLY  16           HA3      GLY  16   6.775   6.821 -12.493

  No H/Q in entry =           3
  In of MODEL   39
    1    H    GLN  17           H        GLN  17   5.061   8.766 -13.540
    2    HA   GLN  17           HA       GLN  17   6.620  11.121 -13.241
    3    HB2  GLN  17           HB2      GLN  17   5.270  10.610 -15.268
    4    HB3  GLN  17           HB3      GLN  17   3.799  10.864 -14.327
    5    HG2  GLN  17           HG2      GLN  17   4.325  12.903 -15.555
    6    HG3  GLN  17           HG3      GLN  17   4.558  13.185 -13.830
    7   HE21  GLN  17          HE21      GLN  17   6.253  14.738 -13.915
    8   HE22  GLN  17          HE22      GLN  17   7.767  14.424 -14.616

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ALA  18           H        ALA  18   3.539  10.073 -11.869
    2    HA   ALA  18           HA       ALA  18   2.802  12.454 -10.594
    3    HB1  ALA  18           HB1      ALA  18   1.694   9.987 -10.811
    4    HB2  ALA  18           HB2      ALA  18   1.143  11.201  -9.658
    5    HB3  ALA  18           HB3      ALA  18   2.249   9.928  -9.139

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ARG  19           H        ARG  19   4.711   9.707  -9.333
    2    HA   ARG  19           HA       ARG  19   5.252  10.866  -6.814
    3    HB2  ARG  19           HB2      ARG  19   5.685   8.468  -7.347
    4    HB3  ARG  19           HB3      ARG  19   7.028   8.968  -8.378
    5    HG2  ARG  19           HG2      ARG  19   8.153  10.016  -6.463
    6    HG3  ARG  19           HG3      ARG  19   6.789   9.613  -5.421
    7    HD2  ARG  19           HD2      ARG  19   8.569   7.995  -5.079
    8    HD3  ARG  19           HD3      ARG  19   7.196   7.201  -5.856
    9    HE   ARG  19           HE       ARG  19   8.877   8.038  -7.915
   10   HH21  ARG  19          HH11      ARG  19  10.445   6.649  -8.779
   11   HH22  ARG  19          HH12      ARG  19  11.010   5.305  -7.849
   12   HH11  ARG  19          HH21      ARG  19   8.990   6.005  -5.140
   13   HH12  ARG  19          HH22      ARG  19  10.184   4.940  -5.788

  No H/Q in entry =          13
  In of MODEL   39
    1    H    SER  20           H        SER  20   7.046  10.917  -9.877
    2    HA   SER  20           HA       SER  20   9.283  12.354  -9.068
    3    HB2  SER  20           HB2      SER  20   9.309  11.483 -11.273
    4    HB3  SER  20           HB3      SER  20   7.796  12.280 -11.688
    5    HG   SER  20           HG       SER  20  10.264  13.550 -11.077

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU  21           H        LEU  21   6.162  13.593 -10.240
    2    HA   LEU  21           HA       LEU  21   6.807  16.345 -10.017
    3    HB2  LEU  21           HB2      LEU  21   4.155  14.893  -9.919
    4    HB3  LEU  21           HB3      LEU  21   4.302  16.649  -9.920
    5    HG   LEU  21           HG       LEU  21   5.500  14.871 -12.065
    6   HD12  LEU  21          HD11      LEU  21   3.515  15.954 -13.397
    7   HD11  LEU  21          HD12      LEU  21   2.790  16.149 -11.799
    8   HD13  LEU  21          HD13      LEU  21   3.208  14.539 -12.387
    9   HD21  LEU  21          HD21      LEU  21   5.238  17.843 -11.639
   10   HD23  LEU  21          HD22      LEU  21   5.249  17.222 -13.287
   11   HD22  LEU  21          HD23      LEU  21   6.626  16.936 -12.234

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ALA  22           H        ALA  22   5.336  14.037  -7.760
    2    HA   ALA  22           HA       ALA  22   4.729  15.836  -5.686
    3    HB3  ALA  22           HB1      ALA  22   3.993  13.436  -5.847
    4    HB2  ALA  22           HB2      ALA  22   4.588  13.912  -4.256
    5    HB1  ALA  22           HB3      ALA  22   5.613  12.966  -5.336

  No H/Q in entry =           5
  In of MODEL   39
    1    H    TYR  23           H        TYR  23   7.681  13.843  -6.150
    2    HA   TYR  23           HA       TYR  23   9.070  14.874  -3.906
    3    HB2  TYR  23           HB2      TYR  23   9.868  12.877  -5.076
    4    HB3  TYR  23           HB3      TYR  23  10.165  13.823  -6.534
    5    HD1  TYR  23           HD1      TYR  23  11.145  13.497  -2.944
    6    HD2  TYR  23           HD2      TYR  23  12.191  15.002  -6.831
    7    HE1  TYR  23           HE1      TYR  23  13.402  14.093  -2.107
    8    HE2  TYR  23           HE2      TYR  23  14.447  15.600  -5.991
    9    HH   TYR  23           HH       TYR  23  15.486  14.717  -2.725

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ALA  24           H        ALA  24   8.849  15.983  -7.270
    2    HA   ALA  24           HA       ALA  24  10.723  18.090  -7.035
    3    HB2  ALA  24           HB1      ALA  24  10.263  18.150  -9.241
    4    HB3  ALA  24           HB2      ALA  24   8.702  18.881  -8.868
    5    HB1  ALA  24           HB3      ALA  24   8.846  17.129  -9.002

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA  25           H        ALA  25   7.251  17.864  -6.388
    2    HA   ALA  25           HA       ALA  25   6.743  20.575  -5.812
    3    HB1  ALA  25           HB1      ALA  25   5.105  18.557  -6.002
    4    HB2  ALA  25           HB2      ALA  25   4.730  19.840  -4.850
    5    HB3  ALA  25           HB3      ALA  25   5.442  18.327  -4.286

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU  26           H        LEU  26   7.860  17.906  -3.773
    2    HA   LEU  26           HA       LEU  26   7.966  19.336  -1.335
    3    HB2  LEU  26           HB2      LEU  26   8.091  16.921  -1.333
    4    HB3  LEU  26           HB3      LEU  26   9.553  16.948  -2.315
    5    HG   LEU  26           HG       LEU  26  10.768  18.079  -0.483
    6   HD12  LEU  26          HD11      LEU  26   9.559  18.069   1.786
    7   HD11  LEU  26          HD12      LEU  26   8.067  17.913   0.862
    8   HD13  LEU  26          HD13      LEU  26   9.092  19.332   0.647
    9   HD21  LEU  26          HD21      LEU  26   9.272  15.591   0.399
   10   HD23  LEU  26          HD22      LEU  26  10.786  16.171   1.085
   11   HD22  LEU  26          HD23      LEU  26  10.735  15.614  -0.586

  No H/Q in entry =          11
  In of MODEL   39
    1    H    LYS  27           H        LYS  27  10.370  18.796  -3.879
    2    HA   LYS  27           HA       LYS  27  12.547  20.064  -2.667
    3    HB2  LYS  27           HB2      LYS  27  12.650  18.720  -4.759
    4    HB3  LYS  27           HB3      LYS  27  11.861  20.043  -5.617
    5    HG2  LYS  27           HG2      LYS  27  13.712  21.552  -5.052
    6    HG3  LYS  27           HG3      LYS  27  14.496  20.269  -4.123
    7    HD2  LYS  27           HD2      LYS  27  14.641  18.885  -6.179
    8    HD3  LYS  27           HD3      LYS  27  13.902  20.195  -7.101
    9    HE2  LYS  27           HE2      LYS  27  15.775  21.685  -6.501
   10    HE3  LYS  27           HE3      LYS  27  16.518  20.379  -5.571
   11    HZ3  LYS  27           HZ1      LYS  27  17.490  20.494  -7.764
   12    HZ2  LYS  27           HZ2      LYS  27  15.959  20.356  -8.494
   13    HZ1  LYS  27           HZ3      LYS  27  16.606  19.053  -7.615

  No H/Q in entry =          13
  In of MODEL   39
    1    H    GLN  28           H        GLN  28   9.892  21.413  -4.593
    2    HA   GLN  28           HA       GLN  28  10.815  24.078  -4.751
    3    HB2  GLN  28           HB2      GLN  28   7.997  22.972  -4.617
    4    HB3  GLN  28           HB3      GLN  28   8.386  24.649  -4.996
    5    HG2  GLN  28           HG2      GLN  28   9.409  22.252  -6.546
    6    HG3  GLN  28           HG3      GLN  28   8.047  23.256  -7.040
    7   HE21  GLN  28          HE21      GLN  28   8.882  25.830  -6.642
    8   HE22  GLN  28          HE22      GLN  28  10.306  26.154  -7.506

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ALA  29           H        ALA  29   8.925  22.358  -2.302
    2    HA   ALA  29           HA       ALA  29   8.360  24.541  -0.613
    3    HB2  ALA  29           HB1      ALA  29   7.664  22.961   0.959
    4    HB1  ALA  29           HB2      ALA  29   8.898  21.794   0.483
    5    HB3  ALA  29           HB3      ALA  29   7.499  22.070  -0.554

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LYS  30           H        LYS  30  11.120  22.311  -0.707
    2    HA   LYS  30           HA       LYS  30  12.443  23.280   1.587
    3    HB2  LYS  30           HB2      LYS  30  13.536  22.011  -0.933
    4    HB3  LYS  30           HB3      LYS  30  14.525  22.382   0.481
    5    HG2  LYS  30           HG2      LYS  30  13.002  20.977   1.871
    6    HG3  LYS  30           HG3      LYS  30  12.111  20.545   0.408
    7    HD2  LYS  30           HD2      LYS  30  14.161  19.587  -0.570
    8    HD3  LYS  30           HD3      LYS  30  15.071  20.034   0.875
    9    HE2  LYS  30           HE2      LYS  30  13.596  18.581   2.240
   10    HE3  LYS  30           HE3      LYS  30  12.717  18.115   0.778
   11    HZ2  LYS  30           HZ1      LYS  30  14.536  16.560   1.523
   12    HZ1  LYS  30           HZ2      LYS  30  15.653  17.763   1.064
   13    HZ3  LYS  30           HZ3      LYS  30  14.617  17.067  -0.093

  No H/Q in entry =          13
  In of MODEL   39
    1    H    GLN  31           H        GLN  31  12.291  24.486  -1.707
    2    HA   GLN  31           HA       GLN  31  14.421  26.408  -1.301
    3    HB2  GLN  31           HB2      GLN  31  12.361  26.429  -3.509
    4    HB3  GLN  31           HB3      GLN  31  13.971  27.147  -3.522
    5    HG2  GLN  31           HG2      GLN  31  14.474  24.457  -2.953
    6    HG3  GLN  31           HG3      GLN  31  13.162  24.386  -4.122
    7   HE21  GLN  31          HE21      GLN  31  16.013  23.632  -4.549
    8   HE22  GLN  31          HE22      GLN  31  16.561  24.615  -5.818

  No H/Q in entry =           8
  In of MODEL   39
    1    H    GLY  32           H        GLY  32  11.359  26.183  -0.131
    2    HA3  GLY  32           HA2      GLY  32  10.191  27.734   1.153
    3    HA2  GLY  32           HA3      GLY  32  11.296  28.985   0.595

  No H/Q in entry =           3
  In of MODEL   39
    1    H    ASP  33           H        ASP  33   9.938  27.065  -1.889
    2    HA   ASP  33           HA       ASP  33   8.236  29.316  -2.728
    3    HB2  ASP  33           HB2      ASP  33   9.350  26.913  -4.182
    4    HB3  ASP  33           HB3      ASP  33   8.178  28.014  -4.902

  No H/Q in entry =           4
  In of MODEL   39
    1    H    PHE  34           H        PHE  34   6.566  28.816  -1.152
    2    HA   PHE  34           HA       PHE  34   5.221  26.325  -1.048
    3    HB2  PHE  34           HB2      PHE  34   4.228  29.098  -0.358
    4    HB3  PHE  34           HB3      PHE  34   3.403  27.595   0.058
    5    HD1  PHE  34           HD1      PHE  34   5.629  30.023   1.258
    6    HD2  PHE  34           HD2      PHE  34   5.007  25.773   1.205
    7    HE1  PHE  34           HE1      PHE  34   7.039  29.790   3.283
    8    HE2  PHE  34           HE2      PHE  34   6.419  25.544   3.228
    9    HZ   PHE  34           HZ       PHE  34   7.429  27.553   4.267

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ALA  35           H        ALA  35   4.736  29.184  -3.052
    2    HA   ALA  35           HA       ALA  35   2.185  28.536  -4.058
    3    HB3  ALA  35           HB1      ALA  35   3.202  29.945  -6.102
    4    HB2  ALA  35           HB2      ALA  35   4.424  30.321  -4.888
    5    HB1  ALA  35           HB3      ALA  35   2.731  30.707  -4.583

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA  36           H        ALA  36   5.412  27.909  -5.439
    2    HA   ALA  36           HA       ALA  36   4.425  26.468  -7.676
    3    HB3  ALA  36           HB1      ALA  36   6.577  26.623  -8.308
    4    HB2  ALA  36           HB2      ALA  36   7.084  25.600  -6.963
    5    HB1  ALA  36           HB3      ALA  36   6.956  27.346  -6.745

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA  37           H        ALA  37   5.421  25.484  -4.430
    2    HA   ALA  37           HA       ALA  37   5.397  22.696  -4.861
    3    HB2  ALA  37           HB1      ALA  37   5.130  24.480  -2.479
    4    HB1  ALA  37           HB2      ALA  37   6.279  23.179  -2.782
    5    HB3  ALA  37           HB3      ALA  37   4.626  22.802  -2.298

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LYS  38           H        LYS  38   2.843  24.867  -3.671
    2    HA   LYS  38           HA       LYS  38   0.771  23.025  -3.434
    3    HB2  LYS  38           HB2      LYS  38   1.086  25.785  -3.182
    4    HB3  LYS  38           HB3      LYS  38  -0.121  25.623  -4.452
    5    HG2  LYS  38           HG2      LYS  38  -1.541  24.278  -2.999
    6    HG3  LYS  38           HG3      LYS  38  -0.286  24.234  -1.753
    7    HD2  LYS  38           HD2      LYS  38  -0.501  26.567  -1.302
    8    HD3  LYS  38           HD3      LYS  38  -1.428  26.845  -2.776
    9    HE2  LYS  38           HE2      LYS  38  -2.916  26.856  -0.825
   10    HE3  LYS  38           HE3      LYS  38  -3.280  25.476  -1.866
   11    HZ3  LYS  38           HZ1      LYS  38  -2.522  24.014  -0.340
   12    HZ2  LYS  38           HZ2      LYS  38  -2.881  25.265   0.753
   13    HZ1  LYS  38           HZ3      LYS  38  -1.287  25.037   0.215

  No H/Q in entry =          13
  In of MODEL   39
    1    H    ALA  39           H        ALA  39   1.701  24.944  -6.288
    2    HA   ALA  39           HA       ALA  39  -0.375  24.049  -7.976
    3    HB2  ALA  39           HB1      ALA  39   2.343  24.737  -9.050
    4    HB1  ALA  39           HB2      ALA  39   1.365  25.983  -8.276
    5    HB3  ALA  39           HB3      ALA  39   0.753  25.139  -9.698

  No H/Q in entry =           5
  In of MODEL   39
    1    H    MET  40           H        MET  40   2.885  22.795  -7.423
    2    HA   MET  40           HA       MET  40   2.799  20.776  -9.416
    3    HB2  MET  40           HB2      MET  40   4.428  21.019  -6.880
    4    HB3  MET  40           HB3      MET  40   4.686  19.768  -8.098
    5    HG2  MET  40           HG2      MET  40   4.697  22.725  -8.760
    6    HG3  MET  40           HG3      MET  40   6.160  21.843  -8.323
    7    HE3  MET  40           HE1      MET  40   7.040  19.643 -11.141
    8    HE2  MET  40           HE2      MET  40   6.494  19.314  -9.500
    9    HE1  MET  40           HE3      MET  40   7.569  20.676  -9.806

  No H/Q in entry =           9
  In of MODEL   39
    1    H    MET  41           H        MET  41   1.911  20.802  -5.985
    2    HA   MET  41           HA       MET  41   1.420  18.029  -5.706
    3    HB2  MET  41           HB2      MET  41   0.065  20.367  -4.342
    4    HB3  MET  41           HB3      MET  41  -0.063  18.686  -3.835
    5    HG2  MET  41           HG2      MET  41   2.643  18.948  -3.893
    6    HG3  MET  41           HG3      MET  41   2.182  20.599  -3.492
    7    HE2  MET  41           HE1      MET  41  -0.825  19.302  -1.744
    8    HE1  MET  41           HE2      MET  41  -0.033  20.827  -2.126
    9    HE3  MET  41           HE3      MET  41  -0.071  20.253  -0.458

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ASP  42           H        ASP  42  -0.665  20.726  -6.661
    2    HA   ASP  42           HA       ASP  42  -3.087  19.331  -6.780
    3    HB2  ASP  42           HB2      ASP  42  -2.419  21.911  -7.039
    4    HB3  ASP  42           HB3      ASP  42  -2.578  21.516  -8.747

  No H/Q in entry =           4
  In of MODEL   39
    1    H    GLN  43           H        GLN  43  -0.675  19.959  -9.300
    2    HA   GLN  43           HA       GLN  43  -2.059  18.622 -11.380
    3    HB2  GLN  43           HB2      GLN  43   0.895  19.180 -11.021
    4    HB3  GLN  43           HB3      GLN  43   0.178  18.532 -12.498
    5    HG2  GLN  43           HG2      GLN  43  -1.362  20.537 -12.525
    6    HG3  GLN  43           HG3      GLN  43  -0.409  21.205 -11.205
    7   HE21  GLN  43          HE21      GLN  43  -0.287  22.830 -13.290
    8   HE22  GLN  43          HE22      GLN  43   1.124  22.630 -14.209

  No H/Q in entry =           8
  In of MODEL   39
    1    H    SER  44           H        SER  44   0.327  17.513  -9.009
    2    HA   SER  44           HA       SER  44   0.691  14.913 -10.040
    3    HB2  SER  44           HB2      SER  44   1.583  16.363  -7.809
    4    HB3  SER  44           HB3      SER  44   0.746  14.966  -7.133
    5    HG   SER  44           HG       SER  44   2.862  14.377  -7.577

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ARG  45           H        ARG  45  -1.629  16.195  -7.682
    2    HA   ARG  45           HA       ARG  45  -2.976  13.813  -7.039
    3    HB2  ARG  45           HB2      ARG  45  -3.197  15.977  -5.843
    4    HB3  ARG  45           HB3      ARG  45  -4.073  16.633  -7.223
    5    HG2  ARG  45           HG2      ARG  45  -5.811  14.881  -6.928
    6    HG3  ARG  45           HG3      ARG  45  -4.947  14.280  -5.512
    7    HD2  ARG  45           HD2      ARG  45  -5.179  16.542  -4.452
    8    HD3  ARG  45           HD3      ARG  45  -6.184  17.049  -5.826
    9    HE   ARG  45           HE       ARG  45  -7.251  14.656  -4.780
   10   HH21  ARG  45          HH11      ARG  45  -9.077  14.703  -3.495
   11   HH22  ARG  45          HH12      ARG  45  -9.487  16.135  -2.621
   12   HH11  ARG  45          HH21      ARG  45  -6.745  17.909  -3.756
   13   HH12  ARG  45          HH22      ARG  45  -8.161  17.951  -2.767

  No H/Q in entry =          13
  In of MODEL   39
    1    H    MET  46           H        MET  46  -3.616  16.211  -9.582
    2    HA   MET  46           HA       MET  46  -5.945  15.005 -10.627
    3    HB2  MET  46           HB2      MET  46  -3.882  16.867 -11.812
    4    HB3  MET  46           HB3      MET  46  -5.258  16.288 -12.756
    5    HG2  MET  46           HG2      MET  46  -6.812  17.194 -11.100
    6    HG3  MET  46           HG3      MET  46  -5.470  17.707 -10.082
    7    HE2  MET  46           HE1      MET  46  -7.093  19.414 -13.940
    8    HE1  MET  46           HE2      MET  46  -7.269  17.797 -13.265
    9    HE3  MET  46           HE3      MET  46  -5.849  18.191 -14.233

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ALA  47           H        ALA  47  -2.516  14.579 -11.412
    2    HA   ALA  47           HA       ALA  47  -2.852  12.848 -13.622
    3    HB3  ALA  47           HB1      ALA  47  -0.685  13.770 -13.286
    4    HB2  ALA  47           HB2      ALA  47  -0.515  12.044 -12.955
    5    HB1  ALA  47           HB3      ALA  47  -0.615  13.193 -11.620

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU  48           H        LEU  48  -2.546  12.213 -10.151
    2    HA   LEU  48           HA       LEU  48  -2.598   9.373 -10.312
    3    HB2  LEU  48           HB2      LEU  48  -3.374  11.276  -8.090
    4    HB3  LEU  48           HB3      LEU  48  -3.252   9.527  -7.892
    5    HG   LEU  48           HG       LEU  48  -0.987  11.263  -8.905
    6   HD13  LEU  48          HD11      LEU  48  -1.264  12.026  -6.711
    7   HD12  LEU  48          HD12      LEU  48  -0.080  10.736  -6.523
    8   HD11  LEU  48          HD13      LEU  48  -1.770  10.447  -6.113
    9   HD22  LEU  48          HD21      LEU  48  -0.460   9.086  -9.552
   10   HD21  LEU  48          HD22      LEU  48  -1.308   8.356  -8.190
   11   HD23  LEU  48          HD23      LEU  48   0.255   9.133  -7.941

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ASN  49           H        ASN  49  -5.096  11.826  -9.888
    2    HA   ASN  49           HA       ASN  49  -7.252  10.128  -9.334
    3    HB2  ASN  49           HB2      ASN  49  -7.338  12.552  -9.010
    4    HB3  ASN  49           HB3      ASN  49  -7.205  12.812 -10.744
    5   HD21  ASN  49          HD21      ASN  49  -9.411  13.847  -9.342
    6   HD22  ASN  49          HD22      ASN  49 -10.808  12.995  -9.788

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLU  50           H        GLU  50  -6.014  11.347 -12.430
    2    HA   GLU  50           HA       GLU  50  -7.962  10.063 -14.062
    3    HB2  GLU  50           HB2      GLU  50  -6.530  11.906 -14.885
    4    HB3  GLU  50           HB3      GLU  50  -5.119  10.855 -14.759
    5    HG2  GLU  50           HG2      GLU  50  -6.081   9.306 -16.390
    6    HG3  GLU  50           HG3      GLU  50  -7.558  10.262 -16.465

  No H/Q in entry =           6
  In of MODEL   39
    1    H    ALA  51           H        ALA  51  -4.767   9.119 -12.881
    2    HA   ALA  51           HA       ALA  51  -4.601   6.670 -14.303
    3    HB2  ALA  51           HB1      ALA  51  -2.608   6.411 -13.218
    4    HB1  ALA  51           HB2      ALA  51  -3.290   6.821 -11.645
    5    HB3  ALA  51           HB3      ALA  51  -2.863   8.100 -12.782

  No H/Q in entry =           5
  In of MODEL   39
    1    H    HIS  52           H        HIS  52  -5.762   7.480 -11.044
    2    HA   HIS  52           HA       HIS  52  -6.401   4.859 -10.211
    3    HB2  HIS  52           HB2      HIS  52  -6.286   6.749  -8.657
    4    HB3  HIS  52           HB3      HIS  52  -7.680   7.493  -9.440
    5    HD1  HIS  52           HD1      HIS  52  -9.943   5.958  -9.388
    6    HD2  HIS  52           HD2      HIS  52  -6.965   4.969  -6.645
    7    HE1  HIS  52           HE1      HIS  52 -11.047   4.522  -7.618
    8    HE2  HIS  52           HE2      HIS  52  -9.245   3.911  -5.937

  No H/Q in entry =           8
  In of MODEL   39
    1    H    LEU  53           H        LEU  53  -8.272   7.291 -11.982
    2    HA   LEU  53           HA       LEU  53 -10.757   5.962 -11.978
    3    HB2  LEU  53           HB2      LEU  53  -9.519   7.959 -13.861
    4    HB3  LEU  53           HB3      LEU  53 -11.114   7.275 -14.161
    5    HG   LEU  53           HG       LEU  53 -10.380   8.600 -11.530
    6   HD11  LEU  53          HD11      LEU  53 -11.479   9.774 -14.086
    7   HD13  LEU  53          HD12      LEU  53 -10.136  10.355 -13.101
    8   HD12  LEU  53          HD13      LEU  53 -11.791  10.518 -12.522
    9   HD21  LEU  53          HD21      LEU  53 -12.955   7.713 -12.850
   10   HD23  LEU  53          HD22      LEU  53 -12.956   8.960 -11.608
   11   HD22  LEU  53          HD23      LEU  53 -12.390   7.346 -11.225

  No H/Q in entry =          11
  In of MODEL   39
    1    H    VAL  54           H        VAL  54  -8.021   5.808 -14.235
    2    HA   VAL  54           HA       VAL  54  -9.231   4.021 -16.071
    3    HB   VAL  54           HB       VAL  54  -6.326   4.569 -15.410
    4   HG12  VAL  54          HG11      VAL  54  -6.081   3.490 -17.802
    5   HG11  VAL  54          HG12      VAL  54  -7.594   2.687 -17.388
    6   HG13  VAL  54          HG13      VAL  54  -6.168   2.452 -16.380
    7   HG22  VAL  54          HG21      VAL  54  -7.132   6.502 -16.447
    8   HG21  VAL  54          HG22      VAL  54  -8.320   5.622 -17.407
    9   HG23  VAL  54          HG23      VAL  54  -6.615   5.567 -17.850

  No H/Q in entry =           9
  In of MODEL   39
    1    H    GLN  55           H        GLN  55  -7.203   3.501 -13.187
    2    HA   GLN  55           HA       GLN  55  -7.074   0.686 -13.447
    3    HB2  GLN  55           HB2      GLN  55  -5.521   1.603 -11.938
    4    HB3  GLN  55           HB3      GLN  55  -6.745   2.551 -11.099
    5    HG2  GLN  55           HG2      GLN  55  -7.398   0.782  -9.778
    6    HG3  GLN  55           HG3      GLN  55  -7.166  -0.400 -11.059
    7   HE21  GLN  55          HE21      GLN  55  -5.518  -1.826 -10.578
    8   HE22  GLN  55          HE22      GLN  55  -4.132  -1.456  -9.676

  No H/Q in entry =           8
  In of MODEL   39
    1    H    THR  56           H        THR  56  -9.424   2.813 -11.813
    2    HA   THR  56           HA       THR  56 -10.972   0.906 -10.514
    3    HB   THR  56           HB       THR  56 -12.105   3.284 -12.010
    4    HG1  THR  56           HG1      THR  56 -10.484   3.079  -9.768
    5   HG23  THR  56          HG21      THR  56 -13.943   3.098 -10.626
    6   HG22  THR  56          HG22      THR  56 -13.021   2.332  -9.330
    7   HG21  THR  56          HG23      THR  56 -13.493   1.398 -10.750

  No H/Q in entry =           7
  In of MODEL   39
    1    H    LYS  57           H        LYS  57 -11.214   1.989 -13.897
    2    HA   LYS  57           HA       LYS  57 -13.351   0.272 -14.637
    3    HB2  LYS  57           HB2      LYS  57 -12.507   2.239 -15.957
    4    HB3  LYS  57           HB3      LYS  57 -11.063   1.313 -16.341
    5    HG2  LYS  57           HG2      LYS  57 -12.425  -0.381 -17.482
    6    HG3  LYS  57           HG3      LYS  57 -13.891   0.501 -17.072
    7    HD2  LYS  57           HD2      LYS  57 -13.099   2.438 -18.391
    8    HD3  LYS  57           HD3      LYS  57 -11.635   1.553 -18.812
    9    HE2  LYS  57           HE2      LYS  57 -13.002  -0.187 -19.927
   10    HE3  LYS  57           HE3      LYS  57 -14.472   0.694 -19.519
   11    HZ2  LYS  57           HZ1      LYS  57 -12.337   1.434 -21.405
   12    HZ1  LYS  57           HZ2      LYS  57 -13.319   2.635 -20.712
   13    HZ3  LYS  57           HZ3      LYS  57 -14.015   1.399 -21.648

  No H/Q in entry =          13
  In of MODEL   39
    1    H    LEU  58           H        LEU  58  -9.841  -0.109 -14.606
    2    HA   LEU  58           HA       LEU  58  -9.822  -2.625 -15.896
    3    HB2  LEU  58           HB2      LEU  58  -7.794  -1.305 -14.102
    4    HB3  LEU  58           HB3      LEU  58  -7.517  -2.822 -14.959
    5    HG   LEU  58           HG       LEU  58  -8.318  -0.228 -16.315
    6   HD11  LEU  58          HD11      LEU  58  -5.649  -1.428 -15.644
    7   HD13  LEU  58          HD12      LEU  58  -6.168   0.256 -15.590
    8   HD12  LEU  58          HD13      LEU  58  -5.829  -0.509 -17.139
    9   HD22  LEU  58          HD21      LEU  58  -8.882  -1.797 -17.903
   10   HD21  LEU  58          HD22      LEU  58  -7.819  -3.030 -17.230
   11   HD23  LEU  58          HD23      LEU  58  -7.153  -1.746 -18.239

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  59           H        ILE  59 -10.633  -1.736 -12.639
    2    HA   ILE  59           HA       ILE  59 -10.236  -4.499 -11.696
    3    HB   ILE  59           HB       ILE  59  -9.819  -2.222 -10.300
    4   HG12  ILE  59          HG12      ILE  59 -11.126  -4.604  -8.970
    5   HG13  ILE  59          HG13      ILE  59  -9.485  -4.645  -9.566
    6   HG22  ILE  59          HG21      ILE  59 -12.550  -2.998  -9.321
    7   HG21  ILE  59          HG22      ILE  59 -12.377  -1.764 -10.548
    8   HG23  ILE  59          HG23      ILE  59 -11.636  -1.552  -8.963
    9   HD12  ILE  59          HD11      ILE  59 -10.599  -2.804  -7.467
   10   HD11  ILE  59          HD12      ILE  59  -9.002  -2.599  -8.172
   11   HD13  ILE  59          HD13      ILE  59  -9.373  -4.047  -7.236

  No H/Q in entry =          11
  In of MODEL   39
    1    H    GLU  60           H        GLU  60 -12.833  -2.220 -12.485
    2    HA   GLU  60           HA       GLU  60 -14.988  -3.769 -11.457
    3    HB2  GLU  60           HB2      GLU  60 -15.374  -1.460 -11.990
    4    HB3  GLU  60           HB3      GLU  60 -14.830  -1.687 -13.648
    5    HG2  GLU  60           HG2      GLU  60 -17.167  -3.271 -12.612
    6    HG3  GLU  60           HG3      GLU  60 -17.399  -1.625 -13.164

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLY  61           H        GLY  61 -13.337  -3.727 -14.584
    2    HA3  GLY  61           HA2      GLY  61 -15.023  -5.996 -15.464
    3    HA2  GLY  61           HA3      GLY  61 -14.202  -4.879 -16.547

  No H/Q in entry =           3
  In of MODEL   39
    1    H    ASP  62           H        ASP  62 -12.791  -6.314 -13.673
    2    HA   ASP  62           HA       ASP  62 -10.507  -7.216 -15.138
    3    HB2  ASP  62           HB2      ASP  62  -9.832  -8.124 -12.898
    4    HB3  ASP  62           HB3      ASP  62 -10.231  -6.410 -12.886

  No H/Q in entry =           4
  In of MODEL   39
    1    H    ALA  63           H        ALA  63 -13.551  -8.611 -14.852
    2    HA   ALA  63           HA       ALA  63 -13.326 -11.284 -14.301
    3    HB1  ALA  63           HB1      ALA  63 -14.646 -10.173 -16.804
    4    HB2  ALA  63           HB2      ALA  63 -15.371 -10.105 -15.198
    5    HB3  ALA  63           HB3      ALA  63 -15.070 -11.666 -15.966

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLY  64           H        GLY  64 -12.538  -9.768 -17.412
    2    HA3  GLY  64           HA2      GLY  64 -11.098 -10.354 -19.097
    3    HA2  GLY  64           HA3      GLY  64 -10.232 -11.324 -17.912

  No H/Q in entry =           3
  In of MODEL   39
    1    H    GLU  65           H        GLU  65  -9.920 -13.234 -18.958
    2    HA   GLU  65           HA       GLU  65 -11.766 -14.360 -20.777
    3    HB2  GLU  65           HB2      GLU  65  -9.443 -15.587 -19.295
    4    HB3  GLU  65           HB3      GLU  65 -10.364 -16.425 -20.544
    5    HG2  GLU  65           HG2      GLU  65  -9.805 -14.686 -22.169
    6    HG3  GLU  65           HG3      GLU  65  -8.948 -13.773 -20.929

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLY  66           H        GLY  66 -11.066 -15.084 -17.424
    2    HA3  GLY  66           HA2      GLY  66 -13.356 -16.913 -17.246
    3    HA2  GLY  66           HA3      GLY  66 -12.012 -16.846 -16.122

  No H/Q in entry =           3
  In of MODEL   39
    1    H    LYS  67           H        LYS  67 -14.443 -16.957 -15.081
    2    HA   LYS  67           HA       LYS  67 -15.768 -14.501 -14.671
    3    HB2  LYS  67           HB2      LYS  67 -15.839 -17.110 -13.165
    4    HB3  LYS  67           HB3      LYS  67 -16.923 -15.753 -12.830
    5    HG2  LYS  67           HG2      LYS  67 -17.684 -15.767 -15.173
    6    HG3  LYS  67           HG3      LYS  67 -16.594 -17.106 -15.526
    7    HD2  LYS  67           HD2      LYS  67 -17.804 -18.517 -13.894
    8    HD3  LYS  67           HD3      LYS  67 -18.906 -17.177 -13.566
    9    HE2  LYS  67           HE2      LYS  67 -19.619 -17.159 -15.919
   10    HE3  LYS  67           HE3      LYS  67 -18.494 -18.469 -16.280
   11    HZ1  LYS  67           HZ1      LYS  67 -19.858 -19.492 -14.223
   12    HZ3  LYS  67           HZ2      LYS  67 -20.266 -19.748 -15.851
   13    HZ2  LYS  67           HZ3      LYS  67 -21.064 -18.550 -14.951

  No H/Q in entry =          13
  In of MODEL   39
    1    H    MET  68           H        MET  68 -14.459 -16.343 -12.007
    2    HA   MET  68           HA       MET  68 -14.095 -14.150 -10.283
    3    HB2  MET  68           HB2      MET  68 -13.134 -16.999 -10.236
    4    HB3  MET  68           HB3      MET  68 -12.752 -15.861  -8.945
    5    HG2  MET  68           HG2      MET  68 -15.153 -15.433  -8.599
    6    HG3  MET  68           HG3      MET  68 -15.543 -16.559  -9.900
    7    HE1  MET  68           HE1      MET  68 -16.983 -16.881  -7.602
    8    HE3  MET  68           HE2      MET  68 -16.712 -18.395  -6.741
    9    HE2  MET  68           HE3      MET  68 -16.985 -18.417  -8.482

  No H/Q in entry =           9
  In of MODEL   39
    1    H    LYS  69           H        LYS  69 -11.704 -15.878 -12.310
    2    HA   LYS  69           HA       LYS  69  -9.414 -14.709 -11.209
    3    HB2  LYS  69           HB2      LYS  69  -9.403 -16.708 -12.640
    4    HB3  LYS  69           HB3      LYS  69  -9.789 -15.703 -14.038
    5    HG2  LYS  69           HG2      LYS  69  -7.717 -14.420 -13.714
    6    HG3  LYS  69           HG3      LYS  69  -7.338 -15.373 -12.281
    7    HD2  LYS  69           HD2      LYS  69  -7.241 -17.417 -13.667
    8    HD3  LYS  69           HD3      LYS  69  -7.599 -16.455 -15.102
    9    HE2  LYS  69           HE2      LYS  69  -5.242 -16.631 -15.119
   10    HE3  LYS  69           HE3      LYS  69  -5.542 -15.039 -14.423
   11    HZ1  LYS  69           HZ1      LYS  69  -5.596 -16.889 -12.343
   12    HZ3  LYS  69           HZ2      LYS  69  -4.443 -15.675 -12.631
   13    HZ2  LYS  69           HZ3      LYS  69  -4.218 -17.233 -13.270

  No H/Q in entry =          13
  In of MODEL   39
    1    H    VAL  70           H        VAL  70  -8.110 -12.973 -11.623
    2    HA   VAL  70           HA       VAL  70  -9.173 -10.892 -13.452
    3    HB   VAL  70           HB       VAL  70  -8.147  -9.261 -11.888
    4   HG12  VAL  70          HG11      VAL  70 -10.020 -11.157 -10.449
    5   HG11  VAL  70          HG12      VAL  70 -10.550 -10.051 -11.718
    6   HG13  VAL  70          HG13      VAL  70  -9.880  -9.414 -10.217
    7   HG23  VAL  70          HG21      VAL  70  -7.718 -11.666 -10.076
    8   HG22  VAL  70          HG22      VAL  70  -7.310  -9.990  -9.719
    9   HG21  VAL  70          HG23      VAL  70  -6.425 -10.866 -10.967

  No H/Q in entry =           9
  In of MODEL   39
    1    H    SER  71           H        SER  71  -7.528  -9.445 -14.332
    2    HA   SER  71           HA       SER  71  -5.365 -10.804 -15.557
    3    HB2  SER  71           HB2      SER  71  -6.435  -8.780 -16.518
    4    HB3  SER  71           HB3      SER  71  -5.777  -7.824 -15.192
    5    HG   SER  71           HG       SER  71  -4.552  -8.866 -17.430

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU  72           H        LEU  72  -3.275 -11.014 -14.991
    2    HA   LEU  72           HA       LEU  72  -2.540 -10.790 -12.284
    3    HB2  LEU  72           HB2      LEU  72  -0.895 -11.193 -14.779
    4    HB3  LEU  72           HB3      LEU  72  -0.223 -11.260 -13.152
    5    HG   LEU  72           HG       LEU  72  -2.563 -12.979 -14.037
    6   HD11  LEU  72          HD11      LEU  72  -0.518 -13.453 -15.387
    7   HD13  LEU  72          HD12      LEU  72  -0.950 -14.794 -14.328
    8   HD12  LEU  72          HD13      LEU  72   0.376 -13.717 -13.889
    9   HD22  LEU  72          HD21      LEU  72  -2.531 -13.000 -11.687
   10   HD21  LEU  72          HD22      LEU  72  -0.782 -12.857 -11.599
   11   HD23  LEU  72          HD23      LEU  72  -1.516 -14.385 -12.079

  No H/Q in entry =          11
  In of MODEL   39
    1    H    VAL  73           H        VAL  73  -1.870  -8.763 -15.069
    2    HA   VAL  73           HA       VAL  73   0.034  -7.039 -13.978
    3    HB   VAL  73           HB       VAL  73  -0.414  -5.609 -15.827
    4   HG12  VAL  73          HG11      VAL  73  -1.138  -8.403 -16.744
    5   HG11  VAL  73          HG12      VAL  73   0.496  -7.933 -16.277
    6   HG13  VAL  73          HG13      VAL  73  -0.282  -7.161 -17.657
    7   HG23  VAL  73          HG21      VAL  73  -2.558  -6.290 -17.226
    8   HG22  VAL  73          HG22      VAL  73  -2.695  -5.172 -15.872
    9   HG21  VAL  73          HG23      VAL  73  -3.131  -6.868 -15.662

  No H/Q in entry =           9
  In of MODEL   39
    1    H    LEU  74           H        LEU  74  -3.357  -7.201 -13.397
    2    HA   LEU  74           HA       LEU  74  -4.007  -4.553 -12.780
    3    HB2  LEU  74           HB2      LEU  74  -5.711  -6.250 -12.944
    4    HB3  LEU  74           HB3      LEU  74  -5.002  -7.154 -11.609
    5    HG   LEU  74           HG       LEU  74  -5.486  -5.271 -10.079
    6   HD12  LEU  74          HD11      LEU  74  -7.136  -3.538 -11.075
    7   HD11  LEU  74          HD12      LEU  74  -6.506  -4.043 -12.641
    8   HD13  LEU  74          HD13      LEU  74  -5.423  -3.337 -11.441
    9   HD23  LEU  74          HD21      LEU  74  -8.044  -5.746 -11.515
   10   HD22  LEU  74          HD22      LEU  74  -7.654  -5.886  -9.815
   11   HD21  LEU  74          HD23      LEU  74  -7.163  -7.148 -10.917

  No H/Q in entry =          11
  In of MODEL   39
    1    H    VAL  75           H        VAL  75  -2.917  -7.126 -10.626
    2    HA   VAL  75           HA       VAL  75  -2.723  -5.573  -8.284
    3    HB   VAL  75           HB       VAL  75  -1.197  -8.046  -9.085
    4   HG11  VAL  75          HG11      VAL  75  -1.405  -6.573  -6.420
    5   HG13  VAL  75          HG12      VAL  75   0.053  -6.825  -7.367
    6   HG12  VAL  75          HG13      VAL  75  -0.744  -8.194  -6.611
    7   HG23  VAL  75          HG21      VAL  75  -2.830  -9.108  -7.539
    8   HG22  VAL  75          HG22      VAL  75  -3.643  -8.318  -8.889
    9   HG21  VAL  75          HG23      VAL  75  -3.612  -7.545  -7.303

  No H/Q in entry =           9
  In of MODEL   39
    1    H    GLU  76           H        GLU  76  -0.322  -6.300 -10.836
    2    HA   GLU  76           HA       GLU  76   1.853  -4.923  -9.693
    3    HB2  GLU  76           HB2      GLU  76   2.081  -6.390 -11.671
    4    HB3  GLU  76           HB3      GLU  76   1.123  -5.268 -12.625
    5    HG2  GLU  76           HG2      GLU  76   3.442  -4.868 -13.153
    6    HG3  GLU  76           HG3      GLU  76   2.897  -3.505 -12.196

  No H/Q in entry =           6
  In of MODEL   39
    1    H    ALA  77           H        ALA  77  -0.709  -3.756 -11.865
    2    HA   ALA  77           HA       ALA  77   0.244  -1.097 -12.047
    3    HB3  ALA  77           HB1      ALA  77  -2.681  -1.809 -12.161
    4    HB1  ALA  77           HB2      ALA  77  -1.578  -2.307 -13.444
    5    HB2  ALA  77           HB3      ALA  77  -1.800  -0.595 -13.090

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLN  78           H        GLN  78  -1.988  -2.684  -9.821
    2    HA   GLN  78           HA       GLN  78  -2.818  -0.376  -8.414
    3    HB2  GLN  78           HB2      GLN  78  -3.897  -2.649  -8.321
    4    HB3  GLN  78           HB3      GLN  78  -2.545  -3.194  -7.331
    5    HG2  GLN  78           HG2      GLN  78  -3.070  -1.463  -5.661
    6    HG3  GLN  78           HG3      GLN  78  -4.425  -0.916  -6.648
    7   HE21  GLN  78          HE21      GLN  78  -4.853  -1.899  -3.991
    8   HE22  GLN  78          HE22      GLN  78  -5.695  -3.369  -4.097

  No H/Q in entry =           8
  In of MODEL   39
    1    H    LEU  79           H        LEU  79  -0.105  -2.595  -7.982
    2    HA   LEU  79           HA       LEU  79   0.875  -1.684  -5.531
    3    HB2  LEU  79           HB2      LEU  79   1.766  -3.681  -6.605
    4    HB3  LEU  79           HB3      LEU  79   2.390  -2.719  -7.942
    5    HG   LEU  79           HG       LEU  79   3.939  -1.558  -6.448
    6   HD13  LEU  79          HD11      LEU  79   2.945  -1.328  -4.375
    7   HD12  LEU  79          HD12      LEU  79   4.045  -2.662  -4.038
    8   HD11  LEU  79          HD13      LEU  79   2.342  -2.986  -4.357
    9   HD23  LEU  79          HD21      LEU  79   5.186  -3.689  -5.554
   10   HD22  LEU  79          HD22      LEU  79   4.969  -3.492  -7.290
   11   HD21  LEU  79          HD23      LEU  79   3.912  -4.578  -6.391

  No H/Q in entry =          11
  In of MODEL   39
    1    H    HIS  80           H        HIS  80   1.707  -0.555  -8.809
    2    HA   HIS  80           HA       HIS  80   3.491   1.459  -7.898
    3    HB2  HIS  80           HB2      HIS  80   2.195   0.746 -10.473
    4    HB3  HIS  80           HB3      HIS  80   2.767   2.407 -10.305
    5    HD1  HIS  80           HD1      HIS  80   5.160   2.743 -10.843
    6    HD2  HIS  80           HD2      HIS  80   4.407  -1.180  -9.647
    7    HE1  HIS  80           HE1      HIS  80   7.368   1.499 -11.024
    8    HE2  HIS  80           HE2      HIS  80   6.920  -0.895 -10.298

  No H/Q in entry =           8
  In of MODEL   39
    1    H    LEU  81           H        LEU  81   0.079   1.568  -8.856
    2    HA   LEU  81           HA       LEU  81  -0.236   4.356  -8.523
    3    HB2  LEU  81           HB2      LEU  81  -2.216   2.080  -8.431
    4    HB3  LEU  81           HB3      LEU  81  -2.693   3.776  -8.336
    5    HG   LEU  81           HG       LEU  81  -0.997   2.653 -10.583
    6   HD12  LEU  81          HD11      LEU  81  -3.242   2.939 -11.867
    7   HD11  LEU  81          HD12      LEU  81  -3.987   2.858 -10.271
    8   HD13  LEU  81          HD13      LEU  81  -3.027   1.505 -10.865
    9   HD23  LEU  81          HD21      LEU  81  -2.134   4.780 -11.672
   10   HD22  LEU  81          HD22      LEU  81  -0.714   4.973 -10.648
   11   HD21  LEU  81          HD23      LEU  81  -2.320   5.296  -9.998

  No H/Q in entry =          11
  In of MODEL   39
    1    H    MET  82           H        MET  82  -0.839   1.659  -6.270
    2    HA   MET  82           HA       MET  82  -1.903   3.228  -4.176
    3    HB2  MET  82           HB2      MET  82  -0.487   0.563  -4.225
    4    HB3  MET  82           HB3      MET  82  -1.067   1.279  -2.723
    5    HG2  MET  82           HG2      MET  82  -2.808   0.758  -5.154
    6    HG3  MET  82           HG3      MET  82  -2.704  -0.314  -3.759
    7    HE3  MET  82           HE1      MET  82  -4.434   1.307  -0.933
    8    HE2  MET  82           HE2      MET  82  -2.710   1.612  -1.128
    9    HE1  MET  82           HE3      MET  82  -3.376   0.044  -1.578

  No H/Q in entry =           9
  In of MODEL   39
    1    H    THR  83           H        THR  83   1.410   2.195  -4.887
    2    HA   THR  83           HA       THR  83   2.625   3.318  -2.594
    3    HB   THR  83           HB       THR  83   4.711   3.296  -4.081
    4    HG1  THR  83           HG1      THR  83   4.467   2.766  -6.104
    5   HG22  THR  83          HG21      THR  83   4.307   0.631  -4.411
    6   HG21  THR  83          HG22      THR  83   3.019   0.990  -3.263
    7   HG23  THR  83          HG23      THR  83   4.695   1.360  -2.854

  No H/Q in entry =           7
  In of MODEL   39
    1    H    SER  84           H        SER  84   2.213   4.592  -5.891
    2    HA   SER  84           HA       SER  84   3.516   7.053  -5.443
    3    HB2  SER  84           HB2      SER  84   1.447   6.188  -7.450
    4    HB3  SER  84           HB3      SER  84   2.099   7.826  -7.428
    5    HG   SER  84           HG       SER  84   3.509   5.374  -7.729

  No H/Q in entry =           5
  In of MODEL   39
    1    H    MET  85           H        MET  85   0.036   6.241  -5.250
    2    HA   MET  85           HA       MET  85  -0.863   8.837  -4.642
    3    HB2  MET  85           HB2      MET  85  -2.359   7.002  -5.302
    4    HB3  MET  85           HB3      MET  85  -2.051   6.205  -3.760
    5    HG2  MET  85           HG2      MET  85  -2.974   8.140  -2.555
    6    HG3  MET  85           HG3      MET  85  -3.241   8.974  -4.084
    7    HE2  MET  85           HE1      MET  85  -6.846   8.310  -3.231
    8    HE1  MET  85           HE2      MET  85  -5.462   9.395  -3.127
    9    HE3  MET  85           HE3      MET  85  -5.752   8.224  -1.845

  No H/Q in entry =           9
  In of MODEL   39
    1    H    LEU  86           H        LEU  86   0.112   6.189  -2.506
    2    HA   LEU  86           HA       LEU  86  -0.426   7.482  -0.059
    3    HB2  LEU  86           HB2      LEU  86   0.074   5.019  -0.458
    4    HB3  LEU  86           HB3      LEU  86   1.773   5.475  -0.563
    5    HG   LEU  86           HG       LEU  86   1.446   6.630   1.708
    6   HD11  LEU  86          HD11      LEU  86  -1.240   5.823   1.253
    7   HD13  LEU  86          HD12      LEU  86  -0.576   6.579   2.700
    8   HD12  LEU  86          HD13      LEU  86  -0.641   4.822   2.580
    9   HD23  LEU  86          HD21      LEU  86   1.063   3.631   1.831
   10   HD22  LEU  86          HD22      LEU  86   2.057   4.655   2.865
   11   HD21  LEU  86          HD23      LEU  86   2.552   4.338   1.203

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ALA  87           H        ALA  87   2.547   7.233  -1.968
    2    HA   ALA  87           HA       ALA  87   4.243   8.667  -0.253
    3    HB3  ALA  87           HB1      ALA  87   4.335   7.658  -2.962
    4    HB2  ALA  87           HB2      ALA  87   5.672   8.007  -1.869
    5    HB1  ALA  87           HB3      ALA  87   5.032   9.279  -2.909

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ARG  88           H        ARG  88   2.262   9.777  -2.960
    2    HA   ARG  88           HA       ARG  88   2.999  12.477  -2.846
    3    HB2  ARG  88           HB2      ARG  88   1.749  11.308  -4.696
    4    HB3  ARG  88           HB3      ARG  88   0.296  11.430  -3.704
    5    HG2  ARG  88           HG2      ARG  88   1.280  14.025  -3.625
    6    HG3  ARG  88           HG3      ARG  88   1.700  13.517  -5.259
    7    HD2  ARG  88           HD2      ARG  88  -0.446  13.568  -5.942
    8    HD3  ARG  88           HD3      ARG  88  -1.012  12.706  -4.511
    9    HE   ARG  88           HE       ARG  88  -1.243  15.481  -4.925
   10   HH21  ARG  88          HH11      ARG  88  -1.777  16.802  -3.183
   11   HH22  ARG  88          HH12      ARG  88  -1.462  16.268  -1.568
   12   HH11  ARG  88          HH21      ARG  88  -0.180  13.231  -2.560
   13   HH12  ARG  88          HH22      ARG  88  -0.576  14.240  -1.215

  No H/Q in entry =          13
  In of MODEL   39
    1    H    GLU  89           H        GLU  89   0.329  10.765  -1.190
    2    HA   GLU  89           HA       GLU  89  -0.801  13.060   0.024
    3    HB2  GLU  89           HB2      GLU  89  -1.890  10.806  -0.057
    4    HB3  GLU  89           HB3      GLU  89  -0.750  10.265   1.176
    5    HG2  GLU  89           HG2      GLU  89  -1.582  11.951   2.742
    6    HG3  GLU  89           HG3      GLU  89  -2.652  12.609   1.506

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LEU  90           H        LEU  90   1.688  10.800   1.180
    2    HA   LEU  90           HA       LEU  90   2.044  12.047   3.708
    3    HB2  LEU  90           HB2      LEU  90   3.829  10.298   2.017
    4    HB3  LEU  90           HB3      LEU  90   4.253  10.818   3.654
    5    HG   LEU  90           HG       LEU  90   1.631   9.439   3.009
    6   HD12  LEU  90          HD11      LEU  90   2.805   7.407   4.008
    7   HD11  LEU  90          HD12      LEU  90   4.314   8.283   3.757
    8   HD13  LEU  90          HD13      LEU  90   3.298   7.864   2.376
    9   HD22  LEU  90          HD21      LEU  90   1.369  10.357   5.133
   10   HD21  LEU  90          HD22      LEU  90   3.091  10.272   5.504
   11   HD23  LEU  90          HD23      LEU  90   2.104   8.812   5.558

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  91           H        ILE  91   3.622  12.453   0.571
    2    HA   ILE  91           HA       ILE  91   5.581  14.308   1.399
    3    HB   ILE  91           HB       ILE  91   4.257  13.804  -1.273
    4   HG12  ILE  91          HG12      ILE  91   7.102  13.351  -0.318
    5   HG13  ILE  91          HG13      ILE  91   5.837  12.138  -0.148
    6   HG22  ILE  91          HG21      ILE  91   6.458  15.179  -1.975
    7   HG21  ILE  91          HG22      ILE  91   6.149  15.974  -0.431
    8   HG23  ILE  91          HG23      ILE  91   4.917  15.989  -1.692
    9   HD13  ILE  91          HD11      ILE  91   5.652  11.814  -2.455
   10   HD12  ILE  91          HD12      ILE  91   7.385  12.078  -2.252
   11   HD11  ILE  91          HD13      ILE  91   6.354  13.389  -2.831

  No H/Q in entry =          11
  In of MODEL   39
    1    H    THR  92           H        THR  92   2.207  14.700   0.414
    2    HA   THR  92           HA       THR  92   2.145  17.523   0.356
    3    HB   THR  92           HB       THR  92   0.007  15.501   1.068
    4    HG1  THR  92           HG1      THR  92   0.300  15.328  -1.019
    5   HG22  THR  92          HG21      THR  92  -1.425  17.646   0.358
    6   HG21  THR  92          HG22      THR  92  -0.038  18.488   1.047
    7   HG23  THR  92          HG23      THR  92  -0.959  17.354   2.033

  No H/Q in entry =           7
  In of MODEL   39
    1    H    GLU  93           H        GLU  93   1.643  15.213   3.012
    2    HA   GLU  93           HA       GLU  93   1.102  17.109   5.036
    3    HB2  GLU  93           HB2      GLU  93   2.450  14.400   5.260
    4    HB3  GLU  93           HB3      GLU  93   1.757  15.317   6.599
    5    HG2  GLU  93           HG2      GLU  93   0.138  14.522   4.170
    6    HG3  GLU  93           HG3      GLU  93   0.261  13.499   5.596

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LEU  94           H        LEU  94   4.119  15.665   3.864
    2    HA   LEU  94           HA       LEU  94   5.868  16.831   5.741
    3    HB2  LEU  94           HB2      LEU  94   6.262  15.872   2.907
    4    HB3  LEU  94           HB3      LEU  94   7.590  16.545   3.848
    5    HG   LEU  94           HG       LEU  94   5.885  14.327   4.993
    6   HD11  LEU  94          HD11      LEU  94   7.968  14.128   2.847
    7   HD13  LEU  94          HD12      LEU  94   6.536  13.137   3.117
    8   HD12  LEU  94          HD13      LEU  94   7.971  12.900   4.114
    9   HD23  LEU  94          HD21      LEU  94   8.088  13.816   6.130
   10   HD22  LEU  94          HD22      LEU  94   7.405  15.385   6.552
   11   HD21  LEU  94          HD23      LEU  94   8.737  15.282   5.400

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  95           H        ILE  95   4.693  17.992   2.600
    2    HA   ILE  95           HA       ILE  95   6.236  20.368   2.533
    3    HB   ILE  95           HB       ILE  95   3.592  19.654   1.244
    4   HG12  ILE  95          HG12      ILE  95   6.368  20.026   0.089
    5   HG13  ILE  95          HG13      ILE  95   5.741  18.464   0.607
    6   HG21  ILE  95          HG21      ILE  95   5.310  22.142   1.015
    7   HG23  ILE  95          HG22      ILE  95   3.588  22.053   1.383
    8   HG22  ILE  95          HG23      ILE  95   4.165  21.661  -0.238
    9   HD13  ILE  95          HD11      ILE  95   4.171  18.371  -1.112
   10   HD12  ILE  95          HD12      ILE  95   5.504  19.206  -1.908
   11   HD11  ILE  95          HD13      ILE  95   4.125  20.124  -1.306

  No H/Q in entry =          11
  In of MODEL   39
    1    H    GLU  96           H        GLU  96   3.004  19.676   3.849
    2    HA   GLU  96           HA       GLU  96   2.357  22.315   4.607
    3    HB2  GLU  96           HB2      GLU  96   0.704  20.512   4.628
    4    HB3  GLU  96           HB3      GLU  96   1.585  19.693   5.917
    5    HG2  GLU  96           HG2      GLU  96   0.559  20.963   7.495
    6    HG3  GLU  96           HG3      GLU  96   1.072  22.444   6.696

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LEU  97           H        LEU  97   4.241  19.785   6.217
    2    HA   LEU  97           HA       LEU  97   4.599  21.135   8.687
    3    HB2  LEU  97           HB2      LEU  97   6.152  18.986   7.260
    4    HB3  LEU  97           HB3      LEU  97   6.744  19.676   8.769
    5    HG   LEU  97           HG       LEU  97   3.946  18.550   8.476
    6   HD12  LEU  97          HD11      LEU  97   4.918  16.548   9.680
    7   HD11  LEU  97          HD12      LEU  97   6.519  17.198   9.326
    8   HD13  LEU  97          HD13      LEU  97   5.446  16.729   8.007
    9   HD23  LEU  97          HD21      LEU  97   4.420  18.258  11.037
   10   HD22  LEU  97          HD22      LEU  97   4.016  19.866  10.437
   11   HD21  LEU  97          HD23      LEU  97   5.695  19.446  10.770

  No H/Q in entry =          11
  In of MODEL   39
    1    H    HIS  98           H        HIS  98   6.449  21.176   5.649
    2    HA   HIS  98           HA       HIS  98   8.591  22.779   6.535
    3    HB2  HIS  98           HB2      HIS  98   7.282  22.512   3.818
    4    HB3  HIS  98           HB3      HIS  98   8.713  23.506   4.099
    5    HD1  HIS  98           HD1      HIS  98   7.543  19.922   4.124
    6    HD2  HIS  98           HD2      HIS  98  11.102  22.059   4.527
    7    HE1  HIS  98           HE1      HIS  98   9.416  18.214   4.053
    8    HE2  HIS  98           HE2      HIS  98  11.588  19.495   4.298

  No H/Q in entry =           8
  In of MODEL   39
    1    H    GLU  99           H        GLU  99   5.352  23.578   5.382
    2    HA   GLU  99           HA       GLU  99   5.699  26.397   5.325
    3    HB2  GLU  99           HB2      GLU  99   3.826  25.208   4.205
    4    HB3  GLU  99           HB3      GLU  99   3.145  24.837   5.789
    5    HG2  GLU  99           HG2      GLU  99   2.941  27.227   6.294
    6    HG3  GLU  99           HG3      GLU  99   3.702  27.637   4.760

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LYS 100           H        LYS 100   4.611  24.147   7.852
    2    HA   LYS 100           HA       LYS 100   4.014  26.193   9.752
    3    HB2  LYS 100           HB2      LYS 100   4.625  23.248  10.091
    4    HB3  LYS 100           HB3      LYS 100   4.174  24.314  11.427
    5    HG2  LYS 100           HG2      LYS 100   2.093  24.930  10.193
    6    HG3  LYS 100           HG3      LYS 100   2.525  23.767   8.937
    7    HD2  LYS 100           HD2      LYS 100   2.478  21.944  10.597
    8    HD3  LYS 100           HD3      LYS 100   2.064  23.101  11.864
    9    HE2  LYS 100           HE2      LYS 100  -0.004  23.700  10.616
   10    HE3  LYS 100           HE3      LYS 100   0.401  22.486   9.396
   11    HZ1  LYS 100           HZ1      LYS 100   0.162  21.814  12.278
   12    HZ3  LYS 100           HZ2      LYS 100   0.149  20.761  10.942
   13    HZ2  LYS 100           HZ3      LYS 100  -1.176  21.785  11.232

  No H/Q in entry =          13
  In of MODEL   39
    1    H    LEU 101           H        LEU 101   6.951  24.430   8.896
    2    HA   LEU 101           HA       LEU 101   8.555  25.286  11.090
    3    HB2  LEU 101           HB2      LEU 101   9.142  24.308   8.307
    4    HB3  LEU 101           HB3      LEU 101  10.443  24.987   9.280
    5    HG   LEU 101           HG       LEU 101   8.642  22.810  10.354
    6   HD12  LEU 101          HD11      LEU 101  10.708  21.337   9.731
    7   HD11  LEU 101          HD12      LEU 101  11.053  22.606   8.557
    8   HD13  LEU 101          HD13      LEU 101   9.534  21.716   8.472
    9   HD21  LEU 101          HD21      LEU 101  11.359  23.946  11.065
   10   HD23  LEU 101          HD22      LEU 101  10.836  22.368  11.646
   11   HD22  LEU 101          HD23      LEU 101   9.932  23.814  12.092

  No H/Q in entry =          11
  In of MODEL   39
    1    H    LYS 102           H        LYS 102   6.938  27.134   8.962
    2    HA   LYS 102           HA       LYS 102   6.989  29.428   8.672
    3    HB2  LYS 102           HB2      LYS 102   8.568  29.327  10.760
    4    HB3  LYS 102           HB3      LYS 102   9.858  29.537   9.592
    5    HG2  LYS 102           HG2      LYS 102   7.738  31.466  10.470
    6    HG3  LYS 102           HG3      LYS 102   9.445  31.745  10.207
    7    HD2  LYS 102           HD2      LYS 102   7.484  31.303   7.920
    8    HD3  LYS 102           HD3      LYS 102   7.854  32.886   8.587
    9    HE2  LYS 102           HE2      LYS 102   9.226  31.718   6.504
   10    HE3  LYS 102           HE3      LYS 102   9.835  33.031   7.512
   11    HZ2  LYS 102           HZ1      LYS 102  11.375  31.142   7.325
   12    HZ1  LYS 102           HZ2      LYS 102  10.228  30.147   8.074
   13    HZ3  LYS 102           HZ3      LYS 102  10.912  31.440   8.930

  No H/Q in entry =          13
  In of MODEL   39
    1    H    ALA 103           H        ALA 103  10.256  28.124   8.084
    2    HA   ALA 103           HA       ALA 103  11.191  29.513   6.003
    3    HB2  ALA 103           HB1      ALA 103  12.093  27.309   5.067
    4    HB1  ALA 103           HB2      ALA 103  11.215  26.524   6.379
    5    HB3  ALA 103           HB3      ALA 103  12.495  27.682   6.744

  No H/Q in entry =           5
  In of MODEL   39
    1    H1   LYS   3           H1       LYS   3 -30.748   6.214 -19.915
    2    H2   LYS   3           H3       LYS   3 -29.760   5.874 -21.253
    3    H3   LYS   3           H2       LYS   3 -31.181   4.983 -20.999
    4    HA   LYS   3           HA       LYS   3 -30.228   3.590 -19.565
    5    HB2  LYS   3           HB2      LYS   3 -27.899   4.914 -20.905
    6    HB3  LYS   3           HB3      LYS   3 -27.617   3.719 -19.638
    7    HG2  LYS   3           HG2      LYS   3 -29.074   2.151 -20.972
    8    HG3  LYS   3           HG3      LYS   3 -28.986   3.327 -22.282
    9    HD2  LYS   3           HD2      LYS   3 -26.508   3.143 -22.211
   10    HD3  LYS   3           HD3      LYS   3 -26.672   1.870 -21.003
   11    HE2  LYS   3           HE2      LYS   3 -28.190   0.707 -22.710
   12    HE3  LYS   3           HE3      LYS   3 -27.529   1.846 -23.882
   13    HZ3  LYS   3           HZ1      LYS   3 -25.765   0.564 -24.116
   14    HZ2  LYS   3           HZ2      LYS   3 -26.435  -0.567 -23.041
   15    HZ1  LYS   3           HZ3      LYS   3 -25.415   0.658 -22.457

  No H/Q in entry =          15
  In of MODEL   39
    1    H    LYS   4           H        LYS   4 -30.300   3.486 -17.502
    2    HA   LYS   4           HA       LYS   4 -29.516   5.779 -15.886
    3    HB2  LYS   4           HB2      LYS   4 -30.799   3.134 -15.149
    4    HB3  LYS   4           HB3      LYS   4 -30.547   4.485 -14.044
    5    HG2  LYS   4           HG2      LYS   4 -32.339   4.433 -16.478
    6    HG3  LYS   4           HG3      LYS   4 -32.840   4.528 -14.791
    7    HD2  LYS   4           HD2      LYS   4 -32.080   6.734 -14.557
    8    HD3  LYS   4           HD3      LYS   4 -31.033   6.619 -15.971
    9    HE2  LYS   4           HE2      LYS   4 -32.915   8.041 -16.472
   10    HE3  LYS   4           HE3      LYS   4 -33.031   6.555 -17.415
   11    HZ3  LYS   4           HZ1      LYS   4 -34.644   5.717 -15.864
   12    HZ2  LYS   4           HZ2      LYS   4 -35.151   7.218 -16.478
   13    HZ1  LYS   4           HZ3      LYS   4 -34.508   7.114 -14.909

  No H/Q in entry =          13
  In of MODEL   39
    1    H    HIS   5           H        HIS   5 -28.056   5.848 -14.285
    2    HA   HIS   5           HA       HIS   5 -25.827   3.945 -14.568
    3    HB2  HIS   5           HB2      HIS   5 -26.007   6.727 -13.411
    4    HB3  HIS   5           HB3      HIS   5 -24.555   5.729 -13.367
    5    HD1  HIS   5           HD1      HIS   5 -23.038   6.856 -14.965
    6    HD2  HIS   5           HD2      HIS   5 -26.846   6.323 -16.537
    7    HE1  HIS   5           HE1      HIS   5 -22.835   7.388 -17.425
    8    HE2  HIS   5           HE2      HIS   5 -25.158   7.052 -18.351

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ILE   6           H        ILE   6 -25.656   2.390 -13.222
    2    HA   ILE   6           HA       ILE   6 -26.642   2.736 -10.471
    3    HB   ILE   6           HB       ILE   6 -25.883   0.218 -11.959
    4   HG12  ILE   6          HG12      ILE   6 -28.601   1.254 -11.145
    5   HG13  ILE   6          HG13      ILE   6 -27.944   1.367 -12.777
    6   HG23  ILE   6          HG21      ILE   6 -26.308  -0.989 -10.081
    7   HG22  ILE   6          HG22      ILE   6 -27.434   0.203  -9.430
    8   HG21  ILE   6          HG23      ILE   6 -25.696   0.487  -9.333
    9   HD13  ILE   6          HD11      ILE   6 -28.466  -0.745 -13.244
   10   HD12  ILE   6          HD12      ILE   6 -29.489  -0.671 -11.810
   11   HD11  ILE   6          HD13      ILE   6 -27.856  -1.328 -11.694

  No H/Q in entry =          11
  In of MODEL   39
    1    H    TYR   7           H        TYR   7 -24.873   3.344  -9.182
    2    HA   TYR   7           HA       TYR   7 -22.188   2.290  -9.825
    3    HB2  TYR   7           HB2      TYR   7 -23.085   4.779  -8.393
    4    HB3  TYR   7           HB3      TYR   7 -21.416   4.210  -8.411
    5    HD1  TYR   7           HD1      TYR   7 -22.464   3.248 -11.491
    6    HD2  TYR   7           HD2      TYR   7 -21.698   6.836  -9.322
    7    HE1  TYR   7           HE1      TYR   7 -21.979   4.426 -13.601
    8    HE2  TYR   7           HE2      TYR   7 -21.254   8.021 -11.423
    9    HH   TYR   7           HH       TYR   7 -21.460   7.902 -13.655

  No H/Q in entry =           9
  In of MODEL   39
    1    H    LEU   8           H        LEU   8 -21.275   0.932  -8.466
    2    HA   LEU   8           HA       LEU   8 -22.439   0.520  -5.783
    3    HB2  LEU   8           HB2      LEU   8 -20.778  -1.228  -7.575
    4    HB3  LEU   8           HB3      LEU   8 -20.987  -1.573  -5.858
    5    HG   LEU   8           HG       LEU   8 -23.468  -1.675  -6.296
    6   HD13  LEU   8          HD11      LEU   8 -23.545  -0.492  -8.427
    7   HD12  LEU   8          HD12      LEU   8 -24.126  -2.143  -8.643
    8   HD11  LEU   8          HD13      LEU   8 -22.500  -1.705  -9.165
    9   HD23  LEU   8          HD21      LEU   8 -22.248  -3.784  -7.945
   10   HD22  LEU   8          HD22      LEU   8 -23.348  -3.893  -6.572
   11   HD21  LEU   8          HD23      LEU   8 -21.634  -3.589  -6.304

  No H/Q in entry =          11
  In of MODEL   39
    1    H    PHE   9           H        PHE   9 -21.169   0.911  -3.997
    2    HA   PHE   9           HA       PHE   9 -18.349   1.742  -4.500
    3    HB2  PHE   9           HB2      PHE   9 -20.307   2.913  -2.524
    4    HB3  PHE   9           HB3      PHE   9 -18.600   3.321  -2.613
    5    HD1  PHE   9           HD1      PHE   9 -17.708   4.642  -4.433
    6    HD2  PHE   9           HD2      PHE   9 -21.866   3.590  -4.319
    7    HE1  PHE   9           HE1      PHE   9 -18.171   6.273  -6.239
    8    HE2  PHE   9           HE2      PHE   9 -22.330   5.234  -6.120
    9    HZ   PHE   9           HZ       PHE   9 -20.480   6.571  -7.086

  No H/Q in entry =           9
  In of MODEL   39
    1    H    SER  10           H        SER  10 -16.809   0.766  -3.358
    2    HA   SER  10           HA       SER  10 -17.072  -0.070  -0.650
    3    HB2  SER  10           HB2      SER  10 -18.332  -1.917  -1.725
    4    HB3  SER  10           HB3      SER  10 -16.933  -2.253  -2.732
    5    HG   SER  10           HG       SER  10 -15.955  -3.140  -1.095

  No H/Q in entry =           5
  In of MODEL   39
    1    H    SER  11           H        SER  11 -15.068   0.014   0.203
    2    HA   SER  11           HA       SER  11 -12.851   0.812  -1.295
    3    HB2  SER  11           HB2      SER  11 -11.720   0.881   0.700
    4    HB3  SER  11           HB3      SER  11 -13.386   0.865   1.284
    5    HG   SER  11           HG       SER  11 -12.462  -0.760   2.380

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA  12           H        ALA  12 -14.112  -1.892  -2.097
    2    HA   ALA  12           HA       ALA  12 -11.544  -3.140  -2.662
    3    HB2  ALA  12           HB1      ALA  12 -12.242  -5.371  -1.921
    4    HB1  ALA  12           HB2      ALA  12 -13.753  -4.705  -1.304
    5    HB3  ALA  12           HB3      ALA  12 -12.220  -4.238  -0.568

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLY  13           H        GLY  13 -12.303  -2.178  -4.695
    2    HA3  GLY  13           HA2      GLY  13 -14.573  -2.846  -6.134
    3    HA2  GLY  13           HA3      GLY  13 -13.019  -2.441  -6.876

  No H/Q in entry =           3
  In of MODEL   39
    1    H    MET  14           H        MET  14 -11.555  -4.735  -5.923
    2    HA   MET  14           HA       MET  14 -11.997  -6.519  -8.000
    3    HB2  MET  14           HB2      MET  14  -9.922  -6.603  -6.714
    4    HB3  MET  14           HB3      MET  14 -10.780  -7.234  -5.309
    5    HG2  MET  14           HG2      MET  14 -11.421  -9.239  -6.633
    6    HG3  MET  14           HG3      MET  14 -10.523  -8.601  -8.012
    7    HE3  MET  14           HE1      MET  14  -6.969  -8.768  -7.293
    8    HE2  MET  14           HE2      MET  14  -7.723  -7.356  -6.557
    9    HE1  MET  14           HE3      MET  14  -8.329  -7.968  -8.093

  No H/Q in entry =           9
  In of MODEL   39
    1    H    SER  15           H        SER  15 -13.196  -6.943  -4.660
    2    HA   SER  15           HA       SER  15 -14.582  -9.375  -5.346
    3    HB2  SER  15           HB2      SER  15 -14.106  -9.202  -3.029
    4    HB3  SER  15           HB3      SER  15 -14.761  -7.569  -2.937
    5    HG   SER  15           HG       SER  15 -16.767  -8.343  -2.954

  No H/Q in entry =           5
  In of MODEL   39
    1    H    THR  16           H        THR  16 -15.620  -5.976  -4.971
    2    HA   THR  16           HA       THR  16 -18.416  -6.434  -5.490
    3    HB   THR  16           HB       THR  16 -16.814  -3.915  -6.054
    4    HG1  THR  16           HG1      THR  16 -16.587  -4.888  -3.885
    5   HG22  THR  16          HG21      THR  16 -19.663  -4.188  -5.104
    6   HG21  THR  16          HG22      THR  16 -19.254  -4.188  -6.828
    7   HG23  THR  16          HG23      THR  16 -18.880  -2.783  -5.818

  No H/Q in entry =           7
  In of MODEL   39
    1    H    SER  17           H        SER  17 -15.585  -5.984  -7.349
    2    HA   SER  17           HA       SER  17 -16.669  -5.253  -9.872
    3    HB2  SER  17           HB2      SER  17 -14.087  -6.634  -9.116
    4    HB3  SER  17           HB3      SER  17 -14.501  -6.232 -10.783
    5    HG   SER  17           HG       SER  17 -14.903  -4.102  -9.220

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU  18           H        LEU  18 -16.210  -8.388  -8.364
    2    HA   LEU  18           HA       LEU  18 -16.823  -9.911 -10.697
    3    HB2  LEU  18           HB2      LEU  18 -15.649 -10.885  -8.779
    4    HB3  LEU  18           HB3      LEU  18 -17.066 -10.611  -7.766
    5    HG   LEU  18           HG       LEU  18 -18.359 -12.122  -9.283
    6   HD11  LEU  18          HD11      LEU  18 -15.629 -12.369 -10.523
    7   HD13  LEU  18          HD12      LEU  18 -17.182 -12.107 -11.315
    8   HD12  LEU  18          HD13      LEU  18 -16.796 -13.685 -10.631
    9   HD22  LEU  18          HD21      LEU  18 -17.589 -12.971  -7.218
   10   HD21  LEU  18          HD22      LEU  18 -15.952 -13.184  -7.843
   11   HD23  LEU  18          HD23      LEU  18 -17.265 -14.195  -8.447

  No H/Q in entry =          11
  In of MODEL   39
    1    H    LEU  19           H        LEU  19 -18.776  -8.595  -8.025
    2    HA   LEU  19           HA       LEU  19 -21.267  -9.718  -8.857
    3    HB2  LEU  19           HB2      LEU  19 -20.976  -8.846  -6.617
    4    HB3  LEU  19           HB3      LEU  19 -20.663  -7.234  -7.259
    5    HG   LEU  19           HG       LEU  19 -22.970  -6.996  -7.922
    6   HD11  LEU  19          HD11      LEU  19 -23.149  -9.878  -7.078
    7   HD13  LEU  19          HD12      LEU  19 -23.677  -9.135  -8.588
    8   HD12  LEU  19          HD13      LEU  19 -24.573  -8.839  -7.099
    9   HD21  LEU  19          HD21      LEU  19 -22.488  -7.932  -5.109
   10   HD23  LEU  19          HD22      LEU  19 -24.017  -7.224  -5.630
   11   HD22  LEU  19          HD23      LEU  19 -22.531  -6.280  -5.726

  No H/Q in entry =          11
  In of MODEL   39
    1    H    VAL  20           H        VAL  20 -19.670  -6.617  -9.595
    2    HA   VAL  20           HA       VAL  20 -21.735  -5.539 -11.200
    3    HB   VAL  20           HB       VAL  20 -18.735  -5.032 -11.211
    4   HG12  VAL  20          HG11      VAL  20 -19.491  -2.947 -12.596
    5   HG11  VAL  20          HG12      VAL  20 -20.859  -3.964 -13.048
    6   HG13  VAL  20          HG13      VAL  20 -19.216  -4.477 -13.429
    7   HG23  VAL  20          HG21      VAL  20 -19.610  -2.753 -10.452
    8   HG22  VAL  20          HG22      VAL  20 -19.692  -4.090  -9.307
    9   HG21  VAL  20          HG23      VAL  20 -21.142  -3.582 -10.173

  No H/Q in entry =           9
  In of MODEL   39
    1    H    SER  21           H        SER  21 -19.034  -7.691 -12.168
    2    HA   SER  21           HA       SER  21 -19.792  -7.605 -14.927
    3    HB2  SER  21           HB2      SER  21 -18.414  -9.618 -15.215
    4    HB3  SER  21           HB3      SER  21 -17.555  -8.384 -14.295
    5    HG   SER  21           HG       SER  21 -17.837  -9.518 -12.471

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LYS  22           H        LYS  22 -20.945  -9.710 -12.326
    2    HA   LYS  22           HA       LYS  22 -22.519 -11.314 -14.132
    3    HB2  LYS  22           HB2      LYS  22 -21.766 -11.871 -11.704
    4    HB3  LYS  22           HB3      LYS  22 -23.195 -10.950 -11.236
    5    HG2  LYS  22           HG2      LYS  22 -24.624 -12.576 -11.878
    6    HG3  LYS  22           HG3      LYS  22 -23.627 -13.062 -13.248
    7    HD2  LYS  22           HD2      LYS  22 -22.098 -14.226 -11.726
    8    HD3  LYS  22           HD3      LYS  22 -23.094 -13.738 -10.354
    9    HE2  LYS  22           HE2      LYS  22 -23.930 -15.550 -12.628
   10    HE3  LYS  22           HE3      LYS  22 -23.585 -16.043 -10.970
   11    HZ3  LYS  22           HZ1      LYS  22 -25.924 -15.937 -11.272
   12    HZ2  LYS  22           HZ2      LYS  22 -25.841 -14.359 -11.898
   13    HZ1  LYS  22           HZ3      LYS  22 -25.473 -14.645 -10.265

  No H/Q in entry =          13
  In of MODEL   39
    1    H    MET  23           H        MET  23 -23.164  -8.338 -12.321
    2    HA   MET  23           HA       MET  23 -25.969  -8.338 -12.850
    3    HB2  MET  23           HB2      MET  23 -24.054  -6.079 -12.302
    4    HB3  MET  23           HB3      MET  23 -25.792  -5.858 -12.498
    5    HG2  MET  23           HG2      MET  23 -26.240  -7.113 -10.510
    6    HG3  MET  23           HG3      MET  23 -24.545  -7.576 -10.362
    7    HE2  MET  23           HE1      MET  23 -26.734  -3.833  -9.257
    8    HE1  MET  23           HE2      MET  23 -27.009  -4.819 -10.693
    9    HE3  MET  23           HE3      MET  23 -25.928  -3.426 -10.773

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ARG  24           H        ARG  24 -23.157  -7.029 -14.636
    2    HA   ARG  24           HA       ARG  24 -24.595  -5.717 -16.670
    3    HB2  ARG  24           HB2      ARG  24 -21.794  -6.698 -16.337
    4    HB3  ARG  24           HB3      ARG  24 -22.331  -6.421 -17.975
    5    HG2  ARG  24           HG2      ARG  24 -22.869  -4.045 -17.420
    6    HG3  ARG  24           HG3      ARG  24 -22.300  -4.340 -15.756
    7    HD2  ARG  24           HD2      ARG  24 -20.079  -5.008 -16.623
    8    HD3  ARG  24           HD3      ARG  24 -20.654  -4.747 -18.264
    9    HE   ARG  24           HE       ARG  24 -20.370  -2.540 -18.137
   10   HH21  ARG  24          HH11      ARG  24 -18.625  -1.280 -17.490
   11   HH22  ARG  24          HH12      ARG  24 -18.246  -1.140 -15.809
   12   HH11  ARG  24          HH21      ARG  24 -20.526  -3.712 -14.966
   13   HH12  ARG  24          HH22      ARG  24 -19.384  -2.575 -14.323

  No H/Q in entry =          13
  In of MODEL   39
    1    H    ALA  25           H        ALA  25 -23.586  -9.085 -16.327
    2    HA   ALA  25           HA       ALA  25 -24.220  -9.940 -18.955
    3    HB1  ALA  25           HB1      ALA  25 -23.597 -11.981 -18.219
    4    HB3  ALA  25           HB2      ALA  25 -24.665 -11.902 -16.818
    5    HB2  ALA  25           HB3      ALA  25 -23.083 -11.126 -16.765

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLN  26           H        GLN  26 -26.072  -9.866 -15.948
    2    HA   GLN  26           HA       GLN  26 -28.446 -11.008 -16.965
    3    HB2  GLN  26           HB2      GLN  26 -27.895  -9.237 -14.603
    4    HB3  GLN  26           HB3      GLN  26 -29.478  -9.914 -14.954
    5    HG2  GLN  26           HG2      GLN  26 -26.946 -11.449 -14.438
    6    HG3  GLN  26           HG3      GLN  26 -28.311 -11.282 -13.343
    7   HE21  GLN  26          HE21      GLN  26 -27.157 -13.507 -14.572
    8   HE22  GLN  26          HE22      GLN  26 -28.227 -14.532 -15.361

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ALA  27           H        ALA  27 -27.400  -7.637 -16.621
    2    HA   ALA  27           HA       ALA  27 -29.846  -6.474 -17.444
    3    HB1  ALA  27           HB1      ALA  27 -28.002  -5.203 -16.335
    4    HB3  ALA  27           HB2      ALA  27 -28.553  -4.442 -17.829
    5    HB2  ALA  27           HB3      ALA  27 -27.048  -5.360 -17.811

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLU  28           H        GLU  28 -27.172  -7.818 -19.270
    2    HA   GLU  28           HA       GLU  28 -28.050  -6.789 -21.814
    3    HB2  GLU  28           HB2      GLU  28 -25.701  -7.542 -21.158
    4    HB3  GLU  28           HB3      GLU  28 -26.300  -9.190 -21.337
    5    HG2  GLU  28           HG2      GLU  28 -25.111  -8.484 -23.308
    6    HG3  GLU  28           HG3      GLU  28 -26.816  -8.756 -23.666

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LYS  29           H        LYS  29 -28.334  -9.860 -20.109
    2    HA   LYS  29           HA       LYS  29 -29.670 -11.318 -22.101
    3    HB2  LYS  29           HB2      LYS  29 -28.671 -12.304 -20.073
    4    HB3  LYS  29           HB3      LYS  29 -29.927 -11.538 -19.100
    5    HG2  LYS  29           HG2      LYS  29 -31.624 -12.871 -20.162
    6    HG3  LYS  29           HG3      LYS  29 -30.437 -13.564 -21.265
    7    HD2  LYS  29           HD2      LYS  29 -29.350 -14.741 -19.503
    8    HD3  LYS  29           HD3      LYS  29 -30.239 -13.850 -18.269
    9    HE2  LYS  29           HE2      LYS  29 -31.067 -16.178 -18.601
   10    HE3  LYS  29           HE3      LYS  29 -32.301 -14.947 -18.875
   11    HZ1  LYS  29           HZ1      LYS  29 -31.720 -15.139 -21.294
   12    HZ3  LYS  29           HZ2      LYS  29 -32.493 -16.489 -20.615
   13    HZ2  LYS  29           HZ3      LYS  29 -30.821 -16.522 -20.898

  No H/Q in entry =          13
  In of MODEL   39
    1    H    TYR  30           H        TYR  30 -31.011  -9.127 -19.643
    2    HA   TYR  30           HA       TYR  30 -33.677  -9.507 -20.901
    3    HB2  TYR  30           HB2      TYR  30 -33.008  -8.332 -18.193
    4    HB3  TYR  30           HB3      TYR  30 -34.628  -8.546 -18.857
    5    HD1  TYR  30           HD1      TYR  30 -35.613 -10.809 -19.043
    6    HD2  TYR  30           HD2      TYR  30 -31.771 -10.189 -17.316
    7    HE1  TYR  30           HE1      TYR  30 -35.609 -13.126 -18.208
    8    HE2  TYR  30           HE2      TYR  30 -31.767 -12.491 -16.487
    9    HH   TYR  30           HH       TYR  30 -33.476 -14.813 -17.557

  No H/Q in entry =           9
  In of MODEL   39
    1    H    GLU  31           H        GLU  31 -31.438  -7.602 -21.714
    2    HA   GLU  31           HA       GLU  31 -31.285  -5.461 -22.569
    3    HB2  GLU  31           HB2      GLU  31 -34.199  -6.088 -23.097
    4    HB3  GLU  31           HB3      GLU  31 -33.307  -4.761 -23.839
    5    HG2  GLU  31           HG2      GLU  31 -31.874  -6.266 -24.995
    6    HG3  GLU  31           HG3      GLU  31 -32.492  -7.646 -24.090

  No H/Q in entry =           6
  In of MODEL   39
    1    H    VAL  32           H        VAL  32 -31.504  -5.310 -19.841
    2    HA   VAL  32           HA       VAL  32 -33.302  -3.126 -19.232
    3    HB   VAL  32           HB       VAL  32 -30.956  -4.173 -17.614
    4   HG12  VAL  32          HG11      VAL  32 -32.480  -3.269 -15.746
    5   HG11  VAL  32          HG12      VAL  32 -33.272  -2.358 -17.030
    6   HG13  VAL  32          HG13      VAL  32 -31.559  -2.107 -16.700
    7   HG21  VAL  32          HG21      VAL  32 -32.774  -5.846 -18.291
    8   HG23  VAL  32          HG22      VAL  32 -33.796  -4.966 -17.153
    9   HG22  VAL  32          HG23      VAL  32 -32.308  -5.730 -16.594

  No H/Q in entry =           9
  In of MODEL   39
    1    HA   PRO  33           HA       PRO  33 -30.161  -0.325 -20.923
    2    HB2  PRO  33           HB2      PRO  33 -31.601   1.947 -20.847
    3    HB3  PRO  33           HB3      PRO  33 -32.102   0.644 -21.925
    4    HG2  PRO  33           HG2      PRO  33 -33.077   1.235 -19.129
    5    HG3  PRO  33           HG3      PRO  33 -34.035   1.034 -20.596
    6    HD2  PRO  33           HD2      PRO  33 -33.660  -1.026 -18.895
    7    HD3  PRO  33           HD3      PRO  33 -33.716  -1.292 -20.637

  No H/Q in entry =           7
  In of MODEL   39
    1    H    VAL  34           H        VAL  34 -28.933  -0.879 -18.955
    2    HA   VAL  34           HA       VAL  34 -28.585   1.562 -17.342
    3    HB   VAL  34           HB       VAL  34 -28.067   0.112 -15.377
    4   HG12  VAL  34          HG11      VAL  34 -30.508  -0.678 -15.077
    5   HG11  VAL  34          HG12      VAL  34 -30.787   0.067 -16.650
    6   HG13  VAL  34          HG13      VAL  34 -30.215   1.046 -15.300
    7   HG21  VAL  34          HG21      VAL  34 -28.300  -1.938 -17.355
    8   HG23  VAL  34          HG22      VAL  34 -29.380  -2.244 -15.993
    9   HG22  VAL  34          HG23      VAL  34 -27.655  -2.007 -15.715

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ILE  35           H        ILE  35 -26.603   1.947 -16.491
    2    HA   ILE  35           HA       ILE  35 -24.331   0.526 -17.714
    3    HB   ILE  35           HB       ILE  35 -24.646   3.439 -16.951
    4   HG12  ILE  35          HG12      ILE  35 -23.684   2.062 -19.466
    5   HG13  ILE  35          HG13      ILE  35 -25.297   2.738 -19.230
    6   HG21  ILE  35          HG21      ILE  35 -22.131   1.822 -17.214
    7   HG23  ILE  35          HG22      ILE  35 -22.559   3.034 -16.007
    8   HG22  ILE  35          HG23      ILE  35 -22.146   3.531 -17.648
    9   HD11  ILE  35          HD11      ILE  35 -23.831   4.897 -18.651
   10   HD13  ILE  35          HD12      ILE  35 -24.366   4.505 -20.285
   11   HD12  ILE  35          HD13      ILE  35 -22.731   4.092 -19.770

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ILE  36           H        ILE  36 -23.147  -0.510 -16.089
    2    HA   ILE  36           HA       ILE  36 -23.591   0.162 -13.231
    3    HB   ILE  36           HB       ILE  36 -22.840  -2.582 -14.291
    4   HG12  ILE  36          HG12      ILE  36 -25.627  -1.677 -13.564
    5   HG13  ILE  36          HG13      ILE  36 -25.041  -1.700 -15.228
    6   HG23  ILE  36          HG21      ILE  36 -23.234  -3.366 -12.168
    7   HG22  ILE  36          HG22      ILE  36 -24.324  -2.042 -11.759
    8   HG21  ILE  36          HG23      ILE  36 -22.584  -1.765 -11.819
    9   HD13  ILE  36          HD11      ILE  36 -25.274  -3.911 -15.401
   10   HD12  ILE  36          HD12      ILE  36 -26.347  -3.734 -14.013
   11   HD11  ILE  36          HD13      ILE  36 -24.664  -4.204 -13.773

  No H/Q in entry =          11
  In of MODEL   39
    1    H    GLU  37           H        GLU  37 -21.800   0.753 -12.121
    2    HA   GLU  37           HA       GLU  37 -19.129  -0.142 -13.001
    3    HB2  GLU  37           HB2      GLU  37 -20.049   2.672 -12.518
    4    HB3  GLU  37           HB3      GLU  37 -18.361   2.211 -12.301
    5    HG2  GLU  37           HG2      GLU  37 -18.503   3.188 -14.419
    6    HG3  GLU  37           HG3      GLU  37 -18.377   1.450 -14.688

  No H/Q in entry =           6
  In of MODEL   39
    1    H    ALA  38           H        ALA  38 -17.663  -0.398 -11.302
    2    HA   ALA  38           HA       ALA  38 -18.711  -0.145  -8.544
    3    HB1  ALA  38           HB1      ALA  38 -17.047  -2.158  -9.925
    4    HB3  ALA  38           HB2      ALA  38 -18.114  -2.340  -8.533
    5    HB2  ALA  38           HB3      ALA  38 -16.483  -1.703  -8.316

  No H/Q in entry =           5
  In of MODEL   39
    1    H    PHE  39           H        PHE  39 -17.446   1.049  -7.078
    2    HA   PHE  39           HA       PHE  39 -14.880   2.160  -7.972
    3    HB2  PHE  39           HB2      PHE  39 -17.047   3.837  -6.708
    4    HB3  PHE  39           HB3      PHE  39 -15.461   4.383  -7.248
    5    HD1  PHE  39           HD1      PHE  39 -14.998   4.788  -9.558
    6    HD2  PHE  39           HD2      PHE  39 -18.808   3.343  -8.297
    7    HE1  PHE  39           HE1      PHE  39 -15.937   5.359 -11.779
    8    HE2  PHE  39           HE2      PHE  39 -19.757   3.902 -10.507
    9    HZ   PHE  39           HZ       PHE  39 -18.322   4.883 -12.265

  No H/Q in entry =           9
  In of MODEL   39
    1    HA   PRO  40           HA       PRO  40 -13.999   1.446  -3.666
    2    HB2  PRO  40           HB2      PRO  40 -12.177   3.415  -3.074
    3    HB3  PRO  40           HB3      PRO  40 -11.765   2.057  -4.121
    4    HG2  PRO  40           HG2      PRO  40 -12.706   4.810  -4.913
    5    HG3  PRO  40           HG3      PRO  40 -11.298   3.922  -5.494
    6    HD2  PRO  40           HD2      PRO  40 -13.509   3.872  -6.923
    7    HD3  PRO  40           HD3      PRO  40 -12.600   2.379  -6.702

  No H/Q in entry =           7
  In of MODEL   39
    1    H    GLU  41           H        GLU  41 -14.609   2.474  -1.557
    2    HA   GLU  41           HA       GLU  41 -16.803   4.241  -1.585
    3    HB2  GLU  41           HB2      GLU  41 -16.659   4.218   0.803
    4    HB3  GLU  41           HB3      GLU  41 -16.262   2.600   0.224
    5    HG2  GLU  41           HG2      GLU  41 -13.906   2.997   0.610
    6    HG3  GLU  41           HG3      GLU  41 -14.238   4.664   1.082

  No H/Q in entry =           6
  In of MODEL   39
    1    H    THR  42           H        THR  42 -13.446   5.062  -1.623
    2    HA   THR  42           HA       THR  42 -13.736   7.650  -0.454
    3    HB   THR  42           HB       THR  42 -11.556   8.145  -1.547
    4    HG1  THR  42           HG1      THR  42 -11.267   5.562  -2.452
    5   HG23  THR  42          HG21      THR  42 -10.258   6.451  -0.368
    6   HG22  THR  42          HG22      THR  42 -11.665   5.387  -0.302
    7   HG21  THR  42          HG23      THR  42 -11.661   6.898   0.605

  No H/Q in entry =           7
  In of MODEL   39
    1    H    LEU  43           H        LEU  43 -14.645   6.533  -3.544
    2    HA   LEU  43           HA       LEU  43 -14.812   9.297  -4.559
    3    HB2  LEU  43           HB2      LEU  43 -15.238   6.639  -5.914
    4    HB3  LEU  43           HB3      LEU  43 -15.399   8.210  -6.697
    5    HG   LEU  43           HG       LEU  43 -12.832   7.033  -5.659
    6   HD12  LEU  43          HD11      LEU  43 -13.563   7.543  -8.524
    7   HD11  LEU  43          HD12      LEU  43 -13.959   6.014  -7.741
    8   HD13  LEU  43          HD13      LEU  43 -12.278   6.527  -7.872
    9   HD22  LEU  43          HD21      LEU  43 -12.586   9.358  -5.533
   10   HD21  LEU  43          HD22      LEU  43 -13.567   9.635  -6.972
   11   HD23  LEU  43          HD23      LEU  43 -11.944   8.966  -7.127

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ALA  44           H        ALA  44 -16.824   7.556  -2.695
    2    HA   ALA  44           HA       ALA  44 -19.294   7.466  -4.036
    3    HB2  ALA  44           HB1      ALA  44 -19.204   6.378  -1.921
    4    HB3  ALA  44           HB2      ALA  44 -20.275   7.759  -1.679
    5    HB1  ALA  44           HB3      ALA  44 -18.606   7.828  -1.114

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLY  45           H        GLY  45 -17.807  10.248  -2.535
    2    HA3  GLY  45           HA2      GLY  45 -20.198  11.811  -2.940
    3    HA2  GLY  45           HA3      GLY  45 -18.641  12.400  -2.360

  No H/Q in entry =           3
  In of MODEL   39
    1    H    GLU  46           H        GLU  46 -17.118  11.384  -4.622
    2    HA   GLU  46           HA       GLU  46 -17.678  13.590  -6.431
    3    HB2  GLU  46           HB2      GLU  46 -15.543  11.451  -6.395
    4    HB3  GLU  46           HB3      GLU  46 -15.627  12.744  -7.591
    5    HG2  GLU  46           HG2      GLU  46 -14.072  13.552  -6.103
    6    HG3  GLU  46           HG3      GLU  46 -15.559  14.317  -5.543

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LYS  47           H        LYS  47 -17.655  10.062  -6.810
    2    HA   LYS  47           HA       LYS  47 -18.725  10.270  -9.498
    3    HB2  LYS  47           HB2      LYS  47 -17.160   8.423  -8.405
    4    HB3  LYS  47           HB3      LYS  47 -18.714   7.710  -7.973
    5    HG2  LYS  47           HG2      LYS  47 -18.202   6.685  -9.975
    6    HG3  LYS  47           HG3      LYS  47 -19.278   7.992 -10.464
    7    HD2  LYS  47           HD2      LYS  47 -17.391   7.939 -11.954
    8    HD3  LYS  47           HD3      LYS  47 -17.289   9.386 -10.953
    9    HE2  LYS  47           HE2      LYS  47 -15.948   7.091  -9.771
   10    HE3  LYS  47           HE3      LYS  47 -15.286   7.544 -11.341
   11    HZ2  LYS  47           HZ1      LYS  47 -15.242   8.972  -8.826
   12    HZ1  LYS  47           HZ2      LYS  47 -15.553   9.925 -10.198
   13    HZ3  LYS  47           HZ3      LYS  47 -14.134   8.993 -10.114

  No H/Q in entry =          13
  In of MODEL   39
    1    H    GLY  48           H        GLY  48 -20.095   9.601  -6.350
    2    HA3  GLY  48           HA2      GLY  48 -22.506   8.472  -7.092
    3    HA2  GLY  48           HA3      GLY  48 -22.264   9.482  -5.667

  No H/Q in entry =           3
  In of MODEL   39
    1    H    GLN  49           H        GLN  49 -21.599  11.862  -7.271
    2    HA   GLN  49           HA       GLN  49 -24.125  13.043  -7.454
    3    HB2  GLN  49           HB2      GLN  49 -21.547  13.813  -8.806
    4    HB3  GLN  49           HB3      GLN  49 -22.982  14.820  -8.750
    5    HG2  GLN  49           HG2      GLN  49 -22.842  14.879  -6.311
    6    HG3  GLN  49           HG3      GLN  49 -21.420  13.850  -6.367
    7   HE21  GLN  49          HE21      GLN  49 -21.250  16.095  -5.128
    8   HE22  GLN  49          HE22      GLN  49 -20.287  17.313  -5.788

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ASN  50           H        ASN  50 -22.481  11.079  -9.797
    2    HA   ASN  50           HA       ASN  50 -24.321  11.971 -11.909
    3    HB2  ASN  50           HB2      ASN  50 -21.785  10.354 -12.096
    4    HB3  ASN  50           HB3      ASN  50 -22.812  10.788 -13.455
    5   HD21  ASN  50          HD21      ASN  50 -20.166  11.584 -11.835
    6   HD22  ASN  50          HD22      ASN  50 -19.883  13.206 -12.201

  No H/Q in entry =           6
  In of MODEL   39
    1    H    ALA  51           H        ALA  51 -24.393   9.651  -9.626
    2    HA   ALA  51           HA       ALA  51 -25.224   7.501 -11.425
    3    HB2  ALA  51           HB1      ALA  51 -24.694   6.162  -9.713
    4    HB3  ALA  51           HB2      ALA  51 -25.801   7.020  -8.642
    5    HB1  ALA  51           HB3      ALA  51 -24.143   7.590  -8.835

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ASP  52           H        ASP  52 -27.260   6.506 -11.285
    2    HA   ASP  52           HA       ASP  52 -29.393   8.412 -10.668
    3    HB2  ASP  52           HB2      ASP  52 -29.261   5.877 -12.297
    4    HB3  ASP  52           HB3      ASP  52 -30.787   6.661 -11.886

  No H/Q in entry =           4
  In of MODEL   39
    1    H    VAL  53           H        VAL  53 -27.886   5.495  -9.593
    2    HA   VAL  53           HA       VAL  53 -29.342   5.704  -7.092
    3    HB   VAL  53           HB       VAL  53 -30.778   4.084  -8.321
    4   HG11  VAL  53          HG11      VAL  53 -29.046   3.150  -9.815
    5   HG13  VAL  53          HG12      VAL  53 -29.924   1.894  -8.942
    6   HG12  VAL  53          HG13      VAL  53 -28.303   2.356  -8.426
    7   HG23  VAL  53          HG21      VAL  53 -30.029   2.111  -6.591
    8   HG22  VAL  53          HG22      VAL  53 -31.122   3.454  -6.254
    9   HG21  VAL  53          HG23      VAL  53 -29.415   3.582  -5.836

  No H/Q in entry =           9
  In of MODEL   39
    1    H    VAL  54           H        VAL  54 -28.055   5.259  -5.418
    2    HA   VAL  54           HA       VAL  54 -25.317   4.318  -5.993
    3    HB   VAL  54           HB       VAL  54 -26.352   6.163  -3.781
    4   HG11  VAL  54          HG11      VAL  54 -23.815   4.662  -4.027
    5   HG13  VAL  54          HG12      VAL  54 -24.558   5.387  -2.602
    6   HG12  VAL  54          HG13      VAL  54 -23.613   6.386  -3.707
    7   HG22  VAL  54          HG21      VAL  54 -25.429   7.933  -4.901
    8   HG21  VAL  54          HG22      VAL  54 -25.996   6.938  -6.242
    9   HG23  VAL  54          HG23      VAL  54 -24.292   6.919  -5.790

  No H/Q in entry =           9
  In of MODEL   39
    1    H    LEU  55           H        LEU  55 -24.789   2.390  -5.315
    2    HA   LEU  55           HA       LEU  55 -26.353   1.160  -3.132
    3    HB2  LEU  55           HB2      LEU  55 -24.814  -0.091  -5.396
    4    HB3  LEU  55           HB3      LEU  55 -25.613  -0.981  -4.099
    5    HG   LEU  55           HG       LEU  55 -26.984   0.615  -6.253
    6   HD13  LEU  55          HD11      LEU  55 -26.731  -1.266  -7.441
    7   HD12  LEU  55          HD12      LEU  55 -27.724  -2.092  -6.240
    8   HD11  LEU  55          HD13      LEU  55 -25.968  -2.078  -6.075
    9   HD23  LEU  55          HD21      LEU  55 -28.352  -1.261  -4.378
   10   HD22  LEU  55          HD22      LEU  55 -28.998   0.128  -5.254
   11   HD21  LEU  55          HD23      LEU  55 -27.982   0.375  -3.833

  No H/Q in entry =          11
  In of MODEL   39
    1    H    LEU  56           H        LEU  56 -25.235   0.560  -1.308
    2    HA   LEU  56           HA       LEU  56 -22.289   0.865  -1.339
    3    HB2  LEU  56           HB2      LEU  56 -24.116   0.748   1.047
    4    HB3  LEU  56           HB3      LEU  56 -22.395   1.125   1.044
    5    HG   LEU  56           HG       LEU  56 -24.634   2.857   0.034
    6   HD11  LEU  56          HD11      LEU  56 -23.551   2.481   2.570
    7   HD13  LEU  56          HD12      LEU  56 -24.495   3.872   2.034
    8   HD12  LEU  56          HD13      LEU  56 -22.735   3.922   1.959
    9   HD23  LEU  56          HD21      LEU  56 -22.636   4.491  -0.170
   10   HD22  LEU  56          HD22      LEU  56 -23.042   3.386  -1.483
   11   HD21  LEU  56          HD23      LEU  56 -21.709   3.010  -0.393

  No H/Q in entry =          11
  In of MODEL   39
    1    H    GLY  57           H        GLY  57 -20.964  -0.798  -0.768
    2    HA3  GLY  57           HA2      GLY  57 -21.967  -3.457  -0.929
    3    HA2  GLY  57           HA3      GLY  57 -20.334  -3.006  -0.447

  No H/Q in entry =           3
  In of MODEL   39
    1    HA   PRO  58           HA       PRO  58 -23.203  -3.897   3.257
    2    HB2  PRO  58           HB2      PRO  58 -22.604  -6.512   3.910
    3    HB3  PRO  58           HB3      PRO  58 -23.967  -6.078   2.880
    4    HG2  PRO  58           HG2      PRO  58 -21.262  -7.054   2.131
    5    HG3  PRO  58           HG3      PRO  58 -22.834  -7.477   1.453
    6    HD2  PRO  58           HD2      PRO  58 -21.161  -5.729   0.215
    7    HD3  PRO  58           HD3      PRO  58 -22.915  -5.591   0.097

  No H/Q in entry =           7
  In of MODEL   39
    1    H    GLN  59           H        GLN  59 -19.844  -4.484   2.686
    2    HA   GLN  59           HA       GLN  59 -19.112  -4.480   5.453
    3    HB2  GLN  59           HB2      GLN  59 -17.457  -3.676   3.055
    4    HB3  GLN  59           HB3      GLN  59 -16.845  -3.972   4.670
    5    HG2  GLN  59           HG2      GLN  59 -18.143  -6.002   2.861
    6    HG3  GLN  59           HG3      GLN  59 -16.424  -5.857   3.188
    7   HE21  GLN  59          HE21      GLN  59 -18.855  -7.482   3.869
    8   HE22  GLN  59          HE22      GLN  59 -18.763  -8.272   5.330

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ILE  60           H        ILE  60 -19.948  -1.937   3.197
    2    HA   ILE  60           HA       ILE  60 -19.052   0.025   5.219
    3    HB   ILE  60           HB       ILE  60 -19.212   1.732   3.366
    4   HG12  ILE  60          HG12      ILE  60 -19.083  -0.527   1.413
    5   HG13  ILE  60          HG13      ILE  60 -20.653   0.074   1.948
    6   HG23  ILE  60          HG21      ILE  60 -17.088   1.204   2.405
    7   HG22  ILE  60          HG22      ILE  60 -17.268  -0.492   2.850
    8   HG21  ILE  60          HG23      ILE  60 -17.102   0.734   4.104
    9   HD12  ILE  60          HD11      ILE  60 -18.554   1.454   0.313
   10   HD11  ILE  60          HD12      ILE  60 -19.673   2.412   1.282
   11   HD13  ILE  60          HD13      ILE  60 -20.289   1.334   0.030

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ALA  61           H        ALA  61 -21.556  -1.482   5.292
    2    HA   ALA  61           HA       ALA  61 -23.725   0.244   4.788
    3    HB1  ALA  61           HB1      ALA  61 -24.997  -1.187   6.126
    4    HB2  ALA  61           HB2      ALA  61 -23.620  -1.603   7.147
    5    HB3  ALA  61           HB3      ALA  61 -23.721  -2.233   5.503

  No H/Q in entry =           5
  In of MODEL   39
    1    H    TYR  62           H        TYR  62 -21.545   0.108   7.606
    2    HA   TYR  62           HA       TYR  62 -23.061   1.840   9.237
    3    HB2  TYR  62           HB2      TYR  62 -21.014   2.224  10.477
    4    HB3  TYR  62           HB3      TYR  62 -21.128   0.518  10.047
    5    HD1  TYR  62           HD1      TYR  62 -19.544  -0.489   8.475
    6    HD2  TYR  62           HD2      TYR  62 -19.270   3.655   9.477
    7    HE1  TYR  62           HE1      TYR  62 -17.319  -0.385   7.419
    8    HE2  TYR  62           HE2      TYR  62 -17.030   3.754   8.423
    9    HH   TYR  62           HH       TYR  62 -15.936   2.072   6.377

  No H/Q in entry =           9
  In of MODEL   39
    1    H    MET  63           H        MET  63 -21.369   2.601   6.381
    2    HA   MET  63           HA       MET  63 -21.118   5.437   7.031
    3    HB2  MET  63           HB2      MET  63 -20.536   3.850   4.530
    4    HB3  MET  63           HB3      MET  63 -20.299   5.593   4.675
    5    HG2  MET  63           HG2      MET  63 -18.615   5.233   6.383
    6    HG3  MET  63           HG3      MET  63 -18.864   3.492   6.276
    7    HE3  MET  63           HE1      MET  63 -18.247   6.121   2.884
    8    HE2  MET  63           HE2      MET  63 -16.727   6.368   3.744
    9    HE1  MET  63           HE3      MET  63 -18.263   6.618   4.577

  No H/Q in entry =           9
  In of MODEL   39
    1    H    LEU  64           H        LEU  64 -23.733   3.650   6.075
    2    HA   LEU  64           HA       LEU  64 -24.880   5.072   3.964
    3    HB2  LEU  64           HB2      LEU  64 -25.823   3.010   4.908
    4    HB3  LEU  64           HB3      LEU  64 -26.264   3.890   6.370
    5    HG   LEU  64           HG       LEU  64 -27.908   5.178   5.109
    6   HD13  LEU  64          HD11      LEU  64 -27.601   5.374   2.875
    7   HD12  LEU  64          HD12      LEU  64 -28.297   3.758   2.750
    8   HD11  LEU  64          HD13      LEU  64 -26.547   3.961   2.819
    9   HD23  LEU  64          HD21      LEU  64 -28.511   2.371   4.401
   10   HD22  LEU  64          HD22      LEU  64 -29.469   3.551   5.295
   11   HD21  LEU  64          HD23      LEU  64 -28.127   2.727   6.086

  No H/Q in entry =          11
  In of MODEL   39
    1    HA   PRO  65           HA       PRO  65 -26.978   8.338   6.646
    2    HB2  PRO  65           HB2      PRO  65 -24.991   8.468   8.914
    3    HB3  PRO  65           HB3      PRO  65 -26.721   8.806   8.942
    4    HG2  PRO  65           HG2      PRO  65 -25.871   6.538   9.912
    5    HG3  PRO  65           HG3      PRO  65 -27.283   6.534   8.855
    6    HD2  PRO  65           HD2      PRO  65 -24.428   5.816   8.185
    7    HD3  PRO  65           HD3      PRO  65 -25.911   4.970   7.741

  No H/Q in entry =           7
  In of MODEL   39
    1    H    GLU  66           H        GLU  66 -23.427   8.167   6.750
    2    HA   GLU  66           HA       GLU  66 -23.035  10.948   6.302
    3    HB2  GLU  66           HB2      GLU  66 -21.294   8.572   5.702
    4    HB3  GLU  66           HB3      GLU  66 -20.787  10.245   5.471
    5    HG2  GLU  66           HG2      GLU  66 -21.004  10.660   7.831
    6    HG3  GLU  66           HG3      GLU  66 -21.585   9.015   8.085

  No H/Q in entry =           6
  In of MODEL   39
    1    H    ILE  67           H        ILE  67 -23.210   8.171   4.094
    2    HA   ILE  67           HA       ILE  67 -22.720   9.827   1.777
    3    HB   ILE  67           HB       ILE  67 -23.717   6.955   1.996
    4   HG12  ILE  67          HG12      ILE  67 -21.042   8.021   1.076
    5   HG13  ILE  67          HG13      ILE  67 -21.364   7.639   2.766
    6   HG21  ILE  67          HG21      ILE  67 -23.580   8.794  -0.259
    7   HG23  ILE  67          HG22      ILE  67 -24.261   7.169  -0.187
    8   HG22  ILE  67          HG23      ILE  67 -22.541   7.391  -0.506
    9   HD12  ILE  67          HD11      ILE  67 -20.986   5.816   0.448
   10   HD11  ILE  67          HD12      ILE  67 -22.029   5.300   1.772
   11   HD13  ILE  67          HD13      ILE  67 -20.344   5.713   2.088

  No H/Q in entry =          11
  In of MODEL   39
    1    H    GLN  68           H        GLN  68 -25.636   8.898   3.404
    2    HA   GLN  68           HA       GLN  68 -27.418   9.858   1.400
    3    HB2  GLN  68           HB2      GLN  68 -27.708   9.558   4.387
    4    HB3  GLN  68           HB3      GLN  68 -28.998  10.182   3.374
    5    HG2  GLN  68           HG2      GLN  68 -29.088   8.133   2.130
    6    HG3  GLN  68           HG3      GLN  68 -27.665   7.520   2.953
    7   HE21  GLN  68          HE21      GLN  68 -29.888   6.236   2.822
    8   HE22  GLN  68          HE22      GLN  68 -30.743   5.833   4.237

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ARG  69           H        ARG  69 -25.775  11.511   4.124
    2    HA   ARG  69           HA       ARG  69 -27.048  14.034   3.668
    3    HB2  ARG  69           HB2      ARG  69 -24.750  13.048   5.290
    4    HB3  ARG  69           HB3      ARG  69 -24.764  14.763   4.903
    5    HG2  ARG  69           HG2      ARG  69 -27.085  14.903   5.856
    6    HG3  ARG  69           HG3      ARG  69 -26.941  13.215   6.358
    7    HD2  ARG  69           HD2      ARG  69 -25.172  15.523   7.248
    8    HD3  ARG  69           HD3      ARG  69 -26.340  14.674   8.248
    9    HE   ARG  69           HE       ARG  69 -23.756  13.635   7.333
   10   HH21  ARG  69          HH11      ARG  69 -23.020  11.863   8.563
   11   HH22  ARG  69          HH12      ARG  69 -24.085  11.102   9.696
   12   HH11  ARG  69          HH21      ARG  69 -26.742  13.220   9.016
   13   HH12  ARG  69          HH22      ARG  69 -26.193  11.868   9.951

  No H/Q in entry =          13
  In of MODEL   39
    1    H    LEU  70           H        LEU  70 -24.220  12.504   2.352
    2    HA   LEU  70           HA       LEU  70 -23.014  14.809   1.156
    3    HB2  LEU  70           HB2      LEU  70 -22.108  12.467   1.795
    4    HB3  LEU  70           HB3      LEU  70 -22.727  11.998   0.213
    5    HG   LEU  70           HG       LEU  70 -21.077  13.294  -0.882
    6   HD11  LEU  70          HD11      LEU  70 -20.245  14.153   1.899
    7   HD13  LEU  70          HD12      LEU  70 -20.894  15.191   0.629
    8   HD12  LEU  70          HD13      LEU  70 -19.306  14.449   0.433
    9   HD22  LEU  70          HD21      LEU  70 -19.709  11.532  -0.611
   10   HD21  LEU  70          HD22      LEU  70 -20.664  11.066   0.797
   11   HD23  LEU  70          HD23      LEU  70 -19.243  12.090   0.995

  No H/Q in entry =          11
  In of MODEL   39
    1    H    LEU  71           H        LEU  71 -25.250  12.328   0.064
    2    HA   LEU  71           HA       LEU  71 -25.703  13.794  -2.479
    3    HB2  LEU  71           HB2      LEU  71 -26.022  10.827  -1.988
    4    HB3  LEU  71           HB3      LEU  71 -26.107  11.667  -3.535
    5    HG   LEU  71           HG       LEU  71 -23.600  11.612  -1.855
    6   HD12  LEU  71          HD11      LEU  71 -23.697   9.949  -4.262
    7   HD11  LEU  71          HD12      LEU  71 -24.739   9.384  -2.957
    8   HD13  LEU  71          HD13      LEU  71 -23.012   9.604  -2.673
    9   HD22  LEU  71          HD21      LEU  71 -23.624  13.407  -3.378
   10   HD21  LEU  71          HD22      LEU  71 -24.151  12.363  -4.697
   11   HD23  LEU  71          HD23      LEU  71 -22.541  12.166  -4.005

  No H/Q in entry =          11
  In of MODEL   39
    1    HA   PRO  72           HA       PRO  72 -29.601  13.533   0.120
    2    HB2  PRO  72           HB2      PRO  72 -30.359  16.123  -0.008
    3    HB3  PRO  72           HB3      PRO  72 -29.076  15.639   1.100
    4    HG2  PRO  72           HG2      PRO  72 -28.825  16.782  -1.670
    5    HG3  PRO  72           HG3      PRO  72 -28.048  17.327  -0.184
    6    HD2  PRO  72           HD2      PRO  72 -26.760  15.690  -1.916
    7    HD3  PRO  72           HD3      PRO  72 -26.524  15.542  -0.175

  No H/Q in entry =           7
  In of MODEL   39
    1    H    ASN  73           H        ASN  73 -28.918  14.412  -3.104
    2    HA   ASN  73           HA       ASN  73 -31.784  14.205  -3.754
    3    HB2  ASN  73           HB2      ASN  73 -31.261  15.259  -5.865
    4    HB3  ASN  73           HB3      ASN  73 -30.710  16.239  -4.514
    5   HD21  ASN  73          HD21      ASN  73 -29.895  16.209  -7.186
    6   HD22  ASN  73          HD22      ASN  73 -28.234  15.981  -7.364

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LYS  74           H        LYS  74 -29.897  11.880  -3.279
    2    HA   LYS  74           HA       LYS  74 -30.501  10.468  -5.809
    3    HB2  LYS  74           HB2      LYS  74 -27.994  10.103  -4.164
    4    HB3  LYS  74           HB3      LYS  74 -28.399   9.282  -5.672
    5    HG2  LYS  74           HG2      LYS  74 -28.017  12.242  -5.514
    6    HG3  LYS  74           HG3      LYS  74 -26.684  11.121  -5.792
    7    HD2  LYS  74           HD2      LYS  74 -27.824  10.207  -7.728
    8    HD3  LYS  74           HD3      LYS  74 -29.204  11.265  -7.435
    9    HE2  LYS  74           HE2      LYS  74 -27.897  13.213  -7.899
   10    HE3  LYS  74           HE3      LYS  74 -26.412  12.262  -7.965
   11    HZ2  LYS  74           HZ1      LYS  74 -27.842  12.889 -10.111
   12    HZ1  LYS  74           HZ2      LYS  74 -28.561  11.400  -9.719
   13    HZ3  LYS  74           HZ3      LYS  74 -26.888  11.489 -10.006

  No H/Q in entry =          13
  In of MODEL   39
    1    HA   PRO  75           HA       PRO  75 -32.035   7.590  -2.801
    2    HB2  PRO  75           HB2      PRO  75 -32.423   5.360  -4.351
    3    HB3  PRO  75           HB3      PRO  75 -33.493   6.758  -4.450
    4    HG2  PRO  75           HG2      PRO  75 -31.169   6.040  -6.194
    5    HG3  PRO  75           HG3      PRO  75 -32.795   6.535  -6.661
    6    HD2  PRO  75           HD2      PRO  75 -30.781   8.321  -6.632
    7    HD3  PRO  75           HD3      PRO  75 -32.398   8.795  -6.112

  No H/Q in entry =           7
  In of MODEL   39
    1    H    VAL  76           H        VAL  76 -30.636   6.498  -1.401
    2    HA   VAL  76           HA       VAL  76 -28.214   5.173  -2.470
    3    HB   VAL  76           HB       VAL  76 -28.461   6.692   0.162
    4   HG11  VAL  76          HG11      VAL  76 -26.150   5.288  -1.191
    5   HG13  VAL  76          HG12      VAL  76 -26.875   4.892   0.368
    6   HG12  VAL  76          HG13      VAL  76 -25.966   6.390   0.174
    7   HG22  VAL  76          HG21      VAL  76 -27.711   8.550  -0.750
    8   HG21  VAL  76          HG22      VAL  76 -28.270   7.852  -2.271
    9   HG23  VAL  76          HG23      VAL  76 -26.576   7.703  -1.802

  No H/Q in entry =           9
  In of MODEL   39
    1    H    GLU  77           H        GLU  77 -28.090   3.022  -1.821
    2    HA   GLU  77           HA       GLU  77 -28.927   2.310   0.839
    3    HB2  GLU  77           HB2      GLU  77 -30.596   0.721   0.322
    4    HB3  GLU  77           HB3      GLU  77 -31.077   2.253  -0.408
    5    HG2  GLU  77           HG2      GLU  77 -30.484   1.436  -2.579
    6    HG3  GLU  77           HG3      GLU  77 -29.908  -0.075  -1.878

  No H/Q in entry =           6
  In of MODEL   39
    1    H    VAL  78           H        VAL  78 -28.690   0.222   1.535
    2    HA   VAL  78           HA       VAL  78 -26.050  -0.670   0.679
    3    HB   VAL  78           HB       VAL  78 -27.810  -1.446   3.045
    4   HG11  VAL  78          HG11      VAL  78 -25.514  -2.786   1.959
    5   HG13  VAL  78          HG12      VAL  78 -26.451  -3.196   3.397
    6   HG12  VAL  78          HG13      VAL  78 -25.085  -2.087   3.520
    7   HG22  VAL  78          HG21      VAL  78 -26.306  -0.121   4.373
    8   HG21  VAL  78          HG22      VAL  78 -26.994   0.856   3.077
    9   HG23  VAL  78          HG23      VAL  78 -25.339   0.260   2.949

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ILE  79           H        ILE  79 -25.583  -2.613  -0.191
    2    HA   ILE  79           HA       ILE  79 -27.693  -4.029  -1.531
    3    HB   ILE  79           HB       ILE  79 -24.728  -4.671  -1.277
    4   HG12  ILE  79          HG12      ILE  79 -26.301  -3.540  -3.596
    5   HG13  ILE  79          HG13      ILE  79 -25.396  -2.548  -2.452
    6   HG22  ILE  79          HG21      ILE  79 -25.859  -5.844  -3.586
    7   HG21  ILE  79          HG22      ILE  79 -26.874  -6.302  -2.218
    8   HG23  ILE  79          HG23      ILE  79 -25.145  -6.651  -2.189
    9   HD13  ILE  79          HD11      ILE  79 -23.974  -2.747  -4.258
   10   HD12  ILE  79          HD12      ILE  79 -24.381  -4.445  -4.513
   11   HD11  ILE  79          HD13      ILE  79 -23.388  -3.974  -3.133

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ASP  80           H        ASP  80 -28.638  -5.906  -0.923
    2    HA   ASP  80           HA       ASP  80 -28.641  -6.763   1.738
    3    HB2  ASP  80           HB2      ASP  80 -30.404  -7.295   0.094
    4    HB3  ASP  80           HB3      ASP  80 -29.281  -8.363  -0.750

  No H/Q in entry =           4
  In of MODEL   39
    1    H    SER  81           H        SER  81 -27.161  -7.940   2.898
    2    HA   SER  81           HA       SER  81 -24.685  -8.742   1.738
    3    HB2  SER  81           HB2      SER  81 -24.186  -9.748   3.926
    4    HB3  SER  81           HB3      SER  81 -24.838  -8.120   4.112
    5    HG   SER  81           HG       SER  81 -26.667  -8.907   4.877

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU  82           H        LEU  82 -27.480 -10.717   2.072
    2    HA   LEU  82           HA       LEU  82 -26.025 -13.154   1.603
    3    HB2  LEU  82           HB2      LEU  82 -28.935 -12.557   1.124
    4    HB3  LEU  82           HB3      LEU  82 -28.194 -14.143   1.326
    5    HG   LEU  82           HG       LEU  82 -28.466 -12.052   3.465
    6   HD13  LEU  82          HD11      LEU  82 -30.621 -13.015   2.911
    7   HD12  LEU  82          HD12      LEU  82 -30.056 -13.730   4.423
    8   HD11  LEU  82          HD13      LEU  82 -29.936 -14.640   2.916
    9   HD23  LEU  82          HD21      LEU  82 -27.737 -14.039   4.869
   10   HD22  LEU  82          HD22      LEU  82 -26.497 -13.338   3.832
   11   HD21  LEU  82          HD23      LEU  82 -27.302 -14.832   3.354

  No H/Q in entry =          11
  In of MODEL   39
    1    H    LEU  83           H        LEU  83 -27.877 -10.884  -0.368
    2    HA   LEU  83           HA       LEU  83 -27.714 -12.290  -2.815
    3    HB2  LEU  83           HB2      LEU  83 -28.011  -9.358  -2.218
    4    HB3  LEU  83           HB3      LEU  83 -28.056 -10.029  -3.848
    5    HG   LEU  83           HG       LEU  83 -30.120 -10.297  -1.682
    6   HD13  LEU  83          HD11      LEU  83 -30.793  -8.438  -2.783
    7   HD12  LEU  83          HD12      LEU  83 -31.291  -9.554  -4.053
    8   HD11  LEU  83          HD13      LEU  83 -29.723  -8.752  -4.147
    9   HD23  LEU  83          HD21      LEU  83 -30.290 -11.594  -4.387
   10   HD22  LEU  83          HD22      LEU  83 -31.283 -11.880  -2.959
   11   HD21  LEU  83          HD23      LEU  83 -29.616 -12.452  -3.001

  No H/Q in entry =          11
  In of MODEL   39
    1    H    TYR  84           H        TYR  84 -25.678  -9.958  -1.162
    2    HA   TYR  84           HA       TYR  84 -23.782  -9.581  -3.286
    3    HB2  TYR  84           HB2      TYR  84 -24.262  -8.052  -1.277
    4    HB3  TYR  84           HB3      TYR  84 -23.267  -9.170  -0.346
    5    HD1  TYR  84           HD1      TYR  84 -20.913  -9.030  -0.395
    6    HD2  TYR  84           HD2      TYR  84 -23.213  -6.854  -3.260
    7    HE1  TYR  84           HE1      TYR  84 -18.862  -7.866  -1.140
    8    HE2  TYR  84           HE2      TYR  84 -21.171  -5.693  -4.022
    9    HH   TYR  84           HH       TYR  84 -18.919  -5.628  -3.865

  No H/Q in entry =           9
  In of MODEL   39
    1    H    GLY  85           H        GLY  85 -23.645 -11.541  -0.305
    2    HA3  GLY  85           HA2      GLY  85 -21.104 -12.597  -0.751
    3    HA2  GLY  85           HA3      GLY  85 -22.374 -13.377   0.191

  No H/Q in entry =           3
  In of MODEL   39
    1    H    LYS  86           H        LYS  86 -24.220 -13.710  -1.878
    2    HA   LYS  86           HA       LYS  86 -23.254 -16.146  -3.089
    3    HB2  LYS  86           HB2      LYS  86 -25.509 -15.841  -2.133
    4    HB3  LYS  86           HB3      LYS  86 -25.845 -14.618  -3.357
    5    HG2  LYS  86           HG2      LYS  86 -25.747 -16.293  -5.083
    6    HG3  LYS  86           HG3      LYS  86 -25.350 -17.524  -3.884
    7    HD2  LYS  86           HD2      LYS  86 -27.450 -17.026  -2.696
    8    HD3  LYS  86           HD3      LYS  86 -27.850 -15.822  -3.920
    9    HE2  LYS  86           HE2      LYS  86 -27.393 -18.744  -4.501
   10    HE3  LYS  86           HE3      LYS  86 -28.979 -18.016  -4.255
   11    HZ3  LYS  86           HZ1      LYS  86 -28.626 -18.006  -6.562
   12    HZ2  LYS  86           HZ2      LYS  86 -27.027 -17.453  -6.411
   13    HZ1  LYS  86           HZ3      LYS  86 -28.321 -16.409  -6.071

  No H/Q in entry =          13
  In of MODEL   39
    1    H    VAL  87           H        VAL  87 -23.107 -12.950  -4.037
    2    HA   VAL  87           HA       VAL  87 -22.746 -11.823  -5.994
    3    HB   VAL  87           HB       VAL  87 -21.769 -14.402  -7.257
    4   HG13  VAL  87          HG11      VAL  87 -20.358 -12.983  -8.515
    5   HG12  VAL  87          HG12      VAL  87 -20.537 -11.650  -7.373
    6   HG11  VAL  87          HG13      VAL  87 -21.878 -12.095  -8.428
    7   HG22  VAL  87          HG21      VAL  87 -20.683 -14.588  -5.202
    8   HG21  VAL  87          HG22      VAL  87 -20.456 -12.846  -5.060
    9   HG23  VAL  87          HG23      VAL  87 -19.513 -13.766  -6.231

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ASP  88           H        ASP  88 -25.289 -12.357  -5.652
    2    HA   ASP  88           HA       ASP  88 -26.441 -13.568  -8.037
    3    HB2  ASP  88           HB2      ASP  88 -27.462 -13.733  -5.717
    4    HB3  ASP  88           HB3      ASP  88 -27.845 -12.017  -5.849

  No H/Q in entry =           4
  In of MODEL   39
    1    H    GLY  89           H        GLY  89 -25.675 -12.368  -9.694
    2    HA3  GLY  89           HA2      GLY  89 -25.745  -9.595  -9.943
    3    HA2  GLY  89           HA3      GLY  89 -25.756 -10.738 -11.284

  No H/Q in entry =           3
  In of MODEL   39
    1    H    LEU  90           H        LEU  90 -28.258 -11.984 -10.831
    2    HA   LEU  90           HA       LEU  90 -29.982  -9.998 -11.990
    3    HB2  LEU  90           HB2      LEU  90 -30.140 -12.400 -12.530
    4    HB3  LEU  90           HB3      LEU  90 -30.670 -12.716 -10.880
    5    HG   LEU  90           HG       LEU  90 -32.740 -11.523 -11.277
    6   HD13  LEU  90          HD11      LEU  90 -32.482  -9.816 -12.780
    7   HD12  LEU  90          HD12      LEU  90 -33.063 -11.051 -13.900
    8   HD11  LEU  90          HD13      LEU  90 -31.335 -10.722 -13.770
    9   HD23  LEU  90          HD21      LEU  90 -32.719 -13.196 -13.683
   10   HD22  LEU  90          HD22      LEU  90 -33.715 -13.297 -12.231
   11   HD21  LEU  90          HD23      LEU  90 -32.086 -13.975 -12.233

  No H/Q in entry =          11
  In of MODEL   39
    1    H    GLY  91           H        GLY  91 -29.895 -11.449  -8.781
    2    HA3  GLY  91           HA2      GLY  91 -32.195 -10.228  -7.777
    3    HA2  GLY  91           HA3      GLY  91 -30.832 -10.799  -6.815

  No H/Q in entry =           3
  In of MODEL   39
    1    H    VAL  92           H        VAL  92 -28.836  -9.064  -7.689
    2    HA   VAL  92           HA       VAL  92 -29.546  -6.707  -6.185
    3    HB   VAL  92           HB       VAL  92 -27.010  -7.304  -7.754
    4   HG12  VAL  92          HG11      VAL  92 -27.115  -5.374  -5.462
    5   HG11  VAL  92          HG12      VAL  92 -27.748  -4.832  -7.017
    6   HG13  VAL  92          HG13      VAL  92 -26.073  -5.364  -6.885
    7   HG22  VAL  92          HG21      VAL  92 -26.861  -8.871  -6.134
    8   HG21  VAL  92          HG22      VAL  92 -27.980  -8.028  -5.062
    9   HG23  VAL  92          HG23      VAL  92 -26.304  -7.495  -5.181

  No H/Q in entry =           9
  In of MODEL   39
    1    H    LEU  93           H        LEU  93 -29.144  -7.443  -9.591
    2    HA   LEU  93           HA       LEU  93 -29.379  -4.814 -10.568
    3    HB2  LEU  93           HB2      LEU  93 -28.802  -6.717 -11.993
    4    HB3  LEU  93           HB3      LEU  93 -30.421  -7.377 -11.769
    5    HG   LEU  93           HG       LEU  93 -31.347  -5.396 -12.934
    6   HD11  LEU  93          HD11      LEU  93 -29.438  -3.866 -12.444
    7   HD13  LEU  93          HD12      LEU  93 -29.868  -3.909 -14.155
    8   HD12  LEU  93          HD13      LEU  93 -28.454  -4.789 -13.579
    9   HD23  LEU  93          HD21      LEU  93 -30.317  -6.043 -15.204
   10   HD22  LEU  93          HD22      LEU  93 -31.214  -7.250 -14.282
   11   HD21  LEU  93          HD23      LEU  93 -29.449  -7.264 -14.273

  No H/Q in entry =          11
  In of MODEL   39
    1    H    LYS  94           H        LYS  94 -31.857  -7.249  -9.691
    2    HA   LYS  94           HA       LYS  94 -34.139  -5.728 -10.357
    3    HB2  LYS  94           HB2      LYS  94 -33.725  -7.895  -8.305
    4    HB3  LYS  94           HB3      LYS  94 -35.292  -7.143  -8.596
    5    HG2  LYS  94           HG2      LYS  94 -35.221  -7.960 -10.916
    6    HG3  LYS  94           HG3      LYS  94 -33.693  -8.767 -10.565
    7    HD2  LYS  94           HD2      LYS  94 -34.877 -10.024  -8.724
    8    HD3  LYS  94           HD3      LYS  94 -36.390  -9.326  -9.302
    9    HE2  LYS  94           HE2      LYS  94 -35.897 -10.314 -11.548
   10    HE3  LYS  94           HE3      LYS  94 -34.519 -11.140 -10.821
   11    HZ3  LYS  94           HZ1      LYS  94 -36.426 -12.591 -10.978
   12    HZ2  LYS  94           HZ2      LYS  94 -37.364 -11.510 -10.061
   13    HZ1  LYS  94           HZ3      LYS  94 -36.040 -12.299  -9.351

  No H/Q in entry =          13
  In of MODEL   39
    1    H    ALA  95           H        ALA  95 -32.341  -5.867  -7.294
    2    HA   ALA  95           HA       ALA  95 -34.135  -4.189  -5.855
    3    HB2  ALA  95           HB1      ALA  95 -31.820  -5.647  -5.278
    4    HB3  ALA  95           HB2      ALA  95 -32.770  -4.685  -4.147
    5    HB1  ALA  95           HB3      ALA  95 -31.386  -3.965  -4.973

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA  96           H        ALA  96 -31.450  -3.477  -7.948
    2    HA   ALA  96           HA       ALA  96 -31.249  -0.709  -7.221
    3    HB2  ALA  96           HB1      ALA  96 -29.866  -0.573  -9.325
    4    HB3  ALA  96           HB2      ALA  96 -30.234  -2.273  -9.617
    5    HB1  ALA  96           HB3      ALA  96 -29.310  -1.804  -8.190

  No H/Q in entry =           5
  In of MODEL   39
    1    H    VAL  97           H        VAL  97 -32.831  -2.406  -9.889
    2    HA   VAL  97           HA       VAL  97 -33.800  -0.088 -11.191
    3    HB   VAL  97           HB       VAL  97 -34.726  -2.979 -11.189
    4   HG11  VAL  97          HG11      VAL  97 -36.432  -0.911 -11.720
    5   HG13  VAL  97          HG12      VAL  97 -36.551  -2.512 -12.450
    6   HG12  VAL  97          HG13      VAL  97 -35.739  -1.209 -13.315
    7   HG21  VAL  97          HG21      VAL  97 -33.361  -1.239 -13.245
    8   HG23  VAL  97          HG22      VAL  97 -33.880  -2.905 -13.509
    9   HG22  VAL  97          HG23      VAL  97 -32.624  -2.547 -12.322

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ALA  98           H        ALA  98 -35.086  -2.174  -8.625
    2    HA   ALA  98           HA       ALA  98 -37.600  -0.916  -8.312
    3    HB1  ALA  98           HB1      ALA  98 -36.683  -3.137  -7.235
    4    HB3  ALA  98           HB2      ALA  98 -37.830  -2.149  -6.327
    5    HB2  ALA  98           HB3      ALA  98 -36.108  -2.064  -5.959

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA  99           H        ALA  99 -34.500  -0.216  -6.657
    2    HA   ALA  99           HA       ALA  99 -35.557   1.840  -5.036
    3    HB1  ALA  99           HB1      ALA  99 -32.943   0.829  -5.751
    4    HB2  ALA  99           HB2      ALA  99 -33.471   1.626  -4.268
    5    HB3  ALA  99           HB3      ALA  99 -32.946   2.590  -5.648

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ILE 100           H        ILE 100 -34.491   1.872  -8.386
    2    HA   ILE 100           HA       ILE 100 -34.549   4.721  -8.653
    3    HB   ILE 100           HB       ILE 100 -34.722   2.537 -10.757
    4   HG12  ILE 100          HG12      ILE 100 -32.481   4.448 -10.104
    5   HG13  ILE 100          HG13      ILE 100 -32.590   2.815  -9.447
    6   HG21  ILE 100          HG21      ILE 100 -35.020   5.469 -10.938
    7   HG23  ILE 100          HG22      ILE 100 -35.573   4.205 -12.036
    8   HG22  ILE 100          HG23      ILE 100 -33.896   4.750 -12.091
    9   HD12  ILE 100          HD11      ILE 100 -32.001   3.702 -12.233
   10   HD11  ILE 100          HD12      ILE 100 -32.731   2.120 -11.957
   11   HD13  ILE 100          HD13      ILE 100 -31.171   2.511 -11.234

  No H/Q in entry =          11
  In of MODEL   39
    1    H    LYS 101           H        LYS 101 -36.946   2.198  -9.352
    2    HA   LYS 101           HA       LYS 101 -38.950   3.918 -10.392
    3    HB2  LYS 101           HB2      LYS 101 -38.958   1.160  -9.220
    4    HB3  LYS 101           HB3      LYS 101 -40.474   1.980  -9.588
    5    HG2  LYS 101           HG2      LYS 101 -39.981   2.058 -11.884
    6    HG3  LYS 101           HG3      LYS 101 -38.305   1.585 -11.612
    7    HD2  LYS 101           HD2      LYS 101 -39.629  -0.283 -12.475
    8    HD3  LYS 101           HD3      LYS 101 -39.026  -0.613 -10.850
    9    HE2  LYS 101           HE2      LYS 101 -41.120  -1.212 -10.347
   10    HE3  LYS 101           HE3      LYS 101 -41.504   0.510 -10.380
   11    HZ3  LYS 101           HZ1      LYS 101 -42.388   0.357 -12.501
   12    HZ2  LYS 101           HZ2      LYS 101 -42.916  -1.085 -11.774
   13    HZ1  LYS 101           HZ3      LYS 101 -41.602  -1.110 -12.849

  No H/Q in entry =          13
  In of MODEL   39
    1    H    LYS 102           H        LYS 102 -38.541   2.473  -7.158
    2    HA   LYS 102           HA       LYS 102 -40.743   3.781  -5.994
    3    HB2  LYS 102           HB2      LYS 102 -39.593   1.880  -4.941
    4    HB3  LYS 102           HB3      LYS 102 -38.161   2.880  -4.705
    5    HG2  LYS 102           HG2      LYS 102 -39.427   4.353  -3.239
    6    HG3  LYS 102           HG3      LYS 102 -40.862   3.358  -3.478
    7    HD2  LYS 102           HD2      LYS 102 -39.723   1.458  -2.414
    8    HD3  LYS 102           HD3      LYS 102 -38.288   2.455  -2.174
    9    HE2  LYS 102           HE2      LYS 102 -39.586   4.011  -0.797
   10    HE3  LYS 102           HE3      LYS 102 -41.038   3.046  -1.060
   11    HZ1  LYS 102           HZ1      LYS 102 -39.400   1.237  -0.017
   12    HZ3  LYS 102           HZ2      LYS 102 -40.477   2.183   0.891
   13    HZ2  LYS 102           HZ3      LYS 102 -38.846   2.636   0.768

  No H/Q in entry =          13
  In of MODEL   39
    1    H    ALA 103           H        ALA 103 -37.726   5.030  -7.008
    2    HA   ALA 103           HA       ALA 103 -37.862   7.380  -5.264
    3    HB2  ALA 103           HB1      ALA 103 -35.832   8.004  -6.837
    4    HB3  ALA 103           HB2      ALA 103 -35.866   6.281  -7.207
    5    HB1  ALA 103           HB3      ALA 103 -35.628   6.821  -5.546

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA 104           H        ALA 104 -38.492   6.623  -8.603
    2    HA   ALA 104           HA       ALA 104 -38.954   9.420  -9.273
    3    HB2  ALA 104           HB1      ALA 104 -39.012   8.719 -11.464
    4    HB1  ALA 104           HB2      ALA 104 -39.807   7.195 -11.067
    5    HB3  ALA 104           HB3      ALA 104 -38.077   7.390 -10.780

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA 105           H        ALA 105 -40.662   7.414  -7.447
    2    HA   ALA 105           HA       ALA 105 -43.026   8.909  -7.459
    3    HB2  ALA 105           HB1      ALA 105 -43.793   8.049  -9.489
    4    HB3  ALA 105           HB2      ALA 105 -44.486   6.906  -8.339
    5    HB1  ALA 105           HB3      ALA 105 -43.028   6.482  -9.232

  No H/Q in entry =           5
  In of MODEL   40
    1    H1   ALA   1           H3       ALA   1 -12.403 -15.459  -2.420
    2    H2   ALA   1           H2       ALA   1 -11.476 -16.610  -3.264
    3    H3   ALA   1           H1       ALA   1 -12.610 -15.650  -4.094
    4    HA   ALA   1           HA       ALA   1 -14.028 -17.334  -3.857
    5    HB3  ALA   1           HB1      ALA   1 -12.653 -19.123  -3.401
    6    HB1  ALA   1           HB2      ALA   1 -13.406 -19.005  -1.811
    7    HB2  ALA   1           HB3      ALA   1 -11.822 -18.283  -2.091

  No H/Q in entry =           7
  In of MODEL   40
    1    H    GLU   2           H        GLU   2 -15.660 -18.172  -2.203
    2    HA   GLU   2           HA       GLU   2 -17.286 -16.435  -1.139
    3    HB2  GLU   2           HB2      GLU   2 -16.374 -18.875   0.400
    4    HB3  GLU   2           HB3      GLU   2 -17.888 -18.007   0.657
    5    HG2  GLU   2           HG2      GLU   2 -18.882 -19.078  -1.079
    6    HG3  GLU   2           HG3      GLU   2 -17.556 -18.690  -2.164

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLU   3           H        GLU   3 -15.388 -17.817   1.479
    2    HA   GLU   3           HA       GLU   3 -15.579 -15.465   3.042
    3    HB2  GLU   3           HB2      GLU   3 -14.024 -18.031   3.285
    4    HB3  GLU   3           HB3      GLU   3 -13.776 -16.717   4.435
    5    HG2  GLU   3           HG2      GLU   3 -15.970 -16.844   5.255
    6    HG3  GLU   3           HG3      GLU   3 -16.576 -17.634   3.805

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LEU   4           H        LEU   4 -12.644 -16.976   1.645
    2    HA   LEU   4           HA       LEU   4 -10.786 -15.097   2.246
    3    HB2  LEU   4           HB2      LEU   4 -11.035 -16.385  -0.482
    4    HB3  LEU   4           HB3      LEU   4  -9.574 -15.684   0.204
    5    HG   LEU   4           HG       LEU   4 -11.095 -18.065   1.312
    6   HD13  LEU   4          HD11      LEU   4  -9.481 -19.438   0.378
    7   HD12  LEU   4          HD12      LEU   4  -8.255 -18.170   0.353
    8   HD11  LEU   4          HD13      LEU   4  -9.545 -18.174  -0.848
    9   HD23  LEU   4          HD21      LEU   4  -8.844 -18.159   2.692
   10   HD22  LEU   4          HD22      LEU   4 -10.152 -17.105   3.224
   11   HD21  LEU   4          HD23      LEU   4  -8.782 -16.431   2.342

  No H/Q in entry =          11
  In of MODEL   40
    1    H    GLU   5           H        GLU   5 -13.120 -14.855  -0.425
    2    HA   GLU   5           HA       GLU   5 -12.088 -12.382  -1.421
    3    HB2  GLU   5           HB2      GLU   5 -13.438 -13.919  -2.808
    4    HB3  GLU   5           HB3      GLU   5 -14.834 -13.606  -1.775
    5    HG2  GLU   5           HG2      GLU   5 -13.362 -11.329  -3.084
    6    HG3  GLU   5           HG3      GLU   5 -14.590 -12.232  -3.970

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLU   6           H        GLU   6 -14.822 -13.231   0.671
    2    HA   GLU   6           HA       GLU   6 -15.693 -10.545   1.078
    3    HB2  GLU   6           HB2      GLU   6 -17.136 -12.532   1.473
    4    HB3  GLU   6           HB3      GLU   6 -16.115 -12.972   2.842
    5    HG2  GLU   6           HG2      GLU   6 -18.016 -11.756   3.706
    6    HG3  GLU   6           HG3      GLU   6 -16.603 -10.709   3.834

  No H/Q in entry =           6
  In of MODEL   40
    1    H    VAL   7           H        VAL   7 -13.410 -12.687   2.643
    2    HA   VAL   7           HA       VAL   7 -12.923 -11.124   4.973
    3    HB   VAL   7           HB       VAL   7 -11.246 -13.185   3.517
    4   HG11  VAL   7          HG11      VAL   7 -10.757 -11.664   6.085
    5   HG13  VAL   7          HG12      VAL   7  -9.660 -11.888   4.723
    6   HG12  VAL   7          HG13      VAL   7 -10.029 -13.243   5.789
    7   HG21  VAL   7          HG21      VAL   7 -13.502 -13.724   4.738
    8   HG23  VAL   7          HG22      VAL   7 -12.571 -13.465   6.213
    9   HG22  VAL   7          HG23      VAL   7 -12.094 -14.728   5.080

  No H/Q in entry =           9
  In of MODEL   40
    1    H    VAL   8           H        VAL   8 -11.416 -11.249   1.761
    2    HA   VAL   8           HA       VAL   8  -9.329  -9.403   2.257
    3    HB   VAL   8           HB       VAL   8 -10.803 -10.066  -0.304
    4   HG12  VAL   8          HG11      VAL   8  -8.632  -9.086  -1.312
    5   HG11  VAL   8          HG12      VAL   8  -8.400  -8.322   0.261
    6   HG13  VAL   8          HG13      VAL   8  -9.830  -7.945  -0.700
    7   HG23  VAL   8          HG21      VAL   8  -7.973 -10.880   0.119
    8   HG22  VAL   8          HG22      VAL   8  -9.316 -11.798  -0.559
    9   HG21  VAL   8          HG23      VAL   8  -9.130 -11.676   1.188

  No H/Q in entry =           9
  In of MODEL   40
    1    H    MET   9           H        MET   9 -12.671  -8.969   1.100
    2    HA   MET   9           HA       MET   9 -12.573  -6.193   0.672
    3    HB2  MET   9           HB2      MET   9 -14.799  -8.060   1.474
    4    HB3  MET   9           HB3      MET   9 -15.074  -6.324   1.314
    5    HG2  MET   9           HG2      MET   9 -14.298  -6.380  -1.002
    6    HG3  MET   9           HG3      MET   9 -13.913  -8.094  -0.855
    7    HE1  MET   9           HE1      MET   9 -16.400  -5.370  -0.541
    8    HE3  MET   9           HE2      MET   9 -17.248  -6.288   0.700
    9    HE2  MET   9           HE3      MET   9 -17.996  -6.055  -0.877

  No H/Q in entry =           9
  In of MODEL   40
    1    H    GLY  10           H        GLY  10 -13.257  -8.083   3.596
    2    HA3  GLY  10           HA2      GLY  10 -13.778  -5.895   5.320
    3    HA2  GLY  10           HA3      GLY  10 -13.232  -7.492   5.830

  No H/Q in entry =           3
  In of MODEL   40
    1    H    LEU  11           H        LEU  11 -10.790  -7.643   4.513
    2    HA   LEU  11           HA       LEU  11  -9.071  -6.233   6.272
    3    HB2  LEU  11           HB2      LEU  11  -8.543  -7.658   3.661
    4    HB3  LEU  11           HB3      LEU  11  -7.264  -6.970   4.660
    5    HG   LEU  11           HG       LEU  11  -9.289  -8.982   5.673
    6   HD13  LEU  11          HD11      LEU  11  -8.083 -10.229   4.105
    7   HD12  LEU  11          HD12      LEU  11  -7.150 -10.482   5.579
    8   HD11  LEU  11          HD13      LEU  11  -6.596  -9.321   4.374
    9   HD22  LEU  11          HD21      LEU  11  -8.423  -7.983   7.592
   10   HD21  LEU  11          HD22      LEU  11  -6.881  -7.598   6.829
   11   HD23  LEU  11          HD23      LEU  11  -7.226  -9.252   7.335

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  12           H        ILE  12  -9.968  -5.668   2.884
    2    HA   ILE  12           HA       ILE  12  -8.251  -3.457   2.461
    3    HB   ILE  12           HB       ILE  12 -10.912  -4.099   1.166
    4   HG12  ILE  12          HG12      ILE  12  -8.898  -5.770   1.080
    5   HG13  ILE  12          HG13      ILE  12  -9.744  -5.388  -0.405
    6   HG22  ILE  12          HG21      ILE  12 -10.001  -2.701  -0.715
    7   HG21  ILE  12          HG22      ILE  12  -8.674  -2.219   0.334
    8   HG23  ILE  12          HG23      ILE  12 -10.314  -1.803   0.738
    9   HD13  ILE  12          HD11      ILE  12  -7.995  -3.838  -1.041
   10   HD12  ILE  12          HD12      ILE  12  -7.241  -5.367  -0.593
   11   HD11  ILE  12          HD13      ILE  12  -7.212  -4.019   0.518

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  13           H        ILE  13 -11.614  -3.688   3.556
    2    HA   ILE  13           HA       ILE  13 -12.043  -0.897   3.832
    3    HB   ILE  13           HB       ILE  13 -13.274  -3.308   5.186
    4   HG12  ILE  13          HG12      ILE  13 -13.496  -2.747   2.652
    5   HG13  ILE  13          HG13      ILE  13 -14.925  -3.197   3.557
    6   HG23  ILE  13          HG21      ILE  13 -13.740  -1.620   6.750
    7   HG22  ILE  13          HG22      ILE  13 -15.162  -1.583   5.716
    8   HG21  ILE  13          HG23      ILE  13 -13.898  -0.373   5.517
    9   HD11  ILE  13          HD11      ILE  13 -14.171  -0.297   3.340
   10   HD13  ILE  13          HD12      ILE  13 -15.740  -1.028   3.619
   11   HD12  ILE  13          HD13      ILE  13 -15.030  -1.098   2.021

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ASN  14           H        ASN  14 -10.958  -3.404   6.101
    2    HA   ASN  14           HA       ASN  14 -10.738  -1.774   8.390
    3    HB2  ASN  14           HB2      ASN  14 -10.513  -4.383   8.062
    4    HB3  ASN  14           HB3      ASN  14  -8.801  -4.014   7.905
    5   HD21  ASN  14          HD21      ASN  14  -9.452  -5.536  10.078
    6   HD22  ASN  14          HD22      ASN  14  -9.414  -4.619  11.504

  No H/Q in entry =           6
  In of MODEL   40
    1    H    SER  15           H        SER  15  -8.346  -2.617   5.895
    2    HA   SER  15           HA       SER  15  -6.187  -1.150   6.969
    3    HB2  SER  15           HB2      SER  15  -5.169  -1.373   4.812
    4    HB3  SER  15           HB3      SER  15  -6.143  -2.823   5.031
    5    HG   SER  15           HG       SER  15  -7.130  -2.241   3.286

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLY  16           H        GLY  16  -8.780  -0.251   4.725
    2    HA3  GLY  16           HA2      GLY  16  -7.895   2.382   4.179
    3    HA2  GLY  16           HA3      GLY  16  -9.552   1.804   4.017

  No H/Q in entry =           3
  In of MODEL   40
    1    H    GLN  17           H        GLN  17 -10.101   1.079   6.665
    2    HA   GLN  17           HA       GLN  17 -10.783   3.588   7.811
    3    HB2  GLN  17           HB2      GLN  17 -10.710   0.802   8.986
    4    HB3  GLN  17           HB3      GLN  17 -11.323   2.208   9.859
    5    HG2  GLN  17           HG2      GLN  17 -12.353   1.271   7.165
    6    HG3  GLN  17           HG3      GLN  17 -13.131   0.928   8.709
    7   HE21  GLN  17          HE21      GLN  17 -13.650   2.843   6.181
    8   HE22  GLN  17          HE22      GLN  17 -14.178   4.266   6.943

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ALA  18           H        ALA  18  -8.176   1.280   8.425
    2    HA   ALA  18           HA       ALA  18  -7.066   2.481  10.697
    3    HB2  ALA  18           HB1      ALA  18  -6.478   0.262   9.325
    4    HB3  ALA  18           HB2      ALA  18  -5.307   1.032  10.397
    5    HB1  ALA  18           HB3      ALA  18  -5.228   1.313   8.657

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ARG  19           H        ARG  19  -6.291   3.004   7.250
    2    HA   ARG  19           HA       ARG  19  -4.374   5.033   7.682
    3    HB2  ARG  19           HB2      ARG  19  -4.712   3.900   5.484
    4    HB3  ARG  19           HB3      ARG  19  -6.247   4.755   5.309
    5    HG2  ARG  19           HG2      ARG  19  -5.099   6.916   5.382
    6    HG3  ARG  19           HG3      ARG  19  -3.557   6.116   5.684
    7    HD2  ARG  19           HD2      ARG  19  -3.677   6.712   3.342
    8    HD3  ARG  19           HD3      ARG  19  -3.778   4.953   3.484
    9    HE   ARG  19           HE       ARG  19  -6.404   5.885   3.479
   10   HH21  ARG  19          HH11      ARG  19  -7.598   6.056   1.562
   11   HH22  ARG  19          HH12      ARG  19  -6.776   6.130   0.042
   12   HH11  ARG  19          HH21      ARG  19  -3.629   5.928   1.444
   13   HH12  ARG  19          HH22      ARG  19  -4.527   6.054  -0.025

  No H/Q in entry =          13
  In of MODEL   40
    1    H    SER  20           H        SER  20  -7.871   5.180   7.083
    2    HA   SER  20           HA       SER  20  -8.204   7.939   7.040
    3    HB2  SER  20           HB2      SER  20  -9.945   6.068   6.673
    4    HB3  SER  20           HB3      SER  20 -10.164   6.120   8.420
    5    HG   SER  20           HG       SER  20 -10.439   8.266   6.578

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU  21           H        LEU  21  -8.222   5.751   9.840
    2    HA   LEU  21           HA       LEU  21  -8.645   7.747  11.809
    3    HB2  LEU  21           HB2      LEU  21  -7.433   4.989  11.891
    4    HB3  LEU  21           HB3      LEU  21  -7.484   6.011  13.324
    5    HG   LEU  21           HG       LEU  21  -9.930   5.327  11.666
    6   HD13  LEU  21          HD11      LEU  21  -9.161   3.258  12.589
    7   HD12  LEU  21          HD12      LEU  21 -10.450   3.817  13.655
    8   HD11  LEU  21          HD13      LEU  21  -8.763   4.017  14.132
    9   HD22  LEU  21          HD21      LEU  21 -10.599   7.177  12.896
   10   HD21  LEU  21          HD22      LEU  21  -9.431   6.892  14.183
   11   HD23  LEU  21          HD23      LEU  21 -10.900   5.932  14.104

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ALA  22           H        ALA  22  -5.705   6.352  10.398
    2    HA   ALA  22           HA       ALA  22  -3.814   7.647  12.022
    3    HB2  ALA  22           HB1      ALA  22  -3.413   5.793  10.327
    4    HB1  ALA  22           HB2      ALA  22  -2.207   7.079  10.365
    5    HB3  ALA  22           HB3      ALA  22  -3.425   7.047   9.089

  No H/Q in entry =           5
  In of MODEL   40
    1    H    TYR  23           H        TYR  23  -5.123   8.680   8.842
    2    HA   TYR  23           HA       TYR  23  -3.767  11.166   8.776
    3    HB2  TYR  23           HB2      TYR  23  -4.855  10.267   6.782
    4    HB3  TYR  23           HB3      TYR  23  -6.432  10.384   7.564
    5    HD1  TYR  23           HD1      TYR  23  -3.515  12.405   6.411
    6    HD2  TYR  23           HD2      TYR  23  -7.655  12.406   7.555
    7    HE1  TYR  23           HE1      TYR  23  -3.723  14.759   5.656
    8    HE2  TYR  23           HE2      TYR  23  -7.863  14.759   6.799
    9    HH   TYR  23           HH       TYR  23  -5.371  16.330   4.981

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ALA  24           H        ALA  24  -6.894  10.211  10.154
    2    HA   ALA  24           HA       ALA  24  -7.709  12.806  10.930
    3    HB1  ALA  24           HB1      ALA  24  -9.538  11.569  11.395
    4    HB2  ALA  24           HB2      ALA  24  -8.717  10.988  12.842
    5    HB3  ALA  24           HB3      ALA  24  -8.599  10.078  11.337

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA  25           H        ALA  25  -5.727  10.329  12.499
    2    HA   ALA  25           HA       ALA  25  -5.379  11.574  15.004
    3    HB2  ALA  25           HB1      ALA  25  -4.631   9.217  14.178
    4    HB3  ALA  25           HB2      ALA  25  -3.609  10.065  15.341
    5    HB1  ALA  25           HB3      ALA  25  -3.173  10.048  13.631

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU  26           H        LEU  26  -3.586  11.864  11.964
    2    HA   LEU  26           HA       LEU  26  -1.613  13.666  12.883
    3    HB2  LEU  26           HB2      LEU  26  -1.321  12.516  10.777
    4    HB3  LEU  26           HB3      LEU  26  -2.788  13.237  10.124
    5    HG   LEU  26           HG       LEU  26  -1.755  15.479  10.264
    6   HD12  LEU  26          HD11      LEU  26   0.783  15.477  10.678
    7   HD11  LEU  26          HD12      LEU  26   0.547  13.897  11.419
    8   HD13  LEU  26          HD13      LEU  26  -0.249  15.317  12.098
    9   HD21  LEU  26          HD21      LEU  26  -0.029  13.412   8.865
   10   HD23  LEU  26          HD22      LEU  26  -0.058  15.135   8.498
   11   HD22  LEU  26          HD23      LEU  26  -1.489  14.150   8.207

  No H/Q in entry =          11
  In of MODEL   40
    1    H    LYS  27           H        LYS  27  -4.791  14.178  11.407
    2    HA   LYS  27           HA       LYS  27  -4.712  16.966  11.214
    3    HB2  LYS  27           HB2      LYS  27  -6.469  15.506  10.226
    4    HB3  LYS  27           HB3      LYS  27  -7.127  15.252  11.841
    5    HG2  LYS  27           HG2      LYS  27  -7.537  17.661  12.082
    6    HG3  LYS  27           HG3      LYS  27  -6.826  17.955  10.491
    7    HD2  LYS  27           HD2      LYS  27  -8.571  16.537   9.453
    8    HD3  LYS  27           HD3      LYS  27  -9.287  16.260  11.042
    9    HE2  LYS  27           HE2      LYS  27  -9.709  18.675  11.290
   10    HE3  LYS  27           HE3      LYS  27  -8.964  18.973   9.715
   11    HZ3  LYS  27           HZ1      LYS  27 -11.343  18.869   9.473
   12    HZ2  LYS  27           HZ2      LYS  27 -11.404  17.351  10.240
   13    HZ1  LYS  27           HZ3      LYS  27 -10.658  17.511   8.719

  No H/Q in entry =          13
  In of MODEL   40
    1    H    GLN  28           H        GLN  28  -5.619  14.883  13.937
    2    HA   GLN  28           HA       GLN  28  -6.497  16.891  15.717
    3    HB2  GLN  28           HB2      GLN  28  -5.116  14.248  16.257
    4    HB3  GLN  28           HB3      GLN  28  -5.852  15.256  17.504
    5    HG2  GLN  28           HG2      GLN  28  -7.318  14.152  15.091
    6    HG3  GLN  28           HG3      GLN  28  -7.383  13.457  16.709
    7   HE21  GLN  28          HE21      GLN  28  -9.229  15.293  14.741
    8   HE22  GLN  28          HE22      GLN  28  -9.976  16.307  15.879

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ALA  29           H        ALA  29  -3.289  15.566  15.025
    2    HA   ALA  29           HA       ALA  29  -1.838  16.947  17.006
    3    HB1  ALA  29           HB1      ALA  29   0.086  16.239  15.885
    4    HB3  ALA  29           HB2      ALA  29  -0.668  16.374  14.296
    5    HB2  ALA  29           HB3      ALA  29  -1.102  15.043  15.369

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LYS  30           H        LYS  30  -2.688  17.841  13.678
    2    HA   LYS  30           HA       LYS  30  -1.252  20.266  13.582
    3    HB2  LYS  30           HB2      LYS  30  -3.792  19.422  12.172
    4    HB3  LYS  30           HB3      LYS  30  -2.942  20.929  11.831
    5    HG2  LYS  30           HG2      LYS  30  -0.887  19.614  11.314
    6    HG3  LYS  30           HG3      LYS  30  -1.810  18.127  11.557
    7    HD2  LYS  30           HD2      LYS  30  -3.367  18.789   9.764
    8    HD3  LYS  30           HD3      LYS  30  -2.466  20.288   9.524
    9    HE2  LYS  30           HE2      LYS  30  -0.449  18.973   8.941
   10    HE3  LYS  30           HE3      LYS  30  -1.368  17.480   9.150
   11    HZ2  LYS  30           HZ1      LYS  30  -1.183  18.353   6.810
   12    HZ1  LYS  30           HZ2      LYS  30  -2.212  19.627   7.281
   13    HZ3  LYS  30           HZ3      LYS  30  -2.755  18.016   7.349

  No H/Q in entry =          13
  In of MODEL   40
    1    H    GLN  31           H        GLN  31  -4.361  19.448  14.994
    2    HA   GLN  31           HA       GLN  31  -5.091  22.212  15.452
    3    HB2  GLN  31           HB2      GLN  31  -6.300  19.778  16.770
    4    HB3  GLN  31           HB3      GLN  31  -7.040  21.359  16.528
    5    HG2  GLN  31           HG2      GLN  31  -6.341  20.579  13.936
    6    HG3  GLN  31           HG3      GLN  31  -6.883  19.080  14.680
    7   HE21  GLN  31          HE21      GLN  31  -8.275  20.675  12.583
    8   HE22  GLN  31          HE22      GLN  31  -9.783  21.084  13.242

  No H/Q in entry =           8
  In of MODEL   40
    1    H    GLY  32           H        GLY  32  -2.802  20.253  16.767
    2    HA3  GLY  32           HA2      GLY  32  -1.395  20.694  18.569
    3    HA2  GLY  32           HA3      GLY  32  -2.508  21.950  19.096

  No H/Q in entry =           3
  In of MODEL   40
    1    H    ASP  33           H        ASP  33  -3.970  18.930  18.428
    2    HA   ASP  33           HA       ASP  33  -4.385  18.471  21.307
    3    HB2  ASP  33           HB2      ASP  33  -5.805  17.483  18.828
    4    HB3  ASP  33           HB3      ASP  33  -6.157  16.874  20.443

  No H/Q in entry =           4
  In of MODEL   40
    1    H    PHE  34           H        PHE  34  -2.227  17.592  21.609
    2    HA   PHE  34           HA       PHE  34  -1.257  15.333  20.203
    3    HB2  PHE  34           HB2      PHE  34  -0.626  16.303  22.999
    4    HB3  PHE  34           HB3      PHE  34   0.287  15.070  22.128
    5    HD1  PHE  34           HD1      PHE  34   0.159  18.496  22.872
    6    HD2  PHE  34           HD2      PHE  34   0.953  15.790  19.630
    7    HE1  PHE  34           HE1      PHE  34   1.477  20.253  21.721
    8    HE2  PHE  34           HE2      PHE  34   2.265  17.550  18.484
    9    HZ   PHE  34           HZ       PHE  34   2.529  19.779  19.534

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ALA  35           H        ALA  35  -3.291  15.630  23.068
    2    HA   ALA  35           HA       ALA  35  -3.113  12.963  23.957
    3    HB3  ALA  35           HB1      ALA  35  -5.562  13.619  24.818
    4    HB1  ALA  35           HB2      ALA  35  -5.008  15.231  24.366
    5    HB2  ALA  35           HB3      ALA  35  -4.105  14.292  25.554

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA  36           H        ALA  36  -5.544  14.517  21.863
    2    HA   ALA  36           HA       ALA  36  -6.991  12.125  21.380
    3    HB1  ALA  36           HB1      ALA  36  -8.429  13.569  20.429
    4    HB3  ALA  36           HB2      ALA  36  -7.252  13.977  19.180
    5    HB2  ALA  36           HB3      ALA  36  -7.264  14.861  20.706

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA  37           H        ALA  37  -4.291  13.681  19.714
    2    HA   ALA  37           HA       ALA  37  -4.279  12.051  17.413
    3    HB3  ALA  37           HB1      ALA  37  -2.264  13.733  18.838
    4    HB2  ALA  37           HB2      ALA  37  -2.794  13.800  17.159
    5    HB1  ALA  37           HB3      ALA  37  -1.657  12.554  17.676

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LYS  38           H        LYS  38  -2.524  11.715  20.489
    2    HA   LYS  38           HA       LYS  38  -1.230   9.299  19.993
    3    HB2  LYS  38           HB2      LYS  38  -1.529  11.060  22.143
    4    HB3  LYS  38           HB3      LYS  38  -2.168   9.537  22.756
    5    HG2  LYS  38           HG2      LYS  38  -0.089   8.391  22.215
    6    HG3  LYS  38           HG3      LYS  38   0.538   9.830  21.405
    7    HD2  LYS  38           HD2      LYS  38   0.724  11.041  23.443
    8    HD3  LYS  38           HD3      LYS  38  -0.309   9.902  24.307
    9    HE2  LYS  38           HE2      LYS  38   2.042   9.554  24.924
   10    HE3  LYS  38           HE3      LYS  38   1.419   8.148  24.057
   11    HZ3  LYS  38           HZ1      LYS  38   2.724   8.554  22.276
   12    HZ2  LYS  38           HZ2      LYS  38   3.690   9.367  23.414
   13    HZ1  LYS  38           HZ3      LYS  38   2.622  10.244  22.426

  No H/Q in entry =          13
  In of MODEL   40
    1    H    ALA  39           H        ALA  39  -4.461   9.832  21.399
    2    HA   ALA  39           HA       ALA  39  -5.057   7.119  21.896
    3    HB3  ALA  39           HB1      ALA  39  -7.190   9.093  21.136
    4    HB2  ALA  39           HB2      ALA  39  -6.289   9.305  22.637
    5    HB1  ALA  39           HB3      ALA  39  -7.225   7.833  22.370

  No H/Q in entry =           5
  In of MODEL   40
    1    H    MET  40           H        MET  40  -5.617   9.147  19.055
    2    HA   MET  40           HA       MET  40  -7.119   7.238  17.591
    3    HB2  MET  40           HB2      MET  40  -5.479   9.615  16.691
    4    HB3  MET  40           HB3      MET  40  -6.518   8.672  15.619
    5    HG2  MET  40           HG2      MET  40  -7.535   9.927  18.181
    6    HG3  MET  40           HG3      MET  40  -7.582  10.766  16.633
    7    HE3  MET  40           HE1      MET  40 -10.188   9.185  14.566
    8    HE2  MET  40           HE2      MET  40  -8.434   9.281  14.417
    9    HE1  MET  40           HE3      MET  40  -9.334  10.656  15.055

  No H/Q in entry =           9
  In of MODEL   40
    1    H    MET  41           H        MET  41  -3.619   7.931  17.713
    2    HA   MET  41           HA       MET  41  -2.884   6.172  15.608
    3    HB2  MET  41           HB2      MET  41  -1.258   6.812  18.082
    4    HB3  MET  41           HB3      MET  41  -0.649   6.160  16.564
    5    HG2  MET  41           HG2      MET  41  -1.779   8.360  15.566
    6    HG3  MET  41           HG3      MET  41  -1.534   8.940  17.212
    7    HE2  MET  41           HE1      MET  41   1.358   6.805  17.567
    8    HE1  MET  41           HE2      MET  41   0.585   8.106  18.469
    9    HE3  MET  41           HE3      MET  41   2.212   8.331  17.826

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ASP  42           H        ASP  42  -3.273   5.694  19.093
    2    HA   ASP  42           HA       ASP  42  -2.269   3.088  19.246
    3    HB2  ASP  42           HB2      ASP  42  -3.120   4.853  21.073
    4    HB3  ASP  42           HB3      ASP  42  -4.559   3.846  20.999

  No H/Q in entry =           4
  In of MODEL   40
    1    H    GLN  43           H        GLN  43  -5.589   4.234  18.750
    2    HA   GLN  43           HA       GLN  43  -6.764   1.661  18.549
    3    HB2  GLN  43           HB2      GLN  43  -7.655   4.327  17.427
    4    HB3  GLN  43           HB3      GLN  43  -8.636   2.860  17.402
    5    HG2  GLN  43           HG2      GLN  43  -8.343   2.728  19.909
    6    HG3  GLN  43           HG3      GLN  43  -7.599   4.325  19.841
    7   HE21  GLN  43          HE21      GLN  43  -9.777   4.427  21.343
    8   HE22  GLN  43          HE22      GLN  43 -11.130   5.021  20.513

  No H/Q in entry =           8
  In of MODEL   40
    1    H    SER  44           H        SER  44  -5.398   3.865  16.142
    2    HA   SER  44           HA       SER  44  -6.118   2.395  13.849
    3    HB2  SER  44           HB2      SER  44  -4.832   4.762  14.299
    4    HB3  SER  44           HB3      SER  44  -3.491   3.751  13.766
    5    HG   SER  44           HG       SER  44  -4.592   4.741  12.006

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ARG  45           H        ARG  45  -3.241   2.242  15.928
    2    HA   ARG  45           HA       ARG  45  -1.785   0.273  14.540
    3    HB2  ARG  45           HB2      ARG  45  -0.925   1.679  16.413
    4    HB3  ARG  45           HB3      ARG  45  -1.928   0.758  17.531
    5    HG2  ARG  45           HG2      ARG  45  -0.722  -1.314  16.882
    6    HG3  ARG  45           HG3      ARG  45   0.305  -0.368  15.806
    7    HD2  ARG  45           HD2      ARG  45   1.057   0.998  17.765
    8    HD3  ARG  45           HD3      ARG  45   0.122  -0.069  18.836
    9    HE   ARG  45           HE       ARG  45   1.801  -1.681  17.251
   10   HH21  ARG  45          HH11      ARG  45   3.692  -2.529  18.085
   11   HH22  ARG  45          HH12      ARG  45   4.475  -1.756  19.418
   12   HH11  ARG  45          HH21      ARG  45   2.135   0.776  19.647
   13   HH12  ARG  45          HH22      ARG  45   3.593   0.118  20.300

  No H/Q in entry =          13
  In of MODEL   40
    1    H    MET  46           H        MET  46  -4.186  -0.025  17.140
    2    HA   MET  46           HA       MET  46  -4.052  -2.827  17.439
    3    HB2  MET  46           HB2      MET  46  -6.194  -0.795  18.047
    4    HB3  MET  46           HB3      MET  46  -6.426  -2.513  18.379
    5    HG2  MET  46           HG2      MET  46  -4.390  -2.524  19.767
    6    HG3  MET  46           HG3      MET  46  -4.142  -0.818  19.433
    7    HE3  MET  46           HE1      MET  46  -5.892   0.928  22.097
    8    HE2  MET  46           HE2      MET  46  -5.502   1.121  20.391
    9    HE1  MET  46           HE3      MET  46  -4.301   0.453  21.490

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ALA  47           H        ALA  47  -6.048  -0.779  15.351
    2    HA   ALA  47           HA       ALA  47  -7.691  -2.806  14.280
    3    HB3  ALA  47           HB1      ALA  47  -8.343  -0.559  13.870
    4    HB1  ALA  47           HB2      ALA  47  -7.862  -1.194  12.297
    5    HB2  ALA  47           HB3      ALA  47  -6.768  -0.142  13.196

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU  48           H        LEU  48  -4.556  -1.535  13.232
    2    HA   LEU  48           HA       LEU  48  -4.296  -3.122  10.886
    3    HB2  LEU  48           HB2      LEU  48  -2.222  -1.876  12.698
    4    HB3  LEU  48           HB3      LEU  48  -1.863  -2.597  11.129
    5    HG   LEU  48           HG       LEU  48  -3.856  -0.354  11.525
    6   HD13  LEU  48          HD11      LEU  48  -1.723   0.492  12.193
    7   HD12  LEU  48          HD12      LEU  48  -1.991   1.054  10.543
    8   HD11  LEU  48          HD13      LEU  48  -0.911  -0.308  10.847
    9   HD22  LEU  48          HD21      LEU  48  -4.341  -1.326   9.446
   10   HD21  LEU  48          HD22      LEU  48  -2.664  -1.782   9.150
   11   HD23  LEU  48          HD23      LEU  48  -3.161  -0.096   8.995

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ASN  49           H        ASN  49  -3.256  -3.543  14.231
    2    HA   ASN  49           HA       ASN  49  -1.684  -5.826  13.894
    3    HB2  ASN  49           HB2      ASN  49  -1.680  -4.508  15.946
    4    HB3  ASN  49           HB3      ASN  49  -3.353  -4.944  16.266
    5   HD21  ASN  49          HD21      ASN  49  -1.683  -5.575  18.284
    6   HD22  ASN  49          HD22      ASN  49  -1.327  -7.233  18.314

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLU  50           H        GLU  50  -5.149  -5.505  14.566
    2    HA   GLU  50           HA       GLU  50  -5.700  -8.297  14.667
    3    HB2  GLU  50           HB2      GLU  50  -7.262  -6.590  15.548
    4    HB3  GLU  50           HB3      GLU  50  -7.548  -6.017  13.903
    5    HG2  GLU  50           HG2      GLU  50  -8.444  -8.199  13.258
    6    HG3  GLU  50           HG3      GLU  50  -8.072  -8.852  14.850

  No H/Q in entry =           6
  In of MODEL   40
    1    H    ALA  51           H        ALA  51  -5.734  -5.890  12.078
    2    HA   ALA  51           HA       ALA  51  -6.744  -7.598  10.051
    3    HB2  ALA  51           HB1      ALA  51  -6.498  -5.784   8.687
    4    HB1  ALA  51           HB2      ALA  51  -4.853  -5.461   9.236
    5    HB3  ALA  51           HB3      ALA  51  -6.230  -4.932  10.207

  No H/Q in entry =           5
  In of MODEL   40
    1    H    HIS  52           H        HIS  52  -3.441  -6.742  11.037
    2    HA   HIS  52           HA       HIS  52  -2.064  -8.246   9.083
    3    HB2  HIS  52           HB2      HIS  52  -1.023  -6.524  10.553
    4    HB3  HIS  52           HB3      HIS  52  -1.174  -7.636  11.912
    5    HD1  HIS  52           HD1      HIS  52   0.310  -9.795  11.866
    6    HD2  HIS  52           HD2      HIS  52   1.048  -7.150   8.729
    7    HE1  HIS  52           HE1      HIS  52   2.488 -10.532  10.805
    8    HE2  HIS  52           HE2      HIS  52   2.952  -8.929   8.890

  No H/Q in entry =           8
  In of MODEL   40
    1    H    LEU  53           H        LEU  53  -3.289  -9.115  12.293
    2    HA   LEU  53           HA       LEU  53  -2.130 -11.678  12.479
    3    HB2  LEU  53           HB2      LEU  53  -4.595 -10.460  13.697
    4    HB3  LEU  53           HB3      LEU  53  -4.166 -12.145  13.983
    5    HG   LEU  53           HG       LEU  53  -2.231  -9.858  14.472
    6   HD12  LEU  53          HD11      LEU  53  -2.822 -10.103  16.867
    7   HD11  LEU  53          HD12      LEU  53  -4.090 -11.245  16.424
    8   HD13  LEU  53          HD13      LEU  53  -4.199  -9.565  15.911
    9   HD22  LEU  53          HD21      LEU  53  -0.969 -11.846  14.433
   10   HD21  LEU  53          HD22      LEU  53  -2.287 -12.806  15.095
   11   HD23  LEU  53          HD23      LEU  53  -1.380 -11.729  16.140

  No H/Q in entry =          11
  In of MODEL   40
    1    H    VAL  54           H        VAL  54  -5.225 -10.596  11.120
    2    HA   VAL  54           HA       VAL  54  -6.179 -13.173  10.425
    3    HB   VAL  54           HB       VAL  54  -6.783 -10.427   9.298
    4   HG12  VAL  54          HG11      VAL  54  -8.906 -11.769   8.482
    5   HG11  VAL  54          HG12      VAL  54  -7.816 -13.153   8.550
    6   HG13  VAL  54          HG13      VAL  54  -7.435 -11.781   7.512
    7   HG22  VAL  54          HG21      VAL  54  -7.691 -10.457  11.450
    8   HG21  VAL  54          HG22      VAL  54  -7.972 -12.196  11.425
    9   HG23  VAL  54          HG23      VAL  54  -9.036 -11.120  10.522

  No H/Q in entry =           9
  In of MODEL   40
    1    H    GLN  55           H        GLN  55  -4.269 -10.747   8.643
    2    HA   GLN  55           HA       GLN  55  -4.161 -12.205   6.221
    3    HB2  GLN  55           HB2      GLN  55  -3.521  -9.950   6.038
    4    HB3  GLN  55           HB3      GLN  55  -2.412 -10.049   7.403
    5    HG2  GLN  55           HG2      GLN  55  -0.708 -10.918   6.125
    6    HG3  GLN  55           HG3      GLN  55  -1.798 -11.873   5.128
    7   HE21  GLN  55          HE21      GLN  55  -1.803 -11.176   3.008
    8   HE22  GLN  55          HE22      GLN  55  -1.579  -9.573   2.503

  No H/Q in entry =           8
  In of MODEL   40
    1    H    THR  56           H        THR  56  -2.056 -12.227   9.102
    2    HA   THR  56           HA       THR  56  -0.004 -13.856   8.180
    3    HB   THR  56           HB       THR  56  -1.248 -14.102  10.927
    4    HG1  THR  56           HG1      THR  56  -0.165 -11.976   9.700
    5   HG23  THR  56          HG21      THR  56   0.839 -14.906  11.620
    6   HG22  THR  56          HG22      THR  56   1.672 -14.215  10.227
    7   HG21  THR  56          HG23      THR  56   0.657 -15.644  10.029

  No H/Q in entry =           7
  In of MODEL   40
    1    H    LYS  57           H        LYS  57  -3.140 -14.846   9.540
    2    HA   LYS  57           HA       LYS  57  -2.740 -17.648   9.286
    3    HB2  LYS  57           HB2      LYS  57  -4.546 -16.489  10.622
    4    HB3  LYS  57           HB3      LYS  57  -5.341 -16.096   9.105
    5    HG2  LYS  57           HG2      LYS  57  -4.628 -18.951   9.520
    6    HG3  LYS  57           HG3      LYS  57  -5.926 -18.313  10.525
    7    HD2  LYS  57           HD2      LYS  57  -7.102 -17.521   8.488
    8    HD3  LYS  57           HD3      LYS  57  -5.818 -18.205   7.491
    9    HE2  LYS  57           HE2      LYS  57  -6.322 -20.457   8.363
   10    HE3  LYS  57           HE3      LYS  57  -7.588 -19.796   9.395
   11    HZ1  LYS  57           HZ1      LYS  57  -8.630 -18.925   7.315
   12    HZ3  LYS  57           HZ2      LYS  57  -8.625 -20.617   7.464
   13    HZ2  LYS  57           HZ3      LYS  57  -7.511 -19.850   6.436

  No H/Q in entry =          13
  In of MODEL   40
    1    H    LEU  58           H        LEU  58  -4.031 -15.177   7.117
    2    HA   LEU  58           HA       LEU  58  -4.863 -16.983   5.105
    3    HB2  LEU  58           HB2      LEU  58  -4.207 -14.044   4.979
    4    HB3  LEU  58           HB3      LEU  58  -4.886 -14.966   3.636
    5    HG   LEU  58           HG       LEU  58  -6.163 -14.774   6.384
    6   HD11  LEU  58          HD11      LEU  58  -6.435 -13.114   3.897
    7   HD13  LEU  58          HD12      LEU  58  -6.417 -12.612   5.587
    8   HD12  LEU  58          HD13      LEU  58  -7.853 -13.380   4.913
    9   HD22  LEU  58          HD21      LEU  58  -7.157 -16.664   5.508
   10   HD21  LEU  58          HD22      LEU  58  -6.810 -16.213   3.839
   11   HD23  LEU  58          HD23      LEU  58  -8.161 -15.467   4.692

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  59           H        ILE  59  -1.708 -15.827   5.971
    2    HA   ILE  59           HA       ILE  59  -0.621 -16.565   3.332
    3    HB   ILE  59           HB       ILE  59   0.181 -14.516   4.903
    4   HG12  ILE  59          HG12      ILE  59   2.254 -16.200   3.483
    5   HG13  ILE  59          HG13      ILE  59   1.072 -15.250   2.618
    6   HG22  ILE  59          HG21      ILE  59   2.221 -16.608   5.612
    7   HG21  ILE  59          HG22      ILE  59   0.872 -16.293   6.680
    8   HG23  ILE  59          HG23      ILE  59   2.022 -15.012   6.296
    9   HD12  ILE  59          HD11      ILE  59   3.182 -14.001   2.916
   10   HD11  ILE  59          HD12      ILE  59   3.006 -14.154   4.663
   11   HD13  ILE  59          HD13      ILE  59   1.841 -13.206   3.738

  No H/Q in entry =          11
  In of MODEL   40
    1    H    GLU  60           H        GLU  60  -0.652 -17.680   6.697
    2    HA   GLU  60           HA       GLU  60   1.346 -19.691   6.427
    3    HB2  GLU  60           HB2      GLU  60   0.852 -19.209   8.646
    4    HB3  GLU  60           HB3      GLU  60  -0.886 -19.157   8.355
    5    HG2  GLU  60           HG2      GLU  60  -0.048 -21.197   9.637
    6    HG3  GLU  60           HG3      GLU  60  -1.022 -21.547   8.211

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLY  61           H        GLY  61  -2.166 -19.729   5.939
    2    HA3  GLY  61           HA2      GLY  61  -1.964 -22.523   4.973
    3    HA2  GLY  61           HA3      GLY  61  -3.437 -21.764   5.568

  No H/Q in entry =           3
  In of MODEL   40
    1    H    ASP  62           H        ASP  62  -1.181 -20.216   3.371
    2    HA   ASP  62           HA       ASP  62  -3.148 -19.407   1.549
    3    HB2  ASP  62           HB2      ASP  62  -0.806 -18.467   1.897
    4    HB3  ASP  62           HB3      ASP  62  -0.226 -19.798   0.901

  No H/Q in entry =           4
  In of MODEL   40
    1    H    ALA  63           H        ALA  63  -4.279 -21.590   1.318
    2    HA   ALA  63           HA       ALA  63  -3.085 -23.700  -0.190
    3    HB1  ALA  63           HB1      ALA  63  -5.418 -24.459  -0.532
    4    HB3  ALA  63           HB2      ALA  63  -5.982 -22.962   0.210
    5    HB2  ALA  63           HB3      ALA  63  -5.048 -24.119   1.160

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLY  64           H        GLY  64  -5.024 -20.863  -1.023
    2    HA3  GLY  64           HA2      GLY  64  -5.134 -19.677  -3.008
    3    HA2  GLY  64           HA3      GLY  64  -3.992 -20.808  -3.716

  No H/Q in entry =           3
  In of MODEL   40
    1    H    GLU  65           H        GLU  65  -5.815 -20.141  -5.449
    2    HA   GLU  65           HA       GLU  65  -8.310 -21.446  -5.291
    3    HB2  GLU  65           HB2      GLU  65  -6.725 -20.480  -7.669
    4    HB3  GLU  65           HB3      GLU  65  -8.372 -21.103  -7.776
    5    HG2  GLU  65           HG2      GLU  65  -9.160 -19.376  -6.234
    6    HG3  GLU  65           HG3      GLU  65  -7.515 -18.780  -6.027

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLY  66           H        GLY  66  -5.258 -22.423  -6.668
    2    HA3  GLY  66           HA2      GLY  66  -6.300 -25.081  -7.359
    3    HA2  GLY  66           HA3      GLY  66  -4.837 -24.360  -8.001

  No H/Q in entry =           3
  In of MODEL   40
    1    H    LYS  67           H        LYS  67  -4.048 -26.544  -7.446
    2    HA   LYS  67           HA       LYS  67  -3.825 -27.560  -4.876
    3    HB2  LYS  67           HB2      LYS  67  -2.053 -27.911  -7.290
    4    HB3  LYS  67           HB3      LYS  67  -1.915 -28.880  -5.817
    5    HG2  LYS  67           HG2      LYS  67  -4.270 -29.564  -6.028
    6    HG3  LYS  67           HG3      LYS  67  -4.434 -28.583  -7.483
    7    HD2  LYS  67           HD2      LYS  67  -2.680 -29.964  -8.580
    8    HD3  LYS  67           HD3      LYS  67  -2.607 -30.977  -7.137
    9    HE2  LYS  67           HE2      LYS  67  -5.127 -30.501  -8.750
   10    HE3  LYS  67           HE3      LYS  67  -4.094 -31.917  -8.925
   11    HZ2  LYS  67           HZ1      LYS  67  -5.858 -31.161  -6.718
   12    HZ1  LYS  67           HZ2      LYS  67  -4.434 -32.007  -6.341
   13    HZ3  LYS  67           HZ3      LYS  67  -5.573 -32.686  -7.402

  No H/Q in entry =          13
  In of MODEL   40
    1    H    MET  68           H        MET  68  -0.762 -26.991  -6.279
    2    HA   MET  68           HA       MET  68   0.481 -26.177  -3.884
    3    HB2  MET  68           HB2      MET  68   1.340 -26.223  -6.764
    4    HB3  MET  68           HB3      MET  68   2.407 -25.640  -5.485
    5    HG2  MET  68           HG2      MET  68   2.191 -27.775  -4.299
    6    HG3  MET  68           HG3      MET  68   1.073 -28.364  -5.531
    7    HE1  MET  68           HE1      MET  68   4.375 -27.140  -4.521
    8    HE3  MET  68           HE2      MET  68   4.559 -26.243  -6.028
    9    HE2  MET  68           HE3      MET  68   5.555 -27.667  -5.730

  No H/Q in entry =           9
  In of MODEL   40
    1    H    LYS  69           H        LYS  69  -0.581 -24.278  -6.701
    2    HA   LYS  69           HA       LYS  69   0.640 -21.899  -6.327
    3    HB2  LYS  69           HB2      LYS  69  -2.207 -22.379  -7.149
    4    HB3  LYS  69           HB3      LYS  69  -1.418 -20.799  -7.242
    5    HG2  LYS  69           HG2      LYS  69   0.373 -21.767  -8.632
    6    HG3  LYS  69           HG3      LYS  69  -0.414 -23.343  -8.550
    7    HD2  LYS  69           HD2      LYS  69  -2.405 -22.418  -9.665
    8    HD3  LYS  69           HD3      LYS  69  -1.632 -20.833  -9.736
    9    HE2  LYS  69           HE2      LYS  69   0.187 -21.767 -11.109
   10    HE3  LYS  69           HE3      LYS  69  -0.566 -23.360 -11.029
   11    HZ2  LYS  69           HZ1      LYS  69  -1.028 -21.523 -12.947
   12    HZ1  LYS  69           HZ2      LYS  69  -2.342 -21.269 -11.900
   13    HZ3  LYS  69           HZ3      LYS  69  -2.066 -22.808 -12.564

  No H/Q in entry =          13
  In of MODEL   40
    1    H    VAL  70           H        VAL  70  -0.935 -19.790  -5.815
    2    HA   VAL  70           HA       VAL  70  -1.757 -20.022  -2.979
    3    HB   VAL  70           HB       VAL  70  -0.691 -17.779  -2.612
    4   HG11  VAL  70          HG11      VAL  70   1.087 -20.063  -3.508
    5   HG13  VAL  70          HG12      VAL  70   0.495 -19.756  -1.875
    6   HG12  VAL  70          HG13      VAL  70   1.666 -18.661  -2.608
    7   HG22  VAL  70          HG21      VAL  70   0.850 -16.866  -4.249
    8   HG21  VAL  70          HG22      VAL  70  -0.671 -17.180  -5.080
    9   HG23  VAL  70          HG23      VAL  70   0.683 -18.289  -5.279

  No H/Q in entry =           9
  In of MODEL   40
    1    H    SER  71           H        SER  71  -3.141 -18.255  -2.286
    2    HA   SER  71           HA       SER  71  -5.222 -17.651  -4.152
    3    HB2  SER  71           HB2      SER  71  -5.530 -17.896  -1.646
    4    HB3  SER  71           HB3      SER  71  -4.713 -16.348  -1.455
    5    HG   SER  71           HG       SER  71  -7.165 -16.930  -2.737

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU  72           H        LEU  72  -5.381 -16.004  -5.514
    2    HA   LEU  72           HA       LEU  72  -3.244 -14.224  -5.991
    3    HB2  LEU  72           HB2      LEU  72  -6.110 -14.230  -6.935
    4    HB3  LEU  72           HB3      LEU  72  -4.896 -13.090  -7.508
    5    HG   LEU  72           HG       LEU  72  -4.529 -16.100  -7.647
    6   HD13  LEU  72          HD11      LEU  72  -5.202 -15.964  -9.978
    7   HD12  LEU  72          HD12      LEU  72  -5.414 -14.218  -9.853
    8   HD11  LEU  72          HD13      LEU  72  -6.499 -15.303  -8.983
    9   HD23  LEU  72          HD21      LEU  72  -2.958 -15.262  -9.560
   10   HD22  LEU  72          HD22      LEU  72  -2.392 -15.093  -7.907
   11   HD21  LEU  72          HD23      LEU  72  -3.060 -13.701  -8.753

  No H/Q in entry =          11
  In of MODEL   40
    1    H    VAL  73           H        VAL  73  -6.331 -13.824  -4.358
    2    HA   VAL  73           HA       VAL  73  -6.332 -11.054  -3.997
    3    HB   VAL  73           HB       VAL  73  -8.041 -11.398  -2.388
    4   HG13  VAL  73          HG11      VAL  73  -9.495 -13.012  -3.540
    5   HG12  VAL  73          HG12      VAL  73  -8.096 -13.693  -4.369
    6   HG11  VAL  73          HG13      VAL  73  -8.603 -12.038  -4.711
    7   HG21  VAL  73          HG21      VAL  73  -6.650 -14.030  -2.014
    8   HG23  VAL  73          HG22      VAL  73  -8.378 -13.926  -1.676
    9   HG22  VAL  73          HG23      VAL  73  -7.245 -12.900  -0.797

  No H/Q in entry =           9
  In of MODEL   40
    1    H    LEU  74           H        LEU  74  -4.431 -13.458  -2.423
    2    HA   LEU  74           HA       LEU  74  -4.000 -12.333   0.103
    3    HB2  LEU  74           HB2      LEU  74  -3.251 -14.561  -0.406
    4    HB3  LEU  74           HB3      LEU  74  -2.187 -13.960  -1.677
    5    HG   LEU  74           HG       LEU  74  -0.907 -12.691   0.054
    6   HD12  LEU  74          HD11      LEU  74  -1.352 -13.579   2.452
    7   HD11  LEU  74          HD12      LEU  74  -2.940 -14.038   1.834
    8   HD13  LEU  74          HD13      LEU  74  -2.443 -12.345   1.822
    9   HD22  LEU  74          HD21      LEU  74   0.351 -14.544   0.644
   10   HD21  LEU  74          HD22      LEU  74  -0.579 -15.148  -0.708
   11   HD23  LEU  74          HD23      LEU  74  -1.071 -15.548   0.920

  No H/Q in entry =          11
  In of MODEL   40
    1    H    VAL  75           H        VAL  75  -2.105 -11.958  -2.854
    2    HA   VAL  75           HA       VAL  75  -0.277 -10.066  -1.838
    3    HB   VAL  75           HB       VAL  75  -1.241 -10.537  -4.660
    4   HG13  VAL  75          HG11      VAL  75  -0.367  -8.239  -4.462
    5   HG12  VAL  75          HG12      VAL  75   0.817  -9.245  -5.282
    6   HG11  VAL  75          HG13      VAL  75   1.042  -8.833  -3.589
    7   HG22  VAL  75          HG21      VAL  75   0.918 -11.707  -4.858
    8   HG21  VAL  75          HG22      VAL  75  -0.034 -12.407  -3.547
    9   HG23  VAL  75          HG23      VAL  75   1.300 -11.312  -3.181

  No H/Q in entry =           9
  In of MODEL   40
    1    H    GLU  76           H        GLU  76  -3.423  -9.663  -3.492
    2    HA   GLU  76           HA       GLU  76  -3.431  -6.848  -3.583
    3    HB2  GLU  76           HB2      GLU  76  -5.112  -8.268  -4.746
    4    HB3  GLU  76           HB3      GLU  76  -5.778  -8.742  -3.191
    5    HG2  GLU  76           HG2      GLU  76  -7.199  -7.008  -4.066
    6    HG3  GLU  76           HG3      GLU  76  -6.288  -6.292  -2.752

  No H/Q in entry =           6
  In of MODEL   40
    1    H    ALA  77           H        ALA  77  -4.574  -9.068  -1.050
    2    HA   ALA  77           HA       ALA  77  -5.498  -7.058   0.717
    3    HB2  ALA  77           HB1      ALA  77  -5.848  -9.640   0.777
    4    HB3  ALA  77           HB2      ALA  77  -5.742  -8.757   2.298
    5    HB1  ALA  77           HB3      ALA  77  -4.346  -9.653   1.702

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLN  78           H        GLN  78  -2.376  -8.655   0.344
    2    HA   GLN  78           HA       GLN  78  -1.098  -7.523   2.597
    3    HB2  GLN  78           HB2      GLN  78  -0.268  -9.473   1.236
    4    HB3  GLN  78           HB3      GLN  78   0.182  -8.331  -0.028
    5    HG2  GLN  78           HG2      GLN  78   1.668  -7.163   1.547
    6    HG3  GLN  78           HG3      GLN  78   1.216  -8.293   2.821
    7   HE21  GLN  78          HE21      GLN  78   3.940  -8.079   1.993
    8   HE22  GLN  78          HE22      GLN  78   4.376  -9.516   1.202

  No H/Q in entry =           8
  In of MODEL   40
    1    H    LEU  79           H        LEU  79  -1.450  -6.444  -0.746
    2    HA   LEU  79           HA       LEU  79   0.272  -4.245  -0.726
    3    HB2  LEU  79           HB2      LEU  79  -0.769  -5.027  -2.781
    4    HB3  LEU  79           HB3      LEU  79  -2.366  -4.612  -2.170
    5    HG   LEU  79           HG       LEU  79  -1.782  -2.234  -2.136
    6   HD13  LEU  79          HD11      LEU  79   0.462  -2.029  -1.625
    7   HD12  LEU  79          HD12      LEU  79   0.515  -1.736  -3.363
    8   HD11  LEU  79          HD13      LEU  79   0.943  -3.324  -2.723
    9   HD23  LEU  79          HD21      LEU  79  -1.147  -2.036  -4.688
   10   HD22  LEU  79          HD22      LEU  79  -2.685  -2.760  -4.230
   11   HD21  LEU  79          HD23      LEU  79  -1.330  -3.790  -4.680

  No H/Q in entry =          11
  In of MODEL   40
    1    H    HIS  80           H        HIS  80  -3.196  -4.353   0.103
    2    HA   HIS  80           HA       HIS  80  -3.340  -1.596   0.777
    3    HB2  HIS  80           HB2      HIS  80  -5.082  -3.977   1.088
    4    HB3  HIS  80           HB3      HIS  80  -5.379  -2.636   2.198
    5    HD1  HIS  80           HD1      HIS  80  -6.969  -0.969   1.298
    6    HD2  HIS  80           HD2      HIS  80  -4.810  -2.807  -1.759
    7    HE1  HIS  80           HE1      HIS  80  -7.794   0.050  -0.877
    8    HE2  HIS  80           HE2      HIS  80  -6.484  -1.064  -2.749

  No H/Q in entry =           8
  In of MODEL   40
    1    H    LEU  81           H        LEU  81  -2.899  -4.506   2.759
    2    HA   LEU  81           HA       LEU  81  -2.862  -3.169   5.248
    3    HB2  LEU  81           HB2      LEU  81  -1.689  -5.802   4.358
    4    HB3  LEU  81           HB3      LEU  81  -1.652  -5.250   6.034
    5    HG   LEU  81           HG       LEU  81  -4.203  -5.453   4.407
    6   HD12  LEU  81          HD11      LEU  81  -4.539  -7.519   5.947
    7   HD11  LEU  81          HD12      LEU  81  -2.786  -7.479   6.132
    8   HD13  LEU  81          HD13      LEU  81  -3.500  -7.691   4.533
    9   HD23  LEU  81          HD21      LEU  81  -5.047  -5.651   6.908
   10   HD22  LEU  81          HD22      LEU  81  -4.696  -4.065   6.224
   11   HD21  LEU  81          HD23      LEU  81  -3.521  -4.850   7.280

  No H/Q in entry =          11
  In of MODEL   40
    1    H    MET  82           H        MET  82  -0.198  -4.110   3.072
    2    HA   MET  82           HA       MET  82   1.901  -3.259   4.757
    3    HB2  MET  82           HB2      MET  82   1.678  -3.585   1.763
    4    HB3  MET  82           HB3      MET  82   3.170  -3.044   2.528
    5    HG2  MET  82           HG2      MET  82   1.719  -5.611   3.244
    6    HG3  MET  82           HG3      MET  82   3.091  -5.521   2.143
    7    HE3  MET  82           HE1      MET  82   6.121  -4.845   4.126
    8    HE2  MET  82           HE2      MET  82   5.222  -3.460   3.514
    9    HE1  MET  82           HE3      MET  82   5.283  -4.948   2.573

  No H/Q in entry =           9
  In of MODEL   40
    1    H    THR  83           H        THR  83   0.106  -1.576   2.208
    2    HA   THR  83           HA       THR  83   1.562   0.847   2.302
    3    HB   THR  83           HB       THR  83  -0.599   1.814   1.321
    4    HG1  THR  83           HG1      THR  83  -2.272   0.547   1.211
    5   HG22  THR  83          HG21      THR  83  -0.363  -0.001  -0.686
    6   HG21  THR  83          HG22      THR  83   1.133  -0.323   0.188
    7   HG23  THR  83          HG23      THR  83   0.800   1.298  -0.421

  No H/Q in entry =           7
  In of MODEL   40
    1    H    SER  84           H        SER  84  -1.461  -0.137   3.902
    2    HA   SER  84           HA       SER  84  -1.912   2.296   5.256
    3    HB2  SER  84           HB2      SER  84  -2.795  -0.528   5.811
    4    HB3  SER  84           HB3      SER  84  -3.263   0.818   6.849
    5    HG   SER  84           HG       SER  84  -3.730   0.522   4.057

  No H/Q in entry =           5
  In of MODEL   40
    1    H    MET  85           H        MET  85  -0.254  -0.670   6.373
    2    HA   MET  85           HA       MET  85   0.285   0.238   8.980
    3    HB2  MET  85           HB2      MET  85   0.534  -2.109   8.292
    4    HB3  MET  85           HB3      MET  85   1.925  -1.665   7.302
    5    HG2  MET  85           HG2      MET  85   3.117  -0.869   9.301
    6    HG3  MET  85           HG3      MET  85   1.717  -1.258  10.299
    7    HE1  MET  85           HE1      MET  85   4.119  -2.308   7.771
    8    HE3  MET  85           HE2      MET  85   4.355  -4.051   7.892
    9    HE2  MET  85           HE3      MET  85   5.171  -2.978   9.024

  No H/Q in entry =           9
  In of MODEL   40
    1    H    LEU  86           H        LEU  86   2.221   0.468   6.028
    2    HA   LEU  86           HA       LEU  86   4.460   1.734   7.186
    3    HB2  LEU  86           HB2      LEU  86   4.246   0.664   4.873
    4    HB3  LEU  86           HB3      LEU  86   3.465   2.161   4.367
    5    HG   LEU  86           HG       LEU  86   5.516   3.367   5.349
    6   HD11  LEU  86          HD11      LEU  86   6.174   0.740   6.139
    7   HD13  LEU  86          HD12      LEU  86   7.204   2.166   6.241
    8   HD12  LEU  86          HD13      LEU  86   7.293   1.121   4.825
    9   HD23  LEU  86          HD21      LEU  86   6.198   1.599   2.992
   10   HD22  LEU  86          HD22      LEU  86   6.623   3.288   3.259
   11   HD21  LEU  86          HD23      LEU  86   4.962   2.852   2.861

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ALA  87           H        ALA  87   1.569   3.037   5.609
    2    HA   ALA  87           HA       ALA  87   2.213   5.755   5.701
    3    HB1  ALA  87           HB1      ALA  87  -0.126   4.172   5.157
    4    HB3  ALA  87           HB2      ALA  87   0.215   5.828   4.662
    5    HB2  ALA  87           HB3      ALA  87  -0.583   5.516   6.205

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ARG  88           H        ARG  88   0.490   3.777   8.086
    2    HA   ARG  88           HA       ARG  88   0.018   5.829   9.940
    3    HB2  ARG  88           HB2      ARG  88  -0.964   3.494  10.000
    4    HB3  ARG  88           HB3      ARG  88   0.568   2.963  10.703
    5    HG2  ARG  88           HG2      ARG  88   0.132   5.040  12.330
    6    HG3  ARG  88           HG3      ARG  88  -1.541   4.748  11.875
    7    HD2  ARG  88           HD2      ARG  88  -1.681   2.897  13.115
    8    HD3  ARG  88           HD3      ARG  88  -0.103   2.288  12.580
    9    HE   ARG  88           HE       ARG  88  -0.611   3.552  15.039
   10   HH21  ARG  88          HH11      ARG  88   0.967   4.531  16.279
   11   HH22  ARG  88          HH12      ARG  88   2.493   4.933  15.574
   12   HH11  ARG  88          HH21      ARG  88   1.670   3.700  12.460
   13   HH12  ARG  88          HH22      ARG  88   2.899   4.446  13.424

  No H/Q in entry =          13
  In of MODEL   40
    1    H    GLU  89           H        GLU  89   2.773   3.560   9.707
    2    HA   GLU  89           HA       GLU  89   4.053   4.418  12.052
    3    HB2  GLU  89           HB2      GLU  89   4.673   2.393  10.701
    4    HB3  GLU  89           HB3      GLU  89   5.468   3.476   9.557
    5    HG2  GLU  89           HG2      GLU  89   6.970   4.290  11.302
    6    HG3  GLU  89           HG3      GLU  89   6.119   3.345  12.520

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LEU  90           H        LEU  90   4.387   5.581   8.728
    2    HA   LEU  90           HA       LEU  90   6.354   7.544   9.318
    3    HB2  LEU  90           HB2      LEU  90   4.340   7.256   7.091
    4    HB3  LEU  90           HB3      LEU  90   5.593   8.504   7.115
    5    HG   LEU  90           HG       LEU  90   6.214   5.555   7.439
    6   HD12  LEU  90          HD11      LEU  90   6.964   5.783   4.999
    7   HD11  LEU  90          HD12      LEU  90   5.975   7.242   4.956
    8   HD13  LEU  90          HD13      LEU  90   5.227   5.681   5.295
    9   HD22  LEU  90          HD21      LEU  90   8.132   6.669   8.123
   10   HD21  LEU  90          HD22      LEU  90   7.806   8.083   7.121
   11   HD23  LEU  90          HD23      LEU  90   8.439   6.609   6.388

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  91           H        ILE  91   2.815   7.623   9.172
    2    HA   ILE  91           HA       ILE  91   2.522  10.399   9.632
    3    HB   ILE  91           HB       ILE  91   0.690   8.054  10.169
    4   HG12  ILE  91          HG12      ILE  91   0.480  10.345   8.192
    5   HG13  ILE  91          HG13      ILE  91   1.313   8.837   7.814
    6   HG22  ILE  91          HG21      ILE  91  -1.006  10.141  10.241
    7   HG21  ILE  91          HG22      ILE  91   0.410  10.945  10.915
    8   HG23  ILE  91          HG23      ILE  91  -0.251   9.516  11.708
    9   HD13  ILE  91          HD11      ILE  91  -0.653   7.584   7.856
   10   HD12  ILE  91          HD12      ILE  91  -1.216   9.111   7.180
   11   HD11  ILE  91          HD13      ILE  91  -1.492   8.746   8.884

  No H/Q in entry =          11
  In of MODEL   40
    1    H    THR  92           H        THR  92   2.880   7.644  11.825
    2    HA   THR  92           HA       THR  92   2.462   9.018  14.253
    3    HB   THR  92           HB       THR  92   4.230   6.655  13.579
    4    HG1  THR  92           HG1      THR  92   2.249   5.931  13.478
    5   HG22  THR  92          HG21      THR  92   3.844   6.369  16.213
    6   HG21  THR  92          HG22      THR  92   3.809   8.129  16.145
    7   HG23  THR  92          HG23      THR  92   5.227   7.251  15.568

  No H/Q in entry =           7
  In of MODEL   40
    1    H    GLU  93           H        GLU  93   5.404   8.525  12.316
    2    HA   GLU  93           HA       GLU  93   7.182   9.918  14.015
    3    HB2  GLU  93           HB2      GLU  93   7.263   9.611  10.999
    4    HB3  GLU  93           HB3      GLU  93   8.613  10.116  12.014
    5    HG2  GLU  93           HG2      GLU  93   7.161   7.501  12.455
    6    HG3  GLU  93           HG3      GLU  93   8.546   7.634  11.378

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LEU  94           H        LEU  94   5.149  10.974  11.307
    2    HA   LEU  94           HA       LEU  94   5.998  13.665  11.214
    3    HB2  LEU  94           HB2      LEU  94   3.385  12.344  10.458
    4    HB3  LEU  94           HB3      LEU  94   3.671  14.068  10.222
    5    HG   LEU  94           HG       LEU  94   5.655  12.051   9.164
    6   HD11  LEU  94          HD11      LEU  94   2.922  12.649   8.106
    7   HD13  LEU  94          HD12      LEU  94   3.881  11.177   7.975
    8   HD12  LEU  94          HD13      LEU  94   4.238  12.555   6.934
    9   HD23  LEU  94          HD21      LEU  94   5.934  13.888   7.447
   10   HD22  LEU  94          HD22      LEU  94   6.357  14.369   9.090
   11   HD21  LEU  94          HD23      LEU  94   4.814  14.864   8.394

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  95           H        ILE  95   3.435  12.084  13.103
    2    HA   ILE  95           HA       ILE  95   2.431  14.446  14.305
    3    HB   ILE  95           HB       ILE  95   2.403  11.562  15.222
    4   HG12  ILE  95          HG12      ILE  95   0.210  13.373  14.179
    5   HG13  ILE  95          HG13      ILE  95   1.149  12.302  13.143
    6   HG21  ILE  95          HG21      ILE  95   1.160  14.051  16.431
    7   HG23  ILE  95          HG22      ILE  95   2.190  12.863  17.231
    8   HG22  ILE  95          HG23      ILE  95   0.548  12.429  16.756
    9   HD13  ILE  95          HD11      ILE  95   0.216  10.375  14.057
   10   HD12  ILE  95          HD12      ILE  95  -1.149  11.486  14.137
   11   HD11  ILE  95          HD13      ILE  95  -0.188  11.168  15.581

  No H/Q in entry =          11
  In of MODEL   40
    1    H    GLU  96           H        GLU  96   4.992  12.184  15.293
    2    HA   GLU  96           HA       GLU  96   5.566  13.367  17.788
    3    HB2  GLU  96           HB2      GLU  96   6.481  11.196  17.133
    4    HB3  GLU  96           HB3      GLU  96   7.425  11.958  15.855
    5    HG2  GLU  96           HG2      GLU  96   9.083  12.477  17.318
    6    HG3  GLU  96           HG3      GLU  96   7.949  13.305  18.376

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LEU  97           H        LEU  97   6.651  14.132  14.503
    2    HA   LEU  97           HA       LEU  97   8.567  16.098  15.220
    3    HB2  LEU  97           HB2      LEU  97   6.966  15.580  12.724
    4    HB3  LEU  97           HB3      LEU  97   8.007  16.995  12.849
    5    HG   LEU  97           HG       LEU  97   8.995  14.181  13.401
    6   HD12  LEU  97          HD11      LEU  97   9.993  14.367  11.084
    7   HD11  LEU  97          HD12      LEU  97   8.962  15.773  10.824
    8   HD13  LEU  97          HD13      LEU  97   8.239  14.191  11.115
    9   HD23  LEU  97          HD21      LEU  97  11.182  15.429  12.660
   10   HD22  LEU  97          HD22      LEU  97  10.568  15.704  14.290
   11   HD21  LEU  97          HD23      LEU  97  10.271  16.895  13.026

  No H/Q in entry =          11
  In of MODEL   40
    1    H    HIS  98           H        HIS  98   5.078  16.287  14.568
    2    HA   HIS  98           HA       HIS  98   4.820  19.090  14.711
    3    HB2  HIS  98           HB2      HIS  98   2.897  16.865  15.431
    4    HB3  HIS  98           HB3      HIS  98   2.455  18.572  15.492
    5    HD1  HIS  98           HD1      HIS  98   3.436  15.849  13.079
    6    HD2  HIS  98           HD2      HIS  98   2.117  19.803  12.969
    7    HE1  HIS  98           HE1      HIS  98   2.883  16.353  10.657
    8    HE2  HIS  98           HE2      HIS  98   2.083  18.755  10.568

  No H/Q in entry =           8
  In of MODEL   40
    1    H    GLU  99           H        GLU  99   4.918  16.593  17.203
    2    HA   GLU  99           HA       GLU  99   4.335  18.290  19.406
    3    HB2  GLU  99           HB2      GLU  99   4.210  15.809  19.496
    4    HB3  GLU  99           HB3      GLU  99   5.969  15.739  19.387
    5    HG2  GLU  99           HG2      GLU  99   6.178  17.022  21.464
    6    HG3  GLU  99           HG3      GLU  99   4.428  17.188  21.561

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LYS 100           H        LYS 100   7.375  17.319  17.837
    2    HA   LYS 100           HA       LYS 100   9.051  18.690  19.696
    3    HB2  LYS 100           HB2      LYS 100   9.535  17.766  16.855
    4    HB3  LYS 100           HB3      LYS 100  10.776  18.515  17.865
    5    HG2  LYS 100           HG2      LYS 100  10.375  16.765  19.601
    6    HG3  LYS 100           HG3      LYS 100   9.231  15.981  18.508
    7    HD2  LYS 100           HD2      LYS 100  11.020  15.677  16.839
    8    HD3  LYS 100           HD3      LYS 100  12.169  16.473  17.917
    9    HE2  LYS 100           HE2      LYS 100  11.748  14.719  19.630
   10    HE3  LYS 100           HE3      LYS 100  10.660  13.902  18.503
   11    HZ1  LYS 100           HZ1      LYS 100  13.490  14.532  17.848
   12    HZ3  LYS 100           HZ2      LYS 100  12.431  13.495  17.018
   13    HZ2  LYS 100           HZ3      LYS 100  13.014  13.063  18.555

  No H/Q in entry =          13
  In of MODEL   40
    1    H    LEU 101           H        LEU 101   7.369  19.650  16.745
    2    HA   LEU 101           HA       LEU 101   8.620  22.190  16.416
    3    HB2  LEU 101           HB2      LEU 101   6.007  20.997  15.527
    4    HB3  LEU 101           HB3      LEU 101   6.283  22.725  15.325
    5    HG   LEU 101           HG       LEU 101   8.289  20.682  14.352
    6   HD12  LEU 101          HD11      LEU 101   7.142  21.211  12.069
    7   HD11  LEU 101          HD12      LEU 101   5.750  21.659  13.052
    8   HD13  LEU 101          HD13      LEU 101   6.390  20.018  13.128
    9   HD21  LEU 101          HD21      LEU 101   7.704  23.604  13.805
   10   HD23  LEU 101          HD22      LEU 101   8.670  22.633  12.695
   11   HD22  LEU 101          HD23      LEU 101   9.216  22.878  14.354

  No H/Q in entry =          11
  In of MODEL   40
    1    H    LYS 102           H        LYS 102   7.068  21.067  19.029
    2    HA   LYS 102           HA       LYS 102   6.453  22.162  20.965
    3    HB2  LYS 102           HB2      LYS 102   7.764  24.136  19.846
    4    HB3  LYS 102           HB3      LYS 102   6.174  24.766  19.473
    5    HG2  LYS 102           HG2      LYS 102   7.549  24.482  22.124
    6    HG3  LYS 102           HG3      LYS 102   6.616  25.826  21.499
    7    HD2  LYS 102           HD2      LYS 102   5.333  23.206  22.371
    8    HD3  LYS 102           HD3      LYS 102   5.603  24.560  23.458
    9    HE2  LYS 102           HE2      LYS 102   3.317  24.196  21.969
   10    HE3  LYS 102           HE3      LYS 102   3.843  25.732  22.655
   11    HZ2  LYS 102           HZ1      LYS 102   3.313  25.855  20.276
   12    HZ1  LYS 102           HZ2      LYS 102   4.558  24.755  19.949
   13    HZ3  LYS 102           HZ3      LYS 102   4.924  26.278  20.597

  No H/Q in entry =          13
  In of MODEL   40
    1    H    ALA 103           H        ALA 103   4.837  23.738  18.203
    2    HA   ALA 103           HA       ALA 103   2.392  24.348  19.092
    3    HB1  ALA 103           HB1      ALA 103   1.480  23.527  16.847
    4    HB2  ALA 103           HB2      ALA 103   3.119  22.966  16.515
    5    HB3  ALA 103           HB3      ALA 103   2.810  24.682  16.787

  No H/Q in entry =           5
  In of MODEL   40
    1    H1   ALA   1           H3       ALA   1  10.306 -20.199  -6.322
    2    H2   ALA   1           H2       ALA   1   9.338 -20.386  -7.708
    3    H3   ALA   1           H1       ALA   1   8.890 -21.130  -6.247
    4    HA   ALA   1           HA       ALA   1   9.901 -22.953  -6.993
    5    HB1  ALA   1           HB1      ALA   1  10.000 -22.588  -9.267
    6    HB2  ALA   1           HB2      ALA   1  11.730 -22.466  -8.939
    7    HB3  ALA   1           HB3      ALA   1  10.754 -21.003  -9.085

  No H/Q in entry =           7
  In of MODEL   40
    1    H    GLU   2           H        GLU   2  12.169 -23.939  -7.055
    2    HA   GLU   2           HA       GLU   2  13.554 -23.886  -4.844
    3    HB2  GLU   2           HB2      GLU   2  14.910 -23.767  -7.544
    4    HB3  GLU   2           HB3      GLU   2  15.629 -24.395  -6.062
    5    HG2  GLU   2           HG2      GLU   2  14.581 -26.394  -6.308
    6    HG3  GLU   2           HG3      GLU   2  13.021 -25.623  -6.563

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLU   3           H        GLU   3  15.352 -22.042  -7.242
    2    HA   GLU   3           HA       GLU   3  16.534 -20.380  -5.278
    3    HB2  GLU   3           HB2      GLU   3  16.475 -20.367  -8.288
    4    HB3  GLU   3           HB3      GLU   3  17.243 -19.053  -7.397
    5    HG2  GLU   3           HG2      GLU   3  18.884 -20.456  -6.480
    6    HG3  GLU   3           HG3      GLU   3  17.914 -21.907  -6.705

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LEU   4           H        LEU   4  14.263 -19.487  -7.904
    2    HA   LEU   4           HA       LEU   4  13.839 -16.873  -7.284
    3    HB2  LEU   4           HB2      LEU   4  11.632 -18.811  -8.018
    4    HB3  LEU   4           HB3      LEU   4  11.585 -17.060  -8.211
    5    HG   LEU   4           HG       LEU   4  13.518 -18.950  -9.592
    6   HD13  LEU   4          HD11      LEU   4  12.217 -18.775 -11.500
    7   HD12  LEU   4          HD12      LEU   4  11.534 -17.220 -11.027
    8   HD11  LEU   4          HD13      LEU   4  10.958 -18.704 -10.270
    9   HD23  LEU   4          HD21      LEU   4  13.889 -16.706 -10.937
   10   HD22  LEU   4          HD22      LEU   4  14.746 -16.967  -9.419
   11   HD21  LEU   4          HD23      LEU   4  13.309 -15.948  -9.453

  No H/Q in entry =          11
  In of MODEL   40
    1    H    GLU   5           H        GLU   5  12.311 -19.638  -5.649
    2    HA   GLU   5           HA       GLU   5  10.661 -18.046  -3.940
    3    HB2  GLU   5           HB2      GLU   5  10.183 -20.408  -4.459
    4    HB3  GLU   5           HB3      GLU   5  11.624 -20.880  -3.557
    5    HG2  GLU   5           HG2      GLU   5   9.519 -19.154  -2.275
    6    HG3  GLU   5           HG3      GLU   5   9.333 -20.907  -2.325

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLU   6           H        GLU   6  13.782 -19.677  -3.505
    2    HA   GLU   6           HA       GLU   6  14.151 -18.834  -0.804
    3    HB2  GLU   6           HB2      GLU   6  15.343 -20.766  -1.821
    4    HB3  GLU   6           HB3      GLU   6  16.236 -19.642  -2.848
    5    HG2  GLU   6           HG2      GLU   6  17.623 -20.135  -0.935
    6    HG3  GLU   6           HG3      GLU   6  17.028 -18.485  -0.749

  No H/Q in entry =           6
  In of MODEL   40
    1    H    VAL   7           H        VAL   7  14.934 -17.510  -3.951
    2    HA   VAL   7           HA       VAL   7  16.654 -15.413  -3.081
    3    HB   VAL   7           HB       VAL   7  14.940 -15.742  -5.558
    4   HG11  VAL   7          HG11      VAL   7  16.869 -13.561  -4.740
    5   HG13  VAL   7          HG12      VAL   7  15.228 -13.391  -5.362
    6   HG12  VAL   7          HG13      VAL   7  16.529 -13.910  -6.435
    7   HG21  VAL   7          HG21      VAL   7  17.025 -17.233  -4.996
    8   HG23  VAL   7          HG22      VAL   7  17.952 -15.785  -5.390
    9   HG22  VAL   7          HG23      VAL   7  16.903 -16.515  -6.603

  No H/Q in entry =           9
  In of MODEL   40
    1    H    VAL   8           H        VAL   8  13.157 -15.627  -3.635
    2    HA   VAL   8           HA       VAL   8  12.534 -12.910  -3.154
    3    HB   VAL   8           HB       VAL   8  10.885 -15.416  -2.729
    4   HG12  VAL   8          HG11      VAL   8   8.973 -13.676  -2.892
    5   HG11  VAL   8          HG12      VAL   8  10.207 -12.481  -2.494
    6   HG13  VAL   8          HG13      VAL   8   9.848 -13.786  -1.365
    7   HG23  VAL   8          HG21      VAL   8  10.247 -13.486  -4.902
    8   HG22  VAL   8          HG22      VAL   8  10.282 -15.245  -4.937
    9   HG21  VAL   8          HG23      VAL   8  11.779 -14.334  -5.099

  No H/Q in entry =           9
  In of MODEL   40
    1    H    MET   9           H        MET   9  12.760 -15.726  -0.984
    2    HA   MET   9           HA       MET   9  11.966 -14.450   1.392
    3    HB2  MET   9           HB2      MET   9  13.833 -16.753   0.839
    4    HB3  MET   9           HB3      MET   9  13.553 -16.171   2.480
    5    HG2  MET   9           HG2      MET   9  11.153 -16.562   2.252
    6    HG3  MET   9           HG3      MET   9  11.369 -17.042   0.567
    7    HE1  MET   9           HE1      MET   9  12.220 -17.481   4.118
    8    HE3  MET   9           HE2      MET   9  13.808 -18.130   3.714
    9    HE2  MET   9           HE3      MET   9  12.576 -19.191   4.391

  No H/Q in entry =           9
  In of MODEL   40
    1    H    GLY  10           H        GLY  10  15.142 -14.717  -0.169
    2    HA3  GLY  10           HA2      GLY  10  16.623 -13.324   1.804
    3    HA2  GLY  10           HA3      GLY  10  17.083 -13.491   0.110

  No H/Q in entry =           3
  In of MODEL   40
    1    H    LEU  11           H        LEU  11  14.931 -12.234  -1.124
    2    HA   LEU  11           HA       LEU  11  15.656  -9.500  -0.952
    3    HB2  LEU  11           HB2      LEU  11  13.267 -10.871  -2.190
    4    HB3  LEU  11           HB3      LEU  11  13.573  -9.141  -2.344
    5    HG   LEU  11           HG       LEU  11  15.569 -11.276  -3.140
    6   HD13  LEU  11          HD11      LEU  11  13.817 -11.613  -4.660
    7   HD12  LEU  11          HD12      LEU  11  14.836 -10.443  -5.497
    8   HD11  LEU  11          HD13      LEU  11  13.371  -9.906  -4.676
    9   HD22  LEU  11          HD21      LEU  11  16.829  -9.331  -2.910
   10   HD21  LEU  11          HD22      LEU  11  15.468  -8.273  -3.284
   11   HD23  LEU  11          HD23      LEU  11  16.286  -9.150  -4.576

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  12           H        ILE  12  12.863 -11.290   0.312
    2    HA   ILE  12           HA       ILE  12  11.502  -9.050   1.379
    3    HB   ILE  12           HB       ILE  12  11.499 -11.936   2.319
    4   HG12  ILE  12          HG12      ILE  12  10.818 -11.286  -0.126
    5   HG13  ILE  12          HG13      ILE  12   9.776 -12.363   0.785
    6   HG22  ILE  12          HG21      ILE  12   9.237 -11.331   3.251
    7   HG21  ILE  12          HG22      ILE  12   9.591  -9.642   2.888
    8   HG23  ILE  12          HG23      ILE  12  10.579 -10.518   4.057
    9   HD13  ILE  12          HD11      ILE  12   8.281 -10.526   1.298
   10   HD12  ILE  12          HD12      ILE  12   8.562 -10.548  -0.442
   11   HD11  ILE  12          HD13      ILE  12   9.384  -9.375   0.564

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  13           H        ILE  13  13.865 -11.292   2.776
    2    HA   ILE  13           HA       ILE  13  13.919 -10.121   5.360
    3    HB   ILE  13           HB       ILE  13  15.957 -11.716   3.788
    4   HG12  ILE  13          HG12      ILE  13  13.673 -12.662   4.618
    5   HG13  ILE  13          HG13      ILE  13  15.137 -13.599   4.904
    6   HG23  ILE  13          HG21      ILE  13  17.330 -10.580   5.326
    7   HG22  ILE  13          HG22      ILE  13  16.970 -12.089   6.155
    8   HG21  ILE  13          HG23      ILE  13  16.110 -10.613   6.597
    9   HD11  ILE  13          HD11      ILE  13  14.226 -11.638   7.003
   10   HD13  ILE  13          HD12      ILE  13  15.159 -13.120   7.183
   11   HD12  ILE  13          HD13      ILE  13  13.430 -13.204   6.872

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ASN  14           H        ASN  14  15.877  -9.607   2.442
    2    HA   ASN  14           HA       ASN  14  17.647  -7.691   3.508
    3    HB2  ASN  14           HB2      ASN  14  17.607  -8.950   1.189
    4    HB3  ASN  14           HB3      ASN  14  16.731  -7.520   0.657
    5   HD21  ASN  14          HD21      ASN  14  19.166  -7.886  -0.532
    6   HD22  ASN  14          HD22      ASN  14  20.323  -6.819   0.098

  No H/Q in entry =           6
  In of MODEL   40
    1    H    SER  15           H        SER  15  14.540  -7.300   1.819
    2    HA   SER  15           HA       SER  15  14.462  -4.479   1.884
    3    HB2  SER  15           HB2      SER  15  12.126  -4.695   1.391
    4    HB3  SER  15           HB3      SER  15  12.906  -6.068   0.614
    5    HG   SER  15           HG       SER  15  11.626  -7.245   1.773

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLY  16           H        GLY  16  13.340  -6.932   4.181
    2    HA3  GLY  16           HA2      GLY  16  12.141  -5.175   6.045
    3    HA2  GLY  16           HA3      GLY  16  12.737  -6.791   6.401

  No H/Q in entry =           3
  In of MODEL   40
    1    H    GLN  17           H        GLN  17  15.451  -6.489   5.808
    2    HA   GLN  17           HA       GLN  17  16.424  -5.286   8.192
    3    HB2  GLN  17           HB2      GLN  17  17.834  -6.143   5.651
    4    HB3  GLN  17           HB3      GLN  17  18.685  -5.562   7.082
    5    HG2  GLN  17           HG2      GLN  17  16.764  -7.905   7.062
    6    HG3  GLN  17           HG3      GLN  17  18.519  -8.054   7.003
    7   HE21  GLN  17          HE21      GLN  17  16.179  -8.505   9.167
    8   HE22  GLN  17          HE22      GLN  17  16.909  -7.906  10.575

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ALA  18           H        ALA  18  16.246  -4.196   4.836
    2    HA   ALA  18           HA       ALA  18  17.709  -1.821   5.069
    3    HB1  ALA  18           HB1      ALA  18  16.576  -3.016   2.999
    4    HB3  ALA  18           HB2      ALA  18  16.861  -1.276   2.988
    5    HB2  ALA  18           HB3      ALA  18  15.254  -1.905   3.357

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ARG  19           H        ARG  19  14.203  -2.370   5.466
    2    HA   ARG  19           HA       ARG  19  13.565   0.285   6.189
    3    HB2  ARG  19           HB2      ARG  19  11.864  -1.445   5.598
    4    HB3  ARG  19           HB3      ARG  19  12.198  -2.252   7.133
    5    HG2  ARG  19           HG2      ARG  19  11.510  -0.256   8.378
    6    HG3  ARG  19           HG3      ARG  19  11.269   0.627   6.872
    7    HD2  ARG  19           HD2      ARG  19   9.120  -0.147   7.691
    8    HD3  ARG  19           HD3      ARG  19   9.528  -1.027   6.212
    9    HE   ARG  19           HE       ARG  19  10.470  -2.586   8.312
   10   HH21  ARG  19          HH11      ARG  19   9.202  -4.215   9.246
   11   HH22  ARG  19          HH12      ARG  19   7.483  -4.168   9.076
   12   HH11  ARG  19          HH21      ARG  19   7.490  -1.257   7.222
   13   HH12  ARG  19          HH22      ARG  19   6.514  -2.493   7.926

  No H/Q in entry =          13
  In of MODEL   40
    1    H    SER  20           H        SER  20  14.392  -2.560   8.140
    2    HA   SER  20           HA       SER  20  14.122  -1.466  10.680
    3    HB2  SER  20           HB2      SER  20  14.733  -3.884   9.991
    4    HB3  SER  20           HB3      SER  20  16.398  -3.312   9.984
    5    HG   SER  20           HG       SER  20  14.549  -3.191  12.138

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU  21           H        LEU  21  16.965  -1.430   8.543
    2    HA   LEU  21           HA       LEU  21  18.657   0.032  10.286
    3    HB2  LEU  21           HB2      LEU  21  18.617  -0.380   7.300
    4    HB3  LEU  21           HB3      LEU  21  19.801   0.679   8.061
    5    HG   LEU  21           HG       LEU  21  19.368  -2.211   8.875
    6   HD13  LEU  21          HD11      LEU  21  20.183  -2.274   6.627
    7   HD12  LEU  21          HD12      LEU  21  21.589  -2.533   7.658
    8   HD11  LEU  21          HD13      LEU  21  21.312  -0.953   6.927
    9   HD22  LEU  21          HD21      LEU  21  20.490  -1.273  10.684
   10   HD21  LEU  21          HD22      LEU  21  21.253  -0.019   9.714
   11   HD23  LEU  21          HD23      LEU  21  21.875  -1.661   9.668

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ALA  22           H        ALA  22  16.403   1.034   7.733
    2    HA   ALA  22           HA       ALA  22  16.973   3.786   7.756
    3    HB3  ALA  22           HB1      ALA  22  15.556   2.565   6.074
    4    HB2  ALA  22           HB2      ALA  22  14.867   4.084   6.646
    5    HB1  ALA  22           HB3      ALA  22  14.259   2.550   7.268

  No H/Q in entry =           5
  In of MODEL   40
    1    H    TYR  23           H        TYR  23  14.456   1.993   9.586
    2    HA   TYR  23           HA       TYR  23  13.520   4.237  11.042
    3    HB2  TYR  23           HB2      TYR  23  12.260   2.137  11.014
    4    HB3  TYR  23           HB3      TYR  23  13.583   1.310  11.838
    5    HD1  TYR  23           HD1      TYR  23  11.104   4.074  12.207
    6    HD2  TYR  23           HD2      TYR  23  13.783   1.368  14.195
    7    HE1  TYR  23           HE1      TYR  23  10.182   4.773  14.402
    8    HE2  TYR  23           HE2      TYR  23  12.861   2.066  16.388
    9    HH   TYR  23           HH       TYR  23  10.016   4.049  16.638

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ALA  24           H        ALA  24  16.138   1.929  11.672
    2    HA   ALA  24           HA       ALA  24  16.821   2.908  14.238
    3    HB3  ALA  24           HB1      ALA  24  18.156   1.100  14.067
    4    HB2  ALA  24           HB2      ALA  24  19.194   2.012  12.971
    5    HB1  ALA  24           HB3      ALA  24  17.888   1.021  12.327

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA  25           H        ALA  25  17.788   3.836  10.962
    2    HA   ALA  25           HA       ALA  25  19.756   5.745  11.613
    3    HB1  ALA  25           HB1      ALA  25  19.028   4.813   9.295
    4    HB3  ALA  25           HB2      ALA  25  19.550   6.494   9.393
    5    HB2  ALA  25           HB3      ALA  25  17.830   6.108   9.323

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU  26           H        LEU  26  16.244   6.017  11.253
    2    HA   LEU  26           HA       LEU  26  16.054   8.800  11.713
    3    HB2  LEU  26           HB2      LEU  26  14.177   7.590  10.782
    4    HB3  LEU  26           HB3      LEU  26  14.074   6.559  12.204
    5    HG   LEU  26           HG       LEU  26  13.493   8.520  13.590
    6   HD12  LEU  26          HD11      LEU  26  12.857  10.633  12.272
    7   HD11  LEU  26          HD12      LEU  26  13.830   9.972  10.960
    8   HD13  LEU  26          HD13      LEU  26  14.579  10.343  12.513
    9   HD21  LEU  26          HD21      LEU  26  11.813   8.235  11.080
   10   HD23  LEU  26          HD22      LEU  26  11.261   8.935  12.599
   11   HD22  LEU  26          HD23      LEU  26  11.692   7.229  12.523

  No H/Q in entry =          11
  In of MODEL   40
    1    H    LYS  27           H        LYS  27  15.912   6.015  13.897
    2    HA   LYS  27           HA       LYS  27  15.337   7.381  16.270
    3    HB2  LYS  27           HB2      LYS  27  15.334   4.906  15.997
    4    HB3  LYS  27           HB3      LYS  27  17.097   4.937  15.954
    5    HG2  LYS  27           HG2      LYS  27  17.160   5.914  18.206
    6    HG3  LYS  27           HG3      LYS  27  15.394   5.955  18.252
    7    HD2  LYS  27           HD2      LYS  27  15.337   3.489  18.008
    8    HD3  LYS  27           HD3      LYS  27  17.102   3.457  17.996
    9    HE2  LYS  27           HE2      LYS  27  17.149   4.438  20.255
   10    HE3  LYS  27           HE3      LYS  27  15.383   4.500  20.271
   11    HZ3  LYS  27           HZ1      LYS  27  16.146   2.534  21.415
   12    HZ2  LYS  27           HZ2      LYS  27  17.056   2.048  20.062
   13    HZ1  LYS  27           HZ3      LYS  27  15.358   2.075  19.983

  No H/Q in entry =          13
  In of MODEL   40
    1    H    GLN  28           H        GLN  28  18.445   6.763  14.676
    2    HA   GLN  28           HA       GLN  28  20.144   7.818  16.669
    3    HB2  GLN  28           HB2      GLN  28  20.430   7.780  13.654
    4    HB3  GLN  28           HB3      GLN  28  21.723   8.228  14.766
    5    HG2  GLN  28           HG2      GLN  28  20.266   5.570  14.797
    6    HG3  GLN  28           HG3      GLN  28  21.852   5.838  14.076
    7   HE21  GLN  28          HE21      GLN  28  20.562   4.532  16.775
    8   HE22  GLN  28          HE22      GLN  28  21.757   4.932  17.911

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ALA  29           H        ALA  29  18.411   9.333  13.982
    2    HA   ALA  29           HA       ALA  29  19.446  11.939  14.243
    3    HB2  ALA  29           HB1      ALA  29  17.756  12.604  12.775
    4    HB1  ALA  29           HB2      ALA  29  16.596  11.444  13.422
    5    HB3  ALA  29           HB3      ALA  29  17.919  10.887  12.397

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LYS  30           H        LYS  30  16.648  10.373  15.760
    2    HA   LYS  30           HA       LYS  30  15.666  12.636  17.125
    3    HB2  LYS  30           HB2      LYS  30  15.512   9.695  17.819
    4    HB3  LYS  30           HB3      LYS  30  14.665  10.954  18.717
    5    HG2  LYS  30           HG2      LYS  30  13.549  11.663  16.601
    6    HG3  LYS  30           HG3      LYS  30  14.335  10.318  15.769
    7    HD2  LYS  30           HD2      LYS  30  13.240   8.721  17.293
    8    HD3  LYS  30           HD3      LYS  30  12.465  10.055  18.148
    9    HE2  LYS  30           HE2      LYS  30  11.305  10.711  16.058
   10    HE3  LYS  30           HE3      LYS  30  12.060   9.349  15.223
   11    HZ2  LYS  30           HZ1      LYS  30   9.746   8.970  16.102
   12    HZ1  LYS  30           HZ2      LYS  30  10.415   9.008  17.669
   13    HZ3  LYS  30           HZ3      LYS  30  10.906   7.820  16.555

  No H/Q in entry =          13
  In of MODEL   40
    1    H    GLN  31           H        GLN  31  18.295  10.426  17.854
    2    HA   GLN  31           HA       GLN  31  18.638  11.427  20.551
    3    HB2  GLN  31           HB2      GLN  31  20.637   9.832  18.941
    4    HB3  GLN  31           HB3      GLN  31  20.505   9.953  20.696
    5    HG2  GLN  31           HG2      GLN  31  17.978   9.040  19.924
    6    HG3  GLN  31           HG3      GLN  31  19.067   8.183  18.841
    7   HE21  GLN  31          HE21      GLN  31  17.509   7.052  21.114
    8   HE22  GLN  31          HE22      GLN  31  18.655   6.371  22.162

  No H/Q in entry =           8
  In of MODEL   40
    1    H    GLY  32           H        GLY  32  19.175  12.746  17.589
    2    HA3  GLY  32           HA2      GLY  32  20.189  14.779  17.081
    3    HA2  GLY  32           HA3      GLY  32  20.947  14.767  18.669

  No H/Q in entry =           3
  In of MODEL   40
    1    H    ASP  33           H        ASP  33  21.327  11.875  16.882
    2    HA   ASP  33           HA       ASP  33  24.161  12.511  16.417
    3    HB2  ASP  33           HB2      ASP  33  22.615   9.917  16.525
    4    HB3  ASP  33           HB3      ASP  33  24.303  10.010  16.030

  No H/Q in entry =           4
  In of MODEL   40
    1    H    PHE  34           H        PHE  34  23.699  13.847  14.541
    2    HA   PHE  34           HA       PHE  34  22.335  12.890  12.251
    3    HB2  PHE  34           HB2      PHE  34  24.496  14.993  12.487
    4    HB3  PHE  34           HB3      PHE  34  23.507  14.721  11.055
    5    HD1  PHE  34           HD1      PHE  34  23.786  16.642  13.975
    6    HD2  PHE  34           HD2      PHE  34  20.878  14.576  11.583
    7    HE1  PHE  34           HE1      PHE  34  21.990  18.062  14.927
    8    HE2  PHE  34           HE2      PHE  34  19.086  15.996  12.538
    9    HZ   PHE  34           HZ       PHE  34  19.645  17.740  14.206

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ALA  35           H        ALA  35  25.706  12.651  13.257
    2    HA   ALA  35           HA       ALA  35  26.799  11.823  10.797
    3    HB3  ALA  35           HB1      ALA  35  28.464  10.624  12.512
    4    HB2  ALA  35           HB2      ALA  35  27.615  11.658  13.661
    5    HB1  ALA  35           HB3      ALA  35  28.461  12.374  12.291

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA  36           H        ALA  36  25.657   9.874  13.556
    2    HA   ALA  36           HA       ALA  36  26.106   7.384  12.272
    3    HB2  ALA  36           HB1      ALA  36  25.666   6.636  14.345
    4    HB3  ALA  36           HB2      ALA  36  23.985   7.155  14.197
    5    HB1  ALA  36           HB3      ALA  36  25.202   8.268  14.823

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA  37           H        ALA  37  23.314   9.548  12.414
    2    HA   ALA  37           HA       ALA  37  21.434   7.808  11.232
    3    HB3  ALA  37           HB1      ALA  37  21.700  10.766  11.534
    4    HB1  ALA  37           HB2      ALA  37  20.373   9.704  12.004
    5    HB2  ALA  37           HB3      ALA  37  20.568  10.179  10.316

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LYS  38           H        LYS  38  23.566  10.245   9.761
    2    HA   LYS  38           HA       LYS  38  22.920   9.835   7.083
    3    HB2  LYS  38           HB2      LYS  38  24.750  11.363   8.532
    4    HB3  LYS  38           HB3      LYS  38  25.770  10.364   7.503
    5    HG2  LYS  38           HG2      LYS  38  24.615  11.156   5.510
    6    HG3  LYS  38           HG3      LYS  38  23.432  12.023   6.494
    7    HD2  LYS  38           HD2      LYS  38  25.048  13.598   7.251
    8    HD3  LYS  38           HD3      LYS  38  26.395  12.596   6.712
    9    HE2  LYS  38           HE2      LYS  38  26.063  14.477   5.167
   10    HE3  LYS  38           HE3      LYS  38  25.707  12.947   4.358
   11    HZ3  LYS  38           HZ1      LYS  38  23.516  13.420   4.230
   12    HZ2  LYS  38           HZ2      LYS  38  24.060  15.028   4.322
   13    HZ1  LYS  38           HZ3      LYS  38  23.476  14.247   5.712

  No H/Q in entry =          13
  In of MODEL   40
    1    H    ALA  39           H        ALA  39  25.413   8.198   9.032
    2    HA   ALA  39           HA       ALA  39  26.462   6.603   6.957
    3    HB2  ALA  39           HB1      ALA  39  26.361   5.631   9.798
    4    HB1  ALA  39           HB2      ALA  39  27.332   7.046   9.386
    5    HB3  ALA  39           HB3      ALA  39  27.663   5.494   8.617

  No H/Q in entry =           5
  In of MODEL   40
    1    H    MET  40           H        MET  40  23.842   6.013   9.254
    2    HA   MET  40           HA       MET  40  23.364   3.316   8.511
    3    HB2  MET  40           HB2      MET  40  21.574   5.378   9.811
    4    HB3  MET  40           HB3      MET  40  21.146   3.675   9.630
    5    HG2  MET  40           HG2      MET  40  23.707   4.579  10.974
    6    HG3  MET  40           HG3      MET  40  22.210   4.320  11.866
    7    HE3  MET  40           HE1      MET  40  21.601   0.693  12.030
    8    HE2  MET  40           HE2      MET  40  20.748   2.009  11.227
    9    HE1  MET  40           HE3      MET  40  21.493   2.282  12.801

  No H/Q in entry =           9
  In of MODEL   40
    1    H    MET  41           H        MET  41  21.988   6.391   7.334
    2    HA   MET  41           HA       MET  41  20.016   5.226   5.659
    3    HB2  MET  41           HB2      MET  41  21.529   7.799   5.154
    4    HB3  MET  41           HB3      MET  41  19.994   7.327   4.435
    5    HG2  MET  41           HG2      MET  41  19.247   7.139   6.986
    6    HG3  MET  41           HG3      MET  41  20.570   8.280   7.211
    7    HE2  MET  41           HE1      MET  41  20.022   9.586   3.879
    8    HE1  MET  41           HE2      MET  41  20.985  10.009   5.291
    9    HE3  MET  41           HE3      MET  41  19.725  11.105   4.731

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ASP  42           H        ASP  42  23.399   6.109   5.108
    2    HA   ASP  42           HA       ASP  42  23.484   5.643   2.349
    3    HB2  ASP  42           HB2      ASP  42  25.248   6.613   4.121
    4    HB3  ASP  42           HB3      ASP  42  25.885   4.980   3.987

  No H/Q in entry =           4
  In of MODEL   40
    1    H    GLN  43           H        GLN  43  24.183   3.471   5.062
    2    HA   GLN  43           HA       GLN  43  24.820   1.211   3.471
    3    HB2  GLN  43           HB2      GLN  43  23.800   1.397   6.316
    4    HB3  GLN  43           HB3      GLN  43  24.361  -0.096   5.555
    5    HG2  GLN  43           HG2      GLN  43  26.538   1.090   5.048
    6    HG3  GLN  43           HG3      GLN  43  25.972   2.420   6.052
    7   HE21  GLN  43          HE21      GLN  43  28.194   1.417   7.084
    8   HE22  GLN  43          HE22      GLN  43  27.907   0.333   8.357

  No H/Q in entry =           8
  In of MODEL   40
    1    H    SER  44           H        SER  44  21.778   2.377   4.861
    2    HA   SER  44           HA       SER  44  20.182   0.155   4.182
    3    HB2  SER  44           HB2      SER  44  19.771   2.685   5.336
    4    HB3  SER  44           HB3      SER  44  18.736   2.659   3.911
    5    HG   SER  44           HG       SER  44  17.632   1.724   5.631

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ARG  45           H        ARG  45  20.960   3.116   2.387
    2    HA   ARG  45           HA       ARG  45  19.428   2.657   0.081
    3    HB2  ARG  45           HB2      ARG  45  20.598   4.777   0.672
    4    HB3  ARG  45           HB3      ARG  45  22.133   4.005   0.283
    5    HG2  ARG  45           HG2      ARG  45  21.344   3.617  -2.032
    6    HG3  ARG  45           HG3      ARG  45  19.821   4.412  -1.642
    7    HD2  ARG  45           HD2      ARG  45  21.097   6.491  -1.052
    8    HD3  ARG  45           HD3      ARG  45  22.584   5.701  -1.624
    9    HE   ARG  45           HE       ARG  45  20.650   5.494  -3.659
   10   HH21  ARG  45          HH11      ARG  45  20.659   6.869  -5.418
   11   HH22  ARG  45          HH12      ARG  45  21.435   8.409  -5.309
   12   HH11  ARG  45          HH21      ARG  45  22.412   7.965  -2.025
   13   HH12  ARG  45          HH22      ARG  45  22.427   9.029  -3.385

  No H/Q in entry =          13
  In of MODEL   40
    1    H    MET  46           H        MET  46  22.781   1.738   0.823
    2    HA   MET  46           HA       MET  46  23.371   0.546  -1.665
    3    HB2  MET  46           HB2      MET  46  24.476   0.202   1.122
    4    HB3  MET  46           HB3      MET  46  25.117  -0.704  -0.252
    5    HG2  MET  46           HG2      MET  46  25.557   1.416  -1.445
    6    HG3  MET  46           HG3      MET  46  24.920   2.320  -0.078
    7    HE3  MET  46           HE1      MET  46  27.770   2.955   2.068
    8    HE2  MET  46           HE2      MET  46  26.037   2.656   2.164
    9    HE1  MET  46           HE3      MET  46  26.676   3.685   0.884

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ALA  47           H        ALA  47  21.973  -0.779   1.308
    2    HA   ALA  47           HA       ALA  47  21.883  -3.489   0.496
    3    HB2  ALA  47           HB1      ALA  47  21.513  -3.031   2.802
    4    HB3  ALA  47           HB2      ALA  47  19.968  -3.611   2.183
    5    HB1  ALA  47           HB3      ALA  47  20.220  -1.884   2.447

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU  48           H        LEU  48  19.565  -0.830   0.150
    2    HA   LEU  48           HA       LEU  48  17.499  -2.332  -1.103
    3    HB2  LEU  48           HB2      LEU  48  18.192   0.614  -1.210
    4    HB3  LEU  48           HB3      LEU  48  16.711  -0.075  -1.877
    5    HG   LEU  48           HG       LEU  48  17.564  -0.397   1.010
    6   HD13  LEU  48          HD11      LEU  48  17.177   1.909   0.831
    7   HD12  LEU  48          HD12      LEU  48  15.610   1.281   1.340
    8   HD11  LEU  48          HD13      LEU  48  15.885   1.705  -0.350
    9   HD22  LEU  48          HD21      LEU  48  16.012  -2.090   0.626
   10   HD21  LEU  48          HD22      LEU  48  15.149  -1.172  -0.608
   11   HD23  LEU  48          HD23      LEU  48  14.944  -0.769   1.096

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ASN  49           H        ASN  49  20.211  -0.437  -2.331
    2    HA   ASN  49           HA       ASN  49  19.555  -0.503  -5.055
    3    HB2  ASN  49           HB2      ASN  49  21.256   0.987  -4.130
    4    HB3  ASN  49           HB3      ASN  49  22.267  -0.388  -3.703
    5   HD21  ASN  49          HD21      ASN  49  23.514   1.396  -5.288
    6   HD22  ASN  49          HD22      ASN  49  23.594   0.867  -6.899

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLU  50           H        GLU  50  21.512  -2.730  -3.102
    2    HA   GLU  50           HA       GLU  50  22.186  -4.490  -5.234
    3    HB2  GLU  50           HB2      GLU  50  23.388  -4.487  -3.069
    4    HB3  GLU  50           HB3      GLU  50  21.938  -5.097  -2.273
    5    HG2  GLU  50           HG2      GLU  50  21.997  -7.127  -3.638
    6    HG3  GLU  50           HG3      GLU  50  23.380  -6.511  -4.539

  No H/Q in entry =           6
  In of MODEL   40
    1    H    ALA  51           H        ALA  51  19.535  -4.394  -2.903
    2    HA   ALA  51           HA       ALA  51  18.333  -6.849  -3.665
    3    HB3  ALA  51           HB1      ALA  51  16.751  -6.325  -2.106
    4    HB1  ALA  51           HB2      ALA  51  16.559  -4.675  -2.700
    5    HB2  ALA  51           HB3      ALA  51  17.915  -5.082  -1.647

  No H/Q in entry =           5
  In of MODEL   40
    1    H    HIS  52           H        HIS  52  17.792  -3.490  -4.690
    2    HA   HIS  52           HA       HIS  52  15.669  -3.983  -6.488
    3    HB2  HIS  52           HB2      HIS  52  16.357  -1.729  -5.679
    4    HB3  HIS  52           HB3      HIS  52  17.801  -1.843  -6.684
    5    HD1  HIS  52           HD1      HIS  52  17.464  -1.787  -9.280
    6    HD2  HIS  52           HD2      HIS  52  13.959  -1.218  -7.096
    7    HE1  HIS  52           HE1      HIS  52  15.733  -0.925 -10.916
    8    HE2  HIS  52           HE2      HIS  52  13.591  -0.572  -9.600

  No H/Q in entry =           8
  In of MODEL   40
    1    H    LEU  53           H        LEU  53  19.186  -4.035  -6.927
    2    HA   LEU  53           HA       LEU  53  19.234  -4.344  -9.728
    3    HB2  LEU  53           HB2      LEU  53  21.160  -5.138  -7.559
    4    HB3  LEU  53           HB3      LEU  53  21.468  -5.524  -9.250
    5    HG   LEU  53           HG       LEU  53  20.840  -2.709  -8.307
    6   HD12  LEU  53          HD11      LEU  53  23.286  -2.308  -8.450
    7   HD11  LEU  53          HD12      LEU  53  23.536  -4.030  -8.734
    8   HD13  LEU  53          HD13      LEU  53  22.888  -3.478  -7.194
    9   HD22  LEU  53          HD21      LEU  53  20.572  -2.740 -10.645
   10   HD21  LEU  53          HD22      LEU  53  21.818  -3.963 -10.866
   11   HD23  LEU  53          HD23      LEU  53  22.271  -2.310 -10.502

  No H/Q in entry =          11
  In of MODEL   40
    1    H    VAL  54           H        VAL  54  19.094  -6.736  -7.108
    2    HA   VAL  54           HA       VAL  54  19.183  -9.028  -8.774
    3    HB   VAL  54           HB       VAL  54  18.040  -8.596  -6.003
    4   HG12  VAL  54          HG11      VAL  54  18.329 -11.217  -6.006
    5   HG11  VAL  54          HG12      VAL  54  18.143 -11.042  -7.751
    6   HG13  VAL  54          HG13      VAL  54  16.863 -10.497  -6.669
    7   HG22  VAL  54          HG21      VAL  54  20.358  -8.416  -5.784
    8   HG21  VAL  54          HG22      VAL  54  20.679  -9.509  -7.128
    9   HG23  VAL  54          HG23      VAL  54  20.143 -10.153  -5.577

  No H/Q in entry =           9
  In of MODEL   40
    1    H    GLN  55           H        GLN  55  16.483  -7.092  -7.481
    2    HA   GLN  55           HA       GLN  55  14.438  -8.727  -8.556
    3    HB2  GLN  55           HB2      GLN  55  13.713  -7.196  -6.924
    4    HB3  GLN  55           HB3      GLN  55  14.522  -5.836  -7.698
    5    HG2  GLN  55           HG2      GLN  55  12.799  -5.485  -9.184
    6    HG3  GLN  55           HG3      GLN  55  12.455  -7.201  -9.358
    7   HE21  GLN  55          HE21      GLN  55  10.443  -7.726  -8.550
    8   HE22  GLN  55          HE22      GLN  55   9.681  -6.965  -7.239

  No H/Q in entry =           8
  In of MODEL   40
    1    H    THR  56           H        THR  56  16.211  -5.947  -9.912
    2    HA   THR  56           HA       THR  56  14.774  -5.560 -12.256
    3    HB   THR  56           HB       THR  56  17.794  -5.513 -12.108
    4    HG1  THR  56           HG1      THR  56  15.959  -4.120 -10.720
    5   HG23  THR  56          HG21      THR  56  17.688  -4.020 -13.911
    6   HG22  THR  56          HG22      THR  56  16.000  -3.620 -13.603
    7   HG21  THR  56          HG23      THR  56  16.422  -5.184 -14.302

  No H/Q in entry =           7
  In of MODEL   40
    1    H    LYS  57           H        LYS  57  17.395  -7.893 -11.655
    2    HA   LYS  57           HA       LYS  57  17.376  -9.081 -14.236
    3    HB2  LYS  57           HB2      LYS  57  19.154  -9.349 -12.460
    4    HB3  LYS  57           HB3      LYS  57  18.038 -10.377 -11.572
    5    HG2  LYS  57           HG2      LYS  57  18.503 -11.094 -14.417
    6    HG3  LYS  57           HG3      LYS  57  19.852 -11.356 -13.318
    7    HD2  LYS  57           HD2      LYS  57  18.368 -12.680 -11.832
    8    HD3  LYS  57           HD3      LYS  57  17.043 -12.456 -12.972
    9    HE2  LYS  57           HE2      LYS  57  18.354 -13.602 -14.732
   10    HE3  LYS  57           HE3      LYS  57  19.682 -13.842 -13.597
   11    HZ1  LYS  57           HZ1      LYS  57  18.076 -15.051 -12.161
   12    HZ3  LYS  57           HZ2      LYS  57  18.402 -15.814 -13.643
   13    HZ2  LYS  57           HZ3      LYS  57  16.947 -14.967 -13.422

  No H/Q in entry =          13
  In of MODEL   40
    1    H    LEU  58           H        LEU  58  15.593  -9.733 -11.259
    2    HA   LEU  58           HA       LEU  58  14.340 -12.089 -12.197
    3    HB2  LEU  58           HB2      LEU  58  13.573 -10.179  -9.995
    4    HB3  LEU  58           HB3      LEU  58  12.747 -11.706 -10.313
    5    HG   LEU  58           HG       LEU  58  15.724 -11.466  -9.764
    6   HD11  LEU  58          HD11      LEU  58  13.352 -11.858  -7.968
    7   HD13  LEU  58          HD12      LEU  58  14.817 -10.913  -7.706
    8   HD12  LEU  58          HD13      LEU  58  14.868 -12.670  -7.575
    9   HD22  LEU  58          HD21      LEU  58  15.579 -13.523 -10.796
   10   HD21  LEU  58          HD22      LEU  58  13.864 -13.713 -10.432
   11   HD23  LEU  58          HD23      LEU  58  15.071 -14.031  -9.186

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  59           H        ILE  59  13.709  -8.743 -12.871
    2    HA   ILE  59           HA       ILE  59  10.984  -9.356 -13.807
    3    HB   ILE  59           HB       ILE  59  11.809  -7.089 -12.596
    4   HG12  ILE  59          HG12      ILE  59   9.923  -6.928 -14.956
    5   HG13  ILE  59          HG13      ILE  59   9.482  -7.700 -13.455
    6   HG22  ILE  59          HG21      ILE  59  11.916  -6.252 -15.478
    7   HG21  ILE  59          HG22      ILE  59  13.383  -6.720 -14.648
    8   HG23  ILE  59          HG23      ILE  59  12.429  -5.359 -14.067
    9   HD12  ILE  59          HD11      ILE  59   8.744  -5.344 -13.496
   10   HD11  ILE  59          HD12      ILE  59  10.419  -4.841 -13.711
   11   HD13  ILE  59          HD13      ILE  59   9.922  -5.630 -12.213

  No H/Q in entry =          11
  In of MODEL   40
    1    H    GLU  60           H        GLU  60  14.195  -8.540 -15.070
    2    HA   GLU  60           HA       GLU  60  13.415  -8.125 -17.775
    3    HB2  GLU  60           HB2      GLU  60  15.567  -7.365 -17.336
    4    HB3  GLU  60           HB3      GLU  60  15.981  -8.780 -16.373
    5    HG2  GLU  60           HG2      GLU  60  17.088  -8.660 -18.666
    6    HG3  GLU  60           HG3      GLU  60  16.214 -10.152 -18.326

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLY  61           H        GLY  61  14.361 -11.022 -15.968
    2    HA3  GLY  61           HA2      GLY  61  13.795 -12.657 -18.372
    3    HA2  GLY  61           HA3      GLY  61  14.824 -13.154 -17.033

  No H/Q in entry =           3
  In of MODEL   40
    1    H    ASP  62           H        ASP  62  11.724 -11.571 -16.651
    2    HA   ASP  62           HA       ASP  62  10.753 -13.416 -14.782
    3    HB2  ASP  62           HB2      ASP  62  10.006 -11.023 -15.176
    4    HB3  ASP  62           HB3      ASP  62   9.044 -11.640 -16.516

  No H/Q in entry =           4
  In of MODEL   40
    1    H    ALA  63           H        ALA  63  11.276 -15.474 -16.038
    2    HA   ALA  63           HA       ALA  63   9.718 -16.238 -18.311
    3    HB3  ALA  63           HB1      ALA  63  10.441 -18.549 -17.706
    4    HB2  ALA  63           HB2      ALA  63  11.123 -17.912 -16.211
    5    HB1  ALA  63           HB3      ALA  63  11.783 -17.407 -17.766

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLY  64           H        GLY  64   9.331 -16.633 -14.829
    2    HA3  GLY  64           HA2      GLY  64   7.408 -16.938 -13.576
    3    HA2  GLY  64           HA3      GLY  64   6.473 -16.926 -15.065

  No H/Q in entry =           3
  In of MODEL   40
    1    H    GLU  65           H        GLU  65   5.547 -18.706 -13.399
    2    HA   GLU  65           HA       GLU  65   6.880 -21.188 -13.271
    3    HB2  GLU  65           HB2      GLU  65   3.961 -20.485 -13.005
    4    HB3  GLU  65           HB3      GLU  65   4.607 -22.099 -12.710
    5    HG2  GLU  65           HG2      GLU  65   6.087 -21.231 -10.976
    6    HG3  GLU  65           HG3      GLU  65   5.554 -19.584 -11.306

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLY  66           H        GLY  66   4.518 -19.931 -15.509
    2    HA3  GLY  66           HA2      GLY  66   4.691 -22.326 -17.199
    3    HA2  GLY  66           HA3      GLY  66   3.414 -21.129 -17.256

  No H/Q in entry =           3
  In of MODEL   40
    1    H    LYS  67           H        LYS  67   3.904 -21.381 -19.584
    2    HA   LYS  67           HA       LYS  67   6.267 -20.643 -20.816
    3    HB2  LYS  67           HB2      LYS  67   3.414 -20.451 -21.771
    4    HB3  LYS  67           HB3      LYS  67   4.819 -20.210 -22.817
    5    HG2  LYS  67           HG2      LYS  67   5.669 -22.440 -22.215
    6    HG3  LYS  67           HG3      LYS  67   4.291 -22.687 -21.147
    7    HD2  LYS  67           HD2      LYS  67   2.770 -22.460 -23.107
    8    HD3  LYS  67           HD3      LYS  67   4.186 -22.325 -24.154
    9    HE2  LYS  67           HE2      LYS  67   3.655 -24.674 -22.311
   10    HE3  LYS  67           HE3      LYS  67   3.256 -24.657 -24.029
   11    HZ2  LYS  67           HZ1      LYS  67   5.875 -24.745 -22.730
   12    HZ1  LYS  67           HZ2      LYS  67   5.752 -23.922 -24.209
   13    HZ3  LYS  67           HZ3      LYS  67   5.323 -25.563 -24.108

  No H/Q in entry =          13
  In of MODEL   40
    1    H    MET  68           H        MET  68   3.710 -18.593 -21.753
    2    HA   MET  68           HA       MET  68   5.263 -16.252 -21.889
    3    HB2  MET  68           HB2      MET  68   2.315 -16.798 -22.094
    4    HB3  MET  68           HB3      MET  68   2.975 -15.172 -22.257
    5    HG2  MET  68           HG2      MET  68   4.414 -15.910 -24.096
    6    HG3  MET  68           HG3      MET  68   3.831 -17.564 -23.912
    7    HE1  MET  68           HE1      MET  68   3.243 -14.022 -24.624
    8    HE3  MET  68           HE2      MET  68   1.674 -14.057 -23.821
    9    HE2  MET  68           HE3      MET  68   1.756 -13.885 -25.573

  No H/Q in entry =           9
  In of MODEL   40
    1    H    LYS  69           H        LYS  69   2.875 -17.273 -19.431
    2    HA   LYS  69           HA       LYS  69   2.404 -14.976 -18.073
    3    HB2  LYS  69           HB2      LYS  69   2.852 -17.749 -16.981
    4    HB3  LYS  69           HB3      LYS  69   2.245 -16.415 -15.997
    5    HG2  LYS  69           HG2      LYS  69   0.390 -16.078 -17.589
    6    HG3  LYS  69           HG3      LYS  69   0.992 -17.413 -18.572
    7    HD2  LYS  69           HD2      LYS  69   0.656 -18.963 -16.691
    8    HD3  LYS  69           HD3      LYS  69   0.073 -17.631 -15.690
    9    HE2  LYS  69           HE2      LYS  69  -1.774 -17.241 -17.282
   10    HE3  LYS  69           HE3      LYS  69  -1.195 -18.576 -18.278
   11    HZ2  LYS  69           HZ1      LYS  69  -2.982 -18.782 -16.252
   12    HZ1  LYS  69           HZ2      LYS  69  -1.535 -19.287 -15.520
   13    HZ3  LYS  69           HZ3      LYS  69  -2.101 -20.069 -16.919

  No H/Q in entry =          13
  In of MODEL   40
    1    H    VAL  70           H        VAL  70   3.227 -14.941 -15.479
    2    HA   VAL  70           HA       VAL  70   6.156 -14.515 -15.552
    3    HB   VAL  70           HB       VAL  70   5.761 -12.436 -14.203
    4   HG11  VAL  70          HG11      VAL  70   4.583 -12.605 -16.990
    5   HG13  VAL  70          HG12      VAL  70   6.249 -12.218 -16.563
    6   HG12  VAL  70          HG13      VAL  70   4.955 -11.085 -16.177
    7   HG22  VAL  70          HG21      VAL  70   3.543 -11.481 -14.057
    8   HG21  VAL  70          HG22      VAL  70   3.421 -13.149 -13.500
    9   HG23  VAL  70          HG23      VAL  70   2.875 -12.720 -15.122

  No H/Q in entry =           9
  In of MODEL   40
    1    H    SER  71           H        SER  71   7.127 -14.444 -13.410
    2    HA   SER  71           HA       SER  71   6.200 -16.508 -11.667
    3    HB2  SER  71           HB2      SER  71   8.606 -15.837 -11.969
    4    HB3  SER  71           HB3      SER  71   8.254 -14.363 -11.072
    5    HG   SER  71           HG       SER  71   8.111 -17.056 -10.210

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU  72           H        LEU  72   4.793 -16.376 -10.029
    2    HA   LEU  72           HA       LEU  72   3.272 -14.045  -9.577
    3    HB2  LEU  72           HB2      LEU  72   3.531 -16.611  -8.016
    4    HB3  LEU  72           HB3      LEU  72   2.381 -15.341  -7.607
    5    HG   LEU  72           HG       LEU  72   2.511 -16.614 -10.359
    6   HD13  LEU  72          HD11      LEU  72   0.652 -18.024  -9.683
    7   HD12  LEU  72          HD12      LEU  72   0.617 -17.277  -8.086
    8   HD11  LEU  72          HD13      LEU  72   1.987 -18.281  -8.560
    9   HD23  LEU  72          HD21      LEU  72   0.028 -15.787 -10.226
   10   HD22  LEU  72          HD22      LEU  72   1.277 -14.599 -10.556
   11   HD21  LEU  72          HD23      LEU  72   0.612 -14.748  -8.932

  No H/Q in entry =          11
  In of MODEL   40
    1    H    VAL  73           H        VAL  73   5.913 -15.520  -7.811
    2    HA   VAL  73           HA       VAL  73   5.874 -13.992  -5.474
    3    HB   VAL  73           HB       VAL  73   8.060 -14.819  -5.061
    4   HG13  VAL  73          HG11      VAL  73   7.811 -17.208  -5.619
    5   HG12  VAL  73          HG12      VAL  73   6.576 -16.803  -6.812
    6   HG11  VAL  73          HG13      VAL  73   6.274 -16.521  -5.097
    7   HG21  VAL  73          HG21      VAL  73   8.197 -14.903  -8.055
    8   HG23  VAL  73          HG22      VAL  73   9.177 -16.039  -7.129
    9   HG22  VAL  73          HG23      VAL  73   9.388 -14.303  -6.900

  No H/Q in entry =           9
  In of MODEL   40
    1    H    LEU  74           H        LEU  74   6.872 -13.102  -8.649
    2    HA   LEU  74           HA       LEU  74   8.841 -11.179  -8.152
    3    HB2  LEU  74           HB2      LEU  74   8.368 -11.921 -10.392
    4    HB3  LEU  74           HB3      LEU  74   6.714 -11.321 -10.288
    5    HG   LEU  74           HG       LEU  74   7.621  -9.004 -10.002
    6   HD12  LEU  74          HD11      LEU  74  10.086  -8.830 -10.805
    7   HD11  LEU  74          HD12      LEU  74  10.209 -10.522 -10.328
    8   HD13  LEU  74          HD13      LEU  74   9.799  -9.296  -9.129
    9   HD22  LEU  74          HD21      LEU  74   7.867  -8.714 -12.283
   10   HD21  LEU  74          HD22      LEU  74   7.094 -10.281 -12.205
   11   HD23  LEU  74          HD23      LEU  74   8.820 -10.185 -12.473

  No H/Q in entry =          11
  In of MODEL   40
    1    H    VAL  75           H        VAL  75   5.350 -10.750  -8.502
    2    HA   VAL  75           HA       VAL  75   5.288  -7.994  -7.907
    3    HB   VAL  75           HB       VAL  75   3.176 -10.118  -7.536
    4   HG13  VAL  75          HG11      VAL  75   2.719  -8.213  -6.031
    5   HG12  VAL  75          HG12      VAL  75   1.621  -8.157  -7.402
    6   HG11  VAL  75          HG13      VAL  75   3.011  -7.083  -7.350
    7   HG22  VAL  75          HG21      VAL  75   2.289  -9.133  -9.612
    8   HG21  VAL  75          HG22      VAL  75   3.949  -9.674  -9.860
    9   HG23  VAL  75          HG23      VAL  75   3.604  -7.959  -9.634

  No H/Q in entry =           9
  In of MODEL   40
    1    H    GLU  76           H        GLU  76   5.000 -10.874  -5.806
    2    HA   GLU  76           HA       GLU  76   4.548  -9.514  -3.380
    3    HB2  GLU  76           HB2      GLU  76   4.348 -11.982  -3.634
    4    HB3  GLU  76           HB3      GLU  76   6.086 -12.094  -3.850
    5    HG2  GLU  76           HG2      GLU  76   5.616 -12.676  -1.561
    6    HG3  GLU  76           HG3      GLU  76   6.364 -11.090  -1.534

  No H/Q in entry =           6
  In of MODEL   40
    1    H    ALA  77           H        ALA  77   7.596 -10.455  -4.947
    2    HA   ALA  77           HA       ALA  77   9.298  -9.438  -2.928
    3    HB1  ALA  77           HB1      ALA  77   9.829 -10.967  -4.975
    4    HB2  ALA  77           HB2      ALA  77  11.056  -9.834  -4.410
    5    HB3  ALA  77           HB3      ALA  77  10.082  -9.444  -5.827

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLN  78           H        GLN  78   7.924  -7.995  -5.838
    2    HA   GLN  78           HA       GLN  78   9.308  -5.534  -5.727
    3    HB2  GLN  78           HB2      GLN  78   7.998  -6.428  -7.687
    4    HB3  GLN  78           HB3      GLN  78   6.522  -6.031  -6.810
    5    HG2  GLN  78           HG2      GLN  78   7.210  -3.669  -6.710
    6    HG3  GLN  78           HG3      GLN  78   8.690  -4.059  -7.587
    7   HE21  GLN  78          HE21      GLN  78   6.827  -2.204  -8.689
    8   HE22  GLN  78          HE22      GLN  78   6.110  -2.906 -10.059

  No H/Q in entry =           8
  In of MODEL   40
    1    H    LEU  79           H        LEU  79   6.274  -6.636  -4.300
    2    HA   LEU  79           HA       LEU  79   5.311  -4.219  -3.284
    3    HB2  LEU  79           HB2      LEU  79   3.970  -6.254  -3.235
    4    HB3  LEU  79           HB3      LEU  79   5.105  -7.011  -2.121
    5    HG   LEU  79           HG       LEU  79   4.574  -5.367  -0.390
    6   HD13  LEU  79          HD11      LEU  79   4.135  -3.343  -1.435
    7   HD12  LEU  79          HD12      LEU  79   2.503  -3.849  -0.998
    8   HD11  LEU  79          HD13      LEU  79   3.081  -4.074  -2.647
    9   HD23  LEU  79          HD21      LEU  79   1.981  -5.825  -0.302
   10   HD22  LEU  79          HD22      LEU  79   3.103  -7.180  -0.197
   11   HD21  LEU  79          HD23      LEU  79   2.294  -6.828  -1.721

  No H/Q in entry =          11
  In of MODEL   40
    1    H    HIS  80           H        HIS  80   7.462  -6.588  -1.707
    2    HA   HIS  80           HA       HIS  80   7.770  -5.056   0.666
    3    HB2  HIS  80           HB2      HIS  80   9.077  -7.434  -0.539
    4    HB3  HIS  80           HB3      HIS  80   9.999  -6.553   0.681
    5    HD1  HIS  80           HD1      HIS  80   9.498  -7.189   3.022
    6    HD2  HIS  80           HD2      HIS  80   6.272  -7.989   0.506
    7    HE1  HIS  80           HE1      HIS  80   7.711  -8.272   4.466
    8    HE2  HIS  80           HE2      HIS  80   5.738  -8.764   2.941

  No H/Q in entry =           8
  In of MODEL   40
    1    H    LEU  81           H        LEU  81   9.773  -5.351  -2.246
    2    HA   LEU  81           HA       LEU  81  11.840  -3.640  -1.361
    3    HB2  LEU  81           HB2      LEU  81  10.910  -4.412  -4.127
    4    HB3  LEU  81           HB3      LEU  81  12.344  -3.426  -3.833
    5    HG   LEU  81           HG       LEU  81  11.913  -6.145  -2.567
    6   HD12  LEU  81          HD11      LEU  81  13.721  -6.791  -4.317
    7   HD11  LEU  81          HD12      LEU  81  13.176  -5.357  -5.185
    8   HD13  LEU  81          HD13      LEU  81  12.046  -6.667  -4.852
    9   HD23  LEU  81          HD21      LEU  81  14.545  -5.866  -2.550
   10   HD22  LEU  81          HD22      LEU  81  13.573  -5.096  -1.299
   11   HD21  LEU  81          HD23      LEU  81  14.165  -4.148  -2.662

  No H/Q in entry =          11
  In of MODEL   40
    1    H    MET  82           H        MET  82   8.928  -2.958  -3.298
    2    HA   MET  82           HA       MET  82   9.506  -0.238  -3.791
    3    HB2  MET  82           HB2      MET  82   6.924  -1.796  -3.673
    4    HB3  MET  82           HB3      MET  82   6.948  -0.071  -4.032
    5    HG2  MET  82           HG2      MET  82   8.521  -2.163  -5.572
    6    HG3  MET  82           HG3      MET  82   6.963  -1.517  -6.084
    7    HE3  MET  82           HE1      MET  82   7.461   1.935  -7.245
    8    HE2  MET  82           HE2      MET  82   7.082   1.709  -5.540
    9    HE1  MET  82           HE3      MET  82   6.402   0.612  -6.738

  No H/Q in entry =           9
  In of MODEL   40
    1    H    THR  83           H        THR  83   7.689  -1.818  -1.192
    2    HA   THR  83           HA       THR  83   6.871   0.538   0.140
    3    HB   THR  83           HB       THR  83   6.712  -1.040   2.154
    4    HG1  THR  83           HG1      THR  83   7.441  -3.000   1.919
    5   HG22  THR  83          HG21      THR  83   5.038  -2.578   0.680
    6   HG21  THR  83          HG22      THR  83   5.285  -1.250  -0.448
    7   HG23  THR  83          HG23      THR  83   4.647  -0.930   1.165

  No H/Q in entry =           7
  In of MODEL   40
    1    H    SER  84           H        SER  84   9.664  -1.602   0.658
    2    HA   SER  84           HA       SER  84  10.741  -0.193   2.851
    3    HB2  SER  84           HB2      SER  84  11.970  -2.048   0.822
    4    HB3  SER  84           HB3      SER  84  12.926  -1.312   2.107
    5    HG   SER  84           HG       SER  84  10.627  -2.969   2.359

  No H/Q in entry =           5
  In of MODEL   40
    1    H    MET  85           H        MET  85  11.501   0.067  -0.636
    2    HA   MET  85           HA       MET  85  13.528   2.002  -0.377
    3    HB2  MET  85           HB2      MET  85  13.115   0.731  -2.447
    4    HB3  MET  85           HB3      MET  85  11.601   1.608  -2.675
    5    HG2  MET  85           HG2      MET  85  12.827   3.734  -2.803
    6    HG3  MET  85           HG3      MET  85  14.345   2.889  -2.519
    7    HE1  MET  85           HE1      MET  85  11.237   3.156  -4.398
    8    HE3  MET  85           HE2      MET  85  11.486   2.507  -6.016
    9    HE2  MET  85           HE3      MET  85  12.049   4.130  -5.633

  No H/Q in entry =           9
  In of MODEL   40
    1    H    LEU  86           H        LEU  86  10.044   2.390  -0.888
    2    HA   LEU  86           HA       LEU  86  10.022   5.204  -1.062
    3    HB2  LEU  86           HB2      LEU  86   8.154   3.573  -1.644
    4    HB3  LEU  86           HB3      LEU  86   7.821   3.484   0.085
    5    HG   LEU  86           HG       LEU  86   7.699   6.047   0.040
    6   HD11  LEU  86          HD11      LEU  86   8.471   5.607  -2.663
    7   HD13  LEU  86          HD12      LEU  86   8.057   7.139  -1.898
    8   HD12  LEU  86          HD13      LEU  86   6.807   6.197  -2.707
    9   HD23  LEU  86          HD21      LEU  86   5.547   4.731  -1.629
   10   HD22  LEU  86          HD22      LEU  86   5.374   5.990  -0.409
   11   HD21  LEU  86          HD23      LEU  86   5.748   4.339   0.080

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ALA  87           H        ALA  87   9.521   3.025   1.677
    2    HA   ALA  87           HA       ALA  87   9.000   4.941   3.652
    3    HB1  ALA  87           HB1      ALA  87   9.764   2.110   3.558
    4    HB3  ALA  87           HB2      ALA  87   8.651   2.936   4.645
    5    HB2  ALA  87           HB3      ALA  87  10.379   2.940   4.991

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ARG  88           H        ARG  88  12.062   3.473   2.669
    2    HA   ARG  88           HA       ARG  88  13.691   4.821   4.507
    3    HB2  ARG  88           HB2      ARG  88  14.330   2.842   3.098
    4    HB3  ARG  88           HB3      ARG  88  14.500   3.936   1.729
    5    HG2  ARG  88           HG2      ARG  88  15.992   5.222   3.680
    6    HG3  ARG  88           HG3      ARG  88  16.287   3.527   4.054
    7    HD2  ARG  88           HD2      ARG  88  17.550   3.217   2.208
    8    HD3  ARG  88           HD3      ARG  88  16.428   4.108   1.176
    9    HE   ARG  88           HE       ARG  88  18.837   5.132   2.228
   10   HH21  ARG  88          HH11      ARG  88  19.216   7.346   2.040
   11   HH22  ARG  88          HH12      ARG  88  17.882   8.439   1.899
   12   HH11  ARG  88          HH21      ARG  88  15.510   5.937   1.950
   13   HH12  ARG  88          HH22      ARG  88  15.782   7.638   1.823

  No H/Q in entry =          13
  In of MODEL   40
    1    H    GLU  89           H        GLU  89  12.734   5.743   1.186
    2    HA   GLU  89           HA       GLU  89  14.316   8.080   1.037
    3    HB2  GLU  89           HB2      GLU  89  13.158   7.062  -0.915
    4    HB3  GLU  89           HB3      GLU  89  11.621   7.625  -0.256
    5    HG2  GLU  89           HG2      GLU  89  12.358   9.952  -0.412
    6    HG3  GLU  89           HG3      GLU  89  13.955   9.438  -0.949

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LEU  90           H        LEU  90  10.979   7.618   2.163
    2    HA   LEU  90           HA       LEU  90  10.505  10.357   2.746
    3    HB2  LEU  90           HB2      LEU  90   9.271   7.799   3.765
    4    HB3  LEU  90           HB3      LEU  90   8.664   9.403   4.192
    5    HG   LEU  90           HG       LEU  90   9.071   8.525   1.321
    6   HD12  LEU  90          HD11      LEU  90   6.532   8.234   1.381
    7   HD11  LEU  90          HD12      LEU  90   6.686   8.216   3.138
    8   HD13  LEU  90          HD13      LEU  90   7.486   6.977   2.170
    9   HD22  LEU  90          HD21      LEU  90   8.812  10.837   1.254
   10   HD21  LEU  90          HD22      LEU  90   7.825  10.880   2.713
   11   HD23  LEU  90          HD23      LEU  90   7.120  10.340   1.190

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  91           H        ILE  91  11.726   7.651   4.661
    2    HA   ILE  91           HA       ILE  91  11.886   9.007   7.133
    3    HB   ILE  91           HB       ILE  91  13.405   6.649   6.004
    4   HG12  ILE  91          HG12      ILE  91  11.390   6.840   8.263
    5   HG13  ILE  91          HG13      ILE  91  10.916   6.571   6.586
    6   HG22  ILE  91          HG21      ILE  91  13.870   6.420   8.644
    7   HG21  ILE  91          HG22      ILE  91  13.821   8.180   8.548
    8   HG23  ILE  91          HG23      ILE  91  14.986   7.277   7.581
    9   HD13  ILE  91          HD11      ILE  91  11.887   4.454   6.510
   10   HD12  ILE  91          HD12      ILE  91  11.294   4.517   8.170
   11   HD11  ILE  91          HD13      ILE  91  13.000   4.805   7.833

  No H/Q in entry =          11
  In of MODEL   40
    1    H    THR  92           H        THR  92  14.101   8.812   4.382
    2    HA   THR  92           HA       THR  92  16.287  10.169   5.546
    3    HB   THR  92           HB       THR  92  15.300  10.067   2.685
    4    HG1  THR  92           HG1      THR  92  16.103   8.157   3.085
    5   HG22  THR  92          HG21      THR  92  17.881  10.720   2.394
    6   HG21  THR  92          HG22      THR  92  17.584  11.541   3.926
    7   HG23  THR  92          HG23      THR  92  16.621  11.947   2.506

  No H/Q in entry =           7
  In of MODEL   40
    1    H    GLU  93           H        GLU  93  13.418  11.371   3.820
    2    HA   GLU  93           HA       GLU  93  14.054  14.122   3.942
    3    HB2  GLU  93           HB2      GLU  93  11.330  12.790   3.951
    4    HB3  GLU  93           HB3      GLU  93  11.643  14.487   3.585
    5    HG2  GLU  93           HG2      GLU  93  12.948  12.229   2.051
    6    HG3  GLU  93           HG3      GLU  93  11.412  12.936   1.565

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LEU  94           H        LEU  94  12.279  11.986   6.146
    2    HA   LEU  94           HA       LEU  94  11.498  13.939   8.028
    3    HB2  LEU  94           HB2      LEU  94  12.029  10.975   8.294
    4    HB3  LEU  94           HB3      LEU  94  11.472  11.955   9.647
    5    HG   LEU  94           HG       LEU  94   9.990  12.037   7.018
    6   HD11  LEU  94          HD11      LEU  94  10.038   9.809   9.015
    7   HD13  LEU  94          HD12      LEU  94   9.736   9.757   7.280
    8   HD12  LEU  94          HD13      LEU  94   8.465  10.290   8.379
    9   HD23  LEU  94          HD21      LEU  94   8.076  12.461   8.618
   10   HD22  LEU  94          HD22      LEU  94   9.333  13.696   8.659
   11   HD21  LEU  94          HD23      LEU  94   9.252  12.477   9.930

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  95           H        ILE  95  14.442  11.966   7.786
    2    HA   ILE  95           HA       ILE  95  15.623  12.863  10.203
    3    HB   ILE  95           HB       ILE  95  16.846  11.783   7.652
    4   HG12  ILE  95          HG12      ILE  95  16.532  10.579  10.416
    5   HG13  ILE  95          HG13      ILE  95  15.362  10.342   9.120
    6   HG21  ILE  95          HG21      ILE  95  18.113  12.563  10.297
    7   HG23  ILE  95          HG22      ILE  95  18.584  13.089   8.679
    8   HG22  ILE  95          HG23      ILE  95  18.865  11.423   9.183
    9   HD13  ILE  95          HD11      ILE  95  16.823   9.045   7.854
   10   HD12  ILE  95          HD12      ILE  95  17.288   8.584   9.488
   11   HD11  ILE  95          HD13      ILE  95  18.259   9.752   8.593

  No H/Q in entry =          11
  In of MODEL   40
    1    H    GLU  96           H        GLU  96  15.797  14.104   6.872
    2    HA   GLU  96           HA       GLU  96  17.675  16.153   7.356
    3    HB2  GLU  96           HB2      GLU  96  17.001  15.507   5.094
    4    HB3  GLU  96           HB3      GLU  96  15.366  16.088   5.396
    5    HG2  GLU  96           HG2      GLU  96  15.964  18.210   4.860
    6    HG3  GLU  96           HG3      GLU  96  17.263  18.188   6.043

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LEU  97           H        LEU  97  14.161  16.018   7.784
    2    HA   LEU  97           HA       LEU  97  13.786  18.756   8.434
    3    HB2  LEU  97           HB2      LEU  97  12.229  16.251   9.040
    4    HB3  LEU  97           HB3      LEU  97  11.740  17.804   9.716
    5    HG   LEU  97           HG       LEU  97  12.217  17.389   6.750
    6   HD12  LEU  97          HD11      LEU  97   9.692  17.300   6.631
    7   HD11  LEU  97          HD12      LEU  97   9.682  17.095   8.381
    8   HD13  LEU  97          HD13      LEU  97  10.445  15.879   7.356
    9   HD23  LEU  97          HD21      LEU  97  10.509  19.379   6.788
   10   HD22  LEU  97          HD22      LEU  97  12.195  19.712   7.182
   11   HD21  LEU  97          HD23      LEU  97  11.004  19.556   8.471

  No H/Q in entry =          11
  In of MODEL   40
    1    H    HIS  98           H        HIS  98  14.564  15.911  10.421
    2    HA   HIS  98           HA       HIS  98  14.425  17.167  12.941
    3    HB2  HIS  98           HB2      HIS  98  16.141  14.886  11.933
    4    HB3  HIS  98           HB3      HIS  98  16.147  15.420  13.615
    5    HD1  HIS  98           HD1      HIS  98  13.924  13.832  11.018
    6    HD2  HIS  98           HD2      HIS  98  13.830  14.741  15.086
    7    HE1  HIS  98           HE1      HIS  98  11.881  12.665  11.967
    8    HE2  HIS  98           HE2      HIS  98  11.804  13.211  14.440

  No H/Q in entry =           8
  In of MODEL   40
    1    H    GLU  99           H        GLU  99  16.977  17.020  10.506
    2    HA   GLU  99           HA       GLU  99  18.983  18.317  12.039
    3    HB2  GLU  99           HB2      GLU  99  19.442  17.028   9.966
    4    HB3  GLU  99           HB3      GLU  99  18.652  18.298   9.029
    5    HG2  GLU  99           HG2      GLU  99  20.285  19.941   9.824
    6    HG3  GLU  99           HG3      GLU  99  21.046  18.724  10.844

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LYS 100           H        LYS 100  16.477  19.524   9.826
    2    HA   LYS 100           HA       LYS 100  17.317  22.249   9.978
    3    HB2  LYS 100           HB2      LYS 100  14.664  21.003   9.220
    4    HB3  LYS 100           HB3      LYS 100  14.991  22.737   9.134
    5    HG2  LYS 100           HG2      LYS 100  16.956  22.262   7.666
    6    HG3  LYS 100           HG3      LYS 100  16.516  20.551   7.679
    7    HD2  LYS 100           HD2      LYS 100  14.329  21.098   6.680
    8    HD3  LYS 100           HD3      LYS 100  14.752  22.811   6.675
    9    HE2  LYS 100           HE2      LYS 100  16.703  22.304   5.214
   10    HE3  LYS 100           HE3      LYS 100  16.211  20.607   5.175
   11    HZ1  LYS 100           HZ1      LYS 100  14.421  22.831   4.347
   12    HZ3  LYS 100           HZ2      LYS 100  14.210  21.165   4.080
   13    HZ2  LYS 100           HZ3      LYS 100  15.435  22.010   3.261

  No H/Q in entry =          13
  In of MODEL   40
    1    H    LEU 101           H        LEU 101  15.188  20.230  11.937
    2    HA   LEU 101           HA       LEU 101  14.054  22.311  13.522
    3    HB2  LEU 101           HB2      LEU 101  14.450  19.354  13.897
    4    HB3  LEU 101           HB3      LEU 101  13.929  20.338  15.261
    5    HG   LEU 101           HG       LEU 101  12.513  20.457  12.592
    6   HD12  LEU 101          HD11      LEU 101  10.829  18.915  13.856
    7   HD11  LEU 101          HD12      LEU 101  12.217  18.477  14.850
    8   HD13  LEU 101          HD13      LEU 101  12.245  18.176  13.112
    9   HD21  LEU 101          HD21      LEU 101  11.868  21.251  15.447
   10   HD23  LEU 101          HD22      LEU 101  10.604  21.049  14.236
   11   HD22  LEU 101          HD23      LEU 101  11.858  22.265  14.002

  No H/Q in entry =          11
  In of MODEL   40
    1    H    LYS 102           H        LYS 102  17.191  21.655  13.083
    2    HA   LYS 102           HA       LYS 102  19.052  22.493  14.158
    3    HB2  LYS 102           HB2      LYS 102  17.262  24.033  15.297
    4    HB3  LYS 102           HB3      LYS 102  17.452  22.963  16.670
    5    HG2  LYS 102           HG2      LYS 102  19.377  24.947  15.507
    6    HG3  LYS 102           HG3      LYS 102  18.990  24.634  17.185
    7    HD2  LYS 102           HD2      LYS 102  20.626  22.700  15.493
    8    HD3  LYS 102           HD3      LYS 102  21.337  24.008  16.430
    9    HE2  LYS 102           HE2      LYS 102  20.898  21.463  17.391
   10    HE3  LYS 102           HE3      LYS 102  21.139  22.898  18.386
   11    HZ2  LYS 102           HZ1      LYS 102  19.151  21.644  19.001
   12    HZ1  LYS 102           HZ2      LYS 102  18.510  21.889  17.452
   13    HZ3  LYS 102           HZ3      LYS 102  18.762  23.212  18.482

  No H/Q in entry =          13
  In of MODEL   40
    1    H    ALA 103           H        ALA 103  16.955  20.913  16.575
    2    HA   ALA 103           HA       ALA 103  18.662  19.670  18.226
    3    HB2  ALA 103           HB1      ALA 103  17.046  17.688  18.215
    4    HB1  ALA 103           HB2      ALA 103  16.164  18.559  16.960
    5    HB3  ALA 103           HB3      ALA 103  16.354  19.272  18.561

  No H/Q in entry =           5
  In of MODEL   40
    1    H1   ALA   1           H3       ALA   1  -1.698  -6.736 -21.476
    2    H2   ALA   1           H2       ALA   1  -2.516  -8.159 -21.028
    3    H3   ALA   1           H1       ALA   1  -0.909  -8.234 -21.583
    4    HA   ALA   1           HA       ALA   1  -1.750  -8.683 -23.580
    5    HB1  ALA   1           HB1      ALA   1  -3.899  -9.367 -23.109
    6    HB2  ALA   1           HB2      ALA   1  -4.313  -7.847 -23.902
    7    HB3  ALA   1           HB3      ALA   1  -4.253  -7.934 -22.143

  No H/Q in entry =           7
  In of MODEL   40
    1    H    GLU   2           H        GLU   2  -2.561  -7.473 -25.566
    2    HA   GLU   2           HA       GLU   2  -1.129  -5.479 -26.437
    3    HB2  GLU   2           HB2      GLU   2  -4.137  -5.496 -26.755
    4    HB3  GLU   2           HB3      GLU   2  -3.002  -4.648 -27.802
    5    HG2  GLU   2           HG2      GLU   2  -2.529  -6.542 -28.963
    6    HG3  GLU   2           HG3      GLU   2  -2.247  -7.457 -27.488

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLU   3           H        GLU   3  -4.268  -4.173 -25.533
    2    HA   GLU   3           HA       GLU   3  -3.179  -1.637 -24.896
    3    HB2  GLU   3           HB2      GLU   3  -5.889  -2.908 -24.569
    4    HB3  GLU   3           HB3      GLU   3  -5.564  -1.300 -23.917
    5    HG2  GLU   3           HG2      GLU   3  -5.192  -0.372 -26.040
    6    HG3  GLU   3           HG3      GLU   3  -4.823  -1.931 -26.769

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LEU   4           H        LEU   4  -4.809  -3.976 -22.724
    2    HA   LEU   4           HA       LEU   4  -4.425  -2.762 -20.329
    3    HB2  LEU   4           HB2      LEU   4  -3.930  -5.711 -20.808
    4    HB3  LEU   4           HB3      LEU   4  -4.324  -4.963 -19.262
    5    HG   LEU   4           HG       LEU   4  -6.097  -4.999 -21.727
    6   HD13  LEU   4          HD11      LEU   4  -7.319  -6.700 -20.735
    7   HD12  LEU   4          HD12      LEU   4  -6.827  -6.254 -19.102
    8   HD11  LEU   4          HD13      LEU   4  -5.705  -7.112 -20.156
    9   HD23  LEU   4          HD21      LEU   4  -7.768  -4.166 -19.856
   10   HD22  LEU   4          HD22      LEU   4  -6.711  -3.010 -20.663
   11   HD21  LEU   4          HD23      LEU   4  -6.295  -3.612 -19.059

  No H/Q in entry =          11
  In of MODEL   40
    1    H    GLU   5           H        GLU   5  -1.957  -4.641 -22.066
    2    HA   GLU   5           HA       GLU   5   0.031  -4.397 -20.028
    3    HB2  GLU   5           HB2      GLU   5   0.078  -6.165 -21.774
    4    HB3  GLU   5           HB3      GLU   5   0.387  -4.927 -22.992
    5    HG2  GLU   5           HG2      GLU   5   2.161  -5.157 -20.572
    6    HG3  GLU   5           HG3      GLU   5   2.418  -6.207 -21.964

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLU   6           H        GLU   6  -0.576  -2.663 -23.067
    2    HA   GLU   6           HA       GLU   6   1.624  -0.868 -22.793
    3    HB2  GLU   6           HB2      GLU   6   0.490  -1.324 -24.955
    4    HB3  GLU   6           HB3      GLU   6  -0.949  -0.506 -24.347
    5    HG2  GLU   6           HG2      GLU   6   0.292   1.098 -25.650
    6    HG3  GLU   6           HG3      GLU   6   0.486   1.535 -23.954

  No H/Q in entry =           6
  In of MODEL   40
    1    H    VAL   7           H        VAL   7  -1.715  -0.888 -21.748
    2    HA   VAL   7           HA       VAL   7  -1.891   1.825 -20.903
    3    HB   VAL   7           HB       VAL   7  -3.395  -0.670 -20.075
    4   HG11  VAL   7          HG11      VAL   7  -3.722   2.221 -19.251
    5   HG13  VAL   7          HG12      VAL   7  -3.647   0.792 -18.221
    6   HG12  VAL   7          HG13      VAL   7  -5.074   1.089 -19.213
    7   HG21  VAL   7          HG21      VAL   7  -3.534   0.416 -22.460
    8   HG23  VAL   7          HG22      VAL   7  -4.459   1.678 -21.644
    9   HG22  VAL   7          HG23      VAL   7  -5.032   0.010 -21.623

  No H/Q in entry =           9
  In of MODEL   40
    1    H    VAL   8           H        VAL   8  -0.954  -1.181 -19.270
    2    HA   VAL   8           HA       VAL   8  -0.618  -0.116 -16.670
    3    HB   VAL   8           HB       VAL   8   0.747  -2.451 -18.035
    4   HG12  VAL   8          HG11      VAL   8   1.137  -3.124 -15.572
    5   HG11  VAL   8          HG12      VAL   8   0.831  -1.429 -15.193
    6   HG13  VAL   8          HG13      VAL   8   2.181  -1.868 -16.239
    7   HG23  VAL   8          HG21      VAL   8  -1.226  -2.868 -15.844
    8   HG22  VAL   8          HG22      VAL   8  -1.048  -3.723 -17.373
    9   HG21  VAL   8          HG23      VAL   8  -1.906  -2.187 -17.321

  No H/Q in entry =           9
  In of MODEL   40
    1    H    MET   9           H        MET   9   1.626  -0.445 -19.419
    2    HA   MET   9           HA       MET   9   3.929   0.555 -18.154
    3    HB2  MET   9           HB2      MET   9   2.981   0.604 -21.017
    4    HB3  MET   9           HB3      MET   9   4.507   1.348 -20.540
    5    HG2  MET   9           HG2      MET   9   5.305  -0.775 -19.638
    6    HG3  MET   9           HG3      MET   9   3.751  -1.536 -19.985
    7    HE1  MET   9           HE1      MET   9   6.686   0.342 -21.159
    8    HE3  MET   9           HE2      MET   9   5.764   1.066 -22.474
    9    HE2  MET   9           HE3      MET   9   7.007  -0.130 -22.832

  No H/Q in entry =           9
  In of MODEL   40
    1    H    GLY  10           H        GLY  10   1.273   2.209 -19.825
    2    HA3  GLY  10           HA2      GLY  10   2.282   4.844 -19.572
    3    HA2  GLY  10           HA3      GLY  10   0.585   4.414 -19.778

  No H/Q in entry =           3
  In of MODEL   40
    1    H    LEU  11           H        LEU  11   0.159   2.886 -17.497
    2    HA   LEU  11           HA       LEU  11  -0.336   4.865 -15.531
    3    HB2  LEU  11           HB2      LEU  11  -0.322   1.848 -15.385
    4    HB3  LEU  11           HB3      LEU  11  -0.812   2.875 -14.039
    5    HG   LEU  11           HG       LEU  11  -2.049   3.021 -16.802
    6   HD13  LEU  11          HD11      LEU  11  -2.671   0.885 -16.054
    7   HD12  LEU  11          HD12      LEU  11  -4.003   1.899 -15.504
    8   HD11  LEU  11          HD13      LEU  11  -2.756   1.393 -14.366
    9   HD22  LEU  11          HD21      LEU  11  -2.604   5.043 -15.788
   10   HD21  LEU  11          HD22      LEU  11  -2.541   4.370 -14.159
   11   HD23  LEU  11          HD23      LEU  11  -3.923   4.032 -15.202

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  12           H        ILE  12   2.163   2.355 -15.783
    2    HA   ILE  12           HA       ILE  12   3.378   2.862 -13.278
    3    HB   ILE  12           HB       ILE  12   4.611   1.808 -15.845
    4   HG12  ILE  12          HG12      ILE  12   2.580   0.610 -14.697
    5   HG13  ILE  12          HG13      ILE  12   3.960  -0.349 -15.192
    6   HG22  ILE  12          HG21      ILE  12   6.278   0.756 -14.275
    7   HG21  ILE  12          HG22      ILE  12   5.591   1.726 -12.972
    8   HG23  ILE  12          HG23      ILE  12   6.373   2.515 -14.340
    9   HD13  ILE  12          HD11      ILE  12   4.789  -0.385 -12.916
   10   HD12  ILE  12          HD12      ILE  12   3.097  -0.877 -12.899
   11   HD11  ILE  12          HD13      ILE  12   3.543   0.742 -12.407

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  13           H        ILE  13   4.001   4.126 -16.530
    2    HA   ILE  13           HA       ILE  13   6.169   5.805 -15.801
    3    HB   ILE  13           HB       ILE  13   4.139   5.928 -18.045
    4   HG12  ILE  13          HG12      ILE  13   5.926   4.051 -17.790
    5   HG13  ILE  13          HG13      ILE  13   5.730   4.827 -19.356
    6   HG23  ILE  13          HG21      ILE  13   4.836   8.173 -17.908
    7   HG22  ILE  13          HG22      ILE  13   5.928   7.489 -19.107
    8   HG21  ILE  13          HG23      ILE  13   6.485   7.741 -17.454
    9   HD11  ILE  13          HD11      ILE  13   7.733   5.972 -17.423
   10   HD13  ILE  13          HD12      ILE  13   7.734   5.991 -19.183
   11   HD12  ILE  13          HD13      ILE  13   8.141   4.511 -18.323

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ASN  14           H        ASN  14   2.671   6.363 -16.065
    2    HA   ASN  14           HA       ASN  14   2.679   9.107 -15.418
    3    HB2  ASN  14           HB2      ASN  14   0.756   7.503 -16.253
    4    HB3  ASN  14           HB3      ASN  14   0.432   7.324 -14.533
    5   HD21  ASN  14          HD21      ASN  14  -1.567   8.521 -15.960
    6   HD22  ASN  14          HD22      ASN  14  -1.600  10.194 -15.687

  No H/Q in entry =           6
  In of MODEL   40
    1    H    SER  15           H        SER  15   2.333   6.229 -13.351
    2    HA   SER  15           HA       SER  15   2.052   7.596 -10.898
    3    HB2  SER  15           HB2      SER  15   2.562   5.497  -9.856
    4    HB3  SER  15           HB3      SER  15   1.730   5.096 -11.355
    5    HG   SER  15           HG       SER  15   3.448   4.015 -11.843

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLY  16           H        GLY  16   4.907   6.455 -12.663
    2    HA3  GLY  16           HA2      GLY  16   6.846   7.171 -10.731
    3    HA2  GLY  16           HA3      GLY  16   7.145   6.969 -12.455

  No H/Q in entry =           3
  In of MODEL   40
    1    H    GLN  17           H        GLN  17   5.489   8.959 -13.510
    2    HA   GLN  17           HA       GLN  17   7.107  11.272 -13.195
    3    HB2  GLN  17           HB2      GLN  17   4.348  10.898 -14.393
    4    HB3  GLN  17           HB3      GLN  17   5.238  12.419 -14.463
    5    HG2  GLN  17           HG2      GLN  17   6.269   9.772 -15.519
    6    HG3  GLN  17           HG3      GLN  17   5.553  11.039 -16.513
    7   HE21  GLN  17          HE21      GLN  17   8.497   9.857 -15.911
    8   HE22  GLN  17          HE22      GLN  17   9.422  11.281 -15.902

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ALA  18           H        ALA  18   3.990  10.303 -11.847
    2    HA   ALA  18           HA       ALA  18   3.306  12.699 -10.573
    3    HB1  ALA  18           HB1      ALA  18   2.136  10.262 -10.803
    4    HB2  ALA  18           HB2      ALA  18   1.609  11.487  -9.651
    5    HB3  ALA  18           HB3      ALA  18   2.677  10.185  -9.127

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ARG  19           H        ARG  19   5.135   9.900  -9.304
    2    HA   ARG  19           HA       ARG  19   5.688  11.040  -6.779
    3    HB2  ARG  19           HB2      ARG  19   6.062   8.633  -7.314
    4    HB3  ARG  19           HB3      ARG  19   7.425   9.100  -8.335
    5    HG2  ARG  19           HG2      ARG  19   8.562  10.115  -6.409
    6    HG3  ARG  19           HG3      ARG  19   7.181   9.746  -5.378
    7    HD2  ARG  19           HD2      ARG  19   8.916   8.080  -5.027
    8    HD3  ARG  19           HD3      ARG  19   7.529   7.324  -5.815
    9    HE   ARG  19           HE       ARG  19   9.246   8.122  -7.860
   10   HH21  ARG  19          HH11      ARG  19  10.783   6.694  -8.716
   11   HH22  ARG  19          HH12      ARG  19  11.306   5.334  -7.786
   12   HH11  ARG  19          HH21      ARG  19   9.286   6.081  -5.089
   13   HH12  ARG  19          HH22      ARG  19  10.456   4.987  -5.731

  No H/Q in entry =          13
  In of MODEL   40
    1    H    SER  20           H        SER  20   7.504  11.051  -9.829
    2    HA   SER  20           HA       SER  20   9.771  12.428  -9.001
    3    HB2  SER  20           HB2      SER  20   9.225  11.415 -11.316
    4    HB3  SER  20           HB3      SER  20   8.474  12.968 -11.661
    5    HG   SER  20           HG       SER  20  11.152  12.503 -10.837

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU  21           H        LEU  21   6.692  13.750 -10.192
    2    HA   LEU  21           HA       LEU  21   7.406  16.484  -9.959
    3    HB2  LEU  21           HB2      LEU  21   4.766  15.030 -10.003
    4    HB3  LEU  21           HB3      LEU  21   4.847  16.774  -9.769
    5    HG   LEU  21           HG       LEU  21   6.139  15.334 -12.105
    6   HD13  LEU  21          HD11      LEU  21   3.774  15.012 -12.333
    7   HD12  LEU  21          HD12      LEU  21   4.198  16.355 -13.394
    8   HD11  LEU  21          HD13      LEU  21   3.435  16.671 -11.836
    9   HD22  LEU  21          HD21      LEU  21   7.212  17.399 -12.040
   10   HD21  LEU  21          HD22      LEU  21   5.856  18.213 -11.267
   11   HD23  LEU  21          HD23      LEU  21   5.794  17.847 -12.985

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ALA  22           H        ALA  22   5.860  14.210  -7.717
    2    HA   ALA  22           HA       ALA  22   5.286  16.020  -5.644
    3    HB3  ALA  22           HB1      ALA  22   4.488  13.640  -5.815
    4    HB2  ALA  22           HB2      ALA  22   5.084  14.098  -4.219
    5    HB1  ALA  22           HB3      ALA  22   6.092  13.127  -5.294

  No H/Q in entry =           5
  In of MODEL   40
    1    H    TYR  23           H        TYR  23   8.188  13.952  -6.091
    2    HA   TYR  23           HA       TYR  23   9.588  14.942  -3.836
    3    HB2  TYR  23           HB2      TYR  23  10.344  12.927  -5.001
    4    HB3  TYR  23           HB3      TYR  23  10.670  13.865  -6.458
    5    HD1  TYR  23           HD1      TYR  23  11.635  13.489  -2.871
    6    HD2  TYR  23           HD2      TYR  23  12.718  15.021  -6.738
    7    HE1  TYR  23           HE1      TYR  23  13.903  14.031  -2.024
    8    HE2  TYR  23           HE2      TYR  23  14.984  15.562  -5.888
    9    HH   TYR  23           HH       TYR  23  16.092  14.467  -2.780

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ALA  24           H        ALA  24   9.419  16.064  -7.198
    2    HA   ALA  24           HA       ALA  24  11.345  18.120  -6.946
    3    HB2  ALA  24           HB1      ALA  24  10.902  18.196  -9.154
    4    HB3  ALA  24           HB2      ALA  24   9.358  18.967  -8.791
    5    HB1  ALA  24           HB3      ALA  24   9.458  17.213  -8.927

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA  25           H        ALA  25   7.864  17.983  -6.323
    2    HA   ALA  25           HA       ALA  25   7.423  20.706  -5.745
    3    HB1  ALA  25           HB1      ALA  25   5.734  18.731  -5.952
    4    HB2  ALA  25           HB2      ALA  25   5.385  20.021  -4.799
    5    HB3  ALA  25           HB3      ALA  25   6.053  18.489  -4.233

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU  26           H        LEU  26   8.455  18.005  -3.704
    2    HA   LEU  26           HA       LEU  26   8.581  19.426  -1.263
    3    HB2  LEU  26           HB2      LEU  26   8.643  17.008  -1.265
    4    HB3  LEU  26           HB3      LEU  26  10.113  16.999  -2.237
    5    HG   LEU  26           HG       LEU  26  11.344  18.095  -0.394
    6   HD12  LEU  26          HD11      LEU  26  10.119  18.112   1.867
    7   HD11  LEU  26          HD12      LEU  26   8.629  17.997   0.933
    8   HD13  LEU  26          HD13      LEU  26   9.693  19.389   0.728
    9   HD21  LEU  26          HD21      LEU  26   9.778  15.645   0.472
   10   HD23  LEU  26          HD22      LEU  26  11.301  16.185   1.170
   11   HD22  LEU  26          HD23      LEU  26  11.247  15.632  -0.502

  No H/Q in entry =          11
  In of MODEL   40
    1    H    LYS  27           H        LYS  27  10.988  18.829  -3.791
    2    HA   LYS  27           HA       LYS  27  13.189  20.037  -2.560
    3    HB2  LYS  27           HB2      LYS  27  13.272  18.696  -4.655
    4    HB3  LYS  27           HB3      LYS  27  12.524  20.040  -5.515
    5    HG2  LYS  27           HG2      LYS  27  14.409  21.500  -4.934
    6    HG3  LYS  27           HG3      LYS  27  15.153  20.194  -4.002
    7    HD2  LYS  27           HD2      LYS  27  15.277  18.812  -6.061
    8    HD3  LYS  27           HD3      LYS  27  14.578  20.142  -6.984
    9    HE2  LYS  27           HE2      LYS  27  16.485  21.582  -6.368
   10    HE3  LYS  27           HE3      LYS  27  17.187  20.255  -5.436
   11    HZ3  LYS  27           HZ1      LYS  27  18.177  20.349  -7.622
   12    HZ2  LYS  27           HZ2      LYS  27  16.649  20.253  -8.363
   13    HZ1  LYS  27           HZ3      LYS  27  17.255  18.932  -7.483

  No H/Q in entry =          13
  In of MODEL   40
    1    H    GLN  28           H        GLN  28  10.584  21.459  -4.503
    2    HA   GLN  28           HA       GLN  28  11.577  24.100  -4.648
    3    HB2  GLN  28           HB2      GLN  28   8.729  23.069  -4.534
    4    HB3  GLN  28           HB3      GLN  28   9.167  24.734  -4.912
    5    HG2  GLN  28           HG2      GLN  28  10.127  22.306  -6.454
    6    HG3  GLN  28           HG3      GLN  28   8.804  23.355  -6.958
    7   HE21  GLN  28          HE21      GLN  28  11.938  22.822  -7.690
    8   HE22  GLN  28          HE22      GLN  28  12.440  24.400  -8.066

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ALA  29           H        ALA  29   9.625  22.424  -2.216
    2    HA   ALA  29           HA       ALA  29   9.105  24.618  -0.527
    3    HB2  ALA  29           HB1      ALA  29   8.357  23.053   1.037
    4    HB1  ALA  29           HB2      ALA  29   9.563  21.855   0.567
    5    HB3  ALA  29           HB3      ALA  29   8.180  22.170  -0.479

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LYS  30           H        LYS  30  11.807  22.317  -0.605
    2    HA   LYS  30           HA       LYS  30  13.138  23.247   1.699
    3    HB2  LYS  30           HB2      LYS  30  14.216  21.955  -0.816
    4    HB3  LYS  30           HB3      LYS  30  15.204  22.298   0.606
    5    HG2  LYS  30           HG2      LYS  30  13.635  20.930   1.983
    6    HG3  LYS  30           HG3      LYS  30  12.744  20.524   0.512
    7    HD2  LYS  30           HD2      LYS  30  14.775  19.515  -0.454
    8    HD3  LYS  30           HD3      LYS  30  15.686  19.935   0.999
    9    HE2  LYS  30           HE2      LYS  30  14.164  18.518   2.350
   10    HE3  LYS  30           HE3      LYS  30  13.284  18.078   0.881
   11    HZ2  LYS  30           HZ1      LYS  30  15.056  16.475   1.636
   12    HZ1  LYS  30           HZ2      LYS  30  16.207  17.650   1.187
   13    HZ3  LYS  30           HZ3      LYS  30  15.163  16.982   0.021

  No H/Q in entry =          13
  In of MODEL   40
    1    H    GLN  31           H        GLN  31  13.041  24.463  -1.593
    2    HA   GLN  31           HA       GLN  31  15.218  26.328  -1.167
    3    HB2  GLN  31           HB2      GLN  31  13.174  26.407  -3.390
    4    HB3  GLN  31           HB3      GLN  31  14.802  27.083  -3.390
    5    HG2  GLN  31           HG2      GLN  31  15.231  24.380  -2.824
    6    HG3  GLN  31           HG3      GLN  31  13.926  24.346  -4.002
    7   HE21  GLN  31          HE21      GLN  31  16.759  23.519  -4.410
    8   HE22  GLN  31          HE22      GLN  31  17.342  24.489  -5.674

  No H/Q in entry =           8
  In of MODEL   40
    1    H    GLY  32           H        GLY  32  12.142  26.180  -0.020
    2    HA3  GLY  32           HA2      GLY  32  11.006  27.758   1.259
    3    HA2  GLY  32           HA3      GLY  32  12.146  28.982   0.712

  No H/Q in entry =           3
  In of MODEL   40
    1    H    ASP  33           H        ASP  33  10.757  27.103  -1.785
    2    HA   ASP  33           HA       ASP  33   9.120  29.398  -2.632
    3    HB2  ASP  33           HB2      ASP  33  10.182  26.971  -4.083
    4    HB3  ASP  33           HB3      ASP  33   9.044  28.102  -4.809

  No H/Q in entry =           4
  In of MODEL   40
    1    H    PHE  34           H        PHE  34   7.427  28.938  -1.069
    2    HA   PHE  34           HA       PHE  34   6.017  26.483  -0.980
    3    HB2  PHE  34           HB2      PHE  34   5.091  29.280  -0.290
    4    HB3  PHE  34           HB3      PHE  34   4.224  27.798   0.117
    5    HD1  PHE  34           HD1      PHE  34   6.504  30.165   1.337
    6    HD2  PHE  34           HD2      PHE  34   5.772  25.933   1.271
    7    HE1  PHE  34           HE1      PHE  34   7.893  29.891   3.372
    8    HE2  PHE  34           HE2      PHE  34   7.164  25.663   3.303
    9    HZ   PHE  34           HZ       PHE  34   8.218  27.643   4.353

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ALA  35           H        ALA  35   5.620  29.358  -2.981
    2    HA   ALA  35           HA       ALA  35   3.061  28.779  -4.006
    3    HB1  ALA  35           HB1      ALA  35   4.128  30.164  -6.040
    4    HB3  ALA  35           HB2      ALA  35   5.351  30.507  -4.816
    5    HB2  ALA  35           HB3      ALA  35   3.666  30.936  -4.523

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA  36           H        ALA  36   6.280  28.070  -5.365
    2    HA   ALA  36           HA       ALA  36   5.272  26.661  -7.612
    3    HB3  ALA  36           HB1      ALA  36   7.432  26.761  -8.230
    4    HB2  ALA  36           HB2      ALA  36   7.901  25.722  -6.883
    5    HB1  ALA  36           HB3      ALA  36   7.817  27.470  -6.662

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA  37           H        ALA  37   6.218  25.644  -4.362
    2    HA   ALA  37           HA       ALA  37   6.125  22.858  -4.800
    3    HB2  ALA  37           HB1      ALA  37   5.888  24.645  -2.415
    4    HB1  ALA  37           HB2      ALA  37   7.005  23.314  -2.713
    5    HB3  ALA  37           HB3      ALA  37   5.340  22.979  -2.241

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LYS  38           H        LYS  38   3.620  25.093  -3.622
    2    HA   LYS  38           HA       LYS  38   1.499  23.305  -3.404
    3    HB2  LYS  38           HB2      LYS  38   1.884  26.056  -3.144
    4    HB3  LYS  38           HB3      LYS  38   0.682  25.927  -4.423
    5    HG2  LYS  38           HG2      LYS  38  -0.782  24.617  -2.983
    6    HG3  LYS  38           HG3      LYS  38   0.462  24.538  -1.728
    7    HD2  LYS  38           HD2      LYS  38   0.305  26.875  -1.273
    8    HD3  LYS  38           HD3      LYS  38  -0.604  27.179  -2.754
    9    HE2  LYS  38           HE2      LYS  38  -2.106  27.226  -0.813
   10    HE3  LYS  38           HE3      LYS  38  -2.497  25.857  -1.859
   11    HZ3  LYS  38           HZ1      LYS  38  -1.788  24.373  -0.331
   12    HZ2  LYS  38           HZ2      LYS  38  -2.123  25.631   0.763
   13    HZ1  LYS  38           HZ3      LYS  38  -0.532  25.362   0.235

  No H/Q in entry =          13
  In of MODEL   40
    1    H    ALA  39           H        ALA  39   2.500  25.204  -6.247
    2    HA   ALA  39           HA       ALA  39   0.412  24.368  -7.951
    3    HB2  ALA  39           HB1      ALA  39   3.155  24.986  -9.005
    4    HB1  ALA  39           HB2      ALA  39   2.205  26.256  -8.235
    5    HB3  ALA  39           HB3      ALA  39   1.581  25.431  -9.663

  No H/Q in entry =           5
  In of MODEL   40
    1    H    MET  40           H        MET  40   3.635  23.028  -7.379
    2    HA   MET  40           HA       MET  40   3.511  21.016  -9.376
    3    HB2  MET  40           HB2      MET  40   5.127  21.212  -6.828
    4    HB3  MET  40           HB3      MET  40   5.362  19.957  -8.047
    5    HG2  MET  40           HG2      MET  40   5.454  22.914  -8.703
    6    HG3  MET  40           HG3      MET  40   6.890  21.993  -8.258
    7    HE3  MET  40           HE1      MET  40   7.733  19.776 -11.074
    8    HE2  MET  40           HE2      MET  40   7.167  19.458  -9.437
    9    HE1  MET  40           HE3      MET  40   8.279  20.793  -9.734

  No H/Q in entry =           9
  In of MODEL   40
    1    H    MET  41           H        MET  41   2.599  21.058  -5.951
    2    HA   MET  41           HA       MET  41   2.034  18.299  -5.682
    3    HB2  MET  41           HB2      MET  41   0.731  20.668  -4.322
    4    HB3  MET  41           HB3      MET  41   0.556  18.990  -3.820
    5    HG2  MET  41           HG2      MET  41   3.269  19.181  -3.858
    6    HG3  MET  41           HG3      MET  41   2.848  20.843  -3.457
    7    HE2  MET  41           HE1      MET  41  -0.205  19.621  -1.733
    8    HE1  MET  41           HE2      MET  41   0.629  21.126  -2.106
    9    HE3  MET  41           HE3      MET  41   0.565  20.550  -0.440

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ASP  42           H        ASP  42   0.027  21.050  -6.646
    2    HA   ASP  42           HA       ASP  42  -2.429  19.719  -6.785
    3    HB2  ASP  42           HB2      ASP  42  -1.693  22.281  -7.033
    4    HB3  ASP  42           HB3      ASP  42  -1.850  21.894  -8.743

  No H/Q in entry =           4
  In of MODEL   40
    1    H    GLN  43           H        GLN  43   0.016  20.289  -9.287
    2    HA   GLN  43           HA       GLN  43  -1.388  18.993 -11.379
    3    HB2  GLN  43           HB2      GLN  43   1.577  19.473 -10.998
    4    HB3  GLN  43           HB3      GLN  43   0.855  18.846 -12.482
    5    HG2  GLN  43           HG2      GLN  43  -0.634  20.891 -12.515
    6    HG3  GLN  43           HG3      GLN  43   0.328  21.532 -11.186
    7   HE21  GLN  43          HE21      GLN  43   0.506  23.157 -13.268
    8   HE22  GLN  43          HE22      GLN  43   1.918  22.922 -14.177

  No H/Q in entry =           8
  In of MODEL   40
    1    H    SER  44           H        SER  44   0.952  17.818  -8.994
    2    HA   SER  44           HA       SER  44   1.256  15.211 -10.028
    3    HB2  SER  44           HB2      SER  44   2.169  16.632  -7.787
    4    HB3  SER  44           HB3      SER  44   1.291  15.256  -7.120
    5    HG   SER  44           HG       SER  44   3.395  14.614  -7.551

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ARG  45           H        ARG  45  -1.047  16.548  -7.684
    2    HA   ARG  45           HA       ARG  45  -2.460  14.201  -7.055
    3    HB2  ARG  45           HB2      ARG  45  -2.633  16.367  -5.856
    4    HB3  ARG  45           HB3      ARG  45  -3.482  17.048  -7.240
    5    HG2  ARG  45           HG2      ARG  45  -5.267  15.341  -6.961
    6    HG3  ARG  45           HG3      ARG  45  -4.429  14.715  -5.541
    7    HD2  ARG  45           HD2      ARG  45  -4.609  16.981  -4.477
    8    HD3  ARG  45           HD3      ARG  45  -5.591  17.516  -5.857
    9    HE   ARG  45           HE       ARG  45  -6.727  15.149  -4.824
   10   HH21  ARG  45          HH11      ARG  45  -8.561  15.241  -3.552
   11   HH22  ARG  45          HH12      ARG  45  -8.939  16.682  -2.678
   12   HH11  ARG  45          HH21      ARG  45  -6.144  18.386  -3.790
   13   HH12  ARG  45          HH22      ARG  45  -7.566  18.464  -2.811

  No H/Q in entry =          13
  In of MODEL   40
    1    H    MET  46           H        MET  46  -3.019  16.620  -9.598
    2    HA   MET  46           HA       MET  46  -5.372  15.477 -10.661
    3    HB2  MET  46           HB2      MET  46  -3.251  17.284 -11.831
    4    HB3  MET  46           HB3      MET  46  -4.639  16.746 -12.781
    5    HG2  MET  46           HG2      MET  46  -6.168  17.672 -11.091
    6    HG3  MET  46           HG3      MET  46  -4.797  18.194 -10.120
    7    HE3  MET  46           HE1      MET  46  -4.060  21.566 -11.249
    8    HE2  MET  46           HE2      MET  46  -3.234  20.136 -10.638
    9    HE1  MET  46           HE3      MET  46  -4.784  20.613  -9.947

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ALA  47           H        ALA  47  -1.949  14.962 -11.423
    2    HA   ALA  47           HA       ALA  47  -2.314  13.246 -13.639
    3    HB3  ALA  47           HB1      ALA  47  -0.127  14.111 -13.286
    4    HB2  ALA  47           HB2      ALA  47  -0.004  12.380 -12.958
    5    HB1  ALA  47           HB3      ALA  47  -0.084  13.529 -11.621

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU  48           H        LEU  48  -2.049  12.596 -10.167
    2    HA   LEU  48           HA       LEU  48  -2.174   9.758 -10.335
    3    HB2  LEU  48           HB2      LEU  48  -2.916  11.677  -8.114
    4    HB3  LEU  48           HB3      LEU  48  -2.841   9.925  -7.919
    5    HG   LEU  48           HG       LEU  48  -0.524  11.603  -8.913
    6   HD13  LEU  48          HD11      LEU  48  -0.797  12.369  -6.719
    7   HD12  LEU  48          HD12      LEU  48   0.352  11.049  -6.526
    8   HD11  LEU  48          HD13      LEU  48  -1.349  10.803  -6.128
    9   HD22  LEU  48          HD21      LEU  48  -0.049   9.414  -9.561
   10   HD21  LEU  48          HD22      LEU  48  -0.926   8.704  -8.206
   11   HD23  LEU  48          HD23      LEU  48   0.655   9.439  -7.945

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ASN  49           H        ASN  49  -4.610  12.275  -9.923
    2    HA   ASN  49           HA       ASN  49  -6.813  10.632  -9.388
    3    HB2  ASN  49           HB2      ASN  49  -6.848  13.052  -9.054
    4    HB3  ASN  49           HB3      ASN  49  -6.678  13.320 -10.785
    5   HD21  ASN  49          HD21      ASN  49  -8.851  14.514  -9.730
    6   HD22  ASN  49          HD22      ASN  49 -10.274  13.658 -10.074

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLU  50           H        GLU  50  -5.523  11.825 -12.472
    2    HA   GLU  50           HA       GLU  50  -7.491  10.596 -14.121
    3    HB2  GLU  50           HB2      GLU  50  -6.007  12.401 -14.930
    4    HB3  GLU  50           HB3      GLU  50  -4.624  11.314 -14.796
    5    HG2  GLU  50           HG2      GLU  50  -5.615   9.794 -16.437
    6    HG3  GLU  50           HG3      GLU  50  -7.065  10.788 -16.521

  No H/Q in entry =           6
  In of MODEL   40
    1    H    ALA  51           H        ALA  51  -4.331   9.566 -12.920
    2    HA   ALA  51           HA       ALA  51  -4.218   7.116 -14.346
    3    HB2  ALA  51           HB1      ALA  51  -2.240   6.804 -13.248
    4    HB1  ALA  51           HB2      ALA  51  -2.923   7.228 -11.678
    5    HB3  ALA  51           HB3      ALA  51  -2.454   8.498 -12.809

  No H/Q in entry =           5
  In of MODEL   40
    1    H    HIS  52           H        HIS  52  -5.381   7.950 -11.094
    2    HA   HIS  52           HA       HIS  52  -6.094   5.345 -10.270
    3    HB2  HIS  52           HB2      HIS  52  -5.932   7.320  -8.766
    4    HB3  HIS  52           HB3      HIS  52  -7.404   7.961  -9.495
    5    HD1  HIS  52           HD1      HIS  52  -9.634   6.664  -9.035
    6    HD2  HIS  52           HD2      HIS  52  -6.335   5.172  -6.968
    7    HE1  HIS  52           HE1      HIS  52 -10.545   5.101  -7.262
    8    HE2  HIS  52           HE2      HIS  52  -8.546   4.183  -5.993

  No H/Q in entry =           8
  In of MODEL   40
    1    H    LEU  53           H        LEU  53  -7.888   7.828 -12.049
    2    HA   LEU  53           HA       LEU  53 -10.407   6.564 -12.065
    3    HB2  LEU  53           HB2      LEU  53  -9.102   8.537 -13.927
    4    HB3  LEU  53           HB3      LEU  53 -10.707   7.889 -14.254
    5    HG   LEU  53           HG       LEU  53  -9.979   9.192 -11.610
    6   HD12  LEU  53          HD11      LEU  53 -11.130  11.207 -12.486
    7   HD11  LEU  53          HD12      LEU  53 -11.268  10.427 -14.063
    8   HD13  LEU  53          HD13      LEU  53  -9.682  10.833 -13.413
    9   HD22  LEU  53          HD21      LEU  53 -11.990   8.005 -11.288
   10   HD21  LEU  53          HD22      LEU  53 -12.526   8.285 -12.941
   11   HD23  LEU  53          HD23      LEU  53 -12.588   9.586 -11.768

  No H/Q in entry =          11
  In of MODEL   40
    1    H    VAL  54           H        VAL  54  -7.660   6.343 -14.304
    2    HA   VAL  54           HA       VAL  54  -8.903   4.592 -16.152
    3    HB   VAL  54           HB       VAL  54  -5.989   5.063 -15.469
    4   HG12  VAL  54          HG11      VAL  54  -5.755   3.983 -17.862
    5   HG11  VAL  54          HG12      VAL  54  -7.292   3.218 -17.460
    6   HG13  VAL  54          HG13      VAL  54  -5.879   2.945 -16.443
    7   HG22  VAL  54          HG21      VAL  54  -6.737   7.018 -16.508
    8   HG21  VAL  54          HG22      VAL  54  -7.941   6.172 -17.478
    9   HG23  VAL  54          HG23      VAL  54  -6.235   6.074 -17.909

  No H/Q in entry =           9
  In of MODEL   40
    1    H    GLN  55           H        GLN  55  -6.909   4.014 -13.255
    2    HA   GLN  55           HA       GLN  55  -6.852   1.197 -13.520
    3    HB2  GLN  55           HB2      GLN  55  -5.286   2.071 -11.999
    4    HB3  GLN  55           HB3      GLN  55  -6.491   3.048 -11.166
    5    HG2  GLN  55           HG2      GLN  55  -7.199   1.295  -9.853
    6    HG3  GLN  55           HG3      GLN  55  -6.988   0.109 -11.135
    7   HE21  GLN  55          HE21      GLN  55  -5.381  -1.361 -10.646
    8   HE22  GLN  55          HE22      GLN  55  -3.993  -1.028  -9.733

  No H/Q in entry =           8
  In of MODEL   40
    1    H    THR  56           H        THR  56  -9.158   3.381 -11.898
    2    HA   THR  56           HA       THR  56 -10.763   1.512 -10.614
    3    HB   THR  56           HB       THR  56 -11.831   3.918 -12.113
    4    HG1  THR  56           HG1      THR  56 -10.023   3.773 -10.140
    5   HG23  THR  56          HG21      THR  56 -13.632   3.840 -10.620
    6   HG22  THR  56          HG22      THR  56 -12.743   2.868  -9.447
    7   HG21  THR  56          HG23      THR  56 -13.329   2.133 -10.940

  No H/Q in entry =           7
  In of MODEL   40
    1    H    LYS  57           H        LYS  57 -10.953   2.608 -13.997
    2    HA   LYS  57           HA       LYS  57 -13.129   0.948 -14.755
    3    HB2  LYS  57           HB2      LYS  57 -12.193   2.905 -16.053
    4    HB3  LYS  57           HB3      LYS  57 -10.806   1.904 -16.460
    5    HG2  LYS  57           HG2      LYS  57 -13.478   0.739 -17.033
    6    HG3  LYS  57           HG3      LYS  57 -12.988   2.095 -18.041
    7    HD2  LYS  57           HD2      LYS  57 -10.880   0.915 -18.593
    8    HD3  LYS  57           HD3      LYS  57 -11.390  -0.453 -17.607
    9    HE2  LYS  57           HE2      LYS  57 -13.366  -0.774 -19.059
   10    HE3  LYS  57           HE3      LYS  57 -12.877   0.598 -20.052
   11    HZ1  LYS  57           HZ1      LYS  57 -10.745  -0.616 -20.429
   12    HZ3  LYS  57           HZ2      LYS  57 -12.117  -1.344 -21.118
   13    HZ2  LYS  57           HZ3      LYS  57 -11.446  -1.970 -19.688

  No H/Q in entry =          13
  In of MODEL   40
    1    H    LEU  58           H        LEU  58  -9.630   0.476 -14.700
    2    HA   LEU  58           HA       LEU  58  -9.667  -2.037 -15.996
    3    HB2  LEU  58           HB2      LEU  58  -7.618  -0.774 -14.184
    4    HB3  LEU  58           HB3      LEU  58  -7.375  -2.296 -15.043
    5    HG   LEU  58           HG       LEU  58  -8.098   0.321 -16.399
    6   HD11  LEU  58          HD11      LEU  58  -5.467  -0.949 -15.711
    7   HD13  LEU  58          HD12      LEU  58  -5.942   0.748 -15.657
    8   HD12  LEU  58          HD13      LEU  58  -5.611  -0.023 -17.206
    9   HD22  LEU  58          HD21      LEU  58  -8.692  -1.230 -17.994
   10   HD21  LEU  58          HD22      LEU  58  -7.666  -2.491 -17.316
   11   HD23  LEU  58          HD23      LEU  58  -6.960  -1.223 -18.318

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  59           H        ILE  59 -10.478  -1.134 -12.742
    2    HA   ILE  59           HA       ILE  59 -10.159  -3.907 -11.802
    3    HB   ILE  59           HB       ILE  59  -9.687  -1.651 -10.397
    4   HG12  ILE  59          HG12      ILE  59 -11.091  -3.980  -9.071
    5   HG13  ILE  59          HG13      ILE  59  -9.455  -4.094  -9.668
    6   HG22  ILE  59          HG21      ILE  59 -12.463  -2.338  -9.470
    7   HG21  ILE  59          HG22      ILE  59 -12.214  -1.087 -10.665
    8   HG23  ILE  59          HG23      ILE  59 -11.499  -0.939  -9.062
    9   HD12  ILE  59          HD11      ILE  59  -9.483  -3.500  -7.285
   10   HD11  ILE  59          HD12      ILE  59 -10.426  -2.063  -7.657
   11   HD13  ILE  59          HD13      ILE  59  -8.770  -2.208  -8.246

  No H/Q in entry =          11
  In of MODEL   40
    1    H    GLU  60           H        GLU  60 -12.690  -1.561 -12.604
    2    HA   GLU  60           HA       GLU  60 -14.892  -3.055 -11.596
    3    HB2  GLU  60           HB2      GLU  60 -15.498  -0.876 -12.077
    4    HB3  GLU  60           HB3      GLU  60 -14.522  -0.816 -13.541
    5    HG2  GLU  60           HG2      GLU  60 -17.052  -0.872 -13.895
    6    HG3  GLU  60           HG3      GLU  60 -16.135  -2.078 -14.775

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLY  61           H        GLY  61 -13.218  -3.050 -14.710
    2    HA3  GLY  61           HA2      GLY  61 -14.957  -5.273 -15.607
    3    HA2  GLY  61           HA3      GLY  61 -14.099  -4.175 -16.682

  No H/Q in entry =           3
  In of MODEL   40
    1    H    ASP  62           H        ASP  62 -12.743  -5.648 -13.801
    2    HA   ASP  62           HA       ASP  62 -10.405  -6.510 -15.105
    3    HB2  ASP  62           HB2      ASP  62 -10.757  -6.029 -12.635
    4    HB3  ASP  62           HB3      ASP  62 -11.515  -7.614 -12.522

  No H/Q in entry =           4
  In of MODEL   40
    1    H    ALA  63           H        ALA  63 -11.516  -7.656 -16.994
    2    HA   ALA  63           HA       ALA  63 -12.838 -10.165 -16.642
    3    HB3  ALA  63           HB1      ALA  63 -12.254 -10.496 -19.053
    4    HB2  ALA  63           HB2      ALA  63 -11.224  -9.068 -18.974
    5    HB1  ALA  63           HB3      ALA  63 -12.968  -8.913 -18.750

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLY  64           H        GLY  64  -9.479  -9.220 -17.112
    2    HA3  GLY  64           HA2      GLY  64  -7.527 -10.312 -16.526
    3    HA2  GLY  64           HA3      GLY  64  -8.493 -11.642 -15.900

  No H/Q in entry =           3
  In of MODEL   40
    1    H    GLU  65           H        GLU  65  -6.389 -12.541 -17.138
    2    HA   GLU  65           HA       GLU  65  -6.494 -12.701 -19.953
    3    HB2  GLU  65           HB2      GLU  65  -5.172 -14.497 -17.921
    4    HB3  GLU  65           HB3      GLU  65  -4.944 -14.647 -19.664
    5    HG2  GLU  65           HG2      GLU  65  -4.080 -12.370 -19.790
    6    HG3  GLU  65           HG3      GLU  65  -4.398 -12.127 -18.073

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLY  66           H        GLY  66  -7.727 -14.802 -17.455
    2    HA3  GLY  66           HA2      GLY  66  -9.017 -16.561 -19.417
    3    HA2  GLY  66           HA3      GLY  66  -8.724 -16.949 -17.734

  No H/Q in entry =           3
  In of MODEL   40
    1    H    LYS  67           H        LYS  67 -11.000 -17.654 -17.987
    2    HA   LYS  67           HA       LYS  67 -13.154 -15.974 -18.433
    3    HB2  LYS  67           HB2      LYS  67 -12.926 -18.453 -16.733
    4    HB3  LYS  67           HB3      LYS  67 -14.462 -17.685 -17.156
    5    HG2  LYS  67           HG2      LYS  67 -13.943 -17.910 -19.546
    6    HG3  LYS  67           HG3      LYS  67 -12.383 -18.632 -19.154
    7    HD2  LYS  67           HD2      LYS  67 -13.567 -20.500 -18.010
    8    HD3  LYS  67           HD3      LYS  67 -15.108 -19.791 -18.501
    9    HE2  LYS  67           HE2      LYS  67 -12.913 -20.588 -20.436
   10    HE3  LYS  67           HE3      LYS  67 -14.308 -21.596 -20.053
   11    HZ2  LYS  67           HZ1      LYS  67 -14.175 -19.105 -21.576
   12    HZ1  LYS  67           HZ2      LYS  67 -15.571 -19.389 -20.652
   13    HZ3  LYS  67           HZ3      LYS  67 -15.106 -20.494 -21.853

  No H/Q in entry =          13
  In of MODEL   40
    1    H    MET  68           H        MET  68 -13.259 -17.304 -15.297
    2    HA   MET  68           HA       MET  68 -14.304 -15.008 -14.054
    3    HB2  MET  68           HB2      MET  68 -13.243 -17.624 -13.024
    4    HB3  MET  68           HB3      MET  68 -13.853 -16.376 -11.938
    5    HG2  MET  68           HG2      MET  68 -16.007 -16.377 -13.114
    6    HG3  MET  68           HG3      MET  68 -15.400 -17.584 -14.248
    7    HE1  MET  68           HE1      MET  68 -16.303 -16.537 -10.855
    8    HE3  MET  68           HE2      MET  68 -14.926 -17.396 -10.170
    9    HE2  MET  68           HE3      MET  68 -16.560 -17.988  -9.875

  No H/Q in entry =           9
  In of MODEL   40
    1    H    LYS  69           H        LYS  69 -10.985 -16.343 -13.952
    2    HA   LYS  69           HA       LYS  69  -9.871 -14.990 -11.893
    3    HB2  LYS  69           HB2      LYS  69  -8.700 -15.595 -14.603
    4    HB3  LYS  69           HB3      LYS  69  -7.732 -14.980 -13.261
    5    HG2  LYS  69           HG2      LYS  69  -8.463 -16.882 -11.861
    6    HG3  LYS  69           HG3      LYS  69  -9.423 -17.499 -13.205
    7    HD2  LYS  69           HD2      LYS  69  -7.377 -17.744 -14.561
    8    HD3  LYS  69           HD3      LYS  69  -6.413 -17.127 -13.217
    9    HE2  LYS  69           HE2      LYS  69  -7.170 -19.009 -11.808
   10    HE3  LYS  69           HE3      LYS  69  -8.133 -19.626 -13.149
   11    HZ2  LYS  69           HZ1      LYS  69  -5.572 -20.303 -12.636
   12    HZ1  LYS  69           HZ2      LYS  69  -5.385 -19.108 -13.829
   13    HZ3  LYS  69           HZ3      LYS  69  -6.341 -20.479 -14.138

  No H/Q in entry =          13
  In of MODEL   40
    1    H    VAL  70           H        VAL  70  -7.858 -13.288 -12.519
    2    HA   VAL  70           HA       VAL  70  -9.138 -10.858 -13.625
    3    HB   VAL  70           HB       VAL  70  -8.033  -9.591 -11.768
    4   HG11  VAL  70          HG11      VAL  70 -10.057 -11.727 -11.035
    5   HG13  VAL  70          HG12      VAL  70 -10.404 -10.099 -11.620
    6   HG12  VAL  70          HG13      VAL  70  -9.689 -10.328 -10.025
    7   HG22  VAL  70          HG21      VAL  70  -7.163 -10.781  -9.835
    8   HG21  VAL  70          HG22      VAL  70  -6.357 -11.425 -11.264
    9   HG23  VAL  70          HG23      VAL  70  -7.662 -12.334 -10.506

  No H/Q in entry =           9
  In of MODEL   40
    1    H    SER  71           H        SER  71  -7.581  -9.208 -14.244
    2    HA   SER  71           HA       SER  71  -5.364 -10.249 -15.718
    3    HB2  SER  71           HB2      SER  71  -6.686  -8.199 -16.351
    4    HB3  SER  71           HB3      SER  71  -5.932  -7.365 -14.996
    5    HG   SER  71           HG       SER  71  -4.726  -8.464 -17.309

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU  72           H        LEU  72  -3.347 -10.594 -15.063
    2    HA   LEU  72           HA       LEU  72  -2.625 -10.395 -12.350
    3    HB2  LEU  72           HB2      LEU  72  -0.979 -10.841 -14.835
    4    HB3  LEU  72           HB3      LEU  72  -0.313 -10.919 -13.208
    5    HG   LEU  72           HG       LEU  72  -2.690 -12.584 -14.095
    6   HD13  LEU  72          HD11      LEU  72  -1.142 -14.429 -14.420
    7   HD12  LEU  72          HD12      LEU  72   0.216 -13.426 -13.910
    8   HD11  LEU  72          HD13      LEU  72  -0.618 -13.077 -15.425
    9   HD23  LEU  72          HD21      LEU  72  -1.686 -14.010 -12.136
   10   HD22  LEU  72          HD22      LEU  72  -2.655 -12.603 -11.725
   11   HD21  LEU  72          HD23      LEU  72  -0.897 -12.508 -11.668

  No H/Q in entry =          11
  In of MODEL   40
    1    H    VAL  73           H        VAL  73  -1.884  -8.381 -15.126
    2    HA   VAL  73           HA       VAL  73   0.058  -6.708 -14.018
    3    HB   VAL  73           HB       VAL  73  -0.325  -5.276 -15.870
    4   HG13  VAL  73          HG11      VAL  73  -0.406  -6.872 -17.736
    5   HG12  VAL  73          HG12      VAL  73  -1.092  -8.099 -16.672
    6   HG11  VAL  73          HG13      VAL  73   0.555  -7.527 -16.411
    7   HG21  VAL  73          HG21      VAL  73  -3.093  -6.419 -15.716
    8   HG23  VAL  73          HG22      VAL  73  -2.493  -5.857 -17.275
    9   HG22  VAL  73          HG23      VAL  73  -2.589  -4.740 -15.913

  No H/Q in entry =           9
  In of MODEL   40
    1    H    LEU  74           H        LEU  74  -3.341  -6.784 -13.462
    2    HA   LEU  74           HA       LEU  74  -3.926  -4.122 -12.843
    3    HB2  LEU  74           HB2      LEU  74  -5.674  -5.769 -13.022
    4    HB3  LEU  74           HB3      LEU  74  -4.997  -6.698 -11.688
    5    HG   LEU  74           HG       LEU  74  -5.408  -4.751 -10.175
    6   HD12  LEU  74          HD11      LEU  74  -7.127  -3.087 -11.173
    7   HD11  LEU  74          HD12      LEU  74  -6.535  -3.633 -12.741
    8   HD13  LEU  74          HD13      LEU  74  -5.430  -2.862 -11.600
    9   HD22  LEU  74          HD21      LEU  74  -7.621  -5.333  -9.841
   10   HD21  LEU  74          HD22      LEU  74  -7.035  -6.671 -10.806
   11   HD23  LEU  74          HD23      LEU  74  -7.968  -5.405 -11.566

  No H/Q in entry =          11
  In of MODEL   40
    1    H    VAL  75           H        VAL  75  -2.918  -6.726 -10.687
    2    HA   VAL  75           HA       VAL  75  -2.701  -5.183  -8.340
    3    HB   VAL  75           HB       VAL  75  -1.241  -7.696  -9.138
    4   HG13  VAL  75          HG11      VAL  75   0.042  -6.481  -7.408
    5   HG12  VAL  75          HG12      VAL  75  -0.775  -7.856  -6.680
    6   HG11  VAL  75          HG13      VAL  75  -1.427  -6.241  -6.469
    7   HG22  VAL  75          HG21      VAL  75  -2.907  -8.740  -7.658
    8   HG21  VAL  75          HG22      VAL  75  -3.723  -7.835  -8.933
    9   HG23  VAL  75          HG23      VAL  75  -3.610  -7.162  -7.306

  No H/Q in entry =           9
  In of MODEL   40
    1    H    GLU  76           H        GLU  76  -0.301  -5.967 -10.877
    2    HA   GLU  76           HA       GLU  76   1.901  -4.650  -9.716
    3    HB2  GLU  76           HB2      GLU  76   2.072  -6.127 -11.708
    4    HB3  GLU  76           HB3      GLU  76   1.196  -4.937 -12.660
    5    HG2  GLU  76           HG2      GLU  76   3.540  -4.652 -13.141
    6    HG3  GLU  76           HG3      GLU  76   3.055  -3.281 -12.161

  No H/Q in entry =           6
  In of MODEL   40
    1    H    ALA  77           H        ALA  77  -0.615  -3.412 -11.903
    2    HA   ALA  77           HA       ALA  77   0.407  -0.778 -12.072
    3    HB1  ALA  77           HB1      ALA  77  -1.454  -1.963 -13.467
    4    HB3  ALA  77           HB2      ALA  77  -1.593  -0.232 -13.155
    5    HB2  ALA  77           HB3      ALA  77  -2.536  -1.377 -12.202

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLN  78           H        GLN  78  -1.881  -2.311  -9.866
    2    HA   GLN  78           HA       GLN  78  -2.660   0.014  -8.460
    3    HB2  GLN  78           HB2      GLN  78  -3.796  -2.233  -8.380
    4    HB3  GLN  78           HB3      GLN  78  -2.468  -2.809  -7.377
    5    HG2  GLN  78           HG2      GLN  78  -2.967  -1.069  -5.712
    6    HG3  GLN  78           HG3      GLN  78  -4.296  -0.486  -6.713
    7   HE21  GLN  78          HE21      GLN  78  -4.803  -1.443  -4.073
    8   HE22  GLN  78          HE22      GLN  78  -5.672  -2.896  -4.183

  No H/Q in entry =           8
  In of MODEL   40
    1    H    LEU  79           H        LEU  79  -0.009  -2.274  -8.013
    2    HA   LEU  79           HA       LEU  79   0.977  -1.395  -5.554
    3    HB2  LEU  79           HB2      LEU  79   1.824  -3.411  -6.626
    4    HB3  LEU  79           HB3      LEU  79   2.481  -2.464  -7.956
    5    HG   LEU  79           HG       LEU  79   4.050  -1.346  -6.449
    6   HD13  LEU  79          HD11      LEU  79   3.047  -1.094  -4.382
    7   HD12  LEU  79          HD12      LEU  79   4.110  -2.457  -4.041
    8   HD11  LEU  79          HD13      LEU  79   2.401  -2.736  -4.372
    9   HD23  LEU  79          HD21      LEU  79   5.235  -3.510  -5.551
   10   HD22  LEU  79          HD22      LEU  79   5.035  -3.305  -7.288
   11   HD21  LEU  79          HD23      LEU  79   3.944  -4.364  -6.399

  No H/Q in entry =          11
  In of MODEL   40
    1    H    HIS  80           H        HIS  80   1.861  -0.280  -8.823
    2    HA   HIS  80           HA       HIS  80   3.691   1.685  -7.896
    3    HB2  HIS  80           HB2      HIS  80   2.395   1.011 -10.481
    4    HB3  HIS  80           HB3      HIS  80   3.008   2.656 -10.306
    5    HD1  HIS  80           HD1      HIS  80   5.413   2.930 -10.826
    6    HD2  HIS  80           HD2      HIS  80   4.550  -0.974  -9.644
    7    HE1  HIS  80           HE1      HIS  80   7.589   1.630 -10.994
    8    HE2  HIS  80           HE2      HIS  80   7.074  -0.753 -10.277

  No H/Q in entry =           8
  In of MODEL   40
    1    H    LEU  81           H        LEU  81   0.289   1.884  -8.877
    2    HA   LEU  81           HA       LEU  81   0.044   4.679  -8.540
    3    HB2  LEU  81           HB2      LEU  81  -1.994   2.455  -8.467
    4    HB3  LEU  81           HB3      LEU  81  -2.428   4.162  -8.371
    5    HG   LEU  81           HG       LEU  81  -0.746   3.000 -10.609
    6   HD12  LEU  81          HD11      LEU  81  -2.974   3.346 -11.909
    7   HD11  LEU  81          HD12      LEU  81  -3.732   3.282 -10.318
    8   HD13  LEU  81          HD13      LEU  81  -2.803   1.906 -10.908
    9   HD23  LEU  81          HD21      LEU  81  -1.820   5.158 -11.702
   10   HD22  LEU  81          HD22      LEU  81  -0.402   5.311 -10.667
   11   HD21  LEU  81          HD23      LEU  81  -2.004   5.675 -10.027

  No H/Q in entry =          11
  In of MODEL   40
    1    H    MET  82           H        MET  82  -0.644   1.994  -6.298
    2    HA   MET  82           HA       MET  82  -1.682   3.585  -4.208
    3    HB2  MET  82           HB2      MET  82  -0.335   0.885  -4.252
    4    HB3  MET  82           HB3      MET  82  -0.908   1.612  -2.753
    5    HG2  MET  82           HG2      MET  82  -2.644   1.142  -5.197
    6    HG3  MET  82           HG3      MET  82  -2.578   0.064  -3.804
    7    HE3  MET  82           HE1      MET  82  -4.285   1.724  -0.986
    8    HE2  MET  82           HE2      MET  82  -2.552   1.985  -1.169
    9    HE1  MET  82           HE3      MET  82  -3.256   0.436  -1.627

  No H/Q in entry =           9
  In of MODEL   40
    1    H    THR  83           H        THR  83   1.608   2.468  -4.897
    2    HA   THR  83           HA       THR  83   2.835   3.554  -2.594
    3    HB   THR  83           HB       THR  83   4.931   3.481  -4.066
    4    HG1  THR  83           HG1      THR  83   4.687   2.962  -6.091
    5   HG22  THR  83          HG21      THR  83   4.460   0.829  -4.405
    6   HG21  THR  83          HG22      THR  83   3.174   1.218  -3.265
    7   HG23  THR  83          HG23      THR  83   4.856   1.544  -2.843

  No H/Q in entry =           7
  In of MODEL   40
    1    H    SER  84           H        SER  84   2.480   4.846  -5.891
    2    HA   SER  84           HA       SER  84   3.844   7.271  -5.429
    3    HB2  SER  84           HB2      SER  84   1.767   6.464  -7.451
    4    HB3  SER  84           HB3      SER  84   2.461   8.085  -7.422
    5    HG   SER  84           HG       SER  84   3.809   5.597  -7.718

  No H/Q in entry =           5
  In of MODEL   40
    1    H    MET  85           H        MET  85   0.342   6.549  -5.261
    2    HA   MET  85           HA       MET  85  -0.493   9.167  -4.654
    3    HB2  MET  85           HB2      MET  85  -2.035   7.379  -5.329
    4    HB3  MET  85           HB3      MET  85  -1.753   6.560  -3.793
    5    HG2  MET  85           HG2      MET  85  -2.632   8.507  -2.573
    6    HG3  MET  85           HG3      MET  85  -2.871   9.363  -4.095
    7    HE1  MET  85           HE1      MET  85  -3.373   6.352  -2.103
    8    HE3  MET  85           HE2      MET  85  -4.859   5.562  -2.622
    9    HE2  MET  85           HE3      MET  85  -4.941   6.961  -1.556

  No H/Q in entry =           9
  In of MODEL   40
    1    H    LEU  86           H        LEU  86   0.397   6.490  -2.517
    2    HA   LEU  86           HA       LEU  86  -0.124   7.792  -0.071
    3    HB2  LEU  86           HB2      LEU  86   0.314   5.317  -0.472
    4    HB3  LEU  86           HB3      LEU  86   2.026   5.729  -0.564
    5    HG   LEU  86           HG       LEU  86   1.712   6.887   1.707
    6   HD11  LEU  86          HD11      LEU  86  -0.990   6.151   1.232
    7   HD13  LEU  86          HD12      LEU  86  -0.317   6.887   2.684
    8   HD12  LEU  86          HD13      LEU  86  -0.427   5.133   2.561
    9   HD23  LEU  86          HD21      LEU  86   1.251   3.899   1.821
   10   HD22  LEU  86          HD22      LEU  86   2.263   4.895   2.864
   11   HD21  LEU  86          HD23      LEU  86   2.762   4.569   1.204

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ALA  87           H        ALA  87   2.855   7.470  -1.960
    2    HA   ALA  87           HA       ALA  87   4.575   8.856  -0.230
    3    HB3  ALA  87           HB1      ALA  87   4.660   7.849  -2.940
    4    HB2  ALA  87           HB2      ALA  87   5.998   8.162  -1.837
    5    HB1  ALA  87           HB3      ALA  87   5.399   9.452  -2.878

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ARG  88           H        ARG  88   2.643  10.022  -2.948
    2    HA   ARG  88           HA       ARG  88   3.448  12.702  -2.824
    3    HB2  ARG  88           HB2      ARG  88   2.182  11.569  -4.685
    4    HB3  ARG  88           HB3      ARG  88   0.726  11.727  -3.702
    5    HG2  ARG  88           HG2      ARG  88   1.776  14.295  -3.611
    6    HG3  ARG  88           HG3      ARG  88   2.195  13.780  -5.243
    7    HD2  ARG  88           HD2      ARG  88   0.055  13.888  -5.941
    8    HD3  ARG  88           HD3      ARG  88  -0.543  13.038  -4.516
    9    HE   ARG  88           HE       ARG  88  -0.699  15.819  -4.926
   10   HH21  ARG  88          HH11      ARG  88  -1.211  17.149  -3.184
   11   HH22  ARG  88          HH12      ARG  88  -0.922  16.604  -1.568
   12   HH11  ARG  88          HH21      ARG  88   0.288  13.537  -2.558
   13   HH12  ARG  88          HH22      ARG  88  -0.091  14.553  -1.214

  No H/Q in entry =          13
  In of MODEL   40
    1    H    GLU  89           H        GLU  89   0.724  11.056  -1.190
    2    HA   GLU  89           HA       GLU  89  -0.355  13.377   0.022
    3    HB2  GLU  89           HB2      GLU  89  -1.501  11.152  -0.072
    4    HB3  GLU  89           HB3      GLU  89  -0.385  10.580   1.168
    5    HG2  GLU  89           HG2      GLU  89  -1.184  12.284   2.732
    6    HG3  GLU  89           HG3      GLU  89  -2.227  12.971   1.490

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LEU  90           H        LEU  90   2.066  11.051   1.190
    2    HA   LEU  90           HA       LEU  90   2.437  12.283   3.723
    3    HB2  LEU  90           HB2      LEU  90   4.188  10.492   2.041
    4    HB3  LEU  90           HB3      LEU  90   4.613  10.998   3.682
    5    HG   LEU  90           HG       LEU  90   1.961   9.688   3.016
    6   HD12  LEU  90          HD11      LEU  90   3.075   7.625   4.018
    7   HD11  LEU  90          HD12      LEU  90   4.608   8.462   3.779
    8   HD13  LEU  90          HD13      LEU  90   3.591   8.072   2.391
    9   HD22  LEU  90          HD21      LEU  90   1.708  10.609   5.140
   10   HD21  LEU  90          HD22      LEU  90   3.424  10.478   5.523
   11   HD23  LEU  90          HD23      LEU  90   2.399   9.044   5.566

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  91           H        ILE  91   4.046  12.654   0.598
    2    HA   ILE  91           HA       ILE  91   6.047  14.457   1.443
    3    HB   ILE  91           HB       ILE  91   4.730  13.992  -1.238
    4   HG12  ILE  91          HG12      ILE  91   7.555  13.464  -0.265
    5   HG13  ILE  91          HG13      ILE  91   6.258  12.283  -0.106
    6   HG22  ILE  91          HG21      ILE  91   6.971  15.311  -1.922
    7   HG21  ILE  91          HG22      ILE  91   6.671  16.111  -0.379
    8   HG23  ILE  91          HG23      ILE  91   5.449  16.160  -1.648
    9   HD13  ILE  91          HD11      ILE  91   6.081  11.969  -2.415
   10   HD12  ILE  91          HD12      ILE  91   7.818  12.188  -2.200
   11   HD11  ILE  91          HD13      ILE  91   6.826  13.526  -2.782

  No H/Q in entry =          11
  In of MODEL   40
    1    H    THR  92           H        THR  92   2.692  14.938   0.436
    2    HA   THR  92           HA       THR  92   2.704  17.761   0.384
    3    HB   THR  92           HB       THR  92   0.509  15.794   1.077
    4    HG1  THR  92           HG1      THR  92   0.812  15.618  -1.009
    5   HG22  THR  92          HG21      THR  92  -0.862  17.977   0.361
    6   HG21  THR  92          HG22      THR  92   0.541  18.781   1.061
    7   HG23  THR  92          HG23      THR  92  -0.416  17.670   2.039

  No H/Q in entry =           7
  In of MODEL   40
    1    H    GLU  93           H        GLU  93   2.123  15.460   3.031
    2    HA   GLU  93           HA       GLU  93   1.617  17.365   5.055
    3    HB2  GLU  93           HB2      GLU  93   2.892  14.622   5.283
    4    HB3  GLU  93           HB3      GLU  93   2.214  15.554   6.619
    5    HG2  GLU  93           HG2      GLU  93   0.592  14.806   4.177
    6    HG3  GLU  93           HG3      GLU  93   0.679  13.778   5.602

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LEU  94           H        LEU  94   4.603  15.846   3.902
    2    HA   LEU  94           HA       LEU  94   6.369  16.963   5.793
    3    HB2  LEU  94           HB2      LEU  94   6.758  15.999   2.960
    4    HB3  LEU  94           HB3      LEU  94   8.096  16.635   3.912
    5    HG   LEU  94           HG       LEU  94   6.326  14.460   5.039
    6   HD11  LEU  94          HD11      LEU  94   8.419  14.212   2.908
    7   HD13  LEU  94          HD12      LEU  94   6.959  13.257   3.166
    8   HD12  LEU  94          HD13      LEU  94   8.381  12.982   4.173
    9   HD23  LEU  94          HD21      LEU  94   8.507  13.890   6.191
   10   HD22  LEU  94          HD22      LEU  94   7.862  15.476   6.612
   11   HD21  LEU  94          HD23      LEU  94   9.200  15.340   5.469

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  95           H        ILE  95   5.247  18.160   2.647
    2    HA   ILE  95           HA       ILE  95   6.851  20.495   2.595
    3    HB   ILE  95           HB       ILE  95   4.199  19.852   1.287
    4   HG12  ILE  95          HG12      ILE  95   6.992  20.154   0.152
    5   HG13  ILE  95          HG13      ILE  95   6.321  18.609   0.662
    6   HG21  ILE  95          HG21      ILE  95   5.982  22.296   1.075
    7   HG23  ILE  95          HG22      ILE  95   4.256  22.251   1.430
    8   HG22  ILE  95          HG23      ILE  95   4.834  21.847  -0.187
    9   HD13  ILE  95          HD11      ILE  95   4.761  18.560  -1.068
   10   HD12  ILE  95          HD12      ILE  95   6.121  19.362  -1.853
   11   HD11  ILE  95          HD13      ILE  95   4.762  20.314  -1.258

  No H/Q in entry =          11
  In of MODEL   40
    1    H    GLU  96           H        GLU  96   3.593  19.885   3.887
    2    HA   GLU  96           HA       GLU  96   3.010  22.538   4.647
    3    HB2  GLU  96           HB2      GLU  96   1.311  20.778   4.652
    4    HB3  GLU  96           HB3      GLU  96   2.160  19.935   5.945
    5    HG2  GLU  96           HG2      GLU  96   1.157  21.228   7.519
    6    HG3  GLU  96           HG3      GLU  96   1.714  22.696   6.726

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LEU  97           H        LEU  97   4.816  19.956   6.264
    2    HA   LEU  97           HA       LEU  97   5.192  21.292   8.739
    3    HB2  LEU  97           HB2      LEU  97   6.698  19.106   7.319
    4    HB3  LEU  97           HB3      LEU  97   7.298  19.778   8.833
    5    HG   LEU  97           HG       LEU  97   4.473  18.725   8.518
    6   HD12  LEU  97          HD11      LEU  97   5.384  16.696   9.725
    7   HD11  LEU  97          HD12      LEU  97   7.004  17.305   9.384
    8   HD13  LEU  97          HD13      LEU  97   5.928  16.866   8.056
    9   HD23  LEU  97          HD21      LEU  97   4.921  18.416  11.082
   10   HD22  LEU  97          HD22      LEU  97   4.564  20.035  10.482
   11   HD21  LEU  97          HD23      LEU  97   6.229  19.571  10.826

  No H/Q in entry =          11
  In of MODEL   40
    1    H    HIS  98           H        HIS  98   7.063  21.291   5.715
    2    HA   HIS  98           HA       HIS  98   9.239  22.836   6.619
    3    HB2  HIS  98           HB2      HIS  98   7.943  22.608   3.892
    4    HB3  HIS  98           HB3      HIS  98   9.397  23.565   4.186
    5    HD1  HIS  98           HD1      HIS  98   8.135  20.012   4.194
    6    HD2  HIS  98           HD2      HIS  98  11.745  22.055   4.627
    7    HE1  HIS  98           HE1      HIS  98   9.964  18.256   4.133
    8    HE2  HIS  98           HE2      HIS  98  12.167  19.480   4.396

  No H/Q in entry =           8
  In of MODEL   40
    1    H    GLU  99           H        GLU  99   6.031  23.722   5.446
    2    HA   GLU  99           HA       GLU  99   6.451  26.531   5.396
    3    HB2  GLU  99           HB2      GLU  99   4.556  25.393   4.261
    4    HB3  GLU  99           HB3      GLU  99   3.854  25.037   5.839
    5    HG2  GLU  99           HG2      GLU  99   3.709  27.429   6.348
    6    HG3  GLU  99           HG3      GLU  99   4.491  27.823   4.820

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LYS 100           H        LYS 100   5.287  24.304   7.911
    2    HA   LYS 100           HA       LYS 100   4.730  26.361   9.811
    3    HB2  LYS 100           HB2      LYS 100   5.262  23.401  10.148
    4    HB3  LYS 100           HB3      LYS 100   4.830  24.476  11.483
    5    HG2  LYS 100           HG2      LYS 100   2.774  25.147  10.237
    6    HG3  LYS 100           HG3      LYS 100   3.184  23.976   8.980
    7    HD2  LYS 100           HD2      LYS 100   3.079  22.152  10.636
    8    HD3  LYS 100           HD3      LYS 100   2.686  23.316  11.903
    9    HE2  LYS 100           HE2      LYS 100   0.643  23.972  10.641
   10    HE3  LYS 100           HE3      LYS 100   1.025  22.750   9.422
   11    HZ1  LYS 100           HZ1      LYS 100   0.748  22.079  12.301
   12    HZ3  LYS 100           HZ2      LYS 100   0.717  21.029  10.962
   13    HZ2  LYS 100           HZ3      LYS 100  -0.583  22.087  11.245

  No H/Q in entry =          13
  In of MODEL   40
    1    H    LEU 101           H        LEU 101   7.627  24.525   8.972
    2    HA   LEU 101           HA       LEU 101   9.237  25.334  11.179
    3    HB2  LEU 101           HB2      LEU 101   9.818  24.347   8.398
    4    HB3  LEU 101           HB3      LEU 101  11.129  24.990   9.382
    5    HG   LEU 101           HG       LEU 101   9.265  22.858  10.439
    6   HD12  LEU 101          HD11      LEU 101  11.296  21.334   9.826
    7   HD11  LEU 101          HD12      LEU 101  11.682  22.595   8.658
    8   HD13  LEU 101          HD13      LEU 101  10.141  21.745   8.561
    9   HD21  LEU 101          HD21      LEU 101  12.005  23.922  11.171
   10   HD23  LEU 101          HD22      LEU 101  11.438  22.356  11.745
   11   HD22  LEU 101          HD23      LEU 101  10.567  23.824  12.188

  No H/Q in entry =          11
  In of MODEL   40
    1    H    LYS 102           H        LYS 102   7.683  27.228   9.044
    2    HA   LYS 102           HA       LYS 102   7.795  29.520   8.759
    3    HB2  LYS 102           HB2      LYS 102   9.357  29.375  10.858
    4    HB3  LYS 102           HB3      LYS 102  10.660  29.553   9.699
    5    HG2  LYS 102           HG2      LYS 102   8.584  31.535  10.567
    6    HG3  LYS 102           HG3      LYS 102  10.301  31.769  10.317
    7    HD2  LYS 102           HD2      LYS 102   8.344  31.384   8.015
    8    HD3  LYS 102           HD3      LYS 102   8.751  32.955   8.688
    9    HE2  LYS 102           HE2      LYS 102  10.106  31.756   6.612
   10    HE3  LYS 102           HE3      LYS 102  10.742  33.050   7.627
   11    HZ2  LYS 102           HZ1      LYS 102  12.234  31.123   7.447
   12    HZ1  LYS 102           HZ2      LYS 102  11.056  30.156   8.185
   13    HZ3  LYS 102           HZ3      LYS 102  11.768  31.429   9.049

  No H/Q in entry =          13
  In of MODEL   40
    1    H    ALA 103           H        ALA 103  11.032  28.133   8.192
    2    HA   ALA 103           HA       ALA 103  12.017  29.501   6.121
    3    HB2  ALA 103           HB1      ALA 103  12.869  27.277   5.186
    4    HB1  ALA 103           HB2      ALA 103  11.961  26.512   6.489
    5    HB3  ALA 103           HB3      ALA 103  13.268  27.635   6.866

  No H/Q in entry =           5
  In of MODEL   40
    1    H1   LYS   3           H1       LYS   3 -31.841   5.439 -19.708
    2    H2   LYS   3           H3       LYS   3 -30.843   5.207 -21.061
    3    H3   LYS   3           H2       LYS   3 -32.180   4.192 -20.809
    4    HA   LYS   3           HA       LYS   3 -31.096   2.863 -19.408
    5    HB2  LYS   3           HB2      LYS   3 -28.903   4.402 -20.748
    6    HB3  LYS   3           HB3      LYS   3 -28.506   3.214 -19.506
    7    HG2  LYS   3           HG2      LYS   3 -29.840   1.550 -20.852
    8    HG3  LYS   3           HG3      LYS   3 -29.867   2.751 -22.143
    9    HD2  LYS   3           HD2      LYS   3 -27.382   2.779 -22.100
   10    HD3  LYS   3           HD3      LYS   3 -27.423   1.476 -20.913
   11    HE2  LYS   3           HE2      LYS   3 -28.858   0.216 -22.625
   12    HE3  LYS   3           HE3      LYS   3 -28.309   1.428 -23.783
   13    HZ3  LYS   3           HZ1      LYS   3 -26.446   0.303 -24.059
   14    HZ2  LYS   3           HZ2      LYS   3 -27.005  -0.898 -22.997
   15    HZ1  LYS   3           HZ3      LYS   3 -26.085   0.400 -22.402

  No H/Q in entry =          15
  In of MODEL   40
    1    H    LYS   4           H        LYS   4 -31.134   2.718 -17.347
    2    HA   LYS   4           HA       LYS   4 -30.529   5.042 -15.699
    3    HB2  LYS   4           HB2      LYS   4 -31.575   2.286 -14.996
    4    HB3  LYS   4           HB3      LYS   4 -31.425   3.635 -13.870
    5    HG2  LYS   4           HG2      LYS   4 -33.234   3.471 -16.286
    6    HG3  LYS   4           HG3      LYS   4 -33.721   3.495 -14.592
    7    HD2  LYS   4           HD2      LYS   4 -33.150   5.752 -14.328
    8    HD3  LYS   4           HD3      LYS   4 -32.113   5.752 -15.754
    9    HE2  LYS   4           HE2      LYS   4 -34.114   7.017 -16.210
   10    HE3  LYS   4           HE3      LYS   4 -34.115   5.542 -17.178
   11    HZ3  LYS   4           HZ1      LYS   4 -35.633   4.544 -15.626
   12    HZ2  LYS   4           HZ2      LYS   4 -36.272   6.006 -16.208
   13    HZ1  LYS   4           HZ3      LYS   4 -35.605   5.932 -14.648

  No H/Q in entry =          13
  In of MODEL   40
    1    H    HIS   5           H        HIS   5 -29.062   5.208 -14.112
    2    HA   HIS   5           HA       HIS   5 -26.683   3.507 -14.452
    3    HB2  HIS   5           HB2      HIS   5 -27.084   6.244 -13.244
    4    HB3  HIS   5           HB3      HIS   5 -25.553   5.373 -13.232
    5    HD1  HIS   5           HD1      HIS   5 -24.155   6.650 -14.826
    6    HD2  HIS   5           HD2      HIS   5 -27.923   5.823 -16.367
    7    HE1  HIS   5           HE1      HIS   5 -24.028   7.239 -17.277
    8    HE2  HIS   5           HE2      HIS   5 -26.324   6.722 -18.186

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ILE   6           H        ILE   6 -26.364   1.949 -13.135
    2    HA   ILE   6           HA       ILE   6 -27.344   2.164 -10.368
    3    HB   ILE   6           HB       ILE   6 -26.391  -0.254 -11.909
    4   HG12  ILE   6          HG12      ILE   6 -29.179   0.533 -11.049
    5   HG13  ILE   6          HG13      ILE   6 -28.551   0.728 -12.685
    6   HG23  ILE   6          HG21      ILE   6 -26.691  -1.525 -10.048
    7   HG22  ILE   6          HG22      ILE   6 -27.906  -0.443  -9.364
    8   HG21  ILE   6          HG23      ILE   6 -26.197  -0.015  -9.281
    9   HD13  ILE   6          HD11      ILE   6 -28.897  -1.411 -13.184
   10   HD12  ILE   6          HD12      ILE   6 -29.908  -1.450 -11.739
   11   HD11  ILE   6          HD13      ILE   6 -28.224  -1.967 -11.652

  No H/Q in entry =          11
  In of MODEL   40
    1    H    TYR   7           H        TYR   7 -25.618   2.899  -9.087
    2    HA   TYR   7           HA       TYR   7 -22.861   2.089  -9.776
    3    HB2  TYR   7           HB2      TYR   7 -23.948   4.468  -8.292
    4    HB3  TYR   7           HB3      TYR   7 -22.239   4.044  -8.336
    5    HD1  TYR   7           HD1      TYR   7 -23.238   3.047 -11.423
    6    HD2  TYR   7           HD2      TYR   7 -22.752   6.651  -9.199
    7    HE1  TYR   7           HE1      TYR   7 -22.879   4.298 -13.515
    8    HE2  TYR   7           HE2      TYR   7 -22.436   7.904 -11.282
    9    HH   TYR   7           HH       TYR   7 -22.657   7.805 -13.514

  No H/Q in entry =           9
  In of MODEL   40
    1    H    LEU   8           H        LEU   8 -21.820   0.790  -8.451
    2    HA   LEU   8           HA       LEU   8 -22.914   0.236  -5.763
    3    HB2  LEU   8           HB2      LEU   8 -21.131  -1.333  -7.603
    4    HB3  LEU   8           HB3      LEU   8 -21.290  -1.725  -5.891
    5    HG   LEU   8           HG       LEU   8 -23.758  -2.029  -6.305
    6   HD13  LEU   8          HD11      LEU   8 -23.961  -0.822  -8.414
    7   HD12  LEU   8          HD12      LEU   8 -24.401  -2.512  -8.653
    8   HD11  LEU   8          HD13      LEU   8 -22.825  -1.929  -9.183
    9   HD23  LEU   8          HD21      LEU   8 -22.383  -3.999  -8.003
   10   HD22  LEU   8          HD22      LEU   8 -23.454  -4.225  -6.621
   11   HD21  LEU   8          HD23      LEU   8 -21.769  -3.782  -6.365

  No H/Q in entry =          11
  In of MODEL   40
    1    H    PHE   9           H        PHE   9 -21.655   0.690  -3.980
    2    HA   PHE   9           HA       PHE   9 -18.921   1.765  -4.486
    3    HB2  PHE   9           HB2      PHE   9 -20.980   2.737  -2.508
    4    HB3  PHE   9           HB3      PHE   9 -19.298   3.248  -2.517
    5    HD1  PHE   9           HD1      PHE   9 -18.406   4.633  -4.311
    6    HD2  PHE   9           HD2      PHE   9 -22.527   3.439  -4.280
    7    HE1  PHE   9           HE1      PHE   9 -18.902   6.298  -6.075
    8    HE2  PHE   9           HE2      PHE   9 -23.025   5.117  -6.040
    9    HZ   PHE   9           HZ       PHE   9 -21.210   6.542  -6.943

  No H/Q in entry =           9
  In of MODEL   40
    1    H    SER  10           H        SER  10 -17.283   0.912  -3.347
    2    HA   SER  10           HA       SER  10 -17.475   0.000  -0.662
    3    HB2  SER  10           HB2      SER  10 -18.576  -1.937  -1.675
    4    HB3  SER  10           HB3      SER  10 -17.250  -2.104  -2.815
    5    HG   SER  10           HG       SER  10 -17.445  -2.864  -0.199

  No H/Q in entry =           5
  In of MODEL   40
    1    H    SER  11           H        SER  11 -15.451   0.124   0.211
    2    HA   SER  11           HA       SER  11 -13.315   1.142  -1.307
    3    HB2  SER  11           HB2      SER  11 -12.103   1.166   0.682
    4    HB3  SER  11           HB3      SER  11 -13.778   1.264   1.228
    5    HG   SER  11           HG       SER  11 -11.912  -0.693   1.604

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA  12           H        ALA  12 -14.375  -1.576  -2.183
    2    HA   ALA  12           HA       ALA  12 -11.746  -2.696  -2.732
    3    HB2  ALA  12           HB1      ALA  12 -12.092  -4.024  -0.847
    4    HB3  ALA  12           HB2      ALA  12 -12.707  -5.041  -2.149
    5    HB1  ALA  12           HB3      ALA  12 -13.830  -4.143  -1.128

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLY  13           H        GLY  13 -12.600  -1.687  -4.750
    2    HA3  GLY  13           HA2      GLY  13 -14.804  -2.512  -6.211
    3    HA2  GLY  13           HA3      GLY  13 -13.288  -1.961  -6.940

  No H/Q in entry =           3
  In of MODEL   40
    1    H    MET  14           H        MET  14 -11.690  -4.204  -5.913
    2    HA   MET  14           HA       MET  14 -11.963  -5.954  -8.075
    3    HB2  MET  14           HB2      MET  14  -9.891  -5.890  -6.771
    4    HB3  MET  14           HB3      MET  14 -10.702  -6.633  -5.394
    5    HG2  MET  14           HG2      MET  14 -11.165  -8.642  -6.783
    6    HG3  MET  14           HG3      MET  14 -10.311  -7.891  -8.132
    7    HE1  MET  14           HE1      MET  14  -8.116  -7.382  -8.362
    8    HE3  MET  14           HE2      MET  14  -6.730  -7.880  -7.394
    9    HE2  MET  14           HE3      MET  14  -7.687  -6.488  -6.895

  No H/Q in entry =           9
  In of MODEL   40
    1    H    SER  15           H        SER  15 -13.192  -6.455  -4.771
    2    HA   SER  15           HA       SER  15 -14.368  -9.004  -5.459
    3    HB2  SER  15           HB2      SER  15 -14.797  -7.238  -3.040
    4    HB3  SER  15           HB3      SER  15 -15.657  -8.753  -3.300
    5    HG   SER  15           HG       SER  15 -12.832  -8.605  -3.480

  No H/Q in entry =           5
  In of MODEL   40
    1    H    THR  16           H        THR  16 -15.627  -5.694  -5.118
    2    HA   THR  16           HA       THR  16 -18.385  -6.342  -5.671
    3    HB   THR  16           HB       THR  16 -16.954  -3.708  -6.170
    4    HG1  THR  16           HG1      THR  16 -16.708  -3.592  -4.116
    5   HG22  THR  16          HG21      THR  16 -19.785  -4.147  -5.247
    6   HG21  THR  16          HG22      THR  16 -19.377  -4.183  -6.972
    7   HG23  THR  16          HG23      THR  16 -19.084  -2.725  -6.012

  No H/Q in entry =           7
  In of MODEL   40
    1    H    SER  17           H        SER  17 -15.551  -5.634  -7.514
    2    HA   SER  17           HA       SER  17 -16.722  -4.957 -10.013
    3    HB2  SER  17           HB2      SER  17 -14.024  -6.122  -9.305
    4    HB3  SER  17           HB3      SER  17 -14.489  -5.736 -10.962
    5    HG   SER  17           HG       SER  17 -14.857  -3.775  -9.021

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU  18           H        LEU  18 -15.981  -8.065  -8.565
    2    HA   LEU  18           HA       LEU  18 -16.490  -9.596 -10.919
    3    HB2  LEU  18           HB2      LEU  18 -15.216 -10.494  -9.025
    4    HB3  LEU  18           HB3      LEU  18 -16.644 -10.367  -8.000
    5    HG   LEU  18           HG       LEU  18 -17.806 -12.014  -9.364
    6   HD11  LEU  18          HD11      LEU  18 -15.364 -11.698 -11.073
    7   HD13  LEU  18          HD12      LEU  18 -17.060 -11.774 -11.551
    8   HD12  LEU  18          HD13      LEU  18 -16.217 -13.241 -11.056
    9   HD22  LEU  18          HD21      LEU  18 -16.672 -12.963  -7.576
   10   HD21  LEU  18          HD22      LEU  18 -15.095 -12.733  -8.334
   11   HD23  LEU  18          HD23      LEU  18 -16.209 -13.946  -8.966

  No H/Q in entry =          11
  In of MODEL   40
    1    H    LEU  19           H        LEU  19 -18.516  -8.496  -8.204
    2    HA   LEU  19           HA       LEU  19 -20.913  -9.812  -9.030
    3    HB2  LEU  19           HB2      LEU  19 -20.679  -8.961  -6.780
    4    HB3  LEU  19           HB3      LEU  19 -20.495  -7.317  -7.389
    5    HG   LEU  19           HG       LEU  19 -22.866  -7.427  -8.182
    6   HD11  LEU  19          HD11      LEU  19 -23.061  -9.888  -8.256
    7   HD13  LEU  19          HD12      LEU  19 -24.311  -9.157  -7.250
    8   HD12  LEU  19          HD13      LEU  19 -22.921  -9.937  -6.498
    9   HD23  LEU  19          HD21      LEU  19 -23.787  -7.265  -5.831
   10   HD22  LEU  19          HD22      LEU  19 -22.417  -6.224  -6.215
   11   HD21  LEU  19          HD23      LEU  19 -22.169  -7.695  -5.274

  No H/Q in entry =          11
  In of MODEL   40
    1    H    VAL  20           H        VAL  20 -19.593  -6.575  -9.730
    2    HA   VAL  20           HA       VAL  20 -21.761  -5.651 -11.295
    3    HB   VAL  20           HB       VAL  20 -18.813  -4.898 -11.539
    4   HG11  VAL  20          HG11      VAL  20 -21.291  -3.527 -12.615
    5   HG13  VAL  20          HG12      VAL  20 -20.006  -4.268 -13.569
    6   HG12  VAL  20          HG13      VAL  20 -19.674  -2.824 -12.612
    7   HG21  VAL  20          HG21      VAL  20 -21.056  -3.915  -9.839
    8   HG23  VAL  20          HG22      VAL  20 -19.787  -2.802 -10.347
    9   HG22  VAL  20          HG23      VAL  20 -19.375  -4.238  -9.411

  No H/Q in entry =           9
  In of MODEL   40
    1    H    SER  21           H        SER  21 -18.899  -7.548 -12.327
    2    HA   SER  21           HA       SER  21 -19.694  -7.480 -15.076
    3    HB2  SER  21           HB2      SER  21 -18.152  -9.364 -15.413
    4    HB3  SER  21           HB3      SER  21 -17.391  -8.077 -14.481
    5    HG   SER  21           HG       SER  21 -17.331  -9.309 -12.779

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LYS  22           H        LYS  22 -20.633  -9.720 -12.502
    2    HA   LYS  22           HA       LYS  22 -22.086 -11.421 -14.320
    3    HB2  LYS  22           HB2      LYS  22 -21.285 -12.118 -12.034
    4    HB3  LYS  22           HB3      LYS  22 -22.562 -11.107 -11.359
    5    HG2  LYS  22           HG2      LYS  22 -23.511 -13.211 -11.312
    6    HG3  LYS  22           HG3      LYS  22 -24.147 -12.540 -12.814
    7    HD2  LYS  22           HD2      LYS  22 -22.495 -13.761 -14.103
    8    HD3  LYS  22           HD3      LYS  22 -21.746 -14.361 -12.622
    9    HE2  LYS  22           HE2      LYS  22 -23.818 -15.577 -12.075
   10    HE3  LYS  22           HE3      LYS  22 -24.555 -14.985 -13.564
   11    HZ2  LYS  22           HZ1      LYS  22 -22.444 -16.996 -13.207
   12    HZ1  LYS  22           HZ2      LYS  22 -22.539 -16.125 -14.663
   13    HZ3  LYS  22           HZ3      LYS  22 -23.854 -17.068 -14.150

  No H/Q in entry =          13
  In of MODEL   40
    1    H    MET  23           H        MET  23 -22.961  -8.541 -12.450
    2    HA   MET  23           HA       MET  23 -25.761  -8.770 -12.950
    3    HB2  MET  23           HB2      MET  23 -24.039  -6.366 -12.382
    4    HB3  MET  23           HB3      MET  23 -25.791  -6.291 -12.556
    5    HG2  MET  23           HG2      MET  23 -26.108  -7.613 -10.586
    6    HG3  MET  23           HG3      MET  23 -24.378  -7.932 -10.464
    7    HE2  MET  23           HE1      MET  23 -26.865  -4.407  -9.270
    8    HE1  MET  23           HE2      MET  23 -27.070  -5.389 -10.720
    9    HE3  MET  23           HE3      MET  23 -26.113  -3.909 -10.786

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ARG  24           H        ARG  24 -23.091  -7.197 -14.741
    2    HA   ARG  24           HA       ARG  24 -24.660  -5.978 -16.736
    3    HB2  ARG  24           HB2      ARG  24 -21.789  -6.972 -16.800
    4    HB3  ARG  24           HB3      ARG  24 -22.519  -6.073 -18.106
    5    HG2  ARG  24           HG2      ARG  24 -22.806  -4.090 -16.657
    6    HG3  ARG  24           HG3      ARG  24 -22.158  -5.015 -15.276
    7    HD2  ARG  24           HD2      ARG  24 -20.327  -3.722 -16.214
    8    HD3  ARG  24           HD3      ARG  24 -20.084  -5.414 -16.629
    9    HE   ARG  24           HE       ARG  24 -20.139  -4.975 -18.792
   10   HH21  ARG  24          HH11      ARG  24 -19.395  -3.345 -20.149
   11   HH22  ARG  24          HH12      ARG  24 -20.179  -1.803 -20.147
   12   HH11  ARG  24          HH21      ARG  24 -22.072  -2.646 -17.278
   13   HH12  ARG  24          HH22      ARG  24 -21.768  -1.403 -18.451

  No H/Q in entry =          13
  In of MODEL   40
    1    H    ALA  25           H        ALA  25 -23.364  -9.253 -16.464
    2    HA   ALA  25           HA       ALA  25 -23.954 -10.116 -19.099
    3    HB1  ALA  25           HB1      ALA  25 -23.151 -12.108 -18.406
    4    HB3  ALA  25           HB2      ALA  25 -24.206 -12.144 -16.993
    5    HB2  ALA  25           HB3      ALA  25 -22.696 -11.236 -16.943

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLN  26           H        GLN  26 -25.770 -10.250 -16.073
    2    HA   GLN  26           HA       GLN  26 -28.050 -11.572 -17.086
    3    HB2  GLN  26           HB2      GLN  26 -27.623  -9.802 -14.699
    4    HB3  GLN  26           HB3      GLN  26 -29.147 -10.604 -15.046
    5    HG2  GLN  26           HG2      GLN  26 -26.490 -11.926 -14.584
    6    HG3  GLN  26           HG3      GLN  26 -27.851 -11.894 -13.471
    7   HE21  GLN  26          HE21      GLN  26 -26.526 -13.992 -14.751
    8   HE22  GLN  26          HE22      GLN  26 -27.515 -15.091 -15.546

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ALA  27           H        ALA  27 -27.291  -8.131 -16.693
    2    HA   ALA  27           HA       ALA  27 -29.835  -7.167 -17.471
    3    HB1  ALA  27           HB1      ALA  27 -28.094  -5.761 -16.358
    4    HB3  ALA  27           HB2      ALA  27 -28.725  -5.026 -17.832
    5    HB2  ALA  27           HB3      ALA  27 -27.147  -5.812 -17.847

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLU  28           H        GLU  28 -27.078  -8.248 -19.346
    2    HA   GLU  28           HA       GLU  28 -28.071  -7.254 -21.863
    3    HB2  GLU  28           HB2      GLU  28 -25.658  -7.815 -21.244
    4    HB3  GLU  28           HB3      GLU  28 -26.118  -9.505 -21.447
    5    HG2  GLU  28           HG2      GLU  28 -25.017  -8.669 -23.416
    6    HG3  GLU  28           HG3      GLU  28 -26.696  -9.078 -23.762

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LYS  29           H        LYS  29 -28.074 -10.366 -20.209
    2    HA   LYS  29           HA       LYS  29 -29.304 -11.900 -22.214
    3    HB2  LYS  29           HB2      LYS  29 -28.201 -12.830 -20.214
    4    HB3  LYS  29           HB3      LYS  29 -29.505 -12.191 -19.215
    5    HG2  LYS  29           HG2      LYS  29 -31.096 -13.645 -20.283
    6    HG3  LYS  29           HG3      LYS  29 -29.867 -14.216 -21.409
    7    HD2  LYS  29           HD2      LYS  29 -28.663 -15.325 -19.680
    8    HD3  LYS  29           HD3      LYS  29 -29.611 -14.534 -18.422
    9    HE2  LYS  29           HE2      LYS  29 -30.242 -16.918 -18.786
   10    HE3  LYS  29           HE3      LYS  29 -31.579 -15.792 -19.026
   11    HZ1  LYS  29           HZ1      LYS  29 -31.013 -15.893 -21.455
   12    HZ3  LYS  29           HZ2      LYS  29 -31.660 -17.316 -20.790
   13    HZ2  LYS  29           HZ3      LYS  29 -29.994 -17.202 -21.091

  No H/Q in entry =          13
  In of MODEL   40
    1    H    TYR  30           H        TYR  30 -30.797  -9.872 -19.704
    2    HA   TYR  30           HA       TYR  30 -33.435 -10.456 -20.942
    3    HB2  TYR  30           HB2      TYR  30 -32.837  -9.274 -18.220
    4    HB3  TYR  30           HB3      TYR  30 -34.441  -9.614 -18.871
    5    HD1  TYR  30           HD1      TYR  30 -35.233 -11.949 -19.086
    6    HD2  TYR  30           HD2      TYR  30 -31.437 -11.033 -17.389
    7    HE1  TYR  30           HE1      TYR  30 -35.022 -14.271 -18.293
    8    HE2  TYR  30           HE2      TYR  30 -31.227 -13.340 -16.599
    9    HH   TYR  30           HH       TYR  30 -32.745 -15.781 -17.693

  No H/Q in entry =           9
  In of MODEL   40
    1    H    GLU  31           H        GLU  31 -31.376  -8.354 -21.743
    2    HA   GLU  31           HA       GLU  31 -31.417  -6.195 -22.562
    3    HB2  GLU  31           HB2      GLU  31 -34.271  -7.058 -23.071
    4    HB3  GLU  31           HB3      GLU  31 -33.504  -5.647 -23.798
    5    HG2  GLU  31           HG2      GLU  31 -31.962  -7.005 -24.995
    6    HG3  GLU  31           HG3      GLU  31 -32.450  -8.448 -24.109

  No H/Q in entry =           6
  In of MODEL   40
    1    H    VAL  32           H        VAL  32 -31.615  -6.108 -19.829
    2    HA   VAL  32           HA       VAL  32 -33.583  -4.096 -19.163
    3    HB   VAL  32           HB       VAL  32 -31.140  -4.966 -17.589
    4   HG12  VAL  32          HG11      VAL  32 -32.713  -4.227 -15.689
    5   HG11  VAL  32          HG12      VAL  32 -33.594  -3.366 -16.950
    6   HG13  VAL  32          HG13      VAL  32 -31.905  -2.974 -16.632
    7   HG21  VAL  32          HG21      VAL  32 -32.816  -6.776 -18.276
    8   HG23  VAL  32          HG22      VAL  32 -33.896  -6.006 -17.112
    9   HG22  VAL  32          HG23      VAL  32 -32.343  -6.650 -16.582

  No H/Q in entry =           9
  In of MODEL   40
    1    HA   PRO  33           HA       PRO  33 -30.712  -1.009 -20.837
    2    HB2  PRO  33           HB2      PRO  33 -32.339   1.130 -20.706
    3    HB3  PRO  33           HB3      PRO  33 -32.740  -0.193 -21.802
    4    HG2  PRO  33           HG2      PRO  33 -33.730   0.266 -18.986
    5    HG3  PRO  33           HG3      PRO  33 -34.684   0.010 -20.446
    6    HD2  PRO  33           HD2      PRO  33 -34.116  -2.039 -18.785
    7    HD3  PRO  33           HD3      PRO  33 -34.169  -2.280 -20.532

  No H/Q in entry =           7
  In of MODEL   40
    1    H    VAL  34           H        VAL  34 -29.418  -1.489 -18.892
    2    HA   VAL  34           HA       VAL  34 -29.260   0.944 -17.239
    3    HB   VAL  34           HB       VAL  34 -28.599  -0.488 -15.305
    4   HG12  VAL  34          HG11      VAL  34 -30.960  -1.489 -14.995
    5   HG11  VAL  34          HG12      VAL  34 -31.319  -0.743 -16.552
    6   HG13  VAL  34          HG13      VAL  34 -30.817   0.258 -15.190
    7   HG21  VAL  34          HG21      VAL  34 -28.680  -2.517 -17.318
    8   HG23  VAL  34          HG22      VAL  34 -29.714  -2.937 -15.950
    9   HG22  VAL  34          HG23      VAL  34 -28.012  -2.560 -15.685

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ILE  35           H        ILE  35 -27.308   1.482 -16.402
    2    HA   ILE  35           HA       ILE  35 -24.938   0.281 -17.672
    3    HB   ILE  35           HB       ILE  35 -25.491   3.144 -16.855
    4   HG12  ILE  35          HG12      ILE  35 -24.445   1.896 -19.404
    5   HG13  ILE  35          HG13      ILE  35 -26.106   2.428 -19.139
    6   HG21  ILE  35          HG21      ILE  35 -22.851   1.751 -17.172
    7   HG23  ILE  35          HG22      ILE  35 -23.366   2.902 -15.940
    8   HG22  ILE  35          HG23      ILE  35 -23.015   3.459 -17.575
    9   HD11  ILE  35          HD11      ILE  35 -24.823   4.693 -18.536
   10   HD13  ILE  35          HD12      ILE  35 -25.342   4.286 -20.173
   11   HD12  ILE  35          HD13      ILE  35 -23.672   4.004 -19.681

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ILE  36           H        ILE  36 -23.652  -0.678 -16.077
    2    HA   ILE  36           HA       ILE  36 -24.118  -0.094 -13.205
    3    HB   ILE  36           HB       ILE  36 -23.149  -2.746 -14.320
    4   HG12  ILE  36          HG12      ILE  36 -25.994  -2.094 -13.549
    5   HG13  ILE  36          HG13      ILE  36 -25.427  -2.039 -15.219
    6   HG23  ILE  36          HG21      ILE  36 -23.451  -3.596 -12.208
    7   HG22  ILE  36          HG22      ILE  36 -24.644  -2.376 -11.764
    8   HG21  ILE  36          HG23      ILE  36 -22.934  -1.952 -11.837
    9   HD13  ILE  36          HD11      ILE  36 -25.475  -4.258 -15.430
   10   HD12  ILE  36          HD12      ILE  36 -26.542  -4.197 -14.028
   11   HD11  ILE  36          HD13      ILE  36 -24.823  -4.526 -13.813

  No H/Q in entry =          11
  In of MODEL   40
    1    H    GLU  37           H        GLU  37 -22.371   0.628 -12.103
    2    HA   GLU  37           HA       GLU  37 -19.644  -0.020 -13.026
    3    HB2  GLU  37           HB2      GLU  37 -20.681   2.717 -12.307
    4    HB3  GLU  37           HB3      GLU  37 -18.972   2.311 -12.467
    5    HG2  GLU  37           HG2      GLU  37 -21.003   2.197 -14.678
    6    HG3  GLU  37           HG3      GLU  37 -19.854   3.507 -14.404

  No H/Q in entry =           6
  In of MODEL   40
    1    H    ALA  38           H        ALA  38 -18.142  -0.180 -11.347
    2    HA   ALA  38           HA       ALA  38 -19.175  -0.063  -8.574
    3    HB1  ALA  38           HB1      ALA  38 -17.362  -1.903 -10.008
    4    HB3  ALA  38           HB2      ALA  38 -18.394  -2.199  -8.608
    5    HB2  ALA  38           HB3      ALA  38 -16.821  -1.430  -8.397

  No H/Q in entry =           5
  In of MODEL   40
    1    H    PHE  39           H        PHE  39 -18.000   1.209  -7.100
    2    HA   PHE  39           HA       PHE  39 -15.547   2.550  -7.999
    3    HB2  PHE  39           HB2      PHE  39 -18.029   3.905  -6.961
    4    HB3  PHE  39           HB3      PHE  39 -16.438   4.661  -6.903
    5    HD1  PHE  39           HD1      PHE  39 -15.160   4.738  -9.178
    6    HD2  PHE  39           HD2      PHE  39 -19.380   4.278  -8.771
    7    HE1  PHE  39           HE1      PHE  39 -15.463   5.588 -11.486
    8    HE2  PHE  39           HE2      PHE  39 -19.698   5.118 -11.071
    9    HZ   PHE  39           HZ       PHE  39 -17.743   5.745 -12.448

  No H/Q in entry =           9
  In of MODEL   40
    1    HA   PRO  40           HA       PRO  40 -14.558   1.841  -3.717
    2    HB2  PRO  40           HB2      PRO  40 -12.904   3.950  -3.110
    3    HB3  PRO  40           HB3      PRO  40 -12.389   2.648  -4.182
    4    HG2  PRO  40           HG2      PRO  40 -13.567   5.322  -4.920
    5    HG3  PRO  40           HG3      PRO  40 -12.097   4.564  -5.531
    6    HD2  PRO  40           HD2      PRO  40 -14.314   4.353  -6.937
    7    HD3  PRO  40           HD3      PRO  40 -13.278   2.940  -6.747

  No H/Q in entry =           7
  In of MODEL   40
    1    H    GLU  41           H        GLU  41 -15.228   2.778  -1.584
    2    HA   GLU  41           HA       GLU  41 -17.565   4.352  -1.559
    3    HB2  GLU  41           HB2      GLU  41 -17.363   4.330   0.840
    4    HB3  GLU  41           HB3      GLU  41 -16.907   2.744   0.219
    5    HG2  GLU  41           HG2      GLU  41 -15.289   3.065   1.802
    6    HG3  GLU  41           HG3      GLU  41 -14.480   3.700   0.369

  No H/Q in entry =           6
  In of MODEL   40
    1    H    THR  42           H        THR  42 -14.291   5.456  -1.616
    2    HA   THR  42           HA       THR  42 -14.785   7.990  -0.398
    3    HB   THR  42           HB       THR  42 -12.666   8.687  -1.491
    4    HG1  THR  42           HG1      THR  42 -12.842   6.101  -2.665
    5   HG21  THR  42          HG21      THR  42 -12.687   7.328   0.623
    6   HG23  THR  42          HG22      THR  42 -11.224   7.127  -0.343
    7   HG22  THR  42          HG23      THR  42 -12.474   5.885  -0.368

  No H/Q in entry =           7
  In of MODEL   40
    1    H    LEU  43           H        LEU  43 -15.633   6.853  -3.499
    2    HA   LEU  43           HA       LEU  43 -16.045   9.608  -4.463
    3    HB2  LEU  43           HB2      LEU  43 -16.293   6.956  -5.873
    4    HB3  LEU  43           HB3      LEU  43 -16.536   8.536  -6.616
    5    HG   LEU  43           HG       LEU  43 -13.912   7.480  -5.593
    6   HD13  LEU  43          HD11      LEU  43 -13.345   6.950  -7.768
    7   HD12  LEU  43          HD12      LEU  43 -14.557   8.029  -8.457
    8   HD11  LEU  43          HD13      LEU  43 -15.050   6.497  -7.738
    9   HD23  LEU  43          HD21      LEU  43 -13.119   9.481  -7.011
   10   HD22  LEU  43          HD22      LEU  43 -13.815   9.817  -5.425
   11   HD21  LEU  43          HD23      LEU  43 -14.781  10.056  -6.882

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ALA  44           H        ALA  44 -17.880   7.672  -2.609
    2    HA   ALA  44           HA       ALA  44 -20.348   7.393  -3.926
    3    HB2  ALA  44           HB1      ALA  44 -20.142   6.283  -1.832
    4    HB3  ALA  44           HB2      ALA  44 -21.324   7.563  -1.555
    5    HB1  ALA  44           HB3      ALA  44 -19.661   7.764  -1.006

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLY  45           H        GLY  45 -19.087  10.267  -2.391
    2    HA3  GLY  45           HA2      GLY  45 -21.606  11.627  -2.744
    3    HA2  GLY  45           HA3      GLY  45 -20.098  12.338  -2.170

  No H/Q in entry =           3
  In of MODEL   40
    1    H    GLU  46           H        GLU  46 -18.521  11.492  -4.465
    2    HA   GLU  46           HA       GLU  46 -19.287  13.672  -6.229
    3    HB2  GLU  46           HB2      GLU  46 -16.985  11.714  -6.301
    4    HB3  GLU  46           HB3      GLU  46 -17.186  13.072  -7.409
    5    HG2  GLU  46           HG2      GLU  46 -16.851  13.306  -4.427
    6    HG3  GLU  46           HG3      GLU  46 -15.561  13.515  -5.612

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LYS  47           H        LYS  47 -18.969  10.166  -6.670
    2    HA   LYS  47           HA       LYS  47 -20.084  10.328  -9.343
    3    HB2  LYS  47           HB2      LYS  47 -18.784   8.301  -7.676
    4    HB3  LYS  47           HB3      LYS  47 -20.137   7.673  -8.618
    5    HG2  LYS  47           HG2      LYS  47 -18.109   7.368  -9.849
    6    HG3  LYS  47           HG3      LYS  47 -19.087   8.595 -10.651
    7    HD2  LYS  47           HD2      LYS  47 -17.764  10.353  -9.589
    8    HD3  LYS  47           HD3      LYS  47 -16.791   9.132  -8.773
    9    HE2  LYS  47           HE2      LYS  47 -16.047   8.278 -10.939
   10    HE3  LYS  47           HE3      LYS  47 -17.019   9.502 -11.754
   11    HZ1  LYS  47           HZ1      LYS  47 -15.703  11.161 -10.418
   12    HZ3  LYS  47           HZ2      LYS  47 -14.872  10.361 -11.663
   13    HZ2  LYS  47           HZ3      LYS  47 -14.640   9.889 -10.047

  No H/Q in entry =          13
  In of MODEL   40
    1    H    GLY  48           H        GLY  48 -21.355   9.491  -6.193
    2    HA3  GLY  48           HA2      GLY  48 -23.670   8.174  -6.931
    3    HA2  GLY  48           HA3      GLY  48 -23.498   9.177  -5.491

  No H/Q in entry =           3
  In of MODEL   40
    1    H    GLN  49           H        GLN  49 -23.058  11.631  -7.059
    2    HA   GLN  49           HA       GLN  49 -25.677  12.596  -7.196
    3    HB2  GLN  49           HB2      GLN  49 -23.189  13.605  -8.560
    4    HB3  GLN  49           HB3      GLN  49 -24.703  14.486  -8.471
    5    HG2  GLN  49           HG2      GLN  49 -24.540  14.515  -6.034
    6    HG3  GLN  49           HG3      GLN  49 -23.037  13.612  -6.122
    7   HE21  GLN  49          HE21      GLN  49 -23.043  15.842  -4.846
    8   HE22  GLN  49          HE22      GLN  49 -22.194  17.149  -5.493

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ASN  50           H        ASN  50 -23.899  10.819  -9.590
    2    HA   ASN  50           HA       ASN  50 -25.833  11.586 -11.666
    3    HB2  ASN  50           HB2      ASN  50 -23.171  10.194 -11.907
    4    HB3  ASN  50           HB3      ASN  50 -24.246  10.562 -13.249
    5   HD21  ASN  50          HD21      ASN  50 -21.659  11.553 -11.642
    6   HD22  ASN  50          HD22      ASN  50 -21.518  13.200 -11.982

  No H/Q in entry =           6
  In of MODEL   40
    1    H    ALA  51           H        ALA  51 -25.681   9.231  -9.424
    2    HA   ALA  51           HA       ALA  51 -26.347   7.048 -11.253
    3    HB2  ALA  51           HB1      ALA  51 -25.685   5.731  -9.570
    4    HB3  ALA  51           HB2      ALA  51 -26.849   6.473  -8.472
    5    HB1  ALA  51           HB3      ALA  51 -25.247   7.185  -8.673

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ASP  52           H        ASP  52 -28.290   5.881 -11.110
    2    HA   ASP  52           HA       ASP  52 -30.569   7.589 -10.436
    3    HB2  ASP  52           HB2      ASP  52 -30.242   5.101 -12.111
    4    HB3  ASP  52           HB3      ASP  52 -31.824   5.746 -11.671

  No H/Q in entry =           4
  In of MODEL   40
    1    H    VAL  53           H        VAL  53 -28.807   4.792  -9.429
    2    HA   VAL  53           HA       VAL  53 -30.246   4.836  -6.909
    3    HB   VAL  53           HB       VAL  53 -31.555   3.120  -8.152
    4   HG11  VAL  53          HG11      VAL  53 -29.766   2.360  -9.680
    5   HG13  VAL  53          HG12      VAL  53 -30.524   1.020  -8.821
    6   HG12  VAL  53          HG13      VAL  53 -28.943   1.610  -8.313
    7   HG23  VAL  53          HG21      VAL  53 -30.620   1.189  -6.466
    8   HG22  VAL  53          HG22      VAL  53 -31.820   2.428  -6.095
    9   HG21  VAL  53          HG23      VAL  53 -30.123   2.694  -5.691

  No H/Q in entry =           9
  In of MODEL   40
    1    H    VAL  54           H        VAL  54 -28.908   4.473  -5.258
    2    HA   VAL  54           HA       VAL  54 -26.106   3.778  -5.877
    3    HB   VAL  54           HB       VAL  54 -27.268   5.490  -3.622
    4   HG11  VAL  54          HG11      VAL  54 -24.615   4.216  -3.921
    5   HG13  VAL  54          HG12      VAL  54 -25.401   4.851  -2.476
    6   HG12  VAL  54          HG13      VAL  54 -24.557   5.944  -3.573
    7   HG22  VAL  54          HG21      VAL  54 -26.512   7.352  -4.720
    8   HG21  VAL  54          HG22      VAL  54 -27.007   6.335  -6.073
    9   HG23  VAL  54          HG23      VAL  54 -25.303   6.453  -5.639

  No H/Q in entry =           9
  In of MODEL   40
    1    H    LEU  55           H        LEU  55 -25.408   1.891  -5.239
    2    HA   LEU  55           HA       LEU  55 -26.836   0.496  -3.062
    3    HB2  LEU  55           HB2      LEU  55 -25.224  -0.581  -5.363
    4    HB3  LEU  55           HB3      LEU  55 -25.929  -1.558  -4.074
    5    HG   LEU  55           HG       LEU  55 -27.456  -0.049  -6.185
    6   HD13  LEU  55          HD11      LEU  55 -27.058  -1.880  -7.409
    7   HD12  LEU  55          HD12      LEU  55 -27.962  -2.808  -6.213
    8   HD11  LEU  55          HD13      LEU  55 -26.213  -2.648  -6.065
    9   HD23  LEU  55          HD21      LEU  55 -28.638  -2.065  -4.330
   10   HD22  LEU  55          HD22      LEU  55 -29.409  -0.722  -5.174
   11   HD21  LEU  55          HD23      LEU  55 -28.401  -0.413  -3.760

  No H/Q in entry =          11
  In of MODEL   40
    1    H    LEU  56           H        LEU  56 -25.650  -0.037  -1.261
    2    HA   LEU  56           HA       LEU  56 -22.741   0.518  -1.316
    3    HB2  LEU  56           HB2      LEU  56 -24.524   0.206   1.087
    4    HB3  LEU  56           HB3      LEU  56 -22.841   0.727   1.072
    5    HG   LEU  56           HG       LEU  56 -25.231   2.279   0.116
    6   HD11  LEU  56          HD11      LEU  56 -24.090   1.956   2.633
    7   HD13  LEU  56          HD12      LEU  56 -25.155   3.270   2.132
    8   HD12  LEU  56          HD13      LEU  56 -23.406   3.469   2.040
    9   HD23  LEU  56          HD21      LEU  56 -23.382   4.082  -0.080
   10   HD22  LEU  56          HD22      LEU  56 -23.707   2.967  -1.407
   11   HD21  LEU  56          HD23      LEU  56 -22.334   2.688  -0.338

  No H/Q in entry =          11
  In of MODEL   40
    1    H    GLY  57           H        GLY  57 -21.273  -1.036  -0.787
    2    HA3  GLY  57           HA2      GLY  57 -22.052  -3.768  -0.987
    3    HA2  GLY  57           HA3      GLY  57 -20.456  -3.187  -0.516

  No H/Q in entry =           3
  In of MODEL   40
    1    HA   PRO  58           HA       PRO  58 -23.194  -4.382   3.204
    2    HB2  PRO  58           HB2      PRO  58 -22.368  -6.946   3.805
    3    HB3  PRO  58           HB3      PRO  58 -23.775  -6.613   2.796
    4    HG2  PRO  58           HG2      PRO  58 -21.005  -7.343   2.002
    5    HG3  PRO  58           HG3      PRO  58 -22.543  -7.886   1.333
    6    HD2  PRO  58           HD2      PRO  58 -21.039  -5.982   0.110
    7    HD3  PRO  58           HD3      PRO  58 -22.801  -5.992   0.012

  No H/Q in entry =           7
  In of MODEL   40
    1    H    GLN  59           H        GLN  59 -19.804  -4.669   2.589
    2    HA   GLN  59           HA       GLN  59 -19.043  -4.651   5.347
    3    HB2  GLN  59           HB2      GLN  59 -17.523  -3.741   2.900
    4    HB3  GLN  59           HB3      GLN  59 -16.842  -3.855   4.511
    5    HG2  GLN  59           HG2      GLN  59 -17.922  -6.138   2.867
    6    HG3  GLN  59           HG3      GLN  59 -16.227  -5.771   3.143
    7   HE21  GLN  59          HE21      GLN  59 -18.393  -7.656   3.960
    8   HE22  GLN  59          HE22      GLN  59 -18.193  -8.328   5.468

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ILE  60           H        ILE  60 -20.118  -2.151   3.146
    2    HA   ILE  60           HA       ILE  60 -19.369  -0.153   5.192
    3    HB   ILE  60           HB       ILE  60 -19.697   1.565   3.370
    4   HG12  ILE  60          HG12      ILE  60 -19.384  -0.637   1.376
    5   HG13  ILE  60          HG13      ILE  60 -20.997  -0.201   1.938
    6   HG23  ILE  60          HG21      ILE  60 -17.531   1.430   2.665
    7   HG22  ILE  60          HG22      ILE  60 -17.579  -0.323   2.495
    8   HG21  ILE  60          HG23      ILE  60 -17.508   0.405   4.099
    9   HD13  ILE  60          HD11      ILE  60 -20.766   1.116   0.032
   10   HD12  ILE  60          HD12      ILE  60 -19.055   1.420   0.328
   11   HD11  ILE  60          HD13      ILE  60 -20.276   2.230   1.308

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ALA  61           H        ALA  61 -21.734  -1.869   5.264
    2    HA   ALA  61           HA       ALA  61 -24.048  -0.326   4.813
    3    HB1  ALA  61           HB1      ALA  61 -25.178  -1.881   6.140
    4    HB2  ALA  61           HB2      ALA  61 -23.758  -2.196   7.138
    5    HB3  ALA  61           HB3      ALA  61 -23.825  -2.804   5.484

  No H/Q in entry =           5
  In of MODEL   40
    1    H    TYR  62           H        TYR  62 -21.831  -0.323   7.606
    2    HA   TYR  62           HA       TYR  62 -23.470   1.246   9.282
    3    HB2  TYR  62           HB2      TYR  62 -21.467   1.758  10.526
    4    HB3  TYR  62           HB3      TYR  62 -21.402   0.069  10.023
    5    HD1  TYR  62           HD1      TYR  62 -19.729  -0.696   8.411
    6    HD2  TYR  62           HD2      TYR  62 -19.897   3.411   9.579
    7    HE1  TYR  62           HE1      TYR  62 -17.534  -0.311   7.355
    8    HE2  TYR  62           HE2      TYR  62 -17.687   3.792   8.524
    9    HH   TYR  62           HH       TYR  62 -15.747   1.172   7.418

  No H/Q in entry =           9
  In of MODEL   40
    1    H    MET  63           H        MET  63 -21.883   2.196   6.423
    2    HA   MET  63           HA       MET  63 -21.866   5.032   7.121
    3    HB2  MET  63           HB2      MET  63 -21.177   3.540   4.589
    4    HB3  MET  63           HB3      MET  63 -21.092   5.294   4.757
    5    HG2  MET  63           HG2      MET  63 -19.360   5.065   6.436
    6    HG3  MET  63           HG3      MET  63 -19.462   3.310   6.320
    7    HE1  MET  63           HE1      MET  63 -19.149   6.485   4.642
    8    HE3  MET  63           HE2      MET  63 -19.027   6.035   2.942
    9    HE2  MET  63           HE3      MET  63 -17.566   6.376   3.871

  No H/Q in entry =           9
  In of MODEL   40
    1    H    LEU  64           H        LEU  64 -24.329   3.044   6.160
    2    HA   LEU  64           HA       LEU  64 -25.619   4.399   4.087
    3    HB2  LEU  64           HB2      LEU  64 -26.371   2.249   5.004
    4    HB3  LEU  64           HB3      LEU  64 -26.869   3.064   6.486
    5    HG   LEU  64           HG       LEU  64 -28.631   4.229   5.264
    6   HD13  LEU  64          HD11      LEU  64 -28.367   4.487   3.031
    7   HD12  LEU  64          HD12      LEU  64 -28.925   2.820   2.885
    8   HD11  LEU  64          HD13      LEU  64 -27.198   3.171   2.939
    9   HD23  LEU  64          HD21      LEU  64 -29.001   1.393   4.513
   10   HD22  LEU  64          HD22      LEU  64 -30.046   2.472   5.438
   11   HD21  LEU  64          HD23      LEU  64 -28.629   1.752   6.200

  No H/Q in entry =          11
  In of MODEL   40
    1    HA   PRO  65           HA       PRO  65 -27.954   7.430   6.848
    2    HB2  PRO  65           HB2      PRO  65 -25.959   7.691   9.097
    3    HB3  PRO  65           HB3      PRO  65 -27.710   7.880   9.148
    4    HG2  PRO  65           HG2      PRO  65 -26.661   5.676  10.069
    5    HG3  PRO  65           HG3      PRO  65 -28.080   5.570   9.028
    6    HD2  PRO  65           HD2      PRO  65 -25.181   5.108   8.316
    7    HD3  PRO  65           HD3      PRO  65 -26.591   4.147   7.871

  No H/Q in entry =           7
  In of MODEL   40
    1    H    GLU  66           H        GLU  66 -24.400   7.560   6.912
    2    HA   GLU  66           HA       GLU  66 -24.251  10.372   6.510
    3    HB2  GLU  66           HB2      GLU  66 -22.322   8.162   5.850
    4    HB3  GLU  66           HB3      GLU  66 -21.962   9.876   5.643
    5    HG2  GLU  66           HG2      GLU  66 -22.185  10.232   8.012
    6    HG3  GLU  66           HG3      GLU  66 -22.623   8.539   8.243

  No H/Q in entry =           6
  In of MODEL   40
    1    H    ILE  67           H        ILE  67 -24.217   7.627   4.254
    2    HA   ILE  67           HA       ILE  67 -23.895   9.357   1.962
    3    HB   ILE  67           HB       ILE  67 -24.643   6.408   2.140
    4   HG12  ILE  67          HG12      ILE  67 -22.079   7.713   1.213
    5   HG13  ILE  67          HG13      ILE  67 -22.347   7.276   2.899
    6   HG21  ILE  67          HG21      ILE  67 -24.688   8.289  -0.082
    7   HG23  ILE  67          HG22      ILE  67 -25.227   6.611  -0.032
    8   HG22  ILE  67          HG23      ILE  67 -23.537   6.984  -0.365
    9   HD12  ILE  67          HD11      ILE  67 -21.843   5.532   0.546
   10   HD11  ILE  67          HD12      ILE  67 -22.823   4.906   1.870
   11   HD13  ILE  67          HD13      ILE  67 -21.175   5.455   2.176

  No H/Q in entry =          11
  In of MODEL   40
    1    H    GLN  68           H        GLN  68 -26.703   8.157   3.601
    2    HA   GLN  68           HA       GLN  68 -28.583   8.995   1.635
    3    HB2  GLN  68           HB2      GLN  68 -28.811   8.621   4.618
    4    HB3  GLN  68           HB3      GLN  68 -30.162   9.149   3.630
    5    HG2  GLN  68           HG2      GLN  68 -30.092   7.122   2.351
    6    HG3  GLN  68           HG3      GLN  68 -28.612   6.619   3.148
    7   HE21  GLN  68          HE21      GLN  68 -30.720   5.153   3.017
    8   HE22  GLN  68          HE22      GLN  68 -31.521   4.654   4.434

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ARG  69           H        ARG  69 -27.055  10.736   4.370
    2    HA   ARG  69           HA       ARG  69 -28.542  13.148   3.971
    3    HB2  ARG  69           HB2      ARG  69 -26.150  12.334   5.552
    4    HB3  ARG  69           HB3      ARG  69 -26.315  14.048   5.196
    5    HG2  ARG  69           HG2      ARG  69 -28.628  13.974   6.175
    6    HG3  ARG  69           HG3      ARG  69 -28.335  12.296   6.645
    7    HD2  ARG  69           HD2      ARG  69 -26.758  14.731   7.558
    8    HD3  ARG  69           HD3      ARG  69 -27.837  13.769   8.554
    9    HE   ARG  69           HE       ARG  69 -25.186  12.969   7.596
   10   HH21  ARG  69          HH11      ARG  69 -24.288  11.246   8.786
   11   HH22  ARG  69          HH12      ARG  69 -25.271  10.378   9.916
   12   HH11  ARG  69          HH21      ARG  69 -28.106  12.274   9.301
   13   HH12  ARG  69          HH22      ARG  69 -27.434  10.959  10.206

  No H/Q in entry =          13
  In of MODEL   40
    1    H    LEU  70           H        LEU  70 -25.610  11.887   2.600
    2    HA   LEU  70           HA       LEU  70 -24.618  14.306   1.432
    3    HB2  LEU  70           HB2      LEU  70 -23.510  12.039   2.021
    4    HB3  LEU  70           HB3      LEU  70 -24.105  11.546   0.436
    5    HG   LEU  70           HG       LEU  70 -22.584  12.996  -0.651
    6   HD11  LEU  70          HD11      LEU  70 -21.796  13.875   2.135
    7   HD13  LEU  70          HD12      LEU  70 -22.544  14.876   0.890
    8   HD12  LEU  70          HD13      LEU  70 -20.902  14.274   0.665
    9   HD22  LEU  70          HD21      LEU  70 -21.069  11.351  -0.426
   10   HD21  LEU  70          HD22      LEU  70 -21.964  10.782   0.983
   11   HD23  LEU  70          HD23      LEU  70 -20.632  11.920   1.185

  No H/Q in entry =          11
  In of MODEL   40
    1    H    LEU  71           H        LEU  71 -26.649  11.663   0.320
    2    HA   LEU  71           HA       LEU  71 -27.254  13.127  -2.192
    3    HB2  LEU  71           HB2      LEU  71 -27.314  10.135  -1.750
    4    HB3  LEU  71           HB3      LEU  71 -27.488  10.991  -3.281
    5    HG   LEU  71           HG       LEU  71 -24.966  11.122  -1.628
    6   HD12  LEU  71          HD11      LEU  71 -24.949   9.497  -4.063
    7   HD11  LEU  71          HD12      LEU  71 -25.925   8.824  -2.757
    8   HD13  LEU  71          HD13      LEU  71 -24.219   9.185  -2.489
    9   HD22  LEU  71          HD21      LEU  71 -25.160  12.933  -3.119
   10   HD21  LEU  71          HD22      LEU  71 -25.612  11.870  -4.451
   11   HD23  LEU  71          HD23      LEU  71 -23.984  11.800  -3.779

  No H/Q in entry =          11
  In of MODEL   40
    1    HA   PRO  72           HA       PRO  72 -31.085  12.491   0.442
    2    HB2  PRO  72           HB2      PRO  72 -32.062  15.009   0.367
    3    HB3  PRO  72           HB3      PRO  72 -30.729  14.618   1.453
    4    HG2  PRO  72           HG2      PRO  72 -30.609  15.824  -1.299
    5    HG3  PRO  72           HG3      PRO  72 -29.863  16.409   0.189
    6    HD2  PRO  72           HD2      PRO  72 -28.461  14.917  -1.584
    7    HD3  PRO  72           HD3      PRO  72 -28.193  14.759   0.151

  No H/Q in entry =           7
  In of MODEL   40
    1    H    ASN  73           H        ASN  73 -30.517  13.479  -2.774
    2    HA   ASN  73           HA       ASN  73 -33.362  13.040  -3.397
    3    HB2  ASN  73           HB2      ASN  73 -32.955  14.169  -5.494
    4    HB3  ASN  73           HB3      ASN  73 -32.473  15.170  -4.133
    5   HD21  ASN  73          HD21      ASN  73 -31.690  15.256  -6.813
    6   HD22  ASN  73          HD22      ASN  73 -30.017  15.172  -7.011

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LYS  74           H        LYS  74 -31.280  10.877  -2.982
    2    HA   LYS  74           HA       LYS  74 -31.791   9.461  -5.531
    3    HB2  LYS  74           HB2      LYS  74 -29.243   9.282  -3.919
    4    HB3  LYS  74           HB3      LYS  74 -29.593   8.456  -5.437
    5    HG2  LYS  74           HG2      LYS  74 -29.463  11.434  -5.230
    6    HG3  LYS  74           HG3      LYS  74 -28.043  10.435  -5.541
    7    HD2  LYS  74           HD2      LYS  74 -29.124   9.461  -7.482
    8    HD3  LYS  74           HD3      LYS  74 -30.586  10.393  -7.156
    9    HE2  LYS  74           HE2      LYS  74 -29.454  12.452  -7.598
   10    HE3  LYS  74           HE3      LYS  74 -27.895  11.633  -7.697
   11    HZ2  LYS  74           HZ1      LYS  74 -29.398  12.171  -9.816
   12    HZ1  LYS  74           HZ2      LYS  74 -29.982  10.620  -9.444
   13    HZ3  LYS  74           HZ3      LYS  74 -28.328  10.855  -9.746

  No H/Q in entry =          13
  In of MODEL   40
    1    HA   PRO  75           HA       PRO  75 -33.040   6.412  -2.560
    2    HB2  PRO  75           HB2      PRO  75 -33.256   4.184  -4.144
    3    HB3  PRO  75           HB3      PRO  75 -34.442   5.488  -4.208
    4    HG2  PRO  75           HG2      PRO  75 -32.085   4.998  -5.987
    5    HG3  PRO  75           HG3      PRO  75 -33.753   5.362  -6.429
    6    HD2  PRO  75           HD2      PRO  75 -31.896   7.312  -6.389
    7    HD3  PRO  75           HD3      PRO  75 -33.543   7.638  -5.845

  No H/Q in entry =           7
  In of MODEL   40
    1    H    VAL  76           H        VAL  76 -31.537   5.421  -1.193
    2    HA   VAL  76           HA       VAL  76 -29.024   4.324  -2.310
    3    HB   VAL  76           HB       VAL  76 -29.368   5.773   0.350
    4   HG11  VAL  76          HG11      VAL  76 -26.962   4.593  -1.051
    5   HG13  VAL  76          HG12      VAL  76 -27.632   4.111   0.509
    6   HG12  VAL  76          HG13      VAL  76 -26.856   5.684   0.333
    7   HG22  VAL  76          HG21      VAL  76 -28.788   7.703  -0.536
    8   HG21  VAL  76          HG22      VAL  76 -29.304   6.985  -2.063
    9   HG23  VAL  76          HG23      VAL  76 -27.599   6.972  -1.613

  No H/Q in entry =           9
  In of MODEL   40
    1    H    GLU  77           H        GLU  77 -28.709   2.181  -1.700
    2    HA   GLU  77           HA       GLU  77 -29.452   1.356   0.954
    3    HB2  GLU  77           HB2      GLU  77 -30.986  -0.361   0.427
    4    HB3  GLU  77           HB3      GLU  77 -31.605   1.138  -0.271
    5    HG2  GLU  77           HG2      GLU  77 -30.969   0.410  -2.462
    6    HG3  GLU  77           HG3      GLU  77 -30.259  -1.058  -1.793

  No H/Q in entry =           6
  In of MODEL   40
    1    H    VAL  78           H        VAL  78 -29.030  -0.715   1.611
    2    HA   VAL  78           HA       VAL  78 -26.335  -1.365   0.714
    3    HB   VAL  78           HB       VAL  78 -27.995  -2.327   3.083
    4   HG11  VAL  78          HG11      VAL  78 -25.606  -3.449   1.949
    5   HG13  VAL  78          HG12      VAL  78 -26.488  -3.962   3.390
    6   HG12  VAL  78          HG13      VAL  78 -25.220  -2.743   3.518
    7   HG22  VAL  78          HG21      VAL  78 -26.594  -0.903   4.419
    8   HG21  VAL  78          HG22      VAL  78 -27.377   0.035   3.147
    9   HG23  VAL  78          HG23      VAL  78 -25.679  -0.416   2.992

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ILE  79           H        ILE  79 -25.716  -3.247  -0.196
    2    HA   ILE  79           HA       ILE  79 -27.712  -4.814  -1.539
    3    HB   ILE  79           HB       ILE  79 -24.701  -5.206  -1.327
    4   HG12  ILE  79          HG12      ILE  79 -26.391  -4.174  -3.610
    5   HG13  ILE  79          HG13      ILE  79 -25.560  -3.127  -2.458
    6   HG22  ILE  79          HG21      ILE  79 -25.755  -6.432  -3.644
    7   HG21  ILE  79          HG22      ILE  79 -26.711  -6.998  -2.275
    8   HG23  ILE  79          HG23      ILE  79 -24.959  -7.198  -2.270
    9   HD13  ILE  79          HD11      ILE  79 -24.148  -3.175  -4.281
   10   HD12  ILE  79          HD12      ILE  79 -24.412  -4.897  -4.562
   11   HD11  ILE  79          HD13      ILE  79 -23.446  -4.366  -3.184

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ASP  80           H        ASP  80 -28.487  -6.775  -0.955
    2    HA   ASP  80           HA       ASP  80 -28.386  -7.674   1.689
    3    HB2  ASP  80           HB2      ASP  80 -30.117  -8.326   0.055
    4    HB3  ASP  80           HB3      ASP  80 -28.918  -9.280  -0.818

  No H/Q in entry =           4
  In of MODEL   40
    1    H    SER  81           H        SER  81 -26.798  -8.739   2.815
    2    HA   SER  81           HA       SER  81 -24.277  -9.308   1.615
    3    HB2  SER  81           HB2      SER  81 -23.673 -10.313   3.782
    4    HB3  SER  81           HB3      SER  81 -24.446  -8.742   3.999
    5    HG   SER  81           HG       SER  81 -26.410 -10.332   4.064

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU  82           H        LEU  82 -26.890 -11.519   1.943
    2    HA   LEU  82           HA       LEU  82 -25.240 -13.815   1.415
    3    HB2  LEU  82           HB2      LEU  82 -28.200 -13.328   1.175
    4    HB3  LEU  82           HB3      LEU  82 -27.430 -14.898   0.950
    5    HG   LEU  82           HG       LEU  82 -27.409 -13.335   3.515
    6   HD11  LEU  82          HD11      LEU  82 -29.673 -14.107   2.896
    7   HD13  LEU  82          HD12      LEU  82 -29.038 -15.005   4.277
    8   HD12  LEU  82          HD13      LEU  82 -29.047 -15.741   2.674
    9   HD21  LEU  82          HD21      LEU  82 -26.356 -15.986   2.574
   10   HD23  LEU  82          HD22      LEU  82 -26.735 -15.718   4.275
   11   HD22  LEU  82          HD23      LEU  82 -25.521 -14.719   3.475

  No H/Q in entry =          11
  In of MODEL   40
    1    H    LEU  83           H        LEU  83 -27.301 -11.678  -0.496
    2    HA   LEU  83           HA       LEU  83 -27.047 -13.024  -2.969
    3    HB2  LEU  83           HB2      LEU  83 -27.585 -10.140  -2.318
    4    HB3  LEU  83           HB3      LEU  83 -27.593 -10.783  -3.958
    5    HG   LEU  83           HG       LEU  83 -29.601 -11.263  -1.777
    6   HD13  LEU  83          HD11      LEU  83 -30.441  -9.450  -2.837
    7   HD12  LEU  83          HD12      LEU  83 -30.858 -10.582  -4.121
    8   HD11  LEU  83          HD13      LEU  83 -29.364  -9.648  -4.218
    9   HD23  LEU  83          HD21      LEU  83 -29.691 -12.524  -4.502
   10   HD22  LEU  83          HD22      LEU  83 -30.639 -12.918  -3.069
   11   HD21  LEU  83          HD23      LEU  83 -28.931 -13.345  -3.139

  No H/Q in entry =          11
  In of MODEL   40
    1    H    TYR  84           H        TYR  84 -25.197 -10.555  -1.296
    2    HA   TYR  84           HA       TYR  84 -23.365  -9.984  -3.432
    3    HB2  TYR  84           HB2      TYR  84 -23.930  -8.506  -1.434
    4    HB3  TYR  84           HB3      TYR  84 -22.906  -9.574  -0.478
    5    HD1  TYR  84           HD1      TYR  84 -20.482  -9.961  -1.490
    6    HD2  TYR  84           HD2      TYR  84 -22.966  -6.596  -2.348
    7    HE1  TYR  84           HE1      TYR  84 -18.486  -8.681  -2.189
    8    HE2  TYR  84           HE2      TYR  84 -20.982  -5.309  -3.060
    9    HH   TYR  84           HH       TYR  84 -18.537  -5.341  -2.649

  No H/Q in entry =           9
  In of MODEL   40
    1    H    GLY  85           H        GLY  85 -23.027 -11.975  -0.488
    2    HA3  GLY  85           HA2      GLY  85 -20.411 -12.802  -0.979
    3    HA2  GLY  85           HA3      GLY  85 -21.600 -13.703  -0.038

  No H/Q in entry =           3
  In of MODEL   40
    1    H    LYS  86           H        LYS  86 -23.434 -14.157  -2.094
    2    HA   LYS  86           HA       LYS  86 -22.279 -16.481  -3.357
    3    HB2  LYS  86           HB2      LYS  86 -24.545 -16.369  -2.367
    4    HB3  LYS  86           HB3      LYS  86 -24.994 -15.180  -3.589
    5    HG2  LYS  86           HG2      LYS  86 -24.752 -16.844  -5.317
    6    HG3  LYS  86           HG3      LYS  86 -24.261 -18.036  -4.113
    7    HD2  LYS  86           HD2      LYS  86 -26.393 -17.724  -2.934
    8    HD3  LYS  86           HD3      LYS  86 -26.884 -16.532  -4.136
    9    HE2  LYS  86           HE2      LYS  86 -27.813 -18.855  -4.460
   10    HE3  LYS  86           HE3      LYS  86 -26.973 -18.170  -5.851
   11    HZ1  LYS  86           HZ1      LYS  86 -25.438 -19.752  -3.910
   12    HZ3  LYS  86           HZ2      LYS  86 -25.189 -19.554  -5.579
   13    HZ2  LYS  86           HZ3      LYS  86 -26.429 -20.570  -5.020

  No H/Q in entry =          13
  In of MODEL   40
    1    H    VAL  87           H        VAL  87 -22.415 -13.269  -4.249
    2    HA   VAL  87           HA       VAL  87 -22.175 -12.083  -6.190
    3    HB   VAL  87           HB       VAL  87 -20.991 -14.557  -7.491
    4   HG11  VAL  87          HG11      VAL  87 -21.345 -12.207  -8.600
    5   HG13  VAL  87          HG12      VAL  87 -19.802 -13.035  -8.818
    6   HG12  VAL  87          HG13      VAL  87 -19.949 -11.739  -7.631
    7   HG21  VAL  87          HG21      VAL  87 -20.104 -14.259  -5.141
    8   HG23  VAL  87          HG22      VAL  87 -19.421 -12.733  -5.697
    9   HG22  VAL  87          HG23      VAL  87 -18.909 -14.249  -6.436

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ASP  88           H        ASP  88 -24.657 -12.837  -5.831
    2    HA   ASP  88           HA       ASP  88 -25.732 -14.102  -8.226
    3    HB2  ASP  88           HB2      ASP  88 -26.707 -14.392  -5.898
    4    HB3  ASP  88           HB3      ASP  88 -27.237 -12.713  -5.995

  No H/Q in entry =           4
  In of MODEL   40
    1    H    GLY  89           H        GLY  89 -25.090 -12.814  -9.869
    2    HA3  GLY  89           HA2      GLY  89 -25.397 -10.053 -10.068
    3    HA2  GLY  89           HA3      GLY  89 -25.327 -11.170 -11.429

  No H/Q in entry =           3
  In of MODEL   40
    1    H    LEU  90           H        LEU  90 -27.709 -12.632 -10.973
    2    HA   LEU  90           HA       LEU  90 -29.609 -10.781 -12.080
    3    HB2  LEU  90           HB2      LEU  90 -29.568 -13.177 -12.660
    4    HB3  LEU  90           HB3      LEU  90 -30.050 -13.566 -11.009
    5    HG   LEU  90           HG       LEU  90 -32.218 -12.546 -11.364
    6   HD13  LEU  90          HD11      LEU  90 -32.123 -10.799 -12.840
    7   HD12  LEU  90          HD12      LEU  90 -32.611 -12.059 -13.975
    8   HD11  LEU  90          HD13      LEU  90 -30.916 -11.587 -13.858
    9   HD23  LEU  90          HD21      LEU  90 -32.084 -14.171 -13.801
   10   HD22  LEU  90          HD22      LEU  90 -33.049 -14.380 -12.340
   11   HD21  LEU  90          HD23      LEU  90 -31.370 -14.916 -12.370

  No H/Q in entry =          11
  In of MODEL   40
    1    H    GLY  91           H        GLY  91 -29.362 -12.273  -8.896
    2    HA3  GLY  91           HA2      GLY  91 -31.744 -11.268  -7.848
    3    HA2  GLY  91           HA3      GLY  91 -30.326 -11.737  -6.911

  No H/Q in entry =           3
  In of MODEL   40
    1    H    VAL  92           H        VAL  92 -28.496  -9.825  -7.773
    2    HA   VAL  92           HA       VAL  92 -29.386  -7.562  -6.222
    3    HB   VAL  92           HB       VAL  92 -26.826  -7.915  -7.826
    4   HG12  VAL  92          HG11      VAL  92 -27.068  -6.039  -5.499
    5   HG11  VAL  92          HG12      VAL  92 -27.764  -5.526  -7.038
    6   HG13  VAL  92          HG13      VAL  92 -26.048  -5.916  -6.933
    7   HG22  VAL  92          HG21      VAL  92 -26.525  -9.490  -6.235
    8   HG21  VAL  92          HG22      VAL  92 -27.701  -8.763  -5.137
    9   HG23  VAL  92          HG23      VAL  92 -26.076  -8.088  -5.265

  No H/Q in entry =           9
  In of MODEL   40
    1    H    LEU  93           H        LEU  93 -28.962  -8.204  -9.643
    2    HA   LEU  93           HA       LEU  93 -29.431  -5.587 -10.571
    3    HB2  LEU  93           HB2      LEU  93 -28.711  -7.411 -12.035
    4    HB3  LEU  93           HB3      LEU  93 -30.266  -8.211 -11.807
    5    HG   LEU  93           HG       LEU  93 -31.370  -6.296 -12.926
    6   HD11  LEU  93          HD11      LEU  93 -29.592  -4.617 -12.430
    7   HD13  LEU  93          HD12      LEU  93 -30.037  -4.668 -14.137
    8   HD12  LEU  93          HD13      LEU  93 -28.547  -5.435 -13.591
    9   HD23  LEU  93          HD21      LEU  93 -30.316  -6.815 -15.218
   10   HD22  LEU  93          HD22      LEU  93 -31.096  -8.109 -14.309
   11   HD21  LEU  93          HD23      LEU  93 -29.336  -7.973 -14.318

  No H/Q in entry =          11
  In of MODEL   40
    1    H    LYS  94           H        LYS  94 -31.684  -8.240  -9.712
    2    HA   LYS  94           HA       LYS  94 -34.094  -6.906 -10.328
    3    HB2  LYS  94           HB2      LYS  94 -33.473  -9.066  -8.318
    4    HB3  LYS  94           HB3      LYS  94 -35.102  -8.444  -8.580
    5    HG2  LYS  94           HG2      LYS  94 -34.989  -9.215 -10.915
    6    HG3  LYS  94           HG3      LYS  94 -33.394  -9.894 -10.593
    7    HD2  LYS  94           HD2      LYS  94 -34.444 -11.277  -8.764
    8    HD3  LYS  94           HD3      LYS  94 -36.018 -10.701  -9.313
    9    HE2  LYS  94           HE2      LYS  94 -35.470 -11.606 -11.582
   10    HE3  LYS  94           HE3      LYS  94 -34.018 -12.323 -10.884
   11    HZ3  LYS  94           HZ1      LYS  94 -35.797 -13.928 -11.046
   12    HZ2  LYS  94           HZ2      LYS  94 -36.813 -12.948 -10.101
   13    HZ1  LYS  94           HZ3      LYS  94 -35.418 -13.633  -9.419

  No H/Q in entry =          13
  In of MODEL   40
    1    H    ALA  95           H        ALA  95 -32.254  -6.943  -7.286
    2    HA   ALA  95           HA       ALA  95 -34.169  -5.450  -5.799
    3    HB2  ALA  95           HB1      ALA  95 -31.730  -6.715  -5.273
    4    HB3  ALA  95           HB2      ALA  95 -32.745  -5.855  -4.115
    5    HB1  ALA  95           HB3      ALA  95 -31.438  -5.008  -4.941

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA  96           H        ALA  96 -31.577  -4.476  -7.907
    2    HA   ALA  96           HA       ALA  96 -31.603  -1.713  -7.133
    3    HB2  ALA  96           HB1      ALA  96 -30.261  -1.425  -9.248
    4    HB3  ALA  96           HB2      ALA  96 -30.488  -3.144  -9.566
    5    HB1  ALA  96           HB3      ALA  96 -29.591  -2.624  -8.141

  No H/Q in entry =           5
  In of MODEL   40
    1    H    VAL  97           H        VAL  97 -33.066  -3.495  -9.814
    2    HA   VAL  97           HA       VAL  97 -34.244  -1.246 -11.065
    3    HB   VAL  97           HB       VAL  97 -34.921  -4.205 -11.105
    4   HG11  VAL  97          HG11      VAL  97 -36.804  -2.281 -11.583
    5   HG13  VAL  97          HG12      VAL  97 -36.794  -3.874 -12.339
    6   HG12  VAL  97          HG13      VAL  97 -36.106  -2.493 -13.190
    7   HG21  VAL  97          HG21      VAL  97 -33.734  -2.321 -13.144
    8   HG23  VAL  97          HG22      VAL  97 -34.112  -4.019 -13.432
    9   HG22  VAL  97          HG23      VAL  97 -32.877  -3.578 -12.251

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ALA  98           H        ALA  98 -35.319  -3.476  -8.525
    2    HA   ALA  98           HA       ALA  98 -37.926  -2.442  -8.162
    3    HB1  ALA  98           HB1      ALA  98 -36.811  -4.594  -7.135
    4    HB3  ALA  98           HB2      ALA  98 -38.028  -3.723  -6.198
    5    HB2  ALA  98           HB3      ALA  98 -36.315  -3.499  -5.845

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA  99           H        ALA  99 -34.878  -1.509  -6.527
    2    HA   ALA  99           HA       ALA  99 -36.086   0.422  -4.860
    3    HB1  ALA  99           HB1      ALA  99 -33.405  -0.350  -5.618
    4    HB2  ALA  99           HB2      ALA  99 -33.981   0.375  -4.117
    5    HB3  ALA  99           HB3      ALA  99 -33.555   1.402  -5.485

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ILE 100           H        ILE 100 -35.066   0.600  -8.219
    2    HA   ILE 100           HA       ILE 100 -35.369   3.439  -8.434
    3    HB   ILE 100           HB       ILE 100 -35.380   1.283 -10.575
    4   HG12  ILE 100          HG12      ILE 100 -33.302   3.366  -9.912
    5   HG13  ILE 100          HG13      ILE 100 -33.264   1.719  -9.283
    6   HG21  ILE 100          HG21      ILE 100 -35.929   4.183 -10.701
    7   HG23  ILE 100          HG22      ILE 100 -36.385   2.894 -11.817
    8   HG22  ILE 100          HG23      ILE 100 -34.761   3.580 -11.878
    9   HD12  ILE 100          HD11      ILE 100 -32.786   2.700 -12.058
   10   HD11  ILE 100          HD12      ILE 100 -33.375   1.058 -11.803
   11   HD13  ILE 100          HD13      ILE 100 -31.846   1.568 -11.089

  No H/Q in entry =          11
  In of MODEL   40
    1    H    LYS 101           H        LYS 101 -37.552   0.734  -9.154
    2    HA   LYS 101           HA       LYS 101 -39.706   2.293 -10.144
    3    HB2  LYS 101           HB2      LYS 101 -39.466  -0.475  -9.019
    4    HB3  LYS 101           HB3      LYS 101 -41.051   0.220  -9.358
    5    HG2  LYS 101           HG2      LYS 101 -40.592   0.377 -11.656
    6    HG3  LYS 101           HG3      LYS 101 -38.880   0.045 -11.410
    7    HD2  LYS 101           HD2      LYS 101 -40.050  -1.914 -12.293
    8    HD3  LYS 101           HD3      LYS 101 -39.403  -2.219 -10.680
    9    HE2  LYS 101           HE2      LYS 101 -41.432  -3.002 -10.167
   10    HE3  LYS 101           HE3      LYS 101 -41.961  -1.320 -10.166
   11    HZ3  LYS 101           HZ1      LYS 101 -42.854  -1.512 -12.280
   12    HZ2  LYS 101           HZ2      LYS 101 -43.249  -3.005 -11.572
   13    HZ1  LYS 101           HZ3      LYS 101 -41.950  -2.899 -12.661

  No H/Q in entry =          13
  In of MODEL   40
    1    H    LYS 102           H        LYS 102 -39.138   0.835  -6.939
    2    HA   LYS 102           HA       LYS 102 -41.430   1.931  -5.730
    3    HB2  LYS 102           HB2      LYS 102 -40.110   0.118  -4.722
    4    HB3  LYS 102           HB3      LYS 102 -38.765   1.231  -4.483
    5    HG2  LYS 102           HG2      LYS 102 -40.134   2.566  -2.979
    6    HG3  LYS 102           HG3      LYS 102 -41.483   1.457  -3.220
    7    HD2  LYS 102           HD2      LYS 102 -40.174  -0.357  -2.202
    8    HD3  LYS 102           HD3      LYS 102 -38.826   0.755  -1.959
    9    HE2  LYS 102           HE2      LYS 102 -40.237   2.171  -0.542
   10    HE3  LYS 102           HE3      LYS 102 -41.604   1.091  -0.807
   11    HZ1  LYS 102           HZ1      LYS 102 -39.805  -0.590   0.187
   12    HZ3  LYS 102           HZ2      LYS 102 -40.949   0.246   1.123
   13    HZ2  LYS 102           HZ3      LYS 102 -39.363   0.839   0.991

  No H/Q in entry =          13
  In of MODEL   40
    1    H    ALA 103           H        ALA 103 -38.542   3.449  -6.752
    2    HA   ALA 103           HA       ALA 103 -38.857   5.749  -4.965
    3    HB2  ALA 103           HB1      ALA 103 -36.904   6.571  -6.548
    4    HB3  ALA 103           HB2      ALA 103 -36.797   4.856  -6.949
    5    HB1  ALA 103           HB3      ALA 103 -36.586   5.387  -5.281

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA 104           H        ALA 104 -39.458   4.998  -8.310
    2    HA   ALA 104           HA       ALA 104 -40.165   7.755  -8.926
    3    HB2  ALA 104           HB1      ALA 104 -40.188   7.089 -11.129
    4    HB1  ALA 104           HB2      ALA 104 -40.846   5.497 -10.751
    5    HB3  ALA 104           HB3      ALA 104 -39.135   5.834 -10.478

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA 105           H        ALA 105 -41.675   5.581  -7.119
    2    HA   ALA 105           HA       ALA 105 -44.156   6.870  -7.081
    3    HB2  ALA 105           HB1      ALA 105 -44.872   5.982  -9.118
    4    HB3  ALA 105           HB2      ALA 105 -45.452   4.765  -7.981
    5    HB1  ALA 105           HB3      ALA 105 -43.973   4.481  -8.896

  No H/Q in entry =           5
  In of MODEL   41
    1    H1   ALA   1           H3       ALA   1 -12.153 -15.921  -2.400
    2    H2   ALA   1           H2       ALA   1 -11.203 -17.060  -3.235
    3    H3   ALA   1           H1       ALA   1 -12.352 -16.125  -4.073
    4    HA   ALA   1           HA       ALA   1 -13.740 -17.834  -3.830
    5    HB3  ALA   1           HB1      ALA   1 -12.333 -19.595  -3.360
    6    HB1  ALA   1           HB2      ALA   1 -13.093 -19.481  -1.772
    7    HB2  ALA   1           HB3      ALA   1 -11.522 -18.732  -2.053

  No H/Q in entry =           7
  In of MODEL   41
    1    H    GLU   2           H        GLU   2 -15.360 -18.693  -2.176
    2    HA   GLU   2           HA       GLU   2 -17.021 -16.979  -1.126
    3    HB2  GLU   2           HB2      GLU   2 -16.069 -19.393   0.429
    4    HB3  GLU   2           HB3      GLU   2 -17.599 -18.552   0.678
    5    HG2  GLU   2           HG2      GLU   2 -18.569 -19.650  -1.055
    6    HG3  GLU   2           HG3      GLU   2 -17.246 -19.245  -2.138

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLU   3           H        GLU   3 -15.105 -18.311   1.505
    2    HA   GLU   3           HA       GLU   3 -15.344 -15.954   3.054
    3    HB2  GLU   3           HB2      GLU   3 -13.743 -18.490   3.316
    4    HB3  GLU   3           HB3      GLU   3 -13.521 -17.165   4.459
    5    HG2  GLU   3           HG2      GLU   3 -15.715 -17.327   5.274
    6    HG3  GLU   3           HG3      GLU   3 -16.303 -18.136   3.827

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LEU   4           H        LEU   4 -12.377 -17.419   1.673
    2    HA   LEU   4           HA       LEU   4 -10.556 -15.502   2.268
    3    HB2  LEU   4           HB2      LEU   4 -10.774 -16.810  -0.453
    4    HB3  LEU   4           HB3      LEU   4  -9.327 -16.078   0.232
    5    HG   LEU   4           HG       LEU   4 -10.808 -18.481   1.351
    6   HD13  LEU   4          HD11      LEU   4  -9.166 -19.830   0.429
    7   HD12  LEU   4          HD12      LEU   4  -7.964 -18.539   0.400
    8   HD11  LEU   4          HD13      LEU   4  -9.250 -18.573  -0.805
    9   HD23  LEU   4          HD21      LEU   4  -8.559 -18.526   2.737
   10   HD22  LEU   4          HD22      LEU   4  -9.888 -17.493   3.260
   11   HD21  LEU   4          HD23      LEU   4  -8.528 -16.798   2.377

  No H/Q in entry =          11
  In of MODEL   41
    1    H    GLU   5           H        GLU   5 -12.887 -15.319  -0.411
    2    HA   GLU   5           HA       GLU   5 -11.897 -12.832  -1.418
    3    HB2  GLU   5           HB2      GLU   5 -13.229 -14.429  -2.780
    4    HB3  GLU   5           HB3      GLU   5 -14.633 -14.077  -1.771
    5    HG2  GLU   5           HG2      GLU   5 -14.532 -11.712  -2.419
    6    HG3  GLU   5           HG3      GLU   5 -13.097 -12.029  -3.393

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLU   6           H        GLU   6 -14.621 -13.720   0.672
    2    HA   GLU   6           HA       GLU   6 -15.542 -11.048   1.061
    3    HB2  GLU   6           HB2      GLU   6 -15.945 -13.581   2.666
    4    HB3  GLU   6           HB3      GLU   6 -16.760 -12.058   3.016
    5    HG2  GLU   6           HG2      GLU   6 -16.890 -13.465   0.336
    6    HG3  GLU   6           HG3      GLU   6 -18.117 -13.625   1.591

  No H/Q in entry =           6
  In of MODEL   41
    1    H    VAL   7           H        VAL   7 -13.225 -13.139   2.644
    2    HA   VAL   7           HA       VAL   7 -12.773 -11.553   4.966
    3    HB   VAL   7           HB       VAL   7 -11.054 -13.591   3.527
    4   HG11  VAL   7          HG11      VAL   7 -10.600 -12.046   6.087
    5   HG13  VAL   7          HG12      VAL   7  -9.496 -12.259   4.729
    6   HG12  VAL   7          HG13      VAL   7  -9.843 -13.614   5.803
    7   HG21  VAL   7          HG21      VAL   7 -13.304 -14.165   4.744
    8   HG23  VAL   7          HG22      VAL   7 -12.381 -13.880   6.221
    9   HG22  VAL   7          HG23      VAL   7 -11.878 -15.141   5.097

  No H/Q in entry =           9
  In of MODEL   41
    1    H    VAL   8           H        VAL   8 -11.255 -11.669   1.759
    2    HA   VAL   8           HA       VAL   8  -9.204  -9.782   2.250
    3    HB   VAL   8           HB       VAL   8 -10.658 -10.476  -0.314
    4   HG11  VAL   8          HG11      VAL   8  -8.336  -8.656   0.286
    5   HG13  VAL   8          HG12      VAL   8  -9.706  -8.389  -0.794
    6   HG12  VAL   8          HG13      VAL   8  -8.420  -9.501  -1.261
    7   HG21  VAL   8          HG21      VAL   8  -8.982 -12.065   1.192
    8   HG23  VAL   8          HG22      VAL   8  -7.829 -11.259   0.133
    9   HG22  VAL   8          HG23      VAL   8  -9.145 -12.202  -0.559

  No H/Q in entry =           9
  In of MODEL   41
    1    H    MET   9           H        MET   9 -12.550  -9.417   1.082
    2    HA   MET   9           HA       MET   9 -12.502  -6.642   0.638
    3    HB2  MET   9           HB2      MET   9 -14.713  -8.516   1.485
    4    HB3  MET   9           HB3      MET   9 -14.994  -6.793   1.227
    5    HG2  MET   9           HG2      MET   9 -14.439  -6.924  -1.065
    6    HG3  MET   9           HG3      MET   9 -13.636  -8.482  -0.869
    7    HE1  MET   9           HE1      MET   9 -16.882  -6.725   0.091
    8    HE3  MET   9           HE2      MET   9 -16.879  -8.074   1.221
    9    HE2  MET   9           HE3      MET   9 -18.120  -7.983  -0.025

  No H/Q in entry =           9
  In of MODEL   41
    1    H    GLY  10           H        GLY  10 -13.160  -8.527   3.570
    2    HA3  GLY  10           HA2      GLY  10 -13.725  -6.339   5.280
    3    HA2  GLY  10           HA3      GLY  10 -13.152  -7.923   5.801

  No H/Q in entry =           3
  In of MODEL   41
    1    H    LEU  11           H        LEU  11 -10.703  -8.036   4.491
    2    HA   LEU  11           HA       LEU  11  -9.015  -6.585   6.246
    3    HB2  LEU  11           HB2      LEU  11  -8.454  -8.015   3.645
    4    HB3  LEU  11           HB3      LEU  11  -7.190  -7.298   4.644
    5    HG   LEU  11           HG       LEU  11  -9.181  -9.341   5.663
    6   HD13  LEU  11          HD11      LEU  11  -7.948 -10.575   4.106
    7   HD12  LEU  11          HD12      LEU  11  -7.014 -10.802   5.584
    8   HD11  LEU  11          HD13      LEU  11  -6.479  -9.638   4.373
    9   HD22  LEU  11          HD21      LEU  11  -8.338  -8.315   7.578
   10   HD21  LEU  11          HD22      LEU  11  -6.802  -7.906   6.817
   11   HD23  LEU  11          HD23      LEU  11  -7.118  -9.563   7.332

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  12           H        ILE  12  -9.914  -6.056   2.853
    2    HA   ILE  12           HA       ILE  12  -8.236  -3.816   2.422
    3    HB   ILE  12           HB       ILE  12 -10.882  -4.512   1.123
    4   HG12  ILE  12          HG12      ILE  12  -8.843  -6.152   1.053
    5   HG13  ILE  12          HG13      ILE  12  -9.686  -5.790  -0.438
    6   HG21  ILE  12          HG21      ILE  12  -8.667  -2.618   0.273
    7   HG23  ILE  12          HG22      ILE  12 -10.320  -2.177   0.680
    8   HG22  ILE  12          HG23      ILE  12  -9.983  -3.124  -0.740
    9   HD13  ILE  12          HD11      ILE  12  -7.957  -4.226  -1.078
   10   HD12  ILE  12          HD12      ILE  12  -7.179  -5.734  -0.604
   11   HD11  ILE  12          HD13      ILE  12  -7.186  -4.370   0.490

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  13           H        ILE  13 -11.597  -4.103   3.509
    2    HA   ILE  13           HA       ILE  13 -12.078  -1.319   3.768
    3    HB   ILE  13           HB       ILE  13 -13.268  -3.746   5.127
    4   HG12  ILE  13          HG12      ILE  13 -13.497  -3.182   2.591
    5   HG13  ILE  13          HG13      ILE  13 -14.915  -3.671   3.494
    6   HG22  ILE  13          HG21      ILE  13 -15.179  -2.097   5.675
    7   HG21  ILE  13          HG22      ILE  13 -13.995  -0.822   5.423
    8   HG23  ILE  13          HG23      ILE  13 -13.739  -2.021   6.687
    9   HD11  ILE  13          HD11      ILE  13 -14.154  -0.773   3.059
   10   HD13  ILE  13          HD12      ILE  13 -15.645  -1.406   3.730
   11   HD12  ILE  13          HD13      ILE  13 -15.288  -1.664   2.037

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ASN  14           H        ASN  14 -10.953  -3.793   6.054
    2    HA   ASN  14           HA       ASN  14 -10.770  -2.145   8.334
    3    HB2  ASN  14           HB2      ASN  14 -10.496  -4.751   8.022
    4    HB3  ASN  14           HB3      ASN  14  -8.790  -4.352   7.867
    5   HD21  ASN  14          HD21      ASN  14  -9.420  -5.873  10.047
    6   HD22  ASN  14          HD22      ASN  14  -9.402  -4.947  11.468

  No H/Q in entry =           6
  In of MODEL   41
    1    H    SER  15           H        SER  15  -8.356  -2.959   5.850
    2    HA   SER  15           HA       SER  15  -6.227  -1.445   6.922
    3    HB2  SER  15           HB2      SER  15  -5.199  -1.662   4.768
    4    HB3  SER  15           HB3      SER  15  -6.146  -3.128   4.993
    5    HG   SER  15           HG       SER  15  -7.281  -2.574   3.332

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLY  16           H        GLY  16  -8.830  -0.608   4.666
    2    HA3  GLY  16           HA2      GLY  16  -7.992   2.038   4.106
    3    HA2  GLY  16           HA3      GLY  16  -9.638   1.429   3.943

  No H/Q in entry =           3
  In of MODEL   41
    1    H    GLN  17           H        GLN  17 -10.181   0.709   6.594
    2    HA   GLN  17           HA       GLN  17 -10.912   3.212   7.724
    3    HB2  GLN  17           HB2      GLN  17 -12.139   1.138   8.223
    4    HB3  GLN  17           HB3      GLN  17 -10.725   0.500   9.063
    5    HG2  GLN  17           HG2      GLN  17 -10.829   2.332  10.686
    6    HG3  GLN  17           HG3      GLN  17 -12.195   3.040   9.826
    7   HE21  GLN  17          HE21      GLN  17 -12.397   2.227  12.576
    8   HE22  GLN  17          HE22      GLN  17 -13.472   0.915  12.658

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ALA  18           H        ALA  18  -8.264   0.956   8.357
    2    HA   ALA  18           HA       ALA  18  -7.183   2.190  10.626
    3    HB2  ALA  18           HB1      ALA  18  -6.550  -0.026   9.268
    4    HB3  ALA  18           HB2      ALA  18  -5.397   0.772  10.339
    5    HB1  ALA  18           HB3      ALA  18  -5.318   1.044   8.597

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ARG  19           H        ARG  19  -6.408   2.708   7.177
    2    HA   ARG  19           HA       ARG  19  -4.530   4.774   7.602
    3    HB2  ARG  19           HB2      ARG  19  -4.842   3.622   5.411
    4    HB3  ARG  19           HB3      ARG  19  -6.391   4.447   5.227
    5    HG2  ARG  19           HG2      ARG  19  -5.283   6.630   5.290
    6    HG3  ARG  19           HG3      ARG  19  -3.728   5.860   5.600
    7    HD2  ARG  19           HD2      ARG  19  -3.852   6.440   3.255
    8    HD3  ARG  19           HD3      ARG  19  -3.921   4.680   3.407
    9    HE   ARG  19           HE       ARG  19  -6.564   5.564   3.390
   10   HH21  ARG  19          HH11      ARG  19  -7.755   5.702   1.468
   11   HH22  ARG  19          HH12      ARG  19  -6.931   5.781  -0.050
   12   HH11  ARG  19          HH21      ARG  19  -3.784   5.646   1.362
   13   HH12  ARG  19          HH22      ARG  19  -4.681   5.747  -0.110

  No H/Q in entry =          13
  In of MODEL   41
    1    H    SER  20           H        SER  20  -8.027   4.853   6.994
    2    HA   SER  20           HA       SER  20  -8.411   7.605   6.934
    3    HB2  SER  20           HB2      SER  20 -10.169   5.900   6.465
    4    HB3  SER  20           HB3      SER  20 -10.265   5.576   8.194
    5    HG   SER  20           HG       SER  20 -10.390   8.235   7.543

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU  21           H        LEU  21  -8.397   5.434   9.747
    2    HA   LEU  21           HA       LEU  21  -8.862   7.433  11.702
    3    HB2  LEU  21           HB2      LEU  21  -7.483   4.746  11.876
    4    HB3  LEU  21           HB3      LEU  21  -7.806   5.765  13.275
    5    HG   LEU  21           HG       LEU  21  -9.956   4.825  11.353
    6   HD11  LEU  21          HD11      LEU  21  -8.880   3.627  13.904
    7   HD13  LEU  21          HD12      LEU  21  -9.200   2.831  12.362
    8   HD12  LEU  21          HD13      LEU  21 -10.543   3.334  13.390
    9   HD21  LEU  21          HD21      LEU  21  -9.915   6.398  13.917
   10   HD23  LEU  21          HD22      LEU  21 -11.301   5.360  13.600
   11   HD22  LEU  21          HD23      LEU  21 -10.902   6.655  12.481

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ALA  22           H        ALA  22  -5.892   6.084  10.308
    2    HA   ALA  22           HA       ALA  22  -4.030   7.422  11.929
    3    HB2  ALA  22           HB1      ALA  22  -3.591   5.566  10.246
    4    HB1  ALA  22           HB2      ALA  22  -2.408   6.874  10.279
    5    HB3  ALA  22           HB3      ALA  22  -3.622   6.813   9.000

  No H/Q in entry =           5
  In of MODEL   41
    1    H    TYR  23           H        TYR  23  -5.349   8.413   8.739
    2    HA   TYR  23           HA       TYR  23  -4.039  10.923   8.663
    3    HB2  TYR  23           HB2      TYR  23  -5.106   9.990   6.672
    4    HB3  TYR  23           HB3      TYR  23  -6.688  10.088   7.449
    5    HD1  TYR  23           HD1      TYR  23  -3.798  12.151   6.299
    6    HD2  TYR  23           HD2      TYR  23  -7.944  12.087   7.413
    7    HE1  TYR  23           HE1      TYR  23  -4.040  14.495   5.527
    8    HE2  TYR  23           HE2      TYR  23  -8.188  14.431   6.640
    9    HH   TYR  23           HH       TYR  23  -5.818  16.487   6.231

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ALA  24           H        ALA  24  -7.151   9.919  10.038
    2    HA   ALA  24           HA       ALA  24  -8.017  12.503  10.796
    3    HB1  ALA  24           HB1      ALA  24  -9.823  11.235  11.264
    4    HB2  ALA  24           HB2      ALA  24  -8.996  10.677  12.716
    5    HB3  ALA  24           HB3      ALA  24  -8.857   9.761  11.217

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA  25           H        ALA  25  -5.994  10.072  12.385
    2    HA   ALA  25           HA       ALA  25  -5.676  11.337  14.883
    3    HB2  ALA  25           HB1      ALA  25  -4.882   8.990  14.074
    4    HB3  ALA  25           HB2      ALA  25  -3.879   9.863  15.234
    5    HB1  ALA  25           HB3      ALA  25  -3.438   9.844  13.526

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU  26           H        LEU  26  -3.880  11.643  11.847
    2    HA   LEU  26           HA       LEU  26  -1.942  13.486  12.761
    3    HB2  LEU  26           HB2      LEU  26  -1.623  12.329  10.662
    4    HB3  LEU  26           HB3      LEU  26  -3.102  13.020  10.001
    5    HG   LEU  26           HG       LEU  26  -2.111  15.281  10.130
    6   HD12  LEU  26          HD11      LEU  26   0.426  15.328  10.551
    7   HD11  LEU  26          HD12      LEU  26   0.217  13.748  11.301
    8   HD13  LEU  26          HD13      LEU  26  -0.607  15.157  11.969
    9   HD21  LEU  26          HD21      LEU  26  -0.343  13.239   8.748
   10   HD23  LEU  26          HD22      LEU  26  -0.403  14.958   8.371
   11   HD22  LEU  26          HD23      LEU  26  -1.815  13.945   8.082

  No H/Q in entry =          11
  In of MODEL   41
    1    H    LYS  27           H        LYS  27  -5.125  13.931  11.273
    2    HA   LYS  27           HA       LYS  27  -5.097  16.719  11.064
    3    HB2  LYS  27           HB2      LYS  27  -6.824  15.221  10.080
    4    HB3  LYS  27           HB3      LYS  27  -7.482  14.964  11.695
    5    HG2  LYS  27           HG2      LYS  27  -7.936  17.367  11.920
    6    HG3  LYS  27           HG3      LYS  27  -7.227  17.664  10.330
    7    HD2  LYS  27           HD2      LYS  27  -8.942  16.209   9.295
    8    HD3  LYS  27           HD3      LYS  27  -9.658  15.928  10.884
    9    HE2  LYS  27           HE2      LYS  27 -10.125  18.336  11.116
   10    HE3  LYS  27           HE3      LYS  27  -9.381  18.638   9.542
   11    HZ3  LYS  27           HZ1      LYS  27 -11.757  18.489   9.295
   12    HZ2  LYS  27           HZ2      LYS  27 -11.792  16.975  10.070
   13    HZ1  LYS  27           HZ3      LYS  27 -11.045  17.140   8.550

  No H/Q in entry =          13
  In of MODEL   41
    1    H    GLN  28           H        GLN  28  -5.973  14.635  13.797
    2    HA   GLN  28           HA       GLN  28  -6.892  16.637  15.563
    3    HB2  GLN  28           HB2      GLN  28  -5.465  14.023  16.121
    4    HB3  GLN  28           HB3      GLN  28  -6.223  15.025  17.361
    5    HG2  GLN  28           HG2      GLN  28  -7.659  13.876  14.951
    6    HG3  GLN  28           HG3      GLN  28  -7.720  13.195  16.577
    7   HE21  GLN  28          HE21      GLN  28  -9.622  14.932  14.601
    8   HE22  GLN  28          HE22      GLN  28 -10.378  15.965  15.716

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ALA  29           H        ALA  29  -3.660  15.368  14.887
    2    HA   ALA  29           HA       ALA  29  -2.239  16.786  16.863
    3    HB1  ALA  29           HB1      ALA  29  -0.300  16.108  15.752
    4    HB3  ALA  29           HB2      ALA  29  -1.051  16.219  14.160
    5    HB2  ALA  29           HB3      ALA  29  -1.464  14.887  15.239

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LYS  30           H        LYS  30  -3.096  17.645  13.528
    2    HA   LYS  30           HA       LYS  30  -1.704  20.096  13.422
    3    HB2  LYS  30           HB2      LYS  30  -4.225  19.197  12.010
    4    HB3  LYS  30           HB3      LYS  30  -3.402  20.717  11.663
    5    HG2  LYS  30           HG2      LYS  30  -1.321  19.437  11.159
    6    HG3  LYS  30           HG3      LYS  30  -2.217  17.935  11.407
    7    HD2  LYS  30           HD2      LYS  30  -3.782  18.558   9.607
    8    HD3  LYS  30           HD3      LYS  30  -2.908  20.071   9.360
    9    HE2  LYS  30           HE2      LYS  30  -0.866  18.790   8.790
   10    HE3  LYS  30           HE3      LYS  30  -1.758  17.282   9.006
   11    HZ2  LYS  30           HZ1      LYS  30  -1.582  18.145   6.661
   12    HZ1  LYS  30           HZ2      LYS  30  -2.635  19.403   7.122
   13    HZ3  LYS  30           HZ3      LYS  30  -3.149  17.782   7.198

  No H/Q in entry =          13
  In of MODEL   41
    1    H    GLN  31           H        GLN  31  -4.802  19.228  14.830
    2    HA   GLN  31           HA       GLN  31  -5.584  21.982  15.270
    3    HB2  GLN  31           HB2      GLN  31  -6.751  19.533  16.599
    4    HB3  GLN  31           HB3      GLN  31  -7.520  21.099  16.346
    5    HG2  GLN  31           HG2      GLN  31  -6.799  20.317  13.761
    6    HG3  GLN  31           HG3      GLN  31  -7.317  18.812  14.512
    7   HE21  GLN  31          HE21      GLN  31  -8.731  20.370  12.401
    8   HE22  GLN  31          HE22      GLN  31 -10.249  20.755  13.054

  No H/Q in entry =           8
  In of MODEL   41
    1    H    GLY  32           H        GLY  32  -3.264  20.073  16.602
    2    HA3  GLY  32           HA2      GLY  32  -1.870  20.550  18.406
    3    HA2  GLY  32           HA3      GLY  32  -3.007  21.788  18.922

  No H/Q in entry =           3
  In of MODEL   41
    1    H    ASP  33           H        ASP  33  -4.411  18.738  18.268
    2    HA   ASP  33           HA       ASP  33  -4.825  18.288  21.149
    3    HB2  ASP  33           HB2      ASP  33  -6.220  17.260  18.672
    4    HB3  ASP  33           HB3      ASP  33  -6.566  16.654  20.290

  No H/Q in entry =           4
  In of MODEL   41
    1    H    PHE  34           H        PHE  34  -2.653  17.451  21.462
    2    HA   PHE  34           HA       PHE  34  -1.637  15.202  20.071
    3    HB2  PHE  34           HB2      PHE  34  -1.031  16.200  22.863
    4    HB3  PHE  34           HB3      PHE  34  -0.094  14.979  22.002
    5    HD1  PHE  34           HD1      PHE  34  -0.287  18.406  22.725
    6    HD2  PHE  34           HD2      PHE  34   0.565  15.696  19.501
    7    HE1  PHE  34           HE1      PHE  34   1.001  20.180  21.568
    8    HE2  PHE  34           HE2      PHE  34   1.848  17.474  18.349
    9    HZ   PHE  34           HZ       PHE  34   2.068  19.713  19.387

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ALA  35           H        ALA  35  -3.684  15.478  22.929
    2    HA   ALA  35           HA       ALA  35  -3.460  12.820  23.835
    3    HB3  ALA  35           HB1      ALA  35  -5.923  13.436  24.685
    4    HB1  ALA  35           HB2      ALA  35  -5.397  15.055  24.225
    5    HB2  ALA  35           HB3      ALA  35  -4.481  14.140  25.421

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA  36           H        ALA  36  -5.913  14.316  21.725
    2    HA   ALA  36           HA       ALA  36  -7.315  11.896  21.252
    3    HB1  ALA  36           HB1      ALA  36  -8.776  13.307  20.288
    4    HB3  ALA  36           HB2      ALA  36  -7.603  13.730  19.040
    5    HB2  ALA  36           HB3      ALA  36  -7.636  14.622  20.561

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA  37           H        ALA  37  -4.640  13.492  19.584
    2    HA   ALA  37           HA       ALA  37  -4.591  11.849  17.292
    3    HB3  ALA  37           HB1      ALA  37  -2.611  13.576  18.713
    4    HB2  ALA  37           HB2      ALA  37  -3.138  13.624  17.032
    5    HB1  ALA  37           HB3      ALA  37  -1.979  12.402  17.560

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LYS  38           H        LYS  38  -2.839  11.563  20.375
    2    HA   LYS  38           HA       LYS  38  -1.499   9.168  19.897
    3    HB2  LYS  38           HB2      LYS  38  -1.836  10.936  22.035
    4    HB3  LYS  38           HB3      LYS  38  -2.448   9.405  22.656
    5    HG2  LYS  38           HG2      LYS  38  -0.347   8.294  22.127
    6    HG3  LYS  38           HG3      LYS  38   0.256   9.740  21.310
    7    HD2  LYS  38           HD2      LYS  38   0.414  10.966  23.342
    8    HD3  LYS  38           HD3      LYS  38  -0.601   9.813  24.210
    9    HE2  LYS  38           HE2      LYS  38   1.755   9.512  24.835
   10    HE3  LYS  38           HE3      LYS  38   1.160   8.090  23.974
   11    HZ3  LYS  38           HZ1      LYS  38   2.462   8.510  22.195
   12    HZ2  LYS  38           HZ2      LYS  38   3.410   9.347  23.331
   13    HZ1  LYS  38           HZ3      LYS  38   2.328  10.198  22.334

  No H/Q in entry =          13
  In of MODEL   41
    1    H    ALA  39           H        ALA  39  -4.743   9.650  21.291
    2    HA   ALA  39           HA       ALA  39  -5.290   6.930  21.803
    3    HB3  ALA  39           HB1      ALA  39  -7.458   8.860  21.025
    4    HB2  ALA  39           HB2      ALA  39  -6.564   9.097  22.527
    5    HB1  ALA  39           HB3      ALA  39  -7.472   7.607  22.267

  No H/Q in entry =           5
  In of MODEL   41
    1    H    MET  40           H        MET  40  -5.880   8.930  18.949
    2    HA   MET  40           HA       MET  40  -7.342   6.985  17.491
    3    HB2  MET  40           HB2      MET  40  -5.744   9.387  16.582
    4    HB3  MET  40           HB3      MET  40  -6.762   8.418  15.513
    5    HG2  MET  40           HG2      MET  40  -7.809   9.670  18.065
    6    HG3  MET  40           HG3      MET  40  -7.868  10.499  16.512
    7    HE3  MET  40           HE1      MET  40 -10.438   8.858  14.447
    8    HE2  MET  40           HE2      MET  40  -8.686   8.985  14.302
    9    HE1  MET  40           HE3      MET  40  -9.612  10.347  14.930

  No H/Q in entry =           9
  In of MODEL   41
    1    H    MET  41           H        MET  41  -3.856   7.743  17.619
    2    HA   MET  41           HA       MET  41  -3.083   5.986  15.526
    3    HB2  MET  41           HB2      MET  41  -1.475   6.670  18.000
    4    HB3  MET  41           HB3      MET  41  -0.851   6.021  16.488
    5    HG2  MET  41           HG2      MET  41  -2.018   8.194  15.474
    6    HG3  MET  41           HG3      MET  41  -1.789   8.788  17.117
    7    HE2  MET  41           HE1      MET  41   1.141   6.708  17.492
    8    HE1  MET  41           HE2      MET  41   0.343   8.000  18.384
    9    HE3  MET  41           HE3      MET  41   1.966   8.251  17.744

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ASP  42           H        ASP  42  -3.472   5.522  19.013
    2    HA   ASP  42           HA       ASP  42  -2.421   2.935  19.183
    3    HB2  ASP  42           HB2      ASP  42  -3.309   4.695  20.998
    4    HB3  ASP  42           HB3      ASP  42  -4.730   3.661  20.926

  No H/Q in entry =           4
  In of MODEL   41
    1    H    GLN  43           H        GLN  43  -5.760   4.016  18.672
    2    HA   GLN  43           HA       GLN  43  -6.887   1.421  18.483
    3    HB2  GLN  43           HB2      GLN  43  -7.824   4.064  17.343
    4    HB3  GLN  43           HB3      GLN  43  -8.778   2.579  17.324
    5    HG2  GLN  43           HG2      GLN  43  -8.489   2.468  19.832
    6    HG3  GLN  43           HG3      GLN  43  -7.775   4.077  19.758
    7   HE21  GLN  43          HE21      GLN  43  -9.958   4.148  21.253
    8   HE22  GLN  43          HE22      GLN  43 -11.320   4.712  20.416

  No H/Q in entry =           8
  In of MODEL   41
    1    H    SER  44           H        SER  44  -5.555   3.636  16.067
    2    HA   SER  44           HA       SER  44  -6.242   2.140  13.781
    3    HB2  SER  44           HB2      SER  44  -5.001   4.533  14.220
    4    HB3  SER  44           HB3      SER  44  -3.640   3.544  13.696
    5    HG   SER  44           HG       SER  44  -4.754   4.503  11.928

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ARG  45           H        ARG  45  -3.368   2.052  15.868
    2    HA   ARG  45           HA       ARG  45  -1.873   0.103  14.496
    3    HB2  ARG  45           HB2      ARG  45  -1.044   1.535  16.362
    4    HB3  ARG  45           HB3      ARG  45  -2.033   0.602  17.483
    5    HG2  ARG  45           HG2      ARG  45  -0.787  -1.452  16.850
    6    HG3  ARG  45           HG3      ARG  45   0.225  -0.493  15.771
    7    HD2  ARG  45           HD2      ARG  45   0.947   0.898  17.724
    8    HD3  ARG  45           HD3      ARG  45   0.029  -0.179  18.799
    9    HE   ARG  45           HE       ARG  45   1.741  -1.769  17.227
   10   HH21  ARG  45          HH11      ARG  45   3.645  -2.578  18.071
   11   HH22  ARG  45          HH12      ARG  45   4.410  -1.783  19.402
   12   HH11  ARG  45          HH21      ARG  45   2.024   0.706  19.610
   13   HH12  ARG  45          HH22      ARG  45   3.491   0.079  20.271

  No H/Q in entry =          13
  In of MODEL   41
    1    H    MET  46           H        MET  46  -4.275  -0.225  17.091
    2    HA   MET  46           HA       MET  46  -4.091  -3.022  17.407
    3    HB2  MET  46           HB2      MET  46  -6.277  -1.030  17.994
    4    HB3  MET  46           HB3      MET  46  -6.468  -2.749  18.344
    5    HG2  MET  46           HG2      MET  46  -4.451  -2.705  19.746
    6    HG3  MET  46           HG3      MET  46  -4.210  -1.005  19.375
    7    HE2  MET  46           HE1      MET  46  -5.275  -0.385  22.932
    8    HE1  MET  46           HE2      MET  46  -4.102  -0.173  21.637
    9    HE3  MET  46           HE3      MET  46  -4.267  -1.743  22.417

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ALA  47           H        ALA  47  -6.117  -1.023  15.301
    2    HA   ALA  47           HA       ALA  47  -7.721  -3.087  14.238
    3    HB3  ALA  47           HB1      ALA  47  -8.412  -0.854  13.813
    4    HB1  ALA  47           HB2      ALA  47  -7.916  -1.490  12.245
    5    HB2  ALA  47           HB3      ALA  47  -6.844  -0.412  13.141

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU  48           H        LEU  48  -4.607  -1.764  13.191
    2    HA   LEU  48           HA       LEU  48  -4.311  -3.360  10.855
    3    HB2  LEU  48           HB2      LEU  48  -2.265  -2.065  12.665
    4    HB3  LEU  48           HB3      LEU  48  -1.889  -2.788  11.101
    5    HG   LEU  48           HG       LEU  48  -3.924  -0.580  11.479
    6   HD13  LEU  48          HD11      LEU  48  -1.809   0.309  12.147
    7   HD12  LEU  48          HD12      LEU  48  -2.082   0.856  10.493
    8   HD11  LEU  48          HD13      LEU  48  -0.979  -0.484  10.808
    9   HD22  LEU  48          HD21      LEU  48  -4.385  -1.573   9.405
   10   HD21  LEU  48          HD22      LEU  48  -2.699  -2.000   9.115
   11   HD23  LEU  48          HD23      LEU  48  -3.226  -0.324   8.949

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ASN  49           H        ASN  49  -3.272  -3.742  14.205
    2    HA   ASN  49           HA       ASN  49  -1.658  -5.998  13.885
    3    HB2  ASN  49           HB2      ASN  49  -1.677  -4.675  15.930
    4    HB3  ASN  49           HB3      ASN  49  -3.347  -5.124  16.244
    5   HD21  ASN  49          HD21      ASN  49  -0.078  -6.539  15.914
    6   HD22  ASN  49          HD22      ASN  49  -0.378  -7.856  16.942

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLU  50           H        GLU  50  -5.130  -5.736  14.547
    2    HA   GLU  50           HA       GLU  50  -5.630  -8.538  14.662
    3    HB2  GLU  50           HB2      GLU  50  -7.226  -6.855  15.529
    4    HB3  GLU  50           HB3      GLU  50  -7.517  -6.296  13.880
    5    HG2  GLU  50           HG2      GLU  50  -8.371  -8.498  13.246
    6    HG3  GLU  50           HG3      GLU  50  -7.991  -9.135  14.842

  No H/Q in entry =           6
  In of MODEL   41
    1    H    ALA  51           H        ALA  51  -5.701  -6.147  12.059
    2    HA   ALA  51           HA       ALA  51  -6.674  -7.884  10.039
    3    HB2  ALA  51           HB1      ALA  51  -6.457  -6.075   8.666
    4    HB1  ALA  51           HB2      ALA  51  -4.821  -5.718   9.218
    5    HB3  ALA  51           HB3      ALA  51  -6.209  -5.209  10.181

  No H/Q in entry =           5
  In of MODEL   41
    1    H    HIS  52           H        HIS  52  -3.389  -6.962  11.030
    2    HA   HIS  52           HA       HIS  52  -1.980  -8.452   9.088
    3    HB2  HIS  52           HB2      HIS  52  -0.971  -6.704  10.544
    4    HB3  HIS  52           HB3      HIS  52  -1.113  -7.804  11.916
    5    HD1  HIS  52           HD1      HIS  52   0.380  -9.969  11.873
    6    HD2  HIS  52           HD2      HIS  52   1.145  -7.291   8.770
    7    HE1  HIS  52           HE1      HIS  52   2.582 -10.677  10.841
    8    HE2  HIS  52           HE2      HIS  52   3.062  -9.055   8.948

  No H/Q in entry =           8
  In of MODEL   41
    1    H    LEU  53           H        LEU  53  -3.198  -9.325  12.300
    2    HA   LEU  53           HA       LEU  53  -1.993 -11.865  12.504
    3    HB2  LEU  53           HB2      LEU  53  -4.485 -10.687  13.708
    4    HB3  LEU  53           HB3      LEU  53  -4.022 -12.361  14.005
    5    HG   LEU  53           HG       LEU  53  -2.121 -10.043  14.476
    6   HD12  LEU  53          HD11      LEU  53  -2.729 -10.263  16.877
    7   HD11  LEU  53          HD12      LEU  53  -3.997 -11.404  16.432
    8   HD13  LEU  53          HD13      LEU  53  -4.093  -9.729  15.900
    9   HD21  LEU  53          HD21      LEU  53  -2.175 -12.971  15.239
   10   HD23  LEU  53          HD22      LEU  53  -1.222 -11.811  16.158
   11   HD22  LEU  53          HD23      LEU  53  -0.873 -12.080  14.460

  No H/Q in entry =          11
  In of MODEL   41
    1    H    VAL  54           H        VAL  54  -5.103 -10.848  11.130
    2    HA   VAL  54           HA       VAL  54  -6.008 -13.447  10.447
    3    HB   VAL  54           HB       VAL  54  -6.659 -10.719   9.304
    4   HG12  VAL  54          HG11      VAL  54  -8.755 -12.104   8.490
    5   HG11  VAL  54          HG12      VAL  54  -7.639 -13.467   8.569
    6   HG13  VAL  54          HG13      VAL  54  -7.280 -12.094   7.524
    7   HG22  VAL  54          HG21      VAL  54  -7.571 -10.753  11.453
    8   HG21  VAL  54          HG22      VAL  54  -7.821 -12.497  11.437
    9   HG23  VAL  54          HG23      VAL  54  -8.902 -11.445  10.525

  No H/Q in entry =           9
  In of MODEL   41
    1    H    GLN  55           H        GLN  55  -4.137 -10.995   8.657
    2    HA   GLN  55           HA       GLN  55  -3.996 -12.466   6.244
    3    HB2  GLN  55           HB2      GLN  55  -3.398 -10.201   6.049
    4    HB3  GLN  55           HB3      GLN  55  -2.291 -10.271   7.418
    5    HG2  GLN  55           HG2      GLN  55  -0.568 -11.116   6.149
    6    HG3  GLN  55           HG3      GLN  55  -1.636 -12.096   5.154
    7   HE21  GLN  55          HE21      GLN  55  -1.649 -11.412   3.031
    8   HE22  GLN  55          HE22      GLN  55  -1.453  -9.809   2.517

  No H/Q in entry =           8
  In of MODEL   41
    1    H    THR  56           H        THR  56  -1.899 -12.432   9.131
    2    HA   THR  56           HA       THR  56   0.186 -14.029   8.224
    3    HB   THR  56           HB       THR  56  -1.063 -14.280  10.969
    4    HG1  THR  56           HG1      THR  56   0.629 -12.314   9.843
    5   HG22  THR  56          HG21      THR  56   1.851 -14.392  10.189
    6   HG21  THR  56          HG22      THR  56   0.828 -15.830  10.168
    7   HG23  THR  56          HG23      THR  56   1.095 -14.957  11.678

  No H/Q in entry =           7
  In of MODEL   41
    1    H    LYS  57           H        LYS  57  -2.936 -15.068   9.581
    2    HA   LYS  57           HA       LYS  57  -2.484 -17.864   9.344
    3    HB2  LYS  57           HB2      LYS  57  -4.308 -16.771  10.681
    4    HB3  LYS  57           HB3      LYS  57  -5.097 -16.330   9.174
    5    HG2  LYS  57           HG2      LYS  57  -5.306 -18.708   8.571
    6    HG3  LYS  57           HG3      LYS  57  -4.507 -19.164  10.074
    7    HD2  LYS  57           HD2      LYS  57  -7.027 -17.493  10.059
    8    HD3  LYS  57           HD3      LYS  57  -7.080 -19.256  10.062
    9    HE2  LYS  57           HE2      LYS  57  -5.588 -19.198  12.119
   10    HE3  LYS  57           HE3      LYS  57  -5.832 -17.454  12.173
   11    HZ1  LYS  57           HZ1      LYS  57  -8.342 -18.311  11.940
   12    HZ3  LYS  57           HZ2      LYS  57  -7.576 -18.026  13.430
   13    HZ2  LYS  57           HZ3      LYS  57  -7.666 -19.604  12.808

  No H/Q in entry =          13
  In of MODEL   41
    1    H    LEU  58           H        LEU  58  -3.814 -15.430   7.157
    2    HA   LEU  58           HA       LEU  58  -4.607 -17.262   5.154
    3    HB2  LEU  58           HB2      LEU  58  -4.005 -14.313   5.012
    4    HB3  LEU  58           HB3      LEU  58  -4.663 -15.255   3.673
    5    HG   LEU  58           HG       LEU  58  -5.951 -15.070   6.416
    6   HD11  LEU  58          HD11      LEU  58  -6.247 -13.430   3.919
    7   HD13  LEU  58          HD12      LEU  58  -6.243 -12.918   5.606
    8   HD12  LEU  58          HD13      LEU  58  -7.662 -13.716   4.932
    9   HD22  LEU  58          HD21      LEU  58  -6.908 -16.983   5.549
   10   HD21  LEU  58          HD22      LEU  58  -6.564 -16.535   3.878
   11   HD23  LEU  58          HD23      LEU  58  -7.931 -15.809   4.723

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  59           H        ILE  59  -1.476 -16.043   6.021
    2    HA   ILE  59           HA       ILE  59  -0.369 -16.776   3.390
    3    HB   ILE  59           HB       ILE  59   0.392 -14.703   4.943
    4   HG12  ILE  59          HG12      ILE  59   2.497 -16.370   3.552
    5   HG13  ILE  59          HG13      ILE  59   1.312 -15.437   2.675
    6   HG21  ILE  59          HG21      ILE  59   1.119 -16.464   6.727
    7   HG23  ILE  59          HG22      ILE  59   2.219 -15.153   6.366
    8   HG22  ILE  59          HG23      ILE  59   2.483 -16.752   5.671
    9   HD11  ILE  59          HD11      ILE  59   2.043 -13.394   3.903
   10   HD13  ILE  59          HD12      ILE  59   3.326 -14.098   2.922
   11   HD12  ILE  59          HD13      ILE  59   3.307 -14.357   4.667

  No H/Q in entry =          11
  In of MODEL   41
    1    H    GLU  60           H        GLU  60  -0.388 -17.873   6.761
    2    HA   GLU  60           HA       GLU  60   1.647 -19.848   6.508
    3    HB2  GLU  60           HB2      GLU  60   0.860 -19.047   8.691
    4    HB3  GLU  60           HB3      GLU  60  -0.730 -19.741   8.384
    5    HG2  GLU  60           HG2      GLU  60   0.268 -21.996   8.268
    6    HG3  GLU  60           HG3      GLU  60   1.864 -21.305   8.555

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLY  61           H        GLY  61  -1.862 -19.953   6.011
    2    HA3  GLY  61           HA2      GLY  61  -1.606 -22.748   5.062
    3    HA2  GLY  61           HA3      GLY  61  -3.095 -22.013   5.648

  No H/Q in entry =           3
  In of MODEL   41
    1    H    ASP  62           H        ASP  62  -0.861 -20.435   3.449
    2    HA   ASP  62           HA       ASP  62  -2.907 -19.805   1.585
    3    HB2  ASP  62           HB2      ASP  62  -0.885 -18.426   1.975
    4    HB3  ASP  62           HB3      ASP  62   0.098 -19.695   1.253

  No H/Q in entry =           4
  In of MODEL   41
    1    H    ALA  63           H        ALA  63  -3.194 -22.511   1.729
    2    HA   ALA  63           HA       ALA  63  -1.691 -24.030  -0.152
    3    HB3  ALA  63           HB1      ALA  63  -4.523 -24.442   0.803
    4    HB2  ALA  63           HB2      ALA  63  -3.068 -25.076   1.570
    5    HB1  ALA  63           HB3      ALA  63  -3.532 -25.637  -0.037

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLY  64           H        GLY  64  -4.646 -22.105  -0.375
    2    HA3  GLY  64           HA2      GLY  64  -5.852 -21.305  -2.153
    3    HA2  GLY  64           HA3      GLY  64  -4.351 -21.380  -3.062

  No H/Q in entry =           3
  In of MODEL   41
    1    H    GLU  65           H        GLU  65  -4.919 -22.283  -4.985
    2    HA   GLU  65           HA       GLU  65  -6.977 -24.200  -5.270
    3    HB2  GLU  65           HB2      GLU  65  -4.717 -23.471  -7.135
    4    HB3  GLU  65           HB3      GLU  65  -6.092 -24.487  -7.572
    5    HG2  GLU  65           HG2      GLU  65  -6.316 -21.653  -6.522
    6    HG3  GLU  65           HG3      GLU  65  -6.419 -22.099  -8.223

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLY  66           H        GLY  66  -3.551 -24.481  -4.848
    2    HA3  GLY  66           HA2      GLY  66  -3.716 -27.227  -4.038
    3    HA2  GLY  66           HA3      GLY  66  -2.898 -27.022  -5.574

  No H/Q in entry =           3
  In of MODEL   41
    1    H    LYS  67           H        LYS  67  -1.522 -28.191  -3.647
    2    HA   LYS  67           HA       LYS  67  -0.176 -26.858  -1.708
    3    HB2  LYS  67           HB2      LYS  67   1.803 -28.451  -2.493
    4    HB3  LYS  67           HB3      LYS  67   0.332 -29.083  -1.741
    5    HG2  LYS  67           HG2      LYS  67  -0.652 -29.561  -3.893
    6    HG3  LYS  67           HG3      LYS  67   0.657 -28.731  -4.733
    7    HD2  LYS  67           HD2      LYS  67   2.255 -30.425  -3.841
    8    HD3  LYS  67           HD3      LYS  67   0.895 -31.284  -3.116
    9    HE2  LYS  67           HE2      LYS  67   1.123 -30.655  -6.072
   10    HE3  LYS  67           HE3      LYS  67   1.563 -32.202  -5.353
   11    HZ2  LYS  67           HZ1      LYS  67  -1.106 -30.948  -5.519
   12    HZ1  LYS  67           HZ2      LYS  67  -0.774 -32.184  -4.403
   13    HZ3  LYS  67           HZ3      LYS  67  -0.621 -32.476  -6.069

  No H/Q in entry =          13
  In of MODEL   41
    1    H    MET  68           H        MET  68   0.936 -27.085  -5.047
    2    HA   MET  68           HA       MET  68   3.219 -25.439  -4.781
    3    HB2  MET  68           HB2      MET  68   1.609 -26.414  -7.124
    4    HB3  MET  68           HB3      MET  68   3.010 -25.363  -7.332
    5    HG2  MET  68           HG2      MET  68   3.072 -27.970  -5.792
    6    HG3  MET  68           HG3      MET  68   3.552 -27.818  -7.483
    7    HE3  MET  68           HE1      MET  68   6.046 -27.288  -3.886
    8    HE2  MET  68           HE2      MET  68   5.121 -28.629  -4.558
    9    HE1  MET  68           HE3      MET  68   4.278 -27.259  -3.839

  No H/Q in entry =           9
  In of MODEL   41
    1    H    LYS  69           H        LYS  69  -0.087 -24.689  -5.868
    2    HA   LYS  69           HA       LYS  69   0.641 -21.966  -6.495
    3    HB2  LYS  69           HB2      LYS  69  -1.097 -23.458  -7.710
    4    HB3  LYS  69           HB3      LYS  69  -2.198 -22.871  -6.457
    5    HG2  LYS  69           HG2      LYS  69  -1.671 -20.558  -7.018
    6    HG3  LYS  69           HG3      LYS  69  -0.477 -21.088  -8.203
    7    HD2  LYS  69           HD2      LYS  69  -3.367 -21.941  -8.380
    8    HD3  LYS  69           HD3      LYS  69  -2.799 -20.433  -9.101
    9    HE2  LYS  69           HE2      LYS  69  -0.993 -21.828 -10.256
   10    HE3  LYS  69           HE3      LYS  69  -1.907 -23.248  -9.748
   11    HZ1  LYS  69           HZ1      LYS  69  -3.232 -21.039 -11.180
   12    HZ3  LYS  69           HZ2      LYS  69  -3.706 -22.665 -11.052
   13    HZ2  LYS  69           HZ3      LYS  69  -2.389 -22.236 -12.036

  No H/Q in entry =          13
  In of MODEL   41
    1    H    VAL  70           H        VAL  70  -0.570 -20.076  -5.746
    2    HA   VAL  70           HA       VAL  70  -1.425 -20.285  -2.913
    3    HB   VAL  70           HB       VAL  70  -0.423 -17.892  -2.776
    4   HG13  VAL  70          HG11      VAL  70   1.725 -18.788  -2.095
    5   HG12  VAL  70          HG12      VAL  70   1.484 -20.226  -3.089
    6   HG11  VAL  70          HG13      VAL  70   0.476 -19.958  -1.667
    7   HG21  VAL  70          HG21      VAL  70  -0.061 -17.910  -5.358
    8   HG23  VAL  70          HG22      VAL  70   1.347 -18.910  -5.009
    9   HG22  VAL  70          HG23      VAL  70   1.248 -17.276  -4.358

  No H/Q in entry =           9
  In of MODEL   41
    1    H    SER  71           H        SER  71  -2.849 -18.565  -2.233
    2    HA   SER  71           HA       SER  71  -4.938 -17.989  -4.093
    3    HB2  SER  71           HB2      SER  71  -5.259 -18.235  -1.599
    4    HB3  SER  71           HB3      SER  71  -4.429 -16.696  -1.390
    5    HG   SER  71           HG       SER  71  -6.914 -17.258  -2.590

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU  72           H        LEU  72  -5.113 -16.355  -5.473
    2    HA   LEU  72           HA       LEU  72  -3.009 -14.539  -5.954
    3    HB2  LEU  72           HB2      LEU  72  -5.871 -14.605  -6.905
    4    HB3  LEU  72           HB3      LEU  72  -4.678 -13.443  -7.481
    5    HG   LEU  72           HG       LEU  72  -4.259 -16.448  -7.607
    6   HD11  LEU  72          HD11      LEU  72  -5.244 -14.549  -9.759
    7   HD13  LEU  72          HD12      LEU  72  -6.207 -15.801  -8.974
    8   HD12  LEU  72          HD13      LEU  72  -4.842 -16.249  -9.999
    9   HD23  LEU  72          HD21      LEU  72  -2.691 -15.579  -9.516
   10   HD22  LEU  72          HD22      LEU  72  -2.133 -15.423  -7.858
   11   HD21  LEU  72          HD23      LEU  72  -2.812 -14.028  -8.692

  No H/Q in entry =          11
  In of MODEL   41
    1    H    VAL  73           H        VAL  73  -6.107 -14.186  -4.332
    2    HA   VAL  73           HA       VAL  73  -6.160 -11.415  -3.987
    3    HB   VAL  73           HB       VAL  73  -7.876 -11.776  -2.401
    4   HG11  VAL  73          HG11      VAL  73  -8.117 -12.686  -4.839
    5   HG13  VAL  73          HG12      VAL  73  -9.340 -13.114  -3.644
    6   HG12  VAL  73          HG13      VAL  73  -8.079 -14.272  -4.067
    7   HG22  VAL  73          HG21      VAL  73  -7.052 -13.211  -0.766
    8   HG21  VAL  73          HG22      VAL  73  -6.423 -14.360  -1.947
    9   HG23  VAL  73          HG23      VAL  73  -8.155 -14.290  -1.619

  No H/Q in entry =           9
  In of MODEL   41
    1    H    LEU  74           H        LEU  74  -4.219 -13.774  -2.394
    2    HA   LEU  74           HA       LEU  74  -3.816 -12.626   0.127
    3    HB2  LEU  74           HB2      LEU  74  -3.026 -14.844  -0.370
    4    HB3  LEU  74           HB3      LEU  74  -1.967 -14.229  -1.637
    5    HG   LEU  74           HG       LEU  74  -0.707 -12.939   0.083
    6   HD12  LEU  74          HD11      LEU  74  -1.161 -13.777   2.493
    7   HD11  LEU  74          HD12      LEU  74  -2.737 -14.273   1.876
    8   HD13  LEU  74          HD13      LEU  74  -2.268 -12.574   1.830
    9   HD23  LEU  74          HD21      LEU  74  -0.851 -15.773   1.013
   10   HD22  LEU  74          HD22      LEU  74   0.540 -14.759   0.702
   11   HD21  LEU  74          HD23      LEU  74  -0.352 -15.431  -0.643

  No H/Q in entry =          11
  In of MODEL   41
    1    H    VAL  75           H        VAL  75  -1.920 -12.234  -2.827
    2    HA   VAL  75           HA       VAL  75  -0.130 -10.302  -1.818
    3    HB   VAL  75           HB       VAL  75  -1.080 -10.791  -4.642
    4   HG11  VAL  75          HG11      VAL  75   1.202  -9.075  -3.564
    5   HG13  VAL  75          HG12      VAL  75  -0.217  -8.501  -4.429
    6   HG12  VAL  75          HG13      VAL  75   0.974  -9.489  -5.259
    7   HG21  VAL  75          HG21      VAL  75   0.197 -12.589  -3.308
    8   HG23  VAL  75          HG22      VAL  75   1.567 -11.477  -3.338
    9   HG22  VAL  75          HG23      VAL  75   0.907 -12.105  -4.849

  No H/Q in entry =           9
  In of MODEL   41
    1    H    GLU  76           H        GLU  76  -3.278  -9.967  -3.482
    2    HA   GLU  76           HA       GLU  76  -3.338  -7.153  -3.590
    3    HB2  GLU  76           HB2      GLU  76  -4.990  -8.598  -4.753
    4    HB3  GLU  76           HB3      GLU  76  -5.645  -9.096  -3.200
    5    HG2  GLU  76           HG2      GLU  76  -7.106  -7.392  -4.070
    6    HG3  GLU  76           HG3      GLU  76  -6.214  -6.662  -2.749

  No H/Q in entry =           6
  In of MODEL   41
    1    H    ALA  77           H        ALA  77  -4.447  -9.379  -1.047
    2    HA   ALA  77           HA       ALA  77  -5.412  -7.376   0.706
    3    HB2  ALA  77           HB1      ALA  77  -6.004  -9.729   0.993
    4    HB3  ALA  77           HB2      ALA  77  -5.233  -9.118   2.455
    5    HB1  ALA  77           HB3      ALA  77  -4.322 -10.131   1.337

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLN  78           H        GLN  78  -2.260  -8.918   0.350
    2    HA   GLN  78           HA       GLN  78  -1.010  -7.750   2.600
    3    HB2  GLN  78           HB2      GLN  78  -0.142  -9.691   1.249
    4    HB3  GLN  78           HB3      GLN  78   0.295  -8.546  -0.016
    5    HG2  GLN  78           HG2      GLN  78   1.751  -7.348   1.565
    6    HG3  GLN  78           HG3      GLN  78   1.313  -8.483   2.838
    7   HE21  GLN  78          HE21      GLN  78   3.260  -9.654   3.125
    8   HE22  GLN  78          HE22      GLN  78   4.058 -10.475   1.870

  No H/Q in entry =           8
  In of MODEL   41
    1    H    LEU  79           H        LEU  79  -1.372  -6.696  -0.750
    2    HA   LEU  79           HA       LEU  79   0.309  -4.466  -0.738
    3    HB2  LEU  79           HB2      LEU  79  -0.712  -5.279  -2.792
    4    HB3  LEU  79           HB3      LEU  79  -2.318  -4.889  -2.187
    5    HG   LEU  79           HG       LEU  79  -1.778  -2.501  -2.166
    6   HD13  LEU  79          HD11      LEU  79   0.461  -2.252  -1.649
    7   HD12  LEU  79          HD12      LEU  79   0.512  -1.968  -3.389
    8   HD11  LEU  79          HD13      LEU  79   0.968  -3.544  -2.738
    9   HD23  LEU  79          HD21      LEU  79  -1.140  -2.307  -4.717
   10   HD22  LEU  79          HD22      LEU  79  -2.665  -3.056  -4.259
   11   HD21  LEU  79          HD23      LEU  79  -1.290  -4.064  -4.699

  No H/Q in entry =          11
  In of MODEL   41
    1    H    HIS  80           H        HIS  80  -3.159  -4.633   0.082
    2    HA   HIS  80           HA       HIS  80  -3.356  -1.875   0.740
    3    HB2  HIS  80           HB2      HIS  80  -5.054  -4.286   1.060
    4    HB3  HIS  80           HB3      HIS  80  -5.379  -2.944   2.161
    5    HD1  HIS  80           HD1      HIS  80  -6.997  -1.312   1.247
    6    HD2  HIS  80           HD2      HIS  80  -4.796  -3.127  -1.793
    7    HE1  HIS  80           HE1      HIS  80  -7.835  -0.321  -0.936
    8    HE2  HIS  80           HE2      HIS  80  -6.499  -1.422  -2.798

  No H/Q in entry =           8
  In of MODEL   41
    1    H    LEU  81           H        LEU  81  -2.867  -4.765   2.740
    2    HA   LEU  81           HA       LEU  81  -2.860  -3.413   5.221
    3    HB2  LEU  81           HB2      LEU  81  -1.637  -6.030   4.349
    4    HB3  LEU  81           HB3      LEU  81  -1.615  -5.467   6.022
    5    HG   LEU  81           HG       LEU  81  -4.157  -5.726   4.390
    6   HD12  LEU  81          HD11      LEU  81  -4.460  -7.789   5.941
    7   HD11  LEU  81          HD12      LEU  81  -2.708  -7.716   6.130
    8   HD13  LEU  81          HD13      LEU  81  -3.414  -7.950   4.531
    9   HD23  LEU  81          HD21      LEU  81  -5.005  -5.925   6.890
   10   HD22  LEU  81          HD22      LEU  81  -4.680  -4.337   6.197
   11   HD21  LEU  81          HD23      LEU  81  -3.495  -5.094   7.261

  No H/Q in entry =          11
  In of MODEL   41
    1    H    MET  82           H        MET  82  -0.174  -4.318   3.057
    2    HA   MET  82           HA       MET  82   1.905  -3.418   4.743
    3    HB2  MET  82           HB2      MET  82   1.695  -3.766   1.751
    4    HB3  MET  82           HB3      MET  82   3.176  -3.193   2.516
    5    HG2  MET  82           HG2      MET  82   1.770  -5.782   3.243
    6    HG3  MET  82           HG3      MET  82   3.143  -5.673   2.145
    7    HE3  MET  82           HE1      MET  82   6.154  -4.930   4.133
    8    HE2  MET  82           HE2      MET  82   5.231  -3.565   3.510
    9    HE1  MET  82           HE3      MET  82   5.323  -5.057   2.578

  No H/Q in entry =           9
  In of MODEL   41
    1    H    THR  83           H        THR  83   0.086  -1.783   2.179
    2    HA   THR  83           HA       THR  83   1.496   0.666   2.263
    3    HB   THR  83           HB       THR  83  -0.679   1.588   1.271
    4    HG1  THR  83           HG1      THR  83  -2.328   0.289   1.164
    5   HG22  THR  83          HG21      THR  83  -0.404  -0.234  -0.725
    6   HG21  THR  83          HG22      THR  83   1.095  -0.524   0.155
    7   HG23  THR  83          HG23      THR  83   0.734   1.088  -0.464

  No H/Q in entry =           7
  In of MODEL   41
    1    H    SER  84           H        SER  84  -1.512  -0.364   3.861
    2    HA   SER  84           HA       SER  84  -2.012   2.069   5.199
    3    HB2  SER  84           HB2      SER  84  -2.844  -0.768   5.769
    4    HB3  SER  84           HB3      SER  84  -3.340   0.575   6.798
    5    HG   SER  84           HG       SER  84  -3.794   0.254   4.006

  No H/Q in entry =           5
  In of MODEL   41
    1    H    MET  85           H        MET  85  -0.303  -0.860   6.338
    2    HA   MET  85           HA       MET  85   0.212   0.072   8.941
    3    HB2  MET  85           HB2      MET  85   0.507  -2.273   8.266
    4    HB3  MET  85           HB3      MET  85   1.894  -1.810   7.278
    5    HG2  MET  85           HG2      MET  85   3.045  -0.957   9.293
    6    HG3  MET  85           HG3      MET  85   1.657  -1.420  10.278
    7    HE3  MET  85           HE1      MET  85   1.820  -3.651  11.663
    8    HE2  MET  85           HE2      MET  85   1.662  -5.083  10.649
    9    HE1  MET  85           HE3      MET  85   0.652  -3.674  10.338

  No H/Q in entry =           9
  In of MODEL   41
    1    H    LEU  86           H        LEU  86   2.152   0.322   5.993
    2    HA   LEU  86           HA       LEU  86   4.364   1.635   7.149
    3    HB2  LEU  86           HB2      LEU  86   4.176   0.547   4.843
    4    HB3  LEU  86           HB3      LEU  86   3.369   2.028   4.325
    5    HG   LEU  86           HG       LEU  86   5.396   3.276   5.306
    6   HD11  LEU  86          HD11      LEU  86   6.100   0.667   6.113
    7   HD13  LEU  86          HD12      LEU  86   7.103   2.112   6.209
    8   HD12  LEU  86          HD13      LEU  86   7.214   1.060   4.800
    9   HD23  LEU  86          HD21      LEU  86   6.116   1.508   2.961
   10   HD22  LEU  86          HD22      LEU  86   6.509   3.206   3.219
   11   HD21  LEU  86          HD23      LEU  86   4.857   2.737   2.819

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ALA  87           H        ALA  87   1.454   2.875   5.557
    2    HA   ALA  87           HA       ALA  87   2.048   5.605   5.635
    3    HB1  ALA  87           HB1      ALA  87  -0.260   3.976   5.094
    4    HB3  ALA  87           HB2      ALA  87   0.052   5.636   4.590
    5    HB2  ALA  87           HB3      ALA  87  -0.745   5.318   6.133

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ARG  88           H        ARG  88   0.355   3.609   8.027
    2    HA   ARG  88           HA       ARG  88  -0.160   5.663   9.868
    3    HB2  ARG  88           HB2      ARG  88  -1.099   3.311   9.939
    4    HB3  ARG  88           HB3      ARG  88   0.441   2.813  10.649
    5    HG2  ARG  88           HG2      ARG  88  -0.038   4.891  12.263
    6    HG3  ARG  88           HG3      ARG  88  -1.704   4.565  11.805
    7    HD2  ARG  88           HD2      ARG  88  -1.813   2.719  13.055
    8    HD3  ARG  88           HD3      ARG  88  -0.223   2.136  12.528
    9    HE   ARG  88           HE       ARG  88  -0.761   3.405  14.979
   10   HH21  ARG  88          HH11      ARG  88   0.795   4.420  16.217
   11   HH22  ARG  88          HH12      ARG  88   2.316   4.846  15.514
   12   HH11  ARG  88          HH21      ARG  88   1.524   3.580  12.405
   13   HH12  ARG  88          HH22      ARG  88   2.737   4.354  13.367

  No H/Q in entry =          13
  In of MODEL   41
    1    H    GLU  89           H        GLU  89   2.637   3.444   9.655
    2    HA   GLU  89           HA       GLU  89   3.895   4.339  11.999
    3    HB2  GLU  89           HB2      GLU  89   4.556   2.318  10.661
    4    HB3  GLU  89           HB3      GLU  89   5.333   3.409   9.513
    5    HG2  GLU  89           HG2      GLU  89   6.815   4.261  11.257
    6    HG3  GLU  89           HG3      GLU  89   5.979   3.307  12.478

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LEU  90           H        LEU  90   4.217   5.489   8.669
    2    HA   LEU  90           HA       LEU  90   6.145   7.492   9.252
    3    HB2  LEU  90           HB2      LEU  90   4.143   7.153   7.022
    4    HB3  LEU  90           HB3      LEU  90   5.373   8.425   7.042
    5    HG   LEU  90           HG       LEU  90   6.048   5.489   7.385
    6   HD12  LEU  90          HD11      LEU  90   6.800   5.717   4.946
    7   HD11  LEU  90          HD12      LEU  90   5.784   7.157   4.892
    8   HD13  LEU  90          HD13      LEU  90   5.064   5.584   5.238
    9   HD22  LEU  90          HD21      LEU  90   7.943   6.642   8.067
   10   HD21  LEU  90          HD22      LEU  90   7.594   8.044   7.056
   11   HD23  LEU  90          HD23      LEU  90   8.256   6.578   6.334

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  91           H        ILE  91   2.606   7.504   9.097
    2    HA   ILE  91           HA       ILE  91   2.261  10.277   9.540
    3    HB   ILE  91           HB       ILE  91   0.471   7.901  10.086
    4   HG12  ILE  91          HG12      ILE  91   0.224  10.177   8.094
    5   HG13  ILE  91          HG13      ILE  91   1.086   8.683   7.728
    6   HG22  ILE  91          HG21      ILE  91  -1.264   9.958  10.141
    7   HG21  ILE  91          HG22      ILE  91   0.136  10.792  10.814
    8   HG23  ILE  91          HG23      ILE  91  -0.501   9.356  11.613
    9   HD13  ILE  91          HD11      ILE  91  -0.857   7.393   7.772
   10   HD12  ILE  91          HD12      ILE  91  -1.447   8.906   7.085
   11   HD11  ILE  91          HD13      ILE  91  -1.720   8.546   8.790

  No H/Q in entry =          11
  In of MODEL   41
    1    H    THR  92           H        THR  92   2.663   7.542  11.749
    2    HA   THR  92           HA       THR  92   2.214   8.922  14.169
    3    HB   THR  92           HB       THR  92   4.027   6.588  13.513
    4    HG1  THR  92           HG1      THR  92   2.059   5.828  13.411
    5   HG22  THR  92          HG21      THR  92   3.639   6.310  16.147
    6   HG21  THR  92          HG22      THR  92   3.572   8.069  16.069
    7   HG23  THR  92          HG23      THR  92   5.007   7.214  15.501

  No H/Q in entry =           7
  In of MODEL   41
    1    H    GLU  93           H        GLU  93   5.169   8.472  12.242
    2    HA   GLU  93           HA       GLU  93   6.917   9.907  13.938
    3    HB2  GLU  93           HB2      GLU  93   7.012   9.584  10.924
    4    HB3  GLU  93           HB3      GLU  93   8.349  10.120  11.939
    5    HG2  GLU  93           HG2      GLU  93   6.944   7.482  12.392
    6    HG3  GLU  93           HG3      GLU  93   8.329   7.633  11.318

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LEU  94           H        LEU  94   4.872  10.910  11.218
    2    HA   LEU  94           HA       LEU  94   5.671  13.616  11.112
    3    HB2  LEU  94           HB2      LEU  94   3.085  12.243  10.357
    4    HB3  LEU  94           HB3      LEU  94   3.340  13.970  10.111
    5    HG   LEU  94           HG       LEU  94   5.364  11.984   9.070
    6   HD11  LEU  94          HD11      LEU  94   2.623  12.525   8.001
    7   HD13  LEU  94          HD12      LEU  94   3.610  11.070   7.882
    8   HD12  LEU  94          HD13      LEU  94   3.944  12.448   6.834
    9   HD23  LEU  94          HD21      LEU  94   5.614  13.815   7.343
   10   HD22  LEU  94          HD22      LEU  94   6.024  14.314   8.984
   11   HD21  LEU  94          HD23      LEU  94   4.473  14.776   8.281

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  95           H        ILE  95   3.134  11.998  13.003
    2    HA   ILE  95           HA       ILE  95   2.082  14.349  14.189
    3    HB   ILE  95           HB       ILE  95   2.105  11.470  15.122
    4   HG12  ILE  95          HG12      ILE  95  -0.118  13.234  14.063
    5   HG13  ILE  95          HG13      ILE  95   0.843  12.175  13.036
    6   HG21  ILE  95          HG21      ILE  95   0.814  13.942  16.313
    7   HG23  ILE  95          HG22      ILE  95   1.863  12.779  17.123
    8   HG22  ILE  95          HG23      ILE  95   0.230  12.312  16.646
    9   HD13  ILE  95          HD11      ILE  95  -0.056  10.236  13.959
   10   HD12  ILE  95          HD12      ILE  95  -1.442  11.322  14.029
   11   HD11  ILE  95          HD13      ILE  95  -0.479  11.031  15.477

  No H/Q in entry =          11
  In of MODEL   41
    1    H    GLU  96           H        GLU  96   4.682  12.140  15.196
    2    HA   GLU  96           HA       GLU  96   5.228  13.348  17.686
    3    HB2  GLU  96           HB2      GLU  96   6.184  11.190  17.047
    4    HB3  GLU  96           HB3      GLU  96   7.117  11.963  15.766
    5    HG2  GLU  96           HG2      GLU  96   8.761  12.520  17.231
    6    HG3  GLU  96           HG3      GLU  96   7.609  13.333  18.281

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LEU  97           H        LEU  97   6.307  14.114  14.400
    2    HA   LEU  97           HA       LEU  97   8.185  16.118  15.110
    3    HB2  LEU  97           HB2      LEU  97   6.601  15.556  12.613
    4    HB3  LEU  97           HB3      LEU  97   7.615  16.992  12.732
    5    HG   LEU  97           HG       LEU  97   8.652  14.199  13.303
    6   HD12  LEU  97          HD11      LEU  97   9.653  14.390  10.987
    7   HD11  LEU  97          HD12      LEU  97   8.598  15.776  10.717
    8   HD13  LEU  97          HD13      LEU  97   7.903  14.182  11.015
    9   HD23  LEU  97          HD21      LEU  97  10.819  15.484  12.561
   10   HD22  LEU  97          HD22      LEU  97  10.195  15.756  14.188
   11   HD21  LEU  97          HD23      LEU  97   9.879  16.934  12.915

  No H/Q in entry =          11
  In of MODEL   41
    1    H    HIS  98           H        HIS  98   4.694  16.239  14.447
    2    HA   HIS  98           HA       HIS  98   4.384  19.038  14.573
    3    HB2  HIS  98           HB2      HIS  98   2.501  16.783  15.302
    4    HB3  HIS  98           HB3      HIS  98   2.028  18.482  15.351
    5    HD1  HIS  98           HD1      HIS  98   3.065  15.763  12.957
    6    HD2  HIS  98           HD2      HIS  98   1.674  19.691  12.820
    7    HE1  HIS  98           HE1      HIS  98   2.509  16.242  10.530
    8    HE2  HIS  98           HE2      HIS  98   1.666  18.628  10.426

  No H/Q in entry =           8
  In of MODEL   41
    1    H    GLU  99           H        GLU  99   4.521  16.558  17.080
    2    HA   GLU  99           HA       GLU  99   3.902  18.256  19.271
    3    HB2  GLU  99           HB2      GLU  99   3.822  15.774  19.376
    4    HB3  GLU  99           HB3      GLU  99   5.583  15.736  19.272
    5    HG2  GLU  99           HG2      GLU  99   5.762  17.035  21.342
    6    HG3  GLU  99           HG3      GLU  99   4.008  17.169  21.434

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LYS 100           H        LYS 100   6.963  17.333  17.716
    2    HA   LYS 100           HA       LYS 100   8.608  18.745  19.572
    3    HB2  LYS 100           HB2      LYS 100   9.117  17.814  16.738
    4    HB3  LYS 100           HB3      LYS 100  10.341  18.591  17.746
    5    HG2  LYS 100           HG2      LYS 100   9.968  16.845  19.491
    6    HG3  LYS 100           HG3      LYS 100   8.842  16.033  18.400
    7    HD2  LYS 100           HD2      LYS 100  10.640  15.752  16.738
    8    HD3  LYS 100           HD3      LYS 100  11.772  16.576  17.814
    9    HE2  LYS 100           HE2      LYS 100  11.378  14.824  19.537
   10    HE3  LYS 100           HE3      LYS 100  10.309  13.981  18.411
   11    HZ1  LYS 100           HZ1      LYS 100  13.128  14.659  17.760
   12    HZ3  LYS 100           HZ2      LYS 100  12.090  13.598  16.933
   13    HZ2  LYS 100           HZ3      LYS 100  12.677  13.185  18.474

  No H/Q in entry =          13
  In of MODEL   41
    1    H    LEU 101           H        LEU 101   6.918  19.657  16.610
    2    HA   LEU 101           HA       LEU 101   8.123  22.217  16.271
    3    HB2  LEU 101           HB2      LEU 101   5.534  20.971  15.382
    4    HB3  LEU 101           HB3      LEU 101   5.779  22.703  15.170
    5    HG   LEU 101           HG       LEU 101   7.825  20.691  14.214
    6   HD12  LEU 101          HD11      LEU 101   6.675  21.186  11.925
    7   HD11  LEU 101          HD12      LEU 101   5.271  21.614  12.902
    8   HD13  LEU 101          HD13      LEU 101   5.942  19.986  12.990
    9   HD21  LEU 101          HD21      LEU 101   7.187  23.600  13.649
   10   HD23  LEU 101          HD22      LEU 101   8.174  22.640  12.547
   11   HD22  LEU 101          HD23      LEU 101   8.711  22.904  14.206

  No H/Q in entry =          11
  In of MODEL   41
    1    H    LYS 102           H        LYS 102   6.584  21.081  18.886
    2    HA   LYS 102           HA       LYS 102   5.944  22.176  20.814
    3    HB2  LYS 102           HB2      LYS 102   7.222  24.168  19.687
    4    HB3  LYS 102           HB3      LYS 102   5.621  24.766  19.306
    5    HG2  LYS 102           HG2      LYS 102   6.994  24.522  21.961
    6    HG3  LYS 102           HG3      LYS 102   6.038  25.846  21.327
    7    HD2  LYS 102           HD2      LYS 102   4.801  23.208  22.210
    8    HD3  LYS 102           HD3      LYS 102   5.043  24.573  23.290
    9    HE2  LYS 102           HE2      LYS 102   2.768  24.158  21.798
   10    HE3  LYS 102           HE3      LYS 102   3.264  25.707  22.476
   11    HZ2  LYS 102           HZ1      LYS 102   2.738  25.806  20.095
   12    HZ1  LYS 102           HZ2      LYS 102   4.004  24.728  19.778
   13    HZ3  LYS 102           HZ3      LYS 102   4.341  26.261  20.417

  No H/Q in entry =          13
  In of MODEL   41
    1    H    ALA 103           H        ALA 103   4.306  23.706  18.039
    2    HA   ALA 103           HA       ALA 103   1.848  24.276  18.917
    3    HB1  ALA 103           HB1      ALA 103   0.958  23.425  16.675
    4    HB2  ALA 103           HB2      ALA 103   2.607  22.893  16.350
    5    HB3  ALA 103           HB3      ALA 103   2.266  24.604  16.611

  No H/Q in entry =           5
  In of MODEL   41
    1    H1   ALA   1           H3       ALA   1  10.650 -20.265  -6.214
    2    H2   ALA   1           H2       ALA   1   9.689 -20.478  -7.602
    3    H3   ALA   1           H1       ALA   1   9.251 -21.222  -6.137
    4    HA   ALA   1           HA       ALA   1  10.297 -23.030  -6.870
    5    HB1  ALA   1           HB1      ALA   1  10.396 -22.676  -9.146
    6    HB2  ALA   1           HB2      ALA   1  12.123 -22.520  -8.814
    7    HB3  ALA   1           HB3      ALA   1  11.121 -21.076  -8.971

  No H/Q in entry =           7
  In of MODEL   41
    1    H    GLU   2           H        GLU   2  12.584 -23.974  -6.921
    2    HA   GLU   2           HA       GLU   2  13.961 -23.883  -4.706
    3    HB2  GLU   2           HB2      GLU   2  15.322 -23.755  -7.403
    4    HB3  GLU   2           HB3      GLU   2  16.049 -24.360  -5.915
    5    HG2  GLU   2           HG2      GLU   2  15.038 -26.380  -6.152
    6    HG3  GLU   2           HG3      GLU   2  13.465 -25.639  -6.416

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLU   3           H        GLU   3  15.732 -22.020  -7.110
    2    HA   GLU   3           HA       GLU   3  16.877 -20.325  -5.152
    3    HB2  GLU   3           HB2      GLU   3  16.827 -20.331  -8.163
    4    HB3  GLU   3           HB3      GLU   3  17.567 -18.997  -7.278
    5    HG2  GLU   3           HG2      GLU   3  19.232 -20.365  -6.348
    6    HG3  GLU   3           HG3      GLU   3  18.289 -21.835  -6.567

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LEU   4           H        LEU   4  14.598 -19.490  -7.790
    2    HA   LEU   4           HA       LEU   4  14.124 -16.880  -7.186
    3    HB2  LEU   4           HB2      LEU   4  11.955 -18.862  -7.915
    4    HB3  LEU   4           HB3      LEU   4  11.876 -17.114  -8.118
    5    HG   LEU   4           HG       LEU   4  13.847 -18.976  -9.483
    6   HD13  LEU   4          HD11      LEU   4  12.548 -18.836 -11.396
    7   HD12  LEU   4          HD12      LEU   4  11.836 -17.291 -10.934
    8   HD11  LEU   4          HD13      LEU   4  11.285 -18.781 -10.169
    9   HD23  LEU   4          HD21      LEU   4  14.181 -16.734 -10.840
   10   HD22  LEU   4          HD22      LEU   4  15.038 -16.970  -9.318
   11   HD21  LEU   4          HD23      LEU   4  13.583 -15.977  -9.363

  No H/Q in entry =          11
  In of MODEL   41
    1    H    GLU   5           H        GLU   5  12.643 -19.663  -5.539
    2    HA   GLU   5           HA       GLU   5  10.958 -18.091  -3.843
    3    HB2  GLU   5           HB2      GLU   5  10.536 -20.470  -4.357
    4    HB3  GLU   5           HB3      GLU   5  11.973 -20.904  -3.429
    5    HG2  GLU   5           HG2      GLU   5  11.011 -19.891  -1.417
    6    HG3  GLU   5           HG3      GLU   5   9.592 -19.385  -2.334

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLU   6           H        GLU   6  14.108 -19.662  -3.391
    2    HA   GLU   6           HA       GLU   6  14.454 -18.798  -0.694
    3    HB2  GLU   6           HB2      GLU   6  16.422 -19.730  -2.795
    4    HB3  GLU   6           HB3      GLU   6  16.863 -19.391  -1.120
    5    HG2  GLU   6           HG2      GLU   6  14.726 -21.370  -1.956
    6    HG3  GLU   6           HG3      GLU   6  16.380 -21.811  -1.532

  No H/Q in entry =           6
  In of MODEL   41
    1    H    VAL   7           H        VAL   7  15.221 -17.477  -3.846
    2    HA   VAL   7           HA       VAL   7  16.900 -15.344  -2.985
    3    HB   VAL   7           HB       VAL   7  15.199 -15.719  -5.464
    4   HG11  VAL   7          HG11      VAL   7  17.085 -13.498  -4.654
    5   HG13  VAL   7          HG12      VAL   7  15.443 -13.362  -5.281
    6   HG12  VAL   7          HG13      VAL   7  16.756 -13.864  -6.347
    7   HG21  VAL   7          HG21      VAL   7  17.309 -17.168  -4.887
    8   HG23  VAL   7          HG22      VAL   7  18.211 -15.705  -5.288
    9   HG22  VAL   7          HG23      VAL   7  17.179 -16.461  -6.499

  No H/Q in entry =           9
  In of MODEL   41
    1    H    VAL   8           H        VAL   8  13.409 -15.625  -3.547
    2    HA   VAL   8           HA       VAL   8  12.734 -12.918  -3.083
    3    HB   VAL   8           HB       VAL   8  11.129 -15.449  -2.643
    4   HG11  VAL   8          HG11      VAL   8  10.422 -12.526  -2.411
    5   HG13  VAL   8          HG12      VAL   8  10.027 -13.847  -1.311
    6   HG12  VAL   8          HG13      VAL   8   9.198 -13.714  -2.861
    7   HG21  VAL   8          HG21      VAL   8  12.014 -14.383  -5.024
    8   HG23  VAL   8          HG22      VAL   8  10.476 -13.547  -4.829
    9   HG22  VAL   8          HG23      VAL   8  10.521 -15.306  -4.863

  No H/Q in entry =           9
  In of MODEL   41
    1    H    MET   9           H        MET   9  13.006 -15.717  -0.896
    2    HA   MET   9           HA       MET   9  12.183 -14.441   1.470
    3    HB2  MET   9           HB2      MET   9  14.109 -16.705   0.947
    4    HB3  MET   9           HB3      MET   9  13.779 -16.128   2.581
    5    HG2  MET   9           HG2      MET   9  11.495 -16.731   2.458
    6    HG3  MET   9           HG3      MET   9  11.539 -16.866   0.700
    7    HE1  MET   9           HE1      MET   9  13.512 -17.976   3.769
    8    HE3  MET   9           HE2      MET   9  14.705 -18.200   2.493
    9    HE2  MET   9           HE3      MET   9  14.086 -19.599   3.366

  No H/Q in entry =           9
  In of MODEL   41
    1    H    GLY  10           H        GLY  10  15.367 -14.659  -0.080
    2    HA3  GLY  10           HA2      GLY  10  16.817 -13.228   1.888
    3    HA2  GLY  10           HA3      GLY  10  17.284 -13.396   0.196

  No H/Q in entry =           3
  In of MODEL   41
    1    H    LEU  11           H        LEU  11  15.114 -12.186  -1.050
    2    HA   LEU  11           HA       LEU  11  15.788  -9.438  -0.893
    3    HB2  LEU  11           HB2      LEU  11  13.428 -10.860  -2.129
    4    HB3  LEU  11           HB3      LEU  11  13.702  -9.125  -2.293
    5    HG   LEU  11           HG       LEU  11  15.739 -11.228  -3.071
    6   HD13  LEU  11          HD11      LEU  11  13.997 -11.606  -4.593
    7   HD12  LEU  11          HD12      LEU  11  14.997 -10.423  -5.435
    8   HD11  LEU  11          HD13      LEU  11  13.520  -9.908  -4.621
    9   HD22  LEU  11          HD21      LEU  11  16.962  -9.259  -2.849
   10   HD21  LEU  11          HD22      LEU  11  15.584  -8.229  -3.233
   11   HD23  LEU  11          HD23      LEU  11  16.421  -9.097  -4.518

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  12           H        ILE  12  13.024 -11.272   0.374
    2    HA   ILE  12           HA       ILE  12  11.619  -9.051   1.425
    3    HB   ILE  12           HB       ILE  12  11.667 -11.931   2.380
    4   HG12  ILE  12          HG12      ILE  12  10.979 -11.309  -0.069
    5   HG13  ILE  12          HG13      ILE  12   9.954 -12.396   0.846
    6   HG21  ILE  12          HG21      ILE  12   9.733  -9.660   2.941
    7   HG23  ILE  12          HG22      ILE  12  10.709 -10.540   4.117
    8   HG22  ILE  12          HG23      ILE  12   9.383 -11.354   3.287
    9   HD13  ILE  12          HD11      ILE  12   8.436 -10.565   1.355
   10   HD12  ILE  12          HD12      ILE  12   8.700 -10.623  -0.386
   11   HD11  ILE  12          HD13      ILE  12   9.517  -9.418   0.585

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  13           H        ILE  13  14.020 -11.241   2.841
    2    HA   ILE  13           HA       ILE  13  14.045 -10.055   5.418
    3    HB   ILE  13           HB       ILE  13  16.114 -11.623   3.859
    4   HG12  ILE  13          HG12      ILE  13  13.840 -12.594   4.709
    5   HG13  ILE  13          HG13      ILE  13  15.319 -13.511   4.975
    6   HG22  ILE  13          HG21      ILE  13  17.155 -11.963   6.191
    7   HG21  ILE  13          HG22      ILE  13  16.236 -10.548   6.689
    8   HG23  ILE  13          HG23      ILE  13  17.445 -10.409   5.412
    9   HD11  ILE  13          HD11      ILE  13  14.144 -11.620   7.044
   10   HD13  ILE  13          HD12      ILE  13  15.454 -12.774   7.265
   11   HD12  ILE  13          HD13      ILE  13  13.814 -13.350   6.999

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ASN  14           H        ASN  14  16.001  -9.521   2.502
    2    HA   ASN  14           HA       ASN  14  17.732  -7.567   3.562
    3    HB2  ASN  14           HB2      ASN  14  17.722  -8.840   1.250
    4    HB3  ASN  14           HB3      ASN  14  16.822  -7.429   0.707
    5   HD21  ASN  14          HD21      ASN  14  19.266  -7.758  -0.473
    6   HD22  ASN  14          HD22      ASN  14  20.402  -6.666   0.154

  No H/Q in entry =           6
  In of MODEL   41
    1    H    SER  15           H        SER  15  14.623  -7.243   1.862
    2    HA   SER  15           HA       SER  15  14.493  -4.423   1.911
    3    HB2  SER  15           HB2      SER  15  12.163  -4.685   1.411
    4    HB3  SER  15           HB3      SER  15  12.970  -6.049   0.646
    5    HG   SER  15           HG       SER  15  11.862  -7.315   1.881

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLY  16           H        GLY  16  13.411  -6.884   4.219
    2    HA3  GLY  16           HA2      GLY  16  12.174  -5.138   6.069
    3    HA2  GLY  16           HA3      GLY  16  12.799  -6.741   6.437

  No H/Q in entry =           3
  In of MODEL   41
    1    H    GLN  17           H        GLN  17  15.509  -6.392   5.849
    2    HA   GLN  17           HA       GLN  17  16.452  -5.158   8.228
    3    HB2  GLN  17           HB2      GLN  17  17.717  -6.934   7.090
    4    HB3  GLN  17           HB3      GLN  17  17.969  -5.877   5.701
    5    HG2  GLN  17           HG2      GLN  17  19.215  -4.295   7.096
    6    HG3  GLN  17           HG3      GLN  17  18.920  -5.293   8.520
    7   HE21  GLN  17          HE21      GLN  17  21.587  -4.714   7.646
    8   HE22  GLN  17          HE22      GLN  17  22.290  -6.155   7.095

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ALA  18           H        ALA  18  16.264  -4.091   4.865
    2    HA   ALA  18           HA       ALA  18  17.683  -1.687   5.089
    3    HB1  ALA  18           HB1      ALA  18  16.577  -2.916   3.022
    4    HB3  ALA  18           HB2      ALA  18  16.830  -1.171   3.002
    5    HB2  ALA  18           HB3      ALA  18  15.234  -1.826   3.370

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ARG  19           H        ARG  19  14.186  -2.299   5.479
    2    HA   ARG  19           HA       ARG  19  13.498   0.348   6.185
    3    HB2  ARG  19           HB2      ARG  19  11.830  -1.416   5.600
    4    HB3  ARG  19           HB3      ARG  19  12.174  -2.208   7.140
    5    HG2  ARG  19           HG2      ARG  19  11.447  -0.218   8.372
    6    HG3  ARG  19           HG3      ARG  19  11.194   0.652   6.860
    7    HD2  ARG  19           HD2      ARG  19   9.056  -0.157   7.678
    8    HD3  ARG  19           HD3      ARG  19   9.485  -1.038   6.205
    9    HE   ARG  19           HE       ARG  19  10.450  -2.567   8.317
   10   HH21  ARG  19          HH11      ARG  19   9.210  -4.214   9.257
   11   HH22  ARG  19          HH12      ARG  19   7.490  -4.199   9.082
   12   HH11  ARG  19          HH21      ARG  19   7.449  -1.299   7.211
   13   HH12  ARG  19          HH22      ARG  19   6.493  -2.549   7.920

  No H/Q in entry =          13
  In of MODEL   41
    1    H    SER  20           H        SER  20  14.371  -2.470   8.154
    2    HA   SER  20           HA       SER  20  14.074  -1.366  10.688
    3    HB2  SER  20           HB2      SER  20  14.696  -3.774  10.071
    4    HB3  SER  20           HB3      SER  20  16.357  -3.199   9.952
    5    HG   SER  20           HG       SER  20  15.353  -2.244  12.195

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU  21           H        LEU  21  16.922  -1.290   8.558
    2    HA   LEU  21           HA       LEU  21  18.581   0.213  10.296
    3    HB2  LEU  21           HB2      LEU  21  18.569  -0.068   7.283
    4    HB3  LEU  21           HB3      LEU  21  19.815   0.804   8.173
    5    HG   LEU  21           HG       LEU  21  19.096  -2.094   8.708
    6   HD11  LEU  21          HD11      LEU  21  21.113  -0.834   6.855
    7   HD13  LEU  21          HD12      LEU  21  19.982  -2.145   6.525
    8   HD12  LEU  21          HD13      LEU  21  21.391  -2.435   7.544
    9   HD21  LEU  21          HD21      LEU  21  21.157  -0.168   9.750
   10   HD23  LEU  21          HD22      LEU  21  21.599  -1.866   9.625
   11   HD22  LEU  21          HD23      LEU  21  20.243  -1.387  10.632

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ALA  22           H        ALA  22  16.317   1.159   7.732
    2    HA   ALA  22           HA       ALA  22  16.836   3.921   7.740
    3    HB3  ALA  22           HB1      ALA  22  15.446   2.664   6.062
    4    HB2  ALA  22           HB2      ALA  22  14.728   4.173   6.623
    5    HB1  ALA  22           HB3      ALA  22  14.147   2.632   7.253

  No H/Q in entry =           5
  In of MODEL   41
    1    H    TYR  23           H        TYR  23  14.348   2.092   9.574
    2    HA   TYR  23           HA       TYR  23  13.366   4.327  11.015
    3    HB2  TYR  23           HB2      TYR  23  12.145   2.203  10.996
    4    HB3  TYR  23           HB3      TYR  23  13.481   1.406  11.828
    5    HD1  TYR  23           HD1      TYR  23  10.963   4.140  12.175
    6    HD2  TYR  23           HD2      TYR  23  13.660   1.469  14.184
    7    HE1  TYR  23           HE1      TYR  23  10.023   4.835  14.364
    8    HE2  TYR  23           HE2      TYR  23  12.720   2.161  16.370
    9    HH   TYR  23           HH       TYR  23  11.082   4.825  16.903

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ALA  24           H        ALA  24  16.025   2.071  11.665
    2    HA   ALA  24           HA       ALA  24  16.682   3.077  14.227
    3    HB1  ALA  24           HB1      ALA  24  18.051   1.293  14.070
    4    HB3  ALA  24           HB2      ALA  24  19.075   2.218  12.971
    5    HB2  ALA  24           HB3      ALA  24  17.789   1.200  12.330

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA  25           H        ALA  25  17.641   4.004  10.948
    2    HA   ALA  25           HA       ALA  25  19.572   5.953  11.593
    3    HB1  ALA  25           HB1      ALA  25  18.868   4.994   9.279
    4    HB3  ALA  25           HB2      ALA  25  19.358   6.685   9.368
    5    HB2  ALA  25           HB3      ALA  25  17.646   6.266   9.296

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU  26           H        LEU  26  16.057   6.158  11.223
    2    HA   LEU  26           HA       LEU  26  15.814   8.940  11.666
    3    HB2  LEU  26           HB2      LEU  26  13.963   7.690  10.736
    4    HB3  LEU  26           HB3      LEU  26  13.875   6.666  12.164
    5    HG   LEU  26           HG       LEU  26  13.253   8.623  13.538
    6   HD12  LEU  26          HD11      LEU  26  12.583  10.716  12.205
    7   HD11  LEU  26          HD12      LEU  26  13.571  10.066  10.900
    8   HD13  LEU  26          HD13      LEU  26  14.309  10.460  12.453
    9   HD21  LEU  26          HD21      LEU  26  11.586   8.293  11.025
   10   HD23  LEU  26          HD22      LEU  26  11.017   8.992  12.538
   11   HD22  LEU  26          HD23      LEU  26  11.480   7.293  12.474

  No H/Q in entry =          11
  In of MODEL   41
    1    H    LYS  27           H        LYS  27  15.717   6.165  13.866
    2    HA   LYS  27           HA       LYS  27  15.110   7.534  16.229
    3    HB2  LYS  27           HB2      LYS  27  15.154   5.058  15.971
    4    HB3  LYS  27           HB3      LYS  27  16.917   5.121  15.931
    5    HG2  LYS  27           HG2      LYS  27  16.955   6.113  18.179
    6    HG3  LYS  27           HG3      LYS  27  15.188   6.121  18.220
    7    HD2  LYS  27           HD2      LYS  27  15.178   3.653  17.989
    8    HD3  LYS  27           HD3      LYS  27  16.943   3.653  17.982
    9    HE2  LYS  27           HE2      LYS  27  16.965   4.648  20.236
   10    HE3  LYS  27           HE3      LYS  27  15.199   4.678  20.246
   11    HZ3  LYS  27           HZ1      LYS  27  15.995   2.733  21.404
   12    HZ2  LYS  27           HZ2      LYS  27  16.917   2.256  20.057
   13    HZ1  LYS  27           HZ3      LYS  27  15.219   2.251  19.973

  No H/Q in entry =          13
  In of MODEL   41
    1    H    GLN  28           H        GLN  28  18.234   6.964  14.646
    2    HA   GLN  28           HA       GLN  28  19.907   8.062  16.638
    3    HB2  GLN  28           HB2      GLN  28  20.203   8.011  13.624
    4    HB3  GLN  28           HB3      GLN  28  21.485   8.491  14.736
    5    HG2  GLN  28           HG2      GLN  28  20.078   5.806  14.776
    6    HG3  GLN  28           HG3      GLN  28  21.664   6.100  14.065
    7   HE21  GLN  28          HE21      GLN  28  20.426   4.736  16.734
    8   HE22  GLN  28          HE22      GLN  28  21.586   5.185  17.887

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ALA  29           H        ALA  29  18.155   9.529  13.938
    2    HA   ALA  29           HA       ALA  29  19.141  12.155  14.186
    3    HB2  ALA  29           HB1      ALA  29  17.443  12.780  12.709
    4    HB1  ALA  29           HB2      ALA  29  16.303  11.603  13.360
    5    HB3  ALA  29           HB3      ALA  29  17.638  11.064  12.342

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LYS  30           H        LYS  30  16.368  10.547  15.705
    2    HA   LYS  30           HA       LYS  30  15.340  12.799  17.053
    3    HB2  LYS  30           HB2      LYS  30  15.239   9.860  17.764
    4    HB3  LYS  30           HB3      LYS  30  14.366  11.108  18.653
    5    HG2  LYS  30           HG2      LYS  30  13.244  11.784  16.530
    6    HG3  LYS  30           HG3      LYS  30  14.056  10.449  15.708
    7    HD2  LYS  30           HD2      LYS  30  12.987   8.842  17.238
    8    HD3  LYS  30           HD3      LYS  30  12.185  10.166  18.084
    9    HE2  LYS  30           HE2      LYS  30  11.019  10.788  15.987
   10    HE3  LYS  30           HE3      LYS  30  11.801   9.435  15.161
   11    HZ2  LYS  30           HZ1      LYS  30   9.493   9.019  16.037
   12    HZ1  LYS  30           HZ2      LYS  30  10.156   9.078  17.605
   13    HZ3  LYS  30           HZ3      LYS  30  10.672   7.893  16.499

  No H/Q in entry =          13
  In of MODEL   41
    1    H    GLN  31           H        GLN  31  18.008  10.642  17.802
    2    HA   GLN  31           HA       GLN  31  18.325  11.665  20.495
    3    HB2  GLN  31           HB2      GLN  31  20.358  10.098  18.899
    4    HB3  GLN  31           HB3      GLN  31  20.219  10.226  20.653
    5    HG2  GLN  31           HG2      GLN  31  17.711   9.262  19.880
    6    HG3  GLN  31           HG3      GLN  31  18.819   8.419  18.805
    7   HE21  GLN  31          HE21      GLN  31  17.275   7.273  21.080
    8   HE22  GLN  31          HE22      GLN  31  18.431   6.619  22.135

  No H/Q in entry =           8
  In of MODEL   41
    1    H    GLY  32           H        GLY  32  18.846  12.977  17.526
    2    HA3  GLY  32           HA2      GLY  32  19.824  15.024  17.010
    3    HA2  GLY  32           HA3      GLY  32  20.577  15.036  18.599

  No H/Q in entry =           3
  In of MODEL   41
    1    H    ASP  33           H        ASP  33  21.015  12.141  16.830
    2    HA   ASP  33           HA       ASP  33  23.839  12.826  16.369
    3    HB2  ASP  33           HB2      ASP  33  22.340  10.205  16.489
    4    HB3  ASP  33           HB3      ASP  33  24.027  10.326  15.997

  No H/Q in entry =           4
  In of MODEL   41
    1    H    PHE  34           H        PHE  34  23.357  14.143  14.484
    2    HA   PHE  34           HA       PHE  34  22.017  13.148  12.196
    3    HB2  PHE  34           HB2      PHE  34  24.139  15.291  12.425
    4    HB3  PHE  34           HB3      PHE  34  23.158  14.993  10.992
    5    HD1  PHE  34           HD1      PHE  34  23.394  16.935  13.901
    6    HD2  PHE  34           HD2      PHE  34  20.531  14.802  11.514
    7    HE1  PHE  34           HE1      PHE  34  21.570  18.328  14.841
    8    HE2  PHE  34           HE2      PHE  34  18.711  16.195  12.456
    9    HZ   PHE  34           HZ       PHE  34  19.234  17.958  14.115

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ALA  35           H        ALA  35  25.390  12.977  13.212
    2    HA   ALA  35           HA       ALA  35  26.505  12.154  10.760
    3    HB3  ALA  35           HB1      ALA  35  28.186  10.996  12.486
    4    HB2  ALA  35           HB2      ALA  35  27.315  12.021  13.627
    5    HB1  ALA  35           HB3      ALA  35  28.152  12.744  12.255

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA  36           H        ALA  36  25.391  10.200  13.527
    2    HA   ALA  36           HA       ALA  36  25.889   7.712  12.259
    3    HB2  ALA  36           HB1      ALA  36  25.457   6.968  14.335
    4    HB3  ALA  36           HB2      ALA  36  23.767   7.455  14.180
    5    HB1  ALA  36           HB3      ALA  36  24.961   8.594  14.803

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA  37           H        ALA  37  23.057   9.825  12.381
    2    HA   ALA  37           HA       ALA  37  21.213   8.043  11.205
    3    HB3  ALA  37           HB1      ALA  37  21.423  11.008  11.490
    4    HB1  ALA  37           HB2      ALA  37  20.115   9.924  11.962
    5    HB2  ALA  37           HB3      ALA  37  20.306  10.393  10.272

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LYS  38           H        LYS  38  23.303  10.511   9.725
    2    HA   LYS  38           HA       LYS  38  22.672  10.074   7.047
    3    HB2  LYS  38           HB2      LYS  38  24.471  11.644   8.493
    4    HB3  LYS  38           HB3      LYS  38  25.511  10.657   7.472
    5    HG2  LYS  38           HG2      LYS  38  24.347  11.417   5.471
    6    HG3  LYS  38           HG3      LYS  38  23.146  12.268   6.447
    7    HD2  LYS  38           HD2      LYS  38  24.731  13.876   7.199
    8    HD3  LYS  38           HD3      LYS  38  26.097  12.896   6.669
    9    HE2  LYS  38           HE2      LYS  38  25.734  14.762   5.112
   10    HE3  LYS  38           HE3      LYS  38  25.410  13.220   4.311
   11    HZ3  LYS  38           HZ1      LYS  38  23.211  13.653   4.175
   12    HZ2  LYS  38           HZ2      LYS  38  23.724  15.271   4.259
   13    HZ1  LYS  38           HZ3      LYS  38  23.151  14.487   5.652

  No H/Q in entry =          13
  In of MODEL   41
    1    H    ALA  39           H        ALA  39  25.190   8.495   9.013
    2    HA   ALA  39           HA       ALA  39  26.273   6.907   6.950
    3    HB2  ALA  39           HB1      ALA  39  26.183   5.950   9.796
    4    HB1  ALA  39           HB2      ALA  39  27.129   7.380   9.378
    5    HB3  ALA  39           HB3      ALA  39  27.491   5.830   8.620

  No H/Q in entry =           5
  In of MODEL   41
    1    H    MET  40           H        MET  40  23.658   6.282   9.244
    2    HA   MET  40           HA       MET  40  23.233   3.573   8.515
    3    HB2  MET  40           HB2      MET  40  21.401   5.609   9.798
    4    HB3  MET  40           HB3      MET  40  21.005   3.897   9.626
    5    HG2  MET  40           HG2      MET  40  23.546   4.856  10.971
    6    HG3  MET  40           HG3      MET  40  22.051   4.574  11.861
    7    HE3  MET  40           HE1      MET  40  21.508   0.938  12.045
    8    HE2  MET  40           HE2      MET  40  20.634   2.233  11.232
    9    HE1  MET  40           HE3      MET  40  21.369   2.529  12.806

  No H/Q in entry =           9
  In of MODEL   41
    1    H    MET  41           H        MET  41  21.804   6.614   7.317
    2    HA   MET  41           HA       MET  41  19.858   5.404   5.643
    3    HB2  MET  41           HB2      MET  41  21.324   8.001   5.127
    4    HB3  MET  41           HB3      MET  41  19.801   7.497   4.406
    5    HG2  MET  41           HG2      MET  41  19.050   7.310   6.956
    6    HG3  MET  41           HG3      MET  41  20.351   8.476   7.178
    7    HE2  MET  41           HE1      MET  41  19.788   9.752   3.837
    8    HE1  MET  41           HE2      MET  41  20.739  10.201   5.250
    9    HE3  MET  41           HE3      MET  41  19.461  11.271   4.680

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ASP  42           H        ASP  42  23.226   6.346   5.096
    2    HA   ASP  42           HA       ASP  42  23.327   5.866   2.339
    3    HB2  ASP  42           HB2      ASP  42  25.068   6.878   4.110
    4    HB3  ASP  42           HB3      ASP  42  25.735   5.257   3.988

  No H/Q in entry =           4
  In of MODEL   41
    1    H    GLN  43           H        GLN  43  24.058   3.722   5.067
    2    HA   GLN  43           HA       GLN  43  24.740   1.465   3.491
    3    HB2  GLN  43           HB2      GLN  43  23.710   1.649   6.332
    4    HB3  GLN  43           HB3      GLN  43  24.300   0.162   5.582
    5    HG2  GLN  43           HG2      GLN  43  26.457   1.385   5.073
    6    HG3  GLN  43           HG3      GLN  43  25.863   2.711   6.068
    7   HE21  GLN  43          HE21      GLN  43  28.100   1.754   7.112
    8   HE22  GLN  43          HE22      GLN  43  27.830   0.673   8.390

  No H/Q in entry =           8
  In of MODEL   41
    1    H    SER  44           H        SER  44  21.674   2.583   4.867
    2    HA   SER  44           HA       SER  44  20.121   0.328   4.196
    3    HB2  SER  44           HB2      SER  44  19.661   2.857   5.334
    4    HB3  SER  44           HB3      SER  44  18.630   2.804   3.907
    5    HG   SER  44           HG       SER  44  17.538   1.858   5.630

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ARG  45           H        ARG  45  20.849   3.293   2.385
    2    HA   ARG  45           HA       ARG  45  19.333   2.792   0.079
    3    HB2  ARG  45           HB2      ARG  45  20.462   4.937   0.660
    4    HB3  ARG  45           HB3      ARG  45  22.012   4.190   0.280
    5    HG2  ARG  45           HG2      ARG  45  21.236   3.774  -2.035
    6    HG3  ARG  45           HG3      ARG  45  19.698   4.544  -1.654
    7    HD2  ARG  45           HD2      ARG  45  20.934   6.649  -1.072
    8    HD3  ARG  45           HD3      ARG  45  22.437   5.883  -1.636
    9    HE   ARG  45           HE       ARG  45  20.512   5.629  -3.675
   10   HH21  ARG  45          HH11      ARG  45  20.501   6.994  -5.442
   11   HH22  ARG  45          HH12      ARG  45  21.248   8.549  -5.340
   12   HH11  ARG  45          HH21      ARG  45  22.224   8.142  -2.051
   13   HH12  ARG  45          HH22      ARG  45  22.223   9.198  -3.417

  No H/Q in entry =          13
  In of MODEL   41
    1    H    MET  46           H        MET  46  22.700   1.939   0.835
    2    HA   MET  46           HA       MET  46  23.318   0.744  -1.645
    3    HB2  MET  46           HB2      MET  46  24.421   0.424   1.148
    4    HB3  MET  46           HB3      MET  46  25.088  -0.459  -0.229
    5    HG2  MET  46           HG2      MET  46  25.491   1.669  -1.409
    6    HG3  MET  46           HG3      MET  46  24.813   2.558  -0.052
    7    HE2  MET  46           HE1      MET  46  28.344   3.611   0.662
    8    HE1  MET  46           HE2      MET  46  26.666   4.026   0.327
    9    HE3  MET  46           HE3      MET  46  27.694   3.424  -0.972

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ALA  47           H        ALA  47  21.937  -0.590   1.332
    2    HA   ALA  47           HA       ALA  47  21.899  -3.305   0.536
    3    HB2  ALA  47           HB1      ALA  47  21.514  -2.840   2.839
    4    HB3  ALA  47           HB2      ALA  47  19.981  -3.453   2.219
    5    HB1  ALA  47           HB3      ALA  47  20.201  -1.720   2.473

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU  48           H        LEU  48  19.533  -0.691   0.169
    2    HA   LEU  48           HA       LEU  48  17.498  -2.238  -1.081
    3    HB2  LEU  48           HB2      LEU  48  18.138   0.719  -1.203
    4    HB3  LEU  48           HB3      LEU  48  16.672  -0.001  -1.870
    5    HG   LEU  48           HG       LEU  48  17.522  -0.291   1.021
    6   HD13  LEU  48          HD11      LEU  48  17.093   2.008   0.827
    7   HD12  LEU  48          HD12      LEU  48  15.537   1.354   1.336
    8   HD11  LEU  48          HD13      LEU  48  15.809   1.772  -0.356
    9   HD22  LEU  48          HD21      LEU  48  16.002  -2.014   0.642
   10   HD21  LEU  48          HD22      LEU  48  15.126  -1.119  -0.600
   11   HD23  LEU  48          HD23      LEU  48  14.909  -0.710   1.102

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ASN  49           H        ASN  49  20.179  -0.301  -2.314
    2    HA   ASN  49           HA       ASN  49  19.532  -0.395  -5.038
    3    HB2  ASN  49           HB2      ASN  49  21.199   1.135  -4.135
    4    HB3  ASN  49           HB3      ASN  49  22.230  -0.212  -3.667
    5   HD21  ASN  49          HD21      ASN  49  20.754   1.295  -6.565
    6   HD22  ASN  49          HD22      ASN  49  21.999   0.837  -7.622

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLU  50           H        GLU  50  21.524  -2.575  -3.067
    2    HA   GLU  50           HA       GLU  50  22.236  -4.333  -5.187
    3    HB2  GLU  50           HB2      GLU  50  23.431  -4.296  -3.019
    4    HB3  GLU  50           HB3      GLU  50  21.991  -4.928  -2.223
    5    HG2  GLU  50           HG2      GLU  50  22.091  -6.965  -3.576
    6    HG3  GLU  50           HG3      GLU  50  23.465  -6.329  -4.477

  No H/Q in entry =           6
  In of MODEL   41
    1    H    ALA  51           H        ALA  51  19.577  -4.273  -2.864
    2    HA   ALA  51           HA       ALA  51  18.423  -6.754  -3.615
    3    HB3  ALA  51           HB1      ALA  51  16.827  -6.251  -2.063
    4    HB1  ALA  51           HB2      ALA  51  16.606  -4.607  -2.667
    5    HB2  ALA  51           HB3      ALA  51  17.966  -4.984  -1.608

  No H/Q in entry =           5
  In of MODEL   41
    1    H    HIS  52           H        HIS  52  17.823  -3.412  -4.661
    2    HA   HIS  52           HA       HIS  52  15.714  -3.954  -6.461
    3    HB2  HIS  52           HB2      HIS  52  16.352  -1.683  -5.665
    4    HB3  HIS  52           HB3      HIS  52  17.808  -1.776  -6.657
    5    HD1  HIS  52           HD1      HIS  52  17.477  -1.804  -9.269
    6    HD2  HIS  52           HD2      HIS  52  13.976  -1.163  -7.098
    7    HE1  HIS  52           HE1      HIS  52  15.750  -0.968 -10.923
    8    HE2  HIS  52           HE2      HIS  52  13.611  -0.573  -9.614

  No H/Q in entry =           8
  In of MODEL   41
    1    H    LEU  53           H        LEU  53  19.233  -3.944  -6.890
    2    HA   LEU  53           HA       LEU  53  19.294  -4.269  -9.689
    3    HB2  LEU  53           HB2      LEU  53  21.229  -5.019  -7.512
    4    HB3  LEU  53           HB3      LEU  53  21.548  -5.401  -9.203
    5    HG   LEU  53           HG       LEU  53  20.854  -2.596  -8.277
    6   HD12  LEU  53          HD11      LEU  53  23.311  -2.157  -8.415
    7   HD11  LEU  53          HD12      LEU  53  23.576  -3.889  -8.620
    8   HD13  LEU  53          HD13      LEU  53  22.893  -3.273  -7.118
    9   HD21  LEU  53          HD21      LEU  53  21.969  -3.820 -10.808
   10   HD23  LEU  53          HD22      LEU  53  22.279  -2.132 -10.414
   11   HD22  LEU  53          HD23      LEU  53  20.633  -2.687 -10.649

  No H/Q in entry =          11
  In of MODEL   41
    1    H    VAL  54           H        VAL  54  19.191  -6.647  -7.056
    2    HA   VAL  54           HA       VAL  54  19.327  -8.947  -8.708
    3    HB   VAL  54           HB       VAL  54  18.168  -8.520  -5.943
    4   HG12  VAL  54          HG11      VAL  54  18.505 -11.136  -5.930
    5   HG11  VAL  54          HG12      VAL  54  18.321 -10.974  -7.676
    6   HG13  VAL  54          HG13      VAL  54  17.029 -10.446  -6.601
    7   HG22  VAL  54          HG21      VAL  54  20.482  -8.296  -5.719
    8   HG21  VAL  54          HG22      VAL  54  20.826  -9.391  -7.056
    9   HG23  VAL  54          HG23      VAL  54  20.298 -10.035  -5.502

  No H/Q in entry =           9
  In of MODEL   41
    1    H    GLN  55           H        GLN  55  16.588  -7.054  -7.434
    2    HA   GLN  55           HA       GLN  55  14.576  -8.732  -8.504
    3    HB2  GLN  55           HB2      GLN  55  13.818  -7.205  -6.883
    4    HB3  GLN  55           HB3      GLN  55  14.605  -5.835  -7.663
    5    HG2  GLN  55           HG2      GLN  55  12.880  -5.525  -9.156
    6    HG3  GLN  55           HG3      GLN  55  12.568  -7.248  -9.320
    7   HE21  GLN  55          HE21      GLN  55  10.563  -7.805  -8.515
    8   HE22  GLN  55          HE22      GLN  55   9.784  -7.050  -7.210

  No H/Q in entry =           8
  In of MODEL   41
    1    H    THR  56           H        THR  56  16.302  -5.927  -9.872
    2    HA   THR  56           HA       THR  56  14.864  -5.581 -12.223
    3    HB   THR  56           HB       THR  56  17.883  -5.478 -12.069
    4    HG1  THR  56           HG1      THR  56  15.894  -3.688 -11.160
    5   HG22  THR  56          HG21      THR  56  15.993  -3.693 -13.599
    6   HG21  THR  56          HG22      THR  56  16.604  -5.200 -14.280
    7   HG23  THR  56          HG23      THR  56  17.727  -3.912 -13.839

  No H/Q in entry =           7
  In of MODEL   41
    1    H    LYS  57           H        LYS  57  17.526  -7.861 -11.601
    2    HA   LYS  57           HA       LYS  57  17.536  -9.065 -14.175
    3    HB2  LYS  57           HB2      LYS  57  19.325  -9.300 -12.424
    4    HB3  LYS  57           HB3      LYS  57  18.225 -10.302 -11.489
    5    HG2  LYS  57           HG2      LYS  57  18.124 -11.929 -13.336
    6    HG3  LYS  57           HG3      LYS  57  19.221 -10.933 -14.284
    7    HD2  LYS  57           HD2      LYS  57  19.977 -11.966 -11.545
    8    HD3  LYS  57           HD3      LYS  57  20.272 -12.905 -13.009
    9    HE2  LYS  57           HE2      LYS  57  21.489 -10.861 -13.934
   10    HE3  LYS  57           HE3      LYS  57  21.404 -10.172 -12.314
   11    HZ1  LYS  57           HZ1      LYS  57  22.345 -12.598 -11.777
   12    HZ3  LYS  57           HZ2      LYS  57  23.335 -11.250 -12.068
   13    HZ2  LYS  57           HZ3      LYS  57  23.018 -12.360 -13.314

  No H/Q in entry =          13
  In of MODEL   41
    1    H    LEU  58           H        LEU  58  15.757  -9.732 -11.199
    2    HA   LEU  58           HA       LEU  58  14.550 -12.116 -12.126
    3    HB2  LEU  58           HB2      LEU  58  13.742 -10.208  -9.938
    4    HB3  LEU  58           HB3      LEU  58  12.945 -11.752 -10.249
    5    HG   LEU  58           HG       LEU  58  15.916 -11.453  -9.693
    6   HD11  LEU  58          HD11      LEU  58  13.546 -11.879  -7.901
    7   HD13  LEU  58          HD12      LEU  58  14.993 -10.906  -7.640
    8   HD12  LEU  58          HD13      LEU  58  15.076 -12.661  -7.499
    9   HD22  LEU  58          HD21      LEU  58  15.812 -13.520 -10.713
   10   HD21  LEU  58          HD22      LEU  58  14.099 -13.738 -10.353
   11   HD23  LEU  58          HD23      LEU  58  15.308 -14.027  -9.102

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  59           H        ILE  59  13.859  -8.786 -12.821
    2    HA   ILE  59           HA       ILE  59  11.148  -9.455 -13.761
    3    HB   ILE  59           HB       ILE  59  11.933  -7.165 -12.562
    4   HG12  ILE  59          HG12      ILE  59  10.042  -7.054 -14.922
    5   HG13  ILE  59          HG13      ILE  59   9.616  -7.826 -13.416
    6   HG21  ILE  59          HG21      ILE  59  13.483  -6.769 -14.621
    7   HG23  ILE  59          HG22      ILE  59  12.509  -5.431 -14.056
    8   HG22  ILE  59          HG23      ILE  59  12.010  -6.358 -15.468
    9   HD11  ILE  59          HD11      ILE  59  10.118  -5.711 -12.204
   10   HD13  ILE  59          HD12      ILE  59   8.810  -5.530 -13.373
   11   HD12  ILE  59          HD13      ILE  59  10.427  -4.939 -13.760

  No H/Q in entry =          11
  In of MODEL   41
    1    H    GLU  60           H        GLU  60  14.348  -8.588 -15.020
    2    HA   GLU  60           HA       GLU  60  13.568  -8.202 -17.730
    3    HB2  GLU  60           HB2      GLU  60  15.745  -7.460 -16.858
    4    HB3  GLU  60           HB3      GLU  60  16.217  -9.135 -16.589
    5    HG2  GLU  60           HG2      GLU  60  16.015  -9.587 -19.009
    6    HG3  GLU  60           HG3      GLU  60  15.539  -7.912 -19.281

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLY  61           H        GLY  61  14.561 -11.071 -15.904
    2    HA3  GLY  61           HA2      GLY  61  14.032 -12.731 -18.299
    3    HA2  GLY  61           HA3      GLY  61  15.066 -13.201 -16.955

  No H/Q in entry =           3
  In of MODEL   41
    1    H    ASP  62           H        ASP  62  11.936 -11.673 -16.591
    2    HA   ASP  62           HA       ASP  62  11.019 -13.662 -14.785
    3    HB2  ASP  62           HB2      ASP  62  10.335 -11.300 -14.675
    4    HB3  ASP  62           HB3      ASP  62   9.476 -11.483 -16.202

  No H/Q in entry =           4
  In of MODEL   41
    1    H    ALA  63           H        ALA  63  11.641 -15.225 -16.923
    2    HA   ALA  63           HA       ALA  63   9.538 -15.681 -18.795
    3    HB2  ALA  63           HB1      ALA  63  11.613 -17.618 -17.731
    4    HB1  ALA  63           HB2      ALA  63  11.833 -16.538 -19.106
    5    HB3  ALA  63           HB3      ALA  63  10.647 -17.842 -19.189

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLY  64           H        GLY  64  10.274 -16.985 -15.606
    2    HA3  GLY  64           HA2      GLY  64   9.050 -18.213 -14.107
    3    HA2  GLY  64           HA3      GLY  64   7.626 -17.531 -14.879

  No H/Q in entry =           3
  In of MODEL   41
    1    H    GLU  65           H        GLU  65   6.278 -19.243 -15.151
    2    HA   GLU  65           HA       GLU  65   7.166 -21.880 -15.651
    3    HB2  GLU  65           HB2      GLU  65   4.448 -20.630 -16.047
    4    HB3  GLU  65           HB3      GLU  65   4.779 -22.359 -16.135
    5    HG2  GLU  65           HG2      GLU  65   5.370 -20.614 -13.730
    6    HG3  GLU  65           HG3      GLU  65   3.960 -21.659 -13.886

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLY  66           H        GLY  66   6.142 -19.315 -17.745
    2    HA3  GLY  66           HA2      GLY  66   7.373 -20.501 -20.051
    3    HA2  GLY  66           HA3      GLY  66   5.624 -20.452 -20.159

  No H/Q in entry =           3
  In of MODEL   41
    1    H    LYS  67           H        LYS  67   6.985 -19.201 -22.056
    2    HA   LYS  67           HA       LYS  67   7.961 -16.692 -21.843
    3    HB2  LYS  67           HB2      LYS  67   6.670 -16.364 -24.141
    4    HB3  LYS  67           HB3      LYS  67   8.036 -17.477 -23.986
    5    HG2  LYS  67           HG2      LYS  67   6.558 -19.357 -23.652
    6    HG3  LYS  67           HG3      LYS  67   5.152 -18.300 -23.549
    7    HD2  LYS  67           HD2      LYS  67   5.540 -17.605 -25.907
    8    HD3  LYS  67           HD3      LYS  67   6.879 -18.752 -25.998
    9    HE2  LYS  67           HE2      LYS  67   4.033 -19.515 -25.281
   10    HE3  LYS  67           HE3      LYS  67   4.722 -19.672 -26.897
   11    HZ2  LYS  67           HZ1      LYS  67   5.489 -21.100 -24.428
   12    HZ1  LYS  67           HZ2      LYS  67   6.543 -21.001 -25.755
   13    HZ3  LYS  67           HZ3      LYS  67   5.025 -21.748 -25.924

  No H/Q in entry =          13
  In of MODEL   41
    1    H    MET  68           H        MET  68   4.535 -17.384 -22.296
    2    HA   MET  68           HA       MET  68   3.589 -14.733 -22.118
    3    HB2  MET  68           HB2      MET  68   2.293 -17.432 -21.854
    4    HB3  MET  68           HB3      MET  68   1.372 -15.938 -21.671
    5    HG2  MET  68           HG2      MET  68   3.095 -16.575 -24.080
    6    HG3  MET  68           HG3      MET  68   1.354 -16.846 -24.014
    7    HE3  MET  68           HE1      MET  68   3.499 -13.196 -25.249
    8    HE2  MET  68           HE2      MET  68   3.483 -14.866 -25.811
    9    HE1  MET  68           HE3      MET  68   4.267 -14.465 -24.284

  No H/Q in entry =           9
  In of MODEL   41
    1    H    LYS  69           H        LYS  69   3.865 -17.257 -19.595
    2    HA   LYS  69           HA       LYS  69   2.585 -15.550 -17.642
    3    HB2  LYS  69           HB2      LYS  69   2.431 -18.136 -17.862
    4    HB3  LYS  69           HB3      LYS  69   3.926 -18.126 -16.923
    5    HG2  LYS  69           HG2      LYS  69   2.867 -16.816 -15.162
    6    HG3  LYS  69           HG3      LYS  69   1.388 -16.681 -16.113
    7    HD2  LYS  69           HD2      LYS  69   2.530 -19.366 -15.340
    8    HD3  LYS  69           HD3      LYS  69   1.432 -18.485 -14.277
    9    HE2  LYS  69           HE2      LYS  69  -0.145 -18.309 -16.282
   10    HE3  LYS  69           HE3      LYS  69   0.890 -19.497 -17.074
   11    HZ1  LYS  69           HZ1      LYS  69  -0.171 -20.001 -14.373
   12    HZ3  LYS  69           HZ2      LYS  69   0.362 -21.116 -15.539
   13    HZ2  LYS  69           HZ3      LYS  69  -1.124 -20.317 -15.740

  No H/Q in entry =          13
  In of MODEL   41
    1    H    VAL  70           H        VAL  70   3.493 -15.193 -15.434
    2    HA   VAL  70           HA       VAL  70   6.418 -14.710 -15.468
    3    HB   VAL  70           HB       VAL  70   5.768 -12.665 -14.004
    4   HG13  VAL  70          HG11      VAL  70   5.644 -11.262 -15.986
    5   HG12  VAL  70          HG12      VAL  70   5.079 -12.621 -16.956
    6   HG11  VAL  70          HG13      VAL  70   6.727 -12.610 -16.328
    7   HG21  VAL  70          HG21      VAL  70   3.302 -13.515 -13.972
    8   HG23  VAL  70          HG22      VAL  70   3.206 -12.838 -15.597
    9   HG22  VAL  70          HG23      VAL  70   3.566 -11.790 -14.225

  No H/Q in entry =           9
  In of MODEL   41
    1    H    SER  71           H        SER  71   7.392 -14.637 -13.352
    2    HA   SER  71           HA       SER  71   6.509 -16.681 -11.576
    3    HB2  SER  71           HB2      SER  71   8.898 -15.962 -11.879
    4    HB3  SER  71           HB3      SER  71   8.508 -14.477 -11.014
    5    HG   SER  71           HG       SER  71   8.488 -17.150 -10.101

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU  72           H        LEU  72   5.078 -16.566  -9.958
    2    HA   LEU  72           HA       LEU  72   3.513 -14.261  -9.523
    3    HB2  LEU  72           HB2      LEU  72   3.814 -16.810  -7.944
    4    HB3  LEU  72           HB3      LEU  72   2.637 -15.560  -7.551
    5    HG   LEU  72           HG       LEU  72   2.808 -16.863 -10.287
    6   HD11  LEU  72          HD11      LEU  72   1.010 -17.535  -7.938
    7   HD13  LEU  72          HD12      LEU  72   2.277 -18.568  -8.597
    8   HD12  LEU  72          HD13      LEU  72   0.849 -18.197  -9.565
    9   HD23  LEU  72          HD21      LEU  72   0.315 -16.062 -10.191
   10   HD22  LEU  72          HD22      LEU  72   1.555 -14.865 -10.528
   11   HD21  LEU  72          HD23      LEU  72   0.876 -14.996  -8.909

  No H/Q in entry =          11
  In of MODEL   41
    1    H    VAL  73           H        VAL  73   6.175 -15.676  -7.742
    2    HA   VAL  73           HA       VAL  73   6.102 -14.136  -5.414
    3    HB   VAL  73           HB       VAL  73   8.286 -14.934  -4.979
    4   HG11  VAL  73          HG11      VAL  73   6.321 -16.617  -5.389
    5   HG13  VAL  73          HG12      VAL  73   7.962 -17.239  -5.209
    6   HG12  VAL  73          HG13      VAL  73   7.251 -17.076  -6.815
    7   HG22  VAL  73          HG21      VAL  73   9.628 -14.358  -6.790
    8   HG21  VAL  73          HG22      VAL  73   8.481 -14.987  -7.971
    9   HG23  VAL  73          HG23      VAL  73   9.477 -16.099  -7.033

  No H/Q in entry =           9
  In of MODEL   41
    1    H    LEU  74           H        LEU  74   7.092 -13.246  -8.591
    2    HA   LEU  74           HA       LEU  74   9.024 -11.284  -8.101
    3    HB2  LEU  74           HB2      LEU  74   8.572 -12.047 -10.338
    4    HB3  LEU  74           HB3      LEU  74   6.906 -11.478 -10.242
    5    HG   LEU  74           HG       LEU  74   7.742  -9.146  -9.996
    6   HD12  LEU  74          HD11      LEU  74  10.220  -8.885 -10.692
    7   HD11  LEU  74          HD12      LEU  74  10.393 -10.576 -10.227
    8   HD13  LEU  74          HD13      LEU  74   9.897  -9.380  -9.031
    9   HD23  LEU  74          HD21      LEU  74   9.069 -10.320 -12.400
   10   HD22  LEU  74          HD22      LEU  74   8.067  -8.894 -12.252
   11   HD21  LEU  74          HD23      LEU  74   7.324 -10.478 -12.212

  No H/Q in entry =          11
  In of MODEL   41
    1    H    VAL  75           H        VAL  75   5.527 -10.921  -8.463
    2    HA   VAL  75           HA       VAL  75   5.413  -8.164  -7.884
    3    HB   VAL  75           HB       VAL  75   3.338 -10.322  -7.502
    4   HG11  VAL  75          HG11      VAL  75   3.131  -7.284  -7.319
    5   HG13  VAL  75          HG12      VAL  75   2.825  -8.435  -6.027
    6   HG12  VAL  75          HG13      VAL  75   1.749  -8.370  -7.414
    7   HG21  VAL  75          HG21      VAL  75   4.272  -9.700  -9.826
    8   HG23  VAL  75          HG22      VAL  75   3.500  -8.134  -9.586
    9   HG22  VAL  75          HG23      VAL  75   2.522  -9.602  -9.626

  No H/Q in entry =           9
  In of MODEL   41
    1    H    GLU  76           H        GLU  76   5.172 -11.036  -5.766
    2    HA   GLU  76           HA       GLU  76   4.688  -9.670  -3.350
    3    HB2  GLU  76           HB2      GLU  76   4.526 -12.137  -3.572
    4    HB3  GLU  76           HB3      GLU  76   6.262 -12.230  -3.816
    5    HG2  GLU  76           HG2      GLU  76   5.850 -12.803  -1.519
    6    HG3  GLU  76           HG3      GLU  76   6.557 -11.198  -1.510

  No H/Q in entry =           6
  In of MODEL   41
    1    H    ALA  77           H        ALA  77   7.757 -10.564  -4.903
    2    HA   ALA  77           HA       ALA  77   9.435  -9.505  -2.886
    3    HB1  ALA  77           HB1      ALA  77  10.293 -11.038  -4.574
    4    HB2  ALA  77           HB2      ALA  77  11.188  -9.520  -4.645
    5    HB3  ALA  77           HB3      ALA  77   9.948  -9.869  -5.849

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLN  78           H        GLN  78   8.042  -8.104  -5.808
    2    HA   GLN  78           HA       GLN  78   9.380  -5.617  -5.708
    3    HB2  GLN  78           HB2      GLN  78   8.090  -6.550  -7.665
    4    HB3  GLN  78           HB3      GLN  78   6.606  -6.166  -6.795
    5    HG2  GLN  78           HG2      GLN  78   7.253  -3.796  -6.718
    6    HG3  GLN  78           HG3      GLN  78   8.748  -4.169  -7.574
    7   HE21  GLN  78          HE21      GLN  78   8.390  -3.221  -9.623
    8   HE22  GLN  78          HE22      GLN  78   7.053  -3.577 -10.607

  No H/Q in entry =           8
  In of MODEL   41
    1    H    LEU  79           H        LEU  79   6.364  -6.767  -4.283
    2    HA   LEU  79           HA       LEU  79   5.354  -4.362  -3.284
    3    HB2  LEU  79           HB2      LEU  79   4.050  -6.421  -3.225
    4    HB3  LEU  79           HB3      LEU  79   5.196  -7.151  -2.105
    5    HG   LEU  79           HG       LEU  79   4.630  -5.506  -0.384
    6   HD13  LEU  79          HD11      LEU  79   4.156  -3.497  -1.442
    7   HD12  LEU  79          HD12      LEU  79   2.533  -4.030  -1.006
    8   HD11  LEU  79          HD13      LEU  79   3.119  -4.255  -2.652
    9   HD23  LEU  79          HD21      LEU  79   2.046  -6.012  -0.300
   10   HD22  LEU  79          HD22      LEU  79   3.192  -7.345  -0.184
   11   HD21  LEU  79          HD23      LEU  79   2.381  -7.017  -1.713

  No H/Q in entry =          11
  In of MODEL   41
    1    H    HIS  80           H        HIS  80   7.544  -6.681  -1.687
    2    HA   HIS  80           HA       HIS  80   7.816  -5.131   0.678
    3    HB2  HIS  80           HB2      HIS  80   9.170  -7.491  -0.509
    4    HB3  HIS  80           HB3      HIS  80  10.072  -6.586   0.708
    5    HD1  HIS  80           HD1      HIS  80   9.577  -7.217   3.051
    6    HD2  HIS  80           HD2      HIS  80   6.373  -8.092   0.531
    7    HE1  HIS  80           HE1      HIS  80   7.806  -8.325   4.497
    8    HE2  HIS  80           HE2      HIS  80   5.847  -8.862   2.969

  No H/Q in entry =           8
  In of MODEL   41
    1    H    LEU  81           H        LEU  81   9.833  -5.405  -2.227
    2    HA   LEU  81           HA       LEU  81  11.865  -3.652  -1.346
    3    HB2  LEU  81           HB2      LEU  81  10.958  -4.457  -4.110
    4    HB3  LEU  81           HB3      LEU  81  12.372  -3.443  -3.818
    5    HG   LEU  81           HG       LEU  81  11.988  -6.162  -2.538
    6   HD12  LEU  81          HD11      LEU  81  13.813  -6.785  -4.279
    7   HD11  LEU  81          HD12      LEU  81  13.243  -5.367  -5.157
    8   HD13  LEU  81          HD13      LEU  81  12.137  -6.695  -4.819
    9   HD23  LEU  81          HD21      LEU  81  14.614  -5.835  -2.515
   10   HD22  LEU  81          HD22      LEU  81  13.624  -5.075  -1.271
   11   HD21  LEU  81          HD23      LEU  81  14.203  -4.125  -2.639

  No H/Q in entry =          11
  In of MODEL   41
    1    H    MET  82           H        MET  82   8.946  -3.034  -3.295
    2    HA   MET  82           HA       MET  82   9.476  -0.308  -3.802
    3    HB2  MET  82           HB2      MET  82   6.923  -1.913  -3.682
    4    HB3  MET  82           HB3      MET  82   6.916  -0.189  -4.051
    5    HG2  MET  82           HG2      MET  82   8.531  -2.260  -5.574
    6    HG3  MET  82           HG3      MET  82   6.963  -1.646  -6.094
    7    HE3  MET  82           HE1      MET  82   7.401   1.807  -7.275
    8    HE2  MET  82           HE2      MET  82   7.021   1.584  -5.569
    9    HE1  MET  82           HE3      MET  82   6.365   0.468  -6.763

  No H/Q in entry =           9
  In of MODEL   41
    1    H    THR  83           H        THR  83   7.682  -1.906  -1.199
    2    HA   THR  83           HA       THR  83   6.816   0.443   0.117
    3    HB   THR  83           HB       THR  83   6.681  -1.126   2.140
    4    HG1  THR  83           HG1      THR  83   7.447  -3.074   1.918
    5   HG22  THR  83          HG21      THR  83   5.040  -2.703   0.670
    6   HG21  THR  83          HG22      THR  83   5.265  -1.377  -0.465
    7   HG23  THR  83          HG23      THR  83   4.617  -1.060   1.145

  No H/Q in entry =           7
  In of MODEL   41
    1    H    SER  84           H        SER  84   9.646  -1.642   0.655
    2    HA   SER  84           HA       SER  84  10.692  -0.201   2.842
    3    HB2  SER  84           HB2      SER  84  11.960  -2.045   0.827
    4    HB3  SER  84           HB3      SER  84  12.899  -1.284   2.110
    5    HG   SER  84           HG       SER  84  10.630  -2.982   2.367

  No H/Q in entry =           5
  In of MODEL   41
    1    H    MET  85           H        MET  85  11.457   0.053  -0.644
    2    HA   MET  85           HA       MET  85  13.447   2.026  -0.391
    3    HB2  MET  85           HB2      MET  85  13.063   0.737  -2.454
    4    HB3  MET  85           HB3      MET  85  11.534   1.584  -2.692
    5    HG2  MET  85           HG2      MET  85  12.739   3.737  -2.798
    6    HG3  MET  85           HG3      MET  85  14.265   2.892  -2.561
    7    HE3  MET  85           HE1      MET  85  15.769   2.430  -4.651
    8    HE2  MET  85           HE2      MET  85  15.136   1.159  -5.693
    9    HE1  MET  85           HE3      MET  85  15.047   0.975  -3.947

  No H/Q in entry =           9
  In of MODEL   41
    1    H    LEU  86           H        LEU  86   9.958   2.346  -0.914
    2    HA   LEU  86           HA       LEU  86   9.885   5.159  -1.104
    3    HB2  LEU  86           HB2      LEU  86   8.048   3.491  -1.682
    4    HB3  LEU  86           HB3      LEU  86   7.712   3.405   0.047
    5    HG   LEU  86           HG       LEU  86   7.543   5.965  -0.014
    6   HD11  LEU  86          HD11      LEU  86   8.330   5.524  -2.711
    7   HD13  LEU  86          HD12      LEU  86   7.886   7.052  -1.957
    8   HD12  LEU  86          HD13      LEU  86   6.656   6.082  -2.763
    9   HD23  LEU  86          HD21      LEU  86   5.420   4.600  -1.680
   10   HD22  LEU  86          HD22      LEU  86   5.221   5.863  -0.468
   11   HD21  LEU  86          HD23      LEU  86   5.624   4.221   0.031

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ALA  87           H        ALA  87   9.416   2.987   1.647
    2    HA   ALA  87           HA       ALA  87   8.854   4.905   3.608
    3    HB1  ALA  87           HB1      ALA  87   9.671   2.087   3.533
    4    HB3  ALA  87           HB2      ALA  87   8.539   2.899   4.613
    5    HB2  ALA  87           HB3      ALA  87  10.267   2.937   4.963

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ARG  88           H        ARG  88  11.946   3.488   2.643
    2    HA   ARG  88           HA       ARG  88  13.544   4.876   4.477
    3    HB2  ARG  88           HB2      ARG  88  14.224   2.901   3.081
    4    HB3  ARG  88           HB3      ARG  88  14.378   3.990   1.706
    5    HG2  ARG  88           HG2      ARG  88  15.840   5.314   3.653
    6    HG3  ARG  88           HG3      ARG  88  16.165   3.627   4.038
    7    HD2  ARG  88           HD2      ARG  88  17.439   3.329   2.197
    8    HD3  ARG  88           HD3      ARG  88  16.303   4.194   1.157
    9    HE   ARG  88           HE       ARG  88  18.690   5.269   2.210
   10   HH21  ARG  88          HH11      ARG  88  19.029   7.488   2.009
   11   HH22  ARG  88          HH12      ARG  88  17.675   8.555   1.858
   12   HH11  ARG  88          HH21      ARG  88  15.350   6.010   1.918
   13   HH12  ARG  88          HH22      ARG  88  15.591   7.715   1.782

  No H/Q in entry =          13
  In of MODEL   41
    1    H    GLU  89           H        GLU  89  12.579   5.761   1.147
    2    HA   GLU  89           HA       GLU  89  14.119   8.126   0.989
    3    HB2  GLU  89           HB2      GLU  89  12.985   7.075  -0.959
    4    HB3  GLU  89           HB3      GLU  89  11.436   7.613  -0.308
    5    HG2  GLU  89           HG2      GLU  89  12.131   9.953  -0.475
    6    HG3  GLU  89           HG3      GLU  89  13.738   9.466  -1.005

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LEU  90           H        LEU  90  10.788   7.609   2.109
    2    HA   LEU  90           HA       LEU  90  10.262  10.342   2.675
    3    HB2  LEU  90           HB2      LEU  90   9.072   7.768   3.706
    4    HB3  LEU  90           HB3      LEU  90   8.435   9.362   4.122
    5    HG   LEU  90           HG       LEU  90   8.865   8.475   1.257
    6   HD12  LEU  90          HD11      LEU  90   6.332   8.138   1.312
    7   HD11  LEU  90          HD12      LEU  90   6.482   8.134   3.069
    8   HD13  LEU  90          HD13      LEU  90   7.307   6.904   2.111
    9   HD22  LEU  90          HD21      LEU  90   8.564  10.782   1.175
   10   HD21  LEU  90          HD22      LEU  90   7.573  10.815   2.632
   11   HD23  LEU  90          HD23      LEU  90   6.882  10.254   1.110

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  91           H        ILE  91  11.527   7.670   4.609
    2    HA   ILE  91           HA       ILE  91  11.655   9.043   7.074
    3    HB   ILE  91           HB       ILE  91  13.220   6.707   5.962
    4   HG12  ILE  91          HG12      ILE  91  11.196   6.874   8.214
    5   HG13  ILE  91          HG13      ILE  91  10.732   6.586   6.538
    6   HG22  ILE  91          HG21      ILE  91  13.683   6.502   8.605
    7   HG21  ILE  91          HG22      ILE  91  13.601   8.260   8.498
    8   HG23  ILE  91          HG23      ILE  91  14.786   7.373   7.540
    9   HD13  ILE  91          HD11      ILE  91  11.742   4.488   6.477
   10   HD12  ILE  91          HD12      ILE  91  11.143   4.549   8.135
   11   HD11  ILE  91          HD13      ILE  91  12.845   4.867   7.801

  No H/Q in entry =          11
  In of MODEL   41
    1    H    THR  92           H        THR  92  13.882   8.873   4.329
    2    HA   THR  92           HA       THR  92  16.039  10.277   5.492
    3    HB   THR  92           HB       THR  92  15.062  10.140   2.628
    4    HG1  THR  92           HG1      THR  92  15.899   8.247   3.041
    5   HG22  THR  92          HG21      THR  92  17.631  10.838   2.341
    6   HG21  THR  92          HG22      THR  92  17.315  11.663   3.867
    7   HG23  THR  92          HG23      THR  92  16.348  12.043   2.442

  No H/Q in entry =           7
  In of MODEL   41
    1    H    GLU  93           H        GLU  93  13.153  11.416   3.750
    2    HA   GLU  93           HA       GLU  93  13.738  14.179   3.858
    3    HB2  GLU  93           HB2      GLU  93  11.039  12.797   3.868
    4    HB3  GLU  93           HB3      GLU  93  11.322  14.497   3.492
    5    HG2  GLU  93           HG2      GLU  93  12.672  12.254   1.975
    6    HG3  GLU  93           HG3      GLU  93  11.125  12.930   1.481

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LEU  94           H        LEU  94  11.996  12.023   6.070
    2    HA   LEU  94           HA       LEU  94  11.174  13.972   7.938
    3    HB2  LEU  94           HB2      LEU  94  11.759  11.020   8.223
    4    HB3  LEU  94           HB3      LEU  94  11.180  11.998   9.568
    5    HG   LEU  94           HG       LEU  94   9.704  12.037   6.935
    6   HD11  LEU  94          HD11      LEU  94   9.788   9.822   8.946
    7   HD13  LEU  94          HD12      LEU  94   9.492   9.754   7.210
    8   HD12  LEU  94          HD13      LEU  94   8.208  10.270   8.303
    9   HD23  LEU  94          HD21      LEU  94   7.778  12.435   8.528
   10   HD22  LEU  94          HD22      LEU  94   9.013  13.693   8.565
   11   HD21  LEU  94          HD23      LEU  94   8.950  12.480   9.843

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  95           H        ILE  95  14.155  12.052   7.716
    2    HA   ILE  95           HA       ILE  95  15.313  12.985  10.131
    3    HB   ILE  95           HB       ILE  95  16.563  11.913   7.589
    4   HG12  ILE  95          HG12      ILE  95  16.263  10.719  10.359
    5   HG13  ILE  95          HG13      ILE  95  15.101  10.453   9.062
    6   HG21  ILE  95          HG21      ILE  95  17.808  12.732  10.233
    7   HG23  ILE  95          HG22      ILE  95  18.273  13.256   8.613
    8   HG22  ILE  95          HG23      ILE  95  18.583  11.599   9.127
    9   HD13  ILE  95          HD11      ILE  95  16.589   9.176   7.807
   10   HD12  ILE  95          HD12      ILE  95  17.058   8.733   9.445
   11   HD11  ILE  95          HD13      ILE  95  18.010   9.913   8.546

  No H/Q in entry =          11
  In of MODEL   41
    1    H    GLU  96           H        GLU  96  15.473  14.209   6.793
    2    HA   GLU  96           HA       GLU  96  17.311  16.295   7.269
    3    HB2  GLU  96           HB2      GLU  96  16.655  15.624   5.010
    4    HB3  GLU  96           HB3      GLU  96  15.010  16.177   5.304
    5    HG2  GLU  96           HG2      GLU  96  15.570  18.306   4.757
    6    HG3  GLU  96           HG3      GLU  96  16.866  18.315   5.943

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LEU  97           H        LEU  97  13.799  16.098   7.689
    2    HA   LEU  97           HA       LEU  97  13.372  18.832   8.322
    3    HB2  LEU  97           HB2      LEU  97  11.860  16.303   8.939
    4    HB3  LEU  97           HB3      LEU  97  11.341  17.851   9.604
    5    HG   LEU  97           HG       LEU  97  11.833  17.428   6.642
    6   HD12  LEU  97          HD11      LEU  97   9.311  17.291   6.517
    7   HD11  LEU  97          HD12      LEU  97   9.300  17.096   8.268
    8   HD13  LEU  97          HD13      LEU  97  10.087  15.889   7.252
    9   HD23  LEU  97          HD21      LEU  97  10.089  19.386   6.664
   10   HD22  LEU  97          HD22      LEU  97  11.768  19.752   7.060
   11   HD21  LEU  97          HD23      LEU  97  10.576  19.582   8.347

  No H/Q in entry =          11
  In of MODEL   41
    1    H    HIS  98           H        HIS  98  14.197  16.015  10.328
    2    HA   HIS  98           HA       HIS  98  14.029  17.282  12.840
    3    HB2  HIS  98           HB2      HIS  98  15.788  15.027  11.850
    4    HB3  HIS  98           HB3      HIS  98  15.780  15.571  13.529
    5    HD1  HIS  98           HD1      HIS  98  13.594  13.927  10.936
    6    HD2  HIS  98           HD2      HIS  98  13.472  14.858  14.997
    7    HE1  HIS  98           HE1      HIS  98  11.570  12.728  11.886
    8    HE2  HIS  98           HE2      HIS  98  11.476  13.287  14.355

  No H/Q in entry =           8
  In of MODEL   41
    1    H    GLU  99           H        GLU  99  16.589  17.168  10.412
    2    HA   GLU  99           HA       GLU  99  18.566  18.510  11.943
    3    HB2  GLU  99           HB2      GLU  99  19.055  17.218   9.879
    4    HB3  GLU  99           HB3      GLU  99  18.244  18.468   8.932
    5    HG2  GLU  99           HG2      GLU  99  19.845  20.146   9.723
    6    HG3  GLU  99           HG3      GLU  99  20.625  18.949  10.751

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LYS 100           H        LYS 100  16.045  19.659   9.717
    2    HA   LYS 100           HA       LYS 100  16.834  22.399   9.855
    3    HB2  LYS 100           HB2      LYS 100  14.207  21.100   9.097
    4    HB3  LYS 100           HB3      LYS 100  14.502  22.839   9.002
    5    HG2  LYS 100           HG2      LYS 100  16.479  22.392   7.542
    6    HG3  LYS 100           HG3      LYS 100  16.070  20.674   7.564
    7    HD2  LYS 100           HD2      LYS 100  13.877  21.174   6.556
    8    HD3  LYS 100           HD3      LYS 100  14.268  22.894   6.542
    9    HE2  LYS 100           HE2      LYS 100  16.233  22.415   5.089
   10    HE3  LYS 100           HE3      LYS 100  15.772  20.709   5.059
   11    HZ1  LYS 100           HZ1      LYS 100  13.943  22.894   4.213
   12    HZ3  LYS 100           HZ2      LYS 100  13.764  21.224   3.955
   13    HZ2  LYS 100           HZ3      LYS 100  14.975  22.087   3.135

  No H/Q in entry =          13
  In of MODEL   41
    1    H    LEU 101           H        LEU 101  14.737  20.352  11.820
    2    HA   LEU 101           HA       LEU 101  13.561  22.421  13.390
    3    HB2  LEU 101           HB2      LEU 101  14.010  19.474  13.783
    4    HB3  LEU 101           HB3      LEU 101  13.468  20.457  15.140
    5    HG   LEU 101           HG       LEU 101  12.057  20.534  12.467
    6   HD12  LEU 101          HD11      LEU 101  10.398  18.969  13.735
    7   HD11  LEU 101          HD12      LEU 101  11.791  18.563  14.735
    8   HD13  LEU 101          HD13      LEU 101  11.830  18.251  12.999
    9   HD21  LEU 101          HD21      LEU 101  11.390  21.333  15.315
   10   HD23  LEU 101          HD22      LEU 101  10.133  21.101  14.102
   11   HD22  LEU 101          HD23      LEU 101  11.365  22.338  13.864

  No H/Q in entry =          11
  In of MODEL   41
    1    H    LYS 102           H        LYS 102  16.711  21.821  12.963
    2    HA   LYS 102           HA       LYS 102  18.553  22.699  14.038
    3    HB2  LYS 102           HB2      LYS 102  16.732  24.212  15.163
    4    HB3  LYS 102           HB3      LYS 102  16.938  23.154  16.543
    5    HG2  LYS 102           HG2      LYS 102  18.829  25.167  15.373
    6    HG3  LYS 102           HG3      LYS 102  18.443  24.856  17.052
    7    HD2  LYS 102           HD2      LYS 102  20.120  22.943  15.376
    8    HD3  LYS 102           HD3      LYS 102  20.803  24.269  16.307
    9    HE2  LYS 102           HE2      LYS 102  20.409  21.722  17.281
   10    HE3  LYS 102           HE3      LYS 102  20.621  23.167  18.269
   11    HZ2  LYS 102           HZ1      LYS 102  18.654  21.880  18.886
   12    HZ1  LYS 102           HZ2      LYS 102  18.013  22.105  17.334
   13    HZ3  LYS 102           HZ3      LYS 102  18.238  23.438  18.357

  No H/Q in entry =          13
  In of MODEL   41
    1    H    ALA 103           H        ALA 103  16.479  21.095  16.459
    2    HA   ALA 103           HA       ALA 103  18.204  19.893  18.122
    3    HB2  ALA 103           HB1      ALA 103  16.625  17.882  18.117
    4    HB1  ALA 103           HB2      ALA 103  15.730  18.730  16.855
    5    HB3  ALA 103           HB3      ALA 103  15.903  19.455  18.452

  No H/Q in entry =           5
  In of MODEL   41
    1    H1   ALA   1           H3       ALA   1  -1.558  -7.113 -21.479
    2    H2   ALA   1           H2       ALA   1  -2.351  -8.549 -21.024
    3    H3   ALA   1           H1       ALA   1  -0.742  -8.597 -21.574
    4    HA   ALA   1           HA       ALA   1  -1.569  -9.073 -23.572
    5    HB1  ALA   1           HB1      ALA   1  -3.706  -9.794 -23.102
    6    HB2  ALA   1           HB2      ALA   1  -4.145  -8.287 -23.905
    7    HB3  ALA   1           HB3      ALA   1  -4.089  -8.362 -22.145

  No H/Q in entry =           7
  In of MODEL   41
    1    H    GLU   2           H        GLU   2  -2.396  -7.890 -25.566
    2    HA   GLU   2           HA       GLU   2  -0.998  -5.875 -26.445
    3    HB2  GLU   2           HB2      GLU   2  -4.005  -5.949 -26.771
    4    HB3  GLU   2           HB3      GLU   2  -2.883  -5.086 -27.820
    5    HG2  GLU   2           HG2      GLU   2  -2.373  -6.978 -28.968
    6    HG3  GLU   2           HG3      GLU   2  -2.078  -7.880 -27.488

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLU   3           H        GLU   3  -4.164  -4.622 -25.557
    2    HA   GLU   3           HA       GLU   3  -3.124  -2.062 -24.932
    3    HB2  GLU   3           HB2      GLU   3  -5.810  -3.381 -24.604
    4    HB3  GLU   3           HB3      GLU   3  -5.517  -1.764 -23.961
    5    HG2  GLU   3           HG2      GLU   3  -5.156  -0.842 -26.089
    6    HG3  GLU   3           HG3      GLU   3  -4.756  -2.398 -26.808

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LEU   4           H        LEU   4  -4.716  -4.419 -22.751
    2    HA   LEU   4           HA       LEU   4  -4.361  -3.184 -20.362
    3    HB2  LEU   4           HB2      LEU   4  -3.811  -6.126 -20.823
    4    HB3  LEU   4           HB3      LEU   4  -4.222  -5.376 -19.282
    5    HG   LEU   4           HG       LEU   4  -5.988  -5.459 -21.751
    6   HD13  LEU   4          HD11      LEU   4  -7.181  -7.176 -20.752
    7   HD12  LEU   4          HD12      LEU   4  -6.702  -6.712 -19.121
    8   HD11  LEU   4          HD13      LEU   4  -5.561  -7.556 -20.167
    9   HD23  LEU   4          HD21      LEU   4  -7.679  -4.646 -19.890
   10   HD22  LEU   4          HD22      LEU   4  -6.641  -3.475 -20.700
   11   HD21  LEU   4          HD23      LEU   4  -6.218  -4.061 -19.092

  No H/Q in entry =          11
  In of MODEL   41
    1    H    GLU   5           H        GLU   5  -1.854  -5.027 -22.081
    2    HA   GLU   5           HA       GLU   5   0.123  -4.734 -20.040
    3    HB2  GLU   5           HB2      GLU   5   0.200  -6.510 -21.782
    4    HB3  GLU   5           HB3      GLU   5   0.506  -5.270 -22.999
    5    HG2  GLU   5           HG2      GLU   5   2.570  -4.615 -21.852
    6    HG3  GLU   5           HG3      GLU   5   2.262  -5.800 -20.583

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLU   6           H        GLU   6  -0.507  -3.029 -23.090
    2    HA   GLU   6           HA       GLU   6   1.659  -1.193 -22.821
    3    HB2  GLU   6           HB2      GLU   6  -0.900  -1.091 -24.432
    4    HB3  GLU   6           HB3      GLU   6   0.378   0.119 -24.548
    5    HG2  GLU   6           HG2      GLU   6   0.782  -2.849 -25.009
    6    HG3  GLU   6           HG3      GLU   6   0.562  -1.663 -26.294

  No H/Q in entry =           6
  In of MODEL   41
    1    H    VAL   7           H        VAL   7  -1.682  -1.268 -21.785
    2    HA   VAL   7           HA       VAL   7  -1.910   1.446 -20.956
    3    HB   VAL   7           HB       VAL   7  -3.371  -1.072 -20.118
    4   HG11  VAL   7          HG11      VAL   7  -3.753   1.818 -19.312
    5   HG13  VAL   7          HG12      VAL   7  -3.654   0.396 -18.273
    6   HG12  VAL   7          HG13      VAL   7  -5.084   0.661 -19.270
    7   HG21  VAL   7          HG21      VAL   7  -3.523  -0.002 -22.509
    8   HG23  VAL   7          HG22      VAL   7  -4.473   1.247 -21.703
    9   HG22  VAL   7          HG23      VAL   7  -5.015  -0.431 -21.674

  No H/Q in entry =           9
  In of MODEL   41
    1    H    VAL   8           H        VAL   8  -0.922  -1.533 -19.303
    2    HA   VAL   8           HA       VAL   8  -0.613  -0.447 -16.709
    3    HB   VAL   8           HB       VAL   8   0.793  -2.765 -18.058
    4   HG11  VAL   8          HG11      VAL   8   0.904  -1.677 -15.249
    5   HG13  VAL   8          HG12      VAL   8   2.231  -2.207 -16.281
    6   HG12  VAL   8          HG13      VAL   8   1.152  -3.396 -15.553
    7   HG21  VAL   8          HG21      VAL   8  -1.863  -2.541 -17.337
    8   HG23  VAL   8          HG22      VAL   8  -1.158  -3.197 -15.863
    9   HG22  VAL   8          HG23      VAL   8  -0.986  -4.070 -17.381

  No H/Q in entry =           9
  In of MODEL   41
    1    H    MET   9           H        MET   9   1.644  -0.751 -19.449
    2    HA   MET   9           HA       MET   9   3.925   0.299 -18.184
    3    HB2  MET   9           HB2      MET   9   3.024   0.501 -21.070
    4    HB3  MET   9           HB3      MET   9   4.624   0.970 -20.496
    5    HG2  MET   9           HG2      MET   9   4.580  -1.469 -19.437
    6    HG3  MET   9           HG3      MET   9   3.418  -1.758 -20.733
    7    HE2  MET   9           HE1      MET   9   5.267   0.898 -22.567
    8    HE1  MET   9           HE2      MET   9   3.872  -0.146 -22.827
    9    HE3  MET   9           HE3      MET   9   5.322  -0.363 -23.803

  No H/Q in entry =           9
  In of MODEL   41
    1    H    GLY  10           H        GLY  10   1.243   1.894 -19.873
    2    HA3  GLY  10           HA2      GLY  10   2.203   4.549 -19.632
    3    HA2  GLY  10           HA3      GLY  10   0.514   4.087 -19.840

  No H/Q in entry =           3
  In of MODEL   41
    1    H    LEU  11           H        LEU  11   0.111   2.564 -17.551
    2    HA   LEU  11           HA       LEU  11  -0.426   4.545 -15.598
    3    HB2  LEU  11           HB2      LEU  11  -0.357   1.530 -15.435
    4    HB3  LEU  11           HB3      LEU  11  -0.870   2.556 -14.096
    5    HG   LEU  11           HG       LEU  11  -2.102   2.662 -16.862
    6   HD13  LEU  11          HD11      LEU  11  -2.686   0.520 -16.104
    7   HD12  LEU  11          HD12      LEU  11  -4.038   1.512 -15.564
    8   HD11  LEU  11          HD13      LEU  11  -2.785   1.035 -14.419
    9   HD22  LEU  11          HD21      LEU  11  -2.697   4.680 -15.862
   10   HD21  LEU  11          HD22      LEU  11  -2.625   4.017 -14.229
   11   HD23  LEU  11          HD23      LEU  11  -3.998   3.648 -15.274

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  12           H        ILE  12   2.119   2.080 -15.828
    2    HA   ILE  12           HA       ILE  12   3.318   2.624 -13.323
    3    HB   ILE  12           HB       ILE  12   4.575   1.577 -15.882
    4   HG12  ILE  12          HG12      ILE  12   2.567   0.344 -14.740
    5   HG13  ILE  12          HG13      ILE  12   3.973  -0.591 -15.205
    6   HG21  ILE  12          HG21      ILE  12   5.553   1.567 -13.008
    7   HG23  ILE  12          HG22      ILE  12   6.339   2.307 -14.403
    8   HG22  ILE  12          HG23      ILE  12   6.241   0.552 -14.273
    9   HD13  ILE  12          HD11      ILE  12   4.781  -0.550 -12.911
   10   HD12  ILE  12          HD12      ILE  12   3.115  -1.126 -12.924
   11   HD11  ILE  12          HD13      ILE  12   3.472   0.518 -12.441

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  13           H        ILE  13   3.926   3.880 -16.582
    2    HA   ILE  13           HA       ILE  13   6.061   5.603 -15.856
    3    HB   ILE  13           HB       ILE  13   4.036   5.671 -18.107
    4   HG12  ILE  13          HG12      ILE  13   5.887   3.845 -17.818
    5   HG13  ILE  13          HG13      ILE  13   5.641   4.580 -19.398
    6   HG22  ILE  13          HG21      ILE  13   5.764   7.259 -19.182
    7   HG21  ILE  13          HG22      ILE  13   6.364   7.526 -17.549
    8   HG23  ILE  13          HG23      ILE  13   4.700   7.946 -17.953
    9   HD11  ILE  13          HD11      ILE  13   7.720   5.562 -17.408
   10   HD13  ILE  13          HD12      ILE  13   7.531   6.049 -19.089
   11   HD12  ILE  13          HD13      ILE  13   8.060   4.415 -18.702

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ASN  14           H        ASN  14   2.555   6.095 -16.133
    2    HA   ASN  14           HA       ASN  14   2.510   8.843 -15.502
    3    HB2  ASN  14           HB2      ASN  14   0.619   7.198 -16.333
    4    HB3  ASN  14           HB3      ASN  14   0.294   7.023 -14.613
    5   HD21  ASN  14          HD21      ASN  14  -1.723   8.175 -16.052
    6   HD22  ASN  14          HD22      ASN  14  -1.787   9.849 -15.789

  No H/Q in entry =           6
  In of MODEL   41
    1    H    SER  15           H        SER  15   2.212   5.971 -13.419
    2    HA   SER  15           HA       SER  15   1.899   7.346 -10.975
    3    HB2  SER  15           HB2      SER  15   2.444   5.263  -9.920
    4    HB3  SER  15           HB3      SER  15   1.623   4.840 -11.418
    5    HG   SER  15           HG       SER  15   3.376   3.894 -12.041

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLY  16           H        GLY  16   4.779   6.248 -12.725
    2    HA3  GLY  16           HA2      GLY  16   6.700   7.010 -10.792
    3    HA2  GLY  16           HA3      GLY  16   7.007   6.804 -12.515

  No H/Q in entry =           3
  In of MODEL   41
    1    H    GLN  17           H        GLN  17   5.317   8.758 -13.586
    2    HA   GLN  17           HA       GLN  17   6.891  11.102 -13.280
    3    HB2  GLN  17           HB2      GLN  17   5.600  10.647 -15.328
    4    HB3  GLN  17           HB3      GLN  17   4.096  10.799 -14.420
    5    HG2  GLN  17           HG2      GLN  17   4.615  13.133 -13.891
    6    HG3  GLN  17           HG3      GLN  17   6.162  12.996 -14.724
    7   HE21  GLN  17          HE21      GLN  17   4.204  14.914 -15.553
    8   HE22  GLN  17          HE22      GLN  17   3.630  14.459 -17.085

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ALA  18           H        ALA  18   3.789  10.083 -11.935
    2    HA   ALA  18           HA       ALA  18   3.058  12.473 -10.676
    3    HB1  ALA  18           HB1      ALA  18   1.933  10.014 -10.895
    4    HB2  ALA  18           HB2      ALA  18   1.380  11.236  -9.752
    5    HB3  ALA  18           HB3      ALA  18   2.471   9.957  -9.217

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ARG  19           H        ARG  19   4.934   9.716  -9.387
    2    HA   ARG  19           HA       ARG  19   5.459  10.881  -6.866
    3    HB2  ARG  19           HB2      ARG  19   5.879   8.478  -7.387
    4    HB3  ARG  19           HB3      ARG  19   7.236   8.964  -8.406
    5    HG2  ARG  19           HG2      ARG  19   8.349  10.011  -6.484
    6    HG3  ARG  19           HG3      ARG  19   6.972   9.622  -5.454
    7    HD2  ARG  19           HD2      ARG  19   8.737   7.991  -5.089
    8    HD3  ARG  19           HD3      ARG  19   7.366   7.205  -5.876
    9    HE   ARG  19           HE       ARG  19   9.073   8.022  -7.921
   10   HH21  ARG  19          HH11      ARG  19  10.638   6.618  -8.765
   11   HH22  ARG  19          HH12      ARG  19  11.184   5.274  -7.825
   12   HH11  ARG  19          HH21      ARG  19   9.143   5.998  -5.138
   13   HH12  ARG  19          HH22      ARG  19  10.335   4.922  -5.770

  No H/Q in entry =          13
  In of MODEL   41
    1    H    SER  20           H        SER  20   7.283  10.908  -9.911
    2    HA   SER  20           HA       SER  20   9.523  12.330  -9.086
    3    HB2  SER  20           HB2      SER  20   9.222  11.312 -11.349
    4    HB3  SER  20           HB3      SER  20   8.122  12.628 -11.751
    5    HG   SER  20           HG       SER  20  10.499  13.452 -10.665

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU  21           H        LEU  21   6.423  13.589 -10.293
    2    HA   LEU  21           HA       LEU  21   7.086  16.337 -10.074
    3    HB2  LEU  21           HB2      LEU  21   4.422  14.905  -9.998
    4    HB3  LEU  21           HB3      LEU  21   4.582  16.659 -10.002
    5    HG   LEU  21           HG       LEU  21   5.781  14.861 -12.131
    6   HD11  LEU  21          HD11      LEU  21   3.099  16.222 -11.921
    7   HD13  LEU  21          HD12      LEU  21   3.468  14.574 -12.435
    8   HD12  LEU  21          HD13      LEU  21   3.837  15.932 -13.497
    9   HD21  LEU  21          HD21      LEU  21   5.586  17.833 -11.694
   10   HD23  LEU  21          HD22      LEU  21   5.559  17.231 -13.348
   11   HD22  LEU  21          HD23      LEU  21   6.942  16.898 -12.318

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ALA  22           H        ALA  22   5.575  14.048  -7.823
    2    HA   ALA  22           HA       ALA  22   4.962  15.859  -5.762
    3    HB3  ALA  22           HB1      ALA  22   4.209  13.464  -5.921
    4    HB2  ALA  22           HB2      ALA  22   4.793  13.942  -4.326
    5    HB1  ALA  22           HB3      ALA  22   5.821  12.984  -5.393

  No H/Q in entry =           5
  In of MODEL   41
    1    H    TYR  23           H        TYR  23   7.904  13.842  -6.189
    2    HA   TYR  23           HA       TYR  23   9.278  14.871  -3.936
    3    HB2  TYR  23           HB2      TYR  23  10.075  12.864  -5.088
    4    HB3  TYR  23           HB3      TYR  23  10.389  13.800  -6.549
    5    HD1  TYR  23           HD1      TYR  23  11.342  13.479  -2.952
    6    HD2  TYR  23           HD2      TYR  23  12.423  14.972  -6.833
    7    HE1  TYR  23           HE1      TYR  23  13.596  14.065  -2.099
    8    HE2  TYR  23           HE2      TYR  23  14.676  15.559  -5.978
    9    HH   TYR  23           HH       TYR  23  15.443  15.928  -2.920

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ALA  24           H        ALA  24   9.099  15.970  -7.305
    2    HA   ALA  24           HA       ALA  24  10.986  18.063  -7.060
    3    HB2  ALA  24           HB1      ALA  24  10.548  18.118  -9.270
    4    HB3  ALA  24           HB2      ALA  24   8.989  18.862  -8.916
    5    HB1  ALA  24           HB3      ALA  24   9.121  17.109  -9.041

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA  25           H        ALA  25   7.506  17.865  -6.446
    2    HA   ALA  25           HA       ALA  25   7.013  20.583  -5.885
    3    HB1  ALA  25           HB1      ALA  25   5.361  18.576  -6.084
    4    HB2  ALA  25           HB2      ALA  25   4.985  19.866  -4.940
    5    HB3  ALA  25           HB3      ALA  25   5.681  18.350  -4.364

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU  26           H        LEU  26   8.089  17.913  -3.826
    2    HA   LEU  26           HA       LEU  26   8.183  19.351  -1.392
    3    HB2  LEU  26           HB2      LEU  26   8.289  16.935  -1.380
    4    HB3  LEU  26           HB3      LEU  26   9.761  16.947  -2.348
    5    HG   LEU  26           HG       LEU  26  10.967  18.075  -0.508
    6   HD12  LEU  26          HD11      LEU  26   9.736  18.083   1.749
    7   HD11  LEU  26          HD12      LEU  26   8.251  17.935   0.812
    8   HD13  LEU  26          HD13      LEU  26   9.289  19.346   0.601
    9   HD21  LEU  26          HD21      LEU  26   9.444  15.602   0.368
   10   HD23  LEU  26          HD22      LEU  26  10.955  16.174   1.067
   11   HD22  LEU  26          HD23      LEU  26  10.916  15.610  -0.602

  No H/Q in entry =          11
  In of MODEL   41
    1    H    LYS  27           H        LYS  27  10.607  18.784  -3.910
    2    HA   LYS  27           HA       LYS  27  12.782  20.039  -2.681
    3    HB2  LYS  27           HB2      LYS  27  12.895  18.687  -4.767
    4    HB3  LYS  27           HB3      LYS  27  12.125  20.013  -5.638
    5    HG2  LYS  27           HG2      LYS  27  13.981  21.510  -5.060
    6    HG3  LYS  27           HG3      LYS  27  14.747  20.224  -4.119
    7    HD2  LYS  27           HD2      LYS  27  14.901  18.832  -6.169
    8    HD3  LYS  27           HD3      LYS  27  14.181  20.144  -7.102
    9    HE2  LYS  27           HE2      LYS  27  16.060  21.621  -6.489
   10    HE3  LYS  27           HE3      LYS  27  16.784  20.314  -5.547
   11    HZ3  LYS  27           HZ1      LYS  27  17.778  20.413  -7.732
   12    HZ2  LYS  27           HZ2      LYS  27  16.253  20.284  -8.475
   13    HZ1  LYS  27           HZ3      LYS  27  16.882  18.980  -7.586

  No H/Q in entry =          13
  In of MODEL   41
    1    H    GLN  28           H        GLN  28  10.156  21.401  -4.639
    2    HA   GLN  28           HA       GLN  28  11.101  24.059  -4.797
    3    HB2  GLN  28           HB2      GLN  28   8.273  22.974  -4.687
    4    HB3  GLN  28           HB3      GLN  28   8.679  24.646  -5.068
    5    HG2  GLN  28           HG2      GLN  28   9.689  22.233  -6.601
    6    HG3  GLN  28           HG3      GLN  28   8.350  23.261  -7.113
    7   HE21  GLN  28          HE21      GLN  28  11.465  22.774  -7.881
    8   HE22  GLN  28          HE22      GLN  28  11.958  24.359  -8.236

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ALA  29           H        ALA  29   9.174  22.362  -2.360
    2    HA   ALA  29           HA       ALA  29   8.609  24.555  -0.685
    3    HB2  ALA  29           HB1      ALA  29   7.886  22.986   0.886
    4    HB1  ALA  29           HB2      ALA  29   9.115  21.808   0.426
    5    HB3  ALA  29           HB3      ALA  29   7.729  22.091  -0.625

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LYS  30           H        LYS  30  11.353  22.304  -0.743
    2    HA   LYS  30           HA       LYS  30  12.660  23.272   1.560
    3    HB2  LYS  30           HB2      LYS  30  13.769  21.985  -0.945
    4    HB3  LYS  30           HB3      LYS  30  14.747  22.354   0.477
    5    HG2  LYS  30           HG2      LYS  30  13.199  20.966   1.858
    6    HG3  LYS  30           HG3      LYS  30  12.319  20.535   0.387
    7    HD2  LYS  30           HD2      LYS  30  14.372  19.558  -0.567
    8    HD3  LYS  30           HD3      LYS  30  15.271  20.003   0.885
    9    HE2  LYS  30           HE2      LYS  30  13.772  18.566   2.241
   10    HE3  LYS  30           HE3      LYS  30  12.903  18.102   0.772
   11    HZ2  LYS  30           HZ1      LYS  30  14.703  16.536   1.541
   12    HZ1  LYS  30           HZ2      LYS  30  15.834  17.729   1.088
   13    HZ3  LYS  30           HZ3      LYS  30  14.804  17.036  -0.077

  No H/Q in entry =          13
  In of MODEL   41
    1    H    GLN  31           H        GLN  31  12.550  24.467  -1.740
    2    HA   GLN  31           HA       GLN  31  14.691  26.374  -1.320
    3    HB2  GLN  31           HB2      GLN  31  12.652  26.403  -3.548
    4    HB3  GLN  31           HB3      GLN  31  14.268  27.108  -3.548
    5    HG2  GLN  31           HG2      GLN  31  14.745  24.417  -2.965
    6    HG3  GLN  31           HG3      GLN  31  13.444  24.352  -4.146
    7   HE21  GLN  31          HE21      GLN  31  16.293  23.575  -4.542
    8   HE22  GLN  31          HE22      GLN  31  16.861  24.548  -5.810

  No H/Q in entry =           8
  In of MODEL   41
    1    H    GLY  32           H        GLY  32  11.615  26.176  -0.180
    2    HA3  GLY  32           HA2      GLY  32  10.447  27.741   1.087
    3    HA2  GLY  32           HA3      GLY  32  11.566  28.981   0.536

  No H/Q in entry =           3
  In of MODEL   41
    1    H    ASP  33           H        ASP  33  10.218  27.063  -1.954
    2    HA   ASP  33           HA       ASP  33   8.541  29.323  -2.819
    3    HB2  ASP  33           HB2      ASP  33   9.652  26.907  -4.252
    4    HB3  ASP  33           HB3      ASP  33   8.496  28.013  -4.988

  No H/Q in entry =           4
  In of MODEL   41
    1    H    PHE  34           H        PHE  34   6.853  28.841  -1.257
    2    HA   PHE  34           HA       PHE  34   5.488  26.361  -1.157
    3    HB2  PHE  34           HB2      PHE  34   4.509  29.144  -0.487
    4    HB3  PHE  34           HB3      PHE  34   3.669  27.649  -0.073
    5    HD1  PHE  34           HD1      PHE  34   5.901  30.064   1.139
    6    HD2  PHE  34           HD2      PHE  34   5.248  25.819   1.096
    7    HE1  PHE  34           HE1      PHE  34   7.290  29.828   3.179
    8    HE2  PHE  34           HE2      PHE  34   6.638  25.587   3.134
    9    HZ   PHE  34           HZ       PHE  34   7.653  27.592   4.175

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ALA  35           H        ALA  35   5.044  29.216  -3.176
    2    HA   ALA  35           HA       ALA  35   2.499  28.584  -4.205
    3    HB3  ALA  35           HB1      ALA  35   3.546  29.977  -6.244
    4    HB2  ALA  35           HB2      ALA  35   4.759  30.349  -5.019
    5    HB1  ALA  35           HB3      ALA  35   3.065  30.749  -4.732

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA  36           H        ALA  36   5.734  27.927  -5.551
    2    HA   ALA  36           HA       ALA  36   4.758  26.486  -7.793
    3    HB3  ALA  36           HB1      ALA  36   6.918  26.622  -8.405
    4    HB2  ALA  36           HB2      ALA  36   7.403  25.600  -7.051
    5    HB1  ALA  36           HB3      ALA  36   7.286  27.348  -6.840

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA  37           H        ALA  37   5.714  25.506  -4.534
    2    HA   ALA  37           HA       ALA  37   5.674  22.716  -4.955
    3    HB2  ALA  37           HB1      ALA  37   5.397  24.512  -2.582
    4    HB1  ALA  37           HB2      ALA  37   6.539  23.201  -2.869
    5    HB3  ALA  37           HB3      ALA  37   4.879  22.838  -2.400

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LYS  38           H        LYS  38   3.125  24.912  -3.798
    2    HA   LYS  38           HA       LYS  38   1.037  23.086  -3.574
    3    HB2  LYS  38           HB2      LYS  38   1.370  25.845  -3.330
    4    HB3  LYS  38           HB3      LYS  38   0.174  25.687  -4.611
    5    HG2  LYS  38           HG2      LYS  38  -1.270  24.358  -3.167
    6    HG3  LYS  38           HG3      LYS  38  -0.027  24.309  -1.909
    7    HD2  LYS  38           HD2      LYS  38  -0.229  26.646  -1.468
    8    HD3  LYS  38           HD3      LYS  38  -1.140  26.925  -2.952
    9    HE2  LYS  38           HE2      LYS  38  -2.647  26.954  -1.016
   10    HE3  LYS  38           HE3      LYS  38  -3.010  25.573  -2.055
   11    HZ3  LYS  38           HZ1      LYS  38  -2.278  24.111  -0.517
   12    HZ2  LYS  38           HZ2      LYS  38  -2.639  25.369   0.569
   13    HZ1  LYS  38           HZ3      LYS  38  -1.042  25.127   0.047

  No H/Q in entry =          13
  In of MODEL   41
    1    H    ALA  39           H        ALA  39   2.009  24.987  -6.426
    2    HA   ALA  39           HA       ALA  39  -0.058  24.102  -8.131
    3    HB2  ALA  39           HB1      ALA  39   2.677  24.765  -9.181
    4    HB1  ALA  39           HB2      ALA  39   1.701  26.022  -8.421
    5    HB3  ALA  39           HB3      ALA  39   1.096  25.177  -9.846

  No H/Q in entry =           5
  In of MODEL   41
    1    H    MET  40           H        MET  40   3.188  22.825  -7.542
    2    HA   MET  40           HA       MET  40   3.106  20.799  -9.528
    3    HB2  MET  40           HB2      MET  40   4.712  21.040  -6.977
    4    HB3  MET  40           HB3      MET  40   4.973  19.782  -8.188
    5    HG2  MET  40           HG2      MET  40   5.012  22.737  -8.861
    6    HG3  MET  40           HG3      MET  40   6.464  21.845  -8.407
    7    HE3  MET  40           HE1      MET  40   7.355  19.628 -11.208
    8    HE2  MET  40           HE2      MET  40   6.791  19.309  -9.570
    9    HE1  MET  40           HE3      MET  40   7.878  20.663  -9.872

  No H/Q in entry =           9
  In of MODEL   41
    1    H    MET  41           H        MET  41   2.185  20.845  -6.106
    2    HA   MET  41           HA       MET  41   1.670  18.077  -5.822
    3    HB2  MET  41           HB2      MET  41   0.319  20.430  -4.480
    4    HB3  MET  41           HB3      MET  41   0.174  18.752  -3.967
    5    HG2  MET  41           HG2      MET  41   2.883  18.993  -4.000
    6    HG3  MET  41           HG3      MET  41   2.430  20.649  -3.610
    7    HE2  MET  41           HE1      MET  41  -0.604  19.381  -1.887
    8    HE1  MET  41           HE2      MET  41   0.203  20.898  -2.266
    9    HE3  MET  41           HE3      MET  41   0.145  20.332  -0.597

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ASP  42           H        ASP  42  -0.385  20.786  -6.807
    2    HA   ASP  42           HA       ASP  42  -2.816  19.408  -6.945
    3    HB2  ASP  42           HB2      ASP  42  -2.126  21.983  -7.206
    4    HB3  ASP  42           HB3      ASP  42  -2.271  21.582  -8.914

  No H/Q in entry =           4
  In of MODEL   41
    1    H    GLN  43           H        GLN  43  -0.375  20.009  -9.444
    2    HA   GLN  43           HA       GLN  43  -1.749  18.675 -11.532
    3    HB2  GLN  43           HB2      GLN  43   1.205  19.212 -11.146
    4    HB3  GLN  43           HB3      GLN  43   0.499  18.564 -12.628
    5    HG2  GLN  43           HG2      GLN  43  -1.027  20.580 -12.677
    6    HG3  GLN  43           HG3      GLN  43  -0.081  21.246 -11.350
    7   HE21  GLN  43          HE21      GLN  43   0.074  22.862 -13.440
    8   HE22  GLN  43          HE22      GLN  43   1.492  22.648 -14.344

  No H/Q in entry =           8
  In of MODEL   41
    1    H    SER  44           H        SER  44   0.605  17.557  -9.134
    2    HA   SER  44           HA       SER  44   0.960  14.950 -10.151
    3    HB2  SER  44           HB2      SER  44   1.841  16.401  -7.917
    4    HB3  SER  44           HB3      SER  44   0.987  15.013  -7.244
    5    HG   SER  44           HG       SER  44   3.103  14.407  -7.665

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ARG  45           H        ARG  45  -1.373  16.258  -7.821
    2    HA   ARG  45           HA       ARG  45  -2.744  13.889  -7.183
    3    HB2  ARG  45           HB2      ARG  45  -2.960  16.059  -5.997
    4    HB3  ARG  45           HB3      ARG  45  -3.818  16.716  -7.387
    5    HG2  ARG  45           HG2      ARG  45  -5.573  14.979  -7.103
    6    HG3  ARG  45           HG3      ARG  45  -4.727  14.376  -5.677
    7    HD2  ARG  45           HD2      ARG  45  -4.951  16.644  -4.627
    8    HD3  ARG  45           HD3      ARG  45  -5.940  17.154  -6.013
    9    HE   ARG  45           HE       ARG  45  -7.034  14.772  -4.968
   10   HH21  ARG  45          HH11      ARG  45  -8.873  14.838  -3.701
   11   HH22  ARG  45          HH12      ARG  45  -9.280  16.277  -2.837
   12   HH11  ARG  45          HH21      ARG  45  -6.514  18.025  -3.952
   13   HH12  ARG  45          HH22      ARG  45  -7.939  18.082  -2.977

  No H/Q in entry =          13
  In of MODEL   41
    1    H    MET  46           H        MET  46  -3.341  16.283  -9.741
    2    HA   MET  46           HA       MET  46  -5.669  15.090 -10.804
    3    HB2  MET  46           HB2      MET  46  -3.577  16.923 -11.990
    4    HB3  MET  46           HB3      MET  46  -4.966  16.363 -12.926
    5    HG2  MET  46           HG2      MET  46  -6.491  17.278 -11.222
    6    HG3  MET  46           HG3      MET  46  -5.115  17.830 -10.273
    7    HE2  MET  46           HE1      MET  46  -6.072  21.287 -11.342
    8    HE1  MET  46           HE2      MET  46  -5.804  20.099 -10.070
    9    HE3  MET  46           HE3      MET  46  -7.287  20.043 -11.021

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ALA  47           H        ALA  47  -2.236  14.635 -11.554
    2    HA   ALA  47           HA       ALA  47  -2.563  12.899 -13.760
    3    HB3  ALA  47           HB1      ALA  47  -0.393  13.806 -13.407
    4    HB2  ALA  47           HB2      ALA  47  -0.240  12.080 -13.068
    5    HB1  ALA  47           HB3      ALA  47  -0.344  13.234 -11.738

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU  48           H        LEU  48  -2.296  12.275 -10.284
    2    HA   LEU  48           HA       LEU  48  -2.368   9.434 -10.435
    3    HB2  LEU  48           HB2      LEU  48  -3.151  11.351  -8.228
    4    HB3  LEU  48           HB3      LEU  48  -3.044   9.602  -8.023
    5    HG   LEU  48           HG       LEU  48  -0.756  11.317  -9.020
    6   HD13  LEU  48          HD11      LEU  48  -1.049  12.091  -6.832
    7   HD12  LEU  48          HD12      LEU  48   0.123  10.793  -6.627
    8   HD11  LEU  48          HD13      LEU  48  -1.573  10.518  -6.232
    9   HD22  LEU  48          HD21      LEU  48  -0.239   9.133  -9.654
   10   HD21  LEU  48          HD22      LEU  48  -1.106   8.415  -8.297
   11   HD23  LEU  48          HD23      LEU  48   0.460   9.181  -8.036

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ASN  49           H        ASN  49  -4.851  11.908 -10.045
    2    HA   ASN  49           HA       ASN  49  -7.025  10.228  -9.506
    3    HB2  ASN  49           HB2      ASN  49  -7.119  12.641  -9.181
    4    HB3  ASN  49           HB3      ASN  49  -6.924  12.914 -10.907
    5   HD21  ASN  49          HD21      ASN  49  -9.147  11.377  -8.556
    6   HD22  ASN  49          HD22      ASN  49 -10.543  11.620  -9.488

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLU  50           H        GLU  50  -5.748  11.426 -12.594
    2    HA   GLU  50           HA       GLU  50  -7.690  10.151 -14.240
    3    HB2  GLU  50           HB2      GLU  50  -6.236  11.979 -15.056
    4    HB3  GLU  50           HB3      GLU  50  -4.834  10.918 -14.912
    5    HG2  GLU  50           HG2      GLU  50  -5.792   9.371 -16.547
    6    HG3  GLU  50           HG3      GLU  50  -7.260  10.338 -16.640

  No H/Q in entry =           6
  In of MODEL   41
    1    H    ALA  51           H        ALA  51  -4.514   9.187 -13.025
    2    HA   ALA  51           HA       ALA  51  -4.352   6.731 -14.436
    3    HB2  ALA  51           HB1      ALA  51  -2.372   6.462 -13.331
    4    HB1  ALA  51           HB2      ALA  51  -3.066   6.883 -11.766
    5    HB3  ALA  51           HB3      ALA  51  -2.618   8.154 -12.903

  No H/Q in entry =           5
  In of MODEL   41
    1    H    HIS  52           H        HIS  52  -5.539   7.563 -11.192
    2    HA   HIS  52           HA       HIS  52  -6.206   4.950 -10.355
    3    HB2  HIS  52           HB2      HIS  52  -6.085   6.931  -8.859
    4    HB3  HIS  52           HB3      HIS  52  -7.561   7.548  -9.600
    5    HD1  HIS  52           HD1      HIS  52  -9.771   6.186  -9.174
    6    HD2  HIS  52           HD2      HIS  52  -6.471   4.821  -7.025
    7    HE1  HIS  52           HE1      HIS  52 -10.671   4.629  -7.391
    8    HE2  HIS  52           HE2      HIS  52  -8.671   3.789  -6.072

  No H/Q in entry =           8
  In of MODEL   41
    1    H    LEU  53           H        LEU  53  -8.040   7.389 -12.154
    2    HA   LEU  53           HA       LEU  53 -10.536   6.078 -12.169
    3    HB2  LEU  53           HB2      LEU  53  -9.263   8.063 -14.042
    4    HB3  LEU  53           HB3      LEU  53 -10.858   7.386 -14.363
    5    HG   LEU  53           HG       LEU  53 -10.159   8.706 -11.722
    6   HD12  LEU  53          HD11      LEU  53 -11.322  10.712 -12.615
    7   HD11  LEU  53          HD12      LEU  53 -11.423   9.930 -14.193
    8   HD13  LEU  53          HD13      LEU  53  -9.854  10.353 -13.514
    9   HD21  LEU  53          HD21      LEU  53 -12.716   7.847 -13.092
   10   HD23  LEU  53          HD22      LEU  53 -12.729   9.094 -11.851
   11   HD22  LEU  53          HD23      LEU  53 -12.186   7.473 -11.457

  No H/Q in entry =          11
  In of MODEL   41
    1    H    VAL  54           H        VAL  54  -7.779   5.895 -14.399
    2    HA   VAL  54           HA       VAL  54  -8.985   4.111 -16.240
    3    HB   VAL  54           HB       VAL  54  -6.082   4.640 -15.552
    4   HG12  VAL  54          HG11      VAL  54  -5.822   3.550 -17.938
    5   HG11  VAL  54          HG12      VAL  54  -7.345   2.759 -17.536
    6   HG13  VAL  54          HG13      VAL  54  -5.931   2.518 -16.513
    7   HG22  VAL  54          HG21      VAL  54  -6.863   6.575 -16.604
    8   HG21  VAL  54          HG22      VAL  54  -8.048   5.700 -17.573
    9   HG23  VAL  54          HG23      VAL  54  -6.340   5.631 -17.999

  No H/Q in entry =           9
  In of MODEL   41
    1    H    GLN  55           H        GLN  55  -6.989   3.586 -13.334
    2    HA   GLN  55           HA       GLN  55  -6.879   0.770 -13.583
    3    HB2  GLN  55           HB2      GLN  55  -5.333   1.681 -12.062
    4    HB3  GLN  55           HB3      GLN  55  -6.558   2.640 -11.238
    5    HG2  GLN  55           HG2      GLN  55  -7.238   0.882  -9.917
    6    HG3  GLN  55           HG3      GLN  55  -7.002  -0.307 -11.192
    7   HE21  GLN  55          HE21      GLN  55  -5.369  -1.744 -10.690
    8   HE22  GLN  55          HE22      GLN  55  -3.990  -1.380  -9.775

  No H/Q in entry =           8
  In of MODEL   41
    1    H    THR  56           H        THR  56  -9.229   2.921 -11.980
    2    HA   THR  56           HA       THR  56 -10.803   1.030 -10.689
    3    HB   THR  56           HB       THR  56 -11.915   3.404 -12.205
    4    HG1  THR  56           HG1      THR  56 -10.540   3.219  -9.745
    5   HG22  THR  56          HG21      THR  56 -12.785   2.249  -9.556
    6   HG21  THR  56          HG22      THR  56 -13.437   1.668 -11.088
    7   HG23  THR  56          HG23      THR  56 -13.673   3.349 -10.609

  No H/Q in entry =           7
  In of MODEL   41
    1    H    LYS  57           H        LYS  57 -11.004   2.102 -14.079
    2    HA   LYS  57           HA       LYS  57 -13.147   0.398 -14.833
    3    HB2  LYS  57           HB2      LYS  57 -12.273   2.354 -16.151
    4    HB3  LYS  57           HB3      LYS  57 -10.834   1.414 -16.519
    5    HG2  LYS  57           HG2      LYS  57 -12.216  -0.279 -17.654
    6    HG3  LYS  57           HG3      LYS  57 -13.667   0.645 -17.280
    7    HD2  LYS  57           HD2      LYS  57 -11.375   1.857 -18.833
    8    HD3  LYS  57           HD3      LYS  57 -12.661   0.959 -19.635
    9    HE2  LYS  57           HE2      LYS  57 -14.322   2.503 -18.487
   10    HE3  LYS  57           HE3      LYS  57 -12.955   3.486 -17.967
   11    HZ1  LYS  57           HZ1      LYS  57 -12.432   3.207 -20.565
   12    HZ3  LYS  57           HZ2      LYS  57 -13.307   4.508 -19.908
   13    HZ2  LYS  57           HZ3      LYS  57 -14.128   3.189 -20.597

  No H/Q in entry =          13
  In of MODEL   41
    1    H    LEU  58           H        LEU  58  -9.640  -0.009 -14.766
    2    HA   LEU  58           HA       LEU  58  -9.627  -2.530 -16.047
    3    HB2  LEU  58           HB2      LEU  58  -7.607  -1.219 -14.237
    4    HB3  LEU  58           HB3      LEU  58  -7.333  -2.741 -15.086
    5    HG   LEU  58           HG       LEU  58  -8.101  -0.146 -16.459
    6   HD11  LEU  58          HD11      LEU  58  -5.448  -1.363 -15.758
    7   HD13  LEU  58          HD12      LEU  58  -5.955   0.325 -15.715
    8   HD12  LEU  58          HD13      LEU  58  -5.606  -0.448 -17.258
    9   HD22  LEU  58          HD21      LEU  58  -8.662  -1.716 -18.047
   10   HD21  LEU  58          HD22      LEU  58  -7.614  -2.955 -17.359
   11   HD23  LEU  58          HD23      LEU  58  -6.929  -1.680 -18.366

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  59           H        ILE  59 -10.464  -1.623 -12.801
    2    HA   ILE  59           HA       ILE  59 -10.096  -4.385 -11.844
    3    HB   ILE  59           HB       ILE  59  -9.666  -2.117 -10.449
    4   HG12  ILE  59          HG12      ILE  59 -11.044  -4.461  -9.122
    5   HG13  ILE  59          HG13      ILE  59  -9.399  -4.545  -9.699
    6   HG21  ILE  59          HG21      ILE  59 -12.209  -1.615 -10.723
    7   HG23  ILE  59          HG22      ILE  59 -11.495  -1.408  -9.141
    8   HG22  ILE  59          HG23      ILE  59 -12.435  -2.852  -9.509
    9   HD11  ILE  59          HD11      ILE  59  -8.827  -2.572  -8.308
   10   HD13  ILE  59          HD12      ILE  59  -9.368  -3.940  -7.345
   11   HD12  ILE  59          HD13      ILE  59 -10.463  -2.592  -7.659

  No H/Q in entry =          11
  In of MODEL   41
    1    H    GLU  60           H        GLU  60 -12.668  -2.090 -12.666
    2    HA   GLU  60           HA       GLU  60 -14.845  -3.618 -11.655
    3    HB2  GLU  60           HB2      GLU  60 -15.077  -1.252 -12.255
    4    HB3  GLU  60           HB3      GLU  60 -14.740  -1.630 -13.942
    5    HG2  GLU  60           HG2      GLU  60 -16.762  -3.083 -13.993
    6    HG3  GLU  60           HG3      GLU  60 -17.119  -2.609 -12.346

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLY  61           H        GLY  61 -13.163  -3.601 -14.765
    2    HA3  GLY  61           HA2      GLY  61 -14.857  -5.860 -15.653
    3    HA2  GLY  61           HA3      GLY  61 -14.017  -4.753 -16.732

  No H/Q in entry =           3
  In of MODEL   41
    1    H    ASP  62           H        ASP  62 -12.641  -6.183 -13.839
    2    HA   ASP  62           HA       ASP  62 -10.340  -7.099 -15.247
    3    HB2  ASP  62           HB2      ASP  62 -10.303  -6.329 -12.899
    4    HB3  ASP  62           HB3      ASP  62 -11.289  -7.713 -12.438

  No H/Q in entry =           4
  In of MODEL   41
    1    H    ALA  63           H        ALA  63 -12.315  -8.349 -16.650
    2    HA   ALA  63           HA       ALA  63 -13.063 -10.949 -15.752
    3    HB2  ALA  63           HB1      ALA  63 -12.639  -9.901 -18.577
    4    HB3  ALA  63           HB2      ALA  63 -14.144  -9.793 -17.665
    5    HB1  ALA  63           HB3      ALA  63 -13.519 -11.370 -18.156

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLY  64           H        GLY  64 -10.291  -9.693 -17.509
    2    HA3  GLY  64           HA2      GLY  64  -8.271 -10.595 -18.097
    3    HA2  GLY  64           HA3      GLY  64  -8.464 -11.641 -16.695

  No H/Q in entry =           3
  In of MODEL   41
    1    H    GLU  65           H        GLU  65  -7.914 -13.636 -17.417
    2    HA   GLU  65           HA       GLU  65  -8.355 -14.538 -20.057
    3    HB2  GLU  65           HB2      GLU  65  -7.781 -16.101 -17.537
    4    HB3  GLU  65           HB3      GLU  65  -7.741 -16.773 -19.168
    5    HG2  GLU  65           HG2      GLU  65  -6.074 -14.418 -18.238
    6    HG3  GLU  65           HG3      GLU  65  -5.486 -16.074 -18.364

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLY  66           H        GLY  66 -10.197 -14.855 -17.139
    2    HA3  GLY  66           HA2      GLY  66 -12.602 -15.541 -18.546
    3    HA2  GLY  66           HA3      GLY  66 -11.982 -16.857 -17.567

  No H/Q in entry =           3
  In of MODEL   41
    1    H    LYS  67           H        LYS  67 -14.432 -16.021 -17.028
    2    HA   LYS  67           HA       LYS  67 -15.014 -13.907 -15.446
    3    HB2  LYS  67           HB2      LYS  67 -16.587 -15.684 -14.250
    4    HB3  LYS  67           HB3      LYS  67 -16.859 -15.166 -15.919
    5    HG2  LYS  67           HG2      LYS  67 -15.668 -17.083 -16.785
    6    HG3  LYS  67           HG3      LYS  67 -15.147 -17.550 -15.167
    7    HD2  LYS  67           HD2      LYS  67 -17.534 -17.909 -14.539
    8    HD3  LYS  67           HD3      LYS  67 -17.995 -17.543 -16.203
    9    HE2  LYS  67           HE2      LYS  67 -16.054 -19.741 -15.431
   10    HE3  LYS  67           HE3      LYS  67 -17.769 -20.007 -15.744
   11    HZ2  LYS  67           HZ1      LYS  67 -15.684 -19.088 -17.628
   12    HZ1  LYS  67           HZ2      LYS  67 -17.336 -18.869 -17.948
   13    HZ3  LYS  67           HZ3      LYS  67 -16.704 -20.435 -17.762

  No H/Q in entry =          13
  In of MODEL   41
    1    H    MET  68           H        MET  68 -13.906 -17.006 -14.186
    2    HA   MET  68           HA       MET  68 -13.737 -16.262 -11.471
    3    HB2  MET  68           HB2      MET  68 -12.575 -18.509 -13.091
    4    HB3  MET  68           HB3      MET  68 -12.246 -18.344 -11.366
    5    HG2  MET  68           HG2      MET  68 -15.031 -18.417 -12.559
    6    HG3  MET  68           HG3      MET  68 -14.211 -19.822 -11.872
    7    HE3  MET  68           HE1      MET  68 -16.730 -16.838  -9.807
    8    HE2  MET  68           HE2      MET  68 -17.007 -17.977 -11.123
    9    HE1  MET  68           HE3      MET  68 -16.008 -16.551 -11.397

  No H/Q in entry =           9
  In of MODEL   41
    1    H    LYS  69           H        LYS  69 -11.202 -16.318 -14.001
    2    HA   LYS  69           HA       LYS  69  -9.180 -15.531 -12.092
    3    HB2  LYS  69           HB2      LYS  69  -8.933 -17.081 -14.163
    4    HB3  LYS  69           HB3      LYS  69  -8.711 -15.571 -15.050
    5    HG2  LYS  69           HG2      LYS  69  -6.870 -14.931 -13.577
    6    HG3  LYS  69           HG3      LYS  69  -7.132 -16.363 -12.584
    7    HD2  LYS  69           HD2      LYS  69  -6.533 -16.583 -15.535
    8    HD3  LYS  69           HD3      LYS  69  -5.244 -16.482 -14.335
    9    HE2  LYS  69           HE2      LYS  69  -6.401 -18.417 -13.129
   10    HE3  LYS  69           HE3      LYS  69  -7.382 -18.607 -14.581
   11    HZ1  LYS  69           HZ1      LYS  69  -4.434 -18.514 -14.730
   12    HZ3  LYS  69           HZ2      LYS  69  -5.537 -19.152 -15.853
   13    HZ2  LYS  69           HZ3      LYS  69  -5.245 -19.963 -14.388

  No H/Q in entry =          13
  In of MODEL   41
    1    H    VAL  70           H        VAL  70  -7.614 -13.747 -12.515
    2    HA   VAL  70           HA       VAL  70  -8.914 -11.325 -13.624
    3    HB   VAL  70           HB       VAL  70  -7.635 -10.149 -11.701
    4   HG13  VAL  70          HG11      VAL  70  -9.573 -10.378 -10.248
    5   HG12  VAL  70          HG12      VAL  70 -10.007 -11.909 -11.013
    6   HG11  VAL  70          HG13      VAL  70 -10.125 -10.403 -11.923
    7   HG21  VAL  70          HG21      VAL  70  -6.455 -12.405 -11.138
    8   HG23  VAL  70          HG22      VAL  70  -7.974 -12.834 -10.355
    9   HG22  VAL  70          HG23      VAL  70  -7.054 -11.442  -9.787

  No H/Q in entry =           9
  In of MODEL   41
    1    H    SER  71           H        SER  71  -7.418  -9.671 -14.283
    2    HA   SER  71           HA       SER  71  -5.160 -10.642 -15.727
    3    HB2  SER  71           HB2      SER  71  -6.517  -8.625 -16.365
    4    HB3  SER  71           HB3      SER  71  -5.812  -7.778 -14.991
    5    HG   SER  71           HG       SER  71  -4.570  -8.770 -17.323

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU  72           H        LEU  72  -3.154 -10.964 -15.047
    2    HA   LEU  72           HA       LEU  72  -2.443 -10.735 -12.334
    3    HB2  LEU  72           HB2      LEU  72  -0.779 -11.163 -14.811
    4    HB3  LEU  72           HB3      LEU  72  -0.122 -11.225 -13.179
    5    HG   LEU  72           HG       LEU  72  -2.461 -12.935 -14.082
    6   HD11  LEU  72          HD11      LEU  72   0.488 -13.638 -13.929
    7   HD13  LEU  72          HD12      LEU  72  -0.454 -13.474 -15.411
    8   HD12  LEU  72          HD13      LEU  72  -0.821 -14.771 -14.272
    9   HD23  LEU  72          HD21      LEU  72  -1.474 -14.333 -12.103
   10   HD22  LEU  72          HD22      LEU  72  -2.447 -12.926 -11.707
   11   HD21  LEU  72          HD23      LEU  72  -0.691 -12.829 -11.636

  No H/Q in entry =          11
  In of MODEL   41
    1    H    VAL  73           H        VAL  73  -1.731  -8.725 -15.120
    2    HA   VAL  73           HA       VAL  73   0.176  -7.010 -14.017
    3    HB   VAL  73           HB       VAL  73  -0.217  -5.603 -15.880
    4   HG11  VAL  73          HG11      VAL  73   0.480  -8.102 -16.227
    5   HG13  VAL  73          HG12      VAL  73   0.048  -7.132 -17.634
    6   HG12  VAL  73          HG13      VAL  73  -1.118  -8.265 -16.953
    7   HG22  VAL  73          HG21      VAL  73  -2.480  -5.079 -15.934
    8   HG21  VAL  73          HG22      VAL  73  -2.978  -6.753 -15.704
    9   HG23  VAL  73          HG23      VAL  73  -2.389  -6.217 -17.278

  No H/Q in entry =           9
  In of MODEL   41
    1    H    LEU  74           H        LEU  74  -3.222  -7.145 -13.468
    2    HA   LEU  74           HA       LEU  74  -3.858  -4.490 -12.867
    3    HB2  LEU  74           HB2      LEU  74  -5.575  -6.170 -13.041
    4    HB3  LEU  74           HB3      LEU  74  -4.884  -7.081 -11.701
    5    HG   LEU  74           HG       LEU  74  -5.343  -5.154 -10.189
    6   HD12  LEU  74          HD11      LEU  74  -7.029  -3.471 -11.176
    7   HD11  LEU  74          HD12      LEU  74  -6.468  -4.020 -12.754
    8   HD13  LEU  74          HD13      LEU  74  -5.337  -3.265 -11.629
    9   HD23  LEU  74          HD21      LEU  74  -7.881  -5.803 -11.627
   10   HD22  LEU  74          HD22      LEU  74  -7.545  -5.732  -9.911
   11   HD21  LEU  74          HD23      LEU  74  -6.969  -7.090 -10.846

  No H/Q in entry =          11
  In of MODEL   41
    1    H    VAL  75           H        VAL  75  -2.808  -7.063 -10.693
    2    HA   VAL  75           HA       VAL  75  -2.626  -5.502  -8.354
    3    HB   VAL  75           HB       VAL  75  -1.113  -7.992  -9.132
    4   HG11  VAL  75          HG11      VAL  75  -1.338  -6.523  -6.467
    5   HG13  VAL  75          HG12      VAL  75   0.127  -6.754  -7.409
    6   HG12  VAL  75          HG13      VAL  75  -0.661  -8.136  -6.667
    7   HG21  VAL  75          HG21      VAL  75  -3.686  -7.956  -8.867
    8   HG23  VAL  75          HG22      VAL  75  -3.383  -7.639  -7.159
    9   HG22  VAL  75          HG23      VAL  75  -2.803  -9.134  -7.895

  No H/Q in entry =           9
  In of MODEL   41
    1    H    GLU  76           H        GLU  76  -0.205  -6.257 -10.881
    2    HA   GLU  76           HA       GLU  76   1.969  -4.893  -9.722
    3    HB2  GLU  76           HB2      GLU  76   2.182  -6.376 -11.701
    4    HB3  GLU  76           HB3      GLU  76   1.274  -5.220 -12.663
    5    HG2  GLU  76           HG2      GLU  76   3.608  -4.875 -13.151
    6    HG3  GLU  76           HG3      GLU  76   3.090  -3.509 -12.181

  No H/Q in entry =           6
  In of MODEL   41
    1    H    ALA  77           H        ALA  77  -0.563  -3.714 -11.922
    2    HA   ALA  77           HA       ALA  77   0.412  -1.063 -12.104
    3    HB1  ALA  77           HB1      ALA  77  -1.245  -1.954 -13.676
    4    HB2  ALA  77           HB2      ALA  77  -1.872  -0.509 -12.883
    5    HB3  ALA  77           HB3      ALA  77  -2.423  -2.103 -12.372

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLN  78           H        GLN  78  -1.854  -2.625  -9.895
    2    HA   GLN  78           HA       GLN  78  -2.680  -0.306  -8.504
    3    HB2  GLN  78           HB2      GLN  78  -3.772  -2.577  -8.417
    4    HB3  GLN  78           HB3      GLN  78  -2.438  -3.117  -7.401
    5    HG2  GLN  78           HG2      GLN  78  -2.983  -1.378  -5.751
    6    HG3  GLN  78           HG3      GLN  78  -4.312  -0.823  -6.766
    7   HE21  GLN  78          HE21      GLN  78  -6.138  -1.466  -5.541
    8   HE22  GLN  78          HE22      GLN  78  -6.423  -3.065  -5.044

  No H/Q in entry =           8
  In of MODEL   41
    1    H    LEU  79           H        LEU  79   0.012  -2.543  -8.038
    2    HA   LEU  79           HA       LEU  79   0.974  -1.631  -5.581
    3    HB2  LEU  79           HB2      LEU  79   1.861  -3.638  -6.639
    4    HB3  LEU  79           HB3      LEU  79   2.505  -2.686  -7.973
    5    HG   LEU  79           HG       LEU  79   4.048  -1.532  -6.469
    6   HD13  LEU  79          HD11      LEU  79   3.035  -1.286  -4.406
    7   HD12  LEU  79          HD12      LEU  79   4.122  -2.627  -4.054
    8   HD11  LEU  79          HD13      LEU  79   2.420  -2.939  -4.388
    9   HD23  LEU  79          HD21      LEU  79   5.271  -3.668  -5.554
   10   HD22  LEU  79          HD22      LEU  79   5.071  -3.477  -7.293
   11   HD21  LEU  79          HD23      LEU  79   3.998  -4.551  -6.401

  No H/Q in entry =          11
  In of MODEL   41
    1    H    HIS  80           H        HIS  80   1.847  -0.520  -8.855
    2    HA   HIS  80           HA       HIS  80   3.638   1.484  -7.934
    3    HB2  HIS  80           HB2      HIS  80   2.362   0.771 -10.518
    4    HB3  HIS  80           HB3      HIS  80   2.944   2.428 -10.351
    5    HD1  HIS  80           HD1      HIS  80   5.345   2.744 -10.867
    6    HD2  HIS  80           HD2      HIS  80   4.550  -1.168  -9.664
    7    HE1  HIS  80           HE1      HIS  80   7.545   1.483 -11.021
    8    HE2  HIS  80           HE2      HIS  80   7.071  -0.905 -10.291

  No H/Q in entry =           8
  In of MODEL   41
    1    H    LEU  81           H        LEU  81   0.236   1.615  -8.925
    2    HA   LEU  81           HA       LEU  81  -0.062   4.406  -8.605
    3    HB2  LEU  81           HB2      LEU  81  -2.059   2.146  -8.525
    4    HB3  LEU  81           HB3      LEU  81  -2.525   3.846  -8.440
    5    HG   LEU  81           HG       LEU  81  -0.816   2.701 -10.666
    6   HD12  LEU  81          HD11      LEU  81  -3.046   2.999 -11.974
    7   HD11  LEU  81          HD12      LEU  81  -3.806   2.930 -10.385
    8   HD13  LEU  81          HD13      LEU  81  -2.851   1.568 -10.964
    9   HD23  LEU  81          HD21      LEU  81  -1.926   4.833 -11.775
   10   HD22  LEU  81          HD22      LEU  81  -0.514   5.018 -10.737
   11   HD21  LEU  81          HD23      LEU  81  -2.124   5.356 -10.104

  No H/Q in entry =          11
  In of MODEL   41
    1    H    MET  82           H        MET  82  -0.707   1.722  -6.349
    2    HA   MET  82           HA       MET  82  -1.779   3.307  -4.271
    3    HB2  MET  82           HB2      MET  82  -0.383   0.631  -4.296
    4    HB3  MET  82           HB3      MET  82  -0.973   1.357  -2.803
    5    HG2  MET  82           HG2      MET  82  -2.693   0.841  -5.248
    6    HG3  MET  82           HG3      MET  82  -2.611  -0.228  -3.849
    7    HE3  MET  82           HE1      MET  82  -4.357   1.417  -1.045
    8    HE2  MET  82           HE2      MET  82  -2.628   1.709  -1.225
    9    HE1  MET  82           HE3      MET  82  -3.302   0.144  -1.676

  No H/Q in entry =           9
  In of MODEL   41
    1    H    THR  83           H        THR  83   1.533   2.246  -4.946
    2    HA   THR  83           HA       THR  83   2.733   3.368  -2.645
    3    HB   THR  83           HB       THR  83   4.834   3.325  -4.111
    4    HG1  THR  83           HG1      THR  83   4.605   2.790  -6.134
    5   HG22  THR  83          HG21      THR  83   4.413   0.663  -4.436
    6   HG21  THR  83          HG22      THR  83   3.116   1.035  -3.301
    7   HG23  THR  83          HG23      THR  83   4.791   1.394  -2.877

  No H/Q in entry =           7
  In of MODEL   41
    1    H    SER  84           H        SER  84   2.363   4.634  -5.950
    2    HA   SER  84           HA       SER  84   3.681   7.086  -5.499
    3    HB2  SER  84           HB2      SER  84   1.625   6.230  -7.522
    4    HB3  SER  84           HB3      SER  84   2.289   7.863  -7.500
    5    HG   SER  84           HG       SER  84   3.683   5.399  -7.779

  No H/Q in entry =           5
  In of MODEL   41
    1    H    MET  85           H        MET  85   0.193   6.301  -5.337
    2    HA   MET  85           HA       MET  85  -0.692   8.907  -4.747
    3    HB2  MET  85           HB2      MET  85  -2.196   7.080  -5.415
    4    HB3  MET  85           HB3      MET  85  -1.909   6.285  -3.867
    5    HG2  MET  85           HG2      MET  85  -2.811   8.259  -2.685
    6    HG3  MET  85           HG3      MET  85  -3.097   9.051  -4.233
    7    HE3  MET  85           HE1      MET  85  -5.534   9.055  -5.182
    8    HE2  MET  85           HE2      MET  85  -6.035   7.487  -5.813
    9    HE1  MET  85           HE3      MET  85  -4.398   8.066  -6.109

  No H/Q in entry =           9
  In of MODEL   41
    1    H    LEU  86           H        LEU  86   0.242   6.259  -2.592
    2    HA   LEU  86           HA       LEU  86  -0.310   7.565  -0.155
    3    HB2  LEU  86           HB2      LEU  86   0.174   5.097  -0.540
    4    HB3  LEU  86           HB3      LEU  86   1.878   5.539  -0.631
    5    HG   LEU  86           HG       LEU  86   1.537   6.705   1.633
    6   HD11  LEU  86          HD11      LEU  86  -1.150   5.917   1.155
    7   HD13  LEU  86          HD12      LEU  86  -0.494   6.673   2.605
    8   HD12  LEU  86          HD13      LEU  86  -0.571   4.917   2.491
    9   HD23  LEU  86          HD21      LEU  86   1.131   3.710   1.763
   10   HD22  LEU  86          HD22      LEU  86   2.122   4.730   2.803
   11   HD21  LEU  86          HD23      LEU  86   2.631   4.404   1.147

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ALA  87           H        ALA  87   2.679   7.287  -2.034
    2    HA   ALA  87           HA       ALA  87   4.369   8.715  -0.308
    3    HB3  ALA  87           HB1      ALA  87   4.480   7.694  -3.012
    4    HB2  ALA  87           HB2      ALA  87   5.809   8.037  -1.907
    5    HB1  ALA  87           HB3      ALA  87   5.189   9.310  -2.958

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ARG  88           H        ARG  88   2.423   9.829  -3.038
    2    HA   ARG  88           HA       ARG  88   3.179  12.524  -2.927
    3    HB2  ARG  88           HB2      ARG  88   1.938  11.357  -4.785
    4    HB3  ARG  88           HB3      ARG  88   0.477  11.494  -3.807
    5    HG2  ARG  88           HG2      ARG  88   1.479  14.081  -3.728
    6    HG3  ARG  88           HG3      ARG  88   1.912  13.565  -5.356
    7    HD2  ARG  88           HD2      ARG  88  -0.228  13.629  -6.060
    8    HD3  ARG  88           HD3      ARG  88  -0.813  12.776  -4.632
    9    HE   ARG  88           HE       ARG  88  -1.019  15.552  -5.058
   10   HH21  ARG  88          HH11      ARG  88  -1.560  16.883  -3.326
   11   HH22  ARG  88          HH12      ARG  88  -1.266  16.352  -1.706
   12   HH11  ARG  88          HH21      ARG  88   0.003  13.303  -2.674
   13   HH12  ARG  88          HH22      ARG  88  -0.398  14.319  -1.337

  No H/Q in entry =          13
  In of MODEL   41
    1    H    GLU  89           H        GLU  89   0.481  10.837  -1.291
    2    HA   GLU  89           HA       GLU  89  -0.645  13.146  -0.096
    3    HB2  GLU  89           HB2      GLU  89  -1.749  10.900  -0.179
    4    HB3  GLU  89           HB3      GLU  89  -0.626  10.355   1.067
    5    HG2  GLU  89           HG2      GLU  89  -1.460  12.053   2.618
    6    HG3  GLU  89           HG3      GLU  89  -2.513  12.714   1.370

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LEU  90           H        LEU  90   1.816  10.872   1.092
    2    HA   LEU  90           HA       LEU  90   2.157  12.125   3.619
    3    HB2  LEU  90           HB2      LEU  90   3.945  10.356   1.953
    4    HB3  LEU  90           HB3      LEU  90   4.357  10.880   3.591
    5    HG   LEU  90           HG       LEU  90   1.732   9.518   2.926
    6   HD12  LEU  90          HD11      LEU  90   2.880   7.481   3.944
    7   HD11  LEU  90          HD12      LEU  90   4.398   8.345   3.704
    8   HD13  LEU  90          HD13      LEU  90   3.392   7.928   2.315
    9   HD22  LEU  90          HD21      LEU  90   1.456  10.446   5.044
   10   HD21  LEU  90          HD22      LEU  90   3.173  10.349   5.432
   11   HD23  LEU  90          HD23      LEU  90   2.174   8.896   5.481

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  91           H        ILE  91   3.768  12.508   0.496
    2    HA   ILE  91           HA       ILE  91   5.733  14.351   1.337
    3    HB   ILE  91           HB       ILE  91   4.432  13.847  -1.346
    4   HG12  ILE  91          HG12      ILE  91   7.264  13.376  -0.362
    5   HG13  ILE  91          HG13      ILE  91   5.988  12.173  -0.200
    6   HG22  ILE  91          HG21      ILE  91   6.650  15.203  -2.032
    7   HG21  ILE  91          HG22      ILE  91   6.332  16.006  -0.493
    8   HG23  ILE  91          HG23      ILE  91   5.112  16.025  -1.766
    9   HD13  ILE  91          HD11      ILE  91   5.823  11.842  -2.507
   10   HD12  ILE  91          HD12      ILE  91   7.555  12.094  -2.289
   11   HD11  ILE  91          HD13      ILE  91   6.540  13.411  -2.882

  No H/Q in entry =          11
  In of MODEL   41
    1    H    THR  92           H        THR  92   2.372  14.764   0.318
    2    HA   THR  92           HA       THR  92   2.332  17.587   0.249
    3    HB   THR  92           HB       THR  92   0.172  15.584   0.947
    4    HG1  THR  92           HG1      THR  92   0.484  15.401  -1.136
    5   HG22  THR  92          HG21      THR  92  -1.236  17.738   0.215
    6   HG21  THR  92          HG22      THR  92   0.150  18.571   0.914
    7   HG23  THR  92          HG23      THR  92  -0.789  17.448   1.896

  No H/Q in entry =           7
  In of MODEL   41
    1    H    GLU  93           H        GLU  93   1.787  15.292   2.908
    2    HA   GLU  93           HA       GLU  93   1.240  17.199   4.919
    3    HB2  GLU  93           HB2      GLU  93   2.565  14.481   5.167
    4    HB3  GLU  93           HB3      GLU  93   1.866  15.408   6.495
    5    HG2  GLU  93           HG2      GLU  93   0.265  14.616   4.054
    6    HG3  GLU  93           HG3      GLU  93   0.367  13.598   5.485

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LEU  94           H        LEU  94   4.257  15.727   3.783
    2    HA   LEU  94           HA       LEU  94   5.997  16.888   5.673
    3    HB2  LEU  94           HB2      LEU  94   6.411  15.915   2.846
    4    HB3  LEU  94           HB3      LEU  94   7.735  16.581   3.797
    5    HG   LEU  94           HG       LEU  94   6.002  14.381   4.933
    6   HD11  LEU  94          HD11      LEU  94   8.105  14.158   2.809
    7   HD13  LEU  94          HD12      LEU  94   6.662  13.179   3.069
    8   HD12  LEU  94          HD13      LEU  94   8.086  12.935   4.080
    9   HD23  LEU  94          HD21      LEU  94   8.190  13.857   6.094
   10   HD22  LEU  94          HD22      LEU  94   7.515  15.434   6.504
   11   HD21  LEU  94          HD23      LEU  94   8.858  15.316   5.365

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  95           H        ILE  95   4.861  18.046   2.516
    2    HA   ILE  95           HA       ILE  95   6.423  20.410   2.455
    3    HB   ILE  95           HB       ILE  95   3.786  19.711   1.143
    4   HG12  ILE  95          HG12      ILE  95   6.576  20.058   0.014
    5   HG13  ILE  95          HG13      ILE  95   5.933  18.503   0.531
    6   HG21  ILE  95          HG21      ILE  95   5.525  22.186   0.922
    7   HG23  ILE  95          HG22      ILE  95   3.799  22.111   1.273
    8   HG22  ILE  95          HG23      ILE  95   4.389  21.709  -0.340
    9   HD13  ILE  95          HD11      ILE  95   4.379  18.415  -1.202
   10   HD12  ILE  95          HD12      ILE  95   5.726  19.237  -1.989
   11   HD11  ILE  95          HD13      ILE  95   4.348  20.168  -1.403

  No H/Q in entry =          11
  In of MODEL   41
    1    H    GLU  96           H        GLU  96   3.173  19.747   3.742
    2    HA   GLU  96           HA       GLU  96   2.539  22.393   4.484
    3    HB2  GLU  96           HB2      GLU  96   0.872  20.603   4.496
    4    HB3  GLU  96           HB3      GLU  96   1.734  19.783   5.796
    5    HG2  GLU  96           HG2      GLU  96   0.703  21.066   7.359
    6    HG3  GLU  96           HG3      GLU  96   1.234  22.540   6.560

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LEU  97           H        LEU  97   4.388  19.855   6.122
    2    HA   LEU  97           HA       LEU  97   4.732  21.212   8.590
    3    HB2  LEU  97           HB2      LEU  97   6.283  19.046   7.186
    4    HB3  LEU  97           HB3      LEU  97   6.865  19.737   8.698
    5    HG   LEU  97           HG       LEU  97   4.061  18.631   8.382
    6   HD12  LEU  97          HD11      LEU  97   5.006  16.626   9.603
    7   HD11  LEU  97          HD12      LEU  97   6.616  17.263   9.262
    8   HD13  LEU  97          HD13      LEU  97   5.552  16.797   7.935
    9   HD23  LEU  97          HD21      LEU  97   4.508  18.346  10.949
   10   HD22  LEU  97          HD22      LEU  97   4.122  19.954  10.339
   11   HD21  LEU  97          HD23      LEU  97   5.795  19.522  10.690

  No H/Q in entry =          11
  In of MODEL   41
    1    H    HIS  98           H        HIS  98   6.612  21.227   5.570
    2    HA   HIS  98           HA       HIS  98   8.756  22.818   6.472
    3    HB2  HIS  98           HB2      HIS  98   7.473  22.550   3.742
    4    HB3  HIS  98           HB3      HIS  98   8.908  23.535   4.035
    5    HD1  HIS  98           HD1      HIS  98   7.710  19.960   4.060
    6    HD2  HIS  98           HD2      HIS  98  11.282  22.072   4.490
    7    HE1  HIS  98           HE1      HIS  98   9.572  18.238   4.014
    8    HE2  HIS  98           HE2      HIS  98  11.751  19.503   4.276

  No H/Q in entry =           8
  In of MODEL   41
    1    H    GLU  99           H        GLU  99   5.536  23.637   5.284
    2    HA   GLU  99           HA       GLU  99   5.904  26.454   5.220
    3    HB2  GLU  99           HB2      GLU  99   4.033  25.274   4.086
    4    HB3  GLU  99           HB3      GLU  99   3.334  24.914   5.665
    5    HG2  GLU  99           HG2      GLU  99   3.143  27.307   6.158
    6    HG3  GLU  99           HG3      GLU  99   3.922  27.706   4.631

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LYS 100           H        LYS 100   4.774  24.221   7.744
    2    HA   LYS 100           HA       LYS 100   4.174  26.278   9.631
    3    HB2  LYS 100           HB2      LYS 100   4.759  23.330   9.986
    4    HB3  LYS 100           HB3      LYS 100   4.304  24.404  11.314
    5    HG2  LYS 100           HG2      LYS 100   2.240  25.031  10.058
    6    HG3  LYS 100           HG3      LYS 100   2.675  23.860   8.810
    7    HD2  LYS 100           HD2      LYS 100   2.599  22.044  10.476
    8    HD3  LYS 100           HD3      LYS 100   2.181  23.208  11.735
    9    HE2  LYS 100           HE2      LYS 100   0.129  23.819  10.464
   10    HE3  LYS 100           HE3      LYS 100   0.537  22.597   9.253
   11    HZ1  LYS 100           HZ1      LYS 100   0.265  21.937  12.135
   12    HZ3  LYS 100           HZ2      LYS 100   0.257  20.880  10.803
   13    HZ2  LYS 100           HZ3      LYS 100  -1.063  21.915  11.076

  No H/Q in entry =          13
  In of MODEL   41
    1    H    LEU 101           H        LEU 101   7.107  24.490   8.811
    2    HA   LEU 101           HA       LEU 101   8.696  25.342  11.017
    3    HB2  LEU 101           HB2      LEU 101   9.302  24.349   8.243
    4    HB3  LEU 101           HB3      LEU 101  10.599  25.022   9.227
    5    HG   LEU 101           HG       LEU 101   8.771  22.862  10.291
    6   HD12  LEU 101          HD11      LEU 101  10.832  21.372   9.693
    7   HD11  LEU 101          HD12      LEU 101  11.198  22.634   8.518
    8   HD13  LEU 101          HD13      LEU 101   9.672  21.755   8.422
    9   HD21  LEU 101          HD21      LEU 101  11.489  23.981  11.024
   10   HD23  LEU 101          HD22      LEU 101  10.949  22.409  11.606
   11   HD22  LEU 101          HD23      LEU 101  10.051  23.863  12.037

  No H/Q in entry =          11
  In of MODEL   41
    1    H    LYS 102           H        LYS 102   7.113  27.194   8.866
    2    HA   LYS 102           HA       LYS 102   7.184  29.487   8.569
    3    HB2  LYS 102           HB2      LYS 102   8.742  29.382  10.672
    4    HB3  LYS 102           HB3      LYS 102  10.045  29.577   9.516
    5    HG2  LYS 102           HG2      LYS 102   7.931  31.526  10.366
    6    HG3  LYS 102           HG3      LYS 102   9.643  31.791  10.119
    7    HD2  LYS 102           HD2      LYS 102   7.700  31.355   7.815
    8    HD3  LYS 102           HD3      LYS 102   8.076  32.938   8.480
    9    HE2  LYS 102           HE2      LYS 102   9.459  31.752   6.414
   10    HE3  LYS 102           HE3      LYS 102  10.069  33.063   7.423
   11    HZ2  LYS 102           HZ1      LYS 102  11.596  31.163   7.258
   12    HZ1  LYS 102           HZ2      LYS 102  10.434  30.179   7.999
   13    HZ3  LYS 102           HZ3      LYS 102  11.120  31.470   8.857

  No H/Q in entry =          13
  In of MODEL   41
    1    H    ALA 103           H        ALA 103  10.447  28.156   8.018
    2    HA   ALA 103           HA       ALA 103  11.413  29.530   5.941
    3    HB2  ALA 103           HB1      ALA 103  12.307  27.316   5.022
    4    HB1  ALA 103           HB2      ALA 103  11.411  26.543   6.327
    5    HB3  ALA 103           HB3      ALA 103  12.696  27.692   6.701

  No H/Q in entry =           5
  In of MODEL   41
    1    H1   LYS   3           H1       LYS   3 -31.286   6.403 -19.488
    2    H2   LYS   3           H3       LYS   3 -30.300   6.146 -20.846
    3    H3   LYS   3           H2       LYS   3 -31.688   5.197 -20.613
    4    HA   LYS   3           HA       LYS   3 -30.674   3.788 -19.238
    5    HB2  LYS   3           HB2      LYS   3 -28.404   5.238 -20.549
    6    HB3  LYS   3           HB3      LYS   3 -28.069   4.009 -19.330
    7    HG2  LYS   3           HG2      LYS   3 -29.485   2.440 -20.706
    8    HG3  LYS   3           HG3      LYS   3 -29.451   3.664 -21.974
    9    HD2  LYS   3           HD2      LYS   3 -26.967   3.564 -21.933
   10    HD3  LYS   3           HD3      LYS   3 -27.075   2.243 -20.770
   11    HE2  LYS   3           HE2      LYS   3 -28.572   1.091 -22.504
   12    HE3  LYS   3           HE3      LYS   3 -27.962   2.294 -23.639
   13    HZ3  LYS   3           HZ1      LYS   3 -26.158   1.081 -23.936
   14    HZ2  LYS   3           HZ2      LYS   3 -26.778  -0.110 -22.897
   15    HZ1  LYS   3           HZ3      LYS   3 -25.793   1.127 -22.278

  No H/Q in entry =          15
  In of MODEL   41
    1    H    LYS   4           H        LYS   4 -30.719   3.607 -17.179
    2    HA   LYS   4           HA       LYS   4 -29.996   5.866 -15.488
    3    HB2  LYS   4           HB2      LYS   4 -31.182   3.155 -14.835
    4    HB3  LYS   4           HB3      LYS   4 -30.964   4.473 -13.686
    5    HG2  LYS   4           HG2      LYS   4 -32.779   4.448 -16.103
    6    HG3  LYS   4           HG3      LYS   4 -33.264   4.464 -14.409
    7    HD2  LYS   4           HD2      LYS   4 -32.578   6.684 -14.102
    8    HD3  LYS   4           HD3      LYS   4 -31.543   6.657 -15.529
    9    HE2  LYS   4           HE2      LYS   4 -33.476   8.030 -15.961
   10    HE3  LYS   4           HE3      LYS   4 -33.552   6.576 -16.955
   11    HZ3  LYS   4           HZ1      LYS   4 -35.119   5.627 -15.422
   12    HZ2  LYS   4           HZ2      LYS   4 -35.682   7.132 -15.976
   13    HZ1  LYS   4           HZ3      LYS   4 -35.020   6.994 -14.417

  No H/Q in entry =          13
  In of MODEL   41
    1    H    HIS   5           H        HIS   5 -28.523   5.928 -13.900
    2    HA   HIS   5           HA       HIS   5 -26.234   4.115 -14.273
    3    HB2  HIS   5           HB2      HIS   5 -26.496   6.845 -13.013
    4    HB3  HIS   5           HB3      HIS   5 -25.010   5.897 -13.019
    5    HD1  HIS   5           HD1      HIS   5 -23.550   7.130 -14.591
    6    HD2  HIS   5           HD2      HIS   5 -27.353   6.525 -16.145
    7    HE1  HIS   5           HE1      HIS   5 -23.392   7.757 -17.030
    8    HE2  HIS   5           HE2      HIS   5 -25.711   7.375 -17.946

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ILE   6           H        ILE   6 -25.996   2.518 -12.986
    2    HA   ILE   6           HA       ILE   6 -26.964   2.731 -10.214
    3    HB   ILE   6           HB       ILE   6 -26.137   0.296 -11.800
    4   HG12  ILE   6          HG12      ILE   6 -28.880   1.209 -10.923
    5   HG13  ILE   6          HG13      ILE   6 -28.243   1.402 -12.556
    6   HG23  ILE   6          HG21      ILE   6 -26.500  -0.992  -9.962
    7   HG22  ILE   6          HG22      ILE   6 -27.659   0.138  -9.259
    8   HG21  ILE   6          HG23      ILE   6 -25.930   0.478  -9.167
    9   HD13  ILE   6          HD11      ILE   6 -28.697  -0.708 -13.095
   10   HD12  ILE   6          HD12      ILE   6 -29.709  -0.721 -11.649
   11   HD11  ILE   6          HD13      ILE   6 -28.054  -1.326 -11.573

  No H/Q in entry =          11
  In of MODEL   41
    1    H    TYR   7           H        TYR   7 -25.203   3.354  -8.921
    2    HA   TYR   7           HA       TYR   7 -22.492   2.416  -9.626
    3    HB2  TYR   7           HB2      TYR   7 -23.457   4.819  -8.098
    4    HB3  TYR   7           HB3      TYR   7 -21.771   4.310  -8.150
    5    HD1  TYR   7           HD1      TYR   7 -22.818   3.422 -11.255
    6    HD2  TYR   7           HD2      TYR   7 -22.149   6.954  -8.964
    7    HE1  TYR   7           HE1      TYR   7 -22.395   4.692 -13.323
    8    HE2  TYR   7           HE2      TYR   7 -21.769   8.228 -11.025
    9    HH   TYR   7           HH       TYR   7 -21.994   8.184 -13.257

  No H/Q in entry =           9
  In of MODEL   41
    1    H    LEU   8           H        LEU   8 -21.518   1.042  -8.325
    2    HA   LEU   8           HA       LEU   8 -22.639   0.495  -5.648
    3    HB2  LEU   8           HB2      LEU   8 -20.939  -1.130  -7.518
    4    HB3  LEU   8           HB3      LEU   8 -21.118  -1.544  -5.814
    5    HG   LEU   8           HG       LEU   8 -23.598  -1.715  -6.231
    6   HD13  LEU   8          HD11      LEU   8 -23.739  -0.460  -8.318
    7   HD12  LEU   8          HD12      LEU   8 -24.265  -2.121  -8.587
    8   HD11  LEU   8          HD13      LEU   8 -22.660  -1.609  -9.108
    9   HD23  LEU   8          HD21      LEU   8 -22.325  -3.721  -7.966
   10   HD22  LEU   8          HD22      LEU   8 -23.408  -3.916  -6.589
   11   HD21  LEU   8          HD23      LEU   8 -21.701  -3.564  -6.325

  No H/Q in entry =          11
  In of MODEL   41
    1    H    PHE   9           H        PHE   9 -21.366   0.882  -3.860
    2    HA   PHE   9           HA       PHE   9 -18.588   1.835  -4.377
    3    HB2  PHE   9           HB2      PHE   9 -20.611   2.864  -2.394
    4    HB3  PHE   9           HB3      PHE   9 -18.903   3.277  -2.346
    5    HD1  PHE   9           HD1      PHE   9 -17.884   4.647  -4.084
    6    HD2  PHE   9           HD2      PHE   9 -22.068   3.708  -4.178
    7    HE1  PHE   9           HE1      PHE   9 -18.235   6.383  -5.814
    8    HE2  PHE   9           HE2      PHE   9 -22.422   5.456  -5.903
    9    HZ   PHE   9           HZ       PHE   9 -20.502   6.791  -6.726

  No H/Q in entry =           9
  In of MODEL   41
    1    H    SER  10           H        SER  10 -16.984   0.880  -3.295
    2    HA   SER  10           HA       SER  10 -17.148  -0.052  -0.618
    3    HB2  SER  10           HB2      SER  10 -17.030  -2.413  -0.927
    4    HB3  SER  10           HB3      SER  10 -18.406  -1.858  -1.867
    5    HG   SER  10           HG       SER  10 -16.208  -3.134  -2.680

  No H/Q in entry =           5
  In of MODEL   41
    1    H    SER  11           H        SER  11 -15.129   0.103   0.165
    2    HA   SER  11           HA       SER  11 -12.964   0.935  -1.401
    3    HB2  SER  11           HB2      SER  11 -11.726   0.960   0.571
    4    HB3  SER  11           HB3      SER  11 -13.386   1.145   1.137
    5    HG   SER  11           HG       SER  11 -11.611  -0.820   1.635

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA  12           H        ALA  12 -14.183  -1.796  -2.117
    2    HA   ALA  12           HA       ALA  12 -11.602  -3.039  -2.679
    3    HB3  ALA  12           HB1      ALA  12 -12.384  -4.105  -0.571
    4    HB2  ALA  12           HB2      ALA  12 -12.252  -5.243  -1.911
    5    HB1  ALA  12           HB3      ALA  12 -13.835  -4.643  -1.420

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLY  13           H        GLY  13 -12.453  -1.972  -4.683
    2    HA3  GLY  13           HA2      GLY  13 -14.674  -2.715  -6.150
    3    HA2  GLY  13           HA3      GLY  13 -13.139  -2.220  -6.877

  No H/Q in entry =           3
  In of MODEL   41
    1    H    MET  14           H        MET  14 -11.649  -4.541  -5.826
    2    HA   MET  14           HA       MET  14 -11.925  -6.257  -8.005
    3    HB2  MET  14           HB2      MET  14  -9.911  -6.328  -6.627
    4    HB3  MET  14           HB3      MET  14 -10.815  -7.016  -5.280
    5    HG2  MET  14           HG2      MET  14 -11.336  -9.005  -6.668
    6    HG3  MET  14           HG3      MET  14 -10.417  -8.309  -8.002
    7    HE3  MET  14           HE1      MET  14  -8.193  -9.099  -8.482
    8    HE2  MET  14           HE2      MET  14  -6.868  -8.847  -7.346
    9    HE1  MET  14           HE3      MET  14  -7.938  -7.507  -7.749

  No H/Q in entry =           9
  In of MODEL   41
    1    H    SER  15           H        SER  15 -13.297  -6.783  -4.749
    2    HA   SER  15           HA       SER  15 -14.608  -9.222  -5.600
    3    HB2  SER  15           HB2      SER  15 -15.196  -7.607  -3.103
    4    HB3  SER  15           HB3      SER  15 -15.756  -9.238  -3.458
    5    HG   SER  15           HG       SER  15 -13.005  -8.517  -3.434

  No H/Q in entry =           5
  In of MODEL   41
    1    H    THR  16           H        THR  16 -15.637  -5.846  -5.129
    2    HA   THR  16           HA       THR  16 -18.437  -6.280  -5.669
    3    HB   THR  16           HB       THR  16 -16.823  -3.748  -6.133
    4    HG1  THR  16           HG1      THR  16 -17.759  -3.392  -3.892
    5   HG21  THR  16          HG21      THR  16 -19.216  -3.914  -6.959
    6   HG23  THR  16          HG22      THR  16 -18.915  -2.616  -5.791
    7   HG22  THR  16          HG23      THR  16 -19.696  -4.119  -5.279

  No H/Q in entry =           7
  In of MODEL   41
    1    H    SER  17           H        SER  17 -15.586  -5.710  -7.512
    2    HA   SER  17           HA       SER  17 -16.720  -4.928  -9.997
    3    HB2  SER  17           HB2      SER  17 -14.087  -6.261  -9.333
    4    HB3  SER  17           HB3      SER  17 -14.534  -5.776 -10.968
    5    HG   SER  17           HG       SER  17 -15.010  -3.678  -9.587

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU  18           H        LEU  18 -16.140  -8.097  -8.608
    2    HA   LEU  18           HA       LEU  18 -16.725  -9.555 -10.990
    3    HB2  LEU  18           HB2      LEU  18 -15.499 -10.545  -9.104
    4    HB3  LEU  18           HB3      LEU  18 -16.929 -10.377  -8.087
    5    HG   LEU  18           HG       LEU  18 -18.152 -11.940  -9.495
    6   HD13  LEU  18          HD11      LEU  18 -17.362 -11.659 -11.672
    7   HD12  LEU  18          HD12      LEU  18 -16.636 -13.199 -11.213
    8   HD11  LEU  18          HD13      LEU  18 -15.673 -11.723 -11.172
    9   HD22  LEU  18          HD21      LEU  18 -17.031 -13.920  -8.865
   10   HD21  LEU  18          HD22      LEU  18 -16.698 -12.707  -7.627
   11   HD23  LEU  18          HD23      LEU  18 -15.469 -13.101  -8.828

  No H/Q in entry =          11
  In of MODEL   41
    1    H    LEU  19           H        LEU  19 -18.693  -8.403  -8.253
    2    HA   LEU  19           HA       LEU  19 -21.153  -9.580  -9.103
    3    HB2  LEU  19           HB2      LEU  19 -20.889  -8.790  -6.837
    4    HB3  LEU  19           HB3      LEU  19 -20.601  -7.148  -7.411
    5    HG   LEU  19           HG       LEU  19 -22.930  -6.966  -8.110
    6   HD12  LEU  19          HD11      LEU  19 -24.538  -8.730  -7.468
    7   HD11  LEU  19          HD12      LEU  19 -23.191  -9.756  -6.976
    8   HD13  LEU  19          HD13      LEU  19 -23.376  -9.296  -8.668
    9   HD22  LEU  19          HD21      LEU  19 -23.919  -6.939  -5.878
   10   HD21  LEU  19          HD22      LEU  19 -22.278  -6.292  -5.869
   11   HD23  LEU  19          HD23      LEU  19 -22.585  -7.923  -5.274

  No H/Q in entry =          11
  In of MODEL   41
    1    H    VAL  20           H        VAL  20 -19.669  -6.402  -9.742
    2    HA   VAL  20           HA       VAL  20 -21.788  -5.339 -11.288
    3    HB   VAL  20           HB       VAL  20 -18.801  -4.736 -11.430
    4   HG11  VAL  20          HG11      VAL  20 -21.142  -3.420 -12.816
    5   HG13  VAL  20          HG12      VAL  20 -19.667  -4.052 -13.544
    6   HG12  VAL  20          HG13      VAL  20 -19.607  -2.594 -12.555
    7   HG21  VAL  20          HG21      VAL  20 -21.120  -3.480 -10.006
    8   HG23  VAL  20          HG22      VAL  20 -19.634  -2.592 -10.332
    9   HG22  VAL  20          HG23      VAL  20 -19.588  -4.049  -9.341

  No H/Q in entry =           9
  In of MODEL   41
    1    H    SER  21           H        SER  21 -19.025  -7.362 -12.358
    2    HA   SER  21           HA       SER  21 -19.815  -7.202 -15.105
    3    HB2  SER  21           HB2      SER  21 -18.375  -9.161 -15.474
    4    HB3  SER  21           HB3      SER  21 -17.547  -7.925 -14.530
    5    HG   SER  21           HG       SER  21 -17.540  -9.181 -12.844

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LYS  22           H        LYS  22 -20.868  -9.438 -12.572
    2    HA   LYS  22           HA       LYS  22 -22.406 -11.029 -14.420
    3    HB2  LYS  22           HB2      LYS  22 -21.639 -11.796 -12.138
    4    HB3  LYS  22           HB3      LYS  22 -22.882 -10.748 -11.457
    5    HG2  LYS  22           HG2      LYS  22 -23.867 -12.856 -11.459
    6    HG3  LYS  22           HG3      LYS  22 -24.529 -12.080 -12.898
    7    HD2  LYS  22           HD2      LYS  22 -22.945 -13.273 -14.305
    8    HD3  LYS  22           HD3      LYS  22 -22.199 -14.001 -12.881
    9    HE2  LYS  22           HE2      LYS  22 -25.090 -14.411 -13.667
   10    HE3  LYS  22           HE3      LYS  22 -23.784 -15.507 -14.118
   11    HZ3  LYS  22           HZ1      LYS  22 -24.121 -16.542 -12.220
   12    HZ2  LYS  22           HZ2      LYS  22 -25.251 -15.379 -11.711
   13    HZ1  LYS  22           HZ3      LYS  22 -23.600 -15.158 -11.385

  No H/Q in entry =          13
  In of MODEL   41
    1    H    MET  23           H        MET  23 -23.133  -8.143 -12.497
    2    HA   MET  23           HA       MET  23 -25.942  -8.220 -12.999
    3    HB2  MET  23           HB2      MET  23 -24.099  -5.918 -12.388
    4    HB3  MET  23           HB3      MET  23 -25.845  -5.750 -12.559
    5    HG2  MET  23           HG2      MET  23 -26.229  -7.090 -10.613
    6    HG3  MET  23           HG3      MET  23 -24.519  -7.500 -10.498
    7    HE2  MET  23           HE1      MET  23 -26.822  -3.876  -9.239
    8    HE1  MET  23           HE2      MET  23 -27.077  -4.818 -10.706
    9    HE3  MET  23           HE3      MET  23 -26.045  -3.388 -10.745

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ARG  24           H        ARG  24 -23.193  -6.753 -14.761
    2    HA   ARG  24           HA       ARG  24 -24.697  -5.419 -16.733
    3    HB2  ARG  24           HB2      ARG  24 -22.251  -5.029 -16.343
    4    HB3  ARG  24           HB3      ARG  24 -21.918  -6.608 -17.011
    5    HG2  ARG  24           HG2      ARG  24 -22.785  -5.890 -19.232
    6    HG3  ARG  24           HG3      ARG  24 -23.152  -4.286 -18.543
    7    HD2  ARG  24           HD2      ARG  24 -20.398  -5.608 -18.590
    8    HD3  ARG  24           HD3      ARG  24 -20.943  -4.347 -19.688
    9    HE   ARG  24           HE       ARG  24 -21.276  -3.102 -17.391
   10   HH21  ARG  24          HH11      ARG  24 -19.877  -1.344 -17.457
   11   HH22  ARG  24          HH12      ARG  24 -18.177  -1.607 -17.638
   12   HH11  ARG  24          HH21      ARG  24 -18.674  -5.038 -18.359
   13   HH12  ARG  24          HH22      ARG  24 -17.474  -3.798 -18.161

  No H/Q in entry =          13
  In of MODEL   41
    1    H    ALA  25           H        ALA  25 -23.571  -8.760 -16.522
    2    HA   ALA  25           HA       ALA  25 -24.203  -9.541 -19.173
    3    HB1  ALA  25           HB1      ALA  25 -23.504 -11.586 -18.518
    4    HB3  ALA  25           HB2      ALA  25 -24.559 -11.592 -17.105
    5    HB2  ALA  25           HB3      ALA  25 -23.004 -10.766 -17.039

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLN  26           H        GLN  26 -26.024  -9.639 -16.148
    2    HA   GLN  26           HA       GLN  26 -28.369 -10.824 -17.184
    3    HB2  GLN  26           HB2      GLN  26 -27.854  -9.122 -14.765
    4    HB3  GLN  26           HB3      GLN  26 -29.417  -9.839 -15.126
    5    HG2  GLN  26           HG2      GLN  26 -26.829 -11.303 -14.690
    6    HG3  GLN  26           HG3      GLN  26 -28.188 -11.223 -13.576
    7   HE21  GLN  26          HE21      GLN  26 -26.971 -13.362 -14.895
    8   HE22  GLN  26          HE22      GLN  26 -28.014 -14.395 -15.711

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ALA  27           H        ALA  27 -27.436  -7.434 -16.728
    2    HA   ALA  27           HA       ALA  27 -29.927  -6.327 -17.487
    3    HB1  ALA  27           HB1      ALA  27 -28.116  -5.034 -16.350
    4    HB3  ALA  27           HB2      ALA  27 -28.709  -4.240 -17.809
    5    HB2  ALA  27           HB3      ALA  27 -27.173  -5.105 -17.839

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLU  28           H        GLU  28 -27.229  -7.512 -19.384
    2    HA   GLU  28           HA       GLU  28 -28.167  -6.424 -21.881
    3    HB2  GLU  28           HB2      GLU  28 -25.788  -7.118 -21.273
    4    HB3  GLU  28           HB3      GLU  28 -26.333  -8.777 -21.508
    5    HG2  GLU  28           HG2      GLU  28 -25.190  -7.962 -23.462
    6    HG3  GLU  28           HG3      GLU  28 -26.888  -8.279 -23.814

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LYS  29           H        LYS  29 -28.330  -9.561 -20.286
    2    HA   LYS  29           HA       LYS  29 -29.636 -10.992 -22.318
    3    HB2  LYS  29           HB2      LYS  29 -28.584 -12.015 -20.335
    4    HB3  LYS  29           HB3      LYS  29 -29.854 -11.328 -19.324
    5    HG2  LYS  29           HG2      LYS  29 -31.516 -12.680 -20.417
    6    HG3  LYS  29           HG3      LYS  29 -30.319 -13.292 -21.556
    7    HD2  LYS  29           HD2      LYS  29 -29.173 -14.493 -19.847
    8    HD3  LYS  29           HD3      LYS  29 -30.078 -13.677 -18.574
    9    HE2  LYS  29           HE2      LYS  29 -30.831 -16.019 -18.982
   10    HE3  LYS  29           HE3      LYS  29 -32.108 -14.822 -19.200
   11    HZ1  LYS  29           HZ1      LYS  29 -31.548 -14.907 -21.631
   12    HZ3  LYS  29           HZ2      LYS  29 -32.266 -16.307 -20.992
   13    HZ2  LYS  29           HZ3      LYS  29 -30.596 -16.272 -21.292

  No H/Q in entry =          13
  In of MODEL   41
    1    H    TYR  30           H        TYR  30 -31.025  -8.938 -19.769
    2    HA   TYR  30           HA       TYR  30 -33.690  -9.363 -21.015
    3    HB2  TYR  30           HB2      TYR  30 -33.032  -8.264 -18.273
    4    HB3  TYR  30           HB3      TYR  30 -34.651  -8.509 -18.929
    5    HD1  TYR  30           HD1      TYR  30 -35.560 -10.797 -19.187
    6    HD2  TYR  30           HD2      TYR  30 -31.723 -10.108 -17.475
    7    HE1  TYR  30           HE1      TYR  30 -35.470 -13.140 -18.438
    8    HE2  TYR  30           HE2      TYR  30 -31.632 -12.436 -16.729
    9    HH   TYR  30           HH       TYR  30 -33.273 -14.776 -17.867

  No H/Q in entry =           9
  In of MODEL   41
    1    H    GLU  31           H        GLU  31 -31.526  -7.354 -21.778
    2    HA   GLU  31           HA       GLU  31 -31.454  -5.182 -22.557
    3    HB2  GLU  31           HB2      GLU  31 -34.350  -5.888 -23.080
    4    HB3  GLU  31           HB3      GLU  31 -33.511  -4.506 -23.783
    5    HG2  GLU  31           HG2      GLU  31 -32.040  -5.917 -25.006
    6    HG3  GLU  31           HG3      GLU  31 -32.602  -7.349 -24.145

  No H/Q in entry =           6
  In of MODEL   41
    1    H    VAL  32           H        VAL  32 -31.649  -5.135 -19.824
    2    HA   VAL  32           HA       VAL  32 -33.512  -3.038 -19.119
    3    HB   VAL  32           HB       VAL  32 -31.117  -4.060 -17.562
    4   HG12  VAL  32          HG11      VAL  32 -32.650  -3.278 -15.648
    5   HG11  VAL  32          HG12      VAL  32 -33.487  -2.349 -16.892
    6   HG13  VAL  32          HG13      VAL  32 -31.779  -2.050 -16.569
    7   HG21  VAL  32          HG21      VAL  32 -32.884  -5.769 -18.283
    8   HG23  VAL  32          HG22      VAL  32 -33.923  -4.967 -17.104
    9   HG22  VAL  32          HG23      VAL  32 -32.404  -5.699 -16.587

  No H/Q in entry =           9
  In of MODEL   41
    1    HA   PRO  33           HA       PRO  33 -30.488  -0.071 -20.737
    2    HB2  PRO  33           HB2      PRO  33 -32.003   2.145 -20.565
    3    HB3  PRO  33           HB3      PRO  33 -32.471   0.865 -21.686
    4    HG2  PRO  33           HG2      PRO  33 -33.436   1.322 -18.861
    5    HG3  PRO  33           HG3      PRO  33 -34.402   1.141 -20.326
    6    HD2  PRO  33           HD2      PRO  33 -33.940  -0.964 -18.704
    7    HD3  PRO  33           HD3      PRO  33 -34.004  -1.169 -20.454

  No H/Q in entry =           7
  In of MODEL   41
    1    H    VAL  34           H        VAL  34 -29.220  -0.654 -18.802
    2    HA   VAL  34           HA       VAL  34 -28.938   1.739 -17.105
    3    HB   VAL  34           HB       VAL  34 -28.351   0.238 -15.199
    4   HG12  VAL  34          HG11      VAL  34 -30.761  -0.646 -14.905
    5   HG11  VAL  34          HG12      VAL  34 -31.081   0.145 -16.447
    6   HG13  VAL  34          HG13      VAL  34 -30.528   1.094 -15.068
    7   HG21  VAL  34          HG21      VAL  34 -28.535  -1.747 -17.247
    8   HG23  VAL  34          HG22      VAL  34 -29.590  -2.138 -15.888
    9   HG22  VAL  34          HG23      VAL  34 -27.872  -1.853 -15.617

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ILE  35           H        ILE  35 -26.962   2.160 -16.259
    2    HA   ILE  35           HA       ILE  35 -24.656   0.863 -17.553
    3    HB   ILE  35           HB       ILE  35 -25.062   3.734 -16.682
    4   HG12  ILE  35          HG12      ILE  35 -24.081   2.483 -19.255
    5   HG13  ILE  35          HG13      ILE  35 -25.712   3.094 -18.979
    6   HG21  ILE  35          HG21      ILE  35 -22.496   2.215 -17.027
    7   HG23  ILE  35          HG22      ILE  35 -22.951   3.368 -15.773
    8   HG22  ILE  35          HG23      ILE  35 -22.574   3.936 -17.400
    9   HD11  ILE  35          HD11      ILE  35 -24.315   5.279 -18.336
   10   HD13  ILE  35          HD12      ILE  35 -24.854   4.928 -19.979
   11   HD12  ILE  35          HD13      ILE  35 -23.200   4.553 -19.493

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ILE  36           H        ILE  36 -23.420  -0.190 -15.977
    2    HA   ILE  36           HA       ILE  36 -23.858   0.365 -13.094
    3    HB   ILE  36           HB       ILE  36 -23.024  -2.313 -14.260
    4   HG12  ILE  36          HG12      ILE  36 -25.832  -1.530 -13.474
    5   HG13  ILE  36          HG13      ILE  36 -25.264  -1.473 -15.143
    6   HG23  ILE  36          HG21      ILE  36 -23.370  -3.186 -12.163
    7   HG22  ILE  36          HG22      ILE  36 -24.499  -1.915 -11.696
    8   HG21  ILE  36          HG23      ILE  36 -22.770  -1.577 -11.762
    9   HD13  ILE  36          HD11      ILE  36 -25.424  -3.683 -15.394
   10   HD12  ILE  36          HD12      ILE  36 -26.487  -3.594 -13.992
   11   HD11  ILE  36          HD13      ILE  36 -24.787  -4.014 -13.783

  No H/Q in entry =          11
  In of MODEL   41
    1    H    GLU  37           H        GLU  37 -22.075   0.976 -11.980
    2    HA   GLU  37           HA       GLU  37 -19.385   0.206 -12.917
    3    HB2  GLU  37           HB2      GLU  37 -20.287   2.979 -12.154
    4    HB3  GLU  37           HB3      GLU  37 -18.599   2.492 -12.305
    5    HG2  GLU  37           HG2      GLU  37 -18.894   2.099 -14.667
    6    HG3  GLU  37           HG3      GLU  37 -20.607   2.493 -14.540

  No H/Q in entry =           6
  In of MODEL   41
    1    H    ALA  38           H        ALA  38 -17.894  -0.061 -11.242
    2    HA   ALA  38           HA       ALA  38 -18.921   0.057  -8.466
    3    HB1  ALA  38           HB1      ALA  38 -17.203  -1.846  -9.935
    4    HB3  ALA  38           HB2      ALA  38 -18.249  -2.115  -8.541
    5    HB2  ALA  38           HB3      ALA  38 -16.639  -1.432  -8.317

  No H/Q in entry =           5
  In of MODEL   41
    1    H    PHE  39           H        PHE  39 -17.683   1.240  -6.970
    2    HA   PHE  39           HA       PHE  39 -15.164   2.470  -7.846
    3    HB2  PHE  39           HB2      PHE  39 -17.580   3.927  -6.793
    4    HB3  PHE  39           HB3      PHE  39 -15.954   4.601  -6.699
    5    HD1  PHE  39           HD1      PHE  39 -14.645   4.665  -8.956
    6    HD2  PHE  39           HD2      PHE  39 -18.888   4.412  -8.609
    7    HE1  PHE  39           HE1      PHE  39 -14.875   5.583 -11.247
    8    HE2  PHE  39           HE2      PHE  39 -19.134   5.321 -10.892
    9    HZ   PHE  39           HZ       PHE  39 -17.132   5.880 -12.230

  No H/Q in entry =           9
  In of MODEL   41
    1    HA   PRO  40           HA       PRO  40 -14.214   1.632  -3.578
    2    HB2  PRO  40           HB2      PRO  40 -12.455   3.643  -2.933
    3    HB3  PRO  40           HB3      PRO  40 -12.007   2.335  -4.029
    4    HG2  PRO  40           HG2      PRO  40 -13.045   5.079  -4.718
    5    HG3  PRO  40           HG3      PRO  40 -11.617   4.257  -5.344
    6    HD2  PRO  40           HD2      PRO  40 -13.842   4.189  -6.750
    7    HD3  PRO  40           HD3      PRO  40 -12.880   2.720  -6.590

  No H/Q in entry =           7
  In of MODEL   41
    1    H    GLU  41           H        GLU  41 -14.836   2.563  -1.428
    2    HA   GLU  41           HA       GLU  41 -17.090   4.253  -1.372
    3    HB2  GLU  41           HB2      GLU  41 -16.825   4.227   1.051
    4    HB3  GLU  41           HB3      GLU  41 -16.594   2.610   0.382
    5    HG2  GLU  41           HG2      GLU  41 -14.910   2.704   1.937
    6    HG3  GLU  41           HG3      GLU  41 -14.067   3.222   0.478

  No H/Q in entry =           6
  In of MODEL   41
    1    H    THR  42           H        THR  42 -13.763   5.189  -1.411
    2    HA   THR  42           HA       THR  42 -14.127   7.723  -0.146
    3    HB   THR  42           HB       THR  42 -11.977   8.330  -1.233
    4    HG1  THR  42           HG1      THR  42 -12.647   6.841  -3.102
    5   HG22  THR  42          HG21      THR  42 -11.884   5.501  -0.173
    6   HG21  THR  42          HG22      THR  42 -12.105   6.913   0.862
    7   HG23  THR  42          HG23      THR  42 -10.621   6.729  -0.072

  No H/Q in entry =           7
  In of MODEL   41
    1    H    LEU  43           H        LEU  43 -15.032   6.688  -3.266
    2    HA   LEU  43           HA       LEU  43 -15.302   9.477  -4.179
    3    HB2  LEU  43           HB2      LEU  43 -15.679   6.867  -5.635
    4    HB3  LEU  43           HB3      LEU  43 -15.852   8.468  -6.351
    5    HG   LEU  43           HG       LEU  43 -13.277   7.270  -5.358
    6   HD12  LEU  43          HD11      LEU  43 -13.894   7.918  -8.205
    7   HD11  LEU  43          HD12      LEU  43 -14.472   6.399  -7.523
    8   HD13  LEU  43          HD13      LEU  43 -12.746   6.754  -7.542
    9   HD23  LEU  43          HD21      LEU  43 -12.323   9.242  -6.611
   10   HD22  LEU  43          HD22      LEU  43 -13.200   9.647  -5.133
   11   HD21  LEU  43          HD23      LEU  43 -13.963   9.884  -6.705

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ALA  44           H        ALA  44 -17.234   7.604  -2.360
    2    HA   ALA  44           HA       ALA  44 -19.713   7.476  -3.681
    3    HB2  ALA  44           HB1      ALA  44 -19.565   6.318  -1.607
    4    HB3  ALA  44           HB2      ALA  44 -20.680   7.650  -1.306
    5    HB1  ALA  44           HB3      ALA  44 -19.008   7.757  -0.754

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLY  45           H        GLY  45 -18.307  10.253  -2.094
    2    HA3  GLY  45           HA2      GLY  45 -20.753  11.745  -2.420
    3    HA2  GLY  45           HA3      GLY  45 -19.211  12.367  -1.833

  No H/Q in entry =           3
  In of MODEL   41
    1    H    GLU  46           H        GLU  46 -17.678  11.486  -4.144
    2    HA   GLU  46           HA       GLU  46 -18.332  13.733  -5.868
    3    HB2  GLU  46           HB2      GLU  46 -16.123  11.672  -5.921
    4    HB3  GLU  46           HB3      GLU  46 -16.267  12.993  -7.079
    5    HG2  GLU  46           HG2      GLU  46 -15.967  14.617  -5.315
    6    HG3  GLU  46           HG3      GLU  46 -15.926  13.333  -4.107

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LYS  47           H        LYS  47 -18.193  10.225  -6.374
    2    HA   LYS  47           HA       LYS  47 -19.298  10.493  -9.043
    3    HB2  LYS  47           HB2      LYS  47 -18.716   8.068  -7.334
    4    HB3  LYS  47           HB3      LYS  47 -19.284   8.009  -9.002
    5    HG2  LYS  47           HG2      LYS  47 -16.744   9.390  -8.220
    6    HG3  LYS  47           HG3      LYS  47 -16.807   7.673  -8.614
    7    HD2  LYS  47           HD2      LYS  47 -17.804   8.228 -10.795
    8    HD3  LYS  47           HD3      LYS  47 -17.673   9.942 -10.401
    9    HE2  LYS  47           HE2      LYS  47 -15.247   9.722 -10.237
   10    HE3  LYS  47           HE3      LYS  47 -15.374   8.007 -10.619
   11    HZ3  LYS  47           HZ1      LYS  47 -16.305   8.565 -12.747
   12    HZ2  LYS  47           HZ2      LYS  47 -14.810   9.343 -12.551
   13    HZ1  LYS  47           HZ3      LYS  47 -16.254  10.221 -12.380

  No H/Q in entry =          13
  In of MODEL   41
    1    H    GLY  48           H        GLY  48 -20.610   9.665  -5.908
    2    HA3  GLY  48           HA2      GLY  48 -22.990   8.481  -6.668
    3    HA2  GLY  48           HA3      GLY  48 -22.767   9.447  -5.210

  No H/Q in entry =           3
  In of MODEL   41
    1    H    GLN  49           H        GLN  49 -22.202  11.904  -6.733
    2    HA   GLN  49           HA       GLN  49 -24.767  13.004  -6.850
    3    HB2  GLN  49           HB2      GLN  49 -22.231  13.910  -8.197
    4    HB3  GLN  49           HB3      GLN  49 -23.698  14.865  -8.090
    5    HG2  GLN  49           HG2      GLN  49 -23.535  14.841  -5.654
    6    HG3  GLN  49           HG3      GLN  49 -22.079  13.864  -5.759
    7   HE21  GLN  49          HE21      GLN  49 -21.973  16.067  -4.441
    8   HE22  GLN  49          HE22      GLN  49 -21.058  17.341  -5.065

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ASN  50           H        ASN  50 -23.082  11.182  -9.278
    2    HA   ASN  50           HA       ASN  50 -24.974  12.086 -11.338
    3    HB2  ASN  50           HB2      ASN  50 -22.386  10.565 -11.608
    4    HB3  ASN  50           HB3      ASN  50 -23.442  11.012 -12.940
    5   HD21  ASN  50          HD21      ASN  50 -20.806  11.840 -11.317
    6   HD22  ASN  50          HD22      ASN  50 -20.582  13.483 -11.627

  No H/Q in entry =           6
  In of MODEL   41
    1    H    ALA  51           H        ALA  51 -24.943   9.685  -9.140
    2    HA   ALA  51           HA       ALA  51 -25.719   7.573 -11.008
    3    HB2  ALA  51           HB1      ALA  51 -25.125   6.193  -9.350
    4    HB3  ALA  51           HB2      ALA  51 -26.250   6.974  -8.239
    5    HB1  ALA  51           HB3      ALA  51 -24.615   7.607  -8.427

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ASP  52           H        ASP  52 -27.719   6.505 -10.885
    2    HA   ASP  52           HA       ASP  52 -29.908   8.314 -10.180
    3    HB2  ASP  52           HB2      ASP  52 -29.708   5.844 -11.901
    4    HB3  ASP  52           HB3      ASP  52 -31.256   6.561 -11.448

  No H/Q in entry =           4
  In of MODEL   41
    1    H    VAL  53           H        VAL  53 -28.292   5.412  -9.225
    2    HA   VAL  53           HA       VAL  53 -29.727   5.482  -6.704
    3    HB   VAL  53           HB       VAL  53 -31.122   3.859  -7.979
    4   HG11  VAL  53          HG11      VAL  53 -29.374   3.038  -9.521
    5   HG13  VAL  53          HG12      VAL  53 -30.200   1.723  -8.687
    6   HG12  VAL  53          HG13      VAL  53 -28.591   2.222  -8.169
    7   HG23  VAL  53          HG21      VAL  53 -30.288   1.853  -6.328
    8   HG22  VAL  53          HG22      VAL  53 -31.421   3.144  -5.933
    9   HG21  VAL  53          HG23      VAL  53 -29.714   3.315  -5.525

  No H/Q in entry =           9
  In of MODEL   41
    1    H    VAL  54           H        VAL  54 -28.410   5.022  -5.060
    2    HA   VAL  54           HA       VAL  54 -25.647   4.196  -5.694
    3    HB   VAL  54           HB       VAL  54 -26.721   5.924  -3.407
    4   HG11  VAL  54          HG11      VAL  54 -24.137   4.521  -3.731
    5   HG13  VAL  54          HG12      VAL  54 -24.889   5.168  -2.274
    6   HG12  VAL  54          HG13      VAL  54 -23.990   6.237  -3.351
    7   HG22  VAL  54          HG21      VAL  54 -25.871   7.763  -4.471
    8   HG21  VAL  54          HG22      VAL  54 -26.416   6.798  -5.842
    9   HG23  VAL  54          HG23      VAL  54 -24.708   6.821  -5.406

  No H/Q in entry =           9
  In of MODEL   41
    1    H    LEU  55           H        LEU  55 -25.047   2.264  -5.092
    2    HA   LEU  55           HA       LEU  55 -26.545   0.904  -2.940
    3    HB2  LEU  55           HB2      LEU  55 -24.989  -0.212  -5.262
    4    HB3  LEU  55           HB3      LEU  55 -25.743  -1.174  -3.991
    5    HG   LEU  55           HG       LEU  55 -27.190   0.450  -6.073
    6   HD13  LEU  55          HD11      LEU  55 -26.886  -1.376  -7.330
    7   HD12  LEU  55          HD12      LEU  55 -27.837  -2.279  -6.151
    8   HD11  LEU  55          HD13      LEU  55 -26.082  -2.211  -6.002
    9   HD23  LEU  55          HD21      LEU  55 -28.474  -1.538  -4.255
   10   HD22  LEU  55          HD22      LEU  55 -29.175  -0.141  -5.073
   11   HD21  LEU  55          HD23      LEU  55 -28.154   0.090  -3.655

  No H/Q in entry =          11
  In of MODEL   41
    1    H    LEU  56           H        LEU  56 -25.388   0.278  -1.149
    2    HA   LEU  56           HA       LEU  56 -22.455   0.685  -1.196
    3    HB2  LEU  56           HB2      LEU  56 -24.252   0.419   1.200
    4    HB3  LEU  56           HB3      LEU  56 -22.545   0.854   1.195
    5    HG   LEU  56           HG       LEU  56 -24.851   2.544   0.269
    6   HD11  LEU  56          HD11      LEU  56 -23.729   2.116   2.779
    7   HD13  LEU  56          HD12      LEU  56 -24.726   3.491   2.303
    8   HD12  LEU  56          HD13      LEU  56 -22.970   3.603   2.214
    9   HD23  LEU  56          HD21      LEU  56 -22.913   4.253   0.106
   10   HD22  LEU  56          HD22      LEU  56 -23.295   3.182  -1.242
   11   HD21  LEU  56          HD23      LEU  56 -21.937   2.812  -0.179

  No H/Q in entry =          11
  In of MODEL   41
    1    H    GLY  57           H        GLY  57 -21.068  -0.951  -0.698
    2    HA3  GLY  57           HA2      GLY  57 -21.982  -3.636  -0.949
    3    HA2  GLY  57           HA3      GLY  57 -20.360  -3.145  -0.463

  No H/Q in entry =           3
  In of MODEL   41
    1    HA   PRO  58           HA       PRO  58 -23.159  -4.269   3.232
    2    HB2  PRO  58           HB2      PRO  58 -22.464  -6.882   3.785
    3    HB3  PRO  58           HB3      PRO  58 -23.852  -6.459   2.783
    4    HG2  PRO  58           HG2      PRO  58 -21.123  -7.314   1.974
    5    HG3  PRO  58           HG3      PRO  58 -22.688  -7.766   1.296
    6    HD2  PRO  58           HD2      PRO  58 -21.087  -5.919   0.107
    7    HD3  PRO  58           HD3      PRO  58 -22.846  -5.837   0.010

  No H/Q in entry =           7
  In of MODEL   41
    1    H    GLN  59           H        GLN  59 -19.787  -4.717   2.609
    2    HA   GLN  59           HA       GLN  59 -19.026  -4.789   5.368
    3    HB2  GLN  59           HB2      GLN  59 -17.425  -3.842   2.985
    4    HB3  GLN  59           HB3      GLN  59 -16.787  -4.176   4.582
    5    HG2  GLN  59           HG2      GLN  59 -18.062  -6.196   2.747
    6    HG3  GLN  59           HG3      GLN  59 -16.336  -5.982   2.987
    7   HE21  GLN  59          HE21      GLN  59 -18.600  -7.778   3.712
    8   HE22  GLN  59          HE22      GLN  59 -18.405  -8.595   5.148

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ILE  60           H        ILE  60 -19.973  -2.197   3.213
    2    HA   ILE  60           HA       ILE  60 -19.122  -0.279   5.295
    3    HB   ILE  60           HB       ILE  60 -19.356   1.488   3.509
    4   HG12  ILE  60          HG12      ILE  60 -19.181  -0.689   1.471
    5   HG13  ILE  60          HG13      ILE  60 -20.762  -0.164   2.048
    6   HG21  ILE  60          HG21      ILE  60 -17.233   0.179   4.202
    7   HG23  ILE  60          HG22      ILE  60 -17.203   1.251   2.802
    8   HG22  ILE  60          HG23      ILE  60 -17.351  -0.491   2.575
    9   HD13  ILE  60          HD11      ILE  60 -20.445   1.165   0.158
   10   HD12  ILE  60          HD12      ILE  60 -18.722   1.371   0.470
   11   HD11  ILE  60          HD13      ILE  60 -19.905   2.228   1.457

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ALA  61           H        ALA  61 -21.573  -1.872   5.338
    2    HA   ALA  61           HA       ALA  61 -23.805  -0.206   4.917
    3    HB1  ALA  61           HB1      ALA  61 -25.013  -1.725   6.215
    4    HB2  ALA  61           HB2      ALA  61 -23.612  -2.130   7.206
    5    HB3  ALA  61           HB3      ALA  61 -23.709  -2.703   5.542

  No H/Q in entry =           5
  In of MODEL   41
    1    H    TYR  62           H        TYR  62 -21.592  -0.367   7.708
    2    HA   TYR  62           HA       TYR  62 -23.148   1.252   9.414
    3    HB2  TYR  62           HB2      TYR  62 -21.103   1.662  10.649
    4    HB3  TYR  62           HB3      TYR  62 -21.163  -0.030  10.159
    5    HD1  TYR  62           HD1      TYR  62 -19.566  -0.924   8.529
    6    HD2  TYR  62           HD2      TYR  62 -19.415   3.185   9.691
    7    HE1  TYR  62           HE1      TYR  62 -17.358  -0.707   7.457
    8    HE2  TYR  62           HE2      TYR  62 -17.192   3.396   8.620
    9    HH   TYR  62           HH       TYR  62 -15.448   2.169   7.822

  No H/Q in entry =           9
  In of MODEL   41
    1    H    MET  63           H        MET  63 -21.514   2.172   6.572
    2    HA   MET  63           HA       MET  63 -21.352   4.991   7.322
    3    HB2  MET  63           HB2      MET  63 -20.741   3.514   4.761
    4    HB3  MET  63           HB3      MET  63 -20.564   5.258   4.964
    5    HG2  MET  63           HG2      MET  63 -18.859   4.886   6.664
    6    HG3  MET  63           HG3      MET  63 -19.033   3.144   6.456
    7    HE1  MET  63           HE1      MET  63 -16.681   3.445   6.374
    8    HE3  MET  63           HE2      MET  63 -15.740   4.388   5.217
    9    HE2  MET  63           HE3      MET  63 -16.158   2.712   4.856

  No H/Q in entry =           9
  In of MODEL   41
    1    H    LEU  64           H        LEU  64 -23.914   3.150   6.326
    2    HA   LEU  64           HA       LEU  64 -25.131   4.607   4.278
    3    HB2  LEU  64           HB2      LEU  64 -25.993   2.482   5.156
    4    HB3  LEU  64           HB3      LEU  64 -26.448   3.293   6.654
    5    HG   LEU  64           HG       LEU  64 -28.149   4.568   5.455
    6   HD13  LEU  64          HD11      LEU  64 -27.872   4.854   3.227
    7   HD12  LEU  64          HD12      LEU  64 -28.514   3.221   3.051
    8   HD11  LEU  64          HD13      LEU  64 -26.771   3.482   3.110
    9   HD23  LEU  64          HD21      LEU  64 -28.663   1.770   4.652
   10   HD22  LEU  64          HD22      LEU  64 -29.652   2.883   5.597
   11   HD21  LEU  64          HD23      LEU  64 -28.273   2.078   6.344

  No H/Q in entry =          11
  In of MODEL   41
    1    HA   PRO  65           HA       PRO  65 -27.311   7.701   7.098
    2    HB2  PRO  65           HB2      PRO  65 -25.305   7.818   9.349
    3    HB3  PRO  65           HB3      PRO  65 -27.045   8.095   9.405
    4    HG2  PRO  65           HG2      PRO  65 -26.109   5.825  10.285
    5    HG3  PRO  65           HG3      PRO  65 -27.532   5.810   9.242
    6    HD2  PRO  65           HD2      PRO  65 -24.660   5.214   8.520
    7    HD3  PRO  65           HD3      PRO  65 -26.118   4.335   8.059

  No H/Q in entry =           7
  In of MODEL   41
    1    H    GLU  66           H        GLU  66 -23.755   7.649   7.161
    2    HA   GLU  66           HA       GLU  66 -23.461  10.456   6.811
    3    HB2  GLU  66           HB2      GLU  66 -21.647   8.164   6.110
    4    HB3  GLU  66           HB3      GLU  66 -21.200   9.860   5.934
    5    HG2  GLU  66           HG2      GLU  66 -21.406  10.183   8.309
    6    HG3  GLU  66           HG3      GLU  66 -21.930   8.510   8.509

  No H/Q in entry =           6
  In of MODEL   41
    1    H    ILE  67           H        ILE  67 -23.567   7.755   4.505
    2    HA   ILE  67           HA       ILE  67 -23.157   9.509   2.245
    3    HB   ILE  67           HB       ILE  67 -24.054   6.599   2.369
    4   HG12  ILE  67          HG12      ILE  67 -21.426   7.788   1.464
    5   HG13  ILE  67          HG13      ILE  67 -21.716   7.335   3.142
    6   HG21  ILE  67          HG21      ILE  67 -24.002   8.521   0.182
    7   HG23  ILE  67          HG22      ILE  67 -24.627   6.872   0.202
    8   HG22  ILE  67          HG23      ILE  67 -22.919   7.164  -0.126
    9   HD12  ILE  67          HD11      ILE  67 -21.302   5.610   0.756
   10   HD11  ILE  67          HD12      ILE  67 -22.313   5.011   2.070
   11   HD13  ILE  67          HD13      ILE  67 -20.639   5.470   2.384

  No H/Q in entry =          11
  In of MODEL   41
    1    H    GLN  68           H        GLN  68 -26.022   8.423   3.864
    2    HA   GLN  68           HA       GLN  68 -27.856   9.392   1.914
    3    HB2  GLN  68           HB2      GLN  68 -28.105   8.975   4.890
    4    HB3  GLN  68           HB3      GLN  68 -29.427   9.591   3.913
    5    HG2  GLN  68           HG2      GLN  68 -29.459   7.586   2.596
    6    HG3  GLN  68           HG3      GLN  68 -28.008   6.994   3.383
    7   HE21  GLN  68          HE21      GLN  68 -30.187   5.639   3.226
    8   HE22  GLN  68          HE22      GLN  68 -31.013   5.156   4.634

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ARG  69           H        ARG  69 -26.243  11.003   4.680
    2    HA   ARG  69           HA       ARG  69 -27.605  13.494   4.328
    3    HB2  ARG  69           HB2      ARG  69 -25.257  12.530   5.891
    4    HB3  ARG  69           HB3      ARG  69 -25.335  14.256   5.567
    5    HG2  ARG  69           HG2      ARG  69 -27.649  14.283   6.545
    6    HG3  ARG  69           HG3      ARG  69 -27.441  12.583   6.985
    7    HD2  ARG  69           HD2      ARG  69 -25.743  14.917   7.941
    8    HD3  ARG  69           HD3      ARG  69 -26.871  13.993   8.921
    9    HE   ARG  69           HE       ARG  69 -24.263  13.077   7.945
   10   HH21  ARG  69          HH11      ARG  69 -23.454  11.288   9.103
   11   HH22  ARG  69          HH12      ARG  69 -24.481  10.452  10.218
   12   HH11  ARG  69          HH21      ARG  69 -27.216  12.500   9.640
   13   HH12  ARG  69          HH22      ARG  69 -26.611  11.135  10.520

  No H/Q in entry =          13
  In of MODEL   41
    1    H    LEU  70           H        LEU  70 -24.740  12.110   2.932
    2    HA   LEU  70           HA       LEU  70 -23.625  14.496   1.808
    3    HB2  LEU  70           HB2      LEU  70 -22.634  12.166   2.353
    4    HB3  LEU  70           HB3      LEU  70 -23.254  11.734   0.761
    5    HG   LEU  70           HG       LEU  70 -21.661  13.124  -0.302
    6   HD11  LEU  70          HD11      LEU  70 -20.829  13.910   2.501
    7   HD13  LEU  70          HD12      LEU  70 -21.526  14.970   1.276
    8   HD12  LEU  70          HD13      LEU  70 -19.917  14.290   1.038
    9   HD22  LEU  70          HD21      LEU  70 -20.231  11.400  -0.107
   10   HD21  LEU  70          HD22      LEU  70 -21.154  10.852   1.291
   11   HD23  LEU  70          HD23      LEU  70 -19.766  11.917   1.514

  No H/Q in entry =          11
  In of MODEL   41
    1    H    LEU  71           H        LEU  71 -25.788  11.982   0.648
    2    HA   LEU  71           HA       LEU  71 -26.316  13.521  -1.836
    3    HB2  LEU  71           HB2      LEU  71 -26.530  10.529  -1.450
    4    HB3  LEU  71           HB3      LEU  71 -26.660  11.421  -2.964
    5    HG   LEU  71           HG       LEU  71 -24.135  11.392  -1.312
    6   HD12  LEU  71          HD11      LEU  71 -24.201   9.814  -3.775
    7   HD11  LEU  71          HD12      LEU  71 -25.209   9.167  -2.482
    8   HD13  LEU  71          HD13      LEU  71 -23.488   9.435  -2.207
    9   HD22  LEU  71          HD21      LEU  71 -24.236  13.239  -2.768
   10   HD21  LEU  71          HD22      LEU  71 -24.742  12.225  -4.119
   11   HD23  LEU  71          HD23      LEU  71 -23.118  12.059  -3.450

  No H/Q in entry =          11
  In of MODEL   41
    1    HA   PRO  72           HA       PRO  72 -30.177  13.034   0.787
    2    HB2  PRO  72           HB2      PRO  72 -31.023  15.600   0.760
    3    HB3  PRO  72           HB3      PRO  72 -29.713  15.120   1.839
    4    HG2  PRO  72           HG2      PRO  72 -29.530  16.370  -0.891
    5    HG3  PRO  72           HG3      PRO  72 -28.756  16.887   0.606
    6    HD2  PRO  72           HD2      PRO  72 -27.432  15.359  -1.195
    7    HD3  PRO  72           HD3      PRO  72 -27.173  15.156   0.537

  No H/Q in entry =           7
  In of MODEL   41
    1    H    ASN  73           H        ASN  73 -29.558  14.051  -2.409
    2    HA   ASN  73           HA       ASN  73 -32.421  13.769  -3.039
    3    HB2  ASN  73           HB2      ASN  73 -31.957  14.915  -5.115
    4    HB3  ASN  73           HB3      ASN  73 -31.425  15.865  -3.736
    5   HD21  ASN  73          HD21      ASN  73 -30.637  15.960  -6.414
    6   HD22  ASN  73          HD22      ASN  73 -28.971  15.794  -6.614

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LYS  74           H        LYS  74 -30.452  11.495  -2.666
    2    HA   LYS  74           HA       LYS  74 -31.035  10.155  -5.239
    3    HB2  LYS  74           HB2      LYS  74 -28.499   9.817  -3.632
    4    HB3  LYS  74           HB3      LYS  74 -28.891   9.037  -5.166
    5    HG2  LYS  74           HG2      LYS  74 -28.609  12.001  -4.904
    6    HG3  LYS  74           HG3      LYS  74 -27.242  10.936  -5.234
    7    HD2  LYS  74           HD2      LYS  74 -28.370  10.054  -7.192
    8    HD3  LYS  74           HD3      LYS  74 -29.783  11.053  -6.848
    9    HE2  LYS  74           HE2      LYS  74 -28.547  13.061  -7.253
   10    HE3  LYS  74           HE3      LYS  74 -27.031  12.164  -7.367
   11    HZ2  LYS  74           HZ1      LYS  74 -28.505  12.818  -9.476
   12    HZ1  LYS  74           HZ2      LYS  74 -29.167  11.292  -9.131
   13    HZ3  LYS  74           HZ3      LYS  74 -27.503  11.448  -9.430

  No H/Q in entry =          13
  In of MODEL   41
    1    HA   PRO  75           HA       PRO  75 -32.438   7.119  -2.324
    2    HB2  PRO  75           HB2      PRO  75 -32.767   4.935  -3.950
    3    HB3  PRO  75           HB3      PRO  75 -33.884   6.298  -3.988
    4    HG2  PRO  75           HG2      PRO  75 -31.556   5.722  -5.779
    5    HG3  PRO  75           HG3      PRO  75 -33.202   6.179  -6.212
    6    HD2  PRO  75           HD2      PRO  75 -31.249   8.030  -6.137
    7    HD3  PRO  75           HD3      PRO  75 -32.877   8.429  -5.586

  No H/Q in entry =           7
  In of MODEL   41
    1    H    VAL  76           H        VAL  76 -30.988   6.027  -0.977
    2    HA   VAL  76           HA       VAL  76 -28.534   4.824  -2.116
    3    HB   VAL  76           HB       VAL  76 -28.806   6.239   0.571
    4   HG11  VAL  76          HG11      VAL  76 -26.461   4.964  -0.853
    5   HG13  VAL  76          HG12      VAL  76 -27.156   4.488   0.698
    6   HG12  VAL  76          HG13      VAL  76 -26.300   6.022   0.550
    7   HG22  VAL  76          HG21      VAL  76 -28.127   8.153  -0.280
    8   HG21  VAL  76          HG22      VAL  76 -28.679   7.492  -1.820
    9   HG23  VAL  76          HG23      VAL  76 -26.976   7.383  -1.372

  No H/Q in entry =           9
  In of MODEL   41
    1    H    GLU  77           H        GLU  77 -28.330   2.657  -1.547
    2    HA   GLU  77           HA       GLU  77 -29.115   1.822   1.093
    3    HB2  GLU  77           HB2      GLU  77 -30.734   0.196   0.535
    4    HB3  GLU  77           HB3      GLU  77 -31.275   1.736  -0.135
    5    HG2  GLU  77           HG2      GLU  77 -30.677   1.018  -2.339
    6    HG3  GLU  77           HG3      GLU  77 -30.043  -0.496  -1.698

  No H/Q in entry =           6
  In of MODEL   41
    1    H    VAL  78           H        VAL  78 -28.799  -0.280   1.711
    2    HA   VAL  78           HA       VAL  78 -26.140  -1.050   0.800
    3    HB   VAL  78           HB       VAL  78 -27.847  -1.970   3.152
    4   HG11  VAL  78          HG11      VAL  78 -25.519  -3.191   1.996
    5   HG13  VAL  78          HG12      VAL  78 -26.426  -3.685   3.428
    6   HG12  VAL  78          HG13      VAL  78 -25.099  -2.535   3.578
    7   HG22  VAL  78          HG21      VAL  78 -26.377  -0.643   4.513
    8   HG21  VAL  78          HG22      VAL  78 -27.110   0.356   3.259
    9   HG23  VAL  78          HG23      VAL  78 -25.437  -0.178   3.094

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ILE  79           H        ILE  79 -25.618  -2.943  -0.145
    2    HA   ILE  79           HA       ILE  79 -27.691  -4.381  -1.515
    3    HB   ILE  79           HB       ILE  79 -24.704  -4.931  -1.313
    4   HG12  ILE  79          HG12      ILE  79 -26.339  -3.772  -3.574
    5   HG13  ILE  79          HG13      ILE  79 -25.456  -2.790  -2.404
    6   HG22  ILE  79          HG21      ILE  79 -25.819  -6.058  -3.651
    7   HG21  ILE  79          HG22      ILE  79 -26.803  -6.600  -2.292
    8   HG23  ILE  79          HG23      ILE  79 -25.064  -6.890  -2.292
    9   HD13  ILE  79          HD11      ILE  79 -24.048  -2.877  -4.228
   10   HD12  ILE  79          HD12      ILE  79 -24.398  -4.577  -4.542
   11   HD11  ILE  79          HD13      ILE  79 -23.408  -4.122  -3.154

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ASP  80           H        ASP  80 -28.566  -6.310  -0.968
    2    HA   ASP  80           HA       ASP  80 -28.512  -7.263   1.660
    3    HB2  ASP  80           HB2      ASP  80 -30.273  -7.795   0.015
    4    HB3  ASP  80           HB3      ASP  80 -29.124  -8.793  -0.876

  No H/Q in entry =           4
  In of MODEL   41
    1    H    SER  81           H        SER  81 -26.980  -8.428   2.764
    2    HA   SER  81           HA       SER  81 -24.491  -9.102   1.553
    3    HB2  SER  81           HB2      SER  81 -23.941 -10.178   3.700
    4    HB3  SER  81           HB3      SER  81 -24.630  -8.574   3.946
    5    HG   SER  81           HG       SER  81 -26.662 -10.124   3.956

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU  82           H        LEU  82 -27.214 -11.183   1.841
    2    HA   LEU  82           HA       LEU  82 -25.682 -13.551   1.271
    3    HB2  LEU  82           HB2      LEU  82 -28.616 -13.033   0.847
    4    HB3  LEU  82           HB3      LEU  82 -27.822 -14.602   0.972
    5    HG   LEU  82           HG       LEU  82 -28.132 -12.613   3.202
    6   HD11  LEU  82          HD11      LEU  82 -29.530 -15.218   2.550
    7   HD13  LEU  82          HD12      LEU  82 -30.261 -13.614   2.643
    8   HD12  LEU  82          HD13      LEU  82 -29.650 -14.390   4.105
    9   HD21  LEU  82          HD21      LEU  82 -26.841 -15.320   2.923
   10   HD23  LEU  82          HD22      LEU  82 -27.345 -14.683   4.489
   11   HD22  LEU  82          HD23      LEU  82 -26.131 -13.827   3.539

  No H/Q in entry =          11
  In of MODEL   41
    1    H    LEU  83           H        LEU  83 -27.632 -11.276  -0.600
    2    HA   LEU  83           HA       LEU  83 -27.446 -12.588  -3.097
    3    HB2  LEU  83           HB2      LEU  83 -27.836  -9.690  -2.393
    4    HB3  LEU  83           HB3      LEU  83 -27.875 -10.304  -4.045
    5    HG   LEU  83           HG       LEU  83 -29.906 -10.719  -1.871
    6   HD13  LEU  83          HD11      LEU  83 -30.653  -8.847  -2.897
    7   HD12  LEU  83          HD12      LEU  83 -31.126  -9.933  -4.202
    8   HD11  LEU  83          HD13      LEU  83 -29.587  -9.075  -4.282
    9   HD23  LEU  83          HD21      LEU  83 -30.061 -11.924  -4.619
   10   HD22  LEU  83          HD22      LEU  83 -31.029 -12.295  -3.193
   11   HD21  LEU  83          HD23      LEU  83 -29.343 -12.808  -3.272

  No H/Q in entry =          11
  In of MODEL   41
    1    H    TYR  84           H        TYR  84 -25.472 -10.248  -1.381
    2    HA   TYR  84           HA       TYR  84 -23.614  -9.730  -3.506
    3    HB2  TYR  84           HB2      TYR  84 -24.080  -8.236  -1.521
    4    HB3  TYR  84           HB3      TYR  84 -23.186  -9.391  -0.535
    5    HD1  TYR  84           HD1      TYR  84 -20.761  -9.962  -1.422
    6    HD2  TYR  84           HD2      TYR  84 -22.930  -6.421  -2.418
    7    HE1  TYR  84           HE1      TYR  84 -18.641  -8.851  -2.034
    8    HE2  TYR  84           HE2      TYR  84 -20.820  -5.301  -3.044
    9    HH   TYR  84           HH       TYR  84 -18.252  -6.534  -3.846

  No H/Q in entry =           9
  In of MODEL   41
    1    H    GLY  85           H        GLY  85 -23.378 -11.791  -0.600
    2    HA3  GLY  85           HA2      GLY  85 -20.808 -12.741  -1.108
    3    HA2  GLY  85           HA3      GLY  85 -22.041 -13.597  -0.183

  No H/Q in entry =           3
  In of MODEL   41
    1    H    LYS  86           H        LYS  86 -23.896 -13.920  -2.245
    2    HA   LYS  86           HA       LYS  86 -22.861 -16.276  -3.553
    3    HB2  LYS  86           HB2      LYS  86 -25.498 -14.811  -3.612
    4    HB3  LYS  86           HB3      LYS  86 -25.205 -16.350  -4.419
    5    HG2  LYS  86           HG2      LYS  86 -24.888 -17.432  -2.302
    6    HG3  LYS  86           HG3      LYS  86 -25.085 -15.893  -1.462
    7    HD2  LYS  86           HD2      LYS  86 -27.223 -16.900  -1.395
    8    HD3  LYS  86           HD3      LYS  86 -27.322 -15.695  -2.678
    9    HE2  LYS  86           HE2      LYS  86 -27.226 -17.314  -4.365
   10    HE3  LYS  86           HE3      LYS  86 -26.603 -18.546  -3.267
   11    HZ3  LYS  86           HZ1      LYS  86 -28.645 -19.023  -2.496
   12    HZ2  LYS  86           HZ2      LYS  86 -29.172 -18.334  -3.958
   13    HZ1  LYS  86           HZ3      LYS  86 -29.169 -17.407  -2.536

  No H/Q in entry =          13
  In of MODEL   41
    1    H    VAL  87           H        VAL  87 -22.832 -13.044  -4.385
    2    HA   VAL  87           HA       VAL  87 -22.531 -11.836  -6.304
    3    HB   VAL  87           HB       VAL  87 -21.475 -14.342  -7.655
    4   HG12  VAL  87          HG11      VAL  87 -20.303 -11.570  -7.730
    5   HG11  VAL  87          HG12      VAL  87 -21.701 -11.970  -8.730
    6   HG13  VAL  87          HG13      VAL  87 -20.189 -12.852  -8.935
    7   HG21  VAL  87          HG21      VAL  87 -20.527 -14.283  -5.382
    8   HG23  VAL  87          HG22      VAL  87 -19.932 -12.654  -5.696
    9   HG22  VAL  87          HG23      VAL  87 -19.316 -14.013  -6.633

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ASP  88           H        ASP  88 -25.049 -12.469  -5.957
    2    HA   ASP  88           HA       ASP  88 -26.186 -13.633  -8.374
    3    HB2  ASP  88           HB2      ASP  88 -27.175 -13.916  -6.052
    4    HB3  ASP  88           HB3      ASP  88 -27.618 -12.211  -6.117

  No H/Q in entry =           4
  In of MODEL   41
    1    H    GLY  89           H        GLY  89 -25.478 -12.349  -9.994
    2    HA3  GLY  89           HA2      GLY  89 -25.644  -9.572 -10.142
    3    HA2  GLY  89           HA3      GLY  89 -25.630 -10.667 -11.523

  No H/Q in entry =           3
  In of MODEL   41
    1    H    LEU  90           H        LEU  90 -28.084 -12.013 -11.092
    2    HA   LEU  90           HA       LEU  90 -29.887 -10.047 -12.163
    3    HB2  LEU  90           HB2      LEU  90 -29.968 -12.431 -12.788
    4    HB3  LEU  90           HB3      LEU  90 -30.470 -12.826 -11.144
    5    HG   LEU  90           HG       LEU  90 -32.583 -11.690 -11.479
    6   HD13  LEU  90          HD11      LEU  90 -32.399  -9.922 -12.922
    7   HD12  LEU  90          HD12      LEU  90 -32.950 -11.135 -14.080
    8   HD11  LEU  90          HD13      LEU  90 -31.233 -10.753 -13.954
    9   HD23  LEU  90          HD21      LEU  90 -32.531 -13.274 -13.944
   10   HD22  LEU  90          HD22      LEU  90 -33.507 -13.461 -12.488
   11   HD21  LEU  90          HD23      LEU  90 -31.856 -14.082 -12.530

  No H/Q in entry =          11
  In of MODEL   41
    1    H    GLY  91           H        GLY  91 -29.717 -11.608  -9.009
    2    HA3  GLY  91           HA2      GLY  91 -32.045 -10.503  -7.940
    3    HA2  GLY  91           HA3      GLY  91 -30.654 -11.061  -7.012

  No H/Q in entry =           3
  In of MODEL   41
    1    H    VAL  92           H        VAL  92 -28.728  -9.229  -7.841
    2    HA   VAL  92           HA       VAL  92 -29.501  -6.953  -6.247
    3    HB   VAL  92           HB       VAL  92 -26.963  -7.407  -7.859
    4   HG12  VAL  92          HG11      VAL  92 -27.110  -5.564  -5.498
    5   HG11  VAL  92          HG12      VAL  92 -27.777  -4.988  -7.027
    6   HG13  VAL  92          HG13      VAL  92 -26.083  -5.468  -6.929
    7   HG22  VAL  92          HG21      VAL  92 -26.743  -9.024  -6.297
    8   HG21  VAL  92          HG22      VAL  92 -27.880  -8.259  -5.186
    9   HG23  VAL  92          HG23      VAL  92 -26.224  -7.665  -5.302

  No H/Q in entry =           9
  In of MODEL   41
    1    H    LEU  93           H        LEU  93 -29.110  -7.553  -9.680
    2    HA   LEU  93           HA       LEU  93 -29.444  -4.899 -10.559
    3    HB2  LEU  93           HB2      LEU  93 -28.818  -6.729 -12.057
    4    HB3  LEU  93           HB3      LEU  93 -30.413  -7.453 -11.842
    5    HG   LEU  93           HG       LEU  93 -31.417  -5.463 -12.926
    6   HD11  LEU  93          HD11      LEU  93 -29.556  -3.887 -12.399
    7   HD13  LEU  93          HD12      LEU  93 -30.001  -3.884 -14.107
    8   HD12  LEU  93          HD13      LEU  93 -28.552  -4.736 -13.576
    9   HD23  LEU  93          HD21      LEU  93 -30.389  -5.994 -15.228
   10   HD22  LEU  93          HD22      LEU  93 -31.235  -7.262 -14.342
   11   HD21  LEU  93          HD23      LEU  93 -29.470  -7.215 -14.350

  No H/Q in entry =          11
  In of MODEL   41
    1    H    LYS  94           H        LYS  94 -31.830  -7.448  -9.748
    2    HA   LYS  94           HA       LYS  94 -34.169  -5.982 -10.338
    3    HB2  LYS  94           HB2      LYS  94 -33.659  -8.207  -8.369
    4    HB3  LYS  94           HB3      LYS  94 -35.254  -7.498  -8.618
    5    HG2  LYS  94           HG2      LYS  94 -35.180  -8.230 -10.966
    6    HG3  LYS  94           HG3      LYS  94 -33.622  -8.996 -10.659
    7    HD2  LYS  94           HD2      LYS  94 -34.743 -10.358  -8.855
    8    HD3  LYS  94           HD3      LYS  94 -36.284  -9.692  -9.391
    9    HE2  LYS  94           HE2      LYS  94 -35.782 -10.581 -11.677
   10    HE3  LYS  94           HE3      LYS  94 -34.369 -11.385 -10.994
   11    HZ3  LYS  94           HZ1      LYS  94 -36.228 -12.893 -11.185
   12    HZ2  LYS  94           HZ2      LYS  94 -37.193 -11.879 -10.220
   13    HZ1  LYS  94           HZ3      LYS  94 -35.834 -12.647  -9.551

  No H/Q in entry =          13
  In of MODEL   41
    1    H    ALA  95           H        ALA  95 -32.335  -6.170  -7.298
    2    HA   ALA  95           HA       ALA  95 -34.170  -4.608  -5.783
    3    HB2  ALA  95           HB1      ALA  95 -31.801  -6.006  -5.281
    4    HB3  ALA  95           HB2      ALA  95 -32.769  -5.117  -4.107
    5    HB1  ALA  95           HB3      ALA  95 -31.421  -4.322  -4.918

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA  96           H        ALA  96 -31.531  -3.729  -7.874
    2    HA   ALA  96           HA       ALA  96 -31.417  -0.983  -7.048
    3    HB2  ALA  96           HB1      ALA  96 -30.061  -0.724  -9.159
    4    HB3  ALA  96           HB2      ALA  96 -30.376  -2.424  -9.509
    5    HB1  ALA  96           HB3      ALA  96 -29.453  -1.976  -8.075

  No H/Q in entry =           5
  In of MODEL   41
    1    H    VAL  97           H        VAL  97 -32.968  -2.638  -9.761
    2    HA   VAL  97           HA       VAL  97 -34.029  -0.309 -10.969
    3    HB   VAL  97           HB       VAL  97 -34.857  -3.228 -11.064
    4   HG11  VAL  97          HG11      VAL  97 -36.639  -1.202 -11.504
    5   HG13  VAL  97          HG12      VAL  97 -36.711  -2.779 -12.291
    6   HG12  VAL  97          HG13      VAL  97 -35.952  -1.419 -13.116
    7   HG21  VAL  97          HG21      VAL  97 -33.574  -1.369 -13.068
    8   HG23  VAL  97          HG22      VAL  97 -34.038  -3.041 -13.388
    9   HG22  VAL  97          HG23      VAL  97 -32.783  -2.684 -12.200

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ALA  98           H        ALA  98 -35.217  -2.527  -8.470
    2    HA   ALA  98           HA       ALA  98 -37.768  -1.368  -8.086
    3    HB1  ALA  98           HB1      ALA  98 -36.766  -3.594  -7.100
    4    HB3  ALA  98           HB2      ALA  98 -37.936  -2.679  -6.146
    5    HB2  ALA  98           HB3      ALA  98 -36.213  -2.549  -5.791

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA  99           H        ALA  99 -34.677  -0.623  -6.437
    2    HA   ALA  99           HA       ALA  99 -35.787   1.337  -4.732
    3    HB1  ALA  99           HB1      ALA  99 -33.148   0.442  -5.507
    4    HB2  ALA  99           HB2      ALA  99 -33.686   1.167  -3.992
    5    HB3  ALA  99           HB3      ALA  99 -33.208   2.197  -5.342

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ILE 100           H        ILE 100 -34.757   1.524  -8.089
    2    HA   ILE 100           HA       ILE 100 -34.914   4.377  -8.253
    3    HB   ILE 100           HB       ILE 100 -35.035   2.266 -10.432
    4   HG12  ILE 100          HG12      ILE 100 -32.853   4.227  -9.731
    5   HG13  ILE 100          HG13      ILE 100 -32.900   2.569  -9.133
    6   HG21  ILE 100          HG21      ILE 100 -35.436   5.191 -10.504
    7   HG23  ILE 100          HG22      ILE 100 -35.956   3.949 -11.643
    8   HG22  ILE 100          HG23      ILE 100 -34.299   4.552 -11.692
    9   HD12  ILE 100          HD11      ILE 100 -32.371   3.576 -11.890
   10   HD11  ILE 100          HD12      ILE 100 -33.043   1.961 -11.664
   11   HD13  ILE 100          HD13      ILE 100 -31.491   2.378 -10.942

  No H/Q in entry =          11
  In of MODEL   41
    1    H    LYS 101           H        LYS 101 -37.232   1.802  -9.020
    2    HA   LYS 101           HA       LYS 101 -39.303   3.487  -9.979
    3    HB2  LYS 101           HB2      LYS 101 -39.206   0.690  -8.907
    4    HB3  LYS 101           HB3      LYS 101 -40.754   1.471  -9.231
    5    HG2  LYS 101           HG2      LYS 101 -40.287   1.647 -11.527
    6    HG3  LYS 101           HG3      LYS 101 -38.593   1.224 -11.287
    7    HD2  LYS 101           HD2      LYS 101 -39.862  -0.657 -12.205
    8    HD3  LYS 101           HD3      LYS 101 -39.232  -1.024 -10.600
    9    HE2  LYS 101           HE2      LYS 101 -41.298  -1.712 -10.099
   10    HE3  LYS 101           HE3      LYS 101 -41.740  -0.004 -10.067
   11    HZ3  LYS 101           HZ1      LYS 101 -42.642  -0.112 -12.183
   12    HZ2  LYS 101           HZ2      LYS 101 -43.112  -1.595 -11.504
   13    HZ1  LYS 101           HZ3      LYS 101 -41.809  -1.536 -12.591

  No H/Q in entry =          13
  In of MODEL   41
    1    H    LYS 102           H        LYS 102 -38.812   1.942  -6.802
    2    HA   LYS 102           HA       LYS 102 -41.045   3.131  -5.572
    3    HB2  LYS 102           HB2      LYS 102 -39.821   1.235  -4.599
    4    HB3  LYS 102           HB3      LYS 102 -38.420   2.274  -4.340
    5    HG2  LYS 102           HG2      LYS 102 -39.719   3.649  -2.811
    6    HG3  LYS 102           HG3      LYS 102 -41.124   2.614  -3.072
    7    HD2  LYS 102           HD2      LYS 102 -39.909   0.718  -2.088
    8    HD3  LYS 102           HD3      LYS 102 -38.506   1.754  -1.825
    9    HE2  LYS 102           HE2      LYS 102 -39.843   3.215  -0.382
   10    HE3  LYS 102           HE3      LYS 102 -41.263   2.211  -0.665
   11    HZ1  LYS 102           HZ1      LYS 102 -39.554   0.422   0.296
   12    HZ3  LYS 102           HZ2      LYS 102 -40.653   1.297   1.249
   13    HZ2  LYS 102           HZ3      LYS 102 -39.039   1.811   1.126

  No H/Q in entry =          13
  In of MODEL   41
    1    H    ALA 103           H        ALA 103 -38.083   4.519  -6.567
    2    HA   ALA 103           HA       ALA 103 -38.281   6.798  -4.739
    3    HB2  ALA 103           HB1      ALA 103 -36.289   7.548  -6.306
    4    HB3  ALA 103           HB2      ALA 103 -36.269   5.839  -6.739
    5    HB1  ALA 103           HB3      ALA 103 -36.032   6.326  -5.061

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA 104           H        ALA 104 -38.919   6.140  -8.097
    2    HA   ALA 104           HA       ALA 104 -39.484   8.942  -8.660
    3    HB2  ALA 104           HB1      ALA 104 -39.540   8.319 -10.875
    4    HB1  ALA 104           HB2      ALA 104 -40.278   6.756 -10.526
    5    HB3  ALA 104           HB3      ALA 104 -38.553   7.000 -10.248

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA 105           H        ALA 105 -41.103   6.815  -6.893
    2    HA   ALA 105           HA       ALA 105 -43.516   8.227  -6.829
    3    HB2  ALA 105           HB1      ALA 105 -44.275   7.415  -8.882
    4    HB3  ALA 105           HB2      ALA 105 -44.917   6.209  -7.768
    5    HB1  ALA 105           HB3      ALA 105 -43.453   5.867  -8.688

  No H/Q in entry =           5
  In of MODEL   42
    1    H1   ALA   1           H3       ALA   1 -12.466 -15.463  -2.262
    2    H2   ALA   1           H2       ALA   1 -11.543 -16.617  -3.107
    3    H3   ALA   1           H1       ALA   1 -12.679 -15.658  -3.935
    4    HA   ALA   1           HA       ALA   1 -14.098 -17.340  -3.689
    5    HB3  ALA   1           HB1      ALA   1 -12.723 -19.130  -3.234
    6    HB1  ALA   1           HB2      ALA   1 -13.471 -19.008  -1.641
    7    HB2  ALA   1           HB3      ALA   1 -11.887 -18.287  -1.929

  No H/Q in entry =           7
  In of MODEL   42
    1    H    GLU   2           H        GLU   2 -15.725 -18.174  -2.028
    2    HA   GLU   2           HA       GLU   2 -17.346 -16.433  -0.961
    3    HB2  GLU   2           HB2      GLU   2 -16.431 -18.871   0.579
    4    HB3  GLU   2           HB3      GLU   2 -17.942 -18.001   0.840
    5    HG2  GLU   2           HG2      GLU   2 -18.944 -19.074  -0.891
    6    HG3  GLU   2           HG3      GLU   2 -17.621 -18.690  -1.981

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLU   3           H        GLU   3 -15.439 -17.811   1.653
    2    HA   GLU   3           HA       GLU   3 -15.623 -15.455   3.212
    3    HB2  GLU   3           HB2      GLU   3 -14.070 -18.023   3.455
    4    HB3  GLU   3           HB3      GLU   3 -13.816 -16.706   4.601
    5    HG2  GLU   3           HG2      GLU   3 -16.008 -16.830   5.429
    6    HG3  GLU   3           HG3      GLU   3 -16.620 -17.621   3.982

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LEU   4           H        LEU   4 -12.694 -16.972   1.807
    2    HA   LEU   4           HA       LEU   4 -10.833 -15.093   2.398
    3    HB2  LEU   4           HB2      LEU   4 -11.092 -16.387  -0.326
    4    HB3  LEU   4           HB3      LEU   4  -9.628 -15.685   0.352
    5    HG   LEU   4           HG       LEU   4 -11.148 -18.063   1.471
    6   HD13  LEU   4          HD11      LEU   4  -9.537 -19.440   0.535
    7   HD12  LEU   4          HD12      LEU   4  -8.311 -18.173   0.503
    8   HD11  LEU   4          HD13      LEU   4  -9.605 -18.177  -0.694
    9   HD23  LEU   4          HD21      LEU   4  -8.892 -18.156   2.843
   10   HD22  LEU   4          HD22      LEU   4 -10.197 -17.100   3.378
   11   HD21  LEU   4          HD23      LEU   4  -8.829 -16.429   2.490

  No H/Q in entry =          11
  In of MODEL   42
    1    H    GLU   5           H        GLU   5 -13.176 -14.855  -0.266
    2    HA   GLU   5           HA       GLU   5 -12.145 -12.384  -1.270
    3    HB2  GLU   5           HB2      GLU   5 -13.510 -13.940  -2.636
    4    HB3  GLU   5           HB3      GLU   5 -14.902 -13.587  -1.611
    5    HG2  GLU   5           HG2      GLU   5 -14.775 -11.212  -2.230
    6    HG3  GLU   5           HG3      GLU   5 -13.361 -11.540  -3.232

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLU   6           H        GLU   6 -14.872 -13.227   0.833
    2    HA   GLU   6           HA       GLU   6 -15.740 -10.539   1.237
    3    HB2  GLU   6           HB2      GLU   6 -16.186 -13.081   2.816
    4    HB3  GLU   6           HB3      GLU   6 -16.950 -11.542   3.211
    5    HG2  GLU   6           HG2      GLU   6 -18.001 -11.460   1.005
    6    HG3  GLU   6           HG3      GLU   6 -17.183 -12.948   0.535

  No H/Q in entry =           6
  In of MODEL   42
    1    H    VAL   7           H        VAL   7 -13.454 -12.680   2.798
    2    HA   VAL   7           HA       VAL   7 -12.957 -11.112   5.124
    3    HB   VAL   7           HB       VAL   7 -11.286 -13.178   3.667
    4   HG11  VAL   7          HG11      VAL   7 -10.787 -11.652   6.229
    5   HG13  VAL   7          HG12      VAL   7  -9.696 -11.880   4.864
    6   HG12  VAL   7          HG13      VAL   7 -10.062 -13.232   5.935
    7   HG21  VAL   7          HG21      VAL   7 -13.539 -13.712   4.896
    8   HG23  VAL   7          HG22      VAL   7 -12.602 -13.451   6.367
    9   HG22  VAL   7          HG23      VAL   7 -12.131 -14.717   5.236

  No H/Q in entry =           9
  In of MODEL   42
    1    H    VAL   8           H        VAL   8 -11.461 -11.246   1.907
    2    HA   VAL   8           HA       VAL   8  -9.371  -9.400   2.392
    3    HB   VAL   8           HB       VAL   8 -10.854 -10.072  -0.161
    4   HG13  VAL   8          HG11      VAL   8  -9.866  -7.898  -0.459
    5   HG12  VAL   8          HG12      VAL   8  -8.792  -9.057  -1.244
    6   HG11  VAL   8          HG13      VAL   8  -8.376  -8.402   0.340
    7   HG21  VAL   8          HG21      VAL   8  -9.165 -11.667   1.329
    8   HG23  VAL   8          HG22      VAL   8  -8.024 -10.868   0.253
    9   HG22  VAL   8          HG23      VAL   8  -9.353 -11.806  -0.419

  No H/Q in entry =           9
  In of MODEL   42
    1    H    MET   9           H        MET   9 -12.716  -8.966   1.246
    2    HA   MET   9           HA       MET   9 -12.618  -6.191   0.811
    3    HB2  MET   9           HB2      MET   9 -14.844  -8.052   1.627
    4    HB3  MET   9           HB3      MET   9 -15.115  -6.316   1.459
    5    HG2  MET   9           HG2      MET   9 -13.999  -6.579  -0.866
    6    HG3  MET   9           HG3      MET   9 -14.302  -8.303  -0.656
    7    HE3  MET   9           HE1      MET   9 -18.059  -8.692  -0.420
    8    HE2  MET   9           HE2      MET   9 -16.885  -8.613   0.889
    9    HE1  MET   9           HE3      MET   9 -16.473  -9.453  -0.603

  No H/Q in entry =           9
  In of MODEL   42
    1    H    GLY  10           H        GLY  10 -13.293  -8.074   3.741
    2    HA3  GLY  10           HA2      GLY  10 -13.806  -5.882   5.462
    3    HA2  GLY  10           HA3      GLY  10 -13.260  -7.479   5.974

  No H/Q in entry =           3
  In of MODEL   42
    1    H    LEU  11           H        LEU  11 -10.822  -7.634   4.649
    2    HA   LEU  11           HA       LEU  11  -9.096  -6.223   6.399
    3    HB2  LEU  11           HB2      LEU  11  -8.578  -7.653   3.789
    4    HB3  LEU  11           HB3      LEU  11  -7.295  -6.964   4.782
    5    HG   LEU  11           HG       LEU  11  -9.319  -8.972   5.807
    6   HD13  LEU  11          HD11      LEU  11  -8.119 -10.224   4.237
    7   HD12  LEU  11          HD12      LEU  11  -7.181 -10.475   5.709
    8   HD11  LEU  11          HD13      LEU  11  -6.631  -9.316   4.499
    9   HD22  LEU  11          HD21      LEU  11  -8.445  -7.970   7.720
   10   HD21  LEU  11          HD22      LEU  11  -6.905  -7.588   6.951
   11   HD23  LEU  11          HD23      LEU  11  -7.250  -9.240   7.462

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  12           H        ILE  12 -10.005  -5.664   3.013
    2    HA   ILE  12           HA       ILE  12  -8.287  -3.455   2.580
    3    HB   ILE  12           HB       ILE  12 -10.955  -4.090   1.295
    4   HG12  ILE  12          HG12      ILE  12  -8.935  -5.768   1.214
    5   HG13  ILE  12          HG13      ILE  12  -9.807  -5.407  -0.262
    6   HG21  ILE  12          HG21      ILE  12  -8.708  -2.225   0.469
    7   HG23  ILE  12          HG22      ILE  12 -10.372  -1.779   0.829
    8   HG22  ILE  12          HG23      ILE  12  -9.998  -2.730  -0.580
    9   HD12  ILE  12          HD11      ILE  12  -7.311  -5.382  -0.505
   10   HD11  ILE  12          HD12      ILE  12  -7.260  -4.026   0.619
   11   HD13  ILE  12          HD13      ILE  12  -8.060  -3.853  -0.924

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  13           H        ILE  13 -11.647  -3.681   3.686
    2    HA   ILE  13           HA       ILE  13 -12.072  -0.889   3.958
    3    HB   ILE  13           HB       ILE  13 -13.300  -3.296   5.322
    4   HG12  ILE  13          HG12      ILE  13 -13.530  -2.739   2.786
    5   HG13  ILE  13          HG13      ILE  13 -14.955  -3.189   3.697
    6   HG21  ILE  13          HG21      ILE  13 -13.832  -0.368   5.699
    7   HG23  ILE  13          HG22      ILE  13 -13.843  -1.656   6.896
    8   HG22  ILE  13          HG23      ILE  13 -15.190  -1.488   5.772
    9   HD11  ILE  13          HD11      ILE  13 -14.128  -0.312   3.245
   10   HD13  ILE  13          HD12      ILE  13 -15.632  -0.907   3.922
   11   HD12  ILE  13          HD13      ILE  13 -15.284  -1.182   2.229

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ASN  14           H        ASN  14 -10.981  -3.392   6.228
    2    HA   ASN  14           HA       ASN  14 -10.752  -1.757   8.513
    3    HB2  ASN  14           HB2      ASN  14 -10.531  -4.367   8.190
    4    HB3  ASN  14           HB3      ASN  14  -8.818  -4.000   8.026
    5   HD21  ASN  14          HD21      ASN  14  -9.464  -5.517  10.205
    6   HD22  ASN  14          HD22      ASN  14  -9.420  -4.597  11.629

  No H/Q in entry =           6
  In of MODEL   42
    1    H    SER  15           H        SER  15  -8.370  -2.608   6.012
    2    HA   SER  15           HA       SER  15  -6.205  -1.140   7.075
    3    HB2  SER  15           HB2      SER  15  -5.196  -1.365   4.912
    4    HB3  SER  15           HB3      SER  15  -6.165  -2.816   5.142
    5    HG   SER  15           HG       SER  15  -6.933  -2.190   3.268

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLY  16           H        GLY  16  -8.805  -0.244   4.839
    2    HA3  GLY  16           HA2      GLY  16  -7.920   2.387   4.283
    3    HA2  GLY  16           HA3      GLY  16  -9.578   1.811   4.128

  No H/Q in entry =           3
  In of MODEL   42
    1    H    GLN  17           H        GLN  17 -10.119   1.092   6.780
    2    HA   GLN  17           HA       GLN  17 -10.794   3.604   7.923
    3    HB2  GLN  17           HB2      GLN  17 -10.716   0.823   9.112
    4    HB3  GLN  17           HB3      GLN  17 -11.335   2.232   9.973
    5    HG2  GLN  17           HG2      GLN  17 -12.356   1.281   7.280
    6    HG3  GLN  17           HG3      GLN  17 -13.134   0.931   8.824
    7   HE21  GLN  17          HE21      GLN  17 -13.477   2.944   6.261
    8   HE22  GLN  17          HE22      GLN  17 -14.097   4.319   7.041

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ALA  18           H        ALA  18  -8.187   1.295   8.532
    2    HA   ALA  18           HA       ALA  18  -7.068   2.499  10.799
    3    HB2  ALA  18           HB1      ALA  18  -6.487   0.277   9.429
    4    HB3  ALA  18           HB2      ALA  18  -5.312   1.048  10.495
    5    HB1  ALA  18           HB3      ALA  18  -5.238   1.326   8.754

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ARG  19           H        ARG  19  -6.305   3.015   7.347
    2    HA   ARG  19           HA       ARG  19  -4.384   5.043   7.768
    3    HB2  ARG  19           HB2      ARG  19  -4.732   3.905   5.574
    4    HB3  ARG  19           HB3      ARG  19  -6.266   4.761   5.403
    5    HG2  ARG  19           HG2      ARG  19  -5.116   6.922   5.467
    6    HG3  ARG  19           HG3      ARG  19  -3.574   6.121   5.765
    7    HD2  ARG  19           HD2      ARG  19  -3.702   6.712   3.422
    8    HD3  ARG  19           HD3      ARG  19  -3.804   4.953   3.569
    9    HE   ARG  19           HE       ARG  19  -6.428   5.888   3.571
   10   HH21  ARG  19          HH11      ARG  19  -7.629   6.056   1.657
   11   HH22  ARG  19          HH12      ARG  19  -6.812   6.125   0.135
   12   HH11  ARG  19          HH21      ARG  19  -3.660   5.924   1.527
   13   HH12  ARG  19          HH22      ARG  19  -4.564   6.048   0.061

  No H/Q in entry =          13
  In of MODEL   42
    1    H    SER  20           H        SER  20  -7.884   5.192   7.181
    2    HA   SER  20           HA       SER  20  -8.214   7.951   7.134
    3    HB2  SER  20           HB2      SER  20  -9.959   6.081   6.777
    4    HB3  SER  20           HB3      SER  20 -10.171   6.137   8.525
    5    HG   SER  20           HG       SER  20 -11.134   8.006   8.338

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU  21           H        LEU  21  -8.225   5.769   9.939
    2    HA   LEU  21           HA       LEU  21  -8.639   7.769  11.904
    3    HB2  LEU  21           HB2      LEU  21  -7.308   5.058  12.063
    4    HB3  LEU  21           HB3      LEU  21  -7.611   6.077  13.467
    5    HG   LEU  21           HG       LEU  21  -9.784   5.189  11.546
    6   HD12  LEU  21          HD11      LEU  21  -9.079   4.026  14.255
    7   HD11  LEU  21          HD12      LEU  21  -8.695   3.266  12.712
    8   HD13  LEU  21          HD13      LEU  21 -10.379   3.494  13.187
    9   HD21  LEU  21          HD21      LEU  21  -9.706   6.713  14.141
   10   HD23  LEU  21          HD22      LEU  21 -11.115   5.717  13.794
   11   HD22  LEU  21          HD23      LEU  21 -10.681   7.028  12.708

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ALA  22           H        ALA  22  -5.705   6.369  10.487
    2    HA   ALA  22           HA       ALA  22  -3.807   7.665  12.101
    3    HB2  ALA  22           HB1      ALA  22  -3.414   5.807  10.409
    4    HB1  ALA  22           HB2      ALA  22  -2.207   7.092  10.440
    5    HB3  ALA  22           HB3      ALA  22  -3.429   7.059   9.168

  No H/Q in entry =           5
  In of MODEL   42
    1    H    TYR  23           H        TYR  23  -5.127   8.693   8.923
    2    HA   TYR  23           HA       TYR  23  -3.768  11.177   8.848
    3    HB2  TYR  23           HB2      TYR  23  -4.864  10.277   6.860
    4    HB3  TYR  23           HB3      TYR  23  -6.439  10.393   7.646
    5    HD1  TYR  23           HD1      TYR  23  -3.524  12.420   6.490
    6    HD2  TYR  23           HD2      TYR  23  -7.665  12.411   7.629
    7    HE1  TYR  23           HE1      TYR  23  -3.736  14.772   5.733
    8    HE2  TYR  23           HE2      TYR  23  -7.878  14.763   6.871
    9    HH   TYR  23           HH       TYR  23  -5.280  16.381   5.153

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ALA  24           H        ALA  24  -6.892  10.228  10.238
    2    HA   ALA  24           HA       ALA  24  -7.702  12.825  11.011
    3    HB1  ALA  24           HB1      ALA  24  -9.530  11.591  11.486
    4    HB2  ALA  24           HB2      ALA  24  -8.704  11.012  12.931
    5    HB3  ALA  24           HB3      ALA  24  -8.593  10.099  11.427

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA  25           H        ALA  25  -5.717  10.350  12.579
    2    HA   ALA  25           HA       ALA  25  -5.359  11.600  15.080
    3    HB2  ALA  25           HB1      ALA  25  -4.616   9.241  14.257
    4    HB3  ALA  25           HB2      ALA  25  -3.589  10.090  15.414
    5    HB1  ALA  25           HB3      ALA  25  -3.159  10.069  13.703

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU  26           H        LEU  26  -3.576  11.882  12.033
    2    HA   LEU  26           HA       LEU  26  -1.598  13.684  12.942
    3    HB2  LEU  26           HB2      LEU  26  -1.314  12.530  10.838
    4    HB3  LEU  26           HB3      LEU  26  -2.783  13.251  10.188
    5    HG   LEU  26           HG       LEU  26  -1.748  15.492  10.319
    6   HD12  LEU  26          HD11      LEU  26   0.792  15.489  10.724
    7   HD11  LEU  26          HD12      LEU  26   0.557  13.910  11.470
    8   HD13  LEU  26          HD13      LEU  26  -0.236  15.333  12.148
    9   HD21  LEU  26          HD21      LEU  26  -0.029  13.421   8.919
   10   HD23  LEU  26          HD22      LEU  26  -0.057  15.143   8.548
   11   HD22  LEU  26          HD23      LEU  26  -1.491  14.158   8.265

  No H/Q in entry =          11
  In of MODEL   42
    1    H    LYS  27           H        LYS  27  -4.781  14.196  11.476
    2    HA   LYS  27           HA       LYS  27  -4.701  16.984  11.276
    3    HB2  LYS  27           HB2      LYS  27  -6.462  15.523  10.297
    4    HB3  LYS  27           HB3      LYS  27  -7.115  15.273  11.916
    5    HG2  LYS  27           HG2      LYS  27  -7.521  17.683  12.153
    6    HG3  LYS  27           HG3      LYS  27  -6.816  17.973  10.559
    7    HD2  LYS  27           HD2      LYS  27  -8.565  16.554   9.529
    8    HD3  LYS  27           HD3      LYS  27  -9.276  16.282  11.122
    9    HE2  LYS  27           HE2      LYS  27  -9.696  18.697  11.366
   10    HE3  LYS  27           HE3      LYS  27  -8.956  18.991   9.788
   11    HZ3  LYS  27           HZ1      LYS  27 -11.335  18.888   9.555
   12    HZ2  LYS  27           HZ2      LYS  27 -11.395  17.373  10.325
   13    HZ1  LYS  27           HZ3      LYS  27 -10.654  17.529   8.801

  No H/Q in entry =          13
  In of MODEL   42
    1    H    GLN  28           H        GLN  28  -5.599  14.907  14.007
    2    HA   GLN  28           HA       GLN  28  -6.469  16.920  15.786
    3    HB2  GLN  28           HB2      GLN  28  -5.089  14.276  16.326
    4    HB3  GLN  28           HB3      GLN  28  -5.820  15.288  17.574
    5    HG2  GLN  28           HG2      GLN  28  -7.295  14.180  15.168
    6    HG3  GLN  28           HG3      GLN  28  -7.355  13.488  16.788
    7   HE21  GLN  28          HE21      GLN  28  -9.225  15.296  14.833
    8   HE22  GLN  28          HE22      GLN  28  -9.960  16.324  15.966

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ALA  29           H        ALA  29  -3.266  15.591  15.085
    2    HA   ALA  29           HA       ALA  29  -1.806  16.974  17.058
    3    HB1  ALA  29           HB1      ALA  29   0.113  16.263  15.933
    4    HB3  ALA  29           HB2      ALA  29  -0.646  16.394  14.346
    5    HB2  ALA  29           HB3      ALA  29  -1.078  15.066  15.423

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LYS  30           H        LYS  30  -2.667  17.862  13.732
    2    HA   LYS  30           HA       LYS  30  -1.229  20.286  13.625
    3    HB2  LYS  30           HB2      LYS  30  -3.775  19.441  12.226
    4    HB3  LYS  30           HB3      LYS  30  -2.924  20.946  11.879
    5    HG2  LYS  30           HG2      LYS  30  -0.872  19.628  11.358
    6    HG3  LYS  30           HG3      LYS  30  -1.796  18.143  11.607
    7    HD2  LYS  30           HD2      LYS  30  -3.358  18.802   9.818
    8    HD3  LYS  30           HD3      LYS  30  -2.458  20.300   9.571
    9    HE2  LYS  30           HE2      LYS  30  -0.444  18.982   8.984
   10    HE3  LYS  30           HE3      LYS  30  -1.363  17.490   9.200
   11    HZ2  LYS  30           HZ1      LYS  30  -1.185  18.359   6.857
   12    HZ1  LYS  30           HZ2      LYS  30  -2.211  19.634   7.329
   13    HZ3  LYS  30           HZ3      LYS  30  -2.756  18.024   7.403

  No H/Q in entry =          13
  In of MODEL   42
    1    H    GLN  31           H        GLN  31  -4.334  19.473  15.050
    2    HA   GLN  31           HA       GLN  31  -5.060  22.239  15.504
    3    HB2  GLN  31           HB2      GLN  31  -6.266  19.809  16.832
    4    HB3  GLN  31           HB3      GLN  31  -7.006  21.390  16.589
    5    HG2  GLN  31           HG2      GLN  31  -6.316  20.604  13.997
    6    HG3  GLN  31           HG3      GLN  31  -6.858  19.106  14.746
    7   HE21  GLN  31          HE21      GLN  31  -8.255  20.699  12.649
    8   HE22  GLN  31          HE22      GLN  31  -9.761  21.111  13.313

  No H/Q in entry =           8
  In of MODEL   42
    1    H    GLY  32           H        GLY  32  -2.769  20.281  16.815
    2    HA3  GLY  32           HA2      GLY  32  -1.355  20.724  18.612
    3    HA2  GLY  32           HA3      GLY  32  -2.465  21.982  19.140

  No H/Q in entry =           3
  In of MODEL   42
    1    H    ASP  33           H        ASP  33  -3.931  18.962  18.484
    2    HA   ASP  33           HA       ASP  33  -4.337  18.510  21.365
    3    HB2  ASP  33           HB2      ASP  33  -5.767  17.518  18.893
    4    HB3  ASP  33           HB3      ASP  33  -6.114  16.912  20.511

  No H/Q in entry =           4
  In of MODEL   42
    1    H    PHE  34           H        PHE  34  -2.179  17.629  21.662
    2    HA   PHE  34           HA       PHE  34  -1.215  15.367  20.257
    3    HB2  PHE  34           HB2      PHE  34  -0.574  16.342  23.049
    4    HB3  PHE  34           HB3      PHE  34   0.335  15.106  22.177
    5    HD1  PHE  34           HD1      PHE  34   0.213  18.534  22.914
    6    HD2  PHE  34           HD2      PHE  34   0.992  15.821  19.675
    7    HE1  PHE  34           HE1      PHE  34   1.528  20.288  21.755
    8    HE2  PHE  34           HE2      PHE  34   2.303  17.577  18.521
    9    HZ   PHE  34           HZ       PHE  34   2.572  19.808  19.566

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ALA  35           H        ALA  35  -3.240  15.671  23.128
    2    HA   ALA  35           HA       ALA  35  -3.061  13.006  24.023
    3    HB3  ALA  35           HB1      ALA  35  -5.506  13.666  24.890
    4    HB1  ALA  35           HB2      ALA  35  -4.952  15.277  24.433
    5    HB2  ALA  35           HB3      ALA  35  -4.046  14.340  25.620

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA  36           H        ALA  36  -5.498  14.558  21.933
    2    HA   ALA  36           HA       ALA  36  -6.949  12.166  21.461
    3    HB1  ALA  36           HB1      ALA  36  -8.388  13.609  20.511
    4    HB3  ALA  36           HB2      ALA  36  -7.215  14.013  19.257
    5    HB2  ALA  36           HB3      ALA  36  -7.221  14.901  20.782

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA  37           H        ALA  37  -4.253  13.717  19.782
    2    HA   ALA  37           HA       ALA  37  -4.250  12.082  17.484
    3    HB3  ALA  37           HB1      ALA  37  -2.228  13.765  18.899
    4    HB2  ALA  37           HB2      ALA  37  -2.765  13.829  17.221
    5    HB1  ALA  37           HB3      ALA  37  -1.626  12.583  17.737

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LYS  38           H        LYS  38  -2.485  11.750  20.555
    2    HA   LYS  38           HA       LYS  38  -1.195   9.332  20.059
    3    HB2  LYS  38           HB2      LYS  38  -1.485  11.098  22.207
    4    HB3  LYS  38           HB3      LYS  38  -2.122   9.577  22.825
    5    HG2  LYS  38           HG2      LYS  38  -0.046   8.428  22.280
    6    HG3  LYS  38           HG3      LYS  38   0.579   9.865  21.464
    7    HD2  LYS  38           HD2      LYS  38   0.773  11.080  23.499
    8    HD3  LYS  38           HD3      LYS  38  -0.258   9.944  24.370
    9    HE2  LYS  38           HE2      LYS  38   2.095   9.595  24.979
   10    HE3  LYS  38           HE3      LYS  38   1.468   8.188  24.117
   11    HZ3  LYS  38           HZ1      LYS  38   2.767   8.589  22.331
   12    HZ2  LYS  38           HZ2      LYS  38   3.738   9.404  23.464
   13    HZ1  LYS  38           HZ3      LYS  38   2.666  10.279  22.477

  No H/Q in entry =          13
  In of MODEL   42
    1    H    ALA  39           H        ALA  39  -4.421   9.871  21.475
    2    HA   ALA  39           HA       ALA  39  -5.016   7.160  21.981
    3    HB3  ALA  39           HB1      ALA  39  -7.151   9.134  21.223
    4    HB2  ALA  39           HB2      ALA  39  -6.244   9.348  22.721
    5    HB1  ALA  39           HB3      ALA  39  -7.182   7.877  22.461

  No H/Q in entry =           5
  In of MODEL   42
    1    H    MET  40           H        MET  40  -5.585   9.182  19.137
    2    HA   MET  40           HA       MET  40  -7.094   7.271  17.682
    3    HB2  MET  40           HB2      MET  40  -5.455   9.645  16.772
    4    HB3  MET  40           HB3      MET  40  -6.498   8.700  15.706
    5    HG2  MET  40           HG2      MET  40  -7.505   9.962  18.268
    6    HG3  MET  40           HG3      MET  40  -7.557  10.798  16.719
    7    HE3  MET  40           HE1      MET  40 -10.171   9.215  14.664
    8    HE2  MET  40           HE2      MET  40  -8.418   9.308  14.509
    9    HE1  MET  40           HE3      MET  40  -9.314  10.686  15.147

  No H/Q in entry =           9
  In of MODEL   42
    1    H    MET  41           H        MET  41  -3.592   7.961  17.791
    2    HA   MET  41           HA       MET  41  -2.866   6.198  15.687
    3    HB2  MET  41           HB2      MET  41  -1.231   6.841  18.154
    4    HB3  MET  41           HB3      MET  41  -0.628   6.186  16.635
    5    HG2  MET  41           HG2      MET  41  -1.759   8.384  15.637
    6    HG3  MET  41           HG3      MET  41  -1.509   8.968  17.281
    7    HE2  MET  41           HE1      MET  41   1.382   6.831  17.630
    8    HE1  MET  41           HE2      MET  41   0.615   8.135  18.532
    9    HE3  MET  41           HE3      MET  41   2.239   8.357  17.882

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ASP  42           H        ASP  42  -3.243   5.728  19.174
    2    HA   ASP  42           HA       ASP  42  -2.241   3.120  19.329
    3    HB2  ASP  42           HB2      ASP  42  -3.084   4.890  21.156
    4    HB3  ASP  42           HB3      ASP  42  -4.525   3.884  21.089

  No H/Q in entry =           4
  In of MODEL   42
    1    H    GLN  43           H        GLN  43  -5.562   4.268  18.842
    2    HA   GLN  43           HA       GLN  43  -6.740   1.696  18.651
    3    HB2  GLN  43           HB2      GLN  43  -7.633   4.360  17.527
    4    HB3  GLN  43           HB3      GLN  43  -8.615   2.894  17.508
    5    HG2  GLN  43           HG2      GLN  43  -8.313   2.768  20.014
    6    HG3  GLN  43           HG3      GLN  43  -7.568   4.363  19.941
    7   HE21  GLN  43          HE21      GLN  43  -9.740   4.471  21.449
    8   HE22  GLN  43          HE22      GLN  43 -11.097   5.064  20.623

  No H/Q in entry =           8
  In of MODEL   42
    1    H    SER  44           H        SER  44  -5.380   3.893  16.235
    2    HA   SER  44           HA       SER  44  -6.109   2.420  13.948
    3    HB2  SER  44           HB2      SER  44  -4.820   4.786  14.388
    4    HB3  SER  44           HB3      SER  44  -3.481   3.773  13.852
    5    HG   SER  44           HG       SER  44  -4.588   4.761  12.094

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ARG  45           H        ARG  45  -3.225   2.268  16.017
    2    HA   ARG  45           HA       ARG  45  -1.776   0.296  14.628
    3    HB2  ARG  45           HB2      ARG  45  -0.909   1.705  16.494
    4    HB3  ARG  45           HB3      ARG  45  -1.908   0.786  17.618
    5    HG2  ARG  45           HG2      ARG  45  -0.706  -1.288  16.970
    6    HG3  ARG  45           HG3      ARG  45   0.318  -0.345  15.888
    7    HD2  ARG  45           HD2      ARG  45   1.078   1.025  17.842
    8    HD3  ARG  45           HD3      ARG  45   0.146  -0.039  18.918
    9    HE   ARG  45           HE       ARG  45   1.818  -1.656  17.330
   10   HH21  ARG  45          HH11      ARG  45   3.710  -2.504  18.160
   11   HH22  ARG  45          HH12      ARG  45   4.499  -1.729  19.489
   12   HH11  ARG  45          HH21      ARG  45   2.162   0.805  19.721
   13   HH12  ARG  45          HH22      ARG  45   3.622   0.147  20.370

  No H/Q in entry =          13
  In of MODEL   42
    1    H    MET  46           H        MET  46  -4.168   0.005  17.237
    2    HA   MET  46           HA       MET  46  -4.036  -2.796  17.542
    3    HB2  MET  46           HB2      MET  46  -6.186  -0.769  18.145
    4    HB3  MET  46           HB3      MET  46  -6.396  -2.486  18.500
    5    HG2  MET  46           HG2      MET  46  -4.357  -2.461  19.878
    6    HG3  MET  46           HG3      MET  46  -4.117  -0.759  19.514
    7    HE2  MET  46           HE1      MET  46  -4.268   0.326  21.982
    8    HE1  MET  46           HE2      MET  46  -3.893  -1.377  22.217
    9    HE3  MET  46           HE3      MET  46  -5.111  -0.606  23.226

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ALA  47           H        ALA  47  -6.037  -0.751  15.456
    2    HA   ALA  47           HA       ALA  47  -7.686  -2.779  14.395
    3    HB3  ALA  47           HB1      ALA  47  -8.337  -0.533  13.983
    4    HB1  ALA  47           HB2      ALA  47  -7.862  -1.172  12.409
    5    HB2  ALA  47           HB3      ALA  47  -6.764  -0.118  13.302

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU  48           H        LEU  48  -4.553  -1.513  13.333
    2    HA   LEU  48           HA       LEU  48  -4.303  -3.105  10.990
    3    HB2  LEU  48           HB2      LEU  48  -2.221  -1.857  12.792
    4    HB3  LEU  48           HB3      LEU  48  -1.868  -2.582  11.223
    5    HG   LEU  48           HG       LEU  48  -3.858  -0.336  11.621
    6   HD13  LEU  48          HD11      LEU  48  -1.722   0.509  12.280
    7   HD12  LEU  48          HD12      LEU  48  -1.995   1.068  10.630
    8   HD11  LEU  48          HD13      LEU  48  -0.916  -0.294  10.933
    9   HD22  LEU  48          HD21      LEU  48  -4.351  -1.312   9.547
   10   HD21  LEU  48          HD22      LEU  48  -2.676  -1.771   9.245
   11   HD23  LEU  48          HD23      LEU  48  -3.171  -0.084   9.089

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ASN  49           H        ASN  49  -3.251  -3.520  14.332
    2    HA   ASN  49           HA       ASN  49  -1.683  -5.805  13.994
    3    HB2  ASN  49           HB2      ASN  49  -1.667  -4.487  16.043
    4    HB3  ASN  49           HB3      ASN  49  -3.341  -4.911  16.368
    5   HD21  ASN  49          HD21      ASN  49  -0.111  -6.406  15.968
    6   HD22  ASN  49          HD22      ASN  49  -0.418  -7.708  17.013

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLU  50           H        GLU  50  -5.144  -5.480  14.678
    2    HA   GLU  50           HA       GLU  50  -5.698  -8.271  14.786
    3    HB2  GLU  50           HB2      GLU  50  -7.256  -6.561  15.669
    4    HB3  GLU  50           HB3      GLU  50  -7.546  -5.991  14.024
    5    HG2  GLU  50           HG2      GLU  50  -8.446  -8.173  13.387
    6    HG3  GLU  50           HG3      GLU  50  -8.069  -8.824  14.979

  No H/Q in entry =           6
  In of MODEL   42
    1    H    ALA  51           H        ALA  51  -5.739  -5.870  12.193
    2    HA   ALA  51           HA       ALA  51  -6.757  -7.581  10.172
    3    HB2  ALA  51           HB1      ALA  51  -6.514  -5.771   8.804
    4    HB1  ALA  51           HB2      ALA  51  -4.868  -5.447   9.347
    5    HB3  ALA  51           HB3      ALA  51  -6.240  -4.916  10.321

  No H/Q in entry =           5
  In of MODEL   42
    1    H    HIS  52           H        HIS  52  -3.450  -6.726  11.146
    2    HA   HIS  52           HA       HIS  52  -2.081  -8.235   9.190
    3    HB2  HIS  52           HB2      HIS  52  -1.025  -6.515  10.640
    4    HB3  HIS  52           HB3      HIS  52  -1.189  -7.607  12.015
    5    HD1  HIS  52           HD1      HIS  52   0.210  -9.856  11.916
    6    HD2  HIS  52           HD2      HIS  52   1.115  -7.104   8.918
    7    HE1  HIS  52           HE1      HIS  52   2.405 -10.603  10.896
    8    HE2  HIS  52           HE2      HIS  52   2.969  -8.936   9.066

  No H/Q in entry =           8
  In of MODEL   42
    1    H    LEU  53           H        LEU  53  -3.296  -9.096  12.406
    2    HA   LEU  53           HA       LEU  53  -2.139 -11.659  12.594
    3    HB2  LEU  53           HB2      LEU  53  -4.598 -10.437  13.818
    4    HB3  LEU  53           HB3      LEU  53  -4.170 -12.122  14.104
    5    HG   LEU  53           HG       LEU  53  -2.228  -9.838  14.582
    6   HD13  LEU  53          HD11      LEU  53  -4.095  -9.450  16.058
    7   HD12  LEU  53          HD12      LEU  53  -2.813 -10.194  17.011
    8   HD11  LEU  53          HD13      LEU  53  -4.185 -11.157  16.477
    9   HD22  LEU  53          HD21      LEU  53  -0.978 -11.837  14.540
   10   HD21  LEU  53          HD22      LEU  53  -2.295 -12.783  15.226
   11   HD23  LEU  53          HD23      LEU  53  -1.371 -11.700  16.251

  No H/Q in entry =          11
  In of MODEL   42
    1    H    VAL  54           H        VAL  54  -5.237 -10.578  11.243
    2    HA   VAL  54           HA       VAL  54  -6.196 -13.156  10.556
    3    HB   VAL  54           HB       VAL  54  -6.801 -10.412   9.426
    4   HG12  VAL  54          HG11      VAL  54  -8.928 -11.754   8.620
    5   HG11  VAL  54          HG12      VAL  54  -7.839 -13.138   8.688
    6   HG13  VAL  54          HG13      VAL  54  -7.460 -11.768   7.646
    7   HG22  VAL  54          HG21      VAL  54  -7.701 -10.437  11.581
    8   HG21  VAL  54          HG22      VAL  54  -7.985 -12.176  11.561
    9   HG23  VAL  54          HG23      VAL  54  -9.051 -11.100  10.659

  No H/Q in entry =           9
  In of MODEL   42
    1    H    GLN  55           H        GLN  55  -4.290 -10.735   8.763
    2    HA   GLN  55           HA       GLN  55  -4.192 -12.199   6.344
    3    HB2  GLN  55           HB2      GLN  55  -3.551  -9.945   6.154
    4    HB3  GLN  55           HB3      GLN  55  -2.437 -10.041   7.515
    5    HG2  GLN  55           HG2      GLN  55  -0.738 -10.915   6.233
    6    HG3  GLN  55           HG3      GLN  55  -1.832 -11.871   5.241
    7   HE21  GLN  55          HE21      GLN  55  -1.844 -11.178   3.121
    8   HE22  GLN  55          HE22      GLN  55  -1.620  -9.577   2.611

  No H/Q in entry =           8
  In of MODEL   42
    1    H    THR  56           H        THR  56  -2.077 -12.216   9.218
    2    HA   THR  56           HA       THR  56  -0.029 -13.849   8.292
    3    HB   THR  56           HB       THR  56  -1.317 -13.868  11.036
    4    HG1  THR  56           HG1      THR  56  -0.097 -11.973   9.834
    5   HG23  THR  56          HG21      THR  56  -0.007 -15.829  10.941
    6   HG22  THR  56          HG22      THR  56   1.078 -14.631  11.648
    7   HG21  THR  56          HG23      THR  56   1.226 -15.060   9.944

  No H/Q in entry =           7
  In of MODEL   42
    1    H    LYS  57           H        LYS  57  -3.162 -14.833   9.665
    2    HA   LYS  57           HA       LYS  57  -2.765 -17.636   9.415
    3    HB2  LYS  57           HB2      LYS  57  -4.559 -16.523  10.769
    4    HB3  LYS  57           HB3      LYS  57  -5.346 -16.045   9.273
    5    HG2  LYS  57           HG2      LYS  57  -5.633 -18.399   8.644
    6    HG3  LYS  57           HG3      LYS  57  -4.809 -18.907  10.116
    7    HD2  LYS  57           HD2      LYS  57  -6.581 -17.827  11.472
    8    HD3  LYS  57           HD3      LYS  57  -7.419 -17.357   9.993
    9    HE2  LYS  57           HE2      LYS  57  -7.665 -19.736   9.368
   10    HE3  LYS  57           HE3      LYS  57  -6.816 -20.225  10.833
   11    HZ2  LYS  57           HZ1      LYS  57  -9.524 -19.231  10.499
   12    HZ1  LYS  57           HZ2      LYS  57  -8.688 -18.662  11.864
   13    HZ3  LYS  57           HZ3      LYS  57  -8.898 -20.332  11.629

  No H/Q in entry =          13
  In of MODEL   42
    1    H    LEU  58           H        LEU  58  -4.061 -15.169   7.246
    2    HA   LEU  58           HA       LEU  58  -4.901 -16.978   5.240
    3    HB2  LEU  58           HB2      LEU  58  -4.244 -14.040   5.106
    4    HB3  LEU  58           HB3      LEU  58  -4.928 -14.964   3.767
    5    HG   LEU  58           HG       LEU  58  -6.195 -14.765   6.519
    6   HD11  LEU  58          HD11      LEU  58  -6.475 -13.111   4.029
    7   HD13  LEU  58          HD12      LEU  58  -6.450 -12.605   5.719
    8   HD12  LEU  58          HD13      LEU  58  -7.889 -13.373   5.051
    9   HD22  LEU  58          HD21      LEU  58  -7.194 -16.656   5.651
   10   HD21  LEU  58          HD22      LEU  58  -6.852 -16.209   3.979
   11   HD23  LEU  58          HD23      LEU  58  -8.200 -15.460   4.835

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  59           H        ILE  59  -1.742 -15.823   6.093
    2    HA   ILE  59           HA       ILE  59  -0.666 -16.567   3.452
    3    HB   ILE  59           HB       ILE  59   0.144 -14.517   5.021
    4   HG12  ILE  59          HG12      ILE  59   2.190 -16.208   3.570
    5   HG13  ILE  59          HG13      ILE  59   1.018 -15.225   2.732
    6   HG23  ILE  59          HG21      ILE  59   1.985 -15.035   6.405
    7   HG22  ILE  59          HG22      ILE  59   2.199 -16.621   5.699
    8   HG21  ILE  59          HG23      ILE  59   0.847 -16.306   6.785
    9   HD12  ILE  59          HD11      ILE  59   3.035 -14.225   4.741
   10   HD11  ILE  59          HD12      ILE  59   1.826 -13.220   3.945
   11   HD13  ILE  59          HD13      ILE  59   3.109 -13.976   2.998

  No H/Q in entry =          11
  In of MODEL   42
    1    H    GLU  60           H        GLU  60  -0.686 -17.676   6.819
    2    HA   GLU  60           HA       GLU  60   1.309 -19.689   6.547
    3    HB2  GLU  60           HB2      GLU  60   0.577 -18.902   8.740
    4    HB3  GLU  60           HB3      GLU  60  -1.049 -19.511   8.441
    5    HG2  GLU  60           HG2      GLU  60   1.339 -21.351   8.310
    6    HG3  GLU  60           HG3      GLU  60   0.557 -20.986   9.847

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLY  61           H        GLY  61  -2.204 -19.725   6.071
    2    HA3  GLY  61           HA2      GLY  61  -2.008 -22.521   5.110
    3    HA2  GLY  61           HA3      GLY  61  -3.478 -21.759   5.709

  No H/Q in entry =           3
  In of MODEL   42
    1    H    ASP  62           H        ASP  62  -1.228 -20.217   3.501
    2    HA   ASP  62           HA       ASP  62  -2.840 -19.081   1.729
    3    HB2  ASP  62           HB2      ASP  62  -1.132 -19.452  -0.008
    4    HB3  ASP  62           HB3      ASP  62  -0.397 -19.056   1.541

  No H/Q in entry =           4
  In of MODEL   42
    1    H    ALA  63           H        ALA  63  -3.952 -19.555  -0.239
    2    HA   ALA  63           HA       ALA  63  -5.373 -22.040  -0.262
    3    HB1  ALA  63           HB1      ALA  63  -6.343 -21.225  -2.357
    4    HB3  ALA  63           HB2      ALA  63  -5.162 -19.916  -2.394
    5    HB2  ALA  63           HB3      ALA  63  -6.372 -19.975  -1.110

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLY  64           H        GLY  64  -5.342 -23.612  -1.992
    2    HA3  GLY  64           HA2      GLY  64  -4.370 -24.925  -3.641
    3    HA2  GLY  64           HA3      GLY  64  -3.094 -23.730  -3.808

  No H/Q in entry =           3
  In of MODEL   42
    1    H    GLU  65           H        GLU  65  -4.255 -26.107  -1.383
    2    HA   GLU  65           HA       GLU  65  -1.802 -26.338  -0.051
    3    HB2  GLU  65           HB2      GLU  65  -4.090 -28.286  -0.304
    4    HB3  GLU  65           HB3      GLU  65  -2.713 -28.527   0.773
    5    HG2  GLU  65           HG2      GLU  65  -3.204 -26.418   1.918
    6    HG3  GLU  65           HG3      GLU  65  -4.541 -26.109   0.813

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLY  66           H        GLY  66  -3.160 -28.308  -2.613
    2    HA3  GLY  66           HA2      GLY  66  -1.041 -30.164  -2.865
    3    HA2  GLY  66           HA3      GLY  66  -2.306 -29.865  -4.040

  No H/Q in entry =           3
  In of MODEL   42
    1    H    LYS  67           H        LYS  67  -1.888 -27.342  -4.836
    2    HA   LYS  67           HA       LYS  67   0.560 -27.597  -6.377
    3    HB2  LYS  67           HB2      LYS  67  -1.844 -25.797  -6.623
    4    HB3  LYS  67           HB3      LYS  67  -0.449 -25.724  -7.707
    5    HG2  LYS  67           HG2      LYS  67  -0.742 -28.099  -8.273
    6    HG3  LYS  67           HG3      LYS  67  -2.114 -28.203  -7.173
    7    HD2  LYS  67           HD2      LYS  67  -3.306 -26.499  -8.534
    8    HD3  LYS  67           HD3      LYS  67  -1.946 -26.475  -9.658
    9    HE2  LYS  67           HE2      LYS  67  -3.508 -28.976  -8.958
   10    HE3  LYS  67           HE3      LYS  67  -3.827 -27.985 -10.382
   11    HZ3  LYS  67           HZ1      LYS  67  -2.381 -29.799 -10.954
   12    HZ2  LYS  67           HZ2      LYS  67  -1.282 -29.370  -9.734
   13    HZ1  LYS  67           HZ3      LYS  67  -1.518 -28.345 -11.068

  No H/Q in entry =          13
  In of MODEL   42
    1    H    MET  68           H        MET  68   1.976 -25.896  -6.815
    2    HA   MET  68           HA       MET  68   3.039 -24.633  -4.527
    3    HB2  MET  68           HB2      MET  68   3.622 -24.266  -7.466
    4    HB3  MET  68           HB3      MET  68   4.594 -23.577  -6.165
    5    HG2  MET  68           HG2      MET  68   4.006 -26.534  -6.492
    6    HG3  MET  68           HG3      MET  68   5.505 -25.750  -6.996
    7    HE3  MET  68           HE1      MET  68   7.426 -24.842  -4.059
    8    HE2  MET  68           HE2      MET  68   6.231 -23.640  -4.543
    9    HE1  MET  68           HE3      MET  68   7.023 -24.628  -5.767

  No H/Q in entry =           9
  In of MODEL   42
    1    H    LYS  69           H        LYS  69   0.452 -23.625  -6.445
    2    HA   LYS  69           HA       LYS  69   0.988 -20.800  -6.313
    3    HB2  LYS  69           HB2      LYS  69  -1.419 -22.329  -7.255
    4    HB3  LYS  69           HB3      LYS  69  -1.308 -20.565  -7.275
    5    HG2  LYS  69           HG2      LYS  69   0.729 -20.689  -8.641
    6    HG3  LYS  69           HG3      LYS  69   0.654 -22.451  -8.610
    7    HD2  LYS  69           HD2      LYS  69  -1.524 -22.385  -9.762
    8    HD3  LYS  69           HD3      LYS  69  -1.458 -20.622  -9.787
    9    HE2  LYS  69           HE2      LYS  69   0.621 -20.716 -11.117
   10    HE3  LYS  69           HE3      LYS  69   0.552 -22.478 -11.097
   11    HZ2  LYS  69           HZ1      LYS  69  -0.632 -20.808 -12.925
   12    HZ1  LYS  69           HZ2      LYS  69  -1.914 -21.355 -11.954
   13    HZ3  LYS  69           HZ3      LYS  69  -0.909 -22.471 -12.746

  No H/Q in entry =          13
  In of MODEL   42
    1    H    VAL  70           H        VAL  70  -0.463 -19.186  -5.412
    2    HA   VAL  70           HA       VAL  70  -1.809 -20.059  -2.917
    3    HB   VAL  70           HB       VAL  70  -1.000 -17.954  -1.877
    4   HG13  VAL  70          HG11      VAL  70   1.138 -18.772  -1.351
    5   HG12  VAL  70          HG12      VAL  70   1.405 -19.387  -2.983
    6   HG11  VAL  70          HG13      VAL  70   0.288 -20.218  -1.899
    7   HG21  VAL  70          HG21      VAL  70   0.299 -17.620  -4.592
    8   HG23  VAL  70          HG22      VAL  70   0.999 -16.866  -3.161
    9   HG22  VAL  70          HG23      VAL  70  -0.634 -16.441  -3.666

  No H/Q in entry =           9
  In of MODEL   42
    1    H    SER  71           H        SER  71  -3.303 -18.329  -2.100
    2    HA   SER  71           HA       SER  71  -5.276 -17.670  -4.004
    3    HB2  SER  71           HB2      SER  71  -5.652 -17.871  -1.514
    4    HB3  SER  71           HB3      SER  71  -4.816 -16.335  -1.312
    5    HG   SER  71           HG       SER  71  -7.327 -16.898  -2.357

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU  72           H        LEU  72  -5.455 -16.022  -5.379
    2    HA   LEU  72           HA       LEU  72  -3.319 -14.245  -5.867
    3    HB2  LEU  72           HB2      LEU  72  -6.188 -14.246  -6.800
    4    HB3  LEU  72           HB3      LEU  72  -4.970 -13.113  -7.383
    5    HG   LEU  72           HG       LEU  72  -4.638 -16.128  -7.517
    6   HD12  LEU  72          HD11      LEU  72  -5.444 -14.240  -9.747
    7   HD11  LEU  72          HD12      LEU  72  -6.582 -15.265  -8.870
    8   HD13  LEU  72          HD13      LEU  72  -5.301 -15.996  -9.839
    9   HD21  LEU  72          HD21      LEU  72  -3.095 -13.747  -8.517
   10   HD23  LEU  72          HD22      LEU  72  -3.042 -15.236  -9.446
   11   HD22  LEU  72          HD23      LEU  72  -2.488 -15.223  -7.775

  No H/Q in entry =          11
  In of MODEL   42
    1    H    VAL  73           H        VAL  73  -6.399 -13.838  -4.224
    2    HA   VAL  73           HA       VAL  73  -6.397 -11.068  -3.869
    3    HB   VAL  73           HB       VAL  73  -8.113 -11.399  -2.280
    4   HG11  VAL  73          HG11      VAL  73  -8.585 -12.157  -4.625
    5   HG13  VAL  73          HG12      VAL  73  -9.573 -12.971  -3.413
    6   HG12  VAL  73          HG13      VAL  73  -8.190 -13.803  -4.127
    7   HG22  VAL  73          HG21      VAL  73  -7.305 -12.843  -0.645
    8   HG21  VAL  73          HG22      VAL  73  -6.701 -14.006  -1.826
    9   HG23  VAL  73          HG23      VAL  73  -8.429 -13.907  -1.491

  No H/Q in entry =           9
  In of MODEL   42
    1    H    LEU  74           H        LEU  74  -4.492 -13.470  -2.297
    2    HA   LEU  74           HA       LEU  74  -4.052 -12.339   0.226
    3    HB2  LEU  74           HB2      LEU  74  -3.306 -14.569  -0.276
    4    HB3  LEU  74           HB3      LEU  74  -2.251 -13.976  -1.558
    5    HG   LEU  74           HG       LEU  74  -0.920 -12.735   0.122
    6   HD12  LEU  74          HD11      LEU  74  -1.384 -13.452   2.558
    7   HD11  LEU  74          HD12      LEU  74  -2.981 -13.934   1.980
    8   HD13  LEU  74          HD13      LEU  74  -2.469 -12.250   1.859
    9   HD21  LEU  74          HD21      LEU  74  -0.751 -15.299  -0.511
   10   HD23  LEU  74          HD22      LEU  74  -1.155 -15.480   1.182
   11   HD22  LEU  74          HD23      LEU  74   0.284 -14.597   0.730

  No H/Q in entry =          11
  In of MODEL   42
    1    H    VAL  75           H        VAL  75  -2.167 -11.972  -2.739
    2    HA   VAL  75           HA       VAL  75  -0.334 -10.080  -1.733
    3    HB   VAL  75           HB       VAL  75  -1.309 -10.548  -4.553
    4   HG11  VAL  75          HG11      VAL  75   0.983  -8.845  -3.479
    5   HG13  VAL  75          HG12      VAL  75  -0.421  -8.274  -4.367
    6   HG12  VAL  75          HG13      VAL  75   0.774  -9.278  -5.173
    7   HG22  VAL  75          HG21      VAL  75  -0.140 -12.455  -3.589
    8   HG21  VAL  75          HG22      VAL  75   1.137 -11.409  -2.971
    9   HG23  VAL  75          HG23      VAL  75   0.956 -11.647  -4.709

  No H/Q in entry =           9
  In of MODEL   42
    1    H    GLU  76           H        GLU  76  -3.485  -9.678  -3.377
    2    HA   GLU  76           HA       GLU  76  -3.491  -6.863  -3.474
    3    HB2  GLU  76           HB2      GLU  76  -5.178  -8.260  -4.636
    4    HB3  GLU  76           HB3      GLU  76  -5.826  -8.772  -3.085
    5    HG2  GLU  76           HG2      GLU  76  -7.269  -7.033  -3.926
    6    HG3  GLU  76           HG3      GLU  76  -6.367  -6.343  -2.590

  No H/Q in entry =           6
  In of MODEL   42
    1    H    ALA  77           H        ALA  77  -4.627  -9.076  -0.933
    2    HA   ALA  77           HA       ALA  77  -5.543  -7.062   0.833
    3    HB1  ALA  77           HB1      ALA  77  -4.407  -9.716   1.710
    4    HB2  ALA  77           HB2      ALA  77  -5.991  -9.578   0.949
    5    HB3  ALA  77           HB3      ALA  77  -5.675  -8.762   2.479

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLN  78           H        GLN  78  -2.423  -8.663   0.453
    2    HA   GLN  78           HA       GLN  78  -1.137  -7.527   2.699
    3    HB2  GLN  78           HB2      GLN  78  -0.316  -9.480   1.332
    4    HB3  GLN  78           HB3      GLN  78   0.140  -8.336   0.073
    5    HG2  GLN  78           HG2      GLN  78   1.623  -7.177   1.659
    6    HG3  GLN  78           HG3      GLN  78   1.168  -8.317   2.923
    7   HE21  GLN  78          HE21      GLN  78   3.896  -8.077   2.062
    8   HE22  GLN  78          HE22      GLN  78   4.332  -9.517   1.275

  No H/Q in entry =           8
  In of MODEL   42
    1    H    LEU  79           H        LEU  79  -1.500  -6.455  -0.645
    2    HA   LEU  79           HA       LEU  79   0.225  -4.257  -0.635
    3    HB2  LEU  79           HB2      LEU  79  -0.825  -5.043  -2.686
    4    HB3  LEU  79           HB3      LEU  79  -2.419  -4.624  -2.070
    5    HG   LEU  79           HG       LEU  79  -1.833  -2.247  -2.043
    6   HD13  LEU  79          HD11      LEU  79   0.413  -2.043  -1.539
    7   HD12  LEU  79          HD12      LEU  79   0.460  -1.754  -3.278
    8   HD11  LEU  79          HD13      LEU  79   0.889  -3.340  -2.636
    9   HD23  LEU  79          HD21      LEU  79  -1.206  -2.055  -4.597
   10   HD22  LEU  79          HD22      LEU  79  -2.744  -2.777  -4.133
   11   HD21  LEU  79          HD23      LEU  79  -1.391  -3.809  -4.585

  No H/Q in entry =          11
  In of MODEL   42
    1    H    HIS  80           H        HIS  80  -3.241  -4.360   0.206
    2    HA   HIS  80           HA       HIS  80  -3.381  -1.602   0.874
    3    HB2  HIS  80           HB2      HIS  80  -5.123  -3.981   1.197
    4    HB3  HIS  80           HB3      HIS  80  -5.415  -2.637   2.304
    5    HD1  HIS  80           HD1      HIS  80  -7.007  -0.970   1.406
    6    HD2  HIS  80           HD2      HIS  80  -4.860  -2.816  -1.654
    7    HE1  HIS  80           HE1      HIS  80  -7.839   0.045  -0.768
    8    HE2  HIS  80           HE2      HIS  80  -6.536  -1.075  -2.642

  No H/Q in entry =           8
  In of MODEL   42
    1    H    LEU  81           H        LEU  81  -2.935  -4.508   2.861
    2    HA   LEU  81           HA       LEU  81  -2.888  -3.165   5.347
    3    HB2  LEU  81           HB2      LEU  81  -1.720  -5.802   4.458
    4    HB3  LEU  81           HB3      LEU  81  -1.677  -5.246   6.133
    5    HG   LEU  81           HG       LEU  81  -4.234  -5.450   4.516
    6   HD12  LEU  81          HD11      LEU  81  -4.567  -7.512   6.061
    7   HD11  LEU  81          HD12      LEU  81  -2.813  -7.474   6.240
    8   HD13  LEU  81          HD13      LEU  81  -3.533  -7.689   4.643
    9   HD23  LEU  81          HD21      LEU  81  -5.070  -5.642   7.020
   10   HD22  LEU  81          HD22      LEU  81  -4.719  -4.058   6.331
   11   HD21  LEU  81          HD23      LEU  81  -3.542  -4.842   7.385

  No H/Q in entry =          11
  In of MODEL   42
    1    H    MET  82           H        MET  82  -0.233  -4.114   3.163
    2    HA   MET  82           HA       MET  82   1.873  -3.261   4.839
    3    HB2  MET  82           HB2      MET  82   1.639  -3.593   1.848
    4    HB3  MET  82           HB3      MET  82   3.135  -3.051   2.605
    5    HG2  MET  82           HG2      MET  82   1.684  -5.615   3.332
    6    HG3  MET  82           HG3      MET  82   3.052  -5.529   2.226
    7    HE3  MET  82           HE1      MET  82   6.089  -4.852   4.198
    8    HE2  MET  82           HE2      MET  82   5.189  -3.467   3.586
    9    HE1  MET  82           HE3      MET  82   5.246  -4.957   2.647

  No H/Q in entry =           9
  In of MODEL   42
    1    H    THR  83           H        THR  83   0.071  -1.581   2.293
    2    HA   THR  83           HA       THR  83   1.529   0.840   2.377
    3    HB   THR  83           HB       THR  83  -0.634   1.807   1.402
    4    HG1  THR  83           HG1      THR  83  -2.309   0.541   1.300
    5   HG22  THR  83          HG21      THR  83  -0.407  -0.013  -0.603
    6   HG21  THR  83          HG22      THR  83   1.092  -0.334   0.267
    7   HG23  THR  83          HG23      THR  83   0.758   1.286  -0.344

  No H/Q in entry =           7
  In of MODEL   42
    1    H    SER  84           H        SER  84  -1.489  -0.138   3.990
    2    HA   SER  84           HA       SER  84  -1.934   2.299   5.340
    3    HB2  SER  84           HB2      SER  84  -2.817  -0.524   5.904
    4    HB3  SER  84           HB3      SER  84  -3.281   0.825   6.941
    5    HG   SER  84           HG       SER  84  -3.757   0.523   4.151

  No H/Q in entry =           5
  In of MODEL   42
    1    H    MET  85           H        MET  85  -0.274  -0.667   6.458
    2    HA   MET  85           HA       MET  85   0.274   0.246   9.061
    3    HB2  MET  85           HB2      MET  85   0.519  -2.101   8.383
    4    HB3  MET  85           HB3      MET  85   1.902  -1.664   7.378
    5    HG2  MET  85           HG2      MET  85   3.118  -0.866   9.358
    6    HG3  MET  85           HG3      MET  85   1.726  -1.235  10.376
    7    HE2  MET  85           HE1      MET  85   4.706  -3.985   8.358
    8    HE1  MET  85           HE2      MET  85   4.276  -2.321   7.970
    9    HE3  MET  85           HE3      MET  85   3.297  -3.645   7.347

  No H/Q in entry =           9
  In of MODEL   42
    1    H    LEU  86           H        LEU  86   2.200   0.469   6.102
    2    HA   LEU  86           HA       LEU  86   4.444   1.735   7.249
    3    HB2  LEU  86           HB2      LEU  86   4.222   0.660   4.940
    4    HB3  LEU  86           HB3      LEU  86   3.440   2.157   4.433
    5    HG   LEU  86           HG       LEU  86   5.496   3.363   5.405
    6   HD11  LEU  86          HD11      LEU  86   6.155   0.737   6.199
    7   HD13  LEU  86          HD12      LEU  86   7.186   2.163   6.293
    8   HD12  LEU  86          HD13      LEU  86   7.269   1.114   4.880
    9   HD23  LEU  86          HD21      LEU  86   6.168   1.590   3.049
   10   HD22  LEU  86          HD22      LEU  86   6.596   3.279   3.312
   11   HD21  LEU  86          HD23      LEU  86   4.932   2.843   2.920

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ALA  87           H        ALA  87   1.549   3.037   5.679
    2    HA   ALA  87           HA       ALA  87   2.196   5.755   5.763
    3    HB1  ALA  87           HB1      ALA  87  -0.146   4.172   5.231
    4    HB3  ALA  87           HB2      ALA  87   0.194   5.828   4.731
    5    HB2  ALA  87           HB3      ALA  87  -0.598   5.520   6.278

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ARG  88           H        ARG  88   0.479   3.783   8.159
    2    HA   ARG  88           HA       ARG  88   0.015   5.840  10.010
    3    HB2  ARG  88           HB2      ARG  88  -0.968   3.506  10.078
    4    HB3  ARG  88           HB3      ARG  88   0.566   2.975  10.777
    5    HG2  ARG  88           HG2      ARG  88   0.137   5.056  12.401
    6    HG3  ARG  88           HG3      ARG  88  -1.538   4.764  11.952
    7    HD2  ARG  88           HD2      ARG  88  -1.675   2.916  13.197
    8    HD3  ARG  88           HD3      ARG  88  -0.099   2.304  12.658
    9    HE   ARG  88           HE       ARG  88  -0.598   3.575  15.116
   10   HH21  ARG  88          HH11      ARG  88   0.985   4.555  16.349
   11   HH22  ARG  88          HH12      ARG  88   2.509   4.953  15.638
   12   HH11  ARG  88          HH21      ARG  88   1.674   3.715  12.529
   13   HH12  ARG  88          HH22      ARG  88   2.907   4.461  13.487

  No H/Q in entry =          13
  In of MODEL   42
    1    H    GLU  89           H        GLU  89   2.768   3.568   9.772
    2    HA   GLU  89           HA       GLU  89   4.057   4.430  12.111
    3    HB2  GLU  89           HB2      GLU  89   4.671   2.401  10.762
    4    HB3  GLU  89           HB3      GLU  89   5.462   3.481   9.613
    5    HG2  GLU  89           HG2      GLU  89   6.971   4.298  11.351
    6    HG3  GLU  89           HG3      GLU  89   6.123   3.356  12.574

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LEU  90           H        LEU  90   4.381   5.585   8.783
    2    HA   LEU  90           HA       LEU  90   6.351   7.548   9.362
    3    HB2  LEU  90           HB2      LEU  90   4.329   7.257   7.143
    4    HB3  LEU  90           HB3      LEU  90   5.583   8.504   7.160
    5    HG   LEU  90           HG       LEU  90   6.203   5.555   7.488
    6   HD12  LEU  90          HD11      LEU  90   6.945   5.778   5.045
    7   HD11  LEU  90          HD12      LEU  90   5.956   7.237   5.003
    8   HD13  LEU  90          HD13      LEU  90   5.209   5.677   5.347
    9   HD22  LEU  90          HD21      LEU  90   8.124   6.669   8.163
   10   HD21  LEU  90          HD22      LEU  90   7.796   8.081   7.159
   11   HD23  LEU  90          HD23      LEU  90   8.425   6.605   6.427

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  91           H        ILE  91   2.812   7.629   9.229
    2    HA   ILE  91           HA       ILE  91   2.522  10.407   9.684
    3    HB   ILE  91           HB       ILE  91   0.691   8.064  10.232
    4   HG12  ILE  91          HG12      ILE  91   0.475  10.352   8.250
    5   HG13  ILE  91          HG13      ILE  91   1.306   8.843   7.873
    6   HG22  ILE  91          HG21      ILE  91  -1.004  10.154  10.305
    7   HG21  ILE  91          HG22      ILE  91   0.416  10.958  10.973
    8   HG23  ILE  91          HG23      ILE  91  -0.244   9.531  11.770
    9   HD13  ILE  91          HD11      ILE  91  -0.661   7.591   7.925
   10   HD12  ILE  91          HD12      ILE  91  -1.225   9.117   7.247
   11   HD11  ILE  91          HD13      ILE  91  -1.496   8.756   8.953

  No H/Q in entry =          11
  In of MODEL   42
    1    H    THR  92           H        THR  92   2.886   7.657  11.881
    2    HA   THR  92           HA       THR  92   2.478   9.036  14.308
    3    HB   THR  92           HB       THR  92   4.241   6.670  13.633
    4    HG1  THR  92           HG1      THR  92   2.259   5.948  13.540
    5   HG22  THR  92          HG21      THR  92   3.864   6.390  16.268
    6   HG21  THR  92          HG22      THR  92   3.830   8.150  16.196
    7   HG23  THR  92          HG23      THR  92   5.246   7.270  15.617

  No H/Q in entry =           7
  In of MODEL   42
    1    H    GLU  93           H        GLU  93   5.412   8.537  12.361
    2    HA   GLU  93           HA       GLU  93   7.197   9.931  14.052
    3    HB2  GLU  93           HB2      GLU  93   7.268   9.618  11.036
    4    HB3  GLU  93           HB3      GLU  93   8.622  10.123  12.045
    5    HG2  GLU  93           HG2      GLU  93   7.168   7.511  12.496
    6    HG3  GLU  93           HG3      GLU  93   8.550   7.640  11.415

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LEU  94           H        LEU  94   5.155  10.984  11.348
    2    HA   LEU  94           HA       LEU  94   6.006  13.674  11.247
    3    HB2  LEU  94           HB2      LEU  94   3.390  12.353  10.503
    4    HB3  LEU  94           HB3      LEU  94   3.677  14.076  10.262
    5    HG   LEU  94           HG       LEU  94   5.655  12.055   9.201
    6   HD11  LEU  94          HD11      LEU  94   2.919  12.653   8.151
    7   HD13  LEU  94          HD12      LEU  94   3.877  11.180   8.020
    8   HD12  LEU  94          HD13      LEU  94   4.231  12.556   6.975
    9   HD23  LEU  94          HD21      LEU  94   5.930  13.888   7.479
   10   HD22  LEU  94          HD22      LEU  94   6.359  14.373   9.120
   11   HD21  LEU  94          HD23      LEU  94   4.814  14.867   8.428

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  95           H        ILE  95   3.449  12.098  13.147
    2    HA   ILE  95           HA       ILE  95   2.451  14.464  14.348
    3    HB   ILE  95           HB       ILE  95   2.424  11.582  15.271
    4   HG12  ILE  95          HG12      ILE  95   0.229  13.393  14.232
    5   HG13  ILE  95          HG13      ILE  95   1.163  12.318  13.195
    6   HG21  ILE  95          HG21      ILE  95   1.188  14.074  16.479
    7   HG23  ILE  95          HG22      ILE  95   2.219  12.888  17.279
    8   HG22  ILE  95          HG23      ILE  95   0.575  12.454  16.810
    9   HD13  ILE  95          HD11      ILE  95   0.232  10.395  14.117
   10   HD12  ILE  95          HD12      ILE  95  -1.132  11.506  14.199
   11   HD11  ILE  95          HD13      ILE  95  -0.166  11.191  15.640

  No H/Q in entry =          11
  In of MODEL   42
    1    H    GLU  96           H        GLU  96   5.013  12.202  15.332
    2    HA   GLU  96           HA       GLU  96   5.598  13.390  17.822
    3    HB2  GLU  96           HB2      GLU  96   6.508  11.216  17.169
    4    HB3  GLU  96           HB3      GLU  96   7.449  11.975  15.886
    5    HG2  GLU  96           HG2      GLU  96   9.112  12.496  17.342
    6    HG3  GLU  96           HG3      GLU  96   7.982  13.327  18.403

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LEU  97           H        LEU  97   6.671  14.147  14.532
    2    HA   LEU  97           HA       LEU  97   8.592  16.112  15.238
    3    HB2  LEU  97           HB2      LEU  97   6.982  15.590  12.749
    4    HB3  LEU  97           HB3      LEU  97   8.025  17.005  12.868
    5    HG   LEU  97           HG       LEU  97   9.011  14.191  13.422
    6   HD12  LEU  97          HD11      LEU  97  10.002  14.371  11.101
    7   HD11  LEU  97          HD12      LEU  97   8.971  15.778  10.842
    8   HD13  LEU  97          HD13      LEU  97   8.248  14.197  11.139
    9   HD23  LEU  97          HD21      LEU  97  11.197  15.436  12.671
   10   HD22  LEU  97          HD22      LEU  97  10.589  15.715  14.303
   11   HD21  LEU  97          HD23      LEU  97  10.289  16.903  13.036

  No H/Q in entry =          11
  In of MODEL   42
    1    H    HIS  98           H        HIS  98   5.100  16.303  14.598
    2    HA   HIS  98           HA       HIS  98   4.845  19.107  14.736
    3    HB2  HIS  98           HB2      HIS  98   2.924  16.885  15.468
    4    HB3  HIS  98           HB3      HIS  98   2.483  18.593  15.526
    5    HD1  HIS  98           HD1      HIS  98   3.453  15.864  13.116
    6    HD2  HIS  98           HD2      HIS  98   2.137  19.818  13.001
    7    HE1  HIS  98           HE1      HIS  98   2.892  16.363  10.694
    8    HE2  HIS  98           HE2      HIS  98   2.094  18.765  10.604

  No H/Q in entry =           8
  In of MODEL   42
    1    H    GLU  99           H        GLU  99   4.950  16.615  17.233
    2    HA   GLU  99           HA       GLU  99   4.377  18.317  19.434
    3    HB2  GLU  99           HB2      GLU  99   4.250  15.836  19.530
    4    HB3  GLU  99           HB3      GLU  99   6.008  15.764  19.415
    5    HG2  GLU  99           HG2      GLU  99   6.225  17.052  21.489
    6    HG3  GLU  99           HG3      GLU  99   4.475  17.220  21.591

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LYS 100           H        LYS 100   7.409  17.340  17.857
    2    HA   LYS 100           HA       LYS 100   9.093  18.714  19.708
    3    HB2  LYS 100           HB2      LYS 100   9.566  17.784  16.866
    4    HB3  LYS 100           HB3      LYS 100  10.812  18.534  17.870
    5    HG2  LYS 100           HG2      LYS 100  10.415  16.788  19.611
    6    HG3  LYS 100           HG3      LYS 100   9.267  16.002  18.524
    7    HD2  LYS 100           HD2      LYS 100  11.050  15.693  16.850
    8    HD3  LYS 100           HD3      LYS 100  12.203  16.490  17.922
    9    HE2  LYS 100           HE2      LYS 100  11.787  14.740  19.641
   10    HE3  LYS 100           HE3      LYS 100  10.695  13.922  18.519
   11    HZ1  LYS 100           HZ1      LYS 100  13.522  14.548  17.853
   12    HZ3  LYS 100           HZ2      LYS 100  12.459  13.510  17.028
   13    HZ2  LYS 100           HZ3      LYS 100  13.047  13.081  18.564

  No H/Q in entry =          13
  In of MODEL   42
    1    H    LEU 101           H        LEU 101   7.402  19.669  16.759
    2    HA   LEU 101           HA       LEU 101   8.655  22.207  16.422
    3    HB2  LEU 101           HB2      LEU 101   6.037  21.015  15.544
    4    HB3  LEU 101           HB3      LEU 101   6.314  22.742  15.337
    5    HG   LEU 101           HG       LEU 101   8.315  20.695  14.362
    6   HD12  LEU 101          HD11      LEU 101   7.160  21.220  12.082
    7   HD11  LEU 101          HD12      LEU 101   5.772  21.671  13.068
    8   HD13  LEU 101          HD13      LEU 101   6.411  20.030  13.146
    9   HD21  LEU 101          HD21      LEU 101   7.730  23.617  13.811
   10   HD23  LEU 101          HD22      LEU 101   8.691  22.642  12.699
   11   HD22  LEU 101          HD23      LEU 101   9.244  22.890  14.355

  No H/Q in entry =          11
  In of MODEL   42
    1    H    LYS 102           H        LYS 102   7.110  21.091  19.042
    2    HA   LYS 102           HA       LYS 102   6.503  22.191  20.978
    3    HB2  LYS 102           HB2      LYS 102   7.812  24.162  19.850
    4    HB3  LYS 102           HB3      LYS 102   6.221  24.792  19.481
    5    HG2  LYS 102           HG2      LYS 102   7.605  24.512  22.127
    6    HG3  LYS 102           HG3      LYS 102   6.671  25.856  21.503
    7    HD2  LYS 102           HD2      LYS 102   5.389  23.239  22.385
    8    HD3  LYS 102           HD3      LYS 102   5.663  24.595  23.468
    9    HE2  LYS 102           HE2      LYS 102   3.372  24.229  21.988
   10    HE3  LYS 102           HE3      LYS 102   3.902  25.766  22.670
   11    HZ2  LYS 102           HZ1      LYS 102   3.364  25.885  20.292
   12    HZ1  LYS 102           HZ2      LYS 102   4.607  24.783  19.963
   13    HZ3  LYS 102           HZ3      LYS 102   4.976  26.308  20.606

  No H/Q in entry =          13
  In of MODEL   42
    1    H    ALA 103           H        ALA 103   4.878  23.762  18.218
    2    HA   ALA 103           HA       ALA 103   2.437  24.376  19.114
    3    HB1  ALA 103           HB1      ALA 103   1.517  23.551  16.874
    4    HB2  ALA 103           HB2      ALA 103   3.154  22.988  16.537
    5    HB3  ALA 103           HB3      ALA 103   2.847  24.705  16.807

  No H/Q in entry =           5
  In of MODEL   42
    1    H1   ALA   1           H3       ALA   1  10.226 -20.232  -6.232
    2    H2   ALA   1           H2       ALA   1   9.252 -20.421  -7.614
    3    H3   ALA   1           H1       ALA   1   8.809 -21.162  -6.150
    4    HA   ALA   1           HA       ALA   1   9.815 -22.987  -6.896
    5    HB1  ALA   1           HB1      ALA   1   9.907 -22.627  -9.171
    6    HB2  ALA   1           HB2      ALA   1  11.638 -22.505  -8.849
    7    HB3  ALA   1           HB3      ALA   1  10.663 -21.042  -8.995

  No H/Q in entry =           7
  In of MODEL   42
    1    H    GLU   2           H        GLU   2  12.083 -23.975  -6.964
    2    HA   GLU   2           HA       GLU   2  13.475 -23.918  -4.758
    3    HB2  GLU   2           HB2      GLU   2  14.822 -23.806  -7.463
    4    HB3  GLU   2           HB3      GLU   2  15.546 -24.431  -5.981
    5    HG2  GLU   2           HG2      GLU   2  14.495 -26.430  -6.220
    6    HG3  GLU   2           HG3      GLU   2  12.935 -25.658  -6.471

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLU   3           H        GLU   3  15.267 -22.081  -7.165
    2    HA   GLU   3           HA       GLU   3  16.456 -20.415  -5.209
    3    HB2  GLU   3           HB2      GLU   3  16.388 -20.409  -8.219
    4    HB3  GLU   3           HB3      GLU   3  17.159 -19.094  -7.334
    5    HG2  GLU   3           HG2      GLU   3  18.802 -20.496  -6.420
    6    HG3  GLU   3           HG3      GLU   3  17.831 -21.947  -6.638

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LEU   4           H        LEU   4  14.177 -19.527  -7.829
    2    HA   LEU   4           HA       LEU   4  13.758 -16.911  -7.213
    3    HB2  LEU   4           HB2      LEU   4  11.546 -18.848  -7.936
    4    HB3  LEU   4           HB3      LEU   4  11.500 -17.098  -8.133
    5    HG   LEU   4           HG       LEU   4  13.427 -18.993  -9.516
    6   HD13  LEU   4          HD11      LEU   4  12.119 -18.820 -11.420
    7   HD12  LEU   4          HD12      LEU   4  11.440 -17.264 -10.948
    8   HD11  LEU   4          HD13      LEU   4  10.864 -18.746 -10.186
    9   HD23  LEU   4          HD21      LEU   4  13.795 -16.752 -10.867
   10   HD22  LEU   4          HD22      LEU   4  14.657 -17.010  -9.351
   11   HD21  LEU   4          HD23      LEU   4  13.221 -15.990  -9.383

  No H/Q in entry =          11
  In of MODEL   42
    1    H    GLU   5           H        GLU   5  12.233 -19.671  -5.567
    2    HA   GLU   5           HA       GLU   5  10.590 -18.073  -3.856
    3    HB2  GLU   5           HB2      GLU   5  10.108 -20.436  -4.369
    4    HB3  GLU   5           HB3      GLU   5  11.552 -20.908  -3.470
    5    HG2  GLU   5           HG2      GLU   5  10.647 -19.882  -1.434
    6    HG3  GLU   5           HG3      GLU   5   9.217 -19.357  -2.322

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLU   6           H        GLU   6  13.711 -19.706  -3.428
    2    HA   GLU   6           HA       GLU   6  14.090 -18.859  -0.731
    3    HB2  GLU   6           HB2      GLU   6  16.020 -19.831  -2.850
    4    HB3  GLU   6           HB3      GLU   6  16.490 -19.489  -1.183
    5    HG2  GLU   6           HG2      GLU   6  14.891 -21.146  -0.359
    6    HG3  GLU   6           HG3      GLU   6  14.327 -21.450  -2.002

  No H/Q in entry =           6
  In of MODEL   42
    1    H    VAL   7           H        VAL   7  14.864 -17.542  -3.883
    2    HA   VAL   7           HA       VAL   7  16.588 -15.444  -3.023
    3    HB   VAL   7           HB       VAL   7  14.866 -15.777  -5.493
    4   HG11  VAL   7          HG11      VAL   7  16.799 -13.596  -4.688
    5   HG13  VAL   7          HG12      VAL   7  15.157 -13.426  -5.303
    6   HG12  VAL   7          HG13      VAL   7  16.453 -13.949  -6.380
    7   HG21  VAL   7          HG21      VAL   7  16.951 -17.268  -4.935
    8   HG23  VAL   7          HG22      VAL   7  17.878 -15.822  -5.336
    9   HG22  VAL   7          HG23      VAL   7  16.825 -16.553  -6.543

  No H/Q in entry =           9
  In of MODEL   42
    1    H    VAL   8           H        VAL   8  13.090 -15.656  -3.565
    2    HA   VAL   8           HA       VAL   8  12.470 -12.938  -3.088
    3    HB   VAL   8           HB       VAL   8  10.821 -15.442  -2.652
    4   HG13  VAL   8          HG11      VAL   8   9.880 -13.717  -1.264
    5   HG12  VAL   8          HG12      VAL   8   8.889 -13.790  -2.722
    6   HG11  VAL   8          HG13      VAL   8  10.080 -12.506  -2.530
    7   HG21  VAL   8          HG21      VAL   8  11.704 -14.348  -5.029
    8   HG23  VAL   8          HG22      VAL   8  10.168 -13.516  -4.813
    9   HG22  VAL   8          HG23      VAL   8  10.213 -15.275  -4.868

  No H/Q in entry =           9
  In of MODEL   42
    1    H    MET   9           H        MET   9  12.701 -15.750  -0.912
    2    HA   MET   9           HA       MET   9  11.917 -14.467   1.463
    3    HB2  MET   9           HB2      MET   9  13.764 -16.781   0.898
    4    HB3  MET   9           HB3      MET   9  13.525 -16.187   2.542
    5    HG2  MET   9           HG2      MET   9  10.993 -16.389   2.030
    6    HG3  MET   9           HG3      MET   9  11.495 -17.394   0.669
    7    HE3  MET   9           HE1      MET   9  13.190 -20.420   2.138
    8    HE2  MET   9           HE2      MET   9  13.968 -18.962   1.529
    9    HE1  MET   9           HE3      MET   9  12.530 -19.584   0.726

  No H/Q in entry =           9
  In of MODEL   42
    1    H    GLY  10           H        GLY  10  15.087 -14.741  -0.107
    2    HA3  GLY  10           HA2      GLY  10  16.577 -13.345   1.858
    3    HA2  GLY  10           HA3      GLY  10  17.030 -13.516   0.162

  No H/Q in entry =           3
  In of MODEL   42
    1    H    LEU  11           H        LEU  11  14.875 -12.260  -1.067
    2    HA   LEU  11           HA       LEU  11  15.603  -9.526  -0.904
    3    HB2  LEU  11           HB2      LEU  11  13.209 -10.898  -2.130
    4    HB3  LEU  11           HB3      LEU  11  13.515  -9.168  -2.289
    5    HG   LEU  11           HG       LEU  11  15.507 -11.306  -3.088
    6   HD13  LEU  11          HD11      LEU  11  13.749 -11.645  -4.601
    7   HD12  LEU  11          HD12      LEU  11  14.766 -10.478  -5.444
    8   HD11  LEU  11          HD13      LEU  11  13.304  -9.938  -4.619
    9   HD22  LEU  11          HD21      LEU  11  16.769  -9.362  -2.866
   10   HD21  LEU  11          HD22      LEU  11  15.408  -8.304  -3.237
   11   HD23  LEU  11          HD23      LEU  11  16.221  -9.184  -4.531

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  12           H        ILE  12  12.813 -11.311   0.374
    2    HA   ILE  12           HA       ILE  12  11.457  -9.068   1.441
    3    HB   ILE  12           HB       ILE  12  11.455 -11.950   2.390
    4   HG12  ILE  12          HG12      ILE  12  10.770 -11.308  -0.057
    5   HG13  ILE  12          HG13      ILE  12   9.732 -12.383   0.858
    6   HG21  ILE  12          HG21      ILE  12   9.568  -9.644   2.962
    7   HG23  ILE  12          HG22      ILE  12  10.528 -10.546   4.132
    8   HG22  ILE  12          HG23      ILE  12   9.183 -11.329   3.303
    9   HD12  ILE  12          HD11      ILE  12   8.519 -10.567  -0.375
   10   HD11  ILE  12          HD12      ILE  12   9.347  -9.388   0.640
   11   HD13  ILE  12          HD13      ILE  12   8.240 -10.538   1.357

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  13           H        ILE  13  13.824 -11.308   2.835
    2    HA   ILE  13           HA       ILE  13  13.887 -10.132   5.416
    3    HB   ILE  13           HB       ILE  13  15.921 -11.730   3.841
    4   HG12  ILE  13          HG12      ILE  13  13.634 -12.670   4.678
    5   HG13  ILE  13          HG13      ILE  13  15.096 -13.612   4.948
    6   HG21  ILE  13          HG21      ILE  13  16.091 -10.539   6.592
    7   HG23  ILE  13          HG22      ILE  13  17.347 -10.681   5.368
    8   HG22  ILE  13          HG23      ILE  13  16.852 -12.100   6.291
    9   HD11  ILE  13          HD11      ILE  13  13.975 -11.699   7.024
   10   HD13  ILE  13          HD12      ILE  13  15.222 -12.922   7.242
   11   HD12  ILE  13          HD13      ILE  13  13.555 -13.409   6.960

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ASN  14           H        ASN  14  15.836  -9.626   2.490
    2    HA   ASN  14           HA       ASN  14  17.611  -7.709   3.546
    3    HB2  ASN  14           HB2      ASN  14  17.561  -8.973   1.229
    4    HB3  ASN  14           HB3      ASN  14  16.685  -7.543   0.697
    5   HD21  ASN  14          HD21      ASN  14  19.116  -7.914  -0.499
    6   HD22  ASN  14          HD22      ASN  14  20.276  -6.847   0.125

  No H/Q in entry =           6
  In of MODEL   42
    1    H    SER  15           H        SER  15  14.498  -7.319   1.867
    2    HA   SER  15           HA       SER  15  14.423  -4.497   1.926
    3    HB2  SER  15           HB2      SER  15  12.084  -4.714   1.442
    4    HB3  SER  15           HB3      SER  15  12.861  -6.086   0.664
    5    HG   SER  15           HG       SER  15  11.420  -7.151   1.784

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLY  16           H        GLY  16  13.307  -6.945   4.232
    2    HA3  GLY  16           HA2      GLY  16  12.116  -5.183   6.096
    3    HA2  GLY  16           HA3      GLY  16  12.711  -6.799   6.454

  No H/Q in entry =           3
  In of MODEL   42
    1    H    GLN  17           H        GLN  17  15.424  -6.500   5.851
    2    HA   GLN  17           HA       GLN  17  16.406  -5.293   8.229
    3    HB2  GLN  17           HB2      GLN  17  17.809  -6.152   5.685
    4    HB3  GLN  17           HB3      GLN  17  18.662  -5.576   7.116
    5    HG2  GLN  17           HG2      GLN  17  16.735  -7.913   7.099
    6    HG3  GLN  17           HG3      GLN  17  18.489  -8.068   7.029
    7   HE21  GLN  17          HE21      GLN  17  16.062  -8.370   9.200
    8   HE22  GLN  17          HE22      GLN  17  16.844  -7.836  10.609

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ALA  18           H        ALA  18  16.217  -4.210   4.871
    2    HA   ALA  18           HA       ALA  18  17.683  -1.835   5.094
    3    HB2  ALA  18           HB1      ALA  18  16.542  -3.034   3.030
    4    HB3  ALA  18           HB2      ALA  18  16.828  -1.295   3.015
    5    HB1  ALA  18           HB3      ALA  18  15.223  -1.921   3.390

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ARG  19           H        ARG  19  14.178  -2.381   5.504
    2    HA   ARG  19           HA       ARG  19  13.545   0.277   6.224
    3    HB2  ARG  19           HB2      ARG  19  11.841  -1.454   5.642
    4    HB3  ARG  19           HB3      ARG  19  12.179  -2.257   7.177
    5    HG2  ARG  19           HG2      ARG  19  11.497  -0.259   8.421
    6    HG3  ARG  19           HG3      ARG  19  11.252   0.622   6.914
    7    HD2  ARG  19           HD2      ARG  19   9.104  -0.149   7.742
    8    HD3  ARG  19           HD3      ARG  19   9.507  -1.032   6.263
    9    HE   ARG  19           HE       ARG  19  10.455  -2.588   8.364
   10   HH21  ARG  19          HH11      ARG  19   9.189  -4.214   9.306
   11   HH22  ARG  19          HH12      ARG  19   7.469  -4.165   9.142
   12   HH11  ARG  19          HH21      ARG  19   7.472  -1.258   7.281
   13   HH12  ARG  19          HH22      ARG  19   6.497  -2.492   7.991

  No H/Q in entry =          13
  In of MODEL   42
    1    H    SER  20           H        SER  20  14.376  -2.566   8.178
    2    HA   SER  20           HA       SER  20  14.116  -1.465  10.717
    3    HB2  SER  20           HB2      SER  20  14.720  -3.886  10.032
    4    HB3  SER  20           HB3      SER  20  16.387  -3.316  10.014
    5    HG   SER  20           HG       SER  20  16.364  -3.228  12.119

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU  21           H        LEU  21  16.952  -1.436   8.570
    2    HA   LEU  21           HA       LEU  21  18.651   0.028  10.303
    3    HB2  LEU  21           HB2      LEU  21  18.615  -0.241   7.289
    4    HB3  LEU  21           HB3      LEU  21  19.882   0.603   8.174
    5    HG   LEU  21           HG       LEU  21  19.109  -2.281   8.707
    6   HD12  LEU  21          HD11      LEU  21  21.450  -1.225   7.091
    7   HD11  LEU  21          HD12      LEU  21  19.992  -1.928   6.391
    8   HD13  LEU  21          HD13      LEU  21  21.053  -2.918   7.390
    9   HD21  LEU  21          HD21      LEU  21  21.243  -0.409   9.714
   10   HD23  LEU  21          HD22      LEU  21  21.609  -2.128   9.616
   11   HD22  LEU  21          HD23      LEU  21  20.283  -1.572  10.623

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ALA  22           H        ALA  22  16.389   1.026   7.757
    2    HA   ALA  22           HA       ALA  22  16.962   3.778   7.771
    3    HB3  ALA  22           HB1      ALA  22  15.537   2.555   6.097
    4    HB2  ALA  22           HB2      ALA  22  14.851   4.075   6.668
    5    HB1  ALA  22           HB3      ALA  22  14.245   2.543   7.296

  No H/Q in entry =           5
  In of MODEL   42
    1    H    TYR  23           H        TYR  23  14.449   1.991   9.614
    2    HA   TYR  23           HA       TYR  23  13.520   4.238  11.069
    3    HB2  TYR  23           HB2      TYR  23  12.259   2.138  11.049
    4    HB3  TYR  23           HB3      TYR  23  13.583   1.313  11.871
    5    HD1  TYR  23           HD1      TYR  23  11.113   4.086  12.240
    6    HD2  TYR  23           HD2      TYR  23  13.785   1.372  14.227
    7    HE1  TYR  23           HE1      TYR  23  10.198   4.791  14.436
    8    HE2  TYR  23           HE2      TYR  23  12.869   2.077  16.421
    9    HH   TYR  23           HH       TYR  23  10.073   4.199  16.650

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ALA  24           H        ALA  24  16.139   1.929  11.694
    2    HA   ALA  24           HA       ALA  24  16.831   2.914  14.256
    3    HB1  ALA  24           HB1      ALA  24  18.164   1.104  14.084
    4    HB3  ALA  24           HB2      ALA  24  19.199   2.013  12.983
    5    HB2  ALA  24           HB3      ALA  24  17.889   1.022  12.345

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA  25           H        ALA  25  17.787   3.834  10.974
    2    HA   ALA  25           HA       ALA  25  19.760   5.742  11.615
    3    HB1  ALA  25           HB1      ALA  25  19.023   4.806   9.301
    4    HB3  ALA  25           HB2      ALA  25  19.546   6.487   9.394
    5    HB2  ALA  25           HB3      ALA  25  17.826   6.102   9.331

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU  26           H        LEU  26  16.247   6.017  11.267
    2    HA   LEU  26           HA       LEU  26  16.060   8.801  11.721
    3    HB2  LEU  26           HB2      LEU  26  14.179   7.591  10.799
    4    HB3  LEU  26           HB3      LEU  26  14.081   6.563  12.223
    5    HG   LEU  26           HG       LEU  26  13.505   8.527  13.608
    6   HD12  LEU  26          HD11      LEU  26  12.867  10.638  12.287
    7   HD11  LEU  26          HD12      LEU  26  13.834   9.973  10.973
    8   HD13  LEU  26          HD13      LEU  26  14.590  10.347  12.523
    9   HD21  LEU  26          HD21      LEU  26  11.817   8.239  11.104
   10   HD23  LEU  26          HD22      LEU  26  11.271   8.942  12.623
   11   HD22  LEU  26          HD23      LEU  26  11.700   7.235  12.550

  No H/Q in entry =          11
  In of MODEL   42
    1    H    LYS  27           H        LYS  27  15.923   6.021  13.912
    2    HA   LYS  27           HA       LYS  27  15.358   7.392  16.283
    3    HB2  LYS  27           HB2      LYS  27  15.351   4.917  16.016
    4    HB3  LYS  27           HB3      LYS  27  17.115   4.946  15.966
    5    HG2  LYS  27           HG2      LYS  27  17.187   5.928  18.217
    6    HG3  LYS  27           HG3      LYS  27  15.420   5.971  18.269
    7    HD2  LYS  27           HD2      LYS  27  15.360   3.504  18.029
    8    HD3  LYS  27           HD3      LYS  27  17.125   3.470  18.011
    9    HE2  LYS  27           HE2      LYS  27  17.181   4.456  20.269
   10    HE3  LYS  27           HE3      LYS  27  15.416   4.520  20.290
   11    HZ3  LYS  27           HZ1      LYS  27  16.181   2.556  21.436
   12    HZ2  LYS  27           HZ2      LYS  27  17.085   2.066  20.081
   13    HZ1  LYS  27           HZ3      LYS  27  15.387   2.094  20.008

  No H/Q in entry =          13
  In of MODEL   42
    1    H    GLN  28           H        GLN  28  18.460   6.768  14.680
    2    HA   GLN  28           HA       GLN  28  20.166   7.826  16.665
    3    HB2  GLN  28           HB2      GLN  28  20.444   7.783  13.649
    4    HB3  GLN  28           HB3      GLN  28  21.741   8.230  14.757
    5    HG2  GLN  28           HG2      GLN  28  20.278   5.574  14.789
    6    HG3  GLN  28           HG3      GLN  28  21.867   5.840  14.072
    7   HE21  GLN  28          HE21      GLN  28  20.597   4.503  16.749
    8   HE22  GLN  28          HE22      GLN  28  21.779   4.914  17.895

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ALA  29           H        ALA  29  18.426   9.337  13.981
    2    HA   ALA  29           HA       ALA  29  19.464  11.942  14.233
    3    HB2  ALA  29           HB1      ALA  29  17.769  12.605  12.769
    4    HB1  ALA  29           HB2      ALA  29  16.611  11.448  13.423
    5    HB3  ALA  29           HB3      ALA  29  17.929  10.888  12.394

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LYS  30           H        LYS  30  16.670  10.382  15.762
    2    HA   LYS  30           HA       LYS  30  15.694  12.649  17.126
    3    HB2  LYS  30           HB2      LYS  30  15.541   9.709  17.827
    4    HB3  LYS  30           HB3      LYS  30  14.697  10.971  18.725
    5    HG2  LYS  30           HG2      LYS  30  13.575  11.676  16.611
    6    HG3  LYS  30           HG3      LYS  30  14.356  10.329  15.780
    7    HD2  LYS  30           HD2      LYS  30  13.266   8.736  17.311
    8    HD3  LYS  30           HD3      LYS  30  12.494  10.072  18.166
    9    HE2  LYS  30           HE2      LYS  30  11.328  10.725  16.079
   10    HE3  LYS  30           HE3      LYS  30  12.079   9.361  15.243
   11    HZ2  LYS  30           HZ1      LYS  30   9.768   8.986  16.131
   12    HZ1  LYS  30           HZ2      LYS  30  10.442   9.027  17.696
   13    HZ3  LYS  30           HZ3      LYS  30  10.928   7.835  16.583

  No H/Q in entry =          13
  In of MODEL   42
    1    H    GLN  31           H        GLN  31  18.324  10.438  17.850
    2    HA   GLN  31           HA       GLN  31  18.677  11.444  20.545
    3    HB2  GLN  31           HB2      GLN  31  20.670   9.844  18.931
    4    HB3  GLN  31           HB3      GLN  31  20.544   9.969  20.686
    5    HG2  GLN  31           HG2      GLN  31  18.013   9.056  19.925
    6    HG3  GLN  31           HG3      GLN  31  19.098   8.196  18.840
    7   HE21  GLN  31          HE21      GLN  31  17.546   7.071  21.121
    8   HE22  GLN  31          HE22      GLN  31  18.695   6.391  22.166

  No H/Q in entry =           8
  In of MODEL   42
    1    H    GLY  32           H        GLY  32  19.205  12.757  17.578
    2    HA3  GLY  32           HA2      GLY  32  20.219  14.787  17.062
    3    HA2  GLY  32           HA3      GLY  32  20.982  14.779  18.647

  No H/Q in entry =           3
  In of MODEL   42
    1    H    ASP  33           H        ASP  33  21.353  11.882  16.865
    2    HA   ASP  33           HA       ASP  33  24.187  12.515  16.389
    3    HB2  ASP  33           HB2      ASP  33  22.639   9.922  16.508
    4    HB3  ASP  33           HB3      ASP  33  24.325  10.013  16.007

  No H/Q in entry =           4
  In of MODEL   42
    1    H    PHE  34           H        PHE  34  23.719  13.847  14.511
    2    HA   PHE  34           HA       PHE  34  22.346  12.887  12.228
    3    HB2  PHE  34           HB2      PHE  34  24.511  14.988  12.453
    4    HB3  PHE  34           HB3      PHE  34  23.516  14.714  11.024
    5    HD1  PHE  34           HD1      PHE  34  23.807  16.641  13.939
    6    HD2  PHE  34           HD2      PHE  34  20.889  14.572  11.562
    7    HE1  PHE  34           HE1      PHE  34  22.015  18.065  14.895
    8    HE2  PHE  34           HE2      PHE  34  19.101  15.996  12.520
    9    HZ   PHE  34           HZ       PHE  34  19.668  17.743  14.182

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ALA  35           H        ALA  35  25.721  12.647  13.223
    2    HA   ALA  35           HA       ALA  35  26.805  11.812  10.761
    3    HB3  ALA  35           HB1      ALA  35  28.474  10.616  12.473
    4    HB2  ALA  35           HB2      ALA  35  27.630  11.653  13.623
    5    HB1  ALA  35           HB3      ALA  35  28.473  12.365  12.248

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA  36           H        ALA  36  25.671   9.870  13.528
    2    HA   ALA  36           HA       ALA  36  26.113   7.377  12.248
    3    HB2  ALA  36           HB1      ALA  36  25.679   6.635  14.324
    4    HB3  ALA  36           HB2      ALA  36  23.998   7.154  14.181
    5    HB1  ALA  36           HB3      ALA  36  25.218   8.267  14.801

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA  37           H        ALA  37  23.324   9.544  12.395
    2    HA   ALA  37           HA       ALA  37  21.438   7.803  11.224
    3    HB3  ALA  37           HB1      ALA  37  21.707  10.762  11.519
    4    HB1  ALA  37           HB2      ALA  37  20.382   9.702  11.995
    5    HB2  ALA  37           HB3      ALA  37  20.571  10.173  10.305

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LYS  38           H        LYS  38  23.566  10.235   9.740
    2    HA   LYS  38           HA       LYS  38  22.911   9.820   7.065
    3    HB2  LYS  38           HB2      LYS  38  24.748  11.350   8.505
    4    HB3  LYS  38           HB3      LYS  38  25.763  10.347   7.474
    5    HG2  LYS  38           HG2      LYS  38  24.602  11.137   5.483
    6    HG3  LYS  38           HG3      LYS  38  23.423  12.007   6.470
    7    HD2  LYS  38           HD2      LYS  38  25.043  13.582   7.218
    8    HD3  LYS  38           HD3      LYS  38  26.387  12.577   6.676
    9    HE2  LYS  38           HE2      LYS  38  26.051  14.455   5.128
   10    HE3  LYS  38           HE3      LYS  38  25.692  12.923   4.323
   11    HZ3  LYS  38           HZ1      LYS  38  23.501  13.399   4.202
   12    HZ2  LYS  38           HZ2      LYS  38  24.046  15.006   4.289
   13    HZ1  LYS  38           HZ3      LYS  38  23.466  14.229   5.683

  No H/Q in entry =          13
  In of MODEL   42
    1    H    ALA  39           H        ALA  39  25.410   8.185   9.009
    2    HA   ALA  39           HA       ALA  39  26.449   6.585   6.934
    3    HB2  ALA  39           HB1      ALA  39  26.358   5.619   9.777
    4    HB1  ALA  39           HB2      ALA  39  27.329   7.032   9.359
    5    HB3  ALA  39           HB3      ALA  39  27.656   5.478   8.592

  No H/Q in entry =           5
  In of MODEL   42
    1    H    MET  40           H        MET  40  23.837   6.002   9.241
    2    HA   MET  40           HA       MET  40  23.355   3.304   8.505
    3    HB2  MET  40           HB2      MET  40  21.571   5.370   9.807
    4    HB3  MET  40           HB3      MET  40  21.141   3.667   9.632
    5    HG2  MET  40           HG2      MET  40  23.708   4.572  10.964
    6    HG3  MET  40           HG3      MET  40  22.213   4.315  11.863
    7    HE3  MET  40           HE1      MET  40  21.601   0.690  12.036
    8    HE2  MET  40           HE2      MET  40  20.747   2.005  11.233
    9    HE1  MET  40           HE3      MET  40  21.498   2.280  12.804

  No H/Q in entry =           9
  In of MODEL   42
    1    H    MET  41           H        MET  41  21.977   6.377   7.327
    2    HA   MET  41           HA       MET  41  19.998   5.210   5.661
    3    HB2  MET  41           HB2      MET  41  21.511   7.781   5.145
    4    HB3  MET  41           HB3      MET  41  19.974   7.309   4.432
    5    HG2  MET  41           HG2      MET  41  19.236   7.127   6.986
    6    HG3  MET  41           HG3      MET  41  20.560   8.267   7.204
    7    HE2  MET  41           HE1      MET  41  20.002   9.566   3.872
    8    HE1  MET  41           HE2      MET  41  20.970   9.991   5.280
    9    HE3  MET  41           HE3      MET  41  19.709  11.088   4.722

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ASP  42           H        ASP  42  23.380   6.090   5.096
    2    HA   ASP  42           HA       ASP  42  23.455   5.618   2.338
    3    HB2  ASP  42           HB2      ASP  42  25.226   6.590   4.102
    4    HB3  ASP  42           HB3      ASP  42  25.862   4.956   3.969

  No H/Q in entry =           4
  In of MODEL   42
    1    H    GLN  43           H        GLN  43  24.162   3.450   5.053
    2    HA   GLN  43           HA       GLN  43  24.791   1.186   3.465
    3    HB2  GLN  43           HB2      GLN  43  23.782   1.379   6.313
    4    HB3  GLN  43           HB3      GLN  43  24.338  -0.116   5.554
    5    HG2  GLN  43           HG2      GLN  43  26.515   1.067   5.036
    6    HG3  GLN  43           HG3      GLN  43  25.953   2.401   6.039
    7   HE21  GLN  43          HE21      GLN  43  28.178   1.397   7.066
    8   HE22  GLN  43          HE22      GLN  43  27.894   0.317   8.342

  No H/Q in entry =           8
  In of MODEL   42
    1    H    SER  44           H        SER  44  21.755   2.358   4.863
    2    HA   SER  44           HA       SER  44  20.155   0.136   4.194
    3    HB2  SER  44           HB2      SER  44  19.750   2.669   5.344
    4    HB3  SER  44           HB3      SER  44  18.710   2.641   3.923
    5    HG   SER  44           HG       SER  44  17.611   1.710   5.649

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ARG  45           H        ARG  45  20.929   3.093   2.390
    2    HA   ARG  45           HA       ARG  45  19.389   2.630   0.090
    3    HB2  ARG  45           HB2      ARG  45  20.563   4.750   0.673
    4    HB3  ARG  45           HB3      ARG  45  22.096   3.976   0.280
    5    HG2  ARG  45           HG2      ARG  45  21.298   3.584  -2.032
    6    HG3  ARG  45           HG3      ARG  45  19.778   4.381  -1.638
    7    HD2  ARG  45           HD2      ARG  45  21.058   6.460  -1.056
    8    HD3  ARG  45           HD3      ARG  45  22.542   5.667  -1.632
    9    HE   ARG  45           HE       ARG  45  20.600   5.458  -3.660
   10   HH21  ARG  45          HH11      ARG  45  20.604   6.829  -5.422
   11   HH22  ARG  45          HH12      ARG  45  21.382   8.369  -5.319
   12   HH11  ARG  45          HH21      ARG  45  22.370   7.931  -2.037
   13   HH12  ARG  45          HH22      ARG  45  22.381   8.992  -3.399

  No H/Q in entry =          13
  In of MODEL   42
    1    H    MET  46           H        MET  46  22.744   1.710   0.823
    2    HA   MET  46           HA       MET  46  23.324   0.512  -1.665
    3    HB2  MET  46           HB2      MET  46  24.437   0.165   1.120
    4    HB3  MET  46           HB3      MET  46  25.077  -0.731  -0.262
    5    HG2  MET  46           HG2      MET  46  25.529   1.381  -1.441
    6    HG3  MET  46           HG3      MET  46  24.859   2.291  -0.093
    7    HE2  MET  46           HE1      MET  46  27.005   3.735   0.737
    8    HE1  MET  46           HE2      MET  46  27.258   3.280  -0.945
    9    HE3  MET  46           HE3      MET  46  28.584   3.140   0.206

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ALA  47           H        ALA  47  21.935  -0.806   1.316
    2    HA   ALA  47           HA       ALA  47  21.840  -3.517   0.510
    3    HB2  ALA  47           HB1      ALA  47  21.478  -3.053   2.817
    4    HB3  ALA  47           HB2      ALA  47  19.930  -3.634   2.204
    5    HB1  ALA  47           HB3      ALA  47  20.185  -1.907   2.463

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU  48           H        LEU  48  19.523  -0.857   0.167
    2    HA   LEU  48           HA       LEU  48  17.451  -2.360  -1.076
    3    HB2  LEU  48           HB2      LEU  48  18.147   0.585  -1.191
    4    HB3  LEU  48           HB3      LEU  48  16.663  -0.104  -1.852
    5    HG   LEU  48           HG       LEU  48  17.525  -0.420   1.032
    6   HD13  LEU  48          HD11      LEU  48  17.139   1.886   0.850
    7   HD12  LEU  48          HD12      LEU  48  15.574   1.260   1.366
    8   HD11  LEU  48          HD13      LEU  48  15.844   1.680  -0.326
    9   HD22  LEU  48          HD21      LEU  48  15.970  -2.112   0.657
   10   HD21  LEU  48          HD22      LEU  48  15.104  -1.196  -0.576
   11   HD23  LEU  48          HD23      LEU  48  14.905  -0.790   1.129

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ASN  49           H        ASN  49  20.161  -0.469  -2.318
    2    HA   ASN  49           HA       ASN  49  19.496  -0.541  -5.039
    3    HB2  ASN  49           HB2      ASN  49  21.197   0.955  -4.144
    4    HB3  ASN  49           HB3      ASN  49  22.204  -0.413  -3.682
    5   HD21  ASN  49          HD21      ASN  49  20.762   1.151  -6.563
    6   HD22  ASN  49          HD22      ASN  49  21.987   0.662  -7.630

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLU  50           H        GLU  50  21.457  -2.766  -3.088
    2    HA   GLU  50           HA       GLU  50  22.122  -4.530  -5.219
    3    HB2  GLU  50           HB2      GLU  50  23.331  -4.524  -3.058
    4    HB3  GLU  50           HB3      GLU  50  21.884  -5.131  -2.255
    5    HG2  GLU  50           HG2      GLU  50  21.937  -7.164  -3.616
    6    HG3  GLU  50           HG3      GLU  50  23.317  -6.551  -4.524

  No H/Q in entry =           6
  In of MODEL   42
    1    H    ALA  51           H        ALA  51  19.479  -4.427  -2.879
    2    HA   ALA  51           HA       ALA  51  18.273  -6.883  -3.632
    3    HB3  ALA  51           HB1      ALA  51  16.696  -6.355  -2.068
    4    HB1  ALA  51           HB2      ALA  51  16.504  -4.705  -2.665
    5    HB2  ALA  51           HB3      ALA  51  17.863  -5.112  -1.616

  No H/Q in entry =           5
  In of MODEL   42
    1    H    HIS  52           H        HIS  52  17.731  -3.526  -4.662
    2    HA   HIS  52           HA       HIS  52  15.601  -4.020  -6.451
    3    HB2  HIS  52           HB2      HIS  52  16.277  -1.765  -5.657
    4    HB3  HIS  52           HB3      HIS  52  17.736  -1.882  -6.640
    5    HD1  HIS  52           HD1      HIS  52  17.395  -1.972  -9.268
    6    HD2  HIS  52           HD2      HIS  52  13.945  -1.120  -7.088
    7    HE1  HIS  52           HE1      HIS  52  15.701  -1.080 -10.926
    8    HE2  HIS  52           HE2      HIS  52  13.593  -0.555  -9.612

  No H/Q in entry =           8
  In of MODEL   42
    1    H    LEU  53           H        LEU  53  19.117  -4.077  -6.902
    2    HA   LEU  53           HA       LEU  53  19.155  -4.392  -9.703
    3    HB2  LEU  53           HB2      LEU  53  21.088  -5.179  -7.538
    4    HB3  LEU  53           HB3      LEU  53  21.390  -5.576  -9.227
    5    HG   LEU  53           HG       LEU  53  20.767  -2.753  -8.303
    6   HD13  LEU  53          HD11      LEU  53  22.796  -3.383  -7.168
    7   HD12  LEU  53          HD12      LEU  53  23.260  -2.407  -8.561
    8   HD11  LEU  53          HD13      LEU  53  23.429  -4.157  -8.617
    9   HD22  LEU  53          HD21      LEU  53  20.494  -2.816 -10.644
   10   HD21  LEU  53          HD22      LEU  53  21.757  -4.025 -10.851
   11   HD23  LEU  53          HD23      LEU  53  22.188  -2.363 -10.499

  No H/Q in entry =          11
  In of MODEL   42
    1    H    VAL  54           H        VAL  54  19.022  -6.778  -7.077
    2    HA   VAL  54           HA       VAL  54  19.104  -9.073  -8.738
    3    HB   VAL  54           HB       VAL  54  17.970  -8.634  -5.965
    4   HG12  VAL  54          HG11      VAL  54  18.257 -11.256  -5.963
    5   HG11  VAL  54          HG12      VAL  54  18.065 -11.085  -7.708
    6   HG13  VAL  54          HG13      VAL  54  16.790 -10.536  -6.622
    7   HG22  VAL  54          HG21      VAL  54  20.289  -8.456  -5.754
    8   HG21  VAL  54          HG22      VAL  54  20.604  -9.552  -7.097
    9   HG23  VAL  54          HG23      VAL  54  20.073 -10.193  -5.542

  No H/Q in entry =           9
  In of MODEL   42
    1    H    GLN  55           H        GLN  55  16.409  -7.133  -7.441
    2    HA   GLN  55           HA       GLN  55  14.359  -8.768  -8.505
    3    HB2  GLN  55           HB2      GLN  55  13.641  -7.232  -6.874
    4    HB3  GLN  55           HB3      GLN  55  14.449  -5.875  -7.653
    5    HG2  GLN  55           HG2      GLN  55  12.721  -5.526  -9.134
    6    HG3  GLN  55           HG3      GLN  55  12.375  -7.242  -9.303
    7   HE21  GLN  55          HE21      GLN  55  10.365  -7.764  -8.488
    8   HE22  GLN  55          HE22      GLN  55   9.608  -6.999  -7.175

  No H/Q in entry =           8
  In of MODEL   42
    1    H    THR  56           H        THR  56  16.130  -5.992  -9.873
    2    HA   THR  56           HA       THR  56  14.685  -5.610 -12.213
    3    HB   THR  56           HB       THR  56  17.691  -5.496 -11.852
    4    HG1  THR  56           HG1      THR  56  15.889  -4.105 -10.716
    5   HG23  THR  56          HG21      THR  56  17.350  -5.510 -14.183
    6   HG22  THR  56          HG22      THR  56  17.389  -3.794 -13.781
    7   HG21  THR  56          HG23      THR  56  15.843  -4.600 -14.056

  No H/Q in entry =           7
  In of MODEL   42
    1    H    LYS  57           H        LYS  57  17.306  -7.943 -11.616
    2    HA   LYS  57           HA       LYS  57  17.278  -9.136 -14.195
    3    HB2  LYS  57           HB2      LYS  57  19.075  -9.416 -12.463
    4    HB3  LYS  57           HB3      LYS  57  17.962 -10.390 -11.514
    5    HG2  LYS  57           HG2      LYS  57  17.808 -12.024 -13.345
    6    HG3  LYS  57           HG3      LYS  57  18.904 -11.052 -14.321
    7    HD2  LYS  57           HD2      LYS  57  20.673 -11.344 -12.608
    8    HD3  LYS  57           HD3      LYS  57  19.583 -12.355 -11.663
    9    HE2  LYS  57           HE2      LYS  57  19.439 -13.969 -13.523
   10    HE3  LYS  57           HE3      LYS  57  20.503 -12.962 -14.502
   11    HZ2  LYS  57           HZ1      LYS  57  21.132 -14.667 -12.230
   12    HZ1  LYS  57           HZ2      LYS  57  21.988 -13.205 -12.343
   13    HZ3  LYS  57           HZ3      LYS  57  22.043 -14.325 -13.619

  No H/Q in entry =          13
  In of MODEL   42
    1    H    LEU  58           H        LEU  58  15.504  -9.781 -11.210
    2    HA   LEU  58           HA       LEU  58  14.246 -12.138 -12.138
    3    HB2  LEU  58           HB2      LEU  58  13.488 -10.222  -9.938
    4    HB3  LEU  58           HB3      LEU  58  12.660 -11.749 -10.250
    5    HG   LEU  58           HG       LEU  58  15.639 -11.510  -9.711
    6   HD11  LEU  58          HD11      LEU  58  13.272 -11.897  -7.906
    7   HD13  LEU  58          HD12      LEU  58  14.739 -10.953  -7.651
    8   HD12  LEU  58          HD13      LEU  58  14.789 -12.709  -7.517
    9   HD22  LEU  58          HD21      LEU  58  15.489 -13.570 -10.738
   10   HD21  LEU  58          HD22      LEU  58  13.774 -13.757 -10.369
   11   HD23  LEU  58          HD23      LEU  58  14.985 -14.074  -9.126

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  59           H        ILE  59  13.615  -8.792 -12.817
    2    HA   ILE  59           HA       ILE  59  10.886  -9.405 -13.742
    3    HB   ILE  59           HB       ILE  59  11.734  -7.132 -12.543
    4   HG12  ILE  59          HG12      ILE  59   9.800  -6.994 -14.868
    5   HG13  ILE  59          HG13      ILE  59   9.392  -7.751 -13.350
    6   HG23  ILE  59          HG21      ILE  59  12.309  -5.418 -14.061
    7   HG22  ILE  59          HG22      ILE  59  11.787  -6.337 -15.455
    8   HG21  ILE  59          HG23      ILE  59  13.273  -6.766 -14.613
    9   HD12  ILE  59          HD11      ILE  59  10.270  -4.886 -13.707
   10   HD11  ILE  59          HD12      ILE  59   9.926  -5.644 -12.153
   11   HD13  ILE  59          HD13      ILE  59   8.632  -5.426 -13.333

  No H/Q in entry =          11
  In of MODEL   42
    1    H    GLU  60           H        GLU  60  14.094  -8.595 -15.018
    2    HA   GLU  60           HA       GLU  60  13.305  -8.184 -17.722
    3    HB2  GLU  60           HB2      GLU  60  15.496  -7.476 -16.892
    4    HB3  GLU  60           HB3      GLU  60  15.939  -9.151 -16.575
    5    HG2  GLU  60           HG2      GLU  60  15.098  -8.286 -19.338
    6    HG3  GLU  60           HG3      GLU  60  16.760  -8.068 -18.793

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLY  61           H        GLY  61  14.254 -11.078 -15.912
    2    HA3  GLY  61           HA2      GLY  61  13.679 -12.719 -18.311
    3    HA2  GLY  61           HA3      GLY  61  14.712 -13.214 -16.974

  No H/Q in entry =           3
  In of MODEL   42
    1    H    ASP  62           H        ASP  62  11.616 -11.625 -16.581
    2    HA   ASP  62           HA       ASP  62  10.503 -13.016 -14.615
    3    HB2  ASP  62           HB2      ASP  62   8.297 -12.591 -15.600
    4    HB3  ASP  62           HB3      ASP  62   9.360 -11.198 -15.779

  No H/Q in entry =           4
  In of MODEL   42
    1    H    ALA  63           H        ALA  63   9.203 -14.906 -14.273
    2    HA   ALA  63           HA       ALA  63  10.063 -17.238 -15.705
    3    HB3  ALA  63           HB1      ALA  63   8.416 -18.421 -14.286
    4    HB1  ALA  63           HB2      ALA  63   7.784 -16.868 -13.742
    5    HB2  ALA  63           HB3      ALA  63   9.434 -17.339 -13.336

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLY  64           H        GLY  64   8.691 -18.709 -16.865
    2    HA3  GLY  64           HA2      GLY  64   6.982 -19.311 -18.313
    3    HA2  GLY  64           HA3      GLY  64   6.149 -17.816 -17.910

  No H/Q in entry =           3
  In of MODEL   42
    1    H    GLU  65           H        GLU  65   9.105 -18.898 -19.625
    2    HA   GLU  65           HA       GLU  65   9.372 -16.572 -21.173
    3    HB2  GLU  65           HB2      GLU  65  10.317 -19.391 -21.675
    4    HB3  GLU  65           HB3      GLU  65  10.773 -18.014 -22.677
    5    HG2  GLU  65           HG2      GLU  65  11.740 -16.879 -20.743
    6    HG3  GLU  65           HG3      GLU  65  11.218 -18.189 -19.684

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLY  66           H        GLY  66   7.842 -19.632 -21.932
    2    HA3  GLY  66           HA2      GLY  66   7.016 -19.023 -24.571
    3    HA2  GLY  66           HA3      GLY  66   6.417 -20.331 -23.569

  No H/Q in entry =           3
  In of MODEL   42
    1    H    LYS  67           H        LYS  67   5.199 -19.086 -21.527
    2    HA   LYS  67           HA       LYS  67   2.859 -17.956 -22.825
    3    HB2  LYS  67           HB2      LYS  67   3.356 -19.014 -20.045
    4    HB3  LYS  67           HB3      LYS  67   1.808 -18.344 -20.579
    5    HG2  LYS  67           HG2      LYS  67   1.717 -19.977 -22.417
    6    HG3  LYS  67           HG3      LYS  67   3.274 -20.636 -21.924
    7    HD2  LYS  67           HD2      LYS  67   2.295 -21.263 -19.732
    8    HD3  LYS  67           HD3      LYS  67   0.729 -20.657 -20.278
    9    HE2  LYS  67           HE2      LYS  67   2.299 -22.817 -21.711
   10    HE3  LYS  67           HE3      LYS  67   1.000 -23.142 -20.564
   11    HZ3  LYS  67           HZ1      LYS  67   0.113 -23.161 -22.767
   12    HZ2  LYS  67           HZ2      LYS  67   0.787 -21.642 -23.115
   13    HZ1  LYS  67           HZ3      LYS  67  -0.468 -21.778 -21.976

  No H/Q in entry =          13
  In of MODEL   42
    1    H    MET  68           H        MET  68   1.699 -16.197 -22.077
    2    HA   MET  68           HA       MET  68   3.172 -13.829 -21.722
    3    HB2  MET  68           HB2      MET  68   0.226 -14.399 -21.399
    4    HB3  MET  68           HB3      MET  68   0.932 -12.784 -21.434
    5    HG2  MET  68           HG2      MET  68   1.233 -14.837 -23.643
    6    HG3  MET  68           HG3      MET  68   0.080 -13.502 -23.666
    7    HE3  MET  68           HE1      MET  68   1.874 -10.382 -24.131
    8    HE2  MET  68           HE2      MET  68   1.780 -10.914 -22.456
    9    HE1  MET  68           HE3      MET  68   0.458 -11.277 -23.561

  No H/Q in entry =           9
  In of MODEL   42
    1    H    LYS  69           H        LYS  69   2.340 -16.085 -19.325
    2    HA   LYS  69           HA       LYS  69   1.881 -14.179 -17.209
    3    HB2  LYS  69           HB2      LYS  69   2.171 -17.180 -17.219
    4    HB3  LYS  69           HB3      LYS  69   1.882 -16.240 -15.754
    5    HG2  LYS  69           HG2      LYS  69  -0.154 -15.280 -16.758
    6    HG3  LYS  69           HG3      LYS  69   0.131 -16.212 -18.228
    7    HD2  LYS  69           HD2      LYS  69  -0.064 -18.306 -16.946
    8    HD3  LYS  69           HD3      LYS  69  -0.344 -17.379 -15.469
    9    HE2  LYS  69           HE2      LYS  69  -2.364 -16.383 -16.468
   10    HE3  LYS  69           HE3      LYS  69  -2.085 -17.294 -17.951
   11    HZ2  LYS  69           HZ1      LYS  69  -3.483 -18.131 -15.733
   12    HZ1  LYS  69           HZ2      LYS  69  -2.027 -19.003 -15.691
   13    HZ3  LYS  69           HZ3      LYS  69  -3.026 -19.077 -17.063

  No H/Q in entry =          13
  In of MODEL   42
    1    H    VAL  70           H        VAL  70   3.076 -14.150 -15.139
    2    HA   VAL  70           HA       VAL  70   5.990 -14.586 -15.475
    3    HB   VAL  70           HB       VAL  70   6.339 -12.496 -14.187
    4   HG13  VAL  70          HG11      VAL  70   6.060 -11.063 -16.034
    5   HG12  VAL  70          HG12      VAL  70   4.551 -11.836 -16.519
    6   HG11  VAL  70          HG13      VAL  70   6.087 -12.661 -16.779
    7   HG21  VAL  70          HG21      VAL  70   3.314 -12.440 -14.302
    8   HG23  VAL  70          HG22      VAL  70   4.245 -10.955 -14.119
    9   HG22  VAL  70          HG23      VAL  70   4.358 -12.222 -12.897

  No H/Q in entry =           9
  In of MODEL   42
    1    H    SER  71           H        SER  71   7.121 -14.565 -13.321
    2    HA   SER  71           HA       SER  71   6.101 -16.534 -11.579
    3    HB2  SER  71           HB2      SER  71   8.518 -15.938 -11.813
    4    HB3  SER  71           HB3      SER  71   8.194 -14.434 -10.953
    5    HG   SER  71           HG       SER  71   8.279 -17.059 -10.040

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU  72           H        LEU  72   4.703 -16.412  -9.928
    2    HA   LEU  72           HA       LEU  72   3.185 -14.079  -9.475
    3    HB2  LEU  72           HB2      LEU  72   3.447 -16.639  -7.904
    4    HB3  LEU  72           HB3      LEU  72   2.295 -15.367  -7.504
    5    HG   LEU  72           HG       LEU  72   2.433 -16.678 -10.240
    6   HD12  LEU  72          HD11      LEU  72   0.468 -17.261  -8.009
    7   HD11  LEU  72          HD12      LEU  72   1.863 -18.278  -8.364
    8   HD13  LEU  72          HD13      LEU  72   0.590 -18.077  -9.567
    9   HD21  LEU  72          HD21      LEU  72   0.602 -14.717  -8.879
   10   HD23  LEU  72          HD22      LEU  72  -0.069 -15.795 -10.091
   11   HD22  LEU  72          HD23      LEU  72   1.226 -14.684 -10.523

  No H/Q in entry =          11
  In of MODEL   42
    1    H    VAL  73           H        VAL  73   5.831 -15.552  -7.716
    2    HA   VAL  73           HA       VAL  73   5.801 -14.019  -5.382
    3    HB   VAL  73           HB       VAL  73   7.971 -14.862  -4.962
    4   HG11  VAL  73          HG11      VAL  73   6.123 -16.550  -5.127
    5   HG13  VAL  73          HG12      VAL  73   7.719 -17.224  -5.459
    6   HG12  VAL  73          HG13      VAL  73   6.619 -16.865  -6.789
    7   HG22  VAL  73          HG21      VAL  73   9.312 -14.300  -6.780
    8   HG21  VAL  73          HG22      VAL  73   8.149 -14.909  -7.956
    9   HG23  VAL  73          HG23      VAL  73   9.133 -16.038  -7.024

  No H/Q in entry =           9
  In of MODEL   42
    1    H    LEU  74           H        LEU  74   6.789 -13.136  -8.562
    2    HA   LEU  74           HA       LEU  74   8.762 -11.214  -8.077
    3    HB2  LEU  74           HB2      LEU  74   8.286 -11.956 -10.313
    4    HB3  LEU  74           HB3      LEU  74   6.629 -11.365 -10.205
    5    HG   LEU  74           HG       LEU  74   7.478  -9.048  -9.978
    6   HD12  LEU  74          HD11      LEU  74   9.969  -8.796 -10.623
    7   HD11  LEU  74          HD12      LEU  74  10.127 -10.487 -10.153
    8   HD13  LEU  74          HD13      LEU  74   9.613  -9.289  -8.968
    9   HD21  LEU  74          HD21      LEU  74   7.146 -10.448 -12.200
   10   HD23  LEU  74          HD22      LEU  74   8.868 -10.171 -12.330
   11   HD22  LEU  74          HD23      LEU  74   7.780  -8.805 -12.242

  No H/Q in entry =          11
  In of MODEL   42
    1    H    VAL  75           H        VAL  75   5.270 -10.783  -8.415
    2    HA   VAL  75           HA       VAL  75   5.212  -8.026  -7.826
    3    HB   VAL  75           HB       VAL  75   3.098 -10.144  -7.437
    4   HG11  VAL  75          HG11      VAL  75   2.944  -7.103  -7.259
    5   HG13  VAL  75          HG12      VAL  75   2.641  -8.243  -5.956
    6   HG12  VAL  75          HG13      VAL  75   1.546  -8.170  -7.327
    7   HG22  VAL  75          HG21      VAL  75   3.773  -9.794  -9.763
    8   HG21  VAL  75          HG22      VAL  75   3.639  -8.048  -9.568
    9   HG23  VAL  75          HG23      VAL  75   2.193  -9.056  -9.508

  No H/Q in entry =           9
  In of MODEL   42
    1    H    GLU  76           H        GLU  76   4.929 -10.901  -5.717
    2    HA   GLU  76           HA       GLU  76   4.486  -9.535  -3.293
    3    HB2  GLU  76           HB2      GLU  76   4.276 -11.998  -3.523
    4    HB3  GLU  76           HB3      GLU  76   6.008 -12.122  -3.778
    5    HG2  GLU  76           HG2      GLU  76   5.576 -12.699  -1.476
    6    HG3  GLU  76           HG3      GLU  76   6.350 -11.125  -1.472

  No H/Q in entry =           6
  In of MODEL   42
    1    H    ALA  77           H        ALA  77   7.528 -10.482  -4.868
    2    HA   ALA  77           HA       ALA  77   9.238  -9.463  -2.858
    3    HB3  ALA  77           HB1      ALA  77   9.929  -9.559  -5.792
    4    HB1  ALA  77           HB2      ALA  77   9.832 -11.017  -4.805
    5    HB2  ALA  77           HB3      ALA  77  11.004  -9.760  -4.408

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLN  78           H        GLN  78   7.855  -8.025  -5.766
    2    HA   GLN  78           HA       GLN  78   9.242  -5.564  -5.665
    3    HB2  GLN  78           HB2      GLN  78   7.927  -6.458  -7.619
    4    HB3  GLN  78           HB3      GLN  78   6.452  -6.063  -6.739
    5    HG2  GLN  78           HG2      GLN  78   7.128  -3.702  -6.647
    6    HG3  GLN  78           HG3      GLN  78   8.614  -4.086  -7.514
    7   HE21  GLN  78          HE21      GLN  78   6.704  -2.245  -8.605
    8   HE22  GLN  78          HE22      GLN  78   6.018  -2.950  -9.988

  No H/Q in entry =           8
  In of MODEL   42
    1    H    LEU  79           H        LEU  79   6.212  -6.661  -4.225
    2    HA   LEU  79           HA       LEU  79   5.255  -4.241  -3.211
    3    HB2  LEU  79           HB2      LEU  79   3.912  -6.274  -3.153
    4    HB3  LEU  79           HB3      LEU  79   5.050  -7.030  -2.042
    5    HG   LEU  79           HG       LEU  79   4.526  -5.382  -0.312
    6   HD13  LEU  79          HD11      LEU  79   4.085  -3.360  -1.360
    7   HD12  LEU  79          HD12      LEU  79   2.454  -3.863  -0.916
    8   HD11  LEU  79          HD13      LEU  79   3.027  -4.093  -2.566
    9   HD23  LEU  79          HD21      LEU  79   1.933  -5.838  -0.214
   10   HD22  LEU  79          HD22      LEU  79   3.054  -7.193  -0.110
   11   HD21  LEU  79          HD23      LEU  79   2.241  -6.844  -1.632

  No H/Q in entry =          11
  In of MODEL   42
    1    H    HIS  80           H        HIS  80   7.409  -6.608  -1.637
    2    HA   HIS  80           HA       HIS  80   7.726  -5.071   0.732
    3    HB2  HIS  80           HB2      HIS  80   9.027  -7.453  -0.472
    4    HB3  HIS  80           HB3      HIS  80   9.954  -6.570   0.743
    5    HD1  HIS  80           HD1      HIS  80   9.461  -7.201   3.087
    6    HD2  HIS  80           HD2      HIS  80   6.225  -8.004   0.583
    7    HE1  HIS  80           HE1      HIS  80   7.678  -8.280   4.540
    8    HE2  HIS  80           HE2      HIS  80   5.699  -8.773   3.022

  No H/Q in entry =           8
  In of MODEL   42
    1    H    LEU  81           H        LEU  81   9.719  -5.374  -2.186
    2    HA   LEU  81           HA       LEU  81  11.790  -3.663  -1.312
    3    HB2  LEU  81           HB2      LEU  81  10.851  -4.441  -4.073
    4    HB3  LEU  81           HB3      LEU  81  12.286  -3.455  -3.786
    5    HG   LEU  81           HG       LEU  81  11.857  -6.171  -2.513
    6   HD12  LEU  81          HD11      LEU  81  13.659  -6.823  -4.268
    7   HD11  LEU  81          HD12      LEU  81  13.112  -5.390  -5.137
    8   HD13  LEU  81          HD13      LEU  81  11.982  -6.698  -4.797
    9   HD23  LEU  81          HD21      LEU  81  14.490  -5.894  -2.506
   10   HD22  LEU  81          HD22      LEU  81  13.522  -5.121  -1.252
   11   HD21  LEU  81          HD23      LEU  81  14.111  -4.176  -2.620

  No H/Q in entry =          11
  In of MODEL   42
    1    H    MET  82           H        MET  82   8.872  -2.983  -3.240
    2    HA   MET  82           HA       MET  82   9.451  -0.265  -3.741
    3    HB2  MET  82           HB2      MET  82   6.868  -1.821  -3.610
    4    HB3  MET  82           HB3      MET  82   6.893  -0.096  -3.973
    5    HG2  MET  82           HG2      MET  82   8.458  -2.192  -5.514
    6    HG3  MET  82           HG3      MET  82   6.899  -1.546  -6.022
    7    HE3  MET  82           HE1      MET  82   7.396   1.903  -7.193
    8    HE2  MET  82           HE2      MET  82   7.023   1.681  -5.486
    9    HE1  MET  82           HE3      MET  82   6.338   0.582  -6.679

  No H/Q in entry =           9
  In of MODEL   42
    1    H    THR  83           H        THR  83   7.642  -1.838  -1.132
    2    HA   THR  83           HA       THR  83   6.830   0.522   0.198
    3    HB   THR  83           HB       THR  83   6.677  -1.052   2.215
    4    HG1  THR  83           HG1      THR  83   7.404  -3.013   1.982
    5   HG22  THR  83          HG21      THR  83   4.997  -2.591   0.750
    6   HG21  THR  83          HG22      THR  83   5.240  -1.265  -0.381
    7   HG23  THR  83          HG23      THR  83   4.609  -0.942   1.234

  No H/Q in entry =           7
  In of MODEL   42
    1    H    SER  84           H        SER  84   9.623  -1.619   0.710
    2    HA   SER  84           HA       SER  84  10.709  -0.206   2.897
    3    HB2  SER  84           HB2      SER  84  11.929  -2.067   0.867
    4    HB3  SER  84           HB3      SER  84  12.891  -1.329   2.147
    5    HG   SER  84           HG       SER  84  10.591  -2.983   2.411

  No H/Q in entry =           5
  In of MODEL   42
    1    H    MET  85           H        MET  85  11.458   0.046  -0.593
    2    HA   MET  85           HA       MET  85  13.487   1.979  -0.346
    3    HB2  MET  85           HB2      MET  85  13.061   0.703  -2.411
    4    HB3  MET  85           HB3      MET  85  11.552   1.586  -2.637
    5    HG2  MET  85           HG2      MET  85  12.786   3.705  -2.775
    6    HG3  MET  85           HG3      MET  85  14.301   2.856  -2.488
    7    HE2  MET  85           HE1      MET  85  11.638   2.983  -6.145
    8    HE1  MET  85           HE2      MET  85  11.241   3.308  -4.460
    9    HE3  MET  85           HE3      MET  85  11.222   1.653  -5.054

  No H/Q in entry =           9
  In of MODEL   42
    1    H    LEU  86           H        LEU  86  10.002   2.369  -0.846
    2    HA   LEU  86           HA       LEU  86   9.981   5.183  -1.025
    3    HB2  LEU  86           HB2      LEU  86   8.110   3.553  -1.598
    4    HB3  LEU  86           HB3      LEU  86   7.783   3.467   0.133
    5    HG   LEU  86           HG       LEU  86   7.662   6.030   0.082
    6   HD11  LEU  86          HD11      LEU  86   8.424   5.584  -2.622
    7   HD13  LEU  86          HD12      LEU  86   8.015   7.117  -1.859
    8   HD12  LEU  86          HD13      LEU  86   6.761   6.175  -2.661
    9   HD23  LEU  86          HD21      LEU  86   5.503   4.712  -1.575
   10   HD22  LEU  86          HD22      LEU  86   5.336   5.974  -0.358
   11   HD21  LEU  86          HD23      LEU  86   5.711   4.323   0.133

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ALA  87           H        ALA  87   9.488   3.010   1.720
    2    HA   ALA  87           HA       ALA  87   8.975   4.931   3.692
    3    HB1  ALA  87           HB1      ALA  87   9.737   2.098   3.602
    4    HB3  ALA  87           HB2      ALA  87   8.628   2.928   4.691
    5    HB2  ALA  87           HB3      ALA  87  10.357   2.931   5.031

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ARG  88           H        ARG  88  12.033   3.458   2.703
    2    HA   ARG  88           HA       ARG  88  13.669   4.809   4.532
    3    HB2  ARG  88           HB2      ARG  88  14.302   2.826   3.125
    4    HB3  ARG  88           HB3      ARG  88  14.468   3.917   1.752
    5    HG2  ARG  88           HG2      ARG  88  15.968   5.206   3.696
    6    HG3  ARG  88           HG3      ARG  88  16.262   3.511   4.073
    7    HD2  ARG  88           HD2      ARG  88  17.519   3.196   2.222
    8    HD3  ARG  88           HD3      ARG  88  16.393   4.086   1.193
    9    HE   ARG  88           HE       ARG  88  18.807   5.111   2.234
   10   HH21  ARG  88          HH11      ARG  88  19.188   7.324   2.040
   11   HH22  ARG  88          HH12      ARG  88  17.854   8.417   1.901
   12   HH11  ARG  88          HH21      ARG  88  15.480   5.917   1.966
   13   HH12  ARG  88          HH22      ARG  88  15.753   7.618   1.835

  No H/Q in entry =          13
  In of MODEL   42
    1    H    GLU  89           H        GLU  89  12.701   5.725   1.212
    2    HA   GLU  89           HA       GLU  89  14.285   8.060   1.052
    3    HB2  GLU  89           HB2      GLU  89  13.119   7.039  -0.893
    4    HB3  GLU  89           HB3      GLU  89  11.585   7.604  -0.230
    5    HG2  GLU  89           HG2      GLU  89  12.324   9.930  -0.393
    6    HG3  GLU  89           HG3      GLU  89  13.918   9.414  -0.935

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LEU  90           H        LEU  90  10.951   7.603   2.191
    2    HA   LEU  90           HA       LEU  90  10.482  10.344   2.770
    3    HB2  LEU  90           HB2      LEU  90   9.249   7.789   3.799
    4    HB3  LEU  90           HB3      LEU  90   8.645   9.394   4.224
    5    HG   LEU  90           HG       LEU  90   9.041   8.509   1.354
    6   HD12  LEU  90          HD11      LEU  90   6.502   8.221   1.423
    7   HD11  LEU  90          HD12      LEU  90   6.662   8.207   3.180
    8   HD13  LEU  90          HD13      LEU  90   7.458   6.965   2.212
    9   HD22  LEU  90          HD21      LEU  90   8.783  10.822   1.283
   10   HD21  LEU  90          HD22      LEU  90   7.802  10.869   2.746
   11   HD23  LEU  90          HD23      LEU  90   7.091  10.326   1.226

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  91           H        ILE  91  11.707   7.641   4.686
    2    HA   ILE  91           HA       ILE  91  11.877   9.002   7.155
    3    HB   ILE  91           HB       ILE  91  13.389   6.640   6.025
    4   HG12  ILE  91          HG12      ILE  91  11.383   6.837   8.291
    5   HG13  ILE  91          HG13      ILE  91  10.903   6.565   6.617
    6   HG22  ILE  91          HG21      ILE  91  13.864   6.416   8.665
    7   HG21  ILE  91          HG22      ILE  91  13.816   8.176   8.565
    8   HG23  ILE  91          HG23      ILE  91  14.977   7.270   7.596
    9   HD13  ILE  91          HD11      ILE  91  11.872   4.448   6.542
   10   HD12  ILE  91          HD12      ILE  91  11.284   4.514   8.204
   11   HD11  ILE  91          HD13      ILE  91  12.990   4.800   7.860

  No H/Q in entry =          11
  In of MODEL   42
    1    H    THR  92           H        THR  92  14.082   8.799   4.397
    2    HA   THR  92           HA       THR  92  16.273  10.157   5.551
    3    HB   THR  92           HB       THR  92  15.277  10.050   2.693
    4    HG1  THR  92           HG1      THR  92  16.079   8.139   3.094
    5   HG22  THR  92          HG21      THR  92  17.856  10.699   2.392
    6   HG21  THR  92          HG22      THR  92  17.566  11.524   3.923
    7   HG23  THR  92          HG23      THR  92  16.598  11.928   2.506

  No H/Q in entry =           7
  In of MODEL   42
    1    H    GLU  93           H        GLU  93  13.400  11.357   3.831
    2    HA   GLU  93           HA       GLU  93  14.038  14.108   3.946
    3    HB2  GLU  93           HB2      GLU  93  11.313  12.779   3.967
    4    HB3  GLU  93           HB3      GLU  93  11.627  14.474   3.596
    5    HG2  GLU  93           HG2      GLU  93  12.924  12.212   2.062
    6    HG3  GLU  93           HG3      GLU  93  11.387  12.919   1.580

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LEU  94           H        LEU  94  12.268  11.978   6.161
    2    HA   LEU  94           HA       LEU  94  11.496  13.936   8.041
    3    HB2  LEU  94           HB2      LEU  94  12.026  10.972   8.311
    4    HB3  LEU  94           HB3      LEU  94  11.474  11.955   9.664
    5    HG   LEU  94           HG       LEU  94   9.982  12.033   7.040
    6   HD11  LEU  94          HD11      LEU  94  10.036   9.809   9.042
    7   HD13  LEU  94          HD12      LEU  94   9.728   9.754   7.308
    8   HD12  LEU  94          HD13      LEU  94   8.461  10.290   8.410
    9   HD23  LEU  94          HD21      LEU  94   8.074  12.462   8.646
   10   HD22  LEU  94          HD22      LEU  94   9.333  13.696   8.680
   11   HD21  LEU  94          HD23      LEU  94   9.255  12.479   9.954

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  95           H        ILE  95  14.438  11.960   7.793
    2    HA   ILE  95           HA       ILE  95  15.628  12.861  10.204
    3    HB   ILE  95           HB       ILE  95  16.841  11.774   7.651
    4   HG12  ILE  95          HG12      ILE  95  16.535  10.576  10.419
    5   HG13  ILE  95          HG13      ILE  95  15.360  10.338   9.127
    6   HG21  ILE  95          HG21      ILE  95  18.118  12.559  10.290
    7   HG23  ILE  95          HG22      ILE  95  18.583  13.081   8.670
    8   HG22  ILE  95          HG23      ILE  95  18.865  11.416   9.176
    9   HD13  ILE  95          HD11      ILE  95  16.816   9.036   7.858
   10   HD12  ILE  95          HD12      ILE  95  17.287   8.579   9.492
   11   HD11  ILE  95          HD13      ILE  95  18.256   9.744   8.591

  No H/Q in entry =          11
  In of MODEL   42
    1    H    GLU  96           H        GLU  96  15.791  14.094   6.870
    2    HA   GLU  96           HA       GLU  96  17.672  16.143   7.342
    3    HB2  GLU  96           HB2      GLU  96  16.990  15.493   5.085
    4    HB3  GLU  96           HB3      GLU  96  15.357  16.076   5.391
    5    HG2  GLU  96           HG2      GLU  96  15.955  18.196   4.848
    6    HG3  GLU  96           HG3      GLU  96  17.258  18.175   6.026

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LEU  97           H        LEU  97  14.160  16.012   7.783
    2    HA   LEU  97           HA       LEU  97  13.789  18.751   8.428
    3    HB2  LEU  97           HB2      LEU  97  12.233  16.250   9.046
    4    HB3  LEU  97           HB3      LEU  97  11.747  17.804   9.720
    5    HG   LEU  97           HG       LEU  97  12.213  17.383   6.753
    6   HD12  LEU  97          HD11      LEU  97   9.688  17.295   6.643
    7   HD11  LEU  97          HD12      LEU  97   9.684  17.094   8.394
    8   HD13  LEU  97          HD13      LEU  97  10.442  15.875   7.368
    9   HD23  LEU  97          HD21      LEU  97  10.507  19.374   6.793
   10   HD22  LEU  97          HD22      LEU  97  12.195  19.707   7.180
   11   HD21  LEU  97          HD23      LEU  97  11.008  19.554   8.474

  No H/Q in entry =          11
  In of MODEL   42
    1    H    HIS  98           H        HIS  98  14.572  15.911  10.419
    2    HA   HIS  98           HA       HIS  98  14.443  17.172  12.937
    3    HB2  HIS  98           HB2      HIS  98  16.153  14.887  11.927
    4    HB3  HIS  98           HB3      HIS  98  16.166  15.425  13.609
    5    HD1  HIS  98           HD1      HIS  98  13.932  13.833  11.023
    6    HD2  HIS  98           HD2      HIS  98  13.853  14.751  15.089
    7    HE1  HIS  98           HE1      HIS  98  11.891  12.670  11.981
    8    HE2  HIS  98           HE2      HIS  98  11.823  13.221  14.453

  No H/Q in entry =           8
  In of MODEL   42
    1    H    GLU  99           H        GLU  99  16.986  17.018  10.493
    2    HA   GLU  99           HA       GLU  99  18.998  18.316  12.016
    3    HB2  GLU  99           HB2      GLU  99  19.449  17.022   9.945
    4    HB3  GLU  99           HB3      GLU  99  18.657  18.291   9.008
    5    HG2  GLU  99           HG2      GLU  99  20.294  19.934   9.794
    6    HG3  GLU  99           HG3      GLU  99  21.057  18.719  10.813

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LYS 100           H        LYS 100  16.486  19.521   9.810
    2    HA   LYS 100           HA       LYS 100  17.328  22.245   9.953
    3    HB2  LYS 100           HB2      LYS 100  14.672  20.999   9.207
    4    HB3  LYS 100           HB3      LYS 100  15.000  22.733   9.116
    5    HG2  LYS 100           HG2      LYS 100  16.959  22.253   7.643
    6    HG3  LYS 100           HG3      LYS 100  16.518  20.543   7.660
    7    HD2  LYS 100           HD2      LYS 100  14.328  21.090   6.668
    8    HD3  LYS 100           HD3      LYS 100  14.753  22.802   6.658
    9    HE2  LYS 100           HE2      LYS 100  16.698  22.290   5.191
   10    HE3  LYS 100           HE3      LYS 100  16.205  20.594   5.158
   11    HZ1  LYS 100           HZ1      LYS 100  14.414  22.817   4.331
   12    HZ3  LYS 100           HZ2      LYS 100  14.201  21.151   4.068
   13    HZ2  LYS 100           HZ3      LYS 100  15.423  21.994   3.243

  No H/Q in entry =          13
  In of MODEL   42
    1    H    LEU 101           H        LEU 101  15.205  20.232  11.924
    2    HA   LEU 101           HA       LEU 101  14.078  22.317  13.508
    3    HB2  LEU 101           HB2      LEU 101  14.473  19.360  13.888
    4    HB3  LEU 101           HB3      LEU 101  13.958  20.348  15.251
    5    HG   LEU 101           HG       LEU 101  12.532  20.462  12.587
    6   HD12  LEU 101          HD11      LEU 101  10.851  18.925  13.861
    7   HD11  LEU 101          HD12      LEU 101  12.242  18.488  14.850
    8   HD13  LEU 101          HD13      LEU 101  12.265  18.183  13.113
    9   HD21  LEU 101          HD21      LEU 101  11.898  21.264  15.443
   10   HD23  LEU 101          HD22      LEU 101  10.630  21.060  14.237
   11   HD22  LEU 101          HD23      LEU 101  11.884  22.275  13.995

  No H/Q in entry =          11
  In of MODEL   42
    1    H    LYS 102           H        LYS 102  17.213  21.657  13.060
    2    HA   LYS 102           HA       LYS 102  19.078  22.496  14.127
    3    HB2  LYS 102           HB2      LYS 102  17.293  24.040  15.268
    4    HB3  LYS 102           HB3      LYS 102  17.488  22.973  16.643
    5    HG2  LYS 102           HG2      LYS 102  19.410  24.953  15.469
    6    HG3  LYS 102           HG3      LYS 102  19.029  24.644  17.149
    7    HD2  LYS 102           HD2      LYS 102  20.657  22.705  15.456
    8    HD3  LYS 102           HD3      LYS 102  21.372  24.014  16.387
    9    HE2  LYS 102           HE2      LYS 102  20.935  21.472  17.355
   10    HE3  LYS 102           HE3      LYS 102  21.181  22.909  18.347
   11    HZ2  LYS 102           HZ1      LYS 102  19.193  21.657  18.970
   12    HZ1  LYS 102           HZ2      LYS 102  18.548  21.900  17.424
   13    HZ3  LYS 102           HZ3      LYS 102  18.804  23.225  18.450

  No H/Q in entry =          13
  In of MODEL   42
    1    H    ALA 103           H        ALA 103  16.988  20.923  16.554
    2    HA   ALA 103           HA       ALA 103  18.700  19.682  18.202
    3    HB2  ALA 103           HB1      ALA 103  17.082  17.701  18.200
    4    HB1  ALA 103           HB2      ALA 103  16.197  18.571  16.947
    5    HB3  ALA 103           HB3      ALA 103  16.393  19.287  18.545

  No H/Q in entry =           5
  In of MODEL   42
    1    H1   ALA   1           H3       ALA   1  -1.820  -6.790 -21.373
    2    H2   ALA   1           H2       ALA   1  -2.637  -8.212 -20.919
    3    H3   ALA   1           H1       ALA   1  -1.032  -8.289 -21.479
    4    HA   ALA   1           HA       ALA   1  -1.881  -8.742 -23.473
    5    HB1  ALA   1           HB1      ALA   1  -4.029  -9.423 -22.993
    6    HB2  ALA   1           HB2      ALA   1  -4.444  -7.905 -23.788
    7    HB3  ALA   1           HB3      ALA   1  -4.378  -7.988 -22.029

  No H/Q in entry =           7
  In of MODEL   42
    1    H    GLU   2           H        GLU   2  -2.697  -7.535 -25.459
    2    HA   GLU   2           HA       GLU   2  -1.266  -5.545 -26.339
    3    HB2  GLU   2           HB2      GLU   2  -4.275  -5.559 -26.646
    4    HB3  GLU   2           HB3      GLU   2  -3.143  -4.715 -27.699
    5    HG2  GLU   2           HG2      GLU   2  -2.677  -6.612 -28.857
    6    HG3  GLU   2           HG3      GLU   2  -2.390  -7.524 -27.382

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLU   3           H        GLU   3  -4.401  -4.234 -25.427
    2    HA   GLU   3           HA       GLU   3  -3.309  -1.697 -24.799
    3    HB2  GLU   3           HB2      GLU   3  -6.018  -2.966 -24.459
    4    HB3  GLU   3           HB3      GLU   3  -5.690  -1.356 -23.812
    5    HG2  GLU   3           HG2      GLU   3  -5.324  -0.433 -25.938
    6    HG3  GLU   3           HG3      GLU   3  -4.959  -1.994 -26.666

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LEU   4           H        LEU   4  -4.933  -4.031 -22.617
    2    HA   LEU   4           HA       LEU   4  -4.539  -2.812 -20.225
    3    HB2  LEU   4           HB2      LEU   4  -4.049  -5.762 -20.700
    4    HB3  LEU   4           HB3      LEU   4  -4.437  -5.010 -19.154
    5    HG   LEU   4           HG       LEU   4  -6.218  -5.050 -21.612
    6   HD13  LEU   4          HD11      LEU   4  -7.438  -6.748 -20.613
    7   HD12  LEU   4          HD12      LEU   4  -6.940  -6.299 -18.982
    8   HD11  LEU   4          HD13      LEU   4  -5.822  -7.160 -20.039
    9   HD23  LEU   4          HD21      LEU   4  -7.882  -4.212 -19.738
   10   HD22  LEU   4          HD22      LEU   4  -6.826  -3.058 -20.551
   11   HD21  LEU   4          HD23      LEU   4  -6.405  -3.658 -18.947

  No H/Q in entry =          11
  In of MODEL   42
    1    H    GLU   5           H        GLU   5  -2.079  -4.696 -21.967
    2    HA   GLU   5           HA       GLU   5  -0.084  -4.450 -19.936
    3    HB2  GLU   5           HB2      GLU   5  -0.051  -6.220 -21.685
    4    HB3  GLU   5           HB3      GLU   5   0.269  -4.983 -22.900
    5    HG2  GLU   5           HG2      GLU   5   2.351  -4.366 -21.754
    6    HG3  GLU   5           HG3      GLU   5   2.032  -5.564 -20.500

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLU   6           H        GLU   6  -0.699  -2.722 -22.977
    2    HA   GLU   6           HA       GLU   6   1.503  -0.928 -22.714
    3    HB2  GLU   6           HB2      GLU   6  -1.061  -0.787 -24.314
    4    HB3  GLU   6           HB3      GLU   6   0.221   0.419 -24.423
    5    HG2  GLU   6           HG2      GLU   6   1.820  -1.291 -25.120
    6    HG3  GLU   6           HG3      GLU   6   0.598  -2.545 -24.926

  No H/Q in entry =           6
  In of MODEL   42
    1    H    VAL   7           H        VAL   7  -1.833  -0.943 -21.658
    2    HA   VAL   7           HA       VAL   7  -2.004   1.772 -20.818
    3    HB   VAL   7           HB       VAL   7  -3.507  -0.721 -19.980
    4   HG11  VAL   7          HG11      VAL   7  -3.829   2.173 -19.161
    5   HG13  VAL   7          HG12      VAL   7  -3.751   0.746 -18.128
    6   HG12  VAL   7          HG13      VAL   7  -5.181   1.042 -19.115
    7   HG21  VAL   7          HG21      VAL   7  -3.653   0.361 -22.366
    8   HG23  VAL   7          HG22      VAL   7  -4.574   1.625 -21.549
    9   HG22  VAL   7          HG23      VAL   7  -5.149  -0.042 -21.523

  No H/Q in entry =           9
  In of MODEL   42
    1    H    VAL   8           H        VAL   8  -1.063  -1.232 -19.181
    2    HA   VAL   8           HA       VAL   8  -0.718  -0.161 -16.586
    3    HB   VAL   8           HB       VAL   8   0.640  -2.500 -17.950
    4   HG13  VAL   8          HG11      VAL   8   2.051  -1.786 -16.128
    5   HG12  VAL   8          HG12      VAL   8   1.146  -3.193 -15.568
    6   HG11  VAL   8          HG13      VAL   8   0.661  -1.575 -15.062
    7   HG21  VAL   8          HG21      VAL   8  -2.010  -2.239 -17.237
    8   HG23  VAL   8          HG22      VAL   8  -1.322  -2.892 -15.753
    9   HG22  VAL   8          HG23      VAL   8  -1.155  -3.780 -17.263

  No H/Q in entry =           9
  In of MODEL   42
    1    H    MET   9           H        MET   9   1.517  -0.498 -19.341
    2    HA   MET   9           HA       MET   9   3.825   0.502 -18.086
    3    HB2  MET   9           HB2      MET   9   2.864   0.526 -20.943
    4    HB3  MET   9           HB3      MET   9   4.380   1.302 -20.484
    5    HG2  MET   9           HG2      MET   9   4.938  -0.945 -19.319
    6    HG3  MET   9           HG3      MET   9   3.631  -1.613 -20.298
    7    HE3  MET   9           HE1      MET   9   4.681  -1.226 -23.893
    8    HE2  MET   9           HE2      MET   9   3.632  -0.152 -22.971
    9    HE1  MET   9           HE3      MET   9   3.555  -1.891 -22.704

  No H/Q in entry =           9
  In of MODEL   42
    1    H    GLY  10           H        GLY  10   1.164   2.155 -19.752
    2    HA3  GLY  10           HA2      GLY  10   2.177   4.790 -19.508
    3    HA2  GLY  10           HA3      GLY  10   0.478   4.361 -19.707

  No H/Q in entry =           3
  In of MODEL   42
    1    H    LEU  11           H        LEU  11   0.059   2.838 -17.422
    2    HA   LEU  11           HA       LEU  11  -0.427   4.822 -15.457
    3    HB2  LEU  11           HB2      LEU  11  -0.415   1.806 -15.306
    4    HB3  LEU  11           HB3      LEU  11  -0.900   2.836 -13.960
    5    HG   LEU  11           HG       LEU  11  -2.147   2.976 -16.718
    6   HD13  LEU  11          HD11      LEU  11  -2.767   0.843 -15.964
    7   HD12  LEU  11          HD12      LEU  11  -4.097   1.859 -15.412
    8   HD11  LEU  11          HD13      LEU  11  -2.846   1.354 -14.277
    9   HD22  LEU  11          HD21      LEU  11  -2.696   5.001 -15.707
   10   HD21  LEU  11          HD22      LEU  11  -2.628   4.332 -14.077
   11   HD23  LEU  11          HD23      LEU  11  -4.013   3.993 -15.114

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  12           H        ILE  12   2.068   2.309 -15.713
    2    HA   ILE  12           HA       ILE  12   3.293   2.821 -13.213
    3    HB   ILE  12           HB       ILE  12   4.516   1.760 -15.783
    4   HG12  ILE  12          HG12      ILE  12   2.489   0.563 -14.635
    5   HG13  ILE  12          HG13      ILE  12   3.873  -0.398 -15.115
    6   HG21  ILE  12          HG21      ILE  12   5.505   1.718 -12.914
    7   HG23  ILE  12          HG22      ILE  12   6.300   2.447 -14.308
    8   HG22  ILE  12          HG23      ILE  12   6.167   0.694 -14.186
    9   HD12  ILE  12          HD11      ILE  12   3.006  -0.919 -12.827
   10   HD11  ILE  12          HD12      ILE  12   3.423   0.722 -12.338
   11   HD13  ILE  12          HD13      ILE  12   4.680  -0.393 -12.825

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  13           H        ILE  13   3.905   4.077 -16.471
    2    HA   ILE  13           HA       ILE  13   6.078   5.756 -15.752
    3    HB   ILE  13           HB       ILE  13   4.040   5.880 -17.989
    4   HG12  ILE  13          HG12      ILE  13   5.837   4.001 -17.722
    5   HG13  ILE  13          HG13      ILE  13   5.604   4.751 -19.297
    6   HG21  ILE  13          HG21      ILE  13   6.309   7.725 -17.320
    7   HG23  ILE  13          HG22      ILE  13   4.724   8.110 -17.981
    8   HG22  ILE  13          HG23      ILE  13   5.958   7.396 -19.018
    9   HD11  ILE  13          HD11      ILE  13   7.717   5.678 -17.317
   10   HD13  ILE  13          HD12      ILE  13   7.543   6.151 -19.002
   11   HD12  ILE  13          HD13      ILE  13   8.023   4.507 -18.598

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ASN  14           H        ASN  14   2.580   6.317 -16.005
    2    HA   ASN  14           HA       ASN  14   2.591   9.062 -15.364
    3    HB2  ASN  14           HB2      ASN  14   0.664   7.457 -16.189
    4    HB3  ASN  14           HB3      ASN  14   0.347   7.282 -14.468
    5   HD21  ASN  14          HD21      ASN  14  -1.657   8.478 -15.891
    6   HD22  ASN  14          HD22      ASN  14  -1.687  10.152 -15.621

  No H/Q in entry =           6
  In of MODEL   42
    1    H    SER  15           H        SER  15   2.251   6.188 -13.290
    2    HA   SER  15           HA       SER  15   1.979   7.561 -10.839
    3    HB2  SER  15           HB2      SER  15   2.495   5.464  -9.795
    4    HB3  SER  15           HB3      SER  15   1.650   5.062 -11.285
    5    HG   SER  15           HG       SER  15   3.377   3.874 -11.572

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLY  16           H        GLY  16   4.827   6.413 -12.611
    2    HA3  GLY  16           HA2      GLY  16   6.774   7.132 -10.687
    3    HA2  GLY  16           HA3      GLY  16   7.066   6.926 -12.412

  No H/Q in entry =           3
  In of MODEL   42
    1    H    GLN  17           H        GLN  17   5.409   8.916 -13.466
    2    HA   GLN  17           HA       GLN  17   7.029  11.228 -13.161
    3    HB2  GLN  17           HB2      GLN  17   4.267  10.851 -14.350
    4    HB3  GLN  17           HB3      GLN  17   5.154  12.374 -14.425
    5    HG2  GLN  17           HG2      GLN  17   6.190   9.727 -15.478
    6    HG3  GLN  17           HG3      GLN  17   5.463  10.988 -16.473
    7   HE21  GLN  17          HE21      GLN  17   8.427   9.818 -15.738
    8   HE22  GLN  17          HE22      GLN  17   9.340  11.247 -15.797

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ALA  18           H        ALA  18   3.916  10.264 -11.801
    2    HA   ALA  18           HA       ALA  18   3.239  12.663 -10.529
    3    HB1  ALA  18           HB1      ALA  18   2.066  10.227 -10.750
    4    HB2  ALA  18           HB2      ALA  18   1.543  11.455  -9.599
    5    HB3  ALA  18           HB3      ALA  18   2.613  10.153  -9.075

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ARG  19           H        ARG  19   5.069   9.866  -9.261
    2    HA   ARG  19           HA       ARG  19   5.632  11.011  -6.740
    3    HB2  ARG  19           HB2      ARG  19   6.002   8.602  -7.271
    4    HB3  ARG  19           HB3      ARG  19   7.362   9.066  -8.297
    5    HG2  ARG  19           HG2      ARG  19   8.507  10.083  -6.378
    6    HG3  ARG  19           HG3      ARG  19   7.129   9.718  -5.341
    7    HD2  ARG  19           HD2      ARG  19   8.864   8.052  -4.993
    8    HD3  ARG  19           HD3      ARG  19   7.473   7.295  -5.774
    9    HE   ARG  19           HE       ARG  19   9.184   8.087  -7.827
   10   HH21  ARG  19          HH11      ARG  19  10.716   6.656  -8.686
   11   HH22  ARG  19          HH12      ARG  19  11.242   5.298  -7.754
   12   HH11  ARG  19          HH21      ARG  19   9.232   6.052  -5.052
   13   HH12  ARG  19          HH22      ARG  19  10.399   4.955  -5.695

  No H/Q in entry =          13
  In of MODEL   42
    1    H    SER  20           H        SER  20   7.437  11.014  -9.796
    2    HA   SER  20           HA       SER  20   9.709  12.390  -8.979
    3    HB2  SER  20           HB2      SER  20   9.157  11.373 -11.289
    4    HB3  SER  20           HB3      SER  20   8.401  12.924 -11.636
    5    HG   SER  20           HG       SER  20  10.308  13.811 -11.762

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU  21           H        LEU  21   6.627  13.712 -10.162
    2    HA   LEU  21           HA       LEU  21   7.344  16.446  -9.937
    3    HB2  LEU  21           HB2      LEU  21   4.651  15.070  -9.843
    4    HB3  LEU  21           HB3      LEU  21   4.851  16.820  -9.856
    5    HG   LEU  21           HG       LEU  21   5.993  14.988 -11.986
    6   HD12  LEU  21          HD11      LEU  21   3.467  16.669 -12.073
    7   HD11  LEU  21          HD12      LEU  21   3.506  14.911 -11.919
    8   HD13  LEU  21          HD13      LEU  21   4.110  15.680 -13.386
    9   HD21  LEU  21          HD21      LEU  21   5.875  17.964 -11.554
   10   HD23  LEU  21          HD22      LEU  21   5.812  17.360 -13.208
   11   HD22  LEU  21          HD23      LEU  21   7.200  16.994 -12.194

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ALA  22           H        ALA  22   5.803  14.179  -7.685
    2    HA   ALA  22           HA       ALA  22   5.238  15.993  -5.614
    3    HB3  ALA  22           HB1      ALA  22   4.438  13.614  -5.777
    4    HB2  ALA  22           HB2      ALA  22   5.040  14.074  -4.184
    5    HB1  ALA  22           HB3      ALA  22   6.044  13.101  -5.260

  No H/Q in entry =           5
  In of MODEL   42
    1    H    TYR  23           H        TYR  23   8.137  13.922  -6.067
    2    HA   TYR  23           HA       TYR  23   9.545  14.916  -3.818
    3    HB2  TYR  23           HB2      TYR  23  10.296  12.897  -4.983
    4    HB3  TYR  23           HB3      TYR  23  10.619  13.833  -6.442
    5    HD1  TYR  23           HD1      TYR  23  11.587  13.484  -2.852
    6    HD2  TYR  23           HD2      TYR  23  12.673  14.964  -6.736
    7    HE1  TYR  23           HE1      TYR  23  13.857  14.025  -2.012
    8    HE2  TYR  23           HE2      TYR  23  14.943  15.505  -5.895
    9    HH   TYR  23           HH       TYR  23  15.993  14.529  -2.683

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ALA  24           H        ALA  24   9.366  16.030  -7.183
    2    HA   ALA  24           HA       ALA  24  11.295  18.085  -6.941
    3    HB2  ALA  24           HB1      ALA  24  10.844  18.157  -9.148
    4    HB3  ALA  24           HB2      ALA  24   9.302  18.930  -8.782
    5    HB1  ALA  24           HB3      ALA  24   9.400  17.175  -8.914

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA  25           H        ALA  25   7.816  17.953  -6.307
    2    HA   ALA  25           HA       ALA  25   7.379  20.677  -5.732
    3    HB1  ALA  25           HB1      ALA  25   5.687  18.704  -5.929
    4    HB2  ALA  25           HB2      ALA  25   5.343  19.996  -4.777
    5    HB3  ALA  25           HB3      ALA  25   6.013  18.464  -4.211

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU  26           H        LEU  26   8.416  17.979  -3.690
    2    HA   LEU  26           HA       LEU  26   8.552  19.406  -1.252
    3    HB2  LEU  26           HB2      LEU  26   8.612  16.988  -1.249
    4    HB3  LEU  26           HB3      LEU  26  10.078  16.976  -2.226
    5    HG   LEU  26           HG       LEU  26  11.316  18.074  -0.389
    6   HD12  LEU  26          HD11      LEU  26  10.099  18.097   1.875
    7   HD11  LEU  26          HD12      LEU  26   8.606  17.981   0.947
    8   HD13  LEU  26          HD13      LEU  26   9.670  19.372   0.735
    9   HD21  LEU  26          HD21      LEU  26   9.751  15.627   0.487
   10   HD23  LEU  26          HD22      LEU  26  11.277  16.167   1.179
   11   HD22  LEU  26          HD23      LEU  26  11.217  15.611  -0.491

  No H/Q in entry =          11
  In of MODEL   42
    1    H    LYS  27           H        LYS  27  10.950  18.802  -3.787
    2    HA   LYS  27           HA       LYS  27  13.156  20.010  -2.566
    3    HB2  LYS  27           HB2      LYS  27  13.230  18.664  -4.658
    4    HB3  LYS  27           HB3      LYS  27  12.480  20.008  -5.519
    5    HG2  LYS  27           HG2      LYS  27  14.368  21.466  -4.947
    6    HG3  LYS  27           HG3      LYS  27  15.114  20.163  -4.015
    7    HD2  LYS  27           HD2      LYS  27  15.230  18.776  -6.071
    8    HD3  LYS  27           HD3      LYS  27  14.530  20.104  -6.995
    9    HE2  LYS  27           HE2      LYS  27  16.440  21.544  -6.389
   10    HE3  LYS  27           HE3      LYS  27  17.144  20.219  -5.456
   11    HZ3  LYS  27           HZ1      LYS  27  18.126  20.307  -7.646
   12    HZ2  LYS  27           HZ2      LYS  27  16.595  20.210  -8.381
   13    HZ1  LYS  27           HZ3      LYS  27  17.204  18.891  -7.500

  No H/Q in entry =          13
  In of MODEL   42
    1    H    GLN  28           H        GLN  28  10.545  21.430  -4.503
    2    HA   GLN  28           HA       GLN  28  11.540  24.069  -4.657
    3    HB2  GLN  28           HB2      GLN  28   8.691  23.041  -4.532
    4    HB3  GLN  28           HB3      GLN  28   9.129  24.705  -4.913
    5    HG2  GLN  28           HG2      GLN  28  10.081  22.274  -6.455
    6    HG3  GLN  28           HG3      GLN  28   8.759  23.327  -6.957
    7   HE21  GLN  28          HE21      GLN  28  11.879  22.784  -7.714
    8   HE22  GLN  28          HE22      GLN  28  12.389  24.360  -8.085

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ALA  29           H        ALA  29   9.595  22.401  -2.215
    2    HA   ALA  29           HA       ALA  29   9.082  24.598  -0.528
    3    HB2  ALA  29           HB1      ALA  29   8.339  23.038   1.041
    4    HB1  ALA  29           HB2      ALA  29   9.542  21.838   0.570
    5    HB3  ALA  29           HB3      ALA  29   8.156  22.151  -0.472

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LYS  30           H        LYS  30  11.782  22.295  -0.611
    2    HA   LYS  30           HA       LYS  30  13.122  23.229   1.687
    3    HB2  LYS  30           HB2      LYS  30  14.190  21.931  -0.829
    4    HB3  LYS  30           HB3      LYS  30  15.184  22.275   0.588
    5    HG2  LYS  30           HG2      LYS  30  13.618  20.912   1.973
    6    HG3  LYS  30           HG3      LYS  30  12.721  20.503   0.507
    7    HD2  LYS  30           HD2      LYS  30  14.749  19.491  -0.464
    8    HD3  LYS  30           HD3      LYS  30  15.664  19.913   0.985
    9    HE2  LYS  30           HE2      LYS  30  14.147  18.500   2.344
   10    HE3  LYS  30           HE3      LYS  30  13.260  18.058   0.879
   11    HZ2  LYS  30           HZ1      LYS  30  15.034  16.455   1.631
   12    HZ1  LYS  30           HZ2      LYS  30  16.185  17.628   1.176
   13    HZ3  LYS  30           HZ3      LYS  30  15.135  16.959   0.015

  No H/Q in entry =          13
  In of MODEL   42
    1    H    GLN  31           H        GLN  31  13.015  24.438  -1.608
    2    HA   GLN  31           HA       GLN  31  15.194  26.302  -1.194
    3    HB2  GLN  31           HB2      GLN  31  13.143  26.379  -3.410
    4    HB3  GLN  31           HB3      GLN  31  14.772  27.053  -3.417
    5    HG2  GLN  31           HG2      GLN  31  15.201  24.350  -2.846
    6    HG3  GLN  31           HG3      GLN  31  13.891  24.315  -4.019
    7   HE21  GLN  31          HE21      GLN  31  16.722  23.485  -4.436
    8   HE22  GLN  31          HE22      GLN  31  17.302  24.452  -5.704

  No H/Q in entry =           8
  In of MODEL   42
    1    H    GLY  32           H        GLY  32  12.123  26.159  -0.036
    2    HA3  GLY  32           HA2      GLY  32  10.993  27.741   1.244
    3    HA2  GLY  32           HA3      GLY  32  12.132  28.962   0.690

  No H/Q in entry =           3
  In of MODEL   42
    1    H    ASP  33           H        ASP  33  10.732  27.079  -1.798
    2    HA   ASP  33           HA       ASP  33   9.094  29.375  -2.644
    3    HB2  ASP  33           HB2      ASP  33  10.149  26.943  -4.093
    4    HB3  ASP  33           HB3      ASP  33   9.010  28.074  -4.818

  No H/Q in entry =           4
  In of MODEL   42
    1    H    PHE  34           H        PHE  34   7.406  28.919  -1.074
    2    HA   PHE  34           HA       PHE  34   5.995  26.465  -0.975
    3    HB2  PHE  34           HB2      PHE  34   5.073  29.264  -0.288
    4    HB3  PHE  34           HB3      PHE  34   4.207  27.785   0.125
    5    HD1  PHE  34           HD1      PHE  34   6.493  30.152   1.333
    6    HD2  PHE  34           HD2      PHE  34   5.757  25.920   1.278
    7    HE1  PHE  34           HE1      PHE  34   7.889  29.881   3.363
    8    HE2  PHE  34           HE2      PHE  34   7.155  25.653   3.306
    9    HZ   PHE  34           HZ       PHE  34   8.215  27.635   4.348

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ALA  35           H        ALA  35   5.593  29.337  -2.981
    2    HA   ALA  35           HA       ALA  35   3.030  28.757  -3.996
    3    HB1  ALA  35           HB1      ALA  35   4.091  30.138  -6.036
    4    HB3  ALA  35           HB2      ALA  35   5.319  30.482  -4.817
    5    HB2  ALA  35           HB3      ALA  35   3.635  30.912  -4.519

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA  36           H        ALA  36   6.243  28.043  -5.364
    2    HA   ALA  36           HA       ALA  36   5.226  26.630  -7.605
    3    HB3  ALA  36           HB1      ALA  36   7.384  26.726  -8.230
    4    HB2  ALA  36           HB2      ALA  36   7.858  25.690  -6.883
    5    HB1  ALA  36           HB3      ALA  36   7.776  27.439  -6.665

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA  37           H        ALA  37   6.183  25.619  -4.355
    2    HA   ALA  37           HA       ALA  37   6.086  22.832  -4.787
    3    HB2  ALA  37           HB1      ALA  37   5.859  24.624  -2.406
    4    HB1  ALA  37           HB2      ALA  37   6.974  23.292  -2.704
    5    HB3  ALA  37           HB3      ALA  37   5.310  22.960  -2.226

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LYS  38           H        LYS  38   3.587  25.072  -3.606
    2    HA   LYS  38           HA       LYS  38   1.466  23.286  -3.376
    3    HB2  LYS  38           HB2      LYS  38   1.854  26.037  -3.124
    4    HB3  LYS  38           HB3      LYS  38   0.647  25.907  -4.398
    5    HG2  LYS  38           HG2      LYS  38  -0.813  24.601  -2.950
    6    HG3  LYS  38           HG3      LYS  38   0.436  24.523  -1.699
    7    HD2  LYS  38           HD2      LYS  38   0.282  26.861  -1.249
    8    HD3  LYS  38           HD3      LYS  38  -0.632  27.164  -2.727
    9    HE2  LYS  38           HE2      LYS  38  -2.127  27.215  -0.781
   10    HE3  LYS  38           HE3      LYS  38  -2.523  25.845  -1.823
   11    HZ3  LYS  38           HZ1      LYS  38  -1.810  24.363  -0.294
   12    HZ2  LYS  38           HZ2      LYS  38  -2.140  25.624   0.798
   13    HZ1  LYS  38           HZ3      LYS  38  -0.551  25.353   0.265

  No H/Q in entry =          13
  In of MODEL   42
    1    H    ALA  39           H        ALA  39   2.458  25.179  -6.227
    2    HA   ALA  39           HA       ALA  39   0.364  24.340  -7.922
    3    HB2  ALA  39           HB1      ALA  39   3.104  24.954  -8.987
    4    HB1  ALA  39           HB2      ALA  39   2.157  26.227  -8.216
    5    HB3  ALA  39           HB3      ALA  39   1.527  25.399  -9.641

  No H/Q in entry =           5
  In of MODEL   42
    1    H    MET  40           H        MET  40   3.587  22.999  -7.358
    2    HA   MET  40           HA       MET  40   3.455  20.982  -9.351
    3    HB2  MET  40           HB2      MET  40   5.080  21.183  -6.809
    4    HB3  MET  40           HB3      MET  40   5.309  19.925  -8.026
    5    HG2  MET  40           HG2      MET  40   5.402  22.880  -8.688
    6    HG3  MET  40           HG3      MET  40   6.838  21.959  -8.246
    7    HE3  MET  40           HE1      MET  40   7.670  19.736 -11.061
    8    HE2  MET  40           HE2      MET  40   7.110  19.422  -9.421
    9    HE1  MET  40           HE3      MET  40   8.221  20.755  -9.724

  No H/Q in entry =           9
  In of MODEL   42
    1    H    MET  41           H        MET  41   2.555  21.033  -5.923
    2    HA   MET  41           HA       MET  41   1.989  18.275  -5.646
    3    HB2  MET  41           HB2      MET  41   0.692  20.647  -4.287
    4    HB3  MET  41           HB3      MET  41   0.517  18.971  -3.780
    5    HG2  MET  41           HG2      MET  41   3.230  19.160  -3.828
    6    HG3  MET  41           HG3      MET  41   2.812  20.823  -3.429
    7    HE2  MET  41           HE1      MET  41  -0.236  19.607  -1.692
    8    HE1  MET  41           HE2      MET  41   0.598  21.110  -2.071
    9    HE3  MET  41           HE3      MET  41   0.539  20.538  -0.403

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ASP  42           H        ASP  42  -0.019  21.026  -6.608
    2    HA   ASP  42           HA       ASP  42  -2.477  19.696  -6.736
    3    HB2  ASP  42           HB2      ASP  42  -1.740  22.258  -6.993
    4    HB3  ASP  42           HB3      ASP  42  -1.903  21.866  -8.701

  No H/Q in entry =           4
  In of MODEL   42
    1    H    GLN  43           H        GLN  43  -0.040  20.259  -9.248
    2    HA   GLN  43           HA       GLN  43  -1.452  18.959 -11.332
    3    HB2  GLN  43           HB2      GLN  43   1.514  19.438 -10.962
    4    HB3  GLN  43           HB3      GLN  43   0.786  18.809 -12.443
    5    HG2  GLN  43           HG2      GLN  43  -0.701  20.855 -12.475
    6    HG3  GLN  43           HG3      GLN  43   0.266  21.497 -11.151
    7   HE21  GLN  43          HE21      GLN  43   0.439  23.118 -13.236
    8   HE22  GLN  43          HE22      GLN  43   1.847  22.880 -14.150

  No H/Q in entry =           8
  In of MODEL   42
    1    H    SER  44           H        SER  44   0.894  17.788  -8.953
    2    HA   SER  44           HA       SER  44   1.193  15.178  -9.982
    3    HB2  SER  44           HB2      SER  44   2.115  16.604  -7.748
    4    HB3  SER  44           HB3      SER  44   1.238  15.230  -7.075
    5    HG   SER  44           HG       SER  44   3.339  14.585  -7.511

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ARG  45           H        ARG  45  -1.101  16.522  -7.633
    2    HA   ARG  45           HA       ARG  45  -2.513  14.178  -6.994
    3    HB2  ARG  45           HB2      ARG  45  -2.680  16.347  -5.800
    4    HB3  ARG  45           HB3      ARG  45  -3.534  17.026  -7.182
    5    HG2  ARG  45           HG2      ARG  45  -5.320  15.321  -6.893
    6    HG3  ARG  45           HG3      ARG  45  -4.477  14.697  -5.474
    7    HD2  ARG  45           HD2      ARG  45  -4.652  16.965  -4.415
    8    HD3  ARG  45           HD3      ARG  45  -5.638  17.498  -5.793
    9    HE   ARG  45           HE       ARG  45  -6.772  15.135  -4.751
   10   HH21  ARG  45          HH11      ARG  45  -8.602  15.231  -3.472
   11   HH22  ARG  45          HH12      ARG  45  -8.976  16.674  -2.600
   12   HH11  ARG  45          HH21      ARG  45  -6.183  18.373  -3.726
   13   HH12  ARG  45          HH22      ARG  45  -7.601  18.454  -2.742

  No H/Q in entry =          13
  In of MODEL   42
    1    H    MET  46           H        MET  46  -3.080  16.592  -9.540
    2    HA   MET  46           HA       MET  46  -5.437  15.448 -10.593
    3    HB2  MET  46           HB2      MET  46  -3.316  17.241 -11.791
    4    HB3  MET  46           HB3      MET  46  -4.730  16.717 -12.712
    5    HG2  MET  46           HG2      MET  46  -6.213  17.664 -10.991
    6    HG3  MET  46           HG3      MET  46  -4.815  18.171 -10.051
    7    HE2  MET  46           HE1      MET  46  -5.134  20.866 -10.020
    8    HE1  MET  46           HE2      MET  46  -6.711  20.156 -10.348
    9    HE3  MET  46           HE3      MET  46  -6.169  21.550 -11.281

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ALA  47           H        ALA  47  -2.017  14.929 -11.366
    2    HA   ALA  47           HA       ALA  47  -2.392  13.208 -13.577
    3    HB3  ALA  47           HB1      ALA  47  -0.203  14.072 -13.233
    4    HB2  ALA  47           HB2      ALA  47  -0.080  12.342 -12.902
    5    HB1  ALA  47           HB3      ALA  47  -0.154  13.494 -11.567

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU  48           H        LEU  48  -2.115  12.566 -10.105
    2    HA   LEU  48           HA       LEU  48  -2.243   9.728 -10.265
    3    HB2  LEU  48           HB2      LEU  48  -2.976  11.652  -8.047
    4    HB3  LEU  48           HB3      LEU  48  -2.901   9.900  -7.848
    5    HG   LEU  48           HG       LEU  48  -0.587  11.574  -8.853
    6   HD13  LEU  48          HD11      LEU  48  -0.852  12.345  -6.660
    7   HD12  LEU  48          HD12      LEU  48   0.297  11.024  -6.468
    8   HD11  LEU  48          HD13      LEU  48  -1.402  10.781  -6.064
    9   HD22  LEU  48          HD21      LEU  48  -0.116   9.384  -9.498
   10   HD21  LEU  48          HD22      LEU  48  -0.988   8.677  -8.139
   11   HD23  LEU  48          HD23      LEU  48   0.594   9.412  -7.885

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ASN  49           H        ASN  49  -4.676  12.248  -9.851
    2    HA   ASN  49           HA       ASN  49  -6.878  10.608  -9.304
    3    HB2  ASN  49           HB2      ASN  49  -6.922  13.022  -8.971
    4    HB3  ASN  49           HB3      ASN  49  -6.736  13.296 -10.698
    5   HD21  ASN  49          HD21      ASN  49  -8.969  11.804  -8.328
    6   HD22  ASN  49          HD22      ASN  49 -10.368  12.078  -9.246

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLU  50           H        GLU  50  -5.598  11.793 -12.396
    2    HA   GLU  50           HA       GLU  50  -7.573  10.562 -14.035
    3    HB2  GLU  50           HB2      GLU  50  -6.089  12.365 -14.853
    4    HB3  GLU  50           HB3      GLU  50  -4.707  11.276 -14.722
    5    HG2  GLU  50           HG2      GLU  50  -5.705   9.754 -16.356
    6    HG3  GLU  50           HG3      GLU  50  -7.155  10.749 -16.437

  No H/Q in entry =           6
  In of MODEL   42
    1    H    ALA  51           H        ALA  51  -4.409   9.532 -12.843
    2    HA   ALA  51           HA       ALA  51  -4.303   7.079 -14.264
    3    HB2  ALA  51           HB1      ALA  51  -2.322   6.767 -13.172
    4    HB1  ALA  51           HB2      ALA  51  -2.998   7.196 -11.601
    5    HB3  ALA  51           HB3      ALA  51  -2.533   8.462 -12.736

  No H/Q in entry =           5
  In of MODEL   42
    1    H    HIS  52           H        HIS  52  -5.454   7.921 -11.009
    2    HA   HIS  52           HA       HIS  52  -6.166   5.318 -10.178
    3    HB2  HIS  52           HB2      HIS  52  -5.998   7.282  -8.669
    4    HB3  HIS  52           HB3      HIS  52  -7.457   7.945  -9.406
    5    HD1  HIS  52           HD1      HIS  52  -9.695   6.563  -9.050
    6    HD2  HIS  52           HD2      HIS  52  -6.452   5.253  -6.784
    7    HE1  HIS  52           HE1      HIS  52 -10.641   5.043  -7.259
    8    HE2  HIS  52           HE2      HIS  52  -8.675   4.235  -5.868

  No H/Q in entry =           8
  In of MODEL   42
    1    H    LEU  53           H        LEU  53  -7.964   7.799 -11.956
    2    HA   LEU  53           HA       LEU  53 -10.485   6.537 -11.961
    3    HB2  LEU  53           HB2      LEU  53  -9.184   8.504 -13.832
    4    HB3  LEU  53           HB3      LEU  53 -10.792   7.858 -14.150
    5    HG   LEU  53           HG       LEU  53 -10.051   9.166 -11.513
    6   HD13  LEU  53          HD11      LEU  53  -9.758  10.880 -13.161
    7   HD12  LEU  53          HD12      LEU  53 -11.359  11.133 -12.464
    8   HD11  LEU  53          HD13      LEU  53 -11.192  10.370 -14.042
    9   HD22  LEU  53          HD21      LEU  53 -12.062   7.984 -11.178
   10   HD21  LEU  53          HD22      LEU  53 -12.604   8.255 -12.830
   11   HD23  LEU  53          HD23      LEU  53 -12.661   9.563 -11.664

  No H/Q in entry =          11
  In of MODEL   42
    1    H    VAL  54           H        VAL  54  -7.745   6.309 -14.208
    2    HA   VAL  54           HA       VAL  54  -8.996   4.555 -16.049
    3    HB   VAL  54           HB       VAL  54  -6.080   5.025 -15.377
    4   HG12  VAL  54          HG11      VAL  54  -5.855   3.940 -17.768
    5   HG11  VAL  54          HG12      VAL  54  -7.391   3.177 -17.359
    6   HG13  VAL  54          HG13      VAL  54  -5.975   2.904 -16.346
    7   HG22  VAL  54          HG21      VAL  54  -6.830   6.979 -16.417
    8   HG21  VAL  54          HG22      VAL  54  -8.037   6.131 -17.381
    9   HG23  VAL  54          HG23      VAL  54  -6.334   6.031 -17.818

  No H/Q in entry =           9
  In of MODEL   42
    1    H    GLN  55           H        GLN  55  -6.993   3.981 -13.157
    2    HA   GLN  55           HA       GLN  55  -6.939   1.164 -13.416
    3    HB2  GLN  55           HB2      GLN  55  -5.367   2.039 -11.902
    4    HB3  GLN  55           HB3      GLN  55  -6.568   3.019 -11.067
    5    HG2  GLN  55           HG2      GLN  55  -7.274   1.269  -9.749
    6    HG3  GLN  55           HG3      GLN  55  -7.068   0.081 -11.029
    7   HE21  GLN  55          HE21      GLN  55  -5.461  -1.389 -10.542
    8   HE22  GLN  55          HE22      GLN  55  -4.069  -1.055  -9.635

  No H/Q in entry =           8
  In of MODEL   42
    1    H    THR  56           H        THR  56  -9.237   3.354 -11.791
    2    HA   THR  56           HA       THR  56 -10.840   1.489 -10.498
    3    HB   THR  56           HB       THR  56 -11.722   3.998 -11.957
    4    HG1  THR  56           HG1      THR  56 -10.143   3.770  -9.970
    5   HG23  THR  56          HG21      THR  56 -13.699   2.782 -11.550
    6   HG22  THR  56          HG22      THR  56 -13.566   3.844 -10.147
    7   HG21  THR  56          HG23      THR  56 -13.099   2.147 -10.019

  No H/Q in entry =           7
  In of MODEL   42
    1    H    LYS  57           H        LYS  57 -11.041   2.577 -13.882
    2    HA   LYS  57           HA       LYS  57 -13.221   0.918 -14.629
    3    HB2  LYS  57           HB2      LYS  57 -12.328   2.859 -15.949
    4    HB3  LYS  57           HB3      LYS  57 -10.899   1.904 -16.320
    5    HG2  LYS  57           HG2      LYS  57 -12.286   0.236 -17.469
    6    HG3  LYS  57           HG3      LYS  57 -13.737   1.149 -17.074
    7    HD2  LYS  57           HD2      LYS  57 -12.885   3.067 -18.389
    8    HD3  LYS  57           HD3      LYS  57 -11.442   2.143 -18.801
    9    HE2  LYS  57           HE2      LYS  57 -12.843   0.443 -19.927
   10    HE3  LYS  57           HE3      LYS  57 -14.298   1.352 -19.516
   11    HZ2  LYS  57           HZ1      LYS  57 -12.272   1.897 -21.525
   12    HZ1  LYS  57           HZ2      LYS  57 -12.868   3.249 -20.684
   13    HZ3  LYS  57           HZ3      LYS  57 -13.934   2.235 -21.535

  No H/Q in entry =          13
  In of MODEL   42
    1    H    LEU  58           H        LEU  58  -9.722   0.443 -14.585
    2    HA   LEU  58           HA       LEU  58  -9.766  -2.073 -15.876
    3    HB2  LEU  58           HB2      LEU  58  -7.709  -0.808 -14.074
    4    HB3  LEU  58           HB3      LEU  58  -7.471  -2.332 -14.930
    5    HG   LEU  58           HG       LEU  58  -8.196   0.283 -16.289
    6   HD11  LEU  58          HD11      LEU  58  -5.563  -0.988 -15.608
    7   HD13  LEU  58          HD12      LEU  58  -6.037   0.710 -15.556
    8   HD12  LEU  58          HD13      LEU  58  -5.713  -0.065 -17.104
    9   HD22  LEU  58          HD21      LEU  58  -8.797  -1.271 -17.879
   10   HD21  LEU  58          HD22      LEU  58  -7.769  -2.532 -17.202
   11   HD23  LEU  58          HD23      LEU  58  -7.066  -1.266 -18.208

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  59           H        ILE  59 -10.565  -1.162 -12.621
    2    HA   ILE  59           HA       ILE  59 -10.245  -3.934 -11.676
    3    HB   ILE  59           HB       ILE  59  -9.772  -1.669 -10.280
    4   HG12  ILE  59          HG12      ILE  59 -11.146  -4.021  -8.961
    5   HG13  ILE  59          HG13      ILE  59  -9.500  -4.094  -9.540
    6   HG23  ILE  59          HG21      ILE  59 -11.589  -0.955  -8.966
    7   HG22  ILE  59          HG22      ILE  59 -12.532  -2.387  -9.306
    8   HG21  ILE  59          HG23      ILE  59 -12.320  -1.149 -10.541
    9   HD12  ILE  59          HD11      ILE  59 -10.562  -2.140  -7.513
   10   HD11  ILE  59          HD12      ILE  59  -8.912  -2.152  -8.118
   11   HD13  ILE  59          HD13      ILE  59  -9.512  -3.509  -7.163

  No H/Q in entry =          11
  In of MODEL   42
    1    H    GLU  60           H        GLU  60 -12.777  -1.587 -12.475
    2    HA   GLU  60           HA       GLU  60 -14.976  -3.077 -11.455
    3    HB2  GLU  60           HB2      GLU  60 -15.177  -0.708 -12.040
    4    HB3  GLU  60           HB3      GLU  60 -14.839  -1.076 -13.729
    5    HG2  GLU  60           HG2      GLU  60 -17.144  -2.402 -12.315
    6    HG3  GLU  60           HG3      GLU  60 -17.324  -0.803 -13.006

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLY  61           H        GLY  61 -13.314  -3.080 -14.576
    2    HA3  GLY  61           HA2      GLY  61 -15.057  -5.303 -15.461
    3    HA2  GLY  61           HA3      GLY  61 -14.202  -4.208 -16.542

  No H/Q in entry =           3
  In of MODEL   42
    1    H    ASP  62           H        ASP  62 -12.831  -5.669 -13.664
    2    HA   ASP  62           HA       ASP  62 -10.414  -6.397 -14.514
    3    HB2  ASP  62           HB2      ASP  62 -10.494  -8.275 -12.918
    4    HB3  ASP  62           HB3      ASP  62 -11.252  -6.832 -12.253

  No H/Q in entry =           4
  In of MODEL   42
    1    H    ALA  63           H        ALA  63  -9.354  -8.204 -15.525
    2    HA   ALA  63           HA       ALA  63 -10.721  -9.292 -17.809
    3    HB3  ALA  63           HB1      ALA  63  -8.602 -10.540 -18.146
    4    HB2  ALA  63           HB2      ALA  63  -8.065 -10.052 -16.539
    5    HB1  ALA  63           HB3      ALA  63  -8.289  -8.840 -17.801

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLY  64           H        GLY  64 -11.064 -11.518 -18.264
    2    HA3  GLY  64           HA2      GLY  64 -11.591 -13.726 -17.789
    3    HA2  GLY  64           HA3      GLY  64 -11.064 -13.473 -16.130

  No H/Q in entry =           3
  In of MODEL   42
    1    H    GLU  65           H        GLU  65 -13.676 -12.421 -18.342
    2    HA   GLU  65           HA       GLU  65 -15.465 -11.672 -16.317
    3    HB2  GLU  65           HB2      GLU  65 -15.973 -12.567 -19.152
    4    HB3  GLU  65           HB3      GLU  65 -17.223 -11.916 -18.090
    5    HG2  GLU  65           HG2      GLU  65 -15.966  -9.837 -17.828
    6    HG3  GLU  65           HG3      GLU  65 -14.650 -10.484 -18.806

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLY  66           H        GLY  66 -15.197 -14.682 -18.093
    2    HA3  GLY  66           HA2      GLY  66 -17.335 -16.070 -16.868
    3    HA2  GLY  66           HA3      GLY  66 -16.027 -16.781 -17.791

  No H/Q in entry =           3
  In of MODEL   42
    1    H    LYS  67           H        LYS  67 -13.837 -16.266 -16.326
    2    HA   LYS  67           HA       LYS  67 -14.219 -18.021 -14.046
    3    HB2  LYS  67           HB2      LYS  67 -11.767 -17.037 -15.496
    4    HB3  LYS  67           HB3      LYS  67 -11.710 -18.099 -14.082
    5    HG2  LYS  67           HG2      LYS  67 -13.138 -19.739 -15.235
    6    HG3  LYS  67           HG3      LYS  67 -13.232 -18.680 -16.641
    7    HD2  LYS  67           HD2      LYS  67 -10.766 -18.850 -16.906
    8    HD3  LYS  67           HD3      LYS  67 -10.718 -19.967 -15.542
    9    HE2  LYS  67           HE2      LYS  67 -12.372 -20.424 -18.041
   10    HE3  LYS  67           HE3      LYS  67 -10.772 -21.119 -17.779
   11    HZ3  LYS  67           HZ1      LYS  67 -12.445 -22.689 -17.127
   12    HZ2  LYS  67           HZ2      LYS  67 -13.184 -21.552 -16.104
   13    HZ1  LYS  67           HZ3      LYS  67 -11.635 -22.147 -15.738

  No H/Q in entry =          13
  In of MODEL   42
    1    H    MET  68           H        MET  68 -13.318 -17.730 -12.027
    2    HA   MET  68           HA       MET  68 -13.876 -15.280 -10.774
    3    HB2  MET  68           HB2      MET  68 -12.322 -17.684  -9.817
    4    HB3  MET  68           HB3      MET  68 -12.838 -16.353  -8.781
    5    HG2  MET  68           HG2      MET  68 -14.703 -18.060 -10.456
    6    HG3  MET  68           HG3      MET  68 -14.432 -18.267  -8.724
    7    HE3  MET  68           HE1      MET  68 -16.000 -15.525  -6.936
    8    HE2  MET  68           HE2      MET  68 -14.360 -15.197  -7.495
    9    HE1  MET  68           HE3      MET  68 -14.813 -16.835  -7.026

  No H/Q in entry =           9
  In of MODEL   42
    1    H    LYS  69           H        LYS  69 -11.073 -16.070 -12.533
    2    HA   LYS  69           HA       LYS  69  -9.225 -14.591 -10.888
    3    HB2  LYS  69           HB2      LYS  69  -8.960 -15.880 -13.603
    4    HB3  LYS  69           HB3      LYS  69  -7.632 -15.042 -12.797
    5    HG2  LYS  69           HG2      LYS  69  -7.871 -16.539 -10.844
    6    HG3  LYS  69           HG3      LYS  69  -9.192 -17.379 -11.652
    7    HD2  LYS  69           HD2      LYS  69  -7.664 -18.039 -13.474
    8    HD3  LYS  69           HD3      LYS  69  -6.338 -17.204 -12.662
    9    HE2  LYS  69           HE2      LYS  69  -6.591 -18.682 -10.707
   10    HE3  LYS  69           HE3      LYS  69  -7.933 -19.508 -11.498
   11    HZ2  LYS  69           HZ1      LYS  69  -5.249 -20.103 -11.718
   12    HZ1  LYS  69           HZ2      LYS  69  -5.674 -19.401 -13.205
   13    HZ3  LYS  69           HZ3      LYS  69  -6.520 -20.759 -12.631

  No H/Q in entry =          13
  In of MODEL   42
    1    H    VAL  70           H        VAL  70  -7.827 -12.830 -11.669
    2    HA   VAL  70           HA       VAL  70  -9.225 -10.945 -13.482
    3    HB   VAL  70           HB       VAL  70  -8.461  -9.126 -11.989
    4   HG13  VAL  70          HG11      VAL  70 -10.226  -9.373 -10.460
    5   HG12  VAL  70          HG12      VAL  70  -9.949 -11.106 -10.280
    6   HG11  VAL  70          HG13      VAL  70 -10.690 -10.481 -11.752
    7   HG21  VAL  70          HG21      VAL  70  -7.364 -11.466 -10.418
    8   HG23  VAL  70          HG22      VAL  70  -7.770  -9.950  -9.617
    9   HG22  VAL  70          HG23      VAL  70  -6.541  -9.976 -10.881

  No H/Q in entry =           9
  In of MODEL   42
    1    H    SER  71           H        SER  71  -7.715  -9.201 -14.243
    2    HA   SER  71           HA       SER  71  -5.483 -10.278 -15.590
    3    HB2  SER  71           HB2      SER  71  -6.733  -8.217 -16.282
    4    HB3  SER  71           HB3      SER  71  -6.000  -7.370 -14.922
    5    HG   SER  71           HG       SER  71  -4.887  -8.256 -17.310

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU  72           H        LEU  72  -3.450 -10.634 -14.946
    2    HA   LEU  72           HA       LEU  72  -2.718 -10.429 -12.237
    3    HB2  LEU  72           HB2      LEU  72  -1.079 -10.880 -14.726
    4    HB3  LEU  72           HB3      LEU  72  -0.411 -10.958 -13.099
    5    HG   LEU  72           HG       LEU  72  -2.780 -12.627 -14.006
    6   HD12  LEU  72          HD11      LEU  72   0.106 -13.505 -13.719
    7   HD11  LEU  72          HD12      LEU  72  -0.642 -13.107 -15.265
    8   HD13  LEU  72          HD13      LEU  72  -1.249 -14.464 -14.315
    9   HD21  LEU  72          HD21      LEU  72  -1.076 -12.476 -11.531
   10   HD23  LEU  72          HD22      LEU  72  -1.771 -14.024 -11.984
   11   HD22  LEU  72          HD23      LEU  72  -2.823 -12.649 -11.658

  No H/Q in entry =          11
  In of MODEL   42
    1    H    VAL  73           H        VAL  73  -1.985  -8.422 -15.019
    2    HA   VAL  73           HA       VAL  73  -0.038  -6.749 -13.922
    3    HB   VAL  73           HB       VAL  73  -0.412  -5.331 -15.779
    4   HG11  VAL  73          HG11      VAL  73   0.384  -7.659 -16.275
    5   HG13  VAL  73          HG12      VAL  73  -0.461  -6.905 -17.626
    6   HG12  VAL  73          HG13      VAL  73  -1.284  -8.106 -16.633
    7   HG22  VAL  73          HG21      VAL  73  -2.666  -4.756 -15.799
    8   HG21  VAL  73          HG22      VAL  73  -3.197  -6.424 -15.597
    9   HG23  VAL  73          HG23      VAL  73  -2.603  -5.872 -17.163

  No H/Q in entry =           9
  In of MODEL   42
    1    H    LEU  74           H        LEU  74  -3.435  -6.820 -13.353
    2    HA   LEU  74           HA       LEU  74  -4.016  -4.156 -12.738
    3    HB2  LEU  74           HB2      LEU  74  -5.768  -5.798 -12.906
    4    HB3  LEU  74           HB3      LEU  74  -5.085  -6.731 -11.579
    5    HG   LEU  74           HG       LEU  74  -5.510  -4.838 -10.038
    6   HD12  LEU  74          HD11      LEU  74  -7.110  -3.058 -10.998
    7   HD11  LEU  74          HD12      LEU  74  -6.551  -3.588 -12.584
    8   HD13  LEU  74          HD13      LEU  74  -5.404  -2.913 -11.424
    9   HD21  LEU  74          HD21      LEU  74  -7.228  -6.682 -10.865
   10   HD23  LEU  74          HD22      LEU  74  -8.060  -5.261 -11.461
   11   HD22  LEU  74          HD23      LEU  74  -7.715  -5.403  -9.755

  No H/Q in entry =          11
  In of MODEL   42
    1    H    VAL  75           H        VAL  75  -3.003  -6.757 -10.580
    2    HA   VAL  75           HA       VAL  75  -2.776  -5.208  -8.237
    3    HB   VAL  75           HB       VAL  75  -1.320  -7.725  -9.034
    4   HG11  VAL  75          HG11      VAL  75  -1.473  -6.234  -6.376
    5   HG13  VAL  75          HG12      VAL  75  -0.026  -6.548  -7.323
    6   HG12  VAL  75          HG13      VAL  75  -0.875  -7.880  -6.557
    7   HG22  VAL  75          HG21      VAL  75  -3.738  -7.992  -8.842
    8   HG21  VAL  75          HG22      VAL  75  -3.750  -7.113  -7.313
    9   HG23  VAL  75          HG23      VAL  75  -2.984  -8.700  -7.414

  No H/Q in entry =           9
  In of MODEL   42
    1    H    GLU  76           H        GLU  76  -0.386  -6.000 -10.781
    2    HA   GLU  76           HA       GLU  76   1.821  -4.682  -9.630
    3    HB2  GLU  76           HB2      GLU  76   2.005  -6.158 -11.612
    4    HB3  GLU  76           HB3      GLU  76   1.098  -4.996 -12.566
    5    HG2  GLU  76           HG2      GLU  76   3.438  -4.686 -13.072
    6    HG3  GLU  76           HG3      GLU  76   2.929  -3.303 -12.123

  No H/Q in entry =           6
  In of MODEL   42
    1    H    ALA  77           H        ALA  77  -0.701  -3.447 -11.811
    2    HA   ALA  77           HA       ALA  77   0.323  -0.814 -11.990
    3    HB3  ALA  77           HB1      ALA  77  -2.611  -1.510 -12.129
    4    HB1  ALA  77           HB2      ALA  77  -1.493  -1.931 -13.427
    5    HB2  ALA  77           HB3      ALA  77  -1.742  -0.240 -12.993

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLN  78           H        GLN  78  -1.958  -2.340  -9.772
    2    HA   GLN  78           HA       GLN  78  -2.731  -0.012  -8.368
    3    HB2  GLN  78           HB2      GLN  78  -3.870  -2.256  -8.280
    4    HB3  GLN  78           HB3      GLN  78  -2.538  -2.834  -7.282
    5    HG2  GLN  78           HG2      GLN  78  -3.026  -1.096  -5.614
    6    HG3  GLN  78           HG3      GLN  78  -4.354  -0.504  -6.610
    7   HE21  GLN  78          HE21      GLN  78  -4.833  -1.478  -3.958
    8   HE22  GLN  78          HE22      GLN  78  -5.721  -2.921  -4.073

  No H/Q in entry =           8
  In of MODEL   42
    1    H    LEU  79           H        LEU  79  -0.080  -2.302  -7.926
    2    HA   LEU  79           HA       LEU  79   0.915  -1.418  -5.472
    3    HB2  LEU  79           HB2      LEU  79   1.756  -3.437  -6.542
    4    HB3  LEU  79           HB3      LEU  79   2.410  -2.493  -7.877
    5    HG   LEU  79           HG       LEU  79   3.984  -1.374  -6.378
    6   HD13  LEU  79          HD11      LEU  79   2.989  -1.116  -4.308
    7   HD12  LEU  79          HD12      LEU  79   4.052  -2.479  -3.968
    8   HD11  LEU  79          HD13      LEU  79   2.342  -2.757  -4.292
    9   HD23  LEU  79          HD21      LEU  79   5.171  -3.537  -5.479
   10   HD22  LEU  79          HD22      LEU  79   4.965  -3.335  -7.216
   11   HD21  LEU  79          HD23      LEU  79   3.876  -4.392  -6.321

  No H/Q in entry =          11
  In of MODEL   42
    1    H    HIS  80           H        HIS  80   1.789  -0.311  -8.747
    2    HA   HIS  80           HA       HIS  80   3.623   1.654  -7.830
    3    HB2  HIS  80           HB2      HIS  80   2.318   0.976 -10.409
    4    HB3  HIS  80           HB3      HIS  80   2.933   2.621 -10.240
    5    HD1  HIS  80           HD1      HIS  80   5.337   2.892 -10.768
    6    HD2  HIS  80           HD2      HIS  80   4.474  -1.008  -9.575
    7    HE1  HIS  80           HE1      HIS  80   7.511   1.590 -10.941
    8    HE2  HIS  80           HE2      HIS  80   6.996  -0.791 -10.217

  No H/Q in entry =           8
  In of MODEL   42
    1    H    LEU  81           H        LEU  81   0.219   1.855  -8.800
    2    HA   LEU  81           HA       LEU  81  -0.023   4.650  -8.468
    3    HB2  LEU  81           HB2      LEU  81  -2.063   2.428  -8.383
    4    HB3  LEU  81           HB3      LEU  81  -2.495   4.136  -8.290
    5    HG   LEU  81           HG       LEU  81  -0.822   2.968 -10.530
    6   HD12  LEU  81          HD11      LEU  81  -3.054   3.313 -11.823
    7   HD11  LEU  81          HD12      LEU  81  -3.806   3.253 -10.230
    8   HD13  LEU  81          HD13      LEU  81  -2.881   1.875 -10.820
    9   HD23  LEU  81          HD21      LEU  81  -1.898   5.125 -11.624
   10   HD22  LEU  81          HD22      LEU  81  -0.476   5.279 -10.595
   11   HD21  LEU  81          HD23      LEU  81  -2.075   5.645  -9.950

  No H/Q in entry =          11
  In of MODEL   42
    1    H    MET  82           H        MET  82  -0.706   1.970  -6.217
    2    HA   MET  82           HA       MET  82  -1.735   3.568  -4.127
    3    HB2  MET  82           HB2      MET  82  -0.391   0.866  -4.171
    4    HB3  MET  82           HB3      MET  82  -0.957   1.597  -2.671
    5    HG2  MET  82           HG2      MET  82  -2.702   1.123  -5.108
    6    HG3  MET  82           HG3      MET  82  -2.632   0.048  -3.713
    7    HE3  MET  82           HE1      MET  82  -4.329   1.716  -0.893
    8    HE2  MET  82           HE2      MET  82  -2.596   1.975  -1.082
    9    HE1  MET  82           HE3      MET  82  -3.303   0.425  -1.535

  No H/Q in entry =           9
  In of MODEL   42
    1    H    THR  83           H        THR  83   1.552   2.446  -4.826
    2    HA   THR  83           HA       THR  83   2.788   3.536  -2.529
    3    HB   THR  83           HB       THR  83   4.878   3.458  -4.008
    4    HG1  THR  83           HG1      THR  83   4.627   2.935  -6.031
    5   HG22  THR  83          HG21      THR  83   4.404   0.805  -4.340
    6   HG21  THR  83          HG22      THR  83   3.122   1.198  -3.196
    7   HG23  THR  83          HG23      THR  83   4.806   1.524  -2.781

  No H/Q in entry =           7
  In of MODEL   42
    1    H    SER  84           H        SER  84   2.422   4.821  -5.827
    2    HA   SER  84           HA       SER  84   3.789   7.246  -5.375
    3    HB2  SER  84           HB2      SER  84   1.705   6.437  -7.389
    4    HB3  SER  84           HB3      SER  84   2.401   8.057  -7.365
    5    HG   SER  84           HG       SER  84   3.745   5.567  -7.661

  No H/Q in entry =           5
  In of MODEL   42
    1    H    MET  85           H        MET  85   0.288   6.528  -5.194
    2    HA   MET  85           HA       MET  85  -0.543   9.147  -4.590
    3    HB2  MET  85           HB2      MET  85  -2.085   7.351  -5.255
    4    HB3  MET  85           HB3      MET  85  -1.805   6.548  -3.711
    5    HG2  MET  85           HG2      MET  85  -2.684   8.504  -2.510
    6    HG3  MET  85           HG3      MET  85  -2.916   9.350  -4.039
    7    HE2  MET  85           HE1      MET  85  -5.190   5.876  -2.225
    8    HE1  MET  85           HE2      MET  85  -3.544   6.421  -1.913
    9    HE3  MET  85           HE3      MET  85  -3.867   5.353  -3.274

  No H/Q in entry =           9
  In of MODEL   42
    1    H    LEU  86           H        LEU  86   0.352   6.474  -2.449
    2    HA   LEU  86           HA       LEU  86  -0.159   7.782  -0.005
    3    HB2  LEU  86           HB2      LEU  86   0.275   5.306  -0.402
    4    HB3  LEU  86           HB3      LEU  86   1.987   5.716  -0.501
    5    HG   LEU  86           HG       LEU  86   1.682   6.879   1.768
    6   HD11  LEU  86          HD11      LEU  86  -1.022   6.145   1.304
    7   HD13  LEU  86          HD12      LEU  86  -0.343   6.883   2.753
    8   HD12  LEU  86          HD13      LEU  86  -0.455   5.128   2.633
    9   HD23  LEU  86          HD21      LEU  86   1.219   3.892   1.890
   10   HD22  LEU  86          HD22      LEU  86   2.236   4.889   2.928
   11   HD21  LEU  86          HD23      LEU  86   2.728   4.559   1.268

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ALA  87           H        ALA  87   2.813   7.453  -1.903
    2    HA   ALA  87           HA       ALA  87   4.540   8.841  -0.182
    3    HB3  ALA  87           HB1      ALA  87   4.615   7.829  -2.891
    4    HB2  ALA  87           HB2      ALA  87   5.957   8.142  -1.793
    5    HB1  ALA  87           HB3      ALA  87   5.355   9.431  -2.835

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ARG  88           H        ARG  88   2.599  10.003  -2.897
    2    HA   ARG  88           HA       ARG  88   3.408  12.682  -2.780
    3    HB2  ARG  88           HB2      ARG  88   2.134  11.547  -4.635
    4    HB3  ARG  88           HB3      ARG  88   0.681  11.708  -3.647
    5    HG2  ARG  88           HG2      ARG  88   1.734  14.275  -3.565
    6    HG3  ARG  88           HG3      ARG  88   2.147  13.757  -5.197
    7    HD2  ARG  88           HD2      ARG  88   0.004  13.865  -5.889
    8    HD3  ARG  88           HD3      ARG  88  -0.589  13.018  -4.459
    9    HE   ARG  88           HE       ARG  88  -0.744  15.799  -4.875
   10   HH21  ARG  88          HH11      ARG  88  -1.249  17.133  -3.134
   11   HH22  ARG  88          HH12      ARG  88  -0.955  16.591  -1.518
   12   HH11  ARG  88          HH21      ARG  88   0.249  13.521  -2.505
   13   HH12  ARG  88          HH22      ARG  88  -0.124  14.540  -1.162

  No H/Q in entry =          13
  In of MODEL   42
    1    H    GLU  89           H        GLU  89   0.688  11.042  -1.133
    2    HA   GLU  89           HA       GLU  89  -0.386  13.368   0.077
    3    HB2  GLU  89           HB2      GLU  89  -1.533  11.143  -0.008
    4    HB3  GLU  89           HB3      GLU  89  -0.413  10.572   1.229
    5    HG2  GLU  89           HG2      GLU  89  -1.206  12.280   2.792
    6    HG3  GLU  89           HG3      GLU  89  -2.253  12.966   1.552

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LEU  90           H        LEU  90   2.038  11.042   1.241
    2    HA   LEU  90           HA       LEU  90   2.419  12.279   3.771
    3    HB2  LEU  90           HB2      LEU  90   4.162  10.482   2.087
    4    HB3  LEU  90           HB3      LEU  90   4.594  10.991   3.724
    5    HG   LEU  90           HG       LEU  90   1.939   9.683   3.071
    6   HD12  LEU  90          HD11      LEU  90   3.053   7.621   4.074
    7   HD11  LEU  90          HD12      LEU  90   4.587   8.456   3.828
    8   HD13  LEU  90          HD13      LEU  90   3.565   8.063   2.444
    9   HD22  LEU  90          HD21      LEU  90   1.693  10.608   5.194
   10   HD21  LEU  90          HD22      LEU  90   3.411  10.476   5.571
   11   HD23  LEU  90          HD23      LEU  90   2.385   9.043   5.621

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  91           H        ILE  91   4.018  12.642   0.639
    2    HA   ILE  91           HA       ILE  91   6.023  14.444   1.474
    3    HB   ILE  91           HB       ILE  91   4.696  13.975  -1.202
    4   HG12  ILE  91          HG12      ILE  91   7.524  13.446  -0.237
    5   HG13  ILE  91          HG13      ILE  91   6.226  12.267  -0.072
    6   HG22  ILE  91          HG21      ILE  91   6.936  15.291  -1.897
    7   HG21  ILE  91          HG22      ILE  91   6.642  16.094  -0.354
    8   HG23  ILE  91          HG23      ILE  91   5.416  16.141  -1.619
    9   HD13  ILE  91          HD11      ILE  91   6.041  11.948  -2.379
   10   HD12  ILE  91          HD12      ILE  91   7.779  12.166  -2.170
   11   HD11  ILE  91          HD13      ILE  91   6.786  13.504  -2.752

  No H/Q in entry =          11
  In of MODEL   42
    1    H    THR  92           H        THR  92   2.664  14.926   0.477
    2    HA   THR  92           HA       THR  92   2.679  17.749   0.419
    3    HB   THR  92           HB       THR  92   0.485  15.786   1.124
    4    HG1  THR  92           HG1      THR  92   0.780  15.605  -0.962
    5   HG22  THR  92          HG21      THR  92  -0.887  17.968   0.408
    6   HG21  THR  92          HG22      THR  92   0.519  18.773   1.101
    7   HG23  THR  92          HG23      THR  92  -0.435  17.664   2.085

  No H/Q in entry =           7
  In of MODEL   42
    1    H    GLU  93           H        GLU  93   2.105  15.455   3.073
    2    HA   GLU  93           HA       GLU  93   1.608  17.364   5.095
    3    HB2  GLU  93           HB2      GLU  93   2.881  14.620   5.324
    4    HB3  GLU  93           HB3      GLU  93   2.208  15.556   6.660
    5    HG2  GLU  93           HG2      GLU  93   0.577  14.804   4.226
    6    HG3  GLU  93           HG3      GLU  93   0.668  13.779   5.653

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LEU  94           H        LEU  94   4.589  15.840   3.934
    2    HA   LEU  94           HA       LEU  94   6.362  16.959   5.818
    3    HB2  LEU  94           HB2      LEU  94   6.740  15.989   2.985
    4    HB3  LEU  94           HB3      LEU  94   8.082  16.626   3.930
    5    HG   LEU  94           HG       LEU  94   6.314  14.455   5.069
    6   HD11  LEU  94          HD11      LEU  94   8.399  14.200   2.931
    7   HD13  LEU  94          HD12      LEU  94   6.940  13.248   3.196
    8   HD12  LEU  94          HD13      LEU  94   8.365  12.973   4.198
    9   HD23  LEU  94          HD21      LEU  94   8.499  13.885   6.214
   10   HD22  LEU  94          HD22      LEU  94   7.857  15.473   6.634
   11   HD21  LEU  94          HD23      LEU  94   9.190  15.334   5.487

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  95           H        ILE  95   5.230  18.151   2.672
    2    HA   ILE  95           HA       ILE  95   6.836  20.485   2.610
    3    HB   ILE  95           HB       ILE  95   4.178  19.841   1.312
    4   HG12  ILE  95          HG12      ILE  95   6.968  20.138   0.167
    5   HG13  ILE  95          HG13      ILE  95   6.297  18.595   0.682
    6   HG21  ILE  95          HG21      ILE  95   5.963  22.283   1.089
    7   HG23  ILE  95          HG22      ILE  95   4.238  22.240   1.450
    8   HG22  ILE  95          HG23      ILE  95   4.810  21.832  -0.168
    9   HD13  ILE  95          HD11      ILE  95   4.731  18.543  -1.042
   10   HD12  ILE  95          HD12      ILE  95   6.090  19.342  -1.833
   11   HD11  ILE  95          HD13      ILE  95   4.733  20.296  -1.236

  No H/Q in entry =          11
  In of MODEL   42
    1    H    GLU  96           H        GLU  96   3.582  19.880   3.915
    2    HA   GLU  96           HA       GLU  96   3.003  22.535   4.671
    3    HB2  GLU  96           HB2      GLU  96   1.303  20.777   4.686
    4    HB3  GLU  96           HB3      GLU  96   2.156  19.935   5.978
    5    HG2  GLU  96           HG2      GLU  96   1.160  21.232   7.552
    6    HG3  GLU  96           HG3      GLU  96   1.715  22.699   6.754

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LEU  97           H        LEU  97   4.813  19.955   6.288
    2    HA   LEU  97           HA       LEU  97   5.198  21.296   8.758
    3    HB2  LEU  97           HB2      LEU  97   6.698  19.105   7.337
    4    HB3  LEU  97           HB3      LEU  97   7.303  19.780   8.848
    5    HG   LEU  97           HG       LEU  97   4.477  18.729   8.545
    6   HD12  LEU  97          HD11      LEU  97   5.390  16.702   9.753
    7   HD11  LEU  97          HD12      LEU  97   7.009  17.309   9.405
    8   HD13  LEU  97          HD13      LEU  97   5.929  16.868   8.082
    9   HD23  LEU  97          HD21      LEU  97   4.933  18.425  11.108
   10   HD22  LEU  97          HD22      LEU  97   4.575  20.043  10.506
   11   HD21  LEU  97          HD23      LEU  97   6.241  19.578  10.845

  No H/Q in entry =          11
  In of MODEL   42
    1    H    HIS  98           H        HIS  98   7.060  21.286   5.727
    2    HA   HIS  98           HA       HIS  98   9.240  22.832   6.621
    3    HB2  HIS  98           HB2      HIS  98   7.935  22.599   3.899
    4    HB3  HIS  98           HB3      HIS  98   9.390  23.555   4.186
    5    HD1  HIS  98           HD1      HIS  98   8.124  20.004   4.206
    6    HD2  HIS  98           HD2      HIS  98  11.739  22.044   4.622
    7    HE1  HIS  98           HE1      HIS  98   9.952  18.246   4.142
    8    HE2  HIS  98           HE2      HIS  98  12.157  19.468   4.395

  No H/Q in entry =           8
  In of MODEL   42
    1    H    GLU  99           H        GLU  99   6.029  23.718   5.456
    2    HA   GLU  99           HA       GLU  99   6.451  26.526   5.400
    3    HB2  GLU  99           HB2      GLU  99   4.550  25.388   4.274
    4    HB3  GLU  99           HB3      GLU  99   3.854  25.035   5.855
    5    HG2  GLU  99           HG2      GLU  99   3.712  27.429   6.359
    6    HG3  GLU  99           HG3      GLU  99   4.490  27.819   4.828

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LYS 100           H        LYS 100   5.293  24.306   7.923
    2    HA   LYS 100           HA       LYS 100   4.745  26.368   9.821
    3    HB2  LYS 100           HB2      LYS 100   5.275  23.407  10.162
    4    HB3  LYS 100           HB3      LYS 100   4.849  24.485  11.497
    5    HG2  LYS 100           HG2      LYS 100   2.789  25.157  10.256
    6    HG3  LYS 100           HG3      LYS 100   3.194  23.982   9.001
    7    HD2  LYS 100           HD2      LYS 100   3.093  22.161  10.661
    8    HD3  LYS 100           HD3      LYS 100   2.705  23.329  11.927
    9    HE2  LYS 100           HE2      LYS 100   0.658  23.984  10.670
   10    HE3  LYS 100           HE3      LYS 100   1.035  22.759   9.452
   11    HZ1  LYS 100           HZ1      LYS 100   0.768  22.094  12.333
   12    HZ3  LYS 100           HZ2      LYS 100   0.732  21.041  10.997
   13    HZ2  LYS 100           HZ3      LYS 100  -0.566  22.101  11.282

  No H/Q in entry =          13
  In of MODEL   42
    1    H    LEU 101           H        LEU 101   7.637  24.527   8.976
    2    HA   LEU 101           HA       LEU 101   9.256  25.339  11.176
    3    HB2  LEU 101           HB2      LEU 101   9.826  24.346   8.395
    4    HB3  LEU 101           HB3      LEU 101  11.141  24.990   9.373
    5    HG   LEU 101           HG       LEU 101   9.279  22.862  10.440
    6   HD12  LEU 101          HD11      LEU 101  11.306  21.335   9.824
    7   HD11  LEU 101          HD12      LEU 101  11.690  22.593   8.651
    8   HD13  LEU 101          HD13      LEU 101  10.147  21.745   8.561
    9   HD21  LEU 101          HD21      LEU 101  12.022  23.925  11.160
   10   HD23  LEU 101          HD22      LEU 101  11.456  22.361  11.740
   11   HD22  LEU 101          HD23      LEU 101  10.588  23.831  12.183

  No H/Q in entry =          11
  In of MODEL   42
    1    H    LYS 102           H        LYS 102   7.696  27.230   9.042
    2    HA   LYS 102           HA       LYS 102   7.809  29.522   8.752
    3    HB2  LYS 102           HB2      LYS 102   9.378  29.379  10.845
    4    HB3  LYS 102           HB3      LYS 102  10.677  29.554   9.682
    5    HG2  LYS 102           HG2      LYS 102   8.606  31.540  10.552
    6    HG3  LYS 102           HG3      LYS 102  10.322  31.772  10.296
    7    HD2  LYS 102           HD2      LYS 102   8.357  31.383   8.001
    8    HD3  LYS 102           HD3      LYS 102   8.767  32.955   8.670
    9    HE2  LYS 102           HE2      LYS 102  10.115  31.751   6.591
   10    HE3  LYS 102           HE3      LYS 102  10.755  33.047   7.602
   11    HZ2  LYS 102           HZ1      LYS 102  12.244  31.118   7.420
   12    HZ1  LYS 102           HZ2      LYS 102  11.069  30.153   8.165
   13    HZ3  LYS 102           HZ3      LYS 102  11.784  31.428   9.023

  No H/Q in entry =          13
  In of MODEL   42
    1    H    ALA 103           H        ALA 103  11.042  28.131   8.176
    2    HA   ALA 103           HA       ALA 103  12.022  29.494   6.098
    3    HB2  ALA 103           HB1      ALA 103  12.868  27.266   5.166
    4    HB1  ALA 103           HB2      ALA 103  11.965  26.505   6.474
    5    HB3  ALA 103           HB3      ALA 103  13.274  27.628   6.844

  No H/Q in entry =           5
  In of MODEL   42
    1    H1   LYS   3           H1       LYS   3 -31.395   5.549 -20.023
    2    H2   LYS   3           H3       LYS   3 -30.377   5.295 -21.359
    3    H3   LYS   3           H2       LYS   3 -31.737   4.306 -21.128
    4    HA   LYS   3           HA       LYS   3 -30.701   2.961 -19.707
    5    HB2  LYS   3           HB2      LYS   3 -28.458   4.458 -21.011
    6    HB3  LYS   3           HB3      LYS   3 -28.104   3.266 -19.760
    7    HG2  LYS   3           HG2      LYS   3 -29.444   1.623 -21.126
    8    HG3  LYS   3           HG3      LYS   3 -29.427   2.821 -22.419
    9    HD2  LYS   3           HD2      LYS   3 -26.944   2.804 -22.334
   10    HD3  LYS   3           HD3      LYS   3 -27.028   1.505 -21.145
   11    HE2  LYS   3           HE2      LYS   3 -28.455   0.268 -22.879
   12    HE3  LYS   3           HE3      LYS   3 -27.866   1.466 -24.030
   13    HZ3  LYS   3           HZ1      LYS   3 -26.018   0.309 -24.270
   14    HZ2  LYS   3           HZ2      LYS   3 -26.616  -0.881 -23.215
   15    HZ1  LYS   3           HZ3      LYS   3 -25.684   0.402 -22.608

  No H/Q in entry =          15
  In of MODEL   42
    1    H    LYS   4           H        LYS   4 -30.778   2.822 -17.646
    2    HA   LYS   4           HA       LYS   4 -30.159   5.139 -15.993
    3    HB2  LYS   4           HB2      LYS   4 -31.265   2.403 -15.301
    4    HB3  LYS   4           HB3      LYS   4 -31.111   3.752 -14.176
    5    HG2  LYS   4           HG2      LYS   4 -32.882   3.615 -16.622
    6    HG3  LYS   4           HG3      LYS   4 -33.397   3.651 -14.937
    7    HD2  LYS   4           HD2      LYS   4 -32.790   5.899 -14.668
    8    HD3  LYS   4           HD3      LYS   4 -31.730   5.877 -16.076
    9    HE2  LYS   4           HE2      LYS   4 -33.699   7.175 -16.568
   10    HE3  LYS   4           HE3      LYS   4 -33.710   5.698 -17.533
   11    HZ3  LYS   4           HZ1      LYS   4 -35.271   4.731 -16.006
   12    HZ2  LYS   4           HZ2      LYS   4 -35.874   6.203 -16.602
   13    HZ1  LYS   4           HZ3      LYS   4 -35.235   6.121 -15.030

  No H/Q in entry =          13
  In of MODEL   42
    1    H    HIS   5           H        HIS   5 -28.717   5.283 -14.380
    2    HA   HIS   5           HA       HIS   5 -26.363   3.539 -14.676
    3    HB2  HIS   5           HB2      HIS   5 -26.737   6.285 -13.480
    4    HB3  HIS   5           HB3      HIS   5 -25.221   5.387 -13.440
    5    HD1  HIS   5           HD1      HIS   5 -23.774   6.636 -15.013
    6    HD2  HIS   5           HD2      HIS   5 -27.528   5.872 -16.617
    7    HE1  HIS   5           HE1      HIS   5 -23.594   7.216 -17.463
    8    HE2  HIS   5           HE2      HIS   5 -25.882   6.738 -18.410

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ILE   6           H        ILE   6 -26.095   1.978 -13.351
    2    HA   ILE   6           HA       ILE   6 -27.118   2.217 -10.602
    3    HB   ILE   6           HB       ILE   6 -26.183  -0.221 -12.121
    4   HG12  ILE   6          HG12      ILE   6 -28.969   0.618 -11.310
    5   HG13  ILE   6          HG13      ILE   6 -28.311   0.799 -12.936
    6   HG23  ILE   6          HG21      ILE   6 -26.536  -1.482 -10.261
    7   HG22  ILE   6          HG22      ILE   6 -27.743  -0.377  -9.601
    8   HG21  ILE   6          HG23      ILE   6 -26.029   0.021  -9.489
    9   HD13  ILE   6          HD11      ILE   6 -28.687  -1.337 -13.436
   10   HD12  ILE   6          HD12      ILE   6 -29.722  -1.354 -12.008
   11   HD11  ILE   6          HD13      ILE   6 -28.048  -1.901 -11.891

  No H/Q in entry =          11
  In of MODEL   42
    1    H    TYR   7           H        TYR   7 -25.401   2.925  -9.293
    2    HA   TYR   7           HA       TYR   7 -22.648   2.064  -9.932
    3    HB2  TYR   7           HB2      TYR   7 -23.719   4.465  -8.471
    4    HB3  TYR   7           HB3      TYR   7 -22.016   4.011  -8.485
    5    HD1  TYR   7           HD1      TYR   7 -22.978   3.024 -11.587
    6    HD2  TYR   7           HD2      TYR   7 -22.468   6.624  -9.362
    7    HE1  TYR   7           HE1      TYR   7 -22.562   4.263 -13.675
    8    HE2  TYR   7           HE2      TYR   7 -22.094   7.867 -11.443
    9    HH   TYR   7           HH       TYR   7 -22.277   7.767 -13.678

  No H/Q in entry =           9
  In of MODEL   42
    1    H    LEU   8           H        LEU   8 -21.653   0.750  -8.586
    2    HA   LEU   8           HA       LEU   8 -22.802   0.222  -5.917
    3    HB2  LEU   8           HB2      LEU   8 -21.016  -1.384  -7.722
    4    HB3  LEU   8           HB3      LEU   8 -21.211  -1.768  -6.013
    5    HG   LEU   8           HG       LEU   8 -23.678  -2.030  -6.469
    6   HD13  LEU   8          HD11      LEU   8 -23.822  -0.824  -8.584
    7   HD12  LEU   8          HD12      LEU   8 -24.289  -2.507  -8.826
    8   HD11  LEU   8          HD13      LEU   8 -22.693  -1.953  -9.330
    9   HD23  LEU   8          HD21      LEU   8 -22.308  -4.028  -8.138
   10   HD22  LEU   8          HD22      LEU   8 -23.408  -4.231  -6.775
   11   HD21  LEU   8          HD23      LEU   8 -21.718  -3.816  -6.491

  No H/Q in entry =          11
  In of MODEL   42
    1    H    PHE   9           H        PHE   9 -21.583   0.675  -4.119
    2    HA   PHE   9           HA       PHE   9 -18.819   1.701  -4.574
    3    HB2  PHE   9           HB2      PHE   9 -20.922   2.722  -2.669
    4    HB3  PHE   9           HB3      PHE   9 -19.229   3.192  -2.604
    5    HD1  PHE   9           HD1      PHE   9 -18.224   4.547  -4.362
    6    HD2  PHE   9           HD2      PHE   9 -22.373   3.462  -4.505
    7    HE1  PHE   9           HE1      PHE   9 -18.600   6.221  -6.148
    8    HE2  PHE   9           HE2      PHE   9 -22.751   5.148  -6.286
    9    HZ   PHE   9           HZ       PHE   9 -20.863   6.523  -7.113

  No H/Q in entry =           9
  In of MODEL   42
    1    H    SER  10           H        SER  10 -17.225   0.832  -3.404
    2    HA   SER  10           HA       SER  10 -17.473  -0.065  -0.717
    3    HB2  SER  10           HB2      SER  10 -18.584  -1.982  -1.829
    4    HB3  SER  10           HB3      SER  10 -17.155  -2.203  -2.827
    5    HG   SER  10           HG       SER  10 -17.131  -3.557  -1.000

  No H/Q in entry =           5
  In of MODEL   42
    1    H    SER  11           H        SER  11 -15.476   0.134   0.179
    2    HA   SER  11           HA       SER  11 -13.299   1.062  -1.321
    3    HB2  SER  11           HB2      SER  11 -13.846   1.133   1.256
    4    HB3  SER  11           HB3      SER  11 -12.817  -0.301   1.280
    5    HG   SER  11           HG       SER  11 -12.105   2.259   1.118

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA  12           H        ALA  12 -14.387  -1.698  -2.115
    2    HA   ALA  12           HA       ALA  12 -11.750  -2.831  -2.606
    3    HB3  ALA  12           HB1      ALA  12 -12.207  -4.038  -0.618
    4    HB2  ALA  12           HB2      ALA  12 -12.596  -5.142  -1.936
    5    HB1  ALA  12           HB3      ALA  12 -13.890  -4.308  -1.077

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLY  13           H        GLY  13 -12.619  -1.861  -4.646
    2    HA3  GLY  13           HA2      GLY  13 -14.785  -2.798  -6.118
    3    HA2  GLY  13           HA3      GLY  13 -13.291  -2.177  -6.832

  No H/Q in entry =           3
  In of MODEL   42
    1    H    MET  14           H        MET  14 -11.768  -4.435  -5.485
    2    HA   MET  14           HA       MET  14 -11.681  -6.180  -7.681
    3    HB2  MET  14           HB2      MET  14  -9.828  -6.061  -6.065
    4    HB3  MET  14           HB3      MET  14 -10.819  -6.863  -4.848
    5    HG2  MET  14           HG2      MET  14  -9.370  -8.512  -5.899
    6    HG3  MET  14           HG3      MET  14 -11.026  -8.824  -6.421
    7    HE1  MET  14           HE1      MET  14  -7.630  -7.230  -7.204
    8    HE3  MET  14           HE2      MET  14  -7.389  -7.811  -8.850
    9    HE2  MET  14           HE3      MET  14  -7.643  -8.967  -7.545

  No H/Q in entry =           9
  In of MODEL   42
    1    H    SER  15           H        SER  15 -13.401  -6.641  -4.613
    2    HA   SER  15           HA       SER  15 -14.476  -9.197  -5.545
    3    HB2  SER  15           HB2      SER  15 -15.024  -7.657  -2.996
    4    HB3  SER  15           HB3      SER  15 -15.838  -9.157  -3.433
    5    HG   SER  15           HG       SER  15 -13.056  -8.717  -3.011

  No H/Q in entry =           5
  In of MODEL   42
    1    H    THR  16           H        THR  16 -15.629  -5.865  -5.132
    2    HA   THR  16           HA       THR  16 -18.405  -6.382  -5.725
    3    HB   THR  16           HB       THR  16 -16.838  -3.825  -6.217
    4    HG1  THR  16           HG1      THR  16 -18.054  -3.608  -3.964
    5   HG22  THR  16          HG21      THR  16 -19.714  -4.168  -5.372
    6   HG21  THR  16          HG22      THR  16 -19.242  -4.135  -7.080
    7   HG23  THR  16          HG23      THR  16 -18.937  -2.737  -6.039

  No H/Q in entry =           7
  In of MODEL   42
    1    H    SER  17           H        SER  17 -15.517  -5.782  -7.529
    2    HA   SER  17           HA       SER  17 -16.633  -5.090 -10.048
    3    HB2  SER  17           HB2      SER  17 -13.967  -6.299  -9.290
    4    HB3  SER  17           HB3      SER  17 -14.396  -5.913 -10.957
    5    HG   SER  17           HG       SER  17 -14.902  -3.867  -9.235

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU  18           H        LEU  18 -15.972  -8.208  -8.582
    2    HA   LEU  18           HA       LEU  18 -16.467  -9.734 -10.941
    3    HB2  LEU  18           HB2      LEU  18 -15.242 -10.644  -9.016
    4    HB3  LEU  18           HB3      LEU  18 -16.694 -10.501  -8.025
    5    HG   LEU  18           HG       LEU  18 -17.843 -12.124  -9.443
    6   HD12  LEU  18          HD11      LEU  18 -16.221 -13.393 -11.060
    7   HD11  LEU  18          HD12      LEU  18 -15.308 -11.884 -11.029
    8   HD13  LEU  18          HD13      LEU  18 -16.978 -11.894 -11.593
    9   HD23  LEU  18          HD21      LEU  18 -15.204 -13.330  -8.753
   10   HD22  LEU  18          HD22      LEU  18 -16.826 -14.003  -8.585
   11   HD21  LEU  18          HD23      LEU  18 -16.288 -12.721  -7.500

  No H/Q in entry =          11
  In of MODEL   42
    1    H    LEU  19           H        LEU  19 -18.519  -8.592  -8.263
    2    HA   LEU  19           HA       LEU  19 -20.925  -9.868  -9.128
    3    HB2  LEU  19           HB2      LEU  19 -20.725  -9.022  -6.877
    4    HB3  LEU  19           HB3      LEU  19 -20.483  -7.383  -7.480
    5    HG   LEU  19           HG       LEU  19 -22.835  -7.415  -8.315
    6   HD13  LEU  19          HD11      LEU  19 -24.353  -9.116  -7.442
    7   HD12  LEU  19          HD12      LEU  19 -23.002  -9.948  -6.675
    8   HD11  LEU  19          HD13      LEU  19 -23.101  -9.864  -8.434
    9   HD22  LEU  19          HD21      LEU  19 -23.804  -7.050  -6.109
   10   HD21  LEU  19          HD22      LEU  19 -22.190  -6.346  -6.225
   11   HD23  LEU  19          HD23      LEU  19 -22.429  -7.867  -5.365

  No H/Q in entry =          11
  In of MODEL   42
    1    H    VAL  20           H        VAL  20 -19.536  -6.656  -9.811
    2    HA   VAL  20           HA       VAL  20 -21.660  -5.697 -11.415
    3    HB   VAL  20           HB       VAL  20 -18.694  -4.996 -11.489
    4   HG11  VAL  20          HG11      VAL  20 -21.015  -3.751 -12.980
    5   HG13  VAL  20          HG12      VAL  20 -19.556  -4.459 -13.673
    6   HG12  VAL  20          HG13      VAL  20 -19.458  -2.955 -12.758
    7   HG22  VAL  20          HG21      VAL  20 -19.529  -4.215  -9.478
    8   HG21  VAL  20          HG22      VAL  20 -21.105  -3.828 -10.166
    9   HG23  VAL  20          HG23      VAL  20 -19.707  -2.821 -10.543

  No H/Q in entry =           9
  In of MODEL   42
    1    H    SER  21           H        SER  21 -18.814  -7.647 -12.395
    2    HA   SER  21           HA       SER  21 -19.560  -7.572 -15.157
    3    HB2  SER  21           HB2      SER  21 -18.049  -9.486 -15.462
    4    HB3  SER  21           HB3      SER  21 -17.280  -8.208 -14.524
    5    HG   SER  21           HG       SER  21 -17.583  -9.376 -12.689

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LYS  22           H        LYS  22 -20.584  -9.788 -12.594
    2    HA   LYS  22           HA       LYS  22 -22.035 -11.468 -14.433
    3    HB2  LYS  22           HB2      LYS  22 -22.322 -11.118 -11.447
    4    HB3  LYS  22           HB3      LYS  22 -23.165 -12.335 -12.403
    5    HG2  LYS  22           HG2      LYS  22 -20.167 -12.152 -12.150
    6    HG3  LYS  22           HG3      LYS  22 -21.190 -13.199 -11.168
    7    HD2  LYS  22           HD2      LYS  22 -21.964 -14.333 -13.217
    8    HD3  LYS  22           HD3      LYS  22 -20.885 -13.313 -14.169
    9    HE2  LYS  22           HE2      LYS  22 -18.946 -14.254 -13.001
   10    HE3  LYS  22           HE3      LYS  22 -20.013 -15.255 -12.016
   11    HZ1  LYS  22           HZ1      LYS  22 -20.272 -15.536 -14.895
   12    HZ3  LYS  22           HZ2      LYS  22 -20.325 -16.714 -13.672
   13    HZ2  LYS  22           HZ3      LYS  22 -18.829 -16.117 -14.212

  No H/Q in entry =          13
  In of MODEL   42
    1    H    MET  23           H        MET  23 -22.891  -8.569 -12.585
    2    HA   MET  23           HA       MET  23 -25.686  -8.749 -13.134
    3    HB2  MET  23           HB2      MET  23 -23.931  -6.375 -12.540
    4    HB3  MET  23           HB3      MET  23 -25.678  -6.269 -12.745
    5    HG2  MET  23           HG2      MET  23 -26.053  -7.580 -10.778
    6    HG3  MET  23           HG3      MET  23 -24.331  -7.931 -10.625
    7    HE2  MET  23           HE1      MET  23 -26.774  -4.360  -9.482
    8    HE1  MET  23           HE2      MET  23 -26.973  -5.340 -10.933
    9    HE3  MET  23           HE3      MET  23 -25.988  -3.878 -10.986

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ARG  24           H        ARG  24 -22.957  -7.229 -14.880
    2    HA   ARG  24           HA       ARG  24 -24.469  -5.987 -16.905
    3    HB2  ARG  24           HB2      ARG  24 -22.044  -5.511 -16.481
    4    HB3  ARG  24           HB3      ARG  24 -21.649  -7.090 -17.114
    5    HG2  ARG  24           HG2      ARG  24 -22.548  -6.425 -19.357
    6    HG3  ARG  24           HG3      ARG  24 -22.896  -4.807 -18.693
    7    HD2  ARG  24           HD2      ARG  24 -20.448  -4.690 -17.984
    8    HD3  ARG  24           HD3      ARG  24 -20.201  -6.160 -18.918
    9    HE   ARG  24           HE       ARG  24 -20.587  -3.582 -20.074
   10   HH21  ARG  24          HH11      ARG  24 -21.314  -3.604 -22.202
   11   HH22  ARG  24          HH12      ARG  24 -21.025  -4.992 -23.190
   12   HH11  ARG  24          HH21      ARG  24 -19.916  -6.881 -20.410
   13   HH12  ARG  24          HH22      ARG  24 -20.189  -6.922 -22.124

  No H/Q in entry =          13
  In of MODEL   42
    1    H    ALA  25           H        ALA  25 -23.237  -9.283 -16.604
    2    HA   ALA  25           HA       ALA  25 -23.797 -10.141 -19.247
    3    HB1  ALA  25           HB1      ALA  25 -23.042 -12.146 -18.537
    4    HB3  ALA  25           HB2      ALA  25 -24.121 -12.159 -17.142
    5    HB2  ALA  25           HB3      ALA  25 -22.596 -11.280 -17.067

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLN  26           H        GLN  26 -25.667 -10.236 -16.252
    2    HA   GLN  26           HA       GLN  26 -27.953 -11.520 -17.302
    3    HB2  GLN  26           HB2      GLN  26 -27.536  -9.752 -14.911
    4    HB3  GLN  26           HB3      GLN  26 -29.068 -10.528 -15.283
    5    HG2  GLN  26           HG2      GLN  26 -26.441 -11.896 -14.771
    6    HG3  GLN  26           HG3      GLN  26 -27.821 -11.837 -13.683
    7   HE21  GLN  26          HE21      GLN  26 -26.512 -13.961 -14.936
    8   HE22  GLN  26          HE22      GLN  26 -27.506 -15.045 -15.746

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ALA  27           H        ALA  27 -27.140  -8.092 -16.903
    2    HA   ALA  27           HA       ALA  27 -29.652  -7.085 -17.727
    3    HB1  ALA  27           HB1      ALA  27 -27.905  -5.708 -16.587
    4    HB3  ALA  27           HB2      ALA  27 -28.499  -4.964 -18.073
    5    HB2  ALA  27           HB3      ALA  27 -26.935  -5.779 -18.059

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLU  28           H        GLU  28 -26.883  -8.219 -19.553
    2    HA   GLU  28           HA       GLU  28 -27.814  -7.214 -22.087
    3    HB2  GLU  28           HB2      GLU  28 -25.424  -7.816 -21.426
    4    HB3  GLU  28           HB3      GLU  28 -25.910  -9.498 -21.633
    5    HG2  GLU  28           HG2      GLU  28 -24.760  -8.686 -23.585
    6    HG3  GLU  28           HG3      GLU  28 -26.440  -9.066 -23.959

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LYS  29           H        LYS  29 -27.902 -10.322 -20.429
    2    HA   LYS  29           HA       LYS  29 -29.124 -11.838 -22.451
    3    HB2  LYS  29           HB2      LYS  29 -28.073 -12.783 -20.429
    4    HB3  LYS  29           HB3      LYS  29 -29.383 -12.119 -19.454
    5    HG2  LYS  29           HG2      LYS  29 -30.979 -13.546 -20.546
    6    HG3  LYS  29           HG3      LYS  29 -29.743 -14.142 -21.650
    7    HD2  LYS  29           HD2      LYS  29 -28.588 -15.268 -19.899
    8    HD3  LYS  29           HD3      LYS  29 -29.542 -14.457 -18.659
    9    HE2  LYS  29           HE2      LYS  29 -30.210 -16.831 -19.029
   10    HE3  LYS  29           HE3      LYS  29 -31.523 -15.681 -19.294
   11    HZ1  LYS  29           HZ1      LYS  29 -30.917 -15.799 -21.712
   12    HZ3  LYS  29           HZ2      LYS  29 -31.600 -17.208 -21.056
   13    HZ2  LYS  29           HZ3      LYS  29 -29.927 -17.124 -21.329

  No H/Q in entry =          13
  In of MODEL   42
    1    H    TYR  30           H        TYR  30 -30.623  -9.778 -19.971
    2    HA   TYR  30           HA       TYR  30 -33.250 -10.317 -21.252
    3    HB2  TYR  30           HB2      TYR  30 -32.678  -9.141 -18.523
    4    HB3  TYR  30           HB3      TYR  30 -34.276  -9.453 -19.200
    5    HD1  TYR  30           HD1      TYR  30 -35.105 -11.775 -19.425
    6    HD2  TYR  30           HD2      TYR  30 -31.323 -10.923 -17.663
    7    HE1  TYR  30           HE1      TYR  30 -34.950 -14.097 -18.624
    8    HE2  TYR  30           HE2      TYR  30 -31.169 -13.231 -16.867
    9    HH   TYR  30           HH       TYR  30 -32.712 -15.647 -17.982

  No H/Q in entry =           9
  In of MODEL   42
    1    H    GLU  31           H        GLU  31 -31.142  -8.255 -22.021
    2    HA   GLU  31           HA       GLU  31 -31.128  -6.097 -22.845
    3    HB2  GLU  31           HB2      GLU  31 -33.989  -6.911 -23.401
    4    HB3  GLU  31           HB3      GLU  31 -33.184  -5.515 -24.120
    5    HG2  GLU  31           HG2      GLU  31 -31.646  -6.904 -25.287
    6    HG3  GLU  31           HG3      GLU  31 -32.176  -8.335 -24.406

  No H/Q in entry =           6
  In of MODEL   42
    1    H    VAL  32           H        VAL  32 -31.372  -6.000 -20.117
    2    HA   VAL  32           HA       VAL  32 -33.316  -3.952 -19.489
    3    HB   VAL  32           HB       VAL  32 -30.915  -4.861 -17.870
    4   HG12  VAL  32          HG11      VAL  32 -32.507  -4.089 -16.000
    5   HG11  VAL  32          HG12      VAL  32 -33.352  -3.216 -17.277
    6   HG13  VAL  32          HG13      VAL  32 -31.661  -2.853 -16.932
    7   HG21  VAL  32          HG21      VAL  32 -32.612  -6.642 -18.584
    8   HG23  VAL  32          HG22      VAL  32 -33.697  -5.850 -17.440
    9   HG22  VAL  32          HG23      VAL  32 -32.165  -6.521 -16.882

  No H/Q in entry =           9
  In of MODEL   42
    1    HA   PRO  33           HA       PRO  33 -30.362  -0.921 -21.119
    2    HB2  PRO  33           HB2      PRO  33 -31.952   1.247 -21.021
    3    HB3  PRO  33           HB3      PRO  33 -32.359  -0.070 -22.121
    4    HG2  PRO  33           HG2      PRO  33 -33.387   0.412 -19.324
    5    HG3  PRO  33           HG3      PRO  33 -34.321   0.170 -20.800
    6    HD2  PRO  33           HD2      PRO  33 -33.818  -1.885 -19.125
    7    HD3  PRO  33           HD3      PRO  33 -33.845  -2.129 -20.871

  No H/Q in entry =           7
  In of MODEL   42
    1    H    VAL  34           H        VAL  34 -29.110  -1.419 -19.151
    2    HA   VAL  34           HA       VAL  34 -28.937   1.016 -17.502
    3    HB   VAL  34           HB       VAL  34 -28.335  -0.424 -15.554
    4   HG12  VAL  34          HG11      VAL  34 -30.718  -1.382 -15.283
    5   HG11  VAL  34          HG12      VAL  34 -31.038  -0.634 -16.846
    6   HG13  VAL  34          HG13      VAL  34 -30.541   0.362 -15.478
    7   HG21  VAL  34          HG21      VAL  34 -28.417  -2.457 -17.563
    8   HG23  VAL  34          HG22      VAL  34 -29.482  -2.854 -16.212
    9   HG22  VAL  34          HG23      VAL  34 -27.779  -2.506 -15.919

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ILE  35           H        ILE  35 -26.991   1.521 -16.633
    2    HA   ILE  35           HA       ILE  35 -24.621   0.275 -17.860
    3    HB   ILE  35           HB       ILE  35 -25.137   3.149 -17.057
    4   HG12  ILE  35          HG12      ILE  35 -24.070   1.877 -19.585
    5   HG13  ILE  35          HG13      ILE  35 -25.725   2.438 -19.350
    6   HG21  ILE  35          HG21      ILE  35 -22.517   1.709 -17.326
    7   HG23  ILE  35          HG22      ILE  35 -23.032   2.871 -16.105
    8   HG22  ILE  35          HG23      ILE  35 -22.644   3.418 -17.737
    9   HD11  ILE  35          HD11      ILE  35 -24.412   4.682 -18.731
   10   HD13  ILE  35          HD12      ILE  35 -24.911   4.280 -20.375
   11   HD12  ILE  35          HD13      ILE  35 -23.254   3.970 -19.854

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ILE  36           H        ILE  36 -23.379  -0.703 -16.241
    2    HA   ILE  36           HA       ILE  36 -23.884  -0.104 -13.377
    3    HB   ILE  36           HB       ILE  36 -22.944  -2.776 -14.471
    4   HG12  ILE  36          HG12      ILE  36 -25.789  -2.071 -13.750
    5   HG13  ILE  36          HG13      ILE  36 -25.194  -2.031 -15.409
    6   HG23  ILE  36          HG21      ILE  36 -23.296  -3.616 -12.362
    7   HG22  ILE  36          HG22      ILE  36 -24.476  -2.374 -11.941
    8   HG21  ILE  36          HG23      ILE  36 -22.757  -1.980 -11.986
    9   HD13  ILE  36          HD11      ILE  36 -25.276  -4.249 -15.616
   10   HD12  ILE  36          HD12      ILE  36 -26.366  -4.165 -14.234
   11   HD11  ILE  36          HD13      ILE  36 -24.658  -4.524 -13.988

  No H/Q in entry =          11
  In of MODEL   42
    1    H    GLU  37           H        GLU  37 -22.144   0.590 -12.247
    2    HA   GLU  37           HA       GLU  37 -19.413  -0.109 -13.122
    3    HB2  GLU  37           HB2      GLU  37 -20.420   2.646 -12.434
    4    HB3  GLU  37           HB3      GLU  37 -18.713   2.213 -12.547
    5    HG2  GLU  37           HG2      GLU  37 -20.689   2.120 -14.809
    6    HG3  GLU  37           HG3      GLU  37 -19.529   3.414 -14.512

  No H/Q in entry =           6
  In of MODEL   42
    1    H    ALA  38           H        ALA  38 -17.944  -0.292 -11.417
    2    HA   ALA  38           HA       ALA  38 -19.023  -0.151  -8.662
    3    HB1  ALA  38           HB1      ALA  38 -17.217  -2.026 -10.061
    4    HB3  ALA  38           HB2      ALA  38 -18.278  -2.300  -8.679
    5    HB2  ALA  38           HB3      ALA  38 -16.696  -1.559  -8.441

  No H/Q in entry =           5
  In of MODEL   42
    1    H    PHE  39           H        PHE  39 -17.850   1.104  -7.172
    2    HA   PHE  39           HA       PHE  39 -15.358   2.399  -8.031
    3    HB2  PHE  39           HB2      PHE  39 -17.632   3.912  -6.748
    4    HB3  PHE  39           HB3      PHE  39 -16.089   4.568  -7.295
    5    HD1  PHE  39           HD1      PHE  39 -15.664   4.993  -9.615
    6    HD2  PHE  39           HD2      PHE  39 -19.376   3.345  -8.318
    7    HE1  PHE  39           HE1      PHE  39 -16.655   5.519 -11.825
    8    HE2  PHE  39           HE2      PHE  39 -20.378   3.858 -10.516
    9    HZ   PHE  39           HZ       PHE  39 -19.016   4.917 -12.286

  No H/Q in entry =           9
  In of MODEL   42
    1    HA   PRO  40           HA       PRO  40 -14.456   1.683  -3.730
    2    HB2  PRO  40           HB2      PRO  40 -12.776   3.765  -3.101
    3    HB3  PRO  40           HB3      PRO  40 -12.266   2.449  -4.158
    4    HG2  PRO  40           HG2      PRO  40 -13.381   5.142  -4.926
    5    HG3  PRO  40           HG3      PRO  40 -11.915   4.354  -5.509
    6    HD2  PRO  40           HD2      PRO  40 -14.112   4.186  -6.948
    7    HD3  PRO  40           HD3      PRO  40 -13.108   2.752  -6.745

  No H/Q in entry =           7
  In of MODEL   42
    1    H    GLU  41           H        GLU  41 -15.146   2.637  -1.611
    2    HA   GLU  41           HA       GLU  41 -17.455   4.253  -1.629
    3    HB2  GLU  41           HB2      GLU  41 -17.334   4.194   0.755
    4    HB3  GLU  41           HB3      GLU  41 -16.801   2.622   0.160
    5    HG2  GLU  41           HG2      GLU  41 -14.483   3.220   0.567
    6    HG3  GLU  41           HG3      GLU  41 -14.971   4.833   1.087

  No H/Q in entry =           6
  In of MODEL   42
    1    H    THR  42           H        THR  42 -14.161   5.298  -1.632
    2    HA   THR  42           HA       THR  42 -14.630   7.843  -0.428
    3    HB   THR  42           HB       THR  42 -12.482   8.500  -1.485
    4    HG1  THR  42           HG1      THR  42 -12.029   5.965  -2.464
    5   HG21  THR  42          HG21      THR  42 -12.483   5.724  -0.272
    6   HG23  THR  42          HG22      THR  42 -12.446   7.243   0.625
    7   HG22  THR  42          HG23      THR  42 -11.081   6.787  -0.391

  No H/Q in entry =           7
  In of MODEL   42
    1    H    LEU  43           H        LEU  43 -15.445   6.714  -3.541
    2    HA   LEU  43           HA       LEU  43 -15.792   9.473  -4.517
    3    HB2  LEU  43           HB2      LEU  43 -16.040   6.816  -5.917
    4    HB3  LEU  43           HB3      LEU  43 -16.284   8.388  -6.675
    5    HG   LEU  43           HG       LEU  43 -13.663   7.346  -5.626
    6   HD11  LEU  43          HD11      LEU  43 -14.776   6.347  -7.772
    7   HD13  LEU  43          HD12      LEU  43 -13.078   6.820  -7.798
    8   HD12  LEU  43          HD13      LEU  43 -14.298   7.883  -8.497
    9   HD22  LEU  43          HD21      LEU  43 -13.676   9.720  -5.463
   10   HD21  LEU  43          HD22      LEU  43 -14.480   9.893  -7.024
   11   HD23  LEU  43          HD23      LEU  43 -12.810   9.334  -6.951

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ALA  44           H        ALA  44 -17.692   7.575  -2.692
    2    HA   ALA  44           HA       ALA  44 -20.142   7.337  -4.051
    3    HB2  ALA  44           HB1      ALA  44 -19.992   6.228  -1.951
    4    HB3  ALA  44           HB2      ALA  44 -21.155   7.529  -1.697
    5    HB1  ALA  44           HB3      ALA  44 -19.498   7.703  -1.119

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLY  45           H        GLY  45 -18.856  10.191  -2.500
    2    HA3  GLY  45           HA2      GLY  45 -21.344  11.595  -2.899
    3    HA2  GLY  45           HA3      GLY  45 -19.834  12.279  -2.300

  No H/Q in entry =           3
  In of MODEL   42
    1    H    GLU  46           H        GLU  46 -18.234  11.402  -4.567
    2    HA   GLU  46           HA       GLU  46 -18.930  13.590  -6.348
    3    HB2  GLU  46           HB2      GLU  46 -16.599  13.221  -5.717
    4    HB3  GLU  46           HB3      GLU  46 -16.663  11.591  -6.388
    5    HG2  GLU  46           HG2      GLU  46 -15.506  12.973  -7.933
    6    HG3  GLU  46           HG3      GLU  46 -17.087  12.601  -8.621

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LYS  47           H        LYS  47 -18.667  10.078  -6.776
    2    HA   LYS  47           HA       LYS  47 -19.733  10.253  -9.469
    3    HB2  LYS  47           HB2      LYS  47 -19.119   7.877  -7.703
    4    HB3  LYS  47           HB3      LYS  47 -19.627   7.779  -9.389
    5    HG2  LYS  47           HG2      LYS  47 -17.170   9.276  -8.570
    6    HG3  LYS  47           HG3      LYS  47 -17.145   7.541  -8.876
    7    HD2  LYS  47           HD2      LYS  47 -18.078   7.938 -11.116
    8    HD3  LYS  47           HD3      LYS  47 -18.045   9.673 -10.807
    9    HE2  LYS  47           HE2      LYS  47 -16.111   9.107 -12.092
   10    HE3  LYS  47           HE3      LYS  47 -15.587   9.494 -10.454
   11    HZ3  LYS  47           HZ1      LYS  47 -14.575   7.548 -10.470
   12    HZ2  LYS  47           HZ2      LYS  47 -15.339   7.063 -11.906
   13    HZ1  LYS  47           HZ3      LYS  47 -16.105   6.814 -10.410

  No H/Q in entry =          13
  In of MODEL   42
    1    H    GLY  48           H        GLY  48 -21.072   9.447  -6.339
    2    HA3  GLY  48           HA2      GLY  48 -23.398   8.170  -7.114
    3    HA2  GLY  48           HA3      GLY  48 -23.232   9.172  -5.673

  No H/Q in entry =           3
  In of MODEL   42
    1    H    GLN  49           H        GLN  49 -22.721  11.615  -7.239
    2    HA   GLN  49           HA       GLN  49 -25.320  12.626  -7.422
    3    HB2  GLN  49           HB2      GLN  49 -22.791  13.587  -8.745
    4    HB3  GLN  49           HB3      GLN  49 -24.291  14.495  -8.684
    5    HG2  GLN  49           HG2      GLN  49 -24.169  14.527  -6.246
    6    HG3  GLN  49           HG3      GLN  49 -22.682  13.597  -6.305
    7   HE21  GLN  49          HE21      GLN  49 -22.670  15.830  -5.034
    8   HE22  GLN  49          HE22      GLN  49 -21.787  17.120  -5.670

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ASN  50           H        ASN  50 -23.533  10.811  -9.781
    2    HA   ASN  50           HA       ASN  50 -25.418  11.608 -11.892
    3    HB2  ASN  50           HB2      ASN  50 -22.777  10.168 -12.085
    4    HB3  ASN  50           HB3      ASN  50 -23.823  10.552 -13.446
    5   HD21  ASN  50          HD21      ASN  50 -21.246  11.501 -11.796
    6   HD22  ASN  50          HD22      ASN  50 -21.070  13.144 -12.138

  No H/Q in entry =           6
  In of MODEL   42
    1    H    ALA  51           H        ALA  51 -25.346   9.256  -9.643
    2    HA   ALA  51           HA       ALA  51 -26.019   7.080 -11.478
    3    HB2  ALA  51           HB1      ALA  51 -25.410   5.756  -9.782
    4    HB3  ALA  51           HB2      ALA  51 -26.578   6.521  -8.707
    5    HB1  ALA  51           HB3      ALA  51 -24.962   7.205  -8.881

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ASP  52           H        ASP  52 -27.985   5.949 -11.367
    2    HA   ASP  52           HA       ASP  52 -30.244   7.699 -10.736
    3    HB2  ASP  52           HB2      ASP  52 -29.933   5.201 -12.400
    4    HB3  ASP  52           HB3      ASP  52 -31.510   5.875 -11.989

  No H/Q in entry =           4
  In of MODEL   42
    1    H    VAL  53           H        VAL  53 -28.550   4.873  -9.693
    2    HA   VAL  53           HA       VAL  53 -30.031   4.948  -7.199
    3    HB   VAL  53           HB       VAL  53 -31.348   3.253  -8.461
    4   HG11  VAL  53          HG11      VAL  53 -29.548   2.459  -9.955
    5   HG13  VAL  53          HG12      VAL  53 -30.344   1.134  -9.106
    6   HG12  VAL  53          HG13      VAL  53 -28.762   1.697  -8.574
    7   HG23  VAL  53          HG21      VAL  53 -30.477   1.309  -6.754
    8   HG22  VAL  53          HG22      VAL  53 -31.660   2.571  -6.406
    9   HG21  VAL  53          HG23      VAL  53 -29.968   2.807  -5.973

  No H/Q in entry =           9
  In of MODEL   42
    1    H    VAL  54           H        VAL  54 -28.727   4.566  -5.524
    2    HA   VAL  54           HA       VAL  54 -25.929   3.819  -6.093
    3    HB   VAL  54           HB       VAL  54 -27.098   5.558  -3.862
    4   HG11  VAL  54          HG11      VAL  54 -24.464   4.235  -4.112
    5   HG13  VAL  54          HG12      VAL  54 -25.263   4.888  -2.682
    6   HG12  VAL  54          HG13      VAL  54 -24.381   5.964  -3.767
    7   HG22  VAL  54          HG21      VAL  54 -26.291   7.403  -4.951
    8   HG21  VAL  54          HG22      VAL  54 -26.781   6.391  -6.310
    9   HG23  VAL  54          HG23      VAL  54 -25.083   6.481  -5.846

  No H/Q in entry =           9
  In of MODEL   42
    1    H    LEU  55           H        LEU  55 -25.276   1.922  -5.439
    2    HA   LEU  55           HA       LEU  55 -26.765   0.558  -3.284
    3    HB2  LEU  55           HB2      LEU  55 -25.133  -0.553  -5.554
    4    HB3  LEU  55           HB3      LEU  55 -25.878  -1.514  -4.276
    5    HG   LEU  55           HG       LEU  55 -27.340   0.017  -6.417
    6   HD13  LEU  55          HD11      LEU  55 -26.955  -1.824  -7.629
    7   HD12  LEU  55          HD12      LEU  55 -27.896  -2.733  -6.447
    8   HD11  LEU  55          HD13      LEU  55 -26.146  -2.603  -6.270
    9   HD23  LEU  55          HD21      LEU  55 -28.590  -1.974  -4.578
   10   HD22  LEU  55          HD22      LEU  55 -29.323  -0.619  -5.437
   11   HD21  LEU  55          HD23      LEU  55 -28.334  -0.325  -4.008

  No H/Q in entry =          11
  In of MODEL   42
    1    H    LEU  56           H        LEU  56 -25.619   0.008  -1.461
    2    HA   LEU  56           HA       LEU  56 -22.701   0.511  -1.468
    3    HB2  LEU  56           HB2      LEU  56 -24.531   0.236   0.904
    4    HB3  LEU  56           HB3      LEU  56 -22.839   0.729   0.918
    5    HG   LEU  56           HG       LEU  56 -25.183   2.320  -0.083
    6   HD11  LEU  56          HD11      LEU  56 -24.092   1.982   2.455
    7   HD13  LEU  56          HD12      LEU  56 -25.125   3.313   1.932
    8   HD12  LEU  56          HD13      LEU  56 -23.372   3.482   1.871
    9   HD23  LEU  56          HD21      LEU  56 -23.300   4.088  -0.250
   10   HD22  LEU  56          HD22      LEU  56 -23.622   2.977  -1.581
   11   HD21  LEU  56          HD23      LEU  56 -22.272   2.676  -0.487

  No H/Q in entry =          11
  In of MODEL   42
    1    H    GLY  57           H        GLY  57 -21.271  -1.067  -0.911
    2    HA3  GLY  57           HA2      GLY  57 -22.092  -3.785  -1.117
    3    HA2  GLY  57           HA3      GLY  57 -20.495  -3.232  -0.617

  No H/Q in entry =           3
  In of MODEL   42
    1    HA   PRO  58           HA       PRO  58 -23.319  -4.369   3.054
    2    HB2  PRO  58           HB2      PRO  58 -22.549  -6.946   3.674
    3    HB3  PRO  58           HB3      PRO  58 -23.932  -6.590   2.640
    4    HG2  PRO  58           HG2      PRO  58 -21.163  -7.371   1.896
    5    HG3  PRO  58           HG3      PRO  58 -22.699  -7.888   1.201
    6    HD2  PRO  58           HD2      PRO  58 -21.139  -6.015   0.000
    7    HD3  PRO  58           HD3      PRO  58 -22.899  -5.993  -0.128

  No H/Q in entry =           7
  In of MODEL   42
    1    H    GLN  59           H        GLN  59 -19.925  -4.718   2.497
    2    HA   GLN  59           HA       GLN  59 -19.210  -4.706   5.269
    3    HB2  GLN  59           HB2      GLN  59 -17.674  -3.936   2.790
    4    HB3  GLN  59           HB3      GLN  59 -16.991  -3.843   4.401
    5    HG2  GLN  59           HG2      GLN  59 -17.986  -6.328   3.018
    6    HG3  GLN  59           HG3      GLN  59 -16.308  -5.883   3.284
    7   HE21  GLN  59          HE21      GLN  59 -18.406  -7.752   4.252
    8   HE22  GLN  59          HE22      GLN  59 -18.227  -8.243   5.831

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ILE  60           H        ILE  60 -20.204  -2.193   3.043
    2    HA   ILE  60           HA       ILE  60 -19.454  -0.204   5.099
    3    HB   ILE  60           HB       ILE  60 -19.726   1.514   3.264
    4   HG12  ILE  60          HG12      ILE  60 -19.399  -0.701   1.286
    5   HG13  ILE  60          HG13      ILE  60 -21.018  -0.241   1.812
    6   HG23  ILE  60          HG21      ILE  60 -17.561   1.088   2.259
    7   HG22  ILE  60          HG22      ILE  60 -17.615  -0.575   2.842
    8   HG21  ILE  60          HG23      ILE  60 -17.552   0.760   3.992
    9   HD11  ILE  60          HD11      ILE  60 -20.212   2.183   1.194
   10   HD13  ILE  60          HD12      ILE  60 -20.758   1.082  -0.070
   11   HD12  ILE  60          HD13      ILE  60 -19.033   1.321   0.205

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ALA  61           H        ALA  61 -21.851  -1.877   5.134
    2    HA   ALA  61           HA       ALA  61 -24.128  -0.295   4.639
    3    HB1  ALA  61           HB1      ALA  61 -25.308  -1.827   5.950
    4    HB2  ALA  61           HB2      ALA  61 -23.912  -2.164   6.974
    5    HB3  ALA  61           HB3      ALA  61 -23.961  -2.775   5.320

  No H/Q in entry =           5
  In of MODEL   42
    1    H    TYR  62           H        TYR  62 -21.960  -0.324   7.470
    2    HA   TYR  62           HA       TYR  62 -23.598   1.278   9.115
    3    HB2  TYR  62           HB2      TYR  62 -21.607   1.760  10.389
    4    HB3  TYR  62           HB3      TYR  62 -21.569   0.068   9.897
    5    HD1  TYR  62           HD1      TYR  62 -19.907  -0.729   8.269
    6    HD2  TYR  62           HD2      TYR  62 -19.963   3.361   9.506
    7    HE1  TYR  62           HE1      TYR  62 -17.688  -0.395   7.247
    8    HE2  TYR  62           HE2      TYR  62 -17.730   3.690   8.486
    9    HH   TYR  62           HH       TYR  62 -16.093   1.006   6.844

  No H/Q in entry =           9
  In of MODEL   42
    1    H    MET  63           H        MET  63 -21.946   2.191   6.282
    2    HA   MET  63           HA       MET  63 -21.890   5.029   6.974
    3    HB2  MET  63           HB2      MET  63 -21.192   3.527   4.450
    4    HB3  MET  63           HB3      MET  63 -21.064   5.278   4.632
    5    HG2  MET  63           HG2      MET  63 -19.378   4.977   6.360
    6    HG3  MET  63           HG3      MET  63 -19.506   3.227   6.182
    7    HE2  MET  63           HE1      MET  63 -16.627   3.314   5.443
    8    HE1  MET  63           HE2      MET  63 -17.034   4.930   6.018
    9    HE3  MET  63           HE3      MET  63 -16.164   4.730   4.496

  No H/Q in entry =           9
  In of MODEL   42
    1    H    LEU  64           H        LEU  64 -24.373   3.083   5.974
    2    HA   LEU  64           HA       LEU  64 -25.601   4.455   3.876
    3    HB2  LEU  64           HB2      LEU  64 -26.408   2.321   4.785
    4    HB3  LEU  64           HB3      LEU  64 -26.916   3.148   6.257
    5    HG   LEU  64           HG       LEU  64 -28.636   4.341   5.002
    6   HD13  LEU  64          HD11      LEU  64 -28.329   4.589   2.773
    7   HD12  LEU  64          HD12      LEU  64 -28.915   2.933   2.622
    8   HD11  LEU  64          HD13      LEU  64 -27.183   3.253   2.705
    9   HD23  LEU  64          HD21      LEU  64 -29.044   1.512   4.251
   10   HD22  LEU  64          HD22      LEU  64 -30.085   2.610   5.155
   11   HD21  LEU  64          HD23      LEU  64 -28.695   1.867   5.943

  No H/Q in entry =          11
  In of MODEL   42
    1    HA   PRO  65           HA       PRO  65 -27.931   7.534   6.590
    2    HB2  PRO  65           HB2      PRO  65 -25.969   7.765   8.873
    3    HB3  PRO  65           HB3      PRO  65 -27.717   7.985   8.894
    4    HG2  PRO  65           HG2      PRO  65 -26.724   5.765   9.838
    5    HG3  PRO  65           HG3      PRO  65 -28.126   5.682   8.772
    6    HD2  PRO  65           HD2      PRO  65 -25.225   5.167   8.111
    7    HD3  PRO  65           HD3      PRO  65 -26.644   4.230   7.644

  No H/Q in entry =           7
  In of MODEL   42
    1    H    GLU  66           H        GLU  66 -24.376   7.602   6.715
    2    HA   GLU  66           HA       GLU  66 -24.170  10.408   6.310
    3    HB2  GLU  66           HB2      GLU  66 -22.270   8.164   5.689
    4    HB3  GLU  66           HB3      GLU  66 -21.875   9.870   5.485
    5    HG2  GLU  66           HG2      GLU  66 -22.133  10.236   7.849
    6    HG3  GLU  66           HG3      GLU  66 -22.604   8.552   8.075

  No H/Q in entry =           6
  In of MODEL   42
    1    H    ILE  67           H        ILE  67 -24.145   7.658   4.061
    2    HA   ILE  67           HA       ILE  67 -23.754   9.378   1.771
    3    HB   ILE  67           HB       ILE  67 -24.557   6.442   1.942
    4   HG12  ILE  67          HG12      ILE  67 -21.955   7.699   1.056
    5   HG13  ILE  67          HG13      ILE  67 -22.259   7.271   2.739
    6   HG21  ILE  67          HG21      ILE  67 -24.531   8.319  -0.284
    7   HG23  ILE  67          HG22      ILE  67 -25.100   6.650  -0.240
    8   HG22  ILE  67          HG23      ILE  67 -23.398   6.992  -0.545
    9   HD12  ILE  67          HD11      ILE  67 -21.746   5.512   0.398
   10   HD11  ILE  67          HD12      ILE  67 -22.759   4.907   1.707
   11   HD13  ILE  67          HD13      ILE  67 -21.108   5.428   2.040

  No H/Q in entry =          11
  In of MODEL   42
    1    H    GLN  68           H        GLN  68 -26.610   8.231   3.366
    2    HA   GLN  68           HA       GLN  68 -28.441   9.098   1.365
    3    HB2  GLN  68           HB2      GLN  68 -28.727   8.735   4.344
    4    HB3  GLN  68           HB3      GLN  68 -30.052   9.285   3.331
    5    HG2  GLN  68           HG2      GLN  68 -29.995   7.254   2.058
    6    HG3  GLN  68           HG3      GLN  68 -28.539   6.726   2.881
    7   HE21  GLN  68          HE21      GLN  68 -30.669   5.297   2.718
    8   HE22  GLN  68          HE22      GLN  68 -31.503   4.816   4.121

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ARG  69           H        ARG  69 -26.929  10.818   4.122
    2    HA   ARG  69           HA       ARG  69 -28.367  13.255   3.693
    3    HB2  ARG  69           HB2      ARG  69 -26.016  12.402   5.316
    4    HB3  ARG  69           HB3      ARG  69 -26.145  14.119   4.953
    5    HG2  ARG  69           HG2      ARG  69 -28.475  14.088   5.892
    6    HG3  ARG  69           HG3      ARG  69 -28.220  12.406   6.371
    7    HD2  ARG  69           HD2      ARG  69 -26.617  14.814   7.306
    8    HD3  ARG  69           HD3      ARG  69 -27.730  13.873   8.285
    9    HE   ARG  69           HE       ARG  69 -25.077  13.025   7.374
   10   HH21  ARG  69          HH11      ARG  69 -24.230  11.289   8.584
   11   HH22  ARG  69          HH12      ARG  69 -25.248  10.442   9.699
   12   HH11  ARG  69          HH21      ARG  69 -28.038  12.386   9.031
   13   HH12  ARG  69          HH22      ARG  69 -27.404  11.061   9.950

  No H/Q in entry =          13
  In of MODEL   42
    1    H    LEU  70           H        LEU  70 -25.434  11.939   2.375
    2    HA   LEU  70           HA       LEU  70 -24.379  14.336   1.220
    3    HB2  LEU  70           HB2      LEU  70 -23.321  12.052   1.832
    4    HB3  LEU  70           HB3      LEU  70 -23.899  11.565   0.238
    5    HG   LEU  70           HG       LEU  70 -22.335  12.986  -0.827
    6   HD11  LEU  70          HD11      LEU  70 -21.578  13.857   1.972
    7   HD13  LEU  70          HD12      LEU  70 -22.288  14.868   0.712
    8   HD12  LEU  70          HD13      LEU  70 -20.652  14.237   0.516
    9   HD22  LEU  70          HD21      LEU  70 -20.852  11.315  -0.572
   10   HD21  LEU  70          HD22      LEU  70 -21.781  10.766   0.823
   11   HD23  LEU  70          HD23      LEU  70 -20.433  11.880   1.045

  No H/Q in entry =          11
  In of MODEL   42
    1    H    LEU  71           H        LEU  71 -26.438  11.727   0.077
    2    HA   LEU  71           HA       LEU  71 -26.973  13.196  -2.448
    3    HB2  LEU  71           HB2      LEU  71 -27.094  10.207  -2.000
    4    HB3  LEU  71           HB3      LEU  71 -27.227  11.062  -3.536
    5    HG   LEU  71           HG       LEU  71 -24.732  11.152  -1.840
    6   HD12  LEU  71          HD11      LEU  71 -24.701   9.522  -4.271
    7   HD11  LEU  71          HD12      LEU  71 -25.711   8.869  -2.982
    8   HD13  LEU  71          HD13      LEU  71 -24.004   9.200  -2.683
    9   HD22  LEU  71          HD21      LEU  71 -24.868  12.963  -3.338
   10   HD21  LEU  71          HD22      LEU  71 -25.316  11.906  -4.675
   11   HD23  LEU  71          HD23      LEU  71 -23.701  11.808  -3.975

  No H/Q in entry =          11
  In of MODEL   42
    1    HA   PRO  72           HA       PRO  72 -30.860  12.635   0.120
    2    HB2  PRO  72           HB2      PRO  72 -31.790  15.170   0.024
    3    HB3  PRO  72           HB3      PRO  72 -30.484  14.757   1.134
    4    HG2  PRO  72           HG2      PRO  72 -30.295  15.954  -1.618
    5    HG3  PRO  72           HG3      PRO  72 -29.565  16.529  -0.119
    6    HD2  PRO  72           HD2      PRO  72 -28.158  15.008  -1.865
    7    HD3  PRO  72           HD3      PRO  72 -27.923  14.851  -0.125

  No H/Q in entry =           7
  In of MODEL   42
    1    H    ASN  73           H        ASN  73 -30.219  13.605  -3.087
    2    HA   ASN  73           HA       ASN  73 -33.061  13.214  -3.757
    3    HB2  ASN  73           HB2      ASN  73 -32.598  14.332  -5.849
    4    HB3  ASN  73           HB3      ASN  73 -32.122  15.327  -4.482
    5   HD21  ASN  73          HD21      ASN  73 -31.291  15.392  -7.148
    6   HD22  ASN  73          HD22      ASN  73 -29.617  15.278  -7.318

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LYS  74           H        LYS  74 -31.023  11.016  -3.303
    2    HA   LYS  74           HA       LYS  74 -31.516   9.604  -5.856
    3    HB2  LYS  74           HB2      LYS  74 -29.000   9.383  -4.200
    4    HB3  LYS  74           HB3      LYS  74 -29.339   8.559  -5.723
    5    HG2  LYS  74           HG2      LYS  74 -29.160  11.536  -5.520
    6    HG3  LYS  74           HG3      LYS  74 -27.752  10.511  -5.805
    7    HD2  LYS  74           HD2      LYS  74 -28.817   9.551  -7.762
    8    HD3  LYS  74           HD3      LYS  74 -30.267  10.509  -7.463
    9    HE2  LYS  74           HE2      LYS  74 -29.091  12.548  -7.890
   10    HE3  LYS  74           HE3      LYS  74 -27.546  11.700  -7.960
   11    HZ2  LYS  74           HZ1      LYS  74 -29.003  12.260 -10.106
   12    HZ1  LYS  74           HZ2      LYS  74 -29.621  10.721  -9.740
   13    HZ3  LYS  74           HZ3      LYS  74 -27.957  10.926 -10.014

  No H/Q in entry =          13
  In of MODEL   42
    1    HA   PRO  75           HA       PRO  75 -32.870   6.584  -2.901
    2    HB2  PRO  75           HB2      PRO  75 -33.098   4.357  -4.485
    3    HB3  PRO  75           HB3      PRO  75 -34.259   5.681  -4.571
    4    HG2  PRO  75           HG2      PRO  75 -31.882   5.146  -6.309
    5    HG3  PRO  75           HG3      PRO  75 -33.536   5.538  -6.780
    6    HD2  PRO  75           HD2      PRO  75 -31.646   7.455  -6.712
    7    HD3  PRO  75           HD3      PRO  75 -33.295   7.811  -6.197

  No H/Q in entry =           7
  In of MODEL   42
    1    H    VAL  76           H        VAL  76 -31.409   5.570  -1.506
    2    HA   VAL  76           HA       VAL  76 -28.897   4.426  -2.577
    3    HB   VAL  76           HB       VAL  76 -29.261   5.887   0.074
    4   HG11  VAL  76          HG11      VAL  76 -26.853   4.661  -1.283
    5   HG13  VAL  76          HG12      VAL  76 -27.558   4.194   0.265
    6   HG12  VAL  76          HG13      VAL  76 -26.751   5.753   0.100
    7   HG22  VAL  76          HG21      VAL  76 -28.632   7.804  -0.807
    8   HG21  VAL  76          HG22      VAL  76 -29.135   7.093  -2.341
    9   HG23  VAL  76          HG23      VAL  76 -27.437   7.050  -1.863

  No H/Q in entry =           9
  In of MODEL   42
    1    H    GLU  77           H        GLU  77 -28.632   2.279  -1.959
    2    HA   GLU  77           HA       GLU  77 -29.434   1.473   0.685
    3    HB2  GLU  77           HB2      GLU  77 -30.989  -0.217   0.135
    4    HB3  GLU  77           HB3      GLU  77 -31.569   1.290  -0.577
    5    HG2  GLU  77           HG2      GLU  77 -30.909   0.547  -2.755
    6    HG3  GLU  77           HG3      GLU  77 -30.237  -0.932  -2.071

  No H/Q in entry =           6
  In of MODEL   42
    1    H    VAL  78           H        VAL  78 -29.061  -0.603   1.353
    2    HA   VAL  78           HA       VAL  78 -26.362  -1.303   0.503
    3    HB   VAL  78           HB       VAL  78 -28.080  -2.230   2.845
    4   HG11  VAL  78          HG11      VAL  78 -25.692  -3.397   1.756
    5   HG13  VAL  78          HG12      VAL  78 -26.607  -3.890   3.182
    6   HG12  VAL  78          HG13      VAL  78 -25.321  -2.694   3.330
    7   HG22  VAL  78          HG21      VAL  78 -26.676  -0.827   4.203
    8   HG21  VAL  78          HG22      VAL  78 -27.420   0.122   2.915
    9   HG23  VAL  78          HG23      VAL  78 -25.728  -0.361   2.790

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ILE  79           H        ILE  79 -25.761  -3.197  -0.391
    2    HA   ILE  79           HA       ILE  79 -27.762  -4.732  -1.766
    3    HB   ILE  79           HB       ILE  79 -24.761  -5.177  -1.501
    4   HG12  ILE  79          HG12      ILE  79 -26.394  -4.121  -3.814
    5   HG13  ILE  79          HG13      ILE  79 -25.564  -3.086  -2.650
    6   HG22  ILE  79          HG21      ILE  79 -25.798  -6.390  -3.834
    7   HG21  ILE  79          HG22      ILE  79 -26.788  -6.936  -2.480
    8   HG23  ILE  79          HG23      ILE  79 -25.040  -7.167  -2.443
    9   HD13  ILE  79          HD11      ILE  79 -24.122  -3.164  -4.448
   10   HD12  ILE  79          HD12      ILE  79 -24.411  -4.881  -4.731
   11   HD11  ILE  79          HD13      ILE  79 -23.461  -4.364  -3.337

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ASP  80           H        ASP  80 -28.582  -6.678  -1.192
    2    HA   ASP  80           HA       ASP  80 -28.542  -7.572   1.457
    3    HB2  ASP  80           HB2      ASP  80 -30.256  -8.198  -0.206
    4    HB3  ASP  80           HB3      ASP  80 -29.059  -9.175  -1.056

  No H/Q in entry =           4
  In of MODEL   42
    1    H    SER  81           H        SER  81 -26.993  -8.663   2.611
    2    HA   SER  81           HA       SER  81 -24.461  -9.279   1.456
    3    HB2  SER  81           HB2      SER  81 -23.910 -10.284   3.635
    4    HB3  SER  81           HB3      SER  81 -24.667  -8.705   3.837
    5    HG   SER  81           HG       SER  81 -26.651  -9.870   4.154

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU  82           H        LEU  82 -27.119 -11.443   1.744
    2    HA   LEU  82           HA       LEU  82 -25.501 -13.769   1.250
    3    HB2  LEU  82           HB2      LEU  82 -28.448 -13.230   0.955
    4    HB3  LEU  82           HB3      LEU  82 -27.701 -14.814   0.751
    5    HG   LEU  82           HG       LEU  82 -27.723 -13.237   3.307
    6   HD13  LEU  82          HD11      LEU  82 -29.965 -13.965   2.800
    7   HD12  LEU  82          HD12      LEU  82 -29.302 -15.064   4.011
    8   HD11  LEU  82          HD13      LEU  82 -29.388 -15.562   2.322
    9   HD23  LEU  82          HD21      LEU  82 -27.054 -15.611   4.101
   10   HD22  LEU  82          HD22      LEU  82 -25.829 -14.610   3.322
   11   HD21  LEU  82          HD23      LEU  82 -26.633 -15.888   2.410

  No H/Q in entry =          11
  In of MODEL   42
    1    H    LEU  83           H        LEU  83 -27.491 -11.601  -0.701
    2    HA   LEU  83           HA       LEU  83 -27.218 -12.957  -3.166
    3    HB2  LEU  83           HB2      LEU  83 -27.716 -10.061  -2.531
    4    HB3  LEU  83           HB3      LEU  83 -27.706 -10.708  -4.170
    5    HG   LEU  83           HG       LEU  83 -29.760 -11.146  -2.022
    6   HD13  LEU  83          HD11      LEU  83 -30.550  -9.322  -3.100
    7   HD12  LEU  83          HD12      LEU  83 -30.965 -10.449  -4.390
    8   HD11  LEU  83          HD13      LEU  83 -29.454  -9.543  -4.463
    9   HD23  LEU  83          HD21      LEU  83 -29.826 -12.413  -4.746
   10   HD22  LEU  83          HD22      LEU  83 -30.806 -12.787  -3.329
   11   HD21  LEU  83          HD23      LEU  83 -29.105 -13.244  -3.368

  No H/Q in entry =          11
  In of MODEL   42
    1    H    TYR  84           H        TYR  84 -25.354 -10.517  -1.468
    2    HA   TYR  84           HA       TYR  84 -23.475  -9.983  -3.573
    3    HB2  TYR  84           HB2      TYR  84 -24.064  -8.509  -1.558
    4    HB3  TYR  84           HB3      TYR  84 -23.023  -9.579  -0.620
    5    HD1  TYR  84           HD1      TYR  84 -20.636 -10.001  -1.851
    6    HD2  TYR  84           HD2      TYR  84 -23.093  -6.534  -2.283
    7    HE1  TYR  84           HE1      TYR  84 -18.658  -8.704  -2.567
    8    HE2  TYR  84           HE2      TYR  84 -21.126  -5.229  -3.011
    9    HH   TYR  84           HH       TYR  84 -18.033  -6.170  -2.494

  No H/Q in entry =           9
  In of MODEL   42
    1    H    GLY  85           H        GLY  85 -23.224 -11.972  -0.619
    2    HA3  GLY  85           HA2      GLY  85 -20.614 -12.847  -1.063
    3    HA2  GLY  85           HA3      GLY  85 -21.835 -13.725  -0.141

  No H/Q in entry =           3
  In of MODEL   42
    1    H    LYS  86           H        LYS  86 -23.642 -14.151  -2.226
    2    HA   LYS  86           HA       LYS  86 -22.507 -16.499  -3.465
    3    HB2  LYS  86           HB2      LYS  86 -24.966 -15.687  -2.574
    4    HB3  LYS  86           HB3      LYS  86 -25.136 -15.517  -4.319
    5    HG2  LYS  86           HG2      LYS  86 -24.404 -18.032  -2.866
    6    HG3  LYS  86           HG3      LYS  86 -25.985 -17.636  -3.541
    7    HD2  LYS  86           HD2      LYS  86 -24.909 -17.348  -5.766
    8    HD3  LYS  86           HD3      LYS  86 -23.384 -17.881  -5.061
    9    HE2  LYS  86           HE2      LYS  86 -24.361 -20.036  -4.515
   10    HE3  LYS  86           HE3      LYS  86 -25.923 -19.506  -5.138
   11    HZ2  LYS  86           HZ1      LYS  86 -24.162 -20.816  -6.613
   12    HZ1  LYS  86           HZ2      LYS  86 -23.641 -19.230  -6.929
   13    HZ3  LYS  86           HZ3      LYS  86 -25.241 -19.681  -7.271

  No H/Q in entry =          13
  In of MODEL   42
    1    H    VAL  87           H        VAL  87 -22.570 -13.286  -4.367
    2    HA   VAL  87           HA       VAL  87 -22.275 -12.109  -6.306
    3    HB   VAL  87           HB       VAL  87 -20.912 -14.719  -7.086
    4   HG11  VAL  87          HG11      VAL  87 -21.565 -12.322  -8.708
    5   HG13  VAL  87          HG12      VAL  87 -21.242 -13.977  -9.226
    6   HG12  VAL  87          HG13      VAL  87 -19.904 -12.900  -8.830
    7   HG23  VAL  87          HG21      VAL  87 -18.870 -13.295  -6.910
    8   HG22  VAL  87          HG22      VAL  87 -19.719 -13.548  -5.387
    9   HG21  VAL  87          HG23      VAL  87 -19.886 -12.018  -6.244

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ASP  88           H        ASP  88 -24.777 -12.818  -5.988
    2    HA   ASP  88           HA       ASP  88 -25.833 -14.070  -8.398
    3    HB2  ASP  88           HB2      ASP  88 -26.853 -14.337  -6.087
    4    HB3  ASP  88           HB3      ASP  88 -27.350 -12.649  -6.196

  No H/Q in entry =           4
  In of MODEL   42
    1    H    GLY  89           H        GLY  89 -25.140 -12.797 -10.033
    2    HA3  GLY  89           HA2      GLY  89 -25.394 -10.031 -10.243
    3    HA2  GLY  89           HA3      GLY  89 -25.321 -11.154 -11.600

  No H/Q in entry =           3
  In of MODEL   42
    1    H    LEU  90           H        LEU  90 -27.735 -12.571 -11.182
    2    HA   LEU  90           HA       LEU  90 -29.583 -10.689 -12.325
    3    HB2  LEU  90           HB2      LEU  90 -29.574 -13.087 -12.899
    4    HB3  LEU  90           HB3      LEU  90 -30.092 -13.464 -11.256
    5    HG   LEU  90           HG       LEU  90 -32.236 -12.406 -11.650
    6   HD13  LEU  90          HD11      LEU  90 -32.085 -10.664 -13.128
    7   HD12  LEU  90          HD12      LEU  90 -32.574 -11.919 -14.269
    8   HD11  LEU  90          HD13      LEU  90 -30.874 -11.477 -14.122
    9   HD23  LEU  90          HD21      LEU  90 -32.089 -14.039 -14.081
   10   HD22  LEU  90          HD22      LEU  90 -33.083 -14.228 -12.637
   11   HD21  LEU  90          HD23      LEU  90 -31.412 -14.795 -12.637

  No H/Q in entry =          11
  In of MODEL   42
    1    H    GLY  91           H        GLY  91 -29.416 -12.177  -9.134
    2    HA3  GLY  91           HA2      GLY  91 -31.800 -11.128  -8.129
    3    HA2  GLY  91           HA3      GLY  91 -30.406 -11.620  -7.167

  No H/Q in entry =           3
  In of MODEL   42
    1    H    VAL  92           H        VAL  92 -28.527  -9.743  -8.002
    2    HA   VAL  92           HA       VAL  92 -29.403  -7.461  -6.470
    3    HB   VAL  92           HB       VAL  92 -26.824  -7.863  -8.030
    4   HG12  VAL  92          HG11      VAL  92 -27.072  -5.978  -5.711
    5   HG11  VAL  92          HG12      VAL  92 -27.732  -5.457  -7.263
    6   HG13  VAL  92          HG13      VAL  92 -26.025  -5.877  -7.127
    7   HG22  VAL  92          HG21      VAL  92 -26.578  -9.440  -6.430
    8   HG21  VAL  92          HG22      VAL  92 -27.759  -8.690  -5.355
    9   HG23  VAL  92          HG23      VAL  92 -26.121  -8.043  -5.455

  No H/Q in entry =           9
  In of MODEL   42
    1    H    LEU  93           H        LEU  93 -28.932  -8.119  -9.883
    2    HA   LEU  93           HA       LEU  93 -29.339  -5.497 -10.824
    3    HB2  LEU  93           HB2      LEU  93 -28.626  -7.336 -12.272
    4    HB3  LEU  93           HB3      LEU  93 -30.199  -8.107 -12.068
    5    HG   LEU  93           HG       LEU  93 -31.249  -6.176 -13.211
    6   HD11  LEU  93          HD11      LEU  93 -29.451  -4.528 -12.687
    7   HD13  LEU  93          HD12      LEU  93 -29.866  -4.574 -14.401
    8   HD12  LEU  93          HD13      LEU  93 -28.400  -5.367 -13.828
    9   HD23  LEU  93          HD21      LEU  93 -30.165  -6.719 -15.483
   10   HD22  LEU  93          HD22      LEU  93 -30.983  -7.997 -14.585
   11   HD21  LEU  93          HD23      LEU  93 -29.222  -7.891 -14.564

  No H/Q in entry =          11
  In of MODEL   42
    1    H    LYS  94           H        LYS  94 -31.653  -8.106 -10.000
    2    HA   LYS  94           HA       LYS  94 -34.027  -6.733 -10.659
    3    HB2  LYS  94           HB2      LYS  94 -33.480  -8.897  -8.634
    4    HB3  LYS  94           HB3      LYS  94 -35.093  -8.248  -8.925
    5    HG2  LYS  94           HG2      LYS  94 -34.954  -9.025 -11.256
    6    HG3  LYS  94           HG3      LYS  94 -33.376  -9.731 -10.906
    7    HD2  LYS  94           HD2      LYS  94 -34.483 -11.092  -9.092
    8    HD3  LYS  94           HD3      LYS  94 -36.036 -10.490  -9.669
    9    HE2  LYS  94           HE2      LYS  94 -35.466 -11.409 -11.926
   10    HE3  LYS  94           HE3      LYS  94 -34.039 -12.151 -11.202
   11    HZ3  LYS  94           HZ1      LYS  94 -35.843 -13.724 -11.392
   12    HZ2  LYS  94           HZ2      LYS  94 -36.857 -12.723 -10.466
   13    HZ1  LYS  94           HZ3      LYS  94 -35.487 -13.431  -9.758

  No H/Q in entry =          13
  In of MODEL   42
    1    H    ALA  95           H        ALA  95 -32.242  -6.795  -7.586
    2    HA   ALA  95           HA       ALA  95 -34.154  -5.264  -6.136
    3    HB2  ALA  95           HB1      ALA  95 -31.749  -6.570  -5.564
    4    HB3  ALA  95           HB2      ALA  95 -32.767  -5.690  -4.425
    5    HB1  ALA  95           HB3      ALA  95 -31.431  -4.868  -5.231

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA  96           H        ALA  96 -31.510  -4.341  -8.199
    2    HA   ALA  96           HA       ALA  96 -31.500  -1.577  -7.432
    3    HB2  ALA  96           HB1      ALA  96 -30.117  -1.317  -9.524
    4    HB3  ALA  96           HB2      ALA  96 -30.369  -3.033  -9.843
    5    HB1  ALA  96           HB3      ALA  96 -29.488  -2.525  -8.403

  No H/Q in entry =           5
  In of MODEL   42
    1    H    VAL  97           H        VAL  97 -32.949  -3.338 -10.134
    2    HA   VAL  97           HA       VAL  97 -34.065  -1.071 -11.409
    3    HB   VAL  97           HB       VAL  97 -34.794  -4.018 -11.455
    4   HG11  VAL  97          HG11      VAL  97 -36.633  -2.062 -11.969
    5   HG13  VAL  97          HG12      VAL  97 -36.639  -3.657 -12.723
    6   HG12  VAL  97          HG13      VAL  97 -35.912  -2.289 -13.563
    7   HG21  VAL  97          HG21      VAL  97 -33.538  -2.160 -13.478
    8   HG23  VAL  97          HG22      VAL  97 -33.941  -3.852 -13.769
    9   HG22  VAL  97          HG23      VAL  97 -32.719  -3.430 -12.568

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ALA  98           H        ALA  98 -35.222  -3.276  -8.883
    2    HA   ALA  98           HA       ALA  98 -37.817  -2.195  -8.568
    3    HB1  ALA  98           HB1      ALA  98 -36.759  -4.365  -7.517
    4    HB3  ALA  98           HB2      ALA  98 -37.975  -3.470  -6.604
    5    HB2  ALA  98           HB3      ALA  98 -36.264  -3.275  -6.222

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA  99           H        ALA  99 -34.781  -1.313  -6.883
    2    HA   ALA  99           HA       ALA  99 -35.983   0.644  -5.240
    3    HB1  ALA  99           HB1      ALA  99 -33.303  -0.178  -5.951
    4    HB2  ALA  99           HB2      ALA  99 -33.892   0.561  -4.461
    5    HB3  ALA  99           HB3      ALA  99 -33.424   1.577  -5.824

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ILE 100           H        ILE 100 -34.903   0.796  -8.582
    2    HA   ILE 100           HA       ILE 100 -35.151   3.638  -8.809
    3    HB   ILE 100           HB       ILE 100 -35.165   1.479 -10.945
    4   HG12  ILE 100          HG12      ILE 100 -33.061   3.526 -10.250
    5   HG13  ILE 100          HG13      ILE 100 -33.063   1.880  -9.617
    6   HG21  ILE 100          HG21      ILE 100 -35.659   4.387 -11.087
    7   HG23  ILE 100          HG22      ILE 100 -36.118   3.104 -12.207
    8   HG22  ILE 100          HG23      ILE 100 -34.481   3.761 -12.241
    9   HD12  ILE 100          HD11      ILE 100 -32.520   2.847 -12.385
   10   HD11  ILE 100          HD12      ILE 100 -33.142   1.215 -12.136
   11   HD13  ILE 100          HD13      ILE 100 -31.617   1.699 -11.398

  No H/Q in entry =          11
  In of MODEL   42
    1    H    LYS 101           H        LYS 101 -37.368   0.971  -9.560
    2    HA   LYS 101           HA       LYS 101 -39.477   2.566 -10.590
    3    HB2  LYS 101           HB2      LYS 101 -39.307  -0.203  -9.456
    4    HB3  LYS 101           HB3      LYS 101 -40.873   0.519  -9.823
    5    HG2  LYS 101           HG2      LYS 101 -40.372   0.662 -12.114
    6    HG3  LYS 101           HG3      LYS 101 -38.670   0.301 -11.837
    7    HD2  LYS 101           HD2      LYS 101 -39.860  -1.640 -12.736
    8    HD3  LYS 101           HD3      LYS 101 -39.246  -1.952 -11.113
    9    HE2  LYS 101           HE2      LYS 101 -41.297  -2.698 -10.631
   10    HE3  LYS 101           HE3      LYS 101 -41.796  -1.006 -10.643
   11    HZ3  LYS 101           HZ1      LYS 101 -42.656  -1.188 -12.772
   12    HZ2  LYS 101           HZ2      LYS 101 -43.089  -2.671 -12.068
   13    HZ1  LYS 101           HZ3      LYS 101 -41.770  -2.591 -13.135

  No H/Q in entry =          13
  In of MODEL   42
    1    H    LYS 102           H        LYS 102 -38.991   1.105  -7.372
    2    HA   LYS 102           HA       LYS 102 -41.284   2.245  -6.206
    3    HB2  LYS 102           HB2      LYS 102 -40.014   0.412  -5.173
    4    HB3  LYS 102           HB3      LYS 102 -38.653   1.502  -4.912
    5    HG2  LYS 102           HG2      LYS 102 -40.024   2.864  -3.434
    6    HG3  LYS 102           HG3      LYS 102 -41.388   1.778  -3.697
    7    HD2  LYS 102           HD2      LYS 102 -40.129  -0.056  -2.652
    8    HD3  LYS 102           HD3      LYS 102 -38.766   1.032  -2.388
    9    HE2  LYS 102           HE2      LYS 102 -40.174   2.477  -0.999
   10    HE3  LYS 102           HE3      LYS 102 -41.557   1.419  -1.285
   11    HZ1  LYS 102           HZ1      LYS 102 -39.806  -0.290  -0.257
   12    HZ3  LYS 102           HZ2      LYS 102 -40.950   0.568   0.658
   13    HZ2  LYS 102           HZ3      LYS 102 -39.352   1.133   0.551

  No H/Q in entry =          13
  In of MODEL   42
    1    H    ALA 103           H        ALA 103 -38.352   3.710  -7.182
    2    HA   ALA 103           HA       ALA 103 -38.656   6.019  -5.406
    3    HB2  ALA 103           HB1      ALA 103 -36.663   6.801  -6.956
    4    HB3  ALA 103           HB2      ALA 103 -36.579   5.085  -7.351
    5    HB1  ALA 103           HB3      ALA 103 -36.387   5.616  -5.680

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA 104           H        ALA 104 -39.214   5.270  -8.758
    2    HA   ALA 104           HA       ALA 104 -39.861   8.039  -9.392
    3    HB2  ALA 104           HB1      ALA 104 -39.857   7.368 -11.594
    4    HB1  ALA 104           HB2      ALA 104 -40.550   5.789 -11.223
    5    HB3  ALA 104           HB3      ALA 104 -38.838   6.095 -10.922

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA 105           H        ALA 105 -41.440   5.896  -7.606
    2    HA   ALA 105           HA       ALA 105 -43.898   7.228  -7.614
    3    HB2  ALA 105           HB1      ALA 105 -44.594   6.349  -9.661
    4    HB3  ALA 105           HB2      ALA 105 -45.215   5.145  -8.531
    5    HB1  ALA 105           HB3      ALA 105 -43.725   4.833  -9.421

  No H/Q in entry =           5
  In of MODEL   43
    1    H1   ALA   1           H3       ALA   1 -12.036 -16.260  -2.473
    2    H2   ALA   1           H2       ALA   1 -11.069 -17.390  -3.300
    3    H3   ALA   1           H1       ALA   1 -12.222 -16.470  -4.147
    4    HA   ALA   1           HA       ALA   1 -13.593 -18.193  -3.908
    5    HB3  ALA   1           HB1      ALA   1 -12.170 -19.938  -3.426
    6    HB1  ALA   1           HB2      ALA   1 -12.940 -19.830  -1.843
    7    HB2  ALA   1           HB3      ALA   1 -11.375 -19.063  -2.117

  No H/Q in entry =           7
  In of MODEL   43
    1    H    GLU   2           H        GLU   2 -15.213 -19.067  -2.261
    2    HA   GLU   2           HA       GLU   2 -16.899 -17.369  -1.224
    3    HB2  GLU   2           HB2      GLU   2 -15.929 -19.769   0.341
    4    HB3  GLU   2           HB3      GLU   2 -17.469 -18.944   0.579
    5    HG2  GLU   2           HG2      GLU   2 -18.417 -20.057  -1.156
    6    HG3  GLU   2           HG3      GLU   2 -17.093 -19.640  -2.233

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLU   3           H        GLU   3 -14.983 -18.674   1.421
    2    HA   GLU   3           HA       GLU   3 -15.256 -16.316   2.963
    3    HB2  GLU   3           HB2      GLU   3 -13.629 -18.834   3.240
    4    HB3  GLU   3           HB3      GLU   3 -13.429 -17.504   4.381
    5    HG2  GLU   3           HG2      GLU   3 -15.625 -17.689   5.184
    6    HG3  GLU   3           HG3      GLU   3 -16.196 -18.507   3.735

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LEU   4           H        LEU   4 -12.266 -17.752   1.602
    2    HA   LEU   4           HA       LEU   4 -10.469 -15.814   2.203
    3    HB2  LEU   4           HB2      LEU   4 -10.657 -17.130  -0.516
    4    HB3  LEU   4           HB3      LEU   4  -9.223 -16.381   0.175
    5    HG   LEU   4           HG       LEU   4 -10.684 -18.798   1.291
    6   HD13  LEU   4          HD11      LEU   4  -9.022 -20.130   0.381
    7   HD12  LEU   4          HD12      LEU   4  -7.834 -18.827   0.356
    8   HD11  LEU   4          HD13      LEU   4  -9.113 -18.878  -0.856
    9   HD23  LEU   4          HD21      LEU   4  -8.443 -18.815   2.689
   10   HD22  LEU   4          HD22      LEU   4  -9.785 -17.795   3.203
   11   HD21  LEU   4          HD23      LEU   4  -8.428 -17.088   2.327

  No H/Q in entry =          11
  In of MODEL   43
    1    H    GLU   5           H        GLU   5 -12.787 -15.662  -0.489
    2    HA   GLU   5           HA       GLU   5 -11.819 -13.167  -1.497
    3    HB2  GLU   5           HB2      GLU   5 -13.124 -14.779  -2.863
    4    HB3  GLU   5           HB3      GLU   5 -14.538 -14.445  -1.863
    5    HG2  GLU   5           HG2      GLU   5 -14.461 -12.077  -2.509
    6    HG3  GLU   5           HG3      GLU   5 -13.021 -12.380  -3.482

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLU   6           H        GLU   6 -14.544 -14.080   0.580
    2    HA   GLU   6           HA       GLU   6 -15.497 -11.417   0.957
    3    HB2  GLU   6           HB2      GLU   6 -16.892 -13.432   1.357
    4    HB3  GLU   6           HB3      GLU   6 -15.864 -13.849   2.727
    5    HG2  GLU   6           HG2      GLU   6 -16.439 -11.732   3.828
    6    HG3  GLU   6           HG3      GLU   6 -17.438 -11.273   2.451

  No H/Q in entry =           6
  In of MODEL   43
    1    H    VAL   7           H        VAL   7 -13.167 -13.479   2.558
    2    HA   VAL   7           HA       VAL   7 -12.745 -11.884   4.880
    3    HB   VAL   7           HB       VAL   7 -10.996 -13.906   3.455
    4   HG11  VAL   7          HG11      VAL   7 -10.573 -12.351   6.013
    5   HG13  VAL   7          HG12      VAL   7  -9.459 -12.554   4.662
    6   HG12  VAL   7          HG13      VAL   7  -9.797 -13.911   5.737
    7   HG21  VAL   7          HG21      VAL   7 -13.246 -14.502   4.661
    8   HG23  VAL   7          HG22      VAL   7 -12.335 -14.204   6.142
    9   HG22  VAL   7          HG23      VAL   7 -11.812 -15.461   5.023

  No H/Q in entry =           9
  In of MODEL   43
    1    H    VAL   8           H        VAL   8 -11.207 -11.991   1.682
    2    HA   VAL   8           HA       VAL   8  -9.180 -10.080   2.180
    3    HB   VAL   8           HB       VAL   8 -10.611 -10.816  -0.385
    4   HG12  VAL   8          HG11      VAL   8  -8.540  -9.747  -1.434
    5   HG11  VAL   8          HG12      VAL   8  -8.227  -9.025   0.146
    6   HG13  VAL   8          HG13      VAL   8  -9.708  -8.628  -0.726
    7   HG22  VAL   8          HG21      VAL   8  -9.061 -12.505  -0.604
    8   HG21  VAL   8          HG22      VAL   8  -8.881 -12.326   1.140
    9   HG23  VAL   8          HG23      VAL   8  -7.754 -11.518   0.053

  No H/Q in entry =           9
  In of MODEL   43
    1    H    MET   9           H        MET   9 -12.523  -9.754   0.992
    2    HA   MET   9           HA       MET   9 -12.503  -6.979   0.542
    3    HB2  MET   9           HB2      MET   9 -14.656  -8.941   1.281
    4    HB3  MET   9           HB3      MET   9 -15.013  -7.213   1.227
    5    HG2  MET   9           HG2      MET   9 -13.927  -7.244  -1.109
    6    HG3  MET   9           HG3      MET   9 -14.078  -9.000  -1.017
    7    HE3  MET   9           HE1      MET   9 -17.635  -9.878  -1.190
    8    HE2  MET   9           HE2      MET   9 -16.856  -9.684   0.378
    9    HE1  MET   9           HE3      MET   9 -15.932 -10.314  -0.983

  No H/Q in entry =           9
  In of MODEL   43
    1    H    GLY  10           H        GLY  10 -13.156  -8.865   3.475
    2    HA3  GLY  10           HA2      GLY  10 -13.755  -6.680   5.177
    3    HA2  GLY  10           HA3      GLY  10 -13.168  -8.256   5.704

  No H/Q in entry =           3
  In of MODEL   43
    1    H    LEU  11           H        LEU  11 -10.710  -8.345   4.409
    2    HA   LEU  11           HA       LEU  11  -9.049  -6.873   6.170
    3    HB2  LEU  11           HB2      LEU  11  -8.457  -8.301   3.575
    4    HB3  LEU  11           HB3      LEU  11  -7.207  -7.569   4.579
    5    HG   LEU  11           HG       LEU  11  -9.181  -9.631   5.592
    6   HD13  LEU  11          HD11      LEU  11  -7.926 -10.855   4.044
    7   HD12  LEU  11          HD12      LEU  11  -6.998 -11.069   5.528
    8   HD11  LEU  11          HD13      LEU  11  -6.469  -9.901   4.318
    9   HD22  LEU  11          HD21      LEU  11  -8.361  -8.592   7.510
   10   HD21  LEU  11          HD22      LEU  11  -6.824  -8.168   6.756
   11   HD23  LEU  11          HD23      LEU  11  -7.125  -9.827   7.273

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  12           H        ILE  12  -9.934  -6.361   2.771
    2    HA   ILE  12           HA       ILE  12  -8.278  -4.103   2.344
    3    HB   ILE  12           HB       ILE  12 -10.903  -4.851   1.033
    4   HG12  ILE  12          HG12      ILE  12  -8.829  -6.436   0.957
    5   HG13  ILE  12          HG13      ILE  12  -9.659  -6.074  -0.543
    6   HG22  ILE  12          HG21      ILE  12 -10.031  -3.420  -0.849
    7   HG21  ILE  12          HG22      ILE  12  -8.754  -2.861   0.225
    8   HG23  ILE  12          HG23      ILE  12 -10.423  -2.536   0.595
    9   HD13  ILE  12          HD11      ILE  12  -7.958  -4.433  -1.111
   10   HD12  ILE  12          HD12      ILE  12  -7.168  -5.954  -0.703
   11   HD11  ILE  12          HD13      ILE  12  -7.188  -4.641   0.450

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  13           H        ILE  13 -11.642  -4.425   3.413
    2    HA   ILE  13           HA       ILE  13 -12.155  -1.645   3.663
    3    HB   ILE  13           HB       ILE  13 -13.325  -4.074   5.041
    4   HG12  ILE  13          HG12      ILE  13 -13.524  -3.547   2.485
    5   HG13  ILE  13          HG13      ILE  13 -14.933  -4.076   3.378
    6   HG21  ILE  13          HG21      ILE  13 -14.060  -1.156   5.270
    7   HG23  ILE  13          HG22      ILE  13 -13.862  -2.335   6.561
    8   HG22  ILE  13          HG23      ILE  13 -15.274  -2.410   5.510
    9   HD11  ILE  13          HD11      ILE  13 -14.274  -1.156   2.934
   10   HD13  ILE  13          HD12      ILE  13 -15.755  -1.843   3.571
   11   HD12  ILE  13          HD13      ILE  13 -15.347  -2.092   1.888

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ASN  14           H        ASN  14 -11.016  -4.102   5.961
    2    HA   ASN  14           HA       ASN  14 -10.863  -2.447   8.238
    3    HB2  ASN  14           HB2      ASN  14 -10.560  -5.051   7.933
    4    HB3  ASN  14           HB3      ASN  14  -8.857  -4.633   7.787
    5   HD21  ASN  14          HD21      ASN  14  -9.482  -6.157   9.967
    6   HD22  ASN  14          HD22      ASN  14  -9.483  -5.228  11.386

  No H/Q in entry =           6
  In of MODEL   43
    1    H    SER  15           H        SER  15  -8.427  -3.240   5.770
    2    HA   SER  15           HA       SER  15  -6.320  -1.701   6.850
    3    HB2  SER  15           HB2      SER  15  -5.279  -1.909   4.700
    4    HB3  SER  15           HB3      SER  15  -6.207  -3.386   4.928
    5    HG   SER  15           HG       SER  15  -7.300  -2.858   3.231

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLY  16           H        GLY  16  -8.920  -0.897   4.577
    2    HA3  GLY  16           HA2      GLY  16  -8.108   1.757   4.017
    3    HA2  GLY  16           HA3      GLY  16  -9.746   1.129   3.846

  No H/Q in entry =           3
  In of MODEL   43
    1    H    GLN  17           H        GLN  17 -10.296   0.409   6.495
    2    HA   GLN  17           HA       GLN  17 -11.060   2.906   7.615
    3    HB2  GLN  17           HB2      GLN  17 -10.924   0.128   8.799
    4    HB3  GLN  17           HB3      GLN  17 -11.562   1.517   9.677
    5    HG2  GLN  17           HG2      GLN  17 -13.245   1.880   7.933
    6    HG3  GLN  17           HG3      GLN  17 -12.582   0.545   6.992
    7   HE21  GLN  17          HE21      GLN  17 -15.077  -0.050   7.411
    8   HE22  GLN  17          HE22      GLN  17 -15.346  -1.041   8.763

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ALA  18           H        ALA  18  -8.392   0.681   8.269
    2    HA   ALA  18           HA       ALA  18  -7.337   1.931  10.541
    3    HB2  ALA  18           HB1      ALA  18  -6.673  -0.280   9.192
    4    HB3  ALA  18           HB2      ALA  18  -5.534   0.532  10.267
    5    HB1  ALA  18           HB3      ALA  18  -5.449   0.802   8.525

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ARG  19           H        ARG  19  -6.549   2.450   7.095
    2    HA   ARG  19           HA       ARG  19  -4.695   4.537   7.527
    3    HB2  ARG  19           HB2      ARG  19  -4.982   3.377   5.336
    4    HB3  ARG  19           HB3      ARG  19  -6.540   4.186   5.141
    5    HG2  ARG  19           HG2      ARG  19  -5.456   6.380   5.205
    6    HG3  ARG  19           HG3      ARG  19  -3.894   5.628   5.527
    7    HD2  ARG  19           HD2      ARG  19  -4.012   6.202   3.179
    8    HD3  ARG  19           HD3      ARG  19  -4.062   4.441   3.335
    9    HE   ARG  19           HE       ARG  19  -6.714   5.297   3.301
   10   HH21  ARG  19          HH11      ARG  19  -7.896   5.417   1.372
   11   HH22  ARG  19          HH12      ARG  19  -7.064   5.503  -0.141
   12   HH11  ARG  19          HH21      ARG  19  -3.924   5.404   1.289
   13   HH12  ARG  19          HH22      ARG  19  -4.813   5.493  -0.189

  No H/Q in entry =          13
  In of MODEL   43
    1    H    SER  20           H        SER  20  -8.190   4.578   6.898
    2    HA   SER  20           HA       SER  20  -8.603   7.325   6.830
    3    HB2  SER  20           HB2      SER  20 -10.451   5.950   6.287
    4    HB3  SER  20           HB3      SER  20 -10.332   5.058   7.801
    5    HG   SER  20           HG       SER  20 -11.133   6.781   8.882

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU  21           H        LEU  21  -8.581   5.160   9.647
    2    HA   LEU  21           HA       LEU  21  -9.079   7.158  11.596
    3    HB2  LEU  21           HB2      LEU  21  -7.670   4.487  11.786
    4    HB3  LEU  21           HB3      LEU  21  -8.018   5.506  13.180
    5    HG   LEU  21           HG       LEU  21 -10.145   4.550  11.242
    6   HD13  LEU  21          HD11      LEU  21 -10.687   2.815  12.835
    7   HD12  LEU  21          HD12      LEU  21  -9.479   3.413  13.970
    8   HD11  LEU  21          HD13      LEU  21  -8.971   2.677  12.449
    9   HD22  LEU  21          HD21      LEU  21 -11.080   6.368  12.391
   10   HD21  LEU  21          HD22      LEU  21 -10.160   6.058  13.860
   11   HD23  LEU  21          HD23      LEU  21 -11.528   5.035  13.451

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ALA  22           H        ALA  22  -6.087   5.838  10.221
    2    HA   ALA  22           HA       ALA  22  -4.249   7.201  11.850
    3    HB2  ALA  22           HB1      ALA  22  -3.780   5.346  10.174
    4    HB1  ALA  22           HB2      ALA  22  -2.612   6.667  10.211
    5    HB3  ALA  22           HB3      ALA  22  -3.818   6.590   8.925

  No H/Q in entry =           5
  In of MODEL   43
    1    H    TYR  23           H        TYR  23  -5.561   8.170   8.651
    2    HA   TYR  23           HA       TYR  23  -4.277  10.694   8.576
    3    HB2  TYR  23           HB2      TYR  23  -5.321   9.749   6.581
    4    HB3  TYR  23           HB3      TYR  23  -6.908   9.824   7.348
    5    HD1  TYR  23           HD1      TYR  23  -4.050  11.915   6.180
    6    HD2  TYR  23           HD2      TYR  23  -8.185  11.817   7.337
    7    HE1  TYR  23           HE1      TYR  23  -4.322  14.256   5.405
    8    HE2  TYR  23           HE2      TYR  23  -8.458  14.157   6.561
    9    HH   TYR  23           HH       TYR  23  -6.397  15.677   4.557

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ALA  24           H        ALA  24  -7.387   9.659   9.936
    2    HA   ALA  24           HA       ALA  24  -8.285  12.235  10.684
    3    HB1  ALA  24           HB1      ALA  24 -10.080  10.948  11.144
    4    HB2  ALA  24           HB2      ALA  24  -9.254  10.403  12.602
    5    HB3  ALA  24           HB3      ALA  24  -9.097   9.485  11.105

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA  25           H        ALA  25  -6.244   9.829  12.290
    2    HA   ALA  25           HA       ALA  25  -5.954  11.104  14.786
    3    HB2  ALA  25           HB1      ALA  25  -5.131   8.764  13.987
    4    HB3  ALA  25           HB2      ALA  25  -4.143   9.650  15.150
    5    HB1  ALA  25           HB3      ALA  25  -3.693   9.632  13.445

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU  26           H        LEU  26  -4.145  11.422  11.759
    2    HA   LEU  26           HA       LEU  26  -2.233  13.289  12.680
    3    HB2  LEU  26           HB2      LEU  26  -1.889  12.131  10.586
    4    HB3  LEU  26           HB3      LEU  26  -3.372  12.804   9.915
    5    HG   LEU  26           HG       LEU  26  -2.406  15.076  10.045
    6   HD12  LEU  26          HD11      LEU  26   0.128  15.152  10.480
    7   HD11  LEU  26          HD12      LEU  26  -0.068  13.571  11.232
    8   HD13  LEU  26          HD13      LEU  26  -0.911  14.973  11.893
    9   HD21  LEU  26          HD21      LEU  26  -0.608  13.050   8.677
   10   HD23  LEU  26          HD22      LEU  26  -0.685  14.768   8.296
   11   HD22  LEU  26          HD23      LEU  26  -2.084  13.739   8.002

  No H/Q in entry =          11
  In of MODEL   43
    1    H    LYS  27           H        LYS  27  -5.412  13.695  11.174
    2    HA   LYS  27           HA       LYS  27  -5.413  16.483  10.959
    3    HB2  LYS  27           HB2      LYS  27  -7.117  14.964   9.968
    4    HB3  LYS  27           HB3      LYS  27  -7.782  14.704  11.580
    5    HG2  LYS  27           HG2      LYS  27  -8.264  17.102  11.797
    6    HG3  LYS  27           HG3      LYS  27  -7.549  17.404  10.211
    7    HD2  LYS  27           HD2      LYS  27  -9.242  15.927   9.169
    8    HD3  LYS  27           HD3      LYS  27  -9.963  15.642  10.755
    9    HE2  LYS  27           HE2      LYS  27 -10.458  18.045  10.979
   10    HE3  LYS  27           HE3      LYS  27  -9.709  18.353   9.409
   11    HZ3  LYS  27           HZ1      LYS  27 -12.081  18.177   9.148
   12    HZ2  LYS  27           HZ2      LYS  27 -12.105  16.664   9.927
   13    HZ1  LYS  27           HZ3      LYS  27 -11.351  16.834   8.410

  No H/Q in entry =          13
  In of MODEL   43
    1    H    GLN  28           H        GLN  28  -6.281  14.396  13.691
    2    HA   GLN  28           HA       GLN  28  -7.233  16.391  15.447
    3    HB2  GLN  28           HB2      GLN  28  -6.041  13.666  15.780
    4    HB3  GLN  28           HB3      GLN  28  -6.194  14.698  17.204
    5    HG2  GLN  28           HG2      GLN  28  -8.184  13.178  16.724
    6    HG3  GLN  28           HG3      GLN  28  -8.559  14.888  16.928
    7   HE21  GLN  28          HE21      GLN  28  -8.894  16.168  14.884
    8   HE22  GLN  28          HE22      GLN  28  -9.436  15.365  13.489

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ALA  29           H        ALA  29  -3.982  15.156  14.792
    2    HA   ALA  29           HA       ALA  29  -2.589  16.594  16.774
    3    HB1  ALA  29           HB1      ALA  29  -0.636  15.934  15.675
    4    HB3  ALA  29           HB2      ALA  29  -1.379  16.034  14.079
    5    HB2  ALA  29           HB3      ALA  29  -1.784  14.700  15.158

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LYS  30           H        LYS  30  -3.436  17.437  13.432
    2    HA   LYS  30           HA       LYS  30  -2.071  19.902  13.328
    3    HB2  LYS  30           HB2      LYS  30  -4.573  18.973  11.904
    4    HB3  LYS  30           HB3      LYS  30  -3.765  20.501  11.558
    5    HG2  LYS  30           HG2      LYS  30  -1.667  19.243  11.069
    6    HG3  LYS  30           HG3      LYS  30  -2.549  17.732  11.316
    7    HD2  LYS  30           HD2      LYS  30  -4.109  18.333   9.505
    8    HD3  LYS  30           HD3      LYS  30  -3.251  19.856   9.260
    9    HE2  LYS  30           HE2      LYS  30  -1.192  18.596   8.704
   10    HE3  LYS  30           HE3      LYS  30  -2.068  17.078   8.918
   11    HZ2  LYS  30           HZ1      LYS  30  -1.889  17.938   6.573
   12    HZ1  LYS  30           HZ2      LYS  30  -2.958  19.185   7.025
   13    HZ3  LYS  30           HZ3      LYS  30  -3.455  17.560   7.102

  No H/Q in entry =          13
  In of MODEL   43
    1    H    GLN  31           H        GLN  31  -5.167  19.004  14.721
    2    HA   GLN  31           HA       GLN  31  -5.981  21.749  15.150
    3    HB2  GLN  31           HB2      GLN  31  -7.129  19.291  16.478
    4    HB3  GLN  31           HB3      GLN  31  -7.913  20.848  16.217
    5    HG2  GLN  31           HG2      GLN  31  -7.169  20.068  13.638
    6    HG3  GLN  31           HG3      GLN  31  -7.674  18.559  14.390
    7   HE21  GLN  31          HE21      GLN  31  -9.094  20.097  12.268
    8   HE22  GLN  31          HE22      GLN  31 -10.619  20.467  12.911

  No H/Q in entry =           8
  In of MODEL   43
    1    H    GLY  32           H        GLY  32  -3.647  19.869  16.500
    2    HA3  GLY  32           HA2      GLY  32  -2.269  20.365  18.310
    3    HA2  GLY  32           HA3      GLY  32  -3.423  21.592  18.818

  No H/Q in entry =           3
  In of MODEL   43
    1    H    ASP  33           H        ASP  33  -4.789  18.525  18.162
    2    HA   ASP  33           HA       ASP  33  -5.215  18.077  21.042
    3    HB2  ASP  33           HB2      ASP  33  -6.585  17.029  18.559
    4    HB3  ASP  33           HB3      ASP  33  -6.933  16.422  20.176

  No H/Q in entry =           4
  In of MODEL   43
    1    H    PHE  34           H        PHE  34  -3.035  17.264  21.369
    2    HA   PHE  34           HA       PHE  34  -1.987  15.024  19.988
    3    HB2  PHE  34           HB2      PHE  34  -1.409  16.033  22.782
    4    HB3  PHE  34           HB3      PHE  34  -0.453  14.821  21.929
    5    HD1  PHE  34           HD1      PHE  34  -0.687  18.248  22.643
    6    HD2  PHE  34           HD2      PHE  34   0.212  15.540  19.430
    7    HE1  PHE  34           HE1      PHE  34   0.588  20.033  21.489
    8    HE2  PHE  34           HE2      PHE  34   1.483  17.329  18.281
    9    HZ   PHE  34           HZ       PHE  34   1.672  19.573  19.315

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ALA  35           H        ALA  35  -4.054  15.283  22.834
    2    HA   ALA  35           HA       ALA  35  -3.805  12.630  23.747
    3    HB3  ALA  35           HB1      ALA  35  -6.280  13.220  24.582
    4    HB1  ALA  35           HB2      ALA  35  -5.769  14.844  24.121
    5    HB2  ALA  35           HB3      ALA  35  -4.850  13.942  25.324

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA  36           H        ALA  36  -6.263  14.095  21.620
    2    HA   ALA  36           HA       ALA  36  -7.635  11.658  21.145
    3    HB1  ALA  36           HB1      ALA  36  -9.106  13.051  20.170
    4    HB3  ALA  36           HB2      ALA  36  -7.931  13.484  18.927
    5    HB2  ALA  36           HB3      ALA  36  -7.982  14.379  20.446

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA  37           H        ALA  37  -4.968  13.280  19.488
    2    HA   ALA  37           HA       ALA  37  -4.889  11.633  17.200
    3    HB3  ALA  37           HB1      ALA  37  -2.935  13.384  18.629
    4    HB2  ALA  37           HB2      ALA  37  -3.454  13.422  16.945
    5    HB1  ALA  37           HB3      ALA  37  -2.284  12.214  17.481

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LYS  38           H        LYS  38  -3.151  11.372  20.293
    2    HA   LYS  38           HA       LYS  38  -1.783   8.991  19.828
    3    HB2  LYS  38           HB2      LYS  38  -2.151  10.760  21.961
    4    HB3  LYS  38           HB3      LYS  38  -2.750   9.224  22.581
    5    HG2  LYS  38           HG2      LYS  38  -0.634   8.135  22.067
    6    HG3  LYS  38           HG3      LYS  38  -0.042   9.585  21.250
    7    HD2  LYS  38           HD2      LYS  38   0.091  10.818  23.280
    8    HD3  LYS  38           HD3      LYS  38  -0.916   9.655  24.145
    9    HE2  LYS  38           HE2      LYS  38   1.439   9.381  24.784
   10    HE3  LYS  38           HE3      LYS  38   0.865   7.951  23.923
   11    HZ3  LYS  38           HZ1      LYS  38   2.172   8.381  22.150
   12    HZ2  LYS  38           HZ2      LYS  38   3.105   9.231  23.289
   13    HZ1  LYS  38           HZ3      LYS  38   2.019  10.068  22.285

  No H/Q in entry =          13
  In of MODEL   43
    1    H    ALA  39           H        ALA  39  -5.040   9.441  21.203
    2    HA   ALA  39           HA       ALA  39  -5.559   6.715  21.718
    3    HB3  ALA  39           HB1      ALA  39  -7.744   8.620  20.923
    4    HB2  ALA  39           HB2      ALA  39  -6.861   8.870  22.430
    5    HB1  ALA  39           HB3      ALA  39  -7.751   7.369  22.168

  No H/Q in entry =           5
  In of MODEL   43
    1    H    MET  40           H        MET  40  -6.155   8.703  18.856
    2    HA   MET  40           HA       MET  40  -7.588   6.739  17.395
    3    HB2  MET  40           HB2      MET  40  -6.011   9.156  16.489
    4    HB3  MET  40           HB3      MET  40  -7.012   8.174  15.417
    5    HG2  MET  40           HG2      MET  40  -8.087   9.420  17.960
    6    HG3  MET  40           HG3      MET  40  -8.146  10.245  16.404
    7    HE3  MET  40           HE1      MET  40 -10.687   8.572  14.329
    8    HE2  MET  40           HE2      MET  40  -8.935   8.717  14.194
    9    HE1  MET  40           HE3      MET  40  -9.880  10.071  14.813

  No H/Q in entry =           9
  In of MODEL   43
    1    H    MET  41           H        MET  41  -4.111   7.535  17.540
    2    HA   MET  41           HA       MET  41  -3.307   5.783  15.455
    3    HB2  MET  41           HB2      MET  41  -1.721   6.489  17.937
    4    HB3  MET  41           HB3      MET  41  -1.081   5.844  16.430
    5    HG2  MET  41           HG2      MET  41  -2.266   8.001  15.405
    6    HG3  MET  41           HG3      MET  41  -2.052   8.602  17.048
    7    HE2  MET  41           HE1      MET  41   0.898   6.555  17.444
    8    HE1  MET  41           HE2      MET  41   0.080   7.840  18.329
    9    HE3  MET  41           HE3      MET  41   1.704   8.108  17.697

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ASP  42           H        ASP  42  -3.711   5.321  18.941
    2    HA   ASP  42           HA       ASP  42  -2.632   2.747  19.123
    3    HB2  ASP  42           HB2      ASP  42  -3.550   4.501  20.929
    4    HB3  ASP  42           HB3      ASP  42  -4.959   3.451  20.851

  No H/Q in entry =           4
  In of MODEL   43
    1    H    GLN  43           H        GLN  43  -5.980   3.791  18.591
    2    HA   GLN  43           HA       GLN  43  -7.078   1.183  18.401
    3    HB2  GLN  43           HB2      GLN  43  -8.037   3.813  17.250
    4    HB3  GLN  43           HB3      GLN  43  -8.974   2.317  17.229
    5    HG2  GLN  43           HG2      GLN  43  -8.699   2.214  19.739
    6    HG3  GLN  43           HG3      GLN  43  -8.001   3.831  19.665
    7   HE21  GLN  43          HE21      GLN  43 -10.194   3.882  21.147
    8   HE22  GLN  43          HE22      GLN  43 -11.557   4.429  20.302

  No H/Q in entry =           8
  In of MODEL   43
    1    H    SER  44           H        SER  44  -5.756   3.407  15.988
    2    HA   SER  44           HA       SER  44  -6.414   1.899  13.701
    3    HB2  SER  44           HB2      SER  44  -5.202   4.306  14.142
    4    HB3  SER  44           HB3      SER  44  -3.827   3.331  13.628
    5    HG   SER  44           HG       SER  44  -4.941   4.274  11.851

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ARG  45           H        ARG  45  -3.551   1.846  15.805
    2    HA   ARG  45           HA       ARG  45  -2.027  -0.090  14.445
    3    HB2  ARG  45           HB2      ARG  45  -1.225   1.356  16.313
    4    HB3  ARG  45           HB3      ARG  45  -2.209   0.414  17.430
    5    HG2  ARG  45           HG2      ARG  45  -0.937  -1.627  16.808
    6    HG3  ARG  45           HG3      ARG  45   0.071  -0.660  15.733
    7    HD2  ARG  45           HD2      ARG  45   0.766   0.744  17.687
    8    HD3  ARG  45           HD3      ARG  45  -0.147  -0.341  18.759
    9    HE   ARG  45           HE       ARG  45   1.592  -1.916  17.201
   10   HH21  ARG  45          HH11      ARG  45   3.500  -2.702  18.058
   11   HH22  ARG  45          HH12      ARG  45   4.248  -1.896  19.391
   12   HH11  ARG  45          HH21      ARG  45   1.834   0.568  19.580
   13   HH12  ARG  45          HH22      ARG  45   3.305  -0.042  20.250

  No H/Q in entry =          13
  In of MODEL   43
    1    H    MET  46           H        MET  46  -4.439  -0.437  17.028
    2    HA   MET  46           HA       MET  46  -4.227  -3.232  17.350
    3    HB2  MET  46           HB2      MET  46  -6.448  -1.270  17.915
    4    HB3  MET  46           HB3      MET  46  -6.603  -2.989  18.282
    5    HG2  MET  46           HG2      MET  46  -4.584  -2.884  19.683
    6    HG3  MET  46           HG3      MET  46  -4.394  -1.179  19.304
    7    HE2  MET  46           HE1      MET  46  -4.753  -0.015  21.896
    8    HE1  MET  46           HE2      MET  46  -4.094  -1.647  21.876
    9    HE3  MET  46           HE3      MET  46  -5.368  -1.234  23.019

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ALA  47           H        ALA  47  -6.263  -1.260  15.229
    2    HA   ALA  47           HA       ALA  47  -7.838  -3.343  14.161
    3    HB3  ALA  47           HB1      ALA  47  -8.551  -1.119  13.728
    4    HB1  ALA  47           HB2      ALA  47  -8.039  -1.753  12.164
    5    HB2  ALA  47           HB3      ALA  47  -6.984  -0.662  13.064

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU  48           H        LEU  48  -4.732  -1.989  13.129
    2    HA   LEU  48           HA       LEU  48  -4.406  -3.586  10.798
    3    HB2  LEU  48           HB2      LEU  48  -2.385  -2.265  12.617
    4    HB3  LEU  48           HB3      LEU  48  -1.992  -2.988  11.057
    5    HG   LEU  48           HG       LEU  48  -4.053  -0.801  11.418
    6   HD13  LEU  48          HD11      LEU  48  -1.952   0.112  12.096
    7   HD12  LEU  48          HD12      LEU  48  -2.222   0.653  10.440
    8   HD11  LEU  48          HD13      LEU  48  -1.105  -0.674  10.764
    9   HD22  LEU  48          HD21      LEU  48  -4.492  -1.803   9.343
   10   HD21  LEU  48          HD22      LEU  48  -2.800  -2.213   9.064
   11   HD23  LEU  48          HD23      LEU  48  -3.344  -0.543   8.892

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ASN  49           H        ASN  49  -3.382  -3.949  14.155
    2    HA   ASN  49           HA       ASN  49  -1.742  -6.189  13.849
    3    HB2  ASN  49           HB2      ASN  49  -1.792  -4.857  15.890
    4    HB3  ASN  49           HB3      ASN  49  -3.455  -5.334  16.199
    5   HD21  ASN  49          HD21      ASN  49  -0.171  -6.720  15.847
    6   HD22  ASN  49          HD22      ASN  49  -0.447  -8.027  16.894

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLU  50           H        GLU  50  -5.220  -5.964  14.491
    2    HA   GLU  50           HA       GLU  50  -5.690  -8.770  14.609
    3    HB2  GLU  50           HB2      GLU  50  -7.309  -7.103  15.463
    4    HB3  GLU  50           HB3      GLU  50  -7.597  -6.551  13.812
    5    HG2  GLU  50           HG2      GLU  50  -8.423  -8.763  13.177
    6    HG3  GLU  50           HG3      GLU  50  -8.046  -9.393  14.777

  No H/Q in entry =           6
  In of MODEL   43
    1    H    ALA  51           H        ALA  51  -5.772  -6.386  12.001
    2    HA   ALA  51           HA       ALA  51  -6.715  -8.138   9.979
    3    HB2  ALA  51           HB1      ALA  51  -6.510  -6.329   8.603
    4    HB1  ALA  51           HB2      ALA  51  -4.881  -5.953   9.163
    5    HB3  ALA  51           HB3      ALA  51  -6.280  -5.458  10.118

  No H/Q in entry =           5
  In of MODEL   43
    1    H    HIS  52           H        HIS  52  -3.446  -7.178  10.986
    2    HA   HIS  52           HA       HIS  52  -2.010  -8.657   9.056
    3    HB2  HIS  52           HB2      HIS  52  -0.985  -6.912  10.461
    4    HB3  HIS  52           HB3      HIS  52  -1.202  -7.932  11.883
    5    HD1  HIS  52           HD1      HIS  52   0.118 -10.281  11.834
    6    HD2  HIS  52           HD2      HIS  52   1.309  -7.481   8.985
    7    HE1  HIS  52           HE1      HIS  52   2.373 -11.048  10.977
    8    HE2  HIS  52           HE2      HIS  52   3.113  -9.351   9.238

  No H/Q in entry =           8
  In of MODEL   43
    1    H    LEU  53           H        LEU  53  -3.236  -9.535  12.262
    2    HA   LEU  53           HA       LEU  53  -2.004 -12.062  12.479
    3    HB2  LEU  53           HB2      LEU  53  -4.515 -10.908  13.667
    4    HB3  LEU  53           HB3      LEU  53  -4.038 -12.576  13.969
    5    HG   LEU  53           HG       LEU  53  -2.160 -10.241  14.446
    6   HD12  LEU  53          HD11      LEU  53  -2.781 -10.535  16.866
    7   HD11  LEU  53          HD12      LEU  53  -4.104 -11.576  16.346
    8   HD13  LEU  53          HD13      LEU  53  -4.082  -9.881  15.875
    9   HD21  LEU  53          HD21      LEU  53  -2.195 -13.169  15.204
   10   HD23  LEU  53          HD22      LEU  53  -1.276 -12.006  16.152
   11   HD22  LEU  53          HD23      LEU  53  -0.887 -12.258  14.460

  No H/Q in entry =          11
  In of MODEL   43
    1    H    VAL  54           H        VAL  54  -5.118 -11.082  11.085
    2    HA   VAL  54           HA       VAL  54  -5.990 -13.692  10.403
    3    HB   VAL  54           HB       VAL  54  -6.665 -10.973   9.250
    4   HG12  VAL  54          HG11      VAL  54  -8.741 -12.384   8.427
    5   HG11  VAL  54          HG12      VAL  54  -7.611 -13.734   8.515
    6   HG13  VAL  54          HG13      VAL  54  -7.261 -12.359   7.470
    7   HG22  VAL  54          HG21      VAL  54  -7.589 -11.013  11.394
    8   HG21  VAL  54          HG22      VAL  54  -7.820 -12.760  11.381
    9   HG23  VAL  54          HG23      VAL  54  -8.907 -11.722  10.460

  No H/Q in entry =           9
  In of MODEL   43
    1    H    GLN  55           H        GLN  55  -4.137 -11.224   8.618
    2    HA   GLN  55           HA       GLN  55  -3.966 -12.698   6.209
    3    HB2  GLN  55           HB2      GLN  55  -3.391 -10.427   6.013
    4    HB3  GLN  55           HB3      GLN  55  -2.291 -10.482   7.388
    5    HG2  GLN  55           HG2      GLN  55  -0.552 -11.311   6.130
    6    HG3  GLN  55           HG3      GLN  55  -1.604 -12.305   5.132
    7   HE21  GLN  55          HE21      GLN  55  -1.612 -11.626   3.007
    8   HE22  GLN  55          HE22      GLN  55  -1.431 -10.021   2.491

  No H/Q in entry =           8
  In of MODEL   43
    1    H    THR  56           H        THR  56  -1.885 -12.635   9.107
    2    HA   THR  56           HA       THR  56   0.221 -14.211   8.216
    3    HB   THR  56           HB       THR  56  -1.043 -14.461  10.954
    4    HG1  THR  56           HG1      THR  56   0.383 -12.415   9.719
    5   HG23  THR  56          HG21      THR  56   1.025 -15.258  11.668
    6   HG22  THR  56          HG22      THR  56   1.890 -14.505  10.328
    7   HG21  THR  56          HG23      THR  56   0.925 -15.955  10.052

  No H/Q in entry =           7
  In of MODEL   43
    1    H    LYS  57           H        LYS  57  -2.897 -15.281   9.557
    2    HA   LYS  57           HA       LYS  57  -2.412 -18.072   9.329
    3    HB2  LYS  57           HB2      LYS  57  -4.250 -17.054  10.667
    4    HB3  LYS  57           HB3      LYS  57  -5.022 -16.527   9.179
    5    HG2  LYS  57           HG2      LYS  57  -6.115 -18.550   9.879
    6    HG3  LYS  57           HG3      LYS  57  -5.136 -18.941   8.466
    7    HD2  LYS  57           HD2      LYS  57  -3.458 -19.996   9.793
    8    HD3  LYS  57           HD3      LYS  57  -4.110 -19.327  11.288
    9    HE2  LYS  57           HE2      LYS  57  -4.790 -21.650  11.169
   10    HE3  LYS  57           HE3      LYS  57  -6.225 -20.674  10.864
   11    HZ1  LYS  57           HZ1      LYS  57  -4.711 -21.284   8.496
   12    HZ3  LYS  57           HZ2      LYS  57  -6.380 -21.419   8.789
   13    HZ2  LYS  57           HZ3      LYS  57  -5.327 -22.659   9.278

  No H/Q in entry =          13
  In of MODEL   43
    1    H    LEU  58           H        LEU  58  -3.756 -15.658   7.130
    2    HA   LEU  58           HA       LEU  58  -4.518 -17.503   5.126
    3    HB2  LEU  58           HB2      LEU  58  -3.948 -14.548   4.981
    4    HB3  LEU  58           HB3      LEU  58  -4.588 -15.499   3.640
    5    HG   LEU  58           HG       LEU  58  -5.893 -15.323   6.376
    6   HD11  LEU  58          HD11      LEU  58  -6.193 -13.692   3.873
    7   HD13  LEU  58          HD12      LEU  58  -6.204 -13.176   5.560
    8   HD12  LEU  58          HD13      LEU  58  -7.611 -13.991   4.880
    9   HD22  LEU  58          HD21      LEU  58  -6.824 -17.248   5.507
   10   HD21  LEU  58          HD22      LEU  58  -6.476 -16.800   3.838
   11   HD23  LEU  58          HD23      LEU  58  -7.856 -16.088   4.673

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  59           H        ILE  59  -1.406 -16.248   6.008
    2    HA   ILE  59           HA       ILE  59  -0.276 -16.975   3.385
    3    HB   ILE  59           HB       ILE  59   0.453 -14.892   4.955
    4   HG12  ILE  59          HG12      ILE  59   2.565 -16.524   3.528
    5   HG13  ILE  59          HG13      ILE  59   1.369 -15.582   2.675
    6   HG23  ILE  59          HG21      ILE  59   2.287 -15.348   6.363
    7   HG22  ILE  59          HG22      ILE  59   2.572 -16.922   5.656
    8   HG21  ILE  59          HG23      ILE  59   1.197 -16.664   6.727
    9   HD12  ILE  59          HD11      ILE  59   3.400 -14.544   4.647
   10   HD11  ILE  59          HD12      ILE  59   2.100 -13.562   3.976
   11   HD13  ILE  59          HD13      ILE  59   3.350 -14.213   2.917

  No H/Q in entry =          11
  In of MODEL   43
    1    H    GLU  60           H        GLU  60  -0.302 -18.064   6.758
    2    HA   GLU  60           HA       GLU  60   1.756 -20.017   6.521
    3    HB2  GLU  60           HB2      GLU  60   0.927 -19.206   8.695
    4    HB3  GLU  60           HB3      GLU  60  -0.636 -19.959   8.382
    5    HG2  GLU  60           HG2      GLU  60   0.454 -22.176   8.277
    6    HG3  GLU  60           HG3      GLU  60   2.015 -21.420   8.593

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLY  61           H        GLY  61  -1.749 -20.162   6.005
    2    HA3  GLY  61           HA2      GLY  61  -1.457 -22.956   5.063
    3    HA2  GLY  61           HA3      GLY  61  -2.957 -22.236   5.640

  No H/Q in entry =           3
  In of MODEL   43
    1    H    ASP  62           H        ASP  62  -0.722 -20.651   3.444
    2    HA   ASP  62           HA       ASP  62  -2.413 -19.579   1.672
    3    HB2  ASP  62           HB2      ASP  62  -0.638 -19.807  -0.040
    4    HB3  ASP  62           HB3      ASP  62   0.003 -19.313   1.522

  No H/Q in entry =           4
  In of MODEL   43
    1    H    ALA  63           H        ALA  63  -1.412 -23.014   1.531
    2    HA   ALA  63           HA       ALA  63  -3.850 -23.661   0.064
    3    HB3  ALA  63           HB1      ALA  63  -1.132 -24.094  -1.171
    4    HB2  ALA  63           HB2      ALA  63  -2.427 -23.068  -1.788
    5    HB1  ALA  63           HB3      ALA  63  -2.631 -24.821  -1.757

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLY  64           H        GLY  64  -0.886 -24.529   1.679
    2    HA3  GLY  64           HA2      GLY  64  -0.441 -26.272   3.132
    3    HA2  GLY  64           HA3      GLY  64  -2.073 -26.864   2.875

  No H/Q in entry =           3
  In of MODEL   43
    1    H    GLU  65           H        GLU  65  -0.162 -26.319   0.044
    2    HA   GLU  65           HA       GLU  65   0.242 -29.239  -0.162
    3    HB2  GLU  65           HB2      GLU  65  -0.420 -27.255  -2.339
    4    HB3  GLU  65           HB3      GLU  65  -0.020 -28.951  -2.614
    5    HG2  GLU  65           HG2      GLU  65  -2.278 -28.018  -0.825
    6    HG3  GLU  65           HG3      GLU  65  -2.492 -28.504  -2.504

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLY  66           H        GLY  66   1.837 -29.859  -1.822
    2    HA3  GLY  66           HA2      GLY  66   4.420 -28.990  -1.140
    3    HA2  GLY  66           HA3      GLY  66   4.009 -30.063  -2.464

  No H/Q in entry =           3
  In of MODEL   43
    1    H    LYS  67           H        LYS  67   2.352 -28.151  -3.837
    2    HA   LYS  67           HA       LYS  67   4.343 -26.913  -5.429
    3    HB2  LYS  67           HB2      LYS  67   2.464 -26.126  -6.777
    4    HB3  LYS  67           HB3      LYS  67   2.252 -27.824  -6.331
    5    HG2  LYS  67           HG2      LYS  67   0.784 -27.191  -4.479
    6    HG3  LYS  67           HG3      LYS  67   1.042 -25.483  -4.828
    7    HD2  LYS  67           HD2      LYS  67  -1.064 -26.059  -5.810
    8    HD3  LYS  67           HD3      LYS  67   0.084 -25.947  -7.146
    9    HE2  LYS  67           HE2      LYS  67   0.290 -28.313  -7.308
   10    HE3  LYS  67           HE3      LYS  67  -0.486 -28.563  -5.745
   11    HZ2  LYS  67           HZ1      LYS  67  -1.802 -28.843  -7.976
   12    HZ1  LYS  67           HZ2      LYS  67  -1.988 -27.161  -7.831
   13    HZ3  LYS  67           HZ3      LYS  67  -2.545 -28.191  -6.600

  No H/Q in entry =          13
  In of MODEL   43
    1    H    MET  68           H        MET  68   4.804 -24.837  -5.877
    2    HA   MET  68           HA       MET  68   4.950 -23.014  -3.740
    3    HB2  MET  68           HB2      MET  68   5.541 -22.882  -6.672
    4    HB3  MET  68           HB3      MET  68   5.644 -21.428  -5.679
    5    HG2  MET  68           HG2      MET  68   7.832 -22.480  -5.735
    6    HG3  MET  68           HG3      MET  68   7.160 -22.672  -4.115
    7    HE1  MET  68           HE1      MET  68   9.138 -24.282  -3.985
    8    HE3  MET  68           HE2      MET  68   8.753 -26.002  -3.985
    9    HE2  MET  68           HE3      MET  68   7.806 -24.895  -2.996

  No H/Q in entry =           9
  In of MODEL   43
    1    H    LYS  69           H        LYS  69   2.710 -23.161  -6.485
    2    HA   LYS  69           HA       LYS  69   1.631 -20.664  -6.486
    3    HB2  LYS  69           HB2      LYS  69   0.230 -23.283  -6.923
    4    HB3  LYS  69           HB3      LYS  69  -0.509 -21.711  -7.250
    5    HG2  LYS  69           HG2      LYS  69   1.329 -21.135  -8.766
    6    HG3  LYS  69           HG3      LYS  69   2.114 -22.677  -8.422
    7    HD2  LYS  69           HD2      LYS  69   0.124 -23.863  -9.324
    8    HD3  LYS  69           HD3      LYS  69  -0.593 -22.302  -9.733
    9    HE2  LYS  69           HE2      LYS  69   2.097 -23.253 -10.757
   10    HE3  LYS  69           HE3      LYS  69   0.590 -23.388 -11.663
   11    HZ3  LYS  69           HZ1      LYS  69   1.222 -21.381 -12.418
   12    HZ2  LYS  69           HZ2      LYS  69   2.197 -21.042 -11.068
   13    HZ1  LYS  69           HZ3      LYS  69   0.514 -20.828 -10.979

  No H/Q in entry =          13
  In of MODEL   43
    1    H    VAL  70           H        VAL  70   0.214 -19.420  -5.406
    2    HA   VAL  70           HA       VAL  70  -1.160 -20.540  -3.034
    3    HB   VAL  70           HB       VAL  70  -0.617 -18.410  -1.837
    4   HG12  VAL  70          HG11      VAL  70   1.968 -19.669  -2.726
    5   HG11  VAL  70          HG12      VAL  70   0.791 -20.606  -1.805
    6   HG13  VAL  70          HG13      VAL  70   1.491 -19.143  -1.111
    7   HG22  VAL  70          HG21      VAL  70  -0.174 -16.852  -3.599
    8   HG21  VAL  70          HG22      VAL  70   0.993 -17.933  -4.359
    9   HG23  VAL  70          HG23      VAL  70   1.398 -17.126  -2.845

  No H/Q in entry =           9
  In of MODEL   43
    1    H    SER  71           H        SER  71  -2.773 -18.856  -2.198
    2    HA   SER  71           HA       SER  71  -4.713 -18.289  -4.164
    3    HB2  SER  71           HB2      SER  71  -5.202 -18.523  -1.716
    4    HB3  SER  71           HB3      SER  71  -4.391 -16.985  -1.436
    5    HG   SER  71           HG       SER  71  -6.725 -17.497  -2.966

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU  72           H        LEU  72  -4.974 -16.624  -5.505
    2    HA   LEU  72           HA       LEU  72  -2.887 -14.786  -5.979
    3    HB2  LEU  72           HB2      LEU  72  -5.746 -14.868  -6.944
    4    HB3  LEU  72           HB3      LEU  72  -4.546 -13.717  -7.525
    5    HG   LEU  72           HG       LEU  72  -4.127 -16.722  -7.615
    6   HD13  LEU  72          HD11      LEU  72  -6.070 -16.140  -8.994
    7   HD12  LEU  72          HD12      LEU  72  -4.694 -16.525 -10.028
    8   HD11  LEU  72          HD13      LEU  72  -5.155 -14.844  -9.765
    9   HD22  LEU  72          HD21      LEU  72  -2.019 -15.708  -7.872
   10   HD21  LEU  72          HD22      LEU  72  -2.669 -14.316  -8.722
   11   HD23  LEU  72          HD23      LEU  72  -2.560 -15.872  -9.539

  No H/Q in entry =          11
  In of MODEL   43
    1    H    VAL  73           H        VAL  73  -5.997 -14.464  -4.375
    2    HA   VAL  73           HA       VAL  73  -6.083 -11.692  -4.036
    3    HB   VAL  73           HB       VAL  73  -7.801 -12.069  -2.452
    4   HG13  VAL  73          HG11      VAL  73  -9.227 -13.598  -3.633
    5   HG12  VAL  73          HG12      VAL  73  -7.847 -14.493  -4.264
    6   HG11  VAL  73          HG13      VAL  73  -8.173 -12.858  -4.837
    7   HG22  VAL  73          HG21      VAL  73  -6.985 -13.505  -0.818
    8   HG21  VAL  73          HG22      VAL  73  -6.319 -14.635  -1.998
    9   HG23  VAL  73          HG23      VAL  73  -8.056 -14.601  -1.693

  No H/Q in entry =           9
  In of MODEL   43
    1    H    LEU  74           H        LEU  74  -4.125 -14.027  -2.427
    2    HA   LEU  74           HA       LEU  74  -3.749 -12.869   0.094
    3    HB2  LEU  74           HB2      LEU  74  -2.933 -15.080  -0.396
    4    HB3  LEU  74           HB3      LEU  74  -1.872 -14.454  -1.657
    5    HG   LEU  74           HG       LEU  74  -0.603 -13.183   0.041
    6   HD12  LEU  74          HD11      LEU  74  -1.110 -13.896   2.476
    7   HD11  LEU  74          HD12      LEU  74  -2.688 -14.393   1.862
    8   HD13  LEU  74          HD13      LEU  74  -2.187 -12.706   1.743
    9   HD23  LEU  74          HD21      LEU  74  -0.787 -15.933   1.152
   10   HD22  LEU  74          HD22      LEU  74   0.610 -14.997   0.667
   11   HD21  LEU  74          HD23      LEU  74  -0.381 -15.761  -0.555

  No H/Q in entry =          11
  In of MODEL   43
    1    H    VAL  75           H        VAL  75  -1.841 -12.462  -2.851
    2    HA   VAL  75           HA       VAL  75  -0.078 -10.509  -1.835
    3    HB   VAL  75           HB       VAL  75  -1.005 -11.022  -4.663
    4   HG11  VAL  75          HG11      VAL  75   1.230  -9.253  -3.576
    5   HG13  VAL  75          HG12      VAL  75  -0.184  -8.720  -4.472
    6   HG12  VAL  75          HG13      VAL  75   1.041  -9.692  -5.270
    7   HG22  VAL  75          HG21      VAL  75   0.219 -12.871  -3.572
    8   HG21  VAL  75          HG22      VAL  75   1.508 -11.756  -3.118
    9   HG23  VAL  75          HG23      VAL  75   1.217 -12.121  -4.819

  No H/Q in entry =           9
  In of MODEL   43
    1    H    GLU  76           H        GLU  76  -3.220 -10.212  -3.518
    2    HA   GLU  76           HA       GLU  76  -3.310  -7.399  -3.632
    3    HB2  GLU  76           HB2      GLU  76  -4.935  -8.931  -4.777
    4    HB3  GLU  76           HB3      GLU  76  -5.631  -9.319  -3.211
    5    HG2  GLU  76           HG2      GLU  76  -6.304  -6.982  -2.893
    6    HG3  GLU  76           HG3      GLU  76  -5.567  -6.524  -4.416

  No H/Q in entry =           6
  In of MODEL   43
    1    H    ALA  77           H        ALA  77  -4.409  -9.632  -1.091
    2    HA   ALA  77           HA       ALA  77  -5.406  -7.636   0.652
    3    HB3  ALA  77           HB1      ALA  77  -5.463  -9.333   2.325
    4    HB1  ALA  77           HB2      ALA  77  -4.208 -10.271   1.517
    5    HB2  ALA  77           HB3      ALA  77  -5.812 -10.140   0.797

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLN  78           H        GLN  78  -2.235  -9.144   0.317
    2    HA   GLN  78           HA       GLN  78  -1.010  -7.957   2.572
    3    HB2  GLN  78           HB2      GLN  78  -0.112  -9.892   1.234
    4    HB3  GLN  78           HB3      GLN  78   0.315  -8.748  -0.036
    5    HG2  GLN  78           HG2      GLN  78   1.751  -7.524   1.544
    6    HG3  GLN  78           HG3      GLN  78   1.323  -8.659   2.821
    7   HE21  GLN  78          HE21      GLN  78   4.048  -8.347   1.979
    8   HE22  GLN  78          HE22      GLN  78   4.533  -9.784   1.214

  No H/Q in entry =           8
  In of MODEL   43
    1    H    LEU  79           H        LEU  79  -1.366  -6.915  -0.782
    2    HA   LEU  79           HA       LEU  79   0.291  -4.667  -0.766
    3    HB2  LEU  79           HB2      LEU  79  -0.709  -5.495  -2.824
    4    HB3  LEU  79           HB3      LEU  79  -2.322  -5.122  -2.229
    5    HG   LEU  79           HG       LEU  79  -1.809  -2.728  -2.210
    6   HD13  LEU  79          HD11      LEU  79   0.424  -2.453  -1.681
    7   HD12  LEU  79          HD12      LEU  79   0.482  -2.172  -3.421
    8   HD11  LEU  79          HD13      LEU  79   0.952  -3.742  -2.765
    9   HD23  LEU  79          HD21      LEU  79  -1.158  -2.531  -4.758
   10   HD22  LEU  79          HD22      LEU  79  -2.679  -3.297  -4.307
   11   HD21  LEU  79          HD23      LEU  79  -1.290  -4.290  -4.737

  No H/Q in entry =          11
  In of MODEL   43
    1    H    HIS  80           H        HIS  80  -3.179  -4.869   0.035
    2    HA   HIS  80           HA       HIS  80  -3.410  -2.113   0.685
    3    HB2  HIS  80           HB2      HIS  80  -5.084  -4.541   1.002
    4    HB3  HIS  80           HB3      HIS  80  -5.429  -3.201   2.097
    5    HD1  HIS  80           HD1      HIS  80  -7.060  -1.588   1.171
    6    HD2  HIS  80           HD2      HIS  80  -4.822  -3.386  -1.853
    7    HE1  HIS  80           HE1      HIS  80  -7.896  -0.611  -1.019
    8    HE2  HIS  80           HE2      HIS  80  -6.538  -1.701  -2.871

  No H/Q in entry =           8
  In of MODEL   43
    1    H    LEU  81           H        LEU  81  -2.901  -4.993   2.694
    2    HA   LEU  81           HA       LEU  81  -2.923  -3.635   5.173
    3    HB2  LEU  81           HB2      LEU  81  -1.666  -6.240   4.314
    4    HB3  LEU  81           HB3      LEU  81  -1.660  -5.674   5.985
    5    HG   LEU  81           HG       LEU  81  -4.190  -5.964   4.339
    6   HD12  LEU  81          HD11      LEU  81  -4.479  -8.027   5.893
    7   HD11  LEU  81          HD12      LEU  81  -2.729  -7.934   6.092
    8   HD13  LEU  81          HD13      LEU  81  -3.423  -8.180   4.489
    9   HD23  LEU  81          HD21      LEU  81  -5.049  -6.167   6.835
   10   HD22  LEU  81          HD22      LEU  81  -4.739  -4.577   6.141
   11   HD21  LEU  81          HD23      LEU  81  -3.551  -5.319   7.213

  No H/Q in entry =          11
  In of MODEL   43
    1    H    MET  82           H        MET  82  -0.215  -4.516   3.026
    2    HA   MET  82           HA       MET  82   1.844  -3.589   4.721
    3    HB2  MET  82           HB2      MET  82   1.656  -3.946   1.729
    4    HB3  MET  82           HB3      MET  82   3.125  -3.355   2.501
    5    HG2  MET  82           HG2      MET  82   1.743  -5.958   3.226
    6    HG3  MET  82           HG3      MET  82   3.122  -5.836   2.136
    7    HE3  MET  82           HE1      MET  82   6.114  -5.057   4.138
    8    HE2  MET  82           HE2      MET  82   5.179  -3.703   3.508
    9    HE1  MET  82           HE3      MET  82   5.292  -5.196   2.579

  No H/Q in entry =           9
  In of MODEL   43
    1    H    THR  83           H        THR  83   0.022  -1.980   2.144
    2    HA   THR  83           HA       THR  83   1.405   0.485   2.230
    3    HB   THR  83           HB       THR  83  -0.774   1.380   1.224
    4    HG1  THR  83           HG1      THR  83  -2.409   0.064   1.110
    5   HG22  THR  83          HG21      THR  83  -0.468  -0.443  -0.767
    6   HG21  THR  83          HG22      THR  83   1.029  -0.714   0.122
    7   HG23  THR  83          HG23      THR  83   0.654   0.892  -0.502

  No H/Q in entry =           7
  In of MODEL   43
    1    H    SER  84           H        SER  84  -1.601  -0.575   3.814
    2    HA   SER  84           HA       SER  84  -2.134   1.855   5.144
    3    HB2  SER  84           HB2      SER  84  -2.939  -0.990   5.715
    4    HB3  SER  84           HB3      SER  84  -3.455   0.350   6.738
    5    HG   SER  84           HG       SER  84  -3.890   0.019   3.944

  No H/Q in entry =           5
  In of MODEL   43
    1    H    MET  85           H        MET  85  -0.400  -1.052   6.299
    2    HA   MET  85           HA       MET  85   0.090  -0.109   8.903
    3    HB2  MET  85           HB2      MET  85   0.414  -2.452   8.234
    4    HB3  MET  85           HB3      MET  85   1.801  -1.976   7.253
    5    HG2  MET  85           HG2      MET  85   2.944  -1.123   9.262
    6    HG3  MET  85           HG3      MET  85   1.549  -1.560  10.248
    7    HE1  MET  85           HE1      MET  85   4.143  -2.519   7.849
    8    HE3  MET  85           HE2      MET  85   3.267  -3.920   7.238
    9    HE2  MET  85           HE3      MET  85   4.681  -4.151   8.261

  No H/Q in entry =           9
  In of MODEL   43
    1    H    LEU  86           H        LEU  86   2.044   0.156   5.965
    2    HA   LEU  86           HA       LEU  86   4.235   1.496   7.130
    3    HB2  LEU  86           HB2      LEU  86   4.072   0.401   4.825
    4    HB3  LEU  86           HB3      LEU  86   3.252   1.871   4.300
    5    HG   LEU  86           HG       LEU  86   5.259   3.144   5.289
    6   HD11  LEU  86          HD11      LEU  86   5.986   0.544   6.106
    7   HD13  LEU  86          HD12      LEU  86   6.973   2.000   6.204
    8   HD12  LEU  86          HD13      LEU  86   7.104   0.947   4.798
    9   HD23  LEU  86          HD21      LEU  86   6.012   1.378   2.952
   10   HD22  LEU  86          HD22      LEU  86   6.385   3.081   3.209
   11   HD21  LEU  86          HD23      LEU  86   4.740   2.593   2.801

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ALA  87           H        ALA  87   1.320   2.700   5.519
    2    HA   ALA  87           HA       ALA  87   1.884   5.437   5.594
    3    HB1  ALA  87           HB1      ALA  87  -0.403   3.781   5.044
    4    HB3  ALA  87           HB2      ALA  87  -0.107   5.443   4.539
    5    HB2  ALA  87           HB3      ALA  87  -0.908   5.120   6.078

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ARG  88           H        ARG  88   0.199   3.428   7.981
    2    HA   ARG  88           HA       ARG  88  -0.349   5.480   9.815
    3    HB2  ARG  88           HB2      ARG  88  -1.262   3.118   9.885
    4    HB3  ARG  88           HB3      ARG  88   0.279   2.638  10.605
    5    HG2  ARG  88           HG2      ARG  88  -0.232   4.714  12.212
    6    HG3  ARG  88           HG3      ARG  88  -1.891   4.369  11.745
    7    HD2  ARG  88           HD2      ARG  88  -1.988   2.524  12.999
    8    HD3  ARG  88           HD3      ARG  88  -0.388   1.957  12.483
    9    HE   ARG  88           HE       ARG  88  -0.954   3.226  14.927
   10   HH21  ARG  88          HH11      ARG  88   0.584   4.261  16.172
   11   HH22  ARG  88          HH12      ARG  88   2.104   4.701  15.476
   12   HH11  ARG  88          HH21      ARG  88   1.344   3.421  12.366
   13   HH12  ARG  88          HH22      ARG  88   2.542   4.209  13.333

  No H/Q in entry =          13
  In of MODEL   43
    1    H    GLU  89           H        GLU  89   2.474   3.291   9.623
    2    HA   GLU  89           HA       GLU  89   3.708   4.205  11.971
    3    HB2  GLU  89           HB2      GLU  89   4.399   2.188  10.642
    4    HB3  GLU  89           HB3      GLU  89   5.171   3.285   9.496
    5    HG2  GLU  89           HG2      GLU  89   6.634   4.157  11.246
    6    HG3  GLU  89           HG3      GLU  89   5.801   3.197  12.465

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LEU  90           H        LEU  90   4.037   5.350   8.640
    2    HA   LEU  90           HA       LEU  90   5.939   7.376   9.230
    3    HB2  LEU  90           HB2      LEU  90   3.954   7.011   6.990
    4    HB3  LEU  90           HB3      LEU  90   5.170   8.295   7.014
    5    HG   LEU  90           HG       LEU  90   5.875   5.368   7.367
    6   HD12  LEU  90          HD11      LEU  90   6.638   5.599   4.932
    7   HD11  LEU  90          HD12      LEU  90   5.607   7.027   4.869
    8   HD13  LEU  90          HD13      LEU  90   4.902   5.448   5.214
    9   HD22  LEU  90          HD21      LEU  90   7.753   6.543   8.057
   10   HD21  LEU  90          HD22      LEU  90   7.394   7.939   7.041
   11   HD23  LEU  90          HD23      LEU  90   8.076   6.479   6.326

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  91           H        ILE  91   2.402   7.349   9.055
    2    HA   ILE  91           HA       ILE  91   2.023  10.119   9.490
    3    HB   ILE  91           HB       ILE  91   0.257   7.725  10.031
    4   HG12  ILE  91          HG12      ILE  91  -0.004   9.994   8.033
    5   HG13  ILE  91          HG13      ILE  91   0.877   8.508   7.675
    6   HG22  ILE  91          HG21      ILE  91  -1.501   9.763  10.072
    7   HG21  ILE  91          HG22      ILE  91  -0.114  10.613  10.751
    8   HG23  ILE  91          HG23      ILE  91  -0.740   9.172  11.550
    9   HD13  ILE  91          HD11      ILE  91  -1.052   7.198   7.711
   10   HD12  ILE  91          HD12      ILE  91  -1.655   8.702   7.018
   11   HD11  ILE  91          HD13      ILE  91  -1.934   8.343   8.722

  No H/Q in entry =          11
  In of MODEL   43
    1    H    THR  92           H        THR  92   2.443   7.393  11.708
    2    HA   THR  92           HA       THR  92   1.965   8.773  14.121
    3    HB   THR  92           HB       THR  92   3.807   6.458  13.482
    4    HG1  THR  92           HG1      THR  92   1.849   5.676  13.370
    5   HG22  THR  92          HG21      THR  92   3.407   6.182  16.114
    6   HG21  THR  92          HG22      THR  92   3.321   7.940  16.031
    7   HG23  THR  92          HG23      THR  92   4.769   7.099  15.473

  No H/Q in entry =           7
  In of MODEL   43
    1    H    GLU  93           H        GLU  93   4.936   8.352  12.212
    2    HA   GLU  93           HA       GLU  93   6.658   9.809  13.915
    3    HB2  GLU  93           HB2      GLU  93   6.774   9.481  10.902
    4    HB3  GLU  93           HB3      GLU  93   8.100  10.033  11.924
    5    HG2  GLU  93           HG2      GLU  93   6.721   7.381  12.374
    6    HG3  GLU  93           HG3      GLU  93   8.110   7.545  11.308

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LEU  94           H        LEU  94   4.618  10.784  11.182
    2    HA   LEU  94           HA       LEU  94   5.388  13.498  11.074
    3    HB2  LEU  94           HB2      LEU  94   2.822  12.095  10.307
    4    HB3  LEU  94           HB3      LEU  94   3.060  13.825  10.059
    5    HG   LEU  94           HG       LEU  94   5.111  11.858   9.035
    6   HD11  LEU  94          HD11      LEU  94   2.370  12.367   7.948
    7   HD13  LEU  94          HD12      LEU  94   3.373  10.923   7.838
    8   HD12  LEU  94          HD13      LEU  94   3.698  12.303   6.789
    9   HD23  LEU  94          HD21      LEU  94   5.350  13.689   7.304
   10   HD22  LEU  94          HD22      LEU  94   5.745  14.195   8.947
   11   HD21  LEU  94          HD23      LEU  94   4.194  14.639   8.234

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  95           H        ILE  95   2.858  11.857  12.954
    2    HA   ILE  95           HA       ILE  95   1.774  14.198  14.129
    3    HB   ILE  95           HB       ILE  95   1.823  11.322  15.068
    4   HG12  ILE  95          HG12      ILE  95  -0.413  13.060  13.993
    5   HG13  ILE  95          HG13      ILE  95   0.566  12.008  12.974
    6   HG21  ILE  95          HG21      ILE  95   0.498  13.783  16.247
    7   HG23  ILE  95          HG22      ILE  95   1.556  12.632  17.066
    8   HG22  ILE  95          HG23      ILE  95  -0.069  12.147  16.581
    9   HD13  ILE  95          HD11      ILE  95  -0.318  10.062  13.896
   10   HD12  ILE  95          HD12      ILE  95  -1.715  11.133  13.956
   11   HD11  ILE  95          HD13      ILE  95  -0.758  10.855  15.410

  No H/Q in entry =          11
  In of MODEL   43
    1    H    GLU  96           H        GLU  96   4.392  12.021  15.156
    2    HA   GLU  96           HA       GLU  96   4.911  13.240  17.646
    3    HB2  GLU  96           HB2      GLU  96   5.894  11.091  17.017
    4    HB3  GLU  96           HB3      GLU  96   6.826  11.871  15.740
    5    HG2  GLU  96           HG2      GLU  96   8.455  12.450  17.213
    6    HG3  GLU  96           HG3      GLU  96   7.289  13.252  18.254

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LEU  97           H        LEU  97   6.000  14.010  14.364
    2    HA   LEU  97           HA       LEU  97   7.852  16.037  15.081
    3    HB2  LEU  97           HB2      LEU  97   6.288  15.452  12.576
    4    HB3  LEU  97           HB3      LEU  97   7.286  16.898  12.698
    5    HG   LEU  97           HG       LEU  97   8.350  14.119  13.281
    6   HD12  LEU  97          HD11      LEU  97   9.362  14.315  10.970
    7   HD11  LEU  97          HD12      LEU  97   8.293  15.689  10.691
    8   HD13  LEU  97          HD13      LEU  97   7.615  14.089  10.989
    9   HD23  LEU  97          HD21      LEU  97  10.507  15.425  12.548
   10   HD22  LEU  97          HD22      LEU  97   9.871  15.694  14.171
   11   HD21  LEU  97          HD23      LEU  97   9.550  16.866  12.894

  No H/Q in entry =          11
  In of MODEL   43
    1    H    HIS  98           H        HIS  98   4.364  16.118  14.398
    2    HA   HIS  98           HA       HIS  98   4.023  18.913  14.516
    3    HB2  HIS  98           HB2      HIS  98   2.160  16.639  15.239
    4    HB3  HIS  98           HB3      HIS  98   1.668  18.333  15.282
    5    HD1  HIS  98           HD1      HIS  98   2.748  15.621  12.900
    6    HD2  HIS  98           HD2      HIS  98   1.315  19.533  12.746
    7    HE1  HIS  98           HE1      HIS  98   2.201  16.089  10.469
    8    HE2  HIS  98           HE2      HIS  98   1.332  18.465  10.354

  No H/Q in entry =           8
  In of MODEL   43
    1    H    GLU  99           H        GLU  99   4.173  16.440  17.029
    2    HA   GLU  99           HA       GLU  99   3.522  18.136  19.213
    3    HB2  GLU  99           HB2      GLU  99   3.469  15.654  19.323
    4    HB3  GLU  99           HB3      GLU  99   5.230  15.634  19.229
    5    HG2  GLU  99           HG2      GLU  99   5.384  16.940  21.297
    6    HG3  GLU  99           HG3      GLU  99   3.628  17.055  21.378

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LYS 100           H        LYS 100   6.602  17.243  17.677
    2    HA   LYS 100           HA       LYS 100   8.221  18.677  19.540
    3    HB2  LYS 100           HB2      LYS 100   8.756  17.746  16.710
    4    HB3  LYS 100           HB3      LYS 100   9.966  18.539  17.724
    5    HG2  LYS 100           HG2      LYS 100   9.602  16.792  19.471
    6    HG3  LYS 100           HG3      LYS 100   8.491  15.966  18.375
    7    HD2  LYS 100           HD2      LYS 100  10.302  15.701  16.723
    8    HD3  LYS 100           HD3      LYS 100  11.418  16.539  17.804
    9    HE2  LYS 100           HE2      LYS 100  11.034  14.787  19.528
   10    HE3  LYS 100           HE3      LYS 100   9.980  13.929  18.399
   11    HZ1  LYS 100           HZ1      LYS 100  12.796  14.637  17.762
   12    HZ3  LYS 100           HZ2      LYS 100  11.774  13.563  16.931
   13    HZ2  LYS 100           HZ3      LYS 100  12.357  13.160  18.476

  No H/Q in entry =          13
  In of MODEL   43
    1    H    LEU 101           H        LEU 101   6.537  19.564  16.566
    2    HA   LEU 101           HA       LEU 101   7.716  22.137  16.228
    3    HB2  LEU 101           HB2      LEU 101   5.147  20.861  15.327
    4    HB3  LEU 101           HB3      LEU 101   5.374  22.594  15.113
    5    HG   LEU 101           HG       LEU 101   7.447  20.603  14.173
    6   HD12  LEU 101          HD11      LEU 101   6.304  21.081  11.877
    7   HD11  LEU 101          HD12      LEU 101   4.891  21.495  12.844
    8   HD13  LEU 101          HD13      LEU 101   5.578  19.875  12.939
    9   HD21  LEU 101          HD21      LEU 101   6.781  23.503  13.598
   10   HD23  LEU 101          HD22      LEU 101   7.784  22.552  12.504
   11   HD22  LEU 101          HD23      LEU 101   8.309  22.826  14.165

  No H/Q in entry =          11
  In of MODEL   43
    1    H    LYS 102           H        LYS 102   6.176  20.990  18.837
    2    HA   LYS 102           HA       LYS 102   5.512  22.082  20.759
    3    HB2  LYS 102           HB2      LYS 102   6.775  24.085  19.634
    4    HB3  LYS 102           HB3      LYS 102   5.170  24.664  19.243
    5    HG2  LYS 102           HG2      LYS 102   6.530  24.442  21.907
    6    HG3  LYS 102           HG3      LYS 102   5.563  25.753  21.264
    7    HD2  LYS 102           HD2      LYS 102   4.351  23.104  22.146
    8    HD3  LYS 102           HD3      LYS 102   4.571  24.473  23.225
    9    HE2  LYS 102           HE2      LYS 102   2.310  24.030  21.720
   10    HE3  LYS 102           HE3      LYS 102   2.785  25.587  22.398
   11    HZ2  LYS 102           HZ1      LYS 102   2.272  25.675  20.014
   12    HZ1  LYS 102           HZ2      LYS 102   3.551  24.610  19.706
   13    HZ3  LYS 102           HZ3      LYS 102   3.867  26.148  20.344

  No H/Q in entry =          13
  In of MODEL   43
    1    H    ALA 103           H        ALA 103   3.874  23.587  17.971
    2    HA   ALA 103           HA       ALA 103   1.405  24.133  18.834
    3    HB1  ALA 103           HB1      ALA 103   0.536  23.267  16.589
    4    HB2  ALA 103           HB2      ALA 103   2.194  22.752  16.275
    5    HB3  ALA 103           HB3      ALA 103   1.833  24.461  16.530

  No H/Q in entry =           5
  In of MODEL   43
    1    H1   ALA   1           H3       ALA   1  10.835 -20.363  -6.149
    2    H2   ALA   1           H2       ALA   1   9.884 -20.590  -7.542
    3    H3   ALA   1           H1       ALA   1   9.446 -21.335  -6.078
    4    HA   ALA   1           HA       ALA   1  10.516 -23.133  -6.801
    5    HB1  ALA   1           HB1      ALA   1  10.624 -22.783  -9.077
    6    HB2  ALA   1           HB2      ALA   1  12.347 -22.608  -8.736
    7    HB3  ALA   1           HB3      ALA   1  11.330 -21.175  -8.902

  No H/Q in entry =           7
  In of MODEL   43
    1    H    GLU   2           H        GLU   2  12.813 -24.052  -6.837
    2    HA   GLU   2           HA       GLU   2  14.176 -23.941  -4.615
    3    HB2  GLU   2           HB2      GLU   2  15.551 -23.804  -7.304
    4    HB3  GLU   2           HB3      GLU   2  16.276 -24.398  -5.811
    5    HG2  GLU   2           HG2      GLU   2  15.289 -26.430  -6.049
    6    HG3  GLU   2           HG3      GLU   2  13.709 -25.707  -6.324

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLU   3           H        GLU   3  15.940 -22.064  -7.012
    2    HA   GLU   3           HA       GLU   3  17.056 -20.352  -5.052
    3    HB2  GLU   3           HB2      GLU   3  17.023 -20.365  -8.063
    4    HB3  GLU   3           HB3      GLU   3  17.744 -19.022  -7.177
    5    HG2  GLU   3           HG2      GLU   3  19.418 -20.369  -6.235
    6    HG3  GLU   3           HG3      GLU   3  18.493 -21.850  -6.455

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LEU   4           H        LEU   4  14.783 -19.548  -7.704
    2    HA   LEU   4           HA       LEU   4  14.277 -16.943  -7.109
    3    HB2  LEU   4           HB2      LEU   4  12.134 -18.950  -7.846
    4    HB3  LEU   4           HB3      LEU   4  12.037 -17.203  -8.054
    5    HG   LEU   4           HG       LEU   4  14.036 -19.046  -9.403
    6   HD13  LEU   4          HD11      LEU   4  12.747 -18.924 -11.323
    7   HD12  LEU   4          HD12      LEU   4  12.015 -17.387 -10.869
    8   HD11  LEU   4          HD13      LEU   4  11.476 -18.881 -10.104
    9   HD23  LEU   4          HD21      LEU   4  14.353 -16.803 -10.763
   10   HD22  LEU   4          HD22      LEU   4  15.204 -17.027  -9.236
   11   HD21  LEU   4          HD23      LEU   4  13.739 -16.050  -9.290

  No H/Q in entry =          11
  In of MODEL   43
    1    H    GLU   5           H        GLU   5  12.817 -19.738  -5.464
    2    HA   GLU   5           HA       GLU   5  11.106 -18.181  -3.782
    3    HB2  GLU   5           HB2      GLU   5  10.726 -20.573  -4.300
    4    HB3  GLU   5           HB3      GLU   5  12.149 -20.978  -3.338
    5    HG2  GLU   5           HG2      GLU   5  11.128 -19.941  -1.359
    6    HG3  GLU   5           HG3      GLU   5   9.712 -19.499  -2.313

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLU   6           H        GLU   6  14.270 -19.716  -3.308
    2    HA   GLU   6           HA       GLU   6  14.591 -18.842  -0.611
    3    HB2  GLU   6           HB2      GLU   6  15.849 -20.746  -1.589
    4    HB3  GLU   6           HB3      GLU   6  16.709 -19.613  -2.636
    5    HG2  GLU   6           HG2      GLU   6  17.598 -18.444  -0.666
    6    HG3  GLU   6           HG3      GLU   6  16.715 -19.540   0.396

  No H/Q in entry =           6
  In of MODEL   43
    1    H    VAL   7           H        VAL   7  15.362 -17.521  -3.762
    2    HA   VAL   7           HA       VAL   7  17.012 -15.367  -2.895
    3    HB   VAL   7           HB       VAL   7  15.330 -15.766  -5.383
    4   HG11  VAL   7          HG11      VAL   7  17.187 -13.523  -4.568
    5   HG13  VAL   7          HG12      VAL   7  15.547 -13.406  -5.204
    6   HG12  VAL   7          HG13      VAL   7  16.871 -13.896  -6.262
    7   HG21  VAL   7          HG21      VAL   7  17.453 -17.190  -4.792
    8   HG23  VAL   7          HG22      VAL   7  18.340 -15.719  -5.191
    9   HG22  VAL   7          HG23      VAL   7  17.323 -16.489  -6.406

  No H/Q in entry =           9
  In of MODEL   43
    1    H    VAL   8           H        VAL   8  13.528 -15.688  -3.476
    2    HA   VAL   8           HA       VAL   8  12.821 -12.987  -3.023
    3    HB   VAL   8           HB       VAL   8  11.243 -15.537  -2.591
    4   HG12  VAL   8          HG11      VAL   8   9.267 -13.930  -2.714
    5   HG11  VAL   8          HG12      VAL   8  10.425 -12.621  -2.474
    6   HG13  VAL   8          HG13      VAL   8  10.217 -13.852  -1.230
    7   HG22  VAL   8          HG21      VAL   8  10.669 -15.407  -4.819
    8   HG21  VAL   8          HG22      VAL   8  12.125 -14.426  -4.954
    9   HG23  VAL   8          HG23      VAL   8  10.556 -13.648  -4.780

  No H/Q in entry =           9
  In of MODEL   43
    1    H    MET   9           H        MET   9  13.111 -15.778  -0.827
    2    HA   MET   9           HA       MET   9  12.260 -14.507   1.530
    3    HB2  MET   9           HB2      MET   9  14.157 -16.779   0.984
    4    HB3  MET   9           HB3      MET   9  13.936 -16.170   2.625
    5    HG2  MET   9           HG2      MET   9  11.408 -16.431   2.187
    6    HG3  MET   9           HG3      MET   9  11.881 -17.413   0.799
    7    HE3  MET   9           HE1      MET   9  13.335 -20.547   2.027
    8    HE2  MET   9           HE2      MET   9  14.366 -19.183   1.605
    9    HE1  MET   9           HE3      MET   9  12.872 -19.457   0.715

  No H/Q in entry =           9
  In of MODEL   43
    1    H    GLY  10           H        GLY  10  15.456 -14.693  -0.001
    2    HA3  GLY  10           HA2      GLY  10  16.879 -13.241   1.972
    3    HA2  GLY  10           HA3      GLY  10  17.357 -13.408   0.283

  No H/Q in entry =           3
  In of MODEL   43
    1    H    LEU  11           H        LEU  11  15.181 -12.225  -0.978
    2    HA   LEU  11           HA       LEU  11  15.824  -9.469  -0.823
    3    HB2  LEU  11           HB2      LEU  11  13.487 -10.920  -2.069
    4    HB3  LEU  11           HB3      LEU  11  13.742  -9.182  -2.235
    5    HG   LEU  11           HG       LEU  11  15.807 -11.264  -2.997
    6   HD13  LEU  11          HD11      LEU  11  14.078 -11.664  -4.529
    7   HD12  LEU  11          HD12      LEU  11  15.070 -10.472  -5.367
    8   HD11  LEU  11          HD13      LEU  11  13.583  -9.972  -4.562
    9   HD22  LEU  11          HD21      LEU  11  17.007  -9.281  -2.772
   10   HD21  LEU  11          HD22      LEU  11  15.620  -8.267  -3.166
   11   HD23  LEU  11          HD23      LEU  11  16.474  -9.129  -4.445

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  12           H        ILE  12  13.074 -11.331   0.432
    2    HA   ILE  12           HA       ILE  12  11.639  -9.123   1.470
    3    HB   ILE  12           HB       ILE  12  11.715 -12.013   2.390
    4   HG12  ILE  12          HG12      ILE  12  10.974 -11.382  -0.018
    5   HG13  ILE  12          HG13      ILE  12   9.918 -12.423   0.914
    6   HG22  ILE  12          HG21      ILE  12   9.451 -11.465   3.373
    7   HG21  ILE  12          HG22      ILE  12   9.792  -9.762   3.065
    8   HG23  ILE  12          HG23      ILE  12  10.802 -10.676   4.184
    9   HD13  ILE  12          HD11      ILE  12   8.491 -10.525   1.448
   10   HD12  ILE  12          HD12      ILE  12   8.714 -10.610  -0.298
   11   HD11  ILE  12          HD13      ILE  12   9.603  -9.431   0.643

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  13           H        ILE  13  14.055 -11.284   2.905
    2    HA   ILE  13           HA       ILE  13  14.052 -10.091   5.480
    3    HB   ILE  13           HB       ILE  13  16.155 -11.633   3.939
    4   HG12  ILE  13          HG12      ILE  13  13.890 -12.647   4.737
    5   HG13  ILE  13          HG13      ILE  13  15.377 -13.536   5.052
    6   HG22  ILE  13          HG21      ILE  13  16.882 -11.932   6.551
    7   HG21  ILE  13          HG22      ILE  13  16.336 -10.261   6.564
    8   HG23  ILE  13          HG23      ILE  13  17.619 -10.758   5.462
    9   HD11  ILE  13          HD11      ILE  13  14.105 -11.655   7.074
   10   HD13  ILE  13          HD12      ILE  13  15.431 -12.782   7.341
   11   HD12  ILE  13          HD13      ILE  13  13.811 -13.391   7.031

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ASN  14           H        ASN  14  16.019  -9.543   2.573
    2    HA   ASN  14           HA       ASN  14  17.723  -7.568   3.639
    3    HB2  ASN  14           HB2      ASN  14  17.739  -8.845   1.329
    4    HB3  ASN  14           HB3      ASN  14  16.827  -7.446   0.778
    5   HD21  ASN  14          HD21      ASN  14  19.281  -7.750  -0.387
    6   HD22  ASN  14          HD22      ASN  14  20.401  -6.645   0.244

  No H/Q in entry =           6
  In of MODEL   43
    1    H    SER  15           H        SER  15  14.620  -7.281   1.921
    2    HA   SER  15           HA       SER  15  14.459  -4.463   1.962
    3    HB2  SER  15           HB2      SER  15  12.133  -4.752   1.453
    4    HB3  SER  15           HB3      SER  15  12.961  -6.104   0.690
    5    HG   SER  15           HG       SER  15  11.811  -7.365   1.891

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLY  16           H        GLY  16  13.390  -6.930   4.270
    2    HA3  GLY  16           HA2      GLY  16  12.124  -5.194   6.109
    3    HA2  GLY  16           HA3      GLY  16  12.764  -6.789   6.484

  No H/Q in entry =           3
  In of MODEL   43
    1    H    GLN  17           H        GLN  17  15.474  -6.412   5.911
    2    HA   GLN  17           HA       GLN  17  16.390  -5.163   8.293
    3    HB2  GLN  17           HB2      GLN  17  17.841  -6.004   5.770
    4    HB3  GLN  17           HB3      GLN  17  18.668  -5.376   7.196
    5    HG2  GLN  17           HG2      GLN  17  17.735  -7.181   8.566
    6    HG3  GLN  17           HG3      GLN  17  16.839  -7.794   7.176
    7   HE21  GLN  17          HE21      GLN  17  18.340  -9.761   7.974
    8   HE22  GLN  17          HE22      GLN  17  19.826  -9.887   7.164

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ALA  18           H        ALA  18  16.209  -4.105   4.926
    2    HA   ALA  18           HA       ALA  18  17.600  -1.686   5.152
    3    HB2  ALA  18           HB1      ALA  18  16.520  -2.930   3.082
    4    HB3  ALA  18           HB2      ALA  18  16.754  -1.183   3.060
    5    HB1  ALA  18           HB3      ALA  18  15.163  -1.855   3.420

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ARG  19           H        ARG  19  14.108  -2.334   5.524
    2    HA   ARG  19           HA       ARG  19  13.387   0.307   6.221
    3    HB2  ARG  19           HB2      ARG  19  11.742  -1.478   5.630
    4    HB3  ARG  19           HB3      ARG  19  12.086  -2.262   7.173
    5    HG2  ARG  19           HG2      ARG  19  11.330  -0.278   8.397
    6    HG3  ARG  19           HG3      ARG  19  11.076   0.587   6.882
    7    HD2  ARG  19           HD2      ARG  19   8.943  -0.244   7.689
    8    HD3  ARG  19           HD3      ARG  19   9.389  -1.123   6.221
    9    HE   ARG  19           HE       ARG  19  10.359  -2.638   8.341
   10   HH21  ARG  19          HH11      ARG  19   9.132  -4.295   9.279
   11   HH22  ARG  19          HH12      ARG  19   7.413  -4.300   9.094
   12   HH11  ARG  19          HH21      ARG  19   7.351  -1.405   7.216
   13   HH12  ARG  19          HH22      ARG  19   6.405  -2.663   7.922

  No H/Q in entry =          13
  In of MODEL   43
    1    H    SER  20           H        SER  20  14.280  -2.498   8.201
    2    HA   SER  20           HA       SER  20  13.956  -1.392  10.730
    3    HB2  SER  20           HB2      SER  20  14.465  -3.707  10.627
    4    HB3  SER  20           HB3      SER  20  15.918  -3.424   9.671
    5    HG   SER  20           HG       SER  20  16.942  -2.670  11.437

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU  21           H        LEU  21  16.815  -1.289   8.617
    2    HA   LEU  21           HA       LEU  21  18.449   0.235  10.361
    3    HB2  LEU  21           HB2      LEU  21  18.456  -0.049   7.348
    4    HB3  LEU  21           HB3      LEU  21  19.690   0.834   8.245
    5    HG   LEU  21           HG       LEU  21  18.993  -2.066   8.794
    6   HD13  LEU  21          HD11      LEU  21  20.910  -2.686   7.460
    7   HD12  LEU  21          HD12      LEU  21  21.336  -0.995   7.197
    8   HD11  LEU  21          HD13      LEU  21  19.877  -1.659   6.465
    9   HD22  LEU  21          HD21      LEU  21  20.133  -1.303  10.694
   10   HD21  LEU  21          HD22      LEU  21  21.100  -0.142   9.789
   11   HD23  LEU  21          HD23      LEU  21  21.480  -1.854   9.703

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ALA  22           H        ALA  22  16.188   1.151   7.782
    2    HA   ALA  22           HA       ALA  22  16.677   3.919   7.787
    3    HB3  ALA  22           HB1      ALA  22  15.311   2.643   6.103
    4    HB2  ALA  22           HB2      ALA  22  14.573   4.146   6.657
    5    HB1  ALA  22           HB3      ALA  22  14.005   2.599   7.287

  No H/Q in entry =           5
  In of MODEL   43
    1    H    TYR  23           H        TYR  23  14.199   2.067   9.610
    2    HA   TYR  23           HA       TYR  23  13.184   4.294  11.041
    3    HB2  TYR  23           HB2      TYR  23  11.987   2.158  11.020
    4    HB3  TYR  23           HB3      TYR  23  13.326   1.375  11.859
    5    HD1  TYR  23           HD1      TYR  23  10.744   4.045  12.188
    6    HD2  TYR  23           HD2      TYR  23  13.530   1.483  14.220
    7    HE1  TYR  23           HE1      TYR  23   9.785   4.732  14.371
    8    HE2  TYR  23           HE2      TYR  23  12.571   2.169  16.401
    9    HH   TYR  23           HH       TYR  23   9.668   3.588  16.767

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ALA  24           H        ALA  24  15.864   2.068  11.710
    2    HA   ALA  24           HA       ALA  24  16.496   3.087  14.274
    3    HB1  ALA  24           HB1      ALA  24  17.885   1.318  14.129
    4    HB3  ALA  24           HB2      ALA  24  18.905   2.252  13.034
    5    HB2  ALA  24           HB3      ALA  24  17.634   1.218  12.387

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA  25           H        ALA  25  17.463   4.017  10.999
    2    HA   ALA  25           HA       ALA  25  19.369   5.989  11.651
    3    HB1  ALA  25           HB1      ALA  25  18.688   5.017   9.334
    4    HB3  ALA  25           HB2      ALA  25  19.160   6.713   9.423
    5    HB2  ALA  25           HB3      ALA  25  17.453   6.276   9.342

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU  26           H        LEU  26  15.854   6.155  11.260
    2    HA   LEU  26           HA       LEU  26  15.579   8.934  11.695
    3    HB2  LEU  26           HB2      LEU  26  13.746   7.663  10.758
    4    HB3  LEU  26           HB3      LEU  26  13.661   6.640  12.188
    5    HG   LEU  26           HG       LEU  26  13.010   8.594  13.554
    6   HD12  LEU  26          HD11      LEU  26  12.325  10.677  12.213
    7   HD11  LEU  26          HD12      LEU  26  13.327  10.034  10.914
    8   HD13  LEU  26          HD13      LEU  26  14.052  10.439  12.471
    9   HD21  LEU  26          HD21      LEU  26  11.361   8.240  11.032
   10   HD23  LEU  26          HD22      LEU  26  10.776   8.936  12.541
   11   HD22  LEU  26          HD23      LEU  26  11.258   7.242  12.482

  No H/Q in entry =          11
  In of MODEL   43
    1    H    LYS  27           H        LYS  27  15.499   6.164  13.901
    2    HA   LYS  27           HA       LYS  27  14.864   7.531  16.257
    3    HB2  LYS  27           HB2      LYS  27  14.936   5.055  16.005
    4    HB3  LYS  27           HB3      LYS  27  16.698   5.137  15.976
    5    HG2  LYS  27           HG2      LYS  27  16.714   6.134  18.221
    6    HG3  LYS  27           HG3      LYS  27  14.946   6.123  18.252
    7    HD2  LYS  27           HD2      LYS  27  14.964   3.655  18.027
    8    HD3  LYS  27           HD3      LYS  27  16.729   3.674  18.030
    9    HE2  LYS  27           HE2      LYS  27  16.728   4.673  20.282
   10    HE3  LYS  27           HE3      LYS  27  14.962   4.685  20.282
   11    HZ3  LYS  27           HZ1      LYS  27  15.772   2.751  21.448
   12    HZ2  LYS  27           HZ2      LYS  27  16.707   2.281  20.107
   13    HZ1  LYS  27           HZ3      LYS  27  15.010   2.258  20.014

  No H/Q in entry =          13
  In of MODEL   43
    1    H    GLN  28           H        GLN  28  18.003   6.992  14.694
    2    HA   GLN  28           HA       GLN  28  19.653   8.112  16.693
    3    HB2  GLN  28           HB2      GLN  28  19.884   7.706  13.736
    4    HB3  GLN  28           HB3      GLN  28  21.061   8.743  14.541
    5    HG2  GLN  28           HG2      GLN  28  21.681   6.271  14.372
    6    HG3  GLN  28           HG3      GLN  28  21.776   6.983  15.981
    7   HE21  GLN  28          HE21      GLN  28  19.871   6.560  17.456
    8   HE22  GLN  28          HE22      GLN  28  18.971   5.139  17.235

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ALA  29           H        ALA  29  17.900   9.554  13.979
    2    HA   ALA  29           HA       ALA  29  18.856  12.191  14.228
    3    HB2  ALA  29           HB1      ALA  29  17.159  12.795  12.739
    4    HB1  ALA  29           HB2      ALA  29  16.028  11.607  13.387
    5    HB3  ALA  29           HB3      ALA  29  17.375  11.080  12.377

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LYS  30           H        LYS  30  16.092  10.556  15.734
    2    HA   LYS  30           HA       LYS  30  15.032  12.800  17.072
    3    HB2  LYS  30           HB2      LYS  30  14.959   9.861  17.789
    4    HB3  LYS  30           HB3      LYS  30  14.067  11.102  18.669
    5    HG2  LYS  30           HG2      LYS  30  12.950  11.761  16.539
    6    HG3  LYS  30           HG3      LYS  30  13.781  10.433  15.725
    7    HD2  LYS  30           HD2      LYS  30  12.721   8.817  17.252
    8    HD3  LYS  30           HD3      LYS  30  11.899  10.134  18.090
    9    HE2  LYS  30           HE2      LYS  30  10.739  10.740  15.985
   10    HE3  LYS  30           HE3      LYS  30  11.541   9.394  15.167
   11    HZ2  LYS  30           HZ1      LYS  30   9.232   8.954  16.031
   12    HZ1  LYS  30           HZ2      LYS  30   9.886   9.024  17.603
   13    HZ3  LYS  30           HZ3      LYS  30  10.420   7.842  16.502

  No H/Q in entry =          13
  In of MODEL   43
    1    H    GLN  31           H        GLN  31  17.719  10.674  17.840
    2    HA   GLN  31           HA       GLN  31  18.009  11.706  20.533
    3    HB2  GLN  31           HB2      GLN  31  20.068  10.157  18.952
    4    HB3  GLN  31           HB3      GLN  31  19.918  10.288  20.704
    5    HG2  GLN  31           HG2      GLN  31  17.425   9.295  19.920
    6    HG3  GLN  31           HG3      GLN  31  18.548   8.462  18.853
    7   HE21  GLN  31          HE21      GLN  31  17.004   7.304  21.122
    8   HE22  GLN  31          HE22      GLN  31  18.161   6.665  22.185

  No H/Q in entry =           8
  In of MODEL   43
    1    H    GLY  32           H        GLY  32  18.533  13.017  17.564
    2    HA3  GLY  32           HA2      GLY  32  19.491  15.074  17.048
    3    HA2  GLY  32           HA3      GLY  32  20.235  15.097  18.642

  No H/Q in entry =           3
  In of MODEL   43
    1    H    ASP  33           H        ASP  33  20.715  12.203  16.882
    2    HA   ASP  33           HA       ASP  33  23.533  12.918  16.436
    3    HB2  ASP  33           HB2      ASP  33  22.063  10.281  16.552
    4    HB3  ASP  33           HB3      ASP  33  23.751  10.420  16.070

  No H/Q in entry =           4
  In of MODEL   43
    1    H    PHE  34           H        PHE  34  23.048  14.226  14.544
    2    HA   PHE  34           HA       PHE  34  21.732  13.211  12.251
    3    HB2  PHE  34           HB2      PHE  34  23.829  15.378  12.488
    4    HB3  PHE  34           HB3      PHE  34  22.860  15.066  11.050
    5    HD1  PHE  34           HD1      PHE  34  23.058  17.017  13.956
    6    HD2  PHE  34           HD2      PHE  34  20.232  14.848  11.557
    7    HE1  PHE  34           HE1      PHE  34  21.213  18.392  14.882
    8    HE2  PHE  34           HE2      PHE  34  18.391  16.222  12.486
    9    HZ   PHE  34           HZ       PHE  34  18.885  17.995  14.144

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ALA  35           H        ALA  35  25.101  13.079  13.287
    2    HA   ALA  35           HA       ALA  35  26.238  12.264  10.843
    3    HB3  ALA  35           HB1      ALA  35  27.922  11.128  12.581
    4    HB2  ALA  35           HB2      ALA  35  27.034  12.145  13.715
    5    HB1  ALA  35           HB3      ALA  35  27.870  12.875  12.346

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA  36           H        ALA  36  25.130  10.304  13.608
    2    HA   ALA  36           HA       ALA  36  25.663   7.818  12.348
    3    HB2  ALA  36           HB1      ALA  36  25.227   7.074  14.424
    4    HB3  ALA  36           HB2      ALA  36  23.533   7.542  14.258
    5    HB1  ALA  36           HB3      ALA  36  24.711   8.695  14.885

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA  37           H        ALA  37  22.807   9.900  12.449
    2    HA   ALA  37           HA       ALA  37  20.989   8.096  11.267
    3    HB3  ALA  37           HB1      ALA  37  21.165  11.064  11.547
    4    HB1  ALA  37           HB2      ALA  37  19.867   9.967  12.014
    5    HB2  ALA  37           HB3      ALA  37  20.062  10.434  10.324

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LYS  38           H        LYS  38  23.061  10.584   9.793
    2    HA   LYS  38           HA       LYS  38  22.450  10.134   7.113
    3    HB2  LYS  38           HB2      LYS  38  24.223  11.726   8.565
    4    HB3  LYS  38           HB3      LYS  38  25.280  10.749   7.553
    5    HG2  LYS  38           HG2      LYS  38  24.119  11.491   5.544
    6    HG3  LYS  38           HG3      LYS  38  22.903  12.331   6.511
    7    HD2  LYS  38           HD2      LYS  38  24.466  13.959   7.269
    8    HD3  LYS  38           HD3      LYS  38  25.846  12.992   6.748
    9    HE2  LYS  38           HE2      LYS  38  25.471  14.850   5.185
   10    HE3  LYS  38           HE3      LYS  38  25.168  13.304   4.386
   11    HZ3  LYS  38           HZ1      LYS  38  22.965  13.712   4.236
   12    HZ2  LYS  38           HZ2      LYS  38  23.461  15.336   4.320
   13    HZ1  LYS  38           HZ3      LYS  38  22.888  14.549   5.711

  No H/Q in entry =          13
  In of MODEL   43
    1    H    ALA  39           H        ALA  39  24.974   8.586   9.097
    2    HA   ALA  39           HA       ALA  39  26.086   7.006   7.043
    3    HB2  ALA  39           HB1      ALA  39  25.990   6.054   9.891
    4    HB1  ALA  39           HB2      ALA  39  26.922   7.493   9.475
    5    HB3  ALA  39           HB3      ALA  39  27.305   5.946   8.722

  No H/Q in entry =           5
  In of MODEL   43
    1    H    MET  40           H        MET  40  23.465   6.357   9.323
    2    HA   MET  40           HA       MET  40  23.073   3.642   8.598
    3    HB2  MET  40           HB2      MET  40  21.212   5.661   9.866
    4    HB3  MET  40           HB3      MET  40  20.836   3.944   9.696
    5    HG2  MET  40           HG2      MET  40  23.358   4.934  11.053
    6    HG3  MET  40           HG3      MET  40  21.861   4.638  11.936
    7    HE3  MET  40           HE1      MET  40  21.357   0.996  12.124
    8    HE2  MET  40           HE2      MET  40  20.473   2.280  11.303
    9    HE1  MET  40           HE3      MET  40  21.197   2.587  12.881

  No H/Q in entry =           9
  In of MODEL   43
    1    H    MET  41           H        MET  41  21.617   6.665   7.385
    2    HA   MET  41           HA       MET  41  19.694   5.430   5.704
    3    HB2  MET  41           HB2      MET  41  21.135   8.042   5.190
    4    HB3  MET  41           HB3      MET  41  19.622   7.520   4.462
    5    HG2  MET  41           HG2      MET  41  18.859   7.330   7.008
    6    HG3  MET  41           HG3      MET  41  20.146   8.511   7.235
    7    HE2  MET  41           HE1      MET  41  19.588   9.774   3.888
    8    HE1  MET  41           HE2      MET  41  20.526  10.236   5.305
    9    HE3  MET  41           HE3      MET  41  19.239  11.291   4.725

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ASP  42           H        ASP  42  23.055   6.408   5.173
    2    HA   ASP  42           HA       ASP  42  23.177   5.923   2.418
    3    HB2  ASP  42           HB2      ASP  42  24.896   6.958   4.197
    4    HB3  ASP  42           HB3      ASP  42  25.582   5.344   4.082

  No H/Q in entry =           4
  In of MODEL   43
    1    H    GLN  43           H        GLN  43  23.916   3.793   5.155
    2    HA   GLN  43           HA       GLN  43  24.632   1.540   3.588
    3    HB2  GLN  43           HB2      GLN  43  23.583   1.719   6.422
    4    HB3  GLN  43           HB3      GLN  43  24.194   0.237   5.679
    5    HG2  GLN  43           HG2      GLN  43  26.340   1.482   5.179
    6    HG3  GLN  43           HG3      GLN  43  25.726   2.804   6.168
    7   HE21  GLN  43          HE21      GLN  43  27.968   1.874   7.227
    8   HE22  GLN  43          HE22      GLN  43  27.702   0.792   8.506

  No H/Q in entry =           8
  In of MODEL   43
    1    H    SER  44           H        SER  44  21.546   2.627   4.943
    2    HA   SER  44           HA       SER  44  20.021   0.354   4.269
    3    HB2  SER  44           HB2      SER  44  19.527   2.880   5.399
    4    HB3  SER  44           HB3      SER  44  18.505   2.813   3.966
    5    HG   SER  44           HG       SER  44  17.414   1.859   5.685

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ARG  45           H        ARG  45  20.727   3.323   2.456
    2    HA   ARG  45           HA       ARG  45  19.229   2.801   0.142
    3    HB2  ARG  45           HB2      ARG  45  20.332   4.959   0.725
    4    HB3  ARG  45           HB3      ARG  45  21.892   4.229   0.355
    5    HG2  ARG  45           HG2      ARG  45  21.134   3.799  -1.963
    6    HG3  ARG  45           HG3      ARG  45  19.585   4.553  -1.593
    7    HD2  ARG  45           HD2      ARG  45  20.795   6.673  -1.008
    8    HD3  ARG  45           HD3      ARG  45  22.309   5.922  -1.562
    9    HE   ARG  45           HE       ARG  45  20.399   5.642  -3.611
   10   HH21  ARG  45          HH11      ARG  45  20.383   7.003  -5.381
   11   HH22  ARG  45          HH12      ARG  45  21.113   8.567  -5.278
   12   HH11  ARG  45          HH21      ARG  45  22.074   8.177  -1.983
   13   HH12  ARG  45          HH22      ARG  45  22.069   9.231  -3.351

  No H/Q in entry =          13
  In of MODEL   43
    1    H    MET  46           H        MET  46  22.602   1.986   0.919
    2    HA   MET  46           HA       MET  46  23.246   0.792  -1.554
    3    HB2  MET  46           HB2      MET  46  24.337   0.478   1.245
    4    HB3  MET  46           HB3      MET  46  25.027  -0.381  -0.137
    5    HG2  MET  46           HG2      MET  46  25.396   1.768  -1.295
    6    HG3  MET  46           HG3      MET  46  24.702   2.629   0.073
    7    HE2  MET  46           HE1      MET  46  26.984   4.120   0.952
    8    HE1  MET  46           HE2      MET  46  26.944   3.724  -0.763
    9    HE3  MET  46           HE3      MET  46  28.439   3.517   0.147

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ALA  47           H        ALA  47  21.863  -0.550   1.417
    2    HA   ALA  47           HA       ALA  47  21.860  -3.267   0.627
    3    HB2  ALA  47           HB1      ALA  47  21.456  -2.801   2.927
    4    HB3  ALA  47           HB2      ALA  47  19.934  -3.432   2.299
    5    HB1  ALA  47           HB3      ALA  47  20.134  -1.697   2.551

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU  48           H        LEU  48  19.467  -0.680   0.241
    2    HA   LEU  48           HA       LEU  48  17.457  -2.252  -1.018
    3    HB2  LEU  48           HB2      LEU  48  18.065   0.712  -1.142
    4    HB3  LEU  48           HB3      LEU  48  16.610  -0.025  -1.816
    5    HG   LEU  48           HG       LEU  48  17.447  -0.299   1.080
    6   HD13  LEU  48          HD11      LEU  48  16.994   1.994   0.879
    7   HD12  LEU  48          HD12      LEU  48  15.443   1.324   1.381
    8   HD11  LEU  48          HD13      LEU  48  15.719   1.742  -0.311
    9   HD22  LEU  48          HD21      LEU  48  15.949  -2.040   0.697
   10   HD21  LEU  48          HD22      LEU  48  15.070  -1.157  -0.552
   11   HD23  LEU  48          HD23      LEU  48  14.839  -0.747   1.148

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ASN  49           H        ASN  49  20.123  -0.287  -2.239
    2    HA   ASN  49           HA       ASN  49  19.492  -0.395  -4.967
    3    HB2  ASN  49           HB2      ASN  49  21.140   1.154  -4.048
    4    HB3  ASN  49           HB3      ASN  49  22.185  -0.185  -3.589
    5   HD21  ASN  49          HD21      ASN  49  20.703   1.342  -6.469
    6   HD22  ASN  49          HD22      ASN  49  21.945   0.896  -7.534

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLU  50           H        GLU  50  21.497  -2.548  -2.979
    2    HA   GLU  50           HA       GLU  50  22.240  -4.303  -5.092
    3    HB2  GLU  50           HB2      GLU  50  23.423  -4.249  -2.917
    4    HB3  GLU  50           HB3      GLU  50  21.984  -4.895  -2.128
    5    HG2  GLU  50           HG2      GLU  50  22.115  -6.933  -3.476
    6    HG3  GLU  50           HG3      GLU  50  23.487  -6.284  -4.371

  No H/Q in entry =           6
  In of MODEL   43
    1    H    ALA  51           H        ALA  51  19.567  -4.268  -2.784
    2    HA   ALA  51           HA       ALA  51  18.445  -6.762  -3.536
    3    HB3  ALA  51           HB1      ALA  51  16.834  -6.273  -1.994
    4    HB1  ALA  51           HB2      ALA  51  16.600  -4.634  -2.603
    5    HB2  ALA  51           HB3      ALA  51  17.958  -4.993  -1.536

  No H/Q in entry =           5
  In of MODEL   43
    1    H    HIS  52           H        HIS  52  17.814  -3.429  -4.593
    2    HA   HIS  52           HA       HIS  52  15.721  -3.998  -6.403
    3    HB2  HIS  52           HB2      HIS  52  16.274  -1.720  -5.640
    4    HB3  HIS  52           HB3      HIS  52  17.795  -1.795  -6.529
    5    HD1  HIS  52           HD1      HIS  52  17.563  -2.079  -9.198
    6    HD2  HIS  52           HD2      HIS  52  14.074  -0.996  -7.191
    7    HE1  HIS  52           HE1      HIS  52  15.963  -1.211 -10.960
    8    HE2  HIS  52           HE2      HIS  52  13.832  -0.546  -9.751

  No H/Q in entry =           8
  In of MODEL   43
    1    H    LEU  53           H        LEU  53  19.242  -3.951  -6.813
    2    HA   LEU  53           HA       LEU  53  19.323  -4.281  -9.611
    3    HB2  LEU  53           HB2      LEU  53  21.253  -4.998  -7.419
    4    HB3  LEU  53           HB3      LEU  53  21.587  -5.393  -9.104
    5    HG   LEU  53           HG       LEU  53  20.859  -2.586  -8.210
    6   HD12  LEU  53          HD11      LEU  53  23.329  -2.141  -8.372
    7   HD11  LEU  53          HD12      LEU  53  23.584  -3.882  -8.486
    8   HD13  LEU  53          HD13      LEU  53  22.889  -3.189  -7.026
    9   HD21  LEU  53          HD21      LEU  53  22.005  -3.823 -10.720
   10   HD23  LEU  53          HD22      LEU  53  22.295  -2.129 -10.341
   11   HD22  LEU  53          HD23      LEU  53  20.656  -2.702 -10.582

  No H/Q in entry =          11
  In of MODEL   43
    1    H    VAL  54           H        VAL  54  19.231  -6.655  -6.973
    2    HA   VAL  54           HA       VAL  54  19.402  -8.956  -8.619
    3    HB   VAL  54           HB       VAL  54  18.222  -8.536  -5.862
    4   HG12  VAL  54          HG11      VAL  54  18.588 -11.148  -5.841
    5   HG11  VAL  54          HG12      VAL  54  18.412 -10.992  -7.588
    6   HG13  VAL  54          HG13      VAL  54  17.108 -10.476  -6.521
    7   HG22  VAL  54          HG21      VAL  54  20.533  -8.286  -5.625
    8   HG21  VAL  54          HG22      VAL  54  20.897  -9.380  -6.958
    9   HG23  VAL  54          HG23      VAL  54  20.366 -10.027  -5.405

  No H/Q in entry =           9
  In of MODEL   43
    1    H    GLN  55           H        GLN  55  16.635  -7.090  -7.365
    2    HA   GLN  55           HA       GLN  55  14.648  -8.793  -8.443
    3    HB2  GLN  55           HB2      GLN  55  13.864  -7.270  -6.829
    4    HB3  GLN  55           HB3      GLN  55  14.640  -5.894  -7.608
    5    HG2  GLN  55           HG2      GLN  55  12.920  -5.606  -9.111
    6    HG3  GLN  55           HG3      GLN  55  12.628  -7.332  -9.273
    7   HE21  GLN  55          HE21      GLN  55  10.625  -7.910  -8.478
    8   HE22  GLN  55          HE22      GLN  55   9.830  -7.161  -7.179

  No H/Q in entry =           8
  In of MODEL   43
    1    H    THR  56           H        THR  56  16.350  -5.972  -9.806
    2    HA   THR  56           HA       THR  56  14.922  -5.647 -12.166
    3    HB   THR  56           HB       THR  56  17.938  -5.508 -11.983
    4    HG1  THR  56           HG1      THR  56  15.913  -3.931 -10.905
    5   HG23  THR  56          HG21      THR  56  17.830  -4.101 -13.834
    6   HG22  THR  56          HG22      THR  56  16.154  -3.654 -13.522
    7   HG21  THR  56          HG23      THR  56  16.532  -5.241 -14.191

  No H/Q in entry =           7
  In of MODEL   43
    1    H    LYS  57           H        LYS  57  17.605  -7.896 -11.524
    2    HA   LYS  57           HA       LYS  57  17.643  -9.105 -14.096
    3    HB2  LYS  57           HB2      LYS  57  19.446  -9.338 -12.393
    4    HB3  LYS  57           HB3      LYS  57  18.352 -10.271 -11.382
    5    HG2  LYS  57           HG2      LYS  57  19.756 -11.830 -12.559
    6    HG3  LYS  57           HG3      LYS  57  18.144 -11.939 -13.257
    7    HD2  LYS  57           HD2      LYS  57  18.783 -10.691 -15.186
    8    HD3  LYS  57           HD3      LYS  57  20.291 -10.164 -14.442
    9    HE2  LYS  57           HE2      LYS  57  20.838 -11.933 -15.998
   10    HE3  LYS  57           HE3      LYS  57  21.008 -12.604 -14.377
   11    HZ1  LYS  57           HZ1      LYS  57  18.355 -12.849 -15.439
   12    HZ3  LYS  57           HZ2      LYS  57  19.349 -14.019 -14.715
   13    HZ2  LYS  57           HZ3      LYS  57  19.517 -13.664 -16.366

  No H/Q in entry =          13
  In of MODEL   43
    1    H    LEU  58           H        LEU  58  15.854  -9.786 -11.128
    2    HA   LEU  58           HA       LEU  58  14.679 -12.185 -12.057
    3    HB2  LEU  58           HB2      LEU  58  13.838 -10.281  -9.877
    4    HB3  LEU  58           HB3      LEU  58  13.060 -11.834 -10.190
    5    HG   LEU  58           HG       LEU  58  16.024 -11.502  -9.618
    6   HD11  LEU  58          HD11      LEU  58  13.648 -11.949  -7.838
    7   HD13  LEU  58          HD12      LEU  58  15.083 -10.960  -7.572
    8   HD12  LEU  58          HD13      LEU  58  15.185 -12.714  -7.426
    9   HD22  LEU  58          HD21      LEU  58  15.948 -13.571 -10.634
   10   HD21  LEU  58          HD22      LEU  58  14.236 -13.808 -10.283
   11   HD23  LEU  58          HD23      LEU  58  15.441 -14.081  -9.024

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  59           H        ILE  59  13.956  -8.864 -12.763
    2    HA   ILE  59           HA       ILE  59  11.258  -9.564 -13.716
    3    HB   ILE  59           HB       ILE  59  12.022  -7.260 -12.521
    4   HG12  ILE  59          HG12      ILE  59  10.114  -7.200 -14.871
    5   HG13  ILE  59          HG13      ILE  59   9.709  -7.949 -13.349
    6   HG23  ILE  59          HG21      ILE  59  12.561  -5.537 -14.043
    7   HG22  ILE  59          HG22      ILE  59  12.092  -6.482 -15.437
    8   HG21  ILE  59          HG23      ILE  59  13.577  -6.857 -14.569
    9   HD12  ILE  59          HD11      ILE  59  10.444  -5.058 -13.792
   10   HD11  ILE  59          HD12      ILE  59  10.246  -5.781 -12.196
   11   HD13  ILE  59          HD13      ILE  59   8.870  -5.682 -13.295

  No H/Q in entry =          11
  In of MODEL   43
    1    H    GLU  60           H        GLU  60  14.455  -8.665 -14.959
    2    HA   GLU  60           HA       GLU  60  13.686  -8.294 -17.675
    3    HB2  GLU  60           HB2      GLU  60  15.851  -7.528 -16.784
    4    HB3  GLU  60           HB3      GLU  60  16.340  -9.201 -16.524
    5    HG2  GLU  60           HG2      GLU  60  16.156  -9.640 -18.945
    6    HG3  GLU  60           HG3      GLU  60  15.654  -7.972 -19.212

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLY  61           H        GLY  61  14.700 -11.147 -15.837
    2    HA3  GLY  61           HA2      GLY  61  14.203 -12.818 -18.232
    3    HA2  GLY  61           HA3      GLY  61  15.235 -13.274 -16.880

  No H/Q in entry =           3
  In of MODEL   43
    1    H    ASP  62           H        ASP  62  12.084 -11.780 -16.543
    2    HA   ASP  62           HA       ASP  62  11.034 -13.235 -14.559
    3    HB2  ASP  62           HB2      ASP  62   8.806 -12.790 -15.498
    4    HB3  ASP  62           HB3      ASP  62   9.857 -11.383 -15.624

  No H/Q in entry =           4
  In of MODEL   43
    1    H    ALA  63           H        ALA  63  11.026 -14.356 -17.969
    2    HA   ALA  63           HA       ALA  63  10.829 -17.125 -17.044
    3    HB1  ALA  63           HB1      ALA  63   8.691 -15.852 -18.770
    4    HB3  ALA  63           HB2      ALA  63   8.475 -16.572 -17.176
    5    HB2  ALA  63           HB3      ALA  63   8.881 -17.592 -18.555

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLY  64           H        GLY  64  11.173 -14.739 -19.560
    2    HA3  GLY  64           HA2      GLY  64  12.595 -14.709 -21.386
    3    HA2  GLY  64           HA3      GLY  64  13.130 -16.328 -20.958

  No H/Q in entry =           3
  In of MODEL   43
    1    H    GLU  65           H        GLU  65   9.719 -15.833 -21.247
    2    HA   GLU  65           HA       GLU  65   9.804 -17.182 -23.874
    3    HB2  GLU  65           HB2      GLU  65   7.835 -17.558 -21.618
    4    HB3  GLU  65           HB3      GLU  65   7.672 -18.276 -23.220
    5    HG2  GLU  65           HG2      GLU  65  10.080 -18.673 -21.427
    6    HG3  GLU  65           HG3      GLU  65   8.737 -19.808 -21.534

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLY  66           H        GLY  66   7.772 -17.041 -25.088
    2    HA3  GLY  66           HA2      GLY  66   7.155 -14.398 -25.801
    3    HA2  GLY  66           HA3      GLY  66   6.317 -15.834 -26.351

  No H/Q in entry =           3
  In of MODEL   43
    1    H    LYS  67           H        LYS  67   5.467 -16.667 -23.735
    2    HA   LYS  67           HA       LYS  67   3.017 -15.258 -23.599
    3    HB2  LYS  67           HB2      LYS  67   2.460 -16.822 -21.816
    4    HB3  LYS  67           HB3      LYS  67   3.252 -17.666 -23.154
    5    HG2  LYS  67           HG2      LYS  67   5.396 -17.586 -21.981
    6    HG3  LYS  67           HG3      LYS  67   4.673 -16.658 -20.670
    7    HD2  LYS  67           HD2      LYS  67   4.769 -18.928 -19.914
    8    HD3  LYS  67           HD3      LYS  67   3.081 -18.615 -20.328
    9    HE2  LYS  67           HE2      LYS  67   3.259 -19.781 -22.393
   10    HE3  LYS  67           HE3      LYS  67   5.020 -19.792 -22.323
   11    HZ2  LYS  67           HZ1      LYS  67   3.617 -21.877 -21.630
   12    HZ1  LYS  67           HZ2      LYS  67   3.544 -21.065 -20.141
   13    HZ3  LYS  67           HZ3      LYS  67   5.049 -21.474 -20.817

  No H/Q in entry =          13
  In of MODEL   43
    1    H    MET  68           H        MET  68   2.097 -14.022 -22.083
    2    HA   MET  68           HA       MET  68   3.638 -12.039 -20.831
    3    HB2  MET  68           HB2      MET  68   0.750 -12.827 -20.749
    4    HB3  MET  68           HB3      MET  68   1.357 -11.558 -19.684
    5    HG2  MET  68           HG2      MET  68   0.559 -10.525 -21.731
    6    HG3  MET  68           HG3      MET  68   2.319 -10.410 -21.696
    7    HE1  MET  68           HE1      MET  68   1.853  -9.747 -24.146
    8    HE3  MET  68           HE2      MET  68   2.347 -10.935 -25.348
    9    HE2  MET  68           HE3      MET  68   3.404 -10.581 -23.984

  No H/Q in entry =           9
  In of MODEL   43
    1    H    LYS  69           H        LYS  69   2.179 -14.982 -19.453
    2    HA   LYS  69           HA       LYS  69   2.217 -14.424 -16.778
    3    HB2  LYS  69           HB2      LYS  69   2.823 -17.010 -18.202
    4    HB3  LYS  69           HB3      LYS  69   2.612 -16.901 -16.452
    5    HG2  LYS  69           HG2      LYS  69   0.383 -15.907 -16.767
    6    HG3  LYS  69           HG3      LYS  69   0.589 -15.984 -18.516
    7    HD2  LYS  69           HD2      LYS  69   0.813 -18.455 -18.355
    8    HD3  LYS  69           HD3      LYS  69   0.510 -18.346 -16.619
    9    HE2  LYS  69           HE2      LYS  69  -1.394 -17.320 -18.743
   10    HE3  LYS  69           HE3      LYS  69  -1.546 -18.889 -17.955
   11    HZ3  LYS  69           HZ1      LYS  69  -2.792 -17.719 -16.520
   12    HZ2  LYS  69           HZ2      LYS  69  -2.072 -16.232 -16.915
   13    HZ1  LYS  69           HZ3      LYS  69  -1.297 -17.297 -15.842

  No H/Q in entry =          13
  In of MODEL   43
    1    H    VAL  70           H        VAL  70   3.595 -14.296 -15.075
    2    HA   VAL  70           HA       VAL  70   6.466 -14.870 -15.524
    3    HB   VAL  70           HB       VAL  70   6.971 -12.835 -14.168
    4   HG12  VAL  70          HG11      VAL  70   5.281 -11.997 -16.512
    5   HG11  VAL  70          HG12      VAL  70   6.729 -12.969 -16.772
    6   HG13  VAL  70          HG13      VAL  70   6.857 -11.384 -16.009
    7   HG22  VAL  70          HG21      VAL  70   4.953 -12.484 -12.922
    8   HG21  VAL  70          HG22      VAL  70   3.968 -12.510 -14.384
    9   HG23  VAL  70          HG23      VAL  70   5.025 -11.136 -14.058

  No H/Q in entry =           9
  In of MODEL   43
    1    H    SER  71           H        SER  71   7.633 -14.806 -13.323
    2    HA   SER  71           HA       SER  71   6.616 -16.814 -11.623
    3    HB2  SER  71           HB2      SER  71   9.022 -16.235 -11.797
    4    HB3  SER  71           HB3      SER  71   8.696 -14.701 -10.995
    5    HG   SER  71           HG       SER  71   8.370 -17.332  -9.983

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU  72           H        LEU  72   5.244 -16.733  -9.933
    2    HA   LEU  72           HA       LEU  72   3.652 -14.444  -9.512
    3    HB2  LEU  72           HB2      LEU  72   3.972 -16.982  -7.916
    4    HB3  LEU  72           HB3      LEU  72   2.772 -15.747  -7.548
    5    HG   LEU  72           HG       LEU  72   2.996 -17.057 -10.276
    6   HD13  LEU  72          HD11      LEU  72   2.491 -18.780  -8.607
    7   HD12  LEU  72          HD12      LEU  72   1.048 -18.429  -9.558
    8   HD11  LEU  72          HD13      LEU  72   1.212 -17.772  -7.929
    9   HD22  LEU  72          HD21      LEU  72   1.718 -15.096 -10.527
   10   HD21  LEU  72          HD22      LEU  72   1.009 -15.221  -8.926
   11   HD23  LEU  72          HD23      LEU  72   0.483 -16.308 -10.207

  No H/Q in entry =          11
  In of MODEL   43
    1    H    VAL  73           H        VAL  73   6.319 -15.826  -7.712
    2    HA   VAL  73           HA       VAL  73   6.216 -14.283  -5.389
    3    HB   VAL  73           HB       VAL  73   8.415 -15.046  -4.945
    4   HG13  VAL  73          HG11      VAL  73   8.190 -17.404  -5.309
    5   HG12  VAL  73          HG12      VAL  73   7.212 -17.153  -6.755
    6   HG11  VAL  73          HG13      VAL  73   6.554 -16.768  -5.164
    7   HG22  VAL  73          HG21      VAL  73   9.759 -14.498  -6.756
    8   HG21  VAL  73          HG22      VAL  73   8.602 -15.115  -7.935
    9   HG23  VAL  73          HG23      VAL  73   9.594 -16.236  -7.003

  No H/Q in entry =           9
  In of MODEL   43
    1    H    LEU  74           H        LEU  74   7.214 -13.388  -8.562
    2    HA   LEU  74           HA       LEU  74   9.122 -11.404  -8.065
    3    HB2  LEU  74           HB2      LEU  74   8.693 -12.175 -10.303
    4    HB3  LEU  74           HB3      LEU  74   7.019 -11.629 -10.217
    5    HG   LEU  74           HG       LEU  74   7.790  -9.290 -10.010
    6   HD12  LEU  74          HD11      LEU  74  10.291  -8.964 -10.587
    7   HD11  LEU  74          HD12      LEU  74  10.490 -10.642 -10.086
    8   HD13  LEU  74          HD13      LEU  74   9.900  -9.442  -8.936
    9   HD23  LEU  74          HD21      LEU  74   9.305 -10.368 -12.328
   10   HD22  LEU  74          HD22      LEU  74   8.126  -9.078 -12.246
   11   HD21  LEU  74          HD23      LEU  74   7.585 -10.742 -12.225

  No H/Q in entry =          11
  In of MODEL   43
    1    H    VAL  75           H        VAL  75   5.623 -11.081  -8.447
    2    HA   VAL  75           HA       VAL  75   5.475  -8.323  -7.875
    3    HB   VAL  75           HB       VAL  75   3.421 -10.502  -7.497
    4   HG11  VAL  75          HG11      VAL  75   3.178  -7.465  -7.339
    5   HG13  VAL  75          HG12      VAL  75   2.885  -8.607  -6.036
    6   HG12  VAL  75          HG13      VAL  75   1.810  -8.571  -7.426
    7   HG22  VAL  75          HG21      VAL  75   4.160 -10.113  -9.819
    8   HG21  VAL  75          HG22      VAL  75   3.871  -8.385  -9.630
    9   HG23  VAL  75          HG23      VAL  75   2.517  -9.515  -9.593

  No H/Q in entry =           9
  In of MODEL   43
    1    H    GLU  76           H        GLU  76   5.254 -11.194  -5.753
    2    HA   GLU  76           HA       GLU  76   4.742  -9.828  -3.342
    3    HB2  GLU  76           HB2      GLU  76   4.639 -12.319  -3.622
    4    HB3  GLU  76           HB3      GLU  76   6.390 -12.351  -3.737
    5    HG2  GLU  76           HG2      GLU  76   6.589 -11.471  -1.454
    6    HG3  GLU  76           HG3      GLU  76   4.845 -11.361  -1.310

  No H/Q in entry =           6
  In of MODEL   43
    1    H    ALA  77           H        ALA  77   7.829 -10.692  -4.876
    2    HA   ALA  77           HA       ALA  77   9.484  -9.610  -2.852
    3    HB2  ALA  77           HB1      ALA  77  11.275  -9.789  -4.434
    4    HB3  ALA  77           HB2      ALA  77  10.154  -9.771  -5.795
    5    HB1  ALA  77           HB3      ALA  77  10.204 -11.162  -4.712

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLN  78           H        GLN  78   8.092  -8.231  -5.785
    2    HA   GLN  78           HA       GLN  78   9.403  -5.729  -5.682
    3    HB2  GLN  78           HB2      GLN  78   8.138  -6.674  -7.646
    4    HB3  GLN  78           HB3      GLN  78   6.643  -6.318  -6.785
    5    HG2  GLN  78           HG2      GLN  78   7.252  -3.936  -6.697
    6    HG3  GLN  78           HG3      GLN  78   8.754  -4.284  -7.554
    7   HE21  GLN  78          HE21      GLN  78   6.829  -2.499  -8.681
    8   HE22  GLN  78          HE22      GLN  78   6.156  -3.231 -10.057

  No H/Q in entry =           8
  In of MODEL   43
    1    H    LEU  79           H        LEU  79   6.390  -6.909  -4.272
    2    HA   LEU  79           HA       LEU  79   5.349  -4.513  -3.283
    3    HB2  LEU  79           HB2      LEU  79   4.067  -6.585  -3.228
    4    HB3  LEU  79           HB3      LEU  79   5.215  -7.300  -2.099
    5    HG   LEU  79           HG       LEU  79   4.621  -5.659  -0.386
    6   HD13  LEU  79          HD11      LEU  79   4.132  -3.657  -1.451
    7   HD12  LEU  79          HD12      LEU  79   2.511  -4.207  -1.023
    8   HD11  LEU  79          HD13      LEU  79   3.110  -4.428  -2.665
    9   HD23  LEU  79          HD21      LEU  79   2.042  -6.193  -0.315
   10   HD22  LEU  79          HD22      LEU  79   3.202  -7.512  -0.190
   11   HD21  LEU  79          HD23      LEU  79   2.396  -7.196  -1.724

  No H/Q in entry =          11
  In of MODEL   43
    1    H    HIS  80           H        HIS  80   7.555  -6.805  -1.669
    2    HA   HIS  80           HA       HIS  80   7.797  -5.246   0.694
    3    HB2  HIS  80           HB2      HIS  80   9.184  -7.594  -0.481
    4    HB3  HIS  80           HB3      HIS  80  10.069  -6.677   0.739
    5    HD1  HIS  80           HD1      HIS  80   9.567  -7.308   3.081
    6    HD2  HIS  80           HD2      HIS  80   6.387  -8.223   0.545
    7    HE1  HIS  80           HE1      HIS  80   7.800  -8.432   4.520
    8    HE2  HIS  80           HE2      HIS  80   5.856  -8.994   2.982

  No H/Q in entry =           8
  In of MODEL   43
    1    H    LEU  81           H        LEU  81   9.833  -5.505  -2.199
    2    HA   LEU  81           HA       LEU  81  11.841  -3.727  -1.311
    3    HB2  LEU  81           HB2      LEU  81  10.958  -4.548  -4.078
    4    HB3  LEU  81           HB3      LEU  81  12.359  -3.518  -3.780
    5    HG   LEU  81           HG       LEU  81  11.997  -6.239  -2.496
    6   HD12  LEU  81          HD11      LEU  81  13.839  -6.845  -4.226
    7   HD11  LEU  81          HD12      LEU  81  13.259  -5.435  -5.110
    8   HD13  LEU  81          HD13      LEU  81  12.165  -6.775  -4.775
    9   HD23  LEU  81          HD21      LEU  81  14.620  -5.883  -2.460
   10   HD22  LEU  81          HD22      LEU  81  13.615  -5.131  -1.223
   11   HD21  LEU  81          HD23      LEU  81  14.191  -4.177  -2.589

  No H/Q in entry =          11
  In of MODEL   43
    1    H    MET  82           H        MET  82   8.927  -3.146  -3.278
    2    HA   MET  82           HA       MET  82   9.429  -0.415  -3.788
    3    HB2  MET  82           HB2      MET  82   6.893  -2.047  -3.678
    4    HB3  MET  82           HB3      MET  82   6.870  -0.325  -4.051
    5    HG2  MET  82           HG2      MET  82   8.516  -2.381  -5.561
    6    HG3  MET  82           HG3      MET  82   6.944  -1.785  -6.091
    7    HE3  MET  82           HE1      MET  82   7.351   1.670  -7.277
    8    HE2  MET  82           HE2      MET  82   6.964   1.447  -5.573
    9    HE1  MET  82           HE3      MET  82   6.327   0.321  -6.767

  No H/Q in entry =           9
  In of MODEL   43
    1    H    THR  83           H        THR  83   7.638  -2.027  -1.191
    2    HA   THR  83           HA       THR  83   6.739   0.315   0.115
    3    HB   THR  83           HB       THR  83   6.610  -1.251   2.140
    4    HG1  THR  83           HG1      THR  83   7.398  -3.191   1.927
    5   HG22  THR  83          HG21      THR  83   4.994  -2.849   0.665
    6   HG21  THR  83          HG22      THR  83   5.211  -1.523  -0.472
    7   HG23  THR  83          HG23      THR  83   4.551  -1.209   1.134

  No H/Q in entry =           7
  In of MODEL   43
    1    H    SER  84           H        SER  84   9.589  -1.738   0.673
    2    HA   SER  84           HA       SER  84  10.607  -0.281   2.863
    3    HB2  SER  84           HB2      SER  84  11.906  -2.115   0.860
    4    HB3  SER  84           HB3      SER  84  12.829  -1.341   2.146
    5    HG   SER  84           HG       SER  84  10.577  -3.063   2.393

  No H/Q in entry =           5
  In of MODEL   43
    1    H    MET  85           H        MET  85  11.388  -0.026  -0.619
    2    HA   MET  85           HA       MET  85  13.355   1.969  -0.360
    3    HB2  MET  85           HB2      MET  85  13.001   0.674  -2.422
    4    HB3  MET  85           HB3      MET  85  11.460   1.496  -2.669
    5    HG2  MET  85           HG2      MET  85  12.614   3.662  -2.803
    6    HG3  MET  85           HG3      MET  85  14.158   2.869  -2.505
    7    HE1  MET  85           HE1      MET  85  11.088   3.165  -4.467
    8    HE3  MET  85           HE2      MET  85  11.147   1.527  -5.112
    9    HE2  MET  85           HE3      MET  85  11.505   2.889  -6.165

  No H/Q in entry =           9
  In of MODEL   43
    1    H    LEU  86           H        LEU  86   9.866   2.251  -0.902
    2    HA   LEU  86           HA       LEU  86   9.763   5.062  -1.099
    3    HB2  LEU  86           HB2      LEU  86   7.948   3.372  -1.684
    4    HB3  LEU  86           HB3      LEU  86   7.604   3.287   0.044
    5    HG   LEU  86           HG       LEU  86   7.406   5.845  -0.024
    6   HD11  LEU  86          HD11      LEU  86   8.214   5.406  -2.716
    7   HD13  LEU  86          HD12      LEU  86   7.749   6.931  -1.967
    8   HD12  LEU  86          HD13      LEU  86   6.534   5.946  -2.779
    9   HD23  LEU  86          HD21      LEU  86   5.308   4.453  -1.699
   10   HD22  LEU  86          HD22      LEU  86   5.088   5.716  -0.491
   11   HD21  LEU  86          HD23      LEU  86   5.507   4.080   0.014

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ALA  87           H        ALA  87   9.302   2.891   1.653
    2    HA   ALA  87           HA       ALA  87   8.709   4.806   3.608
    3    HB1  ALA  87           HB1      ALA  87   9.557   1.998   3.544
    4    HB3  ALA  87           HB2      ALA  87   8.410   2.799   4.615
    5    HB2  ALA  87           HB3      ALA  87  10.135   2.857   4.974

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ARG  88           H        ARG  88  11.821   3.421   2.663
    2    HA   ARG  88           HA       ARG  88  13.394   4.831   4.503
    3    HB2  ARG  88           HB2      ARG  88  14.103   2.860   3.115
    4    HB3  ARG  88           HB3      ARG  88  14.252   3.948   1.738
    5    HG2  ARG  88           HG2      ARG  88  15.689   5.293   3.691
    6    HG3  ARG  88           HG3      ARG  88  16.030   3.610   4.082
    7    HD2  ARG  88           HD2      ARG  88  17.318   3.322   2.248
    8    HD3  ARG  88           HD3      ARG  88  16.178   4.172   1.200
    9    HE   ARG  88           HE       ARG  88  18.548   5.275   2.264
   10   HH21  ARG  88          HH11      ARG  88  18.864   7.497   2.061
   11   HH22  ARG  88          HH12      ARG  88  17.499   8.549   1.900
   12   HH11  ARG  88          HH21      ARG  88  15.201   5.979   1.951
   13   HH12  ARG  88          HH22      ARG  88  15.424   7.687   1.813

  No H/Q in entry =          13
  In of MODEL   43
    1    H    GLU  89           H        GLU  89  12.438   5.698   1.166
    2    HA   GLU  89           HA       GLU  89  13.953   8.079   1.011
    3    HB2  GLU  89           HB2      GLU  89  12.841   7.012  -0.941
    4    HB3  GLU  89           HB3      GLU  89  11.283   7.535  -0.300
    5    HG2  GLU  89           HG2      GLU  89  11.953   9.881  -0.469
    6    HG3  GLU  89           HG3      GLU  89  13.569   9.410  -0.988

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LEU  90           H        LEU  90  10.621   7.528   2.114
    2    HA   LEU  90           HA       LEU  90  10.062  10.257   2.670
    3    HB2  LEU  90           HB2      LEU  90   8.895   7.672   3.700
    4    HB3  LEU  90           HB3      LEU  90   8.238   9.260   4.109
    5    HG   LEU  90           HG       LEU  90   8.694   8.372   1.248
    6   HD12  LEU  90          HD11      LEU  90   6.165   8.007   1.290
    7   HD11  LEU  90          HD12      LEU  90   6.304   8.008   3.048
    8   HD13  LEU  90          HD13      LEU  90   7.148   6.785   2.097
    9   HD22  LEU  90          HD21      LEU  90   8.368  10.675   1.160
   10   HD21  LEU  90          HD22      LEU  90   7.368  10.701   2.611
   11   HD23  LEU  90          HD23      LEU  90   6.693  10.128   1.087

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  91           H        ILE  91  11.346   7.603   4.617
    2    HA   ILE  91           HA       ILE  91  11.445   8.983   7.080
    3    HB   ILE  91           HB       ILE  91  13.042   6.661   5.982
    4   HG12  ILE  91          HG12      ILE  91  11.003   6.811   8.223
    5   HG13  ILE  91          HG13      ILE  91  10.552   6.515   6.544
    6   HG22  ILE  91          HG21      ILE  91  13.491   6.467   8.628
    7   HG21  ILE  91          HG22      ILE  91  13.391   8.224   8.517
    8   HG23  ILE  91          HG23      ILE  91  14.591   7.348   7.567
    9   HD13  ILE  91          HD11      ILE  91  11.584   4.427   6.494
   10   HD12  ILE  91          HD12      ILE  91  10.976   4.485   8.148
   11   HD11  ILE  91          HD13      ILE  91  12.676   4.821   7.823

  No H/Q in entry =          11
  In of MODEL   43
    1    H    THR  92           H        THR  92  13.688   8.831   4.348
    2    HA   THR  92           HA       THR  92  15.823  10.261   5.520
    3    HB   THR  92           HB       THR  92  14.864  10.107   2.651
    4    HG1  THR  92           HG1      THR  92  15.719   8.224   3.073
    5   HG22  THR  92          HG21      THR  92  17.427  10.833   2.376
    6   HG21  THR  92          HG22      THR  92  17.093  11.657   3.899
    7   HG23  THR  92          HG23      THR  92  16.131  12.023   2.468

  No H/Q in entry =           7
  In of MODEL   43
    1    H    GLU  93           H        GLU  93  12.935  11.364   3.760
    2    HA   GLU  93           HA       GLU  93  13.490  14.134   3.865
    3    HB2  GLU  93           HB2      GLU  93  10.805  12.723   3.862
    4    HB3  GLU  93           HB3      GLU  93  11.072  14.424   3.484
    5    HG2  GLU  93           HG2      GLU  93  12.455  12.194   1.980
    6    HG3  GLU  93           HG3      GLU  93  10.904  12.852   1.476

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LEU  94           H        LEU  94  11.758  11.964   6.072
    2    HA   LEU  94           HA       LEU  94  10.905  13.908   7.931
    3    HB2  LEU  94           HB2      LEU  94  11.521  10.963   8.225
    4    HB3  LEU  94           HB3      LEU  94  10.923  11.937   9.565
    5    HG   LEU  94           HG       LEU  94   9.462  11.954   6.924
    6   HD11  LEU  94          HD11      LEU  94   9.559   9.745   8.940
    7   HD13  LEU  94          HD12      LEU  94   9.273   9.670   7.203
    8   HD12  LEU  94          HD13      LEU  94   7.978  10.174   8.287
    9   HD23  LEU  94          HD21      LEU  94   7.523  12.335   8.505
   10   HD22  LEU  94          HD22      LEU  94   8.743  13.606   8.546
   11   HD21  LEU  94          HD23      LEU  94   8.687  12.395   9.826

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  95           H        ILE  95  13.908  12.020   7.730
    2    HA   ILE  95           HA       ILE  95  15.041  12.971  10.149
    3    HB   ILE  95           HB       ILE  95  16.317  11.907   7.617
    4   HG12  ILE  95          HG12      ILE  95  16.015  10.716  10.388
    5   HG13  ILE  95          HG13      ILE  95  14.863  10.434   9.084
    6   HG21  ILE  95          HG21      ILE  95  17.538  12.745  10.265
    7   HG23  ILE  95          HG22      ILE  95  18.007  13.271   8.648
    8   HG22  ILE  95          HG23      ILE  95  18.333  11.618   9.167
    9   HD13  ILE  95          HD11      ILE  95  16.372   9.171   7.840
   10   HD12  ILE  95          HD12      ILE  95  16.837   8.737   9.482
   11   HD11  ILE  95          HD13      ILE  95  17.781   9.925   8.586

  No H/Q in entry =          11
  In of MODEL   43
    1    H    GLU  96           H        GLU  96  15.207  14.190   6.809
    2    HA   GLU  96           HA       GLU  96  17.020  16.297   7.291
    3    HB2  GLU  96           HB2      GLU  96  16.384  15.614   5.030
    4    HB3  GLU  96           HB3      GLU  96  14.731  16.149   5.313
    5    HG2  GLU  96           HG2      GLU  96  15.271  18.283   4.765
    6    HG3  GLU  96           HG3      GLU  96  16.560  18.308   5.958

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LEU  97           H        LEU  97  13.508  16.062   7.692
    2    HA   LEU  97           HA       LEU  97  13.048  18.793   8.316
    3    HB2  LEU  97           HB2      LEU  97  11.560  16.249   8.930
    4    HB3  LEU  97           HB3      LEU  97  11.020  17.791   9.589
    5    HG   LEU  97           HG       LEU  97  11.534  17.368   6.631
    6   HD12  LEU  97          HD11      LEU  97   9.013  17.203   6.492
    7   HD11  LEU  97          HD12      LEU  97   8.995  17.012   8.243
    8   HD13  LEU  97          HD13      LEU  97   9.801  15.811   7.234
    9   HD23  LEU  97          HD21      LEU  97   9.768  19.307   6.639
   10   HD22  LEU  97          HD22      LEU  97  11.440  19.692   7.043
   11   HD21  LEU  97          HD23      LEU  97  10.243  19.511   8.324

  No H/Q in entry =          11
  In of MODEL   43
    1    H    HIS  98           H        HIS  98  13.892  15.988  10.333
    2    HA   HIS  98           HA       HIS  98  13.695  17.259  12.841
    3    HB2  HIS  98           HB2      HIS  98  15.485  15.022  11.866
    4    HB3  HIS  98           HB3      HIS  98  15.462  15.569  13.544
    5    HD1  HIS  98           HD1      HIS  98  13.308  13.895  10.942
    6    HD2  HIS  98           HD2      HIS  98  13.153  14.834  15.001
    7    HE1  HIS  98           HE1      HIS  98  11.292  12.677  11.883
    8    HE2  HIS  98           HE2      HIS  98  11.178  13.240  14.351

  No H/Q in entry =           8
  In of MODEL   43
    1    H    GLU  99           H        GLU  99  16.270  17.168  10.428
    2    HA   GLU  99           HA       GLU  99  18.224  18.535  11.967
    3    HB2  GLU  99           HB2      GLU  99  18.739  17.244   9.909
    4    HB3  GLU  99           HB3      GLU  99  17.919  18.483   8.955
    5    HG2  GLU  99           HG2      GLU  99  19.497  20.180   9.750
    6    HG3  GLU  99           HG3      GLU  99  20.285  18.994  10.786

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LYS 100           H        LYS 100  15.703  19.651   9.724
    2    HA   LYS 100           HA       LYS 100  16.461  22.400   9.861
    3    HB2  LYS 100           HB2      LYS 100  13.853  21.071   9.091
    4    HB3  LYS 100           HB3      LYS 100  14.129  22.813   8.994
    5    HG2  LYS 100           HG2      LYS 100  16.120  22.384   7.546
    6    HG3  LYS 100           HG3      LYS 100  15.730  20.662   7.569
    7    HD2  LYS 100           HD2      LYS 100  13.536  21.136   6.548
    8    HD3  LYS 100           HD3      LYS 100  13.909  22.860   6.532
    9    HE2  LYS 100           HE2      LYS 100  15.887  22.400   5.091
   10    HE3  LYS 100           HE3      LYS 100  15.445  20.689   5.063
   11    HZ1  LYS 100           HZ1      LYS 100  13.598  22.852   4.202
   12    HZ3  LYS 100           HZ2      LYS 100  13.438  21.179   3.946
   13    HZ2  LYS 100           HZ3      LYS 100  14.644  22.053   3.131

  No H/Q in entry =          13
  In of MODEL   43
    1    H    LEU 101           H        LEU 101  14.376  20.335  11.819
    2    HA   LEU 101           HA       LEU 101  13.169  22.394  13.377
    3    HB2  LEU 101           HB2      LEU 101  13.647  19.453  13.779
    4    HB3  LEU 101           HB3      LEU 101  13.087  20.432  15.131
    5    HG   LEU 101           HG       LEU 101  11.690  20.489  12.450
    6   HD12  LEU 101          HD11      LEU 101  10.042  18.909  13.713
    7   HD11  LEU 101          HD12      LEU 101  11.433  18.519  14.721
    8   HD13  LEU 101          HD13      LEU 101  11.485  18.205  12.986
    9   HD21  LEU 101          HD21      LEU 101  10.999  21.286  15.292
   10   HD23  LEU 101          HD22      LEU 101   9.751  21.038  14.073
   11   HD22  LEU 101          HD23      LEU 101  10.971  22.288  13.839

  No H/Q in entry =          11
  In of MODEL   43
    1    H    LYS 102           H        LYS 102  16.327  21.827  12.970
    2    HA   LYS 102           HA       LYS 102  18.153  22.728  14.053
    3    HB2  LYS 102           HB2      LYS 102  16.309  24.224  15.164
    4    HB3  LYS 102           HB3      LYS 102  16.519  23.171  16.548
    5    HG2  LYS 102           HG2      LYS 102  18.395  25.201  15.384
    6    HG3  LYS 102           HG3      LYS 102  18.003  24.890  17.062
    7    HD2  LYS 102           HD2      LYS 102  19.710  22.992  15.399
    8    HD3  LYS 102           HD3      LYS 102  20.373  24.328  16.331
    9    HE2  LYS 102           HE2      LYS 102  20.001  21.778  17.309
   10    HE3  LYS 102           HE3      LYS 102  20.192  23.228  18.295
   11    HZ2  LYS 102           HZ1      LYS 102  18.236  21.921  18.903
   12    HZ1  LYS 102           HZ2      LYS 102  17.602  22.135  17.348
   13    HZ3  LYS 102           HZ3      LYS 102  17.806  23.472  18.369

  No H/Q in entry =          13
  In of MODEL   43
    1    H    ALA 103           H        ALA 103  16.083  21.107  16.466
    2    HA   ALA 103           HA       ALA 103  17.812  19.927  18.141
    3    HB2  ALA 103           HB1      ALA 103  16.255  17.898  18.132
    4    HB1  ALA 103           HB2      ALA 103  15.358  18.734  16.863
    5    HB3  ALA 103           HB3      ALA 103  15.514  19.465  18.459

  No H/Q in entry =           5
  In of MODEL   43
    1    H1   ALA   1           H3       ALA   1  -1.430  -7.378 -21.511
    2    H2   ALA   1           H2       ALA   1  -2.209  -8.821 -21.058
    3    H3   ALA   1           H1       ALA   1  -0.596  -8.853 -21.599
    4    HA   ALA   1           HA       ALA   1  -1.407  -9.343 -23.600
    5    HB1  ALA   1           HB1      ALA   1  -3.539 -10.086 -23.141
    6    HB2  ALA   1           HB2      ALA   1  -3.990  -8.585 -23.949
    7    HB3  ALA   1           HB3      ALA   1  -3.943  -8.656 -22.189

  No H/Q in entry =           7
  In of MODEL   43
    1    H    GLU   2           H        GLU   2  -2.236  -8.172 -25.602
    2    HA   GLU   2           HA       GLU   2  -0.855  -6.145 -26.477
    3    HB2  GLU   2           HB2      GLU   2  -3.859  -6.252 -26.820
    4    HB3  GLU   2           HB3      GLU   2  -2.740  -5.380 -27.864
    5    HG2  GLU   2           HG2      GLU   2  -2.203  -7.268 -29.006
    6    HG3  GLU   2           HG3      GLU   2  -1.907  -8.163 -27.521

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLU   3           H        GLU   3  -4.039  -4.924 -25.610
    2    HA   GLU   3           HA       GLU   3  -3.031  -2.352 -24.985
    3    HB2  GLU   3           HB2      GLU   3  -5.704  -3.700 -24.669
    4    HB3  GLU   3           HB3      GLU   3  -5.432  -2.078 -24.028
    5    HG2  GLU   3           HG2      GLU   3  -5.070  -1.156 -26.155
    6    HG3  GLU   3           HG3      GLU   3  -4.649  -2.709 -26.869

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LEU   4           H        LEU   4  -4.609  -4.721 -22.807
    2    HA   LEU   4           HA       LEU   4  -4.281  -3.478 -20.419
    3    HB2  LEU   4           HB2      LEU   4  -3.697  -6.414 -20.870
    4    HB3  LEU   4           HB3      LEU   4  -4.125  -5.666 -19.333
    5    HG   LEU   4           HG       LEU   4  -5.876  -5.773 -21.812
    6   HD13  LEU   4          HD11      LEU   4  -7.055  -7.501 -20.816
    7   HD12  LEU   4          HD12      LEU   4  -6.590  -7.028 -19.183
    8   HD11  LEU   4          HD13      LEU   4  -5.435  -7.861 -20.221
    9   HD23  LEU   4          HD21      LEU   4  -7.586  -4.975 -19.962
   10   HD22  LEU   4          HD22      LEU   4  -6.556  -3.794 -20.770
   11   HD21  LEU   4          HD23      LEU   4  -6.136  -4.372 -19.157

  No H/Q in entry =          11
  In of MODEL   43
    1    H    GLU   5           H        GLU   5  -1.745  -5.296 -22.120
    2    HA   GLU   5           HA       GLU   5   0.217  -4.978 -20.068
    3    HB2  GLU   5           HB2      GLU   5   0.343  -6.760 -21.786
    4    HB3  GLU   5           HB3      GLU   5   0.600  -5.531 -23.025
    5    HG2  GLU   5           HG2      GLU   5   2.660  -4.806 -21.913
    6    HG3  GLU   5           HG3      GLU   5   2.398  -5.979 -20.624

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLU   6           H        GLU   6  -0.414  -3.287 -23.126
    2    HA   GLU   6           HA       GLU   6   1.731  -1.426 -22.848
    3    HB2  GLU   6           HB2      GLU   6   0.643  -1.922 -25.018
    4    HB3  GLU   6           HB3      GLU   6  -0.839  -1.170 -24.431
    5    HG2  GLU   6           HG2      GLU   6   0.346   0.962 -24.128
    6    HG3  GLU   6           HG3      GLU   6   1.846   0.217 -24.677

  No H/Q in entry =           6
  In of MODEL   43
    1    H    VAL   7           H        VAL   7  -1.615  -1.535 -21.831
    2    HA   VAL   7           HA       VAL   7  -1.878   1.178 -21.009
    3    HB   VAL   7           HB       VAL   7  -3.316  -1.354 -20.174
    4   HG11  VAL   7          HG11      VAL   7  -3.734   1.533 -19.376
    5   HG13  VAL   7          HG12      VAL   7  -3.626   0.115 -18.334
    6   HG12  VAL   7          HG13      VAL   7  -5.053   0.361 -19.339
    7   HG21  VAL   7          HG21      VAL   7  -3.466  -0.291 -22.568
    8   HG23  VAL   7          HG22      VAL   7  -4.434   0.949 -21.770
    9   HG22  VAL   7          HG23      VAL   7  -4.958  -0.735 -21.740

  No H/Q in entry =           9
  In of MODEL   43
    1    H    VAL   8           H        VAL   8  -0.867  -1.787 -19.344
    2    HA   VAL   8           HA       VAL   8  -0.585  -0.692 -16.751
    3    HB   VAL   8           HB       VAL   8   0.851  -2.998 -18.088
    4   HG12  VAL   8          HG11      VAL   8   1.343  -3.656 -15.682
    5   HG11  VAL   8          HG12      VAL   8   0.850  -2.028 -15.218
    6   HG13  VAL   8          HG13      VAL   8   2.243  -2.259 -16.274
    7   HG22  VAL   8          HG21      VAL   8  -0.918  -4.317 -17.415
    8   HG21  VAL   8          HG22      VAL   8  -1.799  -2.794 -17.373
    9   HG23  VAL   8          HG23      VAL   8  -1.108  -3.450 -15.894

  No H/Q in entry =           9
  In of MODEL   43
    1    H    MET   9           H        MET   9   1.691  -0.976 -19.478
    2    HA   MET   9           HA       MET   9   3.953   0.100 -18.202
    3    HB2  MET   9           HB2      MET   9   3.023   0.038 -21.063
    4    HB3  MET   9           HB3      MET   9   4.480   0.923 -20.616
    5    HG2  MET   9           HG2      MET   9   5.208  -1.241 -19.416
    6    HG3  MET   9           HG3      MET   9   3.928  -2.032 -20.337
    7    HE3  MET   9           HE1      MET   9   4.895  -2.056 -23.880
    8    HE2  MET   9           HE2      MET   9   3.863  -0.786 -23.231
    9    HE1  MET   9           HE3      MET   9   3.756  -2.418 -22.579

  No H/Q in entry =           9
  In of MODEL   43
    1    H    GLY  10           H        GLY  10   1.264   1.662 -19.909
    2    HA3  GLY  10           HA2      GLY  10   2.193   4.328 -19.669
    3    HA2  GLY  10           HA3      GLY  10   0.511   3.847 -19.885

  No H/Q in entry =           3
  In of MODEL   43
    1    H    LEU  11           H        LEU  11   0.111   2.325 -17.596
    2    HA   LEU  11           HA       LEU  11  -0.458   4.305 -15.649
    3    HB2  LEU  11           HB2      LEU  11  -0.357   1.291 -15.479
    4    HB3  LEU  11           HB3      LEU  11  -0.889   2.313 -14.146
    5    HG   LEU  11           HG       LEU  11  -2.106   2.400 -16.919
    6   HD13  LEU  11          HD11      LEU  11  -2.671   0.254 -16.159
    7   HD12  LEU  11          HD12      LEU  11  -4.037   1.232 -15.629
    8   HD11  LEU  11          HD13      LEU  11  -2.785   0.772 -14.477
    9   HD22  LEU  11          HD21      LEU  11  -2.729   4.414 -15.927
   10   HD21  LEU  11          HD22      LEU  11  -2.659   3.756 -14.292
   11   HD23  LEU  11          HD23      LEU  11  -4.022   3.369 -15.343

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  12           H        ILE  12   2.115   1.867 -15.860
    2    HA   ILE  12           HA       ILE  12   3.294   2.429 -13.350
    3    HB   ILE  12           HB       ILE  12   4.539   1.366 -15.907
    4   HG12  ILE  12          HG12      ILE  12   2.601   0.106 -14.715
    5   HG13  ILE  12          HG13      ILE  12   4.039  -0.805 -15.126
    6   HG22  ILE  12          HG21      ILE  12   6.290   0.437 -14.348
    7   HG21  ILE  12          HG22      ILE  12   5.600   1.426 -13.062
    8   HG23  ILE  12          HG23      ILE  12   6.311   2.194 -14.481
    9   HD13  ILE  12          HD11      ILE  12   4.832  -0.604 -12.826
   10   HD12  ILE  12          HD12      ILE  12   3.201  -1.274 -12.833
   11   HD11  ILE  12          HD13      ILE  12   3.457   0.407 -12.420

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  13           H        ILE  13   3.907   3.685 -16.607
    2    HA   ILE  13           HA       ILE  13   6.019   5.433 -15.874
    3    HB   ILE  13           HB       ILE  13   4.001   5.497 -18.134
    4   HG12  ILE  13          HG12      ILE  13   5.821   3.646 -17.840
    5   HG13  ILE  13          HG13      ILE  13   5.600   4.390 -19.421
    6   HG23  ILE  13          HG21      ILE  13   4.790   7.780 -17.762
    7   HG22  ILE  13          HG22      ILE  13   5.519   7.146 -19.234
    8   HG21  ILE  13          HG23      ILE  13   6.468   7.235 -17.751
    9   HD11  ILE  13          HD11      ILE  13   7.670   5.360 -17.417
   10   HD13  ILE  13          HD12      ILE  13   7.518   5.807 -19.113
   11   HD12  ILE  13          HD13      ILE  13   8.013   4.175 -18.676

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ASN  14           H        ASN  14   2.508   5.886 -16.171
    2    HA   ASN  14           HA       ASN  14   2.430   8.634 -15.547
    3    HB2  ASN  14           HB2      ASN  14   0.562   6.967 -16.385
    4    HB3  ASN  14           HB3      ASN  14   0.229   6.793 -14.666
    5   HD21  ASN  14          HD21      ASN  14  -1.792   7.919 -16.119
    6   HD22  ASN  14          HD22      ASN  14  -1.876   9.593 -15.860

  No H/Q in entry =           6
  In of MODEL   43
    1    H    SER  15           H        SER  15   2.151   5.763 -13.460
    2    HA   SER  15           HA       SER  15   1.810   7.141 -11.020
    3    HB2  SER  15           HB2      SER  15   2.379   5.066  -9.957
    4    HB3  SER  15           HB3      SER  15   1.560   4.631 -11.454
    5    HG   SER  15           HG       SER  15   3.316   3.665 -12.032

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLY  16           H        GLY  16   4.712   6.070 -12.752
    2    HA3  GLY  16           HA2      GLY  16   6.613   6.858 -10.810
    3    HA2  GLY  16           HA3      GLY  16   6.932   6.651 -12.530

  No H/Q in entry =           3
  In of MODEL   43
    1    H    GLN  17           H        GLN  17   5.227   8.584 -13.615
    2    HA   GLN  17           HA       GLN  17   6.774  10.946 -13.305
    3    HB2  GLN  17           HB2      GLN  17   4.040  10.476 -14.526
    4    HB3  GLN  17           HB3      GLN  17   4.877  12.027 -14.595
    5    HG2  GLN  17           HG2      GLN  17   6.766  10.991 -15.755
    6    HG3  GLN  17           HG3      GLN  17   5.996   9.410 -15.636
    7   HE21  GLN  17          HE21      GLN  17   6.412   9.879 -18.183
    8   HE22  GLN  17          HE22      GLN  17   5.065  10.523 -18.992

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ALA  18           H        ALA  18   3.676   9.896 -11.975
    2    HA   ALA  18           HA       ALA  18   2.911  12.281 -10.726
    3    HB1  ALA  18           HB1      ALA  18   1.814   9.809 -10.946
    4    HB2  ALA  18           HB2      ALA  18   1.242  11.027  -9.809
    5    HB3  ALA  18           HB3      ALA  18   2.344   9.761  -9.264

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ARG  19           H        ARG  19   4.810   9.547  -9.420
    2    HA   ARG  19           HA       ARG  19   5.308  10.723  -6.899
    3    HB2  ARG  19           HB2      ARG  19   5.757   8.323  -7.412
    4    HB3  ARG  19           HB3      ARG  19   7.114   8.822  -8.425
    5    HG2  ARG  19           HG2      ARG  19   8.205   9.885  -6.498
    6    HG3  ARG  19           HG3      ARG  19   6.827   9.484  -5.476
    7    HD2  ARG  19           HD2      ARG  19   8.607   7.873  -5.097
    8    HD3  ARG  19           HD3      ARG  19   7.249   7.070  -5.890
    9    HE   ARG  19           HE       ARG  19   8.959   7.901  -7.927
   10   HH21  ARG  19          HH11      ARG  19  10.544   6.513  -8.759
   11   HH22  ARG  19          HH12      ARG  19  11.099   5.176  -7.813
   12   HH11  ARG  19          HH21      ARG  19   9.035   5.885  -5.139
   13   HH12  ARG  19          HH22      ARG  19  10.242   4.820  -5.763

  No H/Q in entry =          13
  In of MODEL   43
    1    H    SER  20           H        SER  20   7.148  10.763  -9.934
    2    HA   SER  20           HA       SER  20   9.368  12.212  -9.099
    3    HB2  SER  20           HB2      SER  20   9.431  11.328 -11.298
    4    HB3  SER  20           HB3      SER  20   7.921  12.118 -11.741
    5    HG   SER  20           HG       SER  20   8.946  14.037 -11.844

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU  21           H        LEU  21   6.261  13.434 -10.326
    2    HA   LEU  21           HA       LEU  21   6.893  16.189 -10.109
    3    HB2  LEU  21           HB2      LEU  21   4.241  14.733 -10.038
    4    HB3  LEU  21           HB3      LEU  21   4.389  16.488 -10.059
    5    HG   LEU  21           HG       LEU  21   5.635  14.696 -12.162
    6   HD13  LEU  21          HD11      LEU  21   3.736  15.189 -13.580
    7   HD12  LEU  21          HD12      LEU  21   3.044  16.257 -12.358
    8   HD11  LEU  21          HD13      LEU  21   3.124  14.521 -12.066
    9   HD22  LEU  21          HD21      LEU  21   6.722  16.772 -12.321
   10   HD21  LEU  21          HD22      LEU  21   5.302  17.681 -11.812
   11   HD23  LEU  21          HD23      LEU  21   5.375  17.007 -13.432

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ALA  22           H        ALA  22   5.395  13.889  -7.862
    2    HA   ALA  22           HA       ALA  22   4.750  15.697  -5.808
    3    HB3  ALA  22           HB1      ALA  22   4.025  13.294  -5.966
    4    HB2  ALA  22           HB2      ALA  22   4.594  13.781  -4.369
    5    HB1  ALA  22           HB3      ALA  22   5.639  12.833  -5.428

  No H/Q in entry =           5
  In of MODEL   43
    1    H    TYR  23           H        TYR  23   7.716  13.712  -6.214
    2    HA   TYR  23           HA       TYR  23   9.067  14.761  -3.956
    3    HB2  TYR  23           HB2      TYR  23   9.891  12.760  -5.099
    4    HB3  TYR  23           HB3      TYR  23  10.203  13.696  -6.560
    5    HD1  TYR  23           HD1      TYR  23  11.158  13.344  -2.972
    6    HD2  TYR  23           HD2      TYR  23  12.208  14.939  -6.822
    7    HE1  TYR  23           HE1      TYR  23  13.401  13.958  -2.108
    8    HE2  TYR  23           HE2      TYR  23  14.449  15.553  -5.957
    9    HH   TYR  23           HH       TYR  23  15.771  14.328  -3.246

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ALA  24           H        ALA  24   8.894  15.850  -7.329
    2    HA   ALA  24           HA       ALA  24  10.757  17.964  -7.077
    3    HB2  ALA  24           HB1      ALA  24  10.330  18.010  -9.290
    4    HB3  ALA  24           HB2      ALA  24   8.761  18.738  -8.946
    5    HB1  ALA  24           HB3      ALA  24   8.914  16.986  -9.067

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA  25           H        ALA  25   7.276  17.730  -6.483
    2    HA   ALA  25           HA       ALA  25   6.751  20.443  -5.930
    3    HB1  ALA  25           HB1      ALA  25   5.122  18.418  -6.134
    4    HB2  ALA  25           HB2      ALA  25   4.725  19.706  -4.995
    5    HB3  ALA  25           HB3      ALA  25   5.434  18.199  -4.411

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU  26           H        LEU  26   7.844  17.790  -3.859
    2    HA   LEU  26           HA       LEU  26   7.908  19.233  -1.428
    3    HB2  LEU  26           HB2      LEU  26   8.041  16.819  -1.410
    4    HB3  LEU  26           HB3      LEU  26   9.518  16.845  -2.370
    5    HG   LEU  26           HG       LEU  26  10.701  17.991  -0.526
    6   HD12  LEU  26          HD11      LEU  26   9.457  17.989   1.725
    7   HD11  LEU  26          HD12      LEU  26   7.979  17.824   0.779
    8   HD13  LEU  26          HD13      LEU  26   9.003  19.245   0.572
    9   HD21  LEU  26          HD21      LEU  26   9.200  15.503   0.347
   10   HD23  LEU  26          HD22      LEU  26  10.701  16.092   1.054
   11   HD22  LEU  26          HD23      LEU  26  10.677  15.525  -0.614

  No H/Q in entry =          11
  In of MODEL   43
    1    H    LYS  27           H        LYS  27  10.353  18.688  -3.931
    2    HA   LYS  27           HA       LYS  27  12.507  19.969  -2.693
    3    HB2  LYS  27           HB2      LYS  27  12.646  18.614  -4.775
    4    HB3  LYS  27           HB3      LYS  27  11.867  19.929  -5.653
    5    HG2  LYS  27           HG2      LYS  27  13.703  21.448  -5.068
    6    HG3  LYS  27           HG3      LYS  27  14.477  20.172  -4.120
    7    HD2  LYS  27           HD2      LYS  27  14.659  18.778  -6.166
    8    HD3  LYS  27           HD3      LYS  27  13.929  20.080  -7.106
    9    HE2  LYS  27           HE2      LYS  27  15.788  21.579  -6.486
   10    HE3  LYS  27           HE3      LYS  27  16.521  20.282  -5.537
   11    HZ3  LYS  27           HZ1      LYS  27  17.526  20.387  -7.716
   12    HZ2  LYS  27           HZ2      LYS  27  16.008  20.240  -8.468
   13    HZ1  LYS  27           HZ3      LYS  27  16.645  18.944  -7.572

  No H/Q in entry =          13
  In of MODEL   43
    1    H    GLN  28           H        GLN  28   9.877  21.298  -4.668
    2    HA   GLN  28           HA       GLN  28  10.794  23.966  -4.827
    3    HB2  GLN  28           HB2      GLN  28   8.117  22.632  -4.983
    4    HB3  GLN  28           HB3      GLN  28   8.180  24.388  -4.835
    5    HG2  GLN  28           HG2      GLN  28   8.163  23.470  -7.219
    6    HG3  GLN  28           HG3      GLN  28   9.455  24.607  -6.840
    7   HE21  GLN  28          HE21      GLN  28  11.633  23.624  -6.327
    8   HE22  GLN  28          HE22      GLN  28  12.031  22.120  -7.005

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ALA  29           H        ALA  29   8.872  22.253  -2.397
    2    HA   ALA  29           HA       ALA  29   8.273  24.444  -0.730
    3    HB2  ALA  29           HB1      ALA  29   7.558  22.870   0.840
    4    HB1  ALA  29           HB2      ALA  29   8.803  21.705   0.390
    5    HB3  ALA  29           HB3      ALA  29   7.420  21.970  -0.670

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LYS  30           H        LYS  30  11.041  22.222  -0.768
    2    HA   LYS  30           HA       LYS  30  12.325  23.210   1.540
    3    HB2  LYS  30           HB2      LYS  30  13.462  21.930  -0.955
    4    HB3  LYS  30           HB3      LYS  30  14.428  22.313   0.472
    5    HG2  LYS  30           HG2      LYS  30  12.888  20.910   1.846
    6    HG3  LYS  30           HG3      LYS  30  12.021  20.467   0.372
    7    HD2  LYS  30           HD2      LYS  30  14.089  19.510  -0.569
    8    HD3  LYS  30           HD3      LYS  30  14.975  19.968   0.888
    9    HE2  LYS  30           HE2      LYS  30  13.484  18.518   2.238
   10    HE3  LYS  30           HE3      LYS  30  12.629  18.041   0.766
   11    HZ2  LYS  30           HZ1      LYS  30  14.442  16.497   1.548
   12    HZ1  LYS  30           HZ2      LYS  30  15.562  17.701   1.099
   13    HZ3  LYS  30           HZ3      LYS  30  14.547  16.994  -0.070

  No H/Q in entry =          13
  In of MODEL   43
    1    H    GLN  31           H        GLN  31  12.221  24.396  -1.763
    2    HA   GLN  31           HA       GLN  31  14.338  26.328  -1.334
    3    HB2  GLN  31           HB2      GLN  31  12.312  26.329  -3.575
    4    HB3  GLN  31           HB3      GLN  31  13.920  27.052  -3.567
    5    HG2  GLN  31           HG2      GLN  31  14.423  24.368  -2.975
    6    HG3  GLN  31           HG3      GLN  31  13.129  24.286  -4.163
    7   HE21  GLN  31          HE21      GLN  31  15.989  23.539  -4.541
    8   HE22  GLN  31          HE22      GLN  31  16.554  24.516  -5.808

  No H/Q in entry =           8
  In of MODEL   43
    1    H    GLY  32           H        GLY  32  11.259  26.099  -0.211
    2    HA3  GLY  32           HA2      GLY  32  10.066  27.653   1.045
    3    HA2  GLY  32           HA3      GLY  32  11.175  28.905   0.498

  No H/Q in entry =           3
  In of MODEL   43
    1    H    ASP  33           H        ASP  33   9.862  26.966  -1.995
    2    HA   ASP  33           HA       ASP  33   8.166  29.206  -2.874
    3    HB2  ASP  33           HB2      ASP  33   9.311  26.799  -4.297
    4    HB3  ASP  33           HB3      ASP  33   8.146  27.891  -5.041

  No H/Q in entry =           4
  In of MODEL   43
    1    H    PHE  34           H        PHE  34   6.474  28.709  -1.321
    2    HA   PHE  34           HA       PHE  34   5.136  26.214  -1.224
    3    HB2  PHE  34           HB2      PHE  34   4.123  28.988  -0.565
    4    HB3  PHE  34           HB3      PHE  34   3.296  27.485  -0.153
    5    HD1  PHE  34           HD1      PHE  34   5.495  29.927   1.067
    6    HD2  PHE  34           HD2      PHE  34   4.888  25.675   1.029
    7    HE1  PHE  34           HE1      PHE  34   6.875  29.710   3.115
    8    HE2  PHE  34           HE2      PHE  34   6.270  25.462   3.075
    9    HZ   PHE  34           HZ       PHE  34   7.257  27.480   4.118

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ALA  35           H        ALA  35   4.672  29.061  -3.252
    2    HA   ALA  35           HA       ALA  35   2.139  28.398  -4.293
    3    HB3  ALA  35           HB1      ALA  35   3.183  29.798  -6.329
    4    HB2  ALA  35           HB2      ALA  35   4.385  30.186  -5.098
    5    HB1  ALA  35           HB3      ALA  35   2.685  30.568  -4.822

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA  36           H        ALA  36   5.389  27.774  -5.620
    2    HA   ALA  36           HA       ALA  36   4.442  26.317  -7.864
    3    HB3  ALA  36           HB1      ALA  36   6.603  26.476  -8.464
    4    HB2  ALA  36           HB2      ALA  36   7.092  25.462  -7.105
    5    HB1  ALA  36           HB3      ALA  36   6.954  27.208  -6.899

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA  37           H        ALA  37   5.390  25.355  -4.597
    2    HA   ALA  37           HA       ALA  37   5.382  22.564  -5.013
    3    HB2  ALA  37           HB1      ALA  37   5.073  24.361  -2.645
    4    HB1  ALA  37           HB2      ALA  37   6.231  23.062  -2.923
    5    HB3  ALA  37           HB3      ALA  37   4.572  22.682  -2.462

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LYS  38           H        LYS  38   2.803  24.734  -3.875
    2    HA   LYS  38           HA       LYS  38   0.734  22.886  -3.659
    3    HB2  LYS  38           HB2      LYS  38   1.036  25.648  -3.419
    4    HB3  LYS  38           HB3      LYS  38  -0.151  25.475  -4.706
    5    HG2  LYS  38           HG2      LYS  38  -1.588  24.133  -3.267
    6    HG3  LYS  38           HG3      LYS  38  -0.353  24.101  -2.002
    7    HD2  LYS  38           HD2      LYS  38  -0.583  26.436  -1.567
    8    HD3  LYS  38           HD3      LYS  38  -1.488  26.702  -3.058
    9    HE2  LYS  38           HE2      LYS  38  -3.006  26.719  -1.129
   10    HE3  LYS  38           HE3      LYS  38  -3.349  25.332  -2.168
   11    HZ3  LYS  38           HZ1      LYS  38  -2.610  23.881  -0.622
   12    HZ2  LYS  38           HZ2      LYS  38  -2.990  25.137   0.458
   13    HZ1  LYS  38           HZ3      LYS  38  -1.387  24.911  -0.054

  No H/Q in entry =          13
  In of MODEL   43
    1    H    ALA  39           H        ALA  39   1.702  24.791  -6.509
    2    HA   ALA  39           HA       ALA  39  -0.346  23.880  -8.224
    3    HB2  ALA  39           HB1      ALA  39   2.387  24.570  -9.260
    4    HB1  ALA  39           HB2      ALA  39   1.393  25.818  -8.508
    5    HB3  ALA  39           HB3      ALA  39   0.806  24.964  -9.935

  No H/Q in entry =           5
  In of MODEL   43
    1    H    MET  40           H        MET  40   2.910  22.640  -7.613
    2    HA   MET  40           HA       MET  40   2.862  20.609  -9.596
    3    HB2  MET  40           HB2      MET  40   4.450  20.873  -7.036
    4    HB3  MET  40           HB3      MET  40   4.732  19.616  -8.243
    5    HG2  MET  40           HG2      MET  40   4.743  22.569  -8.922
    6    HG3  MET  40           HG3      MET  40   6.201  21.694  -8.458
    7    HE3  MET  40           HE1      MET  40   7.133  19.481 -11.249
    8    HE2  MET  40           HE2      MET  40   6.563  19.159  -9.614
    9    HE1  MET  40           HE3      MET  40   7.637  20.524  -9.912

  No H/Q in entry =           9
  In of MODEL   43
    1    H    MET  41           H        MET  41   1.921  20.652  -6.179
    2    HA   MET  41           HA       MET  41   1.434  17.879  -5.892
    3    HB2  MET  41           HB2      MET  41   0.051  20.220  -4.562
    4    HB3  MET  41           HB3      MET  41  -0.080  18.542  -4.047
    5    HG2  MET  41           HG2      MET  41   2.627  18.812  -4.065
    6    HG3  MET  41           HG3      MET  41   2.154  20.464  -3.681
    7    HE2  MET  41           HE1      MET  41  -0.876  19.166  -1.972
    8    HE1  MET  41           HE2      MET  41  -0.083  20.692  -2.351
    9    HE3  MET  41           HE3      MET  41  -0.145  20.128  -0.680

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ASP  42           H        ASP  42  -0.644  20.563  -6.894
    2    HA   ASP  42           HA       ASP  42  -3.059  19.159  -7.043
    3    HB2  ASP  42           HB2      ASP  42  -2.396  21.740  -7.306
    4    HB3  ASP  42           HB3      ASP  42  -2.527  21.335  -9.014

  No H/Q in entry =           4
  In of MODEL   43
    1    H    GLN  43           H        GLN  43  -0.610  19.781  -9.529
    2    HA   GLN  43           HA       GLN  43  -1.958  18.428 -11.622
    3    HB2  GLN  43           HB2      GLN  43   0.988  18.998 -11.221
    4    HB3  GLN  43           HB3      GLN  43   0.297  18.338 -12.705
    5    HG2  GLN  43           HG2      GLN  43  -1.250  20.338 -12.768
    6    HG3  GLN  43           HG3      GLN  43  -0.319  21.017 -11.436
    7   HE21  GLN  43          HE21      GLN  43  -0.171  22.630 -13.529
    8   HE22  GLN  43          HE22      GLN  43   1.255  22.430 -14.424

  No H/Q in entry =           8
  In of MODEL   43
    1    H    SER  44           H        SER  44   0.394  17.341  -9.208
    2    HA   SER  44           HA       SER  44   0.783  14.736 -10.218
    3    HB2  SER  44           HB2      SER  44   1.636  16.201  -7.982
    4    HB3  SER  44           HB3      SER  44   0.793  14.805  -7.311
    5    HG   SER  44           HG       SER  44   2.918  14.222  -7.719

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ARG  45           H        ARG  45  -1.577  16.023  -7.904
    2    HA   ARG  45           HA       ARG  45  -2.926  13.641  -7.268
    3    HB2  ARG  45           HB2      ARG  45  -3.172  15.811  -6.089
    4    HB3  ARG  45           HB3      ARG  45  -4.030  16.455  -7.485
    5    HG2  ARG  45           HG2      ARG  45  -5.766  14.699  -7.207
    6    HG3  ARG  45           HG3      ARG  45  -4.922  14.109  -5.774
    7    HD2  ARG  45           HD2      ARG  45  -5.178  16.377  -4.731
    8    HD3  ARG  45           HD3      ARG  45  -6.163  16.872  -6.123
    9    HE   ARG  45           HE       ARG  45  -7.238  14.481  -5.080
   10   HH21  ARG  45          HH11      ARG  45  -9.084  14.529  -3.824
   11   HH22  ARG  45          HH12      ARG  45  -9.512  15.966  -2.965
   12   HH11  ARG  45          HH21      ARG  45  -6.759  17.742  -4.068
   13   HH12  ARG  45          HH22      ARG  45  -8.190  17.785  -3.101

  No H/Q in entry =          13
  In of MODEL   43
    1    H    MET  46           H        MET  46  -3.534  16.022  -9.835
    2    HA   MET  46           HA       MET  46  -5.843  14.802 -10.909
    3    HB2  MET  46           HB2      MET  46  -3.764  16.650 -12.093
    4    HB3  MET  46           HB3      MET  46  -5.150  16.080 -13.027
    5    HG2  MET  46           HG2      MET  46  -6.682  16.995 -11.337
    6    HG3  MET  46           HG3      MET  46  -5.314  17.540 -10.372
    7    HE2  MET  46           HE1      MET  46  -5.723  20.375 -10.461
    8    HE1  MET  46           HE2      MET  46  -7.180  19.396 -10.606
    9    HE3  MET  46           HE3      MET  46  -6.938  20.770 -11.684

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ALA  47           H        ALA  47  -2.401  14.382 -11.638
    2    HA   ALA  47           HA       ALA  47  -2.697  12.638 -13.842
    3    HB3  ALA  47           HB1      ALA  47  -0.539  13.570 -13.479
    4    HB2  ALA  47           HB2      ALA  47  -0.368  11.846 -13.135
    5    HB1  ALA  47           HB3      ALA  47  -0.493  13.002 -11.808

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU  48           H        LEU  48  -2.442  12.024 -10.364
    2    HA   LEU  48           HA       LEU  48  -2.482   9.182 -10.509
    3    HB2  LEU  48           HB2      LEU  48  -3.299  11.096  -8.310
    4    HB3  LEU  48           HB3      LEU  48  -3.174   9.349  -8.100
    5    HG   LEU  48           HG       LEU  48  -0.900  11.086  -9.088
    6   HD13  LEU  48          HD11      LEU  48  -1.214  11.861  -6.904
    7   HD12  LEU  48          HD12      LEU  48  -0.028  10.577  -6.690
    8   HD11  LEU  48          HD13      LEU  48  -1.724  10.284  -6.304
    9   HD22  LEU  48          HD21      LEU  48  -0.355   8.907  -9.715
   10   HD21  LEU  48          HD22      LEU  48  -1.222   8.182  -8.362
   11   HD23  LEU  48          HD23      LEU  48   0.334   8.966  -8.093

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ASN  49           H        ASN  49  -4.995  11.630 -10.138
    2    HA   ASN  49           HA       ASN  49  -7.153   9.927  -9.607
    3    HB2  ASN  49           HB2      ASN  49  -7.271  12.343  -9.290
    4    HB3  ASN  49           HB3      ASN  49  -7.077  12.610 -11.018
    5   HD21  ASN  49          HD21      ASN  49  -9.285  11.058  -8.660
    6   HD22  ASN  49          HD22      ASN  49 -10.683  11.281  -9.594

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLU  50           H        GLU  50  -5.872  11.133 -12.691
    2    HA   GLU  50           HA       GLU  50  -7.790   9.833 -14.345
    3    HB2  GLU  50           HB2      GLU  50  -6.352  11.676 -15.157
    4    HB3  GLU  50           HB3      GLU  50  -4.940  10.631 -15.003
    5    HG2  GLU  50           HG2      GLU  50  -5.871   9.069 -16.640
    6    HG3  GLU  50           HG3      GLU  50  -7.349  10.020 -16.743

  No H/Q in entry =           6
  In of MODEL   43
    1    H    ALA  51           H        ALA  51  -4.611   8.906 -13.110
    2    HA   ALA  51           HA       ALA  51  -4.415   6.450 -14.515
    3    HB2  ALA  51           HB1      ALA  51  -2.437   6.204 -13.398
    4    HB1  ALA  51           HB2      ALA  51  -3.145   6.621 -11.838
    5    HB3  ALA  51           HB3      ALA  51  -2.705   7.895 -12.975

  No H/Q in entry =           5
  In of MODEL   43
    1    H    HIS  52           H        HIS  52  -5.628   7.275 -11.279
    2    HA   HIS  52           HA       HIS  52  -6.272   4.657 -10.441
    3    HB2  HIS  52           HB2      HIS  52  -6.184   6.581  -8.911
    4    HB3  HIS  52           HB3      HIS  52  -7.597   7.277  -9.704
    5    HD1  HIS  52           HD1      HIS  52  -9.845   5.786  -9.567
    6    HD2  HIS  52           HD2      HIS  52  -6.790   4.704  -6.947
    7    HE1  HIS  52           HE1      HIS  52 -10.905   4.314  -7.800
    8    HE2  HIS  52           HE2      HIS  52  -9.055   3.647  -6.193

  No H/Q in entry =           8
  In of MODEL   43
    1    H    LEU  53           H        LEU  53  -8.123   7.072 -12.255
    2    HA   LEU  53           HA       LEU  53 -10.604   5.734 -12.281
    3    HB2  LEU  53           HB2      LEU  53  -9.341   7.729 -14.149
    4    HB3  LEU  53           HB3      LEU  53 -10.925   7.033 -14.482
    5    HG   LEU  53           HG       LEU  53 -10.264   8.365 -11.837
    6   HD12  LEU  53          HD11      LEU  53 -11.509  10.335 -12.773
    7   HD11  LEU  53          HD12      LEU  53 -11.456   9.557 -14.356
    8   HD13  LEU  53          HD13      LEU  53  -9.963  10.046 -13.561
    9   HD21  LEU  53          HD21      LEU  53 -12.790   7.450 -13.221
   10   HD23  LEU  53          HD22      LEU  53 -12.844   8.726 -12.011
   11   HD22  LEU  53          HD23      LEU  53 -12.279   7.127 -11.570

  No H/Q in entry =          11
  In of MODEL   43
    1    H    VAL  54           H        VAL  54  -7.832   5.577 -14.495
    2    HA   VAL  54           HA       VAL  54  -9.008   3.775 -16.339
    3    HB   VAL  54           HB       VAL  54  -6.115   4.337 -15.636
    4   HG12  VAL  54          HG11      VAL  54  -5.829   3.246 -18.018
    5   HG11  VAL  54          HG12      VAL  54  -7.347   2.439 -17.623
    6   HG13  VAL  54          HG13      VAL  54  -5.935   2.215 -16.591
    7   HG22  VAL  54          HG21      VAL  54  -6.912   6.261 -16.697
    8   HG21  VAL  54          HG22      VAL  54  -8.081   5.372 -17.670
    9   HG23  VAL  54          HG23      VAL  54  -6.370   5.321 -18.086

  No H/Q in entry =           9
  In of MODEL   43
    1    H    GLN  55           H        GLN  55  -7.023   3.279 -13.421
    2    HA   GLN  55           HA       GLN  55  -6.880   0.463 -13.663
    3    HB2  GLN  55           HB2      GLN  55  -5.354   1.394 -12.136
    4    HB3  GLN  55           HB3      GLN  55  -6.594   2.342 -11.320
    5    HG2  GLN  55           HG2      GLN  55  -7.262   0.579 -10.000
    6    HG3  GLN  55           HG3      GLN  55  -7.005  -0.610 -11.270
    7   HE21  GLN  55          HE21      GLN  55  -5.360  -2.028 -10.756
    8   HE22  GLN  55          HE22      GLN  55  -3.990  -1.647  -9.834

  No H/Q in entry =           8
  In of MODEL   43
    1    H    THR  56           H        THR  56  -9.263   2.591 -12.078
    2    HA   THR  56           HA       THR  56 -10.824   0.686 -10.792
    3    HB   THR  56           HB       THR  56 -11.948   3.047 -12.318
    4    HG1  THR  56           HG1      THR  56 -10.360   2.871 -10.047
    5   HG23  THR  56          HG21      THR  56 -13.778   2.900 -10.893
    6   HG22  THR  56          HG22      THR  56 -12.866   2.051  -9.643
    7   HG21  THR  56          HG23      THR  56 -13.373   1.198 -11.103

  No H/Q in entry =           7
  In of MODEL   43
    1    H    LYS  57           H        LYS  57 -11.017   1.749 -14.185
    2    HA   LYS  57           HA       LYS  57 -13.137   0.020 -14.947
    3    HB2  LYS  57           HB2      LYS  57 -12.332   1.963 -16.285
    4    HB3  LYS  57           HB3      LYS  57 -10.825   1.109 -16.590
    5    HG2  LYS  57           HG2      LYS  57 -12.224   0.814 -18.523
    6    HG3  LYS  57           HG3      LYS  57 -12.165  -0.726 -17.675
    7    HD2  LYS  57           HD2      LYS  57 -14.355  -0.424 -16.769
    8    HD3  LYS  57           HD3      LYS  57 -14.390   1.278 -17.224
    9    HE2  LYS  57           HE2      LYS  57 -15.744   0.057 -18.825
   10    HE3  LYS  57           HE3      LYS  57 -14.268   0.550 -19.653
   11    HZ1  LYS  57           HZ1      LYS  57 -14.060  -1.990 -18.321
   12    HZ3  LYS  57           HZ2      LYS  57 -13.617  -1.547 -19.901
   13    HZ2  LYS  57           HZ3      LYS  57 -15.227  -1.967 -19.551

  No H/Q in entry =          13
  In of MODEL   43
    1    H    LEU  58           H        LEU  58  -9.626  -0.348 -14.859
    2    HA   LEU  58           HA       LEU  58  -9.579  -2.871 -16.135
    3    HB2  LEU  58           HB2      LEU  58  -7.583  -1.535 -14.317
    4    HB3  LEU  58           HB3      LEU  58  -7.288  -3.056 -15.161
    5    HG   LEU  58           HG       LEU  58  -8.076  -0.472 -16.544
    6   HD11  LEU  58          HD11      LEU  58  -5.415  -1.658 -15.825
    7   HD13  LEU  58          HD12      LEU  58  -5.940   0.024 -15.789
    8   HD12  LEU  58          HD13      LEU  58  -5.574  -0.749 -17.328
    9   HD22  LEU  58          HD21      LEU  58  -8.611  -2.052 -18.132
   10   HD21  LEU  58          HD22      LEU  58  -7.554  -3.277 -17.435
   11   HD23  LEU  58          HD23      LEU  58  -6.877  -1.997 -18.441

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  59           H        ILE  59 -10.444  -1.967 -12.896
    2    HA   ILE  59           HA       ILE  59 -10.051  -4.723 -11.931
    3    HB   ILE  59           HB       ILE  59  -9.663  -2.437 -10.542
    4   HG12  ILE  59          HG12      ILE  59 -10.985  -4.816  -9.219
    5   HG13  ILE  59          HG13      ILE  59  -9.335  -4.854  -9.789
    6   HG23  ILE  59          HG21      ILE  59 -11.518  -1.778  -9.247
    7   HG22  ILE  59          HG22      ILE  59 -12.418  -3.233  -9.607
    8   HG21  ILE  59          HG23      ILE  59 -12.217  -1.985 -10.835
    9   HD12  ILE  59          HD11      ILE  59 -10.477  -2.972  -7.740
   10   HD11  ILE  59          HD12      ILE  59  -8.851  -2.828  -8.393
   11   HD13  ILE  59          HD13      ILE  59  -9.299  -4.247  -7.445

  No H/Q in entry =          11
  In of MODEL   43
    1    H    GLU  60           H        GLU  60 -12.643  -2.458 -12.773
    2    HA   GLU  60           HA       GLU  60 -14.809  -4.008 -11.770
    3    HB2  GLU  60           HB2      GLU  60 -15.034  -1.633 -12.393
    4    HB3  GLU  60           HB3      GLU  60 -14.737  -2.044 -14.080
    5    HG2  GLU  60           HG2      GLU  60 -16.761  -3.466 -14.088
    6    HG3  GLU  60           HG3      GLU  60 -17.065  -3.039 -12.417

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLY  61           H        GLY  61 -13.110  -3.978 -14.871
    2    HA3  GLY  61           HA2      GLY  61 -14.775  -6.258 -15.763
    3    HA2  GLY  61           HA3      GLY  61 -13.940  -5.144 -16.840

  No H/Q in entry =           3
  In of MODEL   43
    1    H    ASP  62           H        ASP  62 -12.568  -6.556 -13.936
    2    HA   ASP  62           HA       ASP  62 -10.112  -7.191 -14.815
    3    HB2  ASP  62           HB2      ASP  62 -10.095  -9.007 -13.132
    4    HB3  ASP  62           HB3      ASP  62 -10.851  -7.542 -12.516

  No H/Q in entry =           4
  In of MODEL   43
    1    H    ALA  63           H        ALA  63 -12.974  -9.288 -15.384
    2    HA   ALA  63           HA       ALA  63 -11.627 -10.473 -17.704
    3    HB1  ALA  63           HB1      ALA  63 -12.518 -12.089 -15.289
    4    HB2  ALA  63           HB2      ALA  63 -10.886 -11.986 -15.946
    5    HB3  ALA  63           HB3      ALA  63 -12.155 -12.801 -16.860

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLY  64           H        GLY  64 -14.397 -10.073 -15.630
    2    HA3  GLY  64           HA2      GLY  64 -16.626  -9.780 -16.176
    3    HA2  GLY  64           HA3      GLY  64 -16.219 -10.039 -17.866

  No H/Q in entry =           3
  In of MODEL   43
    1    H    GLU  65           H        GLU  65 -15.142 -12.390 -15.560
    2    HA   GLU  65           HA       GLU  65 -17.287 -14.201 -16.479
    3    HB2  GLU  65           HB2      GLU  65 -14.377 -14.824 -15.977
    4    HB3  GLU  65           HB3      GLU  65 -15.615 -16.040 -16.292
    5    HG2  GLU  65           HG2      GLU  65 -14.972 -13.729 -18.146
    6    HG3  GLU  65           HG3      GLU  65 -14.366 -15.372 -18.350

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLY  66           H        GLY  66 -17.555 -16.128 -15.140
    2    HA3  GLY  66           HA2      GLY  66 -18.348 -15.505 -12.523
    3    HA2  GLY  66           HA3      GLY  66 -18.261 -17.113 -13.215

  No H/Q in entry =           3
  In of MODEL   43
    1    H    LYS  67           H        LYS  67 -15.443 -17.054 -13.726
    2    HA   LYS  67           HA       LYS  67 -14.515 -18.043 -11.246
    3    HB2  LYS  67           HB2      LYS  67 -12.430 -18.472 -12.440
    4    HB3  LYS  67           HB3      LYS  67 -13.823 -18.941 -13.423
    5    HG2  LYS  67           HG2      LYS  67 -13.720 -16.824 -14.644
    6    HG3  LYS  67           HG3      LYS  67 -12.391 -16.275 -13.624
    7    HD2  LYS  67           HD2      LYS  67 -11.405 -17.065 -15.664
    8    HD3  LYS  67           HD3      LYS  67 -11.085 -18.298 -14.441
    9    HE2  LYS  67           HE2      LYS  67 -12.810 -19.718 -15.266
   10    HE3  LYS  67           HE3      LYS  67 -13.513 -18.424 -16.236
   11    HZ2  LYS  67           HZ1      LYS  67 -11.972 -20.220 -17.309
   12    HZ1  LYS  67           HZ2      LYS  67 -10.735 -19.203 -16.745
   13    HZ3  LYS  67           HZ3      LYS  67 -11.905 -18.605 -17.821

  No H/Q in entry =          13
  In of MODEL   43
    1    H    MET  68           H        MET  68 -12.982 -17.406  -9.866
    2    HA   MET  68           HA       MET  68 -12.824 -14.694  -9.165
    3    HB2  MET  68           HB2      MET  68 -11.424 -17.184  -8.274
    4    HB3  MET  68           HB3      MET  68 -10.917 -15.613  -7.654
    5    HG2  MET  68           HG2      MET  68 -12.579 -16.514  -6.140
    6    HG3  MET  68           HG3      MET  68 -13.309 -15.170  -7.020
    7    HE1  MET  68           HE1      MET  68 -15.398 -16.221  -5.938
    8    HE3  MET  68           HE2      MET  68 -16.492 -17.049  -7.044
    9    HE2  MET  68           HE3      MET  68 -15.793 -15.497  -7.505

  No H/Q in entry =           9
  In of MODEL   43
    1    H    LYS  69           H        LYS  69 -10.512 -16.692 -10.995
    2    HA   LYS  69           HA       LYS  69  -8.235 -15.188 -10.811
    3    HB2  LYS  69           HB2      LYS  69  -9.325 -16.735 -13.157
    4    HB3  LYS  69           HB3      LYS  69  -7.689 -16.075 -13.117
    5    HG2  LYS  69           HG2      LYS  69  -7.220 -17.330 -11.051
    6    HG3  LYS  69           HG3      LYS  69  -8.861 -17.970 -11.058
    7    HD2  LYS  69           HD2      LYS  69  -8.409 -19.040 -13.258
    8    HD3  LYS  69           HD3      LYS  69  -6.746 -18.456 -13.175
    9    HE2  LYS  69           HE2      LYS  69  -8.028 -20.230 -11.078
   10    HE3  LYS  69           HE3      LYS  69  -7.005 -20.824 -12.385
   11    HZ3  LYS  69           HZ1      LYS  69  -5.410 -20.515 -10.843
   12    HZ2  LYS  69           HZ2      LYS  69  -6.288 -19.337  -9.991
   13    HZ1  LYS  69           HZ3      LYS  69  -5.453 -18.917 -11.411

  No H/Q in entry =          13
  In of MODEL   43
    1    H    VAL  70           H        VAL  70  -7.296 -13.393 -11.642
    2    HA   VAL  70           HA       VAL  70  -8.808 -11.776 -13.611
    3    HB   VAL  70           HB       VAL  70  -8.130  -9.762 -12.307
    4   HG12  VAL  70          HG11      VAL  70  -9.659 -11.608 -10.484
    5   HG11  VAL  70          HG12      VAL  70 -10.339 -11.129 -12.040
    6   HG13  VAL  70          HG13      VAL  70  -9.956  -9.905 -10.830
    7   HG22  VAL  70          HG21      VAL  70  -6.231 -10.509 -11.054
    8   HG21  VAL  70          HG22      VAL  70  -7.115 -11.894 -10.413
    9   HG23  VAL  70          HG23      VAL  70  -7.496 -10.267  -9.850

  No H/Q in entry =           9
  In of MODEL   43
    1    H    SER  71           H        SER  71  -7.340  -9.943 -14.414
    2    HA   SER  71           HA       SER  71  -5.072 -11.010 -15.708
    3    HB2  SER  71           HB2      SER  71  -6.333  -9.032 -16.529
    4    HB3  SER  71           HB3      SER  71  -5.733  -8.105 -15.156
    5    HG   SER  71           HG       SER  71  -4.278  -9.260 -17.294

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU  72           H        LEU  72  -3.019 -11.232 -15.080
    2    HA   LEU  72           HA       LEU  72  -2.326 -10.990 -12.364
    3    HB2  LEU  72           HB2      LEU  72  -0.638 -11.398 -14.828
    4    HB3  LEU  72           HB3      LEU  72   0.003 -11.462 -13.189
    5    HG   LEU  72           HG       LEU  72  -2.318 -13.186 -14.113
    6   HD13  LEU  72          HD11      LEU  72  -0.335 -13.729 -15.454
    7   HD12  LEU  72          HD12      LEU  72  -0.638 -15.010 -14.281
    8   HD11  LEU  72          HD13      LEU  72   0.644 -13.834 -13.989
    9   HD22  LEU  72          HD21      LEU  72  -2.320 -13.197 -11.761
   10   HD21  LEU  72          HD22      LEU  72  -0.572 -13.067 -11.649
   11   HD23  LEU  72          HD23      LEU  72  -1.312 -14.589 -12.139

  No H/Q in entry =          11
  In of MODEL   43
    1    H    VAL  73           H        VAL  73  -1.621  -8.978 -15.150
    2    HA   VAL  73           HA       VAL  73   0.261  -7.240 -14.040
    3    HB   VAL  73           HB       VAL  73  -0.144  -5.836 -15.907
    4   HG13  VAL  73          HG11      VAL  73  -0.016  -7.400 -17.724
    5   HG12  VAL  73          HG12      VAL  73  -0.917  -8.617 -16.822
    6   HG11  VAL  73          HG13      VAL  73   0.721  -8.187 -16.330
    7   HG22  VAL  73          HG21      VAL  73  -2.421  -5.361 -15.965
    8   HG21  VAL  73          HG22      VAL  73  -2.882  -7.050 -15.764
    9   HG23  VAL  73          HG23      VAL  73  -2.287  -6.479 -17.323

  No H/Q in entry =           9
  In of MODEL   43
    1    H    LEU  74           H        LEU  74  -3.138  -7.411 -13.510
    2    HA   LEU  74           HA       LEU  74  -3.807  -4.762 -12.919
    3    HB2  LEU  74           HB2      LEU  74  -5.503  -6.463 -13.099
    4    HB3  LEU  74           HB3      LEU  74  -4.811  -7.360 -11.749
    5    HG   LEU  74           HG       LEU  74  -5.326  -5.479 -10.232
    6   HD12  LEU  74          HD11      LEU  74  -6.936  -3.730 -11.236
    7   HD11  LEU  74          HD12      LEU  74  -6.327  -4.253 -12.806
    8   HD13  LEU  74          HD13      LEU  74  -5.223  -3.554 -11.620
    9   HD23  LEU  74          HD21      LEU  74  -7.856  -5.956 -11.721
   10   HD22  LEU  74          HD22      LEU  74  -7.504  -6.083 -10.011
   11   HD21  LEU  74          HD23      LEU  74  -6.988  -7.354 -11.092

  No H/Q in entry =          11
  In of MODEL   43
    1    H    VAL  75           H        VAL  75  -2.741  -7.319 -10.733
    2    HA   VAL  75           HA       VAL  75  -2.589  -5.751  -8.397
    3    HB   VAL  75           HB       VAL  75  -1.048  -8.227  -9.162
    4   HG11  VAL  75          HG11      VAL  75  -1.292  -6.748  -6.502
    5   HG13  VAL  75          HG12      VAL  75   0.177  -6.976  -7.439
    6   HG12  VAL  75          HG13      VAL  75  -0.604  -8.359  -6.693
    7   HG22  VAL  75          HG21      VAL  75  -3.486  -8.512  -8.993
    8   HG21  VAL  75          HG22      VAL  75  -3.489  -7.703  -7.425
    9   HG23  VAL  75          HG23      VAL  75  -2.700  -9.272  -7.609

  No H/Q in entry =           9
  In of MODEL   43
    1    H    GLU  76           H        GLU  76  -0.146  -6.485 -10.908
    2    HA   GLU  76           HA       GLU  76   2.007  -5.094  -9.739
    3    HB2  GLU  76           HB2      GLU  76   2.183  -6.594 -11.741
    4    HB3  GLU  76           HB3      GLU  76   1.360  -5.371 -12.697
    5    HG2  GLU  76           HG2      GLU  76   3.185  -3.782 -12.303
    6    HG3  GLU  76           HG3      GLU  76   4.016  -4.934 -11.274

  No H/Q in entry =           6
  In of MODEL   43
    1    H    ALA  77           H        ALA  77  -0.526  -3.948 -11.957
    2    HA   ALA  77           HA       ALA  77   0.421  -1.287 -12.139
    3    HB2  ALA  77           HB1      ALA  77  -1.688  -0.768 -13.126
    4    HB3  ALA  77           HB2      ALA  77  -2.478  -2.126 -12.324
    5    HB1  ALA  77           HB3      ALA  77  -1.317  -2.422 -13.619

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLN  78           H        GLN  78  -1.840  -2.868  -9.939
    2    HA   GLN  78           HA       GLN  78  -2.699  -0.556  -8.558
    3    HB2  GLN  78           HB2      GLN  78  -3.766  -2.839  -8.472
    4    HB3  GLN  78           HB3      GLN  78  -2.433  -3.362  -7.447
    5    HG2  GLN  78           HG2      GLN  78  -3.006  -1.621  -5.807
    6    HG3  GLN  78           HG3      GLN  78  -4.340  -1.089  -6.829
    7   HE21  GLN  78          HE21      GLN  78  -4.811  -2.057  -4.168
    8   HE22  GLN  78          HE22      GLN  78  -5.649  -3.529  -4.281

  No H/Q in entry =           8
  In of MODEL   43
    1    H    LEU  79           H        LEU  79   0.014  -2.762  -8.072
    2    HA   LEU  79           HA       LEU  79   0.953  -1.835  -5.611
    3    HB2  LEU  79           HB2      LEU  79   1.867  -3.834  -6.660
    4    HB3  LEU  79           HB3      LEU  79   2.508  -2.878  -7.993
    5    HG   LEU  79           HG       LEU  79   4.030  -1.704  -6.482
    6   HD13  LEU  79          HD11      LEU  79   3.003  -1.464  -4.425
    7   HD12  LEU  79          HD12      LEU  79   4.103  -2.793  -4.064
    8   HD11  LEU  79          HD13      LEU  79   2.406  -3.124  -4.407
    9   HD23  LEU  79          HD21      LEU  79   5.271  -3.825  -5.556
   10   HD22  LEU  79          HD22      LEU  79   5.079  -3.639  -7.297
   11   HD21  LEU  79          HD23      LEU  79   4.013  -4.723  -6.408

  No H/Q in entry =          11
  In of MODEL   43
    1    H    HIS  80           H        HIS  80   1.832  -0.721  -8.883
    2    HA   HIS  80           HA       HIS  80   3.595   1.304  -7.956
    3    HB2  HIS  80           HB2      HIS  80   2.342   0.572 -10.546
    4    HB3  HIS  80           HB3      HIS  80   2.905   2.235 -10.380
    5    HD1  HIS  80           HD1      HIS  80   5.305   2.577 -10.882
    6    HD2  HIS  80           HD2      HIS  80   4.546  -1.342  -9.676
    7    HE1  HIS  80           HE1      HIS  80   7.519   1.339 -11.021
    8    HE2  HIS  80           HE2      HIS  80   7.068  -1.052 -10.289

  No H/Q in entry =           8
  In of MODEL   43
    1    H    LEU  81           H        LEU  81   0.198   1.396  -8.967
    2    HA   LEU  81           HA       LEU  81  -0.132   4.185  -8.655
    3    HB2  LEU  81           HB2      LEU  81  -2.105   1.903  -8.581
    4    HB3  LEU  81           HB3      LEU  81  -2.590   3.597  -8.502
    5    HG   LEU  81           HG       LEU  81  -0.856   2.467 -10.716
    6   HD12  LEU  81          HD11      LEU  81  -3.081   2.737 -12.037
    7   HD11  LEU  81          HD12      LEU  81  -3.850   2.664 -10.452
    8   HD13  LEU  81          HD13      LEU  81  -2.876   1.311 -11.023
    9   HD23  LEU  81          HD21      LEU  81  -1.982   4.584 -11.836
   10   HD22  LEU  81          HD22      LEU  81  -0.579   4.787 -10.791
   11   HD21  LEU  81          HD23      LEU  81  -2.195   5.109 -10.167

  No H/Q in entry =          11
  In of MODEL   43
    1    H    MET  82           H        MET  82  -0.761   1.498  -6.396
    2    HA   MET  82           HA       MET  82  -1.862   3.076  -4.328
    3    HB2  MET  82           HB2      MET  82  -0.437   0.415  -4.340
    4    HB3  MET  82           HB3      MET  82  -1.042   1.137  -2.851
    5    HG2  MET  82           HG2      MET  82  -2.743   0.597  -5.305
    6    HG3  MET  82           HG3      MET  82  -2.657  -0.467  -3.903
    7    HE3  MET  82           HE1      MET  82  -4.437   1.165  -1.113
    8    HE2  MET  82           HE2      MET  82  -2.711   1.475  -1.284
    9    HE1  MET  82           HE3      MET  82  -3.365  -0.098  -1.735

  No H/Q in entry =           9
  In of MODEL   43
    1    H    THR  83           H        THR  83   1.465   2.050  -4.981
    2    HA   THR  83           HA       THR  83   2.641   3.190  -2.676
    3    HB   THR  83           HB       THR  83   4.749   3.167  -4.131
    4    HG1  THR  83           HG1      THR  83   4.538   2.625  -6.154
    5   HG22  THR  83          HG21      THR  83   4.360   0.499  -4.452
    6   HG21  THR  83          HG22      THR  83   3.053   0.860  -3.326
    7   HG23  THR  83          HG23      THR  83   4.721   1.238  -2.893

  No H/Q in entry =           7
  In of MODEL   43
    1    H    SER  84           H        SER  84   2.276   4.444  -5.987
    2    HA   SER  84           HA       SER  84   3.563   6.912  -5.533
    3    HB2  SER  84           HB2      SER  84   1.528   6.029  -7.567
    4    HB3  SER  84           HB3      SER  84   2.175   7.669  -7.544
    5    HG   SER  84           HG       SER  84   3.597   5.219  -7.809

  No H/Q in entry =           5
  In of MODEL   43
    1    H    MET  85           H        MET  85   0.083   6.089  -5.389
    2    HA   MET  85           HA       MET  85  -0.833   8.686  -4.810
    3    HB2  MET  85           HB2      MET  85  -2.315   6.844  -5.483
    4    HB3  MET  85           HB3      MET  85  -2.025   6.052  -3.934
    5    HG2  MET  85           HG2      MET  85  -2.965   7.999  -2.751
    6    HG3  MET  85           HG3      MET  85  -3.230   8.812  -4.292
    7    HE1  MET  85           HE1      MET  85  -3.746   5.906  -2.116
    8    HE3  MET  85           HE2      MET  85  -4.027   4.792  -3.451
    9    HE2  MET  85           HE3      MET  85  -5.372   5.283  -2.426

  No H/Q in entry =           9
  In of MODEL   43
    1    H    LEU  86           H        LEU  86   0.117   6.053  -2.644
    2    HA   LEU  86           HA       LEU  86  -0.463   7.358  -0.214
    3    HB2  LEU  86           HB2      LEU  86   0.051   4.895  -0.590
    4    HB3  LEU  86           HB3      LEU  86   1.750   5.356  -0.672
    5    HG   LEU  86           HG       LEU  86   1.384   6.522   1.587
    6   HD11  LEU  86          HD11      LEU  86  -1.292   5.704   1.096
    7   HD13  LEU  86          HD12      LEU  86  -0.653   6.471   2.548
    8   HD12  LEU  86          HD13      LEU  86  -0.710   4.713   2.438
    9   HD23  LEU  86          HD21      LEU  86   1.009   3.523   1.721
   10   HD22  LEU  86          HD22      LEU  86   1.983   4.556   2.765
   11   HD21  LEU  86          HD23      LEU  86   2.505   4.232   1.112

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ALA  87           H        ALA  87   2.540   7.109  -2.075
    2    HA   ALA  87           HA       ALA  87   4.204   8.559  -0.342
    3    HB3  ALA  87           HB1      ALA  87   4.342   7.534  -3.043
    4    HB2  ALA  87           HB2      ALA  87   5.660   7.894  -1.932
    5    HB1  ALA  87           HB3      ALA  87   5.032   9.158  -2.988

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ARG  88           H        ARG  88   2.262   9.646  -3.086
    2    HA   ARG  88           HA       ARG  88   2.987  12.349  -2.976
    3    HB2  ARG  88           HB2      ARG  88   1.770  11.165  -4.838
    4    HB3  ARG  88           HB3      ARG  88   0.302  11.288  -3.869
    5    HG2  ARG  88           HG2      ARG  88   1.276  13.886  -3.790
    6    HG3  ARG  88           HG3      ARG  88   1.723  13.371  -5.414
    7    HD2  ARG  88           HD2      ARG  88  -0.413  13.410  -6.131
    8    HD3  ARG  88           HD3      ARG  88  -0.998  12.554  -4.704
    9    HE   ARG  88           HE       ARG  88  -1.231  15.326  -5.138
   10   HH21  ARG  88          HH11      ARG  88  -1.797  16.655  -3.412
   11   HH22  ARG  88          HH12      ARG  88  -1.506  16.131  -1.789
   12   HH11  ARG  88          HH21      ARG  88  -0.198  13.094  -2.743
   13   HH12  ARG  88          HH22      ARG  88  -0.618  14.109  -1.410

  No H/Q in entry =          13
  In of MODEL   43
    1    H    GLU  89           H        GLU  89   0.299  10.637  -1.351
    2    HA   GLU  89           HA       GLU  89  -0.859  12.935  -0.168
    3    HB2  GLU  89           HB2      GLU  89  -1.938  10.677  -0.253
    4    HB3  GLU  89           HB3      GLU  89  -0.816  10.147   1.001
    5    HG2  GLU  89           HG2      GLU  89  -1.678  11.840   2.544
    6    HG3  GLU  89           HG3      GLU  89  -2.730  12.486   1.288

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LEU  90           H        LEU  90   1.620  10.690   1.039
    2    HA   LEU  90           HA       LEU  90   1.933  11.953   3.565
    3    HB2  LEU  90           HB2      LEU  90   3.750  10.200   1.913
    4    HB3  LEU  90           HB3      LEU  90   4.146  10.732   3.552
    5    HG   LEU  90           HG       LEU  90   1.540   9.340   2.875
    6   HD12  LEU  90          HD11      LEU  90   2.705   7.318   3.904
    7   HD11  LEU  90          HD12      LEU  90   4.215   8.198   3.670
    8   HD13  LEU  90          HD13      LEU  90   3.221   7.767   2.277
    9   HD22  LEU  90          HD21      LEU  90   1.242  10.269   4.990
   10   HD21  LEU  90          HD22      LEU  90   2.958  10.192   5.387
   11   HD23  LEU  90          HD23      LEU  90   1.975   8.729   5.434

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  91           H        ILE  91   3.558  12.347   0.451
    2    HA   ILE  91           HA       ILE  91   5.497  14.213   1.298
    3    HB   ILE  91           HB       ILE  91   4.217  13.689  -1.391
    4   HG12  ILE  91          HG12      ILE  91   7.048  13.252  -0.390
    5   HG13  ILE  91          HG13      ILE  91   5.785  12.035  -0.233
    6   HG22  ILE  91          HG21      ILE  91   6.424  15.068  -2.067
    7   HG21  ILE  91          HG22      ILE  91   6.088  15.871  -0.533
    8   HG23  ILE  91          HG23      ILE  91   4.876  15.874  -1.812
    9   HD13  ILE  91          HD11      ILE  91   5.637  11.697  -2.539
   10   HD12  ILE  91          HD12      ILE  91   7.365  11.969  -2.312
   11   HD11  ILE  91          HD13      ILE  91   6.339  13.273  -2.914

  No H/Q in entry =          11
  In of MODEL   43
    1    H    THR  92           H        THR  92   2.138  14.588   0.259
    2    HA   THR  92           HA       THR  92   2.068  17.410   0.184
    3    HB   THR  92           HB       THR  92  -0.074  15.385   0.875
    4    HG1  THR  92           HG1      THR  92   0.251  15.201  -1.207
    5   HG22  THR  92          HG21      THR  92  -1.502  17.521   0.130
    6   HG21  THR  92          HG22      THR  92  -0.129  18.371   0.835
    7   HG23  THR  92          HG23      THR  92  -1.061  17.240   1.814

  No H/Q in entry =           7
  In of MODEL   43
    1    H    GLU  93           H        GLU  93   1.533  15.114   2.845
    2    HA   GLU  93           HA       GLU  93   0.954  17.019   4.849
    3    HB2  GLU  93           HB2      GLU  93   2.307  14.316   5.110
    4    HB3  GLU  93           HB3      GLU  93   1.590  15.239   6.432
    5    HG2  GLU  93           HG2      GLU  93   0.011  14.424   3.983
    6    HG3  GLU  93           HG3      GLU  93   0.116  13.410   5.417

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LEU  94           H        LEU  94   3.993  15.579   3.732
    2    HA   LEU  94           HA       LEU  94   5.709  16.762   5.630
    3    HB2  LEU  94           HB2      LEU  94   6.150  15.788   2.807
    4    HB3  LEU  94           HB3      LEU  94   7.461  16.470   3.765
    5    HG   LEU  94           HG       LEU  94   5.746  14.254   4.896
    6   HD11  LEU  94          HD11      LEU  94   7.863  14.050   2.784
    7   HD13  LEU  94          HD12      LEU  94   6.430  13.055   3.037
    8   HD12  LEU  94          HD13      LEU  94   7.850  12.829   4.058
    9   HD23  LEU  94          HD21      LEU  94   7.933  13.756   6.070
   10   HD22  LEU  94          HD22      LEU  94   7.238  15.326   6.472
   11   HD21  LEU  94          HD23      LEU  94   8.588  15.221   5.342

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  95           H        ILE  95   4.579  17.901   2.464
    2    HA   ILE  95           HA       ILE  95   6.115  20.282   2.407
    3    HB   ILE  95           HB       ILE  95   3.493  19.551   1.082
    4   HG12  ILE  95          HG12      ILE  95   6.286  19.926  -0.033
    5   HG13  ILE  95          HG13      ILE  95   5.656  18.365   0.484
    6   HG21  ILE  95          HG21      ILE  95   5.206  22.044   0.865
    7   HG23  ILE  95          HG22      ILE  95   3.479  21.951   1.206
    8   HG22  ILE  95          HG23      ILE  95   4.082  21.552  -0.403
    9   HD13  ILE  95          HD11      ILE  95   4.113  18.257  -1.258
   10   HD12  ILE  95          HD12      ILE  95   5.456  19.092  -2.038
   11   HD11  ILE  95          HD13      ILE  95   4.064  20.008  -1.462

  No H/Q in entry =          11
  In of MODEL   43
    1    H    GLU  96           H        GLU  96   2.865  19.586   3.677
    2    HA   GLU  96           HA       GLU  96   2.198  22.227   4.410
    3    HB2  GLU  96           HB2      GLU  96   0.551  20.418   4.416
    4    HB3  GLU  96           HB3      GLU  96   1.414  19.610   5.723
    5    HG2  GLU  96           HG2      GLU  96   0.360  20.886   7.277
    6    HG3  GLU  96           HG3      GLU  96   0.880  22.364   6.477

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LEU  97           H        LEU  97   4.065  19.713   6.063
    2    HA   LEU  97           HA       LEU  97   4.381  21.078   8.530
    3    HB2  LEU  97           HB2      LEU  97   5.963  18.926   7.140
    4    HB3  LEU  97           HB3      LEU  97   6.529  19.627   8.654
    5    HG   LEU  97           HG       LEU  97   3.739  18.490   8.324
    6   HD12  LEU  97          HD11      LEU  97   4.699  16.498   9.555
    7   HD11  LEU  97          HD12      LEU  97   6.303  17.151   9.222
    8   HD13  LEU  97          HD13      LEU  97   5.252  16.671   7.889
    9   HD23  LEU  97          HD21      LEU  97   4.174  18.215  10.894
   10   HD22  LEU  97          HD22      LEU  97   3.775  19.817  10.278
   11   HD21  LEU  97          HD23      LEU  97   5.450  19.405  10.640

  No H/Q in entry =          11
  In of MODEL   43
    1    H    HIS  98           H        HIS  98   6.277  21.108   5.521
    2    HA   HIS  98           HA       HIS  98   8.399  22.724   6.431
    3    HB2  HIS  98           HB2      HIS  98   7.134  22.436   3.695
    4    HB3  HIS  98           HB3      HIS  98   8.556  23.437   3.993
    5    HD1  HIS  98           HD1      HIS  98   7.398  19.849   4.020
    6    HD2  HIS  98           HD2      HIS  98  10.944  22.001   4.466
    7    HE1  HIS  98           HE1      HIS  98   9.278  18.147   3.988
    8    HE2  HIS  98           HE2      HIS  98  11.442  19.437   4.260

  No H/Q in entry =           8
  In of MODEL   43
    1    H    GLU  99           H        GLU  99   5.176  23.505   5.224
    2    HA   GLU  99           HA       GLU  99   5.514  26.325   5.155
    3    HB2  GLU  99           HB2      GLU  99   3.663  25.123   4.014
    4    HB3  GLU  99           HB3      GLU  99   2.958  24.759   5.589
    5    HG2  GLU  99           HG2      GLU  99   2.739  27.150   6.077
    6    HG3  GLU  99           HG3      GLU  99   3.522  27.554   4.552

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LYS 100           H        LYS 100   4.395  24.085   7.678
    2    HA   LYS 100           HA       LYS 100   3.762  26.140   9.557
    3    HB2  LYS 100           HB2      LYS 100   4.377  23.199   9.922
    4    HB3  LYS 100           HB3      LYS 100   3.902  24.271  11.245
    5    HG2  LYS 100           HG2      LYS 100   1.838  24.873   9.976
    6    HG3  LYS 100           HG3      LYS 100   2.293  23.704   8.733
    7    HD2  LYS 100           HD2      LYS 100   2.228  21.890  10.403
    8    HD3  LYS 100           HD3      LYS 100   1.790  23.053  11.657
    9    HE2  LYS 100           HE2      LYS 100  -0.261  23.639  10.373
   10    HE3  LYS 100           HE3      LYS 100   0.167  22.419   9.167
   11    HZ1  LYS 100           HZ1      LYS 100  -0.114  21.762  12.048
   12    HZ3  LYS 100           HZ2      LYS 100  -0.103  20.702  10.719
   13    HZ2  LYS 100           HZ3      LYS 100  -1.436  21.723  10.982

  No H/Q in entry =          13
  In of MODEL   43
    1    H    LEU 101           H        LEU 101   6.718  24.383   8.757
    2    HA   LEU 101           HA       LEU 101   8.285  25.256  10.970
    3    HB2  LEU 101           HB2      LEU 101   8.918  24.265   8.202
    4    HB3  LEU 101           HB3      LEU 101  10.202  24.953   9.192
    5    HG   LEU 101           HG       LEU 101   8.391  22.776  10.250
    6   HD12  LEU 101          HD11      LEU 101  10.472  21.308   9.667
    7   HD11  LEU 101          HD12      LEU 101  10.831  22.570   8.491
    8   HD13  LEU 101          HD13      LEU 101   9.315  21.675   8.389
    9   HD21  LEU 101          HD21      LEU 101  11.093  23.926  10.996
   10   HD23  LEU 101          HD22      LEU 101  10.567  22.349  11.579
   11   HD22  LEU 101          HD23      LEU 101   9.650  23.794  12.002

  No H/Q in entry =          11
  In of MODEL   43
    1    H    LYS 102           H        LYS 102   6.694  27.087   8.807
    2    HA   LYS 102           HA       LYS 102   6.742  29.379   8.505
    3    HB2  LYS 102           HB2      LYS 102   8.290  29.296  10.617
    4    HB3  LYS 102           HB3      LYS 102   9.596  29.503   9.468
    5    HG2  LYS 102           HG2      LYS 102   7.456  31.430  10.302
    6    HG3  LYS 102           HG3      LYS 102   9.167  31.713  10.064
    7    HD2  LYS 102           HD2      LYS 102   7.242  31.252   7.749
    8    HD3  LYS 102           HD3      LYS 102   7.597  32.840   8.413
    9    HE2  LYS 102           HE2      LYS 102   9.005  31.665   6.358
   10    HE3  LYS 102           HE3      LYS 102   9.594  32.985   7.368
   11    HZ2  LYS 102           HZ1      LYS 102  11.142  31.101   7.215
   12    HZ1  LYS 102           HZ2      LYS 102   9.988  30.106   7.952
   13    HZ3  LYS 102           HZ3      LYS 102  10.654  31.406   8.811

  No H/Q in entry =          13
  In of MODEL   43
    1    H    ALA 103           H        ALA 103  10.022  28.083   7.975
    2    HA   ALA 103           HA       ALA 103  10.985  29.463   5.901
    3    HB2  ALA 103           HB1      ALA 103  11.909  27.257   4.992
    4    HB1  ALA 103           HB2      ALA 103  11.013  26.477   6.293
    5    HB3  ALA 103           HB3      ALA 103  12.283  27.641   6.672

  No H/Q in entry =           5
  In of MODEL   43
    1    H1   LYS   3           H1       LYS   3 -30.841   6.671 -19.630
    2    H2   LYS   3           H3       LYS   3 -29.882   6.330 -20.988
    3    H3   LYS   3           H2       LYS   3 -31.312   5.457 -20.718
    4    HA   LYS   3           HA       LYS   3 -30.355   4.036 -19.315
    5    HB2  LYS   3           HB2      LYS   3 -28.030   5.338 -20.682
    6    HB3  LYS   3           HB3      LYS   3 -27.744   4.126 -19.432
    7    HG2  LYS   3           HG2      LYS   3 -29.248   2.593 -20.755
    8    HG3  LYS   3           HG3      LYS   3 -29.165   3.781 -22.056
    9    HD2  LYS   3           HD2      LYS   3 -26.688   3.561 -22.030
   10    HD3  LYS   3           HD3      LYS   3 -26.850   2.277 -20.832
   11    HE2  LYS   3           HE2      LYS   3 -28.418   1.155 -22.524
   12    HE3  LYS   3           HE3      LYS   3 -27.759   2.296 -23.695
   13    HZ3  LYS   3           HZ1      LYS   3 -26.019   0.989 -23.974
   14    HZ2  LYS   3           HZ2      LYS   3 -26.687  -0.143 -22.899
   15    HZ1  LYS   3           HZ3      LYS   3 -25.639   1.062 -22.321

  No H/Q in entry =          15
  In of MODEL   43
    1    H    LYS   4           H        LYS   4 -30.392   3.911 -17.252
    2    HA   LYS   4           HA       LYS   4 -29.545   6.176 -15.627
    3    HB2  LYS   4           HB2      LYS   4 -30.856   3.543 -14.894
    4    HB3  LYS   4           HB3      LYS   4 -30.563   4.878 -13.780
    5    HG2  LYS   4           HG2      LYS   4 -32.398   4.879 -16.183
    6    HG3  LYS   4           HG3      LYS   4 -32.868   4.963 -14.485
    7    HD2  LYS   4           HD2      LYS   4 -32.071   7.154 -14.244
    8    HD3  LYS   4           HD3      LYS   4 -31.050   7.040 -15.676
    9    HE2  LYS   4           HE2      LYS   4 -32.918   8.494 -16.130
   10    HE3  LYS   4           HE3      LYS   4 -33.074   7.019 -17.085
   11    HZ3  LYS   4           HZ1      LYS   4 -34.673   6.189 -15.515
   12    HZ2  LYS   4           HZ2      LYS   4 -35.167   7.704 -16.105
   13    HZ1  LYS   4           HZ3      LYS   4 -34.499   7.576 -14.548

  No H/Q in entry =          13
  In of MODEL   43
    1    H    HIS   5           H        HIS   5 -28.057   6.206 -14.051
    2    HA   HIS   5           HA       HIS   5 -25.862   4.273 -14.392
    3    HB2  HIS   5           HB2      HIS   5 -25.980   7.045 -13.205
    4    HB3  HIS   5           HB3      HIS   5 -24.542   6.025 -13.197
    5    HD1  HIS   5           HD1      HIS   5 -23.037   7.145 -14.810
    6    HD2  HIS   5           HD2      HIS   5 -26.879   6.687 -16.319
    7    HE1  HIS   5           HE1      HIS   5 -22.870   7.699 -17.267
    8    HE2  HIS   5           HE2      HIS   5 -25.213   7.408 -18.156

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ILE   6           H        ILE   6 -25.691   2.702 -13.066
    2    HA   ILE   6           HA       ILE   6 -26.623   3.034 -10.295
    3    HB   ILE   6           HB       ILE   6 -25.928   0.520 -11.822
    4   HG12  ILE   6          HG12      ILE   6 -28.616   1.588 -10.948
    5   HG13  ILE   6          HG13      ILE   6 -27.986   1.708 -12.591
    6   HG23  ILE   6          HG21      ILE   6 -26.339  -0.699  -9.947
    7   HG22  ILE   6          HG22      ILE   6 -27.434   0.504  -9.265
    8   HG21  ILE   6          HG23      ILE   6 -25.691   0.760  -9.197
    9   HD13  ILE   6          HD11      ILE   6 -28.548  -0.391 -13.069
   10   HD12  ILE   6          HD12      ILE   6 -29.545  -0.316 -11.617
   11   HD11  ILE   6          HD13      ILE   6 -27.920  -0.999 -11.538

  No H/Q in entry =          11
  In of MODEL   43
    1    H    TYR   7           H        TYR   7 -24.822   3.602  -9.031
    2    HA   TYR   7           HA       TYR   7 -22.166   2.515  -9.732
    3    HB2  TYR   7           HB2      TYR   7 -22.999   5.003  -8.260
    4    HB3  TYR   7           HB3      TYR   7 -21.341   4.409  -8.312
    5    HD1  TYR   7           HD1      TYR   7 -22.457   3.494 -11.384
    6    HD2  TYR   7           HD2      TYR   7 -21.598   7.047  -9.193
    7    HE1  TYR   7           HE1      TYR   7 -21.992   4.686 -13.489
    8    HE2  TYR   7           HE2      TYR   7 -21.174   8.248 -11.289
    9    HH   TYR   7           HH       TYR   7 -21.420   8.155 -13.518

  No H/Q in entry =           9
  In of MODEL   43
    1    H    LEU   8           H        LEU   8 -21.250   1.130  -8.402
    2    HA   LEU   8           HA       LEU   8 -22.372   0.707  -5.704
    3    HB2  LEU   8           HB2      LEU   8 -20.769  -1.046  -7.543
    4    HB3  LEU   8           HB3      LEU   8 -20.953  -1.407  -5.827
    5    HG   LEU   8           HG       LEU   8 -23.443  -1.466  -6.222
    6   HD13  LEU   8          HD11      LEU   8 -23.540  -0.261  -8.339
    7   HD12  LEU   8          HD12      LEU   8 -24.150  -1.900  -8.561
    8   HD11  LEU   8          HD13      LEU   8 -22.526  -1.482  -9.106
    9   HD23  LEU   8          HD21      LEU   8 -22.284  -3.577  -7.912
   10   HD22  LEU   8          HD22      LEU   8 -23.363  -3.684  -6.522
   11   HD21  LEU   8          HD23      LEU   8 -21.639  -3.408  -6.280

  No H/Q in entry =          11
  In of MODEL   43
    1    H    PHE   9           H        PHE   9 -21.058   1.060  -3.936
    2    HA   PHE   9           HA       PHE   9 -18.243   1.869  -4.499
    3    HB2  PHE   9           HB2      PHE   9 -20.200   3.032  -2.525
    4    HB3  PHE   9           HB3      PHE   9 -18.472   3.348  -2.475
    5    HD1  PHE   9           HD1      PHE   9 -17.365   4.600  -4.265
    6    HD2  PHE   9           HD2      PHE   9 -21.609   3.969  -4.286
    7    HE1  PHE   9           HE1      PHE   9 -17.614   6.333  -6.018
    8    HE2  PHE   9           HE2      PHE   9 -21.859   5.713  -6.033
    9    HZ   PHE   9           HZ       PHE   9 -19.860   6.890  -6.905

  No H/Q in entry =           9
  In of MODEL   43
    1    H    SER  10           H        SER  10 -16.694   0.814  -3.450
    2    HA   SER  10           HA       SER  10 -16.879  -0.072  -0.747
    3    HB2  SER  10           HB2      SER  10 -17.008  -2.389  -0.982
    4    HB3  SER  10           HB3      SER  10 -18.171  -1.826  -2.173
    5    HG   SER  10           HG       SER  10 -15.618  -2.910  -2.507

  No H/Q in entry =           5
  In of MODEL   43
    1    H    SER  11           H        SER  11 -14.855   0.032   0.031
    2    HA   SER  11           HA       SER  11 -12.674   0.786  -1.542
    3    HB2  SER  11           HB2      SER  11 -12.118  -0.598   1.017
    4    HB3  SER  11           HB3      SER  11 -11.528   0.950   0.407
    5    HG   SER  11           HG       SER  11 -13.571   0.462   2.055

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA  12           H        ALA  12 -13.980  -1.908  -2.272
    2    HA   ALA  12           HA       ALA  12 -11.447  -3.210  -2.875
    3    HB2  ALA  12           HB1      ALA  12 -12.016  -5.361  -2.013
    4    HB1  ALA  12           HB2      ALA  12 -13.652  -4.841  -1.610
    5    HB3  ALA  12           HB3      ALA  12 -12.280  -4.208  -0.702

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLY  13           H        GLY  13 -12.210  -2.258  -4.897
    2    HA3  GLY  13           HA2      GLY  13 -14.518  -2.897  -6.300
    3    HA2  GLY  13           HA3      GLY  13 -12.970  -2.512  -7.065

  No H/Q in entry =           3
  In of MODEL   43
    1    H    MET  14           H        MET  14 -11.512  -4.805  -6.155
    2    HA   MET  14           HA       MET  14 -11.951  -6.590  -8.207
    3    HB2  MET  14           HB2      MET  14  -9.938  -6.636  -6.709
    4    HB3  MET  14           HB3      MET  14 -10.899  -7.499  -5.509
    5    HG2  MET  14           HG2      MET  14  -9.890  -9.266  -6.651
    6    HG3  MET  14           HG3      MET  14 -11.403  -9.120  -7.546
    7    HE1  MET  14           HE1      MET  14  -7.821  -7.655  -7.261
    8    HE3  MET  14           HE2      MET  14  -7.152  -8.120  -8.823
    9    HE2  MET  14           HE3      MET  14  -7.716  -9.364  -7.710

  No H/Q in entry =           9
  In of MODEL   43
    1    H    SER  15           H        SER  15 -13.216  -7.062  -4.896
    2    HA   SER  15           HA       SER  15 -14.677  -9.422  -5.717
    3    HB2  SER  15           HB2      SER  15 -14.140  -9.455  -3.410
    4    HB3  SER  15           HB3      SER  15 -14.711  -7.806  -3.173
    5    HG   SER  15           HG       SER  15 -16.680  -9.340  -4.196

  No H/Q in entry =           5
  In of MODEL   43
    1    H    THR  16           H        THR  16 -15.573  -6.005  -5.107
    2    HA   THR  16           HA       THR  16 -18.400  -6.333  -5.519
    3    HB   THR  16           HB       THR  16 -16.718  -3.869  -6.096
    4    HG1  THR  16           HG1      THR  16 -17.763  -3.647  -3.744
    5   HG21  THR  16          HG21      THR  16 -19.604  -4.288  -5.278
    6   HG23  THR  16          HG22      THR  16 -19.035  -3.714  -6.855
    7   HG22  THR  16          HG23      THR  16 -18.817  -2.721  -5.407

  No H/Q in entry =           7
  In of MODEL   43
    1    H    SER  17           H        SER  17 -15.646  -5.882  -7.456
    2    HA   SER  17           HA       SER  17 -16.763  -5.109  -9.953
    3    HB2  SER  17           HB2      SER  17 -14.190  -6.543  -9.264
    4    HB3  SER  17           HB3      SER  17 -14.627  -6.101 -10.914
    5    HG   SER  17           HG       SER  17 -14.994  -3.959  -9.456

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU  18           H        LEU  18 -16.324  -8.266  -8.485
    2    HA   LEU  18           HA       LEU  18 -17.002  -9.755 -10.822
    3    HB2  LEU  18           HB2      LEU  18 -15.809 -10.763  -8.930
    4    HB3  LEU  18           HB3      LEU  18 -17.209 -10.485  -7.895
    5    HG   LEU  18           HG       LEU  18 -18.539 -11.961  -9.420
    6   HD11  LEU  18          HD11      LEU  18 -15.824 -12.218 -10.687
    7   HD13  LEU  18          HD12      LEU  18 -17.387 -11.955 -11.460
    8   HD12  LEU  18          HD13      LEU  18 -16.992 -13.534 -10.786
    9   HD21  LEU  18          HD21      LEU  18 -17.467 -12.673  -7.287
   10   HD23  LEU  18          HD22      LEU  18 -16.138 -13.323  -8.251
   11   HD22  LEU  18          HD23      LEU  18 -17.767 -13.967  -8.449

  No H/Q in entry =          11
  In of MODEL   43
    1    H    LEU  19           H        LEU  19 -18.887  -8.438  -8.102
    2    HA   LEU  19           HA       LEU  19 -21.410  -9.514  -8.902
    3    HB2  LEU  19           HB2      LEU  19 -21.047  -8.660  -6.657
    4    HB3  LEU  19           HB3      LEU  19 -20.756  -7.046  -7.299
    5    HG   LEU  19           HG       LEU  19 -23.080  -6.811  -7.898
    6   HD11  LEU  19          HD11      LEU  19 -23.156  -9.717  -7.224
    7   HD13  LEU  19          HD12      LEU  19 -23.933  -8.849  -8.548
    8   HD12  LEU  19          HD13      LEU  19 -24.592  -8.740  -6.916
    9   HD22  LEU  19          HD21      LEU  19 -22.504  -6.153  -5.681
   10   HD21  LEU  19          HD22      LEU  19 -22.609  -7.816  -5.101
   11   HD23  LEU  19          HD23      LEU  19 -24.067  -6.967  -5.614

  No H/Q in entry =          11
  In of MODEL   43
    1    H    VAL  20           H        VAL  20 -19.778  -6.431  -9.636
    2    HA   VAL  20           HA       VAL  20 -21.856  -5.306 -11.194
    3    HB   VAL  20           HB       VAL  20 -18.844  -4.852 -11.347
    4   HG13  VAL  20          HG11      VAL  20 -19.650  -4.219 -13.500
    5   HG12  VAL  20          HG12      VAL  20 -19.532  -2.723 -12.573
    6   HG11  VAL  20          HG13      VAL  20 -21.102  -3.486 -12.820
    7   HG22  VAL  20          HG21      VAL  20 -19.545  -3.994  -9.321
    8   HG21  VAL  20          HG22      VAL  20 -21.114  -3.500  -9.955
    9   HG23  VAL  20          HG23      VAL  20 -19.663  -2.594 -10.388

  No H/Q in entry =           9
  In of MODEL   43
    1    H    SER  21           H        SER  21 -19.204  -7.488 -12.231
    2    HA   SER  21           HA       SER  21 -20.010  -7.361 -14.975
    3    HB2  SER  21           HB2      SER  21 -18.668  -9.393 -15.306
    4    HB3  SER  21           HB3      SER  21 -17.774  -8.180 -14.393
    5    HG   SER  21           HG       SER  21 -18.288  -9.308 -12.508

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LYS  22           H        LYS  22 -21.149  -9.477 -12.376
    2    HA   LYS  22           HA       LYS  22 -22.777 -11.038 -14.170
    3    HB2  LYS  22           HB2      LYS  22 -22.027 -11.779 -11.872
    4    HB3  LYS  22           HB3      LYS  22 -23.218 -10.657 -11.212
    5    HG2  LYS  22           HG2      LYS  22 -24.300 -12.715 -11.153
    6    HG3  LYS  22           HG3      LYS  22 -24.932 -11.951 -12.611
    7    HD2  LYS  22           HD2      LYS  22 -23.416 -13.257 -13.989
    8    HD3  LYS  22           HD3      LYS  22 -22.689 -13.972 -12.549
    9    HE2  LYS  22           HE2      LYS  22 -25.589 -14.293 -13.354
   10    HE3  LYS  22           HE3      LYS  22 -24.321 -15.474 -13.685
   11    HZ3  LYS  22           HZ1      LYS  22 -24.430 -16.263 -11.631
   12    HZ2  LYS  22           HZ2      LYS  22 -25.910 -15.439 -11.503
   13    HZ1  LYS  22           HZ3      LYS  22 -24.486 -14.720 -10.922

  No H/Q in entry =          13
  In of MODEL   43
    1    H    MET  23           H        MET  23 -23.347  -8.071 -12.318
    2    HA   MET  23           HA       MET  23 -26.160  -8.023 -12.797
    3    HB2  MET  23           HB2      MET  23 -24.201  -5.799 -12.260
    4    HB3  MET  23           HB3      MET  23 -25.939  -5.550 -12.423
    5    HG2  MET  23           HG2      MET  23 -26.371  -6.818 -10.440
    6    HG3  MET  23           HG3      MET  23 -24.680  -7.309 -10.327
    7    HE2  MET  23           HE1      MET  23 -26.794  -3.544  -9.146
    8    HE1  MET  23           HE2      MET  23 -27.108  -4.511 -10.586
    9    HE3  MET  23           HE3      MET  23 -26.008  -3.134 -10.671

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ARG  24           H        ARG  24 -23.359  -6.739 -14.618
    2    HA   ARG  24           HA       ARG  24 -24.814  -5.384 -16.613
    3    HB2  ARG  24           HB2      ARG  24 -22.347  -5.106 -16.250
    4    HB3  ARG  24           HB3      ARG  24 -22.099  -6.716 -16.882
    5    HG2  ARG  24           HG2      ARG  24 -22.986  -5.995 -19.108
    6    HG3  ARG  24           HG3      ARG  24 -23.199  -4.352 -18.450
    7    HD2  ARG  24           HD2      ARG  24 -20.737  -4.407 -17.795
    8    HD3  ARG  24           HD3      ARG  24 -20.617  -5.903 -18.714
    9    HE   ARG  24           HE       ARG  24 -20.826  -3.318 -19.895
   10   HH21  ARG  24          HH11      ARG  24 -21.606  -3.300 -22.004
   11   HH22  ARG  24          HH12      ARG  24 -21.459  -4.717 -22.983
   12   HH11  ARG  24          HH21      ARG  24 -20.441  -6.665 -20.210
   13   HH12  ARG  24          HH22      ARG  24 -20.759  -6.700 -21.915

  No H/Q in entry =          13
  In of MODEL   43
    1    H    ALA  25           H        ALA  25 -23.850  -8.770 -16.322
    2    HA   ALA  25           HA       ALA  25 -24.542  -9.589 -18.948
    3    HB1  ALA  25           HB1      ALA  25 -23.938 -11.647 -18.243
    4    HB3  ALA  25           HB2      ALA  25 -24.980 -11.565 -16.823
    5    HB2  ALA  25           HB3      ALA  25 -23.386 -10.813 -16.790

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLN  26           H        GLN  26 -26.340  -9.518 -15.907
    2    HA   GLN  26           HA       GLN  26 -28.748 -10.613 -16.893
    3    HB2  GLN  26           HB2      GLN  26 -28.129  -8.876 -14.523
    4    HB3  GLN  26           HB3      GLN  26 -29.729  -9.526 -14.854
    5    HG2  GLN  26           HG2      GLN  26 -27.211 -11.103 -14.399
    6    HG3  GLN  26           HG3      GLN  26 -28.555 -10.927 -13.277
    7   HE21  GLN  26          HE21      GLN  26 -27.456 -13.156 -14.549
    8   HE22  GLN  26          HE22      GLN  26 -28.555 -14.156 -15.329

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ALA  27           H        ALA  27 -27.646  -7.262 -16.533
    2    HA   ALA  27           HA       ALA  27 -30.088  -6.055 -17.303
    3    HB1  ALA  27           HB1      ALA  27 -28.205  -4.822 -16.214
    4    HB3  ALA  27           HB2      ALA  27 -28.773  -4.038 -17.689
    5    HB2  ALA  27           HB3      ALA  27 -27.281  -4.978 -17.708

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLU  28           H        GLU  28 -27.467  -7.419 -19.188
    2    HA   GLU  28           HA       GLU  28 -28.374  -6.352 -21.705
    3    HB2  GLU  28           HB2      GLU  28 -26.026  -7.146 -21.099
    4    HB3  GLU  28           HB3      GLU  28 -26.653  -8.782 -21.285
    5    HG2  GLU  28           HG2      GLU  28 -25.488  -8.074 -23.269
    6    HG3  GLU  28           HG3      GLU  28 -27.203  -8.317 -23.599

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LYS  29           H        LYS  29 -28.676  -9.435 -20.027
    2    HA   LYS  29           HA       LYS  29 -30.067 -10.852 -22.011
    3    HB2  LYS  29           HB2      LYS  29 -29.049 -11.874 -20.009
    4    HB3  LYS  29           HB3      LYS  29 -30.274 -11.100 -19.008
    5    HG2  LYS  29           HG2      LYS  29 -32.010 -12.396 -20.051
    6    HG3  LYS  29           HG3      LYS  29 -30.854 -13.095 -21.182
    7    HD2  LYS  29           HD2      LYS  29 -29.754 -14.306 -19.452
    8    HD3  LYS  29           HD3      LYS  29 -30.607 -13.415 -18.194
    9    HE2  LYS  29           HE2      LYS  29 -31.475 -15.726 -18.535
   10    HE3  LYS  29           HE3      LYS  29 -32.696 -14.474 -18.774
   11    HZ1  LYS  29           HZ1      LYS  29 -32.162 -14.650 -21.206
   12    HZ3  LYS  29           HZ2      LYS  29 -32.942 -15.996 -20.525
   13    HZ2  LYS  29           HZ3      LYS  29 -31.276 -16.051 -20.838

  No H/Q in entry =          13
  In of MODEL   43
    1    H    TYR  30           H        TYR  30 -31.332  -8.667 -19.507
    2    HA   TYR  30           HA       TYR  30 -34.025  -8.994 -20.722
    3    HB2  TYR  30           HB2      TYR  30 -33.291  -7.857 -18.013
    4    HB3  TYR  30           HB3      TYR  30 -34.925  -8.039 -18.651
    5    HD1  TYR  30           HD1      TYR  30 -35.947 -10.286 -18.842
    6    HD2  TYR  30           HD2      TYR  30 -32.066  -9.742 -17.178
    7    HE1  TYR  30           HE1      TYR  30 -35.964 -12.610 -18.031
    8    HE2  TYR  30           HE2      TYR  30 -32.083 -12.052 -16.371
    9    HH   TYR  30           HH       TYR  30 -33.845 -14.336 -17.434

  No H/Q in entry =           9
  In of MODEL   43
    1    H    GLU  31           H        GLU  31 -31.772  -7.114 -21.553
    2    HA   GLU  31           HA       GLU  31 -31.602  -4.967 -22.390
    3    HB2  GLU  31           HB2      GLU  31 -34.533  -5.545 -22.872
    4    HB3  GLU  31           HB3      GLU  31 -33.634  -4.225 -23.617
    5    HG2  GLU  31           HG2      GLU  31 -32.244  -5.739 -24.814
    6    HG3  GLU  31           HG3      GLU  31 -32.868  -7.118 -23.911

  No H/Q in entry =           6
  In of MODEL   43
    1    H    VAL  32           H        VAL  32 -31.770  -4.841 -19.657
    2    HA   VAL  32           HA       VAL  32 -33.523  -2.638 -18.994
    3    HB   VAL  32           HB       VAL  32 -31.166  -3.735 -17.429
    4   HG12  VAL  32          HG11      VAL  32 -32.643  -2.829 -15.525
    5   HG11  VAL  32          HG12      VAL  32 -33.444  -1.893 -16.787
    6   HG13  VAL  32          HG13      VAL  32 -31.722  -1.669 -16.484
    7   HG21  VAL  32          HG21      VAL  32 -33.021  -5.373 -18.091
    8   HG23  VAL  32          HG22      VAL  32 -34.009  -4.491 -16.926
    9   HG22  VAL  32          HG23      VAL  32 -32.524  -5.282 -16.401

  No H/Q in entry =           9
  In of MODEL   43
    1    HA   PRO  33           HA       PRO  33 -30.372   0.134 -20.712
    2    HB2  PRO  33           HB2      PRO  33 -31.775   2.426 -20.588
    3    HB3  PRO  33           HB3      PRO  33 -32.315   1.142 -21.670
    4    HG2  PRO  33           HG2      PRO  33 -33.231   1.719 -18.853
    5    HG3  PRO  33           HG3      PRO  33 -34.218   1.548 -20.304
    6    HD2  PRO  33           HD2      PRO  33 -33.845  -0.535 -18.630
    7    HD3  PRO  33           HD3      PRO  33 -33.934  -0.783 -20.374

  No H/Q in entry =           7
  In of MODEL   43
    1    H    VAL  34           H        VAL  34 -29.116  -0.459 -18.773
    2    HA   VAL  34           HA       VAL  34 -28.704   1.960 -17.142
    3    HB   VAL  34           HB       VAL  34 -28.174   0.483 -15.200
    4   HG12  VAL  34          HG11      VAL  34 -30.621  -0.274 -14.867
    5   HG11  VAL  34          HG12      VAL  34 -30.916   0.491 -16.426
    6   HG13  VAL  34          HG13      VAL  34 -30.306   1.448 -15.076
    7   HG21  VAL  34          HG21      VAL  34 -28.472  -1.544 -17.195
    8   HG23  VAL  34          HG22      VAL  34 -29.532  -1.847 -15.817
    9   HG22  VAL  34          HG23      VAL  34 -27.800  -1.639 -15.568

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ILE  35           H        ILE  35 -26.702   2.306 -16.323
    2    HA   ILE  35           HA       ILE  35 -24.473   0.865 -17.599
    3    HB   ILE  35           HB       ILE  35 -24.731   3.774 -16.801
    4   HG12  ILE  35          HG12      ILE  35 -23.834   2.410 -19.347
    5   HG13  ILE  35          HG13      ILE  35 -25.431   3.106 -19.076
    6   HG21  ILE  35          HG21      ILE  35 -22.246   2.122 -17.125
    7   HG23  ILE  35          HG22      ILE  35 -22.633   3.328 -15.899
    8   HG22  ILE  35          HG23      ILE  35 -22.242   3.836 -17.542
    9   HD11  ILE  35          HD11      ILE  35 -23.924   5.237 -18.500
   10   HD13  ILE  35          HD12      ILE  35 -24.494   4.870 -20.130
   11   HD12  ILE  35          HD13      ILE  35 -22.856   4.427 -19.647

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ILE  36           H        ILE  36 -23.276  -0.206 -16.005
    2    HA   ILE  36           HA       ILE  36 -23.660   0.444 -13.135
    3    HB   ILE  36           HB       ILE  36 -22.970  -2.301 -14.235
    4   HG12  ILE  36          HG12      ILE  36 -25.730  -1.362 -13.449
    5   HG13  ILE  36          HG13      ILE  36 -25.173  -1.376 -15.123
    6   HG23  ILE  36          HG21      ILE  36 -23.338  -3.100 -12.113
    7   HG22  ILE  36          HG22      ILE  36 -24.401  -1.765 -11.671
    8   HG21  ILE  36          HG23      ILE  36 -22.657  -1.513 -11.760
    9   HD13  ILE  36          HD11      ILE  36 -25.443  -3.581 -15.315
   10   HD12  ILE  36          HD12      ILE  36 -26.488  -3.403 -13.907
   11   HD11  ILE  36          HD13      ILE  36 -24.809  -3.900 -13.701

  No H/Q in entry =          11
  In of MODEL   43
    1    H    GLU  37           H        GLU  37 -21.842   0.996 -12.050
    2    HA   GLU  37           HA       GLU  37 -19.200   0.071 -12.987
    3    HB2  GLU  37           HB2      GLU  37 -19.966   2.903 -12.299
    4    HB3  GLU  37           HB3      GLU  37 -18.301   2.335 -12.433
    5    HG2  GLU  37           HG2      GLU  37 -18.600   1.899 -14.781
    6    HG3  GLU  37           HG3      GLU  37 -20.302   2.348 -14.673

  No H/Q in entry =           6
  In of MODEL   43
    1    H    ALA  38           H        ALA  38 -17.709  -0.225 -11.317
    2    HA   ALA  38           HA       ALA  38 -18.704   0.015  -8.538
    3    HB1  ALA  38           HB1      ALA  38 -17.095  -2.008  -9.968
    4    HB3  ALA  38           HB2      ALA  38 -18.140  -2.188  -8.559
    5    HB2  ALA  38           HB3      ALA  38 -16.497  -1.579  -8.365

  No H/Q in entry =           5
  In of MODEL   43
    1    H    PHE  39           H        PHE  39 -17.396   1.174  -7.083
    2    HA   PHE  39           HA       PHE  39 -14.829   2.257  -8.010
    3    HB2  PHE  39           HB2      PHE  39 -17.158   3.859  -6.970
    4    HB3  PHE  39           HB3      PHE  39 -15.499   4.454  -6.919
    5    HD1  PHE  39           HD1      PHE  39 -14.225   4.390  -9.197
    6    HD2  PHE  39           HD2      PHE  39 -18.468   4.356  -8.780
    7    HE1  PHE  39           HE1      PHE  39 -14.447   5.252 -11.510
    8    HE2  PHE  39           HE2      PHE  39 -18.707   5.210 -11.085
    9    HZ   PHE  39           HZ       PHE  39 -16.702   5.632 -12.468

  No H/Q in entry =           9
  In of MODEL   43
    1    HA   PRO  40           HA       PRO  40 -13.883   1.485  -3.728
    2    HB2  PRO  40           HB2      PRO  40 -12.023   3.421  -3.149
    3    HB3  PRO  40           HB3      PRO  40 -11.648   2.067  -4.216
    4    HG2  PRO  40           HG2      PRO  40 -12.561   4.841  -4.965
    5    HG3  PRO  40           HG3      PRO  40 -11.176   3.938  -5.579
    6    HD2  PRO  40           HD2      PRO  40 -13.415   3.936  -6.969
    7    HD3  PRO  40           HD3      PRO  40 -12.524   2.427  -6.778

  No H/Q in entry =           7
  In of MODEL   43
    1    H    GLU  41           H        GLU  41 -14.440   2.500  -1.598
    2    HA   GLU  41           HA       GLU  41 -16.607   4.300  -1.570
    3    HB2  GLU  41           HB2      GLU  41 -16.581   4.081   0.739
    4    HB3  GLU  41           HB3      GLU  41 -15.823   2.580   0.208
    5    HG2  GLU  41           HG2      GLU  41 -14.410   5.020   1.282
    6    HG3  GLU  41           HG3      GLU  41 -14.668   3.498   2.135

  No H/Q in entry =           6
  In of MODEL   43
    1    H    THR  42           H        THR  42 -13.240   5.071  -1.659
    2    HA   THR  42           HA       THR  42 -13.469   7.651  -0.458
    3    HB   THR  42           HB       THR  42 -11.300   8.124  -1.564
    4    HG1  THR  42           HG1      THR  42 -11.503   5.512  -2.639
    5   HG22  THR  42          HG21      THR  42 -11.430   5.329  -0.408
    6   HG21  THR  42          HG22      THR  42 -11.396   6.811   0.550
    7   HG23  THR  42          HG23      THR  42 -10.014   6.379  -0.455

  No H/Q in entry =           7
  In of MODEL   43
    1    H    LEU  43           H        LEU  43 -14.451   6.580  -3.544
    2    HA   LEU  43           HA       LEU  43 -14.592   9.355  -4.528
    3    HB2  LEU  43           HB2      LEU  43 -15.097   6.724  -5.907
    4    HB3  LEU  43           HB3      LEU  43 -15.221   8.310  -6.667
    5    HG   LEU  43           HG       LEU  43 -12.673   7.067  -5.661
    6   HD11  LEU  43          HD11      LEU  43 -13.923   6.120  -7.760
    7   HD13  LEU  43          HD12      LEU  43 -12.189   6.430  -7.824
    8   HD12  LEU  43          HD13      LEU  43 -13.316   7.587  -8.530
    9   HD21  LEU  43          HD21      LEU  43 -13.378   9.677  -6.968
   10   HD23  LEU  43          HD22      LEU  43 -11.777   8.968  -7.183
   11   HD22  LEU  43          HD23      LEU  43 -12.350   9.376  -5.567

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ALA  44           H        ALA  44 -16.598   7.626  -2.646
    2    HA   ALA  44           HA       ALA  44 -19.092   7.587  -3.944
    3    HB2  ALA  44           HB1      ALA  44 -18.982   6.476  -1.841
    4    HB3  ALA  44           HB2      ALA  44 -20.027   7.870  -1.567
    5    HB1  ALA  44           HB3      ALA  44 -18.348   7.909  -1.031

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLY  45           H        GLY  45 -17.537  10.331  -2.441
    2    HA3  GLY  45           HA2      GLY  45 -19.910  11.933  -2.788
    3    HA2  GLY  45           HA3      GLY  45 -18.335  12.494  -2.229

  No H/Q in entry =           3
  In of MODEL   43
    1    H    GLU  46           H        GLU  46 -16.868  11.478  -4.528
    2    HA   GLU  46           HA       GLU  46 -17.425  13.710  -6.304
    3    HB2  GLU  46           HB2      GLU  46 -15.325  11.538  -6.335
    4    HB3  GLU  46           HB3      GLU  46 -15.409  12.853  -7.508
    5    HG2  GLU  46           HG2      GLU  46 -13.813  13.605  -6.031
    6    HG3  GLU  46           HG3      GLU  46 -15.277  14.392  -5.440

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LYS  47           H        LYS  47 -17.463  10.187  -6.720
    2    HA   LYS  47           HA       LYS  47 -18.577  10.438  -9.386
    3    HB2  LYS  47           HB2      LYS  47 -18.049   8.054  -7.608
    4    HB3  LYS  47           HB3      LYS  47 -18.714   7.942  -9.238
    5    HG2  LYS  47           HG2      LYS  47 -16.172   9.409  -8.910
    6    HG3  LYS  47           HG3      LYS  47 -16.131   7.657  -8.721
    7    HD2  LYS  47           HD2      LYS  47 -15.735   8.032 -11.006
    8    HD3  LYS  47           HD3      LYS  47 -17.427   7.549 -10.907
    9    HE2  LYS  47           HE2      LYS  47 -18.197   9.638 -11.425
   10    HE3  LYS  47           HE3      LYS  47 -16.780  10.444 -10.754
   11    HZ1  LYS  47           HZ1      LYS  47 -15.546   9.338 -12.669
   12    HZ3  LYS  47           HZ2      LYS  47 -16.531  10.675 -13.020
   13    HZ2  LYS  47           HZ3      LYS  47 -17.080   9.104 -13.359

  No H/Q in entry =          13
  In of MODEL   43
    1    H    GLY  48           H        GLY  48 -19.900   9.757  -6.220
    2    HA3  GLY  48           HA2      GLY  48 -22.342   8.673  -6.931
    3    HA2  GLY  48           HA3      GLY  48 -22.060   9.664  -5.501

  No H/Q in entry =           3
  In of MODEL   43
    1    H    GLN  49           H        GLN  49 -21.388  12.051  -7.093
    2    HA   GLN  49           HA       GLN  49 -23.898  13.270  -7.219
    3    HB2  GLN  49           HB2      GLN  49 -21.332  14.015  -8.609
    4    HB3  GLN  49           HB3      GLN  49 -22.751  15.044  -8.517
    5    HG2  GLN  49           HG2      GLN  49 -22.566  15.075  -6.081
    6    HG3  GLN  49           HG3      GLN  49 -21.162  14.026  -6.172
    7   HE21  GLN  49          HE21      GLN  49 -20.936  16.254  -4.914
    8   HE22  GLN  49          HE22      GLN  49 -19.966  17.466  -5.578

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ASN  50           H        ASN  50 -22.325  11.306  -9.610
    2    HA   ASN  50           HA       ASN  50 -24.189  12.248 -11.680
    3    HB2  ASN  50           HB2      ASN  50 -21.681  10.595 -11.929
    4    HB3  ASN  50           HB3      ASN  50 -22.725  11.059 -13.264
    5   HD21  ASN  50          HD21      ASN  50 -20.038  11.798 -11.684
    6   HD22  ASN  50          HD22      ASN  50 -19.737  13.420 -12.038

  No H/Q in entry =           6
  In of MODEL   43
    1    H    ALA  51           H        ALA  51 -24.255   9.905  -9.420
    2    HA   ALA  51           HA       ALA  51 -25.150   7.786 -11.226
    3    HB2  ALA  51           HB1      ALA  51 -24.610   6.423  -9.536
    4    HB3  ALA  51           HB2      ALA  51 -25.686   7.286  -8.437
    5    HB1  ALA  51           HB3      ALA  51 -24.023   7.834  -8.655

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ASP  52           H        ASP  52 -27.199   6.821 -11.060
    2    HA   ASP  52           HA       ASP  52 -29.290   8.753 -10.385
    3    HB2  ASP  52           HB2      ASP  52 -29.227   6.232 -12.041
    4    HB3  ASP  52           HB3      ASP  52 -30.732   7.035 -11.597

  No H/Q in entry =           4
  In of MODEL   43
    1    H    VAL  53           H        VAL  53 -27.809   5.802  -9.366
    2    HA   VAL  53           HA       VAL  53 -29.217   6.008  -6.838
    3    HB   VAL  53           HB       VAL  53 -30.700   4.422  -8.057
    4   HG11  VAL  53          HG11      VAL  53 -29.008   3.477  -9.591
    5   HG13  VAL  53          HG12      VAL  53 -29.889   2.225  -8.716
    6   HG12  VAL  53          HG13      VAL  53 -28.254   2.658  -8.224
    7   HG23  VAL  53          HG21      VAL  53 -29.951   2.420  -6.361
    8   HG22  VAL  53          HG22      VAL  53 -31.017   3.776  -5.992
    9   HG21  VAL  53          HG23      VAL  53 -29.300   3.873  -5.602

  No H/Q in entry =           9
  In of MODEL   43
    1    H    VAL  54           H        VAL  54 -27.910   5.526  -5.193
    2    HA   VAL  54           HA       VAL  54 -25.196   4.550  -5.825
    3    HB   VAL  54           HB       VAL  54 -26.163   6.387  -3.576
    4   HG11  VAL  54          HG11      VAL  54 -23.654   4.852  -3.882
    5   HG13  VAL  54          HG12      VAL  54 -24.362   5.573  -2.438
    6   HG12  VAL  54          HG13      VAL  54 -23.421   6.568  -3.549
    7   HG22  VAL  54          HG21      VAL  54 -25.234   8.154  -4.695
    8   HG21  VAL  54          HG22      VAL  54 -25.839   7.182  -6.036
    9   HG23  VAL  54          HG23      VAL  54 -24.128   7.132  -5.614

  No H/Q in entry =           9
  In of MODEL   43
    1    H    LEU  55           H        LEU  55 -24.685   2.607  -5.176
    2    HA   LEU  55           HA       LEU  55 -26.229   1.379  -2.978
    3    HB2  LEU  55           HB2      LEU  55 -24.749   0.127  -5.281
    4    HB3  LEU  55           HB3      LEU  55 -25.539  -0.764  -3.979
    5    HG   LEU  55           HG       LEU  55 -26.922   0.875  -6.093
    6   HD13  LEU  55          HD11      LEU  55 -26.719  -0.996  -7.303
    7   HD12  LEU  55          HD12      LEU  55 -27.703  -1.820  -6.094
    8   HD11  LEU  55          HD13      LEU  55 -25.945  -1.834  -5.960
    9   HD23  LEU  55          HD21      LEU  55 -28.286  -1.000  -4.213
   10   HD22  LEU  55          HD22      LEU  55 -28.927   0.408  -5.063
   11   HD21  LEU  55          HD23      LEU  55 -27.882   0.625  -3.659

  No H/Q in entry =          11
  In of MODEL   43
    1    H    LEU  56           H        LEU  56 -25.087   0.743  -1.180
    2    HA   LEU  56           HA       LEU  56 -22.139   1.005  -1.260
    3    HB2  LEU  56           HB2      LEU  56 -23.926   0.889   1.157
    4    HB3  LEU  56           HB3      LEU  56 -22.199   1.241   1.126
    5    HG   LEU  56           HG       LEU  56 -24.428   3.016   0.174
    6   HD11  LEU  56          HD11      LEU  56 -23.307   2.599   2.686
    7   HD13  LEU  56          HD12      LEU  56 -24.239   4.008   2.181
    8   HD12  LEU  56          HD13      LEU  56 -22.481   4.033   2.076
    9   HD23  LEU  56          HD21      LEU  56 -22.410   4.623  -0.048
   10   HD22  LEU  56          HD22      LEU  56 -22.856   3.538  -1.366
   11   HD21  LEU  56          HD23      LEU  56 -21.510   3.130  -0.302

  No H/Q in entry =          11
  In of MODEL   43
    1    H    GLY  57           H        GLY  57 -20.830  -0.684  -0.729
    2    HA3  GLY  57           HA2      GLY  57 -21.875  -3.326  -0.902
    3    HA2  GLY  57           HA3      GLY  57 -20.227  -2.903  -0.441

  No H/Q in entry =           3
  In of MODEL   43
    1    HA   PRO  58           HA       PRO  58 -23.045  -3.791   3.302
    2    HB2  PRO  58           HB2      PRO  58 -22.473  -6.421   3.919
    3    HB3  PRO  58           HB3      PRO  58 -23.848  -5.956   2.917
    4    HG2  PRO  58           HG2      PRO  58 -21.171  -6.965   2.110
    5    HG3  PRO  58           HG3      PRO  58 -22.761  -7.357   1.457
    6    HD2  PRO  58           HD2      PRO  58 -21.084  -5.622   0.207
    7    HD3  PRO  58           HD3      PRO  58 -22.838  -5.456   0.121

  No H/Q in entry =           7
  In of MODEL   43
    1    H    GLN  59           H        GLN  59 -19.704  -4.422   2.666
    2    HA   GLN  59           HA       GLN  59 -18.925  -4.458   5.420
    3    HB2  GLN  59           HB2      GLN  59 -17.282  -3.624   3.025
    4    HB3  GLN  59           HB3      GLN  59 -16.667  -4.013   4.619
    5    HG2  GLN  59           HG2      GLN  59 -18.074  -5.932   2.769
    6    HG3  GLN  59           HG3      GLN  59 -16.336  -5.829   3.001
    7   HE21  GLN  59          HE21      GLN  59 -18.763  -7.432   3.761
    8   HE22  GLN  59          HE22      GLN  59 -18.601  -8.284   5.181

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ILE  60           H        ILE  60 -19.762  -1.880   3.205
    2    HA   ILE  60           HA       ILE  60 -18.800   0.049   5.230
    3    HB   ILE  60           HB       ILE  60 -18.975   1.776   3.392
    4   HG12  ILE  60          HG12      ILE  60 -18.893  -0.475   1.427
    5   HG13  ILE  60          HG13      ILE  60 -20.448   0.144   1.981
    6   HG22  ILE  60          HG21      ILE  60 -17.049  -0.313   2.529
    7   HG21  ILE  60          HG22      ILE  60 -16.904   0.417   4.127
    8   HG23  ILE  60          HG23      ILE  60 -16.835   1.431   2.685
    9   HD13  ILE  60          HD11      ILE  60 -20.092   1.410   0.068
   10   HD12  ILE  60          HD12      ILE  60 -18.350   1.502   0.328
   11   HD11  ILE  60          HD13      ILE  60 -19.442   2.473   1.316

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ALA  61           H        ALA  61 -21.325  -1.421   5.332
    2    HA   ALA  61           HA       ALA  61 -23.476   0.341   4.884
    3    HB1  ALA  61           HB1      ALA  61 -24.746  -1.084   6.231
    4    HB2  ALA  61           HB2      ALA  61 -23.358  -1.531   7.223
    5    HB3  ALA  61           HB3      ALA  61 -23.498  -2.143   5.574

  No H/Q in entry =           5
  In of MODEL   43
    1    H    TYR  62           H        TYR  62 -21.249   0.144   7.661
    2    HA   TYR  62           HA       TYR  62 -22.710   1.881   9.336
    3    HB2  TYR  62           HB2      TYR  62 -20.640   2.219  10.547
    4    HB3  TYR  62           HB3      TYR  62 -20.781   0.521  10.095
    5    HD1  TYR  62           HD1      TYR  62 -19.230  -0.485   8.492
    6    HD2  TYR  62           HD2      TYR  62 -18.901   3.647   9.530
    7    HE1  TYR  62           HE1      TYR  62 -17.021  -0.392   7.401
    8    HE2  TYR  62           HE2      TYR  62 -16.678   3.734   8.440
    9    HH   TYR  62           HH       TYR  62 -15.632   1.499   6.321

  No H/Q in entry =           9
  In of MODEL   43
    1    H    MET  63           H        MET  63 -21.057   2.645   6.459
    2    HA   MET  63           HA       MET  63 -20.752   5.472   7.133
    3    HB2  MET  63           HB2      MET  63 -20.239   3.902   4.606
    4    HB3  MET  63           HB3      MET  63 -19.971   5.639   4.765
    5    HG2  MET  63           HG2      MET  63 -18.261   5.238   6.436
    6    HG3  MET  63           HG3      MET  63 -18.543   3.501   6.322
    7    HE3  MET  63           HE1      MET  63 -17.923   6.148   2.937
    8    HE2  MET  63           HE2      MET  63 -16.393   6.357   3.790
    9    HE1  MET  63           HE3      MET  63 -17.918   6.628   4.635

  No H/Q in entry =           9
  In of MODEL   43
    1    H    LEU  64           H        LEU  64 -23.410   3.733   6.205
    2    HA   LEU  64           HA       LEU  64 -24.573   5.194   4.129
    3    HB2  LEU  64           HB2      LEU  64 -25.529   3.136   5.070
    4    HB3  LEU  64           HB3      LEU  64 -25.932   4.008   6.548
    5    HG   LEU  64           HG       LEU  64 -27.578   5.334   5.328
    6   HD13  LEU  64          HD11      LEU  64 -27.307   5.547   3.092
    7   HD12  LEU  64          HD12      LEU  64 -28.030   3.944   2.963
    8   HD11  LEU  64          HD13      LEU  64 -26.276   4.121   3.003
    9   HD23  LEU  64          HD21      LEU  64 -28.235   2.544   4.604
   10   HD22  LEU  64          HD22      LEU  64 -29.160   3.729   5.527
   11   HD21  LEU  64          HD23      LEU  64 -27.816   2.876   6.284

  No H/Q in entry =          11
  In of MODEL   43
    1    HA   PRO  65           HA       PRO  65 -26.574   8.463   6.882
    2    HB2  PRO  65           HB2      PRO  65 -24.545   8.541   9.115
    3    HB3  PRO  65           HB3      PRO  65 -26.268   8.904   9.176
    4    HG2  PRO  65           HG2      PRO  65 -25.437   6.614  10.108
    5    HG3  PRO  65           HG3      PRO  65 -26.867   6.642   9.078
    6    HD2  PRO  65           HD2      PRO  65 -24.035   5.887   8.350
    7    HD3  PRO  65           HD3      PRO  65 -25.537   5.069   7.923

  No H/Q in entry =           7
  In of MODEL   43
    1    H    GLU  66           H        GLU  66 -23.024   8.239   6.920
    2    HA   GLU  66           HA       GLU  66 -22.597  11.017   6.493
    3    HB2  GLU  66           HB2      GLU  66 -20.903   8.621   5.839
    4    HB3  GLU  66           HB3      GLU  66 -20.375  10.289   5.617
    5    HG2  GLU  66           HG2      GLU  66 -20.544  10.684   7.983
    6    HG3  GLU  66           HG3      GLU  66 -21.147   9.045   8.231

  No H/Q in entry =           6
  In of MODEL   43
    1    H    ILE  67           H        ILE  67 -22.854   8.267   4.260
    2    HA   ILE  67           HA       ILE  67 -22.380   9.939   1.952
    3    HB   ILE  67           HB       ILE  67 -23.416   7.080   2.160
    4   HG12  ILE  67          HG12      ILE  67 -20.742   8.116   1.204
    5   HG13  ILE  67          HG13      ILE  67 -21.039   7.721   2.895
    6   HG21  ILE  67          HG21      ILE  67 -23.291   8.940  -0.078
    7   HG23  ILE  67          HG22      ILE  67 -23.994   7.325  -0.010
    8   HG22  ILE  67          HG23      ILE  67 -22.278   7.524  -0.357
    9   HD12  ILE  67          HD11      ILE  67 -20.731   5.917   0.554
   10   HD11  ILE  67          HD12      ILE  67 -21.757   5.402   1.890
   11   HD13  ILE  67          HD13      ILE  67 -20.061   5.786   2.179

  No H/Q in entry =          11
  In of MODEL   43
    1    H    GLN  68           H        GLN  68 -25.280   9.037   3.621
    2    HA   GLN  68           HA       GLN  68 -27.082  10.044   1.660
    3    HB2  GLN  68           HB2      GLN  68 -27.324   9.717   4.647
    4    HB3  GLN  68           HB3      GLN  68 -28.623  10.371   3.665
    5    HG2  GLN  68           HG2      GLN  68 -28.765   8.337   2.402
    6    HG3  GLN  68           HG3      GLN  68 -27.338   7.694   3.193
    7   HE21  GLN  68          HE21      GLN  68 -29.582   6.445   3.088
    8   HE22  GLN  68          HE22      GLN  68 -30.418   6.039   4.514

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ARG  69           H        ARG  69 -25.367  11.645   4.371
    2    HA   ARG  69           HA       ARG  69 -26.609  14.190   3.962
    3    HB2  ARG  69           HB2      ARG  69 -24.298  13.152   5.532
    4    HB3  ARG  69           HB3      ARG  69 -24.294  14.872   5.165
    5    HG2  ARG  69           HG2      ARG  69 -26.595  15.038   6.159
    6    HG3  ARG  69           HG3      ARG  69 -26.467  13.343   6.641
    7    HD2  ARG  69           HD2      ARG  69 -24.648  15.614   7.523
    8    HD3  ARG  69           HD3      ARG  69 -25.812  14.771   8.535
    9    HE   ARG  69           HE       ARG  69 -23.260  13.704   7.564
   10   HH21  ARG  69          HH11      ARG  69 -22.529  11.909   8.763
   11   HH22  ARG  69          HH12      ARG  69 -23.586  11.153   9.907
   12   HH11  ARG  69          HH21      ARG  69 -26.223  13.317   9.295
   13   HH12  ARG  69          HH22      ARG  69 -25.676  11.948  10.207

  No H/Q in entry =          13
  In of MODEL   43
    1    H    LEU  70           H        LEU  70 -23.828  12.632   2.582
    2    HA   LEU  70           HA       LEU  70 -22.608  14.930   1.388
    3    HB2  LEU  70           HB2      LEU  70 -21.727  12.569   1.986
    4    HB3  LEU  70           HB3      LEU  70 -22.381  12.126   0.411
    5    HG   LEU  70           HG       LEU  70 -20.731  13.409  -0.700
    6   HD11  LEU  70          HD11      LEU  70 -19.837  14.225   2.074
    7   HD13  LEU  70          HD12      LEU  70 -20.492  15.286   0.827
    8   HD12  LEU  70          HD13      LEU  70 -18.921  14.523   0.594
    9   HD22  LEU  70          HD21      LEU  70 -19.386  11.623  -0.471
   10   HD21  LEU  70          HD22      LEU  70 -20.322  11.156   0.949
   11   HD23  LEU  70          HD23      LEU  70 -18.883  12.158   1.131

  No H/Q in entry =          11
  In of MODEL   43
    1    H    LEU  71           H        LEU  71 -24.902  12.495   0.310
    2    HA   LEU  71           HA       LEU  71 -25.376  13.994  -2.209
    3    HB2  LEU  71           HB2      LEU  71 -25.731  11.026  -1.743
    4    HB3  LEU  71           HB3      LEU  71 -25.832  11.883  -3.279
    5    HG   LEU  71           HG       LEU  71 -23.296  11.775  -1.645
    6   HD12  LEU  71          HD11      LEU  71 -23.460  10.138  -4.067
    7   HD11  LEU  71          HD12      LEU  71 -24.488   9.575  -2.749
    8   HD13  LEU  71          HD13      LEU  71 -22.753   9.767  -2.494
    9   HD22  LEU  71          HD21      LEU  71 -23.320  13.585  -3.149
   10   HD21  LEU  71          HD22      LEU  71 -23.886  12.563  -4.470
   11   HD23  LEU  71          HD23      LEU  71 -22.267  12.335  -3.808

  No H/Q in entry =          11
  In of MODEL   43
    1    HA   PRO  72           HA       PRO  72 -29.231  13.764   0.455
    2    HB2  PRO  72           HB2      PRO  72 -29.953  16.366   0.366
    3    HB3  PRO  72           HB3      PRO  72 -28.657  15.852   1.447
    4    HG2  PRO  72           HG2      PRO  72 -28.438  17.019  -1.316
    5    HG3  PRO  72           HG3      PRO  72 -27.627  17.538   0.162
    6    HD2  PRO  72           HD2      PRO  72 -26.394  15.899  -1.608
    7    HD3  PRO  72           HD3      PRO  72 -26.129  15.730   0.126

  No H/Q in entry =           7
  In of MODEL   43
    1    H    ASN  73           H        ASN  73 -28.593  14.666  -2.772
    2    HA   ASN  73           HA       ASN  73 -31.472  14.509  -3.372
    3    HB2  ASN  73           HB2      ASN  73 -30.970  15.576  -5.481
    4    HB3  ASN  73           HB3      ASN  73 -30.380  16.534  -4.132
    5   HD21  ASN  73          HD21      ASN  73 -29.613  16.520  -6.818
    6   HD22  ASN  73          HD22      ASN  73 -27.958  16.268  -7.026

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LYS  74           H        LYS  74 -29.612  12.152  -2.954
    2    HA   LYS  74           HA       LYS  74 -30.282  10.775  -5.487
    3    HB2  LYS  74           HB2      LYS  74 -27.752  10.354  -3.891
    4    HB3  LYS  74           HB3      LYS  74 -28.195   9.555  -5.399
    5    HG2  LYS  74           HG2      LYS  74 -27.767  12.508  -5.219
    6    HG3  LYS  74           HG3      LYS  74 -26.456  11.370  -5.531
    7    HD2  LYS  74           HD2      LYS  74 -27.643  10.493  -7.456
    8    HD3  LYS  74           HD3      LYS  74 -29.002  11.568  -7.128
    9    HE2  LYS  74           HE2      LYS  74 -27.674  13.502  -7.596
   10    HE3  LYS  74           HE3      LYS  74 -26.205  12.530  -7.697
   11    HZ2  LYS  74           HZ1      LYS  74 -27.663  13.199  -9.811
   12    HZ1  LYS  74           HZ2      LYS  74 -28.397  11.717  -9.422
   13    HZ3  LYS  74           HZ3      LYS  74 -26.729  11.784  -9.737

  No H/Q in entry =          13
  In of MODEL   43
    1    HA   PRO  75           HA       PRO  75 -31.807   7.888  -2.482
    2    HB2  PRO  75           HB2      PRO  75 -32.256   5.681  -4.047
    3    HB3  PRO  75           HB3      PRO  75 -33.306   7.096  -4.113
    4    HG2  PRO  75           HG2      PRO  75 -31.024   6.360  -5.905
    5    HG3  PRO  75           HG3      PRO  75 -32.650   6.885  -6.338
    6    HD2  PRO  75           HD2      PRO  75 -30.608   8.640  -6.326
    7    HD3  PRO  75           HD3      PRO  75 -32.210   9.133  -5.774

  No H/Q in entry =           7
  In of MODEL   43
    1    H    VAL  76           H        VAL  76 -30.400   6.763  -1.118
    2    HA   VAL  76           HA       VAL  76 -28.018   5.411  -2.242
    3    HB   VAL  76           HB       VAL  76 -28.195   6.907   0.408
    4   HG11  VAL  76          HG11      VAL  76 -25.929   5.483  -1.000
    5   HG13  VAL  76          HG12      VAL  76 -26.633   5.081   0.568
    6   HG12  VAL  76          HG13      VAL  76 -25.705   6.568   0.374
    7   HG22  VAL  76          HG21      VAL  76 -27.432   8.763  -0.498
    8   HG21  VAL  76          HG22      VAL  76 -28.029   8.089  -2.015
    9   HG23  VAL  76          HG23      VAL  76 -26.330   7.909  -1.578

  No H/Q in entry =           9
  In of MODEL   43
    1    H    GLU  77           H        GLU  77 -27.913   3.252  -1.618
    2    HA   GLU  77           HA       GLU  77 -28.715   2.526   1.049
    3    HB2  GLU  77           HB2      GLU  77 -30.417   0.967   0.546
    4    HB3  GLU  77           HB3      GLU  77 -30.888   2.514  -0.161
    5    HG2  GLU  77           HG2      GLU  77 -30.345   1.711  -2.349
    6    HG3  GLU  77           HG3      GLU  77 -29.780   0.184  -1.673

  No H/Q in entry =           6
  In of MODEL   43
    1    H    VAL  78           H        VAL  78 -28.497   0.428   1.720
    2    HA   VAL  78           HA       VAL  78 -25.887  -0.495   0.809
    3    HB   VAL  78           HB       VAL  78 -27.617  -1.269   3.198
    4   HG11  VAL  78          HG11      VAL  78 -25.360  -2.633   2.057
    5   HG13  VAL  78          HG12      VAL  78 -26.278  -3.043   3.508
    6   HG12  VAL  78          HG13      VAL  78 -24.895  -1.956   3.617
    7   HG22  VAL  78          HG21      VAL  78 -26.070   0.019   4.511
    8   HG21  VAL  78          HG22      VAL  78 -26.765   1.020   3.238
    9   HG23  VAL  78          HG23      VAL  78 -25.122   0.400   3.074

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ILE  79           H        ILE  79 -25.465  -2.435  -0.089
    2    HA   ILE  79           HA       ILE  79 -27.619  -3.806  -1.406
    3    HB   ILE  79           HB       ILE  79 -24.660  -4.496  -1.212
    4   HG12  ILE  79          HG12      ILE  79 -26.257  -3.316  -3.491
    5   HG13  ILE  79          HG13      ILE  79 -25.316  -2.350  -2.353
    6   HG22  ILE  79          HG21      ILE  79 -25.849  -5.627  -3.511
    7   HG21  ILE  79          HG22      ILE  79 -26.847  -6.085  -2.130
    8   HG23  ILE  79          HG23      ILE  79 -25.123  -6.459  -2.135
    9   HD13  ILE  79          HD11      ILE  79 -23.930  -2.552  -4.185
   10   HD12  ILE  79          HD12      ILE  79 -24.366  -4.242  -4.451
   11   HD11  ILE  79          HD13      ILE  79 -23.343  -3.799  -3.083

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ASP  80           H        ASP  80 -28.582  -5.675  -0.800
    2    HA   ASP  80           HA       ASP  80 -28.551  -6.560   1.851
    3    HB2  ASP  80           HB2      ASP  80 -30.351  -7.049   0.233
    4    HB3  ASP  80           HB3      ASP  80 -29.259  -8.124  -0.640

  No H/Q in entry =           4
  In of MODEL   43
    1    H    SER  81           H        SER  81 -27.068  -7.771   2.973
    2    HA   SER  81           HA       SER  81 -24.626  -8.597   1.761
    3    HB2  SER  81           HB2      SER  81 -24.109  -9.642   3.933
    4    HB3  SER  81           HB3      SER  81 -24.717  -7.999   4.141
    5    HG   SER  81           HG       SER  81 -26.405  -8.734   5.118

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU  82           H        LEU  82 -27.444 -10.533   2.125
    2    HA   LEU  82           HA       LEU  82 -26.035 -12.987   1.606
    3    HB2  LEU  82           HB2      LEU  82 -28.935 -12.211   1.377
    4    HB3  LEU  82           HB3      LEU  82 -28.323 -13.851   1.169
    5    HG   LEU  82           HG       LEU  82 -28.149 -12.262   3.712
    6   HD11  LEU  82          HD11      LEU  82 -30.102 -14.309   2.677
    7   HD13  LEU  82          HD12      LEU  82 -30.436 -12.751   3.436
    8   HD12  LEU  82          HD13      LEU  82 -29.832 -14.094   4.407
    9   HD23  LEU  82          HD21      LEU  82 -27.677 -14.682   4.508
   10   HD22  LEU  82          HD22      LEU  82 -26.386 -13.802   3.691
   11   HD21  LEU  82          HD23      LEU  82 -27.326 -15.005   2.809

  No H/Q in entry =          11
  In of MODEL   43
    1    H    LEU  83           H        LEU  83 -27.887 -10.669  -0.308
    2    HA   LEU  83           HA       LEU  83 -27.787 -12.052  -2.772
    3    HB2  LEU  83           HB2      LEU  83 -28.030  -9.123  -2.141
    4    HB3  LEU  83           HB3      LEU  83 -28.114  -9.776  -3.776
    5    HG   LEU  83           HG       LEU  83 -30.143 -10.035  -1.577
    6   HD13  LEU  83          HD11      LEU  83 -30.807  -8.156  -2.647
    7   HD12  LEU  83          HD12      LEU  83 -31.344  -9.250  -3.919
    8   HD11  LEU  83          HD13      LEU  83 -29.765  -8.472  -4.032
    9   HD23  LEU  83          HD21      LEU  83 -30.380 -11.302  -4.291
   10   HD22  LEU  83          HD22      LEU  83 -31.353 -11.588  -2.848
   11   HD21  LEU  83          HD23      LEU  83 -29.696 -12.185  -2.927

  No H/Q in entry =          11
  In of MODEL   43
    1    H    TYR  84           H        TYR  84 -25.687  -9.768  -1.133
    2    HA   TYR  84           HA       TYR  84 -23.824  -9.398  -3.286
    3    HB2  TYR  84           HB2      TYR  84 -24.239  -7.875  -1.266
    4    HB3  TYR  84           HB3      TYR  84 -23.268  -9.022  -0.347
    5    HD1  TYR  84           HD1      TYR  84 -20.903  -8.972  -0.439
    6    HD2  TYR  84           HD2      TYR  84 -23.177  -6.661  -3.218
    7    HE1  TYR  84           HE1      TYR  84 -18.830  -7.857  -1.190
    8    HE2  TYR  84           HE2      TYR  84 -21.112  -5.546  -3.985
    9    HH   TYR  84           HH       TYR  84 -18.564  -5.221  -2.506

  No H/Q in entry =           9
  In of MODEL   43
    1    H    GLY  85           H        GLY  85 -23.664 -11.391  -0.327
    2    HA3  GLY  85           HA2      GLY  85 -21.148 -12.480  -0.829
    3    HA2  GLY  85           HA3      GLY  85 -22.413 -13.250   0.127

  No H/Q in entry =           3
  In of MODEL   43
    1    H    LYS  86           H        LYS  86 -24.300 -13.534  -1.912
    2    HA   LYS  86           HA       LYS  86 -23.392 -15.972  -3.164
    3    HB2  LYS  86           HB2      LYS  86 -25.960 -14.392  -3.320
    4    HB3  LYS  86           HB3      LYS  86 -25.729 -16.015  -3.966
    5    HG2  LYS  86           HG2      LYS  86 -25.353 -15.465  -1.068
    6    HG3  LYS  86           HG3      LYS  86 -26.959 -15.723  -1.751
    7    HD2  LYS  86           HD2      LYS  86 -24.773 -17.599  -2.519
    8    HD3  LYS  86           HD3      LYS  86 -25.480 -17.759  -0.912
    9    HE2  LYS  86           HE2      LYS  86 -27.725 -17.875  -1.983
   10    HE3  LYS  86           HE3      LYS  86 -26.925 -17.890  -3.553
   11    HZ1  LYS  86           HZ1      LYS  86 -26.310 -19.845  -1.407
   12    HZ3  LYS  86           HZ2      LYS  86 -25.848 -19.915  -3.041
   13    HZ2  LYS  86           HZ3      LYS  86 -27.476 -20.128  -2.610

  No H/Q in entry =          13
  In of MODEL   43
    1    H    VAL  87           H        VAL  87 -23.212 -12.768  -4.082
    2    HA   VAL  87           HA       VAL  87 -22.871 -11.626  -6.035
    3    HB   VAL  87           HB       VAL  87 -21.974 -14.158  -7.420
    4   HG11  VAL  87          HG11      VAL  87 -21.938 -11.687  -8.312
    5   HG13  VAL  87          HG12      VAL  87 -20.537 -12.725  -8.584
    6   HG12  VAL  87          HG13      VAL  87 -20.515 -11.533  -7.284
    7   HG21  VAL  87          HG21      VAL  87 -20.425 -12.778  -5.235
    8   HG23  VAL  87          HG22      VAL  87 -19.783 -14.002  -6.329
    9   HG22  VAL  87          HG23      VAL  87 -21.062 -14.420  -5.191

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ASP  88           H        ASP  88 -25.413 -12.126  -5.652
    2    HA   ASP  88           HA       ASP  88 -26.627 -13.296  -8.028
    3    HB2  ASP  88           HB2      ASP  88 -27.608 -13.469  -5.692
    4    HB3  ASP  88           HB3      ASP  88 -27.968 -11.746  -5.800

  No H/Q in entry =           4
  In of MODEL   43
    1    H    GLY  89           H        GLY  89 -25.872 -12.090  -9.687
    2    HA3  GLY  89           HA2      GLY  89 -25.903  -9.314  -9.906
    3    HA2  GLY  89           HA3      GLY  89 -25.955 -10.443 -11.258

  No H/Q in entry =           3
  In of MODEL   43
    1    H    LEU  90           H        LEU  90 -28.468 -11.656 -10.774
    2    HA   LEU  90           HA       LEU  90 -30.182  -9.632 -11.883
    3    HB2  LEU  90           HB2      LEU  90 -30.385 -12.025 -12.444
    4    HB3  LEU  90           HB3      LEU  90 -30.891 -12.352 -10.787
    5    HG   LEU  90           HG       LEU  90 -32.949 -11.123 -11.136
    6   HD13  LEU  90          HD11      LEU  90 -32.692  -9.405 -12.626
    7   HD12  LEU  90          HD12      LEU  90 -33.310 -10.618 -13.748
    8   HD11  LEU  90          HD13      LEU  90 -31.576 -10.318 -13.645
    9   HD23  LEU  90          HD21      LEU  90 -32.997 -12.772 -13.559
   10   HD22  LEU  90          HD22      LEU  90 -33.967 -12.872 -12.090
   11   HD21  LEU  90          HD23      LEU  90 -32.349 -13.574 -12.128

  No H/Q in entry =          11
  In of MODEL   43
    1    H    GLY  91           H        GLY  91 -30.060 -11.118  -8.690
    2    HA3  GLY  91           HA2      GLY  91 -32.324  -9.872  -7.633
    3    HA2  GLY  91           HA3      GLY  91 -30.952 -10.473  -6.702

  No H/Q in entry =           3
  In of MODEL   43
    1    H    VAL  92           H        VAL  92 -28.946  -8.760  -7.593
    2    HA   VAL  92           HA       VAL  92 -29.594  -6.408  -6.053
    3    HB   VAL  92           HB       VAL  92 -27.096  -7.027  -7.673
    4   HG12  VAL  92          HG11      VAL  92 -27.131  -5.119  -5.360
    5   HG11  VAL  92          HG12      VAL  92 -27.783  -4.551  -6.898
    6   HG13  VAL  92          HG13      VAL  92 -26.114  -5.110  -6.801
    7   HG22  VAL  92          HG21      VAL  92 -26.941  -8.613  -6.071
    8   HG21  VAL  92          HG22      VAL  92 -28.029  -7.763  -4.972
    9   HG23  VAL  92          HG23      VAL  92 -26.347  -7.255  -5.115

  No H/Q in entry =           9
  In of MODEL   43
    1    H    LEU  93           H        LEU  93 -29.263  -7.116  -9.473
    2    HA   LEU  93           HA       LEU  93 -29.475  -4.472 -10.419
    3    HB2  LEU  93           HB2      LEU  93 -28.951  -6.369 -11.873
    4    HB3  LEU  93           HB3      LEU  93 -30.577  -7.008 -11.627
    5    HG   LEU  93           HG       LEU  93 -31.494  -5.000 -12.755
    6   HD11  LEU  93          HD11      LEU  93 -29.553  -3.504 -12.285
    7   HD13  LEU  93          HD12      LEU  93 -30.014  -3.523 -13.987
    8   HD12  LEU  93          HD13      LEU  93 -28.602  -4.431 -13.445
    9   HD23  LEU  93          HD21      LEU  93 -30.514  -5.639 -15.050
   10   HD22  LEU  93          HD22      LEU  93 -31.411  -6.842 -14.125
   11   HD21  LEU  93          HD23      LEU  93 -29.648  -6.883 -14.147

  No H/Q in entry =          11
  In of MODEL   43
    1    H    LYS  94           H        LYS  94 -31.975  -6.879  -9.524
    2    HA   LYS  94           HA       LYS  94 -34.244  -5.317 -10.133
    3    HB2  LYS  94           HB2      LYS  94 -33.826  -7.512  -8.111
    4    HB3  LYS  94           HB3      LYS  94 -35.387  -6.733  -8.366
    5    HG2  LYS  94           HG2      LYS  94 -35.369  -7.528 -10.695
    6    HG3  LYS  94           HG3      LYS  94 -33.848  -8.361 -10.378
    7    HD2  LYS  94           HD2      LYS  94 -35.018  -9.619  -8.531
    8    HD3  LYS  94           HD3      LYS  94 -36.531  -8.892  -9.073
    9    HE2  LYS  94           HE2      LYS  94 -36.092  -9.864 -11.339
   10    HE3  LYS  94           HE3      LYS  94 -34.714 -10.718 -10.645
   11    HZ3  LYS  94           HZ1      LYS  94 -36.645 -12.138 -10.783
   12    HZ2  LYS  94           HZ2      LYS  94 -37.552 -11.054  -9.838
   13    HZ1  LYS  94           HZ3      LYS  94 -36.226 -11.869  -9.159

  No H/Q in entry =          13
  In of MODEL   43
    1    H    ALA  95           H        ALA  95 -32.395  -5.515  -7.105
    2    HA   ALA  95           HA       ALA  95 -34.138  -3.826  -5.616
    3    HB2  ALA  95           HB1      ALA  95 -31.835  -5.324  -5.095
    4    HB3  ALA  95           HB2      ALA  95 -32.749  -4.359  -3.939
    5    HB1  ALA  95           HB3      ALA  95 -31.371  -3.652  -4.781

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA  96           H        ALA  96 -31.479  -3.132  -7.750
    2    HA   ALA  96           HA       ALA  96 -31.223  -0.374  -6.998
    3    HB2  ALA  96           HB1      ALA  96 -29.875  -0.238  -9.125
    4    HB3  ALA  96           HB2      ALA  96 -30.275  -1.929  -9.427
    5    HB1  ALA  96           HB3      ALA  96 -29.319  -1.489  -8.012

  No H/Q in entry =           5
  In of MODEL   43
    1    H    VAL  97           H        VAL  97 -32.878  -2.021  -9.654
    2    HA   VAL  97           HA       VAL  97 -33.834   0.325 -10.916
    3    HB   VAL  97           HB       VAL  97 -34.804  -2.551 -10.926
    4   HG11  VAL  97          HG11      VAL  97 -36.488  -0.452 -11.408
    5   HG13  VAL  97          HG12      VAL  97 -36.644  -2.045 -12.151
    6   HG12  VAL  97          HG13      VAL  97 -35.827  -0.745 -13.017
    7   HG21  VAL  97          HG21      VAL  97 -33.450  -0.811 -12.989
    8   HG23  VAL  97          HG22      VAL  97 -33.998  -2.466 -13.261
    9   HG22  VAL  97          HG23      VAL  97 -32.716  -2.140 -12.092

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ALA  98           H        ALA  98 -35.106  -1.767  -8.349
    2    HA   ALA  98           HA       ALA  98 -37.595  -0.475  -7.978
    3    HB1  ALA  98           HB1      ALA  98 -36.694  -2.720  -6.941
    4    HB3  ALA  98           HB2      ALA  98 -37.809  -1.726  -6.002
    5    HB2  ALA  98           HB3      ALA  98 -36.079  -1.671  -5.664

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA  99           H        ALA  99 -34.457   0.161  -6.371
    2    HA   ALA  99           HA       ALA  99 -35.453   2.216  -4.711
    3    HB1  ALA  99           HB1      ALA  99 -32.868   1.173  -5.483
    4    HB2  ALA  99           HB2      ALA  99 -33.358   1.963  -3.983
    5    HB3  ALA  99           HB3      ALA  99 -32.842   2.933  -5.363

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ILE 100           H        ILE 100 -34.446   2.266  -8.080
    2    HA   ILE 100           HA       ILE 100 -34.466   5.118  -8.317
    3    HB   ILE 100           HB       ILE 100 -34.708   2.959 -10.439
    4   HG12  ILE 100          HG12      ILE 100 -32.427   4.828  -9.807
    5   HG13  ILE 100          HG13      ILE 100 -32.550   3.191  -9.165
    6   HG21  ILE 100          HG21      ILE 100 -34.966   5.897 -10.585
    7   HG23  ILE 100          HG22      ILE 100 -35.557   4.652 -11.687
    8   HG22  ILE 100          HG23      ILE 100 -33.873   5.173 -11.764
    9   HD12  ILE 100          HD11      ILE 100 -31.997   4.099 -11.951
   10   HD11  ILE 100          HD12      ILE 100 -32.745   2.525 -11.678
   11   HD13  ILE 100          HD13      ILE 100 -31.168   2.884 -10.979

  No H/Q in entry =          11
  In of MODEL   43
    1    H    LYS 101           H        LYS 101 -36.913   2.639  -8.998
    2    HA   LYS 101           HA       LYS 101 -38.908   4.399  -9.986
    3    HB2  LYS 101           HB2      LYS 101 -38.937   1.630  -8.841
    4    HB3  LYS 101           HB3      LYS 101 -40.447   2.476  -9.174
    5    HG2  LYS 101           HG2      LYS 101 -39.993   2.570 -11.478
    6    HG3  LYS 101           HG3      LYS 101 -38.320   2.070 -11.240
    7    HD2  LYS 101           HD2      LYS 101 -39.687   0.231 -12.099
    8    HD3  LYS 101           HD3      LYS 101 -39.062  -0.125 -10.488
    9    HE2  LYS 101           HE2      LYS 101 -41.155  -0.698  -9.954
   10    HE3  LYS 101           HE3      LYS 101 -41.513   1.030  -9.964
   11    HZ3  LYS 101           HZ1      LYS 101 -42.437   0.911 -12.069
   12    HZ2  LYS 101           HZ2      LYS 101 -42.973  -0.529 -11.347
   13    HZ1  LYS 101           HZ3      LYS 101 -41.679  -0.562 -12.445

  No H/Q in entry =          13
  In of MODEL   43
    1    H    LYS 102           H        LYS 102 -38.464   2.914  -6.773
    2    HA   LYS 102           HA       LYS 102 -40.626   4.244  -5.558
    3    HB2  LYS 102           HB2      LYS 102 -39.487   2.316  -4.545
    4    HB3  LYS 102           HB3      LYS 102 -38.035   3.291  -4.324
    5    HG2  LYS 102           HG2      LYS 102 -39.253   4.768  -2.821
    6    HG3  LYS 102           HG3      LYS 102 -40.707   3.796  -3.044
    7    HD2  LYS 102           HD2      LYS 102 -39.578   1.869  -2.020
    8    HD3  LYS 102           HD3      LYS 102 -38.124   2.842  -1.795
    9    HE2  LYS 102           HE2      LYS 102 -39.375   4.403  -0.381
   10    HE3  LYS 102           HE3      LYS 102 -40.846   3.462  -0.627
   11    HZ1  LYS 102           HZ1      LYS 102 -39.217   1.618   0.368
   12    HZ3  LYS 102           HZ2      LYS 102 -40.264   2.570   1.306
   13    HZ2  LYS 102           HZ3      LYS 102 -38.627   3.001   1.157

  No H/Q in entry =          13
  In of MODEL   43
    1    H    ALA 103           H        ALA 103 -37.609   5.458  -6.613
    2    HA   ALA 103           HA       ALA 103 -37.679   7.792  -4.843
    3    HB2  ALA 103           HB1      ALA 103 -35.667   8.401  -6.445
    4    HB3  ALA 103           HB2      ALA 103 -35.733   6.682  -6.833
    5    HB1  ALA 103           HB3      ALA 103 -35.458   7.201  -5.170

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA 104           H        ALA 104 -38.378   7.078  -8.177
    2    HA   ALA 104           HA       ALA 104 -38.810   9.889  -8.811
    3    HB2  ALA 104           HB1      ALA 104 -38.916   9.212 -11.008
    4    HB1  ALA 104           HB2      ALA 104 -39.727   7.696 -10.612
    5    HB3  ALA 104           HB3      ALA 104 -37.989   7.862 -10.354

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA 105           H        ALA 105 -40.516   7.890  -6.976
    2    HA   ALA 105           HA       ALA 105 -42.856   9.420  -6.931
    3    HB2  ALA 105           HB1      ALA 105 -43.672   8.593  -8.956
    4    HB3  ALA 105           HB2      ALA 105 -44.362   7.449  -7.805
    5    HB1  ALA 105           HB3      ALA 105 -42.925   7.011  -8.728

  No H/Q in entry =           5
  In of MODEL   44
    1    H1   ALA   1           H3       ALA   1 -12.274 -15.624  -2.481
    2    H2   ALA   1           H2       ALA   1 -11.338 -16.767  -3.326
    3    H3   ALA   1           H1       ALA   1 -12.475 -15.813  -4.156
    4    HA   ALA   1           HA       ALA   1 -13.883 -17.507  -3.926
    5    HB3  ALA   1           HB1      ALA   1 -12.498 -19.288  -3.471
    6    HB1  ALA   1           HB2      ALA   1 -13.255 -19.178  -1.882
    7    HB2  ALA   1           HB3      ALA   1 -11.675 -18.445  -2.157

  No H/Q in entry =           7
  In of MODEL   44
    1    H    GLU   2           H        GLU   2 -15.513 -18.360  -2.277
    2    HA   GLU   2           HA       GLU   2 -17.153 -16.635  -1.213
    3    HB2  GLU   2           HB2      GLU   2 -16.229 -19.073   0.322
    4    HB3  GLU   2           HB3      GLU   2 -17.748 -18.215   0.578
    5    HG2  GLU   2           HG2      GLU   2 -18.732 -19.288  -1.162
    6    HG3  GLU   2           HG3      GLU   2 -17.405 -18.890  -2.244

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLU   3           H        GLU   3 -15.251 -18.011   1.406
    2    HA   GLU   3           HA       GLU   3 -15.461 -15.663   2.974
    3    HB2  GLU   3           HB2      GLU   3 -13.890 -18.220   3.215
    4    HB3  GLU   3           HB3      GLU   3 -13.653 -16.907   4.368
    5    HG2  GLU   3           HG2      GLU   3 -15.848 -17.050   5.183
    6    HG3  GLU   3           HG3      GLU   3 -16.446 -17.840   3.730

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LEU   4           H        LEU   4 -12.513 -17.152   1.580
    2    HA   LEU   4           HA       LEU   4 -10.669 -15.262   2.189
    3    HB2  LEU   4           HB2      LEU   4 -10.904 -16.545  -0.542
    4    HB3  LEU   4           HB3      LEU   4  -9.448 -15.836   0.148
    5    HG   LEU   4           HG       LEU   4 -10.957 -18.230   1.248
    6   HD13  LEU   4          HD11      LEU   4  -9.331 -19.591   0.314
    7   HD12  LEU   4          HD12      LEU   4  -8.114 -18.315   0.295
    8   HD11  LEU   4          HD13      LEU   4  -9.402 -18.324  -0.909
    9   HD23  LEU   4          HD21      LEU   4  -8.708 -18.313   2.632
   10   HD22  LEU   4          HD22      LEU   4 -10.024 -17.268   3.164
   11   HD21  LEU   4          HD23      LEU   4  -8.657 -16.583   2.287

  No H/Q in entry =          11
  In of MODEL   44
    1    H    GLU   5           H        GLU   5 -12.999 -15.030  -0.487
    2    HA   GLU   5           HA       GLU   5 -11.981 -12.547  -1.475
    3    HB2  GLU   5           HB2      GLU   5 -13.333 -14.117  -2.848
    4    HB3  GLU   5           HB3      GLU   5 -14.732 -13.755  -1.837
    5    HG2  GLU   5           HG2      GLU   5 -14.599 -11.386  -2.465
    6    HG3  GLU   5           HG3      GLU   5 -13.170 -11.717  -3.446

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLU   6           H        GLU   6 -14.713 -13.419   0.609
    2    HA   GLU   6           HA       GLU   6 -15.603 -10.739   1.020
    3    HB2  GLU   6           HB2      GLU   6 -16.999 -12.790   1.408
    4    HB3  GLU   6           HB3      GLU   6 -16.012 -13.134   2.827
    5    HG2  GLU   6           HG2      GLU   6 -17.858 -11.948   3.700
    6    HG3  GLU   6           HG3      GLU   6 -16.593 -10.727   3.570

  No H/Q in entry =           6
  In of MODEL   44
    1    H    VAL   7           H        VAL   7 -13.310 -12.870   2.585
    2    HA   VAL   7           HA       VAL   7 -12.838 -11.309   4.920
    3    HB   VAL   7           HB       VAL   7 -11.144 -13.355   3.463
    4   HG11  VAL   7          HG11      VAL   7 -10.671 -11.837   6.035
    5   HG13  VAL   7          HG12      VAL   7  -9.570 -12.051   4.675
    6   HG12  VAL   7          HG13      VAL   7  -9.933 -13.411   5.738
    7   HG21  VAL   7          HG21      VAL   7 -13.400 -13.912   4.677
    8   HG23  VAL   7          HG22      VAL   7 -12.473 -13.650   6.156
    9   HG22  VAL   7          HG23      VAL   7 -11.986 -14.908   5.021

  No H/Q in entry =           9
  In of MODEL   44
    1    H    VAL   8           H        VAL   8 -11.323 -11.417   1.711
    2    HA   VAL   8           HA       VAL   8  -9.250  -9.559   2.216
    3    HB   VAL   8           HB       VAL   8 -10.714 -10.232  -0.348
    4   HG12  VAL   8          HG11      VAL   8  -8.481  -9.241  -1.302
    5   HG11  VAL   8          HG12      VAL   8  -8.398  -8.401   0.248
    6   HG13  VAL   8          HG13      VAL   8  -9.775  -8.140  -0.824
    7   HG21  VAL   8          HG21      VAL   8  -9.012 -11.813   1.149
    8   HG23  VAL   8          HG22      VAL   8  -7.879 -11.004   0.070
    9   HG22  VAL   8          HG23      VAL   8  -9.200 -11.955  -0.601

  No H/Q in entry =           9
  In of MODEL   44
    1    H    MET   9           H        MET   9 -12.591  -9.144   1.053
    2    HA   MET   9           HA       MET   9 -12.511  -6.366   0.631
    3    HB2  MET   9           HB2      MET   9 -14.707  -8.282   1.372
    4    HB3  MET   9           HB3      MET   9 -15.021  -6.545   1.323
    5    HG2  MET   9           HG2      MET   9 -13.970  -6.583  -1.018
    6    HG3  MET   9           HG3      MET   9 -14.112  -8.338  -0.933
    7    HE3  MET   9           HE1      MET   9 -17.621  -9.261  -1.171
    8    HE2  MET   9           HE2      MET   9 -16.938  -9.053   0.439
    9    HE1  MET   9           HE3      MET   9 -15.923  -9.657  -0.869

  No H/Q in entry =           9
  In of MODEL   44
    1    H    GLY  10           H        GLY  10 -13.189  -8.267   3.548
    2    HA3  GLY  10           HA2      GLY  10 -13.728  -6.087   5.276
    3    HA2  GLY  10           HA3      GLY  10 -13.173  -7.681   5.784

  No H/Q in entry =           3
  In of MODEL   44
    1    H    LEU  11           H        LEU  11 -10.727  -7.813   4.472
    2    HA   LEU  11           HA       LEU  11  -9.021  -6.396   6.238
    3    HB2  LEU  11           HB2      LEU  11  -8.478  -7.811   3.625
    4    HB3  LEU  11           HB3      LEU  11  -7.205  -7.118   4.628
    5    HG   LEU  11           HG       LEU  11  -9.220  -9.145   5.633
    6   HD13  LEU  11          HD11      LEU  11  -8.002 -10.381   4.065
    7   HD12  LEU  11          HD12      LEU  11  -7.071 -10.631   5.540
    8   HD11  LEU  11          HD13      LEU  11  -6.522  -9.463   4.339
    9   HD22  LEU  11          HD21      LEU  11  -8.364  -8.145   7.555
   10   HD21  LEU  11          HD22      LEU  11  -6.823  -7.748   6.796
   11   HD23  LEU  11          HD23      LEU  11  -7.158  -9.405   7.298

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  12           H        ILE  12  -9.915  -5.829   2.849
    2    HA   ILE  12           HA       ILE  12  -8.211  -3.606   2.435
    3    HB   ILE  12           HB       ILE  12 -10.865  -4.264   1.132
    4   HG12  ILE  12          HG12      ILE  12  -8.827  -5.914   1.049
    5   HG13  ILE  12          HG13      ILE  12  -9.688  -5.548  -0.432
    6   HG22  ILE  12          HG21      ILE  12  -9.831  -2.884  -0.767
    7   HG21  ILE  12          HG22      ILE  12  -8.676  -2.292   0.420
    8   HG23  ILE  12          HG23      ILE  12 -10.379  -2.004   0.627
    9   HD13  ILE  12          HD11      ILE  12  -7.966  -3.978  -1.086
   10   HD12  ILE  12          HD12      ILE  12  -7.186  -5.494  -0.635
   11   HD11  ILE  12          HD13      ILE  12  -7.170  -4.139   0.469

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  13           H        ILE  13 -11.575  -3.862   3.522
    2    HA   ILE  13           HA       ILE  13 -12.022  -1.074   3.803
    3    HB   ILE  13           HB       ILE  13 -13.240  -3.493   5.156
    4   HG12  ILE  13          HG12      ILE  13 -13.464  -2.989   2.628
    5   HG13  ILE  13          HG13      ILE  13 -14.913  -3.370   3.532
    6   HG23  ILE  13          HG21      ILE  13 -13.827  -1.890   6.719
    7   HG22  ILE  13          HG22      ILE  13 -15.150  -1.686   5.578
    8   HG21  ILE  13          HG23      ILE  13 -13.786  -0.569   5.554
    9   HD11  ILE  13          HD11      ILE  13 -14.176  -0.494   3.422
   10   HD13  ILE  13          HD12      ILE  13 -15.748  -1.267   3.361
   11   HD12  ILE  13          HD13      ILE  13 -14.752  -1.230   1.923

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ASN  14           H        ASN  14 -10.926  -3.579   6.069
    2    HA   ASN  14           HA       ASN  14 -10.722  -1.952   8.362
    3    HB2  ASN  14           HB2      ASN  14 -10.480  -4.559   8.029
    4    HB3  ASN  14           HB3      ASN  14  -8.769  -4.179   7.876
    5   HD21  ASN  14          HD21      ASN  14  -9.415  -5.710  10.044
    6   HD22  ASN  14          HD22      ASN  14  -9.386  -4.796  11.473

  No H/Q in entry =           6
  In of MODEL   44
    1    H    SER  15           H        SER  15  -8.319  -2.775   5.870
    2    HA   SER  15           HA       SER  15  -6.172  -1.295   6.953
    3    HB2  SER  15           HB2      SER  15  -5.148  -1.508   4.797
    4    HB3  SER  15           HB3      SER  15  -6.113  -2.964   5.011
    5    HG   SER  15           HG       SER  15  -7.013  -0.614   3.704

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLY  16           H        GLY  16  -8.766  -0.409   4.705
    2    HA3  GLY  16           HA2      GLY  16  -7.897   2.231   4.166
    3    HA2  GLY  16           HA3      GLY  16  -9.550   1.643   3.999

  No H/Q in entry =           3
  In of MODEL   44
    1    H    GLN  17           H        GLN  17 -10.100   0.908   6.644
    2    HA   GLN  17           HA       GLN  17 -10.801   3.410   7.795
    3    HB2  GLN  17           HB2      GLN  17 -12.029   1.309   8.262
    4    HB3  GLN  17           HB3      GLN  17 -10.630   0.706   9.151
    5    HG2  GLN  17           HG2      GLN  17 -12.225   1.653  10.732
    6    HG3  GLN  17           HG3      GLN  17 -10.797   2.685  10.667
    7   HE21  GLN  17          HE21      GLN  17 -11.773   4.719  11.108
    8   HE22  GLN  17          HE22      GLN  17 -12.972   5.407  10.121

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ALA  18           H        ALA  18  -8.180   1.118   8.409
    2    HA   ALA  18           HA       ALA  18  -7.083   2.321  10.687
    3    HB2  ALA  18           HB1      ALA  18  -6.477   0.109   9.311
    4    HB3  ALA  18           HB2      ALA  18  -5.314   0.884  10.387
    5    HB1  ALA  18           HB3      ALA  18  -5.233   1.170   8.647

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ARG  19           H        ARG  19  -6.304   2.857   7.242
    2    HA   ARG  19           HA       ARG  19  -4.401   4.897   7.682
    3    HB2  ARG  19           HB2      ARG  19  -4.727   3.767   5.482
    4    HB3  ARG  19           HB3      ARG  19  -6.267   4.612   5.305
    5    HG2  ARG  19           HG2      ARG  19  -5.133   6.781   5.385
    6    HG3  ARG  19           HG3      ARG  19  -3.587   5.990   5.689
    7    HD2  ARG  19           HD2      ARG  19  -3.706   6.591   3.348
    8    HD3  ARG  19           HD3      ARG  19  -3.796   4.830   3.486
    9    HE   ARG  19           HE       ARG  19  -6.427   5.746   3.477
   10   HH21  ARG  19          HH11      ARG  19  -7.618   5.913   1.558
   11   HH22  ARG  19          HH12      ARG  19  -6.794   5.995   0.040
   12   HH11  ARG  19          HH21      ARG  19  -3.648   5.811   1.449
   13   HH12  ARG  19          HH22      ARG  19  -4.544   5.935  -0.022

  No H/Q in entry =          13
  In of MODEL   44
    1    H    SER  20           H        SER  20  -7.898   5.023   7.076
    2    HA   SER  20           HA       SER  20  -8.249   7.780   7.038
    3    HB2  SER  20           HB2      SER  20 -10.127   6.444   6.493
    4    HB3  SER  20           HB3      SER  20 -10.024   5.547   8.006
    5    HG   SER  20           HG       SER  20 -10.346   7.765   8.962

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU  21           H        LEU  21  -8.259   5.586   9.834
    2    HA   LEU  21           HA       LEU  21  -8.699   7.574  11.806
    3    HB2  LEU  21           HB2      LEU  21  -7.353   4.869  11.957
    4    HB3  LEU  21           HB3      LEU  21  -7.661   5.881  13.365
    5    HG   LEU  21           HG       LEU  21  -9.830   4.997  11.438
    6   HD12  LEU  21          HD11      LEU  21  -9.181   3.825  14.157
    7   HD11  LEU  21          HD12      LEU  21  -8.688   3.088  12.632
    8   HD13  LEU  21          HD13      LEU  21 -10.402   3.261  13.014
    9   HD21  LEU  21          HD21      LEU  21  -9.757   6.508  14.041
   10   HD23  LEU  21          HD22      LEU  21 -11.161   5.504  13.693
   11   HD22  LEU  21          HD23      LEU  21 -10.737   6.822  12.612

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ALA  22           H        ALA  22  -5.746   6.202  10.399
    2    HA   ALA  22           HA       ALA  22  -3.868   7.505  12.030
    3    HB2  ALA  22           HB1      ALA  22  -3.451   5.658  10.332
    4    HB1  ALA  22           HB2      ALA  22  -2.253   6.952  10.375
    5    HB3  ALA  22           HB3      ALA  22  -3.469   6.915   9.096

  No H/Q in entry =           5
  In of MODEL   44
    1    H    TYR  23           H        TYR  23  -5.177   8.537   8.849
    2    HA   TYR  23           HA       TYR  23  -3.836  11.032   8.791
    3    HB2  TYR  23           HB2      TYR  23  -4.915  10.129   6.793
    4    HB3  TYR  23           HB3      TYR  23  -6.495  10.236   7.572
    5    HD1  TYR  23           HD1      TYR  23  -3.580  12.286   6.455
    6    HD2  TYR  23           HD2      TYR  23  -7.736  12.242   7.539
    7    HE1  TYR  23           HE1      TYR  23  -3.799  14.638   5.704
    8    HE2  TYR  23           HE2      TYR  23  -7.956  14.596   6.786
    9    HH   TYR  23           HH       TYR  23  -5.552  16.166   4.942

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ALA  24           H        ALA  24  -6.960  10.053  10.160
    2    HA   ALA  24           HA       ALA  24  -7.795  12.641  10.940
    3    HB1  ALA  24           HB1      ALA  24  -9.616  11.391  11.399
    4    HB2  ALA  24           HB2      ALA  24  -8.794  10.813  12.846
    5    HB3  ALA  24           HB3      ALA  24  -8.667   9.907  11.339

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA  25           H        ALA  25  -5.800  10.174  12.508
    2    HA   ALA  25           HA       ALA  25  -5.465  11.416  15.016
    3    HB2  ALA  25           HB1      ALA  25  -4.700   9.066  14.188
    4    HB3  ALA  25           HB2      ALA  25  -3.686   9.918  15.354
    5    HB1  ALA  25           HB3      ALA  25  -3.247   9.907  13.646

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU  26           H        LEU  26  -3.668  11.724  11.981
    2    HA   LEU  26           HA       LEU  26  -1.708  13.537  12.909
    3    HB2  LEU  26           HB2      LEU  26  -1.404  12.393  10.801
    4    HB3  LEU  26           HB3      LEU  26  -2.875  13.106  10.146
    5    HG   LEU  26           HG       LEU  26  -1.857  15.355  10.293
    6   HD12  LEU  26          HD11      LEU  26   0.681  15.368  10.712
    7   HD11  LEU  26          HD12      LEU  26   0.453  13.785  11.450
    8   HD13  LEU  26          HD13      LEU  26  -0.353  15.199  12.130
    9   HD21  LEU  26          HD21      LEU  26  -0.114  13.303   8.893
   10   HD23  LEU  26          HD22      LEU  26  -0.153  15.026   8.530
   11   HD22  LEU  26          HD23      LEU  26  -1.578  14.032   8.234

  No H/Q in entry =          11
  In of MODEL   44
    1    H    LYS  27           H        LYS  27  -4.886  14.031  11.427
    2    HA   LYS  27           HA       LYS  27  -4.825  16.821  11.240
    3    HB2  LYS  27           HB2      LYS  27  -6.570  15.351  10.244
    4    HB3  LYS  27           HB3      LYS  27  -7.231  15.089  11.858
    5    HG2  LYS  27           HG2      LYS  27  -7.656  17.495  12.103
    6    HG3  LYS  27           HG3      LYS  27  -6.944  17.797  10.515
    7    HD2  LYS  27           HD2      LYS  27  -8.677  16.370   9.469
    8    HD3  LYS  27           HD3      LYS  27  -9.395  16.085  11.056
    9    HE2  LYS  27           HE2      LYS  27  -9.833  18.496  11.308
   10    HE3  LYS  27           HE3      LYS  27  -9.087  18.803   9.736
   11    HZ3  LYS  27           HZ1      LYS  27 -11.464  18.684   9.489
   12    HZ2  LYS  27           HZ2      LYS  27 -11.517  17.164  10.252
   13    HZ1  LYS  27           HZ3      LYS  27 -10.769  17.332   8.733

  No H/Q in entry =          13
  In of MODEL   44
    1    H    GLN  28           H        GLN  28  -5.724  14.725  13.957
    2    HA   GLN  28           HA       GLN  28  -6.619  16.724  15.739
    3    HB2  GLN  28           HB2      GLN  28  -5.228  14.085  16.269
    4    HB3  GLN  28           HB3      GLN  28  -5.959  15.087  17.523
    5    HG2  GLN  28           HG2      GLN  28  -7.439  13.999  15.112
    6    HG3  GLN  28           HG3      GLN  28  -7.487  13.284  16.723
    7   HE21  GLN  28          HE21      GLN  28  -7.676  15.578  18.345
    8   HE22  GLN  28          HE22      GLN  28  -9.126  16.389  18.002

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ALA  29           H        ALA  29  -3.402  15.422  15.051
    2    HA   ALA  29           HA       ALA  29  -1.964  16.807  17.038
    3    HB1  ALA  29           HB1      ALA  29  -0.033  16.115  15.920
    4    HB3  ALA  29           HB2      ALA  29  -0.784  16.248  14.330
    5    HB2  ALA  29           HB3      ALA  29  -1.212  14.912  15.398

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LYS  30           H        LYS  30  -2.812  17.703  13.710
    2    HA   LYS  30           HA       LYS  30  -1.392  20.138  13.623
    3    HB2  LYS  30           HB2      LYS  30  -3.923  19.281  12.206
    4    HB3  LYS  30           HB3      LYS  30  -3.082  20.793  11.870
    5    HG2  LYS  30           HG2      LYS  30  -1.017  19.493  11.355
    6    HG3  LYS  30           HG3      LYS  30  -1.931  18.000  11.591
    7    HD2  LYS  30           HD2      LYS  30  -3.489  18.655   9.797
    8    HD3  LYS  30           HD3      LYS  30  -2.598  20.160   9.562
    9    HE2  LYS  30           HE2      LYS  30  -0.571  18.860   8.981
   10    HE3  LYS  30           HE3      LYS  30  -1.481  17.360   9.184
   11    HZ2  LYS  30           HZ1      LYS  30  -1.295  18.240   6.847
   12    HZ1  LYS  30           HZ2      LYS  30  -2.334  19.506   7.318
   13    HZ3  LYS  30           HZ3      LYS  30  -2.866  17.892   7.382

  No H/Q in entry =          13
  In of MODEL   44
    1    H    GLN  31           H        GLN  31  -4.499  19.296  15.026
    2    HA   GLN  31           HA       GLN  31  -5.248  22.055  15.488
    3    HB2  GLN  31           HB2      GLN  31  -6.443  19.610  16.798
    4    HB3  GLN  31           HB3      GLN  31  -7.194  21.187  16.558
    5    HG2  GLN  31           HG2      GLN  31  -6.483  20.417  13.966
    6    HG3  GLN  31           HG3      GLN  31  -7.018  18.912  14.706
    7   HE21  GLN  31          HE21      GLN  31  -8.415  20.503  12.609
    8   HE22  GLN  31          HE22      GLN  31  -9.928  20.901  13.265

  No H/Q in entry =           8
  In of MODEL   44
    1    H    GLY  32           H        GLY  32  -2.949  20.108  16.804
    2    HA3  GLY  32           HA2      GLY  32  -1.549  20.554  18.610
    3    HA2  GLY  32           HA3      GLY  32  -2.672  21.801  19.138

  No H/Q in entry =           3
  In of MODEL   44
    1    H    ASP  33           H        ASP  33  -4.112  18.774  18.460
    2    HA   ASP  33           HA       ASP  33  -4.530  18.306  21.337
    3    HB2  ASP  33           HB2      ASP  33  -5.938  17.314  18.853
    4    HB3  ASP  33           HB3      ASP  33  -6.290  16.699  20.465

  No H/Q in entry =           4
  In of MODEL   44
    1    H    PHE  34           H        PHE  34  -2.367  17.440  21.642
    2    HA   PHE  34           HA       PHE  34  -1.379  15.191  20.233
    3    HB2  PHE  34           HB2      PHE  34  -0.760  16.158  23.033
    4    HB3  PHE  34           HB3      PHE  34   0.162  14.933  22.161
    5    HD1  PHE  34           HD1      PHE  34   0.010  18.357  22.912
    6    HD2  PHE  34           HD2      PHE  34   0.829  15.663  19.666
    7    HE1  PHE  34           HE1      PHE  34   1.319  20.125  21.768
    8    HE2  PHE  34           HE2      PHE  34   2.132  17.434  18.527
    9    HZ   PHE  34           HZ       PHE  34   2.379  19.662  19.582

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ALA  35           H        ALA  35  -3.422  15.468  23.094
    2    HA   ALA  35           HA       ALA  35  -3.228  12.800  23.978
    3    HB3  ALA  35           HB1      ALA  35  -5.683  13.438  24.834
    4    HB1  ALA  35           HB2      ALA  35  -5.139  15.055  24.387
    5    HB2  ALA  35           HB3      ALA  35  -4.233  14.119  25.575

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA  36           H        ALA  36  -5.665  14.342  21.881
    2    HA   ALA  36           HA       ALA  36  -7.095  11.942  21.390
    3    HB1  ALA  36           HB1      ALA  36  -8.540  13.379  20.439
    4    HB3  ALA  36           HB2      ALA  36  -7.363  13.797  19.193
    5    HB2  ALA  36           HB3      ALA  36  -7.384  14.678  20.721

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA  37           H        ALA  37  -4.402  13.520  19.733
    2    HA   ALA  37           HA       ALA  37  -4.374  11.895  17.429
    3    HB3  ALA  37           HB1      ALA  37  -2.372  13.587  18.862
    4    HB2  ALA  37           HB2      ALA  37  -2.900  13.655  17.182
    5    HB1  ALA  37           HB3      ALA  37  -1.755  12.414  17.699

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LYS  38           H        LYS  38  -2.624  11.563  20.508
    2    HA   LYS  38           HA       LYS  38  -1.313   9.157  20.010
    3    HB2  LYS  38           HB2      LYS  38  -1.628  10.912  22.163
    4    HB3  LYS  38           HB3      LYS  38  -2.258   9.383  22.771
    5    HG2  LYS  38           HG2      LYS  38  -0.170   8.252  22.233
    6    HG3  LYS  38           HG3      LYS  38   0.449   9.697  21.427
    7    HD2  LYS  38           HD2      LYS  38   0.623  10.905  23.468
    8    HD3  LYS  38           HD3      LYS  38  -0.405   9.757  24.328
    9    HE2  LYS  38           HE2      LYS  38   1.947   9.423  24.949
   10    HE3  LYS  38           HE3      LYS  38   1.335   8.015  24.077
   11    HZ3  LYS  38           HZ1      LYS  38   2.641   8.434  22.300
   12    HZ2  LYS  38           HZ2      LYS  38   3.600   9.250  23.442
   13    HZ1  LYS  38           HZ3      LYS  38   2.528  10.122  22.453

  No H/Q in entry =          13
  In of MODEL   44
    1    H    ALA  39           H        ALA  39  -4.550   9.666  21.409
    2    HA   ALA  39           HA       ALA  39  -5.129   6.948  21.900
    3    HB3  ALA  39           HB1      ALA  39  -7.274   8.910  21.139
    4    HB2  ALA  39           HB2      ALA  39  -6.377   9.124  22.642
    5    HB1  ALA  39           HB3      ALA  39  -7.303   7.647  22.371

  No H/Q in entry =           5
  In of MODEL   44
    1    H    MET  40           H        MET  40  -5.697   8.979  19.062
    2    HA   MET  40           HA       MET  40  -7.182   7.063  17.590
    3    HB2  MET  40           HB2      MET  40  -5.556   9.452  16.700
    4    HB3  MET  40           HB3      MET  40  -6.586   8.505  15.623
    5    HG2  MET  40           HG2      MET  40  -7.617   9.748  18.186
    6    HG3  MET  40           HG3      MET  40  -7.667  10.590  16.639
    7    HE3  MET  40           HE1      MET  40 -10.257   8.997  14.563
    8    HE2  MET  40           HE2      MET  40  -8.504   9.104  14.418
    9    HE1  MET  40           HE3      MET  40  -9.414  10.472  15.057

  No H/Q in entry =           9
  In of MODEL   44
    1    H    MET  41           H        MET  41  -3.687   7.778  17.722
    2    HA   MET  41           HA       MET  41  -2.936   6.029  15.614
    3    HB2  MET  41           HB2      MET  41  -1.319   6.674  18.093
    4    HB3  MET  41           HB3      MET  41  -0.703   6.030  16.575
    5    HG2  MET  41           HG2      MET  41  -1.845   8.224  15.580
    6    HG3  MET  41           HG3      MET  41  -1.608   8.803  17.228
    7    HE2  MET  41           HE1      MET  41   1.297   6.686  17.584
    8    HE1  MET  41           HE2      MET  41   0.514   7.980  18.487
    9    HE3  MET  41           HE3      MET  41   2.140   8.217  17.848

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ASP  42           H        ASP  42  -3.329   5.541  19.097
    2    HA   ASP  42           HA       ASP  42  -2.309   2.941  19.247
    3    HB2  ASP  42           HB2      ASP  42  -3.175   4.697  21.076
    4    HB3  ASP  42           HB3      ASP  42  -4.608   3.680  20.997

  No H/Q in entry =           4
  In of MODEL   44
    1    H    GLN  43           H        GLN  43  -5.635   4.066  18.746
    2    HA   GLN  43           HA       GLN  43  -6.793   1.486  18.537
    3    HB2  GLN  43           HB2      GLN  43  -7.699   4.149  17.419
    4    HB3  GLN  43           HB3      GLN  43  -8.670   2.675  17.388
    5    HG2  GLN  43           HG2      GLN  43  -8.382   2.540  19.896
    6    HG3  GLN  43           HG3      GLN  43  -7.648   4.142  19.833
    7   HE21  GLN  43          HE21      GLN  43  -9.830   4.227  21.330
    8   HE22  GLN  43          HE22      GLN  43 -11.186   4.814  20.499

  No H/Q in entry =           8
  In of MODEL   44
    1    H    SER  44           H        SER  44  -5.436   3.704  16.138
    2    HA   SER  44           HA       SER  44  -6.141   2.235  13.841
    3    HB2  SER  44           HB2      SER  44  -4.872   4.609  14.298
    4    HB3  SER  44           HB3      SER  44  -3.523   3.608  13.766
    5    HG   SER  44           HG       SER  44  -4.627   4.595  12.005

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ARG  45           H        ARG  45  -3.268   2.096  15.926
    2    HA   ARG  45           HA       ARG  45  -1.796   0.140  14.537
    3    HB2  ARG  45           HB2      ARG  45  -0.950   1.548  16.414
    4    HB3  ARG  45           HB3      ARG  45  -1.949   0.617  17.528
    5    HG2  ARG  45           HG2      ARG  45  -0.728  -1.446  16.877
    6    HG3  ARG  45           HG3      ARG  45   0.295  -0.491  15.806
    7    HD2  ARG  45           HD2      ARG  45   1.034   0.876  17.769
    8    HD3  ARG  45           HD3      ARG  45   0.104  -0.199  18.836
    9    HE   ARG  45           HE       ARG  45   1.797  -1.796  17.251
   10   HH21  ARG  45          HH11      ARG  45   3.691  -2.634  18.087
   11   HH22  ARG  45          HH12      ARG  45   4.466  -1.859  19.424
   12   HH11  ARG  45          HH21      ARG  45   2.109   0.657  19.653
   13   HH12  ARG  45          HH22      ARG  45   3.570   0.007  20.308

  No H/Q in entry =          13
  In of MODEL   44
    1    H    MET  46           H        MET  46  -4.201  -0.179  17.131
    2    HA   MET  46           HA       MET  46  -4.050  -2.981  17.424
    3    HB2  MET  46           HB2      MET  46  -6.218  -0.972  18.024
    4    HB3  MET  46           HB3      MET  46  -6.418  -2.692  18.370
    5    HG2  MET  46           HG2      MET  46  -4.389  -2.660  19.761
    6    HG3  MET  46           HG3      MET  46  -4.155  -0.956  19.404
    7    HE2  MET  46           HE1      MET  46  -5.210  -0.380  22.975
    8    HE1  MET  46           HE2      MET  46  -4.046  -0.139  21.676
    9    HE3  MET  46           HE3      MET  46  -4.193  -1.722  22.433

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ALA  47           H        ALA  47  -6.054  -0.942  15.335
    2    HA   ALA  47           HA       ALA  47  -7.681  -2.978  14.256
    3    HB3  ALA  47           HB1      ALA  47  -8.347  -0.734  13.850
    4    HB1  ALA  47           HB2      ALA  47  -7.858  -1.362  12.276
    5    HB2  ALA  47           HB3      ALA  47  -6.774  -0.305  13.181

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU  48           H        LEU  48  -4.552  -1.683  13.218
    2    HA   LEU  48           HA       LEU  48  -4.277  -3.264  10.869
    3    HB2  LEU  48           HB2      LEU  48  -2.215  -2.008  12.688
    4    HB3  LEU  48           HB3      LEU  48  -1.848  -2.723  11.119
    5    HG   LEU  48           HG       LEU  48  -3.857  -0.494  11.515
    6   HD13  LEU  48          HD11      LEU  48  -1.731   0.364  12.190
    7   HD12  LEU  48          HD12      LEU  48  -1.999   0.928  10.540
    8   HD11  LEU  48          HD13      LEU  48  -0.911  -0.427  10.844
    9   HD22  LEU  48          HD21      LEU  48  -4.331  -1.465   9.433
   10   HD21  LEU  48          HD22      LEU  48  -2.650  -1.910   9.139
   11   HD23  LEU  48          HD23      LEU  48  -3.157  -0.226   8.988

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ASN  49           H        ASN  49  -3.241  -3.685  14.216
    2    HA   ASN  49           HA       ASN  49  -1.654  -5.957  13.877
    3    HB2  ASN  49           HB2      ASN  49  -1.659  -4.648  15.932
    4    HB3  ASN  49           HB3      ASN  49  -3.332  -5.086  16.245
    5   HD21  ASN  49          HD21      ASN  49  -0.080  -6.536  15.882
    6   HD22  ASN  49          HD22      ASN  49  -0.386  -7.852  16.906

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLU  50           H        GLU  50  -5.122  -5.660  14.543
    2    HA   GLU  50           HA       GLU  50  -5.656  -8.456  14.636
    3    HB2  GLU  50           HB2      GLU  50  -7.230  -6.761  15.517
    4    HB3  GLU  50           HB3      GLU  50  -7.516  -6.186  13.873
    5    HG2  GLU  50           HG2      GLU  50  -8.396  -8.372  13.221
    6    HG3  GLU  50           HG3      GLU  50  -8.024  -9.027  14.812

  No H/Q in entry =           6
  In of MODEL   44
    1    H    ALA  51           H        ALA  51  -5.699  -6.044  12.052
    2    HA   ALA  51           HA       ALA  51  -6.694  -7.753  10.019
    3    HB2  ALA  51           HB1      ALA  51  -6.456  -5.936   8.659
    4    HB1  ALA  51           HB2      ALA  51  -4.815  -5.603   9.213
    5    HB3  ALA  51           HB3      ALA  51  -6.197  -5.085  10.182

  No H/Q in entry =           5
  In of MODEL   44
    1    H    HIS  52           H        HIS  52  -3.398  -6.878  11.015
    2    HA   HIS  52           HA       HIS  52  -2.007  -8.369   9.061
    3    HB2  HIS  52           HB2      HIS  52  -0.969  -6.648  10.521
    4    HB3  HIS  52           HB3      HIS  52  -1.137  -7.743  11.893
    5    HD1  HIS  52           HD1      HIS  52   0.108 -10.158  11.551
    6    HD2  HIS  52           HD2      HIS  52   1.353  -7.051   9.065
    7    HE1  HIS  52           HE1      HIS  52   2.357 -10.848  10.613
    8    HE2  HIS  52           HE2      HIS  52   3.129  -8.965   9.095

  No H/Q in entry =           8
  In of MODEL   44
    1    H    LEU  53           H        LEU  53  -3.234  -9.253  12.266
    2    HA   LEU  53           HA       LEU  53  -2.059 -11.808  12.449
    3    HB2  LEU  53           HB2      LEU  53  -4.538 -10.613  13.663
    4    HB3  LEU  53           HB3      LEU  53  -4.090 -12.293  13.949
    5    HG   LEU  53           HG       LEU  53  -2.176  -9.989  14.438
    6   HD13  LEU  53          HD11      LEU  53  -4.092  -9.643  15.886
    7   HD12  LEU  53          HD12      LEU  53  -2.773 -10.301  16.852
    8   HD11  LEU  53          HD13      LEU  53  -4.100 -11.342  16.347
    9   HD23  LEU  53          HD21      LEU  53  -1.292 -11.799  16.105
   10   HD22  LEU  53          HD22      LEU  53  -0.920 -11.985  14.395
   11   HD21  LEU  53          HD23      LEU  53  -2.201 -12.939  15.119

  No H/Q in entry =          11
  In of MODEL   44
    1    H    VAL  54           H        VAL  54  -5.157 -10.744  11.085
    2    HA   VAL  54           HA       VAL  54  -6.093 -13.326  10.382
    3    HB   VAL  54           HB       VAL  54  -6.712 -10.582   9.260
    4   HG12  VAL  54          HG11      VAL  54  -8.825 -11.936   8.436
    5   HG11  VAL  54          HG12      VAL  54  -7.726 -13.312   8.504
    6   HG13  VAL  54          HG13      VAL  54  -7.351 -11.935   7.470
    7   HG22  VAL  54          HG21      VAL  54  -7.624 -10.622  11.409
    8   HG21  VAL  54          HG22      VAL  54  -7.895 -12.363  11.380
    9   HG23  VAL  54          HG23      VAL  54  -8.964 -11.292  10.477

  No H/Q in entry =           9
  In of MODEL   44
    1    H    GLN  55           H        GLN  55  -4.195 -10.883   8.610
    2    HA   GLN  55           HA       GLN  55  -4.072 -12.336   6.185
    3    HB2  GLN  55           HB2      GLN  55  -3.447 -10.076   6.009
    4    HB3  GLN  55           HB3      GLN  55  -2.340 -10.170   7.376
    5    HG2  GLN  55           HG2      GLN  55  -0.628 -11.026   6.099
    6    HG3  GLN  55           HG3      GLN  55  -1.708 -11.985   5.097
    7   HE21  GLN  55          HE21      GLN  55  -1.714 -11.284   2.980
    8   HE22  GLN  55          HE22      GLN  55  -1.499  -9.679   2.478

  No H/Q in entry =           8
  In of MODEL   44
    1    H    THR  56           H        THR  56  -1.973 -12.350   9.071
    2    HA   THR  56           HA       THR  56   0.092 -13.964   8.150
    3    HB   THR  56           HB       THR  56  -1.212 -13.997  10.885
    4    HG1  THR  56           HG1      THR  56   0.500 -12.317   9.561
    5   HG23  THR  56          HG21      THR  56   0.095 -15.914  10.937
    6   HG22  THR  56          HG22      THR  56   1.281 -14.700  11.420
    7   HG21  THR  56          HG23      THR  56   1.243 -15.286   9.756

  No H/Q in entry =           7
  In of MODEL   44
    1    H    LYS  57           H        LYS  57  -3.042 -14.977   9.500
    2    HA   LYS  57           HA       LYS  57  -2.623 -17.776   9.241
    3    HB2  LYS  57           HB2      LYS  57  -4.434 -16.667  10.586
    4    HB3  LYS  57           HB3      LYS  57  -5.219 -16.214   9.081
    5    HG2  LYS  57           HG2      LYS  57  -5.471 -18.578   8.473
    6    HG3  LYS  57           HG3      LYS  57  -4.645 -19.060   9.952
    7    HD2  LYS  57           HD2      LYS  57  -6.437 -18.010  11.295
    8    HD3  LYS  57           HD3      LYS  57  -7.271 -17.539   9.815
    9    HE2  LYS  57           HE2      LYS  57  -7.503 -19.914   9.178
   10    HE3  LYS  57           HE3      LYS  57  -6.650 -20.407  10.638
   11    HZ1  LYS  57           HZ1      LYS  57  -8.435 -19.114  11.865
   12    HZ3  LYS  57           HZ2      LYS  57  -8.892 -20.593  11.163
   13    HZ2  LYS  57           HZ3      LYS  57  -9.301 -19.129  10.404

  No H/Q in entry =          13
  In of MODEL   44
    1    H    LEU  58           H        LEU  58  -3.924 -15.309   7.075
    2    HA   LEU  58           HA       LEU  58  -4.740 -17.115   5.057
    3    HB2  LEU  58           HB2      LEU  58  -4.104 -14.172   4.939
    4    HB3  LEU  58           HB3      LEU  58  -4.773 -15.096   3.592
    5    HG   LEU  58           HG       LEU  58  -6.058 -14.917   6.337
    6   HD11  LEU  58          HD11      LEU  58  -6.335 -13.255   3.854
    7   HD13  LEU  58          HD12      LEU  58  -6.324 -12.756   5.545
    8   HD12  LEU  58          HD13      LEU  58  -7.753 -13.531   4.866
    9   HD22  LEU  58          HD21      LEU  58  -7.037 -16.812   5.456
   10   HD21  LEU  58          HD22      LEU  58  -6.689 -16.355   3.788
   11   HD23  LEU  58          HD23      LEU  58  -8.047 -15.620   4.640

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  59           H        ILE  59  -1.595 -15.941   5.932
    2    HA   ILE  59           HA       ILE  59  -0.498 -16.666   3.294
    3    HB   ILE  59           HB       ILE  59   0.288 -14.618   4.881
    4   HG12  ILE  59          HG12      ILE  59   2.363 -16.274   3.433
    5   HG13  ILE  59          HG13      ILE  59   1.174 -15.318   2.586
    6   HG22  ILE  59          HG21      ILE  59   2.350 -16.697   5.561
    7   HG21  ILE  59          HG22      ILE  59   1.003 -16.406   6.639
    8   HG23  ILE  59          HG23      ILE  59   2.138 -15.110   6.263
    9   HD11  ILE  59          HD11      ILE  59   1.935 -13.318   3.930
   10   HD13  ILE  59          HD12      ILE  59   3.135 -13.946   2.801
   11   HD12  ILE  59          HD13      ILE  59   3.260 -14.319   4.521

  No H/Q in entry =          11
  In of MODEL   44
    1    H    GLU  60           H        GLU  60  -0.528 -17.789   6.656
    2    HA   GLU  60           HA       GLU  60   1.483 -19.786   6.387
    3    HB2  GLU  60           HB2      GLU  60   0.726 -19.010   8.580
    4    HB3  GLU  60           HB3      GLU  60  -0.888 -19.640   8.267
    5    HG2  GLU  60           HG2      GLU  60   0.036 -21.930   8.111
    6    HG3  GLU  60           HG3      GLU  60   1.650 -21.294   8.427

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLY  61           H        GLY  61  -2.027 -19.846   5.891
    2    HA3  GLY  61           HA2      GLY  61  -1.805 -22.636   4.920
    3    HA2  GLY  61           HA3      GLY  61  -3.284 -21.888   5.513

  No H/Q in entry =           3
  In of MODEL   44
    1    H    ASP  62           H        ASP  62  -1.033 -20.319   3.325
    2    HA   ASP  62           HA       ASP  62  -3.123 -19.779   1.433
    3    HB2  ASP  62           HB2      ASP  62  -1.306 -18.639   0.184
    4    HB3  ASP  62           HB3      ASP  62  -1.389 -18.132   1.868

  No H/Q in entry =           4
  In of MODEL   44
    1    H    ALA  63           H        ALA  63  -3.315 -22.389   1.319
    2    HA   ALA  63           HA       ALA  63  -1.512 -23.816  -0.350
    3    HB3  ALA  63           HB1      ALA  63  -3.369 -25.407  -0.643
    4    HB2  ALA  63           HB2      ALA  63  -4.458 -24.255   0.131
    5    HB1  ALA  63           HB3      ALA  63  -3.131 -24.970   1.050

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLY  64           H        GLY  64  -4.388 -21.870  -0.992
    2    HA3  GLY  64           HA2      GLY  64  -5.105 -20.815  -2.909
    3    HA2  GLY  64           HA3      GLY  64  -3.586 -21.261  -3.669

  No H/Q in entry =           3
  In of MODEL   44
    1    H    GLU  65           H        GLU  65  -5.319 -21.450  -5.486
    2    HA   GLU  65           HA       GLU  65  -7.101 -23.643  -5.456
    3    HB2  GLU  65           HB2      GLU  65  -5.895 -22.089  -7.743
    4    HB3  GLU  65           HB3      GLU  65  -7.138 -23.325  -7.948
    5    HG2  GLU  65           HG2      GLU  65  -8.651 -22.089  -6.472
    6    HG3  GLU  65           HG3      GLU  65  -7.407 -20.875  -6.184

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLY  66           H        GLY  66  -3.808 -23.315  -6.518
    2    HA3  GLY  66           HA2      GLY  66  -3.646 -26.085  -7.439
    3    HA2  GLY  66           HA3      GLY  66  -2.441 -24.836  -7.686

  No H/Q in entry =           3
  In of MODEL   44
    1    H    LYS  67           H        LYS  67  -1.705 -27.332  -6.917
    2    HA   LYS  67           HA       LYS  67  -1.534 -27.818  -4.165
    3    HB2  LYS  67           HB2      LYS  67   0.384 -29.348  -4.884
    4    HB3  LYS  67           HB3      LYS  67  -1.197 -29.632  -5.624
    5    HG2  LYS  67           HG2      LYS  67  -0.551 -28.312  -7.585
    6    HG3  LYS  67           HG3      LYS  67   1.008 -27.948  -6.850
    7    HD2  LYS  67           HD2      LYS  67   1.584 -30.345  -6.864
    8    HD3  LYS  67           HD3      LYS  67   0.019 -30.716  -7.593
    9    HE2  LYS  67           HE2      LYS  67   0.586 -29.322  -9.544
   10    HE3  LYS  67           HE3      LYS  67   2.142 -28.929  -8.817
   11    HZ3  LYS  67           HZ1      LYS  67   2.959 -30.993  -9.212
   12    HZ2  LYS  67           HZ2      LYS  67   1.872 -30.897 -10.514
   13    HZ1  LYS  67           HZ3      LYS  67   1.447 -31.752  -9.109

  No H/Q in entry =          13
  In of MODEL   44
    1    H    MET  68           H        MET  68   0.737 -26.244  -6.325
    2    HA   MET  68           HA       MET  68   2.511 -25.534  -4.090
    3    HB2  MET  68           HB2      MET  68   2.916 -25.608  -7.076
    4    HB3  MET  68           HB3      MET  68   4.105 -24.950  -5.951
    5    HG2  MET  68           HG2      MET  68   2.971 -27.756  -5.787
    6    HG3  MET  68           HG3      MET  68   4.522 -27.353  -6.527
    7    HE3  MET  68           HE1      MET  68   6.870 -26.380  -4.008
    8    HE2  MET  68           HE2      MET  68   5.782 -25.023  -4.288
    9    HE1  MET  68           HE3      MET  68   6.193 -26.103  -5.619

  No H/Q in entry =           9
  In of MODEL   44
    1    H    LYS  69           H        LYS  69   0.041 -24.125  -5.867
    2    HA   LYS  69           HA       LYS  69   1.221 -21.472  -5.943
    3    HB2  LYS  69           HB2      LYS  69  -1.530 -22.313  -6.822
    4    HB3  LYS  69           HB3      LYS  69  -0.742 -20.766  -7.150
    5    HG2  LYS  69           HG2      LYS  69   0.417 -23.444  -7.965
    6    HG3  LYS  69           HG3      LYS  69  -0.556 -22.435  -9.036
    7    HD2  LYS  69           HD2      LYS  69   1.127 -20.553  -8.454
    8    HD3  LYS  69           HD3      LYS  69   2.163 -21.858  -7.872
    9    HE2  LYS  69           HE2      LYS  69   2.108 -22.943 -10.046
   10    HE3  LYS  69           HE3      LYS  69   0.935 -21.769 -10.641
   11    HZ3  LYS  69           HZ1      LYS  69   2.890 -20.902 -11.418
   12    HZ2  LYS  69           HZ2      LYS  69   3.796 -21.420 -10.078
   13    HZ1  LYS  69           HZ3      LYS  69   2.758 -20.082  -9.940

  No H/Q in entry =          13
  In of MODEL   44
    1    H    VAL  70           H        VAL  70  -0.379 -19.589  -5.418
    2    HA   VAL  70           HA       VAL  70  -1.620 -20.040  -2.764
    3    HB   VAL  70           HB       VAL  70  -0.718 -17.830  -2.070
    4   HG12  VAL  70          HG11      VAL  70   1.789 -18.608  -2.154
    5   HG11  VAL  70          HG12      VAL  70   1.112 -20.071  -2.872
    6   HG13  VAL  70          HG13      VAL  70   0.611 -19.568  -1.257
    7   HG21  VAL  70          HG21      VAL  70   0.510 -17.948  -4.835
    8   HG23  VAL  70          HG22      VAL  70   1.271 -17.012  -3.550
    9   HG22  VAL  70          HG23      VAL  70  -0.363 -16.615  -4.075

  No H/Q in entry =           9
  In of MODEL   44
    1    H    SER  71           H        SER  71  -3.165 -18.359  -2.184
    2    HA   SER  71           HA       SER  71  -5.046 -17.791  -4.227
    3    HB2  SER  71           HB2      SER  71  -5.597 -17.979  -1.776
    4    HB3  SER  71           HB3      SER  71  -4.780 -16.441  -1.516
    5    HG   SER  71           HG       SER  71  -7.135 -16.393  -1.885

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU  72           H        LEU  72  -5.241 -16.117  -5.561
    2    HA   LEU  72           HA       LEU  72  -3.115 -14.322  -6.030
    3    HB2  LEU  72           HB2      LEU  72  -5.980 -14.337  -6.979
    4    HB3  LEU  72           HB3      LEU  72  -4.765 -13.197  -7.551
    5    HG   LEU  72           HG       LEU  72  -4.415 -16.210  -7.692
    6   HD11  LEU  72          HD11      LEU  72  -6.341 -15.482  -9.066
    7   HD13  LEU  72          HD12      LEU  72  -4.989 -15.990 -10.078
    8   HD12  LEU  72          HD13      LEU  72  -5.319 -14.273  -9.845
    9   HD21  LEU  72          HD21      LEU  72  -2.888 -13.818  -8.699
   10   HD23  LEU  72          HD22      LEU  72  -2.810 -15.320  -9.604
   11   HD22  LEU  72          HD23      LEU  72  -2.270 -15.275  -7.928

  No H/Q in entry =          11
  In of MODEL   44
    1    H    VAL  73           H        VAL  73  -6.208 -13.946  -4.403
    2    HA   VAL  73           HA       VAL  73  -6.228 -11.177  -4.036
    3    HB   VAL  73           HB       VAL  73  -7.946 -11.531  -2.448
    4   HG12  VAL  73          HG11      VAL  73  -8.158 -13.994  -4.167
    5   HG11  VAL  73          HG12      VAL  73  -8.225 -12.387  -4.887
    6   HG13  VAL  73          HG13      VAL  73  -9.430 -12.868  -3.691
    7   HG21  VAL  73          HG21      VAL  73  -6.524 -14.139  -2.027
    8   HG23  VAL  73          HG22      VAL  73  -8.255 -14.051  -1.697
    9   HG22  VAL  73          HG23      VAL  73  -7.138 -12.996  -0.830

  No H/Q in entry =           9
  In of MODEL   44
    1    H    LEU  74           H        LEU  74  -4.314 -13.571  -2.463
    2    HA   LEU  74           HA       LEU  74  -3.897 -12.449   0.067
    3    HB2  LEU  74           HB2      LEU  74  -3.131 -14.670  -0.439
    4    HB3  LEU  74           HB3      LEU  74  -2.074 -14.064  -1.713
    5    HG   LEU  74           HG       LEU  74  -0.752 -12.830  -0.029
    6   HD13  LEU  74          HD11      LEU  74  -2.309 -12.326   1.694
    7   HD12  LEU  74          HD12      LEU  74  -1.241 -13.535   2.410
    8   HD11  LEU  74          HD13      LEU  74  -2.834 -14.005   1.819
    9   HD22  LEU  74          HD21      LEU  74   0.442 -14.691   0.593
   10   HD21  LEU  74          HD22      LEU  74  -0.599 -15.383  -0.630
   11   HD23  LEU  74          HD23      LEU  74  -0.999 -15.592   1.058

  No H/Q in entry =          11
  In of MODEL   44
    1    H    VAL  75           H        VAL  75  -1.998 -12.055  -2.885
    2    HA   VAL  75           HA       VAL  75  -0.184 -10.153  -1.861
    3    HB   VAL  75           HB       VAL  75  -1.139 -10.623  -4.686
    4   HG13  VAL  75          HG11      VAL  75  -0.281  -8.325  -4.497
    5   HG12  VAL  75          HG12      VAL  75   0.927  -9.324  -5.290
    6   HG11  VAL  75          HG13      VAL  75   1.119  -8.900  -3.597
    7   HG21  VAL  75          HG21      VAL  75   0.074 -12.488  -3.566
    8   HG23  VAL  75          HG22      VAL  75   1.403 -11.385  -3.203
    9   HG22  VAL  75          HG23      VAL  75   1.024 -11.788  -4.879

  No H/Q in entry =           9
  In of MODEL   44
    1    H    GLU  76           H        GLU  76  -3.329  -9.768  -3.521
    2    HA   GLU  76           HA       GLU  76  -3.356  -6.952  -3.606
    3    HB2  GLU  76           HB2      GLU  76  -5.026  -8.362  -4.781
    4    HB3  GLU  76           HB3      GLU  76  -5.682  -8.876  -3.235
    5    HG2  GLU  76           HG2      GLU  76  -7.132  -7.149  -4.067
    6    HG3  GLU  76           HG3      GLU  76  -6.222  -6.439  -2.748

  No H/Q in entry =           6
  In of MODEL   44
    1    H    ALA  77           H        ALA  77  -4.490  -9.185  -1.081
    2    HA   ALA  77           HA       ALA  77  -5.431  -7.185   0.689
    3    HB2  ALA  77           HB1      ALA  77  -5.967  -9.617   0.870
    4    HB3  ALA  77           HB2      ALA  77  -5.409  -8.914   2.387
    5    HB1  ALA  77           HB3      ALA  77  -4.317  -9.904   1.422

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLN  78           H        GLN  78  -2.297  -8.761   0.319
    2    HA   GLN  78           HA       GLN  78  -1.032  -7.626   2.578
    3    HB2  GLN  78           HB2      GLN  78  -0.203  -9.567   1.178
    4    HB3  GLN  78           HB3      GLN  78   0.289  -8.391  -0.038
    5    HG2  GLN  78           HG2      GLN  78   1.762  -7.298   1.572
    6    HG3  GLN  78           HG3      GLN  78   1.230  -8.399   2.842
    7   HE21  GLN  78          HE21      GLN  78   1.180 -10.809   1.175
    8   HE22  GLN  78          HE22      GLN  78   2.795 -11.193   0.817

  No H/Q in entry =           8
  In of MODEL   44
    1    H    LEU  79           H        LEU  79  -1.383  -6.542  -0.763
    2    HA   LEU  79           HA       LEU  79   0.324  -4.332  -0.735
    3    HB2  LEU  79           HB2      LEU  79  -0.707  -5.116  -2.794
    4    HB3  LEU  79           HB3      LEU  79  -2.308  -4.712  -2.186
    5    HG   LEU  79           HG       LEU  79  -1.740  -2.331  -2.145
    6   HD13  LEU  79          HD11      LEU  79   0.502  -2.112  -1.628
    7   HD12  LEU  79          HD12      LEU  79   0.556  -1.815  -3.366
    8   HD11  LEU  79          HD13      LEU  79   0.993  -3.401  -2.728
    9   HD23  LEU  79          HD21      LEU  79  -1.101  -2.123  -4.695
   10   HD22  LEU  79          HD22      LEU  79  -2.635  -2.859  -4.243
   11   HD21  LEU  79          HD23      LEU  79  -1.272  -3.878  -4.691

  No H/Q in entry =          11
  In of MODEL   44
    1    H    HIS  80           H        HIS  80  -3.145  -4.464   0.086
    2    HA   HIS  80           HA       HIS  80  -3.309  -1.710   0.766
    3    HB2  HIS  80           HB2      HIS  80  -5.035  -4.103   1.068
    4    HB3  HIS  80           HB3      HIS  80  -5.344  -2.766   2.180
    5    HD1  HIS  80           HD1      HIS  80  -6.943  -1.107   1.280
    6    HD2  HIS  80           HD2      HIS  80  -4.765  -2.924  -1.776
    7    HE1  HIS  80           HE1      HIS  80  -7.770  -0.089  -0.895
    8    HE2  HIS  80           HE2      HIS  80  -6.448  -1.190  -2.766

  No H/Q in entry =           8
  In of MODEL   44
    1    H    LEU  81           H        LEU  81  -2.853  -4.621   2.742
    2    HA   LEU  81           HA       LEU  81  -2.830  -3.289   5.235
    3    HB2  LEU  81           HB2      LEU  81  -1.638  -5.913   4.341
    4    HB3  LEU  81           HB3      LEU  81  -1.608  -5.364   6.018
    5    HG   LEU  81           HG       LEU  81  -4.154  -5.580   4.386
    6   HD12  LEU  81          HD11      LEU  81  -4.481  -7.651   5.920
    7   HD11  LEU  81          HD12      LEU  81  -2.728  -7.600   6.109
    8   HD13  LEU  81          HD13      LEU  81  -3.437  -7.814   4.508
    9   HD23  LEU  81          HD21      LEU  81  -5.003  -5.789   6.884
   10   HD22  LEU  81          HD22      LEU  81  -4.660  -4.199   6.204
   11   HD21  LEU  81          HD23      LEU  81  -3.483  -4.978   7.261

  No H/Q in entry =          11
  In of MODEL   44
    1    H    MET  82           H        MET  82  -0.156  -4.208   3.062
    2    HA   MET  82           HA       MET  82   1.935  -3.347   4.753
    3    HB2  MET  82           HB2      MET  82   1.720  -3.668   1.759
    4    HB3  MET  82           HB3      MET  82   3.207  -3.118   2.528
    5    HG2  MET  82           HG2      MET  82   1.771  -5.696   3.235
    6    HG3  MET  82           HG3      MET  82   3.145  -5.595   2.137
    7    HE3  MET  82           HE1      MET  82   6.166  -4.904   4.129
    8    HE2  MET  82           HE2      MET  82   5.259  -3.523   3.518
    9    HE1  MET  82           HE3      MET  82   5.332  -5.008   2.573

  No H/Q in entry =           9
  In of MODEL   44
    1    H    THR  83           H        THR  83   0.134  -1.670   2.204
    2    HA   THR  83           HA       THR  83   1.573   0.762   2.307
    3    HB   THR  83           HB       THR  83  -0.591   1.717   1.323
    4    HG1  THR  83           HG1      THR  83  -2.256   0.439   1.207
    5   HG22  THR  83          HG21      THR  83  -0.339  -0.092  -0.688
    6   HG21  THR  83          HG22      THR  83   1.157  -0.406   0.189
    7   HG23  THR  83          HG23      THR  83   0.815   1.214  -0.417

  No H/Q in entry =           7
  In of MODEL   44
    1    H    SER  84           H        SER  84  -1.446  -0.245   3.898
    2    HA   SER  84           HA       SER  84  -1.916   2.182   5.256
    3    HB2  SER  84           HB2      SER  84  -2.782  -0.649   5.803
    4    HB3  SER  84           HB3      SER  84  -3.261   0.691   6.844
    5    HG   SER  84           HG       SER  84  -3.720   0.399   4.049

  No H/Q in entry =           5
  In of MODEL   44
    1    H    MET  85           H        MET  85  -0.241  -0.776   6.371
    2    HA   MET  85           HA       MET  85   0.286   0.130   8.981
    3    HB2  MET  85           HB2      MET  85   0.552  -2.213   8.287
    4    HB3  MET  85           HB3      MET  85   1.943  -1.758   7.302
    5    HG2  MET  85           HG2      MET  85   3.116  -0.948   9.313
    6    HG3  MET  85           HG3      MET  85   1.719  -1.374  10.303
    7    HE2  MET  85           HE1      MET  85   5.139  -2.697   8.997
    8    HE1  MET  85           HE2      MET  85   4.064  -2.582   7.605
    9    HE3  MET  85           HE3      MET  85   4.636  -4.158   8.141

  No H/Q in entry =           9
  In of MODEL   44
    1    H    LEU  86           H        LEU  86   2.227   0.380   6.033
    2    HA   LEU  86           HA       LEU  86   4.455   1.658   7.199
    3    HB2  LEU  86           HB2      LEU  86   4.253   0.591   4.884
    4    HB3  LEU  86           HB3      LEU  86   3.463   2.085   4.379
    5    HG   LEU  86           HG       LEU  86   5.505   3.301   5.368
    6   HD11  LEU  86          HD11      LEU  86   6.178   0.677   6.154
    7   HD13  LEU  86          HD12      LEU  86   7.199   2.109   6.261
    8   HD12  LEU  86          HD13      LEU  86   7.297   1.068   4.843
    9   HD23  LEU  86          HD21      LEU  86   6.204   1.543   3.009
   10   HD22  LEU  86          HD22      LEU  86   6.617   3.234   3.281
   11   HD21  LEU  86          HD23      LEU  86   4.959   2.788   2.878

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ALA  87           H        ALA  87   1.559   2.945   5.618
    2    HA   ALA  87           HA       ALA  87   2.186   5.667   5.718
    3    HB1  ALA  87           HB1      ALA  87  -0.142   4.070   5.165
    4    HB3  ALA  87           HB2      ALA  87   0.189   5.729   4.675
    5    HB2  ALA  87           HB3      ALA  87  -0.610   5.409   6.216

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ARG  88           H        ARG  88   0.470   3.672   8.095
    2    HA   ARG  88           HA       ARG  88  -0.020   5.717   9.953
    3    HB2  ARG  88           HB2      ARG  88  -0.986   3.376  10.005
    4    HB3  ARG  88           HB3      ARG  88   0.548   2.854  10.710
    5    HG2  ARG  88           HG2      ARG  88   0.094   4.924  12.341
    6    HG3  ARG  88           HG3      ARG  88  -1.576   4.622  11.881
    7    HD2  ARG  88           HD2      ARG  88  -1.706   2.767  13.117
    8    HD3  ARG  88           HD3      ARG  88  -0.123   2.169  12.585
    9    HE   ARG  88           HE       ARG  88  -0.645   3.426  15.045
   10   HH21  ARG  88          HH11      ARG  88   0.924   4.412  16.291
   11   HH22  ARG  88          HH12      ARG  88   2.449   4.825  15.590
   12   HH11  ARG  88          HH21      ARG  88   1.640   3.594  12.472
   13   HH12  ARG  88          HH22      ARG  88   2.863   4.345  13.439

  No H/Q in entry =          13
  In of MODEL   44
    1    H    GLU  89           H        GLU  89   2.751   3.467   9.720
    2    HA   GLU  89           HA       GLU  89   4.020   4.328  12.070
    3    HB2  GLU  89           HB2      GLU  89   4.657   2.310  10.716
    4    HB3  GLU  89           HB3      GLU  89   5.446   3.401   9.576
    5    HG2  GLU  89           HG2      GLU  89   6.939   4.221  11.326
    6    HG3  GLU  89           HG3      GLU  89   6.092   3.268  12.540

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LEU  90           H        LEU  90   4.354   5.500   8.749
    2    HA   LEU  90           HA       LEU  90   6.306   7.476   9.347
    3    HB2  LEU  90           HB2      LEU  90   4.299   7.179   7.116
    4    HB3  LEU  90           HB3      LEU  90   5.544   8.435   7.146
    5    HG   LEU  90           HG       LEU  90   6.184   5.490   7.464
    6   HD12  LEU  90          HD11      LEU  90   6.938   5.728   5.027
    7   HD11  LEU  90          HD12      LEU  90   5.939   7.180   4.985
    8   HD13  LEU  90          HD13      LEU  90   5.201   5.613   5.319
    9   HD22  LEU  90          HD21      LEU  90   8.093   6.615   8.155
   10   HD21  LEU  90          HD22      LEU  90   7.760   8.029   7.155
   11   HD23  LEU  90          HD23      LEU  90   8.404   6.561   6.421

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  91           H        ILE  91   2.768   7.531   9.195
    2    HA   ILE  91           HA       ILE  91   2.455  10.305   9.660
    3    HB   ILE  91           HB       ILE  91   0.638   7.946  10.188
    4   HG12  ILE  91          HG12      ILE  91   0.417  10.240   8.215
    5   HG13  ILE  91          HG13      ILE  91   1.261   8.739   7.836
    6   HG22  ILE  91          HG21      ILE  91  -1.072  10.022  10.260
    7   HG21  ILE  91          HG22      ILE  91   0.337  10.834  10.939
    8   HG23  ILE  91          HG23      ILE  91  -0.316   9.399  11.727
    9   HD13  ILE  91          HD11      ILE  91  -0.697   7.472   7.871
   10   HD12  ILE  91          HD12      ILE  91  -1.269   8.997   7.197
   11   HD11  ILE  91          HD13      ILE  91  -1.546   8.627   8.899

  No H/Q in entry =          11
  In of MODEL   44
    1    H    THR  92           H        THR  92   2.826   7.547  11.847
    2    HA   THR  92           HA       THR  92   2.394   8.913  14.278
    3    HB   THR  92           HB       THR  92   4.179   6.563  13.603
    4    HG1  THR  92           HG1      THR  92   2.203   5.827  13.496
    5   HG22  THR  92          HG21      THR  92   3.789   6.269  16.234
    6   HG21  THR  92          HG22      THR  92   3.743   8.029  16.170
    7   HG23  THR  92          HG23      THR  92   5.168   7.162  15.595

  No H/Q in entry =           7
  In of MODEL   44
    1    H    GLU  93           H        GLU  93   5.343   8.444  12.346
    2    HA   GLU  93           HA       GLU  93   7.109   9.844  14.052
    3    HB2  GLU  93           HB2      GLU  93   7.198   9.544  11.036
    4    HB3  GLU  93           HB3      GLU  93   8.543  10.056  12.055
    5    HG2  GLU  93           HG2      GLU  93   7.106   7.431  12.487
    6    HG3  GLU  93           HG3      GLU  93   8.493   7.575  11.413

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LEU  94           H        LEU  94   5.074  10.893  11.342
    2    HA   LEU  94           HA       LEU  94   5.906  13.590  11.257
    3    HB2  LEU  94           HB2      LEU  94   3.303  12.254  10.492
    4    HB3  LEU  94           HB3      LEU  94   3.579  13.980  10.260
    5    HG   LEU  94           HG       LEU  94   5.578  11.978   9.203
    6   HD11  LEU  94          HD11      LEU  94   2.844  12.560   8.139
    7   HD13  LEU  94          HD12      LEU  94   3.813  11.095   8.007
    8   HD12  LEU  94          HD13      LEU  94   4.163  12.477   6.970
    9   HD23  LEU  94          HD21      LEU  94   5.849  13.820   7.490
   10   HD22  LEU  94          HD22      LEU  94   6.266  14.301   9.135
   11   HD21  LEU  94          HD23      LEU  94   4.720  14.787   8.436

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  95           H        ILE  95   3.350  11.987  13.136
    2    HA   ILE  95           HA       ILE  95   2.327  14.341  14.341
    3    HB   ILE  95           HB       ILE  95   2.316  11.454  15.251
    4   HG12  ILE  95          HG12      ILE  95   0.114  13.253  14.208
    5   HG13  ILE  95          HG13      ILE  95   1.062  12.191  13.172
    6   HG21  ILE  95          HG21      ILE  95   1.055  13.932  16.463
    7   HG23  ILE  95          HG22      ILE  95   2.091  12.750  17.264
    8   HG22  ILE  95          HG23      ILE  95   0.452  12.306  16.784
    9   HD13  ILE  95          HD11      ILE  95   0.140  10.256  14.080
   10   HD12  ILE  95          HD12      ILE  95  -1.232  11.357  14.159
   11   HD11  ILE  95          HD13      ILE  95  -0.272  11.043  15.604

  No H/Q in entry =          11
  In of MODEL   44
    1    H    GLU  96           H        GLU  96   4.901  12.094  15.330
    2    HA   GLU  96           HA       GLU  96   5.462  13.275  17.828
    3    HB2  GLU  96           HB2      GLU  96   6.392  11.111  17.172
    4    HB3  GLU  96           HB3      GLU  96   7.334  11.882  15.897
    5    HG2  GLU  96           HG2      GLU  96   8.985  12.409  17.365
    6    HG3  GLU  96           HG3      GLU  96   7.844  13.227  18.422

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LEU  97           H        LEU  97   6.549  14.054  14.548
    2    HA   LEU  97           HA       LEU  97   8.451  16.030  15.273
    3    HB2  LEU  97           HB2      LEU  97   6.859  15.507  12.773
    4    HB3  LEU  97           HB3      LEU  97   7.890  16.929  12.903
    5    HG   LEU  97           HG       LEU  97   8.894  14.120  13.451
    6   HD12  LEU  97          HD11      LEU  97   9.897  14.318  11.136
    7   HD11  LEU  97          HD12      LEU  97   8.857  15.718  10.878
    8   HD13  LEU  97          HD13      LEU  97   8.144  14.131  11.164
    9   HD23  LEU  97          HD21      LEU  97  11.076  15.385  12.718
   10   HD22  LEU  97          HD22      LEU  97  10.456  15.651  14.347
   11   HD21  LEU  97          HD23      LEU  97  10.154  16.843  13.085

  No H/Q in entry =          11
  In of MODEL   44
    1    H    HIS  98           H        HIS  98   4.961  16.198  14.614
    2    HA   HIS  98           HA       HIS  98   4.685  18.999  14.762
    3    HB2  HIS  98           HB2      HIS  98   2.775  16.760  15.474
    4    HB3  HIS  98           HB3      HIS  98   2.322  18.464  15.537
    5    HD1  HIS  98           HD1      HIS  98   3.326  15.753  13.121
    6    HD2  HIS  98           HD2      HIS  98   1.981  19.698  13.016
    7    HE1  HIS  98           HE1      HIS  98   2.774  16.258  10.698
    8    HE2  HIS  98           HE2      HIS  98   1.959  18.655  10.613

  No H/Q in entry =           8
  In of MODEL   44
    1    H    GLU  99           H        GLU  99   4.793  16.497  17.249
    2    HA   GLU  99           HA       GLU  99   4.195  18.185  19.454
    3    HB2  GLU  99           HB2      GLU  99   4.086  15.704  19.539
    4    HB3  GLU  99           HB3      GLU  99   5.846  15.645  19.433
    5    HG2  GLU  99           HG2      GLU  99   6.041  16.925  21.514
    6    HG3  GLU  99           HG3      GLU  99   4.290  17.080  21.608

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LYS 100           H        LYS 100   7.244  17.238  17.890
    2    HA   LYS 100           HA       LYS 100   8.907  18.616  19.757
    3    HB2  LYS 100           HB2      LYS 100   9.403  17.702  16.914
    4    HB3  LYS 100           HB3      LYS 100  10.638  18.456  17.928
    5    HG2  LYS 100           HG2      LYS 100  10.244  16.700  19.660
    6    HG3  LYS 100           HG3      LYS 100   9.108  15.911  18.563
    7    HD2  LYS 100           HD2      LYS 100  10.902  15.622  16.897
    8    HD3  LYS 100           HD3      LYS 100  12.044  16.423  17.979
    9    HE2  LYS 100           HE2      LYS 100  11.631  14.663  19.688
   10    HE3  LYS 100           HE3      LYS 100  10.551  13.841  18.556
   11    HZ1  LYS 100           HZ1      LYS 100  13.378  14.491  17.909
   12    HZ3  LYS 100           HZ2      LYS 100  12.327  13.449  17.074
   13    HZ2  LYS 100           HZ3      LYS 100  12.909  13.017  18.611

  No H/Q in entry =          13
  In of MODEL   44
    1    H    LEU 101           H        LEU 101   7.226  19.571  16.803
    2    HA   LEU 101           HA       LEU 101   8.461  22.120  16.483
    3    HB2  LEU 101           HB2      LEU 101   5.858  20.912  15.586
    4    HB3  LEU 101           HB3      LEU 101   6.123  22.642  15.388
    5    HG   LEU 101           HG       LEU 101   8.144  20.614  14.415
    6   HD12  LEU 101          HD11      LEU 101   6.999  21.141  12.130
    7   HD11  LEU 101          HD12      LEU 101   5.601  21.577  13.111
    8   HD13  LEU 101          HD13      LEU 101   6.252  19.941  13.185
    9   HD21  LEU 101          HD21      LEU 101   7.541  23.534  13.873
   10   HD23  LEU 101          HD22      LEU 101   8.516  22.572  12.763
   11   HD22  LEU 101          HD23      LEU 101   9.057  22.817  14.423

  No H/Q in entry =          11
  In of MODEL   44
    1    H    LYS 102           H        LYS 102   6.911  20.981  19.090
    2    HA   LYS 102           HA       LYS 102   6.284  22.068  21.027
    3    HB2  LYS 102           HB2      LYS 102   7.585  24.054  19.915
    4    HB3  LYS 102           HB3      LYS 102   5.992  24.673  19.540
    5    HG2  LYS 102           HG2      LYS 102   7.362  24.393  22.193
    6    HG3  LYS 102           HG3      LYS 102   6.422  25.732  21.569
    7    HD2  LYS 102           HD2      LYS 102   5.155  23.102  22.432
    8    HD3  LYS 102           HD3      LYS 102   5.412  24.455  23.523
    9    HE2  LYS 102           HE2      LYS 102   3.132  24.079  22.028
   10    HE3  LYS 102           HE3      LYS 102   3.647  25.617  22.719
   11    HZ2  LYS 102           HZ1      LYS 102   3.122  25.742  20.339
   12    HZ1  LYS 102           HZ2      LYS 102   4.375  24.651  20.013
   13    HZ3  LYS 102           HZ3      LYS 102   4.729  26.175  20.664

  No H/Q in entry =          13
  In of MODEL   44
    1    H    ALA 103           H        ALA 103   4.664  23.639  18.265
    2    HA   ALA 103           HA       ALA 103   2.213  24.232  19.149
    3    HB1  ALA 103           HB1      ALA 103   1.311  23.409  16.901
    4    HB2  ALA 103           HB2      ALA 103   2.954  22.860  16.571
    5    HB3  ALA 103           HB3      ALA 103   2.634  24.574  16.846

  No H/Q in entry =           5
  In of MODEL   44
    1    H1   ALA   1           H3       ALA   1  10.475 -20.207  -6.343
    2    H2   ALA   1           H2       ALA   1   9.511 -20.398  -7.732
    3    H3   ALA   1           H1       ALA   1   9.065 -21.148  -6.273
    4    HA   ALA   1           HA       ALA   1  10.089 -22.962  -7.021
    5    HB1  ALA   1           HB1      ALA   1  10.191 -22.592  -9.294
    6    HB2  ALA   1           HB2      ALA   1  11.919 -22.459  -8.962
    7    HB3  ALA   1           HB3      ALA   1  10.934 -21.002  -9.107

  No H/Q in entry =           7
  In of MODEL   44
    1    H    GLU   2           H        GLU   2  12.364 -23.933  -7.081
    2    HA   GLU   2           HA       GLU   2  13.743 -23.876  -4.866
    3    HB2  GLU   2           HB2      GLU   2  15.104 -23.743  -7.563
    4    HB3  GLU   2           HB3      GLU   2  15.825 -24.368  -6.080
    5    HG2  GLU   2           HG2      GLU   2  14.790 -26.374  -6.333
    6    HG3  GLU   2           HG3      GLU   2  13.226 -25.613  -6.590

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLU   3           H        GLU   3  15.535 -22.015  -7.256
    2    HA   GLU   3           HA       GLU   3  16.701 -20.349  -5.286
    3    HB2  GLU   3           HB2      GLU   3  16.649 -20.331  -8.296
    4    HB3  GLU   3           HB3      GLU   3  17.406 -19.013  -7.400
    5    HG2  GLU   3           HG2      GLU   3  19.055 -20.408  -6.483
    6    HG3  GLU   3           HG3      GLU   3  18.095 -21.865  -6.713

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LEU   4           H        LEU   4  14.430 -19.466  -7.915
    2    HA   LEU   4           HA       LEU   4  13.988 -16.856  -7.290
    3    HB2  LEU   4           HB2      LEU   4  11.795 -18.806  -8.034
    4    HB3  LEU   4           HB3      LEU   4  11.737 -17.056  -8.223
    5    HG   LEU   4           HG       LEU   4  13.685 -18.930  -9.603
    6   HD13  LEU   4          HD11      LEU   4  12.388 -18.759 -11.514
    7   HD12  LEU   4          HD12      LEU   4  11.694 -17.210 -11.040
    8   HD11  LEU   4          HD13      LEU   4  11.125 -18.699 -10.287
    9   HD23  LEU   4          HD21      LEU   4  14.045 -16.681 -10.943
   10   HD22  LEU   4          HD22      LEU   4  14.900 -16.940  -9.423
   11   HD21  LEU   4          HD23      LEU   4  13.457 -15.930  -9.459

  No H/Q in entry =          11
  In of MODEL   44
    1    H    GLU   5           H        GLU   5  12.475 -19.635  -5.665
    2    HA   GLU   5           HA       GLU   5  10.810 -18.057  -3.955
    3    HB2  GLU   5           HB2      GLU   5  10.360 -20.427  -4.488
    4    HB3  GLU   5           HB3      GLU   5  11.792 -20.883  -3.562
    5    HG2  GLU   5           HG2      GLU   5  10.840 -19.873  -1.545
    6    HG3  GLU   5           HG3      GLU   5   9.426 -19.347  -2.457

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLU   6           H        GLU   6  13.941 -19.668  -3.517
    2    HA   GLU   6           HA       GLU   6  14.298 -18.829  -0.814
    3    HB2  GLU   6           HB2      GLU   6  15.500 -20.751  -1.893
    4    HB3  GLU   6           HB3      GLU   6  16.431 -19.579  -2.827
    5    HG2  GLU   6           HG2      GLU   6  17.800 -20.025  -0.956
    6    HG3  GLU   6           HG3      GLU   6  17.003 -18.507  -0.544

  No H/Q in entry =           6
  In of MODEL   44
    1    H    VAL   7           H        VAL   7  15.080 -17.493  -3.956
    2    HA   VAL   7           HA       VAL   7  16.784 -15.386  -3.078
    3    HB   VAL   7           HB       VAL   7  15.078 -15.721  -5.559
    4   HG11  VAL   7          HG11      VAL   7  16.990 -13.530  -4.733
    5   HG13  VAL   7          HG12      VAL   7  15.350 -13.369  -5.357
    6   HG12  VAL   7          HG13      VAL   7  16.656 -13.878  -6.429
    7   HG21  VAL   7          HG21      VAL   7  17.171 -17.200  -4.996
    8   HG23  VAL   7          HG22      VAL   7  18.090 -15.745  -5.385
    9   HG22  VAL   7          HG23      VAL   7  17.048 -16.479  -6.601

  No H/Q in entry =           9
  In of MODEL   44
    1    H    VAL   8           H        VAL   8  13.290 -15.622  -3.640
    2    HA   VAL   8           HA       VAL   8  12.648 -12.911  -3.155
    3    HB   VAL   8           HB       VAL   8  11.017 -15.431  -2.744
    4   HG12  VAL   8          HG11      VAL   8   9.106 -13.653  -2.936
    5   HG11  VAL   8          HG12      VAL   8  10.349 -12.509  -2.424
    6   HG13  VAL   8          HG13      VAL   8   9.918 -13.867  -1.385
    7   HG21  VAL   8          HG21      VAL   8  11.900 -14.307  -5.108
    8   HG23  VAL   8          HG22      VAL   8  10.355 -13.489  -4.889
    9   HG22  VAL   8          HG23      VAL   8  10.415 -15.248  -4.961

  No H/Q in entry =           9
  In of MODEL   44
    1    H    MET   9           H        MET   9  12.887 -15.730  -0.990
    2    HA   MET   9           HA       MET   9  12.080 -14.464   1.386
    3    HB2  MET   9           HB2      MET   9  13.916 -16.775   0.802
    4    HB3  MET   9           HB3      MET   9  13.730 -16.176   2.450
    5    HG2  MET   9           HG2      MET   9  11.193 -16.373   2.048
    6    HG3  MET   9           HG3      MET   9  11.619 -17.344   0.638
    7    HE3  MET   9           HE1      MET   9  12.990 -20.537   1.784
    8    HE2  MET   9           HE2      MET   9  14.073 -19.205   1.391
    9    HE1  MET   9           HE3      MET   9  12.564 -19.396   0.503

  No H/Q in entry =           9
  In of MODEL   44
    1    H    GLY  10           H        GLY  10  15.261 -14.707  -0.167
    2    HA3  GLY  10           HA2      GLY  10  16.729 -13.309   1.812
    3    HA2  GLY  10           HA3      GLY  10  17.193 -13.469   0.118

  No H/Q in entry =           3
  In of MODEL   44
    1    H    LEU  11           H        LEU  11  15.036 -12.224  -1.117
    2    HA   LEU  11           HA       LEU  11  15.743  -9.485  -0.939
    3    HB2  LEU  11           HB2      LEU  11  13.366 -10.869  -2.184
    4    HB3  LEU  11           HB3      LEU  11  13.660  -9.136  -2.334
    5    HG   LEU  11           HG       LEU  11  15.672 -11.257  -3.131
    6   HD13  LEU  11          HD11      LEU  11  13.925 -11.602  -4.655
    7   HD12  LEU  11          HD12      LEU  11  14.938 -10.424  -5.488
    8   HD11  LEU  11          HD13      LEU  11  13.468  -9.898  -4.668
    9   HD22  LEU  11          HD21      LEU  11  16.918  -9.304  -2.893
   10   HD21  LEU  11          HD22      LEU  11  15.552  -8.255  -3.268
   11   HD23  LEU  11          HD23      LEU  11  16.378  -9.123  -4.560

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  12           H        ILE  12  12.959 -11.296   0.315
    2    HA   ILE  12           HA       ILE  12  11.581  -9.068   1.385
    3    HB   ILE  12           HB       ILE  12  11.594 -11.956   2.314
    4   HG12  ILE  12          HG12      ILE  12  10.910 -11.308  -0.125
    5   HG13  ILE  12          HG13      ILE  12   9.865 -12.382   0.783
    6   HG22  ILE  12          HG21      ILE  12   9.253 -11.287   3.154
    7   HG21  ILE  12          HG22      ILE  12   9.788  -9.617   2.970
    8   HG23  ILE  12          HG23      ILE  12  10.629 -10.695   4.083
    9   HD13  ILE  12          HD11      ILE  12   8.376 -10.536   1.299
   10   HD12  ILE  12          HD12      ILE  12   8.652 -10.571  -0.441
   11   HD11  ILE  12          HD13      ILE  12   9.482  -9.394   0.553

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  13           H        ILE  13  13.956 -11.297   2.782
    2    HA   ILE  13           HA       ILE  13  13.996 -10.132   5.369
    3    HB   ILE  13           HB       ILE  13  16.049 -11.707   3.798
    4   HG12  ILE  13          HG12      ILE  13  13.785 -12.694   4.585
    5   HG13  ILE  13          HG13      ILE  13  15.254 -13.600   4.939
    6   HG23  ILE  13          HG21      ILE  13  17.467 -10.679   5.321
    7   HG22  ILE  13          HG22      ILE  13  16.963 -12.079   6.260
    8   HG21  ILE  13          HG23      ILE  13  16.215 -10.508   6.548
    9   HD11  ILE  13          HD11      ILE  13  14.450 -11.630   7.017
   10   HD13  ILE  13          HD12      ILE  13  15.070 -13.269   7.189
   11   HD12  ILE  13          HD13      ILE  13  13.372 -13.009   6.809

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ASN  14           H        ASN  14  15.957  -9.598   2.456
    2    HA   ASN  14           HA       ASN  14  17.712  -7.673   3.530
    3    HB2  ASN  14           HB2      ASN  14  17.685  -8.927   1.208
    4    HB3  ASN  14           HB3      ASN  14  16.801  -7.502   0.677
    5   HD21  ASN  14          HD21      ASN  14  19.241  -7.849  -0.507
    6   HD22  ASN  14          HD22      ASN  14  20.390  -6.776   0.128

  No H/Q in entry =           6
  In of MODEL   44
    1    H    SER  15           H        SER  15  14.606  -7.299   1.835
    2    HA   SER  15           HA       SER  15  14.509  -4.478   1.906
    3    HB2  SER  15           HB2      SER  15  12.176  -4.709   1.407
    4    HB3  SER  15           HB3      SER  15  12.967  -6.074   0.629
    5    HG   SER  15           HG       SER  15  11.815  -6.143   3.220

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLY  16           H        GLY  16  13.399  -6.944   4.195
    2    HA3  GLY  16           HA2      GLY  16  12.184  -5.198   6.060
    3    HA2  GLY  16           HA3      GLY  16  12.789  -6.812   6.415

  No H/Q in entry =           3
  In of MODEL   44
    1    H    GLN  17           H        GLN  17  15.503  -6.490   5.828
    2    HA   GLN  17           HA       GLN  17  16.462  -5.286   8.217
    3    HB2  GLN  17           HB2      GLN  17  17.680  -7.081   7.006
    4    HB3  GLN  17           HB3      GLN  17  18.007  -5.951   5.691
    5    HG2  GLN  17           HG2      GLN  17  19.946  -6.026   7.155
    6    HG3  GLN  17           HG3      GLN  17  19.166  -4.456   7.328
    7   HE21  GLN  17          HE21      GLN  17  19.666  -4.007   9.526
    8   HE22  GLN  17          HE22      GLN  17  19.176  -4.996  10.814

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ALA  18           H        ALA  18  16.285  -4.190   4.862
    2    HA   ALA  18           HA       ALA  18  17.732  -1.806   5.104
    3    HB2  ALA  18           HB1      ALA  18  16.612  -3.004   3.028
    4    HB3  ALA  18           HB2      ALA  18  16.885  -1.262   3.022
    5    HB1  ALA  18           HB3      ALA  18  15.282  -1.902   3.386

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ARG  19           H        ARG  19  14.229  -2.379   5.492
    2    HA   ARG  19           HA       ARG  19  13.572   0.271   6.219
    3    HB2  ARG  19           HB2      ARG  19  11.884  -1.469   5.621
    4    HB3  ARG  19           HB3      ARG  19  12.219  -2.277   7.154
    5    HG2  ARG  19           HG2      ARG  19  11.516  -0.289   8.403
    6    HG3  ARG  19           HG3      ARG  19  11.273   0.596   6.898
    7    HD2  ARG  19           HD2      ARG  19   9.126  -0.194   7.711
    8    HD3  ARG  19           HD3      ARG  19   9.543  -1.068   6.230
    9    HE   ARG  19           HE       ARG  19  10.491  -2.626   8.329
   10   HH21  ARG  19          HH11      ARG  19   9.232  -4.265   9.257
   11   HH22  ARG  19          HH12      ARG  19   7.513  -4.228   9.083
   12   HH11  ARG  19          HH21      ARG  19   7.505  -1.313   7.236
   13   HH12  ARG  19          HH22      ARG  19   6.535  -2.557   7.935

  No H/Q in entry =          13
  In of MODEL   44
    1    H    SER  20           H        SER  20  14.413  -2.574   8.165
    2    HA   SER  20           HA       SER  20  14.130  -1.486  10.708
    3    HB2  SER  20           HB2      SER  20  14.586  -3.812  10.580
    4    HB3  SER  20           HB3      SER  20  16.036  -3.553   9.615
    5    HG   SER  20           HG       SER  20  16.726  -2.292  11.585

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU  21           H        LEU  21  16.978  -1.427   8.577
    2    HA   LEU  21           HA       LEU  21  18.656   0.042  10.327
    3    HB2  LEU  21           HB2      LEU  21  18.638  -0.221   7.312
    4    HB3  LEU  21           HB3      LEU  21  19.891   0.639   8.203
    5    HG   LEU  21           HG       LEU  21  19.152  -2.253   8.738
    6   HD12  LEU  21          HD11      LEU  21  21.522  -1.220   7.157
    7   HD11  LEU  21          HD12      LEU  21  20.045  -1.826   6.409
    8   HD13  LEU  21          HD13      LEU  21  21.039  -2.901   7.390
    9   HD21  LEU  21          HD21      LEU  21  21.259  -0.353   9.743
   10   HD23  LEU  21          HD22      LEU  21  21.656  -2.064   9.639
   11   HD22  LEU  21          HD23      LEU  21  20.321  -1.535  10.649

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ALA  22           H        ALA  22  16.402   1.035   7.771
    2    HA   ALA  22           HA       ALA  22  16.954   3.791   7.801
    3    HB3  ALA  22           HB1      ALA  22  15.548   2.564   6.114
    4    HB2  ALA  22           HB2      ALA  22  14.848   4.077   6.687
    5    HB1  ALA  22           HB3      ALA  22  14.249   2.537   7.305

  No H/Q in entry =           5
  In of MODEL   44
    1    H    TYR  23           H        TYR  23  14.444   1.977   9.621
    2    HA   TYR  23           HA       TYR  23  13.490   4.211  11.081
    3    HB2  TYR  23           HB2      TYR  23  12.244   2.104  11.046
    4    HB3  TYR  23           HB3      TYR  23  13.569   1.282  11.870
    5    HD1  TYR  23           HD1      TYR  23  11.087   4.045  12.243
    6    HD2  TYR  23           HD2      TYR  23  13.753   1.323  14.226
    7    HE1  TYR  23           HE1      TYR  23  10.157   4.732  14.439
    8    HE2  TYR  23           HE2      TYR  23  12.823   2.008  16.419
    9    HH   TYR  23           HH       TYR  23   9.958   3.840  16.709

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ALA  24           H        ALA  24  16.122   1.919  11.711
    2    HA   ALA  24           HA       ALA  24  16.792   2.897  14.281
    3    HB1  ALA  24           HB1      ALA  24  18.140   1.098  14.109
    4    HB3  ALA  24           HB2      ALA  24  19.174   2.020  13.017
    5    HB2  ALA  24           HB3      ALA  24  17.876   1.022  12.368

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA  25           H        ALA  25  17.761   3.838  11.009
    2    HA   ALA  25           HA       ALA  25  19.715   5.759  11.669
    3    HB1  ALA  25           HB1      ALA  25  18.998   4.827   9.347
    4    HB3  ALA  25           HB2      ALA  25  19.509   6.512   9.450
    5    HB2  ALA  25           HB3      ALA  25  17.792   6.114   9.376

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU  26           H        LEU  26  16.202   6.009  11.302
    2    HA   LEU  26           HA       LEU  26  15.993   8.790  11.767
    3    HB2  LEU  26           HB2      LEU  26  14.126   7.570  10.829
    4    HB3  LEU  26           HB3      LEU  26  14.027   6.535  12.249
    5    HG   LEU  26           HG       LEU  26  13.429   8.489  13.638
    6   HD12  LEU  26          HD11      LEU  26  12.783  10.600  12.323
    7   HD11  LEU  26          HD12      LEU  26  13.762   9.948  11.012
    8   HD13  LEU  26          HD13      LEU  26  14.506  10.321  12.568
    9   HD21  LEU  26          HD21      LEU  26  11.757   8.199  11.124
   10   HD23  LEU  26          HD22      LEU  26  11.197   8.891  12.643
   11   HD22  LEU  26          HD23      LEU  26  11.640   7.188  12.564

  No H/Q in entry =          11
  In of MODEL   44
    1    H    LYS  27           H        LYS  27  15.864   5.999  13.945
    2    HA   LYS  27           HA       LYS  27  15.275   7.356  16.320
    3    HB2  LYS  27           HB2      LYS  27  15.288   4.882  16.041
    4    HB3  LYS  27           HB3      LYS  27  17.052   4.924  16.002
    5    HG2  LYS  27           HG2      LYS  27  17.104   5.897  18.257
    6    HG3  LYS  27           HG3      LYS  27  15.337   5.926  18.299
    7    HD2  LYS  27           HD2      LYS  27  15.297   3.461  18.049
    8    HD3  LYS  27           HD3      LYS  27  17.061   3.439  18.041
    9    HE2  LYS  27           HE2      LYS  27  17.097   4.416  20.302
   10    HE3  LYS  27           HE3      LYS  27  15.331   4.467  20.314
   11    HZ3  LYS  27           HZ1      LYS  27  16.105   2.504  21.456
   12    HZ2  LYS  27           HZ2      LYS  27  17.021   2.026  20.104
   13    HZ1  LYS  27           HZ3      LYS  27  15.323   2.042  20.021

  No H/Q in entry =          13
  In of MODEL   44
    1    H    GLN  28           H        GLN  28  18.391   6.762  14.731
    2    HA   GLN  28           HA       GLN  28  20.078   7.824  16.730
    3    HB2  GLN  28           HB2      GLN  28  20.366   7.781  13.715
    4    HB3  GLN  28           HB3      GLN  28  21.654   8.258  14.823
    5    HG2  GLN  28           HG2      GLN  28  20.238   5.579  14.885
    6    HG3  GLN  28           HG3      GLN  28  21.810   5.862  14.143
    7   HE21  GLN  28          HE21      GLN  28  23.023   7.556  16.045
    8   HE22  GLN  28          HE22      GLN  28  23.187   6.719  17.513

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ALA  29           H        ALA  29  18.342   9.333  14.043
    2    HA   ALA  29           HA       ALA  29  19.359  11.945  14.312
    3    HB2  ALA  29           HB1      ALA  29  17.667  12.602  12.841
    4    HB1  ALA  29           HB2      ALA  29  16.514  11.434  13.483
    5    HB3  ALA  29           HB3      ALA  29  17.842  10.887  12.460

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LYS  30           H        LYS  30  16.567  10.358  15.819
    2    HA   LYS  30           HA       LYS  30  15.567  12.611  17.186
    3    HB2  LYS  30           HB2      LYS  30  15.432   9.667  17.874
    4    HB3  LYS  30           HB3      LYS  30  14.574  10.919  18.772
    5    HG2  LYS  30           HG2      LYS  30  13.459  11.625  16.656
    6    HG3  LYS  30           HG3      LYS  30  14.254  10.288  15.823
    7    HD2  LYS  30           HD2      LYS  30  13.167   8.680  17.341
    8    HD3  LYS  30           HD3      LYS  30  12.381  10.007  18.197
    9    HE2  LYS  30           HE2      LYS  30  11.222  10.660  16.106
   10    HE3  LYS  30           HE3      LYS  30  11.988   9.305  15.269
   11    HZ2  LYS  30           HZ1      LYS  30   9.675   8.909  16.143
   12    HZ1  LYS  30           HZ2      LYS  30  10.339   8.948  17.711
   13    HZ3  LYS  30           HZ3      LYS  30  10.841   7.765  16.595

  No H/Q in entry =          13
  In of MODEL   44
    1    H    GLN  31           H        GLN  31  18.210  10.417  17.916
    2    HA   GLN  31           HA       GLN  31  18.540  11.414  20.617
    3    HB2  GLN  31           HB2      GLN  31  20.553   9.836  19.007
    4    HB3  GLN  31           HB3      GLN  31  20.417   9.952  20.762
    5    HG2  GLN  31           HG2      GLN  31  17.897   9.024  19.983
    6    HG3  GLN  31           HG3      GLN  31  18.994   8.177  18.901
    7   HE21  GLN  31          HE21      GLN  31  17.438   7.030  21.168
    8   HE22  GLN  31          HE22      GLN  31  18.586   6.354  22.217

  No H/Q in entry =           8
  In of MODEL   44
    1    H    GLY  32           H        GLY  32  19.075  12.743  17.659
    2    HA3  GLY  32           HA2      GLY  32  20.077  14.784  17.158
    3    HA2  GLY  32           HA3      GLY  32  20.831  14.773  18.747

  No H/Q in entry =           3
  In of MODEL   44
    1    H    ASP  33           H        ASP  33  21.234  11.888  16.955
    2    HA   ASP  33           HA       ASP  33  24.065  12.543  16.498
    3    HB2  ASP  33           HB2      ASP  33  22.536   9.939  16.597
    4    HB3  ASP  33           HB3      ASP  33  24.224  10.044  16.105

  No H/Q in entry =           4
  In of MODEL   44
    1    H    PHE  34           H        PHE  34  23.598  13.880  14.623
    2    HA   PHE  34           HA       PHE  34  22.245  12.920  12.328
    3    HB2  PHE  34           HB2      PHE  34  24.393  15.036  12.573
    4    HB3  PHE  34           HB3      PHE  34  23.408  14.761  11.138
    5    HD1  PHE  34           HD1      PHE  34  23.668  16.677  14.063
    6    HD2  PHE  34           HD2      PHE  34  20.779  14.597  11.660
    7    HE1  PHE  34           HE1      PHE  34  21.861  18.083  15.014
    8    HE2  PHE  34           HE2      PHE  34  18.975  16.003  12.615
    9    HZ   PHE  34           HZ       PHE  34  19.520  17.747  14.287

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ALA  35           H        ALA  35  25.616  12.700  13.341
    2    HA   ALA  35           HA       ALA  35  26.720  11.885  10.881
    3    HB3  ALA  35           HB1      ALA  35  28.388  10.693  12.597
    4    HB2  ALA  35           HB2      ALA  35  27.530  11.718  13.747
    5    HB1  ALA  35           HB3      ALA  35  28.375  12.443  12.380

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA  36           H        ALA  36  25.585   9.922  13.634
    2    HA   ALA  36           HA       ALA  36  26.053   7.438  12.345
    3    HB2  ALA  36           HB1      ALA  36  25.613   6.683  14.416
    4    HB3  ALA  36           HB2      ALA  36  23.929   7.191  14.265
    5    HB1  ALA  36           HB3      ALA  36  25.137   8.310  14.896

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA  37           H        ALA  37  23.246   9.583  12.485
    2    HA   ALA  37           HA       ALA  37  21.380   7.833  11.296
    3    HB3  ALA  37           HB1      ALA  37  21.626  10.793  11.605
    4    HB1  ALA  37           HB2      ALA  37  20.306   9.721  12.069
    5    HB2  ALA  37           HB3      ALA  37  20.501  10.201  10.383

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LYS  38           H        LYS  38  23.499  10.288   9.835
    2    HA   LYS  38           HA       LYS  38  22.862   9.880   7.154
    3    HB2  LYS  38           HB2      LYS  38  24.679  11.417   8.611
    4    HB3  LYS  38           HB3      LYS  38  25.708  10.426   7.582
    5    HG2  LYS  38           HG2      LYS  38  24.552  11.215   5.588
    6    HG3  LYS  38           HG3      LYS  38  23.361  12.072   6.572
    7    HD2  LYS  38           HD2      LYS  38  24.965  13.656   7.336
    8    HD3  LYS  38           HD3      LYS  38  26.320  12.664   6.797
    9    HE2  LYS  38           HE2      LYS  38  25.978  14.546   5.255
   10    HE3  LYS  38           HE3      LYS  38  25.635  13.015   4.442
   11    HZ3  LYS  38           HZ1      LYS  38  23.441  13.475   4.310
   12    HZ2  LYS  38           HZ2      LYS  38  23.974  15.086   4.408
   13    HZ1  LYS  38           HZ3      LYS  38  23.392  14.298   5.795

  No H/Q in entry =          13
  In of MODEL   44
    1    H    ALA  39           H        ALA  39  25.362   8.255   9.106
    2    HA   ALA  39           HA       ALA  39  26.425   6.671   7.030
    3    HB2  ALA  39           HB1      ALA  39  26.325   5.693   9.868
    4    HB1  ALA  39           HB2      ALA  39  27.287   7.114   9.461
    5    HB3  ALA  39           HB3      ALA  39  27.630   5.566   8.690

  No H/Q in entry =           5
  In of MODEL   44
    1    H    MET  40           H        MET  40  23.804   6.059   9.320
    2    HA   MET  40           HA       MET  40  23.346   3.361   8.570
    3    HB2  MET  40           HB2      MET  40  21.539   5.408   9.870
    4    HB3  MET  40           HB3      MET  40  21.123   3.702   9.685
    5    HG2  MET  40           HG2      MET  40  23.675   4.621  11.036
    6    HG3  MET  40           HG3      MET  40  22.178   4.349  11.925
    7    HE3  MET  40           HE1      MET  40  21.592   0.718  12.079
    8    HE2  MET  40           HE2      MET  40  20.733   2.030  11.277
    9    HE1  MET  40           HE3      MET  40  21.472   2.305  12.853

  No H/Q in entry =           9
  In of MODEL   44
    1    H    MET  41           H        MET  41  21.952   6.429   7.397
    2    HA   MET  41           HA       MET  41  19.991   5.254   5.715
    3    HB2  MET  41           HB2      MET  41  21.488   7.839   5.218
    4    HB3  MET  41           HB3      MET  41  19.959   7.358   4.494
    5    HG2  MET  41           HG2      MET  41  19.207   7.160   7.043
    6    HG3  MET  41           HG3      MET  41  20.522   8.309   7.274
    7    HE2  MET  41           HE1      MET  41  19.973   9.618   3.944
    8    HE1  MET  41           HE2      MET  41  20.929  10.044   5.359
    9    HE3  MET  41           HE3      MET  41  19.664  11.134   4.799

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ASP  42           H        ASP  42  23.370   6.161   5.173
    2    HA   ASP  42           HA       ASP  42  23.464   5.702   2.413
    3    HB2  ASP  42           HB2      ASP  42  25.218   6.680   4.190
    4    HB3  ASP  42           HB3      ASP  42  25.866   5.051   4.055

  No H/Q in entry =           4
  In of MODEL   44
    1    H    GLN  43           H        GLN  43  24.171   3.528   5.122
    2    HA   GLN  43           HA       GLN  43  24.826   1.276   3.528
    3    HB2  GLN  43           HB2      GLN  43  23.799   1.449   6.371
    4    HB3  GLN  43           HB3      GLN  43  24.371  -0.039   5.609
    5    HG2  GLN  43           HG2      GLN  43  26.542   1.163   5.108
    6    HG3  GLN  43           HG3      GLN  43  25.965   2.487   6.114
    7   HE21  GLN  43          HE21      GLN  43  28.191   1.496   7.149
    8   HE22  GLN  43          HE22      GLN  43  27.908   0.408   8.419

  No H/Q in entry =           8
  In of MODEL   44
    1    H    SER  44           H        SER  44  21.774   2.419   4.914
    2    HA   SER  44           HA       SER  44  20.194   0.188   4.226
    3    HB2  SER  44           HB2      SER  44  19.764   2.713   5.385
    4    HB3  SER  44           HB3      SER  44  18.732   2.684   3.958
    5    HG   SER  44           HG       SER  44  17.630   1.737   5.674

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ARG  45           H        ARG  45  20.956   3.158   2.439
    2    HA   ARG  45           HA       ARG  45  19.433   2.694   0.129
    3    HB2  ARG  45           HB2      ARG  45  20.587   4.820   0.727
    4    HB3  ARG  45           HB3      ARG  45  22.128   4.059   0.340
    5    HG2  ARG  45           HG2      ARG  45  21.347   3.671  -1.978
    6    HG3  ARG  45           HG3      ARG  45  19.818   4.455  -1.589
    7    HD2  ARG  45           HD2      ARG  45  21.079   6.541  -0.991
    8    HD3  ARG  45           HD3      ARG  45  22.572   5.762  -1.562
    9    HE   ARG  45           HE       ARG  45  20.644   5.547  -3.602
   10   HH21  ARG  45          HH11      ARG  45  20.648   6.926  -5.358
   11   HH22  ARG  45          HH12      ARG  45  21.414   8.471  -5.244
   12   HH11  ARG  45          HH21      ARG  45  22.386   8.026  -1.959
   13   HH12  ARG  45          HH22      ARG  45  22.397   9.093  -3.316

  No H/Q in entry =          13
  In of MODEL   44
    1    H    MET  46           H        MET  46  22.790   1.795   0.877
    2    HA   MET  46           HA       MET  46  23.393   0.612  -1.612
    3    HB2  MET  46           HB2      MET  46  24.493   0.254   1.176
    4    HB3  MET  46           HB3      MET  46  25.150  -0.620  -0.211
    5    HG2  MET  46           HG2      MET  46  25.573   1.519  -1.365
    6    HG3  MET  46           HG3      MET  46  24.906   2.398   0.004
    7    HE2  MET  46           HE1      MET  46  28.467   3.394   0.706
    8    HE1  MET  46           HE2      MET  46  26.784   3.846   0.450
    9    HE3  MET  46           HE3      MET  46  27.750   3.266  -0.906

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ALA  47           H        ALA  47  21.997  -0.728   1.354
    2    HA   ALA  47           HA       ALA  47  21.927  -3.436   0.537
    3    HB2  ALA  47           HB1      ALA  47  21.548  -2.986   2.843
    4    HB3  ALA  47           HB2      ALA  47  20.009  -3.575   2.219
    5    HB1  ALA  47           HB3      ALA  47  20.249  -1.847   2.487

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU  48           H        LEU  48  19.592  -0.792   0.191
    2    HA   LEU  48           HA       LEU  48  17.539  -2.305  -1.070
    3    HB2  LEU  48           HB2      LEU  48  18.213   0.645  -1.168
    4    HB3  LEU  48           HB3      LEU  48  16.738  -0.051  -1.840
    5    HG   LEU  48           HG       LEU  48  17.586  -0.374   1.048
    6   HD13  LEU  48          HD11      LEU  48  17.184   1.930   0.873
    7   HD12  LEU  48          HD12      LEU  48  15.621   1.291   1.377
    8   HD11  LEU  48          HD13      LEU  48  15.897   1.720  -0.312
    9   HD22  LEU  48          HD21      LEU  48  16.046  -2.076   0.657
   10   HD21  LEU  48          HD22      LEU  48  15.180  -1.161  -0.578
   11   HD23  LEU  48          HD23      LEU  48  14.969  -0.764   1.127

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ASN  49           H        ASN  49  20.241  -0.389  -2.288
    2    HA   ASN  49           HA       ASN  49  19.592  -0.454  -5.013
    3    HB2  ASN  49           HB2      ASN  49  21.278   1.049  -4.098
    4    HB3  ASN  49           HB3      ASN  49  22.292  -0.314  -3.643
    5   HD21  ASN  49          HD21      ASN  49  20.844   1.252  -6.519
    6   HD22  ASN  49          HD22      ASN  49  22.080   0.785  -7.584

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLU  50           H        GLU  50  21.559  -2.673  -3.060
    2    HA   GLU  50           HA       GLU  50  22.249  -4.423  -5.195
    3    HB2  GLU  50           HB2      GLU  50  23.446  -4.417  -3.028
    4    HB3  GLU  50           HB3      GLU  50  21.998  -5.038  -2.236
    5    HG2  GLU  50           HG2      GLU  50  22.074  -7.065  -3.605
    6    HG3  GLU  50           HG3      GLU  50  23.455  -6.438  -4.502

  No H/Q in entry =           6
  In of MODEL   44
    1    H    ALA  51           H        ALA  51  19.592  -4.350  -2.870
    2    HA   ALA  51           HA       ALA  51  18.409  -6.810  -3.640
    3    HB3  ALA  51           HB1      ALA  51  16.819  -6.301  -2.083
    4    HB1  ALA  51           HB2      ALA  51  16.618  -4.650  -2.674
    5    HB2  ALA  51           HB3      ALA  51  17.974  -5.051  -1.619

  No H/Q in entry =           5
  In of MODEL   44
    1    H    HIS  52           H        HIS  52  17.847  -3.453  -4.659
    2    HA   HIS  52           HA       HIS  52  15.731  -3.956  -6.462
    3    HB2  HIS  52           HB2      HIS  52  16.387  -1.699  -5.654
    4    HB3  HIS  52           HB3      HIS  52  17.852  -1.800  -6.631
    5    HD1  HIS  52           HD1      HIS  52  17.382  -2.211  -9.302
    6    HD2  HIS  52           HD2      HIS  52  14.196  -0.738  -7.052
    7    HE1  HIS  52           HE1      HIS  52  15.727  -1.239 -10.954
    8    HE2  HIS  52           HE2      HIS  52  13.779  -0.336  -9.597

  No H/Q in entry =           8
  In of MODEL   44
    1    H    LEU  53           H        LEU  53  19.250  -3.985  -6.893
    2    HA   LEU  53           HA       LEU  53  19.306  -4.287  -9.695
    3    HB2  LEU  53           HB2      LEU  53  21.233  -5.078  -7.526
    4    HB3  LEU  53           HB3      LEU  53  21.547  -5.449  -9.218
    5    HG   LEU  53           HG       LEU  53  20.889  -2.644  -8.266
    6   HD13  LEU  53          HD11      LEU  53  22.920  -3.343  -7.117
    7   HD12  LEU  53          HD12      LEU  53  23.352  -2.239  -8.422
    8   HD11  LEU  53          HD13      LEU  53  23.590  -3.971  -8.620
    9   HD23  LEU  53          HD21      LEU  53  22.331  -2.197 -10.414
   10   HD22  LEU  53          HD22      LEU  53  20.647  -2.676 -10.603
   11   HD21  LEU  53          HD23      LEU  53  21.923  -3.856 -10.837

  No H/Q in entry =          11
  In of MODEL   44
    1    H    VAL  54           H        VAL  54  19.176  -6.685  -7.081
    2    HA   VAL  54           HA       VAL  54  19.284  -8.973  -8.751
    3    HB   VAL  54           HB       VAL  54  18.131  -8.554  -5.982
    4   HG12  VAL  54          HG11      VAL  54  18.438 -11.174  -5.990
    5   HG11  VAL  54          HG12      VAL  54  18.255 -10.996  -7.735
    6   HG13  VAL  54          HG13      VAL  54  16.969 -10.462  -6.654
    7   HG22  VAL  54          HG21      VAL  54  20.448  -8.360  -5.757
    8   HG21  VAL  54          HG22      VAL  54  20.779  -9.448  -7.104
    9   HG23  VAL  54          HG23      VAL  54  20.244 -10.099  -5.554

  No H/Q in entry =           9
  In of MODEL   44
    1    H    GLN  55           H        GLN  55  16.568  -7.058  -7.461
    2    HA   GLN  55           HA       GLN  55  14.536  -8.704  -8.543
    3    HB2  GLN  55           HB2      GLN  55  13.797  -7.181  -6.910
    4    HB3  GLN  55           HB3      GLN  55  14.600  -5.814  -7.679
    5    HG2  GLN  55           HG2      GLN  55  12.878  -5.471  -9.168
    6    HG3  GLN  55           HG3      GLN  55  12.545  -7.189  -9.346
    7   HE21  GLN  55          HE21      GLN  55  10.535  -7.729  -8.544
    8   HE22  GLN  55          HE22      GLN  55   9.765  -6.976  -7.233

  No H/Q in entry =           8
  In of MODEL   44
    1    H    THR  56           H        THR  56  16.294  -5.909  -9.889
    2    HA   THR  56           HA       THR  56  14.860  -5.527 -12.236
    3    HB   THR  56           HB       THR  56  17.863  -5.393 -11.859
    4    HG1  THR  56           HG1      THR  56  15.722  -3.777 -11.218
    5   HG23  THR  56          HG21      THR  56  17.646  -5.329 -14.167
    6   HG22  THR  56          HG22      THR  56  17.438  -3.623 -13.772
    7   HG21  THR  56          HG23      THR  56  16.027  -4.630 -14.098

  No H/Q in entry =           7
  In of MODEL   44
    1    H    LYS  57           H        LYS  57  17.495  -7.843 -11.634
    2    HA   LYS  57           HA       LYS  57  17.489  -9.026 -14.218
    3    HB2  LYS  57           HB2      LYS  57  19.279  -9.299 -12.478
    4    HB3  LYS  57           HB3      LYS  57  18.168 -10.285 -11.539
    5    HG2  LYS  57           HG2      LYS  57  18.044 -11.924 -13.356
    6    HG3  LYS  57           HG3      LYS  57  19.107 -10.934 -14.349
    7    HD2  LYS  57           HD2      LYS  57  20.911 -11.190 -12.679
    8    HD3  LYS  57           HD3      LYS  57  19.854 -12.198 -11.691
    9    HE2  LYS  57           HE2      LYS  57  19.684 -13.841 -13.529
   10    HE3  LYS  57           HE3      LYS  57  20.729 -12.842 -14.537
   11    HZ1  LYS  57           HZ1      LYS  57  22.370 -13.028 -12.618
   12    HZ3  LYS  57           HZ2      LYS  57  22.149 -14.393 -13.604
   13    HZ2  LYS  57           HZ3      LYS  57  21.411 -14.318 -12.076

  No H/Q in entry =          13
  In of MODEL   44
    1    H    LEU  58           H        LEU  58  15.704  -9.696 -11.246
    2    HA   LEU  58           HA       LEU  58  14.469 -12.058 -12.191
    3    HB2  LEU  58           HB2      LEU  58  13.684 -10.158  -9.988
    4    HB3  LEU  58           HB3      LEU  58  12.869 -11.690 -10.311
    5    HG   LEU  58           HG       LEU  58  15.843 -11.431  -9.754
    6   HD11  LEU  58          HD11      LEU  58  13.469 -11.843  -7.964
    7   HD13  LEU  58          HD12      LEU  58  14.928 -10.889  -7.697
    8   HD12  LEU  58          HD13      LEU  58  14.990 -12.646  -7.570
    9   HD22  LEU  58          HD21      LEU  58  15.714 -13.487 -10.791
   10   HD21  LEU  58          HD22      LEU  58  13.999 -13.689 -10.432
   11   HD23  LEU  58          HD23      LEU  58  15.205 -14.002  -9.183

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  59           H        ILE  59  13.816  -8.714 -12.860
    2    HA   ILE  59           HA       ILE  59  11.098  -9.343 -13.803
    3    HB   ILE  59           HB       ILE  59  11.921  -7.070 -12.589
    4   HG12  ILE  59          HG12      ILE  59  10.003  -6.925 -14.926
    5   HG13  ILE  59          HG13      ILE  59   9.589  -7.707 -13.423
    6   HG22  ILE  59          HG21      ILE  59  11.988  -6.241 -15.477
    7   HG21  ILE  59          HG22      ILE  59  13.467  -6.682 -14.654
    8   HG23  ILE  59          HG23      ILE  59  12.497  -5.332 -14.075
    9   HD11  ILE  59          HD11      ILE  59  10.172  -5.588 -12.212
   10   HD13  ILE  59          HD12      ILE  59   8.796  -5.428 -13.301
   11   HD12  ILE  59          HD13      ILE  59  10.379  -4.818 -13.787

  No H/Q in entry =          11
  In of MODEL   44
    1    H    GLU  60           H        GLU  60  14.307  -8.504 -15.057
    2    HA   GLU  60           HA       GLU  60  13.530  -8.088 -17.764
    3    HB2  GLU  60           HB2      GLU  60  15.711  -7.367 -16.919
    4    HB3  GLU  60           HB3      GLU  60  16.164  -9.039 -16.604
    5    HG2  GLU  60           HG2      GLU  60  15.990  -9.552 -19.010
    6    HG3  GLU  60           HG3      GLU  60  15.512  -7.888 -19.334

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLY  61           H        GLY  61  14.490 -10.983 -15.961
    2    HA3  GLY  61           HA2      GLY  61  13.940 -12.617 -18.370
    3    HA2  GLY  61           HA3      GLY  61  14.969 -13.110 -17.029

  No H/Q in entry =           3
  In of MODEL   44
    1    H    ASP  62           H        ASP  62  11.861 -11.546 -16.647
    2    HA   ASP  62           HA       ASP  62  10.916 -13.657 -14.948
    3    HB2  ASP  62           HB2      ASP  62   8.901 -12.246 -14.761
    4    HB3  ASP  62           HB3      ASP  62  10.379 -11.340 -14.452

  No H/Q in entry =           4
  In of MODEL   44
    1    H    ALA  63           H        ALA  63  11.251 -15.174 -17.047
    2    HA   ALA  63           HA       ALA  63   9.223 -15.205 -19.046
    3    HB3  ALA  63           HB1      ALA  63   9.940 -17.560 -19.398
    4    HB2  ALA  63           HB2      ALA  63  10.913 -17.461 -17.931
    5    HB1  ALA  63           HB3      ALA  63  11.307 -16.448 -19.321

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLY  64           H        GLY  64   9.500 -16.673 -15.859
    2    HA3  GLY  64           HA2      GLY  64   7.892 -17.478 -14.420
    3    HA2  GLY  64           HA3      GLY  64   6.666 -16.882 -15.531

  No H/Q in entry =           3
  In of MODEL   44
    1    H    GLU  65           H        GLU  65   5.774 -19.065 -14.622
    2    HA   GLU  65           HA       GLU  65   6.858 -21.489 -15.588
    3    HB2  GLU  65           HB2      GLU  65   4.078 -20.781 -14.662
    4    HB3  GLU  65           HB3      GLU  65   4.582 -22.420 -15.070
    5    HG2  GLU  65           HG2      GLU  65   6.334 -22.346 -13.374
    6    HG3  GLU  65           HG3      GLU  65   5.944 -20.667 -13.006

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLY  66           H        GLY  66   4.498 -19.296 -16.890
    2    HA3  GLY  66           HA2      GLY  66   4.015 -20.946 -19.254
    3    HA2  GLY  66           HA3      GLY  66   3.115 -19.518 -18.783

  No H/Q in entry =           3
  In of MODEL   44
    1    H    LYS  67           H        LYS  67   3.876 -19.877 -21.361
    2    HA   LYS  67           HA       LYS  67   6.354 -18.831 -22.121
    3    HB2  LYS  67           HB2      LYS  67   5.135 -18.421 -24.336
    4    HB3  LYS  67           HB3      LYS  67   5.160 -20.077 -23.714
    5    HG2  LYS  67           HG2      LYS  67   2.939 -19.770 -22.725
    6    HG3  LYS  67           HG3      LYS  67   2.910 -18.091 -23.260
    7    HD2  LYS  67           HD2      LYS  67   3.014 -18.838 -25.611
    8    HD3  LYS  67           HD3      LYS  67   3.029 -20.520 -25.072
    9    HE2  LYS  67           HE2      LYS  67   0.841 -20.198 -23.984
   10    HE3  LYS  67           HE3      LYS  67   0.821 -18.516 -24.511
   11    HZ3  LYS  67           HZ1      LYS  67   0.398 -19.088 -26.645
   12    HZ2  LYS  67           HZ2      LYS  67  -0.312 -20.437 -25.897
   13    HZ1  LYS  67           HZ3      LYS  67   1.250 -20.552 -26.556

  No H/Q in entry =          13
  In of MODEL   44
    1    H    MET  68           H        MET  68   3.258 -17.227 -21.756
    2    HA   MET  68           HA       MET  68   4.455 -14.588 -22.235
    3    HB2  MET  68           HB2      MET  68   1.607 -15.572 -22.215
    4    HB3  MET  68           HB3      MET  68   2.044 -13.868 -22.347
    5    HG2  MET  68           HG2      MET  68   3.036 -16.033 -24.222
    6    HG3  MET  68           HG3      MET  68   1.684 -14.955 -24.571
    7    HE3  MET  68           HE1      MET  68   2.877 -11.627 -25.137
    8    HE2  MET  68           HE2      MET  68   2.868 -11.924 -23.400
    9    HE1  MET  68           HE3      MET  68   1.652 -12.687 -24.423

  No H/Q in entry =           9
  In of MODEL   44
    1    H    LYS  69           H        LYS  69   3.654 -16.493 -19.567
    2    HA   LYS  69           HA       LYS  69   2.737 -14.273 -17.923
    3    HB2  LYS  69           HB2      LYS  69   3.155 -17.168 -17.161
    4    HB3  LYS  69           HB3      LYS  69   2.322 -15.941 -16.202
    5    HG2  LYS  69           HG2      LYS  69   1.499 -16.710 -19.013
    6    HG3  LYS  69           HG3      LYS  69   0.780 -17.405 -17.561
    7    HD2  LYS  69           HD2      LYS  69   0.348 -14.954 -16.848
    8    HD3  LYS  69           HD3      LYS  69   0.649 -14.557 -18.541
    9    HE2  LYS  69           HE2      LYS  69  -1.130 -16.051 -19.260
   10    HE3  LYS  69           HE3      LYS  69  -1.374 -16.610 -17.605
   11    HZ3  LYS  69           HZ1      LYS  69  -2.990 -15.018 -17.802
   12    HZ2  LYS  69           HZ2      LYS  69  -2.057 -14.020 -18.811
   13    HZ1  LYS  69           HZ3      LYS  69  -1.726 -14.096 -17.148

  No H/Q in entry =          13
  In of MODEL   44
    1    H    VAL  70           H        VAL  70   3.592 -14.338 -15.508
    2    HA   VAL  70           HA       VAL  70   6.554 -14.399 -15.521
    3    HB   VAL  70           HB       VAL  70   6.512 -12.324 -14.164
    4   HG12  VAL  70          HG11      VAL  70   5.518 -10.854 -16.108
    5   HG11  VAL  70          HG12      VAL  70   5.347 -12.404 -16.933
    6   HG13  VAL  70          HG13      VAL  70   6.939 -11.852 -16.416
    7   HG21  VAL  70          HG21      VAL  70   3.535 -12.620 -14.618
    8   HG23  VAL  70          HG22      VAL  70   4.250 -11.033 -14.335
    9   HG22  VAL  70          HG23      VAL  70   4.388 -12.291 -13.108

  No H/Q in entry =           9
  In of MODEL   44
    1    H    SER  71           H        SER  71   7.476 -14.498 -13.339
    2    HA   SER  71           HA       SER  71   6.322 -16.525 -11.725
    3    HB2  SER  71           HB2      SER  71   8.764 -16.027 -11.829
    4    HB3  SER  71           HB3      SER  71   8.465 -14.520 -10.965
    5    HG   SER  71           HG       SER  71   9.057 -16.467  -9.692

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU  72           H        LEU  72   4.945 -16.413 -10.054
    2    HA   LEU  72           HA       LEU  72   3.408 -14.093  -9.600
    3    HB2  LEU  72           HB2      LEU  72   3.680 -16.657  -8.040
    4    HB3  LEU  72           HB3      LEU  72   2.516 -15.397  -7.639
    5    HG   LEU  72           HG       LEU  72   2.679 -16.703 -10.376
    6   HD11  LEU  72          HD11      LEU  72   2.092 -18.363  -8.636
    7   HD13  LEU  72          HD12      LEU  72   0.711 -18.010  -9.673
    8   HD12  LEU  72          HD13      LEU  72   0.807 -17.299  -8.062
    9   HD21  LEU  72          HD21      LEU  72   0.820 -14.753  -9.030
   10   HD23  LEU  72          HD22      LEU  72   0.185 -15.817 -10.273
   11   HD22  LEU  72          HD23      LEU  72   1.485 -14.694 -10.658

  No H/Q in entry =          11
  In of MODEL   44
    1    H    VAL  73           H        VAL  73   6.054 -15.553  -7.831
    2    HA   VAL  73           HA       VAL  73   6.000 -14.032  -5.492
    3    HB   VAL  73           HB       VAL  73   8.175 -14.858  -5.064
    4   HG12  VAL  73          HG11      VAL  73   7.063 -16.957  -6.918
    5   HG11  VAL  73          HG12      VAL  73   6.211 -16.518  -5.438
    6   HG13  VAL  73          HG13      VAL  73   7.847 -17.169  -5.355
    7   HG21  VAL  73          HG21      VAL  73   8.364 -14.887  -8.057
    8   HG23  VAL  73          HG22      VAL  73   9.345 -16.024  -7.134
    9   HG22  VAL  73          HG23      VAL  73   9.526 -14.289  -6.872

  No H/Q in entry =           9
  In of MODEL   44
    1    H    LEU  74           H        LEU  74   6.999 -13.128  -8.662
    2    HA   LEU  74           HA       LEU  74   8.955 -11.193  -8.157
    3    HB2  LEU  74           HB2      LEU  74   8.498 -11.928 -10.400
    4    HB3  LEU  74           HB3      LEU  74   6.835 -11.351 -10.298
    5    HG   LEU  74           HG       LEU  74   7.658  -9.029 -10.066
    6   HD13  LEU  74          HD11      LEU  74   9.776  -9.245  -9.022
    7   HD12  LEU  74          HD12      LEU  74  10.158  -8.750 -10.670
    8   HD11  LEU  74          HD13      LEU  74  10.327 -10.440 -10.196
    9   HD22  LEU  74          HD21      LEU  74   7.984  -8.784 -12.323
   10   HD21  LEU  74          HD22      LEU  74   7.390 -10.427 -12.275
   11   HD23  LEU  74          HD23      LEU  74   9.109 -10.138 -12.417

  No H/Q in entry =          11
  In of MODEL   44
    1    H    VAL  75           H        VAL  75   5.462 -10.786  -8.514
    2    HA   VAL  75           HA       VAL  75   5.381  -8.032  -7.913
    3    HB   VAL  75           HB       VAL  75   3.279 -10.167  -7.545
    4   HG13  VAL  75          HG11      VAL  75   2.797  -8.268  -6.051
    5   HG12  VAL  75          HG12      VAL  75   1.718  -8.204  -7.436
    6   HG11  VAL  75          HG13      VAL  75   3.109  -7.135  -7.361
    7   HG21  VAL  75          HG21      VAL  75   4.067  -9.722  -9.868
    8   HG23  VAL  75          HG22      VAL  75   3.698  -8.014  -9.647
    9   HG22  VAL  75          HG23      VAL  75   2.398  -9.206  -9.633

  No H/Q in entry =           9
  In of MODEL   44
    1    H    GLU  76           H        GLU  76   5.107 -10.918  -5.818
    2    HA   GLU  76           HA       GLU  76   4.640  -9.566  -3.391
    3    HB2  GLU  76           HB2      GLU  76   4.449 -12.029  -3.632
    4    HB3  GLU  76           HB3      GLU  76   6.183 -12.140  -3.878
    5    HG2  GLU  76           HG2      GLU  76   5.754 -12.729  -1.583
    6    HG3  GLU  76           HG3      GLU  76   6.498 -11.140  -1.565

  No H/Q in entry =           6
  In of MODEL   44
    1    H    ALA  77           H        ALA  77   7.697 -10.484  -4.953
    2    HA   ALA  77           HA       ALA  77   9.389  -9.460  -2.929
    3    HB1  ALA  77           HB1      ALA  77  10.130 -11.007  -4.730
    4    HB2  ALA  77           HB2      ALA  77  11.160  -9.583  -4.589
    5    HB3  ALA  77           HB3      ALA  77   9.975  -9.688  -5.891

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLN  78           H        GLN  78   8.011  -8.020  -5.838
    2    HA   GLN  78           HA       GLN  78   9.379  -5.550  -5.719
    3    HB2  GLN  78           HB2      GLN  78   8.052  -6.479  -7.671
    4    HB3  GLN  78           HB3      GLN  78   6.590  -6.021  -6.800
    5    HG2  GLN  78           HG2      GLN  78   7.304  -3.685  -6.771
    6    HG3  GLN  78           HG3      GLN  78   8.818  -4.115  -7.567
    7   HE21  GLN  78          HE21      GLN  78   7.683  -6.034  -9.451
    8   HE22  GLN  78          HE22      GLN  78   6.748  -5.152 -10.559

  No H/Q in entry =           8
  In of MODEL   44
    1    H    LEU  79           H        LEU  79   6.349  -6.676  -4.301
    2    HA   LEU  79           HA       LEU  79   5.369  -4.267  -3.282
    3    HB2  LEU  79           HB2      LEU  79   4.041  -6.310  -3.240
    4    HB3  LEU  79           HB3      LEU  79   5.178  -7.063  -2.126
    5    HG   LEU  79           HG       LEU  79   4.632  -5.426  -0.392
    6   HD13  LEU  79          HD11      LEU  79   4.182  -3.403  -1.433
    7   HD12  LEU  79          HD12      LEU  79   2.553  -3.920  -1.001
    8   HD11  LEU  79          HD13      LEU  79   3.136  -4.138  -2.649
    9   HD23  LEU  79          HD21      LEU  79   2.042  -5.901  -0.311
   10   HD22  LEU  79          HD22      LEU  79   3.173  -7.249  -0.206
   11   HD21  LEU  79          HD23      LEU  79   2.365  -6.899  -1.731

  No H/Q in entry =          11
  In of MODEL   44
    1    H    HIS  80           H        HIS  80   7.532  -6.625  -1.705
    2    HA   HIS  80           HA       HIS  80   7.824  -5.096   0.672
    3    HB2  HIS  80           HB2      HIS  80   9.149  -7.463  -0.535
    4    HB3  HIS  80           HB3      HIS  80  10.063  -6.579   0.689
    5    HD1  HIS  80           HD1      HIS  80   9.561  -7.223   3.027
    6    HD2  HIS  80           HD2      HIS  80   6.346  -8.039   0.502
    7    HE1  HIS  80           HE1      HIS  80   7.778  -8.321   4.465
    8    HE2  HIS  80           HE2      HIS  80   5.811  -8.823   2.934

  No H/Q in entry =           8
  In of MODEL   44
    1    H    LEU  81           H        LEU  81   9.835  -5.371  -2.236
    2    HA   LEU  81           HA       LEU  81  11.889  -3.649  -1.343
    3    HB2  LEU  81           HB2      LEU  81  10.971  -4.422  -4.113
    4    HB3  LEU  81           HB3      LEU  81  12.397  -3.427  -3.813
    5    HG   LEU  81           HG       LEU  81  11.981  -6.152  -2.554
    6   HD12  LEU  81          HD11      LEU  81  13.798  -6.782  -4.302
    7   HD11  LEU  81          HD12      LEU  81  13.245  -5.350  -5.168
    8   HD13  LEU  81          HD13      LEU  81  12.123  -6.668  -4.840
    9   HD23  LEU  81          HD21      LEU  81  14.612  -5.855  -2.531
   10   HD22  LEU  81          HD22      LEU  81  13.631  -5.094  -1.280
   11   HD21  LEU  81          HD23      LEU  81  14.221  -4.140  -2.640

  No H/Q in entry =          11
  In of MODEL   44
    1    H    MET  82           H        MET  82   8.977  -2.982  -3.285
    2    HA   MET  82           HA       MET  82   9.538  -0.258  -3.771
    3    HB2  MET  82           HB2      MET  82   6.967  -1.833  -3.661
    4    HB3  MET  82           HB3      MET  82   6.980  -0.107  -4.017
    5    HG2  MET  82           HG2      MET  82   8.570  -2.185  -5.558
    6    HG3  MET  82           HG3      MET  82   7.009  -1.548  -6.072
    7    HE3  MET  82           HE1      MET  82   7.487   1.909  -7.225
    8    HE2  MET  82           HE2      MET  82   7.105   1.678  -5.521
    9    HE1  MET  82           HE3      MET  82   6.436   0.579  -6.723

  No H/Q in entry =           9
  In of MODEL   44
    1    H    THR  83           H        THR  83   7.726  -1.855  -1.179
    2    HA   THR  83           HA       THR  83   6.889   0.493   0.156
    3    HB   THR  83           HB       THR  83   6.737  -1.091   2.166
    4    HG1  THR  83           HG1      THR  83   7.479  -3.045   1.929
    5   HG22  THR  83          HG21      THR  83   5.076  -2.636   0.685
    6   HG21  THR  83          HG22      THR  83   5.316  -1.304  -0.440
    7   HG23  THR  83          HG23      THR  83   4.673  -0.992   1.173

  No H/Q in entry =           7
  In of MODEL   44
    1    H    SER  84           H        SER  84   9.695  -1.630   0.675
    2    HA   SER  84           HA       SER  84  10.759  -0.219   2.874
    3    HB2  SER  84           HB2      SER  84  12.004  -2.061   0.844
    4    HB3  SER  84           HB3      SER  84  12.952  -1.321   2.132
    5    HG   SER  84           HG       SER  84  10.663  -2.994   2.376

  No H/Q in entry =           5
  In of MODEL   44
    1    H    MET  85           H        MET  85  11.525   0.054  -0.610
    2    HA   MET  85           HA       MET  85  13.538   2.001  -0.343
    3    HB2  MET  85           HB2      MET  85  13.134   0.731  -2.417
    4    HB3  MET  85           HB3      MET  85  11.619   1.604  -2.647
    5    HG2  MET  85           HG2      MET  85  12.849   3.736  -2.750
    6    HG3  MET  85           HG3      MET  85  14.365   2.879  -2.493
    7    HE2  MET  85           HE1      MET  85  11.996   4.268  -5.243
    8    HE1  MET  85           HE2      MET  85  11.151   2.925  -4.476
    9    HE3  MET  85           HE3      MET  85  11.635   2.799  -6.163

  No H/Q in entry =           9
  In of MODEL   44
    1    H    LEU  86           H        LEU  86  10.053   2.367  -0.861
    2    HA   LEU  86           HA       LEU  86  10.013   5.182  -1.029
    3    HB2  LEU  86           HB2      LEU  86   8.157   3.540  -1.619
    4    HB3  LEU  86           HB3      LEU  86   7.821   3.445   0.110
    5    HG   LEU  86           HG       LEU  86   7.681   6.007   0.069
    6   HD11  LEU  86          HD11      LEU  86   8.462   5.578  -2.632
    7   HD13  LEU  86          HD12      LEU  86   8.036   7.105  -1.865
    8   HD12  LEU  86          HD13      LEU  86   6.795   6.157  -2.679
    9   HD23  LEU  86          HD21      LEU  86   5.542   4.681  -1.606
   10   HD22  LEU  86          HD22      LEU  86   5.358   5.936  -0.384
   11   HD21  LEU  86          HD23      LEU  86   5.742   4.286   0.101

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ALA  87           H        ALA  87   9.520   2.994   1.705
    2    HA   ALA  87           HA       ALA  87   8.982   4.902   3.682
    3    HB1  ALA  87           HB1      ALA  87   9.765   2.076   3.584
    4    HB3  ALA  87           HB2      ALA  87   8.644   2.892   4.670
    5    HB2  ALA  87           HB3      ALA  87  10.371   2.907   5.019

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ARG  88           H        ARG  88  12.056   3.456   2.703
    2    HA   ARG  88           HA       ARG  88  13.672   4.811   4.547
    3    HB2  ARG  88           HB2      ARG  88  14.327   2.839   3.136
    4    HB3  ARG  88           HB3      ARG  88  14.493   3.938   1.769
    5    HG2  ARG  88           HG2      ARG  88  15.972   5.229   3.726
    6    HG3  ARG  88           HG3      ARG  88  16.277   3.535   4.097
    7    HD2  ARG  88           HD2      ARG  88  17.546   3.237   2.253
    8    HD3  ARG  88           HD3      ARG  88  16.420   4.123   1.221
    9    HE   ARG  88           HE       ARG  88  18.821   5.161   2.280
   10   HH21  ARG  88          HH11      ARG  88  19.186   7.378   2.098
   11   HH22  ARG  88          HH12      ARG  88  17.845   8.461   1.956
   12   HH11  ARG  88          HH21      ARG  88  15.489   5.944   1.997
   13   HH12  ARG  88          HH22      ARG  88  15.750   7.647   1.874

  No H/Q in entry =          13
  In of MODEL   44
    1    H    GLU  89           H        GLU  89  12.716   5.734   1.226
    2    HA   GLU  89           HA       GLU  89  14.283   8.082   1.086
    3    HB2  GLU  89           HB2      GLU  89  13.136   7.060  -0.871
    4    HB3  GLU  89           HB3      GLU  89  11.594   7.611  -0.214
    5    HG2  GLU  89           HG2      GLU  89  12.316   9.944  -0.363
    6    HG3  GLU  89           HG3      GLU  89  13.917   9.442  -0.898

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LEU  90           H        LEU  90  10.947   7.595   2.203
    2    HA   LEU  90           HA       LEU  90  10.453  10.330   2.791
    3    HB2  LEU  90           HB2      LEU  90   9.234   7.762   3.802
    4    HB3  LEU  90           HB3      LEU  90   8.616   9.360   4.231
    5    HG   LEU  90           HG       LEU  90   9.034   8.491   1.359
    6   HD12  LEU  90          HD11      LEU  90   6.497   8.184   1.413
    7   HD11  LEU  90          HD12      LEU  90   6.647   8.163   3.170
    8   HD13  LEU  90          HD13      LEU  90   7.458   6.932   2.201
    9   HD22  LEU  90          HD21      LEU  90   8.760  10.802   1.296
   10   HD21  LEU  90          HD22      LEU  90   7.770  10.835   2.754
   11   HD23  LEU  90          HD23      LEU  90   7.072  10.294   1.228

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  91           H        ILE  91  11.688   7.628   4.703
    2    HA   ILE  91           HA       ILE  91  11.833   8.979   7.179
    3    HB   ILE  91           HB       ILE  91  13.370   6.633   6.047
    4   HG12  ILE  91          HG12      ILE  91  11.349   6.806   8.302
    5   HG13  ILE  91          HG13      ILE  91  10.881   6.538   6.624
    6   HG22  ILE  91          HG21      ILE  91  13.831   6.402   8.688
    7   HG21  ILE  91          HG22      ILE  91  13.771   8.162   8.596
    8   HG23  ILE  91          HG23      ILE  91  14.944   7.269   7.630
    9   HD13  ILE  91          HD11      ILE  91  11.866   4.428   6.546
   10   HD12  ILE  91          HD12      ILE  91  11.269   4.483   8.204
   11   HD11  ILE  91          HD13      ILE  91  12.974   4.783   7.872

  No H/Q in entry =          11
  In of MODEL   44
    1    H    THR  92           H        THR  92  14.056   8.805   4.432
    2    HA   THR  92           HA       THR  92  16.230  10.174   5.604
    3    HB   THR  92           HB       THR  92  15.251  10.072   2.740
    4    HG1  THR  92           HG1      THR  92  16.065   8.165   3.138
    5   HG22  THR  92          HG21      THR  92  17.827  10.741   2.457
    6   HG21  THR  92          HG22      THR  92  17.522  11.557   3.990
    7   HG23  THR  92          HG23      THR  92  16.559  11.960   2.569

  No H/Q in entry =           7
  In of MODEL   44
    1    H    GLU  93           H        GLU  93  13.358  11.361   3.874
    2    HA   GLU  93           HA       GLU  93  13.975  14.116   4.003
    3    HB2  GLU  93           HB2      GLU  93  11.260  12.766   4.003
    4    HB3  GLU  93           HB3      GLU  93  11.563  14.465   3.641
    5    HG2  GLU  93           HG2      GLU  93  12.886  12.219   2.105
    6    HG3  GLU  93           HG3      GLU  93  11.346  12.917   1.618

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LEU  94           H        LEU  94  12.209  11.963   6.199
    2    HA   LEU  94           HA       LEU  94  11.411  13.907   8.083
    3    HB2  LEU  94           HB2      LEU  94  11.961  10.945   8.344
    4    HB3  LEU  94           HB3      LEU  94  11.394  11.919   9.697
    5    HG   LEU  94           HG       LEU  94   9.918  11.997   7.065
    6   HD11  LEU  94          HD11      LEU  94   9.976   9.765   9.058
    7   HD13  LEU  94          HD12      LEU  94   9.679   9.715   7.322
    8   HD12  LEU  94          HD13      LEU  94   8.402  10.237   8.420
    9   HD23  LEU  94          HD21      LEU  94   7.997  12.405   8.663
   10   HD22  LEU  94          HD22      LEU  94   9.247  13.648   8.709
   11   HD21  LEU  94          HD23      LEU  94   9.171  12.425   9.977

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  95           H        ILE  95  14.369  11.953   7.844
    2    HA   ILE  95           HA       ILE  95  15.539  12.853  10.265
    3    HB   ILE  95           HB       ILE  95  16.774  11.786   7.715
    4   HG12  ILE  95          HG12      ILE  95  16.462  10.574  10.475
    5   HG13  ILE  95          HG13      ILE  95  15.296  10.332   9.176
    6   HG21  ILE  95          HG21      ILE  95  18.030  12.569  10.364
    7   HG23  ILE  95          HG22      ILE  95  18.501  13.101   8.748
    8   HG22  ILE  95          HG23      ILE  95  18.792  11.436   9.249
    9   HD13  ILE  95          HD11      ILE  95  16.768   9.047   7.910
   10   HD12  ILE  95          HD12      ILE  95  17.233   8.586   9.545
   11   HD11  ILE  95          HD13      ILE  95  18.199   9.762   8.654

  No H/Q in entry =          11
  In of MODEL   44
    1    H    GLU  96           H        GLU  96  15.712  14.102   6.937
    2    HA   GLU  96           HA       GLU  96  17.575  16.162   7.429
    3    HB2  GLU  96           HB2      GLU  96  16.910  15.517   5.165
    4    HB3  GLU  96           HB3      GLU  96  15.271  16.087   5.464
    5    HG2  GLU  96           HG2      GLU  96  15.857  18.214   4.935
    6    HG3  GLU  96           HG3      GLU  96  17.153  18.197   6.120

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LEU  97           H        LEU  97  14.061  16.003   7.850
    2    HA   LEU  97           HA       LEU  97  13.667  18.737   8.505
    3    HB2  LEU  97           HB2      LEU  97  12.125  16.221   9.102
    4    HB3  LEU  97           HB3      LEU  97  11.624  17.769   9.780
    5    HG   LEU  97           HG       LEU  97  12.110  17.364   6.814
    6   HD12  LEU  97          HD11      LEU  97   9.586  17.259   6.690
    7   HD11  LEU  97          HD12      LEU  97   9.574  17.050   8.439
    8   HD13  LEU  97          HD13      LEU  97  10.347  15.841   7.413
    9   HD23  LEU  97          HD21      LEU  97  10.389  19.343   6.853
   10   HD22  LEU  97          HD22      LEU  97  12.073  19.686   7.251
   11   HD21  LEU  97          HD23      LEU  97  10.879  19.519   8.538

  No H/Q in entry =          11
  In of MODEL   44
    1    H    HIS  98           H        HIS  98  14.459  15.894  10.487
    2    HA   HIS  98           HA       HIS  98  14.307  17.143  13.010
    3    HB2  HIS  98           HB2      HIS  98  16.039  14.876  12.000
    4    HB3  HIS  98           HB3      HIS  98  16.039  15.406  13.684
    5    HD1  HIS  98           HD1      HIS  98  13.831  13.808  11.079
    6    HD2  HIS  98           HD2      HIS  98  13.723  14.708  15.148
    7    HE1  HIS  98           HE1      HIS  98  11.794  12.627  12.020
    8    HE2  HIS  98           HE2      HIS  98  11.708  13.166  14.494

  No H/Q in entry =           8
  In of MODEL   44
    1    H    GLU  99           H        GLU  99  16.864  17.018  10.580
    2    HA   GLU  99           HA       GLU  99  18.858  18.324  12.120
    3    HB2  GLU  99           HB2      GLU  99  19.331  17.043  10.045
    4    HB3  GLU  99           HB3      GLU  99  18.534  18.310   9.109
    5    HG2  GLU  99           HG2      GLU  99  20.155  19.962   9.912
    6    HG3  GLU  99           HG3      GLU  99  20.921  18.748  10.931

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LYS 100           H        LYS 100  16.350  19.520   9.904
    2    HA   LYS 100           HA       LYS 100  17.171  22.250  10.064
    3    HB2  LYS 100           HB2      LYS 100  14.529  20.988   9.297
    4    HB3  LYS 100           HB3      LYS 100  14.844  22.724   9.216
    5    HG2  LYS 100           HG2      LYS 100  16.815  22.266   7.752
    6    HG3  LYS 100           HG3      LYS 100  16.386  20.552   7.760
    7    HD2  LYS 100           HD2      LYS 100  14.198  21.087   6.757
    8    HD3  LYS 100           HD3      LYS 100  14.610  22.802   6.757
    9    HE2  LYS 100           HE2      LYS 100  16.568  22.312   5.299
   10    HE3  LYS 100           HE3      LYS 100  16.087  20.611   5.255
   11    HZ1  LYS 100           HZ1      LYS 100  14.284  22.825   4.428
   12    HZ3  LYS 100           HZ2      LYS 100  14.085  21.159   4.157
   13    HZ2  LYS 100           HZ3      LYS 100  15.305  22.014   3.343

  No H/Q in entry =          13
  In of MODEL   44
    1    H    LEU 101           H        LEU 101  15.051  20.213  12.014
    2    HA   LEU 101           HA       LEU 101  13.900  22.283  13.601
    3    HB2  LEU 101           HB2      LEU 101  14.314  19.327  13.970
    4    HB3  LEU 101           HB3      LEU 101  13.784  20.305  15.335
    5    HG   LEU 101           HG       LEU 101  12.373  20.421  12.664
    6   HD12  LEU 101          HD11      LEU 101  10.697  18.866  13.921
    7   HD11  LEU 101          HD12      LEU 101  12.085  18.435  14.916
    8   HD13  LEU 101          HD13      LEU 101  12.120  18.137  13.178
    9   HD21  LEU 101          HD21      LEU 101  11.717  21.205  15.519
   10   HD23  LEU 101          HD22      LEU 101  10.457  20.997  14.304
   11   HD22  LEU 101          HD23      LEU 101  11.704  22.222  14.076

  No H/Q in entry =          11
  In of MODEL   44
    1    H    LYS 102           H        LYS 102  17.043  21.648  13.168
    2    HA   LYS 102           HA       LYS 102  18.895  22.496  14.249
    3    HB2  LYS 102           HB2      LYS 102  17.093  24.022  15.386
    4    HB3  LYS 102           HB3      LYS 102  17.287  22.950  16.758
    5    HG2  LYS 102           HG2      LYS 102  19.201  24.950  15.603
    6    HG3  LYS 102           HG3      LYS 102  18.813  24.630  17.280
    7    HD2  LYS 102           HD2      LYS 102  20.465  22.711  15.587
    8    HD3  LYS 102           HD3      LYS 102  21.165  24.022  16.529
    9    HE2  LYS 102           HE2      LYS 102  20.741  21.472  17.483
   10    HE3  LYS 102           HE3      LYS 102  20.971  22.906  18.482
   11    HZ2  LYS 102           HZ1      LYS 102  18.989  21.637  19.089
   12    HZ1  LYS 102           HZ2      LYS 102  18.350  21.882  17.540
   13    HZ3  LYS 102           HZ3      LYS 102  18.591  23.204  18.574

  No H/Q in entry =          13
  In of MODEL   44
    1    H    ALA 103           H        ALA 103  16.803  20.898  16.658
    2    HA   ALA 103           HA       ALA 103  18.515  19.662  18.310
    3    HB2  ALA 103           HB1      ALA 103  16.912  17.669  18.290
    4    HB1  ALA 103           HB2      ALA 103  16.027  18.538  17.035
    5    HB3  ALA 103           HB3      ALA 103  16.209  19.249  18.638

  No H/Q in entry =           5
  In of MODEL   44
    1    H1   ALA   1           H3       ALA   1  -1.584  -6.790 -21.495
    2    H2   ALA   1           H2       ALA   1  -2.393  -8.220 -21.051
    3    H3   ALA   1           H1       ALA   1  -0.785  -8.282 -21.603
    4    HA   ALA   1           HA       ALA   1  -1.619  -8.733 -23.603
    5    HB1  ALA   1           HB1      ALA   1  -3.764  -9.432 -23.138
    6    HB2  ALA   1           HB2      ALA   1  -4.186  -7.913 -23.929
    7    HB3  ALA   1           HB3      ALA   1  -4.130  -8.003 -22.170

  No H/Q in entry =           7
  In of MODEL   44
    1    H    GLU   2           H        GLU   2  -2.433  -7.523 -25.588
    2    HA   GLU   2           HA       GLU   2  -1.012  -5.519 -26.452
    3    HB2  GLU   2           HB2      GLU   2  -4.019  -5.554 -26.776
    4    HB3  GLU   2           HB3      GLU   2  -2.887  -4.697 -27.819
    5    HG2  GLU   2           HG2      GLU   2  -2.400  -6.585 -28.983
    6    HG3  GLU   2           HG3      GLU   2  -2.115  -7.502 -27.509

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLU   3           H        GLU   3  -4.162  -4.235 -25.552
    2    HA   GLU   3           HA       GLU   3  -3.091  -1.693 -24.907
    3    HB2  GLU   3           HB2      GLU   3  -5.793  -2.983 -24.588
    4    HB3  GLU   3           HB3      GLU   3  -5.480  -1.374 -23.932
    5    HG2  GLU   3           HG2      GLU   3  -5.110  -0.439 -26.052
    6    HG3  GLU   3           HG3      GLU   3  -4.729  -1.994 -26.785

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LEU   4           H        LEU   4  -4.710  -4.048 -22.744
    2    HA   LEU   4           HA       LEU   4  -4.339  -2.837 -20.345
    3    HB2  LEU   4           HB2      LEU   4  -3.824  -5.781 -20.830
    4    HB3  LEU   4           HB3      LEU   4  -4.226  -5.039 -19.283
    5    HG   LEU   4           HG       LEU   4  -5.994  -5.081 -21.751
    6   HD13  LEU   4          HD11      LEU   4  -7.207  -6.792 -20.766
    7   HD12  LEU   4          HD12      LEU   4  -6.721  -6.347 -19.131
    8   HD11  LEU   4          HD13      LEU   4  -5.591  -7.195 -20.184
    9   HD23  LEU   4          HD21      LEU   4  -7.675  -4.264 -19.883
   10   HD22  LEU   4          HD22      LEU   4  -6.623  -3.098 -20.685
   11   HD21  LEU   4          HD23      LEU   4  -6.206  -3.702 -19.081

  No H/Q in entry =          11
  In of MODEL   44
    1    H    GLU   5           H        GLU   5  -1.856  -4.695 -22.081
    2    HA   GLU   5           HA       GLU   5   0.126  -4.443 -20.038
    3    HB2  GLU   5           HB2      GLU   5   0.176  -6.204 -21.800
    4    HB3  GLU   5           HB3      GLU   5   0.508  -4.954 -23.002
    5    HG2  GLU   5           HG2      GLU   5   2.576  -4.347 -21.831
    6    HG3  GLU   5           HG3      GLU   5   2.241  -5.547 -20.584

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLU   6           H        GLU   6  -0.485  -2.706 -23.074
    2    HA   GLU   6           HA       GLU   6   1.703  -0.898 -22.791
    3    HB2  GLU   6           HB2      GLU   6   0.517  -1.391 -24.948
    4    HB3  GLU   6           HB3      GLU   6  -0.866  -0.481 -24.337
    5    HG2  GLU   6           HG2      GLU   6   0.349   1.106 -25.598
    6    HG3  GLU   6           HG3      GLU   6   0.820   1.435 -23.932

  No H/Q in entry =           6
  In of MODEL   44
    1    H    VAL   7           H        VAL   7  -1.639  -0.941 -21.754
    2    HA   VAL   7           HA       VAL   7  -1.835   1.769 -20.903
    3    HB   VAL   7           HB       VAL   7  -3.324  -0.739 -20.085
    4   HG11  VAL   7          HG11      VAL   7  -3.672   2.149 -19.255
    5   HG13  VAL   7          HG12      VAL   7  -3.589   0.718 -18.228
    6   HG12  VAL   7          HG13      VAL   7  -5.016   1.007 -19.222
    7   HG21  VAL   7          HG21      VAL   7  -3.465   0.352 -22.467
    8   HG23  VAL   7          HG22      VAL   7  -4.399   1.606 -21.650
    9   HG22  VAL   7          HG23      VAL   7  -4.962  -0.066 -21.634

  No H/Q in entry =           9
  In of MODEL   44
    1    H    VAL   8           H        VAL   8  -0.881  -1.235 -19.275
    2    HA   VAL   8           HA       VAL   8  -0.558  -0.174 -16.672
    3    HB   VAL   8           HB       VAL   8   0.815  -2.499 -18.043
    4   HG12  VAL   8          HG11      VAL   8   1.156  -3.143 -15.526
    5   HG11  VAL   8          HG12      VAL   8   0.975  -1.412 -15.240
    6   HG13  VAL   8          HG13      VAL   8   2.273  -2.004 -16.276
    7   HG21  VAL   8          HG21      VAL   8  -1.832  -2.256 -17.322
    8   HG23  VAL   8          HG22      VAL   8  -1.138  -2.904 -15.840
    9   HG22  VAL   8          HG23      VAL   8  -0.969  -3.793 -17.349

  No H/Q in entry =           9
  In of MODEL   44
    1    H    MET   9           H        MET   9   1.694  -0.482 -19.416
    2    HA   MET   9           HA       MET   9   3.988   0.530 -18.144
    3    HB2  MET   9           HB2      MET   9   3.039   0.523 -21.001
    4    HB3  MET   9           HB3      MET   9   4.523   1.364 -20.551
    5    HG2  MET   9           HG2      MET   9   5.199  -0.834 -19.381
    6    HG3  MET   9           HG3      MET   9   3.891  -1.579 -20.302
    7    HE3  MET   9           HE1      MET   9   4.837  -1.615 -23.845
    8    HE2  MET   9           HE2      MET   9   3.844  -0.314 -23.192
    9    HE1  MET   9           HE3      MET   9   3.693  -1.942 -22.538

  No H/Q in entry =           9
  In of MODEL   44
    1    H    GLY  10           H        GLY  10   1.325   2.170 -19.818
    2    HA3  GLY  10           HA2      GLY  10   2.316   4.812 -19.557
    3    HA2  GLY  10           HA3      GLY  10   0.622   4.371 -19.768

  No H/Q in entry =           3
  In of MODEL   44
    1    H    LEU  11           H        LEU  11   0.201   2.835 -17.491
    2    HA   LEU  11           HA       LEU  11  -0.311   4.807 -15.521
    3    HB2  LEU  11           HB2      LEU  11  -0.277   1.790 -15.382
    4    HB3  LEU  11           HB3      LEU  11  -0.778   2.811 -14.035
    5    HG   LEU  11           HG       LEU  11  -2.010   2.954 -16.800
    6   HD13  LEU  11          HD11      LEU  11  -2.619   0.813 -16.058
    7   HD12  LEU  11          HD12      LEU  11  -3.959   1.817 -15.510
    8   HD11  LEU  11          HD13      LEU  11  -2.711   1.316 -14.370
    9   HD22  LEU  11          HD21      LEU  11  -2.580   4.970 -15.783
   10   HD21  LEU  11          HD22      LEU  11  -2.515   4.294 -14.156
   11   HD23  LEU  11          HD23      LEU  11  -3.893   3.949 -15.202

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  12           H        ILE  12   2.205   2.314 -15.773
    2    HA   ILE  12           HA       ILE  12   3.411   2.823 -13.264
    3    HB   ILE  12           HB       ILE  12   4.658   1.784 -15.832
    4   HG12  ILE  12          HG12      ILE  12   2.631   0.567 -14.701
    5   HG13  ILE  12          HG13      ILE  12   4.024  -0.382 -15.179
    6   HG22  ILE  12          HG21      ILE  12   6.267   0.686 -14.156
    7   HG21  ILE  12          HG22      ILE  12   5.639   1.828 -12.966
    8   HG23  ILE  12          HG23      ILE  12   6.459   2.419 -14.411
    9   HD13  ILE  12          HD11      ILE  12   4.832  -0.395 -12.892
   10   HD12  ILE  12          HD12      ILE  12   3.149  -0.921 -12.898
   11   HD11  ILE  12          HD13      ILE  12   3.557   0.707 -12.401

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  13           H        ILE  13   4.033   4.098 -16.513
    2    HA   ILE  13           HA       ILE  13   6.188   5.790 -15.775
    3    HB   ILE  13           HB       ILE  13   4.161   5.910 -18.023
    4   HG12  ILE  13          HG12      ILE  13   5.917   4.023 -17.797
    5   HG13  ILE  13          HG13      ILE  13   5.786   4.847 -19.347
    6   HG23  ILE  13          HG21      ILE  13   4.818   8.130 -18.023
    7   HG22  ILE  13          HG22      ILE  13   6.087   7.442 -19.030
    8   HG21  ILE  13          HG23      ILE  13   6.404   7.784 -17.331
    9   HD11  ILE  13          HD11      ILE  13   7.709   6.053 -17.421
   10   HD13  ILE  13          HD12      ILE  13   7.849   5.806 -19.158
   11   HD12  ILE  13          HD13      ILE  13   8.142   4.467 -18.056

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ASN  14           H        ASN  14   2.688   6.326 -16.045
    2    HA   ASN  14           HA       ASN  14   2.675   9.068 -15.393
    3    HB2  ASN  14           HB2      ASN  14   0.765   7.453 -16.236
    4    HB3  ASN  14           HB3      ASN  14   0.439   7.268 -14.517
    5   HD21  ASN  14          HD21      ASN  14  -1.565   8.456 -15.946
    6   HD22  ASN  14          HD22      ASN  14  -1.609  10.128 -15.669

  No H/Q in entry =           6
  In of MODEL   44
    1    H    SER  15           H        SER  15   2.344   6.183 -13.333
    2    HA   SER  15           HA       SER  15   2.049   7.543 -10.877
    3    HB2  SER  15           HB2      SER  15   2.572   5.445  -9.839
    4    HB3  SER  15           HB3      SER  15   1.742   5.043 -11.338
    5    HG   SER  15           HG       SER  15   4.557   5.207 -11.039

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLY  16           H        GLY  16   4.915   6.424 -12.638
    2    HA3  GLY  16           HA2      GLY  16   6.846   7.149 -10.700
    3    HA2  GLY  16           HA3      GLY  16   7.149   6.953 -12.425

  No H/Q in entry =           3
  In of MODEL   44
    1    H    GLN  17           H        GLN  17   5.483   8.935 -13.479
    2    HA   GLN  17           HA       GLN  17   7.084  11.257 -13.155
    3    HB2  GLN  17           HB2      GLN  17   5.751  10.790 -15.199
    4    HB3  GLN  17           HB3      GLN  17   4.272  11.049 -14.273
    5    HG2  GLN  17           HG2      GLN  17   4.821  13.098 -15.466
    6    HG3  GLN  17           HG3      GLN  17   5.058  13.357 -13.738
    7   HE21  GLN  17          HE21      GLN  17   6.759  14.912 -13.838
    8   HE22  GLN  17          HE22      GLN  17   8.273  14.580 -14.529

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ALA  18           H        ALA  18   3.971  10.264 -11.817
    2    HA   ALA  18           HA       ALA  18   3.269  12.653 -10.538
    3    HB1  ALA  18           HB1      ALA  18   2.115  10.210 -10.776
    4    HB2  ALA  18           HB2      ALA  18   1.577  11.429  -9.623
    5    HB3  ALA  18           HB3      ALA  18   2.653  10.132  -9.099

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ARG  19           H        ARG  19   5.113   9.864  -9.272
    2    HA   ARG  19           HA       ARG  19   5.653  11.002  -6.743
    3    HB2  ARG  19           HB2      ARG  19   6.044   8.598  -7.283
    4    HB3  ARG  19           HB3      ARG  19   7.406   9.077  -8.299
    5    HG2  ARG  19           HG2      ARG  19   8.533  10.095  -6.369
    6    HG3  ARG  19           HG3      ARG  19   7.151   9.714  -5.342
    7    HD2  ARG  19           HD2      ARG  19   8.897   8.060  -4.990
    8    HD3  ARG  19           HD3      ARG  19   7.516   7.296  -5.783
    9    HE   ARG  19           HE       ARG  19   9.232   8.109  -7.822
   10   HH21  ARG  19          HH11      ARG  19  10.780   6.694  -8.678
   11   HH22  ARG  19          HH12      ARG  19  11.311   5.335  -7.750
   12   HH11  ARG  19          HH21      ARG  19   9.280   6.063  -5.056
   13   HH12  ARG  19          HH22      ARG  19  10.458   4.978  -5.697

  No H/Q in entry =          13
  In of MODEL   44
    1    H    SER  20           H        SER  20   7.475  11.032  -9.788
    2    HA   SER  20           HA       SER  20   9.732  12.421  -8.953
    3    HB2  SER  20           HB2      SER  20   9.760  11.558 -11.162
    4    HB3  SER  20           HB3      SER  20   8.268  12.391 -11.587
    5    HG   SER  20           HG       SER  20   9.633  14.351 -10.997

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU  21           H        LEU  21   6.647  13.726 -10.148
    2    HA   LEU  21           HA       LEU  21   7.342  16.464  -9.907
    3    HB2  LEU  21           HB2      LEU  21   4.663  15.061  -9.844
    4    HB3  LEU  21           HB3      LEU  21   4.841  16.813  -9.828
    5    HG   LEU  21           HG       LEU  21   6.034  15.036 -11.977
    6   HD12  LEU  21          HD11      LEU  21   3.493  16.684 -12.136
    7   HD11  LEU  21          HD12      LEU  21   3.516  14.941 -11.862
    8   HD13  LEU  21          HD13      LEU  21   4.144  15.604 -13.369
    9   HD21  LEU  21          HD21      LEU  21   5.806  18.006 -11.524
   10   HD23  LEU  21          HD22      LEU  21   5.816  17.404 -13.178
   11   HD22  LEU  21          HD23      LEU  21   7.184  17.089 -12.124

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ALA  22           H        ALA  22   5.806  14.175  -7.674
    2    HA   ALA  22           HA       ALA  22   5.215  15.977  -5.598
    3    HB3  ALA  22           HB1      ALA  22   4.434  13.592  -5.776
    4    HB2  ALA  22           HB2      ALA  22   5.024  14.050  -4.177
    5    HB1  ALA  22           HB3      ALA  22   6.040  13.089  -5.252

  No H/Q in entry =           5
  In of MODEL   44
    1    H    TYR  23           H        TYR  23   8.133  13.929  -6.043
    2    HA   TYR  23           HA       TYR  23   9.520  14.923  -3.783
    3    HB2  TYR  23           HB2      TYR  23  10.293  12.916  -4.950
    4    HB3  TYR  23           HB3      TYR  23  10.616  13.859  -6.404
    5    HD1  TYR  23           HD1      TYR  23  11.569  13.505  -2.811
    6    HD2  TYR  23           HD2      TYR  23  12.664  15.006  -6.684
    7    HE1  TYR  23           HE1      TYR  23  13.830  14.059  -1.957
    8    HE2  TYR  23           HE2      TYR  23  14.925  15.561  -5.829
    9    HH   TYR  23           HH       TYR  23  16.087  14.416  -2.829

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ALA  24           H        ALA  24   9.352  16.051  -7.143
    2    HA   ALA  24           HA       ALA  24  11.264  18.119  -6.882
    3    HB2  ALA  24           HB1      ALA  24  10.825  18.197  -9.091
    4    HB3  ALA  24           HB2      ALA  24   9.276  18.957  -8.730
    5    HB1  ALA  24           HB3      ALA  24   9.387  17.204  -8.870

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA  25           H        ALA  25   7.783  17.958  -6.267
    2    HA   ALA  25           HA       ALA  25   7.322  20.677  -5.684
    3    HB1  ALA  25           HB1      ALA  25   5.646  18.692  -5.899
    4    HB2  ALA  25           HB2      ALA  25   5.286  19.977  -4.744
    5    HB3  ALA  25           HB3      ALA  25   5.964  18.447  -4.180

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU  26           H        LEU  26   8.368  17.978  -3.647
    2    HA   LEU  26           HA       LEU  26   8.479  19.395  -1.202
    3    HB2  LEU  26           HB2      LEU  26   8.557  16.978  -1.210
    4    HB3  LEU  26           HB3      LEU  26  10.029  16.980  -2.178
    5    HG   LEU  26           HG       LEU  26  11.249  18.080  -0.330
    6   HD12  LEU  26          HD11      LEU  26  10.019  18.083   1.928
    7   HD11  LEU  26          HD12      LEU  26   8.532  17.961   0.990
    8   HD13  LEU  26          HD13      LEU  26   9.586  19.361   0.791
    9   HD21  LEU  26          HD21      LEU  26   9.696  15.618   0.527
   10   HD23  LEU  26          HD22      LEU  26  11.215  16.166   1.230
   11   HD22  LEU  26          HD23      LEU  26  11.168  15.616  -0.443

  No H/Q in entry =          11
  In of MODEL   44
    1    H    LYS  27           H        LYS  27  10.896  18.819  -3.726
    2    HA   LYS  27           HA       LYS  27  13.086  20.039  -2.488
    3    HB2  LYS  27           HB2      LYS  27  13.182  18.702  -4.585
    4    HB3  LYS  27           HB3      LYS  27  12.427  20.044  -5.445
    5    HG2  LYS  27           HG2      LYS  27  14.301  21.514  -4.856
    6    HG3  LYS  27           HG3      LYS  27  15.051  20.212  -3.925
    7    HD2  LYS  27           HD2      LYS  27  15.189  18.835  -5.987
    8    HD3  LYS  27           HD3      LYS  27  14.484  20.162  -6.909
    9    HE2  LYS  27           HE2      LYS  27  16.380  21.613  -6.285
   10    HE3  LYS  27           HE3      LYS  27  17.089  20.289  -5.354
   11    HZ3  LYS  27           HZ1      LYS  27  18.083  20.394  -7.538
   12    HZ2  LYS  27           HZ2      LYS  27  16.557  20.290  -8.282
   13    HZ1  LYS  27           HZ3      LYS  27  17.170  18.971  -7.404

  No H/Q in entry =          13
  In of MODEL   44
    1    H    GLN  28           H        GLN  28  10.475  21.448  -4.433
    2    HA   GLN  28           HA       GLN  28  11.451  24.095  -4.571
    3    HB2  GLN  28           HB2      GLN  28   8.616  23.030  -4.478
    4    HB3  GLN  28           HB3      GLN  28   9.027  24.710  -4.822
    5    HG2  GLN  28           HG2      GLN  28  10.045  22.334  -6.405
    6    HG3  GLN  28           HG3      GLN  28   8.694  23.355  -6.893
    7   HE21  GLN  28          HE21      GLN  28   9.676  25.916  -6.228
    8   HE22  GLN  28          HE22      GLN  28  11.054  26.247  -7.162

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ALA  29           H        ALA  29   9.506  22.402  -2.146
    2    HA   ALA  29           HA       ALA  29   8.967  24.588  -0.454
    3    HB2  ALA  29           HB1      ALA  29   8.226  23.015   1.105
    4    HB1  ALA  29           HB2      ALA  29   9.441  21.826   0.635
    5    HB3  ALA  29           HB3      ALA  29   8.058  22.134  -0.413

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LYS  30           H        LYS  30  11.684  22.305  -0.531
    2    HA   LYS  30           HA       LYS  30  13.004  23.239   1.778
    3    HB2  LYS  30           HB2      LYS  30  14.096  21.960  -0.737
    4    HB3  LYS  30           HB3      LYS  30  15.079  22.305   0.688
    5    HG2  LYS  30           HG2      LYS  30  13.516  20.924   2.058
    6    HG3  LYS  30           HG3      LYS  30  12.630  20.516   0.584
    7    HD2  LYS  30           HD2      LYS  30  14.671  19.522  -0.379
    8    HD3  LYS  30           HD3      LYS  30  15.575  19.945   1.076
    9    HE2  LYS  30           HE2      LYS  30  14.060  18.515   2.421
   10    HE3  LYS  30           HE3      LYS  30  13.185  18.073   0.949
   11    HZ2  LYS  30           HZ1      LYS  30  14.967  16.480   1.704
   12    HZ1  LYS  30           HZ2      LYS  30  16.111  17.663   1.261
   13    HZ3  LYS  30           HZ3      LYS  30  15.073  16.991   0.091

  No H/Q in entry =          13
  In of MODEL   44
    1    H    GLN  31           H        GLN  31  12.907  24.462  -1.512
    2    HA   GLN  31           HA       GLN  31  15.070  26.340  -1.077
    3    HB2  GLN  31           HB2      GLN  31  13.030  26.411  -3.304
    4    HB3  GLN  31           HB3      GLN  31  14.654  27.097  -3.299
    5    HG2  GLN  31           HG2      GLN  31  15.100  24.395  -2.738
    6    HG3  GLN  31           HG3      GLN  31  13.797  24.355  -3.918
    7   HE21  GLN  31          HE21      GLN  31  16.637  23.548  -4.323
    8   HE22  GLN  31          HE22      GLN  31  17.216  24.524  -5.583

  No H/Q in entry =           8
  In of MODEL   44
    1    H    GLY  32           H        GLY  32  11.993  26.169   0.063
    2    HA3  GLY  32           HA2      GLY  32  10.844  27.737   1.343
    3    HA2  GLY  32           HA3      GLY  32  11.977  28.969   0.801

  No H/Q in entry =           3
  In of MODEL   44
    1    H    ASP  33           H        ASP  33  10.605  27.086  -1.703
    2    HA   ASP  33           HA       ASP  33   8.955  29.373  -2.549
    3    HB2  ASP  33           HB2      ASP  33  10.037  26.956  -4.003
    4    HB3  ASP  33           HB3      ASP  33   8.893  28.082  -4.729

  No H/Q in entry =           4
  In of MODEL   44
    1    H    PHE  34           H        PHE  34   7.262  28.899  -0.990
    2    HA   PHE  34           HA       PHE  34   5.868  26.434  -0.910
    3    HB2  PHE  34           HB2      PHE  34   4.922  29.223  -0.216
    4    HB3  PHE  34           HB3      PHE  34   4.064  27.735   0.186
    5    HD1  PHE  34           HD1      PHE  34   6.326  30.114   1.416
    6    HD2  PHE  34           HD2      PHE  34   5.622  25.878   1.339
    7    HE1  PHE  34           HE1      PHE  34   7.713  29.845   3.454
    8    HE2  PHE  34           HE2      PHE  34   7.010  25.612   3.374
    9    HZ   PHE  34           HZ       PHE  34   8.050  27.597   4.431

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ALA  35           H        ALA  35   5.457  29.311  -2.906
    2    HA   ALA  35           HA       ALA  35   2.903  28.717  -3.937
    3    HB1  ALA  35           HB1      ALA  35   3.966  30.114  -5.966
    4    HB3  ALA  35           HB2      ALA  35   5.184  30.462  -4.739
    5    HB2  ALA  35           HB3      ALA  35   3.495  30.879  -4.448

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA  36           H        ALA  36   6.130  28.033  -5.291
    2    HA   ALA  36           HA       ALA  36   5.136  26.621  -7.543
    3    HB3  ALA  36           HB1      ALA  36   7.297  26.737  -8.156
    4    HB2  ALA  36           HB2      ALA  36   7.770  25.698  -6.810
    5    HB1  ALA  36           HB3      ALA  36   7.674  27.445  -6.586

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA  37           H        ALA  37   6.082  25.604  -4.293
    2    HA   ALA  37           HA       ALA  37   6.008  22.818  -4.737
    3    HB2  ALA  37           HB1      ALA  37   5.754  24.598  -2.349
    4    HB1  ALA  37           HB2      ALA  37   6.880  23.276  -2.647
    5    HB3  ALA  37           HB3      ALA  37   5.216  22.929  -2.180

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LYS  38           H        LYS  38   3.486  25.034  -3.560
    2    HA   LYS  38           HA       LYS  38   1.377  23.232  -3.350
    3    HB2  LYS  38           HB2      LYS  38   1.743  25.984  -3.084
    4    HB3  LYS  38           HB3      LYS  38   0.545  25.851  -4.365
    5    HG2  LYS  38           HG2      LYS  38  -0.914  24.528  -2.932
    6    HG3  LYS  38           HG3      LYS  38   0.328  24.454  -1.674
    7    HD2  LYS  38           HD2      LYS  38   0.154  26.789  -1.214
    8    HD3  LYS  38           HD3      LYS  38  -0.754  27.091  -2.696
    9    HE2  LYS  38           HE2      LYS  38  -2.260  27.123  -0.759
   10    HE3  LYS  38           HE3      LYS  38  -2.640  25.755  -1.809
   11    HZ3  LYS  38           HZ1      LYS  38  -1.925  24.271  -0.283
   12    HZ2  LYS  38           HZ2      LYS  38  -2.270  25.525   0.813
   13    HZ1  LYS  38           HZ3      LYS  38  -0.676  25.268   0.288

  No H/Q in entry =          13
  In of MODEL   44
    1    H    ALA  39           H        ALA  39   2.371  25.144  -6.188
    2    HA   ALA  39           HA       ALA  39   0.292  24.297  -7.898
    3    HB2  ALA  39           HB1      ALA  39   3.034  24.936  -8.944
    4    HB1  ALA  39           HB2      ALA  39   2.073  26.198  -8.174
    5    HB3  ALA  39           HB3      ALA  39   1.458  25.372  -9.605

  No H/Q in entry =           5
  In of MODEL   44
    1    H    MET  40           H        MET  40   3.522  22.978  -7.321
    2    HA   MET  40           HA       MET  40   3.416  20.969  -9.323
    3    HB2  MET  40           HB2      MET  40   5.026  21.170  -6.772
    4    HB3  MET  40           HB3      MET  40   5.271  19.919  -7.992
    5    HG2  MET  40           HG2      MET  40   5.346  22.878  -8.642
    6    HG3  MET  40           HG3      MET  40   6.786  21.965  -8.195
    7    HE3  MET  40           HE1      MET  40   7.651  19.761 -11.015
    8    HE2  MET  40           HE2      MET  40   7.083  19.435  -9.380
    9    HE1  MET  40           HE3      MET  40   8.186  20.778  -9.671

  No H/Q in entry =           9
  In of MODEL   44
    1    H    MET  41           H        MET  41   2.497  20.997  -5.901
    2    HA   MET  41           HA       MET  41   1.949  18.234  -5.638
    3    HB2  MET  41           HB2      MET  41   0.627  20.591  -4.276
    4    HB3  MET  41           HB3      MET  41   0.462  18.912  -3.778
    5    HG2  MET  41           HG2      MET  41   3.174  19.121  -3.810
    6    HG3  MET  41           HG3      MET  41   2.741  20.779  -3.406
    7    HE2  MET  41           HE1      MET  41  -0.307  19.533  -1.691
    8    HE1  MET  41           HE2      MET  41   0.518  21.044  -2.059
    9    HE3  MET  41           HE3      MET  41   0.454  20.465  -0.395

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ASP  42           H        ASP  42  -0.073  20.975  -6.600
    2    HA   ASP  42           HA       ASP  42  -2.521  19.627  -6.748
    3    HB2  ASP  42           HB2      ASP  42  -1.801  22.195  -6.989
    4    HB3  ASP  42           HB3      ASP  42  -1.951  21.810  -8.700

  No H/Q in entry =           4
  In of MODEL   44
    1    H    GLN  43           H        GLN  43  -0.074  20.219  -9.243
    2    HA   GLN  43           HA       GLN  43  -1.464  18.918 -11.341
    3    HB2  GLN  43           HB2      GLN  43   1.496  19.417 -10.953
    4    HB3  GLN  43           HB3      GLN  43   0.781  18.789 -12.440
    5    HG2  GLN  43           HG2      GLN  43  -0.720  20.824 -12.472
    6    HG3  GLN  43           HG3      GLN  43   0.234  21.468 -11.139
    7   HE21  GLN  43          HE21      GLN  43   0.406  23.099 -13.217
    8   HE22  GLN  43          HE22      GLN  43   1.821  22.875 -14.123

  No H/Q in entry =           8
  In of MODEL   44
    1    H    SER  44           H        SER  44   0.877  17.753  -8.954
    2    HA   SER  44           HA       SER  44   1.201  15.151  -9.992
    3    HB2  SER  44           HB2      SER  44   2.100  16.573  -7.747
    4    HB3  SER  44           HB3      SER  44   1.229  15.190  -7.085
    5    HG   SER  44           HG       SER  44   3.338  14.562  -7.512

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ARG  45           H        ARG  45  -1.116  16.468  -7.651
    2    HA   ARG  45           HA       ARG  45  -2.514  14.110  -7.030
    3    HB2  ARG  45           HB2      ARG  45  -2.704  16.273  -5.827
    4    HB3  ARG  45           HB3      ARG  45  -3.555  16.951  -7.212
    5    HG2  ARG  45           HG2      ARG  45  -5.330  15.232  -6.940
    6    HG3  ARG  45           HG3      ARG  45  -4.490  14.608  -5.519
    7    HD2  ARG  45           HD2      ARG  45  -4.688  16.870  -4.451
    8    HD3  ARG  45           HD3      ARG  45  -5.670  17.402  -5.832
    9    HE   ARG  45           HE       ARG  45  -6.793  15.026  -4.806
   10   HH21  ARG  45          HH11      ARG  45  -8.630  15.103  -3.538
   11   HH22  ARG  45          HH12      ARG  45  -9.020  16.539  -2.662
   12   HH11  ARG  45          HH21      ARG  45  -6.234  18.264  -3.764
   13   HH12  ARG  45          HH22      ARG  45  -7.658  18.330  -2.788

  No H/Q in entry =          13
  In of MODEL   44
    1    H    MET  46           H        MET  46  -3.084  16.531  -9.569
    2    HA   MET  46           HA       MET  46  -5.427  15.374 -10.640
    3    HB2  MET  46           HB2      MET  46  -3.314  17.191 -11.813
    4    HB3  MET  46           HB3      MET  46  -4.711  16.656 -12.751
    5    HG2  MET  46           HG2      MET  46  -6.225  17.585 -11.052
    6    HG3  MET  46           HG3      MET  46  -4.847  18.092 -10.082
    7    HE2  MET  46           HE1      MET  46  -5.795  21.583 -11.145
    8    HE1  MET  46           HE2      MET  46  -5.413  20.439  -9.863
    9    HE3  MET  46           HE3      MET  46  -6.942  20.300 -10.731

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ALA  47           H        ALA  47  -1.999  14.884 -11.396
    2    HA   ALA  47           HA       ALA  47  -2.348  13.170 -13.616
    3    HB3  ALA  47           HB1      ALA  47  -0.168  14.049 -13.256
    4    HB2  ALA  47           HB2      ALA  47  -0.034  12.318 -12.931
    5    HB1  ALA  47           HB3      ALA  47  -0.124  13.463 -11.592

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU  48           H        LEU  48  -2.087  12.515 -10.145
    2    HA   LEU  48           HA       LEU  48  -2.192   9.676 -10.319
    3    HB2  LEU  48           HB2      LEU  48  -2.952  11.585  -8.096
    4    HB3  LEU  48           HB3      LEU  48  -2.866   9.833  -7.904
    5    HG   LEU  48           HG       LEU  48  -0.558  11.529  -8.889
    6   HD13  LEU  48          HD11      LEU  48  -0.841  12.288  -6.695
    7   HD12  LEU  48          HD12      LEU  48   0.317  10.975  -6.501
    8   HD11  LEU  48          HD13      LEU  48  -1.383  10.717  -6.108
    9   HD22  LEU  48          HD21      LEU  48  -0.067   9.345  -9.541
   10   HD21  LEU  48          HD22      LEU  48  -0.942   8.626  -8.190
   11   HD23  LEU  48          HD23      LEU  48   0.633   9.371  -7.923

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ASN  49           H        ASN  49  -4.646  12.176  -9.907
    2    HA   ASN  49           HA       ASN  49  -6.839  10.518  -9.380
    3    HB2  ASN  49           HB2      ASN  49  -6.905  12.930  -9.036
    4    HB3  ASN  49           HB3      ASN  49  -6.707  13.214 -10.760
    5   HD21  ASN  49          HD21      ASN  49  -8.948  11.681  -8.421
    6   HD22  ASN  49          HD22      ASN  49 -10.341  11.951  -9.350

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLU  50           H        GLU  50  -5.550  11.726 -12.459
    2    HA   GLU  50           HA       GLU  50  -7.507  10.487 -14.115
    3    HB2  GLU  50           HB2      GLU  50  -6.032  12.305 -14.917
    4    HB3  GLU  50           HB3      GLU  50  -4.643  11.226 -14.782
    5    HG2  GLU  50           HG2      GLU  50  -5.620   9.703 -16.429
    6    HG3  GLU  50           HG3      GLU  50  -7.077  10.688 -16.513

  No H/Q in entry =           6
  In of MODEL   44
    1    H    ALA  51           H        ALA  51  -4.343   9.476 -12.909
    2    HA   ALA  51           HA       ALA  51  -4.211   7.030 -14.340
    3    HB2  ALA  51           HB1      ALA  51  -2.233   6.728 -13.238
    4    HB1  ALA  51           HB2      ALA  51  -2.922   7.145 -11.670
    5    HB3  ALA  51           HB3      ALA  51  -2.459   8.420 -12.796

  No H/Q in entry =           5
  In of MODEL   44
    1    H    HIS  52           H        HIS  52  -5.386   7.849 -11.089
    2    HA   HIS  52           HA       HIS  52  -6.083   5.238 -10.272
    3    HB2  HIS  52           HB2      HIS  52  -5.938   7.193  -8.752
    4    HB3  HIS  52           HB3      HIS  52  -7.395   7.853  -9.496
    5    HD1  HIS  52           HD1      HIS  52  -9.553   6.147  -9.385
    6    HD2  HIS  52           HD2      HIS  52  -6.474   5.464  -6.662
    7    HE1  HIS  52           HE1      HIS  52 -10.526   4.696  -7.552
    8    HE2  HIS  52           HE2      HIS  52  -8.660   4.270  -5.883

  No H/Q in entry =           8
  In of MODEL   44
    1    H    LEU  53           H        LEU  53  -7.890   7.713 -12.050
    2    HA   LEU  53           HA       LEU  53 -10.401   6.432 -12.074
    3    HB2  LEU  53           HB2      LEU  53  -9.105   8.415 -13.933
    4    HB3  LEU  53           HB3      LEU  53 -10.709   7.761 -14.258
    5    HG   LEU  53           HG       LEU  53  -9.986   9.056 -11.610
    6   HD13  LEU  53          HD11      LEU  53  -9.673  10.735 -13.341
    7   HD12  LEU  53          HD12      LEU  53 -11.192  11.060 -12.506
    8   HD11  LEU  53          HD13      LEU  53 -11.202  10.297 -14.093
    9   HD23  LEU  53          HD21      LEU  53 -12.572   9.470 -11.758
   10   HD22  LEU  53          HD22      LEU  53 -11.993   7.872 -11.303
   11   HD21  LEU  53          HD23      LEU  53 -12.552   8.166 -12.939

  No H/Q in entry =          11
  In of MODEL   44
    1    H    VAL  54           H        VAL  54  -7.647   6.234 -14.307
    2    HA   VAL  54           HA       VAL  54  -8.874   4.479 -16.162
    3    HB   VAL  54           HB       VAL  54  -5.966   4.968 -15.472
    4   HG12  VAL  54          HG11      VAL  54  -5.719   3.895 -17.866
    5   HG11  VAL  54          HG12      VAL  54  -7.252   3.119 -17.470
    6   HG13  VAL  54          HG13      VAL  54  -5.840   2.852 -16.450
    7   HG22  VAL  54          HG21      VAL  54  -6.724   6.920 -16.508
    8   HG21  VAL  54          HG22      VAL  54  -7.920   6.068 -17.482
    9   HG23  VAL  54          HG23      VAL  54  -6.213   5.982 -17.910

  No H/Q in entry =           9
  In of MODEL   44
    1    H    GLN  55           H        GLN  55  -6.884   3.908 -13.262
    2    HA   GLN  55           HA       GLN  55  -6.807   1.092 -13.533
    3    HB2  GLN  55           HB2      GLN  55  -5.250   1.972 -12.006
    4    HB3  GLN  55           HB3      GLN  55  -6.463   2.940 -11.174
    5    HG2  GLN  55           HG2      GLN  55  -7.163   1.179  -9.867
    6    HG3  GLN  55           HG3      GLN  55  -6.942  -0.002 -11.151
    7   HE21  GLN  55          HE21      GLN  55  -5.326  -1.462 -10.661
    8   HE22  GLN  55          HE22      GLN  55  -3.942  -1.123  -9.745

  No H/Q in entry =           8
  In of MODEL   44
    1    H    THR  56           H        THR  56  -9.131   3.257 -11.912
    2    HA   THR  56           HA       THR  56 -10.727   1.375 -10.635
    3    HB   THR  56           HB       THR  56 -11.616   3.885 -12.087
    4    HG1  THR  56           HG1      THR  56 -10.397   3.335  -9.678
    5   HG23  THR  56          HG21      THR  56 -13.629   2.810 -11.704
    6   HG22  THR  56          HG22      THR  56 -13.419   3.637 -10.160
    7   HG21  THR  56          HG23      THR  56 -13.011   1.928 -10.307

  No H/Q in entry =           7
  In of MODEL   44
    1    H    LYS  57           H        LYS  57 -10.916   2.477 -14.016
    2    HA   LYS  57           HA       LYS  57 -13.080   0.805 -14.783
    3    HB2  LYS  57           HB2      LYS  57 -12.192   2.758 -16.088
    4    HB3  LYS  57           HB3      LYS  57 -10.756   1.813 -16.458
    5    HG2  LYS  57           HG2      LYS  57 -12.127   0.144 -17.622
    6    HG3  LYS  57           HG3      LYS  57 -13.586   1.044 -17.227
    7    HD2  LYS  57           HD2      LYS  57 -12.735   2.980 -18.523
    8    HD3  LYS  57           HD3      LYS  57 -11.295   2.057 -18.945
    9    HE2  LYS  57           HE2      LYS  57 -12.692   0.372 -20.088
   10    HE3  LYS  57           HE3      LYS  57 -14.150   1.262 -19.654
   11    HZ1  LYS  57           HZ1      LYS  57 -13.073   3.203 -20.841
   12    HZ3  LYS  57           HZ2      LYS  57 -13.649   1.932 -21.810
   13    HZ2  LYS  57           HZ3      LYS  57 -11.986   2.077 -21.492

  No H/Q in entry =          13
  In of MODEL   44
    1    H    LEU  58           H        LEU  58  -9.578   0.356 -14.721
    2    HA   LEU  58           HA       LEU  58  -9.596  -2.155 -16.022
    3    HB2  LEU  58           HB2      LEU  58  -7.559  -0.883 -14.203
    4    HB3  LEU  58           HB3      LEU  58  -7.304  -2.401 -15.064
    5    HG   LEU  58           HG       LEU  58  -8.041   0.214 -16.416
    6   HD11  LEU  58          HD11      LEU  58  -5.403  -1.040 -15.726
    7   HD13  LEU  58          HD12      LEU  58  -5.889   0.653 -15.669
    8   HD12  LEU  58          HD13      LEU  58  -5.551  -0.112 -17.219
    9   HD22  LEU  58          HD21      LEU  58  -8.622  -1.337 -18.016
   10   HD21  LEU  58          HD22      LEU  58  -7.589  -2.593 -17.339
   11   HD23  LEU  58          HD23      LEU  58  -6.889  -1.318 -18.336

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  59           H        ILE  59 -10.420  -1.264 -12.768
    2    HA   ILE  59           HA       ILE  59 -10.085  -4.038 -11.834
    3    HB   ILE  59           HB       ILE  59  -9.638  -1.774 -10.425
    4   HG12  ILE  59          HG12      ILE  59 -10.999  -4.135  -9.111
    5   HG13  ILE  59          HG13      ILE  59  -9.359  -4.210  -9.702
    6   HG22  ILE  59          HG21      ILE  59 -12.397  -2.508  -9.486
    7   HG21  ILE  59          HG22      ILE  59 -12.177  -1.257 -10.687
    8   HG23  ILE  59          HG23      ILE  59 -11.456  -1.089  -9.090
    9   HD11  ILE  59          HD11      ILE  59  -8.832  -2.190  -8.308
   10   HD13  ILE  59          HD12      ILE  59  -9.237  -3.624  -7.373
   11   HD12  ILE  59          HD13      ILE  59 -10.433  -2.345  -7.591

  No H/Q in entry =          11
  In of MODEL   44
    1    H    GLU  60           H        GLU  60 -12.629  -1.706 -12.636
    2    HA   GLU  60           HA       GLU  60 -14.824  -3.217 -11.636
    3    HB2  GLU  60           HB2      GLU  60 -15.076  -0.863 -12.194
    4    HB3  GLU  60           HB3      GLU  60 -14.661  -1.181 -13.875
    5    HG2  GLU  60           HG2      GLU  60 -16.672  -2.640 -14.066
    6    HG3  GLU  60           HG3      GLU  60 -17.106  -2.218 -12.423

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLY  61           H        GLY  61 -13.143  -3.194 -14.747
    2    HA3  GLY  61           HA2      GLY  61 -14.865  -5.426 -15.652
    3    HA2  GLY  61           HA3      GLY  61 -14.012  -4.321 -16.722

  No H/Q in entry =           3
  In of MODEL   44
    1    H    ASP  62           H        ASP  62 -12.649  -5.786 -13.842
    2    HA   ASP  62           HA       ASP  62 -10.424  -6.815 -15.350
    3    HB2  ASP  62           HB2      ASP  62  -9.627  -7.545 -13.117
    4    HB3  ASP  62           HB3      ASP  62 -10.082  -5.845 -13.142

  No H/Q in entry =           4
  In of MODEL   44
    1    H    ALA  63           H        ALA  63 -12.287  -8.190 -16.589
    2    HA   ALA  63           HA       ALA  63 -13.241 -10.598 -15.418
    3    HB2  ALA  63           HB1      ALA  63 -13.480 -11.349 -17.792
    4    HB3  ALA  63           HB2      ALA  63 -12.551  -9.942 -18.305
    5    HB1  ALA  63           HB3      ALA  63 -14.125  -9.727 -17.539

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLY  64           H        GLY  64 -10.265  -9.753 -17.088
    2    HA3  GLY  64           HA2      GLY  64  -8.196 -10.756 -17.111
    3    HA2  GLY  64           HA3      GLY  64  -8.771 -11.865 -15.873

  No H/Q in entry =           3
  In of MODEL   44
    1    H    GLU  65           H        GLU  65  -7.303 -13.252 -17.373
    2    HA   GLU  65           HA       GLU  65  -8.274 -14.031 -19.910
    3    HB2  GLU  65           HB2      GLU  65  -6.416 -15.415 -17.979
    4    HB3  GLU  65           HB3      GLU  65  -6.760 -16.014 -19.603
    5    HG2  GLU  65           HG2      GLU  65  -5.944 -13.932 -20.584
    6    HG3  GLU  65           HG3      GLU  65  -5.679 -13.252 -18.979

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLY  66           H        GLY  66  -8.794 -15.293 -16.712
    2    HA3  GLY  66           HA2      GLY  66 -10.507 -17.463 -17.655
    3    HA2  GLY  66           HA3      GLY  66  -9.917 -17.240 -16.019

  No H/Q in entry =           3
  In of MODEL   44
    1    H    LYS  67           H        LYS  67 -12.508 -17.918 -16.489
    2    HA   LYS  67           HA       LYS  67 -14.345 -15.833 -16.770
    3    HB2  LYS  67           HB2      LYS  67 -15.910 -17.479 -15.597
    4    HB3  LYS  67           HB3      LYS  67 -15.122 -18.031 -17.080
    5    HG2  LYS  67           HG2      LYS  67 -13.377 -19.149 -15.773
    6    HG3  LYS  67           HG3      LYS  67 -14.089 -18.551 -14.276
    7    HD2  LYS  67           HD2      LYS  67 -16.148 -19.831 -14.740
    8    HD3  LYS  67           HD3      LYS  67 -15.433 -20.431 -16.239
    9    HE2  LYS  67           HE2      LYS  67 -13.603 -21.480 -14.957
   10    HE3  LYS  67           HE3      LYS  67 -14.308 -20.877 -13.456
   11    HZ3  LYS  67           HZ1      LYS  67 -15.992 -22.370 -13.535
   12    HZ2  LYS  67           HZ2      LYS  67 -14.831 -23.274 -14.384
   13    HZ1  LYS  67           HZ3      LYS  67 -16.036 -22.425 -15.228

  No H/Q in entry =          13
  In of MODEL   44
    1    H    MET  68           H        MET  68 -12.993 -17.242 -13.858
    2    HA   MET  68           HA       MET  68 -14.284 -15.220 -12.166
    3    HB2  MET  68           HB2      MET  68 -12.973 -17.865 -11.562
    4    HB3  MET  68           HB3      MET  68 -13.504 -16.740 -10.312
    5    HG2  MET  68           HG2      MET  68 -15.299 -17.850 -12.488
    6    HG3  MET  68           HG3      MET  68 -15.218 -18.480 -10.841
    7    HE3  MET  68           HE1      MET  68 -16.688 -16.138  -8.560
    8    HE2  MET  68           HE2      MET  68 -15.064 -15.589  -8.967
    9    HE1  MET  68           HE3      MET  68 -15.412 -17.316  -8.901

  No H/Q in entry =           9
  In of MODEL   44
    1    H    LYS  69           H        LYS  69 -11.275 -15.653 -13.637
    2    HA   LYS  69           HA       LYS  69  -9.747 -14.544 -11.423
    3    HB2  LYS  69           HB2      LYS  69  -8.810 -15.358 -14.181
    4    HB3  LYS  69           HB3      LYS  69  -7.780 -14.976 -12.799
    5    HG2  LYS  69           HG2      LYS  69  -9.876 -17.164 -12.773
    6    HG3  LYS  69           HG3      LYS  69  -8.177 -17.449 -13.143
    7    HD2  LYS  69           HD2      LYS  69  -7.699 -16.267 -10.887
    8    HD3  LYS  69           HD3      LYS  69  -9.405 -16.554 -10.540
    9    HE2  LYS  69           HE2      LYS  69  -9.117 -18.950 -10.855
   10    HE3  LYS  69           HE3      LYS  69  -7.448 -18.715 -11.367
   11    HZ3  LYS  69           HZ1      LYS  69  -7.203 -19.249  -9.163
   12    HZ2  LYS  69           HZ2      LYS  69  -8.623 -18.448  -8.686
   13    HZ1  LYS  69           HZ3      LYS  69  -7.231 -17.555  -9.081

  No H/Q in entry =          13
  In of MODEL   44
    1    H    VAL  70           H        VAL  70  -7.898 -12.929 -12.142
    2    HA   VAL  70           HA       VAL  70  -9.089 -10.702 -13.693
    3    HB   VAL  70           HB       VAL  70  -8.118  -9.154 -12.018
    4   HG12  VAL  70          HG11      VAL  70  -9.693  -9.971 -10.083
    5   HG11  VAL  70          HG12      VAL  70 -10.152 -11.224 -11.237
    6   HG13  VAL  70          HG13      VAL  70 -10.399  -9.525 -11.637
    7   HG21  VAL  70          HG21      VAL  70  -7.296 -11.767 -10.741
    8   HG23  VAL  70          HG22      VAL  70  -7.563 -10.335  -9.750
    9   HG22  VAL  70          HG23      VAL  70  -6.325 -10.319 -11.003

  No H/Q in entry =           9
  In of MODEL   44
    1    H    SER  71           H        SER  71  -7.458  -9.138 -14.426
    2    HA   SER  71           HA       SER  71  -5.258 -10.373 -15.732
    3    HB2  SER  71           HB2      SER  71  -6.405  -8.317 -16.562
    4    HB3  SER  71           HB3      SER  71  -5.727  -7.428 -15.201
    5    HG   SER  71           HG       SER  71  -4.519  -7.394 -17.257

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU  72           H        LEU  72  -3.222 -10.673 -15.093
    2    HA   LEU  72           HA       LEU  72  -2.507 -10.475 -12.379
    3    HB2  LEU  72           HB2      LEU  72  -0.846 -10.898 -14.859
    4    HB3  LEU  72           HB3      LEU  72  -0.193 -10.989 -13.226
    5    HG   LEU  72           HG       LEU  72  -2.549 -12.657 -14.165
    6   HD13  LEU  72          HD11      LEU  72  -0.533 -13.216 -15.474
    7   HD12  LEU  72          HD12      LEU  72  -0.923 -14.513 -14.345
    8   HD11  LEU  72          HD13      LEU  72   0.389 -13.392 -13.981
    9   HD21  LEU  72          HD21      LEU  72  -0.832 -12.554 -11.692
   10   HD23  LEU  72          HD22      LEU  72  -1.567 -14.079 -12.163
   11   HD22  LEU  72          HD23      LEU  72  -2.583 -12.685 -11.810

  No H/Q in entry =          11
  In of MODEL   44
    1    H    VAL  73           H        VAL  73  -1.773  -8.450 -15.149
    2    HA   VAL  73           HA       VAL  73   0.155  -6.767 -14.033
    3    HB   VAL  73           HB       VAL  73  -0.223  -5.340 -15.885
    4   HG12  VAL  73          HG11      VAL  73  -1.142  -8.009 -16.943
    5   HG11  VAL  73          HG12      VAL  73   0.477  -7.814 -16.270
    6   HG13  VAL  73          HG13      VAL  73  -0.017  -6.862 -17.669
    7   HG21  VAL  73          HG21      VAL  73  -2.997  -6.468 -15.728
    8   HG23  VAL  73          HG22      VAL  73  -2.397  -5.906 -17.286
    9   HG22  VAL  73          HG23      VAL  73  -2.483  -4.792 -15.922

  No H/Q in entry =           9
  In of MODEL   44
    1    H    LEU  74           H        LEU  74  -3.244  -6.866 -13.484
    2    HA   LEU  74           HA       LEU  74  -3.848  -4.209 -12.861
    3    HB2  LEU  74           HB2      LEU  74  -5.587  -5.862 -13.046
    4    HB3  LEU  74           HB3      LEU  74  -4.904  -6.798 -11.719
    5    HG   LEU  74           HG       LEU  74  -5.357  -4.926 -10.167
    6   HD13  LEU  74          HD11      LEU  74  -5.231  -2.988 -11.532
    7   HD12  LEU  74          HD12      LEU  74  -6.940  -3.129 -11.126
    8   HD11  LEU  74          HD13      LEU  74  -6.365  -3.645 -12.712
    9   HD22  LEU  74          HD21      LEU  74  -7.563  -5.499  -9.913
   10   HD21  LEU  74          HD22      LEU  74  -7.053  -6.738 -11.041
   11   HD23  LEU  74          HD23      LEU  74  -7.913  -5.336 -11.632

  No H/Q in entry =          11
  In of MODEL   44
    1    H    VAL  75           H        VAL  75  -2.828  -6.812 -10.709
    2    HA   VAL  75           HA       VAL  75  -2.626  -5.272  -8.357
    3    HB   VAL  75           HB       VAL  75  -1.153  -7.776  -9.159
    4   HG13  VAL  75          HG11      VAL  75   0.131  -6.558  -7.433
    5   HG12  VAL  75          HG12      VAL  75  -0.678  -7.938  -6.704
    6   HG11  VAL  75          HG13      VAL  75  -1.336  -6.325  -6.489
    7   HG21  VAL  75          HG21      VAL  75  -3.636  -7.913  -8.947
    8   HG23  VAL  75          HG22      VAL  75  -3.514  -7.253  -7.316
    9   HG22  VAL  75          HG23      VAL  75  -2.817  -8.832  -7.684

  No H/Q in entry =           9
  In of MODEL   44
    1    H    GLU  76           H        GLU  76  -0.216  -6.035 -10.891
    2    HA   GLU  76           HA       GLU  76   1.975  -4.706  -9.722
    3    HB2  GLU  76           HB2      GLU  76   2.169  -6.174 -11.713
    4    HB3  GLU  76           HB3      GLU  76   1.274  -5.001 -12.666
    5    HG2  GLU  76           HG2      GLU  76   3.606  -4.672 -13.156
    6    HG3  GLU  76           HG3      GLU  76   3.112  -3.315 -12.162

  No H/Q in entry =           6
  In of MODEL   44
    1    H    ALA  77           H        ALA  77  -0.544  -3.480 -11.912
    2    HA   ALA  77           HA       ALA  77   0.462  -0.839 -12.073
    3    HB1  ALA  77           HB1      ALA  77  -1.243  -1.792 -13.617
    4    HB2  ALA  77           HB2      ALA  77  -1.744  -0.248 -12.926
    5    HB3  ALA  77           HB3      ALA  77  -2.419  -1.752 -12.302

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLN  78           H        GLN  78  -1.821  -2.391  -9.875
    2    HA   GLN  78           HA       GLN  78  -2.619  -0.074  -8.466
    3    HB2  GLN  78           HB2      GLN  78  -3.710  -2.365  -8.409
    4    HB3  GLN  78           HB3      GLN  78  -2.404  -2.879  -7.346
    5    HG2  GLN  78           HG2      GLN  78  -3.009  -1.156  -5.724
    6    HG3  GLN  78           HG3      GLN  78  -4.273  -0.558  -6.797
    7   HE21  GLN  78          HE21      GLN  78  -5.255  -3.151  -7.682
    8   HE22  GLN  78          HE22      GLN  78  -6.003  -3.889  -6.347

  No H/Q in entry =           8
  In of MODEL   44
    1    H    LEU  79           H        LEU  79   0.046  -2.347  -8.019
    2    HA   LEU  79           HA       LEU  79   1.021  -1.466  -5.555
    3    HB2  LEU  79           HB2      LEU  79   1.883  -3.475  -6.629
    4    HB3  LEU  79           HB3      LEU  79   2.537  -2.520  -7.957
    5    HG   LEU  79           HG       LEU  79   4.095  -1.396  -6.444
    6   HD13  LEU  79          HD11      LEU  79   3.086  -1.154  -4.378
    7   HD12  LEU  79          HD12      LEU  79   4.157  -2.511  -4.038
    8   HD11  LEU  79          HD13      LEU  79   2.451  -2.800  -4.373
    9   HD23  LEU  79          HD21      LEU  79   5.293  -3.554  -5.547
   10   HD22  LEU  79          HD22      LEU  79   5.095  -3.346  -7.285
   11   HD21  LEU  79          HD23      LEU  79   4.009  -4.414  -6.400

  No H/Q in entry =          11
  In of MODEL   44
    1    H    HIS  80           H        HIS  80   1.905  -0.339  -8.820
    2    HA   HIS  80           HA       HIS  80   3.720   1.636  -7.884
    3    HB2  HIS  80           HB2      HIS  80   2.434   0.959 -10.474
    4    HB3  HIS  80           HB3      HIS  80   3.036   2.608 -10.294
    5    HD1  HIS  80           HD1      HIS  80   5.440   2.900 -10.808
    6    HD2  HIS  80           HD2      HIS  80   4.600  -1.013  -9.637
    7    HE1  HIS  80           HE1      HIS  80   7.625   1.614 -10.974
    8    HE2  HIS  80           HE2      HIS  80   7.124  -0.774 -10.263

  No H/Q in entry =           8
  In of MODEL   44
    1    H    LEU  81           H        LEU  81   0.319   1.815  -8.873
    2    HA   LEU  81           HA       LEU  81   0.055   4.608  -8.530
    3    HB2  LEU  81           HB2      LEU  81  -1.969   2.370  -8.467
    4    HB3  LEU  81           HB3      LEU  81  -2.415   4.075  -8.368
    5    HG   LEU  81           HG       LEU  81  -0.720   2.928 -10.605
    6   HD12  LEU  81          HD11      LEU  81  -2.947   3.263 -11.909
    7   HD11  LEU  81          HD12      LEU  81  -3.708   3.190 -10.320
    8   HD13  LEU  81          HD13      LEU  81  -2.769   1.821 -10.910
    9   HD23  LEU  81          HD21      LEU  81  -1.805   5.082 -11.695
   10   HD22  LEU  81          HD22      LEU  81  -0.391   5.242 -10.657
   11   HD21  LEU  81          HD23      LEU  81  -1.996   5.594 -10.020

  No H/Q in entry =          11
  In of MODEL   44
    1    H    MET  82           H        MET  82  -0.621   1.913  -6.295
    2    HA   MET  82           HA       MET  82  -1.673   3.494  -4.204
    3    HB2  MET  82           HB2      MET  82  -0.309   0.802  -4.252
    4    HB3  MET  82           HB3      MET  82  -0.890   1.522  -2.752
    5    HG2  MET  82           HG2      MET  82  -2.617   1.046  -5.201
    6    HG3  MET  82           HG3      MET  82  -2.547  -0.034  -3.810
    7    HE3  MET  82           HE1      MET  82  -4.272   1.609  -0.992
    8    HE2  MET  82           HE2      MET  82  -2.540   1.881  -1.171
    9    HE1  MET  82           HE3      MET  82  -3.232   0.328  -1.634

  No H/Q in entry =           9
  In of MODEL   44
    1    H    THR  83           H        THR  83   1.625   2.399  -4.889
    2    HA   THR  83           HA       THR  83   2.840   3.489  -2.580
    3    HB   THR  83           HB       THR  83   4.939   3.433  -4.048
    4    HG1  THR  83           HG1      THR  83   4.704   2.916  -6.075
    5   HG22  THR  83          HG21      THR  83   4.487   0.778  -4.393
    6   HG21  THR  83          HG22      THR  83   3.195   1.156  -3.255
    7   HG23  THR  83          HG23      THR  83   4.875   1.492  -2.829

  No H/Q in entry =           7
  In of MODEL   44
    1    H    SER  84           H        SER  84   2.484   4.785  -5.875
    2    HA   SER  84           HA       SER  84   3.830   7.218  -5.405
    3    HB2  SER  84           HB2      SER  84   1.763   6.402  -7.434
    4    HB3  SER  84           HB3      SER  84   2.447   8.027  -7.399
    5    HG   SER  84           HG       SER  84   3.812   5.549  -7.698

  No H/Q in entry =           5
  In of MODEL   44
    1    H    MET  85           H        MET  85   0.333   6.473  -5.247
    2    HA   MET  85           HA       MET  85  -0.521   9.084  -4.636
    3    HB2  MET  85           HB2      MET  85  -2.046   7.281  -5.318
    4    HB3  MET  85           HB3      MET  85  -1.767   6.470  -3.777
    5    HG2  MET  85           HG2      MET  85  -2.655   8.429  -2.573
    6    HG3  MET  85           HG3      MET  85  -2.912   9.259  -4.106
    7    HE2  MET  85           HE1      MET  85  -4.643   6.988  -1.456
    8    HE1  MET  85           HE2      MET  85  -3.408   6.012  -2.248
    9    HE3  MET  85           HE3      MET  85  -5.109   5.603  -2.451

  No H/Q in entry =           9
  In of MODEL   44
    1    H    LEU  86           H        LEU  86   0.383   6.408  -2.502
    2    HA   LEU  86           HA       LEU  86  -0.152   7.701  -0.055
    3    HB2  LEU  86           HB2      LEU  86   0.303   5.230  -0.460
    4    HB3  LEU  86           HB3      LEU  86   2.012   5.653  -0.548
    5    HG   LEU  86           HG       LEU  86   1.686   6.805   1.725
    6   HD11  LEU  86          HD11      LEU  86  -1.011   6.052   1.242
    7   HD13  LEU  86          HD12      LEU  86  -0.345   6.789   2.698
    8   HD12  LEU  86          HD13      LEU  86  -0.444   5.035   2.570
    9   HD23  LEU  86          HD21      LEU  86   1.244   3.814   1.831
   10   HD22  LEU  86          HD22      LEU  86   2.248   4.814   2.879
   11   HD21  LEU  86          HD23      LEU  86   2.752   4.495   1.220

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ALA  87           H        ALA  87   2.833   7.402  -1.938
    2    HA   ALA  87           HA       ALA  87   4.540   8.796  -0.201
    3    HB3  ALA  87           HB1      ALA  87   4.638   7.796  -2.913
    4    HB2  ALA  87           HB2      ALA  87   5.971   8.115  -1.807
    5    HB1  ALA  87           HB3      ALA  87   5.366   9.403  -2.846

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ARG  88           H        ARG  88   2.606   9.955  -2.921
    2    HA   ARG  88           HA       ARG  88   3.394  12.640  -2.789
    3    HB2  ARG  88           HB2      ARG  88   2.139  11.503  -4.655
    4    HB3  ARG  88           HB3      ARG  88   0.680  11.649  -3.676
    5    HG2  ARG  88           HG2      ARG  88   1.712  14.224  -3.577
    6    HG3  ARG  88           HG3      ARG  88   2.138  13.716  -5.208
    7    HD2  ARG  88           HD2      ARG  88  -0.001  13.811  -5.911
    8    HD3  ARG  88           HD3      ARG  88  -0.596  12.954  -4.489
    9    HE   ARG  88           HE       ARG  88  -0.769  15.735  -4.893
   10   HH21  ARG  88          HH11      ARG  88  -1.294  17.058  -3.150
   11   HH22  ARG  88          HH12      ARG  88  -1.005  16.511  -1.535
   12   HH11  ARG  88          HH21      ARG  88   0.228  13.455  -2.528
   13   HH12  ARG  88          HH22      ARG  88  -0.161  14.465  -1.183

  No H/Q in entry =          13
  In of MODEL   44
    1    H    GLU  89           H        GLU  89   0.677  10.973  -1.165
    2    HA   GLU  89           HA       GLU  89  -0.421  13.285   0.049
    3    HB2  GLU  89           HB2      GLU  89  -1.551  11.053  -0.052
    4    HB3  GLU  89           HB3      GLU  89  -0.434  10.484   1.189
    5    HG2  GLU  89           HG2      GLU  89  -1.248  12.180   2.755
    6    HG3  GLU  89           HG3      GLU  89  -2.293  12.863   1.512

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LEU  90           H        LEU  90   2.014  10.972   1.218
    2    HA   LEU  90           HA       LEU  90   2.371  12.201   3.755
    3    HB2  LEU  90           HB2      LEU  90   4.137  10.425   2.073
    4    HB3  LEU  90           HB3      LEU  90   4.555  10.930   3.715
    5    HG   LEU  90           HG       LEU  90   1.914   9.605   3.041
    6   HD12  LEU  90          HD11      LEU  90   3.038   7.546   4.041
    7   HD11  LEU  90          HD12      LEU  90   4.567   8.394   3.807
    8   HD13  LEU  90          HD13      LEU  90   3.555   8.000   2.416
    9   HD22  LEU  90          HD21      LEU  90   1.650  10.519   5.166
   10   HD21  LEU  90          HD22      LEU  90   3.366  10.398   5.552
   11   HD23  LEU  90          HD23      LEU  90   2.350   8.957   5.591

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  91           H        ILE  91   3.985  12.589   0.634
    2    HA   ILE  91           HA       ILE  91   5.971  14.403   1.488
    3    HB   ILE  91           HB       ILE  91   4.663  13.935  -1.198
    4   HG12  ILE  91          HG12      ILE  91   7.490  13.424  -0.219
    5   HG13  ILE  91          HG13      ILE  91   6.200  12.234  -0.066
    6   HG22  ILE  91          HG21      ILE  91   6.897  15.271  -1.874
    7   HG21  ILE  91          HG22      ILE  91   6.589  16.065  -0.329
    8   HG23  ILE  91          HG23      ILE  91   5.369  16.109  -1.601
    9   HD13  ILE  91          HD11      ILE  91   6.030  11.924  -2.376
   10   HD12  ILE  91          HD12      ILE  91   7.766  12.154  -2.156
   11   HD11  ILE  91          HD13      ILE  91   6.766  13.487  -2.738

  No H/Q in entry =          11
  In of MODEL   44
    1    H    THR  92           H        THR  92   2.615  14.864   0.474
    2    HA   THR  92           HA       THR  92   2.609  17.688   0.428
    3    HB   THR  92           HB       THR  92   0.426  15.705   1.112
    4    HG1  THR  92           HG1      THR  92   0.734  15.535  -0.973
    5   HG22  THR  92          HG21      THR  92  -0.958  17.880   0.398
    6   HG21  THR  92          HG22      THR  92   0.438  18.692   1.102
    7   HG23  THR  92          HG23      THR  92  -0.513  17.572   2.076

  No H/Q in entry =           7
  In of MODEL   44
    1    H    GLU  93           H        GLU  93   2.038  15.377   3.069
    2    HA   GLU  93           HA       GLU  93   1.514  17.274   5.096
    3    HB2  GLU  93           HB2      GLU  93   2.807  14.539   5.321
    4    HB3  GLU  93           HB3      GLU  93   2.120  15.464   6.657
    5    HG2  GLU  93           HG2      GLU  93   0.508  14.711   4.210
    6    HG3  GLU  93           HG3      GLU  93   0.599  13.680   5.633

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LEU  94           H        LEU  94   4.513  15.777   3.946
    2    HA   LEU  94           HA       LEU  94   6.267  16.902   5.844
    3    HB2  LEU  94           HB2      LEU  94   6.669  15.946   3.009
    4    HB3  LEU  94           HB3      LEU  94   8.001  16.589   3.965
    5    HG   LEU  94           HG       LEU  94   6.242  14.400   5.084
    6   HD11  LEU  94          HD11      LEU  94   8.341  14.170   2.957
    7   HD13  LEU  94          HD12      LEU  94   6.888  13.206   3.210
    8   HD12  LEU  94          HD13      LEU  94   8.309  12.937   4.219
    9   HD23  LEU  94          HD21      LEU  94   8.425  13.842   6.239
   10   HD22  LEU  94          HD22      LEU  94   7.769  15.423   6.662
   11   HD21  LEU  94          HD23      LEU  94   9.109  15.298   5.522

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  95           H        ILE  95   5.144  18.098   2.697
    2    HA   ILE  95           HA       ILE  95   6.734  20.444   2.654
    3    HB   ILE  95           HB       ILE  95   4.088  19.787   1.339
    4   HG12  ILE  95          HG12      ILE  95   6.882  20.110   0.211
    5   HG13  ILE  95          HG13      ILE  95   6.220  18.558   0.715
    6   HG21  ILE  95          HG21      ILE  95   5.856  22.242   1.136
    7   HG23  ILE  95          HG22      ILE  95   4.130  22.185   1.487
    8   HG22  ILE  95          HG23      ILE  95   4.714  21.789  -0.129
    9   HD13  ILE  95          HD11      ILE  95   4.664  18.503  -1.018
   10   HD12  ILE  95          HD12      ILE  95   6.021  19.315  -1.798
   11   HD11  ILE  95          HD13      ILE  95   4.654  20.257  -1.204

  No H/Q in entry =          11
  In of MODEL   44
    1    H    GLU  96           H        GLU  96   3.477  19.809   3.938
    2    HA   GLU  96           HA       GLU  96   2.874  22.457   4.702
    3    HB2  GLU  96           HB2      GLU  96   1.187  20.686   4.700
    4    HB3  GLU  96           HB3      GLU  96   2.039  19.846   5.993
    5    HG2  GLU  96           HG2      GLU  96   1.024  21.128   7.567
    6    HG3  GLU  96           HG3      GLU  96   1.573  22.602   6.779

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LEU  97           H        LEU  97   4.694  19.884   6.318
    2    HA   LEU  97           HA       LEU  97   5.055  21.217   8.797
    3    HB2  LEU  97           HB2      LEU  97   6.580  19.043   7.375
    4    HB3  LEU  97           HB3      LEU  97   7.171  19.716   8.892
    5    HG   LEU  97           HG       LEU  97   4.354  18.645   8.568
    6   HD12  LEU  97          HD11      LEU  97   5.275  16.620   9.773
    7   HD11  LEU  97          HD12      LEU  97   6.892  17.240   9.436
    8   HD13  LEU  97          HD13      LEU  97   5.822  16.797   8.105
    9   HD23  LEU  97          HD21      LEU  97   4.798  18.334  11.132
   10   HD22  LEU  97          HD22      LEU  97   4.432  19.952  10.535
   11   HD21  LEU  97          HD23      LEU  97   6.099  19.498  10.882

  No H/Q in entry =          11
  In of MODEL   44
    1    H    HIS  98           H        HIS  98   6.934  21.234   5.776
    2    HA   HIS  98           HA       HIS  98   9.097  22.792   6.689
    3    HB2  HIS  98           HB2      HIS  98   7.809  22.561   3.958
    4    HB3  HIS  98           HB3      HIS  98   9.256  23.527   4.258
    5    HD1  HIS  98           HD1      HIS  98   8.017  19.966   4.255
    6    HD2  HIS  98           HD2      HIS  98  11.613  22.031   4.700
    7    HE1  HIS  98           HE1      HIS  98   9.858  18.222   4.194
    8    HE2  HIS  98           HE2      HIS  98  12.052  19.459   4.465

  No H/Q in entry =           8
  In of MODEL   44
    1    H    GLU  99           H        GLU  99   5.886  23.659   5.510
    2    HA   GLU  99           HA       GLU  99   6.288  26.471   5.468
    3    HB2  GLU  99           HB2      GLU  99   4.402  25.323   4.326
    4    HB3  GLU  99           HB3      GLU  99   3.699  24.959   5.902
    5    HG2  GLU  99           HG2      GLU  99   3.537  27.349   6.415
    6    HG3  GLU  99           HG3      GLU  99   4.321  27.751   4.890

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LYS 100           H        LYS 100   5.133  24.231   7.975
    2    HA   LYS 100           HA       LYS 100   4.558  26.280   9.878
    3    HB2  LYS 100           HB2      LYS 100   5.108  23.322  10.210
    4    HB3  LYS 100           HB3      LYS 100   4.667  24.392  11.547
    5    HG2  LYS 100           HG2      LYS 100   2.609  25.053  10.297
    6    HG3  LYS 100           HG3      LYS 100   3.030  23.887   9.039
    7    HD2  LYS 100           HD2      LYS 100   2.933  22.058  10.690
    8    HD3  LYS 100           HD3      LYS 100   2.529  23.218  11.959
    9    HE2  LYS 100           HE2      LYS 100   0.485  23.863  10.694
   10    HE3  LYS 100           HE3      LYS 100   0.878  22.646   9.473
   11    HZ1  LYS 100           HZ1      LYS 100   0.599  21.966  12.350
   12    HZ3  LYS 100           HZ2      LYS 100   0.578  20.920  11.009
   13    HZ2  LYS 100           HZ3      LYS 100  -0.729  21.968  11.291

  No H/Q in entry =          13
  In of MODEL   44
    1    H    LEU 101           H        LEU 101   7.469  24.465   9.042
    2    HA   LEU 101           HA       LEU 101   9.069  25.279  11.254
    3    HB2  LEU 101           HB2      LEU 101   9.662  24.302   8.472
    4    HB3  LEU 101           HB3      LEU 101  10.967  24.951   9.461
    5    HG   LEU 101           HG       LEU 101   9.114  22.805  10.508
    6   HD12  LEU 101          HD11      LEU 101  11.157  21.296   9.897
    7   HD11  LEU 101          HD12      LEU 101  11.538  22.562   8.732
    8   HD13  LEU 101          HD13      LEU 101  10.002  21.703   8.630
    9   HD21  LEU 101          HD21      LEU 101  11.846  23.886  11.249
   10   HD23  LEU 101          HD22      LEU 101  11.287  22.315  11.819
   11   HD22  LEU 101          HD23      LEU 101  10.407  23.777  12.262

  No H/Q in entry =          11
  In of MODEL   44
    1    H    LYS 102           H        LYS 102   7.507  27.168   9.119
    2    HA   LYS 102           HA       LYS 102   7.605  29.462   8.840
    3    HB2  LYS 102           HB2      LYS 102   9.163  29.322  10.942
    4    HB3  LYS 102           HB3      LYS 102  10.467  29.511   9.787
    5    HG2  LYS 102           HG2      LYS 102   8.377  31.477  10.654
    6    HG3  LYS 102           HG3      LYS 102  10.092  31.724  10.408
    7    HD2  LYS 102           HD2      LYS 102   8.143  31.330   8.101
    8    HD3  LYS 102           HD3      LYS 102   8.538  32.903   8.779
    9    HE2  LYS 102           HE2      LYS 102   9.906  31.717   6.702
   10    HE3  LYS 102           HE3      LYS 102  10.531  33.013   7.722
   11    HZ2  LYS 102           HZ1      LYS 102  12.036  31.096   7.541
   12    HZ1  LYS 102           HZ2      LYS 102  10.863  30.120   8.275
   13    HZ3  LYS 102           HZ3      LYS 102  11.564  31.396   9.142

  No H/Q in entry =          13
  In of MODEL   44
    1    H    ALA 103           H        ALA 103  10.851  28.097   8.277
    2    HA   ALA 103           HA       ALA 103  11.833  29.476   6.211
    3    HB2  ALA 103           HB1      ALA 103  12.701  27.259   5.273
    4    HB1  ALA 103           HB2      ALA 103  11.796  26.486   6.573
    5    HB3  ALA 103           HB3      ALA 103  13.094  27.617   6.955

  No H/Q in entry =           5
  In of MODEL   44
    1    H1   LYS   3           H1       LYS   3 -31.896   5.227 -19.910
    2    H2   LYS   3           H3       LYS   3 -30.918   4.921 -21.263
    3    H3   LYS   3           H2       LYS   3 -32.274   3.947 -20.958
    4    HA   LYS   3           HA       LYS   3 -31.203   2.651 -19.517
    5    HB2  LYS   3           HB2      LYS   3 -28.992   4.089 -20.941
    6    HB3  LYS   3           HB3      LYS   3 -28.607   2.943 -19.656
    7    HG2  LYS   3           HG2      LYS   3 -29.990   1.255 -20.921
    8    HG3  LYS   3           HG3      LYS   3 -30.007   2.404 -22.257
    9    HD2  LYS   3           HD2      LYS   3 -27.522   2.380 -22.243
   10    HD3  LYS   3           HD3      LYS   3 -27.577   1.127 -21.005
   11    HE2  LYS   3           HE2      LYS   3 -29.057  -0.168 -22.650
   12    HE3  LYS   3           HE3      LYS   3 -28.497   0.984 -23.861
   13    HZ3  LYS   3           HZ1      LYS   3 -26.660  -0.189 -24.111
   14    HZ2  LYS   3           HZ2      LYS   3 -27.232  -1.337 -22.996
   15    HZ1  LYS   3           HZ3      LYS   3 -26.279  -0.036 -22.464

  No H/Q in entry =          15
  In of MODEL   44
    1    H    LYS   4           H        LYS   4 -31.220   2.588 -17.452
    2    HA   LYS   4           HA       LYS   4 -30.546   4.962 -15.903
    3    HB2  LYS   4           HB2      LYS   4 -31.642   2.259 -15.080
    4    HB3  LYS   4           HB3      LYS   4 -31.451   3.648 -14.011
    5    HG2  LYS   4           HG2      LYS   4 -33.291   3.428 -16.399
    6    HG3  LYS   4           HG3      LYS   4 -33.758   3.529 -14.702
    7    HD2  LYS   4           HD2      LYS   4 -33.136   5.783 -14.533
    8    HD3  LYS   4           HD3      LYS   4 -32.116   5.704 -15.969
    9    HE2  LYS   4           HE2      LYS   4 -34.095   6.991 -16.454
   10    HE3  LYS   4           HE3      LYS   4 -34.138   5.480 -17.363
   11    HZ3  LYS   4           HZ1      LYS   4 -35.658   4.577 -15.757
   12    HZ2  LYS   4           HZ2      LYS   4 -36.273   6.028 -16.389
   13    HZ1  LYS   4           HZ3      LYS   4 -35.590   6.001 -14.835

  No H/Q in entry =          13
  In of MODEL   44
    1    H    HIS   5           H        HIS   5 -29.058   5.159 -14.341
    2    HA   HIS   5           HA       HIS   5 -26.720   3.396 -14.637
    3    HB2  HIS   5           HB2      HIS   5 -27.049   6.186 -13.535
    4    HB3  HIS   5           HB3      HIS   5 -25.537   5.283 -13.505
    5    HD1  HIS   5           HD1      HIS   5 -24.131   6.467 -15.163
    6    HD2  HIS   5           HD2      HIS   5 -27.932   5.660 -16.630
    7    HE1  HIS   5           HE1      HIS   5 -24.019   6.955 -17.637
    8    HE2  HIS   5           HE2      HIS   5 -26.336   6.452 -18.500

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ILE   6           H        ILE   6 -26.419   1.885 -13.263
    2    HA   ILE   6           HA       ILE   6 -27.361   2.230 -10.497
    3    HB   ILE   6           HB       ILE   6 -26.478  -0.268 -11.950
    4   HG12  ILE   6          HG12      ILE   6 -29.238   0.612 -11.092
    5   HG13  ILE   6          HG13      ILE   6 -28.625   0.731 -12.742
    6   HG23  ILE   6          HG21      ILE   6 -26.782  -1.456 -10.037
    7   HG22  ILE   6          HG22      ILE   6 -27.967  -0.323  -9.384
    8   HG21  ILE   6          HG23      ILE   6 -26.248   0.072  -9.335
    9   HD13  ILE   6          HD11      ILE   6 -29.022  -1.420 -13.152
   10   HD12  ILE   6          HD12      ILE   6 -30.016  -1.380 -11.695
   11   HD11  ILE   6          HD13      ILE   6 -28.342  -1.929 -11.605

  No H/Q in entry =          11
  In of MODEL   44
    1    H    TYR   7           H        TYR   7 -25.605   2.978  -9.265
    2    HA   TYR   7           HA       TYR   7 -22.875   2.082  -9.950
    3    HB2  TYR   7           HB2      TYR   7 -23.895   4.540  -8.550
    4    HB3  TYR   7           HB3      TYR   7 -22.196   4.078  -8.595
    5    HD1  TYR   7           HD1      TYR   7 -23.249   2.982 -11.629
    6    HD2  TYR   7           HD2      TYR   7 -22.663   6.658  -9.555
    7    HE1  TYR   7           HE1      TYR   7 -22.889   4.141 -13.773
    8    HE2  TYR   7           HE2      TYR   7 -22.345   7.822 -11.691
    9    HH   TYR   7           HH       TYR   7 -22.593   7.641 -13.914

  No H/Q in entry =           9
  In of MODEL   44
    1    H    LEU   8           H        LEU   8 -21.846   0.815  -8.585
    2    HA   LEU   8           HA       LEU   8 -22.920   0.392  -5.866
    3    HB2  LEU   8           HB2      LEU   8 -21.191  -1.289  -7.661
    4    HB3  LEU   8           HB3      LEU   8 -21.339  -1.608  -5.934
    5    HG   LEU   8           HG       LEU   8 -23.819  -1.875  -6.308
    6   HD13  LEU   8          HD11      LEU   8 -24.019  -0.749  -8.462
    7   HD12  LEU   8          HD12      LEU   8 -24.498  -2.438  -8.629
    8   HD11  LEU   8          HD13      LEU   8 -22.916  -1.910  -9.198
    9   HD23  LEU   8          HD21      LEU   8 -22.504  -3.941  -7.942
   10   HD22  LEU   8          HD22      LEU   8 -23.564  -4.088  -6.541
   11   HD21  LEU   8          HD23      LEU   8 -21.866  -3.671  -6.320

  No H/Q in entry =          11
  In of MODEL   44
    1    H    PHE   9           H        PHE   9 -21.630   0.884  -4.115
    2    HA   PHE   9           HA       PHE   9 -18.876   1.873  -4.690
    3    HB2  PHE   9           HB2      PHE   9 -20.903   2.978  -2.749
    4    HB3  PHE   9           HB3      PHE   9 -19.205   3.432  -2.759
    5    HD1  PHE   9           HD1      PHE   9 -18.246   4.703  -4.609
    6    HD2  PHE   9           HD2      PHE   9 -22.415   3.690  -4.541
    7    HE1  PHE   9           HE1      PHE   9 -18.670   6.322  -6.435
    8    HE2  PHE   9           HE2      PHE   9 -22.841   5.323  -6.361
    9    HZ   PHE   9           HZ       PHE   9 -20.966   6.634  -7.314

  No H/Q in entry =           9
  In of MODEL   44
    1    H    SER  10           H        SER  10 -17.248   1.023  -3.542
    2    HA   SER  10           HA       SER  10 -17.419   0.225  -0.819
    3    HB2  SER  10           HB2      SER  10 -18.589  -1.719  -1.757
    4    HB3  SER  10           HB3      SER  10 -17.262  -1.978  -2.878
    5    HG   SER  10           HG       SER  10 -16.729  -1.792  -0.140

  No H/Q in entry =           5
  In of MODEL   44
    1    H    SER  11           H        SER  11 -15.372   0.257   0.026
    2    HA   SER  11           HA       SER  11 -13.227   1.170  -1.566
    3    HB2  SER  11           HB2      SER  11 -12.012   1.289   0.404
    4    HB3  SER  11           HB3      SER  11 -13.676   1.393   0.982
    5    HG   SER  11           HG       SER  11 -12.696  -1.167   0.668

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA  12           H        ALA  12 -14.368  -1.504  -2.347
    2    HA   ALA  12           HA       ALA  12 -11.796  -2.762  -2.857
    3    HB2  ALA  12           HB1      ALA  12 -12.670  -5.024  -2.158
    4    HB1  ALA  12           HB2      ALA  12 -13.995  -4.187  -1.350
    5    HB3  ALA  12           HB3      ALA  12 -12.333  -3.913  -0.829

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLY  13           H        GLY  13 -12.537  -1.835  -4.933
    2    HA3  GLY  13           HA2      GLY  13 -14.814  -2.592  -6.343
    3    HA2  GLY  13           HA3      GLY  13 -13.285  -2.121  -7.098

  No H/Q in entry =           3
  In of MODEL   44
    1    H    MET  14           H        MET  14 -11.692  -4.329  -6.179
    2    HA   MET  14           HA       MET  14 -12.103  -6.147  -8.233
    3    HB2  MET  14           HB2      MET  14  -9.990  -6.118  -7.009
    4    HB3  MET  14           HB3      MET  14 -10.773  -6.779  -5.575
    5    HG2  MET  14           HG2      MET  14 -11.340  -8.829  -6.848
    6    HG3  MET  14           HG3      MET  14 -10.548  -8.158  -8.274
    7    HE3  MET  14           HE1      MET  14  -7.036  -8.172  -7.883
    8    HE2  MET  14           HE2      MET  14  -7.610  -6.820  -6.909
    9    HE1  MET  14           HE3      MET  14  -8.472  -7.264  -8.381

  No H/Q in entry =           9
  In of MODEL   44
    1    H    SER  15           H        SER  15 -13.207  -6.563  -4.874
    2    HA   SER  15           HA       SER  15 -14.490  -9.081  -5.477
    3    HB2  SER  15           HB2      SER  15 -14.654  -7.286  -3.054
    4    HB3  SER  15           HB3      SER  15 -15.700  -8.690  -3.251
    5    HG   SER  15           HG       SER  15 -12.881  -8.566  -3.024

  No H/Q in entry =           5
  In of MODEL   44
    1    H    THR  16           H        THR  16 -15.654  -5.726  -5.095
    2    HA   THR  16           HA       THR  16 -18.447  -6.296  -5.516
    3    HB   THR  16           HB       THR  16 -16.964  -3.726  -6.167
    4    HG1  THR  16           HG1      THR  16 -16.832  -4.852  -3.927
    5   HG22  THR  16          HG21      THR  16 -19.174  -2.748  -5.481
    6   HG21  THR  16          HG22      THR  16 -19.821  -4.395  -5.400
    7   HG23  THR  16          HG23      THR  16 -19.251  -3.732  -6.937

  No H/Q in entry =           7
  In of MODEL   44
    1    H    SER  17           H        SER  17 -15.703  -5.700  -7.460
    2    HA   SER  17           HA       SER  17 -16.888  -5.097  -9.972
    3    HB2  SER  17           HB2      SER  17 -14.207  -6.302  -9.257
    4    HB3  SER  17           HB3      SER  17 -14.686  -5.947 -10.917
    5    HG   SER  17           HG       SER  17 -14.839  -3.985  -8.904

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU  18           H        LEU  18 -16.196  -8.161  -8.410
    2    HA   LEU  18           HA       LEU  18 -16.764  -9.772 -10.695
    3    HB2  LEU  18           HB2      LEU  18 -15.488 -10.633  -8.793
    4    HB3  LEU  18           HB3      LEU  18 -16.887 -10.415  -7.744
    5    HG   LEU  18           HG       LEU  18 -18.132 -12.032  -9.201
    6   HD11  LEU  18          HD11      LEU  18 -15.405 -12.190 -10.465
    7   HD13  LEU  18          HD12      LEU  18 -16.973 -12.002 -11.249
    8   HD12  LEU  18          HD13      LEU  18 -16.525 -13.549 -10.532
    9   HD22  LEU  18          HD21      LEU  18 -17.207 -13.949  -8.168
   10   HD21  LEU  18          HD22      LEU  18 -17.020 -12.594  -7.054
   11   HD23  LEU  18          HD23      LEU  18 -15.636 -13.165  -7.984

  No H/Q in entry =          11
  In of MODEL   44
    1    H    LEU  19           H        LEU  19 -18.735  -8.523  -8.004
    2    HA   LEU  19           HA       LEU  19 -21.168  -9.819  -8.753
    3    HB2  LEU  19           HB2      LEU  19 -20.853  -8.863  -6.537
    4    HB3  LEU  19           HB3      LEU  19 -20.712  -7.253  -7.237
    5    HG   LEU  19           HG       LEU  19 -23.049  -7.230  -7.803
    6   HD11  LEU  19          HD11      LEU  19 -22.865 -10.121  -7.100
    7   HD13  LEU  19          HD12      LEU  19 -23.744  -9.337  -8.411
    8   HD12  LEU  19          HD13      LEU  19 -24.376  -9.274  -6.768
    9   HD23  LEU  19          HD21      LEU  19 -23.942  -7.744  -5.388
   10   HD22  LEU  19          HD22      LEU  19 -22.835  -6.403  -5.687
   11   HD21  LEU  19          HD23      LEU  19 -22.224  -7.922  -5.033

  No H/Q in entry =          11
  In of MODEL   44
    1    H    VAL  20           H        VAL  20 -19.788  -6.641  -9.594
    2    HA   VAL  20           HA       VAL  20 -21.955  -5.733 -11.171
    3    HB   VAL  20           HB       VAL  20 -18.990  -5.049 -11.373
    4   HG12  VAL  20          HG11      VAL  20 -19.746  -3.068 -12.692
    5   HG11  VAL  20          HG12      VAL  20 -21.360  -3.776 -12.766
    6   HG13  VAL  20          HG13      VAL  20 -20.001  -4.596 -13.536
    7   HG22  VAL  20          HG21      VAL  20 -19.813  -4.260  -9.328
    8   HG21  VAL  20          HG22      VAL  20 -21.345  -3.760 -10.040
    9   HG23  VAL  20          HG23      VAL  20 -19.869  -2.867 -10.409

  No H/Q in entry =           9
  In of MODEL   44
    1    H    SER  21           H        SER  21 -19.145  -7.730 -12.158
    2    HA   SER  21           HA       SER  21 -19.970  -7.754 -14.899
    3    HB2  SER  21           HB2      SER  21 -18.473  -9.684 -15.176
    4    HB3  SER  21           HB3      SER  21 -17.674  -8.376 -14.307
    5    HG   SER  21           HG       SER  21 -18.107  -9.483 -12.383

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LYS  22           H        LYS  22 -20.926  -9.869 -12.227
    2    HA   LYS  22           HA       LYS  22 -22.435 -11.611 -13.961
    3    HB2  LYS  22           HB2      LYS  22 -22.516 -11.154 -10.981
    4    HB3  LYS  22           HB3      LYS  22 -23.562 -12.306 -11.811
    5    HG2  LYS  22           HG2      LYS  22 -21.581 -13.542 -12.573
    6    HG3  LYS  22           HG3      LYS  22 -20.551 -12.403 -11.708
    7    HD2  LYS  22           HD2      LYS  22 -20.691 -14.163 -10.212
    8    HD3  LYS  22           HD3      LYS  22 -21.961 -13.082  -9.636
    9    HE2  LYS  22           HE2      LYS  22 -22.768 -15.377  -9.655
   10    HE3  LYS  22           HE3      LYS  22 -23.638 -14.422 -10.856
   11    HZ3  LYS  22           HZ1      LYS  22 -23.153 -16.061 -12.240
   12    HZ2  LYS  22           HZ2      LYS  22 -21.986 -16.731 -11.204
   13    HZ1  LYS  22           HZ3      LYS  22 -21.562 -15.464 -12.252

  No H/Q in entry =          13
  In of MODEL   44
    1    H    MET  23           H        MET  23 -23.228  -8.641 -12.198
    2    HA   MET  23           HA       MET  23 -26.039  -8.829 -12.659
    3    HB2  MET  23           HB2      MET  23 -24.260  -6.443 -12.204
    4    HB3  MET  23           HB3      MET  23 -26.011  -6.336 -12.364
    5    HG2  MET  23           HG2      MET  23 -26.334  -7.572 -10.339
    6    HG3  MET  23           HG3      MET  23 -24.609  -7.924 -10.222
    7    HE2  MET  23           HE1      MET  23 -27.007  -4.302  -9.144
    8    HE1  MET  23           HE2      MET  23 -27.251  -5.336 -10.551
    9    HE3  MET  23           HE3      MET  23 -26.263  -3.880 -10.686

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ARG  24           H        ARG  24 -23.357  -7.386 -14.538
    2    HA   ARG  24           HA       ARG  24 -24.922  -6.214 -16.564
    3    HB2  ARG  24           HB2      ARG  24 -22.069  -7.252 -16.581
    4    HB3  ARG  24           HB3      ARG  24 -22.786  -6.448 -17.956
    5    HG2  ARG  24           HG2      ARG  24 -23.077  -4.362 -16.637
    6    HG3  ARG  24           HG3      ARG  24 -22.389  -5.189 -15.214
    7    HD2  ARG  24           HD2      ARG  24 -20.969  -4.936 -17.903
    8    HD3  ARG  24           HD3      ARG  24 -20.728  -3.834 -16.555
    9    HE   ARG  24           HE       ARG  24 -20.139  -6.116 -15.372
   10   HH21  ARG  24          HH11      ARG  24 -17.981  -5.931 -14.767
   11   HH22  ARG  24          HH12      ARG  24 -16.772  -5.664 -15.973
   12   HH11  ARG  24          HH21      ARG  24 -19.223  -5.057 -18.454
   13   HH12  ARG  24          HH22      ARG  24 -17.517  -5.158 -18.153

  No H/Q in entry =          13
  In of MODEL   44
    1    H    ALA  25           H        ALA  25 -23.693  -9.503 -16.175
    2    HA   ALA  25           HA       ALA  25 -24.331 -10.455 -18.769
    3    HB1  ALA  25           HB1      ALA  25 -23.562 -12.436 -18.005
    4    HB3  ALA  25           HB2      ALA  25 -24.601 -12.393 -16.581
    5    HB2  ALA  25           HB3      ALA  25 -23.071 -11.518 -16.583

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLN  26           H        GLN  26 -26.113 -10.431 -15.720
    2    HA   GLN  26           HA       GLN  26 -28.433 -11.743 -16.654
    3    HB2  GLN  26           HB2      GLN  26 -27.942  -9.889 -14.344
    4    HB3  GLN  26           HB3      GLN  26 -29.486 -10.672 -14.644
    5    HG2  GLN  26           HG2      GLN  26 -26.852 -12.031 -14.157
    6    HG3  GLN  26           HG3      GLN  26 -28.199 -11.926 -13.032
    7   HE21  GLN  26          HE21      GLN  26 -26.934 -14.101 -14.242
    8   HE22  GLN  26          HE22      GLN  26 -27.954 -15.210 -14.983

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ALA  27           H        ALA  27 -27.598  -8.306 -16.407
    2    HA   ALA  27           HA       ALA  27 -30.130  -7.320 -17.196
    3    HB1  ALA  27           HB1      ALA  27 -28.346  -5.909 -16.158
    4    HB3  ALA  27           HB2      ALA  27 -28.979  -5.219 -17.654
    5    HB2  ALA  27           HB3      ALA  27 -27.418  -6.039 -17.654

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLU  28           H        GLU  28 -27.418  -8.532 -19.056
    2    HA   GLU  28           HA       GLU  28 -28.418  -7.618 -21.600
    3    HB2  GLU  28           HB2      GLU  28 -26.012  -8.205 -20.985
    4    HB3  GLU  28           HB3      GLU  28 -26.508  -9.892 -21.116
    5    HG2  GLU  28           HG2      GLU  28 -25.412  -9.157 -23.128
    6    HG3  GLU  28           HG3      GLU  28 -27.104  -9.544 -23.440

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LYS  29           H        LYS  29 -28.467 -10.662 -19.824
    2    HA   LYS  29           HA       LYS  29 -29.753 -12.246 -21.753
    3    HB2  LYS  29           HB2      LYS  29 -28.647 -13.121 -19.728
    4    HB3  LYS  29           HB3      LYS  29 -29.926 -12.415 -18.742
    5    HG2  LYS  29           HG2      LYS  29 -31.558 -13.875 -19.733
    6    HG3  LYS  29           HG3      LYS  29 -30.356 -14.517 -20.850
    7    HD2  LYS  29           HD2      LYS  29 -29.155 -15.582 -19.091
    8    HD3  LYS  29           HD3      LYS  29 -30.070 -14.721 -17.855
    9    HE2  LYS  29           HE2      LYS  29 -30.755 -17.104 -18.118
   10    HE3  LYS  29           HE3      LYS  29 -32.073 -15.960 -18.388
   11    HZ1  LYS  29           HZ1      LYS  29 -31.536 -16.169 -20.816
   12    HZ3  LYS  29           HZ2      LYS  29 -32.205 -17.551 -20.089
   13    HZ2  LYS  29           HZ3      LYS  29 -30.541 -17.483 -20.412

  No H/Q in entry =          13
  In of MODEL   44
    1    H    TYR  30           H        TYR  30 -31.174 -10.090 -19.310
    2    HA   TYR  30           HA       TYR  30 -33.838 -10.665 -20.495
    3    HB2  TYR  30           HB2      TYR  30 -33.184  -9.390 -17.828
    4    HB3  TYR  30           HB3      TYR  30 -34.801  -9.721 -18.448
    5    HD1  TYR  30           HD1      TYR  30 -35.644 -12.045 -18.562
    6    HD2  TYR  30           HD2      TYR  30 -31.811 -11.144 -16.942
    7    HE1  TYR  30           HE1      TYR  30 -35.473 -14.337 -17.680
    8    HE2  TYR  30           HE2      TYR  30 -31.641 -13.422 -16.064
    9    HH   TYR  30           HH       TYR  30 -33.223 -15.871 -17.045

  No H/Q in entry =           9
  In of MODEL   44
    1    H    GLU  31           H        GLU  31 -31.745  -8.641 -21.400
    2    HA   GLU  31           HA       GLU  31 -31.748  -6.515 -22.304
    3    HB2  GLU  31           HB2      GLU  31 -34.626  -7.337 -22.747
    4    HB3  GLU  31           HB3      GLU  31 -33.838  -5.974 -23.540
    5    HG2  GLU  31           HG2      GLU  31 -32.339  -7.410 -24.698
    6    HG3  GLU  31           HG3      GLU  31 -32.848  -8.805 -23.749

  No H/Q in entry =           6
  In of MODEL   44
    1    H    VAL  32           H        VAL  32 -31.914  -6.317 -19.575
    2    HA   VAL  32           HA       VAL  32 -33.832  -4.238 -18.969
    3    HB   VAL  32           HB       VAL  32 -31.389  -5.097 -17.386
    4   HG12  VAL  32          HG11      VAL  32 -32.924  -4.250 -15.501
    5   HG11  VAL  32          HG12      VAL  32 -33.802  -3.420 -16.786
    6   HG13  VAL  32          HG13      VAL  32 -32.101  -3.053 -16.502
    7   HG21  VAL  32          HG21      VAL  32 -33.111  -6.896 -17.984
    8   HG23  VAL  32          HG22      VAL  32 -34.160  -6.058 -16.841
    9   HG22  VAL  32          HG23      VAL  32 -32.615  -6.714 -16.302

  No H/Q in entry =           9
  In of MODEL   44
    1    HA   PRO  33           HA       PRO  33 -30.916  -1.283 -20.794
    2    HB2  PRO  33           HB2      PRO  33 -32.496   0.895 -20.731
    3    HB3  PRO  33           HB3      PRO  33 -32.937  -0.461 -21.768
    4    HG2  PRO  33           HG2      PRO  33 -33.884   0.130 -18.964
    5    HG3  PRO  33           HG3      PRO  33 -34.861  -0.163 -20.402
    6    HD2  PRO  33           HD2      PRO  33 -34.317  -2.156 -18.668
    7    HD3  PRO  33           HD3      PRO  33 -34.395  -2.465 -20.402

  No H/Q in entry =           7
  In of MODEL   44
    1    H    VAL  34           H        VAL  34 -29.610  -1.713 -18.845
    2    HA   VAL  34           HA       VAL  34 -29.382   0.780 -17.293
    3    HB   VAL  34           HB       VAL  34 -28.728  -0.588 -15.311
    4   HG12  VAL  34          HG11      VAL  34 -31.107  -1.525 -14.936
    5   HG11  VAL  34          HG12      VAL  34 -31.468  -0.835 -16.517
    6   HG13  VAL  34          HG13      VAL  34 -30.929   0.209 -15.202
    7   HG21  VAL  34          HG21      VAL  34 -28.875  -2.693 -17.240
    8   HG23  VAL  34          HG22      VAL  34 -29.902  -3.036 -15.846
    9   HG22  VAL  34          HG23      VAL  34 -28.190  -2.685 -15.615

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ILE  35           H        ILE  35 -27.410   1.309 -16.499
    2    HA   ILE  35           HA       ILE  35 -25.080   0.008 -17.746
    3    HB   ILE  35           HB       ILE  35 -25.563   2.912 -17.037
    4   HG12  ILE  35          HG12      ILE  35 -24.573   1.543 -19.546
    5   HG13  ILE  35          HG13      ILE  35 -26.219   2.120 -19.284
    6   HG21  ILE  35          HG21      ILE  35 -22.957   1.451 -17.326
    7   HG23  ILE  35          HG22      ILE  35 -23.433   2.661 -16.135
    8   HG22  ILE  35          HG23      ILE  35 -23.090   3.145 -17.796
    9   HD11  ILE  35          HD11      ILE  35 -24.882   4.379 -18.786
   10   HD13  ILE  35          HD12      ILE  35 -25.429   3.918 -20.399
   11   HD12  ILE  35          HD13      ILE  35 -23.759   3.621 -19.914

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ILE  36           H        ILE  36 -23.795  -0.915 -16.128
    2    HA   ILE  36           HA       ILE  36 -24.217  -0.207 -13.276
    3    HB   ILE  36           HB       ILE  36 -23.316  -2.921 -14.295
    4   HG12  ILE  36          HG12      ILE  36 -26.138  -2.179 -13.520
    5   HG13  ILE  36          HG13      ILE  36 -25.590  -2.202 -15.197
    6   HG23  ILE  36          HG21      ILE  36 -23.611  -3.681 -12.147
    7   HG22  ILE  36          HG22      ILE  36 -24.774  -2.419 -11.740
    8   HG21  ILE  36          HG23      ILE  36 -23.056  -2.034 -11.849
    9   HD13  ILE  36          HD11      ILE  36 -25.685  -4.427 -15.318
   10   HD12  ILE  36          HD12      ILE  36 -26.735  -4.286 -13.908
   11   HD11  ILE  36          HD13      ILE  36 -25.022  -4.643 -13.700

  No H/Q in entry =          11
  In of MODEL   44
    1    H    GLU  37           H        GLU  37 -22.442   0.520 -12.222
    2    HA   GLU  37           HA       GLU  37 -19.740  -0.222 -13.148
    3    HB2  GLU  37           HB2      GLU  37 -20.717   2.562 -12.534
    4    HB3  GLU  37           HB3      GLU  37 -19.016   2.118 -12.681
    5    HG2  GLU  37           HG2      GLU  37 -19.362   1.545 -15.017
    6    HG3  GLU  37           HG3      GLU  37 -21.065   1.975 -14.873

  No H/Q in entry =           6
  In of MODEL   44
    1    H    ALA  38           H        ALA  38 -18.223  -0.348 -11.480
    2    HA   ALA  38           HA       ALA  38 -19.222  -0.100  -8.702
    3    HB1  ALA  38           HB1      ALA  38 -17.464  -2.033 -10.082
    4    HB3  ALA  38           HB2      ALA  38 -18.486  -2.251  -8.660
    5    HB2  ALA  38           HB3      ALA  38 -16.894  -1.508  -8.497

  No H/Q in entry =           5
  In of MODEL   44
    1    H    PHE  39           H        PHE  39 -18.003   1.204  -7.293
    2    HA   PHE  39           HA       PHE  39 -15.533   2.456  -8.272
    3    HB2  PHE  39           HB2      PHE  39 -17.919   3.938  -7.166
    4    HB3  PHE  39           HB3      PHE  39 -16.314   4.641  -7.352
    5    HD1  PHE  39           HD1      PHE  39 -15.322   4.766  -9.668
    6    HD2  PHE  39           HD2      PHE  39 -19.435   3.918  -8.926
    7    HE1  PHE  39           HE1      PHE  39 -15.866   5.428 -11.993
    8    HE2  PHE  39           HE2      PHE  39 -19.992   4.569 -11.241
    9    HZ   PHE  39           HZ       PHE  39 -18.210   5.297 -12.791

  No H/Q in entry =           9
  In of MODEL   44
    1    HA   PRO  40           HA       PRO  40 -14.510   1.895  -3.975
    2    HB2  PRO  40           HB2      PRO  40 -12.804   3.989  -3.469
    3    HB3  PRO  40           HB3      PRO  40 -12.330   2.637  -4.497
    4    HG2  PRO  40           HG2      PRO  40 -13.463   5.307  -5.323
    5    HG3  PRO  40           HG3      PRO  40 -12.014   4.497  -5.919
    6    HD2  PRO  40           HD2      PRO  40 -14.251   4.271  -7.295
    7    HD3  PRO  40           HD3      PRO  40 -13.241   2.846  -7.059

  No H/Q in entry =           7
  In of MODEL   44
    1    H    GLU  41           H        GLU  41 -15.136   2.931  -1.874
    2    HA   GLU  41           HA       GLU  41 -17.438   4.555  -1.886
    3    HB2  GLU  41           HB2      GLU  41 -17.199   4.632   0.513
    4    HB3  GLU  41           HB3      GLU  41 -16.808   3.008  -0.053
    5    HG2  GLU  41           HG2      GLU  41 -14.420   3.497   0.184
    6    HG3  GLU  41           HG3      GLU  41 -14.809   5.124   0.745

  No H/Q in entry =           6
  In of MODEL   44
    1    H    THR  42           H        THR  42 -14.142   5.585  -2.022
    2    HA   THR  42           HA       THR  42 -14.569   8.175  -0.901
    3    HB   THR  42           HB       THR  42 -12.450   8.783  -2.044
    4    HG1  THR  42           HG1      THR  42 -12.916   6.263  -3.242
    5   HG22  THR  42          HG21      THR  42 -11.062   6.873  -1.034
    6   HG21  THR  42          HG22      THR  42 -12.606   6.162  -0.561
    7   HG23  THR  42          HG23      THR  42 -12.138   7.742   0.062

  No H/Q in entry =           7
  In of MODEL   44
    1    H    LEU  43           H        LEU  43 -15.477   6.934  -3.944
    2    HA   LEU  43           HA       LEU  43 -15.842   9.657  -5.014
    3    HB2  LEU  43           HB2      LEU  43 -16.137   6.951  -6.305
    4    HB3  LEU  43           HB3      LEU  43 -16.400   8.494  -7.113
    5    HG   LEU  43           HG       LEU  43 -13.745   7.526  -6.084
    6   HD11  LEU  43          HD11      LEU  43 -14.876   6.323  -8.091
    7   HD13  LEU  43          HD12      LEU  43 -13.206   6.868  -8.243
    8   HD12  LEU  43          HD13      LEU  43 -14.509   7.811  -8.964
    9   HD23  LEU  43          HD21      LEU  43 -12.934   9.408  -7.545
   10   HD22  LEU  43          HD22      LEU  43 -13.829   9.918  -6.113
   11   HD21  LEU  43          HD23      LEU  43 -14.612   9.932  -7.693

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ALA  44           H        ALA  44 -17.696   7.836  -3.064
    2    HA   ALA  44           HA       ALA  44 -20.184   7.559  -4.343
    3    HB2  ALA  44           HB1      ALA  44 -19.978   6.527  -2.208
    4    HB3  ALA  44           HB2      ALA  44 -21.129   7.843  -1.969
    5    HB1  ALA  44           HB3      ALA  44 -19.455   8.029  -1.447

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLY  45           H        GLY  45 -18.845  10.463  -2.938
    2    HA3  GLY  45           HA2      GLY  45 -21.339  11.862  -3.316
    3    HA2  GLY  45           HA3      GLY  45 -19.810  12.561  -2.786

  No H/Q in entry =           3
  In of MODEL   44
    1    H    GLU  46           H        GLU  46 -18.278  11.594  -5.064
    2    HA   GLU  46           HA       GLU  46 -19.018  13.717  -6.905
    3    HB2  GLU  46           HB2      GLU  46 -16.754  11.714  -6.901
    4    HB3  GLU  46           HB3      GLU  46 -16.944  13.003  -8.090
    5    HG2  GLU  46           HG2      GLU  46 -15.404  13.895  -6.631
    6    HG3  GLU  46           HG3      GLU  46 -16.921  14.572  -6.039

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LYS  47           H        LYS  47 -18.779  10.191  -7.210
    2    HA   LYS  47           HA       LYS  47 -19.920  10.270  -9.875
    3    HB2  LYS  47           HB2      LYS  47 -19.244   7.968  -8.036
    4    HB3  LYS  47           HB3      LYS  47 -19.833   7.793  -9.689
    5    HG2  LYS  47           HG2      LYS  47 -17.329   9.301  -9.041
    6    HG3  LYS  47           HG3      LYS  47 -17.339   7.559  -9.312
    7    HD2  LYS  47           HD2      LYS  47 -18.384   7.925 -11.509
    8    HD3  LYS  47           HD3      LYS  47 -18.309   9.665 -11.238
    9    HE2  LYS  47           HE2      LYS  47 -15.875   9.543 -11.101
   10    HE3  LYS  47           HE3      LYS  47 -15.945   7.801 -11.356
   11    HZ2  LYS  47           HZ1      LYS  47 -16.499   9.979 -13.240
   12    HZ1  LYS  47           HZ2      LYS  47 -17.255   8.474 -13.457
   13    HZ3  LYS  47           HZ3      LYS  47 -15.559   8.580 -13.453

  No H/Q in entry =          13
  In of MODEL   44
    1    H    GLY  48           H        GLY  48 -21.173   9.587  -6.681
    2    HA3  GLY  48           HA2      GLY  48 -23.524   8.291  -7.341
    3    HA2  GLY  48           HA3      GLY  48 -23.314   9.346  -5.944

  No H/Q in entry =           3
  In of MODEL   44
    1    H    GLN  49           H        GLN  49 -22.839  11.727  -7.613
    2    HA   GLN  49           HA       GLN  49 -25.439  12.741  -7.760
    3    HB2  GLN  49           HB2      GLN  49 -22.947  13.642  -9.190
    4    HB3  GLN  49           HB3      GLN  49 -24.441  14.558  -9.119
    5    HG2  GLN  49           HG2      GLN  49 -24.249  14.680  -6.687
    6    HG3  GLN  49           HG3      GLN  49 -22.767  13.742  -6.755
    7   HE21  GLN  49          HE21      GLN  49 -22.712  16.020  -5.569
    8   HE22  GLN  49          HE22      GLN  49 -21.843  17.283  -6.277

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ASN  50           H        ASN  50 -23.727  10.832 -10.099
    2    HA   ASN  50           HA       ASN  50 -25.668  11.558 -12.184
    3    HB2  ASN  50           HB2      ASN  50 -23.038  10.102 -12.399
    4    HB3  ASN  50           HB3      ASN  50 -24.121  10.439 -13.742
    5   HD21  ASN  50          HD21      ASN  50 -21.495  11.437 -12.204
    6   HD22  ASN  50          HD22      ASN  50 -21.325  13.066 -12.610

  No H/Q in entry =           6
  In of MODEL   44
    1    H    ALA  51           H        ALA  51 -25.539   9.291  -9.852
    2    HA   ALA  51           HA       ALA  51 -26.272   7.053 -11.585
    3    HB2  ALA  51           HB1      ALA  51 -25.619   5.789  -9.859
    4    HB3  ALA  51           HB2      ALA  51 -26.754   6.599  -8.780
    5    HB1  ALA  51           HB3      ALA  51 -25.141   7.268  -9.025

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ASP  52           H        ASP  52 -28.238   5.934 -11.375
    2    HA   ASP  52           HA       ASP  52 -30.472   7.716 -10.746
    3    HB2  ASP  52           HB2      ASP  52 -30.217   5.157 -12.324
    4    HB3  ASP  52           HB3      ASP  52 -31.780   5.852 -11.894

  No H/Q in entry =           4
  In of MODEL   44
    1    H    VAL  53           H        VAL  53 -28.758   4.924  -9.647
    2    HA   VAL  53           HA       VAL  53 -30.167   5.097  -7.116
    3    HB   VAL  53           HB       VAL  53 -31.526   3.362  -8.276
    4   HG11  VAL  53          HG11      VAL  53 -29.771   2.506  -9.792
    5   HG13  VAL  53          HG12      VAL  53 -30.547   1.216  -8.872
    6   HG12  VAL  53          HG13      VAL  53 -28.949   1.792  -8.405
    7   HG23  VAL  53          HG21      VAL  53 -30.613   1.480  -6.523
    8   HG22  VAL  53          HG22      VAL  53 -31.781   2.758  -6.190
    9   HG21  VAL  53          HG23      VAL  53 -30.075   3.003  -5.815

  No H/Q in entry =           9
  In of MODEL   44
    1    H    VAL  54           H        VAL  54 -28.817   4.772  -5.465
    2    HA   VAL  54           HA       VAL  54 -26.038   3.993  -6.087
    3    HB   VAL  54           HB       VAL  54 -27.138   5.818  -3.889
    4   HG11  VAL  54          HG11      VAL  54 -24.516   4.476  -4.165
    5   HG13  VAL  54          HG12      VAL  54 -25.272   5.184  -2.739
    6   HG12  VAL  54          HG13      VAL  54 -24.418   6.215  -3.887
    7   HG22  VAL  54          HG21      VAL  54 -26.356   7.617  -5.069
    8   HG21  VAL  54          HG22      VAL  54 -26.888   6.559  -6.375
    9   HG23  VAL  54          HG23      VAL  54 -25.177   6.657  -5.963

  No H/Q in entry =           9
  In of MODEL   44
    1    H    LEU  55           H        LEU  55 -25.373   2.118  -5.381
    2    HA   LEU  55           HA       LEU  55 -26.806   0.841  -3.136
    3    HB2  LEU  55           HB2      LEU  55 -25.242  -0.361  -5.409
    4    HB3  LEU  55           HB3      LEU  55 -25.952  -1.271  -4.075
    5    HG   LEU  55           HG       LEU  55 -27.471   0.188  -6.228
    6   HD13  LEU  55          HD11      LEU  55 -27.126  -1.699  -7.382
    7   HD12  LEU  55          HD12      LEU  55 -28.036  -2.560  -6.141
    8   HD11  LEU  55          HD13      LEU  55 -26.283  -2.431  -6.019
    9   HD23  LEU  55          HD21      LEU  55 -28.674  -1.729  -4.283
   10   HD22  LEU  55          HD22      LEU  55 -29.427  -0.403  -5.170
   11   HD21  LEU  55          HD23      LEU  55 -28.396  -0.061  -3.781

  No H/Q in entry =          11
  In of MODEL   44
    1    H    LEU  56           H        LEU  56 -25.609   0.355  -1.327
    2    HA   LEU  56           HA       LEU  56 -22.691   0.845  -1.436
    3    HB2  LEU  56           HB2      LEU  56 -24.452   0.666   0.996
    4    HB3  LEU  56           HB3      LEU  56 -22.758   1.150   0.943
    5    HG   LEU  56           HG       LEU  56 -25.126   2.714  -0.048
    6   HD11  LEU  56          HD11      LEU  56 -23.964   2.466   2.468
    7   HD13  LEU  56          HD12      LEU  56 -25.007   3.781   1.926
    8   HD12  LEU  56          HD13      LEU  56 -23.255   3.940   1.807
    9   HD23  LEU  56          HD21      LEU  56 -23.242   4.468  -0.335
   10   HD22  LEU  56          HD22      LEU  56 -23.606   3.309  -1.614
   11   HD21  LEU  56          HD23      LEU  56 -22.227   3.042  -0.549

  No H/Q in entry =          11
  In of MODEL   44
    1    H    GLY  57           H        GLY  57 -21.250  -0.718  -0.862
    2    HA3  GLY  57           HA2      GLY  57 -22.085  -3.439  -0.944
    3    HA2  GLY  57           HA3      GLY  57 -20.473  -2.873  -0.509

  No H/Q in entry =           3
  In of MODEL   44
    1    HA   PRO  58           HA       PRO  58 -23.195  -3.862   3.280
    2    HB2  PRO  58           HB2      PRO  58 -22.414  -6.418   3.974
    3    HB3  PRO  58           HB3      PRO  58 -23.826  -6.094   2.967
    4    HG2  PRO  58           HG2      PRO  58 -21.082  -6.914   2.174
    5    HG3  PRO  58           HG3      PRO  58 -22.639  -7.450   1.543
    6    HD2  PRO  58           HD2      PRO  58 -21.109  -5.629   0.229
    7    HD3  PRO  58           HD3      PRO  58 -22.872  -5.605   0.150

  No H/Q in entry =           7
  In of MODEL   44
    1    H    GLN  59           H        GLN  59 -19.818  -4.246   2.641
    2    HA   GLN  59           HA       GLN  59 -19.025  -4.134   5.388
    3    HB2  GLN  59           HB2      GLN  59 -17.330  -3.046   3.168
    4    HB3  GLN  59           HB3      GLN  59 -16.835  -3.850   4.644
    5    HG2  GLN  59           HG2      GLN  59 -16.441  -5.520   3.157
    6    HG3  GLN  59           HG3      GLN  59 -18.115  -5.884   3.543
    7   HE21  GLN  59          HE21      GLN  59 -16.047  -5.013   1.288
    8   HE22  GLN  59          HE22      GLN  59 -16.789  -4.855  -0.193

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ILE  60           H        ILE  60 -20.073  -1.701   3.100
    2    HA   ILE  60           HA       ILE  60 -19.257   0.359   5.057
    3    HB   ILE  60           HB       ILE  60 -19.060   1.962   3.360
    4   HG12  ILE  60          HG12      ILE  60 -20.635   0.133   1.549
    5   HG13  ILE  60          HG13      ILE  60 -21.216   1.626   2.287
    6   HG22  ILE  60          HG21      ILE  60 -17.697   0.969   1.592
    7   HG21  ILE  60          HG22      ILE  60 -18.232  -0.632   2.103
    8   HG23  ILE  60          HG23      ILE  60 -17.277   0.370   3.196
    9   HD12  ILE  60          HD11      ILE  60 -20.469   1.701  -0.184
   10   HD11  ILE  60          HD12      ILE  60 -18.828   1.634   0.458
   11   HD13  ILE  60          HD13      ILE  60 -19.891   2.973   0.892

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ALA  61           H        ALA  61 -21.658  -1.301   5.223
    2    HA   ALA  61           HA       ALA  61 -23.944   0.272   4.735
    3    HB1  ALA  61           HB1      ALA  61 -25.092  -1.205   6.135
    4    HB2  ALA  61           HB2      ALA  61 -23.668  -1.511   7.130
    5    HB3  ALA  61           HB3      ALA  61 -23.766  -2.182   5.503

  No H/Q in entry =           5
  In of MODEL   44
    1    H    TYR  62           H        TYR  62 -21.696   0.338   7.502
    2    HA   TYR  62           HA       TYR  62 -23.281   2.006   9.132
    3    HB2  TYR  62           HB2      TYR  62 -21.236   2.548  10.315
    4    HB3  TYR  62           HB3      TYR  62 -21.250   0.828   9.923
    5    HD1  TYR  62           HD1      TYR  62 -19.663  -0.101   8.291
    6    HD2  TYR  62           HD2      TYR  62 -19.589   4.054   9.287
    7    HE1  TYR  62           HE1      TYR  62 -17.473   0.122   7.179
    8    HE2  TYR  62           HE2      TYR  62 -17.385   4.272   8.178
    9    HH   TYR  62           HH       TYR  62 -15.784   1.437   6.792

  No H/Q in entry =           9
  In of MODEL   44
    1    H    MET  63           H        MET  63 -21.708   2.808   6.221
    2    HA   MET  63           HA       MET  63 -21.623   5.669   6.805
    3    HB2  MET  63           HB2      MET  63 -21.001   4.069   4.321
    4    HB3  MET  63           HB3      MET  63 -20.866   5.826   4.430
    5    HG2  MET  63           HG2      MET  63 -19.119   5.605   6.093
    6    HG3  MET  63           HG3      MET  63 -19.274   3.850   6.045
    7    HE3  MET  63           HE1      MET  63 -18.880   6.406   2.563
    8    HE2  MET  63           HE2      MET  63 -17.355   6.755   3.378
    9    HE1  MET  63           HE3      MET  63 -18.881   6.950   4.242

  No H/Q in entry =           9
  In of MODEL   44
    1    H    LEU  64           H        LEU  64 -24.139   3.699   5.950
    2    HA   LEU  64           HA       LEU  64 -25.423   4.997   3.838
    3    HB2  LEU  64           HB2      LEU  64 -26.210   2.902   4.849
    4    HB3  LEU  64           HB3      LEU  64 -26.673   3.785   6.302
    5    HG   LEU  64           HG       LEU  64 -28.425   4.938   5.053
    6   HD13  LEU  64          HD11      LEU  64 -28.181   5.102   2.810
    7   HD12  LEU  64          HD12      LEU  64 -28.776   3.442   2.736
    8   HD11  LEU  64          HD13      LEU  64 -27.041   3.758   2.757
    9   HD23  LEU  64          HD21      LEU  64 -28.864   2.083   4.421
   10   HD22  LEU  64          HD22      LEU  64 -29.874   3.220   5.312
   11   HD21  LEU  64          HD23      LEU  64 -28.464   2.500   6.087

  No H/Q in entry =          11
  In of MODEL   44
    1    HA   PRO  65           HA       PRO  65 -27.663   8.184   6.502
    2    HB2  PRO  65           HB2      PRO  65 -25.636   8.491   8.717
    3    HB3  PRO  65           HB3      PRO  65 -27.383   8.719   8.779
    4    HG2  PRO  65           HG2      PRO  65 -26.370   6.531   9.776
    5    HG3  PRO  65           HG3      PRO  65 -27.803   6.415   8.755
    6    HD2  PRO  65           HD2      PRO  65 -24.923   5.863   8.031
    7    HD3  PRO  65           HD3      PRO  65 -26.358   4.915   7.641

  No H/Q in entry =           7
  In of MODEL   44
    1    H    GLU  66           H        GLU  66 -24.107   8.241   6.523
    2    HA   GLU  66           HA       GLU  66 -23.903  11.029   6.007
    3    HB2  GLU  66           HB2      GLU  66 -22.029   8.756   5.416
    4    HB3  GLU  66           HB3      GLU  66 -21.634  10.452   5.138
    5    HG2  GLU  66           HG2      GLU  66 -21.823  10.906   7.492
    6    HG3  GLU  66           HG3      GLU  66 -22.294   9.233   7.795

  No H/Q in entry =           6
  In of MODEL   44
    1    H    ILE  67           H        ILE  67 -23.952   8.198   3.862
    2    HA   ILE  67           HA       ILE  67 -23.621   9.829   1.499
    3    HB   ILE  67           HB       ILE  67 -24.428   6.906   1.804
    4   HG12  ILE  67          HG12      ILE  67 -21.848   8.118   0.797
    5   HG13  ILE  67          HG13      ILE  67 -22.106   7.755   2.503
    6   HG21  ILE  67          HG21      ILE  67 -24.460   8.698  -0.492
    7   HG23  ILE  67          HG22      ILE  67 -25.033   7.035  -0.369
    8   HG22  ILE  67          HG23      ILE  67 -23.340   7.358  -0.734
    9   HD12  ILE  67          HD11      ILE  67 -21.666   5.907   0.215
   10   HD11  ILE  67          HD12      ILE  67 -22.643   5.356   1.574
   11   HD13  ILE  67          HD13      ILE  67 -20.981   5.881   1.840

  No H/Q in entry =          11
  In of MODEL   44
    1    H    GLN  68           H        GLN  68 -26.434   8.754   3.216
    2    HA   GLN  68           HA       GLN  68 -28.319   9.555   1.238
    3    HB2  GLN  68           HB2      GLN  68 -28.521   9.305   4.235
    4    HB3  GLN  68           HB3      GLN  68 -29.871   9.822   3.241
    5    HG2  GLN  68           HG2      GLN  68 -29.858   7.745   2.043
    6    HG3  GLN  68           HG3      GLN  68 -28.380   7.241   2.844
    7   HE21  GLN  68          HE21      GLN  68 -30.520   5.817   2.794
    8   HE22  GLN  68          HE22      GLN  68 -31.315   5.391   4.238

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ARG  69           H        ARG  69 -26.723  11.370   3.885
    2    HA   ARG  69           HA       ARG  69 -28.164  13.795   3.407
    3    HB2  ARG  69           HB2      ARG  69 -25.771  12.993   4.992
    4    HB3  ARG  69           HB3      ARG  69 -25.904  14.695   4.570
    5    HG2  ARG  69           HG2      ARG  69 -28.207  14.709   5.576
    6    HG3  ARG  69           HG3      ARG  69 -27.943  13.045   6.110
    7    HD2  ARG  69           HD2      ARG  69 -26.305  15.480   6.908
    8    HD3  ARG  69           HD3      ARG  69 -27.394  14.582   7.954
    9    HE   ARG  69           HE       ARG  69 -24.770  13.688   6.998
   10   HH21  ARG  69          HH11      ARG  69 -23.895  11.994   8.247
   11   HH22  ARG  69          HH12      ARG  69 -24.883  11.194   9.422
   12   HH11  ARG  69          HH21      ARG  69 -27.686  13.124   8.762
   13   HH12  ARG  69          HH22      ARG  69 -27.029  11.830   9.711

  No H/Q in entry =          13
  In of MODEL   44
    1    H    LEU  70           H        LEU  70 -25.275  12.418   2.056
    2    HA   LEU  70           HA       LEU  70 -24.245  14.768   0.783
    3    HB2  LEU  70           HB2      LEU  70 -23.178  12.502   1.448
    4    HB3  LEU  70           HB3      LEU  70 -23.802  11.959  -0.109
    5    HG   LEU  70           HG       LEU  70 -22.264  13.333  -1.270
    6   HD11  LEU  70          HD11      LEU  70 -21.426  14.304   1.470
    7   HD13  LEU  70          HD12      LEU  70 -22.167  15.271   0.196
    8   HD12  LEU  70          HD13      LEU  70 -20.541  14.626  -0.023
    9   HD22  LEU  70          HD21      LEU  70 -20.781  11.666  -0.995
   10   HD21  LEU  70          HD22      LEU  70 -21.671  11.172   0.445
   11   HD23  LEU  70          HD23      LEU  70 -20.313  12.290   0.586

  No H/Q in entry =          11
  In of MODEL   44
    1    H    LEU  71           H        LEU  71 -26.344  12.127  -0.203
    2    HA   LEU  71           HA       LEU  71 -26.946  13.503  -2.765
    3    HB2  LEU  71           HB2      LEU  71 -27.065  10.533  -2.203
    4    HB3  LEU  71           HB3      LEU  71 -27.239  11.331  -3.766
    5    HG   LEU  71           HG       LEU  71 -24.696  11.473  -2.146
    6   HD12  LEU  71          HD11      LEU  71 -24.741   9.753  -4.514
    7   HD11  LEU  71          HD12      LEU  71 -25.715   9.154  -3.174
    8   HD13  LEU  71          HD13      LEU  71 -23.999   9.488  -2.936
    9   HD22  LEU  71          HD21      LEU  71 -24.870  13.228  -3.705
   10   HD21  LEU  71          HD22      LEU  71 -25.358  12.123  -4.989
   11   HD23  LEU  71          HD23      LEU  71 -23.724  12.044  -4.332

  No H/Q in entry =          11
  In of MODEL   44
    1    HA   PRO  72           HA       PRO  72 -30.760  13.055  -0.067
    2    HB2  PRO  72           HB2      PRO  72 -31.685  15.587  -0.231
    3    HB3  PRO  72           HB3      PRO  72 -30.349  15.211   0.856
    4    HG2  PRO  72           HG2      PRO  72 -30.234  16.304  -1.944
    5    HG3  PRO  72           HG3      PRO  72 -29.460  16.931  -0.488
    6    HD2  PRO  72           HD2      PRO  72 -28.110  15.340  -2.216
    7    HD3  PRO  72           HD3      PRO  72 -27.825  15.247  -0.479

  No H/Q in entry =           7
  In of MODEL   44
    1    H    ASN  73           H        ASN  73 -30.209  13.902  -3.325
    2    HA   ASN  73           HA       ASN  73 -33.070  13.499  -3.900
    3    HB2  ASN  73           HB2      ASN  73 -32.663  14.536  -6.045
    4    HB3  ASN  73           HB3      ASN  73 -32.145  15.579  -4.729
    5   HD21  ASN  73          HD21      ASN  73 -31.391  15.541  -7.418
    6   HD22  ASN  73          HD22      ASN  73 -29.723  15.414  -7.632

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LYS  74           H        LYS  74 -31.028  11.310  -3.422
    2    HA   LYS  74           HA       LYS  74 -31.598   9.806  -5.906
    3    HB2  LYS  74           HB2      LYS  74 -29.036   9.636  -4.315
    4    HB3  LYS  74           HB3      LYS  74 -29.421   8.758  -5.796
    5    HG2  LYS  74           HG2      LYS  74 -29.226  11.739  -5.710
    6    HG3  LYS  74           HG3      LYS  74 -27.831  10.699  -5.996
    7    HD2  LYS  74           HD2      LYS  74 -28.955   9.671  -7.885
    8    HD3  LYS  74           HD3      LYS  74 -30.393  10.646  -7.580
    9    HE2  LYS  74           HE2      LYS  74 -29.223  12.662  -8.116
   10    HE3  LYS  74           HE3      LYS  74 -27.683  11.806  -8.198
   11    HZ2  LYS  74           HZ1      LYS  74 -29.199  12.293 -10.322
   12    HZ1  LYS  74           HZ2      LYS  74 -29.811  10.771  -9.882
   13    HZ3  LYS  74           HZ3      LYS  74 -28.155  10.957 -10.210

  No H/Q in entry =          13
  In of MODEL   44
    1    HA   PRO  75           HA       PRO  75 -32.877   6.904  -2.803
    2    HB2  PRO  75           HB2      PRO  75 -33.157   4.621  -4.295
    3    HB3  PRO  75           HB3      PRO  75 -34.316   5.945  -4.399
    4    HG2  PRO  75           HG2      PRO  75 -31.992   5.336  -6.182
    5    HG3  PRO  75           HG3      PRO  75 -33.656   5.717  -6.620
    6    HD2  PRO  75           HD2      PRO  75 -31.759   7.627  -6.677
    7    HD3  PRO  75           HD3      PRO  75 -33.392   8.009  -6.128

  No H/Q in entry =           7
  In of MODEL   44
    1    H    VAL  76           H        VAL  76 -31.380   5.936  -1.414
    2    HA   VAL  76           HA       VAL  76 -28.903   4.742  -2.514
    3    HB   VAL  76           HB       VAL  76 -29.187   6.302   0.091
    4   HG11  VAL  76          HG11      VAL  76 -26.821   5.016  -1.288
    5   HG13  VAL  76          HG12      VAL  76 -27.484   4.610   0.297
    6   HG12  VAL  76          HG13      VAL  76 -26.677   6.158   0.050
    7   HG22  VAL  76          HG21      VAL  76 -28.576   8.182  -0.877
    8   HG21  VAL  76          HG22      VAL  76 -29.125   7.417  -2.369
    9   HG23  VAL  76          HG23      VAL  76 -27.415   7.385  -1.938

  No H/Q in entry =           9
  In of MODEL   44
    1    H    GLU  77           H        GLU  77 -28.626   2.619  -1.822
    2    HA   GLU  77           HA       GLU  77 -29.356   1.916   0.871
    3    HB2  GLU  77           HB2      GLU  77 -30.931   0.213   0.428
    4    HB3  GLU  77           HB3      GLU  77 -31.527   1.695  -0.323
    5    HG2  GLU  77           HG2      GLU  77 -30.932   0.868  -2.489
    6    HG3  GLU  77           HG3      GLU  77 -30.245  -0.587  -1.770

  No H/Q in entry =           6
  In of MODEL   44
    1    H    VAL  78           H        VAL  78 -28.970  -0.137   1.605
    2    HA   VAL  78           HA       VAL  78 -26.299  -0.880   0.705
    3    HB   VAL  78           HB       VAL  78 -27.952  -1.711   3.128
    4   HG11  VAL  78          HG11      VAL  78 -25.600  -2.928   2.015
    5   HG13  VAL  78          HG12      VAL  78 -26.475  -3.365   3.484
    6   HG12  VAL  78          HG13      VAL  78 -25.181  -2.168   3.550
    7   HG22  VAL  78          HG21      VAL  78 -26.506  -0.265   4.392
    8   HG21  VAL  78          HG22      VAL  78 -27.283   0.638   3.092
    9   HG23  VAL  78          HG23      VAL  78 -25.597   0.144   2.936

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ILE  79           H        ILE  79 -25.730  -2.808  -0.135
    2    HA   ILE  79           HA       ILE  79 -27.774  -4.384  -1.394
    3    HB   ILE  79           HB       ILE  79 -24.768  -4.833  -1.199
    4   HG12  ILE  79          HG12      ILE  79 -26.464  -3.855  -3.502
    5   HG13  ILE  79          HG13      ILE  79 -25.598  -2.782  -2.401
    6   HG22  ILE  79          HG21      ILE  79 -25.876  -6.126  -3.454
    7   HG21  ILE  79          HG22      ILE  79 -26.828  -6.617  -2.053
    8   HG23  ILE  79          HG23      ILE  79 -25.081  -6.854  -2.058
    9   HD13  ILE  79          HD11      ILE  79 -24.208  -2.933  -4.236
   10   HD12  ILE  79          HD12      ILE  79 -24.511  -4.657  -4.446
   11   HD11  ILE  79          HD13      ILE  79 -23.519  -4.094  -3.101

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ASP  80           H        ASP  80 -28.585  -6.304  -0.724
    2    HA   ASP  80           HA       ASP  80 -28.471  -7.099   1.954
    3    HB2  ASP  80           HB2      ASP  80 -30.235  -7.779   0.365
    4    HB3  ASP  80           HB3      ASP  80 -29.065  -8.792  -0.483

  No H/Q in entry =           4
  In of MODEL   44
    1    H    SER  81           H        SER  81 -26.892  -8.154   3.102
    2    HA   SER  81           HA       SER  81 -24.398  -8.823   1.900
    3    HB2  SER  81           HB2      SER  81 -23.791  -9.755   4.098
    4    HB3  SER  81           HB3      SER  81 -24.526  -8.160   4.260
    5    HG   SER  81           HG       SER  81 -25.273  -9.840   5.725

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU  82           H        LEU  82 -27.054 -10.963   2.343
    2    HA   LEU  82           HA       LEU  82 -25.457 -13.313   1.890
    3    HB2  LEU  82           HB2      LEU  82 -28.411 -12.774   1.659
    4    HB3  LEU  82           HB3      LEU  82 -27.674 -14.366   1.494
    5    HG   LEU  82           HG       LEU  82 -27.596 -12.697   3.988
    6   HD11  LEU  82          HD11      LEU  82 -29.356 -15.004   3.134
    7   HD13  LEU  82          HD12      LEU  82 -29.869 -13.378   3.589
    8   HD12  LEU  82          HD13      LEU  82 -29.197 -14.462   4.807
    9   HD23  LEU  82          HD21      LEU  82 -26.960 -15.056   4.849
   10   HD22  LEU  82          HD22      LEU  82 -25.737 -14.122   3.989
   11   HD21  LEU  82          HD23      LEU  82 -26.609 -15.410   3.157

  No H/Q in entry =          11
  In of MODEL   44
    1    H    LEU  83           H        LEU  83 -27.496 -11.210  -0.082
    2    HA   LEU  83           HA       LEU  83 -27.297 -12.657  -2.503
    3    HB2  LEU  83           HB2      LEU  83 -27.767  -9.737  -1.961
    4    HB3  LEU  83           HB3      LEU  83 -27.808 -10.447  -3.575
    5    HG   LEU  83           HG       LEU  83 -29.800 -10.796  -1.354
    6   HD13  LEU  83          HD11      LEU  83 -30.615  -9.009  -2.477
    7   HD12  LEU  83          HD12      LEU  83 -31.070 -10.182  -3.711
    8   HD11  LEU  83          HD13      LEU  83 -29.558  -9.285  -3.860
    9   HD23  LEU  83          HD21      LEU  83 -29.948 -12.162  -4.026
   10   HD22  LEU  83          HD22      LEU  83 -30.888 -12.478  -2.569
   11   HD21  LEU  83          HD23      LEU  83 -29.191 -12.944  -2.640

  No H/Q in entry =          11
  In of MODEL   44
    1    H    TYR  84           H        TYR  84 -25.378 -10.164  -0.949
    2    HA   TYR  84           HA       TYR  84 -23.559  -9.717  -3.126
    3    HB2  TYR  84           HB2      TYR  84 -24.109  -8.209  -1.087
    4    HB3  TYR  84           HB3      TYR  84 -22.943  -9.212  -0.227
    5    HD1  TYR  84           HD1      TYR  84 -20.651  -8.746  -0.358
    6    HD2  TYR  84           HD2      TYR  84 -23.301  -7.022  -3.228
    7    HE1  TYR  84           HE1      TYR  84 -18.786  -7.391  -1.249
    8    HE2  TYR  84           HE2      TYR  84 -21.444  -5.669  -4.135
    9    HH   TYR  84           HH       TYR  84 -19.154  -5.443  -4.133

  No H/Q in entry =           9
  In of MODEL   44
    1    H    GLY  85           H        GLY  85 -23.229 -11.597  -0.108
    2    HA3  GLY  85           HA2      GLY  85 -20.636 -12.499  -0.594
    3    HA2  GLY  85           HA3      GLY  85 -21.833 -13.336   0.395

  No H/Q in entry =           3
  In of MODEL   44
    1    H    LYS  86           H        LYS  86 -23.700 -13.832  -1.621
    2    HA   LYS  86           HA       LYS  86 -22.609 -16.228  -2.804
    3    HB2  LYS  86           HB2      LYS  86 -24.828 -16.171  -1.840
    4    HB3  LYS  86           HB3      LYS  86 -25.290 -14.848  -2.909
    5    HG2  LYS  86           HG2      LYS  86 -26.299 -16.924  -3.594
    6    HG3  LYS  86           HG3      LYS  86 -25.158 -16.349  -4.811
    7    HD2  LYS  86           HD2      LYS  86 -23.477 -17.874  -4.082
    8    HD3  LYS  86           HD3      LYS  86 -24.388 -18.285  -2.631
    9    HE2  LYS  86           HE2      LYS  86 -26.107 -19.346  -3.985
   10    HE3  LYS  86           HE3      LYS  86 -25.249 -18.889  -5.457
   11    HZ1  LYS  86           HZ1      LYS  86 -23.522 -20.224  -3.631
   12    HZ3  LYS  86           HZ2      LYS  86 -23.896 -20.620  -5.241
   13    HZ2  LYS  86           HZ3      LYS  86 -24.882 -21.182  -3.978

  No H/Q in entry =          13
  In of MODEL   44
    1    H    VAL  87           H        VAL  87 -22.687 -13.051  -3.822
    2    HA   VAL  87           HA       VAL  87 -22.444 -11.949  -5.811
    3    HB   VAL  87           HB       VAL  87 -21.378 -14.391  -7.201
    4   HG11  VAL  87          HG11      VAL  87 -21.408 -11.793  -7.865
    5   HG13  VAL  87          HG12      VAL  87 -20.082 -12.858  -8.336
    6   HG12  VAL  87          HG13      VAL  87 -19.913 -11.805  -6.932
    7   HG22  VAL  87          HG21      VAL  87 -20.447 -14.814  -5.062
    8   HG21  VAL  87          HG22      VAL  87 -20.046 -13.115  -4.828
    9   HG23  VAL  87          HG23      VAL  87 -19.180 -14.065  -6.033

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ASP  88           H        ASP  88 -24.939 -12.635  -5.396
    2    HA   ASP  88           HA       ASP  88 -26.066 -13.970  -7.726
    3    HB2  ASP  88           HB2      ASP  88 -27.021 -14.147  -5.379
    4    HB3  ASP  88           HB3      ASP  88 -27.516 -12.462  -5.537

  No H/Q in entry =           4
  In of MODEL   44
    1    H    GLY  89           H        GLY  89 -25.417 -12.762  -9.426
    2    HA3  GLY  89           HA2      GLY  89 -25.668 -10.004  -9.732
    3    HA2  GLY  89           HA3      GLY  89 -25.637 -11.177 -11.048

  No H/Q in entry =           3
  In of MODEL   44
    1    H    LEU  90           H        LEU  90 -28.043 -12.567 -10.508
    2    HA   LEU  90           HA       LEU  90 -29.917 -10.721 -11.668
    3    HB2  LEU  90           HB2      LEU  90 -29.933 -13.139 -12.152
    4    HB3  LEU  90           HB3      LEU  90 -30.405 -13.452 -10.482
    5    HG   LEU  90           HG       LEU  90 -32.555 -12.400 -10.855
    6   HD13  LEU  90          HD11      LEU  90 -32.441 -10.715 -12.399
    7   HD12  LEU  90          HD12      LEU  90 -32.967 -12.009 -13.479
    8   HD11  LEU  90          HD13      LEU  90 -31.261 -11.569 -13.398
    9   HD23  LEU  90          HD21      LEU  90 -32.483 -14.123 -13.226
   10   HD22  LEU  90          HD22      LEU  90 -33.435 -14.253 -11.748
   11   HD21  LEU  90          HD23      LEU  90 -31.767 -14.827 -11.775

  No H/Q in entry =          11
  In of MODEL   44
    1    H    GLY  91           H        GLY  91 -29.664 -12.092  -8.430
    2    HA3  GLY  91           HA2      GLY  91 -32.013 -10.994  -7.398
    3    HA2  GLY  91           HA3      GLY  91 -30.595 -11.456  -6.457

  No H/Q in entry =           3
  In of MODEL   44
    1    H    VAL  92           H        VAL  92 -28.735  -9.619  -7.416
    2    HA   VAL  92           HA       VAL  92 -29.559  -7.279  -5.945
    3    HB   VAL  92           HB       VAL  92 -27.027  -7.749  -7.562
    4   HG12  VAL  92          HG11      VAL  92 -27.202  -5.778  -5.308
    5   HG11  VAL  92          HG12      VAL  92 -27.904  -5.312  -6.859
    6   HG13  VAL  92          HG13      VAL  92 -26.196  -5.735  -6.756
    7   HG22  VAL  92          HG21      VAL  92 -26.740  -9.267  -5.912
    8   HG21  VAL  92          HG22      VAL  92 -27.887  -8.472  -4.833
    9   HG23  VAL  92          HG23      VAL  92 -26.251  -7.837  -5.004

  No H/Q in entry =           9
  In of MODEL   44
    1    H    LEU  93           H        LEU  93 -29.188  -8.064  -9.342
    2    HA   LEU  93           HA       LEU  93 -29.613  -5.477 -10.369
    3    HB2  LEU  93           HB2      LEU  93 -28.948  -7.372 -11.767
    4    HB3  LEU  93           HB3      LEU  93 -30.517  -8.129 -11.490
    5    HG   LEU  93           HG       LEU  93 -31.594  -6.236 -12.673
    6   HD11  LEU  93          HD11      LEU  93 -29.776  -4.578 -12.262
    7   HD13  LEU  93          HD12      LEU  93 -30.240  -4.686 -13.961
    8   HD12  LEU  93          HD13      LEU  93 -28.760  -5.464 -13.402
    9   HD23  LEU  93          HD21      LEU  93 -30.577  -6.869 -14.953
   10   HD22  LEU  93          HD22      LEU  93 -31.374  -8.108 -13.985
   11   HD21  LEU  93          HD23      LEU  93 -29.611  -8.010 -14.019

  No H/Q in entry =          11
  In of MODEL   44
    1    H    LYS  94           H        LYS  94 -31.911  -8.044  -9.382
    2    HA   LYS  94           HA       LYS  94 -34.300  -6.686 -10.024
    3    HB2  LYS  94           HB2      LYS  94 -33.701  -8.777  -7.937
    4    HB3  LYS  94           HB3      LYS  94 -35.319  -8.131  -8.206
    5    HG2  LYS  94           HG2      LYS  94 -35.249  -8.995 -10.509
    6    HG3  LYS  94           HG3      LYS  94 -33.666  -9.695 -10.177
    7    HD2  LYS  94           HD2      LYS  94 -34.724 -10.982  -8.283
    8    HD3  LYS  94           HD3      LYS  94 -36.291 -10.395  -8.838
    9    HE2  LYS  94           HE2      LYS  94 -35.788 -11.400 -11.075
   10    HE3  LYS  94           HE3      LYS  94 -34.344 -12.121 -10.365
   11    HZ3  LYS  94           HZ1      LYS  94 -36.158 -13.692 -10.444
   12    HZ2  LYS  94           HZ2      LYS  94 -37.141 -12.653  -9.528
   13    HZ1  LYS  94           HZ3      LYS  94 -35.753 -13.340  -8.833

  No H/Q in entry =          13
  In of MODEL   44
    1    H    ALA  95           H        ALA  95 -32.426  -6.642  -7.003
    2    HA   ALA  95           HA       ALA  95 -34.291  -5.050  -5.556
    3    HB2  ALA  95           HB1      ALA  95 -31.874  -6.345  -5.006
    4    HB3  ALA  95           HB2      ALA  95 -32.857  -5.419  -3.872
    5    HB1  ALA  95           HB3      ALA  95 -31.542  -4.633  -4.746

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA  96           H        ALA  96 -31.704  -4.216  -7.728
    2    HA   ALA  96           HA       ALA  96 -31.664  -1.425  -7.064
    3    HB2  ALA  96           HB1      ALA  96 -30.340  -1.250  -9.203
    4    HB3  ALA  96           HB2      ALA  96 -30.608  -2.974  -9.451
    5    HB1  ALA  96           HB3      ALA  96 -29.682  -2.418  -8.058

  No H/Q in entry =           5
  In of MODEL   44
    1    H    VAL  97           H        VAL  97 -33.195  -3.280  -9.657
    2    HA   VAL  97           HA       VAL  97 -34.339  -1.056 -10.984
    3    HB   VAL  97           HB       VAL  97 -35.079  -4.000 -10.898
    4   HG11  VAL  97          HG11      VAL  97 -36.926  -2.056 -11.432
    5   HG13  VAL  97          HG12      VAL  97 -36.959  -3.678 -12.125
    6   HG12  VAL  97          HG13      VAL  97 -36.251  -2.346 -13.037
    7   HG21  VAL  97          HG21      VAL  97 -33.875  -2.223 -13.023
    8   HG23  VAL  97          HG22      VAL  97 -34.293  -3.924 -13.240
    9   HG22  VAL  97          HG23      VAL  97 -33.035  -3.462 -12.091

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ALA  98           H        ALA  98 -35.431  -3.160  -8.344
    2    HA   ALA  98           HA       ALA  98 -38.012  -2.058  -7.996
    3    HB1  ALA  98           HB1      ALA  98 -36.931  -4.191  -6.896
    4    HB3  ALA  98           HB2      ALA  98 -38.118  -3.259  -5.982
    5    HB2  ALA  98           HB3      ALA  98 -36.396  -3.056  -5.657

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA  99           H        ALA  99 -34.926  -1.126  -6.432
    2    HA   ALA  99           HA       ALA  99 -36.075   0.895  -4.830
    3    HB1  ALA  99           HB1      ALA  99 -33.419   0.036  -5.586
    4    HB2  ALA  99           HB2      ALA  99 -33.963   0.831  -4.109
    5    HB3  ALA  99           HB3      ALA  99 -33.531   1.795  -5.520

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ILE 100           H        ILE 100 -35.090   0.918  -8.205
    2    HA   ILE 100           HA       ILE 100 -35.335   3.751  -8.530
    3    HB   ILE 100           HB       ILE 100 -35.417   1.514 -10.583
    4   HG12  ILE 100          HG12      ILE 100 -33.287   3.576 -10.024
    5   HG13  ILE 100          HG13      ILE 100 -33.278   1.955  -9.332
    6   HG21  ILE 100          HG21      ILE 100 -35.906   4.417 -10.818
    7   HG23  ILE 100          HG22      ILE 100 -36.401   3.095 -11.876
    8   HG22  ILE 100          HG23      ILE 100 -34.764   3.743 -11.982
    9   HD12  ILE 100          HD11      ILE 100 -32.810   2.815 -12.148
   10   HD11  ILE 100          HD12      ILE 100 -33.430   1.197 -11.821
   11   HD13  ILE 100          HD13      ILE 100 -31.884   1.701 -11.145

  No H/Q in entry =          11
  In of MODEL   44
    1    H    LYS 101           H        LYS 101 -37.583   1.068  -9.118
    2    HA   LYS 101           HA       LYS 101 -39.715   2.632 -10.145
    3    HB2  LYS 101           HB2      LYS 101 -39.521  -0.094  -8.915
    4    HB3  LYS 101           HB3      LYS 101 -41.094   0.621  -9.264
    5    HG2  LYS 101           HG2      LYS 101 -40.658   0.678 -11.571
    6    HG3  LYS 101           HG3      LYS 101 -38.951   0.319 -11.331
    7    HD2  LYS 101           HD2      LYS 101 -40.172  -1.648 -12.121
    8    HD3  LYS 101           HD3      LYS 101 -39.513  -1.904 -10.506
    9    HE2  LYS 101           HE2      LYS 101 -41.551  -2.622  -9.939
   10    HE3  LYS 101           HE3      LYS 101 -42.046  -0.929 -10.000
   11    HZ3  LYS 101           HZ1      LYS 101 -42.966  -1.186 -12.095
   12    HZ2  LYS 101           HZ2      LYS 101 -43.385  -2.640 -11.325
   13    HZ1  LYS 101           HZ3      LYS 101 -42.096  -2.606 -12.430

  No H/Q in entry =          13
  In of MODEL   44
    1    H    LYS 102           H        LYS 102 -39.141   1.290  -6.891
    2    HA   LYS 102           HA       LYS 102 -41.395   2.481  -5.703
    3    HB2  LYS 102           HB2      LYS 102 -40.102   0.682  -4.638
    4    HB3  LYS 102           HB3      LYS 102 -38.731   1.775  -4.458
    5    HG2  LYS 102           HG2      LYS 102 -40.054   3.198  -2.993
    6    HG3  LYS 102           HG3      LYS 102 -41.429   2.108  -3.177
    7    HD2  LYS 102           HD2      LYS 102 -40.146   0.309  -2.100
    8    HD3  LYS 102           HD3      LYS 102 -38.773   1.401  -1.916
    9    HE2  LYS 102           HE2      LYS 102 -40.137   2.902  -0.542
   10    HE3  LYS 102           HE3      LYS 102 -41.530   1.840  -0.749
   11    HZ1  LYS 102           HZ1      LYS 102 -39.756   0.162   0.292
   12    HZ3  LYS 102           HZ2      LYS 102 -40.870   1.059   1.206
   13    HZ2  LYS 102           HZ3      LYS 102 -39.274   1.612   1.033

  No H/Q in entry =          13
  In of MODEL   44
    1    H    ALA 103           H        ALA 103 -38.488   3.896  -6.815
    2    HA   ALA 103           HA       ALA 103 -38.733   6.272  -5.118
    3    HB2  ALA 103           HB1      ALA 103 -36.783   6.987  -6.753
    4    HB3  ALA 103           HB2      ALA 103 -36.716   5.257  -7.087
    5    HB1  ALA 103           HB3      ALA 103 -36.475   5.848  -5.443

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA 104           H        ALA 104 -39.390   5.401  -8.425
    2    HA   ALA 104           HA       ALA 104 -40.045   8.146  -9.141
    3    HB2  ALA 104           HB1      ALA 104 -40.107   7.396 -11.316
    4    HB1  ALA 104           HB2      ALA 104 -40.794   5.833 -10.868
    5    HB3  ALA 104           HB3      ALA 104 -39.074   6.143 -10.626

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA 105           H        ALA 105 -41.579   6.079  -7.233
    2    HA   ALA 105           HA       ALA 105 -44.033   7.420  -7.220
    3    HB2  ALA 105           HB1      ALA 105 -44.789   6.468  -9.213
    4    HB3  ALA 105           HB2      ALA 105 -45.383   5.311  -8.022
    5    HB1  ALA 105           HB3      ALA 105 -43.919   4.959  -8.941

  No H/Q in entry =           5
  In of MODEL   45
    1    H1   ALA   1           H3       ALA   1 -12.153 -15.877  -2.477
    2    H2   ALA   1           H2       ALA   1 -11.200 -17.020  -3.302
    3    H3   ALA   1           H1       ALA   1 -12.338 -16.083  -4.152
    4    HA   ALA   1           HA       ALA   1 -13.734 -17.786  -3.918
    5    HB3  ALA   1           HB1      ALA   1 -12.338 -19.552  -3.434
    6    HB1  ALA   1           HB2      ALA   1 -13.111 -19.434  -1.853
    7    HB2  ALA   1           HB3      ALA   1 -11.534 -18.690  -2.121

  No H/Q in entry =           7
  In of MODEL   45
    1    H    GLU   2           H        GLU   2 -15.372 -18.637  -2.277
    2    HA   GLU   2           HA       GLU   2 -17.035 -16.916  -1.243
    3    HB2  GLU   2           HB2      GLU   2 -16.105 -19.332   0.322
    4    HB3  GLU   2           HB3      GLU   2 -17.634 -18.485   0.557
    5    HG2  GLU   2           HG2      GLU   2 -18.593 -19.582  -1.183
    6    HG3  GLU   2           HG3      GLU   2 -17.260 -19.183  -2.255

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLU   3           H        GLU   3 -15.147 -18.252   1.406
    2    HA   GLU   3           HA       GLU   3 -15.390 -15.892   2.950
    3    HB2  GLU   3           HB2      GLU   3 -13.801 -18.433   3.228
    4    HB3  GLU   3           HB3      GLU   3 -13.585 -17.108   4.372
    5    HG2  GLU   3           HG2      GLU   3 -15.786 -17.261   5.168
    6    HG3  GLU   3           HG3      GLU   3 -16.364 -18.070   3.717

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LEU   4           H        LEU   4 -12.417 -17.369   1.596
    2    HA   LEU   4           HA       LEU   4 -10.595 -15.458   2.205
    3    HB2  LEU   4           HB2      LEU   4 -10.793 -16.769  -0.517
    4    HB3  LEU   4           HB3      LEU   4  -9.350 -16.042   0.180
    5    HG   LEU   4           HG       LEU   4 -10.850 -18.438   1.288
    6   HD13  LEU   4          HD11      LEU   4  -9.204 -19.793   0.382
    7   HD12  LEU   4          HD12      LEU   4  -7.998 -18.507   0.362
    8   HD11  LEU   4          HD13      LEU   4  -9.274 -18.538  -0.854
    9   HD23  LEU   4          HD21      LEU   4  -8.613 -18.489   2.694
   10   HD22  LEU   4          HD22      LEU   4  -9.942 -17.450   3.204
   11   HD21  LEU   4          HD23      LEU   4  -8.572 -16.762   2.333

  No H/Q in entry =          11
  In of MODEL   45
    1    H    GLU   5           H        GLU   5 -12.902 -15.270  -0.495
    2    HA   GLU   5           HA       GLU   5 -11.895 -12.789  -1.496
    3    HB2  GLU   5           HB2      GLU   5 -13.222 -14.385  -2.865
    4    HB3  GLU   5           HB3      GLU   5 -14.634 -14.020  -1.872
    5    HG2  GLU   5           HG2      GLU   5 -14.507 -11.656  -2.527
    6    HG3  GLU   5           HG3      GLU   5 -13.066 -11.990  -3.488

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLU   6           H        GLU   6 -14.639 -13.664   0.571
    2    HA   GLU   6           HA       GLU   6 -15.554 -10.988   0.949
    3    HB2  GLU   6           HB2      GLU   6 -15.982 -13.523   2.545
    4    HB3  GLU   6           HB3      GLU   6 -16.786 -11.995   2.902
    5    HG2  GLU   6           HG2      GLU   6 -16.928 -13.432   0.236
    6    HG3  GLU   6           HG3      GLU   6 -18.178 -13.498   1.477

  No H/Q in entry =           6
  In of MODEL   45
    1    H    VAL   7           H        VAL   7 -13.259 -13.085   2.554
    2    HA   VAL   7           HA       VAL   7 -12.820 -11.498   4.879
    3    HB   VAL   7           HB       VAL   7 -11.097 -13.544   3.457
    4   HG11  VAL   7          HG11      VAL   7 -10.659 -11.998   6.018
    5   HG13  VAL   7          HG12      VAL   7  -9.544 -12.216   4.670
    6   HG12  VAL   7          HG13      VAL   7  -9.906 -13.569   5.743
    7   HG21  VAL   7          HG21      VAL   7 -13.359 -14.109   4.655
    8   HG23  VAL   7          HG22      VAL   7 -12.448 -13.825   6.139
    9   HG22  VAL   7          HG23      VAL   7 -11.940 -15.089   5.021

  No H/Q in entry =           9
  In of MODEL   45
    1    H    VAL   8           H        VAL   8 -11.275 -11.624   1.685
    2    HA   VAL   8           HA       VAL   8  -9.222  -9.744   2.191
    3    HB   VAL   8           HB       VAL   8 -10.657 -10.452  -0.379
    4   HG13  VAL   8          HG11      VAL   8  -9.718  -8.309  -0.776
    5   HG12  VAL   8          HG12      VAL   8  -8.501  -9.435  -1.380
    6   HG11  VAL   8          HG13      VAL   8  -8.287  -8.666   0.193
    7   HG23  VAL   8          HG21      VAL   8  -7.816 -11.207   0.076
    8   HG22  VAL   8          HG22      VAL   8  -9.134 -12.156  -0.605
    9   HG21  VAL   8          HG23      VAL   8  -8.966 -12.015   1.142

  No H/Q in entry =           9
  In of MODEL   45
    1    H    MET   9           H        MET   9 -12.556  -9.368   0.994
    2    HA   MET   9           HA       MET   9 -12.495  -6.593   0.547
    3    HB2  MET   9           HB2      MET   9 -14.700  -8.491   1.332
    4    HB3  MET   9           HB3      MET   9 -15.001  -6.760   1.167
    5    HG2  MET   9           HG2      MET   9 -14.101  -6.841  -1.144
    6    HG3  MET   9           HG3      MET   9 -13.870  -8.582  -0.976
    7    HE3  MET   9           HE1      MET   9 -17.368  -6.459   0.275
    8    HE2  MET   9           HE2      MET   9 -17.496  -6.023  -1.427
    9    HE1  MET   9           HE3      MET   9 -16.004  -5.692  -0.551

  No H/Q in entry =           9
  In of MODEL   45
    1    H    GLY  10           H        GLY  10 -13.184  -8.472   3.476
    2    HA3  GLY  10           HA2      GLY  10 -13.756  -6.281   5.178
    3    HA2  GLY  10           HA3      GLY  10 -13.193  -7.866   5.706

  No H/Q in entry =           3
  In of MODEL   45
    1    H    LEU  11           H        LEU  11 -10.734  -7.989   4.417
    2    HA   LEU  11           HA       LEU  11  -9.056  -6.543   6.185
    3    HB2  LEU  11           HB2      LEU  11  -8.477  -7.977   3.591
    4    HB3  LEU  11           HB3      LEU  11  -7.220  -7.264   4.599
    5    HG   LEU  11           HG       LEU  11  -9.227  -9.298   5.604
    6   HD13  LEU  11          HD11      LEU  11  -7.985 -10.539   4.059
    7   HD12  LEU  11          HD12      LEU  11  -7.065 -10.767   5.545
    8   HD11  LEU  11          HD13      LEU  11  -6.515  -9.607   4.338
    9   HD22  LEU  11          HD21      LEU  11  -8.397  -8.274   7.525
   10   HD21  LEU  11          HD22      LEU  11  -6.853  -7.871   6.777
   11   HD23  LEU  11          HD23      LEU  11  -7.179  -9.526   7.291

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  12           H        ILE  12  -9.923  -6.014   2.784
    2    HA   ILE  12           HA       ILE  12  -8.234  -3.781   2.365
    3    HB   ILE  12           HB       ILE  12 -10.860  -4.509   1.045
    4   HG12  ILE  12          HG12      ILE  12  -8.795  -6.094   0.955
    5   HG13  ILE  12          HG13      ILE  12  -9.605  -5.704  -0.548
    6   HG23  ILE  12          HG21      ILE  12 -10.392  -2.161   0.628
    7   HG22  ILE  12          HG22      ILE  12  -9.975  -3.055  -0.829
    8   HG21  ILE  12          HG23      ILE  12  -8.733  -2.529   0.269
    9   HD11  ILE  12          HD11      ILE  12  -7.141  -4.292   0.511
   10   HD13  ILE  12          HD12      ILE  12  -7.894  -4.057  -1.064
   11   HD12  ILE  12          HD13      ILE  12  -7.113  -5.573  -0.685

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  13           H        ILE  13 -11.606  -4.055   3.423
    2    HA   ILE  13           HA       ILE  13 -12.078  -1.268   3.674
    3    HB   ILE  13           HB       ILE  13 -13.289  -3.690   5.027
    4   HG12  ILE  13          HG12      ILE  13 -13.489  -3.105   2.482
    5   HG13  ILE  13          HG13      ILE  13 -14.904  -3.628   3.371
    6   HG22  ILE  13          HG21      ILE  13 -15.194  -2.055   5.579
    7   HG21  ILE  13          HG22      ILE  13 -14.035  -0.764   5.293
    8   HG23  ILE  13          HG23      ILE  13 -13.746  -1.937   6.575
    9   HD12  ILE  13          HD11      ILE  13 -15.179  -1.540   1.883
   10   HD11  ILE  13          HD12      ILE  13 -14.211  -0.725   3.096
   11   HD13  ILE  13          HD13      ILE  13 -15.750  -1.422   3.552

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ASN  14           H        ASN  14 -10.982  -3.743   5.973
    2    HA   ASN  14           HA       ASN  14 -10.813  -2.093   8.253
    3    HB2  ASN  14           HB2      ASN  14 -10.546  -4.701   7.946
    4    HB3  ASN  14           HB3      ASN  14  -8.837  -4.308   7.805
    5   HD21  ASN  14          HD21      ASN  14  -9.491  -5.825   9.982
    6   HD22  ASN  14          HD22      ASN  14  -9.482  -4.897  11.402

  No H/Q in entry =           6
  In of MODEL   45
    1    H    SER  15           H        SER  15  -8.380  -2.919   5.791
    2    HA   SER  15           HA       SER  15  -6.255  -1.412   6.879
    3    HB2  SER  15           HB2      SER  15  -5.207  -1.639   4.737
    4    HB3  SER  15           HB3      SER  15  -6.169  -3.098   4.951
    5    HG   SER  15           HG       SER  15  -7.713  -2.279   3.611

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLY  16           H        GLY  16  -8.836  -0.568   4.599
    2    HA3  GLY  16           HA2      GLY  16  -7.984   2.074   4.044
    3    HA2  GLY  16           HA3      GLY  16  -9.630   1.471   3.867

  No H/Q in entry =           3
  In of MODEL   45
    1    H    GLN  17           H        GLN  17 -10.198   0.756   6.514
    2    HA   GLN  17           HA       GLN  17 -10.930   3.263   7.635
    3    HB2  GLN  17           HB2      GLN  17 -12.149   1.163   8.112
    4    HB3  GLN  17           HB3      GLN  17 -10.752   0.570   9.011
    5    HG2  GLN  17           HG2      GLN  17 -12.381   1.524  10.567
    6    HG3  GLN  17           HG3      GLN  17 -10.934   2.530  10.531
    7   HE21  GLN  17          HE21      GLN  17 -11.882   4.581  10.963
    8   HE22  GLN  17          HE22      GLN  17 -13.051   5.292   9.958

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ALA  18           H        ALA  18  -8.296   0.998   8.294
    2    HA   ALA  18           HA       ALA  18  -7.230   2.231  10.571
    3    HB2  ALA  18           HB1      ALA  18  -6.594   0.012   9.221
    4    HB3  ALA  18           HB2      ALA  18  -5.447   0.806  10.300
    5    HB1  ALA  18           HB3      ALA  18  -5.352   1.076   8.559

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ARG  19           H        ARG  19  -6.424   2.742   7.128
    2    HA   ARG  19           HA       ARG  19  -4.542   4.802   7.567
    3    HB2  ARG  19           HB2      ARG  19  -4.839   3.648   5.374
    4    HB3  ARG  19           HB3      ARG  19  -6.384   4.479   5.176
    5    HG2  ARG  19           HG2      ARG  19  -5.268   6.658   5.246
    6    HG3  ARG  19           HG3      ARG  19  -3.718   5.882   5.571
    7    HD2  ARG  19           HD2      ARG  19  -3.821   6.460   3.223
    8    HD3  ARG  19           HD3      ARG  19  -3.897   4.701   3.377
    9    HE   ARG  19           HE       ARG  19  -6.536   5.594   3.336
   10   HH21  ARG  19          HH11      ARG  19  -7.711   5.734   1.404
   11   HH22  ARG  19          HH12      ARG  19  -6.873   5.809  -0.107
   12   HH11  ARG  19          HH21      ARG  19  -3.739   5.664   1.332
   13   HH12  ARG  19          HH22      ARG  19  -4.623   5.766  -0.147

  No H/Q in entry =          13
  In of MODEL   45
    1    H    SER  20           H        SER  20  -8.034   4.893   6.928
    2    HA   SER  20           HA       SER  20  -8.407   7.646   6.861
    3    HB2  SER  20           HB2      SER  20 -10.188   6.022   6.353
    4    HB3  SER  20           HB3      SER  20 -10.254   5.567   8.054
    5    HG   SER  20           HG       SER  20 -10.685   8.175   7.010

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU  21           H        LEU  21  -8.425   5.478   9.677
    2    HA   LEU  21           HA       LEU  21  -8.899   7.481  11.626
    3    HB2  LEU  21           HB2      LEU  21  -7.528   4.791  11.818
    4    HB3  LEU  21           HB3      LEU  21  -7.868   5.813  13.212
    5    HG   LEU  21           HG       LEU  21  -9.989   4.858  11.263
    6   HD13  LEU  21          HD11      LEU  21  -8.993   2.947  12.437
    7   HD12  LEU  21          HD12      LEU  21 -10.617   3.257  13.051
    8   HD11  LEU  21          HD13      LEU  21  -9.209   3.766  13.985
    9   HD23  LEU  21          HD21      LEU  21 -11.374   5.406  13.462
   10   HD22  LEU  21          HD22      LEU  21 -10.947   6.712  12.361
   11   HD21  LEU  21          HD23      LEU  21 -10.008   6.458  13.825

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ALA  22           H        ALA  22  -5.923   6.120  10.259
    2    HA   ALA  22           HA       ALA  22  -4.070   7.454  11.895
    3    HB2  ALA  22           HB1      ALA  22  -3.623   5.594  10.218
    4    HB1  ALA  22           HB2      ALA  22  -2.436   6.898  10.260
    5    HB3  ALA  22           HB3      ALA  22  -3.639   6.840   8.970

  No H/Q in entry =           5
  In of MODEL   45
    1    H    TYR  23           H        TYR  23  -5.358   8.445   8.692
    2    HA   TYR  23           HA       TYR  23  -4.037  10.950   8.624
    3    HB2  TYR  23           HB2      TYR  23  -5.088  10.023   6.625
    4    HB3  TYR  23           HB3      TYR  23  -6.676  10.119   7.388
    5    HD1  TYR  23           HD1      TYR  23  -3.778  12.190   6.274
    6    HD2  TYR  23           HD2      TYR  23  -7.938  12.113   7.336
    7    HE1  TYR  23           HE1      TYR  23  -4.017  14.534   5.501
    8    HE2  TYR  23           HE2      TYR  23  -8.178  14.458   6.562
    9    HH   TYR  23           HH       TYR  23  -5.475  16.171   5.027

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ALA  24           H        ALA  24  -7.166   9.959   9.974
    2    HA   ALA  24           HA       ALA  24  -8.028  12.547  10.722
    3    HB1  ALA  24           HB1      ALA  24  -9.843  11.286  11.175
    4    HB2  ALA  24           HB2      ALA  24  -9.030  10.728  12.635
    5    HB3  ALA  24           HB3      ALA  24  -8.882   9.809  11.138

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA  25           H        ALA  25  -6.028  10.110  12.331
    2    HA   ALA  25           HA       ALA  25  -5.727  11.378  14.830
    3    HB2  ALA  25           HB1      ALA  25  -4.935   9.027  14.030
    4    HB3  ALA  25           HB2      ALA  25  -3.938   9.898  15.198
    5    HB1  ALA  25           HB3      ALA  25  -3.483   9.875  13.494

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU  26           H        LEU  26  -3.904  11.673  11.809
    2    HA   LEU  26           HA       LEU  26  -1.967  13.511  12.737
    3    HB2  LEU  26           HB2      LEU  26  -1.635  12.350  10.643
    4    HB3  LEU  26           HB3      LEU  26  -3.105  13.045   9.968
    5    HG   LEU  26           HG       LEU  26  -2.107  15.303  10.103
    6   HD12  LEU  26          HD11      LEU  26   0.427  15.342  10.546
    7   HD11  LEU  26          HD12      LEU  26   0.205  13.763  11.296
    8   HD13  LEU  26          HD13      LEU  26  -0.619  15.176  11.956
    9   HD21  LEU  26          HD21      LEU  26  -0.335  13.253   8.739
   10   HD23  LEU  26          HD22      LEU  26  -0.385  14.972   8.359
   11   HD22  LEU  26          HD23      LEU  26  -1.798  13.963   8.060

  No H/Q in entry =          11
  In of MODEL   45
    1    H    LYS  27           H        LYS  27  -5.136  13.965  11.222
    2    HA   LYS  27           HA       LYS  27  -5.096  16.753  11.010
    3    HB2  LYS  27           HB2      LYS  27  -6.819  15.260  10.012
    4    HB3  LYS  27           HB3      LYS  27  -7.493  15.007  11.622
    5    HG2  LYS  27           HG2      LYS  27  -7.940  17.412  11.841
    6    HG3  LYS  27           HG3      LYS  27  -7.216  17.705  10.256
    7    HD2  LYS  27           HD2      LYS  27  -8.927  16.255   9.208
    8    HD3  LYS  27           HD3      LYS  27  -9.658  15.978  10.791
    9    HE2  LYS  27           HE2      LYS  27 -10.118  18.388  11.017
   10    HE3  LYS  27           HE3      LYS  27  -9.360  18.686   9.449
   11    HZ3  LYS  27           HZ1      LYS  27 -11.734  18.545   9.181
   12    HZ2  LYS  27           HZ2      LYS  27 -11.781  17.032   9.958
   13    HZ1  LYS  27           HZ3      LYS  27 -11.020  17.192   8.444

  No H/Q in entry =          13
  In of MODEL   45
    1    H    GLN  28           H        GLN  28  -6.003  14.676  13.737
    2    HA   GLN  28           HA       GLN  28  -6.930  16.683  15.493
    3    HB2  GLN  28           HB2      GLN  28  -5.518  14.064  16.066
    4    HB3  GLN  28           HB3      GLN  28  -6.281  15.070  17.298
    5    HG2  GLN  28           HG2      GLN  28  -7.700  13.915  14.880
    6    HG3  GLN  28           HG3      GLN  28  -7.783  13.251  16.511
    7   HE21  GLN  28          HE21      GLN  28  -9.609  15.039  14.474
    8   HE22  GLN  28          HE22      GLN  28 -10.389  16.061  15.582

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ALA  29           H        ALA  29  -3.696  15.401  14.846
    2    HA   ALA  29           HA       ALA  29  -2.288  16.817  16.833
    3    HB1  ALA  29           HB1      ALA  29  -0.341  16.130  15.740
    4    HB3  ALA  29           HB2      ALA  29  -1.079  16.242  14.142
    5    HB2  ALA  29           HB3      ALA  29  -1.506  14.913  15.218

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LYS  30           H        LYS  30  -3.113  17.675  13.490
    2    HA   LYS  30           HA       LYS  30  -1.711  20.120  13.393
    3    HB2  LYS  30           HB2      LYS  30  -4.223  19.229  11.961
    4    HB3  LYS  30           HB3      LYS  30  -3.391  20.746  11.618
    5    HG2  LYS  30           HG2      LYS  30  -1.311  19.457  11.134
    6    HG3  LYS  30           HG3      LYS  30  -2.215  17.960  11.377
    7    HD2  LYS  30           HD2      LYS  30  -3.761  18.585   9.562
    8    HD3  LYS  30           HD3      LYS  30  -2.880  20.095   9.321
    9    HE2  LYS  30           HE2      LYS  30  -0.838  18.806   8.770
   10    HE3  LYS  30           HE3      LYS  30  -1.737  17.301   8.980
   11    HZ2  LYS  30           HZ1      LYS  30  -1.538  18.161   6.636
   12    HZ1  LYS  30           HZ2      LYS  30  -2.590  19.423   7.086
   13    HZ3  LYS  30           HZ3      LYS  30  -3.111  17.805   7.160

  No H/Q in entry =          13
  In of MODEL   45
    1    H    GLN  31           H        GLN  31  -4.825  19.266  14.775
    2    HA   GLN  31           HA       GLN  31  -5.600  22.023  15.205
    3    HB2  GLN  31           HB2      GLN  31  -6.788  19.580  16.527
    4    HB3  GLN  31           HB3      GLN  31  -7.549  21.148  16.265
    5    HG2  GLN  31           HG2      GLN  31  -6.808  20.360  13.687
    6    HG3  GLN  31           HG3      GLN  31  -7.337  18.858  14.436
    7   HE21  GLN  31          HE21      GLN  31  -8.728  20.419  12.311
    8   HE22  GLN  31          HE22      GLN  31 -10.250  20.810  12.951

  No H/Q in entry =           8
  In of MODEL   45
    1    H    GLY  32           H        GLY  32  -3.298  20.107  16.560
    2    HA3  GLY  32           HA2      GLY  32  -1.918  20.581  18.375
    3    HA2  GLY  32           HA3      GLY  32  -3.055  21.824  18.880

  No H/Q in entry =           3
  In of MODEL   45
    1    H    ASP  33           H        ASP  33  -4.464  18.778  18.217
    2    HA   ASP  33           HA       ASP  33  -4.905  18.333  21.095
    3    HB2  ASP  33           HB2      ASP  33  -6.283  17.307  18.607
    4    HB3  ASP  33           HB3      ASP  33  -6.644  16.704  20.222

  No H/Q in entry =           4
  In of MODEL   45
    1    H    PHE  34           H        PHE  34  -2.739  17.488  21.428
    2    HA   PHE  34           HA       PHE  34  -1.719  15.234  20.048
    3    HB2  PHE  34           HB2      PHE  34  -1.134  16.233  22.844
    4    HB3  PHE  34           HB3      PHE  34  -0.194  15.008  21.993
    5    HD1  PHE  34           HD1      PHE  34  -0.380  18.436  22.710
    6    HD2  PHE  34           HD2      PHE  34   0.490  15.720  19.497
    7    HE1  PHE  34           HE1      PHE  34   0.924  20.205  21.562
    8    HE2  PHE  34           HE2      PHE  34   1.789  17.491  18.354
    9    HZ   PHE  34           HZ       PHE  34   2.008  19.731  19.391

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ALA  35           H        ALA  35  -3.790  15.521  22.888
    2    HA   ALA  35           HA       ALA  35  -3.583  12.863  23.799
    3    HB3  ALA  35           HB1      ALA  35  -6.051  13.489  24.627
    4    HB1  ALA  35           HB2      ALA  35  -5.515  15.106  24.169
    5    HB2  ALA  35           HB3      ALA  35  -4.613  14.189  25.374

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA  36           H        ALA  36  -6.013  14.366  21.666
    2    HA   ALA  36           HA       ALA  36  -7.419  11.950  21.184
    3    HB1  ALA  36           HB1      ALA  36  -8.866  13.365  20.206
    4    HB3  ALA  36           HB2      ALA  36  -7.682  13.782  18.968
    5    HB2  ALA  36           HB3      ALA  36  -7.724  14.677  20.487

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA  37           H        ALA  37  -4.723  13.534  19.537
    2    HA   ALA  37           HA       ALA  37  -4.661  11.889  17.248
    3    HB3  ALA  37           HB1      ALA  37  -2.687  13.610  18.684
    4    HB2  ALA  37           HB2      ALA  37  -3.199  13.658  16.998
    5    HB1  ALA  37           HB3      ALA  37  -2.049  12.432  17.537

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LYS  38           H        LYS  38  -2.937  11.600  20.346
    2    HA   LYS  38           HA       LYS  38  -1.601   9.200  19.882
    3    HB2  LYS  38           HB2      LYS  38  -1.951  10.972  22.016
    4    HB3  LYS  38           HB3      LYS  38  -2.574   9.444  22.632
    5    HG2  LYS  38           HG2      LYS  38  -0.472   8.325  22.123
    6    HG3  LYS  38           HG3      LYS  38   0.143   9.767  21.310
    7    HD2  LYS  38           HD2      LYS  38   0.288  10.995  23.341
    8    HD3  LYS  38           HD3      LYS  38  -0.738   9.847  24.202
    9    HE2  LYS  38           HE2      LYS  38   1.611   9.538  24.848
   10    HE3  LYS  38           HE3      LYS  38   1.019   8.117  23.984
   11    HZ3  LYS  38           HZ1      LYS  38   2.337   8.530  22.215
   12    HZ2  LYS  38           HZ2      LYS  38   3.279   9.365  23.358
   13    HZ1  LYS  38           HZ3      LYS  38   2.208  10.219  22.351

  No H/Q in entry =          13
  In of MODEL   45
    1    H    ALA  39           H        ALA  39  -4.856   9.695  21.247
    2    HA   ALA  39           HA       ALA  39  -5.416   6.977  21.758
    3    HB3  ALA  39           HB1      ALA  39  -7.570   8.914  20.959
    4    HB2  ALA  39           HB2      ALA  39  -6.689   9.149  22.469
    5    HB1  ALA  39           HB3      ALA  39  -7.600   7.662  22.202

  No H/Q in entry =           5
  In of MODEL   45
    1    H    MET  40           H        MET  40  -5.975   8.976  18.896
    2    HA   MET  40           HA       MET  40  -7.431   7.035  17.429
    3    HB2  MET  40           HB2      MET  40  -5.817   9.429  16.531
    4    HB3  MET  40           HB3      MET  40  -6.829   8.464  15.454
    5    HG2  MET  40           HG2      MET  40  -7.894   9.722  17.995
    6    HG3  MET  40           HG3      MET  40  -7.936  10.550  16.440
    7    HE3  MET  40           HE1      MET  40 -10.494   8.916  14.356
    8    HE2  MET  40           HE2      MET  40  -8.740   9.036  14.226
    9    HE1  MET  40           HE3      MET  40  -9.667  10.402  14.844

  No H/Q in entry =           9
  In of MODEL   45
    1    H    MET  41           H        MET  41  -3.943   7.780  17.585
    2    HA   MET  41           HA       MET  41  -3.159   6.018  15.501
    3    HB2  MET  41           HB2      MET  41  -1.570   6.700  17.989
    4    HB3  MET  41           HB3      MET  41  -0.935   6.046  16.482
    5    HG2  MET  41           HG2      MET  41  -2.086   8.222  15.456
    6    HG3  MET  41           HG3      MET  41  -1.869   8.817  17.101
    7    HE2  MET  41           HE1      MET  41   1.050   6.728  17.503
    8    HE1  MET  41           HE2      MET  41   0.249   8.024  18.387
    9    HE3  MET  41           HE3      MET  41   1.879   8.268  17.761

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ASP  42           H        ASP  42  -3.580   5.559  18.985
    2    HA   ASP  42           HA       ASP  42  -2.540   2.969  19.168
    3    HB2  ASP  42           HB2      ASP  42  -3.437   4.734  20.973
    4    HB3  ASP  42           HB3      ASP  42  -4.861   3.705  20.890

  No H/Q in entry =           4
  In of MODEL   45
    1    H    GLN  43           H        GLN  43  -5.870   4.062  18.626
    2    HA   GLN  43           HA       GLN  43  -7.005   1.471  18.431
    3    HB2  GLN  43           HB2      GLN  43  -7.923   4.116  17.280
    4    HB3  GLN  43           HB3      GLN  43  -8.881   2.634  17.254
    5    HG2  GLN  43           HG2      GLN  43  -8.615   2.524  19.765
    6    HG3  GLN  43           HG3      GLN  43  -7.894   4.131  19.695
    7   HE21  GLN  43          HE21      GLN  43 -10.090   4.212  21.171
    8   HE22  GLN  43          HE22      GLN  43 -11.443   4.780  20.322

  No H/Q in entry =           8
  In of MODEL   45
    1    H    SER  44           H        SER  44  -5.644   3.678  16.024
    2    HA   SER  44           HA       SER  44  -6.316   2.182  13.734
    3    HB2  SER  44           HB2      SER  44  -5.071   4.571  14.181
    4    HB3  SER  44           HB3      SER  44  -3.709   3.576  13.670
    5    HG   SER  44           HG       SER  44  -4.804   4.537  11.891

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ARG  45           H        ARG  45  -3.462   2.085  15.846
    2    HA   ARG  45           HA       ARG  45  -1.961   0.129  14.489
    3    HB2  ARG  45           HB2      ARG  45  -1.144   1.561  16.360
    4    HB3  ARG  45           HB3      ARG  45  -2.145   0.632  17.474
    5    HG2  ARG  45           HG2      ARG  45  -0.901  -1.426  16.854
    6    HG3  ARG  45           HG3      ARG  45   0.124  -0.473  15.782
    7    HD2  ARG  45           HD2      ARG  45   0.833   0.918  17.740
    8    HD3  ARG  45           HD3      ARG  45  -0.098  -0.154  18.808
    9    HE   ARG  45           HE       ARG  45   1.623  -1.752  17.253
   10   HH21  ARG  45          HH11      ARG  45   3.516  -2.567  18.115
   11   HH22  ARG  45          HH12      ARG  45   4.272  -1.773  19.451
   12   HH11  ARG  45          HH21      ARG  45   1.893   0.725  19.636
   13   HH12  ARG  45          HH22      ARG  45   3.353   0.093  20.310

  No H/Q in entry =          13
  In of MODEL   45
    1    H    MET  46           H        MET  46  -4.386  -0.186  17.063
    2    HA   MET  46           HA       MET  46  -4.215  -2.984  17.384
    3    HB2  MET  46           HB2      MET  46  -6.392  -0.977  17.955
    4    HB3  MET  46           HB3      MET  46  -6.605  -2.697  18.293
    5    HG2  MET  46           HG2      MET  46  -4.635  -2.693  19.737
    6    HG3  MET  46           HG3      MET  46  -4.317  -1.010  19.346
    7    HE1  MET  46           HE1      MET  46  -6.522  -3.601  20.678
    8    HE3  MET  46           HE2      MET  46  -8.009  -2.726  20.329
    9    HE2  MET  46           HE3      MET  46  -7.468  -2.899  21.996

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ALA  47           H        ALA  47  -6.217  -0.980  15.259
    2    HA   ALA  47           HA       ALA  47  -7.818  -3.039  14.184
    3    HB3  ALA  47           HB1      ALA  47  -8.498  -0.805  13.751
    4    HB1  ALA  47           HB2      ALA  47  -7.990  -1.444  12.187
    5    HB2  ALA  47           HB3      ALA  47  -6.922  -0.370  13.092

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU  48           H        LEU  48  -4.690  -1.729  13.162
    2    HA   LEU  48           HA       LEU  48  -4.380  -3.328  10.831
    3    HB2  LEU  48           HB2      LEU  48  -2.346  -2.039  12.657
    4    HB3  LEU  48           HB3      LEU  48  -1.958  -2.766  11.097
    5    HG   LEU  48           HG       LEU  48  -3.989  -0.550  11.454
    6   HD13  LEU  48          HD11      LEU  48  -1.876   0.332  12.140
    7   HD12  LEU  48          HD12      LEU  48  -2.133   0.879  10.483
    8   HD11  LEU  48          HD13      LEU  48  -1.037  -0.465  10.809
    9   HD22  LEU  48          HD21      LEU  48  -4.435  -1.544   9.378
   10   HD21  LEU  48          HD22      LEU  48  -2.749  -1.977   9.103
   11   HD23  LEU  48          HD23      LEU  48  -3.268  -0.300   8.931

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ASN  49           H        ASN  49  -3.372  -3.710  14.190
    2    HA   ASN  49           HA       ASN  49  -1.763  -5.973  13.887
    3    HB2  ASN  49           HB2      ASN  49  -1.823  -4.622  15.928
    4    HB3  ASN  49           HB3      ASN  49  -3.478  -5.124  16.238
    5   HD21  ASN  49          HD21      ASN  49  -1.445  -5.609  18.143
    6   HD22  ASN  49          HD22      ASN  49  -1.162  -7.280  18.232

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLU  50           H        GLU  50  -5.239  -5.698  14.518
    2    HA   GLU  50           HA       GLU  50  -5.751  -8.497  14.632
    3    HB2  GLU  50           HB2      GLU  50  -7.348  -6.808  15.484
    4    HB3  GLU  50           HB3      GLU  50  -7.623  -6.250  13.831
    5    HG2  GLU  50           HG2      GLU  50  -8.479  -8.449  13.193
    6    HG3  GLU  50           HG3      GLU  50  -8.116  -9.086  14.793

  No H/Q in entry =           6
  In of MODEL   45
    1    H    ALA  51           H        ALA  51  -5.791  -6.110  12.026
    2    HA   ALA  51           HA       ALA  51  -6.752  -7.846  10.000
    3    HB2  ALA  51           HB1      ALA  51  -6.517  -6.039   8.626
    4    HB1  ALA  51           HB2      ALA  51  -4.884  -5.687   9.192
    5    HB3  ALA  51           HB3      ALA  51  -6.279  -5.172  10.143

  No H/Q in entry =           5
  In of MODEL   45
    1    H    HIS  52           H        HIS  52  -3.473  -6.934  11.017
    2    HA   HIS  52           HA       HIS  52  -2.052  -8.432   9.090
    3    HB2  HIS  52           HB2      HIS  52  -1.028  -6.695  10.526
    4    HB3  HIS  52           HB3      HIS  52  -1.226  -7.752  11.923
    5    HD1  HIS  52           HD1      HIS  52   0.096 -10.097  11.794
    6    HD2  HIS  52           HD2      HIS  52   1.247  -7.221   9.005
    7    HE1  HIS  52           HE1      HIS  52   2.341 -10.838  10.886
    8    HE2  HIS  52           HE2      HIS  52   3.056  -9.095   9.185

  No H/Q in entry =           8
  In of MODEL   45
    1    H    LEU  53           H        LEU  53  -3.301  -9.296  12.292
    2    HA   LEU  53           HA       LEU  53  -2.107 -11.840  12.509
    3    HB2  LEU  53           HB2      LEU  53  -4.587 -10.631  13.698
    4    HB3  LEU  53           HB3      LEU  53  -4.174 -12.321  13.981
    5    HG   LEU  53           HG       LEU  53  -2.134 -10.141  14.454
    6   HD11  LEU  53          HD11      LEU  53  -4.376 -11.053  16.264
    7   HD13  LEU  53          HD12      LEU  53  -3.936  -9.405  15.818
    8   HD12  LEU  53          HD13      LEU  53  -2.899 -10.332  16.897
    9   HD22  LEU  53          HD21      LEU  53  -0.950 -11.755  15.610
   10   HD21  LEU  53          HD22      LEU  53  -1.819 -12.815  14.506
   11   HD23  LEU  53          HD23      LEU  53  -2.397 -12.600  16.148

  No H/Q in entry =          11
  In of MODEL   45
    1    H    VAL  54           H        VAL  54  -5.201 -10.814  11.108
    2    HA   VAL  54           HA       VAL  54  -6.110 -13.410  10.420
    3    HB   VAL  54           HB       VAL  54  -6.741 -10.681   9.268
    4   HG12  VAL  54          HG11      VAL  54  -8.835 -12.060   8.437
    5   HG11  VAL  54          HG12      VAL  54  -7.725 -13.427   8.528
    6   HG13  VAL  54          HG13      VAL  54  -7.352 -12.056   7.484
    7   HG22  VAL  54          HG21      VAL  54  -7.672 -10.709  11.409
    8   HG21  VAL  54          HG22      VAL  54  -7.928 -12.453  11.393
    9   HG23  VAL  54          HG23      VAL  54  -8.998 -11.398  10.470

  No H/Q in entry =           9
  In of MODEL   45
    1    H    GLN  55           H        GLN  55  -4.215 -10.967   8.643
    2    HA   GLN  55           HA       GLN  55  -4.059 -12.441   6.233
    3    HB2  GLN  55           HB2      GLN  55  -3.450 -10.178   6.041
    4    HB3  GLN  55           HB3      GLN  55  -2.355 -10.251   7.419
    5    HG2  GLN  55           HG2      GLN  55  -0.624 -11.104   6.166
    6    HG3  GLN  55           HG3      GLN  55  -1.688 -12.082   5.164
    7   HE21  GLN  55          HE21      GLN  55  -1.679 -11.400   3.039
    8   HE22  GLN  55          HE22      GLN  55  -1.473  -9.798   2.525

  No H/Q in entry =           8
  In of MODEL   45
    1    H    THR  56           H        THR  56  -1.986 -12.412   9.138
    2    HA   THR  56           HA       THR  56   0.100 -14.017   8.251
    3    HB   THR  56           HB       THR  56  -1.176 -14.249  10.985
    4    HG1  THR  56           HG1      THR  56   0.940 -12.535  10.589
    5   HG22  THR  56          HG21      THR  56   1.327 -14.518  11.558
    6   HG21  THR  56          HG22      THR  56   1.555 -14.800   9.832
    7   HG23  THR  56          HG23      THR  56   0.523 -15.877  10.774

  No H/Q in entry =           7
  In of MODEL   45
    1    H    LYS  57           H        LYS  57  -3.037 -15.043   9.582
    2    HA   LYS  57           HA       LYS  57  -2.593 -17.841   9.352
    3    HB2  LYS  57           HB2      LYS  57  -4.426 -16.730  10.669
    4    HB3  LYS  57           HB3      LYS  57  -5.202 -16.305   9.152
    5    HG2  LYS  57           HG2      LYS  57  -5.453 -18.664   8.573
    6    HG3  LYS  57           HG3      LYS  57  -4.592 -19.140  10.036
    7    HD2  LYS  57           HD2      LYS  57  -6.372 -18.090  11.411
    8    HD3  LYS  57           HD3      LYS  57  -7.247 -17.664   9.941
    9    HE2  LYS  57           HE2      LYS  57  -6.503 -20.506  10.717
   10    HE3  LYS  57           HE3      LYS  57  -8.086 -19.792  11.013
   11    HZ3  LYS  57           HZ1      LYS  57  -8.157 -21.012   8.983
   12    HZ2  LYS  57           HZ2      LYS  57  -6.784 -20.212   8.381
   13    HZ1  LYS  57           HZ3      LYS  57  -8.237 -19.359   8.604

  No H/Q in entry =          13
  In of MODEL   45
    1    H    LEU  58           H        LEU  58  -3.895 -15.405   7.152
    2    HA   LEU  58           HA       LEU  58  -4.677 -17.237   5.143
    3    HB2  LEU  58           HB2      LEU  58  -4.064 -14.290   5.003
    4    HB3  LEU  58           HB3      LEU  58  -4.713 -15.231   3.659
    5    HG   LEU  58           HG       LEU  58  -6.024 -15.038   6.391
    6   HD11  LEU  58          HD11      LEU  58  -6.293 -13.400   3.890
    7   HD13  LEU  58          HD12      LEU  58  -6.301 -12.886   5.577
    8   HD12  LEU  58          HD13      LEU  58  -7.718 -13.679   4.892
    9   HD22  LEU  58          HD21      LEU  58  -6.980 -16.949   5.518
   10   HD21  LEU  58          HD22      LEU  58  -6.621 -16.504   3.850
   11   HD23  LEU  58          HD23      LEU  58  -7.992 -15.773   4.682

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  59           H        ILE  59  -1.549 -16.028   6.036
    2    HA   ILE  59           HA       ILE  59  -0.422 -16.768   3.415
    3    HB   ILE  59           HB       ILE  59   0.332 -14.697   4.982
    4   HG12  ILE  59          HG12      ILE  59   2.445 -16.357   3.594
    5   HG13  ILE  59          HG13      ILE  59   1.257 -15.433   2.711
    6   HG21  ILE  59          HG21      ILE  59   1.052 -16.465   6.760
    7   HG23  ILE  59          HG22      ILE  59   2.159 -15.158   6.404
    8   HG22  ILE  59          HG23      ILE  59   2.415 -16.757   5.705
    9   HD12  ILE  59          HD11      ILE  59   3.202 -14.321   4.732
   10   HD11  ILE  59          HD12      ILE  59   1.972 -13.375   3.898
   11   HD13  ILE  59          HD13      ILE  59   3.294 -14.104   2.986

  No H/Q in entry =          11
  In of MODEL   45
    1    H    GLU  60           H        GLU  60  -0.475 -17.860   6.787
    2    HA   GLU  60           HA       GLU  60   1.555 -19.843   6.555
    3    HB2  GLU  60           HB2      GLU  60   0.751 -19.037   8.730
    4    HB3  GLU  60           HB3      GLU  60  -0.838 -19.727   8.410
    5    HG2  GLU  60           HG2      GLU  60   0.168 -21.984   8.292
    6    HG3  GLU  60           HG3      GLU  60   1.754 -21.289   8.621

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLY  61           H        GLY  61  -1.949 -19.937   6.028
    2    HA3  GLY  61           HA2      GLY  61  -1.696 -22.734   5.084
    3    HA2  GLY  61           HA3      GLY  61  -3.186 -21.993   5.657

  No H/Q in entry =           3
  In of MODEL   45
    1    H    ASP  62           H        ASP  62  -0.925 -20.432   3.472
    2    HA   ASP  62           HA       ASP  62  -2.949 -19.754   1.609
    3    HB2  ASP  62           HB2      ASP  62  -1.052 -18.923   0.249
    4    HB3  ASP  62           HB3      ASP  62  -0.967 -18.378   1.921

  No H/Q in entry =           4
  In of MODEL   45
    1    H    ALA  63           H        ALA  63  -0.577 -22.402   1.668
    2    HA   ALA  63           HA       ALA  63  -2.064 -23.739  -0.479
    3    HB3  ALA  63           HB1      ALA  63  -0.329 -23.948  -1.993
    4    HB2  ALA  63           HB2      ALA  63   0.905 -23.578  -0.788
    5    HB1  ALA  63           HB3      ALA  63  -0.115 -22.288  -1.429

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLY  64           H        GLY  64   0.502 -25.418  -0.714
    2    HA3  GLY  64           HA2      GLY  64   1.661 -27.016   0.624
    3    HA2  GLY  64           HA3      GLY  64   0.460 -26.793   1.885

  No H/Q in entry =           3
  In of MODEL   45
    1    H    GLU  65           H        GLU  65  -1.613 -26.984  -0.446
    2    HA   GLU  65           HA       GLU  65  -2.240 -29.706  -0.004
    3    HB2  GLU  65           HB2      GLU  65  -3.294 -27.727  -2.021
    4    HB3  GLU  65           HB3      GLU  65  -3.962 -29.342  -1.789
    5    HG2  GLU  65           HG2      GLU  65  -4.452 -28.847   0.550
    6    HG3  GLU  65           HG3      GLU  65  -3.694 -27.264   0.400

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLY  66           H        GLY  66  -0.708 -28.049  -2.653
    2    HA3  GLY  66           HA2      GLY  66   0.390 -30.538  -3.681
    3    HA2  GLY  66           HA3      GLY  66  -0.620 -29.622  -4.782

  No H/Q in entry =           3
  In of MODEL   45
    1    H    LYS  67           H        LYS  67   0.131 -27.737  -5.675
    2    HA   LYS  67           HA       LYS  67   3.021 -27.487  -5.745
    3    HB2  LYS  67           HB2      LYS  67   2.578 -26.042  -7.713
    4    HB3  LYS  67           HB3      LYS  67   1.832 -27.640  -7.841
    5    HG2  LYS  67           HG2      LYS  67  -0.299 -26.696  -6.980
    6    HG3  LYS  67           HG3      LYS  67   0.446 -25.099  -6.930
    7    HD2  LYS  67           HD2      LYS  67   0.798 -25.170  -9.361
    8    HD3  LYS  67           HD3      LYS  67   0.095 -26.787  -9.425
    9    HE2  LYS  67           HE2      LYS  67  -2.032 -25.903  -8.541
   10    HE3  LYS  67           HE3      LYS  67  -1.334 -24.286  -8.471
   11    HZ2  LYS  67           HZ1      LYS  67  -2.157 -25.858 -10.794
   12    HZ1  LYS  67           HZ2      LYS  67  -0.825 -24.820 -10.974
   13    HZ3  LYS  67           HZ3      LYS  67  -2.331 -24.199 -10.493

  No H/Q in entry =          13
  In of MODEL   45
    1    H    MET  68           H        MET  68   4.075 -25.435  -5.873
    2    HA   MET  68           HA       MET  68   3.919 -23.938  -3.563
    3    HB2  MET  68           HB2      MET  68   5.091 -23.259  -6.257
    4    HB3  MET  68           HB3      MET  68   5.353 -22.288  -4.807
    5    HG2  MET  68           HG2      MET  68   6.302 -24.242  -3.653
    6    HG3  MET  68           HG3      MET  68   6.022 -25.234  -5.085
    7    HE3  MET  68           HE1      MET  68   9.887 -24.394  -4.425
    8    HE2  MET  68           HE2      MET  68   8.907 -25.770  -4.927
    9    HE1  MET  68           HE3      MET  68   8.492 -24.890  -3.458

  No H/Q in entry =           9
  In of MODEL   45
    1    H    LYS  69           H        LYS  69   1.652 -23.796  -6.009
    2    HA   LYS  69           HA       LYS  69   1.155 -21.061  -6.290
    3    HB2  LYS  69           HB2      LYS  69   0.219 -22.772  -7.772
    4    HB3  LYS  69           HB3      LYS  69  -0.884 -23.266  -6.483
    5    HG2  LYS  69           HG2      LYS  69  -1.850 -21.025  -6.399
    6    HG3  LYS  69           HG3      LYS  69  -0.708 -20.462  -7.619
    7    HD2  LYS  69           HD2      LYS  69  -1.652 -22.081  -9.237
    8    HD3  LYS  69           HD3      LYS  69  -2.816 -22.605  -8.017
    9    HE2  LYS  69           HE2      LYS  69  -3.725 -20.315  -7.891
   10    HE3  LYS  69           HE3      LYS  69  -2.561 -19.786  -9.106
   11    HZ1  LYS  69           HZ1      LYS  69  -3.724 -21.940 -10.257
   12    HZ3  LYS  69           HZ2      LYS  69  -4.132 -20.319 -10.566
   13    HZ2  LYS  69           HZ3      LYS  69  -5.024 -21.222  -9.436

  No H/Q in entry =          13
  In of MODEL   45
    1    H    VAL  70           H        VAL  70  -0.039 -19.537  -5.293
    2    HA   VAL  70           HA       VAL  70  -1.448 -20.274  -2.788
    3    HB   VAL  70           HB       VAL  70  -0.670 -18.108  -1.850
    4   HG12  VAL  70          HG11      VAL  70   1.811 -18.766  -1.731
    5   HG11  VAL  70          HG12      VAL  70   1.388 -20.102  -2.803
    6   HG13  VAL  70          HG13      VAL  70   0.643 -19.981  -1.208
    7   HG21  VAL  70          HG21      VAL  70   0.797 -17.946  -4.506
    8   HG23  VAL  70          HG22      VAL  70   1.298 -17.016  -3.095
    9   HG22  VAL  70          HG23      VAL  70  -0.296 -16.754  -3.798

  No H/Q in entry =           9
  In of MODEL   45
    1    H    SER  71           H        SER  71  -3.018 -18.591  -2.122
    2    HA   SER  71           HA       SER  71  -4.893 -17.996  -4.148
    3    HB2  SER  71           HB2      SER  71  -5.439 -18.192  -1.702
    4    HB3  SER  71           HB3      SER  71  -4.613 -16.661  -1.430
    5    HG   SER  71           HG       SER  71  -6.871 -17.138  -3.089

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU  72           H        LEU  72  -5.089 -16.340  -5.488
    2    HA   LEU  72           HA       LEU  72  -2.973 -14.532  -5.953
    3    HB2  LEU  72           HB2      LEU  72  -5.829 -14.578  -6.928
    4    HB3  LEU  72           HB3      LEU  72  -4.616 -13.436  -7.502
    5    HG   LEU  72           HG       LEU  72  -4.241 -16.447  -7.606
    6   HD11  LEU  72          HD11      LEU  72  -5.211 -14.531  -9.749
    7   HD13  LEU  72          HD12      LEU  72  -6.150 -15.826  -9.006
    8   HD12  LEU  72          HD13      LEU  72  -4.766 -16.215 -10.027
    9   HD23  LEU  72          HD21      LEU  72  -2.637 -15.615  -9.502
   10   HD22  LEU  72          HD22      LEU  72  -2.096 -15.459  -7.839
   11   HD21  LEU  72          HD23      LEU  72  -2.742 -14.058  -8.687

  No H/Q in entry =          11
  In of MODEL   45
    1    H    VAL  73           H        VAL  73  -6.084 -14.167  -4.358
    2    HA   VAL  73           HA       VAL  73  -6.130 -11.394  -4.017
    3    HB   VAL  73           HB       VAL  73  -7.862 -11.746  -2.448
    4   HG12  VAL  73          HG11      VAL  73  -8.052 -14.246  -4.111
    5   HG11  VAL  73          HG12      VAL  73  -8.083 -12.663  -4.884
    6   HG13  VAL  73          HG13      VAL  73  -9.318 -13.090  -3.699
    7   HG23  VAL  73          HG21      VAL  73  -8.156 -14.254  -1.659
    8   HG22  VAL  73          HG22      VAL  73  -7.051 -13.180  -0.803
    9   HG21  VAL  73          HG23      VAL  73  -6.423 -14.338  -1.975

  No H/Q in entry =           9
  In of MODEL   45
    1    H    LEU  74           H        LEU  74  -4.211 -13.759  -2.405
    2    HA   LEU  74           HA       LEU  74  -3.826 -12.609   0.118
    3    HB2  LEU  74           HB2      LEU  74  -3.035 -14.826  -0.347
    4    HB3  LEU  74           HB3      LEU  74  -1.986 -14.234  -1.634
    5    HG   LEU  74           HG       LEU  74  -0.670 -12.960   0.027
    6   HD11  LEU  74          HD11      LEU  74  -2.715 -14.149   1.912
    7   HD13  LEU  74          HD12      LEU  74  -2.252 -12.455   1.740
    8   HD12  LEU  74          HD13      LEU  74  -1.134 -13.606   2.474
    9   HD21  LEU  74          HD21      LEU  74  -0.474 -15.532  -0.552
   10   HD23  LEU  74          HD22      LEU  74  -0.897 -15.687   1.139
   11   HD22  LEU  74          HD23      LEU  74   0.542 -14.801   0.689

  No H/Q in entry =          11
  In of MODEL   45
    1    H    VAL  75           H        VAL  75  -1.904 -12.227  -2.820
    2    HA   VAL  75           HA       VAL  75  -0.115 -10.301  -1.797
    3    HB   VAL  75           HB       VAL  75  -1.040 -10.805  -4.626
    4   HG11  VAL  75          HG11      VAL  75   1.210  -9.054  -3.542
    5   HG13  VAL  75          HG12      VAL  75  -0.203  -8.507  -4.433
    6   HG12  VAL  75          HG13      VAL  75   1.011  -9.490  -5.235
    7   HG23  VAL  75          HG21      VAL  75   1.604 -11.453  -3.301
    8   HG22  VAL  75          HG22      VAL  75   0.961 -12.095  -4.812
    9   HG21  VAL  75          HG23      VAL  75   0.248 -12.582  -3.273

  No H/Q in entry =           9
  In of MODEL   45
    1    H    GLU  76           H        GLU  76  -3.248  -9.957  -3.489
    2    HA   GLU  76           HA       GLU  76  -3.296  -7.143  -3.600
    3    HB2  GLU  76           HB2      GLU  76  -4.940  -8.652  -4.751
    4    HB3  GLU  76           HB3      GLU  76  -5.646  -9.028  -3.188
    5    HG2  GLU  76           HG2      GLU  76  -6.257  -6.660  -2.873
    6    HG3  GLU  76           HG3      GLU  76  -5.549  -6.246  -4.422

  No H/Q in entry =           6
  In of MODEL   45
    1    H    ALA  77           H        ALA  77  -4.435  -9.362  -1.065
    2    HA   ALA  77           HA       ALA  77  -5.409  -7.353   0.677
    3    HB2  ALA  77           HB1      ALA  77  -5.948  -9.769   0.895
    4    HB3  ALA  77           HB2      ALA  77  -5.358  -9.071   2.402
    5    HB1  ALA  77           HB3      ALA  77  -4.291 -10.070   1.418

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLN  78           H        GLN  78  -2.259  -8.907   0.350
    2    HA   GLN  78           HA       GLN  78  -1.024  -7.740   2.610
    3    HB2  GLN  78           HB2      GLN  78  -0.150  -9.686   1.271
    4    HB3  GLN  78           HB3      GLN  78   0.300  -8.545   0.005
    5    HG2  GLN  78           HG2      GLN  78   1.747  -7.348   1.594
    6    HG3  GLN  78           HG3      GLN  78   1.296  -8.479   2.867
    7   HE21  GLN  78          HE21      GLN  78   4.027  -8.225   2.068
    8   HE22  GLN  78          HE22      GLN  78   4.495  -9.661   1.290

  No H/Q in entry =           8
  In of MODEL   45
    1    H    LEU  79           H        LEU  79  -1.354  -6.690  -0.744
    2    HA   LEU  79           HA       LEU  79   0.336  -4.465  -0.720
    3    HB2  LEU  79           HB2      LEU  79  -0.671  -5.277  -2.782
    4    HB3  LEU  79           HB3      LEU  79  -2.280  -4.881  -2.192
    5    HG   LEU  79           HG       LEU  79  -1.732  -2.495  -2.168
    6   HD13  LEU  79          HD11      LEU  79   0.503  -2.253  -1.633
    7   HD12  LEU  79          HD12      LEU  79   0.571  -1.972  -3.373
    8   HD11  LEU  79          HD13      LEU  79   1.015  -3.548  -2.716
    9   HD23  LEU  79          HD21      LEU  79  -1.071  -2.305  -4.714
   10   HD22  LEU  79          HD22      LEU  79  -2.603  -3.049  -4.269
   11   HD21  LEU  79          HD23      LEU  79  -1.228  -4.062  -4.696

  No H/Q in entry =          11
  In of MODEL   45
    1    H    HIS  80           H        HIS  80  -3.140  -4.619   0.070
    2    HA   HIS  80           HA       HIS  80  -3.332  -1.860   0.722
    3    HB2  HIS  80           HB2      HIS  80  -5.042  -4.264   1.031
    4    HB3  HIS  80           HB3      HIS  80  -5.371  -2.920   2.127
    5    HD1  HIS  80           HD1      HIS  80  -6.976  -1.283   1.198
    6    HD2  HIS  80           HD2      HIS  80  -4.755  -3.110  -1.821
    7    HE1  HIS  80           HE1      HIS  80  -7.791  -0.291  -0.994
    8    HE2  HIS  80           HE2      HIS  80  -6.443  -1.399  -2.843

  No H/Q in entry =           8
  In of MODEL   45
    1    H    LEU  81           H        LEU  81  -2.871  -4.749   2.730
    2    HA   LEU  81           HA       LEU  81  -2.881  -3.394   5.210
    3    HB2  LEU  81           HB2      LEU  81  -1.660  -6.016   4.352
    4    HB3  LEU  81           HB3      LEU  81  -1.650  -5.451   6.024
    5    HG   LEU  81           HG       LEU  81  -4.179  -5.703   4.370
    6   HD12  LEU  81          HD11      LEU  81  -4.503  -7.763   5.921
    7   HD11  LEU  81          HD12      LEU  81  -2.753  -7.696   6.125
    8   HD13  LEU  81          HD13      LEU  81  -3.445  -7.930   4.520
    9   HD23  LEU  81          HD21      LEU  81  -5.049  -5.896   6.863
   10   HD22  LEU  81          HD22      LEU  81  -4.713  -4.310   6.171
   11   HD21  LEU  81          HD23      LEU  81  -3.539  -5.070   7.246

  No H/Q in entry =          11
  In of MODEL   45
    1    H    MET  82           H        MET  82  -0.180  -4.311   3.070
    2    HA   MET  82           HA       MET  82   1.888  -3.417   4.773
    3    HB2  MET  82           HB2      MET  82   1.703  -3.767   1.779
    4    HB3  MET  82           HB3      MET  82   3.179  -3.198   2.556
    5    HG2  MET  82           HG2      MET  82   1.757  -5.781   3.275
    6    HG3  MET  82           HG3      MET  82   3.140  -5.679   2.188
    7    HE3  MET  82           HE1      MET  82   6.137  -4.945   4.201
    8    HE2  MET  82           HE2      MET  82   5.224  -3.577   3.569
    9    HE1  MET  82           HE3      MET  82   5.319  -5.070   2.639

  No H/Q in entry =           9
  In of MODEL   45
    1    H    THR  83           H        THR  83   0.097  -1.778   2.192
    2    HA   THR  83           HA       THR  83   1.515   0.666   2.284
    3    HB   THR  83           HB       THR  83  -0.648   1.594   1.273
    4    HG1  THR  83           HG1      THR  83  -2.301   0.302   1.153
    5   HG22  THR  83          HG21      THR  83  -0.362  -0.231  -0.719
    6   HG21  THR  83          HG22      THR  83   1.128  -0.525   0.174
    7   HG23  THR  83          HG23      THR  83   0.778   1.087  -0.450

  No H/Q in entry =           7
  In of MODEL   45
    1    H    SER  84           H        SER  84  -1.510  -0.351   3.858
    2    HA   SER  84           HA       SER  84  -2.013   2.085   5.189
    3    HB2  SER  84           HB2      SER  84  -2.860  -0.748   5.754
    4    HB3  SER  84           HB3      SER  84  -3.360   0.597   6.778
    5    HG   SER  84           HG       SER  84  -3.791   0.275   3.982

  No H/Q in entry =           5
  In of MODEL   45
    1    H    MET  85           H        MET  85  -0.324  -0.849   6.346
    2    HA   MET  85           HA       MET  85   0.172   0.085   8.952
    3    HB2  MET  85           HB2      MET  85   0.463  -2.262   8.285
    4    HB3  MET  85           HB3      MET  85   1.858  -1.806   7.305
    5    HG2  MET  85           HG2      MET  85   3.024  -0.985   9.305
    6    HG3  MET  85           HG3      MET  85   1.618  -1.367  10.296
    7    HE2  MET  85           HE1      MET  85   4.681  -4.042   8.340
    8    HE1  MET  85           HE2      MET  85   4.129  -2.438   7.862
    9    HE3  MET  85           HE3      MET  85   3.247  -3.864   7.325

  No H/Q in entry =           9
  In of MODEL   45
    1    H    LEU  86           H        LEU  86   2.138   0.324   6.020
    2    HA   LEU  86           HA       LEU  86   4.344   1.631   7.194
    3    HB2  LEU  86           HB2      LEU  86   4.173   0.541   4.887
    4    HB3  LEU  86           HB3      LEU  86   3.375   2.023   4.361
    5    HG   LEU  86           HG       LEU  86   5.398   3.266   5.358
    6   HD11  LEU  86          HD11      LEU  86   6.085   0.655   6.174
    7   HD13  LEU  86          HD12      LEU  86   7.093   2.096   6.277
    8   HD12  LEU  86          HD13      LEU  86   7.213   1.043   4.870
    9   HD23  LEU  86          HD21      LEU  86   6.132   1.492   3.021
   10   HD22  LEU  86          HD22      LEU  86   6.529   3.189   3.281
   11   HD21  LEU  86          HD23      LEU  86   4.879   2.725   2.868

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ALA  87           H        ALA  87   1.453   2.879   5.575
    2    HA   ALA  87           HA       ALA  87   2.056   5.607   5.655
    3    HB1  ALA  87           HB1      ALA  87  -0.253   3.986   5.097
    4    HB3  ALA  87           HB2      ALA  87   0.069   5.644   4.594
    5    HB2  ALA  87           HB3      ALA  87  -0.742   5.331   6.130

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ARG  88           H        ARG  88   0.335   3.620   8.035
    2    HA   ARG  88           HA       ARG  88  -0.188   5.678   9.869
    3    HB2  ARG  88           HB2      ARG  88  -1.136   3.330   9.935
    4    HB3  ARG  88           HB3      ARG  88   0.396   2.827  10.658
    5    HG2  ARG  88           HG2      ARG  88  -0.090   4.908  12.266
    6    HG3  ARG  88           HG3      ARG  88  -1.753   4.588  11.794
    7    HD2  ARG  88           HD2      ARG  88  -1.880   2.744  13.046
    8    HD3  ARG  88           HD3      ARG  88  -0.287   2.154  12.533
    9    HE   ARG  88           HE       ARG  88  -0.841   3.429  14.977
   10   HH21  ARG  88          HH11      ARG  88   0.707   4.440  16.228
   11   HH22  ARG  88          HH12      ARG  88   2.235   4.858  15.537
   12   HH11  ARG  88          HH21      ARG  88   1.466   3.592  12.423
   13   HH12  ARG  88          HH22      ARG  88   2.673   4.362  13.395

  No H/Q in entry =          13
  In of MODEL   45
    1    H    GLU  89           H        GLU  89   2.602   3.449   9.683
    2    HA   GLU  89           HA       GLU  89   3.843   4.342  12.036
    3    HB2  GLU  89           HB2      GLU  89   4.509   2.317  10.707
    4    HB3  GLU  89           HB3      GLU  89   5.300   3.404   9.564
    5    HG2  GLU  89           HG2      GLU  89   6.770   4.252  11.320
    6    HG3  GLU  89           HG3      GLU  89   5.919   3.303  12.535

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LEU  90           H        LEU  90   4.198   5.486   8.708
    2    HA   LEU  90           HA       LEU  90   6.128   7.483   9.305
    3    HB2  LEU  90           HB2      LEU  90   4.144   7.149   7.059
    4    HB3  LEU  90           HB3      LEU  90   5.378   8.416   7.088
    5    HG   LEU  90           HG       LEU  90   6.040   5.479   7.440
    6   HD12  LEU  90          HD11      LEU  90   6.814   5.701   5.007
    7   HD11  LEU  90          HD12      LEU  90   5.803   7.144   4.943
    8   HD13  LEU  90          HD13      LEU  90   5.075   5.575   5.284
    9   HD22  LEU  90          HD21      LEU  90   7.933   6.626   8.137
   10   HD21  LEU  90          HD22      LEU  90   7.598   8.028   7.121
   11   HD23  LEU  90          HD23      LEU  90   8.261   6.558   6.407

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  91           H        ILE  91   2.591   7.508   9.120
    2    HA   ILE  91           HA       ILE  91   2.252  10.283   9.557
    3    HB   ILE  91           HB       ILE  91   0.449   7.914  10.090
    4   HG12  ILE  91          HG12      ILE  91   0.227  10.189   8.094
    5   HG13  ILE  91          HG13      ILE  91   1.087   8.691   7.736
    6   HG22  ILE  91          HG21      ILE  91  -1.279   9.977  10.127
    7   HG21  ILE  91          HG22      ILE  91   0.118  10.807  10.812
    8   HG23  ILE  91          HG23      ILE  91  -0.531   9.374  11.607
    9   HD13  ILE  91          HD11      ILE  91  -0.861   7.408   7.765
   10   HD12  ILE  91          HD12      ILE  91  -1.439   8.922   7.072
   11   HD11  ILE  91          HD13      ILE  91  -1.729   8.565   8.775

  No H/Q in entry =          11
  In of MODEL   45
    1    H    THR  92           H        THR  92   2.625   7.549  11.773
    2    HA   THR  92           HA       THR  92   2.160   8.933  14.186
    3    HB   THR  92           HB       THR  92   3.970   6.592  13.549
    4    HG1  THR  92           HG1      THR  92   2.001   5.839  13.431
    5   HG22  THR  92          HG21      THR  92   3.558   6.319  16.180
    6   HG21  THR  92          HG22      THR  92   3.498   8.078  16.099
    7   HG23  THR  92          HG23      THR  92   4.935   7.217  15.545

  No H/Q in entry =           7
  In of MODEL   45
    1    H    GLU  93           H        GLU  93   5.130   8.471  12.286
    2    HA   GLU  93           HA       GLU  93   6.868   9.902  13.995
    3    HB2  GLU  93           HB2      GLU  93   6.988   9.575  10.982
    4    HB3  GLU  93           HB3      GLU  93   8.319  10.106  12.009
    5    HG2  GLU  93           HG2      GLU  93   6.900   7.474  12.452
    6    HG3  GLU  93           HG3      GLU  93   8.295   7.619  11.390

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LEU  94           H        LEU  94   4.850  10.909  11.257
    2    HA   LEU  94           HA       LEU  94   5.661  13.611  11.154
    3    HB2  LEU  94           HB2      LEU  94   3.076  12.247  10.378
    4    HB3  LEU  94           HB3      LEU  94   3.340  13.973  10.133
    5    HG   LEU  94           HG       LEU  94   5.365  11.978   9.112
    6   HD11  LEU  94          HD11      LEU  94   2.636  12.528   8.018
    7   HD13  LEU  94          HD12      LEU  94   3.618  11.069   7.909
    8   HD12  LEU  94          HD13      LEU  94   3.966  12.445   6.863
    9   HD23  LEU  94          HD21      LEU  94   5.636  13.806   7.385
   10   HD22  LEU  94          HD22      LEU  94   6.034  14.305   9.029
   11   HD21  LEU  94          HD23      LEU  94   4.491  14.772   8.312

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  95           H        ILE  95   3.101  12.005  13.025
    2    HA   ILE  95           HA       ILE  95   2.048  14.361  14.199
    3    HB   ILE  95           HB       ILE  95   2.052  11.483  15.136
    4   HG12  ILE  95          HG12      ILE  95  -0.155  13.254  14.055
    5   HG13  ILE  95          HG13      ILE  95   0.811  12.190  13.038
    6   HG21  ILE  95          HG21      ILE  95   0.759  13.961  16.313
    7   HG23  ILE  95          HG22      ILE  95   1.798  12.795  17.134
    8   HG22  ILE  95          HG23      ILE  95   0.167  12.333  16.643
    9   HD13  ILE  95          HD11      ILE  95  -0.103  10.256  13.955
   10   HD12  ILE  95          HD12      ILE  95  -1.485  11.347  14.012
   11   HD11  ILE  95          HD13      ILE  95  -0.536  11.054  15.469

  No H/Q in entry =          11
  In of MODEL   45
    1    H    GLU  96           H        GLU  96   4.630  12.144  15.231
    2    HA   GLU  96           HA       GLU  96   5.159  13.353  17.724
    3    HB2  GLU  96           HB2      GLU  96   6.113  11.191  17.096
    4    HB3  GLU  96           HB3      GLU  96   7.060  11.958  15.823
    5    HG2  GLU  96           HG2      GLU  96   8.693  12.512  17.301
    6    HG3  GLU  96           HG3      GLU  96   7.536  13.330  18.340

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LEU  97           H        LEU  97   6.270  14.111  14.447
    2    HA   LEU  97           HA       LEU  97   8.148  16.110  15.171
    3    HB2  LEU  97           HB2      LEU  97   6.584  15.550  12.661
    4    HB3  LEU  97           HB3      LEU  97   7.602  16.982  12.788
    5    HG   LEU  97           HG       LEU  97   8.625  14.187  13.370
    6   HD12  LEU  97          HD11      LEU  97   9.646  14.371  11.063
    7   HD11  LEU  97          HD12      LEU  97   8.598  15.760  10.782
    8   HD13  LEU  97          HD13      LEU  97   7.895  14.170  11.076
    9   HD23  LEU  97          HD21      LEU  97  10.802  15.462  12.646
   10   HD22  LEU  97          HD22      LEU  97  10.165  15.739  14.267
   11   HD21  LEU  97          HD23      LEU  97   9.865  16.916  12.990

  No H/Q in entry =          11
  In of MODEL   45
    1    H    HIS  98           H        HIS  98   4.664  16.242  14.478
    2    HA   HIS  98           HA       HIS  98   4.363  19.042  14.598
    3    HB2  HIS  98           HB2      HIS  98   2.466  16.795  15.313
    4    HB3  HIS  98           HB3      HIS  98   1.998  18.495  15.356
    5    HD1  HIS  98           HD1      HIS  98   3.046  15.770  12.974
    6    HD2  HIS  98           HD2      HIS  98   1.671  19.703  12.821
    7    HE1  HIS  98           HE1      HIS  98   2.513  16.249  10.542
    8    HE2  HIS  98           HE2      HIS  98   1.679  18.637  10.428

  No H/Q in entry =           8
  In of MODEL   45
    1    H    GLU  99           H        GLU  99   4.470  16.564  17.109
    2    HA   GLU  99           HA       GLU  99   3.838  18.268  19.293
    3    HB2  GLU  99           HB2      GLU  99   3.748  15.786  19.399
    4    HB3  GLU  99           HB3      GLU  99   5.509  15.741  19.310
    5    HG2  GLU  99           HG2      GLU  99   5.675  17.042  21.381
    6    HG3  GLU  99           HG3      GLU  99   3.922  17.183  21.457

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LYS 100           H        LYS 100   6.908  17.331  17.765
    2    HA   LYS 100           HA       LYS 100   8.543  18.740  19.634
    3    HB2  LYS 100           HB2      LYS 100   9.072  17.804  16.805
    4    HB3  LYS 100           HB3      LYS 100  10.291  18.578  17.823
    5    HG2  LYS 100           HG2      LYS 100   9.896  16.834  19.567
    6    HG3  LYS 100           HG3      LYS 100   8.776  16.026  18.467
    7    HD2  LYS 100           HD2      LYS 100  10.588  15.737  16.820
    8    HD3  LYS 100           HD3      LYS 100  11.714  16.557  17.906
    9    HE2  LYS 100           HE2      LYS 100  11.299  14.809  19.627
   10    HE3  LYS 100           HE3      LYS 100  10.236  13.968  18.493
   11    HZ1  LYS 100           HZ1      LYS 100  13.064  14.636  17.866
   12    HZ3  LYS 100           HZ2      LYS 100  12.029  13.577  17.031
   13    HZ2  LYS 100           HZ3      LYS 100  12.601  13.164  18.577

  No H/Q in entry =          13
  In of MODEL   45
    1    H    LEU 101           H        LEU 101   6.881  19.654  16.656
    2    HA   LEU 101           HA       LEU 101   8.098  22.210  16.324
    3    HB2  LEU 101           HB2      LEU 101   5.513  20.972  15.414
    4    HB3  LEU 101           HB3      LEU 101   5.766  22.703  15.202
    5    HG   LEU 101           HG       LEU 101   7.813  20.683  14.267
    6   HD12  LEU 101          HD11      LEU 101   6.684  21.179  11.968
    7   HD11  LEU 101          HD12      LEU 101   5.274  21.613  12.931
    8   HD13  LEU 101          HD13      LEU 101   5.938  19.983  13.027
    9   HD21  LEU 101          HD21      LEU 101   7.190  23.592  13.693
   10   HD23  LEU 101          HD22      LEU 101   8.183  22.628  12.601
   11   HD22  LEU 101          HD23      LEU 101   8.707  22.893  14.263

  No H/Q in entry =          11
  In of MODEL   45
    1    H    LYS 102           H        LYS 102   6.533  21.083  18.927
    2    HA   LYS 102           HA       LYS 102   5.880  22.182  20.848
    3    HB2  LYS 102           HB2      LYS 102   7.175  24.168  19.730
    4    HB3  LYS 102           HB3      LYS 102   5.580  24.771  19.334
    5    HG2  LYS 102           HG2      LYS 102   6.928  24.526  22.002
    6    HG3  LYS 102           HG3      LYS 102   5.983  25.852  21.357
    7    HD2  LYS 102           HD2      LYS 102   4.729  23.219  22.233
    8    HD3  LYS 102           HD3      LYS 102   4.966  24.585  23.314
    9    HE2  LYS 102           HE2      LYS 102   2.703  24.176  21.802
   10    HE3  LYS 102           HE3      LYS 102   3.199  25.724  22.483
   11    HZ2  LYS 102           HZ1      LYS 102   2.694  25.823  20.098
   12    HZ1  LYS 102           HZ2      LYS 102   3.959  24.739  19.793
   13    HZ3  LYS 102           HZ3      LYS 102   4.295  26.272  20.433

  No H/Q in entry =          13
  In of MODEL   45
    1    H    ALA 103           H        ALA 103   4.272  23.714  18.057
    2    HA   ALA 103           HA       ALA 103   1.809  24.294  18.913
    3    HB1  ALA 103           HB1      ALA 103   0.934  23.444  16.665
    4    HB2  ALA 103           HB2      ALA 103   2.585  22.905  16.355
    5    HB3  ALA 103           HB3      ALA 103   2.248  24.619  16.611

  No H/Q in entry =           5
  In of MODEL   45
    1    H1   ALA   1           H3       ALA   1  10.667 -20.308  -6.089
    2    H2   ALA   1           H2       ALA   1   9.717 -20.519  -7.484
    3    H3   ALA   1           H1       ALA   1   9.264 -21.259  -6.023
    4    HA   ALA   1           HA       ALA   1  10.310 -23.072  -6.744
    5    HB1  ALA   1           HB1      ALA   1  10.429 -22.722  -9.020
    6    HB2  ALA   1           HB2      ALA   1  12.153 -22.572  -8.674
    7    HB3  ALA   1           HB3      ALA   1  11.158 -21.124  -8.841

  No H/Q in entry =           7
  In of MODEL   45
    1    H    GLU   2           H        GLU   2  12.593 -24.025  -6.774
    2    HA   GLU   2           HA       GLU   2  13.951 -23.936  -4.549
    3    HB2  GLU   2           HB2      GLU   2  15.336 -23.816  -7.234
    4    HB3  GLU   2           HB3      GLU   2  16.047 -24.422  -5.739
    5    HG2  GLU   2           HG2      GLU   2  15.031 -26.439  -5.982
    6    HG3  GLU   2           HG3      GLU   2  13.464 -25.692  -6.261

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLU   3           H        GLU   3  15.749 -22.082  -6.939
    2    HA   GLU   3           HA       GLU   3  16.884 -20.389  -4.973
    3    HB2  GLU   3           HB2      GLU   3  16.859 -20.398  -7.984
    4    HB3  GLU   3           HB3      GLU   3  17.597 -19.066  -7.094
    5    HG2  GLU   3           HG2      GLU   3  19.248 -20.439  -6.149
    6    HG3  GLU   3           HG3      GLU   3  18.303 -21.906  -6.374

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LEU   4           H        LEU   4  14.630 -19.549  -7.631
    2    HA   LEU   4           HA       LEU   4  14.160 -16.937  -7.035
    3    HB2  LEU   4           HB2      LEU   4  11.991 -18.912  -7.780
    4    HB3  LEU   4           HB3      LEU   4  11.920 -17.164  -7.986
    5    HG   LEU   4           HG       LEU   4  13.896 -19.034  -9.331
    6   HD13  LEU   4          HD11      LEU   4  12.615 -18.892 -11.256
    7   HD12  LEU   4          HD12      LEU   4  11.904 -17.344 -10.802
    8   HD11  LEU   4          HD13      LEU   4  11.341 -18.831 -10.040
    9   HD23  LEU   4          HD21      LEU   4  14.250 -16.795 -10.688
   10   HD22  LEU   4          HD22      LEU   4  15.093 -17.032  -9.159
   11   HD21  LEU   4          HD23      LEU   4  13.642 -16.035  -9.217

  No H/Q in entry =          11
  In of MODEL   45
    1    H    GLU   5           H        GLU   5  12.655 -19.713  -5.398
    2    HA   GLU   5           HA       GLU   5  10.962 -18.133  -3.718
    3    HB2  GLU   5           HB2      GLU   5  10.545 -20.515  -4.237
    4    HB3  GLU   5           HB3      GLU   5  11.963 -20.946  -3.281
    5    HG2  GLU   5           HG2      GLU   5  10.965 -19.914  -1.294
    6    HG3  GLU   5           HG3      GLU   5   9.561 -19.423  -2.240

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLU   6           H        GLU   6  14.102 -19.714  -3.237
    2    HA   GLU   6           HA       GLU   6  14.428 -18.848  -0.538
    3    HB2  GLU   6           HB2      GLU   6  16.413 -19.789  -2.621
    4    HB3  GLU   6           HB3      GLU   6  16.837 -19.451  -0.941
    5    HG2  GLU   6           HG2      GLU   6  14.705 -21.424  -1.802
    6    HG3  GLU   6           HG3      GLU   6  16.351 -21.868  -1.355

  No H/Q in entry =           6
  In of MODEL   45
    1    H    VAL   7           H        VAL   7  15.227 -17.534  -3.685
    2    HA   VAL   7           HA       VAL   7  16.906 -15.405  -2.811
    3    HB   VAL   7           HB       VAL   7  15.226 -15.777  -5.305
    4   HG11  VAL   7          HG11      VAL   7  17.112 -13.562  -4.481
    5   HG13  VAL   7          HG12      VAL   7  15.477 -13.421  -5.122
    6   HG12  VAL   7          HG13      VAL   7  16.796 -13.929  -6.177
    7   HG21  VAL   7          HG21      VAL   7  17.325 -17.233  -4.708
    8   HG23  VAL   7          HG22      VAL   7  18.236 -15.774  -5.103
    9   HG22  VAL   7          HG23      VAL   7  17.211 -16.528  -6.322

  No H/Q in entry =           9
  In of MODEL   45
    1    H    VAL   8           H        VAL   8  13.419 -15.675  -3.403
    2    HA   VAL   8           HA       VAL   8  12.750 -12.964  -2.949
    3    HB   VAL   8           HB       VAL   8  11.136 -15.494  -2.530
    4   HG13  VAL   8          HG11      VAL   8  10.065 -13.874  -1.176
    5   HG12  VAL   8          HG12      VAL   8   9.197 -13.787  -2.708
    6   HG11  VAL   8          HG13      VAL   8  10.409 -12.570  -2.312
    7   HG23  VAL   8          HG21      VAL   8  10.483 -13.578  -4.710
    8   HG22  VAL   8          HG22      VAL   8  10.554 -15.337  -4.744
    9   HG21  VAL   8          HG23      VAL   8  12.034 -14.396  -4.893

  No H/Q in entry =           9
  In of MODEL   45
    1    H    MET   9           H        MET   9  12.993 -15.762  -0.756
    2    HA   MET   9           HA       MET   9  12.154 -14.481   1.601
    3    HB2  MET   9           HB2      MET   9  14.059 -16.761   1.084
    4    HB3  MET   9           HB3      MET   9  13.756 -16.171   2.719
    5    HG2  MET   9           HG2      MET   9  11.337 -16.556   2.414
    6    HG3  MET   9           HG3      MET   9  11.640 -17.149   0.780
    7    HE3  MET   9           HE1      MET   9  13.871 -18.247   4.264
    8    HE2  MET   9           HE2      MET   9  12.326 -18.878   4.827
    9    HE1  MET   9           HE3      MET   9  12.446 -17.201   4.300

  No H/Q in entry =           9
  In of MODEL   45
    1    H    GLY  10           H        GLY  10  15.351 -14.712   0.079
    2    HA3  GLY  10           HA2      GLY  10  16.789 -13.283   2.058
    3    HA2  GLY  10           HA3      GLY  10  17.270 -13.455   0.370

  No H/Q in entry =           3
  In of MODEL   45
    1    H    LEU  11           H        LEU  11  15.115 -12.239  -0.896
    2    HA   LEU  11           HA       LEU  11  15.797  -9.493  -0.736
    3    HB2  LEU  11           HB2      LEU  11  13.443 -10.909  -1.991
    4    HB3  LEU  11           HB3      LEU  11  13.724  -9.174  -2.154
    5    HG   LEU  11           HG       LEU  11  15.761 -11.285  -2.913
    6   HD13  LEU  11          HD11      LEU  11  14.031 -11.659  -4.449
    7   HD12  LEU  11          HD12      LEU  11  15.042 -10.480  -5.284
    8   HD11  LEU  11          HD13      LEU  11  13.560  -9.959  -4.483
    9   HD22  LEU  11          HD21      LEU  11  16.989  -9.321  -2.682
   10   HD21  LEU  11          HD22      LEU  11  15.618  -8.286  -3.079
   11   HD23  LEU  11          HD23      LEU  11  16.463  -9.159  -4.356

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  12           H        ILE  12  13.016 -11.316   0.509
    2    HA   ILE  12           HA       ILE  12  11.610  -9.089   1.545
    3    HB   ILE  12           HB       ILE  12  11.642 -11.982   2.458
    4   HG12  ILE  12          HG12      ILE  12  10.912 -11.335   0.052
    5   HG13  ILE  12          HG13      ILE  12   9.834 -12.357   0.983
    6   HG23  ILE  12          HG21      ILE  12  10.748 -10.643   4.260
    7   HG22  ILE  12          HG22      ILE  12   9.381 -11.397   3.441
    8   HG21  ILE  12          HG23      ILE  12   9.763  -9.702   3.140
    9   HD11  ILE  12          HD11      ILE  12   9.590  -9.347   0.721
   10   HD13  ILE  12          HD12      ILE  12   8.449 -10.426   1.521
   11   HD12  ILE  12          HD13      ILE  12   8.667 -10.511  -0.214

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  13           H        ILE  13  13.991 -11.285   2.985
    2    HA   ILE  13           HA       ILE  13  13.998 -10.096   5.561
    3    HB   ILE  13           HB       ILE  13  16.075 -11.672   4.022
    4   HG12  ILE  13          HG12      ILE  13  13.785 -12.627   4.860
    5   HG13  ILE  13          HG13      ILE  13  15.257 -13.558   5.116
    6   HG22  ILE  13          HG21      ILE  13  17.107 -12.014   6.350
    7   HG21  ILE  13          HG22      ILE  13  16.170 -10.617   6.861
    8   HG23  ILE  13          HG23      ILE  13  17.384 -10.446   5.593
    9   HD12  ILE  13          HD11      ILE  13  13.647 -13.286   7.142
   10   HD11  ILE  13          HD12      ILE  13  14.245 -11.631   7.205
   11   HD13  ILE  13          HD13      ILE  13  15.360 -12.974   7.411

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ASN  14           H        ASN  14  15.981  -9.573   2.661
    2    HA   ASN  14           HA       ASN  14  17.710  -7.624   3.733
    3    HB2  ASN  14           HB2      ASN  14  17.715  -8.899   1.422
    4    HB3  ASN  14           HB3      ASN  14  16.824  -7.486   0.870
    5   HD21  ASN  14          HD21      ASN  14  19.278  -7.825  -0.288
    6   HD22  ASN  14          HD22      ASN  14  20.412  -6.736   0.347

  No H/Q in entry =           6
  In of MODEL   45
    1    H    SER  15           H        SER  15  14.617  -7.291   2.006
    2    HA   SER  15           HA       SER  15  14.497  -4.470   2.050
    3    HB2  SER  15           HB2      SER  15  12.171  -4.725   1.530
    4    HB3  SER  15           HB3      SER  15  12.979  -6.093   0.775
    5    HG   SER  15           HG       SER  15  12.284  -7.404   2.394

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLY  16           H        GLY  16  13.385  -6.924   4.352
    2    HA3  GLY  16           HA2      GLY  16  12.139  -5.172   6.189
    3    HA2  GLY  16           HA3      GLY  16  12.755  -6.777   6.564

  No H/Q in entry =           3
  In of MODEL   45
    1    H    GLN  17           H        GLN  17  15.471  -6.438   6.000
    2    HA   GLN  17           HA       GLN  17  16.398  -5.204   8.386
    3    HB2  GLN  17           HB2      GLN  17  17.640  -7.000   7.201
    4    HB3  GLN  17           HB3      GLN  17  17.971  -5.878   5.881
    5    HG2  GLN  17           HG2      GLN  17  19.892  -5.953   7.393
    6    HG3  GLN  17           HG3      GLN  17  19.126  -4.369   7.484
    7   HE21  GLN  17          HE21      GLN  17  19.578  -3.836   9.673
    8   HE22  GLN  17          HE22      GLN  17  19.047  -4.768  10.987

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ALA  18           H        ALA  18  16.242  -4.141   5.020
    2    HA   ALA  18           HA       ALA  18  17.668  -1.742   5.252
    3    HB2  ALA  18           HB1      ALA  18  16.576  -2.969   3.178
    4    HB3  ALA  18           HB2      ALA  18  16.835  -1.225   3.158
    5    HB1  ALA  18           HB3      ALA  18  15.234  -1.874   3.513

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ARG  19           H        ARG  19  14.166  -2.340   5.614
    2    HA   ARG  19           HA       ARG  19  13.481   0.310   6.311
    3    HB2  ARG  19           HB2      ARG  19  11.813  -1.450   5.713
    4    HB3  ARG  19           HB3      ARG  19  12.140  -2.240   7.257
    5    HG2  ARG  19           HG2      ARG  19  11.410  -0.247   8.480
    6    HG3  ARG  19           HG3      ARG  19  11.173   0.623   6.966
    7    HD2  ARG  19           HD2      ARG  19   9.025  -0.178   7.765
    8    HD3  ARG  19           HD3      ARG  19   9.463  -1.062   6.297
    9    HE   ARG  19           HE       ARG  19  10.404  -2.592   8.419
   10   HH21  ARG  19          HH11      ARG  19   9.151  -4.233   9.351
   11   HH22  ARG  19          HH12      ARG  19   7.433  -4.212   9.161
   12   HH11  ARG  19          HH21      ARG  19   7.418  -1.315   7.286
   13   HH12  ARG  19          HH22      ARG  19   6.452  -2.560   7.988

  No H/Q in entry =          13
  In of MODEL   45
    1    H    SER  20           H        SER  20  14.327  -2.510   8.291
    2    HA   SER  20           HA       SER  20  14.013  -1.401  10.820
    3    HB2  SER  20           HB2      SER  20  14.531  -3.783  10.444
    4    HB3  SER  20           HB3      SER  20  16.154  -3.345   9.918
    5    HG   SER  20           HG       SER  20  15.007  -2.792  12.459

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU  21           H        LEU  21  16.879  -1.338   8.715
    2    HA   LEU  21           HA       LEU  21  18.529   0.161  10.466
    3    HB2  LEU  21           HB2      LEU  21  18.542  -0.119   7.453
    4    HB3  LEU  21           HB3      LEU  21  19.785   0.743   8.355
    5    HG   LEU  21           HG       LEU  21  19.041  -2.153   8.865
    6   HD13  LEU  21          HD11      LEU  21  19.965  -1.932   6.614
    7   HD12  LEU  21          HD12      LEU  21  21.169  -2.670   7.670
    8   HD11  LEU  21          HD13      LEU  21  21.306  -0.968   7.232
    9   HD23  LEU  21          HD21      LEU  21  21.513  -1.965   9.826
   10   HD22  LEU  21          HD22      LEU  21  20.155  -1.449  10.818
   11   HD21  LEU  21          HD23      LEU  21  21.117  -0.255   9.962

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ALA  22           H        ALA  22  16.290   1.112   7.881
    2    HA   ALA  22           HA       ALA  22  16.819   3.872   7.890
    3    HB3  ALA  22           HB1      ALA  22  15.439   2.618   6.201
    4    HB2  ALA  22           HB2      ALA  22  14.721   4.131   6.754
    5    HB1  ALA  22           HB3      ALA  22  14.129   2.592   7.381

  No H/Q in entry =           5
  In of MODEL   45
    1    H    TYR  23           H        TYR  23  14.308   2.055   9.704
    2    HA   TYR  23           HA       TYR  23  13.322   4.294  11.134
    3    HB2  TYR  23           HB2      TYR  23  12.092   2.179  11.109
    4    HB3  TYR  23           HB3      TYR  23  13.418   1.372  11.946
    5    HD1  TYR  23           HD1      TYR  23  10.921   4.127  12.288
    6    HD2  TYR  23           HD2      TYR  23  13.581   1.422  14.303
    7    HE1  TYR  23           HE1      TYR  23   9.972   4.821  14.474
    8    HE2  TYR  23           HE2      TYR  23  12.633   2.117  16.487
    9    HH   TYR  23           HH       TYR  23   9.908   4.392  16.667

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ALA  24           H        ALA  24  15.967   2.030  11.810
    2    HA   ALA  24           HA       ALA  24  16.606   3.037  14.376
    3    HB1  ALA  24           HB1      ALA  24  17.970   1.247  14.234
    4    HB3  ALA  24           HB2      ALA  24  19.007   2.168  13.143
    5    HB2  ALA  24           HB3      ALA  24  17.722   1.153  12.491

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA  25           H        ALA  25  17.597   3.956  11.105
    2    HA   ALA  25           HA       ALA  25  19.529   5.899  11.764
    3    HB1  ALA  25           HB1      ALA  25  18.841   4.940   9.445
    4    HB3  ALA  25           HB2      ALA  25  19.337   6.629   9.537
    5    HB2  ALA  25           HB3      ALA  25  17.624   6.217   9.451

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU  26           H        LEU  26  16.018   6.116  11.363
    2    HA   LEU  26           HA       LEU  26  15.781   8.899  11.801
    3    HB2  LEU  26           HB2      LEU  26  13.933   7.655  10.857
    4    HB3  LEU  26           HB3      LEU  26  13.829   6.633  12.285
    5    HG   LEU  26           HG       LEU  26  13.203   8.594  13.651
    6   HD12  LEU  26          HD11      LEU  26  12.552  10.688  12.311
    7   HD11  LEU  26          HD12      LEU  26  13.549  10.033  11.015
    8   HD13  LEU  26          HD13      LEU  26  14.275  10.426  12.573
    9   HD21  LEU  26          HD21      LEU  26  11.556   8.267  11.124
   10   HD23  LEU  26          HD22      LEU  26  10.977   8.970  12.632
   11   HD22  LEU  26          HD23      LEU  26  11.434   7.269  12.573

  No H/Q in entry =          11
  In of MODEL   45
    1    H    LYS  27           H        LYS  27  15.655   6.128  14.003
    2    HA   LYS  27           HA       LYS  27  15.033   7.502  16.359
    3    HB2  LYS  27           HB2      LYS  27  15.070   5.025  16.104
    4    HB3  LYS  27           HB3      LYS  27  16.833   5.082  16.081
    5    HG2  LYS  27           HG2      LYS  27  16.856   6.076  18.327
    6    HG3  LYS  27           HG3      LYS  27  15.089   6.091  18.353
    7    HD2  LYS  27           HD2      LYS  27  15.071   3.623  18.125
    8    HD3  LYS  27           HD3      LYS  27  16.836   3.616  18.133
    9    HE2  LYS  27           HE2      LYS  27  16.843   4.613  20.386
   10    HE3  LYS  27           HE3      LYS  27  15.077   4.650  20.381
   11    HZ3  LYS  27           HZ1      LYS  27  15.856   2.704  21.548
   12    HZ2  LYS  27           HZ2      LYS  27  16.788   2.221  20.209
   13    HZ1  LYS  27           HZ3      LYS  27  15.091   2.223  20.111

  No H/Q in entry =          13
  In of MODEL   45
    1    H    GLN  28           H        GLN  28  18.168   6.919  14.805
    2    HA   GLN  28           HA       GLN  28  19.828   8.013  16.809
    3    HB2  GLN  28           HB2      GLN  28  20.148   7.951  13.798
    4    HB3  GLN  28           HB3      GLN  28  21.421   8.438  14.917
    5    HG2  GLN  28           HG2      GLN  28  20.017   5.751  14.954
    6    HG3  GLN  28           HG3      GLN  28  21.612   6.046  14.264
    7   HE21  GLN  28          HE21      GLN  28  20.288   4.741  16.949
    8   HE22  GLN  28          HE22      GLN  28  21.453   5.174  18.106

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ALA  29           H        ALA  29  18.105   9.483  14.092
    2    HA   ALA  29           HA       ALA  29  19.098  12.106  14.346
    3    HB2  ALA  29           HB1      ALA  29  17.415  12.735  12.854
    4    HB1  ALA  29           HB2      ALA  29  16.265  11.563  13.497
    5    HB3  ALA  29           HB3      ALA  29  17.607  11.018  12.490

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LYS  30           H        LYS  30  16.306  10.509  15.843
    2    HA   LYS  30           HA       LYS  30  15.275  12.767  17.180
    3    HB2  LYS  30           HB2      LYS  30  15.157   9.829  17.893
    4    HB3  LYS  30           HB3      LYS  30  14.281  11.082  18.773
    5    HG2  LYS  30           HG2      LYS  30  13.179  11.759  16.639
    6    HG3  LYS  30           HG3      LYS  30  13.994  10.420  15.827
    7    HD2  LYS  30           HD2      LYS  30  12.906   8.818  17.349
    8    HD3  LYS  30           HD3      LYS  30  12.101  10.146  18.186
    9    HE2  LYS  30           HE2      LYS  30  10.956  10.770  16.078
   10    HE3  LYS  30           HE3      LYS  30  11.740   9.413  15.261
   11    HZ2  LYS  30           HZ1      LYS  30   9.423   9.006  16.117
   12    HZ1  LYS  30           HZ2      LYS  30  10.073   9.066  17.691
   13    HZ3  LYS  30           HZ3      LYS  30  10.594   7.877  16.591

  No H/Q in entry =          13
  In of MODEL   45
    1    H    GLN  31           H        GLN  31  17.928  10.601  17.954
    2    HA   GLN  31           HA       GLN  31  18.226  11.626  20.648
    3    HB2  GLN  31           HB2      GLN  31  20.267  10.050  19.072
    4    HB3  GLN  31           HB3      GLN  31  20.113  10.180  20.824
    5    HG2  GLN  31           HG2      GLN  31  17.608   9.225  20.031
    6    HG3  GLN  31           HG3      GLN  31  18.722   8.377  18.967
    7   HE21  GLN  31          HE21      GLN  31  17.155   7.238  21.230
    8   HE22  GLN  31          HE22      GLN  31  18.299   6.582  22.296

  No H/Q in entry =           8
  In of MODEL   45
    1    H    GLY  32           H        GLY  32  18.777  12.932  17.683
    2    HA3  GLY  32           HA2      GLY  32  19.767  14.976  17.172
    3    HA2  GLY  32           HA3      GLY  32  20.506  14.987  18.768

  No H/Q in entry =           3
  In of MODEL   45
    1    H    ASP  33           H        ASP  33  20.949  12.088  17.007
    2    HA   ASP  33           HA       ASP  33  23.779  12.762  16.569
    3    HB2  ASP  33           HB2      ASP  33  22.270  10.147  16.678
    4    HB3  ASP  33           HB3      ASP  33  23.962  10.262  16.202

  No H/Q in entry =           4
  In of MODEL   45
    1    H    PHE  34           H        PHE  34  23.318  14.079  14.678
    2    HA   PHE  34           HA       PHE  34  21.995  13.086  12.380
    3    HB2  PHE  34           HB2      PHE  34  24.122  15.222  12.625
    4    HB3  PHE  34           HB3      PHE  34  23.153  14.926  11.184
    5    HD1  PHE  34           HD1      PHE  34  23.371  16.870  14.093
    6    HD2  PHE  34           HD2      PHE  34  20.521  14.744  11.683
    7    HE1  PHE  34           HE1      PHE  34  21.543  18.271  15.015
    8    HE2  PHE  34           HE2      PHE  34  18.697  16.145  12.608
    9    HZ   PHE  34           HZ       PHE  34  19.212  17.908  14.269

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ALA  35           H        ALA  35  25.358  12.904  13.425
    2    HA   ALA  35           HA       ALA  35  26.491  12.074  10.984
    3    HB3  ALA  35           HB1      ALA  35  28.153  10.912  12.726
    4    HB2  ALA  35           HB2      ALA  35  27.276  11.941  13.858
    5    HB1  ALA  35           HB3      ALA  35  28.127  12.660  12.492

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA  36           H        ALA  36  25.346  10.128  13.744
    2    HA   ALA  36           HA       ALA  36  25.846   7.636  12.483
    3    HB2  ALA  36           HB1      ALA  36  25.393   6.897  14.556
    4    HB3  ALA  36           HB2      ALA  36  23.707   7.389  14.386
    5    HB1  ALA  36           HB3      ALA  36  24.900   8.524  15.017

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA  37           H        ALA  37  23.021   9.759  12.577
    2    HA   ALA  37           HA       ALA  37  21.180   7.983  11.388
    3    HB3  ALA  37           HB1      ALA  37  21.399  10.948  11.672
    4    HB1  ALA  37           HB2      ALA  37  20.083   9.869  12.134
    5    HB2  ALA  37           HB3      ALA  37  20.290  10.335  10.445

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LYS  38           H        LYS  38  23.292  10.442   9.923
    2    HA   LYS  38           HA       LYS  38  22.683  10.003   7.240
    3    HB2  LYS  38           HB2      LYS  38  24.475  11.569   8.700
    4    HB3  LYS  38           HB3      LYS  38  25.520  10.577   7.689
    5    HG2  LYS  38           HG2      LYS  38  24.377  11.338   5.677
    6    HG3  LYS  38           HG3      LYS  38  23.170  12.195   6.642
    7    HD2  LYS  38           HD2      LYS  38  24.754  13.798   7.406
    8    HD3  LYS  38           HD3      LYS  38  26.122  12.813   6.889
    9    HE2  LYS  38           HE2      LYS  38  25.779  14.678   5.327
   10    HE3  LYS  38           HE3      LYS  38  25.455  13.137   4.525
   11    HZ3  LYS  38           HZ1      LYS  38  23.259  13.577   4.369
   12    HZ2  LYS  38           HZ2      LYS  38  23.778  15.193   4.456
   13    HZ1  LYS  38           HZ3      LYS  38  23.190  14.413   5.845

  No H/Q in entry =          13
  In of MODEL   45
    1    H    ALA  39           H        ALA  39  25.178   8.417   9.230
    2    HA   ALA  39           HA       ALA  39  26.273   6.823   7.178
    3    HB2  ALA  39           HB1      ALA  39  26.155   5.870  10.024
    4    HB1  ALA  39           HB2      ALA  39  27.110   7.296   9.613
    5    HB3  ALA  39           HB3      ALA  39  27.473   5.744   8.859

  No H/Q in entry =           5
  In of MODEL   45
    1    H    MET  40           H        MET  40  23.636   6.211   9.450
    2    HA   MET  40           HA       MET  40  23.207   3.502   8.721
    3    HB2  MET  40           HB2      MET  40  21.372   5.546   9.985
    4    HB3  MET  40           HB3      MET  40  20.971   3.836   9.812
    5    HG2  MET  40           HG2      MET  40  23.504   4.787  11.178
    6    HG3  MET  40           HG3      MET  40  22.000   4.512  12.056
    7    HE3  MET  40           HE1      MET  40  21.443   0.877  12.238
    8    HE2  MET  40           HE2      MET  40  20.580   2.175  11.417
    9    HE1  MET  40           HE3      MET  40  21.303   2.470  12.996

  No H/Q in entry =           9
  In of MODEL   45
    1    H    MET  41           H        MET  41  21.800   6.547   7.507
    2    HA   MET  41           HA       MET  41  19.864   5.342   5.818
    3    HB2  MET  41           HB2      MET  41  21.344   7.933   5.311
    4    HB3  MET  41           HB3      MET  41  19.825   7.433   4.578
    5    HG2  MET  41           HG2      MET  41  19.052   7.252   7.122
    6    HG3  MET  41           HG3      MET  41  20.355   8.414   7.354
    7    HE2  MET  41           HE1      MET  41  19.826   9.688   4.006
    8    HE1  MET  41           HE2      MET  41  20.766  10.135   5.427
    9    HE3  MET  41           HE3      MET  41  19.497  11.210   4.844

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ASP  42           H        ASP  42  23.240   6.271   5.298
    2    HA   ASP  42           HA       ASP  42  23.363   5.787   2.543
    3    HB2  ASP  42           HB2      ASP  42  25.092   6.796   4.328
    4    HB3  ASP  42           HB3      ASP  42  25.755   5.172   4.214

  No H/Q in entry =           4
  In of MODEL   45
    1    H    GLN  43           H        GLN  43  24.063   3.644   5.280
    2    HA   GLN  43           HA       GLN  43  24.751   1.383   3.713
    3    HB2  GLN  43           HB2      GLN  43  23.697   1.574   6.544
    4    HB3  GLN  43           HB3      GLN  43  24.288   0.084   5.801
    5    HG2  GLN  43           HG2      GLN  43  26.453   1.298   5.309
    6    HG3  GLN  43           HG3      GLN  43  25.856   2.628   6.297
    7   HE21  GLN  43          HE21      GLN  43  28.080   1.664   7.362
    8   HE22  GLN  43          HE22      GLN  43  27.795   0.585   8.639

  No H/Q in entry =           8
  In of MODEL   45
    1    H    SER  44           H        SER  44  21.677   2.513   5.060
    2    HA   SER  44           HA       SER  44  20.121   0.263   4.379
    3    HB2  SER  44           HB2      SER  44  19.661   2.795   5.510
    4    HB3  SER  44           HB3      SER  44  18.642   2.744   4.074
    5    HG   SER  44           HG       SER  44  17.532   1.804   5.788

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ARG  45           H        ARG  45  20.876   3.224   2.571
    2    HA   ARG  45           HA       ARG  45  19.377   2.725   0.252
    3    HB2  ARG  45           HB2      ARG  45  20.509   4.866   0.841
    4    HB3  ARG  45           HB3      ARG  45  22.060   4.114   0.475
    5    HG2  ARG  45           HG2      ARG  45  21.303   3.698  -1.847
    6    HG3  ARG  45           HG3      ARG  45  19.764   4.473  -1.480
    7    HD2  ARG  45           HD2      ARG  45  21.003   6.575  -0.890
    8    HD3  ARG  45           HD3      ARG  45  22.507   5.803  -1.439
    9    HE   ARG  45           HE       ARG  45  20.600   5.553  -3.495
   10   HH21  ARG  45          HH11      ARG  45  20.608   6.916  -5.263
   11   HH22  ARG  45          HH12      ARG  45  21.360   8.468  -5.156
   12   HH11  ARG  45          HH21      ARG  45  22.306   8.062  -1.859
   13   HH12  ARG  45          HH22      ARG  45  22.321   9.117  -3.226

  No H/Q in entry =          13
  In of MODEL   45
    1    H    MET  46           H        MET  46  22.735   1.861   1.038
    2    HA   MET  46           HA       MET  46  23.370   0.660  -1.435
    3    HB2  MET  46           HB2      MET  46  24.449   0.351   1.367
    4    HB3  MET  46           HB3      MET  46  25.118  -0.552   0.006
    5    HG2  MET  46           HG2      MET  46  25.577   1.543  -1.190
    6    HG3  MET  46           HG3      MET  46  24.854   2.468   0.120
    7    HE1  MET  46           HE1      MET  46  27.333   0.058  -1.064
    8    HE3  MET  46           HE2      MET  46  27.525  -0.737   0.495
    9    HE2  MET  46           HE3      MET  46  28.815   0.291  -0.126

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ALA  47           H        ALA  47  21.958  -0.664   1.532
    2    HA   ALA  47           HA       ALA  47  21.918  -3.380   0.739
    3    HB2  ALA  47           HB1      ALA  47  21.514  -2.912   3.037
    4    HB3  ALA  47           HB2      ALA  47  19.985  -3.520   2.405
    5    HB1  ALA  47           HB3      ALA  47  20.209  -1.787   2.659

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU  48           H        LEU  48  19.565  -0.759   0.348
    2    HA   LEU  48           HA       LEU  48  17.535  -2.300  -0.918
    3    HB2  LEU  48           HB2      LEU  48  18.186   0.655  -1.038
    4    HB3  LEU  48           HB3      LEU  48  16.723  -0.060  -1.717
    5    HG   LEU  48           HG       LEU  48  17.548  -0.350   1.182
    6   HD13  LEU  48          HD11      LEU  48  17.129   1.950   0.982
    7   HD12  LEU  48          HD12      LEU  48  15.566   1.302   1.478
    8   HD11  LEU  48          HD13      LEU  48  15.854   1.718  -0.212
    9   HD22  LEU  48          HD21      LEU  48  16.025  -2.068   0.792
   10   HD21  LEU  48          HD22      LEU  48  15.163  -1.171  -0.458
   11   HD23  LEU  48          HD23      LEU  48  14.933  -0.760   1.241

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ASN  49           H        ASN  49  20.233  -0.373  -2.129
    2    HA   ASN  49           HA       ASN  49  19.609  -0.469  -4.859
    3    HB2  ASN  49           HB2      ASN  49  21.279   1.051  -3.917
    4    HB3  ASN  49           HB3      ASN  49  22.307  -0.308  -3.485
    5   HD21  ASN  49          HD21      ASN  49  23.263   1.741  -5.181
    6   HD22  ASN  49          HD22      ASN  49  23.474   1.110  -6.742

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLU  50           H        GLU  50  21.576  -2.653  -2.868
    2    HA   GLU  50           HA       GLU  50  22.301  -4.417  -4.980
    3    HB2  GLU  50           HB2      GLU  50  23.477  -4.381  -2.802
    4    HB3  GLU  50           HB3      GLU  50  22.027  -5.007  -2.018
    5    HG2  GLU  50           HG2      GLU  50  22.132  -7.046  -3.367
    6    HG3  GLU  50           HG3      GLU  50  23.516  -6.416  -4.258

  No H/Q in entry =           6
  In of MODEL   45
    1    H    ALA  51           H        ALA  51  19.622  -4.344  -2.680
    2    HA   ALA  51           HA       ALA  51  18.465  -6.822  -3.438
    3    HB3  ALA  51           HB1      ALA  51  16.857  -6.311  -1.901
    4    HB1  ALA  51           HB2      ALA  51  16.648  -4.667  -2.508
    5    HB2  ALA  51           HB3      ALA  51  17.998  -5.048  -1.438

  No H/Q in entry =           5
  In of MODEL   45
    1    H    HIS  52           H        HIS  52  17.886  -3.479  -4.493
    2    HA   HIS  52           HA       HIS  52  15.791  -4.015  -6.311
    3    HB2  HIS  52           HB2      HIS  52  16.403  -1.746  -5.528
    4    HB3  HIS  52           HB3      HIS  52  17.896  -1.843  -6.461
    5    HD1  HIS  52           HD1      HIS  52  17.589  -2.107  -9.121
    6    HD2  HIS  52           HD2      HIS  52  14.167  -0.996  -7.016
    7    HE1  HIS  52           HE1      HIS  52  15.952  -1.213 -10.835
    8    HE2  HIS  52           HE2      HIS  52  13.861  -0.530  -9.567

  No H/Q in entry =           8
  In of MODEL   45
    1    H    LEU  53           H        LEU  53  19.313  -4.019  -6.710
    2    HA   LEU  53           HA       LEU  53  19.398  -4.347  -9.508
    3    HB2  LEU  53           HB2      LEU  53  21.308  -5.074  -7.305
    4    HB3  LEU  53           HB3      LEU  53  21.641  -5.507  -8.979
    5    HG   LEU  53           HG       LEU  53  20.902  -2.670  -8.252
    6   HD11  LEU  53          HD11      LEU  53  23.587  -4.036  -8.018
    7   HD13  LEU  53          HD12      LEU  53  22.757  -3.048  -6.816
    8   HD12  LEU  53          HD13      LEU  53  23.441  -2.296  -8.251
    9   HD22  LEU  53          HD21      LEU  53  21.715  -2.118 -10.348
   10   HD21  LEU  53          HD22      LEU  53  21.212  -3.771 -10.683
   11   HD23  LEU  53          HD23      LEU  53  22.899  -3.419 -10.361

  No H/Q in entry =          11
  In of MODEL   45
    1    H    VAL  54           H        VAL  54  19.263  -6.722  -6.873
    2    HA   VAL  54           HA       VAL  54  19.405  -9.024  -8.521
    3    HB   VAL  54           HB       VAL  54  18.224  -8.589  -5.767
    4   HG12  VAL  54          HG11      VAL  54  18.552 -11.206  -5.747
    5   HG11  VAL  54          HG12      VAL  54  18.383 -11.046  -7.495
    6   HG13  VAL  54          HG13      VAL  54  17.084 -10.513  -6.432
    7   HG22  VAL  54          HG21      VAL  54  20.537  -8.374  -5.523
    8   HG21  VAL  54          HG22      VAL  54  20.889  -9.471  -6.856
    9   HG23  VAL  54          HG23      VAL  54  20.345 -10.112  -5.305

  No H/Q in entry =           9
  In of MODEL   45
    1    H    GLN  55           H        GLN  55  16.662  -7.119  -7.273
    2    HA   GLN  55           HA       GLN  55  14.654  -8.792  -8.358
    3    HB2  GLN  55           HB2      GLN  55  13.888  -7.260  -6.746
    4    HB3  GLN  55           HB3      GLN  55  14.686  -5.894  -7.521
    5    HG2  GLN  55           HG2      GLN  55  12.975  -5.579  -9.028
    6    HG3  GLN  55           HG3      GLN  55  12.658  -7.301  -9.194
    7   HE21  GLN  55          HE21      GLN  55  10.644  -7.850  -8.405
    8   HE22  GLN  55          HE22      GLN  55   9.857  -7.091  -7.108

  No H/Q in entry =           8
  In of MODEL   45
    1    H    THR  56           H        THR  56  16.401  -5.995  -9.714
    2    HA   THR  56           HA       THR  56  14.985  -5.647 -12.078
    3    HB   THR  56           HB       THR  56  18.002  -5.549 -11.873
    4    HG1  THR  56           HG1      THR  56  16.484  -3.273 -11.506
    5   HG22  THR  56          HG21      THR  56  17.519  -3.584 -13.486
    6   HG21  THR  56          HG22      THR  56  15.926  -4.316 -13.676
    7   HG23  THR  56          HG23      THR  56  17.372  -5.224 -14.122

  No H/Q in entry =           7
  In of MODEL   45
    1    H    LYS  57           H        LYS  57  17.633  -7.935 -11.430
    2    HA   LYS  57           HA       LYS  57  17.661  -9.142 -14.003
    3    HB2  LYS  57           HB2      LYS  57  19.435  -9.381 -12.236
    4    HB3  LYS  57           HB3      LYS  57  18.323 -10.379 -11.309
    5    HG2  LYS  57           HG2      LYS  57  18.252 -12.034 -13.104
    6    HG3  LYS  57           HG3      LYS  57  19.282 -11.026 -14.113
    7    HD2  LYS  57           HD2      LYS  57  21.095 -11.213 -12.425
    8    HD3  LYS  57           HD3      LYS  57  20.070 -12.274 -11.459
    9    HE2  LYS  57           HE2      LYS  57  20.887 -12.851 -14.328
   10    HE3  LYS  57           HE3      LYS  57  21.699 -13.533 -12.921
   11    HZ3  LYS  57           HZ1      LYS  57  20.086 -15.079 -13.712
   12    HZ2  LYS  57           HZ2      LYS  57  18.859 -13.905 -13.683
   13    HZ1  LYS  57           HZ3      LYS  57  19.541 -14.460 -12.230

  No H/Q in entry =          13
  In of MODEL   45
    1    H    LEU  58           H        LEU  58  15.854  -9.799 -11.041
    2    HA   LEU  58           HA       LEU  58  14.647 -12.180 -11.976
    3    HB2  LEU  58           HB2      LEU  58  13.827 -10.266  -9.797
    4    HB3  LEU  58           HB3      LEU  58  13.027 -11.808 -10.114
    5    HG   LEU  58           HG       LEU  58  15.994 -11.519  -9.532
    6   HD11  LEU  58          HD11      LEU  58  13.607 -11.934  -7.760
    7   HD13  LEU  58          HD12      LEU  58  15.055 -10.966  -7.489
    8   HD12  LEU  58          HD13      LEU  58  15.131 -12.721  -7.344
    9   HD22  LEU  58          HD21      LEU  58  15.891 -13.586 -10.551
   10   HD21  LEU  58          HD22      LEU  58  14.174 -13.799 -10.206
   11   HD23  LEU  58          HD23      LEU  58  15.372 -14.090  -8.944

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  59           H        ILE  59  13.974  -8.848 -12.681
    2    HA   ILE  59           HA       ILE  59  11.269  -9.508 -13.643
    3    HB   ILE  59           HB       ILE  59  12.060  -7.218 -12.442
    4   HG12  ILE  59          HG12      ILE  59  10.172  -7.097 -14.804
    5   HG13  ILE  59          HG13      ILE  59   9.743  -7.885 -13.307
    6   HG21  ILE  59          HG21      ILE  59  13.617  -6.818 -14.484
    7   HG23  ILE  59          HG22      ILE  59  12.619  -5.484 -13.954
    8   HG22  ILE  59          HG23      ILE  59  12.153  -6.439 -15.359
    9   HD12  ILE  59          HD11      ILE  59  10.579  -5.000 -13.600
   10   HD11  ILE  59          HD12      ILE  59  10.208  -5.788 -12.067
   11   HD13  ILE  59          HD13      ILE  59   8.942  -5.573 -13.276

  No H/Q in entry =          11
  In of MODEL   45
    1    H    GLU  60           H        GLU  60  14.482  -8.654 -14.876
    2    HA   GLU  60           HA       GLU  60  13.727  -8.269 -17.593
    3    HB2  GLU  60           HB2      GLU  60  15.899  -7.532 -16.705
    4    HB3  GLU  60           HB3      GLU  60  16.362  -9.209 -16.426
    5    HG2  GLU  60           HG2      GLU  60  16.187  -9.669 -18.845
    6    HG3  GLU  60           HG3      GLU  60  15.709  -7.996 -19.130

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLY  61           H        GLY  61  14.695 -11.139 -15.755
    2    HA3  GLY  61           HA2      GLY  61  14.180 -12.800 -18.153
    3    HA2  GLY  61           HA3      GLY  61  15.201 -13.272 -16.799

  No H/Q in entry =           3
  In of MODEL   45
    1    H    ASP  62           H        ASP  62  12.074 -11.732 -16.462
    2    HA   ASP  62           HA       ASP  62  11.126 -13.684 -14.646
    3    HB2  ASP  62           HB2      ASP  62   9.001 -12.442 -14.798
    4    HB3  ASP  62           HB3      ASP  62  10.379 -11.370 -14.560

  No H/Q in entry =           4
  In of MODEL   45
    1    H    ALA  63           H        ALA  63  10.616 -13.269 -18.147
    2    HA   ALA  63           HA       ALA  63   9.543 -15.997 -18.285
    3    HB1  ALA  63           HB1      ALA  63   7.471 -15.468 -19.228
    4    HB2  ALA  63           HB2      ALA  63   7.970 -13.832 -19.652
    5    HB3  ALA  63           HB3      ALA  63   7.632 -14.240 -17.970

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLY  64           H        GLY  64   8.470 -15.066 -21.001
    2    HA3  GLY  64           HA2      GLY  64   9.388 -14.421 -23.105
    3    HA2  GLY  64           HA3      GLY  64  10.999 -14.651 -22.441

  No H/Q in entry =           3
  In of MODEL   45
    1    H    GLU  65           H        GLU  65   9.783 -17.283 -21.249
    2    HA   GLU  65           HA       GLU  65  10.857 -18.976 -23.243
    3    HB2  GLU  65           HB2      GLU  65   9.182 -19.577 -20.810
    4    HB3  GLU  65           HB3      GLU  65   9.890 -20.820 -21.839
    5    HG2  GLU  65           HG2      GLU  65  12.130 -19.939 -21.422
    6    HG3  GLU  65           HG3      GLU  65  11.458 -18.624 -20.459

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLY  66           H        GLY  66   7.595 -18.104 -22.413
    2    HA3  GLY  66           HA2      GLY  66   6.603 -19.014 -24.987
    3    HA2  GLY  66           HA3      GLY  66   5.892 -19.776 -23.578

  No H/Q in entry =           3
  In of MODEL   45
    1    H    LYS  67           H        LYS  67   4.493 -18.637 -22.282
    2    HA   LYS  67           HA       LYS  67   3.195 -16.389 -23.578
    3    HB2  LYS  67           HB2      LYS  67   1.390 -16.827 -21.937
    4    HB3  LYS  67           HB3      LYS  67   1.833 -18.261 -22.873
    5    HG2  LYS  67           HG2      LYS  67   3.330 -18.982 -21.030
    6    HG3  LYS  67           HG3      LYS  67   2.829 -17.579 -20.089
    7    HD2  LYS  67           HD2      LYS  67   0.506 -18.384 -20.101
    8    HD3  LYS  67           HD3      LYS  67   0.988 -19.781 -21.064
    9    HE2  LYS  67           HE2      LYS  67   2.530 -20.485 -19.258
   10    HE3  LYS  67           HE3      LYS  67   2.010 -19.107 -18.289
   11    HZ2  LYS  67           HZ1      LYS  67   0.546 -21.547 -18.987
   12    HZ1  LYS  67           HZ2      LYS  67  -0.336 -20.112 -18.773
   13    HZ3  LYS  67           HZ3      LYS  67   0.625 -20.720 -17.510

  No H/Q in entry =          13
  In of MODEL   45
    1    H    MET  68           H        MET  68   2.366 -14.597 -22.419
    2    HA   MET  68           HA       MET  68   4.250 -12.958 -21.279
    3    HB2  MET  68           HB2      MET  68   1.243 -12.915 -21.064
    4    HB3  MET  68           HB3      MET  68   2.275 -11.602 -20.494
    5    HG2  MET  68           HG2      MET  68   3.237 -11.374 -22.756
    6    HG3  MET  68           HG3      MET  68   2.200 -12.681 -23.328
    7    HE3  MET  68           HE1      MET  68   1.077  -9.103 -24.693
    8    HE2  MET  68           HE2      MET  68   1.197 -10.760 -25.278
    9    HE1  MET  68           HE3      MET  68   2.588 -10.004 -24.504

  No H/Q in entry =           9
  In of MODEL   45
    1    H    LYS  69           H        LYS  69   2.961 -15.624 -19.676
    2    HA   LYS  69           HA       LYS  69   2.515 -14.655 -17.087
    3    HB2  LYS  69           HB2      LYS  69   1.802 -16.870 -17.879
    4    HB3  LYS  69           HB3      LYS  69   3.484 -17.405 -17.871
    5    HG2  LYS  69           HG2      LYS  69   3.649 -16.957 -15.470
    6    HG3  LYS  69           HG3      LYS  69   1.997 -16.343 -15.453
    7    HD2  LYS  69           HD2      LYS  69   1.168 -18.558 -16.167
    8    HD3  LYS  69           HD3      LYS  69   2.822 -19.174 -16.158
    9    HE2  LYS  69           HE2      LYS  69   3.011 -18.664 -13.757
   10    HE3  LYS  69           HE3      LYS  69   1.369 -18.023 -13.758
   11    HZ1  LYS  69           HZ1      LYS  69   1.126 -20.489 -14.888
   12    HZ3  LYS  69           HZ2      LYS  69   0.732 -20.081 -13.287
   13    HZ2  LYS  69           HZ3      LYS  69   2.256 -20.738 -13.650

  No H/Q in entry =          13
  In of MODEL   45
    1    H    VAL  70           H        VAL  70   3.692 -14.340 -15.246
    2    HA   VAL  70           HA       VAL  70   6.631 -14.708 -15.404
    3    HB   VAL  70           HB       VAL  70   6.837 -12.623 -14.073
    4   HG12  VAL  70          HG11      VAL  70   6.024 -11.069 -15.953
    5   HG11  VAL  70          HG12      VAL  70   5.421 -12.527 -16.741
    6   HG13  VAL  70          HG13      VAL  70   7.145 -12.347 -16.421
    7   HG21  VAL  70          HG21      VAL  70   3.825 -12.594 -14.442
    8   HG23  VAL  70          HG22      VAL  70   4.741 -11.136 -14.066
    9   HG22  VAL  70          HG23      VAL  70   4.729 -12.484 -12.931

  No H/Q in entry =           9
  In of MODEL   45
    1    H    SER  71           H        SER  71   7.644 -14.725 -13.211
    2    HA   SER  71           HA       SER  71   6.532 -16.713 -11.538
    3    HB2  SER  71           HB2      SER  71   8.963 -16.169 -11.668
    4    HB3  SER  71           HB3      SER  71   8.639 -14.655 -10.828
    5    HG   SER  71           HG       SER  71   8.157 -17.297  -9.895

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU  72           H        LEU  72   5.140 -16.593  -9.885
    2    HA   LEU  72           HA       LEU  72   3.580 -14.282  -9.467
    3    HB2  LEU  72           HB2      LEU  72   3.858 -16.829  -7.877
    4    HB3  LEU  72           HB3      LEU  72   2.678 -15.575  -7.504
    5    HG   LEU  72           HG       LEU  72   2.883 -16.895 -10.230
    6   HD11  LEU  72          HD11      LEU  72   1.042 -17.538  -7.904
    7   HD13  LEU  72          HD12      LEU  72   2.317 -18.581  -8.530
    8   HD12  LEU  72          HD13      LEU  72   0.909 -18.216  -9.528
    9   HD23  LEU  72          HD21      LEU  72   0.390 -16.080 -10.173
   10   HD22  LEU  72          HD22      LEU  72   1.643 -14.895 -10.506
   11   HD21  LEU  72          HD23      LEU  72   0.943 -15.004  -8.895

  No H/Q in entry =          11
  In of MODEL   45
    1    H    VAL  73           H        VAL  73   6.222 -15.704  -7.660
    2    HA   VAL  73           HA       VAL  73   6.134 -14.162  -5.336
    3    HB   VAL  73           HB       VAL  73   8.314 -14.963  -4.883
    4   HG12  VAL  73          HG11      VAL  73   7.262 -17.107  -6.714
    5   HG11  VAL  73          HG12      VAL  73   6.350 -16.638  -5.278
    6   HG13  VAL  73          HG13      VAL  73   7.988 -17.271  -5.116
    7   HG23  VAL  73          HG21      VAL  73   9.498 -16.153  -6.936
    8   HG22  VAL  73          HG22      VAL  73   9.680 -14.418  -6.681
    9   HG21  VAL  73          HG23      VAL  73   8.526 -15.018  -7.873

  No H/Q in entry =           9
  In of MODEL   45
    1    H    LEU  74           H        LEU  74   7.154 -13.279  -8.505
    2    HA   LEU  74           HA       LEU  74   9.089 -11.323  -8.000
    3    HB2  LEU  74           HB2      LEU  74   8.671 -12.072 -10.240
    4    HB3  LEU  74           HB3      LEU  74   6.994 -11.534 -10.160
    5    HG   LEU  74           HG       LEU  74   7.755  -9.192  -9.943
    6   HD11  LEU  74          HD11      LEU  74  10.463 -10.530 -10.035
    7   HD13  LEU  74          HD12      LEU  74   9.866  -9.355  -8.864
    8   HD12  LEU  74          HD13      LEU  74  10.252  -8.844 -10.508
    9   HD21  LEU  74          HD21      LEU  74   7.529 -10.603 -12.161
   10   HD23  LEU  74          HD22      LEU  74   9.251 -10.307 -12.240
   11   HD22  LEU  74          HD23      LEU  74   8.146  -8.953 -12.202

  No H/Q in entry =          11
  In of MODEL   45
    1    H    VAL  75           H        VAL  75   5.597 -10.948  -8.392
    2    HA   VAL  75           HA       VAL  75   5.488  -8.190  -7.818
    3    HB   VAL  75           HB       VAL  75   3.402 -10.342  -7.456
    4   HG11  VAL  75          HG11      VAL  75   3.189  -7.303  -7.283
    5   HG13  VAL  75          HG12      VAL  75   2.901  -8.445  -5.978
    6   HG12  VAL  75          HG13      VAL  75   1.814  -8.402  -7.357
    7   HG23  VAL  75          HG21      VAL  75   3.596  -8.148  -9.532
    8   HG22  VAL  75          HG22      VAL  75   2.599  -9.600  -9.578
    9   HG21  VAL  75          HG23      VAL  75   4.347  -9.725  -9.774

  No H/Q in entry =           9
  In of MODEL   45
    1    H    GLU  76           H        GLU  76   5.218 -11.059  -5.699
    2    HA   GLU  76           HA       GLU  76   4.718  -9.689  -3.289
    3    HB2  GLU  76           HB2      GLU  76   4.570 -12.170  -3.553
    4    HB3  GLU  76           HB3      GLU  76   6.317 -12.241  -3.700
    5    HG2  GLU  76           HG2      GLU  76   6.577 -11.366  -1.419
    6    HG3  GLU  76           HG3      GLU  76   4.838 -11.222  -1.243

  No H/Q in entry =           6
  In of MODEL   45
    1    H    ALA  77           H        ALA  77   7.797 -10.595  -4.814
    2    HA   ALA  77           HA       ALA  77   9.462  -9.539  -2.784
    3    HB1  ALA  77           HB1      ALA  77  10.245 -11.095  -4.550
    4    HB2  ALA  77           HB2      ALA  77  11.247  -9.648  -4.441
    5    HB3  ALA  77           HB3      ALA  77  10.065  -9.806  -5.740

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLN  78           H        GLN  78   8.099  -8.137  -5.720
    2    HA   GLN  78           HA       GLN  78   9.445  -5.655  -5.611
    3    HB2  GLN  78           HB2      GLN  78   8.169  -6.585  -7.577
    4    HB3  GLN  78           HB3      GLN  78   6.678  -6.196  -6.721
    5    HG2  GLN  78           HG2      GLN  78   7.332  -3.828  -6.640
    6    HG3  GLN  78           HG3      GLN  78   8.834  -4.205  -7.483
    7   HE21  GLN  78          HE21      GLN  78   6.946  -2.389  -8.629
    8   HE22  GLN  78          HE22      GLN  78   6.274  -3.113 -10.010

  No H/Q in entry =           8
  In of MODEL   45
    1    H    LEU  79           H        LEU  79   6.412  -6.792  -4.210
    2    HA   LEU  79           HA       LEU  79   5.402  -4.383  -3.223
    3    HB2  LEU  79           HB2      LEU  79   4.091  -6.436  -3.173
    4    HB3  LEU  79           HB3      LEU  79   5.224  -7.169  -2.042
    5    HG   LEU  79           HG       LEU  79   4.649  -5.521  -0.328
    6   HD13  LEU  79          HD11      LEU  79   4.192  -3.511  -1.393
    7   HD12  LEU  79          HD12      LEU  79   2.563  -4.038  -0.970
    8   HD11  LEU  79          HD13      LEU  79   3.163  -4.266  -2.611
    9   HD23  LEU  79          HD21      LEU  79   2.063  -6.017  -0.266
   10   HD22  LEU  79          HD22      LEU  79   3.203  -7.354  -0.139
   11   HD21  LEU  79          HD23      LEU  79   2.407  -7.025  -1.674

  No H/Q in entry =          11
  In of MODEL   45
    1    H    HIS  80           H        HIS  80   7.570  -6.708  -1.604
    2    HA   HIS  80           HA       HIS  80   7.828  -5.155   0.761
    3    HB2  HIS  80           HB2      HIS  80   9.184  -7.522  -0.412
    4    HB3  HIS  80           HB3      HIS  80  10.078  -6.619   0.812
    5    HD1  HIS  80           HD1      HIS  80   9.561  -7.246   3.152
    6    HD2  HIS  80           HD2      HIS  80   6.375  -8.111   0.605
    7    HE1  HIS  80           HE1      HIS  80   7.774  -8.345   4.584
    8    HE2  HIS  80           HE2      HIS  80   5.825  -8.877   3.039

  No H/Q in entry =           8
  In of MODEL   45
    1    H    LEU  81           H        LEU  81   9.868  -5.441  -2.126
    2    HA   LEU  81           HA       LEU  81  11.900  -3.693  -1.230
    3    HB2  LEU  81           HB2      LEU  81  11.013  -4.499  -4.001
    4    HB3  LEU  81           HB3      LEU  81  12.428  -3.489  -3.698
    5    HG   LEU  81           HG       LEU  81  12.023  -6.206  -2.417
    6   HD12  LEU  81          HD11      LEU  81  13.861  -6.837  -4.142
    7   HD11  LEU  81          HD12      LEU  81  13.304  -5.418  -5.027
    8   HD13  LEU  81          HD13      LEU  81  12.190  -6.742  -4.696
    9   HD23  LEU  81          HD21      LEU  81  14.651  -5.888  -2.373
   10   HD22  LEU  81          HD22      LEU  81  13.653  -5.123  -1.138
   11   HD21  LEU  81          HD23      LEU  81  14.247  -4.176  -2.502

  No H/Q in entry =          11
  In of MODEL   45
    1    H    MET  82           H        MET  82   9.000  -3.068  -3.205
    2    HA   MET  82           HA       MET  82   9.544  -0.344  -3.711
    3    HB2  MET  82           HB2      MET  82   6.984  -1.939  -3.610
    4    HB3  MET  82           HB3      MET  82   6.987  -0.216  -3.981
    5    HG2  MET  82           HG2      MET  82   8.607  -2.295  -5.488
    6    HG3  MET  82           HG3      MET  82   7.046  -1.676  -6.023
    7    HE3  MET  82           HE1      MET  82   7.506   1.774  -7.203
    8    HE2  MET  82           HE2      MET  82   7.111   1.555  -5.500
    9    HE1  MET  82           HE3      MET  82   6.461   0.440  -6.698

  No H/Q in entry =           9
  In of MODEL   45
    1    H    THR  83           H        THR  83   7.721  -1.932  -1.121
    2    HA   THR  83           HA       THR  83   6.853   0.421   0.185
    3    HB   THR  83           HB       THR  83   6.694  -1.145   2.208
    4    HG1  THR  83           HG1      THR  83   7.455  -3.096   1.996
    5   HG22  THR  83          HG21      THR  83   5.060  -2.718   0.727
    6   HG21  THR  83          HG22      THR  83   5.300  -1.394  -0.408
    7   HG23  THR  83          HG23      THR  83   4.640  -1.072   1.196

  No H/Q in entry =           7
  In of MODEL   45
    1    H    SER  84           H        SER  84   9.671  -1.673   0.749
    2    HA   SER  84           HA       SER  84  10.703  -0.233   2.944
    3    HB2  SER  84           HB2      SER  84  11.981  -2.084   0.943
    4    HB3  SER  84           HB3      SER  84  12.912  -1.325   2.233
    5    HG   SER  84           HG       SER  84  10.635  -3.014   2.471

  No H/Q in entry =           5
  In of MODEL   45
    1    H    MET  85           H        MET  85  11.498   0.013  -0.535
    2    HA   MET  85           HA       MET  85  13.493   1.980  -0.268
    3    HB2  MET  85           HB2      MET  85  13.122   0.690  -2.333
    4    HB3  MET  85           HB3      MET  85  11.599   1.541  -2.585
    5    HG2  MET  85           HG2      MET  85  12.789   3.684  -2.719
    6    HG3  MET  85           HG3      MET  85  14.317   2.869  -2.402
    7    HE2  MET  85           HE1      MET  85  11.682   2.964  -6.048
    8    HE1  MET  85           HE2      MET  85  11.237   3.084  -4.349
    9    HE3  MET  85           HE3      MET  85  11.358   1.501  -5.104

  No H/Q in entry =           9
  In of MODEL   45
    1    H    LEU  86           H        LEU  86  10.010   2.312  -0.821
    2    HA   LEU  86           HA       LEU  86   9.949   5.124  -1.015
    3    HB2  LEU  86           HB2      LEU  86   8.111   3.462  -1.607
    4    HB3  LEU  86           HB3      LEU  86   7.760   3.380   0.119
    5    HG   LEU  86           HG       LEU  86   7.601   5.940   0.054
    6   HD11  LEU  86          HD11      LEU  86   8.409   5.493  -2.636
    7   HD13  LEU  86          HD12      LEU  86   7.964   7.024  -1.887
    8   HD12  LEU  86          HD13      LEU  86   6.738   6.058  -2.703
    9   HD23  LEU  86          HD21      LEU  86   5.487   4.581  -1.629
   10   HD22  LEU  86          HD22      LEU  86   5.282   5.846  -0.420
   11   HD21  LEU  86          HD23      LEU  86   5.675   4.204   0.085

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ALA  87           H        ALA  87   9.448   2.958   1.734
    2    HA   ALA  87           HA       ALA  87   8.877   4.880   3.688
    3    HB1  ALA  87           HB1      ALA  87   9.684   2.059   3.624
    4    HB3  ALA  87           HB2      ALA  87   8.546   2.876   4.692
    5    HB2  ALA  87           HB3      ALA  87  10.270   2.908   5.057

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ARG  88           H        ARG  88  11.971   3.450   2.751
    2    HA   ARG  88           HA       ARG  88  13.559   4.835   4.597
    3    HB2  ARG  88           HB2      ARG  88  14.243   2.856   3.210
    4    HB3  ARG  88           HB3      ARG  88  14.413   3.943   1.835
    5    HG2  ARG  88           HG2      ARG  88  15.863   5.265   3.793
    6    HG3  ARG  88           HG3      ARG  88  16.178   3.577   4.183
    7    HD2  ARG  88           HD2      ARG  88  17.467   3.272   2.353
    8    HD3  ARG  88           HD3      ARG  88  16.344   4.139   1.303
    9    HE   ARG  88           HE       ARG  88  18.726   5.207   2.374
   10   HH21  ARG  88          HH11      ARG  88  19.074   7.425   2.175
   11   HH22  ARG  88          HH12      ARG  88  17.726   8.496   2.011
   12   HH11  ARG  88          HH21      ARG  88  15.390   5.960   2.053
   13   HH12  ARG  88          HH22      ARG  88  15.639   7.664   1.917

  No H/Q in entry =          13
  In of MODEL   45
    1    H    GLU  89           H        GLU  89  12.626   5.720   1.259
    2    HA   GLU  89           HA       GLU  89  14.176   8.079   1.111
    3    HB2  GLU  89           HB2      GLU  89  13.054   7.030  -0.846
    4    HB3  GLU  89           HB3      GLU  89  11.502   7.574  -0.209
    5    HG2  GLU  89           HG2      GLU  89  12.207   9.911  -0.373
    6    HG3  GLU  89           HG3      GLU  89  13.817   9.418  -0.888

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LEU  90           H        LEU  90  10.833   7.575   2.203
    2    HA   LEU  90           HA       LEU  90  10.312  10.311   2.761
    3    HB2  LEU  90           HB2      LEU  90   9.104   7.742   3.784
    4    HB3  LEU  90           HB3      LEU  90   8.469   9.339   4.193
    5    HG   LEU  90           HG       LEU  90   8.921   8.447   1.333
    6   HD12  LEU  90          HD11      LEU  90   6.387   8.120   1.367
    7   HD11  LEU  90          HD12      LEU  90   6.520   8.117   3.125
    8   HD13  LEU  90          HD13      LEU  90   7.350   6.883   2.175
    9   HD22  LEU  90          HD21      LEU  90   8.629  10.755   1.246
   10   HD21  LEU  90          HD22      LEU  90   7.625  10.794   2.695
   11   HD23  LEU  90          HD23      LEU  90   6.946  10.233   1.167

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  91           H        ILE  91  11.551   7.637   4.709
    2    HA   ILE  91           HA       ILE  91  11.663   9.012   7.173
    3    HB   ILE  91           HB       ILE  91  13.229   6.669   6.077
    4   HG12  ILE  91          HG12      ILE  91  11.186   6.846   8.312
    5   HG13  ILE  91          HG13      ILE  91  10.735   6.558   6.632
    6   HG22  ILE  91          HG21      ILE  91  13.668   6.466   8.724
    7   HG21  ILE  91          HG22      ILE  91  13.594   8.224   8.615
    8   HG23  ILE  91          HG23      ILE  91  14.783   7.332   7.668
    9   HD13  ILE  91          HD11      ILE  91  11.738   4.456   6.583
   10   HD12  ILE  91          HD12      ILE  91  11.125   4.521   8.235
   11   HD11  ILE  91          HD13      ILE  91  12.831   4.832   7.916

  No H/Q in entry =          11
  In of MODEL   45
    1    H    THR  92           H        THR  92  13.912   8.831   4.448
    2    HA   THR  92           HA       THR  92  16.064  10.228   5.627
    3    HB   THR  92           HB       THR  92  15.112  10.092   2.756
    4    HG1  THR  92           HG1      THR  92  15.938   8.196   3.178
    5   HG22  THR  92          HG21      THR  92  17.685  10.780   2.490
    6   HG21  THR  92          HG22      THR  92  17.359  11.608   4.012
    7   HG23  THR  92          HG23      THR  92  16.406  11.990   2.579

  No H/Q in entry =           7
  In of MODEL   45
    1    H    GLU  93           H        GLU  93  13.198  11.376   3.860
    2    HA   GLU  93           HA       GLU  93  13.792  14.137   3.970
    3    HB2  GLU  93           HB2      GLU  93  11.087  12.765   3.958
    4    HB3  GLU  93           HB3      GLU  93  11.380  14.463   3.583
    5    HG2  GLU  93           HG2      GLU  93  12.735  12.214   2.080
    6    HG3  GLU  93           HG3      GLU  93  11.195  12.895   1.572

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LEU  94           H        LEU  94  12.023  11.990   6.169
    2    HA   LEU  94           HA       LEU  94  11.192  13.944   8.028
    3    HB2  LEU  94           HB2      LEU  94  11.764  10.990   8.321
    4    HB3  LEU  94           HB3      LEU  94  11.177  11.971   9.660
    5    HG   LEU  94           HG       LEU  94   9.723  12.013   7.014
    6   HD11  LEU  94          HD11      LEU  94   9.782   9.800   9.029
    7   HD13  LEU  94          HD12      LEU  94   9.501   9.732   7.290
    8   HD12  LEU  94          HD13      LEU  94   8.210  10.253   8.371
    9   HD23  LEU  94          HD21      LEU  94   7.786  12.419   8.590
   10   HD22  LEU  94          HD22      LEU  94   9.024  13.673   8.636
   11   HD21  LEU  94          HD23      LEU  94   8.946  12.462   9.915

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  95           H        ILE  95  14.168  12.013   7.834
    2    HA   ILE  95           HA       ILE  95  15.308  12.945  10.257
    3    HB   ILE  95           HB       ILE  95  16.576  11.865   7.728
    4   HG12  ILE  95          HG12      ILE  95  16.248  10.676  10.497
    5   HG13  ILE  95          HG13      ILE  95  15.096  10.412   9.189
    6   HG21  ILE  95          HG21      ILE  95  17.801  12.682  10.381
    7   HG23  ILE  95          HG22      ILE  95  18.282  13.203   8.765
    8   HG22  ILE  95          HG23      ILE  95  18.582  11.545   9.284
    9   HD13  ILE  95          HD11      ILE  95  16.590   9.128   7.949
   10   HD12  ILE  95          HD12      ILE  95  17.044   8.686   9.592
   11   HD11  ILE  95          HD13      ILE  95  18.007   9.861   8.699

  No H/Q in entry =          11
  In of MODEL   45
    1    H    GLU  96           H        GLU  96  15.501  14.164   6.920
    2    HA   GLU  96           HA       GLU  96  17.343  16.244   7.409
    3    HB2  GLU  96           HB2      GLU  96  16.704  15.573   5.145
    4    HB3  GLU  96           HB3      GLU  96  15.058  16.132   5.424
    5    HG2  GLU  96           HG2      GLU  96  15.631  18.259   4.880
    6    HG3  GLU  96           HG3      GLU  96  16.916  18.264   6.077

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LEU  97           H        LEU  97  13.827  16.060   7.799
    2    HA   LEU  97           HA       LEU  97  13.404  18.797   8.425
    3    HB2  LEU  97           HB2      LEU  97  11.878  16.274   9.032
    4    HB3  LEU  97           HB3      LEU  97  11.358  17.824   9.691
    5    HG   LEU  97           HG       LEU  97  11.875  17.395   6.733
    6   HD12  LEU  97          HD11      LEU  97   9.353  17.268   6.587
    7   HD11  LEU  97          HD12      LEU  97   9.326  17.075   8.338
    8   HD13  LEU  97          HD13      LEU  97  10.118  15.863   7.330
    9   HD23  LEU  97          HD21      LEU  97  10.137  19.360   6.738
   10   HD22  LEU  97          HD22      LEU  97  11.814  19.721   7.148
   11   HD21  LEU  97          HD23      LEU  97  10.610  19.556   8.425

  No H/Q in entry =          11
  In of MODEL   45
    1    H    HIS  98           H        HIS  98  14.202  15.978  10.441
    2    HA   HIS  98           HA       HIS  98  14.016  17.249  12.950
    3    HB2  HIS  98           HB2      HIS  98  15.776  14.987  11.978
    4    HB3  HIS  98           HB3      HIS  98  15.755  15.533  13.656
    5    HD1  HIS  98           HD1      HIS  98  13.585  13.894  11.046
    6    HD2  HIS  98           HD2      HIS  98  13.432  14.830  15.105
    7    HE1  HIS  98           HE1      HIS  98  11.549  12.704  11.980
    8    HE2  HIS  98           HE2      HIS  98  11.436  13.265  14.448

  No H/Q in entry =           8
  In of MODEL   45
    1    H    GLU  99           H        GLU  99  16.597  17.123  10.545
    2    HA   GLU  99           HA       GLU  99  18.565  18.460  12.091
    3    HB2  GLU  99           HB2      GLU  99  19.067  17.164  10.033
    4    HB3  GLU  99           HB3      GLU  99  18.269  18.416   9.078
    5    HG2  GLU  99           HG2      GLU  99  19.869  20.088   9.880
    6    HG3  GLU  99           HG3      GLU  99  20.636  18.890  10.916

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LYS 100           H        LYS 100  16.068  19.615   9.842
    2    HA   LYS 100           HA       LYS 100  16.865  22.352   9.984
    3    HB2  LYS 100           HB2      LYS 100  14.240  21.062   9.204
    4    HB3  LYS 100           HB3      LYS 100  14.542  22.800   9.110
    5    HG2  LYS 100           HG2      LYS 100  16.530  22.344   7.668
    6    HG3  LYS 100           HG3      LYS 100  16.115  20.627   7.688
    7    HD2  LYS 100           HD2      LYS 100  13.932  21.135   6.661
    8    HD3  LYS 100           HD3      LYS 100  14.330  22.853   6.648
    9    HE2  LYS 100           HE2      LYS 100  16.305  22.365   5.212
   10    HE3  LYS 100           HE3      LYS 100  15.839  20.661   5.181
   11    HZ1  LYS 100           HZ1      LYS 100  14.025  22.852   4.316
   12    HZ3  LYS 100           HZ2      LYS 100  13.842  21.181   4.059
   13    HZ2  LYS 100           HZ3      LYS 100  15.063  22.039   3.248

  No H/Q in entry =          13
  In of MODEL   45
    1    H    LEU 101           H        LEU 101  14.744  20.316  11.933
    2    HA   LEU 101           HA       LEU 101  13.562  22.391  13.490
    3    HB2  LEU 101           HB2      LEU 101  13.997  19.443  13.890
    4    HB3  LEU 101           HB3      LEU 101  13.446  20.429  15.241
    5    HG   LEU 101           HG       LEU 101  12.059  20.508  12.556
    6   HD12  LEU 101          HD11      LEU 101  10.384  18.951  13.812
    7   HD11  LEU 101          HD12      LEU 101  11.767  18.540  14.824
    8   HD13  LEU 101          HD13      LEU 101  11.819  18.227  13.089
    9   HD21  LEU 101          HD21      LEU 101  11.371  21.313  15.398
   10   HD23  LEU 101          HD22      LEU 101  10.123  21.084  14.174
   11   HD22  LEU 101          HD23      LEU 101  11.362  22.317  13.945

  No H/Q in entry =          11
  In of MODEL   45
    1    H    LYS 102           H        LYS 102  16.714  21.779  13.091
    2    HA   LYS 102           HA       LYS 102  18.549  22.652  14.181
    3    HB2  LYS 102           HB2      LYS 102  16.724  24.173  15.288
    4    HB3  LYS 102           HB3      LYS 102  16.914  23.116  16.671
    5    HG2  LYS 102           HG2      LYS 102  18.823  25.120  15.516
    6    HG3  LYS 102           HG3      LYS 102  18.421  24.813  17.191
    7    HD2  LYS 102           HD2      LYS 102  20.105  22.892  15.532
    8    HD3  LYS 102           HD3      LYS 102  20.785  24.217  16.467
    9    HE2  LYS 102           HE2      LYS 102  20.373  21.672  17.441
   10    HE3  LYS 102           HE3      LYS 102  20.582  23.118  18.429
   11    HZ2  LYS 102           HZ1      LYS 102  18.605  21.838  19.030
   12    HZ1  LYS 102           HZ2      LYS 102  17.979  22.063  17.473
   13    HZ3  LYS 102           HZ3      LYS 102  18.199  23.397  18.496

  No H/Q in entry =          13
  In of MODEL   45
    1    H    ALA 103           H        ALA 103  16.448  21.058  16.586
    2    HA   ALA 103           HA       ALA 103  18.155  19.852  18.265
    3    HB2  ALA 103           HB1      ALA 103  16.568  17.846  18.249
    4    HB1  ALA 103           HB2      ALA 103  15.688  18.696  16.978
    5    HB3  ALA 103           HB3      ALA 103  15.849  19.422  18.576

  No H/Q in entry =           5
  In of MODEL   45
    1    H1   ALA   1           H3       ALA   1  -1.362  -7.131 -21.473
    2    H2   ALA   1           H2       ALA   1  -2.164  -8.563 -21.024
    3    H3   ALA   1           H1       ALA   1  -0.550  -8.617 -21.560
    4    HA   ALA   1           HA       ALA   1  -1.362  -9.093 -23.564
    5    HB1  ALA   1           HB1      ALA   1  -3.505  -9.806 -23.112
    6    HB2  ALA   1           HB2      ALA   1  -3.933  -8.297 -23.920
    7    HB3  ALA   1           HB3      ALA   1  -3.892  -8.371 -22.161

  No H/Q in entry =           7
  In of MODEL   45
    1    H    GLU   2           H        GLU   2  -2.167  -7.909 -25.567
    2    HA   GLU   2           HA       GLU   2  -0.755  -5.901 -26.436
    3    HB2  GLU   2           HB2      GLU   2  -3.759  -5.964 -26.788
    4    HB3  GLU   2           HB3      GLU   2  -2.624  -5.107 -27.828
    5    HG2  GLU   2           HG2      GLU   2  -2.111  -7.001 -28.970
    6    HG3  GLU   2           HG3      GLU   2  -1.832  -7.902 -27.486

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLU   3           H        GLU   3  -3.923  -4.635 -25.577
    2    HA   GLU   3           HA       GLU   3  -2.880  -2.078 -24.946
    3    HB2  GLU   3           HB2      GLU   3  -5.573  -3.387 -24.640
    4    HB3  GLU   3           HB3      GLU   3  -5.280  -1.770 -23.996
    5    HG2  GLU   3           HG2      GLU   3  -4.898  -0.852 -26.122
    6    HG3  GLU   3           HG3      GLU   3  -4.497  -2.410 -26.836

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LEU   4           H        LEU   4  -4.499  -4.426 -22.776
    2    HA   LEU   4           HA       LEU   4  -4.160  -3.190 -20.386
    3    HB2  LEU   4           HB2      LEU   4  -3.617  -6.134 -20.838
    4    HB3  LEU   4           HB3      LEU   4  -4.039  -5.381 -19.302
    5    HG   LEU   4           HG       LEU   4  -5.783  -5.461 -21.786
    6   HD13  LEU   4          HD11      LEU   4  -6.991  -7.173 -20.796
    7   HD12  LEU   4          HD12      LEU   4  -6.524  -6.708 -19.160
    8   HD11  LEU   4          HD13      LEU   4  -5.378  -7.557 -20.196
    9   HD23  LEU   4          HD21      LEU   4  -7.488  -4.640 -19.940
   10   HD22  LEU   4          HD22      LEU   4  -6.438  -3.473 -20.743
   11   HD21  LEU   4          HD23      LEU   4  -6.031  -4.058 -19.131

  No H/Q in entry =          11
  In of MODEL   45
    1    H    GLU   5           H        GLU   5  -1.645  -5.044 -22.081
    2    HA   GLU   5           HA       GLU   5   0.315  -4.756 -20.023
    3    HB2  GLU   5           HB2      GLU   5   0.399  -6.533 -21.765
    4    HB3  GLU   5           HB3      GLU   5   0.725  -5.295 -22.978
    5    HG2  GLU   5           HG2      GLU   5   2.780  -4.652 -21.811
    6    HG3  GLU   5           HG3      GLU   5   2.450  -5.832 -20.542

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLU   6           H        GLU   6  -0.282  -3.052 -23.081
    2    HA   GLU   6           HA       GLU   6   1.888  -1.224 -22.795
    3    HB2  GLU   6           HB2      GLU   6  -0.655  -1.122 -24.431
    4    HB3  GLU   6           HB3      GLU   6   0.618   0.093 -24.532
    5    HG2  GLU   6           HG2      GLU   6   1.030  -2.872 -25.001
    6    HG3  GLU   6           HG3      GLU   6   0.840  -1.675 -26.279

  No H/Q in entry =           6
  In of MODEL   45
    1    H    VAL   7           H        VAL   7  -1.462  -1.285 -21.788
    2    HA   VAL   7           HA       VAL   7  -1.688   1.431 -20.964
    3    HB   VAL   7           HB       VAL   7  -3.164  -1.081 -20.135
    4   HG11  VAL   7          HG11      VAL   7  -3.543   1.811 -19.336
    5   HG13  VAL   7          HG12      VAL   7  -3.459   0.390 -18.295
    6   HG12  VAL   7          HG13      VAL   7  -4.879   0.659 -19.304
    7   HG21  VAL   7          HG21      VAL   7  -3.292  -0.013 -22.529
    8   HG23  VAL   7          HG22      VAL   7  -4.244   1.240 -21.733
    9   HG22  VAL   7          HG23      VAL   7  -4.793  -0.436 -21.706

  No H/Q in entry =           9
  In of MODEL   45
    1    H    VAL   8           H        VAL   8  -0.725  -1.550 -19.299
    2    HA   VAL   8           HA       VAL   8  -0.434  -0.462 -16.704
    3    HB   VAL   8           HB       VAL   8   0.975  -2.787 -18.038
    4   HG13  VAL   8          HG11      VAL   8   2.389  -2.169 -16.239
    5   HG12  VAL   8          HG12      VAL   8   1.360  -3.435 -15.566
    6   HG11  VAL   8          HG13      VAL   8   1.027  -1.741 -15.203
    7   HG23  VAL   8          HG21      VAL   8  -1.011  -3.205 -15.856
    8   HG22  VAL   8          HG22      VAL   8  -0.801  -4.083 -17.368
    9   HG21  VAL   8          HG23      VAL   8  -1.684  -2.561 -17.353

  No H/Q in entry =           9
  In of MODEL   45
    1    H    MET   9           H        MET   9   1.845  -0.777 -19.424
    2    HA   MET   9           HA       MET   9   4.119   0.266 -18.140
    3    HB2  MET   9           HB2      MET   9   3.202   0.272 -21.013
    4    HB3  MET   9           HB3      MET   9   4.706   1.055 -20.529
    5    HG2  MET   9           HG2      MET   9   5.490  -1.067 -19.534
    6    HG3  MET   9           HG3      MET   9   3.989  -1.850 -20.035
    7    HE3  MET   9           HE1      MET   9   6.367   0.736 -22.470
    8    HE2  MET   9           HE2      MET   9   7.608  -0.493 -22.251
    9    HE1  MET   9           HE3      MET   9   6.829   0.224 -20.843

  No H/Q in entry =           9
  In of MODEL   45
    1    H    GLY  10           H        GLY  10   1.458   1.868 -19.854
    2    HA3  GLY  10           HA2      GLY  10   2.425   4.520 -19.608
    3    HA2  GLY  10           HA3      GLY  10   0.737   4.064 -19.830

  No H/Q in entry =           3
  In of MODEL   45
    1    H    LEU  11           H        LEU  11   0.308   2.546 -17.543
    2    HA   LEU  11           HA       LEU  11  -0.239   4.531 -15.597
    3    HB2  LEU  11           HB2      LEU  11  -0.182   1.516 -15.429
    4    HB3  LEU  11           HB3      LEU  11  -0.703   2.545 -14.096
    5    HG   LEU  11           HG       LEU  11  -1.910   2.652 -16.873
    6   HD13  LEU  11          HD11      LEU  11  -2.509   0.513 -16.117
    7   HD12  LEU  11          HD12      LEU  11  -3.862   1.511 -15.590
    8   HD11  LEU  11          HD13      LEU  11  -2.620   1.031 -14.435
    9   HD22  LEU  11          HD21      LEU  11  -2.506   4.673 -15.880
   10   HD21  LEU  11          HD22      LEU  11  -2.451   4.012 -14.246
   11   HD23  LEU  11          HD23      LEU  11  -3.816   3.647 -15.302

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  12           H        ILE  12   2.299   2.056 -15.802
    2    HA   ILE  12           HA       ILE  12   3.479   2.599 -13.288
    3    HB   ILE  12           HB       ILE  12   4.719   1.522 -15.841
    4   HG12  ILE  12          HG12      ILE  12   2.753   0.291 -14.655
    5   HG13  ILE  12          HG13      ILE  12   4.176  -0.642 -15.075
    6   HG23  ILE  12          HG21      ILE  12   6.507   2.305 -14.422
    7   HG22  ILE  12          HG22      ILE  12   6.437   0.552 -14.252
    8   HG21  ILE  12          HG23      ILE  12   5.763   1.587 -12.995
    9   HD11  ILE  12          HD11      ILE  12   3.610   0.575 -12.358
   10   HD13  ILE  12          HD12      ILE  12   4.977  -0.457 -12.773
   11   HD12  ILE  12          HD13      ILE  12   3.352  -1.108 -12.783

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  13           H        ILE  13   4.120   3.849 -16.542
    2    HA   ILE  13           HA       ILE  13   6.254   5.565 -15.800
    3    HB   ILE  13           HB       ILE  13   4.250   5.636 -18.068
    4   HG12  ILE  13          HG12      ILE  13   6.102   3.810 -17.755
    5   HG13  ILE  13          HG13      ILE  13   5.855   4.532 -19.341
    6   HG22  ILE  13          HG21      ILE  13   5.973   7.224 -19.135
    7   HG21  ILE  13          HG22      ILE  13   6.587   7.480 -17.505
    8   HG23  ILE  13          HG23      ILE  13   4.924   7.912 -17.894
    9   HD12  ILE  13          HD11      ILE  13   8.304   4.353 -18.446
   10   HD11  ILE  13          HD12      ILE  13   7.852   5.704 -17.413
   11   HD13  ILE  13          HD13      ILE  13   7.785   5.877 -19.162

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ASN  14           H        ASN  14   2.752   6.070 -16.107
    2    HA   ASN  14           HA       ASN  14   2.712   8.818 -15.480
    3    HB2  ASN  14           HB2      ASN  14   0.822   7.179 -16.326
    4    HB3  ASN  14           HB3      ASN  14   0.482   7.008 -14.608
    5   HD21  ASN  14          HD21      ASN  14  -1.519   8.165 -16.066
    6   HD22  ASN  14          HD22      ASN  14  -1.579   9.839 -15.805

  No H/Q in entry =           6
  In of MODEL   45
    1    H    SER  15           H        SER  15   2.385   5.949 -13.397
    2    HA   SER  15           HA       SER  15   2.056   7.329 -10.957
    3    HB2  SER  15           HB2      SER  15   2.590   5.245  -9.895
    4    HB3  SER  15           HB3      SER  15   1.773   4.824 -11.396
    5    HG   SER  15           HG       SER  15   3.719   4.352 -12.320

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLY  16           H        GLY  16   4.948   6.218 -12.681
    2    HA3  GLY  16           HA2      GLY  16   6.854   6.976 -10.733
    3    HA2  GLY  16           HA3      GLY  16   7.175   6.767 -12.452

  No H/Q in entry =           3
  In of MODEL   45
    1    H    GLN  17           H        GLN  17   5.502   8.725 -13.540
    2    HA   GLN  17           HA       GLN  17   7.082  11.064 -13.223
    3    HB2  GLN  17           HB2      GLN  17   5.770  10.566 -15.275
    4    HB3  GLN  17           HB3      GLN  17   4.281  10.823 -14.365
    5    HG2  GLN  17           HG2      GLN  17   4.849  12.859 -15.589
    6    HG3  GLN  17           HG3      GLN  17   5.019  13.142 -13.857
    7   HE21  GLN  17          HE21      GLN  17   6.710  14.705 -13.894
    8   HE22  GLN  17          HE22      GLN  17   8.251  14.388 -14.533

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ALA  18           H        ALA  18   3.965  10.057 -11.904
    2    HA   ALA  18           HA       ALA  18   3.231  12.452 -10.654
    3    HB1  ALA  18           HB1      ALA  18   2.099   9.997 -10.880
    4    HB2  ALA  18           HB2      ALA  18   1.541  11.222  -9.743
    5    HB3  ALA  18           HB3      ALA  18   2.623   9.939  -9.197

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ARG  19           H        ARG  19   5.086   9.690  -9.345
    2    HA   ARG  19           HA       ARG  19   5.594  10.856  -6.822
    3    HB2  ARG  19           HB2      ARG  19   6.009   8.450  -7.336
    4    HB3  ARG  19           HB3      ARG  19   7.377   8.931  -8.344
    5    HG2  ARG  19           HG2      ARG  19   8.477   9.975  -6.414
    6    HG3  ARG  19           HG3      ARG  19   7.090   9.593  -5.395
    7    HD2  ARG  19           HD2      ARG  19   8.845   7.956  -5.013
    8    HD3  ARG  19           HD3      ARG  19   7.478   7.174  -5.811
    9    HE   ARG  19           HE       ARG  19   9.206   7.983  -7.842
   10   HH21  ARG  19          HH11      ARG  19  10.774   6.572  -8.671
   11   HH22  ARG  19          HH12      ARG  19  11.307   5.227  -7.725
   12   HH11  ARG  19          HH21      ARG  19   9.245   5.962  -5.056
   13   HH12  ARG  19          HH22      ARG  19  10.438   4.881  -5.677

  No H/Q in entry =          13
  In of MODEL   45
    1    H    SER  20           H        SER  20   7.444  10.872  -9.851
    2    HA   SER  20           HA       SER  20   9.681  12.288  -9.008
    3    HB2  SER  20           HB2      SER  20   9.483  11.290 -11.254
    4    HB3  SER  20           HB3      SER  20   8.277  12.499 -11.681
    5    HG   SER  20           HG       SER  20  10.953  13.010 -10.871

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU  21           H        LEU  21   6.597  13.556 -10.243
    2    HA   LEU  21           HA       LEU  21   7.268  16.302 -10.021
    3    HB2  LEU  21           HB2      LEU  21   4.596  14.884  -9.961
    4    HB3  LEU  21           HB3      LEU  21   4.768  16.637  -9.978
    5    HG   LEU  21           HG       LEU  21   5.962  14.809 -12.084
    6   HD13  LEU  21          HD11      LEU  21   3.516  14.661 -12.139
    7   HD12  LEU  21          HD12      LEU  21   4.091  15.598 -13.519
    8   HD11  LEU  21          HD13      LEU  21   3.391  16.420 -12.126
    9   HD23  LEU  21          HD21      LEU  21   5.768  17.161 -13.319
   10   HD22  LEU  21          HD22      LEU  21   7.156  16.827 -12.287
   11   HD21  LEU  21          HD23      LEU  21   5.824  17.796 -11.676

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ALA  22           H        ALA  22   5.730  14.021  -7.781
    2    HA   ALA  22           HA       ALA  22   5.105  15.837  -5.727
    3    HB3  ALA  22           HB1      ALA  22   4.345  13.444  -5.890
    4    HB2  ALA  22           HB2      ALA  22   4.916  13.922  -4.291
    5    HB1  ALA  22           HB3      ALA  22   5.951  12.959  -5.348

  No H/Q in entry =           5
  In of MODEL   45
    1    H    TYR  23           H        TYR  23   8.043  13.809  -6.127
    2    HA   TYR  23           HA       TYR  23   9.402  14.836  -3.863
    3    HB2  TYR  23           HB2      TYR  23  10.203  12.825  -5.003
    4    HB3  TYR  23           HB3      TYR  23  10.529  13.756  -6.465
    5    HD1  TYR  23           HD1      TYR  23  11.454  13.455  -2.859
    6    HD2  TYR  23           HD2      TYR  23  12.572  14.909  -6.744
    7    HE1  TYR  23           HE1      TYR  23  13.703  14.039  -1.993
    8    HE2  TYR  23           HE2      TYR  23  14.820  15.493  -5.878
    9    HH   TYR  23           HH       TYR  23  15.779  14.683  -2.557

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ALA  24           H        ALA  24   9.255  15.931  -7.235
    2    HA   ALA  24           HA       ALA  24  11.148  18.017  -6.976
    3    HB2  ALA  24           HB1      ALA  24  10.729  18.071  -9.190
    4    HB3  ALA  24           HB2      ALA  24   9.169  18.822  -8.850
    5    HB1  ALA  24           HB3      ALA  24   9.297  17.068  -8.972

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA  25           H        ALA  25   7.662  17.833  -6.392
    2    HA   ALA  25           HA       ALA  25   7.174  20.553  -5.838
    3    HB1  ALA  25           HB1      ALA  25   5.517  18.552  -6.050
    4    HB2  ALA  25           HB2      ALA  25   5.136  19.845  -4.910
    5    HB3  ALA  25           HB3      ALA  25   5.820  18.327  -4.326

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU  26           H        LEU  26   8.223  17.882  -3.767
    2    HA   LEU  26           HA       LEU  26   8.300  19.322  -1.334
    3    HB2  LEU  26           HB2      LEU  26   8.398  16.906  -1.319
    4    HB3  LEU  26           HB3      LEU  26   9.879  16.912  -2.274
    5    HG   LEU  26           HG       LEU  26  11.072  18.038  -0.425
    6   HD12  LEU  26          HD11      LEU  26   9.822  18.052   1.822
    7   HD11  LEU  26          HD12      LEU  26   8.345  17.909   0.872
    8   HD13  LEU  26          HD13      LEU  26   9.390  19.316   0.669
    9   HD21  LEU  26          HD21      LEU  26   9.533  15.571   0.441
   10   HD23  LEU  26          HD22      LEU  26  11.040  16.138   1.152
   11   HD22  LEU  26          HD23      LEU  26  11.013  15.573  -0.516

  No H/Q in entry =          11
  In of MODEL   45
    1    H    LYS  27           H        LYS  27  10.745  18.743  -3.831
    2    HA   LYS  27           HA       LYS  27  12.914  19.992  -2.584
    3    HB2  LYS  27           HB2      LYS  27  13.040  18.637  -4.668
    4    HB3  LYS  27           HB3      LYS  27  12.282  19.965  -5.546
    5    HG2  LYS  27           HG2      LYS  27  14.138  21.456  -4.955
    6    HG3  LYS  27           HG3      LYS  27  14.891  20.168  -4.005
    7    HD2  LYS  27           HD2      LYS  27  15.058  18.773  -6.052
    8    HD3  LYS  27           HD3      LYS  27  14.351  20.087  -6.993
    9    HE2  LYS  27           HE2      LYS  27  16.229  21.559  -6.366
   10    HE3  LYS  27           HE3      LYS  27  16.940  20.249  -5.416
   11    HZ3  LYS  27           HZ1      LYS  27  17.953  20.343  -7.592
   12    HZ2  LYS  27           HZ2      LYS  27  16.435  20.218  -8.349
   13    HZ1  LYS  27           HZ3      LYS  27  17.051  18.913  -7.453

  No H/Q in entry =          13
  In of MODEL   45
    1    H    GLN  28           H        GLN  28  10.309  21.362  -4.566
    2    HA   GLN  28           HA       GLN  28  11.265  24.015  -4.719
    3    HB2  GLN  28           HB2      GLN  28   8.433  22.940  -4.633
    4    HB3  GLN  28           HB3      GLN  28   8.847  24.611  -5.011
    5    HG2  GLN  28           HG2      GLN  28   9.862  22.194  -6.534
    6    HG3  GLN  28           HG3      GLN  28   8.533  23.226  -7.058
    7   HE21  GLN  28          HE21      GLN  28  11.701  22.731  -7.713
    8   HE22  GLN  28          HE22      GLN  28  12.182  24.313  -8.100

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ALA  29           H        ALA  29   9.311  22.328  -2.297
    2    HA   ALA  29           HA       ALA  29   8.739  24.526  -0.630
    3    HB2  ALA  29           HB1      ALA  29   7.997  22.961   0.937
    4    HB1  ALA  29           HB2      ALA  29   9.226  21.778   0.489
    5    HB3  ALA  29           HB3      ALA  29   7.850  22.065  -0.575

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LYS  30           H        LYS  30  11.475  22.264  -0.661
    2    HA   LYS  30           HA       LYS  30  12.766  23.231   1.652
    3    HB2  LYS  30           HB2      LYS  30  13.892  21.937  -0.842
    4    HB3  LYS  30           HB3      LYS  30  14.859  22.304   0.588
    5    HG2  LYS  30           HG2      LYS  30  13.294  20.923   1.957
    6    HG3  LYS  30           HG3      LYS  30  12.426  20.494   0.479
    7    HD2  LYS  30           HD2      LYS  30  14.483  19.508  -0.456
    8    HD3  LYS  30           HD3      LYS  30  15.371  19.952   1.003
    9    HE2  LYS  30           HE2      LYS  30  13.855  18.522   2.347
   10    HE3  LYS  30           HE3      LYS  30  12.998  18.059   0.872
   11    HZ2  LYS  30           HZ1      LYS  30  14.785  16.488   1.658
   12    HZ1  LYS  30           HZ2      LYS  30  15.924  17.676   1.214
   13    HZ3  LYS  30           HZ3      LYS  30  14.902  16.985   0.041

  No H/Q in entry =          13
  In of MODEL   45
    1    H    GLN  31           H        GLN  31  12.689  24.422  -1.651
    2    HA   GLN  31           HA       GLN  31  14.833  26.322  -1.214
    3    HB2  GLN  31           HB2      GLN  31  12.813  26.356  -3.460
    4    HB3  GLN  31           HB3      GLN  31  14.432  27.055  -3.447
    5    HG2  GLN  31           HG2      GLN  31  14.894  24.363  -2.856
    6    HG3  GLN  31           HG3      GLN  31  13.603  24.301  -4.048
    7   HE21  GLN  31          HE21      GLN  31  16.452  23.513  -4.419
    8   HE22  GLN  31          HE22      GLN  31  17.035  24.483  -5.683

  No H/Q in entry =           8
  In of MODEL   45
    1    H    GLY  32           H        GLY  32  11.747  26.137  -0.100
    2    HA3  GLY  32           HA2      GLY  32  10.574  27.707   1.155
    3    HA2  GLY  32           HA3      GLY  32  11.702  28.943   0.612

  No H/Q in entry =           3
  In of MODEL   45
    1    H    ASP  33           H        ASP  33  10.368  27.026  -1.888
    2    HA   ASP  33           HA       ASP  33   8.707  29.291  -2.769
    3    HB2  ASP  33           HB2      ASP  33   9.822  26.869  -4.191
    4    HB3  ASP  33           HB3      ASP  33   8.676  27.979  -4.937

  No H/Q in entry =           4
  In of MODEL   45
    1    H    PHE  34           H        PHE  34   7.004  28.817  -1.221
    2    HA   PHE  34           HA       PHE  34   5.630  26.342  -1.131
    3    HB2  PHE  34           HB2      PHE  34   4.655  29.129  -0.472
    4    HB3  PHE  34           HB3      PHE  34   3.805  27.638  -0.064
    5    HD1  PHE  34           HD1      PHE  34   6.036  30.047   1.165
    6    HD2  PHE  34           HD2      PHE  34   5.367  25.804   1.121
    7    HE1  PHE  34           HE1      PHE  34   7.406  29.808   3.217
    8    HE2  PHE  34           HE2      PHE  34   6.739  25.569   3.171
    9    HZ   PHE  34           HZ       PHE  34   7.753  27.572   4.218

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ALA  35           H        ALA  35   5.213  29.197  -3.157
    2    HA   ALA  35           HA       ALA  35   2.674  28.572  -4.207
    3    HB3  ALA  35           HB1      ALA  35   3.744  29.959  -6.238
    4    HB2  ALA  35           HB2      ALA  35   4.948  30.329  -5.003
    5    HB1  ALA  35           HB3      ALA  35   3.253  30.734  -4.732

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA  36           H        ALA  36   5.918  27.902  -5.524
    2    HA   ALA  36           HA       ALA  36   4.957  26.462  -7.773
    3    HB3  ALA  36           HB1      ALA  36   7.122  26.590  -8.366
    4    HB2  ALA  36           HB2      ALA  36   7.592  25.567  -7.007
    5    HB1  ALA  36           HB3      ALA  36   7.479  27.316  -6.799

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA  37           H        ALA  37   5.881  25.483  -4.504
    2    HA   ALA  37           HA       ALA  37   5.835  22.693  -4.923
    3    HB2  ALA  37           HB1      ALA  37   5.544  24.492  -2.554
    4    HB1  ALA  37           HB2      ALA  37   6.683  23.176  -2.830
    5    HB3  ALA  37           HB3      ALA  37   5.018  22.820  -2.375

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LYS  38           H        LYS  38   3.283  24.898  -3.790
    2    HA   LYS  38           HA       LYS  38   1.187  23.080  -3.582
    3    HB2  LYS  38           HB2      LYS  38   1.529  25.838  -3.338
    4    HB3  LYS  38           HB3      LYS  38   0.343  25.683  -4.629
    5    HG2  LYS  38           HG2      LYS  38  -1.118  24.361  -3.197
    6    HG3  LYS  38           HG3      LYS  38   0.113  24.309  -1.927
    7    HD2  LYS  38           HD2      LYS  38  -0.084  26.647  -1.491
    8    HD3  LYS  38           HD3      LYS  38  -0.981  26.928  -2.984
    9    HE2  LYS  38           HE2      LYS  38  -2.505  26.965  -1.060
   10    HE3  LYS  38           HE3      LYS  38  -2.864  25.584  -2.101
   11    HZ3  LYS  38           HZ1      LYS  38  -2.151  24.121  -0.555
   12    HZ2  LYS  38           HZ2      LYS  38  -2.516  25.382   0.526
   13    HZ1  LYS  38           HZ3      LYS  38  -0.915  25.133   0.018

  No H/Q in entry =          13
  In of MODEL   45
    1    H    ALA  39           H        ALA  39   2.191  24.975  -6.428
    2    HA   ALA  39           HA       ALA  39   0.136  24.095  -8.149
    3    HB2  ALA  39           HB1      ALA  39   2.881  24.747  -9.177
    4    HB1  ALA  39           HB2      ALA  39   1.903  26.008  -8.427
    5    HB3  ALA  39           HB3      ALA  39   1.308  25.164  -9.856

  No H/Q in entry =           5
  In of MODEL   45
    1    H    MET  40           H        MET  40   3.371  22.807  -7.531
    2    HA   MET  40           HA       MET  40   3.300  20.779  -9.515
    3    HB2  MET  40           HB2      MET  40   4.884  21.017  -6.951
    4    HB3  MET  40           HB3      MET  40   5.151  19.757  -8.158
    5    HG2  MET  40           HG2      MET  40   5.207  22.711  -8.834
    6    HG3  MET  40           HG3      MET  40   6.651  21.814  -8.366
    7    HE3  MET  40           HE1      MET  40   7.559  19.591 -11.157
    8    HE2  MET  40           HE2      MET  40   6.979  19.276  -9.524
    9    HE1  MET  40           HE3      MET  40   8.074  20.625  -9.818

  No H/Q in entry =           9
  In of MODEL   45
    1    H    MET  41           H        MET  41   2.349  20.832  -6.101
    2    HA   MET  41           HA       MET  41   1.822  18.067  -5.819
    3    HB2  MET  41           HB2      MET  41   0.468  20.426  -4.491
    4    HB3  MET  41           HB3      MET  41   0.312  18.749  -3.978
    5    HG2  MET  41           HG2      MET  41   3.022  18.980  -3.988
    6    HG3  MET  41           HG3      MET  41   2.572  20.639  -3.603
    7    HE2  MET  41           HE1      MET  41  -0.482  19.383  -1.905
    8    HE1  MET  41           HE2      MET  41   0.334  20.897  -2.279
    9    HE3  MET  41           HE3      MET  41   0.259  20.333  -0.610

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ASP  42           H        ASP  42  -0.215  20.781  -6.824
    2    HA   ASP  42           HA       ASP  42  -2.650  19.413  -6.981
    3    HB2  ASP  42           HB2      ASP  42  -1.948  21.984  -7.240
    4    HB3  ASP  42           HB3      ASP  42  -2.080  21.582  -8.949

  No H/Q in entry =           4
  In of MODEL   45
    1    H    GLN  43           H        GLN  43  -0.185  20.002  -9.460
    2    HA   GLN  43           HA       GLN  43  -1.545  18.670 -11.559
    3    HB2  GLN  43           HB2      GLN  43   1.407  19.197 -11.148
    4    HB3  GLN  43           HB3      GLN  43   0.711  18.549 -12.635
    5    HG2  GLN  43           HG2      GLN  43  -0.807  20.571 -12.700
    6    HG3  GLN  43           HG3      GLN  43   0.130  21.235 -11.365
    7   HE21  GLN  43          HE21      GLN  43   0.308  22.848 -13.456
    8   HE22  GLN  43          HE22      GLN  43   1.733  22.629 -14.347

  No H/Q in entry =           8
  In of MODEL   45
    1    H    SER  44           H        SER  44   0.784  17.547  -9.139
    2    HA   SER  44           HA       SER  44   1.138  14.937 -10.151
    3    HB2  SER  44           HB2      SER  44   2.005  16.388  -7.910
    4    HB3  SER  44           HB3      SER  44   1.140  15.004  -7.243
    5    HG   SER  44           HG       SER  44   3.257  14.390  -7.645

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ARG  45           H        ARG  45  -1.211  16.257  -7.842
    2    HA   ARG  45           HA       ARG  45  -2.596  13.893  -7.213
    3    HB2  ARG  45           HB2      ARG  45  -2.814  16.065  -6.031
    4    HB3  ARG  45           HB3      ARG  45  -3.658  16.724  -7.430
    5    HG2  ARG  45           HG2      ARG  45  -5.421  14.993  -7.159
    6    HG3  ARG  45           HG3      ARG  45  -4.589  14.389  -5.724
    7    HD2  ARG  45           HD2      ARG  45  -4.815  16.659  -4.679
    8    HD3  ARG  45           HD3      ARG  45  -5.789  17.170  -6.074
    9    HE   ARG  45           HE       ARG  45  -6.901  14.794  -5.037
   10   HH21  ARG  45          HH11      ARG  45  -8.751  14.868  -3.786
   11   HH22  ARG  45          HH12      ARG  45  -9.160  16.309  -2.926
   12   HH11  ARG  45          HH21      ARG  45  -6.379  18.047  -4.020
   13   HH12  ARG  45          HH22      ARG  45  -7.812  18.110  -3.057

  No H/Q in entry =          13
  In of MODEL   45
    1    H    MET  46           H        MET  46  -3.162  16.286  -9.779
    2    HA   MET  46           HA       MET  46  -5.485  15.100 -10.861
    3    HB2  MET  46           HB2      MET  46  -3.379  16.935 -12.013
    4    HB3  MET  46           HB3      MET  46  -4.741  16.363 -12.983
    5    HG2  MET  46           HG2      MET  46  -6.321  17.292 -11.364
    6    HG3  MET  46           HG3      MET  46  -4.997  17.798 -10.322
    7    HE1  MET  46           HE1      MET  46  -6.726  17.889 -13.547
    8    HE3  MET  46           HE2      MET  46  -5.273  18.250 -14.474
    9    HE2  MET  46           HE3      MET  46  -6.497  19.498 -14.244

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ALA  47           H        ALA  47  -2.047  14.632 -11.580
    2    HA   ALA  47           HA       ALA  47  -2.362  12.894 -13.787
    3    HB3  ALA  47           HB1      ALA  47  -0.191  13.794 -13.416
    4    HB2  ALA  47           HB2      ALA  47  -0.047  12.068 -13.074
    5    HB1  ALA  47           HB3      ALA  47  -0.158  13.224 -11.746

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU  48           H        LEU  48  -2.126  12.273 -10.308
    2    HA   LEU  48           HA       LEU  48  -2.207   9.432 -10.457
    3    HB2  LEU  48           HB2      LEU  48  -3.003  11.355  -8.259
    4    HB3  LEU  48           HB3      LEU  48  -2.904   9.606  -8.050
    5    HG   LEU  48           HG       LEU  48  -0.601  11.311  -9.030
    6   HD13  LEU  48          HD11      LEU  48  -0.911  12.089  -6.845
    7   HD12  LEU  48          HD12      LEU  48   0.256  10.787  -6.629
    8   HD11  LEU  48          HD13      LEU  48  -1.445  10.519  -6.248
    9   HD22  LEU  48          HD21      LEU  48  -0.087   9.125  -9.657
   10   HD21  LEU  48          HD22      LEU  48  -0.968   8.412  -8.307
   11   HD23  LEU  48          HD23      LEU  48   0.599   9.172  -8.033

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ASN  49           H        ASN  49  -4.685  11.916 -10.091
    2    HA   ASN  49           HA       ASN  49  -6.870  10.244  -9.568
    3    HB2  ASN  49           HB2      ASN  49  -6.925  12.675  -9.262
    4    HB3  ASN  49           HB3      ASN  49  -6.776  12.918 -10.998
    5   HD21  ASN  49          HD21      ASN  49  -8.983  13.981  -9.606
    6   HD22  ASN  49          HD22      ASN  49 -10.384  13.142 -10.063

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLU  50           H        GLU  50  -5.562  11.434 -12.647
    2    HA   GLU  50           HA       GLU  50  -7.493  10.164 -14.308
    3    HB2  GLU  50           HB2      GLU  50  -6.026  11.986 -15.114
    4    HB3  GLU  50           HB3      GLU  50  -4.630  10.921 -14.957
    5    HG2  GLU  50           HG2      GLU  50  -5.579   9.375 -16.598
    6    HG3  GLU  50           HG3      GLU  50  -7.043  10.346 -16.705

  No H/Q in entry =           6
  In of MODEL   45
    1    H    ALA  51           H        ALA  51  -4.332   9.190 -13.065
    2    HA   ALA  51           HA       ALA  51  -4.167   6.732 -14.472
    3    HB2  ALA  51           HB1      ALA  51  -2.197   6.457 -13.349
    4    HB1  ALA  51           HB2      ALA  51  -2.903   6.882 -11.791
    5    HB3  ALA  51           HB3      ALA  51  -2.441   8.151 -12.925

  No H/Q in entry =           5
  In of MODEL   45
    1    H    HIS  52           H        HIS  52  -5.378   7.572 -11.239
    2    HA   HIS  52           HA       HIS  52  -6.062   4.962 -10.405
    3    HB2  HIS  52           HB2      HIS  52  -5.948   6.911  -8.889
    4    HB3  HIS  52           HB3      HIS  52  -7.379   7.586  -9.666
    5    HD1  HIS  52           HD1      HIS  52  -9.604   6.054  -9.502
    6    HD2  HIS  52           HD2      HIS  52  -6.510   5.052  -6.896
    7    HE1  HIS  52           HE1      HIS  52 -10.625   4.585  -7.710
    8    HE2  HIS  52           HE2      HIS  52  -8.750   3.965  -6.112

  No H/Q in entry =           8
  In of MODEL   45
    1    H    LEU  53           H        LEU  53  -7.872   7.406 -12.222
    2    HA   LEU  53           HA       LEU  53 -10.372   6.104 -12.257
    3    HB2  LEU  53           HB2      LEU  53  -9.072   8.099 -14.094
    4    HB3  LEU  53           HB3      LEU  53 -10.645   7.406 -14.477
    5    HG   LEU  53           HG       LEU  53 -10.126   8.626 -11.760
    6   HD11  LEU  53          HD11      LEU  53 -10.818  10.020 -14.351
    7   HD13  LEU  53          HD12      LEU  53  -9.545  10.427 -13.199
    8   HD12  LEU  53          HD13      LEU  53 -11.233  10.704 -12.783
    9   HD22  LEU  53          HD21      LEU  53 -12.430   8.610 -11.521
   10   HD21  LEU  53          HD22      LEU  53 -12.265   7.246 -12.620
   11   HD23  LEU  53          HD23      LEU  53 -12.728   8.818 -13.241

  No H/Q in entry =          11
  In of MODEL   45
    1    H    VAL  54           H        VAL  54  -7.597   5.909 -14.463
    2    HA   VAL  54           HA       VAL  54  -8.793   4.126 -16.312
    3    HB   VAL  54           HB       VAL  54  -5.895   4.646 -15.600
    4   HG12  VAL  54          HG11      VAL  54  -5.617   3.552 -17.982
    5   HG11  VAL  54          HG12      VAL  54  -7.147   2.768 -17.592
    6   HG13  VAL  54          HG13      VAL  54  -5.742   2.522 -16.557
    7   HG22  VAL  54          HG21      VAL  54  -6.660   6.582 -16.661
    8   HG21  VAL  54          HG22      VAL  54  -7.839   5.711 -17.638
    9   HG23  VAL  54          HG23      VAL  54  -6.128   5.635 -18.050

  No H/Q in entry =           9
  In of MODEL   45
    1    H    GLN  55           H        GLN  55  -6.824   3.598 -13.389
    2    HA   GLN  55           HA       GLN  55  -6.722   0.781 -13.633
    3    HB2  GLN  55           HB2      GLN  55  -5.187   1.688 -12.100
    4    HB3  GLN  55           HB3      GLN  55  -6.415   2.653 -11.288
    5    HG2  GLN  55           HG2      GLN  55  -7.112   0.899  -9.971
    6    HG3  GLN  55           HG3      GLN  55  -6.870  -0.292 -11.242
    7   HE21  GLN  55          HE21      GLN  55  -5.247  -1.735 -10.724
    8   HE22  GLN  55          HE22      GLN  55  -3.874  -1.375  -9.798

  No H/Q in entry =           8
  In of MODEL   45
    1    H    THR  56           H        THR  56  -9.078   2.942 -12.053
    2    HA   THR  56           HA       THR  56 -10.670   1.059 -10.774
    3    HB   THR  56           HB       THR  56 -11.753   3.439 -12.301
    4    HG1  THR  56           HG1      THR  56 -11.134   3.677  -9.629
    5   HG22  THR  56          HG21      THR  56 -13.270   3.413 -10.202
    6   HG21  THR  56          HG22      THR  56 -12.680   1.766  -9.974
    7   HG23  THR  56          HG23      THR  56 -13.559   2.194 -11.442

  No H/Q in entry =           7
  In of MODEL   45
    1    H    LYS  57           H        LYS  57 -10.838   2.128 -14.166
    2    HA   LYS  57           HA       LYS  57 -12.980   0.431 -14.937
    3    HB2  LYS  57           HB2      LYS  57 -12.086   2.382 -16.248
    4    HB3  LYS  57           HB3      LYS  57 -10.651   1.432 -16.606
    5    HG2  LYS  57           HG2      LYS  57 -11.991  -0.224 -17.790
    6    HG3  LYS  57           HG3      LYS  57 -13.473   0.621 -17.359
    7    HD2  LYS  57           HD2      LYS  57 -12.707   2.600 -18.643
    8    HD3  LYS  57           HD3      LYS  57 -11.244   1.732 -19.100
    9    HE2  LYS  57           HE2      LYS  57 -14.068   0.812 -19.747
   10    HE3  LYS  57           HE3      LYS  57 -13.003   1.633 -20.888
   11    HZ3  LYS  57           HZ1      LYS  57 -12.849  -0.709 -21.225
   12    HZ2  LYS  57           HZ2      LYS  57 -12.530  -0.987 -19.579
   13    HZ1  LYS  57           HZ3      LYS  57 -11.388  -0.178 -20.546

  No H/Q in entry =          13
  In of MODEL   45
    1    H    LEU  58           H        LEU  58  -9.476   0.011 -14.839
    2    HA   LEU  58           HA       LEU  58  -9.461  -2.511 -16.117
    3    HB2  LEU  58           HB2      LEU  58  -7.452  -1.206 -14.291
    4    HB3  LEU  58           HB3      LEU  58  -7.176  -2.730 -15.136
    5    HG   LEU  58           HG       LEU  58  -7.923  -0.134 -16.519
    6   HD11  LEU  58          HD11      LEU  58  -5.281  -1.359 -15.793
    7   HD13  LEU  58          HD12      LEU  58  -5.781   0.330 -15.757
    8   HD12  LEU  58          HD13      LEU  58  -5.422  -0.446 -17.296
    9   HD22  LEU  58          HD21      LEU  58  -8.476  -1.704 -18.110
   10   HD21  LEU  58          HD22      LEU  58  -7.439  -2.945 -17.411
   11   HD23  LEU  58          HD23      LEU  58  -6.740  -1.674 -18.414

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  59           H        ILE  59 -10.322  -1.598 -12.879
    2    HA   ILE  59           HA       ILE  59  -9.973  -4.360 -11.916
    3    HB   ILE  59           HB       ILE  59  -9.556  -2.082 -10.523
    4   HG12  ILE  59          HG12      ILE  59 -10.921  -4.431  -9.195
    5   HG13  ILE  59          HG13      ILE  59  -9.277  -4.514  -9.777
    6   HG21  ILE  59          HG21      ILE  59 -12.099  -1.596 -10.804
    7   HG23  ILE  59          HG22      ILE  59 -11.395  -1.394  -9.216
    8   HG22  ILE  59          HG23      ILE  59 -12.323  -2.841  -9.598
    9   HD12  ILE  59          HD11      ILE  59 -10.328  -2.532  -7.771
   10   HD11  ILE  59          HD12      ILE  59  -8.677  -2.563  -8.376
   11   HD13  ILE  59          HD13      ILE  59  -9.286  -3.903  -7.405

  No H/Q in entry =          11
  In of MODEL   45
    1    H    GLU  60           H        GLU  60 -12.529  -2.057 -12.763
    2    HA   GLU  60           HA       GLU  60 -14.720  -3.576 -11.769
    3    HB2  GLU  60           HB2      GLU  60 -14.936  -1.208 -12.376
    4    HB3  GLU  60           HB3      GLU  60 -14.592  -1.593 -14.060
    5    HG2  GLU  60           HG2      GLU  60 -16.622  -3.010 -14.144
    6    HG3  GLU  60           HG3      GLU  60 -16.974  -2.593 -12.480

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLY  61           H        GLY  61 -13.012  -3.568 -14.864
    2    HA3  GLY  61           HA2      GLY  61 -14.706  -5.823 -15.764
    3    HA2  GLY  61           HA3      GLY  61 -13.853  -4.720 -16.837

  No H/Q in entry =           3
  In of MODEL   45
    1    H    ASP  62           H        ASP  62 -12.501  -6.144 -13.932
    2    HA   ASP  62           HA       ASP  62 -10.186  -7.069 -15.287
    3    HB2  ASP  62           HB2      ASP  62  -9.635  -8.069 -13.087
    4    HB3  ASP  62           HB3      ASP  62 -10.134  -6.388 -12.947

  No H/Q in entry =           4
  In of MODEL   45
    1    H    ALA  63           H        ALA  63 -13.189  -8.718 -14.309
    2    HA   ALA  63           HA       ALA  63 -12.492 -10.975 -16.051
    3    HB3  ALA  63           HB1      ALA  63 -12.543 -12.643 -14.403
    4    HB2  ALA  63           HB2      ALA  63 -13.413 -11.622 -13.259
    5    HB1  ALA  63           HB3      ALA  63 -11.697 -11.346 -13.562

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLY  64           H        GLY  64 -14.606 -12.459 -14.429
    2    HA3  GLY  64           HA2      GLY  64 -16.968 -12.342 -14.116
    3    HA2  GLY  64           HA3      GLY  64 -17.020 -10.979 -15.226

  No H/Q in entry =           3
  In of MODEL   45
    1    H    GLU  65           H        GLU  65 -15.050 -12.682 -16.942
    2    HA   GLU  65           HA       GLU  65 -17.003 -13.628 -18.744
    3    HB2  GLU  65           HB2      GLU  65 -14.035 -14.135 -18.586
    4    HB3  GLU  65           HB3      GLU  65 -15.051 -14.692 -19.916
    5    HG2  GLU  65           HG2      GLU  65 -15.741 -12.390 -20.389
    6    HG3  GLU  65           HG3      GLU  65 -14.790 -11.807 -19.024

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLY  66           H        GLY  66 -15.037 -15.254 -16.375
    2    HA3  GLY  66           HA2      GLY  66 -16.804 -17.562 -16.372
    3    HA2  GLY  66           HA3      GLY  66 -15.126 -17.874 -16.770

  No H/Q in entry =           3
  In of MODEL   45
    1    H    LYS  67           H        LYS  67 -13.566 -17.758 -15.191
    2    HA   LYS  67           HA       LYS  67 -14.551 -18.130 -12.486
    3    HB2  LYS  67           HB2      LYS  67 -12.267 -18.991 -12.058
    4    HB3  LYS  67           HB3      LYS  67 -13.070 -19.806 -13.406
    5    HG2  LYS  67           HG2      LYS  67 -11.922 -18.275 -14.991
    6    HG3  LYS  67           HG3      LYS  67 -11.081 -17.527 -13.635
    7    HD2  LYS  67           HD2      LYS  67 -10.009 -19.671 -13.093
    8    HD3  LYS  67           HD3      LYS  67 -10.876 -20.447 -14.420
    9    HE2  LYS  67           HE2      LYS  67  -9.786 -18.920 -16.030
   10    HE3  LYS  67           HE3      LYS  67  -8.915 -18.150 -14.704
   11    HZ2  LYS  67           HZ1      LYS  67  -8.527 -20.789 -15.900
   12    HZ1  LYS  67           HZ2      LYS  67  -8.235 -20.629 -14.235
   13    HZ3  LYS  67           HZ3      LYS  67  -7.378 -19.671 -15.345

  No H/Q in entry =          13
  In of MODEL   45
    1    H    MET  68           H        MET  68 -13.451 -17.329 -10.647
    2    HA   MET  68           HA       MET  68 -13.443 -14.599 -10.369
    3    HB2  MET  68           HB2      MET  68 -12.013 -16.714  -8.766
    4    HB3  MET  68           HB3      MET  68 -12.143 -15.030  -8.258
    5    HG2  MET  68           HG2      MET  68 -14.606 -15.191  -8.367
    6    HG3  MET  68           HG3      MET  68 -14.470 -16.880  -8.860
    7    HE3  MET  68           HE1      MET  68 -15.797 -16.437  -5.108
    8    HE2  MET  68           HE2      MET  68 -16.133 -17.429  -6.526
    9    HE1  MET  68           HE3      MET  68 -16.103 -15.674  -6.676

  No H/Q in entry =           9
  In of MODEL   45
    1    H    LYS  69           H        LYS  69 -11.078 -16.231 -12.114
    2    HA   LYS  69           HA       LYS  69  -8.718 -14.952 -11.307
    3    HB2  LYS  69           HB2      LYS  69  -8.790 -16.973 -12.704
    4    HB3  LYS  69           HB3      LYS  69  -9.392 -16.010 -14.055
    5    HG2  LYS  69           HG2      LYS  69  -7.359 -14.630 -14.003
    6    HG3  LYS  69           HG3      LYS  69  -6.761 -15.543 -12.620
    7    HD2  LYS  69           HD2      LYS  69  -6.748 -17.603 -13.990
    8    HD3  LYS  69           HD3      LYS  69  -7.313 -16.673 -15.379
    9    HE2  LYS  69           HE2      LYS  69  -5.294 -15.272 -15.283
   10    HE3  LYS  69           HE3      LYS  69  -4.730 -16.166 -13.873
   11    HZ1  LYS  69           HZ1      LYS  69  -5.276 -18.106 -15.695
   12    HZ3  LYS  69           HZ2      LYS  69  -3.735 -17.496 -15.329
   13    HZ2  LYS  69           HZ3      LYS  69  -4.608 -16.872 -16.646

  No H/Q in entry =          13
  In of MODEL   45
    1    H    VAL  70           H        VAL  70  -7.581 -13.149 -11.861
    2    HA   VAL  70           HA       VAL  70  -8.867 -11.210 -13.701
    3    HB   VAL  70           HB       VAL  70  -8.074  -9.428 -12.172
    4   HG12  VAL  70          HG11      VAL  70  -9.667 -10.058 -10.248
    5   HG11  VAL  70          HG12      VAL  70  -9.909 -11.579 -11.108
    6   HG13  VAL  70          HG13      VAL  70 -10.351 -10.054 -11.874
    7   HG21  VAL  70          HG21      VAL  70  -7.171 -11.815 -10.532
    8   HG23  VAL  70          HG22      VAL  70  -7.433 -10.227  -9.815
    9   HG22  VAL  70          HG23      VAL  70  -6.202 -10.438 -11.059

  No H/Q in entry =           9
  In of MODEL   45
    1    H    SER  71           H        SER  71  -7.309  -9.551 -14.477
    2    HA   SER  71           HA       SER  71  -5.046 -10.702 -15.713
    3    HB2  SER  71           HB2      SER  71  -6.239  -8.679 -16.557
    4    HB3  SER  71           HB3      SER  71  -5.600  -7.770 -15.190
    5    HG   SER  71           HG       SER  71  -4.128  -9.096 -17.228

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU  72           H        LEU  72  -3.027 -10.968 -15.051
    2    HA   LEU  72           HA       LEU  72  -2.338 -10.739 -12.333
    3    HB2  LEU  72           HB2      LEU  72  -0.651 -11.171 -14.793
    4    HB3  LEU  72           HB3      LEU  72  -0.013 -11.242 -13.153
    5    HG   LEU  72           HG       LEU  72  -2.346 -12.939 -14.100
    6   HD11  LEU  72          HD11      LEU  72   0.601 -13.633 -13.896
    7   HD13  LEU  72          HD12      LEU  72  -0.332 -13.507 -15.387
    8   HD12  LEU  72          HD13      LEU  72  -0.694 -14.785 -14.226
    9   HD23  LEU  72          HD21      LEU  72  -1.404 -14.339 -12.098
   10   HD22  LEU  72          HD22      LEU  72  -2.392 -12.934 -11.729
   11   HD21  LEU  72          HD23      LEU  72  -0.638 -12.831 -11.612

  No H/Q in entry =          11
  In of MODEL   45
    1    H    VAL  73           H        VAL  73  -1.595  -8.734 -15.114
    2    HA   VAL  73           HA       VAL  73   0.308  -7.025 -13.997
    3    HB   VAL  73           HB       VAL  73  -0.061  -5.622 -15.866
    4   HG12  VAL  73          HG11      VAL  73  -0.980  -8.261 -16.966
    5   HG11  VAL  73          HG12      VAL  73   0.600  -8.144 -16.195
    6   HG13  VAL  73          HG13      VAL  73   0.232  -7.151 -17.604
    7   HG23  VAL  73          HG21      VAL  73  -2.215  -6.184 -17.282
    8   HG22  VAL  73          HG22      VAL  73  -2.329  -5.090 -15.904
    9   HG21  VAL  73          HG23      VAL  73  -2.831  -6.773 -15.736

  No H/Q in entry =           9
  In of MODEL   45
    1    H    LEU  74           H        LEU  74  -3.095  -7.146 -13.478
    2    HA   LEU  74           HA       LEU  74  -3.727  -4.489 -12.885
    3    HB2  LEU  74           HB2      LEU  74  -5.457  -6.142 -13.068
    4    HB3  LEU  74           HB3      LEU  74  -4.772  -7.082 -11.746
    5    HG   LEU  74           HG       LEU  74  -5.236  -5.222 -10.182
    6   HD11  LEU  74          HD11      LEU  74  -6.244  -3.935 -12.722
    7   HD13  LEU  74          HD12      LEU  74  -5.123  -3.272 -11.533
    8   HD12  LEU  74          HD13      LEU  74  -6.836  -3.432 -11.138
    9   HD21  LEU  74          HD21      LEU  74  -6.925  -7.063 -11.017
   10   HD23  LEU  74          HD22      LEU  74  -7.752  -5.667 -11.676
   11   HD22  LEU  74          HD23      LEU  74  -7.465  -5.765  -9.955

  No H/Q in entry =          11
  In of MODEL   45
    1    H    VAL  75           H        VAL  75  -2.705  -7.063 -10.699
    2    HA   VAL  75           HA       VAL  75  -2.537  -5.500  -8.361
    3    HB   VAL  75           HB       VAL  75  -1.037  -8.000  -9.127
    4   HG11  VAL  75          HG11      VAL  75  -1.236  -6.504  -6.474
    5   HG13  VAL  75          HG12      VAL  75   0.224  -6.785  -7.413
    6   HG12  VAL  75          HG13      VAL  75  -0.599  -8.136  -6.651
    7   HG23  VAL  75          HG21      VAL  75  -3.302  -7.613  -7.156
    8   HG22  VAL  75          HG22      VAL  75  -2.728  -9.120  -7.870
    9   HG21  VAL  75          HG23      VAL  75  -3.609  -7.954  -8.859

  No H/Q in entry =           9
  In of MODEL   45
    1    H    GLU  76           H        GLU  76  -0.097  -6.267 -10.865
    2    HA   GLU  76           HA       GLU  76   2.072  -4.909  -9.689
    3    HB2  GLU  76           HB2      GLU  76   2.239  -6.408 -11.689
    4    HB3  GLU  76           HB3      GLU  76   1.427  -5.180 -12.647
    5    HG2  GLU  76           HG2      GLU  76   3.269  -3.599 -12.222
    6    HG3  GLU  76           HG3      GLU  76   4.098  -4.790 -11.239

  No H/Q in entry =           6
  In of MODEL   45
    1    H    ALA  77           H        ALA  77  -0.437  -3.724 -11.913
    2    HA   ALA  77           HA       ALA  77   0.548  -1.076 -12.090
    3    HB1  ALA  77           HB1      ALA  77  -1.131  -2.050 -13.643
    4    HB2  ALA  77           HB2      ALA  77  -1.660  -0.512 -12.961
    5    HB3  ALA  77           HB3      ALA  77  -2.319  -2.025 -12.339

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLN  78           H        GLN  78  -1.742  -2.627  -9.898
    2    HA   GLN  78           HA       GLN  78  -2.571  -0.304  -8.517
    3    HB2  GLN  78           HB2      GLN  78  -3.674  -2.568  -8.436
    4    HB3  GLN  78           HB3      GLN  78  -2.349  -3.117  -7.411
    5    HG2  GLN  78           HG2      GLN  78  -2.895  -1.382  -5.760
    6    HG3  GLN  78           HG3      GLN  78  -4.211  -0.809  -6.785
    7   HE21  GLN  78          HE21      GLN  78  -4.743  -1.770  -4.145
    8   HE22  GLN  78          HE22      GLN  78  -5.607  -3.227  -4.269

  No H/Q in entry =           8
  In of MODEL   45
    1    H    LEU  79           H        LEU  79   0.108  -2.550  -8.025
    2    HA   LEU  79           HA       LEU  79   1.053  -1.639  -5.561
    3    HB2  LEU  79           HB2      LEU  79   1.941  -3.650  -6.609
    4    HB3  LEU  79           HB3      LEU  79   2.600  -2.702  -7.939
    5    HG   LEU  79           HG       LEU  79   4.135  -1.551  -6.422
    6   HD13  LEU  79          HD11      LEU  79   3.105  -1.299  -4.368
    7   HD12  LEU  79          HD12      LEU  79   4.184  -2.644  -4.005
    8   HD11  LEU  79          HD13      LEU  79   2.483  -2.950  -4.354
    9   HD23  LEU  79          HD21      LEU  79   5.341  -3.691  -5.495
   10   HD22  LEU  79          HD22      LEU  79   5.158  -3.501  -7.236
   11   HD21  LEU  79          HD23      LEU  79   4.073  -4.570  -6.351

  No H/Q in entry =          11
  In of MODEL   45
    1    H    HIS  80           H        HIS  80   1.958  -0.534  -8.828
    2    HA   HIS  80           HA       HIS  80   3.748   1.464  -7.894
    3    HB2  HIS  80           HB2      HIS  80   2.491   0.753 -10.489
    4    HB3  HIS  80           HB3      HIS  80   3.078   2.408 -10.319
    5    HD1  HIS  80           HD1      HIS  80   5.485   2.715 -10.814
    6    HD2  HIS  80           HD2      HIS  80   4.665  -1.194  -9.614
    7    HE1  HIS  80           HE1      HIS  80   7.681   1.445 -10.948
    8    HE2  HIS  80           HE2      HIS  80   7.193  -0.940 -10.219

  No H/Q in entry =           8
  In of MODEL   45
    1    H    LEU  81           H        LEU  81   0.355   1.606  -8.915
    2    HA   LEU  81           HA       LEU  81   0.065   4.399  -8.601
    3    HB2  LEU  81           HB2      LEU  81  -1.941   2.146  -8.535
    4    HB3  LEU  81           HB3      LEU  81  -2.402   3.847  -8.456
    5    HG   LEU  81           HG       LEU  81  -0.677   2.694 -10.667
    6   HD12  LEU  81          HD11      LEU  81  -2.895   2.998 -11.994
    7   HD11  LEU  81          HD12      LEU  81  -3.670   2.934 -10.411
    8   HD13  LEU  81          HD13      LEU  81  -2.714   1.568 -10.980
    9   HD23  LEU  81          HD21      LEU  81  -1.770   4.829 -11.787
   10   HD22  LEU  81          HD22      LEU  81  -0.367   5.010 -10.738
   11   HD21  LEU  81          HD23      LEU  81  -1.981   5.355 -10.118

  No H/Q in entry =          11
  In of MODEL   45
    1    H    MET  82           H        MET  82  -0.610   1.720  -6.347
    2    HA   MET  82           HA       MET  82  -1.694   3.311  -4.280
    3    HB2  MET  82           HB2      MET  82  -0.308   0.630  -4.291
    4    HB3  MET  82           HB3      MET  82  -0.907   1.359  -2.803
    5    HG2  MET  82           HG2      MET  82  -2.608   0.847  -5.263
    6    HG3  MET  82           HG3      MET  82  -2.542  -0.220  -3.862
    7    HE3  MET  82           HE1      MET  82  -4.306   1.434  -1.075
    8    HE2  MET  82           HE2      MET  82  -2.575   1.719  -1.240
    9    HE1  MET  82           HE3      MET  82  -3.250   0.156  -1.695

  No H/Q in entry =           9
  In of MODEL   45
    1    H    THR  83           H        THR  83   1.620   2.238  -4.925
    2    HA   THR  83           HA       THR  83   2.805   3.358  -2.615
    3    HB   THR  83           HB       THR  83   4.917   3.306  -4.064
    4    HG1  THR  83           HG1      THR  83   4.704   2.769  -6.088
    5   HG22  THR  83          HG21      THR  83   4.490   0.644  -4.389
    6   HG21  THR  83          HG22      THR  83   3.185   1.023  -3.266
    7   HG23  THR  83          HG23      THR  83   4.857   1.376  -2.828

  No H/Q in entry =           7
  In of MODEL   45
    1    H    SER  84           H        SER  84   2.468   4.621  -5.926
    2    HA   SER  84           HA       SER  84   3.790   7.069  -5.466
    3    HB2  SER  84           HB2      SER  84   1.748   6.218  -7.506
    4    HB3  SER  84           HB3      SER  84   2.418   7.848  -7.480
    5    HG   SER  84           HG       SER  84   3.806   5.379  -7.743

  No H/Q in entry =           5
  In of MODEL   45
    1    H    MET  85           H        MET  85   0.298   6.297  -5.332
    2    HA   MET  85           HA       MET  85  -0.583   8.906  -4.754
    3    HB2  MET  85           HB2      MET  85  -2.092   7.093  -5.433
    4    HB3  MET  85           HB3      MET  85  -1.813   6.286  -3.890
    5    HG2  MET  85           HG2      MET  85  -2.740   8.215  -2.687
    6    HG3  MET  85           HG3      MET  85  -2.960   9.074  -4.209
    7    HE2  MET  85           HE1      MET  85  -5.187   5.602  -2.399
    8    HE1  MET  85           HE2      MET  85  -3.498   6.068  -2.202
    9    HE3  MET  85           HE3      MET  85  -3.965   5.024  -3.540

  No H/Q in entry =           9
  In of MODEL   45
    1    H    LEU  86           H        LEU  86   0.323   6.257  -2.587
    2    HA   LEU  86           HA       LEU  86  -0.245   7.569  -0.157
    3    HB2  LEU  86           HB2      LEU  86   0.234   5.098  -0.535
    4    HB3  LEU  86           HB3      LEU  86   1.940   5.534  -0.611
    5    HG   LEU  86           HG       LEU  86   1.583   6.704   1.648
    6   HD11  LEU  86          HD11      LEU  86  -1.102   5.925   1.148
    7   HD13  LEU  86          HD12      LEU  86  -0.456   6.681   2.603
    8   HD12  LEU  86          HD13      LEU  86  -0.539   4.924   2.490
    9   HD23  LEU  86          HD21      LEU  86   1.165   3.710   1.778
   10   HD22  LEU  86          HD22      LEU  86   2.151   4.728   2.825
   11   HD21  LEU  86          HD23      LEU  86   2.673   4.398   1.174

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ALA  87           H        ALA  87   2.759   7.277  -2.010
    2    HA   ALA  87           HA       ALA  87   4.439   8.701  -0.271
    3    HB3  ALA  87           HB1      ALA  87   4.570   7.677  -2.972
    4    HB2  ALA  87           HB2      ALA  87   5.890   8.017  -1.857
    5    HB1  ALA  87           HB3      ALA  87   5.284   9.291  -2.914

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ARG  88           H        ARG  88   2.521   9.819  -3.019
    2    HA   ARG  88           HA       ARG  88   3.285  12.511  -2.904
    3    HB2  ARG  88           HB2      ARG  88   2.057  11.347  -4.771
    4    HB3  ARG  88           HB3      ARG  88   0.588  11.490  -3.806
    5    HG2  ARG  88           HG2      ARG  88   1.598  14.074  -3.722
    6    HG3  ARG  88           HG3      ARG  88   2.043  13.554  -5.345
    7    HD2  ARG  88           HD2      ARG  88  -0.090  13.625  -6.068
    8    HD3  ARG  88           HD3      ARG  88  -0.691  12.776  -4.644
    9    HE   ARG  88           HE       ARG  88  -0.883  15.552  -5.075
   10   HH21  ARG  88          HH11      ARG  88  -1.434  16.887  -3.350
   11   HH22  ARG  88          HH12      ARG  88  -1.156  16.358  -1.726
   12   HH11  ARG  88          HH21      ARG  88   0.110  13.302  -2.680
   13   HH12  ARG  88          HH22      ARG  88  -0.299  14.322  -1.348

  No H/Q in entry =          13
  In of MODEL   45
    1    H    GLU  89           H        GLU  89   0.567  10.837  -1.289
    2    HA   GLU  89           HA       GLU  89  -0.560  13.151  -0.107
    3    HB2  GLU  89           HB2      GLU  89  -1.672  10.909  -0.198
    4    HB3  GLU  89           HB3      GLU  89  -0.561  10.361   1.059
    5    HG2  GLU  89           HG2      GLU  89  -1.403  12.064   2.601
    6    HG3  GLU  89           HG3      GLU  89  -2.442  12.727   1.343

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LEU  90           H        LEU  90   1.882  10.869   1.105
    2    HA   LEU  90           HA       LEU  90   2.206  12.124   3.633
    3    HB2  LEU  90           HB2      LEU  90   4.002  10.347   1.984
    4    HB3  LEU  90           HB3      LEU  90   4.401  10.871   3.626
    5    HG   LEU  90           HG       LEU  90   1.777   9.518   2.939
    6   HD12  LEU  90          HD11      LEU  90   2.909   7.478   3.969
    7   HD11  LEU  90          HD12      LEU  90   4.432   8.336   3.741
    8   HD13  LEU  90          HD13      LEU  90   3.437   7.921   2.345
    9   HD22  LEU  90          HD21      LEU  90   1.486  10.449   5.054
   10   HD21  LEU  90          HD22      LEU  90   3.199  10.346   5.457
   11   HD23  LEU  90          HD23      LEU  90   2.195   8.898   5.499

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  91           H        ILE  91   3.845  12.497   0.524
    2    HA   ILE  91           HA       ILE  91   5.809  14.335   1.379
    3    HB   ILE  91           HB       ILE  91   4.530  13.832  -1.314
    4   HG12  ILE  91          HG12      ILE  91   7.351  13.352  -0.305
    5   HG13  ILE  91          HG13      ILE  91   6.069  12.154  -0.153
    6   HG22  ILE  91          HG21      ILE  91   6.759  15.179  -1.982
    7   HG21  ILE  91          HG22      ILE  91   6.430  15.985  -0.448
    8   HG23  ILE  91          HG23      ILE  91   5.221  16.007  -1.731
    9   HD13  ILE  91          HD11      ILE  91   5.923  11.821  -2.460
   10   HD12  ILE  91          HD12      ILE  91   7.655  12.067  -2.228
   11   HD11  ILE  91          HD13      ILE  91   6.650  13.386  -2.831

  No H/Q in entry =          11
  In of MODEL   45
    1    H    THR  92           H        THR  92   2.459  14.759   0.330
    2    HA   THR  92           HA       THR  92   2.430  17.582   0.258
    3    HB   THR  92           HB       THR  92   0.257  15.587   0.940
    4    HG1  THR  92           HG1      THR  92   0.586  15.401  -1.140
    5   HG22  THR  92          HG21      THR  92  -1.138  17.745   0.194
    6   HG21  THR  92          HG22      THR  92   0.245  18.574   0.904
    7   HG23  THR  92          HG23      THR  92  -0.706  17.456   1.879

  No H/Q in entry =           7
  In of MODEL   45
    1    H    GLU  93           H        GLU  93   1.853  15.291   2.915
    2    HA   GLU  93           HA       GLU  93   1.296  17.203   4.920
    3    HB2  GLU  93           HB2      GLU  93   2.609  14.480   5.181
    4    HB3  GLU  93           HB3      GLU  93   1.902  15.412   6.503
    5    HG2  GLU  93           HG2      GLU  93   0.319  14.623   4.048
    6    HG3  GLU  93           HG3      GLU  93   0.405  13.606   5.482

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LEU  94           H        LEU  94   4.317  15.719   3.811
    2    HA   LEU  94           HA       LEU  94   6.045  16.876   5.714
    3    HB2  LEU  94           HB2      LEU  94   6.480  15.898   2.892
    4    HB3  LEU  94           HB3      LEU  94   7.798  16.561   3.854
    5    HG   LEU  94           HG       LEU  94   6.047  14.368   4.978
    6   HD11  LEU  94          HD11      LEU  94   8.167  14.135   2.872
    7   HD13  LEU  94          HD12      LEU  94   6.719  13.161   3.120
    8   HD12  LEU  94          HD13      LEU  94   8.133  12.914   4.145
    9   HD23  LEU  94          HD21      LEU  94   8.224  13.838   6.158
   10   HD22  LEU  94          HD22      LEU  94   7.551  15.417   6.560
   11   HD21  LEU  94          HD23      LEU  94   8.903  15.293   5.434

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  95           H        ILE  95   4.941  18.034   2.547
    2    HA   ILE  95           HA       ILE  95   6.511  20.393   2.496
    3    HB   ILE  95           HB       ILE  95   3.883  19.701   1.163
    4   HG12  ILE  95          HG12      ILE  95   6.685  20.037   0.057
    5   HG13  ILE  95          HG13      ILE  95   6.031  18.485   0.570
    6   HG21  ILE  95          HG21      ILE  95   5.633  22.169   0.953
    7   HG23  ILE  95          HG22      ILE  95   3.904  22.101   1.290
    8   HG22  ILE  95          HG23      ILE  95   4.506  21.695  -0.318
    9   HD13  ILE  95          HD11      ILE  95   4.491  18.401  -1.176
   10   HD12  ILE  95          HD12      ILE  95   5.849  19.217  -1.952
   11   HD11  ILE  95          HD13      ILE  95   4.468  20.153  -1.379

  No H/Q in entry =          11
  In of MODEL   45
    1    H    GLU  96           H        GLU  96   3.248  19.743   3.756
    2    HA   GLU  96           HA       GLU  96   2.617  22.392   4.490
    3    HB2  GLU  96           HB2      GLU  96   0.944  20.608   4.489
    4    HB3  GLU  96           HB3      GLU  96   1.791  19.786   5.797
    5    HG2  GLU  96           HG2      GLU  96   0.752  21.075   7.350
    6    HG3  GLU  96           HG3      GLU  96   1.295  22.546   6.553

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LEU  97           H        LEU  97   4.443  19.849   6.146
    2    HA   LEU  97           HA       LEU  97   4.770  21.208   8.616
    3    HB2  LEU  97           HB2      LEU  97   6.325  19.034   7.228
    4    HB3  LEU  97           HB3      LEU  97   6.897  19.726   8.744
    5    HG   LEU  97           HG       LEU  97   4.092  18.629   8.405
    6   HD12  LEU  97          HD11      LEU  97   5.019  16.622   9.636
    7   HD11  LEU  97          HD12      LEU  97   6.634  17.253   9.309
    8   HD13  LEU  97          HD13      LEU  97   5.580  16.789   7.972
    9   HD23  LEU  97          HD21      LEU  97   4.515  18.345  10.976
   10   HD22  LEU  97          HD22      LEU  97   4.141  19.954  10.360
   11   HD21  LEU  97          HD23      LEU  97   5.809  19.517  10.726

  No H/Q in entry =          11
  In of MODEL   45
    1    H    HIS  98           H        HIS  98   6.676  21.213   5.612
    2    HA   HIS  98           HA       HIS  98   8.819  22.797   6.530
    3    HB2  HIS  98           HB2      HIS  98   7.557  22.530   3.790
    4    HB3  HIS  98           HB3      HIS  98   8.994  23.511   4.094
    5    HD1  HIS  98           HD1      HIS  98   7.783  19.940   4.113
    6    HD2  HIS  98           HD2      HIS  98  11.359  22.039   4.572
    7    HE1  HIS  98           HE1      HIS  98   9.639  18.210   4.085
    8    HE2  HIS  98           HE2      HIS  98  11.820  19.468   4.364

  No H/Q in entry =           8
  In of MODEL   45
    1    H    GLU  99           H        GLU  99   5.611  23.626   5.314
    2    HA   GLU  99           HA       GLU  99   5.991  26.441   5.249
    3    HB2  GLU  99           HB2      GLU  99   4.125  25.267   4.101
    4    HB3  GLU  99           HB3      GLU  99   3.411  24.912   5.674
    5    HG2  GLU  99           HG2      GLU  99   3.224  27.305   6.163
    6    HG3  GLU  99           HG3      GLU  99   4.018  27.699   4.642

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LYS 100           H        LYS 100   4.831  24.215   7.767
    2    HA   LYS 100           HA       LYS 100   4.222  26.277   9.646
    3    HB2  LYS 100           HB2      LYS 100   4.793  23.327  10.009
    4    HB3  LYS 100           HB3      LYS 100   4.331  24.405  11.332
    5    HG2  LYS 100           HG2      LYS 100   2.279  25.037  10.058
    6    HG3  LYS 100           HG3      LYS 100   2.721  23.864   8.815
    7    HD2  LYS 100           HD2      LYS 100   2.624  22.049  10.482
    8    HD3  LYS 100           HD3      LYS 100   2.199  23.217  11.736
    9    HE2  LYS 100           HE2      LYS 100   0.161  23.833  10.447
   10    HE3  LYS 100           HE3      LYS 100   0.575  22.609   9.241
   11    HZ1  LYS 100           HZ1      LYS 100   0.276  21.953  12.121
   12    HZ3  LYS 100           HZ2      LYS 100   0.276  20.894  10.790
   13    HZ2  LYS 100           HZ3      LYS 100  -1.043  21.935  11.050

  No H/Q in entry =          13
  In of MODEL   45
    1    H    LEU 101           H        LEU 101   7.155  24.478   8.853
    2    HA   LEU 101           HA       LEU 101   8.728  25.326  11.072
    3    HB2  LEU 101           HB2      LEU 101   9.355  24.328   8.305
    4    HB3  LEU 101           HB3      LEU 101  10.645  24.997   9.299
    5    HG   LEU 101           HG       LEU 101   8.800  22.845  10.349
    6   HD12  LEU 101          HD11      LEU 101  10.861  21.347   9.771
    7   HD11  LEU 101          HD12      LEU 101  11.242  22.606   8.598
    8   HD13  LEU 101          HD13      LEU 101   9.714  21.733   8.489
    9   HD21  LEU 101          HD21      LEU 101  11.516  23.956  11.104
   10   HD23  LEU 101          HD22      LEU 101  10.966  22.385  11.684
   11   HD22  LEU 101          HD23      LEU 101  10.069  23.844  12.106

  No H/Q in entry =          11
  In of MODEL   45
    1    H    LYS 102           H        LYS 102   7.170  27.182   8.905
    2    HA   LYS 102           HA       LYS 102   7.252  29.473   8.606
    3    HB2  LYS 102           HB2      LYS 102   8.792  29.366  10.723
    4    HB3  LYS 102           HB3      LYS 102  10.105  29.555   9.578
    5    HG2  LYS 102           HG2      LYS 102   7.991  31.512  10.407
    6    HG3  LYS 102           HG3      LYS 102   9.706  31.770  10.175
    7    HD2  LYS 102           HD2      LYS 102   7.782  31.339   7.854
    8    HD3  LYS 102           HD3      LYS 102   8.158  32.921   8.521
    9    HE2  LYS 102           HE2      LYS 102   9.554  31.728   6.468
   10    HE3  LYS 102           HE3      LYS 102  10.160  33.038   7.481
   11    HZ2  LYS 102           HZ1      LYS 102  11.681  31.132   7.331
   12    HZ1  LYS 102           HZ2      LYS 102  10.510  30.153   8.064
   13    HZ3  LYS 102           HZ3      LYS 102  11.193  31.443   8.926

  No H/Q in entry =          13
  In of MODEL   45
    1    H    ALA 103           H        ALA 103  10.515  28.130   8.084
    2    HA   ALA 103           HA       ALA 103  11.504  29.499   6.015
    3    HB2  ALA 103           HB1      ALA 103  12.398  27.280   5.106
    4    HB1  ALA 103           HB2      ALA 103  11.488  26.512   6.404
    5    HB3  ALA 103           HB3      ALA 103  12.773  27.657   6.788

  No H/Q in entry =           5
  In of MODEL   45
    1    H1   LYS   3           H1       LYS   3 -31.567   6.209 -19.640
    2    H2   LYS   3           H3       LYS   3 -30.603   5.917 -21.007
    3    H3   LYS   3           H2       LYS   3 -31.993   4.982 -20.733
    4    HA   LYS   3           HA       LYS   3 -30.965   3.596 -19.344
    5    HB2  LYS   3           HB2      LYS   3 -28.708   5.006 -20.720
    6    HB3  LYS   3           HB3      LYS   3 -28.361   3.801 -19.480
    7    HG2  LYS   3           HG2      LYS   3 -29.806   2.211 -20.801
    8    HG3  LYS   3           HG3      LYS   3 -29.785   3.408 -22.095
    9    HD2  LYS   3           HD2      LYS   3 -27.301   3.295 -22.089
   10    HD3  LYS   3           HD3      LYS   3 -27.398   2.000 -20.897
   11    HE2  LYS   3           HE2      LYS   3 -28.927   0.820 -22.584
   12    HE3  LYS   3           HE3      LYS   3 -28.328   1.995 -23.753
   13    HZ3  LYS   3           HZ1      LYS   3 -26.535   0.766 -24.053
   14    HZ2  LYS   3           HZ2      LYS   3 -27.146  -0.400 -22.979
   15    HZ1  LYS   3           HZ3      LYS   3 -26.146   0.846 -22.401

  No H/Q in entry =          15
  In of MODEL   45
    1    H    LYS   4           H        LYS   4 -30.980   3.459 -17.281
    2    HA   LYS   4           HA       LYS   4 -30.220   5.749 -15.650
    3    HB2  LYS   4           HB2      LYS   4 -31.410   3.059 -14.923
    4    HB3  LYS   4           HB3      LYS   4 -31.168   4.400 -13.804
    5    HG2  LYS   4           HG2      LYS   4 -33.019   4.333 -16.192
    6    HG3  LYS   4           HG3      LYS   4 -33.478   4.388 -14.491
    7    HD2  LYS   4           HD2      LYS   4 -32.777   6.610 -14.243
    8    HD3  LYS   4           HD3      LYS   4 -31.763   6.547 -15.684
    9    HE2  LYS   4           HE2      LYS   4 -33.695   7.922 -16.116
   10    HE3  LYS   4           HE3      LYS   4 -33.794   6.448 -17.078
   11    HZ3  LYS   4           HZ1      LYS   4 -35.343   5.540 -15.501
   12    HZ2  LYS   4           HZ2      LYS   4 -35.906   7.035 -16.078
   13    HZ1  LYS   4           HZ3      LYS   4 -35.222   6.927 -14.528

  No H/Q in entry =          13
  In of MODEL   45
    1    H    HIS   5           H        HIS   5 -28.723   5.836 -14.086
    2    HA   HIS   5           HA       HIS   5 -26.450   4.003 -14.454
    3    HB2  HIS   5           HB2      HIS   5 -26.677   6.761 -13.250
    4    HB3  HIS   5           HB3      HIS   5 -25.197   5.805 -13.258
    5    HD1  HIS   5           HD1      HIS   5 -23.754   6.998 -14.876
    6    HD2  HIS   5           HD2      HIS   5 -27.584   6.380 -16.360
    7    HE1  HIS   5           HE1      HIS   5 -23.630   7.572 -17.331
    8    HE2  HIS   5           HE2      HIS   5 -25.964   7.183 -18.204

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ILE   6           H        ILE   6 -26.200   2.433 -13.138
    2    HA   ILE   6           HA       ILE   6 -27.124   2.710 -10.358
    3    HB   ILE   6           HB       ILE   6 -26.333   0.238 -11.904
    4   HG12  ILE   6          HG12      ILE   6 -29.059   1.183 -11.004
    5   HG13  ILE   6          HG13      ILE   6 -28.445   1.339 -12.651
    6   HG23  ILE   6          HG21      ILE   6 -26.675  -1.010 -10.033
    7   HG22  ILE   6          HG22      ILE   6 -27.818   0.141  -9.336
    8   HG21  ILE   6          HG23      ILE   6 -26.087   0.472  -9.279
    9   HD13  ILE   6          HD11      ILE   6 -28.919  -0.780 -13.138
   10   HD12  ILE   6          HD12      ILE   6 -29.908  -0.757 -11.677
   11   HD11  ILE   6          HD13      ILE   6 -28.255  -1.369 -11.613

  No H/Q in entry =          11
  In of MODEL   45
    1    H    TYR   7           H        TYR   7 -25.341   3.349  -9.104
    2    HA   TYR   7           HA       TYR   7 -22.645   2.383  -9.830
    3    HB2  TYR   7           HB2      TYR   7 -23.574   4.823  -8.339
    4    HB3  TYR   7           HB3      TYR   7 -21.892   4.304  -8.406
    5    HD1  TYR   7           HD1      TYR   7 -22.991   3.357 -11.474
    6    HD2  TYR   7           HD2      TYR   7 -22.270   6.932  -9.270
    7    HE1  TYR   7           HE1      TYR   7 -22.593   4.579 -13.576
    8    HE2  TYR   7           HE2      TYR   7 -21.914   8.161 -11.362
    9    HH   TYR   7           HH       TYR   7 -22.173   8.070 -13.590

  No H/Q in entry =           9
  In of MODEL   45
    1    H    LEU   8           H        LEU   8 -21.660   1.031  -8.516
    2    HA   LEU   8           HA       LEU   8 -22.742   0.547  -5.811
    3    HB2  LEU   8           HB2      LEU   8 -21.078  -1.126  -7.671
    4    HB3  LEU   8           HB3      LEU   8 -21.234  -1.504  -5.956
    5    HG   LEU   8           HG       LEU   8 -23.722  -1.669  -6.333
    6   HD13  LEU   8          HD11      LEU   8 -23.887  -0.458  -8.443
    7   HD12  LEU   8          HD12      LEU   8 -24.426  -2.121  -8.669
    8   HD11  LEU   8          HD13      LEU   8 -22.826  -1.629  -9.224
    9   HD23  LEU   8          HD21      LEU   8 -22.485  -3.718  -8.044
   10   HD22  LEU   8          HD22      LEU   8 -23.548  -3.880  -6.646
   11   HD21  LEU   8          HD23      LEU   8 -21.835  -3.531  -6.416

  No H/Q in entry =          11
  In of MODEL   45
    1    H    PHE   9           H        PHE   9 -21.439   0.939  -4.048
    2    HA   PHE   9           HA       PHE   9 -18.655   1.858  -4.593
    3    HB2  PHE   9           HB2      PHE   9 -20.646   2.945  -2.607
    4    HB3  PHE   9           HB3      PHE   9 -18.934   3.344  -2.596
    5    HD1  PHE   9           HD1      PHE   9 -17.932   4.660  -4.391
    6    HD2  PHE   9           HD2      PHE   9 -22.131   3.778  -4.367
    7    HE1  PHE   9           HE1      PHE   9 -18.301   6.367  -6.147
    8    HE2  PHE   9           HE2      PHE   9 -22.501   5.497  -6.119
    9    HZ   PHE   9           HZ       PHE   9 -20.584   6.787  -7.015

  No H/Q in entry =           9
  In of MODEL   45
    1    H    SER  10           H        SER  10 -17.045   0.926  -3.476
    2    HA   SER  10           HA       SER  10 -17.241   0.014  -0.792
    3    HB2  SER  10           HB2      SER  10 -17.227  -2.319  -1.039
    4    HB3  SER  10           HB3      SER  10 -18.454  -1.794  -2.181
    5    HG   SER  10           HG       SER  10 -15.815  -2.652  -2.640

  No H/Q in entry =           5
  In of MODEL   45
    1    H    SER  11           H        SER  11 -15.204   0.076   0.040
    2    HA   SER  11           HA       SER  11 -13.035   0.956  -1.506
    3    HB2  SER  11           HB2      SER  11 -13.517   0.968   1.098
    4    HB3  SER  11           HB3      SER  11 -12.508  -0.478   1.041
    5    HG   SER  11           HG       SER  11 -10.879   0.727   0.119

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA  12           H        ALA  12 -14.251  -1.701  -2.343
    2    HA   ALA  12           HA       ALA  12 -11.696  -2.962  -2.939
    3    HB2  ALA  12           HB1      ALA  12 -12.210  -4.173  -0.944
    4    HB3  ALA  12           HB2      ALA  12 -12.587  -5.237  -2.298
    5    HB1  ALA  12           HB3      ALA  12 -13.886  -4.407  -1.444

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLY  13           H        GLY  13 -12.493  -1.931  -4.947
    2    HA3  GLY  13           HA2      GLY  13 -14.785  -2.590  -6.353
    3    HA2  GLY  13           HA3      GLY  13 -13.254  -2.144  -7.119

  No H/Q in entry =           3
  In of MODEL   45
    1    H    MET  14           H        MET  14 -11.691  -4.423  -6.379
    2    HA   MET  14           HA       MET  14 -12.259  -6.145  -8.471
    3    HB2  MET  14           HB2      MET  14 -10.095  -6.232  -7.333
    4    HB3  MET  14           HB3      MET  14 -10.842  -6.942  -5.904
    5    HG2  MET  14           HG2      MET  14 -11.524  -8.906  -7.255
    6    HG3  MET  14           HG3      MET  14 -10.765  -8.187  -8.676
    7    HE1  MET  14           HE1      MET  14  -8.585  -7.749  -9.089
    8    HE3  MET  14           HE2      MET  14  -7.141  -8.372  -8.295
    9    HE2  MET  14           HE3      MET  14  -7.942  -6.941  -7.651

  No H/Q in entry =           9
  In of MODEL   45
    1    H    SER  15           H        SER  15 -13.253  -6.673  -5.077
    2    HA   SER  15           HA       SER  15 -14.604  -9.131  -5.720
    3    HB2  SER  15           HB2      SER  15 -14.958  -7.360  -3.286
    4    HB3  SER  15           HB3      SER  15 -15.715  -8.934  -3.512
    5    HG   SER  15           HG       SER  15 -12.924  -8.351  -3.450

  No H/Q in entry =           5
  In of MODEL   45
    1    H    THR  16           H        THR  16 -15.728  -5.767  -5.284
    2    HA   THR  16           HA       THR  16 -18.523  -6.315  -5.738
    3    HB   THR  16           HB       THR  16 -17.020  -3.730  -6.278
    4    HG1  THR  16           HG1      THR  16 -18.300  -3.923  -3.894
    5   HG22  THR  16          HG21      THR  16 -19.237  -2.764  -5.601
    6   HG21  THR  16          HG22      THR  16 -19.895  -4.410  -5.587
    7   HG23  THR  16          HG23      THR  16 -19.293  -3.698  -7.091

  No H/Q in entry =           7
  In of MODEL   45
    1    H    SER  17           H        SER  17 -15.749  -5.735  -7.649
    2    HA   SER  17           HA       SER  17 -16.918  -4.999 -10.133
    3    HB2  SER  17           HB2      SER  17 -14.292  -6.390  -9.544
    4    HB3  SER  17           HB3      SER  17 -14.764  -5.794 -11.136
    5    HG   SER  17           HG       SER  17 -13.580  -4.461  -9.224

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU  18           H        LEU  18 -16.332  -8.140  -8.686
    2    HA   LEU  18           HA       LEU  18 -16.961  -9.645 -11.027
    3    HB2  LEU  18           HB2      LEU  18 -15.713 -10.543  -9.065
    4    HB3  LEU  18           HB3      LEU  18 -17.203 -10.457  -8.126
    5    HG   LEU  18           HG       LEU  18 -18.265 -12.018  -9.735
    6   HD13  LEU  18          HD11      LEU  18 -17.130 -11.808 -11.756
    7   HD12  LEU  18          HD12      LEU  18 -16.452 -13.308 -11.123
    8   HD11  LEU  18          HD13      LEU  18 -15.547 -11.802 -10.981
    9   HD22  LEU  18          HD21      LEU  18 -17.103 -14.000  -8.957
   10   HD21  LEU  18          HD22      LEU  18 -17.297 -12.813  -7.666
   11   HD23  LEU  18          HD23      LEU  18 -15.733 -13.006  -8.457

  No H/Q in entry =          11
  In of MODEL   45
    1    H    LEU  19           H        LEU  19 -18.882  -8.426  -8.286
    2    HA   LEU  19           HA       LEU  19 -21.360  -9.607  -9.073
    3    HB2  LEU  19           HB2      LEU  19 -21.050  -8.767  -6.829
    4    HB3  LEU  19           HB3      LEU  19 -20.777  -7.138  -7.445
    5    HG   LEU  19           HG       LEU  19 -23.103  -6.935  -8.066
    6   HD13  LEU  19          HD11      LEU  19 -23.724  -9.125  -8.732
    7   HD12  LEU  19          HD12      LEU  19 -24.676  -8.782  -7.288
    8   HD11  LEU  19          HD13      LEU  19 -23.249  -9.811  -7.178
    9   HD21  LEU  19          HD21      LEU  19 -22.578  -7.906  -5.270
   10   HD23  LEU  19          HD22      LEU  19 -24.095  -7.156  -5.768
   11   HD22  LEU  19          HD23      LEU  19 -22.588  -6.245  -5.864

  No H/Q in entry =          11
  In of MODEL   45
    1    H    VAL  20           H        VAL  20 -19.871  -6.451  -9.803
    2    HA   VAL  20           HA       VAL  20 -22.007  -5.410 -11.338
    3    HB   VAL  20           HB       VAL  20 -19.020  -4.825 -11.513
    4   HG13  VAL  20          HG11      VAL  20 -19.874  -4.213 -13.655
    5   HG12  VAL  20          HG12      VAL  20 -19.809  -2.720 -12.718
    6   HG11  VAL  20          HG13      VAL  20 -21.348  -3.546 -12.954
    7   HG23  VAL  20          HG21      VAL  20 -19.797  -2.657 -10.473
    8   HG22  VAL  20          HG22      VAL  20 -19.860  -4.086  -9.444
    9   HG21  VAL  20          HG23      VAL  20 -21.338  -3.464 -10.177

  No H/Q in entry =           9
  In of MODEL   45
    1    H    SER  21           H        SER  21 -19.271  -7.469 -12.406
    2    HA   SER  21           HA       SER  21 -20.102  -7.363 -15.145
    3    HB2  SER  21           HB2      SER  21 -18.676  -9.337 -15.495
    4    HB3  SER  21           HB3      SER  21 -17.829  -8.086 -14.587
    5    HG   SER  21           HG       SER  21 -18.453 -10.616 -13.886

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LYS  22           H        LYS  22 -21.127  -9.540 -12.548
    2    HA   LYS  22           HA       LYS  22 -22.700 -11.161 -14.339
    3    HB2  LYS  22           HB2      LYS  22 -21.898 -11.867 -12.041
    4    HB3  LYS  22           HB3      LYS  22 -23.151 -10.819 -11.380
    5    HG2  LYS  22           HG2      LYS  22 -24.065 -12.977 -11.338
    6    HG3  LYS  22           HG3      LYS  22 -24.808 -12.188 -12.728
    7    HD2  LYS  22           HD2      LYS  22 -23.412 -13.369 -14.254
    8    HD3  LYS  22           HD3      LYS  22 -22.391 -13.973 -12.948
    9    HE2  LYS  22           HE2      LYS  22 -23.801 -15.775 -13.653
   10    HE3  LYS  22           HE3      LYS  22 -24.378 -15.234 -12.077
   11    HZ2  LYS  22           HZ1      LYS  22 -25.786 -15.425 -14.496
   12    HZ1  LYS  22           HZ2      LYS  22 -25.766 -13.798 -14.007
   13    HZ3  LYS  22           HZ3      LYS  22 -26.365 -14.992 -12.959

  No H/Q in entry =          13
  In of MODEL   45
    1    H    MET  23           H        MET  23 -23.384  -8.231 -12.467
    2    HA   MET  23           HA       MET  23 -26.200  -8.303 -12.925
    3    HB2  MET  23           HB2      MET  23 -24.336  -5.999 -12.390
    4    HB3  MET  23           HB3      MET  23 -26.084  -5.824 -12.539
    5    HG2  MET  23           HG2      MET  23 -26.446  -7.122 -10.560
    6    HG3  MET  23           HG3      MET  23 -24.735  -7.538 -10.462
    7    HE2  MET  23           HE1      MET  23 -27.001  -3.876  -9.244
    8    HE1  MET  23           HE2      MET  23 -27.283  -4.848 -10.688
    9    HE3  MET  23           HE3      MET  23 -26.244  -3.424 -10.773

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ARG  24           H        ARG  24 -23.473  -6.888 -14.759
    2    HA   ARG  24           HA       ARG  24 -24.998  -5.588 -16.736
    3    HB2  ARG  24           HB2      ARG  24 -22.188  -6.737 -16.826
    4    HB3  ARG  24           HB3      ARG  24 -22.883  -5.818 -18.139
    5    HG2  ARG  24           HG2      ARG  24 -23.071  -3.810 -16.686
    6    HG3  ARG  24           HG3      ARG  24 -22.400  -4.754 -15.329
    7    HD2  ARG  24           HD2      ARG  24 -20.372  -5.241 -16.728
    8    HD3  ARG  24           HD3      ARG  24 -21.041  -4.200 -17.977
    9    HE   ARG  24           HE       ARG  24 -20.965  -2.493 -15.967
   10   HH21  ARG  24          HH11      ARG  24 -19.546  -0.875 -16.617
   11   HH22  ARG  24          HH12      ARG  24 -17.908  -1.274 -17.002
   12   HH11  ARG  24          HH21      ARG  24 -18.613  -4.741 -16.900
   13   HH12  ARG  24          HH22      ARG  24 -17.364  -3.564 -17.157

  No H/Q in entry =          13
  In of MODEL   45
    1    H    ALA  25           H        ALA  25 -23.886  -8.930 -16.471
    2    HA   ALA  25           HA       ALA  25 -24.562  -9.763 -19.096
    3    HB1  ALA  25           HB1      ALA  25 -23.864 -11.798 -18.408
    4    HB3  ALA  25           HB2      ALA  25 -24.898 -11.769 -16.979
    5    HB2  ALA  25           HB3      ALA  25 -23.338 -10.949 -16.954

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLN  26           H        GLN  26 -26.338  -9.788 -16.042
    2    HA   GLN  26           HA       GLN  26 -28.705 -10.981 -17.017
    3    HB2  GLN  26           HB2      GLN  26 -28.144  -9.232 -14.642
    4    HB3  GLN  26           HB3      GLN  26 -29.716  -9.948 -14.964
    5    HG2  GLN  26           HG2      GLN  26 -27.129 -11.417 -14.536
    6    HG3  GLN  26           HG3      GLN  26 -28.470 -11.305 -13.404
    7   HE21  GLN  26          HE21      GLN  26 -27.285 -13.478 -14.696
    8   HE22  GLN  26          HE22      GLN  26 -28.346 -14.521 -15.473

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ALA  27           H        ALA  27 -27.747  -7.587 -16.647
    2    HA   ALA  27           HA       ALA  27 -30.244  -6.484 -17.391
    3    HB1  ALA  27           HB1      ALA  27 -28.409  -5.176 -16.308
    4    HB3  ALA  27           HB2      ALA  27 -29.020  -4.409 -17.775
    5    HB2  ALA  27           HB3      ALA  27 -27.489  -5.283 -17.810

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLU  28           H        GLU  28 -27.580  -7.723 -19.303
    2    HA   GLU  28           HA       GLU  28 -28.552  -6.682 -21.808
    3    HB2  GLU  28           HB2      GLU  28 -26.167  -7.377 -21.223
    4    HB3  GLU  28           HB3      GLU  28 -26.724  -9.038 -21.413
    5    HG2  GLU  28           HG2      GLU  28 -25.606  -8.270 -23.402
    6    HG3  GLU  28           HG3      GLU  28 -27.311  -8.585 -23.721

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LYS  29           H        LYS  29 -28.707  -9.785 -20.145
    2    HA   LYS  29           HA       LYS  29 -30.051 -11.251 -22.126
    3    HB2  LYS  29           HB2      LYS  29 -28.973 -12.238 -20.138
    4    HB3  LYS  29           HB3      LYS  29 -30.224 -11.523 -19.123
    5    HG2  LYS  29           HG2      LYS  29 -31.909 -12.887 -20.162
    6    HG3  LYS  29           HG3      LYS  29 -30.732 -13.530 -21.305
    7    HD2  LYS  29           HD2      LYS  29 -29.568 -14.701 -19.590
    8    HD3  LYS  29           HD3      LYS  29 -30.449 -13.854 -18.321
    9    HE2  LYS  29           HE2      LYS  29 -31.220 -16.199 -18.667
   10    HE3  LYS  29           HE3      LYS  29 -32.495 -15.000 -18.891
   11    HZ1  LYS  29           HZ1      LYS  29 -31.971 -15.140 -21.327
   12    HZ3  LYS  29           HZ2      LYS  29 -32.687 -16.523 -20.648
   13    HZ2  LYS  29           HZ3      LYS  29 -31.023 -16.502 -20.974

  No H/Q in entry =          13
  In of MODEL   45
    1    H    TYR  30           H        TYR  30 -31.390  -9.136 -19.601
    2    HA   TYR  30           HA       TYR  30 -34.075  -9.573 -20.797
    3    HB2  TYR  30           HB2      TYR  30 -33.371  -8.420 -18.089
    4    HB3  TYR  30           HB3      TYR  30 -35.000  -8.669 -18.715
    5    HD1  TYR  30           HD1      TYR  30 -35.926 -10.957 -18.911
    6    HD2  TYR  30           HD2      TYR  30 -32.059 -10.253 -17.272
    7    HE1  TYR  30           HE1      TYR  30 -35.835 -13.285 -18.113
    8    HE2  TYR  30           HE2      TYR  30 -31.969 -12.566 -16.478
    9    HH   TYR  30           HH       TYR  30 -33.639 -14.920 -17.542

  No H/Q in entry =           9
  In of MODEL   45
    1    H    GLU  31           H        GLU  31 -31.913  -7.592 -21.635
    2    HA   GLU  31           HA       GLU  31 -31.843  -5.437 -22.461
    3    HB2  GLU  31           HB2      GLU  31 -34.749  -6.138 -22.925
    4    HB3  GLU  31           HB3      GLU  31 -33.914  -4.776 -23.670
    5    HG2  GLU  31           HG2      GLU  31 -32.469  -6.221 -24.885
    6    HG3  GLU  31           HG3      GLU  31 -33.024  -7.632 -23.985

  No H/Q in entry =           6
  In of MODEL   45
    1    H    VAL  32           H        VAL  32 -31.995  -5.332 -19.726
    2    HA   VAL  32           HA       VAL  32 -33.837  -3.210 -19.038
    3    HB   VAL  32           HB       VAL  32 -31.423  -4.213 -17.496
    4   HG12  VAL  32          HG11      VAL  32 -32.924  -3.381 -15.577
    5   HG11  VAL  32          HG12      VAL  32 -33.774  -2.474 -16.827
    6   HG13  VAL  32          HG13      VAL  32 -32.060  -2.178 -16.536
    7   HG21  VAL  32          HG21      VAL  32 -33.210  -5.926 -18.153
    8   HG23  VAL  32          HG22      VAL  32 -34.226  -5.094 -16.977
    9   HG22  VAL  32          HG23      VAL  32 -32.704  -5.823 -16.468

  No H/Q in entry =           9
  In of MODEL   45
    1    HA   PRO  33           HA       PRO  33 -30.822  -0.295 -20.764
    2    HB2  PRO  33           HB2      PRO  33 -32.323   1.933 -20.617
    3    HB3  PRO  33           HB3      PRO  33 -32.815   0.633 -21.702
    4    HG2  PRO  33           HG2      PRO  33 -33.734   1.154 -18.874
    5    HG3  PRO  33           HG3      PRO  33 -34.723   0.948 -20.319
    6    HD2  PRO  33           HD2      PRO  33 -34.247  -1.125 -18.660
    7    HD3  PRO  33           HD3      PRO  33 -34.339  -1.367 -20.405

  No H/Q in entry =           7
  In of MODEL   45
    1    H    VAL  34           H        VAL  34 -29.527  -0.843 -18.837
    2    HA   VAL  34           HA       VAL  34 -29.208   1.582 -17.195
    3    HB   VAL  34           HB       VAL  34 -28.600   0.120 -15.266
    4   HG12  VAL  34          HG11      VAL  34 -31.010  -0.745 -14.918
    5   HG11  VAL  34          HG12      VAL  34 -31.349   0.016 -16.471
    6   HG13  VAL  34          HG13      VAL  34 -30.771   0.991 -15.120
    7   HG21  VAL  34          HG21      VAL  34 -28.825  -1.907 -17.270
    8   HG23  VAL  34          HG22      VAL  34 -29.860  -2.263 -15.887
    9   HG22  VAL  34          HG23      VAL  34 -28.137  -1.982 -15.648

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ILE  35           H        ILE  35 -27.217   2.012 -16.389
    2    HA   ILE  35           HA       ILE  35 -24.938   0.675 -17.689
    3    HB   ILE  35           HB       ILE  35 -25.316   3.567 -16.873
    4   HG12  ILE  35          HG12      ILE  35 -24.379   2.255 -19.433
    5   HG13  ILE  35          HG13      ILE  35 -26.003   2.880 -19.146
    6   HG21  ILE  35          HG21      ILE  35 -22.764   2.026 -17.225
    7   HG23  ILE  35          HG22      ILE  35 -23.193   3.208 -15.988
    8   HG22  ILE  35          HG23      ILE  35 -22.838   3.740 -17.632
    9   HD11  ILE  35          HD11      ILE  35 -24.586   5.072 -18.570
   10   HD13  ILE  35          HD12      ILE  35 -25.152   4.689 -20.197
   11   HD12  ILE  35          HD13      ILE  35 -23.493   4.315 -19.729

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ILE  36           H        ILE  36 -23.683  -0.351 -16.110
    2    HA   ILE  36           HA       ILE  36 -24.073   0.266 -13.233
    3    HB   ILE  36           HB       ILE  36 -23.273  -2.440 -14.354
    4   HG12  ILE  36          HG12      ILE  36 -26.064  -1.625 -13.543
    5   HG13  ILE  36          HG13      ILE  36 -25.521  -1.608 -15.221
    6   HG23  ILE  36          HG21      ILE  36 -23.590  -3.266 -12.234
    7   HG22  ILE  36          HG22      ILE  36 -24.707  -1.980 -11.776
    8   HG21  ILE  36          HG23      ILE  36 -22.976  -1.652 -11.877
    9   HD13  ILE  36          HD11      ILE  36 -25.695  -3.821 -15.423
   10   HD12  ILE  36          HD12      ILE  36 -26.737  -3.695 -14.006
   11   HD11  ILE  36          HD13      ILE  36 -25.037  -4.120 -13.816

  No H/Q in entry =          11
  In of MODEL   45
    1    H    GLU  37           H        GLU  37 -22.273   0.891 -12.159
    2    HA   GLU  37           HA       GLU  37 -19.600   0.087 -13.121
    3    HB2  GLU  37           HB2      GLU  37 -20.388   2.882 -12.307
    4    HB3  GLU  37           HB3      GLU  37 -18.754   2.340 -12.687
    5    HG2  GLU  37           HG2      GLU  37 -21.043   2.445 -14.631
    6    HG3  GLU  37           HG3      GLU  37 -19.779   3.664 -14.472

  No H/Q in entry =           6
  In of MODEL   45
    1    H    ALA  38           H        ALA  38 -18.085  -0.154 -11.463
    2    HA   ALA  38           HA       ALA  38 -19.069   0.029  -8.676
    3    HB1  ALA  38           HB1      ALA  38 -17.384  -1.915 -10.129
    4    HB3  ALA  38           HB2      ALA  38 -18.410  -2.147  -8.714
    5    HB2  ALA  38           HB3      ALA  38 -16.794  -1.468  -8.528

  No H/Q in entry =           5
  In of MODEL   45
    1    H    PHE  39           H        PHE  39 -17.802   1.237  -7.223
    2    HA   PHE  39           HA       PHE  39 -15.290   2.435  -8.163
    3    HB2  PHE  39           HB2      PHE  39 -17.648   3.945  -7.039
    4    HB3  PHE  39           HB3      PHE  39 -16.015   4.604  -7.114
    5    HD1  PHE  39           HD1      PHE  39 -14.905   4.726  -9.410
    6    HD2  PHE  39           HD2      PHE  39 -19.093   4.173  -8.826
    7    HE1  PHE  39           HE1      PHE  39 -15.321   5.535 -11.715
    8    HE2  PHE  39           HE2      PHE  39 -19.524   4.971 -11.122
    9    HZ   PHE  39           HZ       PHE  39 -17.643   5.626 -12.585

  No H/Q in entry =           9
  In of MODEL   45
    1    HA   PRO  40           HA       PRO  40 -14.280   1.681  -3.893
    2    HB2  PRO  40           HB2      PRO  40 -12.502   3.695  -3.317
    3    HB3  PRO  40           HB3      PRO  40 -12.077   2.363  -4.392
    4    HG2  PRO  40           HG2      PRO  40 -13.112   5.099  -5.122
    5    HG3  PRO  40           HG3      PRO  40 -11.697   4.256  -5.752
    6    HD2  PRO  40           HD2      PRO  40 -13.943   4.168  -7.123
    7    HD3  PRO  40           HD3      PRO  40 -12.987   2.699  -6.947

  No H/Q in entry =           7
  In of MODEL   45
    1    H    GLU  41           H        GLU  41 -14.865   2.660  -1.753
    2    HA   GLU  41           HA       GLU  41 -17.108   4.364  -1.699
    3    HB2  GLU  41           HB2      GLU  41 -16.604   4.498   0.771
    4    HB3  GLU  41           HB3      GLU  41 -16.799   2.871   0.119
    5    HG2  GLU  41           HG2      GLU  41 -14.988   2.630   1.528
    6    HG3  GLU  41           HG3      GLU  41 -14.222   2.870  -0.042

  No H/Q in entry =           6
  In of MODEL   45
    1    H    THR  42           H        THR  42 -13.779   5.281  -1.808
    2    HA   THR  42           HA       THR  42 -14.110   7.842  -0.592
    3    HB   THR  42           HB       THR  42 -11.974   8.416  -1.734
    4    HG1  THR  42           HG1      THR  42 -11.777   7.388  -3.572
    5   HG23  THR  42          HG21      THR  42 -10.609   6.854  -0.538
    6   HG22  THR  42          HG22      THR  42 -11.867   5.618  -0.596
    7   HG21  THR  42          HG23      THR  42 -12.087   7.051   0.404

  No H/Q in entry =           7
  In of MODEL   45
    1    H    LEU  43           H        LEU  43 -15.068   6.747  -3.675
    2    HA   LEU  43           HA       LEU  43 -15.337   9.518  -4.643
    3    HB2  LEU  43           HB2      LEU  43 -15.684   6.858  -6.013
    4    HB3  LEU  43           HB3      LEU  43 -15.981   8.419  -6.776
    5    HG   LEU  43           HG       LEU  43 -13.292   7.458  -5.831
    6   HD11  LEU  43          HD11      LEU  43 -14.461   6.283  -7.835
    7   HD13  LEU  43          HD12      LEU  43 -12.797   6.838  -8.010
    8   HD12  LEU  43          HD13      LEU  43 -14.119   7.789  -8.688
    9   HD22  LEU  43          HD21      LEU  43 -13.235   9.798  -5.821
   10   HD21  LEU  43          HD22      LEU  43 -14.299   9.925  -7.223
   11   HD23  LEU  43          HD23      LEU  43 -12.633   9.385  -7.427

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ALA  44           H        ALA  44 -17.251   7.694  -2.756
    2    HA   ALA  44           HA       ALA  44 -19.750   7.552  -4.035
    3    HB2  ALA  44           HB1      ALA  44 -19.577   6.437  -1.941
    4    HB3  ALA  44           HB2      ALA  44 -20.680   7.782  -1.650
    5    HB1  ALA  44           HB3      ALA  44 -19.000   7.890  -1.127

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLY  45           H        GLY  45 -18.305  10.354  -2.529
    2    HA3  GLY  45           HA2      GLY  45 -20.749  11.853  -2.850
    3    HA2  GLY  45           HA3      GLY  45 -19.195  12.478  -2.299

  No H/Q in entry =           3
  In of MODEL   45
    1    H    GLU  46           H        GLU  46 -17.703  11.540  -4.615
    2    HA   GLU  46           HA       GLU  46 -18.370  13.754  -6.375
    3    HB2  GLU  46           HB2      GLU  46 -16.032  13.237  -5.778
    4    HB3  GLU  46           HB3      GLU  46 -16.196  11.661  -6.555
    5    HG2  GLU  46           HG2      GLU  46 -16.523  12.739  -8.708
    6    HG3  GLU  46           HG3      GLU  46 -16.411  14.324  -7.944

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LYS  47           H        LYS  47 -18.257  10.235  -6.809
    2    HA   LYS  47           HA       LYS  47 -19.401  10.452  -9.466
    3    HB2  LYS  47           HB2      LYS  47 -18.820   8.055  -7.718
    4    HB3  LYS  47           HB3      LYS  47 -19.391   7.975  -9.385
    5    HG2  LYS  47           HG2      LYS  47 -16.843   9.359  -8.638
    6    HG3  LYS  47           HG3      LYS  47 -16.912   7.632  -8.987
    7    HD2  LYS  47           HD2      LYS  47 -17.907   8.131 -11.179
    8    HD3  LYS  47           HD3      LYS  47 -17.782   9.853 -10.830
    9    HE2  LYS  47           HE2      LYS  47 -15.356   9.650 -10.667
   10    HE3  LYS  47           HE3      LYS  47 -15.475   7.922 -10.993
   11    HZ3  LYS  47           HZ1      LYS  47 -16.379   8.386 -13.142
   12    HZ2  LYS  47           HZ2      LYS  47 -14.919   9.235 -12.963
   13    HZ1  LYS  47           HZ3      LYS  47 -16.401  10.055 -12.830

  No H/Q in entry =          13
  In of MODEL   45
    1    H    GLY  48           H        GLY  48 -20.670   9.698  -6.295
    2    HA3  GLY  48           HA2      GLY  48 -23.067   8.511  -6.995
    3    HA2  GLY  48           HA3      GLY  48 -22.818   9.506  -5.560

  No H/Q in entry =           3
  In of MODEL   45
    1    H    GLN  49           H        GLN  49 -22.262  11.928  -7.143
    2    HA   GLN  49           HA       GLN  49 -24.824  13.039  -7.245
    3    HB2  GLN  49           HB2      GLN  49 -22.303  13.902  -8.649
    4    HB3  GLN  49           HB3      GLN  49 -23.764  14.868  -8.540
    5    HG2  GLN  49           HG2      GLN  49 -23.564  14.894  -6.106
    6    HG3  GLN  49           HG3      GLN  49 -22.116  13.907  -6.213
    7   HE21  GLN  49          HE21      GLN  49 -21.977  16.137  -4.944
    8   HE22  GLN  49          HE22      GLN  49 -21.066  17.392  -5.608

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ASN  50           H        ASN  50 -23.186  11.158  -9.658
    2    HA   ASN  50           HA       ASN  50 -25.103  12.028 -11.709
    3    HB2  ASN  50           HB2      ASN  50 -22.527  10.487 -11.985
    4    HB3  ASN  50           HB3      ASN  50 -23.601  10.912 -13.310
    5   HD21  ASN  50          HD21      ASN  50 -20.938  11.760 -11.746
    6   HD22  ASN  50          HD22      ASN  50 -20.709  13.395 -12.094

  No H/Q in entry =           6
  In of MODEL   45
    1    H    ALA  51           H        ALA  51 -25.051   9.673  -9.461
    2    HA   ALA  51           HA       ALA  51 -25.867   7.527 -11.272
    3    HB2  ALA  51           HB1      ALA  51 -25.255   6.180  -9.595
    4    HB3  ALA  51           HB2      ALA  51 -26.358   6.989  -8.483
    5    HB1  ALA  51           HB3      ALA  51 -24.723   7.609  -8.710

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ASP  52           H        ASP  52 -27.870   6.472 -11.097
    2    HA   ASP  52           HA       ASP  52 -30.038   8.308 -10.397
    3    HB2  ASP  52           HB2      ASP  52 -29.878   5.802 -12.067
    4    HB3  ASP  52           HB3      ASP  52 -31.414   6.536 -11.607

  No H/Q in entry =           4
  In of MODEL   45
    1    H    VAL  53           H        VAL  53 -28.423   5.418  -9.405
    2    HA   VAL  53           HA       VAL  53 -29.820   5.549  -6.865
    3    HB   VAL  53           HB       VAL  53 -31.241   3.908  -8.084
    4   HG11  VAL  53          HG11      VAL  53 -29.521   3.045  -9.634
    5   HG13  VAL  53          HG12      VAL  53 -30.341   1.752  -8.759
    6   HG12  VAL  53          HG13      VAL  53 -28.722   2.252  -8.277
    7   HG23  VAL  53          HG21      VAL  53 -30.392   1.931  -6.404
    8   HG22  VAL  53          HG22      VAL  53 -31.514   3.237  -6.019
    9   HG21  VAL  53          HG23      VAL  53 -29.801   3.408  -5.641

  No H/Q in entry =           9
  In of MODEL   45
    1    H    VAL  54           H        VAL  54 -28.479   5.116  -5.232
    2    HA   VAL  54           HA       VAL  54 -25.731   4.263  -5.890
    3    HB   VAL  54           HB       VAL  54 -26.760   6.044  -3.624
    4   HG11  VAL  54          HG11      VAL  54 -24.189   4.621  -3.957
    5   HG13  VAL  54          HG12      VAL  54 -24.916   5.303  -2.503
    6   HG12  VAL  54          HG13      VAL  54 -24.028   6.344  -3.615
    7   HG22  VAL  54          HG21      VAL  54 -25.917   7.856  -4.739
    8   HG21  VAL  54          HG22      VAL  54 -26.489   6.865  -6.081
    9   HG23  VAL  54          HG23      VAL  54 -24.775   6.889  -5.672

  No H/Q in entry =           9
  In of MODEL   45
    1    H    LEU  55           H        LEU  55 -25.131   2.341  -5.256
    2    HA   LEU  55           HA       LEU  55 -26.604   1.034  -3.053
    3    HB2  LEU  55           HB2      LEU  55 -25.089  -0.138  -5.374
    4    HB3  LEU  55           HB3      LEU  55 -25.828  -1.070  -4.071
    5    HG   LEU  55           HG       LEU  55 -27.298   0.518  -6.166
    6   HD13  LEU  55          HD11      LEU  55 -27.023  -1.336  -7.389
    7   HD12  LEU  55          HD12      LEU  55 -27.961  -2.209  -6.176
    8   HD11  LEU  55          HD13      LEU  55 -26.203  -2.147  -6.055
    9   HD23  LEU  55          HD21      LEU  55 -28.565  -1.424  -4.287
   10   HD22  LEU  55          HD22      LEU  55 -29.272  -0.042  -5.123
   11   HD21  LEU  55          HD23      LEU  55 -28.228   0.214  -3.726

  No H/Q in entry =          11
  In of MODEL   45
    1    H    LEU  56           H        LEU  56 -25.423   0.440  -1.267
    2    HA   LEU  56           HA       LEU  56 -22.489   0.829  -1.367
    3    HB2  LEU  56           HB2      LEU  56 -24.251   0.624   1.062
    4    HB3  LEU  56           HB3      LEU  56 -22.541   1.051   1.021
    5    HG   LEU  56           HG       LEU  56 -24.853   2.732   0.095
    6   HD11  LEU  56          HD11      LEU  56 -23.696   2.351   2.596
    7   HD13  LEU  56          HD12      LEU  56 -24.692   3.721   2.106
    8   HD12  LEU  56          HD13      LEU  56 -22.937   3.822   1.988
    9   HD23  LEU  56          HD21      LEU  56 -22.908   4.427  -0.134
   10   HD22  LEU  56          HD22      LEU  56 -23.316   3.330  -1.453
   11   HD21  LEU  56          HD23      LEU  56 -21.945   2.975  -0.403

  No H/Q in entry =          11
  In of MODEL   45
    1    H    GLY  57           H        GLY  57 -21.103  -0.804  -0.855
    2    HA3  GLY  57           HA2      GLY  57 -22.034  -3.488  -1.036
    3    HA2  GLY  57           HA3      GLY  57 -20.403  -2.996  -0.584

  No H/Q in entry =           3
  In of MODEL   45
    1    HA   PRO  58           HA       PRO  58 -23.151  -4.025   3.175
    2    HB2  PRO  58           HB2      PRO  58 -22.461  -6.631   3.773
    3    HB3  PRO  58           HB3      PRO  58 -23.862  -6.221   2.782
    4    HG2  PRO  58           HG2      PRO  58 -21.151  -7.108   1.951
    5    HG3  PRO  58           HG3      PRO  58 -22.727  -7.565   1.307
    6    HD2  PRO  58           HD2      PRO  58 -21.135  -5.753   0.055
    7    HD3  PRO  58           HD3      PRO  58 -22.895  -5.663  -0.017

  No H/Q in entry =           7
  In of MODEL   45
    1    H    GLN  59           H        GLN  59 -19.792  -4.506   2.511
    2    HA   GLN  59           HA       GLN  59 -18.990  -4.523   5.258
    3    HB2  GLN  59           HB2      GLN  59 -17.400  -3.601   2.860
    4    HB3  GLN  59           HB3      GLN  59 -16.760  -3.982   4.445
    5    HG2  GLN  59           HG2      GLN  59 -18.099  -5.937   2.583
    6    HG3  GLN  59           HG3      GLN  59 -16.366  -5.766   2.804
    7   HE21  GLN  59          HE21      GLN  59 -18.600  -7.571   3.491
    8   HE22  GLN  59          HE22      GLN  59 -18.416  -8.411   4.914

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ILE  60           H        ILE  60 -19.954  -1.972   3.064
    2    HA   ILE  60           HA       ILE  60 -19.063  -0.014   5.092
    3    HB   ILE  60           HB       ILE  60 -19.319   1.714   3.271
    4   HG12  ILE  60          HG12      ILE  60 -19.164  -0.502   1.275
    5   HG13  ILE  60          HG13      ILE  60 -20.742   0.021   1.865
    6   HG22  ILE  60          HG21      ILE  60 -17.328  -0.287   2.355
    7   HG21  ILE  60          HG22      ILE  60 -17.191   0.414   3.966
    8   HG23  ILE  60          HG23      ILE  60 -17.175   1.459   2.546
    9   HD13  ILE  60          HD11      ILE  60 -20.462   1.314  -0.055
   10   HD12  ILE  60          HD12      ILE  60 -18.738   1.546   0.232
   11   HD11  ILE  60          HD13      ILE  60 -19.919   2.407   1.218

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ALA  61           H        ALA  61 -21.520  -1.594   5.205
    2    HA   ALA  61           HA       ALA  61 -23.750   0.076   4.782
    3    HB1  ALA  61           HB1      ALA  61 -24.946  -1.409   6.131
    4    HB2  ALA  61           HB2      ALA  61 -23.532  -1.801   7.109
    5    HB3  ALA  61           HB3      ALA  61 -23.658  -2.409   5.459

  No H/Q in entry =           5
  In of MODEL   45
    1    H    TYR  62           H        TYR  62 -21.496  -0.039   7.543
    2    HA   TYR  62           HA       TYR  62 -23.018   1.625   9.237
    3    HB2  TYR  62           HB2      TYR  62 -20.986   2.008  10.463
    4    HB3  TYR  62           HB3      TYR  62 -20.995   0.327   9.932
    5    HD1  TYR  62           HD1      TYR  62 -19.411  -0.453   8.208
    6    HD2  TYR  62           HD2      TYR  62 -19.317   3.583   9.608
    7    HE1  TYR  62           HE1      TYR  62 -17.213  -0.136   7.136
    8    HE2  TYR  62           HE2      TYR  62 -17.105   3.895   8.537
    9    HH   TYR  62           HH       TYR  62 -15.938   2.668   6.438

  No H/Q in entry =           9
  In of MODEL   45
    1    H    MET  63           H        MET  63 -21.421   2.475   6.352
    2    HA   MET  63           HA       MET  63 -21.234   5.308   7.041
    3    HB2  MET  63           HB2      MET  63 -20.678   3.783   4.495
    4    HB3  MET  63           HB3      MET  63 -20.472   5.526   4.675
    5    HG2  MET  63           HG2      MET  63 -18.732   5.172   6.319
    6    HG3  MET  63           HG3      MET  63 -18.959   3.428   6.205
    7    HE3  MET  63           HE1      MET  63 -18.466   6.086   2.808
    8    HE2  MET  63           HE2      MET  63 -16.939   6.358   3.649
    9    HE1  MET  63           HE3      MET  63 -18.467   6.573   4.505

  No H/Q in entry =           9
  In of MODEL   45
    1    H    LEU  64           H        LEU  64 -23.821   3.461   6.122
    2    HA   LEU  64           HA       LEU  64 -25.062   4.881   4.063
    3    HB2  LEU  64           HB2      LEU  64 -25.921   2.779   4.999
    4    HB3  LEU  64           HB3      LEU  64 -26.349   3.624   6.486
    5    HG   LEU  64           HG       LEU  64 -28.061   4.883   5.286
    6   HD13  LEU  64          HD11      LEU  64 -27.816   5.121   3.048
    7   HD12  LEU  64          HD12      LEU  64 -28.470   3.488   2.915
    8   HD11  LEU  64          HD13      LEU  64 -26.725   3.741   2.943
    9   HD23  LEU  64          HD21      LEU  64 -28.603   2.071   4.549
   10   HD22  LEU  64          HD22      LEU  64 -29.570   3.210   5.486
   11   HD21  LEU  64          HD23      LEU  64 -28.185   2.412   6.229

  No H/Q in entry =          11
  In of MODEL   45
    1    HA   PRO  65           HA       PRO  65 -27.182   8.046   6.848
    2    HB2  PRO  65           HB2      PRO  65 -25.142   8.199   9.068
    3    HB3  PRO  65           HB3      PRO  65 -26.879   8.487   9.143
    4    HG2  PRO  65           HG2      PRO  65 -25.941   6.230  10.057
    5    HG3  PRO  65           HG3      PRO  65 -27.379   6.201   9.036
    6    HD2  PRO  65           HD2      PRO  65 -24.523   5.575   8.283
    7    HD3  PRO  65           HD3      PRO  65 -25.992   4.693   7.863

  No H/Q in entry =           7
  In of MODEL   45
    1    H    GLU  66           H        GLU  66 -23.626   7.975   6.859
    2    HA   GLU  66           HA       GLU  66 -23.324  10.772   6.446
    3    HB2  GLU  66           HB2      GLU  66 -21.532   8.456   5.766
    4    HB3  GLU  66           HB3      GLU  66 -21.079  10.146   5.548
    5    HG2  GLU  66           HG2      GLU  66 -21.247  10.520   7.918
    6    HG3  GLU  66           HG3      GLU  66 -21.776   8.855   8.161

  No H/Q in entry =           6
  In of MODEL   45
    1    H    ILE  67           H        ILE  67 -23.477   8.024   4.200
    2    HA   ILE  67           HA       ILE  67 -23.093   9.729   1.897
    3    HB   ILE  67           HB       ILE  67 -24.003   6.826   2.096
    4   HG12  ILE  67          HG12      ILE  67 -21.383   7.982   1.126
    5   HG13  ILE  67          HG13      ILE  67 -21.651   7.565   2.818
    6   HG21  ILE  67          HG21      ILE  67 -23.975   8.701  -0.132
    7   HG23  ILE  67          HG22      ILE  67 -24.607   7.056  -0.068
    8   HG22  ILE  67          HG23      ILE  67 -22.904   7.333  -0.427
    9   HD12  ILE  67          HD11      ILE  67 -21.281   5.788   0.464
   10   HD11  ILE  67          HD12      ILE  67 -22.275   5.223   1.804
   11   HD13  ILE  67          HD13      ILE  67 -20.594   5.679   2.084

  No H/Q in entry =          11
  In of MODEL   45
    1    H    GLN  68           H        GLN  68 -25.940   8.691   3.582
    2    HA   GLN  68           HA       GLN  68 -27.798   9.630   1.640
    3    HB2  GLN  68           HB2      GLN  68 -28.003   9.278   4.627
    4    HB3  GLN  68           HB3      GLN  68 -29.337   9.879   3.657
    5    HG2  GLN  68           HG2      GLN  68 -29.399   7.848   2.384
    6    HG3  GLN  68           HG3      GLN  68 -27.939   7.263   3.161
    7   HE21  GLN  68          HE21      GLN  68 -30.128   5.918   3.066
    8   HE22  GLN  68          HE22      GLN  68 -30.935   5.469   4.496

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ARG  69           H        ARG  69 -26.133  11.289   4.346
    2    HA   ARG  69           HA       ARG  69 -27.489  13.781   3.962
    3    HB2  ARG  69           HB2      ARG  69 -25.123  12.836   5.510
    4    HB3  ARG  69           HB3      ARG  69 -25.196  14.556   5.151
    5    HG2  ARG  69           HG2      ARG  69 -27.494  14.616   6.163
    6    HG3  ARG  69           HG3      ARG  69 -27.290  12.926   6.635
    7    HD2  ARG  69           HD2      ARG  69 -25.564  15.269   7.516
    8    HD3  ARG  69           HD3      ARG  69 -26.683  14.372   8.532
    9    HE   ARG  69           HE       ARG  69 -24.094  13.421   7.536
   10   HH21  ARG  69          HH11      ARG  69 -23.276  11.653   8.719
   11   HH22  ARG  69          HH12      ARG  69 -24.291  10.845   9.867
   12   HH11  ARG  69          HH21      ARG  69 -27.024  12.896   9.287
   13   HH12  ARG  69          HH22      ARG  69 -26.412  11.547  10.186

  No H/Q in entry =          13
  In of MODEL   45
    1    H    LEU  70           H        LEU  70 -24.652  12.352   2.552
    2    HA   LEU  70           HA       LEU  70 -23.542  14.708   1.362
    3    HB2  LEU  70           HB2      LEU  70 -22.555  12.384   1.941
    4    HB3  LEU  70           HB3      LEU  70 -23.202  11.921   0.367
    5    HG   LEU  70           HG       LEU  70 -21.618  13.280  -0.748
    6   HD11  LEU  70          HD11      LEU  70 -20.739  14.120   2.024
    7   HD13  LEU  70          HD12      LEU  70 -21.449  15.158   0.788
    8   HD12  LEU  70          HD13      LEU  70 -19.847  14.464   0.539
    9   HD22  LEU  70          HD21      LEU  70 -20.194  11.552  -0.539
   10   HD21  LEU  70          HD22      LEU  70 -21.098  11.039   0.885
   11   HD23  LEU  70          HD23      LEU  70 -19.702  12.101   1.063

  No H/Q in entry =          11
  In of MODEL   45
    1    H    LEU  71           H        LEU  71 -25.735  12.181   0.288
    2    HA   LEU  71           HA       LEU  71 -26.294  13.671  -2.220
    3    HB2  LEU  71           HB2      LEU  71 -26.517  10.688  -1.767
    4    HB3  LEU  71           HB3      LEU  71 -26.666  11.549  -3.298
    5    HG   LEU  71           HG       LEU  71 -24.116  11.541  -1.683
    6   HD12  LEU  71          HD11      LEU  71 -24.227   9.911  -4.112
    7   HD11  LEU  71          HD12      LEU  71 -25.218   9.298  -2.791
    8   HD13  LEU  71          HD13      LEU  71 -23.492   9.563  -2.547
    9   HD22  LEU  71          HD21      LEU  71 -24.230  13.357  -3.177
   10   HD21  LEU  71          HD22      LEU  71 -24.760  12.318  -4.499
   11   HD23  LEU  71          HD23      LEU  71 -23.128  12.157  -3.850

  No H/Q in entry =          11
  In of MODEL   45
    1    HA   PRO  72           HA       PRO  72 -30.116  13.260   0.471
    2    HB2  PRO  72           HB2      PRO  72 -30.950  15.829   0.402
    3    HB3  PRO  72           HB3      PRO  72 -29.626  15.365   1.471
    4    HG2  PRO  72           HG2      PRO  72 -29.478  16.555  -1.287
    5    HG3  PRO  72           HG3      PRO  72 -28.679  17.101   0.188
    6    HD2  PRO  72           HD2      PRO  72 -27.390  15.527  -1.601
    7    HD3  PRO  72           HD3      PRO  72 -27.105  15.360   0.130

  No H/Q in entry =           7
  In of MODEL   45
    1    H    ASN  73           H        ASN  73 -29.542  14.205  -2.755
    2    HA   ASN  73           HA       ASN  73 -32.415  13.926  -3.335
    3    HB2  ASN  73           HB2      ASN  73 -31.976  15.025  -5.442
    4    HB3  ASN  73           HB3      ASN  73 -31.419  16.001  -4.091
    5   HD21  ASN  73          HD21      ASN  73 -30.672  16.035  -6.783
    6   HD22  ASN  73          HD22      ASN  73 -29.009  15.857  -7.005

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LYS  74           H        LYS  74 -30.451  11.649  -2.943
    2    HA   LYS  74           HA       LYS  74 -31.080  10.259  -5.480
    3    HB2  LYS  74           HB2      LYS  74 -28.522   9.941  -3.904
    4    HB3  LYS  74           HB3      LYS  74 -28.942   9.131  -5.415
    5    HG2  LYS  74           HG2      LYS  74 -28.641  12.098  -5.220
    6    HG3  LYS  74           HG3      LYS  74 -27.284  11.019  -5.548
    7    HD2  LYS  74           HD2      LYS  74 -28.447  10.103  -7.470
    8    HD3  LYS  74           HD3      LYS  74 -29.849  11.117  -7.126
    9    HE2  LYS  74           HE2      LYS  74 -28.609  13.108  -7.592
   10    HE3  LYS  74           HE3      LYS  74 -27.099  12.201  -7.709
   11    HZ2  LYS  74           HZ1      LYS  74 -28.602  12.818  -9.809
   12    HZ1  LYS  74           HZ2      LYS  74 -29.267  11.304  -9.423
   13    HZ3  LYS  74           HZ3      LYS  74 -27.607  11.445  -9.750

  No H/Q in entry =          13
  In of MODEL   45
    1    HA   PRO  75           HA       PRO  75 -32.455   7.293  -2.480
    2    HB2  PRO  75           HB2      PRO  75 -32.819   5.077  -4.054
    3    HB3  PRO  75           HB3      PRO  75 -33.931   6.445  -4.105
    4    HG2  PRO  75           HG2      PRO  75 -31.633   5.819  -5.917
    5    HG3  PRO  75           HG3      PRO  75 -33.284   6.274  -6.335
    6    HD2  PRO  75           HD2      PRO  75 -31.319   8.117  -6.329
    7    HD3  PRO  75           HD3      PRO  75 -32.937   8.536  -5.762

  No H/Q in entry =           7
  In of MODEL   45
    1    H    VAL  76           H        VAL  76 -30.990   6.221  -1.133
    2    HA   VAL  76           HA       VAL  76 -28.561   4.982  -2.282
    3    HB   VAL  76           HB       VAL  76 -28.783   6.454   0.378
    4   HG11  VAL  76          HG11      VAL  76 -26.467   5.137  -1.055
    5   HG13  VAL  76          HG12      VAL  76 -27.142   4.697   0.516
    6   HG12  VAL  76          HG13      VAL  76 -26.281   6.224   0.323
    7   HG22  VAL  76          HG21      VAL  76 -28.108   8.346  -0.523
    8   HG21  VAL  76          HG22      VAL  76 -28.686   7.656  -2.040
    9   HG23  VAL  76          HG23      VAL  76 -26.978   7.547  -1.616

  No H/Q in entry =           9
  In of MODEL   45
    1    H    GLU  77           H        GLU  77 -28.358   2.826  -1.671
    2    HA   GLU  77           HA       GLU  77 -29.107   2.052   0.998
    3    HB2  GLU  77           HB2      GLU  77 -30.743   0.423   0.498
    4    HB3  GLU  77           HB3      GLU  77 -31.287   1.952  -0.195
    5    HG2  GLU  77           HG2      GLU  77 -30.725   1.183  -2.393
    6    HG3  GLU  77           HG3      GLU  77 -30.089  -0.320  -1.729

  No H/Q in entry =           6
  In of MODEL   45
    1    H    VAL  78           H        VAL  78 -28.793  -0.038   1.655
    2    HA   VAL  78           HA       VAL  78 -26.153  -0.842   0.720
    3    HB   VAL  78           HB       VAL  78 -27.829  -1.703   3.117
    4   HG11  VAL  78          HG11      VAL  78 -25.524  -2.961   1.953
    5   HG13  VAL  78          HG12      VAL  78 -26.411  -3.420   3.408
    6   HG12  VAL  78          HG13      VAL  78 -25.077  -2.274   3.513
    7   HG22  VAL  78          HG21      VAL  78 -26.330  -0.356   4.427
    8   HG21  VAL  78          HG22      VAL  78 -27.077   0.620   3.164
    9   HG23  VAL  78          HG23      VAL  78 -25.410   0.072   2.985

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ILE  79           H        ILE  79 -25.654  -2.758  -0.191
    2    HA   ILE  79           HA       ILE  79 -27.756  -4.214  -1.499
    3    HB   ILE  79           HB       ILE  79 -24.767  -4.775  -1.331
    4   HG12  ILE  79          HG12      ILE  79 -26.431  -3.655  -3.591
    5   HG13  ILE  79          HG13      ILE  79 -25.525  -2.654  -2.456
    6   HG22  ILE  79          HG21      ILE  79 -25.924  -5.945  -3.628
    7   HG21  ILE  79          HG22      ILE  79 -26.890  -6.454  -2.243
    8   HG23  ILE  79          HG23      ILE  79 -25.153  -6.752  -2.263
    9   HD13  ILE  79          HD11      ILE  79 -24.145  -2.786  -4.299
   10   HD12  ILE  79          HD12      ILE  79 -24.509  -4.491  -4.570
   11   HD11  ILE  79          HD13      ILE  79 -23.495  -4.012  -3.208

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ASP  80           H        ASP  80 -28.632  -6.126  -0.899
    2    HA   ASP  80           HA       ASP  80 -28.542  -7.022   1.749
    3    HB2  ASP  80           HB2      ASP  80 -30.331  -7.581   0.141
    4    HB3  ASP  80           HB3      ASP  80 -29.201  -8.603  -0.746

  No H/Q in entry =           4
  In of MODEL   45
    1    H    SER  81           H        SER  81 -27.000  -8.174   2.853
    2    HA   SER  81           HA       SER  81 -24.533  -8.887   1.619
    3    HB2  SER  81           HB2      SER  81 -23.951  -9.912   3.778
    4    HB3  SER  81           HB3      SER  81 -24.641  -8.306   4.005
    5    HG   SER  81           HG       SER  81 -26.089  -9.182   5.177

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU  82           H        LEU  82 -27.262 -10.946   1.992
    2    HA   LEU  82           HA       LEU  82 -25.751 -13.333   1.448
    3    HB2  LEU  82           HB2      LEU  82 -28.688 -12.816   1.048
    4    HB3  LEU  82           HB3      LEU  82 -27.896 -14.382   1.215
    5    HG   LEU  82           HG       LEU  82 -28.183 -12.322   3.383
    6   HD13  LEU  82          HD11      LEU  82 -29.885 -13.684   4.277
    7   HD12  LEU  82          HD12      LEU  82 -29.455 -15.048   3.243
    8   HD11  LEU  82          HD13      LEU  82 -30.247 -13.632   2.551
    9   HD22  LEU  82          HD21      LEU  82 -26.170 -13.530   3.718
   10   HD21  LEU  82          HD22      LEU  82 -26.906 -15.044   3.194
   11   HD23  LEU  82          HD23      LEU  82 -27.369 -14.327   4.737

  No H/Q in entry =          11
  In of MODEL   45
    1    H    LEU  83           H        LEU  83 -27.717 -11.087  -0.439
    2    HA   LEU  83           HA       LEU  83 -27.576 -12.452  -2.912
    3    HB2  LEU  83           HB2      LEU  83 -27.940  -9.540  -2.261
    4    HB3  LEU  83           HB3      LEU  83 -28.009 -10.187  -3.900
    5    HG   LEU  83           HG       LEU  83 -30.008 -10.546  -1.688
    6   HD13  LEU  83          HD11      LEU  83 -30.761  -8.692  -2.742
    7   HD12  LEU  83          HD12      LEU  83 -31.259  -9.801  -4.016
    8   HD11  LEU  83          HD13      LEU  83 -29.717  -8.954  -4.138
    9   HD23  LEU  83          HD21      LEU  83 -30.210 -11.807  -4.408
   10   HD22  LEU  83          HD22      LEU  83 -31.158 -12.143  -2.960
   11   HD21  LEU  83          HD23      LEU  83 -29.477 -12.666  -3.053

  No H/Q in entry =          11
  In of MODEL   45
    1    H    TYR  84           H        TYR  84 -25.565 -10.088  -1.274
    2    HA   TYR  84           HA       TYR  84 -23.736  -9.626  -3.439
    3    HB2  TYR  84           HB2      TYR  84 -24.207  -8.140  -1.395
    4    HB3  TYR  84           HB3      TYR  84 -23.158  -9.243  -0.506
    5    HD1  TYR  84           HD1      TYR  84 -20.799  -9.082  -0.659
    6    HD2  TYR  84           HD2      TYR  84 -23.253  -6.839  -3.338
    7    HE1  TYR  84           HE1      TYR  84 -18.802  -7.850  -1.437
    8    HE2  TYR  84           HE2      TYR  84 -21.264  -5.608  -4.134
    9    HH   TYR  84           HH       TYR  84 -18.034  -6.560  -3.187

  No H/Q in entry =           9
  In of MODEL   45
    1    H    GLY  85           H        GLY  85 -23.467 -11.626  -0.493
    2    HA3  GLY  85           HA2      GLY  85 -20.910 -12.600  -1.019
    3    HA2  GLY  85           HA3      GLY  85 -22.133 -13.430  -0.058

  No H/Q in entry =           3
  In of MODEL   45
    1    H    LYS  86           H        LYS  86 -24.020 -13.785  -2.085
    2    HA   LYS  86           HA       LYS  86 -23.017 -16.175  -3.358
    3    HB2  LYS  86           HB2      LYS  86 -25.262 -15.912  -2.331
    4    HB3  LYS  86           HB3      LYS  86 -25.658 -14.727  -3.574
    5    HG2  LYS  86           HG2      LYS  86 -25.563 -16.422  -5.265
    6    HG3  LYS  86           HG3      LYS  86 -25.062 -17.619  -4.070
    7    HD2  LYS  86           HD2      LYS  86 -27.137 -17.212  -2.807
    8    HD3  LYS  86           HD3      LYS  86 -27.640 -16.040  -4.024
    9    HE2  LYS  86           HE2      LYS  86 -27.135 -18.975  -4.506
   10    HE3  LYS  86           HE3      LYS  86 -28.716 -18.206  -4.379
   11    HZ1  LYS  86           HZ1      LYS  86 -27.545 -16.670  -6.221
   12    HZ3  LYS  86           HZ2      LYS  86 -28.498 -18.026  -6.595
   13    HZ2  LYS  86           HZ3      LYS  86 -26.806 -18.161  -6.561

  No H/Q in entry =          13
  In of MODEL   45
    1    H    VAL  87           H        VAL  87 -22.985 -12.961  -4.259
    2    HA   VAL  87           HA       VAL  87 -22.707 -11.796  -6.207
    3    HB   VAL  87           HB       VAL  87 -21.717 -14.263  -7.635
    4   HG12  VAL  87          HG11      VAL  87 -20.672 -11.423  -7.416
    5   HG11  VAL  87          HG12      VAL  87 -21.689 -12.031  -8.724
    6   HG13  VAL  87          HG13      VAL  87 -20.062 -12.671  -8.502
    7   HG22  VAL  87          HG21      VAL  87 -20.763 -14.614  -5.471
    8   HG21  VAL  87          HG22      VAL  87 -20.279 -12.923  -5.356
    9   HG23  VAL  87          HG23      VAL  87 -19.505 -13.983  -6.532

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ASP  88           H        ASP  88 -25.222 -12.408  -5.809
    2    HA   ASP  88           HA       ASP  88 -26.402 -13.616  -8.183
    3    HB2  ASP  88           HB2      ASP  88 -27.358 -13.845  -5.840
    4    HB3  ASP  88           HB3      ASP  88 -27.792 -12.138  -5.936

  No H/Q in entry =           4
  In of MODEL   45
    1    H    GLY  89           H        GLY  89 -25.712 -12.370  -9.840
    2    HA3  GLY  89           HA2      GLY  89 -25.866  -9.596 -10.044
    3    HA2  GLY  89           HA3      GLY  89 -25.880 -10.720 -11.402

  No H/Q in entry =           3
  In of MODEL   45
    1    H    LEU  90           H        LEU  90 -28.333 -12.043 -10.906
    2    HA   LEU  90           HA       LEU  90 -30.142 -10.091 -11.991
    3    HB2  LEU  90           HB2      LEU  90 -30.245 -12.487 -12.564
    4    HB3  LEU  90           HB3      LEU  90 -30.724 -12.844 -10.904
    5    HG   LEU  90           HG       LEU  90 -32.837 -11.704 -11.232
    6   HD13  LEU  90          HD11      LEU  90 -32.665  -9.968 -12.714
    7   HD12  LEU  90          HD12      LEU  90 -33.239 -11.202 -13.838
    8   HD11  LEU  90          HD13      LEU  90 -31.518 -10.826 -13.747
    9   HD23  LEU  90          HD21      LEU  90 -32.830 -13.340 -13.664
   10   HD22  LEU  90          HD22      LEU  90 -33.784 -13.490 -12.189
   11   HD21  LEU  90          HD23      LEU  90 -32.138 -14.122 -12.243

  No H/Q in entry =          11
  In of MODEL   45
    1    H    GLY  91           H        GLY  91 -29.931 -11.587  -8.807
    2    HA3  GLY  91           HA2      GLY  91 -32.238 -10.446  -7.727
    3    HA2  GLY  91           HA3      GLY  91 -30.835 -10.991  -6.809

  No H/Q in entry =           3
  In of MODEL   45
    1    H    VAL  92           H        VAL  92 -28.913  -9.188  -7.705
    2    HA   VAL  92           HA       VAL  92 -29.650  -6.875  -6.148
    3    HB   VAL  92           HB       VAL  92 -27.140  -7.376  -7.788
    4   HG12  VAL  92          HG11      VAL  92 -27.241  -5.483  -5.465
    5   HG11  VAL  92          HG12      VAL  92 -27.929  -4.936  -6.996
    6   HG13  VAL  92          HG13      VAL  92 -26.236  -5.423  -6.913
    7   HG22  VAL  92          HG21      VAL  92 -26.905  -8.962  -6.196
    8   HG21  VAL  92          HG22      VAL  92 -28.020  -8.166  -5.085
    9   HG23  VAL  92          HG23      VAL  92 -26.362  -7.584  -5.238

  No H/Q in entry =           9
  In of MODEL   45
    1    H    LEU  93           H        LEU  93 -29.314  -7.549  -9.573
    2    HA   LEU  93           HA       LEU  93 -29.649  -4.912 -10.503
    3    HB2  LEU  93           HB2      LEU  93 -29.054  -6.777 -11.972
    4    HB3  LEU  93           HB3      LEU  93 -30.649  -7.487 -11.717
    5    HG   LEU  93           HG       LEU  93 -31.659  -5.516 -12.827
    6   HD11  LEU  93          HD11      LEU  93 -29.783  -3.939 -12.362
    7   HD13  LEU  93          HD12      LEU  93 -30.255  -3.968 -14.062
    8   HD12  LEU  93          HD13      LEU  93 -28.802  -4.817 -13.535
    9   HD23  LEU  93          HD21      LEU  93 -30.670  -6.099 -15.133
   10   HD22  LEU  93          HD22      LEU  93 -31.509  -7.344 -14.207
   11   HD21  LEU  93          HD23      LEU  93 -29.744  -7.308 -14.243

  No H/Q in entry =          11
  In of MODEL   45
    1    H    LYS  94           H        LYS  94 -32.035  -7.431  -9.603
    2    HA   LYS  94           HA       LYS  94 -34.375  -5.965 -10.187
    3    HB2  LYS  94           HB2      LYS  94 -33.847  -8.150  -8.180
    4    HB3  LYS  94           HB3      LYS  94 -35.441  -7.438  -8.420
    5    HG2  LYS  94           HG2      LYS  94 -35.406  -8.220 -10.753
    6    HG3  LYS  94           HG3      LYS  94 -33.848  -8.988 -10.452
    7    HD2  LYS  94           HD2      LYS  94 -34.949 -10.305  -8.604
    8    HD3  LYS  94           HD3      LYS  94 -36.495  -9.642  -9.132
    9    HE2  LYS  94           HE2      LYS  94 -36.032 -10.582 -11.405
   10    HE3  LYS  94           HE3      LYS  94 -34.613 -11.378 -10.726
   11    HZ3  LYS  94           HZ1      LYS  94 -36.482 -12.881 -10.857
   12    HZ2  LYS  94           HZ2      LYS  94 -37.427 -11.842  -9.900
   13    HZ1  LYS  94           HZ3      LYS  94 -36.062 -12.603  -9.235

  No H/Q in entry =          13
  In of MODEL   45
    1    H    ALA  95           H        ALA  95 -32.496  -6.098  -7.173
    2    HA   ALA  95           HA       ALA  95 -34.300  -4.494  -5.664
    3    HB2  ALA  95           HB1      ALA  95 -31.930  -5.894  -5.168
    4    HB3  ALA  95           HB2      ALA  95 -32.877  -4.976  -3.998
    5    HB1  ALA  95           HB3      ALA  95 -31.536  -4.205  -4.847

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA  96           H        ALA  96 -31.689  -3.675  -7.812
    2    HA   ALA  96           HA       ALA  96 -31.548  -0.913  -7.047
    3    HB2  ALA  96           HB1      ALA  96 -30.223  -0.706  -9.182
    4    HB3  ALA  96           HB2      ALA  96 -30.551  -2.411  -9.492
    5    HB1  ALA  96           HB3      ALA  96 -29.605  -1.938  -8.080

  No H/Q in entry =           5
  In of MODEL   45
    1    H    VAL  97           H        VAL  97 -33.149  -2.616  -9.700
    2    HA   VAL  97           HA       VAL  97 -34.216  -0.307 -10.941
    3    HB   VAL  97           HB       VAL  97 -35.059  -3.223 -10.961
    4   HG11  VAL  97          HG11      VAL  97 -36.837  -1.197 -11.417
    5   HG13  VAL  97          HG12      VAL  97 -36.929  -2.790 -12.169
    6   HG12  VAL  97          HG13      VAL  97 -36.176  -1.451 -13.033
    7   HG21  VAL  97          HG21      VAL  97 -33.798  -1.414 -13.023
    8   HG23  VAL  97          HG22      VAL  97 -34.275  -3.089 -13.300
    9   HG22  VAL  97          HG23      VAL  97 -33.001  -2.715 -12.139

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ALA  98           H        ALA  98 -35.377  -2.466  -8.377
    2    HA   ALA  98           HA       ALA  98 -37.915  -1.286  -7.981
    3    HB1  ALA  98           HB1      ALA  98 -36.910  -3.495  -6.962
    4    HB3  ALA  98           HB2      ALA  98 -38.061  -2.554  -6.011
    5    HB2  ALA  98           HB3      ALA  98 -36.332  -2.426  -5.684

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA  99           H        ALA  99 -34.797  -0.522  -6.393
    2    HA   ALA  99           HA       ALA  99 -35.868   1.479  -4.715
    3    HB1  ALA  99           HB1      ALA  99 -33.247   0.554  -5.510
    4    HB2  ALA  99           HB2      ALA  99 -33.759   1.314  -4.003
    5    HB3  ALA  99           HB3      ALA  99 -33.296   2.312  -5.380

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ILE 100           H        ILE 100 -34.890   1.590  -8.090
    2    HA   ILE 100           HA       ILE 100 -35.035   4.441  -8.311
    3    HB   ILE 100           HB       ILE 100 -35.200   2.284 -10.443
    4   HG12  ILE 100          HG12      ILE 100 -32.998   4.249  -9.817
    5   HG13  ILE 100          HG13      ILE 100 -33.044   2.603  -9.183
    6   HG21  ILE 100          HG21      ILE 100 -35.586   5.209 -10.571
    7   HG23  ILE 100          HG22      ILE 100 -36.130   3.946 -11.675
    8   HG22  ILE 100          HG23      ILE 100 -34.472   4.539 -11.762
    9   HD12  ILE 100          HD11      ILE 100 -32.551   3.549 -11.969
   10   HD11  ILE 100          HD12      ILE 100 -33.229   1.943 -11.699
   11   HD13  ILE 100          HD13      ILE 100 -31.664   2.367 -11.009

  No H/Q in entry =          11
  In of MODEL   45
    1    H    LYS 101           H        LYS 101 -37.378   1.861  -8.989
    2    HA   LYS 101           HA       LYS 101 -39.455   3.537  -9.952
    3    HB2  LYS 101           HB2      LYS 101 -39.355   0.764  -8.822
    4    HB3  LYS 101           HB3      LYS 101 -40.903   1.546  -9.139
    5    HG2  LYS 101           HG2      LYS 101 -40.471   1.671 -11.445
    6    HG3  LYS 101           HG3      LYS 101 -38.776   1.243 -11.222
    7    HD2  LYS 101           HD2      LYS 101 -40.068  -0.649 -12.082
    8    HD3  LYS 101           HD3      LYS 101 -39.415  -0.986 -10.478
    9    HE2  LYS 101           HE2      LYS 101 -41.478  -1.652  -9.932
   10    HE3  LYS 101           HE3      LYS 101 -41.911   0.058  -9.929
   11    HZ3  LYS 101           HZ1      LYS 101 -42.845  -0.089 -12.029
   12    HZ2  LYS 101           HZ2      LYS 101 -43.312  -1.555 -11.311
   13    HZ1  LYS 101           HZ3      LYS 101 -42.025  -1.526 -12.419

  No H/Q in entry =          13
  In of MODEL   45
    1    H    LYS 102           H        LYS 102 -38.923   2.057  -6.750
    2    HA   LYS 102           HA       LYS 102 -41.131   3.285  -5.513
    3    HB2  LYS 102           HB2      LYS 102 -39.901   1.403  -4.518
    4    HB3  LYS 102           HB3      LYS 102 -38.492   2.439  -4.302
    5    HG2  LYS 102           HG2      LYS 102 -39.761   3.852  -2.783
    6    HG3  LYS 102           HG3      LYS 102 -41.174   2.821  -3.001
    7    HD2  LYS 102           HD2      LYS 102 -39.954   0.939  -1.995
    8    HD3  LYS 102           HD3      LYS 102 -38.542   1.974  -1.776
    9    HE2  LYS 102           HE2      LYS 102 -39.849   3.470  -0.343
   10    HE3  LYS 102           HE3      LYS 102 -41.279   2.468  -0.584
   11    HZ1  LYS 102           HZ1      LYS 102 -39.564   0.691   0.389
   12    HZ3  LYS 102           HZ2      LYS 102 -40.644   1.592   1.338
   13    HZ2  LYS 102           HZ3      LYS 102 -39.030   2.095   1.181

  No H/Q in entry =          13
  In of MODEL   45
    1    H    ALA 103           H        ALA 103 -38.177   4.634  -6.582
    2    HA   ALA 103           HA       ALA 103 -38.335   6.953  -4.799
    3    HB2  ALA 103           HB1      ALA 103 -36.363   7.658  -6.412
    4    HB3  ALA 103           HB2      ALA 103 -36.359   5.940  -6.808
    5    HB1  ALA 103           HB3      ALA 103 -36.094   6.463  -5.146

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA 104           H        ALA 104 -39.028   6.228  -8.132
    2    HA   ALA 104           HA       ALA 104 -39.587   9.020  -8.746
    3    HB2  ALA 104           HB1      ALA 104 -39.680   8.351 -10.946
    4    HB1  ALA 104           HB2      ALA 104 -40.421   6.799 -10.553
    5    HB3  ALA 104           HB3      ALA 104 -38.690   7.040 -10.306

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA 105           H        ALA 105 -41.190   6.940  -6.910
    2    HA   ALA 105           HA       ALA 105 -43.594   8.366  -6.840
    3    HB2  ALA 105           HB1      ALA 105 -44.388   7.515  -8.863
    4    HB3  ALA 105           HB2      ALA 105 -45.019   6.336  -7.714
    5    HB1  ALA 105           HB3      ALA 105 -43.572   5.966  -8.649

  No H/Q in entry =           5
  In of MODEL   46
    1    H1   ALA   1           H3       ALA   1 -11.966 -16.217  -2.345
    2    H2   ALA   1           H2       ALA   1 -11.001 -17.342  -3.182
    3    H3   ALA   1           H1       ALA   1 -12.165 -16.425  -4.018
    4    HA   ALA   1           HA       ALA   1 -13.528 -18.153  -3.772
    5    HB3  ALA   1           HB1      ALA   1 -12.095 -19.894  -3.304
    6    HB1  ALA   1           HB2      ALA   1 -12.852 -19.791  -1.715
    7    HB2  ALA   1           HB3      ALA   1 -11.293 -19.019  -2.000

  No H/Q in entry =           7
  In of MODEL   46
    1    H    GLU   2           H        GLU   2 -15.132 -19.036  -2.113
    2    HA   GLU   2           HA       GLU   2 -16.815 -17.346  -1.060
    3    HB2  GLU   2           HB2      GLU   2 -15.824 -19.746   0.493
    4    HB3  GLU   2           HB3      GLU   2 -17.365 -18.927   0.745
    5    HG2  GLU   2           HG2      GLU   2 -18.323 -20.040  -0.985
    6    HG3  GLU   2           HG3      GLU   2 -17.009 -19.616  -2.072

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLU   3           H        GLU   3 -14.873 -18.650   1.567
    2    HA   GLU   3           HA       GLU   3 -15.143 -16.296   3.116
    3    HB2  GLU   3           HB2      GLU   3 -13.505 -18.809   3.375
    4    HB3  GLU   3           HB3      GLU   3 -13.300 -17.481   4.517
    5    HG2  GLU   3           HG2      GLU   3 -15.489 -17.675   5.337
    6    HG3  GLU   3           HG3      GLU   3 -16.068 -18.492   3.891

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LEU   4           H        LEU   4 -12.159 -17.718   1.729
    2    HA   LEU   4           HA       LEU   4 -10.364 -15.775   2.319
    3    HB2  LEU   4           HB2      LEU   4 -10.569 -17.087  -0.401
    4    HB3  LEU   4           HB3      LEU   4  -9.132 -16.334   0.281
    5    HG   LEU   4           HG       LEU   4 -10.575 -18.757   1.403
    6   HD13  LEU   4          HD11      LEU   4  -8.915 -20.082   0.477
    7   HD12  LEU   4          HD12      LEU   4  -7.733 -18.775   0.445
    8   HD11  LEU   4          HD13      LEU   4  -9.021 -18.827  -0.757
    9   HD23  LEU   4          HD21      LEU   4  -8.323 -18.769   2.783
   10   HD22  LEU   4          HD22      LEU   4  -9.665 -17.756   3.309
   11   HD21  LEU   4          HD23      LEU   4  -8.317 -17.042   2.424

  No H/Q in entry =          11
  In of MODEL   46
    1    H    GLU   5           H        GLU   5 -12.704 -15.626  -0.354
    2    HA   GLU   5           HA       GLU   5 -11.753 -13.126  -1.364
    3    HB2  GLU   5           HB2      GLU   5 -13.067 -14.746  -2.718
    4    HB3  GLU   5           HB3      GLU   5 -14.474 -14.404  -1.711
    5    HG2  GLU   5           HG2      GLU   5 -14.380 -12.034  -2.363
    6    HG3  GLU   5           HG3      GLU   5 -12.959 -12.358  -3.355

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLU   6           H        GLU   6 -14.458 -14.053   0.732
    2    HA   GLU   6           HA       GLU   6 -15.418 -11.394   1.123
    3    HB2  GLU   6           HB2      GLU   6 -16.537 -13.745   1.600
    4    HB3  GLU   6           HB3      GLU   6 -15.805 -13.524   3.188
    5    HG2  GLU   6           HG2      GLU   6 -17.566 -11.468   1.828
    6    HG3  GLU   6           HG3      GLU   6 -18.139 -12.616   3.035

  No H/Q in entry =           6
  In of MODEL   46
    1    H    VAL   7           H        VAL   7 -13.067 -13.451   2.701
    2    HA   VAL   7           HA       VAL   7 -12.632 -11.859   5.022
    3    HB   VAL   7           HB       VAL   7 -10.887 -13.872   3.579
    4   HG11  VAL   7          HG11      VAL   7 -10.450 -12.320   6.138
    5   HG13  VAL   7          HG12      VAL   7  -9.346 -12.517   4.777
    6   HG12  VAL   7          HG13      VAL   7  -9.671 -13.877   5.852
    7   HG21  VAL   7          HG21      VAL   7 -13.125 -14.478   4.802
    8   HG23  VAL   7          HG22      VAL   7 -12.204 -14.180   6.276
    9   HG22  VAL   7          HG23      VAL   7 -11.685 -15.433   5.151

  No H/Q in entry =           9
  In of MODEL   46
    1    H    VAL   8           H        VAL   8 -11.120 -11.953   1.812
    2    HA   VAL   8           HA       VAL   8  -9.096 -10.036   2.298
    3    HB   VAL   8           HB       VAL   8 -10.546 -10.760  -0.260
    4   HG12  VAL   8          HG11      VAL   8  -8.404  -9.720  -1.272
    5   HG11  VAL   8          HG12      VAL   8  -8.198  -8.940   0.298
    6   HG13  VAL   8          HG13      VAL   8  -9.638  -8.613  -0.668
    7   HG22  VAL   8          HG21      VAL   8  -8.994 -12.450  -0.510
    8   HG21  VAL   8          HG22      VAL   8  -8.838 -12.306   1.238
    9   HG23  VAL   8          HG23      VAL   8  -7.690 -11.486   0.185

  No H/Q in entry =           9
  In of MODEL   46
    1    H    MET   9           H        MET   9 -12.449  -9.720   1.137
    2    HA   MET   9           HA       MET   9 -12.443  -6.944   0.693
    3    HB2  MET   9           HB2      MET   9 -14.585  -8.913   1.451
    4    HB3  MET   9           HB3      MET   9 -14.947  -7.186   1.393
    5    HG2  MET   9           HG2      MET   9 -13.870  -7.227  -0.951
    6    HG3  MET   9           HG3      MET   9 -14.026  -8.980  -0.851
    7    HE3  MET   9           HE1      MET   9 -17.601  -9.837  -0.972
    8    HE2  MET   9           HE2      MET   9 -16.775  -9.653   0.571
    9    HE1  MET   9           HE3      MET   9 -15.899 -10.292  -0.817

  No H/Q in entry =           9
  In of MODEL   46
    1    H    GLY  10           H        GLY  10 -13.066  -8.838   3.627
    2    HA3  GLY  10           HA2      GLY  10 -13.659  -6.660   5.338
    3    HA2  GLY  10           HA3      GLY  10 -13.062  -8.234   5.858

  No H/Q in entry =           3
  In of MODEL   46
    1    H    LEU  11           H        LEU  11 -10.614  -8.312   4.542
    2    HA   LEU  11           HA       LEU  11  -8.944  -6.837   6.294
    3    HB2  LEU  11           HB2      LEU  11  -8.368  -8.258   3.691
    4    HB3  LEU  11           HB3      LEU  11  -7.113  -7.523   4.687
    5    HG   LEU  11           HG       LEU  11  -9.071  -9.594   5.711
    6   HD13  LEU  11          HD11      LEU  11  -7.824 -10.811   4.151
    7   HD12  LEU  11          HD12      LEU  11  -6.884 -11.024   5.626
    8   HD11  LEU  11          HD13      LEU  11  -6.368  -9.852   4.415
    9   HD22  LEU  11          HD21      LEU  11  -8.239  -8.557   7.624
   10   HD21  LEU  11          HD22      LEU  11  -6.711  -8.125   6.859
   11   HD23  LEU  11          HD23      LEU  11  -7.001  -9.786   7.375

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  12           H        ILE  12  -9.858  -6.321   2.902
    2    HA   ILE  12           HA       ILE  12  -8.214  -4.057   2.467
    3    HB   ILE  12           HB       ILE  12 -10.853  -4.790   1.175
    4   HG12  ILE  12          HG12      ILE  12  -8.781  -6.396   1.104
    5   HG13  ILE  12          HG13      ILE  12  -9.649  -6.062  -0.381
    6   HG21  ILE  12          HG21      ILE  12  -8.669  -2.855   0.336
    7   HG23  ILE  12          HG22      ILE  12 -10.339  -2.455   0.717
    8   HG22  ILE  12          HG23      ILE  12  -9.958  -3.396  -0.696
    9   HD11  ILE  12          HD11      ILE  12  -7.171  -4.570   0.520
   10   HD13  ILE  12          HD12      ILE  12  -7.960  -4.474  -1.052
   11   HD12  ILE  12          HD13      ILE  12  -7.142  -5.941  -0.573

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  13           H        ILE  13 -11.569  -4.393   3.562
    2    HA   ILE  13           HA       ILE  13 -12.089  -1.615   3.822
    3    HB   ILE  13           HB       ILE  13 -13.240  -4.055   5.197
    4   HG12  ILE  13          HG12      ILE  13 -13.474  -3.541   2.656
    5   HG13  ILE  13          HG13      ILE  13 -14.894  -4.017   3.564
    6   HG22  ILE  13          HG21      ILE  13 -15.186  -2.401   5.686
    7   HG21  ILE  13          HG22      ILE  13 -13.981  -1.137   5.481
    8   HG23  ILE  13          HG23      ILE  13 -13.777  -2.351   6.740
    9   HD11  ILE  13          HD11      ILE  13 -14.233  -1.099   3.323
   10   HD13  ILE  13          HD12      ILE  13 -15.781  -1.882   3.569
   11   HD12  ILE  13          HD13      ILE  13 -15.031  -1.938   1.989

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ASN  14           H        ASN  14 -10.923  -4.072   6.105
    2    HA   ASN  14           HA       ASN  14 -10.758  -2.422   8.385
    3    HB2  ASN  14           HB2      ASN  14 -10.448  -5.024   8.073
    4    HB3  ASN  14           HB3      ASN  14  -8.748  -4.600   7.914
    5   HD21  ASN  14          HD21      ASN  14  -9.350  -6.130  10.095
    6   HD22  ASN  14          HD22      ASN  14  -9.343  -5.204  11.516

  No H/Q in entry =           6
  In of MODEL   46
    1    H    SER  15           H        SER  15  -8.339  -3.201   5.896
    2    HA   SER  15           HA       SER  15  -6.229  -1.657   6.962
    3    HB2  SER  15           HB2      SER  15  -5.207  -1.850   4.800
    4    HB3  SER  15           HB3      SER  15  -6.119  -3.336   5.039
    5    HG   SER  15           HG       SER  15  -7.526  -2.736   3.563

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLY  16           H        GLY  16  -8.850  -0.857   4.712
    2    HA3  GLY  16           HA2      GLY  16  -8.052   1.801   4.151
    3    HA2  GLY  16           HA3      GLY  16  -9.689   1.167   3.991

  No H/Q in entry =           3
  In of MODEL   46
    1    H    GLN  17           H        GLN  17 -10.215   0.440   6.644
    2    HA   GLN  17           HA       GLN  17 -10.980   2.932   7.775
    3    HB2  GLN  17           HB2      GLN  17 -12.149   0.799   8.259
    4    HB3  GLN  17           HB3      GLN  17 -10.735   0.247   9.157
    5    HG2  GLN  17           HG2      GLN  17 -12.370   1.167  10.719
    6    HG3  GLN  17           HG3      GLN  17 -10.961   2.224  10.658
    7   HE21  GLN  17          HE21      GLN  17 -14.387   2.006   9.948
    8   HE22  GLN  17          HE22      GLN  17 -14.572   3.610   9.423

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ALA  18           H        ALA  18  -8.299   0.715   8.403
    2    HA   ALA  18           HA       ALA  18  -7.230   1.965  10.669
    3    HB2  ALA  18           HB1      ALA  18  -6.568  -0.242   9.310
    4    HB3  ALA  18           HB2      ALA  18  -5.424   0.572  10.377
    5    HB1  ALA  18           HB3      ALA  18  -5.353   0.846   8.636

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ARG  19           H        ARG  19  -6.471   2.493   7.218
    2    HA   ARG  19           HA       ARG  19  -4.621   4.586   7.639
    3    HB2  ARG  19           HB2      ARG  19  -4.922   3.430   5.448
    4    HB3  ARG  19           HB3      ARG  19  -6.484   4.233   5.268
    5    HG2  ARG  19           HG2      ARG  19  -5.407   6.431   5.328
    6    HG3  ARG  19           HG3      ARG  19  -3.840   5.684   5.635
    7    HD2  ARG  19           HD2      ARG  19  -3.979   6.262   3.290
    8    HD3  ARG  19           HD3      ARG  19  -4.021   4.501   3.442
    9    HE   ARG  19           HE       ARG  19  -6.676   5.347   3.431
   10   HH21  ARG  19          HH11      ARG  19  -7.874   5.467   1.512
   11   HH22  ARG  19          HH12      ARG  19  -7.055   5.559  -0.008
   12   HH11  ARG  19          HH21      ARG  19  -3.903   5.469   1.397
   13   HH12  ARG  19          HH22      ARG  19  -4.804   5.557  -0.073

  No H/Q in entry =          13
  In of MODEL   46
    1    H    SER  20           H        SER  20  -8.121   4.615   7.038
    2    HA   SER  20           HA       SER  20  -8.545   7.361   6.979
    3    HB2  SER  20           HB2      SER  20 -10.392   5.980   6.448
    4    HB3  SER  20           HB3      SER  20 -10.257   5.086   7.960
    5    HG   SER  20           HG       SER  20 -11.097   6.770   9.042

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU  21           H        LEU  21  -8.493   5.190   9.792
    2    HA   LEU  21           HA       LEU  21  -8.982   7.182  11.749
    3    HB2  LEU  21           HB2      LEU  21  -7.561   4.517  11.921
    4    HB3  LEU  21           HB3      LEU  21  -7.901   5.530  13.320
    5    HG   LEU  21           HG       LEU  21 -10.039   4.564  11.399
    6   HD11  LEU  21          HD11      LEU  21  -8.918   2.672  12.559
    7   HD13  LEU  21          HD12      LEU  21 -10.590   2.876  13.083
    8   HD12  LEU  21          HD13      LEU  21  -9.269   3.439  14.108
    9   HD21  LEU  21          HD21      LEU  21 -10.024   6.087  13.998
   10   HD23  LEU  21          HD22      LEU  21 -11.406   5.065  13.621
   11   HD22  LEU  21          HD23      LEU  21 -10.982   6.393  12.552

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ALA  22           H        ALA  22  -5.996   5.877  10.347
    2    HA   ALA  22           HA       ALA  22  -4.150   7.242  11.965
    3    HB2  ALA  22           HB1      ALA  22  -3.688   5.393  10.281
    4    HB1  ALA  22           HB2      ALA  22  -2.525   6.718  10.311
    5    HB3  ALA  22           HB3      ALA  22  -3.741   6.639   9.035

  No H/Q in entry =           5
  In of MODEL   46
    1    H    TYR  23           H        TYR  23  -5.491   8.214   8.778
    2    HA   TYR  23           HA       TYR  23  -4.217  10.742   8.698
    3    HB2  TYR  23           HB2      TYR  23  -5.275   9.796   6.709
    4    HB3  TYR  23           HB3      TYR  23  -6.856   9.866   7.489
    5    HD1  TYR  23           HD1      TYR  23  -4.010  11.969   6.311
    6    HD2  TYR  23           HD2      TYR  23  -8.139  11.853   7.483
    7    HE1  TYR  23           HE1      TYR  23  -4.293  14.310   5.541
    8    HE2  TYR  23           HE2      TYR  23  -8.424  14.194   6.713
    9    HH   TYR  23           HH       TYR  23  -6.557  15.700   4.690

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ALA  24           H        ALA  24  -7.312   9.693  10.080
    2    HA   ALA  24           HA       ALA  24  -8.213  12.264  10.841
    3    HB1  ALA  24           HB1      ALA  24 -10.000  10.970  11.313
    4    HB2  ALA  24           HB2      ALA  24  -9.161  10.425  12.763
    5    HB3  ALA  24           HB3      ALA  24  -9.013   9.510  11.263

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA  25           H        ALA  25  -6.151   9.863  12.425
    2    HA   ALA  25           HA       ALA  25  -5.846  11.133  14.922
    3    HB2  ALA  25           HB1      ALA  25  -5.020   8.798  14.111
    4    HB3  ALA  25           HB2      ALA  25  -4.027   9.685  15.269
    5    HB1  ALA  25           HB3      ALA  25  -3.590   9.673  13.560

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU  26           H        LEU  26  -4.062  11.464  11.881
    2    HA   LEU  26           HA       LEU  26  -2.149  13.336  12.791
    3    HB2  LEU  26           HB2      LEU  26  -1.818  12.184  10.692
    4    HB3  LEU  26           HB3      LEU  26  -3.308  12.852  10.034
    5    HG   LEU  26           HG       LEU  26  -2.350  15.128  10.161
    6   HD12  LEU  26          HD11      LEU  26   0.187  15.212  10.576
    7   HD11  LEU  26          HD12      LEU  26   0.002  13.629  11.326
    8   HD13  LEU  26          HD13      LEU  26  -0.840  15.026  11.997
    9   HD21  LEU  26          HD21      LEU  26  -0.556  13.111   8.775
   10   HD23  LEU  26          HD22      LEU  26  -0.642  14.830   8.397
   11   HD22  LEU  26          HD23      LEU  26  -2.039  13.796   8.113

  No H/Q in entry =          11
  In of MODEL   46
    1    H    LYS  27           H        LYS  27  -5.342  13.734  11.311
    2    HA   LYS  27           HA       LYS  27  -5.355  16.522  11.101
    3    HB2  LYS  27           HB2      LYS  27  -7.062  14.999  10.121
    4    HB3  LYS  27           HB3      LYS  27  -7.713  14.733  11.738
    5    HG2  LYS  27           HG2      LYS  27  -8.201  17.129  11.964
    6    HG3  LYS  27           HG3      LYS  27  -7.500  17.437  10.372
    7    HD2  LYS  27           HD2      LYS  27  -9.196  15.956   9.341
    8    HD3  LYS  27           HD3      LYS  27  -9.904  15.665  10.932
    9    HE2  LYS  27           HE2      LYS  27 -10.405  18.066  11.165
   10    HE3  LYS  27           HE3      LYS  27  -9.670  18.379   9.590
   11    HZ3  LYS  27           HZ1      LYS  27 -12.044  18.195   9.348
   12    HZ2  LYS  27           HZ2      LYS  27 -12.055  16.681  10.123
   13    HZ1  LYS  27           HZ3      LYS  27 -11.314  16.857   8.601

  No H/Q in entry =          13
  In of MODEL   46
    1    H    GLN  28           H        GLN  28  -6.194  14.426  13.836
    2    HA   GLN  28           HA       GLN  28  -7.138  16.415  15.604
    3    HB2  GLN  28           HB2      GLN  28  -5.674  13.821  16.157
    4    HB3  GLN  28           HB3      GLN  28  -6.438  14.811  17.401
    5    HG2  GLN  28           HG2      GLN  28  -7.876  13.657  14.996
    6    HG3  GLN  28           HG3      GLN  28  -7.910  12.957  16.613
    7   HE21  GLN  28          HE21      GLN  28  -9.852  14.698  14.674
    8   HE22  GLN  28          HE22      GLN  28 -10.614  15.701  15.810

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ALA  29           H        ALA  29  -3.889  15.192  14.921
    2    HA   ALA  29           HA       ALA  29  -2.485  16.631  16.894
    3    HB1  ALA  29           HB1      ALA  29  -0.538  15.981  15.778
    4    HB3  ALA  29           HB2      ALA  29  -1.295  16.082  14.189
    5    HB2  ALA  29           HB3      ALA  29  -1.686  14.744  15.268

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LYS  30           H        LYS  30  -3.362  17.478  13.561
    2    HA   LYS  30           HA       LYS  30  -2.006  19.948  13.451
    3    HB2  LYS  30           HB2      LYS  30  -4.517  19.013  12.046
    4    HB3  LYS  30           HB3      LYS  30  -3.716  20.545  11.696
    5    HG2  LYS  30           HG2      LYS  30  -1.619  19.295  11.188
    6    HG3  LYS  30           HG3      LYS  30  -2.492  17.781  11.438
    7    HD2  LYS  30           HD2      LYS  30  -4.069  18.380   9.641
    8    HD3  LYS  30           HD3      LYS  30  -3.219  19.906   9.392
    9    HE2  LYS  30           HE2      LYS  30  -1.159  18.655   8.818
   10    HE3  LYS  30           HE3      LYS  30  -2.029  17.134   9.036
   11    HZ2  LYS  30           HZ1      LYS  30  -1.871  17.999   6.690
   12    HZ1  LYS  30           HZ2      LYS  30  -2.941  19.241   7.154
   13    HZ3  LYS  30           HZ3      LYS  30  -3.431  17.614   7.231

  No H/Q in entry =          13
  In of MODEL   46
    1    H    GLN  31           H        GLN  31  -5.088  19.036  14.867
    2    HA   GLN  31           HA       GLN  31  -5.908  21.778  15.308
    3    HB2  GLN  31           HB2      GLN  31  -7.037  19.313  16.640
    4    HB3  GLN  31           HB3      GLN  31  -7.829  20.867  16.389
    5    HG2  GLN  31           HG2      GLN  31  -7.103  20.095  13.802
    6    HG3  GLN  31           HG3      GLN  31  -7.596  18.583  14.555
    7   HE21  GLN  31          HE21      GLN  31  -9.038  20.120  12.447
    8   HE22  GLN  31          HE22      GLN  31 -10.560  20.483  13.104

  No H/Q in entry =           8
  In of MODEL   46
    1    H    GLY  32           H        GLY  32  -3.557  19.903  16.635
    2    HA3  GLY  32           HA2      GLY  32  -2.166  20.400  18.436
    3    HA2  GLY  32           HA3      GLY  32  -3.321  21.622  18.955

  No H/Q in entry =           3
  In of MODEL   46
    1    H    ASP  33           H        ASP  33  -4.681  18.552  18.304
    2    HA   ASP  33           HA       ASP  33  -5.082  18.096  21.186
    3    HB2  ASP  33           HB2      ASP  33  -6.468  17.048  18.712
    4    HB3  ASP  33           HB3      ASP  33  -6.801  16.436  20.330

  No H/Q in entry =           4
  In of MODEL   46
    1    H    PHE  34           H        PHE  34  -2.897  17.290  21.494
    2    HA   PHE  34           HA       PHE  34  -1.852  15.057  20.101
    3    HB2  PHE  34           HB2      PHE  34  -1.255  16.063  22.892
    4    HB3  PHE  34           HB3      PHE  34  -0.302  14.856  22.028
    5    HD1  PHE  34           HD1      PHE  34  -0.542  18.280  22.752
    6    HD2  PHE  34           HD2      PHE  34   0.341  15.583  19.526
    7    HE1  PHE  34           HE1      PHE  34   0.717  20.073  21.591
    8    HE2  PHE  34           HE2      PHE  34   1.596  17.379  18.371
    9    HZ   PHE  34           HZ       PHE  34   1.786  19.621  19.408

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ALA  35           H        ALA  35  -3.897  15.303  22.963
    2    HA   ALA  35           HA       ALA  35  -3.631  12.648  23.869
    3    HB3  ALA  35           HB1      ALA  35  -6.101  13.228  24.724
    4    HB1  ALA  35           HB2      ALA  35  -5.600  14.855  24.263
    5    HB2  ALA  35           HB3      ALA  35  -4.668  13.954  25.457

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA  36           H        ALA  36  -6.111  14.109  21.764
    2    HA   ALA  36           HA       ALA  36  -7.478  11.668  21.295
    3    HB1  ALA  36           HB1      ALA  36  -8.962  13.058  20.334
    4    HB3  ALA  36           HB2      ALA  36  -7.799  13.497  19.084
    5    HB2  ALA  36           HB3      ALA  36  -7.841  14.389  20.605

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA  37           H        ALA  37  -4.831  13.303  19.620
    2    HA   ALA  37           HA       ALA  37  -4.763  11.661  17.329
    3    HB3  ALA  37           HB1      ALA  37  -2.805  13.417  18.745
    4    HB2  ALA  37           HB2      ALA  37  -3.337  13.456  17.065
    5    HB1  ALA  37           HB3      ALA  37  -2.159  12.251  17.590

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LYS  38           H        LYS  38  -3.000  11.400  20.407
    2    HA   LYS  38           HA       LYS  38  -1.627   9.025  19.926
    3    HB2  LYS  38           HB2      LYS  38  -1.985  10.788  22.066
    4    HB3  LYS  38           HB3      LYS  38  -2.573   9.249  22.687
    5    HG2  LYS  38           HG2      LYS  38  -0.457   8.169  22.154
    6    HG3  LYS  38           HG3      LYS  38   0.123   9.623  21.335
    7    HD2  LYS  38           HD2      LYS  38   0.268  10.851  23.367
    8    HD3  LYS  38           HD3      LYS  38  -0.728   9.684  24.238
    9    HE2  LYS  38           HE2      LYS  38   1.633   9.417  24.857
   10    HE3  LYS  38           HE3      LYS  38   1.057   7.986  23.998
   11    HZ3  LYS  38           HZ1      LYS  38   2.349   8.425  22.215
   12    HZ2  LYS  38           HZ2      LYS  38   3.287   9.276  23.349
   13    HZ1  LYS  38           HZ3      LYS  38   2.191  10.111  22.355

  No H/Q in entry =          13
  In of MODEL   46
    1    H    ALA  39           H        ALA  39  -4.875   9.460  21.328
    2    HA   ALA  39           HA       ALA  39  -5.380   6.732  21.841
    3    HB3  ALA  39           HB1      ALA  39  -7.578   8.630  21.068
    4    HB2  ALA  39           HB2      ALA  39  -6.684   8.880  22.568
    5    HB1  ALA  39           HB3      ALA  39  -7.571   7.377  22.310

  No H/Q in entry =           5
  In of MODEL   46
    1    H    MET  40           H        MET  40  -6.006   8.724  18.988
    2    HA   MET  40           HA       MET  40  -7.443   6.757  17.534
    3    HB2  MET  40           HB2      MET  40  -5.882   9.182  16.622
    4    HB3  MET  40           HB3      MET  40  -6.889   8.199  15.555
    5    HG2  MET  40           HG2      MET  40  -7.948   9.435  18.109
    6    HG3  MET  40           HG3      MET  40  -8.022  10.263  16.556
    7    HE3  MET  40           HE1      MET  40 -10.573   8.585  14.497
    8    HE2  MET  40           HE2      MET  40  -8.823   8.737  14.348
    9    HE1  MET  40           HE3      MET  40  -9.768  10.086  14.978

  No H/Q in entry =           9
  In of MODEL   46
    1    H    MET  41           H        MET  41  -3.968   7.566  17.654
    2    HA   MET  41           HA       MET  41  -3.174   5.820  15.559
    3    HB2  MET  41           HB2      MET  41  -1.571   6.528  18.030
    4    HB3  MET  41           HB3      MET  41  -0.941   5.888  16.516
    5    HG2  MET  41           HG2      MET  41  -2.142   8.043  15.505
    6    HG3  MET  41           HG3      MET  41  -1.917   8.641  17.148
    7    HE2  MET  41           HE1      MET  41   1.043   6.604  17.515
    8    HE1  MET  41           HE2      MET  41   0.228   7.884  18.410
    9    HE3  MET  41           HE3      MET  41   1.846   8.159  17.766

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ASP  42           H        ASP  42  -3.549   5.350  19.047
    2    HA   ASP  42           HA       ASP  42  -2.460   2.779  19.215
    3    HB2  ASP  42           HB2      ASP  42  -3.369   4.526  21.032
    4    HB3  ASP  42           HB3      ASP  42  -4.775   3.471  20.963

  No H/Q in entry =           4
  In of MODEL   46
    1    H    GLN  43           H        GLN  43  -5.815   3.812  18.711
    2    HA   GLN  43           HA       GLN  43  -6.905   1.201  18.525
    3    HB2  GLN  43           HB2      GLN  43  -7.883   3.830  17.388
    4    HB3  GLN  43           HB3      GLN  43  -8.815   2.331  17.370
    5    HG2  GLN  43           HG2      GLN  43  -8.519   2.224  19.878
    6    HG3  GLN  43           HG3      GLN  43  -7.828   3.843  19.802
    7   HE21  GLN  43          HE21      GLN  43 -10.009   3.883  21.302
    8   HE22  GLN  43          HE22      GLN  43 -11.381   4.427  20.469

  No H/Q in entry =           8
  In of MODEL   46
    1    H    SER  44           H        SER  44  -5.611   3.435  16.106
    2    HA   SER  44           HA       SER  44  -6.281   1.929  13.822
    3    HB2  SER  44           HB2      SER  44  -5.074   4.339  14.258
    4    HB3  SER  44           HB3      SER  44  -3.700   3.370  13.731
    5    HG   SER  44           HG       SER  44  -4.832   4.313  11.965

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ARG  45           H        ARG  45  -3.402   1.882  15.902
    2    HA   ARG  45           HA       ARG  45  -1.881  -0.045  14.526
    3    HB2  ARG  45           HB2      ARG  45  -1.069   1.399  16.391
    4    HB3  ARG  45           HB3      ARG  45  -2.041   0.452  17.514
    5    HG2  ARG  45           HG2      ARG  45  -0.767  -1.583  16.878
    6    HG3  ARG  45           HG3      ARG  45   0.229  -0.610  15.797
    7    HD2  ARG  45           HD2      ARG  45   0.934   0.792  17.748
    8    HD3  ARG  45           HD3      ARG  45   0.034  -0.299  18.825
    9    HE   ARG  45           HE       ARG  45   1.766  -1.864  17.249
   10   HH21  ARG  45          HH11      ARG  45   3.683  -2.644  18.089
   11   HH22  ARG  45          HH12      ARG  45   4.440  -1.838  19.418
   12   HH11  ARG  45          HH21      ARG  45   2.018   0.616  19.632
   13   HH12  ARG  45          HH22      ARG  45   3.496   0.010  20.289

  No H/Q in entry =          13
  In of MODEL   46
    1    H    MET  46           H        MET  46  -4.272  -0.407  17.127
    2    HA   MET  46           HA       MET  46  -4.046  -3.201  17.443
    3    HB2  MET  46           HB2      MET  46  -6.254  -1.236  18.039
    4    HB3  MET  46           HB3      MET  46  -6.431  -2.959  18.379
    5    HG2  MET  46           HG2      MET  46  -4.443  -2.918  19.801
    6    HG3  MET  46           HG3      MET  46  -4.163  -1.229  19.408
    7    HE2  MET  46           HE1      MET  46  -7.251  -3.165  22.097
    8    HE1  MET  46           HE2      MET  46  -6.285  -3.869  20.805
    9    HE3  MET  46           HE3      MET  46  -7.791  -3.042  20.418

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ALA  47           H        ALA  47  -6.107  -1.233  15.342
    2    HA   ALA  47           HA       ALA  47  -7.682  -3.319  14.282
    3    HB3  ALA  47           HB1      ALA  47  -8.407  -1.097  13.859
    4    HB1  ALA  47           HB2      ALA  47  -7.905  -1.725  12.289
    5    HB2  ALA  47           HB3      ALA  47  -6.847  -0.632  13.183

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU  48           H        LEU  48  -4.590  -1.951  13.228
    2    HA   LEU  48           HA       LEU  48  -4.277  -3.543  10.891
    3    HB2  LEU  48           HB2      LEU  48  -2.246  -2.218  12.696
    4    HB3  LEU  48           HB3      LEU  48  -1.863  -2.936  11.132
    5    HG   LEU  48           HG       LEU  48  -3.929  -0.758  11.514
    6   HD13  LEU  48          HD11      LEU  48  -1.825   0.162  12.178
    7   HD12  LEU  48          HD12      LEU  48  -2.111   0.705  10.524
    8   HD11  LEU  48          HD13      LEU  48  -0.987  -0.619  10.837
    9   HD22  LEU  48          HD21      LEU  48  -4.380  -1.758   9.441
   10   HD21  LEU  48          HD22      LEU  48  -2.689  -2.160   9.147
   11   HD23  LEU  48          HD23      LEU  48  -3.241  -0.492   8.983

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ASN  49           H        ASN  49  -3.225  -3.909  14.239
    2    HA   ASN  49           HA       ASN  49  -1.579  -6.142  13.916
    3    HB2  ASN  49           HB2      ASN  49  -1.625  -4.807  15.960
    4    HB3  ASN  49           HB3      ASN  49  -3.278  -5.308  16.283
    5   HD21  ASN  49          HD21      ASN  49  -1.467  -5.834  18.267
    6   HD22  ASN  49          HD22      ASN  49  -1.091  -7.488  18.318

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLU  50           H        GLU  50  -5.052  -5.931  14.585
    2    HA   GLU  50           HA       GLU  50  -5.512  -8.739  14.702
    3    HB2  GLU  50           HB2      GLU  50  -7.129  -7.080  15.572
    4    HB3  GLU  50           HB3      GLU  50  -7.433  -6.525  13.924
    5    HG2  GLU  50           HG2      GLU  50  -8.256  -8.739  13.292
    6    HG3  GLU  50           HG3      GLU  50  -7.864  -9.371  14.887

  No H/Q in entry =           6
  In of MODEL   46
    1    H    ALA  51           H        ALA  51  -5.623  -6.350  12.099
    2    HA   ALA  51           HA       ALA  51  -6.576  -8.101  10.081
    3    HB2  ALA  51           HB1      ALA  51  -6.389  -6.289   8.707
    4    HB1  ALA  51           HB2      ALA  51  -4.756  -5.908   9.255
    5    HB3  ALA  51           HB3      ALA  51  -6.149  -5.420  10.222

  No H/Q in entry =           5
  In of MODEL   46
    1    H    HIS  52           H        HIS  52  -3.303  -7.132  11.064
    2    HA   HIS  52           HA       HIS  52  -1.876  -8.601   9.119
    3    HB2  HIS  52           HB2      HIS  52  -0.849  -6.855  10.524
    4    HB3  HIS  52           HB3      HIS  52  -1.046  -7.883  11.943
    5    HD1  HIS  52           HD1      HIS  52   0.292 -10.219  11.876
    6    HD2  HIS  52           HD2      HIS  52   1.427  -7.409   9.012
    7    HE1  HIS  52           HE1      HIS  52   2.542 -10.969  10.988
    8    HE2  HIS  52           HE2      HIS  52   3.248  -9.266   9.241

  No H/Q in entry =           8
  In of MODEL   46
    1    H    LEU  53           H        LEU  53  -3.074  -9.491  12.334
    2    HA   LEU  53           HA       LEU  53  -1.831 -12.013  12.535
    3    HB2  LEU  53           HB2      LEU  53  -4.336 -10.871  13.745
    4    HB3  LEU  53           HB3      LEU  53  -3.850 -12.538  14.041
    5    HG   LEU  53           HG       LEU  53  -2.007 -10.173  14.524
    6   HD12  LEU  53          HD11      LEU  53  -3.642 -11.691  16.576
    7   HD11  LEU  53          HD12      LEU  53  -4.099 -10.115  15.931
    8   HD13  LEU  53          HD13      LEU  53  -2.614 -10.289  16.860
    9   HD22  LEU  53          HD21      LEU  53  -0.640 -12.081  14.484
   10   HD21  LEU  53          HD22      LEU  53  -1.914 -13.126  15.101
   11   HD23  LEU  53          HD23      LEU  53  -1.081 -12.029  16.186

  No H/Q in entry =          11
  In of MODEL   46
    1    H    VAL  54           H        VAL  54  -4.959 -11.042  11.168
    2    HA   VAL  54           HA       VAL  54  -5.827 -13.653  10.488
    3    HB   VAL  54           HB       VAL  54  -6.521 -10.935   9.346
    4   HG12  VAL  54          HG11      VAL  54  -8.598 -12.351   8.536
    5   HG11  VAL  54          HG12      VAL  54  -7.463 -13.698   8.613
    6   HG13  VAL  54          HG13      VAL  54  -7.127 -12.320   7.567
    7   HG22  VAL  54          HG21      VAL  54  -7.428 -10.983  11.497
    8   HG21  VAL  54          HG22      VAL  54  -7.652 -12.730  11.482
    9   HG23  VAL  54          HG23      VAL  54  -8.751 -11.694  10.572

  No H/Q in entry =           9
  In of MODEL   46
    1    H    GLN  55           H        GLN  55  -3.997 -11.175   8.693
    2    HA   GLN  55           HA       GLN  55  -3.840 -12.644   6.280
    3    HB2  GLN  55           HB2      GLN  55  -3.275 -10.370   6.084
    4    HB3  GLN  55           HB3      GLN  55  -2.164 -10.424   7.450
    5    HG2  GLN  55           HG2      GLN  55  -0.432 -11.244   6.177
    6    HG3  GLN  55           HG3      GLN  55  -1.488 -12.240   5.185
    7   HE21  GLN  55          HE21      GLN  55  -1.516 -11.556   3.061
    8   HE22  GLN  55          HE22      GLN  55  -1.344  -9.950   2.547

  No H/Q in entry =           8
  In of MODEL   46
    1    H    THR  56           H        THR  56  -1.737 -12.579   9.162
    2    HA   THR  56           HA       THR  56   0.368 -14.145   8.250
    3    HB   THR  56           HB       THR  56  -0.870 -14.414  10.998
    4    HG1  THR  56           HG1      THR  56   0.176 -12.269   9.753
    5   HG22  THR  56          HG21      THR  56   2.051 -14.457  10.260
    6   HG21  THR  56          HG22      THR  56   1.068 -15.916  10.145
    7   HG23  THR  56          HG23      THR  56   1.268 -15.107  11.700

  No H/Q in entry =           7
  In of MODEL   46
    1    H    LYS  57           H        LYS  57  -2.735 -15.230   9.614
    2    HA   LYS  57           HA       LYS  57  -2.243 -18.019   9.376
    3    HB2  LYS  57           HB2      LYS  57  -4.075 -16.990  10.727
    4    HB3  LYS  57           HB3      LYS  57  -4.865 -16.496   9.237
    5    HG2  LYS  57           HG2      LYS  57  -5.934 -18.517   9.954
    6    HG3  LYS  57           HG3      LYS  57  -4.933 -18.934   8.566
    7    HD2  LYS  57           HD2      LYS  57  -3.259 -19.933   9.943
    8    HD3  LYS  57           HD3      LYS  57  -3.940 -19.233  11.410
    9    HE2  LYS  57           HE2      LYS  57  -4.589 -21.569  11.339
   10    HE3  LYS  57           HE3      LYS  57  -6.031 -20.616  11.000
   11    HZ1  LYS  57           HZ1      LYS  57  -4.419 -21.357   8.700
   12    HZ3  LYS  57           HZ2      LYS  57  -6.108 -21.313   8.883
   13    HZ2  LYS  57           HZ3      LYS  57  -5.221 -22.631   9.485

  No H/Q in entry =          13
  In of MODEL   46
    1    H    LEU  58           H        LEU  58  -3.613 -15.605   7.193
    2    HA   LEU  58           HA       LEU  58  -4.384 -17.448   5.191
    3    HB2  LEU  58           HB2      LEU  58  -3.825 -14.491   5.048
    4    HB3  LEU  58           HB3      LEU  58  -4.472 -15.442   3.710
    5    HG   LEU  58           HG       LEU  58  -5.757 -15.276   6.456
    6   HD11  LEU  58          HD11      LEU  58  -6.082 -13.641   3.960
    7   HD13  LEU  58          HD12      LEU  58  -6.082 -13.128   5.647
    8   HD12  LEU  58          HD13      LEU  58  -7.491 -13.947   4.977
    9   HD22  LEU  58          HD21      LEU  58  -6.687 -17.203   5.592
   10   HD21  LEU  58          HD22      LEU  58  -6.354 -16.750   3.920
   11   HD23  LEU  58          HD23      LEU  58  -7.730 -16.044   4.768

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  59           H        ILE  59  -1.269 -16.184   6.051
    2    HA   ILE  59           HA       ILE  59  -0.157 -16.901   3.417
    3    HB   ILE  59           HB       ILE  59   0.576 -14.818   4.978
    4   HG12  ILE  59          HG12      ILE  59   2.702 -16.439   3.564
    5   HG13  ILE  59          HG13      ILE  59   1.491 -15.533   2.696
    6   HG22  ILE  59          HG21      ILE  59   2.686 -16.837   5.695
    7   HG21  ILE  59          HG22      ILE  59   1.328 -16.563   6.762
    8   HG23  ILE  59          HG23      ILE  59   2.434 -15.246   6.373
    9   HD11  ILE  59          HD11      ILE  59   3.230 -14.277   4.806
   10   HD13  ILE  59          HD12      ILE  59   2.222 -13.452   3.620
   11   HD12  ILE  59          HD13      ILE  59   3.679 -14.303   3.103

  No H/Q in entry =          11
  In of MODEL   46
    1    H    GLU  60           H        GLU  60  -0.153 -17.997   6.788
    2    HA   GLU  60           HA       GLU  60   1.910 -19.943   6.531
    3    HB2  GLU  60           HB2      GLU  60   1.113 -19.150   8.715
    4    HB3  GLU  60           HB3      GLU  60  -0.465 -19.875   8.413
    5    HG2  GLU  60           HG2      GLU  60   0.577 -22.110   8.294
    6    HG3  GLU  60           HG3      GLU  60   2.160 -21.388   8.581

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLY  61           H        GLY  61  -1.598 -20.099   6.042
    2    HA3  GLY  61           HA2      GLY  61  -1.304 -22.890   5.093
    3    HA2  GLY  61           HA3      GLY  61  -2.801 -22.177   5.683

  No H/Q in entry =           3
  In of MODEL   46
    1    H    ASP  62           H        ASP  62  -0.597 -20.566   3.478
    2    HA   ASP  62           HA       ASP  62  -2.703 -20.103   1.583
    3    HB2  ASP  62           HB2      ASP  62  -0.880 -18.954   0.310
    4    HB3  ASP  62           HB3      ASP  62  -1.059 -18.382   1.965

  No H/Q in entry =           4
  In of MODEL   46
    1    H    ALA  63           H        ALA  63  -0.906 -22.840   2.079
    2    HA   ALA  63           HA       ALA  63   0.058 -23.623  -0.437
    3    HB1  ALA  63           HB1      ALA  63  -1.187 -25.296   1.742
    4    HB2  ALA  63           HB2      ALA  63   0.525 -24.933   1.527
    5    HB3  ALA  63           HB3      ALA  63  -0.315 -25.947   0.353

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLY  64           H        GLY  64  -3.170 -23.996   1.003
    2    HA3  GLY  64           HA2      GLY  64  -5.231 -24.424   0.095
    3    HA2  GLY  64           HA3      GLY  64  -4.635 -23.619  -1.348

  No H/Q in entry =           3
  In of MODEL   46
    1    H    GLU  65           H        GLU  65  -4.939 -24.854  -3.111
    2    HA   GLU  65           HA       GLU  65  -5.511 -27.602  -3.001
    3    HB2  GLU  65           HB2      GLU  65  -4.665 -25.844  -5.301
    4    HB3  GLU  65           HB3      GLU  65  -5.156 -27.529  -5.492
    5    HG2  GLU  65           HG2      GLU  65  -7.334 -27.045  -4.496
    6    HG3  GLU  65           HG3      GLU  65  -6.850 -25.378  -4.191

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLY  66           H        GLY  66  -4.435 -29.378  -3.788
    2    HA3  GLY  66           HA2      GLY  66  -2.148 -30.238  -2.815
    3    HA2  GLY  66           HA3      GLY  66  -2.644 -30.701  -4.432

  No H/Q in entry =           3
  In of MODEL   46
    1    H    LYS  67           H        LYS  67  -2.267 -28.184  -5.666
    2    HA   LYS  67           HA       LYS  67   0.479 -28.387  -6.328
    3    HB2  LYS  67           HB2      LYS  67   0.006 -26.558  -7.889
    4    HB3  LYS  67           HB3      LYS  67  -1.251 -27.800  -7.951
    5    HG2  LYS  67           HG2      LYS  67  -2.647 -26.473  -6.407
    6    HG3  LYS  67           HG3      LYS  67  -1.399 -25.230  -6.345
    7    HD2  LYS  67           HD2      LYS  67  -1.657 -24.837  -8.762
    8    HD3  LYS  67           HD3      LYS  67  -2.894 -26.094  -8.838
    9    HE2  LYS  67           HE2      LYS  67  -4.304 -24.833  -7.271
   10    HE3  LYS  67           HE3      LYS  67  -3.062 -23.589  -7.138
   11    HZ1  LYS  67           HZ1      LYS  67  -3.309 -23.525  -9.705
   12    HZ3  LYS  67           HZ2      LYS  67  -4.432 -22.709  -8.727
   13    HZ2  LYS  67           HZ3      LYS  67  -4.826 -24.218  -9.400

  No H/Q in entry =          13
  In of MODEL   46
    1    H    MET  68           H        MET  68   2.022 -26.695  -6.422
    2    HA   MET  68           HA       MET  68   2.676 -25.623  -3.913
    3    HB2  MET  68           HB2      MET  68   3.746 -24.963  -6.659
    4    HB3  MET  68           HB3      MET  68   4.506 -24.493  -5.138
    5    HG2  MET  68           HG2      MET  68   3.901 -27.350  -5.950
    6    HG3  MET  68           HG3      MET  68   5.484 -26.583  -6.086
    7    HE1  MET  68           HE1      MET  68   6.785 -25.673  -4.459
    8    HE3  MET  68           HE2      MET  68   6.859 -26.104  -2.751
    9    HE2  MET  68           HE3      MET  68   5.774 -24.822  -3.282

  No H/Q in entry =           9
  In of MODEL   46
    1    H    LYS  69           H        LYS  69   1.265 -24.030  -6.767
    2    HA   LYS  69           HA       LYS  69   1.535 -21.413  -6.256
    3    HB2  LYS  69           HB2      LYS  69   0.117 -22.650  -8.052
    4    HB3  LYS  69           HB3      LYS  69  -1.223 -22.284  -6.960
    5    HG2  LYS  69           HG2      LYS  69  -0.687 -19.921  -6.993
    6    HG3  LYS  69           HG3      LYS  69   0.773 -20.225  -7.933
    7    HD2  LYS  69           HD2      LYS  69  -0.737 -19.566  -9.589
    8    HD3  LYS  69           HD3      LYS  69  -0.884 -21.324  -9.644
    9    HE2  LYS  69           HE2      LYS  69  -3.112 -20.262  -9.602
   10    HE3  LYS  69           HE3      LYS  69  -2.838 -21.213  -8.143
   11    HZ1  LYS  69           HZ1      LYS  69  -1.966 -18.465  -7.978
   12    HZ3  LYS  69           HZ2      LYS  69  -2.835 -19.401  -6.859
   13    HZ2  LYS  69           HZ3      LYS  69  -3.643 -18.657  -8.155

  No H/Q in entry =          13
  In of MODEL   46
    1    H    VAL  70           H        VAL  70   0.090 -19.712  -5.432
    2    HA   VAL  70           HA       VAL  70  -1.234 -20.475  -2.888
    3    HB   VAL  70           HB       VAL  70  -0.419 -18.322  -1.962
    4   HG11  VAL  70          HG11      VAL  70   0.876 -20.502  -1.768
    5   HG13  VAL  70          HG12      VAL  70   1.834 -19.035  -1.560
    6   HG12  VAL  70          HG13      VAL  70   1.893 -19.918  -3.086
    7   HG21  VAL  70          HG21      VAL  70   1.004 -18.127  -4.646
    8   HG23  VAL  70          HG22      VAL  70   1.424 -17.142  -3.246
    9   HG22  VAL  70          HG23      VAL  70  -0.171 -16.990  -3.980

  No H/Q in entry =           9
  In of MODEL   46
    1    H    SER  71           H        SER  71  -2.774 -18.795  -2.142
    2    HA   SER  71           HA       SER  71  -4.730 -18.186  -4.089
    3    HB2  SER  71           HB2      SER  71  -5.173 -18.421  -1.620
    4    HB3  SER  71           HB3      SER  71  -4.360 -16.879  -1.371
    5    HG   SER  71           HG       SER  71  -6.401 -17.054  -3.283

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU  72           H        LEU  72  -4.928 -16.549  -5.434
    2    HA   LEU  72           HA       LEU  72  -2.851 -14.703  -5.920
    3    HB2  LEU  72           HB2      LEU  72  -5.715 -14.807  -6.865
    4    HB3  LEU  72           HB3      LEU  72  -4.537 -13.632  -7.444
    5    HG   LEU  72           HG       LEU  72  -4.096 -16.634  -7.572
    6   HD13  LEU  72          HD11      LEU  72  -4.840 -16.599  -9.831
    7   HD12  LEU  72          HD12      LEU  72  -4.861 -14.835  -9.876
    8   HD11  LEU  72          HD13      LEU  72  -6.071 -15.708  -8.934
    9   HD22  LEU  72          HD21      LEU  72  -1.982 -15.650  -7.810
   10   HD21  LEU  72          HD22      LEU  72  -2.614 -14.208  -8.586
   11   HD23  LEU  72          HD23      LEU  72  -2.524 -15.720  -9.483

  No H/Q in entry =          11
  In of MODEL   46
    1    H    VAL  73           H        VAL  73  -5.950 -14.395  -4.291
    2    HA   VAL  73           HA       VAL  73  -6.043 -11.625  -3.946
    3    HB   VAL  73           HB       VAL  73  -7.752 -12.009  -2.361
    4   HG13  VAL  73          HG11      VAL  73  -9.177 -13.530  -3.532
    5   HG12  VAL  73          HG12      VAL  73  -7.806 -14.465  -4.126
    6   HG11  VAL  73          HG13      VAL  73  -8.102 -12.840  -4.748
    7   HG23  VAL  73          HG21      VAL  73  -7.988 -14.524  -1.569
    8   HG22  VAL  73          HG22      VAL  73  -6.901 -13.424  -0.721
    9   HG21  VAL  73          HG23      VAL  73  -6.256 -14.569  -1.897

  No H/Q in entry =           9
  In of MODEL   46
    1    H    LEU  74           H        LEU  74  -4.064 -13.955  -2.358
    2    HA   LEU  74           HA       LEU  74  -3.672 -12.801   0.163
    3    HB2  LEU  74           HB2      LEU  74  -2.850 -15.007  -0.335
    4    HB3  LEU  74           HB3      LEU  74  -1.804 -14.378  -1.607
    5    HG   LEU  74           HG       LEU  74  -0.526 -13.100   0.080
    6   HD11  LEU  74          HD11      LEU  74  -2.587 -14.327   1.916
    7   HD13  LEU  74          HD12      LEU  74  -2.088 -12.638   1.806
    8   HD12  LEU  74          HD13      LEU  74  -1.005 -13.833   2.518
    9   HD21  LEU  74          HD21      LEU  74  -0.288 -15.669  -0.528
   10   HD23  LEU  74          HD22      LEU  74  -0.693 -15.840   1.165
   11   HD22  LEU  74          HD23      LEU  74   0.723 -14.923   0.707

  No H/Q in entry =          11
  In of MODEL   46
    1    H    VAL  75           H        VAL  75  -1.789 -12.382  -2.796
    2    HA   VAL  75           HA       VAL  75  -0.025 -10.424  -1.791
    3    HB   VAL  75           HB       VAL  75  -0.973 -10.924  -4.614
    4   HG12  VAL  75          HG11      VAL  75   1.081  -9.595  -5.229
    5   HG11  VAL  75          HG12      VAL  75   1.271  -9.184  -3.532
    6   HG13  VAL  75          HG13      VAL  75  -0.140  -8.624  -4.414
    7   HG22  VAL  75          HG21      VAL  75   0.229 -12.812  -3.706
    8   HG21  VAL  75          HG22      VAL  75   1.446 -11.760  -2.984
    9   HG23  VAL  75          HG23      VAL  75   1.359 -11.933  -4.737

  No H/Q in entry =           9
  In of MODEL   46
    1    H    GLU  76           H        GLU  76  -3.181 -10.136  -3.448
    2    HA   GLU  76           HA       GLU  76  -3.282  -7.323  -3.555
    3    HB2  GLU  76           HB2      GLU  76  -4.917  -8.789  -4.716
    4    HB3  GLU  76           HB3      GLU  76  -5.558  -9.301  -3.163
    5    HG2  GLU  76           HG2      GLU  76  -7.044  -7.615  -4.038
    6    HG3  GLU  76           HG3      GLU  76  -6.178  -6.888  -2.699

  No H/Q in entry =           6
  In of MODEL   46
    1    H    ALA  77           H        ALA  77  -4.353  -9.564  -1.010
    2    HA   ALA  77           HA       ALA  77  -5.343  -7.575   0.745
    3    HB3  ALA  77           HB1      ALA  77  -6.008  -9.789   1.216
    4    HB2  ALA  77           HB2      ALA  77  -4.887  -9.386   2.516
    5    HB1  ALA  77           HB3      ALA  77  -4.351 -10.390   1.170

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLN  78           H        GLN  78  -2.170  -9.071   0.382
    2    HA   GLN  78           HA       GLN  78  -0.931  -7.885   2.629
    3    HB2  GLN  78           HB2      GLN  78  -0.037  -9.813   1.277
    4    HB3  GLN  78           HB3      GLN  78   0.380  -8.662   0.010
    5    HG2  GLN  78           HG2      GLN  78   1.817  -7.439   1.593
    6    HG3  GLN  78           HG3      GLN  78   1.406  -8.591   2.860
    7   HE21  GLN  78          HE21      GLN  78   4.121  -8.262   2.017
    8   HE22  GLN  78          HE22      GLN  78   4.610  -9.684   1.226

  No H/Q in entry =           8
  In of MODEL   46
    1    H    LEU  79           H        LEU  79  -1.317  -6.837  -0.720
    2    HA   LEU  79           HA       LEU  79   0.332  -4.583  -0.712
    3    HB2  LEU  79           HB2      LEU  79  -0.682  -5.411  -2.764
    4    HB3  LEU  79           HB3      LEU  79  -2.291  -5.044  -2.155
    5    HG   LEU  79           HG       LEU  79  -1.787  -2.648  -2.135
    6   HD13  LEU  79          HD11      LEU  79   0.449  -2.367  -1.624
    7   HD12  LEU  79          HD12      LEU  79   0.493  -2.082  -3.364
    8   HD11  LEU  79          HD13      LEU  79   0.973  -3.651  -2.714
    9   HD23  LEU  79          HD21      LEU  79  -1.157  -2.445  -4.688
   10   HD22  LEU  79          HD22      LEU  79  -2.671  -3.216  -4.227
   11   HD21  LEU  79          HD23      LEU  79  -1.282  -4.204  -4.670

  No H/Q in entry =          11
  In of MODEL   46
    1    H    HIS  80           H        HIS  80  -3.131  -4.800   0.116
    2    HA   HIS  80           HA       HIS  80  -3.367  -2.045   0.774
    3    HB2  HIS  80           HB2      HIS  80  -5.029  -4.481   1.099
    4    HB3  HIS  80           HB3      HIS  80  -5.371  -3.144   2.200
    5    HD1  HIS  80           HD1      HIS  80  -7.015  -1.535   1.289
    6    HD2  HIS  80           HD2      HIS  80  -4.794  -3.318  -1.755
    7    HE1  HIS  80           HE1      HIS  80  -7.871  -0.556  -0.892
    8    HE2  HIS  80           HE2      HIS  80  -6.524  -1.638  -2.757

  No H/Q in entry =           8
  In of MODEL   46
    1    H    LEU  81           H        LEU  81  -2.831  -4.928   2.773
    2    HA   LEU  81           HA       LEU  81  -2.839  -3.575   5.254
    3    HB2  LEU  81           HB2      LEU  81  -1.579  -6.174   4.380
    4    HB3  LEU  81           HB3      LEU  81  -1.561  -5.611   6.052
    5    HG   LEU  81           HG       LEU  81  -4.103  -5.907   4.426
    6   HD12  LEU  81          HD11      LEU  81  -4.373  -7.974   5.978
    7   HD11  LEU  81          HD12      LEU  81  -2.622  -7.875   6.163
    8   HD13  LEU  81          HD13      LEU  81  -3.328  -8.120   4.565
    9   HD23  LEU  81          HD21      LEU  81  -4.942  -6.118   6.928
   10   HD22  LEU  81          HD22      LEU  81  -4.643  -4.526   6.234
   11   HD21  LEU  81          HD23      LEU  81  -3.444  -5.265   7.296

  No H/Q in entry =          11
  In of MODEL   46
    1    H    MET  82           H        MET  82  -0.145  -4.441   3.084
    2    HA   MET  82           HA       MET  82   1.925  -3.511   4.765
    3    HB2  MET  82           HB2      MET  82   1.714  -3.862   1.773
    4    HB3  MET  82           HB3      MET  82   3.187  -3.267   2.535
    5    HG2  MET  82           HG2      MET  82   1.821  -5.876   3.266
    6    HG3  MET  82           HG3      MET  82   3.190  -5.748   2.165
    7    HE3  MET  82           HE1      MET  82   6.195  -4.961   4.145
    8    HE2  MET  82           HE2      MET  82   5.251  -3.610   3.524
    9    HE1  MET  82           HE3      MET  82   5.362  -5.100   2.592

  No H/Q in entry =           9
  In of MODEL   46
    1    H    THR  83           H        THR  83   0.077  -1.903   2.205
    2    HA   THR  83           HA       THR  83   1.451   0.567   2.286
    3    HB   THR  83           HB       THR  83  -0.739   1.456   1.299
    4    HG1  THR  83           HG1      THR  83  -2.370   0.134   1.196
    5   HG22  THR  83          HG21      THR  83  -0.442  -0.362  -0.698
    6   HG21  THR  83          HG22      THR  83   1.063  -0.629   0.179
    7   HG23  THR  83          HG23      THR  83   0.677   0.977  -0.440

  No H/Q in entry =           7
  In of MODEL   46
    1    H    SER  84           H        SER  84  -1.538  -0.507   3.891
    2    HA   SER  84           HA       SER  84  -2.070   1.918   5.230
    3    HB2  SER  84           HB2      SER  84  -2.860  -0.931   5.802
    4    HB3  SER  84           HB3      SER  84  -3.373   0.405   6.832
    5    HG   SER  84           HG       SER  84  -3.828   0.078   4.041

  No H/Q in entry =           5
  In of MODEL   46
    1    H    MET  85           H        MET  85  -0.316  -0.985   6.365
    2    HA   MET  85           HA       MET  85   0.192  -0.045   8.967
    3    HB2  MET  85           HB2      MET  85   0.518  -2.385   8.302
    4    HB3  MET  85           HB3      MET  85   1.887  -1.907   7.296
    5    HG2  MET  85           HG2      MET  85   3.072  -1.058   9.276
    6    HG3  MET  85           HG3      MET  85   1.691  -1.470  10.292
    7    HE1  MET  85           HE1      MET  85   4.283  -2.492   7.893
    8    HE3  MET  85           HE2      MET  85   3.313  -3.821   7.262
    9    HE2  MET  85           HE3      MET  85   4.727  -4.164   8.254

  No H/Q in entry =           9
  In of MODEL   46
    1    H    LEU  86           H        LEU  86   2.121   0.232   6.014
    2    HA   LEU  86           HA       LEU  86   4.316   1.578   7.165
    3    HB2  LEU  86           HB2      LEU  86   4.139   0.487   4.859
    4    HB3  LEU  86           HB3      LEU  86   3.309   1.955   4.344
    5    HG   LEU  86           HG       LEU  86   5.319   3.233   5.320
    6   HD11  LEU  86          HD11      LEU  86   6.063   0.634   6.125
    7   HD13  LEU  86          HD12      LEU  86   7.046   2.094   6.219
    8   HD12  LEU  86          HD13      LEU  86   7.169   1.044   4.810
    9   HD23  LEU  86          HD21      LEU  86   6.060   1.475   2.973
   10   HD22  LEU  86          HD22      LEU  86   6.429   3.179   3.231
   11   HD21  LEU  86          HD23      LEU  86   4.783   2.686   2.834

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ALA  87           H        ALA  87   1.385   2.775   5.580
    2    HA   ALA  87           HA       ALA  87   1.939   5.513   5.656
    3    HB1  ALA  87           HB1      ALA  87  -0.346   3.851   5.121
    4    HB3  ALA  87           HB2      ALA  87  -0.060   5.515   4.616
    5    HB2  ALA  87           HB3      ALA  87  -0.848   5.186   6.161

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ARG  88           H        ARG  88   0.280   3.493   8.053
    2    HA   ARG  88           HA       ARG  88  -0.260   5.540   9.895
    3    HB2  ARG  88           HB2      ARG  88  -1.164   3.174   9.967
    4    HB3  ARG  88           HB3      ARG  88   0.384   2.698  10.674
    5    HG2  ARG  88           HG2      ARG  88  -0.121   4.770  12.289
    6    HG3  ARG  88           HG3      ARG  88  -1.783   4.419  11.835
    7    HD2  ARG  88           HD2      ARG  88  -1.863   2.572  13.086
    8    HD3  ARG  88           HD3      ARG  88  -0.265   2.012  12.555
    9    HE   ARG  88           HE       ARG  88  -0.816   3.273  15.006
   10   HH21  ARG  88          HH11      ARG  88   0.728   4.311  16.241
   11   HH22  ARG  88          HH12      ARG  88   2.240   4.758  15.535
   12   HH11  ARG  88          HH21      ARG  88   1.460   3.482  12.427
   13   HH12  ARG  88          HH22      ARG  88   2.663   4.273  13.387

  No H/Q in entry =          13
  In of MODEL   46
    1    H    GLU  89           H        GLU  89   2.569   3.362   9.675
    2    HA   GLU  89           HA       GLU  89   3.818   4.275  12.016
    3    HB2  GLU  89           HB2      GLU  89   4.506   2.263  10.677
    4    HB3  GLU  89           HB3      GLU  89   5.265   3.366   9.527
    5    HG2  GLU  89           HG2      GLU  89   6.738   4.239  11.268
    6    HG3  GLU  89           HG3      GLU  89   5.919   3.274  12.491

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LEU  90           H        LEU  90   4.116   5.429   8.685
    2    HA   LEU  90           HA       LEU  90   6.016   7.460   9.264
    3    HB2  LEU  90           HB2      LEU  90   4.014   7.092   7.039
    4    HB3  LEU  90           HB3      LEU  90   5.225   8.381   7.056
    5    HG   LEU  90           HG       LEU  90   5.944   5.456   7.397
    6   HD12  LEU  90          HD11      LEU  90   6.687   5.694   4.956
    7   HD11  LEU  90          HD12      LEU  90   5.650   7.119   4.904
    8   HD13  LEU  90          HD13      LEU  90   4.954   5.536   5.252
    9   HD22  LEU  90          HD21      LEU  90   7.824   6.636   8.075
   10   HD21  LEU  90          HD22      LEU  90   7.452   8.033   7.064
   11   HD23  LEU  90          HD23      LEU  90   8.133   6.577   6.341

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  91           H        ILE  91   2.477   7.420   9.117
    2    HA   ILE  91           HA       ILE  91   2.093  10.188   9.561
    3    HB   ILE  91           HB       ILE  91   0.339   7.787  10.111
    4   HG12  ILE  91          HG12      ILE  91   0.054  10.059   8.120
    5   HG13  ILE  91          HG13      ILE  91   0.937   8.577   7.751
    6   HG22  ILE  91          HG21      ILE  91  -1.425   9.818  10.170
    7   HG21  ILE  91          HG22      ILE  91  -0.037  10.672  10.839
    8   HG23  ILE  91          HG23      ILE  91  -0.650   9.227  11.640
    9   HD13  ILE  91          HD11      ILE  91  -0.987   7.259   7.800
   10   HD12  ILE  91          HD12      ILE  91  -1.600   8.763   7.115
   11   HD11  ILE  91          HD13      ILE  91  -1.865   8.399   8.820

  No H/Q in entry =          11
  In of MODEL   46
    1    H    THR  92           H        THR  92   2.540   7.460  11.769
    2    HA   THR  92           HA       THR  92   2.076   8.833  14.189
    3    HB   THR  92           HB       THR  92   3.921   6.525  13.530
    4    HG1  THR  92           HG1      THR  92   1.965   5.736  13.433
    5   HG22  THR  92          HG21      THR  92   3.544   6.242  16.165
    6   HG21  THR  92          HG22      THR  92   3.451   8.000  16.087
    7   HG23  THR  92          HG23      THR  92   4.897   7.166  15.516

  No H/Q in entry =           7
  In of MODEL   46
    1    H    GLU  93           H        GLU  93   5.033   8.426  12.256
    2    HA   GLU  93           HA       GLU  93   6.764   9.886  13.948
    3    HB2  GLU  93           HB2      GLU  93   6.856   9.565  10.934
    4    HB3  GLU  93           HB3      GLU  93   8.188  10.119  11.946
    5    HG2  GLU  93           HG2      GLU  93   6.823   7.461  12.402
    6    HG3  GLU  93           HG3      GLU  93   8.203   7.633  11.325

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LEU  94           H        LEU  94   4.698  10.860  11.233
    2    HA   LEU  94           HA       LEU  94   5.458  13.576  11.125
    3    HB2  LEU  94           HB2      LEU  94   2.890  12.166  10.376
    4    HB3  LEU  94           HB3      LEU  94   3.120  13.897  10.129
    5    HG   LEU  94           HG       LEU  94   5.170  11.940   9.084
    6   HD11  LEU  94          HD11      LEU  94   2.419  12.441   8.021
    7   HD13  LEU  94          HD12      LEU  94   3.427  11.001   7.899
    8   HD12  LEU  94          HD13      LEU  94   3.738  12.384   6.851
    9   HD23  LEU  94          HD21      LEU  94   5.389  13.775   7.356
   10   HD22  LEU  94          HD22      LEU  94   5.795  14.279   8.996
   11   HD21  LEU  94          HD23      LEU  94   4.237  14.719   8.297

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  95           H        ILE  95   2.948  11.922  13.021
    2    HA   ILE  95           HA       ILE  95   1.866  14.257  14.210
    3    HB   ILE  95           HB       ILE  95   1.932  11.379  15.143
    4   HG12  ILE  95          HG12      ILE  95  -0.319  13.111  14.089
    5   HG13  ILE  95          HG13      ILE  95   0.656  12.065  13.060
    6   HG21  ILE  95          HG21      ILE  95   0.608  13.832  16.337
    7   HG23  ILE  95          HG22      ILE  95   1.676  12.684  17.145
    8   HG22  ILE  95          HG23      ILE  95   0.049  12.194  16.672
    9   HD13  ILE  95          HD11      ILE  95  -0.213  10.114  13.985
   10   HD12  ILE  95          HD12      ILE  95  -1.614  11.179  14.058
   11   HD11  ILE  95          HD13      ILE  95  -0.644  10.902  15.504

  No H/Q in entry =          11
  In of MODEL   46
    1    H    GLU  96           H        GLU  96   4.499  12.087  15.211
    2    HA   GLU  96           HA       GLU  96   5.033  13.303  17.699
    3    HB2  GLU  96           HB2      GLU  96   6.019  11.159  17.058
    4    HB3  GLU  96           HB3      GLU  96   6.939  11.944  15.776
    5    HG2  GLU  96           HG2      GLU  96   8.577  12.526  17.236
    6    HG3  GLU  96           HG3      GLU  96   7.416  13.322  18.289

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LEU  97           H        LEU  97   6.094  14.084  14.411
    2    HA   LEU  97           HA       LEU  97   7.944  16.115  15.117
    3    HB2  LEU  97           HB2      LEU  97   6.362  15.530  12.623
    4    HB3  LEU  97           HB3      LEU  97   7.356  16.980  12.741
    5    HG   LEU  97           HG       LEU  97   8.435  14.203  13.309
    6   HD12  LEU  97          HD11      LEU  97   9.428  14.408  10.991
    7   HD11  LEU  97          HD12      LEU  97   8.352  15.779  10.723
    8   HD13  LEU  97          HD13      LEU  97   7.681  14.175  11.023
    9   HD23  LEU  97          HD21      LEU  97  10.581  15.519  12.562
   10   HD22  LEU  97          HD22      LEU  97   9.957  15.782  14.190
   11   HD21  LEU  97          HD23      LEU  97   9.621  16.955  12.918

  No H/Q in entry =          11
  In of MODEL   46
    1    H    HIS  98           H        HIS  98   4.450  16.185  14.462
    2    HA   HIS  98           HA       HIS  98   4.100  18.979  14.589
    3    HB2  HIS  98           HB2      HIS  98   2.252  16.697  15.322
    4    HB3  HIS  98           HB3      HIS  98   1.754  18.389  15.372
    5    HD1  HIS  98           HD1      HIS  98   2.825  15.686  12.976
    6    HD2  HIS  98           HD2      HIS  98   1.377  19.593  12.842
    7    HE1  HIS  98           HE1      HIS  98   2.256  16.157  10.550
    8    HE2  HIS  98           HE2      HIS  98   1.378  18.530  10.448

  No H/Q in entry =           8
  In of MODEL   46
    1    H    GLU  99           H        GLU  99   4.279  16.501  17.095
    2    HA   GLU  99           HA       GLU  99   3.640  18.191  19.288
    3    HB2  GLU  99           HB2      GLU  99   3.597  15.708  19.393
    4    HB3  GLU  99           HB3      GLU  99   5.357  15.695  19.285
    5    HG2  GLU  99           HG2      GLU  99   5.522  16.997  21.355
    6    HG3  GLU  99           HG3      GLU  99   3.767  17.106  21.450

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LYS 100           H        LYS 100   6.710  17.312  17.726
    2    HA   LYS 100           HA       LYS 100   8.339  18.748  19.578
    3    HB2  LYS 100           HB2      LYS 100   8.855  17.825  16.742
    4    HB3  LYS 100           HB3      LYS 100  10.070  18.620  17.748
    5    HG2  LYS 100           HG2      LYS 100   9.726  16.868  19.494
    6    HG3  LYS 100           HG3      LYS 100   8.609  16.040  18.406
    7    HD2  LYS 100           HD2      LYS 100  10.408  15.785  16.739
    8    HD3  LYS 100           HD3      LYS 100  11.530  16.625  17.813
    9    HE2  LYS 100           HE2      LYS 100  11.166  14.868  19.536
   10    HE3  LYS 100           HE3      LYS 100  10.107  14.009  18.414
   11    HZ1  LYS 100           HZ1      LYS 100  12.914  14.728  17.756
   12    HZ3  LYS 100           HZ2      LYS 100  11.890  13.652  16.931
   13    HZ2  LYS 100           HZ3      LYS 100  12.486  13.248  18.471

  No H/Q in entry =          13
  In of MODEL   46
    1    H    LEU 101           H        LEU 101   6.629  19.635  16.620
    2    HA   LEU 101           HA       LEU 101   7.796  22.213  16.278
    3    HB2  LEU 101           HB2      LEU 101   5.223  20.929  15.395
    4    HB3  LEU 101           HB3      LEU 101   5.443  22.664  15.182
    5    HG   LEU 101           HG       LEU 101   7.515  20.682  14.222
    6   HD12  LEU 101          HD11      LEU 101   6.353  21.160  11.936
    7   HD11  LEU 101          HD12      LEU 101   4.946  21.568  12.915
    8   HD13  LEU 101          HD13      LEU 101   5.640  19.950  13.002
    9   HD21  LEU 101          HD21      LEU 101   6.834  23.581  13.658
   10   HD23  LEU 101          HD22      LEU 101   7.832  22.636  12.554
   11   HD22  LEU 101          HD23      LEU 101   8.369  22.908  14.211

  No H/Q in entry =          11
  In of MODEL   46
    1    H    LYS 102           H        LYS 102   6.280  21.055  18.897
    2    HA   LYS 102           HA       LYS 102   5.628  22.140  20.826
    3    HB2  LYS 102           HB2      LYS 102   6.874  24.150  19.695
    4    HB3  LYS 102           HB3      LYS 102   5.264  24.725  19.318
    5    HG2  LYS 102           HG2      LYS 102   6.646  24.502  21.971
    6    HG3  LYS 102           HG3      LYS 102   5.670  25.811  21.338
    7    HD2  LYS 102           HD2      LYS 102   4.474  23.155  22.225
    8    HD3  LYS 102           HD3      LYS 102   4.698  24.524  23.304
    9    HE2  LYS 102           HE2      LYS 102   2.426  24.075  21.817
   10    HE3  LYS 102           HE3      LYS 102   2.901  25.632  22.494
   11    HZ2  LYS 102           HZ1      LYS 102   2.368  25.723  20.114
   12    HZ1  LYS 102           HZ2      LYS 102   3.649  24.663  19.794
   13    HZ3  LYS 102           HZ3      LYS 102   3.965  26.202  20.433

  No H/Q in entry =          13
  In of MODEL   46
    1    H    ALA 103           H        ALA 103   3.962  23.646  18.054
    2    HA   ALA 103           HA       ALA 103   1.498  24.180  18.938
    3    HB1  ALA 103           HB1      ALA 103   0.615  23.316  16.698
    4    HB2  ALA 103           HB2      ALA 103   2.271  22.808  16.370
    5    HB3  ALA 103           HB3      ALA 103   1.906  24.515  16.631

  No H/Q in entry =           5
  In of MODEL   46
    1    H1   ALA   1           H3       ALA   1  10.889 -20.230  -6.212
    2    H2   ALA   1           H2       ALA   1   9.929 -20.457  -7.597
    3    H3   ALA   1           H1       ALA   1   9.505 -21.206  -6.132
    4    HA   ALA   1           HA       ALA   1  10.575 -22.999  -6.866
    5    HB1  ALA   1           HB1      ALA   1  10.664 -22.645  -9.143
    6    HB2  ALA   1           HB2      ALA   1  12.388 -22.463  -8.815
    7    HB3  ALA   1           HB3      ALA   1  11.365 -21.034  -8.970

  No H/Q in entry =           7
  In of MODEL   46
    1    H    GLU   2           H        GLU   2  12.875 -23.910  -6.923
    2    HA   GLU   2           HA       GLU   2  14.256 -23.799  -4.712
    3    HB2  GLU   2           HB2      GLU   2  15.608 -23.651  -7.412
    4    HB3  GLU   2           HB3      GLU   2  16.347 -24.246  -5.925
    5    HG2  GLU   2           HG2      GLU   2  15.365 -26.280  -6.160
    6    HG3  GLU   2           HG3      GLU   2  13.782 -25.562  -6.420

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLU   3           H        GLU   3  15.994 -21.911  -7.119
    2    HA   GLU   3           HA       GLU   3  17.119 -20.199  -5.164
    3    HB2  GLU   3           HB2      GLU   3  17.062 -20.206  -8.174
    4    HB3  GLU   3           HB3      GLU   3  17.785 -18.862  -7.291
    5    HG2  GLU   3           HG2      GLU   3  19.471 -20.205  -6.366
    6    HG3  GLU   3           HG3      GLU   3  18.550 -21.688  -6.582

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LEU   4           H        LEU   4  14.821 -19.397  -7.796
    2    HA   LEU   4           HA       LEU   4  14.311 -16.795  -7.192
    3    HB2  LEU   4           HB2      LEU   4  12.169 -18.808  -7.916
    4    HB3  LEU   4           HB3      LEU   4  12.065 -17.061  -8.119
    5    HG   LEU   4           HG       LEU   4  14.060 -18.895  -9.488
    6   HD13  LEU   4          HD11      LEU   4  12.755 -18.773 -11.398
    7   HD12  LEU   4          HD12      LEU   4  12.021 -17.239 -10.934
    8   HD11  LEU   4          HD13      LEU   4  11.493 -18.737 -10.169
    9   HD23  LEU   4          HD21      LEU   4  14.357 -16.648 -10.846
   10   HD22  LEU   4          HD22      LEU   4  15.222 -16.871  -9.326
   11   HD21  LEU   4          HD23      LEU   4  13.752 -15.900  -9.367

  No H/Q in entry =          11
  In of MODEL   46
    1    H    GLU   5           H        GLU   5  12.874 -19.599  -5.541
    2    HA   GLU   5           HA       GLU   5  11.171 -18.052  -3.842
    3    HB2  GLU   5           HB2      GLU   5  10.794 -20.442  -4.361
    4    HB3  GLU   5           HB3      GLU   5  12.228 -20.846  -3.416
    5    HG2  GLU   5           HG2      GLU   5  11.226 -19.828  -1.422
    6    HG3  GLU   5           HG3      GLU   5   9.803 -19.370  -2.357

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLU   6           H        GLU   6  14.344 -19.576  -3.397
    2    HA   GLU   6           HA       GLU   6  14.684 -18.707  -0.701
    3    HB2  GLU   6           HB2      GLU   6  15.945 -20.552  -2.123
    4    HB3  GLU   6           HB3      GLU   6  17.025 -19.206  -2.492
    5    HG2  GLU   6           HG2      GLU   6  16.222 -20.020   0.314
    6    HG3  GLU   6           HG3      GLU   6  17.726 -20.509  -0.469

  No H/Q in entry =           6
  In of MODEL   46
    1    H    VAL   7           H        VAL   7  15.425 -17.376  -3.855
    2    HA   VAL   7           HA       VAL   7  17.074 -15.218  -2.997
    3    HB   VAL   7           HB       VAL   7  15.374 -15.618  -5.472
    4   HG11  VAL   7          HG11      VAL   7  17.229 -13.370  -4.667
    5   HG13  VAL   7          HG12      VAL   7  15.584 -13.257  -5.290
    6   HG12  VAL   7          HG13      VAL   7  16.901 -13.740  -6.359
    7   HG21  VAL   7          HG21      VAL   7  17.506 -17.036  -4.900
    8   HG23  VAL   7          HG22      VAL   7  18.385 -15.560  -5.303
    9   HG22  VAL   7          HG23      VAL   7  17.361 -16.331  -6.512

  No H/Q in entry =           9
  In of MODEL   46
    1    H    VAL   8           H        VAL   8  13.587 -15.550  -3.551
    2    HA   VAL   8           HA       VAL   8  12.874 -12.853  -3.086
    3    HB   VAL   8           HB       VAL   8  11.306 -15.407  -2.641
    4   HG12  VAL   8          HG11      VAL   8   9.337 -13.750  -2.811
    5   HG11  VAL   8          HG12      VAL   8  10.522 -12.492  -2.464
    6   HG13  VAL   8          HG13      VAL   8  10.233 -13.777  -1.293
    7   HG22  VAL   8          HG21      VAL   8  10.695 -15.272  -4.864
    8   HG21  VAL   8          HG22      VAL   8  12.173 -14.327  -5.013
    9   HG23  VAL   8          HG23      VAL   8  10.624 -13.511  -4.836

  No H/Q in entry =           9
  In of MODEL   46
    1    H    MET   9           H        MET   9  13.191 -15.647  -0.899
    2    HA   MET   9           HA       MET   9  12.355 -14.384   1.469
    3    HB2  MET   9           HB2      MET   9  14.252 -16.650   0.899
    4    HB3  MET   9           HB3      MET   9  14.050 -16.043   2.544
    5    HG2  MET   9           HG2      MET   9  11.516 -16.309   2.134
    6    HG3  MET   9           HG3      MET   9  11.976 -17.291   0.743
    7    HE3  MET   9           HE1      MET   9  13.477 -20.413   1.970
    8    HE2  MET   9           HE2      MET   9  14.480 -19.035   1.523
    9    HE1  MET   9           HE3      MET   9  12.977 -19.340   0.656

  No H/Q in entry =           9
  In of MODEL   46
    1    H    GLY  10           H        GLY  10  15.538 -14.555  -0.089
    2    HA3  GLY  10           HA2      GLY  10  16.972 -13.103   1.876
    3    HA2  GLY  10           HA3      GLY  10  17.438 -13.264   0.183

  No H/Q in entry =           3
  In of MODEL   46
    1    H    LEU  11           H        LEU  11  15.247 -12.086  -1.059
    2    HA   LEU  11           HA       LEU  11  15.881  -9.329  -0.903
    3    HB2  LEU  11           HB2      LEU  11  13.539 -10.785  -2.133
    4    HB3  LEU  11           HB3      LEU  11  13.788  -9.046  -2.298
    5    HG   LEU  11           HG       LEU  11  15.853 -11.119  -3.081
    6   HD13  LEU  11          HD11      LEU  11  14.114 -11.523  -4.599
    7   HD12  LEU  11          HD12      LEU  11  15.094 -10.325  -5.443
    8   HD11  LEU  11          HD13      LEU  11  13.612  -9.832  -4.625
    9   HD22  LEU  11          HD21      LEU  11  17.048  -9.133  -2.861
   10   HD21  LEU  11          HD22      LEU  11  15.654  -8.123  -3.242
   11   HD23  LEU  11          HD23      LEU  11  16.501  -8.979  -4.529

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  12           H        ILE  12  13.148 -11.203   0.370
    2    HA   ILE  12           HA       ILE  12  11.713  -9.003   1.425
    3    HB   ILE  12           HB       ILE  12  11.805 -11.881   2.382
    4   HG12  ILE  12          HG12      ILE  12  11.104 -11.266  -0.067
    5   HG13  ILE  12          HG13      ILE  12  10.102 -12.375   0.847
    6   HG21  ILE  12          HG21      ILE  12   9.833  -9.641   2.939
    7   HG23  ILE  12          HG22      ILE  12  10.828 -10.497   4.116
    8   HG22  ILE  12          HG23      ILE  12   9.515 -11.338   3.293
    9   HD11  ILE  12          HD11      ILE  12   9.613  -9.394   0.622
   10   HD13  ILE  12          HD12      ILE  12   8.543 -10.589   1.352
   11   HD12  ILE  12          HD13      ILE  12   8.824 -10.604  -0.375

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  13           H        ILE  13  14.148 -11.157   2.835
    2    HA   ILE  13           HA       ILE  13  14.162  -9.970   5.413
    3    HB   ILE  13           HB       ILE  13  16.256 -11.503   3.851
    4   HG12  ILE  13          HG12      ILE  13  14.003 -12.524   4.672
    5   HG13  ILE  13          HG13      ILE  13  15.495 -13.408   4.970
    6   HG22  ILE  13          HG21      ILE  13  17.229 -11.843   6.251
    7   HG21  ILE  13          HG22      ILE  13  16.365 -10.363   6.644
    8   HG23  ILE  13          HG23      ILE  13  17.609 -10.351   5.394
    9   HD11  ILE  13          HD11      ILE  13  14.539 -11.472   7.063
   10   HD13  ILE  13          HD12      ILE  13  15.471 -12.954   7.246
   11   HD12  ILE  13          HD13      ILE  13  13.744 -13.038   6.922

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ASN  14           H        ASN  14  16.104  -9.409   2.492
    2    HA   ASN  14           HA       ASN  14  17.809  -7.429   3.548
    3    HB2  ASN  14           HB2      ASN  14  17.811  -8.702   1.235
    4    HB3  ASN  14           HB3      ASN  14  16.889  -7.305   0.695
    5   HD21  ASN  14          HD21      ASN  14  19.336  -7.598  -0.491
    6   HD22  ASN  14          HD22      ASN  14  20.457  -6.490   0.133

  No H/Q in entry =           6
  In of MODEL   46
    1    H    SER  15           H        SER  15  14.691  -7.151   1.855
    2    HA   SER  15           HA       SER  15  14.520  -4.333   1.904
    3    HB2  SER  15           HB2      SER  15  12.191  -4.630   1.414
    4    HB3  SER  15           HB3      SER  15  13.018  -5.976   0.640
    5    HG   SER  15           HG       SER  15  12.195  -7.328   2.062

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLY  16           H        GLY  16  13.479  -6.809   4.215
    2    HA3  GLY  16           HA2      GLY  16  12.221  -5.081   6.067
    3    HA2  GLY  16           HA3      GLY  16  12.870  -6.675   6.434

  No H/Q in entry =           3
  In of MODEL   46
    1    H    GLN  17           H        GLN  17  15.574  -6.286   5.840
    2    HA   GLN  17           HA       GLN  17  16.504  -5.039   8.217
    3    HB2  GLN  17           HB2      GLN  17  17.764  -6.811   7.013
    4    HB3  GLN  17           HB3      GLN  17  18.065  -5.677   5.695
    5    HG2  GLN  17           HG2      GLN  17  20.001  -5.716   7.178
    6    HG3  GLN  17           HG3      GLN  17  19.197  -4.153   7.310
    7   HE21  GLN  17          HE21      GLN  17  20.041  -7.071   9.054
    8   HE22  GLN  17          HE22      GLN  17  19.393  -6.592  10.547

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ALA  18           H        ALA  18  16.292  -3.974   4.854
    2    HA   ALA  18           HA       ALA  18  17.677  -1.551   5.074
    3    HB2  ALA  18           HB1      ALA  18  16.585  -2.795   3.010
    4    HB3  ALA  18           HB2      ALA  18  16.812  -1.047   2.990
    5    HB1  ALA  18           HB3      ALA  18  15.227  -1.726   3.361

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ARG  19           H        ARG  19  14.190  -2.213   5.473
    2    HA   ARG  19           HA       ARG  19  13.465   0.424   6.180
    3    HB2  ARG  19           HB2      ARG  19  11.822  -1.365   5.599
    4    HB3  ARG  19           HB3      ARG  19  12.181  -2.151   7.138
    5    HG2  ARG  19           HG2      ARG  19  11.428  -0.172   8.372
    6    HG3  ARG  19           HG3      ARG  19  11.159   0.694   6.861
    7    HD2  ARG  19           HD2      ARG  19   9.035  -0.146   7.683
    8    HD3  ARG  19           HD3      ARG  19   9.473  -1.020   6.209
    9    HE   ARG  19           HE       ARG  19  10.465  -2.536   8.319
   10   HH21  ARG  19          HH11      ARG  19   9.251  -4.200   9.262
   11   HH22  ARG  19          HH12      ARG  19   7.531  -4.210   9.092
   12   HH11  ARG  19          HH21      ARG  19   7.443  -1.311   7.220
   13   HH12  ARG  19          HH22      ARG  19   6.508  -2.575   7.931

  No H/Q in entry =          13
  In of MODEL   46
    1    H    SER  20           H        SER  20  14.384  -2.382   8.148
    2    HA   SER  20           HA       SER  20  14.077  -1.281  10.682
    3    HB2  SER  20           HB2      SER  20  14.593  -3.596  10.568
    4    HB3  SER  20           HB3      SER  20  16.039  -3.305   9.603
    5    HG   SER  20           HG       SER  20  17.078  -2.576  11.363

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU  21           H        LEU  21  16.918  -1.164   8.546
    2    HA   LEU  21           HA       LEU  21  18.560   0.362  10.280
    3    HB2  LEU  21           HB2      LEU  21  18.545   0.082   7.267
    4    HB3  LEU  21           HB3      LEU  21  19.780   0.972   8.153
    5    HG   LEU  21           HG       LEU  21  19.103  -1.933   8.701
    6   HD11  LEU  21          HD11      LEU  21  19.960  -1.617   6.390
    7   HD13  LEU  21          HD12      LEU  21  21.109  -2.491   7.403
    8   HD12  LEU  21          HD13      LEU  21  21.372  -0.786   7.045
    9   HD21  LEU  21          HD21      LEU  21  21.193   0.006   9.678
   10   HD23  LEU  21          HD22      LEU  21  21.588  -1.707   9.613
   11   HD22  LEU  21          HD23      LEU  21  20.252  -1.154  10.609

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ALA  22           H        ALA  22  16.276   1.275   7.721
    2    HA   ALA  22           HA       ALA  22  16.755   4.045   7.728
    3    HB3  ALA  22           HB1      ALA  22  15.380   2.768   6.052
    4    HB2  ALA  22           HB2      ALA  22  14.640   4.266   6.615
    5    HB1  ALA  22           HB3      ALA  22  14.083   2.716   7.247

  No H/Q in entry =           5
  In of MODEL   46
    1    H    TYR  23           H        TYR  23  14.297   2.180   9.567
    2    HA   TYR  23           HA       TYR  23  13.287   4.400  11.010
    3    HB2  TYR  23           HB2      TYR  23  12.098   2.259  10.994
    4    HB3  TYR  23           HB3      TYR  23  13.446   1.481  11.823
    5    HD1  TYR  23           HD1      TYR  23  10.862   4.147  12.173
    6    HD2  TYR  23           HD2      TYR  23  13.658   1.578  14.181
    7    HE1  TYR  23           HE1      TYR  23   9.915   4.828  14.364
    8    HE2  TYR  23           HE2      TYR  23  12.712   2.258  16.370
    9    HH   TYR  23           HH       TYR  23   9.893   3.505  16.845

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ALA  24           H        ALA  24  15.980   2.183  11.654
    2    HA   ALA  24           HA       ALA  24  16.628   3.199  14.215
    3    HB1  ALA  24           HB1      ALA  24  18.022   1.435  14.055
    4    HB3  ALA  24           HB2      ALA  24  19.030   2.375  12.954
    5    HB2  ALA  24           HB3      ALA  24  17.757   1.338  12.315

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA  25           H        ALA  25  17.566   4.140  10.934
    2    HA   ALA  25           HA       ALA  25  19.470   6.116  11.574
    3    HB1  ALA  25           HB1      ALA  25  18.774   5.147   9.261
    4    HB3  ALA  25           HB2      ALA  25  19.240   6.845   9.350
    5    HB2  ALA  25           HB3      ALA  25  17.534   6.402   9.282

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU  26           H        LEU  26  15.951   6.271  11.212
    2    HA   LEU  26           HA       LEU  26  15.669   9.048  11.655
    3    HB2  LEU  26           HB2      LEU  26  13.834   7.772  10.730
    4    HB3  LEU  26           HB3      LEU  26  13.764   6.746  12.158
    5    HG   LEU  26           HG       LEU  26  13.117   8.695  13.533
    6   HD12  LEU  26          HD11      LEU  26  12.413  10.778  12.202
    7   HD11  LEU  26          HD12      LEU  26  13.408  10.142  10.895
    8   HD13  LEU  26          HD13      LEU  26  14.144  10.546  12.446
    9   HD21  LEU  26          HD21      LEU  26  11.449   8.340  11.024
   10   HD23  LEU  26          HD22      LEU  26  10.874   9.030  12.539
   11   HD22  LEU  26          HD23      LEU  26  11.361   7.339  12.473

  No H/Q in entry =          11
  In of MODEL   46
    1    H    LYS  27           H        LYS  27  15.617   6.273  13.856
    2    HA   LYS  27           HA       LYS  27  14.996   7.633  16.220
    3    HB2  LYS  27           HB2      LYS  27  15.075   5.158  15.962
    4    HB3  LYS  27           HB3      LYS  27  16.837   5.246  15.919
    5    HG2  LYS  27           HG2      LYS  27  16.866   6.239  18.166
    6    HG3  LYS  27           HG3      LYS  27  15.099   6.221  18.211
    7    HD2  LYS  27           HD2      LYS  27  15.124   3.754  17.980
    8    HD3  LYS  27           HD3      LYS  27  16.889   3.779  17.969
    9    HE2  LYS  27           HE2      LYS  27  16.902   4.774  20.223
   10    HE3  LYS  27           HE3      LYS  27  15.136   4.779  20.237
   11    HZ3  LYS  27           HZ1      LYS  27  15.963   2.846  21.393
   12    HZ2  LYS  27           HZ2      LYS  27  16.889   2.382  20.044
   13    HZ1  LYS  27           HZ3      LYS  27  15.191   2.353  19.964

  No H/Q in entry =          13
  In of MODEL   46
    1    H    GLN  28           H        GLN  28  18.124   7.109  14.630
    2    HA   GLN  28           HA       GLN  28  19.786   8.230  16.618
    3    HB2  GLN  28           HB2      GLN  28  20.077   8.189  13.603
    4    HB3  GLN  28           HB3      GLN  28  21.354   8.678  14.716
    5    HG2  GLN  28           HG2      GLN  28  19.975   5.980  14.763
    6    HG3  GLN  28           HG3      GLN  28  21.547   6.288  14.026
    7   HE21  GLN  28          HE21      GLN  28  20.344   4.933  16.727
    8   HE22  GLN  28          HE22      GLN  28  21.526   5.384  17.857

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ALA  29           H        ALA  29  18.006   9.672  13.922
    2    HA   ALA  29           HA       ALA  29  18.954  12.312  14.168
    3    HB2  ALA  29           HB1      ALA  29  17.244  12.912  12.695
    4    HB1  ALA  29           HB2      ALA  29  16.123  11.719  13.349
    5    HB3  ALA  29           HB3      ALA  29  17.463  11.199  12.327

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LYS  30           H        LYS  30  16.209  10.664  15.693
    2    HA   LYS  30           HA       LYS  30  15.151  12.901  17.044
    3    HB2  LYS  30           HB2      LYS  30  15.095   9.960  17.755
    4    HB3  LYS  30           HB3      LYS  30  14.206  11.196  18.646
    5    HG2  LYS  30           HG2      LYS  30  13.069  11.855  16.525
    6    HG3  LYS  30           HG3      LYS  30  13.898  10.532  15.702
    7    HD2  LYS  30           HD2      LYS  30  12.856   8.909  17.234
    8    HD3  LYS  30           HD3      LYS  30  12.037  10.222  18.082
    9    HE2  LYS  30           HE2      LYS  30  10.858  10.827  15.987
   10    HE3  LYS  30           HE3      LYS  30  11.657   9.486  15.160
   11    HZ2  LYS  30           HZ1      LYS  30   9.357   9.036  16.041
   12    HZ1  LYS  30           HZ2      LYS  30  10.023   9.105  17.608
   13    HZ3  LYS  30           HZ3      LYS  30  10.553   7.927  16.501

  No H/Q in entry =          13
  In of MODEL   46
    1    H    GLN  31           H        GLN  31  17.852  10.783  17.787
    2    HA   GLN  31           HA       GLN  31  18.160  11.810  20.479
    3    HB2  GLN  31           HB2      GLN  31  20.212  10.273  18.878
    4    HB3  GLN  31           HB3      GLN  31  20.075  10.399  20.632
    5    HG2  GLN  31           HG2      GLN  31  17.580   9.399  19.866
    6    HG3  GLN  31           HG3      GLN  31  18.697   8.572  18.788
    7   HE21  GLN  31          HE21      GLN  31  17.175   7.403  21.067
    8   HE22  GLN  31          HE22      GLN  31  18.343   6.767  22.119

  No H/Q in entry =           8
  In of MODEL   46
    1    H    GLY  32           H        GLY  32  18.655  13.129  17.509
    2    HA3  GLY  32           HA2      GLY  32  19.602  15.191  16.990
    3    HA2  GLY  32           HA3      GLY  32  20.359  15.214  18.578

  No H/Q in entry =           3
  In of MODEL   46
    1    H    ASP  33           H        ASP  33  20.835  12.325  16.808
    2    HA   ASP  33           HA       ASP  33  23.647  13.051  16.340
    3    HB2  ASP  33           HB2      ASP  33  22.187  10.408  16.463
    4    HB3  ASP  33           HB3      ASP  33  23.871  10.555  15.968

  No H/Q in entry =           4
  In of MODEL   46
    1    H    PHE  34           H        PHE  34  23.141  14.361  14.456
    2    HA   PHE  34           HA       PHE  34  21.811  13.346  12.171
    3    HB2  PHE  34           HB2      PHE  34  23.902  15.520  12.396
    4    HB3  PHE  34           HB3      PHE  34  22.923  15.208  10.965
    5    HD1  PHE  34           HD1      PHE  34  23.137  17.154  13.873
    6    HD2  PHE  34           HD2      PHE  34  20.300  14.979  11.493
    7    HE1  PHE  34           HE1      PHE  34  21.295  18.520  14.817
    8    HE2  PHE  34           HE2      PHE  34  18.461  16.345  12.439
    9    HZ   PHE  34           HZ       PHE  34  18.962  18.116  14.097

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ALA  35           H        ALA  35  25.188  13.224  13.179
    2    HA   ALA  35           HA       ALA  35  26.309  12.418  10.725
    3    HB3  ALA  35           HB1      ALA  35  28.011  11.284  12.447
    4    HB2  ALA  35           HB2      ALA  35  27.128  12.296  13.590
    5    HB1  ALA  35           HB3      ALA  35  27.951  13.032  12.216

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA  36           H        ALA  36  25.231  10.448  13.495
    2    HA   ALA  36           HA       ALA  36  25.762   7.967  12.225
    3    HB2  ALA  36           HB1      ALA  36  25.345   7.218  14.303
    4    HB3  ALA  36           HB2      ALA  36  23.648   7.680  14.151
    5    HB1  ALA  36           HB3      ALA  36  24.827   8.836  14.771

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA  37           H        ALA  37  22.900  10.039  12.354
    2    HA   ALA  37           HA       ALA  37  21.079   8.231  11.182
    3    HB3  ALA  37           HB1      ALA  37  21.247  11.198  11.467
    4    HB1  ALA  37           HB2      ALA  37  19.956  10.096  11.942
    5    HB2  ALA  37           HB3      ALA  37  20.136  10.567  10.251

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LYS  38           H        LYS  38  23.130  10.729   9.697
    2    HA   LYS  38           HA       LYS  38  22.499  10.282   7.021
    3    HB2  LYS  38           HB2      LYS  38  24.278  11.878   8.462
    4    HB3  LYS  38           HB3      LYS  38  25.330  10.906   7.439
    5    HG2  LYS  38           HG2      LYS  38  24.151  11.649   5.441
    6    HG3  LYS  38           HG3      LYS  38  22.940  12.482   6.420
    7    HD2  LYS  38           HD2      LYS  38  24.503  14.114   7.168
    8    HD3  LYS  38           HD3      LYS  38  25.882  13.154   6.635
    9    HE2  LYS  38           HE2      LYS  38  25.488  15.013   5.079
   10    HE3  LYS  38           HE3      LYS  38  25.184  13.468   4.279
   11    HZ3  LYS  38           HZ1      LYS  38  22.979  13.868   4.147
   12    HZ2  LYS  38           HZ2      LYS  38  23.469  15.493   4.231
   13    HZ1  LYS  38           HZ3      LYS  38  22.911  14.702   5.625

  No H/Q in entry =          13
  In of MODEL   46
    1    H    ALA  39           H        ALA  39  25.044   8.740   8.981
    2    HA   ALA  39           HA       ALA  39  26.146   7.168   6.916
    3    HB2  ALA  39           HB1      ALA  39  26.076   6.210   9.762
    4    HB1  ALA  39           HB2      ALA  39  27.000   7.653   9.342
    5    HB3  ALA  39           HB3      ALA  39  27.383   6.108   8.582

  No H/Q in entry =           5
  In of MODEL   46
    1    H    MET  40           H        MET  40  23.545   6.505   9.215
    2    HA   MET  40           HA       MET  40  23.157   3.790   8.488
    3    HB2  MET  40           HB2      MET  40  21.300   5.799   9.775
    4    HB3  MET  40           HB3      MET  40  20.928   4.082   9.604
    5    HG2  MET  40           HG2      MET  40  23.458   5.078  10.943
    6    HG3  MET  40           HG3      MET  40  21.969   4.774  11.837
    7    HE3  MET  40           HE1      MET  40  21.480   1.130  12.021
    8    HE2  MET  40           HE2      MET  40  20.585   2.413  11.211
    9    HE1  MET  40           HE3      MET  40  21.319   2.719  12.783

  No H/Q in entry =           9
  In of MODEL   46
    1    H    MET  41           H        MET  41  21.681   6.810   7.293
    2    HA   MET  41           HA       MET  41  19.749   5.571   5.624
    3    HB2  MET  41           HB2      MET  41  21.177   8.190   5.104
    4    HB3  MET  41           HB3      MET  41  19.659   7.663   4.387
    5    HG2  MET  41           HG2      MET  41  18.917   7.466   6.939
    6    HG3  MET  41           HG3      MET  41  20.202   8.651   7.158
    7    HE2  MET  41           HE1      MET  41  19.613   9.918   3.818
    8    HE1  MET  41           HE2      MET  41  20.560  10.381   5.228
    9    HE3  MET  41           HE3      MET  41  19.266  11.432   4.661

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ASP  42           H        ASP  42  23.102   6.562   5.068
    2    HA   ASP  42           HA       ASP  42  23.204   6.083   2.312
    3    HB2  ASP  42           HB2      ASP  42  24.934   7.121   4.079
    4    HB3  ASP  42           HB3      ASP  42  25.625   5.510   3.955

  No H/Q in entry =           4
  In of MODEL   46
    1    H    GLN  43           H        GLN  43  23.973   3.951   5.038
    2    HA   GLN  43           HA       GLN  43  24.684   1.704   3.461
    3    HB2  GLN  43           HB2      GLN  43  23.658   1.873   6.304
    4    HB3  GLN  43           HB3      GLN  43  24.268   0.394   5.552
    5    HG2  GLN  43           HG2      GLN  43  26.405   1.649   5.038
    6    HG3  GLN  43           HG3      GLN  43  25.795   2.966   6.035
    7   HE21  GLN  43          HE21      GLN  43  28.048   2.042   7.074
    8   HE22  GLN  43          HE22      GLN  43  27.796   0.957   8.353

  No H/Q in entry =           8
  In of MODEL   46
    1    H    SER  44           H        SER  44  21.605   2.777   4.843
    2    HA   SER  44           HA       SER  44  20.083   0.500   4.176
    3    HB2  SER  44           HB2      SER  44  19.589   3.022   5.315
    4    HB3  SER  44           HB3      SER  44  18.556   2.954   3.890
    5    HG   SER  44           HG       SER  44  17.482   1.992   5.616

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ARG  45           H        ARG  45  20.764   3.475   2.364
    2    HA   ARG  45           HA       ARG  45  19.250   2.952   0.060
    3    HB2  ARG  45           HB2      ARG  45  20.349   5.113   0.639
    4    HB3  ARG  45           HB3      ARG  45  21.909   4.389   0.255
    5    HG2  ARG  45           HG2      ARG  45  21.134   3.962  -2.058
    6    HG3  ARG  45           HG3      ARG  45  19.586   4.708  -1.673
    7    HD2  ARG  45           HD2      ARG  45  20.792   6.832  -1.094
    8    HD3  ARG  45           HD3      ARG  45  22.305   6.088  -1.661
    9    HE   ARG  45           HE       ARG  45  20.379   5.805  -3.696
   10   HH21  ARG  45          HH11      ARG  45  20.344   7.169  -5.463
   11   HH22  ARG  45          HH12      ARG  45  21.069   8.735  -5.362
   12   HH11  ARG  45          HH21      ARG  45  22.058   8.343  -2.076
   13   HH12  ARG  45          HH22      ARG  45  22.038   9.399  -3.442

  No H/Q in entry =          13
  In of MODEL   46
    1    H    MET  46           H        MET  46  22.631   2.148   0.809
    2    HA   MET  46           HA       MET  46  23.261   0.961  -1.672
    3    HB2  MET  46           HB2      MET  46  24.374   0.662   1.118
    4    HB3  MET  46           HB3      MET  46  25.049  -0.217  -0.258
    5    HG2  MET  46           HG2      MET  46  25.451   1.896  -1.441
    6    HG3  MET  46           HG3      MET  46  24.721   2.796  -0.118
    7    HE2  MET  46           HE1      MET  46  28.726   0.705  -0.400
    8    HE1  MET  46           HE2      MET  46  27.265   0.467  -1.353
    9    HE3  MET  46           HE3      MET  46  27.445  -0.361   0.192

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ALA  47           H        ALA  47  21.906  -0.392   1.308
    2    HA   ALA  47           HA       ALA  47  21.906  -3.107   0.512
    3    HB2  ALA  47           HB1      ALA  47  21.519  -2.648   2.816
    4    HB3  ALA  47           HB2      ALA  47  19.994  -3.283   2.199
    5    HB1  ALA  47           HB3      ALA  47  20.190  -1.547   2.453

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU  48           H        LEU  48  19.501  -0.528   0.150
    2    HA   LEU  48           HA       LEU  48  17.486  -2.105  -1.095
    3    HB2  LEU  48           HB2      LEU  48  18.082   0.861  -1.219
    4    HB3  LEU  48           HB3      LEU  48  16.625   0.120  -1.882
    5    HG   LEU  48           HG       LEU  48  17.487  -0.157   1.006
    6   HD13  LEU  48          HD11      LEU  48  17.024   2.135   0.814
    7   HD12  LEU  48          HD12      LEU  48  15.479   1.458   1.326
    8   HD11  LEU  48          HD13      LEU  48  15.740   1.881  -0.366
    9   HD22  LEU  48          HD21      LEU  48  15.991  -1.902   0.632
   10   HD21  LEU  48          HD22      LEU  48  15.099  -1.020  -0.608
   11   HD23  LEU  48          HD23      LEU  48  14.880  -0.614   1.094

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ASN  49           H        ASN  49  20.135  -0.128  -2.334
    2    HA   ASN  49           HA       ASN  49  19.483  -0.232  -5.057
    3    HB2  ASN  49           HB2      ASN  49  21.135   1.318  -4.137
    4    HB3  ASN  49           HB3      ASN  49  22.191  -0.022  -3.707
    5   HD21  ASN  49          HD21      ASN  49  23.316   1.857  -5.325
    6   HD22  ASN  49          HD22      ASN  49  23.436   1.300  -6.924

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLU  50           H        GLU  50  21.512  -2.383  -3.090
    2    HA   GLU  50           HA       GLU  50  22.244  -4.131  -5.212
    3    HB2  GLU  50           HB2      GLU  50  23.444  -4.076  -3.047
    4    HB3  GLU  50           HB3      GLU  50  22.015  -4.729  -2.247
    5    HG2  GLU  50           HG2      GLU  50  22.142  -6.764  -3.600
    6    HG3  GLU  50           HG3      GLU  50  23.504  -6.108  -4.505

  No H/Q in entry =           6
  In of MODEL   46
    1    H    ALA  51           H        ALA  51  19.590  -4.109  -2.882
    2    HA   ALA  51           HA       ALA  51  18.471  -6.607  -3.631
    3    HB3  ALA  51           HB1      ALA  51  16.871  -6.127  -2.075
    4    HB1  ALA  51           HB2      ALA  51  16.625  -4.486  -2.679
    5    HB2  ALA  51           HB3      ALA  51  17.993  -4.843  -1.623

  No H/Q in entry =           5
  In of MODEL   46
    1    H    HIS  52           H        HIS  52  17.819  -3.274  -4.675
    2    HA   HIS  52           HA       HIS  52  15.714  -3.846  -6.471
    3    HB2  HIS  52           HB2      HIS  52  16.269  -1.568  -5.705
    4    HB3  HIS  52           HB3      HIS  52  17.779  -1.635  -6.613
    5    HD1  HIS  52           HD1      HIS  52  17.513  -1.922  -9.280
    6    HD2  HIS  52           HD2      HIS  52  14.050  -0.842  -7.226
    7    HE1  HIS  52           HE1      HIS  52  15.889  -1.053 -11.020
    8    HE2  HIS  52           HE2      HIS  52  13.773  -0.390  -9.782

  No H/Q in entry =           8
  In of MODEL   46
    1    H    LEU  53           H        LEU  53  19.232  -3.786  -6.908
    2    HA   LEU  53           HA       LEU  53  19.291  -4.109  -9.707
    3    HB2  LEU  53           HB2      LEU  53  21.241  -4.824  -7.532
    4    HB3  LEU  53           HB3      LEU  53  21.563  -5.214  -9.220
    5    HG   LEU  53           HG       LEU  53  20.854  -2.413  -8.286
    6   HD12  LEU  53          HD11      LEU  53  23.613  -3.515  -8.882
    7   HD11  LEU  53          HD12      LEU  53  22.977  -3.302  -7.252
    8   HD13  LEU  53          HD13      LEU  53  23.213  -1.904  -8.294
    9   HD22  LEU  53          HD21      LEU  53  20.553  -2.434 -10.614
   10   HD21  LEU  53          HD22      LEU  53  21.798  -3.653 -10.860
   11   HD23  LEU  53          HD23      LEU  53  22.253  -1.996 -10.510

  No H/Q in entry =          11
  In of MODEL   46
    1    H    VAL  54           H        VAL  54  19.229  -6.489  -7.074
    2    HA   VAL  54           HA       VAL  54  19.395  -8.786  -8.726
    3    HB   VAL  54           HB       VAL  54  18.236  -8.376  -5.958
    4   HG12  VAL  54          HG11      VAL  54  18.611 -10.987  -5.946
    5   HG11  VAL  54          HG12      VAL  54  18.421 -10.828  -7.692
    6   HG13  VAL  54          HG13      VAL  54  17.123 -10.319  -6.613
    7   HG22  VAL  54          HG21      VAL  54  20.547  -8.119  -5.739
    8   HG21  VAL  54          HG22      VAL  54  20.904  -9.209  -7.077
    9   HG23  VAL  54          HG23      VAL  54  20.389  -9.861  -5.522

  No H/Q in entry =           9
  In of MODEL   46
    1    H    GLN  55           H        GLN  55  16.631  -6.933  -7.446
    2    HA   GLN  55           HA       GLN  55  14.642  -8.641  -8.511
    3    HB2  GLN  55           HB2      GLN  55  13.866  -7.125  -6.889
    4    HB3  GLN  55           HB3      GLN  55  14.630  -5.743  -7.671
    5    HG2  GLN  55           HG2      GLN  55  12.898  -5.459  -9.159
    6    HG3  GLN  55           HG3      GLN  55  12.610  -7.186  -9.323
    7   HE21  GLN  55          HE21      GLN  55  10.616  -7.772  -8.513
    8   HE22  GLN  55          HE22      GLN  55   9.829  -7.029  -7.206

  No H/Q in entry =           8
  In of MODEL   46
    1    H    THR  56           H        THR  56  16.323  -5.811  -9.883
    2    HA   THR  56           HA       THR  56  14.875  -5.486 -12.230
    3    HB   THR  56           HB       THR  56  17.892  -5.338 -12.076
    4    HG1  THR  56           HG1      THR  56  16.026  -4.014 -10.685
    5   HG22  THR  56          HG21      THR  56  16.018  -3.544 -13.606
    6   HG21  THR  56          HG22      THR  56  16.553  -5.082 -14.283
    7   HG23  THR  56          HG23      THR  56  17.737  -3.837 -13.879

  No H/Q in entry =           7
  In of MODEL   46
    1    H    LYS  57           H        LYS  57  17.572  -7.727 -11.615
    2    HA   LYS  57           HA       LYS  57  17.593  -8.931 -14.189
    3    HB2  LYS  57           HB2      LYS  57  19.403  -9.153 -12.479
    4    HB3  LYS  57           HB3      LYS  57  18.319 -10.121 -11.490
    5    HG2  LYS  57           HG2      LYS  57  19.730 -11.649 -12.685
    6    HG3  LYS  57           HG3      LYS  57  18.135 -11.741 -13.422
    7    HD2  LYS  57           HD2      LYS  57  18.816 -10.434 -15.299
    8    HD3  LYS  57           HD3      LYS  57  20.309  -9.935 -14.507
    9    HE2  LYS  57           HE2      LYS  57  20.859 -11.666 -16.121
   10    HE3  LYS  57           HE3      LYS  57  21.038 -12.361 -14.510
   11    HZ1  LYS  57           HZ1      LYS  57  18.405 -12.585 -15.708
   12    HZ3  LYS  57           HZ2      LYS  57  19.289 -13.712 -14.796
   13    HZ2  LYS  57           HZ3      LYS  57  19.630 -13.497 -16.445

  No H/Q in entry =          13
  In of MODEL   46
    1    H    LEU  58           H        LEU  58  15.831  -9.624 -11.208
    2    HA   LEU  58           HA       LEU  58  14.657 -12.025 -12.132
    3    HB2  LEU  58           HB2      LEU  58  13.826 -10.129  -9.943
    4    HB3  LEU  58           HB3      LEU  58  13.051 -11.684 -10.252
    5    HG   LEU  58           HG       LEU  58  16.018 -11.343  -9.703
    6   HD11  LEU  58          HD11      LEU  58  13.659 -11.802  -7.905
    7   HD13  LEU  58          HD12      LEU  58  15.092 -10.808  -7.648
    8   HD12  LEU  58          HD13      LEU  58  15.201 -12.562  -7.507
    9   HD22  LEU  58          HD21      LEU  58  15.942 -13.410 -10.723
   10   HD21  LEU  58          HD22      LEU  58  14.233 -13.654 -10.359
   11   HD23  LEU  58          HD23      LEU  58  15.449 -13.925  -9.110

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  59           H        ILE  59  13.916  -8.705 -12.826
    2    HA   ILE  59           HA       ILE  59  11.213  -9.414 -13.760
    3    HB   ILE  59           HB       ILE  59  11.971  -7.111 -12.564
    4   HG12  ILE  59          HG12      ILE  59  10.065  -7.022 -14.912
    5   HG13  ILE  59          HG13      ILE  59   9.660  -7.815 -13.411
    6   HG22  ILE  59          HG21      ILE  59  12.041  -6.309 -15.460
    7   HG21  ILE  59          HG22      ILE  59  13.523  -6.692 -14.612
    8   HG23  ILE  59          HG23      ILE  59  12.501  -5.367 -14.063
    9   HD11  ILE  59          HD11      ILE  59  10.612  -4.960 -13.519
   10   HD13  ILE  59          HD12      ILE  59   9.853  -5.786 -12.158
   11   HD12  ILE  59          HD13      ILE  59   8.903  -5.396 -13.593

  No H/Q in entry =          11
  In of MODEL   46
    1    H    GLU  60           H        GLU  60  14.397  -8.500 -15.026
    2    HA   GLU  60           HA       GLU  60  13.605  -8.126 -17.735
    3    HB2  GLU  60           HB2      GLU  60  15.771  -7.350 -16.873
    4    HB3  GLU  60           HB3      GLU  60  16.269  -9.016 -16.595
    5    HG2  GLU  60           HG2      GLU  60  16.071  -9.485 -19.012
    6    HG3  GLU  60           HG3      GLU  60  15.571  -7.819 -19.294

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLY  61           H        GLY  61  14.644 -10.980 -15.910
    2    HA3  GLY  61           HA2      GLY  61  14.134 -12.647 -18.305
    3    HA2  GLY  61           HA3      GLY  61  15.178 -13.102 -16.963

  No H/Q in entry =           3
  In of MODEL   46
    1    H    ASP  62           H        ASP  62  12.027 -11.619 -16.590
    2    HA   ASP  62           HA       ASP  62  11.148 -13.734 -14.863
    3    HB2  ASP  62           HB2      ASP  62   9.062 -12.371 -14.749
    4    HB3  ASP  62           HB3      ASP  62  10.521 -11.470 -14.347

  No H/Q in entry =           4
  In of MODEL   46
    1    H    ALA  63           H        ALA  63  11.260 -13.649 -18.183
    2    HA   ALA  63           HA       ALA  63   8.737 -14.474 -19.087
    3    HB1  ALA  63           HB1      ALA  63  11.486 -15.349 -20.015
    4    HB3  ALA  63           HB2      ALA  63  10.559 -13.982 -20.630
    5    HB2  ALA  63           HB3      ALA  63   9.990 -15.629 -20.907

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLY  64           H        GLY  64  11.427 -16.397 -17.809
    2    HA3  GLY  64           HA2      GLY  64  11.544 -18.521 -16.955
    3    HA2  GLY  64           HA3      GLY  64   9.873 -18.292 -16.463

  No H/Q in entry =           3
  In of MODEL   46
    1    H    GLU  65           H        GLU  65   8.642 -19.943 -17.148
    2    HA   GLU  65           HA       GLU  65   9.410 -21.740 -19.160
    3    HB2  GLU  65           HB2      GLU  65   6.713 -21.206 -17.924
    4    HB3  GLU  65           HB3      GLU  65   7.031 -22.536 -19.036
    5    HG2  GLU  65           HG2      GLU  65   8.753 -23.417 -17.542
    6    HG3  GLU  65           HG3      GLU  65   8.528 -22.056 -16.444

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLY  66           H        GLY  66   8.526 -22.226 -21.142
    2    HA3  GLY  66           HA2      GLY  66   8.585 -20.565 -23.187
    3    HA2  GLY  66           HA3      GLY  66   7.428 -21.881 -23.152

  No H/Q in entry =           3
  In of MODEL   46
    1    H    LYS  67           H        LYS  67   5.762 -20.832 -21.111
    2    HA   LYS  67           HA       LYS  67   4.046 -19.225 -22.691
    3    HB2  LYS  67           HB2      LYS  67   2.554 -19.305 -20.751
    4    HB3  LYS  67           HB3      LYS  67   3.236 -20.898 -21.101
    5    HG2  LYS  67           HG2      LYS  67   4.980 -20.529 -19.391
    6    HG3  LYS  67           HG3      LYS  67   4.296 -18.945 -19.034
    7    HD2  LYS  67           HD2      LYS  67   2.189 -20.001 -18.327
    8    HD3  LYS  67           HD3      LYS  67   2.857 -21.592 -18.701
    9    HE2  LYS  67           HE2      LYS  67   4.640 -21.252 -17.042
   10    HE3  LYS  67           HE3      LYS  67   4.007 -19.648 -16.678
   11    HZ1  LYS  67           HZ1      LYS  67   1.829 -20.939 -16.235
   12    HZ3  LYS  67           HZ2      LYS  67   3.047 -20.927 -15.053
   13    HZ2  LYS  67           HZ3      LYS  67   2.852 -22.281 -16.062

  No H/Q in entry =          13
  In of MODEL   46
    1    H    MET  68           H        MET  68   3.046 -17.259 -22.109
    2    HA   MET  68           HA       MET  68   4.824 -15.116 -21.813
    3    HB2  MET  68           HB2      MET  68   1.817 -15.202 -21.561
    4    HB3  MET  68           HB3      MET  68   2.775 -13.731 -21.731
    5    HG2  MET  68           HG2      MET  68   2.757 -16.021 -23.717
    6    HG3  MET  68           HG3      MET  68   1.868 -14.510 -23.912
    7    HE1  MET  68           HE1      MET  68   2.654 -12.382 -23.996
    8    HE3  MET  68           HE2      MET  68   4.216 -11.823 -24.587
    9    HE2  MET  68           HE3      MET  68   4.006 -12.173 -22.874

  No H/Q in entry =           9
  In of MODEL   46
    1    H    LYS  69           H        LYS  69   2.627 -16.565 -19.392
    2    HA   LYS  69           HA       LYS  69   2.553 -14.728 -17.424
    3    HB2  LYS  69           HB2      LYS  69   1.725 -17.200 -17.512
    4    HB3  LYS  69           HB3      LYS  69   3.208 -17.529 -16.612
    5    HG2  LYS  69           HG2      LYS  69   2.586 -15.933 -14.892
    6    HG3  LYS  69           HG3      LYS  69   1.176 -15.425 -15.821
    7    HD2  LYS  69           HD2      LYS  69   0.230 -16.927 -14.307
    8    HD3  LYS  69           HD3      LYS  69   0.527 -17.968 -15.701
    9    HE2  LYS  69           HE2      LYS  69   1.328 -19.033 -13.622
   10    HE3  LYS  69           HE3      LYS  69   2.669 -18.686 -14.713
   11    HZ1  LYS  69           HZ1      LYS  69   1.986 -16.573 -12.852
   12    HZ3  LYS  69           HZ2      LYS  69   3.509 -17.141 -13.343
   13    HZ2  LYS  69           HZ3      LYS  69   2.634 -17.973 -12.149

  No H/Q in entry =          13
  In of MODEL   46
    1    H    VAL  70           H        VAL  70   3.641 -14.562 -15.268
    2    HA   VAL  70           HA       VAL  70   6.589 -14.818 -15.484
    3    HB   VAL  70           HB       VAL  70   6.746 -12.689 -14.228
    4   HG11  VAL  70          HG11      VAL  70   6.700 -12.827 -16.774
    5   HG13  VAL  70          HG12      VAL  70   6.277 -11.256 -16.092
    6   HG12  VAL  70          HG13      VAL  70   5.010 -12.330 -16.682
    7   HG21  VAL  70          HG21      VAL  70   3.721 -12.704 -14.556
    8   HG23  VAL  70          HG22      VAL  70   4.651 -11.285 -14.079
    9   HG22  VAL  70          HG23      VAL  70   4.617 -12.706 -13.036

  No H/Q in entry =           9
  In of MODEL   46
    1    H    SER  71           H        SER  71   7.652 -14.739 -13.318
    2    HA   SER  71           HA       SER  71   6.656 -16.722 -11.568
    3    HB2  SER  71           HB2      SER  71   9.065 -16.069 -11.791
    4    HB3  SER  71           HB3      SER  71   8.695 -14.573 -10.937
    5    HG   SER  71           HG       SER  71   7.886 -17.024  -9.841

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU  72           H        LEU  72   5.255 -16.612  -9.943
    2    HA   LEU  72           HA       LEU  72   3.658 -14.330  -9.505
    3    HB2  LEU  72           HB2      LEU  72   4.000 -16.876  -7.928
    4    HB3  LEU  72           HB3      LEU  72   2.808 -15.643  -7.529
    5    HG   LEU  72           HG       LEU  72   2.988 -16.950 -10.263
    6   HD13  LEU  72          HD11      LEU  72   1.287 -18.471  -9.604
    7   HD12  LEU  72          HD12      LEU  72   0.961 -17.587  -8.115
    8   HD11  LEU  72          HD13      LEU  72   2.456 -18.506  -8.283
    9   HD22  LEU  72          HD21      LEU  72   1.735 -14.983 -10.532
   10   HD21  LEU  72          HD22      LEU  72   1.062 -15.056  -8.912
   11   HD23  LEU  72          HD23      LEU  72   0.480 -16.157 -10.157

  No H/Q in entry =          11
  In of MODEL   46
    1    H    VAL  73           H        VAL  73   6.345 -15.706  -7.729
    2    HA   VAL  73           HA       VAL  73   6.254 -14.167  -5.402
    3    HB   VAL  73           HB       VAL  73   8.450 -14.934  -4.971
    4   HG13  VAL  73          HG11      VAL  73   8.227 -17.279  -5.329
    5   HG12  VAL  73          HG12      VAL  73   7.304 -17.039  -6.813
    6   HG11  VAL  73          HG13      VAL  73   6.578 -16.659  -5.251
    7   HG23  VAL  73          HG21      VAL  73   9.653 -16.082  -7.028
    8   HG22  VAL  73          HG22      VAL  73   9.783 -14.341  -6.782
    9   HG21  VAL  73          HG23      VAL  73   8.641 -14.982  -7.964

  No H/Q in entry =           9
  In of MODEL   46
    1    H    LEU  74           H        LEU  74   7.224 -13.263  -8.581
    2    HA   LEU  74           HA       LEU  74   9.129 -11.273  -8.095
    3    HB2  LEU  74           HB2      LEU  74   8.688 -12.038 -10.331
    4    HB3  LEU  74           HB3      LEU  74   7.011 -11.505 -10.231
    5    HG   LEU  74           HG       LEU  74   7.770  -9.160 -10.020
    6   HD11  LEU  74          HD11      LEU  74  10.475 -10.497 -10.140
    7   HD13  LEU  74          HD12      LEU  74   9.894  -9.308  -8.976
    8   HD12  LEU  74          HD13      LEU  74  10.262  -8.818 -10.630
    9   HD21  LEU  74          HD21      LEU  74   7.530 -10.588 -12.236
   10   HD23  LEU  74          HD22      LEU  74   9.242 -10.247 -12.340
   11   HD22  LEU  74          HD23      LEU  74   8.102  -8.921 -12.282

  No H/Q in entry =          11
  In of MODEL   46
    1    H    VAL  75           H        VAL  75   5.625 -10.962  -8.449
    2    HA   VAL  75           HA       VAL  75   5.473  -8.206  -7.870
    3    HB   VAL  75           HB       VAL  75   3.428 -10.391  -7.476
    4   HG12  VAL  75          HG11      VAL  75   1.805  -8.470  -7.377
    5   HG11  VAL  75          HG12      VAL  75   3.172  -7.366  -7.339
    6   HG13  VAL  75          HG13      VAL  75   2.914  -8.484  -6.010
    7   HG22  VAL  75          HG21      VAL  75   4.015 -10.100  -9.797
    8   HG21  VAL  75          HG22      VAL  75   4.004  -8.345  -9.639
    9   HG23  VAL  75          HG23      VAL  75   2.492  -9.248  -9.552

  No H/Q in entry =           9
  In of MODEL   46
    1    H    GLU  76           H        GLU  76   5.278 -11.081  -5.752
    2    HA   GLU  76           HA       GLU  76   4.780  -9.723  -3.334
    3    HB2  GLU  76           HB2      GLU  76   4.656 -12.193  -3.560
    4    HB3  GLU  76           HB3      GLU  76   6.393 -12.258  -3.801
    5    HG2  GLU  76           HG2      GLU  76   5.971 -12.839  -1.501
    6    HG3  GLU  76           HG3      GLU  76   6.677 -11.234  -1.495

  No H/Q in entry =           6
  In of MODEL   46
    1    H    ALA  77           H        ALA  77   7.858 -10.572  -4.894
    2    HA   ALA  77           HA       ALA  77   9.526  -9.488  -2.882
    3    HB1  ALA  77           HB1      ALA  77  10.583 -10.929  -4.414
    4    HB2  ALA  77           HB2      ALA  77  11.201  -9.332  -4.836
    5    HB3  ALA  77           HB3      ALA  77   9.930 -10.069  -5.809

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLN  78           H        GLN  78   8.106  -8.108  -5.800
    2    HA   GLN  78           HA       GLN  78   9.408  -5.602  -5.703
    3    HB2  GLN  78           HB2      GLN  78   8.131  -6.549  -7.658
    4    HB3  GLN  78           HB3      GLN  78   6.640  -6.197  -6.784
    5    HG2  GLN  78           HG2      GLN  78   7.257  -3.812  -6.694
    6    HG3  GLN  78           HG3      GLN  78   8.741  -4.161  -7.578
    7   HE21  GLN  78          HE21      GLN  78   6.762  -2.376  -8.647
    8   HE22  GLN  78          HE22      GLN  78   6.079  -3.103 -10.020

  No H/Q in entry =           8
  In of MODEL   46
    1    H    LEU  79           H        LEU  79   6.411  -6.795  -4.271
    2    HA   LEU  79           HA       LEU  79   5.369  -4.406  -3.269
    3    HB2  LEU  79           HB2      LEU  79   4.095  -6.483  -3.208
    4    HB3  LEU  79           HB3      LEU  79   5.254  -7.196  -2.090
    5    HG   LEU  79           HG       LEU  79   4.668  -5.560  -0.368
    6   HD13  LEU  79          HD11      LEU  79   4.163  -3.558  -1.425
    7   HD12  LEU  79          HD12      LEU  79   2.548  -4.114  -0.986
    8   HD11  LEU  79          HD13      LEU  79   3.135  -4.330  -2.633
    9   HD23  LEU  79          HD21      LEU  79   2.092  -6.103  -0.279
   10   HD22  LEU  79          HD22      LEU  79   3.257  -7.419  -0.165
   11   HD21  LEU  79          HD23      LEU  79   2.439  -7.103  -1.692

  No H/Q in entry =          11
  In of MODEL   46
    1    H    HIS  80           H        HIS  80   7.596  -6.692  -1.678
    2    HA   HIS  80           HA       HIS  80   7.851  -5.138   0.687
    3    HB2  HIS  80           HB2      HIS  80   9.237  -7.478  -0.504
    4    HB3  HIS  80           HB3      HIS  80  10.129  -6.560   0.711
    5    HD1  HIS  80           HD1      HIS  80   9.648  -7.198   3.056
    6    HD2  HIS  80           HD2      HIS  80   6.451  -8.120   0.543
    7    HE1  HIS  80           HE1      HIS  80   7.897  -8.332   4.506
    8    HE2  HIS  80           HE2      HIS  80   5.942  -8.897   2.982

  No H/Q in entry =           8
  In of MODEL   46
    1    H    LEU  81           H        LEU  81   9.865  -5.383  -2.223
    2    HA   LEU  81           HA       LEU  81  11.874  -3.600  -1.347
    3    HB2  LEU  81           HB2      LEU  81  10.972  -4.419  -4.109
    4    HB3  LEU  81           HB3      LEU  81  12.371  -3.384  -3.820
    5    HG   LEU  81           HG       LEU  81  12.030  -6.109  -2.539
    6   HD12  LEU  81          HD11      LEU  81  13.860  -6.705  -4.284
    7   HD11  LEU  81          HD12      LEU  81  13.268  -5.295  -5.161
    8   HD13  LEU  81          HD13      LEU  81  12.182  -6.639  -4.820
    9   HD23  LEU  81          HD21      LEU  81  14.652  -5.743  -2.523
   10   HD22  LEU  81          HD22      LEU  81  13.654  -4.998  -1.276
   11   HD21  LEU  81          HD23      LEU  81  14.215  -4.039  -2.645

  No H/Q in entry =          11
  In of MODEL   46
    1    H    MET  82           H        MET  82   8.942  -3.025  -3.289
    2    HA   MET  82           HA       MET  82   9.430  -0.291  -3.798
    3    HB2  MET  82           HB2      MET  82   6.901  -1.933  -3.671
    4    HB3  MET  82           HB3      MET  82   6.869  -0.210  -4.041
    5    HG2  MET  82           HG2      MET  82   8.510  -2.258  -5.568
    6    HG3  MET  82           HG3      MET  82   6.932  -1.666  -6.084
    7    HE3  MET  82           HE1      MET  82   7.317   1.793  -7.266
    8    HE2  MET  82           HE2      MET  82   6.944   1.565  -5.559
    9    HE1  MET  82           HE3      MET  82   6.302   0.439  -6.751

  No H/Q in entry =           9
  In of MODEL   46
    1    H    THR  83           H        THR  83   7.665  -1.915  -1.190
    2    HA   THR  83           HA       THR  83   6.769   0.421   0.128
    3    HB   THR  83           HB       THR  83   6.661  -1.150   2.151
    4    HG1  THR  83           HG1      THR  83   7.455  -3.086   1.928
    5   HG22  THR  83          HG21      THR  83   5.040  -2.751   0.685
    6   HG21  THR  83          HG22      THR  83   5.243  -1.422  -0.451
    7   HG23  THR  83          HG23      THR  83   4.594  -1.114   1.161

  No H/Q in entry =           7
  In of MODEL   46
    1    H    SER  84           H        SER  84   9.630  -1.623   0.659
    2    HA   SER  84           HA       SER  84  10.660  -0.167   2.844
    3    HB2  SER  84           HB2      SER  84  11.950  -1.992   0.826
    4    HB3  SER  84           HB3      SER  84  12.881  -1.217   2.107
    5    HG   SER  84           HG       SER  84  10.637  -2.948   2.368

  No H/Q in entry =           5
  In of MODEL   46
    1    H    MET  85           H        MET  85  11.413   0.098  -0.644
    2    HA   MET  85           HA       MET  85  13.375   2.100  -0.396
    3    HB2  MET  85           HB2      MET  85  12.999   0.801  -2.458
    4    HB3  MET  85           HB3      MET  85  11.463   1.637  -2.693
    5    HG2  MET  85           HG2      MET  85  12.629   3.792  -2.834
    6    HG3  MET  85           HG3      MET  85  14.169   2.992  -2.537
    7    HE1  MET  85           HE1      MET  85  11.113   3.356  -4.553
    8    HE3  MET  85           HE2      MET  85  11.134   1.665  -5.047
    9    HE2  MET  85           HE3      MET  85  11.510   2.920  -6.222

  No H/Q in entry =           9
  In of MODEL   46
    1    H    LEU  86           H        LEU  86   9.880   2.370  -0.910
    2    HA   LEU  86           HA       LEU  86   9.766   5.181  -1.101
    3    HB2  LEU  86           HB2      LEU  86   7.952   3.486  -1.674
    4    HB3  LEU  86           HB3      LEU  86   7.622   3.396   0.056
    5    HG   LEU  86           HG       LEU  86   7.415   5.953  -0.005
    6   HD11  LEU  86          HD11      LEU  86   8.202   5.523  -2.704
    7   HD13  LEU  86          HD12      LEU  86   7.738   7.045  -1.949
    8   HD12  LEU  86          HD13      LEU  86   6.520   6.057  -2.753
    9   HD23  LEU  86          HD21      LEU  86   5.308   4.557  -1.666
   10   HD22  LEU  86          HD22      LEU  86   5.094   5.817  -0.454
   11   HD21  LEU  86          HD23      LEU  86   5.522   4.182   0.045

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ALA  87           H        ALA  87   9.335   3.002   1.651
    2    HA   ALA  87           HA       ALA  87   8.750   4.912   3.614
    3    HB1  ALA  87           HB1      ALA  87   9.607   2.106   3.537
    4    HB3  ALA  87           HB2      ALA  87   8.467   2.902   4.619
    5    HB2  ALA  87           HB3      ALA  87  10.194   2.965   4.965

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ARG  88           H        ARG  88  11.859   3.540   2.642
    2    HA   ARG  88           HA       ARG  88  13.442   4.952   4.472
    3    HB2  ARG  88           HB2      ARG  88  14.147   2.986   3.075
    4    HB3  ARG  88           HB3      ARG  88  14.282   4.078   1.699
    5    HG2  ARG  88           HG2      ARG  88  15.729   5.423   3.643
    6    HG3  ARG  88           HG3      ARG  88  16.079   3.741   4.027
    7    HD2  ARG  88           HD2      ARG  88  17.353   3.462   2.183
    8    HD3  ARG  88           HD3      ARG  88  16.202   4.310   1.146
    9    HE   ARG  88           HE       ARG  88  18.576   5.419   2.193
   10   HH21  ARG  88          HH11      ARG  88  18.882   7.643   1.992
   11   HH22  ARG  88          HH12      ARG  88  17.513   8.690   1.844
   12   HH11  ARG  88          HH21      ARG  88  15.225   6.112   1.909
   13   HH12  ARG  88          HH22      ARG  88  15.440   7.820   1.772

  No H/Q in entry =          13
  In of MODEL   46
    1    H    GLU  89           H        GLU  89  12.457   5.822   1.145
    2    HA   GLU  89           HA       GLU  89  13.961   8.209   0.983
    3    HB2  GLU  89           HB2      GLU  89  12.838   7.142  -0.963
    4    HB3  GLU  89           HB3      GLU  89  11.283   7.658  -0.309
    5    HG2  GLU  89           HG2      GLU  89  11.943  10.007  -0.477
    6    HG3  GLU  89           HG3      GLU  89  13.556   9.543  -1.011

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LEU  90           H        LEU  90  10.641   7.644   2.110
    2    HA   LEU  90           HA       LEU  90  10.076  10.369   2.677
    3    HB2  LEU  90           HB2      LEU  90   8.926   7.778   3.711
    4    HB3  LEU  90           HB3      LEU  90   8.267   9.363   4.128
    5    HG   LEU  90           HG       LEU  90   8.704   8.482   1.262
    6   HD12  LEU  90          HD11      LEU  90   6.176   8.108   1.323
    7   HD11  LEU  90          HD12      LEU  90   6.329   8.106   3.080
    8   HD13  LEU  90          HD13      LEU  90   7.170   6.888   2.120
    9   HD22  LEU  90          HD21      LEU  90   8.369  10.784   1.182
   10   HD21  LEU  90          HD22      LEU  90   7.380  10.803   2.641
   11   HD23  LEU  90          HD23      LEU  90   6.695  10.232   1.120

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  91           H        ILE  91  11.385   7.716   4.608
    2    HA   ILE  91           HA       ILE  91  11.499   9.091   7.073
    3    HB   ILE  91           HB       ILE  91  13.095   6.777   5.957
    4   HG12  ILE  91          HG12      ILE  91  11.074   6.915   8.215
    5   HG13  ILE  91          HG13      ILE  91  10.610   6.621   6.540
    6   HG22  ILE  91          HG21      ILE  91  13.566   6.580   8.599
    7   HG21  ILE  91          HG22      ILE  91  13.459   8.336   8.493
    8   HG23  ILE  91          HG23      ILE  91  14.654   7.467   7.532
    9   HD13  ILE  91          HD11      ILE  91  11.650   4.537   6.476
   10   HD12  ILE  91          HD12      ILE  91  11.054   4.590   8.136
   11   HD11  ILE  91          HD13      ILE  91  12.750   4.932   7.798

  No H/Q in entry =          11
  In of MODEL   46
    1    H    THR  92           H        THR  92  13.721   8.953   4.323
    2    HA   THR  92           HA       THR  92  15.860  10.388   5.481
    3    HB   THR  92           HB       THR  92  14.879  10.237   2.620
    4    HG1  THR  92           HG1      THR  92  15.744   8.356   3.031
    5   HG22  THR  92          HG21      THR  92  17.436  10.972   2.326
    6   HG21  THR  92          HG22      THR  92  17.112  11.792   3.853
    7   HG23  THR  92          HG23      THR  92  16.136  12.158   2.430

  No H/Q in entry =           7
  In of MODEL   46
    1    H    GLU  93           H        GLU  93  12.954  11.485   3.746
    2    HA   GLU  93           HA       GLU  93  13.499  14.256   3.852
    3    HB2  GLU  93           HB2      GLU  93  10.820  12.835   3.868
    4    HB3  GLU  93           HB3      GLU  93  11.078  14.539   3.492
    5    HG2  GLU  93           HG2      GLU  93  12.457  12.316   1.972
    6    HG3  GLU  93           HG3      GLU  93  10.899  12.970   1.482

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LEU  94           H        LEU  94  11.793  12.076   6.069
    2    HA   LEU  94           HA       LEU  94  10.948  14.012   7.938
    3    HB2  LEU  94           HB2      LEU  94  11.576  11.069   8.222
    4    HB3  LEU  94           HB3      LEU  94  10.986  12.038   9.569
    5    HG   LEU  94           HG       LEU  94   9.503  12.056   6.939
    6   HD11  LEU  94          HD11      LEU  94   9.624   9.842   8.950
    7   HD13  LEU  94          HD12      LEU  94   9.325   9.771   7.215
    8   HD12  LEU  94          HD13      LEU  94   8.037  10.268   8.310
    9   HD23  LEU  94          HD21      LEU  94   7.576  12.426   8.536
   10   HD22  LEU  94          HD22      LEU  94   8.792  13.702   8.570
   11   HD21  LEU  94          HD23      LEU  94   8.750  12.488   9.848

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  95           H        ILE  95  13.956  12.136   7.709
    2    HA   ILE  95           HA       ILE  95  15.105  13.086  10.121
    3    HB   ILE  95           HB       ILE  95  16.365  12.032   7.577
    4   HG12  ILE  95          HG12      ILE  95  16.089  10.834  10.348
    5   HG13  ILE  95          HG13      ILE  95  14.928  10.551   9.053
    6   HG21  ILE  95          HG21      ILE  95  17.604  12.869  10.218
    7   HG23  ILE  95          HG22      ILE  95  18.058  13.400   8.597
    8   HG22  ILE  95          HG23      ILE  95  18.393  11.747   9.111
    9   HD13  ILE  95          HD11      ILE  95  16.431   9.295   7.795
   10   HD12  ILE  95          HD12      ILE  95  16.911   8.860   9.432
   11   HD11  ILE  95          HD13      ILE  95  17.843  10.054   8.530

  No H/Q in entry =          11
  In of MODEL   46
    1    H    GLU  96           H        GLU  96  15.240  14.312   6.783
    2    HA   GLU  96           HA       GLU  96  17.049  16.425   7.255
    3    HB2  GLU  96           HB2      GLU  96  16.397  15.744   4.998
    4    HB3  GLU  96           HB3      GLU  96  14.745  16.272   5.295
    5    HG2  GLU  96           HG2      GLU  96  15.273  18.410   4.747
    6    HG3  GLU  96           HG3      GLU  96  16.571  18.437   5.930

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LEU  97           H        LEU  97  13.541  16.176   7.683
    2    HA   LEU  97           HA       LEU  97  13.076  18.904   8.317
    3    HB2  LEU  97           HB2      LEU  97  11.602  16.353   8.938
    4    HB3  LEU  97           HB3      LEU  97  11.061  17.893   9.604
    5    HG   LEU  97           HG       LEU  97  11.553  17.477   6.641
    6   HD12  LEU  97          HD11      LEU  97   9.033  17.304   6.522
    7   HD11  LEU  97          HD12      LEU  97   9.029  17.109   8.273
    8   HD13  LEU  97          HD13      LEU  97   9.831  15.913   7.254
    9   HD23  LEU  97          HD21      LEU  97   9.781  19.410   6.667
   10   HD22  LEU  97          HD22      LEU  97  11.455  19.800   7.059
   11   HD21  LEU  97          HD23      LEU  97  10.269  19.613   8.349

  No H/Q in entry =          11
  In of MODEL   46
    1    H    HIS  98           H        HIS  98  13.946  16.099  10.321
    2    HA   HIS  98           HA       HIS  98  13.765  17.364  12.833
    3    HB2  HIS  98           HB2      HIS  98  15.555  15.135  11.839
    4    HB3  HIS  98           HB3      HIS  98  15.543  15.678  13.519
    5    HD1  HIS  98           HD1      HIS  98  13.374  14.003  10.930
    6    HD2  HIS  98           HD2      HIS  98  13.249  14.932  14.992
    7    HE1  HIS  98           HE1      HIS  98  11.370  12.775  11.885
    8    HE2  HIS  98           HE2      HIS  98  11.274  13.332  14.355

  No H/Q in entry =           8
  In of MODEL   46
    1    H    GLU  99           H        GLU  99  16.321  17.287  10.400
    2    HA   GLU  99           HA       GLU  99  18.282  18.658  11.926
    3    HB2  GLU  99           HB2      GLU  99  18.785  17.373   9.861
    4    HB3  GLU  99           HB3      GLU  99  17.954  18.611   8.916
    5    HG2  GLU  99           HG2      GLU  99  19.532  20.312   9.703
    6    HG3  GLU  99           HG3      GLU  99  20.331  19.126  10.729

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LYS 100           H        LYS 100  15.739  19.769   9.705
    2    HA   LYS 100           HA       LYS 100  16.489  22.521   9.842
    3    HB2  LYS 100           HB2      LYS 100  13.879  21.184   9.090
    4    HB3  LYS 100           HB3      LYS 100  14.148  22.927   8.995
    5    HG2  LYS 100           HG2      LYS 100  16.129  22.508   7.530
    6    HG3  LYS 100           HG3      LYS 100  15.745  20.785   7.552
    7    HD2  LYS 100           HD2      LYS 100  13.542  21.253   6.550
    8    HD3  LYS 100           HD3      LYS 100  13.908  22.979   6.535
    9    HE2  LYS 100           HE2      LYS 100  15.876  22.528   5.077
   10    HE3  LYS 100           HE3      LYS 100  15.440  20.815   5.049
   11    HZ1  LYS 100           HZ1      LYS 100  13.578  22.974   4.207
   12    HZ3  LYS 100           HZ2      LYS 100  13.423  21.301   3.949
   13    HZ2  LYS 100           HZ3      LYS 100  14.619  22.181   3.126

  No H/Q in entry =          13
  In of MODEL   46
    1    H    LEU 101           H        LEU 101  14.426  20.444  11.812
    2    HA   LEU 101           HA       LEU 101  13.224  22.496  13.384
    3    HB2  LEU 101           HB2      LEU 101  13.716  19.556  13.776
    4    HB3  LEU 101           HB3      LEU 101  13.163  20.530  15.134
    5    HG   LEU 101           HG       LEU 101  11.745  20.587  12.465
    6   HD12  LEU 101          HD11      LEU 101  10.112  18.998  13.737
    7   HD11  LEU 101          HD12      LEU 101  11.513  18.612  14.734
    8   HD13  LEU 101          HD13      LEU 101  11.553  18.301  12.997
    9   HD21  LEU 101          HD21      LEU 101  11.073  21.376  15.314
   10   HD23  LEU 101          HD22      LEU 101   9.817  21.126  14.104
   11   HD22  LEU 101          HD23      LEU 101  11.030  22.381  13.863

  No H/Q in entry =          11
  In of MODEL   46
    1    H    LYS 102           H        LYS 102  16.381  21.941  12.950
    2    HA   LYS 102           HA       LYS 102  18.212  22.846  14.021
    3    HB2  LYS 102           HB2      LYS 102  16.372  24.333  15.150
    4    HB3  LYS 102           HB3      LYS 102  16.597  23.278  16.530
    5    HG2  LYS 102           HG2      LYS 102  18.456  25.318  15.355
    6    HG3  LYS 102           HG3      LYS 102  18.079  25.002  17.035
    7    HD2  LYS 102           HD2      LYS 102  19.779  23.113  15.355
    8    HD3  LYS 102           HD3      LYS 102  20.445  24.449  16.284
    9    HE2  LYS 102           HE2      LYS 102  20.090  21.897  17.260
   10    HE3  LYS 102           HE3      LYS 102  20.283  23.345  18.247
   11    HZ2  LYS 102           HZ1      LYS 102  18.337  22.029  18.868
   12    HZ1  LYS 102           HZ2      LYS 102  17.689  22.244  17.319
   13    HZ3  LYS 102           HZ3      LYS 102  17.897  23.581  18.341

  No H/Q in entry =          13
  In of MODEL   46
    1    H    ALA 103           H        ALA 103  16.167  21.212  16.447
    2    HA   ALA 103           HA       ALA 103  17.914  20.036  18.106
    3    HB2  ALA 103           HB1      ALA 103  16.364  18.001  18.105
    4    HB1  ALA 103           HB2      ALA 103  15.455  18.836  16.845
    5    HB3  ALA 103           HB3      ALA 103  15.620  19.564  18.441

  No H/Q in entry =           5
  In of MODEL   46
    1    H1   ALA   1           H3       ALA   1  -1.544  -7.258 -21.448
    2    H2   ALA   1           H2       ALA   1  -2.315  -8.705 -20.992
    3    H3   ALA   1           H1       ALA   1  -0.706  -8.730 -21.546
    4    HA   ALA   1           HA       ALA   1  -1.531  -9.218 -23.541
    5    HB1  ALA   1           HB1      ALA   1  -3.656  -9.970 -23.067
    6    HB2  ALA   1           HB2      ALA   1  -4.120  -8.469 -23.868
    7    HB3  ALA   1           HB3      ALA   1  -4.058  -8.544 -22.109

  No H/Q in entry =           7
  In of MODEL   46
    1    H    GLU   2           H        GLU   2  -2.380  -8.047 -25.534
    2    HA   GLU   2           HA       GLU   2  -1.014  -6.012 -26.416
    3    HB2  GLU   2           HB2      GLU   2  -4.020  -6.129 -26.735
    4    HB3  GLU   2           HB3      GLU   2  -2.913  -5.251 -27.786
    5    HG2  GLU   2           HG2      GLU   2  -2.378  -7.135 -28.936
    6    HG3  GLU   2           HG3      GLU   2  -2.066  -8.032 -27.456

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLU   3           H        GLU   3  -4.195  -4.805 -25.521
    2    HA   GLU   3           HA       GLU   3  -3.191  -2.230 -24.899
    3    HB2  GLU   3           HB2      GLU   3  -5.857  -3.588 -24.565
    4    HB3  GLU   3           HB3      GLU   3  -5.586  -1.967 -23.922
    5    HG2  GLU   3           HG2      GLU   3  -5.244  -1.040 -26.050
    6    HG3  GLU   3           HG3      GLU   3  -4.823  -2.590 -26.771

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LEU   4           H        LEU   4  -4.744  -4.610 -22.714
    2    HA   LEU   4           HA       LEU   4  -4.401  -3.370 -20.326
    3    HB2  LEU   4           HB2      LEU   4  -3.809  -6.303 -20.787
    4    HB3  LEU   4           HB3      LEU   4  -4.228  -5.560 -19.246
    5    HG   LEU   4           HG       LEU   4  -5.998  -5.668 -21.711
    6   HD13  LEU   4          HD11      LEU   4  -7.164  -7.403 -20.709
    7   HD12  LEU   4          HD12      LEU   4  -6.687  -6.931 -19.079
    8   HD11  LEU   4          HD13      LEU   4  -5.537  -7.758 -20.128
    9   HD23  LEU   4          HD21      LEU   4  -7.697  -4.880 -19.846
   10   HD22  LEU   4          HD22      LEU   4  -6.677  -3.694 -20.659
   11   HD21  LEU   4          HD23      LEU   4  -6.243  -4.273 -19.051

  No H/Q in entry =          11
  In of MODEL   46
    1    H    GLU   5           H        GLU   5  -1.872  -5.176 -22.050
    2    HA   GLU   5           HA       GLU   5   0.106  -4.855 -20.013
    3    HB2  GLU   5           HB2      GLU   5   0.213  -6.631 -21.747
    4    HB3  GLU   5           HB3      GLU   5   0.479  -5.392 -22.974
    5    HG2  GLU   5           HG2      GLU   5   2.542  -4.690 -21.863
    6    HG3  GLU   5           HG3      GLU   5   2.271  -5.858 -20.571

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLU   6           H        GLU   6  -0.556  -3.159 -23.063
    2    HA   GLU   6           HA       GLU   6   1.584  -1.292 -22.798
    3    HB2  GLU   6           HB2      GLU   6   0.080  -1.949 -24.875
    4    HB3  GLU   6           HB3      GLU   6  -0.916  -0.614 -24.294
    5    HG2  GLU   6           HG2      GLU   6   2.059  -0.411 -24.831
    6    HG3  GLU   6           HG3      GLU   6   0.811   0.095 -25.968

  No H/Q in entry =           6
  In of MODEL   46
    1    H    VAL   7           H        VAL   7  -1.754  -1.415 -21.755
    2    HA   VAL   7           HA       VAL   7  -2.020   1.295 -20.925
    3    HB   VAL   7           HB       VAL   7  -3.441  -1.244 -20.084
    4   HG11  VAL   7          HG11      VAL   7  -3.864   1.641 -19.277
    5   HG13  VAL   7          HG12      VAL   7  -3.742   0.220 -18.238
    6   HG12  VAL   7          HG13      VAL   7  -5.178   0.464 -19.232
    7   HG21  VAL   7          HG21      VAL   7  -3.614  -0.176 -22.475
    8   HG23  VAL   7          HG22      VAL   7  -4.581   1.059 -21.666
    9   HG22  VAL   7          HG23      VAL   7  -5.099  -0.627 -21.636

  No H/Q in entry =           9
  In of MODEL   46
    1    H    VAL   8           H        VAL   8  -0.985  -1.669 -19.274
    2    HA   VAL   8           HA       VAL   8  -0.686  -0.578 -16.681
    3    HB   VAL   8           HB       VAL   8   0.756  -2.875 -18.032
    4   HG12  VAL   8          HG11      VAL   8   1.173  -3.522 -15.569
    5   HG11  VAL   8          HG12      VAL   8   0.801  -1.840 -15.193
    6   HG13  VAL   8          HG13      VAL   8   2.167  -2.227 -16.238
    7   HG22  VAL   8          HG21      VAL   8  -1.002  -4.209 -17.355
    8   HG21  VAL   8          HG22      VAL   8  -1.895  -2.693 -17.326
    9   HG23  VAL   8          HG23      VAL   8  -1.208  -3.334 -15.839

  No H/Q in entry =           9
  In of MODEL   46
    1    H    MET   9           H        MET   9   1.570  -0.849 -19.427
    2    HA   MET   9           HA       MET   9   3.838   0.233 -18.167
    3    HB2  MET   9           HB2      MET   9   2.885   0.181 -21.022
    4    HB3  MET   9           HB3      MET   9   4.348   1.059 -20.579
    5    HG2  MET   9           HG2      MET   9   5.075  -1.115 -19.394
    6    HG3  MET   9           HG3      MET   9   3.787  -1.895 -20.315
    7    HE3  MET   9           HE1      MET   9   4.738  -1.893 -23.866
    8    HE2  MET   9           HE2      MET   9   3.710  -0.630 -23.196
    9    HE1  MET   9           HE3      MET   9   3.606  -2.269 -22.561

  No H/Q in entry =           9
  In of MODEL   46
    1    H    GLY  10           H        GLY  10   1.129   1.789 -19.849
    2    HA3  GLY  10           HA2      GLY  10   2.051   4.458 -19.611
    3    HA2  GLY  10           HA3      GLY  10   0.369   3.971 -19.815

  No H/Q in entry =           3
  In of MODEL   46
    1    H    LEU  11           H        LEU  11  -0.007   2.443 -17.525
    2    HA   LEU  11           HA       LEU  11  -0.568   4.416 -15.571
    3    HB2  LEU  11           HB2      LEU  11  -0.455   1.402 -15.407
    4    HB3  LEU  11           HB3      LEU  11  -0.980   2.420 -14.067
    5    HG   LEU  11           HG       LEU  11  -2.219   2.509 -16.831
    6   HD13  LEU  11          HD11      LEU  11  -2.771   0.359 -16.071
    7   HD12  LEU  11          HD12      LEU  11  -4.136   1.331 -15.528
    8   HD11  LEU  11          HD13      LEU  11  -2.873   0.873 -14.387
    9   HD22  LEU  11          HD21      LEU  11  -2.841   4.518 -15.829
   10   HD21  LEU  11          HD22      LEU  11  -2.756   3.856 -14.197
   11   HD23  LEU  11          HD23      LEU  11  -4.126   3.467 -15.238

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  12           H        ILE  12   2.012   1.988 -15.807
    2    HA   ILE  12           HA       ILE  12   3.209   2.550 -13.305
    3    HB   ILE  12           HB       ILE  12   4.480   1.524 -15.865
    4   HG12  ILE  12          HG12      ILE  12   2.485   0.264 -14.723
    5   HG13  ILE  12          HG13      ILE  12   3.900  -0.652 -15.201
    6   HG21  ILE  12          HG21      ILE  12   5.451   1.492 -12.988
    7   HG23  ILE  12          HG22      ILE  12   6.220   2.287 -14.361
    8   HG22  ILE  12          HG23      ILE  12   6.168   0.527 -14.278
    9   HD11  ILE  12          HD11      ILE  12   3.411   0.454 -12.424
   10   HD13  ILE  12          HD12      ILE  12   4.715  -0.626 -12.914
   11   HD12  ILE  12          HD13      ILE  12   3.060  -1.195 -12.912

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  13           H        ILE  13   3.791   3.815 -16.564
    2    HA   ILE  13           HA       ILE  13   5.902   5.568 -15.844
    3    HB   ILE  13           HB       ILE  13   3.869   5.617 -18.089
    4   HG12  ILE  13          HG12      ILE  13   5.710   3.791 -17.821
    5   HG13  ILE  13          HG13      ILE  13   5.487   4.549 -19.394
    6   HG22  ILE  13          HG21      ILE  13   5.641   7.200 -19.155
    7   HG21  ILE  13          HG22      ILE  13   6.158   7.503 -17.500
    8   HG23  ILE  13          HG23      ILE  13   4.508   7.886 -17.990
    9   HD11  ILE  13          HD11      ILE  13   7.459   5.777 -17.482
   10   HD13  ILE  13          HD12      ILE  13   7.460   5.762 -19.241
   11   HD12  ILE  13          HD13      ILE  13   7.908   4.311 -18.351

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ASN  14           H        ASN  14   2.388   6.010 -16.112
    2    HA   ASN  14           HA       ASN  14   2.305   8.756 -15.482
    3    HB2  ASN  14           HB2      ASN  14   0.436   7.084 -16.308
    4    HB3  ASN  14           HB3      ASN  14   0.118   6.905 -14.587
    5   HD21  ASN  14          HD21      ASN  14  -1.919   8.027 -16.022
    6   HD22  ASN  14          HD22      ASN  14  -2.007   9.700 -15.758

  No H/Q in entry =           6
  In of MODEL   46
    1    H    SER  15           H        SER  15   2.053   5.880 -13.398
    2    HA   SER  15           HA       SER  15   1.726   7.251 -10.953
    3    HB2  SER  15           HB2      SER  15   2.310   5.177  -9.899
    4    HB3  SER  15           HB3      SER  15   1.482   4.742 -11.390
    5    HG   SER  15           HG       SER  15   3.312   4.052 -12.230

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLY  16           H        GLY  16   4.618   6.194 -12.710
    2    HA3  GLY  16           HA2      GLY  16   6.532   6.985 -10.782
    3    HA2  GLY  16           HA3      GLY  16   6.838   6.783 -12.505

  No H/Q in entry =           3
  In of MODEL   46
    1    H    GLN  17           H        GLN  17   5.118   8.712 -13.572
    2    HA   GLN  17           HA       GLN  17   6.658  11.079 -13.270
    3    HB2  GLN  17           HB2      GLN  17   5.323  10.546 -15.304
    4    HB3  GLN  17           HB3      GLN  17   3.846  10.804 -14.375
    5    HG2  GLN  17           HG2      GLN  17   4.372  12.836 -15.610
    6    HG3  GLN  17           HG3      GLN  17   4.600  13.129 -13.887
    7   HE21  GLN  17          HE21      GLN  17   6.230  12.973 -16.979
    8   HE22  GLN  17          HE22      GLN  17   7.773  13.382 -16.402

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ALA  18           H        ALA  18   3.575  10.015 -11.918
    2    HA   ALA  18           HA       ALA  18   2.811  12.394 -10.657
    3    HB1  ALA  18           HB1      ALA  18   1.722   9.919 -10.874
    4    HB2  ALA  18           HB2      ALA  18   1.154  11.133  -9.729
    5    HB3  ALA  18           HB3      ALA  18   2.265   9.870  -9.197

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ARG  19           H        ARG  19   4.730   9.665  -9.372
    2    HA   ARG  19           HA       ARG  19   5.244  10.838  -6.853
    3    HB2  ARG  19           HB2      ARG  19   5.697   8.441  -7.374
    4    HB3  ARG  19           HB3      ARG  19   7.045   8.947  -8.397
    5    HG2  ARG  19           HG2      ARG  19   8.148  10.009  -6.477
    6    HG3  ARG  19           HG3      ARG  19   6.779   9.601  -5.444
    7    HD2  ARG  19           HD2      ARG  19   8.568   7.996  -5.083
    8    HD3  ARG  19           HD3      ARG  19   7.206   7.189  -5.867
    9    HE   ARG  19           HE       ARG  19   8.897   8.031  -7.916
   10   HH21  ARG  19          HH11      ARG  19  10.480   6.651  -8.763
   11   HH22  ARG  19          HH12      ARG  19  11.048   5.314  -7.825
   12   HH11  ARG  19          HH21      ARG  19   9.003   6.009  -5.133
   13   HH12  ARG  19          HH22      ARG  19  10.209   4.951  -5.768

  No H/Q in entry =          13
  In of MODEL   46
    1    H    SER  20           H        SER  20   7.060  10.890  -9.902
    2    HA   SER  20           HA       SER  20   9.281  12.346  -9.082
    3    HB2  SER  20           HB2      SER  20   9.329  11.466 -11.284
    4    HB3  SER  20           HB3      SER  20   7.814  12.252 -11.713
    5    HG   SER  20           HG       SER  20   8.831  14.171 -11.831

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU  21           H        LEU  21   6.160  13.559 -10.281
    2    HA   LEU  21           HA       LEU  21   6.784  16.316 -10.064
    3    HB2  LEU  21           HB2      LEU  21   4.141  14.846  -9.982
    4    HB3  LEU  21           HB3      LEU  21   4.275  16.602  -9.986
    5    HG   LEU  21           HG       LEU  21   5.510  14.832 -12.117
    6   HD11  LEU  21          HD11      LEU  21   3.032  14.614 -12.065
    7   HD13  LEU  21          HD12      LEU  21   3.598  15.429 -13.524
    8   HD12  LEU  21          HD13      LEU  21   2.894  16.367 -12.208
    9   HD21  LEU  21          HD21      LEU  21   5.181  17.804 -11.715
   10   HD23  LEU  21          HD22      LEU  21   5.249  17.165 -13.355
   11   HD22  LEU  21          HD23      LEU  21   6.605  16.923 -12.264

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ALA  22           H        ALA  22   5.312  14.006  -7.810
    2    HA   ALA  22           HA       ALA  22   4.677  15.808  -5.747
    3    HB3  ALA  22           HB1      ALA  22   3.959  13.402  -5.904
    4    HB2  ALA  22           HB2      ALA  22   4.539  13.888  -4.311
    5    HB1  ALA  22           HB3      ALA  22   5.579  12.946  -5.380

  No H/Q in entry =           5
  In of MODEL   46
    1    H    TYR  23           H        TYR  23   7.647  13.834  -6.181
    2    HA   TYR  23           HA       TYR  23   9.012  14.883  -3.932
    3    HB2  TYR  23           HB2      TYR  23   9.834  12.887  -5.085
    4    HB3  TYR  23           HB3      TYR  23  10.131  13.828  -6.547
    5    HD1  TYR  23           HD1      TYR  23  11.112  13.484  -2.964
    6    HD2  TYR  23           HD2      TYR  23  12.133  15.066  -6.825
    7    HE1  TYR  23           HE1      TYR  23  13.359  14.104  -2.117
    8    HE2  TYR  23           HE2      TYR  23  14.379  15.687  -5.976
    9    HH   TYR  23           HH       TYR  23  15.798  14.483  -3.483

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ALA  24           H        ALA  24   8.808  15.978  -7.300
    2    HA   ALA  24           HA       ALA  24  10.665  18.099  -7.060
    3    HB2  ALA  24           HB1      ALA  24  10.221  18.147  -9.269
    4    HB3  ALA  24           HB2      ALA  24   8.652  18.869  -8.911
    5    HB1  ALA  24           HB3      ALA  24   8.810  17.118  -9.036

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA  25           H        ALA  25   7.190  17.851  -6.438
    2    HA   ALA  25           HA       ALA  25   6.659  20.561  -5.875
    3    HB1  ALA  25           HB1      ALA  25   5.036  18.531  -6.071
    4    HB2  ALA  25           HB2      ALA  25   4.644  19.815  -4.925
    5    HB3  ALA  25           HB3      ALA  25   5.363  18.309  -4.351

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU  26           H        LEU  26   7.779  17.907  -3.819
    2    HA   LEU  26           HA       LEU  26   7.857  19.346  -1.385
    3    HB2  LEU  26           HB2      LEU  26   7.998  16.932  -1.373
    4    HB3  LEU  26           HB3      LEU  26   9.468  16.966  -2.345
    5    HG   LEU  26           HG       LEU  26  10.661  18.112  -0.508
    6   HD12  LEU  26          HD11      LEU  26   9.436  18.101   1.752
    7   HD11  LEU  26          HD12      LEU  26   7.951  17.932   0.818
    8   HD13  LEU  26          HD13      LEU  26   8.968  19.358   0.606
    9   HD21  LEU  26          HD21      LEU  26   9.176  15.617   0.372
   10   HD23  LEU  26          HD22      LEU  26  10.681  16.210   1.068
   11   HD22  LEU  26          HD23      LEU  26  10.646  15.646  -0.601

  No H/Q in entry =          11
  In of MODEL   46
    1    H    LYS  27           H        LYS  27  10.284  18.814  -3.909
    2    HA   LYS  27           HA       LYS  27  12.443  20.101  -2.685
    3    HB2  LYS  27           HB2      LYS  27  12.571  18.751  -4.771
    4    HB3  LYS  27           HB3      LYS  27  11.779  20.065  -5.640
    5    HG2  LYS  27           HG2      LYS  27  13.615  21.589  -5.067
    6    HG3  LYS  27           HG3      LYS  27  14.401  20.315  -4.127
    7    HD2  LYS  27           HD2      LYS  27  14.571  18.925  -6.177
    8    HD3  LYS  27           HD3      LYS  27  13.830  20.226  -7.109
    9    HE2  LYS  27           HE2      LYS  27  15.688  21.731  -6.501
   10    HE3  LYS  27           HE3      LYS  27  16.433  20.434  -5.560
   11    HZ3  LYS  27           HZ1      LYS  27  17.420  20.548  -7.747
   12    HZ2  LYS  27           HZ2      LYS  27  15.896  20.397  -8.487
   13    HZ1  LYS  27           HZ3      LYS  27  16.546  19.102  -7.599

  No H/Q in entry =          13
  In of MODEL   46
    1    H    GLN  28           H        GLN  28   9.793  21.425  -4.636
    2    HA   GLN  28           HA       GLN  28  10.698  24.096  -4.797
    3    HB2  GLN  28           HB2      GLN  28   7.886  22.972  -4.679
    4    HB3  GLN  28           HB3      GLN  28   8.269  24.649  -5.065
    5    HG2  GLN  28           HG2      GLN  28   9.315  22.248  -6.593
    6    HG3  GLN  28           HG3      GLN  28   7.953  23.244  -7.103
    7   HE21  GLN  28          HE21      GLN  28  11.064  22.820  -7.899
    8   HE22  GLN  28          HE22      GLN  28  11.524  24.415  -8.257

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ALA  29           H        ALA  29   8.802  22.371  -2.355
    2    HA   ALA  29           HA       ALA  29   8.209  24.556  -0.679
    3    HB2  ALA  29           HB1      ALA  29   7.512  22.977   0.893
    4    HB1  ALA  29           HB2      ALA  29   8.757  21.817   0.431
    5    HB3  ALA  29           HB3      ALA  29   7.365  22.079  -0.618

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LYS  30           H        LYS  30  10.985  22.345  -0.744
    2    HA   LYS  30           HA       LYS  30  12.283  23.332   1.556
    3    HB2  LYS  30           HB2      LYS  30  13.405  22.062  -0.951
    4    HB3  LYS  30           HB3      LYS  30  14.381  22.445   0.469
    5    HG2  LYS  30           HG2      LYS  30  12.857  21.034   1.853
    6    HG3  LYS  30           HG3      LYS  30  11.980  20.591   0.385
    7    HD2  LYS  30           HD2      LYS  30  14.044  19.644  -0.574
    8    HD3  LYS  30           HD3      LYS  30  14.940  20.102   0.876
    9    HE2  LYS  30           HE2      LYS  30  13.465  18.644   2.235
   10    HE3  LYS  30           HE3      LYS  30  12.600  18.166   0.768
   11    HZ2  LYS  30           HZ1      LYS  30  14.424  16.627   1.533
   12    HZ1  LYS  30           HZ2      LYS  30  15.536  17.836   1.078
   13    HZ3  LYS  30           HZ3      LYS  30  14.514  17.128  -0.085

  No H/Q in entry =          13
  In of MODEL   46
    1    H    GLN  31           H        GLN  31  12.149  24.526  -1.744
    2    HA   GLN  31           HA       GLN  31  14.262  26.464  -1.328
    3    HB2  GLN  31           HB2      GLN  31  12.218  26.463  -3.552
    4    HB3  GLN  31           HB3      GLN  31  13.823  27.191  -3.555
    5    HG2  GLN  31           HG2      GLN  31  14.341  24.507  -2.973
    6    HG3  GLN  31           HG3      GLN  31  13.038  24.423  -4.151
    7   HE21  GLN  31          HE21      GLN  31  15.897  23.688  -4.554
    8   HE22  GLN  31          HE22      GLN  31  16.449  24.669  -5.823

  No H/Q in entry =           8
  In of MODEL   46
    1    H    GLY  32           H        GLY  32  11.192  26.221  -0.181
    2    HA3  GLY  32           HA2      GLY  32  10.005  27.769   1.089
    3    HA2  GLY  32           HA3      GLY  32  11.104  29.025   0.535

  No H/Q in entry =           3
  In of MODEL   46
    1    H    ASP  33           H        ASP  33   9.778  27.087  -1.952
    2    HA   ASP  33           HA       ASP  33   8.067  29.323  -2.813
    3    HB2  ASP  33           HB2      ASP  33   9.210  26.923  -4.249
    4    HB3  ASP  33           HB3      ASP  33   8.035  28.012  -4.982

  No H/Q in entry =           4
  In of MODEL   46
    1    H    PHE  34           H        PHE  34   6.389  28.816  -1.247
    2    HA   PHE  34           HA       PHE  34   5.061  26.316  -1.144
    3    HB2  PHE  34           HB2      PHE  34   4.043  29.085  -0.472
    4    HB3  PHE  34           HB3      PHE  34   3.225  27.578  -0.056
    5    HD1  PHE  34           HD1      PHE  34   5.426  30.026   1.151
    6    HD2  PHE  34           HD2      PHE  34   4.833  25.772   1.109
    7    HE1  PHE  34           HE1      PHE  34   6.822  29.810   3.188
    8    HE2  PHE  34           HE2      PHE  34   6.232  25.559   3.144
    9    HZ   PHE  34           HZ       PHE  34   7.220  27.579   4.183

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ALA  35           H        ALA  35   4.571  29.165  -3.163
    2    HA   ALA  35           HA       ALA  35   2.032  28.496  -4.185
    3    HB3  ALA  35           HB1      ALA  35   3.055  29.904  -6.227
    4    HB2  ALA  35           HB2      ALA  35   4.265  30.294  -5.004
    5    HB1  ALA  35           HB3      ALA  35   2.566  30.668  -4.714

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA  36           H        ALA  36   5.274  27.886  -5.539
    2    HA   ALA  36           HA       ALA  36   4.314  26.431  -7.778
    3    HB3  ALA  36           HB1      ALA  36   6.470  26.598  -8.395
    4    HB2  ALA  36           HB2      ALA  36   6.973  25.583  -7.042
    5    HB1  ALA  36           HB3      ALA  36   6.831  27.329  -6.832

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA  37           H        ALA  37   5.292  25.465  -4.521
    2    HA   ALA  37           HA       ALA  37   5.291  22.675  -4.943
    3    HB2  ALA  37           HB1      ALA  37   4.994  24.466  -2.569
    4    HB1  ALA  37           HB2      ALA  37   6.154  23.172  -2.858
    5    HB3  ALA  37           HB3      ALA  37   4.500  22.785  -2.386

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LYS  38           H        LYS  38   2.713  24.833  -3.780
    2    HA   LYS  38           HA       LYS  38   0.652  22.977  -3.551
    3    HB2  LYS  38           HB2      LYS  38   0.946  25.740  -3.307
    4    HB3  LYS  38           HB3      LYS  38  -0.250  25.565  -4.586
    5    HG2  LYS  38           HG2      LYS  38  -1.672  24.215  -3.139
    6    HG3  LYS  38           HG3      LYS  38  -0.426  24.185  -1.883
    7    HD2  LYS  38           HD2      LYS  38  -0.660  26.518  -1.442
    8    HD3  LYS  38           HD3      LYS  38  -1.579  26.784  -2.924
    9    HE2  LYS  38           HE2      LYS  38  -3.082  26.792  -0.984
   10    HE3  LYS  38           HE3      LYS  38  -3.427  25.405  -2.022
   11    HZ3  LYS  38           HZ1      LYS  38  -2.671  23.954  -0.486
   12    HZ2  LYS  38           HZ2      LYS  38  -3.047  25.207   0.600
   13    HZ1  LYS  38           HZ3      LYS  38  -1.448  24.988   0.075

  No H/Q in entry =          13
  In of MODEL   46
    1    H    ALA  39           H        ALA  39   1.591  24.892  -6.405
    2    HA   ALA  39           HA       ALA  39  -0.467  23.977  -8.105
    3    HB2  ALA  39           HB1      ALA  39   2.255  24.679  -9.162
    4    HB1  ALA  39           HB2      ALA  39   1.262  25.922  -8.399
    5    HB3  ALA  39           HB3      ALA  39   0.667  25.068  -9.823

  No H/Q in entry =           5
  In of MODEL   46
    1    H    MET  40           H        MET  40   2.797  22.747  -7.523
    2    HA   MET  40           HA       MET  40   2.741  20.720  -9.509
    3    HB2  MET  40           HB2      MET  40   4.349  20.985  -6.962
    4    HB3  MET  40           HB3      MET  40   4.625  19.731  -8.174
    5    HG2  MET  40           HG2      MET  40   4.620  22.686  -8.847
    6    HG3  MET  40           HG3      MET  40   6.085  21.815  -8.396
    7    HE3  MET  40           HE1      MET  40   7.003  19.611 -11.199
    8    HE2  MET  40           HE2      MET  40   6.447  19.284  -9.560
    9    HE1  MET  40           HE3      MET  40   7.514  20.653  -9.864

  No H/Q in entry =           9
  In of MODEL   46
    1    H    MET  41           H        MET  41   1.827  20.752  -6.085
    2    HA   MET  41           HA       MET  41   1.353  17.978  -5.800
    3    HB2  MET  41           HB2      MET  41  -0.029  20.310  -4.455
    4    HB3  MET  41           HB3      MET  41  -0.149  18.631  -3.942
    5    HG2  MET  41           HG2      MET  41   2.556  18.911  -3.981
    6    HG3  MET  41           HG3      MET  41   2.081  20.561  -3.589
    7    HE2  MET  41           HE1      MET  41  -0.931  19.249  -1.859
    8    HE1  MET  41           HE2      MET  41  -0.146  20.778  -2.241
    9    HE3  MET  41           HE3      MET  41  -0.193  20.210  -0.572

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ASP  42           H        ASP  42  -0.743  20.656  -6.780
    2    HA   ASP  42           HA       ASP  42  -3.154  19.243  -6.912
    3    HB2  ASP  42           HB2      ASP  42  -2.503  21.828  -7.176
    4    HB3  ASP  42           HB3      ASP  42  -2.646  21.425  -8.883

  No H/Q in entry =           4
  In of MODEL   46
    1    H    GLN  43           H        GLN  43  -0.728  19.880  -9.417
    2    HA   GLN  43           HA       GLN  43  -2.087  18.525 -11.502
    3    HB2  GLN  43           HB2      GLN  43   0.860  19.106 -11.123
    4    HB3  GLN  43           HB3      GLN  43   0.159  18.447 -12.603
    5    HG2  GLN  43           HG2      GLN  43  -1.395  20.441 -12.649
    6    HG3  GLN  43           HG3      GLN  43  -0.456  21.121 -11.324
    7   HE21  GLN  43          HE21      GLN  43  -0.330  22.739 -13.414
    8   HE22  GLN  43          HE22      GLN  43   1.089  22.546 -14.322

  No H/Q in entry =           8
  In of MODEL   46
    1    H    SER  44           H        SER  44   0.288  17.442  -9.109
    2    HA   SER  44           HA       SER  44   0.679  14.841 -10.128
    3    HB2  SER  44           HB2      SER  44   1.544  16.305  -7.895
    4    HB3  SER  44           HB3      SER  44   0.711  14.904  -7.221
    5    HG   SER  44           HG       SER  44   2.835  14.329  -7.646

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ARG  45           H        ARG  45  -1.668  16.115  -7.792
    2    HA   ARG  45           HA       ARG  45  -3.003  13.726  -7.150
    3    HB2  ARG  45           HB2      ARG  45  -3.248  15.893  -5.964
    4    HB3  ARG  45           HB3      ARG  45  -4.118  16.537  -7.353
    5    HG2  ARG  45           HG2      ARG  45  -5.847  14.774  -7.064
    6    HG3  ARG  45           HG3      ARG  45  -4.989  14.184  -5.640
    7    HD2  ARG  45           HD2      ARG  45  -5.244  16.449  -4.590
    8    HD3  ARG  45           HD3      ARG  45  -6.243  16.944  -5.973
    9    HE   ARG  45           HE       ARG  45  -7.300  14.547  -4.926
   10   HH21  ARG  45          HH11      ARG  45  -9.137  14.585  -3.655
   11   HH22  ARG  45          HH12      ARG  45  -9.563  16.018  -2.790
   12   HH11  ARG  45          HH21      ARG  45  -6.825  17.807  -3.911
   13   HH12  ARG  45          HH22      ARG  45  -8.249  17.843  -2.933

  No H/Q in entry =          13
  In of MODEL   46
    1    H    MET  46           H        MET  46  -3.640  16.110  -9.707
    2    HA   MET  46           HA       MET  46  -5.953  14.884 -10.765
    3    HB2  MET  46           HB2      MET  46  -3.892  16.752 -11.948
    4    HB3  MET  46           HB3      MET  46  -5.266  16.165 -12.891
    5    HG2  MET  46           HG2      MET  46  -6.826  17.075 -11.245
    6    HG3  MET  46           HG3      MET  46  -5.489  17.589 -10.222
    7    HE2  MET  46           HE1      MET  46  -7.045  19.298 -14.123
    8    HE1  MET  46           HE2      MET  46  -7.296  17.705 -13.415
    9    HE3  MET  46           HE3      MET  46  -5.839  18.025 -14.355

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ALA  47           H        ALA  47  -2.515  14.479 -11.523
    2    HA   ALA  47           HA       ALA  47  -2.823  12.738 -13.728
    3    HB3  ALA  47           HB1      ALA  47  -0.665  13.677 -13.380
    4    HB2  ALA  47           HB2      ALA  47  -0.486  11.953 -13.041
    5    HB1  ALA  47           HB3      ALA  47  -0.604  13.106 -11.711

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU  48           H        LEU  48  -2.538  12.118 -10.253
    2    HA   LEU  48           HA       LEU  48  -2.569   9.276 -10.404
    3    HB2  LEU  48           HB2      LEU  48  -3.375  11.182  -8.195
    4    HB3  LEU  48           HB3      LEU  48  -3.242   9.435  -7.990
    5    HG   LEU  48           HG       LEU  48  -0.982  11.183  -8.992
    6   HD13  LEU  48          HD11      LEU  48  -1.281  11.952  -6.803
    7   HD12  LEU  48          HD12      LEU  48  -0.089  10.672  -6.602
    8   HD11  LEU  48          HD13      LEU  48  -1.781  10.372  -6.203
    9   HD22  LEU  48          HD21      LEU  48  -0.435   9.007  -9.627
   10   HD21  LEU  48          HD22      LEU  48  -1.288   8.276  -8.269
   11   HD23  LEU  48          HD23      LEU  48   0.268   9.065  -8.011

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ASN  49           H        ASN  49  -5.087  11.714 -10.008
    2    HA   ASN  49           HA       ASN  49  -7.235  10.002  -9.464
    3    HB2  ASN  49           HB2      ASN  49  -7.348  12.423  -9.145
    4    HB3  ASN  49           HB3      ASN  49  -7.190  12.684 -10.878
    5   HD21  ASN  49          HD21      ASN  49  -9.408  13.782  -9.715
    6   HD22  ASN  49          HD22      ASN  49 -10.799  12.891 -10.102

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLU  50           H        GLU  50  -5.983  11.219 -12.555
    2    HA   GLU  50           HA       GLU  50  -7.909   9.916 -14.197
    3    HB2  GLU  50           HB2      GLU  50  -6.485  11.765 -15.016
    4    HB3  GLU  50           HB3      GLU  50  -5.067  10.725 -14.875
    5    HG2  GLU  50           HG2      GLU  50  -6.006   9.163 -16.508
    6    HG3  GLU  50           HG3      GLU  50  -7.488  10.108 -16.597

  No H/Q in entry =           6
  In of MODEL   46
    1    H    ALA  51           H        ALA  51  -4.717   8.998 -12.989
    2    HA   ALA  51           HA       ALA  51  -4.523   6.545 -14.400
    3    HB2  ALA  51           HB1      ALA  51  -2.536   6.304 -13.300
    4    HB1  ALA  51           HB2      ALA  51  -3.233   6.715 -11.733
    5    HB3  ALA  51           HB3      ALA  51  -2.806   7.993 -12.871

  No H/Q in entry =           5
  In of MODEL   46
    1    H    HIS  52           H        HIS  52  -5.714   7.359 -11.153
    2    HA   HIS  52           HA       HIS  52  -6.341   4.737 -10.315
    3    HB2  HIS  52           HB2      HIS  52  -6.248   6.663  -8.784
    4    HB3  HIS  52           HB3      HIS  52  -7.675   7.348  -9.561
    5    HD1  HIS  52           HD1      HIS  52  -9.911   5.847  -9.396
    6    HD2  HIS  52           HD2      HIS  52  -6.815   4.771  -6.822
    7    HE1  HIS  52           HE1      HIS  52 -10.940   4.363  -7.620
    8    HE2  HIS  52           HE2      HIS  52  -9.064   3.698  -6.042

  No H/Q in entry =           8
  In of MODEL   46
    1    H    LEU  53           H        LEU  53  -8.215   7.149 -12.109
    2    HA   LEU  53           HA       LEU  53 -10.692   5.802 -12.118
    3    HB2  LEU  53           HB2      LEU  53  -9.451   7.805 -13.993
    4    HB3  LEU  53           HB3      LEU  53 -11.036   7.104 -14.313
    5    HG   LEU  53           HG       LEU  53 -10.333   8.465 -11.690
    6   HD12  LEU  53          HD11      LEU  53 -11.867   9.642 -14.023
    7   HD11  LEU  53          HD12      LEU  53 -10.171   9.997 -13.690
    8   HD13  LEU  53          HD13      LEU  53 -11.414  10.454 -12.529
    9   HD22  LEU  53          HD21      LEU  53 -12.283   7.219 -11.289
   10   HD21  LEU  53          HD22      LEU  53 -12.842   7.383 -12.949
   11   HD23  LEU  53          HD23      LEU  53 -12.973   8.739 -11.843

  No H/Q in entry =          11
  In of MODEL   46
    1    H    VAL  54           H        VAL  54  -7.937   5.659 -14.355
    2    HA   VAL  54           HA       VAL  54  -9.121   3.857 -16.193
    3    HB   VAL  54           HB       VAL  54  -6.225   4.428 -15.512
    4   HG12  VAL  54          HG11      VAL  54  -5.954   3.343 -17.898
    5   HG11  VAL  54          HG12      VAL  54  -7.465   2.530 -17.493
    6   HG13  VAL  54          HG13      VAL  54  -6.045   2.309 -16.473
    7   HG22  VAL  54          HG21      VAL  54  -7.037   6.352 -16.562
    8   HG21  VAL  54          HG22      VAL  54  -8.211   5.460 -17.528
    9   HG23  VAL  54          HG23      VAL  54  -6.503   5.416 -17.958

  No H/Q in entry =           9
  In of MODEL   46
    1    H    GLN  55           H        GLN  55  -7.111   3.362 -13.292
    2    HA   GLN  55           HA       GLN  55  -6.961   0.547 -13.541
    3    HB2  GLN  55           HB2      GLN  55  -5.425   1.481 -12.024
    4    HB3  GLN  55           HB3      GLN  55  -6.662   2.423 -11.197
    5    HG2  GLN  55           HG2      GLN  55  -7.313   0.655  -9.874
    6    HG3  GLN  55           HG3      GLN  55  -7.062  -0.531 -11.150
    7   HE21  GLN  55          HE21      GLN  55  -5.408  -1.944 -10.651
    8   HE22  GLN  55          HE22      GLN  55  -4.032  -1.560  -9.740

  No H/Q in entry =           8
  In of MODEL   46
    1    H    THR  56           H        THR  56  -9.338   2.664 -11.932
    2    HA   THR  56           HA       THR  56 -10.882   0.751 -10.638
    3    HB   THR  56           HB       THR  56 -12.029   3.109 -12.152
    4    HG1  THR  56           HG1      THR  56 -10.235   3.020 -10.142
    5   HG22  THR  56          HG21      THR  56 -12.898   2.019  -9.485
    6   HG21  THR  56          HG22      THR  56 -13.483   1.300 -10.986
    7   HG23  THR  56          HG23      THR  56 -13.816   2.996 -10.630

  No H/Q in entry =           7
  In of MODEL   46
    1    H    LYS  57           H        LYS  57 -11.106   1.820 -14.027
    2    HA   LYS  57           HA       LYS  57 -13.226   0.085 -14.776
    3    HB2  LYS  57           HB2      LYS  57 -12.424   2.038 -16.112
    4    HB3  LYS  57           HB3      LYS  57 -10.931   1.172 -16.443
    5    HG2  LYS  57           HG2      LYS  57 -12.349   0.888 -18.357
    6    HG3  LYS  57           HG3      LYS  57 -12.319  -0.651 -17.504
    7    HD2  LYS  57           HD2      LYS  57 -14.494  -0.306 -16.590
    8    HD3  LYS  57           HD3      LYS  57 -14.493   1.400 -17.028
    9    HE2  LYS  57           HE2      LYS  57 -15.888   0.225 -18.628
   10    HE3  LYS  57           HE3      LYS  57 -14.410   0.697 -19.465
   11    HZ1  LYS  57           HZ1      LYS  57 -14.337  -1.884 -18.146
   12    HZ3  LYS  57           HZ2      LYS  57 -13.741  -1.415 -19.669
   13    HZ2  LYS  57           HZ3      LYS  57 -15.391  -1.774 -19.470

  No H/Q in entry =          13
  In of MODEL   46
    1    H    LEU  58           H        LEU  58  -9.713  -0.271 -14.717
    2    HA   LEU  58           HA       LEU  58  -9.667  -2.792 -15.998
    3    HB2  LEU  58           HB2      LEU  58  -7.661  -1.452 -14.193
    4    HB3  LEU  58           HB3      LEU  58  -7.368  -2.970 -15.043
    5    HG   LEU  58           HG       LEU  58  -8.176  -0.386 -16.414
    6   HD11  LEU  58          HD11      LEU  58  -5.504  -1.564 -15.719
    7   HD13  LEU  58          HD12      LEU  58  -6.035   0.116 -15.675
    8   HD12  LEU  58          HD13      LEU  58  -5.679  -0.652 -17.219
    9   HD22  LEU  58          HD21      LEU  58  -8.718  -1.965 -18.001
   10   HD21  LEU  58          HD22      LEU  58  -7.651  -3.188 -17.315
   11   HD23  LEU  58          HD23      LEU  58  -6.987  -1.903 -18.324

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  59           H        ILE  59 -10.509  -1.897 -12.751
    2    HA   ILE  59           HA       ILE  59 -10.099  -4.653 -11.794
    3    HB   ILE  59           HB       ILE  59  -9.695  -2.382 -10.399
    4   HG12  ILE  59          HG12      ILE  59 -11.055  -4.722  -9.050
    5   HG13  ILE  59          HG13      ILE  59  -9.421  -4.823  -9.657
    6   HG22  ILE  59          HG21      ILE  59 -12.438  -3.121  -9.435
    7   HG21  ILE  59          HG22      ILE  59 -12.259  -1.923 -10.694
    8   HG23  ILE  59          HG23      ILE  59 -11.524  -1.667  -9.114
    9   HD11  ILE  59          HD11      ILE  59 -10.306  -2.646  -7.789
   10   HD13  ILE  59          HD12      ILE  59  -8.656  -3.081  -8.210
   11   HD12  ILE  59          HD13      ILE  59  -9.627  -4.164  -7.211

  No H/Q in entry =          11
  In of MODEL   46
    1    H    GLU  60           H        GLU  60 -12.706  -2.396 -12.611
    2    HA   GLU  60           HA       GLU  60 -14.858  -3.956 -11.594
    3    HB2  GLU  60           HB2      GLU  60 -15.130  -1.594 -12.193
    4    HB3  GLU  60           HB3      GLU  60 -14.785  -1.963 -13.879
    5    HG2  GLU  60           HG2      GLU  60 -16.784  -3.445 -13.940
    6    HG3  GLU  60           HG3      GLU  60 -17.147  -2.990 -12.288

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLY  61           H        GLY  61 -13.183  -3.914 -14.708
    2    HA3  GLY  61           HA2      GLY  61 -14.847  -6.198 -15.592
    3    HA2  GLY  61           HA3      GLY  61 -14.025  -5.079 -16.673

  No H/Q in entry =           3
  In of MODEL   46
    1    H    ASP  62           H        ASP  62 -12.621  -6.487 -13.784
    2    HA   ASP  62           HA       ASP  62 -10.367  -7.457 -15.286
    3    HB2  ASP  62           HB2      ASP  62  -9.592  -8.201 -13.020
    4    HB3  ASP  62           HB3      ASP  62  -9.995  -6.490 -13.108

  No H/Q in entry =           4
  In of MODEL   46
    1    H    ALA  63           H        ALA  63 -13.388  -8.788 -14.909
    2    HA   ALA  63           HA       ALA  63 -13.013 -11.466 -14.163
    3    HB1  ALA  63           HB1      ALA  63 -14.829 -10.276 -16.293
    4    HB2  ALA  63           HB2      ALA  63 -15.236 -10.514 -14.594
    5    HB3  ALA  63           HB3      ALA  63 -14.987 -11.909 -15.647

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLY  64           H        GLY  64 -12.705  -9.928 -17.336
    2    HA3  GLY  64           HA2      GLY  64 -11.671 -10.564 -19.279
    3    HA2  GLY  64           HA3      GLY  64 -10.552 -11.457 -18.258

  No H/Q in entry =           3
  In of MODEL   46
    1    H    GLU  65           H        GLU  65 -10.393 -13.510 -18.928
    2    HA   GLU  65           HA       GLU  65 -12.235 -14.784 -20.604
    3    HB2  GLU  65           HB2      GLU  65 -10.089 -15.931 -18.823
    4    HB3  GLU  65           HB3      GLU  65 -11.007 -16.886 -19.988
    5    HG2  GLU  65           HG2      GLU  65 -10.240 -15.467 -21.817
    6    HG3  GLU  65           HG3      GLU  65  -9.397 -14.415 -20.681

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLY  66           H        GLY  66 -13.553 -16.557 -20.306
    2    HA3  GLY  66           HA2      GLY  66 -15.671 -16.509 -18.729
    3    HA2  GLY  66           HA3      GLY  66 -14.954 -18.034 -19.210

  No H/Q in entry =           3
  In of MODEL   46
    1    H    LYS  67           H        LYS  67 -12.594 -17.843 -17.666
    2    HA   LYS  67           HA       LYS  67 -13.530 -18.926 -15.227
    3    HB2  LYS  67           HB2      LYS  67 -11.156 -19.211 -14.699
    4    HB3  LYS  67           HB3      LYS  67 -11.509 -19.709 -16.359
    5    HG2  LYS  67           HG2      LYS  67 -10.775 -17.496 -17.180
    6    HG3  LYS  67           HG3      LYS  67 -10.412 -17.004 -15.527
    7    HD2  LYS  67           HD2      LYS  67  -8.730 -18.794 -15.354
    8    HD3  LYS  67           HD3      LYS  67  -9.098 -19.302 -17.004
    9    HE2  LYS  67           HE2      LYS  67  -8.409 -17.107 -17.860
   10    HE3  LYS  67           HE3      LYS  67  -8.092 -16.551 -16.217
   11    HZ1  LYS  67           HZ1      LYS  67  -6.561 -18.609 -16.132
   12    HZ3  LYS  67           HZ2      LYS  67  -6.022 -17.210 -16.926
   13    HZ2  LYS  67           HZ3      LYS  67  -6.615 -18.524 -17.825

  No H/Q in entry =          13
  In of MODEL   46
    1    H    MET  68           H        MET  68 -12.923 -18.367 -13.110
    2    HA   MET  68           HA       MET  68 -13.728 -15.811 -12.310
    3    HB2  MET  68           HB2      MET  68 -12.227 -17.940 -10.784
    4    HB3  MET  68           HB3      MET  68 -13.015 -16.540 -10.057
    5    HG2  MET  68           HG2      MET  68 -14.419 -18.628 -11.748
    6    HG3  MET  68           HG3      MET  68 -14.457 -18.564  -9.985
    7    HE1  MET  68           HE1      MET  68 -15.204 -16.910  -8.625
    8    HE3  MET  68           HE2      MET  68 -16.480 -15.736  -8.939
    9    HE2  MET  68           HE3      MET  68 -14.804 -15.322  -9.296

  No H/Q in entry =           9
  In of MODEL   46
    1    H    LYS  69           H        LYS  69 -10.408 -17.127 -12.571
    2    HA   LYS  69           HA       LYS  69  -8.917 -15.349 -11.216
    3    HB2  LYS  69           HB2      LYS  69  -8.258 -17.292 -12.829
    4    HB3  LYS  69           HB3      LYS  69  -8.020 -15.990 -13.998
    5    HG2  LYS  69           HG2      LYS  69  -6.463 -14.864 -12.503
    6    HG3  LYS  69           HG3      LYS  69  -6.782 -16.040 -11.230
    7    HD2  LYS  69           HD2      LYS  69  -4.799 -16.864 -12.145
    8    HD3  LYS  69           HD3      LYS  69  -6.011 -17.787 -13.035
    9    HE2  LYS  69           HE2      LYS  69  -4.314 -16.850 -14.567
   10    HE3  LYS  69           HE3      LYS  69  -5.905 -16.163 -14.885
   11    HZ1  LYS  69           HZ1      LYS  69  -4.317 -14.738 -12.929
   12    HZ3  LYS  69           HZ2      LYS  69  -5.262 -14.143 -14.209
   13    HZ2  LYS  69           HZ3      LYS  69  -3.690 -14.715 -14.504

  No H/Q in entry =          13
  In of MODEL   46
    1    H    VAL  70           H        VAL  70  -7.456 -13.544 -11.910
    2    HA   VAL  70           HA       VAL  70  -8.844 -11.596 -13.662
    3    HB   VAL  70           HB       VAL  70  -8.124  -9.837 -12.077
    4   HG11  VAL  70          HG11      VAL  70 -10.362 -11.055 -11.931
    5   HG13  VAL  70          HG12      VAL  70  -9.836 -10.253 -10.450
    6   HG12  VAL  70          HG13      VAL  70  -9.659 -12.000 -10.618
    7   HG21  VAL  70          HG21      VAL  70  -7.185 -12.212 -10.424
    8   HG23  VAL  70          HG22      VAL  70  -7.331 -10.569  -9.806
    9   HG22  VAL  70          HG23      VAL  70  -6.169 -10.930 -11.082

  No H/Q in entry =           9
  In of MODEL   46
    1    H    SER  71           H        SER  71  -7.372  -9.851 -14.400
    2    HA   SER  71           HA       SER  71  -5.073 -10.862 -15.693
    3    HB2  SER  71           HB2      SER  71  -6.382  -8.857 -16.439
    4    HB3  SER  71           HB3      SER  71  -5.719  -7.969 -15.070
    5    HG   SER  71           HG       SER  71  -3.999  -9.353 -16.805

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU  72           H        LEU  72  -3.068 -11.131 -15.013
    2    HA   LEU  72           HA       LEU  72  -2.355 -10.892 -12.302
    3    HB2  LEU  72           HB2      LEU  72  -0.688 -11.292 -14.781
    4    HB3  LEU  72           HB3      LEU  72  -0.030 -11.351 -13.149
    5    HG   LEU  72           HG       LEU  72  -2.339 -13.091 -14.072
    6   HD13  LEU  72          HD11      LEU  72  -0.784 -14.854 -14.468
    7   HD12  LEU  72          HD12      LEU  72   0.537 -13.952 -13.726
    8   HD11  LEU  72          HD13      LEU  72  -0.108 -13.445 -15.287
    9   HD22  LEU  72          HD21      LEU  72  -2.382 -13.093 -11.723
   10   HD21  LEU  72          HD22      LEU  72  -0.639 -12.931 -11.580
   11   HD23  LEU  72          HD23      LEU  72  -1.342 -14.470 -12.068

  No H/Q in entry =          11
  In of MODEL   46
    1    H    VAL  73           H        VAL  73  -1.679  -8.871 -15.089
    2    HA   VAL  73           HA       VAL  73   0.206  -7.129 -13.990
    3    HB   VAL  73           HB       VAL  73  -0.212  -5.728 -15.853
    4   HG13  VAL  73          HG11      VAL  73  -0.066  -7.278 -17.661
    5   HG12  VAL  73          HG12      VAL  73  -1.029  -8.480 -16.803
    6   HG11  VAL  73          HG13      VAL  73   0.610  -8.116 -16.265
    7   HG23  VAL  73          HG21      VAL  73  -2.374  -6.359 -17.246
    8   HG22  VAL  73          HG22      VAL  73  -2.485  -5.240 -15.888
    9   HG21  VAL  73          HG23      VAL  73  -2.957  -6.927 -15.681

  No H/Q in entry =           9
  In of MODEL   46
    1    H    LEU  74           H        LEU  74  -3.189  -7.313 -13.434
    2    HA   LEU  74           HA       LEU  74  -3.862  -4.668 -12.832
    3    HB2  LEU  74           HB2      LEU  74  -5.552  -6.378 -13.002
    4    HB3  LEU  74           HB3      LEU  74  -4.848  -7.270 -11.657
    5    HG   LEU  74           HG       LEU  74  -5.357  -5.383 -10.140
    6   HD11  LEU  74          HD11      LEU  74  -6.376  -4.181 -12.715
    7   HD13  LEU  74          HD12      LEU  74  -5.294  -3.460 -11.526
    8   HD12  LEU  74          HD13      LEU  74  -7.006  -3.662 -11.153
    9   HD21  LEU  74          HD21      LEU  74  -7.011  -7.281 -10.979
   10   HD23  LEU  74          HD22      LEU  74  -7.874  -5.889 -11.595
   11   HD22  LEU  74          HD23      LEU  74  -7.548  -6.011  -9.883

  No H/Q in entry =          11
  In of MODEL   46
    1    H    VAL  75           H        VAL  75  -2.770  -7.225 -10.660
    2    HA   VAL  75           HA       VAL  75  -2.605  -5.662  -8.322
    3    HB   VAL  75           HB       VAL  75  -1.054  -8.127  -9.101
    4   HG12  VAL  75          HG11      VAL  75  -0.617  -8.260  -6.615
    5   HG11  VAL  75          HG12      VAL  75  -1.301  -6.650  -6.456
    6   HG13  VAL  75          HG13      VAL  75   0.175  -6.885  -7.377
    7   HG22  VAL  75          HG21      VAL  75  -3.423  -8.555  -8.938
    8   HG21  VAL  75          HG22      VAL  75  -3.560  -7.575  -7.478
    9   HG23  VAL  75          HG23      VAL  75  -2.704  -9.118  -7.429

  No H/Q in entry =           9
  In of MODEL   46
    1    H    GLU  76           H        GLU  76  -0.179  -6.382 -10.854
    2    HA   GLU  76           HA       GLU  76   1.978  -4.986  -9.700
    3    HB2  GLU  76           HB2      GLU  76   2.218  -6.462 -11.675
    4    HB3  GLU  76           HB3      GLU  76   1.276  -5.334 -12.638
    5    HG2  GLU  76           HG2      GLU  76   3.608  -4.947 -13.135
    6    HG3  GLU  76           HG3      GLU  76   3.049  -3.578 -12.192

  No H/Q in entry =           6
  In of MODEL   46
    1    H    ALA  77           H        ALA  77  -0.577  -3.844 -11.894
    2    HA   ALA  77           HA       ALA  77   0.359  -1.179 -12.079
    3    HB1  ALA  77           HB1      ALA  77  -1.230  -1.839 -13.699
    4    HB2  ALA  77           HB2      ALA  77  -2.109  -0.718 -12.659
    5    HB3  ALA  77           HB3      ALA  77  -2.345  -2.456 -12.479

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLN  78           H        GLN  78  -1.879  -2.773  -9.864
    2    HA   GLN  78           HA       GLN  78  -2.735  -0.467  -8.472
    3    HB2  GLN  78           HB2      GLN  78  -3.797  -2.750  -8.380
    4    HB3  GLN  78           HB3      GLN  78  -2.450  -3.276  -7.374
    5    HG2  GLN  78           HG2      GLN  78  -3.007  -1.548  -5.716
    6    HG3  GLN  78           HG3      GLN  78  -4.351  -1.009  -6.721
    7   HE21  GLN  78          HE21      GLN  78  -4.791  -1.995  -4.060
    8   HE22  GLN  78          HE22      GLN  78  -5.633  -3.464  -4.174

  No H/Q in entry =           8
  In of MODEL   46
    1    H    LEU  79           H        LEU  79  -0.010  -2.664  -8.011
    2    HA   LEU  79           HA       LEU  79   0.945  -1.739  -5.556
    3    HB2  LEU  79           HB2      LEU  79   1.858  -3.732  -6.616
    4    HB3  LEU  79           HB3      LEU  79   2.485  -2.772  -7.953
    5    HG   LEU  79           HG       LEU  79   4.015  -1.594  -6.452
    6   HD13  LEU  79          HD11      LEU  79   3.003  -1.363  -4.386
    7   HD12  LEU  79          HD12      LEU  79   4.110  -2.688  -4.037
    8   HD11  LEU  79          HD13      LEU  79   2.412  -3.025  -4.367
    9   HD23  LEU  79          HD21      LEU  79   5.270  -3.713  -5.540
   10   HD22  LEU  79          HD22      LEU  79   5.064  -3.524  -7.279
   11   HD21  LEU  79          HD23      LEU  79   4.009  -4.614  -6.383

  No H/Q in entry =          11
  In of MODEL   46
    1    H    HIS  80           H        HIS  80   1.794  -0.615  -8.832
    2    HA   HIS  80           HA       HIS  80   3.557   1.415  -7.916
    3    HB2  HIS  80           HB2      HIS  80   2.286   0.683 -10.497
    4    HB3  HIS  80           HB3      HIS  80   2.844   2.349 -10.332
    5    HD1  HIS  80           HD1      HIS  80   5.239   2.700 -10.853
    6    HD2  HIS  80           HD2      HIS  80   4.504  -1.224  -9.648
    7    HE1  HIS  80           HE1      HIS  80   7.456   1.470 -11.012
    8    HE2  HIS  80           HE2      HIS  80   7.020  -0.924 -10.281

  No H/Q in entry =           8
  In of MODEL   46
    1    H    LEU  81           H        LEU  81   0.151   1.496  -8.899
    2    HA   LEU  81           HA       LEU  81  -0.186   4.283  -8.579
    3    HB2  LEU  81           HB2      LEU  81  -2.150   1.994  -8.494
    4    HB3  LEU  81           HB3      LEU  81  -2.640   3.687  -8.408
    5    HG   LEU  81           HG       LEU  81  -0.920   2.567 -10.638
    6   HD12  LEU  81          HD11      LEU  81  -3.157   2.832 -11.941
    7   HD11  LEU  81          HD12      LEU  81  -3.913   2.753 -10.350
    8   HD13  LEU  81          HD13      LEU  81  -2.939   1.404 -10.931
    9   HD23  LEU  81          HD21      LEU  81  -2.063   4.683 -11.744
   10   HD22  LEU  81          HD22      LEU  81  -0.652   4.888 -10.710
   11   HD21  LEU  81          HD23      LEU  81  -2.265   5.203 -10.073

  No H/Q in entry =          11
  In of MODEL   46
    1    H    MET  82           H        MET  82  -0.787   1.590  -6.321
    2    HA   MET  82           HA       MET  82  -1.877   3.159  -4.241
    3    HB2  MET  82           HB2      MET  82  -0.443   0.504  -4.269
    4    HB3  MET  82           HB3      MET  82  -1.039   1.221  -2.774
    5    HG2  MET  82           HG2      MET  82  -2.757   0.680  -5.216
    6    HG3  MET  82           HG3      MET  82  -2.657  -0.387  -3.817
    7    HE3  MET  82           HE1      MET  82  -4.419   1.232  -1.009
    8    HE2  MET  82           HE2      MET  82  -2.696   1.549  -1.193
    9    HE1  MET  82           HE3      MET  82  -3.348  -0.026  -1.642

  No H/Q in entry =           9
  In of MODEL   46
    1    H    THR  83           H        THR  83   1.448   2.147  -4.923
    2    HA   THR  83           HA       THR  83   2.638   3.286  -2.625
    3    HB   THR  83           HB       THR  83   4.735   3.274  -4.096
    4    HG1  THR  83           HG1      THR  83   4.510   2.735  -6.119
    5   HG22  THR  83          HG21      THR  83   4.352   0.605  -4.420
    6   HG21  THR  83          HG22      THR  83   3.053   0.959  -3.282
    7   HG23  THR  83          HG23      THR  83   4.724   1.342  -2.862

  No H/Q in entry =           7
  In of MODEL   46
    1    H    SER  84           H        SER  84   2.242   4.546  -5.930
    2    HA   SER  84           HA       SER  84   3.524   7.018  -5.481
    3    HB2  SER  84           HB2      SER  84   1.476   6.131  -7.500
    4    HB3  SER  84           HB3      SER  84   2.117   7.774  -7.480
    5    HG   SER  84           HG       SER  84   3.546   5.330  -7.761

  No H/Q in entry =           5
  In of MODEL   46
    1    H    MET  85           H        MET  85   0.048   6.182  -5.311
    2    HA   MET  85           HA       MET  85  -0.873   8.774  -4.719
    3    HB2  MET  85           HB2      MET  85  -2.357   6.936  -5.384
    4    HB3  MET  85           HB3      MET  85  -2.046   6.130  -3.847
    5    HG2  MET  85           HG2      MET  85  -2.988   8.047  -2.629
    6    HG3  MET  85           HG3      MET  85  -3.254   8.895  -4.151
    7    HE1  MET  85           HE1      MET  85  -3.812   5.949  -2.016
    8    HE3  MET  85           HE2      MET  85  -4.012   4.877  -3.400
    9    HE2  MET  85           HE3      MET  85  -5.407   5.291  -2.409

  No H/Q in entry =           9
  In of MODEL   46
    1    H    LEU  86           H        LEU  86   0.104   6.140  -2.566
    2    HA   LEU  86           HA       LEU  86  -0.461   7.439  -0.129
    3    HB2  LEU  86           HB2      LEU  86   0.059   4.977  -0.514
    4    HB3  LEU  86           HB3      LEU  86   1.756   5.445  -0.609
    5    HG   LEU  86           HG       LEU  86   1.403   6.605   1.655
    6   HD11  LEU  86          HD11      LEU  86  -1.273   5.778   1.184
    7   HD13  LEU  86          HD12      LEU  86  -0.625   6.544   2.633
    8   HD12  LEU  86          HD13      LEU  86  -0.677   4.787   2.519
    9   HD23  LEU  86          HD21      LEU  86   1.040   3.605   1.787
   10   HD22  LEU  86          HD22      LEU  86   2.019   4.639   2.824
   11   HD21  LEU  86          HD23      LEU  86   2.529   4.320   1.167

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ALA  87           H        ALA  87   2.528   7.204  -2.014
    2    HA   ALA  87           HA       ALA  87   4.201   8.656  -0.292
    3    HB3  ALA  87           HB1      ALA  87   4.321   7.637  -2.996
    4    HB2  ALA  87           HB2      ALA  87   5.646   8.000  -1.895
    5    HB1  ALA  87           HB3      ALA  87   5.006   9.263  -2.943

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ARG  88           H        ARG  88   2.232   9.741  -3.018
    2    HA   ARG  88           HA       ARG  88   2.949  12.447  -2.908
    3    HB2  ARG  88           HB2      ARG  88   1.721  11.263  -4.763
    4    HB3  ARG  88           HB3      ARG  88   0.261  11.378  -3.782
    5    HG2  ARG  88           HG2      ARG  88   1.225  13.980  -3.706
    6    HG3  ARG  88           HG3      ARG  88   1.662  13.470  -5.334
    7    HD2  ARG  88           HD2      ARG  88  -0.480  13.503  -6.034
    8    HD3  ARG  88           HD3      ARG  88  -1.050  12.642  -4.604
    9    HE   ARG  88           HE       ARG  88  -1.297  15.414  -5.030
   10   HH21  ARG  88          HH11      ARG  88  -1.854  16.737  -3.297
   11   HH22  ARG  88          HH12      ARG  88  -1.548  16.211  -1.677
   12   HH11  ARG  88          HH21      ARG  88  -0.237  13.180  -2.648
   13   HH12  ARG  88          HH22      ARG  88  -0.650  14.191  -1.310

  No H/Q in entry =          13
  In of MODEL   46
    1    H    GLU  89           H        GLU  89   0.280  10.722  -1.266
    2    HA   GLU  89           HA       GLU  89  -0.876  13.014  -0.068
    3    HB2  GLU  89           HB2      GLU  89  -1.948  10.752  -0.149
    4    HB3  GLU  89           HB3      GLU  89  -0.814  10.223   1.094
    5    HG2  GLU  89           HG2      GLU  89  -1.670  11.910   2.648
    6    HG3  GLU  89           HG3      GLU  89  -2.735  12.555   1.401

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LEU  90           H        LEU  90   1.620  10.776   1.114
    2    HA   LEU  90           HA       LEU  90   1.949  12.034   3.640
    3    HB2  LEU  90           HB2      LEU  90   3.759  10.291   1.970
    4    HB3  LEU  90           HB3      LEU  90   4.166  10.821   3.607
    5    HG   LEU  90           HG       LEU  90   1.559   9.421   2.948
    6   HD12  LEU  90          HD11      LEU  90   2.739   7.401   3.963
    7   HD11  LEU  90          HD12      LEU  90   4.244   8.287   3.720
    8   HD13  LEU  90          HD13      LEU  90   3.242   7.855   2.333
    9   HD22  LEU  90          HD21      LEU  90   1.275  10.345   5.067
   10   HD21  LEU  90          HD22      LEU  90   2.994  10.273   5.451
   11   HD23  LEU  90          HD23      LEU  90   2.017   8.806   5.502

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  91           H        ILE  91   3.547  12.440   0.514
    2    HA   ILE  91           HA       ILE  91   5.486  14.312   1.349
    3    HB   ILE  91           HB       ILE  91   4.187  13.788  -1.330
    4   HG12  ILE  91          HG12      ILE  91   7.027  13.359  -0.353
    5   HG13  ILE  91          HG13      ILE  91   5.769  12.137  -0.188
    6   HG22  ILE  91          HG21      ILE  91   6.383  15.176  -2.021
    7   HG21  ILE  91          HG22      ILE  91   6.056  15.975  -0.482
    8   HG23  ILE  91          HG23      ILE  91   4.834  15.976  -1.752
    9   HD13  ILE  91          HD11      ILE  91   5.604  11.804  -2.494
   10   HD12  ILE  91          HD12      ILE  91   7.333  12.081  -2.280
   11   HD11  ILE  91          HD13      ILE  91   6.298  13.383  -2.871

  No H/Q in entry =          11
  In of MODEL   46
    1    H    THR  92           H        THR  92   2.117  14.676   0.338
    2    HA   THR  92           HA       THR  92   2.037  17.498   0.270
    3    HB   THR  92           HB       THR  92  -0.092  15.464   0.973
    4    HG1  THR  92           HG1      THR  92   0.217  15.285  -1.111
    5   HG22  THR  92          HG21      THR  92  -1.534  17.596   0.244
    6   HG21  THR  92          HG22      THR  92  -0.159  18.450   0.940
    7   HG23  THR  92          HG23      THR  92  -1.079  17.314   1.924

  No H/Q in entry =           7
  In of MODEL   46
    1    H    GLU  93           H        GLU  93   1.531  15.195   2.929
    2    HA   GLU  93           HA       GLU  93   0.961  17.094   4.942
    3    HB2  GLU  93           HB2      GLU  93   2.326  14.396   5.187
    4    HB3  GLU  93           HB3      GLU  93   1.616  15.313   6.517
    5    HG2  GLU  93           HG2      GLU  93   0.021  14.497   4.079
    6    HG3  GLU  93           HG3      GLU  93   0.141  13.481   5.510

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LEU  94           H        LEU  94   3.996  15.667   3.799
    2    HA   LEU  94           HA       LEU  94   5.723  16.853   5.685
    3    HB2  LEU  94           HB2      LEU  94   6.145  15.885   2.857
    4    HB3  LEU  94           HB3      LEU  94   7.461  16.571   3.805
    5    HG   LEU  94           HG       LEU  94   5.763  14.346   4.945
    6   HD11  LEU  94          HD11      LEU  94   7.864  14.154   2.816
    7   HD13  LEU  94          HD12      LEU  94   6.437  13.153   3.079
    8   HD12  LEU  94          HD13      LEU  94   7.866  12.930   4.088
    9   HD23  LEU  94          HD21      LEU  94   7.962  13.854   6.101
   10   HD22  LEU  94          HD22      LEU  94   7.264  15.420   6.512
   11   HD21  LEU  94          HD23      LEU  94   8.606  15.322   5.371

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  95           H        ILE  95   4.564  17.994   2.531
    2    HA   ILE  95           HA       ILE  95   6.091  20.380   2.466
    3    HB   ILE  95           HB       ILE  95   3.461  19.643   1.161
    4   HG12  ILE  95          HG12      ILE  95   6.244  20.030   0.025
    5   HG13  ILE  95          HG13      ILE  95   5.624  18.466   0.543
    6   HG21  ILE  95          HG21      ILE  95   5.163  22.142   0.935
    7   HG23  ILE  95          HG22      ILE  95   3.440  22.043   1.290
    8   HG22  ILE  95          HG23      ILE  95   4.031  21.649  -0.325
    9   HD13  ILE  95          HD11      ILE  95   4.067  18.356  -1.187
   10   HD12  ILE  95          HD12      ILE  95   5.401  19.197  -1.976
   11   HD11  ILE  95          HD13      ILE  95   4.010  20.107  -1.387

  No H/Q in entry =          11
  In of MODEL   46
    1    H    GLU  96           H        GLU  96   2.854  19.670   3.761
    2    HA   GLU  96           HA       GLU  96   2.183  22.307   4.504
    3    HB2  GLU  96           HB2      GLU  96   0.542  20.492   4.520
    4    HB3  GLU  96           HB3      GLU  96   1.419  19.685   5.818
    5    HG2  GLU  96           HG2      GLU  96   0.373  20.953   7.383
    6    HG3  GLU  96           HG3      GLU  96   0.881  22.435   6.582

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LEU  97           H        LEU  97   4.072  19.796   6.138
    2    HA   LEU  97           HA       LEU  97   4.402  21.158   8.605
    3    HB2  LEU  97           HB2      LEU  97   5.981  19.014   7.198
    4    HB3  LEU  97           HB3      LEU  97   6.557  19.714   8.708
    5    HG   LEU  97           HG       LEU  97   3.769  18.567   8.398
    6   HD12  LEU  97          HD11      LEU  97   4.745  16.576   9.617
    7   HD11  LEU  97          HD12      LEU  97   6.345  17.236   9.273
    8   HD13  LEU  97          HD13      LEU  97   5.285  16.755   7.948
    9   HD23  LEU  97          HD21      LEU  97   4.225  18.289  10.964
   10   HD22  LEU  97          HD22      LEU  97   3.815  19.891  10.355
   11   HD21  LEU  97          HD23      LEU  97   5.494  19.484  10.702

  No H/Q in entry =          11
  In of MODEL   46
    1    H    HIS  98           H        HIS  98   6.275  21.200   5.581
    2    HA   HIS  98           HA       HIS  98   8.398  22.822   6.477
    3    HB2  HIS  98           HB2      HIS  98   7.112  22.536   3.751
    4    HB3  HIS  98           HB3      HIS  98   8.533  23.541   4.040
    5    HD1  HIS  98           HD1      HIS  98   7.388  19.949   4.068
    6    HD2  HIS  98           HD2      HIS  98  10.930  22.112   4.490
    7    HE1  HIS  98           HE1      HIS  98   9.274  18.254   4.018
    8    HE2  HIS  98           HE2      HIS  98  11.436  19.551   4.275

  No H/Q in entry =           8
  In of MODEL   46
    1    H    GLU  99           H        GLU  99   5.163  23.594   5.297
    2    HA   GLU  99           HA       GLU  99   5.490  26.416   5.232
    3    HB2  GLU  99           HB2      GLU  99   3.634  25.209   4.103
    4    HB3  GLU  99           HB3      GLU  99   2.943  24.839   5.682
    5    HG2  GLU  99           HG2      GLU  99   2.719  27.229   6.177
    6    HG3  GLU  99           HG3      GLU  99   3.489  27.639   4.647

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LYS 100           H        LYS 100   4.399  24.167   7.759
    2    HA   LYS 100           HA       LYS 100   3.774  26.215   9.647
    3    HB2  LYS 100           HB2      LYS 100   4.402  23.276  10.001
    4    HB3  LYS 100           HB3      LYS 100   3.934  24.344  11.330
    5    HG2  LYS 100           HG2      LYS 100   1.858  24.940  10.079
    6    HG3  LYS 100           HG3      LYS 100   2.307  23.776   8.830
    7    HD2  LYS 100           HD2      LYS 100   2.261  21.958  10.496
    8    HD3  LYS 100           HD3      LYS 100   1.829  23.117  11.756
    9    HE2  LYS 100           HE2      LYS 100  -0.234  23.698  10.490
   10    HE3  LYS 100           HE3      LYS 100   0.189  22.482   9.278
   11    HZ1  LYS 100           HZ1      LYS 100  -0.067  21.818  12.160
   12    HZ3  LYS 100           HZ2      LYS 100  -0.062  20.761  10.828
   13    HZ2  LYS 100           HZ3      LYS 100  -1.396  21.777  11.104

  No H/Q in entry =          13
  In of MODEL   46
    1    H    LEU 101           H        LEU 101   6.730  24.470   8.820
    2    HA   LEU 101           HA       LEU 101   8.311  25.345  11.022
    3    HB2  LEU 101           HB2      LEU 101   8.925  24.361   8.247
    4    HB3  LEU 101           HB3      LEU 101  10.214  25.053   9.228
    5    HG   LEU 101           HG       LEU 101   8.421  22.867  10.296
    6   HD12  LEU 101          HD11      LEU 101  10.501  21.407   9.694
    7   HD11  LEU 101          HD12      LEU 101  10.847  22.673   8.518
    8   HD13  LEU 101          HD13      LEU 101   9.334  21.773   8.425
    9   HD21  LEU 101          HD21      LEU 101  11.124  24.025  11.023
   10   HD23  LEU 101          HD22      LEU 101  10.608  22.445  11.606
   11   HD22  LEU 101          HD23      LEU 101   9.690  23.886  12.040

  No H/Q in entry =          11
  In of MODEL   46
    1    H    LYS 102           H        LYS 102   6.697  27.174   8.875
    2    HA   LYS 102           HA       LYS 102   6.734  29.467   8.577
    3    HB2  LYS 102           HB2      LYS 102   8.298  29.385  10.677
    4    HB3  LYS 102           HB3      LYS 102   9.595  29.600   9.518
    5    HG2  LYS 102           HG2      LYS 102   7.454  31.517  10.373
    6    HG3  LYS 102           HG3      LYS 102   9.162  31.807  10.122
    7    HD2  LYS 102           HD2      LYS 102   7.221  31.343   7.822
    8    HD3  LYS 102           HD3      LYS 102   7.575  32.931   8.487
    9    HE2  LYS 102           HE2      LYS 102   8.971  31.766   6.417
   10    HE3  LYS 102           HE3      LYS 102   9.563  33.086   7.426
   11    HZ2  LYS 102           HZ1      LYS 102  11.117  31.208   7.257
   12    HZ1  LYS 102           HZ2      LYS 102   9.972  30.207   8.001
   13    HZ3  LYS 102           HZ3      LYS 102  10.641  31.508   8.857

  No H/Q in entry =          13
  In of MODEL   46
    1    H    ALA 103           H        ALA 103  10.014  28.184   8.019
    2    HA   ALA 103           HA       ALA 103  10.955  29.572   5.940
    3    HB2  ALA 103           HB1      ALA 103  11.880  27.371   5.019
    4    HB1  ALA 103           HB2      ALA 103  10.998  26.585   6.326
    5    HB3  ALA 103           HB3      ALA 103  12.266  27.753   6.697

  No H/Q in entry =           5
  In of MODEL   46
    1    H1   LYS   3           H1       LYS   3 -30.773   6.694 -19.597
    2    H2   LYS   3           H3       LYS   3 -29.801   6.367 -20.949
    3    H3   LYS   3           H2       LYS   3 -31.229   5.484 -20.697
    4    HA   LYS   3           HA       LYS   3 -30.276   4.060 -19.294
    5    HB2  LYS   3           HB2      LYS   3 -27.946   5.383 -20.635
    6    HB3  LYS   3           HB3      LYS   3 -27.664   4.165 -19.391
    7    HG2  LYS   3           HG2      LYS   3 -29.148   2.632 -20.735
    8    HG3  LYS   3           HG3      LYS   3 -29.062   3.829 -22.027
    9    HD2  LYS   3           HD2      LYS   3 -26.585   3.620 -21.984
   10    HD3  LYS   3           HD3      LYS   3 -26.750   2.328 -20.795
   11    HE2  LYS   3           HE2      LYS   3 -28.297   1.209 -22.506
   12    HE3  LYS   3           HE3      LYS   3 -27.637   2.361 -23.665
   13    HZ3  LYS   3           HZ1      LYS   3 -25.887   1.065 -23.938
   14    HZ2  LYS   3           HZ2      LYS   3 -26.557  -0.077 -22.874
   15    HZ1  LYS   3           HZ3      LYS   3 -25.520   1.129 -22.281

  No H/Q in entry =          15
  In of MODEL   46
    1    H    LYS   4           H        LYS   4 -30.327   3.922 -17.232
    2    HA   LYS   4           HA       LYS   4 -29.505   6.181 -15.587
    3    HB2  LYS   4           HB2      LYS   4 -30.808   3.538 -14.881
    4    HB3  LYS   4           HB3      LYS   4 -30.531   4.868 -13.756
    5    HG2  LYS   4           HG2      LYS   4 -32.347   4.874 -16.173
    6    HG3  LYS   4           HG3      LYS   4 -32.831   4.945 -14.479
    7    HD2  LYS   4           HD2      LYS   4 -32.047   7.138 -14.218
    8    HD3  LYS   4           HD3      LYS   4 -31.015   7.038 -15.643
    9    HE2  LYS   4           HE2      LYS   4 -32.887   8.486 -16.103
   10    HE3  LYS   4           HE3      LYS   4 -33.028   7.017 -17.068
   11    HZ3  LYS   4           HZ1      LYS   4 -34.633   6.168 -15.515
   12    HZ2  LYS   4           HZ2      LYS   4 -35.131   7.684 -16.099
   13    HZ1  LYS   4           HZ3      LYS   4 -34.474   7.549 -14.539

  No H/Q in entry =          13
  In of MODEL   46
    1    H    HIS   5           H        HIS   5 -28.029   6.211 -14.000
    2    HA   HIS   5           HA       HIS   5 -25.822   4.291 -14.336
    3    HB2  HIS   5           HB2      HIS   5 -25.963   7.055 -13.133
    4    HB3  HIS   5           HB3      HIS   5 -24.521   6.043 -13.119
    5    HD1  HIS   5           HD1      HIS   5 -23.009   7.181 -14.715
    6    HD2  HIS   5           HD2      HIS   5 -26.836   6.711 -16.256
    7    HE1  HIS   5           HE1      HIS   5 -22.825   7.751 -17.166
    8    HE2  HIS   5           HE2      HIS   5 -25.159   7.452 -18.074

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ILE   6           H        ILE   6 -25.653   2.712 -13.018
    2    HA   ILE   6           HA       ILE   6 -26.608   3.023 -10.251
    3    HB   ILE   6           HB       ILE   6 -25.889   0.522 -11.788
    4   HG12  ILE   6          HG12      ILE   6 -28.589   1.572 -10.930
    5   HG13  ILE   6          HG13      ILE   6 -27.946   1.705 -12.566
    6   HG23  ILE   6          HG21      ILE   6 -26.307  -0.711  -9.925
    7   HG22  ILE   6          HG22      ILE   6 -27.415   0.482  -9.244
    8   HG21  ILE   6          HG23      ILE   6 -25.673   0.747  -9.160
    9   HD13  ILE   6          HD11      ILE   6 -28.493  -0.394 -13.061
   10   HD12  ILE   6          HD12      ILE   6 -29.503  -0.334 -11.616
   11   HD11  ILE   6          HD13      ILE   6 -27.875  -1.008 -11.529

  No H/Q in entry =          11
  In of MODEL   46
    1    H    TYR   7           H        TYR   7 -24.820   3.593  -8.971
    2    HA   TYR   7           HA       TYR   7 -22.153   2.524  -9.657
    3    HB2  TYR   7           HB2      TYR   7 -23.011   4.998  -8.177
    4    HB3  TYR   7           HB3      TYR   7 -21.349   4.414  -8.220
    5    HD1  TYR   7           HD1      TYR   7 -22.436   3.511 -11.305
    6    HD2  TYR   7           HD2      TYR   7 -21.612   7.055  -9.086
    7    HE1  TYR   7           HE1      TYR   7 -21.961   4.719 -13.399
    8    HE2  TYR   7           HE2      TYR   7 -21.178   8.270 -11.172
    9    HH   TYR   7           HH       TYR   7 -21.407   8.190 -13.403

  No H/Q in entry =           9
  In of MODEL   46
    1    H    LEU   8           H        LEU   8 -21.239   1.135  -8.329
    2    HA   LEU   8           HA       LEU   8 -22.382   0.691  -5.642
    3    HB2  LEU   8           HB2      LEU   8 -20.755  -1.044  -7.479
    4    HB3  LEU   8           HB3      LEU   8 -20.950  -1.415  -5.766
    5    HG   LEU   8           HG       LEU   8 -23.437  -1.486  -6.180
    6   HD13  LEU   8          HD11      LEU   8 -23.524  -0.268  -8.292
    7   HD12  LEU   8          HD12      LEU   8 -24.123  -1.909  -8.527
    8   HD11  LEU   8          HD13      LEU   8 -22.497  -1.478  -9.058
    9   HD23  LEU   8          HD21      LEU   8 -22.254  -3.580  -7.875
   10   HD22  LEU   8          HD22      LEU   8 -23.342  -3.700  -6.493
   11   HD21  LEU   8          HD23      LEU   8 -21.622  -3.418  -6.237

  No H/Q in entry =          11
  In of MODEL   46
    1    H    PHE   9           H        PHE   9 -21.094   1.045  -3.860
    2    HA   PHE   9           HA       PHE   9 -18.272   1.854  -4.386
    3    HB2  PHE   9           HB2      PHE   9 -20.197   3.009  -2.369
    4    HB3  PHE   9           HB3      PHE   9 -18.484   3.399  -2.463
    5    HD1  PHE   9           HD1      PHE   9 -17.590   4.743  -4.264
    6    HD2  PHE   9           HD2      PHE   9 -21.760   3.739  -4.139
    7    HE1  PHE   9           HE1      PHE   9 -18.046   6.413  -6.034
    8    HE2  PHE   9           HE2      PHE   9 -22.217   5.421  -5.905
    9    HZ   PHE   9           HZ       PHE   9 -20.357   6.754  -6.858

  No H/Q in entry =           9
  In of MODEL   46
    1    H    SER  10           H        SER  10 -16.740   0.830  -3.303
    2    HA   SER  10           HA       SER  10 -16.937  -0.044  -0.601
    3    HB2  SER  10           HB2      SER  10 -18.250  -1.863  -1.618
    4    HB3  SER  10           HB3      SER  10 -16.933  -2.180  -2.735
    5    HG   SER  10           HG       SER  10 -17.093  -3.462  -0.701

  No H/Q in entry =           5
  In of MODEL   46
    1    H    SER  11           H        SER  11 -14.911   0.037   0.182
    2    HA   SER  11           HA       SER  11 -12.718   0.783  -1.381
    3    HB2  SER  11           HB2      SER  11 -11.395   0.492   0.617
    4    HB3  SER  11           HB3      SER  11 -12.961   1.180   1.051
    5    HG   SER  11           HG       SER  11 -12.196  -1.558   1.189

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA  12           H        ALA  12 -14.036  -1.904  -2.128
    2    HA   ALA  12           HA       ALA  12 -11.494  -3.207  -2.704
    3    HB1  ALA  12           HB1      ALA  12 -13.710  -4.910  -1.579
    4    HB3  ALA  12           HB2      ALA  12 -12.478  -4.196  -0.538
    5    HB2  ALA  12           HB3      ALA  12 -12.008  -5.321  -1.812

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLY  13           H        GLY  13 -12.206  -2.239  -4.740
    2    HA3  GLY  13           HA2      GLY  13 -14.501  -2.840  -6.180
    3    HA2  GLY  13           HA3      GLY  13 -12.937  -2.467  -6.920

  No H/Q in entry =           3
  In of MODEL   46
    1    H    MET  14           H        MET  14 -11.512  -4.796  -6.007
    2    HA   MET  14           HA       MET  14 -11.994  -6.535  -8.101
    3    HB2  MET  14           HB2      MET  14  -9.930  -6.697  -6.802
    4    HB3  MET  14           HB3      MET  14 -10.815  -7.333  -5.417
    5    HG2  MET  14           HG2      MET  14 -11.484  -9.301  -6.766
    6    HG3  MET  14           HG3      MET  14 -10.593  -8.656  -8.145
    7    HE3  MET  14           HE1      MET  14  -7.031  -8.900  -7.473
    8    HE2  MET  14           HE2      MET  14  -7.760  -7.482  -6.720
    9    HE1  MET  14           HE3      MET  14  -8.388  -8.074  -8.256

  No H/Q in entry =           9
  In of MODEL   46
    1    H    SER  15           H        SER  15 -13.203  -7.021  -4.774
    2    HA   SER  15           HA       SER  15 -14.665  -9.384  -5.548
    3    HB2  SER  15           HB2      SER  15 -14.156  -9.353  -3.237
    4    HB3  SER  15           HB3      SER  15 -14.730  -7.698  -3.052
    5    HG   SER  15           HG       SER  15 -16.331  -9.971  -3.693

  No H/Q in entry =           5
  In of MODEL   46
    1    H    THR  16           H        THR  16 -15.582  -5.969  -5.020
    2    HA   THR  16           HA       THR  16 -18.403  -6.319  -5.485
    3    HB   THR  16           HB       THR  16 -16.729  -3.841  -6.021
    4    HG1  THR  16           HG1      THR  16 -17.966  -3.855  -3.645
    5   HG22  THR  16          HG21      THR  16 -18.850  -2.707  -5.379
    6   HG21  THR  16          HG22      THR  16 -19.634  -4.293  -5.264
    7   HG23  THR  16          HG23      THR  16 -19.025  -3.704  -6.817

  No H/Q in entry =           7
  In of MODEL   46
    1    H    SER  17           H        SER  17 -15.607  -5.852  -7.381
    2    HA   SER  17           HA       SER  17 -16.709  -5.071  -9.882
    3    HB2  SER  17           HB2      SER  17 -14.135  -6.496  -9.182
    4    HB3  SER  17           HB3      SER  17 -14.561  -6.046 -10.832
    5    HG   SER  17           HG       SER  17 -14.698  -4.103  -8.828

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU  18           H        LEU  18 -16.265  -8.234  -8.429
    2    HA   LEU  18           HA       LEU  18 -16.917  -9.713 -10.780
    3    HB2  LEU  18           HB2      LEU  18 -15.742 -10.781  -8.951
    4    HB3  LEU  18           HB3      LEU  18 -17.067 -10.421  -7.847
    5    HG   LEU  18           HG       LEU  18 -18.547 -11.885  -9.173
    6   HD13  LEU  18          HD11      LEU  18 -17.629 -11.807 -11.354
    7   HD12  LEU  18          HD12      LEU  18 -17.307 -13.447 -10.789
    8   HD11  LEU  18          HD13      LEU  18 -16.021 -12.242 -10.778
    9   HD21  LEU  18          HD21      LEU  18 -17.193 -12.657  -7.220
   10   HD23  LEU  18          HD22      LEU  18 -16.046 -13.331  -8.379
   11   HD22  LEU  18          HD23      LEU  18 -17.707 -13.918  -8.340

  No H/Q in entry =          11
  In of MODEL   46
    1    H    LEU  19           H        LEU  19 -18.830  -8.422  -8.068
    2    HA   LEU  19           HA       LEU  19 -21.340  -9.506  -8.894
    3    HB2  LEU  19           HB2      LEU  19 -20.997  -8.664  -6.640
    4    HB3  LEU  19           HB3      LEU  19 -20.714  -7.043  -7.271
    5    HG   LEU  19           HG       LEU  19 -23.034  -6.818  -7.882
    6   HD13  LEU  19          HD11      LEU  19 -23.895  -8.839  -8.554
    7   HD12  LEU  19          HD12      LEU  19 -24.528  -8.783  -6.909
    8   HD11  LEU  19          HD13      LEU  19 -23.085  -9.730  -7.266
    9   HD22  LEU  19          HD21      LEU  19 -22.465  -6.186  -5.650
   10   HD21  LEU  19          HD22      LEU  19 -22.594  -7.854  -5.091
   11   HD23  LEU  19          HD23      LEU  19 -24.036  -6.985  -5.614

  No H/Q in entry =          11
  In of MODEL   46
    1    H    VAL  20           H        VAL  20 -19.720  -6.410  -9.597
    2    HA   VAL  20           HA       VAL  20 -21.791  -5.286 -11.164
    3    HB   VAL  20           HB       VAL  20 -18.780  -4.817 -11.321
    4   HG11  VAL  20          HG11      VAL  20 -21.069  -3.487 -12.764
    5   HG13  VAL  20          HG12      VAL  20 -19.558  -4.101 -13.433
    6   HG12  VAL  20          HG13      VAL  20 -19.558  -2.635 -12.453
    7   HG23  VAL  20          HG21      VAL  20 -19.500  -2.624 -10.253
    8   HG22  VAL  20          HG22      VAL  20 -19.545  -4.066  -9.241
    9   HG21  VAL  20          HG23      VAL  20 -21.038  -3.422  -9.924

  No H/Q in entry =           9
  In of MODEL   46
    1    H    SER  21           H        SER  21 -19.120  -7.448 -12.192
    2    HA   SER  21           HA       SER  21 -19.905  -7.309 -14.942
    3    HB2  SER  21           HB2      SER  21 -18.550  -9.333 -15.275
    4    HB3  SER  21           HB3      SER  21 -17.670  -8.120 -14.347
    5    HG   SER  21           HG       SER  21 -17.371  -9.736 -13.061

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LYS  22           H        LYS  22 -21.052  -9.446 -12.365
    2    HA   LYS  22           HA       LYS  22 -22.659 -11.005 -14.180
    3    HB2  LYS  22           HB2      LYS  22 -21.888 -11.606 -11.769
    4    HB3  LYS  22           HB3      LYS  22 -23.304 -10.682 -11.273
    5    HG2  LYS  22           HG2      LYS  22 -24.765 -12.270 -11.974
    6    HG3  LYS  22           HG3      LYS  22 -23.733 -12.787 -13.308
    7    HD2  LYS  22           HD2      LYS  22 -22.302 -14.007 -11.784
    8    HD3  LYS  22           HD3      LYS  22 -23.218 -13.410 -10.399
    9    HE2  LYS  22           HE2      LYS  22 -25.209 -14.612 -11.197
   10    HE3  LYS  22           HE3      LYS  22 -24.296 -15.208 -12.584
   11    HZ2  LYS  22           HZ1      LYS  22 -24.568 -16.413 -10.133
   12    HZ1  LYS  22           HZ2      LYS  22 -22.974 -15.828 -10.155
   13    HZ3  LYS  22           HZ3      LYS  22 -23.514 -16.867 -11.384

  No H/Q in entry =          13
  In of MODEL   46
    1    H    MET  23           H        MET  23 -23.258  -8.053 -12.315
    2    HA   MET  23           HA       MET  23 -26.068  -8.016 -12.817
    3    HB2  MET  23           HB2      MET  23 -24.126  -5.786 -12.251
    4    HB3  MET  23           HB3      MET  23 -25.862  -5.544 -12.426
    5    HG2  MET  23           HG2      MET  23 -26.304  -6.828 -10.454
    6    HG3  MET  23           HG3      MET  23 -24.612  -7.310 -10.330
    7    HE2  MET  23           HE1      MET  23 -26.754  -3.563  -9.144
    8    HE1  MET  23           HE2      MET  23 -27.052  -4.522 -10.591
    9    HE3  MET  23           HE3      MET  23 -25.958  -3.140 -10.659

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ARG  24           H        ARG  24 -23.260  -6.706 -14.608
    2    HA   ARG  24           HA       ARG  24 -24.706  -5.347 -16.605
    3    HB2  ARG  24           HB2      ARG  24 -22.244  -5.060 -16.221
    4    HB3  ARG  24           HB3      ARG  24 -21.982  -6.663 -16.863
    5    HG2  ARG  24           HG2      ARG  24 -22.892  -5.916 -19.087
    6    HG3  ARG  24           HG3      ARG  24 -23.050  -4.273 -18.412
    7    HD2  ARG  24           HD2      ARG  24 -20.471  -5.907 -18.529
    8    HD3  ARG  24           HD3      ARG  24 -20.902  -4.596 -19.621
    9    HE   ARG  24           HE       ARG  24 -19.978  -4.212 -16.952
   10   HH21  ARG  24          HH11      ARG  24 -20.550  -2.245 -16.025
   11   HH22  ARG  24          HH12      ARG  24 -20.923  -0.895 -17.041
   12   HH11  ARG  24          HH21      ARG  24 -20.954  -2.937 -19.932
   13   HH12  ARG  24          HH22      ARG  24 -21.150  -1.313 -19.350

  No H/Q in entry =          13
  In of MODEL   46
    1    H    ALA  25           H        ALA  25 -23.726  -8.729 -16.328
    2    HA   ALA  25           HA       ALA  25 -24.394  -9.536 -18.963
    3    HB1  ALA  25           HB1      ALA  25 -23.784 -11.595 -18.266
    4    HB3  ALA  25           HB2      ALA  25 -24.837 -11.527 -16.853
    5    HB2  ALA  25           HB3      ALA  25 -23.248 -10.768 -16.805

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLN  26           H        GLN  26 -26.215  -9.493 -15.936
    2    HA   GLN  26           HA       GLN  26 -28.610 -10.594 -16.948
    3    HB2  GLN  26           HB2      GLN  26 -28.019  -8.869 -14.563
    4    HB3  GLN  26           HB3      GLN  26 -29.612  -9.525 -14.910
    5    HG2  GLN  26           HG2      GLN  26 -27.091 -11.091 -14.445
    6    HG3  GLN  26           HG3      GLN  26 -28.444 -10.929 -13.332
    7   HE21  GLN  26          HE21      GLN  26 -27.323 -13.145 -14.610
    8   HE22  GLN  26          HE22      GLN  26 -28.412 -14.147 -15.403

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ALA  27           H        ALA  27 -27.529  -7.240 -16.560
    2    HA   ALA  27           HA       ALA  27 -29.971  -6.041 -17.341
    3    HB1  ALA  27           HB1      ALA  27 -28.104  -4.806 -16.230
    4    HB3  ALA  27           HB2      ALA  27 -28.663  -4.015 -17.705
    5    HB2  ALA  27           HB3      ALA  27 -27.167  -4.947 -17.718

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLU  28           H        GLU  28 -27.328  -7.381 -19.214
    2    HA   GLU  28           HA       GLU  28 -28.221  -6.302 -21.732
    3    HB2  GLU  28           HB2      GLU  28 -25.873  -7.087 -21.112
    4    HB3  GLU  28           HB3      GLU  28 -26.490  -8.726 -21.313
    5    HG2  GLU  28           HG2      GLU  28 -25.314  -8.001 -23.283
    6    HG3  GLU  28           HG3      GLU  28 -27.025  -8.250 -23.628

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LYS  29           H        LYS  29 -28.519  -9.398 -20.075
    2    HA   LYS  29           HA       LYS  29 -29.889 -10.810 -22.077
    3    HB2  LYS  29           HB2      LYS  29 -28.879 -11.838 -20.074
    4    HB3  LYS  29           HB3      LYS  29 -30.118 -11.076 -19.077
    5    HG2  LYS  29           HG2      LYS  29 -31.839 -12.375 -20.142
    6    HG3  LYS  29           HG3      LYS  29 -30.669 -13.062 -21.269
    7    HD2  LYS  29           HD2      LYS  29 -29.576 -14.277 -19.537
    8    HD3  LYS  29           HD3      LYS  29 -30.444 -13.397 -18.281
    9    HE2  LYS  29           HE2      LYS  29 -31.298 -15.712 -18.642
   10    HE3  LYS  29           HE3      LYS  29 -32.524 -14.465 -18.883
   11    HZ1  LYS  29           HZ1      LYS  29 -31.968 -14.623 -21.312
   12    HZ3  LYS  29           HZ2      LYS  29 -32.747 -15.977 -20.646
   13    HZ2  LYS  29           HZ3      LYS  29 -31.078 -16.020 -20.946

  No H/Q in entry =          13
  In of MODEL   46
    1    H    TYR  30           H        TYR  30 -31.184  -8.647 -19.570
    2    HA   TYR  30           HA       TYR  30 -33.865  -8.979 -20.808
    3    HB2  TYR  30           HB2      TYR  30 -33.158  -7.856 -18.088
    4    HB3  TYR  30           HB3      TYR  30 -34.787  -8.043 -18.738
    5    HD1  TYR  30           HD1      TYR  30 -35.796 -10.293 -18.951
    6    HD2  TYR  30           HD2      TYR  30 -31.930  -9.739 -17.253
    7    HE1  TYR  30           HE1      TYR  30 -35.806 -12.623 -18.154
    8    HE2  TYR  30           HE2      TYR  30 -31.941 -12.054 -16.461
    9    HH   TYR  30           HH       TYR  30 -33.684 -14.341 -17.552

  No H/Q in entry =           9
  In of MODEL   46
    1    H    GLU  31           H        GLU  31 -31.616  -7.084 -21.611
    2    HA   GLU  31           HA       GLU  31 -31.451  -4.931 -22.433
    3    HB2  GLU  31           HB2      GLU  31 -34.375  -5.521 -22.942
    4    HB3  GLU  31           HB3      GLU  31 -33.477  -4.191 -23.673
    5    HG2  GLU  31           HG2      GLU  31 -32.070  -5.690 -24.866
    6    HG3  GLU  31           HG3      GLU  31 -32.693  -7.079 -23.977

  No H/Q in entry =           6
  In of MODEL   46
    1    H    VAL  32           H        VAL  32 -31.641  -4.822 -19.701
    2    HA   VAL  32           HA       VAL  32 -33.411  -2.631 -19.038
    3    HB   VAL  32           HB       VAL  32 -31.060  -3.727 -17.461
    4   HG12  VAL  32          HG11      VAL  32 -32.556  -2.839 -15.563
    5   HG11  VAL  32          HG12      VAL  32 -33.353  -1.899 -16.826
    6   HG13  VAL  32          HG13      VAL  32 -31.634  -1.669 -16.508
    7   HG21  VAL  32          HG21      VAL  32 -32.901  -5.370 -18.148
    8   HG23  VAL  32          HG22      VAL  32 -33.903  -4.500 -16.986
    9   HG22  VAL  32          HG23      VAL  32 -32.417  -5.287 -16.454

  No H/Q in entry =           9
  In of MODEL   46
    1    HA   PRO  33           HA       PRO  33 -30.260   0.167 -20.716
    2    HB2  PRO  33           HB2      PRO  33 -31.677   2.451 -20.588
    3    HB3  PRO  33           HB3      PRO  33 -32.201   1.170 -21.683
    4    HG2  PRO  33           HG2      PRO  33 -33.142   1.726 -18.868
    5    HG3  PRO  33           HG3      PRO  33 -34.117   1.558 -20.328
    6    HD2  PRO  33           HD2      PRO  33 -33.746  -0.532 -18.664
    7    HD3  PRO  33           HD3      PRO  33 -33.821  -0.770 -20.410

  No H/Q in entry =           7
  In of MODEL   46
    1    H    VAL  34           H        VAL  34 -29.017  -0.431 -18.769
    2    HA   VAL  34           HA       VAL  34 -28.630   1.979 -17.121
    3    HB   VAL  34           HB       VAL  34 -28.107   0.494 -15.185
    4   HG12  VAL  34          HG11      VAL  34 -30.553  -0.279 -14.874
    5   HG11  VAL  34          HG12      VAL  34 -30.840   0.496 -16.431
    6   HG13  VAL  34          HG13      VAL  34 -30.246   1.447 -15.071
    7   HG21  VAL  34          HG21      VAL  34 -28.380  -1.522 -17.194
    8   HG23  VAL  34          HG22      VAL  34 -29.449  -1.840 -15.827
    9   HG22  VAL  34          HG23      VAL  34 -27.720  -1.624 -15.562

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ILE  35           H        ILE  35 -26.636   2.332 -16.284
    2    HA   ILE  35           HA       ILE  35 -24.390   0.909 -17.552
    3    HB   ILE  35           HB       ILE  35 -24.669   3.813 -16.738
    4   HG12  ILE  35          HG12      ILE  35 -23.746   2.467 -19.285
    5   HG13  ILE  35          HG13      ILE  35 -25.349   3.155 -19.022
    6   HG21  ILE  35          HG21      ILE  35 -22.174   2.176 -17.053
    7   HG23  ILE  35          HG22      ILE  35 -22.576   3.372 -15.821
    8   HG22  ILE  35          HG23      ILE  35 -22.175   3.891 -17.459
    9   HD11  ILE  35          HD11      ILE  35 -23.857   5.289 -18.423
   10   HD13  ILE  35          HD12      ILE  35 -24.413   4.931 -20.058
   11   HD12  ILE  35          HD13      ILE  35 -22.776   4.492 -19.565

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ILE  36           H        ILE  36 -23.200  -0.165 -15.955
    2    HA   ILE  36           HA       ILE  36 -23.610   0.465 -13.083
    3    HB   ILE  36           HB       ILE  36 -22.897  -2.268 -14.195
    4   HG12  ILE  36          HG12      ILE  36 -25.667  -1.349 -13.426
    5   HG13  ILE  36          HG13      ILE  36 -25.098  -1.350 -15.095
    6   HG23  ILE  36          HG21      ILE  36 -23.278  -3.084 -12.080
    7   HG22  ILE  36          HG22      ILE  36 -24.350  -1.755 -11.639
    8   HG21  ILE  36          HG23      ILE  36 -22.607  -1.494 -11.712
    9   HD13  ILE  36          HD11      ILE  36 -25.354  -3.556 -15.302
   10   HD12  ILE  36          HD12      ILE  36 -26.412  -3.391 -13.900
   11   HD11  ILE  36          HD13      ILE  36 -24.731  -3.880 -13.685

  No H/Q in entry =          11
  In of MODEL   46
    1    H    GLU  37           H        GLU  37 -21.803   1.020 -11.982
    2    HA   GLU  37           HA       GLU  37 -19.149   0.115 -12.903
    3    HB2  GLU  37           HB2      GLU  37 -19.950   2.938 -12.225
    4    HB3  GLU  37           HB3      GLU  37 -18.277   2.390 -12.306
    5    HG2  GLU  37           HG2      GLU  37 -18.510   1.935 -14.664
    6    HG3  GLU  37           HG3      GLU  37 -20.210   2.392 -14.605

  No H/Q in entry =           6
  In of MODEL   46
    1    H    ALA  38           H        ALA  38 -17.670  -0.184 -11.223
    2    HA   ALA  38           HA       ALA  38 -18.688   0.035  -8.451
    3    HB1  ALA  38           HB1      ALA  38 -17.056  -1.971  -9.881
    4    HB3  ALA  38           HB2      ALA  38 -18.112  -2.166  -8.481
    5    HB2  ALA  38           HB3      ALA  38 -16.473  -1.549  -8.271

  No H/Q in entry =           5
  In of MODEL   46
    1    H    PHE  39           H        PHE  39 -17.398   1.193  -6.979
    2    HA   PHE  39           HA       PHE  39 -14.828   2.293  -7.879
    3    HB2  PHE  39           HB2      PHE  39 -17.038   3.939  -6.642
    4    HB3  PHE  39           HB3      PHE  39 -15.411   4.505  -7.009
    5    HD1  PHE  39           HD1      PHE  39 -14.702   4.851  -9.312
    6    HD2  PHE  39           HD2      PHE  39 -18.694   3.714  -8.338
    7    HE1  PHE  39           HE1      PHE  39 -15.437   5.543 -11.575
    8    HE2  PHE  39           HE2      PHE  39 -19.442   4.393 -10.591
    9    HZ   PHE  39           HZ       PHE  39 -17.815   5.280 -12.227

  No H/Q in entry =           9
  In of MODEL   46
    1    HA   PRO  40           HA       PRO  40 -13.912   1.500  -3.595
    2    HB2  PRO  40           HB2      PRO  40 -12.066   3.444  -2.990
    3    HB3  PRO  40           HB3      PRO  40 -11.677   2.097  -4.060
    4    HG2  PRO  40           HG2      PRO  40 -12.597   4.870  -4.803
    5    HG3  PRO  40           HG3      PRO  40 -11.204   3.975  -5.412
    6    HD2  PRO  40           HD2      PRO  40 -13.432   3.974  -6.818
    7    HD3  PRO  40           HD3      PRO  40 -12.533   2.468  -6.627

  No H/Q in entry =           7
  In of MODEL   46
    1    H    GLU  41           H        GLU  41 -14.491   2.500  -1.463
    2    HA   GLU  41           HA       GLU  41 -16.668   4.288  -1.441
    3    HB2  GLU  41           HB2      GLU  41 -16.505   4.222   0.944
    4    HB3  GLU  41           HB3      GLU  41 -16.121   2.612   0.335
    5    HG2  GLU  41           HG2      GLU  41 -14.523   2.865   1.956
    6    HG3  GLU  41           HG3      GLU  41 -13.653   3.427   0.529

  No H/Q in entry =           6
  In of MODEL   46
    1    H    THR  42           H        THR  42 -13.304   5.076  -1.499
    2    HA   THR  42           HA       THR  42 -13.556   7.648  -0.284
    3    HB   THR  42           HB       THR  42 -11.380   8.139  -1.359
    4    HG1  THR  42           HG1      THR  42 -10.476   6.480  -2.669
    5   HG21  THR  42          HG21      THR  42 -11.469   6.803   0.732
    6   HG23  THR  42          HG22      THR  42 -10.095   6.361  -0.285
    7   HG22  THR  42          HG23      THR  42 -11.524   5.330  -0.238

  No H/Q in entry =           7
  In of MODEL   46
    1    H    LEU  43           H        LEU  43 -14.508   6.592  -3.384
    2    HA   LEU  43           HA       LEU  43 -14.657   9.372  -4.353
    3    HB2  LEU  43           HB2      LEU  43 -15.138   6.747  -5.752
    4    HB3  LEU  43           HB3      LEU  43 -15.262   8.337  -6.502
    5    HG   LEU  43           HG       LEU  43 -12.718   7.092  -5.488
    6   HD12  LEU  43          HD11      LEU  43 -13.453   7.623  -8.348
    7   HD11  LEU  43          HD12      LEU  43 -13.871   6.100  -7.567
    8   HD13  LEU  43          HD13      LEU  43 -12.182   6.583  -7.705
    9   HD21  LEU  43          HD21      LEU  43 -13.365   9.686  -6.885
   10   HD23  LEU  43          HD22      LEU  43 -11.742   8.994  -6.863
   11   HD22  LEU  43          HD23      LEU  43 -12.525   9.454  -5.353

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ALA  44           H        ALA  44 -16.668   7.621  -2.496
    2    HA   ALA  44           HA       ALA  44 -19.151   7.575  -3.814
    3    HB3  ALA  44           HB1      ALA  44 -19.051   6.454  -1.718
    4    HB2  ALA  44           HB2      ALA  44 -20.106   7.840  -1.443
    5    HB1  ALA  44           HB3      ALA  44 -18.431   7.884  -0.894

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLY  45           H        GLY  45 -17.623  10.320  -2.283
    2    HA3  GLY  45           HA2      GLY  45 -20.001  11.911  -2.639
    3    HA2  GLY  45           HA3      GLY  45 -18.434  12.476  -2.064

  No H/Q in entry =           3
  In of MODEL   46
    1    H    GLU  46           H        GLU  46 -16.943  11.483  -4.358
    2    HA   GLU  46           HA       GLU  46 -17.499  13.722  -6.125
    3    HB2  GLU  46           HB2      GLU  46 -15.192  13.102  -5.487
    4    HB3  GLU  46           HB3      GLU  46 -15.406  11.547  -6.289
    5    HG2  GLU  46           HG2      GLU  46 -15.658  12.668  -8.430
    6    HG3  GLU  46           HG3      GLU  46 -15.489  14.236  -7.641

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LYS  47           H        LYS  47 -17.514  10.202  -6.561
    2    HA   LYS  47           HA       LYS  47 -18.608  10.464  -9.235
    3    HB2  LYS  47           HB2      LYS  47 -17.039   8.595  -8.244
    4    HB3  LYS  47           HB3      LYS  47 -18.567   7.891  -7.713
    5    HG2  LYS  47           HG2      LYS  47 -18.572   6.887  -9.696
    6    HG3  LYS  47           HG3      LYS  47 -19.078   8.454 -10.327
    7    HD2  LYS  47           HD2      LYS  47 -16.215   7.548 -10.055
    8    HD3  LYS  47           HD3      LYS  47 -17.152   7.487 -11.547
    9    HE2  LYS  47           HE2      LYS  47 -16.475   9.966  -9.976
   10    HE3  LYS  47           HE3      LYS  47 -15.735   9.461 -11.494
   11    HZ2  LYS  47           HZ1      LYS  47 -18.082  10.928 -11.100
   12    HZ1  LYS  47           HZ2      LYS  47 -18.498   9.457 -11.839
   13    HZ3  LYS  47           HZ3      LYS  47 -17.349  10.479 -12.564

  No H/Q in entry =          13
  In of MODEL   46
    1    H    GLY  48           H        GLY  48 -19.954   9.757  -6.085
    2    HA3  GLY  48           HA2      GLY  48 -22.383   8.663  -6.821
    3    HA2  GLY  48           HA3      GLY  48 -22.117   9.647  -5.383

  No H/Q in entry =           3
  In of MODEL   46
    1    H    GLN  49           H        GLN  49 -21.446  12.047  -6.954
    2    HA   GLN  49           HA       GLN  49 -23.961  13.255  -7.093
    3    HB2  GLN  49           HB2      GLN  49 -21.389  14.021  -8.457
    4    HB3  GLN  49           HB3      GLN  49 -22.812  15.042  -8.370
    5    HG2  GLN  49           HG2      GLN  49 -22.648  15.059  -5.934
    6    HG3  GLN  49           HG3      GLN  49 -21.238  14.018  -6.019
    7   HE21  GLN  49          HE21      GLN  49 -21.033  16.240  -4.747
    8   HE22  GLN  49          HE22      GLN  49 -20.065  17.460  -5.396

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ASN  50           H        ASN  50 -22.359  11.313  -9.484
    2    HA   ASN  50           HA       ASN  50 -24.212  12.257 -11.562
    3    HB2  ASN  50           HB2      ASN  50 -21.693  10.620 -11.801
    4    HB3  ASN  50           HB3      ASN  50 -22.729  11.086 -13.142
    5   HD21  ASN  50          HD21      ASN  50 -20.059  11.830 -11.537
    6   HD22  ASN  50          HD22      ASN  50 -19.764  13.455 -11.879

  No H/Q in entry =           6
  In of MODEL   46
    1    H    ALA  51           H        ALA  51 -24.284   9.902  -9.316
    2    HA   ALA  51           HA       ALA  51 -25.154   7.789 -11.142
    3    HB2  ALA  51           HB1      ALA  51 -24.619   6.418  -9.456
    4    HB3  ALA  51           HB2      ALA  51 -25.708   7.269  -8.361
    5    HB1  ALA  51           HB3      ALA  51 -24.047   7.825  -8.562

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ASP  52           H        ASP  52 -27.197   6.812 -10.998
    2    HA   ASP  52           HA       ASP  52 -29.305   8.728 -10.329
    3    HB2  ASP  52           HB2      ASP  52 -29.215   6.218 -11.999
    4    HB3  ASP  52           HB3      ASP  52 -30.729   7.010 -11.561

  No H/Q in entry =           4
  In of MODEL   46
    1    H    VAL  53           H        VAL  53 -27.816   5.779  -9.316
    2    HA   VAL  53           HA       VAL  53 -29.246   5.962  -6.797
    3    HB   VAL  53           HB       VAL  53 -30.710   4.376  -8.039
    4   HG11  VAL  53          HG11      VAL  53 -29.002   3.449  -9.564
    5   HG13  VAL  53          HG12      VAL  53 -29.883   2.188  -8.703
    6   HG12  VAL  53          HG13      VAL  53 -28.253   2.626  -8.196
    7   HG23  VAL  53          HG21      VAL  53 -29.964   2.368  -6.348
    8   HG22  VAL  53          HG22      VAL  53 -31.040   3.716  -5.979
    9   HG21  VAL  53          HG23      VAL  53 -29.326   3.820  -5.575

  No H/Q in entry =           9
  In of MODEL   46
    1    H    VAL  54           H        VAL  54 -27.947   5.477  -5.145
    2    HA   VAL  54           HA       VAL  54 -25.224   4.519  -5.762
    3    HB   VAL  54           HB       VAL  54 -26.219   6.337  -3.509
    4   HG11  VAL  54          HG11      VAL  54 -23.699   4.817  -3.806
    5   HG13  VAL  54          HG12      VAL  54 -24.421   5.525  -2.362
    6   HG12  VAL  54          HG13      VAL  54 -23.477   6.532  -3.459
    7   HG22  VAL  54          HG21      VAL  54 -25.290   8.116  -4.611
    8   HG21  VAL  54          HG22      VAL  54 -25.880   7.149  -5.962
    9   HG23  VAL  54          HG23      VAL  54 -24.172   7.106  -5.527

  No H/Q in entry =           9
  In of MODEL   46
    1    H    LEU  55           H        LEU  55 -24.708   2.575  -5.120
    2    HA   LEU  55           HA       LEU  55 -26.262   1.325  -2.942
    3    HB2  LEU  55           HB2      LEU  55 -24.758   0.096  -5.240
    4    HB3  LEU  55           HB3      LEU  55 -25.553  -0.807  -3.951
    5    HG   LEU  55           HG       LEU  55 -26.930   0.837  -6.065
    6   HD13  LEU  55          HD11      LEU  55 -26.707  -1.026  -7.285
    7   HD12  LEU  55          HD12      LEU  55 -27.696  -1.862  -6.089
    8   HD11  LEU  55          HD13      LEU  55 -25.939  -1.868  -5.941
    9   HD23  LEU  55          HD21      LEU  55 -28.297  -1.056  -4.207
   10   HD22  LEU  55          HD22      LEU  55 -28.938   0.353  -5.054
   11   HD21  LEU  55          HD23      LEU  55 -27.906   0.567  -3.640

  No H/Q in entry =          11
  In of MODEL   46
    1    H    LEU  56           H        LEU  56 -25.133   0.685  -1.139
    2    HA   LEU  56           HA       LEU  56 -22.184   0.962  -1.195
    3    HB2  LEU  56           HB2      LEU  56 -23.989   0.823   1.207
    4    HB3  LEU  56           HB3      LEU  56 -22.265   1.184   1.193
    5    HG   LEU  56           HG       LEU  56 -24.496   2.953   0.234
    6   HD11  LEU  56          HD11      LEU  56 -23.392   2.527   2.752
    7   HD13  LEU  56          HD12      LEU  56 -24.327   3.935   2.248
    8   HD12  LEU  56          HD13      LEU  56 -22.568   3.968   2.157
    9   HD23  LEU  56          HD21      LEU  56 -22.485   4.572   0.037
   10   HD22  LEU  56          HD22      LEU  56 -22.914   3.492  -1.290
   11   HD21  LEU  56          HD23      LEU  56 -21.574   3.085  -0.220

  No H/Q in entry =          11
  In of MODEL   46
    1    H    GLY  57           H        GLY  57 -20.870  -0.723  -0.663
    2    HA3  GLY  57           HA2      GLY  57 -21.902  -3.369  -0.859
    3    HA2  GLY  57           HA3      GLY  57 -20.259  -2.941  -0.386

  No H/Q in entry =           3
  In of MODEL   46
    1    HA   PRO  58           HA       PRO  58 -23.100  -3.866   3.333
    2    HB2  PRO  58           HB2      PRO  58 -22.521  -6.496   3.937
    3    HB3  PRO  58           HB3      PRO  58 -23.889  -6.033   2.927
    4    HG2  PRO  58           HG2      PRO  58 -21.201  -7.023   2.136
    5    HG3  PRO  58           HG3      PRO  58 -22.784  -7.419   1.467
    6    HD2  PRO  58           HD2      PRO  58 -21.105  -5.668   0.241
    7    HD3  PRO  58           HD3      PRO  58 -22.860  -5.511   0.142

  No H/Q in entry =           7
  In of MODEL   46
    1    H    GLN  59           H        GLN  59 -19.752  -4.475   2.719
    2    HA   GLN  59           HA       GLN  59 -18.993  -4.523   5.478
    3    HB2  GLN  59           HB2      GLN  59 -17.254  -3.551   3.220
    4    HB3  GLN  59           HB3      GLN  59 -16.753  -4.240   4.751
    5    HG2  GLN  59           HG2      GLN  59 -16.453  -6.092   3.520
    6    HG3  GLN  59           HG3      GLN  59 -18.182  -6.295   3.751
    7   HE21  GLN  59          HE21      GLN  59 -15.828  -5.466   1.683
    8   HE22  GLN  59          HE22      GLN  59 -16.402  -5.430   0.122

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ILE  60           H        ILE  60 -19.827  -1.936   3.271
    2    HA   ILE  60           HA       ILE  60 -18.891  -0.016   5.315
    3    HB   ILE  60           HB       ILE  60 -18.567   1.635   3.681
    4   HG12  ILE  60          HG12      ILE  60 -20.162  -0.033   1.736
    5   HG13  ILE  60          HG13      ILE  60 -20.741   1.413   2.564
    6   HG23  ILE  60          HG21      ILE  60 -16.821   0.105   3.441
    7   HG22  ILE  60          HG22      ILE  60 -17.332   0.510   1.802
    8   HG21  ILE  60          HG23      ILE  60 -17.824  -1.020   2.526
    9   HD13  ILE  60          HD11      ILE  60 -19.371   2.833   1.301
   10   HD12  ILE  60          HD12      ILE  60 -19.904   1.636   0.122
   11   HD11  ILE  60          HD13      ILE  60 -18.290   1.523   0.824

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ALA  61           H        ALA  61 -21.409  -1.500   5.390
    2    HA   ALA  61           HA       ALA  61 -23.567   0.254   4.936
    3    HB1  ALA  61           HB1      ALA  61 -24.839  -1.184   6.263
    4    HB2  ALA  61           HB2      ALA  61 -23.457  -1.631   7.263
    5    HB3  ALA  61           HB3      ALA  61 -23.580  -2.233   5.610

  No H/Q in entry =           5
  In of MODEL   46
    1    H    TYR  62           H        TYR  62 -21.360   0.052   7.728
    2    HA   TYR  62           HA       TYR  62 -22.843   1.772   9.402
    3    HB2  TYR  62           HB2      TYR  62 -20.783   2.113  10.631
    4    HB3  TYR  62           HB3      TYR  62 -20.913   0.416  10.169
    5    HD1  TYR  62           HD1      TYR  62 -19.409  -0.528   8.438
    6    HD2  TYR  62           HD2      TYR  62 -18.980   3.510   9.768
    7    HE1  TYR  62           HE1      TYR  62 -17.193  -0.415   7.364
    8    HE2  TYR  62           HE2      TYR  62 -16.749   3.617   8.696
    9    HH   TYR  62           HH       TYR  62 -15.328   0.758   7.218

  No H/Q in entry =           9
  In of MODEL   46
    1    H    MET  63           H        MET  63 -21.172   2.562   6.543
    2    HA   MET  63           HA       MET  63 -20.887   5.385   7.236
    3    HB2  MET  63           HB2      MET  63 -20.344   3.833   4.705
    4    HB3  MET  63           HB3      MET  63 -20.090   5.571   4.874
    5    HG2  MET  63           HG2      MET  63 -18.400   5.156   6.579
    6    HG3  MET  63           HG3      MET  63 -18.653   3.421   6.406
    7    HE3  MET  63           HE1      MET  63 -15.417   5.168   4.988
    8    HE2  MET  63           HE2      MET  63 -15.498   3.411   5.110
    9    HE1  MET  63           HE3      MET  63 -16.185   4.415   6.388

  No H/Q in entry =           9
  In of MODEL   46
    1    H    LEU  64           H        LEU  64 -23.528   3.639   6.277
    2    HA   LEU  64           HA       LEU  64 -24.682   5.106   4.201
    3    HB2  LEU  64           HB2      LEU  64 -25.635   3.038   5.122
    4    HB3  LEU  64           HB3      LEU  64 -26.054   3.899   6.602
    5    HG   LEU  64           HG       LEU  64 -27.698   5.223   5.378
    6   HD13  LEU  64          HD11      LEU  64 -27.410   5.452   3.145
    7   HD12  LEU  64          HD12      LEU  64 -28.123   3.845   3.001
    8   HD11  LEU  64          HD13      LEU  64 -26.371   4.031   3.055
    9   HD23  LEU  64          HD21      LEU  64 -28.334   2.434   4.631
   10   HD22  LEU  64          HD22      LEU  64 -29.272   3.608   5.553
   11   HD21  LEU  64          HD23      LEU  64 -27.930   2.758   6.317

  No H/Q in entry =          11
  In of MODEL   46
    1    HA   PRO  65           HA       PRO  65 -26.722   8.349   6.958
    2    HB2  PRO  65           HB2      PRO  65 -24.710   8.423   9.207
    3    HB3  PRO  65           HB3      PRO  65 -26.437   8.776   9.257
    4    HG2  PRO  65           HG2      PRO  65 -25.601   6.485  10.182
    5    HG3  PRO  65           HG3      PRO  65 -27.023   6.513   9.140
    6    HD2  PRO  65           HD2      PRO  65 -24.181   5.776   8.430
    7    HD3  PRO  65           HD3      PRO  65 -25.676   4.953   7.986

  No H/Q in entry =           7
  In of MODEL   46
    1    H    GLU  66           H        GLU  66 -23.171   8.142   7.022
    2    HA   GLU  66           HA       GLU  66 -22.755  10.926   6.616
    3    HB2  GLU  66           HB2      GLU  66 -21.044   8.542   5.960
    4    HB3  GLU  66           HB3      GLU  66 -20.524  10.214   5.752
    5    HG2  GLU  66           HG2      GLU  66 -20.713  10.593   8.119
    6    HG3  GLU  66           HG3      GLU  66 -21.309   8.950   8.353

  No H/Q in entry =           6
  In of MODEL   46
    1    H    ILE  67           H        ILE  67 -22.981   8.187   4.364
    2    HA   ILE  67           HA       ILE  67 -22.497   9.876   2.070
    3    HB   ILE  67           HB       ILE  67 -23.520   7.010   2.252
    4   HG12  ILE  67          HG12      ILE  67 -20.844   8.066   1.323
    5   HG13  ILE  67          HG13      ILE  67 -21.153   7.658   3.010
    6   HG21  ILE  67          HG21      ILE  67 -23.387   8.884   0.027
    7   HG23  ILE  67          HG22      ILE  67 -24.083   7.265   0.079
    8   HG22  ILE  67          HG23      ILE  67 -22.364   7.475  -0.254
    9   HD12  ILE  67          HD11      ILE  67 -20.816   5.870   0.660
   10   HD11  ILE  67          HD12      ILE  67 -21.850   5.343   1.985
   11   HD13  ILE  67          HD13      ILE  67 -20.159   5.734   2.291

  No H/Q in entry =          11
  In of MODEL   46
    1    H    GLN  68           H        GLN  68 -25.406   8.948   3.710
    2    HA   GLN  68           HA       GLN  68 -27.198   9.958   1.741
    3    HB2  GLN  68           HB2      GLN  68 -27.461   9.612   4.725
    4    HB3  GLN  68           HB3      GLN  68 -28.755  10.264   3.736
    5    HG2  GLN  68           HG2      GLN  68 -28.877   8.238   2.460
    6    HG3  GLN  68           HG3      GLN  68 -27.453   7.598   3.258
    7   HE21  GLN  68          HE21      GLN  68 -29.689   6.338   3.128
    8   HE22  GLN  68          HE22      GLN  68 -30.534   5.919   4.546

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ARG  69           H        ARG  69 -25.512  11.551   4.475
    2    HA   ARG  69           HA       ARG  69 -26.765  14.092   4.072
    3    HB2  ARG  69           HB2      ARG  69 -24.460  13.057   5.655
    4    HB3  ARG  69           HB3      ARG  69 -24.462  14.779   5.297
    5    HG2  ARG  69           HG2      ARG  69 -26.772  14.927   6.274
    6    HG3  ARG  69           HG3      ARG  69 -26.639  13.229   6.747
    7    HD2  ARG  69           HD2      ARG  69 -24.839  15.504   7.657
    8    HD3  ARG  69           HD3      ARG  69 -26.006  14.650   8.655
    9    HE   ARG  69           HE       ARG  69 -23.441  13.602   7.697
   10   HH21  ARG  69          HH11      ARG  69 -22.710  11.803   8.891
   11   HH22  ARG  69          HH12      ARG  69 -23.771  11.034  10.022
   12   HH11  ARG  69          HH21      ARG  69 -26.415  13.189   9.403
   13   HH12  ARG  69          HH22      ARG  69 -25.869  11.817  10.310

  No H/Q in entry =          13
  In of MODEL   46
    1    H    LEU  70           H        LEU  70 -23.965  12.557   2.704
    2    HA   LEU  70           HA       LEU  70 -22.747  14.869   1.533
    3    HB2  LEU  70           HB2      LEU  70 -21.858  12.508   2.125
    4    HB3  LEU  70           HB3      LEU  70 -22.499  12.071   0.542
    5    HG   LEU  70           HG       LEU  70 -20.847  13.370  -0.548
    6   HD11  LEU  70          HD11      LEU  70 -19.978  14.174   2.238
    7   HD13  LEU  70          HD12      LEU  70 -20.629  15.240   0.992
    8   HD12  LEU  70          HD13      LEU  70 -19.051  14.485   0.767
    9   HD22  LEU  70          HD21      LEU  70 -19.493  11.589  -0.320
   10   HD21  LEU  70          HD22      LEU  70 -20.438  11.110   1.090
   11   HD23  LEU  70          HD23      LEU  70 -19.005  12.117   1.290

  No H/Q in entry =          11
  In of MODEL   46
    1    H    LEU  71           H        LEU  71 -25.019  12.429   0.423
    2    HA   LEU  71           HA       LEU  71 -25.482  13.940  -2.091
    3    HB2  LEU  71           HB2      LEU  71 -25.825  10.968  -1.645
    4    HB3  LEU  71           HB3      LEU  71 -25.918  11.834  -3.177
    5    HG   LEU  71           HG       LEU  71 -23.395  11.728  -1.523
    6   HD12  LEU  71          HD11      LEU  71 -23.531  10.105  -3.956
    7   HD11  LEU  71          HD12      LEU  71 -24.567   9.529  -2.650
    8   HD13  LEU  71          HD13      LEU  71 -22.834   9.728  -2.380
    9   HD22  LEU  71          HD21      LEU  71 -23.417  13.548  -3.017
   10   HD21  LEU  71          HD22      LEU  71 -23.967  12.530  -4.348
   11   HD23  LEU  71          HD23      LEU  71 -22.353  12.307  -3.675

  No H/Q in entry =          11
  In of MODEL   46
    1    HA   PRO  72           HA       PRO  72 -29.357  13.674   0.542
    2    HB2  PRO  72           HB2      PRO  72 -30.091  16.273   0.463
    3    HB3  PRO  72           HB3      PRO  72 -28.802  15.758   1.551
    4    HG2  PRO  72           HG2      PRO  72 -28.567  16.944  -1.203
    5    HG3  PRO  72           HG3      PRO  72 -27.770  17.457   0.284
    6    HD2  PRO  72           HD2      PRO  72 -26.515  15.837  -1.486
    7    HD3  PRO  72           HD3      PRO  72 -26.263  15.657   0.249

  No H/Q in entry =           7
  In of MODEL   46
    1    H    ASN  73           H        ASN  73 -28.698  14.599  -2.674
    2    HA   ASN  73           HA       ASN  73 -31.571  14.430  -3.298
    3    HB2  ASN  73           HB2      ASN  73 -31.059  15.513  -5.396
    4    HB3  ASN  73           HB3      ASN  73 -30.485  16.466  -4.036
    5   HD21  ASN  73          HD21      ASN  73 -29.696  16.472  -6.716
    6   HD22  ASN  73          HD22      ASN  73 -28.039  16.231  -6.914

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LYS  74           H        LYS  74 -29.702  12.080  -2.880
    2    HA   LYS  74           HA       LYS  74 -30.345  10.716  -5.426
    3    HB2  LYS  74           HB2      LYS  74 -27.825  10.298  -3.812
    4    HB3  LYS  74           HB3      LYS  74 -28.253   9.506  -5.329
    5    HG2  LYS  74           HG2      LYS  74 -27.842  12.460  -5.127
    6    HG3  LYS  74           HG3      LYS  74 -26.523  11.330  -5.437
    7    HD2  LYS  74           HD2      LYS  74 -27.690  10.460  -7.376
    8    HD3  LYS  74           HD3      LYS  74 -29.057  11.525  -7.052
    9    HE2  LYS  74           HE2      LYS  74 -27.735  13.469  -7.497
   10    HE3  LYS  74           HE3      LYS  74 -26.260  12.504  -7.593
   11    HZ2  LYS  74           HZ1      LYS  74 -27.706  13.180  -9.715
   12    HZ1  LYS  74           HZ2      LYS  74 -28.435  11.692  -9.340
   13    HZ3  LYS  74           HZ3      LYS  74 -26.765  11.769  -9.642

  No H/Q in entry =          13
  In of MODEL   46
    1    HA   PRO  75           HA       PRO  75 -31.878   7.803  -2.450
    2    HB2  PRO  75           HB2      PRO  75 -32.303   5.604  -4.032
    3    HB3  PRO  75           HB3      PRO  75 -33.360   7.012  -4.098
    4    HG2  PRO  75           HG2      PRO  75 -31.061   6.300  -5.876
    5    HG3  PRO  75           HG3      PRO  75 -32.687   6.819  -6.318
    6    HD2  PRO  75           HD2      PRO  75 -30.654   8.585  -6.281
    7    HD3  PRO  75           HD3      PRO  75 -32.262   9.065  -5.738

  No H/Q in entry =           7
  In of MODEL   46
    1    H    VAL  76           H        VAL  76 -30.476   6.676  -1.083
    2    HA   VAL  76           HA       VAL  76 -28.078   5.345  -2.196
    3    HB   VAL  76           HB       VAL  76 -28.285   6.823   0.461
    4   HG11  VAL  76          HG11      VAL  76 -26.000   5.419  -0.936
    5   HG13  VAL  76          HG12      VAL  76 -26.714   5.004   0.624
    6   HG12  VAL  76          HG13      VAL  76 -25.792   6.497   0.445
    7   HG22  VAL  76          HG21      VAL  76 -27.524   8.687  -0.427
    8   HG21  VAL  76          HG22      VAL  76 -28.106   8.020  -1.954
    9   HG23  VAL  76          HG23      VAL  76 -26.409   7.847  -1.504

  No H/Q in entry =           9
  In of MODEL   46
    1    H    GLU  77           H        GLU  77 -27.968   3.182  -1.584
    2    HA   GLU  77           HA       GLU  77 -28.786   2.435   1.072
    3    HB2  GLU  77           HB2      GLU  77 -30.476   0.871   0.546
    4    HB3  GLU  77           HB3      GLU  77 -30.949   2.419  -0.155
    5    HG2  GLU  77           HG2      GLU  77 -30.385   1.632  -2.343
    6    HG3  GLU  77           HG3      GLU  77 -29.818   0.105  -1.672

  No H/Q in entry =           6
  In of MODEL   46
    1    H    VAL  78           H        VAL  78 -28.563   0.334   1.731
    2    HA   VAL  78           HA       VAL  78 -25.941  -0.569   0.836
    3    HB   VAL  78           HB       VAL  78 -27.684  -1.367   3.207
    4   HG11  VAL  78          HG11      VAL  78 -25.412  -2.711   2.076
    5   HG13  VAL  78          HG12      VAL  78 -26.339  -3.136   3.517
    6   HG12  VAL  78          HG13      VAL  78 -24.962  -2.042   3.644
    7   HG22  VAL  78          HG21      VAL  78 -26.155  -0.079   4.541
    8   HG21  VAL  78          HG22      VAL  78 -26.845   0.926   3.267
    9   HG23  VAL  78          HG23      VAL  78 -25.198   0.316   3.113

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ILE  79           H        ILE  79 -25.501  -2.502  -0.070
    2    HA   ILE  79           HA       ILE  79 -27.637  -3.876  -1.412
    3    HB   ILE  79           HB       ILE  79 -24.676  -4.551  -1.199
    4   HG12  ILE  79          HG12      ILE  79 -26.262  -3.367  -3.482
    5   HG13  ILE  79          HG13      ILE  79 -25.335  -2.402  -2.333
    6   HG22  ILE  79          HG21      ILE  79 -25.842  -5.674  -3.514
    7   HG21  ILE  79          HG22      ILE  79 -26.848  -6.147  -2.144
    8   HG23  ILE  79          HG23      ILE  79 -25.123  -6.511  -2.138
    9   HD13  ILE  79          HD11      ILE  79 -23.933  -2.586  -4.155
   10   HD12  ILE  79          HD12      ILE  79 -24.358  -4.275  -4.433
   11   HD11  ILE  79          HD13      ILE  79 -23.348  -3.837  -3.056

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ASP  80           H        ASP  80 -28.596  -5.754  -0.825
    2    HA   ASP  80           HA       ASP  80 -28.580  -6.654   1.822
    3    HB2  ASP  80           HB2      ASP  80 -30.365  -7.142   0.186
    4    HB3  ASP  80           HB3      ASP  80 -29.261  -8.207  -0.685

  No H/Q in entry =           4
  In of MODEL   46
    1    H    SER  81           H        SER  81 -27.100  -7.864   2.947
    2    HA   SER  81           HA       SER  81 -24.644  -8.670   1.750
    3    HB2  SER  81           HB2      SER  81 -24.136  -9.721   3.917
    4    HB3  SER  81           HB3      SER  81 -24.763  -8.087   4.134
    5    HG   SER  81           HG       SER  81 -26.726  -9.938   4.100

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU  82           H        LEU  82 -27.455 -10.623   2.080
    2    HA   LEU  82           HA       LEU  82 -26.029 -13.067   1.557
    3    HB2  LEU  82           HB2      LEU  82 -28.938 -12.434   1.117
    4    HB3  LEU  82           HB3      LEU  82 -28.211 -14.031   1.287
    5    HG   LEU  82           HG       LEU  82 -28.441 -11.972   3.462
    6   HD11  LEU  82          HD11      LEU  82 -30.585 -13.050   2.720
    7   HD13  LEU  82          HD12      LEU  82 -30.133 -13.430   4.382
    8   HD12  LEU  82          HD13      LEU  82 -29.868 -14.616   3.104
    9   HD22  LEU  82          HD21      LEU  82 -26.481 -13.274   3.800
   10   HD21  LEU  82          HD22      LEU  82 -27.291 -14.752   3.283
   11   HD23  LEU  82          HD23      LEU  82 -27.723 -14.002   4.820

  No H/Q in entry =          11
  In of MODEL   46
    1    H    LEU  83           H        LEU  83 -27.879 -10.747  -0.358
    2    HA   LEU  83           HA       LEU  83 -27.753 -12.115  -2.829
    3    HB2  LEU  83           HB2      LEU  83 -28.015  -9.190  -2.182
    4    HB3  LEU  83           HB3      LEU  83 -28.083  -9.834  -3.822
    5    HG   LEU  83           HG       LEU  83 -30.128 -10.117  -1.640
    6   HD13  LEU  83          HD11      LEU  83 -30.793  -8.235  -2.704
    7   HD12  LEU  83          HD12      LEU  83 -31.314  -9.324  -3.987
    8   HD11  LEU  83          HD13      LEU  83 -29.740  -8.537  -4.084
    9   HD23  LEU  83          HD21      LEU  83 -30.337 -11.369  -4.364
   10   HD22  LEU  83          HD22      LEU  83 -31.319 -11.669  -2.931
   11   HD21  LEU  83          HD23      LEU  83 -29.659 -12.256  -3.000

  No H/Q in entry =          11
  In of MODEL   46
    1    H    TYR  84           H        TYR  84 -25.677  -9.830  -1.160
    2    HA   TYR  84           HA       TYR  84 -23.799  -9.437  -3.295
    3    HB2  TYR  84           HB2      TYR  84 -24.236  -7.925  -1.275
    4    HB3  TYR  84           HB3      TYR  84 -23.273  -9.075  -0.349
    5    HD1  TYR  84           HD1      TYR  84 -20.907  -9.025  -0.416
    6    HD2  TYR  84           HD2      TYR  84 -23.154  -6.696  -3.204
    7    HE1  TYR  84           HE1      TYR  84 -18.827  -7.902  -1.137
    8    HE2  TYR  84           HE2      TYR  84 -21.081  -5.574  -3.942
    9    HH   TYR  84           HH       TYR  84 -18.880  -5.162  -3.273

  No H/Q in entry =           9
  In of MODEL   46
    1    H    GLY  85           H        GLY  85 -23.652 -11.447  -0.348
    2    HA3  GLY  85           HA2      GLY  85 -21.126 -12.519  -0.837
    3    HA2  GLY  85           HA3      GLY  85 -22.395 -13.302   0.105

  No H/Q in entry =           3
  In of MODEL   46
    1    H    LYS  86           H        LYS  86 -24.263 -13.583  -1.950
    2    HA   LYS  86           HA       LYS  86 -23.334 -16.009  -3.211
    3    HB2  LYS  86           HB2      LYS  86 -25.578 -15.686  -2.223
    4    HB3  LYS  86           HB3      LYS  86 -25.913 -14.454  -3.439
    5    HG2  LYS  86           HG2      LYS  86 -25.836 -16.124  -5.175
    6    HG3  LYS  86           HG3      LYS  86 -25.452 -17.363  -3.980
    7    HD2  LYS  86           HD2      LYS  86 -27.540 -16.855  -2.786
    8    HD3  LYS  86           HD3      LYS  86 -27.927 -15.627  -3.990
    9    HE2  LYS  86           HE2      LYS  86 -27.996 -17.340  -5.728
   10    HE3  LYS  86           HE3      LYS  86 -27.583 -18.573  -4.536
   11    HZ2  LYS  86           HZ1      LYS  86 -30.069 -17.003  -4.789
   12    HZ1  LYS  86           HZ2      LYS  86 -29.629 -17.674  -3.292
   13    HZ3  LYS  86           HZ3      LYS  86 -29.878 -18.683  -4.633

  No H/Q in entry =          13
  In of MODEL   46
    1    H    VAL  87           H        VAL  87 -23.164 -12.799  -4.108
    2    HA   VAL  87           HA       VAL  87 -22.812 -11.644  -6.051
    3    HB   VAL  87           HB       VAL  87 -21.874 -14.208  -7.370
    4   HG13  VAL  87          HG11      VAL  87 -20.585 -12.806  -8.698
    5   HG12  VAL  87          HG12      VAL  87 -20.475 -11.559  -7.454
    6   HG11  VAL  87          HG13      VAL  87 -21.964 -11.756  -8.379
    7   HG22  VAL  87          HG21      VAL  87 -20.866 -14.343  -5.205
    8   HG21  VAL  87          HG22      VAL  87 -20.397 -12.645  -5.265
    9   HG23  VAL  87          HG23      VAL  87 -19.641 -13.807  -6.354

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ASP  88           H        ASP  88 -25.356 -12.159  -5.691
    2    HA   ASP  88           HA       ASP  88 -26.544 -13.320  -8.084
    3    HB2  ASP  88           HB2      ASP  88 -27.543 -13.512  -5.756
    4    HB3  ASP  88           HB3      ASP  88 -27.911 -11.791  -5.856

  No H/Q in entry =           4
  In of MODEL   46
    1    H    GLY  89           H        GLY  89 -25.783 -12.100  -9.729
    2    HA3  GLY  89           HA2      GLY  89 -25.827  -9.322  -9.932
    3    HA2  GLY  89           HA3      GLY  89 -25.863 -10.445 -11.291

  No H/Q in entry =           3
  In of MODEL   46
    1    H    LEU  90           H        LEU  90 -28.372 -11.673 -10.833
    2    HA   LEU  90           HA       LEU  90 -30.088  -9.652 -11.944
    3    HB2  LEU  90           HB2      LEU  90 -30.274 -12.042 -12.520
    4    HB3  LEU  90           HB3      LEU  90 -30.792 -12.381 -10.870
    5    HG   LEU  90           HG       LEU  90 -32.854 -11.161 -11.227
    6   HD13  LEU  90          HD11      LEU  90 -32.594  -9.433 -12.705
    7   HD12  LEU  90          HD12      LEU  90 -33.197 -10.643 -13.839
    8   HD11  LEU  90          HD13      LEU  90 -31.465 -10.333 -13.721
    9   HD23  LEU  90          HD21      LEU  90 -32.873 -12.796 -13.661
   10   HD22  LEU  90          HD22      LEU  90 -33.854 -12.910 -12.200
   11   HD21  LEU  90          HD23      LEU  90 -32.233 -13.604 -12.230

  No H/Q in entry =          11
  In of MODEL   46
    1    H    GLY  91           H        GLY  91 -29.984 -11.156  -8.758
    2    HA3  GLY  91           HA2      GLY  91 -32.262  -9.928  -7.712
    3    HA2  GLY  91           HA3      GLY  91 -30.895 -10.529  -6.774

  No H/Q in entry =           3
  In of MODEL   46
    1    H    VAL  92           H        VAL  92 -28.891  -8.799  -7.639
    2    HA   VAL  92           HA       VAL  92 -29.563  -6.460  -6.090
    3    HB   VAL  92           HB       VAL  92 -27.049  -7.056  -7.694
    4   HG12  VAL  92          HG11      VAL  92 -27.112  -5.162  -5.369
    5   HG11  VAL  92          HG12      VAL  92 -27.754  -4.588  -6.909
    6   HG13  VAL  92          HG13      VAL  92 -26.084  -5.140  -6.803
    7   HG22  VAL  92          HG21      VAL  92 -26.898  -8.651  -6.100
    8   HG21  VAL  92          HG22      VAL  92 -27.999  -7.814  -5.004
    9   HG23  VAL  92          HG23      VAL  92 -26.319  -7.295  -5.132

  No H/Q in entry =           9
  In of MODEL   46
    1    H    LEU  93           H        LEU  93 -29.201  -7.145  -9.511
    2    HA   LEU  93           HA       LEU  93 -29.420  -4.497 -10.443
    3    HB2  LEU  93           HB2      LEU  93 -28.875  -6.382 -11.904
    4    HB3  LEU  93           HB3      LEU  93 -30.500  -7.031 -11.675
    5    HG   LEU  93           HG       LEU  93 -31.418  -5.022 -12.799
    6   HD11  LEU  93          HD11      LEU  93 -29.489  -3.519 -12.303
    7   HD13  LEU  93          HD12      LEU  93 -29.935  -3.529 -14.010
    8   HD12  LEU  93          HD13      LEU  93 -28.524  -4.433 -13.462
    9   HD23  LEU  93          HD21      LEU  93 -30.416  -5.642 -15.088
   10   HD22  LEU  93          HD22      LEU  93 -31.316  -6.854 -14.177
   11   HD21  LEU  93          HD23      LEU  93 -29.550  -6.885 -14.186

  No H/Q in entry =          11
  In of MODEL   46
    1    H    LYS  94           H        LYS  94 -31.914  -6.923  -9.581
    2    HA   LYS  94           HA       LYS  94 -34.187  -5.368 -10.200
    3    HB2  LYS  94           HB2      LYS  94 -33.773  -7.574  -8.187
    4    HB3  LYS  94           HB3      LYS  94 -35.336  -6.800  -8.450
    5    HG2  LYS  94           HG2      LYS  94 -35.296  -7.582 -10.784
    6    HG3  LYS  94           HG3      LYS  94 -33.773  -8.408 -10.461
    7    HD2  LYS  94           HD2      LYS  94 -34.951  -9.684  -8.630
    8    HD3  LYS  94           HD3      LYS  94 -36.462  -8.962  -9.180
    9    HE2  LYS  94           HE2      LYS  94 -36.002  -9.918 -11.447
   10    HE3  LYS  94           HE3      LYS  94 -34.624 -10.768 -10.748
   11    HZ3  LYS  94           HZ1      LYS  94 -36.547 -12.198 -10.909
   12    HZ2  LYS  94           HZ2      LYS  94 -37.466 -11.124  -9.965
   13    HZ1  LYS  94           HZ3      LYS  94 -36.142 -11.937  -9.281

  No H/Q in entry =          13
  In of MODEL   46
    1    H    ALA  95           H        ALA  95 -32.360  -5.574  -7.158
    2    HA   ALA  95           HA       ALA  95 -34.124  -3.904  -5.673
    3    HB2  ALA  95           HB1      ALA  95 -31.817  -5.393  -5.144
    4    HB3  ALA  95           HB2      ALA  95 -32.746  -4.440  -3.988
    5    HB1  ALA  95           HB3      ALA  95 -31.364  -3.721  -4.815

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA  96           H        ALA  96 -31.452  -3.183  -7.782
    2    HA   ALA  96           HA       ALA  96 -31.216  -0.429  -7.011
    3    HB2  ALA  96           HB1      ALA  96 -29.853  -0.273  -9.126
    4    HB3  ALA  96           HB2      ALA  96 -30.242  -1.963  -9.443
    5    HB1  ALA  96           HB3      ALA  96 -29.299  -1.528  -8.017

  No H/Q in entry =           5
  In of MODEL   46
    1    H    VAL  97           H        VAL  97 -32.841  -2.069  -9.691
    2    HA   VAL  97           HA       VAL  97 -33.800   0.281 -10.944
    3    HB   VAL  97           HB       VAL  97 -34.755  -2.601 -10.981
    4   HG11  VAL  97          HG11      VAL  97 -36.446  -0.508 -11.462
    5   HG13  VAL  97          HG12      VAL  97 -36.588  -2.097 -12.216
    6   HG12  VAL  97          HG13      VAL  97 -35.771  -0.788 -13.068
    7   HG21  VAL  97          HG21      VAL  97 -33.394  -0.842 -13.022
    8   HG23  VAL  97          HG22      VAL  97 -33.932  -2.496 -13.308
    9   HG22  VAL  97          HG23      VAL  97 -32.660  -2.172 -12.128

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ALA  98           H        ALA  98 -35.081  -1.834  -8.401
    2    HA   ALA  98           HA       ALA  98 -37.579  -0.557  -8.042
    3    HB1  ALA  98           HB1      ALA  98 -36.675  -2.804  -7.011
    4    HB3  ALA  98           HB2      ALA  98 -37.802  -1.821  -6.076
    5    HB2  ALA  98           HB3      ALA  98 -36.076  -1.758  -5.723

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA  99           H        ALA  99 -34.457   0.086  -6.407
    2    HA   ALA  99           HA       ALA  99 -35.477   2.125  -4.742
    3    HB1  ALA  99           HB1      ALA  99 -32.881   1.101  -5.500
    4    HB2  ALA  99           HB2      ALA  99 -33.386   1.879  -3.999
    5    HB3  ALA  99           HB3      ALA  99 -32.865   2.859  -5.369

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ILE 100           H        ILE 100 -34.445   2.201  -8.102
    2    HA   ILE 100           HA       ILE 100 -34.477   5.055  -8.323
    3    HB   ILE 100           HB       ILE 100 -34.692   2.906 -10.460
    4   HG12  ILE 100          HG12      ILE 100 -32.426   4.784  -9.798
    5   HG13  ILE 100          HG13      ILE 100 -32.544   3.142  -9.167
    6   HG21  ILE 100          HG21      ILE 100 -34.964   5.845 -10.590
    7   HG23  ILE 100          HG22      ILE 100 -35.539   4.603 -11.704
    8   HG22  ILE 100          HG23      ILE 100 -33.857   5.133 -11.765
    9   HD12  ILE 100          HD11      ILE 100 -31.974   4.070 -11.943
   10   HD11  ILE 100          HD12      ILE 100 -32.717   2.491 -11.685
   11   HD13  ILE 100          HD13      ILE 100 -31.147   2.854 -10.972

  No H/Q in entry =          11
  In of MODEL   46
    1    H    LYS 101           H        LYS 101 -36.905   2.567  -9.039
    2    HA   LYS 101           HA       LYS 101 -38.903   4.322 -10.031
    3    HB2  LYS 101           HB2      LYS 101 -38.927   1.546  -8.903
    4    HB3  LYS 101           HB3      LYS 101 -40.438   2.387  -9.243
    5    HG2  LYS 101           HG2      LYS 101 -39.966   2.496 -11.542
    6    HG3  LYS 101           HG3      LYS 101 -38.292   2.004 -11.293
    7    HD2  LYS 101           HD2      LYS 101 -39.643   0.163 -12.174
    8    HD3  LYS 101           HD3      LYS 101 -39.028  -0.199 -10.561
    9    HE2  LYS 101           HE2      LYS 101 -41.122  -0.786 -10.047
   10    HE3  LYS 101           HE3      LYS 101 -41.490   0.940 -10.049
   11    HZ3  LYS 101           HZ1      LYS 101 -42.397   0.829 -12.163
   12    HZ2  LYS 101           HZ2      LYS 101 -42.931  -0.618 -11.453
   13    HZ1  LYS 101           HZ3      LYS 101 -41.628  -0.638 -12.541

  No H/Q in entry =          13
  In of MODEL   46
    1    H    LYS 102           H        LYS 102 -38.476   2.821  -6.823
    2    HA   LYS 102           HA       LYS 102 -40.654   4.131  -5.618
    3    HB2  LYS 102           HB2      LYS 102 -39.512   2.203  -4.607
    4    HB3  LYS 102           HB3      LYS 102 -38.067   3.184  -4.369
    5    HG2  LYS 102           HG2      LYS 102 -39.305   4.645  -2.867
    6    HG3  LYS 102           HG3      LYS 102 -40.753   3.669  -3.107
    7    HD2  LYS 102           HD2      LYS 102 -39.621   1.740  -2.086
    8    HD3  LYS 102           HD3      LYS 102 -38.174   2.719  -1.844
    9    HE2  LYS 102           HE2      LYS 102 -39.444   4.266  -0.430
   10    HE3  LYS 102           HE3      LYS 102 -40.907   3.319  -0.693
   11    HZ1  LYS 102           HZ1      LYS 102 -39.277   1.477   0.304
   12    HZ3  LYS 102           HZ2      LYS 102 -40.337   2.419   1.238
   13    HZ2  LYS 102           HZ3      LYS 102 -38.701   2.859   1.106

  No H/Q in entry =          13
  In of MODEL   46
    1    H    ALA 103           H        ALA 103 -37.635   5.367  -6.641
    2    HA   ALA 103           HA       ALA 103 -37.731   7.690  -4.858
    3    HB2  ALA 103           HB1      ALA 103 -35.709   8.320  -6.441
    4    HB3  ALA 103           HB2      ALA 103 -35.765   6.603  -6.839
    5    HB1  ALA 103           HB3      ALA 103 -35.505   7.114  -5.172

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA 104           H        ALA 104 -38.401   6.994  -8.202
    2    HA   ALA 104           HA       ALA 104 -38.843   9.805  -8.822
    3    HB2  ALA 104           HB1      ALA 104 -38.928   9.141 -11.023
    4    HB1  ALA 104           HB2      ALA 104 -39.734   7.619 -10.644
    5    HB3  ALA 104           HB3      ALA 104 -37.999   7.792 -10.371

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA 105           H        ALA 105 -40.552   7.786  -7.012
    2    HA   ALA 105           HA       ALA 105 -42.901   9.304  -6.976
    3    HB2  ALA 105           HB1      ALA 105 -43.696   8.485  -9.013
    4    HB3  ALA 105           HB2      ALA 105 -44.390   7.331  -7.875
    5    HB1  ALA 105           HB3      ALA 105 -42.943   6.906  -8.788

  No H/Q in entry =           5
  In of MODEL   47
    1    H1   ALA   1           H3       ALA   1 -12.067 -16.068  -2.283
    2    H2   ALA   1           H2       ALA   1 -11.115 -17.195  -3.131
    3    H3   ALA   1           H1       ALA   1 -12.278 -16.268  -3.956
    4    HA   ALA   1           HA       ALA   1 -13.650 -17.989  -3.707
    5    HB3  ALA   1           HB1      ALA   1 -12.224 -19.740  -3.256
    6    HB1  ALA   1           HB2      ALA   1 -12.971 -19.639  -1.661
    7    HB2  ALA   1           HB3      ALA   1 -11.408 -18.875  -1.953

  No H/Q in entry =           7
  In of MODEL   47
    1    H    GLU   2           H        GLU   2 -15.248 -18.868  -2.042
    2    HA   GLU   2           HA       GLU   2 -16.914 -17.173  -0.971
    3    HB2  GLU   2           HB2      GLU   2 -15.928 -19.585   0.566
    4    HB3  GLU   2           HB3      GLU   2 -17.462 -18.758   0.831
    5    HG2  GLU   2           HG2      GLU   2 -18.438 -19.858  -0.896
    6    HG3  GLU   2           HG3      GLU   2 -17.129 -19.437  -1.990

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLU   3           H        GLU   3 -14.963 -18.498   1.638
    2    HA   GLU   3           HA       GLU   3 -15.209 -16.149   3.198
    3    HB2  GLU   3           HB2      GLU   3 -13.584 -18.672   3.436
    4    HB3  GLU   3           HB3      GLU   3 -13.364 -17.350   4.582
    5    HG2  GLU   3           HG2      GLU   3 -15.549 -17.534   5.416
    6    HG3  GLU   3           HG3      GLU   3 -16.142 -18.342   3.971

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LEU   4           H        LEU   4 -12.242 -17.583   1.786
    2    HA   LEU   4           HA       LEU   4 -10.432 -15.653   2.372
    3    HB2  LEU   4           HB2      LEU   4 -10.663 -16.953  -0.352
    4    HB3  LEU   4           HB3      LEU   4  -9.217 -16.211   0.323
    5    HG   LEU   4           HG       LEU   4 -10.667 -18.631   1.445
    6   HD13  LEU   4          HD11      LEU   4  -9.021 -19.962   0.504
    7   HD12  LEU   4          HD12      LEU   4  -7.831 -18.661   0.469
    8   HD11  LEU   4          HD13      LEU   4  -9.128 -18.702  -0.724
    9   HD23  LEU   4          HD21      LEU   4  -8.406 -18.661   2.811
   10   HD22  LEU   4          HD22      LEU   4  -9.738 -17.642   3.350
   11   HD21  LEU   4          HD23      LEU   4  -8.392 -16.932   2.458

  No H/Q in entry =          11
  In of MODEL   47
    1    H    GLU   5           H        GLU   5 -12.788 -15.480  -0.286
    2    HA   GLU   5           HA       GLU   5 -11.829 -12.981  -1.292
    3    HB2  GLU   5           HB2      GLU   5 -13.167 -14.598  -2.637
    4    HB3  GLU   5           HB3      GLU   5 -14.565 -14.231  -1.626
    5    HG2  GLU   5           HG2      GLU   5 -14.735 -12.855  -3.594
    6    HG3  GLU   5           HG3      GLU   5 -14.272 -11.803  -2.256

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLU   6           H        GLU   6 -14.526 -13.900   0.818
    2    HA   GLU   6           HA       GLU   6 -15.467 -11.238   1.225
    3    HB2  GLU   6           HB2      GLU   6 -16.863 -13.247   1.633
    4    HB3  GLU   6           HB3      GLU   6 -15.814 -13.682   2.982
    5    HG2  GLU   6           HG2      GLU   6 -16.362 -11.572   4.113
    6    HG3  GLU   6           HG3      GLU   6 -17.382 -11.097   2.757

  No H/Q in entry =           6
  In of MODEL   47
    1    H    VAL   7           H        VAL   7 -13.118 -13.314   2.780
    2    HA   VAL   7           HA       VAL   7 -12.659 -11.734   5.104
    3    HB   VAL   7           HB       VAL   7 -10.936 -13.751   3.642
    4   HG11  VAL   7          HG11      VAL   7 -10.473 -12.213   6.204
    5   HG13  VAL   7          HG12      VAL   7  -9.379 -12.410   4.836
    6   HG12  VAL   7          HG13      VAL   7  -9.705 -13.772   5.907
    7   HG21  VAL   7          HG21      VAL   7 -13.170 -14.349   4.877
    8   HG23  VAL   7          HG22      VAL   7 -12.236 -14.062   6.347
    9   HG22  VAL   7          HG23      VAL   7 -11.733 -15.314   5.213

  No H/Q in entry =           9
  In of MODEL   47
    1    H    VAL   8           H        VAL   8 -11.168 -11.825   1.884
    2    HA   VAL   8           HA       VAL   8  -9.130  -9.922   2.364
    3    HB   VAL   8           HB       VAL   8 -10.585 -10.749  -0.151
    4   HG12  VAL   8          HG11      VAL   8  -8.604  -9.506  -1.266
    5   HG11  VAL   8          HG12      VAL   8  -8.444  -8.660   0.274
    6   HG13  VAL   8          HG13      VAL   8  -9.940  -8.530  -0.651
    7   HG23  VAL   8          HG21      VAL   8  -7.781 -11.260  -0.230
    8   HG22  VAL   8          HG22      VAL   8  -9.075 -12.442  -0.063
    9   HG21  VAL   8          HG23      VAL   8  -8.324 -11.756   1.375

  No H/Q in entry =           9
  In of MODEL   47
    1    H    MET   9           H        MET   9 -12.489  -9.581   1.226
    2    HA   MET   9           HA       MET   9 -12.469  -6.804   0.793
    3    HB2  MET   9           HB2      MET   9 -14.619  -8.762   1.559
    4    HB3  MET   9           HB3      MET   9 -14.969  -7.032   1.506
    5    HG2  MET   9           HG2      MET   9 -13.923  -7.066  -0.843
    6    HG3  MET   9           HG3      MET   9 -14.057  -8.821  -0.749
    7    HE3  MET   9           HE1      MET   9 -17.609  -9.728  -0.872
    8    HE2  MET   9           HE2      MET   9 -16.813  -9.526   0.686
    9    HE1  MET   9           HE3      MET   9 -15.902 -10.151  -0.685

  No H/Q in entry =           9
  In of MODEL   47
    1    H    GLY  10           H        GLY  10 -13.084  -8.705   3.724
    2    HA3  GLY  10           HA2      GLY  10 -13.653  -6.530   5.447
    3    HA2  GLY  10           HA3      GLY  10 -13.062  -8.110   5.956

  No H/Q in entry =           3
  In of MODEL   47
    1    H    LEU  11           H        LEU  11 -10.624  -8.197   4.625
    2    HA   LEU  11           HA       LEU  11  -8.933  -6.739   6.371
    3    HB2  LEU  11           HB2      LEU  11  -8.382  -8.153   3.759
    4    HB3  LEU  11           HB3      LEU  11  -7.116  -7.430   4.749
    5    HG   LEU  11           HG       LEU  11  -9.080  -9.493   5.779
    6   HD13  LEU  11          HD11      LEU  11  -7.851 -10.711   4.206
    7   HD12  LEU  11          HD12      LEU  11  -6.902 -10.935   5.674
    8   HD11  LEU  11          HD13      LEU  11  -6.387  -9.762   4.463
    9   HD22  LEU  11          HD21      LEU  11  -8.230  -8.468   7.690
   10   HD21  LEU  11          HD22      LEU  11  -6.704  -8.043   6.917
   11   HD23  LEU  11          HD23      LEU  11  -7.001  -9.704   7.428

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  12           H        ILE  12  -9.866  -6.204   2.987
    2    HA   ILE  12           HA       ILE  12  -8.212  -3.949   2.550
    3    HB   ILE  12           HB       ILE  12 -10.864  -4.660   1.272
    4   HG12  ILE  12          HG12      ILE  12  -8.805  -6.281   1.183
    5   HG13  ILE  12          HG13      ILE  12  -9.678  -5.934  -0.296
    6   HG22  ILE  12          HG21      ILE  12 -10.000  -3.248  -0.618
    7   HG21  ILE  12          HG22      ILE  12  -8.672  -2.735   0.417
    8   HG23  ILE  12          HG23      ILE  12 -10.317  -2.352   0.836
    9   HD12  ILE  12          HD11      ILE  12  -7.170  -5.849  -0.503
   10   HD11  ILE  12          HD12      ILE  12  -7.182  -4.474   0.600
   11   HD13  ILE  12          HD13      ILE  12  -7.967  -4.355  -0.958

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  13           H        ILE  13 -11.561  -4.269   3.666
    2    HA   ILE  13           HA       ILE  13 -12.063  -1.489   3.939
    3    HB   ILE  13           HB       ILE  13 -13.220  -3.930   5.305
    4   HG12  ILE  13          HG12      ILE  13 -13.476  -3.404   2.776
    5   HG13  ILE  13          HG13      ILE  13 -14.900  -3.849   3.694
    6   HG22  ILE  13          HG21      ILE  13 -15.155  -2.218   5.783
    7   HG21  ILE  13          HG22      ILE  13 -13.882  -1.011   5.669
    8   HG23  ILE  13          HG23      ILE  13 -13.777  -2.287   6.879
    9   HD13  ILE  13          HD11      ILE  13 -15.810  -1.732   3.585
   10   HD12  ILE  13          HD12      ILE  13 -14.857  -1.711   2.115
   11   HD11  ILE  13          HD13      ILE  13 -14.223  -0.957   3.561

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ASN  14           H        ASN  14 -10.897  -3.962   6.206
    2    HA   ASN  14           HA       ASN  14 -10.707  -2.321   8.491
    3    HB2  ASN  14           HB2      ASN  14 -10.414  -4.924   8.166
    4    HB3  ASN  14           HB3      ASN  14  -8.713  -4.509   7.998
    5   HD21  ASN  14          HD21      ASN  14  -9.310  -6.044  10.178
    6   HD22  ASN  14          HD22      ASN  14  -9.288  -5.124  11.602

  No H/Q in entry =           6
  In of MODEL   47
    1    H    SER  15           H        SER  15  -8.309  -3.105   5.983
    2    HA   SER  15           HA       SER  15  -6.183  -1.577   7.041
    3    HB2  SER  15           HB2      SER  15  -5.177  -1.770   4.872
    4    HB3  SER  15           HB3      SER  15  -6.096  -3.251   5.111
    5    HG   SER  15           HG       SER  15  -6.411  -1.296   3.266

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLY  16           H        GLY  16  -8.813  -0.754   4.811
    2    HA3  GLY  16           HA2      GLY  16  -8.003   1.901   4.255
    3    HA2  GLY  16           HA3      GLY  16  -9.645   1.279   4.104

  No H/Q in entry =           3
  In of MODEL   47
    1    H    GLN  17           H        GLN  17 -10.158   0.544   6.756
    2    HA   GLN  17           HA       GLN  17 -10.901   3.036   7.902
    3    HB2  GLN  17           HB2      GLN  17 -12.101   0.942   8.401
    4    HB3  GLN  17           HB3      GLN  17 -10.676   0.325   9.236
    5    HG2  GLN  17           HG2      GLN  17 -10.797   2.179  10.846
    6    HG3  GLN  17           HG3      GLN  17 -12.199   2.833  10.001
    7   HE21  GLN  17          HE21      GLN  17 -12.365   2.061  12.750
    8   HE22  GLN  17          HE22      GLN  17 -13.381   0.705  12.863

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ALA  18           H        ALA  18  -8.229   0.801   8.504
    2    HA   ALA  18           HA       ALA  18  -7.138   2.036  10.768
    3    HB2  ALA  18           HB1      ALA  18  -6.498  -0.169   9.396
    4    HB3  ALA  18           HB2      ALA  18  -5.342   0.634  10.459
    5    HB1  ALA  18           HB3      ALA  18  -5.281   0.914   8.718

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ARG  19           H        ARG  19  -6.398   2.573   7.314
    2    HA   ARG  19           HA       ARG  19  -4.534   4.653   7.731
    3    HB2  ARG  19           HB2      ARG  19  -4.855   3.507   5.538
    4    HB3  ARG  19           HB3      ARG  19  -6.413   4.320   5.371
    5    HG2  ARG  19           HG2      ARG  19  -5.323   6.512   5.432
    6    HG3  ARG  19           HG3      ARG  19  -3.758   5.754   5.726
    7    HD2  ARG  19           HD2      ARG  19  -3.909   6.342   3.384
    8    HD3  ARG  19           HD3      ARG  19  -3.961   4.581   3.530
    9    HE   ARG  19           HE       ARG  19  -6.611   5.442   3.539
   10   HH21  ARG  19          HH11      ARG  19  -7.821   5.577   1.629
   11   HH22  ARG  19          HH12      ARG  19  -7.011   5.669   0.104
   12   HH11  ARG  19          HH21      ARG  19  -3.850   5.555   1.488
   13   HH12  ARG  19          HH22      ARG  19  -4.761   5.655   0.024

  No H/Q in entry =          13
  In of MODEL   47
    1    H    SER  20           H        SER  20  -8.037   4.705   7.153
    2    HA   SER  20           HA       SER  20  -8.445   7.454   7.107
    3    HB2  SER  20           HB2      SER  20 -10.302   6.082   6.583
    4    HB3  SER  20           HB3      SER  20 -10.165   5.187   8.094
    5    HG   SER  20           HG       SER  20 -10.796   7.049   9.194

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU  21           H        LEU  21  -8.387   5.272   9.911
    2    HA   LEU  21           HA       LEU  21  -8.852   7.259  11.879
    3    HB2  LEU  21           HB2      LEU  21  -7.447   4.584  12.032
    4    HB3  LEU  21           HB3      LEU  21  -7.770   5.595  13.437
    5    HG   LEU  21           HG       LEU  21  -9.929   4.652  11.528
    6   HD11  LEU  21          HD11      LEU  21  -8.920   3.461  14.121
    7   HD13  LEU  21          HD12      LEU  21  -9.020   2.677  12.544
    8   HD12  LEU  21          HD13      LEU  21 -10.496   3.068  13.430
    9   HD21  LEU  21          HD21      LEU  21  -9.871   6.199  14.105
   10   HD23  LEU  21          HD22      LEU  21 -11.247   5.142  13.805
   11   HD22  LEU  21          HD23      LEU  21 -10.887   6.451  12.690

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ALA  22           H        ALA  22  -5.883   5.941  10.453
    2    HA   ALA  22           HA       ALA  22  -4.019   7.290  12.063
    3    HB2  ALA  22           HB1      ALA  22  -3.578   5.444  10.370
    4    HB1  ALA  22           HB2      ALA  22  -2.407   6.762  10.397
    5    HB3  ALA  22           HB3      ALA  22  -3.631   6.696   9.129

  No H/Q in entry =           5
  In of MODEL   47
    1    H    TYR  23           H        TYR  23  -5.374   8.281   8.889
    2    HA   TYR  23           HA       TYR  23  -4.086  10.802   8.810
    3    HB2  TYR  23           HB2      TYR  23  -5.160   9.872   6.825
    4    HB3  TYR  23           HB3      TYR  23  -6.735   9.945   7.616
    5    HD1  TYR  23           HD1      TYR  23  -3.873  12.067   6.493
    6    HD2  TYR  23           HD2      TYR  23  -8.030  11.913   7.564
    7    HE1  TYR  23           HE1      TYR  23  -4.154  14.413   5.738
    8    HE2  TYR  23           HE2      TYR  23  -8.312  14.258   6.807
    9    HH   TYR  23           HH       TYR  23  -5.541  16.138   5.585

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ALA  24           H        ALA  24  -7.178   9.766  10.209
    2    HA   ALA  24           HA       ALA  24  -8.059  12.340  10.985
    3    HB1  ALA  24           HB1      ALA  24  -9.850  11.055  11.464
    4    HB2  ALA  24           HB2      ALA  24  -9.005  10.499  12.907
    5    HB3  ALA  24           HB3      ALA  24  -8.871   9.590  11.402

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA  25           H        ALA  25  -6.001   9.920  12.547
    2    HA   ALA  25           HA       ALA  25  -5.671  11.179  15.047
    3    HB2  ALA  25           HB1      ALA  25  -4.865   8.842  14.221
    4    HB3  ALA  25           HB2      ALA  25  -3.859   9.720  15.376
    5    HB1  ALA  25           HB3      ALA  25  -3.433   9.711  13.664

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU  26           H        LEU  26  -3.905  11.512  11.996
    2    HA   LEU  26           HA       LEU  26  -1.976  13.368  12.900
    3    HB2  LEU  26           HB2      LEU  26  -1.665  12.222  10.794
    4    HB3  LEU  26           HB3      LEU  26  -3.156  12.902  10.148
    5    HG   LEU  26           HG       LEU  26  -2.183  15.171  10.278
    6   HD12  LEU  26          HD11      LEU  26   0.357  15.239  10.676
    7   HD11  LEU  26          HD12      LEU  26   0.168  13.654  11.422
    8   HD13  LEU  26          HD13      LEU  26  -0.662  15.054  12.103
    9   HD21  LEU  26          HD21      LEU  26  -0.410  13.150   8.872
   10   HD23  LEU  26          HD22      LEU  26  -0.488  14.870   8.502
   11   HD22  LEU  26          HD23      LEU  26  -1.894  13.846   8.222

  No H/Q in entry =          11
  In of MODEL   47
    1    H    LYS  27           H        LYS  27  -5.175  13.791  11.442
    2    HA   LYS  27           HA       LYS  27  -5.173  16.580  11.243
    3    HB2  LYS  27           HB2      LYS  27  -6.895  15.071  10.268
    4    HB3  LYS  27           HB3      LYS  27  -7.537  14.802  11.888
    5    HG2  LYS  27           HG2      LYS  27  -8.010  17.200  12.127
    6    HG3  LYS  27           HG3      LYS  27  -7.317  17.510  10.532
    7    HD2  LYS  27           HD2      LYS  27  -9.029  16.044   9.506
    8    HD3  LYS  27           HD3      LYS  27  -9.728  15.751  11.100
    9    HE2  LYS  27           HE2      LYS  27 -10.214  18.153  11.346
   10    HE3  LYS  27           HE3      LYS  27  -9.487  18.468   9.767
   11    HZ3  LYS  27           HZ1      LYS  27 -11.863  18.300   9.539
   12    HZ2  LYS  27           HZ2      LYS  27 -11.879  16.783  10.309
   13    HZ1  LYS  27           HZ3      LYS  27 -11.146  16.960   8.783

  No H/Q in entry =          13
  In of MODEL   47
    1    H    GLN  28           H        GLN  28  -6.007  14.479  13.976
    2    HA   GLN  28           HA       GLN  28  -6.928  16.466  15.757
    3    HB2  GLN  28           HB2      GLN  28  -5.475  13.861  16.291
    4    HB3  GLN  28           HB3      GLN  28  -6.226  14.852  17.543
    5    HG2  GLN  28           HG2      GLN  28  -7.679  13.699  15.145
    6    HG3  GLN  28           HG3      GLN  28  -7.720  13.017  16.770
    7   HE21  GLN  28          HE21      GLN  28  -9.602  14.814  14.785
    8   HE22  GLN  28          HE22      GLN  28 -10.374  15.811  15.920

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ALA  29           H        ALA  29  -3.690  15.227  15.048
    2    HA   ALA  29           HA       ALA  29  -2.265  16.650  17.018
    3    HB1  ALA  29           HB1      ALA  29  -0.329  15.993  15.887
    4    HB3  ALA  29           HB2      ALA  29  -1.096  16.104  14.302
    5    HB2  ALA  29           HB3      ALA  29  -1.488  14.764  15.379

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LYS  30           H        LYS  30  -3.158  17.514  13.693
    2    HA   LYS  30           HA       LYS  30  -1.789  19.977  13.584
    3    HB2  LYS  30           HB2      LYS  30  -4.314  19.062  12.191
    4    HB3  LYS  30           HB3      LYS  30  -3.507  20.590  11.842
    5    HG2  LYS  30           HG2      LYS  30  -1.420  19.330  11.316
    6    HG3  LYS  30           HG3      LYS  30  -2.301  17.820  11.566
    7    HD2  LYS  30           HD2      LYS  30  -3.886  18.436   9.781
    8    HD3  LYS  30           HD3      LYS  30  -3.028  19.958   9.533
    9    HE2  LYS  30           HE2      LYS  30  -0.980  18.697   8.941
   10    HE3  LYS  30           HE3      LYS  30  -1.857  17.180   9.158
   11    HZ2  LYS  30           HZ1      LYS  30  -1.709  18.053   6.815
   12    HZ1  LYS  30           HZ2      LYS  30  -2.769  19.300   7.290
   13    HZ3  LYS  30           HZ3      LYS  30  -3.268  17.675   7.365

  No H/Q in entry =          13
  In of MODEL   47
    1    H    GLN  31           H        GLN  31  -4.867  19.078  15.016
    2    HA   GLN  31           HA       GLN  31  -5.668  21.823  15.474
    3    HB2  GLN  31           HB2      GLN  31  -6.802  19.359  16.803
    4    HB3  GLN  31           HB3      GLN  31  -7.587  20.920  16.563
    5    HG2  GLN  31           HG2      GLN  31  -6.882  20.153  13.969
    6    HG3  GLN  31           HG3      GLN  31  -7.380  18.641  14.719
    7   HE21  GLN  31          HE21      GLN  31  -8.826  20.195  12.627
    8   HE22  GLN  31          HE22      GLN  31 -10.341  20.564  13.294

  No H/Q in entry =           8
  In of MODEL   47
    1    H    GLY  32           H        GLY  32  -3.319  19.929  16.778
    2    HA3  GLY  32           HA2      GLY  32  -1.914  20.411  18.571
    3    HA2  GLY  32           HA3      GLY  32  -3.057  21.637  19.103

  No H/Q in entry =           3
  In of MODEL   47
    1    H    ASP  33           H        ASP  33  -4.441  18.578  18.449
    2    HA   ASP  33           HA       ASP  33  -4.826  18.114  21.332
    3    HB2  ASP  33           HB2      ASP  33  -6.234  17.083  18.863
    4    HB3  ASP  33           HB3      ASP  33  -6.560  16.468  20.481

  No H/Q in entry =           4
  In of MODEL   47
    1    H    PHE  34           H        PHE  34  -2.643  17.294  21.622
    2    HA   PHE  34           HA       PHE  34  -1.621  15.059  20.214
    3    HB2  PHE  34           HB2      PHE  34  -0.999  16.051  23.005
    4    HB3  PHE  34           HB3      PHE  34  -0.059  14.842  22.131
    5    HD1  PHE  34           HD1      PHE  34  -0.275  18.265  22.868
    6    HD2  PHE  34           HD2      PHE  34   0.572  15.575  19.627
    7    HE1  PHE  34           HE1      PHE  34   0.988  20.054  21.706
    8    HE2  PHE  34           HE2      PHE  34   1.830  17.367  18.470
    9    HZ   PHE  34           HZ       PHE  34   2.040  19.604  19.514

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ALA  35           H        ALA  35  -3.645  15.307  23.090
    2    HA   ALA  35           HA       ALA  35  -3.390  12.647  23.984
    3    HB3  ALA  35           HB1      ALA  35  -5.850  13.239  24.858
    4    HB1  ALA  35           HB2      ALA  35  -5.343  14.864  24.400
    5    HB2  ALA  35           HB3      ALA  35  -4.408  13.953  25.584

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA  36           H        ALA  36  -5.875  14.131  21.901
    2    HA   ALA  36           HA       ALA  36  -7.259  11.700  21.432
    3    HB1  ALA  36           HB1      ALA  36  -8.741  13.102  20.486
    4    HB3  ALA  36           HB2      ALA  36  -7.583  13.539  19.230
    5    HB2  ALA  36           HB3      ALA  36  -7.610  14.426  20.754

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA  37           H        ALA  37  -4.613  13.325  19.746
    2    HA   ALA  37           HA       ALA  37  -4.570  11.691  17.448
    3    HB3  ALA  37           HB1      ALA  37  -2.592  13.430  18.858
    4    HB2  ALA  37           HB2      ALA  37  -3.135  13.480  17.182
    5    HB1  ALA  37           HB3      ALA  37  -1.961  12.265  17.695

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LYS  38           H        LYS  38  -2.789  11.408  20.514
    2    HA   LYS  38           HA       LYS  38  -1.433   9.028  20.015
    3    HB2  LYS  38           HB2      LYS  38  -1.766  10.784  22.163
    4    HB3  LYS  38           HB3      LYS  38  -2.359   9.246  22.783
    5    HG2  LYS  38           HG2      LYS  38  -0.253   8.155  22.232
    6    HG3  LYS  38           HG3      LYS  38   0.330   9.609  21.415
    7    HD2  LYS  38           HD2      LYS  38   0.495  10.829  23.450
    8    HD3  LYS  38           HD3      LYS  38  -0.502   9.664  24.323
    9    HE2  LYS  38           HE2      LYS  38   1.862   9.381  24.926
   10    HE3  LYS  38           HE3      LYS  38   1.272   7.957  24.065
   11    HZ3  LYS  38           HZ1      LYS  38   2.554   8.395  22.276
   12    HZ2  LYS  38           HZ2      LYS  38   3.505   9.236  23.406
   13    HZ1  LYS  38           HZ3      LYS  38   2.407  10.081  22.423

  No H/Q in entry =          13
  In of MODEL   47
    1    H    ALA  39           H        ALA  39  -4.668   9.476  21.439
    2    HA   ALA  39           HA       ALA  39  -5.187   6.749  21.946
    3    HB3  ALA  39           HB1      ALA  39  -7.378   8.663  21.194
    4    HB2  ALA  39           HB2      ALA  39  -6.473   8.902  22.690
    5    HB1  ALA  39           HB3      ALA  39  -7.371   7.406  22.431

  No H/Q in entry =           5
  In of MODEL   47
    1    H    MET  40           H        MET  40  -5.819   8.755  19.104
    2    HA   MET  40           HA       MET  40  -7.278   6.803  17.653
    3    HB2  MET  40           HB2      MET  40  -5.708   9.222  16.739
    4    HB3  MET  40           HB3      MET  40  -6.727   8.249  15.675
    5    HG2  MET  40           HG2      MET  40  -7.763   9.481  18.241
    6    HG3  MET  40           HG3      MET  40  -7.842  10.316  16.691
    7    HE3  MET  40           HE1      MET  40 -10.416   8.661  14.643
    8    HE2  MET  40           HE2      MET  40  -8.666   8.803  14.483
    9    HE1  MET  40           HE3      MET  40  -9.599  10.155  15.124

  No H/Q in entry =           9
  In of MODEL   47
    1    H    MET  41           H        MET  41  -3.797   7.591  17.752
    2    HA   MET  41           HA       MET  41  -3.027   5.848  15.646
    3    HB2  MET  41           HB2      MET  41  -1.404   6.537  18.109
    4    HB3  MET  41           HB3      MET  41  -0.787   5.899  16.589
    5    HG2  MET  41           HG2      MET  41  -1.982   8.065  15.594
    6    HG3  MET  41           HG3      MET  41  -1.744   8.655  17.237
    7    HE2  MET  41           HE1      MET  41   1.207   6.600  17.578
    8    HE1  MET  41           HE2      MET  41   0.406   7.881  18.482
    9    HE3  MET  41           HE3      MET  41   2.021   8.149  17.829

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ASP  42           H        ASP  42  -3.382   5.367  19.134
    2    HA   ASP  42           HA       ASP  42  -2.307   2.789  19.286
    3    HB2  ASP  42           HB2      ASP  42  -3.195   4.535  21.115
    4    HB3  ASP  42           HB3      ASP  42  -4.607   3.488  21.051

  No H/Q in entry =           4
  In of MODEL   47
    1    H    GLN  43           H        GLN  43  -5.660   3.844  18.808
    2    HA   GLN  43           HA       GLN  43  -6.766   1.240  18.619
    3    HB2  GLN  43           HB2      GLN  43  -7.736   3.879  17.498
    4    HB3  GLN  43           HB3      GLN  43  -8.677   2.386  17.481
    5    HG2  GLN  43           HG2      GLN  43  -8.365   2.267  19.986
    6    HG3  GLN  43           HG3      GLN  43  -7.665   3.883  19.911
    7   HE21  GLN  43          HE21      GLN  43  -9.836   3.929  21.426
    8   HE22  GLN  43          HE22      GLN  43 -11.210   4.485  20.604

  No H/Q in entry =           8
  In of MODEL   47
    1    H    SER  44           H        SER  44  -5.475   3.475  16.200
    2    HA   SER  44           HA       SER  44  -6.169   1.982  13.914
    3    HB2  SER  44           HB2      SER  44  -4.945   4.384  14.352
    4    HB3  SER  44           HB3      SER  44  -3.580   3.408  13.812
    5    HG   SER  44           HG       SER  44  -4.718   4.365  12.057

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ARG  45           H        ARG  45  -3.276   1.910  15.976
    2    HA   ARG  45           HA       ARG  45  -1.776  -0.021  14.583
    3    HB2  ARG  45           HB2      ARG  45  -0.944   1.412  16.447
    4    HB3  ARG  45           HB3      ARG  45  -1.914   0.466  17.573
    5    HG2  ARG  45           HG2      ARG  45  -0.656  -1.574  16.921
    6    HG3  ARG  45           HG3      ARG  45   0.338  -0.603  15.837
    7    HD2  ARG  45           HD2      ARG  45   1.065   0.787  17.789
    8    HD3  ARG  45           HD3      ARG  45   0.166  -0.302  18.868
    9    HE   ARG  45           HE       ARG  45   1.878  -1.871  17.275
   10   HH21  ARG  45          HH11      ARG  45   3.796  -2.667  18.100
   11   HH22  ARG  45          HH12      ARG  45   4.565  -1.870  19.426
   12   HH11  ARG  45          HH21      ARG  45   2.160   0.598  19.665
   13   HH12  ARG  45          HH22      ARG  45   3.639  -0.020  20.310

  No H/Q in entry =          13
  In of MODEL   47
    1    H    MET  46           H        MET  46  -4.152  -0.378  17.198
    2    HA   MET  46           HA       MET  46  -3.941  -3.175  17.501
    3    HB2  MET  46           HB2      MET  46  -6.137  -1.202  18.117
    4    HB3  MET  46           HB3      MET  46  -6.314  -2.925  18.458
    5    HG2  MET  46           HG2      MET  46  -4.319  -2.889  19.866
    6    HG3  MET  46           HG3      MET  46  -4.034  -1.201  19.468
    7    HE2  MET  46           HE1      MET  46  -7.077  -3.130  22.200
    8    HE1  MET  46           HE2      MET  46  -6.148  -3.830  20.878
    9    HE3  MET  46           HE3      MET  46  -7.665  -3.001  20.538

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ALA  47           H        ALA  47  -6.004  -1.186  15.421
    2    HA   ALA  47           HA       ALA  47  -7.598  -3.259  14.364
    3    HB3  ALA  47           HB1      ALA  47  -8.313  -1.031  13.954
    4    HB1  ALA  47           HB2      ALA  47  -7.824  -1.656  12.379
    5    HB2  ALA  47           HB3      ALA  47  -6.754  -0.573  13.270

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU  48           H        LEU  48  -4.505  -1.906  13.295
    2    HA   LEU  48           HA       LEU  48  -4.216  -3.490  10.950
    3    HB2  LEU  48           HB2      LEU  48  -2.166  -2.184  12.747
    4    HB3  LEU  48           HB3      LEU  48  -1.797  -2.899  11.177
    5    HG   LEU  48           HG       LEU  48  -3.848  -0.709  11.581
    6   HD13  LEU  48          HD11      LEU  48  -1.734   0.195  12.234
    7   HD12  LEU  48          HD12      LEU  48  -2.027   0.746  10.585
    8   HD11  LEU  48          HD13      LEU  48  -0.909  -0.585  10.885
    9   HD22  LEU  48          HD21      LEU  48  -4.319  -1.699   9.507
   10   HD21  LEU  48          HD22      LEU  48  -2.632  -2.110   9.201
   11   HD23  LEU  48          HD23      LEU  48  -3.175  -0.438   9.047

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ASN  49           H        ASN  49  -3.145  -3.876  14.289
    2    HA   ASN  49           HA       ASN  49  -1.514  -6.117  13.947
    3    HB2  ASN  49           HB2      ASN  49  -1.540  -4.790  15.997
    4    HB3  ASN  49           HB3      ASN  49  -3.193  -5.282  16.328
    5   HD21  ASN  49          HD21      ASN  49  -3.055  -6.653  18.098
    6   HD22  ASN  49          HD22      ASN  49  -1.985  -7.963  18.225

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLU  50           H        GLU  50  -4.982  -5.888  14.640
    2    HA   GLU  50           HA       GLU  50  -5.457  -8.693  14.749
    3    HB2  GLU  50           HB2      GLU  50  -7.060  -7.028  15.636
    4    HB3  GLU  50           HB3      GLU  50  -7.370  -6.465  13.992
    5    HG2  GLU  50           HG2      GLU  50  -8.211  -8.672  13.357
    6    HG3  GLU  50           HG3      GLU  50  -7.812  -9.312  14.947

  No H/Q in entry =           6
  In of MODEL   47
    1    H    ALA  51           H        ALA  51  -5.572  -6.294  12.156
    2    HA   ALA  51           HA       ALA  51  -6.548  -8.032  10.138
    3    HB2  ALA  51           HB1      ALA  51  -6.359  -6.215   8.769
    4    HB1  ALA  51           HB2      ALA  51  -4.720  -5.846   9.308
    5    HB3  ALA  51           HB3      ALA  51  -6.104  -5.353  10.286

  No H/Q in entry =           5
  In of MODEL   47
    1    H    HIS  52           H        HIS  52  -3.262  -7.085  11.103
    2    HA   HIS  52           HA       HIS  52  -1.857  -8.556   9.143
    3    HB2  HIS  52           HB2      HIS  52  -0.798  -6.828  10.532
    4    HB3  HIS  52           HB3      HIS  52  -1.015  -7.835  11.962
    5    HD1  HIS  52           HD1      HIS  52   0.252 -10.230  11.877
    6    HD2  HIS  52           HD2      HIS  52   1.509  -7.397   9.089
    7    HE1  HIS  52           HE1      HIS  52   2.502 -11.016  11.021
    8    HE2  HIS  52           HE2      HIS  52   3.282  -9.300   9.320

  No H/Q in entry =           8
  In of MODEL   47
    1    H    LEU  53           H        LEU  53  -3.039  -9.451  12.362
    2    HA   LEU  53           HA       LEU  53  -1.811 -11.981  12.546
    3    HB2  LEU  53           HB2      LEU  53  -4.305 -10.834  13.775
    4    HB3  LEU  53           HB3      LEU  53  -3.817 -12.501  14.066
    5    HG   LEU  53           HG       LEU  53  -1.951 -10.152  14.527
    6   HD12  LEU  53          HD11      LEU  53  -2.526 -10.579  16.978
    7   HD11  LEU  53          HD12      LEU  53  -3.914 -11.497  16.394
    8   HD13  LEU  53          HD13      LEU  53  -3.774  -9.781  16.028
    9   HD21  LEU  53          HD21      LEU  53  -1.931 -13.091  15.238
   10   HD23  LEU  53          HD22      LEU  53  -1.019 -11.931  16.198
   11   HD22  LEU  53          HD23      LEU  53  -0.645 -12.144  14.499

  No H/Q in entry =          11
  In of MODEL   47
    1    H    VAL  54           H        VAL  54  -4.941 -10.986  11.203
    2    HA   VAL  54           HA       VAL  54  -5.830 -13.589  10.519
    3    HB   VAL  54           HB       VAL  54  -6.514 -10.863   9.391
    4   HG12  VAL  54          HG11      VAL  54  -8.605 -12.264   8.590
    5   HG11  VAL  54          HG12      VAL  54  -7.478 -13.617   8.654
    6   HG13  VAL  54          HG13      VAL  54  -7.140 -12.237   7.612
    7   HG22  VAL  54          HG21      VAL  54  -7.408 -10.913  11.548
    8   HG21  VAL  54          HG22      VAL  54  -7.643 -12.659  11.528
    9   HG23  VAL  54          HG23      VAL  54  -8.741 -11.614  10.629

  No H/Q in entry =           9
  In of MODEL   47
    1    H    GLN  55           H        GLN  55  -3.996 -11.116   8.721
    2    HA   GLN  55           HA       GLN  55  -3.864 -12.576   6.301
    3    HB2  GLN  55           HB2      GLN  55  -3.287 -10.305   6.110
    4    HB3  GLN  55           HB3      GLN  55  -2.167 -10.370   7.469
    5    HG2  GLN  55           HG2      GLN  55  -0.448 -11.196   6.181
    6    HG3  GLN  55           HG3      GLN  55  -1.517 -12.182   5.193
    7   HE21  GLN  55          HE21      GLN  55  -1.554 -11.490   3.072
    8   HE22  GLN  55          HE22      GLN  55  -1.377  -9.883   2.563

  No H/Q in entry =           8
  In of MODEL   47
    1    H    THR  56           H        THR  56  -1.742 -12.535   9.170
    2    HA   THR  56           HA       THR  56   0.348 -14.110   8.238
    3    HB   THR  56           HB       THR  56  -0.877 -14.372  10.993
    4    HG1  THR  56           HG1      THR  56  -0.475 -12.173  10.263
    5   HG23  THR  56          HG21      THR  56   1.158 -15.240  11.659
    6   HG22  THR  56          HG22      THR  56   2.050 -14.396  10.393
    7   HG21  THR  56          HG23      THR  56   1.108 -15.835  10.000

  No H/Q in entry =           7
  In of MODEL   47
    1    H    LYS  57           H        LYS  57  -2.753 -15.181   9.619
    2    HA   LYS  57           HA       LYS  57  -2.278 -17.972   9.367
    3    HB2  LYS  57           HB2      LYS  57  -4.100 -16.902  10.725
    4    HB3  LYS  57           HB3      LYS  57  -4.906 -16.459   9.227
    5    HG2  LYS  57           HG2      LYS  57  -5.093 -18.839   8.614
    6    HG3  LYS  57           HG3      LYS  57  -4.289 -19.291  10.114
    7    HD2  LYS  57           HD2      LYS  57  -6.812 -17.630  10.122
    8    HD3  LYS  57           HD3      LYS  57  -6.869 -19.392  10.090
    9    HE2  LYS  57           HE2      LYS  57  -5.391 -19.390  12.148
   10    HE3  LYS  57           HE3      LYS  57  -5.599 -17.642  12.232
   11    HZ3  LYS  57           HZ1      LYS  57  -7.231 -18.556  13.618
   12    HZ2  LYS  57           HZ2      LYS  57  -7.669 -19.740  12.481
   13    HZ1  LYS  57           HZ3      LYS  57  -8.056 -18.109  12.204

  No H/Q in entry =          13
  In of MODEL   47
    1    H    LEU  58           H        LEU  58  -3.648 -15.541   7.202
    2    HA   LEU  58           HA       LEU  58  -4.443 -17.373   5.198
    3    HB2  LEU  58           HB2      LEU  58  -3.868 -14.418   5.063
    4    HB3  LEU  58           HB3      LEU  58  -4.530 -15.360   3.725
    5    HG   LEU  58           HG       LEU  58  -5.795 -15.197   6.481
    6   HD11  LEU  58          HD11      LEU  58  -6.127 -13.551   3.993
    7   HD13  LEU  58          HD12      LEU  58  -6.112 -13.045   5.682
    8   HD12  LEU  58          HD13      LEU  58  -7.531 -13.852   5.017
    9   HD22  LEU  58          HD21      LEU  58  -6.743 -17.115   5.615
   10   HD21  LEU  58          HD22      LEU  58  -6.418 -16.658   3.943
   11   HD23  LEU  58          HD23      LEU  58  -7.784 -15.947   4.802

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  59           H        ILE  59  -1.315 -16.130   6.043
    2    HA   ILE  59           HA       ILE  59  -0.225 -16.844   3.399
    3    HB   ILE  59           HB       ILE  59   0.531 -14.771   4.958
    4   HG12  ILE  59          HG12      ILE  59   2.623 -16.417   3.520
    5   HG13  ILE  59          HG13      ILE  59   1.432 -15.463   2.676
    6   HG21  ILE  59          HG21      ILE  59   1.296 -16.533   6.723
    7   HG23  ILE  59          HG22      ILE  59   2.383 -15.213   6.354
    8   HG22  ILE  59          HG23      ILE  59   2.647 -16.807   5.648
    9   HD12  ILE  59          HD11      ILE  59   3.443 -14.426   4.671
   10   HD11  ILE  59          HD12      ILE  59   2.190 -13.442   3.918
   11   HD13  ILE  59          HD13      ILE  59   3.470 -14.148   2.931

  No H/Q in entry =          11
  In of MODEL   47
    1    H    GLU  60           H        GLU  60  -0.206 -17.953   6.766
    2    HA   GLU  60           HA       GLU  60   1.844 -19.910   6.488
    3    HB2  GLU  60           HB2      GLU  60   1.093 -19.142   8.684
    4    HB3  GLU  60           HB3      GLU  60  -0.514 -19.802   8.387
    5    HG2  GLU  60           HG2      GLU  60   1.903 -21.589   8.213
    6    HG3  GLU  60           HG3      GLU  60   1.192 -21.210   9.781

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLY  61           H        GLY  61  -1.668 -20.043   6.021
    2    HA3  GLY  61           HA2      GLY  61  -1.397 -22.833   5.059
    3    HA2  GLY  61           HA3      GLY  61  -2.886 -22.113   5.662

  No H/Q in entry =           3
  In of MODEL   47
    1    H    ASP  62           H        ASP  62  -0.685 -20.509   3.448
    2    HA   ASP  62           HA       ASP  62  -2.786 -19.961   1.589
    3    HB2  ASP  62           HB2      ASP  62  -0.961 -18.901   0.276
    4    HB3  ASP  62           HB3      ASP  62  -0.995 -18.364   1.952

  No H/Q in entry =           4
  In of MODEL   47
    1    H    ALA  63           H        ALA  63  -2.632 -22.764   1.795
    2    HA   ALA  63           HA       ALA  63  -1.062 -23.992  -0.240
    3    HB1  ALA  63           HB1      ALA  63  -1.941 -25.441   1.383
    4    HB3  ALA  63           HB2      ALA  63  -2.860 -25.797  -0.079
    5    HB2  ALA  63           HB3      ALA  63  -3.577 -24.806   1.193

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLY  64           H        GLY  64  -4.297 -22.578  -0.169
    2    HA3  GLY  64           HA2      GLY  64  -5.801 -22.041  -1.814
    3    HA2  GLY  64           HA3      GLY  64  -4.390 -21.746  -2.817

  No H/Q in entry =           3
  In of MODEL   47
    1    H    GLU  65           H        GLU  65  -4.856 -22.677  -4.750
    2    HA   GLU  65           HA       GLU  65  -6.528 -24.894  -5.107
    3    HB2  GLU  65           HB2      GLU  65  -4.371 -23.759  -6.883
    4    HB3  GLU  65           HB3      GLU  65  -5.484 -25.033  -7.385
    5    HG2  GLU  65           HG2      GLU  65  -7.398 -23.579  -6.964
    6    HG3  GLU  65           HG3      GLU  65  -6.338 -22.318  -6.342

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLY  66           H        GLY  66  -5.382 -26.640  -6.731
    2    HA3  GLY  66           HA2      GLY  66  -4.255 -28.590  -5.051
    3    HA2  GLY  66           HA3      GLY  66  -4.376 -28.678  -6.797

  No H/Q in entry =           3
  In of MODEL   47
    1    H    LYS  67           H        LYS  67  -2.773 -26.336  -7.282
    2    HA   LYS  67           HA       LYS  67  -0.187 -27.585  -7.200
    3    HB2  LYS  67           HB2      LYS  67  -1.195 -25.013  -8.400
    4    HB3  LYS  67           HB3      LYS  67   0.477 -25.568  -8.548
    5    HG2  LYS  67           HG2      LYS  67  -0.308 -27.691  -9.532
    6    HG3  LYS  67           HG3      LYS  67  -1.978 -27.145  -9.385
    7    HD2  LYS  67           HD2      LYS  67  -1.527 -25.285 -10.920
    8    HD3  LYS  67           HD3      LYS  67   0.163 -25.779 -11.040
    9    HE2  LYS  67           HE2      LYS  67  -1.097 -26.645 -12.961
   10    HE3  LYS  67           HE3      LYS  67  -0.555 -27.976 -11.939
   11    HZ1  LYS  67           HZ1      LYS  67  -3.061 -27.043 -11.045
   12    HZ3  LYS  67           HZ2      LYS  67  -2.641 -28.584 -11.621
   13    HZ2  LYS  67           HZ3      LYS  67  -3.152 -27.381 -12.704

  No H/Q in entry =          13
  In of MODEL   47
    1    H    MET  68           H        MET  68   1.739 -26.711  -6.497
    2    HA   MET  68           HA       MET  68   1.927 -25.953  -3.871
    3    HB2  MET  68           HB2      MET  68   3.845 -25.513  -6.154
    4    HB3  MET  68           HB3      MET  68   4.268 -25.235  -4.465
    5    HG2  MET  68           HG2      MET  68   3.740 -27.560  -3.918
    6    HG3  MET  68           HG3      MET  68   3.225 -27.857  -5.580
    7    HE3  MET  68           HE1      MET  68   6.646 -25.757  -4.383
    8    HE2  MET  68           HE2      MET  68   7.312 -27.271  -3.776
    9    HE1  MET  68           HE3      MET  68   5.735 -26.723  -3.214

  No H/Q in entry =           9
  In of MODEL   47
    1    H    LYS  69           H        LYS  69   0.762 -23.936  -6.277
    2    HA   LYS  69           HA       LYS  69   1.921 -21.467  -5.567
    3    HB2  LYS  69           HB2      LYS  69  -0.640 -22.092  -7.004
    4    HB3  LYS  69           HB3      LYS  69  -0.016 -20.453  -6.783
    5    HG2  LYS  69           HG2      LYS  69   2.098 -21.098  -7.865
    6    HG3  LYS  69           HG3      LYS  69   1.490 -22.740  -8.086
    7    HD2  LYS  69           HD2      LYS  69  -0.346 -21.873  -9.488
    8    HD3  LYS  69           HD3      LYS  69   0.267 -20.233  -9.273
    9    HE2  LYS  69           HE2      LYS  69   2.395 -20.876 -10.330
   10    HE3  LYS  69           HE3      LYS  69   1.803 -22.524 -10.531
   11    HZ1  LYS  69           HZ1      LYS  69  -0.157 -21.279 -11.705
   12    HZ3  LYS  69           HZ2      LYS  69   1.272 -21.650 -12.546
   13    HZ2  LYS  69           HZ3      LYS  69   1.020 -20.081 -11.943

  No H/Q in entry =          13
  In of MODEL   47
    1    H    VAL  70           H        VAL  70   0.061 -19.583  -5.181
    2    HA   VAL  70           HA       VAL  70  -1.269 -20.229  -2.613
    3    HB   VAL  70           HB       VAL  70  -0.547 -17.998  -1.781
    4   HG11  VAL  70          HG11      VAL  70   0.762 -20.086  -1.309
    5   HG13  VAL  70          HG12      VAL  70   1.747 -18.622  -1.290
    6   HG12  VAL  70          HG13      VAL  70   1.792 -19.697  -2.687
    7   HG23  VAL  70          HG21      VAL  70   1.477 -17.009  -3.128
    8   HG22  VAL  70          HG22      VAL  70  -0.159 -16.672  -3.689
    9   HG21  VAL  70          HG23      VAL  70   0.801 -17.916  -4.484

  No H/Q in entry =           9
  In of MODEL   47
    1    H    SER  71           H        SER  71  -2.908 -18.605  -2.029
    2    HA   SER  71           HA       SER  71  -4.766 -18.111  -4.100
    3    HB2  SER  71           HB2      SER  71  -5.358 -18.298  -1.665
    4    HB3  SER  71           HB3      SER  71  -4.587 -16.738  -1.394
    5    HG   SER  71           HG       SER  71  -6.789 -16.442  -1.737

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU  72           H        LEU  72  -5.051 -16.430  -5.419
    2    HA   LEU  72           HA       LEU  72  -2.967 -14.594  -5.913
    3    HB2  LEU  72           HB2      LEU  72  -5.835 -14.688  -6.840
    4    HB3  LEU  72           HB3      LEU  72  -4.664 -13.505  -7.417
    5    HG   LEU  72           HG       LEU  72  -4.216 -16.504  -7.572
    6   HD11  LEU  72          HD11      LEU  72  -5.490 -14.560  -9.490
    7   HD13  LEU  72          HD12      LEU  72  -6.037 -16.170  -9.022
    8   HD12  LEU  72          HD13      LEU  72  -4.645 -15.988 -10.088
    9   HD22  LEU  72          HD21      LEU  72  -2.107 -15.507  -7.813
   10   HD21  LEU  72          HD22      LEU  72  -2.750 -14.065  -8.581
   11   HD23  LEU  72          HD23      LEU  72  -2.656 -15.574  -9.483

  No H/Q in entry =          11
  In of MODEL   47
    1    H    VAL  73           H        VAL  73  -6.053 -14.274  -4.262
    2    HA   VAL  73           HA       VAL  73  -6.127 -11.504  -3.906
    3    HB   VAL  73           HB       VAL  73  -7.851 -11.876  -2.358
    4   HG11  VAL  73          HG11      VAL  73  -8.116 -12.855  -4.730
    5   HG13  VAL  73          HG12      VAL  73  -9.259 -13.395  -3.502
    6   HG12  VAL  73          HG13      VAL  73  -7.908 -14.431  -3.965
    7   HG22  VAL  73          HG21      VAL  73  -6.778 -13.230  -0.709
    8   HG21  VAL  73          HG22      VAL  73  -6.476 -14.525  -1.866
    9   HG23  VAL  73          HG23      VAL  73  -8.119 -14.201  -1.314

  No H/Q in entry =           9
  In of MODEL   47
    1    H    LEU  74           H        LEU  74  -4.152 -13.853  -2.339
    2    HA   LEU  74           HA       LEU  74  -3.736 -12.711   0.183
    3    HB2  LEU  74           HB2      LEU  74  -2.928 -14.916  -0.310
    4    HB3  LEU  74           HB3      LEU  74  -1.906 -14.303  -1.609
    5    HG   LEU  74           HG       LEU  74  -0.573 -13.031   0.034
    6   HD12  LEU  74          HD11      LEU  74  -1.005 -13.689   2.490
    7   HD11  LEU  74          HD12      LEU  74  -2.599 -14.213   1.942
    8   HD13  LEU  74          HD13      LEU  74  -2.117 -12.523   1.772
    9   HD22  LEU  74          HD21      LEU  74   0.656 -14.863   0.674
   10   HD21  LEU  74          HD22      LEU  74  -0.386 -15.585  -0.531
   11   HD23  LEU  74          HD23      LEU  74  -0.765 -15.780   1.165

  No H/Q in entry =          11
  In of MODEL   47
    1    H    VAL  75           H        VAL  75  -1.870 -12.291  -2.787
    2    HA   VAL  75           HA       VAL  75  -0.088 -10.348  -1.785
    3    HB   VAL  75           HB       VAL  75  -1.057 -10.844  -4.601
    4   HG12  VAL  75          HG11      VAL  75   0.993  -9.507  -5.230
    5   HG11  VAL  75          HG12      VAL  75   1.180  -9.086  -3.536
    6   HG13  VAL  75          HG13      VAL  75  -0.236  -8.542  -4.421
    7   HG23  VAL  75          HG21      VAL  75   1.281 -11.835  -4.745
    8   HG22  VAL  75          HG22      VAL  75   0.166 -12.724  -3.708
    9   HG21  VAL  75          HG23      VAL  75   1.382 -11.667  -2.991

  No H/Q in entry =           9
  In of MODEL   47
    1    H    GLU  76           H        GLU  76  -3.254 -10.034  -3.421
    2    HA   GLU  76           HA       GLU  76  -3.338  -7.220  -3.517
    3    HB2  GLU  76           HB2      GLU  76  -4.989  -8.665  -4.674
    4    HB3  GLU  76           HB3      GLU  76  -5.619  -9.193  -3.121
    5    HG2  GLU  76           HG2      GLU  76  -7.108  -7.492  -3.971
    6    HG3  GLU  76           HG3      GLU  76  -6.233  -6.786  -2.627

  No H/Q in entry =           6
  In of MODEL   47
    1    H    ALA  77           H        ALA  77  -4.406  -9.465  -0.973
    2    HA   ALA  77           HA       ALA  77  -5.373  -7.477   0.795
    3    HB1  ALA  77           HB1      ALA  77  -4.411 -10.304   1.186
    4    HB3  ALA  77           HB2      ALA  77  -6.055  -9.676   1.281
    5    HB2  ALA  77           HB3      ALA  77  -4.896  -9.306   2.556

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLN  78           H        GLN  78  -2.211  -8.991   0.406
    2    HA   GLN  78           HA       GLN  78  -0.950  -7.820   2.650
    3    HB2  GLN  78           HB2      GLN  78  -0.097  -9.751   1.242
    4    HB3  GLN  78           HB3      GLN  78   0.370  -8.562   0.028
    5    HG2  GLN  78           HG2      GLN  78   1.832  -7.451   1.634
    6    HG3  GLN  78           HG3      GLN  78   1.318  -8.554   2.906
    7   HE21  GLN  78          HE21      GLN  78   1.310 -10.984   1.300
    8   HE22  GLN  78          HE22      GLN  78   2.926 -11.339   0.918

  No H/Q in entry =           8
  In of MODEL   47
    1    H    LEU  79           H        LEU  79  -1.352  -6.758  -0.693
    2    HA   LEU  79           HA       LEU  79   0.311  -4.513  -0.687
    3    HB2  LEU  79           HB2      LEU  79  -0.722  -5.327  -2.735
    4    HB3  LEU  79           HB3      LEU  79  -2.325  -4.953  -2.115
    5    HG   LEU  79           HG       LEU  79  -1.806  -2.561  -2.089
    6   HD13  LEU  79          HD11      LEU  79   0.435  -2.294  -1.591
    7   HD12  LEU  79          HD12      LEU  79   0.469  -2.004  -3.330
    8   HD11  LEU  79          HD13      LEU  79   0.944  -3.578  -2.690
    9   HD23  LEU  79          HD21      LEU  79  -1.191  -2.351  -4.645
   10   HD22  LEU  79          HD22      LEU  79  -2.707  -3.116  -4.176
   11   HD21  LEU  79          HD23      LEU  79  -1.327  -4.109  -4.632

  No H/Q in entry =          11
  In of MODEL   47
    1    H    HIS  80           H        HIS  80  -3.148  -4.712   0.163
    2    HA   HIS  80           HA       HIS  80  -3.363  -1.959   0.833
    3    HB2  HIS  80           HB2      HIS  80  -5.038  -4.386   1.159
    4    HB3  HIS  80           HB3      HIS  80  -5.364  -3.051   2.268
    5    HD1  HIS  80           HD1      HIS  80  -7.005  -1.429   1.374
    6    HD2  HIS  80           HD2      HIS  80  -4.815  -3.214  -1.692
    7    HE1  HIS  80           HE1      HIS  80  -7.870  -0.437  -0.798
    8    HE2  HIS  80           HE2      HIS  80  -6.541  -1.520  -2.676

  No H/Q in entry =           8
  In of MODEL   47
    1    H    LEU  81           H        LEU  81  -2.832  -4.852   2.817
    2    HA   LEU  81           HA       LEU  81  -2.815  -3.509   5.304
    3    HB2  LEU  81           HB2      LEU  81  -1.577  -6.112   4.411
    4    HB3  LEU  81           HB3      LEU  81  -1.545  -5.556   6.086
    5    HG   LEU  81           HG       LEU  81  -4.099  -5.831   4.475
    6   HD12  LEU  81          HD11      LEU  81  -4.371  -7.902   6.021
    7   HD11  LEU  81          HD12      LEU  81  -2.618  -7.814   6.195
    8   HD13  LEU  81          HD13      LEU  81  -3.336  -8.049   4.600
    9   HD23  LEU  81          HD21      LEU  81  -4.923  -6.046   6.982
   10   HD22  LEU  81          HD22      LEU  81  -4.618  -4.453   6.292
   11   HD21  LEU  81          HD23      LEU  81  -3.417  -5.203   7.343

  No H/Q in entry =          11
  In of MODEL   47
    1    H    MET  82           H        MET  82  -0.141  -4.383   3.113
    2    HA   MET  82           HA       MET  82   1.945  -3.472   4.783
    3    HB2  MET  82           HB2      MET  82   1.713  -3.810   1.792
    4    HB3  MET  82           HB3      MET  82   3.195  -3.227   2.546
    5    HG2  MET  82           HG2      MET  82   1.817  -5.831   3.276
    6    HG3  MET  82           HG3      MET  82   3.180  -5.706   2.167
    7    HE3  MET  82           HE1      MET  82   6.202  -4.945   4.130
    8    HE2  MET  82           HE2      MET  82   5.262  -3.585   3.521
    9    HE1  MET  82           HE3      MET  82   5.358  -5.073   2.582

  No H/Q in entry =           9
  In of MODEL   47
    1    H    THR  83           H        THR  83   0.090  -1.843   2.242
    2    HA   THR  83           HA       THR  83   1.480   0.618   2.323
    3    HB   THR  83           HB       THR  83  -0.711   1.525   1.354
    4    HG1  THR  83           HG1      THR  83  -2.351   0.213   1.256
    5   HG22  THR  83          HG21      THR  83  -0.439  -0.287  -0.652
    6   HG21  THR  83          HG22      THR  83   1.071  -0.567   0.214
    7   HG23  THR  83          HG23      THR  83   0.690   1.043  -0.396

  No H/Q in entry =           7
  In of MODEL   47
    1    H    SER  84           H        SER  84  -1.505  -0.444   3.944
    2    HA   SER  84           HA       SER  84  -2.014   1.979   5.296
    3    HB2  SER  84           HB2      SER  84  -2.817  -0.867   5.861
    4    HB3  SER  84           HB3      SER  84  -3.315   0.468   6.900
    5    HG   SER  84           HG       SER  84  -3.790   0.154   4.111

  No H/Q in entry =           5
  In of MODEL   47
    1    H    MET  85           H        MET  85  -0.269  -0.939   6.408
    2    HA   MET  85           HA       MET  85   0.260  -0.012   9.010
    3    HB2  MET  85           HB2      MET  85   0.569  -2.352   8.327
    4    HB3  MET  85           HB3      MET  85   1.939  -1.874   7.323
    5    HG2  MET  85           HG2      MET  85   3.261  -1.295   9.190
    6    HG3  MET  85           HG3      MET  85   1.861  -1.180  10.255
    7    HE1  MET  85           HE1      MET  85   3.334  -3.559   7.665
    8    HE3  MET  85           HE2      MET  85   1.692  -4.189   7.781
    9    HE2  MET  85           HE3      MET  85   3.048  -5.173   8.326

  No H/Q in entry =           9
  In of MODEL   47
    1    H    LEU  86           H        LEU  86   2.172   0.265   6.046
    2    HA   LEU  86           HA       LEU  86   4.382   1.593   7.188
    3    HB2  LEU  86           HB2      LEU  86   4.184   0.513   4.879
    4    HB3  LEU  86           HB3      LEU  86   3.359   1.988   4.374
    5    HG   LEU  86           HG       LEU  86   5.384   3.250   5.342
    6   HD11  LEU  86          HD11      LEU  86   6.117   0.644   6.133
    7   HD13  LEU  86          HD12      LEU  86   7.109   2.097   6.225
    8   HD12  LEU  86          HD13      LEU  86   7.217   1.052   4.811
    9   HD23  LEU  86          HD21      LEU  86   6.099   1.497   2.984
   10   HD22  LEU  86          HD22      LEU  86   6.480   3.197   3.245
   11   HD21  LEU  86          HD23      LEU  86   4.828   2.715   2.858

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ALA  87           H        ALA  87   1.448   2.814   5.626
    2    HA   ALA  87           HA       ALA  87   2.020   5.549   5.709
    3    HB1  ALA  87           HB1      ALA  87  -0.279   3.902   5.182
    4    HB3  ALA  87           HB2      ALA  87   0.014   5.566   4.682
    5    HB2  ALA  87           HB3      ALA  87  -0.766   5.236   6.231

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ARG  88           H        ARG  88   0.364   3.530   8.108
    2    HA   ARG  88           HA       ARG  88  -0.152   5.572   9.962
    3    HB2  ARG  88           HB2      ARG  88  -1.070   3.212  10.031
    4    HB3  ARG  88           HB3      ARG  88   0.480   2.724  10.726
    5    HG2  ARG  88           HG2      ARG  88  -0.002   4.792  12.352
    6    HG3  ARG  88           HG3      ARG  88  -1.669   4.453  11.907
    7    HD2  ARG  88           HD2      ARG  88  -1.752   2.602  13.152
    8    HD3  ARG  88           HD3      ARG  88  -0.161   2.034  12.609
    9    HE   ARG  88           HE       ARG  88  -0.688   3.290  15.068
   10   HH21  ARG  88          HH11      ARG  88   0.870   4.314  16.297
   11   HH22  ARG  88          HH12      ARG  88   2.380   4.754  15.582
   12   HH11  ARG  88          HH21      ARG  88   1.572   3.494  12.475
   13   HH12  ARG  88          HH22      ARG  88   2.787   4.274  13.430

  No H/Q in entry =          13
  In of MODEL   47
    1    H    GLU  89           H        GLU  89   2.662   3.378   9.716
    2    HA   GLU  89           HA       GLU  89   3.933   4.275  12.051
    3    HB2  GLU  89           HB2      GLU  89   4.600   2.264  10.700
    4    HB3  GLU  89           HB3      GLU  89   5.357   3.367   9.550
    5    HG2  GLU  89           HG2      GLU  89   6.847   4.225  11.284
    6    HG3  GLU  89           HG3      GLU  89   6.030   3.259  12.509

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LEU  90           H        LEU  90   4.215   5.440   8.723
    2    HA   LEU  90           HA       LEU  90   6.131   7.457   9.297
    3    HB2  LEU  90           HB2      LEU  90   4.113   7.110   7.084
    4    HB3  LEU  90           HB3      LEU  90   5.332   8.392   7.098
    5    HG   LEU  90           HG       LEU  90   6.035   5.461   7.423
    6   HD12  LEU  90          HD11      LEU  90   6.764   5.704   4.978
    7   HD11  LEU  90          HD12      LEU  90   5.735   7.135   4.939
    8   HD13  LEU  90          HD13      LEU  90   5.032   5.556   5.285
    9   HD22  LEU  90          HD21      LEU  90   7.926   6.628   8.093
   10   HD21  LEU  90          HD22      LEU  90   7.556   8.030   7.090
   11   HD23  LEU  90          HD23      LEU  90   8.224   6.573   6.357

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  91           H        ILE  91   2.592   7.439   9.173
    2    HA   ILE  91           HA       ILE  91   2.226  10.208   9.630
    3    HB   ILE  91           HB       ILE  91   0.462   7.815  10.182
    4   HG12  ILE  91          HG12      ILE  91   0.178  10.096   8.202
    5   HG13  ILE  91          HG13      ILE  91   1.049   8.610   7.822
    6   HG22  ILE  91          HG21      ILE  91  -1.290   9.856  10.260
    7   HG21  ILE  91          HG22      ILE  91   0.108  10.699  10.924
    8   HG23  ILE  91          HG23      ILE  91  -0.509   9.255  11.724
    9   HD13  ILE  91          HD11      ILE  91  -0.882   7.304   7.879
   10   HD12  ILE  91          HD12      ILE  91  -1.491   8.814   7.203
   11   HD11  ILE  91          HD13      ILE  91  -1.746   8.445   8.909

  No H/Q in entry =          11
  In of MODEL   47
    1    H    THR  92           H        THR  92   2.672   7.468  11.825
    2    HA   THR  92           HA       THR  92   2.232   8.835  14.254
    3    HB   THR  92           HB       THR  92   4.059   6.519  13.573
    4    HG1  THR  92           HG1      THR  92   2.097   5.742  13.486
    5   HG22  THR  92          HG21      THR  92   3.697   6.228  16.210
    6   HG21  THR  92          HG22      THR  92   3.613   7.987  16.138
    7   HG23  THR  92          HG23      THR  92   5.051   7.146  15.555

  No H/Q in entry =           7
  In of MODEL   47
    1    H    GLU  93           H        GLU  93   5.174   8.418  12.299
    2    HA   GLU  93           HA       GLU  93   6.924   9.861  13.985
    3    HB2  GLU  93           HB2      GLU  93   6.995   9.551  10.969
    4    HB3  GLU  93           HB3      GLU  93   8.337  10.094  11.975
    5    HG2  GLU  93           HG2      GLU  93   6.958   7.442  12.430
    6    HG3  GLU  93           HG3      GLU  93   8.333   7.610  11.344

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LEU  94           H        LEU  94   4.846  10.857  11.288
    2    HA   LEU  94           HA       LEU  94   5.622  13.570  11.185
    3    HB2  LEU  94           HB2      LEU  94   3.041  12.177  10.447
    4    HB3  LEU  94           HB3      LEU  94   3.279  13.908  10.206
    5    HG   LEU  94           HG       LEU  94   5.311  11.943   9.140
    6   HD11  LEU  94          HD11      LEU  94   2.556  12.464   8.096
    7   HD13  LEU  94          HD12      LEU  94   3.554  11.019   7.963
    8   HD12  LEU  94          HD13      LEU  94   3.867  12.404   6.918
    9   HD23  LEU  94          HD21      LEU  94   5.529  13.783   7.417
   10   HD22  LEU  94          HD22      LEU  94   5.950  14.279   9.057
   11   HD21  LEU  94          HD23      LEU  94   4.389  14.730   8.369

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  95           H        ILE  95   3.115  11.923  13.091
    2    HA   ILE  95           HA       ILE  95   2.054  14.260  14.296
    3    HB   ILE  95           HB       ILE  95   2.109  11.378  15.217
    4   HG12  ILE  95          HG12      ILE  95  -0.138  13.127  14.185
    5   HG13  ILE  95          HG13      ILE  95   0.823  12.080  13.145
    6   HG21  ILE  95          HG21      ILE  95   0.807  13.835  16.430
    7   HG23  ILE  95          HG22      ILE  95   1.874  12.677  17.226
    8   HG22  ILE  95          HG23      ILE  95   0.241  12.198  16.762
    9   HD13  ILE  95          HD11      ILE  95  -0.051  10.131  14.069
   10   HD12  ILE  95          HD12      ILE  95  -1.445  11.204  14.155
   11   HD11  ILE  95          HD13      ILE  95  -0.467  10.916  15.593

  No H/Q in entry =          11
  In of MODEL   47
    1    H    GLU  96           H        GLU  96   4.681  12.071  15.272
    2    HA   GLU  96           HA       GLU  96   5.238  13.274  17.761
    3    HB2  GLU  96           HB2      GLU  96   6.207  11.126  17.105
    4    HB3  GLU  96           HB3      GLU  96   7.123  11.911  15.820
    5    HG2  GLU  96           HG2      GLU  96   8.774  12.478  17.272
    6    HG3  GLU  96           HG3      GLU  96   7.625  13.277  18.335

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LEU  97           H        LEU  97   6.282  14.061  14.469
    2    HA   LEU  97           HA       LEU  97   8.149  16.079  15.170
    3    HB2  LEU  97           HB2      LEU  97   6.547  15.513  12.685
    4    HB3  LEU  97           HB3      LEU  97   7.550  16.956  12.801
    5    HG   LEU  97           HG       LEU  97   8.617  14.171  13.352
    6   HD12  LEU  97          HD11      LEU  97   9.596  14.379  11.028
    7   HD11  LEU  97          HD12      LEU  97   8.526  15.756  10.773
    8   HD13  LEU  97          HD13      LEU  97   7.848  14.156  11.071
    9   HD23  LEU  97          HD21      LEU  97  10.765  15.476  12.596
   10   HD22  LEU  97          HD22      LEU  97  10.154  15.737  14.229
   11   HD21  LEU  97          HD23      LEU  97   9.817  16.917  12.964

  No H/Q in entry =          11
  In of MODEL   47
    1    H    HIS  98           H        HIS  98   4.652  16.172  14.539
    2    HA   HIS  98           HA       HIS  98   4.319  18.968  14.678
    3    HB2  HIS  98           HB2      HIS  98   2.462  16.694  15.415
    4    HB3  HIS  98           HB3      HIS  98   1.974  18.388  15.475
    5    HD1  HIS  98           HD1      HIS  98   3.013  15.688  13.061
    6    HD2  HIS  98           HD2      HIS  98   1.588  19.604  12.951
    7    HE1  HIS  98           HE1      HIS  98   2.432  16.171  10.641
    8    HE2  HIS  98           HE2      HIS  98   1.567  18.550  10.553

  No H/Q in entry =           8
  In of MODEL   47
    1    H    GLU  99           H        GLU  99   4.499  16.479  17.174
    2    HA   GLU  99           HA       GLU  99   3.885  18.164  19.377
    3    HB2  GLU  99           HB2      GLU  99   3.827  15.681  19.473
    4    HB3  GLU  99           HB3      GLU  99   5.587  15.658  19.353
    5    HG2  GLU  99           HG2      GLU  99   5.773  16.951  21.427
    6    HG3  GLU  99           HG3      GLU  99   4.019  17.070  21.534

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LYS 100           H        LYS 100   6.939  17.273  17.792
    2    HA   LYS 100           HA       LYS 100   8.589  18.692  19.639
    3    HB2  LYS 100           HB2      LYS 100   9.080  17.776  16.796
    4    HB3  LYS 100           HB3      LYS 100  10.307  18.560  17.797
    5    HG2  LYS 100           HG2      LYS 100   9.964  16.804  19.539
    6    HG3  LYS 100           HG3      LYS 100   8.835  15.987  18.454
    7    HD2  LYS 100           HD2      LYS 100  10.622  15.728  16.775
    8    HD3  LYS 100           HD3      LYS 100  11.755  16.557  17.845
    9    HE2  LYS 100           HE2      LYS 100  11.392  14.795  19.564
   10    HE3  LYS 100           HE3      LYS 100  10.320  13.947  18.445
   11    HZ1  LYS 100           HZ1      LYS 100  13.128  14.652  17.771
   12    HZ3  LYS 100           HZ2      LYS 100  12.092  13.585  16.949
   13    HZ2  LYS 100           HZ3      LYS 100  12.696  13.172  18.483

  No H/Q in entry =          13
  In of MODEL   47
    1    H    LEU 101           H        LEU 101   6.865  19.600  16.695
    2    HA   LEU 101           HA       LEU 101   8.045  22.173  16.355
    3    HB2  LEU 101           HB2      LEU 101   5.459  20.908  15.484
    4    HB3  LEU 101           HB3      LEU 101   5.687  22.642  15.277
    5    HG   LEU 101           HG       LEU 101   7.742  20.652  14.295
    6   HD12  LEU 101          HD11      LEU 101   6.567  21.145  12.019
    7   HD11  LEU 101          HD12      LEU 101   5.169  21.557  13.009
    8   HD13  LEU 101          HD13      LEU 101   5.854  19.935  13.084
    9   HD21  LEU 101          HD21      LEU 101   7.074  23.557  13.747
   10   HD23  LEU 101          HD22      LEU 101   8.059  22.610  12.633
   11   HD22  LEU 101          HD23      LEU 101   8.609  22.873  14.287

  No H/Q in entry =          11
  In of MODEL   47
    1    H    LYS 102           H        LYS 102   6.539  21.014  18.979
    2    HA   LYS 102           HA       LYS 102   5.906  22.096  20.917
    3    HB2  LYS 102           HB2      LYS 102   7.157  24.102  19.786
    4    HB3  LYS 102           HB3      LYS 102   5.548  24.688  19.421
    5    HG2  LYS 102           HG2      LYS 102   6.946  24.446  22.064
    6    HG3  LYS 102           HG3      LYS 102   5.973  25.764  21.443
    7    HD2  LYS 102           HD2      LYS 102   4.767  23.112  22.327
    8    HD3  LYS 102           HD3      LYS 102   5.006  24.475  23.410
    9    HE2  LYS 102           HE2      LYS 102   2.722  24.046  21.936
   10    HE3  LYS 102           HE3      LYS 102   3.211  25.597  22.616
   11    HZ2  LYS 102           HZ1      LYS 102   2.663  25.701  20.240
   12    HZ1  LYS 102           HZ2      LYS 102   3.936  24.634  19.908
   13    HZ3  LYS 102           HZ3      LYS 102   4.264  26.168  20.550

  No H/Q in entry =          13
  In of MODEL   47
    1    H    ALA 103           H        ALA 103   4.231  23.621  18.162
    2    HA   ALA 103           HA       ALA 103   1.776  24.167  19.064
    3    HB1  ALA 103           HB1      ALA 103   0.873  23.317  16.827
    4    HB2  ALA 103           HB2      ALA 103   2.525  22.800  16.485
    5    HB3  ALA 103           HB3      ALA 103   2.171  24.508  16.756

  No H/Q in entry =           5
  In of MODEL   47
    1    H1   ALA   1           H3       ALA   1  10.738 -20.201  -6.315
    2    H2   ALA   1           H2       ALA   1   9.767 -20.417  -7.694
    3    H3   ALA   1           H1       ALA   1   9.348 -21.170  -6.229
    4    HA   ALA   1           HA       ALA   1  10.403 -22.966  -6.978
    5    HB1  ALA   1           HB1      ALA   1  10.479 -22.604  -9.253
    6    HB2  ALA   1           HB2      ALA   1  12.207 -22.434  -8.936
    7    HB3  ALA   1           HB3      ALA   1  11.191 -20.998  -9.079

  No H/Q in entry =           7
  In of MODEL   47
    1    H    GLU   2           H        GLU   2  12.697 -23.891  -7.052
    2    HA   GLU   2           HA       GLU   2  14.093 -23.796  -4.850
    3    HB2  GLU   2           HB2      GLU   2  15.429 -23.646  -7.558
    4    HB3  GLU   2           HB3      GLU   2  16.174 -24.251  -6.079
    5    HG2  GLU   2           HG2      GLU   2  15.178 -26.279  -6.315
    6    HG3  GLU   2           HG3      GLU   2  13.597 -25.550  -6.562

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLU   3           H        GLU   3  15.827 -21.909  -7.261
    2    HA   GLU   3           HA       GLU   3  16.974 -20.211  -5.308
    3    HB2  GLU   3           HB2      GLU   3  16.898 -20.206  -8.317
    4    HB3  GLU   3           HB3      GLU   3  17.635 -18.870  -7.434
    5    HG2  GLU   3           HG2      GLU   3  19.319 -20.227  -6.524
    6    HG3  GLU   3           HG3      GLU   3  18.387 -21.704  -6.740

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LEU   4           H        LEU   4  14.665 -19.386  -7.922
    2    HA   LEU   4           HA       LEU   4  14.174 -16.783  -7.304
    3    HB2  LEU   4           HB2      LEU   4  12.016 -18.781  -8.021
    4    HB3  LEU   4           HB3      LEU   4  11.920 -17.033  -8.217
    5    HG   LEU   4           HG       LEU   4  13.895 -18.873  -9.606
    6   HD13  LEU   4          HD11      LEU   4  12.578 -18.736 -11.507
    7   HD12  LEU   4          HD12      LEU   4  11.857 -17.200 -11.033
    8   HD11  LEU   4          HD13      LEU   4  11.325 -18.697 -10.269
    9   HD23  LEU   4          HD21      LEU   4  14.197 -16.622 -10.958
   10   HD22  LEU   4          HD22      LEU   4  15.070 -16.857  -9.444
   11   HD21  LEU   4          HD23      LEU   4  13.607 -15.877  -9.472

  No H/Q in entry =          11
  In of MODEL   47
    1    H    GLU   5           H        GLU   5  12.731 -19.585  -5.655
    2    HA   GLU   5           HA       GLU   5  11.049 -18.034  -3.938
    3    HB2  GLU   5           HB2      GLU   5  10.663 -20.426  -4.469
    4    HB3  GLU   5           HB3      GLU   5  12.091 -20.834  -3.517
    5    HG2  GLU   5           HG2      GLU   5  10.172 -21.089  -2.080
    6    HG3  GLU   5           HG3      GLU   5  11.035 -19.639  -1.569

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLU   6           H        GLU   6  14.215 -19.579  -3.520
    2    HA   GLU   6           HA       GLU   6  14.577 -18.722  -0.823
    3    HB2  GLU   6           HB2      GLU   6  15.817 -20.622  -1.829
    4    HB3  GLU   6           HB3      GLU   6  16.664 -19.487  -2.882
    5    HG2  GLU   6           HG2      GLU   6  17.586 -18.330  -0.922
    6    HG3  GLU   6           HG3      GLU   6  16.715 -19.428   0.149

  No H/Q in entry =           6
  In of MODEL   47
    1    H    VAL   7           H        VAL   7  15.306 -17.383  -3.976
    2    HA   VAL   7           HA       VAL   7  16.974 -15.239  -3.121
    3    HB   VAL   7           HB       VAL   7  15.255 -15.619  -5.587
    4   HG11  VAL   7          HG11      VAL   7  17.128 -13.385  -4.785
    5   HG13  VAL   7          HG12      VAL   7  15.480 -13.261  -5.397
    6   HG12  VAL   7          HG13      VAL   7  16.787 -13.747  -6.477
    7   HG21  VAL   7          HG21      VAL   7  17.382 -17.052  -5.034
    8   HG23  VAL   7          HG22      VAL   7  18.268 -15.580  -5.437
    9   HG22  VAL   7          HG23      VAL   7  17.231 -16.340  -6.642

  No H/Q in entry =           9
  In of MODEL   47
    1    H    VAL   8           H        VAL   8  13.481 -15.548  -3.653
    2    HA   VAL   8           HA       VAL   8  12.787 -12.848  -3.174
    3    HB   VAL   8           HB       VAL   8  11.234 -15.418  -2.796
    4   HG12  VAL   8          HG11      VAL   8   9.247 -13.754  -2.802
    5   HG11  VAL   8          HG12      VAL   8  10.442 -12.536  -2.359
    6   HG13  VAL   8          HG13      VAL   8  10.169 -13.923  -1.308
    7   HG22  VAL   8          HG21      VAL   8  10.349 -15.005  -4.941
    8   HG21  VAL   8          HG22      VAL   8  11.993 -14.403  -5.129
    9   HG23  VAL   8          HG23      VAL   8  10.671 -13.275  -4.850

  No H/Q in entry =           9
  In of MODEL   47
    1    H    MET   9           H        MET   9  13.102 -15.653  -0.999
    2    HA   MET   9           HA       MET   9  12.288 -14.394   1.378
    3    HB2  MET   9           HB2      MET   9  14.172 -16.667   0.791
    4    HB3  MET   9           HB3      MET   9  13.977 -16.067   2.438
    5    HG2  MET   9           HG2      MET   9  11.441 -16.320   2.035
    6    HG3  MET   9           HG3      MET   9  11.892 -17.296   0.636
    7    HE3  MET   9           HE1      MET   9  13.376 -20.434   1.836
    8    HE2  MET   9           HE2      MET   9  14.391 -19.061   1.403
    9    HE1  MET   9           HE3      MET   9  12.887 -19.344   0.532

  No H/Q in entry =           9
  In of MODEL   47
    1    H    GLY  10           H        GLY  10  15.461 -14.578  -0.201
    2    HA3  GLY  10           HA2      GLY  10  16.916 -13.142   1.761
    3    HA2  GLY  10           HA3      GLY  10  17.369 -13.299   0.064

  No H/Q in entry =           3
  In of MODEL   47
    1    H    LEU  11           H        LEU  11  15.178 -12.104  -1.159
    2    HA   LEU  11           HA       LEU  11  15.829  -9.351  -0.997
    3    HB2  LEU  11           HB2      LEU  11  13.471 -10.789  -2.218
    4    HB3  LEU  11           HB3      LEU  11  13.729  -9.051  -2.377
    5    HG   LEU  11           HG       LEU  11  15.777 -11.133  -3.182
    6   HD13  LEU  11          HD11      LEU  11  14.025 -11.520  -4.690
    7   HD12  LEU  11          HD12      LEU  11  15.007 -10.325  -5.536
    8   HD11  LEU  11          HD13      LEU  11  13.533  -9.826  -4.707
    9   HD22  LEU  11          HD21      LEU  11  16.985  -9.154  -2.962
   10   HD21  LEU  11          HD22      LEU  11  15.594  -8.134  -3.330
   11   HD23  LEU  11          HD23      LEU  11  16.427  -8.991  -4.626

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  12           H        ILE  12  13.093 -11.213   0.287
    2    HA   ILE  12           HA       ILE  12  11.679  -9.009   1.359
    3    HB   ILE  12           HB       ILE  12  11.759 -11.893   2.301
    4   HG12  ILE  12          HG12      ILE  12  11.042 -11.258  -0.139
    5   HG13  ILE  12          HG13      ILE  12  10.040 -12.366   0.779
    6   HG22  ILE  12          HG21      ILE  12   9.483 -11.342   3.243
    7   HG21  ILE  12          HG22      ILE  12   9.803  -9.645   2.889
    8   HG23  ILE  12          HG23      ILE  12  10.812 -10.508   4.047
    9   HD12  ILE  12          HD11      ILE  12   8.756 -10.594  -0.431
   10   HD11  ILE  12          HD12      ILE  12   9.572  -9.382   0.555
   11   HD13  ILE  12          HD13      ILE  12   8.510 -10.552   1.307

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  13           H        ILE  13  14.110 -11.183   2.745
    2    HA   ILE  13           HA       ILE  13  14.148 -10.006   5.327
    3    HB   ILE  13           HB       ILE  13  16.214 -11.551   3.744
    4   HG12  ILE  13          HG12      ILE  13  13.972 -12.562   4.587
    5   HG13  ILE  13          HG13      ILE  13  15.462 -13.449   4.892
    6   HG22  ILE  13          HG21      ILE  13  17.212 -11.893   6.139
    7   HG21  ILE  13          HG22      ILE  13  16.374 -10.396   6.527
    8   HG23  ILE  13          HG23      ILE  13  17.603 -10.415   5.262
    9   HD13  ILE  13          HD11      ILE  13  15.374 -13.068   7.173
   10   HD12  ILE  13          HD12      ILE  13  13.653 -12.940   6.822
   11   HD11  ILE  13          HD13      ILE  13  14.629 -11.484   6.971

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ASN  14           H        ASN  14  16.074  -9.445   2.396
    2    HA   ASN  14           HA       ASN  14  17.797  -7.480   3.448
    3    HB2  ASN  14           HB2      ASN  14  17.777  -8.744   1.131
    4    HB3  ASN  14           HB3      ASN  14  16.860  -7.339   0.601
    5   HD21  ASN  14          HD21      ASN  14  19.297  -7.642  -0.601
    6   HD22  ASN  14          HD22      ASN  14  20.429  -6.543   0.020

  No H/Q in entry =           6
  In of MODEL   47
    1    H    SER  15           H        SER  15  14.670  -7.176   1.777
    2    HA   SER  15           HA       SER  15  14.517  -4.358   1.837
    3    HB2  SER  15           HB2      SER  15  12.185  -4.639   1.358
    4    HB3  SER  15           HB3      SER  15  12.997  -5.990   0.578
    5    HG   SER  15           HG       SER  15  11.185  -5.982   2.597

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLY  16           H        GLY  16  13.476  -6.836   4.145
    2    HA3  GLY  16           HA2      GLY  16  12.241  -5.108   6.013
    3    HA2  GLY  16           HA3      GLY  16  12.882  -6.707   6.369

  No H/Q in entry =           3
  In of MODEL   47
    1    H    GLN  17           H        GLN  17  15.584  -6.332   5.759
    2    HA   GLN  17           HA       GLN  17  16.538  -5.099   8.135
    3    HB2  GLN  17           HB2      GLN  17  17.800  -6.865   6.962
    4    HB3  GLN  17           HB3      GLN  17  18.049  -5.780   5.593
    5    HG2  GLN  17           HG2      GLN  17  19.274  -4.213   7.037
    6    HG3  GLN  17           HG3      GLN  17  19.004  -5.266   8.423
    7   HE21  GLN  17          HE21      GLN  17  21.656  -4.633   7.588
    8   HE22  GLN  17          HE22      GLN  17  22.375  -6.038   6.964

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ALA  18           H        ALA  18  16.310  -4.021   4.777
    2    HA   ALA  18           HA       ALA  18  17.710  -1.607   4.997
    3    HB2  ALA  18           HB1      ALA  18  16.598  -2.837   2.936
    4    HB3  ALA  18           HB2      ALA  18  16.835  -1.089   2.921
    5    HB1  ALA  18           HB3      ALA  18  15.248  -1.760   3.300

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ARG  19           H        ARG  19  14.222  -2.249   5.416
    2    HA   ARG  19           HA       ARG  19  13.518   0.389   6.139
    3    HB2  ARG  19           HB2      ARG  19  11.861  -1.388   5.561
    4    HB3  ARG  19           HB3      ARG  19  12.225  -2.182   7.095
    5    HG2  ARG  19           HG2      ARG  19  11.491  -0.204   8.341
    6    HG3  ARG  19           HG3      ARG  19  11.218   0.670   6.835
    7    HD2  ARG  19           HD2      ARG  19   9.094  -0.160   7.668
    8    HD3  ARG  19           HD3      ARG  19   9.517  -1.032   6.188
    9    HE   ARG  19           HE       ARG  19  10.514  -2.561   8.285
   10   HH21  ARG  19          HH11      ARG  19   9.297  -4.221   9.231
   11   HH22  ARG  19          HH12      ARG  19   7.575  -4.221   9.071
   12   HH11  ARG  19          HH21      ARG  19   7.493  -1.314   7.211
   13   HH12  ARG  19          HH22      ARG  19   6.554  -2.575   7.923

  No H/Q in entry =          13
  In of MODEL   47
    1    H    SER  20           H        SER  20  14.433  -2.429   8.089
    2    HA   SER  20           HA       SER  20  14.149  -1.337  10.629
    3    HB2  SER  20           HB2      SER  20  14.650  -3.654  10.503
    4    HB3  SER  20           HB3      SER  20  16.091  -3.368   9.530
    5    HG   SER  20           HG       SER  20  17.050  -2.405  11.330

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU  21           H        LEU  21  16.977  -1.229   8.475
    2    HA   LEU  21           HA       LEU  21  18.639   0.282  10.204
    3    HB2  LEU  21           HB2      LEU  21  18.602   0.017   7.190
    4    HB3  LEU  21           HB3      LEU  21  19.851   0.889   8.075
    5    HG   LEU  21           HG       LEU  21  19.151  -2.014   8.602
    6   HD11  LEU  21          HD11      LEU  21  21.244  -0.771   6.803
    7   HD13  LEU  21          HD12      LEU  21  19.992  -1.930   6.360
    8   HD12  LEU  21          HD13      LEU  21  21.339  -2.437   7.377
    9   HD21  LEU  21          HD21      LEU  21  21.231  -0.090   9.615
   10   HD23  LEU  21          HD22      LEU  21  21.658  -1.792   9.494
   11   HD22  LEU  21          HD23      LEU  21  20.318  -1.296  10.514

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ALA  22           H        ALA  22  16.344   1.218   7.664
    2    HA   ALA  22           HA       ALA  22  16.839   3.984   7.678
    3    HB3  ALA  22           HB1      ALA  22  15.445   2.722   6.007
    4    HB2  ALA  22           HB2      ALA  22  14.719   4.223   6.580
    5    HB1  ALA  22           HB3      ALA  22  14.157   2.674   7.209

  No H/Q in entry =           5
  In of MODEL   47
    1    H    TYR  23           H        TYR  23  14.383   2.127   9.526
    2    HA   TYR  23           HA       TYR  23  13.395   4.348  10.984
    3    HB2  TYR  23           HB2      TYR  23  12.190   2.218  10.970
    4    HB3  TYR  23           HB3      TYR  23  13.540   1.423  11.780
    5    HD1  TYR  23           HD1      TYR  23  11.041   4.172  12.181
    6    HD2  TYR  23           HD2      TYR  23  13.718   1.437  14.131
    7    HE1  TYR  23           HE1      TYR  23  10.123   4.845  14.386
    8    HE2  TYR  23           HE2      TYR  23  12.800   2.109  16.335
    9    HH   TYR  23           HH       TYR  23  10.285   4.623  16.587

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ALA  24           H        ALA  24  16.079   2.112  11.602
    2    HA   ALA  24           HA       ALA  24  16.749   3.115  14.162
    3    HB1  ALA  24           HB1      ALA  24  18.132   1.343  13.987
    4    HB3  ALA  24           HB2      ALA  24  19.139   2.281  12.883
    5    HB2  ALA  24           HB3      ALA  24  17.855   1.254  12.248

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA  25           H        ALA  25  17.672   4.062  10.879
    2    HA   ALA  25           HA       ALA  25  19.592   6.025  11.515
    3    HB1  ALA  25           HB1      ALA  25  18.875   5.069   9.203
    4    HB3  ALA  25           HB2      ALA  25  19.351   6.764   9.295
    5    HB2  ALA  25           HB3      ALA  25  17.643   6.331   9.236

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU  26           H        LEU  26  16.072   6.202  11.176
    2    HA   LEU  26           HA       LEU  26  15.809   8.979  11.632
    3    HB2  LEU  26           HB2      LEU  26  13.960   7.717  10.714
    4    HB3  LEU  26           HB3      LEU  26  13.893   6.687  12.138
    5    HG   LEU  26           HG       LEU  26  13.267   8.634  13.525
    6   HD12  LEU  26          HD11      LEU  26  12.567  10.726  12.206
    7   HD11  LEU  26          HD12      LEU  26  13.549  10.089  10.890
    8   HD13  LEU  26          HD13      LEU  26  14.298  10.483  12.438
    9   HD21  LEU  26          HD21      LEU  26  11.581   8.299  11.025
   10   HD23  LEU  26          HD22      LEU  26  11.020   8.987  12.546
   11   HD22  LEU  26          HD23      LEU  26  11.496   7.292  12.471

  No H/Q in entry =          11
  In of MODEL   47
    1    H    LYS  27           H        LYS  27  15.755   6.196  13.822
    2    HA   LYS  27           HA       LYS  27  15.157   7.550  16.195
    3    HB2  LYS  27           HB2      LYS  27  15.220   5.076  15.927
    4    HB3  LYS  27           HB3      LYS  27  16.982   5.154  15.873
    5    HG2  LYS  27           HG2      LYS  27  17.032   6.138  18.123
    6    HG3  LYS  27           HG3      LYS  27  15.265   6.131  18.180
    7    HD2  LYS  27           HD2      LYS  27  15.273   3.664  17.940
    8    HD3  LYS  27           HD3      LYS  27  17.038   3.678  17.917
    9    HE2  LYS  27           HE2      LYS  27  17.072   4.665  20.175
   10    HE3  LYS  27           HE3      LYS  27  15.306   4.680  20.201
   11    HZ3  LYS  27           HZ1      LYS  27  16.129   2.738  21.344
   12    HZ2  LYS  27           HZ2      LYS  27  17.043   2.273  19.987
   13    HZ1  LYS  27           HZ3      LYS  27  15.345   2.255  19.918

  No H/Q in entry =          13
  In of MODEL   47
    1    H    GLN  28           H        GLN  28  18.272   7.014  14.583
    2    HA   GLN  28           HA       GLN  28  19.953   8.118  16.564
    3    HB2  GLN  28           HB2      GLN  28  20.223   8.081  13.547
    4    HB3  GLN  28           HB3      GLN  28  21.510   8.567  14.651
    5    HG2  GLN  28           HG2      GLN  28  20.129   5.868  14.673
    6    HG3  GLN  28           HG3      GLN  28  21.717   6.187  13.978
    7   HE21  GLN  28          HE21      GLN  28  20.407   4.852  16.664
    8   HE22  GLN  28          HE22      GLN  28  21.579   5.276  17.815

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ALA  29           H        ALA  29  18.164   9.580  13.885
    2    HA   ALA  29           HA       ALA  29  19.130  12.214  14.135
    3    HB2  ALA  29           HB1      ALA  29  17.414  12.829  12.675
    4    HB1  ALA  29           HB2      ALA  29  16.290  11.640  13.332
    5    HB3  ALA  29           HB3      ALA  29  17.620  11.117  12.300

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LYS  30           H        LYS  30  16.384  10.576  15.672
    2    HA   LYS  30           HA       LYS  30  15.349  12.814  17.038
    3    HB2  LYS  30           HB2      LYS  30  15.280   9.871  17.739
    4    HB3  LYS  30           HB3      LYS  30  14.404  11.109  18.639
    5    HG2  LYS  30           HG2      LYS  30  13.257  11.783  16.529
    6    HG3  LYS  30           HG3      LYS  30  14.073  10.458  15.695
    7    HD2  LYS  30           HD2      LYS  30  13.032   8.836  17.228
    8    HD3  LYS  30           HD3      LYS  30  12.226  10.149  18.086
    9    HE2  LYS  30           HE2      LYS  30  11.036  10.770  16.002
   10    HE3  LYS  30           HE3      LYS  30  11.823   9.427  15.164
   11    HZ2  LYS  30           HZ1      LYS  30   9.525   8.987  16.058
   12    HZ1  LYS  30           HZ2      LYS  30  10.202   9.047  17.621
   13    HZ3  LYS  30           HZ3      LYS  30  10.718   7.870  16.506

  No H/Q in entry =          13
  In of MODEL   47
    1    H    GLN  31           H        GLN  31  18.042  10.677  17.755
    2    HA   GLN  31           HA       GLN  31  18.374  11.692  20.449
    3    HB2  GLN  31           HB2      GLN  31  20.406  10.149  18.829
    4    HB3  GLN  31           HB3      GLN  31  20.281  10.270  20.585
    5    HG2  GLN  31           HG2      GLN  31  17.775   9.287  19.830
    6    HG3  GLN  31           HG3      GLN  31  18.880   8.458  18.742
    7   HE21  GLN  31          HE21      GLN  31  17.367   7.290  21.027
    8   HE22  GLN  31          HE22      GLN  31  18.537   6.642  22.069

  No H/Q in entry =           8
  In of MODEL   47
    1    H    GLY  32           H        GLY  32  18.858  13.020  17.481
    2    HA3  GLY  32           HA2      GLY  32  19.813  15.078  16.963
    3    HA2  GLY  32           HA3      GLY  32  20.580  15.090  18.546

  No H/Q in entry =           3
  In of MODEL   47
    1    H    ASP  33           H        ASP  33  21.027  12.206  16.763
    2    HA   ASP  33           HA       ASP  33  23.841  12.917  16.279
    3    HB2  ASP  33           HB2      ASP  33  22.366  10.282  16.402
    4    HB3  ASP  33           HB3      ASP  33  24.048  10.420  15.896

  No H/Q in entry =           4
  In of MODEL   47
    1    H    PHE  34           H        PHE  34  23.331  14.236  14.403
    2    HA   PHE  34           HA       PHE  34  21.980  13.238  12.123
    3    HB2  PHE  34           HB2      PHE  34  24.085  15.399  12.343
    4    HB3  PHE  34           HB3      PHE  34  23.094  15.098  10.917
    5    HD1  PHE  34           HD1      PHE  34  23.339  17.031  13.831
    6    HD2  PHE  34           HD2      PHE  34  20.474  14.882  11.461
    7    HE1  PHE  34           HE1      PHE  34  21.512  18.405  14.792
    8    HE2  PHE  34           HE2      PHE  34  18.650  16.256  12.425
    9    HZ   PHE  34           HZ       PHE  34  19.172  18.017  14.086

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ALA  35           H        ALA  35  25.363  13.093  13.109
    2    HA   ALA  35           HA       ALA  35  26.463  12.289  10.644
    3    HB3  ALA  35           HB1      ALA  35  28.169  11.139  12.351
    4    HB2  ALA  35           HB2      ALA  35  27.300  12.152  13.504
    5    HB1  ALA  35           HB3      ALA  35  28.118  12.888  12.127

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA  36           H        ALA  36  25.390  10.315  13.414
    2    HA   ALA  36           HA       ALA  36  25.899   7.836  12.132
    3    HB2  ALA  36           HB1      ALA  36  25.491   7.081  14.209
    4    HB3  ALA  36           HB2      ALA  36  23.796   7.554  14.070
    5    HB1  ALA  36           HB3      ALA  36  24.986   8.700  14.687

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA  37           H        ALA  37  23.050   9.924  12.286
    2    HA   ALA  37           HA       ALA  37  21.210   8.131  11.120
    3    HB3  ALA  37           HB1      ALA  37  21.398  11.097  11.415
    4    HB1  ALA  37           HB2      ALA  37  20.104  10.000  11.894
    5    HB2  ALA  37           HB3      ALA  37  20.276  10.477  10.204

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LYS  38           H        LYS  38  23.267  10.623   9.631
    2    HA   LYS  38           HA       LYS  38  22.616  10.190   6.957
    3    HB2  LYS  38           HB2      LYS  38  24.413  11.770   8.393
    4    HB3  LYS  38           HB3      LYS  38  25.453  10.796   7.359
    5    HG2  LYS  38           HG2      LYS  38  24.266  11.553   5.372
    6    HG3  LYS  38           HG3      LYS  38  23.066  12.390   6.362
    7    HD2  LYS  38           HD2      LYS  38  24.643  14.009   7.106
    8    HD3  LYS  38           HD3      LYS  38  26.013  13.043   6.560
    9    HE2  LYS  38           HE2      LYS  38  25.621  14.911   5.014
   10    HE3  LYS  38           HE3      LYS  38  25.302  13.370   4.210
   11    HZ3  LYS  38           HZ1      LYS  38  23.098  13.784   4.094
   12    HZ2  LYS  38           HZ2      LYS  38  23.599  15.406   4.181
   13    HZ1  LYS  38           HZ3      LYS  38  23.045  14.613   5.575

  No H/Q in entry =          13
  In of MODEL   47
    1    H    ALA  39           H        ALA  39  25.165   8.625   8.895
    2    HA   ALA  39           HA       ALA  39  26.243   7.054   6.816
    3    HB2  ALA  39           HB1      ALA  39  26.186   6.086   9.659
    4    HB1  ALA  39           HB2      ALA  39  27.116   7.525   9.239
    5    HB3  ALA  39           HB3      ALA  39  27.484   5.981   8.471

  No H/Q in entry =           5
  In of MODEL   47
    1    H    MET  40           H        MET  40  23.654   6.398   9.130
    2    HA   MET  40           HA       MET  40  23.245   3.688   8.395
    3    HB2  MET  40           HB2      MET  40  21.408   5.704   9.702
    4    HB3  MET  40           HB3      MET  40  21.025   3.989   9.527
    5    HG2  MET  40           HG2      MET  40  23.569   4.965  10.853
    6    HG3  MET  40           HG3      MET  40  22.084   4.667  11.756
    7    HE3  MET  40           HE1      MET  40  21.575   1.025  11.930
    8    HE2  MET  40           HE2      MET  40  20.682   2.316  11.130
    9    HE1  MET  40           HE3      MET  40  21.429   2.612  12.698

  No H/Q in entry =           9
  In of MODEL   47
    1    H    MET  41           H        MET  41  21.779   6.722   7.221
    2    HA   MET  41           HA       MET  41  19.829   5.501   5.560
    3    HB2  MET  41           HB2      MET  41  21.269   8.113   5.041
    4    HB3  MET  41           HB3      MET  41  19.744   7.598   4.332
    5    HG2  MET  41           HG2      MET  41  19.017   7.395   6.888
    6    HG3  MET  41           HG3      MET  41  20.310   8.572   7.103
    7    HE2  MET  41           HE1      MET  41  19.707   9.856   3.772
    8    HE1  MET  41           HE2      MET  41  20.666  10.307   5.178
    9    HE3  MET  41           HE3      MET  41  19.374  11.369   4.623

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ASP  42           H        ASP  42  23.184   6.474   4.987
    2    HA   ASP  42           HA       ASP  42  23.265   6.005   2.228
    3    HB2  ASP  42           HB2      ASP  42  25.013   7.026   3.987
    4    HB3  ASP  42           HB3      ASP  42  25.693   5.411   3.853

  No H/Q in entry =           4
  In of MODEL   47
    1    H    GLN  43           H        GLN  43  24.039   3.858   4.941
    2    HA   GLN  43           HA       GLN  43  24.726   1.612   3.350
    3    HB2  GLN  43           HB2      GLN  43  23.720   1.777   6.201
    4    HB3  GLN  43           HB3      GLN  43  24.316   0.298   5.440
    5    HG2  GLN  43           HG2      GLN  43  26.457   1.541   4.917
    6    HG3  GLN  43           HG3      GLN  43  25.861   2.858   5.922
    7   HE21  GLN  43          HE21      GLN  43  28.115   1.917   6.943
    8   HE22  GLN  43          HE22      GLN  43  27.865   0.829   8.219

  No H/Q in entry =           8
  In of MODEL   47
    1    H    SER  44           H        SER  44  21.663   2.699   4.757
    2    HA   SER  44           HA       SER  44  20.123   0.433   4.091
    3    HB2  SER  44           HB2      SER  44  19.652   2.954   5.243
    4    HB3  SER  44           HB3      SER  44  18.609   2.897   3.825
    5    HG   SER  44           HG       SER  44  17.541   1.935   5.553

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ARG  45           H        ARG  45  20.810   3.411   2.286
    2    HA   ARG  45           HA       ARG  45  19.278   2.906  -0.010
    3    HB2  ARG  45           HB2      ARG  45  20.393   5.058   0.570
    4    HB3  ARG  45           HB3      ARG  45  21.946   4.326   0.174
    5    HG2  ARG  45           HG2      ARG  45  21.154   3.912  -2.136
    6    HG3  ARG  45           HG3      ARG  45  19.613   4.667  -1.739
    7    HD2  ARG  45           HD2      ARG  45  20.836   6.781  -1.160
    8    HD3  ARG  45           HD3      ARG  45  22.340   6.030  -1.739
    9    HE   ARG  45           HE       ARG  45  20.400   5.767  -3.763
   10   HH21  ARG  45          HH11      ARG  45  20.361   7.138  -5.524
   11   HH22  ARG  45          HH12      ARG  45  21.096   8.699  -5.422
   12   HH11  ARG  45          HH21      ARG  45  22.104   8.288  -2.144
   13   HH12  ARG  45          HH22      ARG  45  22.082   9.350  -3.506

  No H/Q in entry =          13
  In of MODEL   47
    1    H    MET  46           H        MET  46  22.659   2.079   0.714
    2    HA   MET  46           HA       MET  46  23.265   0.898  -1.776
    3    HB2  MET  46           HB2      MET  46  24.395   0.577   1.006
    4    HB3  MET  46           HB3      MET  46  25.058  -0.294  -0.381
    5    HG2  MET  46           HG2      MET  46  25.461   1.826  -1.551
    6    HG3  MET  46           HG3      MET  46  24.741   2.720  -0.219
    7    HE2  MET  46           HE1      MET  46  28.746   0.636  -0.542
    8    HE1  MET  46           HE2      MET  46  27.284   0.417  -1.499
    9    HE3  MET  46           HE3      MET  46  27.465  -0.442   0.029

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ALA  47           H        ALA  47  21.922  -0.458   1.208
    2    HA   ALA  47           HA       ALA  47  21.900  -3.171   0.402
    3    HB2  ALA  47           HB1      ALA  47  21.531  -2.718   2.710
    4    HB3  ALA  47           HB2      ALA  47  19.999  -3.342   2.101
    5    HB1  ALA  47           HB3      ALA  47  20.206  -1.608   2.360

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU  48           H        LEU  48  19.509  -0.576   0.065
    2    HA   LEU  48           HA       LEU  48  17.476  -2.136  -1.173
    3    HB2  LEU  48           HB2      LEU  48  18.090   0.827  -1.289
    4    HB3  LEU  48           HB3      LEU  48  16.624   0.097  -1.946
    5    HG   LEU  48           HG       LEU  48  17.502  -0.196   0.936
    6   HD13  LEU  48          HD11      LEU  48  17.052   2.099   0.755
    7   HD12  LEU  48          HD12      LEU  48  15.506   1.430   1.275
    8   HD11  LEU  48          HD13      LEU  48  15.759   1.858  -0.417
    9   HD22  LEU  48          HD21      LEU  48  15.994  -1.930   0.565
   10   HD21  LEU  48          HD22      LEU  48  15.099  -1.038  -0.666
   11   HD23  LEU  48          HD23      LEU  48  14.894  -0.638   1.039

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ASN  49           H        ASN  49  20.129  -0.170  -2.421
    2    HA   ASN  49           HA       ASN  49  19.459  -0.260  -5.140
    3    HB2  ASN  49           HB2      ASN  49  21.123   1.279  -4.235
    4    HB3  ASN  49           HB3      ASN  49  22.172  -0.066  -3.800
    5   HD21  ASN  49          HD21      ASN  49  23.906   0.052  -5.215
    6   HD22  ASN  49          HD22      ASN  49  23.775   0.227  -6.897

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLU  50           H        GLU  50  21.487  -2.430  -3.195
    2    HA   GLU  50           HA       GLU  50  22.196  -4.174  -5.328
    3    HB2  GLU  50           HB2      GLU  50  23.409  -4.135  -3.171
    4    HB3  GLU  50           HB3      GLU  50  21.981  -4.783  -2.364
    5    HG2  GLU  50           HG2      GLU  50  22.087  -6.813  -3.726
    6    HG3  GLU  50           HG3      GLU  50  23.448  -6.162  -4.637

  No H/Q in entry =           6
  In of MODEL   47
    1    H    ALA  51           H        ALA  51  19.557  -4.146  -2.981
    2    HA   ALA  51           HA       ALA  51  18.418  -6.633  -3.732
    3    HB3  ALA  51           HB1      ALA  51  16.831  -6.150  -2.164
    4    HB1  ALA  51           HB2      ALA  51  16.591  -4.506  -2.759
    5    HB2  ALA  51           HB3      ALA  51  17.963  -4.875  -1.714

  No H/Q in entry =           5
  In of MODEL   47
    1    H    HIS  52           H        HIS  52  17.779  -3.293  -4.759
    2    HA   HIS  52           HA       HIS  52  15.659  -3.846  -6.543
    3    HB2  HIS  52           HB2      HIS  52  16.208  -1.574  -5.785
    4    HB3  HIS  52           HB3      HIS  52  17.736  -1.645  -6.663
    5    HD1  HIS  52           HD1      HIS  52  17.493  -1.995  -9.347
    6    HD2  HIS  52           HD2      HIS  52  14.055  -0.759  -7.339
    7    HE1  HIS  52           HE1      HIS  52  15.916  -1.095 -11.113
    8    HE2  HIS  52           HE2      HIS  52  13.816  -0.336  -9.904

  No H/Q in entry =           8
  In of MODEL   47
    1    H    LEU  53           H        LEU  53  19.174  -3.805  -7.003
    2    HA   LEU  53           HA       LEU  53  19.214  -4.118  -9.804
    3    HB2  LEU  53           HB2      LEU  53  21.173  -4.859  -7.646
    4    HB3  LEU  53           HB3      LEU  53  21.482  -5.233  -9.340
    5    HG   LEU  53           HG       LEU  53  20.777  -2.437  -8.395
    6   HD12  LEU  53          HD11      LEU  53  23.280  -2.037  -8.687
    7   HD11  LEU  53          HD12      LEU  53  23.467  -3.791  -8.675
    8   HD13  LEU  53          HD13      LEU  53  22.818  -2.966  -7.263
    9   HD21  LEU  53          HD21      LEU  53  21.867  -3.638 -10.948
   10   HD23  LEU  53          HD22      LEU  53  22.161  -1.948 -10.550
   11   HD22  LEU  53          HD23      LEU  53  20.518  -2.524 -10.765

  No H/Q in entry =          11
  In of MODEL   47
    1    H    VAL  54           H        VAL  54  19.154  -6.507  -7.179
    2    HA   VAL  54           HA       VAL  54  19.295  -8.799  -8.841
    3    HB   VAL  54           HB       VAL  54  18.157  -8.393  -6.064
    4   HG12  VAL  54          HG11      VAL  54  18.517 -11.006  -6.064
    5   HG11  VAL  54          HG12      VAL  54  18.316 -10.839  -7.808
    6   HG13  VAL  54          HG13      VAL  54  17.029 -10.327  -6.719
    7   HG22  VAL  54          HG21      VAL  54  20.471  -8.150  -5.859
    8   HG21  VAL  54          HG22      VAL  54  20.813  -9.237  -7.204
    9   HG23  VAL  54          HG23      VAL  54  20.304  -9.892  -5.648

  No H/Q in entry =           9
  In of MODEL   47
    1    H    GLN  55           H        GLN  55  16.551  -6.935  -7.536
    2    HA   GLN  55           HA       GLN  55  14.545  -8.626  -8.595
    3    HB2  GLN  55           HB2      GLN  55  13.788  -7.112  -6.961
    4    HB3  GLN  55           HB3      GLN  55  14.556  -5.732  -7.743
    5    HG2  GLN  55           HG2      GLN  55  12.816  -5.431  -9.219
    6    HG3  GLN  55           HG3      GLN  55  12.517  -7.156  -9.387
    7   HE21  GLN  55          HE21      GLN  55  10.524  -7.734  -8.567
    8   HE22  GLN  55          HE22      GLN  55   9.750  -6.991  -7.252

  No H/Q in entry =           8
  In of MODEL   47
    1    H    THR  56           H        THR  56  16.234  -5.802  -9.966
    2    HA   THR  56           HA       THR  56  14.773  -5.459 -12.303
    3    HB   THR  56           HB       THR  56  17.792  -5.327 -12.158
    4    HG1  THR  56           HG1      THR  56  16.683  -4.205 -10.438
    5   HG23  THR  56          HG21      THR  56  17.674  -3.969 -14.027
    6   HG22  THR  56          HG22      THR  56  16.038  -3.428 -13.660
    7   HG21  THR  56          HG23      THR  56  16.304  -5.035 -14.338

  No H/Q in entry =           7
  In of MODEL   47
    1    H    LYS  57           H        LYS  57  17.460  -7.718 -11.714
    2    HA   LYS  57           HA       LYS  57  17.457  -8.912 -14.292
    3    HB2  LYS  57           HB2      LYS  57  19.264  -9.139 -12.559
    4    HB3  LYS  57           HB3      LYS  57  18.181 -10.153 -11.617
    5    HG2  LYS  57           HG2      LYS  57  18.074 -11.773 -13.473
    6    HG3  LYS  57           HG3      LYS  57  19.162 -10.767 -14.421
    7    HD2  LYS  57           HD2      LYS  57  19.939 -11.799 -11.689
    8    HD3  LYS  57           HD3      LYS  57  20.221 -12.743 -13.151
    9    HE2  LYS  57           HE2      LYS  57  21.458 -10.749 -14.102
   10    HE3  LYS  57           HE3      LYS  57  21.335  -9.985 -12.518
   11    HZ3  LYS  57           HZ1      LYS  57  23.393 -11.060 -12.546
   12    HZ2  LYS  57           HZ2      LYS  57  22.756 -12.475 -13.236
   13    HZ1  LYS  57           HZ3      LYS  57  22.391 -12.074 -11.627

  No H/Q in entry =          13
  In of MODEL   47
    1    H    LEU  58           H        LEU  58  15.710  -9.606 -11.303
    2    HA   LEU  58           HA       LEU  58  14.516 -11.997 -12.229
    3    HB2  LEU  58           HB2      LEU  58  13.711 -10.104 -10.026
    4    HB3  LEU  58           HB3      LEU  58  12.924 -11.653 -10.336
    5    HG   LEU  58           HG       LEU  58  15.897 -11.332  -9.806
    6   HD11  LEU  58          HD11      LEU  58  13.547 -11.784  -7.994
    7   HD13  LEU  58          HD12      LEU  58  14.988 -10.800  -7.743
    8   HD12  LEU  58          HD13      LEU  58  15.087 -12.554  -7.609
    9   HD22  LEU  58          HD21      LEU  58  15.802 -13.395 -10.833
   10   HD21  LEU  58          HD22      LEU  58  14.094 -13.630 -10.459
   11   HD23  LEU  58          HD23      LEU  58  15.317 -13.913  -9.219

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  59           H        ILE  59  13.790  -8.670 -12.905
    2    HA   ILE  59           HA       ILE  59  11.077  -9.359 -13.823
    3    HB   ILE  59           HB       ILE  59  11.852  -7.067 -12.623
    4   HG12  ILE  59          HG12      ILE  59   9.938  -6.977 -14.967
    5   HG13  ILE  59          HG13      ILE  59   9.533  -7.737 -13.450
    6   HG21  ILE  59          HG21      ILE  59  13.384  -6.647 -14.687
    7   HG23  ILE  59          HG22      ILE  59  12.397  -5.320 -14.117
    8   HG22  ILE  59          HG23      ILE  59  11.904  -6.253 -15.527
    9   HD12  ILE  59          HD11      ILE  59  10.325  -4.851 -13.833
   10   HD11  ILE  59          HD12      ILE  59  10.035  -5.602 -12.265
   11   HD13  ILE  59          HD13      ILE  59   8.714  -5.443 -13.424

  No H/Q in entry =          11
  In of MODEL   47
    1    H    GLU  60           H        GLU  60  14.258  -8.459 -15.107
    2    HA   GLU  60           HA       GLU  60  13.451  -8.070 -17.809
    3    HB2  GLU  60           HB2      GLU  60  15.622  -7.298 -16.993
    4    HB3  GLU  60           HB3      GLU  60  16.112  -8.958 -16.663
    5    HG2  GLU  60           HG2      GLU  60  15.233  -8.175 -19.433
    6    HG3  GLU  60           HG3      GLU  60  16.880  -7.841 -18.900

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLY  61           H        GLY  61  14.485 -10.937 -16.003
    2    HA3  GLY  61           HA2      GLY  61  13.949 -12.592 -18.400
    3    HA2  GLY  61           HA3      GLY  61  14.999 -13.059 -17.066

  No H/Q in entry =           3
  In of MODEL   47
    1    H    ASP  62           H        ASP  62  11.860 -11.558 -16.668
    2    HA   ASP  62           HA       ASP  62  10.979 -13.629 -14.907
    3    HB2  ASP  62           HB2      ASP  62   8.892 -12.302 -14.826
    4    HB3  ASP  62           HB3      ASP  62  10.326 -11.324 -14.532

  No H/Q in entry =           4
  In of MODEL   47
    1    H    ALA  63           H        ALA  63  11.519 -14.891 -17.362
    2    HA   ALA  63           HA       ALA  63   9.227 -15.229 -19.026
    3    HB2  ALA  63           HB1      ALA  63  11.302 -15.949 -19.920
    4    HB1  ALA  63           HB2      ALA  63  10.410 -17.436 -19.607
    5    HB3  ALA  63           HB3      ALA  63  11.674 -16.916 -18.493

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLY  64           H        GLY  64  10.400 -16.874 -16.140
    2    HA3  GLY  64           HA2      GLY  64   9.453 -18.411 -14.727
    3    HA2  GLY  64           HA3      GLY  64   7.928 -17.635 -15.130

  No H/Q in entry =           3
  In of MODEL   47
    1    H    GLU  65           H        GLU  65   6.538 -19.305 -15.453
    2    HA   GLU  65           HA       GLU  65   7.240 -21.829 -16.429
    3    HB2  GLU  65           HB2      GLU  65   4.577 -20.415 -16.415
    4    HB3  GLU  65           HB3      GLU  65   4.786 -22.112 -16.848
    5    HG2  GLU  65           HG2      GLU  65   5.745 -22.595 -14.659
    6    HG3  GLU  65           HG3      GLU  65   5.672 -20.890 -14.219

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLY  66           H        GLY  66   5.586 -22.586 -18.334
    2    HA3  GLY  66           HA2      GLY  66   6.906 -22.028 -20.746
    3    HA2  GLY  66           HA3      GLY  66   5.395 -22.901 -20.579

  No H/Q in entry =           3
  In of MODEL   47
    1    H    LYS  67           H        LYS  67   3.924 -20.741 -19.420
    2    HA   LYS  67           HA       LYS  67   3.142 -19.414 -21.837
    3    HB2  LYS  67           HB2      LYS  67   2.078 -19.331 -19.018
    4    HB3  LYS  67           HB3      LYS  67   1.338 -18.470 -20.374
    5    HG2  LYS  67           HG2      LYS  67   1.123 -20.592 -21.613
    6    HG3  LYS  67           HG3      LYS  67   1.864 -21.456 -20.270
    7    HD2  LYS  67           HD2      LYS  67   0.009 -20.838 -18.803
    8    HD3  LYS  67           HD3      LYS  67  -0.719 -19.880 -20.095
    9    HE2  LYS  67           HE2      LYS  67  -1.797 -22.083 -19.973
   10    HE3  LYS  67           HE3      LYS  67  -0.908 -21.923 -21.487
   11    HZ1  LYS  67           HZ1      LYS  67   0.787 -22.937 -19.466
   12    HZ3  LYS  67           HZ2      LYS  67   0.344 -23.645 -20.945
   13    HZ2  LYS  67           HZ3      LYS  67  -0.614 -23.889 -19.562

  No H/Q in entry =          13
  In of MODEL   47
    1    H    MET  68           H        MET  68   2.846 -17.238 -22.184
    2    HA   MET  68           HA       MET  68   4.994 -15.570 -21.901
    3    HB2  MET  68           HB2      MET  68   2.079 -14.910 -22.298
    4    HB3  MET  68           HB3      MET  68   3.374 -13.723 -22.452
    5    HG2  MET  68           HG2      MET  68   4.436 -15.070 -24.202
    6    HG3  MET  68           HG3      MET  68   3.192 -16.308 -24.026
    7    HE3  MET  68           HE1      MET  68   2.565 -12.165 -24.146
    8    HE2  MET  68           HE2      MET  68   3.076 -12.187 -25.832
    9    HE1  MET  68           HE3      MET  68   4.134 -12.850 -24.590

  No H/Q in entry =           9
  In of MODEL   47
    1    H    LYS  69           H        LYS  69   3.023 -16.415 -19.301
    2    HA   LYS  69           HA       LYS  69   2.810 -13.948 -17.939
    3    HB2  LYS  69           HB2      LYS  69   2.675 -16.800 -16.971
    4    HB3  LYS  69           HB3      LYS  69   2.365 -15.409 -15.928
    5    HG2  LYS  69           HG2      LYS  69   0.605 -14.632 -17.465
    6    HG3  LYS  69           HG3      LYS  69   0.915 -16.010 -18.521
    7    HD2  LYS  69           HD2      LYS  69   0.289 -17.552 -16.705
    8    HD3  LYS  69           HD3      LYS  69  -0.016 -16.178 -15.640
    9    HE2  LYS  69           HE2      LYS  69  -1.753 -15.358 -17.191
   10    HE3  LYS  69           HE3      LYS  69  -1.450 -16.731 -18.254
   11    HZ1  LYS  69           HZ1      LYS  69  -1.874 -18.052 -16.052
   12    HZ3  LYS  69           HZ2      LYS  69  -3.166 -17.540 -17.029
   13    HZ2  LYS  69           HZ3      LYS  69  -2.753 -16.663 -15.634

  No H/Q in entry =          13
  In of MODEL   47
    1    H    VAL  70           H        VAL  70   3.659 -14.239 -15.360
    2    HA   VAL  70           HA       VAL  70   6.610 -14.437 -15.490
    3    HB   VAL  70           HB       VAL  70   6.735 -12.397 -14.084
    4   HG11  VAL  70          HG11      VAL  70   6.910 -12.301 -16.583
    5   HG13  VAL  70          HG12      VAL  70   6.283 -10.811 -15.878
    6   HG12  VAL  70          HG13      VAL  70   5.183 -11.950 -16.652
    7   HG23  VAL  70          HG21      VAL  70   4.537 -10.971 -14.158
    8   HG22  VAL  70          HG22      VAL  70   4.667 -12.258 -12.960
    9   HG21  VAL  70          HG23      VAL  70   3.734 -12.517 -14.433

  No H/Q in entry =           9
  In of MODEL   47
    1    H    SER  71           H        SER  71   7.586 -14.578 -13.311
    2    HA   SER  71           HA       SER  71   6.439 -16.613 -11.719
    3    HB2  SER  71           HB2      SER  71   8.880 -16.092 -11.824
    4    HB3  SER  71           HB3      SER  71   8.570 -14.614 -10.916
    5    HG   SER  71           HG       SER  71   9.127 -16.253  -9.490

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU  72           H        LEU  72   5.101 -16.536  -9.995
    2    HA   LEU  72           HA       LEU  72   3.521 -14.246  -9.538
    3    HB2  LEU  72           HB2      LEU  72   3.858 -16.802  -7.976
    4    HB3  LEU  72           HB3      LEU  72   2.678 -15.561  -7.559
    5    HG   LEU  72           HG       LEU  72   2.824 -16.854 -10.303
    6   HD11  LEU  72          HD11      LEU  72   1.330 -17.625  -7.802
    7   HD13  LEU  72          HD12      LEU  72   2.227 -18.657  -8.914
    8   HD12  LEU  72          HD13      LEU  72   0.667 -17.992  -9.395
    9   HD22  LEU  72          HD21      LEU  72   1.573 -14.895 -10.568
   10   HD21  LEU  72          HD22      LEU  72   0.944 -14.937  -8.929
   11   HD23  LEU  72          HD23      LEU  72   0.313 -16.046 -10.142

  No H/Q in entry =          11
  In of MODEL   47
    1    H    VAL  73           H        VAL  73   6.211 -15.645  -7.785
    2    HA   VAL  73           HA       VAL  73   6.145 -14.115  -5.451
    3    HB   VAL  73           HB       VAL  73   8.310 -14.923  -5.017
    4   HG11  VAL  73          HG11      VAL  73   6.435 -16.642  -5.427
    5   HG13  VAL  73          HG12      VAL  73   8.092 -17.247  -5.434
    6   HG12  VAL  73          HG13      VAL  73   7.244 -16.976  -6.956
    7   HG22  VAL  73          HG21      VAL  73   9.555 -14.145  -6.892
    8   HG21  VAL  73          HG22      VAL  73   8.562 -15.059  -8.027
    9   HG23  VAL  73          HG23      VAL  73   9.681 -15.902  -6.955

  No H/Q in entry =           9
  In of MODEL   47
    1    H    LEU  74           H        LEU  74   7.099 -13.204  -8.633
    2    HA   LEU  74           HA       LEU  74   9.019 -11.227  -8.153
    3    HB2  LEU  74           HB2      LEU  74   8.569 -11.972 -10.388
    4    HB3  LEU  74           HB3      LEU  74   6.889 -11.452 -10.277
    5    HG   LEU  74           HG       LEU  74   7.620  -9.105 -10.074
    6   HD12  LEU  74          HD11      LEU  74  10.108  -8.721 -10.648
    7   HD11  LEU  74          HD12      LEU  74  10.347 -10.401 -10.171
    8   HD13  LEU  74          HD13      LEU  74   9.737  -9.232  -9.002
    9   HD22  LEU  74          HD21      LEU  74   7.952  -8.868 -12.329
   10   HD21  LEU  74          HD22      LEU  74   7.441 -10.539 -12.273
   11   HD23  LEU  74          HD23      LEU  74   9.144 -10.165 -12.400

  No H/Q in entry =          11
  In of MODEL   47
    1    H    VAL  75           H        VAL  75   5.515 -10.894  -8.482
    2    HA   VAL  75           HA       VAL  75   5.383  -8.139  -7.892
    3    HB   VAL  75           HB       VAL  75   3.329 -10.316  -7.497
    4   HG12  VAL  75          HG11      VAL  75   1.715  -8.390  -7.367
    5   HG11  VAL  75          HG12      VAL  75   3.085  -7.289  -7.340
    6   HG13  VAL  75          HG13      VAL  75   2.839  -8.413  -6.011
    7   HG23  VAL  75          HG21      VAL  75   2.383  -9.176  -9.555
    8   HG22  VAL  75          HG22      VAL  75   3.919  -9.997  -9.821
    9   HG21  VAL  75          HG23      VAL  75   3.875  -8.242  -9.646

  No H/Q in entry =           9
  In of MODEL   47
    1    H    GLU  76           H        GLU  76   5.185 -11.022  -5.783
    2    HA   GLU  76           HA       GLU  76   4.711  -9.669  -3.358
    3    HB2  GLU  76           HB2      GLU  76   4.563 -12.133  -3.576
    4    HB3  GLU  76           HB3      GLU  76   6.294 -12.216  -3.856
    5    HG2  GLU  76           HG2      GLU  76   5.916 -12.803  -1.550
    6    HG3  GLU  76           HG3      GLU  76   6.642 -11.206  -1.554

  No H/Q in entry =           6
  In of MODEL   47
    1    H    ALA  77           H        ALA  77   7.774 -10.531  -4.941
    2    HA   ALA  77           HA       ALA  77   9.460  -9.464  -2.935
    3    HB3  ALA  77           HB1      ALA  77   9.848 -10.023  -5.870
    4    HB1  ALA  77           HB2      ALA  77  10.488 -10.912  -4.489
    5    HB2  ALA  77           HB3      ALA  77  11.130  -9.318  -4.886

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLN  78           H        GLN  78   8.030  -8.065  -5.839
    2    HA   GLN  78           HA       GLN  78   9.347  -5.567  -5.741
    3    HB2  GLN  78           HB2      GLN  78   8.023  -6.532  -7.678
    4    HB3  GLN  78           HB3      GLN  78   6.560  -6.098  -6.797
    5    HG2  GLN  78           HG2      GLN  78   7.216  -3.750  -6.790
    6    HG3  GLN  78           HG3      GLN  78   8.742  -4.147  -7.578
    7   HE21  GLN  78          HE21      GLN  78   7.682  -6.094  -9.464
    8   HE22  GLN  78          HE22      GLN  78   6.722  -5.246 -10.578

  No H/Q in entry =           8
  In of MODEL   47
    1    H    LEU  79           H        LEU  79   6.353  -6.748  -4.294
    2    HA   LEU  79           HA       LEU  79   5.332  -4.356  -3.276
    3    HB2  LEU  79           HB2      LEU  79   4.046  -6.426  -3.215
    4    HB3  LEU  79           HB3      LEU  79   5.208  -7.150  -2.107
    5    HG   LEU  79           HG       LEU  79   4.643  -5.517  -0.375
    6   HD13  LEU  79          HD11      LEU  79   4.143  -3.508  -1.421
    7   HD12  LEU  79          HD12      LEU  79   2.528  -4.057  -0.973
    8   HD11  LEU  79          HD13      LEU  79   3.102  -4.270  -2.625
    9   HD23  LEU  79          HD21      LEU  79   2.064  -6.045  -0.271
   10   HD22  LEU  79          HD22      LEU  79   3.223  -7.369  -0.170
   11   HD21  LEU  79          HD23      LEU  79   2.396  -7.042  -1.690

  No H/Q in entry =          11
  In of MODEL   47
    1    H    HIS  80           H        HIS  80   7.555  -6.662  -1.708
    2    HA   HIS  80           HA       HIS  80   7.835  -5.118   0.661
    3    HB2  HIS  80           HB2      HIS  80   9.199  -7.462  -0.548
    4    HB3  HIS  80           HB3      HIS  80  10.104  -6.554   0.665
    5    HD1  HIS  80           HD1      HIS  80   9.635  -7.199   3.010
    6    HD2  HIS  80           HD2      HIS  80   6.417  -8.091   0.515
    7    HE1  HIS  80           HE1      HIS  80   7.887  -8.327   4.467
    8    HE2  HIS  80           HE2      HIS  80   5.919  -8.875   2.954

  No H/Q in entry =           8
  In of MODEL   47
    1    H    LEU  81           H        LEU  81   9.828  -5.364  -2.263
    2    HA   LEU  81           HA       LEU  81  11.854  -3.597  -1.394
    3    HB2  LEU  81           HB2      LEU  81  10.929  -4.399  -4.153
    4    HB3  LEU  81           HB3      LEU  81  12.336  -3.374  -3.869
    5    HG   LEU  81           HG       LEU  81  11.987  -6.102  -2.596
    6   HD12  LEU  81          HD11      LEU  81  13.802  -6.702  -4.355
    7   HD11  LEU  81          HD12      LEU  81  13.213  -5.285  -5.223
    8   HD13  LEU  81          HD13      LEU  81  12.121  -6.624  -4.880
    9   HD23  LEU  81          HD21      LEU  81  14.611  -5.752  -2.595
   10   HD22  LEU  81          HD22      LEU  81  13.626  -5.005  -1.339
   11   HD21  LEU  81          HD23      LEU  81  14.184  -4.045  -2.708

  No H/Q in entry =          11
  In of MODEL   47
    1    H    MET  82           H        MET  82   8.913  -2.997  -3.315
    2    HA   MET  82           HA       MET  82   9.414  -0.264  -3.816
    3    HB2  MET  82           HB2      MET  82   6.876  -1.891  -3.679
    4    HB3  MET  82           HB3      MET  82   6.852  -0.167  -4.041
    5    HG2  MET  82           HG2      MET  82   8.471  -2.218  -5.587
    6    HG3  MET  82           HG3      MET  82   6.893  -1.616  -6.091
    7    HE3  MET  82           HE1      MET  82   7.291   1.846  -7.262
    8    HE2  MET  82           HE2      MET  82   6.928   1.613  -5.554
    9    HE1  MET  82           HE3      MET  82   6.271   0.496  -6.746

  No H/Q in entry =           9
  In of MODEL   47
    1    H    THR  83           H        THR  83   7.657  -1.887  -1.203
    2    HA   THR  83           HA       THR  83   6.783   0.449   0.130
    3    HB   THR  83           HB       THR  83   6.679  -1.129   2.147
    4    HG1  THR  83           HG1      THR  83   7.459  -3.069   1.912
    5   HG22  THR  83          HG21      THR  83   5.038  -2.715   0.687
    6   HG21  THR  83          HG22      THR  83   5.242  -1.382  -0.446
    7   HG23  THR  83          HG23      THR  83   4.606  -1.077   1.171

  No H/Q in entry =           7
  In of MODEL   47
    1    H    SER  84           H        SER  84   9.635  -1.614   0.634
    2    HA   SER  84           HA       SER  84  10.688  -0.172   2.818
    3    HB2  SER  84           HB2      SER  84  11.954  -1.997   0.785
    4    HB3  SER  84           HB3      SER  84  12.897  -1.233   2.063
    5    HG   SER  84           HG       SER  84  10.645  -2.951   2.332

  No H/Q in entry =           5
  In of MODEL   47
    1    H    MET  85           H        MET  85  11.420   0.101  -0.673
    2    HA   MET  85           HA       MET  85  13.395   2.091  -0.431
    3    HB2  MET  85           HB2      MET  85  12.904   0.753  -2.491
    4    HB3  MET  85           HB3      MET  85  11.470   1.752  -2.736
    5    HG2  MET  85           HG2      MET  85  13.160   3.751  -2.493
    6    HG3  MET  85           HG3      MET  85  14.365   2.532  -2.901
    7    HE2  MET  85           HE1      MET  85  11.570   0.926  -4.697
    8    HE1  MET  85           HE2      MET  85  13.289   0.582  -4.531
    9    HE3  MET  85           HE3      MET  85  12.633   0.990  -6.111

  No H/Q in entry =           9
  In of MODEL   47
    1    H    LEU  86           H        LEU  86   9.899   2.383  -0.921
    2    HA   LEU  86           HA       LEU  86   9.800   5.195  -1.100
    3    HB2  LEU  86           HB2      LEU  86   7.973   3.514  -1.668
    4    HB3  LEU  86           HB3      LEU  86   7.653   3.419   0.063
    5    HG   LEU  86           HG       LEU  86   7.461   5.977   0.014
    6   HD11  LEU  86          HD11      LEU  86   8.228   5.553  -2.692
    7   HD13  LEU  86          HD12      LEU  86   7.777   7.075  -1.928
    8   HD12  LEU  86          HD13      LEU  86   6.549   6.098  -2.728
    9   HD23  LEU  86          HD21      LEU  86   5.335   4.601  -1.639
   10   HD22  LEU  86          HD22      LEU  86   5.136   5.857  -0.420
   11   HD21  LEU  86          HD23      LEU  86   5.558   4.217   0.069

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ALA  87           H        ALA  87   9.374   3.009   1.646
    2    HA   ALA  87           HA       ALA  87   8.813   4.915   3.620
    3    HB1  ALA  87           HB1      ALA  87   9.653   2.105   3.527
    4    HB3  ALA  87           HB2      ALA  87   8.524   2.902   4.619
    5    HB2  ALA  87           HB3      ALA  87  10.254   2.954   4.954

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ARG  88           H        ARG  88  11.908   3.528   2.622
    2    HA   ARG  88           HA       ARG  88  13.511   4.923   4.447
    3    HB2  ARG  88           HB2      ARG  88  14.195   2.959   3.038
    4    HB3  ARG  88           HB3      ARG  88  14.327   4.055   1.666
    5    HG2  ARG  88           HG2      ARG  88  15.795   5.385   3.605
    6    HG3  ARG  88           HG3      ARG  88  16.138   3.699   3.981
    7    HD2  ARG  88           HD2      ARG  88  17.398   3.419   2.127
    8    HD3  ARG  88           HD3      ARG  88  16.246   4.278   1.101
    9    HE   ARG  88           HE       ARG  88  18.633   5.369   2.136
   10   HH21  ARG  88          HH11      ARG  88  18.951   7.592   1.942
   11   HH22  ARG  88          HH12      ARG  88  17.587   8.647   1.807
   12   HH11  ARG  88          HH21      ARG  88  15.284   6.082   1.877
   13   HH12  ARG  88          HH22      ARG  88  15.509   7.790   1.746

  No H/Q in entry =          13
  In of MODEL   47
    1    H    GLU  89           H        GLU  89  12.509   5.813   1.130
    2    HA   GLU  89           HA       GLU  89  14.027   8.191   0.967
    3    HB2  GLU  89           HB2      GLU  89  12.884   7.138  -0.975
    4    HB3  GLU  89           HB3      GLU  89  11.337   7.660  -0.309
    5    HG2  GLU  89           HG2      GLU  89  12.010  10.006  -0.473
    6    HG3  GLU  89           HG3      GLU  89  13.617   9.535  -1.019

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LEU  90           H        LEU  90  10.710   7.641   2.115
    2    HA   LEU  90           HA       LEU  90  10.166  10.368   2.695
    3    HB2  LEU  90           HB2      LEU  90   9.007   7.779   3.726
    4    HB3  LEU  90           HB3      LEU  90   8.360   9.367   4.154
    5    HG   LEU  90           HG       LEU  90   8.773   8.494   1.282
    6   HD12  LEU  90          HD11      LEU  90   6.243   8.135   1.358
    7   HD11  LEU  90          HD12      LEU  90   6.408   8.125   3.114
    8   HD13  LEU  90          HD13      LEU  90   7.236   6.906   2.144
    9   HD22  LEU  90          HD21      LEU  90   8.451  10.799   1.212
   10   HD21  LEU  90          HD22      LEU  90   7.472  10.818   2.678
   11   HD23  LEU  90          HD23      LEU  90   6.773  10.256   1.160

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  91           H        ILE  91  11.471   7.700   4.608
    2    HA   ILE  91           HA       ILE  91  11.609   9.064   7.077
    3    HB   ILE  91           HB       ILE  91  13.184   6.745   5.942
    4   HG12  ILE  91          HG12      ILE  91  11.179   6.887   8.213
    5   HG13  ILE  91          HG13      ILE  91  10.702   6.602   6.540
    6   HG22  ILE  91          HG21      ILE  91  13.671   6.535   8.580
    7   HG21  ILE  91          HG22      ILE  91  13.574   8.293   8.481
    8   HG23  ILE  91          HG23      ILE  91  14.758   7.420   7.509
    9   HD13  ILE  91          HD11      ILE  91  11.729   4.512   6.462
   10   HD12  ILE  91          HD12      ILE  91  11.145   4.562   8.125
   11   HD11  ILE  91          HD13      ILE  91  12.841   4.895   7.778

  No H/Q in entry =          11
  In of MODEL   47
    1    H    THR  92           H        THR  92  13.812   8.924   4.312
    2    HA   THR  92           HA       THR  92  15.967  10.341   5.461
    3    HB   THR  92           HB       THR  92  14.967  10.207   2.606
    4    HG1  THR  92           HG1      THR  92  15.823   8.320   3.004
    5   HG22  THR  92          HG21      THR  92  17.527  10.928   2.298
    6   HG21  THR  92          HG22      THR  92  17.217  11.744   3.830
    7   HG23  THR  92          HG23      THR  92  16.235  12.122   2.415

  No H/Q in entry =           7
  In of MODEL   47
    1    H    GLU  93           H        GLU  93  13.057  11.462   3.749
    2    HA   GLU  93           HA       GLU  93  13.619  14.230   3.863
    3    HB2  GLU  93           HB2      GLU  93  10.932  12.825   3.891
    4    HB3  GLU  93           HB3      GLU  93  11.197  14.528   3.519
    5    HG2  GLU  93           HG2      GLU  93  12.553  12.303   1.982
    6    HG3  GLU  93           HG3      GLU  93  10.996  12.968   1.504

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LEU  94           H        LEU  94  11.915  12.051   6.082
    2    HA   LEU  94           HA       LEU  94  11.093  13.986   7.964
    3    HB2  LEU  94           HB2      LEU  94  11.706  11.037   8.232
    4    HB3  LEU  94           HB3      LEU  94  11.130  12.005   9.587
    5    HG   LEU  94           HG       LEU  94   9.631  12.041   6.967
    6   HD11  LEU  94          HD11      LEU  94   9.752   9.820   8.968
    7   HD13  LEU  94          HD12      LEU  94   9.441   9.756   7.235
    8   HD12  LEU  94          HD13      LEU  94   8.163  10.257   8.341
    9   HD23  LEU  94          HD21      LEU  94   7.716  12.417   8.578
   10   HD22  LEU  94          HD22      LEU  94   8.940  13.685   8.609
   11   HD21  LEU  94          HD23      LEU  94   8.899  12.467   9.883

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  95           H        ILE  95  14.089  12.092   7.709
    2    HA   ILE  95           HA       ILE  95  15.259  13.026  10.116
    3    HB   ILE  95           HB       ILE  95  16.496  11.974   7.560
    4   HG12  ILE  95          HG12      ILE  95  16.231  10.767  10.328
    5   HG13  ILE  95          HG13      ILE  95  15.059  10.496   9.040
    6   HG21  ILE  95          HG21      ILE  95  17.757  12.793  10.196
    7   HG23  ILE  95          HG22      ILE  95  18.204  13.328   8.574
    8   HG22  ILE  95          HG23      ILE  95  18.533  11.672   9.079
    9   HD13  ILE  95          HD11      ILE  95  16.547   9.236   7.767
   10   HD12  ILE  95          HD12      ILE  95  17.035   8.792   9.400
   11   HD11  ILE  95          HD13      ILE  95  17.969   9.983   8.496

  No H/Q in entry =          11
  In of MODEL   47
    1    H    GLU  96           H        GLU  96  15.379  14.264   6.782
    2    HA   GLU  96           HA       GLU  96  17.204  16.364   7.250
    3    HB2  GLU  96           HB2      GLU  96  16.534  15.696   4.995
    4    HB3  GLU  96           HB3      GLU  96  14.886  16.233   5.305
    5    HG2  GLU  96           HG2      GLU  96  15.424  18.369   4.762
    6    HG3  GLU  96           HG3      GLU  96  16.729  18.384   5.936

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LEU  97           H        LEU  97  13.698  16.135   7.700
    2    HA   LEU  97           HA       LEU  97  13.253  18.863   8.347
    3    HB2  LEU  97           HB2      LEU  97  11.768  16.319   8.968
    4    HB3  LEU  97           HB3      LEU  97  11.241  17.859   9.644
    5    HG   LEU  97           HG       LEU  97  11.711  17.451   6.676
    6   HD12  LEU  97          HD11      LEU  97   9.189  17.294   6.573
    7   HD11  LEU  97          HD12      LEU  97   9.195  17.092   8.323
    8   HD13  LEU  97          HD13      LEU  97   9.984  15.895   7.295
    9   HD23  LEU  97          HD21      LEU  97   9.950  19.395   6.721
   10   HD22  LEU  97          HD22      LEU  97  11.629  19.774   7.103
   11   HD21  LEU  97          HD23      LEU  97  10.450  19.588   8.400

  No H/Q in entry =          11
  In of MODEL   47
    1    H    HIS  98           H        HIS  98  14.120  16.045  10.335
    2    HA   HIS  98           HA       HIS  98  13.962  17.301  12.853
    3    HB2  HIS  98           HB2      HIS  98  15.732  15.066  11.839
    4    HB3  HIS  98           HB3      HIS  98  15.735  15.603  13.521
    5    HD1  HIS  98           HD1      HIS  98  13.539  13.950  10.940
    6    HD2  HIS  98           HD2      HIS  98  13.446  14.864  15.006
    7    HE1  HIS  98           HE1      HIS  98  11.534  12.730  11.904
    8    HE2  HIS  98           HE2      HIS  98  11.458  13.279  14.376

  No H/Q in entry =           8
  In of MODEL   47
    1    H    GLU  99           H        GLU  99  16.502  17.219  10.403
    2    HA   GLU  99           HA       GLU  99  18.481  18.572  11.922
    3    HB2  GLU  99           HB2      GLU  99  18.963  17.292   9.848
    4    HB3  GLU  99           HB3      GLU  99  18.133  18.538   8.914
    5    HG2  GLU  99           HG2      GLU  99  19.726  20.227   9.696
    6    HG3  GLU  99           HG3      GLU  99  20.525  19.033  10.713

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LYS 100           H        LYS 100  15.930  19.707   9.722
    2    HA   LYS 100           HA       LYS 100  16.697  22.453   9.864
    3    HB2  LYS 100           HB2      LYS 100  14.075  21.135   9.124
    4    HB3  LYS 100           HB3      LYS 100  14.354  22.877   9.033
    5    HG2  LYS 100           HG2      LYS 100  16.322  22.452   7.554
    6    HG3  LYS 100           HG3      LYS 100  15.928  20.730   7.573
    7    HD2  LYS 100           HD2      LYS 100  13.721  21.216   6.586
    8    HD3  LYS 100           HD3      LYS 100  14.098  22.939   6.575
    9    HE2  LYS 100           HE2      LYS 100  16.054  22.483   5.103
   10    HE3  LYS 100           HE3      LYS 100  15.607  20.773   5.071
   11    HZ1  LYS 100           HZ1      LYS 100  13.753  22.945   4.249
   12    HZ3  LYS 100           HZ2      LYS 100  13.586  21.274   3.987
   13    HZ2  LYS 100           HZ3      LYS 100  14.782  22.151   3.159

  No H/Q in entry =          13
  In of MODEL   47
    1    H    LEU 101           H        LEU 101  14.635  20.381  11.840
    2    HA   LEU 101           HA       LEU 101  13.455  22.434  13.427
    3    HB2  LEU 101           HB2      LEU 101  13.933  19.490  13.805
    4    HB3  LEU 101           HB3      LEU 101  13.394  20.462  15.170
    5    HG   LEU 101           HG       LEU 101  11.959  20.538  12.510
    6   HD12  LEU 101          HD11      LEU 101  10.325  18.954  13.787
    7   HD11  LEU 101          HD12      LEU 101  11.730  18.556  14.773
    8   HD13  LEU 101          HD13      LEU 101  11.757  18.251  13.036
    9   HD21  LEU 101          HD21      LEU 101  11.311  21.320  15.367
   10   HD23  LEU 101          HD22      LEU 101  10.045  21.082  14.164
   11   HD22  LEU 101          HD23      LEU 101  11.264  22.331  13.920

  No H/Q in entry =          11
  In of MODEL   47
    1    H    LYS 102           H        LYS 102  16.607  21.862  12.971
    2    HA   LYS 102           HA       LYS 102  18.450  22.753  14.033
    3    HB2  LYS 102           HB2      LYS 102  16.626  24.246  15.179
    4    HB3  LYS 102           HB3      LYS 102  16.853  23.184  16.554
    5    HG2  LYS 102           HG2      LYS 102  18.717  25.218  15.375
    6    HG3  LYS 102           HG3      LYS 102  18.349  24.897  17.056
    7    HD2  LYS 102           HD2      LYS 102  20.026  23.005  15.358
    8    HD3  LYS 102           HD3      LYS 102  20.707  24.334  16.288
    9    HE2  LYS 102           HE2      LYS 102  20.343  21.780  17.256
   10    HE3  LYS 102           HE3      LYS 102  20.551  23.223  18.247
   11    HZ2  LYS 102           HZ1      LYS 102  18.601  21.917  18.876
   12    HZ1  LYS 102           HZ2      LYS 102  17.945  22.141  17.331
   13    HZ3  LYS 102           HZ3      LYS 102  18.167  23.472  18.357

  No H/Q in entry =          13
  In of MODEL   47
    1    H    ALA 103           H        ALA 103  16.411  21.122  16.466
    2    HA   ALA 103           HA       ALA 103  18.162  19.928  18.108
    3    HB2  ALA 103           HB1      ALA 103  16.599  17.903  18.110
    4    HB1  ALA 103           HB2      ALA 103  15.687  18.748  16.859
    5    HB3  ALA 103           HB3      ALA 103  15.867  19.469  18.457

  No H/Q in entry =           5
  In of MODEL   47
    1    H1   ALA   1           H3       ALA   1  -1.716  -7.098 -21.421
    2    H2   ALA   1           H2       ALA   1  -2.493  -8.542 -20.964
    3    H3   ALA   1           H1       ALA   1  -0.888  -8.574 -21.529
    4    HA   ALA   1           HA       ALA   1  -1.729  -9.050 -23.521
    5    HB1  ALA   1           HB1      ALA   1  -3.855  -9.791 -23.035
    6    HB2  ALA   1           HB2      ALA   1  -4.315  -8.284 -23.828
    7    HB3  ALA   1           HB3      ALA   1  -4.243  -8.366 -22.070

  No H/Q in entry =           7
  In of MODEL   47
    1    H    GLU   2           H        GLU   2  -2.583  -7.866 -25.504
    2    HA   GLU   2           HA       GLU   2  -1.211  -5.836 -26.387
    3    HB2  GLU   2           HB2      GLU   2  -4.219  -5.934 -26.687
    4    HB3  GLU   2           HB3      GLU   2  -3.114  -5.059 -27.742
    5    HG2  GLU   2           HG2      GLU   2  -2.598  -6.941 -28.902
    6    HG3  GLU   2           HG3      GLU   2  -2.282  -7.846 -27.428

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLU   3           H        GLU   3  -4.379  -4.614 -25.466
    2    HA   GLU   3           HA       GLU   3  -3.356  -2.048 -24.841
    3    HB2  GLU   3           HB2      GLU   3  -6.028  -3.391 -24.495
    4    HB3  GLU   3           HB3      GLU   3  -5.743  -1.773 -23.848
    5    HG2  GLU   3           HG2      GLU   3  -5.409  -0.840 -25.975
    6    HG3  GLU   3           HG3      GLU   3  -5.002  -2.390 -26.704

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LEU   4           H        LEU   4  -4.908  -4.426 -22.655
    2    HA   LEU   4           HA       LEU   4  -4.543  -3.197 -20.264
    3    HB2  LEU   4           HB2      LEU   4  -3.972  -6.132 -20.741
    4    HB3  LEU   4           HB3      LEU   4  -4.376  -5.392 -19.194
    5    HG   LEU   4           HG       LEU   4  -6.163  -5.481 -21.648
    6   HD13  LEU   4          HD11      LEU   4  -7.332  -7.212 -20.645
    7   HD12  LEU   4          HD12      LEU   4  -6.842  -6.750 -19.016
    8   HD11  LEU   4          HD13      LEU   4  -5.704  -7.579 -20.075
    9   HD23  LEU   4          HD21      LEU   4  -7.844  -4.690 -19.769
   10   HD22  LEU   4          HD22      LEU   4  -6.823  -3.507 -20.584
   11   HD21  LEU   4          HD23      LEU   4  -6.381  -4.095 -18.981

  No H/Q in entry =          11
  In of MODEL   47
    1    H    GLU   5           H        GLU   5  -2.036  -5.012 -22.013
    2    HA   GLU   5           HA       GLU   5  -0.043  -4.710 -19.987
    3    HB2  GLU   5           HB2      GLU   5   0.017  -6.473 -21.756
    4    HB3  GLU   5           HB3      GLU   5   0.340  -5.217 -22.951
    5    HG2  GLU   5           HG2      GLU   5   2.458  -6.175 -22.302
    6    HG3  GLU   5           HG3      GLU   5   2.365  -4.561 -21.597

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLU   6           H        GLU   6  -0.714  -2.999 -23.026
    2    HA   GLU   6           HA       GLU   6   1.438  -1.145 -22.768
    3    HB2  GLU   6           HB2      GLU   6   0.328  -1.620 -24.927
    4    HB3  GLU   6           HB3      GLU   6  -1.153  -0.885 -24.315
    5    HG2  GLU   6           HG2      GLU   6   0.000   1.256 -24.021
    6    HG3  GLU   6           HG3      GLU   6   1.514   0.534 -24.558

  No H/Q in entry =           6
  In of MODEL   47
    1    H    VAL   7           H        VAL   7  -1.893  -1.253 -21.704
    2    HA   VAL   7           HA       VAL   7  -2.138   1.456 -20.862
    3    HB   VAL   7           HB       VAL   7  -3.569  -1.078 -20.021
    4   HG11  VAL   7          HG11      VAL   7  -3.969   1.806 -19.200
    5   HG13  VAL   7          HG12      VAL   7  -3.848   0.381 -18.168
    6   HG12  VAL   7          HG13      VAL   7  -5.289   0.637 -19.151
    7   HG21  VAL   7          HG21      VAL   7  -3.751   0.000 -22.406
    8   HG23  VAL   7          HG22      VAL   7  -4.705   1.238 -21.587
    9   HG22  VAL   7          HG23      VAL   7  -5.232  -0.445 -21.560

  No H/Q in entry =           9
  In of MODEL   47
    1    H    VAL   8           H        VAL   8  -1.109  -1.521 -19.229
    2    HA   VAL   8           HA       VAL   8  -0.787  -0.441 -16.634
    3    HB   VAL   8           HB       VAL   8   0.514  -2.775 -18.045
    4   HG12  VAL   8          HG11      VAL   8   1.220  -3.381 -15.634
    5   HG11  VAL   8          HG12      VAL   8   0.960  -1.676 -15.266
    6   HG13  VAL   8          HG13      VAL   8   2.164  -2.146 -16.465
    7   HG23  VAL   8          HG21      VAL   8  -0.975  -3.537 -15.738
    8   HG22  VAL   8          HG22      VAL   8  -1.426  -3.783 -17.423
    9   HG21  VAL   8          HG23      VAL   8  -1.962  -2.339 -16.572

  No H/Q in entry =           9
  In of MODEL   47
    1    H    MET   9           H        MET   9   1.449  -0.715 -19.395
    2    HA   MET   9           HA       MET   9   3.731   0.349 -18.146
    3    HB2  MET   9           HB2      MET   9   2.760   0.315 -20.995
    4    HB3  MET   9           HB3      MET   9   4.232   1.180 -20.558
    5    HG2  MET   9           HG2      MET   9   4.948  -1.006 -19.385
    6    HG3  MET   9           HG3      MET   9   3.651  -1.771 -20.306
    7    HE3  MET   9           HE1      MET   9   4.592  -1.781 -23.852
    8    HE2  MET   9           HE2      MET   9   3.576  -0.504 -23.189
    9    HE1  MET   9           HE3      MET   9   3.459  -2.138 -22.543

  No H/Q in entry =           9
  In of MODEL   47
    1    H    GLY  10           H        GLY  10   1.021   1.927 -19.805
    2    HA3  GLY  10           HA2      GLY  10   1.960   4.589 -19.562
    3    HA2  GLY  10           HA3      GLY  10   0.274   4.113 -19.757

  No H/Q in entry =           3
  In of MODEL   47
    1    H    LEU  11           H        LEU  11  -0.096   2.579 -17.471
    2    HA   LEU  11           HA       LEU  11  -0.633   4.548 -15.505
    3    HB2  LEU  11           HB2      LEU  11  -0.536   1.533 -15.354
    4    HB3  LEU  11           HB3      LEU  11  -1.046   2.549 -14.007
    5    HG   LEU  11           HG       LEU  11  -2.303   2.655 -16.762
    6   HD13  LEU  11          HD11      LEU  11  -2.862   0.505 -16.007
    7   HD12  LEU  11          HD12      LEU  11  -4.218   1.484 -15.451
    8   HD11  LEU  11          HD13      LEU  11  -2.951   1.013 -14.320
    9   HD22  LEU  11          HD21      LEU  11  -2.906   4.664 -15.748
   10   HD21  LEU  11          HD22      LEU  11  -2.815   3.996 -14.119
   11   HD23  LEU  11          HD23      LEU  11  -4.193   3.619 -15.153

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  12           H        ILE  12   1.931   2.106 -15.768
    2    HA   ILE  12           HA       ILE  12   3.148   2.650 -13.271
    3    HB   ILE  12           HB       ILE  12   4.395   1.626 -15.843
    4   HG12  ILE  12          HG12      ILE  12   2.401   0.374 -14.687
    5   HG13  ILE  12          HG13      ILE  12   3.805  -0.548 -15.186
    6   HG22  ILE  12          HG21      ILE  12   6.099   0.623 -14.285
    7   HG21  ILE  12          HG22      ILE  12   5.389   1.564 -12.974
    8   HG23  ILE  12          HG23      ILE  12   6.140   2.384 -14.341
    9   HD12  ILE  12          HD11      ILE  12   2.959  -1.092 -12.887
   10   HD11  ILE  12          HD12      ILE  12   3.367   0.551 -12.397
   11   HD13  ILE  12          HD13      ILE  12   4.628  -0.552 -12.907

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  13           H        ILE  13   3.716   3.924 -16.530
    2    HA   ILE  13           HA       ILE  13   5.843   5.662 -15.816
    3    HB   ILE  13           HB       ILE  13   3.796   5.730 -18.048
    4   HG12  ILE  13          HG12      ILE  13   5.617   3.891 -17.809
    5   HG13  ILE  13          HG13      ILE  13   5.413   4.674 -19.372
    6   HG22  ILE  13          HG21      ILE  13   5.631   7.296 -19.098
    7   HG21  ILE  13          HG22      ILE  13   6.050   7.630 -17.422
    8   HG23  ILE  13          HG23      ILE  13   4.426   7.984 -18.009
    9   HD13  ILE  13          HD11      ILE  13   7.452   5.764 -19.238
   10   HD12  ILE  13          HD12      ILE  13   7.819   4.399 -18.190
   11   HD11  ILE  13          HD13      ILE  13   7.340   5.940 -17.487

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ASN  14           H        ASN  14   2.330   6.126 -16.060
    2    HA   ASN  14           HA       ASN  14   2.267   8.870 -15.419
    3    HB2  ASN  14           HB2      ASN  14   0.383   7.212 -16.239
    4    HB3  ASN  14           HB3      ASN  14   0.075   7.028 -14.517
    5   HD21  ASN  14          HD21      ASN  14  -1.965   8.168 -15.934
    6   HD22  ASN  14          HD22      ASN  14  -2.041   9.840 -15.663

  No H/Q in entry =           6
  In of MODEL   47
    1    H    SER  15           H        SER  15   2.012   5.988 -13.345
    2    HA   SER  15           HA       SER  15   1.709   7.351 -10.892
    3    HB2  SER  15           HB2      SER  15   2.275   5.270  -9.851
    4    HB3  SER  15           HB3      SER  15   1.454   4.842 -11.346
    5    HG   SER  15           HG       SER  15   4.006   4.364 -10.570

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLY  16           H        GLY  16   4.583   6.284 -12.672
    2    HA3  GLY  16           HA2      GLY  16   6.514   7.056 -10.753
    3    HA2  GLY  16           HA3      GLY  16   6.807   6.859 -12.479

  No H/Q in entry =           3
  In of MODEL   47
    1    H    GLN  17           H        GLN  17   5.092   8.802 -13.527
    2    HA   GLN  17           HA       GLN  17   6.648  11.158 -13.226
    3    HB2  GLN  17           HB2      GLN  17   5.333  10.688 -15.263
    4    HB3  GLN  17           HB3      GLN  17   3.840  10.851 -14.336
    5    HG2  GLN  17           HG2      GLN  17   4.406  13.186 -13.808
    6    HG3  GLN  17           HG3      GLN  17   5.915  13.030 -14.707
    7   HE21  GLN  17          HE21      GLN  17   3.944  14.965 -15.461
    8   HE22  GLN  17          HE22      GLN  17   3.299  14.509 -16.963

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ALA  18           H        ALA  18   3.567  10.108 -11.858
    2    HA   ALA  18           HA       ALA  18   2.826  12.487 -10.584
    3    HB1  ALA  18           HB1      ALA  18   1.721  10.019 -10.802
    4    HB2  ALA  18           HB2      ALA  18   1.168  11.232  -9.650
    5    HB3  ALA  18           HB3      ALA  18   2.274   9.960  -9.129

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ARG  19           H        ARG  19   4.737   9.742  -9.321
    2    HA   ARG  19           HA       ARG  19   5.274  10.901  -6.801
    3    HB2  ARG  19           HB2      ARG  19   5.710   8.504  -7.335
    4    HB3  ARG  19           HB3      ARG  19   7.054   9.005  -8.364
    5    HG2  ARG  19           HG2      ARG  19   8.175  10.054  -6.448
    6    HG3  ARG  19           HG3      ARG  19   6.811   9.650  -5.407
    7    HD2  ARG  19           HD2      ARG  19   8.592   8.033  -5.064
    8    HD3  ARG  19           HD3      ARG  19   7.221   7.238  -5.842
    9    HE   ARG  19           HE       ARG  19   8.903   8.077  -7.899
   10   HH21  ARG  19          HH11      ARG  19  10.473   6.690  -8.762
   11   HH22  ARG  19          HH12      ARG  19  11.039   5.347  -7.832
   12   HH11  ARG  19          HH21      ARG  19   9.016   6.044  -5.124
   13   HH12  ARG  19          HH22      ARG  19  10.211   4.981  -5.771

  No H/Q in entry =          13
  In of MODEL   47
    1    H    SER  20           H        SER  20   7.071  10.955  -9.862
    2    HA   SER  20           HA       SER  20   9.306  12.394  -9.051
    3    HB2  SER  20           HB2      SER  20   9.337  11.525 -11.255
    4    HB3  SER  20           HB3      SER  20   7.821  12.316 -11.672
    5    HG   SER  20           HG       SER  20   8.883  14.300 -11.556

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU  21           H        LEU  21   6.185  13.630 -10.226
    2    HA   LEU  21           HA       LEU  21   6.826  16.383 -10.002
    3    HB2  LEU  21           HB2      LEU  21   4.173  14.931  -9.903
    4    HB3  LEU  21           HB3      LEU  21   4.323  16.686  -9.912
    5    HG   LEU  21           HG       LEU  21   5.520  14.898 -12.048
    6   HD11  LEU  21          HD11      LEU  21   2.860  16.347 -11.937
    7   HD13  LEU  21          HD12      LEU  21   3.135  14.619 -12.172
    8   HD12  LEU  21          HD13      LEU  21   3.583  15.763 -13.437
    9   HD21  LEU  21          HD21      LEU  21   5.286  17.867 -11.614
   10   HD23  LEU  21          HD22      LEU  21   5.249  17.263 -13.267
   11   HD22  LEU  21          HD23      LEU  21   6.648  16.951 -12.253

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ALA  22           H        ALA  22   5.355  14.073  -7.747
    2    HA   ALA  22           HA       ALA  22   4.745  15.870  -5.673
    3    HB3  ALA  22           HB1      ALA  22   4.011  13.470  -5.835
    4    HB2  ALA  22           HB2      ALA  22   4.604  13.946  -4.243
    5    HB1  ALA  22           HB3      ALA  22   5.632  13.001  -5.323

  No H/Q in entry =           5
  In of MODEL   47
    1    H    TYR  23           H        TYR  23   7.700  13.881  -6.134
    2    HA   TYR  23           HA       TYR  23   9.085  14.913  -3.889
    3    HB2  TYR  23           HB2      TYR  23   9.890  12.918  -5.053
    4    HB3  TYR  23           HB3      TYR  23  10.178  13.858  -6.516
    5    HD1  TYR  23           HD1      TYR  23  11.160  13.583  -2.919
    6    HD2  TYR  23           HD2      TYR  23  12.213  15.010  -6.834
    7    HE1  TYR  23           HE1      TYR  23  13.419  14.191  -2.092
    8    HE2  TYR  23           HE2      TYR  23  14.469  15.619  -6.005
    9    HH   TYR  23           HH       TYR  23  15.356  15.157  -2.582

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ALA  24           H        ALA  24   8.866  16.022  -7.253
    2    HA   ALA  24           HA       ALA  24  10.737  18.131  -7.016
    3    HB2  ALA  24           HB1      ALA  24  10.279  18.190  -9.222
    4    HB3  ALA  24           HB2      ALA  24   8.717  18.920  -8.851
    5    HB1  ALA  24           HB3      ALA  24   8.864  17.169  -8.984

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA  25           H        ALA  25   7.265  17.901  -6.372
    2    HA   ALA  25           HA       ALA  25   6.754  20.612  -5.796
    3    HB1  ALA  25           HB1      ALA  25   5.118  18.592  -5.989
    4    HB2  ALA  25           HB2      ALA  25   4.741  19.875  -4.836
    5    HB3  ALA  25           HB3      ALA  25   5.454  18.362  -4.272

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU  26           H        LEU  26   7.871  17.944  -3.757
    2    HA   LEU  26           HA       LEU  26   7.974  19.373  -1.319
    3    HB2  LEU  26           HB2      LEU  26   8.101  16.958  -1.317
    4    HB3  LEU  26           HB3      LEU  26   9.564  16.987  -2.298
    5    HG   LEU  26           HG       LEU  26  10.776  18.119  -0.464
    6   HD12  LEU  26          HD11      LEU  26   9.565  18.107   1.804
    7   HD11  LEU  26          HD12      LEU  26   8.074  17.950   0.879
    8   HD13  LEU  26          HD13      LEU  26   9.098  19.370   0.665
    9   HD21  LEU  26          HD21      LEU  26   9.282  15.629   0.416
   10   HD23  LEU  26          HD22      LEU  26  10.795  16.211   1.104
   11   HD22  LEU  26          HD23      LEU  26  10.746  15.654  -0.567

  No H/Q in entry =          11
  In of MODEL   47
    1    H    LYS  27           H        LYS  27  10.381  18.837  -3.860
    2    HA   LYS  27           HA       LYS  27  12.556  20.106  -2.645
    3    HB2  LYS  27           HB2      LYS  27  12.662  18.763  -4.738
    4    HB3  LYS  27           HB3      LYS  27  11.872  20.085  -5.596
    5    HG2  LYS  27           HG2      LYS  27  13.721  21.596  -5.029
    6    HG3  LYS  27           HG3      LYS  27  14.505  20.313  -4.099
    7    HD2  LYS  27           HD2      LYS  27  14.654  18.930  -6.156
    8    HD3  LYS  27           HD3      LYS  27  13.914  20.239  -7.078
    9    HE2  LYS  27           HE2      LYS  27  15.785  21.731  -6.476
   10    HE3  LYS  27           HE3      LYS  27  16.529  20.426  -5.545
   11    HZ3  LYS  27           HZ1      LYS  27  17.503  20.542  -7.738
   12    HZ2  LYS  27           HZ2      LYS  27  15.973  20.403  -8.469
   13    HZ1  LYS  27           HZ3      LYS  27  16.620  19.101  -7.590

  No H/Q in entry =          13
  In of MODEL   47
    1    H    GLN  28           H        GLN  28   9.901  21.453  -4.575
    2    HA   GLN  28           HA       GLN  28  10.821  24.119  -4.731
    3    HB2  GLN  28           HB2      GLN  28   8.005  23.008  -4.601
    4    HB3  GLN  28           HB3      GLN  28   8.392  24.687  -4.977
    5    HG2  GLN  28           HG2      GLN  28   9.401  22.286  -6.530
    6    HG3  GLN  28           HG3      GLN  28   8.059  23.316  -7.028
    7   HE21  GLN  28          HE21      GLN  28  11.215  22.839  -7.744
    8   HE22  GLN  28          HE22      GLN  28  11.684  24.426  -8.123

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ALA  29           H        ALA  29   8.930  22.396  -2.284
    2    HA   ALA  29           HA       ALA  29   8.361  24.578  -0.595
    3    HB2  ALA  29           HB1      ALA  29   7.665  22.997   0.976
    4    HB1  ALA  29           HB2      ALA  29   8.901  21.832   0.501
    5    HB3  ALA  29           HB3      ALA  29   7.503  22.106  -0.537

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LYS  30           H        LYS  30  11.123  22.351  -0.686
    2    HA   LYS  30           HA       LYS  30  12.443  23.322   1.609
    3    HB2  LYS  30           HB2      LYS  30  13.541  22.054  -0.911
    4    HB3  LYS  30           HB3      LYS  30  14.528  22.426   0.505
    5    HG2  LYS  30           HG2      LYS  30  13.004  21.019   1.893
    6    HG3  LYS  30           HG3      LYS  30  12.115  20.586   0.429
    7    HD2  LYS  30           HD2      LYS  30  14.168  19.631  -0.547
    8    HD3  LYS  30           HD3      LYS  30  15.075  20.078   0.899
    9    HE2  LYS  30           HE2      LYS  30  13.601  18.623   2.262
   10    HE3  LYS  30           HE3      LYS  30  12.723  18.157   0.799
   11    HZ2  LYS  30           HZ1      LYS  30  14.543  16.604   1.546
   12    HZ1  LYS  30           HZ2      LYS  30  15.660  17.808   1.088
   13    HZ3  LYS  30           HZ3      LYS  30  14.626  17.111  -0.070

  No H/Q in entry =          13
  In of MODEL   47
    1    H    GLN  31           H        GLN  31  12.294  24.528  -1.686
    2    HA   GLN  31           HA       GLN  31  14.422  26.452  -1.276
    3    HB2  GLN  31           HB2      GLN  31  12.363  26.472  -3.487
    4    HB3  GLN  31           HB3      GLN  31  13.972  27.191  -3.498
    5    HG2  GLN  31           HG2      GLN  31  14.478  24.501  -2.929
    6    HG3  GLN  31           HG3      GLN  31  13.167  24.430  -4.099
    7   HE21  GLN  31          HE21      GLN  31  16.019  23.679  -4.523
    8   HE22  GLN  31          HE22      GLN  31  16.568  24.662  -5.792

  No H/Q in entry =           8
  In of MODEL   47
    1    H    GLY  32           H        GLY  32  11.358  26.223  -0.110
    2    HA3  GLY  32           HA2      GLY  32  10.188  27.773   1.173
    3    HA2  GLY  32           HA3      GLY  32  11.291  29.025   0.617

  No H/Q in entry =           3
  In of MODEL   47
    1    H    ASP  33           H        ASP  33   9.938  27.104  -1.869
    2    HA   ASP  33           HA       ASP  33   8.234  29.354  -2.710
    3    HB2  ASP  33           HB2      ASP  33   9.353  26.952  -4.163
    4    HB3  ASP  33           HB3      ASP  33   8.180  28.052  -4.884

  No H/Q in entry =           4
  In of MODEL   47
    1    H    PHE  34           H        PHE  34   6.564  28.851  -1.135
    2    HA   PHE  34           HA       PHE  34   5.221  26.359  -1.033
    3    HB2  PHE  34           HB2      PHE  34   4.224  29.131  -0.343
    4    HB3  PHE  34           HB3      PHE  34   3.400  27.627   0.072
    5    HD1  PHE  34           HD1      PHE  34   5.623  30.057   1.274
    6    HD2  PHE  34           HD2      PHE  34   5.005  25.807   1.220
    7    HE1  PHE  34           HE1      PHE  34   7.031  29.825   3.301
    8    HE2  PHE  34           HE2      PHE  34   6.415  25.579   3.244
    9    HZ   PHE  34           HZ       PHE  34   7.422  27.589   4.284

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ALA  35           H        ALA  35   4.735  29.218  -3.037
    2    HA   ALA  35           HA       ALA  35   2.186  28.568  -4.046
    3    HB3  ALA  35           HB1      ALA  35   3.203  29.978  -6.089
    4    HB2  ALA  35           HB2      ALA  35   4.424  30.355  -4.873
    5    HB1  ALA  35           HB3      ALA  35   2.729  30.739  -4.570

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA  36           H        ALA  36   5.415  27.944  -5.423
    2    HA   ALA  36           HA       ALA  36   4.432  26.503  -7.662
    3    HB3  ALA  36           HB1      ALA  36   6.584  26.660  -8.292
    4    HB2  ALA  36           HB2      ALA  36   7.090  25.637  -6.946
    5    HB1  ALA  36           HB3      ALA  36   6.960  27.383  -6.728

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA  37           H        ALA  37   5.425  25.519  -4.415
    2    HA   ALA  37           HA       ALA  37   5.405  22.731  -4.847
    3    HB2  ALA  37           HB1      ALA  37   5.133  24.515  -2.464
    4    HB1  ALA  37           HB2      ALA  37   6.284  23.214  -2.766
    5    HB3  ALA  37           HB3      ALA  37   4.631  22.835  -2.284

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LYS  38           H        LYS  38   2.847  24.899  -3.659
    2    HA   LYS  38           HA       LYS  38   0.777  23.055  -3.424
    3    HB2  LYS  38           HB2      LYS  38   1.089  25.816  -3.172
    4    HB3  LYS  38           HB3      LYS  38  -0.117  25.652  -4.442
    5    HG2  LYS  38           HG2      LYS  38  -1.537  24.305  -2.991
    6    HG3  LYS  38           HG3      LYS  38  -0.283  24.263  -1.744
    7    HD2  LYS  38           HD2      LYS  38  -0.501  26.596  -1.292
    8    HD3  LYS  38           HD3      LYS  38  -1.427  26.872  -2.768
    9    HE2  LYS  38           HE2      LYS  38  -2.917  26.882  -0.818
   10    HE3  LYS  38           HE3      LYS  38  -3.278  25.502  -1.859
   11    HZ3  LYS  38           HZ1      LYS  38  -2.520  24.040  -0.333
   12    HZ2  LYS  38           HZ2      LYS  38  -2.882  25.291   0.760
   13    HZ1  LYS  38           HZ3      LYS  38  -1.287  25.064   0.224

  No H/Q in entry =          13
  In of MODEL   47
    1    H    ALA  39           H        ALA  39   1.708  24.975  -6.277
    2    HA   ALA  39           HA       ALA  39  -0.366  24.079  -7.966
    3    HB2  ALA  39           HB1      ALA  39   2.353  24.769  -9.038
    4    HB1  ALA  39           HB2      ALA  39   1.373  26.015  -8.265
    5    HB3  ALA  39           HB3      ALA  39   0.763  25.170  -9.688

  No H/Q in entry =           5
  In of MODEL   47
    1    H    MET  40           H        MET  40   2.895  22.828  -7.411
    2    HA   MET  40           HA       MET  40   2.814  20.809  -9.404
    3    HB2  MET  40           HB2      MET  40   4.439  21.054  -6.867
    4    HB3  MET  40           HB3      MET  40   4.700  19.803  -8.084
    5    HG2  MET  40           HG2      MET  40   4.709  22.760  -8.746
    6    HG3  MET  40           HG3      MET  40   6.171  21.879  -8.308
    7    HE3  MET  40           HE1      MET  40   7.057  19.680 -11.125
    8    HE2  MET  40           HE2      MET  40   6.510  19.351  -9.484
    9    HE1  MET  40           HE3      MET  40   7.583  20.715  -9.790

  No H/Q in entry =           9
  In of MODEL   47
    1    H    MET  41           H        MET  41   1.922  20.833  -5.974
    2    HA   MET  41           HA       MET  41   1.433  18.060  -5.696
    3    HB2  MET  41           HB2      MET  41   0.074  20.396  -4.333
    4    HB3  MET  41           HB3      MET  41  -0.053  18.715  -3.826
    5    HG2  MET  41           HG2      MET  41   2.654  18.979  -3.882
    6    HG3  MET  41           HG3      MET  41   2.191  20.631  -3.481
    7    HE2  MET  41           HE1      MET  41  -0.817  19.330  -1.736
    8    HE1  MET  41           HE2      MET  41  -0.026  20.855  -2.117
    9    HE3  MET  41           HE3      MET  41  -0.065  20.282  -0.449

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ASP  42           H        ASP  42  -0.653  20.755  -6.652
    2    HA   ASP  42           HA       ASP  42  -3.074  19.357  -6.774
    3    HB2  ASP  42           HB2      ASP  42  -2.408  21.938  -7.032
    4    HB3  ASP  42           HB3      ASP  42  -2.565  21.543  -8.740

  No H/Q in entry =           4
  In of MODEL   47
    1    H    GLN  43           H        GLN  43  -0.660  19.988  -9.292
    2    HA   GLN  43           HA       GLN  43  -2.041  18.650 -11.373
    3    HB2  GLN  43           HB2      GLN  43   0.912  19.212 -11.011
    4    HB3  GLN  43           HB3      GLN  43   0.198  18.562 -12.490
    5    HG2  GLN  43           HG2      GLN  43  -1.345  20.566 -12.518
    6    HG3  GLN  43           HG3      GLN  43  -0.393  21.235 -11.196
    7   HE21  GLN  43          HE21      GLN  43  -0.271  22.860 -13.281
    8   HE22  GLN  43          HE22      GLN  43   1.141  22.662 -14.198

  No H/Q in entry =           8
  In of MODEL   47
    1    H    SER  44           H        SER  44   0.344  17.544  -9.000
    2    HA   SER  44           HA       SER  44   0.712  14.944 -10.031
    3    HB2  SER  44           HB2      SER  44   1.600  16.394  -7.799
    4    HB3  SER  44           HB3      SER  44   0.764  14.996  -7.124
    5    HG   SER  44           HG       SER  44   2.881  14.410  -7.566

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ARG  45           H        ARG  45  -1.612  16.223  -7.676
    2    HA   ARG  45           HA       ARG  45  -2.957  13.840  -7.034
    3    HB2  ARG  45           HB2      ARG  45  -3.181  16.003  -5.838
    4    HB3  ARG  45           HB3      ARG  45  -4.057  16.658  -7.218
    5    HG2  ARG  45           HG2      ARG  45  -5.793  14.904  -6.925
    6    HG3  ARG  45           HG3      ARG  45  -4.930  14.304  -5.509
    7    HD2  ARG  45           HD2      ARG  45  -5.165  16.566  -4.448
    8    HD3  ARG  45           HD3      ARG  45  -6.169  17.072  -5.823
    9    HE   ARG  45           HE       ARG  45  -7.235  14.677  -4.779
   10   HH21  ARG  45          HH11      ARG  45  -9.063  14.722  -3.495
   11   HH22  ARG  45          HH12      ARG  45  -9.475  16.154  -2.622
   12   HH11  ARG  45          HH21      ARG  45  -6.734  17.931  -3.755
   13   HH12  ARG  45          HH22      ARG  45  -8.151  17.972  -2.767

  No H/Q in entry =          13
  In of MODEL   47
    1    H    MET  46           H        MET  46  -3.597  16.238  -9.578
    2    HA   MET  46           HA       MET  46  -5.924  15.029 -10.625
    3    HB2  MET  46           HB2      MET  46  -3.860  16.889 -11.814
    4    HB3  MET  46           HB3      MET  46  -5.242  16.313 -12.750
    5    HG2  MET  46           HG2      MET  46  -6.787  17.227 -11.095
    6    HG3  MET  46           HG3      MET  46  -5.444  17.726 -10.073
    7    HE2  MET  46           HE1      MET  46  -7.022  19.477 -13.944
    8    HE1  MET  46           HE2      MET  46  -7.279  17.882 -13.245
    9    HE3  MET  46           HE3      MET  46  -5.833  18.192 -14.204

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ALA  47           H        ALA  47  -2.493  14.606 -11.407
    2    HA   ALA  47           HA       ALA  47  -2.825  12.876 -13.617
    3    HB3  ALA  47           HB1      ALA  47  -0.660  13.800 -13.279
    4    HB2  ALA  47           HB2      ALA  47  -0.489  12.074 -12.948
    5    HB1  ALA  47           HB3      ALA  47  -0.591  13.223 -11.613

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU  48           H        LEU  48  -2.522  12.241 -10.146
    2    HA   LEU  48           HA       LEU  48  -2.571   9.400 -10.307
    3    HB2  LEU  48           HB2      LEU  48  -3.351  11.302  -8.086
    4    HB3  LEU  48           HB3      LEU  48  -3.227   9.553  -7.888
    5    HG   LEU  48           HG       LEU  48  -0.963  11.291  -8.898
    6   HD13  LEU  48          HD11      LEU  48  -1.244  12.054  -6.705
    7   HD12  LEU  48          HD12      LEU  48  -0.058  10.766  -6.516
    8   HD11  LEU  48          HD13      LEU  48  -1.749  10.475  -6.107
    9   HD22  LEU  48          HD21      LEU  48  -0.433   9.115  -9.545
   10   HD21  LEU  48          HD22      LEU  48  -1.282   8.384  -8.184
   11   HD23  LEU  48          HD23      LEU  48   0.280   9.163  -7.934

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ASN  49           H        ASN  49  -5.072  11.851  -9.886
    2    HA   ASN  49           HA       ASN  49  -7.226  10.150  -9.334
    3    HB2  ASN  49           HB2      ASN  49  -7.326  12.569  -9.004
    4    HB3  ASN  49           HB3      ASN  49  -7.172  12.838 -10.736
    5   HD21  ASN  49          HD21      ASN  49  -9.176  13.571 -11.416
    6   HD22  ASN  49          HD22      ASN  49 -10.659  12.848 -11.021

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLU  50           H        GLU  50  -5.987  11.371 -12.428
    2    HA   GLU  50           HA       GLU  50  -7.932  10.086 -14.062
    3    HB2  GLU  50           HB2      GLU  50  -6.501  11.929 -14.884
    4    HB3  GLU  50           HB3      GLU  50  -5.089  10.880 -14.756
    5    HG2  GLU  50           HG2      GLU  50  -6.048   9.331 -16.389
    6    HG3  GLU  50           HG3      GLU  50  -7.525  10.285 -16.465

  No H/Q in entry =           6
  In of MODEL   47
    1    H    ALA  51           H        ALA  51  -4.737   9.144 -12.879
    2    HA   ALA  51           HA       ALA  51  -4.567   6.695 -14.301
    3    HB2  ALA  51           HB1      ALA  51  -2.575   6.439 -13.214
    4    HB1  ALA  51           HB2      ALA  51  -3.259   6.848 -11.642
    5    HB3  ALA  51           HB3      ALA  51  -2.832   8.127 -12.777

  No H/Q in entry =           5
  In of MODEL   47
    1    H    HIS  52           H        HIS  52  -5.732   7.504 -11.043
    2    HA   HIS  52           HA       HIS  52  -6.369   4.883 -10.210
    3    HB2  HIS  52           HB2      HIS  52  -6.257   6.775  -8.657
    4    HB3  HIS  52           HB3      HIS  52  -7.654   7.514  -9.440
    5    HD1  HIS  52           HD1      HIS  52  -9.915   5.982  -9.380
    6    HD2  HIS  52           HD2      HIS  52  -6.927   4.983  -6.652
    7    HE1  HIS  52           HE1      HIS  52 -11.014   4.541  -7.611
    8    HE2  HIS  52           HE2      HIS  52  -9.204   3.923  -5.939

  No H/Q in entry =           8
  In of MODEL   47
    1    H    LEU  53           H        LEU  53  -8.241   7.313 -11.984
    2    HA   LEU  53           HA       LEU  53 -10.725   5.981 -11.981
    3    HB2  LEU  53           HB2      LEU  53  -9.488   7.975 -13.870
    4    HB3  LEU  53           HB3      LEU  53 -11.087   7.296 -14.159
    5    HG   LEU  53           HG       LEU  53 -10.333   8.623 -11.535
    6   HD12  LEU  53          HD11      LEU  53 -11.690  10.566 -12.483
    7   HD11  LEU  53          HD12      LEU  53 -11.508   9.800 -14.062
    8   HD13  LEU  53          HD13      LEU  53 -10.088  10.346 -13.176
    9   HD21  LEU  53          HD21      LEU  53 -12.911   7.724 -12.833
   10   HD23  LEU  53          HD22      LEU  53 -12.914   8.996 -11.618
   11   HD22  LEU  53          HD23      LEU  53 -12.344   7.391 -11.202

  No H/Q in entry =          11
  In of MODEL   47
    1    H    VAL  54           H        VAL  54  -7.986   5.830 -14.236
    2    HA   VAL  54           HA       VAL  54  -9.192   4.042 -16.074
    3    HB   VAL  54           HB       VAL  54  -6.289   4.593 -15.409
    4   HG12  VAL  54          HG11      VAL  54  -6.040   3.515 -17.801
    5   HG11  VAL  54          HG12      VAL  54  -7.553   2.710 -17.389
    6   HG13  VAL  54          HG13      VAL  54  -6.127   2.476 -16.380
    7   HG22  VAL  54          HG21      VAL  54  -7.096   6.525 -16.447
    8   HG21  VAL  54          HG22      VAL  54  -8.281   5.645 -17.408
    9   HG23  VAL  54          HG23      VAL  54  -6.577   5.592 -17.850

  No H/Q in entry =           9
  In of MODEL   47
    1    H    GLN  55           H        GLN  55  -7.167   3.524 -13.188
    2    HA   GLN  55           HA       GLN  55  -7.035   0.709 -13.448
    3    HB2  GLN  55           HB2      GLN  55  -5.484   1.628 -11.938
    4    HB3  GLN  55           HB3      GLN  55  -6.710   2.574 -11.099
    5    HG2  GLN  55           HG2      GLN  55  -7.362   0.805  -9.779
    6    HG3  GLN  55           HG3      GLN  55  -7.127  -0.377 -11.060
    7   HE21  GLN  55          HE21      GLN  55  -5.479  -1.802 -10.578
    8   HE22  GLN  55          HE22      GLN  55  -4.094  -1.430  -9.674

  No H/Q in entry =           8
  In of MODEL   47
    1    H    THR  56           H        THR  56  -9.389   2.834 -11.816
    2    HA   THR  56           HA       THR  56 -10.936   0.925 -10.519
    3    HB   THR  56           HB       THR  56 -12.063   3.306 -12.014
    4    HG1  THR  56           HG1      THR  56 -10.233   3.778 -10.637
    5   HG23  THR  56          HG21      THR  56 -13.931   3.069 -10.710
    6   HG22  THR  56          HG22      THR  56 -13.023   2.420  -9.343
    7   HG21  THR  56          HG23      THR  56 -13.419   1.382 -10.715

  No H/Q in entry =           7
  In of MODEL   47
    1    H    LYS  57           H        LYS  57 -11.175   2.008 -13.903
    2    HA   LYS  57           HA       LYS  57 -13.310   0.289 -14.645
    3    HB2  LYS  57           HB2      LYS  57 -12.464   2.258 -15.962
    4    HB3  LYS  57           HB3      LYS  57 -11.021   1.330 -16.348
    5    HG2  LYS  57           HG2      LYS  57 -12.410  -0.374 -17.468
    6    HG3  LYS  57           HG3      LYS  57 -13.858   0.554 -17.091
    7    HD2  LYS  57           HD2      LYS  57 -11.569   1.763 -18.650
    8    HD3  LYS  57           HD3      LYS  57 -12.851   0.857 -19.451
    9    HE2  LYS  57           HE2      LYS  57 -14.524   2.395 -18.326
   10    HE3  LYS  57           HE3      LYS  57 -13.168   3.381 -17.780
   11    HZ3  LYS  57           HZ1      LYS  57 -13.898   4.329 -19.777
   12    HZ2  LYS  57           HZ2      LYS  57 -14.019   2.825 -20.558
   13    HZ1  LYS  57           HZ3      LYS  57 -12.492   3.474 -20.187

  No H/Q in entry =          13
  In of MODEL   47
    1    H    LEU  58           H        LEU  58  -9.799  -0.089 -14.610
    2    HA   LEU  58           HA       LEU  58  -9.777  -2.604 -15.901
    3    HB2  LEU  58           HB2      LEU  58  -7.751  -1.283 -14.104
    4    HB3  LEU  58           HB3      LEU  58  -7.473  -2.800 -14.961
    5    HG   LEU  58           HG       LEU  58  -8.274  -0.206 -16.317
    6   HD11  LEU  58          HD11      LEU  58  -5.605  -1.403 -15.644
    7   HD13  LEU  58          HD12      LEU  58  -6.126   0.281 -15.590
    8   HD12  LEU  58          HD13      LEU  58  -5.784  -0.484 -17.139
    9   HD22  LEU  58          HD21      LEU  58  -8.836  -1.775 -17.906
   10   HD21  LEU  58          HD22      LEU  58  -7.772  -3.007 -17.232
   11   HD23  LEU  58          HD23      LEU  58  -7.107  -1.722 -18.240

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  59           H        ILE  59 -10.592  -1.717 -12.644
    2    HA   ILE  59           HA       ILE  59 -10.192  -4.479 -11.701
    3    HB   ILE  59           HB       ILE  59  -9.767  -2.214 -10.301
    4   HG12  ILE  59          HG12      ILE  59 -11.119  -4.578  -8.978
    5   HG13  ILE  59          HG13      ILE  59  -9.473  -4.638  -9.557
    6   HG21  ILE  59          HG21      ILE  59 -12.323  -1.739 -10.556
    7   HG23  ILE  59          HG22      ILE  59 -11.589  -1.513  -8.985
    8   HG22  ILE  59          HG23      ILE  59 -12.519  -2.968  -9.330
    9   HD12  ILE  59          HD11      ILE  59 -10.573  -2.738  -7.501
   10   HD11  ILE  59          HD12      ILE  59  -8.943  -2.634  -8.153
   11   HD13  ILE  59          HD13      ILE  59  -9.427  -4.042  -7.207

  No H/Q in entry =          11
  In of MODEL   47
    1    H    GLU  60           H        GLU  60 -12.791  -2.203 -12.492
    2    HA   GLU  60           HA       GLU  60 -14.946  -3.754 -11.467
    3    HB2  GLU  60           HB2      GLU  60 -15.213  -1.392 -12.051
    4    HB3  GLU  60           HB3      GLU  60 -14.871  -1.750 -13.741
    5    HG2  GLU  60           HG2      GLU  60 -17.125  -3.167 -12.341
    6    HG3  GLU  60           HG3      GLU  60 -17.364  -1.551 -12.976

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLY  61           H        GLY  61 -13.291  -3.711 -14.592
    2    HA3  GLY  61           HA2      GLY  61 -14.974  -5.981 -15.474
    3    HA2  GLY  61           HA3      GLY  61 -14.153  -4.863 -16.556

  No H/Q in entry =           3
  In of MODEL   47
    1    H    ASP  62           H        ASP  62 -12.741  -6.292 -13.681
    2    HA   ASP  62           HA       ASP  62 -10.474  -7.227 -15.166
    3    HB2  ASP  62           HB2      ASP  62  -9.723  -8.038 -12.939
    4    HB3  ASP  62           HB3      ASP  62 -10.208  -6.347 -12.917

  No H/Q in entry =           4
  In of MODEL   47
    1    H    ALA  63           H        ALA  63 -12.726  -8.537 -16.238
    2    HA   ALA  63           HA       ALA  63 -13.212 -11.132 -15.159
    3    HB3  ALA  63           HB1      ALA  63 -14.753 -10.321 -16.791
    4    HB2  ALA  63           HB2      ALA  63 -13.871 -11.608 -17.614
    5    HB1  ALA  63           HB3      ALA  63 -13.461  -9.919 -17.921

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLY  64           H        GLY  64 -10.858  -9.850 -17.434
    2    HA3  GLY  64           HA2      GLY  64  -8.974 -10.729 -18.399
    3    HA2  GLY  64           HA3      GLY  64  -8.805 -11.639 -16.903

  No H/Q in entry =           3
  In of MODEL   47
    1    H    GLU  65           H        GLU  65  -8.268 -13.659 -17.571
    2    HA   GLU  65           HA       GLU  65  -9.072 -14.864 -19.955
    3    HB2  GLU  65           HB2      GLU  65  -8.179 -16.105 -17.354
    4    HB3  GLU  65           HB3      GLU  65  -8.407 -17.015 -18.848
    5    HG2  GLU  65           HG2      GLU  65  -6.756 -15.639 -19.992
    6    HG3  GLU  65           HG3      GLU  65  -6.582 -14.613 -18.569

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLY  66           H        GLY  66  -9.996 -17.300 -19.495
    2    HA3  GLY  66           HA2      GLY  66 -12.793 -17.039 -19.478
    3    HA2  GLY  66           HA3      GLY  66 -11.898 -18.546 -19.447

  No H/Q in entry =           3
  In of MODEL   47
    1    H    LYS  67           H        LYS  67 -10.556 -18.045 -16.971
    2    HA   LYS  67           HA       LYS  67 -12.592 -18.973 -15.182
    3    HB2  LYS  67           HB2      LYS  67  -9.633 -18.508 -14.862
    4    HB3  LYS  67           HB3      LYS  67 -10.662 -19.175 -13.588
    5    HG2  LYS  67           HG2      LYS  67 -11.389 -20.977 -15.112
    6    HG3  LYS  67           HG3      LYS  67 -10.362 -20.317 -16.383
    7    HD2  LYS  67           HD2      LYS  67  -8.365 -20.729 -15.018
    8    HD3  LYS  67           HD3      LYS  67  -9.375 -21.333 -13.703
    9    HE2  LYS  67           HE2      LYS  67  -8.483 -23.218 -15.001
   10    HE3  LYS  67           HE3      LYS  67 -10.233 -23.118 -15.201
   11    HZ1  LYS  67           HZ1      LYS  67  -8.934 -21.515 -17.132
   12    HZ3  LYS  67           HZ2      LYS  67  -9.981 -22.830 -17.365
   13    HZ2  LYS  67           HZ3      LYS  67  -8.313 -23.091 -17.189

  No H/Q in entry =          13
  In of MODEL   47
    1    H    MET  68           H        MET  68 -13.124 -18.216 -13.169
    2    HA   MET  68           HA       MET  68 -14.012 -15.643 -12.927
    3    HB2  MET  68           HB2      MET  68 -13.258 -17.631 -10.791
    4    HB3  MET  68           HB3      MET  68 -14.104 -16.121 -10.453
    5    HG2  MET  68           HG2      MET  68 -15.921 -16.771 -11.965
    6    HG3  MET  68           HG3      MET  68 -15.064 -18.258 -12.380
    7    HE3  MET  68           HE1      MET  68 -15.544 -16.649  -8.532
    8    HE2  MET  68           HE2      MET  68 -17.265 -17.008  -8.659
    9    HE1  MET  68           HE3      MET  68 -16.484 -16.026  -9.897

  No H/Q in entry =           9
  In of MODEL   47
    1    H    LYS  69           H        LYS  69 -10.728 -16.421 -12.853
    2    HA   LYS  69           HA       LYS  69  -9.806 -14.706 -10.809
    3    HB2  LYS  69           HB2      LYS  69  -8.438 -15.870 -13.232
    4    HB3  LYS  69           HB3      LYS  69  -7.585 -14.938 -11.998
    5    HG2  LYS  69           HG2      LYS  69  -8.358 -16.513 -10.263
    6    HG3  LYS  69           HG3      LYS  69  -9.228 -17.438 -11.485
    7    HD2  LYS  69           HD2      LYS  69  -7.099 -17.913 -12.642
    8    HD3  LYS  69           HD3      LYS  69  -6.228 -16.996 -11.413
    9    HE2  LYS  69           HE2      LYS  69  -7.053 -18.547  -9.674
   10    HE3  LYS  69           HE3      LYS  69  -7.908 -19.471 -10.907
   11    HZ1  LYS  69           HZ1      LYS  69  -5.541 -19.509 -11.989
   12    HZ3  LYS  69           HZ2      LYS  69  -5.972 -20.631 -10.791
   13    HZ2  LYS  69           HZ3      LYS  69  -5.033 -19.273 -10.389

  No H/Q in entry =          13
  In of MODEL   47
    1    H    VAL  70           H        VAL  70  -7.797 -13.129 -11.749
    2    HA   VAL  70           HA       VAL  70  -9.085 -11.093 -13.470
    3    HB   VAL  70           HB       VAL  70  -8.178  -9.358 -11.951
    4   HG11  VAL  70          HG11      VAL  70 -10.514 -10.260 -11.729
    5   HG13  VAL  70          HG12      VAL  70  -9.859  -9.628 -10.218
    6   HG12  VAL  70          HG13      VAL  70  -9.918 -11.368 -10.493
    7   HG23  VAL  70          HG21      VAL  70  -7.564 -10.292  -9.581
    8   HG22  VAL  70          HG22      VAL  70  -6.344 -10.354 -10.851
    9   HG21  VAL  70          HG23      VAL  70  -7.255 -11.804 -10.433

  No H/Q in entry =           9
  In of MODEL   47
    1    H    SER  71           H        SER  71  -7.504  -9.525 -14.324
    2    HA   SER  71           HA       SER  71  -5.298 -10.771 -15.581
    3    HB2  SER  71           HB2      SER  71  -6.458  -8.751 -16.467
    4    HB3  SER  71           HB3      SER  71  -5.783  -7.813 -15.136
    5    HG   SER  71           HG       SER  71  -4.451  -7.634 -16.940

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU  72           H        LEU  72  -3.222 -10.986 -14.990
    2    HA   LEU  72           HA       LEU  72  -2.489 -10.762 -12.283
    3    HB2  LEU  72           HB2      LEU  72  -0.851 -11.171 -14.778
    4    HB3  LEU  72           HB3      LEU  72  -0.168 -11.221 -13.156
    5    HG   LEU  72           HG       LEU  72  -2.496 -12.964 -14.030
    6   HD11  LEU  72          HD11      LEU  72   0.484 -13.387 -14.154
    7   HD13  LEU  72          HD12      LEU  72  -0.736 -13.752 -15.374
    8   HD12  LEU  72          HD13      LEU  72  -0.605 -14.757 -13.930
    9   HD22  LEU  72          HD21      LEU  72  -2.505 -12.972 -11.687
   10   HD21  LEU  72          HD22      LEU  72  -0.764 -12.775 -11.566
   11   HD23  LEU  72          HD23      LEU  72  -1.442 -14.331 -12.038

  No H/Q in entry =          11
  In of MODEL   47
    1    H    VAL  73           H        VAL  73  -1.819  -8.734 -15.066
    2    HA   VAL  73           HA       VAL  73   0.083  -7.008 -13.974
    3    HB   VAL  73           HB       VAL  73  -0.297  -5.631 -15.841
    4   HG11  VAL  73          HG11      VAL  73   0.361  -8.079 -16.266
    5   HG13  VAL  73          HG12      VAL  73  -0.257  -7.174 -17.646
    6   HG12  VAL  73          HG13      VAL  73  -1.302  -8.313 -16.800
    7   HG22  VAL  73          HG21      VAL  73  -2.615  -5.103 -15.633
    8   HG21  VAL  73          HG22      VAL  73  -3.087  -6.793 -15.789
    9   HG23  VAL  73          HG23      VAL  73  -2.459  -5.922 -17.187

  No H/Q in entry =           9
  In of MODEL   47
    1    H    LEU  74           H        LEU  74  -3.309  -7.174 -13.396
    2    HA   LEU  74           HA       LEU  74  -3.963  -4.527 -12.779
    3    HB2  LEU  74           HB2      LEU  74  -5.675  -6.203 -12.941
    4    HB3  LEU  74           HB3      LEU  74  -4.956  -7.138 -11.633
    5    HG   LEU  74           HG       LEU  74  -5.423  -5.297 -10.053
    6   HD12  LEU  74          HD11      LEU  74  -7.039  -3.508 -10.971
    7   HD11  LEU  74          HD12      LEU  74  -6.472  -3.991 -12.568
    8   HD13  LEU  74          HD13      LEU  74  -5.334  -3.335 -11.389
    9   HD22  LEU  74          HD21      LEU  74  -7.627  -5.885  -9.792
   10   HD21  LEU  74          HD22      LEU  74  -7.104  -7.117 -10.919
   11   HD23  LEU  74          HD23      LEU  74  -7.983  -5.729 -11.509

  No H/Q in entry =          11
  In of MODEL   47
    1    H    VAL  75           H        VAL  75  -2.872  -7.099 -10.625
    2    HA   VAL  75           HA       VAL  75  -2.682  -5.546  -8.281
    3    HB   VAL  75           HB       VAL  75  -1.163  -8.022  -9.085
    4   HG12  VAL  75          HG11      VAL  75  -0.655  -8.167  -6.625
    5   HG11  VAL  75          HG12      VAL  75  -1.358  -6.570  -6.421
    6   HG13  VAL  75          HG13      VAL  75   0.099  -6.766  -7.379
    7   HG23  VAL  75          HG21      VAL  75  -2.786  -9.000  -7.391
    8   HG22  VAL  75          HG22      VAL  75  -3.540  -8.418  -8.875
    9   HG21  VAL  75          HG23      VAL  75  -3.628  -7.449  -7.404

  No H/Q in entry =           9
  In of MODEL   47
    1    H    GLU  76           H        GLU  76  -0.277  -6.270 -10.832
    2    HA   GLU  76           HA       GLU  76   1.895  -4.891  -9.686
    3    HB2  GLU  76           HB2      GLU  76   2.121  -6.360 -11.666
    4    HB3  GLU  76           HB3      GLU  76   1.170  -5.232 -12.619
    5    HG2  GLU  76           HG2      GLU  76   3.487  -4.831 -13.145
    6    HG3  GLU  76           HG3      GLU  76   2.950  -3.474 -12.173

  No H/Q in entry =           6
  In of MODEL   47
    1    H    ALA  77           H        ALA  77  -0.667  -3.726 -11.860
    2    HA   ALA  77           HA       ALA  77   0.284  -1.066 -12.041
    3    HB3  ALA  77           HB1      ALA  77  -2.414  -2.348 -12.448
    4    HB1  ALA  77           HB2      ALA  77  -1.316  -1.677 -13.655
    5    HB2  ALA  77           HB3      ALA  77  -2.206  -0.600 -12.581

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLN  78           H        GLN  78  -1.949  -2.656  -9.817
    2    HA   GLN  78           HA       GLN  78  -2.782  -0.350  -8.411
    3    HB2  GLN  78           HB2      GLN  78  -3.835  -2.652  -8.332
    4    HB3  GLN  78           HB3      GLN  78  -2.502  -3.150  -7.293
    5    HG2  GLN  78           HG2      GLN  78  -3.105  -1.449  -5.652
    6    HG3  GLN  78           HG3      GLN  78  -4.390  -0.855  -6.703
    7   HE21  GLN  78          HE21      GLN  78  -5.350  -3.460  -7.592
    8   HE22  GLN  78          HE22      GLN  78  -6.077  -4.209  -6.253

  No H/Q in entry =           8
  In of MODEL   47
    1    H    LEU  79           H        LEU  79  -0.067  -2.565  -7.976
    2    HA   LEU  79           HA       LEU  79   0.909  -1.654  -5.524
    3    HB2  LEU  79           HB2      LEU  79   1.803  -3.649  -6.598
    4    HB3  LEU  79           HB3      LEU  79   2.427  -2.687  -7.934
    5    HG   LEU  79           HG       LEU  79   3.974  -1.525  -6.439
    6   HD13  LEU  79          HD11      LEU  79   2.977  -1.295  -4.366
    7   HD12  LEU  79          HD12      LEU  79   4.078  -2.628  -4.029
    8   HD11  LEU  79          HD13      LEU  79   2.376  -2.954  -4.349
    9   HD23  LEU  79          HD21      LEU  79   5.223  -3.654  -5.543
   10   HD22  LEU  79          HD22      LEU  79   5.006  -3.458  -7.280
   11   HD21  LEU  79          HD23      LEU  79   3.950  -4.544  -6.382

  No H/Q in entry =          11
  In of MODEL   47
    1    H    HIS  80           H        HIS  80   1.743  -0.523  -8.802
    2    HA   HIS  80           HA       HIS  80   3.525   1.493  -7.889
    3    HB2  HIS  80           HB2      HIS  80   2.232   0.779 -10.465
    4    HB3  HIS  80           HB3      HIS  80   2.801   2.440 -10.297
    5    HD1  HIS  80           HD1      HIS  80   5.195   2.779 -10.832
    6    HD2  HIS  80           HD2      HIS  80   4.444  -1.145  -9.637
    7    HE1  HIS  80           HE1      HIS  80   7.404   1.537 -11.010
    8    HE2  HIS  80           HE2      HIS  80   6.958  -0.858 -10.286

  No H/Q in entry =           8
  In of MODEL   47
    1    H    LEU  81           H        LEU  81   0.113   1.598  -8.850
    2    HA   LEU  81           HA       LEU  81  -0.205   4.386  -8.516
    3    HB2  LEU  81           HB2      LEU  81  -2.183   2.108  -8.427
    4    HB3  LEU  81           HB3      LEU  81  -2.662   3.803  -8.332
    5    HG   LEU  81           HG       LEU  81  -0.963   2.682 -10.578
    6   HD12  LEU  81          HD11      LEU  81  -3.207   2.965 -11.864
    7   HD11  LEU  81          HD12      LEU  81  -3.953   2.884 -10.269
    8   HD13  LEU  81          HD13      LEU  81  -2.991   1.532 -10.862
    9   HD23  LEU  81          HD21      LEU  81  -2.101   4.808 -11.668
   10   HD22  LEU  81          HD22      LEU  81  -0.682   5.002 -10.642
   11   HD21  LEU  81          HD23      LEU  81  -2.289   5.324  -9.993

  No H/Q in entry =          11
  In of MODEL   47
    1    H    MET  82           H        MET  82  -0.808   1.688  -6.265
    2    HA   MET  82           HA       MET  82  -1.875   3.255  -4.172
    3    HB2  MET  82           HB2      MET  82  -0.457   0.592  -4.220
    4    HB3  MET  82           HB3      MET  82  -1.039   1.306  -2.718
    5    HG2  MET  82           HG2      MET  82  -2.777   0.785  -5.150
    6    HG3  MET  82           HG3      MET  82  -2.673  -0.288  -3.756
    7    HE3  MET  82           HE1      MET  82  -4.408   1.331  -0.931
    8    HE2  MET  82           HE2      MET  82  -2.684   1.638  -1.125
    9    HE1  MET  82           HE3      MET  82  -3.348   0.069  -1.576

  No H/Q in entry =           9
  In of MODEL   47
    1    H    THR  83           H        THR  83   1.440   2.226  -4.879
    2    HA   THR  83           HA       THR  83   2.651   3.349  -2.585
    3    HB   THR  83           HB       THR  83   4.738   3.330  -4.070
    4    HG1  THR  83           HG1      THR  83   4.497   2.801  -6.093
    5   HG22  THR  83          HG21      THR  83   4.338   0.665  -4.401
    6   HG21  THR  83          HG22      THR  83   3.048   1.022  -3.254
    7   HG23  THR  83          HG23      THR  83   4.724   1.394  -2.843

  No H/Q in entry =           7
  In of MODEL   47
    1    H    SER  84           H        SER  84   2.241   4.624  -5.882
    2    HA   SER  84           HA       SER  84   3.541   7.086  -5.433
    3    HB2  SER  84           HB2      SER  84   1.474   6.220  -7.442
    4    HB3  SER  84           HB3      SER  84   2.125   7.858  -7.419
    5    HG   SER  84           HG       SER  84   3.538   5.407  -7.719

  No H/Q in entry =           5
  In of MODEL   47
    1    H    MET  85           H        MET  85   0.061   6.271  -5.243
    2    HA   MET  85           HA       MET  85  -0.841   8.866  -4.636
    3    HB2  MET  85           HB2      MET  85  -2.343   7.044  -5.297
    4    HB3  MET  85           HB3      MET  85  -2.022   6.224  -3.770
    5    HG2  MET  85           HG2      MET  85  -3.121   7.886  -2.507
    6    HG3  MET  85           HG3      MET  85  -3.021   9.066  -3.813
    7    HE1  MET  85           HE1      MET  85  -4.040   5.429  -3.256
    8    HE3  MET  85           HE2      MET  85  -3.877   5.454  -5.011
    9    HE2  MET  85           HE3      MET  85  -5.461   5.204  -4.284

  No H/Q in entry =           9
  In of MODEL   47
    1    H    LEU  86           H        LEU  86   0.135   6.218  -2.499
    2    HA   LEU  86           HA       LEU  86  -0.407   7.510  -0.053
    3    HB2  LEU  86           HB2      LEU  86   0.096   5.048  -0.451
    4    HB3  LEU  86           HB3      LEU  86   1.795   5.505  -0.555
    5    HG   LEU  86           HG       LEU  86   1.464   6.659   1.716
    6   HD11  LEU  86          HD11      LEU  86  -1.220   5.850   1.259
    7   HD13  LEU  86          HD12      LEU  86  -0.559   6.607   2.706
    8   HD12  LEU  86          HD13      LEU  86  -0.622   4.850   2.586
    9   HD23  LEU  86          HD21      LEU  86   1.084   3.660   1.838
   10   HD22  LEU  86          HD22      LEU  86   2.076   4.685   2.873
   11   HD21  LEU  86          HD23      LEU  86   2.573   4.369   1.212

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ALA  87           H        ALA  87   2.568   7.265  -1.959
    2    HA   ALA  87           HA       ALA  87   4.261   8.701  -0.242
    3    HB3  ALA  87           HB1      ALA  87   4.357   7.691  -2.951
    4    HB2  ALA  87           HB2      ALA  87   5.692   8.042  -1.857
    5    HB1  ALA  87           HB3      ALA  87   5.052   9.313  -2.896

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ARG  88           H        ARG  88   2.281   9.808  -2.951
    2    HA   ARG  88           HA       ARG  88   3.015  12.509  -2.836
    3    HB2  ARG  88           HB2      ARG  88   1.768  11.339  -4.687
    4    HB3  ARG  88           HB3      ARG  88   0.315  11.460  -3.696
    5    HG2  ARG  88           HG2      ARG  88   1.295  14.055  -3.616
    6    HG3  ARG  88           HG3      ARG  88   1.718  13.549  -5.249
    7    HD2  ARG  88           HD2      ARG  88  -0.428  13.597  -5.935
    8    HD3  ARG  88           HD3      ARG  88  -0.994  12.734  -4.504
    9    HE   ARG  88           HE       ARG  88  -1.227  15.509  -4.918
   10   HH21  ARG  88          HH11      ARG  88  -1.765  16.829  -3.177
   11   HH22  ARG  88          HH12      ARG  88  -1.451  16.295  -1.561
   12   HH11  ARG  88          HH21      ARG  88  -0.165  13.260  -2.552
   13   HH12  ARG  88          HH22      ARG  88  -0.563  14.268  -1.208

  No H/Q in entry =          13
  In of MODEL   47
    1    H    GLU  89           H        GLU  89   0.346  10.794  -1.182
    2    HA   GLU  89           HA       GLU  89  -0.789  13.088   0.031
    3    HB2  GLU  89           HB2      GLU  89  -1.874  10.833  -0.051
    4    HB3  GLU  89           HB3      GLU  89  -0.735  10.293   1.183
    5    HG2  GLU  89           HG2      GLU  89  -1.571  11.978   2.748
    6    HG3  GLU  89           HG3      GLU  89  -2.640  12.634   1.511

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LEU  90           H        LEU  90   1.702  10.830   1.189
    2    HA   LEU  90           HA       LEU  90   2.055  12.077   3.718
    3    HB2  LEU  90           HB2      LEU  90   3.843  10.330   2.029
    4    HB3  LEU  90           HB3      LEU  90   4.264  10.851   3.665
    5    HG   LEU  90           HG       LEU  90   1.645   9.469   3.018
    6   HD12  LEU  90          HD11      LEU  90   2.820   7.438   4.018
    7   HD11  LEU  90          HD12      LEU  90   4.329   8.316   3.768
    8   HD13  LEU  90          HD13      LEU  90   3.314   7.895   2.387
    9   HD22  LEU  90          HD21      LEU  90   1.380  10.386   5.142
   10   HD21  LEU  90          HD22      LEU  90   3.101  10.303   5.514
   11   HD23  LEU  90          HD23      LEU  90   2.116   8.842   5.567

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  91           H        ILE  91   3.635  12.485   0.582
    2    HA   ILE  91           HA       ILE  91   5.591  14.343   1.412
    3    HB   ILE  91           HB       ILE  91   4.271  13.837  -1.261
    4   HG12  ILE  91          HG12      ILE  91   7.115  13.387  -0.303
    5   HG13  ILE  91          HG13      ILE  91   5.851  12.172  -0.135
    6   HG22  ILE  91          HG21      ILE  91   6.471  15.215  -1.961
    7   HG21  ILE  91          HG22      ILE  91   6.159  16.010  -0.417
    8   HG23  ILE  91          HG23      ILE  91   4.929  16.023  -1.679
    9   HD13  ILE  91          HD11      ILE  91   5.669  11.849  -2.441
   10   HD12  ILE  91          HD12      ILE  91   7.401  12.115  -2.237
   11   HD11  ILE  91          HD13      ILE  91   6.369  13.425  -2.816

  No H/Q in entry =          11
  In of MODEL   47
    1    H    THR  92           H        THR  92   2.218  14.731   0.424
    2    HA   THR  92           HA       THR  92   2.153  17.553   0.367
    3    HB   THR  92           HB       THR  92   0.017  15.529   1.077
    4    HG1  THR  92           HG1      THR  92   0.312  15.357  -1.010
    5   HG22  THR  92          HG21      THR  92  -1.417  17.673   0.365
    6   HG21  THR  92          HG22      THR  92  -0.032  18.516   1.055
    7   HG23  THR  92          HG23      THR  92  -0.952  17.381   2.041

  No H/Q in entry =           7
  In of MODEL   47
    1    H    GLU  93           H        GLU  93   1.651  15.243   3.022
    2    HA   GLU  93           HA       GLU  93   1.106  17.138   5.045
    3    HB2  GLU  93           HB2      GLU  93   2.456  14.430   5.270
    4    HB3  GLU  93           HB3      GLU  93   1.761  15.347   6.608
    5    HG2  GLU  93           HG2      GLU  93   0.145  14.550   4.178
    6    HG3  GLU  93           HG3      GLU  93   0.268  13.527   5.605

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LEU  94           H        LEU  94   4.125  15.697   3.876
    2    HA   LEU  94           HA       LEU  94   5.871  16.865   5.756
    3    HB2  LEU  94           HB2      LEU  94   6.269  15.906   2.921
    4    HB3  LEU  94           HB3      LEU  94   7.595  16.581   3.864
    5    HG   LEU  94           HG       LEU  94   5.891  14.361   5.006
    6   HD11  LEU  94          HD11      LEU  94   7.977  14.165   2.863
    7   HD13  LEU  94          HD12      LEU  94   6.546  13.172   3.131
    8   HD12  LEU  94          HD13      LEU  94   7.980  12.937   4.130
    9   HD23  LEU  94          HD21      LEU  94   8.094  13.852   6.145
   10   HD22  LEU  94          HD22      LEU  94   7.409  15.421   6.568
   11   HD21  LEU  94          HD23      LEU  94   8.743  15.319   5.417

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  95           H        ILE  95   4.698  18.025   2.614
    2    HA   ILE  95           HA       ILE  95   6.239  20.403   2.548
    3    HB   ILE  95           HB       ILE  95   3.596  19.686   1.257
    4   HG12  ILE  95          HG12      ILE  95   6.374  20.061   0.104
    5   HG13  ILE  95          HG13      ILE  95   5.748  18.499   0.621
    6   HG21  ILE  95          HG21      ILE  95   5.312  22.176   1.029
    7   HG23  ILE  95          HG22      ILE  95   3.590  22.085   1.395
    8   HG22  ILE  95          HG23      ILE  95   4.169  21.694  -0.224
    9   HD13  ILE  95          HD11      ILE  95   4.179  18.404  -1.099
   10   HD12  ILE  95          HD12      ILE  95   5.513  19.241  -1.894
   11   HD11  ILE  95          HD13      ILE  95   4.132  20.157  -1.293

  No H/Q in entry =          11
  In of MODEL   47
    1    H    GLU  96           H        GLU  96   3.006  19.707   3.861
    2    HA   GLU  96           HA       GLU  96   2.356  22.345   4.619
    3    HB2  GLU  96           HB2      GLU  96   0.705  20.540   4.638
    4    HB3  GLU  96           HB3      GLU  96   1.585  19.723   5.927
    5    HG2  GLU  96           HG2      GLU  96   0.557  20.991   7.504
    6    HG3  GLU  96           HG3      GLU  96   1.068  22.473   6.706

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LEU  97           H        LEU  97   4.241  19.817   6.230
    2    HA   LEU  97           HA       LEU  97   4.595  21.167   8.701
    3    HB2  LEU  97           HB2      LEU  97   6.152  19.020   7.275
    4    HB3  LEU  97           HB3      LEU  97   6.742  19.710   8.784
    5    HG   LEU  97           HG       LEU  97   3.945  18.581   8.488
    6   HD12  LEU  97          HD11      LEU  97   4.917  16.580   9.694
    7   HD11  LEU  97          HD12      LEU  97   6.518  17.232   9.341
    8   HD13  LEU  97          HD13      LEU  97   5.447  16.762   8.021
    9   HD23  LEU  97          HD21      LEU  97   4.416  18.290  11.050
   10   HD22  LEU  97          HD22      LEU  97   4.012  19.897  10.449
   11   HD21  LEU  97          HD23      LEU  97   5.691  19.479  10.784

  No H/Q in entry =          11
  In of MODEL   47
    1    H    HIS  98           H        HIS  98   6.448  21.210   5.664
    2    HA   HIS  98           HA       HIS  98   8.587  22.816   6.553
    3    HB2  HIS  98           HB2      HIS  98   7.281  22.547   3.834
    4    HB3  HIS  98           HB3      HIS  98   8.710  23.544   4.118
    5    HD1  HIS  98           HD1      HIS  98   7.544  19.958   4.140
    6    HD2  HIS  98           HD2      HIS  98  11.101  22.098   4.547
    7    HE1  HIS  98           HE1      HIS  98   9.420  18.252   4.071
    8    HE2  HIS  98           HE2      HIS  98  11.590  19.535   4.318

  No H/Q in entry =           8
  In of MODEL   47
    1    H    GLU  99           H        GLU  99   5.349  23.612   5.397
    2    HA   GLU  99           HA       GLU  99   5.693  26.431   5.340
    3    HB2  GLU  99           HB2      GLU  99   3.822  25.240   4.219
    4    HB3  GLU  99           HB3      GLU  99   3.139  24.868   5.802
    5    HG2  GLU  99           HG2      GLU  99   2.932  27.257   6.306
    6    HG3  GLU  99           HG3      GLU  99   3.695  27.668   4.773

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LYS 100           H        LYS 100   4.604  24.179   7.866
    2    HA   LYS 100           HA       LYS 100   4.003  26.224   9.766
    3    HB2  LYS 100           HB2      LYS 100   4.617  23.280  10.104
    4    HB3  LYS 100           HB3      LYS 100   4.164  24.345  11.441
    5    HG2  LYS 100           HG2      LYS 100   2.083  24.959  10.205
    6    HG3  LYS 100           HG3      LYS 100   2.517  23.797   8.949
    7    HD2  LYS 100           HD2      LYS 100   2.471  21.973  10.608
    8    HD3  LYS 100           HD3      LYS 100   2.054  23.129  11.876
    9    HE2  LYS 100           HE2      LYS 100  -0.013  23.727  10.625
   10    HE3  LYS 100           HE3      LYS 100   0.395  22.514   9.406
   11    HZ1  LYS 100           HZ1      LYS 100   0.153  21.841  12.287
   12    HZ3  LYS 100           HZ2      LYS 100   0.143  20.788  10.951
   13    HZ2  LYS 100           HZ3      LYS 100  -1.183  21.811  11.240

  No H/Q in entry =          13
  In of MODEL   47
    1    H    LEU 101           H        LEU 101   6.943  24.465   8.913
    2    HA   LEU 101           HA       LEU 101   8.544  25.321  11.108
    3    HB2  LEU 101           HB2      LEU 101   9.135  24.345   8.326
    4    HB3  LEU 101           HB3      LEU 101  10.434  25.025   9.300
    5    HG   LEU 101           HG       LEU 101   8.634  22.846  10.372
    6   HD12  LEU 101          HD11      LEU 101  10.703  21.376   9.750
    7   HD11  LEU 101          HD12      LEU 101  11.048  22.645   8.577
    8   HD13  LEU 101          HD13      LEU 101   9.529  21.754   8.491
    9   HD21  LEU 101          HD21      LEU 101  11.349  23.985  11.085
   10   HD23  LEU 101          HD22      LEU 101  10.828  22.406  11.666
   11   HD22  LEU 101          HD23      LEU 101   9.921  23.851  12.111

  No H/Q in entry =          11
  In of MODEL   47
    1    H    LYS 102           H        LYS 102   6.927  27.169   8.979
    2    HA   LYS 102           HA       LYS 102   6.976  29.462   8.689
    3    HB2  LYS 102           HB2      LYS 102   8.553  29.363  10.779
    4    HB3  LYS 102           HB3      LYS 102   9.844  29.574   9.612
    5    HG2  LYS 102           HG2      LYS 102   7.721  31.501  10.488
    6    HG3  LYS 102           HG3      LYS 102   9.428  31.782  10.227
    7    HD2  LYS 102           HD2      LYS 102   7.469  31.339   7.938
    8    HD3  LYS 102           HD3      LYS 102   7.838  32.922   8.606
    9    HE2  LYS 102           HE2      LYS 102   9.212  31.756   6.523
   10    HE3  LYS 102           HE3      LYS 102   9.819  33.068   7.533
   11    HZ2  LYS 102           HZ1      LYS 102  11.361  31.182   7.347
   12    HZ1  LYS 102           HZ2      LYS 102  10.215  30.185   8.094
   13    HZ3  LYS 102           HZ3      LYS 102  10.897  31.479   8.951

  No H/Q in entry =          13
  In of MODEL   47
    1    H    ALA 103           H        ALA 103  10.245  28.162   8.105
    2    HA   ALA 103           HA       ALA 103  11.181  29.552   6.025
    3    HB2  ALA 103           HB1      ALA 103  12.086  27.350   5.089
    4    HB1  ALA 103           HB2      ALA 103  11.208  26.564   6.400
    5    HB3  ALA 103           HB3      ALA 103  12.486  27.722   6.767

  No H/Q in entry =           5
  In of MODEL   47
    1    H1   LYS   3           H1       LYS   3 -30.858   6.222 -19.846
    2    H2   LYS   3           H3       LYS   3 -29.869   5.891 -21.186
    3    H3   LYS   3           H2       LYS   3 -31.283   4.989 -20.931
    4    HA   LYS   3           HA       LYS   3 -30.317   3.602 -19.499
    5    HB2  LYS   3           HB2      LYS   3 -28.000   4.945 -20.842
    6    HB3  LYS   3           HB3      LYS   3 -27.707   3.752 -19.577
    7    HG2  LYS   3           HG2      LYS   3 -29.154   2.173 -20.909
    8    HG3  LYS   3           HG3      LYS   3 -29.078   3.350 -22.219
    9    HD2  LYS   3           HD2      LYS   3 -26.598   3.186 -22.153
   10    HD3  LYS   3           HD3      LYS   3 -26.750   1.911 -20.945
   11    HE2  LYS   3           HE2      LYS   3 -28.263   0.737 -22.651
   12    HE3  LYS   3           HE3      LYS   3 -27.613   1.884 -23.823
   13    HZ3  LYS   3           HZ1      LYS   3 -25.840   0.615 -24.063
   14    HZ2  LYS   3           HZ2      LYS   3 -26.499  -0.524 -22.987
   15    HZ1  LYS   3           HZ3      LYS   3 -25.487   0.710 -22.405

  No H/Q in entry =          15
  In of MODEL   47
    1    H    LYS   4           H        LYS   4 -30.383   3.496 -17.436
    2    HA   LYS   4           HA       LYS   4 -29.613   5.793 -15.819
    3    HB2  LYS   4           HB2      LYS   4 -30.875   3.138 -15.082
    4    HB3  LYS   4           HB3      LYS   4 -30.631   4.489 -13.976
    5    HG2  LYS   4           HG2      LYS   4 -32.427   4.427 -16.407
    6    HG3  LYS   4           HG3      LYS   4 -32.925   4.515 -14.718
    7    HD2  LYS   4           HD2      LYS   4 -32.182   6.727 -14.484
    8    HD3  LYS   4           HD3      LYS   4 -31.138   6.622 -15.901
    9    HE2  LYS   4           HE2      LYS   4 -33.030   8.029 -16.396
   10    HE3  LYS   4           HE3      LYS   4 -33.137   6.544 -17.340
   11    HZ3  LYS   4           HZ1      LYS   4 -34.741   5.691 -15.787
   12    HZ2  LYS   4           HZ2      LYS   4 -35.260   7.189 -16.399
   13    HZ1  LYS   4           HZ3      LYS   4 -34.614   7.089 -14.831

  No H/Q in entry =          13
  In of MODEL   47
    1    H    HIS   5           H        HIS   5 -28.151   5.871 -14.221
    2    HA   HIS   5           HA       HIS   5 -25.909   3.986 -14.511
    3    HB2  HIS   5           HB2      HIS   5 -26.107   6.765 -13.350
    4    HB3  HIS   5           HB3      HIS   5 -24.648   5.777 -13.310
    5    HD1  HIS   5           HD1      HIS   5 -23.142   6.917 -14.911
    6    HD2  HIS   5           HD2      HIS   5 -26.949   6.358 -16.475
    7    HE1  HIS   5           HE1      HIS   5 -22.949   7.453 -17.370
    8    HE2  HIS   5           HE2      HIS   5 -25.270   7.101 -18.291

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ILE   6           H        ILE   6 -25.722   2.430 -13.168
    2    HA   ILE   6           HA       ILE   6 -26.705   2.766 -10.413
    3    HB   ILE   6           HB       ILE   6 -25.931   0.256 -11.905
    4   HG12  ILE   6          HG12      ILE   6 -28.655   1.270 -11.085
    5   HG13  ILE   6          HG13      ILE   6 -28.001   1.390 -12.718
    6   HG23  ILE   6          HG21      ILE   6 -26.343  -0.957 -10.027
    7   HG22  ILE   6          HG22      ILE   6 -27.476   0.227  -9.373
    8   HG21  ILE   6          HG23      ILE   6 -25.740   0.524  -9.279
    9   HD13  ILE   6          HD11      ILE   6 -28.509  -0.726 -13.186
   10   HD12  ILE   6          HD12      ILE   6 -29.531  -0.662 -11.750
   11   HD11  ILE   6          HD13      ILE   6 -27.892  -1.306 -11.639

  No H/Q in entry =          11
  In of MODEL   47
    1    H    TYR   7           H        TYR   7 -24.938   3.387  -9.127
    2    HA   TYR   7           HA       TYR   7 -22.247   2.353  -9.777
    3    HB2  TYR   7           HB2      TYR   7 -23.160   4.835  -8.341
    4    HB3  TYR   7           HB3      TYR   7 -21.488   4.278  -8.361
    5    HD1  TYR   7           HD1      TYR   7 -22.534   3.311 -11.442
    6    HD2  TYR   7           HD2      TYR   7 -21.790   6.902  -9.270
    7    HE1  TYR   7           HE1      TYR   7 -22.063   4.494 -13.550
    8    HE2  TYR   7           HE2      TYR   7 -21.360   8.093 -11.371
    9    HH   TYR   7           HH       TYR   7 -21.569   7.975 -13.602

  No H/Q in entry =           9
  In of MODEL   47
    1    H    LEU   8           H        LEU   8 -21.321   1.001  -8.420
    2    HA   LEU   8           HA       LEU   8 -22.477   0.578  -5.735
    3    HB2  LEU   8           HB2      LEU   8 -20.805  -1.156  -7.533
    4    HB3  LEU   8           HB3      LEU   8 -21.009  -1.505  -5.816
    5    HG   LEU   8           HG       LEU   8 -23.490  -1.625  -6.249
    6   HD13  LEU   8          HD11      LEU   8 -23.580  -0.440  -8.379
    7   HD12  LEU   8          HD12      LEU   8 -24.149  -2.095  -8.595
    8   HD11  LEU   8          HD13      LEU   8 -22.527  -1.644  -9.120
    9   HD23  LEU   8          HD21      LEU   8 -22.257  -3.723  -7.903
   10   HD22  LEU   8          HD22      LEU   8 -23.355  -3.842  -6.528
   11   HD21  LEU   8          HD23      LEU   8 -21.641  -3.526  -6.263

  No H/Q in entry =          11
  In of MODEL   47
    1    H    PHE   9           H        PHE   9 -21.210   0.996  -3.950
    2    HA   PHE   9           HA       PHE   9 -18.401   1.854  -4.469
    3    HB2  PHE   9           HB2      PHE   9 -20.414   3.013  -2.549
    4    HB3  PHE   9           HB3      PHE   9 -18.695   3.379  -2.497
    5    HD1  PHE   9           HD1      PHE   9 -17.618   4.645  -4.284
    6    HD2  PHE   9           HD2      PHE   9 -21.832   3.839  -4.369
    7    HE1  PHE   9           HE1      PHE   9 -17.904   6.325  -6.081
    8    HE2  PHE   9           HE2      PHE   9 -22.117   5.532  -6.161
    9    HZ   PHE   9           HZ       PHE   9 -20.151   6.770  -7.023

  No H/Q in entry =           9
  In of MODEL   47
    1    H    SER  10           H        SER  10 -16.839   0.878  -3.338
    2    HA   SER  10           HA       SER  10 -17.076   0.055  -0.625
    3    HB2  SER  10           HB2      SER  10 -18.350  -1.803  -1.630
    4    HB3  SER  10           HB3      SER  10 -17.003  -2.131  -2.708
    5    HG   SER  10           HG       SER  10 -17.330  -3.207  -0.444

  No H/Q in entry =           5
  In of MODEL   47
    1    H    SER  11           H        SER  11 -15.061   0.158   0.203
    2    HA   SER  11           HA       SER  11 -12.850   0.894  -1.352
    3    HB2  SER  11           HB2      SER  11 -13.331   1.094   1.217
    4    HB3  SER  11           HB3      SER  11 -12.456  -0.437   1.288
    5    HG   SER  11           HG       SER  11 -10.782   0.856   1.259

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA  12           H        ALA  12 -14.131  -1.779  -2.086
    2    HA   ALA  12           HA       ALA  12 -11.597  -3.129  -2.575
    3    HB1  ALA  12           HB1      ALA  12 -13.847  -4.771  -1.428
    4    HB3  ALA  12           HB2      ALA  12 -12.616  -4.044  -0.395
    5    HB2  ALA  12           HB3      ALA  12 -12.149  -5.212  -1.631

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLY  13           H        GLY  13 -12.378  -2.128  -4.633
    2    HA3  GLY  13           HA2      GLY  13 -14.638  -2.911  -6.065
    3    HA2  GLY  13           HA3      GLY  13 -13.113  -2.402  -6.804

  No H/Q in entry =           3
  In of MODEL   47
    1    H    MET  14           H        MET  14 -11.569  -4.625  -5.715
    2    HA   MET  14           HA       MET  14 -11.757  -6.434  -7.817
    3    HB2  MET  14           HB2      MET  14  -9.810  -6.309  -6.238
    4    HB3  MET  14           HB3      MET  14 -10.751  -7.230  -5.065
    5    HG2  MET  14           HG2      MET  14  -9.544  -8.916  -6.149
    6    HG3  MET  14           HG3      MET  14 -11.042  -8.917  -7.079
    7    HE1  MET  14           HE1      MET  14  -7.480  -7.460  -6.755
    8    HE3  MET  14           HE2      MET  14  -6.840  -7.863  -8.347
    9    HE2  MET  14           HE3      MET  14  -7.441  -9.145  -7.298

  No H/Q in entry =           9
  In of MODEL   47
    1    H    SER  15           H        SER  15 -13.329  -6.727  -4.651
    2    HA   SER  15           HA       SER  15 -14.533  -9.275  -5.448
    3    HB2  SER  15           HB2      SER  15 -14.681  -7.678  -2.900
    4    HB3  SER  15           HB3      SER  15 -15.855  -8.946  -3.240
    5    HG   SER  15           HG       SER  15 -14.141  -9.886  -2.176

  No H/Q in entry =           5
  In of MODEL   47
    1    H    THR  16           H        THR  16 -15.594  -5.901  -4.951
    2    HA   THR  16           HA       THR  16 -18.391  -6.364  -5.452
    3    HB   THR  16           HB       THR  16 -16.801  -3.833  -6.000
    4    HG1  THR  16           HG1      THR  16 -16.358  -4.082  -3.947
    5   HG22  THR  16          HG21      THR  16 -18.988  -2.782  -5.377
    6   HG21  THR  16          HG22      THR  16 -19.703  -4.404  -5.322
    7   HG23  THR  16          HG23      THR  16 -19.070  -3.755  -6.841

  No H/Q in entry =           7
  In of MODEL   47
    1    H    SER  17           H        SER  17 -15.577  -5.872  -7.322
    2    HA   SER  17           HA       SER  17 -16.672  -5.148  -9.842
    3    HB2  SER  17           HB2      SER  17 -14.078  -6.514  -9.098
    4    HB3  SER  17           HB3      SER  17 -14.499  -6.103 -10.760
    5    HG   SER  17           HG       SER  17 -14.807  -4.060  -8.944

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU  18           H        LEU  18 -16.185  -8.281  -8.338
    2    HA   LEU  18           HA       LEU  18 -16.792  -9.806 -10.672
    3    HB2  LEU  18           HB2      LEU  18 -15.607 -10.761  -8.743
    4    HB3  LEU  18           HB3      LEU  18 -17.039 -10.520  -7.744
    5    HG   LEU  18           HG       LEU  18 -18.293 -12.096  -9.117
    6   HD13  LEU  18          HD11      LEU  18 -17.457 -11.915 -11.289
    7   HD12  LEU  18          HD12      LEU  18 -16.794 -13.462 -10.762
    8   HD11  LEU  18          HD13      LEU  18 -15.781 -12.021 -10.757
    9   HD21  LEU  18          HD21      LEU  18 -15.638 -13.102  -8.142
   10   HD23  LEU  18          HD22      LEU  18 -17.005 -14.131  -8.572
   11   HD22  LEU  18          HD23      LEU  18 -17.148 -12.989  -7.236

  No H/Q in entry =          11
  In of MODEL   47
    1    H    LEU  19           H        LEU  19 -18.749  -8.508  -7.994
    2    HA   LEU  19           HA       LEU  19 -21.233  -9.648  -8.824
    3    HB2  LEU  19           HB2      LEU  19 -20.936  -8.772  -6.581
    4    HB3  LEU  19           HB3      LEU  19 -20.652  -7.156  -7.228
    5    HG   LEU  19           HG       LEU  19 -22.965  -6.952  -7.871
    6   HD12  LEU  19          HD11      LEU  19 -24.503  -8.867  -6.972
    7   HD11  LEU  19          HD12      LEU  19 -23.050  -9.851  -7.131
    8   HD13  LEU  19          HD13      LEU  19 -23.723  -9.039  -8.544
    9   HD23  LEU  19          HD21      LEU  19 -24.000  -7.182  -5.586
   10   HD22  LEU  19          HD22      LEU  19 -22.504  -6.252  -5.667
   11   HD21  LEU  19          HD23      LEU  19 -22.480  -7.911  -5.066

  No H/Q in entry =          11
  In of MODEL   47
    1    H    VAL  20           H        VAL  20 -19.661  -6.534  -9.561
    2    HA   VAL  20           HA       VAL  20 -21.738  -5.471 -11.160
    3    HB   VAL  20           HB       VAL  20 -18.735  -4.953 -11.302
    4   HG13  VAL  20          HG11      VAL  20 -19.702  -4.372 -13.457
    5   HG12  VAL  20          HG12      VAL  20 -19.366  -2.890 -12.562
    6   HG11  VAL  20          HG13      VAL  20 -21.016  -3.500 -12.668
    7   HG23  VAL  20          HG21      VAL  20 -19.586  -2.726 -10.309
    8   HG22  VAL  20          HG22      VAL  20 -19.445  -4.135  -9.260
    9   HG21  VAL  20          HG23      VAL  20 -21.023  -3.656  -9.883

  No H/Q in entry =           9
  In of MODEL   47
    1    H    SER  21           H        SER  21 -19.022  -7.601 -12.135
    2    HA   SER  21           HA       SER  21 -19.787  -7.518 -14.893
    3    HB2  SER  21           HB2      SER  21 -18.391  -9.516 -15.188
    4    HB3  SER  21           HB3      SER  21 -17.542  -8.281 -14.261
    5    HG   SER  21           HG       SER  21 -17.754  -9.442 -12.469

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LYS  22           H        LYS  22 -20.918  -9.635 -12.293
    2    HA   LYS  22           HA       LYS  22 -22.483 -11.249 -14.097
    3    HB2  LYS  22           HB2      LYS  22 -22.797 -10.840 -11.120
    4    HB3  LYS  22           HB3      LYS  22 -23.608 -12.074 -12.081
    5    HG2  LYS  22           HG2      LYS  22 -20.623 -11.886 -11.713
    6    HG3  LYS  22           HG3      LYS  22 -21.686 -12.928 -10.769
    7    HD2  LYS  22           HD2      LYS  22 -22.373 -14.069 -12.852
    8    HD3  LYS  22           HD3      LYS  22 -21.235 -13.063 -13.751
    9    HE2  LYS  22           HE2      LYS  22 -19.370 -14.014 -12.478
   10    HE3  LYS  22           HE3      LYS  22 -20.496 -14.996 -11.540
   11    HZ2  LYS  22           HZ1      LYS  22 -19.323 -15.527 -14.060
   12    HZ1  LYS  22           HZ2      LYS  22 -21.017 -15.574 -14.177
   13    HZ3  LYS  22           HZ3      LYS  22 -20.216 -16.559 -13.049

  No H/Q in entry =          13
  In of MODEL   47
    1    H    MET  23           H        MET  23 -23.148  -8.280 -12.281
    2    HA   MET  23           HA       MET  23 -25.954  -8.299 -12.805
    3    HB2  MET  23           HB2      MET  23 -24.055  -6.027 -12.259
    4    HB3  MET  23           HB3      MET  23 -25.794  -5.818 -12.451
    5    HG2  MET  23           HG2      MET  23 -26.229  -7.079 -10.463
    6    HG3  MET  23           HG3      MET  23 -24.530  -7.530 -10.319
    7    HE2  MET  23           HE1      MET  23 -26.746  -3.804  -9.206
    8    HE1  MET  23           HE2      MET  23 -27.016  -4.791 -10.641
    9    HE3  MET  23           HE3      MET  23 -25.946  -3.390 -10.723

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ARG  24           H        ARG  24 -23.155  -6.968 -14.594
    2    HA   ARG  24           HA       ARG  24 -24.607  -5.665 -16.625
    3    HB2  ARG  24           HB2      ARG  24 -22.152  -5.333 -16.222
    4    HB3  ARG  24           HB3      ARG  24 -21.861  -6.938 -16.846
    5    HG2  ARG  24           HG2      ARG  24 -22.729  -6.244 -19.087
    6    HG3  ARG  24           HG3      ARG  24 -22.990  -4.604 -18.436
    7    HD2  ARG  24           HD2      ARG  24 -20.530  -4.622 -17.733
    8    HD3  ARG  24           HD3      ARG  24 -20.373  -6.095 -18.682
    9    HE   ARG  24           HE       ARG  24 -21.364  -4.414 -20.497
   10   HH21  ARG  24          HH11      ARG  24 -19.821  -4.369 -22.131
   11   HH22  ARG  24          HH12      ARG  24 -18.200  -3.892 -21.765
   12   HH11  ARG  24          HH21      ARG  24 -18.839  -3.986 -18.285
   13   HH12  ARG  24          HH22      ARG  24 -17.631  -3.658 -19.488

  No H/Q in entry =          13
  In of MODEL   47
    1    H    ALA  25           H        ALA  25 -23.572  -9.025 -16.287
    2    HA   ALA  25           HA       ALA  25 -24.205  -9.882 -18.914
    3    HB1  ALA  25           HB1      ALA  25 -23.565 -11.920 -18.182
    4    HB3  ALA  25           HB2      ALA  25 -24.630 -11.850 -16.779
    5    HB2  ALA  25           HB3      ALA  25 -23.055 -11.062 -16.729

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLN  26           H        GLN  26 -26.051  -9.825 -15.904
    2    HA   GLN  26           HA       GLN  26 -28.418 -10.984 -16.917
    3    HB2  GLN  26           HB2      GLN  26 -27.876  -9.213 -14.554
    4    HB3  GLN  26           HB3      GLN  26 -29.455  -9.901 -14.904
    5    HG2  GLN  26           HG2      GLN  26 -26.911 -11.416 -14.395
    6    HG3  GLN  26           HG3      GLN  26 -28.275 -11.261 -13.296
    7   HE21  GLN  26          HE21      GLN  26 -27.106 -13.475 -14.529
    8   HE22  GLN  26          HE22      GLN  26 -28.170 -14.508 -15.317

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ALA  27           H        ALA  27 -27.399  -7.606 -16.572
    2    HA   ALA  27           HA       ALA  27 -29.853  -6.461 -17.390
    3    HB1  ALA  27           HB1      ALA  27 -28.017  -5.177 -16.283
    4    HB3  ALA  27           HB2      ALA  27 -28.578  -4.418 -17.774
    5    HB2  ALA  27           HB3      ALA  27 -27.066  -5.325 -17.761

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLU  28           H        GLU  28 -27.174  -7.783 -19.222
    2    HA   GLU  28           HA       GLU  28 -28.064  -6.758 -21.762
    3    HB2  GLU  28           HB2      GLU  28 -25.708  -7.493 -21.112
    4    HB3  GLU  28           HB3      GLU  28 -26.295  -9.145 -21.292
    5    HG2  GLU  28           HG2      GLU  28 -25.116  -8.429 -23.265
    6    HG3  GLU  28           HG3      GLU  28 -26.819  -8.714 -23.620

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LYS  29           H        LYS  29 -28.323  -9.833 -20.060
    2    HA   LYS  29           HA       LYS  29 -29.651 -11.299 -22.052
    3    HB2  LYS  29           HB2      LYS  29 -28.641 -12.279 -20.027
    4    HB3  LYS  29           HB3      LYS  29 -29.899 -11.524 -19.051
    5    HG2  LYS  29           HG2      LYS  29 -31.589 -12.869 -20.109
    6    HG3  LYS  29           HG3      LYS  29 -30.400 -13.552 -21.215
    7    HD2  LYS  29           HD2      LYS  29 -29.300 -14.722 -19.458
    8    HD3  LYS  29           HD3      LYS  29 -30.193 -13.839 -18.221
    9    HE2  LYS  29           HE2      LYS  29 -31.003 -16.172 -18.554
   10    HE3  LYS  29           HE3      LYS  29 -32.248 -14.950 -18.823
   11    HZ1  LYS  29           HZ1      LYS  29 -31.671 -15.135 -21.245
   12    HZ3  LYS  29           HZ2      LYS  29 -32.432 -16.493 -20.564
   13    HZ2  LYS  29           HZ3      LYS  29 -30.759 -16.512 -20.851

  No H/Q in entry =          13
  In of MODEL   47
    1    H    TYR  30           H        TYR  30 -31.003  -9.121 -19.589
    2    HA   TYR  30           HA       TYR  30 -33.669  -9.519 -20.842
    3    HB2  TYR  30           HB2      TYR  30 -33.004  -8.342 -18.134
    4    HB3  TYR  30           HB3      TYR  30 -34.623  -8.567 -18.794
    5    HD1  TYR  30           HD1      TYR  30 -35.591 -10.838 -18.980
    6    HD2  TYR  30           HD2      TYR  30 -31.751 -10.190 -17.261
    7    HE1  TYR  30           HE1      TYR  30 -35.568 -13.155 -18.149
    8    HE2  TYR  30           HE2      TYR  30 -31.727 -12.493 -16.433
    9    HH   TYR  30           HH       TYR  30 -33.420 -14.827 -17.503

  No H/Q in entry =           9
  In of MODEL   47
    1    H    GLU  31           H        GLU  31 -31.446  -7.597 -21.657
    2    HA   GLU  31           HA       GLU  31 -31.312  -5.455 -22.511
    3    HB2  GLU  31           HB2      GLU  31 -34.221  -6.103 -23.032
    4    HB3  GLU  31           HB3      GLU  31 -33.340  -4.768 -23.776
    5    HG2  GLU  31           HG2      GLU  31 -31.898  -6.261 -24.936
    6    HG3  GLU  31           HG3      GLU  31 -32.505  -7.646 -24.031

  No H/Q in entry =           6
  In of MODEL   47
    1    H    VAL  32           H        VAL  32 -31.525  -5.308 -19.781
    2    HA   VAL  32           HA       VAL  32 -33.339  -3.138 -19.166
    3    HB   VAL  32           HB       VAL  32 -30.982  -4.168 -17.554
    4   HG12  VAL  32          HG11      VAL  32 -32.509  -3.278 -15.682
    5   HG11  VAL  32          HG12      VAL  32 -33.311  -2.372 -16.964
    6   HG13  VAL  32          HG13      VAL  32 -31.598  -2.107 -16.637
    7   HG21  VAL  32          HG21      VAL  32 -32.788  -5.853 -18.230
    8   HG23  VAL  32          HG22      VAL  32 -33.815  -4.984 -17.089
    9   HG22  VAL  32          HG23      VAL  32 -32.320  -5.736 -16.533

  No H/Q in entry =           9
  In of MODEL   47
    1    HA   PRO  33           HA       PRO  33 -30.223  -0.312 -20.861
    2    HB2  PRO  33           HB2      PRO  33 -31.680   1.950 -20.780
    3    HB3  PRO  33           HB3      PRO  33 -32.173   0.644 -21.858
    4    HG2  PRO  33           HG2      PRO  33 -33.147   1.225 -19.060
    5    HG3  PRO  33           HG3      PRO  33 -34.106   1.019 -20.525
    6    HD2  PRO  33           HD2      PRO  33 -33.713  -1.039 -18.827
    7    HD3  PRO  33           HD3      PRO  33 -33.769  -1.305 -20.569

  No H/Q in entry =           7
  In of MODEL   47
    1    H    VAL  34           H        VAL  34 -28.986  -0.857 -18.896
    2    HA   VAL  34           HA       VAL  34 -28.654   1.584 -17.281
    3    HB   VAL  34           HB       VAL  34 -28.121   0.137 -15.319
    4   HG12  VAL  34          HG11      VAL  34 -30.556  -0.673 -15.015
    5   HG11  VAL  34          HG12      VAL  34 -30.843   0.072 -16.587
    6   HG13  VAL  34          HG13      VAL  34 -30.276   1.054 -15.236
    7   HG21  VAL  34          HG21      VAL  34 -28.342  -1.913 -17.299
    8   HG23  VAL  34          HG22      VAL  34 -29.416  -2.228 -15.935
    9   HG22  VAL  34          HG23      VAL  34 -27.694  -1.980 -15.661

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ILE  35           H        ILE  35 -26.673   1.983 -16.434
    2    HA   ILE  35           HA       ILE  35 -24.392   0.581 -17.663
    3    HB   ILE  35           HB       ILE  35 -24.728   3.491 -16.896
    4   HG12  ILE  35          HG12      ILE  35 -23.761   2.125 -19.415
    5   HG13  ILE  35          HG13      ILE  35 -25.378   2.787 -19.175
    6   HG21  ILE  35          HG21      ILE  35 -22.201   1.893 -17.165
    7   HG23  ILE  35          HG22      ILE  35 -22.635   3.101 -15.957
    8   HG22  ILE  35          HG23      ILE  35 -22.230   3.602 -17.598
    9   HD11  ILE  35          HD11      ILE  35 -23.928   4.956 -18.596
   10   HD13  ILE  35          HD12      ILE  35 -24.463   4.562 -20.230
   11   HD12  ILE  35          HD13      ILE  35 -22.824   4.161 -19.719

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ILE  36           H        ILE  36 -23.197  -0.448 -16.041
    2    HA   ILE  36           HA       ILE  36 -23.641   0.218 -13.183
    3    HB   ILE  36           HB       ILE  36 -22.871  -2.519 -14.246
    4   HG12  ILE  36          HG12      ILE  36 -25.663  -1.636 -13.512
    5   HG13  ILE  36          HG13      ILE  36 -25.080  -1.653 -15.177
    6   HG23  ILE  36          HG21      ILE  36 -23.255  -3.308 -12.123
    7   HG22  ILE  36          HG22      ILE  36 -24.354  -1.992 -11.711
    8   HG21  ILE  36          HG23      ILE  36 -22.615  -1.702 -11.774
    9   HD13  ILE  36          HD11      ILE  36 -25.298  -3.865 -15.353
   10   HD12  ILE  36          HD12      ILE  36 -26.368  -3.698 -13.962
   11   HD11  ILE  36          HD13      ILE  36 -24.682  -4.154 -13.726

  No H/Q in entry =          11
  In of MODEL   47
    1    H    GLU  37           H        GLU  37 -21.853   0.822 -12.075
    2    HA   GLU  37           HA       GLU  37 -19.176  -0.051 -12.962
    3    HB2  GLU  37           HB2      GLU  37 -20.004   2.769 -12.298
    4    HB3  GLU  37           HB3      GLU  37 -18.330   2.231 -12.432
    5    HG2  GLU  37           HG2      GLU  37 -18.630   1.776 -14.777
    6    HG3  GLU  37           HG3      GLU  37 -20.337   2.204 -14.667

  No H/Q in entry =           6
  In of MODEL   47
    1    H    ALA  38           H        ALA  38 -17.705  -0.299 -11.266
    2    HA   ALA  38           HA       ALA  38 -18.749  -0.057  -8.505
    3    HB1  ALA  38           HB1      ALA  38 -17.072  -2.056  -9.892
    4    HB3  ALA  38           HB2      ALA  38 -18.136  -2.247  -8.498
    5    HB2  ALA  38           HB3      ALA  38 -16.510  -1.598  -8.283

  No H/Q in entry =           5
  In of MODEL   47
    1    H    PHE  39           H        PHE  39 -17.491   1.145  -7.041
    2    HA   PHE  39           HA       PHE  39 -14.934   2.277  -7.938
    3    HB2  PHE  39           HB2      PHE  39 -17.334   3.825  -6.991
    4    HB3  PHE  39           HB3      PHE  39 -15.697   4.461  -6.840
    5    HD1  PHE  39           HD1      PHE  39 -14.321   4.753  -8.924
    6    HD2  PHE  39           HD2      PHE  39 -18.517   3.995  -8.988
    7    HE1  PHE  39           HE1      PHE  39 -14.431   5.629 -11.240
    8    HE2  PHE  39           HE2      PHE  39 -18.643   4.859 -11.298
    9    HZ   PHE  39           HZ       PHE  39 -16.599   5.649 -12.442

  No H/Q in entry =           9
  In of MODEL   47
    1    HA   PRO  40           HA       PRO  40 -14.039   1.565  -3.635
    2    HB2  PRO  40           HB2      PRO  40 -12.232   3.547  -3.045
    3    HB3  PRO  40           HB3      PRO  40 -11.811   2.194  -4.095
    4    HG2  PRO  40           HG2      PRO  40 -12.775   4.940  -4.880
    5    HG3  PRO  40           HG3      PRO  40 -11.360   4.065  -5.465
    6    HD2  PRO  40           HD2      PRO  40 -13.575   3.994  -6.894
    7    HD3  PRO  40           HD3      PRO  40 -12.650   2.511  -6.668

  No H/Q in entry =           7
  In of MODEL   47
    1    H    GLU  41           H        GLU  41 -14.653   2.587  -1.523
    2    HA   GLU  41           HA       GLU  41 -16.860   4.336  -1.546
    3    HB2  GLU  41           HB2      GLU  41 -16.741   4.286   0.830
    4    HB3  GLU  41           HB3      GLU  41 -16.263   2.687   0.259
    5    HG2  GLU  41           HG2      GLU  41 -13.906   3.271   0.623
    6    HG3  GLU  41           HG3      GLU  41 -14.400   4.856   1.219

  No H/Q in entry =           6
  In of MODEL   47
    1    H    THR  42           H        THR  42 -13.511   5.183  -1.590
    2    HA   THR  42           HA       THR  42 -13.817   7.768  -0.417
    3    HB   THR  42           HB       THR  42 -11.642   8.280  -1.497
    4    HG1  THR  42           HG1      THR  42 -12.132   5.761  -2.711
    5   HG23  THR  42          HG21      THR  42 -11.668   7.045   0.629
    6   HG22  THR  42          HG22      THR  42 -10.335   6.502  -0.393
    7   HG21  THR  42          HG23      THR  42 -11.793   5.523  -0.254

  No H/Q in entry =           7
  In of MODEL   47
    1    H    LEU  43           H        LEU  43 -14.725   6.648  -3.507
    2    HA   LEU  43           HA       LEU  43 -14.914   9.410  -4.518
    3    HB2  LEU  43           HB2      LEU  43 -15.144   6.707  -5.811
    4    HB3  LEU  43           HB3      LEU  43 -15.637   8.189  -6.628
    5    HG   LEU  43           HG       LEU  43 -12.827   7.594  -5.737
    6   HD11  LEU  43          HD11      LEU  43 -14.324   7.020  -8.246
    7   HD13  LEU  43          HD12      LEU  43 -13.047   6.095  -7.457
    8   HD12  LEU  43          HD13      LEU  43 -12.645   7.547  -8.372
    9   HD22  LEU  43          HD21      LEU  43 -13.047   9.919  -5.884
   10   HD21  LEU  43          HD22      LEU  43 -14.162   9.823  -7.248
   11   HD23  LEU  43          HD23      LEU  43 -12.451   9.467  -7.481

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ALA  44           H        ALA  44 -16.909   7.653  -2.651
    2    HA   ALA  44           HA       ALA  44 -19.380   7.545  -3.988
    3    HB2  ALA  44           HB1      ALA  44 -19.278   6.457  -1.874
    4    HB3  ALA  44           HB2      ALA  44 -20.359   7.828  -1.629
    5    HB1  ALA  44           HB3      ALA  44 -18.690   7.910  -1.067

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLY  45           H        GLY  45 -17.912  10.337  -2.488
    2    HA3  GLY  45           HA2      GLY  45 -20.315  11.882  -2.886
    3    HA2  GLY  45           HA3      GLY  45 -18.762  12.483  -2.308

  No H/Q in entry =           3
  In of MODEL   47
    1    H    GLU  46           H        GLU  46 -17.235  11.481  -4.575
    2    HA   GLU  46           HA       GLU  46 -17.816  13.683  -6.380
    3    HB2  GLU  46           HB2      GLU  46 -15.668  11.556  -6.371
    4    HB3  GLU  46           HB3      GLU  46 -15.760  12.875  -7.539
    5    HG2  GLU  46           HG2      GLU  46 -15.416  13.202  -4.566
    6    HG3  GLU  46           HG3      GLU  46 -14.120  13.291  -5.760

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LYS  47           H        LYS  47 -17.767  10.157  -6.763
    2    HA   LYS  47           HA       LYS  47 -18.844  10.359  -9.448
    3    HB2  LYS  47           HB2      LYS  47 -18.345   7.980  -7.652
    4    HB3  LYS  47           HB3      LYS  47 -18.894   7.880  -9.325
    5    HG2  LYS  47           HG2      LYS  47 -16.321   9.204  -8.541
    6    HG3  LYS  47           HG3      LYS  47 -16.437   7.485  -8.914
    7    HD2  LYS  47           HD2      LYS  47 -17.351   8.018 -11.116
    8    HD3  LYS  47           HD3      LYS  47 -17.248   9.738 -10.745
    9    HE2  LYS  47           HE2      LYS  47 -14.824   9.550 -10.527
   10    HE3  LYS  47           HE3      LYS  47 -14.923   7.826 -10.882
   11    HZ2  LYS  47           HZ1      LYS  47 -14.475   9.651 -12.725
   12    HZ1  LYS  47           HZ2      LYS  47 -16.171   9.628 -12.789
   13    HZ3  LYS  47           HZ3      LYS  47 -15.292   8.198 -13.052

  No H/Q in entry =          13
  In of MODEL   47
    1    H    GLY  48           H        GLY  48 -20.202   9.677  -6.298
    2    HA3  GLY  48           HA2      GLY  48 -22.607   8.530  -7.037
    3    HA2  GLY  48           HA3      GLY  48 -22.369   9.541  -5.610

  No H/Q in entry =           3
  In of MODEL   47
    1    H    GLN  49           H        GLN  49 -21.726  11.927  -7.213
    2    HA   GLN  49           HA       GLN  49 -24.261  13.089  -7.391
    3    HB2  GLN  49           HB2      GLN  49 -21.691  13.880  -8.747
    4    HB3  GLN  49           HB3      GLN  49 -23.134  14.876  -8.687
    5    HG2  GLN  49           HG2      GLN  49 -22.988  14.933  -6.250
    6    HG3  GLN  49           HG3      GLN  49 -21.560  13.915  -6.308
    7   HE21  GLN  49          HE21      GLN  49 -21.404  16.160  -5.068
    8   HE22  GLN  49          HE22      GLN  49 -20.452  17.386  -5.728

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ASN  50           H        ASN  50 -22.607  11.139  -9.739
    2    HA   ASN  50           HA       ASN  50 -24.458  12.019 -11.846
    3    HB2  ASN  50           HB2      ASN  50 -21.910  10.423 -12.041
    4    HB3  ASN  50           HB3      ASN  50 -22.943  10.850 -13.397
    5   HD21  ASN  50          HD21      ASN  50 -20.300  11.665 -11.781
    6   HD22  ASN  50          HD22      ASN  50 -20.029  13.290 -12.146

  No H/Q in entry =           6
  In of MODEL   47
    1    H    ALA  51           H        ALA  51 -24.508   9.697  -9.566
    2    HA   ALA  51           HA       ALA  51 -25.327   7.542 -11.365
    3    HB2  ALA  51           HB1      ALA  51 -24.782   6.207  -9.656
    4    HB3  ALA  51           HB2      ALA  51 -25.893   7.055  -8.581
    5    HB1  ALA  51           HB3      ALA  51 -24.240   7.638  -8.777

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ASP  52           H        ASP  52 -27.355   6.533 -11.222
    2    HA   ASP  52           HA       ASP  52 -29.500   8.422 -10.599
    3    HB2  ASP  52           HB2      ASP  52 -29.353   5.889 -12.230
    4    HB3  ASP  52           HB3      ASP  52 -30.884   6.661 -11.816

  No H/Q in entry =           4
  In of MODEL   47
    1    H    VAL  53           H        VAL  53 -27.969   5.514  -9.530
    2    HA   VAL  53           HA       VAL  53 -29.421   5.711  -7.025
    3    HB   VAL  53           HB       VAL  53 -30.848   4.081  -8.254
    4   HG11  VAL  53          HG11      VAL  53 -29.111   3.161  -9.752
    5   HG13  VAL  53          HG12      VAL  53 -29.978   1.898  -8.878
    6   HG12  VAL  53          HG13      VAL  53 -28.360   2.372  -8.365
    7   HG23  VAL  53          HG21      VAL  53 -30.080   2.112  -6.527
    8   HG22  VAL  53          HG22      VAL  53 -31.183   3.446  -6.186
    9   HG21  VAL  53          HG23      VAL  53 -29.474   3.586  -5.771

  No H/Q in entry =           9
  In of MODEL   47
    1    H    VAL  54           H        VAL  54 -28.128   5.273  -5.355
    2    HA   VAL  54           HA       VAL  54 -25.384   4.353  -5.936
    3    HB   VAL  54           HB       VAL  54 -26.428   6.188  -3.720
    4   HG11  VAL  54          HG11      VAL  54 -23.880   4.707  -3.974
    5   HG13  VAL  54          HG12      VAL  54 -24.626   5.425  -2.546
    6   HG12  VAL  54          HG13      VAL  54 -23.691   6.431  -3.652
    7   HG22  VAL  54          HG21      VAL  54 -25.521   7.966  -4.840
    8   HG21  VAL  54          HG22      VAL  54 -26.083   6.968  -6.181
    9   HG23  VAL  54          HG23      VAL  54 -24.378   6.962  -5.733

  No H/Q in entry =           9
  In of MODEL   47
    1    H    LEU  55           H        LEU  55 -24.839   2.429  -5.261
    2    HA   LEU  55           HA       LEU  55 -26.390   1.185  -3.077
    3    HB2  LEU  55           HB2      LEU  55 -24.846  -0.052  -5.344
    4    HB3  LEU  55           HB3      LEU  55 -25.635  -0.949  -4.047
    5    HG   LEU  55           HG       LEU  55 -27.023   0.639  -6.197
    6   HD13  LEU  55          HD11      LEU  55 -26.758  -1.238  -7.387
    7   HD12  LEU  55          HD12      LEU  55 -27.743  -2.074  -6.185
    8   HD11  LEU  55          HD13      LEU  55 -25.987  -2.047  -6.024
    9   HD23  LEU  55          HD21      LEU  55 -28.373  -1.249  -4.321
   10   HD22  LEU  55          HD22      LEU  55 -29.032   0.135  -5.193
   11   HD21  LEU  55          HD23      LEU  55 -28.015   0.388  -3.776

  No H/Q in entry =          11
  In of MODEL   47
    1    H    LEU  56           H        LEU  56 -25.263   0.592  -1.255
    2    HA   LEU  56           HA       LEU  56 -22.321   0.920  -1.292
    3    HB2  LEU  56           HB2      LEU  56 -24.142   0.786   1.098
    4    HB3  LEU  56           HB3      LEU  56 -22.423   1.175   1.091
    5    HG   LEU  56           HG       LEU  56 -24.677   2.891   0.088
    6   HD11  LEU  56          HD11      LEU  56 -23.586   2.523   2.621
    7   HD13  LEU  56          HD12      LEU  56 -24.542   3.906   2.088
    8   HD12  LEU  56          HD13      LEU  56 -22.782   3.969   2.011
    9   HD23  LEU  56          HD21      LEU  56 -22.692   4.542  -0.118
   10   HD22  LEU  56          HD22      LEU  56 -23.092   3.435  -1.432
   11   HD21  LEU  56          HD23      LEU  56 -21.755   3.067  -0.344

  No H/Q in entry =          11
  In of MODEL   47
    1    H    GLY  57           H        GLY  57 -20.981  -0.734  -0.725
    2    HA3  GLY  57           HA2      GLY  57 -21.964  -3.401  -0.888
    3    HA2  GLY  57           HA3      GLY  57 -20.334  -2.937  -0.406

  No H/Q in entry =           3
  In of MODEL   47
    1    HA   PRO  58           HA       PRO  58 -23.189  -3.854   3.301
    2    HB2  PRO  58           HB2      PRO  58 -22.569  -6.465   3.951
    3    HB3  PRO  58           HB3      PRO  58 -23.938  -6.040   2.923
    4    HG2  PRO  58           HG2      PRO  58 -21.226  -6.996   2.167
    5    HG3  PRO  58           HG3      PRO  58 -22.797  -7.429   1.493
    6    HD2  PRO  58           HD2      PRO  58 -21.138  -5.669   0.253
    7    HD3  PRO  58           HD3      PRO  58 -22.895  -5.543   0.138

  No H/Q in entry =           7
  In of MODEL   47
    1    H    GLN  59           H        GLN  59 -19.826  -4.414   2.723
    2    HA   GLN  59           HA       GLN  59 -19.089  -4.409   5.489
    3    HB2  GLN  59           HB2      GLN  59 -17.319  -3.403   3.277
    4    HB3  GLN  59           HB3      GLN  59 -16.859  -4.161   4.787
    5    HG2  GLN  59           HG2      GLN  59 -16.470  -5.747   3.084
    6    HG3  GLN  59           HG3      GLN  59 -17.917  -6.275   3.927
    7   HE21  GLN  59          HE21      GLN  59 -18.817  -7.184   2.416
    8   HE22  GLN  59          HE22      GLN  59 -19.510  -6.860   0.939

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ILE  60           H        ILE  60 -19.949  -1.869   3.236
    2    HA   ILE  60           HA       ILE  60 -19.063   0.098   5.258
    3    HB   ILE  60           HB       ILE  60 -19.249   1.804   3.402
    4   HG12  ILE  60          HG12      ILE  60 -19.086  -0.464   1.461
    5   HG13  ILE  60          HG13      ILE  60 -20.662   0.131   1.983
    6   HG21  ILE  60          HG21      ILE  60 -17.151   0.566   4.185
    7   HG23  ILE  60          HG22      ILE  60 -17.094   1.471   2.673
    8   HG22  ILE  60          HG23      ILE  60 -17.266  -0.284   2.644
    9   HD12  ILE  60          HD11      ILE  60 -18.578   1.488   0.323
   10   HD11  ILE  60          HD12      ILE  60 -19.655   2.472   1.314
   11   HD13  ILE  60          HD13      ILE  60 -20.323   1.402   0.081

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ALA  61           H        ALA  61 -21.555  -1.429   5.335
    2    HA   ALA  61           HA       ALA  61 -23.739   0.281   4.837
    3    HB1  ALA  61           HB1      ALA  61 -24.998  -1.160   6.177
    4    HB2  ALA  61           HB2      ALA  61 -23.615  -1.567   7.194
    5    HB3  ALA  61           HB3      ALA  61 -23.715  -2.196   5.550

  No H/Q in entry =           5
  In of MODEL   47
    1    H    TYR  62           H        TYR  62 -21.552   0.159   7.651
    2    HA   TYR  62           HA       TYR  62 -23.078   1.877   9.286
    3    HB2  TYR  62           HB2      TYR  62 -21.052   2.254  10.541
    4    HB3  TYR  62           HB3      TYR  62 -21.115   0.558  10.065
    5    HD1  TYR  62           HD1      TYR  62 -19.508  -0.353   8.446
    6    HD2  TYR  62           HD2      TYR  62 -19.333   3.753   9.617
    7    HE1  TYR  62           HE1      TYR  62 -17.283  -0.156   7.405
    8    HE2  TYR  62           HE2      TYR  62 -17.093   3.944   8.579
    9    HH   TYR  62           HH       TYR  62 -15.672   2.933   7.159

  No H/Q in entry =           9
  In of MODEL   47
    1    H    MET  63           H        MET  63 -21.398   2.654   6.428
    2    HA   MET  63           HA       MET  63 -21.167   5.492   7.081
    3    HB2  MET  63           HB2      MET  63 -20.580   3.913   4.575
    4    HB3  MET  63           HB3      MET  63 -20.352   5.657   4.725
    5    HG2  MET  63           HG2      MET  63 -18.651   5.317   6.405
    6    HG3  MET  63           HG3      MET  63 -18.909   3.574   6.342
    7    HE1  MET  63           HE1      MET  63 -18.288   6.659   4.573
    8    HE3  MET  63           HE2      MET  63 -18.305   6.125   2.892
    9    HE2  MET  63           HE3      MET  63 -16.768   6.372   3.723

  No H/Q in entry =           9
  In of MODEL   47
    1    H    LEU  64           H        LEU  64 -23.770   3.685   6.127
    2    HA   LEU  64           HA       LEU  64 -24.932   5.100   4.021
    3    HB2  LEU  64           HB2      LEU  64 -25.858   3.030   4.965
    4    HB3  LEU  64           HB3      LEU  64 -26.302   3.907   6.429
    5    HG   LEU  64           HG       LEU  64 -27.958   5.183   5.171
    6   HD13  LEU  64          HD11      LEU  64 -27.657   5.383   2.937
    7   HD12  LEU  64          HD12      LEU  64 -28.342   3.762   2.813
    8   HD11  LEU  64          HD13      LEU  64 -26.593   3.979   2.877
    9   HD23  LEU  64          HD21      LEU  64 -28.542   2.373   4.462
   10   HD22  LEU  64          HD22      LEU  64 -29.507   3.544   5.359
   11   HD21  LEU  64          HD23      LEU  64 -28.156   2.729   6.147

  No H/Q in entry =          11
  In of MODEL   47
    1    HA   PRO  65           HA       PRO  65 -27.050   8.349   6.711
    2    HB2  PRO  65           HB2      PRO  65 -25.059   8.491   8.975
    3    HB3  PRO  65           HB3      PRO  65 -26.790   8.816   9.006
    4    HG2  PRO  65           HG2      PRO  65 -25.923   6.554   9.971
    5    HG3  PRO  65           HG3      PRO  65 -27.337   6.540   8.918
    6    HD2  PRO  65           HD2      PRO  65 -24.477   5.844   8.242
    7    HD3  PRO  65           HD3      PRO  65 -25.954   4.988   7.799

  No H/Q in entry =           7
  In of MODEL   47
    1    H    GLU  66           H        GLU  66 -23.497   8.205   6.806
    2    HA   GLU  66           HA       GLU  66 -23.127  10.988   6.361
    3    HB2  GLU  66           HB2      GLU  66 -21.369   8.627   5.755
    4    HB3  GLU  66           HB3      GLU  66 -20.875  10.303   5.525
    5    HG2  GLU  66           HG2      GLU  66 -21.090  10.715   7.885
    6    HG3  GLU  66           HG3      GLU  66 -21.660   9.065   8.139

  No H/Q in entry =           6
  In of MODEL   47
    1    H    ILE  67           H        ILE  67 -23.286   8.212   4.150
    2    HA   ILE  67           HA       ILE  67 -22.813   9.875   1.833
    3    HB   ILE  67           HB       ILE  67 -23.788   6.995   2.052
    4   HG12  ILE  67          HG12      ILE  67 -21.123   8.082   1.128
    5   HG13  ILE  67          HG13      ILE  67 -21.438   7.696   2.818
    6   HG21  ILE  67          HG21      ILE  67 -23.669   8.837  -0.201
    7   HG23  ILE  67          HG22      ILE  67 -24.337   7.207  -0.129
    8   HG22  ILE  67          HG23      ILE  67 -22.620   7.442  -0.452
    9   HD12  ILE  67          HD11      ILE  67 -21.051   5.879   0.498
   10   HD11  ILE  67          HD12      ILE  67 -22.088   5.353   1.823
   11   HD13  ILE  67          HD13      ILE  67 -20.405   5.778   2.136

  No H/Q in entry =          11
  In of MODEL   47
    1    H    GLN  68           H        GLN  68 -25.719   8.922   3.465
    2    HA   GLN  68           HA       GLN  68 -27.511   9.871   1.467
    3    HB2  GLN  68           HB2      GLN  68 -27.793   9.565   4.454
    4    HB3  GLN  68           HB3      GLN  68 -29.091  10.180   3.444
    5    HG2  GLN  68           HG2      GLN  68 -29.166   8.132   2.198
    6    HG3  GLN  68           HG3      GLN  68 -27.737   7.529   3.018
    7   HE21  GLN  68          HE21      GLN  68 -29.952   6.228   2.890
    8   HE22  GLN  68          HE22      GLN  68 -30.800   5.817   4.307

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ARG  69           H        ARG  69 -25.876  11.533   4.188
    2    HA   ARG  69           HA       ARG  69 -27.168  14.046   3.738
    3    HB2  ARG  69           HB2      ARG  69 -24.860  13.076   5.354
    4    HB3  ARG  69           HB3      ARG  69 -24.889  14.792   4.970
    5    HG2  ARG  69           HG2      ARG  69 -27.209  14.913   5.926
    6    HG3  ARG  69           HG3      ARG  69 -27.049  13.225   6.427
    7    HD2  ARG  69           HD2      ARG  69 -25.297  15.546   7.316
    8    HD3  ARG  69           HD3      ARG  69 -26.456  14.687   8.316
    9    HE   ARG  69           HE       ARG  69 -23.866  13.669   7.396
   10   HH21  ARG  69          HH11      ARG  69 -23.114  11.901   8.622
   11   HH22  ARG  69          HH12      ARG  69 -24.171  11.132   9.757
   12   HH11  ARG  69          HH21      ARG  69 -26.846  13.230   9.084
   13   HH12  ARG  69          HH22      ARG  69 -26.284  11.882  10.017

  No H/Q in entry =          13
  In of MODEL   47
    1    H    LEU  70           H        LEU  70 -24.331  12.540   2.415
    2    HA   LEU  70           HA       LEU  70 -23.145  14.855   1.219
    3    HB2  LEU  70           HB2      LEU  70 -22.221  12.519   1.854
    4    HB3  LEU  70           HB3      LEU  70 -22.840  12.047   0.272
    5    HG   LEU  70           HG       LEU  70 -21.202  13.357  -0.825
    6   HD11  LEU  70          HD11      LEU  70 -20.371  14.219   1.955
    7   HD13  LEU  70          HD12      LEU  70 -21.030  15.253   0.688
    8   HD12  LEU  70          HD13      LEU  70 -19.437  14.523   0.487
    9   HD22  LEU  70          HD21      LEU  70 -19.820  11.604  -0.558
   10   HD21  LEU  70          HD22      LEU  70 -20.768  11.130   0.851
   11   HD23  LEU  70          HD23      LEU  70 -19.354  12.164   1.046

  No H/Q in entry =          11
  In of MODEL   47
    1    H    LEU  71           H        LEU  71 -25.365  12.359   0.129
    2    HA   LEU  71           HA       LEU  71 -25.834  13.823  -2.412
    3    HB2  LEU  71           HB2      LEU  71 -26.129  10.853  -1.923
    4    HB3  LEU  71           HB3      LEU  71 -26.225  11.694  -3.470
    5    HG   LEU  71           HG       LEU  71 -23.713  11.657  -1.794
    6   HD12  LEU  71          HD11      LEU  71 -23.802   9.995  -4.203
    7   HD11  LEU  71          HD12      LEU  71 -24.838   9.422  -2.897
    8   HD13  LEU  71          HD13      LEU  71 -23.112   9.654  -2.616
    9   HD22  LEU  71          HD21      LEU  71 -23.755  13.453  -3.316
   10   HD21  LEU  71          HD22      LEU  71 -24.276  12.406  -4.635
   11   HD23  LEU  71          HD23      LEU  71 -22.663  12.221  -3.946

  No H/Q in entry =          11
  In of MODEL   47
    1    HA   PRO  72           HA       PRO  72 -29.725  13.530   0.194
    2    HB2  PRO  72           HB2      PRO  72 -30.503  16.115   0.071
    3    HB3  PRO  72           HB3      PRO  72 -29.213  15.639   1.176
    4    HG2  PRO  72           HG2      PRO  72 -28.978  16.786  -1.594
    5    HG3  PRO  72           HG3      PRO  72 -28.202  17.336  -0.109
    6    HD2  PRO  72           HD2      PRO  72 -26.904  15.711  -1.844
    7    HD3  PRO  72           HD3      PRO  72 -26.664  15.562  -0.105

  No H/Q in entry =           7
  In of MODEL   47
    1    H    ASN  73           H        ASN  73 -29.056  14.417  -3.031
    2    HA   ASN  73           HA       ASN  73 -31.920  14.189  -3.673
    3    HB2  ASN  73           HB2      ASN  73 -31.410  15.249  -5.785
    4    HB3  ASN  73           HB3      ASN  73 -30.863  16.232  -4.436
    5   HD21  ASN  73          HD21      ASN  73 -30.054  16.211  -7.108
    6   HD22  ASN  73          HD22      ASN  73 -28.391  15.996  -7.289

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LYS  74           H        LYS  74 -30.015  11.879  -3.205
    2    HA   LYS  74           HA       LYS  74 -30.614  10.464  -5.736
    3    HB2  LYS  74           HB2      LYS  74 -28.100  10.116  -4.096
    4    HB3  LYS  74           HB3      LYS  74 -28.502   9.293  -5.604
    5    HG2  LYS  74           HG2      LYS  74 -28.143  12.256  -5.444
    6    HG3  LYS  74           HG3      LYS  74 -26.802  11.145  -5.725
    7    HD2  LYS  74           HD2      LYS  74 -27.939  10.225  -7.661
    8    HD3  LYS  74           HD3      LYS  74 -29.327  11.273  -7.363
    9    HE2  LYS  74           HE2      LYS  74 -28.035  13.231  -7.829
   10    HE3  LYS  74           HE3      LYS  74 -26.543  12.292  -7.898
   11    HZ2  LYS  74           HZ1      LYS  74 -27.983  12.910 -10.041
   12    HZ1  LYS  74           HZ2      LYS  74 -28.688  11.414  -9.649
   13    HZ3  LYS  74           HZ3      LYS  74 -27.018  11.517  -9.939

  No H/Q in entry =          13
  In of MODEL   47
    1    HA   PRO  75           HA       PRO  75 -32.120   7.572  -2.728
    2    HB2  PRO  75           HB2      PRO  75 -32.494   5.341  -4.279
    3    HB3  PRO  75           HB3      PRO  75 -33.575   6.731  -4.375
    4    HG2  PRO  75           HG2      PRO  75 -31.249   6.031  -6.124
    5    HG3  PRO  75           HG3      PRO  75 -32.880   6.514  -6.587
    6    HD2  PRO  75           HD2      PRO  75 -30.878   8.316  -6.560
    7    HD3  PRO  75           HD3      PRO  75 -32.499   8.776  -6.037

  No H/Q in entry =           7
  In of MODEL   47
    1    H    VAL  76           H        VAL  76 -30.710   6.489  -1.332
    2    HA   VAL  76           HA       VAL  76 -28.280   5.183  -2.406
    3    HB   VAL  76           HB       VAL  76 -28.533   6.698   0.227
    4   HG11  VAL  76          HG11      VAL  76 -26.214   5.313  -1.132
    5   HG13  VAL  76          HG12      VAL  76 -26.933   4.909   0.429
    6   HG12  VAL  76          HG13      VAL  76 -26.036   6.415   0.235
    7   HG22  VAL  76          HG21      VAL  76 -27.799   8.562  -0.684
    8   HG21  VAL  76          HG22      VAL  76 -28.356   7.861  -2.205
    9   HG23  VAL  76          HG23      VAL  76 -26.660   7.724  -1.739

  No H/Q in entry =           9
  In of MODEL   47
    1    H    GLU  77           H        GLU  77 -28.138   3.033  -1.760
    2    HA   GLU  77           HA       GLU  77 -28.964   2.312   0.901
    3    HB2  GLU  77           HB2      GLU  77 -30.622   0.710   0.385
    4    HB3  GLU  77           HB3      GLU  77 -31.117   2.240  -0.342
    5    HG2  GLU  77           HG2      GLU  77 -30.522   1.429  -2.515
    6    HG3  GLU  77           HG3      GLU  77 -29.933  -0.078  -1.815

  No H/Q in entry =           6
  In of MODEL   47
    1    H    VAL  78           H        VAL  78 -28.709   0.225   1.593
    2    HA   VAL  78           HA       VAL  78 -26.066  -0.646   0.733
    3    HB   VAL  78           HB       VAL  78 -27.814  -1.438   3.101
    4   HG11  VAL  78          HG11      VAL  78 -25.511  -2.760   2.009
    5   HG13  VAL  78          HG12      VAL  78 -26.441  -3.179   3.449
    6   HG12  VAL  78          HG13      VAL  78 -25.085  -2.059   3.569
    7   HG22  VAL  78          HG21      VAL  78 -26.318  -0.103   4.427
    8   HG21  VAL  78          HG22      VAL  78 -27.016   0.871   3.133
    9   HG23  VAL  78          HG23      VAL  78 -25.356   0.286   3.001

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ILE  79           H        ILE  79 -25.586  -2.585  -0.141
    2    HA   ILE  79           HA       ILE  79 -27.688  -4.015  -1.478
    3    HB   ILE  79           HB       ILE  79 -24.716  -4.636  -1.231
    4   HG12  ILE  79          HG12      ILE  79 -26.304  -3.514  -3.546
    5   HG13  ILE  79          HG13      ILE  79 -25.403  -2.515  -2.403
    6   HG22  ILE  79          HG21      ILE  79 -25.844  -5.814  -3.538
    7   HG21  ILE  79          HG22      ILE  79 -26.853  -6.282  -2.169
    8   HG23  ILE  79          HG23      ILE  79 -25.122  -6.617  -2.144
    9   HD13  ILE  79          HD11      ILE  79 -23.984  -2.703  -4.211
   10   HD12  ILE  79          HD12      ILE  79 -24.378  -4.403  -4.468
   11   HD11  ILE  79          HD13      ILE  79 -23.386  -3.926  -3.089

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ASP  80           H        ASP  80 -28.617  -5.900  -0.871
    2    HA   ASP  80           HA       ASP  80 -28.608  -6.760   1.790
    3    HB2  ASP  80           HB2      ASP  80 -30.371  -7.304   0.149
    4    HB3  ASP  80           HB3      ASP  80 -29.241  -8.362  -0.697

  No H/Q in entry =           4
  In of MODEL   47
    1    H    SER  81           H        SER  81 -27.116  -7.926   2.946
    2    HA   SER  81           HA       SER  81 -24.638  -8.708   1.780
    3    HB2  SER  81           HB2      SER  81 -24.131  -9.720   3.969
    4    HB3  SER  81           HB3      SER  81 -24.781  -8.092   4.153
    5    HG   SER  81           HG       SER  81 -26.868  -9.490   4.241

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU  82           H        LEU  82 -27.417 -10.705   2.118
    2    HA   LEU  82           HA       LEU  82 -25.944 -13.130   1.643
    3    HB2  LEU  82           HB2      LEU  82 -28.857 -12.423   1.360
    4    HB3  LEU  82           HB3      LEU  82 -28.204 -14.051   1.181
    5    HG   LEU  82           HG       LEU  82 -28.111 -12.430   3.707
    6   HD13  LEU  82          HD11      LEU  82 -30.377 -12.977   3.434
    7   HD12  LEU  82          HD12      LEU  82 -29.751 -14.328   4.380
    8   HD11  LEU  82          HD13      LEU  82 -30.006 -14.510   2.645
    9   HD22  LEU  82          HD21      LEU  82 -26.307 -13.926   3.723
   10   HD21  LEU  82          HD22      LEU  82 -27.212 -15.166   2.856
   11   HD23  LEU  82          HD23      LEU  82 -27.586 -14.821   4.545

  No H/Q in entry =          11
  In of MODEL   47
    1    H    LEU  83           H        LEU  83 -27.818 -10.872  -0.322
    2    HA   LEU  83           HA       LEU  83 -27.648 -12.275  -2.770
    3    HB2  LEU  83           HB2      LEU  83 -27.966  -9.346  -2.169
    4    HB3  LEU  83           HB3      LEU  83 -28.010 -10.016  -3.800
    5    HG   LEU  83           HG       LEU  83 -30.067 -10.302  -1.630
    6   HD13  LEU  83          HD11      LEU  83 -30.757  -8.447  -2.728
    7   HD12  LEU  83          HD12      LEU  83 -31.248  -9.565  -3.998
    8   HD11  LEU  83          HD13      LEU  83 -29.687  -8.751  -4.094
    9   HD23  LEU  83          HD21      LEU  83 -30.232 -11.597  -4.336
   10   HD22  LEU  83          HD22      LEU  83 -31.221 -11.893  -2.906
   11   HD21  LEU  83          HD23      LEU  83 -29.550 -12.452  -2.953

  No H/Q in entry =          11
  In of MODEL   47
    1    H    TYR  84           H        TYR  84 -25.627  -9.929  -1.120
    2    HA   TYR  84           HA       TYR  84 -23.738  -9.537  -3.246
    3    HB2  TYR  84           HB2      TYR  84 -24.223  -8.010  -1.239
    4    HB3  TYR  84           HB3      TYR  84 -23.225  -9.123  -0.306
    5    HD1  TYR  84           HD1      TYR  84 -20.865  -8.999  -0.377
    6    HD2  TYR  84           HD2      TYR  84 -23.183  -6.782  -3.195
    7    HE1  TYR  84           HE1      TYR  84 -18.819  -7.828  -1.119
    8    HE2  TYR  84           HE2      TYR  84 -21.145  -5.610  -3.954
    9    HH   TYR  84           HH       TYR  84 -18.664  -5.158  -2.514

  No H/Q in entry =           9
  In of MODEL   47
    1    H    GLY  85           H        GLY  85 -23.580 -11.499  -0.268
    2    HA3  GLY  85           HA2      GLY  85 -21.032 -12.533  -0.720
    3    HA2  GLY  85           HA3      GLY  85 -22.295 -13.324   0.223

  No H/Q in entry =           3
  In of MODEL   47
    1    H    LYS  86           H        LYS  86 -24.142 -13.669  -1.842
    2    HA   LYS  86           HA       LYS  86 -23.160 -16.097  -3.057
    3    HB2  LYS  86           HB2      LYS  86 -25.401 -15.895  -2.123
    4    HB3  LYS  86           HB3      LYS  86 -25.760 -14.571  -3.230
    5    HG2  LYS  86           HG2      LYS  86 -26.861 -16.575  -3.932
    6    HG3  LYS  86           HG3      LYS  86 -25.615 -16.133  -5.099
    7    HD2  LYS  86           HD2      LYS  86 -24.103 -17.758  -4.238
    8    HD3  LYS  86           HD3      LYS  86 -25.109 -18.038  -2.819
    9    HE2  LYS  86           HE2      LYS  86 -25.429 -19.876  -4.310
   10    HE3  LYS  86           HE3      LYS  86 -26.891 -18.891  -4.358
   11    HZ1  LYS  86           HZ1      LYS  86 -24.671 -18.544  -6.293
   12    HZ3  LYS  86           HZ2      LYS  86 -26.257 -17.943  -6.401
   13    HZ2  LYS  86           HZ3      LYS  86 -25.966 -19.607  -6.573

  No H/Q in entry =          13
  In of MODEL   47
    1    H    VAL  87           H        VAL  87 -23.038 -12.898  -4.002
    2    HA   VAL  87           HA       VAL  87 -22.691 -11.767  -5.959
    3    HB   VAL  87           HB       VAL  87 -21.710 -14.307  -7.280
    4   HG11  VAL  87          HG11      VAL  87 -21.759 -11.836  -8.225
    5   HG13  VAL  87          HG12      VAL  87 -20.362 -12.872  -8.519
    6   HG12  VAL  87          HG13      VAL  87 -20.307 -11.656  -7.242
    7   HG21  VAL  87          HG21      VAL  87 -20.443 -12.915  -4.954
    8   HG23  VAL  87          HG22      VAL  87 -19.460 -13.725  -6.171
    9   HG22  VAL  87          HG23      VAL  87 -20.648 -14.641  -5.244

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ASP  88           H        ASP  88 -25.228 -12.321  -5.612
    2    HA   ASP  88           HA       ASP  88 -26.377 -13.538  -7.996
    3    HB2  ASP  88           HB2      ASP  88 -27.391 -13.714  -5.674
    4    HB3  ASP  88           HB3      ASP  88 -27.788 -12.000  -5.803

  No H/Q in entry =           4
  In of MODEL   47
    1    H    GLY  89           H        GLY  89 -25.623 -12.332  -9.653
    2    HA3  GLY  89           HA2      GLY  89 -25.714  -9.558  -9.900
    3    HA2  GLY  89           HA3      GLY  89 -25.719 -10.701 -11.242

  No H/Q in entry =           3
  In of MODEL   47
    1    H    LEU  90           H        LEU  90 -28.210 -11.965 -10.785
    2    HA   LEU  90           HA       LEU  90 -29.952  -9.992 -11.939
    3    HB2  LEU  90           HB2      LEU  90 -30.093 -12.394 -12.481
    4    HB3  LEU  90           HB3      LEU  90 -30.617 -12.716 -10.829
    5    HG   LEU  90           HG       LEU  90 -32.697 -11.538 -11.221
    6   HD13  LEU  90          HD11      LEU  90 -32.455  -9.827 -12.723
    7   HD12  LEU  90          HD12      LEU  90 -33.029 -11.065 -13.844
    8   HD11  LEU  90          HD13      LEU  90 -31.304 -10.724 -13.716
    9   HD23  LEU  90          HD21      LEU  90 -32.669 -13.209 -13.629
   10   HD22  LEU  90          HD22      LEU  90 -33.660 -13.318 -12.175
   11   HD21  LEU  90          HD23      LEU  90 -32.027 -13.983 -12.181

  No H/Q in entry =          11
  In of MODEL   47
    1    H    GLY  91           H        GLY  91 -29.847 -11.445  -8.730
    2    HA3  GLY  91           HA2      GLY  91 -32.155 -10.242  -7.721
    3    HA2  GLY  91           HA3      GLY  91 -30.785 -10.803  -6.763

  No H/Q in entry =           3
  In of MODEL   47
    1    H    VAL  92           H        VAL  92 -28.805  -9.053  -7.639
    2    HA   VAL  92           HA       VAL  92 -29.529  -6.703  -6.132
    3    HB   VAL  92           HB       VAL  92 -26.992  -7.279  -7.706
    4   HG12  VAL  92          HG11      VAL  92 -27.108  -5.352  -5.411
    5   HG11  VAL  92          HG12      VAL  92 -27.748  -4.812  -6.965
    6   HG13  VAL  92          HG13      VAL  92 -26.068  -5.333  -6.837
    7   HG22  VAL  92          HG21      VAL  92 -26.828  -8.846  -6.087
    8   HG21  VAL  92          HG22      VAL  92 -27.951  -8.012  -5.012
    9   HG23  VAL  92          HG23      VAL  92 -26.279  -7.467  -5.135

  No H/Q in entry =           9
  In of MODEL   47
    1    H    LEU  93           H        LEU  93 -29.128  -7.433  -9.538
    2    HA   LEU  93           HA       LEU  93 -29.385  -4.803 -10.513
    3    HB2  LEU  93           HB2      LEU  93 -28.796  -6.701 -11.940
    4    HB3  LEU  93           HB3      LEU  93 -30.411  -7.374 -11.713
    5    HG   LEU  93           HG       LEU  93 -31.354  -5.398 -12.875
    6   HD11  LEU  93          HD11      LEU  93 -29.456  -3.855 -12.388
    7   HD13  LEU  93          HD12      LEU  93 -29.888  -3.899 -14.097
    8   HD12  LEU  93          HD13      LEU  93 -28.467  -4.770 -13.526
    9   HD23  LEU  93          HD21      LEU  93 -30.323  -6.035 -15.148
   10   HD22  LEU  93          HD22      LEU  93 -31.210  -7.250 -14.225
   11   HD21  LEU  93          HD23      LEU  93 -29.445  -7.250 -14.219

  No H/Q in entry =          11
  In of MODEL   47
    1    H    LYS  94           H        LYS  94 -31.845  -7.258  -9.633
    2    HA   LYS  94           HA       LYS  94 -34.138  -5.753 -10.293
    3    HB2  LYS  94           HB2      LYS  94 -33.703  -7.921  -8.244
    4    HB3  LYS  94           HB3      LYS  94 -35.276  -7.179  -8.531
    5    HG2  LYS  94           HG2      LYS  94 -35.204  -7.994 -10.852
    6    HG3  LYS  94           HG3      LYS  94 -33.670  -8.790 -10.503
    7    HD2  LYS  94           HD2      LYS  94 -34.840 -10.058  -8.663
    8    HD3  LYS  94           HD3      LYS  94 -36.360  -9.370  -9.236
    9    HE2  LYS  94           HE2      LYS  94 -35.864 -10.352 -11.484
   10    HE3  LYS  94           HE3      LYS  94 -34.478 -11.168 -10.761
   11    HZ3  LYS  94           HZ1      LYS  94 -36.375 -12.634 -10.916
   12    HZ2  LYS  94           HZ2      LYS  94 -37.319 -11.561  -9.996
   13    HZ1  LYS  94           HZ3      LYS  94 -35.987 -12.341  -9.289

  No H/Q in entry =          13
  In of MODEL   47
    1    H    ALA  95           H        ALA  95 -32.333  -5.882  -7.234
    2    HA   ALA  95           HA       ALA  95 -34.137  -4.220  -5.789
    3    HB2  ALA  95           HB1      ALA  95 -31.810  -5.661  -5.219
    4    HB3  ALA  95           HB2      ALA  95 -32.764  -4.707  -4.085
    5    HB1  ALA  95           HB3      ALA  95 -31.388  -3.977  -4.912

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA  96           H        ALA  96 -31.461  -3.485  -7.887
    2    HA   ALA  96           HA       ALA  96 -31.279  -0.716  -7.157
    3    HB2  ALA  96           HB1      ALA  96 -29.901  -0.568  -9.263
    4    HB3  ALA  96           HB2      ALA  96 -30.258  -2.270  -9.557
    5    HB1  ALA  96           HB3      ALA  96 -29.335  -1.796  -8.132

  No H/Q in entry =           5
  In of MODEL   47
    1    H    VAL  97           H        VAL  97 -32.854  -2.424  -9.823
    2    HA   VAL  97           HA       VAL  97 -33.843  -0.112 -11.121
    3    HB   VAL  97           HB       VAL  97 -34.747  -3.009 -11.121
    4   HG11  VAL  97          HG11      VAL  97 -36.471  -0.953 -11.647
    5   HG13  VAL  97          HG12      VAL  97 -36.579  -2.556 -12.378
    6   HG12  VAL  97          HG13      VAL  97 -35.778  -1.245 -13.244
    7   HG21  VAL  97          HG21      VAL  97 -33.400  -1.257 -13.178
    8   HG23  VAL  97          HG22      VAL  97 -33.907  -2.926 -13.443
    9   HG22  VAL  97          HG23      VAL  97 -32.651  -2.561 -12.258

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ALA  98           H        ALA  98 -35.108  -2.209  -8.556
    2    HA   ALA  98           HA       ALA  98 -37.630  -0.970  -8.235
    3    HB1  ALA  98           HB1      ALA  98 -36.696  -3.185  -7.163
    4    HB3  ALA  98           HB2      ALA  98 -37.849  -2.207  -6.252
    5    HB2  ALA  98           HB3      ALA  98 -36.125  -2.110  -5.886

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA  99           H        ALA  99 -34.534  -0.250  -6.586
    2    HA   ALA  99           HA       ALA  99 -35.602   1.797  -4.961
    3    HB1  ALA  99           HB1      ALA  99 -32.982   0.807  -5.682
    4    HB2  ALA  99           HB2      ALA  99 -33.513   1.599  -4.198
    5    HB3  ALA  99           HB3      ALA  99 -32.998   2.567  -5.578

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ILE 100           H        ILE 100 -34.544   1.840  -8.313
    2    HA   ILE 100           HA       ILE 100 -34.624   4.690  -8.577
    3    HB   ILE 100           HB       ILE 100 -34.784   2.506 -10.683
    4   HG12  ILE 100          HG12      ILE 100 -32.556   4.433 -10.033
    5   HG13  ILE 100          HG13      ILE 100 -32.652   2.799  -9.377
    6   HG21  ILE 100          HG21      ILE 100 -35.105   5.436 -10.860
    7   HG23  ILE 100          HG22      ILE 100 -35.650   4.169 -11.960
    8   HG22  ILE 100          HG23      ILE 100 -33.977   4.726 -12.016
    9   HD12  ILE 100          HD11      ILE 100 -32.075   3.693 -12.163
   10   HD11  ILE 100          HD12      ILE 100 -32.792   2.107 -11.886
   11   HD13  ILE 100          HD13      ILE 100 -31.234   2.507 -11.167

  No H/Q in entry =          11
  In of MODEL   47
    1    H    LYS 101           H        LYS 101 -37.003   2.150  -9.274
    2    HA   LYS 101           HA       LYS 101 -39.022   3.854 -10.309
    3    HB2  LYS 101           HB2      LYS 101 -39.007   1.095  -9.139
    4    HB3  LYS 101           HB3      LYS 101 -40.530   1.905  -9.503
    5    HG2  LYS 101           HG2      LYS 101 -40.041   1.988 -11.800
    6    HG3  LYS 101           HG3      LYS 101 -38.362   1.528 -11.531
    7    HD2  LYS 101           HD2      LYS 101 -39.673  -0.349 -12.394
    8    HD3  LYS 101           HD3      LYS 101 -39.065  -0.676 -10.771
    9    HE2  LYS 101           HE2      LYS 101 -41.153  -1.291 -10.264
   10    HE3  LYS 101           HE3      LYS 101 -41.551   0.427 -10.296
   11    HZ3  LYS 101           HZ1      LYS 101 -42.438   0.270 -12.415
   12    HZ2  LYS 101           HZ2      LYS 101 -42.953  -1.176 -11.687
   13    HZ1  LYS 101           HZ3      LYS 101 -41.640  -1.189 -12.765

  No H/Q in entry =          13
  In of MODEL   47
    1    H    LYS 102           H        LYS 102 -38.596   2.409  -7.075
    2    HA   LYS 102           HA       LYS 102 -40.806   3.700  -5.907
    3    HB2  LYS 102           HB2      LYS 102 -39.639   1.807  -4.858
    4    HB3  LYS 102           HB3      LYS 102 -38.213   2.818  -4.624
    5    HG2  LYS 102           HG2      LYS 102 -39.488   4.279  -3.155
    6    HG3  LYS 102           HG3      LYS 102 -40.915   3.273  -3.391
    7    HD2  LYS 102           HD2      LYS 102 -39.760   1.381  -2.332
    8    HD3  LYS 102           HD3      LYS 102 -38.332   2.389  -2.092
    9    HE2  LYS 102           HE2      LYS 102 -39.640   3.933  -0.712
   10    HE3  LYS 102           HE3      LYS 102 -41.085   2.958  -0.973
   11    HZ1  LYS 102           HZ1      LYS 102 -39.431   1.159   0.065
   12    HZ3  LYS 102           HZ2      LYS 102 -40.513   2.096   0.977
   13    HZ2  LYS 102           HZ3      LYS 102 -38.885   2.563   0.849

  No H/Q in entry =          13
  In of MODEL   47
    1    H    ALA 103           H        ALA 103 -37.800   4.974  -6.926
    2    HA   ALA 103           HA       ALA 103 -37.950   7.320  -5.179
    3    HB2  ALA 103           HB1      ALA 103 -35.928   7.961  -6.755
    4    HB3  ALA 103           HB2      ALA 103 -35.950   6.238  -7.128
    5    HB1  ALA 103           HB3      ALA 103 -35.713   6.778  -5.467

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA 104           H        ALA 104 -38.581   6.561  -8.517
    2    HA   ALA 104           HA       ALA 104 -39.066   9.355  -9.183
    3    HB2  ALA 104           HB1      ALA 104 -39.122   8.657 -11.375
    4    HB1  ALA 104           HB2      ALA 104 -39.905   7.127 -10.978
    5    HB3  ALA 104           HB3      ALA 104 -38.176   7.335 -10.694

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA 105           H        ALA 105 -40.755   7.335  -7.356
    2    HA   ALA 105           HA       ALA 105 -43.130   8.812  -7.362
    3    HB2  ALA 105           HB1      ALA 105 -43.894   7.948  -9.392
    4    HB3  ALA 105           HB2      ALA 105 -44.577   6.799  -8.241
    5    HB1  ALA 105           HB3      ALA 105 -43.116   6.386  -9.138

  No H/Q in entry =           5
  In of MODEL   48
    1    H1   ALA   1           H3       ALA   1 -12.101 -16.000  -2.344
    2    H2   ALA   1           H2       ALA   1 -11.147 -17.136  -3.178
    3    H3   ALA   1           H1       ALA   1 -12.299 -16.207  -4.017
    4    HA   ALA   1           HA       ALA   1 -13.680 -17.921  -3.772
    5    HB3  ALA   1           HB1      ALA   1 -12.267 -19.676  -3.300
    6    HB1  ALA   1           HB2      ALA   1 -13.026 -19.564  -1.712
    7    HB2  ALA   1           HB3      ALA   1 -11.458 -18.808  -1.994

  No H/Q in entry =           7
  In of MODEL   48
    1    H    GLU   2           H        GLU   2 -15.297 -18.784  -2.115
    2    HA   GLU   2           HA       GLU   2 -16.964 -17.076  -1.067
    3    HB2  GLU   2           HB2      GLU   2 -16.002 -19.485   0.490
    4    HB3  GLU   2           HB3      GLU   2 -17.535 -18.649   0.738
    5    HG2  GLU   2           HG2      GLU   2 -18.501 -19.754  -0.992
    6    HG3  GLU   2           HG3      GLU   2 -17.181 -19.344  -2.077

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLU   3           H        GLU   3 -15.041 -18.398   1.565
    2    HA   GLU   3           HA       GLU   3 -15.289 -16.040   3.111
    3    HB2  GLU   3           HB2      GLU   3 -13.678 -18.569   3.376
    4    HB3  GLU   3           HB3      GLU   3 -13.462 -17.242   4.517
    5    HG2  GLU   3           HG2      GLU   3 -15.655 -17.412   5.333
    6    HG3  GLU   3           HG3      GLU   3 -16.240 -18.225   3.887

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LEU   4           H        LEU   4 -12.317 -17.494   1.731
    2    HA   LEU   4           HA       LEU   4 -10.504 -15.570   2.323
    3    HB2  LEU   4           HB2      LEU   4 -10.717 -16.882  -0.396
    4    HB3  LEU   4           HB3      LEU   4  -9.273 -16.144   0.288
    5    HG   LEU   4           HG       LEU   4 -10.744 -18.551   1.409
    6   HD13  LEU   4          HD11      LEU   4  -9.097 -19.894   0.488
    7   HD12  LEU   4          HD12      LEU   4  -7.900 -18.599   0.457
    8   HD11  LEU   4          HD13      LEU   4  -9.187 -18.640  -0.747
    9   HD23  LEU   4          HD21      LEU   4  -8.495 -18.585   2.794
   10   HD22  LEU   4          HD22      LEU   4  -9.827 -17.557   3.317
   11   HD21  LEU   4          HD23      LEU   4  -8.470 -16.858   2.433

  No H/Q in entry =          11
  In of MODEL   48
    1    H    GLU   5           H        GLU   5 -12.836 -15.399  -0.355
    2    HA   GLU   5           HA       GLU   5 -11.857 -12.910  -1.366
    3    HB2  GLU   5           HB2      GLU   5 -13.192 -14.528  -2.713
    4    HB3  GLU   5           HB3      GLU   5 -14.596 -14.146  -1.717
    5    HG2  GLU   5           HG2      GLU   5 -14.466 -11.792  -2.396
    6    HG3  GLU   5           HG3      GLU   5 -13.028 -12.137  -3.357

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLU   6           H        GLU   6 -14.576 -13.806   0.726
    2    HA   GLU   6           HA       GLU   6 -15.508 -11.137   1.112
    3    HB2  GLU   6           HB2      GLU   6 -15.903 -13.677   2.707
    4    HB3  GLU   6           HB3      GLU   6 -16.711 -12.156   3.079
    5    HG2  GLU   6           HG2      GLU   6 -16.876 -13.584   0.410
    6    HG3  GLU   6           HG3      GLU   6 -18.111 -13.660   1.665

  No H/Q in entry =           6
  In of MODEL   48
    1    H    VAL   7           H        VAL   7 -13.182 -13.217   2.697
    2    HA   VAL   7           HA       VAL   7 -12.735 -11.627   5.018
    3    HB   VAL   7           HB       VAL   7 -11.009 -13.660   3.580
    4   HG11  VAL   7          HG11      VAL   7 -10.560 -12.111   6.138
    5   HG13  VAL   7          HG12      VAL   7  -9.456 -12.320   4.780
    6   HG12  VAL   7          HG13      VAL   7  -9.797 -13.675   5.855
    7   HG21  VAL   7          HG21      VAL   7 -13.256 -14.241   4.799
    8   HG23  VAL   7          HG22      VAL   7 -12.334 -13.951   6.275
    9   HG22  VAL   7          HG23      VAL   7 -11.826 -15.211   5.152

  No H/Q in entry =           9
  In of MODEL   48
    1    H    VAL   8           H        VAL   8 -11.218 -11.741   1.811
    2    HA   VAL   8           HA       VAL   8  -9.174  -9.845   2.298
    3    HB   VAL   8           HB       VAL   8 -10.627 -10.559  -0.261
    4   HG12  VAL   8          HG11      VAL   8  -8.494  -9.533  -1.284
    5   HG11  VAL   8          HG12      VAL   8  -8.251  -8.771   0.289
    6   HG13  VAL   8          HG13      VAL   8  -9.699  -8.410  -0.651
    7   HG22  VAL   8          HG21      VAL   8  -9.092 -12.263  -0.503
    8   HG21  VAL   8          HG22      VAL   8  -8.930 -12.112   1.244
    9   HG23  VAL   8          HG23      VAL   8  -7.777 -11.307   0.185

  No H/Q in entry =           9
  In of MODEL   48
    1    H    MET   9           H        MET   9 -12.522  -9.494   1.131
    2    HA   MET   9           HA       MET   9 -12.486  -6.719   0.684
    3    HB2  MET   9           HB2      MET   9 -14.675  -8.624   1.503
    4    HB3  MET   9           HB3      MET   9 -14.982  -6.897   1.311
    5    HG2  MET   9           HG2      MET   9 -14.071  -7.024  -1.004
    6    HG3  MET   9           HG3      MET   9 -13.879  -8.766  -0.805
    7    HE2  MET   9           HE1      MET   9 -16.588  -6.056  -2.062
    8    HE1  MET   9           HE2      MET   9 -16.006  -5.821  -0.417
    9    HE3  MET   9           HE3      MET   9 -17.682  -6.289  -0.691

  No H/Q in entry =           9
  In of MODEL   48
    1    H    GLY  10           H        GLY  10 -13.134  -8.604   3.619
    2    HA3  GLY  10           HA2      GLY  10 -13.708  -6.417   5.326
    3    HA2  GLY  10           HA3      GLY  10 -13.128  -7.997   5.849

  No H/Q in entry =           3
  In of MODEL   48
    1    H    LEU  11           H        LEU  11 -10.679  -8.102   4.538
    2    HA   LEU  11           HA       LEU  11  -8.996  -6.643   6.291
    3    HB2  LEU  11           HB2      LEU  11  -8.430  -8.073   3.691
    4    HB3  LEU  11           HB3      LEU  11  -7.169  -7.350   4.689
    5    HG   LEU  11           HG       LEU  11  -9.152  -9.400   5.711
    6   HD13  LEU  11          HD11      LEU  11  -7.915 -10.631   4.155
    7   HD12  LEU  11          HD12      LEU  11  -6.980 -10.853   5.632
    8   HD11  LEU  11          HD13      LEU  11  -6.449  -9.688   4.420
    9   HD22  LEU  11          HD21      LEU  11  -8.313  -8.369   7.625
   10   HD21  LEU  11          HD22      LEU  11  -6.778  -7.955   6.862
   11   HD23  LEU  11          HD23      LEU  11  -7.087  -9.612   7.379

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  12           H        ILE  12  -9.898  -6.121   2.897
    2    HA   ILE  12           HA       ILE  12  -8.230  -3.875   2.463
    3    HB   ILE  12           HB       ILE  12 -10.874  -4.577   1.166
    4   HG12  ILE  12          HG12      ILE  12  -8.828  -6.215   1.104
    5   HG13  ILE  12          HG13      ILE  12  -9.684  -5.869  -0.384
    6   HG23  ILE  12          HG21      ILE  12 -10.321  -2.253   0.715
    7   HG22  ILE  12          HG22      ILE  12  -9.955  -3.183  -0.732
    8   HG21  ILE  12          HG23      ILE  12  -8.681  -2.689   0.345
    9   HD13  ILE  12          HD11      ILE  12  -7.966  -4.299  -1.047
   10   HD12  ILE  12          HD12      ILE  12  -7.180  -5.803  -0.573
   11   HD11  ILE  12          HD13      ILE  12  -7.180  -4.435   0.514

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  13           H        ILE  13 -11.590  -4.174   3.552
    2    HA   ILE  13           HA       ILE  13 -12.081  -1.391   3.808
    3    HB   ILE  13           HB       ILE  13 -13.261  -3.822   5.171
    4   HG12  ILE  13          HG12      ILE  13 -13.493  -3.264   2.633
    5   HG13  ILE  13          HG13      ILE  13 -14.909  -3.754   3.539
    6   HG22  ILE  13          HG21      ILE  13 -15.186  -2.136   5.671
    7   HG21  ILE  13          HG22      ILE  13 -13.948  -0.899   5.499
    8   HG23  ILE  13          HG23      ILE  13 -13.783  -2.142   6.737
    9   HD12  ILE  13          HD11      ILE  13 -15.267  -1.727   2.062
   10   HD11  ILE  13          HD12      ILE  13 -14.142  -0.880   3.106
   11   HD13  ILE  13          HD13      ILE  13 -15.647  -1.474   3.769

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ASN  14           H        ASN  14 -10.946  -3.858   6.096
    2    HA   ASN  14           HA       ASN  14 -10.768  -2.207   8.374
    3    HB2  ASN  14           HB2      ASN  14 -10.484  -4.813   8.065
    4    HB3  ASN  14           HB3      ASN  14  -8.780  -4.407   7.909
    5   HD21  ASN  14          HD21      ASN  14  -9.403  -5.928  10.091
    6   HD22  ASN  14          HD22      ASN  14  -9.388  -5.001  11.511

  No H/Q in entry =           6
  In of MODEL   48
    1    H    SER  15           H        SER  15  -8.352  -3.014   5.891
    2    HA   SER  15           HA       SER  15  -6.228  -1.491   6.960
    3    HB2  SER  15           HB2      SER  15  -5.204  -1.699   4.800
    4    HB3  SER  15           HB3      SER  15  -6.132  -3.175   5.038
    5    HG   SER  15           HG       SER  15  -6.371  -1.353   3.117

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLY  16           H        GLY  16  -8.835  -0.666   4.704
    2    HA3  GLY  16           HA2      GLY  16  -8.008   1.982   4.141
    3    HA2  GLY  16           HA3      GLY  16  -9.652   1.366   3.979

  No H/Q in entry =           3
  In of MODEL   48
    1    H    GLN  17           H        GLN  17 -10.190   0.647   6.631
    2    HA   GLN  17           HA       GLN  17 -10.931   3.148   7.759
    3    HB2  GLN  17           HB2      GLN  17 -10.802   0.371   8.947
    4    HB3  GLN  17           HB3      GLN  17 -11.439   1.766   9.818
    5    HG2  GLN  17           HG2      GLN  17 -13.126   2.118   8.083
    6    HG3  GLN  17           HG3      GLN  17 -12.457   0.794   7.133
    7   HE21  GLN  17          HE21      GLN  17 -14.903   1.509   9.314
    8   HE22  GLN  17          HE22      GLN  17 -15.184  -0.055   9.914

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ALA  18           H        ALA  18  -8.275   0.903   8.394
    2    HA   ALA  18           HA       ALA  18  -7.197   2.144  10.661
    3    HB2  ALA  18           HB1      ALA  18  -6.556  -0.070   9.305
    4    HB3  ALA  18           HB2      ALA  18  -5.406   0.733  10.374
    5    HB1  ALA  18           HB3      ALA  18  -5.329   1.004   8.632

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ARG  19           H        ARG  19  -6.426   2.661   7.211
    2    HA   ARG  19           HA       ARG  19  -4.555   4.735   7.633
    3    HB2  ARG  19           HB2      ARG  19  -4.863   3.579   5.443
    4    HB3  ARG  19           HB3      ARG  19  -6.417   4.399   5.259
    5    HG2  ARG  19           HG2      ARG  19  -5.317   6.585   5.319
    6    HG3  ARG  19           HG3      ARG  19  -3.758   5.822   5.630
    7    HD2  ARG  19           HD2      ARG  19  -3.886   6.399   3.283
    8    HD3  ARG  19           HD3      ARG  19  -3.948   4.639   3.437
    9    HE   ARG  19           HE       ARG  19  -6.594   5.513   3.420
   10   HH21  ARG  19          HH11      ARG  19  -7.787   5.644   1.499
   11   HH22  ARG  19          HH12      ARG  19  -6.963   5.725  -0.019
   12   HH11  ARG  19          HH21      ARG  19  -3.815   5.603   1.392
   13   HH12  ARG  19          HH22      ARG  19  -4.713   5.699  -0.080

  No H/Q in entry =          13
  In of MODEL   48
    1    H    SER  20           H        SER  20  -8.054   4.800   7.026
    2    HA   SER  20           HA       SER  20  -8.448   7.551   6.963
    3    HB2  SER  20           HB2      SER  20 -10.221   5.913   6.471
    4    HB3  SER  20           HB3      SER  20 -10.269   5.458   8.172
    5    HG   SER  20           HG       SER  20 -10.430   8.140   7.844

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU  21           H        LEU  21  -8.424   5.382   9.778
    2    HA   LEU  21           HA       LEU  21  -8.896   7.381  11.732
    3    HB2  LEU  21           HB2      LEU  21  -7.512   4.697  11.905
    4    HB3  LEU  21           HB3      LEU  21  -7.827   5.718  13.305
    5    HG   LEU  21           HG       LEU  21  -9.993   4.790  11.395
    6   HD12  LEU  21          HD11      LEU  21 -10.570   3.228  13.332
    7   HD11  LEU  21          HD12      LEU  21  -8.967   3.585  13.974
    8   HD13  LEU  21          HD13      LEU  21  -9.133   2.801  12.402
    9   HD22  LEU  21          HD21      LEU  21 -10.916   6.603  12.547
   10   HD21  LEU  21          HD22      LEU  21  -9.946   6.328  13.991
   11   HD23  LEU  21          HD23      LEU  21 -11.322   5.290  13.650

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ALA  22           H        ALA  22  -5.922   6.042  10.338
    2    HA   ALA  22           HA       ALA  22  -4.065   7.390  11.957
    3    HB2  ALA  22           HB1      ALA  22  -3.619   5.534  10.276
    4    HB1  ALA  22           HB2      ALA  22  -2.441   6.847  10.307
    5    HB3  ALA  22           HB3      ALA  22  -3.656   6.780   9.029

  No H/Q in entry =           5
  In of MODEL   48
    1    H    TYR  23           H        TYR  23  -5.389   8.373   8.766
    2    HA   TYR  23           HA       TYR  23  -4.088  10.887   8.687
    3    HB2  TYR  23           HB2      TYR  23  -5.151   9.949   6.697
    4    HB3  TYR  23           HB3      TYR  23  -6.733  10.039   7.474
    5    HD1  TYR  23           HD1      TYR  23  -3.860  12.111   6.305
    6    HD2  TYR  23           HD2      TYR  23  -7.997  12.037   7.456
    7    HE1  TYR  23           HE1      TYR  23  -4.116  14.454   5.532
    8    HE2  TYR  23           HE2      TYR  23  -8.254  14.379   6.681
    9    HH   TYR  23           HH       TYR  23  -5.470  16.251   5.536

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ALA  24           H        ALA  24  -7.196   9.872  10.064
    2    HA   ALA  24           HA       ALA  24  -8.072  12.454  10.820
    3    HB1  ALA  24           HB1      ALA  24  -9.873  11.179  11.290
    4    HB2  ALA  24           HB2      ALA  24  -9.043  10.627  12.742
    5    HB3  ALA  24           HB3      ALA  24  -8.901   9.709  11.244

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA  25           H        ALA  25  -6.039  10.032  12.411
    2    HA   ALA  25           HA       ALA  25  -5.725  11.302  14.907
    3    HB2  ALA  25           HB1      ALA  25  -4.922   8.957  14.100
    4    HB3  ALA  25           HB2      ALA  25  -3.922   9.835  15.259
    5    HB1  ALA  25           HB3      ALA  25  -3.482   9.816  13.551

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU  26           H        LEU  26  -3.931  11.611  11.870
    2    HA   LEU  26           HA       LEU  26  -2.001  13.463  12.781
    3    HB2  LEU  26           HB2      LEU  26  -1.678  12.305  10.684
    4    HB3  LEU  26           HB3      LEU  26  -3.159  12.989  10.022
    5    HG   LEU  26           HG       LEU  26  -2.177  15.254  10.149
    6   HD12  LEU  26          HD11      LEU  26   0.360  15.312  10.569
    7   HD11  LEU  26          HD12      LEU  26   0.157  13.732  11.320
    8   HD13  LEU  26          HD13      LEU  26  -0.672  15.139  11.988
    9   HD21  LEU  26          HD21      LEU  26  -0.402  13.217   8.768
   10   HD23  LEU  26          HD22      LEU  26  -0.468  14.936   8.389
   11   HD22  LEU  26          HD23      LEU  26  -1.877  13.917   8.102

  No H/Q in entry =          11
  In of MODEL   48
    1    H    LYS  27           H        LYS  27  -5.186  13.894  11.294
    2    HA   LYS  27           HA       LYS  27  -5.169  16.682  11.082
    3    HB2  LYS  27           HB2      LYS  27  -6.890  15.175  10.100
    4    HB3  LYS  27           HB3      LYS  27  -7.547  14.918  11.716
    5    HG2  LYS  27           HG2      LYS  27  -8.010  17.319  11.939
    6    HG3  LYS  27           HG3      LYS  27  -7.302  17.618  10.348
    7    HD2  LYS  27           HD2      LYS  27  -9.012  16.155   9.315
    8    HD3  LYS  27           HD3      LYS  27  -9.726  15.873  10.904
    9    HE2  LYS  27           HE2      LYS  27 -10.203  18.279  11.134
   10    HE3  LYS  27           HE3      LYS  27  -9.461  18.583   9.560
   11    HZ3  LYS  27           HZ1      LYS  27 -11.836  18.424   9.313
   12    HZ2  LYS  27           HZ2      LYS  27 -11.865  16.911  10.090
   13    HZ1  LYS  27           HZ3      LYS  27 -11.119  17.077   8.570

  No H/Q in entry =          13
  In of MODEL   48
    1    H    GLN  28           H        GLN  28  -6.035  14.597  13.818
    2    HA   GLN  28           HA       GLN  28  -6.962  16.598  15.582
    3    HB2  GLN  28           HB2      GLN  28  -5.524  13.990  16.142
    4    HB3  GLN  28           HB3      GLN  28  -6.286  14.990  17.381
    5    HG2  GLN  28           HG2      GLN  28  -7.718  13.832  14.973
    6    HG3  GLN  28           HG3      GLN  28  -7.777  13.154  16.600
    7   HE21  GLN  28          HE21      GLN  28  -9.646  14.935  14.599
    8   HE22  GLN  28          HE22      GLN  28 -10.422  15.944  15.721

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ALA  29           H        ALA  29  -3.724  15.340  14.906
    2    HA   ALA  29           HA       ALA  29  -2.309  16.766  16.880
    3    HB1  ALA  29           HB1      ALA  29  -0.367  16.094  15.769
    4    HB3  ALA  29           HB2      ALA  29  -1.120  16.201  14.178
    5    HB2  ALA  29           HB3      ALA  29  -1.527  14.868  15.258

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LYS  30           H        LYS  30  -3.170  17.618  13.545
    2    HA   LYS  30           HA       LYS  30  -1.788  20.074  13.435
    3    HB2  LYS  30           HB2      LYS  30  -4.306  19.165  12.025
    4    HB3  LYS  30           HB3      LYS  30  -3.489  20.687  11.676
    5    HG2  LYS  30           HG2      LYS  30  -1.403  19.415  11.173
    6    HG3  LYS  30           HG3      LYS  30  -2.294  17.910  11.423
    7    HD2  LYS  30           HD2      LYS  30  -3.861  18.524   9.622
    8    HD3  LYS  30           HD3      LYS  30  -2.994  20.041   9.374
    9    HE2  LYS  30           HE2      LYS  30  -0.946  18.767   8.805
   10    HE3  LYS  30           HE3      LYS  30  -1.832  17.256   9.022
   11    HZ2  LYS  30           HZ1      LYS  30  -1.661  18.117   6.676
   12    HZ1  LYS  30           HZ2      LYS  30  -2.719  19.371   7.136
   13    HZ3  LYS  30           HZ3      LYS  30  -3.226  17.748   7.215

  No H/Q in entry =          13
  In of MODEL   48
    1    H    GLN  31           H        GLN  31  -4.882  19.196  14.845
    2    HA   GLN  31           HA       GLN  31  -5.675  21.947  15.282
    3    HB2  GLN  31           HB2      GLN  31  -6.832  19.495  16.615
    4    HB3  GLN  31           HB3      GLN  31  -7.607  21.058  16.360
    5    HG2  GLN  31           HG2      GLN  31  -6.884  20.276  13.775
    6    HG3  GLN  31           HG3      GLN  31  -7.395  18.770  14.529
    7   HE21  GLN  31          HE21      GLN  31  -8.817  20.320  12.417
    8   HE22  GLN  31          HE22      GLN  31 -10.335  20.699  13.070

  No H/Q in entry =           8
  In of MODEL   48
    1    H    GLY  32           H        GLY  32  -3.346  20.049  16.616
    2    HA3  GLY  32           HA2      GLY  32  -1.954  20.533  18.419
    3    HA2  GLY  32           HA3      GLY  32  -3.096  21.767  18.934

  No H/Q in entry =           3
  In of MODEL   48
    1    H    ASP  33           H        ASP  33  -4.488  18.711  18.284
    2    HA   ASP  33           HA       ASP  33  -4.899  18.263  21.165
    3    HB2  ASP  33           HB2      ASP  33  -6.291  17.227  18.690
    4    HB3  ASP  33           HB3      ASP  33  -6.634  16.621  20.308

  No H/Q in entry =           4
  In of MODEL   48
    1    H    PHE  34           H        PHE  34  -2.724  17.434  21.479
    2    HA   PHE  34           HA       PHE  34  -1.700  15.188  20.090
    3    HB2  PHE  34           HB2      PHE  34  -1.097  16.191  22.881
    4    HB3  PHE  34           HB3      PHE  34  -0.155  14.973  22.021
    5    HD1  PHE  34           HD1      PHE  34  -0.361  18.400  22.740
    6    HD2  PHE  34           HD2      PHE  34   0.500  15.690  19.519
    7    HE1  PHE  34           HE1      PHE  34   0.920  20.178  21.580
    8    HE2  PHE  34           HE2      PHE  34   1.776  17.472  18.364
    9    HZ   PHE  34           HZ       PHE  34   1.988  19.713  19.399

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ALA  35           H        ALA  35  -3.747  15.459  22.948
    2    HA   ALA  35           HA       ALA  35  -3.512  12.803  23.857
    3    HB3  ALA  35           HB1      ALA  35  -5.977  13.410  24.707
    4    HB1  ALA  35           HB2      ALA  35  -5.458  15.031  24.245
    5    HB2  ALA  35           HB3      ALA  35  -4.537  14.121  25.441

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA  36           H        ALA  36  -5.972  14.288  21.746
    2    HA   ALA  36           HA       ALA  36  -7.364  11.861  21.276
    3    HB1  ALA  36           HB1      ALA  36  -8.831  13.265  20.311
    4    HB3  ALA  36           HB2      ALA  36  -7.660  13.691  19.063
    5    HB2  ALA  36           HB3      ALA  36  -7.696  14.585  20.582

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA  37           H        ALA  37  -4.695  13.466  19.605
    2    HA   ALA  37           HA       ALA  37  -4.641  11.821  17.315
    3    HB3  ALA  37           HB1      ALA  37  -2.667  13.557  18.734
    4    HB2  ALA  37           HB2      ALA  37  -3.195  13.601  17.053
    5    HB1  ALA  37           HB3      ALA  37  -2.031  12.384  17.581

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LYS  38           H        LYS  38  -2.887  11.544  20.398
    2    HA   LYS  38           HA       LYS  38  -1.538   9.155  19.922
    3    HB2  LYS  38           HB2      LYS  38  -1.881  10.924  22.059
    4    HB3  LYS  38           HB3      LYS  38  -2.487   9.391  22.681
    5    HG2  LYS  38           HG2      LYS  38  -0.382   8.288  22.153
    6    HG3  LYS  38           HG3      LYS  38   0.215   9.735  21.334
    7    HD2  LYS  38           HD2      LYS  38   0.369  10.964  23.364
    8    HD3  LYS  38           HD3      LYS  38  -0.641   9.808  24.234
    9    HE2  LYS  38           HE2      LYS  38   1.716   9.517  24.859
   10    HE3  LYS  38           HE3      LYS  38   1.127   8.091  24.000
   11    HZ3  LYS  38           HZ1      LYS  38   2.426   8.515  22.219
   12    HZ2  LYS  38           HZ2      LYS  38   3.372   9.357  23.354
   13    HZ1  LYS  38           HZ3      LYS  38   2.286  10.202  22.357

  No H/Q in entry =          13
  In of MODEL   48
    1    H    ALA  39           H        ALA  39  -4.784   9.625  21.316
    2    HA   ALA  39           HA       ALA  39  -5.319   6.903  21.832
    3    HB3  ALA  39           HB1      ALA  39  -7.495   8.824  21.052
    4    HB2  ALA  39           HB2      ALA  39  -6.602   9.066  22.554
    5    HB1  ALA  39           HB3      ALA  39  -7.504   7.572  22.296

  No H/Q in entry =           5
  In of MODEL   48
    1    H    MET  40           H        MET  40  -5.918   8.898  18.975
    2    HA   MET  40           HA       MET  40  -7.373   6.946  17.521
    3    HB2  MET  40           HB2      MET  40  -5.785   9.353  16.609
    4    HB3  MET  40           HB3      MET  40  -6.800   8.379  15.541
    5    HG2  MET  40           HG2      MET  40  -7.851   9.629  18.092
    6    HG3  MET  40           HG3      MET  40  -7.913  10.457  16.537
    7    HE3  MET  40           HE1      MET  40 -10.477   8.804  14.476
    8    HE2  MET  40           HE2      MET  40  -8.726   8.937  14.330
    9    HE1  MET  40           HE3      MET  40  -9.657  10.296  14.956

  No H/Q in entry =           9
  In of MODEL   48
    1    H    MET  41           H        MET  41  -3.890   7.718  17.646
    2    HA   MET  41           HA       MET  41  -3.110   5.962  15.555
    3    HB2  MET  41           HB2      MET  41  -1.505   6.655  18.028
    4    HB3  MET  41           HB3      MET  41  -0.878   6.006  16.516
    5    HG2  MET  41           HG2      MET  41  -2.055   8.173  15.501
    6    HG3  MET  41           HG3      MET  41  -1.827   8.770  17.143
    7    HE2  MET  41           HE1      MET  41   1.111   6.703  17.519
    8    HE1  MET  41           HE2      MET  41   0.308   7.992  18.410
    9    HE3  MET  41           HE3      MET  41   1.930   8.249  17.769

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ASP  42           H        ASP  42  -3.497   5.500  19.042
    2    HA   ASP  42           HA       ASP  42  -2.436   2.917  19.216
    3    HB2  ASP  42           HB2      ASP  42  -3.330   4.675  21.029
    4    HB3  ASP  42           HB3      ASP  42  -4.747   3.636  20.958

  No H/Q in entry =           4
  In of MODEL   48
    1    H    GLN  43           H        GLN  43  -5.779   3.985  18.704
    2    HA   GLN  43           HA       GLN  43  -6.896   1.385  18.518
    3    HB2  GLN  43           HB2      GLN  43  -7.844   4.023  17.376
    4    HB3  GLN  43           HB3      GLN  43  -8.792   2.534  17.359
    5    HG2  GLN  43           HG2      GLN  43  -8.502   2.427  19.867
    6    HG3  GLN  43           HG3      GLN  43  -7.793   4.039  19.790
    7   HE21  GLN  43          HE21      GLN  43  -9.977   4.103  21.286
    8   HE22  GLN  43          HE22      GLN  43 -11.341   4.661  20.450

  No H/Q in entry =           8
  In of MODEL   48
    1    H    SER  44           H        SER  44  -5.574   3.603  16.100
    2    HA   SER  44           HA       SER  44  -6.255   2.101  13.815
    3    HB2  SER  44           HB2      SER  44  -5.024   4.500  14.252
    4    HB3  SER  44           HB3      SER  44  -3.659   3.515  13.728
    5    HG   SER  44           HG       SER  44  -4.777   4.468  11.959

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ARG  45           H        ARG  45  -3.381   2.027  15.902
    2    HA   ARG  45           HA       ARG  45  -1.878   0.082  14.531
    3    HB2  ARG  45           HB2      ARG  45  -1.054   1.519  16.395
    4    HB3  ARG  45           HB3      ARG  45  -2.039   0.583  17.518
    5    HG2  ARG  45           HG2      ARG  45  -0.785  -1.465  16.886
    6    HG3  ARG  45           HG3      ARG  45   0.223  -0.504  15.806
    7    HD2  ARG  45           HD2      ARG  45   0.940   0.892  17.757
    8    HD3  ARG  45           HD3      ARG  45   0.026  -0.188  18.834
    9    HE   ARG  45           HE       ARG  45   1.745  -1.773  17.263
   10   HH21  ARG  45          HH11      ARG  45   3.652  -2.573  18.108
   11   HH22  ARG  45          HH12      ARG  45   4.414  -1.773  19.437
   12   HH11  ARG  45          HH21      ARG  45   2.018   0.707  19.643
   13   HH12  ARG  45          HH22      ARG  45   3.488   0.086  20.304

  No H/Q in entry =          13
  In of MODEL   48
    1    H    MET  46           H        MET  46  -4.277  -0.252  17.127
    2    HA   MET  46           HA       MET  46  -4.082  -3.048  17.446
    3    HB2  MET  46           HB2      MET  46  -6.267  -1.057  18.038
    4    HB3  MET  46           HB3      MET  46  -6.468  -2.778  18.376
    5    HG2  MET  46           HG2      MET  46  -4.486  -2.766  19.803
    6    HG3  MET  46           HG3      MET  46  -4.179  -1.080  19.412
    7    HE3  MET  46           HE1      MET  46  -7.803  -2.845  20.344
    8    HE2  MET  46           HE2      MET  46  -7.392  -2.928  22.054
    9    HE1  MET  46           HE3      MET  46  -6.343  -3.695  20.865

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ALA  47           H        ALA  47  -6.118  -1.060  15.339
    2    HA   ALA  47           HA       ALA  47  -7.713  -3.131  14.278
    3    HB3  ALA  47           HB1      ALA  47  -8.414  -0.902  13.852
    4    HB1  ALA  47           HB2      ALA  47  -7.915  -1.537  12.284
    5    HB2  ALA  47           HB3      ALA  47  -6.847  -0.454  13.179

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU  48           H        LEU  48  -4.605  -1.797  13.229
    2    HA   LEU  48           HA       LEU  48  -4.304  -3.394  10.895
    3    HB2  LEU  48           HB2      LEU  48  -2.262  -2.089  12.702
    4    HB3  LEU  48           HB3      LEU  48  -1.883  -2.813  11.139
    5    HG   LEU  48           HG       LEU  48  -3.927  -0.612  11.515
    6   HD13  LEU  48          HD11      LEU  48  -1.815   0.286  12.182
    7   HD12  LEU  48          HD12      LEU  48  -2.092   0.830  10.527
    8   HD11  LEU  48          HD13      LEU  48  -0.983  -0.505  10.844
    9   HD22  LEU  48          HD21      LEU  48  -4.385  -1.609   9.442
   10   HD21  LEU  48          HD22      LEU  48  -2.698  -2.030   9.153
   11   HD23  LEU  48          HD23      LEU  48  -3.232  -0.356   8.985

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ASN  49           H        ASN  49  -3.262  -3.768  14.245
    2    HA   ASN  49           HA       ASN  49  -1.639  -6.018  13.927
    3    HB2  ASN  49           HB2      ASN  49  -1.675  -4.682  15.970
    4    HB3  ASN  49           HB3      ASN  49  -3.334  -5.163  16.290
    5   HD21  ASN  49          HD21      ASN  49  -3.261  -6.563  18.033
    6   HD22  ASN  49          HD22      ASN  49  -2.183  -7.863  18.191

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLU  50           H        GLU  50  -5.112  -5.770  14.589
    2    HA   GLU  50           HA       GLU  50  -5.601  -8.573  14.708
    3    HB2  GLU  50           HB2      GLU  50  -7.203  -6.895  15.574
    4    HB3  GLU  50           HB3      GLU  50  -7.497  -6.340  13.924
    5    HG2  GLU  50           HG2      GLU  50  -8.343  -8.545  13.293
    6    HG3  GLU  50           HG3      GLU  50  -7.960  -9.180  14.889

  No H/Q in entry =           6
  In of MODEL   48
    1    H    ALA  51           H        ALA  51  -5.682  -6.185  12.102
    2    HA   ALA  51           HA       ALA  51  -6.649  -7.929  10.085
    3    HB2  ALA  51           HB1      ALA  51  -6.440  -6.120   8.709
    4    HB1  ALA  51           HB2      ALA  51  -4.805  -5.756   9.260
    5    HB3  ALA  51           HB3      ALA  51  -6.195  -5.252  10.223

  No H/Q in entry =           5
  In of MODEL   48
    1    H    HIS  52           H        HIS  52  -3.368  -6.993  11.073
    2    HA   HIS  52           HA       HIS  52  -1.953  -8.479   9.133
    3    HB2  HIS  52           HB2      HIS  52  -0.940  -6.730  10.573
    4    HB3  HIS  52           HB3      HIS  52  -1.097  -7.809  11.959
    5    HD1  HIS  52           HD1      HIS  52   0.252 -10.139  11.765
    6    HD2  HIS  52           HD2      HIS  52   1.322  -7.193   9.016
    7    HE1  HIS  52           HE1      HIS  52   2.494 -10.829  10.811
    8    HE2  HIS  52           HE2      HIS  52   3.159  -9.044   9.133

  No H/Q in entry =           8
  In of MODEL   48
    1    H    LEU  53           H        LEU  53  -3.166  -9.353  12.345
    2    HA   LEU  53           HA       LEU  53  -1.951 -11.888  12.552
    3    HB2  LEU  53           HB2      LEU  53  -4.450 -10.722  13.754
    4    HB3  LEU  53           HB3      LEU  53  -3.974 -12.391  14.057
    5    HG   LEU  53           HG       LEU  53  -2.122 -10.032  14.535
    6   HD11  LEU  53          HD11      LEU  53  -4.088 -11.418  16.365
    7   HD13  LEU  53          HD12      LEU  53  -3.923  -9.692  16.050
    8   HD12  LEU  53          HD13      LEU  53  -2.696 -10.537  16.985
    9   HD22  LEU  53          HD21      LEU  53  -0.758 -11.943  14.502
   10   HD21  LEU  53          HD22      LEU  53  -2.037 -12.985  15.115
   11   HD23  LEU  53          HD23      LEU  53  -1.205 -11.891  16.203

  No H/Q in entry =          11
  In of MODEL   48
    1    H    VAL  54           H        VAL  54  -5.066 -10.885  11.178
    2    HA   VAL  54           HA       VAL  54  -5.961 -13.488  10.499
    3    HB   VAL  54           HB       VAL  54  -6.623 -10.764   9.352
    4   HG12  VAL  54          HG11      VAL  54  -8.714 -12.159   8.540
    5   HG11  VAL  54          HG12      VAL  54  -7.593 -13.517   8.621
    6   HG13  VAL  54          HG13      VAL  54  -7.240 -12.144   7.574
    7   HG22  VAL  54          HG21      VAL  54  -7.535 -10.799  11.501
    8   HG21  VAL  54          HG22      VAL  54  -7.777 -12.544  11.488
    9   HG23  VAL  54          HG23      VAL  54  -8.863 -11.498  10.575

  No H/Q in entry =           9
  In of MODEL   48
    1    H    GLN  55           H        GLN  55  -4.101 -11.031   8.705
    2    HA   GLN  55           HA       GLN  55  -3.955 -12.504   6.293
    3    HB2  GLN  55           HB2      GLN  55  -3.365 -10.236   6.096
    4    HB3  GLN  55           HB3      GLN  55  -2.257 -10.301   7.464
    5    HG2  GLN  55           HG2      GLN  55  -0.531 -11.141   6.196
    6    HG3  GLN  55           HG3      GLN  55  -1.596 -12.126   5.203
    7   HE21  GLN  55          HE21      GLN  55  -1.612 -11.444   3.079
    8   HE22  GLN  55          HE22      GLN  55  -1.423  -9.841   2.563

  No H/Q in entry =           8
  In of MODEL   48
    1    H    THR  56           H        THR  56  -1.856 -12.459   9.179
    2    HA   THR  56           HA       THR  56   0.234 -14.048   8.273
    3    HB   THR  56           HB       THR  56  -1.014 -14.294  11.019
    4    HG1  THR  56           HG1      THR  56   0.554 -12.295   9.822
    5   HG22  THR  56          HG21      THR  56   1.914 -14.352  10.373
    6   HG21  THR  56          HG22      THR  56   0.939 -15.798  10.105
    7   HG23  THR  56          HG23      THR  56   1.055 -15.097  11.720

  No H/Q in entry =           7
  In of MODEL   48
    1    H    LYS  57           H        LYS  57  -2.883 -15.098   9.633
    2    HA   LYS  57           HA       LYS  57  -2.420 -17.892   9.399
    3    HB2  LYS  57           HB2      LYS  57  -4.248 -16.809  10.736
    4    HB3  LYS  57           HB3      LYS  57  -5.038 -16.367   9.230
    5    HG2  LYS  57           HG2      LYS  57  -5.255 -18.737   8.624
    6    HG3  LYS  57           HG3      LYS  57  -4.434 -19.204  10.111
    7    HD2  LYS  57           HD2      LYS  57  -6.248 -18.156  11.436
    8    HD3  LYS  57           HD3      LYS  57  -7.081 -17.723   9.943
    9    HE2  LYS  57           HE2      LYS  57  -7.277 -20.107   9.343
   10    HE3  LYS  57           HE3      LYS  57  -6.409 -20.569  10.804
   11    HZ2  LYS  57           HZ1      LYS  57  -9.056 -19.251  10.615
   12    HZ1  LYS  57           HZ2      LYS  57  -8.185 -19.386  12.068
   13    HZ3  LYS  57           HZ3      LYS  57  -8.700 -20.784  11.250

  No H/Q in entry =          13
  In of MODEL   48
    1    H    LEU  58           H        LEU  58  -3.760 -15.466   7.210
    2    HA   LEU  58           HA       LEU  58  -4.547 -17.304   5.209
    3    HB2  LEU  58           HB2      LEU  58  -3.957 -14.352   5.063
    4    HB3  LEU  58           HB3      LEU  58  -4.611 -15.298   3.725
    5    HG   LEU  58           HG       LEU  58  -5.899 -15.115   6.469
    6   HD11  LEU  58          HD11      LEU  58  -6.202 -13.480   3.970
    7   HD13  LEU  58          HD12      LEU  58  -6.200 -12.965   5.657
    8   HD12  LEU  58          HD13      LEU  58  -7.616 -13.769   4.984
    9   HD22  LEU  58          HD21      LEU  58  -6.849 -17.033   5.604
   10   HD21  LEU  58          HD22      LEU  58  -6.507 -16.586   3.933
   11   HD23  LEU  58          HD23      LEU  58  -7.877 -15.865   4.777

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  59           H        ILE  59  -1.420 -16.071   6.073
    2    HA   ILE  59           HA       ILE  59  -0.311 -16.803   3.443
    3    HB   ILE  59           HB       ILE  59   0.441 -14.728   5.007
    4   HG12  ILE  59          HG12      ILE  59   2.541 -16.373   3.580
    5   HG13  ILE  59          HG13      ILE  59   1.345 -15.433   2.725
    6   HG22  ILE  59          HG21      ILE  59   2.539 -16.759   5.715
    7   HG21  ILE  59          HG22      ILE  59   1.180 -16.494   6.782
    8   HG23  ILE  59          HG23      ILE  59   2.285 -15.174   6.406
    9   HD12  ILE  59          HD11      ILE  59   3.477 -14.189   3.054
   10   HD11  ILE  59          HD12      ILE  59   3.225 -14.297   4.795
   11   HD13  ILE  59          HD13      ILE  59   2.098 -13.380   3.795

  No H/Q in entry =          11
  In of MODEL   48
    1    H    GLU  60           H        GLU  60  -0.325 -17.896   6.815
    2    HA   GLU  60           HA       GLU  60   1.717 -19.863   6.564
    3    HB2  GLU  60           HB2      GLU  60   0.925 -19.061   8.746
    4    HB3  GLU  60           HB3      GLU  60  -0.660 -19.767   8.440
    5    HG2  GLU  60           HG2      GLU  60   0.369 -22.016   8.313
    6    HG3  GLU  60           HG3      GLU  60   1.950 -21.303   8.631

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLY  61           H        GLY  61  -1.791 -19.983   6.068
    2    HA3  GLY  61           HA2      GLY  61  -1.525 -22.778   5.122
    3    HA2  GLY  61           HA3      GLY  61  -3.016 -22.048   5.708

  No H/Q in entry =           3
  In of MODEL   48
    1    H    ASP  62           H        ASP  62  -0.791 -20.460   3.507
    2    HA   ASP  62           HA       ASP  62  -2.897 -20.025   1.591
    3    HB2  ASP  62           HB2      ASP  62  -1.098 -18.810   0.355
    4    HB3  ASP  62           HB3      ASP  62  -1.302 -18.260   2.015

  No H/Q in entry =           4
  In of MODEL   48
    1    H    ALA  63           H        ALA  63  -0.963 -22.688   2.103
    2    HA   ALA  63           HA       ALA  63  -0.046 -23.390  -0.482
    3    HB1  ALA  63           HB1      ALA  63  -0.907 -25.129   1.826
    4    HB2  ALA  63           HB2      ALA  63   0.730 -24.595   1.445
    5    HB3  ALA  63           HB3      ALA  63  -0.099 -25.725   0.375

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLY  64           H        GLY  64  -3.132 -23.855   1.175
    2    HA3  GLY  64           HA2      GLY  64  -5.184 -24.597   0.467
    3    HA2  GLY  64           HA3      GLY  64  -4.786 -23.793  -1.041

  No H/Q in entry =           3
  In of MODEL   48
    1    H    GLU  65           H        GLU  65  -4.894 -25.081  -2.790
    2    HA   GLU  65           HA       GLU  65  -5.435 -27.791  -2.708
    3    HB2  GLU  65           HB2      GLU  65  -4.186 -26.149  -4.908
    4    HB3  GLU  65           HB3      GLU  65  -4.723 -27.817  -5.116
    5    HG2  GLU  65           HG2      GLU  65  -6.998 -27.198  -4.457
    6    HG3  GLU  65           HG3      GLU  65  -6.482 -25.540  -4.162

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLY  66           H        GLY  66  -3.916 -29.183  -4.332
    2    HA3  GLY  66           HA2      GLY  66  -1.861 -30.238  -2.725
    3    HA2  GLY  66           HA3      GLY  66  -2.191 -30.665  -4.394

  No H/Q in entry =           3
  In of MODEL   48
    1    H    LYS  67           H        LYS  67  -1.766 -28.042  -5.457
    2    HA   LYS  67           HA       LYS  67   1.067 -28.178  -5.817
    3    HB2  LYS  67           HB2      LYS  67  -1.056 -26.345  -6.920
    4    HB3  LYS  67           HB3      LYS  67   0.646 -26.271  -7.396
    5    HG2  LYS  67           HG2      LYS  67   0.571 -28.650  -8.052
    6    HG3  LYS  67           HG3      LYS  67  -1.127 -28.727  -7.585
    7    HD2  LYS  67           HD2      LYS  67  -1.684 -27.042  -9.291
    8    HD3  LYS  67           HD3      LYS  67   0.018 -26.939  -9.750
    9    HE2  LYS  67           HE2      LYS  67   0.008 -29.328 -10.359
   10    HE3  LYS  67           HE3      LYS  67  -1.690 -29.442  -9.895
   11    HZ3  LYS  67           HZ1      LYS  67  -2.364 -28.273 -11.704
   12    HZ2  LYS  67           HZ2      LYS  67  -0.972 -28.990 -12.362
   13    HZ1  LYS  67           HZ3      LYS  67  -0.929 -27.379 -11.824

  No H/Q in entry =          13
  In of MODEL   48
    1    H    MET  68           H        MET  68   2.497 -26.366  -5.786
    2    HA   MET  68           HA       MET  68   2.788 -25.229  -3.236
    3    HB2  MET  68           HB2      MET  68   4.132 -24.747  -5.881
    4    HB3  MET  68           HB3      MET  68   4.596 -23.864  -4.426
    5    HG2  MET  68           HG2      MET  68   5.026 -25.991  -3.261
    6    HG3  MET  68           HG3      MET  68   4.545 -26.885  -4.705
    7    HE3  MET  68           HE1      MET  68   7.248 -27.597  -3.503
    8    HE2  MET  68           HE2      MET  68   8.224 -27.639  -4.970
    9    HE1  MET  68           HE3      MET  68   6.556 -28.208  -5.012

  No H/Q in entry =           9
  In of MODEL   48
    1    H    LYS  69           H        LYS  69   1.567 -23.793  -6.248
    2    HA   LYS  69           HA       LYS  69   1.623 -21.154  -5.814
    3    HB2  LYS  69           HB2      LYS  69   0.578 -22.211  -7.766
    4    HB3  LYS  69           HB3      LYS  69  -0.858 -22.548  -6.793
    5    HG2  LYS  69           HG2      LYS  69  -1.283 -20.225  -6.437
    6    HG3  LYS  69           HG3      LYS  69   0.299 -19.769  -7.070
    7    HD2  LYS  69           HD2      LYS  69  -1.770 -19.494  -8.620
    8    HD3  LYS  69           HD3      LYS  69  -0.320 -20.244  -9.292
    9    HE2  LYS  69           HE2      LYS  69  -1.226 -22.441  -9.057
   10    HE3  LYS  69           HE3      LYS  69  -2.544 -21.863  -8.037
   11    HZ1  LYS  69           HZ1      LYS  69  -2.573 -20.454 -10.466
   12    HZ3  LYS  69           HZ2      LYS  69  -3.755 -21.496  -9.830
   13    HZ2  LYS  69           HZ3      LYS  69  -2.512 -22.114 -10.810

  No H/Q in entry =          13
  In of MODEL   48
    1    H    VAL  70           H        VAL  70   0.192 -19.496  -5.054
    2    HA   VAL  70           HA       VAL  70  -1.342 -20.266  -2.632
    3    HB   VAL  70           HB       VAL  70  -0.668 -18.020  -1.733
    4   HG11  VAL  70          HG11      VAL  70   0.557 -20.212  -1.269
    5   HG13  VAL  70          HG12      VAL  70   1.489 -18.739  -0.997
    6   HG12  VAL  70          HG13      VAL  70   1.747 -19.688  -2.461
    7   HG22  VAL  70          HG21      VAL  70   1.026 -16.702  -2.820
    8   HG21  VAL  70          HG22      VAL  70  -0.153 -17.096  -4.069
    9   HG23  VAL  70          HG23      VAL  70   1.368 -17.981  -3.988

  No H/Q in entry =           9
  In of MODEL   48
    1    H    SER  71           H        SER  71  -2.972 -18.614  -2.024
    2    HA   SER  71           HA       SER  71  -4.800 -18.088  -4.112
    3    HB2  SER  71           HB2      SER  71  -5.455 -18.283  -1.710
    4    HB3  SER  71           HB3      SER  71  -4.624 -16.767  -1.378
    5    HG   SER  71           HG       SER  71  -6.916 -17.243  -2.963

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU  72           H        LEU  72  -5.060 -16.410  -5.418
    2    HA   LEU  72           HA       LEU  72  -2.963 -14.586  -5.903
    3    HB2  LEU  72           HB2      LEU  72  -5.826 -14.660  -6.853
    4    HB3  LEU  72           HB3      LEU  72  -4.634 -13.499  -7.432
    5    HG   LEU  72           HG       LEU  72  -4.215 -16.505  -7.550
    6   HD12  LEU  72          HD11      LEU  72  -4.802 -16.313  -9.941
    7   HD11  LEU  72          HD12      LEU  72  -5.198 -14.611  -9.706
    8   HD13  LEU  72          HD13      LEU  72  -6.163 -15.857  -8.917
    9   HD23  LEU  72          HD21      LEU  72  -2.638 -15.659  -9.451
   10   HD22  LEU  72          HD22      LEU  72  -2.091 -15.464  -7.794
   11   HD21  LEU  72          HD23      LEU  72  -2.773 -14.091  -8.661

  No H/Q in entry =          11
  In of MODEL   48
    1    H    VAL  73           H        VAL  73  -6.062 -14.244  -4.280
    2    HA   VAL  73           HA       VAL  73  -6.126 -11.472  -3.938
    3    HB   VAL  73           HB       VAL  73  -7.840 -11.838  -2.351
    4   HG11  VAL  73          HG11      VAL  73  -8.294 -12.596  -4.695
    5   HG13  VAL  73          HG12      VAL  73  -9.261 -13.443  -3.490
    6   HG12  VAL  73          HG13      VAL  73  -7.857 -14.234  -4.208
    7   HG21  VAL  73          HG21      VAL  73  -6.386 -14.427  -1.904
    8   HG23  VAL  73          HG22      VAL  73  -8.112 -14.340  -1.556
    9   HG22  VAL  73          HG23      VAL  73  -6.990 -13.270  -0.717

  No H/Q in entry =           9
  In of MODEL   48
    1    H    LEU  74           H        LEU  74  -4.175 -13.822  -2.343
    2    HA   LEU  74           HA       LEU  74  -3.776 -12.670   0.177
    3    HB2  LEU  74           HB2      LEU  74  -2.977 -14.886  -0.318
    4    HB3  LEU  74           HB3      LEU  74  -1.921 -14.267  -1.587
    5    HG   LEU  74           HG       LEU  74  -0.629 -13.007   0.100
    6   HD11  LEU  74          HD11      LEU  74  -2.711 -14.199   1.939
    7   HD13  LEU  74          HD12      LEU  74  -2.202 -12.514   1.811
    8   HD12  LEU  74          HD13      LEU  74  -1.127 -13.707   2.539
    9   HD22  LEU  74          HD21      LEU  74   0.594 -14.843   0.712
   10   HD21  LEU  74          HD22      LEU  74  -0.460 -15.576  -0.476
   11   HD23  LEU  74          HD23      LEU  74  -0.827 -15.751   1.224

  No H/Q in entry =          11
  In of MODEL   48
    1    H    VAL  75           H        VAL  75  -1.883 -12.273  -2.779
    2    HA   VAL  75           HA       VAL  75  -0.100 -10.334  -1.772
    3    HB   VAL  75           HB       VAL  75  -1.046 -10.849  -4.591
    4   HG11  VAL  75          HG11      VAL  75   1.196  -9.071  -3.534
    5   HG13  VAL  75          HG12      VAL  75  -0.233  -8.541  -4.407
    6   HG12  VAL  75          HG13      VAL  75   0.981  -9.510  -5.225
    7   HG23  VAL  75          HG21      VAL  75   1.523 -11.533  -3.118
    8   HG22  VAL  75          HG22      VAL  75   1.128 -11.980  -4.777
    9   HG21  VAL  75          HG23      VAL  75   0.214 -12.674  -3.437

  No H/Q in entry =           9
  In of MODEL   48
    1    H    GLU  76           H        GLU  76  -3.250 -10.013  -3.436
    2    HA   GLU  76           HA       GLU  76  -3.320  -7.199  -3.546
    3    HB2  GLU  76           HB2      GLU  76  -4.968  -8.646  -4.709
    4    HB3  GLU  76           HB3      GLU  76  -5.616  -9.155  -3.157
    5    HG2  GLU  76           HG2      GLU  76  -7.089  -7.455  -4.026
    6    HG3  GLU  76           HG3      GLU  76  -6.209  -6.733  -2.693

  No H/Q in entry =           6
  In of MODEL   48
    1    H    ALA  77           H        ALA  77  -4.420  -9.427  -1.001
    2    HA   ALA  77           HA       ALA  77  -5.393  -7.425   0.750
    3    HB1  ALA  77           HB1      ALA  77  -4.280 -10.165   1.408
    4    HB2  ALA  77           HB2      ALA  77  -5.960  -9.798   1.021
    5    HB3  ALA  77           HB3      ALA  77  -5.237  -9.158   2.495

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLN  78           H        GLN  78  -2.235  -8.955   0.395
    2    HA   GLN  78           HA       GLN  78  -0.988  -7.780   2.643
    3    HB2  GLN  78           HB2      GLN  78  -0.132  -9.721   1.252
    4    HB3  GLN  78           HB3      GLN  78   0.351  -8.541   0.037
    5    HG2  GLN  78           HG2      GLN  78   1.806  -7.428   1.649
    6    HG3  GLN  78           HG3      GLN  78   1.275  -8.522   2.923
    7   HE21  GLN  78          HE21      GLN  78   1.269 -10.961   1.332
    8   HE22  GLN  78          HE22      GLN  78   2.886 -11.326   0.965

  No H/Q in entry =           8
  In of MODEL   48
    1    H    LEU  79           H        LEU  79  -1.356  -6.732  -0.707
    2    HA   LEU  79           HA       LEU  79   0.317  -4.495  -0.699
    3    HB2  LEU  79           HB2      LEU  79  -0.702  -5.314  -2.751
    4    HB3  LEU  79           HB3      LEU  79  -2.309  -4.930  -2.146
    5    HG   LEU  79           HG       LEU  79  -1.779  -2.540  -2.128
    6   HD13  LEU  79          HD11      LEU  79   0.459  -2.281  -1.613
    7   HD12  LEU  79          HD12      LEU  79   0.509  -1.999  -3.352
    8   HD11  LEU  79          HD13      LEU  79   0.972  -3.572  -2.700
    9   HD23  LEU  79          HD21      LEU  79  -1.142  -2.345  -4.680
   10   HD22  LEU  79          HD22      LEU  79  -2.664  -3.101  -4.220
   11   HD21  LEU  79          HD23      LEU  79  -1.285  -4.103  -4.660

  No H/Q in entry =          11
  In of MODEL   48
    1    H    HIS  80           H        HIS  80  -3.150  -4.674   0.123
    2    HA   HIS  80           HA       HIS  80  -3.358  -1.917   0.777
    3    HB2  HIS  80           HB2      HIS  80  -5.046  -4.334   1.101
    4    HB3  HIS  80           HB3      HIS  80  -5.376  -2.992   2.201
    5    HD1  HIS  80           HD1      HIS  80  -7.001  -1.367   1.285
    6    HD2  HIS  80           HD2      HIS  80  -4.794  -3.177  -1.753
    7    HE1  HIS  80           HE1      HIS  80  -7.843  -0.382  -0.898
    8    HE2  HIS  80           HE2      HIS  80  -6.504  -1.479  -2.760

  No H/Q in entry =           8
  In of MODEL   48
    1    H    LEU  81           H        LEU  81  -2.856  -4.803   2.781
    2    HA   LEU  81           HA       LEU  81  -2.855  -3.447   5.260
    3    HB2  LEU  81           HB2      LEU  81  -1.621  -6.060   4.391
    4    HB3  LEU  81           HB3      LEU  81  -1.601  -5.496   6.063
    5    HG   LEU  81           HG       LEU  81  -4.142  -5.767   4.432
    6   HD12  LEU  81          HD11      LEU  81  -4.437  -7.829   5.986
    7   HD11  LEU  81          HD12      LEU  81  -2.685  -7.749   6.174
    8   HD13  LEU  81          HD13      LEU  81  -3.390  -7.988   4.575
    9   HD23  LEU  81          HD21      LEU  81  -4.988  -5.966   6.933
   10   HD22  LEU  81          HD22      LEU  81  -4.671  -4.378   6.238
   11   HD21  LEU  81          HD23      LEU  81  -3.482  -5.129   7.302

  No H/Q in entry =          11
  In of MODEL   48
    1    H    MET  82           H        MET  82  -0.166  -4.344   3.097
    2    HA   MET  82           HA       MET  82   1.910  -3.434   4.780
    3    HB2  MET  82           HB2      MET  82   1.701  -3.787   1.789
    4    HB3  MET  82           HB3      MET  82   3.179  -3.206   2.553
    5    HG2  MET  82           HG2      MET  82   1.784  -5.800   3.283
    6    HG3  MET  82           HG3      MET  82   3.156  -5.688   2.185
    7    HE3  MET  82           HE1      MET  82   6.166  -4.931   4.171
    8    HE2  MET  82           HE2      MET  82   5.237  -3.570   3.547
    9    HE1  MET  82           HE3      MET  82   5.334  -5.062   2.616

  No H/Q in entry =           9
  In of MODEL   48
    1    H    THR  83           H        THR  83   0.084  -1.809   2.216
    2    HA   THR  83           HA       THR  83   1.485   0.645   2.296
    3    HB   THR  83           HB       THR  83  -0.694   1.557   1.304
    4    HG1  THR  83           HG1      THR  83  -2.339   0.252   1.199
    5   HG22  THR  83          HG21      THR  83  -0.413  -0.266  -0.690
    6   HG21  THR  83          HG22      THR  83   1.088  -0.548   0.190
    7   HG23  THR  83          HG23      THR  83   0.720   1.061  -0.431

  No H/Q in entry =           7
  In of MODEL   48
    1    H    SER  84           H        SER  84  -1.519  -0.395   3.897
    2    HA   SER  84           HA       SER  84  -2.028   2.037   5.232
    3    HB2  SER  84           HB2      SER  84  -2.849  -0.802   5.805
    4    HB3  SER  84           HB3      SER  84  -3.349   0.540   6.833
    5    HG   SER  84           HG       SER  84  -3.803   0.215   4.041

  No H/Q in entry =           5
  In of MODEL   48
    1    H    MET  85           H        MET  85  -0.307  -0.884   6.374
    2    HA   MET  85           HA       MET  85   0.206   0.054   8.976
    3    HB2  MET  85           HB2      MET  85   0.509  -2.291   8.305
    4    HB3  MET  85           HB3      MET  85   1.892  -1.824   7.313
    5    HG2  MET  85           HG2      MET  85   3.041  -0.960   9.326
    6    HG3  MET  85           HG3      MET  85   1.659  -1.436  10.314
    7    HE3  MET  85           HE1      MET  85   1.646  -5.094  10.621
    8    HE2  MET  85           HE2      MET  85   0.775  -4.407   9.253
    9    HE1  MET  85           HE3      MET  85   0.842  -3.528  10.777

  No H/Q in entry =           9
  In of MODEL   48
    1    H    LEU  86           H        LEU  86   2.143   0.308   6.026
    2    HA   LEU  86           HA       LEU  86   4.351   1.631   7.180
    3    HB2  LEU  86           HB2      LEU  86   4.166   0.540   4.875
    4    HB3  LEU  86           HB3      LEU  86   3.353   2.017   4.357
    5    HG   LEU  86           HG       LEU  86   5.375   3.274   5.335
    6   HD11  LEU  86          HD11      LEU  86   6.090   0.668   6.145
    7   HD13  LEU  86          HD12      LEU  86   7.087   2.117   6.239
    8   HD12  LEU  86          HD13      LEU  86   7.202   1.065   4.831
    9   HD23  LEU  86          HD21      LEU  86   6.102   1.506   2.992
   10   HD22  LEU  86          HD22      LEU  86   6.488   3.206   3.248
   11   HD21  LEU  86          HD23      LEU  86   4.838   2.730   2.849

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ALA  87           H        ALA  87   1.435   2.858   5.588
    2    HA   ALA  87           HA       ALA  87   2.019   5.590   5.663
    3    HB1  ALA  87           HB1      ALA  87  -0.283   3.951   5.124
    4    HB3  ALA  87           HB2      ALA  87   0.022   5.612   4.619
    5    HB2  ALA  87           HB3      ALA  87  -0.773   5.293   6.162

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ARG  88           H        ARG  88   0.334   3.590   8.058
    2    HA   ARG  88           HA       ARG  88  -0.188   5.644   9.896
    3    HB2  ARG  88           HB2      ARG  88  -1.118   3.288   9.970
    4    HB3  ARG  88           HB3      ARG  88   0.424   2.797  10.680
    5    HG2  ARG  88           HG2      ARG  88  -0.063   4.875  12.292
    6    HG3  ARG  88           HG3      ARG  88  -1.727   4.542  11.835
    7    HD2  ARG  88           HD2      ARG  88  -1.829   2.697  13.088
    8    HD3  ARG  88           HD3      ARG  88  -0.237   2.119  12.561
    9    HE   ARG  88           HE       ARG  88  -0.779   3.389  15.010
   10   HH21  ARG  88          HH11      ARG  88   0.774   4.412  16.246
   11   HH22  ARG  88          HH12      ARG  88   2.292   4.842  15.542
   12   HH11  ARG  88          HH21      ARG  88   1.504   3.571  12.435
   13   HH12  ARG  88          HH22      ARG  88   2.714   4.350  13.396

  No H/Q in entry =          13
  In of MODEL   48
    1    H    GLU  89           H        GLU  89   2.617   3.436   9.685
    2    HA   GLU  89           HA       GLU  89   3.872   4.339  12.027
    3    HB2  GLU  89           HB2      GLU  89   4.541   2.318  10.692
    4    HB3  GLU  89           HB3      GLU  89   5.314   3.411   9.542
    5    HG2  GLU  89           HG2      GLU  89   6.793   4.271  11.285
    6    HG3  GLU  89           HG3      GLU  89   5.960   3.315  12.507

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LEU  90           H        LEU  90   4.189   5.486   8.696
    2    HA   LEU  90           HA       LEU  90   6.109   7.497   9.276
    3    HB2  LEU  90           HB2      LEU  90   4.108   7.148   7.047
    4    HB3  LEU  90           HB3      LEU  90   5.332   8.424   7.066
    5    HG   LEU  90           HG       LEU  90   6.019   5.492   7.411
    6   HD12  LEU  90          HD11      LEU  90   6.770   5.720   4.972
    7   HD11  LEU  90          HD12      LEU  90   5.748   7.156   4.916
    8   HD13  LEU  90          HD13      LEU  90   5.035   5.581   5.264
    9   HD22  LEU  90          HD21      LEU  90   7.910   6.653   8.092
   10   HD21  LEU  90          HD22      LEU  90   7.555   8.052   7.079
   11   HD23  LEU  90          HD23      LEU  90   8.222   6.588   6.358

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  91           H        ILE  91   2.570   7.495   9.122
    2    HA   ILE  91           HA       ILE  91   2.214  10.267   9.563
    3    HB   ILE  91           HB       ILE  91   0.434   7.885  10.111
    4   HG12  ILE  91          HG12      ILE  91   0.177  10.158   8.118
    5   HG13  ILE  91          HG13      ILE  91   1.045   8.666   7.752
    6   HG22  ILE  91          HG21      ILE  91  -1.309   9.935  10.165
    7   HG21  ILE  91          HG22      ILE  91   0.087  10.775  10.836
    8   HG23  ILE  91          HG23      ILE  91  -0.543   9.337  11.637
    9   HD13  ILE  91          HD11      ILE  91  -0.893   7.369   7.799
   10   HD12  ILE  91          HD12      ILE  91  -1.489   8.879   7.111
   11   HD11  ILE  91          HD13      ILE  91  -1.760   8.520   8.816

  No H/Q in entry =          11
  In of MODEL   48
    1    H    THR  92           H        THR  92   2.628   7.536  11.775
    2    HA   THR  92           HA       THR  92   2.174   8.917  14.193
    3    HB   THR  92           HB       THR  92   3.996   6.589  13.539
    4    HG1  THR  92           HG1      THR  92   2.031   5.821  13.439
    5   HG22  THR  92          HG21      THR  92   3.610   6.313  16.174
    6   HG21  THR  92          HG22      THR  92   3.536   8.072  16.093
    7   HG23  THR  92          HG23      THR  92   4.974   7.222  15.526

  No H/Q in entry =           7
  In of MODEL   48
    1    H    GLU  93           H        GLU  93   5.130   8.477  12.265
    2    HA   GLU  93           HA       GLU  93   6.873   9.920  13.959
    3    HB2  GLU  93           HB2      GLU  93   6.968   9.594  10.946
    4    HB3  GLU  93           HB3      GLU  93   8.304  10.136  11.960
    5    HG2  GLU  93           HG2      GLU  93   6.909   7.493  12.416
    6    HG3  GLU  93           HG3      GLU  93   8.294   7.649  11.341

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LEU  94           H        LEU  94   4.823  10.913  11.239
    2    HA   LEU  94           HA       LEU  94   5.612  13.621  11.130
    3    HB2  LEU  94           HB2      LEU  94   3.031  12.237  10.377
    4    HB3  LEU  94           HB3      LEU  94   3.279  13.965  10.129
    5    HG   LEU  94           HG       LEU  94   5.311  11.985   9.090
    6   HD11  LEU  94          HD11      LEU  94   2.567  12.515   8.021
    7   HD13  LEU  94          HD12      LEU  94   3.560  11.064   7.903
    8   HD12  LEU  94          HD13      LEU  94   3.888  12.442   6.853
    9   HD23  LEU  94          HD21      LEU  94   5.552  13.816   7.360
   10   HD22  LEU  94          HD22      LEU  94   5.961  14.318   9.001
   11   HD21  LEU  94          HD23      LEU  94   4.408  14.774   8.298

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  95           H        ILE  95   3.081  11.995  13.023
    2    HA   ILE  95           HA       ILE  95   2.021  14.343  14.207
    3    HB   ILE  95           HB       ILE  95   2.055  11.465  15.143
    4   HG12  ILE  95          HG12      ILE  95  -0.175  13.220  14.083
    5   HG13  ILE  95          HG13      ILE  95   0.790  12.163  13.057
    6   HG21  ILE  95          HG21      ILE  95   0.755  13.934  16.332
    7   HG23  ILE  95          HG22      ILE  95   1.809  12.776  17.144
    8   HG22  ILE  95          HG23      ILE  95   0.178  12.302  16.667
    9   HD13  ILE  95          HD11      ILE  95  -0.101  10.222  13.982
   10   HD12  ILE  95          HD12      ILE  95  -1.491  11.302  14.051
   11   HD11  ILE  95          HD13      ILE  95  -0.526  11.017  15.499

  No H/Q in entry =          11
  In of MODEL   48
    1    H    GLU  96           H        GLU  96   4.629  12.146  15.216
    2    HA   GLU  96           HA       GLU  96   5.172  13.359  17.704
    3    HB2  GLU  96           HB2      GLU  96   6.136  11.204  17.067
    4    HB3  GLU  96           HB3      GLU  96   7.066  11.978  15.785
    5    HG2  GLU  96           HG2      GLU  96   8.708  12.544  17.249
    6    HG3  GLU  96           HG3      GLU  96   7.554  13.354  18.298

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LEU  97           H        LEU  97   6.247  14.125  14.417
    2    HA   LEU  97           HA       LEU  97   8.117  16.138  15.124
    3    HB2  LEU  97           HB2      LEU  97   6.534  15.567  12.628
    4    HB3  LEU  97           HB3      LEU  97   7.543  17.006  12.746
    5    HG   LEU  97           HG       LEU  97   8.591  14.219  13.319
    6   HD12  LEU  97          HD11      LEU  97   9.591  14.410  11.003
    7   HD11  LEU  97          HD12      LEU  97   8.530  15.792  10.732
    8   HD13  LEU  97          HD13      LEU  97   7.842  14.196  11.032
    9   HD23  LEU  97          HD21      LEU  97  10.752  15.511  12.575
   10   HD22  LEU  97          HD22      LEU  97  10.128  15.782  14.202
   11   HD21  LEU  97          HD23      LEU  97   9.808  16.958  12.928

  No H/Q in entry =          11
  In of MODEL   48
    1    H    HIS  98           H        HIS  98   4.626  16.244  14.462
    2    HA   HIS  98           HA       HIS  98   4.305  19.042  14.586
    3    HB2  HIS  98           HB2      HIS  98   2.431  16.780  15.317
    4    HB3  HIS  98           HB3      HIS  98   1.951  18.477  15.365
    5    HD1  HIS  98           HD1      HIS  98   2.998  15.760  12.973
    6    HD2  HIS  98           HD2      HIS  98   1.591  19.682  12.832
    7    HE1  HIS  98           HE1      HIS  98   2.439  16.235  10.546
    8    HE2  HIS  98           HE2      HIS  98   1.586  18.617  10.439

  No H/Q in entry =           8
  In of MODEL   48
    1    H    GLU  99           H        GLU  99   4.452  16.565  17.095
    2    HA   GLU  99           HA       GLU  99   3.827  18.263  19.285
    3    HB2  GLU  99           HB2      GLU  99   3.757  15.781  19.392
    4    HB3  GLU  99           HB3      GLU  99   5.518  15.749  19.287
    5    HG2  GLU  99           HG2      GLU  99   5.692  17.051  21.356
    6    HG3  GLU  99           HG3      GLU  99   3.939  17.179  21.448

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LYS 100           H        LYS 100   6.891  17.350  17.730
    2    HA   LYS 100           HA       LYS 100   8.532  18.771  19.584
    3    HB2  LYS 100           HB2      LYS 100   9.043  17.839  16.750
    4    HB3  LYS 100           HB3      LYS 100  10.265  18.622  17.757
    5    HG2  LYS 100           HG2      LYS 100   9.899  16.876  19.504
    6    HG3  LYS 100           HG3      LYS 100   8.775  16.059  18.414
    7    HD2  LYS 100           HD2      LYS 100  10.574  15.783  16.752
    8    HD3  LYS 100           HD3      LYS 100  11.703  16.612  17.827
    9    HE2  LYS 100           HE2      LYS 100  11.317  14.861  19.551
   10    HE3  LYS 100           HE3      LYS 100  10.251  14.012  18.427
   11    HZ1  LYS 100           HZ1      LYS 100  13.067  14.701  17.775
   12    HZ3  LYS 100           HZ2      LYS 100  12.033  13.634  16.949
   13    HZ2  LYS 100           HZ3      LYS 100  12.622  13.226  18.490

  No H/Q in entry =          13
  In of MODEL   48
    1    H    LEU 101           H        LEU 101   6.836  19.673  16.621
    2    HA   LEU 101           HA       LEU 101   8.031  22.238  16.278
    3    HB2  LEU 101           HB2      LEU 101   5.447  20.981  15.392
    4    HB3  LEU 101           HB3      LEU 101   5.685  22.713  15.178
    5    HG   LEU 101           HG       LEU 101   7.739  20.708  14.224
    6   HD12  LEU 101          HD11      LEU 101   6.586  21.196  11.935
    7   HD11  LEU 101          HD12      LEU 101   5.181  21.619  12.911
    8   HD13  LEU 101          HD13      LEU 101   5.858  19.994  13.000
    9   HD21  LEU 101          HD21      LEU 101   7.089  23.613  13.655
   10   HD23  LEU 101          HD22      LEU 101   8.080  22.656  12.554
   11   HD22  LEU 101          HD23      LEU 101   8.616  22.925  14.212

  No H/Q in entry =          11
  In of MODEL   48
    1    H    LYS 102           H        LYS 102   6.498  21.098  18.895
    2    HA   LYS 102           HA       LYS 102   5.854  22.193  20.822
    3    HB2  LYS 102           HB2      LYS 102   7.124  24.188  19.692
    4    HB3  LYS 102           HB3      LYS 102   5.521  24.779  19.311
    5    HG2  LYS 102           HG2      LYS 102   6.895  24.544  21.967
    6    HG3  LYS 102           HG3      LYS 102   5.934  25.863  21.331
    7    HD2  LYS 102           HD2      LYS 102   4.708  23.221  22.218
    8    HD3  LYS 102           HD3      LYS 102   4.944  24.588  23.296
    9    HE2  LYS 102           HE2      LYS 102   2.671  24.163  21.805
   10    HE3  LYS 102           HE3      LYS 102   3.161  25.715  22.482
   11    HZ2  LYS 102           HZ1      LYS 102   2.634  25.809  20.101
   12    HZ1  LYS 102           HZ2      LYS 102   3.904  24.736  19.784
   13    HZ3  LYS 102           HZ3      LYS 102   4.235  26.271  20.422

  No H/Q in entry =          13
  In of MODEL   48
    1    H    ALA 103           H        ALA 103   4.210  23.713  18.046
    2    HA   ALA 103           HA       ALA 103   1.750  24.275  18.924
    3    HB1  ALA 103           HB1      ALA 103   0.862  23.418  16.684
    4    HB2  ALA 103           HB2      ALA 103   2.513  22.892  16.359
    5    HB3  ALA 103           HB3      ALA 103   2.166  24.602  16.618

  No H/Q in entry =           5
  In of MODEL   48
    1    H1   ALA   1           H3       ALA   1  10.718 -20.259  -6.161
    2    H2   ALA   1           H2       ALA   1   9.758 -20.477  -7.548
    3    H3   ALA   1           H1       ALA   1   9.323 -21.221  -6.083
    4    HA   ALA   1           HA       ALA   1  10.376 -23.026  -6.814
    5    HB1  ALA   1           HB1      ALA   1  10.473 -22.674  -9.091
    6    HB2  ALA   1           HB2      ALA   1  12.199 -22.511  -8.759
    7    HB3  ALA   1           HB3      ALA   1  11.191 -21.071  -8.917

  No H/Q in entry =           7
  In of MODEL   48
    1    H    GLU   2           H        GLU   2  12.666 -23.961  -6.864
    2    HA   GLU   2           HA       GLU   2  14.043 -23.862  -4.651
    3    HB2  GLU   2           HB2      GLU   2  15.403 -23.732  -7.348
    4    HB3  GLU   2           HB3      GLU   2  16.133 -24.332  -5.860
    5    HG2  GLU   2           HG2      GLU   2  15.130 -26.357  -6.094
    6    HG3  GLU   2           HG3      GLU   2  13.554 -25.622  -6.358

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLU   3           H        GLU   3  15.806 -21.995  -7.057
    2    HA   GLU   3           HA       GLU   3  16.945 -20.293  -5.102
    3    HB2  GLU   3           HB2      GLU   3  16.894 -20.302  -8.112
    4    HB3  GLU   3           HB3      GLU   3  17.630 -18.965  -7.228
    5    HG2  GLU   3           HG2      GLU   3  19.300 -20.325  -6.298
    6    HG3  GLU   3           HG3      GLU   3  18.363 -21.799  -6.515

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LEU   4           H        LEU   4  14.662 -19.470  -7.739
    2    HA   LEU   4           HA       LEU   4  14.178 -16.862  -7.138
    3    HB2  LEU   4           HB2      LEU   4  12.017 -18.853  -7.864
    4    HB3  LEU   4           HB3      LEU   4  11.931 -17.105  -8.069
    5    HG   LEU   4           HG       LEU   4  13.909 -18.961  -9.432
    6   HD13  LEU   4          HD11      LEU   4  12.609 -18.828 -11.345
    7   HD12  LEU   4          HD12      LEU   4  11.891 -17.286 -10.884
    8   HD11  LEU   4          HD13      LEU   4  11.345 -18.777 -10.118
    9   HD23  LEU   4          HD21      LEU   4  14.233 -16.719 -10.792
   10   HD22  LEU   4          HD22      LEU   4  15.092 -16.950  -9.270
   11   HD21  LEU   4          HD23      LEU   4  13.633 -15.963  -9.315

  No H/Q in entry =          11
  In of MODEL   48
    1    H    GLU   5           H        GLU   5  12.708 -19.649  -5.488
    2    HA   GLU   5           HA       GLU   5  11.019 -18.081  -3.793
    3    HB2  GLU   5           HB2      GLU   5  10.620 -20.470  -4.312
    4    HB3  GLU   5           HB3      GLU   5  12.045 -20.885  -3.358
    5    HG2  GLU   5           HG2      GLU   5  11.046 -19.871  -1.369
    6    HG3  GLU   5           HG3      GLU   5   9.640 -19.371  -2.309

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLU   6           H        GLU   6  14.174 -19.639  -3.340
    2    HA   GLU   6           HA       GLU   6  14.518 -18.771  -0.644
    3    HB2  GLU   6           HB2      GLU   6  16.489 -19.698  -2.745
    4    HB3  GLU   6           HB3      GLU   6  16.929 -19.354  -1.070
    5    HG2  GLU   6           HG2      GLU   6  14.818 -21.355  -1.924
    6    HG3  GLU   6           HG3      GLU   6  16.465 -21.772  -1.452

  No H/Q in entry =           6
  In of MODEL   48
    1    H    VAL   7           H        VAL   7  15.279 -17.451  -3.798
    2    HA   VAL   7           HA       VAL   7  16.950 -15.310  -2.939
    3    HB   VAL   7           HB       VAL   7  15.250 -15.694  -5.417
    4   HG11  VAL   7          HG11      VAL   7  17.127 -13.465  -4.611
    5   HG13  VAL   7          HG12      VAL   7  15.485 -13.336  -5.237
    6   HG12  VAL   7          HG13      VAL   7  16.799 -13.834  -6.304
    7   HG21  VAL   7          HG21      VAL   7  17.366 -17.134  -4.840
    8   HG23  VAL   7          HG22      VAL   7  18.261 -15.668  -5.243
    9   HG22  VAL   7          HG23      VAL   7  17.232 -16.430  -6.452

  No H/Q in entry =           9
  In of MODEL   48
    1    H    VAL   8           H        VAL   8  13.460 -15.605  -3.500
    2    HA   VAL   8           HA       VAL   8  12.775 -12.900  -3.039
    3    HB   VAL   8           HB       VAL   8  11.180 -15.439  -2.599
    4   HG12  VAL   8          HG11      VAL   8   9.226 -13.767  -2.761
    5   HG11  VAL   8          HG12      VAL   8  10.422 -12.517  -2.418
    6   HG13  VAL   8          HG13      VAL   8  10.126 -13.799  -1.245
    7   HG22  VAL   8          HG21      VAL   8  10.587 -15.300  -4.823
    8   HG21  VAL   8          HG22      VAL   8  12.059 -14.344  -4.967
    9   HG23  VAL   8          HG23      VAL   8  10.504 -13.540  -4.786

  No H/Q in entry =           9
  In of MODEL   48
    1    H    MET   9           H        MET   9  13.058 -15.696  -0.848
    2    HA   MET   9           HA       MET   9  12.230 -14.421   1.516
    3    HB2  MET   9           HB2      MET   9  14.153 -16.684   0.986
    4    HB3  MET   9           HB3      MET   9  13.848 -16.099   2.622
    5    HG2  MET   9           HG2      MET   9  11.425 -16.497   2.305
    6    HG3  MET   9           HG3      MET   9  11.749 -17.115   0.684
    7    HE2  MET   9           HE1      MET   9  11.373 -18.372   4.473
    8    HE1  MET   9           HE2      MET   9  12.611 -17.141   4.240
    9    HE3  MET   9           HE3      MET   9  13.080 -18.776   4.699

  No H/Q in entry =           9
  In of MODEL   48
    1    H    GLY  10           H        GLY  10  15.415 -14.628  -0.035
    2    HA3  GLY  10           HA2      GLY  10  16.860 -13.188   1.931
    3    HA2  GLY  10           HA3      GLY  10  17.327 -13.357   0.239

  No H/Q in entry =           3
  In of MODEL   48
    1    H    LEU  11           H        LEU  11  15.152 -12.157  -1.008
    2    HA   LEU  11           HA       LEU  11  15.815  -9.406  -0.854
    3    HB2  LEU  11           HB2      LEU  11  13.460 -10.839  -2.087
    4    HB3  LEU  11           HB3      LEU  11  13.727  -9.103  -2.253
    5    HG   LEU  11           HG       LEU  11  15.772 -11.198  -3.030
    6   HD13  LEU  11          HD11      LEU  11  14.032 -11.585  -4.551
    7   HD12  LEU  11          HD12      LEU  11  15.027 -10.399  -5.394
    8   HD11  LEU  11          HD13      LEU  11  13.548  -9.889  -4.580
    9   HD22  LEU  11          HD21      LEU  11  16.988  -9.224  -2.810
   10   HD21  LEU  11          HD22      LEU  11  15.605  -8.200  -3.194
   11   HD23  LEU  11          HD23      LEU  11  16.445  -9.067  -4.479

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  12           H        ILE  12  13.059 -11.249   0.416
    2    HA   ILE  12           HA       ILE  12  11.646  -9.033   1.465
    3    HB   ILE  12           HB       ILE  12  11.705 -11.912   2.424
    4   HG12  ILE  12          HG12      ILE  12  11.014 -11.296  -0.026
    5   HG13  ILE  12          HG13      ILE  12   9.990 -12.383   0.891
    6   HG23  ILE  12          HG21      ILE  12  10.746 -10.519   4.157
    7   HG22  ILE  12          HG22      ILE  12   9.419 -11.342   3.339
    8   HG21  ILE  12          HG23      ILE  12   9.762  -9.651   2.980
    9   HD13  ILE  12          HD11      ILE  12   8.457 -10.573   1.383
   10   HD12  ILE  12          HD12      ILE  12   8.750 -10.599  -0.355
   11   HD11  ILE  12          HD13      ILE  12   9.545  -9.406   0.650

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  13           H        ILE  13  14.055 -11.212   2.883
    2    HA   ILE  13           HA       ILE  13  14.077 -10.023   5.459
    3    HB   ILE  13           HB       ILE  13  16.153 -11.582   3.902
    4   HG12  ILE  13          HG12      ILE  13  13.879 -12.560   4.752
    5   HG13  ILE  13          HG13      ILE  13  15.361 -13.475   5.006
    6   HG22  ILE  13          HG21      ILE  13  17.137 -11.924   6.292
    7   HG21  ILE  13          HG22      ILE  13  16.278 -10.443   6.697
    8   HG23  ILE  13          HG23      ILE  13  17.515 -10.427   5.440
    9   HD12  ILE  13          HD11      ILE  13  13.851 -13.312   7.053
   10   HD11  ILE  13          HD12      ILE  13  14.201 -11.588   7.070
   11   HD13  ILE  13          HD13      ILE  13  15.502 -12.749   7.304

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ASN  14           H        ASN  14  16.030  -9.485   2.542
    2    HA   ASN  14           HA       ASN  14  17.754  -7.522   3.599
    3    HB2  ASN  14           HB2      ASN  14  17.747  -8.798   1.288
    4    HB3  ASN  14           HB3      ASN  14  16.841  -7.392   0.744
    5   HD21  ASN  14          HD21      ASN  14  19.287  -7.711  -0.437
    6   HD22  ASN  14          HD22      ASN  14  20.418  -6.615   0.189

  No H/Q in entry =           6
  In of MODEL   48
    1    H    SER  15           H        SER  15  14.643  -7.213   1.900
    2    HA   SER  15           HA       SER  15  14.502  -4.393   1.945
    3    HB2  SER  15           HB2      SER  15  12.172  -4.666   1.449
    4    HB3  SER  15           HB3      SER  15  12.985  -6.024   0.681
    5    HG   SER  15           HG       SER  15  11.079  -6.070   2.524

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLY  16           H        GLY  16  13.430  -6.855   4.256
    2    HA3  GLY  16           HA2      GLY  16  12.187  -5.112   6.105
    3    HA2  GLY  16           HA3      GLY  16  12.818  -6.713   6.474

  No H/Q in entry =           3
  In of MODEL   48
    1    H    GLN  17           H        GLN  17  15.526  -6.353   5.885
    2    HA   GLN  17           HA       GLN  17  16.466  -5.113   8.263
    3    HB2  GLN  17           HB2      GLN  17  17.900  -5.957   5.731
    4    HB3  GLN  17           HB3      GLN  17  18.736  -5.345   7.159
    5    HG2  GLN  17           HG2      GLN  17  17.812  -7.152   8.518
    6    HG3  GLN  17           HG3      GLN  17  16.875  -7.739   7.145
    7   HE21  GLN  17          HE21      GLN  17  19.736  -8.278   8.813
    8   HE22  GLN  17          HE22      GLN  17  20.619  -9.040   7.580

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ALA  18           H        ALA  18  16.272  -4.050   4.898
    2    HA   ALA  18           HA       ALA  18  17.681  -1.642   5.119
    3    HB2  ALA  18           HB1      ALA  18  16.580  -2.876   3.054
    4    HB3  ALA  18           HB2      ALA  18  16.826  -1.130   3.032
    5    HB1  ALA  18           HB3      ALA  18  15.233  -1.792   3.401

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ARG  19           H        ARG  19  14.187  -2.266   5.511
    2    HA   ARG  19           HA       ARG  19  13.489   0.379   6.215
    3    HB2  ARG  19           HB2      ARG  19  11.828  -1.393   5.632
    4    HB3  ARG  19           HB3      ARG  19  12.176  -2.181   7.173
    5    HG2  ARG  19           HG2      ARG  19  11.441  -0.193   8.403
    6    HG3  ARG  19           HG3      ARG  19  11.184   0.675   6.890
    7    HD2  ARG  19           HD2      ARG  19   9.050  -0.142   7.709
    8    HD3  ARG  19           HD3      ARG  19   9.481  -1.023   6.237
    9    HE   ARG  19           HE       ARG  19  10.453  -2.546   8.350
   10   HH21  ARG  19          HH11      ARG  19   9.220  -4.196   9.293
   11   HH22  ARG  19          HH12      ARG  19   7.500  -4.189   9.119
   12   HH11  ARG  19          HH21      ARG  19   7.447  -1.291   7.245
   13   HH12  ARG  19          HH22      ARG  19   6.497  -2.544   7.955

  No H/Q in entry =          13
  In of MODEL   48
    1    H    SER  20           H        SER  20  14.374  -2.434   8.187
    2    HA   SER  20           HA       SER  20  14.073  -1.328  10.719
    3    HB2  SER  20           HB2      SER  20  14.608  -3.707  10.334
    4    HB3  SER  20           HB3      SER  20  16.224  -3.254   9.800
    5    HG   SER  20           HG       SER  20  15.595  -2.124  12.181

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU  21           H        LEU  21  16.920  -1.243   8.588
    2    HA   LEU  21           HA       LEU  21  18.574   0.268  10.324
    3    HB2  LEU  21           HB2      LEU  21  18.562  -0.018   7.311
    4    HB3  LEU  21           HB3      LEU  21  19.804   0.863   8.199
    5    HG   LEU  21           HG       LEU  21  19.099  -2.035   8.751
    6   HD12  LEU  21          HD11      LEU  21  21.334  -2.431   7.549
    7   HD11  LEU  21          HD12      LEU  21  21.155  -0.797   6.911
    8   HD13  LEU  21          HD13      LEU  21  19.952  -2.027   6.530
    9   HD22  LEU  21          HD21      LEU  21  20.247  -1.293  10.651
   10   HD21  LEU  21          HD22      LEU  21  21.200  -0.114   9.756
   11   HD23  LEU  21          HD23      LEU  21  21.597  -1.822   9.650

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ALA  22           H        ALA  22  16.305   1.202   7.760
    2    HA   ALA  22           HA       ALA  22  16.814   3.966   7.765
    3    HB3  ALA  22           HB1      ALA  22  15.428   2.702   6.088
    4    HB2  ALA  22           HB2      ALA  22  14.704   4.209   6.648
    5    HB1  ALA  22           HB3      ALA  22  14.129   2.666   7.280

  No H/Q in entry =           5
  In of MODEL   48
    1    H    TYR  23           H        TYR  23  14.333   2.130   9.601
    2    HA   TYR  23           HA       TYR  23  13.343   4.362  11.040
    3    HB2  TYR  23           HB2      TYR  23  12.129   2.237  11.026
    4    HB3  TYR  23           HB3      TYR  23  13.469   1.442  11.853
    5    HD1  TYR  23           HD1      TYR  23  10.922   4.143  12.210
    6    HD2  TYR  23           HD2      TYR  23  13.680   1.527  14.210
    7    HE1  TYR  23           HE1      TYR  23   9.987   4.831  14.402
    8    HE2  TYR  23           HE2      TYR  23  12.744   2.215  16.400
    9    HH   TYR  23           HH       TYR  23  10.273   4.753  16.627

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ALA  24           H        ALA  24  16.011   2.117  11.691
    2    HA   ALA  24           HA       ALA  24  16.665   3.129  14.252
    3    HB1  ALA  24           HB1      ALA  24  18.041   1.350  14.097
    4    HB3  ALA  24           HB2      ALA  24  19.061   2.278  12.997
    5    HB2  ALA  24           HB3      ALA  24  17.778   1.254  12.357

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA  25           H        ALA  25  17.619   4.056  10.972
    2    HA   ALA  25           HA       ALA  25  19.543   6.013  11.615
    3    HB1  ALA  25           HB1      ALA  25  18.841   5.049   9.301
    4    HB3  ALA  25           HB2      ALA  25  19.325   6.742   9.389
    5    HB2  ALA  25           HB3      ALA  25  17.615   6.317   9.318

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU  26           H        LEU  26  16.027   6.204  11.245
    2    HA   LEU  26           HA       LEU  26  15.773   8.985  11.685
    3    HB2  LEU  26           HB2      LEU  26  13.926   7.728  10.758
    4    HB3  LEU  26           HB3      LEU  26  13.843   6.704  12.187
    5    HG   LEU  26           HG       LEU  26  13.214   8.661  13.558
    6   HD12  LEU  26          HD11      LEU  26  12.535  10.750  12.224
    7   HD11  LEU  26          HD12      LEU  26  13.525  10.102  10.919
    8   HD13  LEU  26          HD13      LEU  26  14.263  10.500  12.471
    9   HD21  LEU  26          HD21      LEU  26  11.547   8.322  11.046
   10   HD23  LEU  26          HD22      LEU  26  10.977   9.019  12.559
   11   HD22  LEU  26          HD23      LEU  26  11.446   7.322  12.496

  No H/Q in entry =          11
  In of MODEL   48
    1    H    LYS  27           H        LYS  27  15.688   6.213  13.888
    2    HA   LYS  27           HA       LYS  27  15.077   7.582  16.250
    3    HB2  LYS  27           HB2      LYS  27  15.130   5.106  15.994
    4    HB3  LYS  27           HB3      LYS  27  16.892   5.175  15.955
    5    HG2  LYS  27           HG2      LYS  27  16.928   6.170  18.201
    6    HG3  LYS  27           HG3      LYS  27  15.161   6.171  18.242
    7    HD2  LYS  27           HD2      LYS  27  15.160   3.703  18.015
    8    HD3  LYS  27           HD3      LYS  27  16.925   3.710  18.007
    9    HE2  LYS  27           HE2      LYS  27  16.944   4.707  20.260
   10    HE3  LYS  27           HE3      LYS  27  15.178   4.731  20.271
   11    HZ3  LYS  27           HZ1      LYS  27  15.982   2.790  21.430
   12    HZ2  LYS  27           HZ2      LYS  27  16.906   2.315  20.083
   13    HZ1  LYS  27           HZ3      LYS  27  15.208   2.304  20.000

  No H/Q in entry =          13
  In of MODEL   48
    1    H    GLN  28           H        GLN  28  18.202   7.023  14.667
    2    HA   GLN  28           HA       GLN  28  19.872   8.129  16.657
    3    HB2  GLN  28           HB2      GLN  28  20.169   8.081  13.643
    4    HB3  GLN  28           HB3      GLN  28  21.448   8.558  14.758
    5    HG2  GLN  28           HG2      GLN  28  20.043   5.873  14.793
    6    HG3  GLN  28           HG3      GLN  28  21.626   6.169  14.077
    7   HE21  GLN  28          HE21      GLN  28  20.337   4.861  16.783
    8   HE22  GLN  28          HE22      GLN  28  21.524   5.282  17.919

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ALA  29           H        ALA  29  18.113   9.586  13.956
    2    HA   ALA  29           HA       ALA  29  19.088  12.216  14.201
    3    HB2  ALA  29           HB1      ALA  29  17.387  12.833  12.724
    4    HB1  ALA  29           HB2      ALA  29  16.252  11.653  13.377
    5    HB3  ALA  29           HB3      ALA  29  17.589  11.118  12.358

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LYS  30           H        LYS  30  16.322  10.599  15.722
    2    HA   LYS  30           HA       LYS  30  15.286  12.849  17.069
    3    HB2  LYS  30           HB2      LYS  30  15.197   9.910  17.783
    4    HB3  LYS  30           HB3      LYS  30  14.319  11.156  18.670
    5    HG2  LYS  30           HG2      LYS  30  13.193  11.825  16.547
    6    HG3  LYS  30           HG3      LYS  30  14.010  10.492  15.727
    7    HD2  LYS  30           HD2      LYS  30  12.948   8.882  17.259
    8    HD3  LYS  30           HD3      LYS  30  12.141  10.204  18.103
    9    HE2  LYS  30           HE2      LYS  30  10.973  10.820  16.006
   10    HE3  LYS  30           HE3      LYS  30  11.760   9.469  15.182
   11    HZ2  LYS  30           HZ1      LYS  30   9.453   9.044  16.058
   12    HZ1  LYS  30           HZ2      LYS  30  10.117   9.108  17.627
   13    HZ3  LYS  30           HZ3      LYS  30  10.637   7.923  16.522

  No H/Q in entry =          13
  In of MODEL   48
    1    H    GLN  31           H        GLN  31  17.963  10.703  17.819
    2    HA   GLN  31           HA       GLN  31  18.276  11.730  20.511
    3    HB2  GLN  31           HB2      GLN  31  20.315  10.169  18.916
    4    HB3  GLN  31           HB3      GLN  31  20.176  10.299  20.669
    5    HG2  GLN  31           HG2      GLN  31  17.672   9.324  19.899
    6    HG3  GLN  31           HG3      GLN  31  18.782   8.485  18.824
    7   HE21  GLN  31          HE21      GLN  31  17.244   7.335  21.101
    8   HE22  GLN  31          HE22      GLN  31  18.402   6.686  22.156

  No H/Q in entry =           8
  In of MODEL   48
    1    H    GLY  32           H        GLY  32  18.791  13.041  17.540
    2    HA3  GLY  32           HA2      GLY  32  19.761  15.092  17.021
    3    HA2  GLY  32           HA3      GLY  32  20.515  15.108  18.610

  No H/Q in entry =           3
  In of MODEL   48
    1    H    ASP  33           H        ASP  33  20.963  12.213  16.845
    2    HA   ASP  33           HA       ASP  33  23.784  12.908  16.382
    3    HB2  ASP  33           HB2      ASP  33  22.296  10.281  16.504
    4    HB3  ASP  33           HB3      ASP  33  23.982  10.409  16.012

  No H/Q in entry =           4
  In of MODEL   48
    1    H    PHE  34           H        PHE  34  23.296  14.221  14.495
    2    HA   PHE  34           HA       PHE  34  21.960  13.218  12.208
    3    HB2  PHE  34           HB2      PHE  34  24.073  15.370  12.435
    4    HB3  PHE  34           HB3      PHE  34  23.093  15.067  11.002
    5    HD1  PHE  34           HD1      PHE  34  23.323  17.013  13.910
    6    HD2  PHE  34           HD2      PHE  34  20.467  14.866  11.525
    7    HE1  PHE  34           HE1      PHE  34  21.493  18.400  14.848
    8    HE2  PHE  34           HE2      PHE  34  18.642  16.252  12.467
    9    HZ   PHE  34           HZ       PHE  34  19.158  18.020  14.124

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ALA  35           H        ALA  35  25.334  13.062  13.224
    2    HA   ALA  35           HA       ALA  35  26.451  12.241  10.772
    3    HB3  ALA  35           HB1      ALA  35  28.137  11.091  12.499
    4    HB2  ALA  35           HB2      ALA  35  27.263  12.114  13.639
    5    HB1  ALA  35           HB3      ALA  35  28.096  12.839  12.266

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA  36           H        ALA  36  25.346  10.286  13.542
    2    HA   ALA  36           HA       ALA  36  25.853   7.798  12.276
    3    HB2  ALA  36           HB1      ALA  36  25.425   7.055  14.354
    4    HB3  ALA  36           HB2      ALA  36  23.733   7.535  14.198
    5    HB1  ALA  36           HB3      ALA  36  24.923   8.679  14.819

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA  37           H        ALA  37  23.013   9.900  12.397
    2    HA   ALA  37           HA       ALA  37  21.175   8.110  11.223
    3    HB3  ALA  37           HB1      ALA  37  21.374  11.076  11.506
    4    HB1  ALA  37           HB2      ALA  37  20.071   9.987  11.979
    5    HB2  ALA  37           HB3      ALA  37  20.259  10.455  10.288

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LYS  38           H        LYS  38  23.255  10.584   9.740
    2    HA   LYS  38           HA       LYS  38  22.625  10.141   7.063
    3    HB2  LYS  38           HB2      LYS  38  24.418  11.720   8.506
    4    HB3  LYS  38           HB3      LYS  38  25.462  10.736   7.486
    5    HG2  LYS  38           HG2      LYS  38  24.295  11.489   5.485
    6    HG3  LYS  38           HG3      LYS  38  23.090  12.336   6.461
    7    HD2  LYS  38           HD2      LYS  38  24.669  13.952   7.210
    8    HD3  LYS  38           HD3      LYS  38  26.039  12.977   6.681
    9    HE2  LYS  38           HE2      LYS  38  25.668  14.839   5.122
   10    HE3  LYS  38           HE3      LYS  38  25.349  13.296   4.323
   11    HZ3  LYS  38           HZ1      LYS  38  23.149  13.719   4.187
   12    HZ2  LYS  38           HZ2      LYS  38  23.656  15.340   4.269
   13    HZ1  LYS  38           HZ3      LYS  38  23.087  14.555   5.663

  No H/Q in entry =          13
  In of MODEL   48
    1    H    ALA  39           H        ALA  39  25.150   8.574   9.030
    2    HA   ALA  39           HA       ALA  39  26.239   6.989   6.968
    3    HB2  ALA  39           HB1      ALA  39  26.153   6.034   9.815
    4    HB1  ALA  39           HB2      ALA  39  27.093   7.467   9.396
    5    HB3  ALA  39           HB3      ALA  39  27.461   5.918   8.638

  No H/Q in entry =           5
  In of MODEL   48
    1    H    MET  40           H        MET  40  23.627   6.356   9.263
    2    HA   MET  40           HA       MET  40  23.212   3.644   8.538
    3    HB2  MET  40           HB2      MET  40  21.373   5.675   9.819
    4    HB3  MET  40           HB3      MET  40  20.983   3.961   9.649
    5    HG2  MET  40           HG2      MET  40  23.521   4.932  10.992
    6    HG3  MET  40           HG3      MET  40  22.027   4.644  11.883
    7    HE3  MET  40           HE1      MET  40  21.499   1.006  12.071
    8    HE2  MET  40           HE2      MET  40  20.619   2.297  11.257
    9    HE1  MET  40           HE3      MET  40  21.354   2.598  12.830

  No H/Q in entry =           9
  In of MODEL   48
    1    H    MET  41           H        MET  41  21.770   6.679   7.337
    2    HA   MET  41           HA       MET  41  19.829   5.459   5.665
    3    HB2  MET  41           HB2      MET  41  21.285   8.062   5.146
    4    HB3  MET  41           HB3      MET  41  19.763   7.550   4.426
    5    HG2  MET  41           HG2      MET  41  19.014   7.363   6.976
    6    HG3  MET  41           HG3      MET  41  20.311   8.535   7.197
    7    HE2  MET  41           HE1      MET  41  19.742   9.805   3.855
    8    HE1  MET  41           HE2      MET  41  20.691  10.259   5.266
    9    HE3  MET  41           HE3      MET  41  19.409  11.324   4.696

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ASP  42           H        ASP  42  23.193   6.414   5.115
    2    HA   ASP  42           HA       ASP  42  23.295   5.931   2.360
    3    HB2  ASP  42           HB2      ASP  42  25.032   6.952   4.129
    4    HB3  ASP  42           HB3      ASP  42  25.706   5.333   4.008

  No H/Q in entry =           4
  In of MODEL   48
    1    H    GLN  43           H        GLN  43  24.036   3.793   5.089
    2    HA   GLN  43           HA       GLN  43  24.726   1.537   3.516
    3    HB2  GLN  43           HB2      GLN  43  23.696   1.720   6.357
    4    HB3  GLN  43           HB3      GLN  43  24.292   0.234   5.608
    5    HG2  GLN  43           HG2      GLN  43  26.443   1.465   5.097
    6    HG3  GLN  43           HG3      GLN  43  25.845   2.790   6.091
    7   HE21  GLN  43          HE21      GLN  43  28.086   1.843   7.135
    8   HE22  GLN  43          HE22      GLN  43  27.820   0.762   8.415

  No H/Q in entry =           8
  In of MODEL   48
    1    H    SER  44           H        SER  44  21.656   2.644   4.891
    2    HA   SER  44           HA       SER  44  20.111   0.383   4.223
    3    HB2  SER  44           HB2      SER  44  19.642   2.911   5.359
    4    HB3  SER  44           HB3      SER  44  18.611   2.852   3.932
    5    HG   SER  44           HG       SER  44  17.523   1.904   5.656

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ARG  45           H        ARG  45  20.827   3.348   2.409
    2    HA   ARG  45           HA       ARG  45  19.312   2.839   0.103
    3    HB2  ARG  45           HB2      ARG  45  20.433   4.989   0.682
    4    HB3  ARG  45           HB3      ARG  45  21.986   4.248   0.302
    5    HG2  ARG  45           HG2      ARG  45  21.211   3.827  -2.012
    6    HG3  ARG  45           HG3      ARG  45  19.670   4.590  -1.631
    7    HD2  ARG  45           HD2      ARG  45  20.898   6.701  -1.052
    8    HD3  ARG  45           HD3      ARG  45  22.403   5.941  -1.615
    9    HE   ARG  45           HE       ARG  45  20.479   5.676  -3.654
   10   HH21  ARG  45          HH11      ARG  45  20.462   7.039  -5.422
   11   HH22  ARG  45          HH12      ARG  45  21.203   8.597  -5.322
   12   HH11  ARG  45          HH21      ARG  45  22.182   8.198  -2.033
   13   HH12  ARG  45          HH22      ARG  45  22.176   9.252  -3.400

  No H/Q in entry =          13
  In of MODEL   48
    1    H    MET  46           H        MET  46  22.683   2.000   0.860
    2    HA   MET  46           HA       MET  46  23.305   0.804  -1.619
    3    HB2  MET  46           HB2      MET  46  24.411   0.510   1.173
    4    HB3  MET  46           HB3      MET  46  25.073  -0.398  -0.189
    5    HG2  MET  46           HG2      MET  46  25.509   1.693  -1.401
    6    HG3  MET  46           HG3      MET  46  24.796   2.622  -0.088
    7    HE3  MET  46           HE1      MET  46  27.404  -0.580   0.213
    8    HE2  MET  46           HE2      MET  46  28.769   0.420  -0.274
    9    HE1  MET  46           HE3      MET  46  27.364   0.284  -1.330

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ALA  47           H        ALA  47  21.930  -0.531   1.360
    2    HA   ALA  47           HA       ALA  47  21.903  -3.247   0.567
    3    HB2  ALA  47           HB1      ALA  47  21.516  -2.782   2.869
    4    HB3  ALA  47           HB2      ALA  47  19.986  -3.401   2.250
    5    HB1  ALA  47           HB3      ALA  47  20.199  -1.667   2.503

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU  48           H        LEU  48  19.526  -0.643   0.197
    2    HA   LEU  48           HA       LEU  48  17.497  -2.200  -1.050
    3    HB2  LEU  48           HB2      LEU  48  18.125   0.760  -1.176
    4    HB3  LEU  48           HB3      LEU  48  16.661   0.033  -1.841
    5    HG   LEU  48           HG       LEU  48  17.514  -0.250   1.049
    6   HD13  LEU  48          HD11      LEU  48  17.076   2.047   0.853
    7   HD12  LEU  48          HD12      LEU  48  15.523   1.387   1.363
    8   HD11  LEU  48          HD13      LEU  48  15.792   1.805  -0.329
    9   HD22  LEU  48          HD21      LEU  48  16.001  -1.979   0.674
   10   HD21  LEU  48          HD22      LEU  48  15.121  -1.089  -0.569
   11   HD23  LEU  48          HD23      LEU  48  14.903  -0.680   1.133

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ASN  49           H        ASN  49  20.169  -0.253  -2.286
    2    HA   ASN  49           HA       ASN  49  19.522  -0.353  -5.010
    3    HB2  ASN  49           HB2      ASN  49  21.185   1.184  -4.103
    4    HB3  ASN  49           HB3      ASN  49  22.223  -0.160  -3.645
    5   HD21  ASN  49          HD21      ASN  49  23.969  -0.092  -5.041
    6   HD22  ASN  49          HD22      ASN  49  23.860   0.077  -6.727

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLU  50           H        GLU  50  21.523  -2.522  -3.037
    2    HA   GLU  50           HA       GLU  50  22.242  -4.281  -5.155
    3    HB2  GLU  50           HB2      GLU  50  23.437  -4.236  -2.988
    4    HB3  GLU  50           HB3      GLU  50  22.000  -4.873  -2.191
    5    HG2  GLU  50           HG2      GLU  50  22.108  -6.911  -3.541
    6    HG3  GLU  50           HG3      GLU  50  23.479  -6.270  -4.444

  No H/Q in entry =           6
  In of MODEL   48
    1    H    ALA  51           H        ALA  51  19.583  -4.228  -2.831
    2    HA   ALA  51           HA       ALA  51  18.439  -6.714  -3.579
    3    HB3  ALA  51           HB1      ALA  51  16.841  -6.216  -2.027
    4    HB1  ALA  51           HB2      ALA  51  16.614  -4.574  -2.633
    5    HB2  ALA  51           HB3      ALA  51  17.976  -4.944  -1.574

  No H/Q in entry =           5
  In of MODEL   48
    1    H    HIS  52           H        HIS  52  17.825  -3.376  -4.629
    2    HA   HIS  52           HA       HIS  52  15.717  -3.928  -6.428
    3    HB2  HIS  52           HB2      HIS  52  16.329  -1.654  -5.645
    4    HB3  HIS  52           HB3      HIS  52  17.804  -1.741  -6.606
    5    HD1  HIS  52           HD1      HIS  52  17.440  -2.027  -9.263
    6    HD2  HIS  52           HD2      HIS  52  14.067  -0.898  -7.088
    7    HE1  HIS  52           HE1      HIS  52  15.768  -1.138 -10.944
    8    HE2  HIS  52           HE2      HIS  52  13.707  -0.445  -9.634

  No H/Q in entry =           8
  In of MODEL   48
    1    H    LEU  53           H        LEU  53  19.236  -3.905  -6.858
    2    HA   LEU  53           HA       LEU  53  19.298  -4.232  -9.657
    3    HB2  LEU  53           HB2      LEU  53  21.236  -4.970  -7.479
    4    HB3  LEU  53           HB3      LEU  53  21.557  -5.358  -9.166
    5    HG   LEU  53           HG       LEU  53  20.877  -2.554  -8.219
    6   HD11  LEU  53          HD11      LEU  53  23.544  -3.943  -8.551
    7   HD13  LEU  53          HD12      LEU  53  22.934  -3.089  -7.134
    8   HD12  LEU  53          HD13      LEU  53  23.381  -2.189  -8.578
    9   HD22  LEU  53          HD21      LEU  53  20.563  -2.570 -10.549
   10   HD21  LEU  53          HD22      LEU  53  21.811  -3.785 -10.803
   11   HD23  LEU  53          HD23      LEU  53  22.263  -2.130 -10.444

  No H/Q in entry =          11
  In of MODEL   48
    1    H    VAL  54           H        VAL  54  19.205  -6.609  -7.021
    2    HA   VAL  54           HA       VAL  54  19.350  -8.909  -8.670
    3    HB   VAL  54           HB       VAL  54  18.190  -8.484  -5.906
    4   HG12  VAL  54          HG11      VAL  54  18.537 -11.098  -5.890
    5   HG11  VAL  54          HG12      VAL  54  18.352 -10.939  -7.636
    6   HG13  VAL  54          HG13      VAL  54  17.058 -10.415  -6.560
    7   HG22  VAL  54          HG21      VAL  54  20.503  -8.251  -5.682
    8   HG21  VAL  54          HG22      VAL  54  20.851  -9.346  -7.018
    9   HG23  VAL  54          HG23      VAL  54  20.326  -9.991  -5.463

  No H/Q in entry =           9
  In of MODEL   48
    1    H    GLN  55           H        GLN  55  16.603  -7.025  -7.398
    2    HA   GLN  55           HA       GLN  55  14.598  -8.713  -8.465
    3    HB2  GLN  55           HB2      GLN  55  13.835  -7.187  -6.846
    4    HB3  GLN  55           HB3      GLN  55  14.616  -5.815  -7.628
    5    HG2  GLN  55           HG2      GLN  55  12.889  -5.513  -9.120
    6    HG3  GLN  55           HG3      GLN  55  12.584  -7.237  -9.282
    7   HE21  GLN  55          HE21      GLN  55  10.581  -7.802  -8.476
    8   HE22  GLN  55          HE22      GLN  55   9.800  -7.049  -7.171

  No H/Q in entry =           8
  In of MODEL   48
    1    H    THR  56           H        THR  56  16.312  -5.903  -9.836
    2    HA   THR  56           HA       THR  56  14.872  -5.565 -12.187
    3    HB   THR  56           HB       THR  56  17.890  -5.448 -12.024
    4    HG1  THR  56           HG1      THR  56  15.875  -3.740 -11.059
    5   HG22  THR  56          HG21      THR  56  16.108  -3.576 -13.546
    6   HG21  THR  56          HG22      THR  56  16.470  -5.164 -14.221
    7   HG23  THR  56          HG23      THR  56  17.781  -4.036 -13.869

  No H/Q in entry =           7
  In of MODEL   48
    1    H    LYS  57           H        LYS  57  17.543  -7.834 -11.564
    2    HA   LYS  57           HA       LYS  57  17.557  -9.040 -14.137
    3    HB2  LYS  57           HB2      LYS  57  19.351  -9.270 -12.395
    4    HB3  LYS  57           HB3      LYS  57  18.255 -10.263 -11.446
    5    HG2  LYS  57           HG2      LYS  57  18.154 -11.920 -13.252
    6    HG3  LYS  57           HG3      LYS  57  19.209 -10.924 -14.248
    7    HD2  LYS  57           HD2      LYS  57  21.005 -11.144 -12.558
    8    HD3  LYS  57           HD3      LYS  57  19.955 -12.167 -11.580
    9    HE2  LYS  57           HE2      LYS  57  19.829 -13.813 -13.419
   10    HE3  LYS  57           HE3      LYS  57  20.868 -12.797 -14.417
   11    HZ2  LYS  57           HZ1      LYS  57  21.568 -14.163 -11.887
   12    HZ1  LYS  57           HZ2      LYS  57  22.544 -12.968 -12.594
   13    HZ3  LYS  57           HZ3      LYS  57  22.235 -14.417 -13.424

  No H/Q in entry =          13
  In of MODEL   48
    1    H    LEU  58           H        LEU  58  15.782  -9.711 -11.159
    2    HA   LEU  58           HA       LEU  58  14.584 -12.101 -12.083
    3    HB2  LEU  58           HB2      LEU  58  13.769 -10.194  -9.897
    4    HB3  LEU  58           HB3      LEU  58  12.978 -11.741 -10.206
    5    HG   LEU  58           HG       LEU  58  15.948 -11.430  -9.651
    6   HD11  LEU  58          HD11      LEU  58  13.580 -11.863  -7.858
    7   HD13  LEU  58          HD12      LEU  58  15.024 -10.884  -7.599
    8   HD12  LEU  58          HD13      LEU  58  15.114 -12.639  -7.456
    9   HD22  LEU  58          HD21      LEU  58  15.851 -13.498 -10.669
   10   HD21  LEU  58          HD22      LEU  58  14.140 -13.723 -10.309
   11   HD23  LEU  58          HD23      LEU  58  15.351 -14.006  -9.057

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  59           H        ILE  59  13.880  -8.774 -12.782
    2    HA   ILE  59           HA       ILE  59  11.171  -9.455 -13.720
    3    HB   ILE  59           HB       ILE  59  11.952  -7.159 -12.524
    4   HG12  ILE  59          HG12      ILE  59  10.046  -7.070 -14.875
    5   HG13  ILE  59          HG13      ILE  59   9.634  -7.831 -13.361
    6   HG22  ILE  59          HG21      ILE  59  12.041  -6.371 -15.425
    7   HG21  ILE  59          HG22      ILE  59  13.514  -6.752 -14.563
    8   HG23  ILE  59          HG23      ILE  59  12.491  -5.419 -14.032
    9   HD12  ILE  59          HD11      ILE  59   8.861  -5.464 -13.483
   10   HD11  ILE  59          HD12      ILE  59  10.547  -4.965 -13.612
   11   HD13  ILE  59          HD13      ILE  59   9.971  -5.754 -12.142

  No H/Q in entry =          11
  In of MODEL   48
    1    H    GLU  60           H        GLU  60  14.367  -8.577 -14.981
    2    HA   GLU  60           HA       GLU  60  13.584  -8.197 -17.691
    3    HB2  GLU  60           HB2      GLU  60  15.760  -7.447 -16.816
    4    HB3  GLU  60           HB3      GLU  60  16.238  -9.121 -16.554
    5    HG2  GLU  60           HG2      GLU  60  16.041  -9.566 -18.973
    6    HG3  GLU  60           HG3      GLU  60  15.546  -7.896 -19.242

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLY  61           H        GLY  61  14.590 -11.060 -15.862
    2    HA3  GLY  61           HA2      GLY  61  14.066 -12.724 -18.256
    3    HA2  GLY  61           HA3      GLY  61  15.103 -13.189 -16.911

  No H/Q in entry =           3
  In of MODEL   48
    1    H    ASP  62           H        ASP  62  11.969 -11.671 -16.543
    2    HA   ASP  62           HA       ASP  62  11.060 -13.816 -14.853
    3    HB2  ASP  62           HB2      ASP  62   9.022 -12.394 -14.653
    4    HB3  ASP  62           HB3      ASP  62  10.513 -11.553 -14.243

  No H/Q in entry =           4
  In of MODEL   48
    1    H    ALA  63           H        ALA  63  11.108 -13.562 -18.178
    2    HA   ALA  63           HA       ALA  63   8.509 -14.369 -18.975
    3    HB1  ALA  63           HB1      ALA  63  11.214 -14.934 -20.216
    4    HB3  ALA  63           HB2      ALA  63  10.134 -13.599 -20.609
    5    HB2  ALA  63           HB3      ALA  63   9.670 -15.254 -21.007

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLY  64           H        GLY  64  11.348 -16.178 -17.930
    2    HA3  GLY  64           HA2      GLY  64  11.678 -18.381 -17.384
    3    HA2  GLY  64           HA3      GLY  64  10.037 -18.313 -16.758

  No H/Q in entry =           3
  In of MODEL   48
    1    H    GLU  65           H        GLU  65   8.716 -19.820 -17.589
    2    HA   GLU  65           HA       GLU  65   9.396 -21.580 -19.603
    3    HB2  GLU  65           HB2      GLU  65   6.665 -20.739 -18.643
    4    HB3  GLU  65           HB3      GLU  65   6.943 -22.092 -19.738
    5    HG2  GLU  65           HG2      GLU  65   8.388 -23.173 -18.084
    6    HG3  GLU  65           HG3      GLU  65   8.196 -21.803 -16.993

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLY  66           H        GLY  66   7.549 -21.880 -21.416
    2    HA3  GLY  66           HA2      GLY  66   8.276 -20.203 -23.551
    3    HA2  GLY  66           HA3      GLY  66   6.987 -21.390 -23.565

  No H/Q in entry =           3
  In of MODEL   48
    1    H    LYS  67           H        LYS  67   5.450 -20.193 -21.474
    2    HA   LYS  67           HA       LYS  67   3.971 -18.318 -23.040
    3    HB2  LYS  67           HB2      LYS  67   3.590 -19.435 -20.268
    4    HB3  LYS  67           HB3      LYS  67   2.449 -18.323 -21.033
    5    HG2  LYS  67           HG2      LYS  67   2.225 -19.864 -22.948
    6    HG3  LYS  67           HG3      LYS  67   3.359 -20.978 -22.188
    7    HD2  LYS  67           HD2      LYS  67   1.820 -21.264 -20.288
    8    HD3  LYS  67           HD3      LYS  67   0.686 -20.136 -21.034
    9    HE2  LYS  67           HE2      LYS  67   0.488 -21.622 -22.994
   10    HE3  LYS  67           HE3      LYS  67   1.621 -22.752 -22.252
   11    HZ3  LYS  67           HZ1      LYS  67   0.103 -23.417 -20.715
   12    HZ2  LYS  67           HZ2      LYS  67  -0.955 -23.040 -21.989
   13    HZ1  LYS  67           HZ3      LYS  67  -0.732 -21.941 -20.712

  No H/Q in entry =          13
  In of MODEL   48
    1    H    MET  68           H        MET  68   3.140 -16.312 -22.291
    2    HA   MET  68           HA       MET  68   5.123 -14.410 -21.739
    3    HB2  MET  68           HB2      MET  68   2.119 -14.312 -21.780
    4    HB3  MET  68           HB3      MET  68   3.091 -12.885 -21.422
    5    HG2  MET  68           HG2      MET  68   4.283 -13.143 -23.558
    6    HG3  MET  68           HG3      MET  68   3.339 -14.589 -23.918
    7    HE3  MET  68           HE1      MET  68   3.412 -12.471 -26.050
    8    HE2  MET  68           HE2      MET  68   1.706 -12.335 -26.468
    9    HE1  MET  68           HE3      MET  68   2.386 -13.912 -26.079

  No H/Q in entry =           9
  In of MODEL   48
    1    H    LYS  69           H        LYS  69   2.759 -15.909 -19.530
    2    HA   LYS  69           HA       LYS  69   2.698 -14.272 -17.401
    3    HB2  LYS  69           HB2      LYS  69   1.811 -16.710 -17.749
    4    HB3  LYS  69           HB3      LYS  69   3.243 -17.148 -16.816
    5    HG2  LYS  69           HG2      LYS  69   2.480 -15.255 -15.194
    6    HG3  LYS  69           HG3      LYS  69   0.915 -15.429 -15.990
    7    HD2  LYS  69           HD2      LYS  69   2.388 -17.379 -14.258
    8    HD3  LYS  69           HD3      LYS  69   0.674 -16.957 -14.263
    9    HE2  LYS  69           HE2      LYS  69   0.614 -18.030 -16.613
   10    HE3  LYS  69           HE3      LYS  69   2.168 -18.743 -16.182
   11    HZ1  LYS  69           HZ1      LYS  69  -0.021 -18.974 -14.260
   12    HZ3  LYS  69           HZ2      LYS  69   1.245 -20.054 -14.598
   13    HZ2  LYS  69           HZ3      LYS  69  -0.088 -19.948 -15.646

  No H/Q in entry =          13
  In of MODEL   48
    1    H    VAL  70           H        VAL  70   3.747 -14.114 -15.304
    2    HA   VAL  70           HA       VAL  70   6.676 -14.585 -15.406
    3    HB   VAL  70           HB       VAL  70   6.857 -12.531 -13.979
    4   HG11  VAL  70          HG11      VAL  70   7.094 -12.576 -16.519
    5   HG13  VAL  70          HG12      VAL  70   6.698 -11.006 -15.822
    6   HG12  VAL  70          HG13      VAL  70   5.440 -11.969 -16.595
    7   HG22  VAL  70          HG21      VAL  70   4.971 -11.083 -13.649
    8   HG21  VAL  70          HG22      VAL  70   4.405 -12.700 -13.235
    9   HG23  VAL  70          HG23      VAL  70   3.982 -11.991 -14.793

  No H/Q in entry =           9
  In of MODEL   48
    1    H    SER  71           H        SER  71   7.664 -14.695 -13.216
    2    HA   SER  71           HA       SER  71   6.496 -16.686 -11.595
    3    HB2  SER  71           HB2      SER  71   8.930 -16.214 -11.664
    4    HB3  SER  71           HB3      SER  71   8.642 -14.677 -10.852
    5    HG   SER  71           HG       SER  71   8.222 -17.311  -9.897

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU  72           H        LEU  72   5.130 -16.586  -9.907
    2    HA   LEU  72           HA       LEU  72   3.556 -14.286  -9.474
    3    HB2  LEU  72           HB2      LEU  72   3.868 -16.833  -7.893
    4    HB3  LEU  72           HB3      LEU  72   2.686 -15.587  -7.500
    5    HG   LEU  72           HG       LEU  72   2.862 -16.890 -10.235
    6   HD12  LEU  72          HD11      LEU  72   0.912 -18.238  -9.509
    7   HD11  LEU  72          HD12      LEU  72   1.068 -17.572  -7.886
    8   HD13  LEU  72          HD13      LEU  72   2.345 -18.595  -8.542
    9   HD23  LEU  72          HD21      LEU  72   0.355 -16.103 -10.116
   10   HD22  LEU  72          HD22      LEU  72   1.591 -14.913 -10.491
   11   HD21  LEU  72          HD23      LEU  72   0.936 -15.018  -8.859

  No H/Q in entry =          11
  In of MODEL   48
    1    H    VAL  73           H        VAL  73   6.225 -15.689  -7.692
    2    HA   VAL  73           HA       VAL  73   6.146 -14.147  -5.367
    3    HB   VAL  73           HB       VAL  73   8.330 -14.939  -4.928
    4   HG11  VAL  73          HG11      VAL  73   6.522 -16.671  -5.110
    5   HG13  VAL  73          HG12      VAL  73   8.137 -17.308  -5.420
    6   HG12  VAL  73          HG13      VAL  73   7.045 -16.978  -6.764
    7   HG21  VAL  73          HG21      VAL  73   8.530 -15.005  -7.924
    8   HG23  VAL  73          HG22      VAL  73   9.546 -16.083  -6.968
    9   HG22  VAL  73          HG23      VAL  73   9.662 -14.337  -6.748

  No H/Q in entry =           9
  In of MODEL   48
    1    H    LEU  74           H        LEU  74   7.131 -13.256  -8.545
    2    HA   LEU  74           HA       LEU  74   9.056 -11.286  -8.057
    3    HB2  LEU  74           HB2      LEU  74   8.614 -12.046 -10.293
    4    HB3  LEU  74           HB3      LEU  74   6.940 -11.501 -10.197
    5    HG   LEU  74           HG       LEU  74   7.712  -9.163  -9.994
    6   HD11  LEU  74          HD11      LEU  74  10.410 -10.515 -10.074
    7   HD13  LEU  74          HD12      LEU  74   9.824  -9.309  -8.929
    8   HD12  LEU  74          HD13      LEU  74  10.215  -8.839 -10.583
    9   HD22  LEU  74          HD21      LEU  74   8.060  -8.937 -12.252
   10   HD21  LEU  74          HD22      LEU  74   7.496 -10.590 -12.188
   11   HD23  LEU  74          HD23      LEU  74   9.211 -10.270 -12.316

  No H/Q in entry =          11
  In of MODEL   48
    1    H    VAL  75           H        VAL  75   5.557 -10.938  -8.418
    2    HA   VAL  75           HA       VAL  75   5.433  -8.180  -7.843
    3    HB   VAL  75           HB       VAL  75   3.368 -10.349  -7.463
    4   HG11  VAL  75          HG11      VAL  75   3.136  -7.313  -7.276
    5   HG13  VAL  75          HG12      VAL  75   2.857  -8.464  -5.977
    6   HG12  VAL  75          HG13      VAL  75   1.766  -8.415  -7.353
    7   HG23  VAL  75          HG21      VAL  75   3.734  -8.183  -9.564
    8   HG22  VAL  75          HG22      VAL  75   2.467  -9.409  -9.548
    9   HG21  VAL  75          HG23      VAL  75   4.149  -9.882  -9.791

  No H/Q in entry =           9
  In of MODEL   48
    1    H    GLU  76           H        GLU  76   5.204 -11.051  -5.722
    2    HA   GLU  76           HA       GLU  76   4.716  -9.685  -3.307
    3    HB2  GLU  76           HB2      GLU  76   4.563 -12.152  -3.526
    4    HB3  GLU  76           HB3      GLU  76   6.299 -12.238  -3.770
    5    HG2  GLU  76           HG2      GLU  76   5.875 -12.813  -1.469
    6    HG3  GLU  76           HG3      GLU  76   6.600 -11.215  -1.466

  No H/Q in entry =           6
  In of MODEL   48
    1    H    ALA  77           H        ALA  77   7.787 -10.568  -4.860
    2    HA   ALA  77           HA       ALA  77   9.462  -9.500  -2.845
    3    HB3  ALA  77           HB1      ALA  77  10.006  -9.815  -5.807
    4    HB1  ALA  77           HB2      ALA  77  10.286 -11.042  -4.571
    5    HB2  ALA  77           HB3      ALA  77  11.225  -9.550  -4.561

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLN  78           H        GLN  78   8.063  -8.108  -5.768
    2    HA   GLN  78           HA       GLN  78   9.391  -5.615  -5.670
    3    HB2  GLN  78           HB2      GLN  78   8.080  -6.583  -7.615
    4    HB3  GLN  78           HB3      GLN  78   6.610  -6.140  -6.748
    5    HG2  GLN  78           HG2      GLN  78   7.280  -3.794  -6.743
    6    HG3  GLN  78           HG3      GLN  78   8.807  -4.203  -7.525
    7   HE21  GLN  78          HE21      GLN  78   7.736  -6.154  -9.404
    8   HE22  GLN  78          HE22      GLN  78   6.786  -5.303 -10.525

  No H/Q in entry =           8
  In of MODEL   48
    1    H    LEU  79           H        LEU  79   6.379  -6.776  -4.243
    2    HA   LEU  79           HA       LEU  79   5.360  -4.374  -3.246
    3    HB2  LEU  79           HB2      LEU  79   4.065  -6.437  -3.185
    4    HB3  LEU  79           HB3      LEU  79   5.214  -7.161  -2.064
    5    HG   LEU  79           HG       LEU  79   4.642  -5.518  -0.345
    6   HD13  LEU  79          HD11      LEU  79   4.160  -3.512  -1.405
    7   HD12  LEU  79          HD12      LEU  79   2.539  -4.051  -0.968
    8   HD11  LEU  79          HD13      LEU  79   3.126  -4.274  -2.614
    9   HD23  LEU  79          HD21      LEU  79   2.060  -6.033  -0.260
   10   HD22  LEU  79          HD22      LEU  79   3.211  -7.362  -0.143
   11   HD21  LEU  79          HD23      LEU  79   2.398  -7.038  -1.671

  No H/Q in entry =          11
  In of MODEL   48
    1    H    HIS  80           H        HIS  80   7.560  -6.683  -1.648
    2    HA   HIS  80           HA       HIS  80   7.827  -5.128   0.716
    3    HB2  HIS  80           HB2      HIS  80   9.190  -7.485  -0.470
    4    HB3  HIS  80           HB3      HIS  80  10.089  -6.575   0.746
    5    HD1  HIS  80           HD1      HIS  80   9.597  -7.206   3.090
    6    HD2  HIS  80           HD2      HIS  80   6.396  -8.095   0.572
    7    HE1  HIS  80           HE1      HIS  80   7.831  -8.319   4.538
    8    HE2  HIS  80           HE2      HIS  80   5.873  -8.865   3.011

  No H/Q in entry =           8
  In of MODEL   48
    1    H    LEU  81           H        LEU  81   9.844  -5.398  -2.190
    2    HA   LEU  81           HA       LEU  81  11.870  -3.636  -1.312
    3    HB2  LEU  81           HB2      LEU  81  10.964  -4.448  -4.075
    4    HB3  LEU  81           HB3      LEU  81  12.374  -3.428  -3.784
    5    HG   LEU  81           HG       LEU  81  12.001  -6.147  -2.500
    6   HD12  LEU  81          HD11      LEU  81  13.828  -6.765  -4.242
    7   HD11  LEU  81          HD12      LEU  81  13.253  -5.349  -5.121
    8   HD13  LEU  81          HD13      LEU  81  12.152  -6.682  -4.781
    9   HD23  LEU  81          HD21      LEU  81  14.627  -5.809  -2.479
   10   HD22  LEU  81          HD22      LEU  81  13.634  -5.052  -1.235
   11   HD21  LEU  81          HD23      LEU  81  14.209  -4.101  -2.604

  No H/Q in entry =          11
  In of MODEL   48
    1    H    MET  82           H        MET  82   8.948  -3.032  -3.260
    2    HA   MET  82           HA       MET  82   9.466  -0.304  -3.771
    3    HB2  MET  82           HB2      MET  82   6.920  -1.918  -3.647
    4    HB3  MET  82           HB3      MET  82   6.906  -0.196  -4.019
    5    HG2  MET  82           HG2      MET  82   8.529  -2.262  -5.540
    6    HG3  MET  82           HG3      MET  82   6.958  -1.655  -6.060
    7    HE3  MET  82           HE1      MET  82   7.382   1.799  -7.245
    8    HE2  MET  82           HE2      MET  82   7.004   1.577  -5.539
    9    HE1  MET  82           HE3      MET  82   6.352   0.457  -6.731

  No H/Q in entry =           9
  In of MODEL   48
    1    H    THR  83           H        THR  83   7.679  -1.906  -1.165
    2    HA   THR  83           HA       THR  83   6.805   0.440   0.149
    3    HB   THR  83           HB       THR  83   6.676  -1.127   2.173
    4    HG1  THR  83           HG1      THR  83   7.450  -3.072   1.954
    5   HG22  THR  83          HG21      THR  83   5.041  -2.712   0.706
    6   HG21  THR  83          HG22      THR  83   5.260  -1.386  -0.431
    7   HG23  THR  83          HG23      THR  83   4.612  -1.070   1.179

  No H/Q in entry =           7
  In of MODEL   48
    1    H    SER  84           H        SER  84   9.643  -1.633   0.688
    2    HA   SER  84           HA       SER  84  10.684  -0.185   2.874
    3    HB2  SER  84           HB2      SER  84  11.959  -2.026   0.860
    4    HB3  SER  84           HB3      SER  84  12.895  -1.260   2.142
    5    HG   SER  84           HG       SER  84  10.633  -2.966   2.401

  No H/Q in entry =           5
  In of MODEL   48
    1    H    MET  85           H        MET  85  11.447   0.068  -0.613
    2    HA   MET  85           HA       MET  85  13.429   2.049  -0.364
    3    HB2  MET  85           HB2      MET  85  13.045   0.753  -2.425
    4    HB3  MET  85           HB3      MET  85  11.517   1.602  -2.664
    5    HG2  MET  85           HG2      MET  85  12.730   3.756  -2.760
    6    HG3  MET  85           HG3      MET  85  14.254   2.899  -2.542
    7    HE3  MET  85           HE1      MET  85  15.051   1.118  -5.656
    8    HE2  MET  85           HE2      MET  85  14.097   0.254  -4.453
    9    HE1  MET  85           HE3      MET  85  15.312   1.413  -3.931

  No H/Q in entry =           9
  In of MODEL   48
    1    H    LEU  86           H        LEU  86   9.939   2.355  -0.885
    2    HA   LEU  86           HA       LEU  86   9.854   5.167  -1.079
    3    HB2  LEU  86           HB2      LEU  86   8.024   3.491  -1.654
    4    HB3  LEU  86           HB3      LEU  86   7.689   3.406   0.076
    5    HG   LEU  86           HG       LEU  86   7.510   5.965   0.012
    6   HD11  LEU  86          HD11      LEU  86   8.298   5.524  -2.686
    7   HD13  LEU  86          HD12      LEU  86   7.848   7.052  -1.933
    8   HD12  LEU  86          HD13      LEU  86   6.622   6.076  -2.738
    9   HD23  LEU  86          HD21      LEU  86   5.392   4.590  -1.652
   10   HD22  LEU  86          HD22      LEU  86   5.188   5.854  -0.441
   11   HD21  LEU  86          HD23      LEU  86   5.598   4.214   0.060

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ALA  87           H        ALA  87   9.395   2.997   1.675
    2    HA   ALA  87           HA       ALA  87   8.827   4.914   3.635
    3    HB1  ALA  87           HB1      ALA  87   9.654   2.100   3.562
    4    HB3  ALA  87           HB2      ALA  87   8.520   2.908   4.641
    5    HB2  ALA  87           HB3      ALA  87  10.247   2.953   4.990

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ARG  88           H        ARG  88  11.923   3.508   2.669
    2    HA   ARG  88           HA       ARG  88  13.517   4.905   4.501
    3    HB2  ARG  88           HB2      ARG  88  14.204   2.931   3.108
    4    HB3  ARG  88           HB3      ARG  88  14.353   4.019   1.731
    5    HG2  ARG  88           HG2      ARG  88  15.811   5.352   3.677
    6    HG3  ARG  88           HG3      ARG  88  16.142   3.666   4.063
    7    HD2  ARG  88           HD2      ARG  88  17.417   3.371   2.222
    8    HD3  ARG  88           HD3      ARG  88  16.277   4.230   1.182
    9    HE   ARG  88           HE       ARG  88  18.661   5.315   2.232
   10   HH21  ARG  88          HH11      ARG  88  18.991   7.536   2.029
   11   HH22  ARG  88          HH12      ARG  88  17.633   8.597   1.878
   12   HH11  ARG  88          HH21      ARG  88  15.317   6.043   1.941
   13   HH12  ARG  88          HH22      ARG  88  15.551   7.749   1.803

  No H/Q in entry =          13
  In of MODEL   48
    1    H    GLU  89           H        GLU  89  12.548   5.783   1.171
    2    HA   GLU  89           HA       GLU  89  14.078   8.153   1.010
    3    HB2  GLU  89           HB2      GLU  89  12.947   7.096  -0.937
    4    HB3  GLU  89           HB3      GLU  89  11.397   7.629  -0.286
    5    HG2  GLU  89           HG2      GLU  89  12.082   9.971  -0.456
    6    HG3  GLU  89           HG3      GLU  89  13.691   9.489  -0.986

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LEU  90           H        LEU  90  10.749   7.624   2.132
    2    HA   LEU  90           HA       LEU  90  10.213  10.356   2.695
    3    HB2  LEU  90           HB2      LEU  90   9.033   7.778   3.729
    4    HB3  LEU  90           HB3      LEU  90   8.390   9.371   4.143
    5    HG   LEU  90           HG       LEU  90   8.823   8.482   1.279
    6   HD12  LEU  90          HD11      LEU  90   6.291   8.136   1.335
    7   HD11  LEU  90          HD12      LEU  90   6.441   8.133   3.093
    8   HD13  LEU  90          HD13      LEU  90   7.271   6.906   2.135
    9   HD22  LEU  90          HD21      LEU  90   8.513  10.788   1.195
   10   HD21  LEU  90          HD22      LEU  90   7.522  10.819   2.652
   11   HD23  LEU  90          HD23      LEU  90   6.833  10.253   1.131

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  91           H        ILE  91  11.489   7.692   4.631
    2    HA   ILE  91           HA       ILE  91  11.613   9.067   7.094
    3    HB   ILE  91           HB       ILE  91  13.187   6.736   5.985
    4   HG12  ILE  91          HG12      ILE  91  11.163   6.898   8.238
    5   HG13  ILE  91          HG13      ILE  91  10.699   6.607   6.562
    6   HG22  ILE  91          HG21      ILE  91  13.650   6.536   8.627
    7   HG21  ILE  91          HG22      ILE  91  13.562   8.294   8.519
    8   HG23  ILE  91          HG23      ILE  91  14.750   7.411   7.561
    9   HD13  ILE  91          HD11      ILE  91  11.717   4.512   6.503
   10   HD12  ILE  91          HD12      ILE  91  11.118   4.572   8.161
   11   HD11  ILE  91          HD13      ILE  91  12.819   4.897   7.826

  No H/Q in entry =          11
  In of MODEL   48
    1    H    THR  92           H        THR  92  13.839   8.903   4.350
    2    HA   THR  92           HA       THR  92  15.990  10.317   5.509
    3    HB   THR  92           HB       THR  92  15.013  10.173   2.647
    4    HG1  THR  92           HG1      THR  92  15.858   8.284   3.061
    5   HG22  THR  92          HG21      THR  92  17.579  10.881   2.357
    6   HG21  THR  92          HG22      THR  92  17.261  11.706   3.883
    7   HG23  THR  92          HG23      THR  92  16.292  12.081   2.458

  No H/Q in entry =           7
  In of MODEL   48
    1    H    GLU  93           H        GLU  93  13.100  11.442   3.768
    2    HA   GLU  93           HA       GLU  93  13.674  14.208   3.873
    3    HB2  GLU  93           HB2      GLU  93  10.980  12.815   3.885
    4    HB3  GLU  93           HB3      GLU  93  11.257  14.516   3.507
    5    HG2  GLU  93           HG2      GLU  93  12.615  12.277   1.992
    6    HG3  GLU  93           HG3      GLU  93  11.065  12.947   1.498

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LEU  94           H        LEU  94  11.941  12.048   6.088
    2    HA   LEU  94           HA       LEU  94  11.112  13.995   7.954
    3    HB2  LEU  94           HB2      LEU  94  11.709  11.046   8.241
    4    HB3  LEU  94           HB3      LEU  94  11.127  12.023   9.586
    5    HG   LEU  94           HG       LEU  94   9.649  12.053   6.953
    6   HD11  LEU  94          HD11      LEU  94   9.743   9.841   8.967
    7   HD13  LEU  94          HD12      LEU  94   9.446   9.770   7.231
    8   HD12  LEU  94          HD13      LEU  94   8.161  10.282   8.324
    9   HD23  LEU  94          HD21      LEU  94   7.723  12.445   8.547
   10   HD22  LEU  94          HD22      LEU  94   8.952  13.709   8.582
   11   HD21  LEU  94          HD23      LEU  94   8.895  12.496   9.861

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  95           H        ILE  95  14.101  12.087   7.733
    2    HA   ILE  95           HA       ILE  95  15.255  13.027  10.146
    3    HB   ILE  95           HB       ILE  95  16.509  11.957   7.605
    4   HG12  ILE  95          HG12      ILE  95  16.214  10.765  10.377
    5   HG13  ILE  95          HG13      ILE  95  15.053  10.493   9.080
    6   HG21  ILE  95          HG21      ILE  95  17.751  12.783  10.248
    7   HG23  ILE  95          HG22      ILE  95  18.214  13.308   8.627
    8   HG22  ILE  95          HG23      ILE  95  18.531  11.653   9.143
    9   HD13  ILE  95          HD11      ILE  95  16.546   9.220   7.826
   10   HD12  ILE  95          HD12      ILE  95  17.017   8.781   9.465
   11   HD11  ILE  95          HD13      ILE  95  17.964   9.964   8.563

  No H/Q in entry =          11
  In of MODEL   48
    1    H    GLU  96           H        GLU  96  15.410  14.248   6.807
    2    HA   GLU  96           HA       GLU  96  17.240  16.342   7.280
    3    HB2  GLU  96           HB2      GLU  96  16.586  15.666   5.022
    4    HB3  GLU  96           HB3      GLU  96  14.938  16.212   5.316
    5    HG2  GLU  96           HG2      GLU  96  15.490  18.343   4.767
    6    HG3  GLU  96           HG3      GLU  96  16.786  18.358   5.952

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LEU  97           H        LEU  97  13.729  16.131   7.702
    2    HA   LEU  97           HA       LEU  97  13.291  18.865   8.331
    3    HB2  LEU  97           HB2      LEU  97  11.790  16.330   8.952
    4    HB3  LEU  97           HB3      LEU  97  11.264  17.876   9.616
    5    HG   LEU  97           HG       LEU  97  11.757  17.452   6.654
    6   HD12  LEU  97          HD11      LEU  97   9.235  17.306   6.530
    7   HD11  LEU  97          HD12      LEU  97   9.226  17.113   8.281
    8   HD13  LEU  97          HD13      LEU  97  10.018  15.907   7.266
    9   HD23  LEU  97          HD21      LEU  97  10.005  19.404   6.674
   10   HD22  LEU  97          HD22      LEU  97  11.683  19.777   7.069
   11   HD21  LEU  97          HD23      LEU  97  10.492  19.603   8.357

  No H/Q in entry =          11
  In of MODEL   48
    1    H    HIS  98           H        HIS  98  14.128  16.052  10.340
    2    HA   HIS  98           HA       HIS  98  13.955  17.322  12.851
    3    HB2  HIS  98           HB2      HIS  98  15.724  15.073  11.862
    4    HB3  HIS  98           HB3      HIS  98  15.714  15.618  13.541
    5    HD1  HIS  98           HD1      HIS  98  13.533  13.963  10.950
    6    HD2  HIS  98           HD2      HIS  98  13.409  14.898  15.011
    7    HE1  HIS  98           HE1      HIS  98  11.514  12.758  11.903
    8    HE2  HIS  98           HE2      HIS  98  11.419  13.318  14.372

  No H/Q in entry =           8
  In of MODEL   48
    1    H    GLU  99           H        GLU  99  16.515  17.215  10.423
    2    HA   GLU  99           HA       GLU  99  18.488  18.567  11.951
    3    HB2  GLU  99           HB2      GLU  99  18.981  17.275   9.888
    4    HB3  GLU  99           HB3      GLU  99  18.165  18.520   8.941
    5    HG2  GLU  99           HG2      GLU  99  19.759  20.205   9.729
    6    HG3  GLU  99           HG3      GLU  99  20.544  19.012  10.758

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LYS 100           H        LYS 100  15.961  19.703   9.724
    2    HA   LYS 100           HA       LYS 100  16.740  22.446   9.860
    3    HB2  LYS 100           HB2      LYS 100  14.117  21.136   9.104
    4    HB3  LYS 100           HB3      LYS 100  14.405  22.876   9.007
    5    HG2  LYS 100           HG2      LYS 100  16.384  22.436   7.547
    6    HG3  LYS 100           HG3      LYS 100  15.982  20.716   7.570
    7    HD2  LYS 100           HD2      LYS 100  13.786  21.207   6.563
    8    HD3  LYS 100           HD3      LYS 100  14.171  22.928   6.547
    9    HE2  LYS 100           HE2      LYS 100  16.137  22.455   5.093
   10    HE3  LYS 100           HE3      LYS 100  15.683  20.747   5.066
   11    HZ1  LYS 100           HZ1      LYS 100  13.845  22.925   4.218
   12    HZ3  LYS 100           HZ2      LYS 100  13.673  21.253   3.962
   13    HZ2  LYS 100           HZ3      LYS 100  14.880  22.120   3.140

  No H/Q in entry =          13
  In of MODEL   48
    1    H    LEU 101           H        LEU 101  14.651  20.394  11.828
    2    HA   LEU 101           HA       LEU 101  13.468  22.460  13.395
    3    HB2  LEU 101           HB2      LEU 101  13.928  19.515  13.792
    4    HB3  LEU 101           HB3      LEU 101  13.383  20.497  15.148
    5    HG   LEU 101           HG       LEU 101  11.970  20.566  12.475
    6   HD12  LEU 101          HD11      LEU 101  10.319  18.996  13.746
    7   HD11  LEU 101          HD12      LEU 101  11.713  18.596  14.746
    8   HD13  LEU 101          HD13      LEU 101  11.753  18.283  13.010
    9   HD21  LEU 101          HD21      LEU 101  11.302  21.365  15.322
   10   HD23  LEU 101          HD22      LEU 101  10.045  21.127  14.110
   11   HD22  LEU 101          HD23      LEU 101  11.272  22.369  13.870

  No H/Q in entry =          11
  In of MODEL   48
    1    H    LYS 102           H        LYS 102  16.620  21.871  12.968
    2    HA   LYS 102           HA       LYS 102  18.458  22.758  14.042
    3    HB2  LYS 102           HB2      LYS 102  16.632  24.265  15.165
    4    HB3  LYS 102           HB3      LYS 102  16.843  23.209  16.547
    5    HG2  LYS 102           HG2      LYS 102  18.726  25.228  15.374
    6    HG3  LYS 102           HG3      LYS 102  18.342  24.918  17.053
    7    HD2  LYS 102           HD2      LYS 102  20.025  23.010  15.379
    8    HD3  LYS 102           HD3      LYS 102  20.704  24.340  16.308
    9    HE2  LYS 102           HE2      LYS 102  20.319  21.792  17.285
   10    HE3  LYS 102           HE3      LYS 102  20.526  23.239  18.272
   11    HZ2  LYS 102           HZ1      LYS 102  18.565  21.945  18.890
   12    HZ1  LYS 102           HZ2      LYS 102  17.923  22.165  17.339
   13    HZ3  LYS 102           HZ3      LYS 102  18.142  23.500  18.360

  No H/Q in entry =          13
  In of MODEL   48
    1    H    ALA 103           H        ALA 103  16.392  21.149  16.465
    2    HA   ALA 103           HA       ALA 103  18.122  19.955  18.128
    3    HB2  ALA 103           HB1      ALA 103  16.551  17.937  18.127
    4    HB1  ALA 103           HB2      ALA 103  15.653  18.780  16.864
    5    HB3  ALA 103           HB3      ALA 103  15.823  19.508  18.460

  No H/Q in entry =           5
  In of MODEL   48
    1    H1   ALA   1           H3       ALA   1  -1.547  -7.172 -21.436
    2    H2   ALA   1           H2       ALA   1  -2.334  -8.610 -20.979
    3    H3   ALA   1           H1       ALA   1  -0.725  -8.652 -21.530
    4    HA   ALA   1           HA       ALA   1  -1.551  -9.134 -23.527
    5    HB1  ALA   1           HB1      ALA   1  -3.685  -9.863 -23.056
    6    HB2  ALA   1           HB2      ALA   1  -4.130  -8.358 -23.860
    7    HB3  ALA   1           HB3      ALA   1  -4.073  -8.432 -22.100

  No H/Q in entry =           7
  In of MODEL   48
    1    H    GLU   2           H        GLU   2  -2.383  -7.956 -25.522
    2    HA   GLU   2           HA       GLU   2  -0.994  -5.937 -26.404
    3    HB2  GLU   2           HB2      GLU   2  -4.000  -6.023 -26.729
    4    HB3  GLU   2           HB3      GLU   2  -2.881  -5.157 -27.779
    5    HG2  GLU   2           HG2      GLU   2  -2.364  -7.048 -28.925
    6    HG3  GLU   2           HG3      GLU   2  -2.065  -7.947 -27.444

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLU   3           H        GLU   3  -4.164  -4.695 -25.516
    2    HA   GLU   3           HA       GLU   3  -3.133  -2.131 -24.894
    3    HB2  GLU   3           HB2      GLU   3  -5.815  -3.460 -24.564
    4    HB3  GLU   3           HB3      GLU   3  -5.528  -1.841 -23.923
    5    HG2  GLU   3           HG2      GLU   3  -5.171  -0.919 -26.051
    6    HG3  GLU   3           HG3      GLU   3  -4.766  -2.475 -26.769

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LEU   4           H        LEU   4  -4.716  -4.491 -22.710
    2    HA   LEU   4           HA       LEU   4  -4.364  -3.252 -20.323
    3    HB2  LEU   4           HB2      LEU   4  -3.803  -6.192 -20.780
    4    HB3  LEU   4           HB3      LEU   4  -4.217  -5.443 -19.240
    5    HG   LEU   4           HG       LEU   4  -5.983  -5.535 -21.708
    6   HD13  LEU   4          HD11      LEU   4  -7.169  -7.256 -20.707
    7   HD12  LEU   4          HD12      LEU   4  -6.691  -6.788 -19.077
    8   HD11  LEU   4          HD13      LEU   4  -5.548  -7.628 -20.122
    9   HD23  LEU   4          HD21      LEU   4  -7.677  -4.727 -19.848
   10   HD22  LEU   4          HD22      LEU   4  -6.644  -3.553 -20.660
   11   HD21  LEU   4          HD23      LEU   4  -6.218  -4.135 -19.051

  No H/Q in entry =          11
  In of MODEL   48
    1    H    GLU   5           H        GLU   5  -1.851  -5.087 -22.041
    2    HA   GLU   5           HA       GLU   5   0.125  -4.785 -20.000
    3    HB2  GLU   5           HB2      GLU   5   0.197  -6.559 -21.754
    4    HB3  GLU   5           HB3      GLU   5   0.524  -5.312 -22.958
    5    HG2  GLU   5           HG2      GLU   5   2.580  -4.682 -21.789
    6    HG3  GLU   5           HG3      GLU   5   2.248  -5.863 -20.524

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLU   6           H        GLU   6  -0.512  -3.086 -23.052
    2    HA   GLU   6           HA       GLU   6   1.647  -1.241 -22.785
    3    HB2  GLU   6           HB2      GLU   6  -0.913  -1.152 -24.397
    4    HB3  GLU   6           HB3      GLU   6   0.359   0.065 -24.513
    5    HG2  GLU   6           HG2      GLU   6   0.769  -2.902 -24.979
    6    HG3  GLU   6           HG3      GLU   6   0.559  -1.710 -26.259

  No H/Q in entry =           6
  In of MODEL   48
    1    H    VAL   7           H        VAL   7  -1.694  -1.327 -21.749
    2    HA   VAL   7           HA       VAL   7  -1.933   1.387 -20.922
    3    HB   VAL   7           HB       VAL   7  -3.383  -1.136 -20.081
    4   HG11  VAL   7          HG11      VAL   7  -3.776   1.753 -19.278
    5   HG13  VAL   7          HG12      VAL   7  -3.671   0.333 -18.238
    6   HG12  VAL   7          HG13      VAL   7  -5.103   0.591 -19.234
    7   HG21  VAL   7          HG21      VAL   7  -3.540  -0.069 -22.473
    8   HG23  VAL   7          HG22      VAL   7  -4.494   1.177 -21.668
    9   HG22  VAL   7          HG23      VAL   7  -5.030  -0.503 -21.637

  No H/Q in entry =           9
  In of MODEL   48
    1    H    VAL   8           H        VAL   8  -0.932  -1.587 -19.266
    2    HA   VAL   8           HA       VAL   8  -0.627  -0.496 -16.674
    3    HB   VAL   8           HB       VAL   8   0.794  -2.810 -18.018
    4   HG12  VAL   8          HG11      VAL   8   1.203  -3.460 -15.558
    5   HG11  VAL   8          HG12      VAL   8   0.837  -1.777 -15.177
    6   HG13  VAL   8          HG13      VAL   8   2.205  -2.169 -16.218
    7   HG22  VAL   8          HG21      VAL   8  -0.980  -4.125 -17.348
    8   HG21  VAL   8          HG22      VAL   8  -1.858  -2.599 -17.321
    9   HG23  VAL   8          HG23      VAL   8  -1.180  -3.249 -15.832

  No H/Q in entry =           9
  In of MODEL   48
    1    H    MET   9           H        MET   9   1.631  -0.794 -19.414
    2    HA   MET   9           HA       MET   9   3.908   0.265 -18.151
    3    HB2  MET   9           HB2      MET   9   2.966   0.280 -21.017
    4    HB3  MET   9           HB3      MET   9   4.477   1.051 -20.539
    5    HG2  MET   9           HG2      MET   9   5.238  -1.090 -19.543
    6    HG3  MET   9           HG3      MET   9   3.743  -1.856 -20.083
    7    HE2  MET   9           HE1      MET   9   7.508  -1.157 -21.322
    8    HE1  MET   9           HE2      MET   9   6.593   0.283 -20.886
    9    HE3  MET   9           HE3      MET   9   7.051   0.014 -22.565

  No H/Q in entry =           9
  In of MODEL   48
    1    H    GLY  10           H        GLY  10   1.219   1.848 -19.841
    2    HA3  GLY  10           HA2      GLY  10   2.169   4.507 -19.603
    3    HA2  GLY  10           HA3      GLY  10   0.482   4.038 -19.810

  No H/Q in entry =           3
  In of MODEL   48
    1    H    LEU  11           H        LEU  11   0.085   2.516 -17.520
    2    HA   LEU  11           HA       LEU  11  -0.459   4.497 -15.568
    3    HB2  LEU  11           HB2      LEU  11  -0.377   1.483 -15.401
    4    HB3  LEU  11           HB3      LEU  11  -0.894   2.508 -14.064
    5    HG   LEU  11           HG       LEU  11  -2.127   2.606 -16.830
    6   HD13  LEU  11          HD11      LEU  11  -2.703   0.463 -16.069
    7   HD12  LEU  11          HD12      LEU  11  -4.059   1.450 -15.529
    8   HD11  LEU  11          HD13      LEU  11  -2.803   0.980 -14.385
    9   HD22  LEU  11          HD21      LEU  11  -2.730   4.623 -15.831
   10   HD21  LEU  11          HD22      LEU  11  -2.655   3.962 -14.198
   11   HD23  LEU  11          HD23      LEU  11  -4.027   3.587 -15.242

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  12           H        ILE  12   2.096   2.042 -15.797
    2    HA   ILE  12           HA       ILE  12   3.294   2.593 -13.293
    3    HB   ILE  12           HB       ILE  12   4.555   1.549 -15.850
    4   HG12  ILE  12          HG12      ILE  12   2.550   0.311 -14.705
    5   HG13  ILE  12          HG13      ILE  12   3.958  -0.619 -15.176
    6   HG23  ILE  12          HG21      ILE  12   6.307   2.297 -14.361
    7   HG22  ILE  12          HG22      ILE  12   6.234   0.539 -14.251
    8   HG21  ILE  12          HG23      ILE  12   5.529   1.531 -12.977
    9   HD13  ILE  12          HD11      ILE  12   4.770  -0.596 -12.890
   10   HD12  ILE  12          HD12      ILE  12   3.096  -1.149 -12.888
   11   HD11  ILE  12          HD13      ILE  12   3.479   0.489 -12.408

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  13           H        ILE  13   3.896   3.849 -16.553
    2    HA   ILE  13           HA       ILE  13   6.024   5.581 -15.830
    3    HB   ILE  13           HB       ILE  13   3.998   5.638 -18.080
    4   HG12  ILE  13          HG12      ILE  13   5.854   3.819 -17.792
    5   HG13  ILE  13          HG13      ILE  13   5.608   4.554 -19.372
    6   HG22  ILE  13          HG21      ILE  13   5.768   7.221 -19.145
    7   HG21  ILE  13          HG22      ILE  13   6.287   7.522 -17.490
    8   HG23  ILE  13          HG23      ILE  13   4.637   7.907 -17.976
    9   HD12  ILE  13          HD11      ILE  13   8.046   4.402 -18.649
   10   HD11  ILE  13          HD12      ILE  13   7.655   5.551 -17.375
   11   HD13  ILE  13          HD13      ILE  13   7.497   6.026 -19.062

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ASN  14           H        ASN  14   2.516   6.059 -16.106
    2    HA   ASN  14           HA       ASN  14   2.460   8.807 -15.478
    3    HB2  ASN  14           HB2      ASN  14   0.576   7.154 -16.306
    4    HB3  ASN  14           HB3      ASN  14   0.252   6.980 -14.586
    5   HD21  ASN  14          HD21      ASN  14  -1.770   8.122 -16.026
    6   HD22  ASN  14          HD22      ASN  14  -1.841   9.796 -15.764

  No H/Q in entry =           6
  In of MODEL   48
    1    H    SER  15           H        SER  15   2.174   5.936 -13.392
    2    HA   SER  15           HA       SER  15   1.857   7.313 -10.949
    3    HB2  SER  15           HB2      SER  15   2.405   5.234  -9.893
    4    HB3  SER  15           HB3      SER  15   1.594   4.802 -11.394
    5    HG   SER  15           HG       SER  15   4.043   4.167 -10.594

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLY  16           H        GLY  16   4.741   6.223 -12.699
    2    HA3  GLY  16           HA2      GLY  16   6.659   6.996 -10.768
    3    HA2  GLY  16           HA3      GLY  16   6.966   6.789 -12.490

  No H/Q in entry =           3
  In of MODEL   48
    1    H    GLN  17           H        GLN  17   5.269   8.735 -13.563
    2    HA   GLN  17           HA       GLN  17   6.833  11.085 -13.260
    3    HB2  GLN  17           HB2      GLN  17   4.090  10.636 -14.465
    4    HB3  GLN  17           HB3      GLN  17   4.936  12.181 -14.538
    5    HG2  GLN  17           HG2      GLN  17   6.805  11.146 -15.720
    6    HG3  GLN  17           HG3      GLN  17   6.046   9.561 -15.580
    7   HE21  GLN  17          HE21      GLN  17   6.429  12.131 -17.708
    8   HE22  GLN  17          HE22      GLN  17   5.069  11.861 -18.687

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ALA  18           H        ALA  18   3.736  10.055 -11.913
    2    HA   ALA  18           HA       ALA  18   2.996  12.444 -10.656
    3    HB1  ALA  18           HB1      ALA  18   1.881   9.981 -10.872
    4    HB2  ALA  18           HB2      ALA  18   1.323  11.202  -9.730
    5    HB3  ALA  18           HB3      ALA  18   2.420   9.927  -9.194

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ARG  19           H        ARG  19   4.883   9.696  -9.364
    2    HA   ARG  19           HA       ARG  19   5.404  10.866  -6.846
    3    HB2  ARG  19           HB2      ARG  19   5.833   8.464  -7.364
    4    HB3  ARG  19           HB3      ARG  19   7.188   8.954  -8.384
    5    HG2  ARG  19           HG2      ARG  19   8.298  10.007  -6.463
    6    HG3  ARG  19           HG3      ARG  19   6.923   9.614  -5.433
    7    HD2  ARG  19           HD2      ARG  19   8.694   7.991  -5.066
    8    HD3  ARG  19           HD3      ARG  19   7.326   7.198  -5.852
    9    HE   ARG  19           HE       ARG  19   9.029   8.020  -7.898
   10   HH21  ARG  19          HH11      ARG  19  10.600   6.621  -8.741
   11   HH22  ARG  19          HH12      ARG  19  11.152   5.280  -7.800
   12   HH11  ARG  19          HH21      ARG  19   9.108   6.000  -5.113
   13   HH12  ARG  19          HH22      ARG  19  10.304   4.928  -5.745

  No H/Q in entry =          13
  In of MODEL   48
    1    H    SER  20           H        SER  20   7.227  10.896  -9.891
    2    HA   SER  20           HA       SER  20   9.461  12.329  -9.068
    3    HB2  SER  20           HB2      SER  20   9.242  11.328 -11.314
    4    HB3  SER  20           HB3      SER  20   8.035  12.538 -11.729
    5    HG   SER  20           HG       SER  20  10.278  13.652 -10.689

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU  21           H        LEU  21   6.356  13.574 -10.275
    2    HA   LEU  21           HA       LEU  21   7.009  16.324 -10.059
    3    HB2  LEU  21           HB2      LEU  21   4.351  14.880  -9.983
    4    HB3  LEU  21           HB3      LEU  21   4.502  16.636  -9.985
    5    HG   LEU  21           HG       LEU  21   5.724  14.858 -12.115
    6   HD12  LEU  21          HD11      LEU  21   3.786  15.751 -13.514
    7   HD11  LEU  21          HD12      LEU  21   3.045  16.261 -11.997
    8   HD13  LEU  21          HD13      LEU  21   3.358  14.551 -12.295
    9   HD22  LEU  21          HD21      LEU  21   6.838  16.900 -12.307
   10   HD21  LEU  21          HD22      LEU  21   5.478  17.834 -11.693
   11   HD23  LEU  21          HD23      LEU  21   5.444  17.216 -13.337

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ALA  22           H        ALA  22   5.508  14.032  -7.806
    2    HA   ALA  22           HA       ALA  22   4.888  15.843  -5.746
    3    HB3  ALA  22           HB1      ALA  22   4.145  13.445  -5.902
    4    HB2  ALA  22           HB2      ALA  22   4.727  13.926  -4.308
    5    HB1  ALA  22           HB3      ALA  22   5.759  12.972  -5.374

  No H/Q in entry =           5
  In of MODEL   48
    1    H    TYR  23           H        TYR  23   7.838  13.837  -6.172
    2    HA   TYR  23           HA       TYR  23   9.209  14.874  -3.921
    3    HB2  TYR  23           HB2      TYR  23  10.013  12.868  -5.071
    4    HB3  TYR  23           HB3      TYR  23  10.322  13.805  -6.533
    5    HD1  TYR  23           HD1      TYR  23  11.293  13.454  -2.948
    6    HD2  TYR  23           HD2      TYR  23  12.337  15.021  -6.809
    7    HE1  TYR  23           HE1      TYR  23  13.545  14.052  -2.098
    8    HE2  TYR  23           HE2      TYR  23  14.589  15.619  -5.958
    9    HH   TYR  23           HH       TYR  23  15.434  15.187  -2.540

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ALA  24           H        ALA  24   9.024  15.968  -7.291
    2    HA   ALA  24           HA       ALA  24  10.903  18.069  -7.049
    3    HB2  ALA  24           HB1      ALA  24  10.464  18.120  -9.259
    4    HB3  ALA  24           HB2      ALA  24   8.902  18.858  -8.905
    5    HB1  ALA  24           HB3      ALA  24   9.041  17.106  -9.028

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA  25           H        ALA  25   7.424  17.859  -6.433
    2    HA   ALA  25           HA       ALA  25   6.921  20.574  -5.875
    3    HB1  ALA  25           HB1      ALA  25   5.277  18.562  -6.072
    4    HB2  ALA  25           HB2      ALA  25   4.896  19.851  -4.928
    5    HB3  ALA  25           HB3      ALA  25   5.597  18.338  -4.351

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU  26           H        LEU  26   8.008  17.911  -3.813
    2    HA   LEU  26           HA       LEU  26   8.097  19.352  -1.381
    3    HB2  LEU  26           HB2      LEU  26   8.213  16.936  -1.367
    4    HB3  LEU  26           HB3      LEU  26   9.684  16.953  -2.335
    5    HG   LEU  26           HG       LEU  26  10.886  18.089  -0.497
    6   HD12  LEU  26          HD11      LEU  26   9.656  18.094   1.761
    7   HD11  LEU  26          HD12      LEU  26   8.171  17.939   0.824
    8   HD13  LEU  26          HD13      LEU  26   9.204  19.354   0.612
    9   HD21  LEU  26          HD21      LEU  26   9.373  15.610   0.382
   10   HD23  LEU  26          HD22      LEU  26  10.882  16.189   1.080
   11   HD22  LEU  26          HD23      LEU  26  10.845  15.623  -0.588

  No H/Q in entry =          11
  In of MODEL   48
    1    H    LYS  27           H        LYS  27  10.523  18.792  -3.900
    2    HA   LYS  27           HA       LYS  27  12.693  20.057  -2.673
    3    HB2  LYS  27           HB2      LYS  27  12.811  18.703  -4.757
    4    HB3  LYS  27           HB3      LYS  27  12.035  20.025  -5.629
    5    HG2  LYS  27           HG2      LYS  27  13.885  21.530  -5.054
    6    HG3  LYS  27           HG3      LYS  27  14.656  20.248  -4.111
    7    HD2  LYS  27           HD2      LYS  27  14.816  18.854  -6.160
    8    HD3  LYS  27           HD3      LYS  27  14.090  20.162  -7.094
    9    HE2  LYS  27           HE2      LYS  27  15.963  21.648  -6.484
   10    HE3  LYS  27           HE3      LYS  27  16.692  20.344  -5.540
   11    HZ3  LYS  27           HZ1      LYS  27  17.685  20.445  -7.725
   12    HZ2  LYS  27           HZ2      LYS  27  16.161  20.310  -8.468
   13    HZ1  LYS  27           HZ3      LYS  27  16.795  19.009  -7.578

  No H/Q in entry =          13
  In of MODEL   48
    1    H    GLN  28           H        GLN  28  10.061  21.407  -4.631
    2    HA   GLN  28           HA       GLN  28  10.995  24.068  -4.792
    3    HB2  GLN  28           HB2      GLN  28   8.173  22.970  -4.682
    4    HB3  GLN  28           HB3      GLN  28   8.569  24.646  -5.061
    5    HG2  GLN  28           HG2      GLN  28   9.588  22.238  -6.597
    6    HG3  GLN  28           HG3      GLN  28   8.249  23.263  -7.107
    7   HE21  GLN  28          HE21      GLN  28  11.379  22.784  -7.851
    8   HE22  GLN  28          HE22      GLN  28  11.862  24.371  -8.212

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ALA  29           H        ALA  29   9.076  22.366  -2.353
    2    HA   ALA  29           HA       ALA  29   8.502  24.559  -0.680
    3    HB2  ALA  29           HB1      ALA  29   7.786  22.989   0.893
    4    HB1  ALA  29           HB2      ALA  29   9.020  21.815   0.434
    5    HB3  ALA  29           HB3      ALA  29   7.633  22.091  -0.618

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LYS  30           H        LYS  30  11.255  22.318  -0.737
    2    HA   LYS  30           HA       LYS  30  12.560  23.294   1.565
    3    HB2  LYS  30           HB2      LYS  30  13.673  22.009  -0.939
    4    HB3  LYS  30           HB3      LYS  30  14.649  22.384   0.483
    5    HG2  LYS  30           HG2      LYS  30  13.108  20.990   1.865
    6    HG3  LYS  30           HG3      LYS  30  12.229  20.554   0.395
    7    HD2  LYS  30           HD2      LYS  30  14.285  19.585  -0.559
    8    HD3  LYS  30           HD3      LYS  30  15.183  20.035   0.893
    9    HE2  LYS  30           HE2      LYS  30  13.690  18.594   2.250
   10    HE3  LYS  30           HE3      LYS  30  12.823  18.124   0.783
   11    HZ2  LYS  30           HZ1      LYS  30  14.629  16.566   1.552
   12    HZ1  LYS  30           HZ2      LYS  30  15.755  17.763   1.098
   13    HZ3  LYS  30           HZ3      LYS  30  14.728  17.065  -0.066

  No H/Q in entry =          13
  In of MODEL   48
    1    H    GLN  31           H        GLN  31  12.444  24.485  -1.737
    2    HA   GLN  31           HA       GLN  31  14.577  26.401  -1.319
    3    HB2  GLN  31           HB2      GLN  31  12.537  26.419  -3.547
    4    HB3  GLN  31           HB3      GLN  31  14.150  27.131  -3.548
    5    HG2  GLN  31           HG2      GLN  31  14.638  24.442  -2.962
    6    HG3  GLN  31           HG3      GLN  31  13.337  24.371  -4.142
    7   HE21  GLN  31          HE21      GLN  31  16.189  23.604  -4.539
    8   HE22  GLN  31          HE22      GLN  31  16.753  24.579  -5.808

  No H/Q in entry =           8
  In of MODEL   48
    1    H    GLY  32           H        GLY  32  11.503  26.192  -0.178
    2    HA3  GLY  32           HA2      GLY  32  10.329  27.754   1.088
    3    HA2  GLY  32           HA3      GLY  32  11.443  28.998   0.535

  No H/Q in entry =           3
  In of MODEL   48
    1    H    ASP  33           H        ASP  33  10.101  27.071  -1.952
    2    HA   ASP  33           HA       ASP  33   8.416  29.324  -2.819
    3    HB2  ASP  33           HB2      ASP  33   9.535  26.911  -4.250
    4    HB3  ASP  33           HB3      ASP  33   8.374  28.012  -4.987

  No H/Q in entry =           4
  In of MODEL   48
    1    H    PHE  34           H        PHE  34   6.730  28.837  -1.256
    2    HA   PHE  34           HA       PHE  34   5.375  26.352  -1.153
    3    HB2  PHE  34           HB2      PHE  34   4.385  29.132  -0.485
    4    HB3  PHE  34           HB3      PHE  34   3.550  27.634  -0.070
    5    HD1  PHE  34           HD1      PHE  34   5.774  30.060   1.139
    6    HD2  PHE  34           HD2      PHE  34   5.137  25.812   1.100
    7    HE1  PHE  34           HE1      PHE  34   7.164  29.831   3.179
    8    HE2  PHE  34           HE2      PHE  34   6.529  25.587   3.138
    9    HZ   PHE  34           HZ       PHE  34   7.537  27.597   4.177

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ALA  35           H        ALA  35   4.919  29.203  -3.175
    2    HA   ALA  35           HA       ALA  35   2.375  28.560  -4.202
    3    HB3  ALA  35           HB1      ALA  35   3.416  29.955  -6.243
    4    HB2  ALA  35           HB2      ALA  35   4.628  30.333  -5.019
    5    HB1  ALA  35           HB3      ALA  35   2.933  30.726  -4.732

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA  36           H        ALA  36   5.613  27.914  -5.549
    2    HA   ALA  36           HA       ALA  36   4.642  26.467  -7.789
    3    HB3  ALA  36           HB1      ALA  36   6.800  26.611  -8.402
    4    HB2  ALA  36           HB2      ALA  36   7.290  25.592  -7.047
    5    HB1  ALA  36           HB3      ALA  36   7.166  27.339  -6.838

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA  37           H        ALA  37   5.603  25.494  -4.529
    2    HA   ALA  37           HA       ALA  37   5.573  22.704  -4.947
    3    HB2  ALA  37           HB1      ALA  37   5.290  24.501  -2.576
    4    HB1  ALA  37           HB2      ALA  37   6.437  23.194  -2.862
    5    HB3  ALA  37           HB3      ALA  37   4.779  22.825  -2.392

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LYS  38           H        LYS  38   3.016  24.890  -3.791
    2    HA   LYS  38           HA       LYS  38   0.935  23.057  -3.565
    3    HB2  LYS  38           HB2      LYS  38   1.258  25.817  -3.324
    4    HB3  LYS  38           HB3      LYS  38   0.062  25.653  -4.604
    5    HG2  LYS  38           HG2      LYS  38  -1.376  24.320  -3.159
    6    HG3  LYS  38           HG3      LYS  38  -0.133  24.277  -1.900
    7    HD2  LYS  38           HD2      LYS  38  -0.344  26.614  -1.462
    8    HD3  LYS  38           HD3      LYS  38  -1.256  26.888  -2.947
    9    HE2  LYS  38           HE2      LYS  38  -2.763  26.914  -1.010
   10    HE3  LYS  38           HE3      LYS  38  -3.121  25.530  -2.047
   11    HZ3  LYS  38           HZ1      LYS  38  -2.383  24.072  -0.508
   12    HZ2  LYS  38           HZ2      LYS  38  -2.748  25.330   0.577
   13    HZ1  LYS  38           HZ3      LYS  38  -1.150  25.093   0.055

  No H/Q in entry =          13
  In of MODEL   48
    1    H    ALA  39           H        ALA  39   1.900  24.958  -6.420
    2    HA   ALA  39           HA       ALA  39  -0.165  24.064  -8.122
    3    HB2  ALA  39           HB1      ALA  39   2.567  24.736  -9.174
    4    HB1  ALA  39           HB2      ALA  39   1.586  25.990  -8.415
    5    HB3  ALA  39           HB3      ALA  39   0.984  25.141  -9.839

  No H/Q in entry =           5
  In of MODEL   48
    1    H    MET  40           H        MET  40   3.086  22.800  -7.533
    2    HA   MET  40           HA       MET  40   3.012  20.772  -9.517
    3    HB2  MET  40           HB2      MET  40   4.617  21.022  -6.967
    4    HB3  MET  40           HB3      MET  40   4.883  19.764  -8.176
    5    HG2  MET  40           HG2      MET  40   4.911  22.718  -8.853
    6    HG3  MET  40           HG3      MET  40   6.365  21.832  -8.398
    7    HE3  MET  40           HE1      MET  40   7.265  19.615 -11.197
    8    HE2  MET  40           HE2      MET  40   6.702  19.296  -9.559
    9    HE1  MET  40           HE3      MET  40   7.784  20.654  -9.862

  No H/Q in entry =           9
  In of MODEL   48
    1    H    MET  41           H        MET  41   2.091  20.817  -6.095
    2    HA   MET  41           HA       MET  41   1.587  18.048  -5.807
    3    HB2  MET  41           HB2      MET  41   0.228  20.397  -4.467
    4    HB3  MET  41           HB3      MET  41   0.089  18.719  -3.953
    5    HG2  MET  41           HG2      MET  41   2.797  18.970  -3.987
    6    HG3  MET  41           HG3      MET  41   2.338  20.626  -3.598
    7    HE2  MET  41           HE1      MET  41  -0.691  19.347  -1.873
    8    HE1  MET  41           HE2      MET  41   0.111  20.867  -2.255
    9    HE3  MET  41           HE3      MET  41   0.055  20.302  -0.585

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ASP  42           H        ASP  42  -0.478  20.747  -6.795
    2    HA   ASP  42           HA       ASP  42  -2.904  19.360  -6.930
    3    HB2  ASP  42           HB2      ASP  42  -2.224  21.937  -7.195
    4    HB3  ASP  42           HB3      ASP  42  -2.369  21.534  -8.902

  No H/Q in entry =           4
  In of MODEL   48
    1    H    GLN  43           H        GLN  43  -0.466  19.968  -9.431
    2    HA   GLN  43           HA       GLN  43  -1.835  18.626 -11.517
    3    HB2  GLN  43           HB2      GLN  43   1.117  19.176 -11.132
    4    HB3  GLN  43           HB3      GLN  43   0.412  18.523 -12.614
    5    HG2  GLN  43           HG2      GLN  43  -1.121  20.533 -12.665
    6    HG3  GLN  43           HG3      GLN  43  -0.178  21.204 -11.338
    7   HE21  GLN  43          HE21      GLN  43  -0.030  22.819 -13.430
    8   HE22  GLN  43          HE22      GLN  43   1.388  22.609 -14.334

  No H/Q in entry =           8
  In of MODEL   48
    1    H    SER  44           H        SER  44   0.524  17.520  -9.118
    2    HA   SER  44           HA       SER  44   0.889  14.914 -10.133
    3    HB2  SER  44           HB2      SER  44   1.764  16.371  -7.901
    4    HB3  SER  44           HB3      SER  44   0.916  14.980  -7.226
    5    HG   SER  44           HG       SER  44   3.034  14.382  -7.647

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ARG  45           H        ARG  45  -1.449  16.215  -7.804
    2    HA   ARG  45           HA       ARG  45  -2.811  13.842  -7.162
    3    HB2  ARG  45           HB2      ARG  45  -3.035  16.012  -5.979
    4    HB3  ARG  45           HB3      ARG  45  -3.896  16.664  -7.370
    5    HG2  ARG  45           HG2      ARG  45  -5.643  14.920  -7.083
    6    HG3  ARG  45           HG3      ARG  45  -4.794  14.322  -5.656
    7    HD2  ARG  45           HD2      ARG  45  -5.028  16.591  -4.609
    8    HD3  ARG  45           HD3      ARG  45  -6.018  17.094  -5.995
    9    HE   ARG  45           HE       ARG  45  -7.103  14.710  -4.947
   10   HH21  ARG  45          HH11      ARG  45  -8.942  14.769  -3.680
   11   HH22  ARG  45          HH12      ARG  45  -9.355  16.208  -2.817
   12   HH11  ARG  45          HH21      ARG  45  -6.596  17.966  -3.935
   13   HH12  ARG  45          HH22      ARG  45  -8.021  18.018  -2.960

  No H/Q in entry =          13
  In of MODEL   48
    1    H    MET  46           H        MET  46  -3.418  16.230  -9.723
    2    HA   MET  46           HA       MET  46  -5.742  15.027 -10.784
    3    HB2  MET  46           HB2      MET  46  -3.660  16.877 -11.957
    4    HB3  MET  46           HB3      MET  46  -5.028  16.297 -12.913
    5    HG2  MET  46           HG2      MET  46  -6.597  17.215 -11.278
    6    HG3  MET  46           HG3      MET  46  -5.265  17.728 -10.248
    7    HE3  MET  46           HE1      MET  46  -5.597  18.101 -14.360
    8    HE2  MET  46           HE2      MET  46  -6.734  19.435 -14.202
    9    HE1  MET  46           HE3      MET  46  -7.096  17.884 -13.447

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ALA  47           H        ALA  47  -2.306  14.584 -11.534
    2    HA   ALA  47           HA       ALA  47  -2.628  12.845 -13.739
    3    HB3  ALA  47           HB1      ALA  47  -0.462  13.761 -13.387
    4    HB2  ALA  47           HB2      ALA  47  -0.301  12.035 -13.046
    5    HB1  ALA  47           HB3      ALA  47  -0.409  13.191 -11.718

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU  48           H        LEU  48  -2.357  12.225 -10.262
    2    HA   LEU  48           HA       LEU  48  -2.418   9.384 -10.410
    3    HB2  LEU  48           HB2      LEU  48  -3.208  11.301  -8.205
    4    HB3  LEU  48           HB3      LEU  48  -3.094   9.552  -7.997
    5    HG   LEU  48           HG       LEU  48  -0.813  11.275  -8.997
    6   HD13  LEU  48          HD11      LEU  48  -1.109  12.050  -6.810
    7   HD12  LEU  48          HD12      LEU  48   0.069  10.757  -6.605
    8   HD11  LEU  48          HD13      LEU  48  -1.626  10.476  -6.209
    9   HD22  LEU  48          HD21      LEU  48  -0.288   9.093  -9.629
   10   HD21  LEU  48          HD22      LEU  48  -1.152   8.372  -8.272
   11   HD23  LEU  48          HD23      LEU  48   0.412   9.145  -8.012

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ASN  49           H        ASN  49  -4.911  11.848 -10.022
    2    HA   ASN  49           HA       ASN  49  -7.078  10.160  -9.480
    3    HB2  ASN  49           HB2      ASN  49  -7.166  12.582  -9.164
    4    HB3  ASN  49           HB3      ASN  49  -7.001  12.841 -10.897
    5   HD21  ASN  49          HD21      ASN  49  -8.996  13.560 -11.613
    6   HD22  ASN  49          HD22      ASN  49 -10.485  12.854 -11.215

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLU  50           H        GLU  50  -5.807  11.360 -12.570
    2    HA   GLU  50           HA       GLU  50  -7.744  10.076 -14.214
    3    HB2  GLU  50           HB2      GLU  50  -6.298  11.909 -15.033
    4    HB3  GLU  50           HB3      GLU  50  -4.892  10.854 -14.888
    5    HG2  GLU  50           HG2      GLU  50  -5.844   9.301 -16.521
    6    HG3  GLU  50           HG3      GLU  50  -7.316  10.262 -16.614

  No H/Q in entry =           6
  In of MODEL   48
    1    H    ALA  51           H        ALA  51  -4.564   9.126 -12.999
    2    HA   ALA  51           HA       ALA  51  -4.393   6.669 -14.408
    3    HB2  ALA  51           HB1      ALA  51  -2.411   6.409 -13.303
    4    HB1  ALA  51           HB2      ALA  51  -3.107   6.829 -11.738
    5    HB3  ALA  51           HB3      ALA  51  -2.664   8.101 -12.876

  No H/Q in entry =           5
  In of MODEL   48
    1    H    HIS  52           H        HIS  52  -5.582   7.500 -11.164
    2    HA   HIS  52           HA       HIS  52  -6.238   4.885 -10.324
    3    HB2  HIS  52           HB2      HIS  52  -6.125   6.852  -8.820
    4    HB3  HIS  52           HB3      HIS  52  -7.587   7.488  -9.573
    5    HD1  HIS  52           HD1      HIS  52  -9.777   5.931  -9.340
    6    HD2  HIS  52           HD2      HIS  52  -6.595   4.962  -6.829
    7    HE1  HIS  52           HE1      HIS  52 -10.725   4.437  -7.527
    8    HE2  HIS  52           HE2      HIS  52  -8.796   3.839  -5.987

  No H/Q in entry =           8
  In of MODEL   48
    1    H    LEU  53           H        LEU  53  -8.083   7.315 -12.125
    2    HA   LEU  53           HA       LEU  53 -10.574   5.995 -12.137
    3    HB2  LEU  53           HB2      LEU  53  -9.309   7.982 -14.014
    4    HB3  LEU  53           HB3      LEU  53 -10.901   7.299 -14.333
    5    HG   LEU  53           HG       LEU  53 -10.180   8.660 -11.715
    6   HD11  LEU  53          HD11      LEU  53 -11.381   9.762 -14.261
    7   HD13  LEU  53          HD12      LEU  53  -9.990  10.370 -13.363
    8   HD12  LEU  53          HD13      LEU  53 -11.612  10.541 -12.701
    9   HD22  LEU  53          HD21      LEU  53 -12.136   7.423 -11.305
   10   HD21  LEU  53          HD22      LEU  53 -12.705   7.597 -12.961
   11   HD23  LEU  53          HD23      LEU  53 -12.816   8.949 -11.851

  No H/Q in entry =          11
  In of MODEL   48
    1    H    VAL  54           H        VAL  54  -7.817   5.820 -14.368
    2    HA   VAL  54           HA       VAL  54  -9.016   4.029 -16.207
    3    HB   VAL  54           HB       VAL  54  -6.115   4.570 -15.521
    4   HG12  VAL  54          HG11      VAL  54  -5.851   3.479 -17.905
    5   HG11  VAL  54          HG12      VAL  54  -7.372   2.682 -17.502
    6   HG13  VAL  54          HG13      VAL  54  -5.955   2.447 -16.479
    7   HG22  VAL  54          HG21      VAL  54  -6.904   6.500 -16.574
    8   HG21  VAL  54          HG22      VAL  54  -8.086   5.620 -17.541
    9   HG23  VAL  54          HG23      VAL  54  -6.378   5.557 -17.968

  No H/Q in entry =           9
  In of MODEL   48
    1    H    GLN  55           H        GLN  55  -7.017   3.515 -13.301
    2    HA   GLN  55           HA       GLN  55  -6.896   0.699 -13.547
    3    HB2  GLN  55           HB2      GLN  55  -5.353   1.617 -12.028
    4    HB3  GLN  55           HB3      GLN  55  -6.582   2.573 -11.204
    5    HG2  GLN  55           HG2      GLN  55  -7.254   0.814  -9.881
    6    HG3  GLN  55           HG3      GLN  55  -7.014  -0.376 -11.155
    7   HE21  GLN  55          HE21      GLN  55  -5.376  -1.806 -10.652
    8   HE22  GLN  55          HE22      GLN  55  -3.997  -1.436  -9.738

  No H/Q in entry =           8
  In of MODEL   48
    1    H    THR  56           H        THR  56  -9.254   2.842 -11.945
    2    HA   THR  56           HA       THR  56 -10.820   0.947 -10.652
    3    HB   THR  56           HB       THR  56 -11.931   3.321 -12.169
    4    HG1  THR  56           HG1      THR  56 -10.502   3.114  -9.755
    5   HG22  THR  56          HG21      THR  56 -12.857   2.322  -9.499
    6   HG21  THR  56          HG22      THR  56 -13.371   1.476 -10.960
    7   HG23  THR  56          HG23      THR  56 -13.763   3.182 -10.743

  No H/Q in entry =           7
  In of MODEL   48
    1    H    LYS  57           H        LYS  57 -11.026   2.014 -14.043
    2    HA   LYS  57           HA       LYS  57 -13.163   0.301 -14.794
    3    HB2  LYS  57           HB2      LYS  57 -12.308   2.256 -16.119
    4    HB3  LYS  57           HB3      LYS  57 -10.855   1.335 -16.476
    5    HG2  LYS  57           HG2      LYS  57 -12.187  -0.369 -17.632
    6    HG3  LYS  57           HG3      LYS  57 -13.667   0.498 -17.240
    7    HD2  LYS  57           HD2      LYS  57 -12.863   2.445 -18.550
    8    HD3  LYS  57           HD3      LYS  57 -11.401   1.553 -18.968
    9    HE2  LYS  57           HE2      LYS  57 -12.771  -0.179 -20.088
   10    HE3  LYS  57           HE3      LYS  57 -14.241   0.703 -19.677
   11    HZ2  LYS  57           HZ1      LYS  57 -12.046   1.583 -21.458
   12    HZ1  LYS  57           HZ2      LYS  57 -13.267   2.626 -20.903
   13    HZ3  LYS  57           HZ3      LYS  57 -13.664   1.289 -21.872

  No H/Q in entry =          13
  In of MODEL   48
    1    H    LEU  58           H        LEU  58  -9.654  -0.092 -14.728
    2    HA   LEU  58           HA       LEU  58  -9.632  -2.614 -16.006
    3    HB2  LEU  58           HB2      LEU  58  -7.616  -1.293 -14.199
    4    HB3  LEU  58           HB3      LEU  58  -7.337  -2.815 -15.046
    5    HG   LEU  58           HG       LEU  58  -8.115  -0.225 -16.422
    6   HD11  LEU  58          HD11      LEU  58  -5.458  -1.431 -15.720
    7   HD13  LEU  58          HD12      LEU  58  -5.971   0.255 -15.679
    8   HD12  LEU  58          HD13      LEU  58  -5.620  -0.518 -17.221
    9   HD22  LEU  58          HD21      LEU  58  -8.671  -1.799 -18.008
   10   HD21  LEU  58          HD22      LEU  58  -7.618  -3.033 -17.319
   11   HD23  LEU  58          HD23      LEU  58  -6.938  -1.756 -18.328

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  59           H        ILE  59 -10.471  -1.707 -12.761
    2    HA   ILE  59           HA       ILE  59 -10.092  -4.467 -11.801
    3    HB   ILE  59           HB       ILE  59  -9.677  -2.189 -10.411
    4   HG12  ILE  59          HG12      ILE  59 -11.019  -4.553  -9.084
    5   HG13  ILE  59          HG13      ILE  59  -9.373  -4.609  -9.661
    6   HG22  ILE  59          HG21      ILE  59 -12.432  -2.939  -9.475
    7   HG21  ILE  59          HG22      ILE  59 -12.220  -1.697 -10.687
    8   HG23  ILE  59          HG23      ILE  59 -11.506  -1.508  -9.088
    9   HD12  ILE  59          HD11      ILE  59  -9.511  -4.006  -7.259
   10   HD11  ILE  59          HD12      ILE  59 -10.415  -2.563  -7.703
   11   HD13  ILE  59          HD13      ILE  59  -8.738  -2.749  -8.221

  No H/Q in entry =          11
  In of MODEL   48
    1    H    GLU  60           H        GLU  60 -12.673  -2.182 -12.625
    2    HA   GLU  60           HA       GLU  60 -14.844  -3.718 -11.611
    3    HB2  GLU  60           HB2      GLU  60 -15.082  -1.352 -12.217
    4    HB3  GLU  60           HB3      GLU  60 -14.751  -1.734 -13.903
    5    HG2  GLU  60           HG2      GLU  60 -16.769  -3.199 -13.937
    6    HG3  GLU  60           HG3      GLU  60 -17.122  -2.709 -12.292

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLY  61           H        GLY  61 -13.163  -3.698 -14.722
    2    HA3  GLY  61           HA2      GLY  61 -14.849  -5.965 -15.607
    3    HA2  GLY  61           HA3      GLY  61 -14.014  -4.855 -16.688

  No H/Q in entry =           3
  In of MODEL   48
    1    H    ASP  62           H        ASP  62 -12.627  -6.271 -13.795
    2    HA   ASP  62           HA       ASP  62 -10.408  -7.311 -15.316
    3    HB2  ASP  62           HB2      ASP  62  -9.583  -7.980 -13.050
    4    HB3  ASP  62           HB3      ASP  62  -9.971  -6.267 -13.184

  No H/Q in entry =           4
  In of MODEL   48
    1    H    ALA  63           H        ALA  63 -13.449  -8.570 -14.756
    2    HA   ALA  63           HA       ALA  63 -12.981 -11.260 -13.990
    3    HB1  ALA  63           HB1      ALA  63 -15.096 -10.023 -15.789
    4    HB2  ALA  63           HB2      ALA  63 -15.240 -10.335 -14.060
    5    HB3  ALA  63           HB3      ALA  63 -15.158 -11.682 -15.198

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLY  64           H        GLY  64 -12.940  -9.634 -17.113
    2    HA3  GLY  64           HA2      GLY  64 -12.268 -10.285 -19.207
    3    HA2  GLY  64           HA3      GLY  64 -11.033 -11.206 -18.358

  No H/Q in entry =           3
  In of MODEL   48
    1    H    GLU  65           H        GLU  65 -11.016 -13.310 -18.859
    2    HA   GLU  65           HA       GLU  65 -12.848 -14.588 -20.468
    3    HB2  GLU  65           HB2      GLU  65 -10.990 -15.763 -18.404
    4    HB3  GLU  65           HB3      GLU  65 -11.887 -16.728 -19.577
    5    HG2  GLU  65           HG2      GLU  65 -10.827 -15.521 -21.423
    6    HG3  GLU  65           HG3      GLU  65  -9.972 -14.486 -20.281

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLY  66           H        GLY  66 -13.670 -16.881 -19.532
    2    HA3  GLY  66           HA2      GLY  66 -16.139 -16.367 -18.286
    3    HA2  GLY  66           HA3      GLY  66 -15.450 -17.948 -18.599

  No H/Q in entry =           3
  In of MODEL   48
    1    H    LYS  67           H        LYS  67 -13.109 -17.579 -17.000
    2    HA   LYS  67           HA       LYS  67 -14.179 -18.371 -14.475
    3    HB2  LYS  67           HB2      LYS  67 -11.365 -18.036 -15.498
    4    HB3  LYS  67           HB3      LYS  67 -11.751 -18.646 -13.884
    5    HG2  LYS  67           HG2      LYS  67 -13.155 -20.418 -14.892
    6    HG3  LYS  67           HG3      LYS  67 -12.740 -19.823 -16.499
    7    HD2  LYS  67           HD2      LYS  67 -10.360 -20.310 -16.072
    8    HD3  LYS  67           HD3      LYS  67 -10.772 -20.900 -14.460
    9    HE2  LYS  67           HE2      LYS  67 -12.213 -22.639 -15.454
   10    HE3  LYS  67           HE3      LYS  67 -11.812 -22.049 -17.069
   11    HZ3  LYS  67           HZ1      LYS  67  -9.707 -22.870 -16.951
   12    HZ2  LYS  67           HZ2      LYS  67 -10.495 -24.012 -15.970
   13    HZ1  LYS  67           HZ3      LYS  67  -9.615 -22.743 -15.261

  No H/Q in entry =          13
  In of MODEL   48
    1    H    MET  68           H        MET  68 -13.469 -17.627 -12.426
    2    HA   MET  68           HA       MET  68 -14.077 -14.936 -11.932
    3    HB2  MET  68           HB2      MET  68 -12.887 -17.125 -10.251
    4    HB3  MET  68           HB3      MET  68 -13.183 -15.512  -9.604
    5    HG2  MET  68           HG2      MET  68 -15.556 -15.681 -10.243
    6    HG3  MET  68           HG3      MET  68 -15.265 -17.289 -10.912
    7    HE3  MET  68           HE1      MET  68 -17.542 -17.043  -8.928
    8    HE2  MET  68           HE2      MET  68 -17.216 -18.433  -7.894
    9    HE1  MET  68           HE3      MET  68 -16.918 -18.544  -9.628

  No H/Q in entry =           9
  In of MODEL   48
    1    H    LYS  69           H        LYS  69 -10.878 -16.528 -12.082
    2    HA   LYS  69           HA       LYS  69  -9.219 -14.768 -10.927
    3    HB2  LYS  69           HB2      LYS  69  -8.526 -16.822 -12.107
    4    HB3  LYS  69           HB3      LYS  69  -8.691 -15.975 -13.646
    5    HG2  LYS  69           HG2      LYS  69  -6.957 -14.415 -13.071
    6    HG3  LYS  69           HG3      LYS  69  -6.932 -14.966 -11.397
    7    HD2  LYS  69           HD2      LYS  69  -5.077 -15.828 -13.002
    8    HD3  LYS  69           HD3      LYS  69  -5.881 -16.998 -11.954
    9    HE2  LYS  69           HE2      LYS  69  -7.286 -17.766 -13.733
   10    HE3  LYS  69           HE3      LYS  69  -6.823 -16.418 -14.770
   11    HZ1  LYS  69           HZ1      LYS  69  -4.510 -17.782 -13.946
   12    HZ3  LYS  69           HZ2      LYS  69  -5.128 -17.597 -15.517
   13    HZ2  LYS  69           HZ3      LYS  69  -5.609 -18.917 -14.561

  No H/Q in entry =          13
  In of MODEL   48
    1    H    VAL  70           H        VAL  70  -7.755 -13.059 -11.623
    2    HA   VAL  70           HA       VAL  70  -8.990 -11.188 -13.568
    3    HB   VAL  70           HB       VAL  70  -8.088  -9.376 -12.092
    4   HG11  VAL  70          HG11      VAL  70 -10.463 -10.338 -12.000
    5   HG13  VAL  70          HG12      VAL  70  -9.924  -9.466 -10.563
    6   HG12  VAL  70          HG13      VAL  70  -9.934 -11.229 -10.573
    7   HG22  VAL  70          HG21      VAL  70  -7.244  -9.876  -9.897
    8   HG21  VAL  70          HG22      VAL  70  -6.387 -10.952 -10.999
    9   HG23  VAL  70          HG23      VAL  70  -7.720 -11.569 -10.025

  No H/Q in entry =           9
  In of MODEL   48
    1    H    SER  71           H        SER  71  -7.403  -9.568 -14.390
    2    HA   SER  71           HA       SER  71  -5.176 -10.802 -15.615
    3    HB2  SER  71           HB2      SER  71  -6.313  -8.799 -16.537
    4    HB3  SER  71           HB3      SER  71  -5.708  -7.852 -15.181
    5    HG   SER  71           HG       SER  71  -4.285  -9.094 -17.282

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU  72           H        LEU  72  -3.125 -11.022 -14.999
    2    HA   LEU  72           HA       LEU  72  -2.414 -10.788 -12.287
    3    HB2  LEU  72           HB2      LEU  72  -0.751 -11.211 -14.765
    4    HB3  LEU  72           HB3      LEU  72  -0.090 -11.268 -13.133
    5    HG   LEU  72           HG       LEU  72  -2.425 -12.989 -14.030
    6   HD13  LEU  72          HD11      LEU  72  -0.780 -14.817 -14.235
    7   HD12  LEU  72          HD12      LEU  72   0.524 -13.686 -13.872
    8   HD11  LEU  72          HD13      LEU  72  -0.407 -13.510 -15.360
    9   HD23  LEU  72          HD21      LEU  72  -1.426 -14.380 -12.051
   10   HD22  LEU  72          HD22      LEU  72  -2.407 -12.978 -11.656
   11   HD21  LEU  72          HD23      LEU  72  -0.651 -12.870 -11.587

  No H/Q in entry =          11
  In of MODEL   48
    1    H    VAL  73           H        VAL  73  -1.711  -8.777 -15.075
    2    HA   VAL  73           HA       VAL  73   0.190  -7.054 -13.975
    3    HB   VAL  73           HB       VAL  73  -0.214  -5.648 -15.838
    4   HG11  VAL  73          HG11      VAL  73   0.661  -7.952 -16.316
    5   HG13  VAL  73          HG12      VAL  73  -0.195  -7.231 -17.678
    6   HG12  VAL  73          HG13      VAL  73  -0.988  -8.453 -16.687
    7   HG21  VAL  73          HG21      VAL  73  -2.964  -6.841 -15.692
    8   HG23  VAL  73          HG22      VAL  73  -2.368  -6.248 -17.240
    9   HG22  VAL  73          HG23      VAL  73  -2.491  -5.151 -15.864

  No H/Q in entry =           9
  In of MODEL   48
    1    H    LEU  74           H        LEU  74  -3.208  -7.201 -13.425
    2    HA   LEU  74           HA       LEU  74  -3.854  -4.549 -12.826
    3    HB2  LEU  74           HB2      LEU  74  -5.568  -6.228 -12.996
    4    HB3  LEU  74           HB3      LEU  74  -4.869  -7.145 -11.664
    5    HG   LEU  74           HG       LEU  74  -5.346  -5.266 -10.124
    6   HD11  LEU  74          HD11      LEU  74  -6.369  -4.027 -12.680
    7   HD13  LEU  74          HD12      LEU  74  -5.268  -3.331 -11.492
    8   HD12  LEU  74          HD13      LEU  74  -6.980  -3.515 -11.106
    9   HD22  LEU  74          HD21      LEU  74  -7.546  -5.867  -9.861
   10   HD21  LEU  74          HD22      LEU  74  -7.009  -7.118 -10.961
   11   HD23  LEU  74          HD23      LEU  74  -7.895  -5.747 -11.583

  No H/Q in entry =          11
  In of MODEL   48
    1    H    VAL  75           H        VAL  75  -2.793  -7.115 -10.650
    2    HA   VAL  75           HA       VAL  75  -2.616  -5.551  -8.313
    3    HB   VAL  75           HB       VAL  75  -1.107  -8.041  -9.094
    4   HG11  VAL  75          HG11      VAL  75  -1.294  -6.559  -6.431
    5   HG13  VAL  75          HG12      VAL  75   0.158  -6.798  -7.393
    6   HG12  VAL  75          HG13      VAL  75  -0.624  -8.174  -6.633
    7   HG23  VAL  75          HG21      VAL  75  -3.463  -7.534  -7.241
    8   HG22  VAL  75          HG22      VAL  75  -2.749  -9.105  -7.603
    9   HG21  VAL  75          HG23      VAL  75  -3.592  -8.208  -8.867

  No H/Q in entry =           9
  In of MODEL   48
    1    H    GLU  76           H        GLU  76  -0.193  -6.299 -10.839
    2    HA   GLU  76           HA       GLU  76   1.976  -4.925  -9.682
    3    HB2  GLU  76           HB2      GLU  76   2.200  -6.407 -11.658
    4    HB3  GLU  76           HB3      GLU  76   1.279  -5.264 -12.622
    5    HG2  GLU  76           HG2      GLU  76   3.614  -4.907 -13.112
    6    HG3  GLU  76           HG3      GLU  76   3.075  -3.534 -12.163

  No H/Q in entry =           6
  In of MODEL   48
    1    H    ALA  77           H        ALA  77  -0.562  -3.759 -11.883
    2    HA   ALA  77           HA       ALA  77   0.402  -1.104 -12.069
    3    HB3  ALA  77           HB1      ALA  77  -2.437  -2.139 -12.323
    4    HB1  ALA  77           HB2      ALA  77  -1.259  -2.023 -13.631
    5    HB2  ALA  77           HB3      ALA  77  -1.869  -0.557 -12.864

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLN  78           H        GLN  78  -1.857  -2.672  -9.857
    2    HA   GLN  78           HA       GLN  78  -2.691  -0.355  -8.469
    3    HB2  GLN  78           HB2      GLN  78  -3.748  -2.660  -8.390
    4    HB3  GLN  78           HB3      GLN  78  -2.432  -3.147  -7.325
    5    HG2  GLN  78           HG2      GLN  78  -3.061  -1.434  -5.709
    6    HG3  GLN  78           HG3      GLN  78  -4.322  -0.841  -6.788
    7   HE21  GLN  78          HE21      GLN  78  -5.299  -3.431  -7.676
    8   HE22  GLN  78          HE22      GLN  78  -6.048  -4.173  -6.345

  No H/Q in entry =           8
  In of MODEL   48
    1    H    LEU  79           H        LEU  79   0.010  -2.581  -8.000
    2    HA   LEU  79           HA       LEU  79   0.969  -1.663  -5.545
    3    HB2  LEU  79           HB2      LEU  79   1.864  -3.667  -6.601
    4    HB3  LEU  79           HB3      LEU  79   2.503  -2.714  -7.937
    5    HG   LEU  79           HG       LEU  79   4.042  -1.552  -6.434
    6   HD13  LEU  79          HD11      LEU  79   3.030  -1.308  -4.371
    7   HD12  LEU  79          HD12      LEU  79   4.121  -2.644  -4.018
    8   HD11  LEU  79          HD13      LEU  79   2.420  -2.963  -4.351
    9   HD23  LEU  79          HD21      LEU  79   5.274  -3.683  -5.517
   10   HD22  LEU  79          HD22      LEU  79   5.073  -3.494  -7.257
   11   HD21  LEU  79          HD23      LEU  79   4.004  -4.571  -6.363

  No H/Q in entry =          11
  In of MODEL   48
    1    H    HIS  80           H        HIS  80   1.837  -0.551  -8.820
    2    HA   HIS  80           HA       HIS  80   3.620   1.460  -7.902
    3    HB2  HIS  80           HB2      HIS  80   2.345   0.740 -10.485
    4    HB3  HIS  80           HB3      HIS  80   2.921   2.399 -10.320
    5    HD1  HIS  80           HD1      HIS  80   5.321   2.724 -10.837
    6    HD2  HIS  80           HD2      HIS  80   4.542  -1.190  -9.630
    7    HE1  HIS  80           HE1      HIS  80   7.525   1.471 -10.991
    8    HE2  HIS  80           HE2      HIS  80   7.062  -0.918 -10.258

  No H/Q in entry =           8
  In of MODEL   48
    1    H    LEU  81           H        LEU  81   0.217   1.577  -8.892
    2    HA   LEU  81           HA       LEU  81  -0.091   4.368  -8.575
    3    HB2  LEU  81           HB2      LEU  81  -2.080   2.099  -8.492
    4    HB3  LEU  81           HB3      LEU  81  -2.552   3.797  -8.409
    5    HG   LEU  81           HG       LEU  81  -0.839   2.657 -10.634
    6   HD12  LEU  81          HD11      LEU  81  -3.071   2.945 -11.942
    7   HD11  LEU  81          HD12      LEU  81  -3.831   2.875 -10.352
    8   HD13  LEU  81          HD13      LEU  81  -2.870   1.516 -10.930
    9   HD23  LEU  81          HD21      LEU  81  -1.958   4.784 -11.745
   10   HD22  LEU  81          HD22      LEU  81  -0.547   4.976 -10.708
   11   HD21  LEU  81          HD23      LEU  81  -2.157   5.308 -10.074

  No H/Q in entry =          11
  In of MODEL   48
    1    H    MET  82           H        MET  82  -0.725   1.683  -6.316
    2    HA   MET  82           HA       MET  82  -1.803   3.266  -4.239
    3    HB2  MET  82           HB2      MET  82  -0.397   0.596  -4.262
    4    HB3  MET  82           HB3      MET  82  -0.989   1.321  -2.770
    5    HG2  MET  82           HG2      MET  82  -2.708   0.795  -5.214
    6    HG3  MET  82           HG3      MET  82  -2.621  -0.271  -3.814
    7    HE3  MET  82           HE1      MET  82  -4.372   1.370  -1.011
    8    HE2  MET  82           HE2      MET  82  -2.645   1.668  -1.192
    9    HE1  MET  82           HE3      MET  82  -3.313   0.100  -1.641

  No H/Q in entry =           9
  In of MODEL   48
    1    H    THR  83           H        THR  83   1.513   2.218  -4.914
    2    HA   THR  83           HA       THR  83   2.710   3.347  -2.615
    3    HB   THR  83           HB       THR  83   4.810   3.311  -4.082
    4    HG1  THR  83           HG1      THR  83   4.583   2.773  -6.104
    5   HG22  THR  83          HG21      THR  83   4.399   0.646  -4.403
    6   HG21  THR  83          HG22      THR  83   3.102   1.015  -3.269
    7   HG23  THR  83          HG23      THR  83   4.775   1.381  -2.846

  No H/Q in entry =           7
  In of MODEL   48
    1    H    SER  84           H        SER  84   2.334   4.607  -5.922
    2    HA   SER  84           HA       SER  84   3.642   7.066  -5.473
    3    HB2  SER  84           HB2      SER  84   1.588   6.199  -7.495
    4    HB3  SER  84           HB3      SER  84   2.246   7.835  -7.475
    5    HG   SER  84           HG       SER  84   3.650   5.375  -7.751

  No H/Q in entry =           5
  In of MODEL   48
    1    H    MET  85           H        MET  85   0.157   6.267  -5.309
    2    HA   MET  85           HA       MET  85  -0.738   8.869  -4.722
    3    HB2  MET  85           HB2      MET  85  -2.236   7.038  -5.388
    4    HB3  MET  85           HB3      MET  85  -1.944   6.245  -3.840
    5    HG2  MET  85           HG2      MET  85  -2.847   8.225  -2.660
    6    HG3  MET  85           HG3      MET  85  -3.153   9.000  -4.213
    7    HE3  MET  85           HE1      MET  85  -6.022   7.342  -5.802
    8    HE2  MET  85           HE2      MET  85  -4.420   6.697  -6.153
    9    HE1  MET  85           HE3      MET  85  -4.624   8.423  -5.874

  No H/Q in entry =           9
  In of MODEL   48
    1    H    LEU  86           H        LEU  86   0.207   6.228  -2.564
    2    HA   LEU  86           HA       LEU  86  -0.349   7.535  -0.129
    3    HB2  LEU  86           HB2      LEU  86   0.145   5.068  -0.511
    4    HB3  LEU  86           HB3      LEU  86   1.847   5.517  -0.603
    5    HG   LEU  86           HG       LEU  86   1.502   6.684   1.660
    6   HD11  LEU  86          HD11      LEU  86  -1.182   5.884   1.184
    7   HD13  LEU  86          HD12      LEU  86  -0.529   6.645   2.633
    8   HD12  LEU  86          HD13      LEU  86  -0.599   4.888   2.521
    9   HD23  LEU  86          HD21      LEU  86   1.107   3.687   1.793
   10   HD22  LEU  86          HD22      LEU  86   2.095   4.712   2.832
   11   HD21  LEU  86          HD23      LEU  86   2.604   4.386   1.176

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ALA  87           H        ALA  87   2.640   7.266  -2.008
    2    HA   ALA  87           HA       ALA  87   4.325   8.702  -0.284
    3    HB3  ALA  87           HB1      ALA  87   4.439   7.679  -2.987
    4    HB2  ALA  87           HB2      ALA  87   5.767   8.029  -1.884
    5    HB1  ALA  87           HB3      ALA  87   5.141   9.298  -2.935

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ARG  88           H        ARG  88   2.374   9.806  -3.015
    2    HA   ARG  88           HA       ARG  88   3.119  12.504  -2.907
    3    HB2  ARG  88           HB2      ARG  88   1.882  11.330  -4.763
    4    HB3  ARG  88           HB3      ARG  88   0.421  11.462  -3.785
    5    HG2  ARG  88           HG2      ARG  88   1.413  14.054  -3.709
    6    HG3  ARG  88           HG3      ARG  88   1.847  13.537  -5.337
    7    HD2  ARG  88           HD2      ARG  88  -0.293  13.592  -6.041
    8    HD3  ARG  88           HD3      ARG  88  -0.875  12.739  -4.611
    9    HE   ARG  88           HE       ARG  88  -1.092  15.513  -5.040
   10   HH21  ARG  88          HH11      ARG  88  -1.637  16.844  -3.309
   11   HH22  ARG  88          HH12      ARG  88  -1.340  16.316  -1.689
   12   HH11  ARG  88          HH21      ARG  88  -0.060  13.271  -2.654
   13   HH12  ARG  88          HH22      ARG  88  -0.464  14.287  -1.318

  No H/Q in entry =          13
  In of MODEL   48
    1    H    GLU  89           H        GLU  89   0.428  10.809  -1.268
    2    HA   GLU  89           HA       GLU  89  -0.706  13.114  -0.075
    3    HB2  GLU  89           HB2      GLU  89  -1.801  10.864  -0.156
    4    HB3  GLU  89           HB3      GLU  89  -0.675  10.324   1.090
    5    HG2  GLU  89           HG2      GLU  89  -1.516  12.021   2.640
    6    HG3  GLU  89           HG3      GLU  89  -2.572  12.677   1.391

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LEU  90           H        LEU  90   1.764  10.851   1.115
    2    HA   LEU  90           HA       LEU  90   2.101  12.108   3.640
    3    HB2  LEU  90           HB2      LEU  90   3.896  10.345   1.975
    4    HB3  LEU  90           HB3      LEU  90   4.306  10.872   3.612
    5    HG   LEU  90           HG       LEU  90   1.686   9.498   2.950
    6   HD12  LEU  90          HD11      LEU  90   2.842   7.467   3.969
    7   HD11  LEU  90          HD12      LEU  90   4.357   8.337   3.728
    8   HD13  LEU  90          HD13      LEU  90   3.352   7.914   2.340
    9   HD22  LEU  90          HD21      LEU  90   1.407  10.428   5.067
   10   HD21  LEU  90          HD22      LEU  90   3.124  10.338   5.454
   11   HD23  LEU  90          HD23      LEU  90   2.131   8.882   5.506

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  91           H        ILE  91   3.710  12.494   0.516
    2    HA   ILE  91           HA       ILE  91   5.667  14.346   1.354
    3    HB   ILE  91           HB       ILE  91   4.368  13.833  -1.328
    4   HG12  ILE  91          HG12      ILE  91   7.202  13.375  -0.344
    5   HG13  ILE  91          HG13      ILE  91   5.930  12.167  -0.181
    6   HG22  ILE  91          HG21      ILE  91   6.580  15.197  -2.016
    7   HG21  ILE  91          HG22      ILE  91   6.259  16.001  -0.478
    8   HG23  ILE  91          HG23      ILE  91   5.039  16.014  -1.751
    9   HD13  ILE  91          HD11      ILE  91   5.766  11.833  -2.487
   10   HD12  ILE  91          HD12      ILE  91   7.498  12.092  -2.270
   11   HD11  ILE  91          HD13      ILE  91   6.477  13.404  -2.864

  No H/Q in entry =          11
  In of MODEL   48
    1    H    THR  92           H        THR  92   2.305  14.745   0.335
    2    HA   THR  92           HA       THR  92   2.254  17.568   0.264
    3    HB   THR  92           HB       THR  92   0.102  15.557   0.965
    4    HG1  THR  92           HG1      THR  92   0.414  15.373  -1.118
    5   HG22  THR  92          HG21      THR  92  -1.316  17.704   0.231
    6   HG21  THR  92          HG22      THR  92   0.068  18.544   0.929
    7   HG23  THR  92          HG23      THR  92  -0.867  17.418   1.912

  No H/Q in entry =           7
  In of MODEL   48
    1    H    GLU  93           H        GLU  93   1.718  15.273   2.925
    2    HA   GLU  93           HA       GLU  93   1.165  17.180   4.935
    3    HB2  GLU  93           HB2      GLU  93   2.501  14.467   5.185
    4    HB3  GLU  93           HB3      GLU  93   1.798  15.393   6.512
    5    HG2  GLU  93           HG2      GLU  93   0.199  14.592   4.072
    6    HG3  GLU  93           HG3      GLU  93   0.306  13.576   5.505

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LEU  94           H        LEU  94   4.187  15.719   3.799
    2    HA   LEU  94           HA       LEU  94   5.923  16.889   5.687
    3    HB2  LEU  94           HB2      LEU  94   6.340  15.914   2.861
    4    HB3  LEU  94           HB3      LEU  94   7.661  16.587   3.811
    5    HG   LEU  94           HG       LEU  94   5.937  14.381   4.950
    6   HD11  LEU  94          HD11      LEU  94   8.040  14.164   2.825
    7   HD13  LEU  94          HD12      LEU  94   6.602  13.179   3.086
    8   HD12  LEU  94          HD13      LEU  94   8.027  12.942   4.098
    9   HD23  LEU  94          HD21      LEU  94   8.128  13.867   6.110
   10   HD22  LEU  94          HD22      LEU  94   7.447  15.441   6.519
   11   HD21  LEU  94          HD23      LEU  94   8.790  15.328   5.380

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  95           H        ILE  95   4.782  18.038   2.530
    2    HA   ILE  95           HA       ILE  95   6.334  20.409   2.465
    3    HB   ILE  95           HB       ILE  95   3.699  19.698   1.155
    4   HG12  ILE  95          HG12      ILE  95   6.488  20.054   0.025
    5   HG13  ILE  95          HG13      ILE  95   5.851  18.498   0.544
    6   HG21  ILE  95          HG21      ILE  95   5.428  22.179   0.930
    7   HG23  ILE  95          HG22      ILE  95   3.703  22.098   1.282
    8   HG22  ILE  95          HG23      ILE  95   4.294  21.696  -0.331
    9   HD13  ILE  95          HD11      ILE  95   4.296  18.402  -1.189
   10   HD12  ILE  95          HD12      ILE  95   5.640  19.229  -1.977
   11   HD11  ILE  95          HD13      ILE  95   4.258  20.154  -1.392

  No H/Q in entry =          11
  In of MODEL   48
    1    H    GLU  96           H        GLU  96   3.087  19.735   3.754
    2    HA   GLU  96           HA       GLU  96   2.443  22.379   4.494
    3    HB2  GLU  96           HB2      GLU  96   0.783  20.582   4.508
    4    HB3  GLU  96           HB3      GLU  96   1.648  19.767   5.808
    5    HG2  GLU  96           HG2      GLU  96   0.613  21.048   7.370
    6    HG3  GLU  96           HG3      GLU  96   1.138  22.523   6.569

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LEU  97           H        LEU  97   4.302  19.850   6.133
    2    HA   LEU  97           HA       LEU  97   4.642  21.211   8.600
    3    HB2  LEU  97           HB2      LEU  97   6.201  19.049   7.198
    4    HB3  LEU  97           HB3      LEU  97   6.781  19.745   8.709
    5    HG   LEU  97           HG       LEU  97   3.981  18.627   8.395
    6   HD12  LEU  97          HD11      LEU  97   4.934  16.627   9.618
    7   HD11  LEU  97          HD12      LEU  97   6.541  17.270   9.276
    8   HD13  LEU  97          HD13      LEU  97   5.479  16.798   7.949
    9   HD23  LEU  97          HD21      LEU  97   4.430  18.346  10.962
   10   HD22  LEU  97          HD22      LEU  97   4.038  19.952  10.350
   11   HD21  LEU  97          HD23      LEU  97   5.712  19.527  10.701

  No H/Q in entry =          11
  In of MODEL   48
    1    H    HIS  98           H        HIS  98   6.521  21.230   5.579
    2    HA   HIS  98           HA       HIS  98   8.659  22.830   6.478
    3    HB2  HIS  98           HB2      HIS  98   7.376  22.554   3.750
    4    HB3  HIS  98           HB3      HIS  98   8.807  23.545   4.041
    5    HD1  HIS  98           HD1      HIS  98   7.624  19.966   4.071
    6    HD2  HIS  98           HD2      HIS  98  11.187  22.091   4.497
    7    HE1  HIS  98           HE1      HIS  98   9.492  18.250   4.025
    8    HE2  HIS  98           HE2      HIS  98  11.666  19.524   4.285

  No H/Q in entry =           8
  In of MODEL   48
    1    H    GLU  99           H        GLU  99   5.435  23.636   5.291
    2    HA   GLU  99           HA       GLU  99   5.792  26.453   5.224
    3    HB2  GLU  99           HB2      GLU  99   3.926  25.265   4.092
    4    HB3  GLU  99           HB3      GLU  99   3.228  24.904   5.671
    5    HG2  GLU  99           HG2      GLU  99   3.028  27.297   6.162
    6    HG3  GLU  99           HG3      GLU  99   3.805  27.697   4.634

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LYS 100           H        LYS 100   4.672  24.219   7.751
    2    HA   LYS 100           HA       LYS 100   4.065  26.275   9.635
    3    HB2  LYS 100           HB2      LYS 100   4.662  23.330   9.994
    4    HB3  LYS 100           HB3      LYS 100   4.203  24.404  11.321
    5    HG2  LYS 100           HG2      LYS 100   2.135  25.021  10.065
    6    HG3  LYS 100           HG3      LYS 100   2.575  23.851   8.818
    7    HD2  LYS 100           HD2      LYS 100   2.506  22.036  10.486
    8    HD3  LYS 100           HD3      LYS 100   2.084  23.200  11.744
    9    HE2  LYS 100           HE2      LYS 100   0.030  23.802  10.473
   10    HE3  LYS 100           HE3      LYS 100   0.442  22.580   9.263
   11    HZ1  LYS 100           HZ1      LYS 100   0.173  21.922  12.145
   12    HZ3  LYS 100           HZ2      LYS 100   0.169  20.863  10.815
   13    HZ2  LYS 100           HZ3      LYS 100  -1.155  21.894  11.087

  No H/Q in entry =          13
  In of MODEL   48
    1    H    LEU 101           H        LEU 101   7.004  24.498   8.816
    2    HA   LEU 101           HA       LEU 101   8.590  25.358  11.021
    3    HB2  LEU 101           HB2      LEU 101   9.200  24.366   8.248
    4    HB3  LEU 101           HB3      LEU 101  10.494  25.044   9.231
    5    HG   LEU 101           HG       LEU 101   8.675  22.879  10.297
    6   HD12  LEU 101          HD11      LEU 101  10.741  21.396   9.700
    7   HD11  LEU 101          HD12      LEU 101  11.102  22.658   8.524
    8   HD13  LEU 101          HD13      LEU 101   9.580  21.773   8.429
    9   HD21  LEU 101          HD21      LEU 101  11.389  24.009  11.028
   10   HD23  LEU 101          HD22      LEU 101  10.855  22.435  11.613
   11   HD22  LEU 101          HD23      LEU 101   9.951  23.886  12.043

  No H/Q in entry =          11
  In of MODEL   48
    1    H    LYS 102           H        LYS 102   6.999  27.203   8.869
    2    HA   LYS 102           HA       LYS 102   7.061  29.495   8.569
    3    HB2  LYS 102           HB2      LYS 102   8.621  29.399  10.672
    4    HB3  LYS 102           HB3      LYS 102   9.922  29.598   9.515
    5    HG2  LYS 102           HG2      LYS 102   7.801  31.539  10.364
    6    HG3  LYS 102           HG3      LYS 102   9.512  31.810  10.116
    7    HD2  LYS 102           HD2      LYS 102   7.570  31.365   7.812
    8    HD3  LYS 102           HD3      LYS 102   7.940  32.949   8.476
    9    HE2  LYS 102           HE2      LYS 102   9.327  31.767   6.411
   10    HE3  LYS 102           HE3      LYS 102   9.932  33.082   7.419
   11    HZ2  LYS 102           HZ1      LYS 102  11.466  31.187   7.255
   12    HZ1  LYS 102           HZ2      LYS 102  10.309  30.199   7.998
   13    HZ3  LYS 102           HZ3      LYS 102  10.990  31.494   8.854

  No H/Q in entry =          13
  In of MODEL   48
    1    H    ALA 103           H        ALA 103  10.329  28.176   8.018
    2    HA   ALA 103           HA       ALA 103  11.289  29.552   5.940
    3    HB2  ALA 103           HB1      ALA 103  12.192  27.341   5.023
    4    HB1  ALA 103           HB2      ALA 103  11.299  26.565   6.329
    5    HB3  ALA 103           HB3      ALA 103  12.579  27.720   6.701

  No H/Q in entry =           5
  In of MODEL   48
    1    H1   LYS   3           H1       LYS   3 -31.097   6.549 -19.573
    2    H2   LYS   3           H3       LYS   3 -30.116   6.267 -20.930
    3    H3   LYS   3           H2       LYS   3 -31.522   5.345 -20.692
    4    HA   LYS   3           HA       LYS   3 -30.534   3.924 -19.310
    5    HB2  LYS   3           HB2      LYS   3 -28.238   5.326 -20.629
    6    HB3  LYS   3           HB3      LYS   3 -27.925   4.096 -19.404
    7    HG2  LYS   3           HG2      LYS   3 -29.370   2.547 -20.772
    8    HG3  LYS   3           HG3      LYS   3 -29.313   3.765 -22.046
    9    HD2  LYS   3           HD2      LYS   3 -26.832   3.619 -22.005
   10    HD3  LYS   3           HD3      LYS   3 -26.964   2.306 -20.836
   11    HE2  LYS   3           HE2      LYS   3 -28.482   1.173 -22.563
   12    HE3  LYS   3           HE3      LYS   3 -27.850   2.360 -23.705
   13    HZ3  LYS   3           HZ1      LYS   3 -26.068   1.112 -23.997
   14    HZ2  LYS   3           HZ2      LYS   3 -26.710  -0.062 -22.952
   15    HZ1  LYS   3           HZ3      LYS   3 -25.703   1.160 -22.339

  No H/Q in entry =          15
  In of MODEL   48
    1    H    LYS   4           H        LYS   4 -30.582   3.753 -17.251
    2    HA   LYS   4           HA       LYS   4 -29.817   6.007 -15.570
    3    HB2  LYS   4           HB2      LYS   4 -31.052   3.321 -14.905
    4    HB3  LYS   4           HB3      LYS   4 -30.811   4.640 -13.761
    5    HG2  LYS   4           HG2      LYS   4 -32.625   4.637 -16.179
    6    HG3  LYS   4           HG3      LYS   4 -33.111   4.670 -14.484
    7    HD2  LYS   4           HD2      LYS   4 -32.384   6.878 -14.188
    8    HD3  LYS   4           HD3      LYS   4 -31.349   6.826 -15.615
    9    HE2  LYS   4           HE2      LYS   4 -33.257   8.232 -16.053
   10    HE3  LYS   4           HE3      LYS   4 -33.360   6.775 -17.041
   11    HZ3  LYS   4           HZ1      LYS   4 -34.944   5.863 -15.503
   12    HZ2  LYS   4           HZ2      LYS   4 -35.479   7.374 -16.064
   13    HZ1  LYS   4           HZ3      LYS   4 -34.821   7.232 -14.505

  No H/Q in entry =          13
  In of MODEL   48
    1    H    HIS   5           H        HIS   5 -28.343   6.049 -13.983
    2    HA   HIS   5           HA       HIS   5 -26.089   4.192 -14.346
    3    HB2  HIS   5           HB2      HIS   5 -26.300   6.933 -13.101
    4    HB3  HIS   5           HB3      HIS   5 -24.832   5.957 -13.101
    5    HD1  HIS   5           HD1      HIS   5 -23.349   7.157 -14.678
    6    HD2  HIS   5           HD2      HIS   5 -27.163   6.615 -16.229
    7    HE1  HIS   5           HE1      HIS   5 -23.180   7.769 -17.121
    8    HE2  HIS   5           HE2      HIS   5 -25.505   7.425 -18.035

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ILE   6           H        ILE   6 -25.880   2.597 -13.053
    2    HA   ILE   6           HA       ILE   6 -26.843   2.842 -10.281
    3    HB   ILE   6           HB       ILE   6 -26.061   0.384 -11.856
    4   HG12  ILE   6          HG12      ILE   6 -28.786   1.350 -10.984
    5   HG13  ILE   6          HG13      ILE   6 -28.146   1.526 -12.618
    6   HG23  ILE   6          HG21      ILE   6 -26.448  -0.888 -10.012
    7   HG22  ILE   6          HG22      ILE   6 -27.585   0.266  -9.314
    8   HG21  ILE   6          HG23      ILE   6 -25.851   0.574  -9.224
    9   HD13  ILE   6          HD11      ILE   6 -28.640  -0.579 -13.145
   10   HD12  ILE   6          HD12      ILE   6 -29.651  -0.566 -11.700
   11   HD11  ILE   6          HD13      ILE   6 -28.007  -1.201 -11.622

  No H/Q in entry =          11
  In of MODEL   48
    1    H    TYR   7           H        TYR   7 -25.071   3.437  -8.991
    2    HA   TYR   7           HA       TYR   7 -22.377   2.447  -9.692
    3    HB2  TYR   7           HB2      TYR   7 -23.297   4.875  -8.175
    4    HB3  TYR   7           HB3      TYR   7 -21.622   4.334  -8.226
    5    HD1  TYR   7           HD1      TYR   7 -22.685   3.452 -11.326
    6    HD2  TYR   7           HD2      TYR   7 -21.953   6.981  -9.052
    7    HE1  TYR   7           HE1      TYR   7 -22.239   4.703 -13.400
    8    HE2  TYR   7           HE2      TYR   7 -21.548   8.239 -11.118
    9    HH   TYR   7           HH       TYR   7 -21.775   8.187 -13.350

  No H/Q in entry =           9
  In of MODEL   48
    1    H    LEU   8           H        LEU   8 -21.429   1.062  -8.385
    2    HA   LEU   8           HA       LEU   8 -22.560   0.547  -5.705
    3    HB2  LEU   8           HB2      LEU   8 -20.890  -1.117  -7.568
    4    HB3  LEU   8           HB3      LEU   8 -21.076  -1.520  -5.861
    5    HG   LEU   8           HG       LEU   8 -23.560  -1.647  -6.279
    6   HD13  LEU   8          HD11      LEU   8 -23.677  -0.400  -8.371
    7   HD12  LEU   8          HD12      LEU   8 -24.234  -2.051  -8.632
    8   HD11  LEU   8          HD13      LEU   8 -22.620  -1.572  -9.155
    9   HD23  LEU   8          HD21      LEU   8 -22.323  -3.684  -8.004
   10   HD22  LEU   8          HD22      LEU   8 -23.409  -3.854  -6.625
   11   HD21  LEU   8          HD23      LEU   8 -21.696  -3.531  -6.363

  No H/Q in entry =          11
  In of MODEL   48
    1    H    PHE   9           H        PHE   9 -21.285   0.926  -3.925
    2    HA   PHE   9           HA       PHE   9 -18.486   1.820  -4.431
    3    HB2  PHE   9           HB2      PHE   9 -20.499   2.903  -2.465
    4    HB3  PHE   9           HB3      PHE   9 -18.784   3.286  -2.416
    5    HD1  PHE   9           HD1      PHE   9 -17.736   4.621  -4.166
    6    HD2  PHE   9           HD2      PHE   9 -21.937   3.758  -4.258
    7    HE1  PHE   9           HE1      PHE   9 -18.054   6.349  -5.912
    8    HE2  PHE   9           HE2      PHE   9 -22.256   5.497  -5.998
    9    HZ   PHE   9           HZ       PHE   9 -20.312   6.789  -6.832

  No H/Q in entry =           9
  In of MODEL   48
    1    H    SER  10           H        SER  10 -16.913   0.820  -3.349
    2    HA   SER  10           HA       SER  10 -17.113  -0.092  -0.660
    3    HB2  SER  10           HB2      SER  10 -16.964  -2.467  -0.996
    4    HB3  SER  10           HB3      SER  10 -18.376  -1.891  -1.868
    5    HG   SER  10           HG       SER  10 -16.991  -1.793  -3.739

  No H/Q in entry =           5
  In of MODEL   48
    1    H    SER  11           H        SER  11 -15.098   0.041   0.149
    2    HA   SER  11           HA       SER  11 -12.911   0.867  -1.381
    3    HB2  SER  11           HB2      SER  11 -11.684   0.829   0.598
    4    HB3  SER  11           HB3      SER  11 -13.347   1.031   1.155
    5    HG   SER  11           HG       SER  11 -11.619  -0.942   1.681

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA  12           H        ALA  12 -14.158  -1.839  -2.168
    2    HA   ALA  12           HA       ALA  12 -11.587  -3.084  -2.750
    3    HB1  ALA  12           HB1      ALA  12 -13.807  -4.608  -1.366
    4    HB3  ALA  12           HB2      ALA  12 -12.221  -4.230  -0.694
    5    HB2  ALA  12           HB3      ALA  12 -12.356  -5.334  -2.062

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLY  13           H        GLY  13 -12.394  -2.046  -4.754
    2    HA3  GLY  13           HA2      GLY  13 -14.644  -2.713  -6.208
    3    HA2  GLY  13           HA3      GLY  13 -13.093  -2.289  -6.945

  No H/Q in entry =           3
  In of MODEL   48
    1    H    MET  14           H        MET  14 -11.616  -4.593  -6.028
    2    HA   MET  14           HA       MET  14 -12.032  -6.334  -8.137
    3    HB2  MET  14           HB2      MET  14  -9.976  -6.449  -6.826
    4    HB3  MET  14           HB3      MET  14 -10.851  -7.109  -5.446
    5    HG2  MET  14           HG2      MET  14 -11.464  -9.092  -6.803
    6    HG3  MET  14           HG3      MET  14 -10.579  -8.422  -8.175
    7    HE3  MET  14           HE1      MET  14  -7.018  -8.601  -7.491
    8    HE2  MET  14           HE2      MET  14  -7.778  -7.191  -6.756
    9    HE1  MET  14           HE3      MET  14  -8.389  -7.813  -8.287

  No H/Q in entry =           9
  In of MODEL   48
    1    H    SER  15           H        SER  15 -13.263  -6.867  -4.820
    2    HA   SER  15           HA       SER  15 -14.639  -9.276  -5.601
    3    HB2  SER  15           HB2      SER  15 -14.129  -9.103  -3.259
    4    HB3  SER  15           HB3      SER  15 -14.940  -7.545  -3.141
    5    HG   SER  15           HG       SER  15 -15.977  -9.991  -2.856

  No H/Q in entry =           5
  In of MODEL   48
    1    H    THR  16           H        THR  16 -15.665  -5.890  -5.147
    2    HA   THR  16           HA       THR  16 -18.464  -6.324  -5.681
    3    HB   THR  16           HB       THR  16 -16.850  -3.795  -6.165
    4    HG1  THR  16           HG1      THR  16 -16.438  -4.044  -4.114
    5   HG21  THR  16          HG21      THR  16 -19.200  -3.871  -7.005
    6   HG23  THR  16          HG22      THR  16 -18.970  -2.676  -5.716
    7   HG22  THR  16          HG23      THR  16 -19.736  -4.233  -5.369

  No H/Q in entry =           7
  In of MODEL   48
    1    H    SER  17           H        SER  17 -15.622  -5.795  -7.540
    2    HA   SER  17           HA       SER  17 -16.742  -5.003 -10.030
    3    HB2  SER  17           HB2      SER  17 -14.138  -6.405  -9.384
    4    HB3  SER  17           HB3      SER  17 -14.576  -5.862 -11.003
    5    HG   SER  17           HG       SER  17 -13.538  -4.155 -10.267

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU  18           H        LEU  18 -16.219  -8.176  -8.625
    2    HA   LEU  18           HA       LEU  18 -16.831  -9.635 -10.999
    3    HB2  LEU  18           HB2      LEU  18 -15.624 -10.642  -9.115
    4    HB3  LEU  18           HB3      LEU  18 -17.045 -10.435  -8.092
    5    HG   LEU  18           HG       LEU  18 -18.308 -11.978  -9.491
    6   HD11  LEU  18          HD11      LEU  18 -15.824 -11.836 -11.167
    7   HD13  LEU  18          HD12      LEU  18 -17.512 -11.736 -11.667
    8   HD12  LEU  18          HD13      LEU  18 -16.824 -13.288 -11.195
    9   HD21  LEU  18          HD21      LEU  18 -15.646 -12.947  -8.517
   10   HD23  LEU  18          HD22      LEU  18 -16.932 -14.024  -9.066
   11   HD22  LEU  18          HD23      LEU  18 -17.197 -12.970  -7.677

  No H/Q in entry =          11
  In of MODEL   48
    1    H    LEU  19           H        LEU  19 -18.778  -8.434  -8.268
    2    HA   LEU  19           HA       LEU  19 -21.259  -9.569  -9.113
    3    HB2  LEU  19           HB2      LEU  19 -20.982  -8.775  -6.851
    4    HB3  LEU  19           HB3      LEU  19 -20.662  -7.140  -7.431
    5    HG   LEU  19           HG       LEU  19 -22.985  -6.914  -8.131
    6   HD13  LEU  19          HD11      LEU  19 -23.512  -9.209  -8.699
    7   HD12  LEU  19          HD12      LEU  19 -24.621  -8.657  -7.445
    8   HD11  LEU  19          HD13      LEU  19 -23.272  -9.710  -7.024
    9   HD21  LEU  19          HD21      LEU  19 -22.648  -7.867  -5.293
   10   HD23  LEU  19          HD22      LEU  19 -23.979  -6.879  -5.895
   11   HD22  LEU  19          HD23      LEU  19 -22.334  -6.240  -5.895

  No H/Q in entry =          11
  In of MODEL   48
    1    H    VAL  20           H        VAL  20 -19.718  -6.423  -9.767
    2    HA   VAL  20           HA       VAL  20 -21.817  -5.327 -11.318
    3    HB   VAL  20           HB       VAL  20 -18.819  -4.779 -11.431
    4   HG11  VAL  20          HG11      VAL  20 -21.102  -3.448 -12.899
    5   HG13  VAL  20          HG12      VAL  20 -19.629  -4.135 -13.583
    6   HG12  VAL  20          HG13      VAL  20 -19.551  -2.653 -12.629
    7   HG23  VAL  20          HG21      VAL  20 -19.649  -2.590 -10.409
    8   HG22  VAL  20          HG22      VAL  20 -19.635  -4.022  -9.382
    9   HG21  VAL  20          HG23      VAL  20 -21.150  -3.460 -10.088

  No H/Q in entry =           9
  In of MODEL   48
    1    H    SER  21           H        SER  21 -19.091  -7.405 -12.378
    2    HA   SER  21           HA       SER  21 -19.879  -7.244 -15.126
    3    HB2  SER  21           HB2      SER  21 -18.473  -9.228 -15.488
    4    HB3  SER  21           HB3      SER  21 -17.624  -8.007 -14.543
    5    HG   SER  21           HG       SER  21 -17.424  -9.403 -13.036

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LYS  22           H        LYS  22 -20.972  -9.448 -12.582
    2    HA   LYS  22           HA       LYS  22 -22.538 -11.020 -14.423
    3    HB2  LYS  22           HB2      LYS  22 -21.752 -11.632 -12.016
    4    HB3  LYS  22           HB3      LYS  22 -23.199 -10.759 -11.513
    5    HG2  LYS  22           HG2      LYS  22 -24.605 -12.384 -12.235
    6    HG3  LYS  22           HG3      LYS  22 -23.562 -12.840 -13.582
    7    HD2  LYS  22           HD2      LYS  22 -22.099 -14.063 -12.107
    8    HD3  LYS  22           HD3      LYS  22 -22.989 -13.496 -10.692
    9    HE2  LYS  22           HE2      LYS  22 -23.623 -15.785 -11.191
   10    HE3  LYS  22           HE3      LYS  22 -24.991 -14.712 -11.489
   11    HZ3  LYS  22           HZ1      LYS  22 -24.945 -15.105 -13.693
   12    HZ2  LYS  22           HZ2      LYS  22 -24.265 -16.576 -13.181
   13    HZ1  LYS  22           HZ3      LYS  22 -23.261 -15.331 -13.752

  No H/Q in entry =          13
  In of MODEL   48
    1    H    MET  23           H        MET  23 -23.213  -8.112 -12.513
    2    HA   MET  23           HA       MET  23 -26.022  -8.139 -13.016
    3    HB2  MET  23           HB2      MET  23 -24.138  -5.869 -12.414
    4    HB3  MET  23           HB3      MET  23 -25.880  -5.670 -12.587
    5    HG2  MET  23           HG2      MET  23 -26.289  -6.993 -10.635
    6    HG3  MET  23           HG3      MET  23 -24.586  -7.434 -10.518
    7    HE2  MET  23           HE1      MET  23 -26.822  -3.762  -9.275
    8    HE1  MET  23           HE2      MET  23 -27.095  -4.706 -10.738
    9    HE3  MET  23           HE3      MET  23 -26.036  -3.296 -10.784

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ARG  24           H        ARG  24 -23.247  -6.732 -14.785
    2    HA   ARG  24           HA       ARG  24 -24.726  -5.379 -16.763
    3    HB2  ARG  24           HB2      ARG  24 -22.277  -5.029 -16.377
    4    HB3  ARG  24           HB3      ARG  24 -21.970  -6.620 -17.030
    5    HG2  ARG  24           HG2      ARG  24 -22.773  -5.921 -19.261
    6    HG3  ARG  24           HG3      ARG  24 -23.197  -4.319 -18.600
    7    HD2  ARG  24           HD2      ARG  24 -21.009  -4.116 -19.628
    8    HD3  ARG  24           HD3      ARG  24 -20.800  -4.090 -17.882
    9    HE   ARG  24           HE       ARG  24 -19.515  -5.886 -17.929
   10   HH21  ARG  24          HH11      ARG  24 -17.904  -6.709 -19.264
   11   HH22  ARG  24          HH12      ARG  24 -18.323  -7.366 -20.807
   12   HH11  ARG  24          HH21      ARG  24 -21.632  -6.135 -20.558
   13   HH12  ARG  24          HH22      ARG  24 -20.533  -7.030 -21.560

  No H/Q in entry =          13
  In of MODEL   48
    1    H    ALA  25           H        ALA  25 -23.662  -8.739 -16.536
    2    HA   ALA  25           HA       ALA  25 -24.309  -9.522 -19.183
    3    HB1  ALA  25           HB1      ALA  25 -23.647 -11.575 -18.518
    4    HB3  ALA  25           HB2      ALA  25 -24.702 -11.556 -17.105
    5    HB2  ALA  25           HB3      ALA  25 -23.132 -10.758 -17.043

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLN  26           H        GLN  26 -26.131  -9.572 -16.158
    2    HA   GLN  26           HA       GLN  26 -28.497 -10.718 -17.188
    3    HB2  GLN  26           HB2      GLN  26 -27.950  -9.015 -14.776
    4    HB3  GLN  26           HB3      GLN  26 -29.526  -9.705 -15.135
    5    HG2  GLN  26           HG2      GLN  26 -26.966 -11.214 -14.691
    6    HG3  GLN  26           HG3      GLN  26 -28.324 -11.103 -13.578
    7   HE21  GLN  26          HE21      GLN  26 -27.147 -13.270 -14.887
    8   HE22  GLN  26          HE22      GLN  26 -28.208 -14.287 -15.698

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ALA  27           H        ALA  27 -27.501  -7.344 -16.749
    2    HA   ALA  27           HA       ALA  27 -29.973  -6.195 -17.512
    3    HB1  ALA  27           HB1      ALA  27 -28.138  -4.929 -16.380
    4    HB3  ALA  27           HB2      ALA  27 -28.717  -4.131 -17.844
    5    HB2  ALA  27           HB3      ALA  27 -27.197  -5.025 -17.870

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLU  28           H        GLU  28 -27.296  -7.438 -19.403
    2    HA   GLU  28           HA       GLU  28 -28.216  -6.344 -21.905
    3    HB2  GLU  28           HB2      GLU  28 -25.849  -7.079 -21.296
    4    HB3  GLU  28           HB3      GLU  28 -26.423  -8.730 -21.521
    5    HG2  GLU  28           HG2      GLU  28 -25.266  -7.944 -23.479
    6    HG3  GLU  28           HG3      GLU  28 -26.970  -8.231 -23.831

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LYS  29           H        LYS  29 -28.436  -9.471 -20.295
    2    HA   LYS  29           HA       LYS  29 -29.768 -10.887 -22.321
    3    HB2  LYS  29           HB2      LYS  29 -28.734 -11.920 -20.333
    4    HB3  LYS  29           HB3      LYS  29 -29.991 -11.206 -19.326
    5    HG2  LYS  29           HG2      LYS  29 -31.678 -12.531 -20.412
    6    HG3  LYS  29           HG3      LYS  29 -30.492 -13.170 -21.548
    7    HD2  LYS  29           HD2      LYS  29 -29.369 -14.384 -19.834
    8    HD3  LYS  29           HD3      LYS  29 -30.259 -13.546 -18.565
    9    HE2  LYS  29           HE2      LYS  29 -31.053 -15.875 -18.962
   10    HE3  LYS  29           HE3      LYS  29 -32.310 -14.656 -19.186
   11    HZ1  LYS  29           HZ1      LYS  29 -31.751 -14.762 -21.616
   12    HZ3  LYS  29           HZ2      LYS  29 -32.495 -16.146 -20.970
   13    HZ2  LYS  29           HZ3      LYS  29 -30.825 -16.143 -21.271

  No H/Q in entry =          13
  In of MODEL   48
    1    H    TYR  30           H        TYR  30 -31.119  -8.796 -19.782
    2    HA   TYR  30           HA       TYR  30 -33.791  -9.178 -21.026
    3    HB2  TYR  30           HB2      TYR  30 -33.113  -8.078 -18.289
    4    HB3  TYR  30           HB3      TYR  30 -34.736  -8.296 -18.943
    5    HD1  TYR  30           HD1      TYR  30 -35.687 -10.568 -19.191
    6    HD2  TYR  30           HD2      TYR  30 -31.838  -9.942 -17.483
    7    HE1  TYR  30           HE1      TYR  30 -35.639 -12.909 -18.430
    8    HE2  TYR  30           HE2      TYR  30 -31.790 -12.269 -16.725
    9    HH   TYR  30           HH       TYR  30 -33.473 -14.582 -17.853

  No H/Q in entry =           9
  In of MODEL   48
    1    H    GLU  31           H        GLU  31 -31.590  -7.214 -21.799
    2    HA   GLU  31           HA       GLU  31 -31.479  -5.045 -22.588
    3    HB2  GLU  31           HB2      GLU  31 -34.387  -5.700 -23.108
    4    HB3  GLU  31           HB3      GLU  31 -33.523  -4.337 -23.816
    5    HG2  GLU  31           HG2      GLU  31 -32.078  -5.782 -25.032
    6    HG3  GLU  31           HG3      GLU  31 -32.666  -7.199 -24.165

  No H/Q in entry =           6
  In of MODEL   48
    1    H    VAL  32           H        VAL  32 -31.672  -4.983 -19.855
    2    HA   VAL  32           HA       VAL  32 -33.498  -2.848 -19.159
    3    HB   VAL  32           HB       VAL  32 -31.120  -3.907 -17.598
    4   HG12  VAL  32          HG11      VAL  32 -32.639  -3.087 -15.688
    5   HG11  VAL  32          HG12      VAL  32 -33.459  -2.150 -16.936
    6   HG13  VAL  32          HG13      VAL  32 -31.746  -1.881 -16.614
    7   HG21  VAL  32          HG21      VAL  32 -32.919  -5.587 -18.310
    8   HG23  VAL  32          HG22      VAL  32 -33.942  -4.760 -17.136
    9   HG22  VAL  32          HG23      VAL  32 -32.438  -5.517 -16.615

  No H/Q in entry =           9
  In of MODEL   48
    1    HA   PRO  33           HA       PRO  33 -30.419   0.055 -20.792
    2    HB2  PRO  33           HB2      PRO  33 -31.892   2.299 -20.631
    3    HB3  PRO  33           HB3      PRO  33 -32.384   1.023 -21.744
    4    HG2  PRO  33           HG2      PRO  33 -33.340   1.512 -18.923
    5    HG3  PRO  33           HG3      PRO  33 -34.310   1.341 -20.385
    6    HD2  PRO  33           HD2      PRO  33 -33.886  -0.765 -18.753
    7    HD3  PRO  33           HD3      PRO  33 -33.954  -0.977 -20.503

  No H/Q in entry =           7
  In of MODEL   48
    1    H    VAL  34           H        VAL  34 -29.162  -0.541 -18.853
    2    HA   VAL  34           HA       VAL  34 -28.836   1.853 -17.168
    3    HB   VAL  34           HB       VAL  34 -28.276   0.351 -15.255
    4   HG12  VAL  34          HG11      VAL  34 -30.702  -0.487 -14.957
    5   HG11  VAL  34          HG12      VAL  34 -31.008   0.303 -16.503
    6   HG13  VAL  34          HG13      VAL  34 -30.437   1.248 -15.128
    7   HG21  VAL  34          HG21      VAL  34 -28.497  -1.640 -17.294
    8   HG23  VAL  34          HG22      VAL  34 -29.558  -2.005 -15.933
    9   HG22  VAL  34          HG23      VAL  34 -27.835  -1.750 -15.664

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ILE  35           H        ILE  35 -26.852   2.242 -16.324
    2    HA   ILE  35           HA       ILE  35 -24.570   0.897 -17.612
    3    HB   ILE  35           HB       ILE  35 -24.924   3.780 -16.755
    4   HG12  ILE  35          HG12      ILE  35 -23.966   2.498 -19.321
    5   HG13  ILE  35          HG13      ILE  35 -25.585   3.140 -19.049
    6   HG21  ILE  35          HG21      ILE  35 -22.387   2.212 -17.092
    7   HG23  ILE  35          HG22      ILE  35 -22.820   3.378 -15.844
    8   HG22  ILE  35          HG23      ILE  35 -22.432   3.932 -17.472
    9   HD11  ILE  35          HD11      ILE  35 -24.148   5.302 -18.416
   10   HD13  ILE  35          HD12      ILE  35 -24.693   4.955 -20.057
   11   HD12  ILE  35          HD13      ILE  35 -23.048   4.551 -19.569

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ILE  36           H        ILE  36 -23.354  -0.171 -16.032
    2    HA   ILE  36           HA       ILE  36 -23.780   0.405 -13.150
    3    HB   ILE  36           HB       ILE  36 -22.997  -2.293 -14.304
    4   HG12  ILE  36          HG12      ILE  36 -25.791  -1.455 -13.522
    5   HG13  ILE  36          HG13      ILE  36 -25.221  -1.417 -15.191
    6   HG23  ILE  36          HG21      ILE  36 -23.358  -3.150 -12.202
    7   HG22  ILE  36          HG22      ILE  36 -24.465  -1.856 -11.741
    8   HG21  ILE  36          HG23      ILE  36 -22.729  -1.550 -11.809
    9   HD13  ILE  36          HD11      ILE  36 -25.421  -3.625 -15.432
   10   HD12  ILE  36          HD12      ILE  36 -26.482  -3.508 -14.029
   11   HD11  ILE  36          HD13      ILE  36 -24.791  -3.958 -13.820

  No H/Q in entry =          11
  In of MODEL   48
    1    H    GLU  37           H        GLU  37 -21.988   0.989 -12.039
    2    HA   GLU  37           HA       GLU  37 -19.312   0.165 -12.973
    3    HB2  GLU  37           HB2      GLU  37 -20.155   2.957 -12.213
    4    HB3  GLU  37           HB3      GLU  37 -18.478   2.435 -12.385
    5    HG2  GLU  37           HG2      GLU  37 -20.522   2.507 -14.586
    6    HG3  GLU  37           HG3      GLU  37 -19.271   3.716 -14.302

  No H/Q in entry =           6
  In of MODEL   48
    1    H    ALA  38           H        ALA  38 -17.826  -0.122 -11.297
    2    HA   ALA  38           HA       ALA  38 -18.850   0.027  -8.522
    3    HB1  ALA  38           HB1      ALA  38 -17.168  -1.914  -9.982
    4    HB3  ALA  38           HB2      ALA  38 -18.219  -2.156  -8.586
    5    HB2  ALA  38           HB3      ALA  38 -16.596  -1.501  -8.365

  No H/Q in entry =           5
  In of MODEL   48
    1    H    PHE  39           H        PHE  39 -17.590   1.195  -7.031
    2    HA   PHE  39           HA       PHE  39 -15.049   2.374  -7.913
    3    HB2  PHE  39           HB2      PHE  39 -17.441   3.880  -6.872
    4    HB3  PHE  39           HB3      PHE  39 -15.804   4.524  -6.770
    5    HD1  PHE  39           HD1      PHE  39 -14.480   4.544  -9.026
    6    HD2  PHE  39           HD2      PHE  39 -18.729   4.400  -8.690
    7    HE1  PHE  39           HE1      PHE  39 -14.682   5.459 -11.321
    8    HE2  PHE  39           HE2      PHE  39 -18.946   5.307 -10.976
    9    HZ   PHE  39           HZ       PHE  39 -16.928   5.811 -12.310

  No H/Q in entry =           9
  In of MODEL   48
    1    HA   PRO  40           HA       PRO  40 -14.115   1.540  -3.640
    2    HB2  PRO  40           HB2      PRO  40 -12.318   3.518  -3.004
    3    HB3  PRO  40           HB3      PRO  40 -11.896   2.200  -4.097
    4    HG2  PRO  40           HG2      PRO  40 -12.887   4.962  -4.792
    5    HG3  PRO  40           HG3      PRO  40 -11.470   4.115  -5.415
    6    HD2  PRO  40           HD2      PRO  40 -13.696   4.072  -6.826
    7    HD3  PRO  40           HD3      PRO  40 -12.759   2.589  -6.656

  No H/Q in entry =           7
  In of MODEL   48
    1    H    GLU  41           H        GLU  41 -14.720   2.491  -1.495
    2    HA   GLU  41           HA       GLU  41 -16.941   4.223  -1.447
    3    HB2  GLU  41           HB2      GLU  41 -16.817   4.087   0.919
    4    HB3  GLU  41           HB3      GLU  41 -16.297   2.519   0.301
    5    HG2  GLU  41           HG2      GLU  41 -13.953   3.166   0.677
    6    HG3  GLU  41           HG3      GLU  41 -14.498   4.709   1.336

  No H/Q in entry =           6
  In of MODEL   48
    1    H    THR  42           H        THR  42 -13.599   5.098  -1.490
    2    HA   THR  42           HA       THR  42 -13.917   7.643  -0.237
    3    HB   THR  42           HB       THR  42 -11.754   8.207  -1.328
    4    HG1  THR  42           HG1      THR  42 -11.401   7.208  -3.138
    5   HG21  THR  42          HG21      THR  42 -11.966   5.466  -0.063
    6   HG23  THR  42          HG22      THR  42 -11.644   6.994   0.758
    7   HG22  THR  42          HG23      THR  42 -10.440   6.308  -0.332

  No H/Q in entry =           7
  In of MODEL   48
    1    H    LEU  43           H        LEU  43 -14.840   6.611  -3.352
    2    HA   LEU  43           HA       LEU  43 -15.059   9.401  -4.278
    3    HB2  LEU  43           HB2      LEU  43 -15.479   6.789  -5.720
    4    HB3  LEU  43           HB3      LEU  43 -15.631   8.388  -6.445
    5    HG   LEU  43           HG       LEU  43 -13.071   7.159  -5.451
    6   HD11  LEU  43          HD11      LEU  43 -14.282   6.296  -7.610
    7   HD13  LEU  43          HD12      LEU  43 -12.552   6.627  -7.632
    8   HD12  LEU  43          HD13      LEU  43 -13.680   7.803  -8.300
    9   HD21  LEU  43          HD21      LEU  43 -13.810   9.823  -6.614
   10   HD23  LEU  43          HD22      LEU  43 -12.204   9.147  -6.895
   11   HD22  LEU  43          HD23      LEU  43 -12.756   9.453  -5.249

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ALA  44           H        ALA  44 -17.024   7.572  -2.450
    2    HA   ALA  44           HA       ALA  44 -19.506   7.483  -3.770
    3    HB3  ALA  44           HB1      ALA  44 -19.379   6.332  -1.692
    4    HB2  ALA  44           HB2      ALA  44 -20.468   7.686  -1.397
    5    HB1  ALA  44           HB3      ALA  44 -18.795   7.764  -0.846

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLY  45           H        GLY  45 -18.048  10.240  -2.197
    2    HA3  GLY  45           HA2      GLY  45 -20.467  11.777  -2.529
    3    HA2  GLY  45           HA3      GLY  45 -18.913  12.373  -1.945

  No H/Q in entry =           3
  In of MODEL   48
    1    H    GLU  46           H        GLU  46 -17.398  11.453  -4.254
    2    HA   GLU  46           HA       GLU  46 -18.009  13.704  -5.986
    3    HB2  GLU  46           HB2      GLU  46 -15.838  11.604  -6.013
    4    HB3  GLU  46           HB3      GLU  46 -15.961  12.903  -7.200
    5    HG2  GLU  46           HG2      GLU  46 -15.639  14.560  -5.469
    6    HG3  GLU  46           HG3      GLU  46 -15.607  13.299  -4.236

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LYS  47           H        LYS  47 -17.936  10.191  -6.476
    2    HA   LYS  47           HA       LYS  47 -19.035  10.467  -9.147
    3    HB2  LYS  47           HB2      LYS  47 -18.497   8.040  -7.425
    4    HB3  LYS  47           HB3      LYS  47 -19.069   7.982  -9.093
    5    HG2  LYS  47           HG2      LYS  47 -16.501   9.317  -8.319
    6    HG3  LYS  47           HG3      LYS  47 -16.600   7.602  -8.714
    7    HD2  LYS  47           HD2      LYS  47 -17.576   8.170 -10.893
    8    HD3  LYS  47           HD3      LYS  47 -17.437   9.882 -10.498
    9    HE2  LYS  47           HE2      LYS  47 -15.014   9.654 -10.335
   10    HE3  LYS  47           HE3      LYS  47 -15.146   7.937 -10.709
   11    HZ3  LYS  47           HZ1      LYS  47 -16.008   8.452 -12.849
   12    HZ2  LYS  47           HZ2      LYS  47 -14.575   9.336 -12.631
   13    HZ1  LYS  47           HZ3      LYS  47 -16.081  10.111 -12.492

  No H/Q in entry =          13
  In of MODEL   48
    1    H    GLY  48           H        GLY  48 -20.363   9.677  -6.008
    2    HA3  GLY  48           HA2      GLY  48 -22.764   8.534  -6.763
    3    HA2  GLY  48           HA3      GLY  48 -22.523   9.502  -5.309

  No H/Q in entry =           3
  In of MODEL   48
    1    H    GLN  49           H        GLN  49 -21.912  11.942  -6.843
    2    HA   GLN  49           HA       GLN  49 -24.457  13.088  -6.966
    3    HB2  GLN  49           HB2      GLN  49 -21.905  13.941  -8.316
    4    HB3  GLN  49           HB3      GLN  49 -23.354  14.923  -8.215
    5    HG2  GLN  49           HG2      GLN  49 -23.191  14.907  -5.778
    6    HG3  GLN  49           HG3      GLN  49 -21.754  13.904  -5.879
    7   HE21  GLN  49          HE21      GLN  49 -21.607  16.110  -4.572
    8   HE22  GLN  49          HE22      GLN  49 -20.669  17.364  -5.201

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ASN  50           H        ASN  50 -22.807  11.225  -9.385
    2    HA   ASN  50           HA       ASN  50 -24.682  12.153 -11.449
    3    HB2  ASN  50           HB2      ASN  50 -22.123  10.583 -11.711
    4    HB3  ASN  50           HB3      ASN  50 -23.169  11.044 -13.046
    5   HD21  ASN  50          HD21      ASN  50 -20.519  11.830 -11.427
    6   HD22  ASN  50          HD22      ASN  50 -20.266  13.467 -11.745

  No H/Q in entry =           6
  In of MODEL   48
    1    H    ALA  51           H        ALA  51 -24.694   9.762  -9.240
    2    HA   ALA  51           HA       ALA  51 -25.510   7.656 -11.098
    3    HB2  ALA  51           HB1      ALA  51 -24.942   6.273  -9.434
    4    HB3  ALA  51           HB2      ALA  51 -26.051   7.079  -8.326
    5    HB1  ALA  51           HB3      ALA  51 -24.405   7.681  -8.517

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ASP  52           H        ASP  52 -27.529   6.625 -10.971
    2    HA   ASP  52           HA       ASP  52 -29.684   8.477 -10.273
    3    HB2  ASP  52           HB2      ASP  52 -29.530   5.996 -11.983
    4    HB3  ASP  52           HB3      ASP  52 -31.064   6.743 -11.534

  No H/Q in entry =           4
  In of MODEL   48
    1    H    VAL  53           H        VAL  53 -28.121   5.551  -9.305
    2    HA   VAL  53           HA       VAL  53 -29.555   5.660  -6.785
    3    HB   VAL  53           HB       VAL  53 -30.979   4.057  -8.051
    4   HG11  VAL  53          HG11      VAL  53 -29.247   3.196  -9.590
    5   HG13  VAL  53          HG12      VAL  53 -30.096   1.900  -8.749
    6   HG12  VAL  53          HG13      VAL  53 -28.479   2.372  -8.234
    7   HG23  VAL  53          HG21      VAL  53 -30.182   2.042  -6.392
    8   HG22  VAL  53          HG22      VAL  53 -31.292   3.357  -6.003
    9   HG21  VAL  53          HG23      VAL  53 -29.583   3.498  -5.596

  No H/Q in entry =           9
  In of MODEL   48
    1    H    VAL  54           H        VAL  54 -28.245   5.182  -5.139
    2    HA   VAL  54           HA       VAL  54 -25.500   4.303  -5.769
    3    HB   VAL  54           HB       VAL  54 -26.540   6.061  -3.490
    4   HG11  VAL  54          HG11      VAL  54 -23.983   4.609  -3.807
    5   HG13  VAL  54          HG12      VAL  54 -24.723   5.277  -2.354
    6   HG12  VAL  54          HG13      VAL  54 -23.804   6.324  -3.435
    7   HG22  VAL  54          HG21      VAL  54 -25.657   7.879  -4.563
    8   HG21  VAL  54          HG22      VAL  54 -26.220   6.919  -5.929
    9   HG23  VAL  54          HG23      VAL  54 -24.513   6.912  -5.493

  No H/Q in entry =           9
  In of MODEL   48
    1    H    LEU  55           H        LEU  55 -24.934   2.363  -5.157
    2    HA   LEU  55           HA       LEU  55 -26.457   1.041  -3.000
    3    HB2  LEU  55           HB2      LEU  55 -24.922  -0.114  -5.315
    4    HB3  LEU  55           HB3      LEU  55 -25.693  -1.057  -4.040
    5    HG   LEU  55           HG       LEU  55 -27.110   0.584  -6.130
    6   HD13  LEU  55          HD11      LEU  55 -26.840  -1.253  -7.378
    7   HD12  LEU  55          HD12      LEU  55 -27.808  -2.133  -6.196
    8   HD11  LEU  55          HD13      LEU  55 -26.051  -2.096  -6.046
    9   HD23  LEU  55          HD21      LEU  55 -28.431  -1.371  -4.302
   10   HD22  LEU  55          HD22      LEU  55 -29.107   0.034  -5.127
   11   HD21  LEU  55          HD23      LEU  55 -28.081   0.253  -3.709

  No H/Q in entry =          11
  In of MODEL   48
    1    H    LEU  56           H        LEU  56 -25.312   0.402  -1.205
    2    HA   LEU  56           HA       LEU  56 -22.371   0.754  -1.255
    3    HB2  LEU  56           HB2      LEU  56 -24.173   0.533   1.144
    4    HB3  LEU  56           HB3      LEU  56 -22.457   0.937   1.136
    5    HG   LEU  56           HG       LEU  56 -24.733   2.665   0.203
    6   HD11  LEU  56          HD11      LEU  56 -23.620   2.228   2.715
    7   HD13  LEU  56          HD12      LEU  56 -24.591   3.619   2.232
    8   HD12  LEU  56          HD13      LEU  56 -22.832   3.699   2.143
    9   HD23  LEU  56          HD21      LEU  56 -22.764   4.337   0.031
   10   HD22  LEU  56          HD22      LEU  56 -23.165   3.267  -1.312
   11   HD21  LEU  56          HD23      LEU  56 -21.815   2.877  -0.247

  No H/Q in entry =          11
  In of MODEL   48
    1    H    GLY  57           H        GLY  57 -21.015  -0.904  -0.749
    2    HA3  GLY  57           HA2      GLY  57 -21.979  -3.573  -0.985
    3    HA2  GLY  57           HA3      GLY  57 -20.347  -3.110  -0.503

  No H/Q in entry =           3
  In of MODEL   48
    1    HA   PRO  58           HA       PRO  58 -23.166  -4.163   3.197
    2    HB2  PRO  58           HB2      PRO  58 -22.519  -6.788   3.762
    3    HB3  PRO  58           HB3      PRO  58 -23.899  -6.343   2.758
    4    HG2  PRO  58           HG2      PRO  58 -21.187  -7.252   1.953
    5    HG3  PRO  58           HG3      PRO  58 -22.759  -7.678   1.277
    6    HD2  PRO  58           HD2      PRO  58 -21.125  -5.867   0.080
    7    HD3  PRO  58           HD3      PRO  58 -22.883  -5.753  -0.017

  No H/Q in entry =           7
  In of MODEL   48
    1    H    GLN  59           H        GLN  59 -19.804  -4.678   2.577
    2    HA   GLN  59           HA       GLN  59 -19.045  -4.750   5.335
    3    HB2  GLN  59           HB2      GLN  59 -17.298  -3.661   3.144
    4    HB3  GLN  59           HB3      GLN  59 -16.821  -4.467   4.625
    5    HG2  GLN  59           HG2      GLN  59 -16.434  -6.007   2.893
    6    HG3  GLN  59           HG3      GLN  59 -17.902  -6.551   3.687
    7   HE21  GLN  59          HE21      GLN  59 -18.809  -7.384   2.144
    8   HE22  GLN  59          HE22      GLN  59 -19.461  -7.004   0.662

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ILE  60           H        ILE  60 -19.942  -2.151   3.168
    2    HA   ILE  60           HA       ILE  60 -19.057  -0.239   5.242
    3    HB   ILE  60           HB       ILE  60 -19.269   1.522   3.441
    4   HG12  ILE  60          HG12      ILE  60 -19.099  -0.678   1.426
    5   HG13  ILE  60          HG13      ILE  60 -20.680  -0.128   1.984
    6   HG21  ILE  60          HG21      ILE  60 -17.163   0.208   4.162
    7   HG23  ILE  60          HG22      ILE  60 -17.114   1.257   2.746
    8   HG22  ILE  60          HG23      ILE  60 -17.275  -0.487   2.546
    9   HD11  ILE  60          HD11      ILE  60 -19.730   2.252   1.384
   10   HD13  ILE  60          HD12      ILE  60 -20.372   1.207   0.117
   11   HD12  ILE  60          HD13      ILE  60 -18.629   1.329   0.361

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ALA  61           H        ALA  61 -21.536  -1.787   5.291
    2    HA   ALA  61           HA       ALA  61 -23.737  -0.082   4.863
    3    HB1  ALA  61           HB1      ALA  61 -24.973  -1.573   6.168
    4    HB2  ALA  61           HB2      ALA  61 -23.580  -1.999   7.161
    5    HB3  ALA  61           HB3      ALA  61 -23.687  -2.578   5.499

  No H/Q in entry =           5
  In of MODEL   48
    1    H    TYR  62           H        TYR  62 -21.527  -0.270   7.654
    2    HA   TYR  62           HA       TYR  62 -23.053   1.385   9.353
    3    HB2  TYR  62           HB2      TYR  62 -21.001   1.762  10.586
    4    HB3  TYR  62           HB3      TYR  62 -21.093   0.069  10.103
    5    HD1  TYR  62           HD1      TYR  62 -19.524  -0.852   8.452
    6    HD2  TYR  62           HD2      TYR  62 -19.274   3.243   9.649
    7    HE1  TYR  62           HE1      TYR  62 -17.311  -0.679   7.379
    8    HE2  TYR  62           HE2      TYR  62 -17.047   3.411   8.577
    9    HH   TYR  62           HH       TYR  62 -15.971   1.735   6.405

  No H/Q in entry =           9
  In of MODEL   48
    1    H    MET  63           H        MET  63 -21.402   2.261   6.507
    2    HA   MET  63           HA       MET  63 -21.189   5.079   7.244
    3    HB2  MET  63           HB2      MET  63 -20.608   3.582   4.687
    4    HB3  MET  63           HB3      MET  63 -20.395   5.323   4.886
    5    HG2  MET  63           HG2      MET  63 -18.680   4.945   6.551
    6    HG3  MET  63           HG3      MET  63 -18.918   3.203   6.423
    7    HE3  MET  63           HE1      MET  63 -18.339   5.882   3.050
    8    HE2  MET  63           HE2      MET  63 -16.831   6.133   3.931
    9    HE1  MET  63           HE3      MET  63 -18.379   6.353   4.751

  No H/Q in entry =           9
  In of MODEL   48
    1    H    LEU  64           H        LEU  64 -23.784   3.281   6.256
    2    HA   LEU  64           HA       LEU  64 -24.975   4.751   4.202
    3    HB2  LEU  64           HB2      LEU  64 -25.876   2.645   5.089
    4    HB3  LEU  64           HB3      LEU  64 -26.316   3.473   6.584
    5    HG   LEU  64           HG       LEU  64 -27.993   4.774   5.378
    6   HD13  LEU  64          HD11      LEU  64 -27.711   5.044   3.149
    7   HD12  LEU  64          HD12      LEU  64 -28.383   3.422   2.980
    8   HD11  LEU  64          HD13      LEU  64 -26.635   3.651   3.038
    9   HD23  LEU  64          HD21      LEU  64 -28.558   1.981   4.588
   10   HD22  LEU  64          HD22      LEU  64 -29.526   3.117   5.529
   11   HD21  LEU  64          HD23      LEU  64 -28.163   2.290   6.279

  No H/Q in entry =          11
  In of MODEL   48
    1    HA   PRO  65           HA       PRO  65 -27.098   7.899   7.007
    2    HB2  PRO  65           HB2      PRO  65 -25.089   7.988   9.258
    3    HB3  PRO  65           HB3      PRO  65 -26.824   8.298   9.312
    4    HG2  PRO  65           HG2      PRO  65 -25.930   6.014  10.202
    5    HG3  PRO  65           HG3      PRO  65 -27.352   6.022   9.160
    6    HD2  PRO  65           HD2      PRO  65 -24.493   5.370   8.441
    7    HD3  PRO  65           HD3      PRO  65 -25.966   4.514   7.983

  No H/Q in entry =           7
  In of MODEL   48
    1    H    GLU  66           H        GLU  66 -23.542   7.780   7.070
    2    HA   GLU  66           HA       GLU  66 -23.198  10.580   6.707
    3    HB2  GLU  66           HB2      GLU  66 -21.426   8.251   6.016
    4    HB3  GLU  66           HB3      GLU  66 -20.948   9.938   5.833
    5    HG2  GLU  66           HG2      GLU  66 -21.148  10.277   8.207
    6    HG3  GLU  66           HG3      GLU  66 -21.701   8.615   8.415

  No H/Q in entry =           6
  In of MODEL   48
    1    H    ILE  67           H        ILE  67 -23.353   7.871   4.414
    2    HA   ILE  67           HA       ILE  67 -22.911   9.607   2.145
    3    HB   ILE  67           HB       ILE  67 -23.861   6.714   2.283
    4   HG12  ILE  67          HG12      ILE  67 -21.213   7.851   1.373
    5   HG13  ILE  67          HG13      ILE  67 -21.511   7.411   3.053
    6   HG21  ILE  67          HG21      ILE  67 -23.775   8.625   0.087
    7   HG23  ILE  67          HG22      ILE  67 -24.429   6.987   0.114
    8   HG22  ILE  67          HG23      ILE  67 -22.716   7.246  -0.214
    9   HD12  ILE  67          HD11      ILE  67 -21.128   5.668   0.675
   10   HD11  ILE  67          HD12      ILE  67 -22.149   5.093   1.992
   11   HD13  ILE  67          HD13      ILE  67 -20.468   5.523   2.304

  No H/Q in entry =          11
  In of MODEL   48
    1    H    GLN  68           H        GLN  68 -25.796   8.581   3.770
    2    HA   GLN  68           HA       GLN  68 -27.612   9.575   1.815
    3    HB2  GLN  68           HB2      GLN  68 -27.868   9.176   4.793
    4    HB3  GLN  68           HB3      GLN  68 -29.179   9.812   3.812
    5    HG2  GLN  68           HG2      GLN  68 -29.248   7.802   2.506
    6    HG3  GLN  68           HG3      GLN  68 -27.808   7.186   3.295
    7   HE21  GLN  68          HE21      GLN  68 -30.012   5.872   3.145
    8   HE22  GLN  68          HE22      GLN  68 -30.846   5.410   4.555

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ARG  69           H        ARG  69 -25.969  11.168   4.573
    2    HA   ARG  69           HA       ARG  69 -27.285  13.683   4.210
    3    HB2  ARG  69           HB2      ARG  69 -24.955  12.682   5.777
    4    HB3  ARG  69           HB3      ARG  69 -25.001  14.409   5.446
    5    HG2  ARG  69           HG2      ARG  69 -27.314  14.483   6.424
    6    HG3  ARG  69           HG3      ARG  69 -27.139  12.781   6.871
    7    HD2  ARG  69           HD2      ARG  69 -25.397  15.088   7.816
    8    HD3  ARG  69           HD3      ARG  69 -26.541  14.189   8.800
    9    HE   ARG  69           HE       ARG  69 -23.950  13.221   7.829
   10   HH21  ARG  69          HH11      ARG  69 -23.175  11.423   8.995
   11   HH22  ARG  69          HH12      ARG  69 -24.217  10.611  10.114
   12   HH11  ARG  69          HH21      ARG  69 -26.914  12.707   9.526
   13   HH12  ARG  69          HH22      ARG  69 -26.333  11.335  10.413

  No H/Q in entry =          13
  In of MODEL   48
    1    H    LEU  70           H        LEU  70 -24.446  12.240   2.820
    2    HA   LEU  70           HA       LEU  70 -23.288  14.600   1.685
    3    HB2  LEU  70           HB2      LEU  70 -22.340  12.254   2.242
    4    HB3  LEU  70           HB3      LEU  70 -22.968  11.825   0.651
    5    HG   LEU  70           HG       LEU  70 -21.350  13.182  -0.417
    6   HD11  LEU  70          HD11      LEU  70 -20.503  13.965   2.380
    7   HD13  LEU  70          HD12      LEU  70 -21.180  15.032   1.151
    8   HD12  LEU  70          HD13      LEU  70 -19.583  14.321   0.916
    9   HD22  LEU  70          HD21      LEU  70 -19.951  11.433  -0.215
   10   HD21  LEU  70          HD22      LEU  70 -20.884  10.907   1.186
   11   HD23  LEU  70          HD23      LEU  70 -19.477  11.948   1.403

  No H/Q in entry =          11
  In of MODEL   48
    1    H    LEU  71           H        LEU  71 -25.496  12.120   0.537
    2    HA   LEU  71           HA       LEU  71 -25.997  13.657  -1.955
    3    HB2  LEU  71           HB2      LEU  71 -26.265  10.671  -1.554
    4    HB3  LEU  71           HB3      LEU  71 -26.379  11.559  -3.073
    5    HG   LEU  71           HG       LEU  71 -23.855  11.491  -1.420
    6   HD12  LEU  71          HD11      LEU  71 -23.950   9.903  -3.877
    7   HD11  LEU  71          HD12      LEU  71 -24.969   9.280  -2.581
    8   HD13  LEU  71          HD13      LEU  71 -23.244   9.519  -2.306
    9   HD22  LEU  71          HD21      LEU  71 -23.922  13.332  -2.885
   10   HD21  LEU  71          HD22      LEU  71 -24.446  12.321  -4.232
   11   HD23  LEU  71          HD23      LEU  71 -22.826  12.128  -3.561

  No H/Q in entry =          11
  In of MODEL   48
    1    HA   PRO  72           HA       PRO  72 -29.865  13.253   0.671
    2    HB2  PRO  72           HB2      PRO  72 -30.664  15.833   0.632
    3    HB3  PRO  72           HB3      PRO  72 -29.363  15.336   1.713
    4    HG2  PRO  72           HG2      PRO  72 -29.158  16.568  -1.023
    5    HG3  PRO  72           HG3      PRO  72 -28.375  17.079   0.472
    6    HD2  PRO  72           HD2      PRO  72 -27.078  15.518  -1.321
    7    HD3  PRO  72           HD3      PRO  72 -26.822  15.318   0.410

  No H/Q in entry =           7
  In of MODEL   48
    1    H    ASN  73           H        ASN  73 -29.228  14.244  -2.530
    2    HA   ASN  73           HA       ASN  73 -32.096  14.011  -3.158
    3    HB2  ASN  73           HB2      ASN  73 -31.611  15.138  -5.240
    4    HB3  ASN  73           HB3      ASN  73 -31.062  16.085  -3.865
    5   HD21  ASN  73          HD21      ASN  73 -30.273  16.153  -6.543
    6   HD22  ASN  73          HD22      ASN  73 -28.610  15.956  -6.743

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LYS  74           H        LYS  74 -30.168  11.704  -2.775
    2    HA   LYS  74           HA       LYS  74 -30.776  10.362  -5.342
    3    HB2  LYS  74           HB2      LYS  74 -28.247   9.985  -3.734
    4    HB3  LYS  74           HB3      LYS  74 -28.654   9.205  -5.262
    5    HG2  LYS  74           HG2      LYS  74 -28.317  12.164  -5.015
    6    HG3  LYS  74           HG3      LYS  74 -26.970  11.074  -5.341
    7    HD2  LYS  74           HD2      LYS  74 -28.114  10.203  -7.295
    8    HD3  LYS  74           HD3      LYS  74 -29.508  11.230  -6.954
    9    HE2  LYS  74           HE2      LYS  74 -28.236  13.212  -7.369
   10    HE3  LYS  74           HE3      LYS  74 -26.737  12.288  -7.479
   11    HZ2  LYS  74           HZ1      LYS  74 -28.199  12.958  -9.591
   12    HZ1  LYS  74           HZ2      LYS  74 -28.889  11.446  -9.239
   13    HZ3  LYS  74           HZ3      LYS  74 -27.222  11.570  -9.539

  No H/Q in entry =          13
  In of MODEL   48
    1    HA   PRO  75           HA       PRO  75 -32.236   7.366  -2.413
    2    HB2  PRO  75           HB2      PRO  75 -32.604   5.181  -4.028
    3    HB3  PRO  75           HB3      PRO  75 -33.696   6.564  -4.073
    4    HG2  PRO  75           HG2      PRO  75 -31.379   5.937  -5.860
    5    HG3  PRO  75           HG3      PRO  75 -33.018   6.421  -6.295
    6    HD2  PRO  75           HD2      PRO  75 -31.030   8.237  -6.230
    7    HD3  PRO  75           HD3      PRO  75 -32.650   8.669  -5.681

  No H/Q in entry =           7
  In of MODEL   48
    1    H    VAL  76           H        VAL  76 -30.806   6.254  -1.060
    2    HA   VAL  76           HA       VAL  76 -28.374   5.001  -2.194
    3    HB   VAL  76           HB       VAL  76 -28.618   6.434   0.487
    4   HG11  VAL  76          HG11      VAL  76 -26.299   5.109  -0.932
    5   HG13  VAL  76          HG12      VAL  76 -27.002   4.652   0.621
    6   HG12  VAL  76          HG13      VAL  76 -26.119   6.170   0.467
    7   HG22  VAL  76          HG21      VAL  76 -27.906   8.330  -0.373
    8   HG21  VAL  76          HG22      VAL  76 -28.470   7.672  -1.910
    9   HG23  VAL  76          HG23      VAL  76 -26.769   7.534  -1.462

  No H/Q in entry =           9
  In of MODEL   48
    1    H    GLU  77           H        GLU  77 -28.209   2.833  -1.614
    2    HA   GLU  77           HA       GLU  77 -29.009   2.025   1.030
    3    HB2  GLU  77           HB2      GLU  77 -30.658   0.427   0.479
    4    HB3  GLU  77           HB3      GLU  77 -31.170   1.973  -0.198
    5    HG2  GLU  77           HG2      GLU  77 -30.586   1.234  -2.399
    6    HG3  GLU  77           HG3      GLU  77 -29.980  -0.288  -1.751

  No H/Q in entry =           6
  In of MODEL   48
    1    H    VAL  78           H        VAL  78 -28.732  -0.079   1.657
    2    HA   VAL  78           HA       VAL  78 -26.088  -0.903   0.749
    3    HB   VAL  78           HB       VAL  78 -27.812  -1.780   3.106
    4   HG11  VAL  78          HG11      VAL  78 -25.506  -3.048   1.957
    5   HG13  VAL  78          HG12      VAL  78 -26.422  -3.519   3.390
    6   HG12  VAL  78          HG13      VAL  78 -25.074  -2.392   3.534
    7   HG22  VAL  78          HG21      VAL  78 -26.317  -0.474   4.461
    8   HG21  VAL  78          HG22      VAL  78 -27.032   0.532   3.202
    9   HG23  VAL  78          HG23      VAL  78 -25.369  -0.034   3.041

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ILE  79           H        ILE  79 -25.600  -2.809  -0.185
    2    HA   ILE  79           HA       ILE  79 -27.700  -4.216  -1.550
    3    HB   ILE  79           HB       ILE  79 -24.723  -4.819  -1.345
    4   HG12  ILE  79          HG12      ILE  79 -26.337  -3.640  -3.612
    5   HG13  ILE  79          HG13      ILE  79 -25.436  -2.671  -2.446
    6   HG22  ILE  79          HG21      ILE  79 -25.859  -5.937  -3.679
    7   HG21  ILE  79          HG22      ILE  79 -26.853  -6.454  -2.316
    8   HG23  ILE  79          HG23      ILE  79 -25.119  -6.775  -2.314
    9   HD13  ILE  79          HD11      ILE  79 -24.030  -2.791  -4.270
   10   HD12  ILE  79          HD12      ILE  79 -24.411  -4.486  -4.575
   11   HD11  ILE  79          HD13      ILE  79 -23.413  -4.042  -3.190

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ASP  80           H        ASP  80 -28.610  -6.126  -0.993
    2    HA   ASP  80           HA       ASP  80 -28.573  -7.066   1.639
    3    HB2  ASP  80           HB2      ASP  80 -30.344  -7.575  -0.004
    4    HB3  ASP  80           HB3      ASP  80 -29.213  -8.597  -0.891

  No H/Q in entry =           4
  In of MODEL   48
    1    H    SER  81           H        SER  81 -27.063  -8.256   2.748
    2    HA   SER  81           HA       SER  81 -24.587  -8.981   1.540
    3    HB2  SER  81           HB2      SER  81 -24.055 -10.054   3.692
    4    HB3  SER  81           HB3      SER  81 -24.718  -8.438   3.932
    5    HG   SER  81           HG       SER  81 -26.005  -9.432   5.223

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU  82           H        LEU  82 -27.347 -11.009   1.838
    2    HA   LEU  82           HA       LEU  82 -25.860 -13.407   1.279
    3    HB2  LEU  82           HB2      LEU  82 -28.783 -12.845   0.843
    4    HB3  LEU  82           HB3      LEU  82 -28.014 -14.424   0.996
    5    HG   LEU  82           HG       LEU  82 -28.306 -12.396   3.192
    6   HD13  LEU  82          HD11      LEU  82 -30.445 -13.387   2.622
    7   HD12  LEU  82          HD12      LEU  82 -29.859 -14.120   4.117
    8   HD11  LEU  82          HD13      LEU  82 -29.729 -14.999   2.592
    9   HD23  LEU  82          HD21      LEU  82 -27.562 -14.472   4.512
   10   HD22  LEU  82          HD22      LEU  82 -26.330 -13.622   3.579
   11   HD21  LEU  82          HD23      LEU  82 -27.035 -15.113   2.954

  No H/Q in entry =          11
  In of MODEL   48
    1    H    LEU  83           H        LEU  83 -27.767 -11.106  -0.602
    2    HA   LEU  83           HA       LEU  83 -27.605 -12.432  -3.093
    3    HB2  LEU  83           HB2      LEU  83 -27.942  -9.526  -2.401
    4    HB3  LEU  83           HB3      LEU  83 -27.993 -10.146  -4.051
    5    HG   LEU  83           HG       LEU  83 -30.031 -10.514  -1.876
    6   HD13  LEU  83          HD11      LEU  83 -30.744  -8.633  -2.911
    7   HD12  LEU  83          HD12      LEU  83 -31.237  -9.715  -4.210
    8   HD11  LEU  83          HD13      LEU  83 -29.682  -8.887  -4.295
    9   HD23  LEU  83          HD21      LEU  83 -30.208 -11.728  -4.618
   10   HD22  LEU  83          HD22      LEU  83 -31.182 -12.075  -3.191
   11   HD21  LEU  83          HD23      LEU  83 -29.507 -12.619  -3.267

  No H/Q in entry =          11
  In of MODEL   48
    1    H    TYR  84           H        TYR  84 -25.590 -10.121  -1.388
    2    HA   TYR  84           HA       TYR  84 -23.722  -9.649  -3.516
    3    HB2  TYR  84           HB2      TYR  84 -24.189  -8.168  -1.488
    4    HB3  TYR  84           HB3      TYR  84 -23.224  -9.314  -0.559
    5    HD1  TYR  84           HD1      TYR  84 -20.842  -9.306  -0.670
    6    HD2  TYR  84           HD2      TYR  84 -23.112  -6.834  -3.310
    7    HE1  TYR  84           HE1      TYR  84 -18.767  -8.150  -1.350
    8    HE2  TYR  84           HE2      TYR  84 -21.044  -5.676  -4.008
    9    HH   TYR  84           HH       TYR  84 -18.827  -5.285  -3.282

  No H/Q in entry =           9
  In of MODEL   48
    1    H    GLY  85           H        GLY  85 -23.523 -11.698  -0.600
    2    HA3  GLY  85           HA2      GLY  85 -20.971 -12.699  -1.103
    3    HA2  GLY  85           HA3      GLY  85 -22.221 -13.528  -0.174

  No H/Q in entry =           3
  In of MODEL   48
    1    H    LYS  86           H        LYS  86 -24.080 -13.825  -2.235
    2    HA   LYS  86           HA       LYS  86 -23.089 -16.206  -3.531
    3    HB2  LYS  86           HB2      LYS  86 -25.703 -14.703  -3.679
    4    HB3  LYS  86           HB3      LYS  86 -25.416 -16.307  -4.352
    5    HG2  LYS  86           HG2      LYS  86 -25.193 -15.702  -1.434
    6    HG3  LYS  86           HG3      LYS  86 -26.691 -16.219  -2.210
    7    HD2  LYS  86           HD2      LYS  86 -25.518 -18.199  -3.107
    8    HD3  LYS  86           HD3      LYS  86 -24.051 -17.692  -2.270
    9    HE2  LYS  86           HE2      LYS  86 -25.197 -17.893  -0.124
   10    HE3  LYS  86           HE3      LYS  86 -26.675 -18.379  -0.953
   11    HZ3  LYS  86           HZ1      LYS  86 -25.534 -20.302  -1.835
   12    HZ2  LYS  86           HZ2      LYS  86 -25.405 -20.288  -0.140
   13    HZ1  LYS  86           HZ3      LYS  86 -24.081 -19.824  -1.095

  No H/Q in entry =          13
  In of MODEL   48
    1    H    VAL  87           H        VAL  87 -23.001 -12.980  -4.379
    2    HA   VAL  87           HA       VAL  87 -22.677 -11.787  -6.304
    3    HB   VAL  87           HB       VAL  87 -21.691 -14.265  -7.726
    4   HG12  VAL  87          HG11      VAL  87 -20.258 -11.644  -7.568
    5   HG11  VAL  87          HG12      VAL  87 -21.735 -11.730  -8.526
    6   HG13  VAL  87          HG13      VAL  87 -20.370 -12.776  -8.914
    7   HG21  VAL  87          HG21      VAL  87 -20.361 -12.943  -5.384
    8   HG23  VAL  87          HG22      VAL  87 -19.454 -13.828  -6.607
    9   HG22  VAL  87          HG23      VAL  87 -20.678 -14.656  -5.646

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ASP  88           H        ASP  88 -25.208 -12.371  -5.954
    2    HA   ASP  88           HA       ASP  88 -26.365 -13.525  -8.365
    3    HB2  ASP  88           HB2      ASP  88 -27.360 -13.779  -6.042
    4    HB3  ASP  88           HB3      ASP  88 -27.772 -12.067  -6.116

  No H/Q in entry =           4
  In of MODEL   48
    1    H    GLY  89           H        GLY  89 -25.634 -12.262  -9.991
    2    HA3  GLY  89           HA2      GLY  89 -25.750  -9.484 -10.151
    3    HA2  GLY  89           HA3      GLY  89 -25.757 -10.585 -11.528

  No H/Q in entry =           3
  In of MODEL   48
    1    H    LEU  90           H        LEU  90 -28.234 -11.883 -11.091
    2    HA   LEU  90           HA       LEU  90 -30.000  -9.890 -12.171
    3    HB2  LEU  90           HB2      LEU  90 -30.125 -12.275 -12.784
    4    HB3  LEU  90           HB3      LEU  90 -30.635 -12.652 -11.139
    5    HG   LEU  90           HG       LEU  90 -32.727 -11.480 -11.479
    6   HD13  LEU  90          HD11      LEU  90 -32.510  -9.722 -12.931
    7   HD12  LEU  90          HD12      LEU  90 -33.082 -10.931 -14.083
    8   HD11  LEU  90          HD13      LEU  90 -31.359 -10.580 -13.960
    9   HD23  LEU  90          HD21      LEU  90 -32.704 -13.076 -13.938
   10   HD22  LEU  90          HD22      LEU  90 -33.683 -13.238 -12.480
   11   HD21  LEU  90          HD23      LEU  90 -32.044 -13.889 -12.518

  No H/Q in entry =          11
  In of MODEL   48
    1    H    GLY  91           H        GLY  91 -29.859 -11.440  -9.009
    2    HA3  GLY  91           HA2      GLY  91 -32.167 -10.286  -7.946
    3    HA2  GLY  91           HA3      GLY  91 -30.786 -10.866  -7.015

  No H/Q in entry =           3
  In of MODEL   48
    1    H    VAL  92           H        VAL  92 -28.826  -9.073  -7.853
    2    HA   VAL  92           HA       VAL  92 -29.557  -6.776  -6.269
    3    HB   VAL  92           HB       VAL  92 -27.028  -7.283  -7.880
    4   HG12  VAL  92          HG11      VAL  92 -27.140  -5.427  -5.526
    5   HG11  VAL  92          HG12      VAL  92 -27.798  -4.847  -7.058
    6   HG13  VAL  92          HG13      VAL  92 -26.113  -5.357  -6.958
    7   HG22  VAL  92          HG21      VAL  92 -26.838  -8.898  -6.310
    8   HG21  VAL  92          HG22      VAL  92 -27.961  -8.106  -5.202
    9   HG23  VAL  92          HG23      VAL  92 -26.294  -7.544  -5.321

  No H/Q in entry =           9
  In of MODEL   48
    1    H    LEU  93           H        LEU  93 -29.177  -7.399  -9.700
    2    HA   LEU  93           HA       LEU  93 -29.463  -4.743 -10.592
    3    HB2  LEU  93           HB2      LEU  93 -28.870  -6.592 -12.080
    4    HB3  LEU  93           HB3      LEU  93 -30.478  -7.285 -11.862
    5    HG   LEU  93           HG       LEU  93 -31.446  -5.283 -12.955
    6   HD11  LEU  93          HD11      LEU  93 -29.556  -3.738 -12.436
    7   HD13  LEU  93          HD12      LEU  93 -30.002  -3.734 -14.143
    8   HD12  LEU  93          HD13      LEU  93 -28.569  -4.610 -13.609
    9   HD23  LEU  93          HD21      LEU  93 -30.428  -5.842 -15.254
   10   HD22  LEU  93          HD22      LEU  93 -31.297  -7.090 -14.363
   11   HD21  LEU  93          HD23      LEU  93 -29.532  -7.077 -14.370

  No H/Q in entry =          11
  In of MODEL   48
    1    H    LYS  94           H        LYS  94 -31.895  -7.244  -9.769
    2    HA   LYS  94           HA       LYS  94 -34.207  -5.739 -10.364
    3    HB2  LYS  94           HB2      LYS  94 -33.737  -7.963  -8.385
    4    HB3  LYS  94           HB3      LYS  94 -35.319  -7.227  -8.637
    5    HG2  LYS  94           HG2      LYS  94 -35.259  -7.971 -10.983
    6    HG3  LYS  94           HG3      LYS  94 -33.716  -8.763 -10.671
    7    HD2  LYS  94           HD2      LYS  94 -34.861 -10.096  -8.860
    8    HD3  LYS  94           HD3      LYS  94 -36.391  -9.404  -9.401
    9    HE2  LYS  94           HE2      LYS  94 -35.904 -10.313 -11.682
   10    HE3  LYS  94           HE3      LYS  94 -34.506 -11.140 -10.995
   11    HZ3  LYS  94           HZ1      LYS  94 -36.392 -12.614 -11.180
   12    HZ2  LYS  94           HZ2      LYS  94 -37.339 -11.579 -10.220
   13    HZ1  LYS  94           HZ3      LYS  94 -35.994 -12.369  -9.547

  No H/Q in entry =          13
  In of MODEL   48
    1    H    ALA  95           H        ALA  95 -32.376  -5.945  -7.325
    2    HA   ALA  95           HA       ALA  95 -34.182  -4.344  -5.816
    3    HB2  ALA  95           HB1      ALA  95 -31.838  -5.782  -5.308
    4    HB3  ALA  95           HB2      ALA  95 -32.791  -4.870  -4.138
    5    HB1  ALA  95           HB3      ALA  95 -31.428  -4.104  -4.953

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA  96           H        ALA  96 -31.529  -3.523  -7.912
    2    HA   ALA  96           HA       ALA  96 -31.363  -0.776  -7.099
    3    HB2  ALA  96           HB1      ALA  96 -30.004  -0.552  -9.210
    4    HB3  ALA  96           HB2      ALA  96 -30.349  -2.247  -9.552
    5    HB1  ALA  96           HB3      ALA  96 -29.419  -1.809  -8.120

  No H/Q in entry =           5
  In of MODEL   48
    1    H    VAL  97           H        VAL  97 -32.945  -2.414  -9.803
    2    HA   VAL  97           HA       VAL  97 -33.964  -0.071 -11.023
    3    HB   VAL  97           HB       VAL  97 -34.844  -2.975 -11.103
    4   HG11  VAL  97          HG11      VAL  97 -36.588  -0.919 -11.553
    5   HG13  VAL  97          HG12      VAL  97 -36.689  -2.499 -12.332
    6   HG12  VAL  97          HG13      VAL  97 -35.906  -1.157 -13.163
    7   HG21  VAL  97          HG21      VAL  97 -33.527  -1.151 -13.117
    8   HG23  VAL  97          HG22      VAL  97 -34.023  -2.815 -13.428
    9   HG22  VAL  97          HG23      VAL  97 -32.761  -2.475 -12.242

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ALA  98           H        ALA  98 -35.191  -2.257  -8.513
    2    HA   ALA  98           HA       ALA  98 -37.721  -1.050  -8.135
    3    HB1  ALA  98           HB1      ALA  98 -36.759  -3.287  -7.138
    4    HB3  ALA  98           HB2      ALA  98 -37.913  -2.348  -6.189
    5    HB2  ALA  98           HB3      ALA  98 -36.188  -2.248  -5.834

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA  99           H        ALA  99 -34.617  -0.353  -6.489
    2    HA   ALA  99           HA       ALA  99 -35.688   1.634  -4.794
    3    HB1  ALA  99           HB1      ALA  99 -33.067   0.688  -5.565
    4    HB2  ALA  99           HB2      ALA  99 -33.592   1.430  -4.053
    5    HB3  ALA  99           HB3      ALA  99 -33.096   2.445  -5.407

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ILE 100           H        ILE 100 -34.657   1.788  -8.151
    2    HA   ILE 100           HA       ILE 100 -34.762   4.643  -8.328
    3    HB   ILE 100           HB       ILE 100 -34.921   2.524 -10.498
    4   HG12  ILE 100          HG12      ILE 100 -32.704   4.448  -9.806
    5   HG13  ILE 100          HG13      ILE 100 -32.781   2.793  -9.200
    6   HG21  ILE 100          HG21      ILE 100 -35.267   5.455 -10.584
    7   HG23  ILE 100          HG22      ILE 100 -35.811   4.217 -11.716
    8   HG22  ILE 100          HG23      ILE 100 -34.143   4.790 -11.768
    9   HD12  ILE 100          HD11      ILE 100 -32.234   3.778 -11.962
   10   HD11  ILE 100          HD12      ILE 100 -32.936   2.177 -11.728
   11   HD13  ILE 100          HD13      ILE 100 -31.376   2.569 -11.008

  No H/Q in entry =          11
  In of MODEL   48
    1    H    LYS 101           H        LYS 101 -37.126   2.106  -9.084
    2    HA   LYS 101           HA       LYS 101 -39.167   3.825 -10.050
    3    HB2  LYS 101           HB2      LYS 101 -39.120   1.032  -8.964
    4    HB3  LYS 101           HB3      LYS 101 -40.653   1.839  -9.293
    5    HG2  LYS 101           HG2      LYS 101 -40.183   1.996 -11.589
    6    HG3  LYS 101           HG3      LYS 101 -38.498   1.542 -11.348
    7    HD2  LYS 101           HD2      LYS 101 -39.801  -0.319 -12.257
    8    HD3  LYS 101           HD3      LYS 101 -39.178  -0.690 -10.650
    9    HE2  LYS 101           HE2      LYS 101 -41.257  -1.338 -10.146
   10    HE3  LYS 101           HE3      LYS 101 -41.667   0.379 -10.122
   11    HZ3  LYS 101           HZ1      LYS 101 -42.571   0.278 -12.238
   12    HZ2  LYS 101           HZ2      LYS 101 -43.068  -1.193 -11.551
   13    HZ1  LYS 101           HZ3      LYS 101 -41.765  -1.164 -12.638

  No H/Q in entry =          13
  In of MODEL   48
    1    H    LYS 102           H        LYS 102 -38.703   2.286  -6.866
    2    HA   LYS 102           HA       LYS 102 -40.914   3.522  -5.642
    3    HB2  LYS 102           HB2      LYS 102 -39.725   1.607  -4.660
    4    HB3  LYS 102           HB3      LYS 102 -38.305   2.622  -4.406
    5    HG2  LYS 102           HG2      LYS 102 -39.579   4.028  -2.883
    6    HG3  LYS 102           HG3      LYS 102 -41.001   3.018  -3.139
    7    HD2  LYS 102           HD2      LYS 102 -39.822   1.104  -2.147
    8    HD3  LYS 102           HD3      LYS 102 -38.400   2.116  -1.888
    9    HE2  LYS 102           HE2      LYS 102 -39.710   3.607  -0.452
   10    HE3  LYS 102           HE3      LYS 102 -41.148   2.628  -0.730
   11    HZ1  LYS 102           HZ1      LYS 102 -39.472   0.813   0.240
   12    HZ3  LYS 102           HZ2      LYS 102 -40.555   1.713   1.188
   13    HZ2  LYS 102           HZ3      LYS 102 -38.932   2.196   1.062

  No H/Q in entry =          13
  In of MODEL   48
    1    H    ALA 103           H        ALA 103 -37.927   4.850  -6.643
    2    HA   ALA 103           HA       ALA 103 -38.082   7.141  -4.825
    3    HB2  ALA 103           HB1      ALA 103 -36.077   7.848  -6.396
    4    HB3  ALA 103           HB2      ALA 103 -36.089   6.135  -6.821
    5    HB1  ALA 103           HB3      ALA 103 -35.843   6.627  -5.146

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA 104           H        ALA 104 -38.733   6.479  -8.180
    2    HA   ALA 104           HA       ALA 104 -39.246   9.288  -8.757
    3    HB2  ALA 104           HB1      ALA 104 -39.314   8.657 -10.969
    4    HB1  ALA 104           HB2      ALA 104 -40.081   7.108 -10.613
    5    HB3  ALA 104           HB3      ALA 104 -38.352   7.322 -10.336

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA 105           H        ALA 105 -40.905   7.199  -6.979
    2    HA   ALA 105           HA       ALA 105 -43.291   8.656  -6.923
    3    HB2  ALA 105           HB1      ALA 105 -44.065   7.849  -8.971
    4    HB3  ALA 105           HB2      ALA 105 -44.729   6.660  -7.851
    5    HB1  ALA 105           HB3      ALA 105 -43.271   6.286  -8.771

  No H/Q in entry =           5
  In of MODEL   49
    1    H1   ALA   1           H3       ALA   1 -12.174 -16.000  -2.452
    2    H2   ALA   1           H2       ALA   1 -11.221 -17.140  -3.282
    3    H3   ALA   1           H1       ALA   1 -12.366 -16.207  -4.126
    4    HA   ALA   1           HA       ALA   1 -13.755 -17.916  -3.886
    5    HB3  ALA   1           HB1      ALA   1 -12.350 -19.676  -3.407
    6    HB1  ALA   1           HB2      ALA   1 -13.115 -19.560  -1.823
    7    HB2  ALA   1           HB3      ALA   1 -11.543 -18.811  -2.099

  No H/Q in entry =           7
  In of MODEL   49
    1    H    GLU   2           H        GLU   2 -15.381 -18.773  -2.236
    2    HA   GLU   2           HA       GLU   2 -17.046 -17.058  -1.194
    3    HB2  GLU   2           HB2      GLU   2 -16.099 -19.470   0.368
    4    HB3  GLU   2           HB3      GLU   2 -17.630 -18.629   0.609
    5    HG2  GLU   2           HG2      GLU   2 -18.593 -19.730  -1.125
    6    HG3  GLU   2           HG3      GLU   2 -17.267 -19.326  -2.204

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLU   3           H        GLU   3 -15.139 -18.386   1.446
    2    HA   GLU   3           HA       GLU   3 -15.384 -16.026   2.990
    3    HB2  GLU   3           HB2      GLU   3 -13.783 -18.561   3.262
    4    HB3  GLU   3           HB3      GLU   3 -13.567 -17.235   4.403
    5    HG2  GLU   3           HG2      GLU   3 -15.763 -17.397   5.211
    6    HG3  GLU   3           HG3      GLU   3 -16.345 -18.208   3.763

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LEU   4           H        LEU   4 -12.412 -17.492   1.622
    2    HA   LEU   4           HA       LEU   4 -10.594 -15.574   2.221
    3    HB2  LEU   4           HB2      LEU   4 -10.801 -16.886  -0.499
    4    HB3  LEU   4           HB3      LEU   4  -9.358 -16.153   0.191
    5    HG   LEU   4           HG       LEU   4 -10.842 -18.555   1.307
    6   HD13  LEU   4          HD11      LEU   4  -9.196 -19.904   0.393
    7   HD12  LEU   4          HD12      LEU   4  -7.994 -18.613   0.367
    8   HD11  LEU   4          HD13      LEU   4  -9.276 -18.650  -0.843
    9   HD23  LEU   4          HD21      LEU   4  -8.598 -18.597   2.701
   10   HD22  LEU   4          HD22      LEU   4  -9.929 -17.563   3.218
   11   HD21  LEU   4          HD23      LEU   4  -8.566 -16.870   2.340

  No H/Q in entry =          11
  In of MODEL   49
    1    H    GLU   5           H        GLU   5 -12.915 -15.396  -0.467
    2    HA   GLU   5           HA       GLU   5 -11.923 -12.911  -1.474
    3    HB2  GLU   5           HB2      GLU   5 -13.246 -14.503  -2.842
    4    HB3  GLU   5           HB3      GLU   5 -14.654 -14.164  -1.836
    5    HG2  GLU   5           HG2      GLU   5 -14.558 -11.792  -2.471
    6    HG3  GLU   5           HG3      GLU   5 -13.129 -12.106  -3.456

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLU   6           H        GLU   6 -14.653 -13.796   0.607
    2    HA   GLU   6           HA       GLU   6 -15.577 -11.123   0.989
    3    HB2  GLU   6           HB2      GLU   6 -16.995 -13.118   1.389
    4    HB3  GLU   6           HB3      GLU   6 -15.966 -13.557   2.752
    5    HG2  GLU   6           HG2      GLU   6 -16.509 -11.441   3.869
    6    HG3  GLU   6           HG3      GLU   6 -17.505 -10.958   2.499

  No H/Q in entry =           6
  In of MODEL   49
    1    H    VAL   7           H        VAL   7 -13.265 -13.211   2.583
    2    HA   VAL   7           HA       VAL   7 -12.822 -11.622   4.905
    3    HB   VAL   7           HB       VAL   7 -11.097 -13.662   3.475
    4   HG11  VAL   7          HG11      VAL   7 -10.653 -12.113   6.034
    5   HG13  VAL   7          HG12      VAL   7  -9.544 -12.327   4.681
    6   HG12  VAL   7          HG13      VAL   7  -9.895 -13.681   5.755
    7   HG21  VAL   7          HG21      VAL   7 -13.351 -14.234   4.685
    8   HG23  VAL   7          HG22      VAL   7 -12.434 -13.947   6.165
    9   HG22  VAL   7          HG23      VAL   7 -11.927 -15.209   5.044

  No H/Q in entry =           9
  In of MODEL   49
    1    H    VAL   8           H        VAL   8 -11.292 -11.743   1.704
    2    HA   VAL   8           HA       VAL   8  -9.244  -9.854   2.199
    3    HB   VAL   8           HB       VAL   8 -10.689 -10.565  -0.365
    4   HG13  VAL   8          HG11      VAL   8  -9.746  -8.397  -0.711
    5   HG12  VAL   8          HG12      VAL   8  -8.588  -9.533  -1.405
    6   HG11  VAL   8          HG13      VAL   8  -8.279  -8.816   0.176
    7   HG22  VAL   8          HG21      VAL   8  -9.154 -12.272  -0.602
    8   HG21  VAL   8          HG22      VAL   8  -9.002 -12.123   1.146
    9   HG23  VAL   8          HG23      VAL   8  -7.842 -11.318   0.094

  No H/Q in entry =           9
  In of MODEL   49
    1    H    MET   9           H        MET   9 -12.585  -9.492   1.018
    2    HA   MET   9           HA       MET   9 -12.537  -6.717   0.570
    3    HB2  MET   9           HB2      MET   9 -14.741  -8.606   1.391
    4    HB3  MET   9           HB3      MET   9 -15.035  -6.879   1.175
    5    HG2  MET   9           HG2      MET   9 -13.778  -7.283  -1.121
    6    HG3  MET   9           HG3      MET   9 -14.304  -8.948  -0.863
    7    HE3  MET   9           HE1      MET   9 -18.096  -8.351  -0.053
    8    HE2  MET   9           HE2      MET   9 -17.078  -7.414   1.036
    9    HE1  MET   9           HE3      MET   9 -16.598  -9.046   0.581

  No H/Q in entry =           9
  In of MODEL   49
    1    H    GLY  10           H        GLY  10 -13.204  -8.598   3.503
    2    HA3  GLY  10           HA2      GLY  10 -13.777  -6.408   5.208
    3    HA2  GLY  10           HA3      GLY  10 -13.205  -7.991   5.733

  No H/Q in entry =           3
  In of MODEL   49
    1    H    LEU  11           H        LEU  11 -10.751  -8.105   4.433
    2    HA   LEU  11           HA       LEU  11  -9.070  -6.651   6.192
    3    HB2  LEU  11           HB2      LEU  11  -8.499  -8.084   3.595
    4    HB3  LEU  11           HB3      LEU  11  -7.239  -7.366   4.597
    5    HG   LEU  11           HG       LEU  11  -9.233  -9.408   5.612
    6   HD13  LEU  11          HD11      LEU  11  -7.994 -10.644   4.061
    7   HD12  LEU  11          HD12      LEU  11  -7.066 -10.868   5.543
    8   HD11  LEU  11          HD13      LEU  11  -6.527  -9.706   4.332
    9   HD22  LEU  11          HD21      LEU  11  -8.398  -8.379   7.529
   10   HD21  LEU  11          HD22      LEU  11  -6.859  -7.971   6.772
   11   HD23  LEU  11          HD23      LEU  11  -7.176  -9.627   7.288

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  12           H        ILE  12  -9.957  -6.127   2.794
    2    HA   ILE  12           HA       ILE  12  -8.278  -3.888   2.366
    3    HB   ILE  12           HB       ILE  12 -10.920  -4.583   1.059
    4   HG12  ILE  12          HG12      ILE  12  -8.866  -6.219   1.006
    5   HG13  ILE  12          HG13      ILE  12  -9.730  -5.883  -0.481
    6   HG21  ILE  12          HG21      ILE  12  -8.701  -2.686   0.228
    7   HG23  ILE  12          HG22      ILE  12 -10.365  -2.257   0.601
    8   HG22  ILE  12          HG23      ILE  12  -9.993  -3.206  -0.808
    9   HD12  ILE  12          HD11      ILE  12  -7.225  -5.809  -0.685
   10   HD11  ILE  12          HD12      ILE  12  -7.228  -4.433   0.415
   11   HD13  ILE  12          HD13      ILE  12  -8.010  -4.309  -1.143

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  13           H        ILE  13 -11.644  -4.174   3.442
    2    HA   ILE  13           HA       ILE  13 -12.126  -1.389   3.694
    3    HB   ILE  13           HB       ILE  13 -13.319  -3.807   5.071
    4   HG12  ILE  13          HG12      ILE  13 -13.522  -3.274   2.518
    5   HG13  ILE  13          HG13      ILE  13 -14.938  -3.781   3.414
    6   HG23  ILE  13          HG21      ILE  13 -13.712  -1.958   6.560
    7   HG22  ILE  13          HG22      ILE  13 -15.215  -2.238   5.692
    8   HG21  ILE  13          HG23      ILE  13 -14.169  -0.898   5.231
    9   HD13  ILE  13          HD11      ILE  13 -15.700  -1.482   3.636
   10   HD12  ILE  13          HD12      ILE  13 -15.354  -1.817   1.951
   11   HD11  ILE  13          HD13      ILE  13 -14.206  -0.897   2.897

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ASN  14           H        ASN  14 -11.009  -3.859   5.988
    2    HA   ASN  14           HA       ASN  14 -10.834  -2.208   8.266
    3    HB2  ASN  14           HB2      ASN  14 -10.559  -4.815   7.959
    4    HB3  ASN  14           HB3      ASN  14  -8.852  -4.415   7.810
    5   HD21  ASN  14          HD21      ASN  14  -9.489  -5.934   9.990
    6   HD22  ASN  14          HD22      ASN  14  -9.477  -5.006  11.410

  No H/Q in entry =           6
  In of MODEL   49
    1    H    SER  15           H        SER  15  -8.411  -3.025   5.793
    2    HA   SER  15           HA       SER  15  -6.286  -1.509   6.870
    3    HB2  SER  15           HB2      SER  15  -5.250  -1.730   4.721
    4    HB3  SER  15           HB3      SER  15  -6.199  -3.195   4.944
    5    HG   SER  15           HG       SER  15  -7.342  -2.640   3.287

  No H/Q in entry =           5
  In of MODEL   49
    1    H    GLY  16           H        GLY  16  -8.881  -0.676   4.603
    2    HA3  GLY  16           HA2      GLY  16  -8.043   1.969   4.043
    3    HA2  GLY  16           HA3      GLY  16  -9.687   1.359   3.874

  No H/Q in entry =           3
  In of MODEL   49
    1    H    GLN  17           H        GLN  17 -10.239   0.643   6.525
    2    HA   GLN  17           HA       GLN  17 -10.975   3.147   7.648
    3    HB2  GLN  17           HB2      GLN  17 -12.199   1.066   8.143
    4    HB3  GLN  17           HB3      GLN  17 -10.789   0.441   8.999
    5    HG2  GLN  17           HG2      GLN  17 -10.925   2.235  10.635
    6    HG3  GLN  17           HG3      GLN  17 -12.231   3.005   9.734
    7   HE21  GLN  17          HE21      GLN  17 -12.551   2.167  12.472
    8   HE22  GLN  17          HE22      GLN  17 -13.687   0.905  12.500

  No H/Q in entry =           8
  In of MODEL   49
    1    H    ALA  18           H        ALA  18  -8.330   0.893   8.295
    2    HA   ALA  18           HA       ALA  18  -7.257   2.131  10.565
    3    HB2  ALA  18           HB1      ALA  18  -6.619  -0.086   9.213
    4    HB3  ALA  18           HB2      ALA  18  -5.469   0.713  10.287
    5    HB1  ALA  18           HB3      ALA  18  -5.384   0.983   8.545

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ARG  19           H        ARG  19  -6.470   2.644   7.119
    2    HA   ARG  19           HA       ARG  19  -4.594   4.711   7.548
    3    HB2  ARG  19           HB2      ARG  19  -4.897   3.556   5.356
    4    HB3  ARG  19           HB3      ARG  19  -6.446   4.381   5.166
    5    HG2  ARG  19           HG2      ARG  19  -5.339   6.563   5.229
    6    HG3  ARG  19           HG3      ARG  19  -3.784   5.794   5.547
    7    HD2  ARG  19           HD2      ARG  19  -3.901   6.371   3.200
    8    HD3  ARG  19           HD3      ARG  19  -3.970   4.611   3.354
    9    HE   ARG  19           HE       ARG  19  -6.612   5.495   3.326
   10   HH21  ARG  19          HH11      ARG  19  -7.797   5.629   1.400
   11   HH22  ARG  19          HH12      ARG  19  -6.967   5.707  -0.115
   12   HH11  ARG  19          HH21      ARG  19  -3.826   5.574   1.309
   13   HH12  ARG  19          HH22      ARG  19  -4.717   5.673  -0.167

  No H/Q in entry =          13
  In of MODEL   49
    1    H    SER  20           H        SER  20  -8.089   4.789   6.926
    2    HA   SER  20           HA       SER  20  -8.473   7.540   6.861
    3    HB2  SER  20           HB2      SER  20 -10.334   6.181   6.320
    4    HB3  SER  20           HB3      SER  20 -10.225   5.293   7.838
    5    HG   SER  20           HG       SER  20 -11.091   7.936   7.359

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LEU  21           H        LEU  21  -8.469   5.373   9.677
    2    HA   LEU  21           HA       LEU  21  -8.941   7.374  11.628
    3    HB2  LEU  21           HB2      LEU  21  -7.562   4.688  11.811
    4    HB3  LEU  21           HB3      LEU  21  -7.890   5.710  13.207
    5    HG   LEU  21           HG       LEU  21 -10.040   4.784  11.279
    6   HD11  LEU  21          HD11      LEU  21  -9.107   3.587  13.902
    7   HD13  LEU  21          HD12      LEU  21  -9.114   2.810  12.319
    8   HD12  LEU  21          HD13      LEU  21 -10.639   3.178  13.127
    9   HD22  LEU  21          HD21      LEU  21 -10.979   6.586  12.429
   10   HD21  LEU  21          HD22      LEU  21 -10.011   6.320  13.874
   11   HD23  LEU  21          HD23      LEU  21 -11.381   5.275  13.534

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ALA  22           H        ALA  22  -5.966   6.024  10.246
    2    HA   ALA  22           HA       ALA  22  -4.110   7.366  11.872
    3    HB2  ALA  22           HB1      ALA  22  -3.665   5.508  10.194
    4    HB1  ALA  22           HB2      ALA  22  -2.482   6.816  10.229
    5    HB3  ALA  22           HB3      ALA  22  -3.692   6.753   8.946

  No H/Q in entry =           5
  In of MODEL   49
    1    H    TYR  23           H        TYR  23  -5.418   8.352   8.676
    2    HA   TYR  23           HA       TYR  23  -4.108  10.862   8.601
    3    HB2  TYR  23           HB2      TYR  23  -5.167   9.926   6.608
    4    HB3  TYR  23           HB3      TYR  23  -6.752  10.024   7.379
    5    HD1  TYR  23           HD1      TYR  23  -3.860  12.089   6.238
    6    HD2  TYR  23           HD2      TYR  23  -8.012  12.021   7.335
    7    HE1  TYR  23           HE1      TYR  23  -4.103  14.432   5.462
    8    HE2  TYR  23           HE2      TYR  23  -8.255  14.363   6.559
    9    HH   TYR  23           HH       TYR  23  -6.796  16.343   6.206

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ALA  24           H        ALA  24  -7.226   9.859   9.966
    2    HA   ALA  24           HA       ALA  24  -8.095  12.443  10.718
    3    HB1  ALA  24           HB1      ALA  24  -9.903  11.176  11.181
    4    HB2  ALA  24           HB2      ALA  24  -9.080  10.621  12.637
    5    HB3  ALA  24           HB3      ALA  24  -8.936   9.702  11.139

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ALA  25           H        ALA  25  -6.077  10.015  12.318
    2    HA   ALA  25           HA       ALA  25  -5.768  11.285  14.815
    3    HB2  ALA  25           HB1      ALA  25  -4.971   8.937  14.012
    4    HB3  ALA  25           HB2      ALA  25  -3.972   9.812  15.174
    5    HB1  ALA  25           HB3      ALA  25  -3.525   9.790  13.468

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LEU  26           H        LEU  26  -3.961  11.586  11.784
    2    HA   LEU  26           HA       LEU  26  -2.028  13.432  12.703
    3    HB2  LEU  26           HB2      LEU  26  -1.701  12.272  10.607
    4    HB3  LEU  26           HB3      LEU  26  -3.177  12.961   9.939
    5    HG   LEU  26           HG       LEU  26  -2.187  15.222  10.069
    6   HD12  LEU  26          HD11      LEU  26   0.348  15.271  10.499
    7   HD11  LEU  26          HD12      LEU  26   0.137  13.692  11.250
    8   HD13  LEU  26          HD13      LEU  26  -0.690  15.102  11.914
    9   HD21  LEU  26          HD21      LEU  26  -0.414  13.179   8.696
   10   HD23  LEU  26          HD22      LEU  26  -0.473  14.898   8.316
   11   HD22  LEU  26          HD23      LEU  26  -1.884  13.884   8.024

  No H/Q in entry =          11
  In of MODEL   49
    1    H    LYS  27           H        LYS  27  -5.205  13.873  11.203
    2    HA   LYS  27           HA       LYS  27  -5.178  16.661  10.990
    3    HB2  LYS  27           HB2      LYS  27  -6.900  15.161  10.001
    4    HB3  LYS  27           HB3      LYS  27  -7.564  14.906  11.615
    5    HG2  LYS  27           HG2      LYS  27  -8.020  17.309  11.835
    6    HG3  LYS  27           HG3      LYS  27  -7.305  17.605  10.247
    7    HD2  LYS  27           HD2      LYS  27  -9.016  16.147   9.208
    8    HD3  LYS  27           HD3      LYS  27  -9.737  15.869  10.794
    9    HE2  LYS  27           HE2      LYS  27 -10.206  18.276  11.022
   10    HE3  LYS  27           HE3      LYS  27  -9.457  18.577   9.450
   11    HZ3  LYS  27           HZ1      LYS  27 -11.831  18.427   9.194
   12    HZ2  LYS  27           HZ2      LYS  27 -11.869  16.914   9.971
   13    HZ1  LYS  27           HZ3      LYS  27 -11.116  17.077   8.454

  No H/Q in entry =          13
  In of MODEL   49
    1    H    GLN  28           H        GLN  28  -6.062  14.581  13.723
    2    HA   GLN  28           HA       GLN  28  -6.989  16.585  15.482
    3    HB2  GLN  28           HB2      GLN  28  -5.565  13.971  16.048
    4    HB3  GLN  28           HB3      GLN  28  -6.323  14.975  17.285
    5    HG2  GLN  28           HG2      GLN  28  -7.761  13.833  14.873
    6    HG3  GLN  28           HG3      GLN  28  -7.817  13.142  16.494
    7   HE21  GLN  28          HE21      GLN  28  -9.689  14.939  14.514
    8   HE22  GLN  28          HE22      GLN  28 -10.459  15.943  15.645

  No H/Q in entry =           8
  In of MODEL   49
    1    H    ALA  29           H        ALA  29  -3.753  15.316  14.820
    2    HA   ALA  29           HA       ALA  29  -2.341  16.738  16.799
    3    HB1  ALA  29           HB1      ALA  29  -0.397  16.058  15.696
    4    HB3  ALA  29           HB2      ALA  29  -1.143  16.167  14.102
    5    HB2  ALA  29           HB3      ALA  29  -1.559  14.836  15.181

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LYS  30           H        LYS  30  -3.186  17.592  13.460
    2    HA   LYS  30           HA       LYS  30  -1.794  20.042  13.355
    3    HB2  LYS  30           HB2      LYS  30  -4.310  19.141  11.936
    4    HB3  LYS  30           HB3      LYS  30  -3.485  20.660  11.589
    5    HG2  LYS  30           HG2      LYS  30  -1.403  19.380  11.095
    6    HG3  LYS  30           HG3      LYS  30  -2.299  17.879  11.342
    7    HD2  LYS  30           HD2      LYS  30  -3.857  18.498   9.535
    8    HD3  LYS  30           HD3      LYS  30  -2.984  20.012   9.289
    9    HE2  LYS  30           HE2      LYS  30  -0.938  18.731   8.729
   10    HE3  LYS  30           HE3      LYS  30  -1.831  17.222   8.943
   11    HZ2  LYS  30           HZ1      LYS  30  -1.647  18.082   6.598
   12    HZ1  LYS  30           HZ2      LYS  30  -2.702  19.340   7.053
   13    HZ3  LYS  30           HZ3      LYS  30  -3.216  17.720   7.130

  No H/Q in entry =          13
  In of MODEL   49
    1    H    GLN  31           H        GLN  31  -4.897  19.176  14.753
    2    HA   GLN  31           HA       GLN  31  -5.681  21.930  15.186
    3    HB2  GLN  31           HB2      GLN  31  -6.853  19.483  16.515
    4    HB3  GLN  31           HB3      GLN  31  -7.621  21.048  16.257
    5    HG2  GLN  31           HG2      GLN  31  -6.890  20.263  13.675
    6    HG3  GLN  31           HG3      GLN  31  -7.410  18.759  14.427
    7   HE21  GLN  31          HE21      GLN  31  -8.818  20.313  12.309
    8   HE22  GLN  31          HE22      GLN  31 -10.338  20.698  12.956

  No H/Q in entry =           8
  In of MODEL   49
    1    H    GLY  32           H        GLY  32  -3.365  20.024  16.530
    2    HA3  GLY  32           HA2      GLY  32  -1.978  20.504  18.338
    3    HA2  GLY  32           HA3      GLY  32  -3.118  21.742  18.849

  No H/Q in entry =           3
  In of MODEL   49
    1    H    ASP  33           H        ASP  33  -4.518  18.691  18.194
    2    HA   ASP  33           HA       ASP  33  -4.943  18.245  21.074
    3    HB2  ASP  33           HB2      ASP  33  -6.329  17.213  18.593
    4    HB3  ASP  33           HB3      ASP  33  -6.680  16.609  20.210

  No H/Q in entry =           4
  In of MODEL   49
    1    H    PHE  34           H        PHE  34  -2.771  17.409  21.396
    2    HA   PHE  34           HA       PHE  34  -1.750  15.158  20.012
    3    HB2  PHE  34           HB2      PHE  34  -1.155  16.160  22.805
    4    HB3  PHE  34           HB3      PHE  34  -0.214  14.938  21.949
    5    HD1  PHE  34           HD1      PHE  34  -0.410  18.366  22.666
    6    HD2  PHE  34           HD2      PHE  34   0.454  15.652  19.449
    7    HE1  PHE  34           HE1      PHE  34   0.882  20.140  21.511
    8    HE2  PHE  34           HE2      PHE  34   1.741  17.429  18.299
    9    HZ   PHE  34           HZ       PHE  34   1.957  19.669  19.334

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ALA  35           H        ALA  35  -3.808  15.438  22.862
    2    HA   ALA  35           HA       ALA  35  -3.585  12.781  23.772
    3    HB3  ALA  35           HB1      ALA  35  -6.052  13.397  24.612
    4    HB1  ALA  35           HB2      ALA  35  -5.525  15.016  24.152
    5    HB2  ALA  35           HB3      ALA  35  -4.612  14.103  25.353

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ALA  36           H        ALA  36  -6.032  14.274  21.651
    2    HA   ALA  36           HA       ALA  36  -7.431  11.852  21.177
    3    HB1  ALA  36           HB1      ALA  36  -8.889  13.261  20.206
    4    HB3  ALA  36           HB2      ALA  36  -7.712  13.683  18.961
    5    HB2  ALA  36           HB3      ALA  36  -7.750  14.577  20.481

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ALA  37           H        ALA  37  -4.750  13.446  19.516
    2    HA   ALA  37           HA       ALA  37  -4.692  11.800  17.227
    3    HB3  ALA  37           HB1      ALA  37  -2.718  13.530  18.653
    4    HB2  ALA  37           HB2      ALA  37  -3.239  13.575  16.970
    5    HB1  ALA  37           HB3      ALA  37  -2.081  12.354  17.503

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LYS  38           H        LYS  38  -2.951  11.519  20.316
    2    HA   LYS  38           HA       LYS  38  -1.609   9.124  19.846
    3    HB2  LYS  38           HB2      LYS  38  -1.955  10.895  21.982
    4    HB3  LYS  38           HB3      LYS  38  -2.568   9.365  22.602
    5    HG2  LYS  38           HG2      LYS  38  -0.465   8.254  22.083
    6    HG3  LYS  38           HG3      LYS  38   0.140   9.699  21.265
    7    HD2  LYS  38           HD2      LYS  38   0.291  10.928  23.296
    8    HD3  LYS  38           HD3      LYS  38  -0.727   9.776  24.162
    9    HE2  LYS  38           HE2      LYS  38   1.627   9.477  24.796
   10    HE3  LYS  38           HE3      LYS  38   1.036   8.053  23.935
   11    HZ3  LYS  38           HZ1      LYS  38   2.344   8.471  22.160
   12    HZ2  LYS  38           HZ2      LYS  38   3.288   9.310  23.298
   13    HZ1  LYS  38           HZ3      LYS  38   2.209  10.159  22.296

  No H/Q in entry =          13
  In of MODEL   49
    1    H    ALA  39           H        ALA  39  -4.859   9.607  21.228
    2    HA   ALA  39           HA       ALA  39  -5.406   6.887  21.742
    3    HB3  ALA  39           HB1      ALA  39  -7.572   8.816  20.954
    4    HB2  ALA  39           HB2      ALA  39  -6.684   9.055  22.459
    5    HB1  ALA  39           HB3      ALA  39  -7.590   7.564  22.197

  No H/Q in entry =           5
  In of MODEL   49
    1    H    MET  40           H        MET  40  -5.986   8.883  18.883
    2    HA   MET  40           HA       MET  40  -7.443   6.936  17.423
    3    HB2  MET  40           HB2      MET  40  -5.842   9.336  16.516
    4    HB3  MET  40           HB3      MET  40  -6.856   8.366  15.445
    5    HG2  MET  40           HG2      MET  40  -7.913   9.621  17.991
    6    HG3  MET  40           HG3      MET  40  -7.966  10.448  16.436
    7    HE3  MET  40           HE1      MET  40 -10.528   8.804  14.365
    8    HE2  MET  40           HE2      MET  40  -8.775   8.931  14.226
    9    HE1  MET  40           HE3      MET  40  -9.705  10.293  14.848

  No H/Q in entry =           9
  In of MODEL   49
    1    H    MET  41           H        MET  41  -3.957   7.695  17.562
    2    HA   MET  41           HA       MET  41  -3.176   5.935  15.475
    3    HB2  MET  41           HB2      MET  41  -1.578   6.624  17.954
    4    HB3  MET  41           HB3      MET  41  -0.947   5.972  16.445
    5    HG2  MET  41           HG2      MET  41  -2.112   8.143  15.424
    6    HG3  MET  41           HG3      MET  41  -1.889   8.740  17.067
    7    HE2  MET  41           HE1      MET  41   1.040   6.662  17.455
    8    HE1  MET  41           HE2      MET  41   0.238   7.955  18.343
    9    HE3  MET  41           HE3      MET  41   1.864   8.205  17.708

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ASP  42           H        ASP  42  -3.578   5.476  18.961
    2    HA   ASP  42           HA       ASP  42  -2.526   2.890  19.139
    3    HB2  ASP  42           HB2      ASP  42  -3.422   4.652  20.948
    4    HB3  ASP  42           HB3      ASP  42  -4.842   3.617  20.872

  No H/Q in entry =           4
  In of MODEL   49
    1    H    GLN  43           H        GLN  43  -5.864   3.969  18.614
    2    HA   GLN  43           HA       GLN  43  -6.989   1.374  18.424
    3    HB2  GLN  43           HB2      GLN  43  -7.923   4.015  17.278
    4    HB3  GLN  43           HB3      GLN  43  -8.876   2.529  17.257
    5    HG2  GLN  43           HG2      GLN  43  -8.597   2.421  19.767
    6    HG3  GLN  43           HG3      GLN  43  -7.882   4.031  19.692
    7   HE21  GLN  43          HE21      GLN  43 -10.071   4.103  21.179
    8   HE22  GLN  43          HE22      GLN  43 -11.431   4.666  20.337

  No H/Q in entry =           8
  In of MODEL   49
    1    H    SER  44           H        SER  44  -5.650   3.585  16.010
    2    HA   SER  44           HA       SER  44  -6.327   2.086  13.724
    3    HB2  SER  44           HB2      SER  44  -5.089   4.480  14.164
    4    HB3  SER  44           HB3      SER  44  -3.726   3.490  13.647
    5    HG   SER  44           HG       SER  44  -4.834   4.447  11.873

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ARG  45           H        ARG  45  -3.462   2.001  15.822
    2    HA   ARG  45           HA       ARG  45  -1.960   0.051  14.458
    3    HB2  ARG  45           HB2      ARG  45  -1.139   1.486  16.325
    4    HB3  ARG  45           HB3      ARG  45  -2.131   0.554  17.443
    5    HG2  ARG  45           HG2      ARG  45  -0.882  -1.500  16.818
    6    HG3  ARG  45           HG3      ARG  45   0.133  -0.543  15.741
    7    HD2  ARG  45           HD2      ARG  45   0.847   0.852  17.695
    8    HD3  ARG  45           HD3      ARG  45  -0.074  -0.224  18.768
    9    HE   ARG  45           HE       ARG  45   1.645  -1.816  17.205
   10   HH21  ARG  45          HH11      ARG  45   3.545  -2.622  18.057
   11   HH22  ARG  45          HH12      ARG  45   4.305  -1.825  19.389
   12   HH11  ARG  45          HH21      ARG  45   1.917   0.663  19.585
   13   HH12  ARG  45          HH22      ARG  45   3.383   0.037  20.252

  No H/Q in entry =          13
  In of MODEL   49
    1    H    MET  46           H        MET  46  -4.371  -0.273  17.045
    2    HA   MET  46           HA       MET  46  -4.188  -3.070  17.365
    3    HB2  MET  46           HB2      MET  46  -6.373  -1.075  17.943
    4    HB3  MET  46           HB3      MET  46  -6.571  -2.795  18.290
    5    HG2  MET  46           HG2      MET  46  -4.577  -2.764  19.712
    6    HG3  MET  46           HG3      MET  46  -4.301  -1.072  19.328
    7    HE2  MET  46           HE1      MET  46  -7.418  -3.023  21.984
    8    HE1  MET  46           HE2      MET  46  -6.425  -3.727  20.712
    9    HE3  MET  46           HE3      MET  46  -7.922  -2.900  20.294

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ALA  47           H        ALA  47  -6.207  -1.075  15.249
    2    HA   ALA  47           HA       ALA  47  -7.806  -3.141  14.183
    3    HB3  ALA  47           HB1      ALA  47  -8.497  -0.909  13.753
    4    HB1  ALA  47           HB2      ALA  47  -7.994  -1.547  12.187
    5    HB2  ALA  47           HB3      ALA  47  -6.926  -0.468  13.086

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LEU  48           H        LEU  48  -4.689  -1.818  13.145
    2    HA   LEU  48           HA       LEU  48  -4.384  -3.417  10.813
    3    HB2  LEU  48           HB2      LEU  48  -2.345  -2.119  12.628
    4    HB3  LEU  48           HB3      LEU  48  -1.963  -2.845  11.067
    5    HG   LEU  48           HG       LEU  48  -4.000  -0.637  11.434
    6   HD13  LEU  48          HD11      LEU  48  -1.888   0.254  12.109
    7   HD12  LEU  48          HD12      LEU  48  -2.155   0.799  10.453
    8   HD11  LEU  48          HD13      LEU  48  -1.052  -0.541  10.774
    9   HD22  LEU  48          HD21      LEU  48  -4.454  -1.633   9.360
   10   HD21  LEU  48          HD22      LEU  48  -2.767  -2.060   9.077
   11   HD23  LEU  48          HD23      LEU  48  -3.294  -0.385   8.907

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ASN  49           H        ASN  49  -3.358  -3.794  14.167
    2    HA   ASN  49           HA       ASN  49  -1.741  -6.050  13.857
    3    HB2  ASN  49           HB2      ASN  49  -1.787  -4.708  15.899
    4    HB3  ASN  49           HB3      ASN  49  -3.445  -5.197  16.214
    5   HD21  ASN  49          HD21      ASN  49  -1.480  -5.704  18.143
    6   HD22  ASN  49          HD22      ASN  49  -1.186  -7.373  18.225

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLU  50           H        GLU  50  -5.215  -5.789  14.505
    2    HA   GLU  50           HA       GLU  50  -5.715  -8.590  14.623
    3    HB2  GLU  50           HB2      GLU  50  -7.314  -6.907  15.481
    4    HB3  GLU  50           HB3      GLU  50  -7.600  -6.351  13.830
    5    HG2  GLU  50           HG2      GLU  50  -8.451  -8.554  13.196
    6    HG3  GLU  50           HG3      GLU  50  -8.077  -9.189  14.795

  No H/Q in entry =           6
  In of MODEL   49
    1    H    ALA  51           H        ALA  51  -5.778  -6.204  12.016
    2    HA   ALA  51           HA       ALA  51  -6.743  -7.944   9.995
    3    HB2  ALA  51           HB1      ALA  51  -6.522  -6.137   8.620
    4    HB1  ALA  51           HB2      ALA  51  -4.887  -5.778   9.177
    5    HB3  ALA  51           HB3      ALA  51  -6.279  -5.269  10.135

  No H/Q in entry =           5
  In of MODEL   49
    1    H    HIS  52           H        HIS  52  -3.462  -7.020  10.996
    2    HA   HIS  52           HA       HIS  52  -2.045  -8.512   9.062
    3    HB2  HIS  52           HB2      HIS  52  -1.043  -6.761  10.522
    4    HB3  HIS  52           HB3      HIS  52  -1.187  -7.861  11.892
    5    HD1  HIS  52           HD1      HIS  52   0.242 -10.103  11.760
    6    HD2  HIS  52           HD2      HIS  52   1.143  -7.265   8.842
    7    HE1  HIS  52           HE1      HIS  52   2.466 -10.788  10.757
    8    HE2  HIS  52           HE2      HIS  52   3.028  -9.067   8.977

  No H/Q in entry =           8
  In of MODEL   49
    1    H    LEU  53           H        LEU  53  -3.274  -9.380  12.270
    2    HA   LEU  53           HA       LEU  53  -2.069 -11.919  12.482
    3    HB2  LEU  53           HB2      LEU  53  -4.562 -10.737  13.677
    4    HB3  LEU  53           HB3      LEU  53  -4.108 -12.413  13.975
    5    HG   LEU  53           HG       LEU  53  -2.207 -10.097  14.460
    6   HD11  LEU  53          HD11      LEU  53  -4.137 -11.453  16.365
    7   HD13  LEU  53          HD12      LEU  53  -4.131  -9.754  15.894
    8   HD12  LEU  53          HD13      LEU  53  -2.821 -10.401  16.874
    9   HD21  LEU  53          HD21      LEU  53  -2.251 -13.034  15.186
   10   HD23  LEU  53          HD22      LEU  53  -1.316 -11.884  16.136
   11   HD22  LEU  53          HD23      LEU  53  -0.944 -12.122  14.439

  No H/Q in entry =          11
  In of MODEL   49
    1    H    VAL  54           H        VAL  54  -5.174 -10.906  11.096
    2    HA   VAL  54           HA       VAL  54  -6.076 -13.506  10.414
    3    HB   VAL  54           HB       VAL  54  -6.724 -10.779   9.264
    4   HG12  VAL  54          HG11      VAL  54  -8.816 -12.167   8.444
    5   HG11  VAL  54          HG12      VAL  54  -7.701 -13.529   8.529
    6   HG13  VAL  54          HG13      VAL  54  -7.339 -12.158   7.484
    7   HG22  VAL  54          HG21      VAL  54  -7.644 -10.811  11.409
    8   HG21  VAL  54          HG22      VAL  54  -7.893 -12.555  11.396
    9   HG23  VAL  54          HG23      VAL  54  -8.972 -11.505  10.478

  No H/Q in entry =           9
  In of MODEL   49
    1    H    GLN  55           H        GLN  55  -4.200 -11.056   8.626
    2    HA   GLN  55           HA       GLN  55  -4.050 -12.530   6.216
    3    HB2  GLN  55           HB2      GLN  55  -3.451 -10.265   6.020
    4    HB3  GLN  55           HB3      GLN  55  -2.349 -10.333   7.393
    5    HG2  GLN  55           HG2      GLN  55  -0.621 -11.179   6.131
    6    HG3  GLN  55           HG3      GLN  55  -1.686 -12.162   5.135
    7   HE21  GLN  55          HE21      GLN  55  -1.691 -11.481   3.010
    8   HE22  GLN  55          HE22      GLN  55  -1.494  -9.878   2.495

  No H/Q in entry =           8
  In of MODEL   49
    1    H    THR  56           H        THR  56  -1.963 -12.492   9.110
    2    HA   THR  56           HA       THR  56   0.125 -14.089   8.213
    3    HB   THR  56           HB       THR  56  -1.189 -14.117  10.944
    4    HG1  THR  56           HG1      THR  56   1.144 -12.782  10.063
    5   HG21  THR  56          HG21      THR  56   1.471 -15.169   9.956
    6   HG23  THR  56          HG22      THR  56   0.178 -16.084  10.732
    7   HG22  THR  56          HG23      THR  56   1.105 -14.905  11.660

  No H/Q in entry =           7
  In of MODEL   49
    1    H    LYS  57           H        LYS  57  -3.001 -15.127   9.560
    2    HA   LYS  57           HA       LYS  57  -2.547 -17.923   9.329
    3    HB2  LYS  57           HB2      LYS  57  -4.376 -16.830  10.658
    4    HB3  LYS  57           HB3      LYS  57  -5.160 -16.390   9.148
    5    HG2  LYS  57           HG2      LYS  57  -5.372 -18.765   8.546
    6    HG3  LYS  57           HG3      LYS  57  -4.571 -19.225  10.046
    7    HD2  LYS  57           HD2      LYS  57  -7.149 -17.631   9.937
    8    HD3  LYS  57           HD3      LYS  57  -7.084 -19.380  10.152
    9    HE2  LYS  57           HE2      LYS  57  -7.051 -18.834  12.378
   10    HE3  LYS  57           HE3      LYS  57  -5.330 -18.590  12.093
   11    HZ3  LYS  57           HZ1      LYS  57  -5.532 -16.372  12.213
   12    HZ2  LYS  57           HZ2      LYS  57  -6.934 -16.734  13.102
   13    HZ1  LYS  57           HZ3      LYS  57  -7.049 -16.345  11.452

  No H/Q in entry =          13
  In of MODEL   49
    1    H    LEU  58           H        LEU  58  -3.870 -15.493   7.134
    2    HA   LEU  58           HA       LEU  58  -4.655 -17.328   5.131
    3    HB2  LEU  58           HB2      LEU  58  -4.054 -14.379   4.987
    4    HB3  LEU  58           HB3      LEU  58  -4.706 -15.323   3.646
    5    HG   LEU  58           HG       LEU  58  -6.004 -15.134   6.385
    6   HD11  LEU  58          HD11      LEU  58  -6.292 -13.499   3.884
    7   HD13  LEU  58          HD12      LEU  58  -6.294 -12.984   5.571
    8   HD12  LEU  58          HD13      LEU  58  -7.710 -13.783   4.893
    9   HD22  LEU  58          HD21      LEU  58  -6.957 -17.049   5.517
   10   HD21  LEU  58          HD22      LEU  58  -6.608 -16.604   3.847
   11   HD23  LEU  58          HD23      LEU  58  -7.978 -15.877   4.686

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  59           H        ILE  59  -1.528 -16.107   6.007
    2    HA   ILE  59           HA       ILE  59  -0.411 -16.844   3.381
    3    HB   ILE  59           HB       ILE  59   0.343 -14.770   4.950
    4   HG12  ILE  59          HG12      ILE  59   2.447 -16.418   3.533
    5   HG13  ILE  59          HG13      ILE  59   1.252 -15.487   2.668
    6   HG23  ILE  59          HG21      ILE  59   2.183 -15.247   6.349
    7   HG22  ILE  59          HG22      ILE  59   2.432 -16.833   5.654
    8   HG21  ILE  59          HG23      ILE  59   1.066 -16.536   6.728
    9   HD11  ILE  59          HD11      ILE  59   1.977 -13.451   3.929
   10   HD13  ILE  59          HD12      ILE  59   3.241 -14.124   2.901
   11   HD12  ILE  59          HD13      ILE  59   3.269 -14.416   4.641

  No H/Q in entry =          11
  In of MODEL   49
    1    H    GLU  60           H        GLU  60  -0.442 -17.935   6.754
    2    HA   GLU  60           HA       GLU  60   1.595 -19.910   6.512
    3    HB2  GLU  60           HB2      GLU  60   0.790 -19.099   8.690
    4    HB3  GLU  60           HB3      GLU  60  -0.790 -19.814   8.379
    5    HG2  GLU  60           HG2      GLU  60   0.246 -22.057   8.262
    6    HG3  GLU  60           HG3      GLU  60   1.824 -21.339   8.580

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLY  61           H        GLY  61  -1.912 -20.017   6.002
    2    HA3  GLY  61           HA2      GLY  61  -1.652 -22.814   5.058
    3    HA2  GLY  61           HA3      GLY  61  -3.143 -22.078   5.638

  No H/Q in entry =           3
  In of MODEL   49
    1    H    ASP  62           H        ASP  62  -0.900 -20.508   3.442
    2    HA   ASP  62           HA       ASP  62  -2.459 -19.366   1.659
    3    HB2  ASP  62           HB2      ASP  62  -0.798 -19.844  -0.100
    4    HB3  ASP  62           HB3      ASP  62  -0.026 -19.447   1.433

  No H/Q in entry =           4
  In of MODEL   49
    1    H    ALA  63           H        ALA  63  -4.388 -19.974   0.800
    2    HA   ALA  63           HA       ALA  63  -5.105 -22.696   0.265
    3    HB2  ALA  63           HB1      ALA  63  -7.088 -21.706  -0.835
    4    HB1  ALA  63           HB2      ALA  63  -6.370 -20.109  -0.633
    5    HB3  ALA  63           HB3      ALA  63  -6.813 -21.062   0.785

  No H/Q in entry =           5
  In of MODEL   49
    1    H    GLY  64           H        GLY  64  -5.277 -23.750  -1.716
    2    HA3  GLY  64           HA2      GLY  64  -5.207 -23.517  -4.206
    3    HA2  GLY  64           HA3      GLY  64  -3.782 -22.524  -3.955

  No H/Q in entry =           3
  In of MODEL   49
    1    H    GLU  65           H        GLU  65  -3.363 -24.502  -5.652
    2    HA   GLU  65           HA       GLU  65  -2.902 -27.064  -4.961
    3    HB2  GLU  65           HB2      GLU  65  -1.090 -25.263  -6.563
    4    HB3  GLU  65           HB3      GLU  65  -0.889 -27.014  -6.467
    5    HG2  GLU  65           HG2      GLU  65  -3.141 -27.354  -7.355
    6    HG3  GLU  65           HG3      GLU  65  -3.418 -25.614  -7.379

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLY  66           H        GLY  66  -1.064 -28.277  -4.368
    2    HA3  GLY  66           HA2      GLY  66  -0.001 -27.657  -1.849
    3    HA2  GLY  66           HA3      GLY  66   0.508 -28.977  -2.884

  No H/Q in entry =           3
  In of MODEL   49
    1    H    LYS  67           H        LYS  67   1.360 -27.289  -5.054
    2    HA   LYS  67           HA       LYS  67   4.046 -26.924  -4.336
    3    HB2  LYS  67           HB2      LYS  67   2.488 -26.016  -6.753
    4    HB3  LYS  67           HB3      LYS  67   4.248 -25.916  -6.614
    5    HG2  LYS  67           HG2      LYS  67   4.364 -28.341  -6.192
    6    HG3  LYS  67           HG3      LYS  67   2.610 -28.453  -6.317
    7    HD2  LYS  67           HD2      LYS  67   2.727 -27.668  -8.656
    8    HD3  LYS  67           HD3      LYS  67   4.485 -27.574  -8.530
    9    HE2  LYS  67           HE2      LYS  67   4.588 -29.988  -8.037
   10    HE3  LYS  67           HE3      LYS  67   2.832 -30.087  -8.154
   11    HZ1  LYS  67           HZ1      LYS  67   3.011 -29.296 -10.454
   12    HZ3  LYS  67           HZ2      LYS  67   3.821 -30.770 -10.216
   13    HZ2  LYS  67           HZ3      LYS  67   4.701 -29.321 -10.328

  No H/Q in entry =          13
  In of MODEL   49
    1    H    MET  68           H        MET  68   4.729 -24.605  -5.740
    2    HA   MET  68           HA       MET  68   4.931 -22.716  -3.678
    3    HB2  MET  68           HB2      MET  68   5.505 -22.692  -6.616
    4    HB3  MET  68           HB3      MET  68   5.666 -21.214  -5.667
    5    HG2  MET  68           HG2      MET  68   7.818 -22.296  -5.665
    6    HG3  MET  68           HG3      MET  68   7.122 -22.517  -4.059
    7    HE1  MET  68           HE1      MET  68   9.344 -24.253  -4.410
    8    HE3  MET  68           HE2      MET  68   8.748 -25.884  -4.106
    9    HE2  MET  68           HE3      MET  68   8.157 -24.540  -3.131

  No H/Q in entry =           9
  In of MODEL   49
    1    H    LYS  69           H        LYS  69   2.641 -22.900  -6.372
    2    HA   LYS  69           HA       LYS  69   1.660 -20.317  -6.344
    3    HB2  LYS  69           HB2      LYS  69   1.114 -21.990  -8.057
    4    HB3  LYS  69           HB3      LYS  69   0.024 -22.778  -6.910
    5    HG2  LYS  69           HG2      LYS  69  -1.287 -20.730  -6.691
    6    HG3  LYS  69           HG3      LYS  69  -0.175 -19.876  -7.760
    7    HD2  LYS  69           HD2      LYS  69  -0.748 -21.434  -9.593
    8    HD3  LYS  69           HD3      LYS  69  -1.883 -22.261  -8.523
    9    HE2  LYS  69           HE2      LYS  69  -3.167 -20.178  -8.252
   10    HE3  LYS  69           HE3      LYS  69  -2.023 -19.332  -9.294
   11    HZ3  LYS  69           HZ1      LYS  69  -3.601 -19.899 -10.807
   12    HZ2  LYS  69           HZ2      LYS  69  -4.059 -21.315  -9.987
   13    HZ1  LYS  69           HZ3      LYS  69  -2.630 -21.287 -10.907

  No H/Q in entry =          13
  In of MODEL   49
    1    H    VAL  70           H        VAL  70   0.205 -19.118  -5.265
    2    HA   VAL  70           HA       VAL  70  -1.269 -20.358  -3.012
    3    HB   VAL  70           HB       VAL  70  -0.822 -18.258  -1.725
    4   HG12  VAL  70          HG11      VAL  70   1.843 -19.385  -2.518
    5   HG11  VAL  70          HG12      VAL  70   0.649 -20.441  -1.764
    6   HG13  VAL  70          HG13      VAL  70   1.226 -19.010  -0.909
    7   HG23  VAL  70          HG21      VAL  70   1.307 -16.999  -2.686
    8   HG22  VAL  70          HG22      VAL  70  -0.303 -16.574  -3.261
    9   HG21  VAL  70          HG23      VAL  70   0.727 -17.623  -4.231

  No H/Q in entry =           9
  In of MODEL   49
    1    H    SER  71           H        SER  71  -2.908 -18.662  -2.166
    2    HA   SER  71           HA       SER  71  -4.828 -18.125  -4.157
    3    HB2  SER  71           HB2      SER  71  -5.353 -18.339  -1.720
    4    HB3  SER  71           HB3      SER  71  -4.541 -16.804  -1.433
    5    HG   SER  71           HG       SER  71  -6.731 -17.199  -3.202

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LEU  72           H        LEU  72  -5.123 -16.437  -5.499
    2    HA   LEU  72           HA       LEU  72  -3.017 -14.621  -5.975
    3    HB2  LEU  72           HB2      LEU  72  -5.877 -14.682  -6.936
    4    HB3  LEU  72           HB3      LEU  72  -4.676 -13.529  -7.512
    5    HG   LEU  72           HG       LEU  72  -4.272 -16.537  -7.623
    6   HD13  LEU  72          HD11      LEU  72  -4.933 -16.437  -9.953
    7   HD12  LEU  72          HD12      LEU  72  -5.138 -14.687  -9.863
    8   HD11  LEU  72          HD13      LEU  72  -6.237 -15.751  -8.985
    9   HD22  LEU  72          HD21      LEU  72  -2.153 -15.555  -7.870
   10   HD21  LEU  72          HD22      LEU  72  -2.783 -14.132  -8.682
   11   HD23  LEU  72          HD23      LEU  72  -2.695 -15.667  -9.541

  No H/Q in entry =          11
  In of MODEL   49
    1    H    VAL  73           H        VAL  73  -6.121 -14.267  -4.364
    2    HA   VAL  73           HA       VAL  73  -6.176 -11.494  -4.024
    3    HB   VAL  73           HB       VAL  73  -7.889 -11.858  -2.424
    4   HG13  VAL  73          HG11      VAL  73  -9.358 -13.270  -3.645
    5   HG12  VAL  73          HG12      VAL  73  -8.035 -14.288  -4.212
    6   HG11  VAL  73          HG13      VAL  73  -8.223 -12.652  -4.847
    7   HG22  VAL  73          HG21      VAL  73  -7.066 -13.329  -0.818
    8   HG21  VAL  73          HG22      VAL  73  -6.460 -14.465  -2.023
    9   HG23  VAL  73          HG23      VAL  73  -8.188 -14.379  -1.683

  No H/Q in entry =           9
  In of MODEL   49
    1    H    LEU  74           H        LEU  74  -4.241 -13.851  -2.421
    2    HA   LEU  74           HA       LEU  74  -3.847 -12.699   0.100
    3    HB2  LEU  74           HB2      LEU  74  -3.052 -14.915  -0.377
    4    HB3  LEU  74           HB3      LEU  74  -2.002 -14.312  -1.658
    5    HG   LEU  74           HG       LEU  74  -0.699 -13.036   0.015
    6   HD11  LEU  74          HD11      LEU  74  -2.766 -14.229   1.866
    7   HD13  LEU  74          HD12      LEU  74  -2.248 -12.546   1.745
    8   HD12  LEU  74          HD13      LEU  74  -1.175 -13.752   2.458
    9   HD21  LEU  74          HD21      LEU  74  -0.489 -15.607  -0.584
   10   HD23  LEU  74          HD22      LEU  74  -0.901 -15.771   1.109
   11   HD22  LEU  74          HD23      LEU  74   0.528 -14.872   0.654

  No H/Q in entry =          11
  In of MODEL   49
    1    H    VAL  75           H        VAL  75  -1.941 -12.310  -2.848
    2    HA   VAL  75           HA       VAL  75  -0.155 -10.377  -1.834
    3    HB   VAL  75           HB       VAL  75  -1.092 -10.884  -4.660
    4   HG13  VAL  75          HG11      VAL  75  -0.257  -8.572  -4.476
    5   HG12  VAL  75          HG12      VAL  75   0.954  -9.565  -5.272
    6   HG11  VAL  75          HG13      VAL  75   1.151  -9.133  -3.581
    7   HG21  VAL  75          HG21      VAL  75   0.152 -12.709  -3.457
    8   HG23  VAL  75          HG22      VAL  75   1.485 -11.581  -3.208
    9   HG22  VAL  75          HG23      VAL  75   1.036 -12.069  -4.844

  No H/Q in entry =           9
  In of MODEL   49
    1    H    GLU  76           H        GLU  76  -3.297 -10.046  -3.511
    2    HA   GLU  76           HA       GLU  76  -3.357  -7.232  -3.623
    3    HB2  GLU  76           HB2      GLU  76  -5.005  -8.685  -4.788
    4    HB3  GLU  76           HB3      GLU  76  -5.667  -9.171  -3.235
    5    HG2  GLU  76           HG2      GLU  76  -7.117  -7.467  -4.134
    6    HG3  GLU  76           HG3      GLU  76  -6.243  -6.740  -2.800

  No H/Q in entry =           6
  In of MODEL   49
    1    H    ALA  77           H        ALA  77  -4.475  -9.454  -1.081
    2    HA   ALA  77           HA       ALA  77  -5.447  -7.449   0.665
    3    HB3  ALA  77           HB1      ALA  77  -5.353  -9.171   2.398
    4    HB1  ALA  77           HB2      ALA  77  -4.327 -10.173   1.373
    5    HB2  ALA  77           HB3      ALA  77  -5.994  -9.851   0.902

  No H/Q in entry =           5
  In of MODEL   49
    1    H    GLN  78           H        GLN  78  -2.293  -8.990   0.324
    2    HA   GLN  78           HA       GLN  78  -1.051  -7.818   2.576
    3    HB2  GLN  78           HB2      GLN  78  -0.175  -9.762   1.237
    4    HB3  GLN  78           HB3      GLN  78   0.260  -8.622  -0.035
    5    HG2  GLN  78           HG2      GLN  78   1.712  -7.411   1.538
    6    HG3  GLN  78           HG3      GLN  78   1.278  -8.541   2.818
    7   HE21  GLN  78          HE21      GLN  78   4.004  -8.233   1.919
    8   HE22  GLN  78          HE22      GLN  78   4.472  -9.685   1.175

  No H/Q in entry =           8
  In of MODEL   49
    1    H    LEU  79           H        LEU  79  -1.402  -6.770  -0.776
    2    HA   LEU  79           HA       LEU  79   0.279  -4.539  -0.761
    3    HB2  LEU  79           HB2      LEU  79  -0.735  -5.356  -2.818
    4    HB3  LEU  79           HB3      LEU  79  -2.343  -4.965  -2.220
    5    HG   LEU  79           HG       LEU  79  -1.804  -2.577  -2.200
    6   HD13  LEU  79          HD11      LEU  79   0.433  -2.327  -1.676
    7   HD12  LEU  79          HD12      LEU  79   0.491  -2.045  -3.415
    8   HD11  LEU  79          HD13      LEU  79   0.945  -3.620  -2.761
    9   HD23  LEU  79          HD21      LEU  79  -1.156  -2.386  -4.749
   10   HD22  LEU  79          HD22      LEU  79  -2.684  -3.136  -4.296
   11   HD21  LEU  79          HD23      LEU  79  -1.306  -4.143  -4.729

  No H/Q in entry =          11
  In of MODEL   49
    1    H    HIS  80           H        HIS  80  -3.192  -4.706   0.046
    2    HA   HIS  80           HA       HIS  80  -3.393  -1.948   0.699
    3    HB2  HIS  80           HB2      HIS  80  -5.091  -4.358   1.017
    4    HB3  HIS  80           HB3      HIS  80  -5.420  -3.015   2.114
    5    HD1  HIS  80           HD1      HIS  80  -7.036  -1.384   1.192
    6    HD2  HIS  80           HD2      HIS  80  -4.823  -3.204  -1.837
    7    HE1  HIS  80           HE1      HIS  80  -7.866  -0.397  -0.995
    8    HE2  HIS  80           HE2      HIS  80  -6.523  -1.500  -2.851

  No H/Q in entry =           8
  In of MODEL   49
    1    H    LEU  81           H        LEU  81  -2.910  -4.834   2.705
    2    HA   LEU  81           HA       LEU  81  -2.913  -3.478   5.184
    3    HB2  LEU  81           HB2      LEU  81  -1.685  -6.096   4.321
    4    HB3  LEU  81           HB3      LEU  81  -1.670  -5.531   5.993
    5    HG   LEU  81           HG       LEU  81  -4.206  -5.793   4.352
    6   HD12  LEU  81          HD11      LEU  81  -4.514  -7.854   5.905
    7   HD11  LEU  81          HD12      LEU  81  -2.763  -7.780   6.100
    8   HD13  LEU  81          HD13      LEU  81  -3.462  -8.017   4.498
    9   HD23  LEU  81          HD21      LEU  81  -5.062  -5.989   6.849
   10   HD22  LEU  81          HD22      LEU  81  -4.736  -4.402   6.155
   11   HD21  LEU  81          HD23      LEU  81  -3.554  -5.157   7.224

  No H/Q in entry =          11
  In of MODEL   49
    1    H    MET  82           H        MET  82  -0.219  -4.386   3.032
    2    HA   MET  82           HA       MET  82   1.854  -3.483   4.723
    3    HB2  MET  82           HB2      MET  82   1.656  -3.835   1.731
    4    HB3  MET  82           HB3      MET  82   3.133  -3.260   2.501
    5    HG2  MET  82           HG2      MET  82   1.725  -5.849   3.227
    6    HG3  MET  82           HG3      MET  82   3.102  -5.741   2.134
    7    HE3  MET  82           HE1      MET  82   6.106  -4.995   4.131
    8    HE2  MET  82           HE2      MET  82   5.185  -3.630   3.503
    9    HE1  MET  82           HE3      MET  82   5.280  -5.124   2.573

  No H/Q in entry =           9
  In of MODEL   49
    1    H    THR  83           H        THR  83   0.044  -1.852   2.151
    2    HA   THR  83           HA       THR  83   1.453   0.598   2.236
    3    HB   THR  83           HB       THR  83  -0.719   1.517   1.235
    4    HG1  THR  83           HG1      THR  83  -2.367   0.218   1.124
    5   HG22  THR  83          HG21      THR  83  -0.436  -0.308  -0.758
    6   HG21  THR  83          HG22      THR  83   1.060  -0.595   0.128
    7   HG23  THR  83          HG23      THR  83   0.701   1.015  -0.495

  No H/Q in entry =           7
  In of MODEL   49
    1    H    SER  84           H        SER  84  -1.561  -0.431   3.825
    2    HA   SER  84           HA       SER  84  -2.066   2.003   5.158
    3    HB2  SER  84           HB2      SER  84  -2.900  -0.833   5.728
    4    HB3  SER  84           HB3      SER  84  -3.400   0.511   6.754
    5    HG   SER  84           HG       SER  84  -3.843   0.187   3.960

  No H/Q in entry =           5
  In of MODEL   49
    1    H    MET  85           H        MET  85  -0.360  -0.923   6.307
    2    HA   MET  85           HA       MET  85   0.145   0.013   8.911
    3    HB2  MET  85           HB2      MET  85   0.442  -2.333   8.245
    4    HB3  MET  85           HB3      MET  85   1.829  -1.873   7.255
    5    HG2  MET  85           HG2      MET  85   3.002  -1.042   9.249
    6    HG3  MET  85           HG3      MET  85   1.604  -1.436  10.248
    7    HE1  MET  85           HE1      MET  85   4.083  -2.465   7.792
    8    HE3  MET  85           HE2      MET  85   3.293  -3.954   7.279
    9    HE2  MET  85           HE3      MET  85   4.720  -4.030   8.308

  No H/Q in entry =           9
  In of MODEL   49
    1    H    LEU  86           H        LEU  86   2.095   0.259   5.969
    2    HA   LEU  86           HA       LEU  86   4.303   1.575   7.131
    3    HB2  LEU  86           HB2      LEU  86   4.124   0.484   4.826
    4    HB3  LEU  86           HB3      LEU  86   3.318   1.963   4.303
    5    HG   LEU  86           HG       LEU  86   5.341   3.214   5.290
    6   HD11  LEU  86          HD11      LEU  86   6.042   0.605   6.103
    7   HD13  LEU  86          HD12      LEU  86   7.045   2.051   6.200
    8   HD12  LEU  86          HD13      LEU  86   7.162   0.997   4.793
    9   HD23  LEU  86          HD21      LEU  86   6.070   1.442   2.950
   10   HD22  LEU  86          HD22      LEU  86   6.462   3.140   3.207
   11   HD21  LEU  86          HD23      LEU  86   4.812   2.670   2.802

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ALA  87           H        ALA  87   1.398   2.811   5.527
    2    HA   ALA  87           HA       ALA  87   1.991   5.542   5.603
    3    HB1  ALA  87           HB1      ALA  87  -0.314   3.911   5.056
    4    HB3  ALA  87           HB2      ALA  87  -0.001   5.570   4.551
    5    HB2  ALA  87           HB3      ALA  87  -0.803   5.254   6.092

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ARG  88           H        ARG  88   0.290   3.549   7.992
    2    HA   ARG  88           HA       ARG  88  -0.232   5.605   9.828
    3    HB2  ARG  88           HB2      ARG  88  -1.170   3.253   9.899
    4    HB3  ARG  88           HB3      ARG  88   0.367   2.756  10.615
    5    HG2  ARG  88           HG2      ARG  88  -0.119   4.837  12.224
    6    HG3  ARG  88           HG3      ARG  88  -1.783   4.510  11.760
    7    HD2  ARG  88           HD2      ARG  88  -1.896   2.665  13.014
    8    HD3  ARG  88           HD3      ARG  88  -0.304   2.082  12.493
    9    HE   ARG  88           HE       ARG  88  -0.851   3.355  14.939
   10   HH21  ARG  88          HH11      ARG  88   0.700   4.372  16.182
   11   HH22  ARG  88          HH12      ARG  88   2.223   4.797  15.484
   12   HH11  ARG  88          HH21      ARG  88   1.443   3.527  12.374
   13   HH12  ARG  88          HH22      ARG  88   2.652   4.302  13.340

  No H/Q in entry =          13
  In of MODEL   49
    1    H    GLU  89           H        GLU  89   2.566   3.387   9.628
    2    HA   GLU  89           HA       GLU  89   3.815   4.286  11.975
    3    HB2  GLU  89           HB2      GLU  89   4.482   2.263  10.643
    4    HB3  GLU  89           HB3      GLU  89   5.263   3.352   9.496
    5    HG2  GLU  89           HG2      GLU  89   6.738   4.207  11.244
    6    HG3  GLU  89           HG3      GLU  89   5.898   3.255  12.464

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LEU  90           H        LEU  90   4.149   5.430   8.645
    2    HA   LEU  90           HA       LEU  90   6.074   7.435   9.232
    3    HB2  LEU  90           HB2      LEU  90   4.080   7.093   6.995
    4    HB3  LEU  90           HB3      LEU  90   5.310   8.364   7.018
    5    HG   LEU  90           HG       LEU  90   5.984   5.430   7.367
    6   HD12  LEU  90          HD11      LEU  90   6.745   5.654   4.931
    7   HD11  LEU  90          HD12      LEU  90   5.729   7.094   4.871
    8   HD13  LEU  90          HD13      LEU  90   5.009   5.521   5.217
    9   HD22  LEU  90          HD21      LEU  90   7.877   6.584   8.055
   10   HD21  LEU  90          HD22      LEU  90   7.531   7.985   7.040
   11   HD23  LEU  90          HD23      LEU  90   8.196   6.518   6.323

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  91           H        ILE  91   2.536   7.446   9.064
    2    HA   ILE  91           HA       ILE  91   2.188  10.220   9.502
    3    HB   ILE  91           HB       ILE  91   0.397   7.844  10.045
    4   HG12  ILE  91          HG12      ILE  91   0.156  10.117   8.049
    5   HG13  ILE  91          HG13      ILE  91   1.020   8.622   7.688
    6   HG22  ILE  91          HG21      ILE  91  -1.338   9.900  10.090
    7   HG21  ILE  91          HG22      ILE  91   0.058  10.735  10.767
    8   HG23  ILE  91          HG23      ILE  91  -0.581   9.300  11.566
    9   HD13  ILE  91          HD11      ILE  91  -0.922   7.332   7.727
   10   HD12  ILE  91          HD12      ILE  91  -1.510   8.843   7.036
   11   HD11  ILE  91          HD13      ILE  91  -1.790   8.486   8.740

  No H/Q in entry =          11
  In of MODEL   49
    1    H    THR  92           H        THR  92   2.583   7.488  11.717
    2    HA   THR  92           HA       THR  92   2.125   8.871  14.132
    3    HB   THR  92           HB       THR  92   3.941   6.537  13.487
    4    HG1  THR  92           HG1      THR  92   1.974   5.775  13.379
    5   HG22  THR  92          HG21      THR  92   3.543   6.263  16.120
    6   HG21  THR  92          HG22      THR  92   3.476   8.022  16.039
    7   HG23  THR  92          HG23      THR  92   4.914   7.166  15.477

  No H/Q in entry =           7
  In of MODEL   49
    1    H    GLU  93           H        GLU  93   5.087   8.420  12.217
    2    HA   GLU  93           HA       GLU  93   6.828   9.857  13.917
    3    HB2  GLU  93           HB2      GLU  93   6.934   9.530  10.904
    4    HB3  GLU  93           HB3      GLU  93   8.268  10.067  11.924
    5    HG2  GLU  93           HG2      GLU  93   6.862   7.430  12.375
    6    HG3  GLU  93           HG3      GLU  93   8.251   7.580  11.306

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LEU  94           H        LEU  94   4.793  10.856  11.189
    2    HA   LEU  94           HA       LEU  94   5.592  13.561  11.081
    3    HB2  LEU  94           HB2      LEU  94   3.009  12.187  10.319
    4    HB3  LEU  94           HB3      LEU  94   3.264  13.914  10.072
    5    HG   LEU  94           HG       LEU  94   5.293  11.926   9.041
    6   HD11  LEU  94          HD11      LEU  94   2.556  12.465   7.961
    7   HD13  LEU  94          HD12      LEU  94   3.543  11.011   7.848
    8   HD12  LEU  94          HD13      LEU  94   3.881  12.387   6.799
    9   HD23  LEU  94          HD21      LEU  94   5.548  13.756   7.312
   10   HD22  LEU  94          HD22      LEU  94   5.952  14.257   8.954
   11   HD21  LEU  94          HD23      LEU  94   4.404  14.717   8.245

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  95           H        ILE  95   3.048  11.946  12.965
    2    HA   ILE  95           HA       ILE  95   1.991  14.298  14.144
    3    HB   ILE  95           HB       ILE  95   2.012  11.420  15.081
    4   HG12  ILE  95          HG12      ILE  95  -0.208  13.182  14.012
    5   HG13  ILE  95          HG13      ILE  95   0.757  12.122  12.990
    6   HG21  ILE  95          HG21      ILE  95   0.715  13.894  16.265
    7   HG23  ILE  95          HG22      ILE  95   1.762  12.732  17.080
    8   HG22  ILE  95          HG23      ILE  95   0.131  12.264  16.598
    9   HD13  ILE  95          HD11      ILE  95  -0.145  10.184  13.912
   10   HD12  ILE  95          HD12      ILE  95  -1.531  11.270  13.976
   11   HD11  ILE  95          HD13      ILE  95  -0.573  10.981  15.428

  No H/Q in entry =          11
  In of MODEL   49
    1    H    GLU  96           H        GLU  96   4.588  12.092  15.164
    2    HA   GLU  96           HA       GLU  96   5.124  13.303  17.654
    3    HB2  GLU  96           HB2      GLU  96   6.083  11.144  17.022
    4    HB3  GLU  96           HB3      GLU  96   7.021  11.915  15.744
    5    HG2  GLU  96           HG2      GLU  96   8.660  12.476  17.213
    6    HG3  GLU  96           HG3      GLU  96   7.504  13.290  18.258

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LEU  97           H        LEU  97   6.215  14.064  14.371
    2    HA   LEU  97           HA       LEU  97   8.090  16.071  15.085
    3    HB2  LEU  97           HB2      LEU  97   6.515  15.505  12.583
    4    HB3  LEU  97           HB3      LEU  97   7.528  16.940  12.704
    5    HG   LEU  97           HG       LEU  97   8.565  14.149  13.283
    6   HD12  LEU  97          HD11      LEU  97   9.574  14.337  10.970
    7   HD11  LEU  97          HD12      LEU  97   8.519  15.722  10.695
    8   HD13  LEU  97          HD13      LEU  97   7.824  14.129  10.992
    9   HD23  LEU  97          HD21      LEU  97  10.733  15.433  12.547
   10   HD22  LEU  97          HD22      LEU  97  10.104  15.707  14.171
   11   HD21  LEU  97          HD23      LEU  97   9.792  16.884  12.895

  No H/Q in entry =          11
  In of MODEL   49
    1    H    HIS  98           H        HIS  98   4.602  16.189  14.409
    2    HA   HIS  98           HA       HIS  98   4.290  18.988  14.530
    3    HB2  HIS  98           HB2      HIS  98   2.405  16.734  15.255
    4    HB3  HIS  98           HB3      HIS  98   1.931  18.432  15.301
    5    HD1  HIS  98           HD1      HIS  98   2.978  15.711  12.914
    6    HD2  HIS  98           HD2      HIS  98   1.586  19.638  12.766
    7    HE1  HIS  98           HE1      HIS  98   2.431  16.186  10.485
    8    HE2  HIS  98           HE2      HIS  98   1.587  18.572  10.374

  No H/Q in entry =           8
  In of MODEL   49
    1    H    GLU  99           H        GLU  99   4.419  16.512  17.041
    2    HA   GLU  99           HA       GLU  99   3.791  18.213  19.228
    3    HB2  GLU  99           HB2      GLU  99   3.712  15.731  19.335
    4    HB3  GLU  99           HB3      GLU  99   5.473  15.693  19.238
    5    HG2  GLU  99           HG2      GLU  99   5.644  16.995  21.307
    6    HG3  GLU  99           HG3      GLU  99   3.890  17.129  21.392

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LYS 100           H        LYS 100   6.858  17.288  17.685
    2    HA   LYS 100           HA       LYS 100   8.496  18.704  19.545
    3    HB2  LYS 100           HB2      LYS 100   9.015  17.769  16.714
    4    HB3  LYS 100           HB3      LYS 100  10.236  18.548  17.725
    5    HG2  LYS 100           HG2      LYS 100   9.857  16.804  19.472
    6    HG3  LYS 100           HG3      LYS 100   8.735  15.991  18.378
    7    HD2  LYS 100           HD2      LYS 100  10.540  15.708  16.722
    8    HD3  LYS 100           HD3      LYS 100  11.667  16.533  17.802
    9    HE2  LYS 100           HE2      LYS 100  11.268  14.784  19.525
   10    HE3  LYS 100           HE3      LYS 100  10.203  13.938  18.397
   11    HZ1  LYS 100           HZ1      LYS 100  13.024  14.617  17.756
   12    HZ3  LYS 100           HZ2      LYS 100  11.990  13.554  16.926
   13    HZ2  LYS 100           HZ3      LYS 100  12.571  13.144  18.470

  No H/Q in entry =          13
  In of MODEL   49
    1    H    LEU 101           H        LEU 101   6.816  19.611  16.576
    2    HA   LEU 101           HA       LEU 101   8.022  22.171  16.237
    3    HB2  LEU 101           HB2      LEU 101   5.437  20.923  15.340
    4    HB3  LEU 101           HB3      LEU 101   5.682  22.654  15.127
    5    HG   LEU 101           HG       LEU 101   7.732  20.642  14.182
    6   HD12  LEU 101          HD11      LEU 101   6.590  21.133  11.888
    7   HD11  LEU 101          HD12      LEU 101   5.183  21.562  12.858
    8   HD13  LEU 101          HD13      LEU 101   5.853  19.934  12.951
    9   HD21  LEU 101          HD21      LEU 101   7.095  23.549  13.610
   10   HD23  LEU 101          HD22      LEU 101   8.086  22.589  12.513
   11   HD22  LEU 101          HD23      LEU 101   8.617  22.856  14.173

  No H/Q in entry =          11
  In of MODEL   49
    1    H    LYS 102           H        LYS 102   6.474  21.039  18.848
    2    HA   LYS 102           HA       LYS 102   5.826  22.136  20.772
    3    HB2  LYS 102           HB2      LYS 102   7.108  24.126  19.646
    4    HB3  LYS 102           HB3      LYS 102   5.508  24.723  19.259
    5    HG2  LYS 102           HG2      LYS 102   6.871  24.484  21.920
    6    HG3  LYS 102           HG3      LYS 102   5.917  25.806  21.280
    7    HD2  LYS 102           HD2      LYS 102   4.678  23.169  22.163
    8    HD3  LYS 102           HD3      LYS 102   4.915  24.536  23.241
    9    HE2  LYS 102           HE2      LYS 102   2.646  24.118  21.741
   10    HE3  LYS 102           HE3      LYS 102   3.139  25.668  22.420
   11    HZ2  LYS 102           HZ1      LYS 102   2.622  25.764  20.036
   12    HZ1  LYS 102           HZ2      LYS 102   3.890  24.686  19.725
   13    HZ3  LYS 102           HZ3      LYS 102   4.223  26.220  20.364

  No H/Q in entry =          13
  In of MODEL   49
    1    H    ALA 103           H        ALA 103   4.198  23.661  17.989
    2    HA   ALA 103           HA       ALA 103   1.737  24.232  18.857
    3    HB1  ALA 103           HB1      ALA 103   0.855  23.377  16.613
    4    HB2  ALA 103           HB2      ALA 103   2.506  22.845  16.295
    5    HB3  ALA 103           HB3      ALA 103   2.163  24.557  16.552

  No H/Q in entry =           5
  In of MODEL   49
    1    H1   ALA   1           H3       ALA   1  10.644 -20.343  -6.177
    2    H2   ALA   1           H2       ALA   1   9.689 -20.558  -7.568
    3    H3   ALA   1           H1       ALA   1   9.246 -21.300  -6.104
    4    HA   ALA   1           HA       ALA   1  10.295 -23.108  -6.830
    5    HB1  ALA   1           HB1      ALA   1  10.402 -22.758  -9.107
    6    HB2  ALA   1           HB2      ALA   1  12.127 -22.601  -8.769
    7    HB3  ALA   1           HB3      ALA   1  11.125 -21.158  -8.931

  No H/Q in entry =           7
  In of MODEL   49
    1    H    GLU   2           H        GLU   2  12.582 -24.052  -6.871
    2    HA   GLU   2           HA       GLU   2  13.951 -23.957  -4.652
    3    HB2  GLU   2           HB2      GLU   2  15.321 -23.833  -7.344
    4    HB3  GLU   2           HB3      GLU   2  16.043 -24.436  -5.853
    5    HG2  GLU   2           HG2      GLU   2  15.034 -26.456  -6.091
    6    HG3  GLU   2           HG3      GLU   2  13.462 -25.716  -6.361

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLU   3           H        GLU   3  15.730 -22.097  -7.052
    2    HA   GLU   3           HA       GLU   3  16.867 -20.399  -5.093
    3    HB2  GLU   3           HB2      GLU   3  16.828 -20.409  -8.103
    4    HB3  GLU   3           HB3      GLU   3  17.565 -19.074  -7.217
    5    HG2  GLU   3           HG2      GLU   3  19.226 -20.440  -6.280
    6    HG3  GLU   3           HG3      GLU   3  18.285 -21.911  -6.500

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LEU   4           H        LEU   4  14.597 -19.568  -7.740
    2    HA   LEU   4           HA       LEU   4  14.120 -16.958  -7.142
    3    HB2  LEU   4           HB2      LEU   4  11.955 -18.942  -7.875
    4    HB3  LEU   4           HB3      LEU   4  11.876 -17.194  -8.082
    5    HG   LEU   4           HG       LEU   4  13.853 -19.058  -9.436
    6   HD13  LEU   4          HD11      LEU   4  12.561 -18.920 -11.354
    7   HD12  LEU   4          HD12      LEU   4  11.846 -17.375 -10.897
    8   HD11  LEU   4          HD13      LEU   4  11.293 -18.864 -10.132
    9   HD23  LEU   4          HD21      LEU   4  14.191 -16.817 -10.795
   10   HD22  LEU   4          HD22      LEU   4  15.043 -17.051  -9.270
   11   HD21  LEU   4          HD23      LEU   4  13.588 -16.059  -9.321

  No H/Q in entry =          11
  In of MODEL   49
    1    H    GLU   5           H        GLU   5  12.634 -19.739  -5.496
    2    HA   GLU   5           HA       GLU   5  10.943 -18.166  -3.809
    3    HB2  GLU   5           HB2      GLU   5  10.523 -20.545  -4.320
    4    HB3  GLU   5           HB3      GLU   5  11.958 -20.977  -3.387
    5    HG2  GLU   5           HG2      GLU   5  10.987 -19.941  -1.382
    6    HG3  GLU   5           HG3      GLU   5   9.560 -19.474  -2.307

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLU   6           H        GLU   6  14.092 -19.735  -3.342
    2    HA   GLU   6           HA       GLU   6  14.427 -18.866  -0.646
    3    HB2  GLU   6           HB2      GLU   6  15.666 -20.781  -1.610
    4    HB3  GLU   6           HB3      GLU   6  16.522 -19.671  -2.682
    5    HG2  GLU   6           HG2      GLU   6  17.443 -18.481  -0.736
    6    HG3  GLU   6           HG3      GLU   6  16.572 -19.565   0.348

  No H/Q in entry =           6
  In of MODEL   49
    1    H    VAL   7           H        VAL   7  15.206 -17.550  -3.797
    2    HA   VAL   7           HA       VAL   7  16.881 -15.415  -2.932
    3    HB   VAL   7           HB       VAL   7  15.190 -15.794  -5.417
    4   HG11  VAL   7          HG11      VAL   7  17.071 -13.571  -4.604
    5   HG13  VAL   7          HG12      VAL   7  15.432 -13.437  -5.237
    6   HG12  VAL   7          HG13      VAL   7  16.749 -13.939  -6.298
    7   HG21  VAL   7          HG21      VAL   7  17.298 -17.241  -4.831
    8   HG23  VAL   7          HG22      VAL   7  18.200 -15.779  -5.230
    9   HG22  VAL   7          HG23      VAL   7  17.173 -16.537  -6.444

  No H/Q in entry =           9
  In of MODEL   49
    1    H    VAL   8           H        VAL   8  13.392 -15.698  -3.506
    2    HA   VAL   8           HA       VAL   8  12.715 -12.990  -3.050
    3    HB   VAL   8           HB       VAL   8  11.112 -15.525  -2.620
    4   HG13  VAL   8          HG11      VAL   8  10.089 -13.855  -1.252
    5   HG12  VAL   8          HG12      VAL   8   9.154 -13.876  -2.747
    6   HG11  VAL   8          HG13      VAL   8  10.339 -12.602  -2.468
    7   HG21  VAL   8          HG21      VAL   8  11.994 -14.428  -4.992
    8   HG23  VAL   8          HG22      VAL   8  10.446 -13.613  -4.792
    9   HG22  VAL   8          HG23      VAL   8  10.514 -15.372  -4.839

  No H/Q in entry =           9
  In of MODEL   49
    1    H    MET   9           H        MET   9  12.980 -15.786  -0.857
    2    HA   MET   9           HA       MET   9  12.147 -14.507   1.504
    3    HB2  MET   9           HB2      MET   9  14.024 -16.798   0.955
    4    HB3  MET   9           HB3      MET   9  13.803 -16.190   2.595
    5    HG2  MET   9           HG2      MET   9  11.507 -16.744   2.620
    6    HG3  MET   9           HG3      MET   9  11.437 -16.890   0.864
    7    HE2  MET   9           HE1      MET   9  14.083 -19.666   3.380
    8    HE1  MET   9           HE2      MET   9  13.598 -18.024   3.792
    9    HE3  MET   9           HE3      MET   9  14.687 -18.299   2.436

  No H/Q in entry =           9
  In of MODEL   49
    1    H    GLY  10           H        GLY  10  15.337 -14.726  -0.034
    2    HA3  GLY  10           HA2      GLY  10  16.780 -13.292   1.937
    3    HA2  GLY  10           HA3      GLY  10  17.253 -13.462   0.247

  No H/Q in entry =           3
  In of MODEL   49
    1    H    LEU  11           H        LEU  11  15.087 -12.255  -1.009
    2    HA   LEU  11           HA       LEU  11  15.759  -9.506  -0.853
    3    HB2  LEU  11           HB2      LEU  11  13.404 -10.931  -2.096
    4    HB3  LEU  11           HB3      LEU  11  13.678  -9.196  -2.261
    5    HG   LEU  11           HG       LEU  11  15.719 -11.299  -3.029
    6   HD13  LEU  11          HD11      LEU  11  13.983 -11.680  -4.557
    7   HD12  LEU  11          HD12      LEU  11  14.985 -10.498  -5.397
    8   HD11  LEU  11          HD13      LEU  11  13.505  -9.982  -4.588
    9   HD22  LEU  11          HD21      LEU  11  16.941  -9.330  -2.805
   10   HD21  LEU  11          HD22      LEU  11  15.563  -8.301  -3.195
   11   HD23  LEU  11          HD23      LEU  11  16.405  -9.171  -4.476

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  12           H        ILE  12  12.992 -11.339   0.406
    2    HA   ILE  12           HA       ILE  12  11.582  -9.118   1.449
    3    HB   ILE  12           HB       ILE  12  11.627 -11.995   2.414
    4   HG12  ILE  12          HG12      ILE  12  10.953 -11.371  -0.045
    5   HG13  ILE  12          HG13      ILE  12   9.938 -12.474   0.862
    6   HG21  ILE  12          HG21      ILE  12   9.685  -9.724   2.949
    7   HG23  ILE  12          HG22      ILE  12  10.654 -10.596   4.136
    8   HG22  ILE  12          HG23      ILE  12   9.336 -11.416   3.302
    9   HD12  ILE  12          HD11      ILE  12   8.676 -10.703  -0.377
   10   HD11  ILE  12          HD12      ILE  12   9.473  -9.491   0.623
   11   HD13  ILE  12          HD13      ILE  12   8.398 -10.662   1.355

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  13           H        ILE  13  13.978 -11.305   2.877
    2    HA   ILE  13           HA       ILE  13  13.994 -10.114   5.453
    3    HB   ILE  13           HB       ILE  13  16.076 -11.677   3.907
    4   HG12  ILE  13          HG12      ILE  13  13.790 -12.651   4.733
    5   HG13  ILE  13          HG13      ILE  13  15.267 -13.573   4.993
    6   HG23  ILE  13          HG21      ILE  13  17.308 -10.370   5.512
    7   HG22  ILE  13          HG22      ILE  13  17.191 -12.000   6.158
    8   HG21  ILE  13          HG23      ILE  13  16.148 -10.726   6.790
    9   HD13  ILE  13          HD11      ILE  13  15.387 -12.848   7.312
   10   HD12  ILE  13          HD12      ILE  13  13.755 -13.434   7.010
   11   HD11  ILE  13          HD13      ILE  13  14.070 -11.705   7.059

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ASN  14           H        ASN  14  15.960  -9.585   2.543
    2    HA   ASN  14           HA       ASN  14  17.687  -7.628   3.606
    3    HB2  ASN  14           HB2      ASN  14  17.685  -8.904   1.296
    4    HB3  ASN  14           HB3      ASN  14  16.787  -7.495   0.748
    5   HD21  ASN  14          HD21      ASN  14  19.236  -7.824  -0.423
    6   HD22  ASN  14          HD22      ASN  14  20.368  -6.731   0.206

  No H/Q in entry =           6
  In of MODEL   49
    1    H    SER  15           H        SER  15  14.584  -7.308   1.895
    2    HA   SER  15           HA       SER  15  14.453  -4.488   1.939
    3    HB2  SER  15           HB2      SER  15  12.127  -4.751   1.427
    4    HB3  SER  15           HB3      SER  15  12.935  -6.119   0.672
    5    HG   SER  15           HG       SER  15  11.829  -7.382   1.915

  No H/Q in entry =           5
  In of MODEL   49
    1    H    GLY  16           H        GLY  16  13.363  -6.945   4.246
    2    HA3  GLY  16           HA2      GLY  16  12.119  -5.197   6.089
    3    HA2  GLY  16           HA3      GLY  16  12.743  -6.800   6.462

  No H/Q in entry =           3
  In of MODEL   49
    1    H    GLN  17           H        GLN  17  15.455  -6.450   5.884
    2    HA   GLN  17           HA       GLN  17  16.389  -5.213   8.264
    3    HB2  GLN  17           HB2      GLN  17  17.653  -6.994   7.121
    4    HB3  GLN  17           HB3      GLN  17  17.923  -5.923   5.745
    5    HG2  GLN  17           HG2      GLN  17  19.200  -4.386   7.120
    6    HG3  GLN  17           HG3      GLN  17  18.818  -5.306   8.574
    7   HE21  GLN  17          HE21      GLN  17  21.533  -4.857   7.778
    8   HE22  GLN  17          HE22      GLN  17  22.206  -6.346   7.320

  No H/Q in entry =           8
  In of MODEL   49
    1    H    ALA  18           H        ALA  18  16.212  -4.150   4.899
    2    HA   ALA  18           HA       ALA  18  17.630  -1.747   5.124
    3    HB2  ALA  18           HB1      ALA  18  16.533  -2.978   3.055
    4    HB3  ALA  18           HB2      ALA  18  16.785  -1.233   3.034
    5    HB1  ALA  18           HB3      ALA  18  15.188  -1.889   3.397

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ARG  19           H        ARG  19  14.132  -2.358   5.503
    2    HA   ARG  19           HA       ARG  19  13.440   0.290   6.203
    3    HB2  ARG  19           HB2      ARG  19  11.776  -1.477   5.614
    4    HB3  ARG  19           HB3      ARG  19  12.114  -2.266   7.156
    5    HG2  ARG  19           HG2      ARG  19  11.382  -0.275   8.383
    6    HG3  ARG  19           HG3      ARG  19  11.134   0.594   6.869
    7    HD2  ARG  19           HD2      ARG  19   8.994  -0.215   7.680
    8    HD3  ARG  19           HD3      ARG  19   9.428  -1.098   6.210
    9    HE   ARG  19           HE       ARG  19  10.385  -2.624   8.327
   10   HH21  ARG  19          HH11      ARG  19   9.143  -4.269   9.266
   11   HH22  ARG  19          HH12      ARG  19   7.424  -4.255   9.084
   12   HH11  ARG  19          HH21      ARG  19   7.388  -1.358   7.209
   13   HH12  ARG  19          HH22      ARG  19   6.431  -2.608   7.916

  No H/Q in entry =          13
  In of MODEL   49
    1    H    SER  20           H        SER  20  14.307  -2.526   8.179
    2    HA   SER  20           HA       SER  20  14.001  -1.418  10.710
    3    HB2  SER  20           HB2      SER  20  14.485  -3.740  10.602
    4    HB3  SER  20           HB3      SER  20  15.940  -3.470   9.645
    5    HG   SER  20           HG       SER  20  15.467  -2.974  12.381

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LEU  21           H        LEU  21  16.856  -1.344   8.590
    2    HA   LEU  21           HA       LEU  21  18.509   0.161  10.332
    3    HB2  LEU  21           HB2      LEU  21  18.507  -0.130   7.320
    4    HB3  LEU  21           HB3      LEU  21  19.746   0.753   8.208
    5    HG   LEU  21           HG       LEU  21  19.040  -2.142   8.771
    6   HD11  LEU  21          HD11      LEU  21  21.182  -0.945   6.993
    7   HD13  LEU  21          HD12      LEU  21  19.892  -2.046   6.514
    8   HD12  LEU  21          HD13      LEU  21  21.198  -2.618   7.549
    9   HD22  LEU  21          HD21      LEU  21  20.186  -1.393  10.668
   10   HD21  LEU  21          HD22      LEU  21  21.140  -0.217   9.771
   11   HD23  LEU  21          HD23      LEU  21  21.537  -1.924   9.672

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ALA  22           H        ALA  22  16.254   1.103   7.759
    2    HA   ALA  22           HA       ALA  22  16.772   3.865   7.764
    3    HB3  ALA  22           HB1      ALA  22  15.389   2.606   6.083
    4    HB2  ALA  22           HB2      ALA  22  14.667   4.115   6.639
    5    HB1  ALA  22           HB3      ALA  22  14.085   2.574   7.269

  No H/Q in entry =           5
  In of MODEL   49
    1    H    TYR  23           H        TYR  23  14.277   2.039   9.592
    2    HA   TYR  23           HA       TYR  23  13.290   4.275  11.026
    3    HB2  TYR  23           HB2      TYR  23  12.070   2.151  11.006
    4    HB3  TYR  23           HB3      TYR  23  13.401   1.355  11.843
    5    HD1  TYR  23           HD1      TYR  23  10.874   4.079  12.178
    6    HD2  TYR  23           HD2      TYR  23  13.585   1.430  14.201
    7    HE1  TYR  23           HE1      TYR  23   9.926   4.775  14.363
    8    HE2  TYR  23           HE2      TYR  23  12.636   2.127  16.383
    9    HH   TYR  23           HH       TYR  23  11.422   4.116  17.308

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ALA  24           H        ALA  24  15.947   2.021  11.689
    2    HA   ALA  24           HA       ALA  24  16.594   3.031  14.252
    3    HB1  ALA  24           HB1      ALA  24  17.964   1.247  14.103
    4    HB3  ALA  24           HB2      ALA  24  18.992   2.171  13.006
    5    HB2  ALA  24           HB3      ALA  24  17.709   1.151  12.361

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ALA  25           H        ALA  25  17.565   3.953  10.975
    2    HA   ALA  25           HA       ALA  25  19.493   5.904  11.624
    3    HB1  ALA  25           HB1      ALA  25  18.797   4.941   9.309
    4    HB3  ALA  25           HB2      ALA  25  19.287   6.632   9.398
    5    HB2  ALA  25           HB3      ALA  25  17.576   6.213   9.320

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LEU  26           H        LEU  26  15.979   6.107  11.241
    2    HA   LEU  26           HA       LEU  26  15.734   8.889  11.679
    3    HB2  LEU  26           HB2      LEU  26  13.886   7.638  10.745
    4    HB3  LEU  26           HB3      LEU  26  13.794   6.616  12.174
    5    HG   LEU  26           HG       LEU  26  13.166   8.575  13.542
    6   HD12  LEU  26          HD11      LEU  26  12.500  10.666  12.204
    7   HD11  LEU  26          HD12      LEU  26  13.493  10.014  10.903
    8   HD13  LEU  26          HD13      LEU  26  14.226  10.410  12.459
    9   HD21  LEU  26          HD21      LEU  26  11.508   8.241  11.024
   10   HD23  LEU  26          HD22      LEU  26  10.934   8.941  12.534
   11   HD22  LEU  26          HD23      LEU  26  11.397   7.242  12.473

  No H/Q in entry =          11
  In of MODEL   49
    1    H    LYS  27           H        LYS  27  15.630   6.118  13.883
    2    HA   LYS  27           HA       LYS  27  15.014   7.490  16.242
    3    HB2  LYS  27           HB2      LYS  27  15.059   5.014  15.987
    4    HB3  LYS  27           HB3      LYS  27  16.822   5.077  15.954
    5    HG2  LYS  27           HG2      LYS  27  16.853   6.072  18.200
    6    HG3  LYS  27           HG3      LYS  27  15.085   6.080  18.235
    7    HD2  LYS  27           HD2      LYS  27  15.076   3.612  18.008
    8    HD3  LYS  27           HD3      LYS  27  16.841   3.612  18.007
    9    HE2  LYS  27           HE2      LYS  27  16.855   4.610  20.260
   10    HE3  LYS  27           HE3      LYS  27  15.089   4.640  20.263
   11    HZ3  LYS  27           HZ1      LYS  27  15.882   2.697  21.427
   12    HZ2  LYS  27           HZ2      LYS  27  16.809   2.218  20.084
   13    HZ1  LYS  27           HZ3      LYS  27  15.111   2.213  19.994

  No H/Q in entry =          13
  In of MODEL   49
    1    H    GLN  28           H        GLN  28  18.144   6.919  14.671
    2    HA   GLN  28           HA       GLN  28  19.809   8.020  16.667
    3    HB2  GLN  28           HB2      GLN  28  20.116   7.966  13.654
    4    HB3  GLN  28           HB3      GLN  28  21.393   8.446  14.771
    5    HG2  GLN  28           HG2      GLN  28  19.986   5.761  14.812
    6    HG3  GLN  28           HG3      GLN  28  21.571   6.054  14.100
    7   HE21  GLN  28          HE21      GLN  28  20.275   4.759  16.809
    8   HE22  GLN  28          HE22      GLN  28  21.461   5.183  17.945

  No H/Q in entry =           8
  In of MODEL   49
    1    H    ALA  29           H        ALA  29  18.066   9.483  13.958
    2    HA   ALA  29           HA       ALA  29  19.051  12.110  14.207
    3    HB2  ALA  29           HB1      ALA  29  17.358  12.732  12.723
    4    HB1  ALA  29           HB2      ALA  29  16.216  11.556  13.372
    5    HB3  ALA  29           HB3      ALA  29  17.555  11.016  12.359

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LYS  30           H        LYS  30  16.273  10.503  15.718
    2    HA   LYS  30           HA       LYS  30  15.239  12.757  17.059
    3    HB2  LYS  30           HB2      LYS  30  15.137   9.818  17.774
    4    HB3  LYS  30           HB3      LYS  30  14.260  11.068  18.658
    5    HG2  LYS  30           HG2      LYS  30  13.145  11.740  16.530
    6    HG3  LYS  30           HG3      LYS  30  13.961  10.404  15.713
    7    HD2  LYS  30           HD2      LYS  30  12.887   8.798  17.241
    8    HD3  LYS  30           HD3      LYS  30  12.081  10.123  18.082
    9    HE2  LYS  30           HE2      LYS  30  10.923  10.743  15.980
   10    HE3  LYS  30           HE3      LYS  30  11.708   9.389  15.159
   11    HZ2  LYS  30           HZ1      LYS  30   9.396   8.973  16.027
   12    HZ1  LYS  30           HZ2      LYS  30  10.054   9.035  17.598
   13    HZ3  LYS  30           HZ3      LYS  30  10.574   7.848  16.495

  No H/Q in entry =          13
  In of MODEL   49
    1    H    GLN  31           H        GLN  31  17.905  10.602  17.821
    2    HA   GLN  31           HA       GLN  31  18.212  11.628  20.513
    3    HB2  GLN  31           HB2      GLN  31  20.251  10.059  18.927
    4    HB3  GLN  31           HB3      GLN  31  20.106  10.190  20.680
    5    HG2  GLN  31           HG2      GLN  31  17.601   9.224  19.900
    6    HG3  GLN  31           HG3      GLN  31  18.713   8.381  18.830
    7   HE21  GLN  31          HE21      GLN  31  17.161   7.237  21.101
    8   HE22  GLN  31          HE22      GLN  31  18.313   6.585  22.161

  No H/Q in entry =           8
  In of MODEL   49
    1    H    GLY  32           H        GLY  32  18.743  12.936  17.545
    2    HA3  GLY  32           HA2      GLY  32  19.722  14.983  17.029
    3    HA2  GLY  32           HA3      GLY  32  20.470  14.997  18.621

  No H/Q in entry =           3
  In of MODEL   49
    1    H    ASP  33           H        ASP  33  20.915  12.100  16.858
    2    HA   ASP  33           HA       ASP  33  23.740  12.785  16.406
    3    HB2  ASP  33           HB2      ASP  33  22.242  10.163  16.524
    4    HB3  ASP  33           HB3      ASP  33  23.931  10.285  16.039

  No H/Q in entry =           4
  In of MODEL   49
    1    H    PHE  34           H        PHE  34  23.265  14.099  14.517
    2    HA   PHE  34           HA       PHE  34  21.934  13.100  12.225
    3    HB2  PHE  34           HB2      PHE  34  24.054  15.245  12.460
    4    HB3  PHE  34           HB3      PHE  34  23.079  14.944  11.023
    5    HD1  PHE  34           HD1      PHE  34  23.303  16.891  13.931
    6    HD2  PHE  34           HD2      PHE  34  20.450  14.753  11.536
    7    HE1  PHE  34           HE1      PHE  34  21.475  18.284  14.861
    8    HE2  PHE  34           HE2      PHE  34  18.625  16.147  12.470
    9    HZ   PHE  34           HZ       PHE  34  19.142  17.913  14.128

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ALA  35           H        ALA  35  25.303  12.932  13.254
    2    HA   ALA  35           HA       ALA  35  26.427  12.106  10.807
    3    HB3  ALA  35           HB1      ALA  35  28.102  10.951  12.542
    4    HB2  ALA  35           HB2      ALA  35  27.227  11.977  13.678
    5    HB1  ALA  35           HB3      ALA  35  28.068  12.699  12.308

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ALA  36           H        ALA  36  25.303  10.156  13.574
    2    HA   ALA  36           HA       ALA  36  25.807   7.666  12.311
    3    HB2  ALA  36           HB1      ALA  36  25.368   6.925  14.386
    4    HB3  ALA  36           HB2      ALA  36  23.678   7.411  14.224
    5    HB1  ALA  36           HB3      ALA  36  24.870   8.551  14.850

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ALA  37           H        ALA  37  22.974   9.778  12.419
    2    HA   ALA  37           HA       ALA  37  21.134   7.994  11.239
    3    HB3  ALA  37           HB1      ALA  37  21.343  10.960  11.521
    4    HB1  ALA  37           HB2      ALA  37  20.034   9.876  11.990
    5    HB2  ALA  37           HB3      ALA  37  20.230  10.342  10.300

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LYS  38           H        LYS  38  23.230  10.461   9.763
    2    HA   LYS  38           HA       LYS  38  22.609  10.019   7.084
    3    HB2  LYS  38           HB2      LYS  38  24.401  11.592   8.534
    4    HB3  LYS  38           HB3      LYS  38  25.446  10.604   7.518
    5    HG2  LYS  38           HG2      LYS  38  24.289  11.360   5.512
    6    HG3  LYS  38           HG3      LYS  38  23.084  12.212   6.482
    7    HD2  LYS  38           HD2      LYS  38  24.666  13.822   7.238
    8    HD3  LYS  38           HD3      LYS  38  26.034  12.842   6.714
    9    HE2  LYS  38           HE2      LYS  38  25.676  14.705   5.153
   10    HE3  LYS  38           HE3      LYS  38  25.355  13.163   4.353
   11    HZ3  LYS  38           HZ1      LYS  38  23.156  13.594   4.208
   12    HZ2  LYS  38           HZ2      LYS  38  23.669  15.213   4.292
   13    HZ1  LYS  38           HZ3      LYS  38  23.091  14.431   5.684

  No H/Q in entry =          13
  In of MODEL   49
    1    H    ALA  39           H        ALA  39  25.120   8.444   9.061
    2    HA   ALA  39           HA       ALA  39  26.211   6.853   7.004
    3    HB2  ALA  39           HB1      ALA  39  26.111   5.901   9.851
    4    HB1  ALA  39           HB2      ALA  39  27.057   7.330   9.435
    5    HB3  ALA  39           HB3      ALA  39  27.423   5.779   8.680

  No H/Q in entry =           5
  In of MODEL   49
    1    H    MET  40           H        MET  40  23.588   6.231   9.289
    2    HA   MET  40           HA       MET  40  23.166   3.520   8.563
    3    HB2  MET  40           HB2      MET  40  21.329   5.558   9.836
    4    HB3  MET  40           HB3      MET  40  20.934   3.845   9.666
    5    HG2  MET  40           HG2      MET  40  23.469   4.808  11.018
    6    HG3  MET  40           HG3      MET  40  21.971   4.526  11.904
    7    HE3  MET  40           HE1      MET  40  21.429   0.890  12.090
    8    HE2  MET  40           HE2      MET  40  20.557   2.184  11.272
    9    HE1  MET  40           HE3      MET  40  21.287   2.482  12.849

  No H/Q in entry =           9
  In of MODEL   49
    1    H    MET  41           H        MET  41  21.740   6.560   7.355
    2    HA   MET  41           HA       MET  41  19.800   5.346   5.676
    3    HB2  MET  41           HB2      MET  41  21.268   7.944   5.162
    4    HB3  MET  41           HB3      MET  41  19.748   7.437   4.436
    5    HG2  MET  41           HG2      MET  41  18.988   7.254   6.984
    6    HG3  MET  41           HG3      MET  41  20.288   8.421   7.209
    7    HE2  MET  41           HE1      MET  41  19.737   9.692   3.864
    8    HE1  MET  41           HE2      MET  41  20.682  10.143   5.279
    9    HE3  MET  41           HE3      MET  41  19.406  11.212   4.703

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ASP  42           H        ASP  42  23.170   6.289   5.140
    2    HA   ASP  42           HA       ASP  42  23.282   5.804   2.385
    3    HB2  ASP  42           HB2      ASP  42  25.016   6.820   4.160
    4    HB3  ASP  42           HB3      ASP  42  25.684   5.199   4.043

  No H/Q in entry =           4
  In of MODEL   49
    1    H    GLN  43           H        GLN  43  24.004   3.665   5.118
    2    HA   GLN  43           HA       GLN  43  24.692   1.406   3.548
    3    HB2  GLN  43           HB2      GLN  43  23.651   1.593   6.385
    4    HB3  GLN  43           HB3      GLN  43  24.245   0.105   5.639
    5    HG2  GLN  43           HG2      GLN  43  26.403   1.328   5.136
    6    HG3  GLN  43           HG3      GLN  43  25.805   2.656   6.127
    7   HE21  GLN  43          HE21      GLN  43  28.039   1.701   7.180
    8   HE22  GLN  43          HE22      GLN  43  27.764   0.622   8.459

  No H/Q in entry =           8
  In of MODEL   49
    1    H    SER  44           H        SER  44  21.621   2.525   4.910
    2    HA   SER  44           HA       SER  44  20.071   0.268   4.237
    3    HB2  SER  44           HB2      SER  44  19.606   2.799   5.370
    4    HB3  SER  44           HB3      SER  44  18.580   2.743   3.939
    5    HG   SER  44           HG       SER  44  17.483   1.800   5.660

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ARG  45           H        ARG  45  20.805   3.231   2.425
    2    HA   ARG  45           HA       ARG  45  19.297   2.726   0.114
    3    HB2  ARG  45           HB2      ARG  45  20.423   4.872   0.696
    4    HB3  ARG  45           HB3      ARG  45  21.975   4.126   0.323
    5    HG2  ARG  45           HG2      ARG  45  21.207   3.706  -1.995
    6    HG3  ARG  45           HG3      ARG  45  19.668   4.475  -1.620
    7    HD2  ARG  45           HD2      ARG  45  20.901   6.582  -1.037
    8    HD3  ARG  45           HD3      ARG  45  22.406   5.816  -1.594
    9    HE   ARG  45           HE       ARG  45  20.489   5.558  -3.640
   10   HH21  ARG  45          HH11      ARG  45  20.484   6.920  -5.408
   11   HH22  ARG  45          HH12      ARG  45  21.230   8.476  -5.306
   12   HH11  ARG  45          HH21      ARG  45  22.194   8.074  -2.013
   13   HH12  ARG  45          HH22      ARG  45  22.197   9.128  -3.380

  No H/Q in entry =          13
  In of MODEL   49
    1    H    MET  46           H        MET  46  22.662   1.875   0.884
    2    HA   MET  46           HA       MET  46  23.289   0.677  -1.592
    3    HB2  MET  46           HB2      MET  46  24.382   0.367   1.205
    4    HB3  MET  46           HB3      MET  46  25.051  -0.527  -0.164
    5    HG2  MET  46           HG2      MET  46  25.489   1.578  -1.354
    6    HG3  MET  46           HG3      MET  46  24.770   2.492  -0.033
    7    HE2  MET  46           HE1      MET  46  28.751   0.344  -0.290
    8    HE1  MET  46           HE2      MET  46  27.310   0.162  -1.284
    9    HE3  MET  46           HE3      MET  46  27.432  -0.704   0.245

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ALA  47           H        ALA  47  21.897  -0.653   1.381
    2    HA   ALA  47           HA       ALA  47  21.863  -3.369   0.590
    3    HB2  ALA  47           HB1      ALA  47  21.470  -2.901   2.890
    4    HB3  ALA  47           HB2      ALA  47  19.940  -3.516   2.265
    5    HB1  ALA  47           HB3      ALA  47  20.158  -1.782   2.518

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LEU  48           H        LEU  48  19.498  -0.757   0.209
    2    HA   LEU  48           HA       LEU  48  17.468  -2.307  -1.046
    3    HB2  LEU  48           HB2      LEU  48  18.107   0.651  -1.169
    4    HB3  LEU  48           HB3      LEU  48  16.644  -0.070  -1.841
    5    HG   LEU  48           HG       LEU  48  17.484  -0.356   1.053
    6   HD13  LEU  48          HD11      LEU  48  17.055   1.942   0.855
    7   HD12  LEU  48          HD12      LEU  48  15.497   1.288   1.359
    8   HD11  LEU  48          HD13      LEU  48  15.775   1.705  -0.333
    9   HD22  LEU  48          HD21      LEU  48  15.966  -2.080   0.672
   10   HD21  LEU  48          HD22      LEU  48  15.094  -1.187  -0.574
   11   HD23  LEU  48          HD23      LEU  48  14.871  -0.776   1.126

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ASN  49           H        ASN  49  20.152  -0.370  -2.271
    2    HA   ASN  49           HA       ASN  49  19.515  -0.468  -4.998
    3    HB2  ASN  49           HB2      ASN  49  21.184   1.059  -4.066
    4    HB3  ASN  49           HB3      ASN  49  22.219  -0.297  -3.636
    5   HD21  ASN  49          HD21      ASN  49  23.204   1.722  -5.319
    6   HD22  ASN  49          HD22      ASN  49  23.394   1.103  -6.888

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLU  50           H        GLU  50  21.501  -2.644  -3.016
    2    HA   GLU  50           HA       GLU  50  22.221  -4.406  -5.131
    3    HB2  GLU  50           HB2      GLU  50  23.409  -4.365  -2.959
    4    HB3  GLU  50           HB3      GLU  50  21.965  -4.997  -2.167
    5    HG2  GLU  50           HG2      GLU  50  22.071  -7.035  -3.517
    6    HG3  GLU  50           HG3      GLU  50  23.448  -6.400  -4.414

  No H/Q in entry =           6
  In of MODEL   49
    1    H    ALA  51           H        ALA  51  19.554  -4.343  -2.818
    2    HA   ALA  51           HA       ALA  51  18.404  -6.825  -3.569
    3    HB3  ALA  51           HB1      ALA  51  16.801  -6.320  -2.024
    4    HB1  ALA  51           HB2      ALA  51  16.583  -4.678  -2.631
    5    HB2  ALA  51           HB3      ALA  51  17.939  -5.053  -1.567

  No H/Q in entry =           5
  In of MODEL   49
    1    H    HIS  52           H        HIS  52  17.806  -3.485  -4.622
    2    HA   HIS  52           HA       HIS  52  15.704  -4.030  -6.429
    3    HB2  HIS  52           HB2      HIS  52  16.340  -1.758  -5.635
    4    HB3  HIS  52           HB3      HIS  52  17.798  -1.852  -6.622
    5    HD1  HIS  52           HD1      HIS  52  17.427  -2.025  -9.258
    6    HD2  HIS  52           HD2      HIS  52  14.014  -1.100  -7.051
    7    HE1  HIS  52           HE1      HIS  52  15.718  -1.156 -10.913
    8    HE2  HIS  52           HE2      HIS  52  13.631  -0.587  -9.582

  No H/Q in entry =           8
  In of MODEL   49
    1    H    LEU  53           H        LEU  53  19.224  -4.020  -6.846
    2    HA   LEU  53           HA       LEU  53  19.296  -4.349  -9.644
    3    HB2  LEU  53           HB2      LEU  53  21.222  -5.091  -7.458
    4    HB3  LEU  53           HB3      LEU  53  21.549  -5.482  -9.144
    5    HG   LEU  53           HG       LEU  53  20.859  -2.673  -8.227
    6   HD11  LEU  53          HD11      LEU  53  23.562  -4.008  -8.539
    7   HD13  LEU  53          HD12      LEU  53  22.891  -3.295  -7.073
    8   HD12  LEU  53          HD13      LEU  53  23.335  -2.265  -8.428
    9   HD21  LEU  53          HD21      LEU  53  21.963  -3.901 -10.762
   10   HD23  LEU  53          HD22      LEU  53  22.263  -2.209 -10.374
   11   HD22  LEU  53          HD23      LEU  53  20.620  -2.777 -10.599

  No H/Q in entry =          11
  In of MODEL   49
    1    H    VAL  54           H        VAL  54  19.184  -6.723  -7.008
    2    HA   VAL  54           HA       VAL  54  19.327  -9.025  -8.656
    3    HB   VAL  54           HB       VAL  54  18.157  -8.594  -5.896
    4   HG12  VAL  54          HG11      VAL  54  18.496 -11.210  -5.878
    5   HG11  VAL  54          HG12      VAL  54  18.318 -11.051  -7.625
    6   HG13  VAL  54          HG13      VAL  54  17.021 -10.522  -6.555
    7   HG22  VAL  54          HG21      VAL  54  20.471  -8.370  -5.663
    8   HG21  VAL  54          HG22      VAL  54  20.820  -9.466  -6.998
    9   HG23  VAL  54          HG23      VAL  54  20.286 -10.109  -5.445

  No H/Q in entry =           9
  In of MODEL   49
    1    H    GLN  55           H        GLN  55  16.582  -7.131  -7.395
    2    HA   GLN  55           HA       GLN  55  14.575  -8.812  -8.470
    3    HB2  GLN  55           HB2      GLN  55  13.811  -7.282  -6.854
    4    HB3  GLN  55           HB3      GLN  55  14.600  -5.913  -7.633
    5    HG2  GLN  55           HG2      GLN  55  12.880  -5.606  -9.132
    6    HG3  GLN  55           HG3      GLN  55  12.569  -7.329  -9.295
    7   HE21  GLN  55          HE21      GLN  55  10.562  -7.886  -8.497
    8   HE22  GLN  55          HE22      GLN  55   9.778  -7.130  -7.196

  No H/Q in entry =           8
  In of MODEL   49
    1    H    THR  56           H        THR  56  16.305  -6.008  -9.835
    2    HA   THR  56           HA       THR  56  14.875  -5.666 -12.192
    3    HB   THR  56           HB       THR  56  17.874  -5.489 -11.794
    4    HG1  THR  56           HG1      THR  56  15.908  -3.456 -11.826
    5   HG21  THR  56          HG21      THR  56  16.057  -4.506 -14.004
    6   HG23  THR  56          HG22      THR  56  17.430  -5.602 -14.152
    7   HG22  THR  56          HG23      THR  56  17.698  -3.903 -13.757

  No H/Q in entry =           7
  In of MODEL   49
    1    H    LYS  57           H        LYS  57  17.536  -7.944 -11.557
    2    HA   LYS  57           HA       LYS  57  17.556  -9.152 -14.129
    3    HB2  LYS  57           HB2      LYS  57  19.339  -9.384 -12.372
    4    HB3  LYS  57           HB3      LYS  57  18.236 -10.385 -11.439
    5    HG2  LYS  57           HG2      LYS  57  18.143 -12.018 -13.277
    6    HG3  LYS  57           HG3      LYS  57  19.235 -11.021 -14.232
    7    HD2  LYS  57           HD2      LYS  57  19.947 -12.161 -11.514
    8    HD3  LYS  57           HD3      LYS  57  20.378 -12.929 -13.042
    9    HE2  LYS  57           HE2      LYS  57  22.287 -11.678 -12.824
   10    HE3  LYS  57           HE3      LYS  57  21.289 -10.393 -13.503
   11    HZ3  LYS  57           HZ1      LYS  57  21.123  -9.353 -11.532
   12    HZ2  LYS  57           HZ2      LYS  57  22.573 -10.173 -11.203
   13    HZ1  LYS  57           HZ3      LYS  57  21.098 -10.790 -10.632

  No H/Q in entry =          13
  In of MODEL   49
    1    H    LEU  58           H        LEU  58  15.766  -9.815 -11.158
    2    HA   LEU  58           HA       LEU  58  14.564 -12.201 -12.086
    3    HB2  LEU  58           HB2      LEU  58  13.747 -10.290  -9.904
    4    HB3  LEU  58           HB3      LEU  58  12.951 -11.834 -10.216
    5    HG   LEU  58           HG       LEU  58  15.920 -11.535  -9.650
    6   HD11  LEU  58          HD11      LEU  58  13.544 -11.958  -7.865
    7   HD13  LEU  58          HD12      LEU  58  14.990 -10.984  -7.601
    8   HD12  LEU  58          HD13      LEU  58  15.073 -12.739  -7.457
    9   HD22  LEU  58          HD21      LEU  58  15.820 -13.602 -10.667
   10   HD21  LEU  58          HD22      LEU  58  14.106 -13.821 -10.313
   11   HD23  LEU  58          HD23      LEU  58  15.311 -14.108  -9.057

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  59           H        ILE  59  13.874  -8.872 -12.789
    2    HA   ILE  59           HA       ILE  59  11.167  -9.543 -13.738
    3    HB   ILE  59           HB       ILE  59  11.952  -7.249 -12.541
    4   HG12  ILE  59          HG12      ILE  59  10.055  -7.145 -14.896
    5   HG13  ILE  59          HG13      ILE  59   9.635  -7.920 -13.390
    6   HG23  ILE  59          HG21      ILE  59  12.529  -5.534 -14.050
    7   HG22  ILE  59          HG22      ILE  59  12.030  -6.455 -15.450
    8   HG21  ILE  59          HG23      ILE  59  13.514  -6.869 -14.597
    9   HD11  ILE  59          HD11      ILE  59  10.163  -5.794 -12.185
   10   HD13  ILE  59          HD12      ILE  59   8.819  -5.638 -13.315
   11   HD12  ILE  59          HD13      ILE  59  10.414  -5.027 -13.754

  No H/Q in entry =          11
  In of MODEL   49
    1    H    GLU  60           H        GLU  60  14.371  -8.677 -14.986
    2    HA   GLU  60           HA       GLU  60  13.600  -8.296 -17.700
    3    HB2  GLU  60           HB2      GLU  60  15.775  -7.553 -16.815
    4    HB3  GLU  60           HB3      GLU  60  16.246  -9.230 -16.553
    5    HG2  GLU  60           HG2      GLU  60  16.034  -9.666 -18.981
    6    HG3  GLU  60           HG3      GLU  60  15.585  -7.981 -19.237

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLY  61           H        GLY  61  14.588 -11.161 -15.866
    2    HA3  GLY  61           HA2      GLY  61  14.068 -12.825 -18.261
    3    HA2  GLY  61           HA3      GLY  61  15.097 -13.292 -16.912

  No H/Q in entry =           3
  In of MODEL   49
    1    H    ASP  62           H        ASP  62  11.964 -11.766 -16.565
    2    HA   ASP  62           HA       ASP  62  10.846 -13.095 -14.588
    3    HB2  ASP  62           HB2      ASP  62   8.650 -12.843 -15.652
    4    HB3  ASP  62           HB3      ASP  62   9.650 -11.416 -15.903

  No H/Q in entry =           4
  In of MODEL   49
    1    H    ALA  63           H        ALA  63  10.939 -15.214 -13.995
    2    HA   ALA  63           HA       ALA  63  11.137 -17.377 -15.876
    3    HB2  ALA  63           HB1      ALA  63  10.864 -18.811 -13.865
    4    HB3  ALA  63           HB2      ALA  63  10.493 -17.374 -12.915
    5    HB1  ALA  63           HB3      ALA  63  12.092 -17.566 -13.634

  No H/Q in entry =           5
  In of MODEL   49
    1    H    GLY  64           H        GLY  64   9.605 -18.874 -16.475
    2    HA3  GLY  64           HA2      GLY  64   7.315 -19.795 -16.024
    3    HA2  GLY  64           HA3      GLY  64   6.793 -18.118 -15.968

  No H/Q in entry =           3
  In of MODEL   49
    1    H    GLU  65           H        GLU  65   5.403 -19.562 -17.684
    2    HA   GLU  65           HA       GLU  65   6.212 -20.247 -20.156
    3    HB2  GLU  65           HB2      GLU  65   3.759 -18.645 -19.444
    4    HB3  GLU  65           HB3      GLU  65   4.025 -19.378 -21.026
    5    HG2  GLU  65           HG2      GLU  65   4.202 -21.593 -20.007
    6    HG3  GLU  65           HG3      GLU  65   4.026 -20.891 -18.399

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLY  66           H        GLY  66   6.153 -19.255 -22.213
    2    HA3  GLY  66           HA2      GLY  66   7.890 -17.072 -22.514
    3    HA2  GLY  66           HA3      GLY  66   6.945 -17.817 -23.788

  No H/Q in entry =           3
  In of MODEL   49
    1    H    LYS  67           H        LYS  67   4.393 -17.241 -22.601
    2    HA   LYS  67           HA       LYS  67   3.877 -14.753 -23.781
    3    HB2  LYS  67           HB2      LYS  67   2.208 -16.465 -21.943
    4    HB3  LYS  67           HB3      LYS  67   1.595 -15.051 -22.810
    5    HG2  LYS  67           HG2      LYS  67   2.289 -16.052 -24.953
    6    HG3  LYS  67           HG3      LYS  67   2.919 -17.458 -24.099
    7    HD2  LYS  67           HD2      LYS  67   0.658 -17.973 -23.265
    8    HD3  LYS  67           HD3      LYS  67   0.023 -16.561 -24.114
    9    HE2  LYS  67           HE2      LYS  67   0.780 -17.509 -26.264
   10    HE3  LYS  67           HE3      LYS  67   1.409 -18.922 -25.419
   11    HZ1  LYS  67           HZ1      LYS  67  -0.844 -19.368 -24.615
   12    HZ3  LYS  67           HZ2      LYS  67  -0.759 -19.391 -26.309
   13    HZ2  LYS  67           HZ3      LYS  67  -1.426 -18.049 -25.508

  No H/Q in entry =          13
  In of MODEL   49
    1    H    MET  68           H        MET  68   1.996 -13.631 -22.066
    2    HA   MET  68           HA       MET  68   3.470 -11.635 -20.776
    3    HB2  MET  68           HB2      MET  68   0.590 -12.456 -20.762
    4    HB3  MET  68           HB3      MET  68   1.153 -11.166 -19.699
    5    HG2  MET  68           HG2      MET  68   0.429 -10.125 -21.743
    6    HG3  MET  68           HG3      MET  68   2.192 -10.073 -21.733
    7    HE1  MET  68           HE1      MET  68   1.192  -9.477 -24.352
    8    HE3  MET  68           HE2      MET  68   1.995 -10.625 -25.419
    9    HE2  MET  68           HE3      MET  68   2.878  -9.929 -24.063

  No H/Q in entry =           9
  In of MODEL   49
    1    H    LYS  69           H        LYS  69   2.047 -14.597 -19.415
    2    HA   LYS  69           HA       LYS  69   2.084 -13.920 -16.723
    3    HB2  LYS  69           HB2      LYS  69   0.992 -15.920 -17.659
    4    HB3  LYS  69           HB3      LYS  69   2.578 -16.662 -17.886
    5    HG2  LYS  69           HG2      LYS  69   3.026 -16.506 -15.481
    6    HG3  LYS  69           HG3      LYS  69   1.478 -15.698 -15.229
    7    HD2  LYS  69           HD2      LYS  69   0.303 -17.704 -16.071
    8    HD3  LYS  69           HD3      LYS  69   1.856 -18.515 -16.290
    9    HE2  LYS  69           HE2      LYS  69   2.321 -18.310 -13.886
   10    HE3  LYS  69           HE3      LYS  69   0.796 -17.459 -13.653
   11    HZ3  LYS  69           HZ1      LYS  69   0.169 -19.575 -13.157
   12    HZ2  LYS  69           HZ2      LYS  69   1.278 -20.289 -14.227
   13    HZ1  LYS  69           HZ3      LYS  69  -0.146 -19.582 -14.823

  No H/Q in entry =          13
  In of MODEL   49
    1    H    VAL  70           H        VAL  70   3.495 -13.914 -15.036
    2    HA   VAL  70           HA       VAL  70   6.302 -14.715 -15.551
    3    HB   VAL  70           HB       VAL  70   6.978 -12.758 -14.157
    4   HG12  VAL  70          HG11      VAL  70   5.301 -11.712 -16.420
    5   HG11  VAL  70          HG12      VAL  70   6.638 -12.809 -16.766
    6   HG13  VAL  70          HG13      VAL  70   6.946 -11.271 -15.962
    7   HG23  VAL  70          HG21      VAL  70   5.055 -10.937 -14.092
    8   HG22  VAL  70          HG22      VAL  70   5.141 -12.169 -12.835
    9   HG21  VAL  70          HG23      VAL  70   3.992 -12.342 -14.161

  No H/Q in entry =           9
  In of MODEL   49
    1    H    SER  71           H        SER  71   7.501 -14.701 -13.327
    2    HA   SER  71           HA       SER  71   6.434 -16.722 -11.675
    3    HB2  SER  71           HB2      SER  71   8.855 -16.171 -11.834
    4    HB3  SER  71           HB3      SER  71   8.545 -14.667 -10.968
    5    HG   SER  71           HG       SER  71   7.904 -17.268 -10.019

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LEU  72           H        LEU  72   5.084 -16.651  -9.947
    2    HA   LEU  72           HA       LEU  72   3.518 -14.346  -9.521
    3    HB2  LEU  72           HB2      LEU  72   3.814 -16.894  -7.938
    4    HB3  LEU  72           HB3      LEU  72   2.636 -15.642  -7.549
    5    HG   LEU  72           HG       LEU  72   2.814 -16.944 -10.285
    6   HD13  LEU  72          HD11      LEU  72   0.968 -18.371  -9.610
    7   HD12  LEU  72          HD12      LEU  72   0.900 -17.598  -8.028
    8   HD11  LEU  72          HD13      LEU  72   2.291 -18.591  -8.463
    9   HD22  LEU  72          HD21      LEU  72   1.579 -14.957 -10.528
   10   HD21  LEU  72          HD22      LEU  72   0.880 -15.065  -8.920
   11   HD23  LEU  72          HD23      LEU  72   0.318 -16.140 -10.197

  No H/Q in entry =          11
  In of MODEL   49
    1    H    VAL  73           H        VAL  73   6.174 -15.757  -7.728
    2    HA   VAL  73           HA       VAL  73   6.091 -14.214  -5.403
    3    HB   VAL  73           HB       VAL  73   8.287 -14.999  -4.968
    4   HG13  VAL  73          HG11      VAL  73   8.016 -17.345  -5.285
    5   HG12  VAL  73          HG12      VAL  73   7.086 -17.112  -6.765
    6   HG11  VAL  73          HG13      VAL  73   6.382 -16.692  -5.204
    7   HG22  VAL  73          HG21      VAL  73   9.619 -14.462  -6.796
    8   HG21  VAL  73          HG22      VAL  73   8.456 -15.094  -7.960
    9   HG23  VAL  73          HG23      VAL  73   9.451 -16.204  -7.017

  No H/Q in entry =           9
  In of MODEL   49
    1    H    LEU  74           H        LEU  74   7.092 -13.328  -8.578
    2    HA   LEU  74           HA       LEU  74   9.022 -11.365  -8.083
    3    HB2  LEU  74           HB2      LEU  74   8.592 -12.119 -10.320
    4    HB3  LEU  74           HB3      LEU  74   6.916 -11.580 -10.232
    5    HG   LEU  74           HG       LEU  74   7.683  -9.238 -10.020
    6   HD11  LEU  74          HD11      LEU  74  10.387 -10.581 -10.128
    7   HD13  LEU  74          HD12      LEU  74   9.799  -9.403  -8.955
    8   HD12  LEU  74          HD13      LEU  74  10.177  -8.896 -10.601
    9   HD21  LEU  74          HD21      LEU  74   7.459 -10.673 -12.236
   10   HD23  LEU  74          HD22      LEU  74   9.172 -10.328 -12.327
   11   HD22  LEU  74          HD23      LEU  74   8.028  -9.005 -12.278

  No H/Q in entry =          11
  In of MODEL   49
    1    H    VAL  75           H        VAL  75   5.526 -11.004  -8.458
    2    HA   VAL  75           HA       VAL  75   5.409  -8.246  -7.884
    3    HB   VAL  75           HB       VAL  75   3.335 -10.407  -7.513
    4   HG13  VAL  75          HG11      VAL  75   2.830  -8.508  -6.019
    5   HG12  VAL  75          HG12      VAL  75   1.744  -8.473  -7.400
    6   HG11  VAL  75          HG13      VAL  75   3.114  -7.376  -7.338
    7   HG21  VAL  75          HG21      VAL  75   4.165  -9.907  -9.833
    8   HG23  VAL  75          HG22      VAL  75   3.671  -8.231  -9.606
    9   HG22  VAL  75          HG23      VAL  75   2.461  -9.515  -9.610

  No H/Q in entry =           9
  In of MODEL   49
    1    H    GLU  76           H        GLU  76   5.162 -11.115  -5.763
    2    HA   GLU  76           HA       GLU  76   4.669  -9.746  -3.350
    3    HB2  GLU  76           HB2      GLU  76   4.515 -12.218  -3.583
    4    HB3  GLU  76           HB3      GLU  76   6.255 -12.301  -3.796
    5    HG2  GLU  76           HG2      GLU  76   5.803 -12.873  -1.504
    6    HG3  GLU  76           HG3      GLU  76   6.505 -11.267  -1.485

  No H/Q in entry =           6
  In of MODEL   49
    1    H    ALA  77           H        ALA  77   7.743 -10.641  -4.891
    2    HA   ALA  77           HA       ALA  77   9.414  -9.578  -2.870
    3    HB2  ALA  77           HB1      ALA  77  11.185  -9.641  -4.573
    4    HB3  ALA  77           HB2      ALA  77   9.972  -9.890  -5.829
    5    HB1  ALA  77           HB3      ALA  77  10.233 -11.125  -4.598

  No H/Q in entry =           5
  In of MODEL   49
    1    H    GLN  78           H        GLN  78   8.031  -8.182  -5.798
    2    HA   GLN  78           HA       GLN  78   9.368  -5.694  -5.697
    3    HB2  GLN  78           HB2      GLN  78   8.093  -6.621  -7.660
    4    HB3  GLN  78           HB3      GLN  78   6.601  -6.257  -6.796
    5    HG2  GLN  78           HG2      GLN  78   7.226  -3.880  -6.703
    6    HG3  GLN  78           HG3      GLN  78   8.724  -4.236  -7.560
    7   HE21  GLN  78          HE21      GLN  78   6.735  -2.444  -8.642
    8   HE22  GLN  78          HE22      GLN  78   6.090  -3.165 -10.037

  No H/Q in entry =           8
  In of MODEL   49
    1    H    LEU  79           H        LEU  79   6.347  -6.843  -4.281
    2    HA   LEU  79           HA       LEU  79   5.332  -4.438  -3.289
    3    HB2  LEU  79           HB2      LEU  79   4.029  -6.496  -3.233
    4    HB3  LEU  79           HB3      LEU  79   5.171  -7.224  -2.107
    5    HG   LEU  79           HG       LEU  79   4.598  -5.578  -0.391
    6   HD13  LEU  79          HD11      LEU  79   4.128  -3.570  -1.453
    7   HD12  LEU  79          HD12      LEU  79   2.503  -4.103  -1.023
    8   HD11  LEU  79          HD13      LEU  79   3.096  -4.330  -2.666
    9   HD23  LEU  79          HD21      LEU  79   2.014  -6.084  -0.316
   10   HD22  LEU  79          HD22      LEU  79   3.160  -7.416  -0.193
   11   HD21  LEU  79          HD23      LEU  79   2.355  -7.091  -1.725

  No H/Q in entry =          11
  In of MODEL   49
    1    H    HIS  80           H        HIS  80   7.517  -6.754  -1.681
    2    HA   HIS  80           HA       HIS  80   7.781  -5.199   0.683
    3    HB2  HIS  80           HB2      HIS  80   9.140  -7.561  -0.496
    4    HB3  HIS  80           HB3      HIS  80  10.037  -6.654   0.723
    5    HD1  HIS  80           HD1      HIS  80   9.534  -7.282   3.065
    6    HD2  HIS  80           HD2      HIS  80   6.339  -8.161   0.535
    7    HE1  HIS  80           HE1      HIS  80   7.758  -8.388   4.506
    8    HE2  HIS  80           HE2      HIS  80   5.804  -8.928   2.972

  No H/Q in entry =           8
  In of MODEL   49
    1    H    LEU  81           H        LEU  81   9.808  -5.477  -2.214
    2    HA   LEU  81           HA       LEU  81  11.837  -3.722  -1.329
    3    HB2  LEU  81           HB2      LEU  81  10.939  -4.532  -4.095
    4    HB3  LEU  81           HB3      LEU  81  12.352  -3.517  -3.799
    5    HG   LEU  81           HG       LEU  81  11.964  -6.234  -2.516
    6   HD12  LEU  81          HD11      LEU  81  13.796  -6.859  -4.250
    7   HD11  LEU  81          HD12      LEU  81  13.229  -5.442  -5.132
    8   HD13  LEU  81          HD13      LEU  81  12.122  -6.770  -4.796
    9   HD23  LEU  81          HD21      LEU  81  14.591  -5.906  -2.485
   10   HD22  LEU  81          HD22      LEU  81  13.596  -5.145  -1.245
   11   HD21  LEU  81          HD23      LEU  81  14.179  -4.196  -2.612

  No H/Q in entry =          11
  In of MODEL   49
    1    H    MET  82           H        MET  82   8.925  -3.108  -3.289
    2    HA   MET  82           HA       MET  82   9.455  -0.382  -3.799
    3    HB2  MET  82           HB2      MET  82   6.902  -1.988  -3.685
    4    HB3  MET  82           HB3      MET  82   6.896  -0.265  -4.057
    5    HG2  MET  82           HG2      MET  82   8.518  -2.338  -5.571
    6    HG3  MET  82           HG3      MET  82   6.951  -1.725  -6.098
    7    HE3  MET  82           HE1      MET  82   7.392   1.727  -7.282
    8    HE2  MET  82           HE2      MET  82   7.006   1.506  -5.577
    9    HE1  MET  82           HE3      MET  82   6.355   0.388  -6.771

  No H/Q in entry =           9
  In of MODEL   49
    1    H    THR  83           H        THR  83   7.652  -1.977  -1.199
    2    HA   THR  83           HA       THR  83   6.781   0.373   0.110
    3    HB   THR  83           HB       THR  83   6.639  -1.193   2.134
    4    HG1  THR  83           HG1      THR  83   7.406  -3.141   1.919
    5   HG22  THR  83          HG21      THR  83   5.003  -2.773   0.661
    6   HG21  THR  83          HG22      THR  83   5.232  -1.448  -0.475
    7   HG23  THR  83          HG23      THR  83   4.579  -1.129   1.132

  No H/Q in entry =           7
  In of MODEL   49
    1    H    SER  84           H        SER  84   9.610  -1.710   0.661
    2    HA   SER  84           HA       SER  84  10.647  -0.266   2.850
    3    HB2  SER  84           HB2      SER  84  11.923  -2.112   0.843
    4    HB3  SER  84           HB3      SER  84  12.857  -1.349   2.128
    5    HG   SER  84           HG       SER  84  10.587  -3.047   2.378

  No H/Q in entry =           5
  In of MODEL   49
    1    H    MET  85           H        MET  85  11.424  -0.017  -0.633
    2    HA   MET  85           HA       MET  85  13.413   1.957  -0.377
    3    HB2  MET  85           HB2      MET  85  13.038   0.665  -2.439
    4    HB3  MET  85           HB3      MET  85  11.508   1.510  -2.684
    5    HG2  MET  85           HG2      MET  85  12.687   3.658  -2.826
    6    HG3  MET  85           HG3      MET  85  14.222   2.851  -2.515
    7    HE1  MET  85           HE1      MET  85  11.150   3.103  -4.449
    8    HE3  MET  85           HE2      MET  85  11.234   1.519  -5.214
    9    HE2  MET  85           HE3      MET  85  11.589   2.960  -6.159

  No H/Q in entry =           9
  In of MODEL   49
    1    H    LEU  86           H        LEU  86   9.926   2.276  -0.912
    2    HA   LEU  86           HA       LEU  86   9.852   5.088  -1.107
    3    HB2  LEU  86           HB2      LEU  86   8.019   3.419  -1.689
    4    HB3  LEU  86           HB3      LEU  86   7.676   3.335   0.039
    5    HG   LEU  86           HG       LEU  86   7.506   5.895  -0.026
    6   HD11  LEU  86          HD11      LEU  86   8.303   5.450  -2.720
    7   HD13  LEU  86          HD12      LEU  86   7.856   6.980  -1.969
    8   HD12  LEU  86          HD13      LEU  86   6.629   6.008  -2.779
    9   HD23  LEU  86          HD21      LEU  86   5.390   4.527  -1.698
   10   HD22  LEU  86          HD22      LEU  86   5.186   5.792  -0.489
   11   HD21  LEU  86          HD23      LEU  86   5.588   4.151   0.015

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ALA  87           H        ALA  87   9.374   2.920   1.645
    2    HA   ALA  87           HA       ALA  87   8.805   4.841   3.602
    3    HB1  ALA  87           HB1      ALA  87   9.623   2.023   3.534
    4    HB3  ALA  87           HB2      ALA  87   8.487   2.836   4.608
    5    HB2  ALA  87           HB3      ALA  87  10.213   2.875   4.964

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ARG  88           H        ARG  88  11.900   3.423   2.650
    2    HA   ARG  88           HA       ARG  88  13.492   4.815   4.488
    3    HB2  ARG  88           HB2      ARG  88  14.177   2.838   3.098
    4    HB3  ARG  88           HB3      ARG  88  14.335   3.925   1.721
    5    HG2  ARG  88           HG2      ARG  88  15.790   5.253   3.672
    6    HG3  ARG  88           HG3      ARG  88  16.114   3.566   4.061
    7    HD2  ARG  88           HD2      ARG  88  17.395   3.266   2.224
    8    HD3  ARG  88           HD3      ARG  88  16.262   4.129   1.179
    9    HE   ARG  88           HE       ARG  88  18.646   5.206   2.239
   10   HH21  ARG  88          HH11      ARG  88  18.985   7.425   2.037
   11   HH22  ARG  88          HH12      ARG  88  17.631   8.491   1.879
   12   HH11  ARG  88          HH21      ARG  88  15.306   5.946   1.934
   13   HH12  ARG  88          HH22      ARG  88  15.547   7.651   1.796

  No H/Q in entry =          13
  In of MODEL   49
    1    H    GLU  89           H        GLU  89  12.539   5.695   1.154
    2    HA   GLU  89           HA       GLU  89  14.078   8.059   0.998
    3    HB2  GLU  89           HB2      GLU  89  12.951   7.006  -0.954
    4    HB3  GLU  89           HB3      GLU  89  11.400   7.544  -0.309
    5    HG2  GLU  89           HG2      GLU  89  12.095   9.884  -0.477
    6    HG3  GLU  89           HG3      GLU  89  13.704   9.396  -1.000

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LEU  90           H        LEU  90  10.743   7.543   2.106
    2    HA   LEU  90           HA       LEU  90  10.214  10.277   2.666
    3    HB2  LEU  90           HB2      LEU  90   9.022   7.704   3.696
    4    HB3  LEU  90           HB3      LEU  90   8.382   9.299   4.108
    5    HG   LEU  90           HG       LEU  90   8.823   8.408   1.246
    6   HD12  LEU  90          HD11      LEU  90   6.290   8.070   1.292
    7   HD11  LEU  90          HD12      LEU  90   6.433   8.068   3.050
    8   HD13  LEU  90          HD13      LEU  90   7.262   6.837   2.096
    9   HD22  LEU  90          HD21      LEU  90   8.522  10.714   1.160
   10   HD21  LEU  90          HD22      LEU  90   7.525  10.750   2.613
   11   HD23  LEU  90          HD23      LEU  90   6.840  10.185   1.089

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  91           H        ILE  91  11.473   7.609   4.609
    2    HA   ILE  91           HA       ILE  91  11.592   8.985   7.072
    3    HB   ILE  91           HB       ILE  91  13.162   6.647   5.969
    4   HG12  ILE  91          HG12      ILE  91  11.130   6.817   8.214
    5   HG13  ILE  91          HG13      ILE  91  10.672   6.527   6.536
    6   HG22  ILE  91          HG21      ILE  91  13.614   6.447   8.614
    7   HG21  ILE  91          HG22      ILE  91  13.533   8.205   8.504
    8   HG23  ILE  91          HG23      ILE  91  14.721   7.317   7.552
    9   HD13  ILE  91          HD11      ILE  91  11.682   4.429   6.482
   10   HD12  ILE  91          HD12      ILE  91  11.077   4.492   8.138
   11   HD11  ILE  91          HD13      ILE  91  12.780   4.810   7.810

  No H/Q in entry =          11
  In of MODEL   49
    1    H    THR  92           H        THR  92  13.828   8.812   4.336
    2    HA   THR  92           HA       THR  92  15.981  10.218   5.504
    3    HB   THR  92           HB       THR  92  15.014  10.077   2.637
    4    HG1  THR  92           HG1      THR  92  15.850   8.184   3.056
    5   HG22  THR  92          HG21      THR  92  17.584  10.775   2.358
    6   HG21  THR  92          HG22      THR  92  17.262  11.602   3.882
    7   HG23  THR  92          HG23      THR  92  16.300  11.979   2.453

  No H/Q in entry =           7
  In of MODEL   49
    1    H    GLU  93           H        GLU  93  13.101  11.353   3.750
    2    HA   GLU  93           HA       GLU  93  13.685  14.117   3.856
    3    HB2  GLU  93           HB2      GLU  93  10.986  12.734   3.858
    4    HB3  GLU  93           HB3      GLU  93  11.270  14.433   3.481
    5    HG2  GLU  93           HG2      GLU  93  12.626  12.189   1.972
    6    HG3  GLU  93           HG3      GLU  93  11.081  12.864   1.472

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LEU  94           H        LEU  94  11.935  11.964   6.065
    2    HA   LEU  94           HA       LEU  94  11.106  13.915   7.927
    3    HB2  LEU  94           HB2      LEU  94  11.691  10.964   8.218
    4    HB3  LEU  94           HB3      LEU  94  11.107  11.943   9.560
    5    HG   LEU  94           HG       LEU  94   9.640  11.978   6.922
    6   HD11  LEU  94          HD11      LEU  94   9.718   9.766   8.936
    7   HD13  LEU  94          HD12      LEU  94   9.428   9.696   7.200
    8   HD12  LEU  94          HD13      LEU  94   8.140  10.213   8.287
    9   HD23  LEU  94          HD21      LEU  94   7.709  12.377   8.507
   10   HD22  LEU  94          HD22      LEU  94   8.943  13.636   8.547
   11   HD21  LEU  94          HD23      LEU  94   8.876  12.425   9.826

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  95           H        ILE  95  14.089  11.996   7.719
    2    HA   ILE  95           HA       ILE  95  15.237  12.932  10.136
    3    HB   ILE  95           HB       ILE  95  16.496  11.857   7.601
    4   HG12  ILE  95          HG12      ILE  95  16.187  10.667  10.372
    5   HG13  ILE  95          HG13      ILE  95  15.030  10.399   9.070
    6   HG21  ILE  95          HG21      ILE  95  17.731  12.680  10.248
    7   HG23  ILE  95          HG22      ILE  95  18.203  13.202   8.629
    8   HG22  ILE  95          HG23      ILE  95  18.512  11.546   9.147
    9   HD13  ILE  95          HD11      ILE  95  16.523   9.120   7.822
   10   HD12  ILE  95          HD12      ILE  95  16.986   8.680   9.463
   11   HD11  ILE  95          HD13      ILE  95  17.941   9.859   8.565

  No H/Q in entry =          11
  In of MODEL   49
    1    H    GLU  96           H        GLU  96  15.409  14.152   6.798
    2    HA   GLU  96           HA       GLU  96  17.245  16.239   7.277
    3    HB2  GLU  96           HB2      GLU  96  16.597  15.565   5.017
    4    HB3  GLU  96           HB3      GLU  96  14.950  16.117   5.304
    5    HG2  GLU  96           HG2      GLU  96  15.512  18.246   4.756
    6    HG3  GLU  96           HG3      GLU  96  16.803  18.256   5.947

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LEU  97           H        LEU  97  13.731  16.041   7.685
    2    HA   LEU  97           HA       LEU  97  13.301  18.776   8.312
    3    HB2  LEU  97           HB2      LEU  97  11.788  16.248   8.927
    4    HB3  LEU  97           HB3      LEU  97  11.265  17.796   9.589
    5    HG   LEU  97           HG       LEU  97  11.769  17.369   6.629
    6   HD12  LEU  97          HD11      LEU  97   9.247  17.231   6.495
    7   HD11  LEU  97          HD12      LEU  97   9.229  17.039   8.246
    8   HD13  LEU  97          HD13      LEU  97  10.021  15.830   7.234
    9   HD23  LEU  97          HD21      LEU  97  10.024  19.327   6.642
   10   HD22  LEU  97          HD22      LEU  97  11.701  19.694   7.043
   11   HD21  LEU  97          HD23      LEU  97  10.505  19.525   8.326

  No H/Q in entry =          11
  In of MODEL   49
    1    H    HIS  98           H        HIS  98  14.120  15.962  10.325
    2    HA   HIS  98           HA       HIS  98  13.942  17.233  12.835
    3    HB2  HIS  98           HB2      HIS  98  15.706  14.978  11.854
    4    HB3  HIS  98           HB3      HIS  98  15.691  15.523  13.533
    5    HD1  HIS  98           HD1      HIS  98  13.515  13.875  10.934
    6    HD2  HIS  98           HD2      HIS  98  13.378  14.812  14.994
    7    HE1  HIS  98           HE1      HIS  98  11.488  12.677  11.878
    8    HE2  HIS  98           HE2      HIS  98  11.385  13.239  14.347

  No H/Q in entry =           8
  In of MODEL   49
    1    H    GLU  99           H        GLU  99  16.511  17.116  10.417
    2    HA   GLU  99           HA       GLU  99  18.482  18.461  11.953
    3    HB2  GLU  99           HB2      GLU  99  18.979  17.166   9.892
    4    HB3  GLU  99           HB3      GLU  99  18.171  18.415   8.941
    5    HG2  GLU  99           HG2      GLU  99  19.768  20.094   9.734
    6    HG3  GLU  99           HG3      GLU  99  20.545  18.899  10.768

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LYS 100           H        LYS 100  15.969  19.606   9.715
    2    HA   LYS 100           HA       LYS 100  16.756  22.346   9.853
    3    HB2  LYS 100           HB2      LYS 100  14.132  21.045   9.087
    4    HB3  LYS 100           HB3      LYS 100  14.427  22.784   8.991
    5    HG2  LYS 100           HG2      LYS 100  16.410  22.336   7.539
    6    HG3  LYS 100           HG3      LYS 100  16.002  20.618   7.561
    7    HD2  LYS 100           HD2      LYS 100  13.811  21.116   6.545
    8    HD3  LYS 100           HD3      LYS 100  14.202  22.836   6.529
    9    HE2  LYS 100           HE2      LYS 100  16.172  22.356   5.084
   10    HE3  LYS 100           HE3      LYS 100  15.712  20.649   5.055
   11    HZ1  LYS 100           HZ1      LYS 100  13.886  22.833   4.200
   12    HZ3  LYS 100           HZ2      LYS 100  13.708  21.162   3.943
   13    HZ2  LYS 100           HZ3      LYS 100  14.922  22.024   3.126

  No H/Q in entry =          13
  In of MODEL   49
    1    H    LEU 101           H        LEU 101  14.653  20.302  11.813
    2    HA   LEU 101           HA       LEU 101  13.470  22.373  13.375
    3    HB2  LEU 101           HB2      LEU 101  13.919  19.426  13.774
    4    HB3  LEU 101           HB3      LEU 101  13.371  20.411  15.128
    5    HG   LEU 101           HG       LEU 101  11.970  20.484  12.450
    6   HD12  LEU 101          HD11      LEU 101  10.307  18.920  13.715
    7   HD11  LEU 101          HD12      LEU 101  11.697  18.516  14.720
    8   HD13  LEU 101          HD13      LEU 101  11.742  18.202  12.984
    9   HD21  LEU 101          HD21      LEU 101  11.293  21.287  15.294
   10   HD23  LEU 101          HD22      LEU 101  10.040  21.052  14.077
   11   HD22  LEU 101          HD23      LEU 101  11.273  22.290  13.842

  No H/Q in entry =          11
  In of MODEL   49
    1    H    LYS 102           H        LYS 102  16.622  21.773  12.961
    2    HA   LYS 102           HA       LYS 102  18.459  22.653  14.042
    3    HB2  LYS 102           HB2      LYS 102  16.634  24.168  15.157
    4    HB3  LYS 102           HB3      LYS 102  16.836  23.111  16.540
    5    HG2  LYS 102           HG2      LYS 102  18.730  25.123  15.374
    6    HG3  LYS 102           HG3      LYS 102  18.339  24.815  17.052
    7    HD2  LYS 102           HD2      LYS 102  20.021  22.900  15.385
    8    HD3  LYS 102           HD3      LYS 102  20.701  24.228  16.316
    9    HE2  LYS 102           HE2      LYS 102  20.304  21.682  17.293
   10    HE3  LYS 102           HE3      LYS 102  20.512  23.128  18.279
   11    HZ2  LYS 102           HZ1      LYS 102  18.543  21.841  18.891
   12    HZ1  LYS 102           HZ2      LYS 102  17.908  22.063  17.337
   13    HZ3  LYS 102           HZ3      LYS 102  18.129  23.398  18.358

  No H/Q in entry =          13
  In of MODEL   49
    1    H    ALA 103           H        ALA 103  16.377  21.052  16.457
    2    HA   ALA 103           HA       ALA 103  18.097  19.853  18.128
    3    HB2  ALA 103           HB1      ALA 103  16.518  17.841  18.121
    4    HB1  ALA 103           HB2      ALA 103  15.628  18.687  16.854
    5    HB3  ALA 103           HB3      ALA 103  15.794  19.415  18.451

  No H/Q in entry =           5
  In of MODEL   49
    1    H1   ALA   1           H3       ALA   1  -1.512  -7.217 -21.505
    2    H2   ALA   1           H2       ALA   1  -2.306  -8.652 -21.051
    3    H3   ALA   1           H1       ALA   1  -0.695  -8.701 -21.596
    4    HA   ALA   1           HA       ALA   1  -1.515  -9.180 -23.595
    5    HB1  ALA   1           HB1      ALA   1  -3.653  -9.901 -23.132
    6    HB2  ALA   1           HB2      ALA   1  -4.090  -8.395 -23.939
    7    HB3  ALA   1           HB3      ALA   1  -4.041  -8.468 -22.179

  No H/Q in entry =           7
  In of MODEL   49
    1    H    GLU   2           H        GLU   2  -2.335  -7.999 -25.595
    2    HA   GLU   2           HA       GLU   2  -0.935  -5.986 -26.471
    3    HB2  GLU   2           HB2      GLU   2  -3.940  -6.061 -26.808
    4    HB3  GLU   2           HB3      GLU   2  -2.814  -5.200 -27.854
    5    HG2  GLU   2           HG2      GLU   2  -2.300  -7.093 -28.998
    6    HG3  GLU   2           HG3      GLU   2  -2.010  -7.992 -27.515

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLU   3           H        GLU   3  -4.104  -4.732 -25.597
    2    HA   GLU   3           HA       GLU   3  -3.067  -2.172 -24.972
    3    HB2  GLU   3           HB2      GLU   3  -5.754  -3.491 -24.652
    4    HB3  GLU   3           HB3      GLU   3  -5.464  -1.872 -24.010
    5    HG2  GLU   3           HG2      GLU   3  -5.096  -0.953 -26.137
    6    HG3  GLU   3           HG3      GLU   3  -4.693  -2.510 -26.853

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LEU   4           H        LEU   4  -4.666  -4.525 -22.793
    2    HA   LEU   4           HA       LEU   4  -4.320  -3.287 -20.404
    3    HB2  LEU   4           HB2      LEU   4  -3.768  -6.229 -20.859
    4    HB3  LEU   4           HB3      LEU   4  -4.185  -5.478 -19.321
    5    HG   LEU   4           HG       LEU   4  -5.942  -5.565 -21.796
    6   HD13  LEU   4          HD11      LEU   4  -7.138  -7.281 -20.799
    7   HD12  LEU   4          HD12      LEU   4  -6.664  -6.814 -19.166
    8   HD11  LEU   4          HD13      LEU   4  -5.520  -7.659 -20.207
    9   HD23  LEU   4          HD21      LEU   4  -7.640  -4.750 -19.942
   10   HD22  LEU   4          HD22      LEU   4  -6.599  -3.580 -20.751
   11   HD21  LEU   4          HD23      LEU   4  -6.182  -4.163 -19.140

  No H/Q in entry =          11
  In of MODEL   49
    1    H    GLU   5           H        GLU   5  -1.807  -5.132 -22.112
    2    HA   GLU   5           HA       GLU   5   0.163  -4.835 -20.063
    3    HB2  GLU   5           HB2      GLU   5   0.254  -6.615 -21.796
    4    HB3  GLU   5           HB3      GLU   5   0.547  -5.382 -23.021
    5    HG2  GLU   5           HG2      GLU   5   2.607  -4.701 -21.866
    6    HG3  GLU   5           HG3      GLU   5   2.315  -5.904 -20.611

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLU   6           H        GLU   6  -0.456  -3.135 -23.119
    2    HA   GLU   6           HA       GLU   6   1.708  -1.298 -22.844
    3    HB2  GLU   6           HB2      GLU   6   0.610  -1.782 -25.012
    4    HB3  GLU   6           HB3      GLU   6  -0.862  -1.011 -24.421
    5    HG2  GLU   6           HG2      GLU   6   0.350   1.106 -24.119
    6    HG3  GLU   6           HG3      GLU   6   1.838   0.343 -24.674

  No H/Q in entry =           6
  In of MODEL   49
    1    H    VAL   7           H        VAL   7  -1.637  -1.372 -21.821
    2    HA   VAL   7           HA       VAL   7  -1.869   1.343 -20.996
    3    HB   VAL   7           HB       VAL   7  -3.332  -1.174 -20.160
    4   HG11  VAL   7          HG11      VAL   7  -3.718   1.717 -19.359
    5   HG13  VAL   7          HG12      VAL   7  -3.622   0.296 -18.318
    6   HG12  VAL   7          HG13      VAL   7  -5.049   0.559 -19.320
    7   HG21  VAL   7          HG21      VAL   7  -3.475  -0.108 -22.553
    8   HG23  VAL   7          HG22      VAL   7  -4.429   1.142 -21.752
    9   HG22  VAL   7          HG23      VAL   7  -4.971  -0.536 -21.722

  No H/Q in entry =           9
  In of MODEL   49
    1    H    VAL   8           H        VAL   8  -0.886  -1.634 -19.335
    2    HA   VAL   8           HA       VAL   8  -0.587  -0.543 -16.742
    3    HB   VAL   8           HB       VAL   8   0.829  -2.862 -18.080
    4   HG13  VAL   8          HG11      VAL   8   2.221  -2.155 -16.261
    5   HG12  VAL   8          HG12      VAL   8   1.287  -3.527 -15.661
    6   HG11  VAL   8          HG13      VAL   8   0.829  -1.884 -15.214
    7   HG23  VAL   8          HG21      VAL   8  -1.148  -3.299 -15.899
    8   HG22  VAL   8          HG22      VAL   8  -0.945  -4.163 -17.419
    9   HG21  VAL   8          HG23      VAL   8  -1.832  -2.644 -17.385

  No H/Q in entry =           9
  In of MODEL   49
    1    H    MET   9           H        MET   9   1.680  -0.850 -19.473
    2    HA   MET   9           HA       MET   9   3.956   0.202 -18.201
    3    HB2  MET   9           HB2      MET   9   3.021   0.170 -21.064
    4    HB3  MET   9           HB3      MET   9   4.501   1.012 -20.608
    5    HG2  MET   9           HG2      MET   9   5.544  -0.974 -19.866
    6    HG3  MET   9           HG3      MET   9   4.010  -1.841 -19.760
    7    HE2  MET   9           HE1      MET   9   5.606  -0.267 -23.762
    8    HE1  MET   9           HE2      MET   9   5.948   0.394 -22.166
    9    HE3  MET   9           HE3      MET   9   4.321   0.510 -22.830

  No H/Q in entry =           9
  In of MODEL   49
    1    H    GLY  10           H        GLY  10   1.280   1.793 -19.902
    2    HA3  GLY  10           HA2      GLY  10   2.238   4.449 -19.662
    3    HA2  GLY  10           HA3      GLY  10   0.551   3.986 -19.875

  No H/Q in entry =           3
  In of MODEL   49
    1    H    LEU  11           H        LEU  11   0.139   2.467 -17.586
    2    HA   LEU  11           HA       LEU  11  -0.405   4.450 -15.637
    3    HB2  LEU  11           HB2      LEU  11  -0.336   1.435 -15.469
    4    HB3  LEU  11           HB3      LEU  11  -0.854   2.463 -14.134
    5    HG   LEU  11           HG       LEU  11  -2.076   2.565 -16.905
    6   HD13  LEU  11          HD11      LEU  11  -2.662   0.424 -16.145
    7   HD12  LEU  11          HD12      LEU  11  -4.017   1.416 -15.612
    8   HD11  LEU  11          HD13      LEU  11  -2.767   0.942 -14.462
    9   HD22  LEU  11          HD21      LEU  11  -2.675   4.584 -15.909
   10   HD21  LEU  11          HD22      LEU  11  -2.609   3.924 -14.276
   11   HD23  LEU  11          HD23      LEU  11  -3.978   3.552 -15.324

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  12           H        ILE  12   2.141   1.986 -15.855
    2    HA   ILE  12           HA       ILE  12   3.331   2.534 -13.346
    3    HB   ILE  12           HB       ILE  12   4.607   1.488 -15.896
    4   HG12  ILE  12          HG12      ILE  12   2.579   0.262 -14.759
    5   HG13  ILE  12          HG13      ILE  12   3.975  -0.674 -15.252
    6   HG21  ILE  12          HG21      ILE  12   5.550   1.447 -13.012
    7   HG23  ILE  12          HG22      ILE  12   6.348   2.219 -14.381
    8   HG22  ILE  12          HG23      ILE  12   6.260   0.461 -14.287
    9   HD12  ILE  12          HD11      ILE  12   3.115  -1.224 -12.965
   10   HD11  ILE  12          HD12      ILE  12   3.523   0.415 -12.463
   11   HD13  ILE  12          HD13      ILE  12   4.786  -0.687 -12.966

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  13           H        ILE  13   3.951   3.785 -16.604
    2    HA   ILE  13           HA       ILE  13   6.082   5.510 -15.873
    3    HB   ILE  13           HB       ILE  13   4.063   5.592 -18.129
    4   HG12  ILE  13          HG12      ILE  13   5.881   3.735 -17.835
    5   HG13  ILE  13          HG13      ILE  13   5.649   4.471 -19.417
    6   HG23  ILE  13          HG21      ILE  13   4.801   7.861 -17.868
    7   HG22  ILE  13          HG22      ILE  13   5.706   7.196 -19.223
    8   HG21  ILE  13          HG23      ILE  13   6.480   7.364 -17.649
    9   HD13  ILE  13          HD11      ILE  13   7.581   5.923 -19.087
   10   HD12  ILE  13          HD12      ILE  13   8.061   4.269 -18.728
   11   HD11  ILE  13          HD13      ILE  13   7.732   5.390 -17.414

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ASN  14           H        ASN  14   2.577   6.001 -16.163
    2    HA   ASN  14           HA       ASN  14   2.529   8.749 -15.537
    3    HB2  ASN  14           HB2      ASN  14   0.641   7.103 -16.372
    4    HB3  ASN  14           HB3      ASN  14   0.310   6.930 -14.653
    5   HD21  ASN  14          HD21      ASN  14  -1.702   8.079 -16.101
    6   HD22  ASN  14          HD22      ASN  14  -1.767   9.753 -15.840

  No H/Q in entry =           6
  In of MODEL   49
    1    H    SER  15           H        SER  15   2.224   5.880 -13.451
    2    HA   SER  15           HA       SER  15   1.902   7.259 -11.010
    3    HB2  SER  15           HB2      SER  15   2.447   5.178  -9.949
    4    HB3  SER  15           HB3      SER  15   1.627   4.751 -11.448
    5    HG   SER  15           HG       SER  15   3.383   3.820 -12.085

  No H/Q in entry =           5
  In of MODEL   49
    1    H    GLY  16           H        GLY  16   4.789   6.159 -12.748
    2    HA3  GLY  16           HA2      GLY  16   6.702   6.925 -10.809
    3    HA2  GLY  16           HA3      GLY  16   7.015   6.716 -12.530

  No H/Q in entry =           3
  In of MODEL   49
    1    H    GLN  17           H        GLN  17   5.329   8.668 -13.610
    2    HA   GLN  17           HA       GLN  17   6.901  11.013 -13.302
    3    HB2  GLN  17           HB2      GLN  17   5.604  10.538 -15.352
    4    HB3  GLN  17           HB3      GLN  17   4.104  10.727 -14.443
    5    HG2  GLN  17           HG2      GLN  17   4.613  13.053 -13.977
    6    HG3  GLN  17           HG3      GLN  17   6.205  12.892 -14.714
    7   HE21  GLN  17          HE21      GLN  17   4.288  14.809 -15.671
    8   HE22  GLN  17          HE22      GLN  17   3.813  14.340 -17.233

  No H/Q in entry =           8
  In of MODEL   49
    1    H    ALA  18           H        ALA  18   3.795   9.994 -11.967
    2    HA   ALA  18           HA       ALA  18   3.058  12.387 -10.714
    3    HB1  ALA  18           HB1      ALA  18   1.935   9.927 -10.934
    4    HB2  ALA  18           HB2      ALA  18   1.377  11.150  -9.795
    5    HB3  ALA  18           HB3      ALA  18   2.467   9.872  -9.254

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ARG  19           H        ARG  19   4.930   9.632  -9.414
    2    HA   ARG  19           HA       ARG  19   5.446  10.801  -6.893
    3    HB2  ARG  19           HB2      ARG  19   5.868   8.397  -7.409
    4    HB3  ARG  19           HB3      ARG  19   7.229   8.882  -8.424
    5    HG2  ARG  19           HG2      ARG  19   8.335   9.932  -6.499
    6    HG3  ARG  19           HG3      ARG  19   6.954   9.544  -5.474
    7    HD2  ARG  19           HD2      ARG  19   8.718   7.915  -5.100
    8    HD3  ARG  19           HD3      ARG  19   7.350   7.126  -5.891
    9    HE   ARG  19           HE       ARG  19   9.065   7.941  -7.931
   10   HH21  ARG  19          HH11      ARG  19  10.633   6.537  -8.767
   11   HH22  ARG  19          HH12      ARG  19  11.177   5.194  -7.823
   12   HH11  ARG  19          HH21      ARG  19   9.125   5.922  -5.145
   13   HH12  ARG  19          HH22      ARG  19  10.320   4.845  -5.771

  No H/Q in entry =          13
  In of MODEL   49
    1    H    SER  20           H        SER  20   7.281  10.823  -9.932
    2    HA   SER  20           HA       SER  20   9.517  12.248  -9.100
    3    HB2  SER  20           HB2      SER  20   9.564  11.364 -11.301
    4    HB3  SER  20           HB3      SER  20   8.064  12.175 -11.740
    5    HG   SER  20           HG       SER  20  10.647  13.240 -11.369

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LEU  21           H        LEU  21   6.421  13.504 -10.320
    2    HA   LEU  21           HA       LEU  21   7.082  16.252 -10.103
    3    HB2  LEU  21           HB2      LEU  21   4.419  14.820 -10.033
    4    HB3  LEU  21           HB3      LEU  21   4.579  16.574 -10.041
    5    HG   LEU  21           HG       LEU  21   5.803  14.786 -12.160
    6   HD11  LEU  21          HD11      LEU  21   3.144  16.242 -12.118
    7   HD13  LEU  21          HD12      LEU  21   3.404  14.504 -12.276
    8   HD12  LEU  21          HD13      LEU  21   3.884  15.589 -13.580
    9   HD22  LEU  21          HD21      LEU  21   6.917  16.836 -12.337
   10   HD21  LEU  21          HD22      LEU  21   5.537  17.768 -11.763
   11   HD23  LEU  21          HD23      LEU  21   5.544  17.129 -13.400

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ALA  22           H        ALA  22   5.565  13.966  -7.854
    2    HA   ALA  22           HA       ALA  22   4.943  15.780  -5.798
    3    HB3  ALA  22           HB1      ALA  22   4.192  13.385  -5.956
    4    HB2  ALA  22           HB2      ALA  22   4.769  13.865  -4.360
    5    HB1  ALA  22           HB3      ALA  22   5.802  12.906  -5.421

  No H/Q in entry =           5
  In of MODEL   49
    1    H    TYR  23           H        TYR  23   7.887  13.764  -6.212
    2    HA   TYR  23           HA       TYR  23   9.253  14.796  -3.955
    3    HB2  TYR  23           HB2      TYR  23  10.054  12.787  -5.101
    4    HB3  TYR  23           HB3      TYR  23  10.373  13.722  -6.562
    5    HD1  TYR  23           HD1      TYR  23  11.321  13.383  -2.968
    6    HD2  TYR  23           HD2      TYR  23  12.400  14.917  -6.834
    7    HE1  TYR  23           HE1      TYR  23  13.572  13.972  -2.108
    8    HE2  TYR  23           HE2      TYR  23  14.650  15.507  -5.973
    9    HH   TYR  23           HH       TYR  23  15.716  15.993  -3.801

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ALA  24           H        ALA  24   9.085  15.890  -7.327
    2    HA   ALA  24           HA       ALA  24  10.971  17.984  -7.077
    3    HB2  ALA  24           HB1      ALA  24  10.541  18.036  -9.289
    4    HB3  ALA  24           HB2      ALA  24   8.980  18.780  -8.942
    5    HB1  ALA  24           HB3      ALA  24   9.114  17.027  -9.064

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ALA  25           H        ALA  25   7.489  17.786  -6.476
    2    HA   ALA  25           HA       ALA  25   6.993  20.504  -5.920
    3    HB1  ALA  25           HB1      ALA  25   5.343  18.497  -6.123
    4    HB2  ALA  25           HB2      ALA  25   4.962  19.788  -4.982
    5    HB3  ALA  25           HB3      ALA  25   5.656  18.273  -4.401

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LEU  26           H        LEU  26   8.063  17.838  -3.853
    2    HA   LEU  26           HA       LEU  26   8.147  19.279  -1.422
    3    HB2  LEU  26           HB2      LEU  26   8.254  16.863  -1.406
    4    HB3  LEU  26           HB3      LEU  26   9.730  16.874  -2.368
    5    HG   LEU  26           HG       LEU  26  10.928  18.006  -0.526
    6   HD12  LEU  26          HD11      LEU  26   9.689  18.016   1.727
    7   HD11  LEU  26          HD12      LEU  26   8.208  17.867   0.785
    8   HD13  LEU  26          HD13      LEU  26   9.246  19.278   0.576
    9   HD21  LEU  26          HD21      LEU  26   9.403  15.534   0.349
   10   HD23  LEU  26          HD22      LEU  26  10.911  16.107   1.052
   11   HD22  LEU  26          HD23      LEU  26  10.878  15.541  -0.616

  No H/Q in entry =          11
  In of MODEL   49
    1    H    LYS  27           H        LYS  27  10.581  18.709  -3.930
    2    HA   LYS  27           HA       LYS  27  12.751  19.967  -2.695
    3    HB2  LYS  27           HB2      LYS  27  12.872  18.612  -4.779
    4    HB3  LYS  27           HB3      LYS  27  12.104  19.936  -5.654
    5    HG2  LYS  27           HG2      LYS  27  13.958  21.435  -5.072
    6    HG3  LYS  27           HG3      LYS  27  14.720  20.150  -4.125
    7    HD2  LYS  27           HD2      LYS  27  14.883  18.756  -6.173
    8    HD3  LYS  27           HD3      LYS  27  14.166  20.066  -7.111
    9    HE2  LYS  27           HE2      LYS  27  16.041  21.545  -6.493
   10    HE3  LYS  27           HE3      LYS  27  16.763  20.239  -5.547
   11    HZ3  LYS  27           HZ1      LYS  27  17.764  20.335  -7.728
   12    HZ2  LYS  27           HZ2      LYS  27  16.243  20.205  -8.477
   13    HZ1  LYS  27           HZ3      LYS  27  16.868  18.902  -7.583

  No H/Q in entry =          13
  In of MODEL   49
    1    H    GLN  28           H        GLN  28  10.132  21.326  -4.664
    2    HA   GLN  28           HA       GLN  28  11.076  23.983  -4.823
    3    HB2  GLN  28           HB2      GLN  28   8.246  22.902  -4.718
    4    HB3  GLN  28           HB3      GLN  28   8.658  24.572  -5.108
    5    HG2  GLN  28           HG2      GLN  28   9.680  22.150  -6.620
    6    HG3  GLN  28           HG3      GLN  28   8.329  23.156  -7.140
    7   HE21  GLN  28          HE21      GLN  28  11.484  22.703  -7.850
    8   HE22  GLN  28          HE22      GLN  28  11.942  24.290  -8.245

  No H/Q in entry =           8
  In of MODEL   49
    1    H    ALA  29           H        ALA  29   9.141  22.289  -2.390
    2    HA   ALA  29           HA       ALA  29   8.569  24.485  -0.720
    3    HB2  ALA  29           HB1      ALA  29   7.840  22.918   0.850
    4    HB1  ALA  29           HB2      ALA  29   9.072  21.739   0.397
    5    HB3  ALA  29           HB3      ALA  29   7.690  22.020  -0.660

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LYS  30           H        LYS  30  11.313  22.234  -0.765
    2    HA   LYS  30           HA       LYS  30  12.612  23.206   1.541
    3    HB2  LYS  30           HB2      LYS  30  13.731  21.916  -0.958
    4    HB3  LYS  30           HB3      LYS  30  14.703  22.288   0.468
    5    HG2  LYS  30           HG2      LYS  30  13.151  20.900   1.844
    6    HG3  LYS  30           HG3      LYS  30  12.277  20.467   0.371
    7    HD2  LYS  30           HD2      LYS  30  14.333  19.490  -0.574
    8    HD3  LYS  30           HD3      LYS  30  15.226  19.937   0.881
    9    HE2  LYS  30           HE2      LYS  30  13.723  18.502   2.233
   10    HE3  LYS  30           HE3      LYS  30  12.860  18.035   0.762
   11    HZ2  LYS  30           HZ1      LYS  30  14.657  16.471   1.539
   12    HZ1  LYS  30           HZ2      LYS  30  15.789  17.664   1.089
   13    HZ3  LYS  30           HZ3      LYS  30  14.764  16.968  -0.079

  No H/Q in entry =          13
  In of MODEL   49
    1    H    GLN  31           H        GLN  31  12.514  24.396  -1.761
    2    HA   GLN  31           HA       GLN  31  14.652  26.305  -1.336
    3    HB2  GLN  31           HB2      GLN  31  12.621  26.329  -3.572
    4    HB3  GLN  31           HB3      GLN  31  14.237  27.035  -3.567
    5    HG2  GLN  31           HG2      GLN  31  14.713  24.345  -2.977
    6    HG3  GLN  31           HG3      GLN  31  13.416  24.278  -4.163
    7   HE21  GLN  31          HE21      GLN  31  16.267  23.501  -4.548
    8   HE22  GLN  31          HE22      GLN  31  16.840  24.473  -5.815

  No H/Q in entry =           8
  In of MODEL   49
    1    H    GLY  32           H        GLY  32  11.573  26.107  -0.207
    2    HA3  GLY  32           HA2      GLY  32  10.400  27.673   1.054
    3    HA2  GLY  32           HA3      GLY  32  11.520  28.914   0.505

  No H/Q in entry =           3
  In of MODEL   49
    1    H    ASP  33           H        ASP  33  10.182  26.991  -1.987
    2    HA   ASP  33           HA       ASP  33   8.508  29.249  -2.861
    3    HB2  ASP  33           HB2      ASP  33   9.624  26.831  -4.287
    4    HB3  ASP  33           HB3      ASP  33   8.470  27.936  -5.029

  No H/Q in entry =           4
  In of MODEL   49
    1    H    PHE  34           H        PHE  34   6.814  28.769  -1.305
    2    HA   PHE  34           HA       PHE  34   5.450  26.289  -1.207
    3    HB2  PHE  34           HB2      PHE  34   4.467  29.072  -0.544
    4    HB3  PHE  34           HB3      PHE  34   3.625  27.578  -0.131
    5    HD1  PHE  34           HD1      PHE  34   5.853  29.996   1.086
    6    HD2  PHE  34           HD2      PHE  34   5.201  25.750   1.046
    7    HE1  PHE  34           HE1      PHE  34   7.234  29.763   3.131
    8    HE2  PHE  34           HE2      PHE  34   6.584  25.521   3.089
    9    HZ   PHE  34           HZ       PHE  34   7.595  27.528   4.131

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ALA  35           H        ALA  35   5.012  29.141  -3.232
    2    HA   ALA  35           HA       ALA  35   2.470  28.506  -4.268
    3    HB3  ALA  35           HB1      ALA  35   3.524  29.897  -6.306
    4    HB2  ALA  35           HB2      ALA  35   4.733  30.271  -5.077
    5    HB1  ALA  35           HB3      ALA  35   3.038  30.670  -4.797

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ALA  36           H        ALA  36   5.710  27.849  -5.602
    2    HA   ALA  36           HA       ALA  36   4.743  26.404  -7.845
    3    HB3  ALA  36           HB1      ALA  36   6.905  26.540  -8.449
    4    HB2  ALA  36           HB2      ALA  36   7.386  25.520  -7.092
    5    HB1  ALA  36           HB3      ALA  36   7.267  27.268  -6.885

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ALA  37           H        ALA  37   5.688  25.429  -4.581
    2    HA   ALA  37           HA       ALA  37   5.650  22.639  -4.999
    3    HB2  ALA  37           HB1      ALA  37   5.364  24.438  -2.629
    4    HB1  ALA  37           HB2      ALA  37   6.507  23.126  -2.910
    5    HB3  ALA  37           HB3      ALA  37   4.846  22.764  -2.447

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LYS  38           H        LYS  38   3.096  24.835  -3.854
    2    HA   LYS  38           HA       LYS  38   1.008  23.009  -3.635
    3    HB2  LYS  38           HB2      LYS  38   1.340  25.768  -3.394
    4    HB3  LYS  38           HB3      LYS  38   0.148  25.608  -4.678
    5    HG2  LYS  38           HG2      LYS  38  -1.301  24.281  -3.238
    6    HG3  LYS  38           HG3      LYS  38  -0.063  24.234  -1.975
    7    HD2  LYS  38           HD2      LYS  38  -0.267  26.571  -1.538
    8    HD3  LYS  38           HD3      LYS  38  -1.172  26.848  -3.027
    9    HE2  LYS  38           HE2      LYS  38  -2.687  26.880  -1.096
   10    HE3  LYS  38           HE3      LYS  38  -3.046  25.497  -2.134
   11    HZ3  LYS  38           HZ1      LYS  38  -2.319  24.037  -0.591
   12    HZ2  LYS  38           HZ2      LYS  38  -2.684  25.297   0.491
   13    HZ1  LYS  38           HZ3      LYS  38  -1.085  25.054  -0.024

  No H/Q in entry =          13
  In of MODEL   49
    1    H    ALA  39           H        ALA  39   1.990  24.906  -6.486
    2    HA   ALA  39           HA       ALA  39  -0.070  24.018  -8.197
    3    HB2  ALA  39           HB1      ALA  39   2.667  24.680  -9.238
    4    HB1  ALA  39           HB2      ALA  39   1.688  25.938  -8.484
    5    HB3  ALA  39           HB3      ALA  39   1.089  25.091  -9.910

  No H/Q in entry =           5
  In of MODEL   49
    1    H    MET  40           H        MET  40   3.173  22.743  -7.594
    2    HA   MET  40           HA       MET  40   3.100  20.714  -9.578
    3    HB2  MET  40           HB2      MET  40   4.696  20.959  -7.022
    4    HB3  MET  40           HB3      MET  40   4.961  19.700  -8.230
    5    HG2  MET  40           HG2      MET  40   5.003  22.654  -8.907
    6    HG3  MET  40           HG3      MET  40   6.453  21.763  -8.446
    7    HE3  MET  40           HE1      MET  40   7.355  19.542 -11.240
    8    HE2  MET  40           HE2      MET  40   6.785  19.225  -9.605
    9    HE1  MET  40           HE3      MET  40   7.873  20.579  -9.904

  No H/Q in entry =           9
  In of MODEL   49
    1    H    MET  41           H        MET  41   2.166  20.764  -6.159
    2    HA   MET  41           HA       MET  41   1.651  17.997  -5.873
    3    HB2  MET  41           HB2      MET  41   0.294  20.351  -4.539
    4    HB3  MET  41           HB3      MET  41   0.147  18.674  -4.025
    5    HG2  MET  41           HG2      MET  41   2.856  18.916  -4.048
    6    HG3  MET  41           HG3      MET  41   2.402  20.573  -3.662
    7    HE2  MET  41           HE1      MET  41  -0.638  19.306  -1.948
    8    HE1  MET  41           HE2      MET  41   0.170  20.823  -2.327
    9    HE3  MET  41           HE3      MET  41   0.106  20.259  -0.657

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ASP  42           H        ASP  42  -0.401  20.704  -6.869
    2    HA   ASP  42           HA       ASP  42  -2.832  19.325  -7.014
    3    HB2  ASP  42           HB2      ASP  42  -2.142  21.899  -7.277
    4    HB3  ASP  42           HB3      ASP  42  -2.280  21.496  -8.985

  No H/Q in entry =           4
  In of MODEL   49
    1    H    GLN  43           H        GLN  43  -0.381  19.923  -9.505
    2    HA   GLN  43           HA       GLN  43  -1.747  18.585 -11.596
    3    HB2  GLN  43           HB2      GLN  43   1.205  19.124 -11.200
    4    HB3  GLN  43           HB3      GLN  43   0.504  18.473 -12.684
    5    HG2  GLN  43           HG2      GLN  43  -1.022  20.489 -12.742
    6    HG3  GLN  43           HG3      GLN  43  -0.081  21.158 -11.412
    7   HE21  GLN  43          HE21      GLN  43   0.081  22.771 -13.504
    8   HE22  GLN  43          HE22      GLN  43   1.502  22.556 -14.402

  No H/Q in entry =           8
  In of MODEL   49
    1    H    SER  44           H        SER  44   0.598  17.472  -9.188
    2    HA   SER  44           HA       SER  44   0.958  14.864 -10.201
    3    HB2  SER  44           HB2      SER  44   1.830  16.318  -7.965
    4    HB3  SER  44           HB3      SER  44   0.974  14.931  -7.294
    5    HG   SER  44           HG       SER  44   3.091  14.325  -7.706

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ARG  45           H        ARG  45  -1.385  16.174  -7.881
    2    HA   ARG  45           HA       ARG  45  -2.757  13.806  -7.244
    3    HB2  ARG  45           HB2      ARG  45  -2.978  15.977  -6.062
    4    HB3  ARG  45           HB3      ARG  45  -3.831  16.632  -7.457
    5    HG2  ARG  45           HG2      ARG  45  -5.586  14.894  -7.176
    6    HG3  ARG  45           HG3      ARG  45  -4.745  14.295  -5.746
    7    HD2  ARG  45           HD2      ARG  45  -4.975  16.564  -4.700
    8    HD3  ARG  45           HD3      ARG  45  -5.958  17.071  -6.090
    9    HE   ARG  45           HE       ARG  45  -7.056  14.691  -5.047
   10   HH21  ARG  45          HH11      ARG  45  -8.899  14.757  -3.786
   11   HH22  ARG  45          HH12      ARG  45  -9.310  16.197  -2.925
   12   HH11  ARG  45          HH21      ARG  45  -6.540  17.945  -4.033
   13   HH12  ARG  45          HH22      ARG  45  -7.969  18.003  -3.063

  No H/Q in entry =          13
  In of MODEL   49
    1    H    MET  46           H        MET  46  -3.345  16.195  -9.808
    2    HA   MET  46           HA       MET  46  -5.670  15.001 -10.878
    3    HB2  MET  46           HB2      MET  46  -3.575  16.836 -12.052
    4    HB3  MET  46           HB3      MET  46  -4.953  16.269 -13.000
    5    HG2  MET  46           HG2      MET  46  -6.505  17.203 -11.358
    6    HG3  MET  46           HG3      MET  46  -5.163  17.703 -10.336
    7    HE2  MET  46           HE1      MET  46  -6.687  19.424 -14.248
    8    HE1  MET  46           HE2      MET  46  -6.992  17.852 -13.519
    9    HE3  MET  46           HE3      MET  46  -5.524  18.109 -14.462

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ALA  47           H        ALA  47  -2.233  14.545 -11.614
    2    HA   ALA  47           HA       ALA  47  -2.552  12.806 -13.819
    3    HB3  ALA  47           HB1      ALA  47  -0.384  13.714 -13.459
    4    HB2  ALA  47           HB2      ALA  47  -0.231  11.989 -13.117
    5    HB1  ALA  47           HB3      ALA  47  -0.340  13.145 -11.790

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LEU  48           H        LEU  48  -2.297  12.187 -10.342
    2    HA   LEU  48           HA       LEU  48  -2.367   9.346 -10.489
    3    HB2  LEU  48           HB2      LEU  48  -3.160  11.266  -8.287
    4    HB3  LEU  48           HB3      LEU  48  -3.053   9.517  -8.079
    5    HG   LEU  48           HG       LEU  48  -0.762  11.231  -9.070
    6   HD13  LEU  48          HD11      LEU  48  -1.063  12.008  -6.884
    7   HD12  LEU  48          HD12      LEU  48   0.109  10.711  -6.674
    8   HD11  LEU  48          HD13      LEU  48  -1.589  10.436  -6.285
    9   HD22  LEU  48          HD21      LEU  48  -0.242   9.047  -9.699
   10   HD21  LEU  48          HD22      LEU  48  -1.113   8.330  -8.345
   11   HD23  LEU  48          HD23      LEU  48   0.452   9.097  -8.079

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ASN  49           H        ASN  49  -4.853  11.819 -10.111
    2    HA   ASN  49           HA       ASN  49  -7.028  10.139  -9.577
    3    HB2  ASN  49           HB2      ASN  49  -7.108  12.563  -9.264
    4    HB3  ASN  49           HB3      ASN  49  -6.938  12.818 -10.996
    5   HD21  ASN  49          HD21      ASN  49  -9.160  13.888  -9.677
    6   HD22  ASN  49          HD22      ASN  49 -10.556  13.040 -10.134

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLU  50           H        GLU  50  -5.741  11.334 -12.662
    2    HA   GLU  50           HA       GLU  50  -7.676  10.056 -14.314
    3    HB2  GLU  50           HB2      GLU  50  -6.220  11.883 -15.128
    4    HB3  GLU  50           HB3      GLU  50  -4.818  10.823 -14.977
    5    HG2  GLU  50           HG2      GLU  50  -5.770   9.273 -16.613
    6    HG3  GLU  50           HG3      GLU  50  -7.238  10.239 -16.713

  No H/Q in entry =           6
  In of MODEL   49
    1    H    ALA  51           H        ALA  51  -4.504   9.094 -13.086
    2    HA   ALA  51           HA       ALA  51  -4.336   6.637 -14.493
    3    HB2  ALA  51           HB1      ALA  51  -2.360   6.369 -13.380
    4    HB1  ALA  51           HB2      ALA  51  -3.060   6.793 -11.819
    5    HB3  ALA  51           HB3      ALA  51  -2.608   8.062 -12.956

  No H/Q in entry =           5
  In of MODEL   49
    1    H    HIS  52           H        HIS  52  -5.535   7.472 -11.254
    2    HA   HIS  52           HA       HIS  52  -6.204   4.861 -10.416
    3    HB2  HIS  52           HB2      HIS  52  -6.089   6.846  -8.923
    4    HB3  HIS  52           HB3      HIS  52  -7.565   7.458  -9.669
    5    HD1  HIS  52           HD1      HIS  52  -9.751   5.960  -9.351
    6    HD2  HIS  52           HD2      HIS  52  -6.500   4.872  -6.983
    7    HE1  HIS  52           HE1      HIS  52 -10.660   4.439  -7.541
    8    HE2  HIS  52           HE2      HIS  52  -8.689   3.767  -6.088

  No H/Q in entry =           8
  In of MODEL   49
    1    H    LEU  53           H        LEU  53  -8.033   7.297 -12.225
    2    HA   LEU  53           HA       LEU  53 -10.528   5.985 -12.247
    3    HB2  LEU  53           HB2      LEU  53  -9.249   7.970 -14.113
    4    HB3  LEU  53           HB3      LEU  53 -10.837   7.289 -14.448
    5    HG   LEU  53           HG       LEU  53 -10.159   8.621 -11.807
    6   HD11  LEU  53          HD11      LEU  53 -11.364   9.805 -14.323
    7   HD13  LEU  53          HD12      LEU  53  -9.866  10.296 -13.532
    8   HD12  LEU  53          HD13      LEU  53 -11.415  10.585 -12.747
    9   HD21  LEU  53          HD21      LEU  53 -12.701   7.713 -13.170
   10   HD23  LEU  53          HD22      LEU  53 -12.738   8.980 -11.950
   11   HD22  LEU  53          HD23      LEU  53 -12.172   7.376 -11.526

  No H/Q in entry =          11
  In of MODEL   49
    1    H    VAL  54           H        VAL  54  -7.763   5.800 -14.467
    2    HA   VAL  54           HA       VAL  54  -8.961   4.012 -16.310
    3    HB   VAL  54           HB       VAL  54  -6.062   4.543 -15.612
    4   HG12  VAL  54          HG11      VAL  54  -5.792   3.450 -17.995
    5   HG11  VAL  54          HG12      VAL  54  -7.317   2.659 -17.598
    6   HG13  VAL  54          HG13      VAL  54  -5.906   2.420 -16.569
    7   HG22  VAL  54          HG21      VAL  54  -6.840   6.476 -16.670
    8   HG21  VAL  54          HG22      VAL  54  -8.021   5.600 -17.641
    9   HG23  VAL  54          HG23      VAL  54  -6.311   5.531 -18.061

  No H/Q in entry =           9
  In of MODEL   49
    1    H    GLN  55           H        GLN  55  -6.976   3.493 -13.396
    2    HA   GLN  55           HA       GLN  55  -6.864   0.676 -13.640
    3    HB2  GLN  55           HB2      GLN  55  -5.325   1.589 -12.115
    4    HB3  GLN  55           HB3      GLN  55  -6.553   2.550 -11.297
    5    HG2  GLN  55           HG2      GLN  55  -7.237   0.793  -9.976
    6    HG3  GLN  55           HG3      GLN  55  -6.996  -0.397 -11.248
    7   HE21  GLN  55          HE21      GLN  55  -5.365  -1.833 -10.738
    8   HE22  GLN  55          HE22      GLN  55  -3.988  -1.468  -9.819

  No H/Q in entry =           8
  In of MODEL   49
    1    H    THR  56           H        THR  56  -9.221   2.828 -12.049
    2    HA   THR  56           HA       THR  56 -10.799   0.939 -10.761
    3    HB   THR  56           HB       THR  56 -11.710   3.426 -12.240
    4    HG1  THR  56           HG1      THR  56 -11.180   2.999  -9.491
    5   HG21  THR  56          HG21      THR  56 -13.078   1.656 -10.204
    6   HG23  THR  56          HG22      THR  56 -13.627   2.031 -11.837
    7   HG22  THR  56          HG23      THR  56 -13.628   3.284 -10.596

  No H/Q in entry =           7
  In of MODEL   49
    1    H    LYS  57           H        LYS  57 -10.988   2.006 -14.153
    2    HA   LYS  57           HA       LYS  57 -13.128   0.300 -14.913
    3    HB2  LYS  57           HB2      LYS  57 -12.244   2.256 -16.227
    4    HB3  LYS  57           HB3      LYS  57 -10.810   1.309 -16.595
    5    HG2  LYS  57           HG2      LYS  57 -12.200  -0.376 -17.730
    6    HG3  LYS  57           HG3      LYS  57 -13.646   0.553 -17.356
    7    HD2  LYS  57           HD2      LYS  57 -11.329   1.637 -18.984
    8    HD3  LYS  57           HD3      LYS  57 -12.770   0.916 -19.698
    9    HE2  LYS  57           HE2      LYS  57 -13.546   3.071 -19.670
   10    HE3  LYS  57           HE3      LYS  57 -13.918   2.716 -17.983
   11    HZ3  LYS  57           HZ1      LYS  57 -12.254   4.001 -17.254
   12    HZ2  LYS  57           HZ2      LYS  57 -12.387   4.743 -18.777
   13    HZ1  LYS  57           HZ3      LYS  57 -11.198   3.559 -18.506

  No H/Q in entry =          13
  In of MODEL   49
    1    H    LEU  58           H        LEU  58  -9.621  -0.106 -14.832
    2    HA   LEU  58           HA       LEU  58  -9.603  -2.628 -16.110
    3    HB2  LEU  58           HB2      LEU  58  -7.589  -1.314 -14.294
    4    HB3  LEU  58           HB3      LEU  58  -7.312  -2.837 -15.140
    5    HG   LEU  58           HG       LEU  58  -8.076  -0.244 -16.520
    6   HD11  LEU  58          HD11      LEU  58  -5.425  -1.460 -15.807
    7   HD13  LEU  58          HD12      LEU  58  -5.932   0.228 -15.768
    8   HD12  LEU  58          HD13      LEU  58  -5.578  -0.547 -17.309
    9   HD22  LEU  58          HD21      LEU  58  -8.631  -1.818 -18.107
   10   HD21  LEU  58          HD22      LEU  58  -7.585  -3.055 -17.414
   11   HD23  LEU  58          HD23      LEU  58  -6.897  -1.781 -18.420

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  59           H        ILE  59 -10.451  -1.717 -12.868
    2    HA   ILE  59           HA       ILE  59 -10.086  -4.477 -11.905
    3    HB   ILE  59           HB       ILE  59  -9.667  -2.202 -10.514
    4   HG12  ILE  59          HG12      ILE  59 -11.029  -4.556  -9.189
    5   HG13  ILE  59          HG13      ILE  59  -9.382  -4.626  -9.761
    6   HG23  ILE  59          HG21      ILE  59 -11.510  -1.509  -9.224
    7   HG22  ILE  59          HG22      ILE  59 -12.433  -2.951  -9.578
    8   HG21  ILE  59          HG23      ILE  59 -12.214  -1.712 -10.810
    9   HD11  ILE  59          HD11      ILE  59  -8.858  -2.617  -8.376
   10   HD13  ILE  59          HD12      ILE  59  -9.325  -4.020  -7.422
   11   HD12  ILE  59          HD13      ILE  59 -10.481  -2.717  -7.702

  No H/Q in entry =          11
  In of MODEL   49
    1    H    GLU  60           H        GLU  60 -12.656  -2.184 -12.741
    2    HA   GLU  60           HA       GLU  60 -14.836  -3.712 -11.735
    3    HB2  GLU  60           HB2      GLU  60 -15.060  -1.343 -12.344
    4    HB3  GLU  60           HB3      GLU  60 -14.730  -1.732 -14.029
    5    HG2  GLU  60           HG2      GLU  60 -16.756  -3.173 -14.073
    6    HG3  GLU  60           HG3      GLU  60 -17.102  -2.709 -12.420

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLY  61           H        GLY  61 -13.143  -3.699 -14.839
    2    HA3  GLY  61           HA2      GLY  61 -14.833  -5.960 -15.730
    3    HA2  GLY  61           HA3      GLY  61 -13.990  -4.854 -16.807

  No H/Q in entry =           3
  In of MODEL   49
    1    H    ASP  62           H        ASP  62 -12.625  -6.281 -13.908
    2    HA   ASP  62           HA       ASP  62 -10.177  -6.928 -14.665
    3    HB2  ASP  62           HB2      ASP  62 -10.269  -8.883 -13.164
    4    HB3  ASP  62           HB3      ASP  62 -11.107  -7.498 -12.472

  No H/Q in entry =           4
  In of MODEL   49
    1    H    ALA  63           H        ALA  63  -9.380  -7.703 -16.569
    2    HA   ALA  63           HA       ALA  63 -10.832  -9.494 -18.293
    3    HB2  ALA  63           HB1      ALA  63  -8.674  -9.551 -19.562
    4    HB3  ALA  63           HB2      ALA  63  -7.910  -8.658 -18.248
    5    HB1  ALA  63           HB3      ALA  63  -9.194  -7.906 -19.197

  No H/Q in entry =           5
  In of MODEL   49
    1    H    GLY  64           H        GLY  64 -10.542 -11.646 -18.658
    2    HA3  GLY  64           HA2      GLY  64  -9.024 -13.623 -18.305
    3    HA2  GLY  64           HA3      GLY  64  -9.002 -13.128 -16.617

  No H/Q in entry =           3
  In of MODEL   49
    1    H    GLU  65           H        GLU  65  -9.769 -15.621 -16.898
    2    HA   GLU  65           HA       GLU  65 -12.225 -16.425 -17.659
    3    HB2  GLU  65           HB2      GLU  65 -10.814 -17.118 -15.086
    4    HB3  GLU  65           HB3      GLU  65 -12.238 -17.971 -15.682
    5    HG2  GLU  65           HG2      GLU  65 -11.067 -18.560 -17.744
    6    HG3  GLU  65           HG3      GLU  65  -9.656 -17.636 -17.233

  No H/Q in entry =           6
  In of MODEL   49
    1    H    GLY  66           H        GLY  66 -14.198 -16.825 -16.579
    2    HA3  GLY  66           HA2      GLY  66 -15.503 -14.534 -15.622
    3    HA2  GLY  66           HA3      GLY  66 -16.150 -16.164 -15.620

  No H/Q in entry =           3
  In of MODEL   49
    1    H    LYS  67           H        LYS  67 -14.125 -17.266 -13.912
    2    HA   LYS  67           HA       LYS  67 -15.336 -16.868 -11.420
    3    HB2  LYS  67           HB2      LYS  67 -12.739 -18.200 -12.174
    4    HB3  LYS  67           HB3      LYS  67 -13.474 -18.298 -10.569
    5    HG2  LYS  67           HG2      LYS  67 -15.540 -19.211 -11.563
    6    HG3  LYS  67           HG3      LYS  67 -14.815 -19.114 -13.165
    7    HD2  LYS  67           HD2      LYS  67 -13.055 -20.699 -12.468
    8    HD3  LYS  67           HD3      LYS  67 -13.787 -20.800 -10.865
    9    HE2  LYS  67           HE2      LYS  67 -15.882 -21.642 -11.874
   10    HE3  LYS  67           HE3      LYS  67 -15.142 -21.554 -13.473
   11    HZ1  LYS  67           HZ1      LYS  67 -13.433 -23.109 -12.690
   12    HZ3  LYS  67           HZ2      LYS  67 -14.991 -23.782 -12.626
   13    HZ2  LYS  67           HZ3      LYS  67 -14.238 -23.241 -11.203

  No H/Q in entry =          13
  In of MODEL   49
    1    H    MET  68           H        MET  68 -13.174 -16.955  -9.666
    2    HA   MET  68           HA       MET  68 -12.932 -14.277  -8.888
    3    HB2  MET  68           HB2      MET  68 -11.604 -16.830  -8.062
    4    HB3  MET  68           HB3      MET  68 -11.072 -15.292  -7.384
    5    HG2  MET  68           HG2      MET  68 -12.772 -16.190  -5.919
    6    HG3  MET  68           HG3      MET  68 -13.473 -14.818  -6.779
    7    HE1  MET  68           HE1      MET  68 -15.508 -16.337  -5.504
    8    HE3  MET  68           HE2      MET  68 -16.650 -16.801  -6.764
    9    HE2  MET  68           HE3      MET  68 -15.906 -15.202  -6.802

  No H/Q in entry =           9
  In of MODEL   49
    1    H    LYS  69           H        LYS  69 -10.666 -16.276 -10.771
    2    HA   LYS  69           HA       LYS  69  -8.380 -14.734 -10.504
    3    HB2  LYS  69           HB2      LYS  69  -8.468 -16.978 -11.522
    4    HB3  LYS  69           HB3      LYS  69  -9.216 -16.280 -12.961
    5    HG2  LYS  69           HG2      LYS  69  -7.256 -14.854 -13.323
    6    HG3  LYS  69           HG3      LYS  69  -6.515 -15.465 -11.845
    7    HD2  LYS  69           HD2      LYS  69  -6.480 -17.743 -12.807
    8    HD3  LYS  69           HD3      LYS  69  -7.199 -17.120 -14.293
    9    HE2  LYS  69           HE2      LYS  69  -5.261 -15.634 -14.620
   10    HE3  LYS  69           HE3      LYS  69  -4.543 -16.234 -13.126
   11    HZ3  LYS  69           HZ1      LYS  69  -3.540 -17.603 -14.610
   12    HZ2  LYS  69           HZ2      LYS  69  -4.825 -17.553 -15.718
   13    HZ1  LYS  69           HZ3      LYS  69  -4.935 -18.525 -14.328

  No H/Q in entry =          13
  In of MODEL   49
    1    H    VAL  70           H        VAL  70  -7.440 -12.979 -11.418
    2    HA   VAL  70           HA       VAL  70  -8.937 -11.505 -13.508
    3    HB   VAL  70           HB       VAL  70  -8.244  -9.414 -12.342
    4   HG12  VAL  70          HG11      VAL  70  -9.749 -11.091 -10.356
    5   HG11  VAL  70          HG12      VAL  70 -10.444 -10.806 -11.953
    6   HG13  VAL  70          HG13      VAL  70 -10.079  -9.445 -10.893
    7   HG23  VAL  70          HG21      VAL  70  -7.658  -9.881  -9.809
    8   HG22  VAL  70          HG22      VAL  70  -6.381  -9.943 -11.022
    9   HG21  VAL  70          HG23      VAL  70  -7.098 -11.437 -10.422

  No H/Q in entry =           9
  In of MODEL   49
    1    H    SER  71           H        SER  71  -7.433  -9.678 -14.362
    2    HA   SER  71           HA       SER  71  -5.211 -10.829 -15.663
    3    HB2  SER  71           HB2      SER  71  -6.420  -8.831 -16.505
    4    HB3  SER  71           HB3      SER  71  -5.787  -7.898 -15.151
    5    HG   SER  71           HG       SER  71  -4.198  -9.300 -17.043

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LEU  72           H        LEU  72  -3.130 -11.059 -15.074
    2    HA   LEU  72           HA       LEU  72  -2.429 -10.826 -12.359
    3    HB2  LEU  72           HB2      LEU  72  -0.755 -11.254 -14.829
    4    HB3  LEU  72           HB3      LEU  72  -0.105 -11.317 -13.193
    5    HG   LEU  72           HG       LEU  72  -2.439 -13.027 -14.111
    6   HD13  LEU  72          HD11      LEU  72  -0.858 -14.844 -14.402
    7   HD12  LEU  72          HD12      LEU  72   0.473 -13.827 -13.851
    8   HD11  LEU  72          HD13      LEU  72  -0.320 -13.483 -15.388
    9   HD22  LEU  72          HD21      LEU  72  -2.463 -13.022 -11.759
   10   HD21  LEU  72          HD22      LEU  72  -0.715 -12.899 -11.632
   11   HD23  LEU  72          HD23      LEU  72  -1.457 -14.422 -12.115

  No H/Q in entry =          11
  In of MODEL   49
    1    H    VAL  73           H        VAL  73  -1.708  -8.819 -15.144
    2    HA   VAL  73           HA       VAL  73   0.195  -7.103 -14.037
    3    HB   VAL  73           HB       VAL  73  -0.209  -5.686 -15.900
    4   HG13  VAL  73          HG11      VAL  73  -0.003  -7.230 -17.693
    5   HG12  VAL  73          HG12      VAL  73  -1.008  -8.430 -16.880
    6   HG11  VAL  73          HG13      VAL  73   0.616  -8.090 -16.284
    7   HG22  VAL  73          HG21      VAL  73  -2.492  -5.218 -15.948
    8   HG21  VAL  73          HG22      VAL  73  -2.945  -6.913 -15.777
    9   HG23  VAL  73          HG23      VAL  73  -2.344  -6.314 -17.322

  No H/Q in entry =           9
  In of MODEL   49
    1    H    LEU  74           H        LEU  74  -3.205  -7.237 -13.501
    2    HA   LEU  74           HA       LEU  74  -3.844  -4.582 -12.906
    3    HB2  LEU  74           HB2      LEU  74  -5.565  -6.252 -13.081
    4    HB3  LEU  74           HB3      LEU  74  -4.874  -7.175 -11.750
    5    HG   LEU  74           HG       LEU  74  -5.347  -5.298 -10.207
    6   HD11  LEU  74          HD11      LEU  74  -6.364  -4.051 -12.762
    7   HD13  LEU  74          HD12      LEU  74  -5.257  -3.363 -11.576
    8   HD12  LEU  74          HD13      LEU  74  -6.969  -3.537 -11.187
    9   HD21  LEU  74          HD21      LEU  74  -7.030  -7.161 -11.057
   10   HD23  LEU  74          HD22      LEU  74  -7.875  -5.752 -11.662
   11   HD22  LEU  74          HD23      LEU  74  -7.549  -5.892  -9.952

  No H/Q in entry =          11
  In of MODEL   49
    1    H    VAL  75           H        VAL  75  -2.802  -7.152 -10.724
    2    HA   VAL  75           HA       VAL  75  -2.628  -5.587  -8.387
    3    HB   VAL  75           HB       VAL  75  -1.123  -8.082  -9.160
    4   HG13  VAL  75          HG11      VAL  75   0.147  -6.843  -7.445
    5   HG12  VAL  75          HG12      VAL  75  -0.662  -8.212  -6.695
    6   HG11  VAL  75          HG13      VAL  75  -1.324  -6.597  -6.509
    7   HG21  VAL  75          HG21      VAL  75  -3.627  -8.196  -8.939
    8   HG23  VAL  75          HG22      VAL  75  -3.469  -7.596  -7.287
    9   HG22  VAL  75          HG23      VAL  75  -2.783  -9.162  -7.727

  No H/Q in entry =           9
  In of MODEL   49
    1    H    GLU  76           H        GLU  76  -0.198  -6.345 -10.904
    2    HA   GLU  76           HA       GLU  76   1.971  -4.979  -9.738
    3    HB2  GLU  76           HB2      GLU  76   2.187  -6.465 -11.717
    4    HB3  GLU  76           HB3      GLU  76   1.289  -5.305 -12.683
    5    HG2  GLU  76           HG2      GLU  76   3.625  -4.967 -13.159
    6    HG3  GLU  76           HG3      GLU  76   3.109  -3.602 -12.188

  No H/Q in entry =           6
  In of MODEL   49
    1    H    ALA  77           H        ALA  77  -0.553  -3.804 -11.950
    2    HA   ALA  77           HA       ALA  77   0.421  -1.153 -12.132
    3    HB2  ALA  77           HB1      ALA  77  -1.821  -0.596 -12.963
    4    HB3  ALA  77           HB2      ALA  77  -2.432  -2.146 -12.384
    5    HB1  ALA  77           HB3      ALA  77  -1.248  -2.098 -13.690

  No H/Q in entry =           5
  In of MODEL   49
    1    H    GLN  78           H        GLN  78  -1.852  -2.712  -9.929
    2    HA   GLN  78           HA       GLN  78  -2.683  -0.392  -8.545
    3    HB2  GLN  78           HB2      GLN  78  -3.781  -2.656  -8.455
    4    HB3  GLN  78           HB3      GLN  78  -2.446  -3.205  -7.444
    5    HG2  GLN  78           HG2      GLN  78  -2.981  -1.462  -5.790
    6    HG3  GLN  78           HG3      GLN  78  -4.318  -0.911  -6.798
    7   HE21  GLN  78          HE21      GLN  78  -4.749  -1.901  -4.126
    8   HE22  GLN  78          HE22      GLN  78  -5.617  -3.356  -4.243

  No H/Q in entry =           8
  In of MODEL   49
    1    H    LEU  79           H        LEU  79   0.007  -2.627  -8.065
    2    HA   LEU  79           HA       LEU  79   0.960  -1.711  -5.606
    3    HB2  LEU  79           HB2      LEU  79   1.852  -3.719  -6.658
    4    HB3  LEU  79           HB3      LEU  79   2.500  -2.769  -7.991
    5    HG   LEU  79           HG       LEU  79   4.037  -1.612  -6.483
    6   HD13  LEU  79          HD11      LEU  79   3.017  -1.363  -4.424
    7   HD12  LEU  79          HD12      LEU  79   4.103  -2.704  -4.066
    8   HD11  LEU  79          HD13      LEU  79   2.402  -3.017  -4.406
    9   HD23  LEU  79          HD21      LEU  79   5.257  -3.747  -5.561
   10   HD22  LEU  79          HD22      LEU  79   5.064  -3.558  -7.301
   11   HD21  LEU  79          HD23      LEU  79   3.988  -4.631  -6.411

  No H/Q in entry =          11
  In of MODEL   49
    1    H    HIS  80           H        HIS  80   1.845  -0.604  -8.878
    2    HA   HIS  80           HA       HIS  80   3.631   1.401  -7.954
    3    HB2  HIS  80           HB2      HIS  80   2.365   0.684 -10.542
    4    HB3  HIS  80           HB3      HIS  80   2.946   2.342 -10.375
    5    HD1  HIS  80           HD1      HIS  80   5.349   2.658 -10.882
    6    HD2  HIS  80           HD2      HIS  80   4.551  -1.253  -9.677
    7    HE1  HIS  80           HE1      HIS  80   7.549   1.397 -11.027
    8    HE2  HIS  80           HE2      HIS  80   7.074  -0.990 -10.295

  No H/Q in entry =           8
  In of MODEL   49
    1    H    LEU  81           H        LEU  81   0.233   1.530  -8.958
    2    HA   LEU  81           HA       LEU  81  -0.066   4.322  -8.643
    3    HB2  LEU  81           HB2      LEU  81  -2.064   2.061  -8.566
    4    HB3  LEU  81           HB3      LEU  81  -2.530   3.761  -8.486
    5    HG   LEU  81           HG       LEU  81  -0.812   2.613 -10.704
    6   HD12  LEU  81          HD11      LEU  81  -3.038   2.909 -12.021
    7   HD11  LEU  81          HD12      LEU  81  -3.804   2.842 -10.434
    8   HD13  LEU  81          HD13      LEU  81  -2.846   1.479 -11.008
    9   HD23  LEU  81          HD21      LEU  81  -1.919   4.743 -11.820
   10   HD22  LEU  81          HD22      LEU  81  -0.511   4.931 -10.778
   11   HD21  LEU  81          HD23      LEU  81  -2.123   5.269 -10.150

  No H/Q in entry =          11
  In of MODEL   49
    1    H    MET  82           H        MET  82  -0.719   1.641  -6.385
    2    HA   MET  82           HA       MET  82  -1.799   3.228  -4.313
    3    HB2  MET  82           HB2      MET  82  -0.403   0.553  -4.330
    4    HB3  MET  82           HB3      MET  82  -0.998   1.280  -2.840
    5    HG2  MET  82           HG2      MET  82  -2.709   0.760  -5.291
    6    HG3  MET  82           HG3      MET  82  -2.632  -0.306  -3.890
    7    HE3  MET  82           HE1      MET  82  -4.388   1.342  -1.095
    8    HE2  MET  82           HE2      MET  82  -2.659   1.634  -1.269
    9    HE1  MET  82           HE3      MET  82  -3.331   0.068  -1.720

  No H/Q in entry =           9
  In of MODEL   49
    1    H    THR  83           H        THR  83   1.515   2.167  -4.974
    2    HA   THR  83           HA       THR  83   2.707   3.293  -2.671
    3    HB   THR  83           HB       THR  83   4.813   3.249  -4.130
    4    HG1  THR  83           HG1      THR  83   4.592   2.711  -6.153
    5   HG22  THR  83          HG21      THR  83   4.394   0.585  -4.452
    6   HG21  THR  83          HG22      THR  83   3.093   0.959  -3.323
    7   HG23  THR  83          HG23      THR  83   4.767   1.319  -2.893

  No H/Q in entry =           7
  In of MODEL   49
    1    H    SER  84           H        SER  84   2.349   4.553  -5.980
    2    HA   SER  84           HA       SER  84   3.664   7.007  -5.527
    3    HB2  SER  84           HB2      SER  84   1.615   6.147  -7.557
    4    HB3  SER  84           HB3      SER  84   2.279   7.781  -7.535
    5    HG   SER  84           HG       SER  84   3.675   5.316  -7.804

  No H/Q in entry =           5
  In of MODEL   49
    1    H    MET  85           H        MET  85   0.175   6.222  -5.376
    2    HA   MET  85           HA       MET  85  -0.713   8.827  -4.794
    3    HB2  MET  85           HB2      MET  85  -2.216   7.004  -5.465
    4    HB3  MET  85           HB3      MET  85  -1.930   6.205  -3.919
    5    HG2  MET  85           HG2      MET  85  -2.856   8.142  -2.724
    6    HG3  MET  85           HG3      MET  85  -3.094   8.985  -4.254
    7    HE1  MET  85           HE1      MET  85  -3.586   6.012  -2.212
    8    HE3  MET  85           HE2      MET  85  -4.095   4.928  -3.505
    9    HE2  MET  85           HE3      MET  85  -5.285   5.546  -2.364

  No H/Q in entry =           9
  In of MODEL   49
    1    H    LEU  86           H        LEU  86   0.214   6.183  -2.631
    2    HA   LEU  86           HA       LEU  86  -0.347   7.493  -0.199
    3    HB2  LEU  86           HB2      LEU  86   0.140   5.024  -0.578
    4    HB3  LEU  86           HB3      LEU  86   1.844   5.467  -0.663
    5    HG   LEU  86           HG       LEU  86   1.494   6.636   1.597
    6   HD11  LEU  86          HD11      LEU  86  -1.190   5.846   1.111
    7   HD13  LEU  86          HD12      LEU  86  -0.540   6.605   2.563
    8   HD12  LEU  86          HD13      LEU  86  -0.617   4.848   2.451
    9   HD23  LEU  86          HD21      LEU  86   1.088   3.640   1.730
   10   HD22  LEU  86          HD22      LEU  86   2.076   4.662   2.773
   11   HD21  LEU  86          HD23      LEU  86   2.590   4.334   1.119

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ALA  87           H        ALA  87   2.649   7.213  -2.066
    2    HA   ALA  87           HA       ALA  87   4.333   8.643  -0.336
    3    HB3  ALA  87           HB1      ALA  87   4.454   7.619  -3.038
    4    HB2  ALA  87           HB2      ALA  87   5.778   7.964  -1.929
    5    HB1  ALA  87           HB3      ALA  87   5.162   9.236  -2.983

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ARG  88           H        ARG  88   2.396   9.753  -3.075
    2    HA   ARG  88           HA       ARG  88   3.151  12.448  -2.965
    3    HB2  ARG  88           HB2      ARG  88   1.917  11.279  -4.825
    4    HB3  ARG  88           HB3      ARG  88   0.452  11.416  -3.853
    5    HG2  ARG  88           HG2      ARG  88   1.454  14.004  -3.774
    6    HG3  ARG  88           HG3      ARG  88   1.892  13.486  -5.400
    7    HD2  ARG  88           HD2      ARG  88  -0.245  13.548  -6.112
    8    HD3  ARG  88           HD3      ARG  88  -0.835  12.697  -4.684
    9    HE   ARG  88           HE       ARG  88  -1.040  15.472  -5.116
   10   HH21  ARG  88          HH11      ARG  88  -1.588  16.805  -3.387
   11   HH22  ARG  88          HH12      ARG  88  -1.300  16.277  -1.766
   12   HH11  ARG  88          HH21      ARG  88  -0.026  13.227  -2.725
   13   HH12  ARG  88          HH22      ARG  88  -0.433  14.245  -1.390

  No H/Q in entry =          13
  In of MODEL   49
    1    H    GLU  89           H        GLU  89   0.447  10.764  -1.336
    2    HA   GLU  89           HA       GLU  89  -0.683  13.074  -0.148
    3    HB2  GLU  89           HB2      GLU  89  -1.786  10.827  -0.233
    4    HB3  GLU  89           HB3      GLU  89  -0.667  10.284   1.018
    5    HG2  GLU  89           HG2      GLU  89  -1.508  11.984   2.564
    6    HG3  GLU  89           HG3      GLU  89  -2.557  12.643   1.311

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LEU  90           H        LEU  90   1.774  10.801   1.052
    2    HA   LEU  90           HA       LEU  90   2.106  12.059   3.579
    3    HB2  LEU  90           HB2      LEU  90   3.900  10.288   1.921
    4    HB3  LEU  90           HB3      LEU  90   4.305  10.814   3.560
    5    HG   LEU  90           HG       LEU  90   1.683   9.450   2.887
    6   HD12  LEU  90          HD11      LEU  90   2.828   7.415   3.912
    7   HD11  LEU  90          HD12      LEU  90   4.347   8.279   3.676
    8   HD13  LEU  90          HD13      LEU  90   3.347   7.860   2.285
    9   HD22  LEU  90          HD21      LEU  90   1.399  10.381   5.003
   10   HD21  LEU  90          HD22      LEU  90   3.115  10.285   5.397
   11   HD23  LEU  90          HD23      LEU  90   2.116   8.833   5.445

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  91           H        ILE  91   3.728  12.437   0.461
    2    HA   ILE  91           HA       ILE  91   5.689  14.283   1.305
    3    HB   ILE  91           HB       ILE  91   4.398  13.774  -1.381
    4   HG12  ILE  91          HG12      ILE  91   7.226  13.306  -0.386
    5   HG13  ILE  91          HG13      ILE  91   5.950  12.102  -0.227
    6   HG22  ILE  91          HG21      ILE  91   6.618  15.130  -2.061
    7   HG21  ILE  91          HG22      ILE  91   6.293  15.935  -0.525
    8   HG23  ILE  91          HG23      ILE  91   5.079  15.952  -1.802
    9   HD13  ILE  91          HD11      ILE  91   5.794  11.768  -2.534
   10   HD12  ILE  91          HD12      ILE  91   7.525  12.021  -2.310
   11   HD11  ILE  91          HD13      ILE  91   6.512  13.336  -2.908

  No H/Q in entry =          11
  In of MODEL   49
    1    H    THR  92           H        THR  92   2.331  14.693   0.274
    2    HA   THR  92           HA       THR  92   2.291  17.516   0.201
    3    HB   THR  92           HB       THR  92   0.129  15.513   0.894
    4    HG1  THR  92           HG1      THR  92   0.449  15.328  -1.188
    5   HG22  THR  92          HG21      THR  92  -1.278  17.665   0.154
    6   HG21  THR  92          HG22      THR  92   0.106  18.500   0.857
    7   HG23  THR  92          HG23      THR  92  -0.836  17.378   1.837

  No H/Q in entry =           7
  In of MODEL   49
    1    H    GLU  93           H        GLU  93   1.737  15.224   2.861
    2    HA   GLU  93           HA       GLU  93   1.182  17.134   4.868
    3    HB2  GLU  93           HB2      GLU  93   2.507  14.417   5.124
    4    HB3  GLU  93           HB3      GLU  93   1.803  15.346   6.448
    5    HG2  GLU  93           HG2      GLU  93   0.211  14.550   4.002
    6    HG3  GLU  93           HG3      GLU  93   0.308  13.534   5.435

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LEU  94           H        LEU  94   4.204  15.662   3.744
    2    HA   LEU  94           HA       LEU  94   5.936  16.826   5.639
    3    HB2  LEU  94           HB2      LEU  94   6.361  15.849   2.815
    4    HB3  LEU  94           HB3      LEU  94   7.681  16.517   3.770
    5    HG   LEU  94           HG       LEU  94   5.945  14.318   4.903
    6   HD11  LEU  94          HD11      LEU  94   8.055  14.093   2.786
    7   HD13  LEU  94          HD12      LEU  94   6.612  13.113   3.042
    8   HD12  LEU  94          HD13      LEU  94   8.032  12.871   4.060
    9   HD23  LEU  94          HD21      LEU  94   8.129  13.796   6.072
   10   HD22  LEU  94          HD22      LEU  94   7.452  15.373   6.477
   11   HD21  LEU  94          HD23      LEU  94   8.799  15.255   5.344

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  95           H        ILE  95   4.812  17.979   2.477
    2    HA   ILE  95           HA       ILE  95   6.373  20.344   2.418
    3    HB   ILE  95           HB       ILE  95   3.741  19.642   1.098
    4   HG12  ILE  95          HG12      ILE  95   6.535  19.988  -0.022
    5   HG13  ILE  95          HG13      ILE  95   5.890  18.434   0.495
    6   HG21  ILE  95          HG21      ILE  95   5.480  22.117   0.879
    7   HG23  ILE  95          HG22      ILE  95   3.753  22.042   1.223
    8   HG22  ILE  95          HG23      ILE  95   4.348  21.637  -0.387
    9   HD13  ILE  95          HD11      ILE  95   4.342  18.343  -1.244
   10   HD12  ILE  95          HD12      ILE  95   5.692  19.164  -2.027
   11   HD11  ILE  95          HD13      ILE  95   4.311  20.095  -1.447

  No H/Q in entry =          11
  In of MODEL   49
    1    H    GLU  96           H        GLU  96   3.119  19.682   3.694
    2    HA   GLU  96           HA       GLU  96   2.481  22.328   4.430
    3    HB2  GLU  96           HB2      GLU  96   0.815  20.538   4.438
    4    HB3  GLU  96           HB3      GLU  96   1.671  19.720   5.742
    5    HG2  GLU  96           HG2      GLU  96   0.635  21.005   7.300
    6    HG3  GLU  96           HG3      GLU  96   1.168  22.478   6.500

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LEU  97           H        LEU  97   4.325  19.793   6.078
    2    HA   LEU  97           HA       LEU  97   4.659  21.154   8.545
    3    HB2  LEU  97           HB2      LEU  97   6.216  18.986   7.150
    4    HB3  LEU  97           HB3      LEU  97   6.792  19.680   8.664
    5    HG   LEU  97           HG       LEU  97   3.990  18.572   8.339
    6   HD12  LEU  97          HD11      LEU  97   4.931  16.569   9.566
    7   HD11  LEU  97          HD12      LEU  97   6.542  17.206   9.230
    8   HD13  LEU  97          HD13      LEU  97   5.483  16.738   7.899
    9   HD23  LEU  97          HD21      LEU  97   4.427  18.291  10.907
   10   HD22  LEU  97          HD22      LEU  97   4.044  19.898  10.293
   11   HD21  LEU  97          HD23      LEU  97   5.715  19.467  10.651

  No H/Q in entry =          11
  In of MODEL   49
    1    H    HIS  98           H        HIS  98   6.550  21.165   5.532
    2    HA   HIS  98           HA       HIS  98   8.691  22.758   6.439
    3    HB2  HIS  98           HB2      HIS  98   7.417  22.486   3.706
    4    HB3  HIS  98           HB3      HIS  98   8.851  23.472   4.002
    5    HD1  HIS  98           HD1      HIS  98   7.655  19.896   4.028
    6    HD2  HIS  98           HD2      HIS  98  11.224  22.009   4.468
    7    HE1  HIS  98           HE1      HIS  98   9.517  18.174   3.991
    8    HE2  HIS  98           HE2      HIS  98  11.695  19.441   4.259

  No H/Q in entry =           8
  In of MODEL   49
    1    H    GLU  99           H        GLU  99   5.474  23.575   5.239
    2    HA   GLU  99           HA       GLU  99   5.842  26.391   5.172
    3    HB2  GLU  99           HB2      GLU  99   3.975  25.209   4.033
    4    HB3  GLU  99           HB3      GLU  99   3.270  24.851   5.609
    5    HG2  GLU  99           HG2      GLU  99   3.077  27.245   6.099
    6    HG3  GLU  99           HG3      GLU  99   3.862  27.641   4.574

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LYS 100           H        LYS 100   4.704  24.161   7.695
    2    HA   LYS 100           HA       LYS 100   4.096  26.221   9.577
    3    HB2  LYS 100           HB2      LYS 100   4.681  23.273   9.938
    4    HB3  LYS 100           HB3      LYS 100   4.221  24.350  11.263
    5    HG2  LYS 100           HG2      LYS 100   2.161  24.974   9.999
    6    HG3  LYS 100           HG3      LYS 100   2.601  23.802   8.754
    7    HD2  LYS 100           HD2      LYS 100   2.519  21.987  10.422
    8    HD3  LYS 100           HD3      LYS 100   2.096  23.154  11.678
    9    HE2  LYS 100           HE2      LYS 100   0.049  23.762  10.399
   10    HE3  LYS 100           HE3      LYS 100   0.462  22.539   9.191
   11    HZ1  LYS 100           HZ1      LYS 100   0.179  21.883  12.073
   12    HZ3  LYS 100           HZ2      LYS 100   0.177  20.823  10.742
   13    HZ2  LYS 100           HZ3      LYS 100  -1.145  21.859  11.009

  No H/Q in entry =          13
  In of MODEL   49
    1    H    LEU 101           H        LEU 101   7.032  24.433   8.770
    2    HA   LEU 101           HA       LEU 101   8.613  25.288  10.981
    3    HB2  LEU 101           HB2      LEU 101   9.230  24.292   8.211
    4    HB3  LEU 101           HB3      LEU 101  10.522  24.966   9.198
    5    HG   LEU 101           HG       LEU 101   8.691  22.808  10.258
    6   HD12  LEU 101          HD11      LEU 101  10.755  21.318   9.670
    7   HD11  LEU 101          HD12      LEU 101  11.125  22.577   8.495
    8   HD13  LEU 101          HD13      LEU 101   9.600  21.698   8.394
    9   HD21  LEU 101          HD21      LEU 101  11.406  23.929  11.000
   10   HD23  LEU 101          HD22      LEU 101  10.865  22.357  11.582
   11   HD22  LEU 101          HD23      LEU 101   9.965  23.811  12.008

  No H/Q in entry =          11
  In of MODEL   49
    1    H    LYS 102           H        LYS 102   7.037  27.137   8.821
    2    HA   LYS 102           HA       LYS 102   7.109  29.429   8.521
    3    HB2  LYS 102           HB2      LYS 102   8.659  29.328  10.630
    4    HB3  LYS 102           HB3      LYS 102   9.966  29.522   9.479
    5    HG2  LYS 102           HG2      LYS 102   7.848  31.471  10.318
    6    HG3  LYS 102           HG3      LYS 102   9.561  31.736  10.077
    7    HD2  LYS 102           HD2      LYS 102   7.627  31.297   7.766
    8    HD3  LYS 102           HD3      LYS 102   8.000  32.881   8.430
    9    HE2  LYS 102           HE2      LYS 102   9.391  31.692   6.371
   10    HE3  LYS 102           HE3      LYS 102   9.996  33.005   7.381
   11    HZ2  LYS 102           HZ1      LYS 102  11.524  31.105   7.224
   12    HZ1  LYS 102           HZ2      LYS 102  10.361  30.122   7.963
   13    HZ3  LYS 102           HZ3      LYS 102  11.043  31.414   8.821

  No H/Q in entry =          13
  In of MODEL   49
    1    H    ALA 103           H        ALA 103  10.374  28.099   7.984
    2    HA   ALA 103           HA       ALA 103  11.347  29.470   5.909
    3    HB2  ALA 103           HB1      ALA 103  12.246  27.255   4.996
    4    HB1  ALA 103           HB2      ALA 103  11.345  26.483   6.299
    5    HB3  ALA 103           HB3      ALA 103  12.628  27.633   6.676

  No H/Q in entry =           5
  In of MODEL   49
    1    H1   LYS   3           H1       LYS   3 -31.200   6.462 -19.527
    2    H2   LYS   3           H3       LYS   3 -30.223   6.186 -20.887
    3    H3   LYS   3           H2       LYS   3 -31.621   5.254 -20.642
    4    HA   LYS   3           HA       LYS   3 -30.617   3.841 -19.264
    5    HB2  LYS   3           HB2      LYS   3 -28.336   5.257 -20.593
    6    HB3  LYS   3           HB3      LYS   3 -28.011   4.031 -19.368
    7    HG2  LYS   3           HG2      LYS   3 -29.451   2.471 -20.729
    8    HG3  LYS   3           HG3      LYS   3 -29.407   3.688 -22.005
    9    HD2  LYS   3           HD2      LYS   3 -26.925   3.559 -21.972
   10    HD3  LYS   3           HD3      LYS   3 -27.043   2.246 -20.801
   11    HE2  LYS   3           HE2      LYS   3 -28.561   1.102 -22.524
   12    HE3  LYS   3           HE3      LYS   3 -27.942   2.291 -23.668
   13    HZ3  LYS   3           HZ1      LYS   3 -26.152   1.056 -23.965
   14    HZ2  LYS   3           HZ2      LYS   3 -26.782  -0.122 -22.917
   15    HZ1  LYS   3           HZ3      LYS   3 -25.781   1.108 -22.309

  No H/Q in entry =          15
  In of MODEL   49
    1    H    LYS   4           H        LYS   4 -30.657   3.672 -17.204
    2    HA   LYS   4           HA       LYS   4 -29.901   5.932 -15.530
    3    HB2  LYS   4           HB2      LYS   4 -31.116   3.238 -14.856
    4    HB3  LYS   4           HB3      LYS   4 -30.878   4.560 -13.715
    5    HG2  LYS   4           HG2      LYS   4 -32.702   4.543 -16.124
    6    HG3  LYS   4           HG3      LYS   4 -33.181   4.574 -14.428
    7    HD2  LYS   4           HD2      LYS   4 -32.468   6.788 -14.138
    8    HD3  LYS   4           HD3      LYS   4 -31.439   6.741 -15.568
    9    HE2  LYS   4           HE2      LYS   4 -33.358   8.133 -16.000
   10    HE3  LYS   4           HE3      LYS   4 -33.454   6.675 -16.987
   11    HZ3  LYS   4           HZ1      LYS   4 -35.026   5.754 -15.441
   12    HZ2  LYS   4           HZ2      LYS   4 -35.575   7.260 -16.001
   13    HZ1  LYS   4           HZ3      LYS   4 -34.909   7.124 -14.445

  No H/Q in entry =          13
  In of MODEL   49
    1    H    HIS   5           H        HIS   5 -28.422   5.985 -13.947
    2    HA   HIS   5           HA       HIS   5 -26.155   4.143 -14.318
    3    HB2  HIS   5           HB2      HIS   5 -26.380   6.884 -13.073
    4    HB3  HIS   5           HB3      HIS   5 -24.907   5.919 -13.079
    5    HD1  HIS   5           HD1      HIS   5 -23.437   7.127 -14.663
    6    HD2  HIS   5           HD2      HIS   5 -27.254   6.557 -16.199
    7    HE1  HIS   5           HE1      HIS   5 -23.281   7.738 -17.107
    8    HE2  HIS   5           HE2      HIS   5 -25.608   7.378 -18.012

  No H/Q in entry =           8
  In of MODEL   49
    1    H    ILE   6           H        ILE   6 -25.931   2.552 -13.023
    2    HA   ILE   6           HA       ILE   6 -26.886   2.792 -10.249
    3    HB   ILE   6           HB       ILE   6 -26.092   0.338 -11.825
    4   HG12  ILE   6          HG12      ILE   6 -28.822   1.287 -10.942
    5   HG13  ILE   6          HG13      ILE   6 -28.188   1.465 -12.578
    6   HG23  ILE   6          HG21      ILE   6 -26.463  -0.935  -9.978
    7   HG22  ILE   6          HG22      ILE   6 -27.606   0.212  -9.276
    8   HG21  ILE   6          HG23      ILE   6 -25.873   0.532  -9.194
    9   HD13  ILE   6          HD11      ILE   6 -28.670  -0.644 -13.103
   10   HD12  ILE   6          HD12      ILE   6 -29.675  -0.636 -11.654
   11   HD11  ILE   6          HD13      ILE   6 -28.026  -1.259 -11.581

  No H/Q in entry =          11
  In of MODEL   49
    1    H    TYR   7           H        TYR   7 -25.111   3.400  -8.966
    2    HA   TYR   7           HA       TYR   7 -22.414   2.428  -9.677
    3    HB2  TYR   7           HB2      TYR   7 -23.346   4.851  -8.158
    4    HB3  TYR   7           HB3      TYR   7 -21.666   4.321  -8.214
    5    HD1  TYR   7           HD1      TYR   7 -22.736   3.429 -11.309
    6    HD2  TYR   7           HD2      TYR   7 -22.017   6.965  -9.042
    7    HE1  TYR   7           HE1      TYR   7 -22.306   4.681 -13.387
    8    HE2  TYR   7           HE2      TYR   7 -21.631   8.223 -11.111
    9    HH   TYR   7           HH       TYR   7 -21.864   8.168 -13.342

  No H/Q in entry =           9
  In of MODEL   49
    1    H    LEU   8           H        LEU   8 -21.452   1.050  -8.373
    2    HA   LEU   8           HA       LEU   8 -22.569   0.530  -5.688
    3    HB2  LEU   8           HB2      LEU   8 -20.894  -1.125  -7.555
    4    HB3  LEU   8           HB3      LEU   8 -21.072  -1.527  -5.847
    5    HG   LEU   8           HG       LEU   8 -23.556  -1.670  -6.255
    6   HD13  LEU   8          HD11      LEU   8 -23.690  -0.426  -8.348
    7   HD12  LEU   8          HD12      LEU   8 -24.236  -2.082  -8.605
    8   HD11  LEU   8          HD13      LEU   8 -22.627  -1.592  -9.135
    9   HD23  LEU   8          HD21      LEU   8 -22.312  -3.702  -7.983
   10   HD22  LEU   8          HD22      LEU   8 -23.392  -3.876  -6.601
   11   HD21  LEU   8          HD23      LEU   8 -21.680  -3.543  -6.346

  No H/Q in entry =          11
  In of MODEL   49
    1    H    PHE   9           H        PHE   9 -21.274   0.887  -3.902
    2    HA   PHE   9           HA       PHE   9 -18.486   1.807  -4.429
    3    HB2  PHE   9           HB2      PHE   9 -20.489   2.837  -2.427
    4    HB3  PHE   9           HB3      PHE   9 -18.772   3.207  -2.354
    5    HD1  PHE   9           HD1      PHE   9 -17.688   4.509  -4.145
    6    HD2  PHE   9           HD2      PHE   9 -21.925   3.835  -4.112
    7    HE1  PHE   9           HE1      PHE   9 -17.985   6.290  -5.841
    8    HE2  PHE   9           HE2      PHE   9 -22.223   5.628  -5.801
    9    HZ   PHE   9           HZ       PHE   9 -20.251   6.851  -6.672

  No H/Q in entry =           9
  In of MODEL   49
    1    H    SER  10           H        SER  10 -16.900   0.781  -3.412
    2    HA   SER  10           HA       SER  10 -17.058  -0.202  -0.739
    3    HB2  SER  10           HB2      SER  10 -18.291  -2.019  -1.926
    4    HB3  SER  10           HB3      SER  10 -16.873  -2.270  -2.931
    5    HG   SER  10           HG       SER  10 -16.828  -3.685  -1.196

  No H/Q in entry =           5
  In of MODEL   49
    1    H    SER  11           H        SER  11 -15.036  -0.036   0.058
    2    HA   SER  11           HA       SER  11 -12.888   0.866  -1.492
    3    HB2  SER  11           HB2      SER  11 -11.661   0.886   0.475
    4    HB3  SER  11           HB3      SER  11 -13.322   0.974   1.064
    5    HG   SER  11           HG       SER  11 -11.449  -0.949   1.431

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ALA  12           H        ALA  12 -14.073  -1.869  -2.270
    2    HA   ALA  12           HA       ALA  12 -11.482  -3.044  -2.900
    3    HB2  ALA  12           HB1      ALA  12 -11.785  -5.122  -1.944
    4    HB1  ALA  12           HB2      ALA  12 -13.542  -4.968  -1.899
    5    HB3  ALA  12           HB3      ALA  12 -12.552  -4.094  -0.731

  No H/Q in entry =           5
  In of MODEL   49
    1    H    GLY  13           H        GLY  13 -12.219  -2.102  -4.915
    2    HA3  GLY  13           HA2      GLY  13 -14.504  -2.715  -6.351
    3    HA2  GLY  13           HA3      GLY  13 -12.947  -2.328  -7.097

  No H/Q in entry =           3
  In of MODEL   49
    1    H    MET  14           H        MET  14 -11.481  -4.638  -6.270
    2    HA   MET  14           HA       MET  14 -12.027  -6.377  -8.349
    3    HB2  MET  14           HB2      MET  14  -9.912  -6.512  -7.126
    4    HB3  MET  14           HB3      MET  14 -10.736  -7.178  -5.717
    5    HG2  MET  14           HG2      MET  14 -11.441  -9.131  -7.092
    6    HG3  MET  14           HG3      MET  14 -10.561  -8.462  -8.466
    7    HE1  MET  14           HE1      MET  14  -8.360  -7.860  -8.571
    8    HE3  MET  14           HE2      MET  14  -6.996  -8.691  -7.826
    9    HE2  MET  14           HE3      MET  14  -7.719  -7.303  -7.017

  No H/Q in entry =           9
  In of MODEL   49
    1    H    SER  15           H        SER  15 -13.108  -6.864  -4.981
    2    HA   SER  15           HA       SER  15 -14.546  -9.264  -5.645
    3    HB2  SER  15           HB2      SER  15 -14.021  -9.131  -3.344
    4    HB3  SER  15           HB3      SER  15 -14.613  -7.476  -3.220
    5    HG   SER  15           HG       SER  15 -15.955  -9.820  -2.940

  No H/Q in entry =           5
  In of MODEL   49
    1    H    THR  16           H        THR  16 -15.580  -5.859  -5.176
    2    HA   THR  16           HA       THR  16 -18.381  -6.342  -5.654
    3    HB   THR  16           HB       THR  16 -16.831  -3.781  -6.169
    4    HG1  THR  16           HG1      THR  16 -17.828  -3.540  -3.861
    5   HG23  THR  16          HG21      THR  16 -18.883  -2.696  -5.997
    6   HG22  THR  16          HG22      THR  16 -19.619  -4.017  -5.072
    7   HG21  THR  16          HG23      THR  16 -19.343  -4.186  -6.812

  No H/Q in entry =           7
  In of MODEL   49
    1    H    SER  17           H        SER  17 -15.594  -5.766  -7.544
    2    HA   SER  17           HA       SER  17 -16.730  -4.985 -10.029
    3    HB2  SER  17           HB2      SER  17 -14.109  -6.339  -9.360
    4    HB3  SER  17           HB3      SER  17 -14.556  -5.873 -11.002
    5    HG   SER  17           HG       SER  17 -13.603  -4.358  -8.979

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LEU  18           H        LEU  18 -16.181  -8.152  -8.624
    2    HA   LEU  18           HA       LEU  18 -16.792  -9.617 -10.995
    3    HB2  LEU  18           HB2      LEU  18 -15.570 -10.611  -9.111
    4    HB3  LEU  18           HB3      LEU  18 -16.993 -10.421  -8.087
    5    HG   LEU  18           HG       LEU  18 -18.241 -11.973  -9.490
    6   HD12  LEU  18          HD11      LEU  18 -16.739 -13.268 -11.192
    7   HD11  LEU  18          HD12      LEU  18 -15.755 -11.804 -11.159
    8   HD13  LEU  18          HD13      LEU  18 -17.441 -11.722 -11.664
    9   HD22  LEU  18          HD21      LEU  18 -17.234 -13.930  -8.752
   10   HD21  LEU  18          HD22      LEU  18 -16.696 -12.694  -7.612
   11   HD23  LEU  18          HD23      LEU  18 -15.609 -13.252  -8.884

  No H/Q in entry =          11
  In of MODEL   49
    1    H    LEU  19           H        LEU  19 -18.736  -8.428  -8.258
    2    HA   LEU  19           HA       LEU  19 -21.213  -9.580  -9.091
    3    HB2  LEU  19           HB2      LEU  19 -20.936  -8.783  -6.832
    4    HB3  LEU  19           HB3      LEU  19 -20.621  -7.148  -7.412
    5    HG   LEU  19           HG       LEU  19 -22.957  -6.957  -8.134
    6   HD12  LEU  19          HD11      LEU  19 -24.578  -8.679  -7.385
    7   HD11  LEU  19          HD12      LEU  19 -23.228  -9.703  -6.899
    8   HD13  LEU  19          HD13      LEU  19 -23.453  -9.290  -8.599
    9   HD21  LEU  19          HD21      LEU  19 -22.282  -7.620  -5.299
   10   HD23  LEU  19          HD22      LEU  19 -23.924  -7.162  -5.747
   11   HD22  LEU  19          HD23      LEU  19 -22.588  -6.050  -6.041

  No H/Q in entry =          11
  In of MODEL   49
    1    H    VAL  20           H        VAL  20 -19.695  -6.423  -9.755
    2    HA   VAL  20           HA       VAL  20 -21.808  -5.345 -11.298
    3    HB   VAL  20           HB       VAL  20 -18.814  -4.776 -11.435
    4   HG13  VAL  20          HG11      VAL  20 -19.677  -4.133 -13.575
    5   HG12  VAL  20          HG12      VAL  20 -19.555  -2.656 -12.619
    6   HG11  VAL  20          HG13      VAL  20 -21.123  -3.429 -12.852
    7   HG22  VAL  20          HG21      VAL  20 -19.586  -4.026  -9.375
    8   HG21  VAL  20          HG22      VAL  20 -21.132  -3.501 -10.038
    9   HG23  VAL  20          HG23      VAL  20 -19.664  -2.591 -10.398

  No H/Q in entry =           9
  In of MODEL   49
    1    H    SER  21           H        SER  21 -19.072  -7.404 -12.367
    2    HA   SER  21           HA       SER  21 -19.871  -7.252 -15.112
    3    HB2  SER  21           HB2      SER  21 -18.449  -9.216 -15.483
    4    HB3  SER  21           HB3      SER  21 -17.608  -7.999 -14.525
    5    HG   SER  21           HG       SER  21 -18.559 -10.507 -13.810

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LYS  22           H        LYS  22 -20.940  -9.461 -12.562
    2    HA   LYS  22           HA       LYS  22 -22.503 -11.044 -14.395
    3    HB2  LYS  22           HB2      LYS  22 -21.768 -11.886 -12.174
    4    HB3  LYS  22           HB3      LYS  22 -22.862 -10.730 -11.414
    5    HG2  LYS  22           HG2      LYS  22 -24.259 -12.490 -11.362
    6    HG3  LYS  22           HG3      LYS  22 -24.592 -12.015 -13.027
    7    HD2  LYS  22           HD2      LYS  22 -22.470 -14.022 -12.285
    8    HD3  LYS  22           HD3      LYS  22 -24.137 -14.474 -12.645
    9    HE2  LYS  22           HE2      LYS  22 -23.177 -14.757 -14.716
   10    HE3  LYS  22           HE3      LYS  22 -23.708 -13.081 -14.841
   11    HZ3  LYS  22           HZ1      LYS  22 -21.641 -12.553 -15.326
   12    HZ2  LYS  22           HZ2      LYS  22 -21.105 -14.140 -15.045
   13    HZ1  LYS  22           HZ3      LYS  22 -21.163 -13.025 -13.766

  No H/Q in entry =          13
  In of MODEL   49
    1    H    MET  23           H        MET  23 -23.189  -8.140 -12.486
    2    HA   MET  23           HA       MET  23 -26.000  -8.186 -12.977
    3    HB2  MET  23           HB2      MET  23 -24.129  -5.903 -12.385
    4    HB3  MET  23           HB3      MET  23 -25.873  -5.715 -12.551
    5    HG2  MET  23           HG2      MET  23 -26.266  -7.040 -10.596
    6    HG3  MET  23           HG3      MET  23 -24.559  -7.469 -10.486
    7    HE2  MET  23           HE1      MET  23 -26.816  -3.812  -9.237
    8    HE1  MET  23           HE2      MET  23 -27.088  -4.759 -10.698
    9    HE3  MET  23           HE3      MET  23 -26.039  -3.341 -10.749

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ARG  24           H        ARG  24 -23.243  -6.761 -14.758
    2    HA   ARG  24           HA       ARG  24 -24.739  -5.420 -16.731
    3    HB2  ARG  24           HB2      ARG  24 -22.288  -5.054 -16.355
    4    HB3  ARG  24           HB3      ARG  24 -21.974  -6.643 -17.010
    5    HG2  ARG  24           HG2      ARG  24 -22.867  -5.925 -19.232
    6    HG3  ARG  24           HG3      ARG  24 -23.165  -4.304 -18.550
    7    HD2  ARG  24           HD2      ARG  24 -20.461  -5.726 -18.609
    8    HD3  ARG  24           HD3      ARG  24 -20.973  -4.472 -19.732
    9    HE   ARG  24           HE       ARG  24 -21.239  -3.163 -17.460
   10   HH21  ARG  24          HH11      ARG  24 -19.785  -1.454 -17.584
   11   HH22  ARG  24          HH12      ARG  24 -18.098  -1.777 -17.781
   12   HH11  ARG  24          HH21      ARG  24 -18.713  -5.204 -18.415
   13   HH12  ARG  24          HH22      ARG  24 -17.473  -4.000 -18.261

  No H/Q in entry =          13
  In of MODEL   49
    1    H    ALA  25           H        ALA  25 -23.650  -8.773 -16.506
    2    HA   ALA  25           HA       ALA  25 -24.301  -9.562 -19.151
    3    HB1  ALA  25           HB1      ALA  25 -23.624 -11.610 -18.486
    4    HB3  ALA  25           HB2      ALA  25 -24.673 -11.597 -17.069
    5    HB2  ALA  25           HB3      ALA  25 -23.109 -10.788 -17.014

  No H/Q in entry =           5
  In of MODEL   49
    1    H    GLN  26           H        GLN  26 -26.112  -9.622 -16.118
    2    HA   GLN  26           HA       GLN  26 -28.474 -10.785 -17.137
    3    HB2  GLN  26           HB2      GLN  26 -27.930  -9.076 -14.730
    4    HB3  GLN  26           HB3      GLN  26 -29.502  -9.777 -15.081
    5    HG2  GLN  26           HG2      GLN  26 -26.931 -11.268 -14.646
    6    HG3  GLN  26           HG3      GLN  26 -28.284 -11.166 -13.528
    7   HE21  GLN  26          HE21      GLN  26 -27.097 -13.327 -14.840
    8   HE22  GLN  26          HE22      GLN  26 -28.156 -14.350 -15.646

  No H/Q in entry =           8
  In of MODEL   49
    1    H    ALA  27           H        ALA  27 -27.500  -7.404 -16.704
    2    HA   ALA  27           HA       ALA  27 -29.981  -6.272 -17.459
    3    HB1  ALA  27           HB1      ALA  27 -28.151  -4.994 -16.336
    4    HB3  ALA  27           HB2      ALA  27 -28.740  -4.200 -17.798
    5    HB2  ALA  27           HB3      ALA  27 -27.216  -5.084 -17.830

  No H/Q in entry =           5
  In of MODEL   49
    1    H    GLU  28           H        GLU  28 -27.304  -7.499 -19.360
    2    HA   GLU  28           HA       GLU  28 -28.240  -6.413 -21.859
    3    HB2  GLU  28           HB2      GLU  28 -25.866  -7.132 -21.258
    4    HB3  GLU  28           HB3      GLU  28 -26.431  -8.786 -21.480
    5    HG2  GLU  28           HG2      GLU  28 -25.287  -7.996 -23.444
    6    HG3  GLU  28           HG3      GLU  28 -26.990  -8.295 -23.788

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LYS  29           H        LYS  29 -28.434  -9.541 -20.246
    2    HA   LYS  29           HA       LYS  29 -29.764 -10.967 -22.265
    3    HB2  LYS  29           HB2      LYS  29 -28.715 -11.991 -20.281
    4    HB3  LYS  29           HB3      LYS  29 -29.974 -11.284 -19.269
    5    HG2  LYS  29           HG2      LYS  29 -31.656 -12.622 -20.347
    6    HG3  LYS  29           HG3      LYS  29 -30.470 -13.255 -21.487
    7    HD2  LYS  29           HD2      LYS  29 -29.332 -14.459 -19.778
    8    HD3  LYS  29           HD3      LYS  29 -30.222 -13.626 -18.505
    9    HE2  LYS  29           HE2      LYS  29 -31.003 -15.961 -18.897
   10    HE3  LYS  29           HE3      LYS  29 -32.269 -14.750 -19.117
   11    HZ1  LYS  29           HZ1      LYS  29 -31.718 -14.855 -21.549
   12    HZ3  LYS  29           HZ2      LYS  29 -32.450 -16.243 -20.899
   13    HZ2  LYS  29           HZ3      LYS  29 -30.781 -16.230 -21.206

  No H/Q in entry =          13
  In of MODEL   49
    1    H    TYR  30           H        TYR  30 -31.118  -8.883 -19.723
    2    HA   TYR  30           HA       TYR  30 -33.793  -9.284 -20.956
    3    HB2  TYR  30           HB2      TYR  30 -33.113  -8.178 -18.222
    4    HB3  TYR  30           HB3      TYR  30 -34.736  -8.407 -18.870
    5    HD1  TYR  30           HD1      TYR  30 -35.673 -10.685 -19.113
    6    HD2  TYR  30           HD2      TYR  30 -31.822 -10.031 -17.419
    7    HE1  TYR  30           HE1      TYR  30 -35.606 -13.026 -18.350
    8    HE2  TYR  30           HE2      TYR  30 -31.755 -12.357 -16.661
    9    HH   TYR  30           HH       TYR  30 -33.427 -14.684 -17.780

  No H/Q in entry =           9
  In of MODEL   49
    1    H    GLU  31           H        GLU  31 -31.608  -7.305 -21.739
    2    HA   GLU  31           HA       GLU  31 -31.515  -5.137 -22.531
    3    HB2  GLU  31           HB2      GLU  31 -34.421  -5.813 -23.038
    4    HB3  GLU  31           HB3      GLU  31 -33.569  -4.444 -23.751
    5    HG2  GLU  31           HG2      GLU  31 -32.119  -5.880 -24.972
    6    HG3  GLU  31           HG3      GLU  31 -32.695  -7.301 -24.102

  No H/Q in entry =           6
  In of MODEL   49
    1    H    VAL  32           H        VAL  32 -31.699  -5.073 -19.796
    2    HA   VAL  32           HA       VAL  32 -33.536  -2.951 -19.096
    3    HB   VAL  32           HB       VAL  32 -31.145  -3.992 -17.543
    4   HG12  VAL  32          HG11      VAL  32 -32.663  -3.181 -15.627
    5   HG11  VAL  32          HG12      VAL  32 -33.493  -2.250 -16.874
    6   HG13  VAL  32          HG13      VAL  32 -31.781  -1.969 -16.558
    7   HG21  VAL  32          HG21      VAL  32 -32.935  -5.684 -18.247
    8   HG23  VAL  32          HG22      VAL  32 -33.960  -4.863 -17.069
    9   HG22  VAL  32          HG23      VAL  32 -32.448  -5.610 -16.553

  No H/Q in entry =           9
  In of MODEL   49
    1    HA   PRO  33           HA       PRO  33 -30.482  -0.029 -20.742
    2    HB2  PRO  33           HB2      PRO  33 -31.971   2.207 -20.578
    3    HB3  PRO  33           HB3      PRO  33 -32.459   0.926 -21.688
    4    HG2  PRO  33           HG2      PRO  33 -33.406   1.410 -18.863
    5    HG3  PRO  33           HG3      PRO  33 -34.381   1.233 -20.323
    6    HD2  PRO  33           HD2      PRO  33 -33.936  -0.869 -18.690
    7    HD3  PRO  33           HD3      PRO  33 -34.010  -1.084 -20.439

  No H/Q in entry =           7
  In of MODEL   49
    1    H    VAL  34           H        VAL  34 -29.213  -0.615 -18.809
    2    HA   VAL  34           HA       VAL  34 -28.898   1.783 -17.127
    3    HB   VAL  34           HB       VAL  34 -28.321   0.287 -15.215
    4   HG12  VAL  34          HG11      VAL  34 -30.739  -0.568 -14.907
    5   HG11  VAL  34          HG12      VAL  34 -31.057   0.218 -16.452
    6   HG13  VAL  34          HG13      VAL  34 -30.487   1.169 -15.080
    7   HG21  VAL  34          HG21      VAL  34 -28.536  -1.707 -17.252
    8   HG23  VAL  34          HG22      VAL  34 -29.589  -2.078 -15.885
    9   HG22  VAL  34          HG23      VAL  34 -27.866  -1.811 -15.623

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ILE  35           H        ILE  35 -26.914   2.187 -16.291
    2    HA   ILE  35           HA       ILE  35 -24.627   0.856 -17.587
    3    HB   ILE  35           HB       ILE  35 -24.997   3.737 -16.731
    4   HG12  ILE  35          HG12      ILE  35 -24.040   2.459 -19.300
    5   HG13  ILE  35          HG13      ILE  35 -25.663   3.091 -19.021
    6   HG21  ILE  35          HG21      ILE  35 -22.451   2.186 -17.076
    7   HG23  ILE  35          HG22      ILE  35 -22.888   3.350 -15.827
    8   HG22  ILE  35          HG23      ILE  35 -22.510   3.906 -17.458
    9   HD11  ILE  35          HD11      ILE  35 -24.239   5.263 -18.395
   10   HD13  ILE  35          HD12      ILE  35 -24.788   4.910 -20.034
   11   HD12  ILE  35          HD13      ILE  35 -23.137   4.518 -19.553

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ILE  36           H        ILE  36 -23.398  -0.203 -16.010
    2    HA   ILE  36           HA       ILE  36 -23.817   0.373 -13.128
    3    HB   ILE  36           HB       ILE  36 -23.020  -2.320 -14.281
    4   HG12  ILE  36          HG12      ILE  36 -25.816  -1.501 -13.490
    5   HG13  ILE  36          HG13      ILE  36 -25.253  -1.461 -15.161
    6   HG23  ILE  36          HG21      ILE  36 -23.367  -3.177 -12.179
    7   HG22  ILE  36          HG22      ILE  36 -24.480  -1.891 -11.714
    8   HG21  ILE  36          HG23      ILE  36 -22.747  -1.574 -11.789
    9   HD13  ILE  36          HD11      ILE  36 -25.440  -3.669 -15.400
   10   HD12  ILE  36          HD12      ILE  36 -26.496  -3.559 -13.992
   11   HD11  ILE  36          HD13      ILE  36 -24.801  -3.998 -13.789

  No H/Q in entry =          11
  In of MODEL   49
    1    H    GLU  37           H        GLU  37 -22.024   0.970 -12.024
    2    HA   GLU  37           HA       GLU  37 -19.347   0.164 -12.967
    3    HB2  GLU  37           HB2      GLU  37 -20.221   2.951 -12.227
    4    HB3  GLU  37           HB3      GLU  37 -18.536   2.449 -12.361
    5    HG2  GLU  37           HG2      GLU  37 -18.812   2.040 -14.720
    6    HG3  GLU  37           HG3      GLU  37 -20.526   2.440 -14.611

  No H/Q in entry =           6
  In of MODEL   49
    1    H    ALA  38           H        ALA  38 -17.852  -0.113 -11.297
    2    HA   ALA  38           HA       ALA  38 -18.867   0.033  -8.518
    3    HB1  ALA  38           HB1      ALA  38 -17.177  -1.898  -9.982
    4    HB3  ALA  38           HB2      ALA  38 -18.220  -2.146  -8.582
    5    HB2  ALA  38           HB3      ALA  38 -16.602  -1.480  -8.368

  No H/Q in entry =           5
  In of MODEL   49
    1    H    PHE  39           H        PHE  39 -17.608   1.211  -7.033
    2    HA   PHE  39           HA       PHE  39 -15.079   2.407  -7.926
    3    HB2  PHE  39           HB2      PHE  39 -17.495   3.888  -6.918
    4    HB3  PHE  39           HB3      PHE  39 -15.868   4.544  -6.745
    5    HD1  PHE  39           HD1      PHE  39 -14.465   4.660  -8.929
    6    HD2  PHE  39           HD2      PHE  39 -18.718   4.372  -8.795
    7    HE1  PHE  39           HE1      PHE  39 -14.590   5.610 -11.216
    8    HE2  PHE  39           HE2      PHE  39 -18.859   5.312 -11.073
    9    HZ   PHE  39           HZ       PHE  39 -16.799   5.906 -12.304

  No H/Q in entry =           9
  In of MODEL   49
    1    HA   PRO  40           HA       PRO  40 -14.122   1.581  -3.657
    2    HB2  PRO  40           HB2      PRO  40 -12.337   3.573  -3.029
    3    HB3  PRO  40           HB3      PRO  40 -11.909   2.256  -4.122
    4    HG2  PRO  40           HG2      PRO  40 -12.921   5.010  -4.816
    5    HG3  PRO  40           HG3      PRO  40 -11.502   4.173  -5.444
    6    HD2  PRO  40           HD2      PRO  40 -13.733   4.114  -6.846
    7    HD3  PRO  40           HD3      PRO  40 -12.785   2.637  -6.678

  No H/Q in entry =           7
  In of MODEL   49
    1    H    GLU  41           H        GLU  41 -14.725   2.531  -1.509
    2    HA   GLU  41           HA       GLU  41 -16.959   4.248  -1.454
    3    HB2  GLU  41           HB2      GLU  41 -16.797   4.142   0.923
    4    HB3  GLU  41           HB3      GLU  41 -16.335   2.560   0.295
    5    HG2  GLU  41           HG2      GLU  41 -14.754   2.866   1.924
    6    HG3  GLU  41           HG3      GLU  41 -13.909   3.491   0.508

  No H/Q in entry =           6
  In of MODEL   49
    1    H    THR  42           H        THR  42 -13.622   5.145  -1.511
    2    HA   THR  42           HA       THR  42 -13.952   7.689  -0.259
    3    HB   THR  42           HB       THR  42 -11.798   8.267  -1.350
    4    HG1  THR  42           HG1      THR  42 -12.510   6.759  -3.209
    5   HG21  THR  42          HG21      THR  42 -11.896   6.882   0.744
    6   HG23  THR  42          HG22      THR  42 -10.452   6.603  -0.231
    7   HG22  THR  42          HG23      THR  42 -11.777   5.442  -0.267

  No H/Q in entry =           7
  In of MODEL   49
    1    H    LEU  43           H        LEU  43 -14.881   6.647  -3.370
    2    HA   LEU  43           HA       LEU  43 -15.122   9.435  -4.297
    3    HB2  LEU  43           HB2      LEU  43 -15.318   6.768  -5.662
    4    HB3  LEU  43           HB3      LEU  43 -15.860   8.258  -6.432
    5    HG   LEU  43           HG       LEU  43 -13.023   7.683  -5.613
    6   HD12  LEU  43          HD11      LEU  43 -12.872   7.763  -8.239
    7   HD11  LEU  43          HD12      LEU  43 -14.554   7.246  -8.134
    8   HD13  LEU  43          HD13      LEU  43 -13.284   6.264  -7.406
    9   HD21  LEU  43          HD21      LEU  43 -14.433   9.980  -6.930
   10   HD23  LEU  43          HD22      LEU  43 -12.740   9.648  -7.301
   11   HD22  LEU  43          HD23      LEU  43 -13.226  10.000  -5.644

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ALA  44           H        ALA  44 -17.069   7.594  -2.461
    2    HA   ALA  44           HA       ALA  44 -19.554   7.488  -3.770
    3    HB2  ALA  44           HB1      ALA  44 -19.411   6.340  -1.692
    4    HB3  ALA  44           HB2      ALA  44 -20.508   7.688  -1.393
    5    HB1  ALA  44           HB3      ALA  44 -18.834   7.778  -0.848

  No H/Q in entry =           5
  In of MODEL   49
    1    H    GLY  45           H        GLY  45 -18.109  10.258  -2.205
    2    HA3  GLY  45           HA2      GLY  45 -20.539  11.776  -2.529
    3    HA2  GLY  45           HA3      GLY  45 -18.988  12.383  -1.952

  No H/Q in entry =           3
  In of MODEL   49
    1    H    GLU  46           H        GLU  46 -17.475  11.472  -4.265
    2    HA   GLU  46           HA       GLU  46 -18.109  13.717  -5.998
    3    HB2  GLU  46           HB2      GLU  46 -15.931  11.622  -6.086
    4    HB3  GLU  46           HB3      GLU  46 -16.054  12.983  -7.202
    5    HG2  GLU  46           HG2      GLU  46 -15.688  13.208  -4.221
    6    HG3  GLU  46           HG3      GLU  46 -14.400  13.345  -5.418

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LYS  47           H        LYS  47 -18.013  10.205  -6.486
    2    HA   LYS  47           HA       LYS  47 -19.124  10.470  -9.151
    3    HB2  LYS  47           HB2      LYS  47 -17.992   8.321  -7.492
    4    HB3  LYS  47           HB3      LYS  47 -19.340   7.822  -8.514
    5    HG2  LYS  47           HG2      LYS  47 -17.250   7.431  -9.642
    6    HG3  LYS  47           HG3      LYS  47 -18.153   8.697 -10.470
    7    HD2  LYS  47           HD2      LYS  47 -16.820  10.392  -9.270
    8    HD3  LYS  47           HD3      LYS  47 -15.881   9.097  -8.530
    9    HE2  LYS  47           HE2      LYS  47 -16.103   9.629 -11.486
   10    HE3  LYS  47           HE3      LYS  47 -14.736  10.070 -10.465
   11    HZ2  LYS  47           HZ1      LYS  47 -15.683   7.372 -11.196
   12    HZ1  LYS  47           HZ2      LYS  47 -14.637   7.633  -9.884
   13    HZ3  LYS  47           HZ3      LYS  47 -14.153   8.061 -11.455

  No H/Q in entry =          13
  In of MODEL   49
    1    H    GLY  48           H        GLY  48 -20.434   9.674  -6.007
    2    HA3  GLY  48           HA2      GLY  48 -22.830   8.515  -6.751
    3    HA2  GLY  48           HA3      GLY  48 -22.591   9.486  -5.299

  No H/Q in entry =           3
  In of MODEL   49
    1    H    GLN  49           H        GLN  49 -22.003  11.928  -6.838
    2    HA   GLN  49           HA       GLN  49 -24.556  13.057  -6.951
    3    HB2  GLN  49           HB2      GLN  49 -22.015  13.925  -8.313
    4    HB3  GLN  49           HB3      GLN  49 -23.470  14.898  -8.206
    5    HG2  GLN  49           HG2      GLN  49 -23.298  14.885  -5.770
    6    HG3  GLN  49           HG3      GLN  49 -21.854  13.892  -5.876
    7   HE21  GLN  49          HE21      GLN  49 -21.716  16.100  -4.571
    8   HE22  GLN  49          HE22      GLN  49 -20.789  17.361  -5.205

  No H/Q in entry =           8
  In of MODEL   49
    1    H    ASN  50           H        ASN  50 -22.901  11.202  -9.375
    2    HA   ASN  50           HA       ASN  50 -24.791  12.116 -11.433
    3    HB2  ASN  50           HB2      ASN  50 -22.222  10.564 -11.704
    4    HB3  ASN  50           HB3      ASN  50 -23.277  11.016 -13.035
    5   HD21  ASN  50          HD21      ASN  50 -20.627  11.822 -11.427
    6   HD22  ASN  50          HD22      ASN  50 -20.385  13.461 -11.747

  No H/Q in entry =           6
  In of MODEL   49
    1    H    ALA  51           H        ALA  51 -24.779   9.727  -9.222
    2    HA   ALA  51           HA       ALA  51 -25.587   7.614 -11.075
    3    HB2  ALA  51           HB1      ALA  51 -25.003   6.236  -9.412
    4    HB3  ALA  51           HB2      ALA  51 -26.114   7.036  -8.301
    5    HB1  ALA  51           HB3      ALA  51 -24.473   7.650  -8.498

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ASP  52           H        ASP  52 -27.599   6.570 -10.939
    2    HA   ASP  52           HA       ASP  52 -29.764   8.408 -10.235
    3    HB2  ASP  52           HB2      ASP  52 -29.599   5.926 -11.942
    4    HB3  ASP  52           HB3      ASP  52 -31.137   6.664 -11.488

  No H/Q in entry =           4
  In of MODEL   49
    1    H    VAL  53           H        VAL  53 -28.178   5.494  -9.270
    2    HA   VAL  53           HA       VAL  53 -29.603   5.594  -6.745
    3    HB   VAL  53           HB       VAL  53 -31.020   3.980  -8.004
    4   HG11  VAL  53          HG11      VAL  53 -29.288   3.131  -9.549
    5   HG13  VAL  53          HG12      VAL  53 -30.126   1.830  -8.703
    6   HG12  VAL  53          HG13      VAL  53 -28.509   2.313  -8.195
    7   HG23  VAL  53          HG21      VAL  53 -30.203   1.973  -6.345
    8   HG22  VAL  53          HG22      VAL  53 -31.321   3.280  -5.953
    9   HG21  VAL  53          HG23      VAL  53 -29.610   3.433  -5.554

  No H/Q in entry =           9
  In of MODEL   49
    1    H    VAL  54           H        VAL  54 -28.284   5.127  -5.104
    2    HA   VAL  54           HA       VAL  54 -25.534   4.267  -5.743
    3    HB   VAL  54           HB       VAL  54 -26.577   6.019  -3.461
    4   HG11  VAL  54          HG11      VAL  54 -24.011   4.584  -3.788
    5   HG13  VAL  54          HG12      VAL  54 -24.750   5.249  -2.332
    6   HG12  VAL  54          HG13      VAL  54 -23.844   6.301  -3.418
    7   HG22  VAL  54          HG21      VAL  54 -25.710   7.843  -4.539
    8   HG21  VAL  54          HG22      VAL  54 -26.273   6.876  -5.903
    9   HG23  VAL  54          HG23      VAL  54 -24.564   6.882  -5.474

  No H/Q in entry =           9
  In of MODEL   49
    1    H    LEU  55           H        LEU  55 -24.953   2.331  -5.132
    2    HA   LEU  55           HA       LEU  55 -26.458   1.000  -2.967
    3    HB2  LEU  55           HB2      LEU  55 -24.924  -0.147  -5.288
    4    HB3  LEU  55           HB3      LEU  55 -25.685  -1.094  -4.008
    5    HG   LEU  55           HG       LEU  55 -27.121   0.537  -6.095
    6   HD13  LEU  55          HD11      LEU  55 -26.843  -1.301  -7.342
    7   HD12  LEU  55          HD12      LEU  55 -27.801  -2.186  -6.155
    8   HD11  LEU  55          HD13      LEU  55 -26.044  -2.137  -6.013
    9   HD23  LEU  55          HD21      LEU  55 -28.420  -1.426  -4.260
   10   HD22  LEU  55          HD22      LEU  55 -29.109  -0.027  -5.084
   11   HD21  LEU  55          HD23      LEU  55 -28.080   0.200  -3.670

  No H/Q in entry =          11
  In of MODEL   49
    1    H    LEU  56           H        LEU  56 -25.301   0.371  -1.177
    2    HA   LEU  56           HA       LEU  56 -22.364   0.743  -1.238
    3    HB2  LEU  56           HB2      LEU  56 -24.155   0.512   1.168
    4    HB3  LEU  56           HB3      LEU  56 -22.442   0.928   1.153
    5    HG   LEU  56           HG       LEU  56 -24.733   2.638   0.227
    6   HD11  LEU  56          HD11      LEU  56 -23.607   2.211   2.735
    7   HD13  LEU  56          HD12      LEU  56 -24.589   3.595   2.255
    8   HD12  LEU  56          HD13      LEU  56 -22.832   3.687   2.158
    9   HD23  LEU  56          HD21      LEU  56 -22.776   4.324   0.046
   10   HD22  LEU  56          HD22      LEU  56 -23.175   3.249  -1.294
   11   HD21  LEU  56          HD23      LEU  56 -21.818   2.870  -0.234

  No H/Q in entry =          11
  In of MODEL   49
    1    H    GLY  57           H        GLY  57 -20.995  -0.906  -0.736
    2    HA3  GLY  57           HA2      GLY  57 -21.938  -3.582  -0.968
    3    HA2  GLY  57           HA3      GLY  57 -20.311  -3.107  -0.488

  No H/Q in entry =           3
  In of MODEL   49
    1    HA   PRO  58           HA       PRO  58 -23.107  -4.177   3.221
    2    HB2  PRO  58           HB2      PRO  58 -22.442  -6.796   3.785
    3    HB3  PRO  58           HB3      PRO  58 -23.829  -6.361   2.787
    4    HG2  PRO  58           HG2      PRO  58 -21.113  -7.253   1.972
    5    HG3  PRO  58           HG3      PRO  58 -22.685  -7.690   1.303
    6    HD2  PRO  58           HD2      PRO  58 -21.068  -5.869   0.097
    7    HD3  PRO  58           HD3      PRO  58 -22.827  -5.766   0.007

  No H/Q in entry =           7
  In of MODEL   49
    1    H    GLN  59           H        GLN  59 -19.744  -4.669   2.587
    2    HA   GLN  59           HA       GLN  59 -18.975  -4.733   5.344
    3    HB2  GLN  59           HB2      GLN  59 -17.334  -3.756   3.004
    4    HB3  GLN  59           HB3      GLN  59 -16.734  -4.235   4.579
    5    HG2  GLN  59           HG2      GLN  59 -18.053  -6.041   2.558
    6    HG3  GLN  59           HG3      GLN  59 -16.331  -5.950   2.891
    7   HE21  GLN  59          HE21      GLN  59 -18.717  -7.664   3.365
    8   HE22  GLN  59          HE22      GLN  59 -18.641  -8.598   4.739

  No H/Q in entry =           8
  In of MODEL   49
    1    H    ILE  60           H        ILE  60 -19.898  -2.142   3.178
    2    HA   ILE  60           HA       ILE  60 -19.018  -0.222   5.246
    3    HB   ILE  60           HB       ILE  60 -19.236   1.537   3.452
    4   HG12  ILE  60          HG12      ILE  60 -19.100  -0.653   1.424
    5   HG13  ILE  60          HG13      ILE  60 -20.671  -0.103   2.006
    6   HG23  ILE  60          HG21      ILE  60 -17.087   1.283   2.771
    7   HG22  ILE  60          HG22      ILE  60 -17.261  -0.449   2.487
    8   HG21  ILE  60          HG23      ILE  60 -17.131   0.165   4.134
    9   HD11  ILE  60          HD11      ILE  60 -19.795   2.270   1.395
   10   HD13  ILE  60          HD12      ILE  60 -20.334   1.203   0.099
   11   HD12  ILE  60          HD13      ILE  60 -18.611   1.403   0.419

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ALA  61           H        ALA  61 -21.486  -1.788   5.307
    2    HA   ALA  61           HA       ALA  61 -23.701  -0.097   4.885
    3    HB1  ALA  61           HB1      ALA  61 -24.921  -1.595   6.197
    4    HB2  ALA  61           HB2      ALA  61 -23.521  -2.011   7.185
    5    HB3  ALA  61           HB3      ALA  61 -23.631  -2.593   5.524

  No H/Q in entry =           5
  In of MODEL   49
    1    H    TYR  62           H        TYR  62 -21.478  -0.269   7.668
    2    HA   TYR  62           HA       TYR  62 -23.009   1.377   9.371
    3    HB2  TYR  62           HB2      TYR  62 -20.963   1.760  10.604
    4    HB3  TYR  62           HB3      TYR  62 -21.027   0.071  10.103
    5    HD1  TYR  62           HD1      TYR  62 -19.445  -0.807   8.443
    6    HD2  TYR  62           HD2      TYR  62 -19.263   3.279   9.679
    7    HE1  TYR  62           HE1      TYR  62 -17.236  -0.586   7.371
    8    HE2  TYR  62           HE2      TYR  62 -17.039   3.494   8.609
    9    HH   TYR  62           HH       TYR  62 -15.938   1.758   6.396

  No H/Q in entry =           9
  In of MODEL   49
    1    H    MET  63           H        MET  63 -21.375   2.263   6.519
    2    HA   MET  63           HA       MET  63 -21.178   5.083   7.252
    3    HB2  MET  63           HB2      MET  63 -20.598   3.590   4.693
    4    HB3  MET  63           HB3      MET  63 -20.393   5.331   4.894
    5    HG2  MET  63           HG2      MET  63 -18.668   4.960   6.548
    6    HG3  MET  63           HG3      MET  63 -18.900   3.217   6.425
    7    HE1  MET  63           HE1      MET  63 -18.356   6.371   4.755
    8    HE3  MET  63           HE2      MET  63 -18.365   5.897   3.056
    9    HE2  MET  63           HE3      MET  63 -16.832   6.141   3.896

  No H/Q in entry =           9
  In of MODEL   49
    1    H    LEU  64           H        LEU  64 -23.765   3.267   6.276
    2    HA   LEU  64           HA       LEU  64 -24.973   4.726   4.225
    3    HB2  LEU  64           HB2      LEU  64 -25.857   2.616   5.119
    4    HB3  LEU  64           HB3      LEU  64 -26.297   3.441   6.613
    5    HG   LEU  64           HG       LEU  64 -27.987   4.730   5.414
    6   HD13  LEU  64          HD11      LEU  64 -27.715   5.000   3.183
    7   HD12  LEU  64          HD12      LEU  64 -28.378   3.373   3.018
    8   HD11  LEU  64          HD13      LEU  64 -26.631   3.614   3.069
    9   HD23  LEU  64          HD21      LEU  64 -28.537   1.933   4.629
   10   HD22  LEU  64          HD22      LEU  64 -29.508   3.063   5.570
   11   HD21  LEU  64          HD23      LEU  64 -28.136   2.245   6.318

  No H/Q in entry =          11
  In of MODEL   49
    1    HA   PRO  65           HA       PRO  65 -27.106   7.862   7.035
    2    HB2  PRO  65           HB2      PRO  65 -25.090   7.968   9.279
    3    HB3  PRO  65           HB3      PRO  65 -26.826   8.265   9.340
    4    HG2  PRO  65           HG2      PRO  65 -25.913   5.988  10.228
    5    HG3  PRO  65           HG3      PRO  65 -27.339   5.985   9.192
    6    HD2  PRO  65           HD2      PRO  65 -24.479   5.352   8.462
    7    HD3  PRO  65           HD3      PRO  65 -25.948   4.487   8.011

  No H/Q in entry =           7
  In of MODEL   49
    1    H    GLU  66           H        GLU  66 -23.550   7.768   7.085
    2    HA   GLU  66           HA       GLU  66 -23.226  10.569   6.719
    3    HB2  GLU  66           HB2      GLU  66 -21.441   8.253   6.022
    4    HB3  GLU  66           HB3      GLU  66 -20.975   9.943   5.836
    5    HG2  GLU  66           HG2      GLU  66 -21.168  10.281   8.210
    6    HG3  GLU  66           HG3      GLU  66 -21.710   8.617   8.422

  No H/Q in entry =           6
  In of MODEL   49
    1    H    ILE  67           H        ILE  67 -23.371   7.858   4.428
    2    HA   ILE  67           HA       ILE  67 -22.950   9.594   2.157
    3    HB   ILE  67           HB       ILE  67 -23.880   6.694   2.301
    4   HG12  ILE  67          HG12      ILE  67 -21.243   7.849   1.379
    5   HG13  ILE  67          HG13      ILE  67 -21.532   7.408   3.060
    6   HG21  ILE  67          HG21      ILE  67 -23.816   8.604   0.102
    7   HG23  ILE  67          HG22      ILE  67 -24.459   6.963   0.134
    8   HG22  ILE  67          HG23      ILE  67 -22.749   7.233  -0.202
    9   HD12  ILE  67          HD11      ILE  67 -21.146   5.665   0.683
   10   HD11  ILE  67          HD12      ILE  67 -22.159   5.085   2.004
   11   HD13  ILE  67          HD13      ILE  67 -20.480   5.526   2.309

  No H/Q in entry =          11
  In of MODEL   49
    1    H    GLN  68           H        GLN  68 -25.822   8.550   3.793
    2    HA   GLN  68           HA       GLN  68 -27.652   9.530   1.845
    3    HB2  GLN  68           HB2      GLN  68 -27.894   9.132   4.824
    4    HB3  GLN  68           HB3      GLN  68 -29.212   9.758   3.848
    5    HG2  GLN  68           HG2      GLN  68 -29.273   7.746   2.544
    6    HG3  GLN  68           HG3      GLN  68 -27.826   7.142   3.327
    7   HE21  GLN  68          HE21      GLN  68 -30.022   5.812   3.187
    8   HE22  GLN  68          HE22      GLN  68 -30.847   5.346   4.601

  No H/Q in entry =           8
  In of MODEL   49
    1    H    ARG  69           H        ARG  69 -26.008  11.137   4.595
    2    HA   ARG  69           HA       ARG  69 -27.344  13.642   4.234
    3    HB2  ARG  69           HB2      ARG  69 -25.001  12.659   5.794
    4    HB3  ARG  69           HB3      ARG  69 -25.060  14.385   5.460
    5    HG2  ARG  69           HG2      ARG  69 -27.369  14.443   6.448
    6    HG3  ARG  69           HG3      ARG  69 -27.181  12.745   6.897
    7    HD2  ARG  69           HD2      ARG  69 -25.451  15.063   7.833
    8    HD3  ARG  69           HD3      ARG  69 -26.586  14.158   8.821
    9    HE   ARG  69           HE       ARG  69 -23.993  13.206   7.841
   10   HH21  ARG  69          HH11      ARG  69 -23.199  11.415   9.006
   11   HH22  ARG  69          HH12      ARG  69 -24.231  10.596  10.130
   12   HH11  ARG  69          HH21      ARG  69 -26.945  12.673   9.550
   13   HH12  ARG  69          HH22      ARG  69 -26.353  11.307  10.435

  No H/Q in entry =          13
  In of MODEL   49
    1    H    LEU  70           H        LEU  70 -24.501  12.217   2.834
    2    HA   LEU  70           HA       LEU  70 -23.363  14.584   1.694
    3    HB2  LEU  70           HB2      LEU  70 -22.396  12.245   2.249
    4    HB3  LEU  70           HB3      LEU  70 -23.028  11.811   0.660
    5    HG   LEU  70           HG       LEU  70 -21.423  13.177  -0.415
    6   HD11  LEU  70          HD11      LEU  70 -20.571  13.968   2.379
    7   HD13  LEU  70          HD12      LEU  70 -21.260  15.030   1.150
    8   HD12  LEU  70          HD13      LEU  70 -19.659  14.330   0.910
    9   HD22  LEU  70          HD21      LEU  70 -20.012  11.437  -0.218
   10   HD21  LEU  70          HD22      LEU  70 -20.936  10.908   1.188
   11   HD23  LEU  70          HD23      LEU  70 -19.535  11.957   1.399

  No H/Q in entry =          11
  In of MODEL   49
    1    H    LEU  71           H        LEU  71 -25.559  12.089   0.556
    2    HA   LEU  71           HA       LEU  71 -26.079  13.620  -1.935
    3    HB2  LEU  71           HB2      LEU  71 -26.326  10.633  -1.531
    4    HB3  LEU  71           HB3      LEU  71 -26.452  11.517  -3.050
    5    HG   LEU  71           HG       LEU  71 -23.920  11.469  -1.406
    6   HD12  LEU  71          HD11      LEU  71 -24.014   9.877  -3.862
    7   HD11  LEU  71          HD12      LEU  71 -25.025   9.249  -2.560
    8   HD13  LEU  71          HD13      LEU  71 -23.300   9.500  -2.294
    9   HD22  LEU  71          HD21      LEU  71 -24.006  13.308  -2.872
   10   HD21  LEU  71          HD22      LEU  71 -24.528  12.293  -4.217
   11   HD23  LEU  71          HD23      LEU  71 -22.905  12.111  -3.552

  No H/Q in entry =          11
  In of MODEL   49
    1    HA   PRO  72           HA       PRO  72 -29.934  13.192   0.706
    2    HB2  PRO  72           HB2      PRO  72 -30.751  15.767   0.668
    3    HB3  PRO  72           HB3      PRO  72 -29.442  15.279   1.744
    4    HG2  PRO  72           HG2      PRO  72 -29.256  16.510  -0.993
    5    HG3  PRO  72           HG3      PRO  72 -28.471  17.028   0.499
    6    HD2  PRO  72           HD2      PRO  72 -27.170  15.474  -1.299
    7    HD3  PRO  72           HD3      PRO  72 -26.906  15.278   0.433

  No H/Q in entry =           7
  In of MODEL   49
    1    H    ASN  73           H        ASN  73 -29.318  14.184  -2.498
    2    HA   ASN  73           HA       ASN  73 -32.186  13.931  -3.115
    3    HB2  ASN  73           HB2      ASN  73 -31.716  15.060  -5.199
    4    HB3  ASN  73           HB3      ASN  73 -31.168  16.011  -3.828
    5   HD21  ASN  73          HD21      ASN  73 -30.390  16.083  -6.509
    6   HD22  ASN  73          HD22      ASN  73 -28.727  15.896  -6.715

  No H/Q in entry =           6
  In of MODEL   49
    1    H    LYS  74           H        LYS  74 -30.241  11.637  -2.736
    2    HA   LYS  74           HA       LYS  74 -30.850  10.290  -5.300
    3    HB2  LYS  74           HB2      LYS  74 -28.311   9.930  -3.702
    4    HB3  LYS  74           HB3      LYS  74 -28.719   9.147  -5.228
    5    HG2  LYS  74           HG2      LYS  74 -28.402  12.108  -4.985
    6    HG3  LYS  74           HG3      LYS  74 -27.048  11.027  -5.314
    7    HD2  LYS  74           HD2      LYS  74 -28.194  10.147  -7.263
    8    HD3  LYS  74           HD3      LYS  74 -29.594  11.164  -6.919
    9    HE2  LYS  74           HE2      LYS  74 -28.337  13.155  -7.341
   10    HE3  LYS  74           HE3      LYS  74 -26.832  12.240  -7.455
   11    HZ2  LYS  74           HZ1      LYS  74 -28.306  12.899  -9.561
   12    HZ1  LYS  74           HZ2      LYS  74 -28.985  11.383  -9.206
   13    HZ3  LYS  74           HZ3      LYS  74 -27.320  11.518  -9.512

  No H/Q in entry =          13
  In of MODEL   49
    1    HA   PRO  75           HA       PRO  75 -32.277   7.286  -2.363
    2    HB2  PRO  75           HB2      PRO  75 -32.637   5.097  -3.975
    3    HB3  PRO  75           HB3      PRO  75 -33.739   6.473  -4.017
    4    HG2  PRO  75           HG2      PRO  75 -31.424   5.860  -5.812
    5    HG3  PRO  75           HG3      PRO  75 -33.067   6.333  -6.242
    6    HD2  PRO  75           HD2      PRO  75 -31.093   8.162  -6.185
    7    HD3  PRO  75           HD3      PRO  75 -32.713   8.584  -5.630

  No H/Q in entry =           7
  In of MODEL   49
    1    H    VAL  76           H        VAL  76 -30.835   6.186  -1.016
    2    HA   VAL  76           HA       VAL  76 -28.399   4.948  -2.157
    3    HB   VAL  76           HB       VAL  76 -28.643   6.381   0.523
    4   HG11  VAL  76          HG11      VAL  76 -26.320   5.071  -0.903
    5   HG13  VAL  76          HG12      VAL  76 -27.014   4.611   0.653
    6   HG12  VAL  76          HG13      VAL  76 -26.141   6.134   0.494
    7   HG22  VAL  76          HG21      VAL  76 -27.946   8.282  -0.341
    8   HG21  VAL  76          HG22      VAL  76 -28.511   7.618  -1.875
    9   HG23  VAL  76          HG23      VAL  76 -26.808   7.492  -1.433

  No H/Q in entry =           9
  In of MODEL   49
    1    H    GLU  77           H        GLU  77 -28.217   2.781  -1.576
    2    HA   GLU  77           HA       GLU  77 -29.001   1.971   1.071
    3    HB2  GLU  77           HB2      GLU  77 -30.641   0.361   0.528
    4    HB3  GLU  77           HB3      GLU  77 -31.167   1.903  -0.148
    5    HG2  GLU  77           HG2      GLU  77 -30.586   1.165  -2.350
    6    HG3  GLU  77           HG3      GLU  77 -29.968  -0.352  -1.703

  No H/Q in entry =           6
  In of MODEL   49
    1    H    VAL  78           H        VAL  78 -28.708  -0.132   1.700
    2    HA   VAL  78           HA       VAL  78 -26.062  -0.938   0.782
    3    HB   VAL  78           HB       VAL  78 -27.770  -1.824   3.146
    4   HG11  VAL  78          HG11      VAL  78 -25.461  -3.079   1.989
    5   HG13  VAL  78          HG12      VAL  78 -26.367  -3.554   3.426
    6   HG12  VAL  78          HG13      VAL  78 -25.027  -2.419   3.564
    7   HG22  VAL  78          HG21      VAL  78 -26.278  -0.508   4.494
    8   HG21  VAL  78          HG22      VAL  78 -27.005   0.493   3.237
    9   HG23  VAL  78          HG23      VAL  78 -25.339  -0.062   3.069

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ILE  79           H        ILE  79 -25.564  -2.842  -0.154
    2    HA   ILE  79           HA       ILE  79 -27.661  -4.264  -1.508
    3    HB   ILE  79           HB       ILE  79 -24.678  -4.847  -1.314
    4   HG12  ILE  79          HG12      ILE  79 -26.309  -3.681  -3.576
    5   HG13  ILE  79          HG13      ILE  79 -25.409  -2.704  -2.414
    6   HG22  ILE  79          HG21      ILE  79 -25.816  -5.973  -3.642
    7   HG21  ILE  79          HG22      ILE  79 -26.801  -6.496  -2.275
    8   HG23  ILE  79          HG23      ILE  79 -25.065  -6.806  -2.281
    9   HD13  ILE  79          HD11      ILE  79 -24.009  -2.817  -4.244
   10   HD12  ILE  79          HD12      ILE  79 -24.382  -4.514  -4.546
   11   HD11  ILE  79          HD13      ILE  79 -23.380  -4.063  -3.165

  No H/Q in entry =          11
  In of MODEL   49
    1    H    ASP  80           H        ASP  80 -28.555  -6.180  -0.946
    2    HA   ASP  80           HA       ASP  80 -28.501  -7.117   1.687
    3    HB2  ASP  80           HB2      ASP  80 -30.276  -7.639   0.052
    4    HB3  ASP  80           HB3      ASP  80 -29.141  -8.654  -0.839

  No H/Q in entry =           4
  In of MODEL   49
    1    H    SER  81           H        SER  81 -26.980  -8.295   2.792
    2    HA   SER  81           HA       SER  81 -24.503  -9.004   1.574
    3    HB2  SER  81           HB2      SER  81 -23.957 -10.074   3.725
    4    HB3  SER  81           HB3      SER  81 -24.626  -8.461   3.965
    5    HG   SER  81           HG       SER  81 -25.771 -10.963   4.450

  No H/Q in entry =           5
  In of MODEL   49
    1    H    LEU  82           H        LEU  82 -27.249 -11.052   1.884
    2    HA   LEU  82           HA       LEU  82 -25.747 -13.440   1.321
    3    HB2  LEU  82           HB2      LEU  82 -28.676 -12.899   0.895
    4    HB3  LEU  82           HB3      LEU  82 -27.895 -14.471   1.049
    5    HG   LEU  82           HG       LEU  82 -28.186 -12.443   3.244
    6   HD13  LEU  82          HD11      LEU  82 -30.327 -13.442   2.669
    7   HD12  LEU  82          HD12      LEU  82 -29.742 -14.154   4.175
    8   HD11  LEU  82          HD13      LEU  82 -29.606 -15.052   2.662
    9   HD22  LEU  82          HD21      LEU  82 -26.199 -13.678   3.600
   10   HD21  LEU  82          HD22      LEU  82 -26.934 -15.171   3.016
   11   HD23  LEU  82          HD23      LEU  82 -27.427 -14.497   4.569

  No H/Q in entry =          11
  In of MODEL   49
    1    H    LEU  83           H        LEU  83 -27.676 -11.153  -0.554
    2    HA   LEU  83           HA       LEU  83 -27.516 -12.481  -3.045
    3    HB2  LEU  83           HB2      LEU  83 -27.870  -9.576  -2.354
    4    HB3  LEU  83           HB3      LEU  83 -27.923 -10.197  -4.003
    5    HG   LEU  83           HG       LEU  83 -29.949 -10.578  -1.819
    6   HD13  LEU  83          HD11      LEU  83 -30.679  -8.702  -2.853
    7   HD12  LEU  83          HD12      LEU  83 -31.170  -9.790  -4.150
    8   HD11  LEU  83          HD13      LEU  83 -29.621  -8.950  -4.241
    9   HD23  LEU  83          HD21      LEU  83 -30.129 -11.795  -4.560
   10   HD22  LEU  83          HD22      LEU  83 -31.096 -12.147  -3.129
   11   HD21  LEU  83          HD23      LEU  83 -29.417 -12.680  -3.211

  No H/Q in entry =          11
  In of MODEL   49
    1    H    TYR  84           H        TYR  84 -25.509 -10.154  -1.349
    2    HA   TYR  84           HA       TYR  84 -23.652  -9.671  -3.485
    3    HB2  TYR  84           HB2      TYR  84 -24.105  -8.171  -1.488
    4    HB3  TYR  84           HB3      TYR  84 -23.187  -9.325  -0.522
    5    HD1  TYR  84           HD1      TYR  84 -20.785  -9.903  -1.510
    6    HD2  TYR  84           HD2      TYR  84 -22.975  -6.336  -2.358
    7    HE1  TYR  84           HE1      TYR  84 -18.682  -8.783  -2.169
    8    HE2  TYR  84           HE2      TYR  84 -20.882  -5.207  -3.028
    9    HH   TYR  84           HH       TYR  84 -18.420  -5.474  -2.529

  No H/Q in entry =           9
  In of MODEL   49
    1    H    GLY  85           H        GLY  85 -23.430 -11.718  -0.567
    2    HA3  GLY  85           HA2      GLY  85 -20.872 -12.700  -1.081
    3    HA2  GLY  85           HA3      GLY  85 -22.112 -13.537  -0.146

  No H/Q in entry =           3
  In of MODEL   49
    1    H    LYS  86           H        LYS  86 -23.979 -13.849  -2.199
    2    HA   LYS  86           HA       LYS  86 -22.976 -16.225  -3.497
    3    HB2  LYS  86           HB2      LYS  86 -25.593 -14.725  -3.510
    4    HB3  LYS  86           HB3      LYS  86 -25.334 -16.239  -4.377
    5    HG2  LYS  86           HG2      LYS  86 -24.837 -17.296  -2.180
    6    HG3  LYS  86           HG3      LYS  86 -25.385 -15.800  -1.423
    7    HD2  LYS  86           HD2      LYS  86 -27.002 -17.374  -3.429
    8    HD3  LYS  86           HD3      LYS  86 -27.184 -17.527  -1.682
    9    HE2  LYS  86           HE2      LYS  86 -27.552 -14.989  -1.694
   10    HE3  LYS  86           HE3      LYS  86 -27.792 -15.169  -3.431
   11    HZ1  LYS  86           HZ1      LYS  86 -29.254 -16.799  -1.430
   12    HZ3  LYS  86           HZ2      LYS  86 -29.597 -16.625  -3.085
   13    HZ2  LYS  86           HZ3      LYS  86 -29.850 -15.324  -2.025

  No H/Q in entry =          13
  In of MODEL   49
    1    H    VAL  87           H        VAL  87 -22.913 -12.998  -4.348
    2    HA   VAL  87           HA       VAL  87 -22.605 -11.805  -6.275
    3    HB   VAL  87           HB       VAL  87 -21.585 -14.328  -7.618
    4   HG11  VAL  87          HG11      VAL  87 -21.785 -11.915  -8.658
    5   HG13  VAL  87          HG12      VAL  87 -20.328 -12.869  -8.937
    6   HG12  VAL  87          HG13      VAL  87 -20.332 -11.600  -7.712
    7   HG22  VAL  87          HG21      VAL  87 -19.466 -14.134  -6.575
    8   HG21  VAL  87          HG22      VAL  87 -20.668 -14.173  -5.286
    9   HG23  VAL  87          HG23      VAL  87 -19.930 -12.643  -5.757

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ASP  88           H        ASP  88 -25.130 -12.406  -5.915
    2    HA   ASP  88           HA       ASP  88 -26.288 -13.570  -8.320
    3    HB2  ASP  88           HB2      ASP  88 -27.273 -13.828  -5.993
    4    HB3  ASP  88           HB3      ASP  88 -27.696 -12.119  -6.067

  No H/Q in entry =           4
  In of MODEL   49
    1    H    GLY  89           H        GLY  89 -25.574 -12.303  -9.950
    2    HA3  GLY  89           HA2      GLY  89 -25.707  -9.525 -10.113
    3    HA2  GLY  89           HA3      GLY  89 -25.713 -10.628 -11.488

  No H/Q in entry =           3
  In of MODEL   49
    1    H    LEU  90           H        LEU  90 -28.179 -11.943 -11.040
    2    HA   LEU  90           HA       LEU  90 -29.963  -9.963 -12.115
    3    HB2  LEU  90           HB2      LEU  90 -30.074 -12.349 -12.726
    4    HB3  LEU  90           HB3      LEU  90 -30.575 -12.729 -11.079
    5    HG   LEU  90           HG       LEU  90 -32.677 -11.570 -11.412
    6   HD13  LEU  90          HD11      LEU  90 -32.477  -9.813 -12.865
    7   HD12  LEU  90          HD12      LEU  90 -33.046 -11.026 -14.014
    8   HD11  LEU  90          HD13      LEU  90 -31.325 -10.662 -13.897
    9   HD23  LEU  90          HD21      LEU  90 -32.652 -13.168 -13.869
   10   HD22  LEU  90          HD22      LEU  90 -33.624 -13.336 -12.406
   11   HD21  LEU  90          HD23      LEU  90 -31.981 -13.976 -12.451

  No H/Q in entry =          11
  In of MODEL   49
    1    H    GLY  91           H        GLY  91 -29.799 -11.508  -8.953
    2    HA3  GLY  91           HA2      GLY  91 -32.111 -10.370  -7.881
    3    HA2  GLY  91           HA3      GLY  91 -30.722 -10.939  -6.956

  No H/Q in entry =           3
  In of MODEL   49
    1    H    VAL  92           H        VAL  92 -28.778  -9.134  -7.802
    2    HA   VAL  92           HA       VAL  92 -29.519  -6.841  -6.217
    3    HB   VAL  92           HB       VAL  92 -26.993  -7.332  -7.838
    4   HG12  VAL  92          HG11      VAL  92 -27.108  -5.475  -5.486
    5   HG11  VAL  92          HG12      VAL  92 -27.775  -4.900  -7.016
    6   HG13  VAL  92          HG13      VAL  92 -26.086  -5.398  -6.922
    7   HG22  VAL  92          HG21      VAL  92 -26.785  -8.944  -6.268
    8   HG21  VAL  92          HG22      VAL  92 -27.909  -8.159  -5.156
    9   HG23  VAL  92          HG23      VAL  92 -26.246  -7.585  -5.282

  No H/Q in entry =           9
  In of MODEL   49
    1    H    LEU  93           H        LEU  93 -29.148  -7.463  -9.649
    2    HA   LEU  93           HA       LEU  93 -29.455  -4.811 -10.542
    3    HB2  LEU  93           HB2      LEU  93 -28.856  -6.657 -12.031
    4    HB3  LEU  93           HB3      LEU  93 -30.458  -7.360 -11.807
    5    HG   LEU  93           HG       LEU  93 -31.443  -5.366 -12.898
    6   HD11  LEU  93          HD11      LEU  93 -29.562  -3.809 -12.387
    7   HD13  LEU  93          HD12      LEU  93 -30.014  -3.809 -14.093
    8   HD12  LEU  93          HD13      LEU  93 -28.573  -4.675 -13.563
    9   HD23  LEU  93          HD21      LEU  93 -30.432  -5.921 -15.200
   10   HD22  LEU  93          HD22      LEU  93 -31.288  -7.175 -14.305
   11   HD21  LEU  93          HD23      LEU  93 -29.523  -7.149 -14.319

  No H/Q in entry =          11
  In of MODEL   49
    1    H    LYS  94           H        LYS  94 -31.867  -7.328  -9.708
    2    HA   LYS  94           HA       LYS  94 -34.190  -5.838 -10.296
    3    HB2  LYS  94           HB2      LYS  94 -33.700  -8.058  -8.317
    4    HB3  LYS  94           HB3      LYS  94 -35.287  -7.332  -8.564
    5    HG2  LYS  94           HG2      LYS  94 -35.231  -8.077 -10.908
    6    HG3  LYS  94           HG3      LYS  94 -33.680  -8.860 -10.602
    7    HD2  LYS  94           HD2      LYS  94 -34.810 -10.198  -8.786
    8    HD3  LYS  94           HD3      LYS  94 -36.346  -9.518  -9.321
    9    HE2  LYS  94           HE2      LYS  94 -35.863 -10.425 -11.603
   10    HE3  LYS  94           HE3      LYS  94 -34.457 -11.242 -10.921
   11    HZ3  LYS  94           HZ1      LYS  94 -36.333 -12.729 -11.096
   12    HZ2  LYS  94           HZ2      LYS  94 -37.282 -11.699 -10.134
   13    HZ1  LYS  94           HZ3      LYS  94 -35.931 -12.479  -9.466

  No H/Q in entry =          13
  In of MODEL   49
    1    H    ALA  95           H        ALA  95 -32.347  -6.030  -7.263
    2    HA   ALA  95           HA       ALA  95 -34.158  -4.438  -5.748
    3    HB2  ALA  95           HB1      ALA  95 -31.803  -5.861  -5.248
    4    HB3  ALA  95           HB2      ALA  95 -32.757  -4.955  -4.075
    5    HB1  ALA  95           HB3      ALA  95 -31.402  -4.179  -4.896

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ALA  96           H        ALA  96 -31.518  -3.602  -7.854
    2    HA   ALA  96           HA       ALA  96 -31.368  -0.853  -7.045
    3    HB2  ALA  96           HB1      ALA  96 -30.018  -0.622  -9.162
    4    HB3  ALA  96           HB2      ALA  96 -30.354  -2.320  -9.501
    5    HB1  ALA  96           HB3      ALA  96 -29.421  -1.875  -8.074

  No H/Q in entry =           5
  In of MODEL   49
    1    H    VAL  97           H        VAL  97 -32.950  -2.504  -9.742
    2    HA   VAL  97           HA       VAL  97 -33.988  -0.170 -10.960
    3    HB   VAL  97           HB       VAL  97 -34.850  -3.080 -11.034
    4   HG11  VAL  97          HG11      VAL  97 -36.609  -1.035 -11.480
    5   HG13  VAL  97          HG12      VAL  97 -36.703  -2.617 -12.256
    6   HG12  VAL  97          HG13      VAL  97 -35.932  -1.270 -13.091
    7   HG21  VAL  97          HG21      VAL  97 -33.553  -1.248 -13.055
    8   HG23  VAL  97          HG22      VAL  97 -34.038  -2.916 -13.363
    9   HG22  VAL  97          HG23      VAL  97 -32.774  -2.567 -12.182

  No H/Q in entry =           9
  In of MODEL   49
    1    H    ALA  98           H        ALA  98 -35.191  -2.361  -8.443
    2    HA   ALA  98           HA       ALA  98 -37.727  -1.170  -8.057
    3    HB1  ALA  98           HB1      ALA  98 -36.748  -3.401  -7.061
    4    HB3  ALA  98           HB2      ALA  98 -37.903  -2.469  -6.108
    5    HB2  ALA  98           HB3      ALA  98 -36.178  -2.356  -5.760

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ALA  99           H        ALA  99 -34.622  -0.452  -6.423
    2    HA   ALA  99           HA       ALA  99 -35.701   1.529  -4.726
    3    HB1  ALA  99           HB1      ALA  99 -33.076   0.600  -5.506
    4    HB2  ALA  99           HB2      ALA  99 -33.601   1.340  -3.993
    5    HB3  ALA  99           HB3      ALA  99 -33.115   2.357  -5.350

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ILE 100           H        ILE 100 -34.684   1.687  -8.087
    2    HA   ILE 100           HA       ILE 100 -34.808   4.541  -8.266
    3    HB   ILE 100           HB       ILE 100 -34.962   2.419 -10.434
    4   HG12  ILE 100          HG12      ILE 100 -32.754   4.359  -9.751
    5   HG13  ILE 100          HG13      ILE 100 -32.818   2.704  -9.144
    6   HG21  ILE 100          HG21      ILE 100 -35.329   5.348 -10.520
    7   HG23  ILE 100          HG22      ILE 100 -35.867   4.105 -11.650
    8   HG22  ILE 100          HG23      ILE 100 -34.204   4.689 -11.709
    9   HD12  ILE 100          HD11      ILE 100 -32.288   3.690 -11.908
   10   HD11  ILE 100          HD12      ILE 100 -32.979   2.085 -11.672
   11   HD13  ILE 100          HD13      ILE 100 -31.418   2.487 -10.958

  No H/Q in entry =          11
  In of MODEL   49
    1    H    LYS 101           H        LYS 101 -37.159   1.988  -9.010
    2    HA   LYS 101           HA       LYS 101 -39.214   3.692  -9.970
    3    HB2  LYS 101           HB2      LYS 101 -39.145   0.900  -8.882
    4    HB3  LYS 101           HB3      LYS 101 -40.684   1.697  -9.206
    5    HG2  LYS 101           HG2      LYS 101 -40.224   1.855 -11.504
    6    HG3  LYS 101           HG3      LYS 101 -38.535   1.413 -11.269
    7    HD2  LYS 101           HD2      LYS 101 -39.830  -0.458 -12.172
    8    HD3  LYS 101           HD3      LYS 101 -39.197  -0.823 -10.567
    9    HE2  LYS 101           HE2      LYS 101 -41.269  -1.484 -10.054
   10    HE3  LYS 101           HE3      LYS 101 -41.692   0.228 -10.029
   11    HZ3  LYS 101           HZ1      LYS 101 -42.602   0.120 -12.141
   12    HZ2  LYS 101           HZ2      LYS 101 -43.087  -1.354 -11.451
   13    HZ1  LYS 101           HZ3      LYS 101 -41.788  -1.317 -12.544

  No H/Q in entry =          13
  In of MODEL   49
    1    H    LYS 102           H        LYS 102 -38.728   2.159  -6.786
    2    HA   LYS 102           HA       LYS 102 -40.942   3.381  -5.555
    3    HB2  LYS 102           HB2      LYS 102 -39.735   1.476  -4.576
    4    HB3  LYS 102           HB3      LYS 102 -38.322   2.500  -4.328
    5    HG2  LYS 102           HG2      LYS 102 -39.600   3.898  -2.801
    6    HG3  LYS 102           HG3      LYS 102 -41.016   2.879  -3.051
    7    HD2  LYS 102           HD2      LYS 102 -39.820   0.974  -2.061
    8    HD3  LYS 102           HD3      LYS 102 -38.405   1.995  -1.809
    9    HE2  LYS 102           HE2      LYS 102 -39.718   3.479  -0.370
   10    HE3  LYS 102           HE3      LYS 102 -41.151   2.489  -0.642
   11    HZ1  LYS 102           HZ1      LYS 102 -39.460   0.687   0.323
   12    HZ3  LYS 102           HZ2      LYS 102 -40.545   1.580   1.274
   13    HZ2  LYS 102           HZ3      LYS 102 -38.925   2.074   1.143

  No H/Q in entry =          13
  In of MODEL   49
    1    H    ALA 103           H        ALA 103 -37.968   4.728  -6.570
    2    HA   ALA 103           HA       ALA 103 -38.131   7.021  -4.753
    3    HB2  ALA 103           HB1      ALA 103 -36.138   7.738  -6.333
    4    HB3  ALA 103           HB2      ALA 103 -36.139   6.026  -6.756
    5    HB1  ALA 103           HB3      ALA 103 -35.890   6.520  -5.082

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ALA 104           H        ALA 104 -38.791   6.351  -8.104
    2    HA   ALA 104           HA       ALA 104 -39.326   9.155  -8.681
    3    HB2  ALA 104           HB1      ALA 104 -39.397   8.521 -10.893
    4    HB1  ALA 104           HB2      ALA 104 -40.154   6.969 -10.532
    5    HB3  ALA 104           HB3      ALA 104 -38.424   7.193 -10.262

  No H/Q in entry =           5
  In of MODEL   49
    1    H    ALA 105           H        ALA 105 -40.963   7.057  -6.896
    2    HA   ALA 105           HA       ALA 105 -43.358   8.498  -6.831
    3    HB2  ALA 105           HB1      ALA 105 -44.135   7.684  -8.876
    4    HB3  ALA 105           HB2      ALA 105 -44.787   6.491  -7.753
    5    HB1  ALA 105           HB3      ALA 105 -43.331   6.127  -8.677

  No H/Q in entry =           5
  In of MODEL   50
    1    H1   ALA   1           H3       ALA   1 -12.337 -15.508  -2.392
    2    H2   ALA   1           H2       ALA   1 -11.406 -16.656  -3.235
    3    H3   ALA   1           H1       ALA   1 -12.541 -15.700  -4.066
    4    HA   ALA   1           HA       ALA   1 -13.954 -17.388  -3.831
    5    HB3  ALA   1           HB1      ALA   1 -12.574 -19.173  -3.373
    6    HB1  ALA   1           HB2      ALA   1 -13.330 -19.058  -1.784
    7    HB2  ALA   1           HB3      ALA   1 -11.748 -18.331  -2.062

  No H/Q in entry =           7
  In of MODEL   50
    1    H    GLU   2           H        GLU   2 -15.586 -18.232  -2.180
    2    HA   GLU   2           HA       GLU   2 -17.219 -16.500  -1.117
    3    HB2  GLU   2           HB2      GLU   2 -16.302 -18.937   0.422
    4    HB3  GLU   2           HB3      GLU   2 -17.818 -18.074   0.677
    5    HG2  GLU   2           HG2      GLU   2 -18.807 -19.147  -1.060
    6    HG3  GLU   2           HG3      GLU   2 -17.480 -18.756  -2.143

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLU   3           H        GLU   3 -15.320 -17.876   1.503
    2    HA   GLU   3           HA       GLU   3 -15.521 -15.525   3.066
    3    HB2  GLU   3           HB2      GLU   3 -13.958 -18.086   3.311
    4    HB3  GLU   3           HB3      GLU   3 -13.715 -16.772   4.461
    5    HG2  GLU   3           HG2      GLU   3 -15.910 -16.905   5.278
    6    HG3  GLU   3           HG3      GLU   3 -16.512 -17.696   3.827

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LEU   4           H        LEU   4 -12.579 -17.027   1.673
    2    HA   LEU   4           HA       LEU   4 -10.728 -15.141   2.277
    3    HB2  LEU   4           HB2      LEU   4 -10.969 -16.430  -0.452
    4    HB3  LEU   4           HB3      LEU   4  -9.510 -15.725   0.236
    5    HG   LEU   4           HG       LEU   4 -11.026 -18.111   1.342
    6   HD13  LEU   4          HD11      LEU   4  -9.406 -19.479   0.410
    7   HD12  LEU   4          HD12      LEU   4  -8.185 -18.207   0.387
    8   HD11  LEU   4          HD13      LEU   4  -9.473 -18.214  -0.816
    9   HD23  LEU   4          HD21      LEU   4  -8.777 -18.198   2.724
   10   HD22  LEU   4          HD22      LEU   4 -10.089 -17.148   3.255
   11   HD21  LEU   4          HD23      LEU   4  -8.719 -16.470   2.375

  No H/Q in entry =          11
  In of MODEL   50
    1    H    GLU   5           H        GLU   5 -13.059 -14.907  -0.398
    2    HA   GLU   5           HA       GLU   5 -12.033 -12.430  -1.392
    3    HB2  GLU   5           HB2      GLU   5 -13.398 -14.011  -2.749
    4    HB3  GLU   5           HB3      GLU   5 -14.795 -13.612  -1.749
    5    HG2  GLU   5           HG2      GLU   5 -14.917 -12.230  -3.715
    6    HG3  GLU   5           HG3      GLU   5 -14.438 -11.192  -2.372

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLU   6           H        GLU   6 -14.767 -13.289   0.696
    2    HA   GLU   6           HA       GLU   6 -15.647 -10.605   1.102
    3    HB2  GLU   6           HB2      GLU   6 -17.081 -12.600   1.495
    4    HB3  GLU   6           HB3      GLU   6 -16.064 -13.031   2.869
    5    HG2  GLU   6           HG2      GLU   6 -17.972 -11.822   3.723
    6    HG3  GLU   6           HG3      GLU   6 -16.568 -10.764   3.849

  No H/Q in entry =           6
  In of MODEL   50
    1    H    VAL   7           H        VAL   7 -13.360 -12.740   2.670
    2    HA   VAL   7           HA       VAL   7 -12.880 -11.175   5.001
    3    HB   VAL   7           HB       VAL   7 -11.195 -13.231   3.547
    4   HG11  VAL   7          HG11      VAL   7 -10.714 -11.709   6.115
    5   HG13  VAL   7          HG12      VAL   7  -9.615 -11.930   4.755
    6   HG12  VAL   7          HG13      VAL   7  -9.982 -13.286   5.821
    7   HG21  VAL   7          HG21      VAL   7 -13.451 -13.777   4.764
    8   HG23  VAL   7          HG22      VAL   7 -12.523 -13.516   6.241
    9   HG22  VAL   7          HG23      VAL   7 -12.041 -14.777   5.109

  No H/Q in entry =           9
  In of MODEL   50
    1    H    VAL   8           H        VAL   8 -11.368 -11.296   1.791
    2    HA   VAL   8           HA       VAL   8  -9.289  -9.443   2.290
    3    HB   VAL   8           HB       VAL   8 -10.757 -10.109  -0.273
    4   HG12  VAL   8          HG11      VAL   8  -8.680  -9.097  -1.336
    5   HG11  VAL   8          HG12      VAL   8  -8.284  -8.436   0.252
    6   HG13  VAL   8          HG13      VAL   8  -9.766  -7.939  -0.563
    7   HG21  VAL   8          HG21      VAL   8  -9.098 -11.724   1.214
    8   HG23  VAL   8          HG22      VAL   8  -7.929 -10.911   0.179
    9   HG22  VAL   8          HG23      VAL   8  -9.242 -11.834  -0.542

  No H/Q in entry =           9
  In of MODEL   50
    1    H    MET   9           H        MET   9 -12.630  -9.020   1.129
    2    HA   MET   9           HA       MET   9 -12.540  -6.243   0.701
    3    HB2  MET   9           HB2      MET   9 -14.773  -8.096   1.529
    4    HB3  MET   9           HB3      MET   9 -15.035  -6.366   1.306
    5    HG2  MET   9           HG2      MET   9 -14.193  -6.526  -1.003
    6    HG3  MET   9           HG3      MET   9 -13.908  -8.253  -0.783
    7    HE1  MET   9           HE1      MET   9 -16.261  -5.431  -0.355
    8    HE3  MET   9           HE2      MET   9 -17.861  -5.986  -0.836
    9    HE2  MET   9           HE3      MET   9 -16.636  -5.681  -2.065

  No H/Q in entry =           9
  In of MODEL   50
    1    H    GLY  10           H        GLY  10 -13.223  -8.135   3.623
    2    HA3  GLY  10           HA2      GLY  10 -13.752  -5.950   5.347
    3    HA2  GLY  10           HA3      GLY  10 -13.203  -7.545   5.858

  No H/Q in entry =           3
  In of MODEL   50
    1    H    LEU  11           H        LEU  11 -10.757  -7.688   4.544
    2    HA   LEU  11           HA       LEU  11  -9.045  -6.273   6.305
    3    HB2  LEU  11           HB2      LEU  11  -8.509  -7.696   3.695
    4    HB3  LEU  11           HB3      LEU  11  -7.234  -7.005   4.696
    5    HG   LEU  11           HG       LEU  11  -9.254  -9.022   5.706
    6   HD13  LEU  11          HD11      LEU  11  -8.042 -10.266   4.140
    7   HD12  LEU  11          HD12      LEU  11  -7.110 -10.516   5.615
    8   HD11  LEU  11          HD13      LEU  11  -6.559  -9.353   4.411
    9   HD22  LEU  11          HD21      LEU  11  -8.394  -8.021   7.626
   10   HD21  LEU  11          HD22      LEU  11  -6.852  -7.631   6.865
   11   HD23  LEU  11          HD23      LEU  11  -7.192  -9.286   7.370

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  12           H        ILE  12  -9.940  -5.710   2.916
    2    HA   ILE  12           HA       ILE  12  -8.229  -3.494   2.496
    3    HB   ILE  12           HB       ILE  12 -10.887  -4.140   1.197
    4   HG12  ILE  12          HG12      ILE  12  -8.863  -5.807   1.119
    5   HG13  ILE  12          HG13      ILE  12  -9.720  -5.439  -0.364
    6   HG21  ILE  12          HG21      ILE  12  -8.645  -2.269   0.369
    7   HG23  ILE  12          HG22      ILE  12 -10.301  -1.818   0.756
    8   HG22  ILE  12          HG23      ILE  12  -9.951  -2.761  -0.664
    9   HD12  ILE  12          HD11      ILE  12  -7.206  -5.409  -0.550
   10   HD11  ILE  12          HD12      ILE  12  -7.202  -4.027   0.544
   11   HD13  ILE  12          HD13      ILE  12  -7.973  -3.903  -1.019

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  13           H        ILE  13 -11.593  -3.736   3.586
    2    HA   ILE  13           HA       ILE  13 -12.030  -0.946   3.862
    3    HB   ILE  13           HB       ILE  13 -13.255  -3.358   5.221
    4   HG12  ILE  13          HG12      ILE  13 -13.473  -2.831   2.686
    5   HG13  ILE  13          HG13      ILE  13 -14.911  -3.254   3.590
    6   HG23  ILE  13          HG21      ILE  13 -13.884  -1.786   6.780
    7   HG22  ILE  13          HG22      ILE  13 -15.156  -1.498   5.600
    8   HG21  ILE  13          HG23      ILE  13 -13.747  -0.439   5.652
    9   HD12  ILE  13          HD11      ILE  13 -14.839  -1.095   2.003
   10   HD11  ILE  13          HD12      ILE  13 -14.185  -0.386   3.466
   11   HD13  ILE  13          HD13      ILE  13 -15.770  -1.123   3.504

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ASN  14           H        ASN  14 -10.941  -3.450   6.132
    2    HA   ASN  14           HA       ASN  14 -10.729  -1.819   8.421
    3    HB2  ASN  14           HB2      ASN  14 -10.496  -4.428   8.094
    4    HB3  ASN  14           HB3      ASN  14  -8.784  -4.053   7.939
    5   HD21  ASN  14          HD21      ASN  14  -9.434  -5.578  10.111
    6   HD22  ASN  14          HD22      ASN  14  -9.401  -4.661  11.537

  No H/Q in entry =           6
  In of MODEL   50
    1    H    SER  15           H        SER  15  -8.331  -2.655   5.930
    2    HA   SER  15           HA       SER  15  -6.178  -1.181   7.007
    3    HB2  SER  15           HB2      SER  15  -5.160  -1.392   4.845
    4    HB3  SER  15           HB3      SER  15  -6.115  -2.851   5.075
    5    HG   SER  15           HG       SER  15  -7.179  -2.295   3.369

  No H/Q in entry =           5
  In of MODEL   50
    1    H    GLY  16           H        GLY  16  -8.771  -0.290   4.760
    2    HA3  GLY  16           HA2      GLY  16  -7.894   2.346   4.215
    3    HA2  GLY  16           HA3      GLY  16  -9.548   1.763   4.050

  No H/Q in entry =           3
  In of MODEL   50
    1    H    GLN  17           H        GLN  17 -10.099   1.036   6.698
    2    HA   GLN  17           HA       GLN  17 -10.790   3.543   7.843
    3    HB2  GLN  17           HB2      GLN  17 -12.047   1.483   8.331
    4    HB3  GLN  17           HB3      GLN  17 -10.642   0.821   9.168
    5    HG2  GLN  17           HG2      GLN  17 -10.716   2.693  10.775
    6    HG3  GLN  17           HG3      GLN  17 -12.123   3.352   9.941
    7   HE21  GLN  17          HE21      GLN  17 -14.047   2.796  10.954
    8   HE22  GLN  17          HE22      GLN  17 -14.316   1.356  11.814

  No H/Q in entry =           8
  In of MODEL   50
    1    H    ALA  18           H        ALA  18  -8.177   1.243   8.460
    2    HA   ALA  18           HA       ALA  18  -7.074   2.447  10.734
    3    HB2  ALA  18           HB1      ALA  18  -6.477   0.230   9.363
    4    HB3  ALA  18           HB2      ALA  18  -5.310   1.003  10.436
    5    HB1  ALA  18           HB3      ALA  18  -5.229   1.285   8.696

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ARG  19           H        ARG  19  -6.296   2.973   7.288
    2    HA   ARG  19           HA       ARG  19  -4.385   5.007   7.723
    3    HB2  ARG  19           HB2      ARG  19  -4.717   3.873   5.524
    4    HB3  ARG  19           HB3      ARG  19  -6.255   4.724   5.348
    5    HG2  ARG  19           HG2      ARG  19  -5.113   6.888   5.422
    6    HG3  ARG  19           HG3      ARG  19  -3.569   6.093   5.726
    7    HD2  ARG  19           HD2      ARG  19  -3.688   6.689   3.384
    8    HD3  ARG  19           HD3      ARG  19  -3.784   4.929   3.526
    9    HE   ARG  19           HE       ARG  19  -6.412   5.854   3.517
   10   HH21  ARG  19          HH11      ARG  19  -7.604   6.021   1.598
   11   HH22  ARG  19          HH12      ARG  19  -6.780   6.097   0.080
   12   HH11  ARG  19          HH21      ARG  19  -3.634   5.905   1.486
   13   HH12  ARG  19          HH22      ARG  19  -4.531   6.029   0.016

  No H/Q in entry =          13
  In of MODEL   50
    1    H    SER  20           H        SER  20  -7.882   5.144   7.119
    2    HA   SER  20           HA       SER  20  -8.224   7.902   7.076
    3    HB2  SER  20           HB2      SER  20 -10.108   6.574   6.535
    4    HB3  SER  20           HB3      SER  20 -10.006   5.676   8.047
    5    HG   SER  20           HG       SER  20 -10.712   8.396   7.662

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LEU  21           H        LEU  21  -8.239   5.714   9.876
    2    HA   LEU  21           HA       LEU  21  -8.671   7.708  11.844
    3    HB2  LEU  21           HB2      LEU  21  -7.332   4.999  12.001
    4    HB3  LEU  21           HB3      LEU  21  -7.639   6.015  13.407
    5    HG   LEU  21           HG       LEU  21  -9.808   5.128  11.480
    6   HD12  LEU  21          HD11      LEU  21 -10.424   3.542  13.352
    7   HD11  LEU  21          HD12      LEU  21  -8.868   3.915  14.091
    8   HD13  LEU  21          HD13      LEU  21  -8.928   3.136  12.508
    9   HD22  LEU  21          HD21      LEU  21 -10.697   6.961  12.636
   10   HD21  LEU  21          HD22      LEU  21  -9.759   6.644  14.092
   11   HD23  LEU  21          HD23      LEU  21 -11.153   5.645  13.715

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ALA  22           H        ALA  22  -5.724   6.322  10.437
    2    HA   ALA  22           HA       ALA  22  -3.840   7.623  12.064
    3    HB2  ALA  22           HB1      ALA  22  -3.431   5.770  10.370
    4    HB1  ALA  22           HB2      ALA  22  -2.228   7.060  10.409
    5    HB3  ALA  22           HB3      ALA  22  -3.445   7.025   9.131

  No H/Q in entry =           5
  In of MODEL   50
    1    H    TYR  23           H        TYR  23  -5.147   8.652   8.882
    2    HA   TYR  23           HA       TYR  23  -3.799  11.142   8.818
    3    HB2  TYR  23           HB2      TYR  23  -4.883  10.238   6.824
    4    HB3  TYR  23           HB3      TYR  23  -6.461  10.354   7.603
    5    HD1  TYR  23           HD1      TYR  23  -3.539  12.384   6.472
    6    HD2  TYR  23           HD2      TYR  23  -7.692  12.368   7.571
    7    HE1  TYR  23           HE1      TYR  23  -3.748  14.737   5.715
    8    HE2  TYR  23           HE2      TYR  23  -7.901  14.721   6.812
    9    HH   TYR  23           HH       TYR  23  -5.238  16.367   5.181

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ALA  24           H        ALA  24  -6.925  10.177  10.192
    2    HA   ALA  24           HA       ALA  24  -7.750  12.770  10.967
    3    HB1  ALA  24           HB1      ALA  24  -9.575  11.527  11.429
    4    HB2  ALA  24           HB2      ALA  24  -8.754  10.948  12.877
    5    HB3  ALA  24           HB3      ALA  24  -8.631  10.039  11.372

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ALA  25           H        ALA  25  -5.762  10.299  12.539
    2    HA   ALA  25           HA       ALA  25  -5.421  11.544  15.044
    3    HB2  ALA  25           HB1      ALA  25  -4.665   9.190  14.219
    4    HB3  ALA  25           HB2      ALA  25  -3.647  10.041  15.383
    5    HB1  ALA  25           HB3      ALA  25  -3.209  10.025  13.674

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LEU  26           H        LEU  26  -3.625  11.840  12.006
    2    HA   LEU  26           HA       LEU  26  -1.658  13.649  12.929
    3    HB2  LEU  26           HB2      LEU  26  -1.360  12.499  10.823
    4    HB3  LEU  26           HB3      LEU  26  -2.829  13.216  10.168
    5    HG   LEU  26           HG       LEU  26  -1.803  15.461  10.309
    6   HD12  LEU  26          HD11      LEU  26   0.735  15.467  10.727
    7   HD11  LEU  26          HD12      LEU  26   0.503  13.886  11.468
    8   HD13  LEU  26          HD13      LEU  26  -0.299  15.304  12.146
    9   HD21  LEU  26          HD21      LEU  26  -0.068  13.400   8.913
   10   HD23  LEU  26          HD22      LEU  26  -0.102  15.123   8.545
   11   HD22  LEU  26          HD23      LEU  26  -1.530  14.133   8.253

  No H/Q in entry =          11
  In of MODEL   50
    1    H    LYS  27           H        LYS  27  -4.836  14.151  11.448
    2    HA   LYS  27           HA       LYS  27  -4.766  16.939  11.255
    3    HB2  LYS  27           HB2      LYS  27  -6.516  15.473  10.265
    4    HB3  LYS  27           HB3      LYS  27  -7.177  15.217  11.879
    5    HG2  LYS  27           HG2      LYS  27  -7.594  17.625  12.119
    6    HG3  LYS  27           HG3      LYS  27  -6.882  17.921  10.530
    7    HD2  LYS  27           HD2      LYS  27  -8.620  16.498   9.489
    8    HD3  LYS  27           HD3      LYS  27  -9.338  16.219  11.077
    9    HE2  LYS  27           HE2      LYS  27  -9.768  18.632  11.324
   10    HE3  LYS  27           HE3      LYS  27  -9.022  18.933   9.751
   11    HZ3  LYS  27           HZ1      LYS  27 -11.400  18.821   9.506
   12    HZ2  LYS  27           HZ2      LYS  27 -11.457  17.304  10.272
   13    HZ1  LYS  27           HZ3      LYS  27 -10.709  17.466   8.752

  No H/Q in entry =          13
  In of MODEL   50
    1    H    GLN  28           H        GLN  28  -5.670  14.853  13.977
    2    HA   GLN  28           HA       GLN  28  -6.556  16.858  15.756
    3    HB2  GLN  28           HB2      GLN  28  -5.187  14.207  16.274
    4    HB3  GLN  28           HB3      GLN  28  -5.877  15.219  17.544
    5    HG2  GLN  28           HG2      GLN  28  -7.424  14.168  15.159
    6    HG3  GLN  28           HG3      GLN  28  -7.446  13.436  16.762
    7   HE21  GLN  28          HE21      GLN  28  -7.644  15.604  18.468
    8   HE22  GLN  28          HE22      GLN  28  -9.056  16.486  18.143

  No H/Q in entry =           8
  In of MODEL   50
    1    H    ALA  29           H        ALA  29  -3.344  15.543  15.068
    2    HA   ALA  29           HA       ALA  29  -1.900  16.928  17.051
    3    HB1  ALA  29           HB1      ALA  29   0.028  16.227  15.933
    4    HB3  ALA  29           HB2      ALA  29  -0.724  16.359  14.344
    5    HB2  ALA  29           HB3      ALA  29  -1.156  15.027  15.415

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LYS  30           H        LYS  30  -2.747  17.820  13.723
    2    HA   LYS  30           HA       LYS  30  -1.319  20.250  13.629
    3    HB2  LYS  30           HB2      LYS  30  -3.855  19.398  12.215
    4    HB3  LYS  30           HB3      LYS  30  -3.008  20.907  11.876
    5    HG2  LYS  30           HG2      LYS  30  -0.948  19.598  11.362
    6    HG3  LYS  30           HG3      LYS  30  -1.867  18.109  11.602
    7    HD2  LYS  30           HD2      LYS  30  -3.424  18.766   9.807
    8    HD3  LYS  30           HD3      LYS  30  -2.528  20.268   9.569
    9    HE2  LYS  30           HE2      LYS  30  -0.506  18.959   8.988
   10    HE3  LYS  30           HE3      LYS  30  -1.421  17.463   9.196
   11    HZ2  LYS  30           HZ1      LYS  30  -1.234  18.338   6.856
   12    HZ1  LYS  30           HZ2      LYS  30  -2.268  19.608   7.326
   13    HZ3  LYS  30           HZ3      LYS  30  -2.806  17.996   7.394

  No H/Q in entry =          13
  In of MODEL   50
    1    H    GLN  31           H        GLN  31  -4.428  19.421  15.036
    2    HA   GLN  31           HA       GLN  31  -5.167  22.184  15.493
    3    HB2  GLN  31           HB2      GLN  31  -6.370  19.746  16.809
    4    HB3  GLN  31           HB3      GLN  31  -7.115  21.325  16.566
    5    HG2  GLN  31           HG2      GLN  31  -6.409  20.547  13.976
    6    HG3  GLN  31           HG3      GLN  31  -6.948  19.046  14.719
    7   HE21  GLN  31          HE21      GLN  31  -8.342  20.637  12.619
    8   HE22  GLN  31          HE22      GLN  31  -9.852  21.041  13.277

  No H/Q in entry =           8
  In of MODEL   50
    1    H    GLY  32           H        GLY  32  -2.874  20.232  16.811
    2    HA3  GLY  32           HA2      GLY  32  -1.471  20.676  18.616
    3    HA2  GLY  32           HA3      GLY  32  -2.588  21.929  19.141

  No H/Q in entry =           3
  In of MODEL   50
    1    H    ASP  33           H        ASP  33  -4.039  18.905  18.471
    2    HA   ASP  33           HA       ASP  33  -4.457  18.444  21.349
    3    HB2  ASP  33           HB2      ASP  33  -5.871  17.452  18.868
    4    HB3  ASP  33           HB3      ASP  33  -6.224  16.842  20.483

  No H/Q in entry =           4
  In of MODEL   50
    1    H    PHE  34           H        PHE  34  -2.297  17.572  21.654
    2    HA   PHE  34           HA       PHE  34  -1.318  15.316  20.249
    3    HB2  PHE  34           HB2      PHE  34  -0.693  16.288  23.046
    4    HB3  PHE  34           HB3      PHE  34   0.224  15.058  22.177
    5    HD1  PHE  34           HD1      PHE  34   0.085  18.483  22.920
    6    HD2  PHE  34           HD2      PHE  34   0.891  15.780  19.679
    7    HE1  PHE  34           HE1      PHE  34   1.398  20.244  21.772
    8    HE2  PHE  34           HE2      PHE  34   2.200  17.544  18.536
    9    HZ   PHE  34           HZ       PHE  34   2.455  19.774  19.586

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ALA  35           H        ALA  35  -3.357  15.606  23.111
    2    HA   ALA  35           HA       ALA  35  -3.172  12.940  24.001
    3    HB3  ALA  35           HB1      ALA  35  -5.624  13.588  24.858
    4    HB1  ALA  35           HB2      ALA  35  -5.075  15.202  24.407
    5    HB2  ALA  35           HB3      ALA  35  -4.171  14.266  25.596

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ALA  36           H        ALA  36  -5.605  14.486  21.903
    2    HA   ALA  36           HA       ALA  36  -7.044  12.090  21.418
    3    HB1  ALA  36           HB1      ALA  36  -8.485  13.529  20.465
    4    HB3  ALA  36           HB2      ALA  36  -7.307  13.941  19.218
    5    HB2  ALA  36           HB3      ALA  36  -7.324  14.825  20.744

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ALA  37           H        ALA  37  -4.347  13.655  19.755
    2    HA   ALA  37           HA       ALA  37  -4.326  12.025  17.454
    3    HB3  ALA  37           HB1      ALA  37  -2.318  13.713  18.883
    4    HB2  ALA  37           HB2      ALA  37  -2.846  13.779  17.203
    5    HB1  ALA  37           HB3      ALA  37  -1.705  12.536  17.721

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LYS  38           H        LYS  38  -2.575  11.694  20.533
    2    HA   LYS  38           HA       LYS  38  -1.272   9.282  20.038
    3    HB2  LYS  38           HB2      LYS  38  -1.580  11.042  22.188
    4    HB3  LYS  38           HB3      LYS  38  -2.214   9.517  22.800
    5    HG2  LYS  38           HG2      LYS  38  -0.131   8.377  22.262
    6    HG3  LYS  38           HG3      LYS  38   0.493   9.819  21.453
    7    HD2  LYS  38           HD2      LYS  38   0.672  11.030  23.491
    8    HD3  LYS  38           HD3      LYS  38  -0.359   9.888  24.355
    9    HE2  LYS  38           HE2      LYS  38   1.993   9.547  24.975
   10    HE3  LYS  38           HE3      LYS  38   1.375   8.139  24.106
   11    HZ3  LYS  38           HZ1      LYS  38   2.681   8.550  22.327
   12    HZ2  LYS  38           HZ2      LYS  38   3.643   9.366  23.467
   13    HZ1  LYS  38           HZ3      LYS  38   2.573  10.239  22.477

  No H/Q in entry =          13
  In of MODEL   50
    1    H    ALA  39           H        ALA  39  -4.507   9.805  21.440
    2    HA   ALA  39           HA       ALA  39  -5.094   7.090  21.937
    3    HB3  ALA  39           HB1      ALA  39  -7.233   9.058  21.173
    4    HB2  ALA  39           HB2      ALA  39  -6.334   9.272  22.675
    5    HB1  ALA  39           HB3      ALA  39  -7.265   7.798  22.407

  No H/Q in entry =           5
  In of MODEL   50
    1    H    MET  40           H        MET  40  -5.658   9.117  19.095
    2    HA   MET  40           HA       MET  40  -7.151   7.203  17.628
    3    HB2  MET  40           HB2      MET  40  -5.517   9.585  16.731
    4    HB3  MET  40           HB3      MET  40  -6.552   8.639  15.658
    5    HG2  MET  40           HG2      MET  40  -7.576   9.891  18.218
    6    HG3  MET  40           HG3      MET  40  -7.624  10.730  16.670
    7    HE3  MET  40           HE1      MET  40 -10.222   9.141  14.600
    8    HE2  MET  40           HE2      MET  40  -8.468   9.242  14.453
    9    HE1  MET  40           HE3      MET  40  -9.373  10.614  15.090

  No H/Q in entry =           9
  In of MODEL   50
    1    H    MET  41           H        MET  41  -3.653   7.906  17.756
    2    HA   MET  41           HA       MET  41  -2.910   6.151  15.651
    3    HB2  MET  41           HB2      MET  41  -1.289   6.795  18.127
    4    HB3  MET  41           HB3      MET  41  -0.677   6.145  16.610
    5    HG2  MET  41           HG2      MET  41  -1.812   8.342  15.611
    6    HG3  MET  41           HG3      MET  41  -1.571   8.923  17.258
    7    HE2  MET  41           HE1      MET  41   1.327   6.796  17.616
    8    HE1  MET  41           HE2      MET  41   0.549   8.095  18.517
    9    HE3  MET  41           HE3      MET  41   2.176   8.325  17.876

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ASP  42           H        ASP  42  -3.302   5.671  19.136
    2    HA   ASP  42           HA       ASP  42  -2.290   3.068  19.290
    3    HB2  ASP  42           HB2      ASP  42  -3.150   4.830  21.116
    4    HB3  ASP  42           HB3      ASP  42  -4.586   3.818  21.040

  No H/Q in entry =           4
  In of MODEL   50
    1    H    GLN  43           H        GLN  43  -5.613   4.203  18.789
    2    HA   GLN  43           HA       GLN  43  -6.780   1.627  18.586
    3    HB2  GLN  43           HB2      GLN  43  -7.678   4.291  17.464
    4    HB3  GLN  43           HB3      GLN  43  -8.654   2.820  17.437
    5    HG2  GLN  43           HG2      GLN  43  -8.364   2.690  19.944
    6    HG3  GLN  43           HG3      GLN  43  -7.625   4.288  19.878
    7   HE21  GLN  43          HE21      GLN  43  -9.805   4.384  21.376
    8   HE22  GLN  43          HE22      GLN  43 -11.160   4.974  20.545

  No H/Q in entry =           8
  In of MODEL   50
    1    H    SER  44           H        SER  44  -5.417   3.835  16.182
    2    HA   SER  44           HA       SER  44  -6.130   2.364  13.888
    3    HB2  SER  44           HB2      SER  44  -4.852   4.735  14.339
    4    HB3  SER  44           HB3      SER  44  -3.507   3.728  13.808
    5    HG   SER  44           HG       SER  44  -4.608   4.715  12.046

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ARG  45           H        ARG  45  -3.255   2.219  15.971
    2    HA   ARG  45           HA       ARG  45  -1.792   0.255  14.585
    3    HB2  ARG  45           HB2      ARG  45  -0.939   1.664  16.458
    4    HB3  ARG  45           HB3      ARG  45  -1.940   0.739  17.575
    5    HG2  ARG  45           HG2      ARG  45  -0.726  -1.329  16.928
    6    HG3  ARG  45           HG3      ARG  45   0.299  -0.380  15.853
    7    HD2  ARG  45           HD2      ARG  45   1.044   0.988  17.814
    8    HD3  ARG  45           HD3      ARG  45   0.111  -0.081  18.883
    9    HE   ARG  45           HE       ARG  45   1.797  -1.688  17.300
   10   HH21  ARG  45          HH11      ARG  45   3.689  -2.530  18.137
   11   HH22  ARG  45          HH12      ARG  45   4.468  -1.755  19.471
   12   HH11  ARG  45          HH21      ARG  45   2.120   0.769  19.697
   13   HH12  ARG  45          HH22      ARG  45   3.579   0.116  20.352

  No H/Q in entry =          13
  In of MODEL   50
    1    H    MET  46           H        MET  46  -4.195  -0.050  17.181
    2    HA   MET  46           HA       MET  46  -4.053  -2.852  17.480
    3    HB2  MET  46           HB2      MET  46  -6.213  -0.833  18.079
    4    HB3  MET  46           HB3      MET  46  -6.420  -2.552  18.427
    5    HG2  MET  46           HG2      MET  46  -4.389  -2.526  19.816
    6    HG3  MET  46           HG3      MET  46  -4.151  -0.823  19.458
    7    HE1  MET  46           HE1      MET  46  -4.016  -0.032  21.714
    8    HE3  MET  46           HE2      MET  46  -4.214  -1.591  22.507
    9    HE2  MET  46           HE3      MET  46  -5.191  -0.220  23.022

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ALA  47           H        ALA  47  -6.052  -0.810  15.389
    2    HA   ALA  47           HA       ALA  47  -7.688  -2.843  14.316
    3    HB3  ALA  47           HB1      ALA  47  -8.346  -0.598  13.905
    4    HB1  ALA  47           HB2      ALA  47  -7.861  -1.231  12.332
    5    HB2  ALA  47           HB3      ALA  47  -6.771  -0.176  13.234

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LEU  48           H        LEU  48  -4.555  -1.561  13.272
    2    HA   LEU  48           HA       LEU  48  -4.287  -3.147  10.927
    3    HB2  LEU  48           HB2      LEU  48  -2.219  -1.895  12.741
    4    HB3  LEU  48           HB3      LEU  48  -1.856  -2.615  11.173
    5    HG   LEU  48           HG       LEU  48  -3.857  -0.378  11.566
    6   HD13  LEU  48          HD11      LEU  48  -1.727   0.475  12.237
    7   HD12  LEU  48          HD12      LEU  48  -1.994   1.036  10.587
    8   HD11  LEU  48          HD13      LEU  48  -0.911  -0.323  10.892
    9   HD22  LEU  48          HD21      LEU  48  -4.336  -1.351   9.487
   10   HD21  LEU  48          HD22      LEU  48  -2.657  -1.803   9.192
   11   HD23  LEU  48          HD23      LEU  48  -3.158  -0.118   9.038

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ASN  49           H        ASN  49  -3.250  -3.565  14.273
    2    HA   ASN  49           HA       ASN  49  -1.671  -5.844  13.938
    3    HB2  ASN  49           HB2      ASN  49  -1.701  -4.500  15.989
    4    HB3  ASN  49           HB3      ASN  49  -3.354  -5.003  16.315
    5   HD21  ASN  49          HD21      ASN  49  -2.725  -6.027  18.330
    6   HD22  ASN  49          HD22      ASN  49  -1.855  -7.484  18.344

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLU  50           H        GLU  50  -5.137  -5.533  14.605
    2    HA   GLU  50           HA       GLU  50  -5.680  -8.327  14.705
    3    HB2  GLU  50           HB2      GLU  50  -7.249  -6.625  15.584
    4    HB3  GLU  50           HB3      GLU  50  -7.534  -6.053  13.939
    5    HG2  GLU  50           HG2      GLU  50  -8.422  -8.237  13.293
    6    HG3  GLU  50           HG3      GLU  50  -8.050  -8.890  14.885

  No H/Q in entry =           6
  In of MODEL   50
    1    H    ALA  51           H        ALA  51  -5.718  -5.920  12.116
    2    HA   ALA  51           HA       ALA  51  -6.720  -7.631  10.087
    3    HB2  ALA  51           HB1      ALA  51  -6.477  -5.817   8.724
    4    HB1  ALA  51           HB2      ALA  51  -4.835  -5.488   9.276
    5    HB3  ALA  51           HB3      ALA  51  -6.214  -4.964  10.244

  No H/Q in entry =           5
  In of MODEL   50
    1    H    HIS  52           H        HIS  52  -3.420  -6.765  11.079
    2    HA   HIS  52           HA       HIS  52  -2.036  -8.265   9.127
    3    HB2  HIS  52           HB2      HIS  52  -0.980  -6.549  10.568
    4    HB3  HIS  52           HB3      HIS  52  -1.171  -7.619  11.956
    5    HD1  HIS  52           HD1      HIS  52   0.243  -9.846  11.950
    6    HD2  HIS  52           HD2      HIS  52   1.154  -7.210   8.851
    7    HE1  HIS  52           HE1      HIS  52   2.440 -10.631  10.964
    8    HE2  HIS  52           HE2      HIS  52   3.009  -9.033   9.073

  No H/Q in entry =           8
  In of MODEL   50
    1    H    LEU  53           H        LEU  53  -3.263  -9.137  12.334
    2    HA   LEU  53           HA       LEU  53  -2.097 -11.697  12.522
    3    HB2  LEU  53           HB2      LEU  53  -4.569 -10.489  13.737
    4    HB3  LEU  53           HB3      LEU  53  -4.131 -12.170  14.024
    5    HG   LEU  53           HG       LEU  53  -2.192  -9.887  14.503
    6   HD11  LEU  53          HD11      LEU  53  -4.196 -11.164  16.380
    7   HD13  LEU  53          HD12      LEU  53  -4.057  -9.458  15.959
    8   HD12  LEU  53          HD13      LEU  53  -2.814 -10.229  16.937
    9   HD23  LEU  53          HD21      LEU  53  -1.338 -11.689  16.189
   10   HD22  LEU  53          HD22      LEU  53  -0.975 -11.911  14.481
   11   HD21  LEU  53          HD23      LEU  53  -2.272 -12.828  15.225

  No H/Q in entry =          11
  In of MODEL   50
    1    H    VAL  54           H        VAL  54  -5.193 -10.624  11.158
    2    HA   VAL  54           HA       VAL  54  -6.138 -13.205  10.462
    3    HB   VAL  54           HB       VAL  54  -6.749 -10.460   9.335
    4   HG12  VAL  54          HG11      VAL  54  -8.867 -11.809   8.515
    5   HG11  VAL  54          HG12      VAL  54  -7.772 -13.189   8.585
    6   HG13  VAL  54          HG13      VAL  54  -7.394 -11.816   7.548
    7   HG22  VAL  54          HG21      VAL  54  -7.659 -10.494  11.485
    8   HG21  VAL  54          HG22      VAL  54  -7.935 -12.233  11.460
    9   HG23  VAL  54          HG23      VAL  54  -9.002 -11.160  10.555

  No H/Q in entry =           9
  In of MODEL   50
    1    H    GLN  55           H        GLN  55  -4.233 -10.772   8.683
    2    HA   GLN  55           HA       GLN  55  -4.117 -12.230   6.261
    3    HB2  GLN  55           HB2      GLN  55  -3.484  -9.973   6.079
    4    HB3  GLN  55           HB3      GLN  55  -2.377 -10.068   7.446
    5    HG2  GLN  55           HG2      GLN  55  -0.668 -10.932   6.170
    6    HG3  GLN  55           HG3      GLN  55  -1.753 -11.890   5.171
    7   HE21  GLN  55          HE21      GLN  55  -1.758 -11.193   3.052
    8   HE22  GLN  55          HE22      GLN  55  -1.538  -9.590   2.547

  No H/Q in entry =           8
  In of MODEL   50
    1    H    THR  56           H        THR  56  -2.016 -12.246   9.145
    2    HA   THR  56           HA       THR  56   0.043 -13.868   8.226
    3    HB   THR  56           HB       THR  56  -1.209 -14.105  10.971
    4    HG1  THR  56           HG1      THR  56   0.389 -12.132   9.778
    5   HG23  THR  56          HG21      THR  56   0.462 -15.745  10.778
    6   HG22  THR  56          HG22      THR  56   1.324 -14.380  11.489
    7   HG21  THR  56          HG23      THR  56   1.478 -14.720   9.765

  No H/Q in entry =           7
  In of MODEL   50
    1    H    LYS  57           H        LYS  57  -3.093 -14.868   9.581
    2    HA   LYS  57           HA       LYS  57  -2.684 -17.668   9.327
    3    HB2  LYS  57           HB2      LYS  57  -4.485 -16.609  10.685
    4    HB3  LYS  57           HB3      LYS  57  -5.255 -16.058   9.204
    5    HG2  LYS  57           HG2      LYS  57  -6.393 -18.056   9.900
    6    HG3  LYS  57           HG3      LYS  57  -5.427 -18.468   8.485
    7    HD2  LYS  57           HD2      LYS  57  -3.770 -19.565   9.807
    8    HD3  LYS  57           HD3      LYS  57  -4.403 -18.882  11.304
    9    HE2  LYS  57           HE2      LYS  57  -6.449 -20.210  11.088
   10    HE3  LYS  57           HE3      LYS  57  -5.923 -20.838   9.528
   11    HZ1  LYS  57           HZ1      LYS  57  -3.884 -21.269  11.398
   12    HZ3  LYS  57           HZ2      LYS  57  -4.820 -22.420  10.567
   13    HZ2  LYS  57           HZ3      LYS  57  -5.340 -21.824  12.072

  No H/Q in entry =          13
  In of MODEL   50
    1    H    LEU  58           H        LEU  58  -3.979 -15.202   7.157
    2    HA   LEU  58           HA       LEU  58  -4.802 -17.010   5.144
    3    HB2  LEU  58           HB2      LEU  58  -4.156 -14.069   5.018
    4    HB3  LEU  58           HB3      LEU  58  -4.830 -14.993   3.674
    5    HG   LEU  58           HG       LEU  58  -6.112 -14.804   6.421
    6   HD11  LEU  58          HD11      LEU  58  -6.385 -13.146   3.934
    7   HD13  LEU  58          HD12      LEU  58  -6.371 -12.644   5.624
    8   HD12  LEU  58          HD13      LEU  58  -7.804 -13.416   4.947
    9   HD22  LEU  58          HD21      LEU  58  -7.098 -16.698   5.544
   10   HD21  LEU  58          HD22      LEU  58  -6.750 -16.245   3.875
   11   HD23  LEU  58          HD23      LEU  58  -8.105 -15.504   4.726

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  59           H        ILE  59  -1.652 -15.844   6.014
    2    HA   ILE  59           HA       ILE  59  -0.560 -16.578   3.377
    3    HB   ILE  59           HB       ILE  59   0.234 -14.529   4.955
    4   HG12  ILE  59          HG12      ILE  59   2.292 -16.209   3.507
    5   HG13  ILE  59          HG13      ILE  59   1.122 -15.224   2.668
    6   HG23  ILE  59          HG21      ILE  59   2.074 -15.043   6.343
    7   HG22  ILE  59          HG22      ILE  59   2.291 -16.630   5.638
    8   HG21  ILE  59          HG23      ILE  59   0.935 -16.315   6.720
    9   HD12  ILE  59          HD11      ILE  59   3.153 -14.244   4.670
   10   HD11  ILE  59          HD12      ILE  59   1.919 -13.229   3.928
   11   HD13  ILE  59          HD13      ILE  59   3.183 -13.951   2.932

  No H/Q in entry =          11
  In of MODEL   50
    1    H    GLU  60           H        GLU  60  -0.592 -17.694   6.741
    2    HA   GLU  60           HA       GLU  60   1.413 -19.699   6.474
    3    HB2  GLU  60           HB2      GLU  60   0.927 -19.246   8.693
    4    HB3  GLU  60           HB3      GLU  60  -0.807 -19.146   8.403
    5    HG2  GLU  60           HG2      GLU  60  -0.042 -21.212   9.675
    6    HG3  GLU  60           HG3      GLU  60  -0.999 -21.536   8.230

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLY  61           H        GLY  61  -2.098 -19.747   5.981
    2    HA3  GLY  61           HA2      GLY  61  -1.886 -22.540   5.015
    3    HA2  GLY  61           HA3      GLY  61  -3.363 -21.786   5.608

  No H/Q in entry =           3
  In of MODEL   50
    1    H    ASP  62           H        ASP  62  -1.109 -20.228   3.415
    2    HA   ASP  62           HA       ASP  62  -3.201 -19.703   1.517
    3    HB2  ASP  62           HB2      ASP  62  -1.346 -18.586   0.258
    4    HB3  ASP  62           HB3      ASP  62  -1.526 -18.017   1.915

  No H/Q in entry =           4
  In of MODEL   50
    1    H    ALA  63           H        ALA  63  -1.432 -22.471   2.000
    2    HA   ALA  63           HA       ALA  63  -0.507 -23.247  -0.537
    3    HB3  ALA  63           HB1      ALA  63  -0.805 -25.555   0.252
    4    HB1  ALA  63           HB2      ALA  63  -1.740 -24.957   1.621
    5    HB2  ALA  63           HB3      ALA  63  -0.031 -24.541   1.471

  No H/Q in entry =           5
  In of MODEL   50
    1    H    GLY  64           H        GLY  64  -3.703 -23.624   0.970
    2    HA3  GLY  64           HA2      GLY  64  -5.775 -24.100   0.111
    3    HA2  GLY  64           HA3      GLY  64  -5.240 -23.233  -1.319

  No H/Q in entry =           3
  In of MODEL   50
    1    H    GLU  65           H        GLU  65  -5.630 -24.425  -3.097
    2    HA   GLU  65           HA       GLU  65  -6.179 -27.144  -3.128
    3    HB2  GLU  65           HB2      GLU  65  -5.162 -25.358  -5.334
    4    HB3  GLU  65           HB3      GLU  65  -5.724 -27.011  -5.591
    5    HG2  GLU  65           HG2      GLU  65  -7.917 -26.445  -4.676
    6    HG3  GLU  65           HG3      GLU  65  -7.369 -24.812  -4.308

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLY  66           H        GLY  66  -4.933 -28.597  -4.754
    2    HA3  GLY  66           HA2      GLY  66  -2.611 -29.545  -3.470
    3    HA2  GLY  66           HA3      GLY  66  -3.245 -30.102  -5.005

  No H/Q in entry =           3
  In of MODEL   50
    1    H    LYS  67           H        LYS  67  -3.041 -27.539  -6.304
    2    HA   LYS  67           HA       LYS  67  -0.417 -27.778  -7.327
    3    HB2  LYS  67           HB2      LYS  67  -2.590 -25.740  -7.779
    4    HB3  LYS  67           HB3      LYS  67  -1.074 -25.776  -8.688
    5    HG2  LYS  67           HG2      LYS  67  -1.521 -28.069  -9.412
    6    HG3  LYS  67           HG3      LYS  67  -2.992 -28.114  -8.441
    7    HD2  LYS  67           HD2      LYS  67  -3.703 -27.663 -10.673
    8    HD3  LYS  67           HD3      LYS  67  -3.789 -26.115  -9.828
    9    HE2  LYS  67           HE2      LYS  67  -1.248 -26.880 -11.232
   10    HE3  LYS  67           HE3      LYS  67  -2.600 -26.252 -12.175
   11    HZ1  LYS  67           HZ1      LYS  67  -2.127 -24.723  -9.811
   12    HZ3  LYS  67           HZ2      LYS  67  -2.240 -24.210 -11.427
   13    HZ2  LYS  67           HZ3      LYS  67  -0.760 -24.769 -10.811

  No H/Q in entry =          13
  In of MODEL   50
    1    H    MET  68           H        MET  68   1.264 -26.344  -7.432
    2    HA   MET  68           HA       MET  68   2.174 -25.262  -5.034
    3    HB2  MET  68           HB2      MET  68   3.062 -24.725  -7.869
    4    HB3  MET  68           HB3      MET  68   3.970 -24.263  -6.429
    5    HG2  MET  68           HG2      MET  68   3.125 -27.097  -7.098
    6    HG3  MET  68           HG3      MET  68   4.738 -26.437  -7.382
    7    HE1  MET  68           HE1      MET  68   5.989 -25.257  -5.887
    8    HE3  MET  68           HE2      MET  68   6.458 -25.953  -4.337
    9    HE2  MET  68           HE3      MET  68   5.272 -24.650  -4.387

  No H/Q in entry =           9
  In of MODEL   50
    1    H    LYS  69           H        LYS  69  -0.154 -23.897  -7.036
    2    HA   LYS  69           HA       LYS  69   0.596 -21.156  -6.827
    3    HB2  LYS  69           HB2      LYS  69  -2.088 -22.327  -7.519
    4    HB3  LYS  69           HB3      LYS  69  -1.596 -20.645  -7.751
    5    HG2  LYS  69           HG2      LYS  69   0.092 -22.866  -8.871
    6    HG3  LYS  69           HG3      LYS  69  -1.344 -22.330  -9.743
    7    HD2  LYS  69           HD2      LYS  69  -0.483 -20.007  -9.708
    8    HD3  LYS  69           HD3      LYS  69   0.970 -20.571  -8.879
    9    HE2  LYS  69           HE2      LYS  69   1.474 -22.065 -10.785
   10    HE3  LYS  69           HE3      LYS  69   0.033 -21.479 -11.617
   11    HZ1  LYS  69           HZ1      LYS  69   2.123 -19.619 -10.676
   12    HZ3  LYS  69           HZ2      LYS  69   0.935 -19.370 -11.864
   13    HZ2  LYS  69           HZ3      LYS  69   2.252 -20.395 -12.179

  No H/Q in entry =          13
  In of MODEL   50
    1    H    VAL  70           H        VAL  70  -0.618 -19.422  -5.821
    2    HA   VAL  70           HA       VAL  70  -1.835 -20.191  -3.226
    3    HB   VAL  70           HB       VAL  70  -0.813 -18.131  -2.288
    4   HG13  VAL  70          HG11      VAL  70   1.372 -19.028  -2.013
    5   HG12  VAL  70          HG12      VAL  70   1.336 -19.796  -3.602
    6   HG11  VAL  70          HG13      VAL  70   0.331 -20.425  -2.296
    7   HG22  VAL  70          HG21      VAL  70  -0.513 -16.651  -4.112
    8   HG21  VAL  70          HG22      VAL  70   0.233 -17.896  -5.111
    9   HG23  VAL  70          HG23      VAL  70   1.135 -17.183  -3.776

  No H/Q in entry =           9
  In of MODEL   50
    1    H    SER  71           H        SER  71  -3.202 -18.441  -2.321
    2    HA   SER  71           HA       SER  71  -5.240 -17.636  -4.106
    3    HB2  SER  71           HB2      SER  71  -5.467 -17.924  -1.588
    4    HB3  SER  71           HB3      SER  71  -4.621 -16.391  -1.407
    5    HG   SER  71           HG       SER  71  -7.141 -16.935  -2.550

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LEU  72           H        LEU  72  -5.308 -16.032  -5.476
    2    HA   LEU  72           HA       LEU  72  -3.177 -14.245  -5.950
    3    HB2  LEU  72           HB2      LEU  72  -6.041 -14.267  -6.899
    4    HB3  LEU  72           HB3      LEU  72  -4.835 -13.114  -7.466
    5    HG   LEU  72           HG       LEU  72  -4.462 -16.123  -7.621
    6   HD12  LEU  72          HD11      LEU  72  -5.240 -14.252  -9.871
    7   HD11  LEU  72          HD12      LEU  72  -6.412 -15.220  -8.977
    8   HD13  LEU  72          HD13      LEU  72  -5.149 -16.012  -9.917
    9   HD21  LEU  72          HD21      LEU  72  -2.946 -13.713  -8.598
   10   HD23  LEU  72          HD22      LEU  72  -2.864 -15.198  -9.531
   11   HD22  LEU  72          HD23      LEU  72  -2.322 -15.183  -7.856

  No H/Q in entry =          11
  In of MODEL   50
    1    H    VAL  73           H        VAL  73  -6.267 -13.855  -4.321
    2    HA   VAL  73           HA       VAL  73  -6.277 -11.085  -3.960
    3    HB   VAL  73           HB       VAL  73  -7.999 -11.428  -2.379
    4   HG11  VAL  73          HG11      VAL  73  -8.436 -12.191  -4.740
    5   HG13  VAL  73          HG12      VAL  73  -9.455 -12.972  -3.532
    6   HG12  VAL  73          HG13      VAL  73  -8.077 -13.837  -4.215
    7   HG21  VAL  73          HG21      VAL  73  -6.581 -14.034  -1.930
    8   HG23  VAL  73          HG22      VAL  73  -8.311 -13.936  -1.599
    9   HG22  VAL  73          HG23      VAL  73  -7.188 -12.877  -0.745

  No H/Q in entry =           9
  In of MODEL   50
    1    H    LEU  74           H        LEU  74  -4.371 -13.483  -2.384
    2    HA   LEU  74           HA       LEU  74  -3.947 -12.356   0.143
    3    HB2  LEU  74           HB2      LEU  74  -3.192 -14.584  -0.367
    4    HB3  LEU  74           HB3      LEU  74  -2.125 -13.977  -1.633
    5    HG   LEU  74           HG       LEU  74  -0.804 -12.758   0.058
    6   HD12  LEU  74          HD11      LEU  74  -1.318 -13.451   2.495
    7   HD11  LEU  74          HD12      LEU  74  -2.916 -13.898   1.894
    8   HD13  LEU  74          HD13      LEU  74  -2.360 -12.228   1.769
    9   HD23  LEU  74          HD21      LEU  74  -1.064 -15.494   1.183
   10   HD22  LEU  74          HD22      LEU  74   0.354 -14.611   0.663
   11   HD21  LEU  74          HD23      LEU  74  -0.685 -15.351  -0.533

  No H/Q in entry =          11
  In of MODEL   50
    1    H    VAL  75           H        VAL  75  -2.049 -11.976  -2.811
    2    HA   VAL  75           HA       VAL  75  -0.229 -10.078  -1.792
    3    HB   VAL  75           HB       VAL  75  -1.188 -10.540  -4.618
    4   HG13  VAL  75          HG11      VAL  75  -0.298  -8.250  -4.410
    5   HG12  VAL  75          HG12      VAL  75   0.885  -9.263  -5.225
    6   HG11  VAL  75          HG13      VAL  75   1.102  -8.857  -3.531
    7   HG21  VAL  75          HG21      VAL  75  -0.002 -12.426  -3.514
    8   HG23  VAL  75          HG22      VAL  75   1.335 -11.343  -3.126
    9   HG22  VAL  75          HG23      VAL  75   0.969 -11.725  -4.810

  No H/Q in entry =           9
  In of MODEL   50
    1    H    GLU  76           H        GLU  76  -3.374  -9.685  -3.451
    2    HA   GLU  76           HA       GLU  76  -3.390  -6.870  -3.541
    3    HB2  GLU  76           HB2      GLU  76  -5.064  -8.320  -4.698
    4    HB3  GLU  76           HB3      GLU  76  -5.743  -8.753  -3.138
    5    HG2  GLU  76           HG2      GLU  76  -6.367  -6.409  -2.728
    6    HG3  GLU  76           HG3      GLU  76  -5.667  -5.925  -4.260

  No H/Q in entry =           6
  In of MODEL   50
    1    H    ALA  77           H        ALA  77  -4.530  -9.093  -1.011
    2    HA   ALA  77           HA       ALA  77  -5.462  -7.086   0.755
    3    HB2  ALA  77           HB1      ALA  77  -5.997  -9.526   0.933
    4    HB3  ALA  77           HB2      ALA  77  -5.462  -8.808   2.452
    5    HB1  ALA  77           HB3      ALA  77  -4.353  -9.800   1.508

  No H/Q in entry =           5
  In of MODEL   50
    1    H    GLN  78           H        GLN  78  -2.335  -8.674   0.386
    2    HA   GLN  78           HA       GLN  78  -1.063  -7.538   2.641
    3    HB2  GLN  78           HB2      GLN  78  -0.225  -9.485   1.281
    4    HB3  GLN  78           HB3      GLN  78   0.224  -8.341   0.018
    5    HG2  GLN  78           HG2      GLN  78   1.700  -7.170   1.601
    6    HG3  GLN  78           HG3      GLN  78   1.251  -8.306   2.869
    7   HE21  GLN  78          HE21      GLN  78   3.977  -8.069   2.033
    8   HE22  GLN  78          HE22      GLN  78   4.421  -9.505   1.242

  No H/Q in entry =           8
  In of MODEL   50
    1    H    LEU  79           H        LEU  79  -1.414  -6.460  -0.702
    2    HA   LEU  79           HA       LEU  79   0.301  -4.256  -0.679
    3    HB2  LEU  79           HB2      LEU  79  -0.735  -5.041  -2.736
    4    HB3  LEU  79           HB3      LEU  79  -2.333  -4.630  -2.127
    5    HG   LEU  79           HG       LEU  79  -1.758  -2.251  -2.092
    6   HD13  LEU  79          HD11      LEU  79   0.485  -2.039  -1.577
    7   HD12  LEU  79          HD12      LEU  79   0.539  -1.746  -3.315
    8   HD11  LEU  79          HD13      LEU  79   0.972  -3.332  -2.675
    9   HD23  LEU  79          HD21      LEU  79  -1.119  -2.051  -4.643
   10   HD22  LEU  79          HD22      LEU  79  -2.656  -2.780  -4.188
   11   HD21  LEU  79          HD23      LEU  79  -1.297  -3.805  -4.635

  No H/Q in entry =          11
  In of MODEL   50
    1    H    HIS  80           H        HIS  80  -3.168  -4.374   0.145
    2    HA   HIS  80           HA       HIS  80  -3.322  -1.618   0.819
    3    HB2  HIS  80           HB2      HIS  80  -5.056  -4.004   1.128
    4    HB3  HIS  80           HB3      HIS  80  -5.359  -2.664   2.237
    5    HD1  HIS  80           HD1      HIS  80  -6.953  -1.002   1.335
    6    HD2  HIS  80           HD2      HIS  80  -4.784  -2.833  -1.719
    7    HE1  HIS  80           HE1      HIS  80  -7.778   0.015  -0.841
    8    HE2  HIS  80           HE2      HIS  80  -6.462  -1.095  -2.712

  No H/Q in entry =           8
  In of MODEL   50
    1    H    LEU  81           H        LEU  81  -2.874  -4.527   2.801
    2    HA   LEU  81           HA       LEU  81  -2.844  -3.189   5.291
    3    HB2  LEU  81           HB2      LEU  81  -1.662  -5.819   4.402
    4    HB3  LEU  81           HB3      LEU  81  -1.629  -5.267   6.078
    5    HG   LEU  81           HG       LEU  81  -4.177  -5.478   4.448
    6   HD12  LEU  81          HD11      LEU  81  -4.510  -7.545   5.987
    7   HD11  LEU  81          HD12      LEU  81  -2.757  -7.499   6.174
    8   HD13  LEU  81          HD13      LEU  81  -3.468  -7.714   4.574
    9   HD23  LEU  81          HD21      LEU  81  -5.025  -5.678   6.947
   10   HD22  LEU  81          HD22      LEU  81  -4.677  -4.091   6.264
   11   HD21  LEU  81          HD23      LEU  81  -3.502  -4.873   7.321

  No H/Q in entry =          11
  In of MODEL   50
    1    H    MET  82           H        MET  82  -0.175  -4.123   3.118
    2    HA   MET  82           HA       MET  82   1.919  -3.265   4.806
    3    HB2  MET  82           HB2      MET  82   1.701  -3.592   1.812
    4    HB3  MET  82           HB3      MET  82   3.191  -3.045   2.578
    5    HG2  MET  82           HG2      MET  82   1.746  -5.617   3.292
    6    HG3  MET  82           HG3      MET  82   3.120  -5.523   2.193
    7    HE3  MET  82           HE1      MET  82   6.145  -4.838   4.181
    8    HE2  MET  82           HE2      MET  82   5.242  -3.455   3.568
    9    HE1  MET  82           HE3      MET  82   5.310  -4.943   2.627

  No H/Q in entry =           9
  In of MODEL   50
    1    H    THR  83           H        THR  83   0.123  -1.587   2.255
    2    HA   THR  83           HA       THR  83   1.570   0.840   2.351
    3    HB   THR  83           HB       THR  83  -0.592   1.801   1.367
    4    HG1  THR  83           HG1      THR  83  -2.261   0.528   1.255
    5   HG22  THR  83          HG21      THR  83  -0.347  -0.013  -0.640
    6   HG21  THR  83          HG22      THR  83   1.149  -0.331   0.236
    7   HG23  THR  83          HG23      THR  83   0.811   1.289  -0.373

  No H/Q in entry =           7
  In of MODEL   50
    1    H    SER  84           H        SER  84  -1.451  -0.154   3.947
    2    HA   SER  84           HA       SER  84  -1.912   2.278   5.300
    3    HB2  SER  84           HB2      SER  84  -2.787  -0.549   5.854
    4    HB3  SER  84           HB3      SER  84  -3.261   0.796   6.892
    5    HG   SER  84           HG       SER  84  -3.723   0.499   4.098

  No H/Q in entry =           5
  In of MODEL   50
    1    H    MET  85           H        MET  85  -0.246  -0.683   6.419
    2    HA   MET  85           HA       MET  85   0.286   0.226   9.027
    3    HB2  MET  85           HB2      MET  85   0.543  -2.119   8.337
    4    HB3  MET  85           HB3      MET  85   1.936  -1.671   7.351
    5    HG2  MET  85           HG2      MET  85   3.127  -0.882   9.348
    6    HG3  MET  85           HG3      MET  85   1.722  -1.253  10.348
    7    HE3  MET  85           HE1      MET  85   3.300  -3.698   7.336
    8    HE2  MET  85           HE2      MET  85   4.721  -3.983   8.339
    9    HE1  MET  85           HE3      MET  85   4.252  -2.334   7.935

  No H/Q in entry =           9
  In of MODEL   50
    1    H    LEU  86           H        LEU  86   2.226   0.464   6.078
    2    HA   LEU  86           HA       LEU  86   4.459   1.736   7.239
    3    HB2  LEU  86           HB2      LEU  86   4.252   0.665   4.926
    4    HB3  LEU  86           HB3      LEU  86   3.467   2.161   4.419
    5    HG   LEU  86           HG       LEU  86   5.513   3.372   5.404
    6   HD11  LEU  86          HD11      LEU  86   6.178   0.747   6.195
    7   HD13  LEU  86          HD12      LEU  86   7.204   2.176   6.297
    8   HD12  LEU  86          HD13      LEU  86   7.297   1.132   4.882
    9   HD23  LEU  86          HD21      LEU  86   6.204   1.607   3.047
   10   HD22  LEU  86          HD22      LEU  86   6.623   3.297   3.316
   11   HD21  LEU  86          HD23      LEU  86   4.964   2.856   2.915

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ALA  87           H        ALA  87   1.566   3.030   5.658
    2    HA   ALA  87           HA       ALA  87   2.202   5.750   5.751
    3    HB1  ALA  87           HB1      ALA  87  -0.131   4.160   5.204
    4    HB3  ALA  87           HB2      ALA  87   0.205   5.817   4.710
    5    HB2  ALA  87           HB3      ALA  87  -0.594   5.502   6.252

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ARG  88           H        ARG  88   0.481   3.766   8.134
    2    HA   ARG  88           HA       ARG  88   0.000   5.817   9.988
    3    HB2  ARG  88           HB2      ARG  88  -0.974   3.479  10.045
    4    HB3  ARG  88           HB3      ARG  88   0.559   2.953  10.750
    5    HG2  ARG  88           HG2      ARG  88   0.113   5.029  12.377
    6    HG3  ARG  88           HG3      ARG  88  -1.558   4.731  11.920
    7    HD2  ARG  88           HD2      ARG  88  -1.694   2.879  13.160
    8    HD3  ARG  88           HD3      ARG  88  -0.113   2.275  12.627
    9    HE   ARG  88           HE       ARG  88  -0.628   3.538  15.085
   10   HH21  ARG  88          HH11      ARG  88   0.944   4.522  16.328
   11   HH22  ARG  88          HH12      ARG  88   2.470   4.928  15.625
   12   HH11  ARG  88          HH21      ARG  88   1.655   3.693  12.510
   13   HH12  ARG  88          HH22      ARG  88   2.881   4.442  13.475

  No H/Q in entry =          13
  In of MODEL   50
    1    H    GLU  89           H        GLU  89   2.763   3.557   9.758
    2    HA   GLU  89           HA       GLU  89   4.037   4.418  12.105
    3    HB2  GLU  89           HB2      GLU  89   4.666   2.395  10.755
    4    HB3  GLU  89           HB3      GLU  89   5.458   3.481   9.612
    5    HG2  GLU  89           HG2      GLU  89   6.955   4.299  11.359
    6    HG3  GLU  89           HG3      GLU  89   6.106   3.352  12.576

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LEU  90           H        LEU  90   4.372   5.582   8.781
    2    HA   LEU  90           HA       LEU  90   6.332   7.552   9.374
    3    HB2  LEU  90           HB2      LEU  90   4.322   7.258   7.145
    4    HB3  LEU  90           HB3      LEU  90   5.571   8.510   7.170
    5    HG   LEU  90           HG       LEU  90   6.201   5.563   7.495
    6   HD12  LEU  90          HD11      LEU  90   6.954   5.793   5.056
    7   HD11  LEU  90          HD12      LEU  90   5.960   7.249   5.012
    8   HD13  LEU  90          HD13      LEU  90   5.217   5.685   5.350
    9   HD22  LEU  90          HD21      LEU  90   8.115   6.682   8.181
   10   HD21  LEU  90          HD22      LEU  90   7.786   8.095   7.179
   11   HD23  LEU  90          HD23      LEU  90   8.425   6.624   6.447

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  91           H        ILE  91   2.794   7.619   9.224
    2    HA   ILE  91           HA       ILE  91   2.491  10.395   9.683
    3    HB   ILE  91           HB       ILE  91   0.666   8.044  10.218
    4   HG12  ILE  91          HG12      ILE  91   0.451  10.335   8.240
    5   HG13  ILE  91          HG13      ILE  91   1.290   8.829   7.863
    6   HG22  ILE  91          HG21      ILE  91  -1.037  10.126  10.287
    7   HG21  ILE  91          HG22      ILE  91   0.376  10.934  10.963
    8   HG23  ILE  91          HG23      ILE  91  -0.282   9.503  11.755
    9   HD13  ILE  91          HD11      ILE  91  -0.672   7.570   7.903
   10   HD12  ILE  91          HD12      ILE  91  -1.240   9.095   7.226
   11   HD11  ILE  91          HD13      ILE  91  -1.517   8.729   8.929

  No H/Q in entry =          11
  In of MODEL   50
    1    H    THR  92           H        THR  92   2.855   7.641  11.876
    2    HA   THR  92           HA       THR  92   2.429   9.013  14.304
    3    HB   THR  92           HB       THR  92   4.205   6.656  13.633
    4    HG1  THR  92           HG1      THR  92   2.226   5.926  13.529
    5   HG22  THR  92          HG21      THR  92   3.817   6.368  16.265
    6   HG21  THR  92          HG22      THR  92   3.776   8.128  16.197
    7   HG23  THR  92          HG23      THR  92   5.198   7.255  15.623

  No H/Q in entry =           7
  In of MODEL   50
    1    H    GLU  93           H        GLU  93   5.375   8.530  12.371
    2    HA   GLU  93           HA       GLU  93   7.147   9.928  14.073
    3    HB2  GLU  93           HB2      GLU  93   7.233   9.621  11.057
    4    HB3  GLU  93           HB3      GLU  93   8.580  10.130  12.074
    5    HG2  GLU  93           HG2      GLU  93   7.135   7.511  12.512
    6    HG3  GLU  93           HG3      GLU  93   8.521   7.648  11.438

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LEU  94           H        LEU  94   5.114  10.978  11.362
    2    HA   LEU  94           HA       LEU  94   5.954  13.671  11.270
    3    HB2  LEU  94           HB2      LEU  94   3.347  12.343  10.511
    4    HB3  LEU  94           HB3      LEU  94   3.628  14.067  10.275
    5    HG   LEU  94           HG       LEU  94   5.620  12.056   9.220
    6   HD11  LEU  94          HD11      LEU  94   2.886  12.646   8.157
    7   HD13  LEU  94          HD12      LEU  94   3.850  11.177   8.028
    8   HD12  LEU  94          HD13      LEU  94   4.204  12.556   6.988
    9   HD23  LEU  94          HD21      LEU  94   5.895  13.894   7.503
   10   HD22  LEU  94          HD22      LEU  94   6.315  14.377   9.147
   11   HD21  LEU  94          HD23      LEU  94   4.771  14.867   8.448

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  95           H        ILE  95   3.394  12.082  13.155
    2    HA   ILE  95           HA       ILE  95   2.381  14.441  14.356
    3    HB   ILE  95           HB       ILE  95   2.360  11.557  15.272
    4   HG12  ILE  95          HG12      ILE  95   0.163  13.361  14.227
    5   HG13  ILE  95          HG13      ILE  95   1.107  12.293  13.192
    6   HG21  ILE  95          HG21      ILE  95   1.109  14.041  16.480
    7   HG23  ILE  95          HG22      ILE  95   2.141  12.857  17.282
    8   HG22  ILE  95          HG23      ILE  95   0.501  12.418  16.805
    9   HD13  ILE  95          HD11      ILE  95   0.179  10.363  14.105
   10   HD12  ILE  95          HD12      ILE  95  -1.189  11.470  14.183
   11   HD11  ILE  95          HD13      ILE  95  -0.229  11.155  15.628

  No H/Q in entry =          11
  In of MODEL   50
    1    H    GLU  96           H        GLU  96   4.947  12.187  15.347
    2    HA   GLU  96           HA       GLU  96   5.515  13.372  17.843
    3    HB2  GLU  96           HB2      GLU  96   6.437  11.203  17.190
    4    HB3  GLU  96           HB3      GLU  96   7.381  11.969  15.913
    5    HG2  GLU  96           HG2      GLU  96   9.034  12.493  17.379
    6    HG3  GLU  96           HG3      GLU  96   7.897  13.317  18.435

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LEU  97           H        LEU  97   6.601  14.140  14.560
    2    HA   LEU  97           HA       LEU  97   8.511  16.112  15.280
    3    HB2  LEU  97           HB2      LEU  97   6.915  15.589  12.782
    4    HB3  LEU  97           HB3      LEU  97   7.951  17.008  12.908
    5    HG   LEU  97           HG       LEU  97   8.947  14.196  13.461
    6   HD12  LEU  97          HD11      LEU  97   9.948  14.385  11.145
    7   HD11  LEU  97          HD12      LEU  97   8.913  15.789  10.885
    8   HD13  LEU  97          HD13      LEU  97   8.195  14.204  11.174
    9   HD23  LEU  97          HD21      LEU  97  11.131  15.452  12.724
   10   HD22  LEU  97          HD22      LEU  97  10.514  15.724  14.353
   11   HD21  LEU  97          HD23      LEU  97  10.215  16.914  13.088

  No H/Q in entry =          11
  In of MODEL   50
    1    H    HIS  98           H        HIS  98   5.022  16.290  14.623
    2    HA   HIS  98           HA       HIS  98   4.755  19.092  14.766
    3    HB2  HIS  98           HB2      HIS  98   2.838  16.862  15.483
    4    HB3  HIS  98           HB3      HIS  98   2.391  18.567  15.544
    5    HD1  HIS  98           HD1      HIS  98   3.383  15.848  13.132
    6    HD2  HIS  98           HD2      HIS  98   2.052  19.797  13.020
    7    HE1  HIS  98           HE1      HIS  98   2.832  16.350  10.709
    8    HE2  HIS  98           HE2      HIS  98   2.025  18.749  10.620

  No H/Q in entry =           8
  In of MODEL   50
    1    H    GLU  99           H        GLU  99   4.857  16.595  17.258
    2    HA   GLU  99           HA       GLU  99   4.266  18.290  19.460
    3    HB2  GLU  99           HB2      GLU  99   4.149  15.809  19.550
    4    HB3  GLU  99           HB3      GLU  99   5.908  15.744  19.443
    5    HG2  GLU  99           HG2      GLU  99   6.110  17.028  21.521
    6    HG3  GLU  99           HG3      GLU  99   4.359  17.189  21.615

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LYS 100           H        LYS 100   7.311  17.329  17.895
    2    HA   LYS 100           HA       LYS 100   8.980  18.705  19.757
    3    HB2  LYS 100           HB2      LYS 100   9.471  17.783  16.916
    4    HB3  LYS 100           HB3      LYS 100  10.708  18.536  17.928
    5    HG2  LYS 100           HG2      LYS 100  10.310  16.784  19.663
    6    HG3  LYS 100           HG3      LYS 100   9.170  15.997  18.569
    7    HD2  LYS 100           HD2      LYS 100  10.962  15.699  16.902
    8    HD3  LYS 100           HD3      LYS 100  12.108  16.498  17.982
    9    HE2  LYS 100           HE2      LYS 100  11.690  14.742  19.695
   10    HE3  LYS 100           HE3      LYS 100  10.606  13.922  18.566
   11    HZ1  LYS 100           HZ1      LYS 100  13.435  14.561  17.915
   12    HZ3  LYS 100           HZ2      LYS 100  12.380  13.521  17.083
   13    HZ2  LYS 100           HZ3      LYS 100  12.962  13.090  18.621

  No H/Q in entry =          13
  In of MODEL   50
    1    H    LEU 101           H        LEU 101   7.300  19.660  16.803
    2    HA   LEU 101           HA       LEU 101   8.543  22.204  16.477
    3    HB2  LEU 101           HB2      LEU 101   5.935  21.003  15.584
    4    HB3  LEU 101           HB3      LEU 101   6.206  22.732  15.382
    5    HG   LEU 101           HG       LEU 101   8.219  20.695  14.412
    6   HD12  LEU 101          HD11      LEU 101   7.074  21.221  12.128
    7   HD11  LEU 101          HD12      LEU 101   5.679  21.664  13.108
    8   HD13  LEU 101          HD13      LEU 101   6.324  20.026  13.186
    9   HD21  LEU 101          HD21      LEU 101   7.626  23.616  13.865
   10   HD23  LEU 101          HD22      LEU 101   8.596  22.648  12.756
   11   HD22  LEU 101          HD23      LEU 101   9.140  22.894  14.415

  No H/Q in entry =          11
  In of MODEL   50
    1    H    LYS 102           H        LYS 102   6.991  21.076  19.088
    2    HA   LYS 102           HA       LYS 102   6.370  22.169  21.023
    3    HB2  LYS 102           HB2      LYS 102   7.677  24.147  19.905
    4    HB3  LYS 102           HB3      LYS 102   6.085  24.772  19.530
    5    HG2  LYS 102           HG2      LYS 102   7.457  24.492  22.183
    6    HG3  LYS 102           HG3      LYS 102   6.520  25.834  21.557
    7    HD2  LYS 102           HD2      LYS 102   5.245  23.209  22.427
    8    HD3  LYS 102           HD3      LYS 102   5.508  24.564  23.514
    9    HE2  LYS 102           HE2      LYS 102   3.226  24.193  22.022
   10    HE3  LYS 102           HE3      LYS 102   3.746  25.730  22.710
   11    HZ2  LYS 102           HZ1      LYS 102   3.219  25.852  20.330
   12    HZ1  LYS 102           HZ2      LYS 102   4.468  24.756  20.005
   13    HZ3  LYS 102           HZ3      LYS 102   4.829  26.280  20.652

  No H/Q in entry =          13
  In of MODEL   50
    1    H    ALA 103           H        ALA 103   4.753  23.740  18.259
    2    HA   ALA 103           HA       ALA 103   2.305  24.343  19.144
    3    HB1  ALA 103           HB1      ALA 103   1.398  23.519  16.898
    4    HB2  ALA 103           HB2      ALA 103   3.039  22.963  16.568
    5    HB3  ALA 103           HB3      ALA 103   2.725  24.678  16.839

  No H/Q in entry =           5
  In of MODEL   50
    1    H1   ALA   1           H3       ALA   1  10.393 -20.178  -6.263
    2    H2   ALA   1           H2       ALA   1   9.427 -20.368  -7.650
    3    H3   ALA   1           H1       ALA   1   8.979 -21.113  -6.189
    4    HA   ALA   1           HA       ALA   1   9.997 -22.933  -6.934
    5    HB1  ALA   1           HB1      ALA   1  10.098 -22.568  -9.208
    6    HB2  ALA   1           HB2      ALA   1  11.827 -22.440  -8.878
    7    HB3  ALA   1           HB3      ALA   1  10.847 -20.980  -9.025

  No H/Q in entry =           7
  In of MODEL   50
    1    H    GLU   2           H        GLU   2  12.268 -23.912  -6.993
    2    HA   GLU   2           HA       GLU   2  13.649 -23.855  -4.781
    3    HB2  GLU   2           HB2      GLU   2  15.009 -23.732  -7.479
    4    HB3  GLU   2           HB3      GLU   2  15.728 -24.357  -5.995
    5    HG2  GLU   2           HG2      GLU   2  14.686 -26.360  -6.243
    6    HG3  GLU   2           HG3      GLU   2  13.125 -25.593  -6.500

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLU   3           H        GLU   3  15.445 -22.005  -7.175
    2    HA   GLU   3           HA       GLU   3  16.619 -20.339  -5.210
    3    HB2  GLU   3           HB2      GLU   3  16.565 -20.326  -8.220
    4    HB3  GLU   3           HB3      GLU   3  17.327 -19.010  -7.328
    5    HG2  GLU   3           HG2      GLU   3  18.971 -20.408  -6.409
    6    HG3  GLU   3           HG3      GLU   3  18.006 -21.862  -6.635

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LEU   4           H        LEU   4  14.349 -19.454  -7.839
    2    HA   LEU   4           HA       LEU   4  13.916 -16.841  -7.219
    3    HB2  LEU   4           HB2      LEU   4  11.716 -18.785  -7.957
    4    HB3  LEU   4           HB3      LEU   4  11.664 -17.035  -8.150
    5    HG   LEU   4           HG       LEU   4  13.605 -18.919  -9.528
    6   HD13  LEU   4          HD11      LEU   4  12.306 -18.747 -11.438
    7   HD12  LEU   4          HD12      LEU   4  11.618 -17.195 -10.966
    8   HD11  LEU   4          HD13      LEU   4  11.045 -18.680 -10.210
    9   HD23  LEU   4          HD21      LEU   4  13.971 -16.674 -10.872
   10   HD22  LEU   4          HD22      LEU   4  14.827 -16.932  -9.353
   11   HD21  LEU   4          HD23      LEU   4  13.387 -15.917  -9.389

  No H/Q in entry =          11
  In of MODEL   50
    1    H    GLU   5           H        GLU   5  12.395 -19.611  -5.587
    2    HA   GLU   5           HA       GLU   5  10.737 -18.023  -3.879
    3    HB2  GLU   5           HB2      GLU   5  10.298 -20.403  -4.418
    4    HB3  GLU   5           HB3      GLU   5  11.709 -20.848  -3.457
    5    HG2  GLU   5           HG2      GLU   5   9.787 -21.061  -2.025
    6    HG3  GLU   5           HG3      GLU   5  10.665 -19.619  -1.516

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLU   6           H        GLU   6  13.863 -19.645  -3.440
    2    HA   GLU   6           HA       GLU   6  14.225 -18.802  -0.739
    3    HB2  GLU   6           HB2      GLU   6  15.425 -20.729  -1.753
    4    HB3  GLU   6           HB3      GLU   6  16.316 -19.603  -2.780
    5    HG2  GLU   6           HG2      GLU   6  17.703 -20.086  -0.870
    6    HG3  GLU   6           HG3      GLU   6  17.097 -18.442  -0.678

  No H/Q in entry =           6
  In of MODEL   50
    1    H    VAL   7           H        VAL   7  15.009 -17.475  -3.884
    2    HA   VAL   7           HA       VAL   7  16.721 -15.372  -3.012
    3    HB   VAL   7           HB       VAL   7  15.012 -15.706  -5.491
    4   HG11  VAL   7          HG11      VAL   7  16.932 -13.520  -4.671
    5   HG13  VAL   7          HG12      VAL   7  15.292 -13.354  -5.295
    6   HG12  VAL   7          HG13      VAL   7  16.595 -13.870  -6.366
    7   HG21  VAL   7          HG21      VAL   7  17.100 -17.191  -4.926
    8   HG23  VAL   7          HG22      VAL   7  18.023 -15.740  -5.320
    9   HG22  VAL   7          HG23      VAL   7  16.978 -16.473  -6.534

  No H/Q in entry =           9
  In of MODEL   50
    1    H    VAL   8           H        VAL   8  13.225 -15.597  -3.571
    2    HA   VAL   8           HA       VAL   8  12.593 -12.882  -3.091
    3    HB   VAL   8           HB       VAL   8  10.951 -15.393  -2.665
    4   HG12  VAL   8          HG11      VAL   8   9.013 -13.760  -2.740
    5   HG11  VAL   8          HG12      VAL   8  10.188 -12.458  -2.563
    6   HG13  VAL   8          HG13      VAL   8  10.005 -13.659  -1.285
    7   HG22  VAL   8          HG21      VAL   8  10.325 -15.211  -4.884
    8   HG21  VAL   8          HG22      VAL   8  11.849 -14.342  -5.029
    9   HG23  VAL   8          HG23      VAL   8  10.344 -13.448  -4.845

  No H/Q in entry =           9
  In of MODEL   50
    1    H    MET   9           H        MET   9  12.825 -15.698  -0.920
    2    HA   MET   9           HA       MET   9  12.024 -14.424   1.454
    3    HB2  MET   9           HB2      MET   9  13.913 -16.715   0.914
    4    HB3  MET   9           HB3      MET   9  13.597 -16.141   2.552
    5    HG2  MET   9           HG2      MET   9  11.188 -16.527   2.241
    6    HG3  MET   9           HG3      MET   9  11.482 -17.067   0.587
    7    HE1  MET   9           HE1      MET   9  12.443 -17.308   4.136
    8    HE3  MET   9           HE2      MET   9  12.755 -19.003   4.505
    9    HE2  MET   9           HE3      MET   9  11.098 -18.446   4.288

  No H/Q in entry =           9
  In of MODEL   50
    1    H    GLY  10           H        GLY  10  15.202 -14.681  -0.102
    2    HA3  GLY  10           HA2      GLY  10  16.677 -13.284   1.873
    3    HA2  GLY  10           HA3      GLY  10  17.139 -13.449   0.179

  No H/Q in entry =           3
  In of MODEL   50
    1    H    LEU  11           H        LEU  11  14.986 -12.199  -1.057
    2    HA   LEU  11           HA       LEU  11  15.702  -9.463  -0.884
    3    HB2  LEU  11           HB2      LEU  11  13.319 -10.841  -2.125
    4    HB3  LEU  11           HB3      LEU  11  13.619  -9.110  -2.279
    5    HG   LEU  11           HG       LEU  11  15.623 -11.239  -3.073
    6   HD13  LEU  11          HD11      LEU  11  13.874 -11.581  -4.595
    7   HD12  LEU  11          HD12      LEU  11  14.890 -10.408  -5.431
    8   HD11  LEU  11          HD13      LEU  11  13.423  -9.876  -4.612
    9   HD22  LEU  11          HD21      LEU  11  16.876  -9.290  -2.840
   10   HD21  LEU  11          HD22      LEU  11  15.513  -8.236  -3.216
   11   HD23  LEU  11          HD23      LEU  11  16.335  -9.110  -4.508

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  12           H        ILE  12  12.912 -11.262   0.375
    2    HA   ILE  12           HA       ILE  12  11.543  -9.026   1.441
    3    HB   ILE  12           HB       ILE  12  11.548 -11.910   2.386
    4   HG12  ILE  12          HG12      ILE  12  10.874 -11.267  -0.065
    5   HG13  ILE  12          HG13      ILE  12   9.836 -12.350   0.842
    6   HG21  ILE  12          HG21      ILE  12   9.639  -9.617   2.943
    7   HG23  ILE  12          HG22      ILE  12  10.605 -10.504   4.121
    8   HG22  ILE  12          HG23      ILE  12   9.273 -11.305   3.292
    9   HD12  ILE  12          HD11      ILE  12   8.604 -10.554  -0.385
   10   HD11  ILE  12          HD12      ILE  12   9.440  -9.357   0.601
   11   HD13  ILE  12          HD13      ILE  12   8.344 -10.496   1.350

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  13           H        ILE  13  13.911 -11.261   2.841
    2    HA   ILE  13           HA       ILE  13  13.958 -10.090   5.426
    3    HB   ILE  13           HB       ILE  13  16.007 -11.674   3.858
    4   HG12  ILE  13          HG12      ILE  13  13.727 -12.639   4.661
    5   HG13  ILE  13          HG13      ILE  13  15.193 -13.564   4.971
    6   HG23  ILE  13          HG21      ILE  13  17.453 -10.712   5.373
    7   HG22  ILE  13          HG22      ILE  13  16.867 -12.039   6.367
    8   HG21  ILE  13          HG23      ILE  13  16.193 -10.422   6.571
    9   HD12  ILE  13          HD11      ILE  13  13.384 -13.047   6.912
   10   HD11  ILE  13          HD12      ILE  13  14.377 -11.602   7.058
   11   HD13  ILE  13          HD13      ILE  13  15.108 -13.190   7.242

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ASN  14           H        ASN  14  15.918  -9.569   2.510
    2    HA   ASN  14           HA       ASN  14  17.680  -7.648   3.579
    3    HB2  ASN  14           HB2      ASN  14  17.647  -8.907   1.259
    4    HB3  ASN  14           HB3      ASN  14  16.768  -7.479   0.726
    5   HD21  ASN  14          HD21      ASN  14  19.206  -7.838  -0.459
    6   HD22  ASN  14          HD22      ASN  14  20.359  -6.768   0.173

  No H/Q in entry =           6
  In of MODEL   50
    1    H    SER  15           H        SER  15  14.574  -7.266   1.886
    2    HA   SER  15           HA       SER  15  14.488  -4.445   1.951
    3    HB2  SER  15           HB2      SER  15  12.151  -4.670   1.457
    4    HB3  SER  15           HB3      SER  15  12.939  -6.035   0.676
    5    HG   SER  15           HG       SER  15  11.714  -7.251   1.851

  No H/Q in entry =           5
  In of MODEL   50
    1    H    GLY  16           H        GLY  16  13.371  -6.903   4.246
    2    HA3  GLY  16           HA2      GLY  16  12.163  -5.149   6.108
    3    HA2  GLY  16           HA3      GLY  16  12.764  -6.764   6.465

  No H/Q in entry =           3
  In of MODEL   50
    1    H    GLN  17           H        GLN  17  15.478  -6.452   5.876
    2    HA   GLN  17           HA       GLN  17  16.443  -5.247   8.261
    3    HB2  GLN  17           HB2      GLN  17  17.669  -7.041   7.090
    4    HB3  GLN  17           HB3      GLN  17  17.960  -5.955   5.730
    5    HG2  GLN  17           HG2      GLN  17  19.195  -4.420   7.215
    6    HG3  GLN  17           HG3      GLN  17  18.909  -5.505   8.574
    7   HE21  GLN  17          HE21      GLN  17  20.668  -6.842   8.979
    8   HE22  GLN  17          HE22      GLN  17  21.750  -7.413   7.803

  No H/Q in entry =           8
  In of MODEL   50
    1    H    ALA  18           H        ALA  18  16.267  -4.157   4.905
    2    HA   ALA  18           HA       ALA  18  17.722  -1.777   5.141
    3    HB2  ALA  18           HB1      ALA  18  16.596  -2.976   3.068
    4    HB3  ALA  18           HB2      ALA  18  16.875  -1.235   3.058
    5    HB1  ALA  18           HB3      ALA  18  15.270  -1.869   3.424

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ARG  19           H        ARG  19  14.217  -2.337   5.532
    2    HA   ARG  19           HA       ARG  19  13.570   0.316   6.255
    3    HB2  ARG  19           HB2      ARG  19  11.876  -1.420   5.661
    4    HB3  ARG  19           HB3      ARG  19  12.209  -2.226   7.196
    5    HG2  ARG  19           HG2      ARG  19  11.514  -0.233   8.441
    6    HG3  ARG  19           HG3      ARG  19  11.273   0.651   6.935
    7    HD2  ARG  19           HD2      ARG  19   9.124  -0.131   7.750
    8    HD3  ARG  19           HD3      ARG  19   9.537  -1.009   6.272
    9    HE   ARG  19           HE       ARG  19  10.481  -2.566   8.373
   10   HH21  ARG  19          HH11      ARG  19   9.217  -4.199   9.306
   11   HH22  ARG  19          HH12      ARG  19   7.498  -4.156   9.133
   12   HH11  ARG  19          HH21      ARG  19   7.498  -1.245   7.279
   13   HH12  ARG  19          HH22      ARG  19   6.525  -2.485   7.982

  No H/Q in entry =          13
  In of MODEL   50
    1    H    SER  20           H        SER  20  14.403  -2.528   8.206
    2    HA   SER  20           HA       SER  20  14.126  -1.434  10.746
    3    HB2  SER  20           HB2      SER  20  14.573  -3.762  10.618
    4    HB3  SER  20           HB3      SER  20  16.028  -3.508   9.658
    5    HG   SER  20           HG       SER  20  15.583  -2.873  12.386

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LEU  21           H        LEU  21  16.972  -1.389   8.614
    2    HA   LEU  21           HA       LEU  21  18.657   0.078  10.358
    3    HB2  LEU  21           HB2      LEU  21  18.637  -0.183   7.343
    4    HB3  LEU  21           HB3      LEU  21  19.898   0.662   8.238
    5    HG   LEU  21           HG       LEU  21  19.132  -2.225   8.763
    6   HD12  LEU  21          HD11      LEU  21  21.260  -2.742   7.523
    7   HD11  LEU  21          HD12      LEU  21  21.316  -1.054   7.016
    8   HD13  LEU  21          HD13      LEU  21  19.983  -2.086   6.500
    9   HD22  LEU  21          HD21      LEU  21  20.295  -1.531  10.670
   10   HD21  LEU  21          HD22      LEU  21  21.267  -0.356   9.792
   11   HD23  LEU  21          HD23      LEU  21  21.635  -2.068   9.662

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ALA  22           H        ALA  22  16.404   1.073   7.803
    2    HA   ALA  22           HA       ALA  22  16.965   3.827   7.826
    3    HB3  ALA  22           HB1      ALA  22  15.554   2.602   6.143
    4    HB2  ALA  22           HB2      ALA  22  14.859   4.119   6.713
    5    HB1  ALA  22           HB3      ALA  22  14.256   2.582   7.335

  No H/Q in entry =           5
  In of MODEL   50
    1    H    TYR  23           H        TYR  23  14.451   2.026   9.653
    2    HA   TYR  23           HA       TYR  23  13.506   4.267  11.108
    3    HB2  TYR  23           HB2      TYR  23  12.254   2.162  11.078
    4    HB3  TYR  23           HB3      TYR  23  13.577   1.340  11.904
    5    HD1  TYR  23           HD1      TYR  23  11.091   4.098  12.269
    6    HD2  TYR  23           HD2      TYR  23  13.772   1.398  14.262
    7    HE1  TYR  23           HE1      TYR  23  10.163   4.794  14.463
    8    HE2  TYR  23           HE2      TYR  23  12.844   2.092  16.453
    9    HH   TYR  23           HH       TYR  23  10.054   4.245  16.668

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ALA  24           H        ALA  24  16.131   1.966  11.741
    2    HA   ALA  24           HA       ALA  24  16.806   2.948  14.308
    3    HB1  ALA  24           HB1      ALA  24  18.148   1.143  14.139
    4    HB3  ALA  24           HB2      ALA  24  19.184   2.060  13.045
    5    HB2  ALA  24           HB3      ALA  24  17.882   1.064  12.398

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ALA  25           H        ALA  25  17.775   3.879  11.034
    2    HA   ALA  25           HA       ALA  25  19.737   5.794  11.688
    3    HB1  ALA  25           HB1      ALA  25  19.015   4.860   9.369
    4    HB3  ALA  25           HB2      ALA  25  19.531   6.543   9.468
    5    HB2  ALA  25           HB3      ALA  25  17.813   6.151   9.395

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LEU  26           H        LEU  26  16.225   6.056  11.323
    2    HA   LEU  26           HA       LEU  26  16.025   8.838  11.783
    3    HB2  LEU  26           HB2      LEU  26  14.153   7.622  10.849
    4    HB3  LEU  26           HB3      LEU  26  14.052   6.591  12.271
    5    HG   LEU  26           HG       LEU  26  13.462   8.549  13.657
    6   HD12  LEU  26          HD11      LEU  26  12.822  10.660  12.338
    7   HD11  LEU  26          HD12      LEU  26  13.798  10.003  11.027
    8   HD13  LEU  26          HD13      LEU  26  14.544  10.376  12.581
    9   HD21  LEU  26          HD21      LEU  26  11.787   8.260  11.144
   10   HD23  LEU  26          HD22      LEU  26  11.231   8.958  12.662
   11   HD22  LEU  26          HD23      LEU  26  11.667   7.253  12.587

  No H/Q in entry =          11
  In of MODEL   50
    1    H    LYS  27           H        LYS  27  15.888   6.052  13.967
    2    HA   LYS  27           HA       LYS  27  15.306   7.416  16.339
    3    HB2  LYS  27           HB2      LYS  27  15.311   4.941  16.066
    4    HB3  LYS  27           HB3      LYS  27  17.074   4.977  16.025
    5    HG2  LYS  27           HG2      LYS  27  17.131   5.955  18.277
    6    HG3  LYS  27           HG3      LYS  27  15.364   5.990  18.321
    7    HD2  LYS  27           HD2      LYS  27  15.316   3.524  18.076
    8    HD3  LYS  27           HD3      LYS  27  17.080   3.497  18.067
    9    HE2  LYS  27           HE2      LYS  27  17.121   4.478  20.326
   10    HE3  LYS  27           HE3      LYS  27  15.356   4.535  20.339
   11    HZ3  LYS  27           HZ1      LYS  27  16.123   2.571  21.484
   12    HZ2  LYS  27           HZ2      LYS  27  17.036   2.088  20.133
   13    HZ1  LYS  27           HZ3      LYS  27  15.339   2.110  20.051

  No H/Q in entry =          13
  In of MODEL   50
    1    H    GLN  28           H        GLN  28  18.418   6.808  14.749
    2    HA   GLN  28           HA       GLN  28  20.111   7.868  16.745
    3    HB2  GLN  28           HB2      GLN  28  20.393   7.808  13.730
    4    HB3  GLN  28           HB3      GLN  28  21.683   8.300  14.828
    5    HG2  GLN  28           HG2      GLN  28  20.272   5.621  14.948
    6    HG3  GLN  28           HG3      GLN  28  21.822   5.890  14.154
    7   HE21  GLN  28          HE21      GLN  28  23.185   7.522  15.931
    8   HE22  GLN  28          HE22      GLN  28  23.355   6.748  17.432

  No H/Q in entry =           8
  In of MODEL   50
    1    H    ALA  29           H        ALA  29  18.378   9.378  14.055
    2    HA   ALA  29           HA       ALA  29  19.404  11.987  14.318
    3    HB2  ALA  29           HB1      ALA  29  17.714  12.646  12.847
    4    HB1  ALA  29           HB2      ALA  29  16.557  11.483  13.493
    5    HB3  ALA  29           HB3      ALA  29  17.882  10.930  12.469

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LYS  30           H        LYS  30  16.608  10.412  15.831
    2    HA   LYS  30           HA       LYS  30  15.617  12.672  17.194
    3    HB2  LYS  30           HB2      LYS  30  15.472   9.730  17.888
    4    HB3  LYS  30           HB3      LYS  30  14.619  10.987  18.785
    5    HG2  LYS  30           HG2      LYS  30  13.505  11.692  16.667
    6    HG3  LYS  30           HG3      LYS  30  14.295  10.350  15.837
    7    HD2  LYS  30           HD2      LYS  30  13.204   8.750  17.359
    8    HD3  LYS  30           HD3      LYS  30  12.423  10.081  18.213
    9    HE2  LYS  30           HE2      LYS  30  11.264  10.734  16.122
   10    HE3  LYS  30           HE3      LYS  30  12.025   9.374  15.287
   11    HZ2  LYS  30           HZ1      LYS  30   9.711   8.988  16.163
   12    HZ1  LYS  30           HZ2      LYS  30  10.377   9.028  17.731
   13    HZ3  LYS  30           HZ3      LYS  30  10.873   7.841  16.617

  No H/Q in entry =          13
  In of MODEL   50
    1    H    GLN  31           H        GLN  31  18.253  10.470  17.927
    2    HA   GLN  31           HA       GLN  31  18.588  11.472  20.625
    3    HB2  GLN  31           HB2      GLN  31  20.595   9.883  19.017
    4    HB3  GLN  31           HB3      GLN  31  20.460  10.003  20.772
    5    HG2  GLN  31           HG2      GLN  31  17.937   9.082  19.997
    6    HG3  GLN  31           HG3      GLN  31  19.030   8.229  18.915
    7   HE21  GLN  31          HE21      GLN  31  17.472   7.093  21.186
    8   HE22  GLN  31          HE22      GLN  31  18.619   6.415  22.235

  No H/Q in entry =           8
  In of MODEL   50
    1    H    GLY  32           H        GLY  32  19.126  12.793  17.663
    2    HA3  GLY  32           HA2      GLY  32  20.134  14.829  17.157
    3    HA2  GLY  32           HA3      GLY  32  20.890  14.819  18.746

  No H/Q in entry =           3
  In of MODEL   50
    1    H    ASP  33           H        ASP  33  21.281  11.928  16.960
    2    HA   ASP  33           HA       ASP  33  24.114  12.573  16.499
    3    HB2  ASP  33           HB2      ASP  33  22.576   9.974  16.604
    4    HB3  ASP  33           HB3      ASP  33  24.264  10.073  16.112

  No H/Q in entry =           4
  In of MODEL   50
    1    H    PHE  34           H        PHE  34  23.650  13.908  14.622
    2    HA   PHE  34           HA       PHE  34  22.292  12.947  12.330
    3    HB2  PHE  34           HB2      PHE  34  24.447  15.056  12.569
    4    HB3  PHE  34           HB3      PHE  34  23.460  14.782  11.135
    5    HD1  PHE  34           HD1      PHE  34  23.729  16.703  14.056
    6    HD2  PHE  34           HD2      PHE  34  20.831  14.628  11.660
    7    HE1  PHE  34           HE1      PHE  34  21.928  18.118  15.006
    8    HE2  PHE  34           HE2      PHE  34  19.033  16.043  12.613
    9    HZ   PHE  34           HZ       PHE  34  19.585  17.788  14.281

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ALA  35           H        ALA  35  25.663  12.718  13.340
    2    HA   ALA  35           HA       ALA  35  26.762  11.894  10.882
    3    HB3  ALA  35           HB1      ALA  35  28.428  10.700  12.599
    4    HB2  ALA  35           HB2      ALA  35  27.574  11.731  13.747
    5    HB1  ALA  35           HB3      ALA  35  28.420  12.450  12.378

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ALA  36           H        ALA  36  25.622   9.941  13.639
    2    HA   ALA  36           HA       ALA  36  26.081   7.452  12.355
    3    HB2  ALA  36           HB1      ALA  36  25.640   6.704  14.428
    4    HB3  ALA  36           HB2      ALA  36  23.957   7.217  14.278
    5    HB1  ALA  36           HB3      ALA  36  25.170   8.334  14.906

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ALA  37           H        ALA  37  23.282   9.608  12.494
    2    HA   ALA  37           HA       ALA  37  21.408   7.862  11.310
    3    HB3  ALA  37           HB1      ALA  37  21.665  10.821  11.612
    4    HB1  ALA  37           HB2      ALA  37  20.341   9.755  12.080
    5    HB2  ALA  37           HB3      ALA  37  20.537  10.231  10.392

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LYS  38           H        LYS  38  23.535  10.306   9.842
    2    HA   LYS  38           HA       LYS  38  22.894   9.894   7.162
    3    HB2  LYS  38           HB2      LYS  38  24.718  11.428   8.614
    4    HB3  LYS  38           HB3      LYS  38  25.742  10.432   7.586
    5    HG2  LYS  38           HG2      LYS  38  24.587  11.221   5.592
    6    HG3  LYS  38           HG3      LYS  38  23.400  12.084   6.575
    7    HD2  LYS  38           HD2      LYS  38  25.011  13.664   7.334
    8    HD3  LYS  38           HD3      LYS  38  26.361  12.666   6.796
    9    HE2  LYS  38           HE2      LYS  38  26.025  14.546   5.251
   10    HE3  LYS  38           HE3      LYS  38  25.676  13.015   4.441
   11    HZ3  LYS  38           HZ1      LYS  38  23.483  13.482   4.310
   12    HZ2  LYS  38           HZ2      LYS  38  24.022  15.091   4.404
   13    HZ1  LYS  38           HZ3      LYS  38  23.439  14.308   5.793

  No H/Q in entry =          13
  In of MODEL   50
    1    H    ALA  39           H        ALA  39  25.390   8.265   9.115
    2    HA   ALA  39           HA       ALA  39  26.446   6.673   7.041
    3    HB2  ALA  39           HB1      ALA  39  26.345   5.701   9.882
    4    HB1  ALA  39           HB2      ALA  39  27.312   7.119   9.471
    5    HB3  ALA  39           HB3      ALA  39  27.649   5.568   8.703

  No H/Q in entry =           5
  In of MODEL   50
    1    H    MET  40           H        MET  40  23.825   6.075   9.335
    2    HA   MET  40           HA       MET  40  23.357   3.377   8.591
    3    HB2  MET  40           HB2      MET  40  21.558   5.433   9.888
    4    HB3  MET  40           HB3      MET  40  21.136   3.728   9.707
    5    HG2  MET  40           HG2      MET  40  23.692   4.641  11.054
    6    HG3  MET  40           HG3      MET  40  22.195   4.376  11.944
    7    HE3  MET  40           HE1      MET  40  21.597   0.748  12.107
    8    HE2  MET  40           HE2      MET  40  20.741   2.061  11.303
    9    HE1  MET  40           HE3      MET  40  21.483   2.336  12.878

  No H/Q in entry =           9
  In of MODEL   50
    1    H    MET  41           H        MET  41  21.973   6.447   7.412
    2    HA   MET  41           HA       MET  41  20.006   5.276   5.734
    3    HB2  MET  41           HB2      MET  41  21.512   7.854   5.232
    4    HB3  MET  41           HB3      MET  41  19.980   7.377   4.510
    5    HG2  MET  41           HG2      MET  41  19.230   7.187   7.060
    6    HG3  MET  41           HG3      MET  41  20.549   8.332   7.287
    7    HE2  MET  41           HE1      MET  41  20.001   9.636   3.954
    8    HE1  MET  41           HE2      MET  41  20.961  10.062   5.368
    9    HE3  MET  41           HE3      MET  41  19.699  11.155   4.806

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ASP  42           H        ASP  42  23.388   6.170   5.188
    2    HA   ASP  42           HA       ASP  42  23.478   5.705   2.429
    3    HB2  ASP  42           HB2      ASP  42  25.236   6.680   4.203
    4    HB3  ASP  42           HB3      ASP  42  25.879   5.049   4.070

  No H/Q in entry =           4
  In of MODEL   50
    1    H    GLN  43           H        GLN  43  24.180   3.534   5.142
    2    HA   GLN  43           HA       GLN  43  24.826   1.276   3.552
    3    HB2  GLN  43           HB2      GLN  43  23.802   1.459   6.396
    4    HB3  GLN  43           HB3      GLN  43  24.368  -0.033   5.636
    5    HG2  GLN  43           HG2      GLN  43  26.543   1.160   5.131
    6    HG3  GLN  43           HG3      GLN  43  25.971   2.489   6.135
    7   HE21  GLN  43          HE21      GLN  43  28.194   1.492   7.170
    8   HE22  GLN  43          HE22      GLN  43  27.909   0.408   8.443

  No H/Q in entry =           8
  In of MODEL   50
    1    H    SER  44           H        SER  44  21.778   2.432   4.938
    2    HA   SER  44           HA       SER  44  20.190   0.206   4.257
    3    HB2  SER  44           HB2      SER  44  19.770   2.734   5.411
    4    HB3  SER  44           HB3      SER  44  18.737   2.706   3.984
    5    HG   SER  44           HG       SER  44  17.633   1.766   5.703

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ARG  45           H        ARG  45  20.962   3.170   2.463
    2    HA   ARG  45           HA       ARG  45  19.434   2.706   0.155
    3    HB2  ARG  45           HB2      ARG  45  20.597   4.829   0.748
    4    HB3  ARG  45           HB3      ARG  45  22.135   4.062   0.361
    5    HG2  ARG  45           HG2      ARG  45  21.350   3.672  -1.956
    6    HG3  ARG  45           HG3      ARG  45  19.824   4.462  -1.568
    7    HD2  ARG  45           HD2      ARG  45  21.093   6.545  -0.975
    8    HD3  ARG  45           HD3      ARG  45  22.583   5.760  -1.545
    9    HE   ARG  45           HE       ARG  45  20.653   5.547  -3.583
   10   HH21  ARG  45          HH11      ARG  45  20.660   6.922  -5.342
   11   HH22  ARG  45          HH12      ARG  45  21.431   8.465  -5.232
   12   HH11  ARG  45          HH21      ARG  45  22.405   8.023  -1.947
   13   HH12  ARG  45          HH22      ARG  45  22.418   9.088  -3.306

  No H/Q in entry =          13
  In of MODEL   50
    1    H    MET  46           H        MET  46  22.789   1.797   0.902
    2    HA   MET  46           HA       MET  46  23.386   0.607  -1.586
    3    HB2  MET  46           HB2      MET  46  24.487   0.254   1.203
    4    HB3  MET  46           HB3      MET  46  25.139  -0.631  -0.180
    5    HG2  MET  46           HG2      MET  46  25.579   1.494  -1.346
    6    HG3  MET  46           HG3      MET  46  24.906   2.389   0.009
    7    HE1  MET  46           HE1      MET  46  26.776   3.836   0.434
    8    HE3  MET  46           HE2      MET  46  27.770   3.231  -0.888
    9    HE2  MET  46           HE3      MET  46  28.463   3.390   0.725

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ALA  47           H        ALA  47  21.988  -0.723   1.385
    2    HA   ALA  47           HA       ALA  47  21.908  -3.432   0.573
    3    HB2  ALA  47           HB1      ALA  47  21.533  -2.975   2.879
    4    HB3  ALA  47           HB2      ALA  47  19.990  -3.561   2.257
    5    HB1  ALA  47           HB3      ALA  47  20.237  -1.833   2.522

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LEU  48           H        LEU  48  19.582  -0.780   0.224
    2    HA   LEU  48           HA       LEU  48  17.522  -2.289  -1.032
    3    HB2  LEU  48           HB2      LEU  48  18.207   0.659  -1.137
    4    HB3  LEU  48           HB3      LEU  48  16.729  -0.034  -1.807
    5    HG   LEU  48           HG       LEU  48  17.578  -0.354   1.081
    6   HD13  LEU  48          HD11      LEU  48  17.184   1.951   0.902
    7   HD12  LEU  48          HD12      LEU  48  15.619   1.318   1.409
    8   HD11  LEU  48          HD13      LEU  48  15.895   1.743  -0.281
    9   HD22  LEU  48          HD21      LEU  48  16.032  -2.051   0.695
   10   HD21  LEU  48          HD22      LEU  48  15.168  -1.136  -0.541
   11   HD23  LEU  48          HD23      LEU  48  14.959  -0.734   1.164

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ASN  49           H        ASN  49  20.230  -0.385  -2.257
    2    HA   ASN  49           HA       ASN  49  19.578  -0.453  -4.981
    3    HB2  ASN  49           HB2      ASN  49  21.277   1.037  -4.032
    4    HB3  ASN  49           HB3      ASN  49  22.297  -0.343  -3.641
    5   HD21  ASN  49          HD21      ASN  49  24.005   0.470  -5.042
    6   HD22  ASN  49          HD22      ASN  49  23.866   0.395  -6.732

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLU  50           H        GLU  50  21.539  -2.675  -3.025
    2    HA   GLU  50           HA       GLU  50  22.222  -4.432  -5.157
    3    HB2  GLU  50           HB2      GLU  50  23.420  -4.425  -2.990
    4    HB3  GLU  50           HB3      GLU  50  21.971  -5.040  -2.196
    5    HG2  GLU  50           HG2      GLU  50  22.039  -7.070  -3.561
    6    HG3  GLU  50           HG3      GLU  50  23.421  -6.450  -4.460

  No H/Q in entry =           6
  In of MODEL   50
    1    H    ALA  51           H        ALA  51  19.567  -4.345  -2.830
    2    HA   ALA  51           HA       ALA  51  18.374  -6.803  -3.594
    3    HB3  ALA  51           HB1      ALA  51  16.788  -6.285  -2.037
    4    HB1  ALA  51           HB2      ALA  51  16.592  -4.634  -2.630
    5    HB2  ALA  51           HB3      ALA  51  17.947  -5.038  -1.576

  No H/Q in entry =           5
  In of MODEL   50
    1    H    HIS  52           H        HIS  52  17.824  -3.446  -4.619
    2    HA   HIS  52           HA       HIS  52  15.705  -3.945  -6.420
    3    HB2  HIS  52           HB2      HIS  52  16.356  -1.689  -5.623
    4    HB3  HIS  52           HB3      HIS  52  17.833  -1.797  -6.580
    5    HD1  HIS  52           HD1      HIS  52  17.560  -1.823  -9.202
    6    HD2  HIS  52           HD2      HIS  52  14.028  -1.112  -7.106
    7    HE1  HIS  52           HE1      HIS  52  15.887  -0.952 -10.892
    8    HE2  HIS  52           HE2      HIS  52  13.728  -0.512  -9.629

  No H/Q in entry =           8
  In of MODEL   50
    1    H    LEU  53           H        LEU  53  19.223  -3.987  -6.854
    2    HA   LEU  53           HA       LEU  53  19.276  -4.295  -9.655
    3    HB2  LEU  53           HB2      LEU  53  21.201  -5.083  -7.483
    4    HB3  LEU  53           HB3      LEU  53  21.513  -5.468  -9.174
    5    HG   LEU  53           HG       LEU  53  20.865  -2.654  -8.244
    6   HD11  LEU  53          HD11      LEU  53  23.539  -4.052  -8.507
    7   HD13  LEU  53          HD12      LEU  53  22.877  -3.259  -7.078
    8   HD12  LEU  53          HD13      LEU  53  23.366  -2.301  -8.470
    9   HD23  LEU  53          HD21      LEU  53  22.311  -2.226 -10.390
   10   HD22  LEU  53          HD22      LEU  53  20.628  -2.709 -10.583
   11   HD21  LEU  53          HD23      LEU  53  21.908  -3.889 -10.800

  No H/Q in entry =          11
  In of MODEL   50
    1    H    VAL  54           H        VAL  54  19.139  -6.687  -7.035
    2    HA   VAL  54           HA       VAL  54  19.238  -8.979  -8.701
    3    HB   VAL  54           HB       VAL  54  18.089  -8.551  -5.932
    4   HG12  VAL  54          HG11      VAL  54  18.387 -11.171  -5.935
    5   HG11  VAL  54          HG12      VAL  54  18.203 -10.997  -7.680
    6   HG13  VAL  54          HG13      VAL  54  16.920 -10.456  -6.599
    7   HG22  VAL  54          HG21      VAL  54  20.407  -8.364  -5.709
    8   HG21  VAL  54          HG22      VAL  54  20.733  -9.456  -7.054
    9   HG23  VAL  54          HG23      VAL  54  20.197 -10.101  -5.503

  No H/Q in entry =           9
  In of MODEL   50
    1    H    GLN  55           H        GLN  55  16.530  -7.052  -7.412
    2    HA   GLN  55           HA       GLN  55  14.492  -8.693  -8.490
    3    HB2  GLN  55           HB2      GLN  55  13.759  -7.164  -6.859
    4    HB3  GLN  55           HB3      GLN  55  14.566  -5.801  -7.632
    5    HG2  GLN  55           HG2      GLN  55  12.844  -5.456  -9.120
    6    HG3  GLN  55           HG3      GLN  55  12.505  -7.173  -9.294
    7   HE21  GLN  55          HE21      GLN  55  10.493  -7.704  -8.490
    8   HE22  GLN  55          HE22      GLN  55   9.727  -6.946  -7.179

  No H/Q in entry =           8
  In of MODEL   50
    1    H    THR  56           H        THR  56  16.258  -5.907  -9.843
    2    HA   THR  56           HA       THR  56  14.823  -5.525 -12.190
    3    HB   THR  56           HB       THR  56  17.843  -5.462 -12.012
    4    HG1  THR  56           HG1      THR  56  15.845  -3.751 -11.039
    5   HG23  THR  56          HG21      THR  56  17.218  -5.105 -14.252
    6   HG22  THR  56          HG22      THR  56  17.350  -3.471 -13.601
    7   HG21  THR  56          HG23      THR  56  15.762  -4.217 -13.797

  No H/Q in entry =           7
  In of MODEL   50
    1    H    LYS  57           H        LYS  57  17.451  -7.849 -11.585
    2    HA   LYS  57           HA       LYS  57  17.439  -9.037 -14.166
    3    HB2  LYS  57           HB2      LYS  57  19.244  -9.329 -12.471
    4    HB3  LYS  57           HB3      LYS  57  18.132 -10.250 -11.469
    5    HG2  LYS  57           HG2      LYS  57  19.498 -11.823 -12.674
    6    HG3  LYS  57           HG3      LYS  57  17.881 -11.887 -13.365
    7    HD2  LYS  57           HD2      LYS  57  18.537 -10.637 -15.284
    8    HD3  LYS  57           HD3      LYS  57  20.053 -10.136 -14.538
    9    HE2  LYS  57           HE2      LYS  57  20.882 -12.445 -14.592
   10    HE3  LYS  57           HE3      LYS  57  19.352 -13.011 -15.260
   11    HZ1  LYS  57           HZ1      LYS  57  20.315 -10.882 -16.821
   12    HZ3  LYS  57           HZ2      LYS  57  20.052 -12.498 -17.272
   13    HZ2  LYS  57           HZ3      LYS  57  21.554 -12.025 -16.637

  No H/Q in entry =          13
  In of MODEL   50
    1    H    LEU  58           H        LEU  58  15.653  -9.695 -11.191
    2    HA   LEU  58           HA       LEU  58  14.409 -12.055 -12.131
    3    HB2  LEU  58           HB2      LEU  58  13.633 -10.147  -9.930
    4    HB3  LEU  58           HB3      LEU  58  12.812 -11.677 -10.250
    5    HG   LEU  58           HG       LEU  58  15.788 -11.427  -9.696
    6   HD11  LEU  58          HD11      LEU  58  13.414 -11.827  -7.903
    7   HD13  LEU  58          HD12      LEU  58  14.876 -10.878  -7.639
    8   HD12  LEU  58          HD13      LEU  58  14.933 -12.635  -7.508
    9   HD22  LEU  58          HD21      LEU  58  15.651 -13.485 -10.728
   10   HD21  LEU  58          HD22      LEU  58  13.935 -13.680 -10.367
   11   HD23  LEU  58          HD23      LEU  58  15.142 -13.995  -9.119

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  59           H        ILE  59  13.768  -8.710 -12.806
    2    HA   ILE  59           HA       ILE  59  11.046  -9.332 -13.745
    3    HB   ILE  59           HB       ILE  59  11.873  -7.060 -12.535
    4   HG12  ILE  59          HG12      ILE  59   9.968  -6.910 -14.882
    5   HG13  ILE  59          HG13      ILE  59   9.542  -7.685 -13.378
    6   HG23  ILE  59          HG21      ILE  59  12.460  -5.338 -14.041
    7   HG22  ILE  59          HG22      ILE  59  11.958  -6.255 -15.443
    8   HG21  ILE  59          HG23      ILE  59  13.435  -6.682 -14.584
    9   HD12  ILE  59          HD11      ILE  59  10.410  -4.813 -13.698
   10   HD11  ILE  59          HD12      ILE  59  10.057  -5.587 -12.154
   11   HD13  ILE  59          HD13      ILE  59   8.773  -5.365 -13.343

  No H/Q in entry =          11
  In of MODEL   50
    1    H    GLU  60           H        GLU  60  14.257  -8.506 -15.004
    2    HA   GLU  60           HA       GLU  60  13.480  -8.093 -17.711
    3    HB2  GLU  60           HB2      GLU  60  15.627  -7.327 -17.286
    4    HB3  GLU  60           HB3      GLU  60  16.042  -8.724 -16.296
    5    HG2  GLU  60           HG2      GLU  60  17.172  -8.657 -18.570
    6    HG3  GLU  60           HG3      GLU  60  16.269 -10.133 -18.235

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLY  61           H        GLY  61  14.432 -10.987 -15.903
    2    HA3  GLY  61           HA2      GLY  61  13.874 -12.624 -18.307
    3    HA2  GLY  61           HA3      GLY  61  14.903 -13.118 -16.967

  No H/Q in entry =           3
  In of MODEL   50
    1    H    ASP  62           H        ASP  62  11.798 -11.544 -16.588
    2    HA   ASP  62           HA       ASP  62  10.854 -13.649 -14.879
    3    HB2  ASP  62           HB2      ASP  62   8.816 -12.217 -14.743
    4    HB3  ASP  62           HB3      ASP  62  10.305 -11.372 -14.331

  No H/Q in entry =           4
  In of MODEL   50
    1    H    ALA  63           H        ALA  63  10.950 -13.504 -18.204
    2    HA   ALA  63           HA       ALA  63   8.385 -14.247 -19.084
    3    HB2  ALA  63           HB1      ALA  63   9.558 -15.318 -20.982
    4    HB1  ALA  63           HB2      ALA  63  11.083 -15.167 -20.113
    5    HB3  ALA  63           HB3      ALA  63  10.216 -13.720 -20.629

  No H/Q in entry =           5
  In of MODEL   50
    1    H    GLY  64           H        GLY  64  11.074 -16.249 -17.932
    2    HA3  GLY  64           HA2      GLY  64  11.187 -18.413 -17.187
    3    HA2  GLY  64           HA3      GLY  64   9.551 -18.160 -16.595

  No H/Q in entry =           3
  In of MODEL   50
    1    H    GLU  65           H        GLU  65   8.278 -19.796 -17.249
    2    HA   GLU  65           HA       GLU  65   8.845 -21.576 -19.294
    3    HB2  GLU  65           HB2      GLU  65   6.194 -20.814 -18.078
    4    HB3  GLU  65           HB3      GLU  65   6.402 -22.161 -19.197
    5    HG2  GLU  65           HG2      GLU  65   8.012 -23.213 -17.700
    6    HG3  GLU  65           HG3      GLU  65   7.934 -21.835 -16.603

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLY  66           H        GLY  66   7.068 -22.015 -21.021
    2    HA3  GLY  66           HA2      GLY  66   7.439 -20.180 -23.131
    3    HA2  GLY  66           HA3      GLY  66   6.385 -21.579 -23.149

  No H/Q in entry =           3
  In of MODEL   50
    1    H    LYS  67           H        LYS  67   4.757 -20.707 -20.942
    2    HA   LYS  67           HA       LYS  67   2.817 -19.242 -22.377
    3    HB2  LYS  67           HB2      LYS  67   2.991 -20.074 -19.484
    4    HB3  LYS  67           HB3      LYS  67   1.564 -19.320 -20.206
    5    HG2  LYS  67           HG2      LYS  67   1.418 -21.104 -21.872
    6    HG3  LYS  67           HG3      LYS  67   2.895 -21.837 -21.253
    7    HD2  LYS  67           HD2      LYS  67   1.092 -23.086 -20.302
    8    HD3  LYS  67           HD3      LYS  67   1.692 -22.042 -19.010
    9    HE2  LYS  67           HE2      LYS  67  -0.506 -21.051 -20.801
   10    HE3  LYS  67           HE3      LYS  67  -0.896 -22.162 -19.489
   11    HZ1  LYS  67           HZ1      LYS  67   0.858 -20.048 -18.676
   12    HZ3  LYS  67           HZ2      LYS  67  -0.592 -20.584 -17.975
   13    HZ2  LYS  67           HZ3      LYS  67  -0.627 -19.472 -19.259

  No H/Q in entry =          13
  In of MODEL   50
    1    H    MET  68           H        MET  68   1.871 -17.295 -22.026
    2    HA   MET  68           HA       MET  68   3.500 -15.065 -21.762
    3    HB2  MET  68           HB2      MET  68   0.505 -15.313 -21.481
    4    HB3  MET  68           HB3      MET  68   1.370 -13.788 -21.673
    5    HG2  MET  68           HG2      MET  68   1.497 -16.100 -23.630
    6    HG3  MET  68           HG3      MET  68   0.504 -14.657 -23.839
    7    HE1  MET  68           HE1      MET  68   1.199 -12.498 -23.571
    8    HE3  MET  68           HE2      MET  68   2.506 -11.836 -24.549
    9    HE2  MET  68           HE3      MET  68   2.766 -12.137 -22.833

  No H/Q in entry =           9
  In of MODEL   50
    1    H    LYS  69           H        LYS  69   2.457 -16.980 -19.181
    2    HA   LYS  69           HA       LYS  69   1.958 -14.919 -17.266
    3    HB2  LYS  69           HB2      LYS  69   2.563 -17.849 -16.838
    4    HB3  LYS  69           HB3      LYS  69   1.924 -16.740 -15.621
    5    HG2  LYS  69           HG2      LYS  69   0.538 -17.005 -18.275
    6    HG3  LYS  69           HG3      LYS  69   0.253 -18.204 -17.013
    7    HD2  LYS  69           HD2      LYS  69  -0.381 -16.381 -15.452
    8    HD3  LYS  69           HD3      LYS  69  -0.161 -15.212 -16.756
    9    HE2  LYS  69           HE2      LYS  69  -1.879 -16.383 -18.093
   10    HE3  LYS  69           HE3      LYS  69  -2.112 -17.534 -16.778
   11    HZ1  LYS  69           HZ1      LYS  69  -2.388 -14.631 -16.334
   12    HZ3  LYS  69           HZ2      LYS  69  -3.002 -15.911 -15.404
   13    HZ2  LYS  69           HZ3      LYS  69  -3.686 -15.551 -16.916

  No H/Q in entry =          13
  In of MODEL   50
    1    H    VAL  70           H        VAL  70   3.127 -14.566 -15.224
    2    HA   VAL  70           HA       VAL  70   6.070 -14.808 -15.521
    3    HB   VAL  70           HB       VAL  70   6.225 -12.618 -14.364
    4   HG13  VAL  70          HG11      VAL  70   5.746 -11.303 -16.290
    5   HG12  VAL  70          HG12      VAL  70   4.420 -12.361 -16.773
    6   HG11  VAL  70          HG13      VAL  70   6.087 -12.916 -16.915
    7   HG22  VAL  70          HG21      VAL  70   4.249 -12.377 -13.099
    8   HG21  VAL  70          HG22      VAL  70   3.226 -12.893 -14.439
    9   HG23  VAL  70          HG23      VAL  70   3.950 -11.285 -14.451

  No H/Q in entry =           9
  In of MODEL   50
    1    H    SER  71           H        SER  71   7.216 -14.643 -13.418
    2    HA   SER  71           HA       SER  71   6.308 -16.543 -11.537
    3    HB2  SER  71           HB2      SER  71   8.704 -15.834 -11.909
    4    HB3  SER  71           HB3      SER  71   8.333 -14.349 -11.037
    5    HG   SER  71           HG       SER  71   8.358 -17.020 -10.131

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LEU  72           H        LEU  72   4.872 -16.372  -9.977
    2    HA   LEU  72           HA       LEU  72   3.344 -14.046  -9.526
    3    HB2  LEU  72           HB2      LEU  72   3.608 -16.613  -7.969
    4    HB3  LEU  72           HB3      LEU  72   2.456 -15.345  -7.556
    5    HG   LEU  72           HG       LEU  72   2.590 -16.633 -10.302
    6   HD12  LEU  72          HD11      LEU  72   0.620 -17.232  -8.079
    7   HD11  LEU  72          HD12      LEU  72   2.021 -18.243  -8.430
    8   HD13  LEU  72          HD13      LEU  72   0.754 -18.042  -9.640
    9   HD21  LEU  72          HD21      LEU  72   0.738 -14.703  -8.914
   10   HD23  LEU  72          HD22      LEU  72   0.098 -15.751 -10.170
   11   HD22  LEU  72          HD23      LEU  72   1.394 -14.618 -10.545

  No H/Q in entry =          11
  In of MODEL   50
    1    H    VAL  73           H        VAL  73   5.987 -15.512  -7.757
    2    HA   VAL  73           HA       VAL  73   5.940 -13.985  -5.420
    3    HB   VAL  73           HB       VAL  73   8.113 -14.817  -4.994
    4   HG11  VAL  73          HG11      VAL  73   6.276 -16.513  -5.155
    5   HG13  VAL  73          HG12      VAL  73   7.872 -17.182  -5.498
    6   HG12  VAL  73          HG13      VAL  73   6.763 -16.822  -6.821
    7   HG21  VAL  73          HG21      VAL  73   8.296 -14.867  -7.988
    8   HG23  VAL  73          HG22      VAL  73   9.281 -15.990  -7.054
    9   HG22  VAL  73          HG23      VAL  73   9.456 -14.252  -6.812

  No H/Q in entry =           9
  In of MODEL   50
    1    H    LEU  74           H        LEU  74   6.939 -13.091  -8.593
    2    HA   LEU  74           HA       LEU  74   8.902 -11.162  -8.094
    3    HB2  LEU  74           HB2      LEU  74   8.436 -11.903 -10.335
    4    HB3  LEU  74           HB3      LEU  74   6.779 -11.313 -10.233
    5    HG   LEU  74           HG       LEU  74   7.611  -8.999 -10.018
    6   HD12  LEU  74          HD11      LEU  74  10.119  -8.731 -10.595
    7   HD11  LEU  74          HD12      LEU  74  10.276 -10.416 -10.104
    8   HD13  LEU  74          HD13      LEU  74   9.717  -9.210  -8.947
    9   HD23  LEU  74          HD21      LEU  74   9.095 -10.103 -12.344
   10   HD22  LEU  74          HD22      LEU  74   7.954  -8.781 -12.253
   11   HD21  LEU  74          HD23      LEU  74   7.366 -10.429 -12.243

  No H/Q in entry =          11
  In of MODEL   50
    1    H    VAL  75           H        VAL  75   5.410 -10.744  -8.449
    2    HA   VAL  75           HA       VAL  75   5.339  -7.988  -7.854
    3    HB   VAL  75           HB       VAL  75   3.234 -10.119  -7.490
    4   HG13  VAL  75          HG11      VAL  75   2.767  -8.226  -5.976
    5   HG12  VAL  75          HG12      VAL  75   1.671  -8.167  -7.348
    6   HG11  VAL  75          HG13      VAL  75   3.057  -7.088  -7.288
    7   HG21  VAL  75          HG21      VAL  75   4.002  -9.666  -9.811
    8   HG23  VAL  75          HG22      VAL  75   3.666  -7.952  -9.575
    9   HG22  VAL  75          HG23      VAL  75   2.344  -9.120  -9.564

  No H/Q in entry =           9
  In of MODEL   50
    1    H    GLU  76           H        GLU  76   5.057 -10.869  -5.753
    2    HA   GLU  76           HA       GLU  76   4.597  -9.511  -3.328
    3    HB2  GLU  76           HB2      GLU  76   4.415 -11.987  -3.604
    4    HB3  GLU  76           HB3      GLU  76   6.159 -12.080  -3.777
    5    HG2  GLU  76           HG2      GLU  76   6.460 -11.219  -1.494
    6    HG3  GLU  76           HG3      GLU  76   4.725 -11.066  -1.290

  No H/Q in entry =           6
  In of MODEL   50
    1    H    ALA  77           H        ALA  77   7.650 -10.442  -4.890
    2    HA   ALA  77           HA       ALA  77   9.346  -9.420  -2.869
    3    HB1  ALA  77           HB1      ALA  77  10.043 -10.975  -4.711
    4    HB2  ALA  77           HB2      ALA  77  11.119  -9.596  -4.495
    5    HB3  ALA  77           HB3      ALA  77   9.963  -9.611  -5.825

  No H/Q in entry =           5
  In of MODEL   50
    1    H    GLN  78           H        GLN  78   7.971  -7.981  -5.781
    2    HA   GLN  78           HA       GLN  78   9.348  -5.515  -5.668
    3    HB2  GLN  78           HB2      GLN  78   8.047  -6.409  -7.630
    4    HB3  GLN  78           HB3      GLN  78   6.566  -6.025  -6.756
    5    HG2  GLN  78           HG2      GLN  78   7.229  -3.660  -6.655
    6    HG3  GLN  78           HG3      GLN  78   8.721  -4.035  -7.515
    7   HE21  GLN  78          HE21      GLN  78   6.819  -2.199  -8.615
    8   HE22  GLN  78          HE22      GLN  78   6.136  -2.903 -10.001

  No H/Q in entry =           8
  In of MODEL   50
    1    H    LEU  79           H        LEU  79   6.315  -6.628  -4.245
    2    HA   LEU  79           HA       LEU  79   5.344  -4.214  -3.231
    3    HB2  LEU  79           HB2      LEU  79   4.009  -6.252  -3.183
    4    HB3  LEU  79           HB3      LEU  79   5.145  -7.006  -2.068
    5    HG   LEU  79           HG       LEU  79   4.606  -5.364  -0.337
    6   HD13  LEU  79          HD11      LEU  79   4.162  -3.342  -1.383
    7   HD12  LEU  79          HD12      LEU  79   2.531  -3.852  -0.948
    8   HD11  LEU  79          HD13      LEU  79   3.112  -4.076  -2.596
    9   HD23  LEU  79          HD21      LEU  79   2.014  -5.830  -0.253
   10   HD22  LEU  79          HD22      LEU  79   3.140  -7.181  -0.146
   11   HD21  LEU  79          HD23      LEU  79   2.333  -6.832  -1.672

  No H/Q in entry =          11
  In of MODEL   50
    1    H    HIS  80           H        HIS  80   7.500  -6.575  -1.651
    2    HA   HIS  80           HA       HIS  80   7.799  -5.043   0.723
    3    HB2  HIS  80           HB2      HIS  80   9.115  -7.417  -0.480
    4    HB3  HIS  80           HB3      HIS  80  10.033  -6.533   0.741
    5    HD1  HIS  80           HD1      HIS  80   9.531  -7.171   3.081
    6    HD2  HIS  80           HD2      HIS  80   6.311  -7.981   0.561
    7    HE1  HIS  80           HE1      HIS  80   7.745  -8.260   4.523
    8    HE2  HIS  80           HE2      HIS  80   5.776  -8.758   2.995

  No H/Q in entry =           8
  In of MODEL   50
    1    H    LEU  81           H        LEU  81   9.807  -5.331  -2.186
    2    HA   LEU  81           HA       LEU  81  11.868  -3.614  -1.298
    3    HB2  LEU  81           HB2      LEU  81  10.944  -4.389  -4.065
    4    HB3  LEU  81           HB3      LEU  81  12.374  -3.399  -3.769
    5    HG   LEU  81           HG       LEU  81  11.950  -6.119  -2.504
    6   HD12  LEU  81          HD11      LEU  81  13.763  -6.760  -4.252
    7   HD11  LEU  81          HD12      LEU  81  13.214  -5.327  -5.121
    8   HD13  LEU  81          HD13      LEU  81  12.088  -6.641  -4.789
    9   HD23  LEU  81          HD21      LEU  81  14.582  -5.832  -2.484
   10   HD22  LEU  81          HD22      LEU  81  13.605  -5.065  -1.233
   11   HD21  LEU  81          HD23      LEU  81  14.197  -4.115  -2.596

  No H/Q in entry =          11
  In of MODEL   50
    1    H    MET  82           H        MET  82   8.956  -2.941  -3.239
    2    HA   MET  82           HA       MET  82   9.527  -0.220  -3.731
    3    HB2  MET  82           HB2      MET  82   6.950  -1.786  -3.616
    4    HB3  MET  82           HB3      MET  82   6.969  -0.061  -3.975
    5    HG2  MET  82           HG2      MET  82   8.550  -2.147  -5.513
    6    HG3  MET  82           HG3      MET  82   6.991  -1.506  -6.027
    7    HE3  MET  82           HE1      MET  82   7.480   1.947  -7.188
    8    HE2  MET  82           HE2      MET  82   7.099   1.720  -5.483
    9    HE1  MET  82           HE3      MET  82   6.425   0.621  -6.682

  No H/Q in entry =           9
  In of MODEL   50
    1    H    THR  83           H        THR  83   7.711  -1.806  -1.135
    2    HA   THR  83           HA       THR  83   6.883   0.548   0.197
    3    HB   THR  83           HB       THR  83   6.727  -1.031   2.210
    4    HG1  THR  83           HG1      THR  83   7.463  -2.988   1.976
    5   HG22  THR  83          HG21      THR  83   5.060  -2.574   0.734
    6   HG21  THR  83          HG22      THR  83   5.304  -1.244  -0.394
    7   HG23  THR  83          HG23      THR  83   4.663  -0.927   1.218

  No H/Q in entry =           7
  In of MODEL   50
    1    H    SER  84           H        SER  84   9.682  -1.583   0.718
    2    HA   SER  84           HA       SER  84  10.753  -0.171   2.913
    3    HB2  SER  84           HB2      SER  84  11.990  -2.022   0.885
    4    HB3  SER  84           HB3      SER  84  12.942  -1.283   2.171
    5    HG   SER  84           HG       SER  84  10.647  -2.947   2.420

  No H/Q in entry =           5
  In of MODEL   50
    1    H    MET  85           H        MET  85  11.517   0.092  -0.573
    2    HA   MET  85           HA       MET  85  13.537   2.033  -0.311
    3    HB2  MET  85           HB2      MET  85  13.130   0.761  -2.382
    4    HB3  MET  85           HB3      MET  85  11.615   1.634  -2.612
    5    HG2  MET  85           HG2      MET  85  12.834   3.762  -2.738
    6    HG3  MET  85           HG3      MET  85  14.354   2.922  -2.451
    7    HE3  MET  85           HE1      MET  85  11.295   1.695  -5.042
    8    HE2  MET  85           HE2      MET  85  11.687   3.046  -6.102
    9    HE1  MET  85           HE3      MET  85  11.300   3.351  -4.415

  No H/Q in entry =           9
  In of MODEL   50
    1    H    LEU  86           H        LEU  86  10.053   2.410  -0.827
    2    HA   LEU  86           HA       LEU  86  10.022   5.224  -1.001
    3    HB2  LEU  86           HB2      LEU  86   8.160   3.588  -1.586
    4    HB3  LEU  86           HB3      LEU  86   7.825   3.497   0.143
    5    HG   LEU  86           HG       LEU  86   7.695   6.059   0.098
    6   HD11  LEU  86          HD11      LEU  86   8.472   5.622  -2.604
    7   HD13  LEU  86          HD12      LEU  86   8.052   7.152  -1.840
    8   HD12  LEU  86          HD13      LEU  86   6.806   6.207  -2.650
    9   HD23  LEU  86          HD21      LEU  86   5.549   4.737  -1.574
   10   HD22  LEU  86          HD22      LEU  86   5.371   5.995  -0.354
   11   HD21  LEU  86          HD23      LEU  86   5.750   4.345   0.135

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ALA  87           H        ALA  87   9.524   3.043   1.738
    2    HA   ALA  87           HA       ALA  87   8.994   4.958   3.711
    3    HB1  ALA  87           HB1      ALA  87   9.768   2.128   3.619
    4    HB3  ALA  87           HB2      ALA  87   8.650   2.951   4.704
    5    HB2  ALA  87           HB3      ALA  87  10.378   2.960   5.052

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ARG  88           H        ARG  88  12.062   3.499   2.733
    2    HA   ARG  88           HA       ARG  88  13.684   4.852   4.573
    3    HB2  ARG  88           HB2      ARG  88  14.332   2.875   3.165
    4    HB3  ARG  88           HB3      ARG  88  14.500   3.970   1.796
    5    HG2  ARG  88           HG2      ARG  88  15.985   5.260   3.749
    6    HG3  ARG  88           HG3      ARG  88  16.285   3.566   4.124
    7    HD2  ARG  88           HD2      ARG  88  17.552   3.260   2.279
    8    HD3  ARG  88           HD3      ARG  88  16.428   4.148   1.246
    9    HE   ARG  88           HE       ARG  88  18.833   5.179   2.301
   10   HH21  ARG  88          HH11      ARG  88  19.205   7.394   2.114
   11   HH22  ARG  88          HH12      ARG  88  17.868   8.483   1.971
   12   HH11  ARG  88          HH21      ARG  88  15.504   5.974   2.019
   13   HH12  ARG  88          HH22      ARG  88  15.770   7.676   1.893

  No H/Q in entry =          13
  In of MODEL   50
    1    H    GLU  89           H        GLU  89  12.729   5.772   1.250
    2    HA   GLU  89           HA       GLU  89  14.304   8.113   1.104
    3    HB2  GLU  89           HB2      GLU  89  13.152   7.092  -0.849
    4    HB3  GLU  89           HB3      GLU  89  11.612   7.650  -0.193
    5    HG2  GLU  89           HG2      GLU  89  12.343   9.979  -0.347
    6    HG3  GLU  89           HG3      GLU  89  13.942   9.471  -0.882

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LEU  90           H        LEU  90  10.967   7.641   2.226
    2    HA   LEU  90           HA       LEU  90  10.484  10.378   2.808
    3    HB2  LEU  90           HB2      LEU  90   9.256   7.816   3.825
    4    HB3  LEU  90           HB3      LEU  90   8.644   9.418   4.252
    5    HG   LEU  90           HG       LEU  90   9.057   8.541   1.381
    6   HD12  LEU  90          HD11      LEU  90   6.519   8.243   1.437
    7   HD11  LEU  90          HD12      LEU  90   6.670   8.226   3.194
    8   HD13  LEU  90          HD13      LEU  90   7.476   6.989   2.228
    9   HD22  LEU  90          HD21      LEU  90   8.791  10.853   1.314
   10   HD21  LEU  90          HD22      LEU  90   7.802  10.893   2.772
   11   HD23  LEU  90          HD23      LEU  90   7.101  10.351   1.248

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  91           H        ILE  91  11.710   7.676   4.725
    2    HA   ILE  91           HA       ILE  91  11.863   9.032   7.197
    3    HB   ILE  91           HB       ILE  91  13.390   6.678   6.070
    4   HG12  ILE  91          HG12      ILE  91  11.372   6.863   8.326
    5   HG13  ILE  91          HG13      ILE  91  10.901   6.593   6.648
    6   HG22  ILE  91          HG21      ILE  91  13.853   6.451   8.710
    7   HG21  ILE  91          HG22      ILE  91  13.798   8.211   8.615
    8   HG23  ILE  91          HG23      ILE  91  14.968   7.312   7.649
    9   HD13  ILE  91          HD11      ILE  91  11.879   4.479   6.574
   10   HD12  ILE  91          HD12      ILE  91  11.283   4.540   8.233
   11   HD11  ILE  91          HD13      ILE  91  12.989   4.834   7.898

  No H/Q in entry =          11
  In of MODEL   50
    1    H    THR  92           H        THR  92  14.082   8.845   4.449
    2    HA   THR  92           HA       THR  92  16.262  10.208   5.617
    3    HB   THR  92           HB       THR  92  15.280  10.103   2.754
    4    HG1  THR  92           HG1      THR  92  16.088   8.195   3.155
    5   HG22  THR  92          HG21      THR  92  17.859  10.764   2.467
    6   HG21  THR  92          HG22      THR  92  17.557  11.584   3.998
    7   HG23  THR  92          HG23      THR  92  16.595  11.987   2.577

  No H/Q in entry =           7
  In of MODEL   50
    1    H    GLU  93           H        GLU  93  13.392  11.401   3.886
    2    HA   GLU  93           HA       GLU  93  14.020  14.154   4.010
    3    HB2  GLU  93           HB2      GLU  93  11.299  12.814   4.015
    4    HB3  GLU  93           HB3      GLU  93  11.608  14.511   3.649
    5    HG2  GLU  93           HG2      GLU  93  12.922  12.258   2.116
    6    HG3  GLU  93           HG3      GLU  93  11.385  12.960   1.629

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LEU  94           H        LEU  94  12.247  12.012   6.211
    2    HA   LEU  94           HA       LEU  94  11.458  13.963   8.092
    3    HB2  LEU  94           HB2      LEU  94  11.998  11.000   8.358
    4    HB3  LEU  94           HB3      LEU  94  11.436  11.979   9.710
    5    HG   LEU  94           HG       LEU  94   9.957  12.056   7.079
    6   HD11  LEU  94          HD11      LEU  94  10.010   9.828   9.077
    7   HD13  LEU  94          HD12      LEU  94   9.710   9.775   7.341
    8   HD12  LEU  94          HD13      LEU  94   8.436  10.304   8.439
    9   HD23  LEU  94          HD21      LEU  94   8.040  12.474   8.677
   10   HD22  LEU  94          HD22      LEU  94   9.293  13.713   8.720
   11   HD21  LEU  94          HD23      LEU  94   9.214  12.493   9.991

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  95           H        ILE  95  14.409  11.999   7.854
    2    HA   ILE  95           HA       ILE  95  15.584  12.899  10.273
    3    HB   ILE  95           HB       ILE  95  16.814  11.823   7.723
    4   HG12  ILE  95          HG12      ILE  95  16.499  10.618  10.487
    5   HG13  ILE  95          HG13      ILE  95  15.332  10.377   9.189
    6   HG21  ILE  95          HG21      ILE  95  18.074  12.607  10.370
    7   HG23  ILE  95          HG22      ILE  95  18.546  13.134   8.753
    8   HG22  ILE  95          HG23      ILE  95  18.831  11.469   9.257
    9   HD13  ILE  95          HD11      ILE  95  16.798   9.085   7.924
   10   HD12  ILE  95          HD12      ILE  95  17.263   8.625   9.560
   11   HD11  ILE  95          HD13      ILE  95  18.232   9.796   8.666

  No H/Q in entry =          11
  In of MODEL   50
    1    H    GLU  96           H        GLU  96  15.758  14.141   6.942
    2    HA   GLU  96           HA       GLU  96  17.629  16.196   7.428
    3    HB2  GLU  96           HB2      GLU  96  16.960  15.548   5.166
    4    HB3  GLU  96           HB3      GLU  96  15.323  16.124   5.465
    5    HG2  GLU  96           HG2      GLU  96  15.916  18.248   4.931
    6    HG3  GLU  96           HG3      GLU  96  17.213  18.229   6.115

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LEU  97           H        LEU  97  14.115  16.050   7.852
    2    HA   LEU  97           HA       LEU  97  13.731  18.786   8.501
    3    HB2  LEU  97           HB2      LEU  97  12.181  16.277   9.105
    4    HB3  LEU  97           HB3      LEU  97  11.686  17.828   9.781
    5    HG   LEU  97           HG       LEU  97  12.168  17.415   6.815
    6   HD12  LEU  97          HD11      LEU  97   9.644  17.318   6.693
    7   HD11  LEU  97          HD12      LEU  97   9.632  17.113   8.443
    8   HD13  LEU  97          HD13      LEU  97  10.400  15.899   7.418
    9   HD23  LEU  97          HD21      LEU  97  10.454  19.400   6.851
   10   HD22  LEU  97          HD22      LEU  97  12.139  19.738   7.247
   11   HD21  LEU  97          HD23      LEU  97  10.946  19.578   8.535

  No H/Q in entry =          11
  In of MODEL   50
    1    H    HIS  98           H        HIS  98  14.515  15.944  10.489
    2    HA   HIS  98           HA       HIS  98  14.369  17.199  13.009
    3    HB2  HIS  98           HB2      HIS  98  16.093  14.924  12.003
    4    HB3  HIS  98           HB3      HIS  98  16.095  15.457  13.686
    5    HD1  HIS  98           HD1      HIS  98  13.880  13.862  11.086
    6    HD2  HIS  98           HD2      HIS  98  13.778  14.771  15.153
    7    HE1  HIS  98           HE1      HIS  98  11.839  12.690  12.032
    8    HE2  HIS  98           HE2      HIS  98  11.757  13.235  14.504

  No H/Q in entry =           8
  In of MODEL   50
    1    H    GLU  99           H        GLU  99  16.924  17.061  10.578
    2    HA   GLU  99           HA       GLU  99  18.924  18.363  12.114
    3    HB2  GLU  99           HB2      GLU  99  19.390  17.076  10.041
    4    HB3  GLU  99           HB3      GLU  99  18.597  18.344   9.103
    5    HG2  GLU  99           HG2      GLU  99  20.224  19.992   9.901
    6    HG3  GLU  99           HG3      GLU  99  20.987  18.777  10.921

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LYS 100           H        LYS 100  16.417  19.563   9.897
    2    HA   LYS 100           HA       LYS 100  17.248  22.290  10.051
    3    HB2  LYS 100           HB2      LYS 100  14.601  21.036   9.289
    4    HB3  LYS 100           HB3      LYS 100  14.922  22.771   9.204
    5    HG2  LYS 100           HG2      LYS 100  16.890  22.302   7.739
    6    HG3  LYS 100           HG3      LYS 100  16.456  20.591   7.750
    7    HD2  LYS 100           HD2      LYS 100  14.268  21.131   6.749
    8    HD3  LYS 100           HD3      LYS 100  14.686  22.845   6.744
    9    HE2  LYS 100           HE2      LYS 100  16.641  22.344   5.286
   10    HE3  LYS 100           HE3      LYS 100  16.155  20.645   5.246
   11    HZ1  LYS 100           HZ1      LYS 100  14.359  22.864   4.416
   12    HZ3  LYS 100           HZ2      LYS 100  14.154  21.197   4.148
   13    HZ2  LYS 100           HZ3      LYS 100  15.376  22.047   3.331

  No H/Q in entry =          13
  In of MODEL   50
    1    H    LEU 101           H        LEU 101  15.123  20.264  12.007
    2    HA   LEU 101           HA       LEU 101  13.981  22.342  13.590
    3    HB2  LEU 101           HB2      LEU 101  14.385  19.386  13.965
    4    HB3  LEU 101           HB3      LEU 101  13.859  20.368  15.328
    5    HG   LEU 101           HG       LEU 101  12.446  20.483  12.658
    6   HD12  LEU 101          HD11      LEU 101  10.766  18.937  13.919
    7   HD11  LEU 101          HD12      LEU 101  12.153  18.503  14.915
    8   HD13  LEU 101          HD13      LEU 101  12.185  18.201  13.177
    9   HD21  LEU 101          HD21      LEU 101  11.796  21.275  15.512
   10   HD23  LEU 101          HD22      LEU 101  10.533  21.070  14.299
   11   HD22  LEU 101          HD23      LEU 101  11.784  22.290  14.067

  No H/Q in entry =          11
  In of MODEL   50
    1    H    LYS 102           H        LYS 102  17.121  21.696  13.156
    2    HA   LYS 102           HA       LYS 102  18.977  22.539  14.233
    3    HB2  LYS 102           HB2      LYS 102  17.180  24.074  15.369
    4    HB3  LYS 102           HB3      LYS 102  17.372  23.004  16.743
    5    HG2  LYS 102           HG2      LYS 102  19.292  24.995  15.583
    6    HG3  LYS 102           HG3      LYS 102  18.904  24.680  17.260
    7    HD2  LYS 102           HD2      LYS 102  20.549  22.751  15.570
    8    HD3  LYS 102           HD3      LYS 102  21.254  24.062  16.508
    9    HE2  LYS 102           HE2      LYS 102  20.822  21.515  17.468
   10    HE3  LYS 102           HE3      LYS 102  21.057  22.951  18.464
   11    HZ2  LYS 102           HZ1      LYS 102  19.072  21.690  19.076
   12    HZ1  LYS 102           HZ2      LYS 102  18.433  21.934  17.527
   13    HZ3  LYS 102           HZ3      LYS 102  18.679  23.257  18.557

  No H/Q in entry =          13
  In of MODEL   50
    1    H    ALA 103           H        ALA 103  16.881  20.953  16.647
    2    HA   ALA 103           HA       ALA 103  18.590  19.715  18.301
    3    HB2  ALA 103           HB1      ALA 103  16.980  17.728  18.286
    4    HB1  ALA 103           HB2      ALA 103  16.097  18.597  17.030
    5    HB3  ALA 103           HB3      ALA 103  16.283  19.310  18.632

  No H/Q in entry =           5
  In of MODEL   50
    1    H1   ALA   1           H3       ALA   1  -1.632  -6.751 -21.432
    2    H2   ALA   1           H2       ALA   1  -2.446  -8.177 -20.985
    3    H3   ALA   1           H1       ALA   1  -0.839  -8.246 -21.538
    4    HA   ALA   1           HA       ALA   1  -1.676  -8.698 -23.537
    5    HB1  ALA   1           HB1      ALA   1  -3.823  -9.389 -23.069
    6    HB2  ALA   1           HB2      ALA   1  -4.240  -7.870 -23.862
    7    HB3  ALA   1           HB3      ALA   1  -4.183  -7.957 -22.103

  No H/Q in entry =           7
  In of MODEL   50
    1    H    GLU   2           H        GLU   2  -2.487  -7.490 -25.523
    2    HA   GLU   2           HA       GLU   2  -1.060  -5.492 -26.392
    3    HB2  GLU   2           HB2      GLU   2  -4.067  -5.517 -26.714
    4    HB3  GLU   2           HB3      GLU   2  -2.934  -4.666 -27.759
    5    HG2  GLU   2           HG2      GLU   2  -2.454  -6.559 -28.920
    6    HG3  GLU   2           HG3      GLU   2  -2.171  -7.473 -27.445

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLU   3           H        GLU   3  -4.205  -4.196 -25.492
    2    HA   GLU   3           HA       GLU   3  -3.125  -1.656 -24.854
    3    HB2  GLU   3           HB2      GLU   3  -5.831  -2.936 -24.530
    4    HB3  GLU   3           HB3      GLU   3  -5.512  -1.327 -23.878
    5    HG2  GLU   3           HG2      GLU   3  -5.140  -0.397 -26.000
    6    HG3  GLU   3           HG3      GLU   3  -4.765  -1.955 -26.730

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LEU   4           H        LEU   4  -4.750  -4.001 -22.684
    2    HA   LEU   4           HA       LEU   4  -4.373  -2.786 -20.289
    3    HB2  LEU   4           HB2      LEU   4  -3.869  -5.732 -20.767
    4    HB3  LEU   4           HB3      LEU   4  -4.267  -4.986 -19.222
    5    HG   LEU   4           HG       LEU   4  -6.037  -5.027 -21.689
    6   HD13  LEU   4          HD11      LEU   4  -7.254  -6.732 -20.699
    7   HD12  LEU   4          HD12      LEU   4  -6.766  -6.285 -19.065
    8   HD11  LEU   4          HD13      LEU   4  -5.640  -7.139 -20.118
    9   HD23  LEU   4          HD21      LEU   4  -7.713  -4.200 -19.821
   10   HD22  LEU   4          HD22      LEU   4  -6.658  -3.040 -20.626
   11   HD21  LEU   4          HD23      LEU   4  -6.242  -3.641 -19.021

  No H/Q in entry =          11
  In of MODEL   50
    1    H    GLU   5           H        GLU   5  -1.897  -4.656 -22.022
    2    HA   GLU   5           HA       GLU   5   0.087  -4.406 -19.981
    3    HB2  GLU   5           HB2      GLU   5   0.120  -6.168 -21.751
    4    HB3  GLU   5           HB3      GLU   5   0.477  -4.919 -22.944
    5    HG2  GLU   5           HG2      GLU   5   2.572  -5.913 -22.290
    6    HG3  GLU   5           HG3      GLU   5   2.506  -4.306 -21.569

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLU   6           H        GLU   6  -0.521  -2.674 -23.021
    2    HA   GLU   6           HA       GLU   6   1.674  -0.873 -22.744
    3    HB2  GLU   6           HB2      GLU   6   0.533  -1.339 -24.906
    4    HB3  GLU   6           HB3      GLU   6  -0.899  -0.506 -24.300
    5    HG2  GLU   6           HG2      GLU   6   0.359   1.080 -25.612
    6    HG3  GLU   6           HG3      GLU   6   0.548   1.526 -23.917

  No H/Q in entry =           6
  In of MODEL   50
    1    H    VAL   7           H        VAL   7  -1.667  -0.902 -21.704
    2    HA   VAL   7           HA       VAL   7  -1.853   1.810 -20.859
    3    HB   VAL   7           HB       VAL   7  -3.351  -0.691 -20.033
    4   HG11  VAL   7          HG11      VAL   7  -3.688   2.200 -19.210
    5   HG13  VAL   7          HG12      VAL   7  -3.609   0.771 -18.179
    6   HG12  VAL   7          HG13      VAL   7  -5.036   1.063 -19.173
    7   HG21  VAL   7          HG21      VAL   7  -3.489   0.396 -22.418
    8   HG23  VAL   7          HG22      VAL   7  -4.419   1.655 -21.603
    9   HG22  VAL   7          HG23      VAL   7  -4.987  -0.015 -21.583

  No H/Q in entry =           9
  In of MODEL   50
    1    H    VAL   8           H        VAL   8  -0.909  -1.194 -19.224
    2    HA   VAL   8           HA       VAL   8  -0.580  -0.128 -16.625
    3    HB   VAL   8           HB       VAL   8   0.796  -2.457 -17.986
    4   HG12  VAL   8          HG11      VAL   8   1.272  -3.153 -15.592
    5   HG11  VAL   8          HG12      VAL   8   0.801  -1.525 -15.103
    6   HG13  VAL   8          HG13      VAL   8   2.196  -1.761 -16.156
    7   HG23  VAL   8          HG21      VAL   8  -1.191  -2.868 -15.803
    8   HG22  VAL   8          HG22      VAL   8  -0.990  -3.743 -17.317
    9   HG21  VAL   8          HG23      VAL   8  -1.859  -2.213 -17.297

  No H/Q in entry =           9
  In of MODEL   50
    1    H    MET   9           H        MET   9   1.669  -0.450 -19.370
    2    HA   MET   9           HA       MET   9   3.967   0.557 -18.101
    3    HB2  MET   9           HB2      MET   9   3.026   0.619 -20.968
    4    HB3  MET   9           HB3      MET   9   4.556   1.344 -20.481
    5    HG2  MET   9           HG2      MET   9   5.297  -0.808 -19.548
    6    HG3  MET   9           HG3      MET   9   3.755  -1.541 -19.996
    7    HE1  MET   9           HE1      MET   9   6.623   0.514 -21.015
    8    HE3  MET   9           HE2      MET   9   7.045   0.098 -22.674
    9    HE2  MET   9           HE3      MET   9   7.454  -1.006 -21.364

  No H/Q in entry =           9
  In of MODEL   50
    1    H    GLY  10           H        GLY  10   1.308   2.203 -19.777
    2    HA3  GLY  10           HA2      GLY  10   2.309   4.841 -19.522
    3    HA2  GLY  10           HA3      GLY  10   0.613   4.406 -19.730

  No H/Q in entry =           3
  In of MODEL   50
    1    H    LEU  11           H        LEU  11   0.189   2.877 -17.450
    2    HA   LEU  11           HA       LEU  11  -0.315   4.854 -15.484
    3    HB2  LEU  11           HB2      LEU  11  -0.291   1.837 -15.339
    4    HB3  LEU  11           HB3      LEU  11  -0.787   2.863 -13.993
    5    HG   LEU  11           HG       LEU  11  -2.021   3.004 -16.757
    6   HD13  LEU  11          HD11      LEU  11  -2.637   0.867 -16.011
    7   HD12  LEU  11          HD12      LEU  11  -3.973   1.877 -15.463
    8   HD11  LEU  11          HD13      LEU  11  -2.725   1.374 -14.323
    9   HD22  LEU  11          HD21      LEU  11  -2.583   5.025 -15.744
   10   HD21  LEU  11          HD22      LEU  11  -2.520   4.352 -14.116
   11   HD23  LEU  11          HD23      LEU  11  -3.899   4.010 -15.160

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  12           H        ILE  12   2.192   2.352 -15.733
    2    HA   ILE  12           HA       ILE  12   3.403   2.862 -13.226
    3    HB   ILE  12           HB       ILE  12   4.646   1.815 -15.791
    4   HG12  ILE  12          HG12      ILE  12   2.611   0.609 -14.660
    5   HG13  ILE  12          HG13      ILE  12   3.998  -0.346 -15.144
    6   HG21  ILE  12          HG21      ILE  12   5.610   1.726 -12.913
    7   HG23  ILE  12          HG22      ILE  12   6.402   2.520 -14.272
    8   HG22  ILE  12          HG23      ILE  12   6.303   0.761 -14.214
    9   HD12  ILE  12          HD11      ILE  12   3.123  -0.885 -12.861
   10   HD11  ILE  12          HD12      ILE  12   3.542   0.753 -12.359
   11   HD13  ILE  12          HD13      ILE  12   4.798  -0.362 -12.853

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  13           H        ILE  13   4.026   4.129 -16.478
    2    HA   ILE  13           HA       ILE  13   6.188   5.814 -15.745
    3    HB   ILE  13           HB       ILE  13   4.159   5.941 -17.990
    4   HG12  ILE  13          HG12      ILE  13   5.927   4.050 -17.740
    5   HG13  ILE  13          HG13      ILE  13   5.748   4.835 -19.304
    6   HG23  ILE  13          HG21      ILE  13   4.826   8.145 -18.048
    7   HG22  ILE  13          HG22      ILE  13   6.142   7.444 -18.983
    8   HG21  ILE  13          HG23      ILE  13   6.379   7.819 -17.277
    9   HD12  ILE  13          HD11      ILE  13   8.161   4.505 -18.133
   10   HD11  ILE  13          HD12      ILE  13   7.705   6.045 -17.414
   11   HD13  ILE  13          HD13      ILE  13   7.790   5.886 -19.164

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ASN  14           H        ASN  14   2.689   6.362 -16.014
    2    HA   ASN  14           HA       ASN  14   2.686   9.106 -15.367
    3    HB2  ASN  14           HB2      ASN  14   0.770   7.495 -16.205
    4    HB3  ASN  14           HB3      ASN  14   0.444   7.315 -14.485
    5   HD21  ASN  14          HD21      ASN  14  -1.557   8.506 -15.915
    6   HD22  ASN  14          HD22      ASN  14  -1.595  10.179 -15.642

  No H/Q in entry =           6
  In of MODEL   50
    1    H    SER  15           H        SER  15   2.347   6.226 -13.301
    2    HA   SER  15           HA       SER  15   2.059   7.592 -10.848
    3    HB2  SER  15           HB2      SER  15   2.581   5.494  -9.806
    4    HB3  SER  15           HB3      SER  15   1.739   5.094 -11.299
    5    HG   SER  15           HG       SER  15   3.461   4.067 -11.875

  No H/Q in entry =           5
  In of MODEL   50
    1    H    GLY  16           H        GLY  16   4.919   6.460 -12.609
    2    HA3  GLY  16           HA2      GLY  16   6.854   7.181 -10.674
    3    HA2  GLY  16           HA3      GLY  16   7.155   6.981 -12.398

  No H/Q in entry =           3
  In of MODEL   50
    1    H    GLN  17           H        GLN  17   5.495   8.966 -13.455
    2    HA   GLN  17           HA       GLN  17   7.105  11.284 -13.137
    3    HB2  GLN  17           HB2      GLN  17   5.793  10.847 -15.185
    4    HB3  GLN  17           HB3      GLN  17   4.299  11.048 -14.268
    5    HG2  GLN  17           HG2      GLN  17   4.938  13.367 -13.723
    6    HG3  GLN  17           HG3      GLN  17   6.430  13.171 -14.642
    7   HE21  GLN  17          HE21      GLN  17   6.270  14.000 -16.725
    8   HE22  GLN  17          HE22      GLN  17   4.843  14.059 -17.643

  No H/Q in entry =           8
  In of MODEL   50
    1    H    ALA  18           H        ALA  18   3.990  10.305 -11.794
    2    HA   ALA  18           HA       ALA  18   3.296  12.699 -10.520
    3    HB1  ALA  18           HB1      ALA  18   2.134  10.258 -10.752
    4    HB2  ALA  18           HB2      ALA  18   1.601  11.482  -9.601
    5    HB3  ALA  18           HB3      ALA  18   2.673  10.183  -9.075

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ARG  19           H        ARG  19   5.131   9.906  -9.250
    2    HA   ARG  19           HA       ARG  19   5.677  11.047  -6.723
    3    HB2  ARG  19           HB2      ARG  19   6.060   8.641  -7.258
    4    HB3  ARG  19           HB3      ARG  19   7.423   9.113  -8.277
    5    HG2  ARG  19           HG2      ARG  19   8.555  10.130  -6.350
    6    HG3  ARG  19           HG3      ARG  19   7.173   9.757  -5.321
    7    HD2  ARG  19           HD2      ARG  19   8.913   8.097  -4.967
    8    HD3  ARG  19           HD3      ARG  19   7.529   7.336  -5.757
    9    HE   ARG  19           HE       ARG  19   9.246   8.140  -7.800
   10   HH21  ARG  19          HH11      ARG  19  10.789   6.717  -8.654
   11   HH22  ARG  19          HH12      ARG  19  11.315   5.359  -7.723
   12   HH11  ARG  19          HH21      ARG  19   9.289   6.099  -5.029
   13   HH12  ARG  19          HH22      ARG  19  10.463   5.008  -5.669

  No H/Q in entry =          13
  In of MODEL   50
    1    H    SER  20           H        SER  20   7.498  11.064  -9.770
    2    HA   SER  20           HA       SER  20   9.760  12.447  -8.940
    3    HB2  SER  20           HB2      SER  20   9.788  11.582 -11.146
    4    HB3  SER  20           HB3      SER  20   8.294  12.410 -11.571
    5    HG   SER  20           HG       SER  20  10.832  13.559 -11.028

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LEU  21           H        LEU  21   6.678  13.760 -10.135
    2    HA   LEU  21           HA       LEU  21   7.383  16.496  -9.900
    3    HB2  LEU  21           HB2      LEU  21   4.697  15.107  -9.825
    4    HB3  LEU  21           HB3      LEU  21   4.887  16.858  -9.827
    5    HG   LEU  21           HG       LEU  21   6.058  15.050 -11.960
    6   HD12  LEU  21          HD11      LEU  21   4.154  15.954 -13.363
    7   HD11  LEU  21          HD12      LEU  21   3.437  16.567 -11.873
    8   HD13  LEU  21          HD13      LEU  21   3.663  14.832 -12.092
    9   HD22  LEU  21          HD21      LEU  21   7.234  17.066 -12.131
   10   HD21  LEU  21          HD22      LEU  21   5.886  18.036 -11.548
   11   HD23  LEU  21          HD23      LEU  21   5.866  17.406 -13.186

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ALA  22           H        ALA  22   5.841  14.218  -7.661
    2    HA   ALA  22           HA       ALA  22   5.258  16.026  -5.588
    3    HB3  ALA  22           HB1      ALA  22   4.469  13.643  -5.761
    4    HB2  ALA  22           HB2      ALA  22   5.061  14.102  -4.164
    5    HB1  ALA  22           HB3      ALA  22   6.074  13.135  -5.237

  No H/Q in entry =           5
  In of MODEL   50
    1    H    TYR  23           H        TYR  23   8.168  13.967  -6.032
    2    HA   TYR  23           HA       TYR  23   9.561  14.961  -3.774
    3    HB2  TYR  23           HB2      TYR  23  10.324  12.948  -4.942
    4    HB3  TYR  23           HB3      TYR  23  10.654  13.891  -6.395
    5    HD1  TYR  23           HD1      TYR  23  11.602  13.521  -2.802
    6    HD2  TYR  23           HD2      TYR  23  12.704  15.038  -6.668
    7    HE1  TYR  23           HE1      TYR  23  13.865  14.065  -1.944
    8    HE2  TYR  23           HE2      TYR  23  14.966  15.583  -5.809
    9    HH   TYR  23           HH       TYR  23  15.983  14.616  -2.571

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ALA  24           H        ALA  24   9.394  16.082  -7.137
    2    HA   ALA  24           HA       ALA  24  11.313  18.145  -6.882
    3    HB2  ALA  24           HB1      ALA  24  10.873  18.219  -9.091
    4    HB3  ALA  24           HB2      ALA  24   9.326  18.985  -8.730
    5    HB1  ALA  24           HB3      ALA  24   9.432  17.231  -8.866

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ALA  25           H        ALA  25   7.832  17.997  -6.264
    2    HA   ALA  25           HA       ALA  25   7.381  20.718  -5.686
    3    HB1  ALA  25           HB1      ALA  25   5.699  18.738  -5.895
    4    HB2  ALA  25           HB2      ALA  25   5.344  20.027  -4.743
    5    HB3  ALA  25           HB3      ALA  25   6.016  18.497  -4.177

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LEU  26           H        LEU  26   8.419  18.020  -3.645
    2    HA   LEU  26           HA       LEU  26   8.537  19.441  -1.203
    3    HB2  LEU  26           HB2      LEU  26   8.607  17.024  -1.205
    4    HB3  LEU  26           HB3      LEU  26  10.078  17.020  -2.175
    5    HG   LEU  26           HG       LEU  26  11.303  18.119  -0.330
    6   HD12  LEU  26          HD11      LEU  26  10.075  18.131   1.929
    7   HD11  LEU  26          HD12      LEU  26   8.587  18.012   0.993
    8   HD13  LEU  26          HD13      LEU  26   9.646  19.408   0.789
    9   HD21  LEU  26          HD21      LEU  26   9.743  15.664   0.534
   10   HD23  LEU  26          HD22      LEU  26  11.264  16.208   1.234
   11   HD22  LEU  26          HD23      LEU  26  11.214  15.655  -0.438

  No H/Q in entry =          11
  In of MODEL   50
    1    H    LYS  27           H        LYS  27  10.950  18.852  -3.727
    2    HA   LYS  27           HA       LYS  27  13.145  20.067  -2.494
    3    HB2  LYS  27           HB2      LYS  27  13.235  18.726  -4.588
    4    HB3  LYS  27           HB3      LYS  27  12.484  20.068  -5.449
    5    HG2  LYS  27           HG2      LYS  27  14.364  21.533  -4.866
    6    HG3  LYS  27           HG3      LYS  27  15.110  20.230  -3.933
    7    HD2  LYS  27           HD2      LYS  27  15.241  18.848  -5.991
    8    HD3  LYS  27           HD3      LYS  27  14.540  20.177  -6.916
    9    HE2  LYS  27           HE2      LYS  27  16.441  21.622  -6.297
   10    HE3  LYS  27           HE3      LYS  27  17.147  20.298  -5.363
   11    HZ3  LYS  27           HZ1      LYS  27  18.139  20.395  -7.549
   12    HZ2  LYS  27           HZ2      LYS  27  16.612  20.294  -8.291
   13    HZ1  LYS  27           HZ3      LYS  27  17.222  18.974  -7.410

  No H/Q in entry =          13
  In of MODEL   50
    1    H    GLN  28           H        GLN  28  10.538  21.481  -4.440
    2    HA   GLN  28           HA       GLN  28  11.523  24.124  -4.583
    3    HB2  GLN  28           HB2      GLN  28   8.688  23.060  -4.495
    4    HB3  GLN  28           HB3      GLN  28   9.093  24.745  -4.823
    5    HG2  GLN  28           HG2      GLN  28  10.136  22.392  -6.426
    6    HG3  GLN  28           HG3      GLN  28   8.764  23.389  -6.903
    7   HE21  GLN  28          HE21      GLN  28   9.630  25.967  -6.325
    8   HE22  GLN  28          HE22      GLN  28  11.026  26.330  -7.221

  No H/Q in entry =           8
  In of MODEL   50
    1    H    ALA  29           H        ALA  29   9.573  22.443  -2.154
    2    HA   ALA  29           HA       ALA  29   9.044  24.634  -0.465
    3    HB2  ALA  29           HB1      ALA  29   8.299  23.068   1.097
    4    HB1  ALA  29           HB2      ALA  29   9.509  21.873   0.629
    5    HB3  ALA  29           HB3      ALA  29   8.127  22.184  -0.419

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LYS  30           H        LYS  30  11.753  22.342  -0.540
    2    HA   LYS  30           HA       LYS  30  13.078  23.276   1.766
    3    HB2  LYS  30           HB2      LYS  30  14.164  21.988  -0.748
    4    HB3  LYS  30           HB3      LYS  30  15.149  22.333   0.676
    5    HG2  LYS  30           HG2      LYS  30  13.582  20.960   2.050
    6    HG3  LYS  30           HG3      LYS  30  12.694  20.552   0.578
    7    HD2  LYS  30           HD2      LYS  30  14.730  19.550  -0.385
    8    HD3  LYS  30           HD3      LYS  30  15.637  19.972   1.069
    9    HE2  LYS  30           HE2      LYS  30  14.118  18.550   2.418
   10    HE3  LYS  30           HE3      LYS  30  13.241  18.108   0.948
   11    HZ2  LYS  30           HZ1      LYS  30  15.017  16.510   1.705
   12    HZ1  LYS  30           HZ2      LYS  30  16.166  17.688   1.258
   13    HZ3  LYS  30           HZ3      LYS  30  15.124  17.018   0.090

  No H/Q in entry =          13
  In of MODEL   50
    1    H    GLN  31           H        GLN  31  12.982  24.492  -1.526
    2    HA   GLN  31           HA       GLN  31  15.152  26.364  -1.097
    3    HB2  GLN  31           HB2      GLN  31  13.111  26.437  -3.323
    4    HB3  GLN  31           HB3      GLN  31  14.737  27.118  -3.321
    5    HG2  GLN  31           HG2      GLN  31  15.174  24.416  -2.754
    6    HG3  GLN  31           HG3      GLN  31  13.871  24.378  -3.933
    7   HE21  GLN  31          HE21      GLN  31  16.707  23.560  -4.338
    8   HE22  GLN  31          HE22      GLN  31  17.289  24.532  -5.601

  No H/Q in entry =           8
  In of MODEL   50
    1    H    GLY  32           H        GLY  32  12.075  26.206   0.045
    2    HA3  GLY  32           HA2      GLY  32  10.933  27.781   1.323
    3    HA2  GLY  32           HA3      GLY  32  12.070  29.008   0.778

  No H/Q in entry =           3
  In of MODEL   50
    1    H    ASP  33           H        ASP  33  10.690  27.125  -1.722
    2    HA   ASP  33           HA       ASP  33   9.047  29.416  -2.570
    3    HB2  ASP  33           HB2      ASP  33  10.119  26.991  -4.020
    4    HB3  ASP  33           HB3      ASP  33   8.978  28.119  -4.747

  No H/Q in entry =           4
  In of MODEL   50
    1    H    PHE  34           H        PHE  34   7.353  28.950  -1.009
    2    HA   PHE  34           HA       PHE  34   5.951  26.490  -0.923
    3    HB2  PHE  34           HB2      PHE  34   5.015  29.284  -0.234
    4    HB3  PHE  34           HB3      PHE  34   4.152  27.800   0.172
    5    HD1  PHE  34           HD1      PHE  34   6.423  30.174   1.395
    6    HD2  PHE  34           HD2      PHE  34   5.705  25.939   1.327
    7    HE1  PHE  34           HE1      PHE  34   7.811  29.904   3.432
    8    HE2  PHE  34           HE2      PHE  34   7.094  25.673   3.362
    9    HZ   PHE  34           HZ       PHE  34   8.141  27.657   4.414

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ALA  35           H        ALA  35   5.548  29.365  -2.924
    2    HA   ALA  35           HA       ALA  35   2.992  28.777  -3.953
    3    HB1  ALA  35           HB1      ALA  35   4.057  30.166  -5.985
    4    HB3  ALA  35           HB2      ALA  35   5.278  30.512  -4.760
    5    HB2  ALA  35           HB3      ALA  35   3.591  30.936  -4.468

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ALA  36           H        ALA  36   6.215  28.079  -5.308
    2    HA   ALA  36           HA       ALA  36   5.214  26.666  -7.556
    3    HB3  ALA  36           HB1      ALA  36   7.375  26.773  -8.170
    4    HB2  ALA  36           HB2      ALA  36   7.846  25.735  -6.823
    5    HB1  ALA  36           HB3      ALA  36   7.756  27.484  -6.602

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ALA  37           H        ALA  37   6.159  25.652  -4.304
    2    HA   ALA  37           HA       ALA  37   6.076  22.866  -4.743
    3    HB2  ALA  37           HB1      ALA  37   5.829  24.652  -2.358
    4    HB1  ALA  37           HB2      ALA  37   6.951  23.325  -2.654
    5    HB3  ALA  37           HB3      ALA  37   5.286  22.985  -2.185

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LYS  38           H        LYS  38   3.562  25.093  -3.569
    2    HA   LYS  38           HA       LYS  38   1.446  23.298  -3.353
    3    HB2  LYS  38           HB2      LYS  38   1.823  26.050  -3.093
    4    HB3  LYS  38           HB3      LYS  38   0.623  25.918  -4.373
    5    HG2  LYS  38           HG2      LYS  38  -0.840  24.603  -2.935
    6    HG3  LYS  38           HG3      LYS  38   0.403  24.528  -1.679
    7    HD2  LYS  38           HD2      LYS  38   0.238  26.864  -1.224
    8    HD3  LYS  38           HD3      LYS  38  -0.670  27.166  -2.705
    9    HE2  LYS  38           HE2      LYS  38  -2.174  27.208  -0.767
   10    HE3  LYS  38           HE3      LYS  38  -2.560  25.838  -1.813
   11    HZ3  LYS  38           HZ1      LYS  38  -1.849  24.356  -0.285
   12    HZ2  LYS  38           HZ2      LYS  38  -2.189  25.613   0.808
   13    HZ1  LYS  38           HZ3      LYS  38  -0.596  25.349   0.283

  No H/Q in entry =          13
  In of MODEL   50
    1    H    ALA  39           H        ALA  39   2.445  25.201  -6.195
    2    HA   ALA  39           HA       ALA  39   0.362  24.358  -7.902
    3    HB2  ALA  39           HB1      ALA  39   3.105  24.985  -8.952
    4    HB1  ALA  39           HB2      ALA  39   2.149  26.253  -8.183
    5    HB3  ALA  39           HB3      ALA  39   1.530  25.426  -9.612

  No H/Q in entry =           5
  In of MODEL   50
    1    H    MET  40           H        MET  40   3.588  23.029  -7.325
    2    HA   MET  40           HA       MET  40   3.474  21.016  -9.323
    3    HB2  MET  40           HB2      MET  40   5.086  21.217  -6.773
    4    HB3  MET  40           HB3      MET  40   5.326  19.963  -7.991
    5    HG2  MET  40           HG2      MET  40   5.410  22.920  -8.647
    6    HG3  MET  40           HG3      MET  40   6.848  22.003  -8.200
    7    HE3  MET  40           HE1      MET  40   7.702  19.790 -11.015
    8    HE2  MET  40           HE2      MET  40   7.135  19.470  -9.379
    9    HE1  MET  40           HE3      MET  40   8.242  20.808  -9.674

  No H/Q in entry =           9
  In of MODEL   50
    1    H    MET  41           H        MET  41   2.557  21.055  -5.899
    2    HA   MET  41           HA       MET  41   2.000  18.294  -5.631
    3    HB2  MET  41           HB2      MET  41   0.687  20.659  -4.273
    4    HB3  MET  41           HB3      MET  41   0.517  18.981  -3.771
    5    HG2  MET  41           HG2      MET  41   3.229  19.180  -3.806
    6    HG3  MET  41           HG3      MET  41   2.803  20.841  -3.405
    7    HE2  MET  41           HE1      MET  41  -0.249  19.609  -1.685
    8    HE1  MET  41           HE2      MET  41   0.581  21.116  -2.057
    9    HE3  MET  41           HE3      MET  41   0.516  20.541  -0.391

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ASP  42           H        ASP  42  -0.014  21.039  -6.597
    2    HA   ASP  42           HA       ASP  42  -2.466  19.700  -6.740
    3    HB2  ASP  42           HB2      ASP  42  -1.737  22.265  -6.987
    4    HB3  ASP  42           HB3      ASP  42  -1.891  21.877  -8.697

  No H/Q in entry =           4
  In of MODEL   50
    1    H    GLN  43           H        GLN  43  -0.019  20.279  -9.238
    2    HA   GLN  43           HA       GLN  43  -1.416  18.978 -11.333
    3    HB2  GLN  43           HB2      GLN  43   1.546  19.468 -10.947
    4    HB3  GLN  43           HB3      GLN  43   0.828  18.839 -12.433
    5    HG2  GLN  43           HG2      GLN  43  -0.666  20.879 -12.468
    6    HG3  GLN  43           HG3      GLN  43   0.291  21.522 -11.138
    7   HE21  GLN  43          HE21      GLN  43   0.468  23.148 -13.218
    8   HE22  GLN  43          HE22      GLN  43   1.881  22.918 -14.125

  No H/Q in entry =           8
  In of MODEL   50
    1    H    SER  44           H        SER  44   0.924  17.810  -8.944
    2    HA   SER  44           HA       SER  44   1.237  15.204  -9.978
    3    HB2  SER  44           HB2      SER  44   2.143  16.628  -7.736
    4    HB3  SER  44           HB3      SER  44   1.269  15.250  -7.071
    5    HG   SER  44           HG       SER  44   3.375  14.614  -7.498

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ARG  45           H        ARG  45  -1.073  16.534  -7.637
    2    HA   ARG  45           HA       ARG  45  -2.479  14.183  -7.011
    3    HB2  ARG  45           HB2      ARG  45  -2.660  16.348  -5.812
    4    HB3  ARG  45           HB3      ARG  45  -3.510  17.027  -7.197
    5    HG2  ARG  45           HG2      ARG  45  -5.290  15.314  -6.921
    6    HG3  ARG  45           HG3      ARG  45  -4.452  14.691  -5.499
    7    HD2  ARG  45           HD2      ARG  45  -4.641  16.956  -4.436
    8    HD3  ARG  45           HD3      ARG  45  -5.623  17.488  -5.817
    9    HE   ARG  45           HE       ARG  45  -6.752  15.118  -4.785
   10   HH21  ARG  45          HH11      ARG  45  -8.588  15.203  -3.516
   11   HH22  ARG  45          HH12      ARG  45  -8.973  16.643  -2.642
   12   HH11  ARG  45          HH21      ARG  45  -6.181  18.356  -3.751
   13   HH12  ARG  45          HH22      ARG  45  -7.604  18.429  -2.773

  No H/Q in entry =          13
  In of MODEL   50
    1    H    MET  46           H        MET  46  -3.042  16.600  -9.554
    2    HA   MET  46           HA       MET  46  -5.390  15.449 -10.621
    3    HB2  MET  46           HB2      MET  46  -3.272  17.255 -11.801
    4    HB3  MET  46           HB3      MET  46  -4.674  16.724 -12.735
    5    HG2  MET  46           HG2      MET  46  -6.179  17.665 -11.038
    6    HG3  MET  46           HG3      MET  46  -4.800  18.162 -10.066
    7    HE1  MET  46           HE1      MET  46  -5.381  20.483  -9.837
    8    HE3  MET  46           HE2      MET  46  -6.887  20.407 -10.746
    9    HE2  MET  46           HE3      MET  46  -5.705  21.663 -11.113

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ALA  47           H        ALA  47  -1.965  14.946 -11.378
    2    HA   ALA  47           HA       ALA  47  -2.322  13.228 -13.594
    3    HB3  ALA  47           HB1      ALA  47  -0.138  14.100 -13.238
    4    HB2  ALA  47           HB2      ALA  47  -0.010  12.370 -12.910
    5    HB1  ALA  47           HB3      ALA  47  -0.095  13.518 -11.573

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LEU  48           H        LEU  48  -2.059  12.579 -10.122
    2    HA   LEU  48           HA       LEU  48  -2.175   9.741 -10.290
    3    HB2  LEU  48           HB2      LEU  48  -2.926  11.657  -8.071
    4    HB3  LEU  48           HB3      LEU  48  -2.846   9.905  -7.876
    5    HG   LEU  48           HG       LEU  48  -0.533  11.591  -8.866
    6   HD13  LEU  48          HD11      LEU  48  -0.812  12.356  -6.673
    7   HD12  LEU  48          HD12      LEU  48   0.342  11.039  -6.478
    8   HD11  LEU  48          HD13      LEU  48  -1.359  10.788  -6.082
    9   HD22  LEU  48          HD21      LEU  48  -0.050   9.404  -9.513
   10   HD21  LEU  48          HD22      LEU  48  -0.927   8.690  -8.160
   11   HD23  LEU  48          HD23      LEU  48   0.652   9.431  -7.896

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ASN  49           H        ASN  49  -4.620  12.250  -9.882
    2    HA   ASN  49           HA       ASN  49  -6.818  10.600  -9.350
    3    HB2  ASN  49           HB2      ASN  49  -6.841  13.030  -9.026
    4    HB3  ASN  49           HB3      ASN  49  -6.708  13.282 -10.761
    5   HD21  ASN  49          HD21      ASN  49  -8.770  14.406 -10.826
    6   HD22  ASN  49          HD22      ASN  49 -10.235  13.569 -10.651

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLU  50           H        GLU  50  -5.528  11.797 -12.432
    2    HA   GLU  50           HA       GLU  50  -7.490  10.562 -14.084
    3    HB2  GLU  50           HB2      GLU  50  -6.010  12.373 -14.891
    4    HB3  GLU  50           HB3      GLU  50  -4.624  11.290 -14.755
    5    HG2  GLU  50           HG2      GLU  50  -5.608   9.767 -16.397
    6    HG3  GLU  50           HG3      GLU  50  -7.061  10.756 -16.483

  No H/Q in entry =           6
  In of MODEL   50
    1    H    ALA  51           H        ALA  51  -4.328   9.542 -12.879
    2    HA   ALA  51           HA       ALA  51  -4.206   7.093 -14.304
    3    HB2  ALA  51           HB1      ALA  51  -2.228   6.786 -13.204
    4    HB1  ALA  51           HB2      ALA  51  -2.914   7.209 -11.635
    5    HB3  ALA  51           HB3      ALA  51  -2.448   8.480 -12.765

  No H/Q in entry =           5
  In of MODEL   50
    1    H    HIS  52           H        HIS  52  -5.375   7.923 -11.054
    2    HA   HIS  52           HA       HIS  52  -6.081   5.316 -10.231
    3    HB2  HIS  52           HB2      HIS  52  -5.929   7.262  -8.709
    4    HB3  HIS  52           HB3      HIS  52  -7.371   7.943  -9.461
    5    HD1  HIS  52           HD1      HIS  52  -9.634   6.629  -9.108
    6    HD2  HIS  52           HD2      HIS  52  -6.424   5.183  -6.877
    7    HE1  HIS  52           HE1      HIS  52 -10.617   5.096  -7.347
    8    HE2  HIS  52           HE2      HIS  52  -8.673   4.206  -5.978

  No H/Q in entry =           8
  In of MODEL   50
    1    H    LEU  53           H        LEU  53  -7.880   7.793 -12.013
    2    HA   LEU  53           HA       LEU  53 -10.396   6.521 -12.032
    3    HB2  LEU  53           HB2      LEU  53  -9.094   8.498 -13.893
    4    HB3  LEU  53           HB3      LEU  53 -10.698   7.846 -14.221
    5    HG   LEU  53           HG       LEU  53  -9.985   9.137 -11.569
    6   HD11  LEU  53          HD11      LEU  53 -11.122  10.380 -14.087
    7   HD13  LEU  53          HD12      LEU  53  -9.644  10.840 -13.243
    8   HD12  LEU  53          HD13      LEU  53 -11.213  11.138 -12.502
    9   HD23  LEU  53          HD21      LEU  53 -12.561   9.566 -11.720
   10   HD22  LEU  53          HD22      LEU  53 -12.002   7.953 -11.293
   11   HD21  LEU  53          HD23      LEU  53 -12.552   8.284 -12.924

  No H/Q in entry =          11
  In of MODEL   50
    1    H    VAL  54           H        VAL  54  -7.645   6.309 -14.267
    2    HA   VAL  54           HA       VAL  54  -8.880   4.554 -16.117
    3    HB   VAL  54           HB       VAL  54  -5.969   5.035 -15.430
    4   HG12  VAL  54          HG11      VAL  54  -5.728   3.956 -17.823
    5   HG11  VAL  54          HG12      VAL  54  -7.263   3.186 -17.423
    6   HG13  VAL  54          HG13      VAL  54  -5.851   2.916 -16.404
    7   HG22  VAL  54          HG21      VAL  54  -6.722   6.988 -16.470
    8   HG21  VAL  54          HG22      VAL  54  -7.921   6.137 -17.442
    9   HG23  VAL  54          HG23      VAL  54  -6.214   6.044 -17.871

  No H/Q in entry =           9
  In of MODEL   50
    1    H    GLN  55           H        GLN  55  -6.889   3.982 -13.217
    2    HA   GLN  55           HA       GLN  55  -6.822   1.166 -13.483
    3    HB2  GLN  55           HB2      GLN  55  -5.261   2.044 -11.959
    4    HB3  GLN  55           HB3      GLN  55  -6.470   3.017 -11.128
    5    HG2  GLN  55           HG2      GLN  55  -7.175   1.262  -9.816
    6    HG3  GLN  55           HG3      GLN  55  -6.958   0.077 -11.098
    7   HE21  GLN  55          HE21      GLN  55  -5.348  -1.388 -10.607
    8   HE22  GLN  55          HE22      GLN  55  -3.961  -1.051  -9.692

  No H/Q in entry =           8
  In of MODEL   50
    1    H    THR  56           H        THR  56  -9.137   3.343 -11.864
    2    HA   THR  56           HA       THR  56 -10.738   1.469 -10.582
    3    HB   THR  56           HB       THR  56 -11.805   3.874 -12.082
    4    HG1  THR  56           HG1      THR  56 -10.347   3.621  -9.695
    5   HG23  THR  56          HG21      THR  56 -13.637   2.702 -11.228
    6   HG22  THR  56          HG22      THR  56 -13.277   3.831  -9.921
    7   HG21  THR  56          HG23      THR  56 -12.749   2.152  -9.809

  No H/Q in entry =           7
  In of MODEL   50
    1    H    LYS  57           H        LYS  57 -10.927   2.564 -13.965
    2    HA   LYS  57           HA       LYS  57 -13.096   0.898 -14.727
    3    HB2  LYS  57           HB2      LYS  57 -12.249   2.829 -16.055
    4    HB3  LYS  57           HB3      LYS  57 -10.768   1.938 -16.377
    5    HG2  LYS  57           HG2      LYS  57 -12.188   1.698 -18.302
    6    HG3  LYS  57           HG3      LYS  57 -12.166   0.148 -17.467
    7    HD2  LYS  57           HD2      LYS  57 -14.341   0.500 -16.546
    8    HD3  LYS  57           HD3      LYS  57 -14.332   2.208 -16.977
    9    HE2  LYS  57           HE2      LYS  57 -14.394   1.640 -19.365
   10    HE3  LYS  57           HE3      LYS  57 -14.315  -0.080 -18.989
   11    HZ1  LYS  57           HZ1      LYS  57 -16.404   1.067 -17.517
   12    HZ3  LYS  57           HZ2      LYS  57 -16.491  -0.105 -18.745
   13    HZ2  LYS  57           HZ3      LYS  57 -16.573   1.547 -19.135

  No H/Q in entry =          13
  In of MODEL   50
    1    H    LEU  58           H        LEU  58  -9.596   0.437 -14.666
    2    HA   LEU  58           HA       LEU  58  -9.624  -2.076 -15.963
    3    HB2  LEU  58           HB2      LEU  58  -7.581  -0.808 -14.148
    4    HB3  LEU  58           HB3      LEU  58  -7.332  -2.329 -15.006
    5    HG   LEU  58           HG       LEU  58  -8.062   0.286 -16.363
    6   HD11  LEU  58          HD11      LEU  58  -5.427  -0.975 -15.672
    7   HD13  LEU  58          HD12      LEU  58  -5.908   0.720 -15.619
    8   HD12  LEU  58          HD13      LEU  58  -5.573  -0.050 -17.167
    9   HD22  LEU  58          HD21      LEU  58  -8.649  -1.266 -17.959
   10   HD21  LEU  58          HD22      LEU  58  -7.619  -2.525 -17.280
   11   HD23  LEU  58          HD23      LEU  58  -6.916  -1.254 -18.281

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  59           H        ILE  59 -10.442  -1.176 -12.710
    2    HA   ILE  59           HA       ILE  59 -10.116  -3.949 -11.770
    3    HB   ILE  59           HB       ILE  59  -9.660  -1.684 -10.366
    4   HG12  ILE  59          HG12      ILE  59 -11.030  -4.040  -9.051
    5   HG13  ILE  59          HG13      ILE  59  -9.387  -4.117  -9.637
    6   HG23  ILE  59          HG21      ILE  59 -11.487  -0.992  -9.051
    7   HG22  ILE  59          HG22      ILE  59 -12.426  -2.421  -9.418
    8   HG21  ILE  59          HG23      ILE  59 -12.202  -1.167 -10.636
    9   HD12  ILE  59          HD11      ILE  59 -10.445  -2.182  -7.589
   10   HD11  ILE  59          HD12      ILE  59  -8.805  -2.154  -8.222
   11   HD13  ILE  59          HD13      ILE  59  -9.360  -3.532  -7.269

  No H/Q in entry =          11
  In of MODEL   50
    1    H    GLU  60           H        GLU  60 -12.653  -1.610 -12.576
    2    HA   GLU  60           HA       GLU  60 -14.852  -3.111 -11.570
    3    HB2  GLU  60           HB2      GLU  60 -15.494  -0.952 -12.052
    4    HB3  GLU  60           HB3      GLU  60 -14.476  -0.855 -13.485
    5    HG2  GLU  60           HG2      GLU  60 -16.970  -0.927 -13.951
    6    HG3  GLU  60           HG3      GLU  60 -16.034  -2.157 -14.773

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLY  61           H        GLY  61 -13.174  -3.101 -14.682
    2    HA3  GLY  61           HA2      GLY  61 -14.904  -5.329 -15.581
    3    HA2  GLY  61           HA3      GLY  61 -14.048  -4.228 -16.655

  No H/Q in entry =           3
  In of MODEL   50
    1    H    ASP  62           H        ASP  62 -12.688  -5.693 -13.773
    2    HA   ASP  62           HA       ASP  62 -10.470  -6.734 -15.284
    3    HB2  ASP  62           HB2      ASP  62  -9.720  -7.508 -13.013
    4    HB3  ASP  62           HB3      ASP  62 -10.042  -5.781 -13.116

  No H/Q in entry =           4
  In of MODEL   50
    1    H    ALA  63           H        ALA  63 -13.535  -7.966 -14.860
    2    HA   ALA  63           HA       ALA  63 -13.212 -10.661 -14.132
    3    HB3  ALA  63           HB1      ALA  63 -15.262 -11.047 -15.486
    4    HB1  ALA  63           HB2      ALA  63 -15.067  -9.456 -16.219
    5    HB2  ALA  63           HB3      ALA  63 -15.414  -9.598 -14.494

  No H/Q in entry =           5
  In of MODEL   50
    1    H    GLY  64           H        GLY  64 -12.981  -9.113 -17.308
    2    HA3  GLY  64           HA2      GLY  64 -12.070  -9.780 -19.300
    3    HA2  GLY  64           HA3      GLY  64 -10.897 -10.655 -18.325

  No H/Q in entry =           3
  In of MODEL   50
    1    H    GLU  65           H        GLU  65 -10.756 -12.705 -19.019
    2    HA   GLU  65           HA       GLU  65 -12.598 -14.023 -20.610
    3    HB2  GLU  65           HB2      GLU  65 -10.524 -15.151 -18.732
    4    HB3  GLU  65           HB3      GLU  65 -11.435 -16.128 -19.884
    5    HG2  GLU  65           HG2      GLU  65 -10.591 -14.787 -21.743
    6    HG3  GLU  65           HG3      GLU  65  -9.744 -13.724 -20.620

  No H/Q in entry =           6
  In of MODEL   50
    1    H    GLY  66           H        GLY  66 -13.403 -16.290 -19.921
    2    HA3  GLY  66           HA2      GLY  66 -15.697 -15.962 -18.321
    3    HA2  GLY  66           HA3      GLY  66 -15.104 -17.472 -18.982

  No H/Q in entry =           3
  In of MODEL   50
    1    H    LYS  67           H        LYS  67 -12.568 -17.377 -17.633
    2    HA   LYS  67           HA       LYS  67 -13.279 -18.714 -15.252
    3    HB2  LYS  67           HB2      LYS  67 -10.624 -17.805 -16.347
    4    HB3  LYS  67           HB3      LYS  67 -10.796 -18.801 -14.897
    5    HG2  LYS  67           HG2      LYS  67 -12.012 -20.503 -16.168
    6    HG3  LYS  67           HG3      LYS  67 -11.949 -19.498 -17.614
    7    HD2  LYS  67           HD2      LYS  67 -10.193 -21.097 -17.861
    8    HD3  LYS  67           HD3      LYS  67  -9.403 -19.590 -17.393
    9    HE2  LYS  67           HE2      LYS  67 -10.286 -21.508 -15.256
   10    HE3  LYS  67           HE3      LYS  67  -8.792 -21.827 -16.138
   11    HZ1  LYS  67           HZ1      LYS  67  -9.016 -19.099 -15.312
   12    HZ3  LYS  67           HZ2      LYS  67  -7.750 -20.204 -15.068
   13    HZ2  LYS  67           HZ3      LYS  67  -9.068 -20.167 -13.996

  No H/Q in entry =          13
  In of MODEL   50
    1    H    MET  68           H        MET  68 -12.853 -18.318 -13.140
    2    HA   MET  68           HA       MET  68 -13.563 -15.854 -12.083
    3    HB2  MET  68           HB2      MET  68 -12.063 -18.138 -10.801
    4    HB3  MET  68           HB3      MET  68 -12.798 -16.798  -9.920
    5    HG2  MET  68           HG2      MET  68 -14.292 -18.684 -11.766
    6    HG3  MET  68           HG3      MET  68 -14.286 -18.788 -10.003
    7    HE1  MET  68           HE1      MET  68 -14.655 -17.075  -8.553
    8    HE3  MET  68           HE2      MET  68 -16.159 -16.157  -8.577
    9    HE2  MET  68           HE3      MET  68 -14.662 -15.397  -9.115

  No H/Q in entry =           9
  In of MODEL   50
    1    H    LYS  69           H        LYS  69 -10.534 -16.559 -13.432
    2    HA   LYS  69           HA       LYS  69  -8.890 -15.098 -11.619
    3    HB2  LYS  69           HB2      LYS  69  -8.360 -15.930 -14.476
    4    HB3  LYS  69           HB3      LYS  69  -7.143 -15.354 -13.335
    5    HG2  LYS  69           HG2      LYS  69  -8.937 -17.657 -12.602
    6    HG3  LYS  69           HG3      LYS  69  -7.503 -17.930 -13.590
    7    HD2  LYS  69           HD2      LYS  69  -6.110 -16.863 -11.839
    8    HD3  LYS  69           HD3      LYS  69  -7.550 -16.646 -10.843
    9    HE2  LYS  69           HE2      LYS  69  -7.908 -19.092 -10.830
   10    HE3  LYS  69           HE3      LYS  69  -6.460 -19.306 -11.812
   11    HZ1  LYS  69           HZ1      LYS  69  -6.380 -17.883  -9.224
   12    HZ3  LYS  69           HZ2      LYS  69  -5.095 -18.574 -10.093
   13    HZ2  LYS  69           HZ3      LYS  69  -6.230 -19.570  -9.311

  No H/Q in entry =          13
  In of MODEL   50
    1    H    VAL  70           H        VAL  70  -7.561 -13.197 -12.106
    2    HA   VAL  70           HA       VAL  70  -8.978 -11.184 -13.763
    3    HB   VAL  70           HB       VAL  70  -8.293  -9.514 -12.068
    4   HG13  VAL  70          HG11      VAL  70 -10.022 -10.037 -10.520
    5   HG12  VAL  70          HG12      VAL  70  -9.763 -11.773 -10.702
    6   HG11  VAL  70          HG13      VAL  70 -10.496 -10.850 -12.012
    7   HG22  VAL  70          HG21      VAL  70  -6.372 -10.391 -11.006
    8   HG21  VAL  70          HG22      VAL  70  -7.113 -11.974 -10.784
    9   HG23  VAL  70          HG23      VAL  70  -7.615 -10.618  -9.778

  No H/Q in entry =           9
  In of MODEL   50
    1    H    SER  71           H        SER  71  -7.552  -9.362 -14.394
    2    HA   SER  71           HA       SER  71  -5.231 -10.234 -15.748
    3    HB2  SER  71           HB2      SER  71  -6.620  -8.208 -16.334
    4    HB3  SER  71           HB3      SER  71  -5.902  -7.393 -14.948
    5    HG   SER  71           HG       SER  71  -4.700  -8.304 -17.328

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LEU  72           H        LEU  72  -3.278 -10.615 -15.021
    2    HA   LEU  72           HA       LEU  72  -2.561 -10.413 -12.308
    3    HB2  LEU  72           HB2      LEU  72  -0.909 -10.853 -14.791
    4    HB3  LEU  72           HB3      LEU  72  -0.246 -10.930 -13.162
    5    HG   LEU  72           HG       LEU  72  -2.610 -12.606 -14.069
    6   HD12  LEU  72          HD11      LEU  72   0.271 -13.498 -13.789
    7   HD11  LEU  72          HD12      LEU  72  -0.455 -13.056 -15.334
    8   HD13  LEU  72          HD13      LEU  72  -1.087 -14.429 -14.424
    9   HD21  LEU  72          HD21      LEU  72  -0.877 -12.480 -11.610
   10   HD23  LEU  72          HD22      LEU  72  -1.606 -14.011 -12.063
   11   HD22  LEU  72          HD23      LEU  72  -2.628 -12.618 -11.716

  No H/Q in entry =          11
  In of MODEL   50
    1    H    VAL  73           H        VAL  73  -1.822  -8.397 -15.083
    2    HA   VAL  73           HA       VAL  73   0.113  -6.718 -13.972
    3    HB   VAL  73           HB       VAL  73  -0.257  -5.298 -15.828
    4   HG11  VAL  73          HG11      VAL  73   0.565  -7.600 -16.344
    5   HG13  VAL  73          HG12      VAL  73  -0.322  -6.877 -17.686
    6   HG12  VAL  73          HG13      VAL  73  -1.099  -8.088 -16.666
    7   HG21  VAL  73          HG21      VAL  73  -3.040  -6.410 -15.673
    8   HG23  VAL  73          HG22      VAL  73  -2.434  -5.832 -17.224
    9   HG22  VAL  73          HG23      VAL  73  -2.518  -4.735 -15.846

  No H/Q in entry =           9
  In of MODEL   50
    1    H    LEU  74           H        LEU  74  -3.286  -6.804 -13.420
    2    HA   LEU  74           HA       LEU  74  -3.881  -4.144 -12.802
    3    HB2  LEU  74           HB2      LEU  74  -5.621  -5.802 -12.984
    4    HB3  LEU  74           HB3      LEU  74  -4.945  -6.722 -11.644
    5    HG   LEU  74           HG       LEU  74  -5.405  -4.840 -10.113
    6   HD12  LEU  74          HD11      LEU  74  -6.975  -3.044 -11.107
    7   HD11  LEU  74          HD12      LEU  74  -6.370  -3.567 -12.677
    8   HD13  LEU  74          HD13      LEU  74  -5.257  -2.905 -11.477
    9   HD23  LEU  74          HD21      LEU  74  -7.965  -5.202 -11.565
   10   HD22  LEU  74          HD22      LEU  74  -7.576  -5.423  -9.873
   11   HD21  LEU  74          HD23      LEU  74  -7.132  -6.657 -11.027

  No H/Q in entry =          11
  In of MODEL   50
    1    H    VAL  75           H        VAL  75  -2.868  -6.745 -10.645
    2    HA   VAL  75           HA       VAL  75  -2.659  -5.202  -8.297
    3    HB   VAL  75           HB       VAL  75  -1.194  -7.712  -9.095
    4   HG13  VAL  75          HG11      VAL  75   0.100  -6.513  -7.373
    5   HG12  VAL  75          HG12      VAL  75  -0.736  -7.867  -6.628
    6   HG11  VAL  75          HG13      VAL  75  -1.365  -6.239  -6.435
    7   HG21  VAL  75          HG21      VAL  75  -3.667  -7.862  -8.887
    8   HG23  VAL  75          HG22      VAL  75  -3.564  -7.168  -7.269
    9   HG22  VAL  75          HG23      VAL  75  -2.860  -8.752  -7.597

  No H/Q in entry =           9
  In of MODEL   50
    1    H    GLU  76           H        GLU  76  -0.253  -5.978 -10.831
    2    HA   GLU  76           HA       GLU  76   1.943  -4.654  -9.667
    3    HB2  GLU  76           HB2      GLU  76   2.093  -6.137 -11.671
    4    HB3  GLU  76           HB3      GLU  76   1.257  -4.916 -12.618
    5    HG2  GLU  76           HG2      GLU  76   3.096  -3.326 -12.237
    6    HG3  GLU  76           HG3      GLU  76   3.947  -4.499 -11.252

  No H/Q in entry =           6
  In of MODEL   50
    1    H    ALA  77           H        ALA  77  -0.574  -3.424 -11.857
    2    HA   ALA  77           HA       ALA  77   0.441  -0.787 -12.025
    3    HB1  ALA  77           HB1      ALA  77  -1.294  -1.791 -13.541
    4    HB2  ALA  77           HB2      ALA  77  -1.720  -0.194 -12.925
    5    HB3  ALA  77           HB3      ALA  77  -2.460  -1.634 -12.226

  No H/Q in entry =           5
  In of MODEL   50
    1    H    GLN  78           H        GLN  78  -1.845  -2.327  -9.822
    2    HA   GLN  78           HA       GLN  78  -2.633  -0.004  -8.417
    3    HB2  GLN  78           HB2      GLN  78  -3.765  -2.252  -8.338
    4    HB3  GLN  78           HB3      GLN  78  -2.435  -2.829  -7.338
    5    HG2  GLN  78           HG2      GLN  78  -2.933  -1.098  -5.665
    6    HG3  GLN  78           HG3      GLN  78  -4.262  -0.508  -6.664
    7   HE21  GLN  78          HE21      GLN  78  -4.762  -1.481  -4.024
    8   HE22  GLN  78          HE22      GLN  78  -5.636  -2.931  -4.143

  No H/Q in entry =           8
  In of MODEL   50
    1    H    LEU  79           H        LEU  79   0.024  -2.285  -7.967
    2    HA   LEU  79           HA       LEU  79   1.003  -1.402  -5.506
    3    HB2  LEU  79           HB2      LEU  79   1.858  -3.416  -6.577
    4    HB3  LEU  79           HB3      LEU  79   2.515  -2.467  -7.906
    5    HG   LEU  79           HG       LEU  79   4.077  -1.345  -6.397
    6   HD13  LEU  79          HD11      LEU  79   3.071  -1.096  -4.331
    7   HD12  LEU  79          HD12      LEU  79   4.138  -2.455  -3.989
    8   HD11  LEU  79          HD13      LEU  79   2.430  -2.739  -4.322
    9   HD23  LEU  79          HD21      LEU  79   5.268  -3.505  -5.497
   10   HD22  LEU  79          HD22      LEU  79   5.070  -3.300  -7.235
   11   HD21  LEU  79          HD23      LEU  79   3.981  -4.363  -6.347

  No H/Q in entry =          11
  In of MODEL   50
    1    H    HIS  80           H        HIS  80   1.889  -0.285  -8.774
    2    HA   HIS  80           HA       HIS  80   3.711   1.685  -7.844
    3    HB2  HIS  80           HB2      HIS  80   2.421   1.008 -10.431
    4    HB3  HIS  80           HB3      HIS  80   3.029   2.654 -10.255
    5    HD1  HIS  80           HD1      HIS  80   5.434   2.937 -10.771
    6    HD2  HIS  80           HD2      HIS  80   4.581  -0.970  -9.591
    7    HE1  HIS  80           HE1      HIS  80   7.614   1.643 -10.936
    8    HE2  HIS  80           HE2      HIS  80   7.105  -0.742 -10.220

  No H/Q in entry =           8
  In of MODEL   50
    1    H    LEU  81           H        LEU  81   0.311   1.874  -8.830
    2    HA   LEU  81           HA       LEU  81   0.056   4.668  -8.493
    3    HB2  LEU  81           HB2      LEU  81  -1.976   2.438  -8.423
    4    HB3  LEU  81           HB3      LEU  81  -2.415   4.144  -8.328
    5    HG   LEU  81           HG       LEU  81  -0.726   2.987 -10.563
    6   HD12  LEU  81          HD11      LEU  81  -2.953   3.327 -11.866
    7   HD11  LEU  81          HD12      LEU  81  -3.713   3.260 -10.276
    8   HD13  LEU  81          HD13      LEU  81  -2.779   1.887 -10.865
    9   HD23  LEU  81          HD21      LEU  81  -1.805   5.142 -11.657
   10   HD22  LEU  81          HD22      LEU  81  -0.389   5.300 -10.621
   11   HD21  LEU  81          HD23      LEU  81  -1.993   5.659  -9.983

  No H/Q in entry =          11
  In of MODEL   50
    1    H    MET  82           H        MET  82  -0.627   1.981  -6.252
    2    HA   MET  82           HA       MET  82  -1.672   3.569  -4.163
    3    HB2  MET  82           HB2      MET  82  -0.318   0.873  -4.206
    4    HB3  MET  82           HB3      MET  82  -0.894   1.598  -2.708
    5    HG2  MET  82           HG2      MET  82  -2.625   1.123  -5.154
    6    HG3  MET  82           HG3      MET  82  -2.558   0.045  -3.761
    7    HE3  MET  82           HE1      MET  82  -4.274   1.700  -0.945
    8    HE2  MET  82           HE2      MET  82  -2.542   1.966  -1.126
    9    HE1  MET  82           HE3      MET  82  -3.240   0.415  -1.585

  No H/Q in entry =           9
  In of MODEL   50
    1    H    THR  83           H        THR  83   1.622   2.462  -4.848
    2    HA   THR  83           HA       THR  83   2.843   3.552  -2.543
    3    HB   THR  83           HB       THR  83   4.940   3.486  -4.012
    4    HG1  THR  83           HG1      THR  83   4.701   2.966  -6.038
    5   HG22  THR  83          HG21      THR  83   4.478   0.832  -4.352
    6   HG21  THR  83          HG22      THR  83   3.189   1.217  -3.213
    7   HG23  THR  83          HG23      THR  83   4.870   1.548  -2.789

  No H/Q in entry =           7
  In of MODEL   50
    1    H    SER  84           H        SER  84   2.488   4.842  -5.840
    2    HA   SER  84           HA       SER  84   3.843   7.272  -5.376
    3    HB2  SER  84           HB2      SER  84   1.772   6.459  -7.402
    4    HB3  SER  84           HB3      SER  84   2.461   8.082  -7.371
    5    HG   SER  84           HG       SER  84   3.817   5.598  -7.666

  No H/Q in entry =           5
  In of MODEL   50
    1    H    MET  85           H        MET  85   0.344   6.540  -5.214
    2    HA   MET  85           HA       MET  85  -0.501   9.154  -4.607
    3    HB2  MET  85           HB2      MET  85  -2.039   7.366  -5.284
    4    HB3  MET  85           HB3      MET  85  -1.752   6.542  -3.753
    5    HG2  MET  85           HG2      MET  85  -2.641   8.472  -2.521
    6    HG3  MET  85           HG3      MET  85  -2.875   9.344  -4.035
    7    HE3  MET  85           HE1      MET  85  -3.856   5.324  -3.304
    8    HE2  MET  85           HE2      MET  85  -5.141   5.875  -2.230
    9    HE1  MET  85           HE3      MET  85  -3.484   6.405  -1.954

  No H/Q in entry =           9
  In of MODEL   50
    1    H    LEU  86           H        LEU  86   0.395   6.480  -2.469
    2    HA   LEU  86           HA       LEU  86  -0.133   7.780  -0.024
    3    HB2  LEU  86           HB2      LEU  86   0.313   5.307  -0.424
    4    HB3  LEU  86           HB3      LEU  86   2.023   5.724  -0.514
    5    HG   LEU  86           HG       LEU  86   1.703   6.881   1.756
    6   HD11  LEU  86          HD11      LEU  86  -0.996   6.137   1.278
    7   HD13  LEU  86          HD12      LEU  86  -0.327   6.875   2.731
    8   HD12  LEU  86          HD13      LEU  86  -0.432   5.120   2.607
    9   HD23  LEU  86          HD21      LEU  86   1.251   3.892   1.869
   10   HD22  LEU  86          HD22      LEU  86   2.259   4.890   2.914
   11   HD21  LEU  86          HD23      LEU  86   2.761   4.566   1.255

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ALA  87           H        ALA  87   2.849   7.467  -1.909
    2    HA   ALA  87           HA       ALA  87   4.563   8.859  -0.176
    3    HB3  ALA  87           HB1      ALA  87   4.655   7.853  -2.886
    4    HB2  ALA  87           HB2      ALA  87   5.990   8.169  -1.782
    5    HB1  ALA  87           HB3      ALA  87   5.388   9.458  -2.823

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ARG  88           H        ARG  88   2.630  10.019  -2.897
    2    HA   ARG  88           HA       ARG  88   3.428  12.701  -2.771
    3    HB2  ARG  88           HB2      ARG  88   2.167  11.565  -4.634
    4    HB3  ARG  88           HB3      ARG  88   0.709  11.718  -3.653
    5    HG2  ARG  88           HG2      ARG  88   1.751  14.289  -3.561
    6    HG3  ARG  88           HG3      ARG  88   2.174  13.776  -5.192
    7    HD2  ARG  88           HD2      ARG  88   0.035  13.877  -5.893
    8    HD3  ARG  88           HD3      ARG  88  -0.562  13.025  -4.469
    9    HE   ARG  88           HE       ARG  88  -0.726  15.806  -4.879
   10   HH21  ARG  88          HH11      ARG  88  -1.245  17.135  -3.138
   11   HH22  ARG  88          HH12      ARG  88  -0.956  16.590  -1.522
   12   HH11  ARG  88          HH21      ARG  88   0.264  13.527  -2.509
   13   HH12  ARG  88          HH22      ARG  88  -0.119  14.542  -1.166

  No H/Q in entry =          13
  In of MODEL   50
    1    H    GLU  89           H        GLU  89   0.706  11.047  -1.141
    2    HA   GLU  89           HA       GLU  89  -0.382  13.365   0.069
    3    HB2  GLU  89           HB2      GLU  89  -1.521  11.136  -0.027
    4    HB3  GLU  89           HB3      GLU  89  -0.404  10.567   1.215
    5    HG2  GLU  89           HG2      GLU  89  -1.211  12.269   2.778
    6    HG3  GLU  89           HG3      GLU  89  -2.255  12.953   1.534

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LEU  90           H        LEU  90   2.045  11.046   1.240
    2    HA   LEU  90           HA       LEU  90   2.408  12.279   3.774
    3    HB2  LEU  90           HB2      LEU  90   4.167  10.493   2.095
    4    HB3  LEU  90           HB3      LEU  90   4.588  11.001   3.736
    5    HG   LEU  90           HG       LEU  90   1.942   9.683   3.066
    6   HD12  LEU  90          HD11      LEU  90   3.060   7.623   4.070
    7   HD11  LEU  90          HD12      LEU  90   4.591   8.465   3.833
    8   HD13  LEU  90          HD13      LEU  90   3.577   8.071   2.443
    9   HD22  LEU  90          HD21      LEU  90   1.683  10.602   5.190
   10   HD21  LEU  90          HD22      LEU  90   3.399  10.477   5.575
   11   HD23  LEU  90          HD23      LEU  90   2.378   9.040   5.617

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  91           H        ILE  91   4.021  12.656   0.651
    2    HA   ILE  91           HA       ILE  91   6.015  14.464   1.500
    3    HB   ILE  91           HB       ILE  91   4.703  13.995  -1.184
    4   HG12  ILE  91          HG12      ILE  91   7.529  13.476  -0.207
    5   HG13  ILE  91          HG13      ILE  91   6.234  12.291  -0.050
    6   HG22  ILE  91          HG21      ILE  91   6.941  15.321  -1.865
    7   HG21  ILE  91          HG22      ILE  91   6.636  16.120  -0.321
    8   HG23  ILE  91          HG23      ILE  91   5.416  16.166  -1.592
    9   HD13  ILE  91          HD11      ILE  91   6.062  11.977  -2.358
   10   HD12  ILE  91          HD12      ILE  91   7.798  12.201  -2.141
   11   HD11  ILE  91          HD13      ILE  91   6.803  13.536  -2.725

  No H/Q in entry =          11
  In of MODEL   50
    1    H    THR  92           H        THR  92   2.659  14.935   0.488
    2    HA   THR  92           HA       THR  92   2.663  17.758   0.436
    3    HB   THR  92           HB       THR  92   0.473  15.784   1.125
    4    HG1  THR  92           HG1      THR  92   0.780  15.609  -0.960
    5   HG22  THR  92          HG21      THR  92  -0.903  17.963   0.408
    6   HG21  THR  92          HG22      THR  92   0.496  18.771   1.110
    7   HG23  THR  92          HG23      THR  92  -0.458  17.657   2.086

  No H/Q in entry =           7
  In of MODEL   50
    1    H    GLU  93           H        GLU  93   2.086  15.455   3.082
    2    HA   GLU  93           HA       GLU  93   1.571  17.358   5.105
    3    HB2  GLU  93           HB2      GLU  93   2.854  14.619   5.335
    4    HB3  GLU  93           HB3      GLU  93   2.171  15.549   6.670
    5    HG2  GLU  93           HG2      GLU  93   0.555  14.796   4.226
    6    HG3  GLU  93           HG3      GLU  93   0.643  13.768   5.651

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LEU  94           H        LEU  94   4.563  15.848   3.956
    2    HA   LEU  94           HA       LEU  94   6.323  16.971   5.850
    3    HB2  LEU  94           HB2      LEU  94   6.719  16.008   3.017
    4    HB3  LEU  94           HB3      LEU  94   8.054  16.649   3.971
    5    HG   LEU  94           HG       LEU  94   6.289  14.468   5.096
    6   HD11  LEU  94          HD11      LEU  94   8.385  14.226   2.967
    7   HD13  LEU  94          HD12      LEU  94   6.928  13.267   3.223
    8   HD12  LEU  94          HD13      LEU  94   8.349  12.996   4.232
    9   HD23  LEU  94          HD21      LEU  94   8.470  13.904   6.250
   10   HD22  LEU  94          HD22      LEU  94   7.820  15.488   6.671
   11   HD21  LEU  94          HD23      LEU  94   9.159  15.357   5.530

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  95           H        ILE  95   5.201  18.164   2.702
    2    HA   ILE  95           HA       ILE  95   6.799  20.505   2.653
    3    HB   ILE  95           HB       ILE  95   4.150  19.854   1.341
    4   HG12  ILE  95          HG12      ILE  95   6.944  20.165   0.210
    5   HG13  ILE  95          HG13      ILE  95   6.277  18.617   0.719
    6   HG21  ILE  95          HG21      ILE  95   5.926  22.303   1.132
    7   HG23  ILE  95          HG22      ILE  95   4.200  22.253   1.485
    8   HG22  ILE  95          HG23      ILE  95   4.781  21.851  -0.132
    9   HD13  ILE  95          HD11      ILE  95   4.719  18.563  -1.013
   10   HD12  ILE  95          HD12      ILE  95   6.078  19.369  -1.796
   11   HD11  ILE  95          HD13      ILE  95   4.715  20.317  -1.203

  No H/Q in entry =          11
  In of MODEL   50
    1    H    GLU  96           H        GLU  96   3.541  19.884   3.941
    2    HA   GLU  96           HA       GLU  96   2.948  22.535   4.699
    3    HB2  GLU  96           HB2      GLU  96   1.254  20.770   4.703
    4    HB3  GLU  96           HB3      GLU  96   2.105  19.930   5.997
    5    HG2  GLU  96           HG2      GLU  96   1.096  21.219   7.569
    6    HG3  GLU  96           HG3      GLU  96   1.648  22.689   6.777

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LEU  97           H        LEU  97   4.760  19.959   6.319
    2    HA   LEU  97           HA       LEU  97   5.128  21.296   8.795
    3    HB2  LEU  97           HB2      LEU  97   6.644  19.115   7.377
    4    HB3  LEU  97           HB3      LEU  97   7.239  19.788   8.892
    5    HG   LEU  97           HG       LEU  97   4.418  18.727   8.573
    6   HD12  LEU  97          HD11      LEU  97   5.333  16.700   9.781
    7   HD11  LEU  97          HD12      LEU  97   6.952  17.315   9.441
    8   HD13  LEU  97          HD13      LEU  97   5.879  16.873   8.112
    9   HD23  LEU  97          HD21      LEU  97   4.863  18.419  11.137
   10   HD22  LEU  97          HD22      LEU  97   4.502  20.037  10.537
   11   HD21  LEU  97          HD23      LEU  97   6.167  19.578  10.883

  No H/Q in entry =          11
  In of MODEL   50
    1    H    HIS  98           H        HIS  98   7.004  21.301   5.773
    2    HA   HIS  98           HA       HIS  98   9.174  22.853   6.681
    3    HB2  HIS  98           HB2      HIS  98   7.883  22.621   3.952
    4    HB3  HIS  98           HB3      HIS  98   9.333  23.582   4.248
    5    HD1  HIS  98           HD1      HIS  98   8.081  20.026   4.254
    6    HD2  HIS  98           HD2      HIS  98  11.685  22.080   4.692
    7    HE1  HIS  98           HE1      HIS  98   9.916  18.275   4.195
    8    HE2  HIS  98           HE2      HIS  98  12.115  19.506   4.462

  No H/Q in entry =           8
  In of MODEL   50
    1    H    GLU  99           H        GLU  99   5.965  23.728   5.503
    2    HA   GLU  99           HA       GLU  99   6.376  26.539   5.454
    3    HB2  GLU  99           HB2      GLU  99   4.486  25.395   4.317
    4    HB3  GLU  99           HB3      GLU  99   3.783  25.037   5.893
    5    HG2  GLU  99           HG2      GLU  99   3.629  27.429   6.402
    6    HG3  GLU  99           HG3      GLU  99   4.413  27.825   4.875

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LYS 100           H        LYS 100   5.215  24.309   7.967
    2    HA   LYS 100           HA       LYS 100   4.649  26.364   9.867
    3    HB2  LYS 100           HB2      LYS 100   5.190  23.405  10.204
    4    HB3  LYS 100           HB3      LYS 100   4.753  24.478  11.539
    5    HG2  LYS 100           HG2      LYS 100   2.696  25.144  10.289
    6    HG3  LYS 100           HG3      LYS 100   3.112  23.974   9.034
    7    HD2  LYS 100           HD2      LYS 100   3.010  22.149  10.689
    8    HD3  LYS 100           HD3      LYS 100   2.611  23.312  11.956
    9    HE2  LYS 100           HE2      LYS 100   0.568  23.962  10.691
   10    HE3  LYS 100           HE3      LYS 100   0.956  22.741   9.472
   11    HZ1  LYS 100           HZ1      LYS 100   0.677  22.069  12.350
   12    HZ3  LYS 100           HZ2      LYS 100   0.651  21.019  11.012
   13    HZ2  LYS 100           HZ3      LYS 100  -0.652  22.073  11.293

  No H/Q in entry =          13
  In of MODEL   50
    1    H    LEU 101           H        LEU 101   7.553  24.536   9.032
    2    HA   LEU 101           HA       LEU 101   9.157  25.350  11.241
    3    HB2  LEU 101           HB2      LEU 101   9.745  24.365   8.461
    4    HB3  LEU 101           HB3      LEU 101  11.053  25.012   9.446
    5    HG   LEU 101           HG       LEU 101   9.194  22.874  10.500
    6   HD12  LEU 101          HD11      LEU 101  11.231  21.357   9.891
    7   HD11  LEU 101          HD12      LEU 101  11.615  22.619   8.723
    8   HD13  LEU 101          HD13      LEU 101  10.076  21.765   8.623
    9   HD21  LEU 101          HD21      LEU 101  11.930  23.947  11.236
   10   HD23  LEU 101          HD22      LEU 101  11.366  22.379  11.810
   11   HD22  LEU 101          HD23      LEU 101  10.491  23.845  12.251

  No H/Q in entry =          11
  In of MODEL   50
    1    H    LYS 102           H        LYS 102   7.601  27.239   9.103
    2    HA   LYS 102           HA       LYS 102   7.706  29.532   8.819
    3    HB2  LYS 102           HB2      LYS 102   9.266  29.391  10.920
    4    HB3  LYS 102           HB3      LYS 102  10.569  29.574   9.763
    5    HG2  LYS 102           HG2      LYS 102   8.486  31.549  10.628
    6    HG3  LYS 102           HG3      LYS 102  10.202  31.789  10.380
    7    HD2  LYS 102           HD2      LYS 102   8.250  31.397   8.076
    8    HD3  LYS 102           HD3      LYS 102   8.651  32.970   8.750
    9    HE2  LYS 102           HE2      LYS 102  10.013  31.776   6.675
   10    HE3  LYS 102           HE3      LYS 102  10.644  33.071   7.692
   11    HZ2  LYS 102           HZ1      LYS 102  12.141  31.149   7.513
   12    HZ1  LYS 102           HZ2      LYS 102  10.966  30.178   8.250
   13    HZ3  LYS 102           HZ3      LYS 102  11.672  31.454   9.114

  No H/Q in entry =          13
  In of MODEL   50
    1    H    ALA 103           H        ALA 103  10.947  28.155   8.256
    2    HA   ALA 103           HA       ALA 103  11.932  29.527   6.186
    3    HB2  ALA 103           HB1      ALA 103  12.791  27.305   5.253
    4    HB1  ALA 103           HB2      ALA 103  11.885  26.538   6.555
    5    HB3  ALA 103           HB3      ALA 103  13.187  27.664   6.934

  No H/Q in entry =           5
  In of MODEL   50
    1    H1   LYS   3           H1       LYS   3 -31.631   5.393 -19.953
    2    H2   LYS   3           H3       LYS   3 -30.634   5.103 -21.296
    3    H3   LYS   3           H2       LYS   3 -31.999   4.131 -21.026
    4    HA   LYS   3           HA       LYS   3 -30.955   2.806 -19.591
    5    HB2  LYS   3           HB2      LYS   3 -28.718   4.256 -20.958
    6    HB3  LYS   3           HB3      LYS   3 -28.357   3.088 -19.687
    7    HG2  LYS   3           HG2      LYS   3 -29.730   1.427 -21.000
    8    HG3  LYS   3           HG3      LYS   3 -29.721   2.598 -22.318
    9    HD2  LYS   3           HD2      LYS   3 -27.235   2.562 -22.266
   10    HD3  LYS   3           HD3      LYS   3 -27.315   1.288 -21.049
   11    HE2  LYS   3           HE2      LYS   3 -28.777   0.028 -22.737
   12    HE3  LYS   3           HE3      LYS   3 -28.193   1.197 -23.921
   13    HZ3  LYS   3           HZ1      LYS   3 -26.358   0.018 -24.162
   14    HZ2  LYS   3           HZ2      LYS   3 -26.952  -1.144 -23.076
   15    HZ1  LYS   3           HZ3      LYS   3 -26.001   0.143 -22.507

  No H/Q in entry =          15
  In of MODEL   50
    1    H    LYS   4           H        LYS   4 -31.004   2.711 -17.527
    2    HA   LYS   4           HA       LYS   4 -30.343   5.055 -15.931
    3    HB2  LYS   4           HB2      LYS   4 -31.463   2.345 -15.168
    4    HB3  LYS   4           HB3      LYS   4 -31.282   3.715 -14.073
    5    HG2  LYS   4           HG2      LYS   4 -33.087   3.543 -16.492
    6    HG3  LYS   4           HG3      LYS   4 -33.579   3.619 -14.801
    7    HD2  LYS   4           HD2      LYS   4 -32.949   5.866 -14.587
    8    HD3  LYS   4           HD3      LYS   4 -31.908   5.805 -16.008
    9    HE2  LYS   4           HE2      LYS   4 -33.874   7.110 -16.501
   10    HE3  LYS   4           HE3      LYS   4 -33.910   5.614 -17.436
   11    HZ3  LYS   4           HZ1      LYS   4 -35.459   4.693 -15.867
   12    HZ2  LYS   4           HZ2      LYS   4 -36.057   6.157 -16.485
   13    HZ1  LYS   4           HZ3      LYS   4 -35.397   6.102 -14.921

  No H/Q in entry =          13
  In of MODEL   50
    1    H    HIS   5           H        HIS   5 -28.878   5.220 -14.342
    2    HA   HIS   5           HA       HIS   5 -26.544   3.450 -14.633
    3    HB2  HIS   5           HB2      HIS   5 -26.877   6.223 -13.491
    4    HB3  HIS   5           HB3      HIS   5 -25.368   5.312 -13.453
    5    HD1  HIS   5           HD1      HIS   5 -23.933   6.516 -15.071
    6    HD2  HIS   5           HD2      HIS   5 -27.714   5.752 -16.608
    7    HE1  HIS   5           HE1      HIS   5 -23.782   7.044 -17.534
    8    HE2  HIS   5           HE2      HIS   5 -26.087   6.567 -18.440

  No H/Q in entry =           8
  In of MODEL   50
    1    H    ILE   6           H        ILE   6 -26.270   1.915 -13.281
    2    HA   ILE   6           HA       ILE   6 -27.253   2.220 -10.522
    3    HB   ILE   6           HB       ILE   6 -26.360  -0.258 -12.003
    4   HG12  ILE   6          HG12      ILE   6 -29.128   0.621 -11.172
    5   HG13  ILE   6          HG13      ILE   6 -28.490   0.763 -12.810
    6   HG23  ILE   6          HG21      ILE   6 -26.698  -1.477 -10.114
    7   HG22  ILE   6          HG22      ILE   6 -27.886  -0.347  -9.461
    8   HG21  ILE   6          HG23      ILE   6 -26.167   0.038  -9.380
    9   HD13  ILE   6          HD11      ILE   6 -28.891  -1.379 -13.261
   10   HD12  ILE   6          HD12      ILE   6 -29.906  -1.357 -11.819
   11   HD11  ILE   6          HD13      ILE   6 -28.236  -1.916 -11.713

  No H/Q in entry =          11
  In of MODEL   50
    1    H    TYR   7           H        TYR   7 -25.512   2.939  -9.253
    2    HA   TYR   7           HA       TYR   7 -22.776   2.041  -9.911
    3    HB2  TYR   7           HB2      TYR   7 -23.805   4.481  -8.486
    4    HB3  TYR   7           HB3      TYR   7 -22.107   4.012  -8.514
    5    HD1  TYR   7           HD1      TYR   7 -23.121   2.970 -11.581
    6    HD2  TYR   7           HD2      TYR   7 -22.548   6.610  -9.439
    7    HE1  TYR   7           HE1      TYR   7 -22.723   4.162 -13.701
    8    HE2  TYR   7           HE2      TYR   7 -22.192   7.807 -11.550
    9    HH   TYR   7           HH       TYR   7 -22.409   7.662 -13.779

  No H/Q in entry =           9
  In of MODEL   50
    1    H    LEU   8           H        LEU   8 -21.773   0.747  -8.552
    2    HA   LEU   8           HA       LEU   8 -22.890   0.285  -5.857
    3    HB2  LEU   8           HB2      LEU   8 -21.143  -1.374  -7.653
    4    HB3  LEU   8           HB3      LEU   8 -21.319  -1.722  -5.933
    5    HG   LEU   8           HG       LEU   8 -23.792  -1.971  -6.350
    6   HD13  LEU   8          HD11      LEU   8 -23.956  -0.808  -8.487
    7   HD12  LEU   8          HD12      LEU   8 -24.440  -2.491  -8.688
    8   HD11  LEU   8          HD13      LEU   8 -22.846  -1.962  -9.225
    9   HD23  LEU   8          HD21      LEU   8 -22.463  -4.016  -7.996
   10   HD22  LEU   8          HD22      LEU   8 -23.545  -4.180  -6.614
   11   HD21  LEU   8          HD23      LEU   8 -21.849  -3.775  -6.360

  No H/Q in entry =          11
  In of MODEL   50
    1    H    PHE   9           H        PHE   9 -21.626   0.748  -4.081
    2    HA   PHE   9           HA       PHE   9 -18.863   1.739  -4.607
    3    HB2  PHE   9           HB2      PHE   9 -20.901   2.808  -2.658
    4    HB3  PHE   9           HB3      PHE   9 -19.205   3.273  -2.669
    5    HD1  PHE   9           HD1      PHE   9 -18.266   4.591  -4.488
    6    HD2  PHE   9           HD2      PHE   9 -22.420   3.517  -4.451
    7    HE1  PHE   9           HE1      PHE   9 -18.708   6.233  -6.290
    8    HE2  PHE   9           HE2      PHE   9 -22.864   5.170  -6.248
    9    HZ   PHE   9           HZ       PHE   9 -21.004   6.523  -7.174

  No H/Q in entry =           9
  In of MODEL   50
    1    H    SER  10           H        SER  10 -17.244   0.905  -3.429
    2    HA   SER  10           HA       SER  10 -17.452   0.046  -0.735
    3    HB2  SER  10           HB2      SER  10 -17.175  -2.342  -1.017
    4    HB3  SER  10           HB3      SER  10 -18.637  -1.839  -1.851
    5    HG   SER  10           HG       SER  10 -17.085  -1.607  -3.718

  No H/Q in entry =           5
  In of MODEL   50
    1    H    SER  11           H        SER  11 -15.436   0.173   0.115
    2    HA   SER  11           HA       SER  11 -13.260   1.062  -1.419
    3    HB2  SER  11           HB2      SER  11 -13.744   1.231   1.135
    4    HB3  SER  11           HB3      SER  11 -12.851  -0.289   1.215
    5    HG   SER  11           HG       SER  11 -12.005   2.250   0.296

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ALA  12           H        ALA  12 -14.388  -1.631  -2.236
    2    HA   ALA  12           HA       ALA  12 -11.799  -2.848  -2.753
    3    HB3  ALA  12           HB1      ALA  12 -12.229  -4.049  -0.766
    4    HB2  ALA  12           HB2      ALA  12 -12.713  -5.139  -2.065
    5    HB1  ALA  12           HB3      ALA  12 -13.939  -4.251  -1.160

  No H/Q in entry =           5
  In of MODEL   50
    1    H    GLY  13           H        GLY  13 -12.693  -1.849  -4.770
    2    HA3  GLY  13           HA2      GLY  13 -14.915  -2.696  -6.193
    3    HA2  GLY  13           HA3      GLY  13 -13.411  -2.148  -6.947

  No H/Q in entry =           3
  In of MODEL   50
    1    H    MET  14           H        MET  14 -11.799  -4.383  -5.901
    2    HA   MET  14           HA       MET  14 -12.053  -6.153  -8.036
    3    HB2  MET  14           HB2      MET  14 -10.036  -6.051  -6.570
    4    HB3  MET  14           HB3      MET  14 -10.915  -6.951  -5.335
    5    HG2  MET  14           HG2      MET  14  -9.697  -8.608  -6.509
    6    HG3  MET  14           HG3      MET  14 -11.310  -8.708  -7.216
    7    HE2  MET  14           HE1      MET  14  -7.427  -8.034  -9.239
    8    HE1  MET  14           HE2      MET  14  -7.947  -9.063  -7.907
    9    HE3  MET  14           HE3      MET  14  -7.647  -7.351  -7.620

  No H/Q in entry =           9
  In of MODEL   50
    1    H    SER  15           H        SER  15 -13.255  -6.727  -4.730
    2    HA   SER  15           HA       SER  15 -14.516  -9.208  -5.479
    3    HB2  SER  15           HB2      SER  15 -14.043  -9.069  -3.158
    4    HB3  SER  15           HB3      SER  15 -14.787  -7.478  -3.024
    5    HG   SER  15           HG       SER  15 -16.779  -8.379  -3.219

  No H/Q in entry =           5
  In of MODEL   50
    1    H    THR  16           H        THR  16 -15.695  -5.865  -5.063
    2    HA   THR  16           HA       THR  16 -18.476  -6.429  -5.563
    3    HB   THR  16           HB       THR  16 -16.973  -3.849  -6.127
    4    HG1  THR  16           HG1      THR  16 -18.261  -3.911  -3.775
    5   HG21  THR  16          HG21      THR  16 -19.385  -4.175  -6.902
    6   HG23  THR  16          HG22      THR  16 -19.095  -2.789  -5.836
    7   HG22  THR  16          HG23      THR  16 -19.812  -4.275  -5.198

  No H/Q in entry =           7
  In of MODEL   50
    1    H    SER  17           H        SER  17 -15.678  -5.816  -7.442
    2    HA   SER  17           HA       SER  17 -16.823  -5.167  -9.961
    3    HB2  SER  17           HB2      SER  17 -14.155  -6.345  -9.181
    4    HB3  SER  17           HB3      SER  17 -14.598  -6.076 -10.866
    5    HG   SER  17           HG       SER  17 -15.175  -3.872  -9.544

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LEU  18           H        LEU  18 -16.169  -8.259  -8.439
    2    HA   LEU  18           HA       LEU  18 -16.710  -9.830 -10.758
    3    HB2  LEU  18           HB2      LEU  18 -15.467 -10.691  -8.809
    4    HB3  LEU  18           HB3      LEU  18 -16.927 -10.551  -7.830
    5    HG   LEU  18           HG       LEU  18 -18.052 -12.189  -9.268
    6   HD12  LEU  18          HD11      LEU  18 -16.390 -13.489 -10.808
    7   HD11  LEU  18          HD12      LEU  18 -15.457 -11.993 -10.764
    8   HD13  LEU  18          HD13      LEU  18 -17.105 -11.988 -11.390
    9   HD21  LEU  18          HD21      LEU  18 -16.589 -12.759  -7.259
   10   HD23  LEU  18          HD22      LEU  18 -15.432 -13.360  -8.448
   11   HD22  LEU  18          HD23      LEU  18 -17.048 -14.061  -8.357

  No H/Q in entry =          11
  In of MODEL   50
    1    H    LEU  19           H        LEU  19 -18.715  -8.615  -8.077
    2    HA   LEU  19           HA       LEU  19 -21.143  -9.886  -8.883
    3    HB2  LEU  19           HB2      LEU  19 -20.919  -9.003  -6.653
    4    HB3  LEU  19           HB3      LEU  19 -20.646  -7.380  -7.285
    5    HG   LEU  19           HG       LEU  19 -22.986  -7.307  -8.056
    6   HD11  LEU  19          HD11      LEU  19 -23.182  -9.966  -6.630
    7   HD13  LEU  19          HD12      LEU  19 -23.393  -9.691  -8.359
    8   HD12  LEU  19          HD13      LEU  19 -24.554  -9.023  -7.213
    9   HD22  LEU  19          HD21      LEU  19 -22.430  -6.330  -5.948
   10   HD21  LEU  19          HD22      LEU  19 -22.503  -7.899  -5.145
   11   HD23  LEU  19          HD23      LEU  19 -23.975  -7.164  -5.780

  No H/Q in entry =          11
  In of MODEL   50
    1    H    VAL  20           H        VAL  20 -19.736  -6.701  -9.651
    2    HA   VAL  20           HA       VAL  20 -21.875  -5.757 -11.245
    3    HB   VAL  20           HB       VAL  20 -18.905  -5.089 -11.465
    4   HG11  VAL  20          HG11      VAL  20 -21.326  -3.751 -12.697
    5   HG13  VAL  20          HG12      VAL  20 -19.970  -4.488 -13.551
    6   HG12  VAL  20          HG13      VAL  20 -19.728  -3.013 -12.615
    7   HG21  VAL  20          HG21      VAL  20 -21.176  -3.945  -9.898
    8   HG23  VAL  20          HG22      VAL  20 -19.814  -2.933 -10.373
    9   HG22  VAL  20          HG23      VAL  20 -19.545  -4.358  -9.369

  No H/Q in entry =           9
  In of MODEL   50
    1    H    SER  21           H        SER  21 -19.060  -7.753 -12.223
    2    HA   SER  21           HA       SER  21 -19.844  -7.728 -14.976
    3    HB2  SER  21           HB2      SER  21 -18.353  -9.663 -15.261
    4    HB3  SER  21           HB3      SER  21 -17.560  -8.371 -14.363
    5    HG   SER  21           HG       SER  21 -17.527  -9.559 -12.631

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LYS  22           H        LYS  22 -20.850  -9.882 -12.353
    2    HA   LYS  22           HA       LYS  22 -22.341 -11.587 -14.138
    3    HB2  LYS  22           HB2      LYS  22 -21.557 -12.221 -11.811
    4    HB3  LYS  22           HB3      LYS  22 -22.856 -11.199 -11.194
    5    HG2  LYS  22           HG2      LYS  22 -23.694 -13.391 -11.125
    6    HG3  LYS  22           HG3      LYS  22 -24.448 -12.645 -12.534
    7    HD2  LYS  22           HD2      LYS  22 -22.997 -13.801 -14.030
    8    HD3  LYS  22           HD3      LYS  22 -21.972 -14.354 -12.704
    9    HE2  LYS  22           HE2      LYS  22 -23.324 -16.206 -13.415
   10    HE3  LYS  22           HE3      LYS  22 -23.910 -15.677 -11.837
   11    HZ3  LYS  22           HZ1      LYS  22 -25.896 -15.224 -12.665
   12    HZ2  LYS  22           HZ2      LYS  22 -25.424 -16.087 -14.050
   13    HZ1  LYS  22           HZ3      LYS  22 -25.264 -14.397 -14.008

  No H/Q in entry =          13
  In of MODEL   50
    1    H    MET  23           H        MET  23 -23.146  -8.642 -12.338
    2    HA   MET  23           HA       MET  23 -25.950  -8.809 -12.844
    3    HB2  MET  23           HB2      MET  23 -24.166  -6.439 -12.325
    4    HB3  MET  23           HB3      MET  23 -25.916  -6.322 -12.508
    5    HG2  MET  23           HG2      MET  23 -26.274  -7.588 -10.509
    6    HG3  MET  23           HG3      MET  23 -24.554  -7.950 -10.373
    7    HE2  MET  23           HE1      MET  23 -26.951  -4.335  -9.271
    8    HE1  MET  23           HE2      MET  23 -27.177  -5.344 -10.698
    9    HE3  MET  23           HE3      MET  23 -26.180  -3.891 -10.795

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ARG  24           H        ARG  24 -23.233  -7.349 -14.659
    2    HA   ARG  24           HA       ARG  24 -24.762  -6.136 -16.690
    3    HB2  ARG  24           HB2      ARG  24 -22.162  -5.999 -16.132
    4    HB3  ARG  24           HB3      ARG  24 -22.060  -7.293 -17.300
    5    HG2  ARG  24           HG2      ARG  24 -21.683  -5.406 -18.660
    6    HG3  ARG  24           HG3      ARG  24 -23.440  -5.642 -18.848
    7    HD2  ARG  24           HD2      ARG  24 -23.800  -4.089 -16.895
    8    HD3  ARG  24           HD3      ARG  24 -22.066  -3.793 -16.886
    9    HE   ARG  24           HE       ARG  24 -23.855  -2.728 -18.849
   10   HH21  ARG  24          HH11      ARG  24 -22.826  -2.038 -20.726
   11   HH22  ARG  24          HH12      ARG  24 -21.159  -1.580 -20.671
   12   HH11  ARG  24          HH21      ARG  24 -20.806  -2.843 -17.383
   13   HH12  ARG  24          HH22      ARG  24 -19.976  -2.051 -18.686

  No H/Q in entry =          13
  In of MODEL   50
    1    H    ALA  25           H        ALA  25 -23.554  -9.437 -16.336
    2    HA   ALA  25           HA       ALA  25 -24.157 -10.344 -18.954
    3    HB1  ALA  25           HB1      ALA  25 -23.411 -12.341 -18.211
    4    HB3  ALA  25           HB2      ALA  25 -24.470 -12.316 -16.802
    5    HB2  ALA  25           HB3      ALA  25 -22.937 -11.448 -16.766

  No H/Q in entry =           5
  In of MODEL   50
    1    H    GLN  26           H        GLN  26 -25.986 -10.361 -15.932
    2    HA   GLN  26           HA       GLN  26 -28.298 -11.645 -16.923
    3    HB2  GLN  26           HB2      GLN  26 -27.833  -9.832 -14.575
    4    HB3  GLN  26           HB3      GLN  26 -29.376 -10.603 -14.910
    5    HG2  GLN  26           HG2      GLN  26 -26.755 -11.982 -14.407
    6    HG3  GLN  26           HG3      GLN  26 -28.119 -11.889 -13.300
    7   HE21  GLN  26          HE21      GLN  26 -26.846 -14.050 -14.526
    8   HE22  GLN  26          HE22      GLN  26 -27.860 -15.141 -15.300

  No H/Q in entry =           8
  In of MODEL   50
    1    H    ALA  27           H        ALA  27 -27.450  -8.218 -16.607
    2    HA   ALA  27           HA       ALA  27 -29.965  -7.206 -17.417
    3    HB1  ALA  27           HB1      ALA  27 -28.191  -5.821 -16.330
    4    HB3  ALA  27           HB2      ALA  27 -28.798  -5.104 -17.824
    5    HB2  ALA  27           HB3      ALA  27 -27.241  -5.931 -17.814

  No H/Q in entry =           5
  In of MODEL   50
    1    H    GLU  28           H        GLU  28 -27.232  -8.402 -19.257
    2    HA   GLU  28           HA       GLU  28 -28.188  -7.442 -21.798
    3    HB2  GLU  28           HB2      GLU  28 -25.795  -8.050 -21.158
    4    HB3  GLU  28           HB3      GLU  28 -26.297  -9.732 -21.323
    5    HG2  GLU  28           HG2      GLU  28 -25.168  -8.971 -23.307
    6    HG3  GLU  28           HG3      GLU  28 -26.856  -9.344 -23.650

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LYS  29           H        LYS  29 -28.279 -10.514 -20.074
    2    HA   LYS  29           HA       LYS  29 -29.543 -12.059 -22.047
    3    HB2  LYS  29           HB2      LYS  29 -28.471 -12.972 -20.021
    4    HB3  LYS  29           HB3      LYS  29 -29.762 -12.276 -19.043
    5    HG2  LYS  29           HG2      LYS  29 -31.387 -13.712 -20.082
    6    HG3  LYS  29           HG3      LYS  29 -30.170 -14.342 -21.191
    7    HD2  LYS  29           HD2      LYS  29 -29.001 -15.441 -19.432
    8    HD3  LYS  29           HD3      LYS  29 -29.931 -14.596 -18.196
    9    HE2  LYS  29           HE2      LYS  29 -30.623 -16.970 -18.507
   10    HE3  LYS  29           HE3      LYS  29 -31.931 -15.816 -18.778
   11    HZ1  LYS  29           HZ1      LYS  29 -31.359 -15.988 -21.201
   12    HZ3  LYS  29           HZ2      LYS  29 -32.045 -17.378 -20.507
   13    HZ2  LYS  29           HZ3      LYS  29 -30.376 -17.314 -20.804

  No H/Q in entry =          13
  In of MODEL   50
    1    H    TYR  30           H        TYR  30 -30.990  -9.936 -19.591
    2    HA   TYR  30           HA       TYR  30 -33.639 -10.479 -20.824
    3    HB2  TYR  30           HB2      TYR  30 -33.019  -9.251 -18.128
    4    HB3  TYR  30           HB3      TYR  30 -34.629  -9.563 -18.778
    5    HD1  TYR  30           HD1      TYR  30 -35.481 -11.881 -18.942
    6    HD2  TYR  30           HD2      TYR  30 -31.668 -11.026 -17.251
    7    HE1  TYR  30           HE1      TYR  30 -35.334 -14.188 -18.094
    8    HE2  TYR  30           HE2      TYR  30 -31.522 -13.318 -16.408
    9    HH   TYR  30           HH       TYR  30 -33.100 -15.743 -17.451

  No H/Q in entry =           9
  In of MODEL   50
    1    H    GLU  31           H        GLU  31 -31.523  -8.451 -21.665
    2    HA   GLU  31           HA       GLU  31 -31.503  -6.311 -22.535
    3    HB2  GLU  31           HB2      GLU  31 -34.378  -7.111 -23.035
    4    HB3  GLU  31           HB3      GLU  31 -33.572  -5.739 -23.793
    5    HG2  GLU  31           HG2      GLU  31 -32.061  -7.164 -24.951
    6    HG3  GLU  31           HG3      GLU  31 -32.591  -8.572 -24.033

  No H/Q in entry =           6
  In of MODEL   50
    1    H    VAL  32           H        VAL  32 -31.708  -6.155 -19.806
    2    HA   VAL  32           HA       VAL  32 -33.626  -4.077 -19.194
    3    HB   VAL  32           HB       VAL  32 -31.210  -4.975 -17.590
    4   HG12  VAL  32          HG11      VAL  32 -32.770  -4.150 -15.714
    5   HG11  VAL  32          HG12      VAL  32 -33.625  -3.295 -16.999
    6   HG13  VAL  32          HG13      VAL  32 -31.927  -2.941 -16.683
    7   HG21  VAL  32          HG21      VAL  32 -32.933  -6.755 -18.243
    8   HG23  VAL  32          HG22      VAL  32 -33.996  -5.930 -17.101
    9   HG22  VAL  32          HG23      VAL  32 -32.461  -6.602 -16.550

  No H/Q in entry =           9
  In of MODEL   50
    1    HA   PRO  33           HA       PRO  33 -30.669  -1.107 -20.928
    2    HB2  PRO  33           HB2      PRO  33 -32.240   1.077 -20.852
    3    HB3  PRO  33           HB3      PRO  33 -32.672  -0.260 -21.919
    4    HG2  PRO  33           HG2      PRO  33 -33.657   0.290 -19.119
    5    HG3  PRO  33           HG3      PRO  33 -34.614   0.025 -20.577
    6    HD2  PRO  33           HD2      PRO  33 -34.105  -1.999 -18.866
    7    HD3  PRO  33           HD3      PRO  33 -34.159  -2.279 -20.607

  No H/Q in entry =           7
  In of MODEL   50
    1    H    VAL  34           H        VAL  34 -29.394  -1.575 -18.967
    2    HA   VAL  34           HA       VAL  34 -29.178   0.891 -17.371
    3    HB   VAL  34           HB       VAL  34 -28.560  -0.513 -15.402
    4   HG12  VAL  34          HG11      VAL  34 -30.948  -1.444 -15.078
    5   HG11  VAL  34          HG12      VAL  34 -31.283  -0.726 -16.652
    6   HG13  VAL  34          HG13      VAL  34 -30.759   0.293 -15.312
    7   HG21  VAL  34          HG21      VAL  34 -28.688  -2.586 -17.366
    8   HG23  VAL  34          HG22      VAL  34 -29.737  -2.946 -15.995
    9   HG22  VAL  34          HG23      VAL  34 -28.027  -2.607 -15.732

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ILE  35           H        ILE  35 -27.215   1.397 -16.539
    2    HA   ILE  35           HA       ILE  35 -24.873   0.105 -17.772
    3    HB   ILE  35           HB       ILE  35 -25.353   2.999 -17.022
    4   HG12  ILE  35          HG12      ILE  35 -24.332   1.665 -19.539
    5   HG13  ILE  35          HG13      ILE  35 -25.980   2.247 -19.293
    6   HG21  ILE  35          HG21      ILE  35 -22.750   1.531 -17.297
    7   HG23  ILE  35          HG22      ILE  35 -23.238   2.723 -16.094
    8   HG22  ILE  35          HG23      ILE  35 -22.869   3.233 -17.741
    9   HD11  ILE  35          HD11      ILE  35 -24.639   4.491 -18.737
   10   HD13  ILE  35          HD12      ILE  35 -25.163   4.059 -20.366
   11   HD12  ILE  35          HD13      ILE  35 -23.502   3.745 -19.861

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ILE  36           H        ILE  36 -23.618  -0.850 -16.150
    2    HA   ILE  36           HA       ILE  36 -24.078  -0.187 -13.294
    3    HB   ILE  36           HB       ILE  36 -23.176  -2.889 -14.344
    4   HG12  ILE  36          HG12      ILE  36 -26.005  -2.144 -13.598
    5   HG13  ILE  36          HG13      ILE  36 -25.432  -2.144 -15.267
    6   HG23  ILE  36          HG21      ILE  36 -23.506  -3.683 -12.213
    7   HG22  ILE  36          HG22      ILE  36 -24.668  -2.421 -11.802
    8   HG21  ILE  36          HG23      ILE  36 -22.947  -2.043 -11.879
    9   HD13  ILE  36          HD11      ILE  36 -25.536  -4.365 -15.426
   10   HD12  ILE  36          HD12      ILE  36 -26.606  -4.244 -14.030
   11   HD11  ILE  36          HD13      ILE  36 -24.898  -4.612 -13.801

  No H/Q in entry =          11
  In of MODEL   50
    1    H    GLU  37           H        GLU  37 -22.316   0.514 -12.201
    2    HA   GLU  37           HA       GLU  37 -19.604  -0.227 -13.099
    3    HB2  GLU  37           HB2      GLU  37 -20.516   2.557 -12.384
    4    HB3  GLU  37           HB3      GLU  37 -18.844   2.071 -12.665
    5    HG2  GLU  37           HG2      GLU  37 -21.023   1.998 -14.732
    6    HG3  GLU  37           HG3      GLU  37 -19.860   3.308 -14.535

  No H/Q in entry =           6
  In of MODEL   50
    1    H    ALA  38           H        ALA  38 -18.112  -0.387 -11.410
    2    HA   ALA  38           HA       ALA  38 -19.152  -0.178  -8.645
    3    HB1  ALA  38           HB1      ALA  38 -17.382  -2.099 -10.028
    4    HB3  ALA  38           HB2      ALA  38 -18.427  -2.334  -8.627
    5    HB2  ALA  38           HB3      ALA  38 -16.835  -1.602  -8.427

  No H/Q in entry =           5
  In of MODEL   50
    1    H    PHE  39           H        PHE  39 -17.948   1.097  -7.197
    2    HA   PHE  39           HA       PHE  39 -15.458   2.351  -8.118
    3    HB2  PHE  39           HB2      PHE  39 -17.828   3.841  -6.986
    4    HB3  PHE  39           HB3      PHE  39 -16.223   4.529  -7.217
    5    HD1  PHE  39           HD1      PHE  39 -15.310   4.752  -9.522
    6    HD2  PHE  39           HD2      PHE  39 -19.373   3.720  -8.740
    7    HE1  PHE  39           HE1      PHE  39 -15.910   5.414 -11.834
    8    HE2  PHE  39           HE2      PHE  39 -19.986   4.371 -11.042
    9    HZ   PHE  39           HZ       PHE  39 -18.256   5.190 -12.605

  No H/Q in entry =           9
  In of MODEL   50
    1    HA   PRO  40           HA       PRO  40 -14.502   1.717  -3.815
    2    HB2  PRO  40           HB2      PRO  40 -12.796   3.794  -3.251
    3    HB3  PRO  40           HB3      PRO  40 -12.312   2.454  -4.290
    4    HG2  PRO  40           HG2      PRO  40 -13.416   5.142  -5.096
    5    HG3  PRO  40           HG3      PRO  40 -11.965   4.331  -5.683
    6    HD2  PRO  40           HD2      PRO  40 -14.181   4.148  -7.090
    7    HD3  PRO  40           HD3      PRO  40 -13.185   2.711  -6.868

  No H/Q in entry =           7
  In of MODEL   50
    1    H    GLU  41           H        GLU  41 -15.155   2.720  -1.707
    2    HA   GLU  41           HA       GLU  41 -17.449   4.355  -1.728
    3    HB2  GLU  41           HB2      GLU  41 -17.216   4.418   0.686
    4    HB3  GLU  41           HB3      GLU  41 -16.890   2.789   0.093
    5    HG2  GLU  41           HG2      GLU  41 -15.233   3.029   1.654
    6    HG3  GLU  41           HG3      GLU  41 -14.399   3.550   0.191

  No H/Q in entry =           6
  In of MODEL   50
    1    H    THR  42           H        THR  42 -14.148   5.371  -1.798
    2    HA   THR  42           HA       THR  42 -14.579   7.945  -0.641
    3    HB   THR  42           HB       THR  42 -12.439   8.560  -1.747
    4    HG1  THR  42           HG1      THR  42 -12.451   5.912  -2.754
    5   HG23  THR  42          HG21      THR  42 -12.096   7.522   0.331
    6   HG22  THR  42          HG22      THR  42 -11.099   6.564  -0.766
    7   HG21  THR  42          HG23      THR  42 -12.673   5.960  -0.252

  No H/Q in entry =           7
  In of MODEL   50
    1    H    LEU  43           H        LEU  43 -15.446   6.758  -3.717
    2    HA   LEU  43           HA       LEU  43 -15.782   9.500  -4.747
    3    HB2  LEU  43           HB2      LEU  43 -16.062   6.813  -6.083
    4    HB3  LEU  43           HB3      LEU  43 -16.321   8.368  -6.873
    5    HG   LEU  43           HG       LEU  43 -13.679   7.372  -5.838
    6   HD12  LEU  43          HD11      LEU  43 -14.462   7.746  -8.710
    7   HD11  LEU  43          HD12      LEU  43 -14.752   6.218  -7.878
    8   HD13  LEU  43          HD13      LEU  43 -13.108   6.835  -8.040
    9   HD21  LEU  43          HD21      LEU  43 -14.603   9.886  -7.195
   10   HD23  LEU  43          HD22      LEU  43 -12.945   9.314  -7.392
   11   HD22  LEU  43          HD23      LEU  43 -13.559   9.701  -5.786

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ALA  44           H        ALA  44 -17.674   7.657  -2.856
    2    HA   ALA  44           HA       ALA  44 -20.144   7.413  -4.176
    3    HB2  ALA  44           HB1      ALA  44 -19.974   6.345  -2.056
    4    HB3  ALA  44           HB2      ALA  44 -21.122   7.662  -1.813
    5    HB1  ALA  44           HB3      ALA  44 -19.456   7.833  -1.262

  No H/Q in entry =           5
  In of MODEL   50
    1    H    GLY  45           H        GLY  45 -18.812  10.287  -2.703
    2    HA3  GLY  45           HA2      GLY  45 -21.293  11.704  -3.097
    3    HA2  GLY  45           HA3      GLY  45 -19.769  12.388  -2.533

  No H/Q in entry =           3
  In of MODEL   50
    1    H    GLU  46           H        GLU  46 -18.208  11.449  -4.803
    2    HA   GLU  46           HA       GLU  46 -18.910  13.606  -6.620
    3    HB2  GLU  46           HB2      GLU  46 -16.652  11.598  -6.581
    4    HB3  GLU  46           HB3      GLU  46 -16.824  12.868  -7.794
    5    HG2  GLU  46           HG2      GLU  46 -15.304  13.781  -6.326
    6    HG3  GLU  46           HG3      GLU  46 -16.829  14.474  -5.775

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LYS  47           H        LYS  47 -18.683  10.084  -6.979
    2    HA   LYS  47           HA       LYS  47 -19.784  10.212  -9.658
    3    HB2  LYS  47           HB2      LYS  47 -18.541   8.193  -7.941
    4    HB3  LYS  47           HB3      LYS  47 -19.909   7.578  -8.870
    5    HG2  LYS  47           HG2      LYS  47 -17.907   7.183 -10.102
    6    HG3  LYS  47           HG3      LYS  47 -18.827   8.445 -10.920
    7    HD2  LYS  47           HD2      LYS  47 -17.430  10.145  -9.801
    8    HD3  LYS  47           HD3      LYS  47 -16.475   8.851  -9.080
    9    HE2  LYS  47           HE2      LYS  47 -16.824   9.297 -12.038
   10    HE3  LYS  47           HE3      LYS  47 -15.426   9.809 -11.094
   11    HZ2  LYS  47           HZ1      LYS  47 -15.872   7.344 -12.267
   12    HZ1  LYS  47           HZ2      LYS  47 -15.970   7.097 -10.591
   13    HZ3  LYS  47           HZ3      LYS  47 -14.578   7.800 -11.266

  No H/Q in entry =          13
  In of MODEL   50
    1    H    GLY  48           H        GLY  48 -21.087   9.483  -6.495
    2    HA3  GLY  48           HA2      GLY  48 -23.434   8.209  -7.211
    3    HA2  GLY  48           HA3      GLY  48 -23.241   9.241  -5.794

  No H/Q in entry =           3
  In of MODEL   50
    1    H    GLN  49           H        GLN  49 -22.730  11.646  -7.417
    2    HA   GLN  49           HA       GLN  49 -25.322  12.676  -7.586
    3    HB2  GLN  49           HB2      GLN  49 -22.805  13.587  -8.964
    4    HB3  GLN  49           HB3      GLN  49 -24.295  14.509  -8.901
    5    HG2  GLN  49           HG2      GLN  49 -24.139  14.591  -6.465
    6    HG3  GLN  49           HG3      GLN  49 -22.661  13.647  -6.526
    7   HE21  GLN  49          HE21      GLN  49 -22.613  15.905  -5.302
    8   HE22  GLN  49          HE22      GLN  49 -21.727  17.174  -5.976

  No H/Q in entry =           8
  In of MODEL   50
    1    H    ASN  50           H        ASN  50 -23.584  10.797  -9.931
    2    HA   ASN  50           HA       ASN  50 -25.491  11.566 -12.032
    3    HB2  ASN  50           HB2      ASN  50 -22.865  10.100 -12.232
    4    HB3  ASN  50           HB3      ASN  50 -23.926  10.464 -13.584
    5   HD21  ASN  50          HD21      ASN  50 -21.318  11.425 -11.991
    6   HD22  ASN  50          HD22      ASN  50 -21.134  13.059 -12.369

  No H/Q in entry =           6
  In of MODEL   50
    1    H    ALA  51           H        ALA  51 -25.407   9.261  -9.736
    2    HA   ALA  51           HA       ALA  51 -26.125   7.053 -11.516
    3    HB2  ALA  51           HB1      ALA  51 -25.503   5.760  -9.800
    4    HB3  ALA  51           HB2      ALA  51 -26.650   6.557  -8.726
    5    HB1  ALA  51           HB3      ALA  51 -25.031   7.223  -8.936

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ASP  52           H        ASP  52 -28.098   5.942 -11.354
    2    HA   ASP  52           HA       ASP  52 -30.333   7.724 -10.730
    3    HB2  ASP  52           HB2      ASP  52 -30.067   5.190 -12.345
    4    HB3  ASP  52           HB3      ASP  52 -31.633   5.886 -11.927

  No H/Q in entry =           4
  In of MODEL   50
    1    H    VAL  53           H        VAL  53 -28.649   4.906  -9.650
    2    HA   VAL  53           HA       VAL  53 -30.096   5.046  -7.138
    3    HB   VAL  53           HB       VAL  53 -31.444   3.337  -8.346
    4   HG11  VAL  53          HG11      VAL  53 -29.672   2.496  -9.849
    5   HG13  VAL  53          HG12      VAL  53 -30.467   1.196  -8.962
    6   HG12  VAL  53          HG13      VAL  53 -28.873   1.756  -8.462
    7   HG23  VAL  53          HG21      VAL  53 -30.567   1.422  -6.611
    8   HG22  VAL  53          HG22      VAL  53 -31.734   2.700  -6.273
    9   HG21  VAL  53          HG23      VAL  53 -30.034   2.931  -5.869

  No H/Q in entry =           9
  In of MODEL   50
    1    H    VAL  54           H        VAL  54 -28.772   4.687  -5.473
    2    HA   VAL  54           HA       VAL  54 -25.988   3.905  -6.065
    3    HB   VAL  54           HB       VAL  54 -27.111   5.699  -3.855
    4   HG11  VAL  54          HG11      VAL  54 -24.492   4.349  -4.114
    5   HG13  VAL  54          HG12      VAL  54 -25.266   5.037  -2.687
    6   HG12  VAL  54          HG13      VAL  54 -24.390   6.083  -3.805
    7   HG22  VAL  54          HG21      VAL  54 -26.303   7.513  -4.993
    8   HG21  VAL  54          HG22      VAL  54 -26.821   6.479  -6.324
    9   HG23  VAL  54          HG23      VAL  54 -25.115   6.562  -5.885

  No H/Q in entry =           9
  In of MODEL   50
    1    H    LEU  55           H        LEU  55 -25.342   2.016  -5.381
    2    HA   LEU  55           HA       LEU  55 -26.814   0.709  -3.177
    3    HB2  LEU  55           HB2      LEU  55 -25.222  -0.463  -5.447
    4    HB3  LEU  55           HB3      LEU  55 -25.957  -1.390  -4.138
    5    HG   LEU  55           HG       LEU  55 -27.436   0.109  -6.290
    6   HD13  LEU  55          HD11      LEU  55 -27.082  -1.760  -7.469
    7   HD12  LEU  55          HD12      LEU  55 -28.016  -2.636  -6.255
    8   HD11  LEU  55          HD13      LEU  55 -26.263  -2.518  -6.105
    9   HD23  LEU  55          HD21      LEU  55 -28.677  -1.833  -4.394
   10   HD22  LEU  55          HD22      LEU  55 -29.410  -0.489  -5.271
   11   HD21  LEU  55          HD23      LEU  55 -28.400  -0.174  -3.861

  No H/Q in entry =          11
  In of MODEL   50
    1    H    LEU  56           H        LEU  56 -25.647   0.187  -1.360
    2    HA   LEU  56           HA       LEU  56 -22.726   0.665  -1.416
    3    HB2  LEU  56           HB2      LEU  56 -24.524   0.455   0.985
    4    HB3  LEU  56           HB3      LEU  56 -22.828   0.932   0.965
    5    HG   LEU  56           HG       LEU  56 -25.172   2.523  -0.036
    6   HD11  LEU  56          HD11      LEU  56 -24.049   2.229   2.493
    7   HD13  LEU  56          HD12      LEU  56 -25.077   3.558   1.957
    8   HD12  LEU  56          HD13      LEU  56 -23.324   3.710   1.868
    9   HD23  LEU  56          HD21      LEU  56 -23.275   4.272  -0.265
   10   HD22  LEU  56          HD22      LEU  56 -23.626   3.136  -1.568
   11   HD21  LEU  56          HD23      LEU  56 -22.265   2.846  -0.487

  No H/Q in entry =          11
  In of MODEL   50
    1    H    GLY  57           H        GLY  57 -21.301  -0.914  -0.847
    2    HA3  GLY  57           HA2      GLY  57 -22.148  -3.629  -0.985
    3    HA2  GLY  57           HA3      GLY  57 -20.540  -3.079  -0.518

  No H/Q in entry =           3
  In of MODEL   50
    1    HA   PRO  58           HA       PRO  58 -23.322  -4.115   3.214
    2    HB2  PRO  58           HB2      PRO  58 -22.565  -6.685   3.877
    3    HB3  PRO  58           HB3      PRO  58 -23.959  -6.338   2.855
    4    HG2  PRO  58           HG2      PRO  58 -21.207  -7.159   2.089
    5    HG3  PRO  58           HG3      PRO  58 -22.758  -7.678   1.427
    6    HD2  PRO  58           HD2      PRO  58 -21.199  -5.843   0.166
    7    HD3  PRO  58           HD3      PRO  58 -22.960  -5.808   0.062

  No H/Q in entry =           7
  In of MODEL   50
    1    H    GLN  59           H        GLN  59 -19.939  -4.506   2.619
    2    HA   GLN  59           HA       GLN  59 -19.186  -4.442   5.379
    3    HB2  GLN  59           HB2      GLN  59 -17.642  -3.647   2.908
    4    HB3  GLN  59           HB3      GLN  59 -16.963  -3.706   4.522
    5    HG2  GLN  59           HG2      GLN  59 -18.135  -6.057   3.047
    6    HG3  GLN  59           HG3      GLN  59 -16.423  -5.687   3.155
    7   HE21  GLN  59          HE21      GLN  59 -18.402  -7.580   4.216
    8   HE22  GLN  59          HE22      GLN  59 -18.098  -8.144   5.752

  No H/Q in entry =           8
  In of MODEL   50
    1    H    ILE  60           H        ILE  60 -20.188  -1.967   3.116
    2    HA   ILE  60           HA       ILE  60 -19.392   0.057   5.118
    3    HB   ILE  60           HB       ILE  60 -19.675   1.739   3.253
    4   HG12  ILE  60          HG12      ILE  60 -19.407  -0.527   1.323
    5   HG13  ILE  60          HG13      ILE  60 -21.010  -0.020   1.855
    6   HG21  ILE  60          HG21      ILE  60 -17.514   0.606   4.029
    7   HG23  ILE  60          HG22      ILE  60 -17.511   1.514   2.518
    8   HG22  ILE  60          HG23      ILE  60 -17.593  -0.247   2.487
    9   HD11  ILE  60          HD11      ILE  60 -20.191   2.366   1.160
   10   HD13  ILE  60          HD12      ILE  60 -20.719   1.232  -0.084
   11   HD12  ILE  60          HD13      ILE  60 -18.998   1.481   0.211

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ALA  61           H        ALA  61 -21.803  -1.594   5.221
    2    HA   ALA  61           HA       ALA  61 -24.074  -0.002   4.726
    3    HB1  ALA  61           HB1      ALA  61 -25.249  -1.495   6.082
    4    HB2  ALA  61           HB2      ALA  61 -23.842  -1.825   7.095
    5    HB3  ALA  61           HB3      ALA  61 -23.919  -2.469   5.455

  No H/Q in entry =           5
  In of MODEL   50
    1    H    TYR  62           H        TYR  62 -21.867   0.008   7.526
    2    HA   TYR  62           HA       TYR  62 -23.469   1.658   9.159
    3    HB2  TYR  62           HB2      TYR  62 -21.438   2.171  10.379
    4    HB3  TYR  62           HB3      TYR  62 -21.457   0.458   9.963
    5    HD1  TYR  62           HD1      TYR  62 -19.853  -0.456   8.336
    6    HD2  TYR  62           HD2      TYR  62 -19.765   3.681   9.402
    7    HE1  TYR  62           HE1      TYR  62 -17.646  -0.230   7.261
    8    HE2  TYR  62           HE2      TYR  62 -17.545   3.903   8.329
    9    HH   TYR  62           HH       TYR  62 -16.307   1.542   6.270

  No H/Q in entry =           9
  In of MODEL   50
    1    H    MET  63           H        MET  63 -21.848   2.499   6.285
    2    HA   MET  63           HA       MET  63 -21.759   5.349   6.917
    3    HB2  MET  63           HB2      MET  63 -21.111   3.791   4.414
    4    HB3  MET  63           HB3      MET  63 -20.961   5.543   4.561
    5    HG2  MET  63           HG2      MET  63 -19.252   5.259   6.267
    6    HG3  MET  63           HG3      MET  63 -19.405   3.508   6.134
    7    HE3  MET  63           HE1      MET  63 -16.360   5.487   4.846
    8    HE2  MET  63           HE2      MET  63 -16.176   3.743   4.671
    9    HE1  MET  63           HE3      MET  63 -16.984   4.406   6.092

  No H/Q in entry =           9
  In of MODEL   50
    1    H    LEU  64           H        LEU  64 -24.271   3.405   5.992
    2    HA   LEU  64           HA       LEU  64 -25.517   4.745   3.883
    3    HB2  LEU  64           HB2      LEU  64 -26.329   2.637   4.847
    4    HB3  LEU  64           HB3      LEU  64 -26.809   3.499   6.308
    5    HG   LEU  64           HG       LEU  64 -28.537   4.680   5.053
    6   HD13  LEU  64          HD11      LEU  64 -28.259   4.879   2.815
    7   HD12  LEU  64          HD12      LEU  64 -28.860   3.225   2.705
    8   HD11  LEU  64          HD13      LEU  64 -27.125   3.531   2.758
    9   HD23  LEU  64          HD21      LEU  64 -28.980   1.839   4.366
   10   HD22  LEU  64          HD22      LEU  64 -29.998   2.966   5.261
   11   HD21  LEU  64          HD23      LEU  64 -28.603   2.227   6.046

  No H/Q in entry =          11
  In of MODEL   50
    1    HA   PRO  65           HA       PRO  65 -27.782   7.900   6.565
    2    HB2  PRO  65           HB2      PRO  65 -25.787   8.160   8.814
    3    HB3  PRO  65           HB3      PRO  65 -27.534   8.395   8.854
    4    HG2  PRO  65           HG2      PRO  65 -26.546   6.187   9.830
    5    HG3  PRO  65           HG3      PRO  65 -27.964   6.094   8.786
    6    HD2  PRO  65           HD2      PRO  65 -25.076   5.540   8.097
    7    HD3  PRO  65           HD3      PRO  65 -26.510   4.607   7.669

  No H/Q in entry =           7
  In of MODEL   50
    1    H    GLU  66           H        GLU  66 -24.225   7.938   6.638
    2    HA   GLU  66           HA       GLU  66 -24.001  10.734   6.173
    3    HB2  GLU  66           HB2      GLU  66 -22.128   8.460   5.572
    4    HB3  GLU  66           HB3      GLU  66 -21.723  10.158   5.327
    5    HG2  GLU  66           HG2      GLU  66 -21.944  10.576   7.686
    6    HG3  GLU  66           HG3      GLU  66 -22.427   8.901   7.954

  No H/Q in entry =           6
  In of MODEL   50
    1    H    ILE  67           H        ILE  67 -24.031   7.938   3.981
    2    HA   ILE  67           HA       ILE  67 -23.657   9.605   1.651
    3    HB   ILE  67           HB       ILE  67 -24.482   6.681   1.894
    4   HG12  ILE  67          HG12      ILE  67 -21.882   7.897   0.946
    5   HG13  ILE  67          HG13      ILE  67 -22.167   7.506   2.641
    6   HG21  ILE  67          HG21      ILE  67 -24.471   8.511  -0.371
    7   HG23  ILE  67          HG22      ILE  67 -25.054   6.849  -0.284
    8   HG22  ILE  67          HG23      ILE  67 -23.354   7.170  -0.619
    9   HD12  ILE  67          HD11      ILE  67 -21.701   5.695   0.331
   10   HD11  ILE  67          HD12      ILE  67 -22.701   5.126   1.666
   11   HD13  ILE  67          HD13      ILE  67 -21.042   5.640   1.966

  No H/Q in entry =          11
  In of MODEL   50
    1    H    GLN  68           H        GLN  68 -26.501   8.517   3.307
    2    HA   GLN  68           HA       GLN  68 -28.352   9.359   1.314
    3    HB2  GLN  68           HB2      GLN  68 -28.600   9.060   4.304
    4    HB3  GLN  68           HB3      GLN  68 -29.933   9.601   3.298
    5    HG2  GLN  68           HG2      GLN  68 -29.911   7.543   2.067
    6    HG3  GLN  68           HG3      GLN  68 -28.448   7.020   2.882
    7   HE21  GLN  68          HE21      GLN  68 -30.594   5.607   2.776
    8   HE22  GLN  68          HE22      GLN  68 -31.412   5.162   4.201

  No H/Q in entry =           8
  In of MODEL   50
    1    H    ARG  69           H        ARG  69 -26.788  11.122   4.014
    2    HA   ARG  69           HA       ARG  69 -28.210  13.563   3.554
    3    HB2  ARG  69           HB2      ARG  69 -25.844  12.723   5.162
    4    HB3  ARG  69           HB3      ARG  69 -25.963  14.432   4.766
    5    HG2  ARG  69           HG2      ARG  69 -28.281  14.442   5.737
    6    HG3  ARG  69           HG3      ARG  69 -28.034  12.768   6.248
    7    HD2  ARG  69           HD2      ARG  69 -26.396  15.181   7.109
    8    HD3  ARG  69           HD3      ARG  69 -27.504  14.271   8.124
    9    HE   ARG  69           HE       ARG  69 -24.871  13.379   7.194
   10   HH21  ARG  69          HH11      ARG  69 -24.022  11.662   8.427
   11   HH22  ARG  69          HH12      ARG  69 -25.031  10.847   9.575
   12   HH11  ARG  69          HH21      ARG  69 -27.815  12.801   8.904
   13   HH12  ARG  69          HH22      ARG  69 -27.179  11.490   9.842

  No H/Q in entry =          13
  In of MODEL   50
    1    H    LEU  70           H        LEU  70 -25.307  12.193   2.223
    2    HA   LEU  70           HA       LEU  70 -24.248  14.557   1.005
    3    HB2  LEU  70           HB2      LEU  70 -23.201  12.276   1.649
    4    HB3  LEU  70           HB3      LEU  70 -23.804  11.762   0.075
    5    HG   LEU  70           HG       LEU  70 -22.242  13.147  -1.041
    6   HD11  LEU  70          HD11      LEU  70 -21.440  14.069   1.728
    7   HD13  LEU  70          HD12      LEU  70 -22.159  15.059   0.457
    8   HD12  LEU  70          HD13      LEU  70 -20.532  14.410   0.252
    9   HD22  LEU  70          HD21      LEU  70 -20.771  11.468  -0.771
   10   HD21  LEU  70          HD22      LEU  70 -21.685  10.956   0.646
   11   HD23  LEU  70          HD23      LEU  70 -20.325  12.064   0.827

  No H/Q in entry =          11
  In of MODEL   50
    1    H    LEU  71           H        LEU  71 -26.344  11.943  -0.054
    2    HA   LEU  71           HA       LEU  71 -26.901  13.363  -2.602
    3    HB2  LEU  71           HB2      LEU  71 -27.041  10.386  -2.092
    4    HB3  LEU  71           HB3      LEU  71 -27.189  11.210  -3.643
    5    HG   LEU  71           HG       LEU  71 -24.669  11.313  -1.983
    6   HD12  LEU  71          HD11      LEU  71 -24.687   9.632  -4.380
    7   HD11  LEU  71          HD12      LEU  71 -25.684   9.016  -3.063
    8   HD13  LEU  71          HD13      LEU  71 -23.971   9.338  -2.795
    9   HD22  LEU  71          HD21      LEU  71 -24.811  13.094  -3.516
   10   HD21  LEU  71          HD22      LEU  71 -25.286  12.012  -4.825
   11   HD23  LEU  71          HD23      LEU  71 -23.662  11.915  -4.145

  No H/Q in entry =          11
  In of MODEL   50
    1    HA   PRO  72           HA       PRO  72 -30.757  12.890   0.030
    2    HB2  PRO  72           HB2      PRO  72 -31.667  15.431  -0.107
    3    HB3  PRO  72           HB3      PRO  72 -30.348  15.030   0.994
    4    HG2  PRO  72           HG2      PRO  72 -30.187  16.168  -1.785
    5    HG3  PRO  72           HG3      PRO  72 -29.432  16.767  -0.309
    6    HD2  PRO  72           HD2      PRO  72 -28.063  15.198  -2.042
    7    HD3  PRO  72           HD3      PRO  72 -27.805  15.074  -0.302

  No H/Q in entry =           7
  In of MODEL   50
    1    H    ASN  73           H        ASN  73 -30.153  13.788  -3.205
    2    HA   ASN  73           HA       ASN  73 -33.006  13.409  -3.829
    3    HB2  ASN  73           HB2      ASN  73 -32.563  14.478  -5.950
    4    HB3  ASN  73           HB3      ASN  73 -32.060  15.497  -4.611
    5   HD21  ASN  73          HD21      ASN  73 -31.265  15.500  -7.289
    6   HD22  ASN  73          HD22      ASN  73 -29.595  15.368  -7.478

  No H/Q in entry =           6
  In of MODEL   50
    1    H    LYS  74           H        LYS  74 -30.982  11.203  -3.356
    2    HA   LYS  74           HA       LYS  74 -31.522   9.742  -5.873
    3    HB2  LYS  74           HB2      LYS  74 -28.984   9.534  -4.248
    4    HB3  LYS  74           HB3      LYS  74 -29.353   8.681  -5.747
    5    HG2  LYS  74           HG2      LYS  74 -29.144  11.660  -5.610
    6    HG3  LYS  74           HG3      LYS  74 -27.751  10.617  -5.891
    7    HD2  LYS  74           HD2      LYS  74 -28.850   9.625  -7.814
    8    HD3  LYS  74           HD3      LYS  74 -30.288  10.603  -7.515
    9    HE2  LYS  74           HE2      LYS  74 -29.101  12.622  -8.001
   10    HE3  LYS  74           HE3      LYS  74 -27.563  11.759  -8.073
   11    HZ2  LYS  74           HZ1      LYS  74 -29.045  12.287 -10.211
   12    HZ1  LYS  74           HZ2      LYS  74 -29.671  10.761  -9.805
   13    HZ3  LYS  74           HZ3      LYS  74 -28.010  10.946 -10.106

  No H/Q in entry =          13
  In of MODEL   50
    1    HA   PRO  75           HA       PRO  75 -32.861   6.797  -2.837
    2    HB2  PRO  75           HB2      PRO  75 -33.130   4.539  -4.370
    3    HB3  PRO  75           HB3      PRO  75 -34.281   5.870  -4.469
    4    HG2  PRO  75           HG2      PRO  75 -31.932   5.278  -6.228
    5    HG3  PRO  75           HG3      PRO  75 -33.589   5.675  -6.684
    6    HD2  PRO  75           HD2      PRO  75 -31.681   7.576  -6.682
    7    HD3  PRO  75           HD3      PRO  75 -33.321   7.958  -6.152

  No H/Q in entry =           7
  In of MODEL   50
    1    H    VAL  76           H        VAL  76 -31.389   5.798  -1.442
    2    HA   VAL  76           HA       VAL  76 -28.902   4.610  -2.523
    3    HB   VAL  76           HB       VAL  76 -29.218   6.129   0.102
    4   HG11  VAL  76          HG11      VAL  76 -26.838   4.854  -1.263
    5   HG13  VAL  76          HG12      VAL  76 -27.526   4.426   0.306
    6   HG12  VAL  76          HG13      VAL  76 -26.709   5.974   0.095
    7   HG22  VAL  76          HG21      VAL  76 -28.584   8.022  -0.827
    8   HG21  VAL  76          HG22      VAL  76 -29.114   7.283  -2.339
    9   HG23  VAL  76          HG23      VAL  76 -27.410   7.235  -1.883

  No H/Q in entry =           9
  In of MODEL   50
    1    H    GLU  77           H        GLU  77 -28.646   2.474  -1.863
    2    HA   GLU  77           HA       GLU  77 -29.419   1.731   0.807
    3    HB2  GLU  77           HB2      GLU  77 -30.996   0.044   0.313
    4    HB3  GLU  77           HB3      GLU  77 -31.572   1.540  -0.421
    5    HG2  GLU  77           HG2      GLU  77 -30.949   0.746  -2.592
    6    HG3  GLU  77           HG3      GLU  77 -30.280  -0.724  -1.886

  No H/Q in entry =           6
  In of MODEL   50
    1    H    VAL  78           H        VAL  78 -29.054  -0.334   1.514
    2    HA   VAL  78           HA       VAL  78 -26.374  -1.076   0.642
    3    HB   VAL  78           HB       VAL  78 -28.066  -1.939   3.026
    4   HG11  VAL  78          HG11      VAL  78 -25.703  -3.149   1.928
    5   HG13  VAL  78          HG12      VAL  78 -26.604  -3.605   3.377
    6   HG12  VAL  78          HG13      VAL  78 -25.306  -2.417   3.482
    7   HG22  VAL  78          HG21      VAL  78 -26.633  -0.520   4.334
    8   HG21  VAL  78          HG22      VAL  78 -27.386   0.407   3.037
    9   HG23  VAL  78          HG23      VAL  78 -25.700  -0.092   2.900

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ILE  79           H        ILE  79 -25.801  -2.994  -0.222
    2    HA   ILE  79           HA       ILE  79 -27.834  -4.538  -1.535
    3    HB   ILE  79           HB       ILE  79 -24.833  -5.005  -1.304
    4   HG12  ILE  79          HG12      ILE  79 -26.490  -3.982  -3.615
    5   HG13  ILE  79          HG13      ILE  79 -25.635  -2.931  -2.485
    6   HG22  ILE  79          HG21      ILE  79 -25.913  -6.256  -3.595
    7   HG21  ILE  79          HG22      ILE  79 -26.888  -6.765  -2.217
    8   HG23  ILE  79          HG23      ILE  79 -25.142  -7.011  -2.200
    9   HD13  ILE  79          HD11      ILE  79 -24.218  -3.058  -4.301
   10   HD12  ILE  79          HD12      ILE  79 -24.526  -4.778  -4.543
   11   HD11  ILE  79          HD13      ILE  79 -23.552  -4.241  -3.174

  No H/Q in entry =          11
  In of MODEL   50
    1    H    ASP  80           H        ASP  80 -28.662  -6.464  -0.909
    2    HA   ASP  80           HA       ASP  80 -28.593  -7.304   1.756
    3    HB2  ASP  80           HB2      ASP  80 -30.336  -7.949   0.130
    4    HB3  ASP  80           HB3      ASP  80 -29.159  -8.954  -0.716

  No H/Q in entry =           4
  In of MODEL   50
    1    H    SER  81           H        SER  81 -27.037  -8.385   2.911
    2    HA   SER  81           HA       SER  81 -24.529  -9.047   1.735
    3    HB2  SER  81           HB2      SER  81 -23.960 -10.019   3.928
    4    HB3  SER  81           HB3      SER  81 -24.687  -8.422   4.103
    5    HG   SER  81           HG       SER  81 -26.479  -9.290   4.878

  No H/Q in entry =           5
  In of MODEL   50
    1    H    LEU  82           H        LEU  82 -27.200 -11.181   2.104
    2    HA   LEU  82           HA       LEU  82 -25.608 -13.531   1.636
    3    HB2  LEU  82           HB2      LEU  82 -28.554 -12.968   1.381
    4    HB3  LEU  82           HB3      LEU  82 -27.830 -14.561   1.181
    5    HG   LEU  82           HG       LEU  82 -27.764 -12.960   3.720
    6   HD11  LEU  82          HD11      LEU  82 -29.602 -15.100   2.673
    7   HD13  LEU  82          HD12      LEU  82 -30.016 -13.577   3.462
    8   HD12  LEU  82          HD13      LEU  82 -29.335 -14.903   4.406
    9   HD23  LEU  82          HD21      LEU  82 -27.152 -15.342   4.525
   10   HD22  LEU  82          HD22      LEU  82 -25.914 -14.397   3.698
   11   HD21  LEU  82          HD23      LEU  82 -26.789 -15.657   2.827

  No H/Q in entry =          11
  In of MODEL   50
    1    H    LEU  83           H        LEU  83 -27.607 -11.385  -0.332
    2    HA   LEU  83           HA       LEU  83 -27.380 -12.795  -2.772
    3    HB2  LEU  83           HB2      LEU  83 -27.843  -9.882  -2.189
    4    HB3  LEU  83           HB3      LEU  83 -27.863 -10.564  -3.815
    5    HG   LEU  83           HG       LEU  83 -29.890 -10.940  -1.630
    6   HD13  LEU  83          HD11      LEU  83 -30.680  -9.131  -2.737
    7   HD12  LEU  83          HD12      LEU  83 -31.121 -10.281  -3.996
    8   HD11  LEU  83          HD13      LEU  83 -29.603  -9.390  -4.107
    9   HD23  LEU  83          HD21      LEU  83 -30.005 -12.261  -4.327
   10   HD22  LEU  83          HD22      LEU  83 -30.968 -12.597  -2.889
   11   HD21  LEU  83          HD23      LEU  83 -29.271 -13.070  -2.942

  No H/Q in entry =          11
  In of MODEL   50
    1    H    TYR  84           H        TYR  84 -25.471 -10.337  -1.150
    2    HA   TYR  84           HA       TYR  84 -23.618  -9.863  -3.291
    3    HB2  TYR  84           HB2      TYR  84 -24.157  -8.333  -1.318
    4    HB3  TYR  84           HB3      TYR  84 -23.142  -9.400  -0.349
    5    HD1  TYR  84           HD1      TYR  84 -20.756  -9.309  -0.486
    6    HD2  TYR  84           HD2      TYR  84 -23.147  -6.995  -3.165
    7    HE1  TYR  84           HE1      TYR  84 -18.736  -8.083  -1.212
    8    HE2  TYR  84           HE2      TYR  84 -21.135  -5.770  -3.906
    9    HH   TYR  84           HH       TYR  84 -18.700  -5.301  -2.590

  No H/Q in entry =           9
  In of MODEL   50
    1    H    GLY  85           H        GLY  85 -23.342 -11.793  -0.300
    2    HA3  GLY  85           HA2      GLY  85 -20.747 -12.700  -0.762
    3    HA2  GLY  85           HA3      GLY  85 -21.962 -13.548   0.195

  No H/Q in entry =           3
  In of MODEL   50
    1    H    LYS  86           H        LYS  86 -23.801 -14.001  -1.856
    2    HA   LYS  86           HA       LYS  86 -22.704 -16.384  -3.061
    3    HB2  LYS  86           HB2      LYS  86 -24.966 -16.200  -2.086
    4    HB3  LYS  86           HB3      LYS  86 -25.381 -15.014  -3.322
    5    HG2  LYS  86           HG2      LYS  86 -25.182 -16.706  -5.031
    6    HG3  LYS  86           HG3      LYS  86 -24.729 -17.896  -3.809
    7    HD2  LYS  86           HD2      LYS  86 -26.855 -17.494  -2.638
    8    HD3  LYS  86           HD3      LYS  86 -27.310 -16.321  -3.873
    9    HE2  LYS  86           HE2      LYS  86 -27.264 -18.070  -5.570
   10    HE3  LYS  86           HE3      LYS  86 -26.768 -19.248  -4.356
   11    HZ2  LYS  86           HZ1      LYS  86 -29.228 -19.121  -4.903
   12    HZ1  LYS  86           HZ2      LYS  86 -29.240 -17.647  -4.059
   13    HZ3  LYS  86           HZ3      LYS  86 -28.811 -19.080  -3.256

  No H/Q in entry =          13
  In of MODEL   50
    1    H    VAL  87           H        VAL  87 -22.751 -13.191  -4.028
    2    HA   VAL  87           HA       VAL  87 -22.474 -12.057  -5.996
    3    HB   VAL  87           HB       VAL  87 -21.175 -14.697  -6.802
    4   HG11  VAL  87          HG11      VAL  87 -21.749 -12.235  -8.343
    5   HG13  VAL  87          HG12      VAL  87 -21.432 -13.873  -8.916
    6   HG12  VAL  87          HG13      VAL  87 -20.091 -12.823  -8.459
    7   HG23  VAL  87          HG21      VAL  87 -19.091 -13.274  -6.597
    8   HG22  VAL  87          HG22      VAL  87 -19.901 -13.701  -5.092
    9   HG21  VAL  87          HG23      VAL  87 -20.101 -12.088  -5.772

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ASP  88           H        ASP  88 -24.977 -12.737  -5.629
    2    HA   ASP  88           HA       ASP  88 -26.075 -14.029  -7.997
    3    HB2  ASP  88           HB2      ASP  88 -27.067 -14.239  -5.667
    4    HB3  ASP  88           HB3      ASP  88 -27.551 -12.549  -5.806

  No H/Q in entry =           4
  In of MODEL   50
    1    H    GLY  89           H        GLY  89 -25.395 -12.796  -9.667
    2    HA3  GLY  89           HA2      GLY  89 -25.629 -10.033  -9.931
    3    HA2  GLY  89           HA3      GLY  89 -25.584 -11.184 -11.266

  No H/Q in entry =           3
  In of MODEL   50
    1    H    LEU  90           H        LEU  90 -28.004 -12.571 -10.785
    2    HA   LEU  90           HA       LEU  90 -29.851 -10.697 -11.942
    3    HB2  LEU  90           HB2      LEU  90 -29.871 -13.106 -12.467
    4    HB3  LEU  90           HB3      LEU  90 -30.370 -13.444 -10.809
    5    HG   LEU  90           HG       LEU  90 -32.510 -12.376 -11.197
    6   HD13  LEU  90          HD11      LEU  90 -32.363 -10.667 -12.711
    7   HD12  LEU  90          HD12      LEU  90 -32.880 -11.941 -13.819
    8   HD11  LEU  90          HD13      LEU  90 -31.173 -11.511 -13.706
    9   HD23  LEU  90          HD21      LEU  90 -32.410 -14.061 -13.594
   10   HD22  LEU  90          HD22      LEU  90 -33.385 -14.211 -12.133
   11   HD21  LEU  90          HD23      LEU  90 -31.720 -14.792 -12.144

  No H/Q in entry =          11
  In of MODEL   50
    1    H    GLY  91           H        GLY  91 -29.654 -12.121  -8.724
    2    HA3  GLY  91           HA2      GLY  91 -32.013 -11.030  -7.708
    3    HA2  GLY  91           HA3      GLY  91 -30.611 -11.514  -6.755

  No H/Q in entry =           3
  In of MODEL   50
    1    H    VAL  92           H        VAL  92 -28.728  -9.670  -7.655
    2    HA   VAL  92           HA       VAL  92 -29.563  -7.350  -6.159
    3    HB   VAL  92           HB       VAL  92 -27.009  -7.807  -7.745
    4   HG12  VAL  92          HG11      VAL  92 -27.209  -5.872  -5.463
    5   HG11  VAL  92          HG12      VAL  92 -27.885  -5.377  -7.017
    6   HG13  VAL  92          HG13      VAL  92 -26.181  -5.810  -6.896
    7   HG22  VAL  92          HG21      VAL  92 -26.755  -9.353  -6.117
    8   HG21  VAL  92          HG22      VAL  92 -27.914  -8.569  -5.041
    9   HG23  VAL  92          HG23      VAL  92 -26.272  -7.940  -5.178

  No H/Q in entry =           9
  In of MODEL   50
    1    H    LEU  93           H        LEU  93 -29.145  -8.083  -9.564
    2    HA   LEU  93           HA       LEU  93 -29.542  -5.478 -10.554
    3    HB2  LEU  93           HB2      LEU  93 -28.866  -7.352 -11.973
    4    HB3  LEU  93           HB3      LEU  93 -30.443  -8.105 -11.732
    5    HG   LEU  93           HG       LEU  93 -31.492  -6.189 -12.901
    6   HD11  LEU  93          HD11      LEU  93 -29.672  -4.546 -12.435
    7   HD13  LEU  93          HD12      LEU  93 -30.112  -4.625 -14.142
    8   HD12  LEU  93          HD13      LEU  93 -28.644  -5.418 -13.572
    9   HD23  LEU  93          HD21      LEU  93 -30.444  -6.789 -15.175
   10   HD22  LEU  93          HD22      LEU  93 -31.260  -8.041 -14.239
   11   HD21  LEU  93          HD23      LEU  93 -29.498  -7.950 -14.244

  No H/Q in entry =          11
  In of MODEL   50
    1    H    LYS  94           H        LYS  94 -31.867  -8.048  -9.644
    2    HA   LYS  94           HA       LYS  94 -34.240  -6.668 -10.298
    3    HB2  LYS  94           HB2      LYS  94 -33.681  -8.795  -8.237
    4    HB3  LYS  94           HB3      LYS  94 -35.292  -8.137  -8.520
    5    HG2  LYS  94           HG2      LYS  94 -35.192  -8.964 -10.835
    6    HG3  LYS  94           HG3      LYS  94 -33.617  -9.677 -10.492
    7    HD2  LYS  94           HD2      LYS  94 -34.710 -10.990  -8.635
    8    HD3  LYS  94           HD3      LYS  94 -36.266 -10.385  -9.203
    9    HE2  LYS  94           HE2      LYS  94 -35.734 -11.357 -11.448
   10    HE3  LYS  94           HE3      LYS  94 -34.304 -12.096 -10.729
   11    HZ3  LYS  94           HZ1      LYS  94 -36.124 -13.657 -10.861
   12    HZ2  LYS  94           HZ2      LYS  94 -37.117 -12.628  -9.942
   13    HZ1  LYS  94           HZ3      LYS  94 -35.742 -13.333  -9.239

  No H/Q in entry =          13
  In of MODEL   50
    1    H    ALA  95           H        ALA  95 -32.411  -6.682  -7.250
    2    HA   ALA  95           HA       ALA  95 -34.290  -5.105  -5.806
    3    HB2  ALA  95           HB1      ALA  95 -31.888  -6.420  -5.239
    4    HB3  ALA  95           HB2      ALA  95 -32.883  -5.508  -4.106
    5    HB1  ALA  95           HB3      ALA  95 -31.552  -4.714  -4.947

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ALA  96           H        ALA  96 -31.667  -4.249  -7.925
    2    HA   ALA  96           HA       ALA  96 -31.623  -1.469  -7.215
    3    HB2  ALA  96           HB1      ALA  96 -30.268  -1.264  -9.330
    4    HB3  ALA  96           HB2      ALA  96 -30.538  -2.985  -9.610
    5    HB1  ALA  96           HB3      ALA  96 -29.632  -2.454  -8.194

  No H/Q in entry =           5
  In of MODEL   50
    1    H    VAL  97           H        VAL  97 -33.124  -3.273  -9.860
    2    HA   VAL  97           HA       VAL  97 -34.238  -1.023 -11.167
    3    HB   VAL  97           HB       VAL  97 -34.993  -3.963 -11.141
    4   HG11  VAL  97          HG11      VAL  97 -36.822  -2.003 -11.671
    5   HG13  VAL  97          HG12      VAL  97 -36.852  -3.613 -12.390
    6   HG12  VAL  97          HG13      VAL  97 -36.125  -2.269 -13.269
    7   HG21  VAL  97          HG21      VAL  97 -33.749  -2.159 -13.219
    8   HG23  VAL  97          HG22      VAL  97 -34.171  -3.854 -13.469
    9   HG22  VAL  97          HG23      VAL  97 -32.929  -3.417 -12.294

  No H/Q in entry =           9
  In of MODEL   50
    1    H    ALA  98           H        ALA  98 -35.379  -3.165  -8.579
    2    HA   ALA  98           HA       ALA  98 -37.959  -2.054  -8.252
    3    HB1  ALA  98           HB1      ALA  98 -36.906  -4.211  -7.170
    4    HB3  ALA  98           HB2      ALA  98 -38.102  -3.287  -6.259
    5    HB2  ALA  98           HB3      ALA  98 -36.384  -3.099  -5.905

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ALA  99           H        ALA  99 -34.894  -1.165  -6.627
    2    HA   ALA  99           HA       ALA  99 -36.056   0.836  -5.009
    3    HB1  ALA  99           HB1      ALA  99 -33.393  -0.023  -5.740
    4    HB2  ALA  99           HB2      ALA  99 -33.955   0.750  -4.257
    5    HB3  ALA  99           HB3      ALA  99 -33.498   1.734  -5.647

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ILE 100           H        ILE 100 -35.021   0.910  -8.368
    2    HA   ILE 100           HA       ILE 100 -35.248   3.748  -8.651
    3    HB   ILE 100           HB       ILE 100 -35.309   1.545 -10.741
    4   HG12  ILE 100          HG12      ILE 100 -33.178   3.588 -10.117
    5   HG13  ILE 100          HG13      ILE 100 -33.186   1.956  -9.450
    6   HG21  ILE 100          HG21      ILE 100 -35.781   4.454 -10.936
    7   HG23  ILE 100          HG22      ILE 100 -36.267   3.152 -12.023
    8   HG22  ILE 100          HG23      ILE 100 -34.625   3.795 -12.094
    9   HD12  ILE 100          HD11      ILE 100 -32.673   2.859 -12.245
   10   HD11  ILE 100          HD12      ILE 100 -33.306   1.240 -11.954
   11   HD13  ILE 100          HD13      ILE 100 -31.767   1.725 -11.246

  No H/Q in entry =          11
  In of MODEL   50
    1    H    LYS 101           H        LYS 101 -37.498   1.087  -9.316
    2    HA   LYS 101           HA       LYS 101 -39.607   2.678 -10.349
    3    HB2  LYS 101           HB2      LYS 101 -39.445  -0.068  -9.161
    4    HB3  LYS 101           HB3      LYS 101 -41.010   0.660  -9.522
    5    HG2  LYS 101           HG2      LYS 101 -40.539   0.752 -11.822
    6    HG3  LYS 101           HG3      LYS 101 -38.837   0.380 -11.560
    7    HD2  LYS 101           HD2      LYS 101 -40.056  -1.568 -12.402
    8    HD3  LYS 101           HD3      LYS 101 -39.422  -1.852 -10.780
    9    HE2  LYS 101           HE2      LYS 101 -41.473  -2.570 -10.256
   10    HE3  LYS 101           HE3      LYS 101 -41.957  -0.874 -10.297
   11    HZ3  LYS 101           HZ1      LYS 101 -42.848  -1.092 -12.410
   12    HZ2  LYS 101           HZ2      LYS 101 -43.285  -2.557 -11.669
   13    HZ1  LYS 101           HZ3      LYS 101 -41.980  -2.511 -12.754

  No H/Q in entry =          13
  In of MODEL   50
    1    H    LYS 102           H        LYS 102 -39.089   1.279  -7.109
    2    HA   LYS 102           HA       LYS 102 -41.355   2.463  -5.935
    3    HB2  LYS 102           HB2      LYS 102 -40.087   0.641  -4.881
    4    HB3  LYS 102           HB3      LYS 102 -38.714   1.724  -4.662
    5    HG2  LYS 102           HG2      LYS 102 -40.052   3.129  -3.196
    6    HG3  LYS 102           HG3      LYS 102 -41.429   2.050  -3.416
    7    HD2  LYS 102           HD2      LYS 102 -40.171   0.227  -2.351
    8    HD3  LYS 102           HD3      LYS 102 -38.796   1.309  -2.128
    9    HE2  LYS 102           HE2      LYS 102 -40.173   2.794  -0.750
   10    HE3  LYS 102           HE3      LYS 102 -41.567   1.743  -0.995
   11    HZ1  LYS 102           HZ1      LYS 102 -39.817   0.040   0.045
   12    HZ3  LYS 102           HZ2      LYS 102 -40.942   0.926   0.957
   13    HZ2  LYS 102           HZ3      LYS 102 -39.340   1.474   0.817

  No H/Q in entry =          13
  In of MODEL   50
    1    H    ALA 103           H        ALA 103 -38.425   3.882  -6.982
    2    HA   ALA 103           HA       ALA 103 -38.685   6.230  -5.250
    3    HB2  ALA 103           HB1      ALA 103 -36.707   6.962  -6.843
    4    HB3  ALA 103           HB2      ALA 103 -36.643   5.238  -7.204
    5    HB1  ALA 103           HB3      ALA 103 -36.424   5.801  -5.548

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ALA 104           H        ALA 104 -39.296   5.416  -8.579
    2    HA   ALA 104           HA       ALA 104 -39.927   8.177  -9.261
    3    HB2  ALA 104           HB1      ALA 104 -39.961   7.461 -11.448
    4    HB1  ALA 104           HB2      ALA 104 -40.662   5.896 -11.035
    5    HB3  ALA 104           HB3      ALA 104 -38.943   6.194 -10.764

  No H/Q in entry =           5
  In of MODEL   50
    1    H    ALA 105           H        ALA 105 -41.500   6.085  -7.410
    2    HA   ALA 105           HA       ALA 105 -43.947   7.439  -7.411
    3    HB2  ALA 105           HB1      ALA 105 -44.678   6.523  -9.430
    4    HB3  ALA 105           HB2      ALA 105 -45.294   5.349  -8.268
    5    HB1  ALA 105           HB3      ALA 105 -43.820   5.005  -9.169

  No H/Q in entry =           5
  In of MODEL   51
    1    H1   ALA   1           H3       ALA   1 -12.254 -15.717  -2.237
    2    H2   ALA   1           H2       ALA   1 -11.318 -16.858  -3.084
    3    H3   ALA   1           H1       ALA   1 -12.467 -15.914  -3.909
    4    HA   ALA   1           HA       ALA   1 -13.864 -17.615  -3.660
    5    HB3  ALA   1           HB1      ALA   1 -12.464 -19.386  -3.208
    6    HB1  ALA   1           HB2      ALA   1 -13.209 -19.274  -1.614
    7    HB2  ALA   1           HB3      ALA   1 -11.636 -18.533  -1.905

  No H/Q in entry =           7
  In of MODEL   51
    1    H    GLU   2           H        GLU   2 -15.475 -18.470  -1.994
    2    HA   GLU   2           HA       GLU   2 -17.116 -16.750  -0.924
    3    HB2  GLU   2           HB2      GLU   2 -16.165 -19.176   0.614
    4    HB3  GLU   2           HB3      GLU   2 -17.688 -18.326   0.879
    5    HG2  GLU   2           HG2      GLU   2 -18.679 -19.413  -0.849
    6    HG3  GLU   2           HG3      GLU   2 -17.364 -19.011  -1.943

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLU   3           H        GLU   3 -15.185 -18.103   1.685
    2    HA   GLU   3           HA       GLU   3 -15.396 -15.750   3.244
    3    HB2  GLU   3           HB2      GLU   3 -13.808 -18.296   3.484
    4    HB3  GLU   3           HB3      GLU   3 -13.569 -16.976   4.629
    5    HG2  GLU   3           HG2      GLU   3 -15.757 -17.128   5.463
    6    HG3  GLU   3           HG3      GLU   3 -16.362 -17.929   4.018

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LEU   4           H        LEU   4 -12.451 -17.228   1.833
    2    HA   LEU   4           HA       LEU   4 -10.613 -15.324   2.419
    3    HB2  LEU   4           HB2      LEU   4 -10.862 -16.621  -0.305
    4    HB3  LEU   4           HB3      LEU   4  -9.406 -15.901   0.370
    5    HG   LEU   4           HG       LEU   4 -10.891 -18.298   1.493
    6   HD13  LEU   4          HD11      LEU   4  -9.265 -19.653   0.552
    7   HD12  LEU   4          HD12      LEU   4  -8.056 -18.370   0.517
    8   HD11  LEU   4          HD13      LEU   4  -9.353 -18.392  -0.676
    9   HD23  LEU   4          HD21      LEU   4  -8.631 -18.361   2.859
   10   HD22  LEU   4          HD22      LEU   4  -9.948 -17.322   3.397
   11   HD21  LEU   4          HD23      LEU   4  -8.592 -16.633   2.506

  No H/Q in entry =          11
  In of MODEL   51
    1    H    GLU   5           H        GLU   5 -12.966 -15.117  -0.240
    2    HA   GLU   5           HA       GLU   5 -11.970 -12.634  -1.247
    3    HB2  GLU   5           HB2      GLU   5 -13.326 -14.222  -2.598
    4    HB3  GLU   5           HB3      GLU   5 -14.720 -13.855  -1.581
    5    HG2  GLU   5           HG2      GLU   5 -14.580 -11.483  -2.224
    6    HG3  GLU   5           HG3      GLU   5 -13.175 -11.834  -3.230

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLU   6           H        GLU   6 -14.681 -13.512   0.864
    2    HA   GLU   6           HA       GLU   6 -15.583 -10.836   1.269
    3    HB2  GLU   6           HB2      GLU   6 -17.006 -12.828   1.678
    4    HB3  GLU   6           HB3      GLU   6 -15.966 -13.272   3.030
    5    HG2  GLU   6           HG2      GLU   6 -16.490 -11.158   4.157
    6    HG3  GLU   6           HG3      GLU   6 -17.493 -10.663   2.795

  No H/Q in entry =           6
  In of MODEL   51
    1    H    VAL   7           H        VAL   7 -13.265 -12.946   2.825
    2    HA   VAL   7           HA       VAL   7 -12.783 -11.371   5.149
    3    HB   VAL   7           HB       VAL   7 -11.089 -13.414   3.688
    4   HG11  VAL   7          HG11      VAL   7 -10.604 -11.882   6.249
    5   HG13  VAL   7          HG12      VAL   7  -9.513 -12.096   4.881
    6   HG12  VAL   7          HG13      VAL   7  -9.859 -13.453   5.953
    7   HG21  VAL   7          HG21      VAL   7 -13.331 -13.979   4.923
    8   HG23  VAL   7          HG22      VAL   7 -12.394 -13.705   6.392
    9   HG22  VAL   7          HG23      VAL   7 -11.909 -14.965   5.260

  No H/Q in entry =           9
  In of MODEL   51
    1    H    VAL   8           H        VAL   8 -11.293 -11.485   1.929
    2    HA   VAL   8           HA       VAL   8  -9.227  -9.612   2.408
    3    HB   VAL   8           HB       VAL   8 -10.705 -10.341  -0.130
    4   HG11  VAL   8          HG11      VAL   8  -8.336  -8.515   0.346
    5   HG13  VAL   8          HG12      VAL   8  -9.836  -8.144  -0.505
    6   HG12  VAL   8          HG13      VAL   8  -8.667  -9.251  -1.224
    7   HG23  VAL   8          HG21      VAL   8  -7.897 -11.055  -0.029
    8   HG22  VAL   8          HG22      VAL   8  -9.293 -12.118  -0.177
    9   HG21  VAL   8          HG23      VAL   8  -8.700 -11.669   1.418

  No H/Q in entry =           9
  In of MODEL   51
    1    H    MET   9           H        MET   9 -12.581  -9.223   1.270
    2    HA   MET   9           HA       MET   9 -12.520  -6.446   0.835
    3    HB2  MET   9           HB2      MET   9 -14.732  -8.315   1.689
    4    HB3  MET   9           HB3      MET   9 -15.008  -6.588   1.454
    5    HG2  MET   9           HG2      MET   9 -14.169  -6.763  -0.859
    6    HG3  MET   9           HG3      MET   9 -13.890  -8.490  -0.626
    7    HE2  MET   9           HE1      MET   9 -16.655  -5.934  -1.928
    8    HE1  MET   9           HE2      MET   9 -16.196  -5.647  -0.253
    9    HE3  MET   9           HE3      MET   9 -17.825  -6.202  -0.629

  No H/Q in entry =           9
  In of MODEL   51
    1    H    GLY  10           H        GLY  10 -13.163  -8.338   3.767
    2    HA3  GLY  10           HA2      GLY  10 -13.701  -6.153   5.489
    3    HA2  GLY  10           HA3      GLY  10 -13.133  -7.742   6.000

  No H/Q in entry =           3
  In of MODEL   51
    1    H    LEU  11           H        LEU  11 -10.696  -7.865   4.668
    2    HA   LEU  11           HA       LEU  11  -8.984  -6.431   6.414
    3    HB2  LEU  11           HB2      LEU  11  -8.454  -7.854   3.803
    4    HB3  LEU  11           HB3      LEU  11  -7.178  -7.149   4.793
    5    HG   LEU  11           HG       LEU  11  -9.172  -9.183   5.823
    6   HD13  LEU  11          HD11      LEU  11  -7.960 -10.419   4.250
    7   HD12  LEU  11          HD12      LEU  11  -7.015 -10.657   5.719
    8   HD11  LEU  11          HD13      LEU  11  -6.483  -9.492   4.508
    9   HD22  LEU  11          HD21      LEU  11  -8.307  -8.169   7.734
   10   HD21  LEU  11          HD22      LEU  11  -6.774  -7.767   6.961
   11   HD23  LEU  11          HD23      LEU  11  -7.095  -9.423   7.472

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  12           H        ILE  12  -9.909  -5.884   3.030
    2    HA   ILE  12           HA       ILE  12  -8.222  -3.653   2.592
    3    HB   ILE  12           HB       ILE  12 -10.889  -4.304   1.313
    4   HG12  ILE  12          HG12      ILE  12  -8.868  -5.987   1.247
    5   HG13  ILE  12          HG13      ILE  12  -9.753  -5.646  -0.226
    6   HG22  ILE  12          HG21      ILE  12  -9.960  -2.943  -0.589
    7   HG21  ILE  12          HG22      ILE  12  -8.633  -2.457   0.458
    8   HG23  ILE  12          HG23      ILE  12 -10.271  -2.023   0.853
    9   HD11  ILE  12          HD11      ILE  12  -7.213  -4.218   0.604
   10   HD13  ILE  12          HD12      ILE  12  -8.027  -4.127  -0.956
   11   HD12  ILE  12          HD13      ILE  12  -7.244  -5.610  -0.461

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  13           H        ILE  13 -11.575  -3.924   3.708
    2    HA   ILE  13           HA       ILE  13 -12.037  -1.137   3.980
    3    HB   ILE  13           HB       ILE  13 -13.229  -3.556   5.355
    4   HG12  ILE  13          HG12      ILE  13 -13.469  -3.036   2.819
    5   HG13  ILE  13          HG13      ILE  13 -14.895  -3.476   3.734
    6   HG21  ILE  13          HG21      ILE  13 -14.032  -0.641   5.550
    7   HG23  ILE  13          HG22      ILE  13 -13.607  -1.717   6.876
    8   HG22  ILE  13          HG23      ILE  13 -15.110  -1.963   5.990
    9   HD12  ILE  13          HD11      ILE  13 -14.909  -1.340   2.146
   10   HD11  ILE  13          HD12      ILE  13 -14.180  -0.599   3.558
   11   HD13  ILE  13          HD13      ILE  13 -15.762  -1.334   3.694

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ASN  14           H        ASN  14 -10.907  -3.626   6.248
    2    HA   ASN  14           HA       ASN  14 -10.694  -1.987   8.532
    3    HB2  ASN  14           HB2      ASN  14 -10.439  -4.594   8.208
    4    HB3  ASN  14           HB3      ASN  14  -8.732  -4.204   8.040
    5   HD21  ASN  14          HD21      ASN  14  -9.352  -5.729  10.220
    6   HD22  ASN  14          HD22      ASN  14  -9.316  -4.809  11.644

  No H/Q in entry =           6
  In of MODEL   51
    1    H    SER  15           H        SER  15  -8.307  -2.807   6.025
    2    HA   SER  15           HA       SER  15  -6.159  -1.310   7.083
    3    HB2  SER  15           HB2      SER  15  -5.150  -1.528   4.922
    4    HB3  SER  15           HB3      SER  15  -6.109  -2.986   5.147
    5    HG   SER  15           HG       SER  15  -6.282  -1.307   3.178

  No H/Q in entry =           5
  In of MODEL   51
    1    H    GLY  16           H        GLY  16  -8.777  -0.449   4.852
    2    HA3  GLY  16           HA2      GLY  16  -7.928   2.194   4.294
    3    HA2  GLY  16           HA3      GLY  16  -9.579   1.595   4.143

  No H/Q in entry =           3
  In of MODEL   51
    1    H    GLN  17           H        GLN  17 -10.103   0.869   6.797
    2    HA   GLN  17           HA       GLN  17 -10.809   3.373   7.941
    3    HB2  GLN  17           HB2      GLN  17 -12.012   1.252   8.422
    4    HB3  GLN  17           HB3      GLN  17 -10.607   0.684   9.323
    5    HG2  GLN  17           HG2      GLN  17 -12.225   1.632  10.883
    6    HG3  GLN  17           HG3      GLN  17 -10.806   2.676  10.812
    7   HE21  GLN  17          HE21      GLN  17 -11.784   4.716  11.201
    8   HE22  GLN  17          HE22      GLN  17 -12.993   5.374  10.208

  No H/Q in entry =           8
  In of MODEL   51
    1    H    ALA  18           H        ALA  18  -8.170   1.099   8.544
    2    HA   ALA  18           HA       ALA  18  -7.061   2.318  10.808
    3    HB2  ALA  18           HB1      ALA  18  -6.454   0.104   9.437
    4    HB3  ALA  18           HB2      ALA  18  -5.287   0.890  10.500
    5    HB1  ALA  18           HB3      ALA  18  -5.221   1.169   8.759

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ARG  19           H        ARG  19  -6.314   2.843   7.354
    2    HA   ARG  19           HA       ARG  19  -4.419   4.896   7.770
    3    HB2  ARG  19           HB2      ARG  19  -4.757   3.754   5.577
    4    HB3  ARG  19           HB3      ARG  19  -6.303   4.590   5.410
    5    HG2  ARG  19           HG2      ARG  19  -5.181   6.765   5.470
    6    HG3  ARG  19           HG3      ARG  19  -3.628   5.985   5.765
    7    HD2  ARG  19           HD2      ARG  19  -3.770   6.574   3.422
    8    HD3  ARG  19           HD3      ARG  19  -3.848   4.814   3.569
    9    HE   ARG  19           HE       ARG  19  -6.485   5.714   3.578
   10   HH21  ARG  19          HH11      ARG  19  -7.692   5.865   1.667
   11   HH22  ARG  19          HH12      ARG  19  -6.880   5.945   0.142
   12   HH11  ARG  19          HH21      ARG  19  -3.722   5.786   1.526
   13   HH12  ARG  19          HH22      ARG  19  -4.631   5.898   0.063

  No H/Q in entry =          13
  In of MODEL   51
    1    H    SER  20           H        SER  20  -7.921   4.999   7.192
    2    HA   SER  20           HA       SER  20  -8.289   7.754   7.145
    3    HB2  SER  20           HB2      SER  20 -10.164   6.403   6.621
    4    HB3  SER  20           HB3      SER  20 -10.044   5.514   8.137
    5    HG   SER  20           HG       SER  20 -10.515   8.305   7.990

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LEU  21           H        LEU  21  -8.263   5.572   9.950
    2    HA   LEU  21           HA       LEU  21  -8.699   7.567  11.917
    3    HB2  LEU  21           HB2      LEU  21  -7.338   4.870  12.068
    4    HB3  LEU  21           HB3      LEU  21  -7.637   5.887  13.474
    5    HG   LEU  21           HG       LEU  21  -9.819   4.979  11.572
    6   HD13  LEU  21          HD11      LEU  21  -9.001   2.979  12.567
    7   HD12  LEU  21          HD12      LEU  21 -10.398   3.437  13.540
    8   HD11  LEU  21          HD13      LEU  21  -8.767   3.760  14.131
    9   HD21  LEU  21          HD21      LEU  21  -9.740   6.484  14.185
   10   HD23  LEU  21          HD22      LEU  21 -11.154   5.505  13.805
   11   HD22  LEU  21          HD23      LEU  21 -10.696   6.830  12.746

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ALA  22           H        ALA  22  -5.750   6.205  10.492
    2    HA   ALA  22           HA       ALA  22  -3.866   7.527  12.101
    3    HB2  ALA  22           HB1      ALA  22  -3.453   5.674  10.408
    4    HB1  ALA  22           HB2      ALA  22  -2.262   6.975  10.436
    5    HB3  ALA  22           HB3      ALA  22  -3.487   6.926   9.167

  No H/Q in entry =           5
  In of MODEL   51
    1    H    TYR  23           H        TYR  23  -5.207   8.537   8.926
    2    HA   TYR  23           HA       TYR  23  -3.882  11.039   8.847
    3    HB2  TYR  23           HB2      TYR  23  -4.971  10.122   6.862
    4    HB3  TYR  23           HB3      TYR  23  -6.544  10.221   7.652
    5    HD1  TYR  23           HD1      TYR  23  -3.651  12.290   6.515
    6    HD2  TYR  23           HD2      TYR  23  -7.802  12.215   7.609
    7    HE1  TYR  23           HE1      TYR  23  -3.892  14.639   5.756
    8    HE2  TYR  23           HE2      TYR  23  -8.045  14.564   6.849
    9    HH   TYR  23           HH       TYR  23  -6.399  16.586   6.581

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ALA  24           H        ALA  24  -6.989  10.048  10.246
    2    HA   ALA  24           HA       ALA  24  -7.832  12.635  11.021
    3    HB1  ALA  24           HB1      ALA  24  -9.642  11.376  11.500
    4    HB2  ALA  24           HB2      ALA  24  -8.805  10.809  12.943
    5    HB3  ALA  24           HB3      ALA  24  -8.685   9.897  11.439

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ALA  25           H        ALA  25  -5.810  10.186  12.584
    2    HA   ALA  25           HA       ALA  25  -5.462  11.441  15.083
    3    HB2  ALA  25           HB1      ALA  25  -4.690   9.092  14.259
    4    HB3  ALA  25           HB2      ALA  25  -3.672   9.955  15.413
    5    HB1  ALA  25           HB3      ALA  25  -3.246   9.940  13.701

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LEU  26           H        LEU  26  -3.691  11.747  12.032
    2    HA   LEU  26           HA       LEU  26  -1.735  13.575  12.936
    3    HB2  LEU  26           HB2      LEU  26  -1.441  12.424  10.831
    4    HB3  LEU  26           HB3      LEU  26  -2.921  13.125  10.184
    5    HG   LEU  26           HG       LEU  26  -1.915  15.380  10.313
    6   HD12  LEU  26          HD11      LEU  26   0.626  15.411  10.712
    7   HD11  LEU  26          HD12      LEU  26   0.413  13.829  11.458
    8   HD13  LEU  26          HD13      LEU  26  -0.396  15.241  12.138
    9   HD21  LEU  26          HD21      LEU  26  -0.172  13.332   8.908
   10   HD23  LEU  26          HD22      LEU  26  -0.225  15.053   8.537
   11   HD22  LEU  26          HD23      LEU  26  -1.645  14.049   8.258

  No H/Q in entry =          11
  In of MODEL   51
    1    H    LYS  27           H        LYS  27  -4.928  14.044  11.477
    2    HA   LYS  27           HA       LYS  27  -4.885  16.833  11.277
    3    HB2  LYS  27           HB2      LYS  27  -6.629  15.348  10.303
    4    HB3  LYS  27           HB3      LYS  27  -7.275  15.090  11.923
    5    HG2  LYS  27           HG2      LYS  27  -7.712  17.494  12.161
    6    HG3  LYS  27           HG3      LYS  27  -7.015  17.793  10.565
    7    HD2  LYS  27           HD2      LYS  27  -8.748  16.352   9.540
    8    HD3  LYS  27           HD3      LYS  27  -9.451  16.070  11.134
    9    HE2  LYS  27           HE2      LYS  27  -9.902  18.479  11.379
   10    HE3  LYS  27           HE3      LYS  27  -9.170  18.783   9.800
   11    HZ3  LYS  27           HZ1      LYS  27 -11.549  18.649   9.572
   12    HZ2  LYS  27           HZ2      LYS  27 -11.586  17.133  10.343
   13    HZ1  LYS  27           HZ3      LYS  27 -10.851  17.298   8.817

  No H/Q in entry =          13
  In of MODEL   51
    1    H    GLN  28           H        GLN  28  -5.749  14.745  14.011
    2    HA   GLN  28           HA       GLN  28  -6.641  16.746  15.791
    3    HB2  GLN  28           HB2      GLN  28  -5.228  14.119  16.324
    4    HB3  GLN  28           HB3      GLN  28  -5.960  15.122  17.578
    5    HG2  GLN  28           HG2      GLN  28  -7.453  14.029  15.178
    6    HG3  GLN  28           HG3      GLN  28  -7.470  13.292  16.779
    7   HE21  GLN  28          HE21      GLN  28  -7.634  15.608  18.409
    8   HE22  GLN  28          HE22      GLN  28  -9.110  16.388  18.106

  No H/Q in entry =           8
  In of MODEL   51
    1    H    ALA  29           H        ALA  29  -3.422  15.460  15.083
    2    HA   ALA  29           HA       ALA  29  -1.976  16.863  17.052
    3    HB1  ALA  29           HB1      ALA  29  -0.050  16.176  15.922
    4    HB3  ALA  29           HB2      ALA  29  -0.815  16.298  14.337
    5    HB2  ALA  29           HB3      ALA  29  -1.227  14.964  15.415

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LYS  30           H        LYS  30  -2.857  17.738  13.727
    2    HA   LYS  30           HA       LYS  30  -1.451  20.181  13.617
    3    HB2  LYS  30           HB2      LYS  30  -3.990  19.303  12.225
    4    HB3  LYS  30           HB3      LYS  30  -3.160  20.818  11.875
    5    HG2  LYS  30           HG2      LYS  30  -1.092  19.528  11.349
    6    HG3  LYS  30           HG3      LYS  30  -1.995  18.031  11.600
    7    HD2  LYS  30           HD2      LYS  30  -3.571  18.669   9.815
    8    HD3  LYS  30           HD3      LYS  30  -2.691  20.178   9.566
    9    HE2  LYS  30           HE2      LYS  30  -0.661  18.887   8.974
   10    HE3  LYS  30           HE3      LYS  30  -1.560  17.383   9.192
   11    HZ2  LYS  30           HZ1      LYS  30  -1.399  18.253   6.849
   12    HZ1  LYS  30           HZ2      LYS  30  -2.441  19.515   7.324
   13    HZ3  LYS  30           HZ3      LYS  30  -2.964  17.898   7.399

  No H/Q in entry =          13
  In of MODEL   51
    1    H    GLN  31           H        GLN  31  -4.542  19.327  15.049
    2    HA   GLN  31           HA       GLN  31  -5.303  22.084  15.506
    3    HB2  GLN  31           HB2      GLN  31  -6.474  19.638  16.836
    4    HB3  GLN  31           HB3      GLN  31  -7.235  21.209  16.595
    5    HG2  GLN  31           HG2      GLN  31  -6.542  20.432  14.001
    6    HG3  GLN  31           HG3      GLN  31  -7.061  18.927  14.752
    7   HE21  GLN  31          HE21      GLN  31  -8.485  20.501  12.659
    8   HE22  GLN  31          HE22      GLN  31  -9.994  20.892  13.326

  No H/Q in entry =           8
  In of MODEL   51
    1    H    GLY  32           H        GLY  32  -2.983  20.157  16.811
    2    HA3  GLY  32           HA2      GLY  32  -1.571  20.618  18.604
    3    HA2  GLY  32           HA3      GLY  32  -2.696  21.862  19.135

  No H/Q in entry =           3
  In of MODEL   51
    1    H    ASP  33           H        ASP  33  -4.124  18.823  18.483
    2    HA   ASP  33           HA       ASP  33  -4.516  18.365  21.365
    3    HB2  ASP  33           HB2      ASP  33  -5.939  17.354  18.897
    4    HB3  ASP  33           HB3      ASP  33  -6.274  16.744  20.515

  No H/Q in entry =           4
  In of MODEL   51
    1    H    PHE  34           H        PHE  34  -2.346  17.513  21.656
    2    HA   PHE  34           HA       PHE  34  -1.356  15.264  20.249
    3    HB2  PHE  34           HB2      PHE  34  -0.720  16.248  23.039
    4    HB3  PHE  34           HB3      PHE  34   0.202  15.024  22.166
    5    HD1  PHE  34           HD1      PHE  34   0.037  18.450  22.902
    6    HD2  PHE  34           HD2      PHE  34   0.844  15.747  19.662
    7    HE1  PHE  34           HE1      PHE  34   1.325  20.221  21.740
    8    HE2  PHE  34           HE2      PHE  34   2.128  17.520  18.505
    9    HZ   PHE  34           HZ       PHE  34   2.371  19.754  19.548

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ALA  35           H        ALA  35  -3.377  15.542  23.125
    2    HA   ALA  35           HA       ALA  35  -3.160  12.879  24.020
    3    HB3  ALA  35           HB1      ALA  35  -5.612  13.507  24.894
    4    HB1  ALA  35           HB2      ALA  35  -5.081  15.125  24.434
    5    HB2  ALA  35           HB3      ALA  35  -4.159  14.200  25.619

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ALA  36           H        ALA  36  -5.623  14.398  21.937
    2    HA   ALA  36           HA       ALA  36  -7.043  11.987  21.468
    3    HB1  ALA  36           HB1      ALA  36  -8.504  13.411  20.522
    4    HB3  ALA  36           HB2      ALA  36  -7.340  13.831  19.265
    5    HB2  ALA  36           HB3      ALA  36  -7.354  14.718  20.789

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ALA  37           H        ALA  37  -4.373  13.573  19.782
    2    HA   ALA  37           HA       ALA  37  -4.354  11.938  17.484
    3    HB3  ALA  37           HB1      ALA  37  -2.351  13.648  18.894
    4    HB2  ALA  37           HB2      ALA  37  -2.892  13.705  17.218
    5    HB1  ALA  37           HB3      ALA  37  -1.736  12.474  17.731

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LYS  38           H        LYS  38  -2.577  11.630  20.551
    2    HA   LYS  38           HA       LYS  38  -1.256   9.230  20.052
    3    HB2  LYS  38           HB2      LYS  38  -1.564  10.992  22.200
    4    HB3  LYS  38           HB3      LYS  38  -2.180   9.463  22.820
    5    HG2  LYS  38           HG2      LYS  38  -0.090   8.341  22.270
    6    HG3  LYS  38           HG3      LYS  38   0.515   9.786  21.453
    7    HD2  LYS  38           HD2      LYS  38   0.698  11.004  23.487
    8    HD3  LYS  38           HD3      LYS  38  -0.316   9.854  24.360
    9    HE2  LYS  38           HE2      LYS  38   2.043   9.537  24.964
   10    HE3  LYS  38           HE3      LYS  38   1.432   8.121  24.103
   11    HZ3  LYS  38           HZ1      LYS  38   2.721   8.540  22.314
   12    HZ2  LYS  38           HZ2      LYS  38   3.684   9.367  23.444
   13    HZ1  LYS  38           HZ3      LYS  38   2.599  10.228  22.460

  No H/Q in entry =          13
  In of MODEL   51
    1    H    ALA  39           H        ALA  39  -4.485   9.726  21.476
    2    HA   ALA  39           HA       ALA  39  -5.043   7.007  21.984
    3    HB3  ALA  39           HB1      ALA  39  -7.206   8.953  21.231
    4    HB2  ALA  39           HB2      ALA  39  -6.298   9.179  22.727
    5    HB1  ALA  39           HB3      ALA  39  -7.217   7.696  22.469

  No H/Q in entry =           5
  In of MODEL   51
    1    H    MET  40           H        MET  40  -5.646   9.021  19.142
    2    HA   MET  40           HA       MET  40  -7.133   7.090  17.691
    3    HB2  MET  40           HB2      MET  40  -5.528   9.485  16.776
    4    HB3  MET  40           HB3      MET  40  -6.561   8.527  15.712
    5    HG2  MET  40           HG2      MET  40  -7.578   9.775  18.277
    6    HG3  MET  40           HG3      MET  40  -7.646  10.611  16.728
    7    HE3  MET  40           HE1      MET  40 -10.243   8.993  14.680
    8    HE2  MET  40           HE2      MET  40  -8.491   9.109  14.520
    9    HE1  MET  40           HE3      MET  40  -9.405  10.475  15.160

  No H/Q in entry =           9
  In of MODEL   51
    1    H    MET  41           H        MET  41  -3.641   7.827  17.790
    2    HA   MET  41           HA       MET  41  -2.896   6.073  15.685
    3    HB2  MET  41           HB2      MET  41  -1.263   6.738  18.147
    4    HB3  MET  41           HB3      MET  41  -0.656   6.091  16.627
    5    HG2  MET  41           HG2      MET  41  -1.819   8.274  15.632
    6    HG3  MET  41           HG3      MET  41  -1.572   8.861  17.275
    7    HE2  MET  41           HE1      MET  41   1.348   6.763  17.617
    8    HE1  MET  41           HE2      MET  41   0.566   8.056  18.520
    9    HE3  MET  41           HE3      MET  41   2.185   8.300  17.867

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ASP  42           H        ASP  42  -3.258   5.598  19.173
    2    HA   ASP  42           HA       ASP  42  -2.221   3.005  19.326
    3    HB2  ASP  42           HB2      ASP  42  -3.083   4.763  21.154
    4    HB3  ASP  42           HB3      ASP  42  -4.511   3.738  21.091

  No H/Q in entry =           4
  In of MODEL   51
    1    H    GLN  43           H        GLN  43  -5.558   4.108  18.847
    2    HA   GLN  43           HA       GLN  43  -6.702   1.520  18.659
    3    HB2  GLN  43           HB2      GLN  43  -7.633   4.173  17.537
    4    HB3  GLN  43           HB3      GLN  43  -8.596   2.693  17.520
    5    HG2  GLN  43           HG2      GLN  43  -8.287   2.571  20.026
    6    HG3  GLN  43           HG3      GLN  43  -7.563   4.177  19.950
    7   HE21  GLN  43          HE21      GLN  43  -9.733   4.255  21.465
    8   HE22  GLN  43          HE22      GLN  43 -11.099   4.831  20.642

  No H/Q in entry =           8
  In of MODEL   51
    1    H    SER  44           H        SER  44  -5.378   3.735  16.239
    2    HA   SER  44           HA       SER  44  -6.093   2.252  13.954
    3    HB2  SER  44           HB2      SER  44  -4.835   4.636  14.391
    4    HB3  SER  44           HB3      SER  44  -3.484   3.640  13.852
    5    HG   SER  44           HG       SER  44  -4.608   4.612  12.096

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ARG  45           H        ARG  45  -3.203   2.139  16.016
    2    HA   ARG  45           HA       ARG  45  -1.731   0.185  14.624
    3    HB2  ARG  45           HB2      ARG  45  -0.878   1.606  16.488
    4    HB3  ARG  45           HB3      ARG  45  -1.862   0.675  17.614
    5    HG2  ARG  45           HG2      ARG  45  -0.634  -1.383  16.963
    6    HG3  ARG  45           HG3      ARG  45   0.375  -0.427  15.879
    7    HD2  ARG  45           HD2      ARG  45   1.121   0.953  17.830
    8    HD3  ARG  45           HD3      ARG  45   0.206  -0.123  18.909
    9    HE   ARG  45           HE       ARG  45   1.896  -1.717  17.317
   10   HH21  ARG  45          HH11      ARG  45   3.801  -2.540  18.142
   11   HH22  ARG  45          HH12      ARG  45   4.583  -1.755  19.469
   12   HH11  ARG  45          HH21      ARG  45   2.213   0.748  19.706
   13   HH12  ARG  45          HH22      ARG  45   3.683   0.110  20.352

  No H/Q in entry =          13
  In of MODEL   51
    1    H    MET  46           H        MET  46  -4.112  -0.136  17.239
    2    HA   MET  46           HA       MET  46  -3.942  -2.936  17.543
    3    HB2  MET  46           HB2      MET  46  -6.100  -0.925  18.163
    4    HB3  MET  46           HB3      MET  46  -6.318  -2.645  18.492
    5    HG2  MET  46           HG2      MET  46  -4.323  -2.664  19.902
    6    HG3  MET  46           HG3      MET  46  -4.004  -0.979  19.522
    7    HE3  MET  46           HE1      MET  46  -7.787  -2.609  20.753
    8    HE2  MET  46           HE2      MET  46  -6.909  -2.994  22.229
    9    HE1  MET  46           HE3      MET  46  -6.288  -3.544  20.676

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ALA  47           H        ALA  47  -5.975  -0.918  15.462
    2    HA   ALA  47           HA       ALA  47  -7.600  -2.968  14.406
    3    HB3  ALA  47           HB1      ALA  47  -8.281  -0.730  13.995
    4    HB1  ALA  47           HB2      ALA  47  -7.802  -1.363  12.420
    5    HB2  ALA  47           HB3      ALA  47  -6.716  -0.295  13.311

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LEU  48           H        LEU  48  -4.487  -1.660  13.336
    2    HA   LEU  48           HA       LEU  48  -4.221  -3.249  10.993
    3    HB2  LEU  48           HB2      LEU  48  -2.152  -1.973  12.789
    4    HB3  LEU  48           HB3      LEU  48  -1.793  -2.693  11.219
    5    HG   LEU  48           HG       LEU  48  -3.812  -0.474  11.622
    6   HD13  LEU  48          HD11      LEU  48  -1.686   0.400  12.276
    7   HD12  LEU  48          HD12      LEU  48  -1.970   0.955  10.626
    8   HD11  LEU  48          HD13      LEU  48  -0.872  -0.393  10.927
    9   HD22  LEU  48          HD21      LEU  48  -4.297  -1.457   9.549
   10   HD21  LEU  48          HD22      LEU  48  -2.617  -1.894   9.243
   11   HD23  LEU  48          HD23      LEU  48  -3.135  -0.214   9.088

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ASN  49           H        ASN  49  -3.156  -3.649  14.332
    2    HA   ASN  49           HA       ASN  49  -1.558  -5.914  13.991
    3    HB2  ASN  49           HB2      ASN  49  -1.584  -4.568  16.039
    4    HB3  ASN  49           HB3      ASN  49  -3.231  -5.080  16.377
    5   HD21  ASN  49          HD21      ASN  49  -2.775  -6.221  18.319
    6   HD22  ASN  49          HD22      ASN  49  -1.815  -7.620  18.362

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLU  50           H        GLU  50  -5.022  -5.634  14.683
    2    HA   GLU  50           HA       GLU  50  -5.538  -8.433  14.793
    3    HB2  GLU  50           HB2      GLU  50  -7.116  -6.743  15.680
    4    HB3  GLU  50           HB3      GLU  50  -7.418  -6.177  14.035
    5    HG2  GLU  50           HG2      GLU  50  -8.291  -8.371  13.401
    6    HG3  GLU  50           HG3      GLU  50  -7.902  -9.017  14.992

  No H/Q in entry =           6
  In of MODEL   51
    1    H    ALA  51           H        ALA  51  -5.617  -6.033  12.199
    2    HA   ALA  51           HA       ALA  51  -6.618  -7.757  10.182
    3    HB2  ALA  51           HB1      ALA  51  -6.403  -5.944   8.812
    4    HB1  ALA  51           HB2      ALA  51  -4.759  -5.599   9.351
    5    HB3  ALA  51           HB3      ALA  51  -6.136  -5.085  10.329

  No H/Q in entry =           5
  In of MODEL   51
    1    H    HIS  52           H        HIS  52  -3.320  -6.858  11.147
    2    HA   HIS  52           HA       HIS  52  -1.936  -8.350   9.188
    3    HB2  HIS  52           HB2      HIS  52  -0.885  -6.621  10.616
    4    HB3  HIS  52           HB3      HIS  52  -1.058  -7.687  12.009
    5    HD1  HIS  52           HD1      HIS  52   0.283 -10.006  11.879
    6    HD2  HIS  52           HD2      HIS  52   1.336  -7.169   9.012
    7    HE1  HIS  52           HE1      HIS  52   2.505 -10.750  10.916
    8    HE2  HIS  52           HE2      HIS  52   3.159  -9.031   9.166

  No H/Q in entry =           8
  In of MODEL   51
    1    H    LEU  53           H        LEU  53  -3.131  -9.226  12.407
    2    HA   LEU  53           HA       LEU  53  -1.940 -11.774  12.592
    3    HB2  LEU  53           HB2      LEU  53  -4.408 -10.579  13.824
    4    HB3  LEU  53           HB3      LEU  53  -3.967 -12.261  14.106
    5    HG   LEU  53           HG       LEU  53  -2.046  -9.959  14.587
    6   HD11  LEU  53          HD11      LEU  53  -4.057 -11.272  16.421
    7   HD13  LEU  53          HD12      LEU  53  -3.829  -9.553  16.105
    8   HD12  LEU  53          HD13      LEU  53  -2.632 -10.443  17.038
    9   HD22  LEU  53          HD21      LEU  53  -0.770 -11.941  14.528
   10   HD21  LEU  53          HD22      LEU  53  -2.072 -12.910  15.209
   11   HD23  LEU  53          HD23      LEU  53  -1.160 -11.823  16.240

  No H/Q in entry =          11
  In of MODEL   51
    1    H    VAL  54           H        VAL  54  -5.056 -10.734  11.249
    2    HA   VAL  54           HA       VAL  54  -5.982 -13.324  10.565
    3    HB   VAL  54           HB       VAL  54  -6.626 -10.589   9.436
    4   HG12  VAL  54          HG11      VAL  54  -8.738 -11.959   8.636
    5   HG11  VAL  54          HG12      VAL  54  -7.630 -13.329   8.700
    6   HG13  VAL  54          HG13      VAL  54  -7.272 -11.954   7.657
    7   HG22  VAL  54          HG21      VAL  54  -7.521 -10.625  11.593
    8   HG21  VAL  54          HG22      VAL  54  -7.781 -12.367  11.574
    9   HG23  VAL  54          HG23      VAL  54  -8.864 -11.306  10.674

  No H/Q in entry =           9
  In of MODEL   51
    1    H    GLN  55           H        GLN  55  -4.112 -10.878   8.767
    2    HA   GLN  55           HA       GLN  55  -4.001 -12.341   6.347
    3    HB2  GLN  55           HB2      GLN  55  -3.391 -10.079   6.156
    4    HB3  GLN  55           HB3      GLN  55  -2.272 -10.160   7.514
    5    HG2  GLN  55           HG2      GLN  55  -0.565 -11.011   6.227
    6    HG3  GLN  55           HG3      GLN  55  -1.648 -11.982   5.239
    7   HE21  GLN  55          HE21      GLN  55  -1.675 -11.290   3.118
    8   HE22  GLN  55          HE22      GLN  55  -1.474  -9.686   2.608

  No H/Q in entry =           8
  In of MODEL   51
    1    H    THR  56           H        THR  56  -1.879 -12.330   9.216
    2    HA   THR  56           HA       THR  56   0.188 -13.936   8.285
    3    HB   THR  56           HB       THR  56  -1.039 -14.185  11.040
    4    HG1  THR  56           HG1      THR  56   0.694 -12.245   9.927
    5   HG23  THR  56          HG21      THR  56   1.005 -15.048  11.710
    6   HG22  THR  56          HG22      THR  56   1.886 -14.244  10.410
    7   HG21  THR  56          HG23      THR  56   0.918 -15.677  10.066

  No H/Q in entry =           7
  In of MODEL   51
    1    H    LYS  57           H        LYS  57  -2.928 -14.961   9.666
    2    HA   LYS  57           HA       LYS  57  -2.495 -17.759   9.416
    3    HB2  LYS  57           HB2      LYS  57  -4.302 -16.654  10.770
    4    HB3  LYS  57           HB3      LYS  57  -5.103 -16.214   9.269
    5    HG2  LYS  57           HG2      LYS  57  -5.376 -18.565   8.678
    6    HG3  LYS  57           HG3      LYS  57  -4.489 -19.058  10.118
    7    HD2  LYS  57           HD2      LYS  57  -6.233 -18.034  11.543
    8    HD3  LYS  57           HD3      LYS  57  -7.129 -17.556  10.101
    9    HE2  LYS  57           HE2      LYS  57  -7.347 -19.936   9.448
   10    HE3  LYS  57           HE3      LYS  57  -6.462 -20.423  10.891
   11    HZ1  LYS  57           HZ1      LYS  57  -8.886 -18.752  11.085
   12    HZ3  LYS  57           HZ2      LYS  57  -8.169 -19.735  12.271
   13    HZ2  LYS  57           HZ3      LYS  57  -8.995 -20.442  10.966

  No H/Q in entry =          13
  In of MODEL   51
    1    H    LEU  58           H        LEU  58  -3.829 -15.309   7.249
    2    HA   LEU  58           HA       LEU  58  -4.650 -17.130   5.246
    3    HB2  LEU  58           HB2      LEU  58  -4.032 -14.184   5.109
    4    HB3  LEU  58           HB3      LEU  58  -4.707 -15.117   3.772
    5    HG   LEU  58           HG       LEU  58  -5.970 -14.934   6.528
    6   HD11  LEU  58          HD11      LEU  58  -6.278 -13.284   4.039
    7   HD13  LEU  58          HD12      LEU  58  -6.256 -12.777   5.728
    8   HD12  LEU  58          HD13      LEU  58  -7.686 -13.564   5.064
    9   HD22  LEU  58          HD21      LEU  58  -6.946 -16.838   5.662
   10   HD21  LEU  58          HD22      LEU  58  -6.614 -16.387   3.990
   11   HD23  LEU  58          HD23      LEU  58  -7.969 -15.656   4.849

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  59           H        ILE  59  -1.505 -15.933   6.090
    2    HA   ILE  59           HA       ILE  59  -0.425 -16.663   3.447
    3    HB   ILE  59           HB       ILE  59   0.361 -14.602   5.011
    4   HG12  ILE  59          HG12      ILE  59   2.427 -16.270   3.560
    5   HG13  ILE  59          HG13      ILE  59   1.243 -15.302   2.722
    6   HG21  ILE  59          HG21      ILE  59   1.110 -16.388   6.764
    7   HG23  ILE  59          HG22      ILE  59   2.207 -15.073   6.401
    8   HG22  ILE  59          HG23      ILE  59   2.457 -16.665   5.685
    9   HD11  ILE  59          HD11      ILE  59   3.169 -14.228   4.782
   10   HD13  ILE  59          HD12      ILE  59   2.036 -13.274   3.827
   11   HD12  ILE  59          HD13      ILE  59   3.390 -14.085   3.039

  No H/Q in entry =          11
  In of MODEL   51
    1    H    GLU  60           H        GLU  60  -0.421 -17.771   6.814
    2    HA   GLU  60           HA       GLU  60   1.599 -19.758   6.537
    3    HB2  GLU  60           HB2      GLU  60   0.932 -19.041   8.741
    4    HB3  GLU  60           HB3      GLU  60  -0.738 -19.519   8.444
    5    HG2  GLU  60           HG2      GLU  60   1.368 -21.615   8.129
    6    HG3  GLU  60           HG3      GLU  60   0.960 -21.107   9.768

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLY  61           H        GLY  61  -1.914 -19.840   6.071
    2    HA3  GLY  61           HA2      GLY  61  -1.683 -22.633   5.110
    3    HA2  GLY  61           HA3      GLY  61  -3.162 -21.891   5.711

  No H/Q in entry =           3
  In of MODEL   51
    1    H    ASP  62           H        ASP  62  -0.939 -20.319   3.497
    2    HA   ASP  62           HA       ASP  62  -3.029 -19.747   1.635
    3    HB2  ASP  62           HB2      ASP  62  -1.190 -18.714   0.324
    4    HB3  ASP  62           HB3      ASP  62  -1.215 -18.174   1.998

  No H/Q in entry =           4
  In of MODEL   51
    1    H    ALA  63           H        ALA  63  -2.839 -22.575   1.883
    2    HA   ALA  63           HA       ALA  63  -1.304 -23.798  -0.177
    3    HB3  ALA  63           HB1      ALA  63  -3.126 -25.606   0.036
    4    HB2  ALA  63           HB2      ALA  63  -3.748 -24.613   1.355
    5    HB1  ALA  63           HB3      ALA  63  -2.113 -25.273   1.442

  No H/Q in entry =           5
  In of MODEL   51
    1    H    GLY  64           H        GLY  64  -4.544 -22.403  -0.051
    2    HA3  GLY  64           HA2      GLY  64  -6.059 -21.836  -1.675
    3    HA2  GLY  64           HA3      GLY  64  -4.675 -21.647  -2.738

  No H/Q in entry =           3
  In of MODEL   51
    1    H    GLU  65           H        GLU  65  -5.276 -22.636  -4.608
    2    HA   GLU  65           HA       GLU  65  -6.993 -24.885  -4.703
    3    HB2  GLU  65           HB2      GLU  65  -5.137 -23.741  -6.791
    4    HB3  GLU  65           HB3      GLU  65  -6.331 -25.003  -7.099
    5    HG2  GLU  65           HG2      GLU  65  -6.971 -22.265  -5.966
    6    HG3  GLU  65           HG3      GLU  65  -7.189 -22.728  -7.652

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLY  66           H        GLY  66  -6.032 -26.614  -6.451
    2    HA3  GLY  66           HA2      GLY  66  -4.599 -28.492  -4.925
    3    HA2  GLY  66           HA3      GLY  66  -4.976 -28.621  -6.632

  No H/Q in entry =           3
  In of MODEL   51
    1    H    LYS  67           H        LYS  67  -3.551 -26.271  -7.429
    2    HA   LYS  67           HA       LYS  67  -0.958 -27.424  -7.752
    3    HB2  LYS  67           HB2      LYS  67  -2.163 -24.823  -8.686
    4    HB3  LYS  67           HB3      LYS  67  -0.551 -25.386  -9.145
    5    HG2  LYS  67           HG2      LYS  67  -1.528 -27.473 -10.029
    6    HG3  LYS  67           HG3      LYS  67  -3.137 -26.915  -9.578
    7    HD2  LYS  67           HD2      LYS  67  -2.909 -24.998 -11.111
    8    HD3  LYS  67           HD3      LYS  67  -1.294 -25.551 -11.561
    9    HE2  LYS  67           HE2      LYS  67  -2.229 -27.657 -12.413
   10    HE3  LYS  67           HE3      LYS  67  -3.845 -27.150 -11.925
   11    HZ1  LYS  67           HZ1      LYS  67  -2.687 -25.121 -13.478
   12    HZ3  LYS  67           HZ2      LYS  67  -4.056 -26.065 -13.821
   13    HZ2  LYS  67           HZ3      LYS  67  -2.517 -26.589 -14.310

  No H/Q in entry =          13
  In of MODEL   51
    1    H    MET  68           H        MET  68   1.041 -26.533  -7.340
    2    HA   MET  68           HA       MET  68   1.642 -25.825  -4.762
    3    HB2  MET  68           HB2      MET  68   3.172 -25.229  -7.295
    4    HB3  MET  68           HB3      MET  68   3.845 -25.096  -5.669
    5    HG2  MET  68           HG2      MET  68   2.629 -27.617  -6.836
    6    HG3  MET  68           HG3      MET  68   4.361 -27.292  -6.727
    7    HE2  MET  68           HE1      MET  68   4.618 -25.883  -3.592
    8    HE1  MET  68           HE2      MET  68   5.539 -26.663  -4.876
    9    HE3  MET  68           HE3      MET  68   5.416 -27.434  -3.297

  No H/Q in entry =           9
  In of MODEL   51
    1    H    LYS  69           H        LYS  69   0.043 -23.789  -6.876
    2    HA   LYS  69           HA       LYS  69   1.269 -21.310  -6.223
    3    HB2  LYS  69           HB2      LYS  69  -1.278 -22.048  -7.588
    4    HB3  LYS  69           HB3      LYS  69  -0.946 -20.367  -7.152
    5    HG2  LYS  69           HG2      LYS  69  -0.147 -21.165  -9.477
    6    HG3  LYS  69           HG3      LYS  69   1.007 -20.285  -8.476
    7    HD2  LYS  69           HD2      LYS  69   2.124 -22.294  -7.830
    8    HD3  LYS  69           HD3      LYS  69   0.830 -23.303  -8.480
    9    HE2  LYS  69           HE2      LYS  69   1.475 -22.952 -10.686
   10    HE3  LYS  69           HE3      LYS  69   2.239 -21.405 -10.322
   11    HZ2  LYS  69           HZ1      LYS  69   3.502 -23.815 -10.591
   12    HZ1  LYS  69           HZ2      LYS  69   3.467 -23.556  -8.912
   13    HZ3  LYS  69           HZ3      LYS  69   4.169 -22.399  -9.937

  No H/Q in entry =          13
  In of MODEL   51
    1    H    VAL  70           H        VAL  70  -0.382 -19.436  -5.523
    2    HA   VAL  70           HA       VAL  70  -1.632 -20.226  -2.953
    3    HB   VAL  70           HB       VAL  70  -0.752 -18.116  -1.982
    4   HG11  VAL  70          HG11      VAL  70   0.485 -20.340  -1.864
    5   HG13  VAL  70          HG12      VAL  70   1.479 -18.903  -1.615
    6   HG12  VAL  70          HG13      VAL  70   1.510 -19.738  -3.168
    7   HG22  VAL  70          HG21      VAL  70  -0.494 -16.750  -3.980
    8   HG21  VAL  70          HG22      VAL  70   0.646 -17.902  -4.673
    9   HG23  VAL  70          HG23      VAL  70   1.108 -16.948  -3.266

  No H/Q in entry =           9
  In of MODEL   51
    1    H    SER  71           H        SER  71  -3.112 -18.517  -2.141
    2    HA   SER  71           HA       SER  71  -5.087 -17.818  -4.034
    3    HB2  SER  71           HB2      SER  71  -5.447 -18.069  -1.537
    4    HB3  SER  71           HB3      SER  71  -4.633 -16.523  -1.323
    5    HG   SER  71           HG       SER  71  -7.160 -17.090  -2.227

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LEU  72           H        LEU  72  -5.243 -16.182  -5.372
    2    HA   LEU  72           HA       LEU  72  -3.132 -14.377  -5.866
    3    HB2  LEU  72           HB2      LEU  72  -6.002 -14.423  -6.793
    4    HB3  LEU  72           HB3      LEU  72  -4.808 -13.266  -7.374
    5    HG   LEU  72           HG       LEU  72  -4.415 -16.274  -7.518
    6   HD11  LEU  72          HD11      LEU  72  -6.390 -15.303  -8.860
    7   HD13  LEU  72          HD12      LEU  72  -5.187 -16.225  -9.762
    8   HD12  LEU  72          HD13      LEU  72  -5.167 -14.463  -9.815
    9   HD22  LEU  72          HD21      LEU  72  -2.290 -15.307  -7.767
   10   HD21  LEU  72          HD22      LEU  72  -2.914 -13.865  -8.550
   11   HD23  LEU  72          HD23      LEU  72  -2.845 -15.385  -9.436

  No H/Q in entry =          11
  In of MODEL   51
    1    H    VAL  73           H        VAL  73  -6.213 -14.012  -4.215
    2    HA   VAL  73           HA       VAL  73  -6.247 -11.241  -3.861
    3    HB   VAL  73           HB       VAL  73  -7.943 -11.601  -2.243
    4   HG12  VAL  73          HG11      VAL  73  -8.081 -13.997  -4.084
    5   HG11  VAL  73          HG12      VAL  73  -8.359 -12.347  -4.639
    6   HG13  VAL  73          HG13      VAL  73  -9.426 -13.063  -3.428
    7   HG21  VAL  73          HG21      VAL  73  -6.533 -14.228  -1.877
    8   HG23  VAL  73          HG22      VAL  73  -8.251 -14.111  -1.496
    9   HG22  VAL  73          HG23      VAL  73  -7.090 -13.085  -0.655

  No H/Q in entry =           9
  In of MODEL   51
    1    H    LEU  74           H        LEU  74  -4.307 -13.617  -2.293
    2    HA   LEU  74           HA       LEU  74  -3.875 -12.481   0.229
    3    HB2  LEU  74           HB2      LEU  74  -3.102 -14.701  -0.278
    4    HB3  LEU  74           HB3      LEU  74  -2.053 -14.091  -1.558
    5    HG   LEU  74           HG       LEU  74  -0.735 -12.842   0.121
    6   HD12  LEU  74          HD11      LEU  74  -1.205 -13.567   2.561
    7   HD11  LEU  74          HD12      LEU  74  -2.800 -14.038   1.974
    8   HD13  LEU  74          HD13      LEU  74  -2.278 -12.357   1.858
    9   HD23  LEU  74          HD21      LEU  74  -0.949 -15.608   1.198
   10   HD22  LEU  74          HD22      LEU  74   0.459 -14.678   0.736
   11   HD21  LEU  74          HD23      LEU  74  -0.538 -15.404  -0.504

  No H/Q in entry =          11
  In of MODEL   51
    1    H    VAL  75           H        VAL  75  -2.003 -12.090  -2.741
    2    HA   VAL  75           HA       VAL  75  -0.192 -10.172  -1.740
    3    HB   VAL  75           HB       VAL  75  -1.169 -10.639  -4.560
    4   HG12  VAL  75          HG11      VAL  75   0.909  -9.353  -5.183
    5   HG11  VAL  75          HG12      VAL  75   1.126  -8.961  -3.484
    6   HG13  VAL  75          HG13      VAL  75  -0.279  -8.359  -4.348
    7   HG23  VAL  75          HG21      VAL  75   1.361 -11.447  -3.078
    8   HG22  VAL  75          HG22      VAL  75   0.994 -11.816  -4.765
    9   HG21  VAL  75          HG23      VAL  75   0.025 -12.531  -3.475

  No H/Q in entry =           9
  In of MODEL   51
    1    H    GLU  76           H        GLU  76  -3.353  -9.813  -3.376
    2    HA   GLU  76           HA       GLU  76  -3.396  -6.998  -3.473
    3    HB2  GLU  76           HB2      GLU  76  -5.067  -8.431  -4.626
    4    HB3  GLU  76           HB3      GLU  76  -5.713  -8.928  -3.069
    5    HG2  GLU  76           HG2      GLU  76  -7.164  -7.208  -3.938
    6    HG3  GLU  76           HG3      GLU  76  -6.273  -6.499  -2.606

  No H/Q in entry =           6
  In of MODEL   51
    1    H    ALA  77           H        ALA  77  -4.496  -9.226  -0.929
    2    HA   ALA  77           HA       ALA  77  -5.435  -7.223   0.839
    3    HB3  ALA  77           HB1      ALA  77  -5.259  -8.970   2.578
    4    HB1  ALA  77           HB2      ALA  77  -4.353  -9.984   1.458
    5    HB2  ALA  77           HB3      ALA  77  -6.034  -9.580   1.117

  No H/Q in entry =           5
  In of MODEL   51
    1    H    GLN  78           H        GLN  78  -2.295  -8.783   0.451
    2    HA   GLN  78           HA       GLN  78  -1.018  -7.630   2.694
    3    HB2  GLN  78           HB2      GLN  78  -0.174  -9.572   1.329
    4    HB3  GLN  78           HB3      GLN  78   0.261  -8.424   0.064
    5    HG2  GLN  78           HG2      GLN  78   1.737  -7.241   1.636
    6    HG3  GLN  78           HG3      GLN  78   1.301  -8.378   2.910
    7   HE21  GLN  78          HE21      GLN  78   4.021  -8.131   2.072
    8   HE22  GLN  78          HE22      GLN  78   4.471  -9.563   1.278

  No H/Q in entry =           8
  In of MODEL   51
    1    H    LEU  79           H        LEU  79  -1.403  -6.563  -0.649
    2    HA   LEU  79           HA       LEU  79   0.292  -4.343  -0.644
    3    HB2  LEU  79           HB2      LEU  79  -0.752  -5.143  -2.692
    4    HB3  LEU  79           HB3      LEU  79  -2.350  -4.745  -2.072
    5    HG   LEU  79           HG       LEU  79  -1.796  -2.361  -2.046
    6   HD13  LEU  79          HD11      LEU  79   0.449  -2.127  -1.549
    7   HD12  LEU  79          HD12      LEU  79   0.487  -1.837  -3.288
    8   HD11  LEU  79          HD13      LEU  79   0.939  -3.418  -2.647
    9   HD23  LEU  79          HD21      LEU  79  -1.178  -2.161  -4.603
   10   HD22  LEU  79          HD22      LEU  79  -2.705  -2.903  -4.134
   11   HD21  LEU  79          HD23      LEU  79  -1.339  -3.917  -4.589

  No H/Q in entry =          11
  In of MODEL   51
    1    H    HIS  80           H        HIS  80  -3.170  -4.492   0.206
    2    HA   HIS  80           HA       HIS  80  -3.345  -1.735   0.874
    3    HB2  HIS  80           HB2      HIS  80  -5.054  -4.137   1.202
    4    HB3  HIS  80           HB3      HIS  80  -5.362  -2.797   2.310
    5    HD1  HIS  80           HD1      HIS  80  -6.978  -1.152   1.415
    6    HD2  HIS  80           HD2      HIS  80  -4.814  -2.970  -1.650
    7    HE1  HIS  80           HE1      HIS  80  -7.828  -0.148  -0.757
    8    HE2  HIS  80           HE2      HIS  80  -6.516  -1.251  -2.634

  No H/Q in entry =           8
  In of MODEL   51
    1    H    LEU  81           H        LEU  81  -2.856  -4.635   2.860
    2    HA   LEU  81           HA       LEU  81  -2.820  -3.291   5.346
    3    HB2  LEU  81           HB2      LEU  81  -1.620  -5.912   4.455
    4    HB3  LEU  81           HB3      LEU  81  -1.580  -5.356   6.129
    5    HG   LEU  81           HG       LEU  81  -4.137  -5.594   4.518
    6   HD12  LEU  81          HD11      LEU  81  -4.439  -7.660   6.065
    7   HD11  LEU  81          HD12      LEU  81  -2.686  -7.598   6.239
    8   HD13  LEU  81          HD13      LEU  81  -3.406  -7.823   4.645
    9   HD23  LEU  81          HD21      LEU  81  -4.964  -5.796   7.025
   10   HD22  LEU  81          HD22      LEU  81  -4.637  -4.208   6.335
   11   HD21  LEU  81          HD23      LEU  81  -3.446  -4.976   7.386

  No H/Q in entry =          11
  In of MODEL   51
    1    H    MET  82           H        MET  82  -0.158  -4.205   3.156
    2    HA   MET  82           HA       MET  82   1.941  -3.324   4.826
    3    HB2  MET  82           HB2      MET  82   1.704  -3.660   1.835
    4    HB3  MET  82           HB3      MET  82   3.194  -3.098   2.589
    5    HG2  MET  82           HG2      MET  82   1.779  -5.681   3.320
    6    HG3  MET  82           HG3      MET  82   3.143  -5.577   2.211
    7    HE3  MET  82           HE1      MET  82   6.176  -4.859   4.174
    8    HE2  MET  82           HE2      MET  82   5.256  -3.486   3.564
    9    HE1  MET  82           HE3      MET  82   5.330  -4.975   2.626

  No H/Q in entry =           9
  In of MODEL   51
    1    H    THR  83           H        THR  83   0.110  -1.669   2.284
    2    HA   THR  83           HA       THR  83   1.536   0.772   2.364
    3    HB   THR  83           HB       THR  83  -0.642   1.710   1.394
    4    HG1  THR  83           HG1      THR  83  -2.301   0.422   1.297
    5   HG22  THR  83          HG21      THR  83  -0.396  -0.107  -0.610
    6   HG21  THR  83          HG22      THR  83   1.109  -0.408   0.256
    7   HG23  THR  83          HG23      THR  83   0.752   1.207  -0.355

  No H/Q in entry =           7
  In of MODEL   51
    1    H    SER  84           H        SER  84  -1.465  -0.246   3.985
    2    HA   SER  84           HA       SER  84  -1.938   2.185   5.336
    3    HB2  SER  84           HB2      SER  84  -2.783  -0.649   5.903
    4    HB3  SER  84           HB3      SER  84  -3.262   0.693   6.941
    5    HG   SER  84           HG       SER  84  -3.741   0.385   4.151

  No H/Q in entry =           5
  In of MODEL   51
    1    H    MET  85           H        MET  85  -0.237  -0.758   6.450
    2    HA   MET  85           HA       MET  85   0.306   0.162   9.052
    3    HB2  MET  85           HB2      MET  85   0.580  -2.181   8.377
    4    HB3  MET  85           HB3      MET  85   1.950  -1.728   7.363
    5    HG2  MET  85           HG2      MET  85   3.157  -0.895   9.345
    6    HG3  MET  85           HG3      MET  85   1.781  -1.317  10.364
    7    HE2  MET  85           HE1      MET  85   0.774  -3.849  10.434
    8    HE1  MET  85           HE2      MET  85   1.802  -3.235  11.728
    9    HE3  MET  85           HE3      MET  85   2.025  -4.880  11.138

  No H/Q in entry =           9
  In of MODEL   51
    1    H    LEU  86           H        LEU  86   2.221   0.410   6.087
    2    HA   LEU  86           HA       LEU  86   4.451   1.706   7.229
    3    HB2  LEU  86           HB2      LEU  86   4.237   0.628   4.920
    4    HB3  LEU  86           HB3      LEU  86   3.435   2.115   4.415
    5    HG   LEU  86           HG       LEU  86   5.477   3.348   5.382
    6   HD11  LEU  86          HD11      LEU  86   6.172   0.731   6.174
    7   HD13  LEU  86          HD12      LEU  86   7.185   2.170   6.266
    8   HD12  LEU  86          HD13      LEU  86   7.278   1.123   4.853
    9   HD23  LEU  86          HD21      LEU  86   6.167   1.583   3.025
   10   HD22  LEU  86          HD22      LEU  86   6.572   3.278   3.286
   11   HD21  LEU  86          HD23      LEU  86   4.914   2.820   2.899

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ALA  87           H        ALA  87   1.535   2.969   5.666
    2    HA   ALA  87           HA       ALA  87   2.147   5.695   5.748
    3    HB1  ALA  87           HB1      ALA  87  -0.176   4.082   5.222
    4    HB3  ALA  87           HB2      ALA  87   0.141   5.742   4.721
    5    HB2  ALA  87           HB3      ALA  87  -0.644   5.423   6.270

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ARG  88           H        ARG  88   0.462   3.701   8.148
    2    HA   ARG  88           HA       ARG  88  -0.025   5.752  10.001
    3    HB2  ARG  88           HB2      ARG  88  -0.977   3.405  10.071
    4    HB3  ARG  88           HB3      ARG  88   0.566   2.895  10.766
    5    HG2  ARG  88           HG2      ARG  88   0.113   4.971  12.391
    6    HG3  ARG  88           HG3      ARG  88  -1.558   4.656  11.947
    7    HD2  ARG  88           HD2      ARG  88  -1.668   2.806  13.192
    8    HD3  ARG  88           HD3      ARG  88  -0.086   2.216  12.649
    9    HE   ARG  88           HE       ARG  88  -0.595   3.480  15.108
   10   HH21  ARG  88          HH11      ARG  88   0.978   4.481  16.337
   11   HH22  ARG  88          HH12      ARG  88   2.495   4.900  15.622
   12   HH11  ARG  88          HH21      ARG  88   1.669   3.650  12.515
   13   HH12  ARG  88          HH22      ARG  88   2.894   4.413  13.470

  No H/Q in entry =          13
  In of MODEL   51
    1    H    GLU  89           H        GLU  89   2.757   3.517   9.756
    2    HA   GLU  89           HA       GLU  89   4.040   4.396  12.092
    3    HB2  GLU  89           HB2      GLU  89   4.678   2.376  10.741
    4    HB3  GLU  89           HB3      GLU  89   5.452   3.466   9.590
    5    HG2  GLU  89           HG2      GLU  89   6.954   4.303  11.324
    6    HG3  GLU  89           HG3      GLU  89   6.122   3.350  12.550

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LEU  90           H        LEU  90   4.340   5.555   8.763
    2    HA   LEU  90           HA       LEU  90   6.286   7.545   9.336
    3    HB2  LEU  90           HB2      LEU  90   4.262   7.226   7.123
    4    HB3  LEU  90           HB3      LEU  90   5.500   8.490   7.136
    5    HG   LEU  90           HG       LEU  90   6.160   5.550   7.463
    6   HD12  LEU  90          HD11      LEU  90   6.893   5.781   5.018
    7   HD11  LEU  90          HD12      LEU  90   5.885   7.227   4.978
    8   HD13  LEU  90          HD13      LEU  90   5.159   5.658   5.325
    9   HD22  LEU  90          HD21      LEU  90   8.068   6.689   8.133
   10   HD21  LEU  90          HD22      LEU  90   7.719   8.096   7.129
   11   HD23  LEU  90          HD23      LEU  90   8.365   6.629   6.397

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  91           H        ILE  91   2.746   7.579   9.212
    2    HA   ILE  91           HA       ILE  91   2.421  10.353   9.667
    3    HB   ILE  91           HB       ILE  91   0.622   7.986  10.220
    4   HG12  ILE  91          HG12      ILE  91   0.371  10.270   8.239
    5   HG13  ILE  91          HG13      ILE  91   1.221   8.772   7.860
    6   HG22  ILE  91          HG21      ILE  91  -1.100  10.052  10.298
    7   HG21  ILE  91          HG22      ILE  91   0.310  10.875  10.961
    8   HG23  ILE  91          HG23      ILE  91  -0.328   9.440  11.761
    9   HD13  ILE  91          HD11      ILE  91  -0.729   7.494   7.917
   10   HD12  ILE  91          HD12      ILE  91  -1.316   9.012   7.240
   11   HD11  ILE  91          HD13      ILE  91  -1.577   8.648   8.947

  No H/Q in entry =          11
  In of MODEL   51
    1    H    THR  92           H        THR  92   2.826   7.608  11.864
    2    HA   THR  92           HA       THR  92   2.406   8.981  14.292
    3    HB   THR  92           HB       THR  92   4.199   6.639  13.613
    4    HG1  THR  92           HG1      THR  92   2.226   5.891  13.525
    5   HG22  THR  92          HG21      THR  92   3.832   6.354  16.249
    6   HG21  THR  92          HG22      THR  92   3.775   8.114  16.177
    7   HG23  THR  92          HG23      THR  92   5.200   7.252  15.594

  No H/Q in entry =           7
  In of MODEL   51
    1    H    GLU  93           H        GLU  93   5.342   8.521  12.338
    2    HA   GLU  93           HA       GLU  93   7.113   9.939  14.024
    3    HB2  GLU  93           HB2      GLU  93   7.179   9.626  11.008
    4    HB3  GLU  93           HB3      GLU  93   8.529  10.150  12.013
    5    HG2  GLU  93           HG2      GLU  93   7.112   7.519  12.469
    6    HG3  GLU  93           HG3      GLU  93   8.489   7.666  11.384

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LEU  94           H        LEU  94   5.050  10.964  11.325
    2    HA   LEU  94           HA       LEU  94   5.865  13.665  11.221
    3    HB2  LEU  94           HB2      LEU  94   3.264  12.310  10.484
    4    HB3  LEU  94           HB3      LEU  94   3.528  14.037  10.242
    5    HG   LEU  94           HG       LEU  94   5.530  12.042   9.177
    6   HD11  LEU  94          HD11      LEU  94   2.784  12.603   8.133
    7   HD13  LEU  94          HD12      LEU  94   3.761  11.143   8.000
    8   HD12  LEU  94          HD13      LEU  94   4.094  12.523   6.954
    9   HD23  LEU  94          HD21      LEU  94   5.776  13.878   7.454
   10   HD22  LEU  94          HD22      LEU  94   6.203  14.368   9.093
   11   HD21  LEU  94          HD23      LEU  94   4.650  14.842   8.405

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  95           H        ILE  95   3.334  12.056  13.128
    2    HA   ILE  95           HA       ILE  95   2.307  14.409  14.331
    3    HB   ILE  95           HB       ILE  95   2.321  11.527  15.255
    4   HG12  ILE  95          HG12      ILE  95   0.099  13.308  14.221
    5   HG13  ILE  95          HG13      ILE  95   1.045  12.246  13.182
    6   HG21  ILE  95          HG21      ILE  95   1.055  14.003  16.466
    7   HG23  ILE  95          HG22      ILE  95   2.104  12.830  17.263
    8   HG22  ILE  95          HG23      ILE  95   0.464  12.374  16.798
    9   HD13  ILE  95          HD11      ILE  95   0.142  10.310  14.106
   10   HD12  ILE  95          HD12      ILE  95  -1.236  11.404  14.192
   11   HD11  ILE  95          HD13      ILE  95  -0.263  11.102  15.630

  No H/Q in entry =          11
  In of MODEL   51
    1    H    GLU  96           H        GLU  96   4.902  12.181  15.309
    2    HA   GLU  96           HA       GLU  96   5.477  13.377  17.798
    3    HB2  GLU  96           HB2      GLU  96   6.414  11.216  17.143
    4    HB3  GLU  96           HB3      GLU  96   7.341  11.987  15.857
    5    HG2  GLU  96           HG2      GLU  96   9.001  12.530  17.309
    6    HG3  GLU  96           HG3      GLU  96   7.863  13.346  18.372

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LEU  97           H        LEU  97   6.532  14.148  14.505
    2    HA   LEU  97           HA       LEU  97   8.428  16.139  15.206
    3    HB2  LEU  97           HB2      LEU  97   6.819  15.595  12.721
    4    HB3  LEU  97           HB3      LEU  97   7.843  17.023  12.836
    5    HG   LEU  97           HG       LEU  97   8.868  14.223  13.388
    6   HD12  LEU  97          HD11      LEU  97   9.850  14.416  11.065
    7   HD11  LEU  97          HD12      LEU  97   8.801  15.809  10.809
    8   HD13  LEU  97          HD13      LEU  97   8.099  14.219  11.107
    9   HD23  LEU  97          HD21      LEU  97  11.036  15.497  12.632
   10   HD22  LEU  97          HD22      LEU  97  10.428  15.767  14.265
   11   HD21  LEU  97          HD23      LEU  97  10.108  16.952  13.000

  No H/Q in entry =          11
  In of MODEL   51
    1    H    HIS  98           H        HIS  98   4.933  16.283  14.574
    2    HA   HIS  98           HA       HIS  98   4.641  19.083  14.712
    3    HB2  HIS  98           HB2      HIS  98   2.750  16.836  15.449
    4    HB3  HIS  98           HB3      HIS  98   2.288  18.538  15.509
    5    HD1  HIS  98           HD1      HIS  98   3.287  15.822  13.096
    6    HD2  HIS  98           HD2      HIS  98   1.919  19.758  12.985
    7    HE1  HIS  98           HE1      HIS  98   2.714  16.313  10.676
    8    HE2  HIS  98           HE2      HIS  98   1.884  18.704  10.587

  No H/Q in entry =           8
  In of MODEL   51
    1    H    GLU  99           H        GLU  99   4.784  16.593  17.209
    2    HA   GLU  99           HA       GLU  99   4.194  18.287  19.412
    3    HB2  GLU  99           HB2      GLU  99   4.101  15.806  19.508
    4    HB3  GLU  99           HB3      GLU  99   5.860  15.757  19.389
    5    HG2  GLU  99           HG2      GLU  99   6.065  17.048  21.462
    6    HG3  GLU  99           HG3      GLU  99   4.313  17.192  21.569

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LYS 100           H        LYS 100   7.236  17.351  17.827
    2    HA   LYS 100           HA       LYS 100   8.906  18.747  19.674
    3    HB2  LYS 100           HB2      LYS 100   9.384  17.823  16.831
    4    HB3  LYS 100           HB3      LYS 100  10.622  18.589  17.832
    5    HG2  LYS 100           HG2      LYS 100  10.253  16.839  19.574
    6    HG3  LYS 100           HG3      LYS 100   9.113  16.038  18.490
    7    HD2  LYS 100           HD2      LYS 100  10.895  15.752  16.811
    8    HD3  LYS 100           HD3      LYS 100  12.041  16.565  17.881
    9    HE2  LYS 100           HE2      LYS 100  11.652  14.809  19.600
   10    HE3  LYS 100           HE3      LYS 100  10.568  13.977  18.482
   11    HZ1  LYS 100           HZ1      LYS 100  13.385  14.640  17.808
   12    HZ3  LYS 100           HZ2      LYS 100  12.334  13.588  16.986
   13    HZ2  LYS 100           HZ3      LYS 100  12.931  13.167  18.521

  No H/Q in entry =          13
  In of MODEL   51
    1    H    LEU 101           H        LEU 101   7.195  19.679  16.730
    2    HA   LEU 101           HA       LEU 101   8.413  22.234  16.388
    3    HB2  LEU 101           HB2      LEU 101   5.809  21.006  15.517
    4    HB3  LEU 101           HB3      LEU 101   6.063  22.737  15.309
    5    HG   LEU 101           HG       LEU 101   8.088  20.717  14.329
    6   HD12  LEU 101          HD11      LEU 101   6.921  21.226  12.052
    7   HD11  LEU 101          HD12      LEU 101   5.529  21.659  13.042
    8   HD13  LEU 101          HD13      LEU 101   6.190  20.027  13.118
    9   HD21  LEU 101          HD21      LEU 101   7.463  23.631  13.779
   10   HD23  LEU 101          HD22      LEU 101   8.434  22.669  12.666
   11   HD22  LEU 101          HD23      LEU 101   8.987  22.924  14.320

  No H/Q in entry =          11
  In of MODEL   51
    1    H    LYS 102           H        LYS 102   6.890  21.098  19.013
    2    HA   LYS 102           HA       LYS 102   6.273  22.190  20.950
    3    HB2  LYS 102           HB2      LYS 102   7.553  24.177  19.818
    4    HB3  LYS 102           HB3      LYS 102   5.953  24.786  19.453
    5    HG2  LYS 102           HG2      LYS 102   7.347  24.526  22.096
    6    HG3  LYS 102           HG3      LYS 102   6.393  25.857  21.474
    7    HD2  LYS 102           HD2      LYS 102   5.149  23.223  22.360
    8    HD3  LYS 102           HD3      LYS 102   5.408  24.583  23.442
    9    HE2  LYS 102           HE2      LYS 102   3.118  24.187  21.968
   10    HE3  LYS 102           HE3      LYS 102   3.629  25.731  22.648
   11    HZ2  LYS 102           HZ1      LYS 102   3.083  25.841  20.272
   12    HZ1  LYS 102           HZ2      LYS 102   4.340  24.756  19.940
   13    HZ3  LYS 102           HZ3      LYS 102   4.691  26.286  20.581

  No H/Q in entry =          13
  In of MODEL   51
    1    H    ALA 103           H        ALA 103   4.621  23.739  18.194
    2    HA   ALA 103           HA       ALA 103   2.174  24.321  19.096
    3    HB1  ALA 103           HB1      ALA 103   1.259  23.483  16.859
    4    HB2  ALA 103           HB2      ALA 103   2.902  22.942  16.518
    5    HB3  ALA 103           HB3      ALA 103   2.574  24.655  16.788

  No H/Q in entry =           5
  In of MODEL   51
    1    H1   ALA   1           H3       ALA   1  10.490 -20.184  -6.264
    2    H2   ALA   1           H2       ALA   1   9.516 -20.387  -7.644
    3    H3   ALA   1           H1       ALA   1   9.086 -21.133  -6.178
    4    HA   ALA   1           HA       ALA   1  10.115 -22.944  -6.926
    5    HB1  ALA   1           HB1      ALA   1  10.196 -22.584  -9.202
    6    HB2  ALA   1           HB2      ALA   1  11.926 -22.439  -8.885
    7    HB3  ALA   1           HB3      ALA   1  10.931 -20.989  -9.028

  No H/Q in entry =           7
  In of MODEL   51
    1    H    GLU   2           H        GLU   2  12.395 -23.902  -7.000
    2    HA   GLU   2           HA       GLU   2  13.791 -23.827  -4.798
    3    HB2  GLU   2           HB2      GLU   2  15.130 -23.698  -7.506
    4    HB3  GLU   2           HB3      GLU   2  15.866 -24.313  -6.026
    5    HG2  GLU   2           HG2      GLU   2  14.841 -26.326  -6.262
    6    HG3  GLU   2           HG3      GLU   2  13.270 -25.574  -6.509

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLU   3           H        GLU   3  15.552 -21.966  -7.210
    2    HA   GLU   3           HA       GLU   3  16.725 -20.285  -5.257
    3    HB2  GLU   3           HB2      GLU   3  16.648 -20.280  -8.266
    4    HB3  GLU   3           HB3      GLU   3  17.405 -18.954  -7.383
    5    HG2  GLU   3           HG2      GLU   3  19.069 -20.335  -6.473
    6    HG3  GLU   3           HG3      GLU   3  18.116 -21.799  -6.688

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LEU   4           H        LEU   4  14.428 -19.427  -7.871
    2    HA   LEU   4           HA       LEU   4  13.975 -16.817  -7.255
    3    HB2  LEU   4           HB2      LEU   4  11.788 -18.783  -7.971
    4    HB3  LEU   4           HB3      LEU   4  11.718 -17.034  -8.168
    5    HG   LEU   4           HG       LEU   4  13.666 -18.903  -9.556
    6   HD13  LEU   4          HD11      LEU   4  12.351 -18.748 -11.457
    7   HD12  LEU   4          HD12      LEU   4  11.652 -17.201 -10.983
    8   HD11  LEU   4          HD13      LEU   4  11.099 -18.690 -10.220
    9   HD23  LEU   4          HD21      LEU   4  14.001 -16.658 -10.908
   10   HD22  LEU   4          HD22      LEU   4  14.870 -16.905  -9.395
   11   HD21  LEU   4          HD23      LEU   4  13.421 -15.903  -9.423

  No H/Q in entry =          11
  In of MODEL   51
    1    H    GLU   5           H        GLU   5  12.491 -19.597  -5.604
    2    HA   GLU   5           HA       GLU   5  10.831 -18.021  -3.889
    3    HB2  GLU   5           HB2      GLU   5  10.395 -20.398  -4.409
    4    HB3  GLU   5           HB3      GLU   5  11.833 -20.839  -3.486
    5    HG2  GLU   5           HG2      GLU   5  10.877 -19.794  -1.476
    6    HG3  GLU   5           HG3      GLU   5   9.444 -19.332  -2.393

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLU   6           H        GLU   6  13.975 -19.612  -3.469
    2    HA   GLU   6           HA       GLU   6  14.349 -18.759  -0.772
    3    HB2  GLU   6           HB2      GLU   6  15.560 -20.677  -1.786
    4    HB3  GLU   6           HB3      GLU   6  16.429 -19.549  -2.828
    5    HG2  GLU   6           HG2      GLU   6  17.371 -18.423  -0.866
    6    HG3  GLU   6           HG3      GLU   6  16.464 -19.492   0.203

  No H/Q in entry =           6
  In of MODEL   51
    1    H    VAL   7           H        VAL   7  15.098 -17.432  -3.926
    2    HA   VAL   7           HA       VAL   7  16.797 -15.312  -3.072
    3    HB   VAL   7           HB       VAL   7  15.072 -15.668  -5.537
    4   HG11  VAL   7          HG11      VAL   7  16.978 -13.461  -4.737
    5   HG13  VAL   7          HG12      VAL   7  15.332 -13.313  -5.349
    6   HG12  VAL   7          HG13      VAL   7  16.632 -13.819  -6.428
    7   HG21  VAL   7          HG21      VAL   7  17.179 -17.132  -4.984
    8   HG23  VAL   7          HG22      VAL   7  18.086 -15.673  -5.388
    9   HG22  VAL   7          HG23      VAL   7  17.038 -16.419  -6.592

  No H/Q in entry =           9
  In of MODEL   51
    1    H    VAL   8           H        VAL   8  13.299 -15.570  -3.605
    2    HA   VAL   8           HA       VAL   8  12.645 -12.860  -3.126
    3    HB   VAL   8           HB       VAL   8  11.037 -15.392  -2.703
    4   HG11  VAL   8          HG11      VAL   8  10.293 -12.472  -2.450
    5   HG13  VAL   8          HG12      VAL   8  10.016 -13.772  -1.291
    6   HG12  VAL   8          HG13      VAL   8   9.088 -13.714  -2.789
    7   HG22  VAL   8          HG21      VAL   8  10.411 -15.199  -4.913
    8   HG21  VAL   8          HG22      VAL   8  11.884 -14.245  -5.059
    9   HG23  VAL   8          HG23      VAL   8  10.335 -13.440  -4.833

  No H/Q in entry =           9
  In of MODEL   51
    1    H    MET   9           H        MET   9  12.919 -15.669  -0.950
    2    HA   MET   9           HA       MET   9  12.124 -14.397   1.426
    3    HB2  MET   9           HB2      MET   9  14.032 -16.670   0.879
    4    HB3  MET   9           HB3      MET   9  13.719 -16.097   2.518
    5    HG2  MET   9           HG2      MET   9  11.311 -16.504   2.215
    6    HG3  MET   9           HG3      MET   9  11.607 -17.053   0.565
    7    HE2  MET   9           HE1      MET   9  11.245 -18.443   4.278
    8    HE1  MET   9           HE2      MET   9  12.532 -17.252   4.112
    9    HE3  MET   9           HE3      MET   9  12.932 -18.924   4.493

  No H/Q in entry =           9
  In of MODEL   51
    1    H    GLY  10           H        GLY  10  15.293 -14.628  -0.152
    2    HA3  GLY  10           HA2      GLY  10  16.769 -13.212   1.809
    3    HA2  GLY  10           HA3      GLY  10  17.220 -13.377   0.112

  No H/Q in entry =           3
  In of MODEL   51
    1    H    LEU  11           H        LEU  11  15.046 -12.150  -1.111
    2    HA   LEU  11           HA       LEU  11  15.738  -9.407  -0.951
    3    HB2  LEU  11           HB2      LEU  11  13.359 -10.811  -2.171
    4    HB3  LEU  11           HB3      LEU  11  13.642  -9.077  -2.331
    5    HG   LEU  11           HG       LEU  11  15.660 -11.189  -3.134
    6   HD13  LEU  11          HD11      LEU  11  13.903 -11.551  -4.643
    7   HD12  LEU  11          HD12      LEU  11  14.902 -10.371  -5.489
    8   HD11  LEU  11          HD13      LEU  11  13.436  -9.850  -4.660
    9   HD22  LEU  11          HD21      LEU  11  16.897  -9.228  -2.915
   10   HD21  LEU  11          HD22      LEU  11  15.521  -8.188  -3.284
   11   HD23  LEU  11          HD23      LEU  11  16.342  -9.057  -4.579

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  12           H        ILE  12  12.975 -11.229   0.334
    2    HA   ILE  12           HA       ILE  12  11.592  -9.003   1.405
    3    HB   ILE  12           HB       ILE  12  11.631 -11.885   2.356
    4   HG12  ILE  12          HG12      ILE  12  10.936 -11.261  -0.090
    5   HG13  ILE  12          HG13      ILE  12   9.907 -12.341   0.829
    6   HG22  ILE  12          HG21      ILE  12   9.369 -11.310   3.296
    7   HG21  ILE  12          HG22      ILE  12   9.687  -9.618   2.912
    8   HG23  ILE  12          HG23      ILE  12  10.697 -10.461   4.086
    9   HD11  ILE  12          HD11      ILE  12   9.492  -9.350   0.608
   10   HD13  ILE  12          HD12      ILE  12   8.391 -10.522   1.328
   11   HD12  ILE  12          HD13      ILE  12   8.678 -10.535  -0.398

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  13           H        ILE  13  13.992 -11.212   2.793
    2    HA   ILE  13           HA       ILE  13  14.046 -10.035   5.374
    3    HB   ILE  13           HB       ILE  13  16.099 -11.604   3.794
    4   HG12  ILE  13          HG12      ILE  13  13.825 -12.577   4.631
    5   HG13  ILE  13          HG13      ILE  13  15.300 -13.499   4.898
    6   HG21  ILE  13          HG21      ILE  13  16.205 -10.653   6.671
    7   HG23  ILE  13          HG22      ILE  13  17.371 -10.317   5.398
    8   HG22  ILE  13          HG23      ILE  13  17.224 -11.950   6.048
    9   HD12  ILE  13          HD11      ILE  13  13.558 -13.051   6.890
   10   HD11  ILE  13          HD12      ILE  13  14.479 -11.557   7.013
   11   HD13  ILE  13          HD13      ILE  13  15.295 -13.106   7.179

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ASN  14           H        ASN  14  15.980  -9.503   2.442
    2    HA   ASN  14           HA       ASN  14  17.732  -7.563   3.494
    3    HB2  ASN  14           HB2      ASN  14  17.694  -8.828   1.177
    4    HB3  ASN  14           HB3      ASN  14  16.798  -7.410   0.648
    5   HD21  ASN  14          HD21      ASN  14  19.230  -7.749  -0.555
    6   HD22  ASN  14          HD22      ASN  14  20.378  -6.666   0.066

  No H/Q in entry =           6
  In of MODEL   51
    1    H    SER  15           H        SER  15  14.611  -7.215   1.822
    2    HA   SER  15           HA       SER  15  14.498  -4.394   1.882
    3    HB2  SER  15           HB2      SER  15  12.163  -4.641   1.403
    4    HB3  SER  15           HB3      SER  15  12.955  -6.005   0.624
    5    HG   SER  15           HG       SER  15  11.029  -6.092   2.384

  No H/Q in entry =           5
  In of MODEL   51
    1    H    GLY  16           H        GLY  16  13.421  -6.856   4.191
    2    HA3  GLY  16           HA2      GLY  16  12.211  -5.109   6.057
    3    HA2  GLY  16           HA3      GLY  16  12.829  -6.718   6.414

  No H/Q in entry =           3
  In of MODEL   51
    1    H    GLN  17           H        GLN  17  15.536  -6.382   5.804
    2    HA   GLN  17           HA       GLN  17  16.507  -5.163   8.180
    3    HB2  GLN  17           HB2      GLN  17  17.716  -6.958   6.946
    4    HB3  GLN  17           HB3      GLN  17  18.048  -5.811   5.648
    5    HG2  GLN  17           HG2      GLN  17  19.978  -5.926   7.137
    6    HG3  GLN  17           HG3      GLN  17  19.217  -4.343   7.287
    7   HE21  GLN  17          HE21      GLN  17  19.683  -3.877   9.486
    8   HE22  GLN  17          HE22      GLN  17  19.167  -4.850  10.777

  No H/Q in entry =           8
  In of MODEL   51
    1    H    ALA  18           H        ALA  18  16.296  -4.082   4.822
    2    HA   ALA  18           HA       ALA  18  17.731  -1.689   5.041
    3    HB1  ALA  18           HB1      ALA  18  16.601  -2.903   2.980
    4    HB3  ALA  18           HB2      ALA  18  16.864  -1.159   2.964
    5    HB2  ALA  18           HB3      ALA  18  15.268  -1.807   3.343

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ARG  19           H        ARG  19  14.234  -2.280   5.460
    2    HA   ARG  19           HA       ARG  19  13.568   0.368   6.181
    3    HB2  ARG  19           HB2      ARG  19  11.885  -1.384   5.604
    4    HB3  ARG  19           HB3      ARG  19  12.238  -2.183   7.138
    5    HG2  ARG  19           HG2      ARG  19  11.533  -0.194   8.384
    6    HG3  ARG  19           HG3      ARG  19  11.272   0.684   6.877
    7    HD2  ARG  19           HD2      ARG  19   9.137  -0.116   7.711
    8    HD3  ARG  19           HD3      ARG  19   9.548  -0.994   6.231
    9    HE   ARG  19           HE       ARG  19  10.521  -2.537   8.329
   10   HH21  ARG  19          HH11      ARG  19   9.280  -4.179   9.275
   11   HH22  ARG  19          HH12      ARG  19   7.559  -4.153   9.115
   12   HH11  ARG  19          HH21      ARG  19   7.519  -1.246   7.254
   13   HH12  ARG  19          HH22      ARG  19   6.562  -2.493   7.966

  No H/Q in entry =          13
  In of MODEL   51
    1    H    SER  20           H        SER  20  14.442  -2.462   8.133
    2    HA   SER  20           HA       SER  20  14.173  -1.365  10.673
    3    HB2  SER  20           HB2      SER  20  14.641  -3.687  10.551
    4    HB3  SER  20           HB3      SER  20  16.082  -3.426   9.572
    5    HG   SER  20           HG       SER  20  15.777  -2.423  12.206

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LEU  21           H        LEU  21  17.003  -1.299   8.519
    2    HA   LEU  21           HA       LEU  21  18.687   0.188  10.248
    3    HB2  LEU  21           HB2      LEU  21  18.647  -0.083   7.234
    4    HB3  LEU  21           HB3      LEU  21  19.905   0.779   8.114
    5    HG   LEU  21           HG       LEU  21  19.174  -2.114   8.654
    6   HD13  LEU  21          HD11      LEU  21  20.019  -2.093   6.427
    7   HD12  LEU  21          HD12      LEU  21  21.395  -2.528   7.439
    8   HD11  LEU  21          HD13      LEU  21  21.241  -0.885   6.822
    9   HD21  LEU  21          HD21      LEU  21  21.286  -0.211   9.649
   10   HD23  LEU  21          HD22      LEU  21  21.678  -1.923   9.548
   11   HD22  LEU  21          HD23      LEU  21  20.349  -1.388  10.562

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ALA  22           H        ALA  22  16.406   1.156   7.706
    2    HA   ALA  22           HA       ALA  22  16.942   3.915   7.719
    3    HB3  ALA  22           HB1      ALA  22  15.530   2.673   6.049
    4    HB2  ALA  22           HB2      ALA  22  14.825   4.184   6.621
    5    HB1  ALA  22           HB3      ALA  22  14.240   2.644   7.251

  No H/Q in entry =           5
  In of MODEL   51
    1    H    TYR  23           H        TYR  23  14.458   2.095   9.568
    2    HA   TYR  23           HA       TYR  23  13.502   4.330  11.025
    3    HB2  TYR  23           HB2      TYR  23  12.268   2.217  11.011
    4    HB3  TYR  23           HB3      TYR  23  13.606   1.405  11.825
    5    HD1  TYR  23           HD1      TYR  23  11.107   4.150  12.212
    6    HD2  TYR  23           HD2      TYR  23  13.817   1.460  14.180
    7    HE1  TYR  23           HE1      TYR  23  10.194   4.840  14.415
    8    HE2  TYR  23           HE2      TYR  23  12.904   2.148  16.380
    9    HH   TYR  23           HH       TYR  23  11.705   4.277  17.286

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ALA  24           H        ALA  24  16.153   2.056  11.644
    2    HA   ALA  24           HA       ALA  24  16.839   3.050  14.204
    3    HB1  ALA  24           HB1      ALA  24  18.195   1.258  14.030
    4    HB3  ALA  24           HB2      ALA  24  19.215   2.181  12.925
    5    HB2  ALA  24           HB3      ALA  24  17.917   1.172  12.291

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ALA  25           H        ALA  25  17.775   3.982  10.920
    2    HA   ALA  25           HA       ALA  25  19.723   5.917  11.555
    3    HB1  ALA  25           HB1      ALA  25  18.993   4.971   9.244
    4    HB3  ALA  25           HB2      ALA  25  19.494   6.658   9.335
    5    HB2  ALA  25           HB3      ALA  25  17.779   6.251   9.276

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LEU  26           H        LEU  26  16.206   6.145  11.216
    2    HA   LEU  26           HA       LEU  26  15.984   8.926  11.671
    3    HB2  LEU  26           HB2      LEU  26  14.117   7.691  10.753
    4    HB3  LEU  26           HB3      LEU  26  14.035   6.662  12.178
    5    HG   LEU  26           HG       LEU  26  13.437   8.619  13.564
    6   HD12  LEU  26          HD11      LEU  26  12.768  10.720  12.245
    7   HD11  LEU  26          HD12      LEU  26  13.741  10.069  10.928
    8   HD13  LEU  26          HD13      LEU  26  14.495  10.452  12.476
    9   HD21  LEU  26          HD21      LEU  26  11.746   8.308  11.064
   10   HD23  LEU  26          HD22      LEU  26  11.195   9.004  12.585
   11   HD22  LEU  26          HD23      LEU  26  11.647   7.303  12.511

  No H/Q in entry =          11
  In of MODEL   51
    1    H    LYS  27           H        LYS  27  15.889   6.145  13.862
    2    HA   LYS  27           HA       LYS  27  15.311   7.509  16.235
    3    HB2  LYS  27           HB2      LYS  27  15.337   5.034  15.968
    4    HB3  LYS  27           HB3      LYS  27  17.100   5.086  15.914
    5    HG2  LYS  27           HG2      LYS  27  17.165   6.070  18.164
    6    HG3  LYS  27           HG3      LYS  27  15.398   6.089  18.220
    7    HD2  LYS  27           HD2      LYS  27  15.370   3.622  17.981
    8    HD3  LYS  27           HD3      LYS  27  17.135   3.611  17.959
    9    HE2  LYS  27           HE2      LYS  27  17.183   4.598  20.216
   10    HE3  LYS  27           HE3      LYS  27  15.418   4.639  20.242
   11    HZ3  LYS  27           HZ1      LYS  27  16.212   2.685  21.386
   12    HZ2  LYS  27           HZ2      LYS  27  17.119   2.207  20.029
   13    HZ1  LYS  27           HZ3      LYS  27  15.421   2.213  19.960

  No H/Q in entry =          13
  In of MODEL   51
    1    H    GLN  28           H        GLN  28  18.418   6.926  14.623
    2    HA   GLN  28           HA       GLN  28  20.115   8.007  16.604
    3    HB2  GLN  28           HB2      GLN  28  20.383   7.961  13.587
    4    HB3  GLN  28           HB3      GLN  28  21.677   8.435  14.688
    5    HG2  GLN  28           HG2      GLN  28  20.256   5.760  14.777
    6    HG3  GLN  28           HG3      GLN  28  21.809   6.033  13.990
    7   HE21  GLN  28          HE21      GLN  28  23.032   7.772  15.883
    8   HE22  GLN  28          HE22      GLN  28  23.254   6.923  17.334

  No H/Q in entry =           8
  In of MODEL   51
    1    H    ALA  29           H        ALA  29  18.348   9.494  13.924
    2    HA   ALA  29           HA       ALA  29  19.352  12.113  14.174
    3    HB2  ALA  29           HB1      ALA  29  17.645  12.753  12.713
    4    HB1  ALA  29           HB2      ALA  29  16.503  11.581  13.371
    5    HB3  ALA  29           HB3      ALA  29  17.827  11.038  12.339

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LYS  30           H        LYS  30  16.582  10.516  15.710
    2    HA   LYS  30           HA       LYS  30  15.580  12.770  17.076
    3    HB2  LYS  30           HB2      LYS  30  15.468   9.828  17.777
    4    HB3  LYS  30           HB3      LYS  30  14.610  11.079  18.678
    5    HG2  LYS  30           HG2      LYS  30  13.473  11.769  16.567
    6    HG3  LYS  30           HG3      LYS  30  14.270  10.432  15.734
    7    HD2  LYS  30           HD2      LYS  30  13.204   8.826  17.268
    8    HD3  LYS  30           HD3      LYS  30  12.418  10.151  18.125
    9    HE2  LYS  30           HE2      LYS  30  11.238  10.789  16.040
   10    HE3  LYS  30           HE3      LYS  30  12.005   9.434  15.203
   11    HZ2  LYS  30           HZ1      LYS  30   9.701   9.028  16.097
   12    HZ1  LYS  30           HZ2      LYS  30  10.378   9.078  17.660
   13    HZ3  LYS  30           HZ3      LYS  30  10.877   7.893  16.545

  No H/Q in entry =          13
  In of MODEL   51
    1    H    GLN  31           H        GLN  31  18.241  10.594  17.794
    2    HA   GLN  31           HA       GLN  31  18.587  11.605  20.487
    3    HB2  GLN  31           HB2      GLN  31  20.597  10.032  18.868
    4    HB3  GLN  31           HB3      GLN  31  20.474  10.155  20.624
    5    HG2  GLN  31           HG2      GLN  31  17.954   9.209  19.870
    6    HG3  GLN  31           HG3      GLN  31  19.047   8.363  18.782
    7   HE21  GLN  31          HE21      GLN  31  17.516   7.218  21.067
    8   HE22  GLN  31          HE22      GLN  31  18.677   6.554  22.109

  No H/Q in entry =           8
  In of MODEL   51
    1    H    GLY  32           H        GLY  32  19.091  12.925  17.519
    2    HA3  GLY  32           HA2      GLY  32  20.076  14.968  17.001
    3    HA2  GLY  32           HA3      GLY  32  20.844  14.970  18.584

  No H/Q in entry =           3
  In of MODEL   51
    1    H    ASP  33           H        ASP  33  21.248  12.078  16.801
    2    HA   ASP  33           HA       ASP  33  24.072  12.748  16.318
    3    HB2  ASP  33           HB2      ASP  33  22.559  10.135  16.441
    4    HB3  ASP  33           HB3      ASP  33  24.242  10.249  15.936

  No H/Q in entry =           4
  In of MODEL   51
    1    H    PHE  34           H        PHE  34  23.582  14.074  14.441
    2    HA   PHE  34           HA       PHE  34  22.216  13.095  12.161
    3    HB2  PHE  34           HB2      PHE  34  24.353  15.225  12.380
    4    HB3  PHE  34           HB3      PHE  34  23.358  14.938  10.954
    5    HD1  PHE  34           HD1      PHE  34  23.631  16.869  13.868
    6    HD2  PHE  34           HD2      PHE  34  20.735  14.761  11.498
    7    HE1  PHE  34           HE1      PHE  34  21.823  18.269  14.828
    8    HE2  PHE  34           HE2      PHE  34  18.931  16.161  12.461
    9    HZ   PHE  34           HZ       PHE  34  19.479  17.916  14.122

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ALA  35           H        ALA  35  25.597  12.900  13.148
    2    HA   ALA  35           HA       ALA  35  26.685  12.080  10.683
    3    HB3  ALA  35           HB1      ALA  35  28.374  10.906  12.391
    4    HB2  ALA  35           HB2      ALA  35  27.520  11.932  13.543
    5    HB1  ALA  35           HB3      ALA  35  28.349  12.655  12.166

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ALA  36           H        ALA  36  25.584  10.123  13.454
    2    HA   ALA  36           HA       ALA  36  26.056   7.636  12.172
    3    HB2  ALA  36           HB1      ALA  36  25.637   6.888  14.250
    4    HB3  ALA  36           HB2      ALA  36  23.949   7.386  14.111
    5    HB1  ALA  36           HB3      ALA  36  25.156   8.515  14.727

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ALA  37           H        ALA  37  23.238   9.766  12.326
    2    HA   ALA  37           HA       ALA  37  21.373   7.999  11.160
    3    HB3  ALA  37           HB1      ALA  37  21.604  10.962  11.454
    4    HB1  ALA  37           HB2      ALA  37  20.293   9.884  11.934
    5    HB2  ALA  37           HB3      ALA  37  20.472  10.358  10.243

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LYS  38           H        LYS  38  23.465  10.460   9.671
    2    HA   LYS  38           HA       LYS  38  22.808  10.036   6.997
    3    HB2  LYS  38           HB2      LYS  38  24.629  11.590   8.432
    4    HB3  LYS  38           HB3      LYS  38  25.654  10.600   7.399
    5    HG2  LYS  38           HG2      LYS  38  24.478  11.374   5.411
    6    HG3  LYS  38           HG3      LYS  38  23.290  12.229   6.401
    7    HD2  LYS  38           HD2      LYS  38  24.891  13.825   7.144
    8    HD3  LYS  38           HD3      LYS  38  26.247  12.839   6.599
    9    HE2  LYS  38           HE2      LYS  38  25.882  14.712   5.052
   10    HE3  LYS  38           HE3      LYS  38  25.541  13.175   4.248
   11    HZ3  LYS  38           HZ1      LYS  38  23.344  13.621   4.132
   12    HZ2  LYS  38           HZ2      LYS  38  23.867  15.236   4.218
   13    HZ1  LYS  38           HZ3      LYS  38  23.302  14.451   5.613

  No H/Q in entry =          13
  In of MODEL   51
    1    H    ALA  39           H        ALA  39  25.334   8.434   8.936
    2    HA   ALA  39           HA       ALA  39  26.389   6.847   6.858
    3    HB2  ALA  39           HB1      ALA  39  26.318   5.881   9.701
    4    HB1  ALA  39           HB2      ALA  39  27.269   7.307   9.280
    5    HB3  ALA  39           HB3      ALA  39  27.615   5.757   8.513

  No H/Q in entry =           5
  In of MODEL   51
    1    H    MET  40           H        MET  40  23.791   6.230   9.172
    2    HA   MET  40           HA       MET  40  23.342   3.526   8.437
    3    HB2  MET  40           HB2      MET  40  21.534   5.569   9.743
    4    HB3  MET  40           HB3      MET  40  21.126   3.860   9.569
    5    HG2  MET  40           HG2      MET  40  23.685   4.799  10.895
    6    HG3  MET  40           HG3      MET  40  22.196   4.523  11.797
    7    HE3  MET  40           HE1      MET  40  21.633   0.889  11.973
    8    HE2  MET  40           HE2      MET  40  20.759   2.193  11.172
    9    HE1  MET  40           HE3      MET  40  21.510   2.479  12.741

  No H/Q in entry =           9
  In of MODEL   51
    1    H    MET  41           H        MET  41  21.921   6.581   7.262
    2    HA   MET  41           HA       MET  41  19.954   5.387   5.601
    3    HB2  MET  41           HB2      MET  41  21.431   7.978   5.081
    4    HB3  MET  41           HB3      MET  41  19.899   7.485   4.372
    5    HG2  MET  41           HG2      MET  41  19.169   7.294   6.928
    6    HG3  MET  41           HG3      MET  41  20.479   8.451   7.143
    7    HE2  MET  41           HE1      MET  41  19.895   9.743   3.811
    8    HE1  MET  41           HE2      MET  41  20.861  10.181   5.217
    9    HE3  MET  41           HE3      MET  41  19.584  11.261   4.662

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ASP  42           H        ASP  42  23.322   6.311   5.028
    2    HA   ASP  42           HA       ASP  42  23.397   5.840   2.269
    3    HB2  ASP  42           HB2      ASP  42  25.159   6.836   4.028
    4    HB3  ASP  42           HB3      ASP  42  25.816   5.211   3.895

  No H/Q in entry =           4
  In of MODEL   51
    1    H    GLN  43           H        GLN  43  24.139   3.683   4.983
    2    HA   GLN  43           HA       GLN  43  24.794   1.427   3.394
    3    HB2  GLN  43           HB2      GLN  43  23.789   1.607   6.244
    4    HB3  GLN  43           HB3      GLN  43  24.364   0.119   5.484
    5    HG2  GLN  43           HG2      GLN  43  26.523   1.331   4.960
    6    HG3  GLN  43           HG3      GLN  43  25.946   2.657   5.965
    7   HE21  GLN  43          HE21      GLN  43  28.187   1.683   6.986
    8   HE22  GLN  43          HE22      GLN  43  27.921   0.599   8.263

  No H/Q in entry =           8
  In of MODEL   51
    1    H    SER  44           H        SER  44  21.746   2.558   4.799
    2    HA   SER  44           HA       SER  44  20.174   0.315   4.134
    3    HB2  SER  44           HB2      SER  44  19.739   2.843   5.285
    4    HB3  SER  44           HB3      SER  44  18.696   2.801   3.867
    5    HG   SER  44           HG       SER  44  17.613   1.856   5.596

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ARG  45           H        ARG  45  20.904   3.282   2.328
    2    HA   ARG  45           HA       ARG  45  19.365   2.798   0.033
    3    HB2  ARG  45           HB2      ARG  45  20.512   4.934   0.612
    4    HB3  ARG  45           HB3      ARG  45  22.054   4.180   0.215
    5    HG2  ARG  45           HG2      ARG  45  21.256   3.777  -2.094
    6    HG3  ARG  45           HG3      ARG  45  19.726   4.554  -1.697
    7    HD2  ARG  45           HD2      ARG  45  20.980   6.650  -1.119
    8    HD3  ARG  45           HD3      ARG  45  22.472   5.877  -1.698
    9    HE   ARG  45           HE       ARG  45  20.529   5.641  -3.721
   10   HH21  ARG  45          HH11      ARG  45  20.510   7.012  -5.483
   11   HH22  ARG  45          HH12      ARG  45  21.268   8.562  -5.382
   12   HH11  ARG  45          HH21      ARG  45  22.270   8.138  -2.103
   13   HH12  ARG  45          HH22      ARG  45  22.263   9.199  -3.466

  No H/Q in entry =          13
  In of MODEL   51
    1    H    MET  46           H        MET  46  22.734   1.922   0.757
    2    HA   MET  46           HA       MET  46  23.323   0.732  -1.732
    3    HB2  MET  46           HB2      MET  46  24.448   0.404   1.049
    4    HB3  MET  46           HB3      MET  46  25.094  -0.490  -0.330
    5    HG2  MET  46           HG2      MET  46  25.536   1.612  -1.517
    6    HG3  MET  46           HG3      MET  46  24.834   2.530  -0.192
    7    HE3  MET  46           HE1      MET  46  27.709  -0.632   0.204
    8    HE2  MET  46           HE2      MET  46  28.747   0.462  -0.706
    9    HE1  MET  46           HE3      MET  46  27.169   0.013  -1.353

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ALA  47           H        ALA  47  21.959  -0.603   1.252
    2    HA   ALA  47           HA       ALA  47  21.898  -3.315   0.447
    3    HB2  ALA  47           HB1      ALA  47  21.536  -2.857   2.754
    4    HB3  ALA  47           HB2      ALA  47  19.994  -3.458   2.146
    5    HB1  ALA  47           HB3      ALA  47  20.227  -1.727   2.404

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LEU  48           H        LEU  48  19.545  -0.686   0.109
    2    HA   LEU  48           HA       LEU  48  17.490  -2.217  -1.129
    3    HB2  LEU  48           HB2      LEU  48  18.147   0.737  -1.246
    4    HB3  LEU  48           HB3      LEU  48  16.670   0.028  -1.903
    5    HG   LEU  48           HG       LEU  48  17.544  -0.277   0.980
    6   HD13  LEU  48          HD11      LEU  48  17.127   2.025   0.797
    7   HD12  LEU  48          HD12      LEU  48  15.572   1.378   1.318
    8   HD11  LEU  48          HD13      LEU  48  15.831   1.801  -0.375
    9   HD22  LEU  48          HD21      LEU  48  16.011  -1.989   0.609
   10   HD21  LEU  48          HD22      LEU  48  15.129  -1.085  -0.623
   11   HD23  LEU  48          HD23      LEU  48  14.929  -0.681   1.083

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ASN  49           H        ASN  49  20.171  -0.291  -2.378
    2    HA   ASN  49           HA       ASN  49  19.500  -0.372  -5.097
    3    HB2  ASN  49           HB2      ASN  49  21.190   1.139  -4.174
    4    HB3  ASN  49           HB3      ASN  49  22.224  -0.227  -3.770
    5   HD21  ASN  49          HD21      ASN  49  23.958   0.312  -5.178
    6   HD22  ASN  49          HD22      ASN  49  23.803   0.335  -6.867

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLU  50           H        GLU  50  21.496  -2.570  -3.150
    2    HA   GLU  50           HA       GLU  50  22.180  -4.326  -5.283
    3    HB2  GLU  50           HB2      GLU  50  23.394  -4.303  -3.125
    4    HB3  GLU  50           HB3      GLU  50  21.956  -4.930  -2.319
    5    HG2  GLU  50           HG2      GLU  50  22.033  -6.962  -3.679
    6    HG3  GLU  50           HG3      GLU  50  23.403  -6.331  -4.590

  No H/Q in entry =           6
  In of MODEL   51
    1    H    ALA  51           H        ALA  51  19.541  -4.258  -2.936
    2    HA   ALA  51           HA       ALA  51  18.366  -6.729  -3.686
    3    HB3  ALA  51           HB1      ALA  51  16.786  -6.222  -2.118
    4    HB1  ALA  51           HB2      ALA  51  16.571  -4.575  -2.714
    5    HB2  ALA  51           HB3      ALA  51  17.937  -4.963  -1.669

  No H/Q in entry =           5
  In of MODEL   51
    1    H    HIS  52           H        HIS  52  17.777  -3.380  -4.715
    2    HA   HIS  52           HA       HIS  52  15.649  -3.903  -6.499
    3    HB2  HIS  52           HB2      HIS  52  16.281  -1.639  -5.715
    4    HB3  HIS  52           HB3      HIS  52  17.756  -1.735  -6.676
    5    HD1  HIS  52           HD1      HIS  52  17.409  -1.958  -9.327
    6    HD2  HIS  52           HD2      HIS  52  14.008  -0.902  -7.160
    7    HE1  HIS  52           HE1      HIS  52  15.739  -1.058 -11.007
    8    HE2  HIS  52           HE2      HIS  52  13.661  -0.410  -9.700

  No H/Q in entry =           8
  In of MODEL   51
    1    H    LEU  53           H        LEU  53  19.164  -3.913  -6.958
    2    HA   LEU  53           HA       LEU  53  19.199  -4.228  -9.759
    3    HB2  LEU  53           HB2      LEU  53  21.147  -4.986  -7.598
    4    HB3  LEU  53           HB3      LEU  53  21.450  -5.384  -9.287
    5    HG   LEU  53           HG       LEU  53  20.800  -2.567  -8.360
    6   HD11  LEU  53          HD11      LEU  53  23.454  -3.987  -8.648
    7   HD13  LEU  53          HD12      LEU  53  22.842  -3.100  -7.253
    8   HD12  LEU  53          HD13      LEU  53  23.314  -2.233  -8.710
    9   HD22  LEU  53          HD21      LEU  53  20.498  -2.626 -10.696
   10   HD21  LEU  53          HD22      LEU  53  21.766  -3.827 -10.923
   11   HD23  LEU  53          HD23      LEU  53  22.191  -2.162 -10.575

  No H/Q in entry =          11
  In of MODEL   51
    1    H    VAL  54           H        VAL  54  19.104  -6.615  -7.133
    2    HA   VAL  54           HA       VAL  54  19.212  -8.909  -8.794
    3    HB   VAL  54           HB       VAL  54  18.080  -8.485  -6.018
    4   HG12  VAL  54          HG11      VAL  54  18.402 -11.103  -6.016
    5   HG11  VAL  54          HG12      VAL  54  18.203 -10.934  -7.761
    6   HG13  VAL  54          HG13      VAL  54  16.924 -10.402  -6.672
    7   HG22  VAL  54          HG21      VAL  54  20.397  -8.276  -5.813
    8   HG21  VAL  54          HG22      VAL  54  20.723  -9.368  -7.157
    9   HG23  VAL  54          HG23      VAL  54  20.205 -10.015  -5.600

  No H/Q in entry =           9
  In of MODEL   51
    1    H    GLN  55           H        GLN  55  16.496  -7.004  -7.490
    2    HA   GLN  55           HA       GLN  55  14.465  -8.667  -8.548
    3    HB2  GLN  55           HB2      GLN  55  13.731  -7.141  -6.916
    4    HB3  GLN  55           HB3      GLN  55  14.518  -5.773  -7.698
    5    HG2  GLN  55           HG2      GLN  55  12.783  -5.447  -9.174
    6    HG3  GLN  55           HG3      GLN  55  12.459  -7.168  -9.342
    7   HE21  GLN  55          HE21      GLN  55  10.458  -7.716  -8.521
    8   HE22  GLN  55          HE22      GLN  55   9.695  -6.961  -7.207

  No H/Q in entry =           8
  In of MODEL   51
    1    H    THR  56           H        THR  56  16.196  -5.868  -9.921
    2    HA   THR  56           HA       THR  56  14.740  -5.505 -12.258
    3    HB   THR  56           HB       THR  56  17.760  -5.419 -12.125
    4    HG1  THR  56           HG1      THR  56  15.791  -3.596 -11.231
    5   HG23  THR  56          HG21      THR  56  17.649  -4.031 -13.976
    6   HG22  THR  56          HG22      THR  56  16.014  -3.489 -13.600
    7   HG21  THR  56          HG23      THR  56  16.275  -5.091 -14.293

  No H/Q in entry =           7
  In of MODEL   51
    1    H    LYS  57           H        LYS  57  17.393  -7.803 -11.667
    2    HA   LYS  57           HA       LYS  57  17.374  -8.997 -14.246
    3    HB2  LYS  57           HB2      LYS  57  19.176  -9.249 -12.508
    4    HB3  LYS  57           HB3      LYS  57  18.078 -10.251 -11.571
    5    HG2  LYS  57           HG2      LYS  57  17.975 -11.892 -13.377
    6    HG3  LYS  57           HG3      LYS  57  18.995 -10.879 -14.393
    7    HD2  LYS  57           HD2      LYS  57  20.836 -11.093 -12.755
    8    HD3  LYS  57           HD3      LYS  57  19.822 -12.128 -11.751
    9    HE2  LYS  57           HE2      LYS  57  19.655 -13.766 -13.597
   10    HE3  LYS  57           HE3      LYS  57  20.669 -12.742 -14.612
   11    HZ1  LYS  57           HZ1      LYS  57  21.603 -13.630 -11.963
   12    HZ3  LYS  57           HZ2      LYS  57  22.513 -13.123 -13.303
   13    HZ2  LYS  57           HZ3      LYS  57  21.754 -14.642 -13.315

  No H/Q in entry =          13
  In of MODEL   51
    1    H    LEU  58           H        LEU  58  15.616  -9.665 -11.256
    2    HA   LEU  58           HA       LEU  58  14.387 -12.038 -12.181
    3    HB2  LEU  58           HB2      LEU  58  13.610 -10.133  -9.979
    4    HB3  LEU  58           HB3      LEU  58  12.801 -11.671 -10.289
    5    HG   LEU  58           HG       LEU  58  15.778 -11.392  -9.758
    6   HD11  LEU  58          HD11      LEU  58  13.421 -11.810  -7.947
    7   HD13  LEU  58          HD12      LEU  58  14.876 -10.846  -7.696
    8   HD12  LEU  58          HD13      LEU  58  14.950 -12.602  -7.561
    9   HD22  LEU  58          HD21      LEU  58  15.652 -13.454 -10.784
   10   HD21  LEU  58          HD22      LEU  58  13.942 -13.664 -10.410
   11   HD23  LEU  58          HD23      LEU  58  15.160 -13.964  -9.171

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  59           H        ILE  59  13.710  -8.701 -12.859
    2    HA   ILE  59           HA       ILE  59  10.987  -9.351 -13.777
    3    HB   ILE  59           HB       ILE  59  11.797  -7.070 -12.577
    4   HG12  ILE  59          HG12      ILE  59   9.880  -6.954 -14.917
    5   HG13  ILE  59          HG13      ILE  59   9.468  -7.709 -13.399
    6   HG21  ILE  59          HG21      ILE  59  13.331  -6.670 -14.643
    7   HG23  ILE  59          HG22      ILE  59  12.360  -5.331 -14.077
    8   HG22  ILE  59          HG23      ILE  59  11.856  -6.262 -15.485
    9   HD11  ILE  59          HD11      ILE  59  10.400  -4.853 -13.684
   10   HD13  ILE  59          HD12      ILE  59   9.867  -5.623 -12.191
   11   HD12  ILE  59          HD13      ILE  59   8.715  -5.341 -13.497

  No H/Q in entry =          11
  In of MODEL   51
    1    H    GLU  60           H        GLU  60  14.181  -8.498 -15.061
    2    HA   GLU  60           HA       GLU  60  13.380  -8.099 -17.763
    3    HB2  GLU  60           HB2      GLU  60  15.549  -7.333 -17.046
    4    HB3  GLU  60           HB3      GLU  60  16.014  -8.954 -16.542
    5    HG2  GLU  60           HG2      GLU  60  15.173  -8.591 -19.384
    6    HG3  GLU  60           HG3      GLU  60  16.750  -7.959 -18.916

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLY  61           H        GLY  61  14.372 -10.980 -15.955
    2    HA3  GLY  61           HA2      GLY  61  13.812 -12.628 -18.352
    3    HA2  GLY  61           HA3      GLY  61  14.855 -13.109 -17.018

  No H/Q in entry =           3
  In of MODEL   51
    1    H    ASP  62           H        ASP  62  11.738 -11.563 -16.622
    2    HA   ASP  62           HA       ASP  62  10.828 -13.619 -14.858
    3    HB2  ASP  62           HB2      ASP  62   8.753 -12.261 -14.792
    4    HB3  ASP  62           HB3      ASP  62  10.203 -11.314 -14.472

  No H/Q in entry =           4
  In of MODEL   51
    1    H    ALA  63           H        ALA  63  11.356 -14.815 -17.393
    2    HA   ALA  63           HA       ALA  63   9.036 -15.140 -19.011
    3    HB1  ALA  63           HB1      ALA  63  10.230 -17.371 -19.596
    4    HB3  ALA  63           HB2      ALA  63  11.528 -16.771 -18.567
    5    HB2  ALA  63           HB3      ALA  63  11.045 -15.859 -19.997

  No H/Q in entry =           5
  In of MODEL   51
    1    H    GLY  64           H        GLY  64  10.255 -16.831 -16.172
    2    HA3  GLY  64           HA2      GLY  64   9.309 -18.349 -14.739
    3    HA2  GLY  64           HA3      GLY  64   7.764 -17.648 -15.200

  No H/Q in entry =           3
  In of MODEL   51
    1    H    GLU  65           H        GLU  65   6.468 -19.394 -15.530
    2    HA   GLU  65           HA       GLU  65   7.392 -21.859 -16.566
    3    HB2  GLU  65           HB2      GLU  65   4.590 -20.762 -16.339
    4    HB3  GLU  65           HB3      GLU  65   4.982 -22.429 -16.756
    5    HG2  GLU  65           HG2      GLU  65   5.885 -21.039 -14.221
    6    HG3  GLU  65           HG3      GLU  65   4.504 -22.129 -14.322

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLY  66           H        GLY  66   5.689 -22.747 -18.359
    2    HA3  GLY  66           HA2      GLY  66   6.729 -21.963 -20.846
    3    HA2  GLY  66           HA3      GLY  66   5.362 -23.028 -20.592

  No H/Q in entry =           3
  In of MODEL   51
    1    H    LYS  67           H        LYS  67   3.728 -21.113 -19.241
    2    HA   LYS  67           HA       LYS  67   2.543 -19.864 -21.517
    3    HB2  LYS  67           HB2      LYS  67   1.832 -19.855 -18.586
    4    HB3  LYS  67           HB3      LYS  67   0.840 -19.108 -19.846
    5    HG2  LYS  67           HG2      LYS  67   0.706 -21.261 -21.033
    6    HG3  LYS  67           HG3      LYS  67   1.711 -22.015 -19.799
    7    HD2  LYS  67           HD2      LYS  67  -0.006 -21.524 -18.097
    8    HD3  LYS  67           HD3      LYS  67  -1.016 -20.774 -19.335
    9    HE2  LYS  67           HE2      LYS  67  -1.096 -22.904 -20.573
   10    HE3  LYS  67           HE3      LYS  67  -0.081 -23.659 -19.344
   11    HZ1  LYS  67           HZ1      LYS  67  -2.260 -22.381 -18.104
   12    HZ3  LYS  67           HZ2      LYS  67  -1.857 -24.031 -18.110
   13    HZ2  LYS  67           HZ3      LYS  67  -2.846 -23.390 -19.336

  No H/Q in entry =          13
  In of MODEL   51
    1    H    MET  68           H        MET  68   1.995 -17.742 -21.840
    2    HA   MET  68           HA       MET  68   3.954 -15.840 -21.799
    3    HB2  MET  68           HB2      MET  68   0.961 -15.449 -21.796
    4    HB3  MET  68           HB3      MET  68   2.133 -14.197 -22.208
    5    HG2  MET  68           HG2      MET  68   1.896 -16.874 -23.611
    6    HG3  MET  68           HG3      MET  68   1.254 -15.350 -24.227
    7    HE2  MET  68           HE1      MET  68   3.813 -13.165 -23.479
    8    HE1  MET  68           HE2      MET  68   2.382 -13.374 -24.486
    9    HE3  MET  68           HE3      MET  68   3.965 -13.210 -25.242

  No H/Q in entry =           9
  In of MODEL   51
    1    H    LYS  69           H        LYS  69   2.436 -16.886 -18.985
    2    HA   LYS  69           HA       LYS  69   2.189 -14.399 -17.614
    3    HB2  LYS  69           HB2      LYS  69   2.067 -17.274 -16.788
    4    HB3  LYS  69           HB3      LYS  69   2.093 -16.000 -15.567
    5    HG2  LYS  69           HG2      LYS  69  -0.221 -16.746 -16.422
    6    HG3  LYS  69           HG3      LYS  69   0.101 -15.013 -16.387
    7    HD2  LYS  69           HD2      LYS  69   0.509 -14.943 -18.738
    8    HD3  LYS  69           HD3      LYS  69   0.578 -16.703 -18.848
    9    HE2  LYS  69           HE2      LYS  69  -1.730 -16.945 -18.629
   10    HE3  LYS  69           HE3      LYS  69  -1.913 -15.402 -17.796
   11    HZ2  LYS  69           HZ1      LYS  69  -2.325 -15.874 -20.463
   12    HZ1  LYS  69           HZ2      LYS  69  -0.835 -15.061 -20.408
   13    HZ3  LYS  69           HZ3      LYS  69  -2.215 -14.357 -19.715

  No H/Q in entry =          13
  In of MODEL   51
    1    H    VAL  70           H        VAL  70   3.241 -14.443 -15.188
    2    HA   VAL  70           HA       VAL  70   6.176 -14.704 -15.498
    3    HB   VAL  70           HB       VAL  70   6.405 -12.571 -14.252
    4   HG11  VAL  70          HG11      VAL  70   6.346 -12.712 -16.787
    5   HG13  VAL  70          HG12      VAL  70   5.922 -11.135 -16.121
    6   HG12  VAL  70          HG13      VAL  70   4.656 -12.216 -16.698
    7   HG22  VAL  70          HG21      VAL  70   4.300 -12.521 -13.032
    8   HG21  VAL  70          HG22      VAL  70   3.383 -12.534 -14.539
    9   HG23  VAL  70          HG23      VAL  70   4.329 -11.114 -14.096

  No H/Q in entry =           9
  In of MODEL   51
    1    H    SER  71           H        SER  71   7.291 -14.630 -13.357
    2    HA   SER  71           HA       SER  71   6.305 -16.579 -11.567
    3    HB2  SER  71           HB2      SER  71   8.718 -15.935 -11.846
    4    HB3  SER  71           HB3      SER  71   8.369 -14.444 -10.974
    5    HG   SER  71           HG       SER  71   8.626 -17.029 -10.066

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LEU  72           H        LEU  72   4.907 -16.439  -9.947
    2    HA   LEU  72           HA       LEU  72   3.360 -14.126  -9.490
    3    HB2  LEU  72           HB2      LEU  72   3.660 -16.681  -7.920
    4    HB3  LEU  72           HB3      LEU  72   2.492 -15.425  -7.518
    5    HG   LEU  72           HG       LEU  72   2.641 -16.741 -10.249
    6   HD11  LEU  72          HD11      LEU  72   2.070 -18.278  -8.261
    7   HD13  LEU  72          HD12      LEU  72   0.908 -18.222  -9.585
    8   HD12  LEU  72          HD13      LEU  72   0.598 -17.319  -8.102
    9   HD22  LEU  72          HD21      LEU  72   1.427 -14.760 -10.540
   10   HD21  LEU  72          HD22      LEU  72   0.773 -14.787  -8.911
   11   HD23  LEU  72          HD23      LEU  72   0.145 -15.892 -10.129

  No H/Q in entry =          11
  In of MODEL   51
    1    H    VAL  73           H        VAL  73   6.030 -15.563  -7.737
    2    HA   VAL  73           HA       VAL  73   5.985 -14.031  -5.404
    3    HB   VAL  73           HB       VAL  73   8.177 -14.836  -4.995
    4   HG12  VAL  73          HG11      VAL  73   6.906 -16.907  -6.799
    5   HG11  VAL  73          HG12      VAL  73   6.289 -16.527  -5.192
    6   HG13  VAL  73          HG13      VAL  73   7.913 -17.186  -5.381
    7   HG21  VAL  73          HG21      VAL  73   8.318 -14.917  -7.993
    8   HG23  VAL  73          HG22      VAL  73   9.327 -16.020  -7.058
    9   HG22  VAL  73          HG23      VAL  73   9.489 -14.277  -6.838

  No H/Q in entry =           9
  In of MODEL   51
    1    H    LEU  74           H        LEU  74   6.953 -13.135  -8.586
    2    HA   LEU  74           HA       LEU  74   8.901 -11.187  -8.106
    3    HB2  LEU  74           HB2      LEU  74   8.428 -11.937 -10.341
    4    HB3  LEU  74           HB3      LEU  74   6.765 -11.364 -10.229
    5    HG   LEU  74           HG       LEU  74   7.581  -9.040 -10.016
    6   HD12  LEU  74          HD11      LEU  74  10.078  -8.758 -10.641
    7   HD11  LEU  74          HD12      LEU  74  10.253 -10.441 -10.147
    8   HD13  LEU  74          HD13      LEU  74   9.707  -9.233  -8.984
    9   HD23  LEU  74          HD21      LEU  74   9.024 -10.150 -12.368
   10   HD22  LEU  74          HD22      LEU  74   7.901  -8.814 -12.258
   11   HD21  LEU  74          HD23      LEU  74   7.293 -10.453 -12.235

  No H/Q in entry =          11
  In of MODEL   51
    1    H    VAL  75           H        VAL  75   5.403 -10.802  -8.436
    2    HA   VAL  75           HA       VAL  75   5.311  -8.046  -7.847
    3    HB   VAL  75           HB       VAL  75   3.223 -10.188  -7.443
    4   HG12  VAL  75          HG11      VAL  75   1.645  -8.223  -7.347
    5   HG11  VAL  75          HG12      VAL  75   3.042  -7.158  -7.297
    6   HG13  VAL  75          HG13      VAL  75   2.748  -8.278  -5.976
    7   HG23  VAL  75          HG21      VAL  75   3.635  -8.068  -9.579
    8   HG22  VAL  75          HG22      VAL  75   2.318  -9.237  -9.533
    9   HG21  VAL  75          HG23      VAL  75   3.977  -9.785  -9.780

  No H/Q in entry =           9
  In of MODEL   51
    1    H    GLU  76           H        GLU  76   5.071 -10.924  -5.737
    2    HA   GLU  76           HA       GLU  76   4.617  -9.564  -3.312
    3    HB2  GLU  76           HB2      GLU  76   4.443 -12.033  -3.553
    4    HB3  GLU  76           HB3      GLU  76   6.180 -12.128  -3.790
    5    HG2  GLU  76           HG2      GLU  76   5.741 -12.710  -1.494
    6    HG3  GLU  76           HG3      GLU  76   6.476 -11.117  -1.481

  No H/Q in entry =           6
  In of MODEL   51
    1    H    ALA  77           H        ALA  77   7.666 -10.471  -4.895
    2    HA   ALA  77           HA       ALA  77   9.368  -9.428  -2.889
    3    HB2  ALA  77           HB1      ALA  77  11.113  -9.471  -4.637
    4    HB3  ALA  77           HB2      ALA  77   9.870  -9.757  -5.857
    5    HB1  ALA  77           HB3      ALA  77  10.179 -10.968  -4.611

  No H/Q in entry =           5
  In of MODEL   51
    1    H    GLN  78           H        GLN  78   7.959  -8.009  -5.794
    2    HA   GLN  78           HA       GLN  78   9.313  -5.531  -5.696
    3    HB2  GLN  78           HB2      GLN  78   8.004  -6.444  -7.646
    4    HB3  GLN  78           HB3      GLN  78   6.526  -6.066  -6.762
    5    HG2  GLN  78           HG2      GLN  78   7.185  -3.695  -6.670
    6    HG3  GLN  78           HG3      GLN  78   8.663  -4.068  -7.556
    7   HE21  GLN  78          HE21      GLN  78   6.776  -2.238  -8.652
    8   HE22  GLN  78          HE22      GLN  78   6.055  -2.951 -10.014

  No H/Q in entry =           8
  In of MODEL   51
    1    H    LEU  79           H        LEU  79   6.301  -6.668  -4.249
    2    HA   LEU  79           HA       LEU  79   5.315  -4.260  -3.233
    3    HB2  LEU  79           HB2      LEU  79   3.999  -6.311  -3.170
    4    HB3  LEU  79           HB3      LEU  79   5.150  -7.052  -2.062
    5    HG   LEU  79           HG       LEU  79   4.609  -5.410  -0.331
    6   HD13  LEU  79          HD11      LEU  79   4.138  -3.395  -1.378
    7   HD12  LEU  79          HD12      LEU  79   2.515  -3.919  -0.930
    8   HD11  LEU  79          HD13      LEU  79   3.086  -4.141  -2.582
    9   HD23  LEU  79          HD21      LEU  79   2.022  -5.901  -0.227
   10   HD22  LEU  79          HD22      LEU  79   3.161  -7.241  -0.125
   11   HD21  LEU  79          HD23      LEU  79   2.340  -6.902  -1.645

  No H/Q in entry =          11
  In of MODEL   51
    1    H    HIS  80           H        HIS  80   7.504  -6.598  -1.663
    2    HA   HIS  80           HA       HIS  80   7.807  -5.057   0.705
    3    HB2  HIS  80           HB2      HIS  80   9.136  -7.422  -0.502
    4    HB3  HIS  80           HB3      HIS  80  10.054  -6.526   0.710
    5    HD1  HIS  80           HD1      HIS  80   9.576  -7.163   3.055
    6    HD2  HIS  80           HD2      HIS  80   6.345  -8.009   0.560
    7    HE1  HIS  80           HE1      HIS  80   7.811  -8.265   4.513
    8    HE2  HIS  80           HE2      HIS  80   5.835  -8.785   3.000

  No H/Q in entry =           8
  In of MODEL   51
    1    H    LEU  81           H        LEU  81   9.796  -5.334  -2.218
    2    HA   LEU  81           HA       LEU  81  11.847  -3.595  -1.350
    3    HB2  LEU  81           HB2      LEU  81  10.910  -4.386  -4.108
    4    HB3  LEU  81           HB3      LEU  81  12.333  -3.381  -3.825
    5    HG   LEU  81           HG       LEU  81  11.944  -6.103  -2.551
    6   HD12  LEU  81          HD11      LEU  81  13.750  -6.730  -4.310
    7   HD11  LEU  81          HD12      LEU  81  13.181  -5.305  -5.178
    8   HD13  LEU  81          HD13      LEU  81  12.070  -6.628  -4.835
    9   HD23  LEU  81          HD21      LEU  81  14.573  -5.791  -2.550
   10   HD22  LEU  81          HD22      LEU  81  13.598  -5.030  -1.294
   11   HD21  LEU  81          HD23      LEU  81  14.171  -4.078  -2.664

  No H/Q in entry =          11
  In of MODEL   51
    1    H    MET  82           H        MET  82   8.915  -2.954  -3.271
    2    HA   MET  82           HA       MET  82   9.456  -0.229  -3.773
    3    HB2  MET  82           HB2      MET  82   6.895  -1.819  -3.636
    4    HB3  MET  82           HB3      MET  82   6.896  -0.094  -3.999
    5    HG2  MET  82           HG2      MET  82   8.485  -2.169  -5.544
    6    HG3  MET  82           HG3      MET  82   6.916  -1.544  -6.048
    7    HE3  MET  82           HE1      MET  82   7.364   1.911  -7.221
    8    HE2  MET  82           HE2      MET  82   6.998   1.684  -5.512
    9    HE1  MET  82           HE3      MET  82   6.325   0.576  -6.704

  No H/Q in entry =           9
  In of MODEL   51
    1    H    THR  83           H        THR  83   7.675  -1.825  -1.160
    2    HA   THR  83           HA       THR  83   6.835   0.524   0.172
    3    HB   THR  83           HB       THR  83   6.708  -1.051   2.190
    4    HG1  THR  83           HG1      THR  83   7.460  -3.003   1.955
    5   HG22  THR  83          HG21      THR  83   5.045  -2.613   0.729
    6   HG21  THR  83          HG22      THR  83   5.268  -1.285  -0.403
    7   HG23  THR  83          HG23      THR  83   4.636  -0.969   1.213

  No H/Q in entry =           7
  In of MODEL   51
    1    H    SER  84           H        SER  84   9.657  -1.580   0.677
    2    HA   SER  84           HA       SER  84  10.731  -0.153   2.861
    3    HB2  SER  84           HB2      SER  84  11.970  -1.997   0.829
    4    HB3  SER  84           HB3      SER  84  12.925  -1.246   2.106
    5    HG   SER  84           HG       SER  84  10.648  -2.931   2.376

  No H/Q in entry =           5
  In of MODEL   51
    1    H    MET  85           H        MET  85  11.467   0.109  -0.631
    2    HA   MET  85           HA       MET  85  13.471   2.069  -0.389
    3    HB2  MET  85           HB2      MET  85  13.060   0.789  -2.453
    4    HB3  MET  85           HB3      MET  85  11.535   1.646  -2.674
    5    HG2  MET  85           HG2      MET  85  12.748   3.791  -2.793
    6    HG3  MET  85           HG3      MET  85  14.273   2.944  -2.555
    7    HE2  MET  85           HE1      MET  85  15.095   0.952  -4.211
    8    HE1  MET  85           HE2      MET  85  15.746   2.582  -4.348
    9    HE3  MET  85           HE3      MET  85  15.348   1.680  -5.805

  No H/Q in entry =           9
  In of MODEL   51
    1    H    LEU  86           H        LEU  86   9.979   2.412  -0.880
    2    HA   LEU  86           HA       LEU  86   9.921   5.226  -1.060
    3    HB2  LEU  86           HB2      LEU  86   8.070   3.571  -1.627
    4    HB3  LEU  86           HB3      LEU  86   7.749   3.481   0.104
    5    HG   LEU  86           HG       LEU  86   7.594   6.042   0.054
    6   HD11  LEU  86          HD11      LEU  86   8.355   5.606  -2.652
    7   HD13  LEU  86          HD12      LEU  86   7.927   7.134  -1.889
    8   HD12  LEU  86          HD13      LEU  86   6.684   6.175  -2.688
    9   HD23  LEU  86          HD21      LEU  86   5.449   4.696  -1.599
   10   HD22  LEU  86          HD22      LEU  86   5.268   5.956  -0.381
   11   HD21  LEU  86          HD23      LEU  86   5.665   4.310   0.109

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ALA  87           H        ALA  87   9.464   3.047   1.687
    2    HA   ALA  87           HA       ALA  87   8.930   4.961   3.660
    3    HB1  ALA  87           HB1      ALA  87   9.729   2.139   3.569
    4    HB3  ALA  87           HB2      ALA  87   8.612   2.954   4.660
    5    HB2  ALA  87           HB3      ALA  87  10.343   2.980   4.995

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ARG  88           H        ARG  88  12.005   3.529   2.663
    2    HA   ARG  88           HA       ARG  88  13.627   4.902   4.488
    3    HB2  ARG  88           HB2      ARG  88  14.283   2.927   3.080
    4    HB3  ARG  88           HB3      ARG  88  14.431   4.020   1.707
    5    HG2  ARG  88           HG2      ARG  88  15.919   5.329   3.646
    6    HG3  ARG  88           HG3      ARG  88  16.236   3.639   4.023
    7    HD2  ARG  88           HD2      ARG  88  17.493   3.340   2.169
    8    HD3  ARG  88           HD3      ARG  88  16.353   4.215   1.142
    9    HE   ARG  88           HE       ARG  88  18.756   5.271   2.178
   10   HH21  ARG  88          HH11      ARG  88  19.106   7.489   1.982
   11   HH22  ARG  88          HH12      ARG  88  17.758   8.565   1.847
   12   HH11  ARG  88          HH21      ARG  88  15.417   6.034   1.917
   13   HH12  ARG  88          HH22      ARG  88  15.667   7.738   1.785

  No H/Q in entry =          13
  In of MODEL   51
    1    H    GLU  89           H        GLU  89  12.639   5.804   1.170
    2    HA   GLU  89           HA       GLU  89  14.192   8.160   1.007
    3    HB2  GLU  89           HB2      GLU  89  13.034   7.123  -0.936
    4    HB3  GLU  89           HB3      GLU  89  11.495   7.668  -0.269
    5    HG2  GLU  89           HG2      GLU  89  12.202  10.004  -0.434
    6    HG3  GLU  89           HG3      GLU  89  13.802   9.509  -0.980

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LEU  90           H        LEU  90  10.867   7.659   2.154
    2    HA   LEU  90           HA       LEU  90  10.363  10.393   2.733
    3    HB2  LEU  90           HB2      LEU  90   9.166   7.823   3.766
    4    HB3  LEU  90           HB3      LEU  90   8.542   9.419   4.193
    5    HG   LEU  90           HG       LEU  90   8.943   8.540   1.321
    6   HD12  LEU  90          HD11      LEU  90   6.408   8.218   1.397
    7   HD11  LEU  90          HD12      LEU  90   6.573   8.206   3.153
    8   HD13  LEU  90          HD13      LEU  90   7.382   6.975   2.183
    9   HD22  LEU  90          HD21      LEU  90   8.655  10.849   1.250
   10   HD21  LEU  90          HD22      LEU  90   7.676  10.883   2.716
   11   HD23  LEU  90          HD23      LEU  90   6.969  10.331   1.198

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  91           H        ILE  91  11.628   7.708   4.647
    2    HA   ILE  91           HA       ILE  91  11.786   9.071   7.115
    3    HB   ILE  91           HB       ILE  91  13.328   6.729   5.982
    4   HG12  ILE  91          HG12      ILE  91  11.324   6.900   8.253
    5   HG13  ILE  91          HG13      ILE  91  10.844   6.622   6.580
    6   HG22  ILE  91          HG21      ILE  91  13.811   6.512   8.620
    7   HG21  ILE  91          HG22      ILE  91  13.740   8.271   8.520
    8   HG23  ILE  91          HG23      ILE  91  14.910   7.381   7.549
    9   HD13  ILE  91          HD11      ILE  91  11.840   4.517   6.503
   10   HD12  ILE  91          HD12      ILE  91  11.256   4.576   8.166
   11   HD11  ILE  91          HD13      ILE  91  12.957   4.885   7.818

  No H/Q in entry =          11
  In of MODEL   51
    1    H    THR  92           H        THR  92  13.988   8.897   4.351
    2    HA   THR  92           HA       THR  92  16.163  10.284   5.500
    3    HB   THR  92           HB       THR  92  15.161  10.163   2.644
    4    HG1  THR  92           HG1      THR  92  15.989   8.263   3.044
    5   HG22  THR  92          HG21      THR  92  17.731  10.847   2.337
    6   HG21  THR  92          HG22      THR  92  17.433  11.668   3.869
    7   HG23  THR  92          HG23      THR  92  16.457  12.058   2.454

  No H/Q in entry =           7
  In of MODEL   51
    1    H    GLU  93           H        GLU  93  13.269  11.446   3.787
    2    HA   GLU  93           HA       GLU  93  13.872  14.205   3.900
    3    HB2  GLU  93           HB2      GLU  93  11.164  12.840   3.928
    4    HB3  GLU  93           HB3      GLU  93  11.455  14.539   3.556
    5    HG2  GLU  93           HG2      GLU  93  12.778  12.294   2.019
    6    HG3  GLU  93           HG3      GLU  93  11.231  12.981   1.541

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LEU  94           H        LEU  94  12.136  12.052   6.119
    2    HA   LEU  94           HA       LEU  94  11.342  14.000   8.001
    3    HB2  LEU  94           HB2      LEU  94  11.912  11.043   8.270
    4    HB3  LEU  94           HB3      LEU  94  11.350  12.019   9.624
    5    HG   LEU  94           HG       LEU  94   9.852  12.077   7.004
    6   HD11  LEU  94          HD11      LEU  94   9.940   9.854   9.007
    7   HD13  LEU  94          HD12      LEU  94   9.628   9.795   7.274
    8   HD12  LEU  94          HD13      LEU  94   8.357  10.314   8.379
    9   HD23  LEU  94          HD21      LEU  94   7.942  12.480   8.615
   10   HD22  LEU  94          HD22      LEU  94   9.185  13.731   8.646
   11   HD21  LEU  94          HD23      LEU  94   9.126  12.514   9.920

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  95           H        ILE  95  14.310  12.062   7.747
    2    HA   ILE  95           HA       ILE  95  15.493  12.980  10.154
    3    HB   ILE  95           HB       ILE  95  16.715  11.909   7.598
    4   HG12  ILE  95          HG12      ILE  95  16.432  10.708  10.367
    5   HG13  ILE  95          HG13      ILE  95  15.257  10.453   9.078
    6   HG21  ILE  95          HG21      ILE  95  17.988  12.711  10.234
    7   HG23  ILE  95          HG22      ILE  95  18.442  13.239   8.612
    8   HG22  ILE  95          HG23      ILE  95  18.747  11.578   9.118
    9   HD13  ILE  95          HD11      ILE  95  16.726   9.171   7.806
   10   HD12  ILE  95          HD12      ILE  95  17.207   8.720   9.439
   11   HD11  ILE  95          HD13      ILE  95  18.158   9.898   8.535

  No H/Q in entry =          11
  In of MODEL   51
    1    H    GLU  96           H        GLU  96  15.632  14.215   6.820
    2    HA   GLU  96           HA       GLU  96  17.487  16.288   7.287
    3    HB2  GLU  96           HB2      GLU  96  16.808  15.629   5.031
    4    HB3  GLU  96           HB3      GLU  96  15.168  16.190   5.341
    5    HG2  GLU  96           HG2      GLU  96  15.737  18.318   4.797
    6    HG3  GLU  96           HG3      GLU  96  17.042  18.315   5.972

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LEU  97           H        LEU  97  13.978  16.111   7.737
    2    HA   LEU  97           HA       LEU  97  13.573  18.845   8.383
    3    HB2  LEU  97           HB2      LEU  97  12.051  16.323   9.004
    4    HB3  LEU  97           HB3      LEU  97  11.546  17.871   9.679
    5    HG   LEU  97           HG       LEU  97  12.011  17.455   6.711
    6   HD12  LEU  97          HD11      LEU  97   9.486  17.335   6.608
    7   HD11  LEU  97          HD12      LEU  97   9.490  17.134   8.358
    8   HD13  LEU  97          HD13      LEU  97  10.261  15.925   7.331
    9   HD23  LEU  97          HD21      LEU  97  10.278  19.424   6.755
   10   HD22  LEU  97          HD22      LEU  97  11.963  19.779   7.138
   11   HD21  LEU  97          HD23      LEU  97  10.781  19.611   8.435

  No H/Q in entry =          11
  In of MODEL   51
    1    H    HIS  98           H        HIS  98  14.398  16.015  10.372
    2    HA   HIS  98           HA       HIS  98  14.259  17.275  12.889
    3    HB2  HIS  98           HB2      HIS  98  15.996  15.014  11.876
    4    HB3  HIS  98           HB3      HIS  98  16.006  15.551  13.557
    5    HD1  HIS  98           HD1      HIS  98  13.787  13.929  10.977
    6    HD2  HIS  98           HD2      HIS  98  13.707  14.847  15.043
    7    HE1  HIS  98           HE1      HIS  98  11.765  12.740  11.941
    8    HE2  HIS  98           HE2      HIS  98  11.696  13.290  14.413

  No H/Q in entry =           8
  In of MODEL   51
    1    H    GLU  99           H        GLU  99  16.797  17.154  10.439
    2    HA   GLU  99           HA       GLU  99  18.796  18.479  11.957
    3    HB2  GLU  99           HB2      GLU  99  19.259  17.192   9.885
    4    HB3  GLU  99           HB3      GLU  99  18.447  18.449   8.950
    5    HG2  GLU  99           HG2      GLU  99  20.065  20.115   9.732
    6    HG3  GLU  99           HG3      GLU  99  20.847  18.910  10.749

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LYS 100           H        LYS 100  16.262  19.651   9.757
    2    HA   LYS 100           HA       LYS 100  17.069  22.385   9.898
    3    HB2  LYS 100           HB2      LYS 100  14.428  21.105   9.158
    4    HB3  LYS 100           HB3      LYS 100  14.732  22.842   9.067
    5    HG2  LYS 100           HG2      LYS 100  16.694  22.389   7.588
    6    HG3  LYS 100           HG3      LYS 100  16.275  20.673   7.607
    7    HD2  LYS 100           HD2      LYS 100  14.076  21.190   6.621
    8    HD3  LYS 100           HD3      LYS 100  14.478  22.908   6.609
    9    HE2  LYS 100           HE2      LYS 100  16.426  22.422   5.137
   10    HE3  LYS 100           HE3      LYS 100  15.955  20.719   5.106
   11    HZ1  LYS 100           HZ1      LYS 100  14.133  22.918   4.283
   12    HZ3  LYS 100           HZ2      LYS 100  13.941  21.249   4.021
   13    HZ2  LYS 100           HZ3      LYS 100  15.150  22.108   3.193

  No H/Q in entry =          13
  In of MODEL   51
    1    H    LEU 101           H        LEU 101  14.977  20.345  11.874
    2    HA   LEU 101           HA       LEU 101  13.827  22.415  13.461
    3    HB2  LEU 101           HB2      LEU 101  14.262  19.464  13.840
    4    HB3  LEU 101           HB3      LEU 101  13.737  20.445  15.205
    5    HG   LEU 101           HG       LEU 101  12.303  20.540  12.544
    6   HD12  LEU 101          HD11      LEU 101  10.646  18.981  13.822
    7   HD11  LEU 101          HD12      LEU 101  12.046  18.562  14.808
    8   HD13  LEU 101          HD13      LEU 101  12.068  18.257  13.071
    9   HD21  LEU 101          HD21      LEU 101  11.666  21.333  15.401
   10   HD23  LEU 101          HD22      LEU 101  10.397  21.113  14.198
   11   HD22  LEU 101          HD23      LEU 101  11.635  22.344  13.954

  No H/Q in entry =          11
  In of MODEL   51
    1    H    LYS 102           H        LYS 102  16.970  21.797  13.005
    2    HA   LYS 102           HA       LYS 102  18.826  22.661  14.067
    3    HB2  LYS 102           HB2      LYS 102  17.024  24.181  15.212
    4    HB3  LYS 102           HB3      LYS 102  17.235  23.117  16.587
    5    HG2  LYS 102           HG2      LYS 102  19.128  25.122  15.408
    6    HG3  LYS 102           HG3      LYS 102  18.755  24.808  17.089
    7    HD2  LYS 102           HD2      LYS 102  20.405  22.891  15.392
    8    HD3  LYS 102           HD3      LYS 102  21.105  24.210  16.321
    9    HE2  LYS 102           HE2      LYS 102  20.704  21.662  17.291
   10    HE3  LYS 102           HE3      LYS 102  20.933  23.102  18.282
   11    HZ2  LYS 102           HZ1      LYS 102  18.964  21.824  18.911
   12    HZ1  LYS 102           HZ2      LYS 102  18.311  22.058  17.366
   13    HZ3  LYS 102           HZ3      LYS 102  18.553  23.386  18.391

  No H/Q in entry =          13
  In of MODEL   51
    1    H    ALA 103           H        ALA 103  16.763  21.061  16.500
    2    HA   ALA 103           HA       ALA 103  18.496  19.843  18.144
    3    HB2  ALA 103           HB1      ALA 103  16.904  17.841  18.146
    4    HB1  ALA 103           HB2      ALA 103  16.004  18.698  16.895
    5    HB3  ALA 103           HB3      ALA 103  16.194  19.417  18.493

  No H/Q in entry =           5
  In of MODEL   51
    1    H1   ALA   1           H3       ALA   1  -1.771  -6.906 -21.377
    2    H2   ALA   1           H2       ALA   1  -2.568  -8.339 -20.920
    3    H3   ALA   1           H1       ALA   1  -0.964  -8.394 -21.484
    4    HA   ALA   1           HA       ALA   1  -1.812  -8.859 -23.476
    5    HB1  ALA   1           HB1      ALA   1  -3.949  -9.569 -22.990
    6    HB2  ALA   1           HB2      ALA   1  -4.386  -8.056 -23.784
    7    HB3  ALA   1           HB3      ALA   1  -4.315  -8.138 -22.026

  No H/Q in entry =           7
  In of MODEL   51
    1    H    GLU   2           H        GLU   2  -2.649  -7.663 -25.459
    2    HA   GLU   2           HA       GLU   2  -1.247  -5.654 -26.343
    3    HB2  GLU   2           HB2      GLU   2  -4.256  -5.709 -26.643
    4    HB3  GLU   2           HB3      GLU   2  -3.138  -4.849 -27.699
    5    HG2  GLU   2           HG2      GLU   2  -2.649  -6.740 -28.858
    6    HG3  GLU   2           HG3      GLU   2  -2.347  -7.648 -27.383

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLU   3           H        GLU   3  -4.397  -4.385 -25.424
    2    HA   GLU   3           HA       GLU   3  -3.336  -1.834 -24.799
    3    HB2  GLU   3           HB2      GLU   3  -6.027  -3.138 -24.452
    4    HB3  GLU   3           HB3      GLU   3  -5.719  -1.525 -23.806
    5    HG2  GLU   3           HG2      GLU   3  -5.371  -0.597 -25.933
    6    HG3  GLU   3           HG3      GLU   3  -4.987  -2.153 -26.662

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LEU   4           H        LEU   4  -4.923  -4.189 -22.612
    2    HA   LEU   4           HA       LEU   4  -4.540  -2.964 -20.222
    3    HB2  LEU   4           HB2      LEU   4  -4.012  -5.907 -20.698
    4    HB3  LEU   4           HB3      LEU   4  -4.406  -5.161 -19.151
    5    HG   LEU   4           HG       LEU   4  -6.193  -5.225 -21.605
    6   HD13  LEU   4          HD11      LEU   4  -7.387  -6.938 -20.602
    7   HD12  LEU   4          HD12      LEU   4  -6.891  -6.482 -18.973
    8   HD11  LEU   4          HD13      LEU   4  -5.765  -7.329 -20.032
    9   HD23  LEU   4          HD21      LEU   4  -7.863  -4.408 -19.726
   10   HD22  LEU   4          HD22      LEU   4  -6.825  -3.241 -20.542
   11   HD21  LEU   4          HD23      LEU   4  -6.392  -3.834 -18.939

  No H/Q in entry =          11
  In of MODEL   51
    1    H    GLU   5           H        GLU   5  -2.060  -4.816 -21.969
    2    HA   GLU   5           HA       GLU   5  -0.063  -4.542 -19.944
    3    HB2  GLU   5           HB2      GLU   5   0.004  -6.315 -21.677
    4    HB3  GLU   5           HB3      GLU   5   0.273  -5.082 -22.909
    5    HG2  GLU   5           HG2      GLU   5   2.359  -4.407 -21.816
    6    HG3  GLU   5           HG3      GLU   5   2.087  -5.583 -20.530

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLU   6           H        GLU   6  -0.709  -2.823 -22.983
    2    HA   GLU   6           HA       GLU   6   1.470  -1.001 -22.726
    3    HB2  GLU   6           HB2      GLU   6   0.341  -1.468 -24.883
    4    HB3  GLU   6           HB3      GLU   6  -1.117  -0.688 -24.269
    5    HG2  GLU   6           HG2      GLU   6   0.102   1.420 -23.986
    6    HG3  GLU   6           HG3      GLU   6   1.590   0.650 -24.534

  No H/Q in entry =           6
  In of MODEL   51
    1    H    VAL   7           H        VAL   7  -1.862  -1.059 -21.662
    2    HA   VAL   7           HA       VAL   7  -2.067   1.653 -20.821
    3    HB   VAL   7           HB       VAL   7  -3.535  -0.859 -19.979
    4   HG11  VAL   7          HG11      VAL   7  -3.893   2.030 -19.160
    5   HG13  VAL   7          HG12      VAL   7  -3.794   0.604 -18.127
    6   HG12  VAL   7          HG13      VAL   7  -5.231   0.881 -19.110
    7   HG21  VAL   7          HG21      VAL   7  -3.702   0.220 -22.365
    8   HG23  VAL   7          HG22      VAL   7  -4.637   1.472 -21.547
    9   HG22  VAL   7          HG23      VAL   7  -5.190  -0.203 -21.519

  No H/Q in entry =           9
  In of MODEL   51
    1    H    VAL   8           H        VAL   8  -1.083  -1.338 -19.187
    2    HA   VAL   8           HA       VAL   8  -0.745  -0.262 -16.592
    3    HB   VAL   8           HB       VAL   8   0.623  -2.588 -17.967
    4   HG11  VAL   8          HG11      VAL   8   0.749  -1.571 -15.122
    5   HG13  VAL   8          HG12      VAL   8   2.089  -1.951 -16.204
    6   HG12  VAL   8          HG13      VAL   8   1.106  -3.250 -15.530
    7   HG21  VAL   8          HG21      VAL   8  -2.013  -2.354 -17.208
    8   HG23  VAL   8          HG22      VAL   8  -1.295  -2.981 -15.728
    9   HG22  VAL   8          HG23      VAL   8  -1.142  -3.887 -17.229

  No H/Q in entry =           9
  In of MODEL   51
    1    H    MET   9           H        MET   9   1.487  -0.570 -19.353
    2    HA   MET   9           HA       MET   9   3.785   0.461 -18.104
    3    HB2  MET   9           HB2      MET   9   2.822   0.515 -20.965
    4    HB3  MET   9           HB3      MET   9   4.355   1.244 -20.487
    5    HG2  MET   9           HG2      MET   9   5.100  -0.911 -19.553
    6    HG3  MET   9           HG3      MET   9   3.561  -1.645 -20.006
    7    HE2  MET   9           HE1      MET   9   7.256  -1.082 -21.361
    8    HE1  MET   9           HE2      MET   9   6.422   0.432 -21.023
    9    HE3  MET   9           HE3      MET   9   6.845   0.018 -22.682

  No H/Q in entry =           9
  In of MODEL   51
    1    H    GLY  10           H        GLY  10   1.098   2.078 -19.764
    2    HA3  GLY  10           HA2      GLY  10   2.076   4.727 -19.522
    3    HA2  GLY  10           HA3      GLY  10   0.383   4.275 -19.717

  No H/Q in entry =           3
  In of MODEL   51
    1    H    LEU  11           H        LEU  11  -0.010   2.747 -17.431
    2    HA   LEU  11           HA       LEU  11  -0.518   4.725 -15.466
    3    HB2  LEU  11           HB2      LEU  11  -0.465   1.709 -15.313
    4    HB3  LEU  11           HB3      LEU  11  -0.961   2.733 -13.967
    5    HG   LEU  11           HG       LEU  11  -2.216   2.856 -16.722
    6   HD13  LEU  11          HD11      LEU  11  -2.806   0.715 -15.966
    7   HD12  LEU  11          HD12      LEU  11  -4.148   1.713 -15.411
    8   HD11  LEU  11          HD13      LEU  11  -2.887   1.225 -14.279
    9   HD22  LEU  11          HD21      LEU  11  -2.790   4.874 -15.709
   10   HD21  LEU  11          HD22      LEU  11  -2.708   4.205 -14.080
   11   HD23  LEU  11          HD23      LEU  11  -4.092   3.848 -15.113

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  12           H        ILE  12   2.010   2.245 -15.727
    2    HA   ILE  12           HA       ILE  12   3.234   2.773 -13.230
    3    HB   ILE  12           HB       ILE  12   4.470   1.731 -15.802
    4   HG12  ILE  12          HG12      ILE  12   2.453   0.510 -14.651
    5   HG13  ILE  12          HG13      ILE  12   3.844  -0.433 -15.148
    6   HG22  ILE  12          HG21      ILE  12   6.152   0.698 -14.237
    7   HG21  ILE  12          HG22      ILE  12   5.455   1.654 -12.931
    8   HG23  ILE  12          HG23      ILE  12   6.225   2.457 -14.297
    9   HD11  ILE  12          HD11      ILE  12   3.410   0.666 -12.359
   10   HD13  ILE  12          HD12      ILE  12   4.676  -0.449 -12.870
   11   HD12  ILE  12          HD13      ILE  12   3.006  -0.968 -12.852

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  13           H        ILE  13   3.822   4.037 -16.490
    2    HA   ILE  13           HA       ILE  13   5.973   5.745 -15.777
    3    HB   ILE  13           HB       ILE  13   3.928   5.842 -18.008
    4   HG12  ILE  13          HG12      ILE  13   5.745   3.984 -17.749
    5   HG13  ILE  13          HG13      ILE  13   5.507   4.737 -19.322
    6   HG21  ILE  13          HG21      ILE  13   6.348   7.605 -17.539
    7   HG23  ILE  13          HG22      ILE  13   4.678   8.121 -17.742
    8   HG22  ILE  13          HG23      ILE  13   5.563   7.451 -19.112
    9   HD12  ILE  13          HD11      ILE  13   7.957   4.486 -18.244
   10   HD11  ILE  13          HD12      ILE  13   7.488   6.000 -17.480
   11   HD13  ILE  13          HD13      ILE  13   7.515   5.875 -19.235

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ASN  14           H        ASN  14   2.467   6.259 -16.021
    2    HA   ASN  14           HA       ASN  14   2.444   9.004 -15.380
    3    HB2  ASN  14           HB2      ASN  14   0.537   7.374 -16.201
    4    HB3  ASN  14           HB3      ASN  14   0.226   7.195 -14.478
    5   HD21  ASN  14          HD21      ASN  14  -1.797   8.364 -15.896
    6   HD22  ASN  14          HD22      ASN  14  -1.848  10.037 -15.626

  No H/Q in entry =           6
  In of MODEL   51
    1    H    SER  15           H        SER  15   2.147   6.127 -13.305
    2    HA   SER  15           HA       SER  15   1.864   7.496 -10.853
    3    HB2  SER  15           HB2      SER  15   2.410   5.406  -9.810
    4    HB3  SER  15           HB3      SER  15   1.568   4.993 -11.300
    5    HG   SER  15           HG       SER  15   3.945   4.214 -10.568

  No H/Q in entry =           5
  In of MODEL   51
    1    H    GLY  16           H        GLY  16   4.722   6.386 -12.633
    2    HA3  GLY  16           HA2      GLY  16   6.664   7.130 -10.714
    3    HA2  GLY  16           HA3      GLY  16   6.955   6.928 -12.440

  No H/Q in entry =           3
  In of MODEL   51
    1    H    GLN  17           H        GLN  17   5.268   8.896 -13.489
    2    HA   GLN  17           HA       GLN  17   6.858  11.229 -13.189
    3    HB2  GLN  17           HB2      GLN  17   5.493  10.725 -15.215
    4    HB3  GLN  17           HB3      GLN  17   4.033  11.024 -14.273
    5    HG2  GLN  17           HG2      GLN  17   4.609  13.039 -15.517
    6    HG3  GLN  17           HG3      GLN  17   4.850  13.327 -13.796
    7   HE21  GLN  17          HE21      GLN  17   6.586  14.834 -13.888
    8   HE22  GLN  17          HE22      GLN  17   8.089  14.478 -14.590

  No H/Q in entry =           8
  In of MODEL   51
    1    H    ALA  18           H        ALA  18   3.762  10.224 -11.820
    2    HA   ALA  18           HA       ALA  18   3.056  12.614 -10.547
    3    HB1  ALA  18           HB1      ALA  18   1.915  10.163 -10.765
    4    HB2  ALA  18           HB2      ALA  18   1.379  11.384  -9.613
    5    HB3  ALA  18           HB3      ALA  18   2.467  10.096  -9.092

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ARG  19           H        ARG  19   4.927   9.842  -9.284
    2    HA   ARG  19           HA       ARG  19   5.480  10.995  -6.764
    3    HB2  ARG  19           HB2      ARG  19   5.881   8.591  -7.296
    4    HB3  ARG  19           HB3      ARG  19   7.232   9.072  -8.326
    5    HG2  ARG  19           HG2      ARG  19   8.369  10.105  -6.409
    6    HG3  ARG  19           HG3      ARG  19   6.998   9.722  -5.369
    7    HD2  ARG  19           HD2      ARG  19   8.756   8.079  -5.025
    8    HD3  ARG  19           HD3      ARG  19   7.374   7.303  -5.802
    9    HE   ARG  19           HE       ARG  19   9.068   8.118  -7.860
   10   HH21  ARG  19          HH11      ARG  19  10.617   6.708  -8.722
   11   HH22  ARG  19          HH12      ARG  19  11.164   5.356  -7.792
   12   HH11  ARG  19          HH21      ARG  19   9.150   6.084  -5.084
   13   HH12  ARG  19          HH22      ARG  19  10.330   5.003  -5.731

  No H/Q in entry =          13
  In of MODEL   51
    1    H    SER  20           H        SER  20   7.278  11.021  -9.824
    2    HA   SER  20           HA       SER  20   9.533  12.427  -9.014
    3    HB2  SER  20           HB2      SER  20   9.547  11.553 -11.219
    4    HB3  SER  20           HB3      SER  20   8.048  12.376 -11.635
    5    HG   SER  20           HG       SER  20  10.431  13.724 -10.899

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LEU  21           H        LEU  21   6.431  13.708 -10.189
    2    HA   LEU  21           HA       LEU  21   7.112  16.452  -9.966
    3    HB2  LEU  21           HB2      LEU  21   4.441  15.035  -9.872
    4    HB3  LEU  21           HB3      LEU  21   4.611  16.789  -9.872
    5    HG   LEU  21           HG       LEU  21   5.791  14.999 -12.017
    6   HD13  LEU  21          HD11      LEU  21   3.434  14.721 -12.210
    7   HD12  LEU  21          HD12      LEU  21   3.850  15.967 -13.388
    8   HD11  LEU  21          HD13      LEU  21   3.126  16.419 -11.846
    9   HD21  LEU  21          HD21      LEU  21   5.577  17.970 -11.573
   10   HD23  LEU  21          HD22      LEU  21   5.550  17.366 -13.228
   11   HD22  LEU  21          HD23      LEU  21   6.939  17.045 -12.200

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ALA  22           H        ALA  22   5.608  14.164  -7.711
    2    HA   ALA  22           HA       ALA  22   5.023  15.971  -5.638
    3    HB3  ALA  22           HB1      ALA  22   4.255  13.582  -5.798
    4    HB2  ALA  22           HB2      ALA  22   4.855  14.050  -4.207
    5    HB1  ALA  22           HB3      ALA  22   5.868  13.090  -5.286

  No H/Q in entry =           5
  In of MODEL   51
    1    H    TYR  23           H        TYR  23   7.949  13.939  -6.098
    2    HA   TYR  23           HA       TYR  23   9.349  14.952  -3.853
    3    HB2  TYR  23           HB2      TYR  23  10.124  12.943  -5.017
    4    HB3  TYR  23           HB3      TYR  23  10.428  13.881  -6.479
    5    HD1  TYR  23           HD1      TYR  23  11.414  13.553  -2.891
    6    HD2  TYR  23           HD2      TYR  23  12.468  15.037  -6.784
    7    HE1  TYR  23           HE1      TYR  23  13.680  14.127  -2.061
    8    HE2  TYR  23           HE2      TYR  23  14.733  15.612  -5.953
    9    HH   TYR  23           HH       TYR  23  15.731  16.172  -3.581

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ALA  24           H        ALA  24   9.147  16.063  -7.217
    2    HA   ALA  24           HA       ALA  24  11.048  18.144  -6.981
    3    HB2  ALA  24           HB1      ALA  24  10.592  18.209  -9.187
    4    HB3  ALA  24           HB2      ALA  24   9.040  18.961  -8.816
    5    HB1  ALA  24           HB3      ALA  24   9.161  17.208  -8.949

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ALA  25           H        ALA  25   7.573  17.965  -6.337
    2    HA   ALA  25           HA       ALA  25   7.102  20.683  -5.762
    3    HB1  ALA  25           HB1      ALA  25   5.436  18.688  -5.954
    4    HB2  ALA  25           HB2      ALA  25   5.078  19.976  -4.802
    5    HB3  ALA  25           HB3      ALA  25   5.769  18.453  -4.237

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LEU  26           H        LEU  26   8.180  18.000  -3.722
    2    HA   LEU  26           HA       LEU  26   8.302  19.428  -1.284
    3    HB2  LEU  26           HB2      LEU  26   8.395  17.012  -1.282
    4    HB3  LEU  26           HB3      LEU  26   9.858  17.019  -2.262
    5    HG   LEU  26           HG       LEU  26  11.087  18.133  -0.429
    6   HD12  LEU  26          HD11      LEU  26   9.875  18.140   1.839
    7   HD11  LEU  26          HD12      LEU  26   8.381  18.005   0.914
    8   HD13  LEU  26          HD13      LEU  26   9.426  19.410   0.700
    9   HD21  LEU  26          HD21      LEU  26   9.556  15.666   0.452
   10   HD23  LEU  26          HD22      LEU  26  11.077  16.227   1.140
   11   HD22  LEU  26          HD23      LEU  26  11.020  15.669  -0.530

  No H/Q in entry =          11
  In of MODEL   51
    1    H    LYS  27           H        LYS  27  10.702  18.856  -3.825
    2    HA   LYS  27           HA       LYS  27  12.895  20.094  -2.611
    3    HB2  LYS  27           HB2      LYS  27  12.982  18.748  -4.702
    4    HB3  LYS  27           HB3      LYS  27  12.212  20.082  -5.562
    5    HG2  LYS  27           HG2      LYS  27  14.082  21.565  -4.995
    6    HG3  LYS  27           HG3      LYS  27  14.848  20.272  -4.065
    7    HD2  LYS  27           HD2      LYS  27  14.976  18.886  -6.121
    8    HD3  LYS  27           HD3      LYS  27  14.256  20.205  -7.043
    9    HE2  LYS  27           HE2      LYS  27  16.148  21.670  -6.442
   10    HE3  LYS  27           HE3      LYS  27  16.873  20.355  -5.510
   11    HZ3  LYS  27           HZ1      LYS  27  17.848  20.456  -7.703
   12    HZ2  LYS  27           HZ2      LYS  27  16.317  20.339  -8.434
   13    HZ1  LYS  27           HZ3      LYS  27  16.945  19.027  -7.555

  No H/Q in entry =          13
  In of MODEL   51
    1    H    GLN  28           H        GLN  28  10.260  21.478  -4.541
    2    HA   GLN  28           HA       GLN  28  11.220  24.131  -4.698
    3    HB2  GLN  28           HB2      GLN  28   8.385  23.064  -4.565
    4    HB3  GLN  28           HB3      GLN  28   8.800  24.735  -4.949
    5    HG2  GLN  28           HG2      GLN  28   9.814  22.330  -6.489
    6    HG3  GLN  28           HG3      GLN  28   8.437  23.314  -6.982
    7   HE21  GLN  28          HE21      GLN  28   9.400  25.907  -6.373
    8   HE22  GLN  28          HE22      GLN  28  10.750  26.239  -7.348

  No H/Q in entry =           8
  In of MODEL   51
    1    H    ALA  29           H        ALA  29   9.304  22.437  -2.250
    2    HA   ALA  29           HA       ALA  29   8.766  24.628  -0.563
    3    HB2  ALA  29           HB1      ALA  29   8.047  23.058   1.009
    4    HB1  ALA  29           HB2      ALA  29   9.265  21.874   0.535
    5    HB3  ALA  29           HB3      ALA  29   7.872  22.168  -0.504

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LYS  30           H        LYS  30  11.496  22.360  -0.653
    2    HA   LYS  30           HA       LYS  30  12.829  23.312   1.642
    3    HB2  LYS  30           HB2      LYS  30  13.908  22.028  -0.877
    4    HB3  LYS  30           HB3      LYS  30  14.900  22.386   0.539
    5    HG2  LYS  30           HG2      LYS  30  13.356  21.002   1.927
    6    HG3  LYS  30           HG3      LYS  30  12.462  20.582   0.463
    7    HD2  LYS  30           HD2      LYS  30  14.500  19.596  -0.512
    8    HD3  LYS  30           HD3      LYS  30  15.414  20.030   0.934
    9    HE2  LYS  30           HE2      LYS  30  13.918  18.598   2.297
   10    HE3  LYS  30           HE3      LYS  30  13.034  18.144   0.835
   11    HZ2  LYS  30           HZ1      LYS  30  14.831  16.565   1.582
   12    HZ1  LYS  30           HZ2      LYS  30  15.965  17.752   1.124
   13    HZ3  LYS  30           HZ3      LYS  30  14.921  17.070  -0.034

  No H/Q in entry =          13
  In of MODEL   51
    1    H    GLN  31           H        GLN  31  12.698  24.520  -1.653
    2    HA   GLN  31           HA       GLN  31  14.853  26.413  -1.244
    3    HB2  GLN  31           HB2      GLN  31  12.795  26.461  -3.455
    4    HB3  GLN  31           HB3      GLN  31  14.415  27.157  -3.466
    5    HG2  GLN  31           HG2      GLN  31  14.881  24.461  -2.896
    6    HG3  GLN  31           HG3      GLN  31  13.569  24.407  -4.066
    7   HE21  GLN  31          HE21      GLN  31  16.410  23.615  -4.490
    8   HE22  GLN  31          HE22      GLN  31  16.974  24.589  -5.759

  No H/Q in entry =           8
  In of MODEL   51
    1    H    GLY  32           H        GLY  32  11.786  26.229  -0.078
    2    HA3  GLY  32           HA2      GLY  32  10.639  27.796   1.204
    3    HA2  GLY  32           HA3      GLY  32  11.760  29.032   0.647

  No H/Q in entry =           3
  In of MODEL   51
    1    H    ASP  33           H        ASP  33  10.379  27.130  -1.837
    2    HA   ASP  33           HA       ASP  33   8.709  29.403  -2.679
    3    HB2  ASP  33           HB2      ASP  33   9.793  26.986  -4.131
    4    HB3  ASP  33           HB3      ASP  33   8.636  28.101  -4.853

  No H/Q in entry =           4
  In of MODEL   51
    1    H    PHE  34           H        PHE  34   7.031  28.926  -1.105
    2    HA   PHE  34           HA       PHE  34   5.653  26.454  -1.002
    3    HB2  PHE  34           HB2      PHE  34   4.696  29.240  -0.313
    4    HB3  PHE  34           HB3      PHE  34   3.850  27.749   0.103
    5    HD1  PHE  34           HD1      PHE  34   6.108  30.147   1.304
    6    HD2  PHE  34           HD2      PHE  34   5.428  25.906   1.251
    7    HE1  PHE  34           HE1      PHE  34   7.512  29.895   3.331
    8    HE2  PHE  34           HE2      PHE  34   6.835  25.658   3.276
    9    HZ   PHE  34           HZ       PHE  34   7.871  27.653   4.315

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ALA  35           H        ALA  35   5.208  29.319  -3.007
    2    HA   ALA  35           HA       ALA  35   2.650  28.705  -4.016
    3    HB1  ALA  35           HB1      ALA  35   3.688  30.099  -6.059
    4    HB3  ALA  35           HB2      ALA  35   4.914  30.460  -4.843
    5    HB2  ALA  35           HB3      ALA  35   3.225  30.868  -4.541

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ALA  36           H        ALA  36   5.869  28.034  -5.392
    2    HA   ALA  36           HA       ALA  36   4.866  26.606  -7.630
    3    HB3  ALA  36           HB1      ALA  36   7.020  26.732  -8.261
    4    HB2  ALA  36           HB2      ALA  36   7.511  25.702  -6.914
    5    HB1  ALA  36           HB3      ALA  36   7.407  27.450  -6.697

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ALA  37           H        ALA  37   5.844  25.609  -4.383
    2    HA   ALA  37           HA       ALA  37   5.783  22.822  -4.814
    3    HB2  ALA  37           HB1      ALA  37   5.538  24.611  -2.432
    4    HB1  ALA  37           HB2      ALA  37   6.669  23.293  -2.734
    5    HB3  ALA  37           HB3      ALA  37   5.011  22.939  -2.251

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LYS  38           H        LYS  38   3.257  25.028  -3.627
    2    HA   LYS  38           HA       LYS  38   1.160  23.214  -3.391
    3    HB2  LYS  38           HB2      LYS  38   1.513  25.970  -3.140
    4    HB3  LYS  38           HB3      LYS  38   0.305  25.824  -4.411
    5    HG2  LYS  38           HG2      LYS  38  -1.135  24.498  -2.960
    6    HG3  LYS  38           HG3      LYS  38   0.118  24.438  -1.712
    7    HD2  LYS  38           HD2      LYS  38  -0.065  26.774  -1.262
    8    HD3  LYS  38           HD3      LYS  38  -0.987  27.064  -2.737
    9    HE2  LYS  38           HE2      LYS  38  -2.478  27.096  -0.788
   10    HE3  LYS  38           HE3      LYS  38  -2.858  25.720  -1.828
   11    HZ3  LYS  38           HZ1      LYS  38  -2.122  24.248  -0.302
   12    HZ2  LYS  38           HZ2      LYS  38  -2.466  25.505   0.791
   13    HZ1  LYS  38           HZ3      LYS  38  -0.874  25.255   0.255

  No H/Q in entry =          13
  In of MODEL   51
    1    H    ALA  39           H        ALA  39   2.120  25.119  -6.245
    2    HA   ALA  39           HA       ALA  39   0.033  24.253  -7.935
    3    HB2  ALA  39           HB1      ALA  39   2.762  24.903  -9.006
    4    HB1  ALA  39           HB2      ALA  39   1.800  26.163  -8.234
    5    HB3  ALA  39           HB3      ALA  39   1.178  25.327  -9.656

  No H/Q in entry =           5
  In of MODEL   51
    1    H    MET  40           H        MET  40   3.275  22.954  -7.378
    2    HA   MET  40           HA       MET  40   3.165  20.936  -9.371
    3    HB2  MET  40           HB2      MET  40   4.793  21.158  -6.833
    4    HB3  MET  40           HB3      MET  40   5.036  19.903  -8.050
    5    HG2  MET  40           HG2      MET  40   5.088  22.860  -8.713
    6    HG3  MET  40           HG3      MET  40   6.538  21.958  -8.275
    7    HE3  MET  40           HE1      MET  40   7.392  19.745 -11.091
    8    HE2  MET  40           HE2      MET  40   6.840  19.424  -9.450
    9    HE1  MET  40           HE3      MET  40   7.932  20.772  -9.756

  No H/Q in entry =           9
  In of MODEL   51
    1    H    MET  41           H        MET  41   2.273  20.975  -5.941
    2    HA   MET  41           HA       MET  41   1.744  18.210  -5.662
    3    HB2  MET  41           HB2      MET  41   0.419  20.565  -4.300
    4    HB3  MET  41           HB3      MET  41   0.268  18.887  -3.792
    5    HG2  MET  41           HG2      MET  41   2.978  19.111  -3.847
    6    HG3  MET  41           HG3      MET  41   2.539  20.769  -3.447
    7    HE2  MET  41           HE1      MET  41  -0.488  19.513  -1.702
    8    HE1  MET  41           HE2      MET  41   0.325  21.027  -2.084
    9    HE3  MET  41           HE3      MET  41   0.278  20.455  -0.416

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ASP  42           H        ASP  42  -0.303  20.934  -6.619
    2    HA   ASP  42           HA       ASP  42  -2.743  19.571  -6.741
    3    HB2  ASP  42           HB2      ASP  42  -2.040  22.142  -7.000
    4    HB3  ASP  42           HB3      ASP  42  -2.203  21.749  -8.708

  No H/Q in entry =           4
  In of MODEL   51
    1    H    GLN  43           H        GLN  43  -0.320  20.166  -9.259
    2    HA   GLN  43           HA       GLN  43  -1.720  18.848 -11.340
    3    HB2  GLN  43           HB2      GLN  43   1.240  19.366 -10.977
    4    HB3  GLN  43           HB3      GLN  43   0.517  18.727 -12.456
    5    HG2  GLN  43           HG2      GLN  43  -0.997  20.753 -12.485
    6    HG3  GLN  43           HG3      GLN  43  -0.035  21.408 -11.163
    7   HE21  GLN  43          HE21      GLN  43   0.111  23.031 -13.249
    8   HE22  GLN  43          HE22      GLN  43   1.520  22.812 -14.166

  No H/Q in entry =           8
  In of MODEL   51
    1    H    SER  44           H        SER  44   0.648  17.708  -8.966
    2    HA   SER  44           HA       SER  44   0.978  15.102  -9.996
    3    HB2  SER  44           HB2      SER  44   1.887  16.540  -7.764
    4    HB3  SER  44           HB3      SER  44   1.030  15.155  -7.089
    5    HG   SER  44           HG       SER  44   3.139  14.538  -7.530

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ARG  45           H        ARG  45  -1.327  16.416  -7.641
    2    HA   ARG  45           HA       ARG  45  -2.707  14.053  -6.999
    3    HB2  ARG  45           HB2      ARG  45  -2.900  16.220  -5.804
    4    HB3  ARG  45           HB3      ARG  45  -3.766  16.887  -7.184
    5    HG2  ARG  45           HG2      ARG  45  -5.528  15.159  -6.890
    6    HG3  ARG  45           HG3      ARG  45  -4.673  14.547  -5.474
    7    HD2  ARG  45           HD2      ARG  45  -4.875  16.812  -4.414
    8    HD3  ARG  45           HD3      ARG  45  -5.872  17.332  -5.790
    9    HE   ARG  45           HE       ARG  45  -6.972  14.954  -4.744
   10   HH21  ARG  45          HH11      ARG  45  -8.800  15.026  -3.461
   11   HH22  ARG  45          HH12      ARG  45  -9.191  16.464  -2.588
   12   HH11  ARG  45          HH21      ARG  45  -6.424  18.200  -3.721
   13   HH12  ARG  45          HH22      ARG  45  -7.840  18.262  -2.734

  No H/Q in entry =          13
  In of MODEL   51
    1    H    MET  46           H        MET  46  -3.311  16.459  -9.543
    2    HA   MET  46           HA       MET  46  -5.656  15.284 -10.590
    3    HB2  MET  46           HB2      MET  46  -3.565  17.114 -11.778
    4    HB3  MET  46           HB3      MET  46  -4.953  16.557 -12.717
    5    HG2  MET  46           HG2      MET  46  -6.488  17.489 -11.058
    6    HG3  MET  46           HG3      MET  46  -5.136  17.979 -10.044
    7    HE3  MET  46           HE1      MET  46  -5.495  18.679 -14.266
    8    HE2  MET  46           HE2      MET  46  -6.891  19.641 -13.790
    9    HE1  MET  46           HE3      MET  46  -6.773  17.959 -13.277

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ALA  47           H        ALA  47  -2.232  14.811 -11.371
    2    HA   ALA  47           HA       ALA  47  -2.589  13.085 -13.581
    3    HB3  ALA  47           HB1      ALA  47  -0.410  13.977 -13.243
    4    HB2  ALA  47           HB2      ALA  47  -0.264  12.249 -12.912
    5    HB1  ALA  47           HB3      ALA  47  -0.350  13.400 -11.577

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LEU  48           H        LEU  48  -2.295  12.446 -10.109
    2    HA   LEU  48           HA       LEU  48  -2.385   9.607 -10.270
    3    HB2  LEU  48           HB2      LEU  48  -3.138  11.521  -8.049
    4    HB3  LEU  48           HB3      LEU  48  -3.040   9.771  -7.851
    5    HG   LEU  48           HG       LEU  48  -0.751  11.475  -8.862
    6   HD13  LEU  48          HD11      LEU  48  -1.020  12.243  -6.668
    7   HD12  LEU  48          HD12      LEU  48   0.147  10.937  -6.479
    8   HD11  LEU  48          HD13      LEU  48  -1.548  10.671  -6.070
    9   HD22  LEU  48          HD21      LEU  48  -0.252   9.291  -9.508
   10   HD21  LEU  48          HD22      LEU  48  -1.112   8.573  -8.146
   11   HD23  LEU  48          HD23      LEU  48   0.461   9.329  -7.896

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ASN  49           H        ASN  49  -4.850  12.094  -9.850
    2    HA   ASN  49           HA       ASN  49  -7.030  10.425  -9.297
    3    HB2  ASN  49           HB2      ASN  49  -7.081  12.851  -8.975
    4    HB3  ASN  49           HB3      ASN  49  -6.947  13.107 -10.711
    5   HD21  ASN  49          HD21      ASN  49  -8.995  14.113 -10.998
    6   HD22  ASN  49          HD22      ASN  49 -10.463  13.308 -10.729

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLU  50           H        GLU  50  -5.773  11.627 -12.392
    2    HA   GLU  50           HA       GLU  50  -7.735  10.369 -14.026
    3    HB2  GLU  50           HB2      GLU  50  -6.278  12.191 -14.848
    4    HB3  GLU  50           HB3      GLU  50  -4.882  11.122 -14.720
    5    HG2  GLU  50           HG2      GLU  50  -5.863   9.586 -16.351
    6    HG3  GLU  50           HG3      GLU  50  -7.326  10.561 -16.429

  No H/Q in entry =           6
  In of MODEL   51
    1    H    ALA  51           H        ALA  51  -4.555   9.381 -12.842
    2    HA   ALA  51           HA       ALA  51  -4.421   6.930 -14.263
    3    HB2  ALA  51           HB1      ALA  51  -2.432   6.645 -13.176
    4    HB1  ALA  51           HB2      ALA  51  -3.111   7.065 -11.603
    5    HB3  ALA  51           HB3      ALA  51  -2.665   8.337 -12.740

  No H/Q in entry =           5
  In of MODEL   51
    1    H    HIS  52           H        HIS  52  -5.574   7.757 -11.005
    2    HA   HIS  52           HA       HIS  52  -6.250   5.145 -10.172
    3    HB2  HIS  52           HB2      HIS  52  -6.105   7.093  -8.652
    4    HB3  HIS  52           HB3      HIS  52  -7.554   7.766  -9.399
    5    HD1  HIS  52           HD1      HIS  52  -9.784   6.288  -9.149
    6    HD2  HIS  52           HD2      HIS  52  -6.605   5.164  -6.699
    7    HE1  HIS  52           HE1      HIS  52 -10.759   4.793  -7.352
    8    HE2  HIS  52           HE2      HIS  52  -8.832   4.099  -5.850

  No H/Q in entry =           8
  In of MODEL   51
    1    H    LEU  53           H        LEU  53  -8.085   7.602 -11.946
    2    HA   LEU  53           HA       LEU  53 -10.588   6.306 -11.944
    3    HB2  LEU  53           HB2      LEU  53  -9.319   8.292 -13.816
    4    HB3  LEU  53           HB3      LEU  53 -10.916   7.623 -14.136
    5    HG   LEU  53           HG       LEU  53 -10.194   8.942 -11.498
    6   HD11  LEU  53          HD11      LEU  53 -11.339  10.118 -14.038
    7   HD13  LEU  53          HD12      LEU  53  -9.934  10.669 -13.124
    8   HD12  LEU  53          HD13      LEU  53 -11.555  10.878 -12.466
    9   HD22  LEU  53          HD21      LEU  53 -12.184   7.731 -11.153
   10   HD21  LEU  53          HD22      LEU  53 -12.731   7.980 -12.807
   11   HD23  LEU  53          HD23      LEU  53 -12.815   9.295 -11.652

  No H/Q in entry =          11
  In of MODEL   51
    1    H    VAL  54           H        VAL  54  -7.852   6.114 -14.198
    2    HA   VAL  54           HA       VAL  54  -9.084   4.344 -16.035
    3    HB   VAL  54           HB       VAL  54  -6.173   4.853 -15.371
    4   HG12  VAL  54          HG11      VAL  54  -5.939   3.770 -17.762
    5   HG11  VAL  54          HG12      VAL  54  -7.464   2.987 -17.350
    6   HG13  VAL  54          HG13      VAL  54  -6.042   2.733 -16.340
    7   HG22  VAL  54          HG21      VAL  54  -6.951   6.796 -16.409
    8   HG21  VAL  54          HG22      VAL  54  -8.150   5.932 -17.370
    9   HG23  VAL  54          HG23      VAL  54  -6.446   5.854 -17.811

  No H/Q in entry =           9
  In of MODEL   51
    1    H    GLN  55           H        GLN  55  -7.067   3.797 -13.148
    2    HA   GLN  55           HA       GLN  55  -6.975   0.981 -13.408
    3    HB2  GLN  55           HB2      GLN  55  -5.411   1.877 -11.898
    4    HB3  GLN  55           HB3      GLN  55  -6.624   2.841 -11.060
    5    HG2  GLN  55           HG2      GLN  55  -7.302   1.082  -9.739
    6    HG3  GLN  55           HG3      GLN  55  -7.084  -0.103 -11.020
    7   HE21  GLN  55          HE21      GLN  55  -5.456  -1.552 -10.537
    8   HE22  GLN  55          HE22      GLN  55  -4.066  -1.200  -9.633

  No H/Q in entry =           8
  In of MODEL   51
    1    H    THR  56           H        THR  56  -9.299   3.140 -11.777
    2    HA   THR  56           HA       THR  56 -10.873   1.254 -10.479
    3    HB   THR  56           HB       THR  56 -11.969   3.649 -11.976
    4    HG1  THR  56           HG1      THR  56 -10.620   3.423  -9.503
    5   HG23  THR  56          HG21      THR  56 -13.822   3.470 -10.622
    6   HG22  THR  56          HG22      THR  56 -12.917   2.734  -9.299
    7   HG21  THR  56          HG23      THR  56 -13.374   1.768 -10.704

  No H/Q in entry =           7
  In of MODEL   51
    1    H    LYS  57           H        LYS  57 -11.097   2.340 -13.863
    2    HA   LYS  57           HA       LYS  57 -13.256   0.651 -14.605
    3    HB2  LYS  57           HB2      LYS  57 -12.386   2.605 -15.924
    4    HB3  LYS  57           HB3      LYS  57 -10.952   1.662 -16.306
    5    HG2  LYS  57           HG2      LYS  57 -12.316  -0.003 -17.466
    6    HG3  LYS  57           HG3      LYS  57 -13.786   0.861 -17.030
    7    HD2  LYS  57           HD2      LYS  57 -13.002   2.826 -18.327
    8    HD3  LYS  57           HD3      LYS  57 -11.555   1.934 -18.791
    9    HE2  LYS  57           HE2      LYS  57 -12.949   0.232 -19.915
   10    HE3  LYS  57           HE3      LYS  57 -14.412   1.095 -19.441
   11    HZ1  LYS  57           HZ1      LYS  57 -12.275   2.428 -20.981
   12    HZ3  LYS  57           HZ2      LYS  57 -13.909   2.870 -20.825
   13    HZ2  LYS  57           HZ3      LYS  57 -13.476   1.513 -21.754

  No H/Q in entry =          13
  In of MODEL   51
    1    H    LEU  58           H        LEU  58  -9.751   0.223 -14.569
    2    HA   LEU  58           HA       LEU  58  -9.765  -2.293 -15.859
    3    HB2  LEU  58           HB2      LEU  58  -7.721  -1.001 -14.063
    4    HB3  LEU  58           HB3      LEU  58  -7.464  -2.522 -14.919
    5    HG   LEU  58           HG       LEU  58  -8.228   0.083 -16.277
    6   HD11  LEU  58          HD11      LEU  58  -5.577  -1.153 -15.602
    7   HD13  LEU  58          HD12      LEU  58  -6.073   0.538 -15.549
    8   HD12  LEU  58          HD13      LEU  58  -5.742  -0.232 -17.098
    9   HD22  LEU  58          HD21      LEU  58  -8.812  -1.479 -17.865
   10   HD21  LEU  58          HD22      LEU  58  -7.766  -2.726 -17.190
   11   HD23  LEU  58          HD23      LEU  58  -7.082  -1.451 -18.199

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  59           H        ILE  59 -10.568  -1.393 -12.603
    2    HA   ILE  59           HA       ILE  59 -10.209  -4.160 -11.659
    3    HB   ILE  59           HB       ILE  59  -9.760  -1.892 -10.262
    4   HG12  ILE  59          HG12      ILE  59 -11.109  -4.259  -8.943
    5   HG13  ILE  59          HG13      ILE  59  -9.463  -4.312  -9.520
    6   HG21  ILE  59          HG21      ILE  59 -12.306  -1.393 -10.501
    7   HG23  ILE  59          HG22      ILE  59 -11.574  -1.199  -8.925
    8   HG22  ILE  59          HG23      ILE  59 -12.516  -2.641  -9.295
    9   HD11  ILE  59          HD11      ILE  59 -10.513  -2.294  -7.550
   10   HD13  ILE  59          HD12      ILE  59  -8.841  -2.444  -8.075
   11   HD12  ILE  59          HD13      ILE  59  -9.582  -3.722  -7.110

  No H/Q in entry =          11
  In of MODEL   51
    1    H    GLU  60           H        GLU  60 -12.774  -1.847 -12.451
    2    HA   GLU  60           HA       GLU  60 -14.951  -3.366 -11.426
    3    HB2  GLU  60           HB2      GLU  60 -15.255  -1.030 -11.978
    4    HB3  GLU  60           HB3      GLU  60 -14.795  -1.318 -13.653
    5    HG2  GLU  60           HG2      GLU  60 -17.076  -2.912 -12.578
    6    HG3  GLU  60           HG3      GLU  60 -17.362  -1.215 -12.903

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLY  61           H        GLY  61 -13.296  -3.348 -14.550
    2    HA3  GLY  61           HA2      GLY  61 -15.012  -5.594 -15.431
    3    HA2  GLY  61           HA3      GLY  61 -14.174  -4.488 -16.514

  No H/Q in entry =           3
  In of MODEL   51
    1    H    ASP  62           H        ASP  62 -12.782  -5.936 -13.638
    2    HA   ASP  62           HA       ASP  62 -10.531  -6.907 -15.122
    3    HB2  ASP  62           HB2      ASP  62  -9.796  -7.734 -12.893
    4    HB3  ASP  62           HB3      ASP  62 -10.251  -6.034 -12.872

  No H/Q in entry =           4
  In of MODEL   51
    1    H    ALA  63           H        ALA  63 -12.873  -8.171 -16.140
    2    HA   ALA  63           HA       ALA  63 -13.352 -10.768 -15.075
    3    HB2  ALA  63           HB1      ALA  63 -14.034 -11.207 -17.556
    4    HB1  ALA  63           HB2      ALA  63 -13.692  -9.494 -17.794
    5    HB3  ALA  63           HB3      ALA  63 -14.940  -9.995 -16.651

  No H/Q in entry =           5
  In of MODEL   51
    1    H    GLY  64           H        GLY  64 -11.055  -9.504 -17.421
    2    HA3  GLY  64           HA2      GLY  64  -9.170 -10.376 -18.387
    3    HA2  GLY  64           HA3      GLY  64  -9.038 -11.384 -16.953

  No H/Q in entry =           3
  In of MODEL   51
    1    H    GLU  65           H        GLU  65  -8.578 -13.377 -17.747
    2    HA   GLU  65           HA       GLU  65  -9.563 -14.363 -20.207
    3    HB2  GLU  65           HB2      GLU  65  -8.369 -15.832 -17.854
    4    HB3  GLU  65           HB3      GLU  65  -8.678 -16.552 -19.434
    5    HG2  GLU  65           HG2      GLU  65  -6.940 -14.111 -18.974
    6    HG3  GLU  65           HG3      GLU  65  -6.327 -15.751 -19.181

  No H/Q in entry =           6
  In of MODEL   51
    1    H    GLY  66           H        GLY  66 -10.371 -16.846 -19.892
    2    HA3  GLY  66           HA2      GLY  66 -13.147 -16.696 -19.499
    3    HA2  GLY  66           HA3      GLY  66 -12.216 -18.164 -19.729

  No H/Q in entry =           3
  In of MODEL   51
    1    H    LYS  67           H        LYS  67 -10.590 -17.885 -17.409
    2    HA   LYS  67           HA       LYS  67 -12.323 -19.094 -15.498
    3    HB2  LYS  67           HB2      LYS  67  -9.394 -18.390 -15.445
    4    HB3  LYS  67           HB3      LYS  67 -10.215 -19.263 -14.144
    5    HG2  LYS  67           HG2      LYS  67 -10.955 -20.979 -15.751
    6    HG3  LYS  67           HG3      LYS  67 -10.147 -20.112 -17.055
    7    HD2  LYS  67           HD2      LYS  67  -7.975 -20.432 -15.925
    8    HD3  LYS  67           HD3      LYS  67  -8.787 -21.310 -14.626
    9    HE2  LYS  67           HE2      LYS  67  -9.592 -22.983 -16.259
   10    HE3  LYS  67           HE3      LYS  67  -8.768 -22.111 -17.552
   11    HZ1  LYS  67           HZ1      LYS  67  -6.959 -22.571 -15.453
   12    HZ3  LYS  67           HZ2      LYS  67  -6.902 -23.152 -17.047
   13    HZ2  LYS  67           HZ3      LYS  67  -7.710 -24.040 -15.846

  No H/Q in entry =          13
  In of MODEL   51
    1    H    MET  68           H        MET  68 -12.624 -18.580 -13.346
    2    HA   MET  68           HA       MET  68 -13.715 -16.126 -12.782
    3    HB2  MET  68           HB2      MET  68 -12.569 -18.188 -10.901
    4    HB3  MET  68           HB3      MET  68 -13.570 -16.830 -10.389
    5    HG2  MET  68           HG2      MET  68 -14.403 -18.927 -12.414
    6    HG3  MET  68           HG3      MET  68 -14.906 -18.899 -10.722
    7    HE2  MET  68           HE1      MET  68 -15.534 -15.557 -10.223
    8    HE1  MET  68           HE2      MET  68 -15.862 -17.166  -9.584
    9    HE3  MET  68           HE3      MET  68 -17.193 -16.174 -10.178

  No H/Q in entry =           9
  In of MODEL   51
    1    H    LYS  69           H        LYS  69 -10.391 -16.611 -13.099
    2    HA   LYS  69           HA       LYS  69  -9.460 -14.931 -11.000
    3    HB2  LYS  69           HB2      LYS  69  -7.953 -15.583 -13.529
    4    HB3  LYS  69           HB3      LYS  69  -7.294 -15.223 -11.932
    5    HG2  LYS  69           HG2      LYS  69  -8.702 -17.706 -12.880
    6    HG3  LYS  69           HG3      LYS  69  -7.188 -17.565 -11.988
    7    HD2  LYS  69           HD2      LYS  69  -8.622 -16.599 -10.071
    8    HD3  LYS  69           HD3      LYS  69 -10.005 -17.252 -10.952
    9    HE2  LYS  69           HE2      LYS  69  -8.504 -19.438 -11.026
   10    HE3  LYS  69           HE3      LYS  69  -7.756 -18.704  -9.608
   11    HZ2  LYS  69           HZ1      LYS  69  -9.965 -20.210  -9.537
   12    HZ1  LYS  69           HZ2      LYS  69 -10.648 -18.657  -9.632
   13    HZ3  LYS  69           HZ3      LYS  69  -9.575 -19.042  -8.370

  No H/Q in entry =          13
  In of MODEL   51
    1    H    VAL  70           H        VAL  70  -7.658 -13.169 -11.863
    2    HA   VAL  70           HA       VAL  70  -9.093 -11.212 -13.562
    3    HB   VAL  70           HB       VAL  70  -8.360  -9.442 -11.994
    4   HG11  VAL  70          HG11      VAL  70 -10.601 -10.625 -11.821
    5   HG13  VAL  70          HG12      VAL  70 -10.047  -9.864 -10.328
    6   HG12  VAL  70          HG13      VAL  70  -9.895 -11.608 -10.539
    7   HG22  VAL  70          HG21      VAL  70  -6.403 -10.507 -10.999
    8   HG21  VAL  70          HG22      VAL  70  -7.398 -11.812 -10.358
    9   HG23  VAL  70          HG23      VAL  70  -7.558 -10.181  -9.709

  No H/Q in entry =           9
  In of MODEL   51
    1    H    SER  71           H        SER  71  -7.610  -9.444 -14.280
    2    HA   SER  71           HA       SER  71  -5.333 -10.458 -15.611
    3    HB2  SER  71           HB2      SER  71  -6.645  -8.425 -16.300
    4    HB3  SER  71           HB3      SER  71  -5.924  -7.566 -14.942
    5    HG   SER  71           HG       SER  71  -4.861  -8.251 -17.365

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LEU  72           H        LEU  72  -3.334 -10.770 -14.945
    2    HA   LEU  72           HA       LEU  72  -2.598 -10.555 -12.237
    3    HB2  LEU  72           HB2      LEU  72  -0.964 -10.987 -14.732
    4    HB3  LEU  72           HB3      LEU  72  -0.284 -11.051 -13.108
    5    HG   LEU  72           HG       LEU  72  -2.635 -12.756 -13.995
    6   HD11  LEU  72          HD11      LEU  72  -0.396 -13.143 -15.218
    7   HD13  LEU  72          HD12      LEU  72  -1.127 -14.537 -14.423
    8   HD12  LEU  72          HD13      LEU  72   0.217 -13.690 -13.657
    9   HD22  LEU  72          HD21      LEU  72  -2.654 -12.750 -11.648
   10   HD21  LEU  72          HD22      LEU  72  -0.908 -12.607 -11.521
   11   HD23  LEU  72          HD23      LEU  72  -1.633 -14.141 -11.995

  No H/Q in entry =          11
  In of MODEL   51
    1    H    VAL  73           H        VAL  73  -1.898  -8.539 -15.022
    2    HA   VAL  73           HA       VAL  73   0.029  -6.840 -13.930
    3    HB   VAL  73           HB       VAL  73  -0.374  -5.422 -15.784
    4   HG12  VAL  73          HG11      VAL  73  -1.225  -8.179 -16.702
    5   HG11  VAL  73          HG12      VAL  73   0.430  -7.789 -16.235
    6   HG13  VAL  73          HG13      VAL  73  -0.313  -6.976 -17.612
    7   HG21  VAL  73          HG21      VAL  73  -3.138  -6.583 -15.615
    8   HG23  VAL  73          HG22      VAL  73  -2.549  -5.994 -17.168
    9   HG22  VAL  73          HG23      VAL  73  -2.645  -4.898 -15.791

  No H/Q in entry =           9
  In of MODEL   51
    1    H    LEU  74           H        LEU  74  -3.366  -6.956 -13.352
    2    HA   LEU  74           HA       LEU  74  -3.980  -4.300 -12.736
    3    HB2  LEU  74           HB2      LEU  74  -5.709  -5.967 -12.901
    4    HB3  LEU  74           HB3      LEU  74  -5.012  -6.888 -11.571
    5    HG   LEU  74           HG       LEU  74  -5.467  -5.007 -10.030
    6   HD12  LEU  74          HD11      LEU  74  -7.074  -3.233 -10.997
    7   HD11  LEU  74          HD12      LEU  74  -6.495  -3.753 -12.578
    8   HD13  LEU  74          HD13      LEU  74  -5.366  -3.075 -11.405
    9   HD23  LEU  74          HD21      LEU  74  -8.034  -5.434 -11.466
   10   HD22  LEU  74          HD22      LEU  74  -7.643  -5.592  -9.768
   11   HD21  LEU  74          HD23      LEU  74  -7.172  -6.853 -10.879

  No H/Q in entry =          11
  In of MODEL   51
    1    H    VAL  75           H        VAL  75  -2.927  -6.886 -10.581
    2    HA   VAL  75           HA       VAL  75  -2.715  -5.335  -8.238
    3    HB   VAL  75           HB       VAL  75  -1.222  -7.829  -9.036
    4   HG12  VAL  75          HG11      VAL  75  -0.766  -7.981  -6.556
    5   HG11  VAL  75          HG12      VAL  75  -1.418  -6.358  -6.384
    6   HG13  VAL  75          HG13      VAL  75   0.044  -6.616  -7.318
    7   HG23  VAL  75          HG21      VAL  75  -3.614  -7.306  -7.235
    8   HG22  VAL  75          HG22      VAL  75  -2.875  -8.881  -7.519
    9   HG21  VAL  75          HG23      VAL  75  -3.688  -8.038  -8.839

  No H/Q in entry =           9
  In of MODEL   51
    1    H    GLU  76           H        GLU  76  -0.321  -6.095 -10.788
    2    HA   GLU  76           HA       GLU  76   1.871  -4.748  -9.643
    3    HB2  GLU  76           HB2      GLU  76   2.061  -6.225 -11.628
    4    HB3  GLU  76           HB3      GLU  76   1.147  -5.064 -12.579
    5    HG2  GLU  76           HG2      GLU  76   3.481  -4.730 -13.086
    6    HG3  GLU  76           HG3      GLU  76   2.972  -3.361 -12.118

  No H/Q in entry =           6
  In of MODEL   51
    1    H    ALA  77           H        ALA  77  -0.673  -3.547 -11.817
    2    HA   ALA  77           HA       ALA  77   0.316  -0.901 -11.999
    3    HB2  ALA  77           HB1      ALA  77  -1.967  -0.329 -12.761
    4    HB3  ALA  77           HB2      ALA  77  -2.529  -1.918 -12.242
    5    HB1  ALA  77           HB3      ALA  77  -1.362  -1.783 -13.556

  No H/Q in entry =           5
  In of MODEL   51
    1    H    GLN  78           H        GLN  78  -1.940  -2.456  -9.775
    2    HA   GLN  78           HA       GLN  78  -2.739  -0.138  -8.370
    3    HB2  GLN  78           HB2      GLN  78  -3.848  -2.398  -8.279
    4    HB3  GLN  78           HB3      GLN  78  -2.506  -2.957  -7.283
    5    HG2  GLN  78           HG2      GLN  78  -3.015  -1.224  -5.616
    6    HG3  GLN  78           HG3      GLN  78  -4.354  -0.653  -6.610
    7   HE21  GLN  78          HE21      GLN  78  -4.844  -1.609  -3.969
    8   HE22  GLN  78          HE22      GLN  78  -5.697  -3.074  -4.075

  No H/Q in entry =           8
  In of MODEL   51
    1    H    LEU  79           H        LEU  79  -0.057  -2.393  -7.934
    2    HA   LEU  79           HA       LEU  79   0.932  -1.495  -5.482
    3    HB2  LEU  79           HB2      LEU  79   1.797  -3.503  -6.555
    4    HB3  LEU  79           HB3      LEU  79   2.435  -2.551  -7.892
    5    HG   LEU  79           HG       LEU  79   3.998  -1.411  -6.397
    6   HD13  LEU  79          HD11      LEU  79   3.005  -1.166  -4.324
    7   HD12  LEU  79          HD12      LEU  79   4.087  -2.515  -3.986
    8   HD11  LEU  79          HD13      LEU  79   2.380  -2.816  -4.306
    9   HD23  LEU  79          HD21      LEU  79   5.216  -3.558  -5.500
   10   HD22  LEU  79          HD22      LEU  79   5.003  -3.359  -7.237
   11   HD21  LEU  79          HD23      LEU  79   3.931  -4.430  -6.339

  No H/Q in entry =          11
  In of MODEL   51
    1    H    HIS  80           H        HIS  80   1.783  -0.377  -8.760
    2    HA   HIS  80           HA       HIS  80   3.593   1.612  -7.848
    3    HB2  HIS  80           HB2      HIS  80   2.291   0.916 -10.423
    4    HB3  HIS  80           HB3      HIS  80   2.884   2.569 -10.256
    5    HD1  HIS  80           HD1      HIS  80   5.283   2.872 -10.791
    6    HD2  HIS  80           HD2      HIS  80   4.475  -1.039  -9.595
    7    HE1  HIS  80           HE1      HIS  80   7.473   1.599 -10.969
    8    HE2  HIS  80           HE2      HIS  80   6.992  -0.789 -10.243

  No H/Q in entry =           8
  In of MODEL   51
    1    H    LEU  81           H        LEU  81   0.184   1.767  -8.809
    2    HA   LEU  81           HA       LEU  81  -0.094   4.559  -8.477
    3    HB2  LEU  81           HB2      LEU  81  -2.104   2.310  -8.387
    4    HB3  LEU  81           HB3      LEU  81  -2.559   4.013  -8.292
    5    HG   LEU  81           HG       LEU  81  -0.876   2.866 -10.537
    6   HD12  LEU  81          HD11      LEU  81  -3.115   3.182 -11.825
    7   HD11  LEU  81          HD12      LEU  81  -3.863   3.112 -10.229
    8   HD13  LEU  81          HD13      LEU  81  -2.920   1.746 -10.821
    9   HD23  LEU  81          HD21      LEU  81  -1.983   5.008 -11.629
   10   HD22  LEU  81          HD22      LEU  81  -0.561   5.181 -10.603
   11   HD21  LEU  81          HD23      LEU  81  -2.163   5.527  -9.954

  No H/Q in entry =          11
  In of MODEL   51
    1    H    MET  82           H        MET  82  -0.736   1.871  -6.225
    2    HA   MET  82           HA       MET  82  -1.780   3.455  -4.132
    3    HB2  MET  82           HB2      MET  82  -0.401   0.771  -4.179
    4    HB3  MET  82           HB3      MET  82  -0.973   1.495  -2.678
    5    HG2  MET  82           HG2      MET  82  -2.718   0.997  -5.110
    6    HG3  MET  82           HG3      MET  82  -2.630  -0.076  -3.715
    7    HE3  MET  82           HE1      MET  82  -4.341   1.569  -0.891
    8    HE2  MET  82           HE2      MET  82  -2.613   1.851  -1.084
    9    HE1  MET  82           HE3      MET  82  -3.300   0.292  -1.535

  No H/Q in entry =           9
  In of MODEL   51
    1    H    THR  83           H        THR  83   1.519   2.377  -4.839
    2    HA   THR  83           HA       THR  83   2.746   3.484  -2.545
    3    HB   THR  83           HB       THR  83   4.834   3.433  -4.029
    4    HG1  THR  83           HG1      THR  83   4.585   2.906  -6.052
    5   HG22  THR  83          HG21      THR  83   4.394   0.774  -4.359
    6   HG21  THR  83          HG22      THR  83   3.110   1.150  -3.212
    7   HG23  THR  83          HG23      THR  83   4.790   1.498  -2.802

  No H/Q in entry =           7
  In of MODEL   51
    1    H    SER  84           H        SER  84   2.355   4.762  -5.843
    2    HA   SER  84           HA       SER  84   3.691   7.206  -5.394
    3    HB2  SER  84           HB2      SER  84   1.613   6.369  -7.403
    4    HB3  SER  84           HB3      SER  84   2.287   7.998  -7.381
    5    HG   SER  84           HG       SER  84   3.664   5.526  -7.680

  No H/Q in entry =           5
  In of MODEL   51
    1    H    MET  85           H        MET  85   0.200   6.441  -5.204
    2    HA   MET  85           HA       MET  85  -0.664   9.050  -4.598
    3    HB2  MET  85           HB2      MET  85  -2.187   7.239  -5.259
    4    HB3  MET  85           HB3      MET  85  -1.887   6.431  -3.722
    5    HG2  MET  85           HG2      MET  85  -2.772   8.388  -2.510
    6    HG3  MET  85           HG3      MET  85  -3.055   9.211  -4.043
    7    HE2  MET  85           HE1      MET  85  -4.601   8.143  -5.991
    8    HE1  MET  85           HE2      MET  85  -5.236   9.398  -4.929
    9    HE3  MET  85           HE3      MET  85  -6.249   8.023  -5.359

  No H/Q in entry =           9
  In of MODEL   51
    1    H    LEU  86           H        LEU  86   0.273   6.389  -2.460
    2    HA   LEU  86           HA       LEU  86  -0.250   7.690  -0.015
    3    HB2  LEU  86           HB2      LEU  86   0.216   5.220  -0.412
    4    HB3  LEU  86           HB3      LEU  86   1.922   5.652  -0.516
    5    HG   LEU  86           HG       LEU  86   1.607   6.812   1.755
    6   HD11  LEU  86          HD11      LEU  86  -1.088   6.042   1.298
    7   HD13  LEU  86          HD12      LEU  86  -0.416   6.790   2.745
    8   HD12  LEU  86          HD13      LEU  86  -0.504   5.034   2.625
    9   HD23  LEU  86          HD21      LEU  86   1.184   3.819   1.878
   10   HD22  LEU  86          HD22      LEU  86   2.190   4.830   2.913
   11   HD21  LEU  86          HD23      LEU  86   2.683   4.506   1.251

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ALA  87           H        ALA  87   2.721   7.400  -1.920
    2    HA   ALA  87           HA       ALA  87   4.434   8.812  -0.204
    3    HB3  ALA  87           HB1      ALA  87   4.516   7.800  -2.912
    4    HB2  ALA  87           HB2      ALA  87   5.856   8.132  -1.818
    5    HB1  ALA  87           HB3      ALA  87   5.235   9.412  -2.858

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ARG  88           H        ARG  88   2.471   9.947  -2.913
    2    HA   ARG  88           HA       ARG  88   3.244  12.637  -2.799
    3    HB2  ARG  88           HB2      ARG  88   1.981  11.485  -4.650
    4    HB3  ARG  88           HB3      ARG  88   0.529  11.627  -3.659
    5    HG2  ARG  88           HG2      ARG  88   1.547  14.207  -3.580
    6    HG3  ARG  88           HG3      ARG  88   1.963  13.694  -5.213
    7    HD2  ARG  88           HD2      ARG  88  -0.182  13.774  -5.899
    8    HD3  ARG  88           HD3      ARG  88  -0.761  12.920  -4.468
    9    HE   ARG  88           HE       ARG  88  -0.954  15.698  -4.883
   10   HH21  ARG  88          HH11      ARG  88  -1.472  17.026  -3.142
   11   HH22  ARG  88          HH12      ARG  88  -1.166  16.488  -1.526
   12   HH11  ARG  88          HH21      ARG  88   0.076  13.434  -2.516
   13   HH12  ARG  88          HH22      ARG  88  -0.308  14.448  -1.172

  No H/Q in entry =          13
  In of MODEL   51
    1    H    GLU  89           H        GLU  89   0.550  10.961  -1.145
    2    HA   GLU  89           HA       GLU  89  -0.551  13.272   0.067
    3    HB2  GLU  89           HB2      GLU  89  -1.669  11.033  -0.014
    4    HB3  GLU  89           HB3      GLU  89  -0.538  10.477   1.220
    5    HG2  GLU  89           HG2      GLU  89  -1.349  12.175   2.785
    6    HG3  GLU  89           HG3      GLU  89  -2.408  12.847   1.547

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LEU  90           H        LEU  90   1.907  10.979   1.226
    2    HA   LEU  90           HA       LEU  90   2.277  12.222   3.755
    3    HB2  LEU  90           HB2      LEU  90   4.040  10.448   2.066
    4    HB3  LEU  90           HB3      LEU  90   4.469  10.963   3.703
    5    HG   LEU  90           HG       LEU  90   1.830   9.619   3.056
    6   HD12  LEU  90          HD11      LEU  90   2.975   7.572   4.056
    7   HD11  LEU  90          HD12      LEU  90   4.496   8.428   3.806
    8   HD13  LEU  90          HD13      LEU  90   3.476   8.022   2.425
    9   HD22  LEU  90          HD21      LEU  90   1.578  10.541   5.180
   10   HD21  LEU  90          HD22      LEU  90   3.298  10.433   5.552
   11   HD23  LEU  90          HD23      LEU  90   2.291   8.986   5.605

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  91           H        ILE  91   3.863  12.605   0.619
    2    HA   ILE  91           HA       ILE  91   5.846  14.434   1.448
    3    HB   ILE  91           HB       ILE  91   4.519  13.947  -1.224
    4   HG12  ILE  91          HG12      ILE  91   7.357  13.456  -0.267
    5   HG13  ILE  91          HG13      ILE  91   6.075  12.260  -0.098
    6   HG22  ILE  91          HG21      ILE  91   6.739  15.292  -1.925
    7   HG21  ILE  91          HG22      ILE  91   6.439  16.092  -0.381
    8   HG23  ILE  91          HG23      ILE  91   5.209  16.123  -1.643
    9   HD13  ILE  91          HD11      ILE  91   5.888  11.938  -2.404
   10   HD12  ILE  91          HD12      ILE  91   7.624  12.179  -2.200
   11   HD11  ILE  91          HD13      ILE  91   6.612  13.504  -2.780

  No H/Q in entry =          11
  In of MODEL   51
    1    H    THR  92           H        THR  92   2.479  14.871   0.460
    2    HA   THR  92           HA       THR  92   2.456  17.695   0.402
    3    HB   THR  92           HB       THR  92   0.290  15.702   1.112
    4    HG1  THR  92           HG1      THR  92   0.583  15.524  -0.975
    5   HG22  THR  92          HG21      THR  92  -1.112  17.866   0.399
    6   HG21  THR  92          HG22      THR  92   0.285  18.689   1.089
    7   HG23  THR  92          HG23      THR  92  -0.652  17.568   2.075

  No H/Q in entry =           7
  In of MODEL   51
    1    H    GLU  93           H        GLU  93   1.920  15.393   3.057
    2    HA   GLU  93           HA       GLU  93   1.402  17.296   5.080
    3    HB2  GLU  93           HB2      GLU  93   2.713  14.569   5.306
    4    HB3  GLU  93           HB3      GLU  93   2.031  15.496   6.644
    5    HG2  GLU  93           HG2      GLU  93   0.404  14.723   4.214
    6    HG3  GLU  93           HG3      GLU  93   0.512  13.699   5.641

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LEU  94           H        LEU  94   4.400  15.811   3.912
    2    HA   LEU  94           HA       LEU  94   6.163  16.954   5.791
    3    HB2  LEU  94           HB2      LEU  94   6.547  15.989   2.957
    4    HB3  LEU  94           HB3      LEU  94   7.883  16.644   3.899
    5    HG   LEU  94           HG       LEU  94   6.147  14.450   5.043
    6   HD11  LEU  94          HD11      LEU  94   8.230  14.222   2.899
    7   HD13  LEU  94          HD12      LEU  94   6.784  13.250   3.168
    8   HD12  LEU  94          HD13      LEU  94   8.215  12.995   4.167
    9   HD23  LEU  94          HD21      LEU  94   8.342  13.909   6.182
   10   HD22  LEU  94          HD22      LEU  94   7.680  15.488   6.603
   11   HD21  LEU  94          HD23      LEU  94   9.012  15.366   5.453

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  95           H        ILE  95   5.007  18.130   2.648
    2    HA   ILE  95           HA       ILE  95   6.582  20.485   2.582
    3    HB   ILE  95           HB       ILE  95   3.930  19.806   1.291
    4   HG12  ILE  95          HG12      ILE  95   6.713  20.140   0.138
    5   HG13  ILE  95          HG13      ILE  95   6.064  18.588   0.656
    6   HG21  ILE  95          HG21      ILE  95   5.682  22.271   1.062
    7   HG23  ILE  95          HG22      ILE  95   3.959  22.206   1.428
    8   HG22  ILE  95          HG23      ILE  95   4.532  21.805  -0.191
    9   HD13  ILE  95          HD11      ILE  95   4.494  18.515  -1.065
   10   HD12  ILE  95          HD12      ILE  95   5.840  19.332  -1.860
   11   HD11  ILE  95          HD13      ILE  95   4.472  20.268  -1.259

  No H/Q in entry =          11
  In of MODEL   51
    1    H    GLU  96           H        GLU  96   3.340  19.837   3.895
    2    HA   GLU  96           HA       GLU  96   2.728  22.484   4.651
    3    HB2  GLU  96           HB2      GLU  96   1.051  20.704   4.671
    4    HB3  GLU  96           HB3      GLU  96   1.919  19.874   5.961
    5    HG2  GLU  96           HG2      GLU  96   0.909  21.158   7.537
    6    HG3  GLU  96           HG3      GLU  96   1.442  22.632   6.738

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LEU  97           H        LEU  97   4.576  19.929   6.264
    2    HA   LEU  97           HA       LEU  97   4.950  21.275   8.734
    3    HB2  LEU  97           HB2      LEU  97   6.475  19.105   7.309
    4    HB3  LEU  97           HB3      LEU  97   7.075  19.788   8.819
    5    HG   LEU  97           HG       LEU  97   4.261  18.699   8.523
    6   HD12  LEU  97          HD11      LEU  97   5.205  16.684   9.729
    7   HD11  LEU  97          HD12      LEU  97   6.815  17.313   9.376
    8   HD13  LEU  97          HD13      LEU  97   5.737  16.858   8.056
    9   HD23  LEU  97          HD21      LEU  97   4.728  18.402  11.085
   10   HD22  LEU  97          HD22      LEU  97   4.348  20.015  10.483
   11   HD21  LEU  97          HD23      LEU  97   6.020  19.572  10.818

  No H/Q in entry =          11
  In of MODEL   51
    1    H    HIS  98           H        HIS  98   6.803  21.290   5.698
    2    HA   HIS  98           HA       HIS  98   8.965  22.865   6.586
    3    HB2  HIS  98           HB2      HIS  98   7.656  22.614   3.867
    4    HB3  HIS  98           HB3      HIS  98   9.099  23.590   4.150
    5    HD1  HIS  98           HD1      HIS  98   7.881  20.022   4.174
    6    HD2  HIS  98           HD2      HIS  98  11.469  22.110   4.581
    7    HE1  HIS  98           HE1      HIS  98   9.732  18.288   4.106
    8    HE2  HIS  98           HE2      HIS  98  11.921  19.540   4.353

  No H/Q in entry =           8
  In of MODEL   51
    1    H    GLU  99           H        GLU  99   5.739  23.708   5.430
    2    HA   GLU  99           HA       GLU  99   6.124  26.522   5.372
    3    HB2  GLU  99           HB2      GLU  99   4.236  25.358   4.251
    4    HB3  GLU  99           HB3      GLU  99   3.548  24.996   5.833
    5    HG2  GLU  99           HG2      GLU  99   3.376  27.388   6.337
    6    HG3  GLU  99           HG3      GLU  99   4.145  27.788   4.804

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LYS 100           H        LYS 100   5.003  24.287   7.898
    2    HA   LYS 100           HA       LYS 100   4.432  26.341   9.797
    3    HB2  LYS 100           HB2      LYS 100   5.002  23.388  10.137
    4    HB3  LYS 100           HB3      LYS 100   4.565  24.461  11.473
    5    HG2  LYS 100           HG2      LYS 100   2.493  25.104  10.237
    6    HG3  LYS 100           HG3      LYS 100   2.910  23.935   8.981
    7    HD2  LYS 100           HD2      LYS 100   2.838  22.113  10.641
    8    HD3  LYS 100           HD3      LYS 100   2.438  23.276  11.908
    9    HE2  LYS 100           HE2      LYS 100   0.379  23.903  10.657
   10    HE3  LYS 100           HE3      LYS 100   0.769  22.684   9.438
   11    HZ1  LYS 100           HZ1      LYS 100   0.518  22.015  12.320
   12    HZ3  LYS 100           HZ2      LYS 100   0.492  20.962  10.984
   13    HZ2  LYS 100           HZ3      LYS 100  -0.819  22.005  11.272

  No H/Q in entry =          13
  In of MODEL   51
    1    H    LEU 101           H        LEU 101   7.346  24.539   8.945
    2    HA   LEU 101           HA       LEU 101   8.959  25.373  11.140
    3    HB2  LEU 101           HB2      LEU 101   9.535  24.387   8.358
    4    HB3  LEU 101           HB3      LEU 101  10.844  25.048   9.333
    5    HG   LEU 101           HG       LEU 101   9.013  22.896  10.405
    6   HD12  LEU 101          HD11      LEU 101  11.059  21.395   9.784
    7   HD11  LEU 101          HD12      LEU 101  11.423  22.659   8.610
    8   HD13  LEU 101          HD13      LEU 101   9.891  21.790   8.524
    9   HD21  LEU 101          HD21      LEU 101  11.744  23.996  11.118
   10   HD23  LEU 101          HD22      LEU 101  11.200  22.424  11.700
   11   HD22  LEU 101          HD23      LEU 101  10.314  23.882  12.144

  No H/Q in entry =          11
  In of MODEL   51
    1    H    LYS 102           H        LYS 102   7.369  27.242   9.010
    2    HA   LYS 102           HA       LYS 102   7.451  29.535   8.720
    3    HB2  LYS 102           HB2      LYS 102   9.027  29.414  10.809
    4    HB3  LYS 102           HB3      LYS 102  10.321  29.606   9.643
    5    HG2  LYS 102           HG2      LYS 102   8.225  31.564  10.518
    6    HG3  LYS 102           HG3      LYS 102   9.937  31.819  10.257
    7    HD2  LYS 102           HD2      LYS 102   7.972  31.404   7.968
    8    HD3  LYS 102           HD3      LYS 102   8.363  32.981   8.635
    9    HE2  LYS 102           HE2      LYS 102   9.721  31.795   6.553
   10    HE3  LYS 102           HE3      LYS 102  10.347  33.099   7.562
   11    HZ2  LYS 102           HZ1      LYS 102  11.861  31.190   7.377
   12    HZ1  LYS 102           HZ2      LYS 102  10.700  30.210   8.125
   13    HZ3  LYS 102           HZ3      LYS 102  11.401  31.494   8.981

  No H/Q in entry =          13
  In of MODEL   51
    1    H    ALA 103           H        ALA 103  10.701  28.187   8.136
    2    HA   ALA 103           HA       ALA 103  11.657  29.563   6.056
    3    HB2  ALA 103           HB1      ALA 103  12.530  27.347   5.121
    4    HB1  ALA 103           HB2      ALA 103  11.640  26.574   6.431
    5    HB3  ALA 103           HB3      ALA 103  12.935  27.714   6.798

  No H/Q in entry =           5
  In of MODEL   51
    1    H1   LYS   3           H1       LYS   3 -31.167   5.961 -19.873
    2    H2   LYS   3           H3       LYS   3 -30.160   5.686 -21.211
    3    H3   LYS   3           H2       LYS   3 -31.546   4.733 -20.982
    4    HA   LYS   3           HA       LYS   3 -30.545   3.354 -19.568
    5    HB2  LYS   3           HB2      LYS   3 -28.263   4.794 -20.869
    6    HB3  LYS   3           HB3      LYS   3 -27.940   3.587 -19.623
    7    HG2  LYS   3           HG2      LYS   3 -29.327   1.987 -20.995
    8    HG3  LYS   3           HG3      LYS   3 -29.280   3.190 -22.283
    9    HD2  LYS   3           HD2      LYS   3 -26.797   3.105 -22.201
   10    HD3  LYS   3           HD3      LYS   3 -26.916   1.804 -21.017
   11    HE2  LYS   3           HE2      LYS   3 -28.380   0.614 -22.755
   12    HE3  LYS   3           HE3      LYS   3 -27.758   1.800 -23.901
   13    HZ3  LYS   3           HZ1      LYS   3 -25.943   0.593 -24.149
   14    HZ2  LYS   3           HZ2      LYS   3 -26.573  -0.584 -23.099
   15    HZ1  LYS   3           HZ3      LYS   3 -25.605   0.670 -22.487

  No H/Q in entry =          15
  In of MODEL   51
    1    H    LYS   4           H        LYS   4 -30.623   3.208 -17.508
    2    HA   LYS   4           HA       LYS   4 -29.938   5.499 -15.845
    3    HB2  LYS   4           HB2      LYS   4 -31.119   2.793 -15.164
    4    HB3  LYS   4           HB3      LYS   4 -30.926   4.132 -14.034
    5    HG2  LYS   4           HG2      LYS   4 -32.704   4.055 -16.478
    6    HG3  LYS   4           HG3      LYS   4 -33.215   4.098 -14.792
    7    HD2  LYS   4           HD2      LYS   4 -32.546   6.327 -14.513
    8    HD3  LYS   4           HD3      LYS   4 -31.488   6.282 -15.923
    9    HE2  LYS   4           HE2      LYS   4 -33.422   7.636 -16.408
   10    HE3  LYS   4           HE3      LYS   4 -33.474   6.165 -17.379
   11    HZ3  LYS   4           HZ1      LYS   4 -35.060   5.234 -15.853
   12    HZ2  LYS   4           HZ2      LYS   4 -35.623   6.725 -16.443
   13    HZ1  LYS   4           HZ3      LYS   4 -34.986   6.617 -14.872

  No H/Q in entry =          13
  In of MODEL   51
    1    H    HIS   5           H        HIS   5 -28.490   5.597 -14.235
    2    HA   HIS   5           HA       HIS   5 -26.186   3.790 -14.541
    3    HB2  HIS   5           HB2      HIS   5 -26.483   6.540 -13.333
    4    HB3  HIS   5           HB3      HIS   5 -24.992   5.599 -13.299
    5    HD1  HIS   5           HD1      HIS   5 -23.513   6.815 -14.868
    6    HD2  HIS   5           HD2      HIS   5 -27.289   6.163 -16.471
    7    HE1  HIS   5           HE1      HIS   5 -23.320   7.401 -17.316
    8    HE2  HIS   5           HE2      HIS   5 -25.623   6.991 -18.261

  No H/Q in entry =           8
  In of MODEL   51
    1    H    ILE   6           H        ILE   6 -25.960   2.218 -13.223
    2    HA   ILE   6           HA       ILE   6 -26.973   2.472 -10.471
    3    HB   ILE   6           HB       ILE   6 -26.107   0.015 -12.002
    4   HG12  ILE   6          HG12      ILE   6 -28.868   0.927 -11.184
    5   HG13  ILE   6          HG13      ILE   6 -28.208   1.097 -12.810
    6   HG23  ILE   6          HG21      ILE   6 -26.493  -1.243 -10.148
    7   HG22  ILE   6          HG22      ILE   6 -27.668  -0.108  -9.481
    8   HG21  ILE   6          HG23      ILE   6 -25.943   0.242  -9.370
    9   HD13  ILE   6          HD11      ILE   6 -28.642  -1.026 -13.318
   10   HD12  ILE   6          HD12      ILE   6 -29.676  -1.020 -11.890
   11   HD11  ILE   6          HD13      ILE   6 -28.019  -1.613 -11.777

  No H/Q in entry =          11
  In of MODEL   51
    1    H    TYR   7           H        TYR   7 -25.235   3.127  -9.162
    2    HA   TYR   7           HA       TYR   7 -22.508   2.193  -9.808
    3    HB2  TYR   7           HB2      TYR   7 -23.509   4.616  -8.336
    4    HB3  TYR   7           HB3      TYR   7 -21.820   4.115  -8.354
    5    HD1  TYR   7           HD1      TYR   7 -22.814   3.169 -11.459
    6    HD2  TYR   7           HD2      TYR   7 -22.201   6.743  -9.219
    7    HE1  TYR   7           HE1      TYR   7 -22.366   4.405 -13.542
    8    HE2  TYR   7           HE2      TYR   7 -21.795   7.984 -11.295
    9    HH   TYR   7           HH       TYR   7 -21.985   7.899 -13.530

  No H/Q in entry =           9
  In of MODEL   51
    1    H    LEU   8           H        LEU   8 -21.548   0.846  -8.469
    2    HA   LEU   8           HA       LEU   8 -22.708   0.338  -5.801
    3    HB2  LEU   8           HB2      LEU   8 -20.970  -1.308  -7.616
    4    HB3  LEU   8           HB3      LEU   8 -21.173  -1.694  -5.907
    5    HG   LEU   8           HG       LEU   8 -23.646  -1.886  -6.361
    6   HD13  LEU   8          HD11      LEU   8 -23.760  -0.668  -8.471
    7   HD12  LEU   8          HD12      LEU   8 -24.274  -2.335  -8.720
    8   HD11  LEU   8          HD13      LEU   8 -22.663  -1.824  -9.223
    9   HD23  LEU   8          HD21      LEU   8 -22.335  -3.914  -8.042
   10   HD22  LEU   8          HD22      LEU   8 -23.438  -4.093  -6.677
   11   HD21  LEU   8          HD23      LEU   8 -21.737  -3.726  -6.394

  No H/Q in entry =          11
  In of MODEL   51
    1    H    PHE   9           H        PHE   9 -21.479   0.757  -4.005
    2    HA   PHE   9           HA       PHE   9 -18.688   1.706  -4.459
    3    HB2  PHE   9           HB2      PHE   9 -20.740   2.779  -2.526
    4    HB3  PHE   9           HB3      PHE   9 -19.041   3.228  -2.522
    5    HD1  PHE   9           HD1      PHE   9 -18.095   4.612  -4.265
    6    HD2  PHE   9           HD2      PHE   9 -22.226   3.459  -4.380
    7    HE1  PHE   9           HE1      PHE   9 -18.509   6.272  -6.055
    8    HE2  PHE   9           HE2      PHE   9 -22.642   5.132  -6.165
    9    HZ   PHE   9           HZ       PHE   9 -20.781   6.534  -7.009

  No H/Q in entry =           9
  In of MODEL   51
    1    H    SER  10           H        SER  10 -17.124   0.798  -3.287
    2    HA   SER  10           HA       SER  10 -17.381  -0.086  -0.600
    3    HB2  SER  10           HB2      SER  10 -18.572  -1.965  -1.708
    4    HB3  SER  10           HB3      SER  10 -17.145  -2.251  -2.691
    5    HG   SER  10           HG       SER  10 -15.998  -2.497  -0.675

  No H/Q in entry =           5
  In of MODEL   51
    1    H    SER  11           H        SER  11 -15.376   0.012   0.277
    2    HA   SER  11           HA       SER  11 -13.177   0.905  -1.205
    3    HB2  SER  11           HB2      SER  11 -13.684   0.973   1.356
    4    HB3  SER  11           HB3      SER  11 -12.788  -0.547   1.375
    5    HG   SER  11           HG       SER  11 -11.084   0.677   1.330

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ALA  12           H        ALA  12 -14.339  -1.771  -2.100
    2    HA   ALA  12           HA       ALA  12 -11.745  -2.986  -2.621
    3    HB2  ALA  12           HB1      ALA  12 -12.177  -4.304  -0.742
    4    HB3  ALA  12           HB2      ALA  12 -12.791  -5.296  -2.065
    5    HB1  ALA  12           HB3      ALA  12 -13.912  -4.371  -1.068

  No H/Q in entry =           5
  In of MODEL   51
    1    H    GLY  13           H        GLY  13 -12.476  -1.974  -4.666
    2    HA3  GLY  13           HA2      GLY  13 -14.704  -2.668  -6.159
    3    HA2  GLY  13           HA3      GLY  13 -13.144  -2.224  -6.865

  No H/Q in entry =           3
  In of MODEL   51
    1    H    MET  14           H        MET  14 -11.662  -4.509  -5.891
    2    HA   MET  14           HA       MET  14 -12.058  -6.270  -8.014
    3    HB2  MET  14           HB2      MET  14  -9.964  -6.295  -6.751
    4    HB3  MET  14           HB3      MET  14 -10.784  -6.978  -5.347
    5    HG2  MET  14           HG2      MET  14 -11.361  -8.987  -6.686
    6    HG3  MET  14           HG3      MET  14 -10.522  -8.295  -8.075
    7    HE2  MET  14           HE1      MET  14  -7.681  -7.006  -6.697
    8    HE1  MET  14           HE2      MET  14  -8.381  -7.575  -8.210
    9    HE3  MET  14           HE3      MET  14  -6.976  -8.396  -7.535

  No H/Q in entry =           9
  In of MODEL   51
    1    H    SER  15           H        SER  15 -13.254  -6.706  -4.684
    2    HA   SER  15           HA       SER  15 -14.531  -9.210  -5.315
    3    HB2  SER  15           HB2      SER  15 -14.977  -7.357  -2.960
    4    HB3  SER  15           HB3      SER  15 -15.804  -8.898  -3.180
    5    HG   SER  15           HG       SER  15 -13.043  -8.938  -3.496

  No H/Q in entry =           5
  In of MODEL   51
    1    H    THR  16           H        THR  16 -15.701  -5.855  -5.057
    2    HA   THR  16           HA       THR  16 -18.465  -6.445  -5.645
    3    HB   THR  16           HB       THR  16 -16.972  -3.842  -6.120
    4    HG1  THR  16           HG1      THR  16 -18.383  -4.099  -3.798
    5   HG21  THR  16          HG21      THR  16 -19.359  -4.202  -6.978
    6   HG23  THR  16          HG22      THR  16 -19.110  -2.808  -5.912
    7   HG22  THR  16          HG23      THR  16 -19.836  -4.296  -5.287

  No H/Q in entry =           7
  In of MODEL   51
    1    H    SER  17           H        SER  17 -15.593  -5.858  -7.449
    2    HA   SER  17           HA       SER  17 -16.693  -5.124  -9.964
    3    HB2  SER  17           HB2      SER  17 -14.062  -6.425  -9.229
    4    HB3  SER  17           HB3      SER  17 -14.485  -5.985 -10.883
    5    HG   SER  17           HG       SER  17 -14.994  -3.895  -9.364

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LEU  18           H        LEU  18 -16.116  -8.265  -8.511
    2    HA   LEU  18           HA       LEU  18 -16.657  -9.768 -10.876
    3    HB2  LEU  18           HB2      LEU  18 -15.458 -10.675  -8.900
    4    HB3  LEU  18           HB3      LEU  18 -16.959 -10.580  -7.980
    5    HG   LEU  18           HG       LEU  18 -18.010 -12.163  -9.541
    6   HD13  LEU  18          HD11      LEU  18 -16.984 -11.953 -11.605
    7   HD12  LEU  18          HD12      LEU  18 -16.193 -13.407 -10.996
    8   HD11  LEU  18          HD13      LEU  18 -15.368 -11.851 -10.907
    9   HD22  LEU  18          HD21      LEU  18 -17.069 -14.057  -8.625
   10   HD21  LEU  18          HD22      LEU  18 -16.638 -12.790  -7.475
   11   HD23  LEU  18          HD23      LEU  18 -15.441 -13.376  -8.631

  No H/Q in entry =          11
  In of MODEL   51
    1    H    LEU  19           H        LEU  19 -18.673  -8.581  -8.191
    2    HA   LEU  19           HA       LEU  19 -21.114  -9.786  -9.059
    3    HB2  LEU  19           HB2      LEU  19 -20.892  -8.957  -6.803
    4    HB3  LEU  19           HB3      LEU  19 -20.599  -7.323  -7.398
    5    HG   LEU  19           HG       LEU  19 -22.910  -7.140  -8.121
    6   HD11  LEU  19          HD11      LEU  19 -23.183  -9.947  -7.033
    7   HD13  LEU  19          HD12      LEU  19 -23.359  -9.455  -8.717
    8   HD12  LEU  19          HD13      LEU  19 -24.529  -8.914  -7.515
    9   HD22  LEU  19          HD21      LEU  19 -23.947  -7.131  -5.913
   10   HD21  LEU  19          HD22      LEU  19 -22.306  -6.489  -5.858
   11   HD23  LEU  19          HD23      LEU  19 -22.632  -8.125  -5.288

  No H/Q in entry =          11
  In of MODEL   51
    1    H    VAL  20           H        VAL  20 -19.638  -6.611  -9.729
    2    HA   VAL  20           HA       VAL  20 -21.737  -5.586 -11.326
    3    HB   VAL  20           HB       VAL  20 -18.752  -4.968 -11.406
    4   HG11  VAL  20          HG11      VAL  20 -21.050  -3.691 -12.903
    5   HG13  VAL  20          HG12      VAL  20 -19.566  -4.368 -13.575
    6   HG12  VAL  20          HG13      VAL  20 -19.509  -2.875 -12.636
    7   HG21  VAL  20          HG21      VAL  20 -21.126  -3.658 -10.124
    8   HG23  VAL  20          HG22      VAL  20 -19.609  -2.805 -10.395
    9   HG22  VAL  20          HG23      VAL  20 -19.643  -4.235  -9.364

  No H/Q in entry =           9
  In of MODEL   51
    1    H    SER  21           H        SER  21 -18.947  -7.611 -12.318
    2    HA   SER  21           HA       SER  21 -19.694  -7.503 -15.079
    3    HB2  SER  21           HB2      SER  21 -18.237  -9.456 -15.395
    4    HB3  SER  21           HB3      SER  21 -17.431  -8.204 -14.451
    5    HG   SER  21           HG       SER  21 -17.353  -9.483 -12.813

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LYS  22           H        LYS  22 -20.776  -9.701 -12.525
    2    HA   LYS  22           HA       LYS  22 -22.275 -11.332 -14.368
    3    HB2  LYS  22           HB2      LYS  22 -22.231 -11.038 -11.387
    4    HB3  LYS  22           HB3      LYS  22 -23.537 -11.927 -12.170
    5    HG2  LYS  22           HG2      LYS  22 -22.092 -13.631 -11.665
    6    HG3  LYS  22           HG3      LYS  22 -21.577 -13.234 -13.303
    7    HD2  LYS  22           HD2      LYS  22 -19.718 -11.945 -12.461
    8    HD3  LYS  22           HD3      LYS  22 -20.274 -12.161 -10.801
    9    HE2  LYS  22           HE2      LYS  22 -18.458 -13.683 -11.167
   10    HE3  LYS  22           HE3      LYS  22 -19.944 -14.629 -11.084
   11    HZ2  LYS  22           HZ1      LYS  22 -18.289 -15.206 -12.886
   12    HZ1  LYS  22           HZ2      LYS  22 -18.786 -13.779 -13.665
   13    HZ3  LYS  22           HZ3      LYS  22 -19.909 -15.018 -13.361

  No H/Q in entry =          13
  In of MODEL   51
    1    H    MET  23           H        MET  23 -23.048  -8.419 -12.507
    2    HA   MET  23           HA       MET  23 -25.847  -8.519 -13.052
    3    HB2  MET  23           HB2      MET  23 -24.027  -6.197 -12.451
    4    HB3  MET  23           HB3      MET  23 -25.772  -6.041 -12.652
    5    HG2  MET  23           HG2      MET  23 -26.180  -7.351 -10.690
    6    HG3  MET  23           HG3      MET  23 -24.468  -7.748 -10.542
    7    HE2  MET  23           HE1      MET  23 -26.810  -4.117  -9.380
    8    HE1  MET  23           HE2      MET  23 -27.037  -5.085 -10.835
    9    HE3  MET  23           HE3      MET  23 -26.012  -3.650 -10.883

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ARG  24           H        ARG  24 -23.080  -7.067 -14.796
    2    HA   ARG  24           HA       ARG  24 -24.560  -5.775 -16.814
    3    HB2  ARG  24           HB2      ARG  24 -22.155  -5.311 -16.441
    4    HB3  ARG  24           HB3      ARG  24 -21.757  -6.932 -16.953
    5    HG2  ARG  24           HG2      ARG  24 -21.292  -5.765 -18.926
    6    HG3  ARG  24           HG3      ARG  24 -23.008  -6.175 -19.198
    7    HD2  ARG  24           HD2      ARG  24 -22.899  -3.829 -19.597
    8    HD3  ARG  24           HD3      ARG  24 -23.531  -3.990 -17.963
    9    HE   ARG  24           HE       ARG  24 -20.945  -3.695 -17.453
   10   HH21  ARG  24          HH11      ARG  24 -20.811  -1.828 -16.207
   11   HH22  ARG  24          HH12      ARG  24 -21.401  -0.331 -16.842
   12   HH11  ARG  24          HH21      ARG  24 -22.915  -1.964 -19.592
   13   HH12  ARG  24          HH22      ARG  24 -22.634  -0.421 -18.849

  No H/Q in entry =          13
  In of MODEL   51
    1    H    ALA  25           H        ALA  25 -23.419  -9.106 -16.528
    2    HA   ALA  25           HA       ALA  25 -24.006  -9.936 -19.175
    3    HB1  ALA  25           HB1      ALA  25 -23.306 -11.965 -18.474
    4    HB3  ALA  25           HB2      ALA  25 -24.383 -11.954 -17.077
    5    HB2  ALA  25           HB3      ALA  25 -22.834 -11.117 -17.001

  No H/Q in entry =           5
  In of MODEL   51
    1    H    GLN  26           H        GLN  26 -25.874  -9.992 -16.177
    2    HA   GLN  26           HA       GLN  26 -28.196 -11.207 -17.229
    3    HB2  GLN  26           HB2      GLN  26 -27.727  -9.462 -14.831
    4    HB3  GLN  26           HB3      GLN  26 -29.280 -10.194 -15.204
    5    HG2  GLN  26           HG2      GLN  26 -26.692 -11.636 -14.702
    6    HG3  GLN  26           HG3      GLN  26 -28.069 -11.544 -13.612
    7   HE21  GLN  26          HE21      GLN  26 -26.821 -13.698 -14.876
    8   HE22  GLN  26          HE22      GLN  26 -27.845 -14.750 -15.689

  No H/Q in entry =           8
  In of MODEL   51
    1    H    ALA  27           H        ALA  27 -27.288  -7.805 -16.816
    2    HA   ALA  27           HA       ALA  27 -29.773  -6.726 -17.633
    3    HB1  ALA  27           HB1      ALA  27 -27.987  -5.402 -16.489
    4    HB3  ALA  27           HB2      ALA  27 -28.561  -4.636 -17.971
    5    HB2  ALA  27           HB3      ALA  27 -27.021  -5.493 -17.963

  No H/Q in entry =           5
  In of MODEL   51
    1    H    GLU  28           H        GLU  28 -27.039  -7.928 -19.467
    2    HA   GLU  28           HA       GLU  28 -27.944  -6.887 -21.996
    3    HB2  GLU  28           HB2      GLU  28 -25.570  -7.558 -21.340
    4    HB3  GLU  28           HB3      GLU  28 -26.102  -9.224 -21.554
    5    HG2  GLU  28           HG2      GLU  28 -24.933  -8.436 -23.504
    6    HG3  GLU  28           HG3      GLU  28 -26.624  -8.768 -23.878

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LYS  29           H        LYS  29 -28.115  -9.998 -20.350
    2    HA   LYS  29           HA       LYS  29 -29.382 -11.470 -22.377
    3    HB2  LYS  29           HB2      LYS  29 -28.354 -12.454 -20.361
    4    HB3  LYS  29           HB3      LYS  29 -29.644 -11.757 -19.382
    5    HG2  LYS  29           HG2      LYS  29 -31.281 -13.136 -20.478
    6    HG3  LYS  29           HG3      LYS  29 -30.063 -13.761 -21.586
    7    HD2  LYS  29           HD2      LYS  29 -28.938 -14.925 -19.841
    8    HD3  LYS  29           HD3      LYS  29 -29.867 -14.093 -18.596
    9    HE2  LYS  29           HE2      LYS  29 -30.600 -16.446 -18.975
   10    HE3  LYS  29           HE3      LYS  29 -31.882 -15.260 -19.233
   11    HZ1  LYS  29           HZ1      LYS  29 -31.283 -15.384 -21.653
   12    HZ3  LYS  29           HZ2      LYS  29 -32.003 -16.777 -21.002
   13    HZ2  LYS  29           HZ3      LYS  29 -30.330 -16.737 -21.276

  No H/Q in entry =          13
  In of MODEL   51
    1    H    TYR  30           H        TYR  30 -30.821  -9.381 -19.887
    2    HA   TYR  30           HA       TYR  30 -33.463  -9.842 -21.167
    3    HB2  TYR  30           HB2      TYR  30 -32.855  -8.693 -18.433
    4    HB3  TYR  30           HB3      TYR  30 -34.461  -8.958 -19.109
    5    HD1  TYR  30           HD1      TYR  30 -35.355 -11.255 -19.343
    6    HD2  TYR  30           HD2      TYR  30 -31.549 -10.515 -17.583
    7    HE1  TYR  30           HE1      TYR  30 -35.263 -13.584 -18.552
    8    HE2  TYR  30           HE2      TYR  30 -31.458 -12.831 -16.796
    9    HH   TYR  30           HH       TYR  30 -33.068 -15.198 -17.919

  No H/Q in entry =           9
  In of MODEL   51
    1    H    GLU  31           H        GLU  31 -31.298  -7.835 -21.930
    2    HA   GLU  31           HA       GLU  31 -31.227  -5.675 -22.746
    3    HB2  GLU  31           HB2      GLU  31 -34.110  -6.407 -23.300
    4    HB3  GLU  31           HB3      GLU  31 -33.267  -5.032 -24.014
    5    HG2  GLU  31           HG2      GLU  31 -31.770  -6.456 -25.190
    6    HG3  GLU  31           HG3      GLU  31 -32.338  -7.877 -24.313

  No H/Q in entry =           6
  In of MODEL   51
    1    H    VAL  32           H        VAL  32 -31.465  -5.584 -20.016
    2    HA   VAL  32           HA       VAL  32 -33.351  -3.485 -19.376
    3    HB   VAL  32           HB       VAL  32 -30.974  -4.467 -17.766
    4   HG12  VAL  32          HG11      VAL  32 -32.541  -3.661 -15.889
    5   HG11  VAL  32          HG12      VAL  32 -33.362  -2.758 -17.162
    6   HG13  VAL  32          HG13      VAL  32 -31.662  -2.444 -16.816
    7   HG21  VAL  32          HG21      VAL  32 -32.719  -6.197 -18.483
    8   HG23  VAL  32          HG22      VAL  32 -33.781  -5.381 -17.336
    9   HG22  VAL  32          HG23      VAL  32 -32.268  -6.095 -16.782

  No H/Q in entry =           9
  In of MODEL   51
    1    HA   PRO  33           HA       PRO  33 -30.316  -0.530 -20.998
    2    HB2  PRO  33           HB2      PRO  33 -31.846   1.682 -20.888
    3    HB3  PRO  33           HB3      PRO  33 -32.288   0.380 -21.993
    4    HG2  PRO  33           HG2      PRO  33 -33.300   0.879 -19.193
    5    HG3  PRO  33           HG3      PRO  33 -34.242   0.668 -20.668
    6    HD2  PRO  33           HD2      PRO  33 -33.794  -1.406 -19.003
    7    HD3  PRO  33           HD3      PRO  33 -33.830  -1.642 -20.751

  No H/Q in entry =           7
  In of MODEL   51
    1    H    VAL  34           H        VAL  34 -29.075  -1.071 -19.034
    2    HA   VAL  34           HA       VAL  34 -28.834   1.351 -17.374
    3    HB   VAL  34           HB       VAL  34 -28.268  -0.113 -15.433
    4   HG12  VAL  34          HG11      VAL  34 -30.678  -1.006 -15.162
    5   HG11  VAL  34          HG12      VAL  34 -30.978  -0.243 -16.722
    6   HG13  VAL  34          HG13      VAL  34 -30.452   0.733 -15.351
    7   HG21  VAL  34          HG21      VAL  34 -28.409  -2.134 -17.451
    8   HG23  VAL  34          HG22      VAL  34 -29.483  -2.507 -16.101
    9   HG22  VAL  34          HG23      VAL  34 -27.770  -2.209 -15.808

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ILE  35           H        ILE  35 -26.872   1.798 -16.505
    2    HA   ILE  35           HA       ILE  35 -24.540   0.492 -17.740
    3    HB   ILE  35           HB       ILE  35 -24.975   3.375 -16.925
    4   HG12  ILE  35          HG12      ILE  35 -23.946   2.086 -19.461
    5   HG13  ILE  35          HG13      ILE  35 -25.585   2.692 -19.222
    6   HG21  ILE  35          HG21      ILE  35 -22.396   1.865 -17.204
    7   HG23  ILE  35          HG22      ILE  35 -22.877   3.036 -15.977
    8   HG22  ILE  35          HG23      ILE  35 -22.476   3.579 -17.607
    9   HD11  ILE  35          HD11      ILE  35 -24.210   4.896 -18.594
   10   HD13  ILE  35          HD12      ILE  35 -24.722   4.515 -20.238
   11   HD12  ILE  35          HD13      ILE  35 -23.074   4.157 -19.721

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ILE  36           H        ILE  36 -23.323  -0.527 -16.127
    2    HA   ILE  36           HA       ILE  36 -23.808   0.074 -13.261
    3    HB   ILE  36           HB       ILE  36 -22.943  -2.618 -14.368
    4   HG12  ILE  36          HG12      ILE  36 -25.768  -1.838 -13.639
    5   HG13  ILE  36          HG13      ILE  36 -25.172  -1.807 -15.300
    6   HG23  ILE  36          HG21      ILE  36 -23.316  -3.457 -12.261
    7   HG22  ILE  36          HG22      ILE  36 -24.460  -2.184 -11.834
    8   HG21  ILE  36          HG23      ILE  36 -22.731  -1.838 -11.880
    9   HD13  ILE  36          HD11      ILE  36 -25.316  -4.021 -15.516
   10   HD12  ILE  36          HD12      ILE  36 -26.403  -3.913 -14.132
   11   HD11  ILE  36          HD13      ILE  36 -24.704  -4.320 -13.890

  No H/Q in entry =          11
  In of MODEL   51
    1    H    GLU  37           H        GLU  37 -22.047   0.714 -12.130
    2    HA   GLU  37           HA       GLU  37 -19.338  -0.056 -13.012
    3    HB2  GLU  37           HB2      GLU  37 -20.270   2.724 -12.314
    4    HB3  GLU  37           HB3      GLU  37 -18.575   2.246 -12.425
    5    HG2  GLU  37           HG2      GLU  37 -18.832   1.800 -14.787
    6    HG3  GLU  37           HG3      GLU  37 -20.545   2.204 -14.693

  No H/Q in entry =           6
  In of MODEL   51
    1    H    ALA  38           H        ALA  38 -17.873  -0.287 -11.310
    2    HA   ALA  38           HA       ALA  38 -18.943  -0.127  -8.553
    3    HB1  ALA  38           HB1      ALA  38 -17.193  -2.046  -9.962
    4    HB3  ALA  38           HB2      ALA  38 -18.260  -2.295  -8.580
    5    HB2  ALA  38           HB3      ALA  38 -16.657  -1.600  -8.342

  No H/Q in entry =           5
  In of MODEL   51
    1    H    PHE  39           H        PHE  39 -17.734   1.089  -7.059
    2    HA   PHE  39           HA       PHE  39 -15.209   2.318  -7.916
    3    HB2  PHE  39           HB2      PHE  39 -17.569   3.823  -6.781
    4    HB3  PHE  39           HB3      PHE  39 -15.947   4.487  -6.967
    5    HD1  PHE  39           HD1      PHE  39 -14.999   4.794  -9.236
    6    HD2  PHE  39           HD2      PHE  39 -19.077   3.735  -8.578
    7    HE1  PHE  39           HE1      PHE  39 -15.549   5.529 -11.538
    8    HE2  PHE  39           HE2      PHE  39 -19.640   4.458 -10.871
    9    HZ   PHE  39           HZ       PHE  39 -17.876   5.327 -12.369

  No H/Q in entry =           9
  In of MODEL   51
    1    HA   PRO  40           HA       PRO  40 -14.322   1.558  -3.620
    2    HB2  PRO  40           HB2      PRO  40 -12.584   3.590  -2.983
    3    HB3  PRO  40           HB3      PRO  40 -12.112   2.266  -4.048
    4    HG2  PRO  40           HG2      PRO  40 -13.152   4.992  -4.801
    5    HG3  PRO  40           HG3      PRO  40 -11.712   4.166  -5.392
    6    HD2  PRO  40           HD2      PRO  40 -13.914   4.061  -6.830
    7    HD3  PRO  40           HD3      PRO  40 -12.945   2.602  -6.628

  No H/Q in entry =           7
  In of MODEL   51
    1    H    GLU  41           H        GLU  41 -14.983   2.522  -1.495
    2    HA   GLU  41           HA       GLU  41 -17.245   4.201  -1.504
    3    HB2  GLU  41           HB2      GLU  41 -17.035   4.206   0.917
    4    HB3  GLU  41           HB3      GLU  41 -16.750   2.583   0.285
    5    HG2  GLU  41           HG2      GLU  41 -15.086   2.709   1.840
    6    HG3  GLU  41           HG3      GLU  41 -14.233   3.307   0.417

  No H/Q in entry =           6
  In of MODEL   51
    1    H    THR  42           H        THR  42 -13.924   5.154  -1.507
    2    HA   THR  42           HA       THR  42 -14.322   7.706  -0.291
    3    HB   THR  42           HB       THR  42 -12.156   8.307  -1.332
    4    HG1  THR  42           HG1      THR  42 -11.230   6.287  -2.445
    5   HG22  THR  42          HG21      THR  42 -12.054   5.471  -0.296
    6   HG21  THR  42          HG22      THR  42 -12.322   6.867   0.750
    7   HG23  THR  42          HG23      THR  42 -10.815   6.717  -0.150

  No H/Q in entry =           7
  In of MODEL   51
    1    H    LEU  43           H        LEU  43 -15.172   6.613  -3.408
    2    HA   LEU  43           HA       LEU  43 -15.442   9.386  -4.372
    3    HB2  LEU  43           HB2      LEU  43 -15.730   6.732  -5.767
    4    HB3  LEU  43           HB3      LEU  43 -15.997   8.299  -6.530
    5    HG   LEU  43           HG       LEU  43 -13.346   7.326  -5.494
    6   HD12  LEU  43          HD11      LEU  43 -14.084   7.675  -8.376
    7   HD11  LEU  43          HD12      LEU  43 -14.435   6.161  -7.543
    8   HD13  LEU  43          HD13      LEU  43 -12.772   6.733  -7.667
    9   HD21  LEU  43          HD21      LEU  43 -14.283   9.799  -6.931
   10   HD23  LEU  43          HD22      LEU  43 -12.606   9.258  -7.021
   11   HD22  LEU  43          HD23      LEU  43 -13.315   9.674  -5.462

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ALA  44           H        ALA  44 -17.393   7.533  -2.551
    2    HA   ALA  44           HA       ALA  44 -19.850   7.369  -3.908
    3    HB2  ALA  44           HB1      ALA  44 -19.728   6.247  -1.813
    4    HB3  ALA  44           HB2      ALA  44 -20.853   7.579  -1.552
    5    HB1  ALA  44           HB3      ALA  44 -19.192   7.704  -0.977

  No H/Q in entry =           5
  In of MODEL   51
    1    H    GLY  45           H        GLY  45 -18.484  10.180  -2.347
    2    HA3  GLY  45           HA2      GLY  45 -20.932  11.653  -2.737
    3    HA2  GLY  45           HA3      GLY  45 -19.403  12.294  -2.137

  No H/Q in entry =           3
  In of MODEL   51
    1    H    GLU  46           H        GLU  46 -17.830  11.382  -4.409
    2    HA   GLU  46           HA       GLU  46 -18.468  13.596  -6.180
    3    HB2  GLU  46           HB2      GLU  46 -16.248  11.545  -6.165
    4    HB3  GLU  46           HB3      GLU  46 -16.380  12.849  -7.346
    5    HG2  GLU  46           HG2      GLU  46 -16.112  14.500  -5.609
    6    HG3  GLU  46           HG3      GLU  46 -16.094  13.241  -4.375

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LYS  47           H        LYS  47 -18.303  10.079  -6.624
    2    HA   LYS  47           HA       LYS  47 -19.367  10.295  -9.314
    3    HB2  LYS  47           HB2      LYS  47 -18.186   8.210  -7.631
    4    HB3  LYS  47           HB3      LYS  47 -19.551   7.645  -8.595
    5    HG2  LYS  47           HG2      LYS  47 -17.538   7.244  -9.808
    6    HG3  LYS  47           HG3      LYS  47 -18.424   8.541 -10.607
    7    HD2  LYS  47           HD2      LYS  47 -17.015  10.188  -9.418
    8    HD3  LYS  47           HD3      LYS  47 -16.087   8.857  -8.731
    9    HE2  LYS  47           HE2      LYS  47 -16.404   9.398 -11.676
   10    HE3  LYS  47           HE3      LYS  47 -15.008   9.864 -10.707
   11    HZ2  LYS  47           HZ1      LYS  47 -15.152   7.591 -12.030
   12    HZ1  LYS  47           HZ2      LYS  47 -15.827   7.082 -10.557
   13    HZ3  LYS  47           HZ3      LYS  47 -14.271   7.763 -10.588

  No H/Q in entry =          13
  In of MODEL   51
    1    H    GLY  48           H        GLY  48 -20.724   9.513  -6.186
    2    HA3  GLY  48           HA2      GLY  48 -23.085   8.304  -6.963
    3    HA2  GLY  48           HA3      GLY  48 -22.890   9.296  -5.518

  No H/Q in entry =           3
  In of MODEL   51
    1    H    GLN  49           H        GLN  49 -22.313  11.730  -7.074
    2    HA   GLN  49           HA       GLN  49 -24.883  12.813  -7.250
    3    HB2  GLN  49           HB2      GLN  49 -22.332  13.710  -8.572
    4    HB3  GLN  49           HB3      GLN  49 -23.805  14.659  -8.505
    5    HG2  GLN  49           HG2      GLN  49 -23.679  14.676  -6.066
    6    HG3  GLN  49           HG3      GLN  49 -22.218  13.707  -6.133
    7   HE21  GLN  49          HE21      GLN  49 -22.143  15.933  -4.852
    8   HE22  GLN  49          HE22      GLN  49 -21.226  17.200  -5.482

  No H/Q in entry =           8
  In of MODEL   51
    1    H    ASN  50           H        ASN  50 -23.150  10.960  -9.619
    2    HA   ASN  50           HA       ASN  50 -25.015  11.818 -11.724
    3    HB2  ASN  50           HB2      ASN  50 -22.415  10.307 -11.927
    4    HB3  ASN  50           HB3      ASN  50 -23.451  10.725 -13.283
    5   HD21  ASN  50          HD21      ASN  50 -20.847  11.595 -11.634
    6   HD22  ASN  50          HD22      ASN  50 -20.627  13.235 -11.969

  No H/Q in entry =           6
  In of MODEL   51
    1    H    ALA  51           H        ALA  51 -25.005   9.455  -9.485
    2    HA   ALA  51           HA       ALA  51 -25.741   7.307 -11.329
    3    HB2  ALA  51           HB1      ALA  51 -25.166   5.959  -9.638
    4    HB3  ALA  51           HB2      ALA  51 -26.312   6.751  -8.558
    5    HB1  ALA  51           HB3      ALA  51 -24.678   7.391  -8.732

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ASP  52           H        ASP  52 -27.737   6.230 -11.219
    2    HA   ASP  52           HA       ASP  52 -29.946   8.038 -10.578
    3    HB2  ASP  52           HB2      ASP  52 -29.707   5.540 -12.253
    4    HB3  ASP  52           HB3      ASP  52 -31.264   6.255 -11.837

  No H/Q in entry =           4
  In of MODEL   51
    1    H    VAL  53           H        VAL  53 -28.329   5.162  -9.549
    2    HA   VAL  53           HA       VAL  53 -29.805   5.268  -7.053
    3    HB   VAL  53           HB       VAL  53 -31.170   3.615  -8.320
    4   HG11  VAL  53          HG11      VAL  53 -29.394   2.777  -9.820
    5   HG13  VAL  53          HG12      VAL  53 -30.226   1.472  -8.977
    6   HG12  VAL  53          HG13      VAL  53 -28.628   1.989  -8.443
    7   HG23  VAL  53          HG21      VAL  53 -30.352   1.641  -6.622
    8   HG22  VAL  53          HG22      VAL  53 -31.499   2.933  -6.268
    9   HG21  VAL  53          HG23      VAL  53 -29.799   3.121  -5.836

  No H/Q in entry =           9
  In of MODEL   51
    1    H    VAL  54           H        VAL  54 -28.510   4.843  -5.381
    2    HA   VAL  54           HA       VAL  54 -25.735   4.022  -5.957
    3    HB   VAL  54           HB       VAL  54 -26.852   5.782  -3.717
    4   HG11  VAL  54          HG11      VAL  54 -24.256   4.389  -3.977
    5   HG13  VAL  54          HG12      VAL  54 -25.035   5.056  -2.543
    6   HG12  VAL  54          HG13      VAL  54 -24.124   6.112  -3.624
    7   HG22  VAL  54          HG21      VAL  54 -25.995   7.608  -4.800
    8   HG21  VAL  54          HG22      VAL  54 -26.515   6.617  -6.162
    9   HG23  VAL  54          HG23      VAL  54 -24.815   6.657  -5.700

  No H/Q in entry =           9
  In of MODEL   51
    1    H    LEU  55           H        LEU  55 -25.132   2.104  -5.313
    2    HA   LEU  55           HA       LEU  55 -26.657   0.772  -3.162
    3    HB2  LEU  55           HB2      LEU  55 -25.058  -0.374  -5.439
    4    HB3  LEU  55           HB3      LEU  55 -25.828  -1.319  -4.163
    5    HG   LEU  55           HG       LEU  55 -27.250   0.261  -6.295
    6   HD13  LEU  55          HD11      LEU  55 -26.918  -1.585  -7.516
    7   HD12  LEU  55          HD12      LEU  55 -27.882  -2.473  -6.336
    8   HD11  LEU  55          HD13      LEU  55 -26.130  -2.392  -6.161
    9   HD23  LEU  55          HD21      LEU  55 -28.552  -1.702  -4.464
   10   HD22  LEU  55          HD22      LEU  55 -29.249  -0.324  -5.316
   11   HD21  LEU  55          HD23      LEU  55 -28.251  -0.063  -3.886

  No H/Q in entry =          11
  In of MODEL   51
    1    H    LEU  56           H        LEU  56 -25.525   0.184  -1.343
    2    HA   LEU  56           HA       LEU  56 -22.594   0.606  -1.351
    3    HB2  LEU  56           HB2      LEU  56 -24.427   0.371   1.022
    4    HB3  LEU  56           HB3      LEU  56 -22.722   0.816   1.036
    5    HG   LEU  56           HG       LEU  56 -25.023   2.477   0.045
    6   HD11  LEU  56          HD11      LEU  56 -23.938   2.097   2.580
    7   HD13  LEU  56          HD12      LEU  56 -24.934   3.458   2.064
    8   HD12  LEU  56          HD13      LEU  56 -23.178   3.579   2.002
    9   HD23  LEU  56          HD21      LEU  56 -23.091   4.193  -0.116
   10   HD22  LEU  56          HD22      LEU  56 -23.446   3.097  -1.452
   11   HD21  LEU  56          HD23      LEU  56 -22.104   2.752  -0.362

  No H/Q in entry =          11
  In of MODEL   51
    1    H    GLY  57           H        GLY  57 -21.206  -1.014  -0.804
    2    HA3  GLY  57           HA2      GLY  57 -22.101  -3.708  -1.020
    3    HA2  GLY  57           HA3      GLY  57 -20.491  -3.200  -0.517

  No H/Q in entry =           3
  In of MODEL   51
    1    HA   PRO  58           HA       PRO  58 -23.340  -4.275   3.151
    2    HB2  PRO  58           HB2      PRO  58 -22.640  -6.876   3.760
    3    HB3  PRO  58           HB3      PRO  58 -24.015  -6.476   2.728
    4    HG2  PRO  58           HG2      PRO  58 -21.269  -7.331   1.977
    5    HG3  PRO  58           HG3      PRO  58 -22.821  -7.802   1.283
    6    HD2  PRO  58           HD2      PRO  58 -21.211  -5.967   0.087
    7    HD3  PRO  58           HD3      PRO  58 -22.969  -5.896  -0.038

  No H/Q in entry =           7
  In of MODEL   51
    1    H    GLN  59           H        GLN  59 -19.957  -4.716   2.588
    2    HA   GLN  59           HA       GLN  59 -19.240  -4.736   5.359
    3    HB2  GLN  59           HB2      GLN  59 -17.495  -3.644   3.166
    4    HB3  GLN  59           HB3      GLN  59 -17.011  -4.388   4.676
    5    HG2  GLN  59           HG2      GLN  59 -16.555  -5.956   2.976
    6    HG3  GLN  59           HG3      GLN  59 -17.991  -6.537   3.803
    7   HE21  GLN  59          HE21      GLN  59 -18.710  -7.524   2.205
    8   HE22  GLN  59          HE22      GLN  59 -19.426  -7.208   0.737

  No H/Q in entry =           8
  In of MODEL   51
    1    H    ILE  60           H        ILE  60 -20.165  -2.186   3.146
    2    HA   ILE  60           HA       ILE  60 -19.359  -0.228   5.208
    3    HB   ILE  60           HB       ILE  60 -19.580   1.505   3.384
    4   HG12  ILE  60          HG12      ILE  60 -19.323  -0.693   1.383
    5   HG13  ILE  60          HG13      ILE  60 -20.930  -0.216   1.930
    6   HG22  ILE  60          HG21      ILE  60 -17.534  -0.482   2.550
    7   HG21  ILE  60          HG22      ILE  60 -17.457   0.260   4.148
    8   HG23  ILE  60          HG23      ILE  60 -17.412   1.271   2.704
    9   HD12  ILE  60          HD11      ILE  60 -18.927   1.350   0.342
   10   HD11  ILE  60          HD12      ILE  60 -20.115   2.200   1.331
   11   HD13  ILE  60          HD13      ILE  60 -20.649   1.116   0.046

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ALA  61           H        ALA  61 -21.801  -1.834   5.240
    2    HA   ALA  61           HA       ALA  61 -24.035  -0.187   4.755
    3    HB1  ALA  61           HB1      ALA  61 -25.255  -1.691   6.060
    4    HB2  ALA  61           HB2      ALA  61 -23.867  -2.071   7.080
    5    HB3  ALA  61           HB3      ALA  61 -23.936  -2.675   5.425

  No H/Q in entry =           5
  In of MODEL   51
    1    H    TYR  62           H        TYR  62 -21.864  -0.289   7.582
    2    HA   TYR  62           HA       TYR  62 -23.456   1.351   9.236
    3    HB2  TYR  62           HB2      TYR  62 -21.427   1.799  10.491
    4    HB3  TYR  62           HB3      TYR  62 -21.482   0.095  10.040
    5    HD1  TYR  62           HD1      TYR  62 -19.867  -0.835   8.447
    6    HD2  TYR  62           HD2      TYR  62 -19.722   3.296   9.529
    7    HE1  TYR  62           HE1      TYR  62 -17.643  -0.644   7.400
    8    HE2  TYR  62           HE2      TYR  62 -17.484   3.483   8.485
    9    HH   TYR  62           HH       TYR  62 -15.662   2.086   7.854

  No H/Q in entry =           9
  In of MODEL   51
    1    H    MET  63           H        MET  63 -21.782   2.231   6.405
    2    HA   MET  63           HA       MET  63 -21.647   5.063   7.109
    3    HB2  MET  63           HB2      MET  63 -20.992   3.549   4.580
    4    HB3  MET  63           HB3      MET  63 -20.821   5.296   4.763
    5    HG2  MET  63           HG2      MET  63 -19.117   4.986   6.440
    6    HG3  MET  63           HG3      MET  63 -19.327   3.238   6.364
    7    HE3  MET  63           HE1      MET  63 -18.722   5.837   2.930
    8    HE2  MET  63           HE2      MET  63 -17.230   6.115   3.829
    9    HE1  MET  63           HE3      MET  63 -18.791   6.345   4.619

  No H/Q in entry =           9
  In of MODEL   51
    1    H    LEU  64           H        LEU  64 -24.183   3.191   6.104
    2    HA   LEU  64           HA       LEU  64 -25.377   4.605   4.014
    3    HB2  LEU  64           HB2      LEU  64 -26.240   2.490   4.915
    4    HB3  LEU  64           HB3      LEU  64 -26.724   3.325   6.390
    5    HG   LEU  64           HG       LEU  64 -28.412   4.570   5.144
    6   HD13  LEU  64          HD11      LEU  64 -28.102   4.820   2.916
    7   HD12  LEU  64          HD12      LEU  64 -28.732   3.180   2.758
    8   HD11  LEU  64          HD13      LEU  64 -26.992   3.452   2.839
    9   HD23  LEU  64          HD21      LEU  64 -28.899   1.756   4.380
   10   HD22  LEU  64          HD22      LEU  64 -29.908   2.880   5.291
   11   HD21  LEU  64          HD23      LEU  64 -28.537   2.094   6.074

  No H/Q in entry =          11
  In of MODEL   51
    1    HA   PRO  65           HA       PRO  65 -27.616   7.736   6.745
    2    HB2  PRO  65           HB2      PRO  65 -25.647   7.902   9.026
    3    HB3  PRO  65           HB3      PRO  65 -27.388   8.171   9.049
    4    HG2  PRO  65           HG2      PRO  65 -26.455   5.920   9.982
    5    HG3  PRO  65           HG3      PRO  65 -27.860   5.880   8.918
    6    HD2  PRO  65           HD2      PRO  65 -24.975   5.288   8.251
    7    HD3  PRO  65           HD3      PRO  65 -26.421   4.392   7.782

  No H/Q in entry =           7
  In of MODEL   51
    1    H    GLU  66           H        GLU  66 -24.062   7.704   6.865
    2    HA   GLU  66           HA       GLU  66 -23.778  10.506   6.472
    3    HB2  GLU  66           HB2      GLU  66 -21.941   8.212   5.837
    4    HB3  GLU  66           HB3      GLU  66 -21.500   9.908   5.640
    5    HG2  GLU  66           HG2      GLU  66 -21.744  10.271   8.006
    6    HG3  GLU  66           HG3      GLU  66 -22.263   8.600   8.226

  No H/Q in entry =           6
  In of MODEL   51
    1    H    ILE  67           H        ILE  67 -23.832   7.766   4.211
    2    HA   ILE  67           HA       ILE  67 -23.396   9.483   1.927
    3    HB   ILE  67           HB       ILE  67 -24.280   6.570   2.088
    4   HG12  ILE  67          HG12      ILE  67 -21.645   7.759   1.203
    5   HG13  ILE  67          HG13      ILE  67 -21.959   7.332   2.885
    6   HG21  ILE  67          HG21      ILE  67 -24.204   8.455  -0.131
    7   HG23  ILE  67          HG22      ILE  67 -24.821   6.803  -0.094
    8   HG22  ILE  67          HG23      ILE  67 -23.110   7.100  -0.398
    9   HD12  ILE  67          HD11      ILE  67 -21.498   5.570   0.535
   10   HD11  ILE  67          HD12      ILE  67 -22.526   4.987   1.843
   11   HD13  ILE  67          HD13      ILE  67 -20.861   5.461   2.175

  No H/Q in entry =          11
  In of MODEL   51
    1    H    GLN  68           H        GLN  68 -26.281   8.409   3.520
    2    HA   GLN  68           HA       GLN  68 -28.090   9.335   1.526
    3    HB2  GLN  68           HB2      GLN  68 -28.383   8.967   4.504
    4    HB3  GLN  68           HB3      GLN  68 -29.692   9.558   3.495
    5    HG2  GLN  68           HG2      GLN  68 -29.694   7.531   2.213
    6    HG3  GLN  68           HG3      GLN  68 -28.252   6.960   3.033
    7   HE21  GLN  68          HE21      GLN  68 -30.421   5.591   2.866
    8   HE22  GLN  68          HE22      GLN  68 -31.266   5.128   4.269

  No H/Q in entry =           8
  In of MODEL   51
    1    H    ARG  69           H        ARG  69 -26.528  11.001   4.288
    2    HA   ARG  69           HA       ARG  69 -27.898  13.479   3.872
    3    HB2  ARG  69           HB2      ARG  69 -25.570  12.554   5.488
    4    HB3  ARG  69           HB3      ARG  69 -25.652  14.275   5.133
    5    HG2  ARG  69           HG2      ARG  69 -27.981  14.305   6.075
    6    HG3  ARG  69           HG3      ARG  69 -27.772  12.614   6.547
    7    HD2  ARG  69           HD2      ARG  69 -26.101  14.973   7.489
    8    HD3  ARG  69           HD3      ARG  69 -27.239  14.059   8.467
    9    HE   ARG  69           HE       ARG  69 -24.611  13.142   7.548
   10   HH21  ARG  69          HH11      ARG  69 -23.810  11.378   8.749
   11   HH22  ARG  69          HH12      ARG  69 -24.850  10.554   9.862
   12   HH11  ARG  69          HH21      ARG  69 -27.587  12.578   9.205
   13   HH12  ARG  69          HH22      ARG  69 -26.988  11.232  10.118

  No H/Q in entry =          13
  In of MODEL   51
    1    H    LEU  70           H        LEU  70 -25.004  12.088   2.544
    2    HA   LEU  70           HA       LEU  70 -23.885  14.460   1.398
    3    HB2  LEU  70           HB2      LEU  70 -22.890  12.144   1.999
    4    HB3  LEU  70           HB3      LEU  70 -23.482  11.681   0.404
    5    HG   LEU  70           HG       LEU  70 -21.880  13.063  -0.657
    6   HD11  LEU  70          HD11      LEU  70 -21.096  13.901   2.143
    7   HD13  LEU  70          HD12      LEU  70 -21.779  14.935   0.890
    8   HD12  LEU  70          HD13      LEU  70 -20.164  14.261   0.689
    9   HD22  LEU  70          HD21      LEU  70 -20.444  11.350  -0.411
   10   HD21  LEU  70          HD22      LEU  70 -21.387  10.821   0.982
   11   HD23  LEU  70          HD23      LEU  70 -20.008  11.897   1.207

  No H/Q in entry =          11
  In of MODEL   51
    1    H    LEU  71           H        LEU  71 -26.016  11.914   0.248
    2    HA   LEU  71           HA       LEU  71 -26.514  13.408  -2.270
    3    HB2  LEU  71           HB2      LEU  71 -26.717  10.422  -1.836
    4    HB3  LEU  71           HB3      LEU  71 -26.828  11.286  -3.368
    5    HG   LEU  71           HG       LEU  71 -24.329  11.300  -1.676
    6   HD12  LEU  71          HD11      LEU  71 -24.347   9.679  -4.113
    7   HD11  LEU  71          HD12      LEU  71 -25.373   9.049  -2.825
    8   HD13  LEU  71          HD13      LEU  71 -23.658   9.332  -2.528
    9   HD22  LEU  71          HD21      LEU  71 -24.417  13.121  -3.165
   10   HD21  LEU  71          HD22      LEU  71 -24.896  12.081  -4.507
   11   HD23  LEU  71          HD23      LEU  71 -23.283  11.936  -3.809

  No H/Q in entry =          11
  In of MODEL   51
    1    HA   PRO  72           HA       PRO  72 -30.411  12.944   0.301
    2    HB2  PRO  72           HB2      PRO  72 -31.271  15.503   0.216
    3    HB3  PRO  72           HB3      PRO  72 -29.975  15.050   1.322
    4    HG2  PRO  72           HG2      PRO  72 -29.757  16.253  -1.425
    5    HG3  PRO  72           HG3      PRO  72 -29.009  16.801   0.076
    6    HD2  PRO  72           HD2      PRO  72 -27.648  15.250  -1.679
    7    HD3  PRO  72           HD3      PRO  72 -27.415  15.078   0.060

  No H/Q in entry =           7
  In of MODEL   51
    1    H    ASN  73           H        ASN  73 -29.749  13.909  -2.903
    2    HA   ASN  73           HA       ASN  73 -32.600  13.600  -3.571
    3    HB2  ASN  73           HB2      ASN  73 -32.109  14.713  -5.660
    4    HB3  ASN  73           HB3      ASN  73 -31.604  15.689  -4.289
    5   HD21  ASN  73          HD21      ASN  73 -30.776  15.743  -6.957
    6   HD22  ASN  73          HD22      ASN  73 -29.105  15.583  -7.128

  No H/Q in entry =           6
  In of MODEL   51
    1    H    LYS  74           H        LYS  74 -30.624  11.344  -3.129
    2    HA   LYS  74           HA       LYS  74 -31.160   9.957  -5.689
    3    HB2  LYS  74           HB2      LYS  74 -28.648   9.660  -4.036
    4    HB3  LYS  74           HB3      LYS  74 -29.012   8.853  -5.562
    5    HG2  LYS  74           HG2      LYS  74 -28.750  11.821  -5.347
    6    HG3  LYS  74           HG3      LYS  74 -27.372  10.759  -5.638
    7    HD2  LYS  74           HD2      LYS  74 -28.465   9.838  -7.598
    8    HD3  LYS  74           HD3      LYS  74 -29.888  10.834  -7.292
    9    HE2  LYS  74           HE2      LYS  74 -28.656  12.842  -7.713
   10    HE3  LYS  74           HE3      LYS  74 -27.135  11.952  -7.788
   11    HZ2  LYS  74           HZ1      LYS  74 -28.578  12.561  -9.930
   12    HZ1  LYS  74           HZ2      LYS  74 -29.239  11.038  -9.570
   13    HZ3  LYS  74           HZ3      LYS  74 -27.570  11.198  -9.846

  No H/Q in entry =          13
  In of MODEL   51
    1    HA   PRO  75           HA       PRO  75 -32.593   6.964  -2.744
    2    HB2  PRO  75           HB2      PRO  75 -32.884   4.750  -4.337
    3    HB3  PRO  75           HB3      PRO  75 -34.008   6.106  -4.417
    4    HG2  PRO  75           HG2      PRO  75 -31.650   5.512  -6.160
    5    HG3  PRO  75           HG3      PRO  75 -33.291   5.952  -6.626
    6    HD2  PRO  75           HD2      PRO  75 -31.349   7.815  -6.553
    7    HD3  PRO  75           HD3      PRO  75 -32.987   8.215  -6.034

  No H/Q in entry =           7
  In of MODEL   51
    1    H    VAL  76           H        VAL  76 -31.158   5.903  -1.356
    2    HA   VAL  76           HA       VAL  76 -28.680   4.695  -2.435
    3    HB   VAL  76           HB       VAL  76 -29.001   6.154   0.222
    4   HG11  VAL  76          HG11      VAL  76 -26.629   4.868  -1.144
    5   HG13  VAL  76          HG12      VAL  76 -27.344   4.414   0.404
    6   HG12  VAL  76          HG13      VAL  76 -26.495   5.950   0.243
    7   HG22  VAL  76          HG21      VAL  76 -28.319   8.057  -0.650
    8   HG21  VAL  76          HG22      VAL  76 -28.843   7.366  -2.187
    9   HG23  VAL  76          HG23      VAL  76 -27.147   7.275  -1.711

  No H/Q in entry =           9
  In of MODEL   51
    1    H    GLU  77           H        GLU  77 -28.474   2.539  -1.826
    2    HA   GLU  77           HA       GLU  77 -29.295   1.745   0.816
    3    HB2  GLU  77           HB2      GLU  77 -30.896   0.100   0.260
    4    HB3  GLU  77           HB3      GLU  77 -31.435   1.626  -0.445
    5    HG2  GLU  77           HG2      GLU  77 -30.798   0.874  -2.627
    6    HG3  GLU  77           HG3      GLU  77 -30.167  -0.626  -1.949

  No H/Q in entry =           6
  In of MODEL   51
    1    H    VAL  78           H        VAL  78 -28.978  -0.344   1.473
    2    HA   VAL  78           HA       VAL  78 -26.301  -1.116   0.618
    3    HB   VAL  78           HB       VAL  78 -28.040  -2.005   2.958
    4   HG11  VAL  78          HG11      VAL  78 -25.687  -3.232   1.860
    5   HG13  VAL  78          HG12      VAL  78 -26.613  -3.707   3.285
    6   HG12  VAL  78          HG13      VAL  78 -25.295  -2.546   3.437
    7   HG22  VAL  78          HG21      VAL  78 -26.597  -0.646   4.319
    8   HG21  VAL  78          HG22      VAL  78 -27.316   0.328   3.037
    9   HG23  VAL  78          HG23      VAL  78 -25.638  -0.201   2.908

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ILE  79           H        ILE  79 -25.753  -3.022  -0.286
    2    HA   ILE  79           HA       ILE  79 -27.798  -4.495  -1.664
    3    HB   ILE  79           HB       ILE  79 -24.810  -5.023  -1.405
    4   HG12  ILE  79          HG12      ILE  79 -26.417  -3.913  -3.712
    5   HG13  ILE  79          HG13      ILE  79 -25.556  -2.906  -2.545
    6   HG22  ILE  79          HG21      ILE  79 -25.883  -6.197  -3.742
    7   HG21  ILE  79          HG22      ILE  79 -26.885  -6.721  -2.389
    8   HG23  ILE  79          HG23      ILE  79 -25.145  -7.000  -2.356
    9   HD13  ILE  79          HD11      ILE  79 -24.120  -3.016  -4.346
   10   HD12  ILE  79          HD12      ILE  79 -24.456  -4.723  -4.635
   11   HD11  ILE  79          HD13      ILE  79 -23.490  -4.239  -3.240

  No H/Q in entry =          11
  In of MODEL   51
    1    H    ASP  80           H        ASP  80 -28.670  -6.419  -1.097
    2    HA   ASP  80           HA       ASP  80 -28.651  -7.325   1.548
    3    HB2  ASP  80           HB2      ASP  80 -30.385  -7.897  -0.115
    4    HB3  ASP  80           HB3      ASP  80 -29.216  -8.902  -0.972

  No H/Q in entry =           4
  In of MODEL   51
    1    H    SER  81           H        SER  81 -27.132  -8.464   2.694
    2    HA   SER  81           HA       SER  81 -24.621  -9.145   1.534
    3    HB2  SER  81           HB2      SER  81 -24.098 -10.179   3.708
    4    HB3  SER  81           HB3      SER  81 -24.800  -8.576   3.916
    5    HG   SER  81           HG       SER  81 -25.860 -11.084   4.475

  No H/Q in entry =           5
  In of MODEL   51
    1    H    LEU  82           H        LEU  82 -27.336 -11.235   1.815
    2    HA   LEU  82           HA       LEU  82 -25.783 -13.604   1.310
    3    HB2  LEU  82           HB2      LEU  82 -28.712 -13.112   0.828
    4    HB3  LEU  82           HB3      LEU  82 -27.911 -14.672   1.001
    5    HG   LEU  82           HG       LEU  82 -28.271 -12.640   3.182
    6   HD12  LEU  82          HD11      LEU  82 -29.547 -15.361   2.879
    7   HD11  LEU  82          HD12      LEU  82 -30.331 -13.874   2.339
    8   HD13  LEU  82          HD13      LEU  82 -29.947 -14.100   4.046
    9   HD21  LEU  82          HD21      LEU  82 -26.977 -15.355   2.996
   10   HD23  LEU  82          HD22      LEU  82 -27.487 -14.658   4.533
   11   HD22  LEU  82          HD23      LEU  82 -26.264 -13.842   3.560

  No H/Q in entry =          11
  In of MODEL   51
    1    H    LEU  83           H        LEU  83 -27.716 -11.372  -0.629
    2    HA   LEU  83           HA       LEU  83 -27.483 -12.725  -3.101
    3    HB2  LEU  83           HB2      LEU  83 -27.900  -9.819  -2.452
    4    HB3  LEU  83           HB3      LEU  83 -27.911 -10.460  -4.094
    5    HG   LEU  83           HG       LEU  83 -29.972 -10.850  -1.945
    6   HD13  LEU  83          HD11      LEU  83 -30.714  -8.999  -3.014
    7   HD12  LEU  83          HD12      LEU  83 -31.160 -10.110  -4.308
    8   HD11  LEU  83          HD13      LEU  83 -29.625  -9.246  -4.378
    9   HD23  LEU  83          HD21      LEU  83 -30.077 -12.103  -4.674
   10   HD22  LEU  83          HD22      LEU  83 -31.066 -12.454  -3.257
   11   HD21  LEU  83          HD23      LEU  83 -29.377 -12.959  -3.301

  No H/Q in entry =          11
  In of MODEL   51
    1    H    TYR  84           H        TYR  84 -25.550 -10.345  -1.394
    2    HA   TYR  84           HA       TYR  84 -23.660  -9.854  -3.499
    3    HB2  TYR  84           HB2      TYR  84 -24.197  -8.364  -1.493
    4    HB3  TYR  84           HB3      TYR  84 -23.212  -9.473  -0.541
    5    HD1  TYR  84           HD1      TYR  84 -20.837  -9.371  -0.596
    6    HD2  TYR  84           HD2      TYR  84 -23.130  -7.048  -3.348
    7    HE1  TYR  84           HE1      TYR  84 -18.786  -8.164  -1.267
    8    HE2  TYR  84           HE2      TYR  84 -21.088  -5.840  -4.036
    9    HH   TYR  84           HH       TYR  84 -18.917  -5.444  -3.492

  No H/Q in entry =           9
  In of MODEL   51
    1    H    GLY  85           H        GLY  85 -23.460 -11.863  -0.555
    2    HA3  GLY  85           HA2      GLY  85 -20.876 -12.807  -1.006
    3    HA2  GLY  85           HA3      GLY  85 -22.120 -13.655  -0.086

  No H/Q in entry =           3
  In of MODEL   51
    1    H    LYS  86           H        LYS  86 -23.941 -14.022  -2.171
    2    HA   LYS  86           HA       LYS  86 -22.872 -16.395  -3.421
    3    HB2  LYS  86           HB2      LYS  86 -25.147 -16.174  -2.466
    4    HB3  LYS  86           HB3      LYS  86 -25.521 -14.972  -3.700
    5    HG2  LYS  86           HG2      LYS  86 -25.333 -16.650  -5.416
    6    HG3  LYS  86           HG3      LYS  86 -24.902 -17.858  -4.205
    7    HD2  LYS  86           HD2      LYS  86 -27.033 -17.452  -3.048
    8    HD3  LYS  86           HD3      LYS  86 -27.464 -16.255  -4.268
    9    HE2  LYS  86           HE2      LYS  86 -28.560 -18.361  -4.754
   10    HE3  LYS  86           HE3      LYS  86 -27.354 -18.014  -5.992
   11    HZ2  LYS  86           HZ1      LYS  86 -27.176 -19.938  -3.750
   12    HZ1  LYS  86           HZ2      LYS  86 -25.791 -19.397  -4.573
   13    HZ3  LYS  86           HZ3      LYS  86 -27.005 -20.237  -5.413

  No H/Q in entry =          13
  In of MODEL   51
    1    H    VAL  87           H        VAL  87 -22.848 -13.178  -4.308
    2    HA   VAL  87           HA       VAL  87 -22.522 -12.001  -6.243
    3    HB   VAL  87           HB       VAL  87 -21.456 -14.472  -7.619
    4   HG11  VAL  87          HG11      VAL  87 -21.529 -12.107  -8.620
    5   HG13  VAL  87          HG12      VAL  87 -19.968 -12.928  -8.657
    6   HG12  VAL  87          HG13      VAL  87 -20.286 -11.690  -7.442
    7   HG22  VAL  87          HG21      VAL  87 -20.427 -14.850  -5.569
    8   HG21  VAL  87          HG22      VAL  87 -20.242 -13.129  -5.236
    9   HG23  VAL  87          HG23      VAL  87 -19.238 -13.902  -6.460

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ASP  88           H        ASP  88 -25.043 -12.642  -5.925
    2    HA   ASP  88           HA       ASP  88 -26.135 -13.853  -8.338
    3    HB2  ASP  88           HB2      ASP  88 -27.159 -14.103  -6.027
    4    HB3  ASP  88           HB3      ASP  88 -27.610 -12.401  -6.129

  No H/Q in entry =           4
  In of MODEL   51
    1    H    GLY  89           H        GLY  89 -25.410 -12.593  -9.969
    2    HA3  GLY  89           HA2      GLY  89 -25.588  -9.820 -10.167
    3    HA2  GLY  89           HA3      GLY  89 -25.548 -10.939 -11.529

  No H/Q in entry =           3
  In of MODEL   51
    1    H    LEU  90           H        LEU  90 -28.000 -12.290 -11.113
    2    HA   LEU  90           HA       LEU  90 -29.796 -10.354 -12.245
    3    HB2  LEU  90           HB2      LEU  90 -29.854 -12.749 -12.831
    4    HB3  LEU  90           HB3      LEU  90 -30.380 -13.118 -11.188
    5    HG   LEU  90           HG       LEU  90 -32.494 -11.999 -11.575
    6   HD13  LEU  90          HD11      LEU  90 -32.297 -10.256 -13.046
    7   HD12  LEU  90          HD12      LEU  90 -32.822 -11.492 -14.191
    8   HD11  LEU  90          HD13      LEU  90 -31.110 -11.097 -14.045
    9   HD23  LEU  90          HD21      LEU  90 -32.395 -13.625 -14.012
   10   HD22  LEU  90          HD22      LEU  90 -33.392 -13.793 -12.568
   11   HD21  LEU  90          HD23      LEU  90 -31.738 -14.405 -12.573

  No H/Q in entry =          11
  In of MODEL   51
    1    H    GLY  91           H        GLY  91 -29.667 -11.860  -9.062
    2    HA3  GLY  91           HA2      GLY  91 -32.018 -10.750  -8.050
    3    HA2  GLY  91           HA3      GLY  91 -30.638 -11.284  -7.091

  No H/Q in entry =           3
  In of MODEL   51
    1    H    VAL  92           H        VAL  92 -28.709  -9.455  -7.920
    2    HA   VAL  92           HA       VAL  92 -29.520  -7.157  -6.378
    3    HB   VAL  92           HB       VAL  92 -26.954  -7.623  -7.943
    4   HG12  VAL  92          HG11      VAL  92 -27.148  -5.741  -5.616
    5   HG11  VAL  92          HG12      VAL  92 -27.793  -5.196  -7.165
    6   HG13  VAL  92          HG13      VAL  92 -26.099  -5.664  -7.033
    7   HG22  VAL  92          HG21      VAL  92 -26.750  -9.213  -6.351
    8   HG21  VAL  92          HG22      VAL  92 -27.909  -8.436  -5.271
    9   HG23  VAL  92          HG23      VAL  92 -26.254  -7.834  -5.371

  No H/Q in entry =           9
  In of MODEL   51
    1    H    LEU  93           H        LEU  93 -29.071  -7.813  -9.794
    2    HA   LEU  93           HA       LEU  93 -29.406  -5.176 -10.724
    3    HB2  LEU  93           HB2      LEU  93 -28.746  -7.028 -12.180
    4    HB3  LEU  93           HB3      LEU  93 -30.340  -7.757 -11.977
    5    HG   LEU  93           HG       LEU  93 -31.338  -5.792 -13.111
    6   HD11  LEU  93          HD11      LEU  93 -29.494  -4.197 -12.582
    7   HD13  LEU  93          HD12      LEU  93 -29.913  -4.225 -14.296
    8   HD12  LEU  93          HD13      LEU  93 -28.468  -5.060 -13.728
    9   HD23  LEU  93          HD21      LEU  93 -30.272  -6.355 -15.387
   10   HD22  LEU  93          HD22      LEU  93 -31.125  -7.614 -14.493
   11   HD21  LEU  93          HD23      LEU  93 -29.360  -7.557 -14.474

  No H/Q in entry =          11
  In of MODEL   51
    1    H    LYS  94           H        LYS  94 -31.791  -7.725  -9.907
    2    HA   LYS  94           HA       LYS  94 -34.128  -6.282 -10.557
    3    HB2  LYS  94           HB2      LYS  94 -33.637  -8.470  -8.542
    4    HB3  LYS  94           HB3      LYS  94 -35.231  -7.774  -8.829
    5    HG2  LYS  94           HG2      LYS  94 -35.117  -8.546 -11.163
    6    HG3  LYS  94           HG3      LYS  94 -33.560  -9.297 -10.817
    7    HD2  LYS  94           HD2      LYS  94 -34.702 -10.635  -9.008
    8    HD3  LYS  94           HD3      LYS  94 -36.238  -9.987  -9.580
    9    HE2  LYS  94           HE2      LYS  94 -35.696 -10.913 -11.842
   10    HE3  LYS  94           HE3      LYS  94 -34.289 -11.696 -11.123
   11    HZ3  LYS  94           HZ1      LYS  94 -36.136 -13.218 -11.317
   12    HZ2  LYS  94           HZ2      LYS  94 -37.122 -12.194 -10.386
   13    HZ1  LYS  94           HZ3      LYS  94 -35.770 -12.943  -9.682

  No H/Q in entry =          13
  In of MODEL   51
    1    H    ALA  95           H        ALA  95 -32.341  -6.407  -7.487
    2    HA   ALA  95           HA       ALA  95 -34.207  -4.831  -6.027
    3    HB2  ALA  95           HB1      ALA  95 -31.838  -6.206  -5.465
    4    HB3  ALA  95           HB2      ALA  95 -32.831  -5.302  -4.321
    5    HB1  ALA  95           HB3      ALA  95 -31.473  -4.513  -5.125

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ALA  96           H        ALA  96 -31.542  -3.973  -8.092
    2    HA   ALA  96           HA       ALA  96 -31.455  -1.213  -7.312
    3    HB2  ALA  96           HB1      ALA  96 -30.068  -0.983  -9.405
    4    HB3  ALA  96           HB2      ALA  96 -30.368  -2.689  -9.730
    5    HB1  ALA  96           HB3      ALA  96 -29.470  -2.212  -8.290

  No H/Q in entry =           5
  In of MODEL   51
    1    H    VAL  97           H        VAL  97 -32.954  -2.921 -10.019
    2    HA   VAL  97           HA       VAL  97 -34.009  -0.619 -11.283
    3    HB   VAL  97           HB       VAL  97 -34.819  -3.545 -11.341
    4   HG11  VAL  97          HG11      VAL  97 -36.604  -1.536 -11.844
    5   HG13  VAL  97          HG12      VAL  97 -36.655  -3.127 -12.604
    6   HG12  VAL  97          HG13      VAL  97 -35.892  -1.777 -13.440
    7   HG21  VAL  97          HG21      VAL  97 -33.515  -1.713 -13.357
    8   HG23  VAL  97          HG22      VAL  97 -33.965  -3.392 -13.655
    9   HG22  VAL  97          HG23      VAL  97 -32.730  -3.009 -12.454

  No H/Q in entry =           9
  In of MODEL   51
    1    H    ALA  98           H        ALA  98 -35.223  -2.802  -8.765
    2    HA   ALA  98           HA       ALA  98 -37.787  -1.651  -8.442
    3    HB1  ALA  98           HB1      ALA  98 -36.788  -3.854  -7.401
    4    HB3  ALA  98           HB2      ALA  98 -37.978  -2.930  -6.483
    5    HB2  ALA  98           HB3      ALA  98 -36.262  -2.783  -6.103

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ALA  99           H        ALA  99 -34.726  -0.860  -6.757
    2    HA   ALA  99           HA       ALA  99 -35.871   1.122  -5.105
    3    HB1  ALA  99           HB1      ALA  99 -33.216   0.229  -5.823
    4    HB2  ALA  99           HB2      ALA  99 -33.783   0.977  -4.329
    5    HB3  ALA  99           HB3      ALA  99 -33.289   1.987  -5.688

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ILE 100           H        ILE 100 -34.792   1.259  -8.447
    2    HA   ILE 100           HA       ILE 100 -34.961   4.108  -8.662
    3    HB   ILE 100           HB       ILE 100 -35.037   1.958 -10.807
    4   HG12  ILE 100          HG12      ILE 100 -32.876   3.944 -10.106
    5   HG13  ILE 100          HG13      ILE 100 -32.923   2.295  -9.480
    6   HG21  ILE 100          HG21      ILE 100 -35.451   4.879 -10.935
    7   HG23  ILE 100          HG22      ILE 100 -35.947   3.614 -12.061
    8   HG22  ILE 100          HG23      ILE 100 -34.292   4.226 -12.094
    9   HD12  ILE 100          HD11      ILE 100 -32.357   3.258 -12.245
   10   HD11  ILE 100          HD12      ILE 100 -33.025   1.644 -12.002
   11   HD13  ILE 100          HD13      ILE 100 -31.485   2.082 -11.263

  No H/Q in entry =          11
  In of MODEL   51
    1    H    LYS 101           H        LYS 101 -37.253   1.506  -9.421
    2    HA   LYS 101           HA       LYS 101 -39.318   3.163 -10.441
    3    HB2  LYS 101           HB2      LYS 101 -39.223   0.385  -9.319
    4    HB3  LYS 101           HB3      LYS 101 -40.769   1.152  -9.681
    5    HG2  LYS 101           HG2      LYS 101 -40.267   1.292 -11.972
    6    HG3  LYS 101           HG3      LYS 101 -38.575   0.881 -11.699
    7    HD2  LYS 101           HD2      LYS 101 -39.819  -1.021 -12.604
    8    HD3  LYS 101           HD3      LYS 101 -39.212  -1.358 -10.983
    9    HE2  LYS 101           HE2      LYS 101 -41.282  -2.049 -10.502
   10    HE3  LYS 101           HE3      LYS 101 -41.735  -0.343 -10.507
   11    HZ3  LYS 101           HZ1      LYS 101 -42.602  -0.492 -12.635
   12    HZ2  LYS 101           HZ2      LYS 101 -43.075  -1.966 -11.937
   13    HZ1  LYS 101           HZ3      LYS 101 -41.756  -1.918 -13.005

  No H/Q in entry =          13
  In of MODEL   51
    1    H    LYS 102           H        LYS 102 -38.868   1.675  -7.230
    2    HA   LYS 102           HA       LYS 102 -41.126   2.873  -6.056
    3    HB2  LYS 102           HB2      LYS 102 -39.906   1.000  -5.032
    4    HB3  LYS 102           HB3      LYS 102 -38.517   2.052  -4.769
    5    HG2  LYS 102           HG2      LYS 102 -39.847   3.445  -3.284
    6    HG3  LYS 102           HG3      LYS 102 -41.241   2.398  -3.549
    7    HD2  LYS 102           HD2      LYS 102 -40.032   0.526  -2.514
    8    HD3  LYS 102           HD3      LYS 102 -38.639   1.574  -2.247
    9    HE2  LYS 102           HE2      LYS 102 -40.006   3.051  -0.850
   10    HE3  LYS 102           HE3      LYS 102 -41.416   2.034  -1.138
   11    HZ1  LYS 102           HZ1      LYS 102 -39.712   0.272  -0.119
   12    HZ3  LYS 102           HZ2      LYS 102 -40.831   1.158   0.800
   13    HZ2  LYS 102           HZ3      LYS 102 -39.218   1.678   0.694

  No H/Q in entry =          13
  In of MODEL   51
    1    H    ALA 103           H        ALA 103 -38.157   4.260  -7.029
    2    HA   ALA 103           HA       ALA 103 -38.395   6.569  -5.242
    3    HB2  ALA 103           HB1      ALA 103 -36.382   7.303  -6.792
    4    HB3  ALA 103           HB2      ALA 103 -36.347   5.586  -7.195
    5    HB1  ALA 103           HB3      ALA 103 -36.138   6.105  -5.523

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ALA 104           H        ALA 104 -38.977   5.851  -8.598
    2    HA   ALA 104           HA       ALA 104 -39.548   8.639  -9.219
    3    HB2  ALA 104           HB1      ALA 104 -39.566   7.977 -11.424
    4    HB1  ALA 104           HB2      ALA 104 -40.301   6.416 -11.059
    5    HB3  ALA 104           HB3      ALA 104 -38.582   6.674 -10.759

  No H/Q in entry =           5
  In of MODEL   51
    1    H    ALA 105           H        ALA 105 -41.183   6.532  -7.441
    2    HA   ALA 105           HA       ALA 105 -43.604   7.932  -7.439
    3    HB2  ALA 105           HB1      ALA 105 -44.326   7.081  -9.489
    4    HB3  ALA 105           HB2      ALA 105 -44.979   5.890  -8.364
    5    HB1  ALA 105           HB3      ALA 105 -43.500   5.541  -9.256

  No H/Q in entry =           5
  In of MODEL   52
    1    H1   ALA   1           H3       ALA   1 -12.086 -16.031  -2.399
    2    H2   ALA   1           H2       ALA   1 -11.132 -17.164  -3.237
    3    H3   ALA   1           H1       ALA   1 -12.286 -16.234  -4.073
    4    HA   ALA   1           HA       ALA   1 -13.665 -17.950  -3.829
    5    HB3  ALA   1           HB1      ALA   1 -12.249 -19.704  -3.363
    6    HB1  ALA   1           HB2      ALA   1 -13.007 -19.597  -1.774
    7    HB2  ALA   1           HB3      ALA   1 -11.439 -18.839  -2.057

  No H/Q in entry =           7
  In of MODEL   52
    1    H    GLU   2           H        GLU   2 -15.279 -18.819  -2.173
    2    HA   GLU   2           HA       GLU   2 -16.946 -17.115  -1.118
    3    HB2  GLU   2           HB2      GLU   2 -15.979 -19.526   0.432
    4    HB3  GLU   2           HB3      GLU   2 -17.513 -18.693   0.684
    5    HG2  GLU   2           HG2      GLU   2 -18.480 -19.795  -1.048
    6    HG3  GLU   2           HG3      GLU   2 -17.162 -19.381  -2.134

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLU   3           H        GLU   3 -15.019 -18.441   1.508
    2    HA   GLU   3           HA       GLU   3 -15.268 -16.086   3.060
    3    HB2  GLU   3           HB2      GLU   3 -13.653 -18.614   3.316
    4    HB3  GLU   3           HB3      GLU   3 -13.437 -17.290   4.460
    5    HG2  GLU   3           HG2      GLU   3 -15.629 -17.464   5.279
    6    HG3  GLU   3           HG3      GLU   3 -16.214 -18.274   3.832

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LEU   4           H        LEU   4 -12.296 -17.535   1.673
    2    HA   LEU   4           HA       LEU   4 -10.483 -15.609   2.267
    3    HB2  LEU   4           HB2      LEU   4 -10.699 -16.915  -0.455
    4    HB3  LEU   4           HB3      LEU   4  -9.255 -16.177   0.229
    5    HG   LEU   4           HG       LEU   4 -10.722 -18.588   1.346
    6   HD13  LEU   4          HD11      LEU   4  -9.074 -19.928   0.420
    7   HD12  LEU   4          HD12      LEU   4  -7.879 -18.631   0.391
    8   HD11  LEU   4          HD13      LEU   4  -9.167 -18.670  -0.812
    9   HD23  LEU   4          HD21      LEU   4  -8.471 -18.623   2.729
   10   HD22  LEU   4          HD22      LEU   4  -9.804 -17.598   3.255
   11   HD21  LEU   4          HD23      LEU   4  -8.449 -16.896   2.372

  No H/Q in entry =          11
  In of MODEL   52
    1    H    GLU   5           H        GLU   5 -12.820 -15.435  -0.408
    2    HA   GLU   5           HA       GLU   5 -11.844 -12.942  -1.414
    3    HB2  GLU   5           HB2      GLU   5 -13.167 -14.538  -2.779
    4    HB3  GLU   5           HB3      GLU   5 -14.571 -14.207  -1.765
    5    HG2  GLU   5           HG2      GLU   5 -14.509 -11.842  -2.401
    6    HG3  GLU   5           HG3      GLU   5 -13.062 -12.127  -3.370

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLU   6           H        GLU   6 -14.560 -13.846   0.679
    2    HA   GLU   6           HA       GLU   6 -15.494 -11.179   1.072
    3    HB2  GLU   6           HB2      GLU   6 -15.885 -13.724   2.663
    4    HB3  GLU   6           HB3      GLU   6 -16.694 -12.204   3.038
    5    HG2  GLU   6           HG2      GLU   6 -17.731 -12.169   0.826
    6    HG3  GLU   6           HG3      GLU   6 -16.865 -13.634   0.371

  No H/Q in entry =           6
  In of MODEL   52
    1    H    VAL   7           H        VAL   7 -13.164 -13.260   2.649
    2    HA   VAL   7           HA       VAL   7 -12.716 -11.675   4.973
    3    HB   VAL   7           HB       VAL   7 -10.989 -13.703   3.529
    4   HG11  VAL   7          HG11      VAL   7 -10.539 -12.159   6.090
    5   HG13  VAL   7          HG12      VAL   7  -9.436 -12.364   4.730
    6   HG12  VAL   7          HG13      VAL   7  -9.775 -13.722   5.803
    7   HG21  VAL   7          HG21      VAL   7 -13.234 -14.289   4.749
    8   HG23  VAL   7          HG22      VAL   7 -12.311 -14.001   6.224
    9   HG22  VAL   7          HG23      VAL   7 -11.803 -15.258   5.098

  No H/Q in entry =           9
  In of MODEL   52
    1    H    VAL   8           H        VAL   8 -11.203 -11.780   1.764
    2    HA   VAL   8           HA       VAL   8  -9.161  -9.883   2.253
    3    HB   VAL   8           HB       VAL   8 -10.588 -10.767  -0.250
    4   HG12  VAL   8          HG11      VAL   8  -8.662  -9.442  -1.389
    5   HG11  VAL   8          HG12      VAL   8  -8.576  -8.550   0.131
    6   HG13  VAL   8          HG13      VAL   8 -10.064  -8.539  -0.813
    7   HG23  VAL   8          HG21      VAL   8  -7.919 -11.297  -0.567
    8   HG22  VAL   8          HG22      VAL   8  -9.050 -12.434   0.160
    9   HG21  VAL   8          HG23      VAL   8  -8.052 -11.412   1.189

  No H/Q in entry =           9
  In of MODEL   52
    1    H    MET   9           H        MET   9 -12.510  -9.533   1.091
    2    HA   MET   9           HA       MET   9 -12.478  -6.757   0.650
    3    HB2  MET   9           HB2      MET   9 -14.640  -8.704   1.406
    4    HB3  MET   9           HB3      MET   9 -14.983  -6.975   1.346
    5    HG2  MET   9           HG2      MET   9 -13.922  -7.017  -0.996
    6    HG3  MET   9           HG3      MET   9 -14.059  -8.772  -0.897
    7    HE2  MET   9           HE1      MET   9 -16.853  -9.494   0.483
    8    HE1  MET   9           HE2      MET   9 -15.879 -10.097  -0.854
    9    HE3  MET   9           HE3      MET   9 -17.575  -9.700  -1.118

  No H/Q in entry =           9
  In of MODEL   52
    1    H    GLY  10           H        GLY  10 -13.120  -8.649   3.582
    2    HA3  GLY  10           HA2      GLY  10 -13.694  -6.467   5.295
    3    HA2  GLY  10           HA3      GLY  10 -13.112  -8.048   5.813

  No H/Q in entry =           3
  In of MODEL   52
    1    H    LEU  11           H        LEU  11 -10.665  -8.147   4.499
    2    HA   LEU  11           HA       LEU  11  -8.982  -6.690   6.253
    3    HB2  LEU  11           HB2      LEU  11  -8.417  -8.113   3.650
    4    HB3  LEU  11           HB3      LEU  11  -7.156  -7.391   4.647
    5    HG   LEU  11           HG       LEU  11  -9.135  -9.445   5.667
    6   HD13  LEU  11          HD11      LEU  11  -7.898 -10.671   4.106
    7   HD12  LEU  11          HD12      LEU  11  -6.961 -10.896   5.583
    8   HD11  LEU  11          HD13      LEU  11  -6.433  -9.727   4.372
    9   HD22  LEU  11          HD21      LEU  11  -8.294  -8.418   7.582
   10   HD21  LEU  11          HD22      LEU  11  -6.761  -8.000   6.819
   11   HD23  LEU  11          HD23      LEU  11  -7.067  -9.659   7.332

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  12           H        ILE  12  -9.888  -6.161   2.862
    2    HA   ILE  12           HA       ILE  12  -8.223  -3.912   2.431
    3    HB   ILE  12           HB       ILE  12 -10.867  -4.620   1.136
    4   HG12  ILE  12          HG12      ILE  12  -8.814  -6.245   1.064
    5   HG13  ILE  12          HG13      ILE  12  -9.672  -5.898  -0.422
    6   HG22  ILE  12          HG21      ILE  12  -9.982  -3.215  -0.752
    7   HG21  ILE  12          HG22      ILE  12  -8.668  -2.697   0.296
    8   HG23  ILE  12          HG23      ILE  12 -10.317  -2.315   0.695
    9   HD11  ILE  12          HD11      ILE  12  -7.176  -4.445   0.494
   10   HD13  ILE  12          HD12      ILE  12  -7.965  -4.315  -1.076
   11   HD12  ILE  12          HD13      ILE  12  -7.169  -5.802  -0.617

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  13           H        ILE  13 -11.581  -4.218   3.523
    2    HA   ILE  13           HA       ILE  13 -12.075  -1.436   3.786
    3    HB   ILE  13           HB       ILE  13 -13.251  -3.872   5.144
    4   HG12  ILE  13          HG12      ILE  13 -13.486  -3.301   2.608
    5   HG13  ILE  13          HG13      ILE  13 -14.898  -3.803   3.513
    6   HG23  ILE  13          HG21      ILE  13 -13.784  -2.226   6.715
    7   HG22  ILE  13          HG22      ILE  13 -15.180  -2.159   5.648
    8   HG21  ILE  13          HG23      ILE  13 -13.905  -0.952   5.505
    9   HD11  ILE  13          HD11      ILE  13 -14.163  -0.897   3.096
   10   HD13  ILE  13          HD12      ILE  13 -15.651  -1.550   3.751
   11   HD12  ILE  13          HD13      ILE  13 -15.281  -1.790   2.059

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ASN  14           H        ASN  14 -10.934  -3.907   6.067
    2    HA   ASN  14           HA       ASN  14 -10.756  -2.261   8.349
    3    HB2  ASN  14           HB2      ASN  14 -10.469  -4.865   8.034
    4    HB3  ASN  14           HB3      ASN  14  -8.766  -4.457   7.877
    5   HD21  ASN  14          HD21      ASN  14  -9.384  -5.984  10.056
    6   HD22  ASN  14          HD22      ASN  14  -9.369  -5.060  11.478

  No H/Q in entry =           6
  In of MODEL   52
    1    H    SER  15           H        SER  15  -8.342  -3.059   5.861
    2    HA   SER  15           HA       SER  15  -6.218  -1.536   6.931
    3    HB2  SER  15           HB2      SER  15  -5.194  -1.743   4.774
    4    HB3  SER  15           HB3      SER  15  -6.130  -3.216   5.002
    5    HG   SER  15           HG       SER  15  -6.454  -1.180   3.204

  No H/Q in entry =           5
  In of MODEL   52
    1    H    GLY  16           H        GLY  16  -8.829  -0.709   4.680
    2    HA3  GLY  16           HA2      GLY  16  -8.006   1.941   4.122
    3    HA2  GLY  16           HA3      GLY  16  -9.649   1.324   3.961

  No H/Q in entry =           3
  In of MODEL   52
    1    H    GLN  17           H        GLN  17 -10.184   0.598   6.612
    2    HA   GLN  17           HA       GLN  17 -10.926   3.096   7.746
    3    HB2  GLN  17           HB2      GLN  17 -12.140   1.012   8.243
    4    HB3  GLN  17           HB3      GLN  17 -10.721   0.385   9.083
    5    HG2  GLN  17           HG2      GLN  17 -10.842   2.192  10.719
    6    HG3  GLN  17           HG3      GLN  17 -12.185   2.928   9.845
    7   HE21  GLN  17          HE21      GLN  17 -12.469   2.126  12.577
    8   HE22  GLN  17          HE22      GLN  17 -13.552   0.820  12.639

  No H/Q in entry =           8
  In of MODEL   52
    1    H    ALA  18           H        ALA  18  -8.266   0.853   8.372
    2    HA   ALA  18           HA       ALA  18  -7.187   2.089  10.641
    3    HB2  ALA  18           HB1      ALA  18  -6.546  -0.121   9.279
    4    HB3  ALA  18           HB2      ALA  18  -5.394   0.681  10.349
    5    HB1  ALA  18           HB3      ALA  18  -5.320   0.956   8.608

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ARG  19           H        ARG  19  -6.421   2.615   7.191
    2    HA   ARG  19           HA       ARG  19  -4.552   4.690   7.616
    3    HB2  ARG  19           HB2      ARG  19  -4.861   3.539   5.423
    4    HB3  ARG  19           HB3      ARG  19  -6.416   4.357   5.243
    5    HG2  ARG  19           HG2      ARG  19  -5.318   6.545   5.307
    6    HG3  ARG  19           HG3      ARG  19  -3.759   5.783   5.614
    7    HD2  ARG  19           HD2      ARG  19  -3.890   6.365   3.269
    8    HD3  ARG  19           HD3      ARG  19  -3.950   4.605   3.419
    9    HE   ARG  19           HE       ARG  19  -6.596   5.475   3.408
   10   HH21  ARG  19          HH11      ARG  19  -7.792   5.609   1.488
   11   HH22  ARG  19          HH12      ARG  19  -6.970   5.695  -0.031
   12   HH11  ARG  19          HH21      ARG  19  -3.821   5.574   1.376
   13   HH12  ARG  19          HH22      ARG  19  -4.720   5.672  -0.095

  No H/Q in entry =          13
  In of MODEL   52
    1    H    SER  20           H        SER  20  -8.051   4.753   7.013
    2    HA   SER  20           HA       SER  20  -8.449   7.503   6.957
    3    HB2  SER  20           HB2      SER  20 -10.305   6.130   6.423
    4    HB3  SER  20           HB3      SER  20 -10.186   5.246   7.942
    5    HG   SER  20           HG       SER  20 -11.193   7.801   7.405

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LEU  21           H        LEU  21  -8.419   5.328   9.767
    2    HA   LEU  21           HA       LEU  21  -8.891   7.322  11.726
    3    HB2  LEU  21           HB2      LEU  21  -7.499   4.642  11.895
    4    HB3  LEU  21           HB3      LEU  21  -7.824   5.658  13.295
    5    HG   LEU  21           HG       LEU  21  -9.975   4.715  11.376
    6   HD11  LEU  21          HD11      LEU  21  -8.933   3.520  13.948
    7   HD13  LEU  21          HD12      LEU  21  -9.146   2.729  12.386
    8   HD12  LEU  21          HD13      LEU  21 -10.556   3.179  13.347
    9   HD21  LEU  21          HD21      LEU  21  -9.931   6.273  13.948
   10   HD23  LEU  21          HD22      LEU  21 -11.312   5.227  13.634
   11   HD22  LEU  21          HD23      LEU  21 -10.929   6.530  12.519

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ALA  22           H        ALA  22  -5.917   5.990  10.325
    2    HA   ALA  22           HA       ALA  22  -4.059   7.336  11.945
    3    HB2  ALA  22           HB1      ALA  22  -3.613   5.484  10.260
    4    HB1  ALA  22           HB2      ALA  22  -2.437   6.799  10.292
    5    HB3  ALA  22           HB3      ALA  22  -3.653   6.733   9.015

  No H/Q in entry =           5
  In of MODEL   52
    1    H    TYR  23           H        TYR  23  -5.388   8.324   8.759
    2    HA   TYR  23           HA       TYR  23  -4.090  10.840   8.683
    3    HB2  TYR  23           HB2      TYR  23  -5.155   9.906   6.693
    4    HB3  TYR  23           HB3      TYR  23  -6.736   9.992   7.471
    5    HD1  TYR  23           HD1      TYR  23  -3.861  12.078   6.327
    6    HD2  TYR  23           HD2      TYR  23  -8.008  11.980   7.436
    7    HE1  TYR  23           HE1      TYR  23  -4.120  14.422   5.560
    8    HE2  TYR  23           HE2      TYR  23  -8.268  14.325   6.668
    9    HH   TYR  23           HH       TYR  23  -5.554  16.079   5.174

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ALA  24           H        ALA  24  -7.196   9.819  10.062
    2    HA   ALA  24           HA       ALA  24  -8.073  12.398  10.825
    3    HB1  ALA  24           HB1      ALA  24  -9.873  11.120  11.294
    4    HB2  ALA  24           HB2      ALA  24  -9.040  10.565  12.744
    5    HB3  ALA  24           HB3      ALA  24  -8.899   9.651  11.243

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ALA  25           H        ALA  25  -6.035   9.975  12.408
    2    HA   ALA  25           HA       ALA  25  -5.720  11.239  14.907
    3    HB2  ALA  25           HB1      ALA  25  -4.916   8.897  14.093
    4    HB3  ALA  25           HB2      ALA  25  -3.915   9.774  15.253
    5    HB1  ALA  25           HB3      ALA  25  -3.477   9.759  13.544

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LEU  26           H        LEU  26  -3.930  11.557  11.868
    2    HA   LEU  26           HA       LEU  26  -2.001  13.410  12.781
    3    HB2  LEU  26           HB2      LEU  26  -1.679  12.257  10.681
    4    HB3  LEU  26           HB3      LEU  26  -3.163  12.940  10.022
    5    HG   LEU  26           HG       LEU  26  -2.183  15.206  10.153
    6   HD12  LEU  26          HD11      LEU  26   0.355  15.266  10.569
    7   HD11  LEU  26          HD12      LEU  26   0.155  13.684  11.318
    8   HD13  LEU  26          HD13      LEU  26  -0.675  15.088  11.989
    9   HD21  LEU  26          HD21      LEU  26  -0.407  13.175   8.765
   10   HD23  LEU  26          HD22      LEU  26  -0.476  14.894   8.390
   11   HD22  LEU  26          HD23      LEU  26  -1.883  13.874   8.103

  No H/Q in entry =          11
  In of MODEL   52
    1    H    LYS  27           H        LYS  27  -5.188  13.840  11.299
    2    HA   LYS  27           HA       LYS  27  -5.175  16.628  11.093
    3    HB2  LYS  27           HB2      LYS  27  -6.895  15.122  10.109
    4    HB3  LYS  27           HB3      LYS  27  -7.550  14.860  11.726
    5    HG2  LYS  27           HG2      LYS  27  -8.016  17.260  11.954
    6    HG3  LYS  27           HG3      LYS  27  -7.310  17.564  10.364
    7    HD2  LYS  27           HD2      LYS  27  -9.020  16.101   9.329
    8    HD3  LYS  27           HD3      LYS  27  -9.732  15.815  10.919
    9    HE2  LYS  27           HE2      LYS  27 -10.211  18.219  11.155
   10    HE3  LYS  27           HE3      LYS  27  -9.471  18.528   9.580
   11    HZ3  LYS  27           HZ1      LYS  27 -11.846  18.367   9.336
   12    HZ2  LYS  27           HZ2      LYS  27 -11.873  16.852  10.110
   13    HZ1  LYS  27           HZ3      LYS  27 -11.128  17.022   8.589

  No H/Q in entry =          13
  In of MODEL   52
    1    H    GLN  28           H        GLN  28  -6.036  14.537  13.825
    2    HA   GLN  28           HA       GLN  28  -6.962  16.532  15.595
    3    HB2  GLN  28           HB2      GLN  28  -5.520  13.926  16.150
    4    HB3  GLN  28           HB3      GLN  28  -6.285  14.921  17.389
    5    HG2  GLN  28           HG2      GLN  28  -7.725  13.796  14.972
    6    HG3  GLN  28           HG3      GLN  28  -7.754  13.065  16.575
    7   HE21  GLN  28          HE21      GLN  28  -8.102  15.194  18.285
    8   HE22  GLN  28          HE22      GLN  28  -9.534  16.029  17.920

  No H/Q in entry =           8
  In of MODEL   52
    1    H    ALA  29           H        ALA  29  -3.724  15.280  14.912
    2    HA   ALA  29           HA       ALA  29  -2.308  16.703  16.888
    3    HB1  ALA  29           HB1      ALA  29  -0.367  16.036  15.773
    4    HB3  ALA  29           HB2      ALA  29  -1.121  16.145  14.182
    5    HB2  ALA  29           HB3      ALA  29  -1.526  14.810  15.260

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LYS  30           H        LYS  30  -3.174  17.562  13.555
    2    HA   LYS  30           HA       LYS  30  -1.795  20.019  13.449
    3    HB2  LYS  30           HB2      LYS  30  -4.314  19.110  12.041
    4    HB3  LYS  30           HB3      LYS  30  -3.499  20.634  11.694
    5    HG2  LYS  30           HG2      LYS  30  -1.413  19.365  11.185
    6    HG3  LYS  30           HG3      LYS  30  -2.301  17.859  11.433
    7    HD2  LYS  30           HD2      LYS  30  -3.871  18.476   9.636
    8    HD3  LYS  30           HD3      LYS  30  -3.006  19.994   9.390
    9    HE2  LYS  30           HE2      LYS  30  -0.958  18.724   8.815
   10    HE3  LYS  30           HE3      LYS  30  -1.842  17.211   9.030
   11    HZ2  LYS  30           HZ1      LYS  30  -1.674  18.078   6.686
   12    HZ1  LYS  30           HZ2      LYS  30  -2.733  19.329   7.150
   13    HZ3  LYS  30           HZ3      LYS  30  -3.238  17.706   7.225

  No H/Q in entry =          13
  In of MODEL   52
    1    H    GLN  31           H        GLN  31  -4.887  19.135  14.862
    2    HA   GLN  31           HA       GLN  31  -5.682  21.884  15.306
    3    HB2  GLN  31           HB2      GLN  31  -6.835  19.428  16.634
    4    HB3  GLN  31           HB3      GLN  31  -7.612  20.990  16.384
    5    HG2  GLN  31           HG2      GLN  31  -6.891  20.214  13.797
    6    HG3  GLN  31           HG3      GLN  31  -7.399  18.706  14.547
    7   HE21  GLN  31          HE21      GLN  31  -8.825  20.259  12.440
    8   HE22  GLN  31          HE22      GLN  31 -10.344  20.636  13.096

  No H/Q in entry =           8
  In of MODEL   52
    1    H    GLY  32           H        GLY  32  -3.349  19.985  16.632
    2    HA3  GLY  32           HA2      GLY  32  -1.955  20.467  18.434
    3    HA2  GLY  32           HA3      GLY  32  -3.098  21.698  18.954

  No H/Q in entry =           3
  In of MODEL   52
    1    H    ASP  33           H        ASP  33  -4.487  18.642  18.299
    2    HA   ASP  33           HA       ASP  33  -4.895  18.187  21.180
    3    HB2  ASP  33           HB2      ASP  33  -6.289  17.155  18.703
    4    HB3  ASP  33           HB3      ASP  33  -6.629  16.545  20.321

  No H/Q in entry =           4
  In of MODEL   52
    1    H    PHE  34           H        PHE  34  -2.718  17.360  21.488
    2    HA   PHE  34           HA       PHE  34  -1.693  15.118  20.093
    3    HB2  PHE  34           HB2      PHE  34  -1.088  16.115  22.885
    4    HB3  PHE  34           HB3      PHE  34  -0.146  14.900  22.021
    5    HD1  PHE  34           HD1      PHE  34  -0.355  18.326  22.749
    6    HD2  PHE  34           HD2      PHE  34   0.506  15.624  19.520
    7    HE1  PHE  34           HE1      PHE  34   0.923  20.108  21.591
    8    HE2  PHE  34           HE2      PHE  34   1.778  17.410  18.368
    9    HZ   PHE  34           HZ       PHE  34   1.989  19.649  19.408

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ALA  35           H        ALA  35  -3.737  15.380  22.954
    2    HA   ALA  35           HA       ALA  35  -3.497  12.722  23.856
    3    HB3  ALA  35           HB1      ALA  35  -5.962  13.324  24.711
    4    HB1  ALA  35           HB2      ALA  35  -5.446  14.947  24.252
    5    HB2  ALA  35           HB3      ALA  35  -4.523  14.036  25.446

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ALA  36           H        ALA  36  -5.962  14.209  21.752
    2    HA   ALA  36           HA       ALA  36  -7.352  11.782  21.279
    3    HB1  ALA  36           HB1      ALA  36  -8.822  13.187  20.319
    4    HB3  ALA  36           HB2      ALA  36  -7.653  13.617  19.070
    5    HB2  ALA  36           HB3      ALA  36  -7.688  14.507  20.592

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ALA  37           H        ALA  37  -4.687  13.393  19.608
    2    HA   ALA  37           HA       ALA  37  -4.634  11.754  17.315
    3    HB3  ALA  37           HB1      ALA  37  -2.660  13.489  18.735
    4    HB2  ALA  37           HB2      ALA  37  -3.190  13.536  17.054
    5    HB1  ALA  37           HB3      ALA  37  -2.024  12.319  17.579

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LYS  38           H        LYS  38  -2.876  11.472  20.394
    2    HA   LYS  38           HA       LYS  38  -1.524   9.086  19.911
    3    HB2  LYS  38           HB2      LYS  38  -1.867  10.849  22.052
    4    HB3  LYS  38           HB3      LYS  38  -2.471   9.314  22.672
    5    HG2  LYS  38           HG2      LYS  38  -0.364   8.215  22.139
    6    HG3  LYS  38           HG3      LYS  38   0.230   9.665  21.322
    7    HD2  LYS  38           HD2      LYS  38   0.385  10.889  23.355
    8    HD3  LYS  38           HD3      LYS  38  -0.623   9.730  24.224
    9    HE2  LYS  38           HE2      LYS  38   1.735   9.440  24.845
   10    HE3  LYS  38           HE3      LYS  38   1.147   8.016  23.983
   11    HZ3  LYS  38           HZ1      LYS  38   2.443   8.445  22.202
   12    HZ2  LYS  38           HZ2      LYS  38   3.389   9.285  23.337
   13    HZ1  LYS  38           HZ3      LYS  38   2.301  10.132  22.344

  No H/Q in entry =          13
  In of MODEL   52
    1    H    ALA  39           H        ALA  39  -4.769   9.549  21.311
    2    HA   ALA  39           HA       ALA  39  -5.301   6.825  21.820
    3    HB3  ALA  39           HB1      ALA  39  -7.480   8.745  21.048
    4    HB2  ALA  39           HB2      ALA  39  -6.585   8.985  22.549
    5    HB1  ALA  39           HB3      ALA  39  -7.486   7.491  22.288

  No H/Q in entry =           5
  In of MODEL   52
    1    H    MET  40           H        MET  40  -5.906   8.826  18.969
    2    HA   MET  40           HA       MET  40  -7.360   6.876  17.512
    3    HB2  MET  40           HB2      MET  40  -5.775   9.286  16.603
    4    HB3  MET  40           HB3      MET  40  -6.791   8.314  15.535
    5    HG2  MET  40           HG2      MET  40  -7.840   9.557  18.090
    6    HG3  MET  40           HG3      MET  40  -7.905  10.388  16.538
    7    HE3  MET  40           HE1      MET  40 -10.470   8.737  14.475
    8    HE2  MET  40           HE2      MET  40  -8.719   8.872  14.328
    9    HE1  MET  40           HE3      MET  40  -9.651  10.229  14.958

  No H/Q in entry =           9
  In of MODEL   52
    1    H    MET  41           H        MET  41  -3.877   7.651  17.635
    2    HA   MET  41           HA       MET  41  -3.099   5.901  15.539
    3    HB2  MET  41           HB2      MET  41  -1.491   6.590  18.011
    4    HB3  MET  41           HB3      MET  41  -0.866   5.945  16.497
    5    HG2  MET  41           HG2      MET  41  -2.045   8.113  15.488
    6    HG3  MET  41           HG3      MET  41  -1.817   8.707  17.132
    7    HE2  MET  41           HE1      MET  41   1.124   6.642  17.499
    8    HE1  MET  41           HE2      MET  41   0.321   7.929  18.394
    9    HE3  MET  41           HE3      MET  41   1.942   8.189  17.752

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ASP  42           H        ASP  42  -3.480   5.430  19.026
    2    HA   ASP  42           HA       ASP  42  -2.416   2.848  19.192
    3    HB2  ASP  42           HB2      ASP  42  -3.310   4.602  21.010
    4    HB3  ASP  42           HB3      ASP  42  -4.726   3.560  20.939

  No H/Q in entry =           4
  In of MODEL   52
    1    H    GLN  43           H        GLN  43  -5.761   3.914  18.687
    2    HA   GLN  43           HA       GLN  43  -6.875   1.313  18.496
    3    HB2  GLN  43           HB2      GLN  43  -7.828   3.952  17.362
    4    HB3  GLN  43           HB3      GLN  43  -8.774   2.462  17.342
    5    HG2  GLN  43           HG2      GLN  43  -8.481   2.349  19.850
    6    HG3  GLN  43           HG3      GLN  43  -7.774   3.962  19.776
    7   HE21  GLN  43          HE21      GLN  43  -9.956   4.021  21.274
    8   HE22  GLN  43          HE22      GLN  43 -11.322   4.579  20.441

  No H/Q in entry =           8
  In of MODEL   52
    1    H    SER  44           H        SER  44  -5.558   3.537  16.081
    2    HA   SER  44           HA       SER  44  -6.241   2.041  13.794
    3    HB2  SER  44           HB2      SER  44  -5.012   4.439  14.234
    4    HB3  SER  44           HB3      SER  44  -3.646   3.458  13.707
    5    HG   SER  44           HG       SER  44  -4.768   4.414  11.941

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ARG  45           H        ARG  45  -3.364   1.964  15.877
    2    HA   ARG  45           HA       ARG  45  -1.861   0.024  14.500
    3    HB2  ARG  45           HB2      ARG  45  -1.037   1.459  16.366
    4    HB3  ARG  45           HB3      ARG  45  -2.018   0.519  17.488
    5    HG2  ARG  45           HG2      ARG  45  -0.763  -1.527  16.850
    6    HG3  ARG  45           HG3      ARG  45   0.243  -0.562  15.771
    7    HD2  ARG  45           HD2      ARG  45   0.960   0.830  17.724
    8    HD3  ARG  45           HD3      ARG  45   0.049  -0.253  18.799
    9    HE   ARG  45           HE       ARG  45   1.767  -1.832  17.223
   10   HH21  ARG  45          HH11      ARG  45   3.676  -2.632  18.064
   11   HH22  ARG  45          HH12      ARG  45   4.439  -1.835  19.394
   12   HH11  ARG  45          HH21      ARG  45   2.041   0.642  19.609
   13   HH12  ARG  45          HH22      ARG  45   3.513   0.021  20.266

  No H/Q in entry =          13
  In of MODEL   52
    1    H    MET  46           H        MET  46  -4.257  -0.318  17.098
    2    HA   MET  46           HA       MET  46  -4.058  -3.115  17.411
    3    HB2  MET  46           HB2      MET  46  -6.263  -1.142  17.997
    4    HB3  MET  46           HB3      MET  46  -6.427  -2.861  18.361
    5    HG2  MET  46           HG2      MET  46  -4.396  -2.775  19.747
    6    HG3  MET  46           HG3      MET  46  -4.199  -1.069  19.373
    7    HE3  MET  46           HE1      MET  46  -4.997  -1.410  23.043
    8    HE2  MET  46           HE2      MET  46  -4.782   0.125  22.207
    9    HE1  MET  46           HE3      MET  46  -3.799  -1.263  21.751

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ALA  47           H        ALA  47  -6.098  -1.124  15.311
    2    HA   ALA  47           HA       ALA  47  -7.692  -3.194  14.247
    3    HB3  ALA  47           HB1      ALA  47  -8.396  -0.965  13.826
    4    HB1  ALA  47           HB2      ALA  47  -7.899  -1.596  12.256
    5    HB2  ALA  47           HB3      ALA  47  -6.831  -0.514  13.152

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LEU  48           H        LEU  48  -4.587  -1.854  13.197
    2    HA   LEU  48           HA       LEU  48  -4.287  -3.446  10.859
    3    HB2  LEU  48           HB2      LEU  48  -2.245  -2.143  12.667
    4    HB3  LEU  48           HB3      LEU  48  -1.867  -2.862  11.101
    5    HG   LEU  48           HG       LEU  48  -3.913  -0.665  11.485
    6   HD13  LEU  48          HD11      LEU  48  -1.801   0.234  12.151
    7   HD12  LEU  48          HD12      LEU  48  -2.080   0.782  10.498
    8   HD11  LEU  48          HD13      LEU  48  -0.969  -0.553  10.810
    9   HD22  LEU  48          HD21      LEU  48  -4.372  -1.658   9.410
   10   HD21  LEU  48          HD22      LEU  48  -2.685  -2.076   9.118
   11   HD23  LEU  48          HD23      LEU  48  -3.221  -0.403   8.955

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ASN  49           H        ASN  49  -3.241  -3.826  14.206
    2    HA   ASN  49           HA       ASN  49  -1.616  -6.074  13.882
    3    HB2  ASN  49           HB2      ASN  49  -1.671  -4.724  15.927
    4    HB3  ASN  49           HB3      ASN  49  -3.315  -5.253  16.254
    5   HD21  ASN  49          HD21      ASN  49  -2.672  -6.257  18.275
    6   HD22  ASN  49          HD22      ASN  49  -1.773  -7.697  18.298

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLU  50           H        GLU  50  -5.088  -5.831  14.549
    2    HA   GLU  50           HA       GLU  50  -5.574  -8.635  14.661
    3    HB2  GLU  50           HB2      GLU  50  -7.176  -6.961  15.533
    4    HB3  GLU  50           HB3      GLU  50  -7.473  -6.402  13.885
    5    HG2  GLU  50           HG2      GLU  50  -8.317  -8.607  13.250
    6    HG3  GLU  50           HG3      GLU  50  -7.932  -9.245  14.845

  No H/Q in entry =           6
  In of MODEL   52
    1    H    ALA  51           H        ALA  51  -5.661  -6.242  12.062
    2    HA   ALA  51           HA       ALA  51  -6.628  -7.981  10.041
    3    HB2  ALA  51           HB1      ALA  51  -6.423  -6.169   8.669
    4    HB1  ALA  51           HB2      ALA  51  -4.787  -5.805   9.219
    5    HB3  ALA  51           HB3      ALA  51  -6.177  -5.304  10.185

  No H/Q in entry =           5
  In of MODEL   52
    1    H    HIS  52           H        HIS  52  -3.347  -7.044  11.027
    2    HA   HIS  52           HA       HIS  52  -1.933  -8.524   9.082
    3    HB2  HIS  52           HB2      HIS  52  -0.915  -6.779  10.520
    4    HB3  HIS  52           HB3      HIS  52  -1.078  -7.853  11.909
    5    HD1  HIS  52           HD1      HIS  52   0.264 -10.189  11.723
    6    HD2  HIS  52           HD2      HIS  52   1.352  -7.251   8.973
    7    HE1  HIS  52           HE1      HIS  52   2.507 -10.887  10.779
    8    HE2  HIS  52           HE2      HIS  52   3.184  -9.107   9.100

  No H/Q in entry =           8
  In of MODEL   52
    1    H    LEU  53           H        LEU  53  -3.141  -9.407  12.294
    2    HA   LEU  53           HA       LEU  53  -1.923 -11.941  12.494
    3    HB2  LEU  53           HB2      LEU  53  -4.420 -10.779  13.703
    4    HB3  LEU  53           HB3      LEU  53  -3.946 -12.450  13.998
    5    HG   LEU  53           HG       LEU  53  -2.066 -10.114  14.471
    6   HD12  LEU  53          HD11      LEU  53  -2.660 -10.363  16.874
    7   HD11  LEU  53          HD12      LEU  53  -3.922 -11.509  16.422
    8   HD13  LEU  53          HD13      LEU  53  -4.030  -9.829  15.906
    9   HD21  LEU  53          HD21      LEU  53  -2.075 -13.050  15.196
   10   HD23  LEU  53          HD22      LEU  53  -1.152 -11.892  16.147
   11   HD22  LEU  53          HD23      LEU  53  -0.781 -12.121  14.449

  No H/Q in entry =          11
  In of MODEL   52
    1    H    VAL  54           H        VAL  54  -5.040 -10.938  11.126
    2    HA   VAL  54           HA       VAL  54  -5.933 -13.541  10.442
    3    HB   VAL  54           HB       VAL  54  -6.600 -10.815   9.302
    4   HG12  VAL  54          HG11      VAL  54  -8.690 -12.210   8.490
    5   HG11  VAL  54          HG12      VAL  54  -7.567 -13.567   8.565
    6   HG13  VAL  54          HG13      VAL  54  -7.217 -12.191   7.522
    7   HG22  VAL  54          HG21      VAL  54  -7.509 -10.856  11.452
    8   HG21  VAL  54          HG22      VAL  54  -7.749 -12.602  11.435
    9   HG23  VAL  54          HG23      VAL  54  -8.837 -11.554  10.526

  No H/Q in entry =           9
  In of MODEL   52
    1    H    GLN  55           H        GLN  55  -4.078 -11.078   8.651
    2    HA   GLN  55           HA       GLN  55  -3.933 -12.545   6.236
    3    HB2  GLN  55           HB2      GLN  55  -3.346 -10.276   6.043
    4    HB3  GLN  55           HB3      GLN  55  -2.237 -10.342   7.410
    5    HG2  GLN  55           HG2      GLN  55  -0.511 -11.177   6.137
    6    HG3  GLN  55           HG3      GLN  55  -1.577 -12.162   5.143
    7   HE21  GLN  55          HE21      GLN  55  -1.596 -11.475   3.021
    8   HE22  GLN  55          HE22      GLN  55  -1.409  -9.870   2.508

  No H/Q in entry =           8
  In of MODEL   52
    1    H    THR  56           H        THR  56  -1.831 -12.504   9.119
    2    HA   THR  56           HA       THR  56   0.260 -14.089   8.207
    3    HB   THR  56           HB       THR  56  -0.983 -14.349  10.954
    4    HG1  THR  56           HG1      THR  56   0.299 -12.260   9.700
    5   HG21  THR  56          HG21      THR  56   0.984 -15.832  10.025
    6   HG23  THR  56          HG22      THR  56   1.094 -15.143  11.645
    7   HG22  THR  56          HG23      THR  56   1.945 -14.380  10.302

  No H/Q in entry =           7
  In of MODEL   52
    1    H    LYS  57           H        LYS  57  -2.855 -15.145   9.568
    2    HA   LYS  57           HA       LYS  57  -2.389 -17.938   9.327
    3    HB2  LYS  57           HB2      LYS  57  -4.216 -16.860  10.669
    4    HB3  LYS  57           HB3      LYS  57  -5.009 -16.416   9.165
    5    HG2  LYS  57           HG2      LYS  57  -5.240 -18.777   8.555
    6    HG3  LYS  57           HG3      LYS  57  -4.392 -19.257  10.023
    7    HD2  LYS  57           HD2      LYS  57  -6.185 -18.228  11.389
    8    HD3  LYS  57           HD3      LYS  57  -7.044 -17.778   9.916
    9    HE2  LYS  57           HE2      LYS  57  -7.227 -20.164   9.288
   10    HE3  LYS  57           HE3      LYS  57  -6.365 -20.629  10.753
   11    HZ2  LYS  57           HZ1      LYS  57  -8.815 -20.769  10.926
   12    HZ1  LYS  57           HZ2      LYS  57  -8.895 -19.082  10.739
   13    HZ3  LYS  57           HZ3      LYS  57  -8.107 -19.753  12.088

  No H/Q in entry =          13
  In of MODEL   52
    1    H    LEU  58           H        LEU  58  -3.734 -15.509   7.146
    2    HA   LEU  58           HA       LEU  58  -4.521 -17.343   5.141
    3    HB2  LEU  58           HB2      LEU  58  -3.935 -14.390   5.002
    4    HB3  LEU  58           HB3      LEU  58  -4.590 -15.334   3.662
    5    HG   LEU  58           HG       LEU  58  -5.875 -15.159   6.408
    6   HD11  LEU  58          HD11      LEU  58  -6.183 -13.518   3.913
    7   HD13  LEU  58          HD12      LEU  58  -6.178 -13.007   5.601
    8   HD12  LEU  58          HD13      LEU  58  -7.595 -13.812   4.929
    9   HD22  LEU  58          HD21      LEU  58  -6.823 -17.076   5.540
   10   HD21  LEU  58          HD22      LEU  58  -6.484 -16.624   3.869
   11   HD23  LEU  58          HD23      LEU  58  -7.853 -15.906   4.717

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  59           H        ILE  59  -1.395 -16.109   6.005
    2    HA   ILE  59           HA       ILE  59  -0.289 -16.833   3.371
    3    HB   ILE  59           HB       ILE  59   0.463 -14.760   4.935
    4   HG12  ILE  59          HG12      ILE  59   2.567 -16.404   3.513
    5   HG13  ILE  59          HG13      ILE  59   1.371 -15.467   2.654
    6   HG21  ILE  59          HG21      ILE  59   1.217 -16.520   6.704
    7   HG23  ILE  59          HG22      ILE  59   2.313 -15.209   6.333
    8   HG22  ILE  59          HG23      ILE  59   2.568 -16.807   5.633
    9   HD11  ILE  59          HD11      ILE  59   3.300 -14.360   4.694
   10   HD13  ILE  59          HD12      ILE  59   2.109 -13.418   3.801
   11   HD12  ILE  59          HD13      ILE  59   3.454 -14.176   2.947

  No H/Q in entry =          11
  In of MODEL   52
    1    H    GLU  60           H        GLU  60  -0.297 -17.934   6.741
    2    HA   GLU  60           HA       GLU  60   1.748 -19.898   6.483
    3    HB2  GLU  60           HB2      GLU  60   0.956 -19.101   8.667
    4    HB3  GLU  60           HB3      GLU  60  -0.628 -19.811   8.362
    5    HG2  GLU  60           HG2      GLU  60   0.409 -22.056   8.228
    6    HG3  GLU  60           HG3      GLU  60   1.987 -21.338   8.549

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLY  61           H        GLY  61  -1.761 -20.021   5.991
    2    HA3  GLY  61           HA2      GLY  61  -1.493 -22.813   5.038
    3    HA2  GLY  61           HA3      GLY  61  -2.984 -22.087   5.628

  No H/Q in entry =           3
  In of MODEL   52
    1    H    ASP  62           H        ASP  62  -0.761 -20.497   3.426
    2    HA   ASP  62           HA       ASP  62  -2.852 -19.959   1.547
    3    HB2  ASP  62           HB2      ASP  62  -1.046 -18.859   0.266
    4    HB3  ASP  62           HB3      ASP  62  -1.058 -18.356   1.953

  No H/Q in entry =           4
  In of MODEL   52
    1    H    ALA  63           H        ALA  63  -3.279 -22.440   1.298
    2    HA   ALA  63           HA       ALA  63  -1.498 -24.020  -0.280
    3    HB3  ALA  63           HB1      ALA  63  -3.541 -24.742   1.150
    4    HB1  ALA  63           HB2      ALA  63  -3.175 -25.611  -0.341
    5    HB2  ALA  63           HB3      ALA  63  -4.467 -24.410  -0.316

  No H/Q in entry =           5
  In of MODEL   52
    1    H    GLY  64           H        GLY  64  -4.194 -21.861  -1.015
    2    HA3  GLY  64           HA2      GLY  64  -4.720 -20.722  -2.950
    3    HA2  GLY  64           HA3      GLY  64  -3.247 -21.348  -3.674

  No H/Q in entry =           3
  In of MODEL   52
    1    H    GLU  65           H        GLU  65  -5.342 -21.191  -5.333
    2    HA   GLU  65           HA       GLU  65  -7.098 -23.403  -5.311
    3    HB2  GLU  65           HB2      GLU  65  -6.196 -21.605  -7.558
    4    HB3  GLU  65           HB3      GLU  65  -7.457 -22.826  -7.727
    5    HG2  GLU  65           HG2      GLU  65  -8.767 -21.765  -5.954
    6    HG3  GLU  65           HG3      GLU  65  -7.491 -20.579  -5.694

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLY  66           H        GLY  66  -3.967 -22.919  -6.738
    2    HA3  GLY  66           HA2      GLY  66  -3.907 -25.465  -8.115
    3    HA2  GLY  66           HA3      GLY  66  -2.637 -24.258  -8.082

  No H/Q in entry =           3
  In of MODEL   52
    1    H    LYS  67           H        LYS  67  -1.413 -26.339  -7.909
    2    HA   LYS  67           HA       LYS  67  -1.456 -27.999  -5.680
    3    HB2  LYS  67           HB2      LYS  67   0.758 -27.297  -7.597
    4    HB3  LYS  67           HB3      LYS  67   0.891 -28.575  -6.383
    5    HG2  LYS  67           HG2      LYS  67  -1.062 -29.710  -7.294
    6    HG3  LYS  67           HG3      LYS  67  -1.331 -28.398  -8.439
    7    HD2  LYS  67           HD2      LYS  67  -0.231 -30.079  -9.700
    8    HD3  LYS  67           HD3      LYS  67   1.039 -28.917  -9.311
    9    HE2  LYS  67           HE2      LYS  67   1.834 -30.283  -7.487
   10    HE3  LYS  67           HE3      LYS  67   0.456 -31.373  -7.636
   11    HZ2  LYS  67           HZ1      LYS  67   2.900 -31.295  -9.144
   12    HZ1  LYS  67           HZ2      LYS  67   1.515 -31.376 -10.125
   13    HZ3  LYS  67           HZ3      LYS  67   1.791 -32.563  -8.940

  No H/Q in entry =          13
  In of MODEL   52
    1    H    MET  68           H        MET  68   1.593 -26.535  -6.055
    2    HA   MET  68           HA       MET  68   1.848 -26.008  -3.231
    3    HB2  MET  68           HB2      MET  68   3.743 -25.747  -5.562
    4    HB3  MET  68           HB3      MET  68   4.192 -25.392  -3.894
    5    HG2  MET  68           HG2      MET  68   3.766 -27.645  -3.204
    6    HG3  MET  68           HG3      MET  68   2.983 -28.035  -4.736
    7    HE2  MET  68           HE1      MET  68   7.393 -26.942  -4.167
    8    HE1  MET  68           HE2      MET  68   6.010 -26.483  -3.176
    9    HE3  MET  68           HE3      MET  68   6.248 -25.727  -4.750

  No H/Q in entry =           9
  In of MODEL   52
    1    H    LYS  69           H        LYS  69   0.702 -24.128  -5.761
    2    HA   LYS  69           HA       LYS  69   1.928 -21.646  -5.201
    3    HB2  LYS  69           HB2      LYS  69  -0.612 -22.313  -6.655
    4    HB3  LYS  69           HB3      LYS  69   0.024 -20.670  -6.513
    5    HG2  LYS  69           HG2      LYS  69   2.149 -21.385  -7.513
    6    HG3  LYS  69           HG3      LYS  69   1.548 -23.039  -7.635
    7    HD2  LYS  69           HD2      LYS  69  -0.281 -22.242  -9.114
    8    HD3  LYS  69           HD3      LYS  69   0.388 -20.611  -9.032
    9    HE2  LYS  69           HE2      LYS  69   1.931 -23.028 -10.012
   10    HE3  LYS  69           HE3      LYS  69   1.112 -21.883 -11.073
   11    HZ1  LYS  69           HZ1      LYS  69   2.499 -20.200  -9.600
   12    HZ3  LYS  69           HZ2      LYS  69   3.131 -20.908 -11.010
   13    HZ2  LYS  69           HZ3      LYS  69   3.531 -21.542  -9.485

  No H/Q in entry =          13
  In of MODEL   52
    1    H    VAL  70           H        VAL  70   0.079 -19.705  -4.991
    2    HA   VAL  70           HA       VAL  70  -1.301 -20.150  -2.408
    3    HB   VAL  70           HB       VAL  70  -0.577 -17.883  -1.716
    4   HG11  VAL  70          HG11      VAL  70   0.767 -20.054  -1.284
    5   HG13  VAL  70          HG12      VAL  70   1.592 -18.516  -1.028
    6   HG12  VAL  70          HG13      VAL  70   1.884 -19.438  -2.502
    7   HG22  VAL  70          HG21      VAL  70  -0.267 -16.912  -3.981
    8   HG21  VAL  70          HG22      VAL  70   1.109 -17.980  -4.248
    9   HG23  VAL  70          HG23      VAL  70   1.200 -16.721  -3.019

  No H/Q in entry =           9
  In of MODEL   52
    1    H    SER  71           H        SER  71  -2.956 -18.510  -1.980
    2    HA   SER  71           HA       SER  71  -4.733 -18.128  -4.162
    3    HB2  SER  71           HB2      SER  71  -5.473 -18.274  -1.777
    4    HB3  SER  71           HB3      SER  71  -4.706 -16.720  -1.467
    5    HG   SER  71           HG       SER  71  -6.590 -17.057  -3.543

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LEU  72           H        LEU  72  -5.049 -16.425  -5.483
    2    HA   LEU  72           HA       LEU  72  -2.954 -14.598  -5.966
    3    HB2  LEU  72           HB2      LEU  72  -5.818 -14.675  -6.913
    4    HB3  LEU  72           HB3      LEU  72  -4.630 -13.510  -7.490
    5    HG   LEU  72           HG       LEU  72  -4.203 -16.512  -7.619
    6   HD12  LEU  72          HD11      LEU  72  -4.743 -16.245 -10.049
    7   HD11  LEU  72          HD12      LEU  72  -5.262 -14.592  -9.713
    8   HD13  LEU  72          HD13      LEU  72  -6.129 -15.951  -8.998
    9   HD23  LEU  72          HD21      LEU  72  -2.639 -15.631  -9.531
   10   HD22  LEU  72          HD22      LEU  72  -2.078 -15.493  -7.873
   11   HD21  LEU  72          HD23      LEU  72  -2.756 -14.088  -8.691

  No H/Q in entry =          11
  In of MODEL   52
    1    H    VAL  73           H        VAL  73  -6.051 -14.263  -4.338
    2    HA   VAL  73           HA       VAL  73  -6.118 -11.492  -3.990
    3    HB   VAL  73           HB       VAL  73  -7.859 -11.853  -2.466
    4   HG12  VAL  73          HG11      VAL  73  -7.865 -14.410  -4.074
    5   HG11  VAL  73          HG12      VAL  73  -8.137 -12.834  -4.813
    6   HG13  VAL  73          HG13      VAL  73  -9.249 -13.433  -3.582
    7   HG23  VAL  73          HG21      VAL  73  -8.140 -14.149  -1.383
    8   HG22  VAL  73          HG22      VAL  73  -6.784 -13.187  -0.793
    9   HG21  VAL  73          HG23      VAL  73  -6.502 -14.506  -1.929

  No H/Q in entry =           9
  In of MODEL   52
    1    H    LEU  74           H        LEU  74  -4.163 -13.843  -2.403
    2    HA   LEU  74           HA       LEU  74  -3.761 -12.697   0.119
    3    HB2  LEU  74           HB2      LEU  74  -2.959 -14.908  -0.376
    4    HB3  LEU  74           HB3      LEU  74  -1.912 -14.292  -1.653
    5    HG   LEU  74           HG       LEU  74  -0.613 -13.026   0.026
    6   HD12  LEU  74          HD11      LEU  74  -1.092 -13.737   2.469
    7   HD11  LEU  74          HD12      LEU  74  -2.682 -14.219   1.875
    8   HD13  LEU  74          HD13      LEU  74  -2.167 -12.537   1.751
    9   HD21  LEU  74          HD21      LEU  74  -0.413 -15.603  -0.568
   10   HD23  LEU  74          HD22      LEU  74  -0.810 -15.756   1.129
   11   HD22  LEU  74          HD23      LEU  74   0.616 -14.861   0.654

  No H/Q in entry =          11
  In of MODEL   52
    1    H    VAL  75           H        VAL  75  -1.873 -12.291  -2.838
    2    HA   VAL  75           HA       VAL  75  -0.091 -10.352  -1.829
    3    HB   VAL  75           HB       VAL  75  -1.041 -10.849  -4.651
    4   HG13  VAL  75          HG11      VAL  75  -0.201  -8.535  -4.438
    5   HG12  VAL  75          HG12      VAL  75   0.986  -9.522  -5.277
    6   HG11  VAL  75          HG13      VAL  75   1.224  -9.119  -3.584
    7   HG23  VAL  75          HG21      VAL  75   1.546 -11.552  -3.221
    8   HG22  VAL  75          HG22      VAL  75   1.082 -12.034  -4.853
    9   HG21  VAL  75          HG23      VAL  75   0.212 -12.682  -3.461

  No H/Q in entry =           9
  In of MODEL   52
    1    H    GLU  76           H        GLU  76  -3.243 -10.031  -3.488
    2    HA   GLU  76           HA       GLU  76  -3.317  -7.217  -3.592
    3    HB2  GLU  76           HB2      GLU  76  -4.965  -8.663  -4.756
    4    HB3  GLU  76           HB3      GLU  76  -5.611  -9.176  -3.205
    5    HG2  GLU  76           HG2      GLU  76  -7.084  -7.475  -4.073
    6    HG3  GLU  76           HG3      GLU  76  -6.209  -6.758  -2.734

  No H/Q in entry =           6
  In of MODEL   52
    1    H    ALA  77           H        ALA  77  -4.411  -9.451  -1.051
    2    HA   ALA  77           HA       ALA  77  -5.384  -7.455   0.706
    3    HB2  ALA  77           HB1      ALA  77  -4.931  -9.279   2.473
    4    HB1  ALA  77           HB2      ALA  77  -4.431 -10.284   1.115
    5    HB3  ALA  77           HB3      ALA  77  -6.075  -9.654   1.186

  No H/Q in entry =           5
  In of MODEL   52
    1    H    GLN  78           H        GLN  78  -2.224  -8.981   0.344
    2    HA   GLN  78           HA       GLN  78  -0.976  -7.809   2.593
    3    HB2  GLN  78           HB2      GLN  78  -0.097  -9.744   1.245
    4    HB3  GLN  78           HB3      GLN  78   0.324  -8.600  -0.027
    5    HG2  GLN  78           HG2      GLN  78   1.777  -7.384   1.544
    6    HG3  GLN  78           HG3      GLN  78   1.359  -8.524   2.820
    7   HE21  GLN  78          HE21      GLN  78   4.077  -8.211   1.940
    8   HE22  GLN  78          HE22      GLN  78   4.550  -9.648   1.170

  No H/Q in entry =           8
  In of MODEL   52
    1    H    LEU  79           H        LEU  79  -1.350  -6.754  -0.755
    2    HA   LEU  79           HA       LEU  79   0.321  -4.515  -0.743
    3    HB2  LEU  79           HB2      LEU  79  -0.700  -5.331  -2.796
    4    HB3  LEU  79           HB3      LEU  79  -2.306  -4.950  -2.188
    5    HG   LEU  79           HG       LEU  79  -1.779  -2.559  -2.165
    6   HD13  LEU  79          HD11      LEU  79   0.459  -2.299  -1.652
    7   HD12  LEU  79          HD12      LEU  79   0.507  -2.013  -3.391
    8   HD11  LEU  79          HD13      LEU  79   0.972  -3.587  -2.743
    9   HD23  LEU  79          HD21      LEU  79  -1.145  -2.358  -4.717
   10   HD22  LEU  79          HD22      LEU  79  -2.667  -3.116  -4.258
   11   HD21  LEU  79          HD23      LEU  79  -1.287  -4.116  -4.701

  No H/Q in entry =          11
  In of MODEL   52
    1    H    HIS  80           H        HIS  80  -3.145  -4.700   0.083
    2    HA   HIS  80           HA       HIS  80  -3.355  -1.945   0.743
    3    HB2  HIS  80           HB2      HIS  80  -5.040  -4.364   1.064
    4    HB3  HIS  80           HB3      HIS  80  -5.370  -3.025   2.167
    5    HD1  HIS  80           HD1      HIS  80  -6.998  -1.400   1.257
    6    HD2  HIS  80           HD2      HIS  80  -4.793  -3.201  -1.788
    7    HE1  HIS  80           HE1      HIS  80  -7.844  -0.411  -0.923
    8    HE2  HIS  80           HE2      HIS  80  -6.506  -1.503  -2.789

  No H/Q in entry =           8
  In of MODEL   52
    1    H    LEU  81           H        LEU  81  -2.848  -4.834   2.739
    2    HA   LEU  81           HA       LEU  81  -2.845  -3.485   5.222
    3    HB2  LEU  81           HB2      LEU  81  -1.609  -6.094   4.346
    4    HB3  LEU  81           HB3      LEU  81  -1.587  -5.534   6.019
    5    HG   LEU  81           HG       LEU  81  -4.131  -5.804   4.391
    6   HD12  LEU  81          HD11      LEU  81  -4.421  -7.870   5.940
    7   HD11  LEU  81          HD12      LEU  81  -2.670  -7.788   6.126
    8   HD13  LEU  81          HD13      LEU  81  -3.376  -8.024   4.527
    9   HD23  LEU  81          HD21      LEU  81  -4.974  -6.010   6.892
   10   HD22  LEU  81          HD22      LEU  81  -4.659  -4.419   6.200
   11   HD21  LEU  81          HD23      LEU  81  -3.467  -5.171   7.261

  No H/Q in entry =          11
  In of MODEL   52
    1    H    MET  82           H        MET  82  -0.158  -4.374   3.053
    2    HA   MET  82           HA       MET  82   1.919  -3.465   4.737
    3    HB2  MET  82           HB2      MET  82   1.707  -3.811   1.745
    4    HB3  MET  82           HB3      MET  82   3.186  -3.231   2.508
    5    HG2  MET  82           HG2      MET  82   1.794  -5.828   3.234
    6    HG3  MET  82           HG3      MET  82   3.165  -5.711   2.134
    7    HE3  MET  82           HE1      MET  82   6.176  -4.955   4.118
    8    HE2  MET  82           HE2      MET  82   5.245  -3.594   3.498
    9    HE1  MET  82           HE3      MET  82   5.343  -5.084   2.564

  No H/Q in entry =           9
  In of MODEL   52
    1    H    THR  83           H        THR  83   0.088  -1.836   2.178
    2    HA   THR  83           HA       THR  83   1.486   0.620   2.262
    3    HB   THR  83           HB       THR  83  -0.695   1.531   1.275
    4    HG1  THR  83           HG1      THR  83  -2.338   0.225   1.169
    5   HG22  THR  83          HG21      THR  83  -0.414  -0.287  -0.724
    6   HG21  THR  83          HG22      THR  83   1.088  -0.570   0.153
    7   HG23  THR  83          HG23      THR  83   0.718   1.041  -0.463

  No H/Q in entry =           7
  In of MODEL   52
    1    H    SER  84           H        SER  84  -1.514  -0.428   3.864
    2    HA   SER  84           HA       SER  84  -2.024   2.001   5.206
    3    HB2  SER  84           HB2      SER  84  -2.841  -0.841   5.773
    4    HB3  SER  84           HB3      SER  84  -3.342   0.498   6.805
    5    HG   SER  84           HG       SER  84  -3.799   0.179   4.013

  No H/Q in entry =           5
  In of MODEL   52
    1    H    MET  85           H        MET  85  -0.298  -0.920   6.339
    2    HA   MET  85           HA       MET  85   0.216   0.012   8.942
    3    HB2  MET  85           HB2      MET  85   0.521  -2.331   8.266
    4    HB3  MET  85           HB3      MET  85   1.901  -1.861   7.273
    5    HG2  MET  85           HG2      MET  85   3.063  -1.012   9.278
    6    HG3  MET  85           HG3      MET  85   1.679  -1.463  10.273
    7    HE1  MET  85           HE1      MET  85   4.944  -2.400   8.794
    8    HE3  MET  85           HE2      MET  85   3.990  -3.005   7.442
    9    HE2  MET  85           HE3      MET  85   4.896  -4.132   8.447

  No H/Q in entry =           9
  In of MODEL   52
    1    H    LEU  86           H        LEU  86   2.150   0.274   5.991
    2    HA   LEU  86           HA       LEU  86   4.357   1.598   7.145
    3    HB2  LEU  86           HB2      LEU  86   4.171   0.512   4.838
    4    HB3  LEU  86           HB3      LEU  86   3.356   1.988   4.323
    5    HG   LEU  86           HG       LEU  86   5.377   3.246   5.302
    6   HD11  LEU  86          HD11      LEU  86   6.096   0.639   6.105
    7   HD13  LEU  86          HD12      LEU  86   7.092   2.089   6.201
    8   HD12  LEU  86          HD13      LEU  86   7.206   1.040   4.791
    9   HD23  LEU  86          HD21      LEU  86   6.103   1.484   2.954
   10   HD22  LEU  86          HD22      LEU  86   6.488   3.184   3.214
   11   HD21  LEU  86          HD23      LEU  86   4.838   2.707   2.816

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ALA  87           H        ALA  87   1.438   2.825   5.559
    2    HA   ALA  87           HA       ALA  87   2.019   5.557   5.639
    3    HB1  ALA  87           HB1      ALA  87  -0.282   3.917   5.100
    4    HB3  ALA  87           HB2      ALA  87   0.020   5.579   4.598
    5    HB2  ALA  87           HB3      ALA  87  -0.772   5.256   6.142

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ARG  88           H        ARG  88   0.339   3.550   8.032
    2    HA   ARG  88           HA       ARG  88  -0.183   5.600   9.876
    3    HB2  ARG  88           HB2      ARG  88  -1.110   3.242   9.945
    4    HB3  ARG  88           HB3      ARG  88   0.433   2.751  10.652
    5    HG2  ARG  88           HG2      ARG  88  -0.054   4.825  12.269
    6    HG3  ARG  88           HG3      ARG  88  -1.719   4.491  11.814
    7    HD2  ARG  88           HD2      ARG  88  -1.817   2.643  13.063
    8    HD3  ARG  88           HD3      ARG  88  -0.224   2.068  12.532
    9    HE   ARG  88           HE       ARG  88  -0.765   3.332  14.985
   10   HH21  ARG  88          HH11      ARG  88   0.788   4.354  16.222
   11   HH22  ARG  88          HH12      ARG  88   2.305   4.787  15.517
   12   HH11  ARG  88          HH21      ARG  88   1.515   3.522  12.408
   13   HH12  ARG  88          HH22      ARG  88   2.725   4.300  13.369

  No H/Q in entry =          13
  In of MODEL   52
    1    H    GLU  89           H        GLU  89   2.625   3.395   9.656
    2    HA   GLU  89           HA       GLU  89   3.881   4.294  11.999
    3    HB2  GLU  89           HB2      GLU  89   4.551   2.277  10.658
    4    HB3  GLU  89           HB3      GLU  89   5.321   3.374   9.510
    5    HG2  GLU  89           HG2      GLU  89   6.801   4.231  11.253
    6    HG3  GLU  89           HG3      GLU  89   5.971   3.272  12.474

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LEU  90           H        LEU  90   4.192   5.448   8.670
    2    HA   LEU  90           HA       LEU  90   6.111   7.460   9.252
    3    HB2  LEU  90           HB2      LEU  90   4.108   7.115   7.025
    4    HB3  LEU  90           HB3      LEU  90   5.331   8.392   7.045
    5    HG   LEU  90           HG       LEU  90   6.021   5.460   7.383
    6   HD12  LEU  90          HD11      LEU  90   6.769   5.694   4.943
    7   HD11  LEU  90          HD12      LEU  90   5.745   7.129   4.892
    8   HD13  LEU  90          HD13      LEU  90   5.034   5.552   5.237
    9   HD22  LEU  90          HD21      LEU  90   7.912   6.622   8.063
   10   HD21  LEU  90          HD22      LEU  90   7.554   8.023   7.054
   11   HD23  LEU  90          HD23      LEU  90   8.222   6.561   6.330

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  91           H        ILE  91   2.572   7.455   9.103
    2    HA   ILE  91           HA       ILE  91   2.213  10.226   9.550
    3    HB   ILE  91           HB       ILE  91   0.437   7.840  10.095
    4   HG12  ILE  91          HG12      ILE  91   0.175  10.117   8.107
    5   HG13  ILE  91          HG13      ILE  91   1.044   8.628   7.737
    6   HG22  ILE  91          HG21      ILE  91  -1.308   9.888  10.156
    7   HG21  ILE  91          HG22      ILE  91   0.088  10.728  10.827
    8   HG23  ILE  91          HG23      ILE  91  -0.540   9.288  11.626
    9   HD13  ILE  91          HD11      ILE  91  -0.892   7.328   7.783
   10   HD12  ILE  91          HD12      ILE  91  -1.491   8.839   7.099
   11   HD11  ILE  91          HD13      ILE  91  -1.760   8.475   8.804

  No H/Q in entry =          11
  In of MODEL   52
    1    H    THR  92           H        THR  92   2.633   7.490  11.755
    2    HA   THR  92           HA       THR  92   2.181   8.865  14.177
    3    HB   THR  92           HB       THR  92   4.004   6.541  13.516
    4    HG1  THR  92           HG1      THR  92   2.040   5.771  13.416
    5   HG22  THR  92          HG21      THR  92   3.622   6.258  16.150
    6   HG21  THR  92          HG22      THR  92   3.546   8.017  16.074
    7   HG23  THR  92          HG23      THR  92   4.985   7.170  15.503

  No H/Q in entry =           7
  In of MODEL   52
    1    H    GLU  93           H        GLU  93   5.135   8.433  12.245
    2    HA   GLU  93           HA       GLU  93   6.878   9.874  13.940
    3    HB2  GLU  93           HB2      GLU  93   6.970   9.555  10.925
    4    HB3  GLU  93           HB3      GLU  93   8.307  10.096  11.939
    5    HG2  GLU  93           HG2      GLU  93   6.915   7.451  12.391
    6    HG3  GLU  93           HG3      GLU  93   8.298   7.611  11.315

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LEU  94           H        LEU  94   4.824  10.870  11.225
    2    HA   LEU  94           HA       LEU  94   5.609  13.580  11.120
    3    HB2  LEU  94           HB2      LEU  94   3.029  12.195  10.368
    4    HB3  LEU  94           HB3      LEU  94   3.275  13.924  10.123
    5    HG   LEU  94           HG       LEU  94   5.307  11.949   9.077
    6   HD11  LEU  94          HD11      LEU  94   2.562  12.477   8.013
    7   HD13  LEU  94          HD12      LEU  94   3.556  11.028   7.890
    8   HD12  LEU  94          HD13      LEU  94   3.881  12.409   6.844
    9   HD23  LEU  94          HD21      LEU  94   5.545  13.784   7.352
   10   HD22  LEU  94          HD22      LEU  94   5.955  14.282   8.993
   11   HD21  LEU  94          HD23      LEU  94   4.401  14.738   8.293

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  95           H        ILE  95   3.083  11.947  13.013
    2    HA   ILE  95           HA       ILE  95   2.022  14.291  14.203
    3    HB   ILE  95           HB       ILE  95   2.060  11.411  15.133
    4   HG12  ILE  95          HG12      ILE  95  -0.173  13.166  14.080
    5   HG13  ILE  95          HG13      ILE  95   0.792  12.112  13.050
    6   HG21  ILE  95          HG21      ILE  95   0.758  13.876  16.330
    7   HG23  ILE  95          HG22      ILE  95   1.815  12.716  17.137
    8   HG22  ILE  95          HG23      ILE  95   0.184  12.242  16.662
    9   HD13  ILE  95          HD11      ILE  95  -0.096  10.168  13.972
   10   HD12  ILE  95          HD12      ILE  95  -1.487  11.247  14.046
   11   HD11  ILE  95          HD13      ILE  95  -0.521  10.959  15.492

  No H/Q in entry =          11
  In of MODEL   52
    1    H    GLU  96           H        GLU  96   4.634  12.095  15.204
    2    HA   GLU  96           HA       GLU  96   5.178  13.302  17.694
    3    HB2  GLU  96           HB2      GLU  96   6.144  11.150  17.051
    4    HB3  GLU  96           HB3      GLU  96   7.071  11.928  15.771
    5    HG2  GLU  96           HG2      GLU  96   8.714  12.493  17.233
    6    HG3  GLU  96           HG3      GLU  96   7.560  13.299  18.286

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LEU  97           H        LEU  97   6.248  14.077  14.408
    2    HA   LEU  97           HA       LEU  97   8.116  16.090  15.117
    3    HB2  LEU  97           HB2      LEU  97   6.531  15.523  12.622
    4    HB3  LEU  97           HB3      LEU  97   7.538  16.964  12.742
    5    HG   LEU  97           HG       LEU  97   8.591  14.176  13.307
    6   HD12  LEU  97          HD11      LEU  97   9.587  14.374  10.991
    7   HD11  LEU  97          HD12      LEU  97   8.524  15.755  10.724
    8   HD13  LEU  97          HD13      LEU  97   7.838  14.158  11.021
    9   HD23  LEU  97          HD21      LEU  97  10.749  15.472  12.564
   10   HD22  LEU  97          HD22      LEU  97  10.127  15.739  14.192
   11   HD21  LEU  97          HD23      LEU  97   9.804  16.917  12.921

  No H/Q in entry =          11
  In of MODEL   52
    1    H    HIS  98           H        HIS  98   4.624  16.194  14.460
    2    HA   HIS  98           HA       HIS  98   4.300  18.991  14.590
    3    HB2  HIS  98           HB2      HIS  98   2.430  16.726  15.319
    4    HB3  HIS  98           HB3      HIS  98   1.948  18.422  15.371
    5    HD1  HIS  98           HD1      HIS  98   2.995  15.712  12.972
    6    HD2  HIS  98           HD2      HIS  98   1.584  19.633  12.842
    7    HE1  HIS  98           HE1      HIS  98   2.433  16.191  10.547
    8    HE2  HIS  98           HE2      HIS  98   1.577  18.573  10.447

  No H/Q in entry =           8
  In of MODEL   52
    1    H    GLU  99           H        GLU  99   4.454  16.509  17.094
    2    HA   GLU  99           HA       GLU  99   3.829  18.202  19.288
    3    HB2  GLU  99           HB2      GLU  99   3.763  15.719  19.390
    4    HB3  GLU  99           HB3      GLU  99   5.523  15.690  19.283
    5    HG2  GLU  99           HG2      GLU  99   5.699  16.987  21.355
    6    HG3  GLU  99           HG3      GLU  99   3.945  17.112  21.449

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LYS 100           H        LYS 100   6.892  17.295  17.727
    2    HA   LYS 100           HA       LYS 100   8.534  18.714  19.582
    3    HB2  LYS 100           HB2      LYS 100   9.042  17.789  16.746
    4    HB3  LYS 100           HB3      LYS 100  10.265  18.571  17.753
    5    HG2  LYS 100           HG2      LYS 100   9.903  16.820  19.497
    6    HG3  LYS 100           HG3      LYS 100   8.779  16.005  18.407
    7    HD2  LYS 100           HD2      LYS 100  10.576  15.735  16.741
    8    HD3  LYS 100           HD3      LYS 100  11.705  16.563  17.817
    9    HE2  LYS 100           HE2      LYS 100  11.323  14.807  19.538
   10    HE3  LYS 100           HE3      LYS 100  10.257  13.960  18.413
   11    HZ1  LYS 100           HZ1      LYS 100  13.071  14.653  17.758
   12    HZ3  LYS 100           HZ2      LYS 100  12.038  13.587  16.931
   13    HZ2  LYS 100           HZ3      LYS 100  12.629  13.176  18.471

  No H/Q in entry =          13
  In of MODEL   52
    1    H    LEU 101           H        LEU 101   6.834  19.620  16.624
    2    HA   LEU 101           HA       LEU 101   8.025  22.188  16.286
    3    HB2  LEU 101           HB2      LEU 101   5.441  20.930  15.399
    4    HB3  LEU 101           HB3      LEU 101   5.677  22.662  15.189
    5    HG   LEU 101           HG       LEU 101   7.732  20.662  14.228
    6   HD12  LEU 101          HD11      LEU 101   6.576  21.154  11.941
    7   HD11  LEU 101          HD12      LEU 101   5.172  21.574  12.920
    8   HD13  LEU 101          HD13      LEU 101   5.850  19.949  13.005
    9   HD21  LEU 101          HD21      LEU 101   7.079  23.568  13.667
   10   HD23  LEU 101          HD22      LEU 101   8.068  22.615  12.563
   11   HD22  LEU 101          HD23      LEU 101   8.607  22.880  14.220

  No H/Q in entry =          11
  In of MODEL   52
    1    H    LYS 102           H        LYS 102   6.497  21.041  18.902
    2    HA   LYS 102           HA       LYS 102   5.854  22.130  20.832
    3    HB2  LYS 102           HB2      LYS 102   7.120  24.129  19.705
    4    HB3  LYS 102           HB3      LYS 102   5.516  24.720  19.327
    5    HG2  LYS 102           HG2      LYS 102   6.893  24.480  21.981
    6    HG3  LYS 102           HG3      LYS 102   5.930  25.799  21.349
    7    HD2  LYS 102           HD2      LYS 102   4.708  23.154  22.232
    8    HD3  LYS 102           HD3      LYS 102   4.944  24.519  23.313
    9    HE2  LYS 102           HE2      LYS 102   2.669  24.094  21.823
   10    HE3  LYS 102           HE3      LYS 102   3.159  25.645  22.503
   11    HZ2  LYS 102           HZ1      LYS 102   2.629  25.744  20.123
   12    HZ1  LYS 102           HZ2      LYS 102   3.900  24.673  19.802
   13    HZ3  LYS 102           HZ3      LYS 102   4.229  26.207  20.443

  No H/Q in entry =          13
  In of MODEL   52
    1    H    ALA 103           H        ALA 103   4.204  23.654  18.061
    2    HA   ALA 103           HA       ALA 103   1.745  24.211  18.944
    3    HB1  ALA 103           HB1      ALA 103   0.855  23.358  16.703
    4    HB2  ALA 103           HB2      ALA 103   2.507  22.835  16.374
    5    HB3  ALA 103           HB3      ALA 103   2.157  24.545  16.638

  No H/Q in entry =           5
  In of MODEL   52
    1    H1   ALA   1           H3       ALA   1  10.733 -20.255  -6.254
    2    H2   ALA   1           H2       ALA   1   9.771 -20.471  -7.641
    3    H3   ALA   1           H1       ALA   1   9.339 -21.218  -6.176
    4    HA   ALA   1           HA       ALA   1  10.393 -23.020  -6.913
    5    HB1  ALA   1           HB1      ALA   1  10.487 -22.664  -9.189
    6    HB2  ALA   1           HB2      ALA   1  12.213 -22.499  -8.859
    7    HB3  ALA   1           HB3      ALA   1  11.203 -21.060  -9.013

  No H/Q in entry =           7
  In of MODEL   52
    1    H    GLU   2           H        GLU   2  12.684 -23.953  -6.968
    2    HA   GLU   2           HA       GLU   2  14.064 -23.857  -4.756
    3    HB2  GLU   2           HB2      GLU   2  15.421 -23.719  -7.455
    4    HB3  GLU   2           HB3      GLU   2  16.153 -24.322  -5.969
    5    HG2  GLU   2           HG2      GLU   2  15.152 -26.347  -6.207
    6    HG3  GLU   2           HG3      GLU   2  13.575 -25.614  -6.467

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLU   3           H        GLU   3  15.822 -21.983  -7.160
    2    HA   GLU   3           HA       GLU   3  16.962 -20.284  -5.202
    3    HB2  GLU   3           HB2      GLU   3  16.907 -20.286  -8.213
    4    HB3  GLU   3           HB3      GLU   3  17.642 -18.950  -7.327
    5    HG2  GLU   3           HG2      GLU   3  19.315 -20.311  -6.402
    6    HG3  GLU   3           HG3      GLU   3  18.380 -21.785  -6.621

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LEU   4           H        LEU   4  14.674 -19.457  -7.835
    2    HA   LEU   4           HA       LEU   4  14.188 -16.851  -7.228
    3    HB2  LEU   4           HB2      LEU   4  12.028 -18.843  -7.956
    4    HB3  LEU   4           HB3      LEU   4  11.940 -17.095  -8.157
    5    HG   LEU   4           HG       LEU   4  13.918 -18.945  -9.527
    6   HD13  LEU   4          HD11      LEU   4  12.616 -18.809 -11.437
    7   HD12  LEU   4          HD12      LEU   4  11.896 -17.269 -10.972
    8   HD11  LEU   4          HD13      LEU   4  11.354 -18.763 -10.209
    9   HD23  LEU   4          HD21      LEU   4  14.238 -16.700 -10.881
   10   HD22  LEU   4          HD22      LEU   4  15.100 -16.933  -9.361
   11   HD21  LEU   4          HD23      LEU   4  13.639 -15.948  -9.402

  No H/Q in entry =          11
  In of MODEL   52
    1    H    GLU   5           H        GLU   5  12.724 -19.643  -5.582
    2    HA   GLU   5           HA       GLU   5  11.034 -18.082  -3.881
    3    HB2  GLU   5           HB2      GLU   5  10.625 -20.463  -4.398
    4    HB3  GLU   5           HB3      GLU   5  12.064 -20.889  -3.469
    5    HG2  GLU   5           HG2      GLU   5  11.094 -19.874  -1.459
    6    HG3  GLU   5           HG3      GLU   5   9.669 -19.390  -2.377

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLU   6           H        GLU   6  14.192 -19.637  -3.436
    2    HA   GLU   6           HA       GLU   6  14.538 -18.774  -0.739
    3    HB2  GLU   6           HB2      GLU   6  16.509 -19.694  -2.843
    4    HB3  GLU   6           HB3      GLU   6  16.949 -19.355  -1.168
    5    HG2  GLU   6           HG2      GLU   6  15.381 -21.055  -0.377
    6    HG3  GLU   6           HG3      GLU   6  14.842 -21.359  -2.029

  No H/Q in entry =           6
  In of MODEL   52
    1    H    VAL   7           H        VAL   7  15.294 -17.446  -3.890
    2    HA   VAL   7           HA       VAL   7  16.963 -15.305  -3.029
    3    HB   VAL   7           HB       VAL   7  15.260 -15.686  -5.506
    4   HG11  VAL   7          HG11      VAL   7  17.136 -13.457  -4.696
    5   HG13  VAL   7          HG12      VAL   7  15.493 -13.328  -5.320
    6   HG12  VAL   7          HG13      VAL   7  16.806 -13.822  -6.389
    7   HG21  VAL   7          HG21      VAL   7  17.379 -17.125  -4.934
    8   HG23  VAL   7          HG22      VAL   7  18.272 -15.657  -5.335
    9   HG22  VAL   7          HG23      VAL   7  17.242 -16.417  -6.545

  No H/Q in entry =           9
  In of MODEL   52
    1    H    VAL   8           H        VAL   8  13.473 -15.604  -3.586
    2    HA   VAL   8           HA       VAL   8  12.785 -12.900  -3.118
    3    HB   VAL   8           HB       VAL   8  11.215 -15.460  -2.733
    4   HG12  VAL   8          HG11      VAL   8   9.271 -13.668  -2.867
    5   HG11  VAL   8          HG12      VAL   8  10.507 -12.587  -2.222
    6   HG13  VAL   8          HG13      VAL   8  10.042 -14.031  -1.323
    7   HG22  VAL   8          HG21      VAL   8  10.483 -15.164  -4.917
    8   HG21  VAL   8          HG22      VAL   8  12.027 -14.329  -5.064
    9   HG23  VAL   8          HG23      VAL   8  10.551 -13.406  -4.809

  No H/Q in entry =           9
  In of MODEL   52
    1    H    MET   9           H        MET   9  13.074 -15.701  -0.934
    2    HA   MET   9           HA       MET   9  12.248 -14.432   1.434
    3    HB2  MET   9           HB2      MET   9  14.129 -16.713   0.867
    4    HB3  MET   9           HB3      MET   9  13.921 -16.109   2.511
    5    HG2  MET   9           HG2      MET   9  11.390 -16.357   2.094
    6    HG3  MET   9           HG3      MET   9  11.845 -17.330   0.694
    7    HE2  MET   9           HE1      MET   9  14.318 -19.147   1.463
    8    HE1  MET   9           HE2      MET   9  12.810 -19.368   0.580
    9    HE3  MET   9           HE3      MET   9  13.245 -20.495   1.863

  No H/Q in entry =           9
  In of MODEL   52
    1    H    GLY  10           H        GLY  10  15.431 -14.632  -0.121
    2    HA3  GLY  10           HA2      GLY  10  16.877 -13.195   1.847
    3    HA2  GLY  10           HA3      GLY  10  17.342 -13.359   0.154

  No H/Q in entry =           3
  In of MODEL   52
    1    H    LEU  11           H        LEU  11  15.164 -12.159  -1.088
    2    HA   LEU  11           HA       LEU  11  15.824  -9.408  -0.928
    3    HB2  LEU  11           HB2      LEU  11  13.469 -10.841  -2.162
    4    HB3  LEU  11           HB3      LEU  11  13.734  -9.104  -2.324
    5    HG   LEU  11           HG       LEU  11  15.781 -11.195  -3.108
    6   HD13  LEU  11          HD11      LEU  11  14.039 -11.580  -4.628
    7   HD12  LEU  11          HD12      LEU  11  15.031 -10.391  -5.470
    8   HD11  LEU  11          HD13      LEU  11  13.553  -9.885  -4.653
    9   HD22  LEU  11          HD21      LEU  11  16.994  -9.220  -2.885
   10   HD21  LEU  11          HD22      LEU  11  15.610  -8.197  -3.266
   11   HD23  LEU  11          HD23      LEU  11  16.450  -9.060  -4.553

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  12           H        ILE  12  13.072 -11.257   0.341
    2    HA   ILE  12           HA       ILE  12  11.657  -9.045   1.397
    3    HB   ILE  12           HB       ILE  12  11.721 -11.926   2.350
    4   HG12  ILE  12          HG12      ILE  12  11.028 -11.305  -0.099
    5   HG13  ILE  12          HG13      ILE  12  10.010 -12.399   0.815
    6   HG22  ILE  12          HG21      ILE  12   9.442 -11.367   3.272
    7   HG21  ILE  12          HG22      ILE  12   9.763  -9.672   2.908
    8   HG23  ILE  12          HG23      ILE  12  10.764 -10.528   4.081
    9   HD11  ILE  12          HD11      ILE  12   9.562  -9.412   0.590
   10   HD13  ILE  12          HD12      ILE  12   8.475 -10.592   1.317
   11   HD12  ILE  12          HD13      ILE  12   8.759 -10.610  -0.410

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  13           H        ILE  13  14.071 -11.224   2.806
    2    HA   ILE  13           HA       ILE  13  14.094 -10.041   5.385
    3    HB   ILE  13           HB       ILE  13  16.170 -11.595   3.822
    4   HG12  ILE  13          HG12      ILE  13  13.902 -12.580   4.668
    5   HG13  ILE  13          HG13      ILE  13  15.386 -13.491   4.932
    6   HG23  ILE  13          HG21      ILE  13  17.544 -10.467   5.341
    7   HG22  ILE  13          HG22      ILE  13  17.151 -11.931   6.232
    8   HG21  ILE  13          HG23      ILE  13  16.308 -10.427   6.598
    9   HD11  ILE  13          HD11      ILE  13  14.235 -11.598   7.012
   10   HD13  ILE  13          HD12      ILE  13  15.508 -12.796   7.224
   11   HD12  ILE  13          HD13      ILE  13  13.850 -13.317   6.952

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ASN  14           H        ASN  14  16.043  -9.494   2.467
    2    HA   ASN  14           HA       ASN  14  17.766  -7.532   3.526
    3    HB2  ASN  14           HB2      ASN  14  17.758  -8.802   1.212
    4    HB3  ASN  14           HB3      ASN  14  16.850  -7.396   0.673
    5   HD21  ASN  14          HD21      ASN  14  19.295  -7.710  -0.511
    6   HD22  ASN  14          HD22      ASN  14  20.425  -6.614   0.115

  No H/Q in entry =           6
  In of MODEL   52
    1    H    SER  15           H        SER  15  14.653  -7.222   1.832
    2    HA   SER  15           HA       SER  15  14.508  -4.403   1.884
    3    HB2  SER  15           HB2      SER  15  12.180  -4.676   1.387
    4    HB3  SER  15           HB3      SER  15  12.992  -6.035   0.619
    5    HG   SER  15           HG       SER  15  11.198  -5.990   2.681

  No H/Q in entry =           5
  In of MODEL   52
    1    H    GLY  16           H        GLY  16  13.442  -6.872   4.191
    2    HA3  GLY  16           HA2      GLY  16  12.200  -5.134   6.045
    3    HA2  GLY  16           HA3      GLY  16  12.833  -6.735   6.409

  No H/Q in entry =           3
  In of MODEL   52
    1    H    GLN  17           H        GLN  17  15.540  -6.371   5.818
    2    HA   GLN  17           HA       GLN  17  16.481  -5.135   8.197
    3    HB2  GLN  17           HB2      GLN  17  17.744  -6.909   7.035
    4    HB3  GLN  17           HB3      GLN  17  18.011  -5.825   5.669
    5    HG2  GLN  17           HG2      GLN  17  19.258  -4.281   7.088
    6    HG3  GLN  17           HG3      GLN  17  18.922  -5.271   8.507
    7   HE21  GLN  17          HE21      GLN  17  21.612  -4.731   7.695
    8   HE22  GLN  17          HE22      GLN  17  22.310  -6.182   7.158

  No H/Q in entry =           8
  In of MODEL   52
    1    H    ALA  18           H        ALA  18  16.282  -4.065   4.836
    2    HA   ALA  18           HA       ALA  18  17.689  -1.655   5.060
    3    HB2  ALA  18           HB1      ALA  18  16.587  -2.886   2.993
    4    HB3  ALA  18           HB2      ALA  18  16.830  -1.140   2.975
    5    HB1  ALA  18           HB3      ALA  18  15.239  -1.804   3.345

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ARG  19           H        ARG  19  14.196  -2.284   5.455
    2    HA   ARG  19           HA       ARG  19  13.495   0.358   6.165
    3    HB2  ARG  19           HB2      ARG  19  11.836  -1.414   5.580
    4    HB3  ARG  19           HB3      ARG  19  12.186  -2.206   7.119
    5    HG2  ARG  19           HG2      ARG  19  11.451  -0.221   8.355
    6    HG3  ARG  19           HG3      ARG  19  11.191   0.650   6.845
    7    HD2  ARG  19           HD2      ARG  19   9.059  -0.172   7.664
    8    HD3  ARG  19           HD3      ARG  19   9.490  -1.048   6.190
    9    HE   ARG  19           HE       ARG  19  10.465  -2.575   8.298
   10   HH21  ARG  19          HH11      ARG  19   9.236  -4.229   9.239
   11   HH22  ARG  19          HH12      ARG  19   7.516  -4.223   9.067
   12   HH11  ARG  19          HH21      ARG  19   7.456  -1.321   7.199
   13   HH12  ARG  19          HH22      ARG  19   6.509  -2.577   7.907

  No H/Q in entry =          13
  In of MODEL   52
    1    H    SER  20           H        SER  20  14.386  -2.458   8.130
    2    HA   SER  20           HA       SER  20  14.087  -1.358  10.665
    3    HB2  SER  20           HB2      SER  20  14.582  -3.676  10.550
    4    HB3  SER  20           HB3      SER  20  16.029  -3.400   9.584
    5    HG   SER  20           HG       SER  20  15.587  -3.050  12.326

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LEU  21           H        LEU  21  16.931  -1.265   8.531
    2    HA   LEU  21           HA       LEU  21  18.586   0.244  10.268
    3    HB2  LEU  21           HB2      LEU  21  18.571  -0.035   7.255
    4    HB3  LEU  21           HB3      LEU  21  19.812   0.845   8.143
    5    HG   LEU  21           HG       LEU  21  19.112  -2.056   8.686
    6   HD11  LEU  21          HD11      LEU  21  21.176  -0.810   6.861
    7   HD13  LEU  21          HD12      LEU  21  19.970  -2.034   6.464
    8   HD12  LEU  21          HD13      LEU  21  21.343  -2.451   7.486
    9   HD21  LEU  21          HD21      LEU  21  21.180  -0.119   9.699
   10   HD23  LEU  21          HD22      LEU  21  21.618  -1.820   9.586
   11   HD22  LEU  21          HD23      LEU  21  20.269  -1.330  10.598

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ALA  22           H        ALA  22  16.313   1.181   7.709
    2    HA   ALA  22           HA       ALA  22  16.818   3.946   7.719
    3    HB3  ALA  22           HB1      ALA  22  15.432   2.684   6.042
    4    HB2  ALA  22           HB2      ALA  22  14.707   4.189   6.606
    5    HB1  ALA  22           HB3      ALA  22  14.134   2.644   7.235

  No H/Q in entry =           5
  In of MODEL   52
    1    H    TYR  23           H        TYR  23  14.342   2.103   9.555
    2    HA   TYR  23           HA       TYR  23  13.351   4.330  11.000
    3    HB2  TYR  23           HB2      TYR  23  12.141   2.201  10.981
    4    HB3  TYR  23           HB3      TYR  23  13.482   1.409  11.810
    5    HD1  TYR  23           HD1      TYR  23  10.945   4.124  12.163
    6    HD2  TYR  23           HD2      TYR  23  13.672   1.476  14.166
    7    HE1  TYR  23           HE1      TYR  23  10.004   4.810  14.354
    8    HE2  TYR  23           HE2      TYR  23  12.731   2.162  16.355
    9    HH   TYR  23           HH       TYR  23   9.995   4.435  16.548

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ALA  24           H        ALA  24  16.022   2.087  11.643
    2    HA   ALA  24           HA       ALA  24  16.678   3.094  14.205
    3    HB1  ALA  24           HB1      ALA  24  18.056   1.317  14.044
    4    HB3  ALA  24           HB2      ALA  24  19.074   2.248  12.945
    5    HB2  ALA  24           HB3      ALA  24  17.792   1.224  12.304

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ALA  25           H        ALA  25  17.628   4.029  10.926
    2    HA   ALA  25           HA       ALA  25  19.550   5.987  11.571
    3    HB1  ALA  25           HB1      ALA  25  18.846   5.027   9.256
    4    HB3  ALA  25           HB2      ALA  25  19.328   6.721   9.347
    5    HB2  ALA  25           HB3      ALA  25  17.619   6.294   9.277

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LEU  26           H        LEU  26  16.033   6.175  11.206
    2    HA   LEU  26           HA       LEU  26  15.777   8.955  11.653
    3    HB2  LEU  26           HB2      LEU  26  13.930   7.697  10.725
    4    HB3  LEU  26           HB3      LEU  26  13.850   6.670  12.151
    5    HG   LEU  26           HG       LEU  26  13.220   8.623  13.528
    6   HD12  LEU  26          HD11      LEU  26  12.537  10.714  12.199
    7   HD11  LEU  26          HD12      LEU  26  13.526  10.070  10.892
    8   HD13  LEU  26          HD13      LEU  26  14.265  10.466  12.444
    9   HD21  LEU  26          HD21      LEU  26  11.551   8.288  11.017
   10   HD23  LEU  26          HD22      LEU  26  10.981   8.981  12.533
   11   HD22  LEU  26          HD23      LEU  26  11.452   7.285  12.465

  No H/Q in entry =          11
  In of MODEL   52
    1    H    LYS  27           H        LYS  27  15.697   6.177  13.850
    2    HA   LYS  27           HA       LYS  27  15.087   7.540  16.215
    3    HB2  LYS  27           HB2      LYS  27  15.143   5.065  15.954
    4    HB3  LYS  27           HB3      LYS  27  16.905   5.136  15.912
    5    HG2  LYS  27           HG2      LYS  27  16.943   6.126  18.160
    6    HG3  LYS  27           HG3      LYS  27  15.176   6.125  18.204
    7    HD2  LYS  27           HD2      LYS  27  15.177   3.658  17.971
    8    HD3  LYS  27           HD3      LYS  27  16.942   3.666  17.961
    9    HE2  LYS  27           HE2      LYS  27  16.963   4.658  20.216
   10    HE3  LYS  27           HE3      LYS  27  15.197   4.680  20.229
   11    HZ3  LYS  27           HZ1      LYS  27  16.005   2.738  21.383
   12    HZ2  LYS  27           HZ2      LYS  27  16.927   2.266  20.034
   13    HZ1  LYS  27           HZ3      LYS  27  15.229   2.254  19.953

  No H/Q in entry =          13
  In of MODEL   52
    1    H    GLN  28           H        GLN  28  18.211   6.988  14.627
    2    HA   GLN  28           HA       GLN  28  19.882   8.092  16.617
    3    HB2  GLN  28           HB2      GLN  28  20.175   8.053  13.603
    4    HB3  GLN  28           HB3      GLN  28  21.457   8.526  14.718
    5    HG2  GLN  28           HG2      GLN  28  20.046   5.845  14.786
    6    HG3  GLN  28           HG3      GLN  28  21.602   6.128  14.007
    7   HE21  GLN  28          HE21      GLN  28  22.956   7.727  15.817
    8   HE22  GLN  28          HE22      GLN  28  23.112   6.931  17.308

  No H/Q in entry =           8
  In of MODEL   52
    1    H    ALA  29           H        ALA  29  18.118   9.553  13.921
    2    HA   ALA  29           HA       ALA  29  19.091  12.184  14.172
    3    HB2  ALA  29           HB1      ALA  29  17.388  12.802  12.698
    4    HB1  ALA  29           HB2      ALA  29  16.255  11.619  13.350
    5    HB3  ALA  29           HB3      ALA  29  17.591  11.088  12.329

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LYS  30           H        LYS  30  16.329  10.560  15.693
    2    HA   LYS  30           HA       LYS  30  15.292  12.805  17.046
    3    HB2  LYS  30           HB2      LYS  30  15.207   9.864  17.753
    4    HB3  LYS  30           HB3      LYS  30  14.329  11.108  18.644
    5    HG2  LYS  30           HG2      LYS  30  13.200  11.780  16.524
    6    HG3  LYS  30           HG3      LYS  30  14.017  10.451  15.700
    7    HD2  LYS  30           HD2      LYS  30  12.959   8.836  17.230
    8    HD3  LYS  30           HD3      LYS  30  12.151  10.154  18.078
    9    HE2  LYS  30           HE2      LYS  30  10.979  10.774  15.984
   10    HE3  LYS  30           HE3      LYS  30  11.767   9.426  15.155
   11    HZ2  LYS  30           HZ1      LYS  30   9.462   8.997  16.034
   12    HZ1  LYS  30           HZ2      LYS  30  10.127   9.058  17.601
   13    HZ3  LYS  30           HZ3      LYS  30  10.647   7.876  16.493

  No H/Q in entry =          13
  In of MODEL   52
    1    H    GLN  31           H        GLN  31  17.972  10.661  17.788
    2    HA   GLN  31           HA       GLN  31  18.288  11.682  20.481
    3    HB2  GLN  31           HB2      GLN  31  20.326  10.127  18.880
    4    HB3  GLN  31           HB3      GLN  31  20.189  10.253  20.634
    5    HG2  GLN  31           HG2      GLN  31  17.685   9.277  19.865
    6    HG3  GLN  31           HG3      GLN  31  18.795   8.441  18.787
    7   HE21  GLN  31          HE21      GLN  31  17.261   7.284  21.063
    8   HE22  GLN  31          HE22      GLN  31  18.421   6.635  22.115

  No H/Q in entry =           8
  In of MODEL   52
    1    H    GLY  32           H        GLY  32  18.798  13.000  17.513
    2    HA3  GLY  32           HA2      GLY  32  19.764  15.053  16.998
    3    HA2  GLY  32           HA3      GLY  32  20.520  15.067  18.586

  No H/Q in entry =           3
  In of MODEL   52
    1    H    ASP  33           H        ASP  33  20.969  12.176  16.813
    2    HA   ASP  33           HA       ASP  33  23.789  12.876  16.348
    3    HB2  ASP  33           HB2      ASP  33  22.304  10.247  16.467
    4    HB3  ASP  33           HB3      ASP  33  23.990  10.378  15.973

  No H/Q in entry =           4
  In of MODEL   52
    1    H    PHE  34           H        PHE  34  23.297  14.193  14.465
    2    HA   PHE  34           HA       PHE  34  21.959  13.194  12.178
    3    HB2  PHE  34           HB2      PHE  34  24.070  15.347  12.407
    4    HB3  PHE  34           HB3      PHE  34  23.089  15.046  10.975
    5    HD1  PHE  34           HD1      PHE  34  23.320  16.986  13.886
    6    HD2  PHE  34           HD2      PHE  34  20.464  14.841  11.501
    7    HE1  PHE  34           HE1      PHE  34  21.490  18.368  14.830
    8    HE2  PHE  34           HE2      PHE  34  18.638  16.223  12.447
    9    HZ   PHE  34           HZ       PHE  34  19.154  17.988  14.108

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ALA  35           H        ALA  35  25.334  13.038  13.189
    2    HA   ALA  35           HA       ALA  35  26.449  12.225  10.734
    3    HB3  ALA  35           HB1      ALA  35  28.139  11.073  12.456
    4    HB2  ALA  35           HB2      ALA  35  27.265  12.092  13.600
    5    HB1  ALA  35           HB3      ALA  35  28.096  12.821  12.227

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ALA  36           H        ALA  36  25.350  10.262  13.501
    2    HA   ALA  36           HA       ALA  36  25.859   7.777  12.229
    3    HB2  ALA  36           HB1      ALA  36  25.434   7.029  14.305
    4    HB3  ALA  36           HB2      ALA  36  23.741   7.508  14.153
    5    HB1  ALA  36           HB3      ALA  36  24.931   8.652  14.775

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ALA  37           H        ALA  37  23.017   9.876  12.357
    2    HA   ALA  37           HA       ALA  37  21.179   8.087  11.182
    3    HB3  ALA  37           HB1      ALA  37  21.375  11.052  11.471
    4    HB1  ALA  37           HB2      ALA  37  20.073   9.961  11.944
    5    HB2  ALA  37           HB3      ALA  37  20.259  10.433  10.254

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LYS  38           H        LYS  38  23.255  10.567   9.702
    2    HA   LYS  38           HA       LYS  38  22.622  10.129   7.025
    3    HB2  LYS  38           HB2      LYS  38  24.414  11.707   8.469
    4    HB3  LYS  38           HB3      LYS  38  25.458  10.727   7.446
    5    HG2  LYS  38           HG2      LYS  38  24.288  11.483   5.448
    6    HG3  LYS  38           HG3      LYS  38  23.083  12.326   6.427
    7    HD2  LYS  38           HD2      LYS  38  24.661  13.942   7.178
    8    HD3  LYS  38           HD3      LYS  38  26.032  12.969   6.645
    9    HE2  LYS  38           HE2      LYS  38  25.657  14.835   5.091
   10    HE3  LYS  38           HE3      LYS  38  25.339  13.293   4.288
   11    HZ3  LYS  38           HZ1      LYS  38  23.138  13.714   4.156
   12    HZ2  LYS  38           HZ2      LYS  38  23.643  15.335   4.242
   13    HZ1  LYS  38           HZ3      LYS  38  23.076  14.547   5.635

  No H/Q in entry =          13
  In of MODEL   52
    1    H    ALA  39           H        ALA  39  25.151   8.560   8.985
    2    HA   ALA  39           HA       ALA  39  26.239   6.981   6.918
    3    HB2  ALA  39           HB1      ALA  39  26.158   6.020   9.763
    4    HB1  ALA  39           HB2      ALA  39  27.096   7.455   9.346
    5    HB3  ALA  39           HB3      ALA  39  27.464   5.908   8.585

  No H/Q in entry =           5
  In of MODEL   52
    1    H    MET  40           H        MET  40  23.631   6.340   9.215
    2    HA   MET  40           HA       MET  40  23.217   3.629   8.484
    3    HB2  MET  40           HB2      MET  40  21.378   5.655   9.772
    4    HB3  MET  40           HB3      MET  40  20.990   3.941   9.599
    5    HG2  MET  40           HG2      MET  40  23.528   4.912  10.941
    6    HG3  MET  40           HG3      MET  40  22.036   4.621  11.833
    7    HE3  MET  40           HE1      MET  40  21.512   0.981  12.013
    8    HE2  MET  40           HE2      MET  40  20.630   2.273  11.203
    9    HE1  MET  40           HE3      MET  40  21.366   2.571  12.776

  No H/Q in entry =           9
  In of MODEL   52
    1    H    MET  41           H        MET  41  21.771   6.665   7.292
    2    HA   MET  41           HA       MET  41  19.829   5.446   5.620
    3    HB2  MET  41           HB2      MET  41  21.281   8.052   5.104
    4    HB3  MET  41           HB3      MET  41  19.759   7.541   4.385
    5    HG2  MET  41           HG2      MET  41  19.014   7.347   6.936
    6    HG3  MET  41           HG3      MET  41  20.309   8.520   7.158
    7    HE2  MET  41           HE1      MET  41  19.735   9.797   3.819
    8    HE1  MET  41           HE2      MET  41  20.685  10.249   5.231
    9    HE3  MET  41           HE3      MET  41  19.401  11.313   4.664

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ASP  42           H        ASP  42  23.191   6.407   5.068
    2    HA   ASP  42           HA       ASP  42  23.290   5.930   2.311
    3    HB2  ASP  42           HB2      ASP  42  25.029   6.950   4.080
    4    HB3  ASP  42           HB3      ASP  42  25.704   5.331   3.955

  No H/Q in entry =           4
  In of MODEL   52
    1    H    GLN  43           H        GLN  43  24.037   3.787   5.035
    2    HA   GLN  43           HA       GLN  43  24.728   1.535   3.455
    3    HB2  GLN  43           HB2      GLN  43  23.701   1.711   6.298
    4    HB3  GLN  43           HB3      GLN  43  24.298   0.227   5.545
    5    HG2  GLN  43           HG2      GLN  43  26.447   1.462   5.034
    6    HG3  GLN  43           HG3      GLN  43  25.849   2.784   6.032
    7   HE21  GLN  43          HE21      GLN  43  28.092   1.837   7.071
    8   HE22  GLN  43          HE22      GLN  43  27.829   0.753   8.349

  No H/Q in entry =           8
  In of MODEL   52
    1    H    SER  44           H        SER  44  21.658   2.636   4.837
    2    HA   SER  44           HA       SER  44  20.116   0.374   4.166
    3    HB2  SER  44           HB2      SER  44  19.644   2.899   5.308
    4    HB3  SER  44           HB3      SER  44  18.612   2.843   3.882
    5    HG   SER  44           HG       SER  44  17.528   1.889   5.605

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ARG  45           H        ARG  45  20.826   3.345   2.358
    2    HA   ARG  45           HA       ARG  45  19.308   2.839   0.053
    3    HB2  ARG  45           HB2      ARG  45  20.427   4.988   0.635
    4    HB3  ARG  45           HB3      ARG  45  21.981   4.251   0.251
    5    HG2  ARG  45           HG2      ARG  45  21.203   3.833  -2.063
    6    HG3  ARG  45           HG3      ARG  45  19.662   4.594  -1.678
    7    HD2  ARG  45           HD2      ARG  45  20.888   6.706  -1.096
    8    HD3  ARG  45           HD3      ARG  45  22.394   5.948  -1.663
    9    HE   ARG  45           HE       ARG  45  20.467   5.686  -3.699
   10   HH21  ARG  45          HH11      ARG  45  20.446   7.053  -5.465
   11   HH22  ARG  45          HH12      ARG  45  21.186   8.612  -5.362
   12   HH11  ARG  45          HH21      ARG  45  22.169   8.206  -2.075
   13   HH12  ARG  45          HH22      ARG  45  22.160   9.264  -3.440

  No H/Q in entry =          13
  In of MODEL   52
    1    H    MET  46           H        MET  46  22.681   2.002   0.803
    2    HA   MET  46           HA       MET  46  23.301   0.813  -1.679
    3    HB2  MET  46           HB2      MET  46  24.410   0.480   1.111
    4    HB3  MET  46           HB3      MET  46  25.086  -0.374  -0.281
    5    HG2  MET  46           HG2      MET  46  25.464   1.776  -1.427
    6    HG3  MET  46           HG3      MET  46  24.772   2.636  -0.058
    7    HE3  MET  46           HE1      MET  46  28.451   3.449  -0.300
    8    HE2  MET  46           HE2      MET  46  27.370   4.063   0.946
    9    HE1  MET  46           HE3      MET  46  26.774   3.848  -0.698

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ALA  47           H        ALA  47  21.931  -0.531   1.298
    2    HA   ALA  47           HA       ALA  47  21.906  -3.245   0.499
    3    HB2  ALA  47           HB1      ALA  47  21.522  -2.786   2.803
    4    HB3  ALA  47           HB2      ALA  47  19.992  -3.405   2.184
    5    HB1  ALA  47           HB3      ALA  47  20.204  -1.672   2.440

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LEU  48           H        LEU  48  19.527  -0.643   0.138
    2    HA   LEU  48           HA       LEU  48  17.498  -2.199  -1.111
    3    HB2  LEU  48           HB2      LEU  48  18.122   0.761  -1.230
    4    HB3  LEU  48           HB3      LEU  48  16.658   0.035  -1.895
    5    HG   LEU  48           HG       LEU  48  17.515  -0.254   0.994
    6   HD13  LEU  48          HD11      LEU  48  17.074   2.042   0.803
    7   HD12  LEU  48          HD12      LEU  48  15.522   1.380   1.314
    8   HD11  LEU  48          HD13      LEU  48  15.789   1.802  -0.378
    9   HD22  LEU  48          HD21      LEU  48  16.003  -1.984   0.616
   10   HD21  LEU  48          HD22      LEU  48  15.120  -1.092  -0.624
   11   HD23  LEU  48          HD23      LEU  48  14.904  -0.687   1.079

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ASN  49           H        ASN  49  20.166  -0.247  -2.345
    2    HA   ASN  49           HA       ASN  49  19.515  -0.341  -5.068
    3    HB2  ASN  49           HB2      ASN  49  21.185   1.187  -4.122
    4    HB3  ASN  49           HB3      ASN  49  22.234  -0.171  -3.734
    5   HD21  ASN  49          HD21      ASN  49  23.928   0.637  -5.139
    6   HD22  ASN  49          HD22      ASN  49  23.783   0.574  -6.829

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLU  50           H        GLU  50  21.522  -2.513  -3.103
    2    HA   GLU  50           HA       GLU  50  22.240  -4.265  -5.226
    3    HB2  GLU  50           HB2      GLU  50  23.438  -4.225  -3.060
    4    HB3  GLU  50           HB3      GLU  50  22.002  -4.865  -2.263
    5    HG2  GLU  50           HG2      GLU  50  22.110  -6.899  -3.618
    6    HG3  GLU  50           HG3      GLU  50  23.480  -6.255  -4.521

  No H/Q in entry =           6
  In of MODEL   52
    1    H    ALA  51           H        ALA  51  19.584  -4.221  -2.899
    2    HA   ALA  51           HA       ALA  51  18.441  -6.707  -3.651
    3    HB3  ALA  51           HB1      ALA  51  16.845  -6.214  -2.096
    4    HB1  ALA  51           HB2      ALA  51  16.615  -4.571  -2.697
    5    HB2  ALA  51           HB3      ALA  51  17.979  -4.942  -1.641

  No H/Q in entry =           5
  In of MODEL   52
    1    H    HIS  52           H        HIS  52  17.822  -3.367  -4.692
    2    HA   HIS  52           HA       HIS  52  15.713  -3.917  -6.490
    3    HB2  HIS  52           HB2      HIS  52  16.317  -1.645  -5.705
    4    HB3  HIS  52           HB3      HIS  52  17.798  -1.728  -6.659
    5    HD1  HIS  52           HD1      HIS  52  17.441  -2.021  -9.319
    6    HD2  HIS  52           HD2      HIS  52  14.067  -0.877  -7.156
    7    HE1  HIS  52           HE1      HIS  52  15.776  -1.127 -11.006
    8    HE2  HIS  52           HE2      HIS  52  13.714  -0.425  -9.703

  No H/Q in entry =           8
  In of MODEL   52
    1    H    LEU  53           H        LEU  53  19.232  -3.890  -6.924
    2    HA   LEU  53           HA       LEU  53  19.290  -4.210  -9.724
    3    HB2  LEU  53           HB2      LEU  53  21.232  -4.950  -7.549
    4    HB3  LEU  53           HB3      LEU  53  21.551  -5.334  -9.239
    5    HG   LEU  53           HG       LEU  53  20.849  -2.530  -8.315
    6   HD12  LEU  53          HD11      LEU  53  23.294  -2.076  -8.452
    7   HD11  LEU  53          HD12      LEU  53  23.577  -3.800  -8.690
    8   HD13  LEU  53          HD13      LEU  53  22.900  -3.220  -7.173
    9   HD21  LEU  53          HD21      LEU  53  21.958  -3.750 -10.851
   10   HD23  LEU  53          HD22      LEU  53  22.252  -2.059 -10.461
   11   HD22  LEU  53          HD23      LEU  53  20.610  -2.632 -10.688

  No H/Q in entry =          11
  In of MODEL   52
    1    H    VAL  54           H        VAL  54  19.203  -6.592  -7.093
    2    HA   VAL  54           HA       VAL  54  19.348  -8.889  -8.748
    3    HB   VAL  54           HB       VAL  54  18.191  -8.471  -5.981
    4   HG12  VAL  54          HG11      VAL  54  18.542 -11.085  -5.971
    5   HG11  VAL  54          HG12      VAL  54  18.355 -10.923  -7.717
    6   HG13  VAL  54          HG13      VAL  54  17.061 -10.403  -6.639
    7   HG22  VAL  54          HG21      VAL  54  20.505  -8.236  -5.760
    8   HG21  VAL  54          HG22      VAL  54  20.853  -9.328  -7.099
    9   HG23  VAL  54          HG23      VAL  54  20.330  -9.977  -5.545

  No H/Q in entry =           9
  In of MODEL   52
    1    H    GLN  55           H        GLN  55  16.602  -7.011  -7.468
    2    HA   GLN  55           HA       GLN  55  14.597  -8.699  -8.537
    3    HB2  GLN  55           HB2      GLN  55  13.834  -7.177  -6.913
    4    HB3  GLN  55           HB3      GLN  55  14.612  -5.803  -7.692
    5    HG2  GLN  55           HG2      GLN  55  12.884  -5.499  -9.182
    6    HG3  GLN  55           HG3      GLN  55  12.580  -7.224  -9.348
    7   HE21  GLN  55          HE21      GLN  55  10.579  -7.792  -8.540
    8   HE22  GLN  55          HE22      GLN  55   9.798  -7.043  -7.233

  No H/Q in entry =           8
  In of MODEL   52
    1    H    THR  56           H        THR  56  16.306  -5.884  -9.903
    2    HA   THR  56           HA       THR  56  14.863  -5.542 -12.252
    3    HB   THR  56           HB       THR  56  17.881  -5.422 -12.093
    4    HG1  THR  56           HG1      THR  56  15.913  -3.938 -10.874
    5   HG21  THR  56          HG21      THR  56  16.471  -5.134 -14.291
    6   HG23  THR  56          HG22      THR  56  17.763  -3.990 -13.927
    7   HG22  THR  56          HG23      THR  56  16.083  -3.556 -13.606

  No H/Q in entry =           7
  In of MODEL   52
    1    H    LYS  57           H        LYS  57  17.538  -7.809 -11.637
    2    HA   LYS  57           HA       LYS  57  17.550  -9.010 -14.212
    3    HB2  LYS  57           HB2      LYS  57  19.344  -9.239 -12.468
    4    HB3  LYS  57           HB3      LYS  57  18.250 -10.244 -11.528
    5    HG2  LYS  57           HG2      LYS  57  18.159 -11.888 -13.343
    6    HG3  LYS  57           HG3      LYS  57  19.209 -10.882 -14.334
    7    HD2  LYS  57           HD2      LYS  57  21.009 -11.103 -12.651
    8    HD3  LYS  57           HD3      LYS  57  19.965 -12.133 -11.673
    9    HE2  LYS  57           HE2      LYS  57  19.842 -13.778 -13.506
   10    HE3  LYS  57           HE3      LYS  57  20.861 -12.754 -14.517
   11    HZ2  LYS  57           HZ1      LYS  57  22.061 -14.561 -13.352
   12    HZ1  LYS  57           HZ2      LYS  57  21.688 -13.811 -11.874
   13    HZ3  LYS  57           HZ3      LYS  57  22.661 -13.011 -13.013

  No H/Q in entry =          13
  In of MODEL   52
    1    H    LEU  58           H        LEU  58  15.778  -9.690 -11.234
    2    HA   LEU  58           HA       LEU  58  14.583 -12.079 -12.162
    3    HB2  LEU  58           HB2      LEU  58  13.768 -10.177  -9.970
    4    HB3  LEU  58           HB3      LEU  58  12.978 -11.725 -10.282
    5    HG   LEU  58           HG       LEU  58  15.948 -11.412  -9.731
    6   HD11  LEU  58          HD11      LEU  58  13.584 -11.852  -7.935
    7   HD13  LEU  58          HD12      LEU  58  15.026 -10.871  -7.676
    8   HD12  LEU  58          HD13      LEU  58  15.118 -12.626  -7.537
    9   HD22  LEU  58          HD21      LEU  58  15.853 -13.477 -10.753
   10   HD21  LEU  58          HD22      LEU  58  14.142 -13.705 -10.391
   11   HD23  LEU  58          HD23      LEU  58  15.355 -13.990  -9.142

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  59           H        ILE  59  13.873  -8.751 -12.852
    2    HA   ILE  59           HA       ILE  59  11.165  -9.433 -13.789
    3    HB   ILE  59           HB       ILE  59  11.942  -7.140 -12.588
    4   HG12  ILE  59          HG12      ILE  59  10.041  -7.043 -14.942
    5   HG13  ILE  59          HG13      ILE  59   9.625  -7.811 -13.431
    6   HG21  ILE  59          HG21      ILE  59  13.484  -6.730 -14.648
    7   HG23  ILE  59          HG22      ILE  59  12.497  -5.400 -14.087
    8   HG22  ILE  59          HG23      ILE  59  12.008  -6.335 -15.496
    9   HD11  ILE  59          HD11      ILE  59  10.485  -4.933 -13.734
   10   HD13  ILE  59          HD12      ILE  59  10.042  -5.711 -12.215
   11   HD12  ILE  59          HD13      ILE  59   8.827  -5.478 -13.473

  No H/Q in entry =          11
  In of MODEL   52
    1    H    GLU  60           H        GLU  60  14.358  -8.548 -15.052
    2    HA   GLU  60           HA       GLU  60  13.571  -8.163 -17.760
    3    HB2  GLU  60           HB2      GLU  60  15.746  -7.410 -16.889
    4    HB3  GLU  60           HB3      GLU  60  16.228  -9.084 -16.626
    5    HG2  GLU  60           HG2      GLU  60  16.022  -9.531 -19.047
    6    HG3  GLU  60           HG3      GLU  60  15.538  -7.857 -19.313

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLY  61           H        GLY  61  14.582 -11.029 -15.939
    2    HA3  GLY  61           HA2      GLY  61  14.058 -12.688 -18.336
    3    HA2  GLY  61           HA3      GLY  61  15.096 -13.155 -16.993

  No H/Q in entry =           3
  In of MODEL   52
    1    H    ASP  62           H        ASP  62  11.959 -11.643 -16.624
    2    HA   ASP  62           HA       ASP  62  11.063 -13.713 -14.865
    3    HB2  ASP  62           HB2      ASP  62   9.002 -12.370 -14.751
    4    HB3  ASP  62           HB3      ASP  62  10.440 -11.387 -14.500

  No H/Q in entry =           4
  In of MODEL   52
    1    H    ALA  63           H        ALA  63  11.389 -15.431 -16.699
    2    HA   ALA  63           HA       ALA  63   9.477 -15.621 -18.812
    3    HB1  ALA  63           HB1      ALA  63  11.717 -16.911 -18.435
    4    HB2  ALA  63           HB2      ALA  63  10.374 -17.741 -19.215
    5    HB3  ALA  63           HB3      ALA  63  10.717 -18.030 -17.510

  No H/Q in entry =           5
  In of MODEL   52
    1    H    GLY  64           H        GLY  64   9.583 -16.814 -15.498
    2    HA3  GLY  64           HA2      GLY  64   7.875 -17.422 -14.069
    3    HA2  GLY  64           HA3      GLY  64   6.722 -16.974 -15.318

  No H/Q in entry =           3
  In of MODEL   52
    1    H    GLU  65           H        GLU  65   6.080 -19.159 -13.905
    2    HA   GLU  65           HA       GLU  65   7.178 -21.589 -14.833
    3    HB2  GLU  65           HB2      GLU  65   4.512 -20.964 -13.573
    4    HB3  GLU  65           HB3      GLU  65   5.066 -22.601 -13.923
    5    HG2  GLU  65           HG2      GLU  65   7.033 -22.275 -12.512
    6    HG3  GLU  65           HG3      GLU  65   6.570 -20.601 -12.211

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLY  66           H        GLY  66   4.499 -19.665 -15.934
    2    HA3  GLY  66           HA2      GLY  66   3.657 -21.534 -17.978
    3    HA2  GLY  66           HA3      GLY  66   2.953 -19.967 -17.634

  No H/Q in entry =           3
  In of MODEL   52
    1    H    LYS  67           H        LYS  67   2.926 -20.064 -20.055
    2    HA   LYS  67           HA       LYS  67   5.186 -19.966 -21.657
    3    HB2  LYS  67           HB2      LYS  67   2.438 -18.786 -22.029
    4    HB3  LYS  67           HB3      LYS  67   3.665 -18.813 -23.302
    5    HG2  LYS  67           HG2      LYS  67   3.832 -21.240 -23.155
    6    HG3  LYS  67           HG3      LYS  67   2.723 -21.266 -21.788
    7    HD2  LYS  67           HD2      LYS  67   1.379 -21.844 -23.651
    8    HD3  LYS  67           HD3      LYS  67   1.032 -20.136 -23.373
    9    HE2  LYS  67           HE2      LYS  67   2.534 -19.466 -25.137
   10    HE3  LYS  67           HE3      LYS  67   3.138 -21.112 -25.318
   11    HZ2  LYS  67           HZ1      LYS  67   0.761 -19.911 -26.386
   12    HZ1  LYS  67           HZ2      LYS  67   0.461 -21.392 -25.614
   13    HZ3  LYS  67           HZ3      LYS  67   1.587 -21.306 -26.884

  No H/Q in entry =          13
  In of MODEL   52
    1    H    MET  68           H        MET  68   3.373 -17.118 -22.008
    2    HA   MET  68           HA       MET  68   5.710 -15.437 -21.965
    3    HB2  MET  68           HB2      MET  68   2.792 -14.909 -22.514
    4    HB3  MET  68           HB3      MET  68   4.042 -13.668 -22.606
    5    HG2  MET  68           HG2      MET  68   5.191 -14.830 -24.359
    6    HG3  MET  68           HG3      MET  68   4.204 -16.274 -24.135
    7    HE2  MET  68           HE1      MET  68   2.728 -12.188 -25.578
    8    HE1  MET  68           HE2      MET  68   4.109 -12.558 -24.549
    9    HE3  MET  68           HE3      MET  68   2.477 -12.667 -23.893

  No H/Q in entry =           9
  In of MODEL   52
    1    H    LYS  69           H        LYS  69   3.641 -16.388 -19.480
    2    HA   LYS  69           HA       LYS  69   3.259 -13.925 -18.132
    3    HB2  LYS  69           HB2      LYS  69   3.108 -16.787 -17.198
    4    HB3  LYS  69           HB3      LYS  69   2.710 -15.414 -16.163
    5    HG2  LYS  69           HG2      LYS  69   1.036 -14.647 -17.790
    6    HG3  LYS  69           HG3      LYS  69   1.445 -15.992 -18.857
    7    HD2  LYS  69           HD2      LYS  69   0.752 -17.585 -17.090
    8    HD3  LYS  69           HD3      LYS  69   0.299 -16.226 -16.058
    9    HE2  LYS  69           HE2      LYS  69  -0.858 -16.726 -18.816
   10    HE3  LYS  69           HE3      LYS  69  -1.641 -17.208 -17.313
   11    HZ1  LYS  69           HZ1      LYS  69  -1.152 -14.683 -16.759
   12    HZ3  LYS  69           HZ2      LYS  69  -2.572 -15.182 -17.547
   13    HZ2  LYS  69           HZ3      LYS  69  -1.276 -14.548 -18.445

  No H/Q in entry =          13
  In of MODEL   52
    1    H    VAL  70           H        VAL  70   3.930 -14.251 -15.492
    2    HA   VAL  70           HA       VAL  70   6.888 -14.366 -15.425
    3    HB   VAL  70           HB       VAL  70   6.865 -12.359 -13.974
    4   HG11  VAL  70          HG11      VAL  70   7.024 -12.328 -16.564
    5   HG13  VAL  70          HG12      VAL  70   6.690 -10.802 -15.743
    6   HG12  VAL  70          HG13      VAL  70   5.379 -11.694 -16.514
    7   HG21  VAL  70          HG21      VAL  70   4.550 -12.610 -13.101
    8   HG23  VAL  70          HG22      VAL  70   3.917 -12.251 -14.706
    9   HG22  VAL  70          HG23      VAL  70   4.785 -11.010 -13.805

  No H/Q in entry =           9
  In of MODEL   52
    1    H    SER  71           H        SER  71   7.731 -14.583 -13.214
    2    HA   SER  71           HA       SER  71   6.470 -16.649 -11.733
    3    HB2  SER  71           HB2      SER  71   8.917 -16.248 -11.717
    4    HB3  SER  71           HB3      SER  71   8.651 -14.739 -10.849
    5    HG   SER  71           HG       SER  71   7.636 -17.213  -9.929

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LEU  72           H        LEU  72   5.136 -16.579  -9.985
    2    HA   LEU  72           HA       LEU  72   3.560 -14.283  -9.545
    3    HB2  LEU  72           HB2      LEU  72   3.877 -16.832  -7.969
    4    HB3  LEU  72           HB3      LEU  72   2.694 -15.588  -7.572
    5    HG   LEU  72           HG       LEU  72   2.869 -16.890 -10.310
    6   HD12  LEU  72          HD11      LEU  72   0.876 -18.202  -9.560
    7   HD11  LEU  72          HD12      LEU  72   1.124 -17.582  -7.929
    8   HD13  LEU  72          HD13      LEU  72   2.343 -18.616  -8.673
    9   HD23  LEU  72          HD21      LEU  72   0.366 -16.100 -10.197
   10   HD22  LEU  72          HD22      LEU  72   1.601 -14.907 -10.561
   11   HD21  LEU  72          HD23      LEU  72   0.941 -15.020  -8.932

  No H/Q in entry =          11
  In of MODEL   52
    1    H    VAL  73           H        VAL  73   6.233 -15.686  -7.769
    2    HA   VAL  73           HA       VAL  73   6.155 -14.150  -5.440
    3    HB   VAL  73           HB       VAL  73   8.307 -14.971  -4.983
    4   HG12  VAL  73          HG11      VAL  73   7.256 -17.012  -6.947
    5   HG11  VAL  73          HG12      VAL  73   6.440 -16.683  -5.418
    6   HG13  VAL  73          HG13      VAL  73   8.095 -17.292  -5.422
    7   HG23  VAL  73          HG21      VAL  73   9.716 -15.933  -6.892
    8   HG22  VAL  73          HG22      VAL  73   9.565 -14.176  -6.853
    9   HG21  VAL  73          HG23      VAL  73   8.603 -15.118  -7.992

  No H/Q in entry =           9
  In of MODEL   52
    1    H    LEU  74           H        LEU  74   7.135 -13.250  -8.617
    2    HA   LEU  74           HA       LEU  74   9.059 -11.279  -8.128
    3    HB2  LEU  74           HB2      LEU  74   8.609 -12.040 -10.365
    4    HB3  LEU  74           HB3      LEU  74   6.939 -11.486 -10.266
    5    HG   LEU  74           HG       LEU  74   7.724  -9.151 -10.056
    6   HD12  LEU  74          HD11      LEU  74  10.220  -8.832 -10.646
    7   HD11  LEU  74          HD12      LEU  74  10.418 -10.516 -10.164
    8   HD13  LEU  74          HD13      LEU  74   9.843  -9.326  -8.996
    9   HD21  LEU  74          HD21      LEU  74   7.495 -10.592 -12.273
   10   HD23  LEU  74          HD22      LEU  74   9.204 -10.236 -12.369
   11   HD22  LEU  74          HD23      LEU  74   8.053  -8.920 -12.314

  No H/Q in entry =          11
  In of MODEL   52
    1    H    VAL  75           H        VAL  75   5.559 -10.934  -8.483
    2    HA   VAL  75           HA       VAL  75   5.432  -8.178  -7.901
    3    HB   VAL  75           HB       VAL  75   3.368 -10.347  -7.518
    4   HG13  VAL  75          HG11      VAL  75   2.852  -8.449  -6.033
    5   HG12  VAL  75          HG12      VAL  75   1.773  -8.409  -7.419
    6   HG11  VAL  75          HG13      VAL  75   3.147  -7.315  -7.348
    7   HG23  VAL  75          HG21      VAL  75   3.692  -8.183  -9.624
    8   HG22  VAL  75          HG22      VAL  75   2.479  -9.461  -9.613
    9   HG21  VAL  75          HG23      VAL  75   4.181  -9.861  -9.848

  No H/Q in entry =           9
  In of MODEL   52
    1    H    GLU  76           H        GLU  76   5.209 -11.054  -5.787
    2    HA   GLU  76           HA       GLU  76   4.722  -9.694  -3.368
    3    HB2  GLU  76           HB2      GLU  76   4.569 -12.158  -3.585
    4    HB3  GLU  76           HB3      GLU  76   6.302 -12.246  -3.846
    5    HG2  GLU  76           HG2      GLU  76   5.893 -12.827  -1.542
    6    HG3  GLU  76           HG3      GLU  76   6.629 -11.234  -1.543

  No H/Q in entry =           6
  In of MODEL   52
    1    H    ALA  77           H        ALA  77   7.793 -10.570  -4.927
    2    HA   ALA  77           HA       ALA  77   9.469  -9.504  -2.912
    3    HB2  ALA  77           HB1      ALA  77  11.146  -9.361  -4.865
    4    HB3  ALA  77           HB2      ALA  77   9.869 -10.089  -5.838
    5    HB1  ALA  77           HB3      ALA  77  10.515 -10.953  -4.444

  No H/Q in entry =           5
  In of MODEL   52
    1    H    GLN  78           H        GLN  78   8.064  -8.108  -5.830
    2    HA   GLN  78           HA       GLN  78   9.390  -5.614  -5.728
    3    HB2  GLN  78           HB2      GLN  78   8.105  -6.546  -7.685
    4    HB3  GLN  78           HB3      GLN  78   6.618  -6.181  -6.812
    5    HG2  GLN  78           HG2      GLN  78   7.247  -3.804  -6.724
    6    HG3  GLN  78           HG3      GLN  78   8.738  -4.161  -7.593
    7   HE21  GLN  78          HE21      GLN  78   6.782  -2.363  -8.681
    8   HE22  GLN  78          HE22      GLN  78   6.109  -3.086 -10.061

  No H/Q in entry =           8
  In of MODEL   52
    1    H    LEU  79           H        LEU  79   6.381  -6.781  -4.300
    2    HA   LEU  79           HA       LEU  79   5.361  -4.382  -3.296
    3    HB2  LEU  79           HB2      LEU  79   4.068  -6.447  -3.239
    4    HB3  LEU  79           HB3      LEU  79   5.219  -7.173  -2.120
    5    HG   LEU  79           HG       LEU  79   4.647  -5.534  -0.397
    6   HD13  LEU  79          HD11      LEU  79   4.162  -3.526  -1.452
    7   HD12  LEU  79          HD12      LEU  79   2.541  -4.067  -1.014
    8   HD11  LEU  79          HD13      LEU  79   3.127  -4.287  -2.661
    9   HD23  LEU  79          HD21      LEU  79   2.066  -6.052  -0.310
   10   HD22  LEU  79          HD22      LEU  79   3.219  -7.380  -0.197
   11   HD21  LEU  79          HD23      LEU  79   2.404  -7.054  -1.724

  No H/Q in entry =          11
  In of MODEL   52
    1    H    HIS  80           H        HIS  80   7.565  -6.692  -1.706
    2    HA   HIS  80           HA       HIS  80   7.833  -5.143   0.661
    3    HB2  HIS  80           HB2      HIS  80   9.197  -7.495  -0.532
    4    HB3  HIS  80           HB3      HIS  80  10.097  -6.587   0.685
    5    HD1  HIS  80           HD1      HIS  80   9.609  -7.224   3.028
    6    HD2  HIS  80           HD2      HIS  80   6.405  -8.111   0.512
    7    HE1  HIS  80           HE1      HIS  80   7.846  -8.342   4.476
    8    HE2  HIS  80           HE2      HIS  80   5.887  -8.887   2.950

  No H/Q in entry =           8
  In of MODEL   52
    1    H    LEU  81           H        LEU  81   9.846  -5.404  -2.248
    2    HA   LEU  81           HA       LEU  81  11.871  -3.641  -1.368
    3    HB2  LEU  81           HB2      LEU  81  10.964  -4.448  -4.132
    4    HB3  LEU  81           HB3      LEU  81  12.373  -3.427  -3.841
    5    HG   LEU  81           HG       LEU  81  12.005  -6.150  -2.563
    6   HD12  LEU  81          HD11      LEU  81  13.830  -6.761  -4.308
    7   HD11  LEU  81          HD12      LEU  81  13.252  -5.344  -5.183
    8   HD13  LEU  81          HD13      LEU  81  12.153  -6.679  -4.845
    9   HD23  LEU  81          HD21      LEU  81  14.630  -5.809  -2.544
   10   HD22  LEU  81          HD22      LEU  81  13.638  -5.056  -1.297
   11   HD21  LEU  81          HD23      LEU  81  14.210  -4.101  -2.665

  No H/Q in entry =          11
  In of MODEL   52
    1    H    MET  82           H        MET  82   8.947  -3.036  -3.312
    2    HA   MET  82           HA       MET  82   9.461  -0.306  -3.817
    3    HB2  MET  82           HB2      MET  82   6.917  -1.924  -3.694
    4    HB3  MET  82           HB3      MET  82   6.901  -0.200  -4.061
    5    HG2  MET  82           HG2      MET  82   8.524  -2.261  -5.590
    6    HG3  MET  82           HG3      MET  82   6.952  -1.655  -6.106
    7    HE3  MET  82           HE1      MET  82   7.370   1.802  -7.283
    8    HE2  MET  82           HE2      MET  82   6.994   1.575  -5.577
    9    HE1  MET  82           HE3      MET  82   6.342   0.457  -6.771

  No H/Q in entry =           9
  In of MODEL   52
    1    H    THR  83           H        THR  83   7.679  -1.917  -1.212
    2    HA   THR  83           HA       THR  83   6.804   0.426   0.108
    3    HB   THR  83           HB       THR  83   6.680  -1.146   2.129
    4    HG1  THR  83           HG1      THR  83   7.455  -3.090   1.904
    5   HG22  THR  83          HG21      THR  83   5.044  -2.730   0.660
    6   HG21  THR  83          HG22      THR  83   5.261  -1.401  -0.474
    7   HG23  THR  83          HG23      THR  83   4.614  -1.089   1.137

  No H/Q in entry =           7
  In of MODEL   52
    1    H    SER  84           H        SER  84   9.646  -1.645   0.639
    2    HA   SER  84           HA       SER  84  10.687  -0.201   2.826
    3    HB2  SER  84           HB2      SER  84  11.962  -2.036   0.807
    4    HB3  SER  84           HB3      SER  84  12.899  -1.272   2.089
    5    HG   SER  84           HG       SER  84  10.639  -2.982   2.347

  No H/Q in entry =           5
  In of MODEL   52
    1    H    MET  85           H        MET  85  11.445   0.060  -0.661
    2    HA   MET  85           HA       MET  85  13.426   2.043  -0.409
    3    HB2  MET  85           HB2      MET  85  13.042   0.753  -2.473
    4    HB3  MET  85           HB3      MET  85  11.511   1.597  -2.707
    5    HG2  MET  85           HG2      MET  85  12.708   3.752  -2.818
    6    HG3  MET  85           HG3      MET  85  14.238   2.915  -2.573
    7    HE1  MET  85           HE1      MET  85  11.678   4.205  -4.926
    8    HE3  MET  85           HE2      MET  85  10.961   2.602  -4.789
    9    HE2  MET  85           HE3      MET  85  11.647   3.120  -6.325

  No H/Q in entry =           9
  In of MODEL   52
    1    H    LEU  86           H        LEU  86   9.934   2.347  -0.926
    2    HA   LEU  86           HA       LEU  86   9.846   5.159  -1.112
    3    HB2  LEU  86           HB2      LEU  86   8.018   3.482  -1.689
    4    HB3  LEU  86           HB3      LEU  86   7.685   3.393   0.040
    5    HG   LEU  86           HG       LEU  86   7.502   5.952  -0.017
    6   HD11  LEU  86          HD11      LEU  86   8.288   5.518  -2.717
    7   HD13  LEU  86          HD12      LEU  86   7.837   7.043  -1.960
    8   HD12  LEU  86          HD13      LEU  86   6.611   6.068  -2.766
    9   HD23  LEU  86          HD21      LEU  86   5.384   4.578  -1.682
   10   HD22  LEU  86          HD22      LEU  86   5.180   5.839  -0.468
   11   HD21  LEU  86          HD23      LEU  86   5.593   4.199   0.029

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ALA  87           H        ALA  87   9.393   2.981   1.636
    2    HA   ALA  87           HA       ALA  87   8.825   4.894   3.601
    3    HB1  ALA  87           HB1      ALA  87   9.656   2.081   3.522
    4    HB3  ALA  87           HB2      ALA  87   8.522   2.885   4.604
    5    HB2  ALA  87           HB3      ALA  87  10.249   2.932   4.951

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ARG  88           H        ARG  88  11.922   3.494   2.629
    2    HA   ARG  88           HA       ARG  88  13.516   4.888   4.462
    3    HB2  ARG  88           HB2      ARG  88  14.204   2.918   3.063
    4    HB3  ARG  88           HB3      ARG  88  14.350   4.010   1.689
    5    HG2  ARG  88           HG2      ARG  88  15.808   5.339   3.636
    6    HG3  ARG  88           HG3      ARG  88  16.142   3.653   4.018
    7    HD2  ARG  88           HD2      ARG  88  17.415   3.364   2.174
    8    HD3  ARG  88           HD3      ARG  88  16.273   4.224   1.138
    9    HE   ARG  88           HE       ARG  88  18.657   5.310   2.188
   10   HH21  ARG  88          HH11      ARG  88  18.984   7.531   1.990
   11   HH22  ARG  88          HH12      ARG  88  17.624   8.591   1.842
   12   HH11  ARG  88          HH21      ARG  88  15.312   6.034   1.902
   13   HH12  ARG  88          HH22      ARG  88  15.544   7.741   1.768

  No H/Q in entry =          13
  In of MODEL   52
    1    H    GLU  89           H        GLU  89  12.542   5.772   1.136
    2    HA   GLU  89           HA       GLU  89  14.069   8.145   0.978
    3    HB2  GLU  89           HB2      GLU  89  12.937   7.091  -0.970
    4    HB3  GLU  89           HB3      GLU  89  11.387   7.620  -0.316
    5    HG2  GLU  89           HG2      GLU  89  12.069   9.963  -0.482
    6    HG3  GLU  89           HG3      GLU  89  13.678   9.485  -1.015

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LEU  90           H        LEU  90  10.742   7.610   2.102
    2    HA   LEU  90           HA       LEU  90  10.203  10.340   2.672
    3    HB2  LEU  90           HB2      LEU  90   9.028   7.758   3.702
    4    HB3  LEU  90           HB3      LEU  90   8.384   9.349   4.121
    5    HG   LEU  90           HG       LEU  90   8.814   8.467   1.254
    6   HD12  LEU  90          HD11      LEU  90   6.283   8.118   1.313
    7   HD11  LEU  90          HD12      LEU  90   6.435   8.112   3.070
    8   HD13  LEU  90          HD13      LEU  90   7.265   6.887   2.109
    9   HD22  LEU  90          HD21      LEU  90   8.501  10.773   1.176
   10   HD21  LEU  90          HD22      LEU  90   7.512  10.799   2.634
   11   HD23  LEU  90          HD23      LEU  90   6.822  10.236   1.113

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  91           H        ILE  91  11.485   7.672   4.601
    2    HA   ILE  91           HA       ILE  91  11.610   9.043   7.067
    3    HB   ILE  91           HB       ILE  91  13.186   6.715   5.950
    4   HG12  ILE  91          HG12      ILE  91  11.164   6.870   8.206
    5   HG13  ILE  91          HG13      ILE  91  10.699   6.582   6.530
    6   HG22  ILE  91          HG21      ILE  91  13.653   6.510   8.592
    7   HG21  ILE  91          HG22      ILE  91  13.563   8.268   8.488
    8   HG23  ILE  91          HG23      ILE  91  14.750   7.388   7.527
    9   HD13  ILE  91          HD11      ILE  91  11.719   4.488   6.465
   10   HD12  ILE  91          HD12      ILE  91  11.123   4.545   8.124
   11   HD11  ILE  91          HD13      ILE  91  12.822   4.871   7.788

  No H/Q in entry =          11
  In of MODEL   52
    1    H    THR  92           H        THR  92  13.833   8.887   4.319
    2    HA   THR  92           HA       THR  92  15.985  10.300   5.480
    3    HB   THR  92           HB       THR  92  15.004  10.162   2.618
    4    HG1  THR  92           HG1      THR  92  15.851   8.273   3.027
    5   HG22  THR  92          HG21      THR  92  17.569  10.874   2.327
    6   HG21  THR  92          HG22      THR  92  17.251  11.695   3.855
    7   HG23  THR  92          HG23      THR  92  16.280  12.072   2.432

  No H/Q in entry =           7
  In of MODEL   52
    1    H    GLU  93           H        GLU  93  13.091  11.427   3.744
    2    HA   GLU  93           HA       GLU  93  13.662  14.193   3.855
    3    HB2  GLU  93           HB2      GLU  93  10.969  12.797   3.867
    4    HB3  GLU  93           HB3      GLU  93  11.244  14.498   3.493
    5    HG2  GLU  93           HG2      GLU  93  12.603  12.265   1.971
    6    HG3  GLU  93           HG3      GLU  93  11.051  12.934   1.480

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LEU  94           H        LEU  94  11.934  12.025   6.067
    2    HA   LEU  94           HA       LEU  94  11.106  13.968   7.939
    3    HB2  LEU  94           HB2      LEU  94  11.706  11.019   8.219
    4    HB3  LEU  94           HB3      LEU  94  11.124  11.992   9.566
    5    HG   LEU  94           HG       LEU  94   9.644  12.026   6.935
    6   HD11  LEU  94          HD11      LEU  94   9.742   9.809   8.944
    7   HD13  LEU  94          HD12      LEU  94   9.444   9.743   7.208
    8   HD12  LEU  94          HD13      LEU  94   8.159  10.250   8.304
    9   HD23  LEU  94          HD21      LEU  94   7.718  12.413   8.532
   10   HD22  LEU  94          HD22      LEU  94   8.947  13.677   8.569
   11   HD21  LEU  94          HD23      LEU  94   8.892  12.462   9.845

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  95           H        ILE  95  14.096  12.063   7.709
    2    HA   ILE  95           HA       ILE  95  15.252  12.999  10.123
    3    HB   ILE  95           HB       ILE  95  16.504  11.937   7.579
    4   HG12  ILE  95          HG12      ILE  95  16.214  10.738  10.348
    5   HG13  ILE  95          HG13      ILE  95  15.052  10.468   9.051
    6   HG21  ILE  95          HG21      ILE  95  17.749  12.758  10.221
    7   HG23  ILE  95          HG22      ILE  95  18.209  13.287   8.602
    8   HG22  ILE  95          HG23      ILE  95  18.528  11.631   9.113
    9   HD13  ILE  95          HD11      ILE  95  16.544   9.199   7.793
   10   HD12  ILE  95          HD12      ILE  95  17.018   8.757   9.430
   11   HD11  ILE  95          HD13      ILE  95  17.963   9.943   8.530

  No H/Q in entry =          11
  In of MODEL   52
    1    H    GLU  96           H        GLU  96  15.401  14.228   6.787
    2    HA   GLU  96           HA       GLU  96  17.230  16.323   7.263
    3    HB2  GLU  96           HB2      GLU  96  16.574  15.652   5.004
    4    HB3  GLU  96           HB3      GLU  96  14.925  16.195   5.301
    5    HG2  GLU  96           HG2      GLU  96  15.474  18.328   4.756
    6    HG3  GLU  96           HG3      GLU  96  16.772  18.342   5.940

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LEU  97           H        LEU  97  13.719  16.108   7.688
    2    HA   LEU  97           HA       LEU  97  13.279  18.839   8.325
    3    HB2  LEU  97           HB2      LEU  97  11.781  16.301   8.941
    4    HB3  LEU  97           HB3      LEU  97  11.255  17.845   9.609
    5    HG   LEU  97           HG       LEU  97  11.745  17.428   6.646
    6   HD12  LEU  97          HD11      LEU  97   9.223  17.279   6.525
    7   HD11  LEU  97          HD12      LEU  97   9.216  17.082   8.275
    8   HD13  LEU  97          HD13      LEU  97  10.008  15.880   7.256
    9   HD23  LEU  97          HD21      LEU  97   9.991  19.378   6.673
   10   HD22  LEU  97          HD22      LEU  97  11.668  19.752   7.067
   11   HD21  LEU  97          HD23      LEU  97  10.479  19.574   8.355

  No H/Q in entry =          11
  In of MODEL   52
    1    H    HIS  98           H        HIS  98  14.122  16.023  10.326
    2    HA   HIS  98           HA       HIS  98  13.951  17.287  12.840
    3    HB2  HIS  98           HB2      HIS  98  15.720  15.042  11.844
    4    HB3  HIS  98           HB3      HIS  98  15.712  15.583  13.524
    5    HD1  HIS  98           HD1      HIS  98  13.530  13.931  10.932
    6    HD2  HIS  98           HD2      HIS  98  13.410  14.857  14.995
    7    HE1  HIS  98           HE1      HIS  98  11.514  12.722  11.884
    8    HE2  HIS  98           HE2      HIS  98  11.421  13.277  14.354

  No H/Q in entry =           8
  In of MODEL   52
    1    H    GLU  99           H        GLU  99  16.508  17.188  10.408
    2    HA   GLU  99           HA       GLU  99  18.481  18.539  11.937
    3    HB2  GLU  99           HB2      GLU  99  18.973  17.252   9.871
    4    HB3  GLU  99           HB3      GLU  99  18.154  18.499   8.927
    5    HG2  GLU  99           HG2      GLU  99  19.747  20.183   9.717
    6    HG3  GLU  99           HG3      GLU  99  20.535  18.989  10.743

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LYS 100           H        LYS 100  15.950  19.677   9.716
    2    HA   LYS 100           HA       LYS 100  16.725  22.421   9.857
    3    HB2  LYS 100           HB2      LYS 100  14.104  21.110   9.101
    4    HB3  LYS 100           HB3      LYS 100  14.390  22.850   9.008
    5    HG2  LYS 100           HG2      LYS 100  16.367  22.415   7.544
    6    HG3  LYS 100           HG3      LYS 100  15.967  20.695   7.564
    7    HD2  LYS 100           HD2      LYS 100  13.769  21.185   6.561
    8    HD3  LYS 100           HD3      LYS 100  14.152  22.907   6.548
    9    HE2  LYS 100           HE2      LYS 100  16.116  22.440   5.091
   10    HE3  LYS 100           HE3      LYS 100  15.664  20.732   5.060
   11    HZ1  LYS 100           HZ1      LYS 100  13.823  22.909   4.220
   12    HZ3  LYS 100           HZ2      LYS 100  13.652  21.237   3.960
   13    HZ2  LYS 100           HZ3      LYS 100  14.857  22.108   3.139

  No H/Q in entry =          13
  In of MODEL   52
    1    H    LEU 101           H        LEU 101  14.642  20.362  11.823
    2    HA   LEU 101           HA       LEU 101  13.458  22.423  13.397
    3    HB2  LEU 101           HB2      LEU 101  13.922  19.477  13.785
    4    HB3  LEU 101           HB3      LEU 101  13.377  20.456  15.144
    5    HG   LEU 101           HG       LEU 101  11.962  20.529  12.473
    6   HD12  LEU 101          HD11      LEU 101  10.313  18.954  13.743
    7   HD11  LEU 101          HD12      LEU 101  11.710  18.553  14.740
    8   HD13  LEU 101          HD13      LEU 101  11.747  18.244  13.003
    9   HD21  LEU 101          HD21      LEU 101  11.296  21.321  15.324
   10   HD23  LEU 101          HD22      LEU 101  10.038  21.084  14.112
   11   HD22  LEU 101          HD23      LEU 101  11.263  22.328  13.874

  No H/Q in entry =          11
  In of MODEL   52
    1    H    LYS 102           H        LYS 102  16.610  21.839  12.964
    2    HA   LYS 102           HA       LYS 102  18.449  22.725  14.037
    3    HB2  LYS 102           HB2      LYS 102  16.622  24.228  15.167
    4    HB3  LYS 102           HB3      LYS 102  16.836  23.169  16.545
    5    HG2  LYS 102           HG2      LYS 102  18.715  25.193  15.375
    6    HG3  LYS 102           HG3      LYS 102  18.334  24.878  17.054
    7    HD2  LYS 102           HD2      LYS 102  20.017  22.975  15.373
    8    HD3  LYS 102           HD3      LYS 102  20.695  24.304  16.304
    9    HE2  LYS 102           HE2      LYS 102  20.315  21.754  17.277
   10    HE3  LYS 102           HE3      LYS 102  20.522  23.199  18.266
   11    HZ2  LYS 102           HZ1      LYS 102  18.562  21.901  18.884
   12    HZ1  LYS 102           HZ2      LYS 102  17.918  22.124  17.334
   13    HZ3  LYS 102           HZ3      LYS 102  18.137  23.457  18.358

  No H/Q in entry =          13
  In of MODEL   52
    1    H    ALA 103           H        ALA 103  16.387  21.108  16.460
    2    HA   ALA 103           HA       ALA 103  18.121  19.912  18.118
    3    HB2  ALA 103           HB1      ALA 103  16.552  17.893  18.114
    4    HB1  ALA 103           HB2      ALA 103  15.651  18.738  16.854
    5    HB3  ALA 103           HB3      ALA 103  15.822  19.462  18.452

  No H/Q in entry =           5
  In of MODEL   52
    1    H1   ALA   1           H3       ALA   1  -1.566  -7.147 -21.484
    2    H2   ALA   1           H2       ALA   1  -2.350  -8.587 -21.029
    3    H3   ALA   1           H1       ALA   1  -0.742  -8.626 -21.582
    4    HA   ALA   1           HA       ALA   1  -1.570  -9.104 -23.579
    5    HB1  ALA   1           HB1      ALA   1  -3.702  -9.837 -23.107
    6    HB2  ALA   1           HB2      ALA   1  -4.151  -8.330 -23.907
    7    HB3  ALA   1           HB3      ALA   1  -4.092  -8.408 -22.148

  No H/Q in entry =           7
  In of MODEL   52
    1    H    GLU   2           H        GLU   2  -2.406  -7.922 -25.571
    2    HA   GLU   2           HA       GLU   2  -1.020  -5.900 -26.450
    3    HB2  GLU   2           HB2      GLU   2  -4.027  -5.988 -26.771
    4    HB3  GLU   2           HB3      GLU   2  -2.910  -5.119 -27.820
    5    HG2  GLU   2           HG2      GLU   2  -2.393  -7.007 -28.972
    6    HG3  GLU   2           HG3      GLU   2  -2.091  -7.908 -27.493

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLU   3           H        GLU   3  -4.190  -4.664 -25.555
    2    HA   GLU   3           HA       GLU   3  -3.162  -2.100 -24.929
    3    HB2  GLU   3           HB2      GLU   3  -5.842  -3.433 -24.598
    4    HB3  GLU   3           HB3      GLU   3  -5.556  -1.814 -23.954
    5    HG2  GLU   3           HG2      GLU   3  -5.203  -0.888 -26.080
    6    HG3  GLU   3           HG3      GLU   3  -4.796  -2.441 -26.803

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LEU   4           H        LEU   4  -4.739  -4.467 -22.748
    2    HA   LEU   4           HA       LEU   4  -4.386  -3.233 -20.358
    3    HB2  LEU   4           HB2      LEU   4  -3.822  -6.171 -20.823
    4    HB3  LEU   4           HB3      LEU   4  -4.235  -5.426 -19.281
    5    HG   LEU   4           HG       LEU   4  -6.004  -5.515 -21.747
    6   HD13  LEU   4          HD11      LEU   4  -7.187  -7.239 -20.749
    7   HD12  LEU   4          HD12      LEU   4  -6.707  -6.774 -19.117
    8   HD11  LEU   4          HD13      LEU   4  -5.564  -7.611 -20.166
    9   HD23  LEU   4          HD21      LEU   4  -7.697  -4.713 -19.882
   10   HD22  LEU   4          HD22      LEU   4  -6.666  -3.536 -20.693
   11   HD21  LEU   4          HD23      LEU   4  -6.238  -4.121 -19.086

  No H/Q in entry =          11
  In of MODEL   52
    1    H    GLU   5           H        GLU   5  -1.874  -5.061 -22.083
    2    HA   GLU   5           HA       GLU   5   0.106  -4.761 -20.044
    3    HB2  GLU   5           HB2      GLU   5   0.176  -6.531 -21.803
    4    HB3  GLU   5           HB3      GLU   5   0.503  -5.281 -23.004
    5    HG2  GLU   5           HG2      GLU   5   2.554  -4.645 -21.810
    6    HG3  GLU   5           HG3      GLU   5   2.228  -5.863 -20.578

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLU   6           H        GLU   6  -0.538  -3.056 -23.092
    2    HA   GLU   6           HA       GLU   6   1.619  -1.209 -22.824
    3    HB2  GLU   6           HB2      GLU   6  -0.941  -1.127 -24.434
    4    HB3  GLU   6           HB3      GLU   6   0.320   0.101 -24.545
    5    HG2  GLU   6           HG2      GLU   6   1.949  -1.582 -25.232
    6    HG3  GLU   6           HG3      GLU   6   0.753  -2.859 -25.030

  No H/Q in entry =           6
  In of MODEL   52
    1    H    VAL   7           H        VAL   7  -1.720  -1.302 -21.783
    2    HA   VAL   7           HA       VAL   7  -1.961   1.410 -20.950
    3    HB   VAL   7           HB       VAL   7  -3.407  -1.116 -20.113
    4   HG11  VAL   7          HG11      VAL   7  -3.803   1.771 -19.303
    5   HG13  VAL   7          HG12      VAL   7  -3.695   0.348 -18.266
    6   HG12  VAL   7          HG13      VAL   7  -5.128   0.607 -19.260
    7   HG21  VAL   7          HG21      VAL   7  -3.568  -0.044 -22.503
    8   HG23  VAL   7          HG22      VAL   7  -4.523   1.199 -21.693
    9   HG22  VAL   7          HG23      VAL   7  -5.057  -0.482 -21.665

  No H/Q in entry =           9
  In of MODEL   52
    1    H    VAL   8           H        VAL   8  -0.955  -1.566 -19.302
    2    HA   VAL   8           HA       VAL   8  -0.647  -0.481 -16.708
    3    HB   VAL   8           HB       VAL   8   0.735  -2.801 -18.076
    4   HG12  VAL   8          HG11      VAL   8   1.091  -3.370 -15.503
    5   HG11  VAL   8          HG12      VAL   8   1.038  -1.614 -15.342
    6   HG13  VAL   8          HG13      VAL   8   2.250  -2.367 -16.376
    7   HG22  VAL   8          HG21      VAL   8  -0.960  -4.145 -17.192
    8   HG21  VAL   8          HG22      VAL   8  -1.866  -2.648 -17.388
    9   HG23  VAL   8          HG23      VAL   8  -1.222  -3.083 -15.809

  No H/Q in entry =           9
  In of MODEL   52
    1    H    MET   9           H        MET   9   1.607  -0.770 -19.452
    2    HA   MET   9           HA       MET   9   3.885   0.289 -18.189
    3    HB2  MET   9           HB2      MET   9   2.934   0.252 -21.046
    4    HB3  MET   9           HB3      MET   9   4.407   1.112 -20.599
    5    HG2  MET   9           HG2      MET   9   5.112  -1.070 -19.421
    6    HG3  MET   9           HG3      MET   9   3.810  -1.835 -20.335
    7    HE2  MET   9           HE1      MET   9   3.752  -0.606 -23.248
    8    HE1  MET   9           HE2      MET   9   3.608  -2.219 -22.554
    9    HE3  MET   9           HE3      MET   9   4.748  -1.930 -23.864

  No H/Q in entry =           9
  In of MODEL   52
    1    H    GLY  10           H        GLY  10   1.192   1.873 -19.871
    2    HA3  GLY  10           HA2      GLY  10   2.139   4.532 -19.629
    3    HA2  GLY  10           HA3      GLY  10   0.452   4.062 -19.835

  No H/Q in entry =           3
  In of MODEL   52
    1    H    LEU  11           H        LEU  11   0.060   2.535 -17.548
    2    HA   LEU  11           HA       LEU  11  -0.484   4.510 -15.591
    3    HB2  LEU  11           HB2      LEU  11  -0.399   1.495 -15.431
    4    HB3  LEU  11           HB3      LEU  11  -0.915   2.517 -14.090
    5    HG   LEU  11           HG       LEU  11  -2.152   2.620 -16.855
    6   HD13  LEU  11          HD11      LEU  11  -2.724   0.475 -16.098
    7   HD12  LEU  11          HD12      LEU  11  -4.081   1.459 -15.555
    8   HD11  LEU  11          HD13      LEU  11  -2.823   0.987 -14.413
    9   HD22  LEU  11          HD21      LEU  11  -2.755   4.634 -15.851
   10   HD21  LEU  11          HD22      LEU  11  -2.678   3.970 -14.219
   11   HD23  LEU  11          HD23      LEU  11  -4.050   3.595 -15.262

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  12           H        ILE  12   2.073   2.059 -15.828
    2    HA   ILE  12           HA       ILE  12   3.274   2.605 -13.324
    3    HB   ILE  12           HB       ILE  12   4.537   1.571 -15.885
    4   HG12  ILE  12          HG12      ILE  12   2.529   0.329 -14.744
    5   HG13  ILE  12          HG13      ILE  12   3.934  -0.600 -15.226
    6   HG22  ILE  12          HG21      ILE  12   6.214   0.553 -14.293
    7   HG21  ILE  12          HG22      ILE  12   5.508   1.535 -13.008
    8   HG23  ILE  12          HG23      ILE  12   6.283   2.312 -14.388
    9   HD11  ILE  12          HD11      ILE  12   3.476   0.510 -12.445
   10   HD13  ILE  12          HD12      ILE  12   4.749  -0.604 -12.944
   11   HD12  ILE  12          HD13      ILE  12   3.080  -1.128 -12.932

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  13           H        ILE  13   3.870   3.869 -16.582
    2    HA   ILE  13           HA       ILE  13   5.998   5.602 -15.858
    3    HB   ILE  13           HB       ILE  13   3.968   5.667 -18.105
    4   HG12  ILE  13          HG12      ILE  13   5.817   3.840 -17.824
    5   HG13  ILE  13          HG13      ILE  13   5.571   4.580 -19.403
    6   HG23  ILE  13          HG21      ILE  13   4.589   7.915 -18.054
    7   HG22  ILE  13          HG22      ILE  13   5.794   7.248 -19.150
    8   HG21  ILE  13          HG23      ILE  13   6.217   7.567 -17.469
    9   HD11  ILE  13          HD11      ILE  13   7.641   5.590 -17.419
   10   HD13  ILE  13          HD12      ILE  13   7.472   6.021 -19.116
   11   HD12  ILE  13          HD13      ILE  13   7.994   4.400 -18.670

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ASN  14           H        ASN  14   2.488   6.076 -16.128
    2    HA   ASN  14           HA       ASN  14   2.430   8.823 -15.494
    3    HB2  ASN  14           HB2      ASN  14   0.547   7.170 -16.324
    4    HB3  ASN  14           HB3      ASN  14   0.225   6.991 -14.604
    5   HD21  ASN  14          HD21      ASN  14  -1.800   8.134 -16.039
    6   HD22  ASN  14          HD22      ASN  14  -1.872   9.808 -15.773

  No H/Q in entry =           6
  In of MODEL   52
    1    H    SER  15           H        SER  15   2.150   5.947 -13.415
    2    HA   SER  15           HA       SER  15   1.834   7.318 -10.968
    3    HB2  SER  15           HB2      SER  15   2.396   5.236  -9.916
    4    HB3  SER  15           HB3      SER  15   1.568   4.811 -11.411
    5    HG   SER  15           HG       SER  15   4.164   4.396 -10.650

  No H/Q in entry =           5
  In of MODEL   52
    1    H    GLY  16           H        GLY  16   4.717   6.236 -12.724
    2    HA3  GLY  16           HA2      GLY  16   6.637   7.006 -10.794
    3    HA2  GLY  16           HA3      GLY  16   6.942   6.803 -12.517

  No H/Q in entry =           3
  In of MODEL   52
    1    H    GLN  17           H        GLN  17   5.241   8.750 -13.583
    2    HA   GLN  17           HA       GLN  17   6.804  11.101 -13.277
    3    HB2  GLN  17           HB2      GLN  17   5.502  10.630 -15.321
    4    HB3  GLN  17           HB3      GLN  17   4.004  10.801 -14.406
    5    HG2  GLN  17           HG2      GLN  17   4.535  13.132 -13.901
    6    HG3  GLN  17           HG3      GLN  17   6.087  12.979 -14.725
    7   HE21  GLN  17          HE21      GLN  17   4.160  14.908 -15.584
    8   HE22  GLN  17          HE22      GLN  17   3.584  14.445 -17.111

  No H/Q in entry =           8
  In of MODEL   52
    1    H    ALA  18           H        ALA  18   3.709  10.065 -11.928
    2    HA   ALA  18           HA       ALA  18   2.968  12.450 -10.665
    3    HB1  ALA  18           HB1      ALA  18   1.855   9.986 -10.885
    4    HB2  ALA  18           HB2      ALA  18   1.298  11.203  -9.740
    5    HB3  ALA  18           HB3      ALA  18   2.396   9.929  -9.208

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ARG  19           H        ARG  19   4.860   9.701  -9.382
    2    HA   ARG  19           HA       ARG  19   5.383  10.866  -6.861
    3    HB2  ARG  19           HB2      ARG  19   5.814   8.465  -7.385
    4    HB3  ARG  19           HB3      ARG  19   7.167   8.960  -8.406
    5    HG2  ARG  19           HG2      ARG  19   8.278  10.009  -6.484
    6    HG3  ARG  19           HG3      ARG  19   6.905   9.613  -5.453
    7    HD2  ARG  19           HD2      ARG  19   8.678   7.990  -5.092
    8    HD3  ARG  19           HD3      ARG  19   7.310   7.198  -5.878
    9    HE   ARG  19           HE       ARG  19   9.010   8.026  -7.925
   10   HH21  ARG  19          HH11      ARG  19  10.581   6.632  -8.773
   11   HH22  ARG  19          HH12      ARG  19  11.135   5.288  -7.835
   12   HH11  ARG  19          HH21      ARG  19   9.095   6.000  -5.144
   13   HH12  ARG  19          HH22      ARG  19  10.291   4.930  -5.780

  No H/Q in entry =          13
  In of MODEL   52
    1    H    SER  20           H        SER  20   7.202  10.905  -9.909
    2    HA   SER  20           HA       SER  20   9.435  12.338  -9.085
    3    HB2  SER  20           HB2      SER  20   9.474  11.459 -11.288
    4    HB3  SER  20           HB3      SER  20   7.969  12.267 -11.717
    5    HG   SER  20           HG       SER  20  10.564  13.280 -11.476

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LEU  21           H        LEU  21   6.328  13.582 -10.285
    2    HA   LEU  21           HA       LEU  21   6.977  16.333 -10.064
    3    HB2  LEU  21           HB2      LEU  21   4.319  14.890  -9.983
    4    HB3  LEU  21           HB3      LEU  21   4.473  16.645  -9.991
    5    HG   LEU  21           HG       LEU  21   5.683  14.854 -12.118
    6   HD11  LEU  21          HD11      LEU  21   3.004  16.250 -11.973
    7   HD13  LEU  21          HD12      LEU  21   3.332  14.553 -12.326
    8   HD12  LEU  21          HD13      LEU  21   3.743  15.795 -13.508
    9   HD21  LEU  21          HD21      LEU  21   5.444  17.824 -11.692
   10   HD23  LEU  21          HD22      LEU  21   5.427  17.213 -13.343
   11   HD22  LEU  21          HD23      LEU  21   6.815  16.907 -12.310

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ALA  22           H        ALA  22   5.481  14.034  -7.814
    2    HA   ALA  22           HA       ALA  22   4.862  15.840  -5.749
    3    HB3  ALA  22           HB1      ALA  22   4.121  13.441  -5.910
    4    HB2  ALA  22           HB2      ALA  22   4.705  13.920  -4.316
    5    HB1  ALA  22           HB3      ALA  22   5.737  12.968  -5.385

  No H/Q in entry =           5
  In of MODEL   52
    1    H    TYR  23           H        TYR  23   7.813  13.838  -6.184
    2    HA   TYR  23           HA       TYR  23   9.187  14.872  -3.932
    3    HB2  TYR  23           HB2      TYR  23   9.991  12.869  -5.088
    4    HB3  TYR  23           HB3      TYR  23  10.298  13.809  -6.547
    5    HD1  TYR  23           HD1      TYR  23  11.259  13.487  -2.953
    6    HD2  TYR  23           HD2      TYR  23  12.325  14.994  -6.833
    7    HE1  TYR  23           HE1      TYR  23  13.512  14.084  -2.104
    8    HE2  TYR  23           HE2      TYR  23  14.576  15.592  -5.983
    9    HH   TYR  23           HH       TYR  23  15.546  14.814  -2.647

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ALA  24           H        ALA  24   8.996  15.973  -7.299
    2    HA   ALA  24           HA       ALA  24  10.873  18.076  -7.055
    3    HB2  ALA  24           HB1      ALA  24  10.431  18.131  -9.264
    4    HB3  ALA  24           HB2      ALA  24   8.869  18.867  -8.906
    5    HB1  ALA  24           HB3      ALA  24   9.010  17.115  -9.034

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ALA  25           H        ALA  25   7.395  17.860  -6.435
    2    HA   ALA  25           HA       ALA  25   6.889  20.574  -5.870
    3    HB1  ALA  25           HB1      ALA  25   5.247  18.559  -6.069
    4    HB2  ALA  25           HB2      ALA  25   4.867  19.846  -4.923
    5    HB3  ALA  25           HB3      ALA  25   5.570  18.332  -4.349

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LEU  26           H        LEU  26   7.982  17.907  -3.816
    2    HA   LEU  26           HA       LEU  26   8.072  19.342  -1.381
    3    HB2  LEU  26           HB2      LEU  26   8.191  16.927  -1.372
    4    HB3  LEU  26           HB3      LEU  26   9.661  16.948  -2.342
    5    HG   LEU  26           HG       LEU  26  10.864  18.080  -0.503
    6   HD12  LEU  26          HD11      LEU  26   9.637  18.079   1.757
    7   HD11  LEU  26          HD12      LEU  26   8.151  17.925   0.821
    8   HD13  LEU  26          HD13      LEU  26   9.182  19.341   0.611
    9   HD21  LEU  26          HD21      LEU  26   9.355  15.598   0.373
   10   HD23  LEU  26          HD22      LEU  26  10.864  16.177   1.070
   11   HD22  LEU  26          HD23      LEU  26  10.825  15.615  -0.599

  No H/Q in entry =          11
  In of MODEL   52
    1    H    LYS  27           H        LYS  27  10.496  18.791  -3.903
    2    HA   LYS  27           HA       LYS  27  12.666  20.056  -2.676
    3    HB2  LYS  27           HB2      LYS  27  12.783  18.707  -4.764
    4    HB3  LYS  27           HB3      LYS  27  12.004  20.030  -5.632
    5    HG2  LYS  27           HG2      LYS  27  13.854  21.535  -5.055
    6    HG3  LYS  27           HG3      LYS  27  14.627  20.252  -4.116
    7    HD2  LYS  27           HD2      LYS  27  14.786  18.863  -6.168
    8    HD3  LYS  27           HD3      LYS  27  14.057  20.173  -7.099
    9    HE2  LYS  27           HE2      LYS  27  15.929  21.659  -6.488
   10    HE3  LYS  27           HE3      LYS  27  16.661  20.354  -5.548
   11    HZ3  LYS  27           HZ1      LYS  27  17.651  20.461  -7.734
   12    HZ2  LYS  27           HZ2      LYS  27  16.127  20.326  -8.475
   13    HZ1  LYS  27           HZ3      LYS  27  16.763  19.023  -7.589

  No H/Q in entry =          13
  In of MODEL   52
    1    H    GLN  28           H        GLN  28  10.030  21.407  -4.628
    2    HA   GLN  28           HA       GLN  28  10.961  24.069  -4.784
    3    HB2  GLN  28           HB2      GLN  28   8.138  22.972  -4.669
    4    HB3  GLN  28           HB3      GLN  28   8.537  24.646  -5.054
    5    HG2  GLN  28           HG2      GLN  28   9.589  22.249  -6.581
    6    HG3  GLN  28           HG3      GLN  28   8.204  23.215  -7.086
    7   HE21  GLN  28          HE21      GLN  28   9.022  25.818  -6.640
    8   HE22  GLN  28          HE22      GLN  28  10.421  26.165  -7.537

  No H/Q in entry =           8
  In of MODEL   52
    1    H    ALA  29           H        ALA  29   9.047  22.360  -2.346
    2    HA   ALA  29           HA       ALA  29   8.473  24.548  -0.668
    3    HB2  ALA  29           HB1      ALA  29   7.760  22.974   0.902
    4    HB1  ALA  29           HB2      ALA  29   8.995  21.802   0.439
    5    HB3  ALA  29           HB3      ALA  29   7.606  22.079  -0.610

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LYS  30           H        LYS  30  11.228  22.311  -0.733
    2    HA   LYS  30           HA       LYS  30  12.534  23.283   1.569
    3    HB2  LYS  30           HB2      LYS  30  13.646  22.005  -0.939
    4    HB3  LYS  30           HB3      LYS  30  14.624  22.377   0.482
    5    HG2  LYS  30           HG2      LYS  30  13.085  20.979   1.863
    6    HG3  LYS  30           HG3      LYS  30  12.205  20.545   0.394
    7    HD2  LYS  30           HD2      LYS  30  14.261  19.580  -0.565
    8    HD3  LYS  30           HD3      LYS  30  15.160  20.028   0.886
    9    HE2  LYS  30           HE2      LYS  30  13.671  18.582   2.242
   10    HE3  LYS  30           HE3      LYS  30  12.802  18.115   0.775
   11    HZ2  LYS  30           HZ1      LYS  30  14.611  16.558   1.538
   12    HZ1  LYS  30           HZ2      LYS  30  15.735  17.757   1.086
   13    HZ3  LYS  30           HZ3      LYS  30  14.707  17.060  -0.078

  No H/Q in entry =          13
  In of MODEL   52
    1    H    GLN  31           H        GLN  31  12.413  24.481  -1.730
    2    HA   GLN  31           HA       GLN  31  14.544  26.399  -1.310
    3    HB2  GLN  31           HB2      GLN  31  12.502  26.420  -3.535
    4    HB3  GLN  31           HB3      GLN  31  14.114  27.133  -3.537
    5    HG2  GLN  31           HG2      GLN  31  14.606  24.444  -2.957
    6    HG3  GLN  31           HG3      GLN  31  13.303  24.373  -4.136
    7   HE21  GLN  31          HE21      GLN  31  16.155  23.611  -4.538
    8   HE22  GLN  31          HE22      GLN  31  16.717  24.589  -5.806

  No H/Q in entry =           8
  In of MODEL   52
    1    H    GLY  32           H        GLY  32  11.472  26.184  -0.166
    2    HA3  GLY  32           HA2      GLY  32  10.298  27.741   1.105
    3    HA2  GLY  32           HA3      GLY  32  11.409  28.988   0.554

  No H/Q in entry =           3
  In of MODEL   52
    1    H    ASP  33           H        ASP  33  10.067  27.065  -1.936
    2    HA   ASP  33           HA       ASP  33   8.378  29.318  -2.796
    3    HB2  ASP  33           HB2      ASP  33   9.499  26.909  -4.234
    4    HB3  ASP  33           HB3      ASP  33   8.335  28.011  -4.967

  No H/Q in entry =           4
  In of MODEL   52
    1    H    PHE  34           H        PHE  34   6.694  28.826  -1.232
    2    HA   PHE  34           HA       PHE  34   5.343  26.338  -1.133
    3    HB2  PHE  34           HB2      PHE  34   4.350  29.116  -0.458
    4    HB3  PHE  34           HB3      PHE  34   3.518  27.616  -0.045
    5    HD1  PHE  34           HD1      PHE  34   5.740  30.041   1.167
    6    HD2  PHE  34           HD2      PHE  34   5.108  25.793   1.120
    7    HE1  PHE  34           HE1      PHE  34   7.133  29.809   3.205
    8    HE2  PHE  34           HE2      PHE  34   6.503  25.565   3.155
    9    HZ   PHE  34           HZ       PHE  34   7.509  27.574   4.197

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ALA  35           H        ALA  35   4.881  29.194  -3.148
    2    HA   ALA  35           HA       ALA  35   2.337  28.550  -4.173
    3    HB3  ALA  35           HB1      ALA  35   3.374  29.951  -6.213
    4    HB2  ALA  35           HB2      ALA  35   4.587  30.328  -4.989
    5    HB1  ALA  35           HB3      ALA  35   2.892  30.718  -4.699

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ALA  36           H        ALA  36   5.573  27.911  -5.526
    2    HA   ALA  36           HA       ALA  36   4.601  26.468  -7.767
    3    HB3  ALA  36           HB1      ALA  36   6.759  26.616  -8.383
    4    HB2  ALA  36           HB2      ALA  36   7.251  25.594  -7.031
    5    HB1  ALA  36           HB3      ALA  36   7.126  27.341  -6.818

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ALA  37           H        ALA  37   5.567  25.489  -4.511
    2    HA   ALA  37           HA       ALA  37   5.540  22.700  -4.936
    3    HB2  ALA  37           HB1      ALA  37   5.258  24.491  -2.560
    4    HB1  ALA  37           HB2      ALA  37   6.406  23.186  -2.850
    5    HB3  ALA  37           HB3      ALA  37   4.749  22.814  -2.379

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LYS  38           H        LYS  38   2.982  24.880  -3.772
    2    HA   LYS  38           HA       LYS  38   0.904  23.044  -3.547
    3    HB2  LYS  38           HB2      LYS  38   1.224  25.804  -3.300
    4    HB3  LYS  38           HB3      LYS  38   0.026  25.641  -4.579
    5    HG2  LYS  38           HG2      LYS  38  -1.408  24.304  -3.135
    6    HG3  LYS  38           HG3      LYS  38  -0.164  24.260  -1.878
    7    HD2  LYS  38           HD2      LYS  38  -0.377  26.594  -1.434
    8    HD3  LYS  38           HD3      LYS  38  -1.291  26.871  -2.917
    9    HE2  LYS  38           HE2      LYS  38  -2.796  26.891  -0.978
   10    HE3  LYS  38           HE3      LYS  38  -3.154  25.509  -2.018
   11    HZ3  LYS  38           HZ1      LYS  38  -2.412  24.049  -0.483
   12    HZ2  LYS  38           HZ2      LYS  38  -2.777  25.303   0.604
   13    HZ1  LYS  38           HZ3      LYS  38  -1.180  25.070   0.080

  No H/Q in entry =          13
  In of MODEL   52
    1    H    ALA  39           H        ALA  39   1.862  24.953  -6.398
    2    HA   ALA  39           HA       ALA  39  -0.203  24.060  -8.101
    3    HB2  ALA  39           HB1      ALA  39   2.526  24.738  -9.154
    4    HB1  ALA  39           HB2      ALA  39   1.545  25.989  -8.391
    5    HB3  ALA  39           HB3      ALA  39   0.943  25.143  -9.817

  No H/Q in entry =           5
  In of MODEL   52
    1    H    MET  40           H        MET  40   3.050  22.799  -7.518
    2    HA   MET  40           HA       MET  40   2.976  20.775  -9.507
    3    HB2  MET  40           HB2      MET  40   4.584  21.021  -6.958
    4    HB3  MET  40           HB3      MET  40   4.849  19.766  -8.171
    5    HG2  MET  40           HG2      MET  40   4.873  22.722  -8.840
    6    HG3  MET  40           HG3      MET  40   6.329  21.836  -8.389
    7    HE3  MET  40           HE1      MET  40   7.228  19.627 -11.195
    8    HE2  MET  40           HE2      MET  40   6.668  19.304  -9.557
    9    HE1  MET  40           HE3      MET  40   7.748  20.663  -9.858

  No H/Q in entry =           9
  In of MODEL   52
    1    H    MET  41           H        MET  41   2.059  20.812  -6.083
    2    HA   MET  41           HA       MET  41   1.559  18.041  -5.802
    3    HB2  MET  41           HB2      MET  41   0.198  20.385  -4.454
    4    HB3  MET  41           HB3      MET  41   0.062  18.706  -3.944
    5    HG2  MET  41           HG2      MET  41   2.770  18.961  -3.981
    6    HG3  MET  41           HG3      MET  41   2.310  20.614  -3.588
    7    HE2  MET  41           HE1      MET  41  -0.716  19.328  -1.861
    8    HE1  MET  41           HE2      MET  41   0.083  20.851  -2.241
    9    HE3  MET  41           HE3      MET  41   0.030  20.282  -0.572

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ASP  42           H        ASP  42  -0.511  20.740  -6.780
    2    HA   ASP  42           HA       ASP  42  -2.936  19.351  -6.916
    3    HB2  ASP  42           HB2      ASP  42  -2.259  21.929  -7.176
    4    HB3  ASP  42           HB3      ASP  42  -2.405  21.530  -8.884

  No H/Q in entry =           4
  In of MODEL   52
    1    H    GLN  43           H        GLN  43  -0.501  19.967  -9.418
    2    HA   GLN  43           HA       GLN  43  -1.872  18.628 -11.506
    3    HB2  GLN  43           HB2      GLN  43   1.080  19.180 -11.124
    4    HB3  GLN  43           HB3      GLN  43   0.375  18.530 -12.605
    5    HG2  GLN  43           HG2      GLN  43  -1.161  20.539 -12.650
    6    HG3  GLN  43           HG3      GLN  43  -0.217  21.208 -11.323
    7   HE21  GLN  43          HE21      GLN  43  -0.074  22.827 -13.411
    8   HE22  GLN  43          HE22      GLN  43   1.344  22.622 -14.318

  No H/Q in entry =           8
  In of MODEL   52
    1    H    SER  44           H        SER  44   0.492  17.520  -9.113
    2    HA   SER  44           HA       SER  44   0.858  14.916 -10.134
    3    HB2  SER  44           HB2      SER  44   1.735  16.369  -7.899
    4    HB3  SER  44           HB3      SER  44   0.889  14.976  -7.227
    5    HG   SER  44           HG       SER  44   3.007  14.381  -7.652

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ARG  45           H        ARG  45  -1.478  16.209  -7.799
    2    HA   ARG  45           HA       ARG  45  -2.836  13.833  -7.161
    3    HB2  ARG  45           HB2      ARG  45  -3.061  16.000  -5.972
    4    HB3  ARG  45           HB3      ARG  45  -3.925  16.654  -7.360
    5    HG2  ARG  45           HG2      ARG  45  -5.670  14.907  -7.075
    6    HG3  ARG  45           HG3      ARG  45  -4.819  14.308  -5.651
    7    HD2  ARG  45           HD2      ARG  45  -5.053  16.573  -4.598
    8    HD3  ARG  45           HD3      ARG  45  -6.046  17.079  -5.982
    9    HE   ARG  45           HE       ARG  45  -7.127  14.691  -4.939
   10   HH21  ARG  45          HH11      ARG  45  -8.964  14.745  -3.669
   11   HH22  ARG  45          HH12      ARG  45  -9.377  16.181  -2.802
   12   HH11  ARG  45          HH21      ARG  45  -6.622  17.945  -3.919
   13   HH12  ARG  45          HH22      ARG  45  -8.046  17.994  -2.942

  No H/Q in entry =          13
  In of MODEL   52
    1    H    MET  46           H        MET  46  -3.449  16.226  -9.715
    2    HA   MET  46           HA       MET  46  -5.773  15.023 -10.776
    3    HB2  MET  46           HB2      MET  46  -3.692  16.868 -11.962
    4    HB3  MET  46           HB3      MET  46  -5.079  16.301 -12.898
    5    HG2  MET  46           HG2      MET  46  -6.610  17.215 -11.208
    6    HG3  MET  46           HG3      MET  46  -5.245  17.751 -10.237
    7    HE3  MET  46           HE1      MET  46  -7.083  20.789 -11.496
    8    HE2  MET  46           HE2      MET  46  -5.603  20.846 -10.545
    9    HE1  MET  46           HE3      MET  46  -6.801  19.594 -10.223

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ALA  47           H        ALA  47  -2.338  14.586 -11.532
    2    HA   ALA  47           HA       ALA  47  -2.660  12.851 -13.740
    3    HB3  ALA  47           HB1      ALA  47  -0.495  13.769 -13.388
    4    HB2  ALA  47           HB2      ALA  47  -0.332  12.043 -13.052
    5    HB1  ALA  47           HB3      ALA  47  -0.440  13.195 -11.721

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LEU  48           H        LEU  48  -2.384  12.224 -10.265
    2    HA   LEU  48           HA       LEU  48  -2.442   9.383 -10.419
    3    HB2  LEU  48           HB2      LEU  48  -3.232  11.294  -8.209
    4    HB3  LEU  48           HB3      LEU  48  -3.116   9.545  -8.005
    5    HG   LEU  48           HG       LEU  48  -0.838  11.272  -9.004
    6   HD13  LEU  48          HD11      LEU  48  -1.132  12.042  -6.815
    7   HD12  LEU  48          HD12      LEU  48   0.048  10.750  -6.614
    8   HD11  LEU  48          HD13      LEU  48  -1.647  10.466  -6.216
    9   HD22  LEU  48          HD21      LEU  48  -0.311   9.092  -9.641
   10   HD21  LEU  48          HD22      LEU  48  -1.172   8.368  -8.285
   11   HD23  LEU  48          HD23      LEU  48   0.391   9.142  -8.025

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ASN  49           H        ASN  49  -4.938  11.844 -10.022
    2    HA   ASN  49           HA       ASN  49  -7.102  10.152  -9.482
    3    HB2  ASN  49           HB2      ASN  49  -7.173  12.583  -9.169
    4    HB3  ASN  49           HB3      ASN  49  -7.047  12.828 -10.907
    5   HD21  ASN  49          HD21      ASN  49  -9.131  13.906 -10.981
    6   HD22  ASN  49          HD22      ASN  49 -10.579  13.043 -10.794

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLU  50           H        GLU  50  -5.836  11.360 -12.570
    2    HA   GLU  50           HA       GLU  50  -7.773  10.078 -14.215
    3    HB2  GLU  50           HB2      GLU  50  -6.331  11.914 -15.031
    4    HB3  GLU  50           HB3      GLU  50  -4.923  10.860 -14.891
    5    HG2  GLU  50           HG2      GLU  50  -5.876   9.310 -16.526
    6    HG3  GLU  50           HG3      GLU  50  -7.349  10.269 -16.615

  No H/Q in entry =           6
  In of MODEL   52
    1    H    ALA  51           H        ALA  51  -4.591   9.128 -13.006
    2    HA   ALA  51           HA       ALA  51  -4.419   6.675 -14.420
    3    HB2  ALA  51           HB1      ALA  51  -2.435   6.414 -13.319
    4    HB1  ALA  51           HB2      ALA  51  -3.130   6.830 -11.752
    5    HB3  ALA  51           HB3      ALA  51  -2.690   8.105 -12.888

  No H/Q in entry =           5
  In of MODEL   52
    1    H    HIS  52           H        HIS  52  -5.605   7.497 -11.173
    2    HA   HIS  52           HA       HIS  52  -6.257   4.879 -10.339
    3    HB2  HIS  52           HB2      HIS  52  -6.145   6.835  -8.825
    4    HB3  HIS  52           HB3      HIS  52  -7.600   7.484  -9.581
    5    HD1  HIS  52           HD1      HIS  52  -9.794   5.915  -9.380
    6    HD2  HIS  52           HD2      HIS  52  -6.641   4.965  -6.826
    7    HE1  HIS  52           HE1      HIS  52 -10.760   4.427  -7.572
    8    HE2  HIS  52           HE2      HIS  52  -8.850   3.839  -6.006

  No H/Q in entry =           8
  In of MODEL   52
    1    H    LEU  53           H        LEU  53  -8.107   7.311 -12.131
    2    HA   LEU  53           HA       LEU  53 -10.596   5.988 -12.144
    3    HB2  LEU  53           HB2      LEU  53  -9.336   7.981 -14.017
    4    HB3  LEU  53           HB3      LEU  53 -10.928   7.297 -14.336
    5    HG   LEU  53           HG       LEU  53 -10.227   8.623 -11.698
    6   HD12  LEU  53          HD11      LEU  53 -11.427  10.612 -12.591
    7   HD11  LEU  53          HD12      LEU  53 -11.510   9.827 -14.169
    8   HD13  LEU  53          HD13      LEU  53  -9.950  10.274 -13.485
    9   HD21  LEU  53          HD21      LEU  53 -12.778   7.716 -13.045
   10   HD23  LEU  53          HD22      LEU  53 -12.808   8.988 -11.828
   11   HD22  LEU  53          HD23      LEU  53 -12.241   7.385 -11.404

  No H/Q in entry =          11
  In of MODEL   52
    1    H    VAL  54           H        VAL  54  -7.842   5.822 -14.379
    2    HA   VAL  54           HA       VAL  54  -9.041   4.033 -16.220
    3    HB   VAL  54           HB       VAL  54  -6.140   4.576 -15.536
    4   HG12  VAL  54          HG11      VAL  54  -5.878   3.491 -17.923
    5   HG11  VAL  54          HG12      VAL  54  -7.397   2.692 -17.520
    6   HG13  VAL  54          HG13      VAL  54  -5.979   2.456 -16.500
    7   HG22  VAL  54          HG21      VAL  54  -6.933   6.508 -16.584
    8   HG21  VAL  54          HG22      VAL  54  -8.115   5.629 -17.552
    9   HG23  VAL  54          HG23      VAL  54  -6.407   5.569 -17.981

  No H/Q in entry =           9
  In of MODEL   52
    1    H    GLN  55           H        GLN  55  -7.038   3.516 -13.318
    2    HA   GLN  55           HA       GLN  55  -6.914   0.700 -13.570
    3    HB2  GLN  55           HB2      GLN  55  -5.371   1.617 -12.051
    4    HB3  GLN  55           HB3      GLN  55  -6.599   2.569 -11.224
    5    HG2  GLN  55           HG2      GLN  55  -7.268   0.806  -9.904
    6    HG3  GLN  55           HG3      GLN  55  -7.028  -0.380 -11.181
    7   HE21  GLN  55          HE21      GLN  55  -5.387  -1.810 -10.683
    8   HE22  GLN  55          HE22      GLN  55  -4.008  -1.440  -9.770

  No H/Q in entry =           8
  In of MODEL   52
    1    H    THR  56           H        THR  56  -9.272   2.837 -11.961
    2    HA   THR  56           HA       THR  56 -10.835   0.936 -10.670
    3    HB   THR  56           HB       THR  56 -11.960   3.308 -12.182
    4    HG1  THR  56           HG1      THR  56 -10.272   3.139 -10.017
    5   HG21  THR  56          HG21      THR  56 -13.393   1.475 -10.969
    6   HG23  THR  56          HG22      THR  56 -13.770   3.179 -10.718
    7   HG22  THR  56          HG23      THR  56 -12.852   2.290  -9.502

  No H/Q in entry =           7
  In of MODEL   52
    1    H    LYS  57           H        LYS  57 -11.047   2.012 -14.058
    2    HA   LYS  57           HA       LYS  57 -13.182   0.298 -14.811
    3    HB2  LYS  57           HB2      LYS  57 -12.326   2.258 -16.129
    4    HB3  LYS  57           HB3      LYS  57 -10.877   1.332 -16.497
    5    HG2  LYS  57           HG2      LYS  57 -12.221  -0.360 -17.654
    6    HG3  LYS  57           HG3      LYS  57 -13.697   0.508 -17.248
    7    HD2  LYS  57           HD2      LYS  57 -12.910   2.456 -18.557
    8    HD3  LYS  57           HD3      LYS  57 -11.441   1.578 -18.978
    9    HE2  LYS  57           HE2      LYS  57 -12.785  -0.154 -20.114
   10    HE3  LYS  57           HE3      LYS  57 -14.270   0.693 -19.685
   11    HZ2  LYS  57           HZ1      LYS  57 -13.436   1.147 -21.962
   12    HZ1  LYS  57           HZ2      LYS  57 -12.083   1.910 -21.274
   13    HZ3  LYS  57           HZ3      LYS  57 -13.642   2.536 -21.011

  No H/Q in entry =          13
  In of MODEL   52
    1    H    LEU  58           H        LEU  58  -9.673  -0.091 -14.750
    2    HA   LEU  58           HA       LEU  58  -9.650  -2.611 -16.034
    3    HB2  LEU  58           HB2      LEU  58  -7.633  -1.292 -14.226
    4    HB3  LEU  58           HB3      LEU  58  -7.353  -2.811 -15.077
    5    HG   LEU  58           HG       LEU  58  -8.136  -0.219 -16.446
    6   HD11  LEU  58          HD11      LEU  58  -5.476  -1.423 -15.750
    7   HD13  LEU  58          HD12      LEU  58  -5.991   0.262 -15.704
    8   HD12  LEU  58          HD13      LEU  58  -5.641  -0.508 -17.249
    9   HD22  LEU  58          HD21      LEU  58  -8.692  -1.790 -18.035
   10   HD21  LEU  58          HD22      LEU  58  -7.637  -3.024 -17.350
   11   HD23  LEU  58          HD23      LEU  58  -6.960  -1.744 -18.356

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  59           H        ILE  59 -10.486  -1.712 -12.786
    2    HA   ILE  59           HA       ILE  59 -10.103  -4.473 -11.832
    3    HB   ILE  59           HB       ILE  59  -9.685  -2.201 -10.436
    4   HG12  ILE  59          HG12      ILE  59 -11.037  -4.561  -9.111
    5   HG13  ILE  59          HG13      ILE  59  -9.391  -4.627  -9.691
    6   HG21  ILE  59          HG21      ILE  59 -12.238  -1.729 -10.703
    7   HG23  ILE  59          HG22      ILE  59 -11.514  -1.506  -9.127
    8   HG22  ILE  59          HG23      ILE  59 -12.440  -2.962  -9.481
    9   HD12  ILE  59          HD11      ILE  59 -10.454  -2.642  -7.694
   10   HD11  ILE  59          HD12      ILE  59  -8.795  -2.695  -8.277
   11   HD13  ILE  59          HD13      ILE  59  -9.434  -4.024  -7.307

  No H/Q in entry =          11
  In of MODEL   52
    1    H    GLU  60           H        GLU  60 -12.687  -2.190 -12.648
    2    HA   GLU  60           HA       GLU  60 -14.855  -3.731 -11.635
    3    HB2  GLU  60           HB2      GLU  60 -15.095  -1.363 -12.235
    4    HB3  GLU  60           HB3      GLU  60 -14.768  -1.742 -13.922
    5    HG2  GLU  60           HG2      GLU  60 -16.785  -3.207 -13.955
    6    HG3  GLU  60           HG3      GLU  60 -17.134  -2.723 -12.308

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLY  61           H        GLY  61 -13.178  -3.701 -14.748
    2    HA3  GLY  61           HA2      GLY  61 -14.862  -5.968 -15.636
    3    HA2  GLY  61           HA3      GLY  61 -14.029  -4.855 -16.715

  No H/Q in entry =           3
  In of MODEL   52
    1    H    ASP  62           H        ASP  62 -12.643  -6.282 -13.826
    2    HA   ASP  62           HA       ASP  62 -10.375  -7.237 -15.301
    3    HB2  ASP  62           HB2      ASP  62  -9.603  -7.997 -13.078
    4    HB3  ASP  62           HB3      ASP  62 -10.139  -6.321 -13.048

  No H/Q in entry =           4
  In of MODEL   52
    1    H    ALA  63           H        ALA  63 -11.922  -8.670 -16.714
    2    HA   ALA  63           HA       ALA  63 -12.987 -11.100 -15.659
    3    HB1  ALA  63           HB1      ALA  63 -13.337  -9.912 -17.980
    4    HB2  ALA  63           HB2      ALA  63 -13.376 -11.673 -17.908
    5    HB3  ALA  63           HB3      ALA  63 -11.921 -10.845 -18.467

  No H/Q in entry =           5
  In of MODEL   52
    1    H    GLY  64           H        GLY  64  -9.876 -10.192 -17.024
    2    HA3  GLY  64           HA2      GLY  64  -7.791 -11.147 -16.791
    3    HA2  GLY  64           HA3      GLY  64  -8.492 -12.319 -15.684

  No H/Q in entry =           3
  In of MODEL   52
    1    H    GLU  65           H        GLU  65  -6.649 -13.326 -17.323
    2    HA   GLU  65           HA       GLU  65  -7.570 -14.142 -19.868
    3    HB2  GLU  65           HB2      GLU  65  -5.425 -15.263 -18.069
    4    HB3  GLU  65           HB3      GLU  65  -5.728 -15.847 -19.705
    5    HG2  GLU  65           HG2      GLU  65  -5.329 -13.612 -20.613
    6    HG3  GLU  65           HG3      GLU  65  -5.105 -12.970 -18.987

  No H/Q in entry =           6
  In of MODEL   52
    1    H    GLY  66           H        GLY  66  -7.747 -15.613 -16.723
    2    HA3  GLY  66           HA2      GLY  66  -8.957 -18.074 -17.653
    3    HA2  GLY  66           HA3      GLY  66  -8.591 -17.643 -15.994

  No H/Q in entry =           3
  In of MODEL   52
    1    H    LYS  67           H        LYS  67 -10.737 -18.737 -15.802
    2    HA   LYS  67           HA       LYS  67 -13.127 -17.709 -16.748
    3    HB2  LYS  67           HB2      LYS  67 -12.498 -19.253 -14.239
    4    HB3  LYS  67           HB3      LYS  67 -14.145 -18.918 -14.792
    5    HG2  LYS  67           HG2      LYS  67 -13.700 -20.017 -16.924
    6    HG3  LYS  67           HG3      LYS  67 -12.012 -20.262 -16.479
    7    HD2  LYS  67           HD2      LYS  67 -13.029 -22.348 -16.029
    8    HD3  LYS  67           HD3      LYS  67 -12.946 -21.567 -14.449
    9    HE2  LYS  67           HE2      LYS  67 -15.255 -20.902 -14.562
   10    HE3  LYS  67           HE3      LYS  67 -15.368 -21.378 -16.257
   11    HZ2  LYS  67           HZ1      LYS  67 -15.540 -22.993 -13.878
   12    HZ1  LYS  67           HZ2      LYS  67 -14.516 -23.640 -15.070
   13    HZ3  LYS  67           HZ3      LYS  67 -16.138 -23.290 -15.437

  No H/Q in entry =          13
  In of MODEL   52
    1    H    MET  68           H        MET  68 -13.153 -17.689 -13.365
    2    HA   MET  68           HA       MET  68 -14.298 -15.053 -13.225
    3    HB2  MET  68           HB2      MET  68 -13.654 -17.068 -11.071
    4    HB3  MET  68           HB3      MET  68 -14.598 -15.596 -10.842
    5    HG2  MET  68           HG2      MET  68 -15.818 -16.758 -13.031
    6    HG3  MET  68           HG3      MET  68 -15.389 -18.155 -12.042
    7    HE3  MET  68           HE1      MET  68 -16.700 -17.451  -8.647
    8    HE2  MET  68           HE2      MET  68 -15.732 -16.016  -8.974
    9    HE1  MET  68           HE3      MET  68 -15.181 -17.588  -9.546

  No H/Q in entry =           9
  In of MODEL   52
    1    H    LYS  69           H        LYS  69 -11.077 -16.057 -13.141
    2    HA   LYS  69           HA       LYS  69 -10.077 -14.476 -11.023
    3    HB2  LYS  69           HB2      LYS  69  -8.762 -15.692 -13.447
    4    HB3  LYS  69           HB3      LYS  69  -7.854 -14.821 -12.209
    5    HG2  LYS  69           HG2      LYS  69  -8.734 -16.347 -10.480
    6    HG3  LYS  69           HG3      LYS  69  -9.654 -17.212 -11.710
    7    HD2  LYS  69           HD2      LYS  69  -7.531 -17.780 -12.869
    8    HD3  LYS  69           HD3      LYS  69  -6.634 -16.973 -11.582
    9    HE2  LYS  69           HE2      LYS  69  -8.557 -19.272 -11.120
   10    HE3  LYS  69           HE3      LYS  69  -6.812 -19.463 -11.273
   11    HZ1  LYS  69           HZ1      LYS  69  -6.896 -17.560  -9.448
   12    HZ3  LYS  69           HZ2      LYS  69  -6.929 -19.210  -9.049
   13    HZ2  LYS  69           HZ3      LYS  69  -8.374 -18.316  -9.098

  No H/Q in entry =          13
  In of MODEL   52
    1    H    VAL  70           H        VAL  70  -7.932 -13.033 -11.910
    2    HA   VAL  70           HA       VAL  70  -9.056 -10.848 -13.563
    3    HB   VAL  70           HB       VAL  70  -8.035  -9.236 -11.992
    4   HG11  VAL  70          HG11      VAL  70 -10.436 -10.215 -11.796
    5   HG13  VAL  70          HG12      VAL  70  -9.794  -9.319 -10.419
    6   HG12  VAL  70          HG13      VAL  70  -9.805 -11.082 -10.396
    7   HG21  VAL  70          HG21      VAL  70  -6.265 -10.724 -11.083
    8   HG23  VAL  70          HG22      VAL  70  -7.503 -11.702 -10.298
    9   HG22  VAL  70          HG23      VAL  70  -7.233 -10.039  -9.779

  No H/Q in entry =           9
  In of MODEL   52
    1    H    SER  71           H        SER  71  -7.378  -9.404 -14.407
    2    HA   SER  71           HA       SER  71  -5.227 -10.796 -15.633
    3    HB2  SER  71           HB2      SER  71  -6.280  -8.766 -16.605
    4    HB3  SER  71           HB3      SER  71  -5.614  -7.810 -15.284
    5    HG   SER  71           HG       SER  71  -3.986  -9.459 -16.897

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LEU  72           H        LEU  72  -3.131 -11.013 -15.054
    2    HA   LEU  72           HA       LEU  72  -2.417 -10.784 -12.342
    3    HB2  LEU  72           HB2      LEU  72  -0.759 -11.202 -14.823
    4    HB3  LEU  72           HB3      LEU  72  -0.093 -11.258 -13.194
    5    HG   LEU  72           HG       LEU  72  -2.425 -12.984 -14.087
    6   HD12  LEU  72          HD11      LEU  72  -0.721 -14.814 -14.206
    7   HD11  LEU  72          HD12      LEU  72   0.543 -13.602 -13.996
    8   HD13  LEU  72          HD13      LEU  72  -0.480 -13.569 -15.433
    9   HD23  LEU  72          HD21      LEU  72  -1.419 -14.371 -12.107
   10   HD22  LEU  72          HD22      LEU  72  -2.411 -12.977 -11.715
   11   HD21  LEU  72          HD23      LEU  72  -0.656 -12.855 -11.643

  No H/Q in entry =          11
  In of MODEL   52
    1    H    VAL  73           H        VAL  73  -1.720  -8.766 -15.126
    2    HA   VAL  73           HA       VAL  73   0.180  -7.044 -14.024
    3    HB   VAL  73           HB       VAL  73  -0.174  -5.675 -15.900
    4   HG12  VAL  73          HG11      VAL  73  -1.198  -8.361 -16.838
    5   HG11  VAL  73          HG12      VAL  73   0.471  -8.116 -16.328
    6   HG13  VAL  73          HG13      VAL  73  -0.168  -7.226 -17.708
    7   HG23  VAL  73          HG21      VAL  73  -2.343  -5.972 -17.256
    8   HG22  VAL  73          HG22      VAL  73  -2.475  -5.105 -15.727
    9   HG21  VAL  73          HG23      VAL  73  -2.983  -6.791 -15.831

  No H/Q in entry =           9
  In of MODEL   52
    1    H    LEU  74           H        LEU  74  -3.217  -7.196 -13.471
    2    HA   LEU  74           HA       LEU  74  -3.865  -4.546 -12.866
    3    HB2  LEU  74           HB2      LEU  74  -5.576  -6.230 -13.037
    4    HB3  LEU  74           HB3      LEU  74  -4.876  -7.144 -11.704
    5    HG   LEU  74           HG       LEU  74  -5.362  -5.272 -10.164
    6   HD12  LEU  74          HD11      LEU  74  -6.972  -3.506 -11.135
    7   HD11  LEU  74          HD12      LEU  74  -6.386  -4.019 -12.716
    8   HD13  LEU  74          HD13      LEU  74  -5.264  -3.337 -11.539
    9   HD21  LEU  74          HD21      LEU  74  -7.044  -7.133 -11.026
   10   HD23  LEU  74          HD22      LEU  74  -7.887  -5.720 -11.626
   11   HD22  LEU  74          HD23      LEU  74  -7.563  -5.868  -9.916

  No H/Q in entry =          11
  In of MODEL   52
    1    H    VAL  75           H        VAL  75  -2.799  -7.116 -10.696
    2    HA   VAL  75           HA       VAL  75  -2.621  -5.557  -8.356
    3    HB   VAL  75           HB       VAL  75  -1.103  -8.040  -9.141
    4   HG13  VAL  75          HG11      VAL  75   0.155  -6.791  -7.420
    5   HG12  VAL  75          HG12      VAL  75  -0.634  -8.177  -6.681
    6   HG11  VAL  75          HG13      VAL  75  -1.318  -6.573  -6.481
    7   HG23  VAL  75          HG21      VAL  75  -3.443  -7.583  -7.258
    8   HG22  VAL  75          HG22      VAL  75  -2.753  -9.139  -7.719
    9   HG21  VAL  75          HG23      VAL  75  -3.614  -8.166  -8.914

  No H/Q in entry =           9
  In of MODEL   52
    1    H    GLU  76           H        GLU  76  -0.200  -6.296 -10.887
    2    HA   GLU  76           HA       GLU  76   1.969  -4.922  -9.730
    3    HB2  GLU  76           HB2      GLU  76   2.196  -6.399 -11.707
    4    HB3  GLU  76           HB3      GLU  76   1.266  -5.260 -12.669
    5    HG2  GLU  76           HG2      GLU  76   3.599  -4.891 -13.166
    6    HG3  GLU  76           HG3      GLU  76   3.059  -3.523 -12.212

  No H/Q in entry =           6
  In of MODEL   52
    1    H    ALA  77           H        ALA  77  -0.573  -3.754 -11.925
    2    HA   ALA  77           HA       ALA  77   0.388  -1.098 -12.105
    3    HB2  ALA  77           HB1      ALA  77  -2.078  -0.613 -12.683
    4    HB3  ALA  77           HB2      ALA  77  -2.325  -2.352 -12.512
    5    HB1  ALA  77           HB3      ALA  77  -1.206  -1.737 -13.728

  No H/Q in entry =           5
  In of MODEL   52
    1    H    GLN  78           H        GLN  78  -1.866  -2.673  -9.894
    2    HA   GLN  78           HA       GLN  78  -2.702  -0.361  -8.500
    3    HB2  GLN  78           HB2      GLN  78  -3.786  -2.632  -8.411
    4    HB3  GLN  78           HB3      GLN  78  -2.445  -3.175  -7.406
    5    HG2  GLN  78           HG2      GLN  78  -2.983  -1.435  -5.748
    6    HG3  GLN  78           HG3      GLN  78  -4.329  -0.895  -6.749
    7   HE21  GLN  78          HE21      GLN  78  -4.774  -1.867  -4.090
    8   HE22  GLN  78          HE22      GLN  78  -5.616  -3.338  -4.195

  No H/Q in entry =           8
  In of MODEL   52
    1    H    LEU  79           H        LEU  79   0.002  -2.585  -8.040
    2    HA   LEU  79           HA       LEU  79   0.964  -1.671  -5.583
    3    HB2  LEU  79           HB2      LEU  79   1.859  -3.672  -6.645
    4    HB3  LEU  79           HB3      LEU  79   2.496  -2.715  -7.979
    5    HG   LEU  79           HG       LEU  79   4.036  -1.554  -6.476
    6   HD13  LEU  79          HD11      LEU  79   3.025  -1.316  -4.411
    7   HD12  LEU  79          HD12      LEU  79   4.119  -2.652  -4.062
    8   HD11  LEU  79          HD13      LEU  79   2.418  -2.973  -4.394
    9   HD23  LEU  79          HD21      LEU  79   5.270  -3.686  -5.566
   10   HD22  LEU  79          HD22      LEU  79   5.068  -3.493  -7.304
   11   HD21  LEU  79          HD23      LEU  79   4.001  -4.574  -6.412

  No H/Q in entry =          11
  In of MODEL   52
    1    H    HIS  80           H        HIS  80   1.826  -0.551  -8.857
    2    HA   HIS  80           HA       HIS  80   3.608   1.460  -7.937
    3    HB2  HIS  80           HB2      HIS  80   2.331   0.744 -10.520
    4    HB3  HIS  80           HB3      HIS  80   2.905   2.404 -10.352
    5    HD1  HIS  80           HD1      HIS  80   5.304   2.733 -10.871
    6    HD2  HIS  80           HD2      HIS  80   4.531  -1.185  -9.672
    7    HE1  HIS  80           HE1      HIS  80   7.509   1.483 -11.030
    8    HE2  HIS  80           HE2      HIS  80   7.050  -0.908 -10.303

  No H/Q in entry =           8
  In of MODEL   52
    1    H    LEU  81           H        LEU  81   0.204   1.575  -8.923
    2    HA   LEU  81           HA       LEU  81  -0.108   4.365  -8.599
    3    HB2  LEU  81           HB2      LEU  81  -2.094   2.094  -8.518
    4    HB3  LEU  81           HB3      LEU  81  -2.568   3.792  -8.431
    5    HG   LEU  81           HG       LEU  81  -0.856   2.659 -10.661
    6   HD12  LEU  81          HD11      LEU  81  -3.090   2.947 -11.965
    7   HD11  LEU  81          HD12      LEU  81  -3.848   2.872 -10.374
    8   HD13  LEU  81          HD13      LEU  81  -2.886   1.515 -10.957
    9   HD23  LEU  81          HD21      LEU  81  -1.979   4.786 -11.765
   10   HD22  LEU  81          HD22      LEU  81  -0.566   4.977 -10.730
   11   HD21  LEU  81          HD23      LEU  81  -2.177   5.306 -10.093

  No H/Q in entry =          11
  In of MODEL   52
    1    H    MET  82           H        MET  82  -0.736   1.675  -6.345
    2    HA   MET  82           HA       MET  82  -1.813   3.252  -4.263
    3    HB2  MET  82           HB2      MET  82  -0.403   0.583  -4.294
    4    HB3  MET  82           HB3      MET  82  -0.994   1.304  -2.799
    5    HG2  MET  82           HG2      MET  82  -2.716   0.782  -5.242
    6    HG3  MET  82           HG3      MET  82  -2.626  -0.288  -3.844
    7    HE3  MET  82           HE1      MET  82  -4.376   1.345  -1.036
    8    HE2  MET  82           HE2      MET  82  -2.649   1.645  -1.218
    9    HE1  MET  82           HE3      MET  82  -3.315   0.078  -1.670

  No H/Q in entry =           9
  In of MODEL   52
    1    H    THR  83           H        THR  83   1.504   2.209  -4.944
    2    HA   THR  83           HA       THR  83   2.702   3.334  -2.644
    3    HB   THR  83           HB       THR  83   4.800   3.304  -4.114
    4    HG1  THR  83           HG1      THR  83   4.571   2.770  -6.137
    5   HG22  THR  83          HG21      THR  83   4.393   0.639  -4.441
    6   HG21  THR  83          HG22      THR  83   3.096   1.004  -3.304
    7   HG23  THR  83          HG23      THR  83   4.770   1.371  -2.882

  No H/Q in entry =           7
  In of MODEL   52
    1    H    SER  84           H        SER  84   2.320   4.601  -5.948
    2    HA   SER  84           HA       SER  84   3.626   7.060  -5.495
    3    HB2  SER  84           HB2      SER  84   1.571   6.196  -7.517
    4    HB3  SER  84           HB3      SER  84   2.227   7.832  -7.494
    5    HG   SER  84           HG       SER  84   3.634   5.375  -7.777

  No H/Q in entry =           5
  In of MODEL   52
    1    H    MET  85           H        MET  85   0.142   6.257  -5.328
    2    HA   MET  85           HA       MET  85  -0.755   8.857  -4.734
    3    HB2  MET  85           HB2      MET  85  -2.253   7.029  -5.402
    4    HB3  MET  85           HB3      MET  85  -1.956   6.227  -3.861
    5    HG2  MET  85           HG2      MET  85  -2.868   8.181  -2.661
    6    HG3  MET  85           HG3      MET  85  -3.154   8.991  -4.200
    7    HE1  MET  85           HE1      MET  85  -4.421   6.768  -1.517
    8    HE3  MET  85           HE2      MET  85  -3.753   5.460  -2.493
    9    HE2  MET  85           HE3      MET  85  -5.496   5.584  -2.271

  No H/Q in entry =           9
  In of MODEL   52
    1    H    LEU  86           H        LEU  86   0.196   6.212  -2.583
    2    HA   LEU  86           HA       LEU  86  -0.359   7.512  -0.145
    3    HB2  LEU  86           HB2      LEU  86   0.137   5.047  -0.533
    4    HB3  LEU  86           HB3      LEU  86   1.839   5.498  -0.626
    5    HG   LEU  86           HG       LEU  86   1.495   6.659   1.639
    6   HD11  LEU  86          HD11      LEU  86  -1.188   5.858   1.165
    7   HD13  LEU  86          HD12      LEU  86  -0.534   6.616   2.615
    8   HD12  LEU  86          HD13      LEU  86  -0.603   4.859   2.499
    9   HD23  LEU  86          HD21      LEU  86   1.104   3.662   1.767
   10   HD22  LEU  86          HD22      LEU  86   2.092   4.686   2.806
   11   HD21  LEU  86          HD23      LEU  86   2.600   4.364   1.149

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ALA  87           H        ALA  87   2.629   7.251  -2.029
    2    HA   ALA  87           HA       ALA  87   4.314   8.686  -0.303
    3    HB3  ALA  87           HB1      ALA  87   4.426   7.669  -3.009
    4    HB2  ALA  87           HB2      ALA  87   5.755   8.018  -1.906
    5    HB1  ALA  87           HB3      ALA  87   5.127   9.289  -2.954

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ARG  88           H        ARG  88   2.358   9.793  -3.029
    2    HA   ARG  88           HA       ARG  88   3.100  12.492  -2.916
    3    HB2  ARG  88           HB2      ARG  88   1.863  11.321  -4.773
    4    HB3  ARG  88           HB3      ARG  88   0.403  11.450  -3.793
    5    HG2  ARG  88           HG2      ARG  88   1.392  14.042  -3.713
    6    HG3  ARG  88           HG3      ARG  88   1.824  13.530  -5.341
    7    HD2  ARG  88           HD2      ARG  88  -0.316  13.584  -6.043
    8    HD3  ARG  88           HD3      ARG  88  -0.896  12.726  -4.614
    9    HE   ARG  88           HE       ARG  88  -1.116  15.501  -5.037
   10   HH21  ARG  88          HH11      ARG  88  -1.661  16.828  -3.302
   11   HH22  ARG  88          HH12      ARG  88  -1.362  16.297  -1.683
   12   HH11  ARG  88          HH21      ARG  88  -0.079  13.255  -2.657
   13   HH12  ARG  88          HH22      ARG  88  -0.483  14.267  -1.318

  No H/Q in entry =          13
  In of MODEL   52
    1    H    GLU  89           H        GLU  89   0.413  10.790  -1.277
    2    HA   GLU  89           HA       GLU  89  -0.722  13.091  -0.078
    3    HB2  GLU  89           HB2      GLU  89  -1.815  10.840  -0.163
    4    HB3  GLU  89           HB3      GLU  89  -0.687  10.299   1.081
    5    HG2  GLU  89           HG2      GLU  89  -1.528  11.991   2.636
    6    HG3  GLU  89           HG3      GLU  89  -2.585  12.648   1.390

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LEU  90           H        LEU  90   1.753  10.828   1.104
    2    HA   LEU  90           HA       LEU  90   2.091  12.080   3.632
    3    HB2  LEU  90           HB2      LEU  90   3.886  10.323   1.960
    4    HB3  LEU  90           HB3      LEU  90   4.297  10.846   3.598
    5    HG   LEU  90           HG       LEU  90   1.678   9.472   2.936
    6   HD12  LEU  90          HD11      LEU  90   2.838   7.440   3.949
    7   HD11  LEU  90          HD12      LEU  90   4.351   8.311   3.708
    8   HD13  LEU  90          HD13      LEU  90   3.346   7.891   2.320
    9   HD22  LEU  90          HD21      LEU  90   1.400  10.396   5.056
   10   HD21  LEU  90          HD22      LEU  90   3.119  10.307   5.440
   11   HD23  LEU  90          HD23      LEU  90   2.127   8.849   5.490

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  91           H        ILE  91   3.695  12.475   0.507
    2    HA   ILE  91           HA       ILE  91   5.652  14.327   1.346
    3    HB   ILE  91           HB       ILE  91   4.349  13.819  -1.335
    4   HG12  ILE  91          HG12      ILE  91   7.185  13.362  -0.356
    5   HG13  ILE  91          HG13      ILE  91   5.916  12.152  -0.194
    6   HG22  ILE  91          HG21      ILE  91   6.560  15.188  -2.023
    7   HG21  ILE  91          HG22      ILE  91   6.239  15.987  -0.483
    8   HG23  ILE  91          HG23      ILE  91   5.018  16.002  -1.754
    9   HD13  ILE  91          HD11      ILE  91   5.749  11.823  -2.501
   10   HD12  ILE  91          HD12      ILE  91   7.480  12.084  -2.285
   11   HD11  ILE  91          HD13      ILE  91   6.458  13.396  -2.875

  No H/Q in entry =          11
  In of MODEL   52
    1    H    THR  92           H        THR  92   2.287  14.725   0.333
    2    HA   THR  92           HA       THR  92   2.233  17.548   0.268
    3    HB   THR  92           HB       THR  92   0.085  15.533   0.967
    4    HG1  THR  92           HG1      THR  92   0.394  15.354  -1.117
    5   HG22  THR  92          HG21      THR  92  -1.336  17.680   0.240
    6   HG21  THR  92          HG22      THR  92   0.047  18.519   0.937
    7   HG23  THR  92          HG23      THR  92  -0.885  17.390   1.919

  No H/Q in entry =           7
  In of MODEL   52
    1    H    GLU  93           H        GLU  93   1.704  15.246   2.924
    2    HA   GLU  93           HA       GLU  93   1.150  17.148   4.939
    3    HB2  GLU  93           HB2      GLU  93   2.490  14.436   5.181
    4    HB3  GLU  93           HB3      GLU  93   1.788  15.359   6.512
    5    HG2  GLU  93           HG2      GLU  93   0.187  14.561   4.072
    6    HG3  GLU  93           HG3      GLU  93   0.296  13.542   5.502

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LEU  94           H        LEU  94   4.173  15.693   3.796
    2    HA   LEU  94           HA       LEU  94   5.910  16.860   5.685
    3    HB2  LEU  94           HB2      LEU  94   6.325  15.893   2.856
    4    HB3  LEU  94           HB3      LEU  94   7.646  16.565   3.806
    5    HG   LEU  94           HG       LEU  94   5.926  14.354   4.942
    6   HD11  LEU  94          HD11      LEU  94   8.027  14.145   2.814
    7   HD13  LEU  94          HD12      LEU  94   6.590  13.158   3.075
    8   HD12  LEU  94          HD13      LEU  94   8.017  12.920   4.084
    9   HD23  LEU  94          HD21      LEU  94   8.119  13.840   6.098
   10   HD22  LEU  94          HD22      LEU  94   7.437  15.413   6.511
   11   HD21  LEU  94          HD23      LEU  94   8.778  15.303   5.371

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  95           H        ILE  95   4.763  18.016   2.531
    2    HA   ILE  95           HA       ILE  95   6.313  20.389   2.471
    3    HB   ILE  95           HB       ILE  95   3.677  19.677   1.162
    4   HG12  ILE  95          HG12      ILE  95   6.464  20.040   0.029
    5   HG13  ILE  95          HG13      ILE  95   5.829  18.481   0.545
    6   HG21  ILE  95          HG21      ILE  95   5.403  22.161   0.941
    7   HG23  ILE  95          HG22      ILE  95   3.679  22.077   1.294
    8   HG22  ILE  95          HG23      ILE  95   4.268  21.680  -0.320
    9   HD13  ILE  95          HD11      ILE  95   4.273  18.388  -1.186
   10   HD12  ILE  95          HD12      ILE  95   5.615  19.217  -1.974
   11   HD11  ILE  95          HD13      ILE  95   4.233  20.140  -1.384

  No H/Q in entry =          11
  In of MODEL   52
    1    H    GLU  96           H        GLU  96   3.069  19.707   3.762
    2    HA   GLU  96           HA       GLU  96   2.422  22.349   4.508
    3    HB2  GLU  96           HB2      GLU  96   0.765  20.550   4.520
    4    HB3  GLU  96           HB3      GLU  96   1.632  19.733   5.818
    5    HG2  GLU  96           HG2      GLU  96   0.597  21.009   7.384
    6    HG3  GLU  96           HG3      GLU  96   1.120  22.487   6.586

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LEU  97           H        LEU  97   4.286  19.819   6.140
    2    HA   LEU  97           HA       LEU  97   4.628  21.174   8.609
    3    HB2  LEU  97           HB2      LEU  97   6.187  19.018   7.200
    4    HB3  LEU  97           HB3      LEU  97   6.768  19.710   8.712
    5    HG   LEU  97           HG       LEU  97   3.970  18.590   8.399
    6   HD12  LEU  97          HD11      LEU  97   4.926  16.588   9.616
    7   HD11  LEU  97          HD12      LEU  97   6.532  17.234   9.274
    8   HD13  LEU  97          HD13      LEU  97   5.469  16.764   7.947
    9   HD23  LEU  97          HD21      LEU  97   4.421  18.304  10.965
   10   HD22  LEU  97          HD22      LEU  97   4.027  19.911  10.357
   11   HD21  LEU  97          HD23      LEU  97   5.702  19.487  10.705

  No H/Q in entry =          11
  In of MODEL   52
    1    H    HIS  98           H        HIS  98   6.502  21.203   5.586
    2    HA   HIS  98           HA       HIS  98   8.640  22.803   6.486
    3    HB2  HIS  98           HB2      HIS  98   7.354  22.532   3.759
    4    HB3  HIS  98           HB3      HIS  98   8.784  23.524   4.050
    5    HD1  HIS  98           HD1      HIS  98   7.605  19.943   4.073
    6    HD2  HIS  98           HD2      HIS  98  11.167  22.072   4.500
    7    HE1  HIS  98           HE1      HIS  98   9.475  18.230   4.022
    8    HE2  HIS  98           HE2      HIS  98  11.648  19.506   4.282

  No H/Q in entry =           8
  In of MODEL   52
    1    H    GLU  99           H        GLU  99   5.414  23.608   5.305
    2    HA   GLU  99           HA       GLU  99   5.768  26.426   5.243
    3    HB2  GLU  99           HB2      GLU  99   3.901  25.238   4.112
    4    HB3  GLU  99           HB3      GLU  99   3.206  24.873   5.690
    5    HG2  GLU  99           HG2      GLU  99   3.004  27.264   6.187
    6    HG3  GLU  99           HG3      GLU  99   3.779  27.668   4.659

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LYS 100           H        LYS 100   4.653  24.184   7.767
    2    HA   LYS 100           HA       LYS 100   4.046  26.236   9.657
    3    HB2  LYS 100           HB2      LYS 100   4.646  23.290  10.008
    4    HB3  LYS 100           HB3      LYS 100   4.188  24.361  11.338
    5    HG2  LYS 100           HG2      LYS 100   2.118  24.979  10.086
    6    HG3  LYS 100           HG3      LYS 100   2.557  23.812   8.836
    7    HD2  LYS 100           HD2      LYS 100   2.493  21.993  10.500
    8    HD3  LYS 100           HD3      LYS 100   2.071  23.154  11.761
    9    HE2  LYS 100           HE2      LYS 100   0.015  23.756  10.494
   10    HE3  LYS 100           HE3      LYS 100   0.427  22.537   9.280
   11    HZ1  LYS 100           HZ1      LYS 100   0.163  21.873  12.162
   12    HZ3  LYS 100           HZ2      LYS 100   0.158  20.817  10.828
   13    HZ2  LYS 100           HZ3      LYS 100  -1.167  21.845  11.105

  No H/Q in entry =          13
  In of MODEL   52
    1    H    LEU 101           H        LEU 101   6.986  24.464   8.830
    2    HA   LEU 101           HA       LEU 101   8.574  25.321  11.035
    3    HB2  LEU 101           HB2      LEU 101   9.181  24.335   8.259
    4    HB3  LEU 101           HB3      LEU 101  10.476  25.013   9.241
    5    HG   LEU 101           HG       LEU 101   8.661  22.843  10.305
    6   HD12  LEU 101          HD11      LEU 101  10.728  21.364   9.703
    7   HD11  LEU 101          HD12      LEU 101  11.086  22.629   8.528
    8   HD13  LEU 101          HD13      LEU 101   9.565  21.743   8.434
    9   HD21  LEU 101          HD21      LEU 101  11.374  23.975  11.036
   10   HD23  LEU 101          HD22      LEU 101  10.843  22.399  11.617
   11   HD22  LEU 101          HD23      LEU 101   9.938  23.848  12.051

  No H/Q in entry =          11
  In of MODEL   52
    1    H    LYS 102           H        LYS 102   6.979  27.168   8.889
    2    HA   LYS 102           HA       LYS 102   7.038  29.461   8.594
    3    HB2  LYS 102           HB2      LYS 102   8.600  29.362  10.695
    4    HB3  LYS 102           HB3      LYS 102   9.899  29.565   9.537
    5    HG2  LYS 102           HG2      LYS 102   7.776  31.502  10.393
    6    HG3  LYS 102           HG3      LYS 102   9.487  31.776  10.143
    7    HD2  LYS 102           HD2      LYS 102   7.543  31.334   7.841
    8    HD3  LYS 102           HD3      LYS 102   7.912  32.917   8.508
    9    HE2  LYS 102           HE2      LYS 102   9.298  31.741   6.438
   10    HE3  LYS 102           HE3      LYS 102   9.902  33.054   7.449
   11    HZ2  LYS 102           HZ1      LYS 102  11.438  31.162   7.278
   12    HZ1  LYS 102           HZ2      LYS 102  10.283  30.171   8.020
   13    HZ3  LYS 102           HZ3      LYS 102  10.964  31.465   8.879

  No H/Q in entry =          13
  In of MODEL   52
    1    H    ALA 103           H        ALA 103  10.306  28.148   8.036
    2    HA   ALA 103           HA       ALA 103  11.262  29.529   5.960
    3    HB2  ALA 103           HB1      ALA 103  12.166  27.321   5.036
    4    HB1  ALA 103           HB2      ALA 103  11.276  26.542   6.342
    5    HB3  ALA 103           HB3      ALA 103  12.555  27.697   6.716

  No H/Q in entry =           5
  In of MODEL   52
    1    H1   LYS   3           H1       LYS   3 -31.197   6.393 -19.544
    2    H2   LYS   3           H3       LYS   3 -30.219   6.106 -20.902
    3    H3   LYS   3           H2       LYS   3 -31.618   5.178 -20.651
    4    HA   LYS   3           HA       LYS   3 -30.617   3.774 -19.262
    5    HB2  LYS   3           HB2      LYS   3 -28.334   5.178 -20.601
    6    HB3  LYS   3           HB3      LYS   3 -28.010   3.960 -19.367
    7    HG2  LYS   3           HG2      LYS   3 -29.452   2.392 -20.717
    8    HG3  LYS   3           HG3      LYS   3 -29.406   3.599 -22.001
    9    HD2  LYS   3           HD2      LYS   3 -26.924   3.467 -21.968
   10    HD3  LYS   3           HD3      LYS   3 -27.044   2.163 -20.787
   11    HE2  LYS   3           HE2      LYS   3 -28.563   1.008 -22.500
   12    HE3  LYS   3           HE3      LYS   3 -27.941   2.188 -23.653
   13    HZ3  LYS   3           HZ1      LYS   3 -26.154   0.949 -23.942
   14    HZ2  LYS   3           HZ2      LYS   3 -26.785  -0.221 -22.885
   15    HZ1  LYS   3           HZ3      LYS   3 -25.783   1.012 -22.287

  No H/Q in entry =          15
  In of MODEL   52
    1    H    LYS   4           H        LYS   4 -30.657   3.620 -17.201
    2    HA   LYS   4           HA       LYS   4 -29.899   5.893 -15.543
    3    HB2  LYS   4           HB2      LYS   4 -31.116   3.205 -14.850
    4    HB3  LYS   4           HB3      LYS   4 -30.877   4.535 -13.718
    5    HG2  LYS   4           HG2      LYS   4 -32.701   4.501 -16.127
    6    HG3  LYS   4           HG3      LYS   4 -33.180   4.546 -14.432
    7    HD2  LYS   4           HD2      LYS   4 -32.464   6.761 -14.158
    8    HD3  LYS   4           HD3      LYS   4 -31.435   6.703 -15.588
    9    HE2  LYS   4           HE2      LYS   4 -33.353   8.094 -16.030
   10    HE3  LYS   4           HE3      LYS   4 -33.451   6.628 -17.006
   11    HZ3  LYS   4           HZ1      LYS   4 -35.024   5.720 -15.453
   12    HZ2  LYS   4           HZ2      LYS   4 -35.570   7.222 -16.025
   13    HZ1  LYS   4           HZ3      LYS   4 -34.905   7.098 -14.468

  No H/Q in entry =          13
  In of MODEL   52
    1    H    HIS   5           H        HIS   5 -28.419   5.956 -13.960
    2    HA   HIS   5           HA       HIS   5 -26.155   4.109 -14.318
    3    HB2  HIS   5           HB2      HIS   5 -26.376   6.859 -13.094
    4    HB3  HIS   5           HB3      HIS   5 -24.903   5.892 -13.092
    5    HD1  HIS   5           HD1      HIS   5 -23.433   7.086 -14.686
    6    HD2  HIS   5           HD2      HIS   5 -27.250   6.509 -16.218
    7    HE1  HIS   5           HE1      HIS   5 -23.277   7.679 -17.133
    8    HE2  HIS   5           HE2      HIS   5 -25.603   7.315 -18.037

  No H/Q in entry =           8
  In of MODEL   52
    1    H    ILE   6           H        ILE   6 -25.931   2.527 -13.011
    2    HA   ILE   6           HA       ILE   6 -26.885   2.788 -10.239
    3    HB   ILE   6           HB       ILE   6 -26.095   0.323 -11.795
    4   HG12  ILE   6          HG12      ILE   6 -28.823   1.281 -10.921
    5   HG13  ILE   6          HG13      ILE   6 -28.191   1.445 -12.558
    6   HG23  ILE   6          HG21      ILE   6 -26.468  -0.936  -9.940
    7   HG22  ILE   6          HG22      ILE   6 -27.609   0.217  -9.246
    8   HG21  ILE   6          HG23      ILE   6 -25.876   0.535  -9.167
    9   HD13  ILE   6          HD11      ILE   6 -28.674  -0.666 -13.067
   10   HD12  ILE   6          HD12      ILE   6 -29.679  -0.648 -11.619
   11   HD11  ILE   6          HD13      ILE   6 -28.031  -1.271 -11.541

  No H/Q in entry =          11
  In of MODEL   52
    1    H    TYR   7           H        TYR   7 -25.112   3.405  -8.961
    2    HA   TYR   7           HA       TYR   7 -22.415   2.425  -9.664
    3    HB2  TYR   7           HB2      TYR   7 -23.344   4.859  -8.164
    4    HB3  TYR   7           HB3      TYR   7 -21.665   4.327  -8.216
    5    HD1  TYR   7           HD1      TYR   7 -22.735   3.413 -11.304
    6    HD2  TYR   7           HD2      TYR   7 -22.013   6.967  -9.063
    7    HE1  TYR   7           HE1      TYR   7 -22.304   4.650 -13.391
    8    HE2  TYR   7           HE2      TYR   7 -21.625   8.209 -11.141
    9    HH   TYR   7           HH       TYR   7 -21.860   8.137 -13.372

  No H/Q in entry =           9
  In of MODEL   52
    1    H    LEU   8           H        LEU   8 -21.454   1.055  -8.349
    2    HA   LEU   8           HA       LEU   8 -22.572   0.557  -5.660
    3    HB2  LEU   8           HB2      LEU   8 -20.899  -1.113  -7.515
    4    HB3  LEU   8           HB3      LEU   8 -21.077  -1.503  -5.805
    5    HG   LEU   8           HG       LEU   8 -23.561  -1.647  -6.211
    6   HD13  LEU   8          HD11      LEU   8 -23.694  -0.418  -8.313
    7   HD12  LEU   8          HD12      LEU   8 -24.242  -2.076  -8.559
    8   HD11  LEU   8          HD13      LEU   8 -22.633  -1.591  -9.092
    9   HD23  LEU   8          HD21      LEU   8 -22.319  -3.692  -7.925
   10   HD22  LEU   8          HD22      LEU   8 -23.399  -3.856  -6.540
   11   HD21  LEU   8          HD23      LEU   8 -21.687  -3.522  -6.288

  No H/Q in entry =          11
  In of MODEL   52
    1    H    PHE   9           H        PHE   9 -21.289   0.952  -3.882
    2    HA   PHE   9           HA       PHE   9 -18.498   1.862  -4.413
    3    HB2  PHE   9           HB2      PHE   9 -20.504   2.936  -2.436
    4    HB3  PHE   9           HB3      PHE   9 -18.790   3.325  -2.394
    5    HD1  PHE   9           HD1      PHE   9 -17.751   4.648  -4.166
    6    HD2  PHE   9           HD2      PHE   9 -21.957   3.801  -4.205
    7    HE1  PHE   9           HE1      PHE   9 -18.082   6.374  -5.911
    8    HE2  PHE   9           HE2      PHE   9 -22.290   5.540  -5.945
    9    HZ   PHE   9           HZ       PHE   9 -20.350   6.821  -6.803

  No H/Q in entry =           9
  In of MODEL   52
    1    H    SER  10           H        SER  10 -16.911   0.875  -3.338
    2    HA   SER  10           HA       SER  10 -17.088  -0.037  -0.649
    3    HB2  SER  10           HB2      SER  10 -18.350  -1.877  -1.720
    4    HB3  SER  10           HB3      SER  10 -16.989  -2.160  -2.795
    5    HG   SER  10           HG       SER  10 -15.724  -2.508  -0.887

  No H/Q in entry =           5
  In of MODEL   52
    1    H    SER  11           H        SER  11 -15.066   0.077   0.148
    2    HA   SER  11           HA       SER  11 -12.891   0.901  -1.415
    3    HB2  SER  11           HB2      SER  11 -11.631   0.856   0.561
    4    HB3  SER  11           HB3      SER  11 -13.285   1.152   1.102
    5    HG   SER  11           HG       SER  11 -13.381  -1.234   1.295

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ALA  12           H        ALA  12 -14.130  -1.795  -2.170
    2    HA   ALA  12           HA       ALA  12 -11.569  -3.068  -2.733
    3    HB1  ALA  12           HB1      ALA  12 -13.808  -4.576  -1.364
    4    HB3  ALA  12           HB2      ALA  12 -12.246  -4.171  -0.655
    5    HB2  ALA  12           HB3      ALA  12 -12.331  -5.295  -2.010

  No H/Q in entry =           5
  In of MODEL   52
    1    H    GLY  13           H        GLY  13 -12.316  -2.081  -4.762
    2    HA3  GLY  13           HA2      GLY  13 -14.587  -2.731  -6.214
    3    HA2  GLY  13           HA3      GLY  13 -13.030  -2.315  -6.946

  No H/Q in entry =           3
  In of MODEL   52
    1    H    MET  14           H        MET  14 -11.559  -4.628  -6.034
    2    HA   MET  14           HA       MET  14 -12.007  -6.366  -8.140
    3    HB2  MET  14           HB2      MET  14  -9.940  -6.499  -6.848
    4    HB3  MET  14           HB3      MET  14 -10.809  -7.146  -5.458
    5    HG2  MET  14           HG2      MET  14 -11.456  -9.126  -6.802
    6    HG3  MET  14           HG3      MET  14 -10.574  -8.472  -8.182
    7    HE2  MET  14           HE1      MET  14  -7.759  -7.264  -6.776
    8    HE1  MET  14           HE2      MET  14  -8.370  -7.882  -8.309
    9    HE3  MET  14           HE3      MET  14  -7.010  -8.681  -7.525

  No H/Q in entry =           9
  In of MODEL   52
    1    H    SER  15           H        SER  15 -13.184  -6.904  -4.814
    2    HA   SER  15           HA       SER  15 -14.612  -9.287  -5.567
    3    HB2  SER  15           HB2      SER  15 -14.117  -9.208  -3.252
    4    HB3  SER  15           HB3      SER  15 -14.730  -7.564  -3.096
    5    HG   SER  15           HG       SER  15 -16.606  -9.284  -4.083

  No H/Q in entry =           5
  In of MODEL   52
    1    H    THR  16           H        THR  16 -15.600  -5.884  -5.096
    2    HA   THR  16           HA       THR  16 -18.410  -6.298  -5.580
    3    HB   THR  16           HB       THR  16 -16.786  -3.784  -6.105
    4    HG1  THR  16           HG1      THR  16 -18.079  -3.916  -3.726
    5   HG21  THR  16          HG21      THR  16 -19.675  -4.261  -5.330
    6   HG23  THR  16          HG22      THR  16 -19.104  -3.743  -6.927
    7   HG22  THR  16          HG23      THR  16 -18.919  -2.684  -5.521

  No H/Q in entry =           7
  In of MODEL   52
    1    H    SER  17           H        SER  17 -15.605  -5.761  -7.470
    2    HA   SER  17           HA       SER  17 -16.739  -4.997  -9.961
    3    HB2  SER  17           HB2      SER  17 -14.121  -6.361  -9.296
    4    HB3  SER  17           HB3      SER  17 -14.569  -5.874 -10.930
    5    HG   SER  17           HG       SER  17 -14.680  -4.028  -8.816

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LEU  18           H        LEU  18 -16.192  -8.154  -8.531
    2    HA   LEU  18           HA       LEU  18 -16.806  -9.636 -10.891
    3    HB2  LEU  18           HB2      LEU  18 -15.585 -10.608  -8.987
    4    HB3  LEU  18           HB3      LEU  18 -17.019 -10.425  -7.981
    5    HG   LEU  18           HG       LEU  18 -18.241 -11.992  -9.387
    6   HD13  LEU  18          HD11      LEU  18 -17.446 -11.767 -11.559
    7   HD12  LEU  18          HD12      LEU  18 -16.683 -13.279 -11.066
    8   HD11  LEU  18          HD13      LEU  18 -15.759 -11.778 -11.049
    9   HD23  LEU  18          HD21      LEU  18 -15.580 -13.187  -8.702
   10   HD22  LEU  18          HD22      LEU  18 -17.165 -13.963  -8.702
   11   HD21  LEU  18          HD23      LEU  18 -16.784 -12.734  -7.495

  No H/Q in entry =          11
  In of MODEL   52
    1    H    LEU  19           H        LEU  19 -18.748  -8.424  -8.163
    2    HA   LEU  19           HA       LEU  19 -21.226  -9.580  -8.988
    3    HB2  LEU  19           HB2      LEU  19 -20.903  -8.743  -6.730
    4    HB3  LEU  19           HB3      LEU  19 -20.671  -7.110  -7.351
    5    HG   LEU  19           HG       LEU  19 -22.997  -6.949  -7.951
    6   HD11  LEU  19          HD11      LEU  19 -22.968  -9.869  -7.339
    7   HD13  LEU  19          HD12      LEU  19 -23.779  -9.002  -8.642
    8   HD12  LEU  19          HD13      LEU  19 -24.440  -8.955  -7.008
    9   HD21  LEU  19          HD21      LEU  19 -22.375  -7.903  -5.179
   10   HD23  LEU  19          HD22      LEU  19 -23.982  -7.330  -5.628
   11   HD22  LEU  19          HD23      LEU  19 -22.592  -6.253  -5.761

  No H/Q in entry =          11
  In of MODEL   52
    1    H    VAL  20           H        VAL  20 -19.706  -6.430  -9.675
    2    HA   VAL  20           HA       VAL  20 -21.816  -5.361 -11.227
    3    HB   VAL  20           HB       VAL  20 -18.823  -4.796 -11.363
    4   HG11  VAL  20          HG11      VAL  20 -21.126  -3.492 -12.821
    5   HG13  VAL  20          HG12      VAL  20 -19.646  -4.160 -13.508
    6   HG12  VAL  20          HG13      VAL  20 -19.585  -2.676 -12.560
    7   HG21  VAL  20          HG21      VAL  20 -21.144  -3.530  -9.970
    8   HG23  VAL  20          HG22      VAL  20 -19.707  -2.592 -10.365
    9   HG22  VAL  20          HG23      VAL  20 -19.575  -4.006  -9.321

  No H/Q in entry =           9
  In of MODEL   52
    1    H    SER  21           H        SER  21 -19.084  -7.431 -12.280
    2    HA   SER  21           HA       SER  21 -19.883  -7.297 -15.026
    3    HB2  SER  21           HB2      SER  21 -18.466  -9.275 -15.378
    4    HB3  SER  21           HB3      SER  21 -17.620  -8.043 -14.443
    5    HG   SER  21           HG       SER  21 -17.249  -9.813 -13.316

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LYS  22           H        LYS  22 -20.954  -9.487 -12.459
    2    HA   LYS  22           HA       LYS  22 -22.518 -11.082 -14.281
    3    HB2  LYS  22           HB2      LYS  22 -22.807 -10.742 -11.292
    4    HB3  LYS  22           HB3      LYS  22 -23.605 -11.971 -12.273
    5    HG2  LYS  22           HG2      LYS  22 -20.619 -11.739 -11.935
    6    HG3  LYS  22           HG3      LYS  22 -21.653 -12.813 -10.993
    7    HD2  LYS  22           HD2      LYS  22 -22.339 -13.948 -13.068
    8    HD3  LYS  22           HD3      LYS  22 -21.266 -12.892 -13.987
    9    HE2  LYS  22           HE2      LYS  22 -19.331 -13.793 -12.770
   10    HE3  LYS  22           HE3      LYS  22 -20.400 -14.840 -11.837
   11    HZ1  LYS  22           HZ1      LYS  22 -20.021 -14.965 -14.776
   12    HZ3  LYS  22           HZ2      LYS  22 -20.989 -16.004 -13.844
   13    HZ2  LYS  22           HZ3      LYS  22 -19.302 -16.010 -13.647

  No H/Q in entry =          13
  In of MODEL   52
    1    H    MET  23           H        MET  23 -23.202  -8.163 -12.393
    2    HA   MET  23           HA       MET  23 -26.012  -8.210 -12.884
    3    HB2  MET  23           HB2      MET  23 -24.138  -5.924 -12.310
    4    HB3  MET  23           HB3      MET  23 -25.883  -5.736 -12.476
    5    HG2  MET  23           HG2      MET  23 -26.277  -7.046 -10.513
    6    HG3  MET  23           HG3      MET  23 -24.570  -7.476 -10.398
    7    HE2  MET  23           HE1      MET  23 -26.823  -3.807  -9.177
    8    HE1  MET  23           HE2      MET  23 -27.096  -4.764 -10.631
    9    HE3  MET  23           HE3      MET  23 -26.045  -3.349 -10.693

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ARG  24           H        ARG  24 -23.253  -6.801 -14.676
    2    HA   ARG  24           HA       ARG  24 -24.747  -5.474 -16.659
    3    HB2  ARG  24           HB2      ARG  24 -22.294  -5.113 -16.281
    4    HB3  ARG  24           HB3      ARG  24 -21.985  -6.702 -16.936
    5    HG2  ARG  24           HG2      ARG  24 -22.842  -5.998 -19.159
    6    HG3  ARG  24           HG3      ARG  24 -23.204  -4.386 -18.488
    7    HD2  ARG  24           HD2      ARG  24 -21.035  -4.235 -19.553
    8    HD3  ARG  24           HD3      ARG  24 -20.783  -4.241 -17.812
    9    HE   ARG  24           HE       ARG  24 -19.555  -6.072 -17.916
   10   HH21  ARG  24          HH11      ARG  24 -18.008  -6.930 -19.303
   11   HH22  ARG  24          HH12      ARG  24 -18.489  -7.556 -20.842
   12   HH11  ARG  24          HH21      ARG  24 -21.750  -6.224 -20.488
   13   HH12  ARG  24          HH22      ARG  24 -20.707  -7.143 -21.529

  No H/Q in entry =          13
  In of MODEL   52
    1    H    ALA  25           H        ALA  25 -23.663  -8.827 -16.409
    2    HA   ALA  25           HA       ALA  25 -24.314  -9.634 -19.047
    3    HB1  ALA  25           HB1      ALA  25 -23.639 -11.679 -18.367
    4    HB3  ALA  25           HB2      ALA  25 -24.688 -11.654 -16.950
    5    HB2  ALA  25           HB3      ALA  25 -23.123 -10.846 -16.901

  No H/Q in entry =           5
  In of MODEL   52
    1    H    GLN  26           H        GLN  26 -26.125  -9.670 -16.014
    2    HA   GLN  26           HA       GLN  26 -28.489 -10.838 -17.025
    3    HB2  GLN  26           HB2      GLN  26 -27.942  -9.111 -14.630
    4    HB3  GLN  26           HB3      GLN  26 -29.516  -9.814 -14.977
    5    HG2  GLN  26           HG2      GLN  26 -26.946 -11.304 -14.530
    6    HG3  GLN  26           HG3      GLN  26 -28.299 -11.192 -13.413
    7   HE21  GLN  26          HE21      GLN  26 -27.115 -13.363 -14.709
    8   HE22  GLN  26          HE22      GLN  26 -28.174 -14.393 -15.506

  No H/Q in entry =           8
  In of MODEL   52
    1    H    ALA  27           H        ALA  27 -27.511  -7.455 -16.617
    2    HA   ALA  27           HA       ALA  27 -29.991  -6.326 -17.381
    3    HB1  ALA  27           HB1      ALA  27 -28.160  -5.041 -16.267
    4    HB3  ALA  27           HB2      ALA  27 -28.748  -4.258 -17.735
    5    HB2  ALA  27           HB3      ALA  27 -27.223  -5.143 -17.760

  No H/Q in entry =           5
  In of MODEL   52
    1    H    GLU  28           H        GLU  28 -27.315  -7.570 -19.272
    2    HA   GLU  28           HA       GLU  28 -28.250  -6.502 -21.780
    3    HB2  GLU  28           HB2      GLU  28 -25.877  -7.219 -21.173
    4    HB3  GLU  28           HB3      GLU  28 -26.444  -8.874 -21.383
    5    HG2  GLU  28           HG2      GLU  28 -25.298  -8.099 -23.352
    6    HG3  GLU  28           HG3      GLU  28 -27.001  -8.399 -23.694

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LYS  29           H        LYS  29 -28.447  -9.617 -20.144
    2    HA   LYS  29           HA       LYS  29 -29.778 -11.058 -22.151
    3    HB2  LYS  29           HB2      LYS  29 -28.731 -12.067 -20.159
    4    HB3  LYS  29           HB3      LYS  29 -29.988 -11.351 -19.152
    5    HG2  LYS  29           HG2      LYS  29 -31.671 -12.696 -20.221
    6    HG3  LYS  29           HG3      LYS  29 -30.486 -13.338 -21.356
    7    HD2  LYS  29           HD2      LYS  29 -29.349 -14.531 -19.637
    8    HD3  LYS  29           HD3      LYS  29 -30.239 -13.687 -18.372
    9    HE2  LYS  29           HE2      LYS  29 -31.023 -16.024 -18.745
   10    HE3  LYS  29           HE3      LYS  29 -32.287 -14.814 -18.974
   11    HZ1  LYS  29           HZ1      LYS  29 -31.737 -14.938 -21.405
   12    HZ3  LYS  29           HZ2      LYS  29 -32.470 -16.321 -20.746
   13    HZ2  LYS  29           HZ3      LYS  29 -30.802 -16.311 -21.053

  No H/Q in entry =          13
  In of MODEL   52
    1    H    TYR  30           H        TYR  30 -31.131  -8.952 -19.625
    2    HA   TYR  30           HA       TYR  30 -33.806  -9.360 -20.855
    3    HB2  TYR  30           HB2      TYR  30 -33.124  -8.234 -18.130
    4    HB3  TYR  30           HB3      TYR  30 -34.748  -8.466 -18.776
    5    HD1  TYR  30           HD1      TYR  30 -35.688 -10.746 -19.001
    6    HD2  TYR  30           HD2      TYR  30 -31.835 -10.083 -17.313
    7    HE1  TYR  30           HE1      TYR  30 -35.623 -13.080 -18.221
    8    HE2  TYR  30           HE2      TYR  30 -31.771 -12.404 -16.537
    9    HH   TYR  30           HH       TYR  30 -33.445 -14.736 -17.638

  No H/Q in entry =           9
  In of MODEL   52
    1    H    GLU  31           H        GLU  31 -31.620  -7.389 -21.653
    2    HA   GLU  31           HA       GLU  31 -31.524  -5.227 -22.461
    3    HB2  GLU  31           HB2      GLU  31 -34.430  -5.905 -22.963
    4    HB3  GLU  31           HB3      GLU  31 -33.577  -4.541 -23.687
    5    HG2  GLU  31           HG2      GLU  31 -32.128  -5.988 -24.897
    6    HG3  GLU  31           HG3      GLU  31 -32.705  -7.402 -24.015

  No H/Q in entry =           6
  In of MODEL   52
    1    H    VAL  32           H        VAL  32 -31.707  -5.143 -19.727
    2    HA   VAL  32           HA       VAL  32 -33.542  -3.013 -19.042
    3    HB   VAL  32           HB       VAL  32 -31.152  -4.046 -17.482
    4   HG12  VAL  32          HG11      VAL  32 -32.669  -3.218 -15.572
    5   HG11  VAL  32          HG12      VAL  32 -33.498  -2.296 -16.826
    6   HG13  VAL  32          HG13      VAL  32 -31.786  -2.014 -16.512
    7   HG21  VAL  32          HG21      VAL  32 -32.944  -5.741 -18.173
    8   HG23  VAL  32          HG22      VAL  32 -33.968  -4.910 -17.002
    9   HG22  VAL  32          HG23      VAL  32 -32.457  -5.655 -16.480

  No H/Q in entry =           9
  In of MODEL   52
    1    HA   PRO  33           HA       PRO  33 -30.485  -0.107 -20.711
    2    HB2  PRO  33           HB2      PRO  33 -31.972   2.131 -20.563
    3    HB3  PRO  33           HB3      PRO  33 -32.461   0.842 -21.664
    4    HG2  PRO  33           HG2      PRO  33 -33.408   1.348 -18.843
    5    HG3  PRO  33           HG3      PRO  33 -34.382   1.161 -20.301
    6    HD2  PRO  33           HD2      PRO  33 -33.940  -0.928 -18.653
    7    HD3  PRO  33           HD3      PRO  33 -34.015  -1.156 -20.401

  No H/Q in entry =           7
  In of MODEL   52
    1    H    VAL  34           H        VAL  34 -29.217  -0.680 -18.774
    2    HA   VAL  34           HA       VAL  34 -28.899   1.730 -17.109
    3    HB   VAL  34           HB       VAL  34 -28.324   0.248 -15.185
    4   HG12  VAL  34          HG11      VAL  34 -30.743  -0.601 -14.871
    5   HG11  VAL  34          HG12      VAL  34 -31.060   0.173 -16.423
    6   HG13  VAL  34          HG13      VAL  34 -30.490   1.133 -15.057
    7   HG21  VAL  34          HG21      VAL  34 -28.541  -1.761 -17.207
    8   HG23  VAL  34          HG22      VAL  34 -29.595  -2.121 -15.839
    9   HG22  VAL  34          HG23      VAL  34 -27.872  -1.854 -15.578

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ILE  35           H        ILE  35 -26.914   2.139 -16.277
    2    HA   ILE  35           HA       ILE  35 -24.630   0.795 -17.562
    3    HB   ILE  35           HB       ILE  35 -24.996   3.683 -16.727
    4   HG12  ILE  35          HG12      ILE  35 -24.040   2.385 -19.286
    5   HG13  ILE  35          HG13      ILE  35 -25.663   3.021 -19.013
    6   HG21  ILE  35          HG21      ILE  35 -22.451   2.127 -17.062
    7   HG23  ILE  35          HG22      ILE  35 -22.887   3.302 -15.822
    8   HG22  ILE  35          HG23      ILE  35 -22.508   3.844 -17.456
    9   HD11  ILE  35          HD11      ILE  35 -24.237   5.196 -18.403
   10   HD13  ILE  35          HD12      ILE  35 -24.786   4.831 -20.040
   11   HD12  ILE  35          HD13      ILE  35 -23.135   4.441 -19.555

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ILE  36           H        ILE  36 -23.401  -0.253 -15.977
    2    HA   ILE  36           HA       ILE  36 -23.821   0.346 -13.100
    3    HB   ILE  36           HB       ILE  36 -23.026  -2.358 -14.233
    4   HG12  ILE  36          HG12      ILE  36 -25.821  -1.529 -13.447
    5   HG13  ILE  36          HG13      ILE  36 -25.258  -1.502 -15.119
    6   HG23  ILE  36          HG21      ILE  36 -23.374  -3.198 -12.123
    7   HG22  ILE  36          HG22      ILE  36 -24.485  -1.907 -11.668
    8   HG21  ILE  36          HG23      ILE  36 -22.752  -1.592 -11.746
    9   HD13  ILE  36          HD11      ILE  36 -25.446  -3.712 -15.341
   10   HD12  ILE  36          HD12      ILE  36 -26.503  -3.591 -13.934
   11   HD11  ILE  36          HD13      ILE  36 -24.808  -4.029 -13.728

  No H/Q in entry =          11
  In of MODEL   52
    1    H    GLU  37           H        GLU  37 -22.026   0.949 -12.000
    2    HA   GLU  37           HA       GLU  37 -19.349   0.132 -12.937
    3    HB2  GLU  37           HB2      GLU  37 -20.218   2.926 -12.213
    4    HB3  GLU  37           HB3      GLU  37 -18.535   2.418 -12.353
    5    HG2  GLU  37           HG2      GLU  37 -18.857   1.968 -14.715
    6    HG3  GLU  37           HG3      GLU  37 -20.549   2.444 -14.582

  No H/Q in entry =           6
  In of MODEL   52
    1    H    ALA  38           H        ALA  38 -17.856  -0.133 -11.265
    2    HA   ALA  38           HA       ALA  38 -18.870   0.035  -8.487
    3    HB1  ALA  38           HB1      ALA  38 -17.183  -1.909  -9.936
    4    HB3  ALA  38           HB2      ALA  38 -18.226  -2.146  -8.536
    5    HB2  ALA  38           HB3      ALA  38 -16.607  -1.479  -8.326

  No H/Q in entry =           5
  In of MODEL   52
    1    H    PHE  39           H        PHE  39 -17.611   1.222  -7.011
    2    HA   PHE  39           HA       PHE  39 -15.080   2.409  -7.913
    3    HB2  PHE  39           HB2      PHE  39 -17.476   3.910  -6.874
    4    HB3  PHE  39           HB3      PHE  39 -15.841   4.563  -6.786
    5    HD1  PHE  39           HD1      PHE  39 -14.531   4.567  -9.051
    6    HD2  PHE  39           HD2      PHE  39 -18.777   4.408  -8.689
    7    HE1  PHE  39           HE1      PHE  39 -14.749   5.462 -11.352
    8    HE2  PHE  39           HE2      PHE  39 -19.010   5.294 -10.981
    9    HZ   PHE  39           HZ       PHE  39 -17.002   5.794 -12.331

  No H/Q in entry =           9
  In of MODEL   52
    1    HA   PRO  40           HA       PRO  40 -14.124   1.615  -3.638
    2    HB2  PRO  40           HB2      PRO  40 -12.337   3.611  -3.025
    3    HB3  PRO  40           HB3      PRO  40 -11.911   2.283  -4.106
    4    HG2  PRO  40           HG2      PRO  40 -12.918   5.033  -4.825
    5    HG3  PRO  40           HG3      PRO  40 -11.501   4.186  -5.446
    6    HD2  PRO  40           HD2      PRO  40 -13.732   4.125  -6.844
    7    HD3  PRO  40           HD3      PRO  40 -12.788   2.646  -6.669

  No H/Q in entry =           7
  In of MODEL   52
    1    H    GLU  41           H        GLU  41 -14.727   2.582  -1.497
    2    HA   GLU  41           HA       GLU  41 -16.958   4.301  -1.455
    3    HB2  GLU  41           HB2      GLU  41 -16.917   4.074   0.861
    4    HB3  GLU  41           HB3      GLU  41 -16.145   2.589   0.303
    5    HG2  GLU  41           HG2      GLU  41 -14.895   3.336   2.160
    6    HG3  GLU  41           HG3      GLU  41 -13.931   3.700   0.729

  No H/Q in entry =           6
  In of MODEL   52
    1    H    THR  42           H        THR  42 -13.621   5.194  -1.519
    2    HA   THR  42           HA       THR  42 -13.948   7.748  -0.285
    3    HB   THR  42           HB       THR  42 -11.794   8.314  -1.392
    4    HG1  THR  42           HG1      THR  42 -11.417   7.293  -3.183
    5   HG23  THR  42          HG21      THR  42 -10.454   6.720  -0.208
    6   HG22  THR  42          HG22      THR  42 -11.727   5.501  -0.290
    7   HG21  THR  42          HG23      THR  42 -11.936   6.927   0.725

  No H/Q in entry =           7
  In of MODEL   52
    1    H    LEU  43           H        LEU  43 -14.878   6.683  -3.389
    2    HA   LEU  43           HA       LEU  43 -15.116   9.465  -4.337
    3    HB2  LEU  43           HB2      LEU  43 -15.534   6.841  -5.759
    4    HB3  LEU  43           HB3      LEU  43 -15.685   8.436  -6.494
    5    HG   LEU  43           HG       LEU  43 -13.123   7.220  -5.488
    6   HD13  LEU  43          HD11      LEU  43 -12.606   6.649  -7.660
    7   HD12  LEU  43          HD12      LEU  43 -13.733   7.816  -8.347
    8   HD11  LEU  43          HD13      LEU  43 -14.339   6.321  -7.635
    9   HD23  LEU  43          HD21      LEU  43 -12.262   9.187  -6.965
   10   HD22  LEU  43          HD22      LEU  43 -12.818   9.519  -5.325
   11   HD21  LEU  43          HD23      LEU  43 -13.868   9.861  -6.699

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ALA  44           H        ALA  44 -17.064   7.640  -2.486
    2    HA   ALA  44           HA       ALA  44 -19.550   7.526  -3.795
    3    HB2  ALA  44           HB1      ALA  44 -19.408   6.393  -1.709
    4    HB3  ALA  44           HB2      ALA  44 -20.505   7.744  -1.419
    5    HB1  ALA  44           HB3      ALA  44 -18.829   7.837  -0.876

  No H/Q in entry =           5
  In of MODEL   52
    1    H    GLY  45           H        GLY  45 -18.103  10.306  -2.251
    2    HA3  GLY  45           HA2      GLY  45 -20.531  11.824  -2.588
    3    HA2  GLY  45           HA3      GLY  45 -18.979  12.434  -2.014

  No H/Q in entry =           3
  In of MODEL   52
    1    H    GLU  46           H        GLU  46 -17.467  11.503  -4.320
    2    HA   GLU  46           HA       GLU  46 -18.098  13.737  -6.070
    3    HB2  GLU  46           HB2      GLU  46 -15.918  11.644  -6.117
    4    HB3  GLU  46           HB3      GLU  46 -16.047  12.968  -7.276
    5    HG2  GLU  46           HG2      GLU  46 -14.485  13.760  -5.782
    6    HG3  GLU  46           HG3      GLU  46 -15.979  14.487  -5.191

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LYS  47           H        LYS  47 -18.005  10.220  -6.530
    2    HA   LYS  47           HA       LYS  47 -19.117  10.467  -9.199
    3    HB2  LYS  47           HB2      LYS  47 -18.570   8.053  -7.463
    4    HB3  LYS  47           HB3      LYS  47 -19.129   7.988  -9.134
    5    HG2  LYS  47           HG2      LYS  47 -16.578   9.349  -8.358
    6    HG3  LYS  47           HG3      LYS  47 -16.655   7.625  -8.717
    7    HD2  LYS  47           HD2      LYS  47 -17.626   8.141 -10.915
    8    HD3  LYS  47           HD3      LYS  47 -17.496   9.862 -10.556
    9    HE2  LYS  47           HE2      LYS  47 -15.068   9.631 -10.360
   10    HE3  LYS  47           HE3      LYS  47 -15.204   7.912 -10.728
   11    HZ3  LYS  47           HZ1      LYS  47 -14.865   8.627 -12.802
   12    HZ2  LYS  47           HZ2      LYS  47 -15.394  10.207 -12.479
   13    HZ1  LYS  47           HZ3      LYS  47 -16.527   8.975 -12.770

  No H/Q in entry =          13
  In of MODEL   52
    1    H    GLY  48           H        GLY  48 -20.428   9.696  -6.048
    2    HA3  GLY  48           HA2      GLY  48 -22.825   8.533  -6.784
    3    HA2  GLY  48           HA3      GLY  48 -22.585   9.515  -5.339

  No H/Q in entry =           3
  In of MODEL   52
    1    H    GLN  49           H        GLN  49 -21.993  11.945  -6.896
    2    HA   GLN  49           HA       GLN  49 -24.546  13.076  -7.018
    3    HB2  GLN  49           HB2      GLN  49 -22.004  13.931  -8.387
    4    HB3  GLN  49           HB3      GLN  49 -23.458  14.906  -8.288
    5    HG2  GLN  49           HG2      GLN  49 -23.286  14.912  -5.852
    6    HG3  GLN  49           HG3      GLN  49 -21.844  13.916  -5.949
    7   HE21  GLN  49          HE21      GLN  49 -21.704  16.135  -4.662
    8   HE22  GLN  49          HE22      GLN  49 -20.775  17.388  -5.306

  No H/Q in entry =           8
  In of MODEL   52
    1    H    ASN  50           H        ASN  50 -22.894  11.202  -9.428
    2    HA   ASN  50           HA       ASN  50 -24.782  12.102 -11.494
    3    HB2  ASN  50           HB2      ASN  50 -22.215  10.544 -11.752
    4    HB3  ASN  50           HB3      ASN  50 -23.269  10.988 -13.087
    5   HD21  ASN  50          HD21      ASN  50 -20.619  11.803 -11.485
    6   HD22  ASN  50          HD22      ASN  50 -20.375  13.439 -11.817

  No H/Q in entry =           6
  In of MODEL   52
    1    H    ALA  51           H        ALA  51 -24.772   9.729  -9.264
    2    HA   ALA  51           HA       ALA  51 -25.584   7.603 -11.101
    3    HB2  ALA  51           HB1      ALA  51 -25.000   6.238  -9.428
    4    HB3  ALA  51           HB2      ALA  51 -26.110   7.047  -8.323
    5    HB1  ALA  51           HB3      ALA  51 -24.469   7.657  -8.525

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ASP  52           H        ASP  52 -27.595   6.562 -10.958
    2    HA   ASP  52           HA       ASP  52 -29.758   8.408 -10.267
    3    HB2  ASP  52           HB2      ASP  52 -29.597   5.913 -11.955
    4    HB3  ASP  52           HB3      ASP  52 -31.133   6.655 -11.508

  No H/Q in entry =           4
  In of MODEL   52
    1    H    VAL  53           H        VAL  53 -28.176   5.499  -9.280
    2    HA   VAL  53           HA       VAL  53 -29.600   5.620  -6.755
    3    HB   VAL  53           HB       VAL  53 -31.019   3.998  -8.002
    4   HG11  VAL  53          HG11      VAL  53 -29.289   3.136  -9.541
    5   HG13  VAL  53          HG12      VAL  53 -30.128   1.841  -8.686
    6   HG12  VAL  53          HG13      VAL  53 -28.510   2.327  -8.181
    7   HG23  VAL  53          HG21      VAL  53 -30.205   2.003  -6.329
    8   HG22  VAL  53          HG22      VAL  53 -31.321   3.314  -5.947
    9   HG21  VAL  53          HG23      VAL  53 -29.610   3.469  -5.549

  No H/Q in entry =           9
  In of MODEL   52
    1    H    VAL  54           H        VAL  54 -28.282   5.164  -5.111
    2    HA   VAL  54           HA       VAL  54 -25.532   4.295  -5.744
    3    HB   VAL  54           HB       VAL  54 -26.574   6.067  -3.476
    4   HG11  VAL  54          HG11      VAL  54 -24.010   4.627  -3.792
    5   HG13  VAL  54          HG12      VAL  54 -24.749   5.303  -2.341
    6   HG12  VAL  54          HG13      VAL  54 -23.841   6.346  -3.434
    7   HG22  VAL  54          HG21      VAL  54 -25.705   7.881  -4.568
    8   HG21  VAL  54          HG22      VAL  54 -26.270   6.906  -5.923
    9   HG23  VAL  54          HG23      VAL  54 -24.561   6.913  -5.495

  No H/Q in entry =           9
  In of MODEL   52
    1    H    LEU  55           H        LEU  55 -24.955   2.364  -5.118
    2    HA   LEU  55           HA       LEU  55 -26.461   1.051  -2.944
    3    HB2  LEU  55           HB2      LEU  55 -24.928  -0.113  -5.255
    4    HB3  LEU  55           HB3      LEU  55 -25.689  -1.050  -3.970
    5    HG   LEU  55           HG       LEU  55 -27.124   0.565  -6.067
    6   HD13  LEU  55          HD11      LEU  55 -26.848  -1.281  -7.301
    7   HD12  LEU  55          HD12      LEU  55 -27.806  -2.157  -6.108
    8   HD11  LEU  55          HD13      LEU  55 -26.049  -2.109  -5.966
    9   HD23  LEU  55          HD21      LEU  55 -28.426  -1.382  -4.219
   10   HD22  LEU  55          HD22      LEU  55 -29.113   0.012  -5.053
   11   HD21  LEU  55          HD23      LEU  55 -28.083   0.248  -3.641

  No H/Q in entry =          11
  In of MODEL   52
    1    H    LEU  56           H        LEU  56 -25.305   0.435  -1.150
    2    HA   LEU  56           HA       LEU  56 -22.368   0.803  -1.213
    3    HB2  LEU  56           HB2      LEU  56 -24.158   0.592   1.195
    4    HB3  LEU  56           HB3      LEU  56 -22.445   1.006   1.177
    5    HG   LEU  56           HG       LEU  56 -24.734   2.712   0.238
    6   HD11  LEU  56          HD11      LEU  56 -23.608   2.302   2.749
    7   HD13  LEU  56          HD12      LEU  56 -24.589   3.684   2.258
    8   HD12  LEU  56          HD13      LEU  56 -22.832   3.773   2.161
    9   HD23  LEU  56          HD21      LEU  56 -22.775   4.394   0.045
   10   HD22  LEU  56          HD22      LEU  56 -23.175   3.310  -1.288
   11   HD21  LEU  56          HD23      LEU  56 -21.819   2.937  -0.225

  No H/Q in entry =          11
  In of MODEL   52
    1    H    GLY  57           H        GLY  57 -20.999  -0.843  -0.698
    2    HA3  GLY  57           HA2      GLY  57 -21.949  -3.519  -0.909
    3    HA2  GLY  57           HA3      GLY  57 -20.319  -3.044  -0.438

  No H/Q in entry =           3
  In of MODEL   52
    1    HA   PRO  58           HA       PRO  58 -23.116  -4.082   3.283
    2    HB2  PRO  58           HB2      PRO  58 -22.453  -6.697   3.868
    3    HB3  PRO  58           HB3      PRO  58 -23.839  -6.269   2.866
    4    HG2  PRO  58           HG2      PRO  58 -21.124  -7.170   2.058
    5    HG3  PRO  58           HG3      PRO  58 -22.697  -7.610   1.392
    6    HD2  PRO  58           HD2      PRO  58 -21.077  -5.800   0.173
    7    HD3  PRO  58           HD3      PRO  58 -22.837  -5.696   0.082

  No H/Q in entry =           7
  In of MODEL   52
    1    H    GLN  59           H        GLN  59 -19.754  -4.582   2.654
    2    HA   GLN  59           HA       GLN  59 -18.983  -4.626   5.411
    3    HB2  GLN  59           HB2      GLN  59 -17.259  -3.556   3.191
    4    HB3  GLN  59           HB3      GLN  59 -16.762  -4.320   4.687
    5    HG2  GLN  59           HG2      GLN  59 -16.369  -5.958   3.104
    6    HG3  GLN  59           HG3      GLN  59 -17.937  -6.416   3.748
    7   HE21  GLN  59          HE21      GLN  59 -18.750  -7.215   2.144
    8   HE22  GLN  59          HE22      GLN  59 -19.220  -6.836   0.594

  No H/Q in entry =           8
  In of MODEL   52
    1    H    ILE  60           H        ILE  60 -19.904  -2.051   3.225
    2    HA   ILE  60           HA       ILE  60 -19.022  -0.117   5.279
    3    HB   ILE  60           HB       ILE  60 -19.256   1.627   3.462
    4   HG12  ILE  60          HG12      ILE  60 -19.077  -0.601   1.475
    5   HG13  ILE  60          HG13      ILE  60 -20.656  -0.038   2.020
    6   HG21  ILE  60          HG21      ILE  60 -17.134   0.374   4.198
    7   HG23  ILE  60          HG22      ILE  60 -17.101   1.361   2.737
    8   HG22  ILE  60          HG23      ILE  60 -17.245  -0.392   2.613
    9   HD11  ILE  60          HD11      ILE  60 -19.678   2.330   1.387
   10   HD13  ILE  60          HD12      ILE  60 -20.348   1.276   0.144
   11   HD12  ILE  60          HD13      ILE  60 -18.603   1.376   0.367

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ALA  61           H        ALA  61 -21.492  -1.678   5.351
    2    HA   ALA  61           HA       ALA  61 -23.705   0.011   4.917
    3    HB1  ALA  61           HB1      ALA  61 -24.927  -1.477   6.239
    4    HB2  ALA  61           HB2      ALA  61 -23.527  -1.886   7.231
    5    HB3  ALA  61           HB3      ALA  61 -23.638  -2.480   5.574

  No H/Q in entry =           5
  In of MODEL   52
    1    H    TYR  62           H        TYR  62 -21.483  -0.142   7.701
    2    HA   TYR  62           HA       TYR  62 -23.012   1.519   9.391
    3    HB2  TYR  62           HB2      TYR  62 -20.979   1.892  10.632
    4    HB3  TYR  62           HB3      TYR  62 -21.019   0.208  10.115
    5    HD1  TYR  62           HD1      TYR  62 -19.430  -0.624   8.427
    6    HD2  TYR  62           HD2      TYR  62 -19.281   3.433   9.759
    7    HE1  TYR  62           HE1      TYR  62 -17.219  -0.363   7.368
    8    HE2  TYR  62           HE2      TYR  62 -17.056   3.689   8.702
    9    HH   TYR  62           HH       TYR  62 -15.546   0.961   7.013

  No H/Q in entry =           9
  In of MODEL   52
    1    H    MET  63           H        MET  63 -21.376   2.381   6.532
    2    HA   MET  63           HA       MET  63 -21.177   5.206   7.245
    3    HB2  MET  63           HB2      MET  63 -20.603   3.699   4.693
    4    HB3  MET  63           HB3      MET  63 -20.384   5.439   4.891
    5    HG2  MET  63           HG2      MET  63 -18.671   5.046   6.562
    6    HG3  MET  63           HG3      MET  63 -18.904   3.306   6.406
    7    HE1  MET  63           HE1      MET  63 -18.287   6.499   4.835
    8    HE3  MET  63           HE2      MET  63 -18.397   6.065   3.129
    9    HE2  MET  63           HE3      MET  63 -16.816   6.258   3.890

  No H/Q in entry =           9
  In of MODEL   52
    1    H    LEU  64           H        LEU  64 -23.765   3.386   6.282
    2    HA   LEU  64           HA       LEU  64 -24.973   4.830   4.220
    3    HB2  LEU  64           HB2      LEU  64 -25.857   2.728   5.129
    4    HB3  LEU  64           HB3      LEU  64 -26.297   3.564   6.618
    5    HG   LEU  64           HG       LEU  64 -27.986   4.845   5.408
    6   HD13  LEU  64          HD11      LEU  64 -27.714   5.098   3.176
    7   HD12  LEU  64          HD12      LEU  64 -28.378   3.471   3.023
    8   HD11  LEU  64          HD13      LEU  64 -26.631   3.711   3.073
    9   HD23  LEU  64          HD21      LEU  64 -28.539   2.044   4.644
   10   HD22  LEU  64          HD22      LEU  64 -29.509   3.182   5.579
   11   HD21  LEU  64          HD23      LEU  64 -28.138   2.368   6.331

  No H/Q in entry =          11
  In of MODEL   52
    1    HA   PRO  65           HA       PRO  65 -27.102   7.989   7.007
    2    HB2  PRO  65           HB2      PRO  65 -25.086   8.110   9.249
    3    HB3  PRO  65           HB3      PRO  65 -26.821   8.410   9.308
    4    HG2  PRO  65           HG2      PRO  65 -25.912   6.139  10.214
    5    HG3  PRO  65           HG3      PRO  65 -27.338   6.129   9.177
    6    HD2  PRO  65           HD2      PRO  65 -24.477   5.487   8.452
    7    HD3  PRO  65           HD3      PRO  65 -25.947   4.620   8.007

  No H/Q in entry =           7
  In of MODEL   52
    1    H    GLU  66           H        GLU  66 -23.546   7.892   7.057
    2    HA   GLU  66           HA       GLU  66 -23.219  10.690   6.669
    3    HB2  GLU  66           HB2      GLU  66 -21.437   8.366   5.991
    4    HB3  GLU  66           HB3      GLU  66 -20.969  10.055   5.792
    5    HG2  GLU  66           HG2      GLU  66 -21.161  10.412   8.164
    6    HG3  GLU  66           HG3      GLU  66 -21.705   8.748   8.387

  No H/Q in entry =           6
  In of MODEL   52
    1    H    ILE  67           H        ILE  67 -23.367   7.961   4.399
    2    HA   ILE  67           HA       ILE  67 -22.944   9.680   2.115
    3    HB   ILE  67           HB       ILE  67 -23.877   6.783   2.281
    4   HG12  ILE  67          HG12      ILE  67 -21.238   7.927   1.350
    5   HG13  ILE  67          HG13      ILE  67 -21.528   7.500   3.035
    6   HG21  ILE  67          HG21      ILE  67 -23.811   8.676   0.068
    7   HG23  ILE  67          HG22      ILE  67 -24.455   7.035   0.112
    8   HG22  ILE  67          HG23      ILE  67 -22.746   7.301  -0.225
    9   HD12  ILE  67          HD11      ILE  67 -21.144   5.739   0.671
   10   HD11  ILE  67          HD12      ILE  67 -22.158   5.170   1.997
   11   HD13  ILE  67          HD13      ILE  67 -20.478   5.612   2.299

  No H/Q in entry =          11
  In of MODEL   52
    1    H    GLN  68           H        GLN  68 -25.817   8.651   3.759
    2    HA   GLN  68           HA       GLN  68 -27.647   9.619   1.804
    3    HB2  GLN  68           HB2      GLN  68 -27.888   9.244   4.786
    4    HB3  GLN  68           HB3      GLN  68 -29.206   9.863   3.805
    5    HG2  GLN  68           HG2      GLN  68 -29.269   7.843   2.515
    6    HG3  GLN  68           HG3      GLN  68 -27.822   7.242   3.305
    7   HE21  GLN  68          HE21      GLN  68 -30.020   5.913   3.173
    8   HE22  GLN  68          HE22      GLN  68 -30.846   5.459   4.591

  No H/Q in entry =           8
  In of MODEL   52
    1    H    ARG  69           H        ARG  69 -26.001  11.245   4.543
    2    HA   ARG  69           HA       ARG  69 -27.333  13.748   4.162
    3    HB2  ARG  69           HB2      ARG  69 -24.992  12.774   5.730
    4    HB3  ARG  69           HB3      ARG  69 -25.049  14.498   5.383
    5    HG2  ARG  69           HG2      ARG  69 -27.358  14.566   6.370
    6    HG3  ARG  69           HG3      ARG  69 -27.171  12.870   6.830
    7    HD2  ARG  69           HD2      ARG  69 -25.439  15.195   7.750
    8    HD3  ARG  69           HD3      ARG  69 -26.575  14.297   8.745
    9    HE   ARG  69           HE       ARG  69 -23.982  13.336   7.773
   10   HH21  ARG  69          HH11      ARG  69 -23.192  11.553   8.950
   11   HH22  ARG  69          HH12      ARG  69 -24.225  10.744  10.080
   12   HH11  ARG  69          HH21      ARG  69 -26.936  12.819   9.486
   13   HH12  ARG  69          HH22      ARG  69 -26.345  11.458  10.381

  No H/Q in entry =          13
  In of MODEL   52
    1    H    LEU  70           H        LEU  70 -24.492  12.311   2.774
    2    HA   LEU  70           HA       LEU  70 -23.352  14.667   1.615
    3    HB2  LEU  70           HB2      LEU  70 -22.387  12.331   2.187
    4    HB3  LEU  70           HB3      LEU  70 -23.019  11.885   0.602
    5    HG   LEU  70           HG       LEU  70 -21.413  13.242  -0.484
    6   HD11  LEU  70          HD11      LEU  70 -20.560  14.054   2.304
    7   HD13  LEU  70          HD12      LEU  70 -21.248  15.107   1.068
    8   HD12  LEU  70          HD13      LEU  70 -19.649  14.404   0.833
    9   HD22  LEU  70          HD21      LEU  70 -20.004  11.503  -0.273
   10   HD21  LEU  70          HD22      LEU  70 -20.929  10.984   1.136
   11   HD23  LEU  70          HD23      LEU  70 -19.526  12.034   1.340

  No H/Q in entry =          11
  In of MODEL   52
    1    H    LEU  71           H        LEU  71 -25.550  12.165   0.496
    2    HA   LEU  71           HA       LEU  71 -26.069  13.679  -2.006
    3    HB2  LEU  71           HB2      LEU  71 -26.318  10.694  -1.580
    4    HB3  LEU  71           HB3      LEU  71 -26.444  11.568  -3.106
    5    HG   LEU  71           HG       LEU  71 -23.913  11.529  -1.461
    6   HD12  LEU  71          HD11      LEU  71 -24.008   9.920  -3.905
    7   HD11  LEU  71          HD12      LEU  71 -25.019   9.302  -2.600
    8   HD13  LEU  71          HD13      LEU  71 -23.294   9.553  -2.334
    9   HD22  LEU  71          HD21      LEU  71 -23.997  13.357  -2.941
   10   HD21  LEU  71          HD22      LEU  71 -24.519  12.332  -4.278
   11   HD23  LEU  71          HD23      LEU  71 -22.896  12.155  -3.612

  No H/Q in entry =          11
  In of MODEL   52
    1    HA   PRO  72           HA       PRO  72 -29.925  13.274   0.638
    2    HB2  PRO  72           HB2      PRO  72 -30.739  15.850   0.581
    3    HB3  PRO  72           HB3      PRO  72 -29.430  15.368   1.659
    4    HG2  PRO  72           HG2      PRO  72 -29.243  16.579  -1.087
    5    HG3  PRO  72           HG3      PRO  72 -28.457  17.107   0.401
    6    HD2  PRO  72           HD2      PRO  72 -27.158  15.538  -1.385
    7    HD3  PRO  72           HD3      PRO  72 -26.894  15.355   0.348

  No H/Q in entry =           7
  In of MODEL   52
    1    H    ASN  73           H        ASN  73 -29.307  14.242  -2.574
    2    HA   ASN  73           HA       ASN  73 -32.175  13.988  -3.189
    3    HB2  ASN  73           HB2      ASN  73 -31.704  15.100  -5.282
    4    HB3  ASN  73           HB3      ASN  73 -31.155  16.061  -3.917
    5   HD21  ASN  73          HD21      ASN  73 -30.377  16.111  -6.600
    6   HD22  ASN  73          HD22      ASN  73 -28.714  15.922  -6.804

  No H/Q in entry =           6
  In of MODEL   52
    1    H    LYS  74           H        LYS  74 -30.233  11.694  -2.793
    2    HA   LYS  74           HA       LYS  74 -30.843  10.327  -5.347
    3    HB2  LYS  74           HB2      LYS  74 -28.305   9.978  -3.746
    4    HB3  LYS  74           HB3      LYS  74 -28.713   9.184  -5.267
    5    HG2  LYS  74           HG2      LYS  74 -28.393  12.147  -5.046
    6    HG3  LYS  74           HG3      LYS  74 -27.041  11.061  -5.366
    7    HD2  LYS  74           HD2      LYS  74 -28.188  10.168  -7.308
    8    HD3  LYS  74           HD3      LYS  74 -29.586  11.189  -6.972
    9    HE2  LYS  74           HE2      LYS  74 -28.326  13.175  -7.409
   10    HE3  LYS  74           HE3      LYS  74 -26.823  12.258  -7.517
   11    HZ2  LYS  74           HZ1      LYS  74 -28.296  12.902  -9.627
   12    HZ1  LYS  74           HZ2      LYS  74 -28.977  11.390  -9.261
   13    HZ3  LYS  74           HZ3      LYS  74 -27.311  11.521  -9.568

  No H/Q in entry =          13
  In of MODEL   52
    1    HA   PRO  75           HA       PRO  75 -32.273   7.348  -2.388
    2    HB2  PRO  75           HB2      PRO  75 -32.635   5.148  -3.983
    3    HB3  PRO  75           HB3      PRO  75 -33.737   6.524  -4.036
    4    HG2  PRO  75           HG2      PRO  75 -31.422   5.895  -5.827
    5    HG3  PRO  75           HG3      PRO  75 -33.064   6.366  -6.260
    6    HD2  PRO  75           HD2      PRO  75 -31.087   8.194  -6.216
    7    HD3  PRO  75           HD3      PRO  75 -32.708   8.621  -5.664

  No H/Q in entry =           7
  In of MODEL   52
    1    H    VAL  76           H        VAL  76 -30.832   6.256  -1.031
    2    HA   VAL  76           HA       VAL  76 -28.398   5.007  -2.164
    3    HB   VAL  76           HB       VAL  76 -28.640   6.460   0.505
    4   HG11  VAL  76          HG11      VAL  76 -26.318   5.138  -0.910
    5   HG13  VAL  76          HG12      VAL  76 -27.013   4.690   0.649
    6   HG12  VAL  76          HG13      VAL  76 -26.139   6.212   0.479
    7   HG22  VAL  76          HG21      VAL  76 -27.942   8.354  -0.373
    8   HG21  VAL  76          HG22      VAL  76 -28.507   7.679  -1.902
    9   HG23  VAL  76          HG23      VAL  76 -26.805   7.555  -1.459

  No H/Q in entry =           9
  In of MODEL   52
    1    H    GLU  77           H        GLU  77 -28.219   2.845  -1.566
    2    HA   GLU  77           HA       GLU  77 -29.003   2.055   1.087
    3    HB2  GLU  77           HB2      GLU  77 -30.645   0.442   0.556
    4    HB3  GLU  77           HB3      GLU  77 -31.169   1.980  -0.132
    5    HG2  GLU  77           HG2      GLU  77 -30.589   1.226  -2.328
    6    HG3  GLU  77           HG3      GLU  77 -29.972  -0.287  -1.670

  No H/Q in entry =           6
  In of MODEL   52
    1    H    VAL  78           H        VAL  78 -28.711  -0.042   1.731
    2    HA   VAL  78           HA       VAL  78 -26.066  -0.859   0.820
    3    HB   VAL  78           HB       VAL  78 -27.776  -1.726   3.191
    4   HG11  VAL  78          HG11      VAL  78 -25.468  -2.991   2.043
    5   HG13  VAL  78          HG12      VAL  78 -26.375  -3.454   3.483
    6   HG12  VAL  78          HG13      VAL  78 -25.032  -2.319   3.614
    7   HG22  VAL  78          HG21      VAL  78 -26.283  -0.400   4.529
    8   HG21  VAL  78          HG22      VAL  78 -27.009   0.592   3.264
    9   HG23  VAL  78          HG23      VAL  78 -25.344   0.034   3.101

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ILE  79           H        ILE  79 -25.572  -2.770  -0.101
    2    HA   ILE  79           HA       ILE  79 -27.668  -4.199  -1.445
    3    HB   ILE  79           HB       ILE  79 -24.687  -4.784  -1.247
    4   HG12  ILE  79          HG12      ILE  79 -26.317  -3.635  -3.517
    5   HG13  ILE  79          HG13      ILE  79 -25.417  -2.649  -2.363
    6   HG22  ILE  79          HG21      ILE  79 -25.825  -5.928  -3.566
    7   HG21  ILE  79          HG22      ILE  79 -26.812  -6.439  -2.196
    8   HG23  ILE  79          HG23      ILE  79 -25.076  -6.751  -2.198
    9   HD13  ILE  79          HD11      ILE  79 -24.017  -2.777  -4.192
   10   HD12  ILE  79          HD12      ILE  79 -24.390  -4.476  -4.481
   11   HD11  ILE  79          HD13      ILE  79 -23.388  -4.016  -3.104

  No H/Q in entry =          11
  In of MODEL   52
    1    H    ASP  80           H        ASP  80 -28.565  -6.110  -0.869
    2    HA   ASP  80           HA       ASP  80 -28.512  -7.028   1.771
    3    HB2  ASP  80           HB2      ASP  80 -30.287  -7.561   0.140
    4    HB3  ASP  80           HB3      ASP  80 -29.154  -8.584  -0.744

  No H/Q in entry =           4
  In of MODEL   52
    1    H    SER  81           H        SER  81 -26.992  -8.199   2.885
    2    HA   SER  81           HA       SER  81 -24.516  -8.921   1.673
    3    HB2  SER  81           HB2      SER  81 -23.971  -9.974   3.832
    4    HB3  SER  81           HB3      SER  81 -24.639  -8.358   4.060
    5    HG   SER  81           HG       SER  81 -25.551 -10.744   4.915

  No H/Q in entry =           5
  In of MODEL   52
    1    H    LEU  82           H        LEU  82 -27.263 -10.963   1.998
    2    HA   LEU  82           HA       LEU  82 -25.764 -13.357   1.453
    3    HB2  LEU  82           HB2      LEU  82 -28.690 -12.686   1.217
    4    HB3  LEU  82           HB3      LEU  82 -28.016 -14.300   0.999
    5    HG   LEU  82           HG       LEU  82 -27.926 -12.726   3.555
    6   HD13  LEU  82          HD11      LEU  82 -29.645 -14.263   4.326
    7   HD12  LEU  82          HD12      LEU  82 -29.626 -15.105   2.775
    8   HD11  LEU  82          HD13      LEU  82 -30.214 -13.445   2.869
    9   HD23  LEU  82          HD21      LEU  82 -27.345 -15.123   4.340
   10   HD22  LEU  82          HD22      LEU  82 -26.092 -14.181   3.533
   11   HD21  LEU  82          HD23      LEU  82 -26.971 -15.423   2.642

  No H/Q in entry =          11
  In of MODEL   52
    1    H    LEU  83           H        LEU  83 -27.692 -11.082  -0.439
    2    HA   LEU  83           HA       LEU  83 -27.532 -12.429  -2.920
    3    HB2  LEU  83           HB2      LEU  83 -27.883  -9.518  -2.251
    4    HB3  LEU  83           HB3      LEU  83 -27.938 -10.152  -3.895
    5    HG   LEU  83           HG       LEU  83 -29.964 -10.513  -1.708
    6   HD13  LEU  83          HD11      LEU  83 -30.693  -8.645  -2.757
    7   HD12  LEU  83          HD12      LEU  83 -31.184  -9.742  -4.046
    8   HD11  LEU  83          HD13      LEU  83 -29.634  -8.905  -4.143
    9   HD23  LEU  83          HD21      LEU  83 -30.145 -11.752  -4.440
   10   HD22  LEU  83          HD22      LEU  83 -31.112 -12.092  -3.007
   11   HD21  LEU  83          HD23      LEU  83 -29.434 -12.627  -3.085

  No H/Q in entry =          11
  In of MODEL   52
    1    H    TYR  84           H        TYR  84 -25.524 -10.092  -1.242
    2    HA   TYR  84           HA       TYR  84 -23.666  -9.626  -3.381
    3    HB2  TYR  84           HB2      TYR  84 -24.156  -8.161  -1.320
    4    HB3  TYR  84           HB3      TYR  84 -23.106  -9.272  -0.443
    5    HD1  TYR  84           HD1      TYR  84 -20.761  -9.048  -0.533
    6    HD2  TYR  84           HD2      TYR  84 -23.188  -6.892  -3.306
    7    HE1  TYR  84           HE1      TYR  84 -18.765  -7.804  -1.294
    8    HE2  TYR  84           HE2      TYR  84 -21.200  -5.649  -4.084
    9    HH   TYR  84           HH       TYR  84 -18.927  -5.570  -4.004

  No H/Q in entry =           9
  In of MODEL   52
    1    H    GLY  85           H        GLY  85 -23.446 -11.650  -0.449
    2    HA3  GLY  85           HA2      GLY  85 -20.889 -12.641  -0.953
    3    HA2  GLY  85           HA3      GLY  85 -22.131 -13.468  -0.013

  No H/Q in entry =           3
  In of MODEL   52
    1    H    LYS  86           H        LYS  86 -23.996 -13.794  -2.064
    2    HA   LYS  86           HA       LYS  86 -22.997 -16.180  -3.343
    3    HB2  LYS  86           HB2      LYS  86 -25.250 -15.915  -2.341
    4    HB3  LYS  86           HB3      LYS  86 -25.624 -14.710  -3.573
    5    HG2  LYS  86           HG2      LYS  86 -25.428 -16.430  -5.286
    6    HG3  LYS  86           HG3      LYS  86 -25.117 -17.625  -4.028
    7    HD2  LYS  86           HD2      LYS  86 -27.530 -15.825  -3.975
    8    HD3  LYS  86           HD3      LYS  86 -27.542 -17.381  -4.805
    9    HE2  LYS  86           HE2      LYS  86 -26.698 -18.342  -2.574
   10    HE3  LYS  86           HE3      LYS  86 -27.236 -16.813  -1.877
   11    HZ3  LYS  86           HZ1      LYS  86 -29.160 -17.974  -1.712
   12    HZ2  LYS  86           HZ2      LYS  86 -28.807 -18.988  -3.029
   13    HZ1  LYS  86           HZ3      LYS  86 -29.368 -17.410  -3.301

  No H/Q in entry =          13
  In of MODEL   52
    1    H    VAL  87           H        VAL  87 -22.929 -12.960  -4.219
    2    HA   VAL  87           HA       VAL  87 -22.621 -11.781  -6.154
    3    HB   VAL  87           HB       VAL  87 -21.607 -14.310  -7.490
    4   HG13  VAL  87          HG11      VAL  87 -20.259 -12.836  -8.744
    5   HG12  VAL  87          HG12      VAL  87 -20.418 -11.540  -7.560
    6   HG11  VAL  87          HG13      VAL  87 -21.783 -11.964  -8.592
    7   HG21  VAL  87          HG21      VAL  87 -20.278 -12.764  -5.291
    8   HG23  VAL  87          HG22      VAL  87 -19.355 -13.678  -6.482
    9   HG22  VAL  87          HG23      VAL  87 -20.506 -14.506  -5.434

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ASP  88           H        ASP  88 -25.147 -12.378  -5.790
    2    HA   ASP  88           HA       ASP  88 -26.307 -13.559  -8.187
    3    HB2  ASP  88           HB2      ASP  88 -27.291 -13.799  -5.858
    4    HB3  ASP  88           HB3      ASP  88 -27.712 -12.089  -5.944

  No H/Q in entry =           4
  In of MODEL   52
    1    H    GLY  89           H        GLY  89 -25.589 -12.305  -9.826
    2    HA3  GLY  89           HA2      GLY  89 -25.721  -9.528 -10.010
    3    HA2  GLY  89           HA3      GLY  89 -25.727 -10.642 -11.377

  No H/Q in entry =           3
  In of MODEL   52
    1    H    LEU  90           H        LEU  90 -28.195 -11.951 -10.918
    2    HA   LEU  90           HA       LEU  90 -29.977  -9.976 -12.009
    3    HB2  LEU  90           HB2      LEU  90 -30.090 -12.367 -12.603
    4    HB3  LEU  90           HB3      LEU  90 -30.591 -12.733 -10.952
    5    HG   LEU  90           HG       LEU  90 -32.692 -11.576 -11.294
    6   HD13  LEU  90          HD11      LEU  90 -32.491  -9.830 -12.760
    7   HD12  LEU  90          HD12      LEU  90 -33.060 -11.050 -13.901
    8   HD11  LEU  90          HD13      LEU  90 -31.339 -10.688 -13.786
    9   HD23  LEU  90          HD21      LEU  90 -32.669 -13.192 -13.738
   10   HD22  LEU  90          HD22      LEU  90 -33.641 -13.348 -12.275
   11   HD21  LEU  90          HD23      LEU  90 -31.999 -13.990 -12.315

  No H/Q in entry =          11
  In of MODEL   52
    1    H    GLY  91           H        GLY  91 -29.814 -11.498  -8.835
    2    HA3  GLY  91           HA2      GLY  91 -32.125 -10.349  -7.772
    3    HA2  GLY  91           HA3      GLY  91 -30.737 -10.913  -6.843

  No H/Q in entry =           3
  In of MODEL   52
    1    H    VAL  92           H        VAL  92 -28.791  -9.117  -7.703
    2    HA   VAL  92           HA       VAL  92 -29.529  -6.810  -6.135
    3    HB   VAL  92           HB       VAL  92 -27.003  -7.317  -7.752
    4   HG12  VAL  92          HG11      VAL  92 -27.118  -5.442  -5.414
    5   HG11  VAL  92          HG12      VAL  92 -27.784  -4.877  -6.948
    6   HG13  VAL  92          HG13      VAL  92 -26.096  -5.377  -6.851
    7   HG22  VAL  92          HG21      VAL  92 -26.798  -8.917  -6.170
    8   HG21  VAL  92          HG22      VAL  92 -27.921  -8.122  -5.064
    9   HG23  VAL  92          HG23      VAL  92 -26.258  -7.551  -5.194

  No H/Q in entry =           9
  In of MODEL   52
    1    H    LEU  93           H        LEU  93 -29.159  -7.460  -9.562
    2    HA   LEU  93           HA       LEU  93 -29.464  -4.813 -10.475
    3    HB2  LEU  93           HB2      LEU  93 -28.866  -6.671 -11.950
    4    HB3  LEU  93           HB3      LEU  93 -30.468  -7.371 -11.720
    5    HG   LEU  93           HG       LEU  93 -31.452  -5.384 -12.826
    6   HD11  LEU  93          HD11      LEU  93 -29.569  -3.825 -12.328
    7   HD13  LEU  93          HD12      LEU  93 -30.022  -3.838 -14.033
    8   HD12  LEU  93          HD13      LEU  93 -28.581  -4.701 -13.497
    9   HD23  LEU  93          HD21      LEU  93 -30.441  -5.956 -15.125
   10   HD22  LEU  93          HD22      LEU  93 -31.299  -7.203 -14.219
   11   HD21  LEU  93          HD23      LEU  93 -29.534  -7.180 -14.234

  No H/Q in entry =          11
  In of MODEL   52
    1    H    LYS  94           H        LYS  94 -31.878  -7.321  -9.622
    2    HA   LYS  94           HA       LYS  94 -34.201  -5.834 -10.221
    3    HB2  LYS  94           HB2      LYS  94 -33.711  -8.039  -8.225
    4    HB3  LYS  94           HB3      LYS  94 -35.298  -7.314  -8.478
    5    HG2  LYS  94           HG2      LYS  94 -35.242  -8.076 -10.817
    6    HG3  LYS  94           HG3      LYS  94 -33.693  -8.858 -10.504
    7    HD2  LYS  94           HD2      LYS  94 -34.824 -10.182  -8.678
    8    HD3  LYS  94           HD3      LYS  94 -36.359  -9.504  -9.218
    9    HE2  LYS  94           HE2      LYS  94 -35.877 -10.428 -11.494
   10    HE3  LYS  94           HE3      LYS  94 -34.471 -11.241 -10.805
   11    HZ3  LYS  94           HZ1      LYS  94 -36.349 -12.729 -10.969
   12    HZ2  LYS  94           HZ2      LYS  94 -37.298 -11.690 -10.016
   13    HZ1  LYS  94           HZ3      LYS  94 -35.947 -12.466  -9.342

  No H/Q in entry =          13
  In of MODEL   52
    1    H    ALA  95           H        ALA  95 -32.357  -6.005  -7.187
    2    HA   ALA  95           HA       ALA  95 -34.166  -4.400  -5.685
    3    HB2  ALA  95           HB1      ALA  95 -31.812  -5.820  -5.173
    4    HB3  ALA  95           HB2      ALA  95 -32.766  -4.905  -4.007
    5    HB1  ALA  95           HB3      ALA  95 -31.410  -4.137  -4.834

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ALA  96           H        ALA  96 -31.525  -3.582  -7.797
    2    HA   ALA  96           HA       ALA  96 -31.372  -0.827  -7.008
    3    HB2  ALA  96           HB1      ALA  96 -30.022  -0.614  -9.127
    4    HB3  ALA  96           HB2      ALA  96 -30.360  -2.313  -9.453
    5    HB1  ALA  96           HB3      ALA  96 -29.426  -1.858  -8.028

  No H/Q in entry =           5
  In of MODEL   52
    1    H    VAL  97           H        VAL  97 -32.956  -2.498  -9.693
    2    HA   VAL  97           HA       VAL  97 -33.991  -0.171 -10.927
    3    HB   VAL  97           HB       VAL  97 -34.857  -3.081 -10.980
    4   HG11  VAL  97          HG11      VAL  97 -36.613  -1.038 -11.441
    5   HG13  VAL  97          HG12      VAL  97 -36.708  -2.625 -12.207
    6   HG12  VAL  97          HG13      VAL  97 -35.936  -1.285 -13.051
    7   HG21  VAL  97          HG21      VAL  97 -33.558  -1.266 -13.015
    8   HG23  VAL  97          HG22      VAL  97 -34.045  -2.935 -13.310
    9   HG22  VAL  97          HG23      VAL  97 -32.781  -2.578 -12.132

  No H/Q in entry =           9
  In of MODEL   52
    1    H    ALA  98           H        ALA  98 -35.197  -2.342  -8.395
    2    HA   ALA  98           HA       ALA  98 -37.732  -1.146  -8.018
    3    HB1  ALA  98           HB1      ALA  98 -36.755  -3.371  -7.005
    4    HB3  ALA  98           HB2      ALA  98 -37.910  -2.429  -6.060
    5    HB2  ALA  98           HB3      ALA  98 -36.183  -2.316  -5.713

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ALA  99           H        ALA  99 -34.626  -0.419  -6.389
    2    HA   ALA  99           HA       ALA  99 -35.703   1.577  -4.707
    3    HB1  ALA  99           HB1      ALA  99 -33.079   0.640  -5.480
    4    HB2  ALA  99           HB2      ALA  99 -33.602   1.392  -3.972
    5    HB3  ALA  99           HB3      ALA  99 -33.117   2.397  -5.336

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ILE 100           H        ILE 100 -34.685   1.709  -8.070
    2    HA   ILE 100           HA       ILE 100 -34.807   4.561  -8.270
    3    HB   ILE 100           HB       ILE 100 -34.964   2.422 -10.420
    4   HG12  ILE 100          HG12      ILE 100 -32.753   4.366  -9.754
    5   HG13  ILE 100          HG13      ILE 100 -32.819   2.716  -9.133
    6   HG21  ILE 100          HG21      ILE 100 -35.326   5.352 -10.529
    7   HG23  ILE 100          HG22      ILE 100 -35.867   4.100 -11.650
    8   HG22  ILE 100          HG23      ILE 100 -34.203   4.682 -11.713
    9   HD12  ILE 100          HD11      ILE 100 -32.288   3.680 -11.906
   10   HD11  ILE 100          HD12      ILE 100 -32.980   2.077 -11.656
   11   HD13  ILE 100          HD13      ILE 100 -31.419   2.483 -10.945

  No H/Q in entry =          11
  In of MODEL   52
    1    H    LYS 101           H        LYS 101 -37.160   2.005  -8.995
    2    HA   LYS 101           HA       LYS 101 -39.214   3.704  -9.967
    3    HB2  LYS 101           HB2      LYS 101 -39.148   0.920  -8.859
    4    HB3  LYS 101           HB3      LYS 101 -40.686   1.716  -9.188
    5    HG2  LYS 101           HG2      LYS 101 -40.226   1.857 -11.487
    6    HG3  LYS 101           HG3      LYS 101 -38.537   1.414 -11.249
    7    HD2  LYS 101           HD2      LYS 101 -39.833  -0.462 -12.138
    8    HD3  LYS 101           HD3      LYS 101 -39.201  -0.816 -10.529
    9    HE2  LYS 101           HE2      LYS 101 -41.274  -1.471 -10.012
   10    HE3  LYS 101           HE3      LYS 101 -41.695   0.243 -10.001
   11    HZ3  LYS 101           HZ1      LYS 101 -42.605   0.118 -12.112
   12    HZ2  LYS 101           HZ2      LYS 101 -43.092  -1.350 -11.411
   13    HZ1  LYS 101           HZ3      LYS 101 -41.793  -1.322 -12.504

  No H/Q in entry =          13
  In of MODEL   52
    1    H    LYS 102           H        LYS 102 -38.730   2.194  -6.772
    2    HA   LYS 102           HA       LYS 102 -40.942   3.428  -5.550
    3    HB2  LYS 102           HB2      LYS 102 -39.738   1.529  -4.556
    4    HB3  LYS 102           HB3      LYS 102 -38.323   2.553  -4.316
    5    HG2  LYS 102           HG2      LYS 102 -39.600   3.965  -2.800
    6    HG3  LYS 102           HG3      LYS 102 -41.017   2.945  -3.042
    7    HD2  LYS 102           HD2      LYS 102 -39.823   1.046  -2.039
    8    HD3  LYS 102           HD3      LYS 102 -38.406   2.068  -1.794
    9    HE2  LYS 102           HE2      LYS 102 -39.718   3.564  -0.365
   10    HE3  LYS 102           HE3      LYS 102 -41.153   2.574  -0.630
   11    HZ1  LYS 102           HZ1      LYS 102 -39.462   0.777   0.348
   12    HZ3  LYS 102           HZ2      LYS 102 -40.546   1.678   1.292
   13    HZ2  LYS 102           HZ3      LYS 102 -38.927   2.170   1.157

  No H/Q in entry =          13
  In of MODEL   52
    1    H    ALA 103           H        ALA 103 -37.967   4.765  -6.575
    2    HA   ALA 103           HA       ALA 103 -38.128   7.070  -4.775
    3    HB2  ALA 103           HB1      ALA 103 -36.134   7.774  -6.360
    4    HB3  ALA 103           HB2      ALA 103 -36.136   6.059  -6.770
    5    HB1  ALA 103           HB3      ALA 103 -35.887   6.566  -5.100

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ALA 104           H        ALA 104 -38.788   6.376  -8.121
    2    HA   ALA 104           HA       ALA 104 -39.320   9.178  -8.720
    3    HB2  ALA 104           HB1      ALA 104 -39.392   8.526 -10.927
    4    HB1  ALA 104           HB2      ALA 104 -40.150   6.977 -10.555
    5    HB3  ALA 104           HB3      ALA 104 -38.420   7.203 -10.286

  No H/Q in entry =           5
  In of MODEL   52
    1    H    ALA 105           H        ALA 105 -40.959   7.094  -6.919
    2    HA   ALA 105           HA       ALA 105 -43.354   8.537  -6.864
    3    HB2  ALA 105           HB1      ALA 105 -44.130   7.708  -8.904
    4    HB3  ALA 105           HB2      ALA 105 -44.783   6.525  -7.771
    5    HB1  ALA 105           HB3      ALA 105 -43.328   6.152  -8.693

  No H/Q in entry =           5
  In of MODEL   53
    1    H1   ALA   1           H3       ALA   1 -12.336 -15.518  -2.431
    2    H2   ALA   1           H2       ALA   1 -11.402 -16.670  -3.267
    3    H3   ALA   1           H1       ALA   1 -12.532 -15.715  -4.106
    4    HA   ALA   1           HA       ALA   1 -13.949 -17.401  -3.872
    5    HB3  ALA   1           HB1      ALA   1 -12.573 -19.186  -3.403
    6    HB1  ALA   1           HB2      ALA   1 -13.335 -19.065  -1.817
    7    HB2  ALA   1           HB3      ALA   1 -11.751 -18.341  -2.091

  No H/Q in entry =           7
  In of MODEL   53
    1    H    GLU   2           H        GLU   2 -15.588 -18.238  -2.225
    2    HA   GLU   2           HA       GLU   2 -17.224 -16.501  -1.175
    3    HB2  GLU   2           HB2      GLU   2 -16.316 -18.935   0.375
    4    HB3  GLU   2           HB3      GLU   2 -17.833 -18.069   0.622
    5    HG2  GLU   2           HG2      GLU   2 -18.815 -19.147  -1.117
    6    HG3  GLU   2           HG3      GLU   2 -17.483 -18.760  -2.195

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLU   3           H        GLU   3 -15.338 -17.872   1.458
    2    HA   GLU   3           HA       GLU   3 -15.543 -15.515   3.013
    3    HB2  GLU   3           HB2      GLU   3 -13.984 -18.078   3.272
    4    HB3  GLU   3           HB3      GLU   3 -13.745 -16.760   4.420
    5    HG2  GLU   3           HG2      GLU   3 -15.944 -16.889   5.227
    6    HG3  GLU   3           HG3      GLU   3 -16.540 -17.683   3.776

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LEU   4           H        LEU   4 -12.596 -17.024   1.637
    2    HA   LEU   4           HA       LEU   4 -10.746 -15.139   2.243
    3    HB2  LEU   4           HB2      LEU   4 -10.977 -16.436  -0.482
    4    HB3  LEU   4           HB3      LEU   4  -9.521 -15.730   0.209
    5    HG   LEU   4           HG       LEU   4 -11.044 -18.111   1.316
    6   HD13  LEU   4          HD11      LEU   4  -9.421 -19.484   0.395
    7   HD12  LEU   4          HD12      LEU   4  -8.198 -18.213   0.374
    8   HD11  LEU   4          HD13      LEU   4  -9.481 -18.223  -0.835
    9   HD23  LEU   4          HD21      LEU   4  -8.801 -18.197   2.709
   10   HD22  LEU   4          HD22      LEU   4 -10.113 -17.144   3.231
   11   HD21  LEU   4          HD23      LEU   4  -8.740 -16.469   2.355

  No H/Q in entry =          11
  In of MODEL   53
    1    H    GLU   5           H        GLU   5 -13.065 -14.910  -0.443
    2    HA   GLU   5           HA       GLU   5 -12.032 -12.438  -1.440
    3    HB2  GLU   5           HB2      GLU   5 -13.382 -14.003  -2.814
    4    HB3  GLU   5           HB3      GLU   5 -14.784 -13.643  -1.805
    5    HG2  GLU   5           HG2      GLU   5 -14.649 -11.272  -2.433
    6    HG3  GLU   5           HG3      GLU   5 -13.223 -11.604  -3.416

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLU   6           H        GLU   6 -14.776 -13.287   0.639
    2    HA   GLU   6           HA       GLU   6 -15.655 -10.601   1.033
    3    HB2  GLU   6           HB2      GLU   6 -17.111 -12.565   1.427
    4    HB3  GLU   6           HB3      GLU   6 -16.085 -13.041   2.777
    5    HG2  GLU   6           HG2      GLU   6 -16.579 -10.930   3.926
    6    HG3  GLU   6           HG3      GLU   6 -17.567 -10.405   2.565

  No H/Q in entry =           6
  In of MODEL   53
    1    H    VAL   7           H        VAL   7 -13.378 -12.734   2.617
    2    HA   VAL   7           HA       VAL   7 -12.907 -11.163   4.946
    3    HB   VAL   7           HB       VAL   7 -11.217 -13.224   3.506
    4   HG11  VAL   7          HG11      VAL   7 -10.746 -11.695   6.071
    5   HG13  VAL   7          HG12      VAL   7  -9.641 -11.921   4.716
    6   HG12  VAL   7          HG13      VAL   7 -10.014 -13.274   5.785
    7   HG21  VAL   7          HG21      VAL   7 -13.479 -13.765   4.715
    8   HG23  VAL   7          HG22      VAL   7 -12.557 -13.499   6.195
    9   HG22  VAL   7          HG23      VAL   7 -12.071 -14.765   5.068

  No H/Q in entry =           9
  In of MODEL   53
    1    H    VAL   8           H        VAL   8 -11.380 -11.295   1.743
    2    HA   VAL   8           HA       VAL   8  -9.301  -9.443   2.245
    3    HB   VAL   8           HB       VAL   8 -10.758 -10.118  -0.321
    4   HG11  VAL   8          HG11      VAL   8  -8.440  -8.297   0.282
    5   HG13  VAL   8          HG12      VAL   8  -9.797  -8.043  -0.816
    6   HG12  VAL   8          HG13      VAL   8  -8.503  -9.155  -1.259
    7   HG22  VAL   8          HG21      VAL   8  -9.246 -11.844  -0.573
    8   HG21  VAL   8          HG22      VAL   8  -9.106 -11.716   1.178
    9   HG23  VAL   8          HG23      VAL   8  -7.924 -10.920   0.144

  No H/Q in entry =           9
  In of MODEL   53
    1    H    MET   9           H        MET   9 -12.636  -9.019   1.068
    2    HA   MET   9           HA       MET   9 -12.542  -6.244   0.632
    3    HB2  MET   9           HB2      MET   9 -14.784  -8.087   1.463
    4    HB3  MET   9           HB3      MET   9 -15.039  -6.358   1.219
    5    HG2  MET   9           HG2      MET   9 -14.182  -6.548  -1.083
    6    HG3  MET   9           HG3      MET   9 -13.906  -8.273  -0.842
    7    HE1  MET   9           HE1      MET   9 -16.153  -5.426  -0.519
    8    HE3  MET   9           HE2      MET   9 -17.813  -5.983  -0.716
    9    HE2  MET   9           HE3      MET   9 -16.802  -5.729  -2.137

  No H/Q in entry =           9
  In of MODEL   53
    1    H    GLY  10           H        GLY  10 -13.239  -8.126   3.557
    2    HA3  GLY  10           HA2      GLY  10 -13.774  -5.935   5.272
    3    HA2  GLY  10           HA3      GLY  10 -13.228  -7.529   5.790

  No H/Q in entry =           3
  In of MODEL   53
    1    H    LEU  11           H        LEU  11 -10.778  -7.679   4.487
    2    HA   LEU  11           HA       LEU  11  -9.072  -6.261   6.252
    3    HB2  LEU  11           HB2      LEU  11  -8.526  -7.692   3.648
    4    HB3  LEU  11           HB3      LEU  11  -7.254  -6.999   4.653
    5    HG   LEU  11           HG       LEU  11  -9.281  -9.012   5.660
    6   HD13  LEU  11          HD11      LEU  11  -8.064 -10.261   4.103
    7   HD12  LEU  11          HD12      LEU  11  -7.139 -10.508   5.583
    8   HD11  LEU  11          HD13      LEU  11  -6.580  -9.349   4.377
    9   HD22  LEU  11          HD21      LEU  11  -8.428  -8.006   7.581
   10   HD21  LEU  11          HD22      LEU  11  -6.882  -7.620   6.826
   11   HD23  LEU  11          HD23      LEU  11  -7.227  -9.272   7.334

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  12           H        ILE  12  -9.951  -5.707   2.857
    2    HA   ILE  12           HA       ILE  12  -8.236  -3.494   2.438
    3    HB   ILE  12           HB       ILE  12 -10.889  -4.142   1.129
    4   HG12  ILE  12          HG12      ILE  12  -8.865  -5.810   1.064
    5   HG13  ILE  12          HG13      ILE  12  -9.715  -5.445  -0.423
    6   HG21  ILE  12          HG21      ILE  12  -8.647  -2.262   0.323
    7   HG23  ILE  12          HG22      ILE  12 -10.316  -1.826   0.671
    8   HG22  ILE  12          HG23      ILE  12  -9.926  -2.773  -0.735
    9   HD11  ILE  12          HD11      ILE  12  -7.189  -4.046   0.497
   10   HD13  ILE  12          HD12      ILE  12  -7.978  -3.889  -1.070
   11   HD12  ILE  12          HD13      ILE  12  -7.213  -5.396  -0.622

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  13           H        ILE  13 -11.605  -3.729   3.514
    2    HA   ILE  13           HA       ILE  13 -12.040  -0.938   3.779
    3    HB   ILE  13           HB       ILE  13 -13.275  -3.353   5.120
    4   HG12  ILE  13          HG12      ILE  13 -13.495  -2.767   2.592
    5   HG13  ILE  13          HG13      ILE  13 -14.925  -3.223   3.491
    6   HG22  ILE  13          HG21      ILE  13 -15.137  -1.745   5.760
    7   HG21  ILE  13          HG22      ILE  13 -14.034  -0.426   5.392
    8   HG23  ILE  13          HG23      ILE  13 -13.647  -1.563   6.681
    9   HD11  ILE  13          HD11      ILE  13 -14.122  -0.330   3.189
   10   HD13  ILE  13          HD12      ILE  13 -15.670  -0.998   3.664
   11   HD12  ILE  13          HD13      ILE  13 -15.139  -1.157   2.005

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ASN  14           H        ASN  14 -10.964  -3.436   6.062
    2    HA   ASN  14           HA       ASN  14 -10.760  -1.798   8.347
    3    HB2  ASN  14           HB2      ASN  14 -10.529  -4.408   8.028
    4    HB3  ASN  14           HB3      ASN  14  -8.816  -4.036   7.880
    5   HD21  ASN  14          HD21      ASN  14  -9.477  -5.553  10.054
    6   HD22  ASN  14          HD22      ASN  14  -9.448  -4.632  11.477

  No H/Q in entry =           6
  In of MODEL   53
    1    H    SER  15           H        SER  15  -8.352  -2.644   5.869
    2    HA   SER  15           HA       SER  15  -6.202  -1.169   6.951
    3    HB2  SER  15           HB2      SER  15  -5.174  -1.390   4.796
    4    HB3  SER  15           HB3      SER  15  -6.136  -2.847   5.022
    5    HG   SER  15           HG       SER  15  -6.875  -2.221   3.130

  No H/Q in entry =           5
  In of MODEL   53
    1    H    GLY  16           H        GLY  16  -8.784  -0.283   4.689
    2    HA3  GLY  16           HA2      GLY  16  -7.902   2.351   4.140
    3    HA2  GLY  16           HA3      GLY  16  -9.556   1.769   3.970

  No H/Q in entry =           3
  In of MODEL   53
    1    H    GLN  17           H        GLN  17 -10.119   1.051   6.617
    2    HA   GLN  17           HA       GLN  17 -10.813   3.562   7.752
    3    HB2  GLN  17           HB2      GLN  17 -10.742   0.779   8.933
    4    HB3  GLN  17           HB3      GLN  17 -11.359   2.184   9.803
    5    HG2  GLN  17           HG2      GLN  17 -12.378   1.253   7.103
    6    HG3  GLN  17           HG3      GLN  17 -13.160   0.898   8.643
    7   HE21  GLN  17          HE21      GLN  17 -13.516   2.911   6.093
    8   HE22  GLN  17          HE22      GLN  17 -14.121   4.291   6.876

  No H/Q in entry =           8
  In of MODEL   53
    1    H    ALA  18           H        ALA  18  -8.205   1.261   8.388
    2    HA   ALA  18           HA       ALA  18  -7.110   2.470  10.663
    3    HB2  ALA  18           HB1      ALA  18  -6.510   0.249   9.301
    4    HB3  ALA  18           HB2      ALA  18  -5.347   1.024  10.377
    5    HB1  ALA  18           HB3      ALA  18  -5.258   1.300   8.636

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ARG  19           H        ARG  19  -6.316   2.985   7.218
    2    HA   ARG  19           HA       ARG  19  -4.406   5.019   7.655
    3    HB2  ARG  19           HB2      ARG  19  -4.730   3.879   5.459
    4    HB3  ARG  19           HB3      ARG  19  -6.265   4.730   5.273
    5    HG2  ARG  19           HG2      ARG  19  -5.121   6.894   5.346
    6    HG3  ARG  19           HG3      ARG  19  -3.580   6.098   5.659
    7    HD2  ARG  19           HD2      ARG  19  -3.688   6.687   3.314
    8    HD3  ARG  19           HD3      ARG  19  -3.786   4.928   3.461
    9    HE   ARG  19           HE       ARG  19  -6.413   5.855   3.439
   10   HH21  ARG  19          HH11      ARG  19  -7.597   6.018   1.514
   11   HH22  ARG  19          HH12      ARG  19  -6.766   6.088  -0.001
   12   HH11  ARG  19          HH21      ARG  19  -3.626   5.897   1.420
   13   HH12  ARG  19          HH22      ARG  19  -4.517   6.017  -0.055

  No H/Q in entry =          13
  In of MODEL   53
    1    H    SER  20           H        SER  20  -7.900   5.158   7.036
    2    HA   SER  20           HA       SER  20  -8.238   7.916   6.983
    3    HB2  SER  20           HB2      SER  20  -9.973   6.042   6.609
    4    HB3  SER  20           HB3      SER  20 -10.201   6.095   8.356
    5    HG   SER  20           HG       SER  20 -10.665   8.087   6.415

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LEU  21           H        LEU  21  -8.268   5.736   9.789
    2    HA   LEU  21           HA       LEU  21  -8.706   7.737  11.750
    3    HB2  LEU  21           HB2      LEU  21  -7.371   5.028  11.922
    4    HB3  LEU  21           HB3      LEU  21  -7.685   6.048  13.322
    5    HG   LEU  21           HG       LEU  21  -9.843   5.157  11.387
    6   HD11  LEU  21          HD11      LEU  21  -8.937   3.954  14.015
    7   HD13  LEU  21          HD12      LEU  21  -8.952   3.171  12.435
    8   HD12  LEU  21          HD13      LEU  21 -10.474   3.566  13.237
    9   HD23  LEU  21          HD21      LEU  21 -11.200   5.669  13.599
   10   HD22  LEU  21          HD22      LEU  21 -10.732   7.009  12.555
   11   HD21  LEU  21          HD23      LEU  21  -9.805   6.664  14.007

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ALA  22           H        ALA  22  -5.755   6.343  10.360
    2    HA   ALA  22           HA       ALA  22  -3.876   7.647  11.991
    3    HB2  ALA  22           HB1      ALA  22  -3.462   5.789  10.304
    4    HB1  ALA  22           HB2      ALA  22  -2.258   7.077  10.345
    5    HB3  ALA  22           HB3      ALA  22  -3.469   7.040   9.062

  No H/Q in entry =           5
  In of MODEL   53
    1    H    TYR  23           H        TYR  23  -5.169   8.668   8.800
    2    HA   TYR  23           HA       TYR  23  -3.817  11.156   8.735
    3    HB2  TYR  23           HB2      TYR  23  -4.892  10.250   6.738
    4    HB3  TYR  23           HB3      TYR  23  -6.474  10.365   7.510
    5    HD1  TYR  23           HD1      TYR  23  -3.556  12.395   6.375
    6    HD2  TYR  23           HD2      TYR  23  -7.705  12.380   7.484
    7    HE1  TYR  23           HE1      TYR  23  -3.766  14.746   5.613
    8    HE2  TYR  23           HE2      TYR  23  -7.917  14.732   6.721
    9    HH   TYR  23           HH       TYR  23  -5.147  16.449   5.276

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ALA  24           H        ALA  24  -6.950  10.199  10.098
    2    HA   ALA  24           HA       ALA  24  -7.776  12.795  10.861
    3    HB1  ALA  24           HB1      ALA  24  -9.604  11.555  11.320
    4    HB2  ALA  24           HB2      ALA  24  -8.790  10.980  12.773
    5    HB3  ALA  24           HB3      ALA  24  -8.662  10.066  11.271

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ALA  25           H        ALA  25  -5.798  10.326  12.449
    2    HA   ALA  25           HA       ALA  25  -5.467  11.579  14.952
    3    HB2  ALA  25           HB1      ALA  25  -4.709   9.222  14.138
    4    HB3  ALA  25           HB2      ALA  25  -3.696  10.075  15.304
    5    HB1  ALA  25           HB3      ALA  25  -3.250  10.054  13.597

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LEU  26           H        LEU  26  -3.657  11.864  11.922
    2    HA   LEU  26           HA       LEU  26  -1.692  13.673  12.847
    3    HB2  LEU  26           HB2      LEU  26  -1.386  12.517  10.746
    4    HB3  LEU  26           HB3      LEU  26  -2.851  13.234  10.082
    5    HG   LEU  26           HG       LEU  26  -1.823  15.478  10.221
    6   HD12  LEU  26          HD11      LEU  26   0.713  15.482  10.650
    7   HD11  LEU  26          HD12      LEU  26   0.475  13.904  11.395
    8   HD13  LEU  26          HD13      LEU  26  -0.327  15.325  12.065
    9   HD21  LEU  26          HD21      LEU  26  -0.085  13.411   8.839
   10   HD23  LEU  26          HD22      LEU  26  -0.115  15.132   8.466
   11   HD22  LEU  26          HD23      LEU  26  -1.543  14.143   8.171

  No H/Q in entry =          11
  In of MODEL   53
    1    H    LYS  27           H        LYS  27  -4.863  14.174  11.351
    2    HA   LYS  27           HA       LYS  27  -4.789  16.962  11.150
    3    HB2  LYS  27           HB2      LYS  27  -6.536  15.495  10.156
    4    HB3  LYS  27           HB3      LYS  27  -7.204  15.244  11.769
    5    HG2  LYS  27           HG2      LYS  27  -7.619  17.654  12.000
    6    HG3  LYS  27           HG3      LYS  27  -6.900  17.944  10.413
    7    HD2  LYS  27           HD2      LYS  27  -8.636  16.520   9.368
    8    HD3  LYS  27           HD3      LYS  27  -9.361  16.246  10.954
    9    HE2  LYS  27           HE2      LYS  27  -9.789  18.661  11.192
   10    HE3  LYS  27           HE3      LYS  27  -9.036  18.956   9.621
   11    HZ3  LYS  27           HZ1      LYS  27 -11.413  18.846   9.366
   12    HZ2  LYS  27           HZ2      LYS  27 -11.475  17.331  10.137
   13    HZ1  LYS  27           HZ3      LYS  27 -10.721  17.488   8.619

  No H/Q in entry =          13
  In of MODEL   53
    1    H    GLN  28           H        GLN  28  -5.707  14.885  13.874
    2    HA   GLN  28           HA       GLN  28  -6.599  16.897  15.643
    3    HB2  GLN  28           HB2      GLN  28  -5.218  14.257  16.197
    4    HB3  GLN  28           HB3      GLN  28  -5.959  15.267  17.438
    5    HG2  GLN  28           HG2      GLN  28  -7.417  14.161  15.021
    6    HG3  GLN  28           HG3      GLN  28  -7.484  13.463  16.639
    7   HE21  GLN  28          HE21      GLN  28  -9.350  15.269  14.682
    8   HE22  GLN  28          HE22      GLN  28 -10.092  16.293  15.814

  No H/Q in entry =           8
  In of MODEL   53
    1    H    ALA  29           H        ALA  29  -3.385  15.576  14.973
    2    HA   ALA  29           HA       ALA  29  -1.948  16.966  16.958
    3    HB1  ALA  29           HB1      ALA  29  -0.016  16.259  15.851
    4    HB3  ALA  29           HB2      ALA  29  -0.761  16.387  14.258
    5    HB2  ALA  29           HB3      ALA  29  -1.199  15.059  15.331

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LYS  30           H        LYS  30  -2.780  17.848  13.623
    2    HA   LYS  30           HA       LYS  30  -1.348  20.276  13.528
    3    HB2  LYS  30           HB2      LYS  30  -3.879  19.423  12.106
    4    HB3  LYS  30           HB3      LYS  30  -3.030  20.930  11.766
    5    HG2  LYS  30           HG2      LYS  30  -0.969  19.618  11.265
    6    HG3  LYS  30           HG3      LYS  30  -1.890  18.130  11.506
    7    HD2  LYS  30           HD2      LYS  30  -3.438  18.783   9.702
    8    HD3  LYS  30           HD3      LYS  30  -2.540  20.283   9.463
    9    HE2  LYS  30           HE2      LYS  30  -0.517  18.970   8.896
   10    HE3  LYS  30           HE3      LYS  30  -1.434  17.476   9.104
   11    HZ2  LYS  30           HZ1      LYS  30  -1.237  18.343   6.762
   12    HZ1  LYS  30           HZ2      LYS  30  -2.271  19.616   7.224
   13    HZ3  LYS  30           HZ3      LYS  30  -2.811  18.005   7.294

  No H/Q in entry =          13
  In of MODEL   53
    1    H    GLN  31           H        GLN  31  -4.464  19.455  14.924
    2    HA   GLN  31           HA       GLN  31  -5.202  22.220  15.370
    3    HB2  GLN  31           HB2      GLN  31  -6.414  19.787  16.688
    4    HB3  GLN  31           HB3      GLN  31  -7.156  21.366  16.437
    5    HG2  GLN  31           HG2      GLN  31  -6.440  20.580  13.852
    6    HG3  GLN  31           HG3      GLN  31  -6.984  19.081  14.598
    7   HE21  GLN  31          HE21      GLN  31  -8.366  20.668  12.487
    8   HE22  GLN  31          HE22      GLN  31  -9.880  21.076  13.137

  No H/Q in entry =           8
  In of MODEL   53
    1    H    GLY  32           H        GLY  32  -2.917  20.270  16.704
    2    HA3  GLY  32           HA2      GLY  32  -1.522  20.718  18.513
    3    HA2  GLY  32           HA3      GLY  32  -2.640  21.973  19.030

  No H/Q in entry =           3
  In of MODEL   53
    1    H    ASP  33           H        ASP  33  -4.092  18.949  18.363
    2    HA   ASP  33           HA       ASP  33  -4.522  18.498  21.241
    3    HB2  ASP  33           HB2      ASP  33  -5.926  17.500  18.756
    4    HB3  ASP  33           HB3      ASP  33  -6.287  16.894  20.371

  No H/Q in entry =           4
  In of MODEL   53
    1    H    PHE  34           H        PHE  34  -2.365  17.623  21.558
    2    HA   PHE  34           HA       PHE  34  -1.382  15.363  20.163
    3    HB2  PHE  34           HB2      PHE  34  -0.769  16.342  22.961
    4    HB3  PHE  34           HB3      PHE  34   0.151  15.108  22.099
    5    HD1  PHE  34           HD1      PHE  34   0.013  18.536  22.831
    6    HD2  PHE  34           HD2      PHE  34   0.830  15.822  19.602
    7    HE1  PHE  34           HE1      PHE  34   1.333  20.293  21.683
    8    HE2  PHE  34           HE2      PHE  34   2.146  17.582  18.459
    9    HZ   PHE  34           HZ       PHE  34   2.399  19.814  19.504

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ALA  35           H        ALA  35  -3.433  15.664  23.016
    2    HA   ALA  35           HA       ALA  35  -3.255  13.000  23.914
    3    HB3  ALA  35           HB1      ALA  35  -5.710  13.653  24.759
    4    HB1  ALA  35           HB2      ALA  35  -5.157  15.265  24.305
    5    HB2  ALA  35           HB3      ALA  35  -4.259  14.332  25.501

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ALA  36           H        ALA  36  -5.677  14.542  21.801
    2    HA   ALA  36           HA       ALA  36  -7.116  12.146  21.317
    3    HB1  ALA  36           HB1      ALA  36  -8.551  13.584  20.353
    4    HB3  ALA  36           HB2      ALA  36  -7.368  13.991  19.110
    5    HB2  ALA  36           HB3      ALA  36  -7.391  14.880  20.633

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ALA  37           H        ALA  37  -4.410  13.703  19.662
    2    HA   ALA  37           HA       ALA  37  -4.381  12.067  17.366
    3    HB3  ALA  37           HB1      ALA  37  -2.377  13.757  18.798
    4    HB2  ALA  37           HB2      ALA  37  -2.899  13.818  17.115
    5    HB1  ALA  37           HB3      ALA  37  -1.761  12.575  17.643

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LYS  38           H        LYS  38  -2.644  11.742  20.453
    2    HA   LYS  38           HA       LYS  38  -1.342   9.328  19.971
    3    HB2  LYS  38           HB2      LYS  38  -1.657  11.095  22.115
    4    HB3  LYS  38           HB3      LYS  38  -2.296   9.573  22.728
    5    HG2  LYS  38           HG2      LYS  38  -0.211   8.429  22.203
    6    HG3  LYS  38           HG3      LYS  38   0.417   9.867  21.392
    7    HD2  LYS  38           HD2      LYS  38   0.589  11.085  23.428
    8    HD3  LYS  38           HD3      LYS  38  -0.447   9.946  24.290
    9    HE2  LYS  38           HE2      LYS  38   1.902   9.604  24.921
   10    HE3  LYS  38           HE3      LYS  38   1.287   8.195  24.054
   11    HZ3  LYS  38           HZ1      LYS  38   2.601   8.598  22.280
   12    HZ2  LYS  38           HZ2      LYS  38   3.559   9.417  23.421
   13    HZ1  LYS  38           HZ3      LYS  38   2.494  10.288  22.424

  No H/Q in entry =          13
  In of MODEL   53
    1    H    ALA  39           H        ALA  39  -4.582   9.859  21.357
    2    HA   ALA  39           HA       ALA  39  -5.175   7.146  21.860
    3    HB3  ALA  39           HB1      ALA  39  -7.308   9.114  21.081
    4    HB2  ALA  39           HB2      ALA  39  -6.415   9.331  22.586
    5    HB1  ALA  39           HB3      ALA  39  -7.347   7.857  22.319

  No H/Q in entry =           5
  In of MODEL   53
    1    H    MET  40           H        MET  40  -5.723   9.164  19.009
    2    HA   MET  40           HA       MET  40  -7.212   7.248  17.542
    3    HB2  MET  40           HB2      MET  40  -5.572   9.625  16.645
    4    HB3  MET  40           HB3      MET  40  -6.603   8.677  15.570
    5    HG2  MET  40           HG2      MET  40  -7.637   9.938  18.122
    6    HG3  MET  40           HG3      MET  40  -7.678  10.773  16.571
    7    HE3  MET  40           HE1      MET  40 -10.268   9.180  14.494
    8    HE2  MET  40           HE2      MET  40  -8.513   9.279  14.355
    9    HE1  MET  40           HE3      MET  40  -9.419  10.654  14.983

  No H/Q in entry =           9
  In of MODEL   53
    1    H    MET  41           H        MET  41  -3.714   7.948  17.682
    2    HA   MET  41           HA       MET  41  -2.964   6.185  15.587
    3    HB2  MET  41           HB2      MET  41  -1.353   6.835  18.068
    4    HB3  MET  41           HB3      MET  41  -0.735   6.180  16.556
    5    HG2  MET  41           HG2      MET  41  -1.863   8.375  15.545
    6    HG3  MET  41           HG3      MET  41  -1.629   8.961  17.190
    7    HE2  MET  41           HE1      MET  41   1.265   6.832  17.568
    8    HE1  MET  41           HE2      MET  41   0.485   8.134  18.462
    9    HE3  MET  41           HE3      MET  41   2.114   8.361  17.827

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ASP  42           H        ASP  42  -3.372   5.717  19.071
    2    HA   ASP  42           HA       ASP  42  -2.363   3.113  19.237
    3    HB2  ASP  42           HB2      ASP  42  -3.229   4.882  21.054
    4    HB3  ASP  42           HB3      ASP  42  -4.666   3.871  20.975

  No H/Q in entry =           4
  In of MODEL   53
    1    H    GLN  43           H        GLN  43  -5.683   4.250  18.719
    2    HA   GLN  43           HA       GLN  43  -6.851   1.674  18.519
    3    HB2  GLN  43           HB2      GLN  43  -7.742   4.336  17.384
    4    HB3  GLN  43           HB3      GLN  43  -8.719   2.866  17.357
    5    HG2  GLN  43           HG2      GLN  43  -8.441   2.743  19.866
    6    HG3  GLN  43           HG3      GLN  43  -7.699   4.340  19.798
    7   HE21  GLN  43          HE21      GLN  43  -9.886   4.443  21.287
    8   HE22  GLN  43          HE22      GLN  43 -11.236   5.032  20.448

  No H/Q in entry =           8
  In of MODEL   53
    1    H    SER  44           H        SER  44  -5.476   3.874  16.113
    2    HA   SER  44           HA       SER  44  -6.180   2.396  13.821
    3    HB2  SER  44           HB2      SER  44  -4.902   4.767  14.271
    4    HB3  SER  44           HB3      SER  44  -3.555   3.757  13.748
    5    HG   SER  44           HG       SER  44  -4.648   4.740  11.979

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ARG  45           H        ARG  45  -3.315   2.255  15.917
    2    HA   ARG  45           HA       ARG  45  -1.847   0.285  14.543
    3    HB2  ARG  45           HB2      ARG  45  -1.001   1.698  16.416
    4    HB3  ARG  45           HB3      ARG  45  -2.008   0.778  17.531
    5    HG2  ARG  45           HG2      ARG  45  -0.794  -1.293  16.896
    6    HG3  ARG  45           HG3      ARG  45   0.237  -0.348  15.823
    7    HD2  ARG  45           HD2      ARG  45   0.975   1.025  17.782
    8    HD3  ARG  45           HD3      ARG  45   0.036  -0.040  18.851
    9    HE   ARG  45           HE       ARG  45   1.728  -1.653  17.280
   10   HH21  ARG  45          HH11      ARG  45   3.615  -2.495  18.128
   11   HH22  ARG  45          HH12      ARG  45   4.388  -1.717  19.463
   12   HH11  ARG  45          HH21      ARG  45   2.043   0.811  19.671
   13   HH12  ARG  45          HH22      ARG  45   3.498   0.157  20.334

  No H/Q in entry =          13
  In of MODEL   53
    1    H    MET  46           H        MET  46  -4.262  -0.010  17.130
    2    HA   MET  46           HA       MET  46  -4.125  -2.811  17.438
    3    HB2  MET  46           HB2      MET  46  -6.286  -0.789  18.020
    4    HB3  MET  46           HB3      MET  46  -6.494  -2.506  18.374
    5    HG2  MET  46           HG2      MET  46  -4.475  -2.476  19.775
    6    HG3  MET  46           HG3      MET  46  -4.225  -0.778  19.405
    7    HE3  MET  46           HE1      MET  46  -4.263  -1.532  22.405
    8    HE2  MET  46           HE2      MET  46  -5.289  -0.229  22.996
    9    HE1  MET  46           HE3      MET  46  -4.140   0.084  21.699

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ALA  47           H        ALA  47  -6.112  -0.773  15.332
    2    HA   ALA  47           HA       ALA  47  -7.745  -2.807  14.258
    3    HB3  ALA  47           HB1      ALA  47  -8.399  -0.563  13.838
    4    HB1  ALA  47           HB2      ALA  47  -7.908  -1.201  12.269
    5    HB2  ALA  47           HB3      ALA  47  -6.822  -0.144  13.172

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LEU  48           H        LEU  48  -4.607  -1.532  13.224
    2    HA   LEU  48           HA       LEU  48  -4.330  -3.126  10.885
    3    HB2  LEU  48           HB2      LEU  48  -2.269  -1.870  12.704
    4    HB3  LEU  48           HB3      LEU  48  -1.900  -2.595  11.140
    5    HG   LEU  48           HG       LEU  48  -3.900  -0.355  11.517
    6   HD13  LEU  48          HD11      LEU  48  -1.772   0.497  12.195
    7   HD12  LEU  48          HD12      LEU  48  -2.032   1.054  10.542
    8   HD11  LEU  48          HD13      LEU  48  -0.951  -0.305  10.856
    9   HD22  LEU  48          HD21      LEU  48  -4.371  -1.334   9.439
   10   HD21  LEU  48          HD22      LEU  48  -2.691  -1.788   9.153
   11   HD23  LEU  48          HD23      LEU  48  -3.190  -0.103   8.991

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ASN  49           H        ASN  49  -3.308  -3.535  14.236
    2    HA   ASN  49           HA       ASN  49  -1.730  -5.816  13.915
    3    HB2  ASN  49           HB2      ASN  49  -1.740  -4.493  15.963
    4    HB3  ASN  49           HB3      ASN  49  -3.414  -4.929  16.274
    5   HD21  ASN  49          HD21      ASN  49  -0.163  -6.384  15.922
    6   HD22  ASN  49          HD22      ASN  49  -0.470  -7.694  16.957

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLU  50           H        GLU  50  -5.199  -5.500  14.567
    2    HA   GLU  50           HA       GLU  50  -5.746  -8.293  14.672
    3    HB2  GLU  50           HB2      GLU  50  -7.316  -6.587  15.539
    4    HB3  GLU  50           HB3      GLU  50  -7.593  -6.019  13.891
    5    HG2  GLU  50           HG2      GLU  50  -8.481  -8.204  13.248
    6    HG3  GLU  50           HG3      GLU  50  -8.117  -8.852  14.843

  No H/Q in entry =           6
  In of MODEL   53
    1    H    ALA  51           H        ALA  51  -5.769  -5.894  12.076
    2    HA   ALA  51           HA       ALA  51  -6.764  -7.609  10.048
    3    HB2  ALA  51           HB1      ALA  51  -6.514  -5.799   8.681
    4    HB1  ALA  51           HB2      ALA  51  -4.873  -5.471   9.239
    5    HB3  ALA  51           HB3      ALA  51  -6.256  -4.942  10.199

  No H/Q in entry =           5
  In of MODEL   53
    1    H    HIS  52           H        HIS  52  -3.468  -6.744  11.051
    2    HA   HIS  52           HA       HIS  52  -2.077  -8.251   9.110
    3    HB2  HIS  52           HB2      HIS  52  -1.056  -6.520  10.589
    4    HB3  HIS  52           HB3      HIS  52  -1.199  -7.641  11.942
    5    HD1  HIS  52           HD1      HIS  52   0.293  -9.799  11.873
    6    HD2  HIS  52           HD2      HIS  52   1.029  -7.110   8.773
    7    HE1  HIS  52           HE1      HIS  52   2.479 -10.510  10.812
    8    HE2  HIS  52           HE2      HIS  52   2.942  -8.881   8.919

  No H/Q in entry =           8
  In of MODEL   53
    1    H    LEU  53           H        LEU  53  -3.319  -9.113  12.315
    2    HA   LEU  53           HA       LEU  53  -2.156 -11.673  12.515
    3    HB2  LEU  53           HB2      LEU  53  -4.632 -10.458  13.716
    4    HB3  LEU  53           HB3      LEU  53  -4.198 -12.140  14.009
    5    HG   LEU  53           HG       LEU  53  -2.268  -9.848  14.498
    6   HD11  LEU  53          HD11      LEU  53  -4.308 -11.128  16.328
    7   HD13  LEU  53          HD12      LEU  53  -4.084  -9.415  15.978
    8   HD12  LEU  53          HD13      LEU  53  -2.893 -10.279  16.943
    9   HD22  LEU  53          HD21      LEU  53  -1.009 -11.839  14.485
   10   HD21  LEU  53          HD22      LEU  53  -2.334 -12.791  15.145
   11   HD23  LEU  53          HD23      LEU  53  -1.433 -11.707  16.188

  No H/Q in entry =          11
  In of MODEL   53
    1    H    VAL  54           H        VAL  54  -5.245 -10.601  11.135
    2    HA   VAL  54           HA       VAL  54  -6.190 -13.183  10.442
    3    HB   VAL  54           HB       VAL  54  -6.793 -10.441   9.304
    4   HG12  VAL  54          HG11      VAL  54  -8.909 -11.790   8.480
    5   HG11  VAL  54          HG12      VAL  54  -7.816 -13.171   8.558
    6   HG13  VAL  54          HG13      VAL  54  -7.432 -11.801   7.519
    7   HG22  VAL  54          HG21      VAL  54  -7.713 -10.467  11.450
    8   HG21  VAL  54          HG22      VAL  54  -7.991 -12.206  11.429
    9   HG23  VAL  54          HG23      VAL  54  -9.052 -11.135  10.517

  No H/Q in entry =           9
  In of MODEL   53
    1    H    GLN  55           H        GLN  55  -4.274 -10.757   8.665
    2    HA   GLN  55           HA       GLN  55  -4.150 -12.223   6.247
    3    HB2  GLN  55           HB2      GLN  55  -3.514  -9.967   6.062
    4    HB3  GLN  55           HB3      GLN  55  -2.412 -10.059   7.433
    5    HG2  GLN  55           HG2      GLN  55  -0.699 -10.929   6.167
    6    HG3  GLN  55           HG3      GLN  55  -1.781 -11.889   5.166
    7   HE21  GLN  55          HE21      GLN  55  -1.775 -11.198   3.045
    8   HE22  GLN  55          HE22      GLN  55  -1.552  -9.597   2.536

  No H/Q in entry =           8
  In of MODEL   53
    1    H    THR  56           H        THR  56  -2.061 -12.232   9.141
    2    HA   THR  56           HA       THR  56  -0.001 -13.860   8.235
    3    HB   THR  56           HB       THR  56  -1.263 -14.091  10.976
    4    HG1  THR  56           HG1      THR  56   0.475 -12.164   9.859
    5   HG22  THR  56          HG21      THR  56   1.667 -14.202  10.347
    6   HG21  THR  56          HG22      THR  56   0.668 -15.626  10.055
    7   HG23  THR  56          HG23      THR  56   0.784 -14.945  11.679

  No H/Q in entry =           7
  In of MODEL   53
    1    H    LYS  57           H        LYS  57  -3.143 -14.852   9.580
    2    HA   LYS  57           HA       LYS  57  -2.736 -17.654   9.336
    3    HB2  LYS  57           HB2      LYS  57  -4.543 -16.576  10.681
    4    HB3  LYS  57           HB3      LYS  57  -5.309 -16.048   9.190
    5    HG2  LYS  57           HG2      LYS  57  -5.981 -18.192   8.606
    6    HG3  LYS  57           HG3      LYS  57  -4.710 -18.964   9.551
    7    HD2  LYS  57           HD2      LYS  57  -7.172 -19.051  10.433
    8    HD3  LYS  57           HD3      LYS  57  -5.872 -18.705  11.574
    9    HE2  LYS  57           HE2      LYS  57  -7.128 -16.383  10.162
   10    HE3  LYS  57           HE3      LYS  57  -8.064 -17.152  11.442
   11    HZ3  LYS  57           HZ1      LYS  57  -6.798 -16.187  12.954
   12    HZ2  LYS  57           HZ2      LYS  57  -6.002 -15.333  11.721
   13    HZ1  LYS  57           HZ3      LYS  57  -5.383 -16.821  12.262

  No H/Q in entry =          13
  In of MODEL   53
    1    H    LEU  58           H        LEU  58  -4.019 -15.192   7.153
    2    HA   LEU  58           HA       LEU  58  -4.836 -17.005   5.141
    3    HB2  LEU  58           HB2      LEU  58  -4.185 -14.066   5.010
    4    HB3  LEU  58           HB3      LEU  58  -4.854 -14.993   3.666
    5    HG   LEU  58           HG       LEU  58  -6.148 -14.795   6.406
    6   HD11  LEU  58          HD11      LEU  58  -6.409 -13.143   3.913
    7   HD13  LEU  58          HD12      LEU  58  -6.402 -12.636   5.602
    8   HD12  LEU  58          HD13      LEU  58  -7.832 -13.409   4.921
    9   HD22  LEU  58          HD21      LEU  58  -7.133 -16.690   5.530
   10   HD21  LEU  58          HD22      LEU  58  -6.777 -16.243   3.862
   11   HD23  LEU  58          HD23      LEU  58  -8.134 -15.497   4.705

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  59           H        ILE  59  -1.688 -15.840   6.022
    2    HA   ILE  59           HA       ILE  59  -0.585 -16.584   3.392
    3    HB   ILE  59           HB       ILE  59   0.204 -14.530   4.970
    4   HG12  ILE  59          HG12      ILE  59   2.276 -16.207   3.539
    5   HG13  ILE  59          HG13      ILE  59   1.098 -15.246   2.684
    6   HG23  ILE  59          HG21      ILE  59   2.032 -15.043   6.370
    7   HG22  ILE  59          HG22      ILE  59   2.266 -16.624   5.658
    8   HG21  ILE  59          HG23      ILE  59   0.902 -16.326   6.734
    9   HD11  ILE  59          HD11      ILE  59   1.865 -13.237   3.974
   10   HD13  ILE  59          HD12      ILE  59   3.102 -13.915   2.919
   11   HD12  ILE  59          HD13      ILE  59   3.149 -14.235   4.653

  No H/Q in entry =          11
  In of MODEL   53
    1    H    GLU  60           H        GLU  60  -0.633 -17.689   6.759
    2    HA   GLU  60           HA       GLU  60   1.371 -19.697   6.507
    3    HB2  GLU  60           HB2      GLU  60   0.611 -18.906   8.693
    4    HB3  GLU  60           HB3      GLU  60  -1.007 -19.531   8.378
    5    HG2  GLU  60           HG2      GLU  60  -0.095 -21.824   8.239
    6    HG3  GLU  60           HG3      GLU  60   1.523 -21.198   8.552

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLY  61           H        GLY  61  -2.138 -19.743   5.999
    2    HA3  GLY  61           HA2      GLY  61  -1.925 -22.539   5.043
    3    HA2  GLY  61           HA3      GLY  61  -3.403 -21.782   5.627

  No H/Q in entry =           3
  In of MODEL   53
    1    H    ASP  62           H        ASP  62  -1.139 -20.231   3.440
    2    HA   ASP  62           HA       ASP  62  -3.221 -19.714   1.528
    3    HB2  ASP  62           HB2      ASP  62  -1.360 -18.600   0.276
    4    HB3  ASP  62           HB3      ASP  62  -1.550 -18.026   1.929

  No H/Q in entry =           4
  In of MODEL   53
    1    H    ALA  63           H        ALA  63  -1.323 -22.439   2.016
    2    HA   ALA  63           HA       ALA  63  -0.576 -23.161  -0.634
    3    HB1  ALA  63           HB1      ALA  63  -1.336 -25.130   1.501
    4    HB2  ALA  63           HB2      ALA  63   0.172 -24.217   1.570
    5    HB3  ALA  63           HB3      ALA  63  -0.140 -25.305   0.215

  No H/Q in entry =           5
  In of MODEL   53
    1    H    GLY  64           H        GLY  64  -3.491 -23.653   1.299
    2    HA3  GLY  64           HA2      GLY  64  -5.577 -24.469   0.793
    3    HA2  GLY  64           HA3      GLY  64  -5.348 -23.642  -0.739

  No H/Q in entry =           3
  In of MODEL   53
    1    H    GLU  65           H        GLU  65  -4.907 -24.846  -2.586
    2    HA   GLU  65           HA       GLU  65  -5.649 -27.592  -2.488
    3    HB2  GLU  65           HB2      GLU  65  -4.532 -25.894  -4.716
    4    HB3  GLU  65           HB3      GLU  65  -5.056 -27.566  -4.926
    5    HG2  GLU  65           HG2      GLU  65  -7.305 -26.995  -4.165
    6    HG3  GLU  65           HG3      GLU  65  -6.801 -25.338  -3.840

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLY  66           H        GLY  66  -4.232 -29.001  -4.118
    2    HA3  GLY  66           HA2      GLY  66  -2.036 -29.965  -2.642
    3    HA2  GLY  66           HA3      GLY  66  -2.498 -30.467  -4.257

  No H/Q in entry =           3
  In of MODEL   53
    1    H    LYS  67           H        LYS  67  -2.206 -27.869  -5.443
    2    HA   LYS  67           HA       LYS  67   0.587 -27.987  -6.044
    3    HB2  LYS  67           HB2      LYS  67  -1.655 -26.230  -7.024
    4    HB3  LYS  67           HB3      LYS  67   0.000 -26.135  -7.641
    5    HG2  LYS  67           HG2      LYS  67  -0.069 -28.532  -8.219
    6    HG3  LYS  67           HG3      LYS  67  -1.718 -28.636  -7.605
    7    HD2  LYS  67           HD2      LYS  67  -2.482 -27.052  -9.309
    8    HD3  LYS  67           HD3      LYS  67  -0.828 -26.864  -9.898
    9    HE2  LYS  67           HE2      LYS  67  -2.039 -28.467 -11.310
   10    HE3  LYS  67           HE3      LYS  67  -0.755 -29.288 -10.423
   11    HZ3  LYS  67           HZ1      LYS  67  -2.233 -30.567  -9.414
   12    HZ2  LYS  67           HZ2      LYS  67  -3.428 -29.933 -10.439
   13    HZ1  LYS  67           HZ3      LYS  67  -3.156 -29.236  -8.915

  No H/Q in entry =          13
  In of MODEL   53
    1    H    MET  68           H        MET  68   1.985 -26.154  -6.203
    2    HA   MET  68           HA       MET  68   2.488 -24.931  -3.729
    3    HB2  MET  68           HB2      MET  68   3.565 -24.497  -6.503
    4    HB3  MET  68           HB3      MET  68   4.149 -23.573  -5.118
    5    HG2  MET  68           HG2      MET  68   4.741 -25.653  -3.955
    6    HG3  MET  68           HG3      MET  68   4.118 -26.601  -5.307
    7    HE2  MET  68           HE1      MET  68   6.605 -27.853  -6.210
    8    HE1  MET  68           HE2      MET  68   6.365 -27.484  -4.503
    9    HE3  MET  68           HE3      MET  68   7.898 -27.088  -5.276

  No H/Q in entry =           9
  In of MODEL   53
    1    H    LYS  69           H        LYS  69   0.978 -23.597  -6.660
    2    HA   LYS  69           HA       LYS  69   1.012 -20.944  -6.266
    3    HB2  LYS  69           HB2      LYS  69  -0.123 -22.024  -8.140
    4    HB3  LYS  69           HB3      LYS  69  -1.476 -22.431  -7.078
    5    HG2  LYS  69           HG2      LYS  69  -1.875 -20.075  -6.607
    6    HG3  LYS  69           HG3      LYS  69  -0.461 -19.616  -7.555
    7    HD2  LYS  69           HD2      LYS  69  -1.509 -20.564  -9.580
    8    HD3  LYS  69           HD3      LYS  69  -2.927 -21.013  -8.630
    9    HE2  LYS  69           HE2      LYS  69  -3.359 -18.891  -9.762
   10    HE3  LYS  69           HE3      LYS  69  -3.242 -18.616  -8.024
   11    HZ2  LYS  69           HZ1      LYS  69  -1.431 -17.813 -10.158
   12    HZ1  LYS  69           HZ2      LYS  69  -0.715 -18.296  -8.696
   13    HZ3  LYS  69           HZ3      LYS  69  -1.830 -17.015  -8.716

  No H/Q in entry =          13
  In of MODEL   53
    1    H    VAL  70           H        VAL  70  -0.214 -19.299  -5.316
    2    HA   VAL  70           HA       VAL  70  -1.718 -20.087  -2.881
    3    HB   VAL  70           HB       VAL  70  -0.912 -17.948  -1.896
    4   HG13  VAL  70          HG11      VAL  70   1.384 -18.681  -1.491
    5   HG12  VAL  70          HG12      VAL  70   1.329 -19.713  -2.920
    6   HG11  VAL  70          HG13      VAL  70   0.313 -20.082  -1.527
    7   HG23  VAL  70          HG21      VAL  70   1.134 -16.927  -3.159
    8   HG22  VAL  70          HG22      VAL  70  -0.481 -16.526  -3.739
    9   HG21  VAL  70          HG23      VAL  70   0.476 -17.743  -4.579

  No H/Q in entry =           9
  In of MODEL   53
    1    H    SER  71           H        SER  71  -3.248 -18.375  -2.162
    2    HA   SER  71           HA       SER  71  -5.134 -17.718  -4.158
    3    HB2  SER  71           HB2      SER  71  -5.654 -17.935  -1.708
    4    HB3  SER  71           HB3      SER  71  -4.798 -16.423  -1.429
    5    HG   SER  71           HG       SER  71  -7.246 -16.524  -1.889

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LEU  72           H        LEU  72  -5.294 -16.059  -5.484
    2    HA   LEU  72           HA       LEU  72  -3.159 -14.276  -5.953
    3    HB2  LEU  72           HB2      LEU  72  -6.019 -14.286  -6.914
    4    HB3  LEU  72           HB3      LEU  72  -4.801 -13.151  -7.485
    5    HG   LEU  72           HG       LEU  72  -4.460 -16.166  -7.617
    6   HD13  LEU  72          HD11      LEU  72  -5.188 -16.099  -9.879
    7   HD12  LEU  72          HD12      LEU  72  -5.148 -14.336  -9.920
    8   HD11  LEU  72          HD13      LEU  72  -6.392 -15.167  -8.988
    9   HD21  LEU  72          HD21      LEU  72  -2.905 -13.782  -8.590
   10   HD23  LEU  72          HD22      LEU  72  -2.843 -15.267  -9.527
   11   HD22  LEU  72          HD23      LEU  72  -2.307 -15.263  -7.849

  No H/Q in entry =          11
  In of MODEL   53
    1    H    VAL  73           H        VAL  73  -6.255 -13.878  -4.339
    2    HA   VAL  73           HA       VAL  73  -6.264 -11.107  -3.987
    3    HB   VAL  73           HB       VAL  73  -7.990 -11.444  -2.406
    4   HG11  VAL  73          HG11      VAL  73  -8.324 -12.269  -4.815
    5   HG13  VAL  73          HG12      VAL  73  -9.467 -12.861  -3.611
    6   HG12  VAL  73          HG13      VAL  73  -8.151 -13.898  -4.162
    7   HG23  VAL  73          HG21      VAL  73  -8.314 -13.954  -1.635
    8   HG22  VAL  73          HG22      VAL  73  -7.191 -12.900  -0.777
    9   HG21  VAL  73          HG23      VAL  73  -6.584 -14.058  -1.960

  No H/Q in entry =           9
  In of MODEL   53
    1    H    LEU  74           H        LEU  74  -4.367 -13.502  -2.395
    2    HA   LEU  74           HA       LEU  74  -3.953 -12.368   0.131
    3    HB2  LEU  74           HB2      LEU  74  -3.193 -14.593  -0.349
    4    HB3  LEU  74           HB3      LEU  74  -2.143 -14.009  -1.638
    5    HG   LEU  74           HG       LEU  74  -0.805 -12.755   0.024
    6   HD13  LEU  74          HD11      LEU  74  -2.355 -12.243   1.756
    7   HD12  LEU  74          HD12      LEU  74  -1.269 -13.436   2.471
    8   HD11  LEU  74          HD13      LEU  74  -2.866 -13.925   1.902
    9   HD22  LEU  74          HD21      LEU  74   0.386 -14.614   0.678
   10   HD21  LEU  74          HD22      LEU  74  -0.632 -15.295  -0.571
   11   HD23  LEU  74          HD23      LEU  74  -1.061 -15.522   1.109

  No H/Q in entry =          11
  In of MODEL   53
    1    H    VAL  75           H        VAL  75  -2.042 -11.998  -2.817
    2    HA   VAL  75           HA       VAL  75  -0.224 -10.099  -1.796
    3    HB   VAL  75           HB       VAL  75  -1.171 -10.579  -4.621
    4   HG13  VAL  75          HG11      VAL  75  -0.299  -8.281  -4.423
    5   HG12  VAL  75          HG12      VAL  75   0.891  -9.288  -5.235
    6   HG11  VAL  75          HG13      VAL  75   1.104  -8.872  -3.542
    7   HG23  VAL  75          HG21      VAL  75   1.406 -11.313  -3.189
    8   HG22  VAL  75          HG22      VAL  75   0.927 -11.801  -4.816
    9   HG21  VAL  75          HG23      VAL  75   0.054 -12.425  -3.414

  No H/Q in entry =           9
  In of MODEL   53
    1    H    GLU  76           H        GLU  76  -3.361  -9.708  -3.469
    2    HA   GLU  76           HA       GLU  76  -3.374  -6.893  -3.568
    3    HB2  GLU  76           HB2      GLU  76  -5.047  -8.301  -4.743
    4    HB3  GLU  76           HB3      GLU  76  -5.710  -8.804  -3.196
    5    HG2  GLU  76           HG2      GLU  76  -7.142  -7.069  -4.071
    6    HG3  GLU  76           HG3      GLU  76  -6.264  -6.379  -2.720

  No H/Q in entry =           6
  In of MODEL   53
    1    H    ALA  77           H        ALA  77  -4.528  -9.108  -1.036
    2    HA   ALA  77           HA       ALA  77  -5.465  -7.094   0.720
    3    HB2  ALA  77           HB1      ALA  77  -6.054  -9.484   0.951
    4    HB3  ALA  77           HB2      ALA  77  -5.395  -8.826   2.447
    5    HB1  ALA  77           HB3      ALA  77  -4.391  -9.841   1.413

  No H/Q in entry =           5
  In of MODEL   53
    1    H    GLN  78           H        GLN  78  -2.338  -8.687   0.370
    2    HA   GLN  78           HA       GLN  78  -1.075  -7.546   2.627
    3    HB2  GLN  78           HB2      GLN  78  -0.236  -9.497   1.271
    4    HB3  GLN  78           HB3      GLN  78   0.227  -8.353   0.013
    5    HG2  GLN  78           HG2      GLN  78   1.695  -7.188   1.605
    6    HG3  GLN  78           HG3      GLN  78   1.231  -8.321   2.872
    7   HE21  GLN  78          HE21      GLN  78   3.965  -8.093   2.051
    8   HE22  GLN  78          HE22      GLN  78   4.409  -9.533   1.270

  No H/Q in entry =           8
  In of MODEL   53
    1    H    LEU  79           H        LEU  79  -1.410  -6.477  -0.721
    2    HA   LEU  79           HA       LEU  79   0.307  -4.274  -0.697
    3    HB2  LEU  79           HB2      LEU  79  -0.721  -5.065  -2.757
    4    HB3  LEU  79           HB3      LEU  79  -2.321  -4.650  -2.156
    5    HG   LEU  79           HG       LEU  79  -1.743  -2.271  -2.126
    6   HD13  LEU  79          HD11      LEU  79   0.498  -2.061  -1.602
    7   HD12  LEU  79          HD12      LEU  79   0.560  -1.773  -3.340
    8   HD11  LEU  79          HD13      LEU  79   0.988  -3.357  -2.693
    9   HD23  LEU  79          HD21      LEU  79  -1.093  -2.080  -4.674
   10   HD22  LEU  79          HD22      LEU  79  -2.633  -2.806  -4.223
   11   HD21  LEU  79          HD23      LEU  79  -1.273  -3.834  -4.662

  No H/Q in entry =          11
  In of MODEL   53
    1    H    HIS  80           H        HIS  80  -3.165  -4.387   0.112
    2    HA   HIS  80           HA       HIS  80  -3.319  -1.628   0.776
    3    HB2  HIS  80           HB2      HIS  80  -5.058  -4.012   1.085
    4    HB3  HIS  80           HB3      HIS  80  -5.364  -2.668   2.189
    5    HD1  HIS  80           HD1      HIS  80  -6.952  -1.007   1.274
    6    HD2  HIS  80           HD2      HIS  80  -4.772  -2.849  -1.764
    7    HE1  HIS  80           HE1      HIS  80  -7.767   0.004  -0.908
    8    HE2  HIS  80           HE2      HIS  80  -6.444  -1.113  -2.769

  No H/Q in entry =           8
  In of MODEL   53
    1    H    LEU  81           H        LEU  81  -2.884  -4.532   2.770
    2    HA   LEU  81           HA       LEU  81  -2.863  -3.186   5.255
    3    HB2  LEU  81           HB2      LEU  81  -1.680  -5.820   4.379
    4    HB3  LEU  81           HB3      LEU  81  -1.654  -5.263   6.054
    5    HG   LEU  81           HG       LEU  81  -4.195  -5.476   4.413
    6   HD12  LEU  81          HD11      LEU  81  -4.536  -7.538   5.957
    7   HD11  LEU  81          HD12      LEU  81  -2.784  -7.494   6.152
    8   HD13  LEU  81          HD13      LEU  81  -3.488  -7.712   4.549
    9   HD23  LEU  81          HD21      LEU  81  -5.053  -5.668   6.910
   10   HD22  LEU  81          HD22      LEU  81  -4.701  -4.084   6.223
   11   HD21  LEU  81          HD23      LEU  81  -3.531  -4.863   7.288

  No H/Q in entry =          11
  In of MODEL   53
    1    H    MET  82           H        MET  82  -0.185  -4.129   3.097
    2    HA   MET  82           HA       MET  82   1.903  -3.268   4.791
    3    HB2  MET  82           HB2      MET  82   1.697  -3.604   1.798
    4    HB3  MET  82           HB3      MET  82   3.184  -3.057   2.569
    5    HG2  MET  82           HG2      MET  82   1.734  -5.625   3.284
    6    HG3  MET  82           HG3      MET  82   3.112  -5.536   2.191
    7    HE3  MET  82           HE1      MET  82   6.129  -4.848   4.190
    8    HE2  MET  82           HE2      MET  82   5.230  -3.466   3.568
    9    HE1  MET  82           HE3      MET  82   5.300  -4.957   2.632

  No H/Q in entry =           9
  In of MODEL   53
    1    H    THR  83           H        THR  83   0.119  -1.596   2.227
    2    HA   THR  83           HA       THR  83   1.569   0.829   2.322
    3    HB   THR  83           HB       THR  83  -0.588   1.789   1.326
    4    HG1  THR  83           HG1      THR  83  -2.258   0.518   1.210
    5   HG22  THR  83          HG21      THR  83  -0.336  -0.032  -0.674
    6   HG21  THR  83          HG22      THR  83   1.155  -0.348   0.209
    7   HG23  THR  83          HG23      THR  83   0.822   1.271  -0.406

  No H/Q in entry =           7
  In of MODEL   53
    1    H    SER  84           H        SER  84  -1.461  -0.156   3.908
    2    HA   SER  84           HA       SER  84  -1.925   2.280   5.252
    3    HB2  SER  84           HB2      SER  84  -2.805  -0.544   5.810
    4    HB3  SER  84           HB3      SER  84  -3.282   0.804   6.842
    5    HG   SER  84           HG       SER  84  -3.732   0.499   4.047

  No H/Q in entry =           5
  In of MODEL   53
    1    H    MET  85           H        MET  85  -0.267  -0.679   6.388
    2    HA   MET  85           HA       MET  85   0.255   0.237   8.995
    3    HB2  MET  85           HB2      MET  85   0.513  -2.111   8.319
    4    HB3  MET  85           HB3      MET  85   1.905  -1.669   7.329
    5    HG2  MET  85           HG2      MET  85   3.096  -0.867   9.324
    6    HG3  MET  85           HG3      MET  85   1.693  -1.240  10.325
    7    HE2  MET  85           HE1      MET  85   4.751  -3.912   8.372
    8    HE1  MET  85           HE2      MET  85   4.202  -2.307   7.895
    9    HE3  MET  85           HE3      MET  85   3.330  -3.730   7.337

  No H/Q in entry =           9
  In of MODEL   53
    1    H    LEU  86           H        LEU  86   2.207   0.463   6.053
    2    HA   LEU  86           HA       LEU  86   4.437   1.737   7.220
    3    HB2  LEU  86           HB2      LEU  86   4.239   0.659   4.910
    4    HB3  LEU  86           HB3      LEU  86   3.457   2.154   4.394
    5    HG   LEU  86           HG       LEU  86   5.501   3.366   5.385
    6   HD11  LEU  86          HD11      LEU  86   6.160   0.743   6.186
    7   HD13  LEU  86          HD12      LEU  86   7.186   2.171   6.289
    8   HD12  LEU  86          HD13      LEU  86   7.285   1.122   4.878
    9   HD23  LEU  86          HD21      LEU  86   6.200   1.593   3.037
   10   HD22  LEU  86          HD22      LEU  86   6.620   3.283   3.302
   11   HD21  LEU  86          HD23      LEU  86   4.962   2.843   2.895

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ALA  87           H        ALA  87   1.553   3.029   5.623
    2    HA   ALA  87           HA       ALA  87   2.191   5.749   5.710
    3    HB1  ALA  87           HB1      ALA  87  -0.142   4.159   5.158
    4    HB3  ALA  87           HB2      ALA  87   0.199   5.815   4.660
    5    HB2  ALA  87           HB3      ALA  87  -0.608   5.506   6.199

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ARG  88           H        ARG  88   0.458   3.774   8.092
    2    HA   ARG  88           HA       ARG  88  -0.029   5.831   9.937
    3    HB2  ARG  88           HB2      ARG  88  -1.006   3.494   9.998
    4    HB3  ARG  88           HB3      ARG  88   0.523   2.968  10.711
    5    HG2  ARG  88           HG2      ARG  88   0.073   5.050  12.329
    6    HG3  ARG  88           HG3      ARG  88  -1.597   4.752  11.865
    7    HD2  ARG  88           HD2      ARG  88  -1.740   2.904  13.111
    8    HD3  ARG  88           HD3      ARG  88  -0.158   2.297  12.587
    9    HE   ARG  88           HE       ARG  88  -0.683   3.568  15.039
   10   HH21  ARG  88          HH11      ARG  88   0.886   4.554  16.285
   11   HH22  ARG  88          HH12      ARG  88   2.415   4.956  15.588
   12   HH11  ARG  88          HH21      ARG  88   1.613   3.713  12.473
   13   HH12  ARG  88          HH22      ARG  88   2.835   4.464  13.441

  No H/Q in entry =          13
  In of MODEL   53
    1    H    GLU  89           H        GLU  89   2.732   3.567   9.726
    2    HA   GLU  89           HA       GLU  89   3.997   4.434  12.076
    3    HB2  GLU  89           HB2      GLU  89   4.629   2.406  10.735
    4    HB3  GLU  89           HB3      GLU  89   5.428   3.488   9.592
    5    HG2  GLU  89           HG2      GLU  89   6.918   4.310  11.343
    6    HG3  GLU  89           HG3      GLU  89   6.062   3.367  12.559

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LEU  90           H        LEU  90   4.348   5.588   8.750
    2    HA   LEU  90           HA       LEU  90   6.307   7.557   9.345
    3    HB2  LEU  90           HB2      LEU  90   4.307   7.258   7.109
    4    HB3  LEU  90           HB3      LEU  90   5.557   8.509   7.136
    5    HG   LEU  90           HG       LEU  90   6.183   5.562   7.472
    6   HD12  LEU  90          HD11      LEU  90   6.946   5.785   5.036
    7   HD11  LEU  90          HD12      LEU  90   5.954   7.241   4.983
    8   HD13  LEU  90          HD13      LEU  90   5.208   5.679   5.322
    9   HD22  LEU  90          HD21      LEU  90   8.094   6.682   8.164
   10   HD21  LEU  90          HD22      LEU  90   7.771   8.092   7.155
   11   HD23  LEU  90          HD23      LEU  90   8.411   6.618   6.431

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  91           H        ILE  91   2.769   7.628   9.180
    2    HA   ILE  91           HA       ILE  91   2.468  10.405   9.630
    3    HB   ILE  91           HB       ILE  91   0.638   8.057  10.163
    4   HG12  ILE  91          HG12      ILE  91   0.434  10.343   8.178
    5   HG13  ILE  91          HG13      ILE  91   1.273   8.836   7.809
    6   HG22  ILE  91          HG21      ILE  91  -1.063  10.142  10.219
    7   HG21  ILE  91          HG22      ILE  91   0.347  10.951  10.899
    8   HG23  ILE  91          HG23      ILE  91  -0.315   9.523  11.692
    9   HD13  ILE  91          HD11      ILE  91  -0.691   7.578   7.844
   10   HD12  ILE  91          HD12      ILE  91  -1.254   9.102   7.160
   11   HD11  ILE  91          HD13      ILE  91  -1.539   8.742   8.863

  No H/Q in entry =          11
  In of MODEL   53
    1    H    THR  92           H        THR  92   2.819   7.658  11.832
    2    HA   THR  92           HA       THR  92   2.384   9.037  14.254
    3    HB   THR  92           HB       THR  92   4.161   6.676  13.598
    4    HG1  THR  92           HG1      THR  92   2.181   5.948  13.487
    5   HG22  THR  92          HG21      THR  92   3.760   6.397  16.229
    6   HG21  THR  92          HG22      THR  92   3.722   8.157  16.156
    7   HG23  THR  92          HG23      THR  92   5.145   7.280  15.590

  No H/Q in entry =           7
  In of MODEL   53
    1    H    GLU  93           H        GLU  93   5.338   8.545  12.335
    2    HA   GLU  93           HA       GLU  93   7.104   9.946  14.041
    3    HB2  GLU  93           HB2      GLU  93   7.203   9.631  11.026
    4    HB3  GLU  93           HB3      GLU  93   8.546  10.141  12.047
    5    HG2  GLU  93           HG2      GLU  93   7.096   7.525  12.488
    6    HG3  GLU  93           HG3      GLU  93   8.487   7.657  11.419

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LEU  94           H        LEU  94   5.084  10.991  11.318
    2    HA   LEU  94           HA       LEU  94   5.928  13.683  11.222
    3    HB2  LEU  94           HB2      LEU  94   3.322  12.355  10.455
    4    HB3  LEU  94           HB3      LEU  94   3.606  14.078  10.215
    5    HG   LEU  94           HG       LEU  94   5.600  12.062   9.175
    6   HD11  LEU  94          HD11      LEU  94   2.872  12.651   8.099
    7   HD13  LEU  94          HD12      LEU  94   3.835  11.181   7.978
    8   HD12  LEU  94          HD13      LEU  94   4.195  12.556   6.935
    9   HD23  LEU  94          HD21      LEU  94   5.885  13.894   7.453
   10   HD22  LEU  94          HD22      LEU  94   6.298  14.381   9.098
   11   HD21  LEU  94          HD23      LEU  94   4.758  14.871   8.391

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  95           H        ILE  95   3.358  12.102  13.100
    2    HA   ILE  95           HA       ILE  95   2.341  14.466  14.290
    3    HB   ILE  95           HB       ILE  95   2.314  11.584  15.215
    4   HG12  ILE  95          HG12      ILE  95   0.124  13.388  14.154
    5   HG13  ILE  95          HG13      ILE  95   1.071  12.315  13.127
    6   HG21  ILE  95          HG21      ILE  95   1.060  14.074  16.409
    7   HG23  ILE  95          HG22      ILE  95   2.088  12.891  17.219
    8   HG22  ILE  95          HG23      ILE  95   0.449  12.452  16.736
    9   HD13  ILE  95          HD11      ILE  95   0.137  10.390  14.041
   10   HD12  ILE  95          HD12      ILE  95  -1.231  11.498  14.110
   11   HD11  ILE  95          HD13      ILE  95  -0.277  11.186  15.560

  No H/Q in entry =          11
  In of MODEL   53
    1    H    GLU  96           H        GLU  96   4.901  12.212  15.299
    2    HA   GLU  96           HA       GLU  96   5.459  13.404  17.793
    3    HB2  GLU  96           HB2      GLU  96   6.382  11.232  17.151
    4    HB3  GLU  96           HB3      GLU  96   7.332  11.993  15.876
    5    HG2  GLU  96           HG2      GLU  96   8.980  12.520  17.347
    6    HG3  GLU  96           HG3      GLU  96   7.839  13.348  18.396

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LEU  97           H        LEU  97   6.561  14.161  14.513
    2    HA   LEU  97           HA       LEU  97   8.469  16.133  15.235
    3    HB2  LEU  97           HB2      LEU  97   6.884  15.604  12.731
    4    HB3  LEU  97           HB3      LEU  97   7.921  17.022  12.858
    5    HG   LEU  97           HG       LEU  97   8.911  14.211  13.424
    6   HD12  LEU  97          HD11      LEU  97   9.922  14.392  11.112
    7   HD11  LEU  97          HD12      LEU  97   8.890  15.796  10.843
    8   HD13  LEU  97          HD13      LEU  97   8.169  14.213  11.134
    9   HD23  LEU  97          HD21      LEU  97  11.100  15.462  12.692
   10   HD22  LEU  97          HD22      LEU  97  10.476  15.740  14.318
   11   HD21  LEU  97          HD23      LEU  97  10.184  16.927  13.048

  No H/Q in entry =          11
  In of MODEL   53
    1    H    HIS  98           H        HIS  98   4.983  16.312  14.562
    2    HA   HIS  98           HA       HIS  98   4.719  19.115  14.695
    3    HB2  HIS  98           HB2      HIS  98   2.797  16.889  15.412
    4    HB3  HIS  98           HB3      HIS  98   2.351  18.595  15.465
    5    HD1  HIS  98           HD1      HIS  98   3.351  15.867  13.066
    6    HD2  HIS  98           HD2      HIS  98   2.025  19.818  12.936
    7    HE1  HIS  98           HE1      HIS  98   2.810  16.363  10.638
    8    HE2  HIS  98           HE2      HIS  98   2.007  18.762  10.538

  No H/Q in entry =           8
  In of MODEL   53
    1    H    GLU  99           H        GLU  99   4.807  16.626  17.195
    2    HA   GLU  99           HA       GLU  99   4.209  18.328  19.390
    3    HB2  GLU  99           HB2      GLU  99   4.089  15.847  19.487
    4    HB3  GLU  99           HB3      GLU  99   5.848  15.780  19.388
    5    HG2  GLU  99           HG2      GLU  99   6.042  17.070  21.463
    6    HG3  GLU  99           HG3      GLU  99   4.291  17.233  21.549

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LYS 100           H        LYS 100   7.259  17.359  17.841
    2    HA   LYS 100           HA       LYS 100   8.922  18.739  19.707
    3    HB2  LYS 100           HB2      LYS 100   9.424  17.808  16.871
    4    HB3  LYS 100           HB3      LYS 100  10.658  18.562  17.885
    5    HG2  LYS 100           HG2      LYS 100  10.250  16.817  19.624
    6    HG3  LYS 100           HG3      LYS 100   9.114  16.027  18.527
    7    HD2  LYS 100           HD2      LYS 100  10.913  15.722  16.870
    8    HD3  LYS 100           HD3      LYS 100  12.055  16.523  17.952
    9    HE2  LYS 100           HE2      LYS 100  11.627  14.773  19.668
   10    HE3  LYS 100           HE3      LYS 100  10.548  13.951  18.537
   11    HZ1  LYS 100           HZ1      LYS 100  13.380  14.585  17.896
   12    HZ3  LYS 100           HZ2      LYS 100  12.327  13.543  17.063
   13    HZ2  LYS 100           HZ3      LYS 100  12.902  13.116  18.604

  No H/Q in entry =          13
  In of MODEL   53
    1    H    LEU 101           H        LEU 101   7.255  19.687  16.742
    2    HA   LEU 101           HA       LEU 101   8.503  22.228  16.414
    3    HB2  LEU 101           HB2      LEU 101   5.897  21.028  15.513
    4    HB3  LEU 101           HB3      LEU 101   6.171  22.755  15.307
    5    HG   LEU 101           HG       LEU 101   8.187  20.713  14.352
    6   HD12  LEU 101          HD11      LEU 101   7.052  21.233  12.061
    7   HD11  LEU 101          HD12      LEU 101   5.653  21.681  13.034
    8   HD13  LEU 101          HD13      LEU 101   6.296  20.042  13.119
    9   HD21  LEU 101          HD21      LEU 101   7.599  23.633  13.793
   10   HD23  LEU 101          HD22      LEU 101   8.573  22.661  12.692
   11   HD22  LEU 101          HD23      LEU 101   9.109  22.912  14.352

  No H/Q in entry =          11
  In of MODEL   53
    1    H    LYS 102           H        LYS 102   6.938  21.110  19.021
    2    HA   LYS 102           HA       LYS 102   6.310  22.210  20.950
    3    HB2  LYS 102           HB2      LYS 102   7.624  24.183  19.832
    4    HB3  LYS 102           HB3      LYS 102   6.035  24.808  19.448
    5    HG2  LYS 102           HG2      LYS 102   7.394  24.535  22.108
    6    HG3  LYS 102           HG3      LYS 102   6.462  25.876  21.474
    7    HD2  LYS 102           HD2      LYS 102   5.180  23.256  22.346
    8    HD3  LYS 102           HD3      LYS 102   5.440  24.613  23.430
    9    HE2  LYS 102           HE2      LYS 102   3.164  24.240  21.930
   10    HE3  LYS 102           HE3      LYS 102   3.683  25.779  22.615
   11    HZ2  LYS 102           HZ1      LYS 102   3.166  25.894  20.232
   12    HZ1  LYS 102           HZ2      LYS 102   4.416  24.796  19.916
   13    HZ3  LYS 102           HZ3      LYS 102   4.775  26.322  20.560

  No H/Q in entry =          13
  In of MODEL   53
    1    H    ALA 103           H        ALA 103   4.706  23.774  18.174
    2    HA   ALA 103           HA       ALA 103   2.255  24.382  19.046
    3    HB1  ALA 103           HB1      ALA 103   1.358  23.552  16.799
    4    HB2  ALA 103           HB2      ALA 103   3.000  22.994  16.478
    5    HB3  ALA 103           HB3      ALA 103   2.686  24.710  16.743

  No H/Q in entry =           5
  In of MODEL   53
    1    H1   ALA   1           H3       ALA   1  10.406 -20.225  -6.188
    2    H2   ALA   1           H2       ALA   1   9.446 -20.418  -7.579
    3    H3   ALA   1           H1       ALA   1   8.991 -21.158  -6.119
    4    HA   ALA   1           HA       ALA   1  10.010 -22.981  -6.853
    5    HB1  ALA   1           HB1      ALA   1  10.121 -22.623  -9.128
    6    HB2  ALA   1           HB2      ALA   1  11.849 -22.496  -8.791
    7    HB3  ALA   1           HB3      ALA   1  10.871 -21.035  -8.946

  No H/Q in entry =           7
  In of MODEL   53
    1    H    GLU   2           H        GLU   2  12.280 -23.963  -6.900
    2    HA   GLU   2           HA       GLU   2  13.652 -23.900  -4.681
    3    HB2  GLU   2           HB2      GLU   2  15.023 -23.787  -7.373
    4    HB3  GLU   2           HB3      GLU   2  15.735 -24.408  -5.885
    5    HG2  GLU   2           HG2      GLU   2  14.692 -26.411  -6.131
    6    HG3  GLU   2           HG3      GLU   2  13.133 -25.644  -6.398

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLU   3           H        GLU   3  15.460 -22.060  -7.073
    2    HA   GLU   3           HA       GLU   3  16.627 -20.389  -5.108
    3    HB2  GLU   3           HB2      GLU   3  16.586 -20.386  -8.118
    4    HB3  GLU   3           HB3      GLU   3  17.346 -19.067  -7.227
    5    HG2  GLU   3           HG2      GLU   3  18.985 -20.464  -6.296
    6    HG3  GLU   3           HG3      GLU   3  18.019 -21.918  -6.522

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LEU   4           H        LEU   4  14.370 -19.509  -7.750
    2    HA   LEU   4           HA       LEU   4  13.937 -16.894  -7.140
    3    HB2  LEU   4           HB2      LEU   4  11.738 -18.838  -7.881
    4    HB3  LEU   4           HB3      LEU   4  11.688 -17.088  -8.080
    5    HG   LEU   4           HG       LEU   4  13.633 -18.979  -9.444
    6   HD13  LEU   4          HD11      LEU   4  12.343 -18.811 -11.360
    7   HD12  LEU   4          HD12      LEU   4  11.655 -17.257 -10.896
    8   HD11  LEU   4          HD13      LEU   4  11.077 -18.740 -10.137
    9   HD23  LEU   4          HD21      LEU   4  14.008 -16.738 -10.793
   10   HD22  LEU   4          HD22      LEU   4  14.857 -16.993  -9.269
   11   HD21  LEU   4          HD23      LEU   4  13.418 -15.976  -9.315

  No H/Q in entry =          11
  In of MODEL   53
    1    H    GLU   5           H        GLU   5  12.405 -19.657  -5.506
    2    HA   GLU   5           HA       GLU   5  10.742 -18.063  -3.810
    3    HB2  GLU   5           HB2      GLU   5  10.272 -20.428  -4.327
    4    HB3  GLU   5           HB3      GLU   5  11.708 -20.895  -3.413
    5    HG2  GLU   5           HG2      GLU   5  10.781 -19.875  -1.387
    6    HG3  GLU   5           HG3      GLU   5   9.362 -19.345  -2.289

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLU   6           H        GLU   6  13.864 -19.686  -3.353
    2    HA   GLU   6           HA       GLU   6  14.215 -18.836  -0.653
    3    HB2  GLU   6           HB2      GLU   6  15.418 -20.767  -1.654
    4    HB3  GLU   6           HB3      GLU   6  16.313 -19.646  -2.683
    5    HG2  GLU   6           HG2      GLU   6  17.230 -18.530  -0.697
    6    HG3  GLU   6           HG3      GLU   6  16.307 -19.606   0.350

  No H/Q in entry =           6
  In of MODEL   53
    1    H    VAL   7           H        VAL   7  15.014 -17.519  -3.798
    2    HA   VAL   7           HA       VAL   7  16.725 -15.416  -2.925
    3    HB   VAL   7           HB       VAL   7  15.026 -15.756  -5.411
    4   HG11  VAL   7          HG11      VAL   7  16.945 -13.568  -4.589
    5   HG13  VAL   7          HG12      VAL   7  15.308 -13.403  -5.220
    6   HG12  VAL   7          HG13      VAL   7  16.616 -13.923  -6.284
    7   HG21  VAL   7          HG21      VAL   7  17.111 -17.241  -4.832
    8   HG23  VAL   7          HG22      VAL   7  18.037 -15.792  -5.226
    9   HG22  VAL   7          HG23      VAL   7  16.997 -16.527  -6.442

  No H/Q in entry =           9
  In of MODEL   53
    1    H    VAL   8           H        VAL   8  13.232 -15.638  -3.499
    2    HA   VAL   8           HA       VAL   8  12.600 -12.921  -3.030
    3    HB   VAL   8           HB       VAL   8  10.953 -15.428  -2.603
    4   HG11  VAL   8          HG11      VAL   8  10.320 -12.503  -2.301
    5   HG13  VAL   8          HG12      VAL   8   9.828 -13.858  -1.284
    6   HG12  VAL   8          HG13      VAL   8   9.066 -13.613  -2.855
    7   HG22  VAL   8          HG21      VAL   8  10.364 -15.269  -4.829
    8   HG21  VAL   8          HG22      VAL   8  11.864 -14.355  -4.965
    9   HG23  VAL   8          HG23      VAL   8  10.332 -13.507  -4.789

  No H/Q in entry =           9
  In of MODEL   53
    1    H    MET   9           H        MET   9  12.819 -15.731  -0.849
    2    HA   MET   9           HA       MET   9  12.009 -14.449   1.517
    3    HB2  MET   9           HB2      MET   9  13.903 -16.742   0.996
    4    HB3  MET   9           HB3      MET   9  13.570 -16.165   2.629
    5    HG2  MET   9           HG2      MET   9  11.162 -16.550   2.289
    6    HG3  MET   9           HG3      MET   9  11.480 -17.104   0.644
    7    HE1  MET   9           HE1      MET   9  12.281 -17.263   4.181
    8    HE3  MET   9           HE2      MET   9  12.871 -18.877   4.567
    9    HE2  MET   9           HE3      MET   9  11.139 -18.593   4.414

  No H/Q in entry =           9
  In of MODEL   53
    1    H    GLY  10           H        GLY  10  15.195 -14.714  -0.024
    2    HA3  GLY  10           HA2      GLY  10  16.662 -13.312   1.954
    3    HA2  GLY  10           HA3      GLY  10  17.131 -13.483   0.263

  No H/Q in entry =           3
  In of MODEL   53
    1    H    LEU  11           H        LEU  11  14.985 -12.235  -0.987
    2    HA   LEU  11           HA       LEU  11  15.703  -9.499  -0.820
    3    HB2  LEU  11           HB2      LEU  11  13.324 -10.879  -2.067
    4    HB3  LEU  11           HB3      LEU  11  13.627  -9.148  -2.225
    5    HG   LEU  11           HG       LEU  11  15.632 -11.281  -3.003
    6   HD13  LEU  11          HD11      LEU  11  13.889 -11.626  -4.532
    7   HD12  LEU  11          HD12      LEU  11  14.910 -10.457  -5.367
    8   HD11  LEU  11          HD13      LEU  11  13.440  -9.921  -4.556
    9   HD22  LEU  11          HD21      LEU  11  16.886  -9.333  -2.771
   10   HD21  LEU  11          HD22      LEU  11  15.526  -8.279  -3.156
   11   HD23  LEU  11          HD23      LEU  11  16.353  -9.158  -4.441

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  12           H        ILE  12  12.906 -11.291   0.433
    2    HA   ILE  12           HA       ILE  12  11.534  -9.050   1.487
    3    HB   ILE  12           HB       ILE  12  11.532 -11.932   2.439
    4   HG12  ILE  12          HG12      ILE  12  10.870 -11.297  -0.016
    5   HG13  ILE  12          HG13      ILE  12   9.824 -12.372   0.892
    6   HG21  ILE  12          HG21      ILE  12   9.627  -9.633   2.984
    7   HG23  ILE  12          HG22      ILE  12  10.583 -10.522   4.168
    8   HG22  ILE  12          HG23      ILE  12   9.252 -11.320   3.332
    9   HD11  ILE  12          HD11      ILE  12   9.435  -9.376   0.660
   10   HD13  ILE  12          HD12      ILE  12   8.322 -10.534   1.385
   11   HD12  ILE  12          HD13      ILE  12   8.613 -10.561  -0.341

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  13           H        ILE  13  13.894 -11.283   2.904
    2    HA   ILE  13           HA       ILE  13  13.931 -10.105   5.484
    3    HB   ILE  13           HB       ILE  13  15.974 -11.705   3.926
    4   HG12  ILE  13          HG12      ILE  13  13.686 -12.638   4.773
    5   HG13  ILE  13          HG13      ILE  13  15.150 -13.580   5.043
    6   HG22  ILE  13          HG21      ILE  13  17.088 -12.051   6.176
    7   HG21  ILE  13          HG22      ILE  13  16.101 -10.736   6.803
    8   HG23  ILE  13          HG23      ILE  13  17.267 -10.426   5.515
    9   HD11  ILE  13          HD11      ILE  13  14.155 -11.630   7.135
   10   HD13  ILE  13          HD12      ILE  13  15.246 -12.999   7.328
   11   HD12  ILE  13          HD13      ILE  13  13.533 -13.277   7.043

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ASN  14           H        ASN  14  15.904  -9.595   2.576
    2    HA   ASN  14           HA       ASN  14  17.664  -7.672   3.647
    3    HB2  ASN  14           HB2      ASN  14  17.640  -8.938   1.331
    4    HB3  ASN  14           HB3      ASN  14  16.765  -7.512   0.789
    5   HD21  ASN  14          HD21      ASN  14  19.207  -7.876  -0.384
    6   HD22  ASN  14          HD22      ASN  14  20.358  -6.805   0.249

  No H/Q in entry =           6
  In of MODEL   53
    1    H    SER  15           H        SER  15  14.566  -7.293   1.939
    2    HA   SER  15           HA       SER  15  14.482  -4.471   1.995
    3    HB2  SER  15           HB2      SER  15  12.150  -4.694   1.488
    4    HB3  SER  15           HB3      SER  15  12.937  -6.068   0.720
    5    HG   SER  15           HG       SER  15  11.425  -7.082   1.823

  No H/Q in entry =           5
  In of MODEL   53
    1    H    GLY  16           H        GLY  16  13.352  -6.920   4.293
    2    HA3  GLY  16           HA2      GLY  16  12.139  -5.160   6.144
    3    HA2  GLY  16           HA3      GLY  16  12.736  -6.774   6.509

  No H/Q in entry =           3
  In of MODEL   53
    1    H    GLN  17           H        GLN  17  15.453  -6.468   5.931
    2    HA   GLN  17           HA       GLN  17  16.409  -5.256   8.316
    3    HB2  GLN  17           HB2      GLN  17  17.837  -6.116   5.786
    4    HB3  GLN  17           HB3      GLN  17  18.677  -5.531   7.221
    5    HG2  GLN  17           HG2      GLN  17  16.757  -7.875   7.199
    6    HG3  GLN  17           HG3      GLN  17  18.512  -8.025   7.140
    7   HE21  GLN  17          HE21      GLN  17  16.095  -8.362   9.299
    8   HE22  GLN  17          HE22      GLN  17  16.857  -7.807  10.709

  No H/Q in entry =           8
  In of MODEL   53
    1    H    ALA  18           H        ALA  18  16.248  -4.176   4.956
    2    HA   ALA  18           HA       ALA  18  17.706  -1.797   5.191
    3    HB1  ALA  18           HB1      ALA  18  16.587  -3.001   3.117
    4    HB3  ALA  18           HB2      ALA  18  16.868  -1.261   3.103
    5    HB2  ALA  18           HB3      ALA  18  15.261  -1.891   3.464

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ARG  19           H        ARG  19  14.198  -2.352   5.569
    2    HA   ARG  19           HA       ARG  19  13.551   0.304   6.280
    3    HB2  ARG  19           HB2      ARG  19  11.857  -1.432   5.685
    4    HB3  ARG  19           HB3      ARG  19  12.183  -2.233   7.223
    5    HG2  ARG  19           HG2      ARG  19  11.485  -0.236   8.459
    6    HG3  ARG  19           HG3      ARG  19  11.251   0.643   6.949
    7    HD2  ARG  19           HD2      ARG  19   9.098  -0.134   7.758
    8    HD3  ARG  19           HD3      ARG  19   9.516  -1.017   6.284
    9    HE   ARG  19           HE       ARG  19  10.449  -2.568   8.394
   10   HH21  ARG  19          HH11      ARG  19   9.180  -4.197   9.326
   11   HH22  ARG  19          HH12      ARG  19   7.461  -4.153   9.146
   12   HH11  ARG  19          HH21      ARG  19   7.473  -1.248   7.283
   13   HH12  ARG  19          HH22      ARG  19   6.495  -2.484   7.985

  No H/Q in entry =          13
  In of MODEL   53
    1    H    SER  20           H        SER  20  14.372  -2.535   8.244
    2    HA   SER  20           HA       SER  20  14.085  -1.433  10.780
    3    HB2  SER  20           HB2      SER  20  14.701  -3.852  10.106
    4    HB3  SER  20           HB3      SER  20  16.367  -3.278  10.097
    5    HG   SER  20           HG       SER  20  14.528  -3.442  12.225

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LEU  21           H        LEU  21  16.941  -1.398   8.659
    2    HA   LEU  21           HA       LEU  21  18.619   0.073  10.407
    3    HB2  LEU  21           HB2      LEU  21  18.612  -0.199   7.393
    4    HB3  LEU  21           HB3      LEU  21  19.869   0.650   8.288
    5    HG   LEU  21           HG       LEU  21  19.102  -2.235   8.818
    6   HD11  LEU  21          HD11      LEU  21  21.293  -1.065   7.082
    7   HD13  LEU  21          HD12      LEU  21  19.972  -2.112   6.564
    8   HD12  LEU  21          HD13      LEU  21  21.246  -2.751   7.602
    9   HD23  LEU  21          HD21      LEU  21  21.575  -2.097   9.741
   10   HD22  LEU  21          HD22      LEU  21  20.260  -1.493  10.743
   11   HD21  LEU  21          HD23      LEU  21  21.255  -0.368   9.833

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ALA  22           H        ALA  22  16.379   1.063   7.838
    2    HA   ALA  22           HA       ALA  22  16.943   3.816   7.856
    3    HB3  ALA  22           HB1      ALA  22  15.538   2.587   6.170
    4    HB2  ALA  22           HB2      ALA  22  14.842   4.107   6.733
    5    HB1  ALA  22           HB3      ALA  22  14.234   2.573   7.357

  No H/Q in entry =           5
  In of MODEL   53
    1    H    TYR  23           H        TYR  23  14.419   2.024   9.677
    2    HA   TYR  23           HA       TYR  23  13.469   4.269  11.121
    3    HB2  TYR  23           HB2      TYR  23  12.215   2.168  11.092
    4    HB3  TYR  23           HB3      TYR  23  13.533   1.344  11.924
    5    HD1  TYR  23           HD1      TYR  23  11.054   4.111  12.277
    6    HD2  TYR  23           HD2      TYR  23  13.718   1.403  14.282
    7    HE1  TYR  23           HE1      TYR  23  10.121   4.813  14.465
    8    HE2  TYR  23           HE2      TYR  23  12.784   2.104  16.469
    9    HH   TYR  23           HH       TYR  23  10.141   4.492  16.658

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ALA  24           H        ALA  24  16.089   1.968  11.772
    2    HA   ALA  24           HA       ALA  24  16.755   2.957  14.340
    3    HB1  ALA  24           HB1      ALA  24  18.095   1.151  14.182
    4    HB3  ALA  24           HB2      ALA  24  19.137   2.062  13.089
    5    HB2  ALA  24           HB3      ALA  24  17.836   1.067  12.440

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ALA  25           H        ALA  25  17.739   3.877  11.067
    2    HA   ALA  25           HA       ALA  25  19.700   5.792  11.723
    3    HB1  ALA  25           HB1      ALA  25  18.987   4.851   9.404
    4    HB3  ALA  25           HB2      ALA  25  19.504   6.534   9.500
    5    HB2  ALA  25           HB3      ALA  25  17.786   6.144   9.421

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LEU  26           H        LEU  26  16.189   6.056  11.343
    2    HA   LEU  26           HA       LEU  26  15.991   8.840  11.793
    3    HB2  LEU  26           HB2      LEU  26  14.122   7.623  10.855
    4    HB3  LEU  26           HB3      LEU  26  14.013   6.597  12.279
    5    HG   LEU  26           HG       LEU  26  13.419   8.560  13.656
    6   HD12  LEU  26          HD11      LEU  26  12.787  10.668  12.328
    7   HD11  LEU  26          HD12      LEU  26  13.768  10.005  11.024
    8   HD13  LEU  26          HD13      LEU  26  14.508  10.382  12.580
    9   HD21  LEU  26          HD21      LEU  26  11.755   8.265  11.137
   10   HD23  LEU  26          HD22      LEU  26  11.193   8.968  12.651
   11   HD22  LEU  26          HD23      LEU  26  11.628   7.262  12.583

  No H/Q in entry =          11
  In of MODEL   53
    1    H    LYS  27           H        LYS  27  15.842   6.061  13.985
    2    HA   LYS  27           HA       LYS  27  15.250   7.433  16.350
    3    HB2  LYS  27           HB2      LYS  27  15.254   4.957  16.085
    4    HB3  LYS  27           HB3      LYS  27  17.017   4.991  16.051
    5    HG2  LYS  27           HG2      LYS  27  17.065   5.976  18.301
    6    HG3  LYS  27           HG3      LYS  27  15.299   6.013  18.337
    7    HD2  LYS  27           HD2      LYS  27  15.248   3.546  18.099
    8    HD3  LYS  27           HD3      LYS  27  17.013   3.517  18.097
    9    HE2  LYS  27           HE2      LYS  27  17.045   4.505  20.354
   10    HE3  LYS  27           HE3      LYS  27  15.280   4.564  20.359
   11    HZ3  LYS  27           HZ1      LYS  27  16.040   2.603  21.514
   12    HZ2  LYS  27           HZ2      LYS  27  16.958   2.115  20.168
   13    HZ1  LYS  27           HZ3      LYS  27  15.261   2.138  20.079

  No H/Q in entry =          13
  In of MODEL   53
    1    H    GLN  28           H        GLN  28  18.369   6.817  14.775
    2    HA   GLN  28           HA       GLN  28  20.054   7.881  16.775
    3    HB2  GLN  28           HB2      GLN  28  20.357   7.833  13.762
    4    HB3  GLN  28           HB3      GLN  28  21.644   8.290  14.879
    5    HG2  GLN  28           HG2      GLN  28  20.193   5.628  14.925
    6    HG3  GLN  28           HG3      GLN  28  21.775   5.895  14.194
    7   HE21  GLN  28          HE21      GLN  28  20.510   4.592  16.900
    8   HE22  GLN  28          HE22      GLN  28  21.706   5.007  18.031

  No H/Q in entry =           8
  In of MODEL   53
    1    H    ALA  29           H        ALA  29  18.334   9.384  14.074
    2    HA   ALA  29           HA       ALA  29  19.362  11.993  14.333
    3    HB2  ALA  29           HB1      ALA  29  17.679  12.650  12.853
    4    HB1  ALA  29           HB2      ALA  29  16.518  11.490  13.497
    5    HB3  ALA  29           HB3      ALA  29  17.847  10.933  12.481

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LYS  30           H        LYS  30  16.558  10.426  15.838
    2    HA   LYS  30           HA       LYS  30  15.563  12.691  17.191
    3    HB2  LYS  30           HB2      LYS  30  15.412   9.751  17.893
    4    HB3  LYS  30           HB3      LYS  30  14.557  11.012  18.782
    5    HG2  LYS  30           HG2      LYS  30  13.452  11.712  16.658
    6    HG3  LYS  30           HG3      LYS  30  14.245  10.366  15.835
    7    HD2  LYS  30           HD2      LYS  30  13.145   8.772  17.357
    8    HD3  LYS  30           HD3      LYS  30  12.362  10.106  18.204
    9    HE2  LYS  30           HE2      LYS  30  11.213  10.754  16.105
   10    HE3  LYS  30           HE3      LYS  30  11.976   9.391  15.278
   11    HZ2  LYS  30           HZ1      LYS  30   9.658   9.010  16.145
   12    HZ1  LYS  30           HZ2      LYS  30  10.317   9.054  17.716
   13    HZ3  LYS  30           HZ3      LYS  30  10.817   7.863  16.608

  No H/Q in entry =          13
  In of MODEL   53
    1    H    GLN  31           H        GLN  31  18.193  10.489  17.942
    2    HA   GLN  31           HA       GLN  31  18.518  11.498  20.638
    3    HB2  GLN  31           HB2      GLN  31  20.530   9.902  19.044
    4    HB3  GLN  31           HB3      GLN  31  20.388  10.028  20.798
    5    HG2  GLN  31           HG2      GLN  31  17.867   9.107  20.015
    6    HG3  GLN  31           HG3      GLN  31  18.964   8.250  18.940
    7   HE21  GLN  31          HE21      GLN  31  17.395   7.122  21.207
    8   HE22  GLN  31          HE22      GLN  31  18.536   6.446  22.264

  No H/Q in entry =           8
  In of MODEL   53
    1    H    GLY  32           H        GLY  32  19.070  12.810  17.675
    2    HA3  GLY  32           HA2      GLY  32  20.083  14.843  17.167
    3    HA2  GLY  32           HA3      GLY  32  20.831  14.837  18.759

  No H/Q in entry =           3
  In of MODEL   53
    1    H    ASP  33           H        ASP  33  21.227  11.941  16.983
    2    HA   ASP  33           HA       ASP  33  24.063  12.581  16.533
    3    HB2  ASP  33           HB2      ASP  33  22.522   9.984  16.640
    4    HB3  ASP  33           HB3      ASP  33  24.212  10.080  16.154

  No H/Q in entry =           4
  In of MODEL   53
    1    H    PHE  34           H        PHE  34  23.609  13.911  14.650
    2    HA   PHE  34           HA       PHE  34  22.260  12.944  12.355
    3    HB2  PHE  34           HB2      PHE  34  24.416  15.052  12.597
    4    HB3  PHE  34           HB3      PHE  34  23.435  14.774  11.160
    5    HD1  PHE  34           HD1      PHE  34  23.694  16.704  14.076
    6    HD2  PHE  34           HD2      PHE  34  20.804  14.625  11.673
    7    HE1  PHE  34           HE1      PHE  34  21.889  18.124  15.014
    8    HE2  PHE  34           HE2      PHE  34  19.003  16.044  12.614
    9    HZ   PHE  34           HZ       PHE  34  19.550  17.794  14.280

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ALA  35           H        ALA  35  25.626  12.715  13.381
    2    HA   ALA  35           HA       ALA  35  26.735  11.882  10.929
    3    HB3  ALA  35           HB1      ALA  35  28.392  10.691  12.658
    4    HB2  ALA  35           HB2      ALA  35  27.535  11.726  13.799
    5    HB1  ALA  35           HB3      ALA  35  28.387  12.440  12.431

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ALA  36           H        ALA  36  25.581   9.938  13.688
    2    HA   ALA  36           HA       ALA  36  26.043   7.445  12.414
    3    HB2  ALA  36           HB1      ALA  36  25.592   6.703  14.487
    4    HB3  ALA  36           HB2      ALA  36  23.911   7.218  14.328
    5    HB1  ALA  36           HB3      ALA  36  25.121   8.335  14.957

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ALA  37           H        ALA  37  23.245   9.604  12.533
    2    HA   ALA  37           HA       ALA  37  21.375   7.857  11.346
    3    HB3  ALA  37           HB1      ALA  37  21.633  10.817  11.641
    4    HB1  ALA  37           HB2      ALA  37  20.307   9.753  12.106
    5    HB2  ALA  37           HB3      ALA  37  20.510  10.224  10.418

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LYS  38           H        LYS  38  23.511  10.294   9.880
    2    HA   LYS  38           HA       LYS  38  22.881   9.875   7.199
    3    HB2  LYS  38           HB2      LYS  38  24.700  11.411   8.655
    4    HB3  LYS  38           HB3      LYS  38  25.728  10.411   7.634
    5    HG2  LYS  38           HG2      LYS  38  24.583  11.195   5.632
    6    HG3  LYS  38           HG3      LYS  38  23.392  12.062   6.607
    7    HD2  LYS  38           HD2      LYS  38  25.001  13.643   7.369
    8    HD3  LYS  38           HD3      LYS  38  26.353  12.642   6.840
    9    HE2  LYS  38           HE2      LYS  38  26.025  14.518   5.288
   10    HE3  LYS  38           HE3      LYS  38  25.678  12.984   4.481
   11    HZ3  LYS  38           HZ1      LYS  38  23.487  13.453   4.339
   12    HZ2  LYS  38           HZ2      LYS  38  24.026  15.062   4.430
   13    HZ1  LYS  38           HZ3      LYS  38  23.436  14.284   5.819

  No H/Q in entry =          13
  In of MODEL   53
    1    H    ALA  39           H        ALA  39  25.367   8.249   9.168
    2    HA   ALA  39           HA       ALA  39  26.430   6.650   7.104
    3    HB2  ALA  39           HB1      ALA  39  26.315   5.686   9.946
    4    HB1  ALA  39           HB2      ALA  39  27.285   7.102   9.536
    5    HB3  ALA  39           HB3      ALA  39  27.625   5.548   8.774

  No H/Q in entry =           5
  In of MODEL   53
    1    H    MET  40           H        MET  40  23.798   6.061   9.387
    2    HA   MET  40           HA       MET  40  23.330   3.361   8.649
    3    HB2  MET  40           HB2      MET  40  21.529   5.424   9.933
    4    HB3  MET  40           HB3      MET  40  21.105   3.719   9.755
    5    HG2  MET  40           HG2      MET  40  23.657   4.633  11.110
    6    HG3  MET  40           HG3      MET  40  22.155   4.372  11.995
    7    HE3  MET  40           HE1      MET  40  21.552   0.745  12.166
    8    HE2  MET  40           HE2      MET  40  20.702   2.057  11.354
    9    HE1  MET  40           HE3      MET  40  21.437   2.336  12.932

  No H/Q in entry =           9
  In of MODEL   53
    1    H    MET  41           H        MET  41  21.955   6.429   7.456
    2    HA   MET  41           HA       MET  41  19.995   5.255   5.773
    3    HB2  MET  41           HB2      MET  41  21.505   7.830   5.269
    4    HB3  MET  41           HB3      MET  41  19.976   7.353   4.542
    5    HG2  MET  41           HG2      MET  41  19.214   7.171   7.089
    6    HG3  MET  41           HG3      MET  41  20.534   8.315   7.318
    7    HE2  MET  41           HE1      MET  41  20.002   9.610   3.980
    8    HE1  MET  41           HE2      MET  41  20.956  10.039   5.396
    9    HE3  MET  41           HE3      MET  41  19.697  11.132   4.826

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ASP  42           H        ASP  42  23.379   6.144   5.238
    2    HA   ASP  42           HA       ASP  42  23.481   5.670   2.481
    3    HB2  ASP  42           HB2      ASP  42  25.233   6.649   4.260
    4    HB3  ASP  42           HB3      ASP  42  25.874   5.017   4.135

  No H/Q in entry =           4
  In of MODEL   53
    1    H    GLN  43           H        GLN  43  24.169   3.507   5.204
    2    HA   GLN  43           HA       GLN  43  24.819   1.244   3.624
    3    HB2  GLN  43           HB2      GLN  43  23.783   1.436   6.462
    4    HB3  GLN  43           HB3      GLN  43  24.351  -0.058   5.710
    5    HG2  GLN  43           HG2      GLN  43  26.529   1.131   5.211
    6    HG3  GLN  43           HG3      GLN  43  25.954   2.463   6.208
    7   HE21  GLN  43          HE21      GLN  43  28.172   1.467   7.256
    8   HE22  GLN  43          HE22      GLN  43  27.880   0.387   8.530

  No H/Q in entry =           8
  In of MODEL   53
    1    H    SER  44           H        SER  44  21.767   2.408   4.993
    2    HA   SER  44           HA       SER  44  20.180   0.181   4.311
    3    HB2  SER  44           HB2      SER  44  19.757   2.713   5.456
    4    HB3  SER  44           HB3      SER  44  18.730   2.681   4.025
    5    HG   SER  44           HG       SER  44  17.618   1.748   5.742

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ARG  45           H        ARG  45  20.962   3.138   2.512
    2    HA   ARG  45           HA       ARG  45  19.444   2.669   0.199
    3    HB2  ARG  45           HB2      ARG  45  20.607   4.793   0.790
    4    HB3  ARG  45           HB3      ARG  45  22.145   4.023   0.413
    5    HG2  ARG  45           HG2      ARG  45  21.370   3.626  -1.906
    6    HG3  ARG  45           HG3      ARG  45  19.844   4.419  -1.527
    7    HD2  ARG  45           HD2      ARG  45  21.112   6.503  -0.936
    8    HD3  ARG  45           HD3      ARG  45  22.604   5.714  -1.497
    9    HE   ARG  45           HE       ARG  45  20.682   5.497  -3.543
   10   HH21  ARG  45          HH11      ARG  45  20.698   6.867  -5.305
   11   HH22  ARG  45          HH12      ARG  45  21.471   8.409  -5.196
   12   HH11  ARG  45          HH21      ARG  45  22.429   7.977  -1.906
   13   HH12  ARG  45          HH22      ARG  45  22.450   9.037  -3.269

  No H/Q in entry =          13
  In of MODEL   53
    1    H    MET  46           H        MET  46  22.795   1.759   0.963
    2    HA   MET  46           HA       MET  46  23.401   0.561  -1.518
    3    HB2  MET  46           HB2      MET  46  24.490   0.209   1.276
    4    HB3  MET  46           HB3      MET  46  25.149  -0.672  -0.105
    5    HG2  MET  46           HG2      MET  46  25.581   1.462  -1.267
    6    HG3  MET  46           HG3      MET  46  24.916   2.347   0.099
    7    HE3  MET  46           HE1      MET  46  27.743   3.179  -0.837
    8    HE2  MET  46           HE2      MET  46  28.517   3.306   0.740
    9    HE1  MET  46           HE3      MET  46  26.835   3.797   0.550

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ALA  47           H        ALA  47  21.989  -0.759   1.450
    2    HA   ALA  47           HA       ALA  47  21.909  -3.470   0.647
    3    HB2  ALA  47           HB1      ALA  47  21.525  -3.006   2.949
    4    HB3  ALA  47           HB2      ALA  47  19.984  -3.592   2.323
    5    HB1  ALA  47           HB3      ALA  47  20.232  -1.864   2.583

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LEU  48           H        LEU  48  19.588  -0.817   0.279
    2    HA   LEU  48           HA       LEU  48  17.532  -2.327  -0.982
    3    HB2  LEU  48           HB2      LEU  48  18.220   0.619  -1.093
    4    HB3  LEU  48           HB3      LEU  48  16.744  -0.074  -1.766
    5    HG   LEU  48           HG       LEU  48  17.581  -0.386   1.126
    6   HD13  LEU  48          HD11      LEU  48  17.190   1.919   0.938
    7   HD12  LEU  48          HD12      LEU  48  15.622   1.289   1.440
    8   HD11  LEU  48          HD13      LEU  48  15.906   1.708  -0.250
    9   HD22  LEU  48          HD21      LEU  48  16.034  -2.083   0.738
   10   HD21  LEU  48          HD22      LEU  48  15.177  -1.170  -0.504
   11   HD23  LEU  48          HD23      LEU  48  14.961  -0.763   1.199

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ASN  49           H        ASN  49  20.247  -0.430  -2.200
    2    HA   ASN  49           HA       ASN  49  19.607  -0.506  -4.927
    3    HB2  ASN  49           HB2      ASN  49  21.297   0.994  -4.016
    4    HB3  ASN  49           HB3      ASN  49  22.304  -0.370  -3.546
    5   HD21  ASN  49          HD21      ASN  49  20.865   1.169  -6.445
    6   HD22  ASN  49          HD22      ASN  49  22.109   0.696  -7.498

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLU  50           H        GLU  50  21.557  -2.724  -2.956
    2    HA   GLU  50           HA       GLU  50  22.247  -4.488  -5.079
    3    HB2  GLU  50           HB2      GLU  50  23.436  -4.476  -2.907
    4    HB3  GLU  50           HB3      GLU  50  21.983  -5.087  -2.117
    5    HG2  GLU  50           HG2      GLU  50  22.054  -7.121  -3.476
    6    HG3  GLU  50           HG3      GLU  50  23.441  -6.505  -4.371

  No H/Q in entry =           6
  In of MODEL   53
    1    H    ALA  51           H        ALA  51  19.582  -4.391  -2.764
    2    HA   ALA  51           HA       ALA  51  18.390  -6.850  -3.525
    3    HB3  ALA  51           HB1      ALA  51  16.797  -6.325  -1.977
    4    HB1  ALA  51           HB2      ALA  51  16.606  -4.677  -2.577
    5    HB2  ALA  51           HB3      ALA  51  17.956  -5.079  -1.515

  No H/Q in entry =           5
  In of MODEL   53
    1    H    HIS  52           H        HIS  52  17.848  -3.496  -4.563
    2    HA   HIS  52           HA       HIS  52  15.736  -3.998  -6.372
    3    HB2  HIS  52           HB2      HIS  52  16.423  -1.741  -5.561
    4    HB3  HIS  52           HB3      HIS  52  17.865  -1.855  -6.571
    5    HD1  HIS  52           HD1      HIS  52  17.511  -1.837  -9.172
    6    HD2  HIS  52           HD2      HIS  52  14.030  -1.205  -6.968
    7    HE1  HIS  52           HE1      HIS  52  15.776  -0.973 -10.804
    8    HE2  HIS  52           HE2      HIS  52  13.648  -0.583  -9.475

  No H/Q in entry =           8
  In of MODEL   53
    1    H    LEU  53           H        LEU  53  19.256  -4.045  -6.790
    2    HA   LEU  53           HA       LEU  53  19.321  -4.362  -9.590
    3    HB2  LEU  53           HB2      LEU  53  21.236  -5.146  -7.408
    4    HB3  LEU  53           HB3      LEU  53  21.555  -5.535  -9.097
    5    HG   LEU  53           HG       LEU  53  20.915  -2.719  -8.161
    6   HD11  LEU  53          HD11      LEU  53  23.562  -4.160  -8.406
    7   HD13  LEU  53          HD12      LEU  53  22.932  -3.271  -7.020
    8   HD12  LEU  53          HD13      LEU  53  23.438  -2.404  -8.466
    9   HD22  LEU  53          HD21      LEU  53  20.654  -2.767 -10.505
   10   HD21  LEU  53          HD22      LEU  53  21.921  -3.972 -10.713
   11   HD23  LEU  53          HD23      LEU  53  22.346  -2.310 -10.348

  No H/Q in entry =          11
  In of MODEL   53
    1    H    VAL  54           H        VAL  54  19.170  -6.746  -6.964
    2    HA   VAL  54           HA       VAL  54  19.274  -9.042  -8.622
    3    HB   VAL  54           HB       VAL  54  18.113  -8.605  -5.860
    4   HG12  VAL  54          HG11      VAL  54  18.408 -11.226  -5.853
    5   HG11  VAL  54          HG12      VAL  54  18.232 -11.056  -7.599
    6   HG13  VAL  54          HG13      VAL  54  16.945 -10.510  -6.526
    7   HG22  VAL  54          HG21      VAL  54  20.430  -8.420  -5.628
    8   HG21  VAL  54          HG22      VAL  54  20.761  -9.516  -6.967
    9   HG23  VAL  54          HG23      VAL  54  20.217 -10.156  -5.416

  No H/Q in entry =           9
  In of MODEL   53
    1    H    GLN  55           H        GLN  55  16.562  -7.108  -7.351
    2    HA   GLN  55           HA       GLN  55  14.527  -8.751  -8.432
    3    HB2  GLN  55           HB2      GLN  55  13.789  -7.216  -6.810
    4    HB3  GLN  55           HB3      GLN  55  14.600  -5.857  -7.583
    5    HG2  GLN  55           HG2      GLN  55  12.886  -5.514  -9.080
    6    HG3  GLN  55           HG3      GLN  55  12.546  -7.231  -9.250
    7   HE21  GLN  55          HE21      GLN  55  10.530  -7.758  -8.453
    8   HE22  GLN  55          HE22      GLN  55   9.759  -6.995  -7.148

  No H/Q in entry =           8
  In of MODEL   53
    1    H    THR  56           H        THR  56  16.302  -5.971  -9.786
    2    HA   THR  56           HA       THR  56  14.878  -5.594 -12.141
    3    HB   THR  56           HB       THR  56  17.897  -5.537 -11.957
    4    HG1  THR  56           HG1      THR  56  15.924  -3.690 -11.124
    5   HG22  THR  56          HG21      THR  56  16.179  -3.627 -13.499
    6   HG21  THR  56          HG22      THR  56  16.490  -5.229 -14.167
    7   HG23  THR  56          HG23      THR  56  17.836  -4.144 -13.813

  No H/Q in entry =           7
  In of MODEL   53
    1    H    LYS  57           H        LYS  57  17.500  -7.919 -11.517
    2    HA   LYS  57           HA       LYS  57  17.499  -9.115 -14.095
    3    HB2  LYS  57           HB2      LYS  57  19.137  -9.331 -12.029
    4    HB3  LYS  57           HB3      LYS  57  18.080 -10.662 -11.582
    5    HG2  LYS  57           HG2      LYS  57  18.444 -11.586 -13.922
    6    HG3  LYS  57           HG3      LYS  57  19.716 -10.383 -14.112
    7    HD2  LYS  57           HD2      LYS  57  19.656 -12.825 -12.397
    8    HD3  LYS  57           HD3      LYS  57  20.994 -12.128 -13.307
    9    HE2  LYS  57           HE2      LYS  57  19.852 -11.104 -10.686
   10    HE3  LYS  57           HE3      LYS  57  21.451 -11.803 -10.931
   11    HZ3  LYS  57           HZ1      LYS  57  22.228  -9.848 -11.556
   12    HZ2  LYS  57           HZ2      LYS  57  20.738  -9.149 -11.140
   13    HZ1  LYS  57           HZ3      LYS  57  21.021  -9.666 -12.732

  No H/Q in entry =          13
  In of MODEL   53
    1    H    LEU  58           H        LEU  58  15.699  -9.762 -11.126
    2    HA   LEU  58           HA       LEU  58  14.457 -12.124 -12.064
    3    HB2  LEU  58           HB2      LEU  58  13.673 -10.208  -9.873
    4    HB3  LEU  58           HB3      LEU  58  12.852 -11.738 -10.191
    5    HG   LEU  58           HG       LEU  58  15.825 -11.490  -9.625
    6   HD11  LEU  58          HD11      LEU  58  13.443 -11.882  -7.841
    7   HD13  LEU  58          HD12      LEU  58  14.905 -10.933  -7.574
    8   HD12  LEU  58          HD13      LEU  58  14.959 -12.690  -7.437
    9   HD22  LEU  58          HD21      LEU  58  15.691 -13.551 -10.652
   10   HD21  LEU  58          HD22      LEU  58  13.973 -13.743 -10.298
   11   HD23  LEU  58          HD23      LEU  58  15.174 -14.055  -9.043

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  59           H        ILE  59  13.822  -8.780 -12.751
    2    HA   ILE  59           HA       ILE  59  11.104  -9.402 -13.701
    3    HB   ILE  59           HB       ILE  59  11.924  -7.129 -12.493
    4   HG12  ILE  59          HG12      ILE  59  10.037  -6.981 -14.855
    5   HG13  ILE  59          HG13      ILE  59   9.599  -7.752 -13.352
    6   HG23  ILE  59          HG21      ILE  59  12.522  -5.410 -14.002
    7   HG22  ILE  59          HG22      ILE  59  12.037  -6.334 -15.405
    8   HG21  ILE  59          HG23      ILE  59  13.504  -6.755 -14.528
    9   HD11  ILE  59          HD11      ILE  59  10.149  -5.643 -12.137
   10   HD13  ILE  59          HD12      ILE  59   8.826  -5.450 -13.285
   11   HD12  ILE  59          HD13      ILE  59  10.442  -4.874 -13.698

  No H/Q in entry =          11
  In of MODEL   53
    1    H    GLU  60           H        GLU  60  14.321  -8.584 -14.948
    2    HA   GLU  60           HA       GLU  60  13.556  -8.178 -17.660
    3    HB2  GLU  60           HB2      GLU  60  15.738  -7.464 -16.805
    4    HB3  GLU  60           HB3      GLU  60  16.183  -9.140 -16.491
    5    HG2  GLU  60           HG2      GLU  60  15.996  -9.644 -18.903
    6    HG3  GLU  60           HG3      GLU  60  15.551  -7.969 -19.219

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLY  61           H        GLY  61  14.497 -11.067 -15.839
    2    HA3  GLY  61           HA2      GLY  61  13.948 -12.711 -18.241
    3    HA2  GLY  61           HA3      GLY  61  14.970 -13.202 -16.894

  No H/Q in entry =           3
  In of MODEL   53
    1    H    ASP  62           H        ASP  62  11.866 -11.623 -16.532
    2    HA   ASP  62           HA       ASP  62  10.909 -13.728 -14.830
    3    HB2  ASP  62           HB2      ASP  62   8.874 -12.291 -14.698
    4    HB3  ASP  62           HB3      ASP  62  10.364 -11.450 -14.280

  No H/Q in entry =           4
  In of MODEL   53
    1    H    ALA  63           H        ALA  63  10.949 -13.466 -18.183
    2    HA   ALA  63           HA       ALA  63   8.351 -14.375 -18.914
    3    HB1  ALA  63           HB1      ALA  63  10.872 -15.094 -20.403
    4    HB3  ALA  63           HB2      ALA  63  10.239 -13.449 -20.415
    5    HB2  ALA  63           HB3      ALA  63   9.265 -14.772 -21.055

  No H/Q in entry =           5
  In of MODEL   53
    1    H    GLY  64           H        GLY  64  11.335 -16.037 -18.041
    2    HA3  GLY  64           HA2      GLY  64  11.825 -18.236 -17.610
    3    HA2  GLY  64           HA3      GLY  64  10.226 -18.281 -16.879

  No H/Q in entry =           3
  In of MODEL   53
    1    H    GLU  65           H        GLU  65   8.567 -19.339 -17.931
    2    HA   GLU  65           HA       GLU  65   9.313 -21.214 -19.928
    3    HB2  GLU  65           HB2      GLU  65   6.616 -20.438 -18.827
    4    HB3  GLU  65           HB3      GLU  65   6.866 -21.760 -19.968
    5    HG2  GLU  65           HG2      GLU  65   8.380 -22.870 -18.409
    6    HG3  GLU  65           HG3      GLU  65   8.248 -21.523 -17.279

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLY  66           H        GLY  66   7.484 -21.514 -21.704
    2    HA3  GLY  66           HA2      GLY  66   8.060 -19.707 -23.781
    3    HA2  GLY  66           HA3      GLY  66   6.850 -20.974 -23.822

  No H/Q in entry =           3
  In of MODEL   53
    1    H    LYS  67           H        LYS  67   5.284 -19.970 -21.653
    2    HA   LYS  67           HA       LYS  67   3.646 -18.144 -23.114
    3    HB2  LYS  67           HB2      LYS  67   3.406 -19.372 -20.372
    4    HB3  LYS  67           HB3      LYS  67   2.171 -18.328 -21.087
    5    HG2  LYS  67           HG2      LYS  67   2.031 -19.830 -23.043
    6    HG3  LYS  67           HG3      LYS  67   3.254 -20.877 -22.328
    7    HD2  LYS  67           HD2      LYS  67   1.780 -21.365 -20.440
    8    HD3  LYS  67           HD3      LYS  67   0.567 -20.250 -21.073
    9    HE2  LYS  67           HE2      LYS  67  -0.016 -22.550 -21.692
   10    HE3  LYS  67           HE3      LYS  67   0.400 -21.624 -23.133
   11    HZ3  LYS  67           HZ1      LYS  67   2.051 -23.013 -23.560
   12    HZ2  LYS  67           HZ2      LYS  67   1.540 -23.989 -22.270
   13    HZ1  LYS  67           HZ3      LYS  67   2.720 -22.792 -22.018

  No H/Q in entry =          13
  In of MODEL   53
    1    H    MET  68           H        MET  68   2.695 -16.230 -22.268
    2    HA   MET  68           HA       MET  68   4.545 -14.209 -21.703
    3    HB2  MET  68           HB2      MET  68   1.542 -14.334 -21.619
    4    HB3  MET  68           HB3      MET  68   2.426 -12.851 -21.253
    5    HG2  MET  68           HG2      MET  68   3.540 -12.962 -23.447
    6    HG3  MET  68           HG3      MET  68   2.670 -14.452 -23.817
    7    HE2  MET  68           HE1      MET  68   1.043 -13.563 -26.037
    8    HE1  MET  68           HE2      MET  68   2.625 -12.826 -25.794
    9    HE3  MET  68           HE3      MET  68   1.233 -11.808 -26.154

  No H/Q in entry =           9
  In of MODEL   53
    1    H    LYS  69           H        LYS  69   2.307 -15.885 -19.473
    2    HA   LYS  69           HA       LYS  69   2.302 -14.331 -17.279
    3    HB2  LYS  69           HB2      LYS  69   1.198 -16.516 -17.434
    4    HB3  LYS  69           HB3      LYS  69   2.757 -17.316 -17.218
    5    HG2  LYS  69           HG2      LYS  69   3.035 -16.275 -15.028
    6    HG3  LYS  69           HG3      LYS  69   1.543 -15.360 -15.246
    7    HD2  LYS  69           HD2      LYS  69   0.266 -17.472 -15.350
    8    HD3  LYS  69           HD3      LYS  69   1.759 -18.381 -15.110
    9    HE2  LYS  69           HE2      LYS  69   0.611 -18.137 -12.967
   10    HE3  LYS  69           HE3      LYS  69   2.098 -17.191 -12.948
   11    HZ2  LYS  69           HZ1      LYS  69  -0.666 -16.298 -12.944
   12    HZ1  LYS  69           HZ2      LYS  69   0.406 -15.391 -13.898
   13    HZ3  LYS  69           HZ3      LYS  69   0.703 -15.591 -12.238

  No H/Q in entry =          13
  In of MODEL   53
    1    H    VAL  70           H        VAL  70   3.442 -14.073 -15.298
    2    HA   VAL  70           HA       VAL  70   6.358 -14.602 -15.470
    3    HB   VAL  70           HB       VAL  70   6.646 -12.512 -14.160
    4   HG13  VAL  70          HG11      VAL  70   6.163 -10.974 -16.010
    5   HG12  VAL  70          HG12      VAL  70   5.039 -12.141 -16.705
    6   HG11  VAL  70          HG13      VAL  70   6.763 -12.505 -16.648
    7   HG23  VAL  70          HG21      VAL  70   4.541 -10.969 -14.198
    8   HG22  VAL  70          HG22      VAL  70   4.615 -12.238 -12.976
    9   HG21  VAL  70          HG23      VAL  70   3.629 -12.462 -14.421

  No H/Q in entry =           9
  In of MODEL   53
    1    H    SER  71           H        SER  71   7.407 -14.614 -13.287
    2    HA   SER  71           HA       SER  71   6.289 -16.569 -11.586
    3    HB2  SER  71           HB2      SER  71   8.725 -16.049 -11.747
    4    HB3  SER  71           HB3      SER  71   8.424 -14.529 -10.908
    5    HG   SER  71           HG       SER  71   9.010 -16.637  -9.713

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LEU  72           H        LEU  72   4.906 -16.424  -9.938
    2    HA   LEU  72           HA       LEU  72   3.378 -14.095  -9.502
    3    HB2  LEU  72           HB2      LEU  72   3.632 -16.652  -7.927
    4    HB3  LEU  72           HB3      LEU  72   2.474 -15.385  -7.536
    5    HG   LEU  72           HG       LEU  72   2.640 -16.711 -10.264
    6   HD13  LEU  72          HD11      LEU  72   0.847 -18.141  -9.613
    7   HD12  LEU  72          HD12      LEU  72   0.575 -17.242  -8.122
    8   HD11  LEU  72          HD13      LEU  72   2.020 -18.237  -8.298
    9   HD21  LEU  72          HD21      LEU  72   0.804 -14.721  -8.950
   10   HD23  LEU  72          HD22      LEU  72   0.147 -15.803 -10.168
   11   HD22  LEU  72          HD23      LEU  72   1.460 -14.706 -10.582

  No H/Q in entry =          11
  In of MODEL   53
    1    H    VAL  73           H        VAL  73   6.011 -15.558  -7.716
    2    HA   VAL  73           HA       VAL  73   5.956 -14.024  -5.385
    3    HB   VAL  73           HB       VAL  73   8.124 -14.859  -4.944
    4   HG11  VAL  73          HG11      VAL  73   6.195 -16.526  -5.250
    5   HG13  VAL  73          HG12      VAL  73   7.827 -17.191  -5.297
    6   HG12  VAL  73          HG13      VAL  73   6.938 -16.928  -6.796
    7   HG23  VAL  73          HG21      VAL  73   9.313 -16.032  -6.986
    8   HG22  VAL  73          HG22      VAL  73   9.474 -14.292  -6.759
    9   HG21  VAL  73          HG23      VAL  73   8.327 -14.925  -7.939

  No H/Q in entry =           9
  In of MODEL   53
    1    H    LEU  74           H        LEU  74   6.970 -13.141  -8.556
    2    HA   LEU  74           HA       LEU  74   8.933 -11.212  -8.054
    3    HB2  LEU  74           HB2      LEU  74   8.489 -11.950 -10.294
    4    HB3  LEU  74           HB3      LEU  74   6.822 -11.383 -10.203
    5    HG   LEU  74           HG       LEU  74   7.624  -9.055  -9.984
    6   HD13  LEU  74          HD11      LEU  74   9.735  -9.255  -8.913
    7   HD12  LEU  74          HD12      LEU  74  10.126  -8.752 -10.557
    8   HD11  LEU  74          HD13      LEU  74  10.309 -10.442 -10.084
    9   HD22  LEU  74          HD21      LEU  74   7.988  -8.820 -12.240
   10   HD21  LEU  74          HD22      LEU  74   7.382 -10.459 -12.184
   11   HD23  LEU  74          HD23      LEU  74   9.105 -10.181 -12.311

  No H/Q in entry =          11
  In of MODEL   53
    1    H    VAL  75           H        VAL  75   5.443 -10.792  -8.425
    2    HA   VAL  75           HA       VAL  75   5.372  -8.034  -7.839
    3    HB   VAL  75           HB       VAL  75   3.261 -10.159  -7.468
    4   HG13  VAL  75          HG11      VAL  75   2.782  -8.251  -5.982
    5   HG12  VAL  75          HG12      VAL  75   1.706  -8.189  -7.372
    6   HG11  VAL  75          HG13      VAL  75   3.101  -7.124  -7.297
    7   HG23  VAL  75          HG21      VAL  75   3.621  -7.994  -9.567
    8   HG22  VAL  75          HG22      VAL  75   2.406  -9.271  -9.568
    9   HG21  VAL  75          HG23      VAL  75   4.109  -9.673  -9.794

  No H/Q in entry =           9
  In of MODEL   53
    1    H    GLU  76           H        GLU  76   5.078 -10.908  -5.730
    2    HA   GLU  76           HA       GLU  76   4.609  -9.542  -3.312
    3    HB2  GLU  76           HB2      GLU  76   4.403 -12.002  -3.531
    4    HB3  GLU  76           HB3      GLU  76   6.135 -12.128  -3.788
    5    HG2  GLU  76           HG2      GLU  76   5.709 -12.702  -1.487
    6    HG3  GLU  76           HG3      GLU  76   6.478 -11.126  -1.484

  No H/Q in entry =           6
  In of MODEL   53
    1    H    ALA  77           H        ALA  77   7.667 -10.481  -4.858
    2    HA   ALA  77           HA       ALA  77   9.356  -9.455  -2.833
    3    HB1  ALA  77           HB1      ALA  77  10.120 -11.012  -4.599
    4    HB2  ALA  77           HB2      ALA  77  11.130  -9.569  -4.510
    5    HB3  ALA  77           HB3      ALA  77   9.932  -9.729  -5.794

  No H/Q in entry =           5
  In of MODEL   53
    1    H    GLN  78           H        GLN  78   7.996  -8.024  -5.755
    2    HA   GLN  78           HA       GLN  78   9.374  -5.559  -5.643
    3    HB2  GLN  78           HB2      GLN  78   8.080  -6.459  -7.608
    4    HB3  GLN  78           HB3      GLN  78   6.596  -6.068  -6.742
    5    HG2  GLN  78           HG2      GLN  78   7.264  -3.704  -6.645
    6    HG3  GLN  78           HG3      GLN  78   8.760  -4.085  -7.499
    7   HE21  GLN  78          HE21      GLN  78   6.871  -2.248  -8.617
    8   HE22  GLN  78          HE22      GLN  78   6.190  -2.955 -10.000

  No H/Q in entry =           8
  In of MODEL   53
    1    H    LEU  79           H        LEU  79   6.334  -6.664  -4.230
    2    HA   LEU  79           HA       LEU  79   5.361  -4.246  -3.227
    3    HB2  LEU  79           HB2      LEU  79   4.024  -6.283  -3.179
    4    HB3  LEU  79           HB3      LEU  79   5.154  -7.034  -2.057
    5    HG   LEU  79           HG       LEU  79   4.609  -5.386  -0.334
    6   HD13  LEU  79          HD11      LEU  79   4.172  -3.367  -1.387
    7   HD12  LEU  79          HD12      LEU  79   2.538  -3.874  -0.958
    8   HD11  LEU  79          HD13      LEU  79   3.127  -4.103  -2.603
    9   HD23  LEU  79          HD21      LEU  79   2.017  -5.850  -0.259
   10   HD22  LEU  79          HD22      LEU  79   3.141  -7.202  -0.143
   11   HD21  LEU  79          HD23      LEU  79   2.340  -6.856  -1.673

  No H/Q in entry =          11
  In of MODEL   53
    1    H    HIS  80           H        HIS  80   7.508  -6.605  -1.631
    2    HA   HIS  80           HA       HIS  80   7.798  -5.066   0.740
    3    HB2  HIS  80           HB2      HIS  80   9.117  -7.445  -0.450
    4    HB3  HIS  80           HB3      HIS  80  10.030  -6.558   0.772
    5    HD1  HIS  80           HD1      HIS  80   9.518  -7.188   3.112
    6    HD2  HIS  80           HD2      HIS  80   6.307  -8.003   0.580
    7    HE1  HIS  80           HE1      HIS  80   7.724  -8.271   4.549
    8    HE2  HIS  80           HE2      HIS  80   5.761  -8.771   3.014

  No H/Q in entry =           8
  In of MODEL   53
    1    H    LEU  81           H        LEU  81   9.819  -5.365  -2.160
    2    HA   LEU  81           HA       LEU  81  11.877  -3.647  -1.268
    3    HB2  LEU  81           HB2      LEU  81  10.965  -4.430  -4.037
    4    HB3  LEU  81           HB3      LEU  81  12.395  -3.440  -3.737
    5    HG   LEU  81           HG       LEU  81  11.962  -6.156  -2.466
    6   HD12  LEU  81          HD11      LEU  81  13.782  -6.804  -4.204
    7   HD11  LEU  81          HD12      LEU  81  13.239  -5.374  -5.079
    8   HD13  LEU  81          HD13      LEU  81  12.110  -6.685  -4.748
    9   HD23  LEU  81          HD21      LEU  81  14.594  -5.872  -2.435
   10   HD22  LEU  81          HD22      LEU  81  13.613  -5.100  -1.191
   11   HD21  LEU  81          HD23      LEU  81  14.211  -4.155  -2.554

  No H/Q in entry =          11
  In of MODEL   53
    1    H    MET  82           H        MET  82   8.975  -2.977  -3.224
    2    HA   MET  82           HA       MET  82   9.550  -0.258  -3.721
    3    HB2  MET  82           HB2      MET  82   6.971  -1.821  -3.613
    4    HB3  MET  82           HB3      MET  82   6.994  -0.097  -3.978
    5    HG2  MET  82           HG2      MET  82   8.580  -2.189  -5.502
    6    HG3  MET  82           HG3      MET  82   7.023  -1.548  -6.025
    7    HE3  MET  82           HE1      MET  82   7.521   1.901  -7.194
    8    HE2  MET  82           HE2      MET  82   7.133   1.679  -5.490
    9    HE1  MET  82           HE3      MET  82   6.462   0.578  -6.689

  No H/Q in entry =           9
  In of MODEL   53
    1    H    THR  83           H        THR  83   7.722  -1.834  -1.128
    2    HA   THR  83           HA       THR  83   6.891   0.525   0.192
    3    HB   THR  83           HB       THR  83   6.724  -1.048   2.210
    4    HG1  THR  83           HG1      THR  83   7.459  -3.007   1.985
    5   HG22  THR  83          HG21      THR  83   5.062  -2.593   0.731
    6   HG21  THR  83          HG22      THR  83   5.312  -1.268  -0.400
    7   HG23  THR  83          HG23      THR  83   4.665  -0.945   1.209

  No H/Q in entry =           7
  In of MODEL   53
    1    H    SER  84           H        SER  84   9.685  -1.608   0.732
    2    HA   SER  84           HA       SER  84  10.748  -0.190   2.927
    3    HB2  SER  84           HB2      SER  84  11.991  -2.049   0.911
    4    HB3  SER  84           HB3      SER  84  12.939  -1.307   2.199
    5    HG   SER  84           HG       SER  84  10.641  -2.968   2.443

  No H/Q in entry =           5
  In of MODEL   53
    1    H    MET  85           H        MET  85  11.527   0.061  -0.556
    2    HA   MET  85           HA       MET  85  13.548   2.001  -0.291
    3    HB2  MET  85           HB2      MET  85  13.146   0.721  -2.359
    4    HB3  MET  85           HB3      MET  85  11.636   1.601  -2.600
    5    HG2  MET  85           HG2      MET  85  12.868   3.723  -2.724
    6    HG3  MET  85           HG3      MET  85  14.382   2.874  -2.430
    7    HE2  MET  85           HE1      MET  85  11.729   3.063  -6.065
    8    HE1  MET  85           HE2      MET  85  11.303   3.231  -4.364
    9    HE3  MET  85           HE3      MET  85  11.348   1.632  -5.094

  No H/Q in entry =           9
  In of MODEL   53
    1    H    LEU  86           H        LEU  86  10.067   2.380  -0.824
    2    HA   LEU  86           HA       LEU  86  10.040   5.193  -1.006
    3    HB2  LEU  86           HB2      LEU  86   8.179   3.557  -1.594
    4    HB3  LEU  86           HB3      LEU  86   7.836   3.472   0.134
    5    HG   LEU  86           HG       LEU  86   7.709   6.035   0.080
    6   HD11  LEU  86          HD11      LEU  86   8.497   5.589  -2.617
    7   HD13  LEU  86          HD12      LEU  86   8.075   7.122  -1.859
    8   HD12  LEU  86          HD13      LEU  86   6.832   6.175  -2.672
    9   HD23  LEU  86          HD21      LEU  86   5.569   4.710  -1.597
   10   HD22  LEU  86          HD22      LEU  86   5.387   5.972  -0.382
   11   HD21  LEU  86          HD23      LEU  86   5.761   4.323   0.114

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ALA  87           H        ALA  87   9.527   3.022   1.737
    2    HA   ALA  87           HA       ALA  87   8.991   4.943   3.703
    3    HB1  ALA  87           HB1      ALA  87   9.762   2.112   3.622
    4    HB3  ALA  87           HB2      ALA  87   8.640   2.939   4.700
    5    HB2  ALA  87           HB3      ALA  87  10.367   2.948   5.055

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ARG  88           H        ARG  88  12.062   3.478   2.742
    2    HA   ARG  88           HA       ARG  88  13.677   4.835   4.585
    3    HB2  ARG  88           HB2      ARG  88  14.329   2.853   3.186
    4    HB3  ARG  88           HB3      ARG  88  14.505   3.943   1.814
    5    HG2  ARG  88           HG2      ARG  88  15.982   5.238   3.770
    6    HG3  ARG  88           HG3      ARG  88  16.278   3.544   4.151
    7    HD2  ARG  88           HD2      ARG  88  17.553   3.231   2.313
    8    HD3  ARG  88           HD3      ARG  88  16.435   4.117   1.272
    9    HE   ARG  88           HE       ARG  88  18.836   5.150   2.335
   10   HH21  ARG  88          HH11      ARG  88  19.212   7.364   2.143
   11   HH22  ARG  88          HH12      ARG  88  17.876   8.453   1.991
   12   HH11  ARG  88          HH21      ARG  88  15.509   5.946   2.035
   13   HH12  ARG  88          HH22      ARG  88  15.778   7.648   1.905

  No H/Q in entry =          13
  In of MODEL   53
    1    H    GLU  89           H        GLU  89  12.737   5.745   1.256
    2    HA   GLU  89           HA       GLU  89  14.316   8.085   1.109
    3    HB2  GLU  89           HB2      GLU  89  13.171   7.059  -0.846
    4    HB3  GLU  89           HB3      GLU  89  11.629   7.620  -0.198
    5    HG2  GLU  89           HG2      GLU  89  12.363   9.948  -0.356
    6    HG3  GLU  89           HG3      GLU  89  13.963   9.436  -0.883

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LEU  90           H        LEU  90  10.973   7.619   2.217
    2    HA   LEU  90           HA       LEU  90  10.490  10.359   2.789
    3    HB2  LEU  90           HB2      LEU  90   9.256   7.802   3.809
    4    HB3  LEU  90           HB3      LEU  90   8.643   9.405   4.228
    5    HG   LEU  90           HG       LEU  90   9.068   8.519   1.362
    6   HD12  LEU  90          HD11      LEU  90   6.530   8.224   1.408
    7   HD11  LEU  90          HD12      LEU  90   6.673   8.212   3.166
    8   HD13  LEU  90          HD13      LEU  90   7.481   6.971   2.206
    9   HD22  LEU  90          HD21      LEU  90   8.805  10.831   1.286
   10   HD21  LEU  90          HD22      LEU  90   7.810  10.876   2.740
   11   HD23  LEU  90          HD23      LEU  90   7.115  10.331   1.214

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  91           H        ILE  91  11.706   7.661   4.720
    2    HA   ILE  91           HA       ILE  91  11.849   9.025   7.189
    3    HB   ILE  91           HB       ILE  91  13.379   6.666   6.075
    4   HG12  ILE  91          HG12      ILE  91  11.351   6.860   8.322
    5   HG13  ILE  91          HG13      ILE  91  10.887   6.585   6.643
    6   HG22  ILE  91          HG21      ILE  91  13.829   6.446   8.718
    7   HG21  ILE  91          HG22      ILE  91  13.777   8.206   8.617
    8   HG23  ILE  91          HG23      ILE  91  14.950   7.303   7.660
    9   HD13  ILE  91          HD11      ILE  91  11.862   4.470   6.579
   10   HD12  ILE  91          HD12      ILE  91  11.260   4.536   8.235
   11   HD11  ILE  91          HD13      ILE  91  12.967   4.827   7.908

  No H/Q in entry =          11
  In of MODEL   53
    1    H    THR  92           H        THR  92  14.080   8.826   4.451
    2    HA   THR  92           HA       THR  92  16.256  10.191   5.624
    3    HB   THR  92           HB       THR  92  15.287  10.079   2.757
    4    HG1  THR  92           HG1      THR  92  16.091   8.171   3.167
    5   HG22  THR  92          HG21      THR  92  17.867  10.735   2.479
    6   HG21  THR  92          HG22      THR  92  17.560  11.560   4.007
    7   HG23  THR  92          HG23      THR  92  16.604  11.961   2.580

  No H/Q in entry =           7
  In of MODEL   53
    1    H    GLU  93           H        GLU  93  13.395  11.382   3.877
    2    HA   GLU  93           HA       GLU  93  14.025  14.135   3.995
    3    HB2  GLU  93           HB2      GLU  93  11.303  12.797   3.992
    4    HB3  GLU  93           HB3      GLU  93  11.616  14.493   3.622
    5    HG2  GLU  93           HG2      GLU  93  12.934  12.234   2.103
    6    HG3  GLU  93           HG3      GLU  93  11.399  12.936   1.606

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LEU  94           H        LEU  94  12.241  12.002   6.195
    2    HA   LEU  94           HA       LEU  94  11.446  13.958   8.066
    3    HB2  LEU  94           HB2      LEU  94  11.981  10.996   8.344
    4    HB3  LEU  94           HB3      LEU  94  11.414  11.979   9.691
    5    HG   LEU  94           HG       LEU  94   9.947  12.050   7.053
    6   HD11  LEU  94          HD11      LEU  94   9.989   9.828   9.058
    7   HD13  LEU  94          HD12      LEU  94   9.697   9.771   7.321
    8   HD12  LEU  94          HD13      LEU  94   8.418  10.304   8.411
    9   HD23  LEU  94          HD21      LEU  94   8.023  12.475   8.641
   10   HD22  LEU  94          HD22      LEU  94   9.278  13.713   8.686
   11   HD21  LEU  94          HD23      LEU  94   9.192  12.497   9.960

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  95           H        ILE  95  14.395  11.990   7.848
    2    HA   ILE  95           HA       ILE  95  15.560  12.897  10.268
    3    HB   ILE  95           HB       ILE  95  16.801  11.812   7.728
    4   HG12  ILE  95          HG12      ILE  95  16.473  10.615  10.494
    5   HG13  ILE  95          HG13      ILE  95  15.310  10.372   9.191
    6   HG21  ILE  95          HG21      ILE  95  18.050  12.603  10.378
    7   HG23  ILE  95          HG22      ILE  95  18.529  13.124   8.761
    8   HG22  ILE  95          HG23      ILE  95  18.811  11.461   9.271
    9   HD13  ILE  95          HD11      ILE  95  16.781   9.074   7.937
   10   HD12  ILE  95          HD12      ILE  95  17.238   8.619   9.576
   11   HD11  ILE  95          HD13      ILE  95  18.212   9.786   8.683

  No H/Q in entry =          11
  In of MODEL   53
    1    H    GLU  96           H        GLU  96  15.751  14.129   6.935
    2    HA   GLU  96           HA       GLU  96  17.622  16.183   7.423
    3    HB2  GLU  96           HB2      GLU  96  16.962  15.529   5.160
    4    HB3  GLU  96           HB3      GLU  96  15.325  16.107   5.450
    5    HG2  GLU  96           HG2      GLU  96  15.922  18.229   4.912
    6    HG3  GLU  96           HG3      GLU  96  17.213  18.213   6.102

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LEU  97           H        LEU  97  14.106  16.042   7.832
    2    HA   LEU  97           HA       LEU  97  13.722  18.781   8.471
    3    HB2  LEU  97           HB2      LEU  97  12.167  16.275   9.076
    4    HB3  LEU  97           HB3      LEU  97  11.670  17.829   9.745
    5    HG   LEU  97           HG       LEU  97  12.165  17.406   6.783
    6   HD12  LEU  97          HD11      LEU  97   9.641  17.311   6.650
    7   HD11  LEU  97          HD12      LEU  97   9.621  17.112   8.400
    8   HD13  LEU  97          HD13      LEU  97  10.392  15.894   7.382
    9   HD23  LEU  97          HD21      LEU  97  10.453  19.393   6.805
   10   HD22  LEU  97          HD22      LEU  97  12.136  19.730   7.207
   11   HD21  LEU  97          HD23      LEU  97  10.938  19.576   8.490

  No H/Q in entry =          11
  In of MODEL   53
    1    H    HIS  98           H        HIS  98  14.494  15.944  10.471
    2    HA   HIS  98           HA       HIS  98  14.338  17.207  12.987
    3    HB2  HIS  98           HB2      HIS  98  16.064  14.927  11.995
    4    HB3  HIS  98           HB3      HIS  98  16.060  15.465  13.676
    5    HD1  HIS  98           HD1      HIS  98  13.855  13.865  11.071
    6    HD2  HIS  98           HD2      HIS  98  13.736  14.786  15.135
    7    HE1  HIS  98           HE1      HIS  98  11.808  12.697  12.012
    8    HE2  HIS  98           HE2      HIS  98  11.716  13.250  14.482

  No H/Q in entry =           8
  In of MODEL   53
    1    H    GLU  99           H        GLU  99  16.904  17.058  10.567
    2    HA   GLU  99           HA       GLU  99  18.898  18.363  12.107
    3    HB2  GLU  99           HB2      GLU  99  19.372  17.069  10.041
    4    HB3  GLU  99           HB3      GLU  99  18.585  18.335   9.096
    5    HG2  GLU  99           HG2      GLU  99  20.210  19.984   9.896
    6    HG3  GLU  99           HG3      GLU  99  20.967  18.771  10.923

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LYS 100           H        LYS 100  16.403  19.559   9.877
    2    HA   LYS 100           HA       LYS 100  17.236  22.286  10.025
    3    HB2  LYS 100           HB2      LYS 100  14.591  21.032   9.255
    4    HB3  LYS 100           HB3      LYS 100  14.914  22.766   9.167
    5    HG2  LYS 100           HG2      LYS 100  16.889  22.291   7.712
    6    HG3  LYS 100           HG3      LYS 100  16.452  20.580   7.727
    7    HD2  LYS 100           HD2      LYS 100  14.270  21.119   6.714
    8    HD3  LYS 100           HD3      LYS 100  14.689  22.833   6.706
    9    HE2  LYS 100           HE2      LYS 100  16.650  22.326   5.257
   10    HE3  LYS 100           HE3      LYS 100  16.162  20.627   5.221
   11    HZ1  LYS 100           HZ1      LYS 100  14.372  22.845   4.376
   12    HZ3  LYS 100           HZ2      LYS 100  14.166  21.178   4.113
   13    HZ2  LYS 100           HZ3      LYS 100  15.393  22.024   3.298

  No H/Q in entry =          13
  In of MODEL   53
    1    H    LEU 101           H        LEU 101  15.100  20.268  11.978
    2    HA   LEU 101           HA       LEU 101  13.953  22.352  13.550
    3    HB2  LEU 101           HB2      LEU 101  14.353  19.396  13.936
    4    HB3  LEU 101           HB3      LEU 101  13.822  20.384  15.294
    5    HG   LEU 101           HG       LEU 101  12.421  20.492  12.617
    6   HD12  LEU 101          HD11      LEU 101  10.733  18.951  13.876
    7   HD11  LEU 101          HD12      LEU 101  12.116  18.519  14.879
    8   HD13  LEU 101          HD13      LEU 101  12.155  18.212  13.142
    9   HD21  LEU 101          HD21      LEU 101  11.759  21.293  15.465
   10   HD23  LEU 101          HD22      LEU 101  10.502  21.085  14.248
   11   HD22  LEU 101          HD23      LEU 101  11.755  22.303  14.017

  No H/Q in entry =          11
  In of MODEL   53
    1    H    LYS 102           H        LYS 102  17.094  21.701  13.132
    2    HA   LYS 102           HA       LYS 102  18.947  22.546  14.215
    3    HB2  LYS 102           HB2      LYS 102  17.147  24.085  15.338
    4    HB3  LYS 102           HB3      LYS 102  17.332  23.020  16.716
    5    HG2  LYS 102           HG2      LYS 102  19.259  25.005  15.558
    6    HG3  LYS 102           HG3      LYS 102  18.863  24.695  17.235
    7    HD2  LYS 102           HD2      LYS 102  20.513  22.760  15.558
    8    HD3  LYS 102           HD3      LYS 102  21.215  24.072  16.495
    9    HE2  LYS 102           HE2      LYS 102  20.776  21.529  17.461
   10    HE3  LYS 102           HE3      LYS 102  21.009  22.968  18.453
   11    HZ2  LYS 102           HZ1      LYS 102  19.019  21.711  19.060
   12    HZ1  LYS 102           HZ2      LYS 102  18.387  21.951  17.507
   13    HZ3  LYS 102           HZ3      LYS 102  18.630  23.277  18.535

  No H/Q in entry =          13
  In of MODEL   53
    1    H    ALA 103           H        ALA 103  16.839  20.969  16.624
    2    HA   ALA 103           HA       ALA 103  18.540  19.734  18.289
    3    HB2  ALA 103           HB1      ALA 103  16.927  17.749  18.274
    4    HB1  ALA 103           HB2      ALA 103  16.051  18.615  17.011
    5    HB3  ALA 103           HB3      ALA 103  16.230  19.333  18.611

  No H/Q in entry =           5
  In of MODEL   53
    1    H1   ALA   1           H3       ALA   1  -1.538  -6.831 -21.451
    2    H2   ALA   1           H2       ALA   1  -2.356  -8.254 -21.003
    3    H3   ALA   1           H1       ALA   1  -0.746  -8.327 -21.549
    4    HA   ALA   1           HA       ALA   1  -1.575  -8.784 -23.550
    5    HB1  ALA   1           HB1      ALA   1  -3.725  -9.471 -23.089
    6    HB2  ALA   1           HB2      ALA   1  -4.137  -7.954 -23.889
    7    HB3  ALA   1           HB3      ALA   1  -4.088  -8.036 -22.130

  No H/Q in entry =           7
  In of MODEL   53
    1    H    GLU   2           H        GLU   2  -2.376  -7.581 -25.544
    2    HA   GLU   2           HA       GLU   2  -0.943  -5.588 -26.413
    3    HB2  GLU   2           HB2      GLU   2  -3.949  -5.611 -26.748
    4    HB3  GLU   2           HB3      GLU   2  -2.810  -4.764 -27.790
    5    HG2  GLU   2           HG2      GLU   2  -2.327  -6.661 -28.943
    6    HG3  GLU   2           HG3      GLU   2  -2.051  -7.571 -27.464

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLU   3           H        GLU   3  -4.090  -4.285 -25.530
    2    HA   GLU   3           HA       GLU   3  -3.010  -1.745 -24.895
    3    HB2  GLU   3           HB2      GLU   3  -5.719  -3.021 -24.579
    4    HB3  GLU   3           HB3      GLU   3  -5.401  -1.410 -23.930
    5    HG2  GLU   3           HG2      GLU   3  -5.019  -0.488 -26.054
    6    HG3  GLU   3           HG3      GLU   3  -4.642  -2.048 -26.777

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LEU   4           H        LEU   4  -4.648  -4.081 -22.726
    2    HA   LEU   4           HA       LEU   4  -4.280  -2.859 -20.332
    3    HB2  LEU   4           HB2      LEU   4  -3.777  -5.808 -20.799
    4    HB3  LEU   4           HB3      LEU   4  -4.181  -5.056 -19.258
    5    HG   LEU   4           HG       LEU   4  -5.940  -5.103 -21.732
    6   HD13  LEU   4          HD11      LEU   4  -7.163  -6.804 -20.742
    7   HD12  LEU   4          HD12      LEU   4  -6.682  -6.352 -19.108
    8   HD11  LEU   4          HD13      LEU   4  -5.552  -7.211 -20.153
    9   HD23  LEU   4          HD21      LEU   4  -7.623  -4.268 -19.874
   10   HD22  LEU   4          HD22      LEU   4  -6.563  -3.112 -20.678
   11   HD21  LEU   4          HD23      LEU   4  -6.155  -3.709 -19.070

  No H/Q in entry =          11
  In of MODEL   53
    1    H    GLU   5           H        GLU   5  -1.798  -4.738 -22.049
    2    HA   GLU   5           HA       GLU   5   0.177  -4.484 -20.000
    3    HB2  GLU   5           HB2      GLU   5   0.234  -6.256 -21.745
    4    HB3  GLU   5           HB3      GLU   5   0.557  -5.019 -22.960
    5    HG2  GLU   5           HG2      GLU   5   2.626  -4.391 -21.798
    6    HG3  GLU   5           HG3      GLU   5   2.303  -5.591 -20.547

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLU   6           H        GLU   6  -0.415  -2.760 -23.048
    2    HA   GLU   6           HA       GLU   6   1.780  -0.960 -22.766
    3    HB2  GLU   6           HB2      GLU   6   0.683  -1.410 -24.938
    4    HB3  GLU   6           HB3      GLU   6  -0.786  -0.636 -24.343
    5    HG2  GLU   6           HG2      GLU   6   0.418   1.475 -24.039
    6    HG3  GLU   6           HG3      GLU   6   1.920   0.714 -24.556

  No H/Q in entry =           6
  In of MODEL   53
    1    H    VAL   7           H        VAL   7  -1.565  -0.983 -21.741
    2    HA   VAL   7           HA       VAL   7  -1.752   1.732 -20.905
    3    HB   VAL   7           HB       VAL   7  -3.256  -0.765 -20.078
    4   HG11  VAL   7          HG11      VAL   7  -3.594   2.129 -19.265
    5   HG13  VAL   7          HG12      VAL   7  -3.521   0.703 -18.230
    6   HG12  VAL   7          HG13      VAL   7  -4.943   0.994 -19.231
    7   HG21  VAL   7          HG21      VAL   7  -3.383   0.315 -22.467
    8   HG23  VAL   7          HG22      VAL   7  -4.315   1.577 -21.660
    9   HG22  VAL   7          HG23      VAL   7  -4.885  -0.092 -21.638

  No H/Q in entry =           9
  In of MODEL   53
    1    H    VAL   8           H        VAL   8  -0.818  -1.268 -19.257
    2    HA   VAL   8           HA       VAL   8  -0.499  -0.194 -16.659
    3    HB   VAL   8           HB       VAL   8   0.877  -2.530 -18.009
    4   HG11  VAL   8          HG11      VAL   8   1.000  -1.437 -15.206
    5   HG13  VAL   8          HG12      VAL   8   2.313  -2.027 -16.224
    6   HG12  VAL   8          HG13      VAL   8   1.189  -3.168 -15.489
    7   HG22  VAL   8          HG21      VAL   8  -0.924  -3.813 -17.343
    8   HG21  VAL   8          HG22      VAL   8  -1.771  -2.269 -17.318
    9   HG23  VAL   8          HG23      VAL   8  -1.112  -2.933 -15.827

  No H/Q in entry =           9
  In of MODEL   53
    1    H    MET   9           H        MET   9   1.761  -0.527 -19.394
    2    HA   MET   9           HA       MET   9   4.055   0.481 -18.118
    3    HB2  MET   9           HB2      MET   9   3.128   0.551 -20.991
    4    HB3  MET   9           HB3      MET   9   4.667   1.251 -20.490
    5    HG2  MET   9           HG2      MET   9   5.364  -0.917 -19.557
    6    HG3  MET   9           HG3      MET   9   3.816  -1.623 -20.025
    7    HE1  MET   9           HE1      MET   9   6.717   0.358 -20.936
    8    HE3  MET   9           HE2      MET   9   7.051   0.142 -22.652
    9    HE2  MET   9           HE3      MET   9   7.566  -1.085 -21.499

  No H/Q in entry =           9
  In of MODEL   53
    1    H    GLY  10           H        GLY  10   1.405   2.125 -19.810
    2    HA3  GLY  10           HA2      GLY  10   2.407   4.763 -19.559
    3    HA2  GLY  10           HA3      GLY  10   0.712   4.329 -19.774

  No H/Q in entry =           3
  In of MODEL   53
    1    H    LEU  11           H        LEU  11   0.276   2.807 -17.491
    2    HA   LEU  11           HA       LEU  11  -0.234   4.791 -15.533
    3    HB2  LEU  11           HB2      LEU  11  -0.214   1.774 -15.378
    4    HB3  LEU  11           HB3      LEU  11  -0.715   2.804 -14.038
    5    HG   LEU  11           HG       LEU  11  -1.936   2.939 -16.808
    6   HD13  LEU  11          HD11      LEU  11  -2.558   0.805 -16.058
    7   HD12  LEU  11          HD12      LEU  11  -3.896   1.817 -15.519
    8   HD11  LEU  11          HD13      LEU  11  -2.654   1.317 -14.372
    9   HD22  LEU  11          HD21      LEU  11  -2.501   4.963 -15.803
   10   HD21  LEU  11          HD22      LEU  11  -2.446   4.295 -14.172
   11   HD23  LEU  11          HD23      LEU  11  -3.821   3.951 -15.222

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  12           H        ILE  12   2.271   2.285 -15.763
    2    HA   ILE  12           HA       ILE  12   3.471   2.802 -13.252
    3    HB   ILE  12           HB       ILE  12   4.723   1.744 -15.809
    4   HG12  ILE  12          HG12      ILE  12   2.684   0.544 -14.677
    5   HG13  ILE  12          HG13      ILE  12   4.072  -0.414 -15.155
    6   HG21  ILE  12          HG21      ILE  12   5.680   1.678 -12.928
    7   HG23  ILE  12          HG22      ILE  12   6.480   2.449 -14.298
    8   HG22  ILE  12          HG23      ILE  12   6.371   0.692 -14.215
    9   HD11  ILE  12          HD11      ILE  12   3.607   0.696 -12.375
   10   HD13  ILE  12          HD12      ILE  12   4.883  -0.418 -12.865
   11   HD12  ILE  12          HD13      ILE  12   3.212  -0.940 -12.870

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  13           H        ILE  13   4.110   4.058 -16.505
    2    HA   ILE  13           HA       ILE  13   6.271   5.743 -15.768
    3    HB   ILE  13           HB       ILE  13   4.255   5.846 -18.026
    4   HG12  ILE  13          HG12      ILE  13   6.076   3.995 -17.740
    5   HG13  ILE  13          HG13      ILE  13   5.853   4.745 -19.316
    6   HG22  ILE  13          HG21      ILE  13   5.895   7.448 -19.111
    7   HG21  ILE  13          HG22      ILE  13   6.669   7.625 -17.541
    8   HG23  ILE  13          HG23      ILE  13   4.993   8.127 -17.754
    9   HD11  ILE  13          HD11      ILE  13   7.894   5.803 -17.341
   10   HD13  ILE  13          HD12      ILE  13   7.793   6.087 -19.075
   11   HD12  ILE  13          HD13      ILE  13   8.272   4.505 -18.471

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ASN  14           H        ASN  14   2.773   6.294 -16.054
    2    HA   ASN  14           HA       ASN  14   2.771   9.039 -15.415
    3    HB2  ASN  14           HB2      ASN  14   0.856   7.428 -16.257
    4    HB3  ASN  14           HB3      ASN  14   0.524   7.254 -14.538
    5   HD21  ASN  14          HD21      ASN  14  -1.470   8.443 -15.980
    6   HD22  ASN  14          HD22      ASN  14  -1.507  10.117 -15.712

  No H/Q in entry =           6
  In of MODEL   53
    1    H    SER  15           H        SER  15   2.420   6.167 -13.342
    2    HA   SER  15           HA       SER  15   2.122   7.540 -10.894
    3    HB2  SER  15           HB2      SER  15   2.639   5.445  -9.844
    4    HB3  SER  15           HB3      SER  15   1.802   5.042 -11.339
    5    HG   SER  15           HG       SER  15   3.538   3.840 -11.570

  No H/Q in entry =           5
  In of MODEL   53
    1    H    GLY  16           H        GLY  16   4.989   6.400 -12.640
    2    HA3  GLY  16           HA2      GLY  16   6.916   7.125 -10.698
    3    HA2  GLY  16           HA3      GLY  16   7.225   6.919 -12.421

  No H/Q in entry =           3
  In of MODEL   53
    1    H    GLN  17           H        GLN  17   5.571   8.903 -13.491
    2    HA   GLN  17           HA       GLN  17   7.182  11.220 -13.173
    3    HB2  GLN  17           HB2      GLN  17   4.431  10.836 -14.387
    4    HB3  GLN  17           HB3      GLN  17   5.318  12.359 -14.456
    5    HG2  GLN  17           HG2      GLN  17   6.371   9.714 -15.494
    6    HG3  GLN  17           HG3      GLN  17   5.644  10.965 -16.500
    7   HE21  GLN  17          HE21      GLN  17   8.609   9.815 -15.731
    8   HE22  GLN  17          HE22      GLN  17   9.515  11.250 -15.793

  No H/Q in entry =           8
  In of MODEL   53
    1    H    ALA  18           H        ALA  18   4.060  10.248 -11.841
    2    HA   ALA  18           HA       ALA  18   3.364  12.646 -10.577
    3    HB1  ALA  18           HB1      ALA  18   2.200  10.207 -10.807
    4    HB2  ALA  18           HB2      ALA  18   1.663  11.434  -9.662
    5    HB3  ALA  18           HB3      ALA  18   2.732  10.136  -9.127

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ARG  19           H        ARG  19   5.190   9.856  -9.290
    2    HA   ARG  19           HA       ARG  19   5.727  11.004  -6.765
    3    HB2  ARG  19           HB2      ARG  19   6.109   8.596  -7.291
    4    HB3  ARG  19           HB3      ARG  19   7.477   9.063  -8.305
    5    HG2  ARG  19           HG2      ARG  19   8.601  10.085  -6.376
    6    HG3  ARG  19           HG3      ARG  19   7.215   9.717  -5.352
    7    HD2  ARG  19           HD2      ARG  19   8.951   8.056  -4.986
    8    HD3  ARG  19           HD3      ARG  19   7.570   7.294  -5.779
    9    HE   ARG  19           HE       ARG  19   9.297   8.089  -7.817
   10   HH21  ARG  19          HH11      ARG  19  10.841   6.663  -8.660
   11   HH22  ARG  19          HH12      ARG  19  11.363   5.306  -7.723
   12   HH11  ARG  19          HH21      ARG  19   9.325   6.057  -5.039
   13   HH12  ARG  19          HH22      ARG  19  10.501   4.963  -5.671

  No H/Q in entry =          13
  In of MODEL   53
    1    H    SER  20           H        SER  20   7.560  11.010  -9.804
    2    HA   SER  20           HA       SER  20   9.820  12.393  -8.968
    3    HB2  SER  20           HB2      SER  20   9.290  11.373 -11.282
    4    HB3  SER  20           HB3      SER  20   8.536  12.922 -11.637
    5    HG   SER  20           HG       SER  20  11.224  12.316 -11.055

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LEU  21           H        LEU  21   6.745  13.706 -10.180
    2    HA   LEU  21           HA       LEU  21   7.452  16.442  -9.951
    3    HB2  LEU  21           HB2      LEU  21   4.764  15.055  -9.885
    4    HB3  LEU  21           HB3      LEU  21   4.956  16.807  -9.889
    5    HG   LEU  21           HG       LEU  21   6.133  14.991 -12.014
    6   HD11  LEU  21          HD11      LEU  21   3.525  16.540 -11.963
    7   HD13  LEU  21          HD12      LEU  21   3.724  14.794 -12.129
    8   HD12  LEU  21          HD13      LEU  21   4.242  15.867 -13.429
    9   HD23  LEU  21          HD21      LEU  21   5.946  17.333 -13.245
   10   HD22  LEU  21          HD22      LEU  21   7.316  17.028 -12.179
   11   HD21  LEU  21          HD23      LEU  21   5.957  17.981 -11.607

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ALA  22           H        ALA  22   5.898  14.172  -7.712
    2    HA   ALA  22           HA       ALA  22   5.308  15.986  -5.647
    3    HB3  ALA  22           HB1      ALA  22   4.516  13.604  -5.815
    4    HB2  ALA  22           HB2      ALA  22   5.102  14.068  -4.217
    5    HB1  ALA  22           HB3      ALA  22   6.119  13.096  -5.284

  No H/Q in entry =           5
  In of MODEL   53
    1    H    TYR  23           H        TYR  23   8.217  13.923  -6.071
    2    HA   TYR  23           HA       TYR  23   9.602  14.923  -3.811
    3    HB2  TYR  23           HB2      TYR  23  10.369  12.906  -4.966
    4    HB3  TYR  23           HB3      TYR  23  10.701  13.840  -6.423
    5    HD1  TYR  23           HD1      TYR  23  11.641  13.498  -2.825
    6    HD2  TYR  23           HD2      TYR  23  12.755  14.978  -6.701
    7    HE1  TYR  23           HE1      TYR  23  13.901  14.046  -1.966
    8    HE2  TYR  23           HE2      TYR  23  15.015  15.528  -5.841
    9    HH   TYR  23           HH       TYR  23  15.920  14.815  -2.464

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ALA  24           H        ALA  24   9.450  16.034  -7.178
    2    HA   ALA  24           HA       ALA  24  11.371  18.095  -6.920
    3    HB2  ALA  24           HB1      ALA  24  10.940  18.164  -9.131
    4    HB3  ALA  24           HB2      ALA  24   9.393  18.932  -8.780
    5    HB1  ALA  24           HB3      ALA  24   9.497  17.178  -8.910

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ALA  25           H        ALA  25   7.887  17.953  -6.318
    2    HA   ALA  25           HA       ALA  25   7.436  20.676  -5.750
    3    HB1  ALA  25           HB1      ALA  25   5.752  18.698  -5.960
    4    HB2  ALA  25           HB2      ALA  25   5.394  19.990  -4.813
    5    HB3  ALA  25           HB3      ALA  25   6.063  18.461  -4.239

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LEU  26           H        LEU  26   8.462  17.983  -3.695
    2    HA   LEU  26           HA       LEU  26   8.571  19.412  -1.257
    3    HB2  LEU  26           HB2      LEU  26   8.638  16.995  -1.252
    4    HB3  LEU  26           HB3      LEU  26  10.114  16.986  -2.215
    5    HG   LEU  26           HG       LEU  26  11.332  18.089  -0.368
    6   HD12  LEU  26          HD11      LEU  26  10.094  18.110   1.885
    7   HD11  LEU  26          HD12      LEU  26   8.610  17.990   0.943
    8   HD13  LEU  26          HD13      LEU  26   9.672  19.383   0.740
    9   HD21  LEU  26          HD21      LEU  26   9.765  15.638   0.496
   10   HD23  LEU  26          HD22      LEU  26  11.284  16.183   1.201
   11   HD22  LEU  26          HD23      LEU  26  11.241  15.625  -0.469

  No H/Q in entry =          11
  In of MODEL   53
    1    H    LYS  27           H        LYS  27  10.994  18.813  -3.770
    2    HA   LYS  27           HA       LYS  27  13.186  20.029  -2.530
    3    HB2  LYS  27           HB2      LYS  27  13.283  18.681  -4.620
    4    HB3  LYS  27           HB3      LYS  27  12.537  20.022  -5.489
    5    HG2  LYS  27           HG2      LYS  27  14.416  21.486  -4.901
    6    HG3  LYS  27           HG3      LYS  27  15.157  20.186  -3.961
    7    HD2  LYS  27           HD2      LYS  27  15.296  18.797  -6.015
    8    HD3  LYS  27           HD3      LYS  27  14.600  20.123  -6.946
    9    HE2  LYS  27           HE2      LYS  27  16.500  21.568  -6.324
   10    HE3  LYS  27           HE3      LYS  27  17.200  20.246  -5.383
   11    HZ3  LYS  27           HZ1      LYS  27  18.202  20.336  -7.564
   12    HZ2  LYS  27           HZ2      LYS  27  16.678  20.234  -8.313
   13    HZ1  LYS  27           HZ3      LYS  27  17.282  18.917  -7.426

  No H/Q in entry =          13
  In of MODEL   53
    1    H    GLN  28           H        GLN  28  10.589  21.439  -4.492
    2    HA   GLN  28           HA       GLN  28  11.577  24.081  -4.639
    3    HB2  GLN  28           HB2      GLN  28   8.733  23.038  -4.545
    4    HB3  GLN  28           HB3      GLN  28   9.162  24.709  -4.911
    5    HG2  GLN  28           HG2      GLN  28  10.143  22.292  -6.459
    6    HG3  GLN  28           HG3      GLN  28   8.824  23.346  -6.968
    7   HE21  GLN  28          HE21      GLN  28  11.958  22.816  -7.687
    8   HE22  GLN  28          HE22      GLN  28  12.467  24.396  -8.043

  No H/Q in entry =           8
  In of MODEL   53
    1    H    ALA  29           H        ALA  29   9.615  22.409  -2.213
    2    HA   ALA  29           HA       ALA  29   9.080  24.607  -0.534
    3    HB2  ALA  29           HB1      ALA  29   8.327  23.045   1.030
    4    HB1  ALA  29           HB2      ALA  29   9.538  21.849   0.571
    5    HB3  ALA  29           HB3      ALA  29   8.161  22.157  -0.484

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LYS  30           H        LYS  30  11.787  22.311  -0.590
    2    HA   LYS  30           HA       LYS  30  13.103  23.251   1.720
    3    HB2  LYS  30           HB2      LYS  30  14.199  21.954  -0.785
    4    HB3  LYS  30           HB3      LYS  30  15.178  22.303   0.641
    5    HG2  LYS  30           HG2      LYS  30  13.603  20.935   2.013
    6    HG3  LYS  30           HG3      LYS  30  12.721  20.523   0.538
    7    HD2  LYS  30           HD2      LYS  30  14.761  19.516  -0.413
    8    HD3  LYS  30           HD3      LYS  30  15.662  19.942   1.044
    9    HE2  LYS  30           HE2      LYS  30  14.136  18.526   2.390
   10    HE3  LYS  30           HE3      LYS  30  13.264  18.080   0.918
   11    HZ2  LYS  30           HZ1      LYS  30  15.036  16.483   1.687
   12    HZ1  LYS  30           HZ2      LYS  30  16.187  17.658   1.242
   13    HZ3  LYS  30           HZ3      LYS  30  15.150  16.985   0.072

  No H/Q in entry =          13
  In of MODEL   53
    1    H    GLN  31           H        GLN  31  13.023  24.457  -1.577
    2    HA   GLN  31           HA       GLN  31  15.193  26.328  -1.144
    3    HB2  GLN  31           HB2      GLN  31  13.162  26.396  -3.379
    4    HB3  GLN  31           HB3      GLN  31  14.789  27.075  -3.372
    5    HG2  GLN  31           HG2      GLN  31  15.221  24.375  -2.795
    6    HG3  GLN  31           HG3      GLN  31  13.922  24.334  -3.980
    7   HE21  GLN  31          HE21      GLN  31  16.759  23.512  -4.370
    8   HE22  GLN  31          HE22      GLN  31  17.348  24.479  -5.633

  No H/Q in entry =           8
  In of MODEL   53
    1    H    GLY  32           H        GLY  32  12.111  26.177  -0.014
    2    HA3  GLY  32           HA2      GLY  32  10.965  27.757   1.254
    3    HA2  GLY  32           HA3      GLY  32  12.106  28.981   0.709

  No H/Q in entry =           3
  In of MODEL   53
    1    H    ASP  33           H        ASP  33  10.734  27.091  -1.790
    2    HA   ASP  33           HA       ASP  33   9.098  29.381  -2.653
    3    HB2  ASP  33           HB2      ASP  33  10.173  26.951  -4.091
    4    HB3  ASP  33           HB3      ASP  33   9.037  28.079  -4.827

  No H/Q in entry =           4
  In of MODEL   53
    1    H    PHE  34           H        PHE  34   7.397  28.923  -1.098
    2    HA   PHE  34           HA       PHE  34   5.992  26.465  -1.010
    3    HB2  PHE  34           HB2      PHE  34   5.056  29.261  -0.334
    4    HB3  PHE  34           HB3      PHE  34   4.190  27.779   0.072
    5    HD1  PHE  34           HD1      PHE  34   6.458  30.154   1.299
    6    HD2  PHE  34           HD2      PHE  34   5.735  25.921   1.241
    7    HE1  PHE  34           HE1      PHE  34   7.836  29.889   3.342
    8    HE2  PHE  34           HE2      PHE  34   7.115  25.659   3.282
    9    HZ   PHE  34           HZ       PHE  34   8.160  27.645   4.332

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ALA  35           H        ALA  35   5.600  29.333  -3.022
    2    HA   ALA  35           HA       ALA  35   3.048  28.745  -4.060
    3    HB3  ALA  35           HB1      ALA  35   4.124  30.127  -6.092
    4    HB2  ALA  35           HB2      ALA  35   5.339  30.476  -4.862
    5    HB1  ALA  35           HB3      ALA  35   3.652  30.902  -4.580

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ALA  36           H        ALA  36   6.276  28.039  -5.399
    2    HA   ALA  36           HA       ALA  36   5.284  26.621  -7.647
    3    HB3  ALA  36           HB1      ALA  36   7.447  26.724  -8.252
    4    HB2  ALA  36           HB2      ALA  36   7.911  25.690  -6.900
    5    HB1  ALA  36           HB3      ALA  36   7.823  27.438  -6.685

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ALA  37           H        ALA  37   6.214  25.616  -4.388
    2    HA   ALA  37           HA       ALA  37   6.129  22.829  -4.818
    3    HB2  ALA  37           HB1      ALA  37   5.874  24.622  -2.441
    4    HB1  ALA  37           HB2      ALA  37   6.996  23.293  -2.728
    5    HB3  ALA  37           HB3      ALA  37   5.328  22.956  -2.265

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LYS  38           H        LYS  38   3.613  25.062  -3.662
    2    HA   LYS  38           HA       LYS  38   1.494  23.270  -3.450
    3    HB2  LYS  38           HB2      LYS  38   1.872  26.022  -3.197
    4    HB3  LYS  38           HB3      LYS  38   0.678  25.888  -4.482
    5    HG2  LYS  38           HG2      LYS  38  -0.792  24.579  -3.047
    6    HG3  LYS  38           HG3      LYS  38   0.445  24.506  -1.784
    7    HD2  LYS  38           HD2      LYS  38   0.281  26.844  -1.337
    8    HD3  LYS  38           HD3      LYS  38  -0.621  27.142  -2.824
    9    HE2  LYS  38           HE2      LYS  38  -2.134  27.191  -0.892
   10    HE3  LYS  38           HE3      LYS  38  -2.516  25.819  -1.936
   11    HZ3  LYS  38           HZ1      LYS  38  -1.813  24.341  -0.400
   12    HZ2  LYS  38           HZ2      LYS  38  -2.157  25.601   0.688
   13    HZ1  LYS  38           HZ3      LYS  38  -0.562  25.334   0.171

  No H/Q in entry =          13
  In of MODEL   53
    1    H    ALA  39           H        ALA  39   2.507  25.163  -6.294
    2    HA   ALA  39           HA       ALA  39   0.431  24.317  -8.007
    3    HB2  ALA  39           HB1      ALA  39   3.179  24.938  -9.047
    4    HB1  ALA  39           HB2      ALA  39   2.221  26.209  -8.286
    5    HB3  ALA  39           HB3      ALA  39   1.607  25.378  -9.716

  No H/Q in entry =           5
  In of MODEL   53
    1    H    MET  40           H        MET  40   3.653  22.986  -7.412
    2    HA   MET  40           HA       MET  40   3.545  20.967  -9.404
    3    HB2  MET  40           HB2      MET  40   5.146  21.174  -6.848
    4    HB3  MET  40           HB3      MET  40   5.390  19.916  -8.061
    5    HG2  MET  40           HG2      MET  40   5.480  22.872  -8.726
    6    HG3  MET  40           HG3      MET  40   6.915  21.954  -8.269
    7    HE3  MET  40           HE1      MET  40   7.779  19.731 -11.074
    8    HE2  MET  40           HE2      MET  40   7.205  19.417  -9.440
    9    HE1  MET  40           HE3      MET  40   8.315  20.754  -9.734

  No H/Q in entry =           9
  In of MODEL   53
    1    H    MET  41           H        MET  41   2.614  21.018  -5.985
    2    HA   MET  41           HA       MET  41   2.052  18.258  -5.711
    3    HB2  MET  41           HB2      MET  41   0.736  20.629  -4.366
    4    HB3  MET  41           HB3      MET  41   0.562  18.952  -3.859
    5    HG2  MET  41           HG2      MET  41   3.274  19.149  -3.883
    6    HG3  MET  41           HG3      MET  41   2.848  20.811  -3.489
    7    HE2  MET  41           HE1      MET  41  -0.212  19.588  -1.779
    8    HE1  MET  41           HE2      MET  41   0.621  21.093  -2.151
    9    HE3  MET  41           HE3      MET  41   0.548  20.522  -0.484

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ASP  42           H        ASP  42   0.046  21.003  -6.694
    2    HA   ASP  42           HA       ASP  42  -2.407  19.666  -6.843
    3    HB2  ASP  42           HB2      ASP  42  -1.675  22.229  -7.095
    4    HB3  ASP  42           HB3      ASP  42  -1.821  21.836  -8.805

  No H/Q in entry =           4
  In of MODEL   53
    1    H    GLN  43           H        GLN  43   0.051  20.234  -9.333
    2    HA   GLN  43           HA       GLN  43  -1.338  18.928 -11.429
    3    HB2  GLN  43           HB2      GLN  43   1.623  19.416 -11.033
    4    HB3  GLN  43           HB3      GLN  43   0.911  18.783 -12.519
    5    HG2  GLN  43           HG2      GLN  43  -0.581  20.825 -12.567
    6    HG3  GLN  43           HG3      GLN  43   0.371  21.471 -11.234
    7   HE21  GLN  43          HE21      GLN  43   0.558  23.091 -13.319
    8   HE22  GLN  43          HE22      GLN  43   1.976  22.856 -14.220

  No H/Q in entry =           8
  In of MODEL   53
    1    H    SER  44           H        SER  44   0.990  17.765  -9.027
    2    HA   SER  44           HA       SER  44   1.305  15.156 -10.052
    3    HB2  SER  44           HB2      SER  44   2.203  16.586  -7.810
    4    HB3  SER  44           HB3      SER  44   1.324  15.210  -7.144
    5    HG   SER  44           HG       SER  44   3.431  14.571  -7.560

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ARG  45           H        ARG  45  -1.014  16.495  -7.725
    2    HA   ARG  45           HA       ARG  45  -2.425  14.147  -7.097
    3    HB2  ARG  45           HB2      ARG  45  -2.609  16.317  -5.906
    4    HB3  ARG  45           HB3      ARG  45  -3.452  16.992  -7.297
    5    HG2  ARG  45           HG2      ARG  45  -5.236  15.282  -7.023
    6    HG3  ARG  45           HG3      ARG  45  -4.404  14.662  -5.596
    7    HD2  ARG  45           HD2      ARG  45  -4.595  16.931  -4.540
    8    HD3  ARG  45           HD3      ARG  45  -5.570  17.460  -5.928
    9    HE   ARG  45           HE       ARG  45  -6.707  15.094  -4.894
   10   HH21  ARG  45          HH11      ARG  45  -8.549  15.185  -3.632
   11   HH22  ARG  45          HH12      ARG  45  -8.935  16.628  -2.765
   12   HH11  ARG  45          HH21      ARG  45  -6.137  18.335  -3.866
   13   HH12  ARG  45          HH22      ARG  45  -7.564  18.412  -2.896

  No H/Q in entry =          13
  In of MODEL   53
    1    H    MET  46           H        MET  46  -2.975  16.557  -9.650
    2    HA   MET  46           HA       MET  46  -5.319  15.406 -10.724
    3    HB2  MET  46           HB2      MET  46  -3.193  17.207 -11.899
    4    HB3  MET  46           HB3      MET  46  -4.590  16.674 -12.839
    5    HG2  MET  46           HG2      MET  46  -6.104  17.617 -11.148
    6    HG3  MET  46           HG3      MET  46  -4.727  18.125 -10.179
    7    HE3  MET  46           HE1      MET  46  -6.822  20.311 -10.845
    8    HE2  MET  46           HE2      MET  46  -5.715  21.606 -11.291
    9    HE1  MET  46           HE3      MET  46  -5.288  20.502  -9.984

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ALA  47           H        ALA  47  -1.891  14.897 -11.465
    2    HA   ALA  47           HA       ALA  47  -2.240  13.173 -13.677
    3    HB3  ALA  47           HB1      ALA  47  -0.057  14.043 -13.314
    4    HB2  ALA  47           HB2      ALA  47   0.068  12.314 -12.980
    5    HB1  ALA  47           HB3      ALA  47  -0.022  13.466 -11.647

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LEU  48           H        LEU  48  -1.994  12.534 -10.202
    2    HA   LEU  48           HA       LEU  48  -2.112   9.695 -10.362
    3    HB2  LEU  48           HB2      LEU  48  -2.870  11.619  -8.152
    4    HB3  LEU  48           HB3      LEU  48  -2.793   9.868  -7.951
    5    HG   LEU  48           HG       LEU  48  -0.474  11.548  -8.936
    6   HD13  LEU  48          HD11      LEU  48  -0.761  12.320  -6.747
    7   HD12  LEU  48          HD12      LEU  48   0.390  11.002  -6.542
    8   HD11  LEU  48          HD13      LEU  48  -1.313  10.754  -6.153
    9   HD22  LEU  48          HD21      LEU  48   0.009   9.358  -9.575
   10   HD21  LEU  48          HD22      LEU  48  -0.874   8.650  -8.223
   11   HD23  LEU  48          HD23      LEU  48   0.704   9.390  -7.955

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ASN  49           H        ASN  49  -4.555  12.209  -9.972
    2    HA   ASN  49           HA       ASN  49  -6.758  10.563  -9.444
    3    HB2  ASN  49           HB2      ASN  49  -6.813  12.978  -9.113
    4    HB3  ASN  49           HB3      ASN  49  -6.609  13.251 -10.839
    5   HD21  ASN  49          HD21      ASN  49  -8.864  11.770  -8.483
    6   HD22  ASN  49          HD22      ASN  49 -10.253  12.026  -9.422

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLU  50           H        GLU  50  -5.452  11.749 -12.525
    2    HA   GLU  50           HA       GLU  50  -7.409  10.511 -14.181
    3    HB2  GLU  50           HB2      GLU  50  -5.923  12.317 -14.987
    4    HB3  GLU  50           HB3      GLU  50  -4.539  11.233 -14.842
    5    HG2  GLU  50           HG2      GLU  50  -5.517   9.706 -16.484
    6    HG3  GLU  50           HG3      GLU  50  -6.969  10.697 -16.579

  No H/Q in entry =           6
  In of MODEL   53
    1    H    ALA  51           H        ALA  51  -4.253   9.491 -12.959
    2    HA   ALA  51           HA       ALA  51  -4.127   7.037 -14.377
    3    HB2  ALA  51           HB1      ALA  51  -2.155   6.732 -13.267
    4    HB1  ALA  51           HB2      ALA  51  -2.847   7.160 -11.703
    5    HB3  ALA  51           HB3      ALA  51  -2.375   8.427 -12.834

  No H/Q in entry =           5
  In of MODEL   53
    1    H    HIS  52           H        HIS  52  -5.310   7.879 -11.134
    2    HA   HIS  52           HA       HIS  52  -6.023   5.275 -10.307
    3    HB2  HIS  52           HB2      HIS  52  -5.873   7.266  -8.813
    4    HB3  HIS  52           HB3      HIS  52  -7.354   7.883  -9.546
    5    HD1  HIS  52           HD1      HIS  52  -9.565   6.553  -9.082
    6    HD2  HIS  52           HD2      HIS  52  -6.248   5.129  -6.999
    7    HE1  HIS  52           HE1      HIS  52 -10.456   4.990  -7.299
    8    HE2  HIS  52           HE2      HIS  52  -8.444   4.114  -6.019

  No H/Q in entry =           8
  In of MODEL   53
    1    H    LEU  53           H        LEU  53  -7.812   7.749 -12.104
    2    HA   LEU  53           HA       LEU  53 -10.328   6.479 -12.130
    3    HB2  LEU  53           HB2      LEU  53  -9.016   8.450 -13.992
    4    HB3  LEU  53           HB3      LEU  53 -10.618   7.798 -14.325
    5    HG   LEU  53           HG       LEU  53  -9.908   9.108 -11.680
    6   HD11  LEU  53          HD11      LEU  53 -11.009  10.305 -14.231
    7   HD13  LEU  53          HD12      LEU  53  -9.601  10.830 -13.307
    8   HD12  LEU  53          HD13      LEU  53 -11.222  11.067 -12.660
    9   HD22  LEU  53          HD21      LEU  53 -11.921   7.934 -11.356
   10   HD21  LEU  53          HD22      LEU  53 -12.439   8.178 -13.019
   11   HD23  LEU  53          HD23      LEU  53 -12.523   9.503 -11.874

  No H/Q in entry =          11
  In of MODEL   53
    1    H    VAL  54           H        VAL  54  -7.568   6.257 -14.352
    2    HA   VAL  54           HA       VAL  54  -8.796   4.498 -16.203
    3    HB   VAL  54           HB       VAL  54  -5.888   4.978 -15.504
    4   HG12  VAL  54          HG11      VAL  54  -5.638   3.891 -17.892
    5   HG11  VAL  54          HG12      VAL  54  -7.176   3.124 -17.497
    6   HG13  VAL  54          HG13      VAL  54  -5.768   2.856 -16.471
    7   HG22  VAL  54          HG21      VAL  54  -6.634   6.928 -16.553
    8   HG21  VAL  54          HG22      VAL  54  -7.830   6.076 -17.528
    9   HG23  VAL  54          HG23      VAL  54  -6.122   5.980 -17.949

  No H/Q in entry =           9
  In of MODEL   53
    1    H    GLN  55           H        GLN  55  -6.819   3.933 -13.292
    2    HA   GLN  55           HA       GLN  55  -6.754   1.115 -13.549
    3    HB2  GLN  55           HB2      GLN  55  -5.198   1.997 -12.021
    4    HB3  GLN  55           HB3      GLN  55  -6.410   2.974 -11.198
    5    HG2  GLN  55           HG2      GLN  55  -7.122   1.223  -9.884
    6    HG3  GLN  55           HG3      GLN  55  -6.902   0.034 -11.162
    7   HE21  GLN  55          HE21      GLN  55  -5.295  -1.431 -10.659
    8   HE22  GLN  55          HE22      GLN  55  -3.912  -1.093  -9.739

  No H/Q in entry =           8
  In of MODEL   53
    1    H    THR  56           H        THR  56  -9.073   3.300 -11.947
    2    HA   THR  56           HA       THR  56 -10.682   1.431 -10.667
    3    HB   THR  56           HB       THR  56 -11.738   3.835 -12.178
    4    HG1  THR  56           HG1      THR  56 -10.418   3.601  -9.690
    5   HG22  THR  56          HG21      THR  56 -12.706   2.871  -9.515
    6   HG21  THR  56          HG22      THR  56 -13.207   2.000 -10.966
    7   HG23  THR  56          HG23      THR  56 -13.588   3.714 -10.787

  No H/Q in entry =           7
  In of MODEL   53
    1    H    LYS  57           H        LYS  57 -10.855   2.517 -14.053
    2    HA   LYS  57           HA       LYS  57 -13.023   0.850 -14.819
    3    HB2  LYS  57           HB2      LYS  57 -12.147   2.785 -16.141
    4    HB3  LYS  57           HB3      LYS  57 -10.687   1.864 -16.475
    5    HG2  LYS  57           HG2      LYS  57 -11.771   0.393 -17.908
    6    HG3  LYS  57           HG3      LYS  57 -13.345   0.660 -17.167
    7    HD2  LYS  57           HD2      LYS  57 -12.855   1.699 -19.522
    8    HD3  LYS  57           HD3      LYS  57 -13.691   2.676 -18.318
    9    HE2  LYS  57           HE2      LYS  57 -10.701   2.781 -18.329
   10    HE3  LYS  57           HE3      LYS  57 -11.537   3.610 -19.641
   11    HZ3  LYS  57           HZ1      LYS  57 -12.075   5.237 -18.272
   12    HZ2  LYS  57           HZ2      LYS  57 -11.164   4.495 -17.043
   13    HZ1  LYS  57           HZ3      LYS  57 -12.824   4.160 -17.196

  No H/Q in entry =          13
  In of MODEL   53
    1    H    LEU  58           H        LEU  58  -9.524   0.386 -14.742
    2    HA   LEU  58           HA       LEU  58  -9.548  -2.131 -16.031
    3    HB2  LEU  58           HB2      LEU  58  -7.512  -0.859 -14.211
    4    HB3  LEU  58           HB3      LEU  58  -7.261  -2.383 -15.064
    5    HG   LEU  58           HG       LEU  58  -7.982   0.228 -16.432
    6   HD11  LEU  58          HD11      LEU  58  -5.352  -1.034 -15.726
    7   HD13  LEU  58          HD12      LEU  58  -5.831   0.662 -15.680
    8   HD12  LEU  58          HD13      LEU  58  -5.490  -0.113 -17.224
    9   HD22  LEU  58          HD21      LEU  58  -8.564  -1.328 -18.026
   10   HD21  LEU  58          HD22      LEU  58  -7.538  -2.586 -17.338
   11   HD23  LEU  58          HD23      LEU  58  -6.830  -1.319 -18.340

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  59           H        ILE  59 -10.380  -1.220 -12.785
    2    HA   ILE  59           HA       ILE  59 -10.061  -3.991 -11.835
    3    HB   ILE  59           HB       ILE  59  -9.603  -1.727 -10.434
    4   HG12  ILE  59          HG12      ILE  59 -10.999  -4.066  -9.118
    5   HG13  ILE  59          HG13      ILE  59  -9.355  -4.159  -9.694
    6   HG23  ILE  59          HG21      ILE  59 -11.436  -1.017  -9.135
    7   HG22  ILE  59          HG22      ILE  59 -12.381  -2.440  -9.501
    8   HG21  ILE  59          HG23      ILE  59 -12.142  -1.194 -10.723
    9   HD11  ILE  59          HD11      ILE  59  -8.784  -2.180  -8.297
   10   HD13  ILE  59          HD12      ILE  59  -9.300  -3.564  -7.345
   11   HD12  ILE  59          HD13      ILE  59 -10.413  -2.226  -7.634

  No H/Q in entry =          11
  In of MODEL   53
    1    H    GLU  60           H        GLU  60 -12.592  -1.651 -12.659
    2    HA   GLU  60           HA       GLU  60 -14.797  -3.147 -11.658
    3    HB2  GLU  60           HB2      GLU  60 -15.013  -0.785 -12.240
    4    HB3  GLU  60           HB3      GLU  60 -14.633  -1.137 -13.923
    5    HG2  GLU  60           HG2      GLU  60 -16.665  -2.579 -14.048
    6    HG3  GLU  60           HG3      GLU  60 -17.064  -2.116 -12.406

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLY  61           H        GLY  61 -13.105  -3.148 -14.763
    2    HA3  GLY  61           HA2      GLY  61 -14.833  -5.377 -15.663
    3    HA2  GLY  61           HA3      GLY  61 -13.972  -4.281 -16.736

  No H/Q in entry =           3
  In of MODEL   53
    1    H    ASP  62           H        ASP  62 -12.626  -5.738 -13.843
    2    HA   ASP  62           HA       ASP  62 -10.403  -6.789 -15.343
    3    HB2  ASP  62           HB2      ASP  62  -9.651  -7.544 -13.074
    4    HB3  ASP  62           HB3      ASP  62  -9.996  -5.821 -13.171

  No H/Q in entry =           4
  In of MODEL   53
    1    H    ALA  63           H        ALA  63 -13.486  -8.026 -14.770
    2    HA   ALA  63           HA       ALA  63 -12.983 -10.764 -14.176
    3    HB1  ALA  63           HB1      ALA  63 -15.228  -9.791 -15.953
    4    HB2  ALA  63           HB2      ALA  63 -15.227  -9.442 -14.225
    5    HB3  ALA  63           HB3      ALA  63 -15.251 -11.115 -14.787

  No H/Q in entry =           5
  In of MODEL   53
    1    H    GLY  64           H        GLY  64 -13.186  -8.948 -17.186
    2    HA3  GLY  64           HA2      GLY  64 -12.710  -9.478 -19.366
    3    HA2  GLY  64           HA3      GLY  64 -11.387 -10.413 -18.681

  No H/Q in entry =           3
  In of MODEL   53
    1    H    GLU  65           H        GLU  65 -11.514 -12.633 -18.641
    2    HA   GLU  65           HA       GLU  65 -13.365 -13.852 -20.408
    3    HB2  GLU  65           HB2      GLU  65 -11.394 -15.044 -18.460
    4    HB3  GLU  65           HB3      GLU  65 -12.338 -15.994 -19.607
    5    HG2  GLU  65           HG2      GLU  65 -11.378 -14.746 -21.478
    6    HG3  GLU  65           HG3      GLU  65 -10.481 -13.721 -20.360

  No H/Q in entry =           6
  In of MODEL   53
    1    H    GLY  66           H        GLY  66 -14.200 -16.117 -19.545
    2    HA3  GLY  66           HA2      GLY  66 -16.556 -15.624 -18.091
    3    HA2  GLY  66           HA3      GLY  66 -15.939 -17.197 -18.553

  No H/Q in entry =           3
  In of MODEL   53
    1    H    LYS  67           H        LYS  67 -13.486 -17.020 -17.116
    2    HA   LYS  67           HA       LYS  67 -14.389 -17.939 -14.574
    3    HB2  LYS  67           HB2      LYS  67 -11.645 -17.595 -15.770
    4    HB3  LYS  67           HB3      LYS  67 -11.935 -18.308 -14.178
    5    HG2  LYS  67           HG2      LYS  67 -13.438 -19.981 -15.197
    6    HG3  LYS  67           HG3      LYS  67 -13.147 -19.277 -16.786
    7    HD2  LYS  67           HD2      LYS  67 -10.770 -19.847 -16.635
    8    HD3  LYS  67           HD3      LYS  67 -11.012 -20.489 -15.008
    9    HE2  LYS  67           HE2      LYS  67 -11.013 -22.325 -16.642
   10    HE3  LYS  67           HE3      LYS  67 -12.612 -22.153 -15.918
   11    HZ3  LYS  67           HZ1      LYS  67 -13.484 -21.720 -17.893
   12    HZ2  LYS  67           HZ2      LYS  67 -11.987 -22.099 -18.601
   13    HZ1  LYS  67           HZ3      LYS  67 -12.357 -20.490 -18.200

  No H/Q in entry =          13
  In of MODEL   53
    1    H    MET  68           H        MET  68 -13.491 -17.351 -12.540
    2    HA   MET  68           HA       MET  68 -14.009 -14.695 -11.816
    3    HB2  MET  68           HB2      MET  68 -12.709 -17.002 -10.395
    4    HB3  MET  68           HB3      MET  68 -12.926 -15.435  -9.618
    5    HG2  MET  68           HG2      MET  68 -15.346 -15.540 -10.052
    6    HG3  MET  68           HG3      MET  68 -15.140 -17.096 -10.860
    7    HE2  MET  68           HE1      MET  68 -16.631 -18.817  -9.016
    8    HE1  MET  68           HE2      MET  68 -17.119 -17.144  -9.274
    9    HE3  MET  68           HE3      MET  68 -17.045 -17.790  -7.636

  No H/Q in entry =           9
  In of MODEL   53
    1    H    LYS  69           H        LYS  69 -10.855 -16.306 -12.324
    2    HA   LYS  69           HA       LYS  69  -9.093 -14.608 -11.211
    3    HB2  LYS  69           HB2      LYS  69  -8.482 -16.615 -12.483
    4    HB3  LYS  69           HB3      LYS  69  -8.796 -15.753 -13.991
    5    HG2  LYS  69           HG2      LYS  69  -7.063 -14.107 -13.445
    6    HG3  LYS  69           HG3      LYS  69  -6.782 -14.892 -11.892
    7    HD2  LYS  69           HD2      LYS  69  -6.078 -16.951 -13.055
    8    HD3  LYS  69           HD3      LYS  69  -6.354 -16.165 -14.611
    9    HE2  LYS  69           HE2      LYS  69  -3.977 -16.037 -14.043
   10    HE3  LYS  69           HE3      LYS  69  -4.685 -14.423 -13.997
   11    HZ2  LYS  69           HZ1      LYS  69  -3.715 -16.093 -11.811
   12    HZ1  LYS  69           HZ2      LYS  69  -5.085 -15.141 -11.499
   13    HZ3  LYS  69           HZ3      LYS  69  -3.638 -14.410 -12.008

  No H/Q in entry =          13
  In of MODEL   53
    1    H    VAL  70           H        VAL  70  -7.784 -12.809 -11.776
    2    HA   VAL  70           HA       VAL  70  -9.036 -10.918 -13.690
    3    HB   VAL  70           HB       VAL  70  -8.250  -9.125 -12.167
    4   HG13  VAL  70          HG11      VAL  70  -9.954  -9.494 -10.438
    5   HG12  VAL  70          HG12      VAL  70  -9.971 -11.220 -10.805
    6   HG11  VAL  70          HG13      VAL  70 -10.552 -10.059 -11.998
    7   HG23  VAL  70          HG21      VAL  70  -7.660  -9.981  -9.775
    8   HG22  VAL  70          HG22      VAL  70  -6.406 -10.057 -11.011
    9   HG21  VAL  70          HG23      VAL  70  -7.296 -11.512 -10.570

  No H/Q in entry =           9
  In of MODEL   53
    1    H    SER  71           H        SER  71  -7.482  -9.235 -14.447
    2    HA   SER  71           HA       SER  71  -5.223 -10.371 -15.703
    3    HB2  SER  71           HB2      SER  71  -6.418  -8.335 -16.513
    4    HB3  SER  71           HB3      SER  71  -5.766  -7.444 -15.140
    5    HG   SER  71           HG       SER  71  -4.610  -7.578 -17.354

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LEU  72           H        LEU  72  -3.216 -10.673 -15.036
    2    HA   LEU  72           HA       LEU  72  -2.510 -10.464 -12.320
    3    HB2  LEU  72           HB2      LEU  72  -0.846 -10.910 -14.793
    4    HB3  LEU  72           HB3      LEU  72  -0.195 -10.989 -13.159
    5    HG   LEU  72           HG       LEU  72  -2.549 -12.663 -14.096
    6   HD13  LEU  72          HD11      LEU  72  -1.041 -14.471 -14.472
    7   HD12  LEU  72          HD12      LEU  72   0.298 -13.605 -13.719
    8   HD11  LEU  72          HD13      LEU  72  -0.318 -13.084 -15.289
    9   HD21  LEU  72          HD21      LEU  72  -0.877 -12.511 -11.598
   10   HD23  LEU  72          HD22      LEU  72  -1.569 -14.058 -12.061
   11   HD22  LEU  72          HD23      LEU  72  -2.622 -12.682 -11.747

  No H/Q in entry =          11
  In of MODEL   53
    1    H    VAL  73           H        VAL  73  -1.757  -8.457 -15.098
    2    HA   VAL  73           HA       VAL  73   0.174  -6.777 -13.984
    3    HB   VAL  73           HB       VAL  73  -0.194  -5.356 -15.843
    4   HG11  VAL  73          HG11      VAL  73   0.556  -7.778 -16.249
    5   HG13  VAL  73          HG12      VAL  73  -0.057  -6.898 -17.649
    6   HG12  VAL  73          HG13      VAL  73  -1.084  -8.071 -16.825
    7   HG23  VAL  73          HG21      VAL  73  -2.365  -5.938 -17.251
    8   HG22  VAL  73          HG22      VAL  73  -2.449  -4.805 -15.904
    9   HG21  VAL  73          HG23      VAL  73  -2.970  -6.476 -15.686

  No H/Q in entry =           9
  In of MODEL   53
    1    H    LEU  74           H        LEU  74  -3.227  -6.858 -13.446
    2    HA   LEU  74           HA       LEU  74  -3.822  -4.195 -12.839
    3    HB2  LEU  74           HB2      LEU  74  -5.573  -5.829 -13.020
    4    HB3  LEU  74           HB3      LEU  74  -4.894  -6.779 -11.702
    5    HG   LEU  74           HG       LEU  74  -5.328  -4.913 -10.135
    6   HD13  LEU  74          HD11      LEU  74  -5.198  -2.968 -11.493
    7   HD12  LEU  74          HD12      LEU  74  -6.904  -3.101 -11.072
    8   HD11  LEU  74          HD13      LEU  74  -6.347  -3.613 -12.666
    9   HD22  LEU  74          HD21      LEU  74  -7.554  -5.444  -9.888
   10   HD21  LEU  74          HD22      LEU  74  -7.027  -6.716 -10.968
   11   HD23  LEU  74          HD23      LEU  74  -7.879  -5.336 -11.615

  No H/Q in entry =          11
  In of MODEL   53
    1    H    VAL  75           H        VAL  75  -2.821  -6.791 -10.670
    2    HA   VAL  75           HA       VAL  75  -2.620  -5.240  -8.326
    3    HB   VAL  75           HB       VAL  75  -1.154  -7.755  -9.110
    4   HG13  VAL  75          HG11      VAL  75   0.132  -6.549  -7.385
    5   HG12  VAL  75          HG12      VAL  75  -0.705  -7.903  -6.642
    6   HG11  VAL  75          HG13      VAL  75  -1.338  -6.278  -6.453
    7   HG23  VAL  75          HG21      VAL  75  -3.479  -7.259  -7.219
    8   HG22  VAL  75          HG22      VAL  75  -2.834  -8.825  -7.711
    9   HG21  VAL  75          HG23      VAL  75  -3.675  -7.809  -8.883

  No H/Q in entry =           9
  In of MODEL   53
    1    H    GLU  76           H        GLU  76  -0.204  -6.028 -10.847
    2    HA   GLU  76           HA       GLU  76   1.988  -4.702  -9.677
    3    HB2  GLU  76           HB2      GLU  76   2.193  -6.180 -11.656
    4    HB3  GLU  76           HB3      GLU  76   1.293  -5.020 -12.620
    5    HG2  GLU  76           HG2      GLU  76   3.635  -4.701 -13.105
    6    HG3  GLU  76           HG3      GLU  76   3.118  -3.322 -12.155

  No H/Q in entry =           6
  In of MODEL   53
    1    H    ALA  77           H        ALA  77  -0.518  -3.476 -11.882
    2    HA   ALA  77           HA       ALA  77   0.501  -0.840 -12.053
    3    HB1  ALA  77           HB1      ALA  77  -1.204  -1.795 -13.597
    4    HB2  ALA  77           HB2      ALA  77  -1.698  -0.245 -12.918
    5    HB3  ALA  77           HB3      ALA  77  -2.384  -1.741 -12.286

  No H/Q in entry =           5
  In of MODEL   53
    1    H    GLN  78           H        GLN  78  -1.797  -2.371  -9.855
    2    HA   GLN  78           HA       GLN  78  -2.589  -0.044  -8.461
    3    HB2  GLN  78           HB2      GLN  78  -3.719  -2.295  -8.382
    4    HB3  GLN  78           HB3      GLN  78  -2.397  -2.862  -7.366
    5    HG2  GLN  78           HG2      GLN  78  -2.916  -1.123  -5.710
    6    HG3  GLN  78           HG3      GLN  78  -4.231  -0.537  -6.725
    7   HE21  GLN  78          HE21      GLN  78  -4.733  -1.514  -4.074
    8   HE22  GLN  78          HE22      GLN  78  -5.621  -2.955  -4.200

  No H/Q in entry =           8
  In of MODEL   53
    1    H    LEU  79           H        LEU  79   0.064  -2.326  -7.992
    2    HA   LEU  79           HA       LEU  79   1.034  -1.437  -5.530
    3    HB2  LEU  79           HB2      LEU  79   1.891  -3.455  -6.591
    4    HB3  LEU  79           HB3      LEU  79   2.554  -2.510  -7.921
    5    HG   LEU  79           HG       LEU  79   4.112  -1.385  -6.408
    6   HD13  LEU  79          HD11      LEU  79   3.097  -1.129  -4.347
    7   HD12  LEU  79          HD12      LEU  79   4.160  -2.488  -3.996
    8   HD11  LEU  79          HD13      LEU  79   2.454  -2.771  -4.336
    9   HD23  LEU  79          HD21      LEU  79   5.296  -3.544  -5.496
   10   HD22  LEU  79          HD22      LEU  79   5.106  -3.344  -7.235
   11   HD21  LEU  79          HD23      LEU  79   4.012  -4.403  -6.349

  No H/Q in entry =          11
  In of MODEL   53
    1    H    HIS  80           H        HIS  80   1.935  -0.330  -8.798
    2    HA   HIS  80           HA       HIS  80   3.755   1.641  -7.865
    3    HB2  HIS  80           HB2      HIS  80   2.476   0.957 -10.456
    4    HB3  HIS  80           HB3      HIS  80   3.084   2.603 -10.282
    5    HD1  HIS  80           HD1      HIS  80   5.492   2.882 -10.789
    6    HD2  HIS  80           HD2      HIS  80   4.630  -1.021  -9.601
    7    HE1  HIS  80           HE1      HIS  80   7.671   1.585 -10.941
    8    HE2  HIS  80           HE2      HIS  80   7.157  -0.797 -10.219

  No H/Q in entry =           8
  In of MODEL   53
    1    H    LEU  81           H        LEU  81   0.359   1.831  -8.867
    2    HA   LEU  81           HA       LEU  81   0.106   4.626  -8.539
    3    HB2  LEU  81           HB2      LEU  81  -1.928   2.398  -8.472
    4    HB3  LEU  81           HB3      LEU  81  -2.366   4.105  -8.384
    5    HG   LEU  81           HG       LEU  81  -0.669   2.939 -10.608
    6   HD12  LEU  81          HD11      LEU  81  -2.890   3.277 -11.922
    7   HD11  LEU  81          HD12      LEU  81  -3.656   3.216 -10.335
    8   HD13  LEU  81          HD13      LEU  81  -2.721   1.840 -10.915
    9   HD23  LEU  81          HD21      LEU  81  -1.741   5.092 -11.714
   10   HD22  LEU  81          HD22      LEU  81  -0.329   5.251 -10.671
   11   HD21  LEU  81          HD23      LEU  81  -1.935   5.614 -10.042

  No H/Q in entry =          11
  In of MODEL   53
    1    H    MET  82           H        MET  82  -0.590   1.946  -6.293
    2    HA   MET  82           HA       MET  82  -1.642   3.542  -4.214
    3    HB2  MET  82           HB2      MET  82  -0.290   0.844  -4.243
    4    HB3  MET  82           HB3      MET  82  -0.873   1.574  -2.749
    5    HG2  MET  82           HG2      MET  82  -2.594   1.094  -5.201
    6    HG3  MET  82           HG3      MET  82  -2.533   0.020  -3.805
    7    HE3  MET  82           HE1      MET  82  -4.261   1.685  -1.002
    8    HE2  MET  82           HE2      MET  82  -2.527   1.949  -1.176
    9    HE1  MET  82           HE3      MET  82  -3.225   0.397  -1.633

  No H/Q in entry =           9
  In of MODEL   53
    1    H    THR  83           H        THR  83   1.654   2.429  -4.881
    2    HA   THR  83           HA       THR  83   2.865   3.525  -2.574
    3    HB   THR  83           HB       THR  83   4.969   3.452  -4.034
    4    HG1  THR  83           HG1      THR  83   4.738   2.926  -6.059
    5   HG22  THR  83          HG21      THR  83   4.506   0.797  -4.367
    6   HG21  THR  83          HG22      THR  83   3.212   1.188  -3.236
    7   HG23  THR  83          HG23      THR  83   4.892   1.518  -2.806

  No H/Q in entry =           7
  In of MODEL   53
    1    H    SER  84           H        SER  84   2.526   4.805  -5.877
    2    HA   SER  84           HA       SER  84   3.882   7.235  -5.414
    3    HB2  SER  84           HB2      SER  84   1.819   6.418  -7.446
    4    HB3  SER  84           HB3      SER  84   2.510   8.040  -7.417
    5    HG   SER  84           HG       SER  84   3.864   5.554  -7.699

  No H/Q in entry =           5
  In of MODEL   53
    1    H    MET  85           H        MET  85   0.381   6.507  -5.265
    2    HA   MET  85           HA       MET  85  -0.463   9.124  -4.670
    3    HB2  MET  85           HB2      MET  85  -1.995   7.327  -5.348
    4    HB3  MET  85           HB3      MET  85  -1.724   6.520  -3.804
    5    HG2  MET  85           HG2      MET  85  -2.617   8.472  -2.606
    6    HG3  MET  85           HG3      MET  85  -2.842   9.320  -4.135
    7    HE2  MET  85           HE1      MET  85  -5.095   5.907  -2.255
    8    HE1  MET  85           HE2      MET  85  -3.399   6.355  -2.079
    9    HE3  MET  85           HE3      MET  85  -3.890   5.287  -3.391

  No H/Q in entry =           9
  In of MODEL   53
    1    H    LEU  86           H        LEU  86   0.421   6.455  -2.520
    2    HA   LEU  86           HA       LEU  86  -0.117   7.764  -0.081
    3    HB2  LEU  86           HB2      LEU  86   0.328   5.289  -0.472
    4    HB3  LEU  86           HB3      LEU  86   2.040   5.704  -0.556
    5    HG   LEU  86           HG       LEU  86   1.710   6.868   1.710
    6   HD11  LEU  86          HD11      LEU  86  -0.987   6.125   1.222
    7   HD13  LEU  86          HD12      LEU  86  -0.324   6.867   2.676
    8   HD12  LEU  86          HD13      LEU  86  -0.430   5.112   2.557
    9   HD23  LEU  86          HD21      LEU  86   1.255   3.880   1.830
   10   HD22  LEU  86          HD22      LEU  86   2.259   4.880   2.876
   11   HD21  LEU  86          HD23      LEU  86   2.768   4.551   1.221

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ALA  87           H        ALA  87   2.873   7.442  -1.952
    2    HA   ALA  87           HA       ALA  87   4.581   8.837  -0.216
    3    HB3  ALA  87           HB1      ALA  87   4.684   7.823  -2.923
    4    HB2  ALA  87           HB2      ALA  87   6.014   8.141  -1.813
    5    HB1  ALA  87           HB3      ALA  87   5.418   9.427  -2.861

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ARG  88           H        ARG  88   2.662   9.990  -2.949
    2    HA   ARG  88           HA       ARG  88   3.461  12.673  -2.827
    3    HB2  ARG  88           HB2      ARG  88   2.208  11.532  -4.693
    4    HB3  ARG  88           HB3      ARG  88   0.746  11.690  -3.719
    5    HG2  ARG  88           HG2      ARG  88   1.790  14.260  -3.629
    6    HG3  ARG  88           HG3      ARG  88   2.219  13.741  -5.257
    7    HD2  ARG  88           HD2      ARG  88   0.083  13.842  -5.968
    8    HD3  ARG  88           HD3      ARG  88  -0.521  12.995  -4.544
    9    HE   ARG  88           HE       ARG  88  -0.680  15.775  -4.963
   10   HH21  ARG  88          HH11      ARG  88  -1.205  17.110  -3.228
   11   HH22  ARG  88          HH12      ARG  88  -0.924  16.570  -1.609
   12   HH11  ARG  88          HH21      ARG  88   0.298  13.503  -2.582
   13   HH12  ARG  88          HH22      ARG  88  -0.091  14.522  -1.243

  No H/Q in entry =          13
  In of MODEL   53
    1    H    GLU  89           H        GLU  89   0.731  11.026  -1.204
    2    HA   GLU  89           HA       GLU  89  -0.360  13.349  -0.006
    3    HB2  GLU  89           HB2      GLU  89  -1.501  11.122  -0.100
    4    HB3  GLU  89           HB3      GLU  89  -0.390  10.555   1.148
    5    HG2  GLU  89           HG2      GLU  89  -1.202  12.262   2.702
    6    HG3  GLU  89           HG3      GLU  89  -2.240  12.944   1.452

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LEU  90           H        LEU  90   2.059  11.031   1.183
    2    HA   LEU  90           HA       LEU  90   2.413  12.272   3.715
    3    HB2  LEU  90           HB2      LEU  90   4.177  10.479   2.048
    4    HB3  LEU  90           HB3      LEU  90   4.592  10.991   3.689
    5    HG   LEU  90           HG       LEU  90   1.947   9.674   3.012
    6   HD12  LEU  90          HD11      LEU  90   3.058   7.615   4.027
    7   HD11  LEU  90          HD12      LEU  90   4.591   8.455   3.795
    8   HD13  LEU  90          HD13      LEU  90   3.583   8.058   2.402
    9   HD22  LEU  90          HD21      LEU  90   1.680  10.600   5.132
   10   HD21  LEU  90          HD22      LEU  90   3.394  10.474   5.525
   11   HD23  LEU  90          HD23      LEU  90   2.371   9.038   5.567

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  91           H        ILE  91   4.040  12.637   0.598
    2    HA   ILE  91           HA       ILE  91   6.032  14.446   1.449
    3    HB   ILE  91           HB       ILE  91   4.731  13.970  -1.239
    4   HG12  ILE  91          HG12      ILE  91   7.552  13.451  -0.248
    5   HG13  ILE  91          HG13      ILE  91   6.256  12.268  -0.093
    6   HG22  ILE  91          HG21      ILE  91   6.973  15.292  -1.914
    7   HG21  ILE  91          HG22      ILE  91   6.663  16.096  -0.374
    8   HG23  ILE  91          HG23      ILE  91   5.448  16.138  -1.651
    9   HD13  ILE  91          HD11      ILE  91   6.093  11.946  -2.401
   10   HD12  ILE  91          HD12      ILE  91   7.828  12.170  -2.177
   11   HD11  ILE  91          HD13      ILE  91   6.837  13.504  -2.769

  No H/Q in entry =          11
  In of MODEL   53
    1    H    THR  92           H        THR  92   2.681  14.917   0.421
    2    HA   THR  92           HA       THR  92   2.688  17.740   0.361
    3    HB   THR  92           HB       THR  92   0.493  15.771   1.047
    4    HG1  THR  92           HG1      THR  92   0.809  15.589  -1.036
    5   HG22  THR  92          HG21      THR  92  -0.878  17.949   0.317
    6   HG21  THR  92          HG22      THR  92   0.520  18.758   1.022
    7   HG23  THR  92          HG23      THR  92  -0.441  17.647   1.998

  No H/Q in entry =           7
  In of MODEL   53
    1    H    GLU  93           H        GLU  93   2.097  15.446   3.011
    2    HA   GLU  93           HA       GLU  93   1.575  17.356   5.027
    3    HB2  GLU  93           HB2      GLU  93   2.855  14.616   5.270
    4    HB3  GLU  93           HB3      GLU  93   2.167  15.551   6.599
    5    HG2  GLU  93           HG2      GLU  93   0.560  14.792   4.150
    6    HG3  GLU  93           HG3      GLU  93   0.641  13.768   5.579

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LEU  94           H        LEU  94   4.571  15.839   3.895
    2    HA   LEU  94           HA       LEU  94   6.323  16.965   5.794
    3    HB2  LEU  94           HB2      LEU  94   6.731  15.994   2.965
    4    HB3  LEU  94           HB3      LEU  94   8.062  16.635   3.923
    5    HG   LEU  94           HG       LEU  94   6.290  14.460   5.047
    6   HD11  LEU  94          HD11      LEU  94   8.395  14.210   2.928
    7   HD13  LEU  94          HD12      LEU  94   6.936  13.253   3.180
    8   HD12  LEU  94          HD13      LEU  94   8.353  12.983   4.196
    9   HD23  LEU  94          HD21      LEU  94   8.466  13.898   6.212
   10   HD22  LEU  94          HD22      LEU  94   7.815  15.484   6.625
   11   HD21  LEU  94          HD23      LEU  94   9.159  15.347   5.490

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  95           H        ILE  95   5.217  18.151   2.637
    2    HA   ILE  95           HA       ILE  95   6.817  20.489   2.588
    3    HB   ILE  95           HB       ILE  95   4.173  19.837   1.266
    4   HG12  ILE  95          HG12      ILE  95   6.973  20.141   0.146
    5   HG13  ILE  95          HG13      ILE  95   6.302  18.596   0.657
    6   HG21  ILE  95          HG21      ILE  95   5.953  22.283   1.057
    7   HG23  ILE  95          HG22      ILE  95   4.225  22.236   1.402
    8   HG22  ILE  95          HG23      ILE  95   4.813  21.829  -0.210
    9   HD13  ILE  95          HD11      ILE  95   4.752  18.539  -1.082
   10   HD12  ILE  95          HD12      ILE  95   6.115  19.341  -1.862
   11   HD11  ILE  95          HD13      ILE  95   4.750  20.292  -1.277

  No H/Q in entry =          11
  In of MODEL   53
    1    H    GLU  96           H        GLU  96   3.553  19.876   3.863
    2    HA   GLU  96           HA       GLU  96   2.960  22.530   4.611
    3    HB2  GLU  96           HB2      GLU  96   1.264  20.767   4.612
    4    HB3  GLU  96           HB3      GLU  96   2.108  19.929   5.912
    5    HG2  GLU  96           HG2      GLU  96   1.093  21.224   7.476
    6    HG3  GLU  96           HG3      GLU  96   1.651  22.692   6.682

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LEU  97           H        LEU  97   4.762  19.957   6.247
    2    HA   LEU  97           HA       LEU  97   5.121  21.301   8.720
    3    HB2  LEU  97           HB2      LEU  97   6.640  19.113   7.314
    4    HB3  LEU  97           HB3      LEU  97   7.229  19.791   8.830
    5    HG   LEU  97           HG       LEU  97   4.408  18.732   8.502
    6   HD12  LEU  97          HD11      LEU  97   5.316  16.708   9.720
    7   HD11  LEU  97          HD12      LEU  97   6.937  17.319   9.386
    8   HD13  LEU  97          HD13      LEU  97   5.870  16.875   8.054
    9   HD23  LEU  97          HD21      LEU  97   4.842  18.432  11.069
   10   HD22  LEU  97          HD22      LEU  97   4.485  20.048  10.463
   11   HD21  LEU  97          HD23      LEU  97   6.149  19.588  10.818

  No H/Q in entry =          11
  In of MODEL   53
    1    H    HIS  98           H        HIS  98   7.010  21.294   5.706
    2    HA   HIS  98           HA       HIS  98   9.177  22.847   6.618
    3    HB2  HIS  98           HB2      HIS  98   7.898  22.608   3.885
    4    HB3  HIS  98           HB3      HIS  98   9.348  23.569   4.184
    5    HD1  HIS  98           HD1      HIS  98   8.092  20.013   4.196
    6    HD2  HIS  98           HD2      HIS  98  11.696  22.065   4.643
    7    HE1  HIS  98           HE1      HIS  98   9.925  18.261   4.150
    8    HE2  HIS  98           HE2      HIS  98  12.124  19.490   4.422

  No H/Q in entry =           8
  In of MODEL   53
    1    H    GLU  99           H        GLU  99   5.974  23.722   5.424
    2    HA   GLU  99           HA       GLU  99   6.389  26.532   5.369
    3    HB2  GLU  99           HB2      GLU  99   4.502  25.387   4.226
    4    HB3  GLU  99           HB3      GLU  99   3.792  25.034   5.801
    5    HG2  GLU  99           HG2      GLU  99   3.639  27.428   6.301
    6    HG3  GLU  99           HG3      GLU  99   4.429  27.818   4.777

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LYS 100           H        LYS 100   5.215  24.311   7.883
    2    HA   LYS 100           HA       LYS 100   4.643  26.372   9.774
    3    HB2  LYS 100           HB2      LYS 100   5.178  23.414  10.122
    4    HB3  LYS 100           HB3      LYS 100   4.737  24.492  11.452
    5    HG2  LYS 100           HG2      LYS 100   2.687  25.156  10.192
    6    HG3  LYS 100           HG3      LYS 100   3.106  23.982   8.941
    7    HD2  LYS 100           HD2      LYS 100   2.995  22.162  10.602
    8    HD3  LYS 100           HD3      LYS 100   2.592  23.329  11.863
    9    HE2  LYS 100           HE2      LYS 100   0.555  23.977  10.588
   10    HE3  LYS 100           HE3      LYS 100   0.947  22.753   9.374
   11    HZ1  LYS 100           HZ1      LYS 100   0.655  22.089  12.253
   12    HZ3  LYS 100           HZ2      LYS 100   0.634  21.035  10.918
   13    HZ2  LYS 100           HZ3      LYS 100  -0.670  22.091  11.190

  No H/Q in entry =          13
  In of MODEL   53
    1    H    LEU 101           H        LEU 101   7.548  24.539   8.957
    2    HA   LEU 101           HA       LEU 101   9.144  25.358  11.171
    3    HB2  LEU 101           HB2      LEU 101   9.742  24.364   8.396
    4    HB3  LEU 101           HB3      LEU 101  11.047  25.012   9.386
    5    HG   LEU 101           HG       LEU 101   9.181  22.880  10.438
    6   HD12  LEU 101          HD11      LEU 101  11.218  21.358   9.842
    7   HD11  LEU 101          HD12      LEU 101  11.609  22.617   8.672
    8   HD13  LEU 101          HD13      LEU 101  10.070  21.764   8.568
    9   HD21  LEU 101          HD21      LEU 101  11.914  23.952  11.182
   10   HD23  LEU 101          HD22      LEU 101  11.347  22.387  11.758
   11   HD22  LEU 101          HD23      LEU 101  10.471  23.854  12.191

  No H/Q in entry =          11
  In of MODEL   53
    1    H    LYS 102           H        LYS 102   7.598  27.242   9.021
    2    HA   LYS 102           HA       LYS 102   7.708  29.534   8.730
    3    HB2  LYS 102           HB2      LYS 102   9.258  29.398  10.838
    4    HB3  LYS 102           HB3      LYS 102  10.567  29.575   9.687
    5    HG2  LYS 102           HG2      LYS 102   8.482  31.556  10.536
    6    HG3  LYS 102           HG3      LYS 102  10.199  31.793  10.295
    7    HD2  LYS 102           HD2      LYS 102   8.257  31.396   7.983
    8    HD3  LYS 102           HD3      LYS 102   8.657  32.971   8.654
    9    HE2  LYS 102           HE2      LYS 102  10.026  31.768   6.589
   10    HE3  LYS 102           HE3      LYS 102  10.654  33.067   7.604
   11    HZ2  LYS 102           HZ1      LYS 102  12.150  31.142   7.438
   12    HZ1  LYS 102           HZ2      LYS 102  10.970  30.175   8.173
   13    HZ3  LYS 102           HZ3      LYS 102  11.675  31.452   9.037

  No H/Q in entry =          13
  In of MODEL   53
    1    H    ALA 103           H        ALA 103  10.950  28.152   8.185
    2    HA   ALA 103           HA       ALA 103  11.945  29.516   6.116
    3    HB2  ALA 103           HB1      ALA 103  12.806  27.291   5.193
    4    HB1  ALA 103           HB2      ALA 103  11.893  26.528   6.493
    5    HB3  ALA 103           HB3      ALA 103  13.195  27.655   6.874

  No H/Q in entry =           5
  In of MODEL   53
    1    H1   LYS   3           H1       LYS   3 -31.810   5.655 -19.748
    2    H2   LYS   3           H3       LYS   3 -30.826   5.393 -21.106
    3    H3   LYS   3           H2       LYS   3 -32.189   4.415 -20.843
    4    HA   LYS   3           HA       LYS   3 -31.130   3.062 -19.446
    5    HB2  LYS   3           HB2      LYS   3 -28.906   4.540 -20.804
    6    HB3  LYS   3           HB3      LYS   3 -28.532   3.346 -19.562
    7    HG2  LYS   3           HG2      LYS   3 -29.918   1.713 -20.895
    8    HG3  LYS   3           HG3      LYS   3 -29.922   2.911 -22.188
    9    HD2  LYS   3           HD2      LYS   3 -27.437   2.875 -22.162
   10    HD3  LYS   3           HD3      LYS   3 -27.504   1.576 -20.971
   11    HE2  LYS   3           HE2      LYS   3 -28.982   0.350 -22.670
   12    HE3  LYS   3           HE3      LYS   3 -28.411   1.544 -23.834
   13    HZ3  LYS   3           HZ1      LYS   3 -26.578   0.371 -24.119
   14    HZ2  LYS   3           HZ2      LYS   3 -27.160  -0.814 -23.051
   15    HZ1  LYS   3           HZ3      LYS   3 -26.204   0.462 -22.465

  No H/Q in entry =          15
  In of MODEL   53
    1    H    LYS   4           H        LYS   4 -31.158   2.924 -17.385
    2    HA   LYS   4           HA       LYS   4 -30.481   5.236 -15.746
    3    HB2  LYS   4           HB2      LYS   4 -31.594   2.510 -15.028
    4    HB3  LYS   4           HB3      LYS   4 -31.402   3.857 -13.908
    5    HG2  LYS   4           HG2      LYS   4 -33.231   3.734 -16.312
    6    HG3  LYS   4           HG3      LYS   4 -33.706   3.774 -14.615
    7    HD2  LYS   4           HD2      LYS   4 -33.074   6.017 -14.360
    8    HD3  LYS   4           HD3      LYS   4 -32.047   5.986 -15.794
    9    HE2  LYS   4           HE2      LYS   4 -34.018   7.301 -16.240
   10    HE3  LYS   4           HE3      LYS   4 -34.063   5.824 -17.203
   11    HZ3  LYS   4           HZ1      LYS   4 -35.596   4.870 -15.639
   12    HZ2  LYS   4           HZ2      LYS   4 -36.200   6.347 -16.220
   13    HZ1  LYS   4           HZ3      LYS   4 -35.526   6.259 -14.665

  No H/Q in entry =          13
  In of MODEL   53
    1    H    HIS   5           H        HIS   5 -29.000   5.368 -14.170
    2    HA   HIS   5           HA       HIS   5 -26.668   3.605 -14.520
    3    HB2  HIS   5           HB2      HIS   5 -26.991   6.354 -13.317
    4    HB3  HIS   5           HB3      HIS   5 -25.483   5.444 -13.313
    5    HD1  HIS   5           HD1      HIS   5 -24.063   6.680 -14.920
    6    HD2  HIS   5           HD2      HIS   5 -27.861   5.947 -16.434
    7    HE1  HIS   5           HE1      HIS   5 -23.937   7.259 -17.373
    8    HE2  HIS   5           HE2      HIS   5 -26.251   6.800 -18.265

  No H/Q in entry =           8
  In of MODEL   53
    1    H    ILE   6           H        ILE   6 -26.381   2.043 -13.201
    2    HA   ILE   6           HA       ILE   6 -27.337   2.291 -10.428
    3    HB   ILE   6           HB       ILE   6 -26.458  -0.156 -11.968
    4   HG12  ILE   6          HG12      ILE   6 -29.218   0.706 -11.093
    5   HG13  ILE   6          HG13      ILE   6 -28.597   0.881 -12.734
    6   HG23  ILE   6          HG21      ILE   6 -26.778  -1.413 -10.102
    7   HG22  ILE   6          HG22      ILE   6 -27.959  -0.298  -9.414
    8   HG21  ILE   6          HG23      ILE   6 -26.239   0.086  -9.342
    9   HD13  ILE   6          HD11      ILE   6 -29.002  -1.252 -13.224
   10   HD12  ILE   6          HD12      ILE   6 -30.003  -1.259 -11.771
   11   HD11  ILE   6          HD13      ILE   6 -28.332  -1.821 -11.695

  No H/Q in entry =          11
  In of MODEL   53
    1    H    TYR   7           H        TYR   7 -25.584   2.984  -9.161
    2    HA   TYR   7           HA       TYR   7 -22.854   2.100  -9.865
    3    HB2  TYR   7           HB2      TYR   7 -23.870   4.511  -8.381
    4    HB3  TYR   7           HB3      TYR   7 -22.173   4.043  -8.435
    5    HD1  TYR   7           HD1      TYR   7 -23.216   3.064 -11.512
    6    HD2  TYR   7           HD2      TYR   7 -22.623   6.659  -9.301
    7    HE1  TYR   7           HE1      TYR   7 -22.839   4.299 -13.611
    8    HE2  TYR   7           HE2      TYR   7 -22.289   7.899 -11.391
    9    HH   TYR   7           HH       TYR   7 -22.527   7.801 -13.621

  No H/Q in entry =           9
  In of MODEL   53
    1    H    LEU   8           H        LEU   8 -21.838   0.780  -8.543
    2    HA   LEU   8           HA       LEU   8 -22.928   0.261  -5.847
    3    HB2  LEU   8           HB2      LEU   8 -21.199  -1.359  -7.694
    4    HB3  LEU   8           HB3      LEU   8 -21.356  -1.741  -5.980
    5    HG   LEU   8           HG       LEU   8 -23.834  -1.984  -6.377
    6   HD13  LEU   8          HD11      LEU   8 -24.020  -0.778  -8.488
    7   HD12  LEU   8          HD12      LEU   8 -24.505  -2.456  -8.719
    8   HD11  LEU   8          HD13      LEU   8 -22.918  -1.915  -9.262
    9   HD23  LEU   8          HD21      LEU   8 -22.521  -3.994  -8.079
   10   HD22  LEU   8          HD22      LEU   8 -23.590  -4.187  -6.689
   11   HD21  LEU   8          HD23      LEU   8 -21.891  -3.786  -6.445

  No H/Q in entry =          11
  In of MODEL   53
    1    H    PHE   9           H        PHE   9 -21.649   0.687  -4.073
    2    HA   PHE   9           HA       PHE   9 -18.892   1.689  -4.608
    3    HB2  PHE   9           HB2      PHE   9 -20.910   2.724  -2.620
    4    HB3  PHE   9           HB3      PHE   9 -19.214   3.187  -2.638
    5    HD1  PHE   9           HD1      PHE   9 -18.292   4.542  -4.439
    6    HD2  PHE   9           HD2      PHE   9 -22.445   3.463  -4.389
    7    HE1  PHE   9           HE1      PHE   9 -18.749   6.216  -6.206
    8    HE2  PHE   9           HE2      PHE   9 -22.903   5.149  -6.151
    9    HZ   PHE   9           HZ       PHE   9 -21.053   6.521  -7.065

  No H/Q in entry =           9
  In of MODEL   53
    1    H    SER  10           H        SER  10 -17.265   0.840  -3.458
    2    HA   SER  10           HA       SER  10 -17.436  -0.066  -0.777
    3    HB2  SER  10           HB2      SER  10 -17.179  -2.442  -1.084
    4    HB3  SER  10           HB3      SER  10 -18.627  -1.935  -1.938
    5    HG   SER  10           HG       SER  10 -16.717  -1.641  -3.649

  No H/Q in entry =           5
  In of MODEL   53
    1    H    SER  11           H        SER  11 -15.413   0.085   0.044
    2    HA   SER  11           HA       SER  11 -13.259   0.995  -1.503
    3    HB2  SER  11           HB2      SER  11 -12.026   1.012   0.477
    4    HB3  SER  11           HB3      SER  11 -13.694   1.182   1.029
    5    HG   SER  11           HG       SER  11 -11.908  -0.773   1.532

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ALA  12           H        ALA  12 -14.390  -1.695  -2.339
    2    HA   ALA  12           HA       ALA  12 -11.797  -2.887  -2.898
    3    HB1  ALA  12           HB1      ALA  12 -13.903  -4.285  -1.268
    4    HB2  ALA  12           HB2      ALA  12 -12.169  -4.167  -0.970
    5    HB3  ALA  12           HB3      ALA  12 -12.770  -5.199  -2.267

  No H/Q in entry =           5
  In of MODEL   53
    1    H    GLY  13           H        GLY  13 -12.678  -1.860  -4.896
    2    HA3  GLY  13           HA2      GLY  13 -14.905  -2.644  -6.326
    3    HA2  GLY  13           HA3      GLY  13 -13.385  -2.142  -7.081

  No H/Q in entry =           3
  In of MODEL   53
    1    H    MET  14           H        MET  14 -11.810  -4.407  -6.114
    2    HA   MET  14           HA       MET  14 -12.171  -6.158  -8.245
    3    HB2  MET  14           HB2      MET  14 -10.091  -6.167  -6.954
    4    HB3  MET  14           HB3      MET  14 -10.918  -6.885  -5.574
    5    HG2  MET  14           HG2      MET  14 -11.454  -8.875  -6.963
    6    HG3  MET  14           HG3      MET  14 -10.588  -8.150  -8.318
    7    HE2  MET  14           HE1      MET  14  -7.824  -6.846  -6.864
    8    HE1  MET  14           HE2      MET  14  -8.435  -7.442  -8.405
    9    HE3  MET  14           HE3      MET  14  -7.043  -8.220  -7.659

  No H/Q in entry =           9
  In of MODEL   53
    1    H    SER  15           H        SER  15 -13.303  -6.720  -4.908
    2    HA   SER  15           HA       SER  15 -14.595  -9.192  -5.605
    3    HB2  SER  15           HB2      SER  15 -14.119  -8.990  -3.285
    4    HB3  SER  15           HB3      SER  15 -14.872  -7.401  -3.193
    5    HG   SER  15           HG       SER  15 -16.211  -9.854  -3.770

  No H/Q in entry =           5
  In of MODEL   53
    1    H    THR  16           H        THR  16 -15.770  -5.843  -5.238
    2    HA   THR  16           HA       THR  16 -18.548  -6.424  -5.750
    3    HB   THR  16           HB       THR  16 -17.060  -3.830  -6.288
    4    HG1  THR  16           HG1      THR  16 -18.389  -4.028  -3.925
    5   HG22  THR  16          HG21      THR  16 -19.894  -4.239  -5.342
    6   HG21  THR  16          HG22      THR  16 -19.487  -4.203  -7.066
    7   HG23  THR  16          HG23      THR  16 -19.176  -2.793  -6.043

  No H/Q in entry =           7
  In of MODEL   53
    1    H    SER  17           H        SER  17 -15.731  -5.802  -7.629
    2    HA   SER  17           HA       SER  17 -16.902  -5.101 -10.123
    3    HB2  SER  17           HB2      SER  17 -14.231  -6.349  -9.443
    4    HB3  SER  17           HB3      SER  17 -14.699  -5.921 -11.089
    5    HG   SER  17           HG       SER  17 -15.222  -3.822  -9.636

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LEU  18           H        LEU  18 -16.231  -8.224  -8.671
    2    HA   LEU  18           HA       LEU  18 -16.795  -9.747 -11.017
    3    HB2  LEU  18           HB2      LEU  18 -15.531 -10.658  -9.110
    4    HB3  LEU  18           HB3      LEU  18 -16.970 -10.520  -8.099
    5    HG   LEU  18           HG       LEU  18 -18.140 -12.113  -9.582
    6   HD11  LEU  18          HD11      LEU  18 -15.529 -11.932 -11.041
    7   HD13  LEU  18          HD12      LEU  18 -17.170 -11.966 -11.686
    8   HD12  LEU  18          HD13      LEU  18 -16.433 -13.444 -11.073
    9   HD23  LEU  18          HD21      LEU  18 -16.783 -14.101  -8.937
   10   HD22  LEU  18          HD22      LEU  18 -17.155 -12.980  -7.624
   11   HD21  LEU  18          HD23      LEU  18 -15.549 -12.984  -8.352

  No H/Q in entry =          11
  In of MODEL   53
    1    H    LEU  19           H        LEU  19 -18.774  -8.588  -8.292
    2    HA   LEU  19           HA       LEU  19 -21.209  -9.844  -9.099
    3    HB2  LEU  19           HB2      LEU  19 -20.932  -8.990  -6.851
    4    HB3  LEU  19           HB3      LEU  19 -20.722  -7.354  -7.472
    5    HG   LEU  19           HG       LEU  19 -23.053  -7.246  -8.101
    6   HD11  LEU  19          HD11      LEU  19 -23.195 -10.085  -7.072
    7   HD13  LEU  19          HD12      LEU  19 -23.438  -9.559  -8.737
    8   HD12  LEU  19          HD13      LEU  19 -24.591  -9.091  -7.489
    9   HD21  LEU  19          HD21      LEU  19 -22.530  -8.208  -5.300
   10   HD23  LEU  19          HD22      LEU  19 -24.046  -7.471  -5.818
   11   HD22  LEU  19          HD23      LEU  19 -22.546  -6.545  -5.889

  No H/Q in entry =          11
  In of MODEL   53
    1    H    VAL  20           H        VAL  20 -19.811  -6.644  -9.816
    2    HA   VAL  20           HA       VAL  20 -21.965  -5.668 -11.369
    3    HB   VAL  20           HB       VAL  20 -18.996  -4.992 -11.531
    4   HG11  VAL  20          HG11      VAL  20 -21.363  -3.817 -12.988
    5   HG13  VAL  20          HG12      VAL  20 -19.828  -4.367 -13.660
    6   HG12  VAL  20          HG13      VAL  20 -19.892  -2.888 -12.701
    7   HG21  VAL  20          HG21      VAL  20 -21.352  -3.740 -10.162
    8   HG23  VAL  20          HG22      VAL  20 -19.870  -2.845 -10.491
    9   HG22  VAL  20          HG23      VAL  20 -19.824  -4.276  -9.461

  No H/Q in entry =           9
  In of MODEL   53
    1    H    SER  21           H        SER  21 -19.159  -7.641 -12.415
    2    HA   SER  21           HA       SER  21 -19.970  -7.561 -15.159
    3    HB2  SER  21           HB2      SER  21 -18.481  -9.486 -15.499
    4    HB3  SER  21           HB3      SER  21 -17.680  -8.215 -14.580
    5    HG   SER  21           HG       SER  21 -18.869  -9.775 -12.848

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LYS  22           H        LYS  22 -20.950  -9.768 -12.572
    2    HA   LYS  22           HA       LYS  22 -22.458 -11.436 -14.376
    3    HB2  LYS  22           HB2      LYS  22 -21.654 -12.124 -12.075
    4    HB3  LYS  22           HB3      LYS  22 -22.935 -11.108 -11.419
    5    HG2  LYS  22           HG2      LYS  22 -23.846 -13.247 -11.375
    6    HG3  LYS  22           HG3      LYS  22 -24.530 -12.531 -12.834
    7    HD2  LYS  22           HD2      LYS  22 -22.826 -13.680 -14.186
    8    HD3  LYS  22           HD3      LYS  22 -22.173 -14.415 -12.721
    9    HE2  LYS  22           HE2      LYS  22 -24.313 -15.566 -12.344
   10    HE3  LYS  22           HE3      LYS  22 -24.968 -14.831 -13.807
   11    HZ1  LYS  22           HZ1      LYS  22 -22.733 -16.032 -14.702
   12    HZ3  LYS  22           HZ2      LYS  22 -24.295 -16.697 -14.776
   13    HZ2  LYS  22           HZ3      LYS  22 -23.252 -17.117 -13.504

  No H/Q in entry =          13
  In of MODEL   53
    1    H    MET  23           H        MET  23 -23.246  -8.530 -12.509
    2    HA   MET  23           HA       MET  23 -26.055  -8.687 -12.990
    3    HB2  MET  23           HB2      MET  23 -24.267  -6.328 -12.440
    4    HB3  MET  23           HB3      MET  23 -26.019  -6.207 -12.603
    5    HG2  MET  23           HG2      MET  23 -26.356  -7.515 -10.627
    6    HG3  MET  23           HG3      MET  23 -24.634  -7.880 -10.515
    7    HE2  MET  23           HE1      MET  23 -27.021  -4.288  -9.315
    8    HE1  MET  23           HE2      MET  23 -27.261  -5.268 -10.761
    9    HE3  MET  23           HE3      MET  23 -26.266  -3.814 -10.837

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ARG  24           H        ARG  24 -23.356  -7.189 -14.802
    2    HA   ARG  24           HA       ARG  24 -24.906  -5.935 -16.791
    3    HB2  ARG  24           HB2      ARG  24 -22.468  -5.478 -16.425
    4    HB3  ARG  24           HB3      ARG  24 -22.100  -7.061 -17.064
    5    HG2  ARG  24           HG2      ARG  24 -22.984  -6.414 -19.293
    6    HG3  ARG  24           HG3      ARG  24 -23.414  -4.811 -18.638
    7    HD2  ARG  24           HD2      ARG  24 -21.247  -4.604 -19.721
    8    HD3  ARG  24           HD3      ARG  24 -21.010  -4.533 -17.981
    9    HE   ARG  24           HE       ARG  24 -20.575  -7.124 -18.480
   10   HH21  ARG  24          HH11      ARG  24 -18.493  -7.497 -17.721
   11   HH22  ARG  24          HH12      ARG  24 -17.174  -6.568 -18.343
   12   HH11  ARG  24          HH21      ARG  24 -19.376  -4.353 -20.007
   13   HH12  ARG  24          HH22      ARG  24 -17.706  -4.716 -19.704

  No H/Q in entry =          13
  In of MODEL   53
    1    H    ALA  25           H        ALA  25 -23.694  -9.242 -16.517
    2    HA   ALA  25           HA       ALA  25 -24.323 -10.096 -19.147
    3    HB1  ALA  25           HB1      ALA  25 -23.568 -12.107 -18.454
    4    HB3  ALA  25           HB2      ALA  25 -24.614 -12.111 -17.033
    5    HB2  ALA  25           HB3      ALA  25 -23.080 -11.244 -16.996

  No H/Q in entry =           5
  In of MODEL   53
    1    H    GLN  26           H        GLN  26 -26.122 -10.175 -16.108
    2    HA   GLN  26           HA       GLN  26 -28.443 -11.440 -17.102
    3    HB2  GLN  26           HB2      GLN  26 -27.955  -9.675 -14.723
    4    HB3  GLN  26           HB3      GLN  26 -29.501 -10.439 -15.058
    5    HG2  GLN  26           HG2      GLN  26 -26.875 -11.828 -14.609
    6    HG3  GLN  26           HG3      GLN  26 -28.229 -11.758 -13.488
    7   HE21  GLN  26          HE21      GLN  26 -26.966 -13.893 -14.771
    8   HE22  GLN  26          HE22      GLN  26 -27.989 -14.969 -15.556

  No H/Q in entry =           8
  In of MODEL   53
    1    H    ALA  27           H        ALA  27 -27.592  -8.019 -16.724
    2    HA   ALA  27           HA       ALA  27 -30.116  -6.992 -17.488
    3    HB1  ALA  27           HB1      ALA  27 -28.331  -5.629 -16.391
    4    HB3  ALA  27           HB2      ALA  27 -28.954  -4.881 -17.863
    5    HB2  ALA  27           HB3      ALA  27 -27.397  -5.708 -17.886

  No H/Q in entry =           5
  In of MODEL   53
    1    H    GLU  28           H        GLU  28 -27.400  -8.148 -19.379
    2    HA   GLU  28           HA       GLU  28 -28.383  -7.137 -21.891
    3    HB2  GLU  28           HB2      GLU  28 -25.983  -7.758 -21.287
    4    HB3  GLU  28           HB3      GLU  28 -26.487  -9.436 -21.482
    5    HG2  GLU  28           HG2      GLU  28 -25.377  -8.633 -23.461
    6    HG3  GLU  28           HG3      GLU  28 -27.069  -9.000 -23.795

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LYS  29           H        LYS  29 -28.456 -10.243 -20.230
    2    HA   LYS  29           HA       LYS  29 -29.739 -11.749 -22.222
    3    HB2  LYS  29           HB2      LYS  29 -28.647 -12.704 -20.226
    4    HB3  LYS  29           HB3      LYS  29 -29.928 -12.028 -19.220
    5    HG2  LYS  29           HG2      LYS  29 -31.562 -13.443 -20.273
    6    HG3  LYS  29           HG3      LYS  29 -30.357 -14.049 -21.406
    7    HD2  LYS  29           HD2      LYS  29 -29.170 -15.184 -19.682
    8    HD3  LYS  29           HD3      LYS  29 -30.088 -14.365 -18.420
    9    HE2  LYS  29           HE2      LYS  29 -30.783 -16.732 -18.773
   10    HE3  LYS  29           HE3      LYS  29 -32.093 -15.573 -19.008
   11    HZ1  LYS  29           HZ1      LYS  29 -31.546 -15.696 -21.439
   12    HZ3  LYS  29           HZ2      LYS  29 -32.224 -17.100 -20.767
   13    HZ2  LYS  29           HZ3      LYS  29 -30.558 -17.028 -21.079

  No H/Q in entry =          13
  In of MODEL   53
    1    H    TYR  30           H        TYR  30 -31.162  -9.678 -19.708
    2    HA   TYR  30           HA       TYR  30 -33.823 -10.195 -20.926
    3    HB2  TYR  30           HB2      TYR  30 -33.176  -9.023 -18.211
    4    HB3  TYR  30           HB3      TYR  30 -34.792  -9.323 -18.851
    5    HD1  TYR  30           HD1      TYR  30 -35.645 -11.637 -19.054
    6    HD2  TYR  30           HD2      TYR  30 -31.816 -10.815 -17.385
    7    HE1  TYR  30           HE1      TYR  30 -35.490 -13.961 -18.257
    8    HE2  TYR  30           HE2      TYR  30 -31.662 -13.125 -16.591
    9    HH   TYR  30           HH       TYR  30 -33.249 -15.528 -17.668

  No H/Q in entry =           9
  In of MODEL   53
    1    H    GLU  31           H        GLU  31 -31.715  -8.150 -21.746
    2    HA   GLU  31           HA       GLU  31 -31.704  -5.992 -22.572
    3    HB2  GLU  31           HB2      GLU  31 -34.585  -6.783 -23.059
    4    HB3  GLU  31           HB3      GLU  31 -33.785  -5.395 -23.797
    5    HG2  GLU  31           HG2      GLU  31 -32.286  -6.796 -24.999
    6    HG3  GLU  31           HG3      GLU  31 -32.807  -8.223 -24.105

  No H/Q in entry =           6
  In of MODEL   53
    1    H    VAL  32           H        VAL  32 -31.883  -5.893 -19.837
    2    HA   VAL  32           HA       VAL  32 -33.795  -3.830 -19.165
    3    HB   VAL  32           HB       VAL  32 -31.364  -4.758 -17.603
    4   HG12  VAL  32          HG11      VAL  32 -32.904  -3.974 -15.695
    5   HG11  VAL  32          HG12      VAL  32 -33.771  -3.093 -16.953
    6   HG13  VAL  32          HG13      VAL  32 -32.070  -2.744 -16.647
    7   HG21  VAL  32          HG21      VAL  32 -33.092  -6.526 -18.275
    8   HG23  VAL  32          HG22      VAL  32 -34.143  -5.724 -17.107
    9   HG22  VAL  32          HG23      VAL  32 -32.603  -6.407 -16.585

  No H/Q in entry =           9
  In of MODEL   53
    1    HA   PRO  33           HA       PRO  33 -30.856  -0.823 -20.865
    2    HB2  PRO  33           HB2      PRO  33 -32.426   1.358 -20.730
    3    HB3  PRO  33           HB3      PRO  33 -32.868   0.043 -21.819
    4    HG2  PRO  33           HG2      PRO  33 -33.826   0.536 -18.999
    5    HG3  PRO  33           HG3      PRO  33 -34.797   0.300 -20.452
    6    HD2  PRO  33           HD2      PRO  33 -34.271  -1.758 -18.789
    7    HD3  PRO  33           HD3      PRO  33 -34.342  -2.002 -20.535

  No H/Q in entry =           7
  In of MODEL   53
    1    H    VAL  34           H        VAL  34 -29.561  -1.331 -18.927
    2    HA   VAL  34           HA       VAL  34 -29.329   1.103 -17.284
    3    HB   VAL  34           HB       VAL  34 -28.693  -0.341 -15.350
    4   HG12  VAL  34          HG11      VAL  34 -31.077  -1.280 -15.021
    5   HG11  VAL  34          HG12      VAL  34 -31.428  -0.529 -16.577
    6   HG13  VAL  34          HG13      VAL  34 -30.890   0.462 -15.222
    7   HG21  VAL  34          HG21      VAL  34 -28.839  -2.373 -17.355
    8   HG23  VAL  34          HG22      VAL  34 -29.875  -2.762 -15.980
    9   HG22  VAL  34          HG23      VAL  34 -28.162  -2.429 -15.728

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ILE  35           H        ILE  35 -27.360   1.592 -16.460
    2    HA   ILE  35           HA       ILE  35 -25.030   0.326 -17.743
    3    HB   ILE  35           HB       ILE  35 -25.503   3.204 -16.930
    4   HG12  ILE  35          HG12      ILE  35 -24.506   1.924 -19.482
    5   HG13  ILE  35          HG13      ILE  35 -26.151   2.499 -19.208
    6   HG21  ILE  35          HG21      ILE  35 -22.901   1.743 -17.260
    7   HG23  ILE  35          HG22      ILE  35 -23.378   2.910 -16.028
    8   HG22  ILE  35          HG23      ILE  35 -23.025   3.454 -17.668
    9   HD11  ILE  35          HD11      ILE  35 -24.806   4.732 -18.621
   10   HD13  ILE  35          HD12      ILE  35 -25.346   4.333 -20.252
   11   HD12  ILE  35          HD13      ILE  35 -23.681   4.010 -19.770

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ILE  36           H        ILE  36 -23.757  -0.662 -16.154
    2    HA   ILE  36           HA       ILE  36 -24.190  -0.058 -13.280
    3    HB   ILE  36           HB       ILE  36 -23.297  -2.737 -14.394
    4   HG12  ILE  36          HG12      ILE  36 -26.119  -2.009 -13.606
    5   HG13  ILE  36          HG13      ILE  36 -25.562  -1.974 -15.279
    6   HG23  ILE  36          HG21      ILE  36 -23.607  -3.574 -12.278
    7   HG22  ILE  36          HG22      ILE  36 -24.765  -2.322 -11.829
    8   HG21  ILE  36          HG23      ILE  36 -23.045  -1.942 -11.915
    9   HD13  ILE  36          HD11      ILE  36 -25.668  -4.192 -15.483
   10   HD12  ILE  36          HD12      ILE  36 -26.724  -4.099 -14.075
   11   HD11  ILE  36          HD13      ILE  36 -25.013  -4.471 -13.871

  No H/Q in entry =          11
  In of MODEL   53
    1    H    GLU  37           H        GLU  37 -22.417   0.622 -12.191
    2    HA   GLU  37           HA       GLU  37 -19.713  -0.100 -13.131
    3    HB2  GLU  37           HB2      GLU  37 -20.623   2.668 -12.353
    4    HB3  GLU  37           HB3      GLU  37 -18.952   2.191 -12.652
    5    HG2  GLU  37           HG2      GLU  37 -21.159   2.215 -14.692
    6    HG3  GLU  37           HG3      GLU  37 -19.915   3.451 -14.502

  No H/Q in entry =           6
  In of MODEL   53
    1    H    ALA  38           H        ALA  38 -18.206  -0.293 -11.461
    2    HA   ALA  38           HA       ALA  38 -19.218  -0.143  -8.681
    3    HB1  ALA  38           HB1      ALA  38 -17.461  -2.033 -10.122
    4    HB3  ALA  38           HB2      ALA  38 -18.492  -2.298  -8.715
    5    HB2  ALA  38           HB3      ALA  38 -16.898  -1.569  -8.516

  No H/Q in entry =           5
  In of MODEL   53
    1    H    PHE  39           H        PHE  39 -17.999   1.103  -7.220
    2    HA   PHE  39           HA       PHE  39 -15.518   2.378  -8.139
    3    HB2  PHE  39           HB2      PHE  39 -17.954   3.801  -7.079
    4    HB3  PHE  39           HB3      PHE  39 -16.344   4.515  -7.049
    5    HD1  PHE  39           HD1      PHE  39 -15.098   4.580  -9.329
    6    HD2  PHE  39           HD2      PHE  39 -19.319   4.163  -8.886
    7    HE1  PHE  39           HE1      PHE  39 -15.412   5.423 -11.639
    8    HE2  PHE  39           HE2      PHE  39 -19.649   4.995 -11.187
    9    HZ   PHE  39           HZ       PHE  39 -17.699   5.600 -12.581

  No H/Q in entry =           9
  In of MODEL   53
    1    HA   PRO  40           HA       PRO  40 -14.520   1.655  -3.860
    2    HB2  PRO  40           HB2      PRO  40 -12.809   3.721  -3.270
    3    HB3  PRO  40           HB3      PRO  40 -12.336   2.403  -4.341
    4    HG2  PRO  40           HG2      PRO  40 -13.446   5.107  -5.079
    5    HG3  PRO  40           HG3      PRO  40 -12.003   4.306  -5.699
    6    HD2  PRO  40           HD2      PRO  40 -14.233   4.150  -7.089
    7    HD3  PRO  40           HD3      PRO  40 -13.232   2.712  -6.902

  No H/Q in entry =           7
  In of MODEL   53
    1    H    GLU  41           H        GLU  41 -15.152   2.615  -1.726
    2    HA   GLU  41           HA       GLU  41 -17.448   4.249  -1.690
    3    HB2  GLU  41           HB2      GLU  41 -17.128   4.307   0.743
    4    HB3  GLU  41           HB3      GLU  41 -16.944   2.674   0.102
    5    HG2  GLU  41           HG2      GLU  41 -15.223   2.772   1.620
    6    HG3  GLU  41           HG3      GLU  41 -14.406   3.228   0.125

  No H/Q in entry =           6
  In of MODEL   53
    1    H    THR  42           H        THR  42 -14.146   5.267  -1.771
    2    HA   THR  42           HA       THR  42 -14.567   7.816  -0.558
    3    HB   THR  42           HB       THR  42 -12.439   8.455  -1.674
    4    HG1  THR  42           HG1      THR  42 -12.314   5.831  -2.687
    5   HG23  THR  42          HG21      THR  42 -11.054   6.997  -0.426
    6   HG22  THR  42          HG22      THR  42 -12.178   5.649  -0.605
    7   HG21  THR  42          HG23      THR  42 -12.588   7.003   0.446

  No H/Q in entry =           7
  In of MODEL   53
    1    H    LEU  43           H        LEU  43 -15.464   6.693  -3.649
    2    HA   LEU  43           HA       LEU  43 -15.811   9.454  -4.618
    3    HB2  LEU  43           HB2      LEU  43 -16.083   6.791  -5.999
    4    HB3  LEU  43           HB3      LEU  43 -16.389   8.351  -6.759
    5    HG   LEU  43           HG       LEU  43 -13.703   7.413  -5.781
    6   HD12  LEU  43          HD11      LEU  43 -14.520   7.767  -8.643
    7   HD11  LEU  43          HD12      LEU  43 -14.810   6.240  -7.809
    8   HD13  LEU  43          HD13      LEU  43 -13.166   6.855  -7.975
    9   HD21  LEU  43          HD21      LEU  43 -14.700   9.883  -7.184
   10   HD23  LEU  43          HD22      LEU  43 -13.018   9.365  -7.308
   11   HD22  LEU  43          HD23      LEU  43 -13.704   9.763  -5.734

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ALA  44           H        ALA  44 -17.683   7.572  -2.747
    2    HA   ALA  44           HA       ALA  44 -20.167   7.354  -4.047
    3    HB2  ALA  44           HB1      ALA  44 -19.975   6.245  -1.952
    4    HB3  ALA  44           HB2      ALA  44 -21.122   7.555  -1.670
    5    HB1  ALA  44           HB3      ALA  44 -19.450   7.715  -1.132

  No H/Q in entry =           5
  In of MODEL   53
    1    H    GLY  45           H        GLY  45 -18.821  10.199  -2.529
    2    HA3  GLY  45           HA2      GLY  45 -21.306  11.622  -2.869
    3    HA2  GLY  45           HA3      GLY  45 -19.777  12.295  -2.306

  No H/Q in entry =           3
  In of MODEL   53
    1    H    GLU  46           H        GLU  46 -18.238  11.404  -4.610
    2    HA   GLU  46           HA       GLU  46 -18.958  13.597  -6.374
    3    HB2  GLU  46           HB2      GLU  46 -16.612  13.165  -5.769
    4    HB3  GLU  46           HB3      GLU  46 -16.717  11.573  -6.520
    5    HG2  GLU  46           HG2      GLU  46 -15.582  12.993  -8.033
    6    HG3  GLU  46           HG3      GLU  46 -17.197  12.719  -8.686

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LYS  47           H        LYS  47 -18.735  10.083  -6.808
    2    HA   LYS  47           HA       LYS  47 -19.863  10.266  -9.474
    3    HB2  LYS  47           HB2      LYS  47 -18.609   8.208  -7.807
    4    HB3  LYS  47           HB3      LYS  47 -19.978   7.618  -8.749
    5    HG2  LYS  47           HG2      LYS  47 -17.945   7.263  -9.970
    6    HG3  LYS  47           HG3      LYS  47 -18.910   8.493 -10.782
    7    HD2  LYS  47           HD2      LYS  47 -17.564  10.247  -9.761
    8    HD3  LYS  47           HD3      LYS  47 -16.616   9.033  -8.903
    9    HE2  LYS  47           HE2      LYS  47 -15.845   8.122 -11.030
   10    HE3  LYS  47           HE3      LYS  47 -16.812   9.315 -11.897
   11    HZ3  LYS  47           HZ1      LYS  47 -15.368  10.944 -11.449
   12    HZ2  LYS  47           HZ2      LYS  47 -14.266   9.666 -11.264
   13    HZ1  LYS  47           HZ3      LYS  47 -14.996  10.362  -9.897

  No H/Q in entry =          13
  In of MODEL   53
    1    H    GLY  48           H        GLY  48 -21.133   9.472  -6.314
    2    HA3  GLY  48           HA2      GLY  48 -23.487   8.212  -7.033
    3    HA2  GLY  48           HA3      GLY  48 -23.280   9.215  -5.596

  No H/Q in entry =           3
  In of MODEL   53
    1    H    GLN  49           H        GLN  49 -22.786  11.652  -7.174
    2    HA   GLN  49           HA       GLN  49 -25.379  12.685  -7.297
    3    HB2  GLN  49           HB2      GLN  49 -22.876  13.625  -8.680
    4    HB3  GLN  49           HB3      GLN  49 -24.366  14.545  -8.583
    5    HG2  GLN  49           HG2      GLN  49 -24.186  14.576  -6.148
    6    HG3  GLN  49           HG3      GLN  49 -22.708  13.635  -6.243
    7   HE21  GLN  49          HE21      GLN  49 -22.649  15.868  -4.973
    8   HE22  GLN  49          HE22      GLN  49 -21.770  17.150  -5.630

  No H/Q in entry =           8
  In of MODEL   53
    1    H    ASN  50           H        ASN  50 -23.664  10.855  -9.697
    2    HA   ASN  50           HA       ASN  50 -25.592  11.666 -11.763
    3    HB2  ASN  50           HB2      ASN  50 -22.969  10.206 -12.018
    4    HB3  ASN  50           HB3      ASN  50 -24.042  10.598 -13.353
    5   HD21  ASN  50          HD21      ASN  50 -21.419  11.526 -11.766
    6   HD22  ASN  50          HD22      ASN  50 -21.239  13.168 -12.112

  No H/Q in entry =           6
  In of MODEL   53
    1    H    ALA  51           H        ALA  51 -25.486   9.314  -9.516
    2    HA   ALA  51           HA       ALA  51 -26.220   7.144 -11.333
    3    HB2  ALA  51           HB1      ALA  51 -25.581   5.815  -9.650
    4    HB3  ALA  51           HB2      ALA  51 -26.718   6.590  -8.549
    5    HB1  ALA  51           HB3      ALA  51 -25.101   7.261  -8.761

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ASP  52           H        ASP  52 -28.191   6.029 -11.175
    2    HA   ASP  52           HA       ASP  52 -30.421   7.797 -10.491
    3    HB2  ASP  52           HB2      ASP  52 -30.170   5.297 -12.161
    4    HB3  ASP  52           HB3      ASP  52 -31.732   5.983 -11.713

  No H/Q in entry =           4
  In of MODEL   53
    1    H    VAL  53           H        VAL  53 -28.725   4.958  -9.487
    2    HA   VAL  53           HA       VAL  53 -30.147   5.045  -6.959
    3    HB   VAL  53           HB       VAL  53 -31.507   3.360  -8.189
    4   HG11  VAL  53          HG11      VAL  53 -29.749   2.552  -9.725
    5   HG13  VAL  53          HG12      VAL  53 -30.536   1.233  -8.858
    6   HG12  VAL  53          HG13      VAL  53 -28.937   1.784  -8.362
    7   HG23  VAL  53          HG21      VAL  53 -30.612   1.411  -6.502
    8   HG22  VAL  53          HG22      VAL  53 -31.776   2.682  -6.127
    9   HG21  VAL  53          HG23      VAL  53 -30.072   2.905  -5.735

  No H/Q in entry =           9
  In of MODEL   53
    1    H    VAL  54           H        VAL  54 -28.806   4.653  -5.315
    2    HA   VAL  54           HA       VAL  54 -26.028   3.883  -5.950
    3    HB   VAL  54           HB       VAL  54 -27.130   5.632  -3.692
    4   HG11  VAL  54          HG11      VAL  54 -24.514   4.289  -4.005
    5   HG13  VAL  54          HG12      VAL  54 -25.274   4.947  -2.557
    6   HG12  VAL  54          HG13      VAL  54 -24.409   6.016  -3.662
    7   HG22  VAL  54          HG21      VAL  54 -26.334   7.469  -4.801
    8   HG21  VAL  54          HG22      VAL  54 -26.865   6.462  -6.148
    9   HG23  VAL  54          HG23      VAL  54 -25.155   6.538  -5.724

  No H/Q in entry =           9
  In of MODEL   53
    1    H    LEU  55           H        LEU  55 -25.375   1.981  -5.311
    2    HA   LEU  55           HA       LEU  55 -26.825   0.630  -3.121
    3    HB2  LEU  55           HB2      LEU  55 -25.255  -0.496  -5.430
    4    HB3  LEU  55           HB3      LEU  55 -25.977  -1.450  -4.133
    5    HG   LEU  55           HG       LEU  55 -27.478   0.092  -6.238
    6   HD13  LEU  55          HD11      LEU  55 -27.136  -1.752  -7.460
    7   HD12  LEU  55          HD12      LEU  55 -28.057  -2.653  -6.255
    8   HD11  LEU  55          HD13      LEU  55 -26.303  -2.537  -6.120
    9   HD23  LEU  55          HD21      LEU  55 -28.700  -1.887  -4.371
   10   HD22  LEU  55          HD22      LEU  55 -29.442  -0.527  -5.213
   11   HD21  LEU  55          HD23      LEU  55 -28.417  -0.241  -3.807

  No H/Q in entry =          11
  In of MODEL   53
    1    H    LEU  56           H        LEU  56 -25.641   0.071  -1.326
    2    HA   LEU  56           HA       LEU  56 -22.719   0.550  -1.402
    3    HB2  LEU  56           HB2      LEU  56 -24.494   0.290   1.013
    4    HB3  LEU  56           HB3      LEU  56 -22.798   0.769   0.986
    5    HG   LEU  56           HG       LEU  56 -25.153   2.379   0.041
    6   HD11  LEU  56          HD11      LEU  56 -24.005   2.032   2.552
    7   HD13  LEU  56          HD12      LEU  56 -25.039   3.372   2.053
    8   HD12  LEU  56          HD13      LEU  56 -23.285   3.527   1.950
    9   HD23  LEU  56          HD21      LEU  56 -23.259   4.132  -0.171
   10   HD22  LEU  56          HD22      LEU  56 -23.622   3.024  -1.494
   11   HD21  LEU  56          HD23      LEU  56 -22.250   2.711  -0.432

  No H/Q in entry =          11
  In of MODEL   53
    1    H    GLY  57           H        GLY  57 -21.289  -1.039  -0.878
    2    HA3  GLY  57           HA2      GLY  57 -22.139  -3.751  -1.066
    3    HA2  GLY  57           HA3      GLY  57 -20.524  -3.211  -0.608

  No H/Q in entry =           3
  In of MODEL   53
    1    HA   PRO  58           HA       PRO  58 -23.268  -4.325   3.134
    2    HB2  PRO  58           HB2      PRO  58 -22.505  -6.908   3.738
    3    HB3  PRO  58           HB3      PRO  58 -23.909  -6.540   2.736
    4    HG2  PRO  58           HG2      PRO  58 -21.165  -7.344   1.927
    5    HG3  PRO  58           HG3      PRO  58 -22.721  -7.849   1.270
    6    HD2  PRO  58           HD2      PRO  58 -21.176  -5.988   0.031
    7    HD3  PRO  58           HD3      PRO  58 -22.937  -5.952  -0.055

  No H/Q in entry =           7
  In of MODEL   53
    1    H    GLN  59           H        GLN  59 -19.891  -4.702   2.498
    2    HA   GLN  59           HA       GLN  59 -19.112  -4.695   5.252
    3    HB2  GLN  59           HB2      GLN  59 -17.594  -3.852   2.780
    4    HB3  GLN  59           HB3      GLN  59 -16.898  -3.935   4.385
    5    HG2  GLN  59           HG2      GLN  59 -18.060  -6.256   2.853
    6    HG3  GLN  59           HG3      GLN  59 -16.349  -5.893   3.016
    7   HE21  GLN  59          HE21      GLN  59 -15.496  -6.811   4.495
    8   HE22  GLN  59          HE22      GLN  59 -15.805  -7.610   5.921

  No H/Q in entry =           8
  In of MODEL   53
    1    H    ILE  60           H        ILE  60 -20.137  -2.174   3.049
    2    HA   ILE  60           HA       ILE  60 -19.321  -0.190   5.085
    3    HB   ILE  60           HB       ILE  60 -19.628   1.528   3.255
    4   HG12  ILE  60          HG12      ILE  60 -19.363  -0.700   1.281
    5   HG13  ILE  60          HG13      ILE  60 -20.965  -0.209   1.833
    6   HG21  ILE  60          HG21      ILE  60 -17.453   0.466   3.995
    7   HG23  ILE  60          HG22      ILE  60 -17.471   1.288   2.436
    8   HG22  ILE  60          HG23      ILE  60 -17.543  -0.472   2.504
    9   HD12  ILE  60          HD11      ILE  60 -18.978   1.319   0.191
   10   HD11  ILE  60          HD12      ILE  60 -20.145   2.194   1.181
   11   HD13  ILE  60          HD13      ILE  60 -20.707   1.089  -0.073

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ALA  61           H        ALA  61 -21.731  -1.844   5.178
    2    HA   ALA  61           HA       ALA  61 -24.007  -0.244   4.738
    3    HB1  ALA  61           HB1      ALA  61 -25.168  -1.765   6.076
    4    HB2  ALA  61           HB2      ALA  61 -23.750  -2.114   7.066
    5    HB3  ALA  61           HB3      ALA  61 -23.844  -2.725   5.414

  No H/Q in entry =           5
  In of MODEL   53
    1    H    TYR  62           H        TYR  62 -21.772  -0.290   7.516
    2    HA   TYR  62           HA       TYR  62 -23.358   1.325   9.199
    3    HB2  TYR  62           HB2      TYR  62 -21.327   1.800  10.419
    4    HB3  TYR  62           HB3      TYR  62 -21.327   0.103   9.942
    5    HD1  TYR  62           HD1      TYR  62 -19.723  -0.732   8.274
    6    HD2  TYR  62           HD2      TYR  62 -19.679   3.365   9.486
    7    HE1  TYR  62           HE1      TYR  62 -17.527  -0.441   7.193
    8    HE2  TYR  62           HE2      TYR  62 -17.469   3.651   8.406
    9    HH   TYR  62           HH       TYR  62 -15.571   2.200   7.760

  No H/Q in entry =           9
  In of MODEL   53
    1    H    MET  63           H        MET  63 -21.766   2.225   6.327
    2    HA   MET  63           HA       MET  63 -21.671   5.063   7.016
    3    HB2  MET  63           HB2      MET  63 -21.048   3.556   4.475
    4    HB3  MET  63           HB3      MET  63 -20.897   5.305   4.657
    5    HG2  MET  63           HG2      MET  63 -19.151   5.015   6.295
    6    HG3  MET  63           HG3      MET  63 -19.339   3.264   6.220
    7    HE1  MET  63           HE1      MET  63 -18.900   6.381   4.459
    8    HE3  MET  63           HE2      MET  63 -18.844   5.874   2.771
    9    HE2  MET  63           HE3      MET  63 -17.345   6.179   3.648

  No H/Q in entry =           9
  In of MODEL   53
    1    H    LEU  64           H        LEU  64 -24.192   3.137   6.077
    2    HA   LEU  64           HA       LEU  64 -25.458   4.518   4.009
    3    HB2  LEU  64           HB2      LEU  64 -26.261   2.391   4.936
    4    HB3  LEU  64           HB3      LEU  64 -26.727   3.223   6.420
    5    HG   LEU  64           HG       LEU  64 -28.467   4.429   5.206
    6   HD13  LEU  64          HD11      LEU  64 -28.212   4.675   2.970
    7   HD12  LEU  64          HD12      LEU  64 -28.814   3.023   2.833
    8   HD11  LEU  64          HD13      LEU  64 -27.078   3.329   2.874
    9   HD23  LEU  64          HD21      LEU  64 -28.915   1.602   4.466
   10   HD22  LEU  64          HD22      LEU  64 -29.926   2.710   5.394
   11   HD21  LEU  64          HD23      LEU  64 -28.523   1.955   6.148

  No H/Q in entry =          11
  In of MODEL   53
    1    HA   PRO  65           HA       PRO  65 -27.699   7.616   6.776
    2    HB2  PRO  65           HB2      PRO  65 -25.682   7.832   9.011
    3    HB3  PRO  65           HB3      PRO  65 -27.427   8.066   9.074
    4    HG2  PRO  65           HG2      PRO  65 -26.429   5.838   9.994
    5    HG3  PRO  65           HG3      PRO  65 -27.857   5.766   8.963
    6    HD2  PRO  65           HD2      PRO  65 -24.976   5.227   8.233
    7    HD3  PRO  65           HD3      PRO  65 -26.413   4.302   7.800

  No H/Q in entry =           7
  In of MODEL   53
    1    H    GLU  66           H        GLU  66 -24.142   7.655   6.816
    2    HA   GLU  66           HA       GLU  66 -23.921  10.460   6.406
    3    HB2  GLU  66           HB2      GLU  66 -22.055   8.200   5.739
    4    HB3  GLU  66           HB3      GLU  66 -21.651   9.903   5.526
    5    HG2  GLU  66           HG2      GLU  66 -21.851  10.271   7.895
    6    HG3  GLU  66           HG3      GLU  66 -22.330   8.591   8.133

  No H/Q in entry =           6
  In of MODEL   53
    1    H    ILE  67           H        ILE  67 -23.973   7.709   4.158
    2    HA   ILE  67           HA       ILE  67 -23.623   9.425   1.858
    3    HB   ILE  67           HB       ILE  67 -24.444   6.496   2.049
    4   HG12  ILE  67          HG12      ILE  67 -21.854   7.732   1.101
    5   HG13  ILE  67          HG13      ILE  67 -22.123   7.307   2.791
    6   HG21  ILE  67          HG21      ILE  67 -24.456   8.372  -0.178
    7   HG23  ILE  67          HG22      ILE  67 -25.038   6.709  -0.119
    8   HG22  ILE  67          HG23      ILE  67 -23.341   7.037  -0.465
    9   HD12  ILE  67          HD11      ILE  67 -21.679   5.544   0.439
   10   HD11  ILE  67          HD12      ILE  67 -22.665   4.947   1.772
   11   HD13  ILE  67          HD13      ILE  67 -21.002   5.454   2.065

  No H/Q in entry =          11
  In of MODEL   53
    1    H    GLN  68           H        GLN  68 -26.449   8.301   3.520
    2    HA   GLN  68           HA       GLN  68 -28.320   9.184   1.563
    3    HB2  GLN  68           HB2      GLN  68 -28.538   8.823   4.549
    4    HB3  GLN  68           HB3      GLN  68 -29.881   9.384   3.567
    5    HG2  GLN  68           HG2      GLN  68 -29.871   7.352   2.294
    6    HG3  GLN  68           HG3      GLN  68 -28.401   6.813   3.083
    7   HE21  GLN  68          HE21      GLN  68 -30.546   5.402   2.970
    8   HE22  GLN  68          HE22      GLN  68 -31.351   4.927   4.394

  No H/Q in entry =           8
  In of MODEL   53
    1    H    ARG  69           H        ARG  69 -26.729  10.892   4.283
    2    HA   ARG  69           HA       ARG  69 -28.157  13.341   3.888
    3    HB2  ARG  69           HB2      ARG  69 -25.775  12.469   5.454
    4    HB3  ARG  69           HB3      ARG  69 -25.898  14.186   5.095
    5    HG2  ARG  69           HG2      ARG  69 -28.206  14.175   6.089
    6    HG3  ARG  69           HG3      ARG  69 -27.954  12.491   6.563
    7    HD2  ARG  69           HD2      ARG  69 -26.308  14.886   7.458
    8    HD3  ARG  69           HD3      ARG  69 -27.406  13.955   8.463
    9    HE   ARG  69           HE       ARG  69 -24.782  13.084   7.490
   10   HH21  ARG  69          HH11      ARG  69 -23.921  11.341   8.679
   11   HH22  ARG  69          HH12      ARG  69 -24.919  10.503   9.818
   12   HH11  ARG  69          HH21      ARG  69 -27.708  12.469   9.216
   13   HH12  ARG  69          HH22      ARG  69 -27.063  11.139  10.120

  No H/Q in entry =          13
  In of MODEL   53
    1    H    LEU  70           H        LEU  70 -25.267  11.999   2.501
    2    HA   LEU  70           HA       LEU  70 -24.220  14.389   1.320
    3    HB2  LEU  70           HB2      LEU  70 -23.167  12.096   1.907
    4    HB3  LEU  70           HB3      LEU  70 -23.785  11.614   0.329
    5    HG   LEU  70           HG       LEU  70 -22.236  13.021  -0.774
    6   HD11  LEU  70          HD11      LEU  70 -21.405  13.887   2.005
    7   HD13  LEU  70          HD12      LEU  70 -22.136  14.903   0.763
    8   HD12  LEU  70          HD13      LEU  70 -20.512  14.260   0.528
    9   HD22  LEU  70          HD21      LEU  70 -20.761  11.339  -0.554
   10   HD21  LEU  70          HD22      LEU  70 -21.661  10.796   0.863
   11   HD23  LEU  70          HD23      LEU  70 -20.299  11.901   1.052

  No H/Q in entry =          11
  In of MODEL   53
    1    H    LEU  71           H        LEU  71 -26.326  11.796   0.228
    2    HA   LEU  71           HA       LEU  71 -26.909  13.269  -2.284
    3    HB2  LEU  71           HB2      LEU  71 -27.044  10.282  -1.833
    4    HB3  LEU  71           HB3      LEU  71 -27.207  11.137  -3.366
    5    HG   LEU  71           HG       LEU  71 -24.671  11.207  -1.730
    6   HD12  LEU  71          HD11      LEU  71 -24.713   9.576  -4.160
    7   HD11  LEU  71          HD12      LEU  71 -25.696   8.932  -2.847
    8   HD13  LEU  71          HD13      LEU  71 -23.980   9.249  -2.590
    9   HD22  LEU  71          HD21      LEU  71 -24.828  13.019  -3.224
   10   HD21  LEU  71          HD22      LEU  71 -25.316  11.965  -4.550
   11   HD23  LEU  71          HD23      LEU  71 -23.685  11.854  -3.889

  No H/Q in entry =          11
  In of MODEL   53
    1    HA   PRO  72           HA       PRO  72 -30.738  12.740   0.376
    2    HB2  PRO  72           HB2      PRO  72 -31.650  15.282   0.301
    3    HB3  PRO  72           HB3      PRO  72 -30.322  14.859   1.379
    4    HG2  PRO  72           HG2      PRO  72 -30.188  16.054  -1.377
    5    HG3  PRO  72           HG3      PRO  72 -29.418  16.623   0.104
    6    HD2  PRO  72           HD2      PRO  72 -28.066  15.091  -1.674
    7    HD3  PRO  72           HD3      PRO  72 -27.791  14.932   0.060

  No H/Q in entry =           7
  In of MODEL   53
    1    H    ASN  73           H        ASN  73 -30.167  13.704  -2.846
    2    HA   ASN  73           HA       ASN  73 -33.026  13.337  -3.449
    3    HB2  ASN  73           HB2      ASN  73 -32.604  14.450  -5.552
    4    HB3  ASN  73           HB3      ASN  73 -32.088  15.442  -4.197
    5   HD21  ASN  73          HD21      ASN  73 -31.320  15.500  -6.882
    6   HD22  ASN  73          HD22      ASN  73 -29.651  15.372  -7.091

  No H/Q in entry =           6
  In of MODEL   53
    1    H    LYS  74           H        LYS  74 -30.996  11.122  -3.042
    2    HA   LYS  74           HA       LYS  74 -31.562   9.713  -5.583
    3    HB2  LYS  74           HB2      LYS  74 -29.008   9.473  -3.987
    4    HB3  LYS  74           HB3      LYS  74 -29.391   8.652  -5.500
    5    HG2  LYS  74           HG2      LYS  74 -29.182  11.626  -5.303
    6    HG3  LYS  74           HG3      LYS  74 -27.791  10.590  -5.621
    7    HD2  LYS  74           HD2      LYS  74 -28.909   9.638  -7.552
    8    HD3  LYS  74           HD3      LYS  74 -30.345  10.608  -7.219
    9    HE2  LYS  74           HE2      LYS  74 -29.162  12.637  -7.674
   10    HE3  LYS  74           HE3      LYS  74 -27.625  11.777  -7.781
   11    HZ2  LYS  74           HZ1      LYS  74 -29.128  12.349  -9.891
   12    HZ1  LYS  74           HZ2      LYS  74 -29.750  10.814  -9.511
   13    HZ3  LYS  74           HZ3      LYS  74 -28.092  11.006  -9.825

  No H/Q in entry =          13
  In of MODEL   53
    1    HA   PRO  75           HA       PRO  75 -32.870   6.706  -2.595
    2    HB2  PRO  75           HB2      PRO  75 -33.153   4.480  -4.172
    3    HB3  PRO  75           HB3      PRO  75 -34.305   5.813  -4.231
    4    HG2  PRO  75           HG2      PRO  75 -31.974   5.258  -6.025
    5    HG3  PRO  75           HG3      PRO  75 -33.635   5.663  -6.456
    6    HD2  PRO  75           HD2      PRO  75 -31.729   7.565  -6.435
    7    HD3  PRO  75           HD3      PRO  75 -33.362   7.934  -5.880

  No H/Q in entry =           7
  In of MODEL   53
    1    H    VAL  76           H        VAL  76 -31.384   5.680  -1.236
    2    HA   VAL  76           HA       VAL  76 -28.907   4.515  -2.366
    3    HB   VAL  76           HB       VAL  76 -29.197   5.979   0.293
    4   HG11  VAL  76          HG11      VAL  76 -26.831   4.734  -1.120
    5   HG13  VAL  76          HG12      VAL  76 -27.504   4.273   0.445
    6   HG12  VAL  76          HG13      VAL  76 -26.688   5.825   0.259
    7   HG22  VAL  76          HG21      VAL  76 -28.573   7.891  -0.602
    8   HG21  VAL  76          HG22      VAL  76 -29.118   7.183  -2.124
    9   HG23  VAL  76          HG23      VAL  76 -27.410   7.127  -1.686

  No H/Q in entry =           9
  In of MODEL   53
    1    H    GLU  77           H        GLU  77 -28.644   2.366  -1.752
    2    HA   GLU  77           HA       GLU  77 -29.391   1.567   0.910
    3    HB2  GLU  77           HB2      GLU  77 -30.972  -0.110   0.397
    4    HB3  GLU  77           HB3      GLU  77 -31.556   1.401  -0.301
    5    HG2  GLU  77           HG2      GLU  77 -30.954   0.652  -2.494
    6    HG3  GLU  77           HG3      GLU  77 -30.279  -0.832  -1.825

  No H/Q in entry =           6
  In of MODEL   53
    1    H    VAL  78           H        VAL  78 -29.018  -0.511   1.569
    2    HA   VAL  78           HA       VAL  78 -26.347  -1.234   0.657
    3    HB   VAL  78           HB       VAL  78 -28.015  -2.147   3.039
    4   HG11  VAL  78          HG11      VAL  78 -25.664  -3.333   1.893
    5   HG13  VAL  78          HG12      VAL  78 -26.549  -3.819   3.341
    6   HG12  VAL  78          HG13      VAL  78 -25.250  -2.633   3.457
    7   HG22  VAL  78          HG21      VAL  78 -26.569  -0.755   4.361
    8   HG21  VAL  78          HG22      VAL  78 -27.336   0.199   3.092
    9   HG23  VAL  78          HG23      VAL  78 -25.650  -0.297   2.927

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ILE  79           H        ILE  79 -25.782  -3.133  -0.252
    2    HA   ILE  79           HA       ILE  79 -27.827  -4.652  -1.577
    3    HB   ILE  79           HB       ILE  79 -24.825  -5.121  -1.384
    4   HG12  ILE  79          HG12      ILE  79 -26.504  -4.052  -3.658
    5   HG13  ILE  79          HG13      ILE  79 -25.639  -3.024  -2.516
    6   HG22  ILE  79          HG21      ILE  79 -25.927  -6.325  -3.691
    7   HG21  ILE  79          HG22      ILE  79 -26.889  -6.863  -2.314
    8   HG23  ILE  79          HG23      ILE  79 -25.142  -7.109  -2.320
    9   HD13  ILE  79          HD11      ILE  79 -24.240  -3.114  -4.347
   10   HD12  ILE  79          HD12      ILE  79 -24.550  -4.829  -4.622
   11   HD11  ILE  79          HD13      ILE  79 -23.562  -4.319  -3.251

  No H/Q in entry =          11
  In of MODEL   53
    1    H    ASP  80           H        ASP  80 -28.650  -6.590  -0.983
    2    HA   ASP  80           HA       ASP  80 -28.554  -7.485   1.664
    3    HB2  ASP  80           HB2      ASP  80 -30.312  -8.097   0.042
    4    HB3  ASP  80           HB3      ASP  80 -29.144  -9.084  -0.836

  No H/Q in entry =           4
  In of MODEL   53
    1    H    SER  81           H        SER  81 -26.987  -8.589   2.781
    2    HA   SER  81           HA       SER  81 -24.489  -9.226   1.567
    3    HB2  SER  81           HB2      SER  81 -23.894 -10.235   3.731
    4    HB3  SER  81           HB3      SER  81 -24.632  -8.649   3.951
    5    HG   SER  81           HG       SER  81 -26.068 -11.066   4.092

  No H/Q in entry =           5
  In of MODEL   53
    1    H    LEU  82           H        LEU  82 -27.156 -11.367   1.917
    2    HA   LEU  82           HA       LEU  82 -25.569 -13.707   1.386
    3    HB2  LEU  82           HB2      LEU  82 -28.518 -13.147   1.157
    4    HB3  LEU  82           HB3      LEU  82 -27.786 -14.736   0.944
    5    HG   LEU  82           HG       LEU  82 -27.735 -13.148   3.493
    6   HD11  LEU  82          HD11      LEU  82 -30.001 -13.994   2.731
    7   HD13  LEU  82          HD12      LEU  82 -29.442 -14.632   4.280
    8   HD12  LEU  82          HD13      LEU  82 -29.334 -15.625   2.825
    9   HD23  LEU  82          HD21      LEU  82 -27.075 -15.520   4.287
   10   HD22  LEU  82          HD22      LEU  82 -25.858 -14.552   3.458
   11   HD21  LEU  82          HD23      LEU  82 -26.712 -15.825   2.588

  No H/Q in entry =          11
  In of MODEL   53
    1    H    LEU  83           H        LEU  83 -27.588 -11.522  -0.517
    2    HA   LEU  83           HA       LEU  83 -27.383 -12.881  -2.988
    3    HB2  LEU  83           HB2      LEU  83 -27.843  -9.981  -2.341
    4    HB3  LEU  83           HB3      LEU  83 -27.878 -10.629  -3.981
    5    HG   LEU  83           HG       LEU  83 -29.884 -11.050  -1.784
    6   HD13  LEU  83          HD11      LEU  83 -30.685  -9.219  -2.844
    7   HD12  LEU  83          HD12      LEU  83 -31.138 -10.344  -4.123
    8   HD11  LEU  83          HD13      LEU  83 -29.622  -9.449  -4.232
    9   HD23  LEU  83          HD21      LEU  83 -30.025 -12.316  -4.506
   10   HD22  LEU  83          HD22      LEU  83 -30.973 -12.681  -3.065
   11   HD21  LEU  83          HD23      LEU  83 -29.277 -13.154  -3.145

  No H/Q in entry =          11
  In of MODEL   53
    1    H    TYR  84           H        TYR  84 -25.460 -10.456  -1.335
    2    HA   TYR  84           HA       TYR  84 -23.628  -9.938  -3.484
    3    HB2  TYR  84           HB2      TYR  84 -24.158  -8.462  -1.453
    4    HB3  TYR  84           HB3      TYR  84 -23.098  -9.538  -0.545
    5    HD1  TYR  84           HD1      TYR  84 -20.740  -9.320  -0.658
    6    HD2  TYR  84           HD2      TYR  84 -23.203  -7.143  -3.383
    7    HE1  TYR  84           HE1      TYR  84 -18.761  -8.044  -1.408
    8    HE2  TYR  84           HE2      TYR  84 -21.232  -5.866  -4.149
    9    HH   TYR  84           HH       TYR  84 -19.039  -5.541  -3.902

  No H/Q in entry =           9
  In of MODEL   53
    1    H    GLY  85           H        GLY  85 -23.322 -11.929  -0.536
    2    HA3  GLY  85           HA2      GLY  85 -20.732 -12.825  -1.042
    3    HA2  GLY  85           HA3      GLY  85 -21.937 -13.693  -0.092

  No H/Q in entry =           3
  In of MODEL   53
    1    H    LYS  86           H        LYS  86 -23.796 -14.105  -2.133
    2    HA   LYS  86           HA       LYS  86 -22.710 -16.461  -3.397
    3    HB2  LYS  86           HB2      LYS  86 -24.971 -16.266  -2.389
    4    HB3  LYS  86           HB3      LYS  86 -25.392 -15.096  -3.638
    5    HG2  LYS  86           HG2      LYS  86 -25.146 -16.826  -5.325
    6    HG3  LYS  86           HG3      LYS  86 -24.763 -17.992  -4.058
    7    HD2  LYS  86           HD2      LYS  86 -27.253 -16.307  -3.967
    8    HD3  LYS  86           HD3      LYS  86 -27.212 -17.849  -4.821
    9    HE2  LYS  86           HE2      LYS  86 -26.306 -18.819  -2.628
   10    HE3  LYS  86           HE3      LYS  86 -26.864 -17.319  -1.889
   11    HZ3  LYS  86           HZ1      LYS  86 -28.802 -18.404  -1.727
   12    HZ2  LYS  86           HZ2      LYS  86 -28.391 -19.551  -2.912
   13    HZ1  LYS  86           HZ3      LYS  86 -28.986 -18.030  -3.374

  No H/Q in entry =          13
  In of MODEL   53
    1    H    VAL  87           H        VAL  87 -22.769 -13.249  -4.298
    2    HA   VAL  87           HA       VAL  87 -22.510 -12.074  -6.245
    3    HB   VAL  87           HB       VAL  87 -21.426 -14.533  -7.631
    4   HG12  VAL  87          HG11      VAL  87 -20.173 -11.804  -7.519
    5   HG11  VAL  87          HG12      VAL  87 -21.590 -12.069  -8.537
    6   HG13  VAL  87          HG13      VAL  87 -20.117 -12.999  -8.813
    7   HG21  VAL  87          HG21      VAL  87 -20.512 -14.661  -5.366
    8   HG23  VAL  87          HG22      VAL  87 -19.937 -13.002  -5.506
    9   HG22  VAL  87          HG23      VAL  87 -19.269 -14.258  -6.547

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ASP  88           H        ASP  88 -25.010 -12.763  -5.867
    2    HA   ASP  88           HA       ASP  88 -26.131 -14.006  -8.250
    3    HB2  ASP  88           HB2      ASP  88 -27.099 -14.265  -5.916
    4    HB3  ASP  88           HB3      ASP  88 -27.585 -12.572  -6.015

  No H/Q in entry =           4
  In of MODEL   53
    1    H    GLY  89           H        GLY  89 -25.468 -12.739  -9.901
    2    HA3  GLY  89           HA2      GLY  89 -25.704  -9.971 -10.107
    3    HA2  GLY  89           HA3      GLY  89 -25.672 -11.095 -11.465

  No H/Q in entry =           3
  In of MODEL   53
    1    H    LEU  90           H        LEU  90 -28.088 -12.493 -10.988
    2    HA   LEU  90           HA       LEU  90 -29.948 -10.595 -12.088
    3    HB2  LEU  90           HB2      LEU  90 -29.971 -12.994 -12.662
    4    HB3  LEU  90           HB3      LEU  90 -30.453 -13.366 -11.007
    5    HG   LEU  90           HG       LEU  90 -32.597 -12.292 -11.352
    6   HD13  LEU  90          HD11      LEU  90 -32.466 -10.551 -12.832
    7   HD12  LEU  90          HD12      LEU  90 -32.994 -11.801 -13.961
    8   HD11  LEU  90          HD13      LEU  90 -31.286 -11.373 -13.855
    9   HD23  LEU  90          HD21      LEU  90 -32.521 -13.926 -13.783
   10   HD22  LEU  90          HD22      LEU  90 -33.482 -14.106 -12.316
   11   HD21  LEU  90          HD23      LEU  90 -31.816 -14.686 -12.356

  No H/Q in entry =          11
  In of MODEL   53
    1    H    GLY  91           H        GLY  91 -29.718 -12.086  -8.902
    2    HA3  GLY  91           HA2      GLY  91 -32.067 -11.016  -7.842
    3    HA2  GLY  91           HA3      GLY  91 -30.655 -11.519  -6.912

  No H/Q in entry =           3
  In of MODEL   53
    1    H    VAL  92           H        VAL  92 -28.782  -9.657  -7.792
    2    HA   VAL  92           HA       VAL  92 -29.603  -7.368  -6.240
    3    HB   VAL  92           HB       VAL  92 -27.064  -7.792  -7.862
    4   HG12  VAL  92          HG11      VAL  92 -27.242  -5.904  -5.538
    5   HG11  VAL  92          HG12      VAL  92 -27.934  -5.378  -7.074
    6   HG13  VAL  92          HG13      VAL  92 -26.228  -5.812  -6.978
    7   HG22  VAL  92          HG21      VAL  92 -26.793  -9.371  -6.268
    8   HG21  VAL  92          HG22      VAL  92 -27.942  -8.610  -5.165
    9   HG23  VAL  92          HG23      VAL  92 -26.302  -7.977  -5.305

  No H/Q in entry =           9
  In of MODEL   53
    1    H    LEU  93           H        LEU  93 -29.218  -8.030  -9.664
    2    HA   LEU  93           HA       LEU  93 -29.625  -5.405 -10.596
    3    HB2  LEU  93           HB2      LEU  93 -28.962  -7.251 -12.060
    4    HB3  LEU  93           HB3      LEU  93 -30.536  -8.009 -11.818
    5    HG   LEU  93           HG       LEU  93 -31.598  -6.069 -12.936
    6   HD11  LEU  93          HD11      LEU  93 -29.774  -4.436 -12.456
    7   HD13  LEU  93          HD12      LEU  93 -30.231  -4.480 -14.160
    8   HD12  LEU  93          HD13      LEU  93 -28.757  -5.284 -13.621
    9   HD23  LEU  93          HD21      LEU  93 -30.572  -6.621 -15.233
   10   HD22  LEU  93          HD22      LEU  93 -31.379  -7.892 -14.315
   11   HD21  LEU  93          HD23      LEU  93 -29.617  -7.801 -14.336

  No H/Q in entry =          11
  In of MODEL   53
    1    H    LYS  94           H        LYS  94 -31.941  -7.996  -9.715
    2    HA   LYS  94           HA       LYS  94 -34.319  -6.602 -10.319
    3    HB2  LYS  94           HB2      LYS  94 -33.741  -8.772  -8.307
    4    HB3  LYS  94           HB3      LYS  94 -35.354  -8.109  -8.560
    5    HG2  LYS  94           HG2      LYS  94 -35.277  -8.888 -10.893
    6    HG3  LYS  94           HG3      LYS  94 -33.698  -9.608 -10.580
    7    HD2  LYS  94           HD2      LYS  94 -34.773 -10.959  -8.740
    8    HD3  LYS  94           HD3      LYS  94 -36.334 -10.343  -9.280
    9    HE2  LYS  94           HE2      LYS  94 -35.824 -11.268 -11.550
   10    HE3  LYS  94           HE3      LYS  94 -34.387 -12.021 -10.860
   11    HZ3  LYS  94           HZ1      LYS  94 -36.207 -13.579 -11.006
   12    HZ2  LYS  94           HZ2      LYS  94 -37.191 -12.570 -10.057
   13    HZ1  LYS  94           HZ3      LYS  94 -35.810 -13.290  -9.382

  No H/Q in entry =          13
  In of MODEL   53
    1    H    ALA  95           H        ALA  95 -32.461  -6.679  -7.289
    2    HA   ALA  95           HA       ALA  95 -34.326  -5.133  -5.794
    3    HB2  ALA  95           HB1      ALA  95 -31.918  -6.459  -5.279
    4    HB3  ALA  95           HB2      ALA  95 -32.902  -5.570  -4.117
    5    HB1  ALA  95           HB3      ALA  95 -31.580  -4.758  -4.955

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ALA  96           H        ALA  96 -31.724  -4.232  -7.921
    2    HA   ALA  96           HA       ALA  96 -31.674  -1.467  -7.154
    3    HB2  ALA  96           HB1      ALA  96 -30.339  -1.219  -9.279
    4    HB3  ALA  96           HB2      ALA  96 -30.612  -2.933  -9.591
    5    HB1  ALA  96           HB3      ALA  96 -29.693  -2.432  -8.173

  No H/Q in entry =           5
  In of MODEL   53
    1    H    VAL  97           H        VAL  97 -33.200  -3.217  -9.821
    2    HA   VAL  97           HA       VAL  97 -34.328  -0.941 -11.070
    3    HB   VAL  97           HB       VAL  97 -35.081  -3.882 -11.098
    4   HG11  VAL  97          HG11      VAL  97 -36.916  -1.911 -11.569
    5   HG13  VAL  97          HG12      VAL  97 -36.953  -3.507 -12.320
    6   HG12  VAL  97          HG13      VAL  97 -36.235  -2.145 -13.179
    7   HG21  VAL  97          HG21      VAL  97 -33.859  -2.035 -13.150
    8   HG23  VAL  97          HG22      VAL  97 -34.283  -3.724 -13.431
    9   HG22  VAL  97          HG23      VAL  97 -33.030  -3.311 -12.259

  No H/Q in entry =           9
  In of MODEL   53
    1    H    ALA  98           H        ALA  98 -35.442  -3.137  -8.517
    2    HA   ALA  98           HA       ALA  98 -38.020  -2.035  -8.140
    3    HB1  ALA  98           HB1      ALA  98 -36.955  -4.212  -7.114
    4    HB3  ALA  98           HB2      ALA  98 -38.143  -3.308  -6.172
    5    HB2  ALA  98           HB3      ALA  98 -36.421  -3.127  -5.831

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ALA  99           H        ALA  99 -34.939  -1.176  -6.527
    2    HA   ALA  99           HA       ALA  99 -36.085   0.791  -4.858
    3    HB1  ALA  99           HB1      ALA  99 -33.429  -0.053  -5.632
    4    HB2  ALA  99           HB2      ALA  99 -33.977   0.690  -4.129
    5    HB3  ALA  99           HB3      ALA  99 -33.534   1.702  -5.503

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ILE 100           H        ILE 100 -35.083   0.933  -8.225
    2    HA   ILE 100           HA       ILE 100 -35.314   3.777  -8.446
    3    HB   ILE 100           HB       ILE 100 -35.395   1.617 -10.581
    4   HG12  ILE 100          HG12      ILE 100 -33.259   3.648  -9.936
    5   HG13  ILE 100          HG13      ILE 100 -33.260   2.002  -9.303
    6   HG21  ILE 100          HG21      ILE 100 -35.870   4.530 -10.712
    7   HG23  ILE 100          HG22      ILE 100 -36.366   3.250 -11.820
    8   HG22  ILE 100          HG23      ILE 100 -34.725   3.894 -11.894
    9   HD12  ILE 100          HD11      ILE 100 -32.774   2.963 -12.084
   10   HD11  ILE 100          HD12      ILE 100 -33.404   1.337 -11.820
   11   HD13  ILE 100          HD13      ILE 100 -31.858   1.808 -11.117

  No H/Q in entry =          11
  In of MODEL   53
    1    H    LYS 101           H        LYS 101 -37.570   1.128  -9.144
    2    HA   LYS 101           HA       LYS 101 -39.690   2.740 -10.123
    3    HB2  LYS 101           HB2      LYS 101 -39.515  -0.030  -8.993
    4    HB3  LYS 101           HB3      LYS 101 -41.083   0.705  -9.323
    5    HG2  LYS 101           HG2      LYS 101 -40.636   0.844 -11.625
    6    HG3  LYS 101           HG3      LYS 101 -38.930   0.467 -11.389
    7    HD2  LYS 101           HD2      LYS 101 -40.157  -1.463 -12.259
    8    HD3  LYS 101           HD3      LYS 101 -39.507  -1.780 -10.650
    9    HE2  LYS 101           HE2      LYS 101 -41.552  -2.509 -10.120
   10    HE3  LYS 101           HE3      LYS 101 -42.038  -0.813 -10.121
   11    HZ3  LYS 101           HZ1      LYS 101 -42.950  -0.988 -12.229
   12    HZ2  LYS 101           HZ2      LYS 101 -43.379  -2.468 -11.514
   13    HZ1  LYS 101           HZ3      LYS 101 -42.084  -2.400 -12.611

  No H/Q in entry =          13
  In of MODEL   53
    1    H    LYS 102           H        LYS 102 -39.139   1.275  -6.918
    2    HA   LYS 102           HA       LYS 102 -41.393   2.434  -5.698
    3    HB2  LYS 102           HB2      LYS 102 -40.115   0.590  -4.694
    4    HB3  LYS 102           HB3      LYS 102 -38.739   1.669  -4.467
    5    HG2  LYS 102           HG2      LYS 102 -40.064   3.043  -2.958
    6    HG3  LYS 102           HG3      LYS 102 -41.442   1.969  -3.187
    7    HD2  LYS 102           HD2      LYS 102 -40.174   0.124  -2.172
    8    HD3  LYS 102           HD3      LYS 102 -38.796   1.201  -1.941
    9    HE2  LYS 102           HE2      LYS 102 -40.160   2.658  -0.518
   10    HE3  LYS 102           HE3      LYS 102 -41.556   1.612  -0.771
   11    HZ1  LYS 102           HZ1      LYS 102 -39.796  -0.112   0.216
   12    HZ3  LYS 102           HZ2      LYS 102 -40.911   0.755   1.157
   13    HZ2  LYS 102           HZ3      LYS 102 -39.311   1.307   1.012

  No H/Q in entry =          13
  In of MODEL   53
    1    H    ALA 103           H        ALA 103 -38.474   3.874  -6.743
    2    HA   ALA 103           HA       ALA 103 -38.717   6.186  -4.961
    3    HB2  ALA 103           HB1      ALA 103 -36.755   6.953  -6.558
    4    HB3  ALA 103           HB2      ALA 103 -36.695   5.235  -6.955
    5    HB1  ALA 103           HB3      ALA 103 -36.460   5.764  -5.290

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ALA 104           H        ALA 104 -39.360   5.442  -8.300
    2    HA   ALA 104           HA       ALA 104 -40.000   8.216  -8.918
    3    HB2  ALA 104           HB1      ALA 104 -40.054   7.544 -11.119
    4    HB1  ALA 104           HB2      ALA 104 -40.751   5.971 -10.733
    5    HB3  ALA 104           HB3      ALA 104 -39.031   6.264 -10.472

  No H/Q in entry =           5
  In of MODEL   53
    1    H    ALA 105           H        ALA 105 -41.553   6.085  -7.096
    2    HA   ALA 105           HA       ALA 105 -44.001   7.438  -7.045
    3    HB2  ALA 105           HB1      ALA 105 -44.751   6.564  -9.074
    4    HB3  ALA 105           HB2      ALA 105 -45.355   5.366  -7.931
    5    HB1  ALA 105           HB3      ALA 105 -43.891   5.041  -8.854

  No H/Q in entry =           5
  In of MODEL   54
    1    H1   ALA   1           H3       ALA   1 -12.248 -15.795  -2.191
    2    H2   ALA   1           H2       ALA   1 -11.317 -16.929  -3.054
    3    H3   ALA   1           H1       ALA   1 -12.476 -15.983  -3.863
    4    HA   ALA   1           HA       ALA   1 -13.866 -17.689  -3.612
    5    HB3  ALA   1           HB1      ALA   1 -12.458 -19.459  -3.184
    6    HB1  ALA   1           HB2      ALA   1 -13.189 -19.359  -1.582
    7    HB2  ALA   1           HB3      ALA   1 -11.620 -18.612  -1.883

  No H/Q in entry =           7
  In of MODEL   54
    1    H    GLU   2           H        GLU   2 -15.460 -18.559  -1.938
    2    HA   GLU   2           HA       GLU   2 -17.097 -16.850  -0.843
    3    HB2  GLU   2           HB2      GLU   2 -16.126 -19.282   0.672
    4    HB3  GLU   2           HB3      GLU   2 -17.648 -18.438   0.955
    5    HG2  GLU   2           HG2      GLU   2 -18.652 -19.517  -0.770
    6    HG3  GLU   2           HG3      GLU   2 -17.347 -19.105  -1.873

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLU   3           H        GLU   3 -15.139 -18.214   1.741
    2    HA   GLU   3           HA       GLU   3 -15.343 -15.871   3.317
    3    HB2  GLU   3           HB2      GLU   3 -13.746 -18.414   3.526
    4    HB3  GLU   3           HB3      GLU   3 -13.501 -17.101   4.678
    5    HG2  GLU   3           HG2      GLU   3 -15.680 -17.264   5.530
    6    HG3  GLU   3           HG3      GLU   3 -16.296 -18.057   4.085

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LEU   4           H        LEU   4 -12.406 -17.332   1.870
    2    HA   LEU   4           HA       LEU   4 -10.568 -15.427   2.452
    3    HB2  LEU   4           HB2      LEU   4 -10.838 -16.708  -0.277
    4    HB3  LEU   4           HB3      LEU   4  -9.377 -15.988   0.389
    5    HG   LEU   4           HG       LEU   4 -10.847 -18.396   1.510
    6   HD13  LEU   4          HD11      LEU   4  -9.225 -19.742   0.547
    7   HD12  LEU   4          HD12      LEU   4  -8.020 -18.455   0.509
    8   HD11  LEU   4          HD13      LEU   4  -9.327 -18.473  -0.673
    9   HD23  LEU   4          HD21      LEU   4  -8.574 -18.462   2.856
   10   HD22  LEU   4          HD22      LEU   4  -9.890 -17.430   3.412
   11   HD21  LEU   4          HD23      LEU   4  -8.543 -16.732   2.513

  No H/Q in entry =          11
  In of MODEL   54
    1    H    GLU   5           H        GLU   5 -12.945 -15.210  -0.184
    2    HA   GLU   5           HA       GLU   5 -11.964 -12.718  -1.185
    3    HB2  GLU   5           HB2      GLU   5 -13.325 -14.297  -2.538
    4    HB3  GLU   5           HB3      GLU   5 -14.710 -13.950  -1.502
    5    HG2  GLU   5           HG2      GLU   5 -14.614 -11.579  -2.128
    6    HG3  GLU   5           HG3      GLU   5 -13.195 -11.889  -3.128

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLU   6           H        GLU   6 -14.654 -13.617   0.944
    2    HA   GLU   6           HA       GLU   6 -15.559 -10.945   1.375
    3    HB2  GLU   6           HB2      GLU   6 -16.980 -12.933   1.784
    4    HB3  GLU   6           HB3      GLU   6 -15.920 -13.401   3.113
    5    HG2  GLU   6           HG2      GLU   6 -16.426 -11.311   4.286
    6    HG3  GLU   6           HG3      GLU   6 -17.435 -10.781   2.943

  No H/Q in entry =           6
  In of MODEL   54
    1    H    VAL   7           H        VAL   7 -13.222 -13.059   2.897
    2    HA   VAL   7           HA       VAL   7 -12.724 -11.497   5.226
    3    HB   VAL   7           HB       VAL   7 -11.038 -13.527   3.738
    4   HG11  VAL   7          HG11      VAL   7 -10.534 -12.009   6.304
    5   HG13  VAL   7          HG12      VAL   7  -9.454 -12.212   4.925
    6   HG12  VAL   7          HG13      VAL   7  -9.787 -13.576   5.991
    7   HG21  VAL   7          HG21      VAL   7 -13.268 -14.105   4.988
    8   HG23  VAL   7          HG22      VAL   7 -12.318 -13.838   6.451
    9   HG22  VAL   7          HG23      VAL   7 -11.840 -15.089   5.306

  No H/Q in entry =           9
  In of MODEL   54
    1    H    VAL   8           H        VAL   8 -11.262 -11.588   1.992
    2    HA   VAL   8           HA       VAL   8  -9.197  -9.712   2.465
    3    HB   VAL   8           HB       VAL   8 -10.697 -10.396  -0.074
    4   HG12  VAL   8          HG11      VAL   8  -8.483  -9.382  -1.058
    5   HG11  VAL   8          HG12      VAL   8  -8.400  -8.534   0.487
    6   HG13  VAL   8          HG13      VAL   8  -9.790  -8.299  -0.573
    7   HG23  VAL   8          HG21      VAL   8  -7.841 -11.145   0.312
    8   HG22  VAL   8          HG22      VAL   8  -9.167 -12.086  -0.367
    9   HG21  VAL   8          HG23      VAL   8  -8.974 -11.977   1.380

  No H/Q in entry =           9
  In of MODEL   54
    1    H    MET   9           H        MET   9 -12.561  -9.325   1.359
    2    HA   MET   9           HA       MET   9 -12.512  -6.545   0.941
    3    HB2  MET   9           HB2      MET   9 -14.680  -8.478   1.721
    4    HB3  MET   9           HB3      MET   9 -15.008  -6.744   1.669
    5    HG2  MET   9           HG2      MET   9 -13.987  -6.788  -0.687
    6    HG3  MET   9           HG3      MET   9 -14.129  -8.543  -0.592
    7    HE1  MET   9           HE1      MET   9 -15.948  -9.861  -0.532
    8    HE3  MET   9           HE2      MET   9 -17.645  -9.457  -0.767
    9    HE2  MET   9           HE3      MET   9 -16.914  -9.260   0.823

  No H/Q in entry =           9
  In of MODEL   54
    1    H    GLY  10           H        GLY  10 -13.124  -8.456   3.867
    2    HA3  GLY  10           HA2      GLY  10 -13.652  -6.284   5.607
    3    HA2  GLY  10           HA3      GLY  10 -13.075  -7.874   6.102

  No H/Q in entry =           3
  In of MODEL   54
    1    H    LEU  11           H        LEU  11 -10.650  -7.983   4.749
    2    HA   LEU  11           HA       LEU  11  -8.927  -6.555   6.488
    3    HB2  LEU  11           HB2      LEU  11  -8.416  -7.961   3.864
    4    HB3  LEU  11           HB3      LEU  11  -7.133  -7.258   4.847
    5    HG   LEU  11           HG       LEU  11  -9.113  -9.304   5.882
    6   HD13  LEU  11          HD11      LEU  11  -7.911 -10.527   4.291
    7   HD12  LEU  11          HD12      LEU  11  -6.953 -10.772   5.750
    8   HD11  LEU  11          HD13      LEU  11  -6.435  -9.598   4.542
    9   HD22  LEU  11          HD21      LEU  11  -8.233  -8.300   7.791
   10   HD21  LEU  11          HD22      LEU  11  -6.709  -7.889   7.007
   11   HD23  LEU  11          HD23      LEU  11  -7.021  -9.549   7.512

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  12           H        ILE  12  -9.883  -5.990   3.116
    2    HA   ILE  12           HA       ILE  12  -8.205  -3.752   2.678
    3    HB   ILE  12           HB       ILE  12 -10.874  -4.435   1.419
    4   HG12  ILE  12          HG12      ILE  12  -8.832  -6.066   1.290
    5   HG13  ILE  12          HG13      ILE  12  -9.700  -5.684  -0.183
    6   HG23  ILE  12          HG21      ILE  12 -10.356  -2.105   0.983
    7   HG22  ILE  12          HG22      ILE  12  -9.978  -3.009  -0.478
    8   HG21  ILE  12          HG23      ILE  12  -8.710  -2.511   0.603
    9   HD13  ILE  12          HD11      ILE  12  -7.987  -4.100  -0.822
   10   HD12  ILE  12          HD12      ILE  12  -7.199  -5.617  -0.394
   11   HD11  ILE  12          HD13      ILE  12  -7.184  -4.277   0.727

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  13           H        ILE  13 -11.548  -4.038   3.821
    2    HA   ILE  13           HA       ILE  13 -12.014  -1.254   4.115
    3    HB   ILE  13           HB       ILE  13 -13.188  -3.687   5.481
    4   HG12  ILE  13          HG12      ILE  13 -13.469  -3.203   2.967
    5   HG13  ILE  13          HG13      ILE  13 -14.911  -3.547   3.897
    6   HG21  ILE  13          HG21      ILE  13 -13.888  -0.766   5.781
    7   HG23  ILE  13          HG22      ILE  13 -13.633  -1.956   7.049
    8   HG22  ILE  13          HG23      ILE  13 -15.091  -2.021   6.061
    9   HD11  ILE  13          HD11      ILE  13 -14.155  -0.688   3.790
   10   HD13  ILE  13          HD12      ILE  13 -15.727  -1.453   3.663
   11   HD12  ILE  13          HD13      ILE  13 -14.681  -1.405   2.262

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ASN  14           H        ASN  14 -10.858  -3.754   6.357
    2    HA   ASN  14           HA       ASN  14 -10.629  -2.129   8.649
    3    HB2  ASN  14           HB2      ASN  14 -10.370  -4.734   8.307
    4    HB3  ASN  14           HB3      ASN  14  -8.666  -4.338   8.126
    5   HD21  ASN  14          HD21      ASN  14  -9.262  -5.878  10.302
    6   HD22  ASN  14          HD22      ASN  14  -9.217  -4.967  11.732

  No H/Q in entry =           6
  In of MODEL   54
    1    H    SER  15           H        SER  15  -8.262  -2.927   6.116
    2    HA   SER  15           HA       SER  15  -6.109  -1.431   7.164
    3    HB2  SER  15           HB2      SER  15  -5.122  -1.627   4.989
    4    HB3  SER  15           HB3      SER  15  -6.064  -3.095   5.221
    5    HG   SER  15           HG       SER  15  -7.769  -2.052   4.073

  No H/Q in entry =           5
  In of MODEL   54
    1    H    GLY  16           H        GLY  16  -8.748  -0.563   4.962
    2    HA3  GLY  16           HA2      GLY  16  -7.911   2.085   4.414
    3    HA2  GLY  16           HA3      GLY  16  -9.562   1.483   4.274

  No H/Q in entry =           3
  In of MODEL   54
    1    H    GLN  17           H        GLN  17 -10.061   0.739   6.927
    2    HA   GLN  17           HA       GLN  17 -10.763   3.234   8.093
    3    HB2  GLN  17           HB2      GLN  17 -11.979   1.143   8.587
    4    HB3  GLN  17           HB3      GLN  17 -10.555   0.517   9.418
    5    HG2  GLN  17           HG2      GLN  17 -10.666   2.324  11.054
    6    HG3  GLN  17           HG3      GLN  17 -12.013   3.061  10.188
    7   HE21  GLN  17          HE21      GLN  17 -12.308   2.279  12.911
    8   HE22  GLN  17          HE22      GLN  17 -13.383   0.968  12.984

  No H/Q in entry =           8
  In of MODEL   54
    1    H    ALA  18           H        ALA  18  -8.113   0.963   8.659
    2    HA   ALA  18           HA       ALA  18  -6.988   2.171  10.920
    3    HB2  ALA  18           HB1      ALA  18  -6.387  -0.033   9.530
    4    HB3  ALA  18           HB2      ALA  18  -5.212   0.750  10.588
    5    HB1  ALA  18           HB3      ALA  18  -5.163   1.039   8.848

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ARG  19           H        ARG  19  -6.272   2.720   7.463
    2    HA   ARG  19           HA       ARG  19  -4.379   4.775   7.876
    3    HB2  ARG  19           HB2      ARG  19  -4.733   3.646   5.678
    4    HB3  ARG  19           HB3      ARG  19  -6.283   4.478   5.530
    5    HG2  ARG  19           HG2      ARG  19  -5.166   6.656   5.594
    6    HG3  ARG  19           HG3      ARG  19  -3.608   5.878   5.870
    7    HD2  ARG  19           HD2      ARG  19  -3.772   6.481   3.533
    8    HD3  ARG  19           HD3      ARG  19  -3.844   4.720   3.669
    9    HE   ARG  19           HE       ARG  19  -6.483   5.613   3.707
   10   HH21  ARG  19          HH11      ARG  19  -7.708   5.774   1.808
   11   HH22  ARG  19          HH12      ARG  19  -6.910   5.865   0.276
   12   HH11  ARG  19          HH21      ARG  19  -3.739   5.705   1.632
   13   HH12  ARG  19          HH22      ARG  19  -4.661   5.824   0.177

  No H/Q in entry =          13
  In of MODEL   54
    1    H    SER  20           H        SER  20  -7.886   4.872   7.329
    2    HA   SER  20           HA       SER  20  -8.261   7.626   7.302
    3    HB2  SER  20           HB2      SER  20  -9.980   5.731   6.952
    4    HB3  SER  20           HB3      SER  20 -10.173   5.772   8.704
    5    HG   SER  20           HG       SER  20 -10.698   7.974   8.521

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LEU  21           H        LEU  21  -8.205   5.427  10.093
    2    HA   LEU  21           HA       LEU  21  -8.629   7.408  12.076
    3    HB2  LEU  21           HB2      LEU  21  -7.253   4.717  12.202
    4    HB3  LEU  21           HB3      LEU  21  -7.557   5.723  13.616
    5    HG   LEU  21           HG       LEU  21  -9.740   4.821  11.714
    6   HD12  LEU  21          HD11      LEU  21 -10.275   3.291  13.756
    7   HD11  LEU  21          HD12      LEU  21  -8.582   3.539  14.180
    8   HD13  LEU  21          HD13      LEU  21  -9.005   2.793  12.638
    9   HD22  LEU  21          HD21      LEU  21 -10.651   6.615  12.903
   10   HD21  LEU  21          HD22      LEU  21  -9.665   6.322  14.332
   11   HD23  LEU  21          HD23      LEU  21 -11.045   5.288  13.992

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ALA  22           H        ALA  22  -5.689   6.063  10.617
    2    HA   ALA  22           HA       ALA  22  -3.794   7.380  12.218
    3    HB2  ALA  22           HB1      ALA  22  -3.391   5.539  10.510
    4    HB1  ALA  22           HB2      ALA  22  -2.204   6.843  10.535
    5    HB3  ALA  22           HB3      ALA  22  -3.440   6.798   9.277

  No H/Q in entry =           5
  In of MODEL   54
    1    H    TYR  23           H        TYR  23  -5.166   8.406   9.062
    2    HA   TYR  23           HA       TYR  23  -3.848  10.912   8.986
    3    HB2  TYR  23           HB2      TYR  23  -4.952  10.004   7.006
    4    HB3  TYR  23           HB3      TYR  23  -6.520  10.097   7.811
    5    HD1  TYR  23           HD1      TYR  23  -3.646  12.163   6.628
    6    HD2  TYR  23           HD2      TYR  23  -7.771  12.100   7.821
    7    HE1  TYR  23           HE1      TYR  23  -3.896  14.516   5.884
    8    HE2  TYR  23           HE2      TYR  23  -8.022  14.452   7.075
    9    HH   TYR  23           HH       TYR  23  -5.406  16.457   6.408

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ALA  24           H        ALA  24  -6.940   9.905  10.406
    2    HA   ALA  24           HA       ALA  24  -7.782  12.484  11.204
    3    HB1  ALA  24           HB1      ALA  24  -9.585  11.218  11.691
    4    HB2  ALA  24           HB2      ALA  24  -8.734  10.644  13.124
    5    HB3  ALA  24           HB3      ALA  24  -8.625   9.741  11.613

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ALA  25           H        ALA  25  -5.741  10.031  12.734
    2    HA   ALA  25           HA       ALA  25  -5.374  11.271  15.238
    3    HB2  ALA  25           HB1      ALA  25  -4.603   8.930  14.393
    4    HB3  ALA  25           HB2      ALA  25  -3.577   9.788  15.543
    5    HB1  ALA  25           HB3      ALA  25  -3.166   9.784  13.828

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LEU  26           H        LEU  26  -3.631  11.600  12.174
    2    HA   LEU  26           HA       LEU  26  -1.671  13.428  13.072
    3    HB2  LEU  26           HB2      LEU  26  -1.393  12.291  10.957
    4    HB3  LEU  26           HB3      LEU  26  -2.881  12.993  10.328
    5    HG   LEU  26           HG       LEU  26  -1.879  15.249  10.462
    6   HD12  LEU  26          HD11      LEU  26   0.665  15.284  10.839
    7   HD11  LEU  26          HD12      LEU  26   0.463  13.697  11.577
    8   HD13  LEU  26          HD13      LEU  26  -0.344  15.103  12.273
    9   HD21  LEU  26          HD21      LEU  26  -0.143  13.214   9.030
   10   HD23  LEU  26          HD22      LEU  26  -0.204  14.938   8.670
   11   HD22  LEU  26          HD23      LEU  26  -1.624  13.932   8.397

  No H/Q in entry =          11
  In of MODEL   54
    1    H    LYS  27           H        LYS  27  -4.878  13.898  11.644
    2    HA   LYS  27           HA       LYS  27  -4.844  16.688  11.462
    3    HB2  LYS  27           HB2      LYS  27  -6.593  15.205  10.493
    4    HB3  LYS  27           HB3      LYS  27  -7.224  14.935  12.117
    5    HG2  LYS  27           HG2      LYS  27  -7.666  17.337  12.374
    6    HG3  LYS  27           HG3      LYS  27  -6.983  17.648  10.774
    7    HD2  LYS  27           HD2      LYS  27  -8.721  16.208   9.755
    8    HD3  LYS  27           HD3      LYS  27  -9.410  15.914  11.354
    9    HE2  LYS  27           HE2      LYS  27  -9.864  18.321  11.618
   10    HE3  LYS  27           HE3      LYS  27  -9.147  18.637  10.034
   11    HZ3  LYS  27           HZ1      LYS  27 -11.527  18.498   9.826
   12    HZ2  LYS  27           HZ2      LYS  27 -11.554  16.976  10.588
   13    HZ1  LYS  27           HZ3      LYS  27 -10.833  17.153   9.056

  No H/Q in entry =          13
  In of MODEL   54
    1    H    GLN  28           H        GLN  28  -5.679  14.581  14.189
    2    HA   GLN  28           HA       GLN  28  -6.561  16.569  15.990
    3    HB2  GLN  28           HB2      GLN  28  -5.136  13.942  16.495
    4    HB3  GLN  28           HB3      GLN  28  -5.861  14.935  17.760
    5    HG2  GLN  28           HG2      GLN  28  -7.359  13.828  15.369
    6    HG3  GLN  28           HG3      GLN  28  -7.381  13.119  16.983
    7   HE21  GLN  28          HE21      GLN  28  -9.276  14.966  15.059
    8   HE22  GLN  28          HE22      GLN  28 -10.019  15.953  16.222

  No H/Q in entry =           8
  In of MODEL   54
    1    H    ALA  29           H        ALA  29  -3.345  15.295  15.246
    2    HA   ALA  29           HA       ALA  29  -1.885  16.689  17.211
    3    HB1  ALA  29           HB1      ALA  29   0.033  16.015  16.059
    4    HB3  ALA  29           HB2      ALA  29  -0.746  16.145  14.482
    5    HB2  ALA  29           HB3      ALA  29  -1.145  14.803  15.555

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LYS  30           H        LYS  30  -2.797  17.584  13.899
    2    HA   LYS  30           HA       LYS  30  -1.399  20.030  13.792
    3    HB2  LYS  30           HB2      LYS  30  -3.947  19.154  12.417
    4    HB3  LYS  30           HB3      LYS  30  -3.124  20.674  12.069
    5    HG2  LYS  30           HG2      LYS  30  -1.057  19.392  11.517
    6    HG3  LYS  30           HG3      LYS  30  -1.954  17.892  11.767
    7    HD2  LYS  30           HD2      LYS  30  -3.548  18.537   9.999
    8    HD3  LYS  30           HD3      LYS  30  -2.674  20.049   9.752
    9    HE2  LYS  30           HE2      LYS  30  -0.646  18.767   9.135
   10    HE3  LYS  30           HE3      LYS  30  -1.539  17.260   9.351
   11    HZ2  LYS  30           HZ1      LYS  30  -1.401  18.145   7.012
   12    HZ1  LYS  30           HZ2      LYS  30  -2.442  19.402   7.503
   13    HZ3  LYS  30           HZ3      LYS  30  -2.960  17.782   7.573

  No H/Q in entry =          13
  In of MODEL   54
    1    H    GLN  31           H        GLN  31  -4.475  19.160  15.246
    2    HA   GLN  31           HA       GLN  31  -5.239  21.911  15.726
    3    HB2  GLN  31           HB2      GLN  31  -6.391  19.454  17.052
    4    HB3  GLN  31           HB3      GLN  31  -7.159  21.025  16.827
    5    HG2  GLN  31           HG2      GLN  31  -6.486  20.265  14.222
    6    HG3  GLN  31           HG3      GLN  31  -6.995  18.755  14.968
    7   HE21  GLN  31          HE21      GLN  31  -8.441  20.338  12.898
    8   HE22  GLN  31          HE22      GLN  31  -9.946  20.722  13.581

  No H/Q in entry =           8
  In of MODEL   54
    1    H    GLY  32           H        GLY  32  -2.902  19.982  16.999
    2    HA3  GLY  32           HA2      GLY  32  -1.475  20.436  18.783
    3    HA2  GLY  32           HA3      GLY  32  -2.599  21.673  19.331

  No H/Q in entry =           3
  In of MODEL   54
    1    H    ASP  33           H        ASP  33  -4.025  18.635  18.672
    2    HA   ASP  33           HA       ASP  33  -4.390  18.158  21.555
    3    HB2  ASP  33           HB2      ASP  33  -5.832  17.159  19.093
    4    HB3  ASP  33           HB3      ASP  33  -6.152  16.538  20.711

  No H/Q in entry =           4
  In of MODEL   54
    1    H    PHE  34           H        PHE  34  -2.216  17.310  21.822
    2    HA   PHE  34           HA       PHE  34  -1.232  15.072  20.392
    3    HB2  PHE  34           HB2      PHE  34  -0.575  16.040  23.183
    4    HB3  PHE  34           HB3      PHE  34   0.343  14.825  22.294
    5    HD1  PHE  34           HD1      PHE  34   0.175  18.245  23.053
    6    HD2  PHE  34           HD2      PHE  34   0.961  15.564  19.789
    7    HE1  PHE  34           HE1      PHE  34   1.449  20.027  21.890
    8    HE2  PHE  34           HE2      PHE  34   2.230  17.349  18.631
    9    HZ   PHE  34           HZ       PHE  34   2.476  19.577  19.687

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ALA  35           H        ALA  35  -3.229  15.327  23.288
    2    HA   ALA  35           HA       ALA  35  -2.998  12.660  24.164
    3    HB3  ALA  35           HB1      ALA  35  -5.443  13.275  25.063
    4    HB1  ALA  35           HB2      ALA  35  -4.920  14.897  24.609
    5    HB2  ALA  35           HB3      ALA  35  -3.986  13.968  25.780

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ALA  36           H        ALA  36  -5.482  14.185  22.111
    2    HA   ALA  36           HA       ALA  36  -6.900  11.773  21.640
    3    HB1  ALA  36           HB1      ALA  36  -8.373  13.199  20.716
    4    HB3  ALA  36           HB2      ALA  36  -7.221  13.630  19.452
    5    HB2  ALA  36           HB3      ALA  36  -7.224  14.507  20.981

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ALA  37           H        ALA  37  -4.249  13.377  19.941
    2    HA   ALA  37           HA       ALA  37  -4.246  11.756  17.633
    3    HB3  ALA  37           HB1      ALA  37  -2.235  13.463  19.036
    4    HB2  ALA  37           HB2      ALA  37  -2.792  13.528  17.365
    5    HB1  ALA  37           HB3      ALA  37  -1.628  12.297  17.860

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LYS  38           H        LYS  38  -2.441  11.434  20.681
    2    HA   LYS  38           HA       LYS  38  -1.119   9.040  20.157
    3    HB2  LYS  38           HB2      LYS  38  -1.412  10.788  22.318
    4    HB3  LYS  38           HB3      LYS  38  -2.019   9.253  22.934
    5    HG2  LYS  38           HG2      LYS  38   0.069   8.141  22.358
    6    HG3  LYS  38           HG3      LYS  38   0.662   9.592  21.545
    7    HD2  LYS  38           HD2      LYS  38   0.860  10.798  23.585
    8    HD3  LYS  38           HD3      LYS  38  -0.143   9.640  24.460
    9    HE2  LYS  38           HE2      LYS  38   2.222   9.325  25.041
   10    HE3  LYS  38           HE3      LYS  38   1.607   7.913  24.177
   11    HZ3  LYS  38           HZ1      LYS  38   2.879   8.346  22.379
   12    HZ2  LYS  38           HZ2      LYS  38   3.850   9.169  23.506
   13    HZ1  LYS  38           HZ3      LYS  38   2.754  10.033  22.537

  No H/Q in entry =          13
  In of MODEL   54
    1    H    ALA  39           H        ALA  39  -4.336   9.519  21.612
    2    HA   ALA  39           HA       ALA  39  -4.883   6.795  22.107
    3    HB3  ALA  39           HB1      ALA  39  -7.058   8.740  21.386
    4    HB2  ALA  39           HB2      ALA  39  -6.137   8.959  22.875
    5    HB1  ALA  39           HB3      ALA  39  -7.055   7.475  22.616

  No H/Q in entry =           5
  In of MODEL   54
    1    H    MET  40           H        MET  40  -5.516   8.826  19.283
    2    HA   MET  40           HA       MET  40  -7.011   6.900  17.833
    3    HB2  MET  40           HB2      MET  40  -5.420   9.304  16.919
    4    HB3  MET  40           HB3      MET  40  -6.460   8.350  15.859
    5    HG2  MET  40           HG2      MET  40  -7.458   9.580  18.441
    6    HG3  MET  40           HG3      MET  40  -7.541  10.425  16.897
    7    HE3  MET  40           HE1      MET  40 -10.152   8.813  14.862
    8    HE2  MET  40           HE2      MET  40  -8.402   8.935  14.687
    9    HE1  MET  40           HE3      MET  40  -9.313  10.294  15.344

  No H/Q in entry =           9
  In of MODEL   54
    1    H    MET  41           H        MET  41  -3.520   7.645  17.907
    2    HA   MET  41           HA       MET  41  -2.789   5.906  15.784
    3    HB2  MET  41           HB2      MET  41  -1.137   6.560  18.236
    4    HB3  MET  41           HB3      MET  41  -0.541   5.924  16.707
    5    HG2  MET  41           HG2      MET  41  -1.718   8.110  15.735
    6    HG3  MET  41           HG3      MET  41  -1.458   8.688  17.380
    7    HE2  MET  41           HE1      MET  41   1.470   6.595  17.683
    8    HE1  MET  41           HE2      MET  41   0.692   7.881  18.601
    9    HE3  MET  41           HE3      MET  41   2.305   8.132  17.935

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ASP  42           H        ASP  42  -3.120   5.409  19.272
    2    HA   ASP  42           HA       ASP  42  -2.075   2.817  19.400
    3    HB2  ASP  42           HB2      ASP  42  -2.925   4.562  21.246
    4    HB3  ASP  42           HB3      ASP  42  -4.351   3.533  21.189

  No H/Q in entry =           4
  In of MODEL   54
    1    H    GLN  43           H        GLN  43  -5.419   3.914  18.957
    2    HA   GLN  43           HA       GLN  43  -6.558   1.325  18.763
    3    HB2  GLN  43           HB2      GLN  43  -7.505   3.982  17.665
    4    HB3  GLN  43           HB3      GLN  43  -8.464   2.500  17.648
    5    HG2  GLN  43           HG2      GLN  43  -8.132   2.364  20.150
    6    HG3  GLN  43           HG3      GLN  43  -7.413   3.971  20.078
    7   HE21  GLN  43          HE21      GLN  43  -9.570   4.035  21.612
    8   HE22  GLN  43          HE22      GLN  43 -10.945   4.612  20.805

  No H/Q in entry =           8
  In of MODEL   54
    1    H    SER  44           H        SER  44  -5.260   3.559  16.345
    2    HA   SER  44           HA       SER  44  -5.992   2.087  14.057
    3    HB2  SER  44           HB2      SER  44  -4.736   4.472  14.498
    4    HB3  SER  44           HB3      SER  44  -3.387   3.483  13.941
    5    HG   SER  44           HG       SER  44  -4.529   4.463  12.201

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ARG  45           H        ARG  45  -3.083   1.969  16.093
    2    HA   ARG  45           HA       ARG  45  -1.618   0.028  14.676
    3    HB2  ARG  45           HB2      ARG  45  -0.752   1.440  16.541
    4    HB3  ARG  45           HB3      ARG  45  -1.724   0.499  17.670
    5    HG2  ARG  45           HG2      ARG  45  -0.497  -1.552  16.995
    6    HG3  ARG  45           HG3      ARG  45   0.500  -0.587  15.908
    7    HD2  ARG  45           HD2      ARG  45   1.260   0.783  17.862
    8    HD3  ARG  45           HD3      ARG  45   0.357  -0.302  18.942
    9    HE   ARG  45           HE       ARG  45   2.036  -1.882  17.325
   10   HH21  ARG  45          HH11      ARG  45   3.951  -2.705  18.129
   11   HH22  ARG  45          HH12      ARG  45   4.742  -1.925  19.453
   12   HH11  ARG  45          HH21      ARG  45   2.369   0.570  19.727
   13   HH12  ARG  45          HH22      ARG  45   3.846  -0.069  20.356

  No H/Q in entry =          13
  In of MODEL   54
    1    H    MET  46           H        MET  46  -3.976  -0.316  17.310
    2    HA   MET  46           HA       MET  46  -3.796  -3.117  17.595
    3    HB2  MET  46           HB2      MET  46  -5.967  -1.124  18.238
    4    HB3  MET  46           HB3      MET  46  -6.153  -2.847  18.578
    5    HG2  MET  46           HG2      MET  46  -4.098  -2.812  19.933
    6    HG3  MET  46           HG3      MET  46  -3.887  -1.102  19.588
    7    HE3  MET  46           HE1      MET  46  -4.855  -1.044  23.317
    8    HE2  MET  46           HE2      MET  46  -4.019  -0.082  22.104
    9    HE1  MET  46           HE3      MET  46  -3.627  -1.788  22.285

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ALA  47           H        ALA  47  -5.852  -1.091  15.545
    2    HA   ALA  47           HA       ALA  47  -7.481  -3.139  14.489
    3    HB3  ALA  47           HB1      ALA  47  -8.172  -0.900  14.099
    4    HB1  ALA  47           HB2      ALA  47  -7.705  -1.522  12.516
    5    HB2  ALA  47           HB3      ALA  47  -6.614  -0.457  13.404

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LEU  48           H        LEU  48  -4.381  -1.816  13.401
    2    HA   LEU  48           HA       LEU  48  -4.132  -3.390  11.045
    3    HB2  LEU  48           HB2      LEU  48  -2.050  -2.120  12.831
    4    HB3  LEU  48           HB3      LEU  48  -1.704  -2.829  11.254
    5    HG   LEU  48           HG       LEU  48  -3.724  -0.618  11.689
    6   HD13  LEU  48          HD11      LEU  48  -1.595   0.257  12.329
    7   HD12  LEU  48          HD12      LEU  48  -1.895   0.822  10.685
    8   HD11  LEU  48          HD13      LEU  48  -0.791  -0.525  10.968
    9   HD22  LEU  48          HD21      LEU  48  -4.225  -1.589   9.613
   10   HD21  LEU  48          HD22      LEU  48  -2.546  -2.019   9.290
   11   HD23  LEU  48          HD23      LEU  48  -3.070  -0.340   9.150

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ASN  49           H        ASN  49  -3.036  -3.808  14.372
    2    HA   ASN  49           HA       ASN  49  -1.436  -6.066  14.003
    3    HB2  ASN  49           HB2      ASN  49  -1.434  -4.745  16.060
    4    HB3  ASN  49           HB3      ASN  49  -3.086  -5.235  16.405
    5   HD21  ASN  49          HD21      ASN  49  -2.954  -6.638  18.147
    6   HD22  ASN  49          HD22      ASN  49  -1.877  -7.943  18.261

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLU  50           H        GLU  50  -4.894  -5.800  14.728
    2    HA   GLU  50           HA       GLU  50  -5.402  -8.600  14.824
    3    HB2  GLU  50           HB2      GLU  50  -6.977  -6.921  15.735
    4    HB3  GLU  50           HB3      GLU  50  -7.295  -6.345  14.097
    5    HG2  GLU  50           HG2      GLU  50  -8.167  -8.538  13.457
    6    HG3  GLU  50           HG3      GLU  50  -7.762  -9.192  15.040

  No H/Q in entry =           6
  In of MODEL   54
    1    H    ALA  51           H        ALA  51  -5.510  -6.184  12.246
    2    HA   ALA  51           HA       ALA  51  -6.525  -7.899  10.227
    3    HB2  ALA  51           HB1      ALA  51  -6.326  -6.077   8.867
    4    HB1  ALA  51           HB2      ALA  51  -4.678  -5.731   9.394
    5    HB3  ALA  51           HB3      ALA  51  -6.048  -5.227  10.386

  No H/Q in entry =           5
  In of MODEL   54
    1    H    HIS  52           H        HIS  52  -3.220  -6.998  11.169
    2    HA   HIS  52           HA       HIS  52  -1.850  -8.473   9.189
    3    HB2  HIS  52           HB2      HIS  52  -0.899  -6.718  10.772
    4    HB3  HIS  52           HB3      HIS  52  -0.846  -7.987  11.995
    5    HD1  HIS  52           HD1      HIS  52   0.303 -10.352  10.807
    6    HD2  HIS  52           HD2      HIS  52   1.534  -6.592   9.495
    7    HE1  HIS  52           HE1      HIS  52   2.557 -10.682   9.702
    8    HE2  HIS  52           HE2      HIS  52   3.321  -8.399   8.897

  No H/Q in entry =           8
  In of MODEL   54
    1    H    LEU  53           H        LEU  53  -3.014  -9.373  12.412
    2    HA   LEU  53           HA       LEU  53  -1.815 -11.918  12.571
    3    HB2  LEU  53           HB2      LEU  53  -4.283 -10.748  13.829
    4    HB3  LEU  53           HB3      LEU  53  -3.816 -12.423  14.104
    5    HG   LEU  53           HG       LEU  53  -1.914 -10.103  14.565
    6   HD11  LEU  53          HD11      LEU  53  -3.913  -9.870  16.010
    7   HD13  LEU  53          HD12      LEU  53  -2.478 -10.286  16.946
    8   HD12  LEU  53          HD13      LEU  53  -3.679 -11.519  16.582
    9   HD21  LEU  53          HD21      LEU  53  -1.925 -13.048  15.246
   10   HD23  LEU  53          HD22      LEU  53  -0.999 -11.912  16.220
   11   HD22  LEU  53          HD23      LEU  53  -0.630 -12.105  14.516

  No H/Q in entry =          11
  In of MODEL   54
    1    H    VAL  54           H        VAL  54  -4.945 -10.878  11.261
    2    HA   VAL  54           HA       VAL  54  -5.871 -13.467  10.570
    3    HB   VAL  54           HB       VAL  54  -6.532 -10.726   9.464
    4   HG12  VAL  54          HG11      VAL  54  -8.647 -12.097   8.673
    5   HG11  VAL  54          HG12      VAL  54  -7.535 -13.464   8.720
    6   HG13  VAL  54          HG13      VAL  54  -7.189 -12.082   7.682
    7   HG22  VAL  54          HG21      VAL  54  -7.407 -10.778  11.628
    8   HG21  VAL  54          HG22      VAL  54  -7.663 -12.521  11.600
    9   HG23  VAL  54          HG23      VAL  54  -8.756 -11.457  10.717

  No H/Q in entry =           9
  In of MODEL   54
    1    H    GLN  55           H        GLN  55  -4.023 -11.005   8.771
    2    HA   GLN  55           HA       GLN  55  -3.930 -12.452   6.341
    3    HB2  GLN  55           HB2      GLN  55  -3.326 -10.187   6.158
    4    HB3  GLN  55           HB3      GLN  55  -2.196 -10.274   7.506
    5    HG2  GLN  55           HG2      GLN  55  -0.498 -11.113   6.199
    6    HG3  GLN  55           HG3      GLN  55  -1.587 -12.080   5.214
    7   HE21  GLN  55          HE21      GLN  55  -1.635 -11.375   3.098
    8   HE22  GLN  55          HE22      GLN  55  -1.442  -9.767   2.596

  No H/Q in entry =           8
  In of MODEL   54
    1    H    THR  56           H        THR  56  -1.782 -12.453   9.191
    2    HA   THR  56           HA       THR  56   0.281 -14.048   8.232
    3    HB   THR  56           HB       THR  56  -0.922 -14.315  10.996
    4    HG1  THR  56           HG1      THR  56  -0.413 -12.110  10.118
    5   HG23  THR  56          HG21      THR  56   0.777 -15.932  10.722
    6   HG22  THR  56          HG22      THR  56   1.599 -14.577  11.495
    7   HG21  THR  56          HG23      THR  56   1.776 -14.843   9.760

  No H/Q in entry =           7
  In of MODEL   54
    1    H    LYS  57           H        LYS  57  -2.820 -15.090   9.634
    2    HA   LYS  57           HA       LYS  57  -2.382 -17.885   9.362
    3    HB2  LYS  57           HB2      LYS  57  -4.179 -16.800  10.741
    4    HB3  LYS  57           HB3      LYS  57  -4.992 -16.340   9.253
    5    HG2  LYS  57           HG2      LYS  57  -5.263 -18.689   8.632
    6    HG3  LYS  57           HG3      LYS  57  -4.379 -19.194  10.070
    7    HD2  LYS  57           HD2      LYS  57  -6.124 -18.175  11.499
    8    HD3  LYS  57           HD3      LYS  57  -7.019 -17.691  10.059
    9    HE2  LYS  57           HE2      LYS  57  -6.315 -20.562  10.769
   10    HE3  LYS  57           HE3      LYS  57  -7.891 -19.828  11.050
   11    HZ1  LYS  57           HZ1      LYS  57  -7.133 -19.342   8.397
   12    HZ3  LYS  57           HZ2      LYS  57  -8.439 -20.262   8.974
   13    HZ2  LYS  57           HZ3      LYS  57  -6.929 -20.997   8.711

  No H/Q in entry =          13
  In of MODEL   54
    1    H    LEU  58           H        LEU  58  -3.741 -15.425   7.223
    2    HA   LEU  58           HA       LEU  58  -4.576 -17.235   5.216
    3    HB2  LEU  58           HB2      LEU  58  -3.966 -14.287   5.092
    4    HB3  LEU  58           HB3      LEU  58  -4.651 -15.213   3.755
    5    HG   LEU  58           HG       LEU  58  -5.890 -15.051   6.522
    6   HD11  LEU  58          HD11      LEU  58  -6.224 -13.386   4.047
    7   HD13  LEU  58          HD12      LEU  58  -6.188 -12.890   5.739
    8   HD12  LEU  58          HD13      LEU  58  -7.622 -13.677   5.082
    9   HD22  LEU  58          HD21      LEU  58  -6.868 -16.952   5.654
   10   HD21  LEU  58          HD22      LEU  58  -6.553 -16.490   3.982
   11   HD23  LEU  58          HD23      LEU  58  -7.902 -15.768   4.857

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  59           H        ILE  59  -1.426 -16.035   6.040
    2    HA   ILE  59           HA       ILE  59  -0.368 -16.747   3.383
    3    HB   ILE  59           HB       ILE  59   0.427 -14.692   4.951
    4   HG12  ILE  59          HG12      ILE  59   2.486 -16.350   3.477
    5   HG13  ILE  59          HG13      ILE  59   1.295 -15.379   2.652
    6   HG21  ILE  59          HG21      ILE  59   1.188 -16.458   6.702
    7   HG23  ILE  59          HG22      ILE  59   2.305 -15.171   6.307
    8   HG22  ILE  59          HG23      ILE  59   2.512 -16.776   5.606
    9   HD12  ILE  59          HD11      ILE  59   3.437 -14.162   2.956
   10   HD11  ILE  59          HD12      ILE  59   3.239 -14.314   4.701
   11   HD13  ILE  59          HD13      ILE  59   2.094 -13.355   3.762

  No H/Q in entry =          11
  In of MODEL   54
    1    H    GLU  60           H        GLU  60  -0.332 -17.876   6.743
    2    HA   GLU  60           HA       GLU  60   1.691 -19.855   6.436
    3    HB2  GLU  60           HB2      GLU  60   1.149 -20.512   8.585
    4    HB3  GLU  60           HB3      GLU  60   0.483 -18.881   8.580
    5    HG2  GLU  60           HG2      GLU  60  -1.290 -20.168   9.440
    6    HG3  GLU  60           HG3      GLU  60  -1.701 -20.030   7.732

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLY  61           H        GLY  61  -1.826 -19.944   5.999
    2    HA3  GLY  61           HA2      GLY  61  -1.596 -22.730   5.019
    3    HA2  GLY  61           HA3      GLY  61  -3.072 -21.996   5.638

  No H/Q in entry =           3
  In of MODEL   54
    1    H    ASP  62           H        ASP  62  -0.871 -20.407   3.413
    2    HA   ASP  62           HA       ASP  62  -2.978 -19.808   1.582
    3    HB2  ASP  62           HB2      ASP  62  -1.175 -18.757   0.265
    4    HB3  ASP  62           HB3      ASP  62  -1.114 -18.274   1.956

  No H/Q in entry =           4
  In of MODEL   54
    1    H    ALA  63           H        ALA  63  -3.429 -22.327   1.401
    2    HA   ALA  63           HA       ALA  63  -1.757 -23.920  -0.271
    3    HB2  ALA  63           HB1      ALA  63  -3.543 -24.824   1.196
    4    HB1  ALA  63           HB2      ALA  63  -3.642 -25.400  -0.468
    5    HB3  ALA  63           HB3      ALA  63  -4.745 -24.145   0.097

  No H/Q in entry =           5
  In of MODEL   54
    1    H    GLY  64           H        GLY  64  -4.466 -21.734  -0.880
    2    HA3  GLY  64           HA2      GLY  64  -5.111 -20.618  -2.788
    3    HA2  GLY  64           HA3      GLY  64  -3.637 -21.175  -3.558

  No H/Q in entry =           3
  In of MODEL   54
    1    H    GLU  65           H        GLU  65  -5.353 -21.236  -5.382
    2    HA   GLU  65           HA       GLU  65  -7.329 -23.248  -5.369
    3    HB2  GLU  65           HB2      GLU  65  -5.924 -21.869  -7.655
    4    HB3  GLU  65           HB3      GLU  65  -7.290 -22.966  -7.859
    5    HG2  GLU  65           HG2      GLU  65  -8.687 -21.543  -6.443
    6    HG3  GLU  65           HG3      GLU  65  -7.322 -20.471  -6.139

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLY  66           H        GLY  66  -4.015 -23.250  -6.448
    2    HA3  GLY  66           HA2      GLY  66  -4.127 -26.128  -7.052
    3    HA2  GLY  66           HA3      GLY  66  -2.953 -25.006  -7.711

  No H/Q in entry =           3
  In of MODEL   54
    1    H    LYS  67           H        LYS  67  -1.816 -27.114  -6.855
    2    HA   LYS  67           HA       LYS  67  -1.319 -27.487  -4.137
    3    HB2  LYS  67           HB2      LYS  67   0.316 -28.196  -6.568
    4    HB3  LYS  67           HB3      LYS  67   0.681 -28.766  -4.935
    5    HG2  LYS  67           HG2      LYS  67  -1.585 -29.730  -4.761
    6    HG3  LYS  67           HG3      LYS  67  -1.950 -29.170  -6.392
    7    HD2  LYS  67           HD2      LYS  67  -0.186 -30.602  -7.306
    8    HD3  LYS  67           HD3      LYS  67   0.254 -31.126  -5.679
    9    HE2  LYS  67           HE2      LYS  67  -1.201 -32.802  -6.719
   10    HE3  LYS  67           HE3      LYS  67  -2.037 -32.035  -5.371
   11    HZ1  LYS  67           HZ1      LYS  67  -2.333 -31.249  -8.218
   12    HZ3  LYS  67           HZ2      LYS  67  -3.193 -30.610  -6.899
   13    HZ2  LYS  67           HZ3      LYS  67  -3.425 -32.226  -7.366

  No H/Q in entry =          13
  In of MODEL   54
    1    H    MET  68           H        MET  68   1.232 -26.449  -6.307
    2    HA   MET  68           HA       MET  68   2.853 -25.292  -4.312
    3    HB2  MET  68           HB2      MET  68   2.890 -24.970  -7.314
    4    HB3  MET  68           HB3      MET  68   4.183 -24.459  -6.228
    5    HG2  MET  68           HG2      MET  68   3.133 -27.294  -6.448
    6    HG3  MET  68           HG3      MET  68   4.611 -26.708  -7.213
    7    HE2  MET  68           HE1      MET  68   5.956 -24.743  -4.745
    8    HE1  MET  68           HE2      MET  68   6.359 -25.623  -6.218
    9    HE3  MET  68           HE3      MET  68   7.111 -26.082  -4.692

  No H/Q in entry =           9
  In of MODEL   54
    1    H    LYS  69           H        LYS  69   0.589 -23.795  -6.610
    2    HA   LYS  69           HA       LYS  69   1.366 -21.134  -6.093
    3    HB2  LYS  69           HB2      LYS  69  -1.151 -22.251  -7.287
    4    HB3  LYS  69           HB3      LYS  69  -0.809 -20.521  -7.174
    5    HG2  LYS  69           HG2      LYS  69   1.298 -20.846  -8.406
    6    HG3  LYS  69           HG3      LYS  69   0.968 -22.575  -8.522
    7    HD2  LYS  69           HD2      LYS  69  -1.091 -22.098  -9.795
    8    HD3  LYS  69           HD3      LYS  69  -0.758 -20.368  -9.682
    9    HE2  LYS  69           HE2      LYS  69   1.366 -20.690 -10.889
   10    HE3  LYS  69           HE3      LYS  69   1.049 -22.421 -10.993
   11    HZ2  LYS  69           HZ1      LYS  69   0.381 -20.766 -12.913
   12    HZ1  LYS  69           HZ2      LYS  69  -1.022 -20.609 -11.967
   13    HZ3  LYS  69           HZ3      LYS  69  -0.552 -22.135 -12.549

  No H/Q in entry =          13
  In of MODEL   54
    1    H    VAL  70           H        VAL  70  -0.183 -19.392  -5.342
    2    HA   VAL  70           HA       VAL  70  -1.573 -20.210  -2.852
    3    HB   VAL  70           HB       VAL  70  -0.794 -18.063  -1.864
    4   HG13  VAL  70          HG11      VAL  70   0.565 -19.830  -1.182
    5   HG12  VAL  70          HG12      VAL  70   1.746 -18.749  -1.923
    6   HG11  VAL  70          HG13      VAL  70   1.146 -20.146  -2.817
    7   HG22  VAL  70          HG21      VAL  70  -0.452 -16.714  -3.856
    8   HG21  VAL  70          HG22      VAL  70   0.728 -17.860  -4.486
    9   HG23  VAL  70          HG23      VAL  70   1.120 -16.889  -3.071

  No H/Q in entry =           9
  In of MODEL   54
    1    H    SER  71           H        SER  71  -3.120 -18.522  -2.111
    2    HA   SER  71           HA       SER  71  -5.038 -17.898  -4.089
    3    HB2  SER  71           HB2      SER  71  -5.547 -18.133  -1.643
    4    HB3  SER  71           HB3      SER  71  -4.697 -16.620  -1.351
    5    HG   SER  71           HG       SER  71  -6.961 -16.330  -1.607

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LEU  72           H        LEU  72  -5.265 -16.223  -5.391
    2    HA   LEU  72           HA       LEU  72  -3.162 -14.410  -5.891
    3    HB2  LEU  72           HB2      LEU  72  -6.042 -14.453  -6.793
    4    HB3  LEU  72           HB3      LEU  72  -4.851 -13.294  -7.380
    5    HG   LEU  72           HG       LEU  72  -4.449 -16.300  -7.535
    6   HD13  LEU  72          HD11      LEU  72  -5.219 -16.223  -9.803
    7   HD12  LEU  72          HD12      LEU  72  -5.311 -14.462  -9.780
    8   HD11  LEU  72          HD13      LEU  72  -6.455 -15.418  -8.837
    9   HD22  LEU  72          HD21      LEU  72  -2.338 -15.323  -7.828
   10   HD21  LEU  72          HD22      LEU  72  -2.985 -13.880  -8.590
   11   HD23  LEU  72          HD23      LEU  72  -2.925 -15.395  -9.486

  No H/Q in entry =          11
  In of MODEL   54
    1    H    VAL  73           H        VAL  73  -6.230 -14.062  -4.212
    2    HA   VAL  73           HA       VAL  73  -6.268 -11.294  -3.840
    3    HB   VAL  73           HB       VAL  73  -7.957 -11.665  -2.229
    4   HG12  VAL  73          HG11      VAL  73  -8.020 -14.040  -4.109
    5   HG11  VAL  73          HG12      VAL  73  -8.456 -12.396  -4.572
    6   HG13  VAL  73          HG13      VAL  73  -9.408 -13.252  -3.360
    7   HG23  VAL  73          HG21      VAL  73  -8.234 -14.178  -1.459
    8   HG22  VAL  73          HG22      VAL  73  -7.099 -13.117  -0.624
    9   HG21  VAL  73          HG23      VAL  73  -6.511 -14.264  -1.826

  No H/Q in entry =           9
  In of MODEL   54
    1    H    LEU  74           H        LEU  74  -4.307 -13.675  -2.304
    2    HA   LEU  74           HA       LEU  74  -3.856 -12.553   0.221
    3    HB2  LEU  74           HB2      LEU  74  -3.079 -14.765  -0.296
    4    HB3  LEU  74           HB3      LEU  74  -2.057 -14.154  -1.595
    5    HG   LEU  74           HG       LEU  74  -0.709 -12.903   0.058
    6   HD13  LEU  74          HD11      LEU  74  -2.210 -12.413   1.826
    7   HD12  LEU  74          HD12      LEU  74  -1.136 -13.635   2.508
    8   HD11  LEU  74          HD13      LEU  74  -2.746 -14.089   1.946
    9   HD21  LEU  74          HD21      LEU  74  -0.541 -15.478  -0.558
   10   HD23  LEU  74          HD22      LEU  74  -0.894 -15.638   1.148
   11   HD22  LEU  74          HD23      LEU  74   0.524 -14.749   0.643

  No H/Q in entry =          11
  In of MODEL   54
    1    H    VAL  75           H        VAL  75  -2.011 -12.138  -2.762
    2    HA   VAL  75           HA       VAL  75  -0.197 -10.223  -1.765
    3    HB   VAL  75           HB       VAL  75  -1.197 -10.678  -4.578
    4   HG12  VAL  75          HG11      VAL  75   0.864  -9.377  -5.216
    5   HG11  VAL  75          HG12      VAL  75   1.100  -8.994  -3.517
    6   HG13  VAL  75          HG13      VAL  75  -0.318  -8.394  -4.361
    7   HG22  VAL  75          HG21      VAL  75   0.763 -12.007  -4.836
    8   HG21  VAL  75          HG22      VAL  75   0.095 -12.494  -3.278
    9   HG23  VAL  75          HG23      VAL  75   1.473 -11.394  -3.342

  No H/Q in entry =           9
  In of MODEL   54
    1    H    GLU  76           H        GLU  76  -3.373  -9.861  -3.371
    2    HA   GLU  76           HA       GLU  76  -3.424  -7.046  -3.450
    3    HB2  GLU  76           HB2      GLU  76  -5.101  -8.476  -4.597
    4    HB3  GLU  76           HB3      GLU  76  -5.731  -8.984  -3.039
    5    HG2  GLU  76           HG2      GLU  76  -7.197  -7.264  -3.880
    6    HG3  GLU  76           HG3      GLU  76  -6.293  -6.560  -2.554

  No H/Q in entry =           6
  In of MODEL   54
    1    H    ALA  77           H        ALA  77  -4.497  -9.293  -0.911
    2    HA   ALA  77           HA       ALA  77  -5.424  -7.304   0.878
    3    HB1  ALA  77           HB1      ALA  77  -4.402 -10.109   1.357
    4    HB3  ALA  77           HB2      ALA  77  -6.080  -9.582   1.244
    5    HB2  ALA  77           HB3      ALA  77  -5.095  -9.099   2.623

  No H/Q in entry =           5
  In of MODEL   54
    1    H    GLN  78           H        GLN  78  -2.284  -8.853   0.453
    2    HA   GLN  78           HA       GLN  78  -0.990  -7.711   2.692
    3    HB2  GLN  78           HB2      GLN  78  -0.152  -9.642   1.308
    4    HB3  GLN  78           HB3      GLN  78   0.265  -8.487   0.046
    5    HG2  GLN  78           HG2      GLN  78   1.753  -7.306   1.610
    6    HG3  GLN  78           HG3      GLN  78   1.336  -8.452   2.880
    7   HE21  GLN  78          HE21      GLN  78   4.047  -8.149   1.946
    8   HE22  GLN  78          HE22      GLN  78   4.493  -9.591   1.168

  No H/Q in entry =           8
  In of MODEL   54
    1    H    LEU  79           H        LEU  79  -1.408  -6.624  -0.641
    2    HA   LEU  79           HA       LEU  79   0.281  -4.399  -0.637
    3    HB2  LEU  79           HB2      LEU  79  -0.778  -5.189  -2.681
    4    HB3  LEU  79           HB3      LEU  79  -2.372  -4.800  -2.044
    5    HG   LEU  79           HG       LEU  79  -1.824  -2.414  -2.009
    6   HD13  LEU  79          HD11      LEU  79   0.425  -2.177  -1.530
    7   HD12  LEU  79          HD12      LEU  79   0.447  -1.877  -3.267
    8   HD11  LEU  79          HD13      LEU  79   0.909  -3.460  -2.640
    9   HD23  LEU  79          HD21      LEU  79  -1.229  -2.196  -4.569
   10   HD22  LEU  79          HD22      LEU  79  -2.749  -2.945  -4.092
   11   HD21  LEU  79          HD23      LEU  79  -1.385  -3.953  -4.566

  No H/Q in entry =          11
  In of MODEL   54
    1    H    HIS  80           H        HIS  80  -3.172  -4.562   0.242
    2    HA   HIS  80           HA       HIS  80  -3.348  -1.811   0.929
    3    HB2  HIS  80           HB2      HIS  80  -5.049  -4.219   1.256
    4    HB3  HIS  80           HB3      HIS  80  -5.350  -2.887   2.375
    5    HD1  HIS  80           HD1      HIS  80  -6.978  -1.240   1.506
    6    HD2  HIS  80           HD2      HIS  80  -4.837  -3.033  -1.590
    7    HE1  HIS  80           HE1      HIS  80  -7.850  -0.225  -0.653
    8    HE2  HIS  80           HE2      HIS  80  -6.551  -1.312  -2.548

  No H/Q in entry =           8
  In of MODEL   54
    1    H    LEU  81           H        LEU  81  -2.834  -4.722   2.893
    2    HA   LEU  81           HA       LEU  81  -2.780  -3.393   5.386
    3    HB2  LEU  81           HB2      LEU  81  -1.581  -6.005   4.468
    4    HB3  LEU  81           HB3      LEU  81  -1.528  -5.459   6.145
    5    HG   LEU  81           HG       LEU  81  -4.099  -5.694   4.556
    6   HD12  LEU  81          HD11      LEU  81  -4.382  -7.771   6.092
    7   HD11  LEU  81          HD12      LEU  81  -2.627  -7.705   6.251
    8   HD13  LEU  81          HD13      LEU  81  -3.361  -7.922   4.662
    9   HD23  LEU  81          HD21      LEU  81  -4.903  -5.914   7.068
   10   HD22  LEU  81          HD22      LEU  81  -4.586  -4.321   6.385
   11   HD21  LEU  81          HD23      LEU  81  -3.384  -5.092   7.421

  No H/Q in entry =          11
  In of MODEL   54
    1    H    MET  82           H        MET  82  -0.135  -4.286   3.167
    2    HA   MET  82           HA       MET  82   1.976  -3.410   4.825
    3    HB2  MET  82           HB2      MET  82   1.713  -3.728   1.834
    4    HB3  MET  82           HB3      MET  82   3.209  -3.167   2.578
    5    HG2  MET  82           HG2      MET  82   1.806  -5.758   3.305
    6    HG3  MET  82           HG3      MET  82   3.161  -5.644   2.184
    7    HE3  MET  82           HE1      MET  82   6.209  -4.930   4.126
    8    HE2  MET  82           HE2      MET  82   5.280  -3.556   3.533
    9    HE1  MET  82           HE3      MET  82   5.350  -5.039   2.585

  No H/Q in entry =           9
  In of MODEL   54
    1    H    THR  83           H        THR  83   0.119  -1.744   2.309
    2    HA   THR  83           HA       THR  83   1.539   0.700   2.392
    3    HB   THR  83           HB       THR  83  -0.650   1.638   1.447
    4    HG1  THR  83           HG1      THR  83  -2.306   0.346   1.357
    5   HG22  THR  83          HG21      THR  83  -0.417  -0.165  -0.571
    6   HG21  THR  83          HG22      THR  83   1.097  -0.468   0.280
    7   HG23  THR  83          HG23      THR  83   0.731   1.150  -0.317

  No H/Q in entry =           7
  In of MODEL   54
    1    H    SER  84           H        SER  84  -1.445  -0.336   4.033
    2    HA   SER  84           HA       SER  84  -1.913   2.085   5.403
    3    HB2  SER  84           HB2      SER  84  -2.745  -0.754   5.959
    4    HB3  SER  84           HB3      SER  84  -3.218   0.580   7.010
    5    HG   SER  84           HG       SER  84  -3.721   0.289   4.223

  No H/Q in entry =           5
  In of MODEL   54
    1    H    MET  85           H        MET  85  -0.194  -0.860   6.483
    2    HA   MET  85           HA       MET  85   0.370   0.045   9.086
    3    HB2  MET  85           HB2      MET  85   0.644  -2.294   8.383
    4    HB3  MET  85           HB3      MET  85   2.014  -1.826   7.376
    5    HG2  MET  85           HG2      MET  85   3.214  -1.010   9.369
    6    HG3  MET  85           HG3      MET  85   1.837  -1.447  10.381
    7    HE2  MET  85           HE1      MET  85   4.961  -3.924   8.326
    8    HE1  MET  85           HE2      MET  85   4.249  -2.393   7.823
    9    HE3  MET  85           HE3      MET  85   3.500  -3.908   7.334

  No H/Q in entry =           9
  In of MODEL   54
    1    H    LEU  86           H        LEU  86   2.258   0.317   6.107
    2    HA   LEU  86           HA       LEU  86   4.495   1.612   7.237
    3    HB2  LEU  86           HB2      LEU  86   4.263   0.547   4.923
    4    HB3  LEU  86           HB3      LEU  86   3.452   2.035   4.434
    5    HG   LEU  86           HG       LEU  86   5.500   3.267   5.392
    6   HD11  LEU  86          HD11      LEU  86   6.208   0.647   6.161
    7   HD13  LEU  86          HD12      LEU  86   7.218   2.088   6.253
    8   HD12  LEU  86          HD13      LEU  86   7.302   1.050   4.832
    9   HD23  LEU  86          HD21      LEU  86   6.173   1.519   3.017
   10   HD22  LEU  86          HD22      LEU  86   6.577   3.213   3.285
   11   HD21  LEU  86          HD23      LEU  86   4.916   2.753   2.910

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ALA  87           H        ALA  87   1.562   2.877   5.707
    2    HA   ALA  87           HA       ALA  87   2.167   5.604   5.801
    3    HB1  ALA  87           HB1      ALA  87  -0.156   3.988   5.285
    4    HB3  ALA  87           HB2      ALA  87   0.152   5.651   4.792
    5    HB2  ALA  87           HB3      ALA  87  -0.618   5.321   6.346

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ARG  88           H        ARG  88   0.508   3.591   8.204
    2    HA   ARG  88           HA       ARG  88   0.033   5.628  10.073
    3    HB2  ARG  88           HB2      ARG  88  -0.913   3.279  10.137
    4    HB3  ARG  88           HB3      ARG  88   0.637   2.768  10.815
    5    HG2  ARG  88           HG2      ARG  88   0.194   4.832  12.457
    6    HG3  ARG  88           HG3      ARG  88  -1.481   4.516  12.025
    7    HD2  ARG  88           HD2      ARG  88  -1.575   2.658  13.260
    8    HD3  ARG  88           HD3      ARG  88   0.004   2.075  12.700
    9    HE   ARG  88           HE       ARG  88  -0.487   3.323  15.171
   10   HH21  ARG  88          HH11      ARG  88   1.094   4.320  16.392
   11   HH22  ARG  88          HH12      ARG  88   2.604   4.747  15.666
   12   HH11  ARG  88          HH21      ARG  88   1.753   3.515  12.560
   13   HH12  ARG  88          HH22      ARG  88   2.985   4.275  13.508

  No H/Q in entry =          13
  In of MODEL   54
    1    H    GLU  89           H        GLU  89   2.818   3.402   9.790
    2    HA   GLU  89           HA       GLU  89   4.119   4.270  12.120
    3    HB2  GLU  89           HB2      GLU  89   4.750   2.259  10.751
    4    HB3  GLU  89           HB3      GLU  89   5.511   3.359   9.600
    5    HG2  GLU  89           HG2      GLU  89   7.026   4.189  11.326
    6    HG3  GLU  89           HG3      GLU  89   6.208   3.227  12.553

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LEU  90           H        LEU  90   4.387   5.451   8.795
    2    HA   LEU  90           HA       LEU  90   6.332   7.441   9.364
    3    HB2  LEU  90           HB2      LEU  90   4.291   7.131   7.167
    4    HB3  LEU  90           HB3      LEU  90   5.525   8.398   7.177
    5    HG   LEU  90           HG       LEU  90   6.196   5.458   7.480
    6   HD12  LEU  90          HD11      LEU  90   6.906   5.707   5.030
    7   HD11  LEU  90          HD12      LEU  90   5.894   7.150   5.008
    8   HD13  LEU  90          HD13      LEU  90   5.175   5.577   5.351
    9   HD22  LEU  90          HD21      LEU  90   8.106   6.598   8.140
   10   HD21  LEU  90          HD22      LEU  90   7.745   8.010   7.148
   11   HD23  LEU  90          HD23      LEU  90   8.389   6.549   6.401

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  91           H        ILE  91   2.792   7.467   9.271
    2    HA   ILE  91           HA       ILE  91   2.464  10.237   9.747
    3    HB   ILE  91           HB       ILE  91   0.675   7.862  10.301
    4   HG12  ILE  91          HG12      ILE  91   0.402  10.158   8.336
    5   HG13  ILE  91          HG13      ILE  91   1.252   8.664   7.940
    6   HG22  ILE  91          HG21      ILE  91  -1.051   9.924  10.406
    7   HG21  ILE  91          HG22      ILE  91   0.363  10.746  11.063
    8   HG23  ILE  91          HG23      ILE  91  -0.264   9.304  11.859
    9   HD13  ILE  91          HD11      ILE  91  -0.694   7.381   8.006
   10   HD12  ILE  91          HD12      ILE  91  -1.291   8.902   7.345
   11   HD11  ILE  91          HD13      ILE  91  -1.536   8.526   9.051

  No H/Q in entry =          11
  In of MODEL   54
    1    H    THR  92           H        THR  92   2.895   7.479  11.922
    2    HA   THR  92           HA       THR  92   2.493   8.837  14.362
    3    HB   THR  92           HB       THR  92   4.286   6.503  13.653
    4    HG1  THR  92           HG1      THR  92   2.314   5.751  13.578
    5   HG22  THR  92          HG21      THR  92   3.943   6.201  16.291
    6   HG21  THR  92          HG22      THR  92   3.881   7.961  16.230
    7   HG23  THR  92          HG23      THR  92   5.303   7.107  15.629

  No H/Q in entry =           7
  In of MODEL   54
    1    H    GLU  93           H        GLU  93   5.412   8.396  12.380
    2    HA   GLU  93           HA       GLU  93   7.195   9.809  14.059
    3    HB2  GLU  93           HB2      GLU  93   7.236   9.515  11.041
    4    HB3  GLU  93           HB3      GLU  93   8.593  10.036  12.038
    5    HG2  GLU  93           HG2      GLU  93   7.186   7.398  12.489
    6    HG3  GLU  93           HG3      GLU  93   8.553   7.556  11.393

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LEU  94           H        LEU  94   5.106  10.845  11.386
    2    HA   LEU  94           HA       LEU  94   5.913  13.549  11.291
    3    HB2  LEU  94           HB2      LEU  94   3.309  12.192  10.568
    4    HB3  LEU  94           HB3      LEU  94   3.566  13.920  10.335
    5    HG   LEU  94           HG       LEU  94   5.564  11.937   9.240
    6   HD11  LEU  94          HD11      LEU  94   2.807  12.498   8.224
    7   HD13  LEU  94          HD12      LEU  94   3.787  11.042   8.073
    8   HD12  LEU  94          HD13      LEU  94   4.107  12.429   7.033
    9   HD23  LEU  94          HD21      LEU  94   5.790  13.785   7.526
   10   HD22  LEU  94          HD22      LEU  94   6.231  14.266   9.165
   11   HD21  LEU  94          HD23      LEU  94   4.670  14.741   8.493

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  95           H        ILE  95   3.403  11.921  13.210
    2    HA   ILE  95           HA       ILE  95   2.381  14.264  14.437
    3    HB   ILE  95           HB       ILE  95   2.409  11.376  15.342
    4   HG12  ILE  95          HG12      ILE  95   0.174  13.158  14.339
    5   HG13  ILE  95          HG13      ILE  95   1.114  12.105  13.285
    6   HG21  ILE  95          HG21      ILE  95   1.148  13.841  16.580
    7   HG23  ILE  95          HG22      ILE  95   2.207  12.666  17.360
    8   HG22  ILE  95          HG23      ILE  95   0.565  12.209  16.907
    9   HD13  ILE  95          HD11      ILE  95   0.224  10.161  14.205
   10   HD12  ILE  95          HD12      ILE  95  -1.156  11.250  14.310
   11   HD11  ILE  95          HD13      ILE  95  -0.169  10.942  15.738

  No H/Q in entry =          11
  In of MODEL   54
    1    H    GLU  96           H        GLU  96   4.989  12.037  15.378
    2    HA   GLU  96           HA       GLU  96   5.583  13.219  17.869
    3    HB2  GLU  96           HB2      GLU  96   6.520  11.064  17.192
    4    HB3  GLU  96           HB3      GLU  96   7.434  11.845  15.904
    5    HG2  GLU  96           HG2      GLU  96   9.105  12.384  17.344
    6    HG3  GLU  96           HG3      GLU  96   7.975  13.190  18.422

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LEU  97           H        LEU  97   6.607  14.012  14.572
    2    HA   LEU  97           HA       LEU  97   8.504  16.004  15.269
    3    HB2  LEU  97           HB2      LEU  97   6.875  15.472  12.794
    4    HB3  LEU  97           HB3      LEU  97   7.896  16.902  12.910
    5    HG   LEU  97           HG       LEU  97   8.934  14.101  13.436
    6   HD12  LEU  97          HD11      LEU  97   9.895  14.311  11.105
    7   HD11  LEU  97          HD12      LEU  97   8.839  15.703  10.867
    8   HD13  LEU  97          HD13      LEU  97   8.145  14.109  11.161
    9   HD23  LEU  97          HD21      LEU  97  11.091  15.385  12.668
   10   HD22  LEU  97          HD22      LEU  97  10.497  15.644  14.308
   11   HD21  LEU  97          HD23      LEU  97  10.163  16.835  13.053

  No H/Q in entry =          11
  In of MODEL   54
    1    H    HIS  98           H        HIS  98   5.003  16.143  14.668
    2    HA   HIS  98           HA       HIS  98   4.705  18.941  14.827
    3    HB2  HIS  98           HB2      HIS  98   2.827  16.685  15.567
    4    HB3  HIS  98           HB3      HIS  98   2.361  18.385  15.641
    5    HD1  HIS  98           HD1      HIS  98   3.346  15.687  13.203
    6    HD2  HIS  98           HD2      HIS  98   1.967  19.620  13.128
    7    HE1  HIS  98           HE1      HIS  98   2.750  16.191  10.791
    8    HE2  HIS  98           HE2      HIS  98   1.913  18.581  10.724

  No H/Q in entry =           8
  In of MODEL   54
    1    H    GLU  99           H        GLU  99   4.877  16.436  17.307
    2    HA   GLU  99           HA       GLU  99   4.302  18.116  19.525
    3    HB2  GLU  99           HB2      GLU  99   4.216  15.633  19.607
    4    HB3  GLU  99           HB3      GLU  99   5.974  15.589  19.472
    5    HG2  GLU  99           HG2      GLU  99   6.194  16.868  21.551
    6    HG3  GLU  99           HG3      GLU  99   4.443  17.007  21.674

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LYS 100           H        LYS 100   7.332  17.197  17.908
    2    HA   LYS 100           HA       LYS 100   9.015  18.586  19.748
    3    HB2  LYS 100           HB2      LYS 100   9.471  17.681  16.896
    4    HB3  LYS 100           HB3      LYS 100  10.715  18.444  17.891
    5    HG2  LYS 100           HG2      LYS 100  10.366  16.682  19.625
    6    HG3  LYS 100           HG3      LYS 100   9.218  15.885  18.546
    7    HD2  LYS 100           HD2      LYS 100  10.987  15.614  16.850
    8    HD3  LYS 100           HD3      LYS 100  12.140  16.423  17.914
    9    HE2  LYS 100           HE2      LYS 100  11.770  14.656  19.626
   10    HE3  LYS 100           HE3      LYS 100  10.678  13.827  18.512
   11    HZ1  LYS 100           HZ1      LYS 100  13.488  14.502  17.818
   12    HZ3  LYS 100           HZ2      LYS 100  12.432  13.453  16.999
   13    HZ2  LYS 100           HZ3      LYS 100  13.044  13.023  18.525

  No H/Q in entry =          13
  In of MODEL   54
    1    H    LEU 101           H        LEU 101   7.276  19.532  16.825
    2    HA   LEU 101           HA       LEU 101   8.484  22.091  16.489
    3    HB2  LEU 101           HB2      LEU 101   5.876  20.863  15.634
    4    HB3  LEU 101           HB3      LEU 101   6.123  22.595  15.435
    5    HG   LEU 101           HG       LEU 101   8.145  20.586  14.424
    6   HD12  LEU 101          HD11      LEU 101   6.957  21.107  12.160
    7   HD11  LEU 101          HD12      LEU 101   5.572  21.530  13.165
    8   HD13  LEU 101          HD13      LEU 101   6.238  19.899  13.226
    9   HD21  LEU 101          HD21      LEU 101   7.508  23.502  13.898
   10   HD23  LEU 101          HD22      LEU 101   8.472  22.550  12.770
   11   HD22  LEU 101          HD23      LEU 101   9.039  22.797  14.421

  No H/Q in entry =          11
  In of MODEL   54
    1    H    LYS 102           H        LYS 102   6.987  20.935  19.120
    2    HA   LYS 102           HA       LYS 102   6.384  22.014  21.069
    3    HB2  LYS 102           HB2      LYS 102   7.649  24.012  19.939
    4    HB3  LYS 102           HB3      LYS 102   6.045  24.618  19.592
    5    HG2  LYS 102           HG2      LYS 102   7.462  24.345  22.221
    6    HG3  LYS 102           HG3      LYS 102   6.500  25.678  21.616
    7    HD2  LYS 102           HD2      LYS 102   5.270  23.035  22.495
    8    HD3  LYS 102           HD3      LYS 102   5.535  24.389  23.584
    9    HE2  LYS 102           HE2      LYS 102   3.233  23.996  22.128
   10    HE3  LYS 102           HE3      LYS 102   3.747  25.537  22.812
   11    HZ2  LYS 102           HZ1      LYS 102   3.180  25.661  20.442
   12    HZ1  LYS 102           HZ2      LYS 102   4.436  24.581  20.092
   13    HZ3  LYS 102           HZ3      LYS 102   4.789  26.107  20.740

  No H/Q in entry =          13
  In of MODEL   54
    1    H    ALA 103           H        ALA 103   4.704  23.575  18.338
    2    HA   ALA 103           HA       ALA 103   2.264  24.145  19.265
    3    HB1  ALA 103           HB1      ALA 103   1.331  23.319  17.031
    4    HB2  ALA 103           HB2      ALA 103   2.973  22.785  16.672
    5    HB3  ALA 103           HB3      ALA 103   2.643  24.495  16.955

  No H/Q in entry =           5
  In of MODEL   54
    1    H1   ALA   1           H3       ALA   1  10.470 -20.179  -6.446
    2    H2   ALA   1           H2       ALA   1   9.484 -20.375  -7.818
    3    H3   ALA   1           H1       ALA   1   9.069 -21.131  -6.354
    4    HA   ALA   1           HA       ALA   1  10.096 -22.935  -7.122
    5    HB1  ALA   1           HB1      ALA   1  10.157 -22.560  -9.396
    6    HB2  ALA   1           HB2      ALA   1  11.889 -22.413  -9.093
    7    HB3  ALA   1           HB3      ALA   1  10.889 -20.964  -9.218

  No H/Q in entry =           7
  In of MODEL   54
    1    H    GLU   2           H        GLU   2  12.378 -23.887  -7.222
    2    HA   GLU   2           HA       GLU   2  13.794 -23.822  -5.031
    3    HB2  GLU   2           HB2      GLU   2  15.108 -23.672  -7.750
    4    HB3  GLU   2           HB3      GLU   2  15.858 -24.294  -6.281
    5    HG2  GLU   2           HG2      GLU   2  14.836 -26.308  -6.520
    6    HG3  GLU   2           HG3      GLU   2  13.262 -25.560  -6.749

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLU   3           H        GLU   3  15.529 -21.942  -7.447
    2    HA   GLU   3           HA       GLU   3  16.714 -20.269  -5.494
    3    HB2  GLU   3           HB2      GLU   3  16.611 -20.246  -8.502
    4    HB3  GLU   3           HB3      GLU   3  17.372 -18.924  -7.618
    5    HG2  GLU   3           HG2      GLU   3  19.047 -20.306  -6.731
    6    HG3  GLU   3           HG3      GLU   3  18.096 -21.770  -6.947

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LEU   4           H        LEU   4  14.392 -19.401  -8.083
    2    HA   LEU   4           HA       LEU   4  13.938 -16.796  -7.446
    3    HB2  LEU   4           HB2      LEU   4  11.749 -18.763  -8.155
    4    HB3  LEU   4           HB3      LEU   4  11.673 -17.013  -8.341
    5    HG   LEU   4           HG       LEU   4  13.614 -18.869  -9.757
    6   HD13  LEU   4          HD11      LEU   4  12.282 -18.705 -11.646
    7   HD12  LEU   4          HD12      LEU   4  11.584 -17.163 -11.156
    8   HD11  LEU   4          HD13      LEU   4  11.040 -18.658 -10.397
    9   HD23  LEU   4          HD21      LEU   4  13.931 -16.614 -11.098
   10   HD22  LEU   4          HD22      LEU   4  14.815 -16.868  -9.594
   11   HD21  LEU   4          HD23      LEU   4  13.363 -15.870  -9.603

  No H/Q in entry =          11
  In of MODEL   54
    1    H    GLU   5           H        GLU   5  12.476 -19.590  -5.800
    2    HA   GLU   5           HA       GLU   5  10.827 -18.029  -4.060
    3    HB2  GLU   5           HB2      GLU   5  10.389 -20.402  -4.590
    4    HB3  GLU   5           HB3      GLU   5  11.839 -20.847  -3.688
    5    HG2  GLU   5           HG2      GLU   5  10.914 -19.855  -1.652
    6    HG3  GLU   5           HG3      GLU   5   9.483 -19.330  -2.540

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLU   6           H        GLU   6  13.978 -19.614  -3.678
    2    HA   GLU   6           HA       GLU   6  14.374 -18.777  -0.979
    3    HB2  GLU   6           HB2      GLU   6  15.585 -20.686  -1.989
    4    HB3  GLU   6           HB3      GLU   6  16.421 -19.567  -3.068
    5    HG2  GLU   6           HG2      GLU   6  17.407 -18.411  -1.146
    6    HG3  GLU   6           HG3      GLU   6  16.533 -19.470  -0.040

  No H/Q in entry =           6
  In of MODEL   54
    1    H    VAL   7           H        VAL   7  15.091 -17.429  -4.131
    2    HA   VAL   7           HA       VAL   7  16.792 -15.310  -3.278
    3    HB   VAL   7           HB       VAL   7  15.047 -15.655  -5.731
    4   HG11  VAL   7          HG11      VAL   7  16.955 -13.448  -4.933
    5   HG13  VAL   7          HG12      VAL   7  15.303 -13.301  -5.530
    6   HG12  VAL   7          HG13      VAL   7  16.595 -13.796  -6.624
    7   HG21  VAL   7          HG21      VAL   7  17.162 -17.116  -5.206
    8   HG23  VAL   7          HG22      VAL   7  18.062 -15.653  -5.608
    9   HG22  VAL   7          HG23      VAL   7  17.006 -16.394  -6.808

  No H/Q in entry =           9
  In of MODEL   54
    1    H    VAL   8           H        VAL   8  13.291 -15.574  -3.782
    2    HA   VAL   8           HA       VAL   8  12.634 -12.869  -3.281
    3    HB   VAL   8           HB       VAL   8  11.034 -15.404  -2.851
    4   HG12  VAL   8          HG11      VAL   8   9.106 -13.635  -3.006
    5   HG11  VAL   8          HG12      VAL   8  10.349 -12.493  -2.495
    6   HG13  VAL   8          HG13      VAL   8   9.937 -13.864  -1.467
    7   HG23  VAL   8          HG21      VAL   8  10.343 -13.444  -4.989
    8   HG22  VAL   8          HG22      VAL   8  10.365 -15.204  -5.042
    9   HG21  VAL   8          HG23      VAL   8  11.866 -14.302  -5.223

  No H/Q in entry =           9
  In of MODEL   54
    1    H    MET   9           H        MET   9  12.934 -15.690  -1.125
    2    HA   MET   9           HA       MET   9  12.157 -14.435   1.266
    3    HB2  MET   9           HB2      MET   9  14.006 -16.727   0.648
    4    HB3  MET   9           HB3      MET   9  13.835 -16.134   2.301
    5    HG2  MET   9           HG2      MET   9  11.294 -16.356   1.927
    6    HG3  MET   9           HG3      MET   9  11.714 -17.323   0.512
    7    HE1  MET   9           HE1      MET   9  12.659 -19.372   0.368
    8    HE3  MET   9           HE2      MET   9  13.122 -20.501   1.639
    9    HE2  MET   9           HE3      MET   9  14.190 -19.162   1.228

  No H/Q in entry =           9
  In of MODEL   54
    1    H    GLY  10           H        GLY  10  15.313 -14.648  -0.341
    2    HA3  GLY  10           HA2      GLY  10  16.802 -13.241   1.615
    3    HA2  GLY  10           HA3      GLY  10  17.239 -13.394  -0.086

  No H/Q in entry =           3
  In of MODEL   54
    1    H    LEU  11           H        LEU  11  15.051 -12.165  -1.283
    2    HA   LEU  11           HA       LEU  11  15.737  -9.421  -1.111
    3    HB2  LEU  11           HB2      LEU  11  13.351 -10.823  -2.319
    4    HB3  LEU  11           HB3      LEU  11  13.628  -9.088  -2.471
    5    HG   LEU  11           HG       LEU  11  15.644 -11.189  -3.305
    6   HD13  LEU  11          HD11      LEU  11  13.875 -11.547  -4.800
    7   HD12  LEU  11          HD12      LEU  11  14.864 -10.359  -5.648
    8   HD11  LEU  11          HD13      LEU  11  13.403  -9.847  -4.803
    9   HD22  LEU  11          HD21      LEU  11  16.878  -9.227  -3.085
   10   HD21  LEU  11          HD22      LEU  11  15.497  -8.188  -3.435
   11   HD23  LEU  11          HD23      LEU  11  16.308  -9.047  -4.742

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  12           H        ILE  12  12.990 -11.258   0.186
    2    HA   ILE  12           HA       ILE  12  11.612  -9.043   1.283
    3    HB   ILE  12           HB       ILE  12  11.667 -11.942   2.179
    4   HG12  ILE  12          HG12      ILE  12  10.894 -11.268  -0.218
    5   HG13  ILE  12          HG13      ILE  12   9.862 -12.331   0.717
    6   HG23  ILE  12          HG21      ILE  12  10.800 -10.582   3.991
    7   HG22  ILE  12          HG22      ILE  12   9.434 -11.377   3.210
    8   HG21  ILE  12          HG23      ILE  12   9.772  -9.679   2.879
    9   HD13  ILE  12          HD11      ILE  12   8.421 -10.468   1.296
   10   HD12  ILE  12          HD12      ILE  12   8.640 -10.489  -0.452
   11   HD11  ILE  12          HD13      ILE  12   9.521  -9.336   0.527

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  13           H        ILE  13  14.029 -11.254   2.636
    2    HA   ILE  13           HA       ILE  13  14.103 -10.093   5.224
    3    HB   ILE  13           HB       ILE  13  16.145 -11.647   3.616
    4   HG12  ILE  13          HG12      ILE  13  13.916 -12.675   4.410
    5   HG13  ILE  13          HG13      ILE  13  15.397 -13.549   4.792
    6   HG21  ILE  13          HG21      ILE  13  16.292 -10.600   6.447
    7   HG23  ILE  13          HG22      ILE  13  17.496 -10.461   5.174
    8   HG22  ILE  13          HG23      ILE  13  17.209 -12.020   5.947
    9   HD11  ILE  13          HD11      ILE  13  14.579 -11.572   6.844
   10   HD13  ILE  13          HD12      ILE  13  15.155 -13.225   7.030
   11   HD12  ILE  13          HD13      ILE  13  13.469 -12.923   6.628

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ASN  14           H        ASN  14  16.010  -9.538   2.279
    2    HA   ASN  14           HA       ASN  14  17.766  -7.600   3.327
    3    HB2  ASN  14           HB2      ASN  14  17.711  -8.850   1.003
    4    HB3  ASN  14           HB3      ASN  14  16.806  -7.431   0.490
    5   HD21  ASN  14          HD21      ASN  14  19.229  -7.756  -0.735
    6   HD22  ASN  14          HD22      ASN  14  20.379  -6.674  -0.118

  No H/Q in entry =           6
  In of MODEL   54
    1    H    SER  15           H        SER  15  14.629  -7.249   1.686
    2    HA   SER  15           HA       SER  15  14.510  -4.429   1.764
    3    HB2  SER  15           HB2      SER  15  12.172  -4.679   1.300
    4    HB3  SER  15           HB3      SER  15  12.959  -6.039   0.511
    5    HG   SER  15           HG       SER  15  12.444  -7.295   2.355

  No H/Q in entry =           5
  In of MODEL   54
    1    H    GLY  16           H        GLY  16  13.459  -6.908   4.066
    2    HA3  GLY  16           HA2      GLY  16  12.261  -5.176   5.954
    3    HA2  GLY  16           HA3      GLY  16  12.886  -6.785   6.296

  No H/Q in entry =           3
  In of MODEL   54
    1    H    GLN  17           H        GLN  17  15.587  -6.439   5.664
    2    HA   GLN  17           HA       GLN  17  16.576  -5.232   8.039
    3    HB2  GLN  17           HB2      GLN  17  17.796  -7.010   6.822
    4    HB3  GLN  17           HB3      GLN  17  18.071  -5.895   5.483
    5    HG2  GLN  17           HG2      GLN  17  19.356  -4.411   6.926
    6    HG3  GLN  17           HG3      GLN  17  18.998  -5.416   8.329
    7   HE21  GLN  17          HE21      GLN  17  21.700  -4.919   7.529
    8   HE22  GLN  17          HE22      GLN  17  22.367  -6.375   6.968

  No H/Q in entry =           8
  In of MODEL   54
    1    H    ALA  18           H        ALA  18  16.332  -4.131   4.689
    2    HA   ALA  18           HA       ALA  18  17.763  -1.735   4.911
    3    HB2  ALA  18           HB1      ALA  18  16.618  -2.940   2.853
    4    HB3  ALA  18           HB2      ALA  18  16.876  -1.195   2.845
    5    HB1  ALA  18           HB3      ALA  18  15.285  -1.849   3.235

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ARG  19           H        ARG  19  14.272  -2.339   5.357
    2    HA   ARG  19           HA       ARG  19  13.605   0.304   6.101
    3    HB2  ARG  19           HB2      ARG  19  11.922  -1.450   5.527
    4    HB3  ARG  19           HB3      ARG  19  12.290  -2.257   7.053
    5    HG2  ARG  19           HG2      ARG  19  11.591  -0.277   8.317
    6    HG3  ARG  19           HG3      ARG  19  11.315   0.609   6.819
    7    HD2  ARG  19           HD2      ARG  19   9.189  -0.201   7.666
    8    HD3  ARG  19           HD3      ARG  19   9.589  -1.069   6.177
    9    HE   ARG  19           HE       ARG  19  10.585  -2.622   8.257
   10   HH21  ARG  19          HH11      ARG  19   9.356  -4.274   9.203
   11   HH22  ARG  19          HH12      ARG  19   7.634  -4.251   9.058
   12   HH11  ARG  19          HH21      ARG  19   7.570  -1.333   7.216
   13   HH12  ARG  19          HH22      ARG  19   6.622  -2.587   7.929

  No H/Q in entry =          13
  In of MODEL   54
    1    H    SER  20           H        SER  20  14.503  -2.537   8.027
    2    HA   SER  20           HA       SER  20  14.254  -1.456  10.576
    3    HB2  SER  20           HB2      SER  20  14.890  -3.863   9.868
    4    HB3  SER  20           HB3      SER  20  16.547  -3.266   9.836
    5    HG   SER  20           HG       SER  20  16.288  -2.639  12.004

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LEU  21           H        LEU  21  17.065  -1.369   8.397
    2    HA   LEU  21           HA       LEU  21  18.760   0.111  10.121
    3    HB2  LEU  21           HB2      LEU  21  18.694  -0.137   7.106
    4    HB3  LEU  21           HB3      LEU  21  19.960   0.717   7.984
    5    HG   LEU  21           HG       LEU  21  19.234  -2.176   8.520
    6   HD12  LEU  21          HD11      LEU  21  21.505  -2.512   7.274
    7   HD11  LEU  21          HD12      LEU  21  21.167  -0.929   6.575
    8   HD13  LEU  21          HD13      LEU  21  20.044  -2.263   6.318
    9   HD22  LEU  21          HD21      LEU  21  20.450  -1.499  10.391
   10   HD21  LEU  21          HD22      LEU  21  21.358  -0.280   9.506
   11   HD23  LEU  21          HD23      LEU  21  21.777  -1.977   9.335

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ALA  22           H        ALA  22  16.454   1.090   7.606
    2    HA   ALA  22           HA       ALA  22  16.983   3.850   7.631
    3    HB3  ALA  22           HB1      ALA  22  15.560   2.614   5.966
    4    HB2  ALA  22           HB2      ALA  22  14.856   4.120   6.553
    5    HB1  ALA  22           HB3      ALA  22  14.281   2.574   7.179

  No H/Q in entry =           5
  In of MODEL   54
    1    H    TYR  23           H        TYR  23  14.521   2.012   9.491
    2    HA   TYR  23           HA       TYR  23  13.572   4.235  10.970
    3    HB2  TYR  23           HB2      TYR  23  12.345   2.116  10.951
    4    HB3  TYR  23           HB3      TYR  23  13.691   1.307  11.753
    5    HD1  TYR  23           HD1      TYR  23  11.182   4.038  12.169
    6    HD2  TYR  23           HD2      TYR  23  13.918   1.354  14.106
    7    HE1  TYR  23           HE1      TYR  23  10.281   4.715  14.380
    8    HE2  TYR  23           HE2      TYR  23  13.018   2.029  16.316
    9    HH   TYR  23           HH       TYR  23  11.109   4.751  16.767

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ALA  24           H        ALA  24  16.234   1.964  11.551
    2    HA   ALA  24           HA       ALA  24  16.939   2.944  14.111
    3    HB1  ALA  24           HB1      ALA  24  18.299   1.156  13.914
    4    HB3  ALA  24           HB2      ALA  24  19.307   2.089  12.806
    5    HB2  ALA  24           HB3      ALA  24  18.006   1.081  12.177

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ALA  25           H        ALA  25  17.844   3.899  10.825
    2    HA   ALA  25           HA       ALA  25  19.793   5.835  11.455
    3    HB1  ALA  25           HB1      ALA  25  19.045   4.901   9.145
    4    HB3  ALA  25           HB2      ALA  25  19.543   6.589   9.242
    5    HB2  ALA  25           HB3      ALA  25  17.828   6.178   9.196

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LEU  26           H        LEU  26  16.273   6.056  11.148
    2    HA   LEU  26           HA       LEU  26  16.047   8.834  11.623
    3    HB2  LEU  26           HB2      LEU  26  14.176   7.599  10.714
    4    HB3  LEU  26           HB3      LEU  26  14.109   6.561  12.133
    5    HG   LEU  26           HG       LEU  26  13.518   8.508  13.536
    6   HD12  LEU  26          HD11      LEU  26  12.832  10.616  12.236
    7   HD11  LEU  26          HD12      LEU  26  13.795   9.975  10.907
    8   HD13  LEU  26          HD13      LEU  26  14.562  10.351  12.451
    9   HD21  LEU  26          HD21      LEU  26  11.806   8.208  11.049
   10   HD23  LEU  26          HD22      LEU  26  11.267   8.893  12.579
   11   HD22  LEU  26          HD23      LEU  26  11.722   7.193  12.490

  No H/Q in entry =          11
  In of MODEL   54
    1    H    LYS  27           H        LYS  27  15.979   6.039  13.797
    2    HA   LYS  27           HA       LYS  27  15.418   7.386  16.184
    3    HB2  LYS  27           HB2      LYS  27  15.448   4.913  15.901
    4    HB3  LYS  27           HB3      LYS  27  17.211   4.970  15.831
    5    HG2  LYS  27           HG2      LYS  27  17.292   5.940  18.087
    6    HG3  LYS  27           HG3      LYS  27  15.526   5.954  18.159
    7    HD2  LYS  27           HD2      LYS  27  15.503   3.488  17.905
    8    HD3  LYS  27           HD3      LYS  27  17.267   3.482  17.867
    9    HE2  LYS  27           HE2      LYS  27  17.333   4.455  20.130
   10    HE3  LYS  27           HE3      LYS  27  15.567   4.491  20.171
   11    HZ3  LYS  27           HZ1      LYS  27  16.377   2.532  21.296
   12    HZ2  LYS  27           HZ2      LYS  27  17.273   2.065  19.928
   13    HZ1  LYS  27           HZ3      LYS  27  15.574   2.067  19.874

  No H/Q in entry =          13
  In of MODEL   54
    1    H    GLN  28           H        GLN  28  18.512   6.821  14.541
    2    HA   GLN  28           HA       GLN  28  20.224   7.894  16.514
    3    HB2  GLN  28           HB2      GLN  28  20.465   7.866  13.494
    4    HB3  GLN  28           HB3      GLN  28  21.767   8.339  14.586
    5    HG2  GLN  28           HG2      GLN  28  20.361   5.654  14.635
    6    HG3  GLN  28           HG3      GLN  28  21.932   5.953  13.896
    7   HE21  GLN  28          HE21      GLN  28  20.686   4.636  16.618
    8   HE22  GLN  28          HE22      GLN  28  21.894   5.051  17.735

  No H/Q in entry =           8
  In of MODEL   54
    1    H    ALA  29           H        ALA  29  18.430   9.393  13.859
    2    HA   ALA  29           HA       ALA  29  19.429  12.013  14.116
    3    HB2  ALA  29           HB1      ALA  29  17.708  12.658  12.674
    4    HB1  ALA  29           HB2      ALA  29  16.575  11.479  13.334
    5    HB3  ALA  29           HB3      ALA  29  17.890  10.946  12.287

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LYS  30           H        LYS  30  16.677  10.400  15.666
    2    HA   LYS  30           HA       LYS  30  15.681  12.642  17.055
    3    HB2  LYS  30           HB2      LYS  30  15.582   9.696  17.739
    4    HB3  LYS  30           HB3      LYS  30  14.729  10.939  18.654
    5    HG2  LYS  30           HG2      LYS  30  13.572  11.639  16.558
    6    HG3  LYS  30           HG3      LYS  30  14.365  10.310  15.710
    7    HD2  LYS  30           HD2      LYS  30  13.317   8.691  17.243
    8    HD3  LYS  30           HD3      LYS  30  12.535  10.009  18.115
    9    HE2  LYS  30           HE2      LYS  30  11.335  10.656  16.045
   10    HE3  LYS  30           HE3      LYS  30  12.098   9.309  15.192
   11    HZ2  LYS  30           HZ1      LYS  30   9.803   8.891  16.104
   12    HZ1  LYS  30           HZ2      LYS  30  10.494   8.934  17.661
   13    HZ3  LYS  30           HZ3      LYS  30  10.986   7.757  16.535

  No H/Q in entry =          13
  In of MODEL   54
    1    H    GLN  31           H        GLN  31  18.354  10.469  17.736
    2    HA   GLN  31           HA       GLN  31  18.721  11.464  20.433
    3    HB2  GLN  31           HB2      GLN  31  20.721   9.906  18.786
    4    HB3  GLN  31           HB3      GLN  31  20.613  10.018  20.543
    5    HG2  GLN  31           HG2      GLN  31  18.088   9.070  19.805
    6    HG3  GLN  31           HG3      GLN  31  19.174   8.234  18.703
    7   HE21  GLN  31          HE21      GLN  31  17.666   7.071  20.994
    8   HE22  GLN  31          HE22      GLN  31  18.838   6.403  22.022

  No H/Q in entry =           8
  In of MODEL   54
    1    H    GLY  32           H        GLY  32  19.195  12.803  17.468
    2    HA3  GLY  32           HA2      GLY  32  20.171  14.853  16.954
    3    HA2  GLY  32           HA3      GLY  32  20.952  14.846  18.530

  No H/Q in entry =           3
  In of MODEL   54
    1    H    ASP  33           H        ASP  33  21.349  11.967  16.726
    2    HA   ASP  33           HA       ASP  33  24.166  12.647  16.223
    3    HB2  ASP  33           HB2      ASP  33  22.661  10.030  16.343
    4    HB3  ASP  33           HB3      ASP  33  24.340  10.151  15.823

  No H/Q in entry =           4
  In of MODEL   54
    1    H    PHE  34           H        PHE  34  23.656  13.984  14.358
    2    HA   PHE  34           HA       PHE  34  22.273  13.016  12.085
    3    HB2  PHE  34           HB2      PHE  34  24.406  15.150  12.298
    4    HB3  PHE  34           HB3      PHE  34  23.400  14.869  10.879
    5    HD1  PHE  34           HD1      PHE  34  23.693  16.782  13.803
    6    HD2  PHE  34           HD2      PHE  34  20.781  14.681  11.445
    7    HE1  PHE  34           HE1      PHE  34  21.890  18.171  14.787
    8    HE2  PHE  34           HE2      PHE  34  18.983  16.071  12.432
    9    HZ   PHE  34           HZ       PHE  34  19.541  17.816  14.099

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ALA  35           H        ALA  35  25.663  12.823  13.040
    2    HA   ALA  35           HA       ALA  35  26.731  12.021  10.561
    3    HB3  ALA  35           HB1      ALA  35  28.439  10.841  12.247
    4    HB2  ALA  35           HB2      ALA  35  27.592  11.857  13.413
    5    HB1  ALA  35           HB3      ALA  35  28.407  12.591  12.033

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ALA  36           H        ALA  36  25.659  10.044  13.329
    2    HA   ALA  36           HA       ALA  36  26.127   7.566  12.028
    3    HB2  ALA  36           HB1      ALA  36  25.728   6.804  14.104
    4    HB3  ALA  36           HB2      ALA  36  24.038   7.298  13.983
    5    HB1  ALA  36           HB3      ALA  36  25.247   8.427  14.596

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ALA  37           H        ALA  37  23.305   9.688  12.219
    2    HA   ALA  37           HA       ALA  37  21.434   7.924  11.059
    3    HB3  ALA  37           HB1      ALA  37  21.660  10.885  11.369
    4    HB1  ALA  37           HB2      ALA  37  20.357   9.801  11.853
    5    HB2  ALA  37           HB3      ALA  37  20.519  10.286  10.165

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LYS  38           H        LYS  38  23.507  10.399   9.566
    2    HA   LYS  38           HA       LYS  38  22.828   9.990   6.896
    3    HB2  LYS  38           HB2      LYS  38  24.657  11.540   8.325
    4    HB3  LYS  38           HB3      LYS  38  25.676  10.560   7.277
    5    HG2  LYS  38           HG2      LYS  38  24.480  11.343   5.304
    6    HG3  LYS  38           HG3      LYS  38  23.299  12.188   6.309
    7    HD2  LYS  38           HD2      LYS  38  24.902  13.784   7.049
    8    HD3  LYS  38           HD3      LYS  38  26.256  12.804   6.486
    9    HE2  LYS  38           HE2      LYS  38  25.872  14.686   4.953
   10    HE3  LYS  38           HE3      LYS  38  25.528  13.154   4.143
   11    HZ3  LYS  38           HZ1      LYS  38  23.329  13.595   4.049
   12    HZ2  LYS  38           HZ2      LYS  38  23.849  15.210   4.141
   13    HZ1  LYS  38           HZ3      LYS  38  23.298  14.415   5.536

  No H/Q in entry =          13
  In of MODEL   54
    1    H    ALA  39           H        ALA  39  25.374   8.383   8.802
    2    HA   ALA  39           HA       ALA  39  26.415   6.812   6.705
    3    HB2  ALA  39           HB1      ALA  39  26.372   5.828   9.543
    4    HB1  ALA  39           HB2      ALA  39  27.315   7.258   9.123
    5    HB3  ALA  39           HB3      ALA  39  27.658   5.714   8.343

  No H/Q in entry =           5
  In of MODEL   54
    1    H    MET  40           H        MET  40  23.839   6.174   9.038
    2    HA   MET  40           HA       MET  40  23.391   3.473   8.291
    3    HB2  MET  40           HB2      MET  40  21.589   5.503   9.625
    4    HB3  MET  40           HB3      MET  40  21.184   3.794   9.444
    5    HG2  MET  40           HG2      MET  40  23.751   4.731  10.753
    6    HG3  MET  40           HG3      MET  40  22.271   4.446  11.667
    7    HE3  MET  40           HE1      MET  40  21.719   0.809  11.824
    8    HE2  MET  40           HE2      MET  40  20.835   2.116  11.040
    9    HE1  MET  40           HE3      MET  40  21.599   2.394  12.603

  No H/Q in entry =           9
  In of MODEL   54
    1    H    MET  41           H        MET  41  21.952   6.531   7.147
    2    HA   MET  41           HA       MET  41  19.973   5.343   5.496
    3    HB2  MET  41           HB2      MET  41  21.439   7.941   4.980
    4    HB3  MET  41           HB3      MET  41  19.902   7.448   4.281
    5    HG2  MET  41           HG2      MET  41  19.195   7.239   6.842
    6    HG3  MET  41           HG3      MET  41  20.504   8.399   7.052
    7    HE2  MET  41           HE1      MET  41  19.887   9.709   3.734
    8    HE1  MET  41           HE2      MET  41  20.864  10.141   5.134
    9    HE3  MET  41           HE3      MET  41  19.580  11.221   4.597

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ASP  42           H        ASP  42  23.334   6.279   4.899
    2    HA   ASP  42           HA       ASP  42  23.385   5.825   2.137
    3    HB2  ASP  42           HB2      ASP  42  25.160   6.815   3.887
    4    HB3  ASP  42           HB3      ASP  42  25.820   5.192   3.738

  No H/Q in entry =           4
  In of MODEL   54
    1    H    GLN  43           H        GLN  43  24.157   3.653   4.831
    2    HA   GLN  43           HA       GLN  43  24.803   1.409   3.221
    3    HB2  GLN  43           HB2      GLN  43  23.823   1.569   6.082
    4    HB3  GLN  43           HB3      GLN  43  24.395   0.087   5.307
    5    HG2  GLN  43           HG2      GLN  43  26.547   1.308   4.772
    6    HG3  GLN  43           HG3      GLN  43  25.975   2.626   5.790
    7   HE21  GLN  43          HE21      GLN  43  28.227   1.652   6.786
    8   HE22  GLN  43          HE22      GLN  43  27.975   0.559   8.058

  No H/Q in entry =           8
  In of MODEL   54
    1    H    SER  44           H        SER  44  21.765   2.524   4.661
    2    HA   SER  44           HA       SER  44  20.193   0.281   3.996
    3    HB2  SER  44           HB2      SER  44  19.762   2.800   5.166
    4    HB3  SER  44           HB3      SER  44  18.706   2.764   3.757
    5    HG   SER  44           HG       SER  44  17.641   1.805   5.489

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ARG  45           H        ARG  45  20.900   3.261   2.202
    2    HA   ARG  45           HA       ARG  45  19.341   2.787  -0.083
    3    HB2  ARG  45           HB2      ARG  45  20.488   4.922   0.499
    4    HB3  ARG  45           HB3      ARG  45  22.029   4.175   0.085
    5    HG2  ARG  45           HG2      ARG  45  21.211   3.784  -2.220
    6    HG3  ARG  45           HG3      ARG  45  19.683   4.554  -1.805
    7    HD2  ARG  45           HD2      ARG  45  20.936   6.650  -1.224
    8    HD3  ARG  45           HD3      ARG  45  22.426   5.885  -1.821
    9    HE   ARG  45           HE       ARG  45  20.465   5.656  -3.829
   10   HH21  ARG  45          HH11      ARG  45  20.428   7.038  -5.582
   11   HH22  ARG  45          HH12      ARG  45  21.182   8.590  -5.478
   12   HH11  ARG  45          HH21      ARG  45  22.214   8.148  -2.211
   13   HH12  ARG  45          HH22      ARG  45  22.193   9.217  -3.566

  No H/Q in entry =          13
  In of MODEL   54
    1    H    MET  46           H        MET  46  22.719   1.916   0.606
    2    HA   MET  46           HA       MET  46  23.289   0.742  -1.895
    3    HB2  MET  46           HB2      MET  46  24.439   0.388   0.874
    4    HB3  MET  46           HB3      MET  46  25.080  -0.478  -0.526
    5    HG2  MET  46           HG2      MET  46  25.464   1.666  -1.686
    6    HG3  MET  46           HG3      MET  46  24.816   2.537  -0.301
    7    HE3  MET  46           HE1      MET  46  28.564   3.396  -0.116
    8    HE2  MET  46           HE2      MET  46  26.997   4.007   0.401
    9    HE1  MET  46           HE3      MET  46  27.233   3.517  -1.276

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ALA  47           H        ALA  47  21.955  -0.615   1.092
    2    HA   ALA  47           HA       ALA  47  21.894  -3.322   0.271
    3    HB2  ALA  47           HB1      ALA  47  21.551  -2.879   2.584
    4    HB3  ALA  47           HB2      ALA  47  20.006  -3.480   1.985
    5    HB1  ALA  47           HB3      ALA  47  20.236  -1.751   2.252

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LEU  48           H        LEU  48  19.531  -0.697  -0.030
    2    HA   LEU  48           HA       LEU  48  17.470  -2.226  -1.260
    3    HB2  LEU  48           HB2      LEU  48  18.117   0.731  -1.364
    4    HB3  LEU  48           HB3      LEU  48  16.637   0.022  -2.012
    5    HG   LEU  48           HG       LEU  48  17.537  -0.298   0.860
    6   HD13  LEU  48          HD11      LEU  48  17.113   2.003   0.696
    7   HD12  LEU  48          HD12      LEU  48  15.564   1.349   1.226
    8   HD11  LEU  48          HD13      LEU  48  15.807   1.784  -0.466
    9   HD22  LEU  48          HD21      LEU  48  16.005  -2.012   0.492
   10   HD21  LEU  48          HD22      LEU  48  15.110  -1.102  -0.725
   11   HD23  LEU  48          HD23      LEU  48  14.924  -0.710   0.984

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ASN  49           H        ASN  49  20.135  -0.285  -2.520
    2    HA   ASN  49           HA       ASN  49  19.440  -0.351  -5.233
    3    HB2  ASN  49           HB2      ASN  49  21.133   1.161  -4.326
    4    HB3  ASN  49           HB3      ASN  49  22.171  -0.200  -3.922
    5   HD21  ASN  49          HD21      ASN  49  23.886  -0.087  -5.359
    6   HD22  ASN  49          HD22      ASN  49  23.735   0.108  -7.038

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLU  50           H        GLU  50  21.459  -2.556  -3.318
    2    HA   GLU  50           HA       GLU  50  22.128  -4.296  -5.467
    3    HB2  GLU  50           HB2      GLU  50  23.361  -4.284  -3.321
    4    HB3  GLU  50           HB3      GLU  50  21.932  -4.919  -2.505
    5    HG2  GLU  50           HG2      GLU  50  22.002  -6.943  -3.879
    6    HG3  GLU  50           HG3      GLU  50  23.362  -6.302  -4.798

  No H/Q in entry =           6
  In of MODEL   54
    1    H    ALA  51           H        ALA  51  19.510  -4.250  -3.098
    2    HA   ALA  51           HA       ALA  51  18.334  -6.719  -3.852
    3    HB3  ALA  51           HB1      ALA  51  16.767  -6.226  -2.268
    4    HB1  ALA  51           HB2      ALA  51  16.542  -4.576  -2.852
    5    HB2  ALA  51           HB3      ALA  51  17.919  -4.967  -1.821

  No H/Q in entry =           5
  In of MODEL   54
    1    H    HIS  52           H        HIS  52  17.727  -3.365  -4.855
    2    HA   HIS  52           HA       HIS  52  15.585  -3.882  -6.623
    3    HB2  HIS  52           HB2      HIS  52  16.401  -1.624  -5.762
    4    HB3  HIS  52           HB3      HIS  52  17.655  -1.717  -6.998
    5    HD1  HIS  52           HD1      HIS  52  16.446  -2.503  -9.488
    6    HD2  HIS  52           HD2      HIS  52  14.229  -0.262  -6.760
    7    HE1  HIS  52           HE1      HIS  52  14.574  -1.417 -10.805
    8    HE2  HIS  52           HE2      HIS  52  13.214  -0.047  -9.156

  No H/Q in entry =           8
  In of MODEL   54
    1    H    LEU  53           H        LEU  53  19.096  -3.881  -7.114
    2    HA   LEU  53           HA       LEU  53  19.108  -4.178  -9.917
    3    HB2  LEU  53           HB2      LEU  53  21.077  -4.949  -7.780
    4    HB3  LEU  53           HB3      LEU  53  21.366  -5.327  -9.475
    5    HG   LEU  53           HG       LEU  53  20.708  -2.523  -8.519
    6   HD11  LEU  53          HD11      LEU  53  22.792  -3.332  -7.441
    7   HD13  LEU  53          HD12      LEU  53  23.117  -2.065  -8.623
    8   HD12  LEU  53          HD13      LEU  53  23.434  -3.747  -9.028
    9   HD21  LEU  53          HD21      LEU  53  21.755  -3.731 -11.089
   10   HD23  LEU  53          HD22      LEU  53  22.063  -2.044 -10.692
   11   HD22  LEU  53          HD23      LEU  53  20.415  -2.609 -10.887

  No H/Q in entry =          11
  In of MODEL   54
    1    H    VAL  54           H        VAL  54  19.042  -6.582  -7.305
    2    HA   VAL  54           HA       VAL  54  19.141  -8.865  -8.981
    3    HB   VAL  54           HB       VAL  54  18.032  -8.461  -6.193
    4   HG12  VAL  54          HG11      VAL  54  18.361 -11.078  -6.211
    5   HG11  VAL  54          HG12      VAL  54  18.147 -10.899  -7.952
    6   HG13  VAL  54          HG13      VAL  54  16.875 -10.378  -6.849
    7   HG22  VAL  54          HG21      VAL  54  20.351  -8.248  -6.007
    8   HG21  VAL  54          HG22      VAL  54  20.668  -9.331  -7.360
    9   HG23  VAL  54          HG23      VAL  54  20.165  -9.988  -5.803

  No H/Q in entry =           9
  In of MODEL   54
    1    H    GLN  55           H        GLN  55  16.431  -6.976  -7.642
    2    HA   GLN  55           HA       GLN  55  14.396  -8.637  -8.693
    3    HB2  GLN  55           HB2      GLN  55  13.672  -7.123  -7.044
    4    HB3  GLN  55           HB3      GLN  55  14.449  -5.748  -7.824
    5    HG2  GLN  55           HG2      GLN  55  12.700  -5.418  -9.283
    6    HG3  GLN  55           HG3      GLN  55  12.379  -7.138  -9.459
    7   HE21  GLN  55          HE21      GLN  55  10.386  -7.696  -8.624
    8   HE22  GLN  55          HE22      GLN  55   9.633  -6.952  -7.299

  No H/Q in entry =           8
  In of MODEL   54
    1    H    THR  56           H        THR  56  16.107  -5.825 -10.063
    2    HA   THR  56           HA       THR  56  14.630  -5.451 -12.385
    3    HB   THR  56           HB       THR  56  17.651  -5.356 -12.269
    4    HG1  THR  56           HG1      THR  56  16.397  -4.232 -10.548
    5   HG23  THR  56          HG21      THR  56  16.927  -4.994 -14.491
    6   HG22  THR  56          HG22      THR  56  17.137  -3.373 -13.831
    7   HG21  THR  56          HG23      THR  56  15.520  -4.066 -13.969

  No H/Q in entry =           7
  In of MODEL   54
    1    H    LYS  57           H        LYS  57  17.294  -7.746 -11.832
    2    HA   LYS  57           HA       LYS  57  17.255  -8.924 -14.417
    3    HB2  LYS  57           HB2      LYS  57  19.075  -9.183 -12.703
    4    HB3  LYS  57           HB3      LYS  57  17.988 -10.187 -11.754
    5    HG2  LYS  57           HG2      LYS  57  17.860 -11.822 -13.568
    6    HG3  LYS  57           HG3      LYS  57  18.880 -10.811 -14.585
    7    HD2  LYS  57           HD2      LYS  57  20.730 -11.040 -12.961
    8    HD3  LYS  57           HD3      LYS  57  19.715 -12.068 -11.950
    9    HE2  LYS  57           HE2      LYS  57  20.444 -12.696 -14.831
   10    HE3  LYS  57           HE3      LYS  57  21.265 -13.388 -13.434
   11    HZ1  LYS  57           HZ1      LYS  57  18.510 -13.695 -13.078
   12    HZ3  LYS  57           HZ2      LYS  57  19.687 -14.900 -13.296
   13    HZ2  LYS  57           HZ3      LYS  57  18.892 -14.233 -14.641

  No H/Q in entry =          13
  In of MODEL   54
    1    H    LEU  58           H        LEU  58  15.526  -9.615 -11.417
    2    HA   LEU  58           HA       LEU  58  14.295 -11.986 -12.345
    3    HB2  LEU  58           HB2      LEU  58  13.532 -10.096 -10.125
    4    HB3  LEU  58           HB3      LEU  58  12.724 -11.634 -10.437
    5    HG   LEU  58           HG       LEU  58  15.705 -11.351  -9.931
    6   HD11  LEU  58          HD11      LEU  58  13.365 -11.786  -8.101
    7   HD13  LEU  58          HD12      LEU  58  14.820 -10.820  -7.857
    8   HD12  LEU  58          HD13      LEU  58  14.899 -12.577  -7.734
    9   HD22  LEU  58          HD21      LEU  58  15.576 -13.407 -10.969
   10   HD21  LEU  58          HD22      LEU  58  13.869 -13.623 -10.581
   11   HD23  LEU  58          HD23      LEU  58  15.099 -13.928  -9.354

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  59           H        ILE  59  13.603  -8.646 -12.996
    2    HA   ILE  59           HA       ILE  59  10.874  -9.297 -13.895
    3    HB   ILE  59           HB       ILE  59  11.687  -7.021 -12.688
    4   HG12  ILE  59          HG12      ILE  59   9.753  -6.894 -15.014
    5   HG13  ILE  59          HG13      ILE  59   9.353  -7.660 -13.498
    6   HG21  ILE  59          HG21      ILE  59  13.208  -6.603 -14.756
    7   HG23  ILE  59          HG22      ILE  59  12.230  -5.271 -14.182
    8   HG22  ILE  59          HG23      ILE  59  11.728  -6.199 -15.592
    9   HD12  ILE  59          HD11      ILE  59   8.589  -5.304 -13.564
   10   HD11  ILE  59          HD12      ILE  59  10.264  -4.795 -13.777
   11   HD13  ILE  59          HD13      ILE  59   9.765  -5.581 -12.279

  No H/Q in entry =          11
  In of MODEL   54
    1    H    GLU  60           H        GLU  60  14.054  -8.428 -15.201
    2    HA   GLU  60           HA       GLU  60  13.228  -8.014 -17.894
    3    HB2  GLU  60           HB2      GLU  60  15.484  -7.870 -18.386
    4    HB3  GLU  60           HB3      GLU  60  15.528  -7.568 -16.651
    5    HG2  GLU  60           HG2      GLU  60  17.189  -9.211 -16.940
    6    HG3  GLU  60           HG3      GLU  60  15.785 -10.152 -16.437

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLY  61           H        GLY  61  14.244 -10.903 -16.113
    2    HA3  GLY  61           HA2      GLY  61  13.667 -12.538 -18.515
    3    HA2  GLY  61           HA3      GLY  61  14.723 -13.025 -17.193

  No H/Q in entry =           3
  In of MODEL   54
    1    H    ASP  62           H        ASP  62  11.605 -11.490 -16.760
    2    HA   ASP  62           HA       ASP  62  10.716 -13.544 -14.991
    3    HB2  ASP  62           HB2      ASP  62   8.655 -12.208 -14.876
    4    HB3  ASP  62           HB3      ASP  62  10.089 -11.209 -14.663

  No H/Q in entry =           4
  In of MODEL   54
    1    H    ALA  63           H        ALA  63  11.077 -15.244 -16.875
    2    HA   ALA  63           HA       ALA  63   9.116 -15.479 -18.935
    3    HB1  ALA  63           HB1      ALA  63  11.303 -16.698 -18.881
    4    HB3  ALA  63           HB2      ALA  63   9.924 -17.752 -19.183
    5    HB2  ALA  63           HB3      ALA  63  10.665 -17.707 -17.583

  No H/Q in entry =           5
  In of MODEL   54
    1    H    GLY  64           H        GLY  64   9.320 -16.657 -15.622
    2    HA3  GLY  64           HA2      GLY  64   7.692 -17.371 -14.162
    3    HA2  GLY  64           HA3      GLY  64   6.486 -16.860 -15.335

  No H/Q in entry =           3
  In of MODEL   54
    1    H    GLU  65           H        GLU  65   5.540 -18.953 -14.333
    2    HA   GLU  65           HA       GLU  65   6.643 -21.453 -15.039
    3    HB2  GLU  65           HB2      GLU  65   3.821 -20.651 -14.346
    4    HB3  GLU  65           HB3      GLU  65   4.329 -22.322 -14.588
    5    HG2  GLU  65           HG2      GLU  65   5.982 -22.115 -12.801
    6    HG3  GLU  65           HG3      GLU  65   5.577 -20.412 -12.590

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLY  66           H        GLY  66   4.310 -19.406 -16.626
    2    HA3  GLY  66           HA2      GLY  66   4.214 -21.186 -18.966
    3    HA2  GLY  66           HA3      GLY  66   2.989 -20.005 -18.546

  No H/Q in entry =           3
  In of MODEL   54
    1    H    LYS  67           H        LYS  67   3.594 -19.847 -21.011
    2    HA   LYS  67           HA       LYS  67   5.902 -18.536 -21.853
    3    HB2  LYS  67           HB2      LYS  67   3.136 -18.654 -23.047
    4    HB3  LYS  67           HB3      LYS  67   4.538 -17.974 -23.884
    5    HG2  LYS  67           HG2      LYS  67   5.752 -20.104 -23.585
    6    HG3  LYS  67           HG3      LYS  67   4.356 -20.786 -22.756
    7    HD2  LYS  67           HD2      LYS  67   2.998 -20.529 -24.782
    8    HD3  LYS  67           HD3      LYS  67   4.366 -19.790 -25.619
    9    HE2  LYS  67           HE2      LYS  67   4.216 -22.168 -26.205
   10    HE3  LYS  67           HE3      LYS  67   5.680 -21.866 -25.272
   11    HZ1  LYS  67           HZ1      LYS  67   3.122 -22.886 -24.162
   12    HZ3  LYS  67           HZ2      LYS  67   4.559 -22.633 -23.293
   13    HZ2  LYS  67           HZ3      LYS  67   4.490 -23.831 -24.497

  No H/Q in entry =          13
  In of MODEL   54
    1    H    MET  68           H        MET  68   2.783 -16.962 -22.072
    2    HA   MET  68           HA       MET  68   3.777 -14.329 -22.083
    3    HB2  MET  68           HB2      MET  68   0.997 -15.381 -21.549
    4    HB3  MET  68           HB3      MET  68   1.394 -13.691 -21.866
    5    HG2  MET  68           HG2      MET  68   1.997 -15.990 -23.747
    6    HG3  MET  68           HG3      MET  68   0.643 -14.873 -23.920
    7    HE2  MET  68           HE1      MET  68   2.103 -11.845 -23.171
    8    HE1  MET  68           HE2      MET  68   0.712 -12.597 -23.947
    9    HE3  MET  68           HE3      MET  68   1.836 -11.640 -24.908

  No H/Q in entry =           9
  In of MODEL   54
    1    H    LYS  69           H        LYS  69   2.396 -16.244 -19.400
    2    HA   LYS  69           HA       LYS  69   2.184 -14.082 -17.591
    3    HB2  LYS  69           HB2      LYS  69   2.276 -17.066 -17.162
    4    HB3  LYS  69           HB3      LYS  69   1.996 -15.909 -15.858
    5    HG2  LYS  69           HG2      LYS  69   0.073 -14.975 -17.100
    6    HG3  LYS  69           HG3      LYS  69   0.345 -16.146 -18.390
    7    HD2  LYS  69           HD2      LYS  69  -0.050 -17.992 -16.808
    8    HD3  LYS  69           HD3      LYS  69  -0.310 -16.828 -15.508
    9    HE2  LYS  69           HE2      LYS  69  -2.221 -15.872 -16.726
   10    HE3  LYS  69           HE3      LYS  69  -1.955 -17.005 -18.050
   11    HZ2  LYS  69           HZ1      LYS  69  -3.637 -17.505 -16.099
   12    HZ1  LYS  69           HZ2      LYS  69  -2.233 -18.119 -15.368
   13    HZ3  LYS  69           HZ3      LYS  69  -2.759 -18.738 -16.860

  No H/Q in entry =          13
  In of MODEL   54
    1    H    VAL  70           H        VAL  70   3.259 -14.097 -15.349
    2    HA   VAL  70           HA       VAL  70   6.185 -14.514 -15.604
    3    HB   VAL  70           HB       VAL  70   6.460 -12.443 -14.249
    4   HG13  VAL  70          HG11      VAL  70   6.790 -12.025 -16.524
    5   HG12  VAL  70          HG12      VAL  70   5.495 -10.890 -16.143
    6   HG11  VAL  70          HG13      VAL  70   5.122 -12.418 -16.939
    7   HG22  VAL  70          HG21      VAL  70   4.316 -12.353 -13.104
    8   HG21  VAL  70          HG22      VAL  70   3.455 -12.278 -14.640
    9   HG23  VAL  70          HG23      VAL  70   4.436 -10.911 -14.113

  No H/Q in entry =           9
  In of MODEL   54
    1    H    SER  71           H        SER  71   7.263 -14.548 -13.434
    2    HA   SER  71           HA       SER  71   6.180 -16.538 -11.746
    3    HB2  SER  71           HB2      SER  71   8.607 -16.032 -11.927
    4    HB3  SER  71           HB3      SER  71   8.329 -14.502 -11.099
    5    HG   SER  71           HG       SER  71   8.967 -16.193  -9.673

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LEU  72           H        LEU  72   4.846 -16.425 -10.056
    2    HA   LEU  72           HA       LEU  72   3.297 -14.118  -9.571
    3    HB2  LEU  72           HB2      LEU  72   3.617 -16.687  -8.027
    4    HB3  LEU  72           HB3      LEU  72   2.455 -15.435  -7.593
    5    HG   LEU  72           HG       LEU  72   2.560 -16.699 -10.351
    6   HD13  LEU  72          HD11      LEU  72   0.791 -18.173  -9.671
    7   HD12  LEU  72          HD12      LEU  72   0.638 -17.370  -8.109
    8   HD11  LEU  72          HD13      LEU  72   2.071 -18.333  -8.468
    9   HD22  LEU  72          HD21      LEU  72   1.314 -14.727 -10.562
   10   HD21  LEU  72          HD22      LEU  72   0.697 -14.806  -8.919
   11   HD23  LEU  72          HD23      LEU  72   0.056 -15.889 -10.152

  No H/Q in entry =          11
  In of MODEL   54
    1    H    VAL  73           H        VAL  73   5.985 -15.560  -7.850
    2    HA   VAL  73           HA       VAL  73   5.958 -14.042  -5.507
    3    HB   VAL  73           HB       VAL  73   8.143 -14.855  -5.115
    4   HG12  VAL  73          HG11      VAL  73   6.823 -16.873  -6.950
    5   HG11  VAL  73          HG12      VAL  73   6.310 -16.566  -5.291
    6   HG13  VAL  73          HG13      VAL  73   7.920 -17.212  -5.613
    7   HG23  VAL  73          HG21      VAL  73   9.295 -15.999  -7.205
    8   HG22  VAL  73          HG22      VAL  73   9.466 -14.266  -6.934
    9   HG21  VAL  73          HG23      VAL  73   8.295 -14.863  -8.111

  No H/Q in entry =           9
  In of MODEL   54
    1    H    LEU  74           H        LEU  74   6.895 -13.125  -8.692
    2    HA   LEU  74           HA       LEU  74   8.843 -11.174  -8.217
    3    HB2  LEU  74           HB2      LEU  74   8.359 -11.905 -10.453
    4    HB3  LEU  74           HB3      LEU  74   6.690 -11.354 -10.323
    5    HG   LEU  74           HG       LEU  74   7.477  -9.020 -10.101
    6   HD13  LEU  74          HD11      LEU  74   9.615  -9.204  -9.087
    7   HD12  LEU  74          HD12      LEU  74   9.963  -8.697 -10.738
    8   HD11  LEU  74          HD13      LEU  74  10.168 -10.385 -10.273
    9   HD21  LEU  74          HD21      LEU  74   7.199 -10.433 -12.328
   10   HD23  LEU  74          HD22      LEU  74   8.909 -10.088 -12.452
   11   HD22  LEU  74          HD23      LEU  74   7.769  -8.765 -12.364

  No H/Q in entry =          11
  In of MODEL   54
    1    H    VAL  75           H        VAL  75   5.341 -10.796  -8.514
    2    HA   VAL  75           HA       VAL  75   5.247  -8.044  -7.907
    3    HB   VAL  75           HB       VAL  75   3.166 -10.192  -7.492
    4   HG12  VAL  75          HG11      VAL  75   1.582  -8.246  -7.364
    5   HG11  VAL  75          HG12      VAL  75   2.965  -7.161  -7.368
    6   HG13  VAL  75          HG13      VAL  75   2.722  -8.264  -6.021
    7   HG22  VAL  75          HG21      VAL  75   2.345  -9.526  -9.612
    8   HG21  VAL  75          HG22      VAL  75   4.092  -9.563  -9.835
    9   HG23  VAL  75          HG23      VAL  75   3.266  -8.023  -9.595

  No H/Q in entry =           9
  In of MODEL   54
    1    H    GLU  76           H        GLU  76   5.033 -10.936  -5.813
    2    HA   GLU  76           HA       GLU  76   4.596  -9.592  -3.376
    3    HB2  GLU  76           HB2      GLU  76   4.422 -12.056  -3.618
    4    HB3  GLU  76           HB3      GLU  76   6.152 -12.152  -3.894
    5    HG2  GLU  76           HG2      GLU  76   5.760 -12.748  -1.592
    6    HG3  GLU  76           HG3      GLU  76   6.502 -11.160  -1.585

  No H/Q in entry =           6
  In of MODEL   54
    1    H    ALA  77           H        ALA  77   7.634 -10.481  -4.991
    2    HA   ALA  77           HA       ALA  77   9.351  -9.447  -2.993
    3    HB3  ALA  77           HB1      ALA  77   9.750  -9.896  -5.955
    4    HB1  ALA  77           HB2      ALA  77  10.267 -10.935  -4.628
    5    HB2  ALA  77           HB3      ALA  77  11.042  -9.369  -4.876

  No H/Q in entry =           5
  In of MODEL   54
    1    H    GLN  78           H        GLN  78   7.912  -8.014  -5.877
    2    HA   GLN  78           HA       GLN  78   9.261  -5.532  -5.776
    3    HB2  GLN  78           HB2      GLN  78   7.936  -6.438  -7.720
    4    HB3  GLN  78           HB3      GLN  78   6.467  -6.066  -6.820
    5    HG2  GLN  78           HG2      GLN  78   7.120  -3.696  -6.722
    6    HG3  GLN  78           HG3      GLN  78   8.594  -4.060  -7.619
    7   HE21  GLN  78          HE21      GLN  78   6.633  -2.234  -8.658
    8   HE22  GLN  78          HE22      GLN  78   5.931  -2.939 -10.033

  No H/Q in entry =           8
  In of MODEL   54
    1    H    LEU  79           H        LEU  79   6.265  -6.686  -4.309
    2    HA   LEU  79           HA       LEU  79   5.281  -4.287  -3.269
    3    HB2  LEU  79           HB2      LEU  79   3.972  -6.342  -3.208
    4    HB3  LEU  79           HB3      LEU  79   5.134  -7.086  -2.115
    5    HG   LEU  79           HG       LEU  79   4.604  -5.457  -0.369
    6   HD13  LEU  79          HD11      LEU  79   4.119  -3.436  -1.399
    7   HD12  LEU  79          HD12      LEU  79   2.501  -3.968  -0.940
    8   HD11  LEU  79          HD13      LEU  79   3.058  -4.178  -2.598
    9   HD23  LEU  79          HD21      LEU  79   2.020  -5.955  -0.245
   10   HD22  LEU  79          HD22      LEU  79   3.163  -7.293  -0.162
   11   HD21  LEU  79          HD23      LEU  79   2.327  -6.947  -1.673

  No H/Q in entry =          11
  In of MODEL   54
    1    H    HIS  80           H        HIS  80   7.491  -6.629  -1.734
    2    HA   HIS  80           HA       HIS  80   7.810  -5.102   0.641
    3    HB2  HIS  80           HB2      HIS  80   9.135  -7.456  -0.592
    4    HB3  HIS  80           HB3      HIS  80  10.061  -6.566   0.617
    5    HD1  HIS  80           HD1      HIS  80   9.605  -7.218   2.963
    6    HD2  HIS  80           HD2      HIS  80   6.354  -8.057   0.491
    7    HE1  HIS  80           HE1      HIS  80   7.855  -8.334   4.429
    8    HE2  HIS  80           HE2      HIS  80   5.868  -8.850   2.930

  No H/Q in entry =           8
  In of MODEL   54
    1    H    LEU  81           H        LEU  81   9.774  -5.356  -2.301
    2    HA   LEU  81           HA       LEU  81  11.828  -3.617  -1.440
    3    HB2  LEU  81           HB2      LEU  81  10.869  -4.393  -4.195
    4    HB3  LEU  81           HB3      LEU  81  12.292  -3.386  -3.918
    5    HG   LEU  81           HG       LEU  81  11.921  -6.117  -2.657
    6   HD12  LEU  81          HD11      LEU  81  13.713  -6.729  -4.436
    7   HD11  LEU  81          HD12      LEU  81  13.133  -5.300  -5.290
    8   HD13  LEU  81          HD13      LEU  81  12.028  -6.628  -4.945
    9   HD23  LEU  81          HD21      LEU  81  14.549  -5.798  -2.678
   10   HD22  LEU  81          HD22      LEU  81  13.583  -5.047  -1.409
   11   HD21  LEU  81          HD23      LEU  81  14.141  -4.086  -2.777

  No H/Q in entry =          11
  In of MODEL   54
    1    H    MET  82           H        MET  82   8.878  -2.971  -3.331
    2    HA   MET  82           HA       MET  82   9.408  -0.242  -3.821
    3    HB2  MET  82           HB2      MET  82   6.852  -1.839  -3.671
    4    HB3  MET  82           HB3      MET  82   6.845  -0.112  -4.024
    5    HG2  MET  82           HG2      MET  82   8.426  -2.174  -5.595
    6    HG3  MET  82           HG3      MET  82   6.851  -1.549  -6.081
    7    HE3  MET  82           HE1      MET  82   7.280   1.914  -7.236
    8    HE2  MET  82           HE2      MET  82   6.929   1.676  -5.526
    9    HE1  MET  82           HE3      MET  82   6.249   0.573  -6.719

  No H/Q in entry =           9
  In of MODEL   54
    1    H    THR  83           H        THR  83   7.654  -1.859  -1.202
    2    HA   THR  83           HA       THR  83   6.819   0.479   0.152
    3    HB   THR  83           HB       THR  83   6.714  -1.109   2.161
    4    HG1  THR  83           HG1      THR  83   7.469  -3.057   1.907
    5   HG22  THR  83          HG21      THR  83   5.042  -2.666   0.705
    6   HG21  THR  83          HG22      THR  83   5.252  -1.329  -0.421
    7   HG23  THR  83          HG23      THR  83   4.633  -1.026   1.203

  No H/Q in entry =           7
  In of MODEL   54
    1    H    SER  84           H        SER  84   9.651  -1.620   0.619
    2    HA   SER  84           HA       SER  84  10.740  -0.204   2.802
    3    HB2  SER  84           HB2      SER  84  11.966  -2.032   0.748
    4    HB3  SER  84           HB3      SER  84  12.930  -1.287   2.021
    5    HG   SER  84           HG       SER  84  10.660  -2.979   2.301

  No H/Q in entry =           5
  In of MODEL   54
    1    H    MET  85           H        MET  85  11.445   0.081  -0.694
    2    HA   MET  85           HA       MET  85  13.446   2.045  -0.457
    3    HB2  MET  85           HB2      MET  85  13.018   0.776  -2.526
    4    HB3  MET  85           HB3      MET  85  11.492   1.635  -2.728
    5    HG2  MET  85           HG2      MET  85  12.690   3.777  -2.863
    6    HG3  MET  85           HG3      MET  85  14.222   2.946  -2.608
    7    HE2  MET  85           HE1      MET  85  11.480   3.177  -6.148
    8    HE1  MET  85           HE2      MET  85  11.081   3.202  -4.433
    9    HE3  MET  85           HE3      MET  85  11.169   1.665  -5.282

  No H/Q in entry =           9
  In of MODEL   54
    1    H    LEU  86           H        LEU  86   9.949   2.383  -0.916
    2    HA   LEU  86           HA       LEU  86   9.883   5.197  -1.078
    3    HB2  LEU  86           HB2      LEU  86   8.031   3.541  -1.639
    4    HB3  LEU  86           HB3      LEU  86   7.725   3.439   0.095
    5    HG   LEU  86           HG       LEU  86   7.563   6.000   0.061
    6   HD11  LEU  86          HD11      LEU  86   8.302   5.583  -2.654
    7   HD13  LEU  86          HD12      LEU  86   7.876   7.105  -1.877
    8   HD12  LEU  86          HD13      LEU  86   6.629   6.147  -2.671
    9   HD23  LEU  86          HD21      LEU  86   5.407   4.659  -1.580
   10   HD22  LEU  86          HD22      LEU  86   5.233   5.910  -0.353
   11   HD21  LEU  86          HD23      LEU  86   5.640   4.263   0.123

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ALA  87           H        ALA  87   9.455   3.000   1.660
    2    HA   ALA  87           HA       ALA  87   8.934   4.901   3.649
    3    HB1  ALA  87           HB1      ALA  87   9.739   2.081   3.533
    4    HB3  ALA  87           HB2      ALA  87   8.630   2.886   4.640
    5    HB2  ALA  87           HB3      ALA  87  10.363   2.915   4.960

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ARG  88           H        ARG  88  12.003   3.482   2.616
    2    HA   ARG  88           HA       ARG  88  13.638   4.848   4.435
    3    HB2  ARG  88           HB2      ARG  88  14.286   2.884   3.009
    4    HB3  ARG  88           HB3      ARG  88  14.420   3.986   1.642
    5    HG2  ARG  88           HG2      ARG  88  15.921   5.287   3.576
    6    HG3  ARG  88           HG3      ARG  88  16.246   3.594   3.939
    7    HD2  ARG  88           HD2      ARG  88  17.487   3.310   2.073
    8    HD3  ARG  88           HD3      ARG  88  16.336   4.189   1.062
    9    HE   ARG  88           HE       ARG  88  18.745   5.245   2.083
   10   HH21  ARG  88          HH11      ARG  88  19.088   7.465   1.898
   11   HH22  ARG  88          HH12      ARG  88  17.736   8.538   1.781
   12   HH11  ARG  88          HH21      ARG  88  15.403   6.001   1.856
   13   HH12  ARG  88          HH22      ARG  88  15.647   7.706   1.733

  No H/Q in entry =          13
  In of MODEL   54
    1    H    GLU  89           H        GLU  89  12.618   5.768   1.132
    2    HA   GLU  89           HA       GLU  89  14.163   8.129   0.970
    3    HB2  GLU  89           HB2      GLU  89  12.992   7.102  -0.969
    4    HB3  GLU  89           HB3      GLU  89  11.456   7.638  -0.285
    5    HG2  GLU  89           HG2      GLU  89  12.156   9.977  -0.442
    6    HG3  GLU  89           HG3      GLU  89  13.753   9.490  -1.005

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LEU  90           H        LEU  90  10.850   7.612   2.143
    2    HA   LEU  90           HA       LEU  90  10.344  10.342   2.744
    3    HB2  LEU  90           HB2      LEU  90   9.163   7.762   3.771
    4    HB3  LEU  90           HB3      LEU  90   8.539   9.354   4.213
    5    HG   LEU  90           HG       LEU  90   8.917   8.493   1.333
    6   HD12  LEU  90          HD11      LEU  90   6.384   8.165   1.429
    7   HD11  LEU  90          HD12      LEU  90   6.563   8.142   3.183
    8   HD13  LEU  90          HD13      LEU  90   7.368   6.919   2.199
    9   HD22  LEU  90          HD21      LEU  90   8.622  10.802   1.279
   10   HD21  LEU  90          HD22      LEU  90   7.656  10.825   2.753
   11   HD23  LEU  90          HD23      LEU  90   6.937  10.280   1.238

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  91           H        ILE  91  11.634   7.647   4.630
    2    HA   ILE  91           HA       ILE  91  11.810   8.996   7.105
    3    HB   ILE  91           HB       ILE  91  13.347   6.665   5.944
    4   HG12  ILE  91          HG12      ILE  91  11.363   6.817   8.233
    5   HG13  ILE  91          HG13      ILE  91  10.869   6.547   6.562
    6   HG22  ILE  91          HG21      ILE  91  13.854   6.433   8.576
    7   HG21  ILE  91          HG22      ILE  91  13.777   8.192   8.488
    8   HG23  ILE  91          HG23      ILE  91  14.942   7.311   7.500
    9   HD13  ILE  91          HD11      ILE  91  11.870   4.446   6.463
   10   HD12  ILE  91          HD12      ILE  91  11.300   4.493   8.132
   11   HD11  ILE  91          HD13      ILE  91  12.997   4.808   7.771

  No H/Q in entry =          11
  In of MODEL   54
    1    H    THR  92           H        THR  92  13.987   8.845   4.321
    2    HA   THR  92           HA       THR  92  16.169  10.230   5.459
    3    HB   THR  92           HB       THR  92  15.142  10.125   2.612
    4    HG1  THR  92           HG1      THR  92  15.979   8.225   2.992
    5   HG22  THR  92          HG21      THR  92  17.707  10.817   2.286
    6   HG21  THR  92          HG22      THR  92  17.421  11.627   3.825
    7   HG23  THR  92          HG23      THR  92  16.431  12.025   2.421

  No H/Q in entry =           7
  In of MODEL   54
    1    H    GLU  93           H        GLU  93  13.257  11.395   3.779
    2    HA   GLU  93           HA       GLU  93  13.854  14.155   3.904
    3    HB2  GLU  93           HB2      GLU  93  11.150  12.783   3.947
    4    HB3  GLU  93           HB3      GLU  93  11.433  14.485   3.583
    5    HG2  GLU  93           HG2      GLU  93  12.748  12.253   2.021
    6    HG3  GLU  93           HG3      GLU  93  11.195  12.939   1.561

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LEU  94           H        LEU  94  12.143  11.984   6.125
    2    HA   LEU  94           HA       LEU  94  11.361  13.918   8.026
    3    HB2  LEU  94           HB2      LEU  94  11.940  10.961   8.271
    4    HB3  LEU  94           HB3      LEU  94  11.388  11.927   9.636
    5    HG   LEU  94           HG       LEU  94   9.866  11.997   7.030
    6   HD11  LEU  94          HD11      LEU  94   9.978   9.762   9.018
    7   HD13  LEU  94          HD12      LEU  94   9.651   9.713   7.287
    8   HD12  LEU  94          HD13      LEU  94   8.389  10.222   8.407
    9   HD23  LEU  94          HD21      LEU  94   7.970  12.386   8.660
   10   HD22  LEU  94          HD22      LEU  94   9.210  13.640   8.688
   11   HD21  LEU  94          HD23      LEU  94   9.165  12.414   9.954

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  95           H        ILE  95  14.331  11.990   7.733
    2    HA   ILE  95           HA       ILE  95  15.533  12.895  10.136
    3    HB   ILE  95           HB       ILE  95  16.735  11.844   7.563
    4   HG12  ILE  95          HG12      ILE  95  16.479  10.624  10.326
    5   HG13  ILE  95          HG13      ILE  95  15.294  10.375   9.046
    6   HG21  ILE  95          HG21      ILE  95  18.029  12.633  10.192
    7   HG23  ILE  95          HG22      ILE  95  18.468  13.172   8.570
    8   HG22  ILE  95          HG23      ILE  95  18.781  11.508   9.062
    9   HD13  ILE  95          HD11      ILE  95  16.755   9.105   7.753
   10   HD12  ILE  95          HD12      ILE  95  17.252   8.645   9.379
   11   HD11  ILE  95          HD13      ILE  95  18.192   9.830   8.474

  No H/Q in entry =          11
  In of MODEL   54
    1    H    GLU  96           H        GLU  96  15.639  14.152   6.808
    2    HA   GLU  96           HA       GLU  96  17.493  16.227   7.272
    3    HB2  GLU  96           HB2      GLU  96  16.796  15.580   5.018
    4    HB3  GLU  96           HB3      GLU  96  15.157  16.135   5.346
    5    HG2  GLU  96           HG2      GLU  96  15.716  18.268   4.810
    6    HG3  GLU  96           HG3      GLU  96  17.032  18.260   5.973

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LEU  97           H        LEU  97  13.989  16.037   7.751
    2    HA   LEU  97           HA       LEU  97  13.582  18.766   8.418
    3    HB2  LEU  97           HB2      LEU  97  12.073  16.237   9.037
    4    HB3  LEU  97           HB3      LEU  97  11.570  17.779   9.726
    5    HG   LEU  97           HG       LEU  97  12.009  17.383   6.752
    6   HD12  LEU  97          HD11      LEU  97   9.484  17.256   6.670
    7   HD11  LEU  97          HD12      LEU  97   9.503  17.045   8.419
    8   HD13  LEU  97          HD13      LEU  97  10.269  15.844   7.377
    9   HD23  LEU  97          HD21      LEU  97  10.272  19.347   6.823
   10   HD22  LEU  97          HD22      LEU  97  11.959  19.704   7.193
   11   HD21  LEU  97          HD23      LEU  97  10.789  19.525   8.499

  No H/Q in entry =          11
  In of MODEL   54
    1    H    HIS  98           H        HIS  98  14.432  15.927  10.382
    2    HA   HIS  98           HA       HIS  98  14.312  17.170  12.908
    3    HB2  HIS  98           HB2      HIS  98  16.046  14.919  11.866
    4    HB3  HIS  98           HB3      HIS  98  16.069  15.446  13.550
    5    HD1  HIS  98           HD1      HIS  98  13.832  13.835  10.980
    6    HD2  HIS  98           HD2      HIS  98  13.785  14.727  15.052
    7    HE1  HIS  98           HE1      HIS  98  11.821  12.634  11.954
    8    HE2  HIS  98           HE2      HIS  98  11.772  13.169  14.430

  No H/Q in entry =           8
  In of MODEL   54
    1    H    GLU  99           H        GLU  99  16.829  17.071  10.436
    2    HA   GLU  99           HA       GLU  99  18.837  18.392  11.944
    3    HB2  GLU  99           HB2      GLU  99  19.286  17.118   9.860
    4    HB3  GLU  99           HB3      GLU  99  18.462  18.380   8.939
    5    HG2  GLU  99           HG2      GLU  99  20.083  20.044   9.718
    6    HG3  GLU  99           HG3      GLU  99  20.876  18.835  10.721

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LYS 100           H        LYS 100  16.282  19.570   9.774
    2    HA   LYS 100           HA       LYS 100  17.083  22.306   9.925
    3    HB2  LYS 100           HB2      LYS 100  14.438  21.023   9.200
    4    HB3  LYS 100           HB3      LYS 100  14.737  22.762   9.117
    5    HG2  LYS 100           HG2      LYS 100  16.687  22.323   7.618
    6    HG3  LYS 100           HG3      LYS 100  16.273  20.606   7.630
    7    HD2  LYS 100           HD2      LYS 100  14.064  21.124   6.666
    8    HD3  LYS 100           HD3      LYS 100  14.461  22.843   6.662
    9    HE2  LYS 100           HE2      LYS 100  16.398  22.371   5.170
   10    HE3  LYS 100           HE3      LYS 100  15.931  20.667   5.132
   11    HZ1  LYS 100           HZ1      LYS 100  14.096  22.866   4.339
   12    HZ3  LYS 100           HZ2      LYS 100  13.906  21.199   4.068
   13    HZ2  LYS 100           HZ3      LYS 100  15.105  22.066   3.235

  No H/Q in entry =          13
  In of MODEL   54
    1    H    LEU 101           H        LEU 101  15.013  20.248  11.906
    2    HA   LEU 101           HA       LEU 101  13.872  22.305  13.516
    3    HB2  LEU 101           HB2      LEU 101  14.317  19.353  13.873
    4    HB3  LEU 101           HB3      LEU 101  13.802  20.324  15.248
    5    HG   LEU 101           HG       LEU 101  12.345  20.432  12.601
    6   HD12  LEU 101          HD11      LEU 101  10.703  18.861  13.884
    7   HD11  LEU 101          HD12      LEU 101  12.112  18.440  14.855
    8   HD13  LEU 101          HD13      LEU 101  12.120  18.145  13.115
    9   HD21  LEU 101          HD21      LEU 101  11.731  21.206  15.468
   10   HD23  LEU 101          HD22      LEU 101  10.452  20.989  14.275
   11   HD22  LEU 101          HD23      LEU 101  11.684  22.225  14.028

  No H/Q in entry =          11
  In of MODEL   54
    1    H    LYS 102           H        LYS 102  17.012  21.698  13.029
    2    HA   LYS 102           HA       LYS 102  18.875  22.560  14.080
    3    HB2  LYS 102           HB2      LYS 102  17.079  24.069  15.250
    4    HB3  LYS 102           HB3      LYS 102  17.306  22.996  16.617
    5    HG2  LYS 102           HG2      LYS 102  19.183  25.014  15.434
    6    HG3  LYS 102           HG3      LYS 102  18.826  24.688  17.116
    7    HD2  LYS 102           HD2      LYS 102  20.466  22.786  15.392
    8    HD3  LYS 102           HD3      LYS 102  21.170  24.101  16.324
    9    HE2  LYS 102           HE2      LYS 102  20.784  21.546  17.280
   10    HE3  LYS 102           HE3      LYS 102  21.019  22.980  18.278
   11    HZ2  LYS 102           HZ1      LYS 102  19.058  21.694  18.917
   12    HZ1  LYS 102           HZ2      LYS 102  18.391  21.936  17.379
   13    HZ3  LYS 102           HZ3      LYS 102  18.638  23.258  18.411

  No H/Q in entry =          13
  In of MODEL   54
    1    H    ALA 103           H        ALA 103  16.838  20.940  16.521
    2    HA   ALA 103           HA       ALA 103  18.588  19.716  18.141
    3    HB2  ALA 103           HB1      ALA 103  17.002  17.710  18.145
    4    HB1  ALA 103           HB2      ALA 103  16.088  18.573  16.907
    5    HB3  ALA 103           HB3      ALA 103  16.291  19.282  18.508

  No H/Q in entry =           5
  In of MODEL   54
    1    H1   ALA   1           H3       ALA   1  -1.957  -6.838 -21.367
    2    H2   ALA   1           H2       ALA   1  -2.746  -8.276 -20.912
    3    H3   ALA   1           H1       ALA   1  -1.147  -8.324 -21.491
    4    HA   ALA   1           HA       ALA   1  -2.011  -8.778 -23.478
    5    HB1  ALA   1           HB1      ALA   1  -4.142  -9.496 -22.978
    6    HB2  ALA   1           HB2      ALA   1  -4.590  -7.979 -23.758
    7    HB3  ALA   1           HB3      ALA   1  -4.504  -8.072 -22.001

  No H/Q in entry =           7
  In of MODEL   54
    1    H    GLU   2           H        GLU   2  -2.868  -7.572 -25.446
    2    HA   GLU   2           HA       GLU   2  -1.479  -5.554 -26.330
    3    HB2  GLU   2           HB2      GLU   2  -4.491  -5.614 -26.604
    4    HB3  GLU   2           HB3      GLU   2  -3.385  -4.745 -27.664
    5    HG2  GLU   2           HG2      GLU   2  -2.901  -6.628 -28.839
    6    HG3  GLU   2           HG3      GLU   2  -2.584  -7.544 -27.373

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLU   3           H        GLU   3  -4.624  -4.299 -25.374
    2    HA   GLU   3           HA       GLU   3  -3.565  -1.749 -24.743
    3    HB2  GLU   3           HB2      GLU   3  -6.250  -3.062 -24.381
    4    HB3  GLU   3           HB3      GLU   3  -5.940  -1.452 -23.728
    5    HG2  GLU   3           HG2      GLU   3  -5.613  -0.510 -25.852
    6    HG3  GLU   3           HG3      GLU   3  -5.231  -2.061 -26.594

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LEU   4           H        LEU   4  -5.127  -4.121 -22.557
    2    HA   LEU   4           HA       LEU   4  -4.726  -2.911 -20.163
    3    HB2  LEU   4           HB2      LEU   4  -4.194  -5.849 -20.662
    4    HB3  LEU   4           HB3      LEU   4  -4.576  -5.114 -19.107
    5    HG   LEU   4           HG       LEU   4  -6.385  -5.167 -21.545
    6   HD13  LEU   4          HD11      LEU   4  -7.566  -6.890 -20.543
    7   HD12  LEU   4          HD12      LEU   4  -7.057  -6.443 -18.915
    8   HD11  LEU   4          HD13      LEU   4  -5.938  -7.280 -19.989
    9   HD23  LEU   4          HD21      LEU   4  -8.041  -4.367 -19.647
   10   HD22  LEU   4          HD22      LEU   4  -7.012  -3.191 -20.464
   11   HD21  LEU   4          HD23      LEU   4  -6.564  -3.794 -18.869

  No H/Q in entry =          11
  In of MODEL   54
    1    H    GLU   5           H        GLU   5  -2.256  -4.745 -21.944
    2    HA   GLU   5           HA       GLU   5  -0.242  -4.479 -19.934
    3    HB2  GLU   5           HB2      GLU   5  -0.210  -6.235 -21.703
    4    HB3  GLU   5           HB3      GLU   5   0.097  -4.982 -22.905
    5    HG2  GLU   5           HG2      GLU   5   2.176  -4.362 -21.762
    6    HG3  GLU   5           HG3      GLU   5   1.871  -5.571 -20.516

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLU   6           H        GLU   6  -0.919  -2.743 -22.957
    2    HA   GLU   6           HA       GLU   6   1.258  -0.916 -22.707
    3    HB2  GLU   6           HB2      GLU   6   0.104  -1.377 -24.856
    4    HB3  GLU   6           HB3      GLU   6  -1.344  -0.593 -24.225
    5    HG2  GLU   6           HG2      GLU   6  -0.099   1.505 -23.932
    6    HG3  GLU   6           HG3      GLU   6   1.366   0.730 -24.529

  No H/Q in entry =           6
  In of MODEL   54
    1    H    VAL   7           H        VAL   7  -2.065  -0.990 -21.614
    2    HA   VAL   7           HA       VAL   7  -2.270   1.717 -20.755
    3    HB   VAL   7           HB       VAL   7  -3.724  -0.805 -19.916
    4   HG11  VAL   7          HG11      VAL   7  -4.082   2.079 -19.075
    5   HG13  VAL   7          HG12      VAL   7  -3.970   0.646 -18.052
    6   HG12  VAL   7          HG13      VAL   7  -5.416   0.926 -19.021
    7   HG21  VAL   7          HG21      VAL   7  -3.914   0.289 -22.294
    8   HG23  VAL   7          HG22      VAL   7  -4.846   1.534 -21.459
    9   HG22  VAL   7          HG23      VAL   7  -5.393  -0.143 -21.437

  No H/Q in entry =           9
  In of MODEL   54
    1    H    VAL   8           H        VAL   8  -1.264  -1.282 -19.148
    2    HA   VAL   8           HA       VAL   8  -0.906  -0.222 -16.550
    3    HB   VAL   8           HB       VAL   8   0.467  -2.532 -17.947
    4   HG12  VAL   8          HG11      VAL   8   0.829  -3.169 -15.420
    5   HG11  VAL   8          HG12      VAL   8   0.673  -1.433 -15.156
    6   HG13  VAL   8          HG13      VAL   8   1.947  -2.055 -16.203
    7   HG23  VAL   8          HG21      VAL   8  -1.447  -2.991 -15.715
    8   HG22  VAL   8          HG22      VAL   8  -1.299  -3.827 -17.258
    9   HG21  VAL   8          HG23      VAL   8  -2.175  -2.303 -17.167

  No H/Q in entry =           9
  In of MODEL   54
    1    H    MET   9           H        MET   9   1.302  -0.506 -19.332
    2    HA   MET   9           HA       MET   9   3.609   0.523 -18.097
    3    HB2  MET   9           HB2      MET   9   2.612   0.517 -20.937
    4    HB3  MET   9           HB3      MET   9   4.099   1.362 -20.509
    5    HG2  MET   9           HG2      MET   9   4.807  -0.833 -19.360
    6    HG3  MET   9           HG3      MET   9   3.485  -1.583 -20.256
    7    HE1  MET   9           HE1      MET   9   3.250  -1.952 -22.482
    8    HE3  MET   9           HE2      MET   9   4.358  -1.627 -23.811
    9    HE2  MET   9           HE3      MET   9   3.379  -0.321 -23.149

  No H/Q in entry =           9
  In of MODEL   54
    1    H    GLY  10           H        GLY  10   0.904   2.143 -19.723
    2    HA3  GLY  10           HA2      GLY  10   1.877   4.793 -19.473
    3    HA2  GLY  10           HA3      GLY  10   0.183   4.338 -19.656

  No H/Q in entry =           3
  In of MODEL   54
    1    H    LEU  11           H        LEU  11  -0.186   2.795 -17.376
    2    HA   LEU  11           HA       LEU  11  -0.681   4.759 -15.394
    3    HB2  LEU  11           HB2      LEU  11  -0.620   1.742 -15.261
    4    HB3  LEU  11           HB3      LEU  11  -1.106   2.756 -13.904
    5    HG   LEU  11           HG       LEU  11  -2.386   2.893 -16.647
    6   HD13  LEU  11          HD11      LEU  11  -2.964   0.746 -15.899
    7   HD12  LEU  11          HD12      LEU  11  -4.303   1.738 -15.326
    8   HD11  LEU  11          HD13      LEU  11  -3.032   1.246 -14.209
    9   HD22  LEU  11          HD21      LEU  11  -2.956   4.903 -15.617
   10   HD21  LEU  11          HD22      LEU  11  -2.858   4.225 -13.992
   11   HD23  LEU  11          HD23      LEU  11  -4.250   3.870 -15.016

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  12           H        ILE  12   1.851   2.287 -15.693
    2    HA   ILE  12           HA       ILE  12   3.095   2.803 -13.204
    3    HB   ILE  12           HB       ILE  12   4.301   1.774 -15.795
    4   HG12  ILE  12          HG12      ILE  12   2.314   0.536 -14.626
    5   HG13  ILE  12          HG13      ILE  12   3.711  -0.399 -15.119
    6   HG23  ILE  12          HG21      ILE  12   6.087   2.502 -14.334
    7   HG22  ILE  12          HG22      ILE  12   6.009   0.743 -14.244
    8   HG21  ILE  12          HG23      ILE  12   5.334   1.724 -12.944
    9   HD13  ILE  12          HD11      ILE  12   4.556  -0.374 -12.840
   10   HD12  ILE  12          HD12      ILE  12   2.887  -0.941 -12.826
   11   HD11  ILE  12          HD13      ILE  12   3.261   0.699 -12.341

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  13           H        ILE  13   3.651   4.089 -16.460
    2    HA   ILE  13           HA       ILE  13   5.804   5.797 -15.756
    3    HB   ILE  13           HB       ILE  13   3.739   5.899 -17.969
    4   HG12  ILE  13          HG12      ILE  13   5.506   4.030 -17.789
    5   HG13  ILE  13          HG13      ILE  13   5.371   4.876 -19.328
    6   HG21  ILE  13          HG21      ILE  13   6.078   7.726 -17.409
    7   HG23  ILE  13          HG22      ILE  13   4.423   8.167 -17.815
    8   HG22  ILE  13          HG23      ILE  13   5.480   7.492 -19.053
    9   HD11  ILE  13          HD11      ILE  13   7.281   6.108 -17.426
   10   HD13  ILE  13          HD12      ILE  13   7.447   5.784 -19.148
   11   HD12  ILE  13          HD13      ILE  13   7.724   4.495 -17.983

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ASN  14           H        ASN  14   2.295   6.304 -15.966
    2    HA   ASN  14           HA       ASN  14   2.271   9.045 -15.308
    3    HB2  ASN  14           HB2      ASN  14   0.360   7.415 -16.122
    4    HB3  ASN  14           HB3      ASN  14   0.064   7.225 -14.398
    5   HD21  ASN  14          HD21      ASN  14  -1.973   8.397 -15.790
    6   HD22  ASN  14          HD22      ASN  14  -2.027  10.069 -15.510

  No H/Q in entry =           6
  In of MODEL   54
    1    H    SER  15           H        SER  15   1.999   6.154 -13.248
    2    HA   SER  15           HA       SER  15   1.734   7.507 -10.786
    3    HB2  SER  15           HB2      SER  15   2.285   5.413  -9.761
    4    HB3  SER  15           HB3      SER  15   1.444   5.004 -11.252
    5    HG   SER  15           HG       SER  15   3.492   4.743 -12.235

  No H/Q in entry =           5
  In of MODEL   54
    1    H    GLY  16           H        GLY  16   4.579   6.416 -12.597
    2    HA3  GLY  16           HA2      GLY  16   6.536   7.153 -10.690
    3    HA2  GLY  16           HA3      GLY  16   6.812   6.963 -12.420

  No H/Q in entry =           3
  In of MODEL   54
    1    H    GLN  17           H        GLN  17   5.111   8.932 -13.442
    2    HA   GLN  17           HA       GLN  17   6.698  11.268 -13.141
    3    HB2  GLN  17           HB2      GLN  17   5.357  10.821 -15.168
    4    HB3  GLN  17           HB3      GLN  17   3.876  11.006 -14.226
    5    HG2  GLN  17           HG2      GLN  17   4.423  13.326 -13.732
    6    HG3  GLN  17           HG3      GLN  17   5.981  13.162 -14.540
    7   HE21  GLN  17          HE21      GLN  17   4.100  15.118 -15.417
    8   HE22  GLN  17          HE22      GLN  17   3.528  14.665 -16.950

  No H/Q in entry =           8
  In of MODEL   54
    1    H    ALA  18           H        ALA  18   3.617  10.246 -11.752
    2    HA   ALA  18           HA       ALA  18   2.916  12.627 -10.458
    3    HB1  ALA  18           HB1      ALA  18   1.779  10.174 -10.681
    4    HB2  ALA  18           HB2      ALA  18   1.250  11.386  -9.516
    5    HB3  ALA  18           HB3      ALA  18   2.346  10.098  -9.013

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ARG  19           H        ARG  19   4.804   9.851  -9.228
    2    HA   ARG  19           HA       ARG  19   5.377  10.990  -6.706
    3    HB2  ARG  19           HB2      ARG  19   5.779   8.590  -7.257
    4    HB3  ARG  19           HB3      ARG  19   7.120   9.082  -8.295
    5    HG2  ARG  19           HG2      ARG  19   8.271  10.106  -6.382
    6    HG3  ARG  19           HG3      ARG  19   6.910   9.712  -5.333
    7    HD2  ARG  19           HD2      ARG  19   8.675   8.072  -5.014
    8    HD3  ARG  19           HD3      ARG  19   7.288   7.297  -5.784
    9    HE   ARG  19           HE       ARG  19   8.962   8.129  -7.851
   10   HH21  ARG  19          HH11      ARG  19  10.508   6.728  -8.736
   11   HH22  ARG  19          HH12      ARG  19  11.065   5.373  -7.819
   12   HH11  ARG  19          HH21      ARG  19   9.074   6.078  -5.090
   13   HH12  ARG  19          HH22      ARG  19  10.251   5.004  -5.753

  No H/Q in entry =          13
  In of MODEL   54
    1    H    SER  20           H        SER  20   7.148  11.040  -9.782
    2    HA   SER  20           HA       SER  20   9.406  12.447  -8.982
    3    HB2  SER  20           HB2      SER  20   8.842  11.435 -11.293
    4    HB3  SER  20           HB3      SER  20   8.061  12.978 -11.620
    5    HG   SER  20           HG       SER  20  10.047  13.993 -11.138

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LEU  21           H        LEU  21   6.291  13.727 -10.122
    2    HA   LEU  21           HA       LEU  21   6.967  16.471  -9.888
    3    HB2  LEU  21           HB2      LEU  21   4.298  15.050  -9.775
    4    HB3  LEU  21           HB3      LEU  21   4.468  16.804  -9.775
    5    HG   LEU  21           HG       LEU  21   5.637  15.022 -11.932
    6   HD12  LEU  21          HD11      LEU  21   3.650  16.073 -13.257
    7   HD11  LEU  21          HD12      LEU  21   2.936  16.327 -11.663
    8   HD13  LEU  21          HD13      LEU  21   3.328  14.695 -12.203
    9   HD22  LEU  21          HD21      LEU  21   6.758  17.058 -12.141
   10   HD21  LEU  21          HD22      LEU  21   5.416  17.998 -11.496
   11   HD23  LEU  21          HD23      LEU  21   5.346  17.387 -13.141

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ALA  22           H        ALA  22   5.488  14.165  -7.634
    2    HA   ALA  22           HA       ALA  22   4.917  15.958  -5.545
    3    HB3  ALA  22           HB1      ALA  22   4.153  13.567  -5.714
    4    HB2  ALA  22           HB2      ALA  22   4.766  14.027  -4.125
    5    HB1  ALA  22           HB3      ALA  22   5.772  13.077  -5.218

  No H/Q in entry =           5
  In of MODEL   54
    1    H    TYR  23           H        TYR  23   7.844  13.936  -6.043
    2    HA   TYR  23           HA       TYR  23   9.261  14.938  -3.804
    3    HB2  TYR  23           HB2      TYR  23  10.029  12.939  -4.991
    4    HB3  TYR  23           HB3      TYR  23  10.323  13.890  -6.446
    5    HD1  TYR  23           HD1      TYR  23  11.342  13.503  -2.877
    6    HD2  TYR  23           HD2      TYR  23  12.348  15.081  -6.744
    7    HE1  TYR  23           HE1      TYR  23  13.612  14.072  -2.055
    8    HE2  TYR  23           HE2      TYR  23  14.618  15.651  -5.922
    9    HH   TYR  23           HH       TYR  23  15.428  15.745  -2.685

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ALA  24           H        ALA  24   9.026  16.070  -7.159
    2    HA   ALA  24           HA       ALA  24  10.925  18.154  -6.927
    3    HB2  ALA  24           HB1      ALA  24  10.448  18.232  -9.128
    4    HB3  ALA  24           HB2      ALA  24   8.898  18.978  -8.740
    5    HB1  ALA  24           HB3      ALA  24   9.023  17.226  -8.884

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ALA  25           H        ALA  25   7.456  17.963  -6.254
    2    HA   ALA  25           HA       ALA  25   6.982  20.676  -5.658
    3    HB1  ALA  25           HB1      ALA  25   5.320  18.677  -5.848
    4    HB2  ALA  25           HB2      ALA  25   4.969  19.957  -4.685
    5    HB3  ALA  25           HB3      ALA  25   5.669  18.433  -4.135

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LEU  26           H        LEU  26   8.085  17.983  -3.644
    2    HA   LEU  26           HA       LEU  26   8.226  19.396  -1.199
    3    HB2  LEU  26           HB2      LEU  26   8.324  16.980  -1.212
    4    HB3  LEU  26           HB3      LEU  26   9.779  16.997  -2.205
    5    HG   LEU  26           HG       LEU  26  11.021  18.103  -0.376
    6   HD12  LEU  26          HD11      LEU  26   9.829  18.093   1.903
    7   HD11  LEU  26          HD12      LEU  26   8.328  17.960   0.990
    8   HD13  LEU  26          HD13      LEU  26   9.367  19.369   0.775
    9   HD21  LEU  26          HD21      LEU  26   9.504  15.627   0.503
   10   HD23  LEU  26          HD22      LEU  26  11.029  16.187   1.181
   11   HD22  LEU  26          HD23      LEU  26  10.959  15.640  -0.492

  No H/Q in entry =          11
  In of MODEL   54
    1    H    LYS  27           H        LYS  27  10.604  18.846  -3.764
    2    HA   LYS  27           HA       LYS  27  12.805  20.082  -2.561
    3    HB2  LYS  27           HB2      LYS  27  12.876  18.750  -4.662
    4    HB3  LYS  27           HB3      LYS  27  12.096  20.087  -5.506
    5    HG2  LYS  27           HG2      LYS  27  13.967  21.572  -4.946
    6    HG3  LYS  27           HG3      LYS  27  14.744  20.274  -4.031
    7    HD2  LYS  27           HD2      LYS  27  14.858  18.902  -6.097
    8    HD3  LYS  27           HD3      LYS  27  14.126  20.225  -7.005
    9    HE2  LYS  27           HE2      LYS  27  16.020  21.691  -6.411
   10    HE3  LYS  27           HE3      LYS  27  16.756  20.371  -5.494
   11    HZ3  LYS  27           HZ1      LYS  27  17.712  20.489  -7.694
   12    HZ2  LYS  27           HZ2      LYS  27  16.175  20.372  -8.412
   13    HZ1  LYS  27           HZ3      LYS  27  16.814  19.057  -7.547

  No H/Q in entry =          13
  In of MODEL   54
    1    H    GLN  28           H        GLN  28  10.150  21.472  -4.459
    2    HA   GLN  28           HA       GLN  28  11.101  24.128  -4.608
    3    HB2  GLN  28           HB2      GLN  28   8.274  23.045  -4.464
    4    HB3  GLN  28           HB3      GLN  28   8.672  24.725  -4.825
    5    HG2  GLN  28           HG2      GLN  28   9.660  22.338  -6.413
    6    HG3  GLN  28           HG3      GLN  28   8.309  23.367  -6.884
    7   HE21  GLN  28          HE21      GLN  28  11.452  22.908  -7.651
    8   HE22  GLN  28          HE22      GLN  28  11.914  24.500  -8.017

  No H/Q in entry =           8
  In of MODEL   54
    1    H    ALA  29           H        ALA  29   9.211  22.414  -2.154
    2    HA   ALA  29           HA       ALA  29   8.682  24.592  -0.449
    3    HB2  ALA  29           HB1      ALA  29   7.981  23.011   1.119
    4    HB1  ALA  29           HB2      ALA  29   9.198  21.833   0.627
    5    HB3  ALA  29           HB3      ALA  29   7.795  22.130  -0.398

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LYS  30           H        LYS  30  11.417  22.332  -0.577
    2    HA   LYS  30           HA       LYS  30  12.768  23.274   1.712
    3    HB2  LYS  30           HB2      LYS  30  13.828  22.008  -0.824
    4    HB3  LYS  30           HB3      LYS  30  14.832  22.360   0.585
    5    HG2  LYS  30           HG2      LYS  30  13.304  20.963   1.978
    6    HG3  LYS  30           HG3      LYS  30  12.397  20.550   0.520
    7    HD2  LYS  30           HD2      LYS  30  14.429  19.575  -0.480
    8    HD3  LYS  30           HD3      LYS  30  15.354  20.003   0.961
    9    HE2  LYS  30           HE2      LYS  30  13.875  18.558   2.328
   10    HE3  LYS  30           HE3      LYS  30  12.979  18.111   0.871
   11    HZ2  LYS  30           HZ1      LYS  30  14.786  16.532   1.592
   12    HZ1  LYS  30           HZ2      LYS  30  15.913  17.725   1.132
   13    HZ3  LYS  30           HZ3      LYS  30  14.861  17.047  -0.022

  No H/Q in entry =          13
  In of MODEL   54
    1    H    GLN  31           H        GLN  31  12.604  24.501  -1.574
    2    HA   GLN  31           HA       GLN  31  14.759  26.397  -1.172
    3    HB2  GLN  31           HB2      GLN  31  12.681  26.454  -3.364
    4    HB3  GLN  31           HB3      GLN  31  14.299  27.154  -3.385
    5    HG2  GLN  31           HG2      GLN  31  14.777  24.456  -2.836
    6    HG3  GLN  31           HG3      GLN  31  13.455  24.406  -3.995
    7   HE21  GLN  31          HE21      GLN  31  16.294  23.624  -4.449
    8   HE22  GLN  31          HE22      GLN  31  16.844  24.608  -5.717

  No H/Q in entry =           8
  In of MODEL   54
    1    H    GLY  32           H        GLY  32  11.703  26.198   0.019
    2    HA3  GLY  32           HA2      GLY  32  10.562  27.754   1.322
    3    HA2  GLY  32           HA3      GLY  32  11.676  28.997   0.763

  No H/Q in entry =           3
  In of MODEL   54
    1    H    ASP  33           H        ASP  33  10.278  27.107  -1.721
    2    HA   ASP  33           HA       ASP  33   8.594  29.381  -2.535
    3    HB2  ASP  33           HB2      ASP  33   9.671  26.975  -4.011
    4    HB3  ASP  33           HB3      ASP  33   8.506  28.092  -4.715

  No H/Q in entry =           4
  In of MODEL   54
    1    H    PHE  34           H        PHE  34   6.932  28.890  -0.948
    2    HA   PHE  34           HA       PHE  34   5.560  26.413  -0.849
    3    HB2  PHE  34           HB2      PHE  34   4.603  29.192  -0.134
    4    HB3  PHE  34           HB3      PHE  34   3.764  27.697   0.279
    5    HD1  PHE  34           HD1      PHE  34   6.026  30.093   1.476
    6    HD2  PHE  34           HD2      PHE  34   5.357  25.850   1.403
    7    HE1  PHE  34           HE1      PHE  34   7.450  29.832   3.489
    8    HE2  PHE  34           HE2      PHE  34   6.782  25.593   3.413
    9    HZ   PHE  34           HZ       PHE  34   7.822  27.585   4.456

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ALA  35           H        ALA  35   5.091  29.290  -2.832
    2    HA   ALA  35           HA       ALA  35   2.526  28.675  -3.822
    3    HB1  ALA  35           HB1      ALA  35   3.542  30.085  -5.866
    4    HB3  ALA  35           HB2      ALA  35   4.778  30.441  -4.659
    5    HB2  ALA  35           HB3      ALA  35   3.091  30.843  -4.339

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ALA  36           H        ALA  36   5.735  28.021  -5.231
    2    HA   ALA  36           HA       ALA  36   4.715  26.605  -7.469
    3    HB3  ALA  36           HB1      ALA  36   6.864  26.740  -8.117
    4    HB2  ALA  36           HB2      ALA  36   7.369  25.703  -6.782
    5    HB1  ALA  36           HB3      ALA  36   7.262  27.449  -6.553

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ALA  37           H        ALA  37   5.724  25.590  -4.237
    2    HA   ALA  37           HA       ALA  37   5.667  22.805  -4.685
    3    HB2  ALA  37           HB1      ALA  37   5.438  24.578  -2.290
    4    HB1  ALA  37           HB2      ALA  37   6.570  23.266  -2.609
    5    HB3  ALA  37           HB3      ALA  37   4.917  22.904  -2.115

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LYS  38           H        LYS  38   3.146  24.997  -3.462
    2    HA   LYS  38           HA       LYS  38   1.056  23.177  -3.219
    3    HB2  LYS  38           HB2      LYS  38   1.403  25.932  -2.954
    4    HB3  LYS  38           HB3      LYS  38   0.185  25.790  -4.215
    5    HG2  LYS  38           HG2      LYS  38  -1.239  24.452  -2.760
    6    HG3  LYS  38           HG3      LYS  38   0.025  24.387  -1.523
    7    HD2  LYS  38           HD2      LYS  38  -0.160  26.720  -1.057
    8    HD3  LYS  38           HD3      LYS  38  -1.096  27.016  -2.522
    9    HE2  LYS  38           HE2      LYS  38  -2.569  27.032  -0.559
   10    HE3  LYS  38           HE3      LYS  38  -2.955  25.663  -1.605
   11    HZ3  LYS  38           HZ1      LYS  38  -2.202  24.183  -0.094
   12    HZ2  LYS  38           HZ2      LYS  38  -2.539  25.431   1.009
   13    HZ1  LYS  38           HZ3      LYS  38  -0.952  25.189   0.457

  No H/Q in entry =          13
  In of MODEL   54
    1    H    ALA  39           H        ALA  39   1.985  25.102  -6.069
    2    HA   ALA  39           HA       ALA  39  -0.114  24.241  -7.746
    3    HB2  ALA  39           HB1      ALA  39   2.604  24.904  -8.837
    4    HB1  ALA  39           HB2      ALA  39   1.645  26.157  -8.048
    5    HB3  ALA  39           HB3      ALA  39   1.013  25.328  -9.471

  No H/Q in entry =           5
  In of MODEL   54
    1    H    MET  40           H        MET  40   3.136  22.947  -7.226
    2    HA   MET  40           HA       MET  40   3.013  20.941  -9.230
    3    HB2  MET  40           HB2      MET  40   4.664  21.152  -6.706
    4    HB3  MET  40           HB3      MET  40   4.899  19.905  -7.933
    5    HG2  MET  40           HG2      MET  40   4.937  22.866  -8.578
    6    HG3  MET  40           HG3      MET  40   6.393  21.965  -8.157
    7    HE3  MET  40           HE1      MET  40   7.228  19.772 -10.995
    8    HE2  MET  40           HE2      MET  40   6.691  19.439  -9.351
    9    HE1  MET  40           HE3      MET  40   7.778  20.792  -9.658

  No H/Q in entry =           9
  In of MODEL   54
    1    H    MET  41           H        MET  41   2.152  20.956  -5.792
    2    HA   MET  41           HA       MET  41   1.632  18.188  -5.526
    3    HB2  MET  41           HB2      MET  41   0.313  20.532  -4.137
    4    HB3  MET  41           HB3      MET  41   0.171  18.850  -3.639
    5    HG2  MET  41           HG2      MET  41   2.880  19.082  -3.717
    6    HG3  MET  41           HG3      MET  41   2.440  20.736  -3.303
    7    HE2  MET  41           HE1      MET  41  -0.568  19.461  -1.539
    8    HE1  MET  41           HE2      MET  41   0.238  20.979  -1.918
    9    HE3  MET  41           HE3      MET  41   0.206  20.397  -0.254

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ASP  42           H        ASP  42  -0.430  20.913  -6.448
    2    HA   ASP  42           HA       ASP  42  -2.868  19.545  -6.557
    3    HB2  ASP  42           HB2      ASP  42  -2.174  22.119  -6.806
    4    HB3  ASP  42           HB3      ASP  42  -2.350  21.736  -8.515

  No H/Q in entry =           4
  In of MODEL   54
    1    H    GLN  43           H        GLN  43  -0.468  20.162  -9.092
    2    HA   GLN  43           HA       GLN  43  -1.883  18.853 -11.169
    3    HB2  GLN  43           HB2      GLN  43   1.079  19.376 -10.830
    4    HB3  GLN  43           HB3      GLN  43   0.344  18.744 -12.305
    5    HG2  GLN  43           HG2      GLN  43  -1.175  20.766 -12.309
    6    HG3  GLN  43           HG3      GLN  43  -0.203  21.416 -10.991
    7   HE21  GLN  43          HE21      GLN  43  -0.080  23.052 -13.068
    8   HE22  GLN  43          HE22      GLN  43   1.321  22.842 -13.999

  No H/Q in entry =           8
  In of MODEL   54
    1    H    SER  44           H        SER  44   0.508  17.704  -8.823
    2    HA   SER  44           HA       SER  44   0.836  15.106  -9.872
    3    HB2  SER  44           HB2      SER  44   1.761  16.532  -7.640
    4    HB3  SER  44           HB3      SER  44   0.914  15.140  -6.966
    5    HG   SER  44           HG       SER  44   3.020  14.531  -7.429

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ARG  45           H        ARG  45  -1.452  16.399  -7.489
    2    HA   ARG  45           HA       ARG  45  -2.820  14.028  -6.850
    3    HB2  ARG  45           HB2      ARG  45  -3.007  16.187  -5.640
    4    HB3  ARG  45           HB3      ARG  45  -3.887  16.861  -7.008
    5    HG2  ARG  45           HG2      ARG  45  -5.642  15.126  -6.710
    6    HG3  ARG  45           HG3      ARG  45  -4.774  14.507  -5.305
    7    HD2  ARG  45           HD2      ARG  45  -4.972  16.766  -4.229
    8    HD3  ARG  45           HD3      ARG  45  -5.983  17.291  -5.593
    9    HE   ARG  45           HE       ARG  45  -7.067  14.904  -4.552
   10   HH21  ARG  45          HH11      ARG  45  -8.884  14.963  -3.253
   11   HH22  ARG  45          HH12      ARG  45  -9.271  16.395  -2.367
   12   HH11  ARG  45          HH21      ARG  45  -6.518  18.145  -3.514
   13   HH12  ARG  45          HH22      ARG  45  -7.926  18.197  -2.514

  No H/Q in entry =          13
  In of MODEL   54
    1    H    MET  46           H        MET  46  -3.453  16.448  -9.374
    2    HA   MET  46           HA       MET  46  -5.803  15.274 -10.408
    3    HB2  MET  46           HB2      MET  46  -3.728  17.117 -11.603
    4    HB3  MET  46           HB3      MET  46  -5.124  16.562 -12.533
    5    HG2  MET  46           HG2      MET  46  -6.636  17.460 -10.808
    6    HG3  MET  46           HG3      MET  46  -5.253  18.003  -9.864
    7    HE3  MET  46           HE1      MET  46  -6.673  21.359 -11.090
    8    HE2  MET  46           HE2      MET  46  -5.700  20.652  -9.805
    9    HE1  MET  46           HE3      MET  46  -7.260  19.940 -10.214

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ALA  47           H        ALA  47  -2.385  14.814 -11.222
    2    HA   ALA  47           HA       ALA  47  -2.757  13.101 -13.439
    3    HB3  ALA  47           HB1      ALA  47  -0.578  13.998 -13.114
    4    HB2  ALA  47           HB2      ALA  47  -0.424  12.268 -12.795
    5    HB1  ALA  47           HB3      ALA  47  -0.501  13.410 -11.452

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LEU  48           H        LEU  48  -2.431  12.442  -9.974
    2    HA   LEU  48           HA       LEU  48  -2.516   9.603 -10.151
    3    HB2  LEU  48           HB2      LEU  48  -3.254  11.502  -7.912
    4    HB3  LEU  48           HB3      LEU  48  -3.149   9.750  -7.726
    5    HG   LEU  48           HG       LEU  48  -0.873  11.467  -8.746
    6   HD13  LEU  48          HD11      LEU  48  -1.125  12.220  -6.546
    7   HD12  LEU  48          HD12      LEU  48   0.046  10.917  -6.375
    8   HD11  LEU  48          HD13      LEU  48  -1.644  10.644  -5.953
    9   HD22  LEU  48          HD21      LEU  48  -0.375   9.288  -9.410
   10   HD21  LEU  48          HD22      LEU  48  -1.221   8.559  -8.046
   11   HD23  LEU  48          HD23      LEU  48   0.353   9.318  -7.805

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ASN  49           H        ASN  49  -4.983  12.082  -9.694
    2    HA   ASN  49           HA       ASN  49  -7.153  10.404  -9.133
    3    HB2  ASN  49           HB2      ASN  49  -7.212  12.825  -8.792
    4    HB3  ASN  49           HB3      ASN  49  -7.085  13.096 -10.525
    5   HD21  ASN  49          HD21      ASN  49  -9.094  13.862 -11.161
    6   HD22  ASN  49          HD22      ASN  49 -10.577  13.149 -10.750

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLU  50           H        GLU  50  -5.927  11.628 -12.231
    2    HA   GLU  50           HA       GLU  50  -7.900  10.375 -13.856
    3    HB2  GLU  50           HB2      GLU  50  -6.455  12.206 -14.679
    4    HB3  GLU  50           HB3      GLU  50  -5.055  11.140 -14.570
    5    HG2  GLU  50           HG2      GLU  50  -6.046   9.611 -16.203
    6    HG3  GLU  50           HG3      GLU  50  -7.512  10.584 -16.261

  No H/Q in entry =           6
  In of MODEL   54
    1    H    ALA  51           H        ALA  51  -4.708   9.389 -12.706
    2    HA   ALA  51           HA       ALA  51  -4.579   6.946 -14.143
    3    HB2  ALA  51           HB1      ALA  51  -2.580   6.659 -13.075
    4    HB1  ALA  51           HB2      ALA  51  -3.246   7.068 -11.495
    5    HB3  ALA  51           HB3      ALA  51  -2.813   8.348 -12.627

  No H/Q in entry =           5
  In of MODEL   54
    1    H    HIS  52           H        HIS  52  -5.706   7.750 -10.871
    2    HA   HIS  52           HA       HIS  52  -6.367   5.131 -10.047
    3    HB2  HIS  52           HB2      HIS  52  -6.225   7.242  -8.623
    4    HB3  HIS  52           HB3      HIS  52  -7.839   7.631  -9.217
    5    HD1  HIS  52           HD1      HIS  52  -9.461   5.241  -9.043
    6    HD2  HIS  52           HD2      HIS  52  -6.460   5.909  -6.229
    7    HE1  HIS  52           HE1      HIS  52 -10.044   3.828  -7.023
    8    HE2  HIS  52           HE2      HIS  52  -8.223   4.225  -5.298

  No H/Q in entry =           8
  In of MODEL   54
    1    H    LEU  53           H        LEU  53  -8.225   7.594 -11.790
    2    HA   LEU  53           HA       LEU  53 -10.725   6.292 -11.774
    3    HB2  LEU  53           HB2      LEU  53  -9.479   8.286 -13.657
    4    HB3  LEU  53           HB3      LEU  53 -11.086   7.623 -13.945
    5    HG   LEU  53           HG       LEU  53 -10.304   8.931 -11.319
    6   HD13  LEU  53          HD11      LEU  53 -10.070  10.563 -13.153
    7   HD12  LEU  53          HD12      LEU  53 -11.474  10.940 -12.152
    8   HD11  LEU  53          HD13      LEU  53 -11.687  10.164 -13.719
    9   HD21  LEU  53          HD21      LEU  53 -12.902   8.054 -12.596
   10   HD23  LEU  53          HD22      LEU  53 -12.882   9.310 -11.363
   11   HD22  LEU  53          HD23      LEU  53 -12.316   7.696 -10.978

  No H/Q in entry =          11
  In of MODEL   54
    1    H    VAL  54           H        VAL  54  -8.008   6.121 -14.054
    2    HA   VAL  54           HA       VAL  54  -9.251   4.359 -15.891
    3    HB   VAL  54           HB       VAL  54  -6.336   4.872 -15.249
    4   HG12  VAL  54          HG11      VAL  54  -6.120   3.804 -17.649
    5   HG11  VAL  54          HG12      VAL  54  -7.640   3.015 -17.228
    6   HG13  VAL  54          HG13      VAL  54  -6.208   2.759 -16.232
    7   HG22  VAL  54          HG21      VAL  54  -7.128   6.819 -16.268
    8   HG21  VAL  54          HG22      VAL  54  -8.333   5.958 -17.224
    9   HG23  VAL  54          HG23      VAL  54  -6.633   5.888 -17.681

  No H/Q in entry =           9
  In of MODEL   54
    1    H    GLN  55           H        GLN  55  -7.207   3.800 -13.025
    2    HA   GLN  55           HA       GLN  55  -7.111   0.985 -13.303
    3    HB2  GLN  55           HB2      GLN  55  -5.536   1.876 -11.801
    4    HB3  GLN  55           HB3      GLN  55  -6.743   2.832 -10.946
    5    HG2  GLN  55           HG2      GLN  55  -7.406   1.063  -9.631
    6    HG3  GLN  55           HG3      GLN  55  -7.196  -0.114 -10.921
    7   HE21  GLN  55          HE21      GLN  55  -5.560  -1.561 -10.461
    8   HE22  GLN  55          HE22      GLN  55  -4.164  -1.211  -9.568

  No H/Q in entry =           8
  In of MODEL   54
    1    H    THR  56           H        THR  56  -9.425   3.128 -11.639
    2    HA   THR  56           HA       THR  56 -10.984   1.230 -10.339
    3    HB   THR  56           HB       THR  56 -12.112   3.624 -11.812
    4    HG1  THR  56           HG1      THR  56 -10.186   3.914 -10.364
    5   HG23  THR  56          HG21      THR  56 -13.886   2.369 -10.907
    6   HG22  THR  56          HG22      THR  56 -13.562   3.580  -9.665
    7   HG21  THR  56          HG23      THR  56 -12.962   1.932  -9.470

  No H/Q in entry =           7
  In of MODEL   54
    1    H    LYS  57           H        LYS  57 -11.240   2.336 -13.714
    2    HA   LYS  57           HA       LYS  57 -13.401   0.647 -14.447
    3    HB2  LYS  57           HB2      LYS  57 -12.552   2.610 -15.763
    4    HB3  LYS  57           HB3      LYS  57 -11.115   1.678 -16.159
    5    HG2  LYS  57           HG2      LYS  57 -12.478   0.007 -17.315
    6    HG3  LYS  57           HG3      LYS  57 -13.948   0.869 -16.874
    7    HD2  LYS  57           HD2      LYS  57 -13.180   2.835 -18.171
    8    HD3  LYS  57           HD3      LYS  57 -11.724   1.958 -18.633
    9    HE2  LYS  57           HE2      LYS  57 -14.549   1.021 -19.250
   10    HE3  LYS  57           HE3      LYS  57 -13.522   1.876 -20.401
   11    HZ1  LYS  57           HZ1      LYS  57 -12.039  -0.225 -19.320
   12    HZ3  LYS  57           HZ2      LYS  57 -12.581  -0.033 -20.919
   13    HZ2  LYS  57           HZ3      LYS  57 -13.543  -0.855 -19.784

  No H/Q in entry =          13
  In of MODEL   54
    1    H    LEU  58           H        LEU  58  -9.895   0.227 -14.445
    2    HA   LEU  58           HA       LEU  58  -9.914  -2.281 -15.751
    3    HB2  LEU  58           HB2      LEU  58  -7.857  -0.994 -13.964
    4    HB3  LEU  58           HB3      LEU  58  -7.604  -2.509 -14.832
    5    HG   LEU  58           HG       LEU  58  -8.387   0.102 -16.167
    6   HD11  LEU  58          HD11      LEU  58  -5.726  -1.131 -15.523
    7   HD13  LEU  58          HD12      LEU  58  -6.226   0.558 -15.455
    8   HD12  LEU  58          HD13      LEU  58  -5.907  -0.201 -17.012
    9   HD22  LEU  58          HD21      LEU  58  -8.981  -1.451 -17.759
   10   HD21  LEU  58          HD22      LEU  58  -7.926  -2.700 -17.102
   11   HD23  LEU  58          HD23      LEU  58  -7.254  -1.417 -18.108

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  59           H        ILE  59 -10.690  -1.403 -12.482
    2    HA   ILE  59           HA       ILE  59 -10.316  -4.175 -11.558
    3    HB   ILE  59           HB       ILE  59  -9.856  -1.920 -10.150
    4   HG12  ILE  59          HG12      ILE  59 -11.207  -4.282  -8.827
    5   HG13  ILE  59          HG13      ILE  59  -9.569  -4.350  -9.427
    6   HG21  ILE  59          HG21      ILE  59 -12.394  -1.400 -10.367
    7   HG23  ILE  59          HG22      ILE  59 -11.662  -1.238  -8.787
    8   HG22  ILE  59          HG23      ILE  59 -12.615  -2.666  -9.183
    9   HD12  ILE  59          HD11      ILE  59  -9.665  -3.771  -7.020
   10   HD11  ILE  59          HD12      ILE  59 -10.565  -2.317  -7.432
   11   HD13  ILE  59          HD13      ILE  59  -8.899  -2.508  -7.977

  No H/Q in entry =          11
  In of MODEL   54
    1    H    GLU  60           H        GLU  60 -12.894  -1.864 -12.313
    2    HA   GLU  60           HA       GLU  60 -15.058  -3.395 -11.279
    3    HB2  GLU  60           HB2      GLU  60 -16.410  -1.789 -12.230
    4    HB3  GLU  60           HB3      GLU  60 -14.887  -0.907 -12.228
    5    HG2  GLU  60           HG2      GLU  60 -15.679  -0.624 -14.432
    6    HG3  GLU  60           HG3      GLU  60 -14.532  -1.938 -14.582

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLY  61           H        GLY  61 -13.430  -3.353 -14.417
    2    HA3  GLY  61           HA2      GLY  61 -15.148  -5.598 -15.297
    3    HA2  GLY  61           HA3      GLY  61 -14.323  -4.483 -16.380

  No H/Q in entry =           3
  In of MODEL   54
    1    H    ASP  62           H        ASP  62 -12.902  -5.946 -13.526
    2    HA   ASP  62           HA       ASP  62 -10.654  -6.892 -15.027
    3    HB2  ASP  62           HB2      ASP  62  -9.897  -7.730 -12.824
    4    HB3  ASP  62           HB3      ASP  62 -10.405  -6.046 -12.751

  No H/Q in entry =           4
  In of MODEL   54
    1    H    ALA  63           H        ALA  63 -12.293  -8.254 -16.458
    2    HA   ALA  63           HA       ALA  63 -13.329 -10.718 -15.465
    3    HB1  ALA  63           HB1      ALA  63 -13.960  -9.621 -17.644
    4    HB2  ALA  63           HB2      ALA  63 -13.538 -11.322 -17.822
    5    HB3  ALA  63           HB3      ALA  63 -12.378 -10.073 -18.278

  No H/Q in entry =           5
  In of MODEL   54
    1    H    GLY  64           H        GLY  64 -10.255  -9.774 -16.887
    2    HA3  GLY  64           HA2      GLY  64  -8.175 -10.752 -16.809
    3    HA2  GLY  64           HA3      GLY  64  -8.814 -11.904 -15.643

  No H/Q in entry =           3
  In of MODEL   54
    1    H    GLU  65           H        GLU  65  -7.241 -13.240 -17.070
    2    HA   GLU  65           HA       GLU  65  -7.991 -13.949 -19.692
    3    HB2  GLU  65           HB2      GLU  65  -6.341 -15.420 -17.641
    4    HB3  GLU  65           HB3      GLU  65  -6.533 -15.956 -19.311
    5    HG2  GLU  65           HG2      GLU  65  -5.603 -13.852 -20.131
    6    HG3  GLU  65           HG3      GLU  65  -5.486 -13.235 -18.484

  No H/Q in entry =           6
  In of MODEL   54
    1    H    GLY  66           H        GLY  66  -8.754 -15.364 -16.597
    2    HA3  GLY  66           HA2      GLY  66 -10.596 -17.294 -17.834
    3    HA2  GLY  66           HA3      GLY  66  -9.890 -17.450 -16.238

  No H/Q in entry =           3
  In of MODEL   54
    1    H    LYS  67           H        LYS  67 -12.383 -17.930 -16.169
    2    HA   LYS  67           HA       LYS  67 -14.253 -15.862 -16.152
    3    HB2  LYS  67           HB2      LYS  67 -14.216 -18.513 -14.719
    4    HB3  LYS  67           HB3      LYS  67 -15.629 -17.452 -14.792
    5    HG2  LYS  67           HG2      LYS  67 -15.532 -17.485 -17.260
    6    HG3  LYS  67           HG3      LYS  67 -14.128 -18.549 -17.190
    7    HD2  LYS  67           HD2      LYS  67 -15.460 -20.288 -16.100
    8    HD3  LYS  67           HD3      LYS  67 -16.864 -19.219 -16.071
    9    HE2  LYS  67           HE2      LYS  67 -17.028 -20.752 -17.981
   10    HE3  LYS  67           HE3      LYS  67 -16.805 -19.097 -18.551
   11    HZ1  LYS  67           HZ1      LYS  67 -14.625 -21.086 -18.228
   12    HZ3  LYS  67           HZ2      LYS  67 -14.476 -19.521 -18.868
   13    HZ2  LYS  67           HZ3      LYS  67 -15.370 -20.701 -19.700

  No H/Q in entry =          13
  In of MODEL   54
    1    H    MET  68           H        MET  68 -13.414 -17.539 -13.196
    2    HA   MET  68           HA       MET  68 -14.182 -15.470 -11.452
    3    HB2  MET  68           HB2      MET  68 -12.432 -17.886 -10.985
    4    HB3  MET  68           HB3      MET  68 -13.109 -16.870  -9.713
    5    HG2  MET  68           HG2      MET  68 -14.747 -18.335 -11.803
    6    HG3  MET  68           HG3      MET  68 -14.497 -18.892 -10.148
    7    HE2  MET  68           HE1      MET  68 -14.790 -16.015  -8.340
    8    HE1  MET  68           HE2      MET  68 -14.898 -17.769  -8.211
    9    HE3  MET  68           HE3      MET  68 -16.314 -16.779  -7.866

  No H/Q in entry =           9
  In of MODEL   54
    1    H    LYS  69           H        LYS  69 -10.929 -16.365 -12.639
    2    HA   LYS  69           HA       LYS  69  -9.520 -14.678 -10.866
    3    HB2  LYS  69           HB2      LYS  69  -8.750 -15.938 -13.495
    4    HB3  LYS  69           HB3      LYS  69  -7.614 -15.029 -12.496
    5    HG2  LYS  69           HG2      LYS  69  -8.074 -16.536 -10.594
    6    HG3  LYS  69           HG3      LYS  69  -9.209 -17.444 -11.589
    7    HD2  LYS  69           HD2      LYS  69  -7.383 -18.024 -13.146
    8    HD3  LYS  69           HD3      LYS  69  -6.245 -17.124 -12.142
    9    HE2  LYS  69           HE2      LYS  69  -6.747 -18.613 -10.237
   10    HE3  LYS  69           HE3      LYS  69  -7.877 -19.517 -11.242
   11    HZ2  LYS  69           HZ1      LYS  69  -5.370 -20.236 -10.963
   12    HZ1  LYS  69           HZ2      LYS  69  -5.165 -19.157 -12.258
   13    HZ3  LYS  69           HZ3      LYS  69  -6.216 -20.484 -12.411

  No H/Q in entry =          13
  In of MODEL   54
    1    H    VAL  70           H        VAL  70  -7.915 -12.953 -11.647
    2    HA   VAL  70           HA       VAL  70  -9.257 -11.031 -13.464
    3    HB   VAL  70           HB       VAL  70  -8.425  -9.240 -11.954
    4   HG13  VAL  70          HG11      VAL  70 -10.686  -9.759 -11.578
    5   HG12  VAL  70          HG12      VAL  70  -9.981  -9.955  -9.973
    6   HG11  VAL  70          HG13      VAL  70 -10.310 -11.371 -10.970
    7   HG22  VAL  70          HG21      VAL  70  -6.542 -10.361 -10.898
    8   HG21  VAL  70          HG22      VAL  70  -7.599 -11.615 -10.255
    9   HG23  VAL  70          HG23      VAL  70  -7.703  -9.972  -9.630

  No H/Q in entry =           9
  In of MODEL   54
    1    H    SER  71           H        SER  71  -7.722  -9.343 -14.252
    2    HA   SER  71           HA       SER  71  -5.488 -10.479 -15.558
    3    HB2  SER  71           HB2      SER  71  -6.693  -8.460 -16.370
    4    HB3  SER  71           HB3      SER  71  -6.058  -7.557 -14.997
    5    HG   SER  71           HG       SER  71  -4.781  -7.332 -16.904

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LEU  72           H        LEU  72  -3.453 -10.746 -14.945
    2    HA   LEU  72           HA       LEU  72  -2.694 -10.546 -12.243
    3    HB2  LEU  72           HB2      LEU  72  -1.077 -10.955 -14.754
    4    HB3  LEU  72           HB3      LEU  72  -0.389 -11.034 -13.134
    5    HG   LEU  72           HG       LEU  72  -2.753 -12.727 -14.003
    6   HD13  LEU  72          HD11      LEU  72  -1.232 -14.523 -14.451
    7   HD12  LEU  72          HD12      LEU  72   0.132 -13.615 -13.801
    8   HD11  LEU  72          HD13      LEU  72  -0.607 -13.123 -15.325
    9   HD22  LEU  72          HD21      LEU  72  -2.700 -12.754 -11.653
   10   HD21  LEU  72          HD22      LEU  72  -0.948 -12.633 -11.581
   11   HD23  LEU  72          HD23      LEU  72  -1.707 -14.150 -12.059

  No H/Q in entry =          11
  In of MODEL   54
    1    H    VAL  73           H        VAL  73  -2.024  -8.511 -15.021
    2    HA   VAL  73           HA       VAL  73  -0.092  -6.813 -13.935
    3    HB   VAL  73           HB       VAL  73  -0.509  -5.390 -15.779
    4   HG12  VAL  73          HG11      VAL  73  -1.354  -8.168 -16.652
    5   HG11  VAL  73          HG12      VAL  73   0.311  -7.713 -16.291
    6   HG13  VAL  73          HG13      VAL  73  -0.540  -6.949 -17.633
    7   HG23  VAL  73          HG21      VAL  73  -2.705  -5.949 -17.142
    8   HG22  VAL  73          HG22      VAL  73  -2.772  -4.853 -15.763
    9   HG21  VAL  73          HG23      VAL  73  -3.277  -6.534 -15.579

  No H/Q in entry =           9
  In of MODEL   54
    1    H    LEU  74           H        LEU  74  -3.481  -6.942 -13.329
    2    HA   LEU  74           HA       LEU  74  -4.097  -4.291 -12.691
    3    HB2  LEU  74           HB2      LEU  74  -5.825  -5.958 -12.850
    4    HB3  LEU  74           HB3      LEU  74  -5.111  -6.892 -11.537
    5    HG   LEU  74           HG       LEU  74  -5.556  -5.033  -9.970
    6   HD13  LEU  74          HD11      LEU  74  -5.456  -3.086 -11.323
    7   HD12  LEU  74          HD12      LEU  74  -7.159  -3.238 -10.896
    8   HD11  LEU  74          HD13      LEU  74  -6.602  -3.740 -12.493
    9   HD21  LEU  74          HD21      LEU  74  -7.274  -6.865 -10.841
   10   HD23  LEU  74          HD22      LEU  74  -8.111  -5.428 -11.388
   11   HD22  LEU  74          HD23      LEU  74  -7.752  -5.622  -9.689

  No H/Q in entry =          11
  In of MODEL   54
    1    H    VAL  75           H        VAL  75  -3.018  -6.889 -10.561
    2    HA   VAL  75           HA       VAL  75  -2.790  -5.352  -8.211
    3    HB   VAL  75           HB       VAL  75  -1.289  -7.834  -9.034
    4   HG12  VAL  75          HG11      VAL  75  -0.814  -8.005  -6.566
    5   HG11  VAL  75          HG12      VAL  75  -1.500  -6.399  -6.362
    6   HG13  VAL  75          HG13      VAL  75  -0.035  -6.610  -7.306
    7   HG22  VAL  75          HG21      VAL  75  -2.968  -8.997  -7.828
    8   HG21  VAL  75          HG22      VAL  75  -3.869  -7.787  -8.739
    9   HG23  VAL  75          HG23      VAL  75  -3.531  -7.531  -7.027

  No H/Q in entry =           9
  In of MODEL   54
    1    H    GLU  76           H        GLU  76  -0.416  -6.090 -10.786
    2    HA   GLU  76           HA       GLU  76   1.783  -4.744  -9.652
    3    HB2  GLU  76           HB2      GLU  76   1.952  -6.209 -11.651
    4    HB3  GLU  76           HB3      GLU  76   1.037  -5.036 -12.585
    5    HG2  GLU  76           HG2      GLU  76   3.375  -4.715 -13.099
    6    HG3  GLU  76           HG3      GLU  76   2.868  -3.344 -12.130

  No H/Q in entry =           6
  In of MODEL   54
    1    H    ALA  77           H        ALA  77  -0.783  -3.536 -11.796
    2    HA   ALA  77           HA       ALA  77   0.197  -0.886 -11.970
    3    HB3  ALA  77           HB1      ALA  77  -2.600  -2.010 -12.258
    4    HB1  ALA  77           HB2      ALA  77  -1.456  -1.644 -13.549
    5    HB2  ALA  77           HB3      ALA  77  -2.176  -0.334 -12.614

  No H/Q in entry =           5
  In of MODEL   54
    1    H    GLN  78           H        GLN  78  -2.035  -2.462  -9.737
    2    HA   GLN  78           HA       GLN  78  -2.828  -0.154  -8.310
    3    HB2  GLN  78           HB2      GLN  78  -3.930  -2.418  -8.223
    4    HB3  GLN  78           HB3      GLN  78  -2.577  -2.978  -7.242
    5    HG2  GLN  78           HG2      GLN  78  -3.077  -1.255  -5.561
    6    HG3  GLN  78           HG3      GLN  78  -4.429  -0.685  -6.540
    7   HE21  GLN  78          HE21      GLN  78  -4.833  -1.693  -3.877
    8   HE22  GLN  78          HE22      GLN  78  -5.704  -3.145  -3.991

  No H/Q in entry =           8
  In of MODEL   54
    1    H    LEU  79           H        LEU  79  -0.136  -2.404  -7.912
    2    HA   LEU  79           HA       LEU  79   0.872  -1.520  -5.463
    3    HB2  LEU  79           HB2      LEU  79   1.733  -3.519  -6.556
    4    HB3  LEU  79           HB3      LEU  79   2.357  -2.557  -7.892
    5    HG   LEU  79           HG       LEU  79   3.930  -1.421  -6.404
    6   HD13  LEU  79          HD11      LEU  79   2.954  -1.192  -4.321
    7   HD12  LEU  79          HD12      LEU  79   4.042  -2.540  -4.001
    8   HD11  LEU  79          HD13      LEU  79   2.333  -2.844  -4.308
    9   HD23  LEU  79          HD21      LEU  79   5.161  -3.571  -5.531
   10   HD22  LEU  79          HD22      LEU  79   4.932  -3.362  -7.265
   11   HD21  LEU  79          HD23      LEU  79   3.870  -4.441  -6.364

  No H/Q in entry =          11
  In of MODEL   54
    1    H    HIS  80           H        HIS  80   1.691  -0.379  -8.741
    2    HA   HIS  80           HA       HIS  80   3.505   1.609  -7.832
    3    HB2  HIS  80           HB2      HIS  80   2.181   0.926 -10.401
    4    HB3  HIS  80           HB3      HIS  80   2.772   2.579 -10.228
    5    HD1  HIS  80           HD1      HIS  80   5.165   2.892 -10.782
    6    HD2  HIS  80           HD2      HIS  80   4.378  -1.029  -9.604
    7    HE1  HIS  80           HE1      HIS  80   7.357   1.625 -10.987
    8    HE2  HIS  80           HE2      HIS  80   6.888  -0.768 -10.272

  No H/Q in entry =           8
  In of MODEL   54
    1    H    LEU  81           H        LEU  81   0.087   1.761  -8.763
    2    HA   LEU  81           HA       LEU  81  -0.195   4.551  -8.410
    3    HB2  LEU  81           HB2      LEU  81  -2.199   2.296  -8.317
    4    HB3  LEU  81           HB3      LEU  81  -2.657   3.997  -8.208
    5    HG   LEU  81           HG       LEU  81  -0.991   2.868 -10.475
    6   HD12  LEU  81          HD11      LEU  81  -3.243   3.186 -11.740
    7   HD11  LEU  81          HD12      LEU  81  -3.976   3.104 -10.139
    8   HD13  LEU  81          HD13      LEU  81  -3.035   1.745 -10.748
    9   HD23  LEU  81          HD21      LEU  81  -2.113   5.014 -11.543
   10   HD22  LEU  81          HD22      LEU  81  -0.683   5.185 -10.529
   11   HD21  LEU  81          HD23      LEU  81  -2.280   5.522  -9.863

  No H/Q in entry =          11
  In of MODEL   54
    1    H    MET  82           H        MET  82  -0.811   1.847  -6.170
    2    HA   MET  82           HA       MET  82  -1.841   3.415  -4.058
    3    HB2  MET  82           HB2      MET  82  -0.455   0.735  -4.133
    4    HB3  MET  82           HB3      MET  82  -1.016   1.448  -2.623
    5    HG2  MET  82           HG2      MET  82  -2.781   0.961  -5.043
    6    HG3  MET  82           HG3      MET  82  -2.678  -0.121  -3.656
    7    HE3  MET  82           HE1      MET  82  -4.368   1.502  -0.806
    8    HE2  MET  82           HE2      MET  82  -2.642   1.790  -1.013
    9    HE1  MET  82           HE3      MET  82  -3.329   0.232  -1.468

  No H/Q in entry =           9
  In of MODEL   54
    1    H    THR  83           H        THR  83   1.455   2.350  -4.800
    2    HA   THR  83           HA       THR  83   2.699   3.445  -2.510
    3    HB   THR  83           HB       THR  83   4.774   3.410  -4.013
    4    HG1  THR  83           HG1      THR  83   4.508   2.895  -6.037
    5   HG22  THR  83          HG21      THR  83   4.338   0.752  -4.356
    6   HG21  THR  83          HG22      THR  83   3.063   1.117  -3.196
    7   HG23  THR  83          HG23      THR  83   4.746   1.467  -2.798

  No H/Q in entry =           7
  In of MODEL   54
    1    H    SER  84           H        SER  84   2.276   4.744  -5.796
    2    HA   SER  84           HA       SER  84   3.610   7.188  -5.345
    3    HB2  SER  84           HB2      SER  84   1.516   6.358  -7.340
    4    HB3  SER  84           HB3      SER  84   2.186   7.988  -7.314
    5    HG   SER  84           HG       SER  84   3.567   5.522  -7.640

  No H/Q in entry =           5
  In of MODEL   54
    1    H    MET  85           H        MET  85   0.122   6.413  -5.129
    2    HA   MET  85           HA       MET  85  -0.743   9.015  -4.499
    3    HB2  MET  85           HB2      MET  85  -2.264   7.199  -5.158
    4    HB3  MET  85           HB3      MET  85  -1.954   6.391  -3.622
    5    HG2  MET  85           HG2      MET  85  -2.840   8.339  -2.403
    6    HG3  MET  85           HG3      MET  85  -3.123   9.171  -3.930
    7    HE2  MET  85           HE1      MET  85  -5.237   5.759  -1.931
    8    HE1  MET  85           HE2      MET  85  -3.528   6.187  -1.882
    9    HE3  MET  85           HE3      MET  85  -4.124   5.110  -3.141

  No H/Q in entry =           9
  In of MODEL   54
    1    H    LEU  86           H        LEU  86   0.219   6.343  -2.385
    2    HA   LEU  86           HA       LEU  86  -0.286   7.628   0.072
    3    HB2  LEU  86           HB2      LEU  86   0.184   5.162  -0.344
    4    HB3  LEU  86           HB3      LEU  86   1.887   5.599  -0.460
    5    HG   LEU  86           HG       LEU  86   1.590   6.744   1.820
    6   HD11  LEU  86          HD11      LEU  86  -1.108   5.970   1.381
    7   HD13  LEU  86          HD12      LEU  86  -0.424   6.710   2.827
    8   HD12  LEU  86          HD13      LEU  86  -0.510   4.955   2.698
    9   HD23  LEU  86          HD21      LEU  86   1.175   3.749   1.928
   10   HD22  LEU  86          HD22      LEU  86   2.188   4.756   2.961
   11   HD21  LEU  86          HD23      LEU  86   2.667   4.444   1.293

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ALA  87           H        ALA  87   2.670   7.358  -1.861
    2    HA   ALA  87           HA       ALA  87   4.394   8.763  -0.151
    3    HB3  ALA  87           HB1      ALA  87   4.455   7.769  -2.866
    4    HB2  ALA  87           HB2      ALA  87   5.803   8.097  -1.782
    5    HB1  ALA  87           HB3      ALA  87   5.170   9.382  -2.808

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ARG  88           H        ARG  88   2.405   9.910  -2.836
    2    HA   ARG  88           HA       ARG  88   3.172  12.602  -2.712
    3    HB2  ARG  88           HB2      ARG  88   1.895  11.457  -4.559
    4    HB3  ARG  88           HB3      ARG  88   0.452  11.589  -3.554
    5    HG2  ARG  88           HG2      ARG  88   1.464  14.172  -3.468
    6    HG3  ARG  88           HG3      ARG  88   1.866  13.670  -5.108
    7    HD2  ARG  88           HD2      ARG  88  -0.285  13.749  -5.774
    8    HD3  ARG  88           HD3      ARG  88  -0.849  12.884  -4.344
    9    HE   ARG  88           HE       ARG  88  -1.052  15.664  -4.740
   10   HH21  ARG  88          HH11      ARG  88  -1.558  16.980  -2.986
   11   HH22  ARG  88          HH12      ARG  88  -1.237  16.433  -1.376
   12   HH11  ARG  88          HH21      ARG  88   0.004  13.389  -2.396
   13   HH12  ARG  88          HH22      ARG  88  -0.371  14.393  -1.042

  No H/Q in entry =          13
  In of MODEL   54
    1    H    GLU  89           H        GLU  89   0.497  10.908  -1.045
    2    HA   GLU  89           HA       GLU  89  -0.599  13.209   0.192
    3    HB2  GLU  89           HB2      GLU  89  -1.713  10.967   0.106
    4    HB3  GLU  89           HB3      GLU  89  -0.570  10.407   1.327
    5    HG2  GLU  89           HG2      GLU  89  -1.371  12.093   2.909
    6    HG3  GLU  89           HG3      GLU  89  -2.443  12.769   1.685

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LEU  90           H        LEU  90   1.874  10.915   1.315
    2    HA   LEU  90           HA       LEU  90   2.263  12.143   3.848
    3    HB2  LEU  90           HB2      LEU  90   4.016  10.384   2.133
    4    HB3  LEU  90           HB3      LEU  90   4.458  10.890   3.769
    5    HG   LEU  90           HG       LEU  90   1.816   9.544   3.136
    6   HD12  LEU  90          HD11      LEU  90   2.975   7.493   4.114
    7   HD11  LEU  90          HD12      LEU  90   4.492   8.354   3.856
    8   HD13  LEU  90          HD13      LEU  90   3.461   7.954   2.481
    9   HD22  LEU  90          HD21      LEU  90   1.581  10.452   5.268
   10   HD21  LEU  90          HD22      LEU  90   3.304  10.345   5.625
   11   HD23  LEU  90          HD23      LEU  90   2.301   8.896   5.678

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  91           H        ILE  91   3.821  12.550   0.701
    2    HA   ILE  91           HA       ILE  91   5.806  14.379   1.524
    3    HB   ILE  91           HB       ILE  91   4.457  13.905  -1.140
    4   HG12  ILE  91          HG12      ILE  91   7.304  13.415  -0.210
    5   HG13  ILE  91          HG13      ILE  91   6.027  12.215  -0.038
    6   HG22  ILE  91          HG21      ILE  91   6.668  15.260  -1.851
    7   HG21  ILE  91          HG22      ILE  91   6.379  16.050  -0.300
    8   HG23  ILE  91          HG23      ILE  91   5.138  16.085  -1.551
    9   HD13  ILE  91          HD11      ILE  91   5.821  11.907  -2.344
   10   HD12  ILE  91          HD12      ILE  91   7.558  12.151  -2.154
   11   HD11  ILE  91          HD13      ILE  91   6.537  13.477  -2.716

  No H/Q in entry =          11
  In of MODEL   54
    1    H    THR  92           H        THR  92   2.430  14.813   0.568
    2    HA   THR  92           HA       THR  92   2.399  17.637   0.528
    3    HB   THR  92           HB       THR  92   0.244  15.634   1.244
    4    HG1  THR  92           HG1      THR  92   0.519  15.471  -0.846
    5   HG22  THR  92          HG21      THR  92  -1.170  17.799   0.558
    6   HG21  THR  92          HG22      THR  92   0.232  18.621   1.240
    7   HG23  THR  92          HG23      THR  92  -0.694  17.492   2.227

  No H/Q in entry =           7
  In of MODEL   54
    1    H    GLU  93           H        GLU  93   1.892  15.317   3.173
    2    HA   GLU  93           HA       GLU  93   1.387  17.206   5.212
    3    HB2  GLU  93           HB2      GLU  93   2.707  14.482   5.410
    4    HB3  GLU  93           HB3      GLU  93   2.034  15.399   6.759
    5    HG2  GLU  93           HG2      GLU  93   0.387  14.636   4.339
    6    HG3  GLU  93           HG3      GLU  93   0.511  13.603   5.758

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LEU  94           H        LEU  94   4.378  15.736   4.009
    2    HA   LEU  94           HA       LEU  94   6.155  16.873   5.879
    3    HB2  LEU  94           HB2      LEU  94   6.516  15.926   3.036
    4    HB3  LEU  94           HB3      LEU  94   7.859  16.578   3.971
    5    HG   LEU  94           HG       LEU  94   6.138  14.373   5.116
    6   HD11  LEU  94          HD11      LEU  94   8.203  14.164   2.953
    7   HD13  LEU  94          HD12      LEU  94   6.762  13.187   3.228
    8   HD12  LEU  94          HD13      LEU  94   8.202  12.928   4.213
    9   HD23  LEU  94          HD21      LEU  94   8.345  13.831   6.232
   10   HD22  LEU  94          HD22      LEU  94   7.682  15.405   6.669
   11   HD21  LEU  94          HD23      LEU  94   9.004  15.294   5.507

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  95           H        ILE  95   4.968  18.065   2.754
    2    HA   ILE  95           HA       ILE  95   6.537  20.425   2.689
    3    HB   ILE  95           HB       ILE  95   3.875  19.747   1.417
    4   HG12  ILE  95          HG12      ILE  95   6.647  20.095   0.242
    5   HG13  ILE  95          HG13      ILE  95   6.007  18.538   0.755
    6   HG21  ILE  95          HG21      ILE  95   5.619  22.218   1.189
    7   HG23  ILE  95          HG22      ILE  95   3.899  22.145   1.569
    8   HG22  ILE  95          HG23      ILE  95   4.459  21.757  -0.058
    9   HD13  ILE  95          HD11      ILE  95   4.422  18.472  -0.951
   10   HD12  ILE  95          HD12      ILE  95   5.759  19.297  -1.753
   11   HD11  ILE  95          HD13      ILE  95   4.394  20.226  -1.134

  No H/Q in entry =          11
  In of MODEL   54
    1    H    GLU  96           H        GLU  96   3.308  19.760   4.026
    2    HA   GLU  96           HA       GLU  96   2.696  22.401   4.805
    3    HB2  GLU  96           HB2      GLU  96   1.024  20.616   4.828
    4    HB3  GLU  96           HB3      GLU  96   1.905  19.780   6.105
    5    HG2  GLU  96           HG2      GLU  96   0.906  21.052   7.698
    6    HG3  GLU  96           HG3      GLU  96   1.428  22.532   6.904

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LEU  97           H        LEU  97   4.564  19.841   6.385
    2    HA   LEU  97           HA       LEU  97   4.956  21.172   8.860
    3    HB2  LEU  97           HB2      LEU  97   6.475  19.014   7.409
    4    HB3  LEU  97           HB3      LEU  97   7.086  19.689   8.917
    5    HG   LEU  97           HG       LEU  97   4.273  18.596   8.639
    6   HD12  LEU  97          HD11      LEU  97   5.232  16.576   9.824
    7   HD11  LEU  97          HD12      LEU  97   6.837  17.210   9.461
    8   HD13  LEU  97          HD13      LEU  97   5.749  16.761   8.148
    9   HD23  LEU  97          HD21      LEU  97   4.763  18.284  11.194
   10   HD22  LEU  97          HD22      LEU  97   4.373  19.899  10.607
   11   HD21  LEU  97          HD23      LEU  97   6.050  19.458  10.924

  No H/Q in entry =          11
  In of MODEL   54
    1    H    HIS  98           H        HIS  98   6.783  21.211   5.808
    2    HA   HIS  98           HA       HIS  98   8.949  22.785   6.687
    3    HB2  HIS  98           HB2      HIS  98   7.616  22.548   3.978
    4    HB3  HIS  98           HB3      HIS  98   9.060  23.526   4.255
    5    HD1  HIS  98           HD1      HIS  98   7.851  19.954   4.267
    6    HD2  HIS  98           HD2      HIS  98  11.437  22.050   4.655
    7    HE1  HIS  98           HE1      HIS  98   9.705  18.226   4.171
    8    HE2  HIS  98           HE2      HIS  98  11.893  19.482   4.407

  No H/Q in entry =           8
  In of MODEL   54
    1    H    GLU  99           H        GLU  99   5.711  23.627   5.564
    2    HA   GLU  99           HA       GLU  99   6.088  26.442   5.520
    3    HB2  GLU  99           HB2      GLU  99   4.193  25.280   4.409
    4    HB3  GLU  99           HB3      GLU  99   3.520  24.908   5.995
    5    HG2  GLU  99           HG2      GLU  99   3.346  27.296   6.516
    6    HG3  GLU  99           HG3      GLU  99   4.100  27.707   4.978

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LYS 100           H        LYS 100   4.994  24.189   8.042
    2    HA   LYS 100           HA       LYS 100   4.435  26.229   9.959
    3    HB2  LYS 100           HB2      LYS 100   5.015  23.276  10.276
    4    HB3  LYS 100           HB3      LYS 100   4.587  24.339  11.622
    5    HG2  LYS 100           HG2      LYS 100   2.503  24.985  10.408
    6    HG3  LYS 100           HG3      LYS 100   2.913  23.825   9.141
    7    HD2  LYS 100           HD2      LYS 100   2.859  21.992  10.791
    8    HD3  LYS 100           HD3      LYS 100   2.467  23.146  12.069
    9    HE2  LYS 100           HE2      LYS 100   0.396  23.776  10.840
   10    HE3  LYS 100           HE3      LYS 100   0.779  22.565   9.610
   11    HZ1  LYS 100           HZ1      LYS 100   0.554  21.878  12.489
   12    HZ3  LYS 100           HZ2      LYS 100   0.520  20.833  11.147
   13    HZ2  LYS 100           HZ3      LYS 100  -0.792  21.870  11.453

  No H/Q in entry =          13
  In of MODEL   54
    1    H    LEU 101           H        LEU 101   7.346  24.440   9.071
    2    HA   LEU 101           HA       LEU 101   8.976  25.265  11.257
    3    HB2  LEU 101           HB2      LEU 101   9.530  24.298   8.464
    4    HB3  LEU 101           HB3      LEU 101  10.846  24.956   9.431
    5    HG   LEU 101           HG       LEU 101   9.030  22.792  10.506
    6   HD12  LEU 101          HD11      LEU 101  11.075  21.301   9.857
    7   HD11  LEU 101          HD12      LEU 101  11.425  22.573   8.688
    8   HD13  LEU 101          HD13      LEU 101   9.895  21.701   8.610
    9   HD21  LEU 101          HD21      LEU 101  11.764  23.895  11.202
   10   HD23  LEU 101          HD22      LEU 101  11.229  22.319  11.778
   11   HD22  LEU 101          HD23      LEU 101  10.344  23.772  12.239

  No H/Q in entry =          11
  In of MODEL   54
    1    H    LYS 102           H        LYS 102   7.363  27.143   9.152
    2    HA   LYS 102           HA       LYS 102   7.436  29.438   8.876
    3    HB2  LYS 102           HB2      LYS 102   9.031  29.308  10.950
    4    HB3  LYS 102           HB3      LYS 102  10.314  29.510   9.774
    5    HG2  LYS 102           HG2      LYS 102   8.221  31.458  10.680
    6    HG3  LYS 102           HG3      LYS 102   9.930  31.719  10.405
    7    HD2  LYS 102           HD2      LYS 102   7.946  31.313   8.131
    8    HD3  LYS 102           HD3      LYS 102   8.339  32.887   8.805
    9    HE2  LYS 102           HE2      LYS 102   9.682  31.717   6.703
   10    HE3  LYS 102           HE3      LYS 102  10.313  33.016   7.715
   11    HZ2  LYS 102           HZ1      LYS 102  11.830  31.113   7.504
   12    HZ1  LYS 102           HZ2      LYS 102  10.679  30.125   8.256
   13    HZ3  LYS 102           HZ3      LYS 102  11.384  31.406   9.115

  No H/Q in entry =          13
  In of MODEL   54
    1    H    ALA 103           H        ALA 103  10.684  28.102   8.255
    2    HA   ALA 103           HA       ALA 103  11.619  29.493   6.175
    3    HB2  ALA 103           HB1      ALA 103  12.490  27.286   5.219
    4    HB1  ALA 103           HB2      ALA 103  11.613  26.502   6.532
    5    HB3  ALA 103           HB3      ALA 103  12.908  27.643   6.895

  No H/Q in entry =           5
  In of MODEL   54
    1    H1   LYS   3           H1       LYS   3 -31.111   5.360 -20.301
    2    H2   LYS   3           H3       LYS   3 -30.096   5.026 -21.620
    3    H3   LYS   3           H2       LYS   3 -31.480   4.081 -21.353
    4    HA   LYS   3           HA       LYS   3 -30.483   2.773 -19.871
    5    HB2  LYS   3           HB2      LYS   3 -28.199   4.157 -21.229
    6    HB3  LYS   3           HB3      LYS   3 -27.878   3.012 -19.926
    7    HG2  LYS   3           HG2      LYS   3 -29.254   1.344 -21.226
    8    HG3  LYS   3           HG3      LYS   3 -29.203   2.485 -22.570
    9    HD2  LYS   3           HD2      LYS   3 -26.721   2.412 -22.474
   10    HD3  LYS   3           HD3      LYS   3 -26.841   1.166 -21.231
   11    HE2  LYS   3           HE2      LYS   3 -28.294  -0.108 -22.916
   12    HE3  LYS   3           HE3      LYS   3 -27.670   1.025 -24.114
   13    HZ3  LYS   3           HZ1      LYS   3 -25.851  -0.187 -24.298
   14    HZ2  LYS   3           HZ2      LYS   3 -26.482  -1.315 -23.196
   15    HZ1  LYS   3           HZ3      LYS   3 -25.521  -0.030 -22.639

  No H/Q in entry =          15
  In of MODEL   54
    1    H    LYS   4           H        LYS   4 -30.568   2.723 -17.807
    2    HA   LYS   4           HA       LYS   4 -29.898   5.092 -16.251
    3    HB2  LYS   4           HB2      LYS   4 -31.074   2.416 -15.449
    4    HB3  LYS   4           HB3      LYS   4 -30.891   3.808 -14.381
    5    HG2  LYS   4           HG2      LYS   4 -32.656   3.610 -16.828
    6    HG3  LYS   4           HG3      LYS   4 -33.176   3.731 -15.147
    7    HD2  LYS   4           HD2      LYS   4 -32.514   5.972 -14.971
    8    HD3  LYS   4           HD3      LYS   4 -31.450   5.865 -16.373
    9    HE2  LYS   4           HE2      LYS   4 -33.385   7.189 -16.929
   10    HE3  LYS   4           HE3      LYS   4 -33.429   5.673 -17.830
   11    HZ3  LYS   4           HZ1      LYS   4 -35.019   4.810 -16.269
   12    HZ2  LYS   4           HZ2      LYS   4 -35.583   6.269 -16.930
   13    HZ1  LYS   4           HZ3      LYS   4 -34.952   6.238 -15.353

  No H/Q in entry =          13
  In of MODEL   54
    1    H    HIS   5           H        HIS   5 -28.458   5.269 -14.640
    2    HA   HIS   5           HA       HIS   5 -26.147   3.457 -14.851
    3    HB2  HIS   5           HB2      HIS   5 -26.457   6.261 -13.775
    4    HB3  HIS   5           HB3      HIS   5 -24.964   5.328 -13.691
    5    HD1  HIS   5           HD1      HIS   5 -23.482   6.472 -15.309
    6    HD2  HIS   5           HD2      HIS   5 -27.248   5.734 -16.895
    7    HE1  HIS   5           HE1      HIS   5 -23.279   6.943 -17.780
    8    HE2  HIS   5           HE2      HIS   5 -25.576   6.482 -18.716

  No H/Q in entry =           8
  In of MODEL   54
    1    H    ILE   6           H        ILE   6 -25.922   1.949 -13.460
    2    HA   ILE   6           HA       ILE   6 -26.948   2.330 -10.728
    3    HB   ILE   6           HB       ILE   6 -26.068  -0.193 -12.138
    4   HG12  ILE   6          HG12      ILE   6 -28.836   0.747 -11.375
    5   HG13  ILE   6          HG13      ILE   6 -28.167   0.842 -13.004
    6   HG23  ILE   6          HG21      ILE   6 -26.459  -1.364 -10.228
    7   HG22  ILE   6          HG22      ILE   6 -27.640  -0.203  -9.622
    8   HG21  ILE   6          HG23      ILE   6 -25.916   0.157  -9.519
    9   HD13  ILE   6          HD11      ILE   6 -28.594  -1.303 -13.415
   10   HD12  ILE   6          HD12      ILE   6 -29.635  -1.233 -11.993
   11   HD11  ILE   6          HD13      ILE   6 -27.976  -1.815 -11.845

  No H/Q in entry =          11
  In of MODEL   54
    1    H    TYR   7           H        TYR   7 -25.218   3.049  -9.443
    2    HA   TYR   7           HA       TYR   7 -22.486   2.096 -10.033
    3    HB2  TYR   7           HB2      TYR   7 -23.501   4.583  -8.681
    4    HB3  TYR   7           HB3      TYR   7 -21.810   4.086  -8.668
    5    HD1  TYR   7           HD1      TYR   7 -22.787   2.993 -11.729
    6    HD2  TYR   7           HD2      TYR   7 -22.195   6.670  -9.657
    7    HE1  TYR   7           HE1      TYR   7 -22.333   4.131 -13.866
    8    HE2  TYR   7           HE2      TYR   7 -21.783   7.813 -11.787
    9    HH   TYR   7           HH       TYR   7 -21.962   7.623 -14.016

  No H/Q in entry =           9
  In of MODEL   54
    1    H    LEU   8           H        LEU   8 -21.528   0.817  -8.629
    2    HA   LEU   8           HA       LEU   8 -22.698   0.431  -5.944
    3    HB2  LEU   8           HB2      LEU   8 -20.946  -1.294  -7.672
    4    HB3  LEU   8           HB3      LEU   8 -21.157  -1.599  -5.949
    5    HG   LEU   8           HG       LEU   8 -23.628  -1.820  -6.403
    6   HD13  LEU   8          HD11      LEU   8 -23.735  -0.703  -8.568
    7   HD12  LEU   8          HD12      LEU   8 -24.243  -2.382  -8.740
    8   HD11  LEU   8          HD13      LEU   8 -22.631  -1.889  -9.261
    9   HD23  LEU   8          HD21      LEU   8 -22.302  -3.921  -7.980
   10   HD22  LEU   8          HD22      LEU   8 -23.411  -4.038  -6.614
   11   HD21  LEU   8          HD23      LEU   8 -21.712  -3.653  -6.340

  No H/Q in entry =          11
  In of MODEL   54
    1    H    PHE   9           H        PHE   9 -21.455   0.907  -4.152
    2    HA   PHE   9           HA       PHE   9 -18.668   1.840  -4.651
    3    HB2  PHE   9           HB2      PHE   9 -20.721   2.989  -2.763
    4    HB3  PHE   9           HB3      PHE   9 -19.016   3.418  -2.747
    5    HD1  PHE   9           HD1      PHE   9 -18.013   4.686  -4.566
    6    HD2  PHE   9           HD2      PHE   9 -22.186   3.687  -4.606
    7    HE1  PHE   9           HE1      PHE   9 -18.383   6.300  -6.408
    8    HE2  PHE   9           HE2      PHE   9 -22.557   5.313  -6.443
    9    HZ   PHE   9           HZ       PHE   9 -20.652   6.614  -7.351

  No H/Q in entry =           9
  In of MODEL   54
    1    H    SER  10           H        SER  10 -17.073   0.999  -3.412
    2    HA   SER  10           HA       SER  10 -17.358   0.213  -0.707
    3    HB2  SER  10           HB2      SER  10 -17.172  -2.183  -0.901
    4    HB3  SER  10           HB3      SER  10 -18.581  -1.666  -1.812
    5    HG   SER  10           HG       SER  10 -16.815  -3.161  -2.747

  No H/Q in entry =           5
  In of MODEL   54
    1    H    SER  11           H        SER  11 -15.353   0.194   0.196
    2    HA   SER  11           HA       SER  11 -13.116   1.018  -1.307
    3    HB2  SER  11           HB2      SER  11 -13.713   1.126   1.286
    4    HB3  SER  11           HB3      SER  11 -12.671  -0.298   1.311
    5    HG   SER  11           HG       SER  11 -11.004   0.900   0.704

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ALA  12           H        ALA  12 -14.308  -1.631  -2.124
    2    HA   ALA  12           HA       ALA  12 -11.747  -2.950  -2.525
    3    HB3  ALA  12           HB1      ALA  12 -12.407  -4.051  -0.493
    4    HB2  ALA  12           HB2      ALA  12 -12.658  -5.181  -1.823
    5    HB1  ALA  12           HB3      ALA  12 -14.034  -4.336  -1.115

  No H/Q in entry =           5
  In of MODEL   54
    1    H    GLY  13           H        GLY  13 -12.490  -1.949  -4.607
    2    HA3  GLY  13           HA2      GLY  13 -14.691  -2.731  -6.102
    3    HA2  GLY  13           HA3      GLY  13 -13.134  -2.266  -6.803

  No H/Q in entry =           3
  In of MODEL   54
    1    H    MET  14           H        MET  14 -11.640  -4.509  -5.688
    2    HA   MET  14           HA       MET  14 -11.920  -6.335  -7.777
    3    HB2  MET  14           HB2      MET  14  -9.910  -6.222  -6.289
    4    HB3  MET  14           HB3      MET  14 -10.816  -7.089  -5.051
    5    HG2  MET  14           HG2      MET  14  -9.654  -8.809  -6.157
    6    HG3  MET  14           HG3      MET  14 -11.225  -8.848  -6.956
    7    HE3  MET  14           HE1      MET  14  -7.166  -7.617  -8.568
    8    HE2  MET  14           HE2      MET  14  -7.563  -8.960  -7.498
    9    HE1  MET  14           HE3      MET  14  -7.730  -7.303  -6.920

  No H/Q in entry =           9
  In of MODEL   54
    1    H    SER  15           H        SER  15 -13.247  -6.682  -4.495
    2    HA   SER  15           HA       SER  15 -14.518  -9.199  -5.153
    3    HB2  SER  15           HB2      SER  15 -14.751  -7.397  -2.748
    4    HB3  SER  15           HB3      SER  15 -15.860  -8.741  -2.998
    5    HG   SER  15           HG       SER  15 -14.298  -9.824  -2.068

  No H/Q in entry =           5
  In of MODEL   54
    1    H    THR  16           H        THR  16 -15.623  -5.822  -4.893
    2    HA   THR  16           HA       THR  16 -18.408  -6.342  -5.430
    3    HB   THR  16           HB       THR  16 -16.839  -3.807  -6.016
    4    HG1  THR  16           HG1      THR  16 -17.919  -3.424  -3.782
    5   HG21  THR  16          HG21      THR  16 -19.177  -3.983  -6.886
    6   HG23  THR  16          HG22      THR  16 -18.985  -2.709  -5.668
    7   HG22  THR  16          HG23      THR  16 -19.728  -4.258  -5.239

  No H/Q in entry =           7
  In of MODEL   54
    1    H    SER  17           H        SER  17 -15.557  -5.813  -7.267
    2    HA   SER  17           HA       SER  17 -16.648  -5.202  -9.819
    3    HB2  SER  17           HB2      SER  17 -14.015  -6.442  -8.998
    4    HB3  SER  17           HB3      SER  17 -14.430  -6.120 -10.681
    5    HG   SER  17           HG       SER  17 -13.305  -4.465  -9.112

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LEU  18           H        LEU  18 -16.069  -8.270  -8.219
    2    HA   LEU  18           HA       LEU  18 -16.594  -9.883 -10.512
    3    HB2  LEU  18           HB2      LEU  18 -15.399 -10.731  -8.535
    4    HB3  LEU  18           HB3      LEU  18 -16.860 -10.527  -7.570
    5    HG   LEU  18           HG       LEU  18 -18.019 -12.177  -8.961
    6   HD13  LEU  18          HD11      LEU  18 -17.086 -12.070 -11.091
    7   HD12  LEU  18          HD12      LEU  18 -16.370 -13.554 -10.461
    8   HD11  LEU  18          HD13      LEU  18 -15.434 -12.061 -10.475
    9   HD21  LEU  18          HD21      LEU  18 -16.641 -12.765  -6.939
   10   HD23  LEU  18          HD22      LEU  18 -15.403 -13.323  -8.066
   11   HD22  LEU  18          HD23      LEU  18 -16.996 -14.078  -8.063

  No H/Q in entry =          11
  In of MODEL   54
    1    H    LEU  19           H        LEU  19 -18.627  -8.578  -7.895
    2    HA   LEU  19           HA       LEU  19 -21.059  -9.830  -8.716
    3    HB2  LEU  19           HB2      LEU  19 -20.830  -8.884  -6.499
    4    HB3  LEU  19           HB3      LEU  19 -20.576  -7.279  -7.182
    5    HG   LEU  19           HG       LEU  19 -22.882  -7.148  -7.865
    6   HD13  LEU  19          HD11      LEU  19 -23.328  -9.439  -8.477
    7   HD12  LEU  19          HD12      LEU  19 -24.467  -8.966  -7.216
    8   HD11  LEU  19          HD13      LEU  19 -23.076  -9.972  -6.815
    9   HD21  LEU  19          HD21      LEU  19 -22.304  -7.942  -5.041
   10   HD23  LEU  19          HD22      LEU  19 -23.934  -7.488  -5.537
   11   HD22  LEU  19          HD23      LEU  19 -22.607  -6.339  -5.713

  No H/Q in entry =          11
  In of MODEL   54
    1    H    VAL  20           H        VAL  20 -19.590  -6.685  -9.528
    2    HA   VAL  20           HA       VAL  20 -21.684  -5.743 -11.181
    3    HB   VAL  20           HB       VAL  20 -18.702  -5.121 -11.286
    4   HG13  VAL  20          HG11      VAL  20 -19.420  -4.552 -13.456
    5   HG12  VAL  20          HG12      VAL  20 -19.571  -3.041 -12.558
    6   HG11  VAL  20          HG13      VAL  20 -21.002  -4.017 -12.888
    7   HG23  VAL  20          HG21      VAL  20 -19.599  -2.905 -10.382
    8   HG22  VAL  20          HG22      VAL  20 -19.550  -4.282  -9.283
    9   HG21  VAL  20          HG23      VAL  20 -21.077  -3.801 -10.024

  No H/Q in entry =           9
  In of MODEL   54
    1    H    SER  21           H        SER  21 -18.884  -7.803 -12.064
    2    HA   SER  21           HA       SER  21 -19.620  -7.827 -14.830
    3    HB2  SER  21           HB2      SER  21 -18.155  -9.792 -15.045
    4    HB3  SER  21           HB3      SER  21 -17.358  -8.491 -14.164
    5    HG   SER  21           HG       SER  21 -16.977 -10.261 -12.991

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LYS  22           H        LYS  22 -20.705  -9.907 -12.179
    2    HA   LYS  22           HA       LYS  22 -22.192 -11.627 -13.952
    3    HB2  LYS  22           HB2      LYS  22 -21.438 -12.064 -11.492
    4    HB3  LYS  22           HB3      LYS  22 -22.929 -11.218 -11.079
    5    HG2  LYS  22           HG2      LYS  22 -24.261 -12.926 -11.772
    6    HG3  LYS  22           HG3      LYS  22 -23.128 -13.451 -13.018
    7    HD2  LYS  22           HD2      LYS  22 -21.747 -14.552 -11.413
    8    HD3  LYS  22           HD3      LYS  22 -22.638 -13.834 -10.069
    9    HE2  LYS  22           HE2      LYS  22 -23.435 -16.041 -10.178
   10    HE3  LYS  22           HE3      LYS  22 -24.683 -15.087 -10.980
   11    HZ2  LYS  22           HZ1      LYS  22 -23.688 -17.306 -11.992
   12    HZ1  LYS  22           HZ2      LYS  22 -22.599 -16.196 -12.676
   13    HZ3  LYS  22           HZ3      LYS  22 -24.265 -16.033 -12.958

  No H/Q in entry =          13
  In of MODEL   54
    1    H    MET  23           H        MET  23 -22.983  -8.632 -12.233
    2    HA   MET  23           HA       MET  23 -25.779  -8.767 -12.784
    3    HB2  MET  23           HB2      MET  23 -23.968  -6.413 -12.285
    4    HB3  MET  23           HB3      MET  23 -25.712  -6.273 -12.501
    5    HG2  MET  23           HG2      MET  23 -26.125  -7.489 -10.482
    6    HG3  MET  23           HG3      MET  23 -24.412  -7.875 -10.307
    7    HE2  MET  23           HE1      MET  23 -26.771  -4.200  -9.327
    8    HE1  MET  23           HE2      MET  23 -26.989  -5.237 -10.736
    9    HE3  MET  23           HE3      MET  23 -25.968  -3.802 -10.848

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ARG  24           H        ARG  24 -23.009  -7.390 -14.583
    2    HA   ARG  24           HA       ARG  24 -24.482  -6.198 -16.665
    3    HB2  ARG  24           HB2      ARG  24 -21.655  -7.304 -16.604
    4    HB3  ARG  24           HB3      ARG  24 -22.314  -6.461 -17.983
    5    HG2  ARG  24           HG2      ARG  24 -22.556  -4.382 -16.676
    6    HG3  ARG  24           HG3      ARG  24 -22.000  -5.239 -15.214
    7    HD2  ARG  24           HD2      ARG  24 -20.082  -4.085 -16.163
    8    HD3  ARG  24           HD3      ARG  24 -19.898  -5.810 -16.453
    9    HE   ARG  24           HE       ARG  24 -21.027  -4.985 -18.737
   10   HH21  ARG  24          HH11      ARG  24 -19.574  -5.616 -20.333
   11   HH22  ARG  24          HH12      ARG  24 -17.937  -5.065 -20.267
   12   HH11  ARG  24          HH21      ARG  24 -18.387  -3.770 -17.004
   13   HH12  ARG  24          HH22      ARG  24 -17.247  -3.965 -18.299

  No H/Q in entry =          13
  In of MODEL   54
    1    H    ALA  25           H        ALA  25 -23.333  -9.508 -16.219
    2    HA   ALA  25           HA       ALA  25 -23.905 -10.464 -18.826
    3    HB1  ALA  25           HB1      ALA  25 -23.203 -12.456 -18.027
    4    HB3  ALA  25           HB2      ALA  25 -24.286 -12.382 -16.637
    5    HB2  ALA  25           HB3      ALA  25 -22.740 -11.537 -16.594

  No H/Q in entry =           5
  In of MODEL   54
    1    H    GLN  26           H        GLN  26 -25.786 -10.385 -15.837
    2    HA   GLN  26           HA       GLN  26 -28.100 -11.656 -16.840
    3    HB2  GLN  26           HB2      GLN  26 -27.648  -9.798 -14.526
    4    HB3  GLN  26           HB3      GLN  26 -29.196 -10.552 -14.870
    5    HG2  GLN  26           HG2      GLN  26 -26.607 -11.960 -14.291
    6    HG3  GLN  26           HG3      GLN  26 -27.989 -11.821 -13.211
    7   HE21  GLN  26          HE21      GLN  26 -26.728 -14.028 -14.367
    8   HE22  GLN  26          HE22      GLN  26 -27.747 -15.121 -15.134

  No H/Q in entry =           8
  In of MODEL   54
    1    H    ALA  27           H        ALA  27 -27.204  -8.235 -16.584
    2    HA   ALA  27           HA       ALA  27 -29.689  -7.203 -17.462
    3    HB1  ALA  27           HB1      ALA  27 -27.912  -5.822 -16.374
    4    HB3  ALA  27           HB2      ALA  27 -28.482  -5.128 -17.893
    5    HB2  ALA  27           HB3      ALA  27 -26.938  -5.979 -17.837

  No H/Q in entry =           5
  In of MODEL   54
    1    H    GLU  28           H        GLU  28 -26.942  -8.481 -19.225
    2    HA   GLU  28           HA       GLU  28 -27.840  -7.563 -21.804
    3    HB2  GLU  28           HB2      GLU  28 -25.467  -8.194 -21.108
    4    HB3  GLU  28           HB3      GLU  28 -25.993  -9.871 -21.246
    5    HG2  GLU  28           HG2      GLU  28 -24.818  -9.172 -23.226
    6    HG3  GLU  28           HG3      GLU  28 -26.506  -9.527 -23.590

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LYS  29           H        LYS  29 -28.009 -10.594 -20.015
    2    HA   LYS  29           HA       LYS  29 -29.262 -12.164 -21.976
    3    HB2  LYS  29           HB2      LYS  29 -28.241 -13.048 -19.912
    4    HB3  LYS  29           HB3      LYS  29 -29.537 -12.311 -18.972
    5    HG2  LYS  29           HG2      LYS  29 -31.165 -13.745 -20.008
    6    HG3  LYS  29           HG3      LYS  29 -29.940 -14.417 -21.082
    7    HD2  LYS  29           HD2      LYS  29 -28.820 -15.495 -19.279
    8    HD3  LYS  29           HD3      LYS  29 -29.757 -14.608 -18.078
    9    HE2  LYS  29           HE2      LYS  29 -30.482 -16.978 -18.349
   10    HE3  LYS  29           HE3      LYS  29 -31.765 -15.810 -18.669
   11    HZ1  LYS  29           HZ1      LYS  29 -31.155 -16.045 -21.077
   12    HZ3  LYS  29           HZ2      LYS  29 -31.874 -17.408 -20.365
   13    HZ2  LYS  29           HZ3      LYS  29 -30.200 -17.376 -20.633

  No H/Q in entry =          13
  In of MODEL   54
    1    H    TYR  30           H        TYR  30 -30.719  -9.964 -19.593
    2    HA   TYR  30           HA       TYR  30 -33.353 -10.493 -20.862
    3    HB2  TYR  30           HB2      TYR  30 -32.761  -9.216 -18.182
    4    HB3  TYR  30           HB3      TYR  30 -34.365  -9.517 -18.852
    5    HD1  TYR  30           HD1      TYR  30 -35.250 -11.825 -18.982
    6    HD2  TYR  30           HD2      TYR  30 -31.453 -10.992 -17.242
    7    HE1  TYR  30           HE1      TYR  30 -35.154 -14.115 -18.081
    8    HE2  TYR  30           HE2      TYR  30 -31.359 -13.267 -16.347
    9    HH   TYR  30           HH       TYR  30 -32.957 -15.690 -17.365

  No H/Q in entry =           9
  In of MODEL   54
    1    H    GLU  31           H        GLU  31 -31.192  -8.518 -21.709
    2    HA   GLU  31           HA       GLU  31 -31.122  -6.398 -22.624
    3    HB2  GLU  31           HB2      GLU  31 -34.001  -7.165 -23.157
    4    HB3  GLU  31           HB3      GLU  31 -33.160  -5.822 -23.930
    5    HG2  GLU  31           HG2      GLU  31 -31.652  -7.295 -25.031
    6    HG3  GLU  31           HG3      GLU  31 -32.220  -8.674 -24.092

  No H/Q in entry =           6
  In of MODEL   54
    1    H    VAL  32           H        VAL  32 -31.373  -6.179 -19.903
    2    HA   VAL  32           HA       VAL  32 -33.267  -4.059 -19.371
    3    HB   VAL  32           HB       VAL  32 -30.895  -4.958 -17.705
    4   HG12  VAL  32          HG11      VAL  32 -32.473  -4.068 -15.875
    5   HG11  VAL  32          HG12      VAL  32 -33.292  -3.229 -17.193
    6   HG13  VAL  32          HG13      VAL  32 -31.594  -2.893 -16.856
    7   HG21  VAL  32          HG21      VAL  32 -32.633  -6.725 -18.349
    8   HG23  VAL  32          HG22      VAL  32 -33.703  -5.858 -17.245
    9   HG22  VAL  32          HG23      VAL  32 -32.189  -6.542 -16.652

  No H/Q in entry =           9
  In of MODEL   54
    1    HA   PRO  33           HA       PRO  33 -30.235  -1.173 -21.116
    2    HB2  PRO  33           HB2      PRO  33 -31.771   1.035 -21.117
    3    HB3  PRO  33           HB3      PRO  33 -32.205  -0.319 -22.161
    4    HG2  PRO  33           HG2      PRO  33 -33.231   0.309 -19.393
    5    HG3  PRO  33           HG3      PRO  33 -34.167   0.027 -20.861
    6    HD2  PRO  33           HD2      PRO  33 -33.720  -1.966 -19.097
    7    HD3  PRO  33           HD3      PRO  33 -33.747  -2.284 -20.833

  No H/Q in entry =           7
  In of MODEL   54
    1    H    VAL  34           H        VAL  34 -29.002  -1.618 -19.124
    2    HA   VAL  34           HA       VAL  34 -28.774   0.880 -17.578
    3    HB   VAL  34           HB       VAL  34 -28.213  -0.490 -15.568
    4   HG12  VAL  34          HG11      VAL  34 -30.621  -1.376 -15.267
    5   HG11  VAL  34          HG12      VAL  34 -30.916  -0.688 -16.862
    6   HG13  VAL  34          HG13      VAL  34 -30.400   0.352 -15.536
    7   HG21  VAL  34          HG21      VAL  34 -28.340  -2.603 -17.489
    8   HG23  VAL  34          HG22      VAL  34 -29.418  -2.917 -16.128
    9   HG22  VAL  34          HG23      VAL  34 -27.707  -2.599 -15.842

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ILE  35           H        ILE  35 -26.818   1.374 -16.723
    2    HA   ILE  35           HA       ILE  35 -24.476   0.019 -17.886
    3    HB   ILE  35           HB       ILE  35 -24.924   2.936 -17.209
    4   HG12  ILE  35          HG12      ILE  35 -23.880   1.531 -19.676
    5   HG13  ILE  35          HG13      ILE  35 -25.522   2.143 -19.472
    6   HG21  ILE  35          HG21      ILE  35 -22.339   1.422 -17.404
    7   HG23  ILE  35          HG22      ILE  35 -22.830   2.648 -16.236
    8   HG22  ILE  35          HG23      ILE  35 -22.423   3.115 -17.888
    9   HD11  ILE  35          HD11      ILE  35 -24.156   4.378 -18.942
   10   HD13  ILE  35          HD12      ILE  35 -24.659   3.918 -20.570
   11   HD12  ILE  35          HD13      ILE  35 -23.013   3.590 -20.029

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ILE  36           H        ILE  36 -23.264  -0.920 -16.221
    2    HA   ILE  36           HA       ILE  36 -23.764  -0.187 -13.389
    3    HB   ILE  36           HB       ILE  36 -22.886  -2.924 -14.363
    4   HG12  ILE  36          HG12      ILE  36 -25.716  -2.120 -13.685
    5   HG13  ILE  36          HG13      ILE  36 -25.113  -2.165 -15.342
    6   HG23  ILE  36          HG21      ILE  36 -23.266  -3.665 -12.222
    7   HG22  ILE  36          HG22      ILE  36 -24.416  -2.378 -11.859
    8   HG21  ILE  36          HG23      ILE  36 -22.687  -2.028 -11.914
    9   HD13  ILE  36          HD11      ILE  36 -25.250  -4.388 -15.455
   10   HD12  ILE  36          HD12      ILE  36 -26.342  -4.219 -14.081
   11   HD11  ILE  36          HD13      ILE  36 -24.643  -4.608 -13.814

  No H/Q in entry =          11
  In of MODEL   54
    1    H    GLU  37           H        GLU  37 -22.011   0.512 -12.281
    2    HA   GLU  37           HA       GLU  37 -19.295  -0.291 -13.114
    3    HB2  GLU  37           HB2      GLU  37 -20.219   2.518 -12.528
    4    HB3  GLU  37           HB3      GLU  37 -18.529   2.028 -12.658
    5    HG2  GLU  37           HG2      GLU  37 -20.548   1.898 -14.880
    6    HG3  GLU  37           HG3      GLU  37 -19.365   3.185 -14.649

  No H/Q in entry =           6
  In of MODEL   54
    1    H    ALA  38           H        ALA  38 -17.836  -0.437 -11.397
    2    HA   ALA  38           HA       ALA  38 -18.919  -0.151  -8.655
    3    HB1  ALA  38           HB1      ALA  38 -17.157  -2.128  -9.964
    4    HB3  ALA  38           HB2      ALA  38 -18.229  -2.316  -8.576
    5    HB2  ALA  38           HB3      ALA  38 -16.629  -1.604  -8.365

  No H/Q in entry =           5
  In of MODEL   54
    1    H    PHE  39           H        PHE  39 -17.721   1.137  -7.214
    2    HA   PHE  39           HA       PHE  39 -15.196   2.333  -8.117
    3    HB2  PHE  39           HB2      PHE  39 -17.430   3.957  -6.906
    4    HB3  PHE  39           HB3      PHE  39 -15.873   4.547  -7.484
    5    HD1  PHE  39           HD1      PHE  39 -15.447   4.872  -9.816
    6    HD2  PHE  39           HD2      PHE  39 -19.189   3.349  -8.451
    7    HE1  PHE  39           HE1      PHE  39 -16.431   5.324 -12.046
    8    HE2  PHE  39           HE2      PHE  39 -20.182   3.788 -10.669
    9    HZ   PHE  39           HZ       PHE  39 -18.802   4.747 -12.482

  No H/Q in entry =           9
  In of MODEL   54
    1    HA   PRO  40           HA       PRO  40 -14.325   1.779  -3.786
    2    HB2  PRO  40           HB2      PRO  40 -12.595   3.838  -3.235
    3    HB3  PRO  40           HB3      PRO  40 -12.116   2.472  -4.242
    4    HG2  PRO  40           HG2      PRO  40 -13.171   5.159  -5.115
    5    HG3  PRO  40           HG3      PRO  40 -11.717   4.324  -5.657
    6    HD2  PRO  40           HD2      PRO  40 -13.910   4.129  -7.109
    7    HD3  PRO  40           HD3      PRO  40 -12.938   2.684  -6.833

  No H/Q in entry =           7
  In of MODEL   54
    1    H    GLU  41           H        GLU  41 -14.998   2.839  -1.712
    2    HA   GLU  41           HA       GLU  41 -17.266   4.508  -1.809
    3    HB2  GLU  41           HB2      GLU  41 -17.290   4.380   0.508
    4    HB3  GLU  41           HB3      GLU  41 -16.434   2.905   0.054
    5    HG2  GLU  41           HG2      GLU  41 -15.183   5.461   1.057
    6    HG3  GLU  41           HG3      GLU  41 -15.392   3.970   1.976

  No H/Q in entry =           6
  In of MODEL   54
    1    H    THR  42           H        THR  42 -13.948   5.471  -1.842
    2    HA   THR  42           HA       THR  42 -14.358   8.077  -0.750
    3    HB   THR  42           HB       THR  42 -12.189   8.635  -1.803
    4    HG1  THR  42           HG1      THR  42 -12.266   7.535  -3.707
    5   HG21  THR  42          HG21      THR  42 -12.537   7.055   0.297
    6   HG23  THR  42          HG22      THR  42 -10.930   7.317  -0.382
    7   HG22  THR  42          HG23      THR  42 -11.825   5.852  -0.778

  No H/Q in entry =           7
  In of MODEL   54
    1    H    LEU  43           H        LEU  43 -15.191   6.835  -3.815
    2    HA   LEU  43           HA       LEU  43 -15.465   9.559  -4.910
    3    HB2  LEU  43           HB2      LEU  43 -15.773   6.850  -6.195
    4    HB3  LEU  43           HB3      LEU  43 -15.979   8.394  -7.021
    5    HG   LEU  43           HG       LEU  43 -13.388   7.327  -5.926
    6   HD12  LEU  43          HD11      LEU  43 -14.171   7.738  -8.802
    7   HD11  LEU  43          HD12      LEU  43 -14.392   6.197  -7.975
    8   HD13  LEU  43          HD13      LEU  43 -12.775   6.872  -8.161
    9   HD22  LEU  43          HD21      LEU  43 -13.163   9.639  -5.841
   10   HD21  LEU  43          HD22      LEU  43 -14.211   9.894  -7.238
   11   HD23  LEU  43          HD23      LEU  43 -12.577   9.271  -7.463

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ALA  44           H        ALA  44 -17.418   7.787  -3.013
    2    HA   ALA  44           HA       ALA  44 -19.870   7.551  -4.371
    3    HB2  ALA  44           HB1      ALA  44 -19.753   6.530  -2.225
    4    HB3  ALA  44           HB2      ALA  44 -20.884   7.869  -2.032
    5    HB1  ALA  44           HB3      ALA  44 -19.226   8.026  -1.455

  No H/Q in entry =           5
  In of MODEL   54
    1    H    GLY  45           H        GLY  45 -18.518  10.438  -2.938
    2    HA3  GLY  45           HA2      GLY  45 -20.970  11.883  -3.407
    3    HA2  GLY  45           HA3      GLY  45 -19.445  12.556  -2.831

  No H/Q in entry =           3
  In of MODEL   54
    1    H    GLU  46           H        GLU  46 -17.859  11.543  -5.051
    2    HA   GLU  46           HA       GLU  46 -18.496  13.669  -6.927
    3    HB2  GLU  46           HB2      GLU  46 -16.276  11.618  -6.852
    4    HB3  GLU  46           HB3      GLU  46 -16.399  12.920  -8.035
    5    HG2  GLU  46           HG2      GLU  46 -16.114  13.302  -5.062
    6    HG3  GLU  46           HG3      GLU  46 -14.793  13.395  -6.228

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LYS  47           H        LYS  47 -18.318  10.137  -7.204
    2    HA   LYS  47           HA       LYS  47 -19.370  10.223  -9.906
    3    HB2  LYS  47           HB2      LYS  47 -18.205   8.216  -8.114
    4    HB3  LYS  47           HB3      LYS  47 -19.550   7.610  -9.081
    5    HG2  LYS  47           HG2      LYS  47 -17.462   7.183 -10.201
    6    HG3  LYS  47           HG3      LYS  47 -18.402   8.365 -11.110
    7    HD2  LYS  47           HD2      LYS  47 -17.097  10.174 -10.058
    8    HD3  LYS  47           HD3      LYS  47 -16.125   8.962  -9.226
    9    HE2  LYS  47           HE2      LYS  47 -16.396   9.119 -12.218
   10    HE3  LYS  47           HE3      LYS  47 -15.096   9.887 -11.309
   11    HZ1  LYS  47           HZ1      LYS  47 -15.692   7.011 -11.045
   12    HZ3  LYS  47           HZ2      LYS  47 -14.274   7.842 -10.620
   13    HZ2  LYS  47           HZ3      LYS  47 -14.660   7.601 -12.257

  No H/Q in entry =          13
  In of MODEL   54
    1    H    GLY  48           H        GLY  48 -20.739   9.585  -6.751
    2    HA3  GLY  48           HA2      GLY  48 -23.093   8.332  -7.481
    3    HA2  GLY  48           HA3      GLY  48 -22.909   9.392  -6.083

  No H/Q in entry =           3
  In of MODEL   54
    1    H    GLN  49           H        GLN  49 -22.332  11.752  -7.749
    2    HA   GLN  49           HA       GLN  49 -24.903  12.818  -7.987
    3    HB2  GLN  49           HB2      GLN  49 -22.348  13.659  -9.339
    4    HB3  GLN  49           HB3      GLN  49 -23.825  14.605  -9.323
    5    HG2  GLN  49           HG2      GLN  49 -23.710  14.738  -6.887
    6    HG3  GLN  49           HG3      GLN  49 -22.245  13.770  -6.901
    7   HE21  GLN  49          HE21      GLN  49 -22.183  16.055  -5.726
    8   HE22  GLN  49          HE22      GLN  49 -21.267  17.294  -6.412

  No H/Q in entry =           8
  In of MODEL   54
    1    H    ASN  50           H        ASN  50 -23.155  10.860 -10.259
    2    HA   ASN  50           HA       ASN  50 -25.013  11.612 -12.410
    3    HB2  ASN  50           HB2      ASN  50 -22.407  10.102 -12.531
    4    HB3  ASN  50           HB3      ASN  50 -23.439  10.453 -13.909
    5   HD21  ASN  50          HD21      ASN  50 -20.844  11.407 -12.291
    6   HD22  ASN  50          HD22      ASN  50 -20.627  13.030 -12.701

  No H/Q in entry =           6
  In of MODEL   54
    1    H    ALA  51           H        ALA  51 -25.006   9.357 -10.063
    2    HA   ALA  51           HA       ALA  51 -25.727   7.122 -11.806
    3    HB2  ALA  51           HB1      ALA  51 -25.156   5.858 -10.052
    4    HB3  ALA  51           HB2      ALA  51 -26.308   6.697  -9.015
    5    HB1  ALA  51           HB3      ALA  51 -24.675   7.332  -9.211

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ASP  52           H        ASP  52 -27.720   6.045 -11.655
    2    HA   ASP  52           HA       ASP  52 -29.937   7.875 -11.109
    3    HB2  ASP  52           HB2      ASP  52 -29.683   5.302 -12.663
    4    HB3  ASP  52           HB3      ASP  52 -31.245   6.032 -12.288

  No H/Q in entry =           4
  In of MODEL   54
    1    H    VAL  53           H        VAL  53 -28.317   5.056  -9.939
    2    HA   VAL  53           HA       VAL  53 -29.803   5.273  -7.457
    3    HB   VAL  53           HB       VAL  53 -31.159   3.559  -8.651
    4   HG11  VAL  53          HG11      VAL  53 -29.373   2.658 -10.103
    5   HG13  VAL  53          HG12      VAL  53 -30.205   1.391  -9.202
    6   HG12  VAL  53          HG13      VAL  53 -28.611   1.937  -8.687
    7   HG23  VAL  53          HG21      VAL  53 -30.341   1.670  -6.859
    8   HG22  VAL  53          HG22      VAL  53 -31.494   2.973  -6.570
    9   HG21  VAL  53          HG23      VAL  53 -29.797   3.186  -6.141

  No H/Q in entry =           9
  In of MODEL   54
    1    H    VAL  54           H        VAL  54 -28.515   4.931  -5.762
    2    HA   VAL  54           HA       VAL  54 -25.735   4.094  -6.286
    3    HB   VAL  54           HB       VAL  54 -26.867   5.954  -4.137
    4   HG11  VAL  54          HG11      VAL  54 -24.266   4.558  -4.319
    5   HG13  VAL  54          HG12      VAL  54 -25.053   5.290  -2.922
    6   HG12  VAL  54          HG13      VAL  54 -24.141   6.296  -4.046
    7   HG22  VAL  54          HG21      VAL  54 -26.011   7.729  -5.299
    8   HG21  VAL  54          HG22      VAL  54 -26.522   6.674  -6.616
    9   HG23  VAL  54          HG23      VAL  54 -24.823   6.740  -6.150

  No H/Q in entry =           9
  In of MODEL   54
    1    H    LEU  55           H        LEU  55 -25.130   2.210  -5.549
    2    HA   LEU  55           HA       LEU  55 -26.661   0.976  -3.345
    3    HB2  LEU  55           HB2      LEU  55 -25.048  -0.271  -5.559
    4    HB3  LEU  55           HB3      LEU  55 -25.821  -1.158  -4.244
    5    HG   LEU  55           HG       LEU  55 -27.238   0.316  -6.454
    6   HD13  LEU  55          HD11      LEU  55 -26.894  -1.584  -7.585
    7   HD12  LEU  55          HD12      LEU  55 -27.861  -2.418  -6.370
    8   HD11  LEU  55          HD13      LEU  55 -26.110  -2.324  -6.191
    9   HD23  LEU  55          HD21      LEU  55 -28.542  -1.563  -4.537
   10   HD22  LEU  55          HD22      LEU  55 -29.239  -0.229  -5.458
   11   HD21  LEU  55          HD23      LEU  55 -28.248   0.102  -4.037

  No H/Q in entry =          11
  In of MODEL   54
    1    H    LEU  56           H        LEU  56 -25.535   0.477  -1.495
    2    HA   LEU  56           HA       LEU  56 -22.605   0.907  -1.511
    3    HB2  LEU  56           HB2      LEU  56 -24.448   0.778   0.863
    4    HB3  LEU  56           HB3      LEU  56 -22.744   1.229   0.863
    5    HG   LEU  56           HG       LEU  56 -25.046   2.834  -0.215
    6   HD11  LEU  56          HD11      LEU  56 -23.971   2.577   2.339
    7   HD13  LEU  56          HD12      LEU  56 -24.969   3.910   1.757
    8   HD12  LEU  56          HD13      LEU  56 -23.212   4.033   1.695
    9   HD23  LEU  56          HD21      LEU  56 -23.118   4.547  -0.449
   10   HD22  LEU  56          HD22      LEU  56 -23.463   3.389  -1.732
   11   HD21  LEU  56          HD23      LEU  56 -22.126   3.100  -0.622

  No H/Q in entry =          11
  In of MODEL   54
    1    H    GLY  57           H        GLY  57 -21.215  -0.680  -0.881
    2    HA3  GLY  57           HA2      GLY  57 -22.103  -3.384  -0.975
    3    HA2  GLY  57           HA3      GLY  57 -20.494  -2.849  -0.494

  No H/Q in entry =           3
  In of MODEL   54
    1    HA   PRO  58           HA       PRO  58 -23.357  -3.759   3.211
    2    HB2  PRO  58           HB2      PRO  58 -22.652  -6.326   3.944
    3    HB3  PRO  58           HB3      PRO  58 -24.024  -5.980   2.890
    4    HG2  PRO  58           HG2      PRO  58 -21.272  -6.860   2.191
    5    HG3  PRO  58           HG3      PRO  58 -22.818  -7.369   1.513
    6    HD2  PRO  58           HD2      PRO  58 -21.210  -5.586   0.241
    7    HD3  PRO  58           HD3      PRO  58 -22.968  -5.527   0.104

  No H/Q in entry =           7
  In of MODEL   54
    1    H    GLN  59           H        GLN  59 -19.971  -4.215   2.685
    2    HA   GLN  59           HA       GLN  59 -19.265  -4.102   5.457
    3    HB2  GLN  59           HB2      GLN  59 -17.563  -3.184   3.141
    4    HB3  GLN  59           HB3      GLN  59 -17.022  -3.664   4.737
    5    HG2  GLN  59           HG2      GLN  59 -16.513  -5.521   3.485
    6    HG3  GLN  59           HG3      GLN  59 -18.091  -5.953   4.124
    7   HE21  GLN  59          HE21      GLN  59 -18.826  -7.007   2.642
    8   HE22  GLN  59          HE22      GLN  59 -19.223  -6.900   1.030

  No H/Q in entry =           8
  In of MODEL   54
    1    H    ILE  60           H        ILE  60 -20.188  -1.662   3.123
    2    HA   ILE  60           HA       ILE  60 -19.397   0.392   5.094
    3    HB   ILE  60           HB       ILE  60 -19.632   2.036   3.180
    4   HG12  ILE  60          HG12      ILE  60 -19.322  -0.281   1.317
    5   HG13  ILE  60          HG13      ILE  60 -20.938   0.241   1.797
    6   HG21  ILE  60          HG21      ILE  60 -17.480   1.246   3.983
    7   HG23  ILE  60          HG22      ILE  60 -17.461   1.564   2.248
    8   HG22  ILE  60          HG23      ILE  60 -17.548  -0.095   2.840
    9   HD12  ILE  60          HD11      ILE  60 -18.896   1.678   0.143
   10   HD11  ILE  60          HD12      ILE  60 -20.073   2.611   1.067
   11   HD13  ILE  60          HD13      ILE  60 -20.621   1.458  -0.151

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ALA  61           H        ALA  61 -21.834  -1.218   5.190
    2    HA   ALA  61           HA       ALA  61 -24.070   0.397   4.619
    3    HB1  ALA  61           HB1      ALA  61 -25.292  -1.048   5.987
    4    HB2  ALA  61           HB2      ALA  61 -23.908  -1.375   7.031
    5    HB3  ALA  61           HB3      ALA  61 -23.967  -2.055   5.405

  No H/Q in entry =           5
  In of MODEL   54
    1    H    TYR  62           H        TYR  62 -21.913   0.436   7.457
    2    HA   TYR  62           HA       TYR  62 -23.517   2.145   9.025
    3    HB2  TYR  62           HB2      TYR  62 -21.502   2.651  10.273
    4    HB3  TYR  62           HB3      TYR  62 -21.535   0.930   9.887
    5    HD1  TYR  62           HD1      TYR  62 -19.946  -0.014   8.237
    6    HD2  TYR  62           HD2      TYR  62 -19.761   4.102   9.369
    7    HE1  TYR  62           HE1      TYR  62 -17.717   0.167   7.199
    8    HE2  TYR  62           HE2      TYR  62 -17.518   4.278   8.332
    9    HH   TYR  62           HH       TYR  62 -15.680   2.781   7.738

  No H/Q in entry =           9
  In of MODEL   54
    1    H    MET  63           H        MET  63 -21.833   2.897   6.163
    2    HA   MET  63           HA       MET  63 -21.709   5.760   6.734
    3    HB2  MET  63           HB2      MET  63 -21.045   4.138   4.276
    4    HB3  MET  63           HB3      MET  63 -20.867   5.890   4.391
    5    HG2  MET  63           HG2      MET  63 -19.184   5.622   6.114
    6    HG3  MET  63           HG3      MET  63 -19.380   3.871   6.050
    7    HE1  MET  63           HE1      MET  63 -18.809   6.979   4.303
    8    HE3  MET  63           HE2      MET  63 -18.843   6.445   2.623
    9    HE2  MET  63           HE3      MET  63 -17.297   6.727   3.427

  No H/Q in entry =           9
  In of MODEL   54
    1    H    LEU  64           H        LEU  64 -24.236   3.835   5.807
    2    HA   LEU  64           HA       LEU  64 -25.424   5.146   3.648
    3    HB2  LEU  64           HB2      LEU  64 -26.285   3.073   4.643
    4    HB3  LEU  64           HB3      LEU  64 -26.777   3.974   6.077
    5    HG   LEU  64           HG       LEU  64 -28.464   5.154   4.765
    6   HD13  LEU  64          HD11      LEU  64 -28.144   5.300   2.529
    7   HD12  LEU  64          HD12      LEU  64 -28.769   3.653   2.445
    8   HD11  LEU  64          HD13      LEU  64 -27.030   3.933   2.521
    9   HD23  LEU  64          HD21      LEU  64 -28.940   2.305   4.132
   10   HD22  LEU  64          HD22      LEU  64 -29.955   3.467   4.985
   11   HD21  LEU  64          HD23      LEU  64 -28.586   2.724   5.810

  No H/Q in entry =          11
  In of MODEL   54
    1    HA   PRO  65           HA       PRO  65 -27.685   8.394   6.219
    2    HB2  PRO  65           HB2      PRO  65 -25.726   8.673   8.498
    3    HB3  PRO  65           HB3      PRO  65 -27.468   8.937   8.502
    4    HG2  PRO  65           HG2      PRO  65 -26.532   6.736   9.543
    5    HG3  PRO  65           HG3      PRO  65 -27.933   6.641   8.476
    6    HD2  PRO  65           HD2      PRO  65 -25.043   6.027   7.851
    7    HD3  PRO  65           HD3      PRO  65 -26.483   5.106   7.418

  No H/Q in entry =           7
  In of MODEL   54
    1    H    GLU  66           H        GLU  66 -24.130   8.379   6.356
    2    HA   GLU  66           HA       GLU  66 -23.854  11.160   5.832
    3    HB2  GLU  66           HB2      GLU  66 -22.006   8.845   5.315
    4    HB3  GLU  66           HB3      GLU  66 -21.569  10.531   5.040
    5    HG2  GLU  66           HG2      GLU  66 -21.826  11.004   7.386
    6    HG3  GLU  66           HG3      GLU  66 -22.340   9.343   7.682

  No H/Q in entry =           6
  In of MODEL   54
    1    H    ILE  67           H        ILE  67 -23.889   8.316   3.703
    2    HA   ILE  67           HA       ILE  67 -23.449   9.926   1.344
    3    HB   ILE  67           HB       ILE  67 -24.323   7.022   1.636
    4   HG12  ILE  67          HG12      ILE  67 -21.689   8.175   0.708
    5   HG13  ILE  67          HG13      ILE  67 -22.009   7.828   2.407
    6   HG21  ILE  67          HG21      ILE  67 -24.244   8.800  -0.668
    7   HG23  ILE  67          HG22      ILE  67 -24.856   7.150  -0.556
    8   HG22  ILE  67          HG23      ILE  67 -23.144   7.437  -0.867
    9   HD12  ILE  67          HD11      ILE  67 -21.532   5.958   0.145
   10   HD11  ILE  67          HD12      ILE  67 -22.564   5.435   1.474
   11   HD13  ILE  67          HD13      ILE  67 -20.901   5.929   1.791

  No H/Q in entry =          11
  In of MODEL   54
    1    H    GLN  68           H        GLN  68 -26.337   8.918   2.972
    2    HA   GLN  68           HA       GLN  68 -28.139   9.745   0.928
    3    HB2  GLN  68           HB2      GLN  68 -28.444   9.516   3.920
    4    HB3  GLN  68           HB3      GLN  68 -29.752  10.056   2.878
    5    HG2  GLN  68           HG2      GLN  68 -29.740   7.971   1.694
    6    HG3  GLN  68           HG3      GLN  68 -28.301   7.443   2.544
    7   HE21  GLN  68          HE21      GLN  68 -30.466   6.061   2.433
    8   HE22  GLN  68          HE22      GLN  68 -31.316   5.661   3.852

  No H/Q in entry =           8
  In of MODEL   54
    1    H    ARG  69           H        ARG  69 -26.594  11.543   3.616
    2    HA   ARG  69           HA       ARG  69 -27.970  13.995   3.078
    3    HB2  ARG  69           HB2      ARG  69 -25.647  13.154   4.746
    4    HB3  ARG  69           HB3      ARG  69 -25.732  14.855   4.311
    5    HG2  ARG  69           HG2      ARG  69 -28.065  14.923   5.240
    6    HG3  ARG  69           HG3      ARG  69 -27.853  13.258   5.791
    7    HD2  ARG  69           HD2      ARG  69 -26.194  15.663   6.629
    8    HD3  ARG  69           HD3      ARG  69 -27.333  14.793   7.643
    9    HE   ARG  69           HE       ARG  69 -24.699  13.841   6.781
   10   HH21  ARG  69          HH11      ARG  69 -23.898  12.138   8.067
   11   HH22  ARG  69          HH12      ARG  69 -24.941  11.364   9.212
   12   HH11  ARG  69          HH21      ARG  69 -27.680  13.346   8.450
   13   HH12  ARG  69          HH22      ARG  69 -27.082  12.046   9.427

  No H/Q in entry =          13
  In of MODEL   54
    1    H    LEU  70           H        LEU  70 -25.066  12.552   1.831
    2    HA   LEU  70           HA       LEU  70 -23.949  14.871   0.578
    3    HB2  LEU  70           HB2      LEU  70 -22.950  12.589   1.292
    4    HB3  LEU  70           HB3      LEU  70 -23.534  12.050  -0.282
    5    HG   LEU  70           HG       LEU  70 -21.932  13.386  -1.400
    6   HD11  LEU  70          HD11      LEU  70 -21.162  14.356   1.362
    7   HD13  LEU  70          HD12      LEU  70 -21.843  15.329   0.058
    8   HD12  LEU  70          HD13      LEU  70 -20.224  14.651  -0.104
    9   HD22  LEU  70          HD21      LEU  70 -20.492  11.690  -1.068
   10   HD21  LEU  70          HD22      LEU  70 -21.439  11.224   0.345
   11   HD23  LEU  70          HD23      LEU  70 -20.063  12.314   0.526

  No H/Q in entry =          11
  In of MODEL   54
    1    H    LEU  71           H        LEU  71 -26.067  12.267  -0.461
    2    HA   LEU  71           HA       LEU  71 -26.558  13.639  -3.048
    3    HB2  LEU  71           HB2      LEU  71 -26.754  10.677  -2.474
    4    HB3  LEU  71           HB3      LEU  71 -26.862  11.468  -4.046
    5    HG   LEU  71           HG       LEU  71 -24.370  11.570  -2.345
    6   HD12  LEU  71          HD11      LEU  71 -24.372   9.836  -4.704
    7   HD11  LEU  71          HD12      LEU  71 -25.402   9.264  -3.392
    8   HD13  LEU  71          HD13      LEU  71 -23.689   9.565  -3.101
    9   HD22  LEU  71          HD21      LEU  71 -24.457  13.318  -3.918
   10   HD21  LEU  71          HD22      LEU  71 -24.927  12.215  -5.212
   11   HD23  LEU  71          HD23      LEU  71 -23.316  12.107  -4.501

  No H/Q in entry =          11
  In of MODEL   54
    1    HA   PRO  72           HA       PRO  72 -30.466  13.284  -0.475
    2    HB2  PRO  72           HB2      PRO  72 -31.333  15.835  -0.683
    3    HB3  PRO  72           HB3      PRO  72 -30.041  15.438   0.449
    4    HG2  PRO  72           HG2      PRO  72 -29.813  16.512  -2.350
    5    HG3  PRO  72           HG3      PRO  72 -29.075  17.132  -0.875
    6    HD2  PRO  72           HD2      PRO  72 -27.700  15.504  -2.547
    7    HD3  PRO  72           HD3      PRO  72 -27.475  15.415  -0.802

  No H/Q in entry =           7
  In of MODEL   54
    1    H    ASN  73           H        ASN  73 -29.792  14.100  -3.718
    2    HA   ASN  73           HA       ASN  73 -32.639  13.751  -4.383
    3    HB2  ASN  73           HB2      ASN  73 -32.143  14.767  -6.519
    4    HB3  ASN  73           HB3      ASN  73 -31.646  15.808  -5.194
    5   HD21  ASN  73          HD21      ASN  73 -30.806  15.739  -7.857
    6   HD22  ASN  73          HD22      ASN  73 -29.134  15.577  -8.014

  No H/Q in entry =           6
  In of MODEL   54
    1    H    LYS  74           H        LYS  74 -30.659  11.525  -3.826
    2    HA   LYS  74           HA       LYS  74 -31.178  10.018  -6.320
    3    HB2  LYS  74           HB2      LYS  74 -28.673   9.806  -4.645
    4    HB3  LYS  74           HB3      LYS  74 -29.028   8.927  -6.132
    5    HG2  LYS  74           HG2      LYS  74 -28.775  11.904  -6.056
    6    HG3  LYS  74           HG3      LYS  74 -27.393  10.833  -6.291
    7    HD2  LYS  74           HD2      LYS  74 -28.474   9.817  -8.209
    8    HD3  LYS  74           HD3      LYS  74 -29.902  10.823  -7.958
    9    HE2  LYS  74           HE2      LYS  74 -28.674  12.812  -8.467
   10    HE3  LYS  74           HE3      LYS  74 -27.150  11.924  -8.493
   11    HZ2  LYS  74           HZ1      LYS  74 -28.586  12.428 -10.668
   12    HZ1  LYS  74           HZ2      LYS  74 -29.243  10.922 -10.239
   13    HZ3  LYS  74           HZ3      LYS  74 -27.574  11.074 -10.515

  No H/Q in entry =          13
  In of MODEL   54
    1    HA   PRO  75           HA       PRO  75 -32.617   7.161  -3.245
    2    HB2  PRO  75           HB2      PRO  75 -32.893   4.874  -4.733
    3    HB3  PRO  75           HB3      PRO  75 -34.022   6.222  -4.881
    4    HG2  PRO  75           HG2      PRO  75 -31.652   5.554  -6.584
    5    HG3  PRO  75           HG3      PRO  75 -33.294   5.967  -7.078
    6    HD2  PRO  75           HD2      PRO  75 -31.358   7.838  -7.084
    7    HD3  PRO  75           HD3      PRO  75 -32.999   8.256  -6.592

  No H/Q in entry =           7
  In of MODEL   54
    1    H    VAL  76           H        VAL  76 -31.184   6.172  -1.802
    2    HA   VAL  76           HA       VAL  76 -28.698   4.921  -2.812
    3    HB   VAL  76           HB       VAL  76 -29.035   6.503  -0.228
    4   HG11  VAL  76          HG11      VAL  76 -26.653   5.162  -1.521
    5   HG13  VAL  76          HG12      VAL  76 -27.375   4.779   0.043
    6   HG12  VAL  76          HG13      VAL  76 -26.529   6.309  -0.186
    7   HG22  VAL  76          HG21      VAL  76 -28.356   8.364  -1.187
    8   HG21  VAL  76          HG22      VAL  76 -28.870   7.601  -2.691
    9   HG23  VAL  76          HG23      VAL  76 -27.177   7.537  -2.204

  No H/Q in entry =           9
  In of MODEL   54
    1    H    GLU  77           H        GLU  77 -28.487   2.797  -2.102
    2    HA   GLU  77           HA       GLU  77 -29.319   2.125   0.570
    3    HB2  GLU  77           HB2      GLU  77 -30.913   0.452   0.085
    4    HB3  GLU  77           HB3      GLU  77 -31.453   1.941  -0.692
    5    HG2  GLU  77           HG2      GLU  77 -30.805   1.089  -2.833
    6    HG3  GLU  77           HG3      GLU  77 -30.171  -0.375  -2.085

  No H/Q in entry =           6
  In of MODEL   54
    1    H    VAL  78           H        VAL  78 -28.998   0.071   1.327
    2    HA   VAL  78           HA       VAL  78 -26.316  -0.731   0.520
    3    HB   VAL  78           HB       VAL  78 -28.062  -1.515   2.892
    4   HG11  VAL  78          HG11      VAL  78 -25.701  -2.785   1.863
    5   HG13  VAL  78          HG12      VAL  78 -26.632  -3.195   3.305
    6   HG12  VAL  78          HG13      VAL  78 -25.318  -2.024   3.407
    7   HG22  VAL  78          HG21      VAL  78 -26.630  -0.090   4.194
    8   HG21  VAL  78          HG22      VAL  78 -27.346   0.820   2.864
    9   HG23  VAL  78          HG23      VAL  78 -25.665   0.292   2.768

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ILE  79           H        ILE  79 -25.758  -2.676  -0.291
    2    HA   ILE  79           HA       ILE  79 -27.792  -4.218  -1.607
    3    HB   ILE  79           HB       ILE  79 -24.804  -4.725  -1.311
    4   HG12  ILE  79          HG12      ILE  79 -26.403  -3.729  -3.674
    5   HG13  ILE  79          HG13      ILE  79 -25.552  -2.666  -2.551
    6   HG22  ILE  79          HG21      ILE  79 -25.863  -6.010  -3.594
    7   HG21  ILE  79          HG22      ILE  79 -26.870  -6.474  -2.222
    8   HG23  ILE  79          HG23      ILE  79 -25.128  -6.746  -2.169
    9   HD13  ILE  79          HD11      ILE  79 -24.106  -2.856  -4.339
   10   HD12  ILE  79          HD12      ILE  79 -24.437  -4.576  -4.549
   11   HD11  ILE  79          HD13      ILE  79 -23.478  -4.023  -3.175

  No H/Q in entry =          11
  In of MODEL   54
    1    H    ASP  80           H        ASP  80 -28.661  -6.117  -0.954
    2    HA   ASP  80           HA       ASP  80 -28.652  -6.898   1.730
    3    HB2  ASP  80           HB2      ASP  80 -30.376  -7.552   0.088
    4    HB3  ASP  80           HB3      ASP  80 -29.200  -8.593  -0.715

  No H/Q in entry =           4
  In of MODEL   54
    1    H    SER  81           H        SER  81 -27.134  -7.977   2.937
    2    HA   SER  81           HA       SER  81 -24.616  -8.703   1.819
    3    HB2  SER  81           HB2      SER  81 -24.034  -9.524   4.019
    4    HB3  SER  81           HB3      SER  81 -24.933  -8.017   4.206
    5    HG   SER  81           HG       SER  81 -26.213  -9.094   5.409

  No H/Q in entry =           5
  In of MODEL   54
    1    H    LEU  82           H        LEU  82 -27.327 -10.787   2.188
    2    HA   LEU  82           HA       LEU  82 -25.764 -13.171   1.800
    3    HB2  LEU  82           HB2      LEU  82 -28.696 -12.576   1.467
    4    HB3  LEU  82           HB3      LEU  82 -27.986 -14.184   1.340
    5    HG   LEU  82           HG       LEU  82 -27.967 -12.494   3.821
    6   HD11  LEU  82          HD11      LEU  82 -29.680 -14.863   3.028
    7   HD13  LEU  82          HD12      LEU  82 -30.239 -13.201   3.224
    8   HD12  LEU  82          HD13      LEU  82 -29.657 -14.107   4.622
    9   HD23  LEU  82          HD21      LEU  82 -27.388 -14.846   4.728
   10   HD22  LEU  82          HD22      LEU  82 -26.125 -13.943   3.892
   11   HD21  LEU  82          HD23      LEU  82 -26.991 -15.230   3.052

  No H/Q in entry =          11
  In of MODEL   54
    1    H    LEU  83           H        LEU  83 -27.694 -11.039  -0.250
    2    HA   LEU  83           HA       LEU  83 -27.447 -12.507  -2.654
    3    HB2  LEU  83           HB2      LEU  83 -27.875  -9.574  -2.144
    4    HB3  LEU  83           HB3      LEU  83 -27.876 -10.291  -3.755
    5    HG   LEU  83           HG       LEU  83 -29.947 -10.587  -1.598
    6   HD13  LEU  83          HD11      LEU  83 -30.688  -8.792  -2.757
    7   HD12  LEU  83          HD12      LEU  83 -31.126  -9.963  -3.999
    8   HD11  LEU  83          HD13      LEU  83 -29.593  -9.097  -4.103
    9   HD23  LEU  83          HD21      LEU  83 -30.035 -11.967  -4.266
   10   HD22  LEU  83          HD22      LEU  83 -31.029 -12.255  -2.839
   11   HD21  LEU  83          HD23      LEU  83 -29.339 -12.755  -2.852

  No H/Q in entry =          11
  In of MODEL   54
    1    H    TYR  84           H        TYR  84 -25.528 -10.043  -1.052
    2    HA   TYR  84           HA       TYR  84 -23.630  -9.645  -3.170
    3    HB2  TYR  84           HB2      TYR  84 -24.202  -8.091  -1.194
    4    HB3  TYR  84           HB3      TYR  84 -23.142  -9.131  -0.244
    5    HD1  TYR  84           HD1      TYR  84 -20.804  -8.846  -0.296
    6    HD2  TYR  84           HD2      TYR  84 -23.225  -6.903  -3.228
    7    HE1  TYR  84           HE1      TYR  84 -18.825  -7.591  -1.081
    8    HE2  TYR  84           HE2      TYR  84 -21.254  -5.651  -4.030
    9    HH   TYR  84           HH       TYR  84 -19.107  -5.085  -3.530

  No H/Q in entry =           9
  In of MODEL   54
    1    H    GLY  85           H        GLY  85 -23.437 -11.512  -0.134
    2    HA3  GLY  85           HA2      GLY  85 -20.850 -12.469  -0.529
    3    HA2  GLY  85           HA3      GLY  85 -22.095 -13.277   0.424

  No H/Q in entry =           3
  In of MODEL   54
    1    H    LYS  86           H        LYS  86 -23.904 -13.747  -1.649
    2    HA   LYS  86           HA       LYS  86 -22.824 -16.173  -2.781
    3    HB2  LYS  86           HB2      LYS  86 -25.069 -16.074  -1.895
    4    HB3  LYS  86           HB3      LYS  86 -25.471 -14.738  -2.973
    5    HG2  LYS  86           HG2      LYS  86 -26.507 -16.771  -3.710
    6    HG3  LYS  86           HG3      LYS  86 -25.291 -16.245  -4.876
    7    HD2  LYS  86           HD2      LYS  86 -23.694 -17.817  -4.036
    8    HD3  LYS  86           HD3      LYS  86 -24.721 -18.212  -2.659
    9    HE2  LYS  86           HE2      LYS  86 -26.382 -19.178  -4.170
   10    HE3  LYS  86           HE3      LYS  86 -25.364 -18.773  -5.551
   11    HZ1  LYS  86           HZ1      LYS  86 -23.628 -20.092  -4.021
   12    HZ3  LYS  86           HZ2      LYS  86 -24.580 -20.839  -5.214
   13    HZ2  LYS  86           HZ3      LYS  86 -25.064 -20.890  -3.588

  No H/Q in entry =          13
  In of MODEL   54
    1    H    VAL  87           H        VAL  87 -22.804 -13.000  -3.819
    2    HA   VAL  87           HA       VAL  87 -22.475 -11.915  -5.806
    3    HB   VAL  87           HB       VAL  87 -21.382 -14.473  -7.008
    4   HG12  VAL  87          HG11      VAL  87 -20.179 -11.717  -7.125
    5   HG11  VAL  87          HG12      VAL  87 -21.550 -12.128  -8.156
    6   HG13  VAL  87          HG13      VAL  87 -20.043 -13.033  -8.289
    7   HG22  VAL  87          HG21      VAL  87 -19.239 -14.089  -5.931
    8   HG21  VAL  87          HG22      VAL  87 -20.492 -14.390  -4.730
    9   HG23  VAL  87          HG23      VAL  87 -19.922 -12.747  -5.015

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ASP  88           H        ASP  88 -24.994 -12.549  -5.468
    2    HA   ASP  88           HA       ASP  88 -26.072 -13.875  -7.827
    3    HB2  ASP  88           HB2      ASP  88 -27.106 -14.018  -5.512
    4    HB3  ASP  88           HB3      ASP  88 -27.562 -12.325  -5.696

  No H/Q in entry =           4
  In of MODEL   54
    1    H    GLY  89           H        GLY  89 -25.343 -12.690  -9.511
    2    HA3  GLY  89           HA2      GLY  89 -25.528  -9.930  -9.840
    3    HA2  GLY  89           HA3      GLY  89 -25.478 -11.111 -11.148

  No H/Q in entry =           3
  In of MODEL   54
    1    H    LEU  90           H        LEU  90 -27.928 -12.451 -10.680
    2    HA   LEU  90           HA       LEU  90 -29.725 -10.574 -11.910
    3    HB2  LEU  90           HB2      LEU  90 -29.774 -12.994 -12.382
    4    HB3  LEU  90           HB3      LEU  90 -30.306 -13.287 -10.727
    5    HG   LEU  90           HG       LEU  90 -32.422 -12.196 -11.175
    6   HD13  LEU  90          HD11      LEU  90 -32.222 -10.522 -12.725
    7   HD12  LEU  90          HD12      LEU  90 -32.740 -11.811 -13.814
    8   HD11  LEU  90          HD13      LEU  90 -31.029 -11.405 -13.679
    9   HD23  LEU  90          HD21      LEU  90 -32.307 -13.934 -13.533
   10   HD22  LEU  90          HD22      LEU  90 -33.309 -14.036 -12.087
   11   HD21  LEU  90          HD23      LEU  90 -31.654 -14.643 -12.056

  No H/Q in entry =          11
  In of MODEL   54
    1    H    GLY  91           H        GLY  91 -29.606 -11.929  -8.659
    2    HA3  GLY  91           HA2      GLY  91 -31.965 -10.779  -7.709
    3    HA2  GLY  91           HA3      GLY  91 -30.588 -11.264  -6.721

  No H/Q in entry =           3
  In of MODEL   54
    1    H    VAL  92           H        VAL  92 -28.661  -9.470  -7.628
    2    HA   VAL  92           HA       VAL  92 -29.484  -7.105  -6.198
    3    HB   VAL  92           HB       VAL  92 -26.911  -7.636  -7.728
    4   HG12  VAL  92          HG11      VAL  92 -27.120  -5.648  -5.493
    5   HG11  VAL  92          HG12      VAL  92 -27.762  -5.177  -7.068
    6   HG13  VAL  92          HG13      VAL  92 -26.066  -5.633  -6.907
    7   HG22  VAL  92          HG21      VAL  92 -26.709  -9.148  -6.062
    8   HG21  VAL  92          HG22      VAL  92 -27.875  -8.325  -5.025
    9   HG23  VAL  92          HG23      VAL  92 -26.221  -7.724  -5.146

  No H/Q in entry =           9
  In of MODEL   54
    1    H    LEU  93           H        LEU  93 -29.020  -7.918  -9.577
    2    HA   LEU  93           HA       LEU  93 -29.358  -5.330 -10.631
    3    HB2  LEU  93           HB2      LEU  93 -28.686  -7.246 -11.996
    4    HB3  LEU  93           HB3      LEU  93 -30.278  -7.969 -11.767
    5    HG   LEU  93           HG       LEU  93 -31.277  -6.064 -12.995
    6   HD11  LEU  93          HD11      LEU  93 -29.440  -4.439 -12.534
    7   HD13  LEU  93          HD12      LEU  93 -29.851  -4.549 -14.247
    8   HD12  LEU  93          HD13      LEU  93 -28.406  -5.351 -13.635
    9   HD23  LEU  93          HD21      LEU  93 -30.199  -6.729 -15.237
   10   HD22  LEU  93          HD22      LEU  93 -31.052  -7.947 -14.289
   11   HD21  LEU  93          HD23      LEU  93 -29.288  -7.885 -14.265

  No H/Q in entry =          11
  In of MODEL   54
    1    H    LYS  94           H        LYS  94 -31.739  -7.844  -9.706
    2    HA   LYS  94           HA       LYS  94 -34.077  -6.442 -10.433
    3    HB2  LYS  94           HB2      LYS  94 -33.589  -8.531  -8.317
    4    HB3  LYS  94           HB3      LYS  94 -35.184  -7.855  -8.642
    5    HG2  LYS  94           HG2      LYS  94 -35.057  -8.734 -10.937
    6    HG3  LYS  94           HG3      LYS  94 -33.499  -9.465 -10.550
    7    HD2  LYS  94           HD2      LYS  94 -34.644 -10.719  -8.684
    8    HD3  LYS  94           HD3      LYS  94 -36.181 -10.103  -9.293
    9    HE2  LYS  94           HE2      LYS  94 -35.625 -11.131 -11.507
   10    HE3  LYS  94           HE3      LYS  94 -34.219 -11.876 -10.745
   11    HZ3  LYS  94           HZ1      LYS  94 -36.061 -13.412 -10.877
   12    HZ2  LYS  94           HZ2      LYS  94 -37.054 -12.348  -9.998
   13    HZ1  LYS  94           HZ3      LYS  94 -35.702 -13.058  -9.255

  No H/Q in entry =          13
  In of MODEL   54
    1    H    ALA  95           H        ALA  95 -32.302  -6.417  -7.354
    2    HA   ALA  95           HA       ALA  95 -34.181  -4.779  -5.977
    3    HB2  ALA  95           HB1      ALA  95 -31.811  -6.118  -5.341
    4    HB3  ALA  95           HB2      ALA  95 -32.811  -5.166  -4.245
    5    HB1  ALA  95           HB3      ALA  95 -31.452  -4.412  -5.079

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ALA  96           H        ALA  96 -31.509  -4.011  -8.068
    2    HA   ALA  96           HA       ALA  96 -31.433  -1.216  -7.418
    3    HB2  ALA  96           HB1      ALA  96 -30.037  -1.080  -9.513
    4    HB3  ALA  96           HB2      ALA  96 -30.331  -2.802  -9.760
    5    HB1  ALA  96           HB3      ALA  96 -29.441  -2.255  -8.340

  No H/Q in entry =           5
  In of MODEL   54
    1    H    VAL  97           H        VAL  97 -32.916  -3.056 -10.049
    2    HA   VAL  97           HA       VAL  97 -33.971  -0.819 -11.425
    3    HB   VAL  97           HB       VAL  97 -34.772  -3.745 -11.348
    4   HG11  VAL  97          HG11      VAL  97 -36.562  -1.769 -11.953
    5   HG13  VAL  97          HG12      VAL  97 -36.604  -3.395 -12.638
    6   HG12  VAL  97          HG13      VAL  97 -35.841  -2.082 -13.532
    7   HG21  VAL  97          HG21      VAL  97 -33.465  -2.007 -13.443
    8   HG23  VAL  97          HG22      VAL  97 -33.909  -3.701 -13.663
    9   HG22  VAL  97          HG23      VAL  97 -32.681  -3.256 -12.476

  No H/Q in entry =           9
  In of MODEL   54
    1    H    ALA  98           H        ALA  98 -35.190  -2.885  -8.812
    2    HA   ALA  98           HA       ALA  98 -37.759  -1.727  -8.555
    3    HB1  ALA  98           HB1      ALA  98 -36.758  -3.876  -7.408
    4    HB3  ALA  98           HB2      ALA  98 -37.955  -2.913  -6.538
    5    HB2  ALA  98           HB3      ALA  98 -36.241  -2.745  -6.157

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ALA  99           H        ALA  99 -34.708  -0.849  -6.895
    2    HA   ALA  99           HA       ALA  99 -35.866   1.204  -5.343
    3    HB1  ALA  99           HB1      ALA  99 -33.205   0.288  -6.006
    4    HB2  ALA  99           HB2      ALA  99 -33.780   1.103  -4.551
    5    HB3  ALA  99           HB3      ALA  99 -33.284   2.049  -5.954

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ILE 100           H        ILE 100 -34.772   1.187  -8.683
    2    HA   ILE 100           HA       ILE 100 -34.950   4.023  -9.032
    3    HB   ILE 100           HB       ILE 100 -35.009   1.775 -11.074
    4   HG12  ILE 100          HG12      ILE 100 -32.857   3.798 -10.457
    5   HG13  ILE 100          HG13      ILE 100 -32.903   2.181  -9.755
    6   HG21  ILE 100          HG21      ILE 100 -35.431   4.686 -11.341
    7   HG23  ILE 100          HG22      ILE 100 -35.917   3.368 -12.408
    8   HG22  ILE 100          HG23      ILE 100 -34.265   3.982 -12.463
    9   HD12  ILE 100          HD11      ILE 100 -32.326   3.015 -12.560
   10   HD11  ILE 100          HD12      ILE 100 -32.990   1.412 -12.244
   11   HD13  ILE 100          HD13      ILE 100 -31.456   1.888 -11.520

  No H/Q in entry =          11
  In of MODEL   54
    1    H    LYS 101           H        LYS 101 -37.229   1.381  -9.679
    2    HA   LYS 101           HA       LYS 101 -39.295   2.982 -10.783
    3    HB2  LYS 101           HB2      LYS 101 -39.197   0.261  -9.533
    4    HB3  LYS 101           HB3      LYS 101 -40.743   1.004  -9.937
    5    HG2  LYS 101           HG2      LYS 101 -40.232   1.038 -12.229
    6    HG3  LYS 101           HG3      LYS 101 -38.540   0.646 -11.930
    7    HD2  LYS 101           HD2      LYS 101 -39.775  -1.301 -12.751
    8    HD3  LYS 101           HD3      LYS 101 -39.173  -1.558 -11.113
    9    HE2  LYS 101           HE2      LYS 101 -41.244  -2.233 -10.609
   10    HE3  LYS 101           HE3      LYS 101 -41.701  -0.531 -10.695
   11    HZ3  LYS 101           HZ1      LYS 101 -42.558  -0.782 -12.818
   12    HZ2  LYS 101           HZ2      LYS 101 -43.030  -2.224 -12.053
   13    HZ1  LYS 101           HZ3      LYS 101 -41.706  -2.222 -13.117

  No H/Q in entry =          13
  In of MODEL   54
    1    H    LYS 102           H        LYS 102 -38.855   1.648  -7.506
    2    HA   LYS 102           HA       LYS 102 -41.122   2.893  -6.399
    3    HB2  LYS 102           HB2      LYS 102 -39.902   1.074  -5.281
    4    HB3  LYS 102           HB3      LYS 102 -38.516   2.140  -5.062
    5    HG2  LYS 102           HG2      LYS 102 -39.858   3.598  -3.650
    6    HG3  LYS 102           HG3      LYS 102 -41.246   2.535  -3.872
    7    HD2  LYS 102           HD2      LYS 102 -40.037   0.717  -2.745
    8    HD3  LYS 102           HD3      LYS 102 -38.648   1.783  -2.522
    9    HE2  LYS 102           HE2      LYS 102 -40.025   3.319  -1.201
   10    HE3  LYS 102           HE3      LYS 102 -41.432   2.285  -1.448
   11    HZ1  LYS 102           HZ1      LYS 102 -39.727   0.578  -0.340
   12    HZ3  LYS 102           HZ2      LYS 102 -40.853   1.502   0.533
   13    HZ2  LYS 102           HZ3      LYS 102 -39.241   2.022   0.409

  No H/Q in entry =          13
  In of MODEL   54
    1    H    ALA 103           H        ALA 103 -38.152   4.241  -7.423
    2    HA   ALA 103           HA       ALA 103 -38.405   6.631  -5.748
    3    HB2  ALA 103           HB1      ALA 103 -36.389   7.299  -7.321
    4    HB3  ALA 103           HB2      ALA 103 -36.346   5.565  -7.643
    5    HB1  ALA 103           HB3      ALA 103 -36.147   6.162  -5.995

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ALA 104           H        ALA 104 -38.970   5.754  -9.068
    2    HA   ALA 104           HA       ALA 104 -39.546   8.509  -9.821
    3    HB2  ALA 104           HB1      ALA 104 -39.553   7.745 -11.993
    4    HB1  ALA 104           HB2      ALA 104 -40.285   6.199 -11.559
    5    HB3  ALA 104           HB3      ALA 104 -38.569   6.477 -11.263

  No H/Q in entry =           5
  In of MODEL   54
    1    H    ALA 105           H        ALA 105 -41.183   6.483  -7.954
    2    HA   ALA 105           HA       ALA 105 -43.609   7.874  -8.028
    3    HB2  ALA 105           HB1      ALA 105 -44.319   6.924 -10.038
    4    HB3  ALA 105           HB2      ALA 105 -44.974   5.786  -8.862
    5    HB1  ALA 105           HB3      ALA 105 -43.489   5.400  -9.730

  No H/Q in entry =           5
  In of MODEL   55
    1    H1   ALA   1           H3       ALA   1 -12.313 -15.628  -2.423
    2    H2   ALA   1           H2       ALA   1 -11.379 -16.775  -3.266
    3    H3   ALA   1           H1       ALA   1 -12.517 -15.821  -4.097
    4    HA   ALA   1           HA       ALA   1 -13.926 -17.514  -3.860
    5    HB3  ALA   1           HB1      ALA   1 -12.541 -19.295  -3.402
    6    HB1  ALA   1           HB2      ALA   1 -13.296 -19.180  -1.812
    7    HB2  ALA   1           HB3      ALA   1 -11.716 -18.449  -2.092

  No H/Q in entry =           7
  In of MODEL   55
    1    H    GLU   2           H        GLU   2 -15.554 -18.361  -2.207
    2    HA   GLU   2           HA       GLU   2 -17.191 -16.632  -1.144
    3    HB2  GLU   2           HB2      GLU   2 -16.266 -19.066   0.396
    4    HB3  GLU   2           HB3      GLU   2 -17.785 -18.207   0.652
    5    HG2  GLU   2           HG2      GLU   2 -18.772 -19.285  -1.084
    6    HG3  GLU   2           HG3      GLU   2 -17.447 -18.890  -2.168

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLU   3           H        GLU   3 -15.286 -18.002   1.476
    2    HA   GLU   3           HA       GLU   3 -15.493 -15.650   3.037
    3    HB2  GLU   3           HB2      GLU   3 -13.923 -18.207   3.283
    4    HB3  GLU   3           HB3      GLU   3 -13.683 -16.891   4.432
    5    HG2  GLU   3           HG2      GLU   3 -15.877 -17.030   5.251
    6    HG3  GLU   3           HG3      GLU   3 -16.477 -17.824   3.801

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LEU   4           H        LEU   4 -12.547 -17.144   1.643
    2    HA   LEU   4           HA       LEU   4 -10.701 -15.254   2.244
    3    HB2  LEU   4           HB2      LEU   4 -10.941 -16.545  -0.483
    4    HB3  LEU   4           HB3      LEU   4  -9.484 -15.835   0.202
    5    HG   LEU   4           HG       LEU   4 -10.993 -18.225   1.311
    6   HD13  LEU   4          HD11      LEU   4  -9.369 -19.589   0.379
    7   HD12  LEU   4          HD12      LEU   4  -8.151 -18.314   0.354
    8   HD11  LEU   4          HD13      LEU   4  -9.440 -18.325  -0.848
    9   HD23  LEU   4          HD21      LEU   4  -8.742 -18.305   2.692
   10   HD22  LEU   4          HD22      LEU   4 -10.056 -17.258   3.224
   11   HD21  LEU   4          HD23      LEU   4  -8.689 -16.576   2.342

  No H/Q in entry =          11
  In of MODEL   55
    1    H    GLU   5           H        GLU   5 -13.035 -15.028  -0.429
    2    HA   GLU   5           HA       GLU   5 -12.017 -12.549  -1.426
    3    HB2  GLU   5           HB2      GLU   5 -13.385 -14.144  -2.774
    4    HB3  GLU   5           HB3      GLU   5 -14.781 -13.728  -1.780
    5    HG2  GLU   5           HG2      GLU   5 -14.897 -12.356  -3.751
    6    HG3  GLU   5           HG3      GLU   5 -14.395 -11.311  -2.421

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLU   6           H        GLU   6 -14.747 -13.413   0.665
    2    HA   GLU   6           HA       GLU   6 -15.634 -10.731   1.069
    3    HB2  GLU   6           HB2      GLU   6 -17.084 -12.696   1.466
    4    HB3  GLU   6           HB3      GLU   6 -16.045 -13.181   2.805
    5    HG2  GLU   6           HG2      GLU   6 -16.529 -11.065   3.962
    6    HG3  GLU   6           HG3      GLU   6 -17.548 -10.555   2.619

  No H/Q in entry =           6
  In of MODEL   55
    1    H    VAL   7           H        VAL   7 -13.340 -12.859   2.637
    2    HA   VAL   7           HA       VAL   7 -12.863 -11.291   4.967
    3    HB   VAL   7           HB       VAL   7 -11.173 -13.343   3.513
    4   HG11  VAL   7          HG11      VAL   7 -10.695 -11.818   6.080
    5   HG13  VAL   7          HG12      VAL   7  -9.596 -12.037   4.719
    6   HG12  VAL   7          HG13      VAL   7  -9.958 -13.393   5.786
    7   HG21  VAL   7          HG21      VAL   7 -13.427 -13.895   4.732
    8   HG23  VAL   7          HG22      VAL   7 -12.498 -13.630   6.208
    9   HG22  VAL   7          HG23      VAL   7 -12.013 -14.891   5.077

  No H/Q in entry =           9
  In of MODEL   55
    1    H    VAL   8           H        VAL   8 -11.353 -11.410   1.756
    2    HA   VAL   8           HA       VAL   8  -9.278  -9.552   2.252
    3    HB   VAL   8           HB       VAL   8 -10.731 -10.358  -0.268
    4   HG13  VAL   8          HG11      VAL   8 -10.060  -8.120  -0.728
    5   HG12  VAL   8          HG12      VAL   8  -8.778  -9.127  -1.405
    6   HG11  VAL   8          HG13      VAL   8  -8.539  -8.317   0.143
    7   HG23  VAL   8          HG21      VAL   8  -7.940 -10.899  -0.355
    8   HG22  VAL   8          HG22      VAL   8  -9.241 -12.068  -0.152
    9   HG21  VAL   8          HG23      VAL   8  -8.466 -11.365   1.263

  No H/Q in entry =           9
  In of MODEL   55
    1    H    MET   9           H        MET   9 -12.621  -9.138   1.093
    2    HA   MET   9           HA       MET   9 -12.540  -6.361   0.663
    3    HB2  MET   9           HB2      MET   9 -14.762  -8.230   1.481
    4    HB3  MET   9           HB3      MET   9 -15.037  -6.498   1.286
    5    HG2  MET   9           HG2      MET   9 -14.644  -6.553  -1.005
    6    HG3  MET   9           HG3      MET   9 -13.633  -7.995  -0.898
    7    HE1  MET   9           HE1      MET   9 -17.178  -6.639  -0.125
    8    HE3  MET   9           HE2      MET   9 -16.881  -7.790   1.175
    9    HE2  MET   9           HE3      MET   9 -18.146  -8.115  -0.007

  No H/Q in entry =           9
  In of MODEL   55
    1    H    GLY  10           H        GLY  10 -13.215  -8.253   3.587
    2    HA3  GLY  10           HA2      GLY  10 -13.749  -6.068   5.310
    3    HA2  GLY  10           HA3      GLY  10 -13.195  -7.661   5.821

  No H/Q in entry =           3
  In of MODEL   55
    1    H    LEU  11           H        LEU  11 -10.750  -7.798   4.506
    2    HA   LEU  11           HA       LEU  11  -9.041  -6.378   6.265
    3    HB2  LEU  11           HB2      LEU  11  -8.503  -7.801   3.655
    4    HB3  LEU  11           HB3      LEU  11  -7.229  -7.105   4.655
    5    HG   LEU  11           HG       LEU  11  -9.243  -9.128   5.668
    6   HD13  LEU  11          HD11      LEU  11  -8.028 -10.369   4.101
    7   HD12  LEU  11          HD12      LEU  11  -7.095 -10.616   5.576
    8   HD11  LEU  11          HD13      LEU  11  -6.547  -9.452   4.370
    9   HD22  LEU  11          HD21      LEU  11  -8.384  -8.123   7.586
   10   HD21  LEU  11          HD22      LEU  11  -6.843  -7.729   6.824
   11   HD23  LEU  11          HD23      LEU  11  -7.179  -9.385   7.331

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  12           H        ILE  12  -9.940  -5.820   2.876
    2    HA   ILE  12           HA       ILE  12  -8.235  -3.599   2.453
    3    HB   ILE  12           HB       ILE  12 -10.892  -4.253   1.156
    4   HG12  ILE  12          HG12      ILE  12  -8.862  -5.914   1.080
    5   HG13  ILE  12          HG13      ILE  12  -9.726  -5.553  -0.401
    6   HG22  ILE  12          HG21      ILE  12  -9.961  -2.864  -0.732
    7   HG21  ILE  12          HG22      ILE  12  -8.662  -2.359   0.341
    8   HG23  ILE  12          HG23      ILE  12 -10.315  -1.964   0.711
    9   HD12  ILE  12          HD11      ILE  12  -7.223  -5.513  -0.617
   10   HD11  ILE  12          HD12      ILE  12  -7.200  -4.150   0.501
   11   HD13  ILE  12          HD13      ILE  12  -7.986  -3.996  -1.052

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  13           H        ILE  13 -11.598  -3.850   3.546
    2    HA   ILE  13           HA       ILE  13 -12.043  -1.061   3.820
    3    HB   ILE  13           HB       ILE  13 -13.260  -3.476   5.178
    4   HG12  ILE  13          HG12      ILE  13 -13.480  -2.926   2.641
    5   HG13  ILE  13          HG13      ILE  13 -14.907  -3.385   3.545
    6   HG22  ILE  13          HG21      ILE  13 -15.160  -1.772   5.683
    7   HG21  ILE  13          HG22      ILE  13 -13.917  -0.543   5.490
    8   HG23  ILE  13          HG23      ILE  13 -13.749  -1.775   6.738
    9   HD11  ILE  13          HD11      ILE  13 -14.200  -0.477   3.365
   10   HD13  ILE  13          HD12      ILE  13 -15.763  -1.244   3.560
   11   HD12  ILE  13          HD13      ILE  13 -14.982  -1.271   1.995

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ASN  14           H        ASN  14 -10.945  -3.560   6.091
    2    HA   ASN  14           HA       ASN  14 -10.736  -1.927   8.379
    3    HB2  ASN  14           HB2      ASN  14 -10.496  -4.535   8.053
    4    HB3  ASN  14           HB3      ASN  14  -8.785  -4.156   7.897
    5   HD21  ASN  14          HD21      ASN  14  -9.429  -5.680  10.070
    6   HD22  ASN  14          HD22      ASN  14  -9.397  -4.763  11.496

  No H/Q in entry =           6
  In of MODEL   55
    1    H    SER  15           H        SER  15  -8.337  -2.758   5.886
    2    HA   SER  15           HA       SER  15  -6.187  -1.277   6.961
    3    HB2  SER  15           HB2      SER  15  -5.169  -1.492   4.801
    4    HB3  SER  15           HB3      SER  15  -6.128  -2.950   5.027
    5    HG   SER  15           HG       SER  15  -6.955  -2.350   3.183

  No H/Q in entry =           5
  In of MODEL   55
    1    H    GLY  16           H        GLY  16  -8.784  -0.395   4.715
    2    HA3  GLY  16           HA2      GLY  16  -7.915   2.243   4.167
    3    HA2  GLY  16           HA3      GLY  16  -9.568   1.655   4.004

  No H/Q in entry =           3
  In of MODEL   55
    1    H    GLN  17           H        GLN  17 -10.115   0.929   6.653
    2    HA   GLN  17           HA       GLN  17 -10.812   3.434   7.797
    3    HB2  GLN  17           HB2      GLN  17 -10.724   0.649   8.971
    4    HB3  GLN  17           HB3      GLN  17 -11.342   2.050   9.847
    5    HG2  GLN  17           HG2      GLN  17 -12.371   1.130   7.147
    6    HG3  GLN  17           HG3      GLN  17 -13.141   0.752   8.687
    7   HE21  GLN  17          HE21      GLN  17 -13.565   2.771   6.168
    8   HE22  GLN  17          HE22      GLN  17 -14.160   4.146   6.966

  No H/Q in entry =           8
  In of MODEL   55
    1    H    ALA  18           H        ALA  18  -8.192   1.142   8.413
    2    HA   ALA  18           HA       ALA  18  -7.091   2.351  10.686
    3    HB2  ALA  18           HB1      ALA  18  -6.488   0.135   9.316
    4    HB3  ALA  18           HB2      ALA  18  -5.323   0.912  10.388
    5    HB1  ALA  18           HB3      ALA  18  -5.244   1.193   8.647

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ARG  19           H        ARG  19  -6.317   2.877   7.238
    2    HA   ARG  19           HA       ARG  19  -4.411   4.917   7.670
    3    HB2  ARG  19           HB2      ARG  19  -4.742   3.780   5.473
    4    HB3  ARG  19           HB3      ARG  19  -6.282   4.626   5.297
    5    HG2  ARG  19           HG2      ARG  19  -5.146   6.794   5.369
    6    HG3  ARG  19           HG3      ARG  19  -3.600   6.003   5.672
    7    HD2  ARG  19           HD2      ARG  19  -3.722   6.597   3.330
    8    HD3  ARG  19           HD3      ARG  19  -3.813   4.837   3.473
    9    HE   ARG  19           HE       ARG  19  -6.444   5.755   3.466
   10   HH21  ARG  19          HH11      ARG  19  -7.637   5.917   1.548
   11   HH22  ARG  19          HH12      ARG  19  -6.815   5.994   0.028
   12   HH11  ARG  19          HH21      ARG  19  -3.667   5.812   1.433
   13   HH12  ARG  19          HH22      ARG  19  -4.566   5.932  -0.036

  No H/Q in entry =          13
  In of MODEL   55
    1    H    SER  20           H        SER  20  -7.909   5.043   7.069
    2    HA   SER  20           HA       SER  20  -8.258   7.800   7.024
    3    HB2  SER  20           HB2      SER  20  -9.988   5.922   6.655
    4    HB3  SER  20           HB3      SER  20 -10.207   5.967   8.403
    5    HG   SER  20           HG       SER  20 -10.737   7.927   6.459

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LEU  21           H        LEU  21  -8.266   5.614   9.826
    2    HA   LEU  21           HA       LEU  21  -8.701   7.608  11.793
    3    HB2  LEU  21           HB2      LEU  21  -7.349   4.906  11.955
    4    HB3  LEU  21           HB3      LEU  21  -7.671   5.921  13.358
    5    HG   LEU  21           HG       LEU  21  -9.823   5.017  11.421
    6   HD12  LEU  21          HD11      LEU  21  -9.069   3.852  14.118
    7   HD11  LEU  21          HD12      LEU  21  -8.773   3.083  12.558
    8   HD13  LEU  21          HD13      LEU  21 -10.428   3.343  13.114
    9   HD21  LEU  21          HD21      LEU  21  -9.770   6.564  13.997
   10   HD23  LEU  21          HD22      LEU  21 -11.159   5.529  13.684
   11   HD22  LEU  21          HD23      LEU  21 -10.767   6.831  12.571

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ALA  22           H        ALA  22  -5.752   6.230  10.385
    2    HA   ALA  22           HA       ALA  22  -3.870   7.537  12.010
    3    HB2  ALA  22           HB1      ALA  22  -3.457   5.684  10.316
    4    HB1  ALA  22           HB2      ALA  22  -2.258   6.977  10.354
    5    HB3  ALA  22           HB3      ALA  22  -3.476   6.938   9.077

  No H/Q in entry =           5
  In of MODEL   55
    1    H    TYR  23           H        TYR  23  -5.183   8.560   8.828
    2    HA   TYR  23           HA       TYR  23  -3.841  11.054   8.761
    3    HB2  TYR  23           HB2      TYR  23  -4.922  10.148   6.767
    4    HB3  TYR  23           HB3      TYR  23  -6.501  10.255   7.548
    5    HD1  TYR  23           HD1      TYR  23  -3.589  12.308   6.431
    6    HD2  TYR  23           HD2      TYR  23  -7.747  12.256   7.504
    7    HE1  TYR  23           HE1      TYR  23  -3.812  14.660   5.675
    8    HE2  TYR  23           HE2      TYR  23  -7.971  14.608   6.747
    9    HH   TYR  23           HH       TYR  23  -5.604  16.171   4.886

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ALA  24           H        ALA  24  -6.964  10.081  10.138
    2    HA   ALA  24           HA       ALA  24  -7.795  12.672  10.911
    3    HB1  ALA  24           HB1      ALA  24  -9.617  11.424  11.376
    4    HB2  ALA  24           HB2      ALA  24  -8.793  10.849  12.824
    5    HB3  ALA  24           HB3      ALA  24  -8.669   9.939  11.319

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ALA  25           H        ALA  25  -5.799  10.208  12.484
    2    HA   ALA  25           HA       ALA  25  -5.461  11.456  14.988
    3    HB2  ALA  25           HB1      ALA  25  -4.698   9.104  14.164
    4    HB3  ALA  25           HB2      ALA  25  -3.682   9.958  15.327
    5    HB1  ALA  25           HB3      ALA  25  -3.245   9.942  13.618

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LEU  26           H        LEU  26  -3.667  11.755  11.949
    2    HA   LEU  26           HA       LEU  26  -1.705  13.569  12.868
    3    HB2  LEU  26           HB2      LEU  26  -1.405  12.420  10.763
    4    HB3  LEU  26           HB3      LEU  26  -2.876  13.132  10.108
    5    HG   LEU  26           HG       LEU  26  -1.856  15.380  10.247
    6   HD12  LEU  26          HD11      LEU  26   0.682  15.393  10.663
    7   HD11  LEU  26          HD12      LEU  26   0.454  13.812  11.405
    8   HD13  LEU  26          HD13      LEU  26  -0.350  15.228  12.083
    9   HD21  LEU  26          HD21      LEU  26  -0.117  13.323   8.851
   10   HD23  LEU  26          HD22      LEU  26  -0.156  15.045   8.483
   11   HD22  LEU  26          HD23      LEU  26  -1.581  14.051   8.192

  No H/Q in entry =          11
  In of MODEL   55
    1    H    LYS  27           H        LYS  27  -4.885  14.062  11.390
    2    HA   LYS  27           HA       LYS  27  -4.823  16.850  11.195
    3    HB2  LYS  27           HB2      LYS  27  -6.570  15.379  10.206
    4    HB3  LYS  27           HB3      LYS  27  -7.228  15.122  11.822
    5    HG2  LYS  27           HG2      LYS  27  -7.652  17.529  12.060
    6    HG3  LYS  27           HG3      LYS  27  -6.942  17.826  10.470
    7    HD2  LYS  27           HD2      LYS  27  -8.677  16.397   9.431
    8    HD3  LYS  27           HD3      LYS  27  -9.393  16.117  11.020
    9    HE2  LYS  27           HE2      LYS  27  -9.830  18.529  11.266
   10    HE3  LYS  27           HE3      LYS  27  -9.086  18.831   9.692
   11    HZ3  LYS  27           HZ1      LYS  27 -11.463  18.713   9.449
   12    HZ2  LYS  27           HZ2      LYS  27 -11.516  17.195  10.216
   13    HZ1  LYS  27           HZ3      LYS  27 -10.770  17.359   8.695

  No H/Q in entry =          13
  In of MODEL   55
    1    H    GLN  28           H        GLN  28  -5.719  14.763  13.919
    2    HA   GLN  28           HA       GLN  28  -6.610  16.767  15.697
    3    HB2  GLN  28           HB2      GLN  28  -5.212  14.135  16.241
    4    HB3  GLN  28           HB3      GLN  28  -5.961  15.137  17.485
    5    HG2  GLN  28           HG2      GLN  28  -7.409  14.021  15.068
    6    HG3  GLN  28           HG3      GLN  28  -7.472  13.325  16.686
    7   HE21  GLN  28          HE21      GLN  28  -9.355  15.109  14.728
    8   HE22  GLN  28          HE22      GLN  28 -10.103  16.132  15.857

  No H/Q in entry =           8
  In of MODEL   55
    1    H    ALA  29           H        ALA  29  -3.394  15.461  15.008
    2    HA   ALA  29           HA       ALA  29  -1.952  16.851  16.989
    3    HB1  ALA  29           HB1      ALA  29  -0.024  16.155  15.870
    4    HB3  ALA  29           HB2      ALA  29  -0.777  16.284  14.280
    5    HB2  ALA  29           HB3      ALA  29  -1.204  14.951  15.353

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LYS  30           H        LYS  30  -2.805  17.738  13.660
    2    HA   LYS  30           HA       LYS  30  -1.383  20.172  13.563
    3    HB2  LYS  30           HB2      LYS  30  -3.918  19.313  12.152
    4    HB3  LYS  30           HB3      LYS  30  -3.076  20.823  11.811
    5    HG2  LYS  30           HG2      LYS  30  -1.013  19.520  11.296
    6    HG3  LYS  30           HG3      LYS  30  -1.927  18.029  11.539
    7    HD2  LYS  30           HD2      LYS  30  -3.487  18.680   9.744
    8    HD3  LYS  30           HD3      LYS  30  -2.595  20.184   9.504
    9    HE2  LYS  30           HE2      LYS  30  -0.570  18.880   8.923
   10    HE3  LYS  30           HE3      LYS  30  -1.481  17.382   9.133
   11    HZ2  LYS  30           HZ1      LYS  30  -1.299  18.255   6.792
   12    HZ1  LYS  30           HZ2      LYS  30  -2.335  19.523   7.262
   13    HZ3  LYS  30           HZ3      LYS  30  -2.869  17.909   7.331

  No H/Q in entry =          13
  In of MODEL   55
    1    H    GLN  31           H        GLN  31  -4.489  19.336  14.973
    2    HA   GLN  31           HA       GLN  31  -5.235  22.097  15.429
    3    HB2  GLN  31           HB2      GLN  31  -6.430  19.656  16.748
    4    HB3  GLN  31           HB3      GLN  31  -7.180  21.233  16.504
    5    HG2  GLN  31           HG2      GLN  31  -6.474  20.455  13.914
    6    HG3  GLN  31           HG3      GLN  31  -7.009  18.953  14.658
    7   HE21  GLN  31          HE21      GLN  31  -8.408  20.539  12.559
    8   HE22  GLN  31          HE22      GLN  31  -9.919  20.940  13.217

  No H/Q in entry =           8
  In of MODEL   55
    1    H    GLY  32           H        GLY  32  -2.936  20.152  16.747
    2    HA3  GLY  32           HA2      GLY  32  -1.533  20.602  18.550
    3    HA2  GLY  32           HA3      GLY  32  -2.654  21.852  19.075

  No H/Q in entry =           3
  In of MODEL   55
    1    H    ASP  33           H        ASP  33  -4.097  18.823  18.408
    2    HA   ASP  33           HA       ASP  33  -4.511  18.363  21.287
    3    HB2  ASP  33           HB2      ASP  33  -5.924  17.366  18.808
    4    HB3  ASP  33           HB3      ASP  33  -6.274  16.755  20.423

  No H/Q in entry =           4
  In of MODEL   55
    1    H    PHE  34           H        PHE  34  -2.348  17.497  21.592
    2    HA   PHE  34           HA       PHE  34  -1.364  15.243  20.187
    3    HB2  PHE  34           HB2      PHE  34  -0.740  16.219  22.983
    4    HB3  PHE  34           HB3      PHE  34   0.180  14.991  22.114
    5    HD1  PHE  34           HD1      PHE  34   0.032  18.416  22.855
    6    HD2  PHE  34           HD2      PHE  34   0.843  15.713  19.615
    7    HE1  PHE  34           HE1      PHE  34   1.340  20.180  21.704
    8    HE2  PHE  34           HE2      PHE  34   2.146  17.480  18.470
    9    HZ   PHE  34           HZ       PHE  34   2.396  19.711  19.518

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ALA  35           H        ALA  35  -3.402  15.530  23.050
    2    HA   ALA  35           HA       ALA  35  -3.209  12.865  23.942
    3    HB3  ALA  35           HB1      ALA  35  -5.662  13.507  24.800
    4    HB1  ALA  35           HB2      ALA  35  -5.117  15.122  24.347
    5    HB2  ALA  35           HB3      ALA  35  -4.210  14.189  25.537

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ALA  36           H        ALA  36  -5.648  14.403  21.845
    2    HA   ALA  36           HA       ALA  36  -7.080  12.002  21.363
    3    HB1  ALA  36           HB1      ALA  36  -8.525  13.437  20.409
    4    HB3  ALA  36           HB2      ALA  36  -7.350  13.851  19.161
    5    HB2  ALA  36           HB3      ALA  36  -7.368  14.736  20.686

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ALA  37           H        ALA  37  -4.388  13.573  19.697
    2    HA   ALA  37           HA       ALA  37  -4.365  11.942  17.397
    3    HB3  ALA  37           HB1      ALA  37  -2.360  13.637  18.823
    4    HB2  ALA  37           HB2      ALA  37  -2.890  13.700  17.143
    5    HB1  ALA  37           HB3      ALA  37  -1.745  12.460  17.662

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LYS  38           H        LYS  38  -2.610  11.618  20.474
    2    HA   LYS  38           HA       LYS  38  -1.302   9.209  19.981
    3    HB2  LYS  38           HB2      LYS  38  -1.612  10.970  22.130
    4    HB3  LYS  38           HB3      LYS  38  -2.242   9.444  22.743
    5    HG2  LYS  38           HG2      LYS  38  -0.156   8.310  22.205
    6    HG3  LYS  38           HG3      LYS  38   0.463   9.752  21.394
    7    HD2  LYS  38           HD2      LYS  38   0.641  10.965  23.431
    8    HD3  LYS  38           HD3      LYS  38  -0.387   9.821  24.296
    9    HE2  LYS  38           HE2      LYS  38   1.966   9.487  24.914
   10    HE3  LYS  38           HE3      LYS  38   1.352   8.077  24.048
   11    HZ3  LYS  38           HZ1      LYS  38   2.656   8.490  22.267
   12    HZ2  LYS  38           HZ2      LYS  38   3.616   9.309  23.406
   13    HZ1  LYS  38           HZ3      LYS  38   2.543  10.178  22.416

  No H/Q in entry =          13
  In of MODEL   55
    1    H    ALA  39           H        ALA  39  -4.537   9.724  21.384
    2    HA   ALA  39           HA       ALA  39  -5.116   7.008  21.883
    3    HB3  ALA  39           HB1      ALA  39  -7.261   8.969  21.120
    4    HB2  ALA  39           HB2      ALA  39  -6.362   9.187  22.622
    5    HB1  ALA  39           HB3      ALA  39  -7.289   7.710  22.355

  No H/Q in entry =           5
  In of MODEL   55
    1    H    MET  40           H        MET  40  -5.687   9.031  19.041
    2    HA   MET  40           HA       MET  40  -7.176   7.112  17.576
    3    HB2  MET  40           HB2      MET  40  -5.550   9.498  16.677
    4    HB3  MET  40           HB3      MET  40  -6.582   8.548  15.604
    5    HG2  MET  40           HG2      MET  40  -7.609   9.799  18.165
    6    HG3  MET  40           HG3      MET  40  -7.660  10.637  16.616
    7    HE3  MET  40           HE1      MET  40 -10.254   9.039  14.549
    8    HE2  MET  40           HE2      MET  40  -8.501   9.145  14.401
    9    HE1  MET  40           HE3      MET  40  -9.409  10.515  15.037

  No H/Q in entry =           9
  In of MODEL   55
    1    H    MET  41           H        MET  41  -3.680   7.825  17.701
    2    HA   MET  41           HA       MET  41  -2.933   6.070  15.597
    3    HB2  MET  41           HB2      MET  41  -1.313   6.721  18.071
    4    HB3  MET  41           HB3      MET  41  -0.699   6.072  16.555
    5    HG2  MET  41           HG2      MET  41  -1.841   8.264  15.555
    6    HG3  MET  41           HG3      MET  41  -1.602   8.847  17.200
    7    HE2  MET  41           HE1      MET  41   1.303   6.729  17.558
    8    HE1  MET  41           HE2      MET  41   0.522   8.026  18.459
    9    HE3  MET  41           HE3      MET  41   2.147   8.260  17.817

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ASP  42           H        ASP  42  -3.322   5.592  19.082
    2    HA   ASP  42           HA       ASP  42  -2.303   2.992  19.237
    3    HB2  ASP  42           HB2      ASP  42  -3.166   4.753  21.063
    4    HB3  ASP  42           HB3      ASP  42  -4.599   3.737  20.988

  No H/Q in entry =           4
  In of MODEL   55
    1    H    GLN  43           H        GLN  43  -5.629   4.118  18.738
    2    HA   GLN  43           HA       GLN  43  -6.789   1.538  18.538
    3    HB2  GLN  43           HB2      GLN  43  -7.695   4.198  17.414
    4    HB3  GLN  43           HB3      GLN  43  -8.667   2.725  17.389
    5    HG2  GLN  43           HG2      GLN  43  -8.375   2.597  19.896
    6    HG3  GLN  43           HG3      GLN  43  -7.640   4.198  19.828
    7   HE21  GLN  43          HE21      GLN  43  -9.820   4.288  21.329
    8   HE22  GLN  43          HE22      GLN  43 -11.177   4.874  20.498

  No H/Q in entry =           8
  In of MODEL   55
    1    H    SER  44           H        SER  44  -5.434   3.748  16.131
    2    HA   SER  44           HA       SER  44  -6.144   2.273  13.839
    3    HB2  SER  44           HB2      SER  44  -4.873   4.648  14.288
    4    HB3  SER  44           HB3      SER  44  -3.525   3.644  13.756
    5    HG   SER  44           HG       SER  44  -4.631   4.627  11.995

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ARG  45           H        ARG  45  -3.268   2.138  15.920
    2    HA   ARG  45           HA       ARG  45  -1.799   0.177  14.534
    3    HB2  ARG  45           HB2      ARG  45  -0.949   1.589  16.406
    4    HB3  ARG  45           HB3      ARG  45  -1.947   0.663  17.524
    5    HG2  ARG  45           HG2      ARG  45  -0.728  -1.403  16.878
    6    HG3  ARG  45           HG3      ARG  45   0.294  -0.451  15.802
    7    HD2  ARG  45           HD2      ARG  45   1.036   0.921  17.760
    8    HD3  ARG  45           HD3      ARG  45   0.107  -0.151  18.832
    9    HE   ARG  45           HE       ARG  45   1.797  -1.754  17.248
   10   HH21  ARG  45          HH11      ARG  45   3.691  -2.590  18.084
   11   HH22  ARG  45          HH12      ARG  45   4.469  -1.812  19.417
   12   HH11  ARG  45          HH21      ARG  45   2.114   0.706  19.643
   13   HH12  ARG  45          HH22      ARG  45   3.576   0.057  20.298

  No H/Q in entry =          13
  In of MODEL   55
    1    H    MET  46           H        MET  46  -4.200  -0.133  17.133
    2    HA   MET  46           HA       MET  46  -4.050  -2.934  17.433
    3    HB2  MET  46           HB2      MET  46  -6.205  -0.915  18.038
    4    HB3  MET  46           HB3      MET  46  -6.426  -2.634  18.372
    5    HG2  MET  46           HG2      MET  46  -4.439  -2.649  19.793
    6    HG3  MET  46           HG3      MET  46  -4.114  -0.967  19.408
    7    HE3  MET  46           HE1      MET  46  -7.727  -2.714  20.308
    8    HE2  MET  46           HE2      MET  46  -7.382  -2.767  22.033
    9    HE1  MET  46           HE3      MET  46  -6.296  -3.565  20.900

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ALA  47           H        ALA  47  -6.056  -0.900  15.342
    2    HA   ALA  47           HA       ALA  47  -7.687  -2.937  14.271
    3    HB3  ALA  47           HB1      ALA  47  -8.352  -0.695  13.860
    4    HB1  ALA  47           HB2      ALA  47  -7.866  -1.328  12.287
    5    HB2  ALA  47           HB3      ALA  47  -6.779  -0.269  13.187

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LEU  48           H        LEU  48  -4.559  -1.648  13.225
    2    HA   LEU  48           HA       LEU  48  -4.288  -3.235  10.880
    3    HB2  LEU  48           HB2      LEU  48  -2.223  -1.976  12.693
    4    HB3  LEU  48           HB3      LEU  48  -1.858  -2.695  11.124
    5    HG   LEU  48           HG       LEU  48  -3.865  -0.464  11.518
    6   HD13  LEU  48          HD11      LEU  48  -1.737   0.395  12.186
    7   HD12  LEU  48          HD12      LEU  48  -2.007   0.954  10.536
    8   HD11  LEU  48          HD13      LEU  48  -0.920  -0.401  10.842
    9   HD22  LEU  48          HD21      LEU  48  -4.343  -1.441   9.439
   10   HD21  LEU  48          HD22      LEU  48  -2.663  -1.887   9.144
   11   HD23  LEU  48          HD23      LEU  48  -3.169  -0.204   8.988

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ASN  49           H        ASN  49  -3.247  -3.648  14.226
    2    HA   ASN  49           HA       ASN  49  -1.662  -5.922  13.892
    3    HB2  ASN  49           HB2      ASN  49  -1.674  -4.597  15.943
    4    HB3  ASN  49           HB3      ASN  49  -3.340  -5.057  16.264
    5   HD21  ASN  49          HD21      ASN  49  -1.381  -5.613  18.183
    6   HD22  ASN  49          HD22      ASN  49  -1.118  -7.288  18.252

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLU  50           H        GLU  50  -5.129  -5.621  14.562
    2    HA   GLU  50           HA       GLU  50  -5.664  -8.416  14.663
    3    HB2  GLU  50           HB2      GLU  50  -7.237  -6.718  15.542
    4    HB3  GLU  50           HB3      GLU  50  -7.524  -6.147  13.897
    5    HG2  GLU  50           HG2      GLU  50  -8.407  -8.335  13.253
    6    HG3  GLU  50           HG3      GLU  50  -8.032  -8.985  14.845

  No H/Q in entry =           6
  In of MODEL   55
    1    H    ALA  51           H        ALA  51  -5.710  -6.011  12.073
    2    HA   ALA  51           HA       ALA  51  -6.709  -7.726  10.046
    3    HB2  ALA  51           HB1      ALA  51  -6.472  -5.912   8.681
    4    HB1  ALA  51           HB2      ALA  51  -4.830  -5.579   9.232
    5    HB3  ALA  51           HB3      ALA  51  -6.210  -5.058  10.201

  No H/Q in entry =           5
  In of MODEL   55
    1    H    HIS  52           H        HIS  52  -3.411  -6.850  11.034
    2    HA   HIS  52           HA       HIS  52  -2.024  -8.347   9.082
    3    HB2  HIS  52           HB2      HIS  52  -0.997  -6.618  10.553
    4    HB3  HIS  52           HB3      HIS  52  -1.139  -7.733  11.911
    5    HD1  HIS  52           HD1      HIS  52   0.280  -9.974  11.757
    6    HD2  HIS  52           HD2      HIS  52   1.159  -7.135   8.833
    7    HE1  HIS  52           HE1      HIS  52   2.484 -10.670  10.722
    8    HE2  HIS  52           HE2      HIS  52   3.033  -8.950   8.937

  No H/Q in entry =           8
  In of MODEL   55
    1    H    LEU  53           H        LEU  53  -3.246  -9.221  12.292
    2    HA   LEU  53           HA       LEU  53  -2.073 -11.777  12.480
    3    HB2  LEU  53           HB2      LEU  53  -4.546 -10.574  13.696
    4    HB3  LEU  53           HB3      LEU  53  -4.105 -12.255  13.983
    5    HG   LEU  53           HG       LEU  53  -2.174  -9.965  14.463
    6   HD11  LEU  53          HD11      LEU  53  -4.199 -11.239  16.316
    7   HD13  LEU  53          HD12      LEU  53  -4.004  -9.527  15.937
    8   HD12  LEU  53          HD13      LEU  53  -2.793 -10.358  16.906
    9   HD21  LEU  53          HD21      LEU  53  -2.258 -12.901  15.176
   10   HD23  LEU  53          HD22      LEU  53  -1.322 -11.772  16.150
   11   HD22  LEU  53          HD23      LEU  53  -0.934 -11.996  14.454

  No H/Q in entry =          11
  In of MODEL   55
    1    H    VAL  54           H        VAL  54  -5.173 -10.715  11.118
    2    HA   VAL  54           HA       VAL  54  -6.111 -13.298  10.424
    3    HB   VAL  54           HB       VAL  54  -6.731 -10.556   9.296
    4   HG12  VAL  54          HG11      VAL  54  -8.845 -11.911   8.479
    5   HG11  VAL  54          HG12      VAL  54  -7.747 -13.288   8.549
    6   HG13  VAL  54          HG13      VAL  54  -7.373 -11.914   7.510
    7   HG22  VAL  54          HG21      VAL  54  -7.639 -10.590  11.446
    8   HG21  VAL  54          HG22      VAL  54  -7.911 -12.331  11.423
    9   HG23  VAL  54          HG23      VAL  54  -8.981 -11.261  10.518

  No H/Q in entry =           9
  In of MODEL   55
    1    H    GLN  55           H        GLN  55  -4.214 -10.861   8.642
    2    HA   GLN  55           HA       GLN  55  -4.096 -12.321   6.221
    3    HB2  GLN  55           HB2      GLN  55  -3.470 -10.062   6.037
    4    HB3  GLN  55           HB3      GLN  55  -2.361 -10.153   7.403
    5    HG2  GLN  55           HG2      GLN  55  -0.651 -11.013   6.126
    6    HG3  GLN  55           HG3      GLN  55  -1.734 -11.975   5.129
    7   HE21  GLN  55          HE21      GLN  55  -1.742 -11.280   3.009
    8   HE22  GLN  55          HE22      GLN  55  -1.527  -9.676   2.503

  No H/Q in entry =           8
  In of MODEL   55
    1    H    THR  56           H        THR  56  -1.993 -12.328   9.104
    2    HA   THR  56           HA       THR  56   0.070 -13.946   8.184
    3    HB   THR  56           HB       THR  56  -1.176 -14.196  10.931
    4    HG1  THR  56           HG1      THR  56  -0.454 -12.008   9.862
    5   HG23  THR  56          HG21      THR  56   0.550 -15.833  10.527
    6   HG22  THR  56          HG22      THR  56   1.243 -14.567  11.543
    7   HG21  THR  56          HG23      THR  56   1.608 -14.613   9.818

  No H/Q in entry =           7
  In of MODEL   55
    1    H    LYS  57           H        LYS  57  -3.062 -14.953   9.543
    2    HA   LYS  57           HA       LYS  57  -2.645 -17.753   9.290
    3    HB2  LYS  57           HB2      LYS  57  -4.450 -16.681  10.646
    4    HB3  LYS  57           HB3      LYS  57  -5.226 -16.160   9.158
    5    HG2  LYS  57           HG2      LYS  57  -6.351 -18.154   9.861
    6    HG3  LYS  57           HG3      LYS  57  -5.353 -18.596   8.478
    7    HD2  LYS  57           HD2      LYS  57  -3.715 -19.642   9.863
    8    HD3  LYS  57           HD3      LYS  57  -4.384 -18.924  11.328
    9    HE2  LYS  57           HE2      LYS  57  -5.881 -20.902   9.572
   10    HE3  LYS  57           HE3      LYS  57  -5.001 -21.361  11.029
   11    HZ2  LYS  57           HZ1      LYS  57  -7.297 -19.490  10.858
   12    HZ1  LYS  57           HZ2      LYS  57  -6.392 -19.774  12.267
   13    HZ3  LYS  57           HZ3      LYS  57  -7.289 -21.033  11.563

  No H/Q in entry =          13
  In of MODEL   55
    1    H    LEU  58           H        LEU  58  -3.949 -15.291   7.119
    2    HA   LEU  58           HA       LEU  58  -4.769 -17.103   5.108
    3    HB2  LEU  58           HB2      LEU  58  -4.131 -14.161   4.980
    4    HB3  LEU  58           HB3      LEU  58  -4.803 -15.087   3.637
    5    HG   LEU  58           HG       LEU  58  -6.083 -14.901   6.384
    6   HD11  LEU  58          HD11      LEU  58  -6.364 -13.245   3.896
    7   HD13  LEU  58          HD12      LEU  58  -6.350 -12.741   5.586
    8   HD12  LEU  58          HD13      LEU  58  -7.780 -13.518   4.911
    9   HD22  LEU  58          HD21      LEU  58  -7.065 -16.797   5.509
   10   HD21  LEU  58          HD22      LEU  58  -6.720 -16.345   3.840
   11   HD23  LEU  58          HD23      LEU  58  -8.076 -15.607   4.691

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  59           H        ILE  59  -1.621 -15.928   5.975
    2    HA   ILE  59           HA       ILE  59  -0.529 -16.661   3.338
    3    HB   ILE  59           HB       ILE  59   0.260 -14.607   4.912
    4   HG12  ILE  59          HG12      ILE  59   2.341 -16.274   3.484
    5   HG13  ILE  59          HG13      ILE  59   1.151 -15.331   2.623
    6   HG21  ILE  59          HG21      ILE  59   0.989 -16.403   6.664
    7   HG23  ILE  59          HG22      ILE  59   2.094 -15.094   6.312
    8   HG22  ILE  59          HG23      ILE  59   2.339 -16.685   5.591
    9   HD11  ILE  59          HD11      ILE  59   1.898 -13.300   3.862
   10   HD13  ILE  59          HD12      ILE  59   3.169 -13.998   2.862
   11   HD12  ILE  59          HD13      ILE  59   3.167 -14.271   4.604

  No H/Q in entry =          11
  In of MODEL   55
    1    H    GLU  60           H        GLU  60  -0.555 -17.775   6.703
    2    HA   GLU  60           HA       GLU  60   1.455 -19.774   6.436
    3    HB2  GLU  60           HB2      GLU  60   0.703 -18.991   8.628
    4    HB3  GLU  60           HB3      GLU  60  -0.914 -19.620   8.319
    5    HG2  GLU  60           HG2      GLU  60   0.014 -21.912   8.159
    6    HG3  GLU  60           HG3      GLU  60   1.624 -21.275   8.489

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLY  61           H        GLY  61  -2.056 -19.833   5.946
    2    HA3  GLY  61           HA2      GLY  61  -1.837 -22.626   4.982
    3    HA2  GLY  61           HA3      GLY  61  -3.315 -21.875   5.575

  No H/Q in entry =           3
  In of MODEL   55
    1    H    ASP  62           H        ASP  62  -1.066 -20.317   3.377
    2    HA   ASP  62           HA       ASP  62  -3.113 -19.649   1.527
    3    HB2  ASP  62           HB2      ASP  62  -1.251 -18.742   0.186
    4    HB3  ASP  62           HB3      ASP  62  -1.141 -18.245   1.871

  No H/Q in entry =           4
  In of MODEL   55
    1    H    ALA  63           H        ALA  63  -3.815 -22.060   1.305
    2    HA   ALA  63           HA       ALA  63  -2.262 -23.852  -0.280
    3    HB1  ALA  63           HB1      ALA  63  -4.538 -24.915  -0.720
    4    HB3  ALA  63           HB2      ALA  63  -5.196 -23.668   0.339
    5    HB2  ALA  63           HB3      ALA  63  -4.013 -24.820   0.962

  No H/Q in entry =           5
  In of MODEL   55
    1    H    GLY  64           H        GLY  64  -4.684 -21.390  -1.016
    2    HA3  GLY  64           HA2      GLY  64  -5.126 -20.235  -2.959
    3    HA2  GLY  64           HA3      GLY  64  -3.707 -20.983  -3.673

  No H/Q in entry =           3
  In of MODEL   55
    1    H    GLU  65           H        GLU  65  -5.584 -20.741  -5.450
    2    HA   GLU  65           HA       GLU  65  -7.653 -22.659  -5.442
    3    HB2  GLU  65           HB2      GLU  65  -6.311 -21.200  -7.715
    4    HB3  GLU  65           HB3      GLU  65  -7.733 -22.226  -7.912
    5    HG2  GLU  65           HG2      GLU  65  -8.990 -20.843  -6.333
    6    HG3  GLU  65           HG3      GLU  65  -7.567 -19.845  -6.043

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLY  66           H        GLY  66  -4.401 -22.746  -6.688
    2    HA3  GLY  66           HA2      GLY  66  -4.687 -25.531  -7.568
    3    HA2  GLY  66           HA3      GLY  66  -3.415 -24.429  -8.057

  No H/Q in entry =           3
  In of MODEL   55
    1    H    LYS  67           H        LYS  67  -2.430 -26.680  -7.458
    2    HA   LYS  67           HA       LYS  67  -2.051 -27.426  -4.791
    3    HB2  LYS  67           HB2      LYS  67  -0.361 -27.950  -7.234
    4    HB3  LYS  67           HB3      LYS  67  -0.165 -28.777  -5.683
    5    HG2  LYS  67           HG2      LYS  67  -2.544 -29.488  -5.786
    6    HG3  LYS  67           HG3      LYS  67  -2.689 -28.723  -7.366
    7    HD2  LYS  67           HD2      LYS  67  -0.649 -30.878  -6.772
    8    HD3  LYS  67           HD3      LYS  67  -2.258 -31.227  -7.410
    9    HE2  LYS  67           HE2      LYS  67  -1.737 -29.535  -9.258
   10    HE3  LYS  67           HE3      LYS  67  -0.064 -29.598  -8.704
   11    HZ2  LYS  67           HZ1      LYS  67  -0.724 -31.169 -10.556
   12    HZ1  LYS  67           HZ2      LYS  67  -1.581 -32.044  -9.380
   13    HZ3  LYS  67           HZ3      LYS  67   0.100 -31.850  -9.241

  No H/Q in entry =          13
  In of MODEL   55
    1    H    MET  68           H        MET  68   0.689 -26.437  -6.720
    2    HA   MET  68           HA       MET  68   2.259 -25.573  -4.541
    3    HB2  MET  68           HB2      MET  68   2.550 -25.090  -7.508
    4    HB3  MET  68           HB3      MET  68   3.798 -24.754  -6.306
    5    HG2  MET  68           HG2      MET  68   2.528 -27.467  -6.773
    6    HG3  MET  68           HG3      MET  68   4.110 -26.976  -7.382
    7    HE1  MET  68           HE1      MET  68   5.862 -26.130  -6.198
    8    HE3  MET  68           HE2      MET  68   6.439 -26.727  -4.644
    9    HE2  MET  68           HE3      MET  68   5.422 -25.288  -4.705

  No H/Q in entry =           9
  In of MODEL   55
    1    H    LYS  69           H        LYS  69   0.332 -23.726  -6.893
    2    HA   LYS  69           HA       LYS  69   1.299 -21.187  -6.208
    3    HB2  LYS  69           HB2      LYS  69  -1.299 -22.006  -7.471
    4    HB3  LYS  69           HB3      LYS  69  -0.789 -20.324  -7.281
    5    HG2  LYS  69           HG2      LYS  69   1.284 -20.797  -8.515
    6    HG3  LYS  69           HG3      LYS  69   0.800 -22.482  -8.698
    7    HD2  LYS  69           HD2      LYS  69  -1.187 -21.782  -9.973
    8    HD3  LYS  69           HD3      LYS  69  -0.718 -20.091  -9.781
    9    HE2  LYS  69           HE2      LYS  69   1.374 -20.510 -10.995
   10    HE3  LYS  69           HE3      LYS  69   0.958 -22.216 -11.149
   11    HZ3  LYS  69           HZ1      LYS  69   0.321 -21.219 -13.156
   12    HZ2  LYS  69           HZ2      LYS  69  -0.395 -19.889 -12.379
   13    HZ1  LYS  69           HZ3      LYS  69  -1.125 -21.421 -12.292

  No H/Q in entry =          13
  In of MODEL   55
    1    H    VAL  70           H        VAL  70  -0.329 -19.367  -5.517
    2    HA   VAL  70           HA       VAL  70  -1.668 -20.166  -2.994
    3    HB   VAL  70           HB       VAL  70  -0.836 -18.052  -1.998
    4   HG11  VAL  70          HG11      VAL  70   1.322 -19.854  -3.133
    5   HG13  VAL  70          HG12      VAL  70   0.436 -20.112  -1.629
    6   HG12  VAL  70          HG13      VAL  70   1.541 -18.744  -1.779
    7   HG22  VAL  70          HG21      VAL  70  -0.412 -16.521  -3.713
    8   HG21  VAL  70          HG22      VAL  70   0.318 -17.742  -4.753
    9   HG23  VAL  70          HG23      VAL  70   1.229 -17.087  -3.395

  No H/Q in entry =           9
  In of MODEL   55
    1    H    SER  71           H        SER  71  -3.177 -18.452  -2.229
    2    HA   SER  71           HA       SER  71  -5.109 -17.794  -4.181
    3    HB2  SER  71           HB2      SER  71  -5.535 -18.024  -1.694
    4    HB3  SER  71           HB3      SER  71  -4.738 -16.470  -1.471
    5    HG   SER  71           HG       SER  71  -6.311 -15.666  -3.046

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LEU  72           H        LEU  72  -5.285 -16.134  -5.513
    2    HA   LEU  72           HA       LEU  72  -3.159 -14.342  -5.989
    3    HB2  LEU  72           HB2      LEU  72  -6.024 -14.370  -6.936
    4    HB3  LEU  72           HB3      LEU  72  -4.820 -13.216  -7.505
    5    HG   LEU  72           HG       LEU  72  -4.434 -16.225  -7.654
    6   HD13  LEU  72          HD11      LEU  72  -6.293 -15.777  -9.076
    7   HD12  LEU  72          HD12      LEU  72  -4.889 -15.794 -10.143
    8   HD11  LEU  72          HD13      LEU  72  -5.594 -14.258  -9.636
    9   HD21  LEU  72          HD21      LEU  72  -2.946 -13.809  -8.665
   10   HD23  LEU  72          HD22      LEU  72  -2.851 -15.308  -9.573
   11   HD22  LEU  72          HD23      LEU  72  -2.304 -15.258  -7.899

  No H/Q in entry =          11
  In of MODEL   55
    1    H    VAL  73           H        VAL  73  -6.249 -13.959  -4.358
    2    HA   VAL  73           HA       VAL  73  -6.267 -11.189  -3.999
    3    HB   VAL  73           HB       VAL  73  -8.009 -11.527  -2.463
    4   HG12  VAL  73          HG11      VAL  73  -8.203 -14.106  -3.986
    5   HG11  VAL  73          HG12      VAL  73  -8.178 -12.580  -4.868
    6   HG13  VAL  73          HG13      VAL  73  -9.448 -12.893  -3.684
    7   HG23  VAL  73          HG21      VAL  73  -8.332 -13.853  -1.433
    8   HG22  VAL  73          HG22      VAL  73  -6.982 -12.907  -0.808
    9   HG21  VAL  73          HG23      VAL  73  -6.688 -14.205  -1.966

  No H/Q in entry =           9
  In of MODEL   55
    1    H    LEU  74           H        LEU  74  -4.352 -13.581  -2.423
    2    HA   LEU  74           HA       LEU  74  -3.930 -12.451   0.104
    3    HB2  LEU  74           HB2      LEU  74  -3.167 -14.675  -0.400
    4    HB3  LEU  74           HB3      LEU  74  -2.109 -14.072  -1.675
    5    HG   LEU  74           HG       LEU  74  -0.791 -12.831   0.011
    6   HD12  LEU  74          HD11      LEU  74  -1.275 -13.551   2.447
    7   HD11  LEU  74          HD12      LEU  74  -2.870 -14.017   1.855
    8   HD13  LEU  74          HD13      LEU  74  -2.342 -12.339   1.741
    9   HD21  LEU  74          HD21      LEU  74  -0.628 -15.407  -0.606
   10   HD23  LEU  74          HD22      LEU  74  -1.021 -15.567   1.090
   11   HD22  LEU  74          HD23      LEU  74   0.414 -14.688   0.619

  No H/Q in entry =          11
  In of MODEL   55
    1    H    VAL  75           H        VAL  75  -2.036 -12.067  -2.853
    2    HA   VAL  75           HA       VAL  75  -0.219 -10.163  -1.837
    3    HB   VAL  75           HB       VAL  75  -1.180 -10.628  -4.662
    4   HG11  VAL  75          HG11      VAL  75   1.109  -8.931  -3.575
    5   HG13  VAL  75          HG12      VAL  75  -0.296  -8.351  -4.456
    6   HG12  VAL  75          HG13      VAL  75   0.898  -9.350  -5.270
    7   HG21  VAL  75          HG21      VAL  75   0.035 -12.487  -3.458
    8   HG23  VAL  75          HG22      VAL  75   1.401 -11.389  -3.253
    9   HG22  VAL  75          HG23      VAL  75   0.898 -11.877  -4.872

  No H/Q in entry =           9
  In of MODEL   55
    1    H    GLU  76           H        GLU  76  -3.367  -9.781  -3.493
    2    HA   GLU  76           HA       GLU  76  -3.391  -6.966  -3.586
    3    HB2  GLU  76           HB2      GLU  76  -5.064  -8.392  -4.750
    4    HB3  GLU  76           HB3      GLU  76  -5.725  -8.876  -3.197
    5    HG2  GLU  76           HG2      GLU  76  -7.154  -7.146  -4.089
    6    HG3  GLU  76           HG3      GLU  76  -6.272  -6.445  -2.745

  No H/Q in entry =           6
  In of MODEL   55
    1    H    ALA  77           H        ALA  77  -4.523  -9.190  -1.053
    2    HA   ALA  77           HA       ALA  77  -5.460  -7.185   0.713
    3    HB3  ALA  77           HB1      ALA  77  -5.348  -8.926   2.441
    4    HB1  ALA  77           HB2      ALA  77  -4.382  -9.939   1.370
    5    HB2  ALA  77           HB3      ALA  77  -6.054  -9.563   0.956

  No H/Q in entry =           5
  In of MODEL   55
    1    H    GLN  78           H        GLN  78  -2.328  -8.764   0.343
    2    HA   GLN  78           HA       GLN  78  -1.058  -7.623   2.596
    3    HB2  GLN  78           HB2      GLN  78  -0.221  -9.568   1.225
    4    HB3  GLN  78           HB3      GLN  78   0.238  -8.415  -0.026
    5    HG2  GLN  78           HG2      GLN  78   1.699  -7.254   1.586
    6    HG3  GLN  78           HG3      GLN  78   1.249  -8.415   2.832
    7   HE21  GLN  78          HE21      GLN  78   3.978  -8.145   2.003
    8   HE22  GLN  78          HE22      GLN  78   4.432  -9.566   1.193

  No H/Q in entry =           8
  In of MODEL   55
    1    H    LEU  79           H        LEU  79  -1.414  -6.548  -0.748
    2    HA   LEU  79           HA       LEU  79   0.295  -4.339  -0.728
    3    HB2  LEU  79           HB2      LEU  79  -0.741  -5.129  -2.784
    4    HB3  LEU  79           HB3      LEU  79  -2.340  -4.722  -2.174
    5    HG   LEU  79           HG       LEU  79  -1.771  -2.341  -2.141
    6   HD13  LEU  79          HD11      LEU  79   0.472  -2.122  -1.628
    7   HD12  LEU  79          HD12      LEU  79   0.524  -1.830  -3.366
    8   HD11  LEU  79          HD13      LEU  79   0.962  -3.415  -2.725
    9   HD23  LEU  79          HD21      LEU  79  -1.135  -2.141  -4.692
   10   HD22  LEU  79          HD22      LEU  79  -2.669  -2.874  -4.235
   11   HD21  LEU  79          HD23      LEU  79  -1.307  -3.896  -4.683

  No H/Q in entry =          11
  In of MODEL   55
    1    H    HIS  80           H        HIS  80  -3.173  -4.467   0.099
    2    HA   HIS  80           HA       HIS  80  -3.334  -1.711   0.771
    3    HB2  HIS  80           HB2      HIS  80  -5.062  -4.102   1.083
    4    HB3  HIS  80           HB3      HIS  80  -5.368  -2.761   2.191
    5    HD1  HIS  80           HD1      HIS  80  -6.967  -1.104   1.289
    6    HD2  HIS  80           HD2      HIS  80  -4.795  -2.931  -1.765
    7    HE1  HIS  80           HE1      HIS  80  -7.797  -0.091  -0.887
    8    HE2  HIS  80           HE2      HIS  80  -6.479  -1.199  -2.758

  No H/Q in entry =           8
  In of MODEL   55
    1    H    LEU  81           H        LEU  81  -2.877  -4.617   2.755
    2    HA   LEU  81           HA       LEU  81  -2.849  -3.277   5.243
    3    HB2  LEU  81           HB2      LEU  81  -1.660  -5.905   4.355
    4    HB3  LEU  81           HB3      LEU  81  -1.628  -5.351   6.031
    5    HG   LEU  81           HG       LEU  81  -4.176  -5.570   4.403
    6   HD12  LEU  81          HD11      LEU  81  -4.502  -7.637   5.944
    7   HD11  LEU  81          HD12      LEU  81  -2.749  -7.586   6.130
    8   HD13  LEU  81          HD13      LEU  81  -3.461  -7.804   4.530
    9   HD23  LEU  81          HD21      LEU  81  -5.021  -5.771   6.904
   10   HD22  LEU  81          HD22      LEU  81  -4.679  -4.184   6.218
   11   HD21  LEU  81          HD23      LEU  81  -3.500  -4.961   7.276

  No H/Q in entry =          11
  In of MODEL   55
    1    H    MET  82           H        MET  82  -0.179  -4.205   3.069
    2    HA   MET  82           HA       MET  82   1.914  -3.340   4.755
    3    HB2  MET  82           HB2      MET  82   1.695  -3.669   1.762
    4    HB3  MET  82           HB3      MET  82   3.183  -3.118   2.527
    5    HG2  MET  82           HG2      MET  82   1.747  -5.693   3.244
    6    HG3  MET  82           HG3      MET  82   3.119  -5.596   2.143
    7    HE3  MET  82           HE1      MET  82   6.144  -4.902   4.128
    8    HE2  MET  82           HE2      MET  82   5.237  -3.522   3.515
    9    HE1  MET  82           HE3      MET  82   5.307  -5.010   2.575

  No H/Q in entry =           9
  In of MODEL   55
    1    H    THR  83           H        THR  83   0.111  -1.669   2.204
    2    HA   THR  83           HA       THR  83   1.552   0.762   2.297
    3    HB   THR  83           HB       THR  83  -0.613   1.716   1.315
    4    HG1  THR  83           HG1      THR  83  -2.279   0.439   1.204
    5   HG22  THR  83          HG21      THR  83  -0.365  -0.099  -0.692
    6   HG21  THR  83          HG22      THR  83   1.132  -0.412   0.184
    7   HG23  THR  83          HG23      THR  83   0.790   1.208  -0.426

  No H/Q in entry =           7
  In of MODEL   55
    1    H    SER  84           H        SER  84  -1.466  -0.239   3.896
    2    HA   SER  84           HA       SER  84  -1.932   2.193   5.248
    3    HB2  SER  84           HB2      SER  84  -2.799  -0.636   5.805
    4    HB3  SER  84           HB3      SER  84  -3.276   0.708   6.842
    5    HG   SER  84           HG       SER  84  -3.739   0.407   4.049

  No H/Q in entry =           5
  In of MODEL   55
    1    H    MET  85           H        MET  85  -0.258  -0.763   6.368
    2    HA   MET  85           HA       MET  85   0.274   0.150   8.975
    3    HB2  MET  85           HB2      MET  85   0.539  -2.193   8.304
    4    HB3  MET  85           HB3      MET  85   1.913  -1.750   7.292
    5    HG2  MET  85           HG2      MET  85   3.139  -0.950   9.261
    6    HG3  MET  85           HG3      MET  85   1.751  -1.305  10.288
    7    HE1  MET  85           HE1      MET  85   4.346  -2.449   7.921
    8    HE3  MET  85           HE2      MET  85   3.259  -3.660   7.248
    9    HE2  MET  85           HE3      MET  85   4.634  -4.165   8.224

  No H/Q in entry =           9
  In of MODEL   55
    1    H    LEU  86           H        LEU  86   2.211   0.390   6.024
    2    HA   LEU  86           HA       LEU  86   4.442   1.670   7.183
    3    HB2  LEU  86           HB2      LEU  86   4.236   0.597   4.871
    4    HB3  LEU  86           HB3      LEU  86   3.446   2.090   4.363
    5    HG   LEU  86           HG       LEU  86   5.490   3.308   5.346
    6   HD11  LEU  86          HD11      LEU  86   6.163   0.685   6.138
    7   HD13  LEU  86          HD12      LEU  86   7.184   2.117   6.239
    8   HD12  LEU  86          HD13      LEU  86   7.280   1.072   4.825
    9   HD23  LEU  86          HD21      LEU  86   6.184   1.542   2.990
   10   HD22  LEU  86          HD22      LEU  86   6.598   3.234   3.257
   11   HD21  LEU  86          HD23      LEU  86   4.940   2.788   2.857

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ALA  87           H        ALA  87   1.544   2.954   5.603
    2    HA   ALA  87           HA       ALA  87   2.173   5.676   5.694
    3    HB1  ALA  87           HB1      ALA  87  -0.157   4.079   5.149
    4    HB3  ALA  87           HB2      ALA  87   0.174   5.737   4.654
    5    HB2  ALA  87           HB3      ALA  87  -0.623   5.422   6.196

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ARG  88           H        ARG  88   0.459   3.689   8.079
    2    HA   ARG  88           HA       ARG  88  -0.026   5.740   9.932
    3    HB2  ARG  88           HB2      ARG  88  -0.994   3.400   9.992
    4    HB3  ARG  88           HB3      ARG  88   0.540   2.878  10.696
    5    HG2  ARG  88           HG2      ARG  88   0.091   4.954  12.322
    6    HG3  ARG  88           HG3      ARG  88  -1.580   4.651  11.866
    7    HD2  ARG  88           HD2      ARG  88  -1.710   2.800  13.107
    8    HD3  ARG  88           HD3      ARG  88  -0.128   2.200  12.574
    9    HE   ARG  88           HE       ARG  88  -0.645   3.463  15.032
   10   HH21  ARG  88          HH11      ARG  88   0.926   4.452  16.272
   11   HH22  ARG  88          HH12      ARG  88   2.450   4.862  15.568
   12   HH11  ARG  88          HH21      ARG  88   1.636   3.623  12.454
   13   HH12  ARG  88          HH22      ARG  88   2.861   4.376  13.418

  No H/Q in entry =          13
  In of MODEL   55
    1    H    GLU  89           H        GLU  89   2.742   3.488   9.701
    2    HA   GLU  89           HA       GLU  89   4.016   4.355  12.047
    3    HB2  GLU  89           HB2      GLU  89   4.649   2.332  10.698
    4    HB3  GLU  89           HB3      GLU  89   5.438   3.419   9.554
    5    HG2  GLU  89           HG2      GLU  89   6.934   4.243  11.299
    6    HG3  GLU  89           HG3      GLU  89   6.088   3.294  12.517

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LEU  90           H        LEU  90   4.345   5.517   8.722
    2    HA   LEU  90           HA       LEU  90   6.300   7.493   9.312
    3    HB2  LEU  90           HB2      LEU  90   4.289   7.191   7.085
    4    HB3  LEU  90           HB3      LEU  90   5.535   8.447   7.109
    5    HG   LEU  90           HG       LEU  90   6.174   5.502   7.435
    6   HD12  LEU  90          HD11      LEU  90   6.924   5.732   4.995
    7   HD11  LEU  90          HD12      LEU  90   5.926   7.185   4.951
    8   HD13  LEU  90          HD13      LEU  90   5.187   5.620   5.290
    9   HD22  LEU  90          HD21      LEU  90   8.084   6.627   8.119
   10   HD21  LEU  90          HD22      LEU  90   7.751   8.038   7.116
   11   HD23  LEU  90          HD23      LEU  90   8.393   6.568   6.385

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  91           H        ILE  91   2.761   7.550   9.164
    2    HA   ILE  91           HA       ILE  91   2.451  10.325   9.622
    3    HB   ILE  91           HB       ILE  91   0.633   7.969  10.159
    4   HG12  ILE  91          HG12      ILE  91   0.410  10.258   8.180
    5   HG13  ILE  91          HG13      ILE  91   1.253   8.755   7.804
    6   HG22  ILE  91          HG21      ILE  91  -1.076  10.047  10.229
    7   HG21  ILE  91          HG22      ILE  91   0.335  10.859  10.903
    8   HG23  ILE  91          HG23      ILE  91  -0.317   9.427  11.696
    9   HD13  ILE  91          HD11      ILE  91  -0.706   7.490   7.846
   10   HD12  ILE  91          HD12      ILE  91  -1.278   9.013   7.168
   11   HD11  ILE  91          HD13      ILE  91  -1.553   8.648   8.872

  No H/Q in entry =          11
  In of MODEL   55
    1    H    THR  92           H        THR  92   2.824   7.574  11.817
    2    HA   THR  92           HA       THR  92   2.396   8.946  14.244
    3    HB   THR  92           HB       THR  92   4.179   6.593  13.573
    4    HG1  THR  92           HG1      THR  92   2.202   5.858  13.471
    5   HG22  THR  92          HG21      THR  92   3.793   6.307  16.206
    6   HG21  THR  92          HG22      THR  92   3.747   8.067  16.137
    7   HG23  THR  92          HG23      THR  92   5.171   7.197  15.562

  No H/Q in entry =           7
  In of MODEL   55
    1    H    GLU  93           H        GLU  93   5.342   8.470  12.309
    2    HA   GLU  93           HA       GLU  93   7.111   9.874  14.009
    3    HB2  GLU  93           HB2      GLU  93   7.196   9.566  10.993
    4    HB3  GLU  93           HB3      GLU  93   8.542  10.079  12.008
    5    HG2  GLU  93           HG2      GLU  93   7.105   7.456  12.450
    6    HG3  GLU  93           HG3      GLU  93   8.490   7.596  11.374

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LEU  94           H        LEU  94   5.073  10.917  11.299
    2    HA   LEU  94           HA       LEU  94   5.906  13.612  11.204
    3    HB2  LEU  94           HB2      LEU  94   3.302  12.276  10.448
    4    HB3  LEU  94           HB3      LEU  94   3.578  14.001  10.210
    5    HG   LEU  94           HG       LEU  94   5.575  11.995   9.155
    6   HD11  LEU  94          HD11      LEU  94   2.839  12.576   8.094
    7   HD13  LEU  94          HD12      LEU  94   3.807  11.110   7.966
    8   HD12  LEU  94          HD13      LEU  94   4.156  12.489   6.924
    9   HD23  LEU  94          HD21      LEU  94   5.844  13.832   7.437
   10   HD22  LEU  94          HD22      LEU  94   6.263  14.317   9.080
   11   HD21  LEU  94          HD23      LEU  94   4.717  14.802   8.382

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  95           H        ILE  95   3.352  12.017  13.092
    2    HA   ILE  95           HA       ILE  95   2.333  14.374  14.292
    3    HB   ILE  95           HB       ILE  95   2.321  11.491  15.211
    4   HG12  ILE  95          HG12      ILE  95   0.118  13.288  14.165
    5   HG13  ILE  95          HG13      ILE  95   1.065  12.222  13.131
    6   HG21  ILE  95          HG21      ILE  95   1.064  13.973  16.418
    7   HG23  ILE  95          HG22      ILE  95   2.100  12.792  17.220
    8   HG22  ILE  95          HG23      ILE  95   0.461  12.348  16.743
    9   HD13  ILE  95          HD11      ILE  95   0.143  10.290  14.046
   10   HD12  ILE  95          HD12      ILE  95  -1.229  11.393  14.124
   11   HD11  ILE  95          HD13      ILE  95  -0.267  11.082  15.569

  No H/Q in entry =          11
  In of MODEL   55
    1    H    GLU  96           H        GLU  96   4.906  12.128  15.283
    2    HA   GLU  96           HA       GLU  96   5.473  13.316  17.778
    3    HB2  GLU  96           HB2      GLU  96   6.400  11.150  17.126
    4    HB3  GLU  96           HB3      GLU  96   7.341  11.917  15.847
    5    HG2  GLU  96           HG2      GLU  96   8.994  12.447  17.311
    6    HG3  GLU  96           HG3      GLU  96   7.855  13.268  18.368

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LEU  97           H        LEU  97   6.555  14.085  14.494
    2    HA   LEU  97           HA       LEU  97   8.459  16.063  15.210
    3    HB2  LEU  97           HB2      LEU  97   6.863  15.534  12.714
    4    HB3  LEU  97           HB3      LEU  97   7.895  16.955  12.839
    5    HG   LEU  97           HG       LEU  97   8.899  14.147  13.393
    6   HD12  LEU  97          HD11      LEU  97   9.898  14.337  11.076
    7   HD11  LEU  97          HD12      LEU  97   8.859  15.738  10.815
    8   HD13  LEU  97          HD13      LEU  97   8.145  14.152  11.106
    9   HD23  LEU  97          HD21      LEU  97  11.080  15.408  12.653
   10   HD22  LEU  97          HD22      LEU  97  10.463  15.680  14.282
   11   HD21  LEU  97          HD23      LEU  97  10.159  16.868  13.017

  No H/Q in entry =          11
  In of MODEL   55
    1    H    HIS  98           H        HIS  98   4.969  16.231  14.555
    2    HA   HIS  98           HA       HIS  98   4.694  19.032  14.697
    3    HB2  HIS  98           HB2      HIS  98   2.784  16.797  15.417
    4    HB3  HIS  98           HB3      HIS  98   2.332  18.501  15.477
    5    HD1  HIS  98           HD1      HIS  98   3.330  15.783  13.066
    6    HD2  HIS  98           HD2      HIS  98   1.989  19.728  12.952
    7    HE1  HIS  98           HE1      HIS  98   2.776  16.282  10.643
    8    HE2  HIS  98           HE2      HIS  98   1.962  18.678  10.553

  No H/Q in entry =           8
  In of MODEL   55
    1    H    GLU  99           H        GLU  99   4.805  16.537  17.190
    2    HA   GLU  99           HA       GLU  99   4.212  18.232  19.392
    3    HB2  GLU  99           HB2      GLU  99   4.101  15.751  19.483
    4    HB3  GLU  99           HB3      GLU  99   5.860  15.691  19.375
    5    HG2  GLU  99           HG2      GLU  99   6.060  16.977  21.452
    6    HG3  GLU  99           HG3      GLU  99   4.309  17.133  21.548

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LYS 100           H        LYS 100   7.257  17.278  17.825
    2    HA   LYS 100           HA       LYS 100   8.924  18.661  19.685
    3    HB2  LYS 100           HB2      LYS 100   9.415  17.738  16.845
    4    HB3  LYS 100           HB3      LYS 100  10.651  18.495  17.855
    5    HG2  LYS 100           HG2      LYS 100  10.260  16.744  19.592
    6    HG3  LYS 100           HG3      LYS 100   9.121  15.952  18.499
    7    HD2  LYS 100           HD2      LYS 100  10.913  15.658  16.831
    8    HD3  LYS 100           HD3      LYS 100  12.057  16.461  17.910
    9    HE2  LYS 100           HE2      LYS 100  11.645  14.705  19.624
   10    HE3  LYS 100           HE3      LYS 100  10.563  13.882  18.496
   11    HZ1  LYS 100           HZ1      LYS 100  13.389  14.528  17.843
   12    HZ3  LYS 100           HZ2      LYS 100  12.336  13.484  17.012
   13    HZ2  LYS 100           HZ3      LYS 100  12.921  13.056  18.550

  No H/Q in entry =          13
  In of MODEL   55
    1    H    LEU 101           H        LEU 101   7.239  19.609  16.732
    2    HA   LEU 101           HA       LEU 101   8.475  22.156  16.403
    3    HB2  LEU 101           HB2      LEU 101   5.870  20.947  15.513
    4    HB3  LEU 101           HB3      LEU 101   6.136  22.676  15.309
    5    HG   LEU 101           HG       LEU 101   8.154  20.644  14.339
    6   HD12  LEU 101          HD11      LEU 101   7.006  21.165  12.055
    7   HD11  LEU 101          HD12      LEU 101   5.610  21.606  13.037
    8   HD13  LEU 101          HD13      LEU 101   6.260  19.969  13.115
    9   HD21  LEU 101          HD21      LEU 101   7.552  23.563  13.790
   10   HD23  LEU 101          HD22      LEU 101   8.524  22.597  12.681
   11   HD22  LEU 101          HD23      LEU 101   9.068  22.846  14.340

  No H/Q in entry =          11
  In of MODEL   55
    1    H    LYS 102           H        LYS 102   6.928  21.026  19.015
    2    HA   LYS 102           HA       LYS 102   6.305  22.118  20.950
    3    HB2  LYS 102           HB2      LYS 102   7.606  24.099  19.831
    4    HB3  LYS 102           HB3      LYS 102   6.012  24.719  19.456
    5    HG2  LYS 102           HG2      LYS 102   7.386  24.445  22.108
    6    HG3  LYS 102           HG3      LYS 102   6.446  25.784  21.482
    7    HD2  LYS 102           HD2      LYS 102   5.178  23.157  22.354
    8    HD3  LYS 102           HD3      LYS 102   5.439  24.513  23.441
    9    HE2  LYS 102           HE2      LYS 102   3.156  24.134  21.951
   10    HE3  LYS 102           HE3      LYS 102   3.673  25.674  22.636
   11    HZ2  LYS 102           HZ1      LYS 102   3.144  25.792  20.257
   12    HZ1  LYS 102           HZ2      LYS 102   4.396  24.699  19.931
   13    HZ3  LYS 102           HZ3      LYS 102   4.752  26.225  20.578

  No H/Q in entry =          13
  In of MODEL   55
    1    H    ALA 103           H        ALA 103   4.682  23.682  18.186
    2    HA   ALA 103           HA       ALA 103   2.233  24.279  19.072
    3    HB1  ALA 103           HB1      ALA 103   1.327  23.451  16.828
    4    HB2  ALA 103           HB2      ALA 103   2.969  22.900  16.497
    5    HB3  ALA 103           HB3      ALA 103   2.650  24.614  16.767

  No H/Q in entry =           5
  In of MODEL   55
    1    H1   ALA   1           H3       ALA   1  10.427 -20.237  -6.307
    2    H2   ALA   1           H2       ALA   1   9.460 -20.431  -7.693
    3    H3   ALA   1           H1       ALA   1   9.016 -21.177  -6.232
    4    HA   ALA   1           HA       ALA   1  10.038 -22.994  -6.976
    5    HB1  ALA   1           HB1      ALA   1  10.137 -22.630  -9.251
    6    HB2  ALA   1           HB2      ALA   1  11.865 -22.497  -8.922
    7    HB3  ALA   1           HB3      ALA   1  10.881 -21.040  -9.069

  No H/Q in entry =           7
  In of MODEL   55
    1    H    GLU   2           H        GLU   2  12.312 -23.966  -7.037
    2    HA   GLU   2           HA       GLU   2  13.695 -23.904  -4.825
    3    HB2  GLU   2           HB2      GLU   2  15.052 -23.779  -7.524
    4    HB3  GLU   2           HB3      GLU   2  15.774 -24.401  -6.040
    5    HG2  GLU   2           HG2      GLU   2  14.737 -26.407  -6.286
    6    HG3  GLU   2           HG3      GLU   2  13.174 -25.645  -6.543

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLU   3           H        GLU   3  15.484 -22.051  -7.222
    2    HA   GLU   3           HA       GLU   3  16.654 -20.380  -5.258
    3    HB2  GLU   3           HB2      GLU   3  16.598 -20.370  -8.268
    4    HB3  GLU   3           HB3      GLU   3  17.357 -19.051  -7.378
    5    HG2  GLU   3           HG2      GLU   3  19.006 -20.444  -6.459
    6    HG3  GLU   3           HG3      GLU   3  18.045 -21.901  -6.683

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LEU   4           H        LEU   4  14.380 -19.503  -7.887
    2    HA   LEU   4           HA       LEU   4  13.940 -16.891  -7.269
    3    HB2  LEU   4           HB2      LEU   4  11.745 -18.842  -8.003
    4    HB3  LEU   4           HB3      LEU   4  11.688 -17.092  -8.197
    5    HG   LEU   4           HG       LEU   4  13.633 -18.971  -9.576
    6   HD13  LEU   4          HD11      LEU   4  12.332 -18.805 -11.485
    7   HD12  LEU   4          HD12      LEU   4  11.640 -17.254 -11.013
    8   HD11  LEU   4          HD13      LEU   4  11.072 -18.741 -10.256
    9   HD23  LEU   4          HD21      LEU   4  13.992 -16.726 -10.922
   10   HD22  LEU   4          HD22      LEU   4  14.849 -16.981  -9.403
   11   HD21  LEU   4          HD23      LEU   4  13.407 -15.970  -9.439

  No H/Q in entry =          11
  In of MODEL   55
    1    H    GLU   5           H        GLU   5  12.428 -19.664  -5.633
    2    HA   GLU   5           HA       GLU   5  10.767 -18.080  -3.926
    3    HB2  GLU   5           HB2      GLU   5  10.347 -20.470  -4.469
    4    HB3  GLU   5           HB3      GLU   5  11.748 -20.899  -3.486
    5    HG2  GLU   5           HG2      GLU   5   9.805 -21.112  -2.081
    6    HG3  GLU   5           HG3      GLU   5  10.670 -19.663  -1.568

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLU   6           H        GLU   6  13.897 -19.692  -3.488
    2    HA   GLU   6           HA       GLU   6  14.259 -18.846  -0.787
    3    HB2  GLU   6           HB2      GLU   6  15.469 -20.769  -1.763
    4    HB3  GLU   6           HB3      GLU   6  16.326 -19.669  -2.844
    5    HG2  GLU   6           HG2      GLU   6  17.286 -18.495  -0.909
    6    HG3  GLU   6           HG3      GLU   6  16.409 -19.564   0.186

  No H/Q in entry =           6
  In of MODEL   55
    1    H    VAL   7           H        VAL   7  15.037 -17.519  -3.934
    2    HA   VAL   7           HA       VAL   7  16.744 -15.411  -3.065
    3    HB   VAL   7           HB       VAL   7  15.034 -15.752  -5.542
    4   HG11  VAL   7          HG11      VAL   7  16.949 -13.559  -4.725
    5   HG13  VAL   7          HG12      VAL   7  15.308 -13.399  -5.348
    6   HG12  VAL   7          HG13      VAL   7  16.612 -13.912  -6.420
    7   HG21  VAL   7          HG21      VAL   7  17.127 -17.230  -4.978
    8   HG23  VAL   7          HG22      VAL   7  18.046 -15.777  -5.373
    9   HG22  VAL   7          HG23      VAL   7  17.002 -16.514  -6.586

  No H/Q in entry =           9
  In of MODEL   55
    1    H    VAL   8           H        VAL   8  13.249 -15.646  -3.621
    2    HA   VAL   8           HA       VAL   8  12.609 -12.933  -3.142
    3    HB   VAL   8           HB       VAL   8  10.999 -15.469  -2.775
    4   HG13  VAL   8          HG11      VAL   8   9.985 -13.915  -1.287
    5   HG12  VAL   8          HG12      VAL   8   9.040 -13.795  -2.771
    6   HG11  VAL   8          HG13      VAL   8  10.245 -12.566  -2.392
    7   HG22  VAL   8          HG21      VAL   8  10.147 -15.048  -4.930
    8   HG21  VAL   8          HG22      VAL   8  11.800 -14.466  -5.104
    9   HG23  VAL   8          HG23      VAL   8  10.490 -13.322  -4.836

  No H/Q in entry =           9
  In of MODEL   55
    1    H    MET   9           H        MET   9  12.850 -15.747  -0.970
    2    HA   MET   9           HA       MET   9  12.047 -14.473   1.404
    3    HB2  MET   9           HB2      MET   9  13.921 -16.770   0.849
    4    HB3  MET   9           HB3      MET   9  13.652 -16.185   2.491
    5    HG2  MET   9           HG2      MET   9  11.426 -16.849   2.512
    6    HG3  MET   9           HG3      MET   9  11.276 -16.754   0.757
    7    HE1  MET   9           HE1      MET   9  13.218 -18.479   3.623
    8    HE3  MET   9           HE2      MET   9  14.432 -18.303   2.359
    9    HE2  MET   9           HE3      MET   9  13.897 -19.910   2.839

  No H/Q in entry =           9
  In of MODEL   55
    1    H    GLY  10           H        GLY  10  15.226 -14.723  -0.154
    2    HA3  GLY  10           HA2      GLY  10  16.698 -13.320   1.819
    3    HA2  GLY  10           HA3      GLY  10  17.159 -13.485   0.125

  No H/Q in entry =           3
  In of MODEL   55
    1    H    LEU  11           H        LEU  11  15.001 -12.242  -1.111
    2    HA   LEU  11           HA       LEU  11  15.710  -9.503  -0.941
    3    HB2  LEU  11           HB2      LEU  11  13.330 -10.889  -2.179
    4    HB3  LEU  11           HB3      LEU  11  13.625  -9.157  -2.334
    5    HG   LEU  11           HG       LEU  11  15.634 -11.281  -3.128
    6   HD13  LEU  11          HD11      LEU  11  13.885 -11.629  -4.648
    7   HD12  LEU  11          HD12      LEU  11  14.898 -10.454  -5.486
    8   HD11  LEU  11          HD13      LEU  11  13.429  -9.925  -4.666
    9   HD22  LEU  11          HD21      LEU  11  16.882  -9.328  -2.897
   10   HD21  LEU  11          HD22      LEU  11  15.516  -8.279  -3.273
   11   HD23  LEU  11          HD23      LEU  11  16.340  -9.152  -4.564

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  12           H        ILE  12  12.926 -11.309   0.323
    2    HA   ILE  12           HA       ILE  12  11.551  -9.076   1.388
    3    HB   ILE  12           HB       ILE  12  11.565 -11.962   2.329
    4   HG12  ILE  12          HG12      ILE  12  10.880 -11.314  -0.116
    5   HG13  ILE  12          HG13      ILE  12   9.847 -12.399   0.793
    6   HG22  ILE  12          HG21      ILE  12   9.291 -11.362   3.249
    7   HG21  ILE  12          HG22      ILE  12   9.655  -9.672   2.904
    8   HG23  ILE  12          HG23      ILE  12  10.633 -10.564   4.069
    9   HD12  ILE  12          HD11      ILE  12   8.612 -10.599  -0.427
   10   HD11  ILE  12          HD12      ILE  12   9.448  -9.406   0.563
   11   HD13  ILE  12          HD13      ILE  12   8.353 -10.550   1.308

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  13           H        ILE  13  13.927 -11.303   2.788
    2    HA   ILE  13           HA       ILE  13  13.972 -10.131   5.371
    3    HB   ILE  13           HB       ILE  13  16.022 -11.712   3.802
    4   HG12  ILE  13          HG12      ILE  13  13.742 -12.674   4.625
    5   HG13  ILE  13          HG13      ILE  13  15.211 -13.601   4.911
    6   HG22  ILE  13          HG21      ILE  13  17.001 -12.089   6.188
    7   HG21  ILE  13          HG22      ILE  13  16.163 -10.600   6.607
    8   HG23  ILE  13          HG23      ILE  13  17.401 -10.591   5.350
    9   HD11  ILE  13          HD11      ILE  13  14.313 -11.650   7.019
   10   HD13  ILE  13          HD12      ILE  13  15.210 -13.155   7.190
   11   HD12  ILE  13          HD13      ILE  13  13.480 -13.196   6.873

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ASN  14           H        ASN  14  15.929  -9.607   2.454
    2    HA   ASN  14           HA       ASN  14  17.687  -7.680   3.520
    3    HB2  ASN  14           HB2      ASN  14  17.655  -8.940   1.201
    4    HB3  ASN  14           HB3      ASN  14  16.772  -7.516   0.668
    5   HD21  ASN  14          HD21      ASN  14  19.210  -7.868  -0.519
    6   HD22  ASN  14          HD22      ASN  14  20.360  -6.794   0.111

  No H/Q in entry =           6
  In of MODEL   55
    1    H    SER  15           H        SER  15  14.578  -7.308   1.829
    2    HA   SER  15           HA       SER  15  14.484  -4.487   1.892
    3    HB2  SER  15           HB2      SER  15  12.151  -4.717   1.395
    4    HB3  SER  15           HB3      SER  15  12.938  -6.087   0.622
    5    HG   SER  15           HG       SER  15  11.510  -7.168   1.739

  No H/Q in entry =           5
  In of MODEL   55
    1    H    GLY  16           H        GLY  16  13.375  -6.946   4.190
    2    HA3  GLY  16           HA2      GLY  16  12.164  -5.194   6.051
    3    HA2  GLY  16           HA3      GLY  16  12.769  -6.807   6.409

  No H/Q in entry =           3
  In of MODEL   55
    1    H    GLN  17           H        GLN  17  15.483  -6.489   5.818
    2    HA   GLN  17           HA       GLN  17  16.446  -5.279   8.202
    3    HB2  GLN  17           HB2      GLN  17  17.858  -6.136   5.662
    4    HB3  GLN  17           HB3      GLN  17  18.710  -5.538   7.086
    5    HG2  GLN  17           HG2      GLN  17  16.802  -7.892   7.103
    6    HG3  GLN  17           HG3      GLN  17  18.557  -8.035   7.016
    7   HE21  GLN  17          HE21      GLN  17  16.171  -8.362   9.215
    8   HE22  GLN  17          HE22      GLN  17  16.957  -7.799  10.610

  No H/Q in entry =           8
  In of MODEL   55
    1    H    ALA  18           H        ALA  18  16.264  -4.192   4.844
    2    HA   ALA  18           HA       ALA  18  17.713  -1.808   5.077
    3    HB1  ALA  18           HB1      ALA  18  16.589  -3.012   3.007
    4    HB3  ALA  18           HB2      ALA  18  16.863  -1.270   2.995
    5    HB2  ALA  18           HB3      ALA  18  15.260  -1.907   3.363

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ARG  19           H        ARG  19  14.210  -2.378   5.472
    2    HA   ARG  19           HA       ARG  19  13.556   0.274   6.193
    3    HB2  ARG  19           HB2      ARG  19  11.866  -1.467   5.602
    4    HB3  ARG  19           HB3      ARG  19  12.203  -2.270   7.137
    5    HG2  ARG  19           HG2      ARG  19  11.503  -0.278   8.381
    6    HG3  ARG  19           HG3      ARG  19  11.258   0.603   6.875
    7    HD2  ARG  19           HD2      ARG  19   9.112  -0.184   7.692
    8    HD3  ARG  19           HD3      ARG  19   9.527  -1.062   6.214
    9    HE   ARG  19           HE       ARG  19  10.476  -2.614   8.316
   10   HH21  ARG  19          HH11      ARG  19   9.218  -4.250   9.250
   11   HH22  ARG  19          HH12      ARG  19   7.498  -4.213   9.079
   12   HH11  ARG  19          HH21      ARG  19   7.489  -1.303   7.223
   13   HH12  ARG  19          HH22      ARG  19   6.520  -2.544   7.927

  No H/Q in entry =          13
  In of MODEL   55
    1    H    SER  20           H        SER  20  14.398  -2.565   8.146
    2    HA   SER  20           HA       SER  20  14.120  -1.470  10.686
    3    HB2  SER  20           HB2      SER  20  14.743  -3.886  10.001
    4    HB3  SER  20           HB3      SER  20  16.406  -3.304   9.988
    5    HG   SER  20           HG       SER  20  14.589  -3.538  12.117

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LEU  21           H        LEU  21  16.964  -1.419   8.551
    2    HA   LEU  21           HA       LEU  21  18.646   0.054  10.293
    3    HB2  LEU  21           HB2      LEU  21  18.625  -0.209   7.278
    4    HB3  LEU  21           HB3      LEU  21  19.884   0.640   8.171
    5    HG   LEU  21           HG       LEU  21  19.124  -2.251   8.692
    6   HD12  LEU  21          HD11      LEU  21  21.427  -1.144   7.054
    7   HD11  LEU  21          HD12      LEU  21  20.004  -1.945   6.393
    8   HD13  LEU  21          HD13      LEU  21  21.128  -2.847   7.407
    9   HD21  LEU  21          HD21      LEU  21  21.214  -0.359   9.737
   10   HD23  LEU  21          HD22      LEU  21  21.639  -2.061   9.596
   11   HD22  LEU  21          HD23      LEU  21  20.292  -1.577  10.612

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ALA  22           H        ALA  22  16.389   1.041   7.739
    2    HA   ALA  22           HA       ALA  22  16.942   3.796   7.760
    3    HB3  ALA  22           HB1      ALA  22  15.534   2.566   6.078
    4    HB2  ALA  22           HB2      ALA  22  14.835   4.081   6.648
    5    HB1  ALA  22           HB3      ALA  22  14.236   2.544   7.271

  No H/Q in entry =           5
  In of MODEL   55
    1    H    TYR  23           H        TYR  23  14.435   1.990   9.589
    2    HA   TYR  23           HA       TYR  23  13.484   4.229  11.044
    3    HB2  TYR  23           HB2      TYR  23  12.236   2.123  11.017
    4    HB3  TYR  23           HB3      TYR  23  13.563   1.302  11.839
    5    HD1  TYR  23           HD1      TYR  23  11.090   4.072  12.216
    6    HD2  TYR  23           HD2      TYR  23  13.749   1.340  14.194
    7    HE1  TYR  23           HE1      TYR  23  10.167   4.764  14.413
    8    HE2  TYR  23           HE2      TYR  23  12.826   2.031  16.389
    9    HH   TYR  23           HH       TYR  23   9.968   3.866  16.686

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ALA  24           H        ALA  24  16.116   1.936  11.676
    2    HA   ALA  24           HA       ALA  24  16.791   2.921  14.242
    3    HB1  ALA  24           HB1      ALA  24  18.137   1.121  14.074
    4    HB3  ALA  24           HB2      ALA  24  19.170   2.039  12.977
    5    HB2  ALA  24           HB3      ALA  24  17.870   1.040  12.333

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ALA  25           H        ALA  25  17.755   3.853  10.966
    2    HA   ALA  25           HA       ALA  25  19.711   5.774  11.618
    3    HB1  ALA  25           HB1      ALA  25  18.990   4.836   9.300
    4    HB3  ALA  25           HB2      ALA  25  19.502   6.520   9.397
    5    HB2  ALA  25           HB3      ALA  25  17.785   6.124   9.326

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LEU  26           H        LEU  26  16.198   6.025  11.255
    2    HA   LEU  26           HA       LEU  26  15.991   8.807  11.713
    3    HB2  LEU  26           HB2      LEU  26  14.122   7.586  10.781
    4    HB3  LEU  26           HB3      LEU  26  14.024   6.555  12.204
    5    HG   LEU  26           HG       LEU  26  13.430   8.513  13.589
    6   HD12  LEU  26          HD11      LEU  26  12.783  10.621  12.269
    7   HD11  LEU  26          HD12      LEU  26  13.760   9.965  10.958
    8   HD13  LEU  26          HD13      LEU  26  14.507  10.342  12.511
    9   HD21  LEU  26          HD21      LEU  26  11.754   8.217  11.078
   10   HD23  LEU  26          HD22      LEU  26  11.197   8.915  12.596
   11   HD22  LEU  26          HD23      LEU  26  11.638   7.210  12.521

  No H/Q in entry =          11
  In of MODEL   55
    1    H    LYS  27           H        LYS  27  15.864   6.023  13.899
    2    HA   LYS  27           HA       LYS  27  15.279   7.387  16.271
    3    HB2  LYS  27           HB2      LYS  27  15.291   4.912  15.999
    4    HB3  LYS  27           HB3      LYS  27  17.054   4.953  15.957
    5    HG2  LYS  27           HG2      LYS  27  17.110   5.932  18.209
    6    HG3  LYS  27           HG3      LYS  27  15.343   5.963  18.254
    7    HD2  LYS  27           HD2      LYS  27  15.301   3.496  18.011
    8    HD3  LYS  27           HD3      LYS  27  17.066   3.474  18.000
    9    HE2  LYS  27           HE2      LYS  27  17.105   4.457  20.259
   10    HE3  LYS  27           HE3      LYS  27  15.340   4.509  20.273
   11    HZ3  LYS  27           HZ1      LYS  27  16.114   2.548  21.419
   12    HZ2  LYS  27           HZ2      LYS  27  17.027   2.066  20.067
   13    HZ1  LYS  27           HZ3      LYS  27  15.329   2.084  19.987

  No H/Q in entry =          13
  In of MODEL   55
    1    H    GLN  28           H        GLN  28  18.392   6.786  14.679
    2    HA   GLN  28           HA       GLN  28  20.083   7.852  16.673
    3    HB2  GLN  28           HB2      GLN  28  20.374   7.817  13.657
    4    HB3  GLN  28           HB3      GLN  28  21.663   8.268  14.772
    5    HG2  GLN  28           HG2      GLN  28  20.214   5.606  14.799
    6    HG3  GLN  28           HG3      GLN  28  21.798   5.879  14.077
    7   HE21  GLN  28          HE21      GLN  28  20.547   4.530  16.754
    8   HE22  GLN  28          HE22      GLN  28  21.729   4.946  17.898

  No H/Q in entry =           8
  In of MODEL   55
    1    H    ALA  29           H        ALA  29  18.344   9.355  13.983
    2    HA   ALA  29           HA       ALA  29  19.363  11.968  14.244
    3    HB2  ALA  29           HB1      ALA  29  17.670  12.622  12.773
    4    HB1  ALA  29           HB2      ALA  29  16.516  11.456  13.421
    5    HB3  ALA  29           HB3      ALA  29  17.843  10.906  12.397

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LYS  30           H        LYS  30  16.573  10.386  15.759
    2    HA   LYS  30           HA       LYS  30  15.576  12.644  17.122
    3    HB2  LYS  30           HB2      LYS  30  15.440   9.703  17.818
    4    HB3  LYS  30           HB3      LYS  30  14.584  10.958  18.714
    5    HG2  LYS  30           HG2      LYS  30  13.466  11.658  16.597
    6    HG3  LYS  30           HG3      LYS  30  14.260  10.318  15.767
    7    HD2  LYS  30           HD2      LYS  30  13.174   8.715  17.291
    8    HD3  LYS  30           HD3      LYS  30  12.390  10.045  18.145
    9    HE2  LYS  30           HE2      LYS  30  11.228  10.693  16.054
   10    HE3  LYS  30           HE3      LYS  30  11.992   9.335  15.220
   11    HZ2  LYS  30           HZ1      LYS  30   9.680   8.943  16.098
   12    HZ1  LYS  30           HZ2      LYS  30  10.347   8.986  17.665
   13    HZ3  LYS  30           HZ3      LYS  30  10.846   7.799  16.552

  No H/Q in entry =          13
  In of MODEL   55
    1    H    GLN  31           H        GLN  31  18.218  10.450  17.854
    2    HA   GLN  31           HA       GLN  31  18.553  11.455  20.551
    3    HB2  GLN  31           HB2      GLN  31  20.563   9.871  18.943
    4    HB3  GLN  31           HB3      GLN  31  20.430   9.992  20.698
    5    HG2  GLN  31           HG2      GLN  31  17.908   9.063  19.926
    6    HG3  GLN  31           HG3      GLN  31  19.003   8.212  18.844
    7   HE21  GLN  31          HE21      GLN  31  17.449   7.073  21.116
    8   HE22  GLN  31          HE22      GLN  31  18.599   6.400  22.165

  No H/Q in entry =           8
  In of MODEL   55
    1    H    GLY  32           H        GLY  32  19.085  12.776  17.589
    2    HA3  GLY  32           HA2      GLY  32  20.087  14.814  17.080
    3    HA2  GLY  32           HA3      GLY  32  20.844  14.808  18.669

  No H/Q in entry =           3
  In of MODEL   55
    1    H    ASP  33           H        ASP  33  21.242  11.916  16.884
    2    HA   ASP  33           HA       ASP  33  24.073  12.569  16.421
    3    HB2  ASP  33           HB2      ASP  33  22.542   9.965  16.529
    4    HB3  ASP  33           HB3      ASP  33  24.230  10.069  16.035

  No H/Q in entry =           4
  In of MODEL   55
    1    H    PHE  34           H        PHE  34  23.604  13.901  14.543
    2    HA   PHE  34           HA       PHE  34  22.247  12.935  12.252
    3    HB2  PHE  34           HB2      PHE  34  24.396  15.050  12.489
    4    HB3  PHE  34           HB3      PHE  34  23.409  14.772  11.056
    5    HD1  PHE  34           HD1      PHE  34  23.675  16.696  13.975
    6    HD2  PHE  34           HD2      PHE  34  20.781  14.611  11.582
    7    HE1  PHE  34           HE1      PHE  34  21.870  18.106  14.925
    8    HE2  PHE  34           HE2      PHE  34  18.980  16.021  12.535
    9    HZ   PHE  34           HZ       PHE  34  19.528  17.769  14.202

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ALA  35           H        ALA  35  25.620  12.716  13.261
    2    HA   ALA  35           HA       ALA  35  26.719  11.893  10.802
    3    HB3  ALA  35           HB1      ALA  35  28.389  10.705  12.519
    4    HB2  ALA  35           HB2      ALA  35  27.534  11.734  13.667
    5    HB1  ALA  35           HB3      ALA  35  28.377  12.454  12.297

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ALA  36           H        ALA  36  25.586   9.938  13.562
    2    HA   ALA  36           HA       ALA  36  26.051   7.450  12.279
    3    HB2  ALA  36           HB1      ALA  36  25.614   6.702  14.353
    4    HB3  ALA  36           HB2      ALA  36  23.930   7.210  14.203
    5    HB1  ALA  36           HB3      ALA  36  25.139   8.331  14.830

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ALA  37           H        ALA  37  23.246   9.598  12.418
    2    HA   ALA  37           HA       ALA  37  21.377   7.846  11.237
    3    HB3  ALA  37           HB1      ALA  37  21.625  10.806  11.537
    4    HB1  ALA  37           HB2      ALA  37  20.305   9.737  12.006
    5    HB2  ALA  37           HB3      ALA  37  20.498  10.212  10.318

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LYS  38           H        LYS  38  23.495  10.295   9.765
    2    HA   LYS  38           HA       LYS  38  22.854   9.880   7.086
    3    HB2  LYS  38           HB2      LYS  38  24.674  11.420   8.536
    4    HB3  LYS  38           HB3      LYS  38  25.700  10.425   7.509
    5    HG2  LYS  38           HG2      LYS  38  24.542  11.210   5.514
    6    HG3  LYS  38           HG3      LYS  38  23.354  12.070   6.497
    7    HD2  LYS  38           HD2      LYS  38  24.960  13.655   7.254
    8    HD3  LYS  38           HD3      LYS  38  26.313  12.661   6.716
    9    HE2  LYS  38           HE2      LYS  38  25.970  14.539   5.170
   10    HE3  LYS  38           HE3      LYS  38  25.625  13.006   4.361
   11    HZ3  LYS  38           HZ1      LYS  38  23.431  13.467   4.232
   12    HZ2  LYS  38           HZ2      LYS  38  23.965  15.078   4.324
   13    HZ1  LYS  38           HZ3      LYS  38  23.385  14.294   5.714

  No H/Q in entry =          13
  In of MODEL   55
    1    H    ALA  39           H        ALA  39  25.356   8.259   9.039
    2    HA   ALA  39           HA       ALA  39  26.414   6.669   6.966
    3    HB2  ALA  39           HB1      ALA  39  26.318   5.698   9.807
    4    HB1  ALA  39           HB2      ALA  39  27.281   7.118   9.395
    5    HB3  ALA  39           HB3      ALA  39  27.622   5.567   8.627

  No H/Q in entry =           5
  In of MODEL   55
    1    H    MET  40           H        MET  40  23.797   6.064   9.261
    2    HA   MET  40           HA       MET  40  23.335   3.364   8.520
    3    HB2  MET  40           HB2      MET  40  21.532   5.417   9.817
    4    HB3  MET  40           HB3      MET  40  21.114   3.711   9.637
    5    HG2  MET  40           HG2      MET  40  23.670   4.631  10.981
    6    HG3  MET  40           HG3      MET  40  22.173   4.363  11.873
    7    HE3  MET  40           HE1      MET  40  21.586   0.733  12.039
    8    HE2  MET  40           HE2      MET  40  20.726   2.044  11.235
    9    HE1  MET  40           HE3      MET  40  21.468   2.322  12.809

  No H/Q in entry =           9
  In of MODEL   55
    1    H    MET  41           H        MET  41  21.942   6.430   7.340
    2    HA   MET  41           HA       MET  41  19.978   5.252   5.664
    3    HB2  MET  41           HB2      MET  41  21.476   7.834   5.159
    4    HB3  MET  41           HB3      MET  41  19.945   7.352   4.438
    5    HG2  MET  41           HG2      MET  41  19.197   7.162   6.989
    6    HG3  MET  41           HG3      MET  41  20.513   8.310   7.214
    7    HE2  MET  41           HE1      MET  41  19.960   9.611   3.881
    8    HE1  MET  41           HE2      MET  41  20.919  10.040   5.294
    9    HE3  MET  41           HE3      MET  41  19.653  11.130   4.732

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ASP  42           H        ASP  42  23.356   6.155   5.115
    2    HA   ASP  42           HA       ASP  42  23.446   5.688   2.356
    3    HB2  ASP  42           HB2      ASP  42  25.203   6.670   4.128
    4    HB3  ASP  42           HB3      ASP  42  25.850   5.041   3.996

  No H/Q in entry =           4
  In of MODEL   55
    1    H    GLN  43           H        GLN  43  24.156   3.522   5.071
    2    HA   GLN  43           HA       GLN  43  24.807   1.264   3.482
    3    HB2  GLN  43           HB2      GLN  43  23.784   1.446   6.326
    4    HB3  GLN  43           HB3      GLN  43  24.354  -0.044   5.567
    5    HG2  GLN  43           HG2      GLN  43  26.525   1.154   5.060
    6    HG3  GLN  43           HG3      GLN  43  25.950   2.482   6.063
    7   HE21  GLN  43          HE21      GLN  43  28.177   1.493   7.097
    8   HE22  GLN  43          HE22      GLN  43  27.896   0.408   8.370

  No H/Q in entry =           8
  In of MODEL   55
    1    H    SER  44           H        SER  44  21.757   2.413   4.869
    2    HA   SER  44           HA       SER  44  20.175   0.181   4.190
    3    HB2  SER  44           HB2      SER  44  19.749   2.710   5.343
    4    HB3  SER  44           HB3      SER  44  18.714   2.677   3.917
    5    HG   SER  44           HG       SER  44  17.615   1.736   5.637

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ARG  45           H        ARG  45  20.937   3.146   2.394
    2    HA   ARG  45           HA       ARG  45  19.409   2.676   0.087
    3    HB2  ARG  45           HB2      ARG  45  20.566   4.804   0.678
    4    HB3  ARG  45           HB3      ARG  45  22.106   4.040   0.290
    5    HG2  ARG  45           HG2      ARG  45  21.321   3.646  -2.025
    6    HG3  ARG  45           HG3      ARG  45  19.793   4.432  -1.637
    7    HD2  ARG  45           HD2      ARG  45  21.057   6.519  -1.047
    8    HD3  ARG  45           HD3      ARG  45  22.548   5.738  -1.617
    9    HE   ARG  45           HE       ARG  45  20.617   5.518  -3.654
   10   HH21  ARG  45          HH11      ARG  45  20.619   6.892  -5.414
   11   HH22  ARG  45          HH12      ARG  45  21.386   8.437  -5.305
   12   HH11  ARG  45          HH21      ARG  45  22.363   8.001  -2.020
   13   HH12  ARG  45          HH22      ARG  45  22.372   9.064  -3.381

  No H/Q in entry =          13
  In of MODEL   55
    1    H    MET  46           H        MET  46  22.767   1.777   0.833
    2    HA   MET  46           HA       MET  46  23.365   0.587  -1.655
    3    HB2  MET  46           HB2      MET  46  24.470   0.250   1.134
    4    HB3  MET  46           HB3      MET  46  25.119  -0.649  -0.242
    5    HG2  MET  46           HG2      MET  46  25.587   1.448  -1.425
    6    HG3  MET  46           HG3      MET  46  24.877   2.372  -0.107
    7    HE3  MET  46           HE1      MET  46  27.409  -0.863   0.151
    8    HE2  MET  46           HE2      MET  46  28.826   0.103  -0.248
    9    HE1  MET  46           HE3      MET  46  27.465   0.043  -1.366

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ALA  47           H        ALA  47  21.973  -0.744   1.318
    2    HA   ALA  47           HA       ALA  47  21.900  -3.454   0.508
    3    HB2  ALA  47           HB1      ALA  47  21.525  -2.997   2.814
    4    HB3  ALA  47           HB2      ALA  47  19.984  -3.587   2.194
    5    HB1  ALA  47           HB3      ALA  47  20.226  -1.859   2.457

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LEU  48           H        LEU  48  19.566  -0.809   0.159
    2    HA   LEU  48           HA       LEU  48  17.510  -2.325  -1.095
    3    HB2  LEU  48           HB2      LEU  48  18.186   0.625  -1.203
    4    HB3  LEU  48           HB3      LEU  48  16.710  -0.073  -1.870
    5    HG   LEU  48           HG       LEU  48  17.562  -0.388   1.017
    6   HD13  LEU  48          HD11      LEU  48  17.162   1.916   0.836
    7   HD12  LEU  48          HD12      LEU  48  15.599   1.279   1.345
    8   HD11  LEU  48          HD13      LEU  48  15.872   1.703  -0.346
    9   HD22  LEU  48          HD21      LEU  48  16.020  -2.090   0.633
   10   HD21  LEU  48          HD22      LEU  48  15.153  -1.178  -0.603
   11   HD23  LEU  48          HD23      LEU  48  14.944  -0.776   1.102

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ASN  49           H        ASN  49  20.212  -0.414  -2.323
    2    HA   ASN  49           HA       ASN  49  19.558  -0.486  -5.046
    3    HB2  ASN  49           HB2      ASN  49  21.250   1.016  -4.123
    4    HB3  ASN  49           HB3      ASN  49  22.268  -0.354  -3.692
    5   HD21  ASN  49          HD21      ASN  49  23.300   1.634  -5.368
    6   HD22  ASN  49          HD22      ASN  49  23.469   1.021  -6.941

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLU  50           H        GLU  50  21.527  -2.701  -3.090
    2    HA   GLU  50           HA       GLU  50  22.213  -4.457  -5.221
    3    HB2  GLU  50           HB2      GLU  50  23.413  -4.446  -3.056
    4    HB3  GLU  50           HB3      GLU  50  21.966  -5.064  -2.260
    5    HG2  GLU  50           HG2      GLU  50  22.038  -7.095  -3.623
    6    HG3  GLU  50           HG3      GLU  50  23.418  -6.471  -4.524

  No H/Q in entry =           6
  In of MODEL   55
    1    H    ALA  51           H        ALA  51  19.559  -4.376  -2.892
    2    HA   ALA  51           HA       ALA  51  18.373  -6.838  -3.654
    3    HB3  ALA  51           HB1      ALA  51  16.786  -6.323  -2.096
    4    HB1  ALA  51           HB2      ALA  51  16.585  -4.674  -2.691
    5    HB2  ALA  51           HB3      ALA  51  17.942  -5.073  -1.637

  No H/Q in entry =           5
  In of MODEL   55
    1    H    HIS  52           H        HIS  52  17.812  -3.483  -4.681
    2    HA   HIS  52           HA       HIS  52  15.693  -3.989  -6.480
    3    HB2  HIS  52           HB2      HIS  52  16.370  -1.731  -5.671
    4    HB3  HIS  52           HB3      HIS  52  17.813  -1.838  -6.678
    5    HD1  HIS  52           HD1      HIS  52  17.416  -1.958  -9.305
    6    HD2  HIS  52           HD2      HIS  52  14.023  -1.062  -7.054
    7    HE1  HIS  52           HE1      HIS  52  15.692  -1.062 -10.932
    8    HE2  HIS  52           HE2      HIS  52  13.618  -0.511  -9.574

  No H/Q in entry =           8
  In of MODEL   55
    1    H    LEU  53           H        LEU  53  19.211  -4.022  -6.916
    2    HA   LEU  53           HA       LEU  53  19.263  -4.332  -9.717
    3    HB2  LEU  53           HB2      LEU  53  21.192  -5.116  -7.547
    4    HB3  LEU  53           HB3      LEU  53  21.504  -5.497  -9.239
    5    HG   LEU  53           HG       LEU  53  20.850  -2.686  -8.301
    6   HD11  LEU  53          HD11      LEU  53  23.513  -4.100  -8.544
    7   HD13  LEU  53          HD12      LEU  53  22.864  -3.245  -7.145
    8   HD12  LEU  53          HD13      LEU  53  23.365  -2.346  -8.572
    9   HD21  LEU  53          HD21      LEU  53  21.935  -3.914 -10.842
   10   HD23  LEU  53          HD22      LEU  53  22.269  -2.232 -10.443
   11   HD22  LEU  53          HD23      LEU  53  20.614  -2.765 -10.671

  No H/Q in entry =          11
  In of MODEL   55
    1    H    VAL  54           H        VAL  54  19.135  -6.723  -7.096
    2    HA   VAL  54           HA       VAL  54  19.239  -9.015  -8.760
    3    HB   VAL  54           HB       VAL  54  18.091  -8.588  -5.991
    4   HG12  VAL  54          HG11      VAL  54  18.396 -11.208  -5.992
    5   HG11  VAL  54          HG12      VAL  54  18.210 -11.035  -7.737
    6   HG13  VAL  54          HG13      VAL  54  16.927 -10.497  -6.656
    7   HG22  VAL  54          HG21      VAL  54  20.408  -8.395  -5.770
    8   HG21  VAL  54          HG22      VAL  54  20.736  -9.487  -7.113
    9   HG23  VAL  54          HG23      VAL  54  20.203 -10.133  -5.561

  No H/Q in entry =           9
  In of MODEL   55
    1    H    GLN  55           H        GLN  55  16.526  -7.095  -7.471
    2    HA   GLN  55           HA       GLN  55  14.492  -8.742  -8.545
    3    HB2  GLN  55           HB2      GLN  55  13.757  -7.214  -6.915
    4    HB3  GLN  55           HB3      GLN  55  14.559  -5.850  -7.690
    5    HG2  GLN  55           HG2      GLN  55  12.835  -5.511  -9.177
    6    HG3  GLN  55           HG3      GLN  55  12.501  -7.229  -9.350
    7   HE21  GLN  55          HE21      GLN  55  10.491  -7.765  -8.543
    8   HE22  GLN  55          HE22      GLN  55   9.724  -7.008  -7.233

  No H/Q in entry =           8
  In of MODEL   55
    1    H    THR  56           H        THR  56  16.250  -5.952  -9.902
    2    HA   THR  56           HA       THR  56  14.812  -5.576 -12.248
    3    HB   THR  56           HB       THR  56  17.832  -5.510 -12.095
    4    HG1  THR  56           HG1      THR  56  16.260  -4.305 -10.494
    5   HG23  THR  56          HG21      THR  56  16.999  -5.182 -14.332
    6   HG22  THR  56          HG22      THR  56  17.459  -3.602 -13.701
    7   HG21  THR  56          HG23      THR  56  15.757  -4.066 -13.759

  No H/Q in entry =           7
  In of MODEL   55
    1    H    LYS  57           H        LYS  57  17.446  -7.892 -11.643
    2    HA   LYS  57           HA       LYS  57  17.436  -9.083 -14.224
    3    HB2  LYS  57           HB2      LYS  57  19.239  -9.363 -12.517
    4    HB3  LYS  57           HB3      LYS  57  18.130 -10.305 -11.531
    5    HG2  LYS  57           HG2      LYS  57  19.491 -11.870 -12.728
    6    HG3  LYS  57           HG3      LYS  57  17.898 -11.908 -13.475
    7    HD2  LYS  57           HD2      LYS  57  18.626 -10.637 -15.350
    8    HD3  LYS  57           HD3      LYS  57  20.114 -10.146 -14.542
    9    HE2  LYS  57           HE2      LYS  57  19.443 -13.014 -15.292
   10    HE3  LYS  57           HE3      LYS  57  20.486 -11.963 -16.248
   11    HZ2  LYS  57           HZ1      LYS  57  20.940 -12.843 -13.453
   12    HZ1  LYS  57           HZ2      LYS  57  21.900 -11.705 -14.270
   13    HZ3  LYS  57           HZ3      LYS  57  21.824 -13.308 -14.824

  No H/Q in entry =          13
  In of MODEL   55
    1    H    LEU  58           H        LEU  58  15.654  -9.743 -11.247
    2    HA   LEU  58           HA       LEU  58  14.417 -12.107 -12.184
    3    HB2  LEU  58           HB2      LEU  58  13.637 -10.200  -9.985
    4    HB3  LEU  58           HB3      LEU  58  12.820 -11.732 -10.302
    5    HG   LEU  58           HG       LEU  58  15.795 -11.474  -9.751
    6   HD11  LEU  58          HD11      LEU  58  13.424 -11.879  -7.956
    7   HD13  LEU  58          HD12      LEU  58  14.883 -10.926  -7.694
    8   HD12  LEU  58          HD13      LEU  58  14.945 -12.682  -7.561
    9   HD22  LEU  58          HD21      LEU  58  15.663 -13.533 -10.782
   10   HD21  LEU  58          HD22      LEU  58  13.948 -13.733 -10.419
   11   HD23  LEU  58          HD23      LEU  58  15.156 -14.043  -9.172

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  59           H        ILE  59  13.766  -8.765 -12.861
    2    HA   ILE  59           HA       ILE  59  11.045  -9.395 -13.798
    3    HB   ILE  59           HB       ILE  59  11.862  -7.121 -12.589
    4   HG12  ILE  59          HG12      ILE  59   9.967  -6.963 -14.943
    5   HG13  ILE  59          HG13      ILE  59   9.535  -7.756 -13.450
    6   HG21  ILE  59          HG21      ILE  59  13.413  -6.727 -14.641
    7   HG23  ILE  59          HG22      ILE  59  12.443  -5.384 -14.083
    8   HG22  ILE  59          HG23      ILE  59  11.947  -6.311 -15.496
    9   HD11  ILE  59          HD11      ILE  59  10.080  -5.659 -12.209
   10   HD13  ILE  59          HD12      ILE  59   8.749  -5.463 -13.347
   11   HD12  ILE  59          HD13      ILE  59  10.358  -4.869 -13.761

  No H/Q in entry =          11
  In of MODEL   55
    1    H    GLU  60           H        GLU  60  14.252  -8.561 -15.059
    2    HA   GLU  60           HA       GLU  60  13.472  -8.152 -17.766
    3    HB2  GLU  60           HB2      GLU  60  15.656  -7.431 -16.922
    4    HB3  GLU  60           HB3      GLU  60  16.108  -9.106 -16.612
    5    HG2  GLU  60           HG2      GLU  60  15.894  -9.604 -19.031
    6    HG3  GLU  60           HG3      GLU  60  15.471  -7.921 -19.332

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLY  61           H        GLY  61  14.433 -11.042 -15.957
    2    HA3  GLY  61           HA2      GLY  61  13.878 -12.683 -18.360
    3    HA2  GLY  61           HA3      GLY  61  14.909 -13.173 -17.020

  No H/Q in entry =           3
  In of MODEL   55
    1    H    ASP  62           H        ASP  62  11.798 -11.608 -16.644
    2    HA   ASP  62           HA       ASP  62  10.864 -13.591 -14.839
    3    HB2  ASP  62           HB2      ASP  62   8.779 -12.291 -14.868
    4    HB3  ASP  62           HB3      ASP  62  10.187 -11.250 -14.674

  No H/Q in entry =           4
  In of MODEL   55
    1    H    ALA  63           H        ALA  63  11.272 -15.437 -16.510
    2    HA   ALA  63           HA       ALA  63   9.459 -15.824 -18.681
    3    HB3  ALA  63           HB1      ALA  63  10.129 -18.276 -18.354
    4    HB2  ALA  63           HB2      ALA  63  11.158 -17.706 -17.042
    5    HB1  ALA  63           HB3      ALA  63  11.436 -17.140 -18.689

  No H/Q in entry =           5
  In of MODEL   55
    1    H    GLY  64           H        GLY  64   9.421 -16.755 -15.280
    2    HA3  GLY  64           HA2      GLY  64   7.667 -17.288 -13.883
    3    HA2  GLY  64           HA3      GLY  64   6.561 -16.887 -15.190

  No H/Q in entry =           3
  In of MODEL   55
    1    H    GLU  65           H        GLU  65   5.679 -18.933 -13.851
    2    HA   GLU  65           HA       GLU  65   6.796 -21.457 -14.431
    3    HB2  GLU  65           HB2      GLU  65   3.993 -20.664 -13.652
    4    HB3  GLU  65           HB3      GLU  65   4.539 -22.335 -13.780
    5    HG2  GLU  65           HG2      GLU  65   6.273 -21.934 -12.108
    6    HG3  GLU  65           HG3      GLU  65   5.823 -20.232 -12.015

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLY  66           H        GLY  66   4.339 -19.576 -16.035
    2    HA3  GLY  66           HA2      GLY  66   4.064 -21.550 -18.187
    3    HA2  GLY  66           HA3      GLY  66   2.953 -20.239 -17.851

  No H/Q in entry =           3
  In of MODEL   55
    1    H    LYS  67           H        LYS  67   3.408 -20.358 -20.332
    2    HA   LYS  67           HA       LYS  67   5.769 -19.337 -21.419
    3    HB2  LYS  67           HB2      LYS  67   2.948 -19.331 -22.489
    4    HB3  LYS  67           HB3      LYS  67   4.381 -18.936 -23.446
    5    HG2  LYS  67           HG2      LYS  67   5.361 -21.141 -22.856
    6    HG3  LYS  67           HG3      LYS  67   3.895 -21.539 -21.966
    7    HD2  LYS  67           HD2      LYS  67   3.876 -20.802 -24.899
    8    HD3  LYS  67           HD3      LYS  67   4.015 -22.466 -24.329
    9    HE2  LYS  67           HE2      LYS  67   1.908 -22.015 -22.946
   10    HE3  LYS  67           HE3      LYS  67   1.722 -20.542 -23.898
   11    HZ2  LYS  67           HZ1      LYS  67   0.534 -22.587 -24.735
   12    HZ1  LYS  67           HZ2      LYS  67   2.061 -23.198 -25.154
   13    HZ3  LYS  67           HZ3      LYS  67   1.493 -21.763 -25.865

  No H/Q in entry =          13
  In of MODEL   55
    1    H    MET  68           H        MET  68   2.794 -17.558 -21.809
    2    HA   MET  68           HA       MET  68   4.005 -15.028 -22.064
    3    HB2  MET  68           HB2      MET  68   1.137 -15.799 -21.515
    4    HB3  MET  68           HB3      MET  68   1.676 -14.184 -21.979
    5    HG2  MET  68           HG2      MET  68   2.133 -16.697 -23.612
    6    HG3  MET  68           HG3      MET  68   0.882 -15.496 -23.934
    7    HE1  MET  68           HE1      MET  68   1.135 -13.253 -24.218
    8    HE3  MET  68           HE2      MET  68   2.391 -12.470 -25.171
    9    HE2  MET  68           HE3      MET  68   2.548 -12.551 -23.417

  No H/Q in entry =           9
  In of MODEL   55
    1    H    LYS  69           H        LYS  69   2.429 -16.542 -19.238
    2    HA   LYS  69           HA       LYS  69   2.289 -14.215 -17.665
    3    HB2  LYS  69           HB2      LYS  69   2.307 -17.135 -16.918
    4    HB3  LYS  69           HB3      LYS  69   2.034 -15.840 -15.751
    5    HG2  LYS  69           HG2      LYS  69   0.144 -15.010 -17.097
    6    HG3  LYS  69           HG3      LYS  69   0.415 -16.295 -18.274
    7    HD2  LYS  69           HD2      LYS  69  -0.029 -17.987 -16.539
    8    HD3  LYS  69           HD3      LYS  69  -0.299 -16.705 -15.356
    9    HE2  LYS  69           HE2      LYS  69  -2.170 -15.841 -16.707
   10    HE3  LYS  69           HE3      LYS  69  -1.898 -17.110 -17.901
   11    HZ3  LYS  69           HZ1      LYS  69  -3.611 -17.870 -16.506
   12    HZ2  LYS  69           HZ2      LYS  69  -2.786 -17.413 -15.093
   13    HZ1  LYS  69           HZ3      LYS  69  -2.227 -18.721 -16.021

  No H/Q in entry =          13
  In of MODEL   55
    1    H    VAL  70           H        VAL  70   3.326 -14.285 -15.296
    2    HA   VAL  70           HA       VAL  70   6.259 -14.632 -15.557
    3    HB   VAL  70           HB       VAL  70   6.522 -12.532 -14.265
    4   HG11  VAL  70          HG11      VAL  70   4.885 -12.276 -16.807
    5   HG13  VAL  70          HG12      VAL  70   6.635 -12.467 -16.719
    6   HG12  VAL  70          HG13      VAL  70   5.878 -10.996 -16.110
    7   HG22  VAL  70          HG21      VAL  70   4.577 -12.161 -13.026
    8   HG21  VAL  70          HG22      VAL  70   3.526 -12.664 -14.349
    9   HG23  VAL  70          HG23      VAL  70   4.286 -11.073 -14.383

  No H/Q in entry =           9
  In of MODEL   55
    1    H    SER  71           H        SER  71   7.337 -14.632 -13.396
    2    HA   SER  71           HA       SER  71   6.268 -16.589 -11.664
    3    HB2  SER  71           HB2      SER  71   8.704 -15.996 -11.898
    4    HB3  SER  71           HB3      SER  71   8.378 -14.528 -10.981
    5    HG   SER  71           HG       SER  71   7.515 -15.946  -9.330

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LEU  72           H        LEU  72   4.893 -16.449 -10.020
    2    HA   LEU  72           HA       LEU  72   3.359 -14.127  -9.570
    3    HB2  LEU  72           HB2      LEU  72   3.631 -16.691  -8.009
    4    HB3  LEU  72           HB3      LEU  72   2.474 -15.427  -7.599
    5    HG   LEU  72           HG       LEU  72   2.613 -16.720 -10.343
    6   HD13  LEU  72          HD11      LEU  72   2.001 -18.487  -8.866
    7   HD12  LEU  72          HD12      LEU  72   0.477 -17.874  -9.506
    8   HD11  LEU  72          HD13      LEU  72   0.999 -17.418  -7.885
    9   HD21  LEU  72          HD21      LEU  72   0.757 -14.791  -8.961
   10   HD23  LEU  72          HD22      LEU  72   0.119 -15.845 -10.214
   11   HD22  LEU  72          HD23      LEU  72   1.411 -14.710 -10.592

  No H/Q in entry =          11
  In of MODEL   55
    1    H    VAL  73           H        VAL  73   6.007 -15.585  -7.801
    2    HA   VAL  73           HA       VAL  73   5.957 -14.056  -5.466
    3    HB   VAL  73           HB       VAL  73   8.097 -14.914  -5.016
    4   HG12  VAL  73          HG11      VAL  73   7.123 -16.980  -6.971
    5   HG11  VAL  73          HG12      VAL  73   6.142 -16.573  -5.563
    6   HG13  VAL  73          HG13      VAL  73   7.774 -17.204  -5.349
    7   HG23  VAL  73          HG21      VAL  73   9.479 -15.903  -6.933
    8   HG22  VAL  73          HG22      VAL  73   9.368 -14.143  -6.883
    9   HG21  VAL  73          HG23      VAL  73   8.381 -15.056  -8.024

  No H/Q in entry =           9
  In of MODEL   55
    1    H    LEU  74           H        LEU  74   6.952 -13.162  -8.640
    2    HA   LEU  74           HA       LEU  74   8.909 -11.227  -8.144
    3    HB2  LEU  74           HB2      LEU  74   8.447 -11.969 -10.384
    4    HB3  LEU  74           HB3      LEU  74   6.786 -11.387 -10.282
    5    HG   LEU  74           HG       LEU  74   7.616  -9.068 -10.057
    6   HD12  LEU  74          HD11      LEU  74  10.112  -8.790 -10.659
    7   HD11  LEU  74          HD12      LEU  74  10.282 -10.482 -10.196
    8   HD13  LEU  74          HD13      LEU  74   9.737  -9.294  -9.012
    9   HD21  LEU  74          HD21      LEU  74   7.337 -10.483 -12.281
   10   HD23  LEU  74          HD22      LEU  74   9.055 -10.175 -12.386
   11   HD22  LEU  74          HD23      LEU  74   7.941  -8.828 -12.317

  No H/Q in entry =          11
  In of MODEL   55
    1    H    VAL  75           H        VAL  75   5.416 -10.819  -8.496
    2    HA   VAL  75           HA       VAL  75   5.338  -8.063  -7.903
    3    HB   VAL  75           HB       VAL  75   3.233 -10.193  -7.518
    4   HG11  VAL  75          HG11      VAL  75   3.063  -7.150  -7.366
    5   HG13  VAL  75          HG12      VAL  75   2.764  -8.280  -6.053
    6   HG12  VAL  75          HG13      VAL  75   1.671  -8.228  -7.428
    7   HG21  VAL  75          HG21      VAL  75   4.078  -9.719  -9.847
    8   HG23  VAL  75          HG22      VAL  75   3.579  -8.043  -9.634
    9   HG22  VAL  75          HG23      VAL  75   2.373  -9.329  -9.626

  No H/Q in entry =           9
  In of MODEL   55
    1    H    GLU  76           H        GLU  76   5.065 -10.943  -5.800
    2    HA   GLU  76           HA       GLU  76   4.603  -9.584  -3.376
    3    HB2  GLU  76           HB2      GLU  76   4.417 -12.052  -3.625
    4    HB3  GLU  76           HB3      GLU  76   6.155 -12.156  -3.845
    5    HG2  GLU  76           HG2      GLU  76   5.676 -12.741  -1.553
    6    HG3  GLU  76           HG3      GLU  76   6.442 -11.163  -1.533

  No H/Q in entry =           6
  In of MODEL   55
    1    H    ALA  77           H        ALA  77   7.657 -10.508  -4.940
    2    HA   ALA  77           HA       ALA  77   9.353  -9.480  -2.921
    3    HB2  ALA  77           HB1      ALA  77  11.120  -9.590  -4.600
    4    HB3  ALA  77           HB2      ALA  77   9.919  -9.738  -5.884
    5    HB1  ALA  77           HB3      ALA  77  10.107 -11.031  -4.700

  No H/Q in entry =           5
  In of MODEL   55
    1    H    GLN  78           H        GLN  78   7.972  -8.047  -5.833
    2    HA   GLN  78           HA       GLN  78   9.341  -5.577  -5.722
    3    HB2  GLN  78           HB2      GLN  78   8.039  -6.479  -7.682
    4    HB3  GLN  78           HB3      GLN  78   6.559  -6.092  -6.807
    5    HG2  GLN  78           HG2      GLN  78   7.229  -3.726  -6.710
    6    HG3  GLN  78           HG3      GLN  78   8.715  -4.106  -7.579
    7   HE21  GLN  78          HE21      GLN  78   6.830  -2.266  -8.683
    8   HE22  GLN  78          HE22      GLN  78   6.130  -2.973 -10.058

  No H/Q in entry =           8
  In of MODEL   55
    1    H    LEU  79           H        LEU  79   6.313  -6.697  -4.297
    2    HA   LEU  79           HA       LEU  79   5.335  -4.285  -3.283
    3    HB2  LEU  79           HB2      LEU  79   4.006  -6.327  -3.233
    4    HB3  LEU  79           HB3      LEU  79   5.145  -7.077  -2.118
    5    HG   LEU  79           HG       LEU  79   4.603  -5.435  -0.388
    6   HD13  LEU  79          HD11      LEU  79   4.153  -3.415  -1.435
    7   HD12  LEU  79          HD12      LEU  79   2.523  -3.930  -0.998
    8   HD11  LEU  79          HD13      LEU  79   3.104  -4.153  -2.647
    9   HD23  LEU  79          HD21      LEU  79   2.013  -5.909  -0.302
   10   HD22  LEU  79          HD22      LEU  79   3.142  -7.257  -0.195
   11   HD21  LEU  79          HD23      LEU  79   2.333  -6.910  -1.720

  No H/Q in entry =          11
  In of MODEL   55
    1    H    HIS  80           H        HIS  80   7.499  -6.640  -1.703
    2    HA   HIS  80           HA       HIS  80   7.796  -5.105   0.670
    3    HB2  HIS  80           HB2      HIS  80   9.118  -7.476  -0.533
    4    HB3  HIS  80           HB3      HIS  80  10.034  -6.588   0.687
    5    HD1  HIS  80           HD1      HIS  80   9.536  -7.226   3.028
    6    HD2  HIS  80           HD2      HIS  80   6.316  -8.047   0.510
    7    HE1  HIS  80           HE1      HIS  80   7.754  -8.319   4.472
    8    HE2  HIS  80           HE2      HIS  80   5.785  -8.823   2.945

  No H/Q in entry =           8
  In of MODEL   55
    1    H    LEU  81           H        LEU  81   9.803  -5.389  -2.241
    2    HA   LEU  81           HA       LEU  81  11.859  -3.666  -1.356
    3    HB2  LEU  81           HB2      LEU  81  10.936  -4.446  -4.122
    4    HB3  LEU  81           HB3      LEU  81  12.363  -3.451  -3.827
    5    HG   LEU  81           HG       LEU  81  11.948  -6.172  -2.560
    6   HD12  LEU  81          HD11      LEU  81  13.761  -6.808  -4.309
    7   HD11  LEU  81          HD12      LEU  81  13.208  -5.378  -5.178
    8   HD13  LEU  81          HD13      LEU  81  12.086  -6.694  -4.844
    9   HD23  LEU  81          HD21      LEU  81  14.578  -5.877  -2.542
   10   HD22  LEU  81          HD22      LEU  81  13.600  -5.112  -1.291
   11   HD21  LEU  81          HD23      LEU  81  14.188  -4.161  -2.655

  No H/Q in entry =          11
  In of MODEL   55
    1    H    MET  82           H        MET  82   8.944  -3.002  -3.295
    2    HA   MET  82           HA       MET  82   9.507  -0.280  -3.789
    3    HB2  MET  82           HB2      MET  82   6.934  -1.853  -3.672
    4    HB3  MET  82           HB3      MET  82   6.949  -0.128  -4.032
    5    HG2  MET  82           HG2      MET  82   8.534  -2.211  -5.570
    6    HG3  MET  82           HG3      MET  82   6.973  -1.575  -6.083
    7    HE3  MET  82           HE1      MET  82   7.452   1.879  -7.247
    8    HE2  MET  82           HE2      MET  82   7.073   1.652  -5.541
    9    HE1  MET  82           HE3      MET  82   6.400   0.551  -6.739

  No H/Q in entry =           9
  In of MODEL   55
    1    H    THR  83           H        THR  83   7.698  -1.869  -1.191
    2    HA   THR  83           HA       THR  83   6.864   0.484   0.140
    3    HB   THR  83           HB       THR  83   6.714  -1.094   2.154
    4    HG1  THR  83           HG1      THR  83   7.455  -3.050   1.921
    5   HG22  THR  83          HG21      THR  83   5.050  -2.643   0.680
    6   HG21  THR  83          HG22      THR  83   5.289  -1.314  -0.449
    7   HG23  THR  83          HG23      THR  83   4.649  -0.997   1.164

  No H/Q in entry =           7
  In of MODEL   55
    1    H    SER  84           H        SER  84   9.669  -1.639   0.660
    2    HA   SER  84           HA       SER  84  10.738  -0.223   2.853
    3    HB2  SER  84           HB2      SER  84  11.978  -2.072   0.826
    4    HB3  SER  84           HB3      SER  84  12.929  -1.329   2.111
    5    HG   SER  84           HG       SER  84  10.640  -3.000   2.363

  No H/Q in entry =           5
  In of MODEL   55
    1    H    MET  85           H        MET  85  11.498   0.039  -0.633
    2    HA   MET  85           HA       MET  85  13.513   1.986  -0.374
    3    HB2  MET  85           HB2      MET  85  13.118   0.718  -2.444
    4    HB3  MET  85           HB3      MET  85  11.590   1.570  -2.672
    5    HG2  MET  85           HG2      MET  85  12.773   3.712  -2.818
    6    HG3  MET  85           HG3      MET  85  14.307   2.905  -2.508
    7    HE1  MET  85           HE1      MET  85  11.287   3.339  -4.596
    8    HE3  MET  85           HE2      MET  85  11.264   1.619  -4.978
    9    HE2  MET  85           HE3      MET  85  11.679   2.783  -6.231

  No H/Q in entry =           9
  In of MODEL   55
    1    H    LEU  86           H        LEU  86  10.028   2.353  -0.888
    2    HA   LEU  86           HA       LEU  86   9.989   5.167  -1.064
    3    HB2  LEU  86           HB2      LEU  86   8.131   3.525  -1.646
    4    HB3  LEU  86           HB3      LEU  86   7.798   3.435   0.083
    5    HG   LEU  86           HG       LEU  86   7.660   5.997   0.036
    6   HD11  LEU  86          HD11      LEU  86   8.436   5.560  -2.666
    7   HD13  LEU  86          HD12      LEU  86   8.013   7.090  -1.902
    8   HD12  LEU  86          HD13      LEU  86   6.769   6.140  -2.712
    9   HD23  LEU  86          HD21      LEU  86   5.517   4.667  -1.633
   10   HD22  LEU  86          HD22      LEU  86   5.336   5.926  -0.414
   11   HD21  LEU  86          HD23      LEU  86   5.720   4.277   0.076

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ALA  87           H        ALA  87   9.499   2.987   1.677
    2    HA   ALA  87           HA       ALA  87   8.965   4.902   3.649
    3    HB1  ALA  87           HB1      ALA  87   9.746   2.074   3.558
    4    HB3  ALA  87           HB2      ALA  87   8.627   2.894   4.644
    5    HB2  ALA  87           HB3      ALA  87  10.356   2.909   4.991

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ARG  88           H        ARG  88  12.037   3.451   2.670
    2    HA   ARG  88           HA       ARG  88  13.656   4.810   4.508
    3    HB2  ARG  88           HB2      ARG  88  14.308   2.833   3.101
    4    HB3  ARG  88           HB3      ARG  88  14.473   3.928   1.731
    5    HG2  ARG  88           HG2      ARG  88  15.956   5.224   3.682
    6    HG3  ARG  88           HG3      ARG  88  16.260   3.531   4.058
    7    HD2  ARG  88           HD2      ARG  88  17.526   3.226   2.212
    8    HD3  ARG  88           HD3      ARG  88  16.399   4.111   1.179
    9    HE   ARG  88           HE       ARG  88  18.802   5.150   2.232
   10   HH21  ARG  88          HH11      ARG  88  19.168   7.366   2.043
   11   HH22  ARG  88          HH12      ARG  88  17.828   8.450   1.900
   12   HH11  ARG  88          HH21      ARG  88  15.470   5.934   1.951
   13   HH12  ARG  88          HH22      ARG  88  15.732   7.637   1.824

  No H/Q in entry =          13
  In of MODEL   55
    1    H    GLU  89           H        GLU  89  12.696   5.724   1.185
    2    HA   GLU  89           HA       GLU  89  14.265   8.070   1.036
    3    HB2  GLU  89           HB2      GLU  89  13.113   7.044  -0.915
    4    HB3  GLU  89           HB3      GLU  89  11.573   7.598  -0.258
    5    HG2  GLU  89           HG2      GLU  89  12.297   9.929  -0.415
    6    HG3  GLU  89           HG3      GLU  89  13.897   9.425  -0.951

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LEU  90           H        LEU  90  10.929   7.589   2.160
    2    HA   LEU  90           HA       LEU  90  10.439  10.326   2.741
    3    HB2  LEU  90           HB2      LEU  90   9.219   7.761   3.761
    4    HB3  LEU  90           HB3      LEU  90   8.603   9.361   4.187
    5    HG   LEU  90           HG       LEU  90   9.016   8.484   1.316
    6   HD12  LEU  90          HD11      LEU  90   6.479   8.178   1.375
    7   HD11  LEU  90          HD12      LEU  90   6.632   8.163   3.132
    8   HD13  LEU  90          HD13      LEU  90   7.440   6.928   2.166
    9   HD22  LEU  90          HD21      LEU  90   8.744  10.795   1.248
   10   HD21  LEU  90          HD22      LEU  90   7.756  10.833   2.707
   11   HD23  LEU  90          HD23      LEU  90   7.055  10.288   1.183

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  91           H        ILE  91  11.675   7.628   4.659
    2    HA   ILE  91           HA       ILE  91  11.825   8.987   7.130
    3    HB   ILE  91           HB       ILE  91  13.358   6.636   6.003
    4   HG12  ILE  91          HG12      ILE  91  11.341   6.817   8.261
    5   HG13  ILE  91          HG13      ILE  91  10.870   6.544   6.584
    6   HG22  ILE  91          HG21      ILE  91  13.823   6.412   8.644
    7   HG21  ILE  91          HG22      ILE  91  13.764   8.172   8.547
    8   HG23  ILE  91          HG23      ILE  91  14.935   7.275   7.582
    9   HD13  ILE  91          HD11      ILE  91  11.853   4.434   6.510
   10   HD12  ILE  91          HD12      ILE  91  11.258   4.494   8.170
   11   HD11  ILE  91          HD13      ILE  91  12.963   4.792   7.834

  No H/Q in entry =          11
  In of MODEL   55
    1    H    THR  92           H        THR  92  14.043   8.803   4.381
    2    HA   THR  92           HA       THR  92  16.220  10.174   5.546
    3    HB   THR  92           HB       THR  92  15.236  10.064   2.684
    4    HG1  THR  92           HG1      THR  92  16.050   8.159   3.085
    5   HG22  THR  92          HG21      THR  92  17.812  10.731   2.394
    6   HG21  THR  92          HG22      THR  92  17.510  11.552   3.925
    7   HG23  THR  92          HG23      THR  92  16.545  11.951   2.505

  No H/Q in entry =           7
  In of MODEL   55
    1    H    GLU  93           H        GLU  93  13.345  11.358   3.816
    2    HA   GLU  93           HA       GLU  93  13.965  14.112   3.937
    3    HB2  GLU  93           HB2      GLU  93  11.249  12.765   3.945
    4    HB3  GLU  93           HB3      GLU  93  11.552  14.462   3.578
    5    HG2  GLU  93           HG2      GLU  93  12.871  12.211   2.046
    6    HG3  GLU  93           HG3      GLU  93  11.332  12.909   1.559

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LEU  94           H        LEU  94  12.200  11.967   6.142
    2    HA   LEU  94           HA       LEU  94  11.407  13.917   8.022
    3    HB2  LEU  94           HB2      LEU  94  11.956  10.956   8.290
    4    HB3  LEU  94           HB3      LEU  94  11.391  11.934   9.641
    5    HG   LEU  94           HG       LEU  94   9.911  12.005   7.011
    6   HD11  LEU  94          HD11      LEU  94   9.971   9.779   9.011
    7   HD13  LEU  94          HD12      LEU  94   9.671   9.724   7.275
    8   HD12  LEU  94          HD13      LEU  94   8.396  10.250   8.373
    9   HD23  LEU  94          HD21      LEU  94   7.993  12.419   8.611
   10   HD22  LEU  94          HD22      LEU  94   9.244  13.661   8.652
   11   HD21  LEU  94          HD23      LEU  94   9.168  12.442   9.923

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  95           H        ILE  95  14.363  11.961   7.783
    2    HA   ILE  95           HA       ILE  95  15.537  12.867  10.200
    3    HB   ILE  95           HB       ILE  95  16.768  11.792   7.651
    4   HG12  ILE  95          HG12      ILE  95  16.459  10.588  10.415
    5   HG13  ILE  95          HG13      ILE  95  15.291  10.343   9.119
    6   HG21  ILE  95          HG21      ILE  95  18.029  12.581  10.296
    7   HG23  ILE  95          HG22      ILE  95  18.498  13.109   8.678
    8   HG22  ILE  95          HG23      ILE  95  18.788  11.445   9.183
    9   HD13  ILE  95          HD11      ILE  95  16.761   9.054   7.854
   10   HD12  ILE  95          HD12      ILE  95  17.228   8.597   9.489
   11   HD11  ILE  95          HD13      ILE  95  18.193   9.770   8.594

  No H/Q in entry =          11
  In of MODEL   55
    1    H    GLU  96           H        GLU  96  15.706  14.106   6.869
    2    HA   GLU  96           HA       GLU  96  17.571  16.166   7.352
    3    HB2  GLU  96           HB2      GLU  96  16.903  15.515   5.091
    4    HB3  GLU  96           HB3      GLU  96  15.264  16.087   5.391
    5    HG2  GLU  96           HG2      GLU  96  15.851  18.212   4.854
    6    HG3  GLU  96           HG3      GLU  96  17.148  18.198   6.037

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LEU  97           H        LEU  97  14.058  16.011   7.778
    2    HA   LEU  97           HA       LEU  97  13.666  18.747   8.426
    3    HB2  LEU  97           HB2      LEU  97  12.124  16.234   9.033
    4    HB3  LEU  97           HB3      LEU  97  11.625  17.784   9.707
    5    HG   LEU  97           HG       LEU  97  12.107  17.370   6.742
    6   HD12  LEU  97          HD11      LEU  97   9.582  17.266   6.622
    7   HD11  LEU  97          HD12      LEU  97   9.572  17.062   8.372
    8   HD13  LEU  97          HD13      LEU  97  10.343  15.850   7.347
    9   HD23  LEU  97          HD21      LEU  97  10.387  19.350   6.778
   10   HD22  LEU  97          HD22      LEU  97  12.071  19.693   7.172
   11   HD21  LEU  97          HD23      LEU  97  10.880  19.531   8.461

  No H/Q in entry =          11
  In of MODEL   55
    1    H    HIS  98           H        HIS  98  14.460  15.909  10.416
    2    HA   HIS  98           HA       HIS  98  14.312  17.165  12.934
    3    HB2  HIS  98           HB2      HIS  98  16.042  14.894  11.929
    4    HB3  HIS  98           HB3      HIS  98  16.044  15.429  13.611
    5    HD1  HIS  98           HD1      HIS  98  13.832  13.825  11.014
    6    HD2  HIS  98           HD2      HIS  98  13.730  14.737  15.080
    7    HE1  HIS  98           HE1      HIS  98  11.795  12.648  11.962
    8    HE2  HIS  98           HE2      HIS  98  11.713  13.194  14.434

  No H/Q in entry =           8
  In of MODEL   55
    1    H    GLU  99           H        GLU  99  16.866  17.032  10.501
    2    HA   GLU  99           HA       GLU  99  18.863  18.341  12.035
    3    HB2  GLU  99           HB2      GLU  99  19.332  17.054   9.963
    4    HB3  GLU  99           HB3      GLU  99  18.534  18.319   9.024
    5    HG2  GLU  99           HG2      GLU  99  20.158  19.972   9.820
    6    HG3  GLU  99           HG3      GLU  99  20.925  18.760  10.841

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LYS 100           H        LYS 100  16.352  19.532   9.819
    2    HA   LYS 100           HA       LYS 100  17.175  22.262   9.970
    3    HB2  LYS 100           HB2      LYS 100  14.531  21.000   9.211
    4    HB3  LYS 100           HB3      LYS 100  14.847  22.736   9.125
    5    HG2  LYS 100           HG2      LYS 100  16.816  22.271   7.658
    6    HG3  LYS 100           HG3      LYS 100  16.386  20.558   7.672
    7    HD2  LYS 100           HD2      LYS 100  14.196  21.091   6.671
    8    HD3  LYS 100           HD3      LYS 100  14.609  22.807   6.665
    9    HE2  LYS 100           HE2      LYS 100  16.565  22.311   5.205
   10    HE3  LYS 100           HE3      LYS 100  16.083  20.611   5.168
   11    HZ1  LYS 100           HZ1      LYS 100  14.280  22.823   4.337
   12    HZ3  LYS 100           HZ2      LYS 100  14.080  21.156   4.071
   13    HZ2  LYS 100           HZ3      LYS 100  15.299  22.008   3.252

  No H/Q in entry =          13
  In of MODEL   55
    1    H    LEU 101           H        LEU 101  15.057  20.231  11.929
    2    HA   LEU 101           HA       LEU 101  13.910  22.307  13.512
    3    HB2  LEU 101           HB2      LEU 101  14.323  19.352  13.889
    4    HB3  LEU 101           HB3      LEU 101  13.796  20.334  15.252
    5    HG   LEU 101           HG       LEU 101  12.380  20.443  12.582
    6   HD12  LEU 101          HD11      LEU 101  10.705  18.893  13.846
    7   HD11  LEU 101          HD12      LEU 101  12.095  18.464  14.841
    8   HD13  LEU 101          HD13      LEU 101  12.126  18.161  13.103
    9   HD21  LEU 101          HD21      LEU 101  11.730  21.236  15.436
   10   HD23  LEU 101          HD22      LEU 101  10.467  21.026  14.224
   11   HD22  LEU 101          HD23      LEU 101  11.714  22.249  13.990

  No H/Q in entry =          11
  In of MODEL   55
    1    H    LYS 102           H        LYS 102  17.052  21.669  13.076
    2    HA   LYS 102           HA       LYS 102  18.906  22.519  14.151
    3    HB2  LYS 102           HB2      LYS 102  17.106  24.049  15.287
    4    HB3  LYS 102           HB3      LYS 102  17.302  22.981  16.662
    5    HG2  LYS 102           HG2      LYS 102  19.216  24.976  15.499
    6    HG3  LYS 102           HG3      LYS 102  18.830  24.661  17.177
    7    HD2  LYS 102           HD2      LYS 102  20.479  22.736  15.487
    8    HD3  LYS 102           HD3      LYS 102  21.181  24.049  16.423
    9    HE2  LYS 102           HE2      LYS 102  20.756  21.502  17.386
   10    HE3  LYS 102           HE3      LYS 102  20.989  22.939  18.381
   11    HZ2  LYS 102           HZ1      LYS 102  19.007  21.674  18.994
   12    HZ1  LYS 102           HZ2      LYS 102  18.366  21.914  17.446
   13    HZ3  LYS 102           HZ3      LYS 102  18.609  23.239  18.475

  No H/Q in entry =          13
  In of MODEL   55
    1    H    ALA 103           H        ALA 103  16.817  20.928  16.568
    2    HA   ALA 103           HA       ALA 103  18.531  19.696  18.221
    3    HB2  ALA 103           HB1      ALA 103  16.926  17.705  18.209
    4    HB1  ALA 103           HB2      ALA 103  16.040  18.570  16.954
    5    HB3  ALA 103           HB3      ALA 103  16.224  19.285  18.554

  No H/Q in entry =           5
  In of MODEL   55
    1    H1   ALA   1           H3       ALA   1  -1.647  -6.855 -21.478
    2    H2   ALA   1           H2       ALA   1  -2.456  -8.283 -21.029
    3    H3   ALA   1           H1       ALA   1  -0.849  -8.348 -21.583
    4    HA   ALA   1           HA       ALA   1  -1.686  -8.804 -23.581
    5    HB1  ALA   1           HB1      ALA   1  -3.831  -9.500 -23.111
    6    HB2  ALA   1           HB2      ALA   1  -4.253  -7.983 -23.904
    7    HB3  ALA   1           HB3      ALA   1  -4.195  -8.069 -22.146

  No H/Q in entry =           7
  In of MODEL   55
    1    H    GLU   2           H        GLU   2  -2.502  -7.599 -25.568
    2    HA   GLU   2           HA       GLU   2  -1.081  -5.598 -26.439
    3    HB2  GLU   2           HB2      GLU   2  -4.089  -5.632 -26.759
    4    HB3  GLU   2           HB3      GLU   2  -2.958  -4.779 -27.806
    5    HG2  GLU   2           HG2      GLU   2  -2.474  -6.671 -28.965
    6    HG3  GLU   2           HG3      GLU   2  -2.188  -7.583 -27.490

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLU   3           H        GLU   3  -4.229  -4.310 -25.538
    2    HA   GLU   3           HA       GLU   3  -3.156  -1.767 -24.902
    3    HB2  GLU   3           HB2      GLU   3  -5.858  -3.054 -24.576
    4    HB3  GLU   3           HB3      GLU   3  -5.543  -1.443 -23.925
    5    HG2  GLU   3           HG2      GLU   3  -5.176  -0.515 -26.048
    6    HG3  GLU   3           HG3      GLU   3  -4.796  -2.072 -26.776

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LEU   4           H        LEU   4  -4.773  -4.114 -22.730
    2    HA   LEU   4           HA       LEU   4  -4.398  -2.897 -20.335
    3    HB2  LEU   4           HB2      LEU   4  -3.886  -5.842 -20.812
    4    HB3  LEU   4           HB3      LEU   4  -4.285  -5.096 -19.267
    5    HG   LEU   4           HG       LEU   4  -6.056  -5.144 -21.732
    6   HD13  LEU   4          HD11      LEU   4  -7.268  -6.851 -20.740
    7   HD12  LEU   4          HD12      LEU   4  -6.780  -6.401 -19.107
    8   HD11  LEU   4          HD13      LEU   4  -5.652  -7.254 -20.160
    9   HD23  LEU   4          HD21      LEU   4  -7.733  -4.320 -19.864
   10   HD22  LEU   4          HD22      LEU   4  -6.682  -3.158 -20.670
   11   HD21  LEU   4          HD23      LEU   4  -6.263  -3.757 -19.066

  No H/Q in entry =          11
  In of MODEL   55
    1    H    GLU   5           H        GLU   5  -1.918  -4.762 -22.069
    2    HA   GLU   5           HA       GLU   5   0.067  -4.504 -20.030
    3    HB2  GLU   5           HB2      GLU   5   0.094  -6.264 -21.809
    4    HB3  GLU   5           HB3      GLU   5   0.469  -5.010 -22.991
    5    HG2  GLU   5           HG2      GLU   5   2.556  -6.005 -22.335
    6    HG3  GLU   5           HG3      GLU   5   2.485  -4.416 -21.577

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLU   6           H        GLU   6  -0.547  -2.776 -23.071
    2    HA   GLU   6           HA       GLU   6   1.642  -0.968 -22.796
    3    HB2  GLU   6           HB2      GLU   6   0.533  -1.419 -24.962
    4    HB3  GLU   6           HB3      GLU   6  -0.933  -0.647 -24.359
    5    HG2  GLU   6           HG2      GLU   6   0.301   1.460 -24.033
    6    HG3  GLU   6           HG3      GLU   6   1.774   0.692 -24.622

  No H/Q in entry =           6
  In of MODEL   55
    1    H    VAL   7           H        VAL   7  -1.698  -1.007 -21.754
    2    HA   VAL   7           HA       VAL   7  -1.891   1.706 -20.910
    3    HB   VAL   7           HB       VAL   7  -3.381  -0.799 -20.082
    4   HG11  VAL   7          HG11      VAL   7  -3.726   2.092 -19.260
    5   HG13  VAL   7          HG12      VAL   7  -3.642   0.663 -18.229
    6   HG12  VAL   7          HG13      VAL   7  -5.071   0.951 -19.222
    7   HG21  VAL   7          HG21      VAL   7  -3.524   0.286 -22.467
    8   HG23  VAL   7          HG22      VAL   7  -4.457   1.543 -21.653
    9   HG22  VAL   7          HG23      VAL   7  -5.021  -0.129 -21.631

  No H/Q in entry =           9
  In of MODEL   55
    1    H    VAL   8           H        VAL   8  -0.937  -1.295 -19.274
    2    HA   VAL   8           HA       VAL   8  -0.609  -0.225 -16.676
    3    HB   VAL   8           HB       VAL   8   0.648  -2.585 -18.082
    4   HG13  VAL   8          HG11      VAL   8   2.301  -1.953 -16.488
    5   HG12  VAL   8          HG12      VAL   8   1.360  -3.218 -15.696
    6   HG11  VAL   8          HG13      VAL   8   1.087  -1.526 -15.282
    7   HG23  VAL   8          HG21      VAL   8  -0.862  -3.322 -15.785
    8   HG22  VAL   8          HG22      VAL   8  -1.318  -3.547 -17.470
    9   HG21  VAL   8          HG23      VAL   8  -1.821  -2.096 -16.612

  No H/Q in entry =           9
  In of MODEL   55
    1    H    MET   9           H        MET   9   1.639  -0.543 -19.422
    2    HA   MET   9           HA       MET   9   3.935   0.471 -18.156
    3    HB2  MET   9           HB2      MET   9   2.990   0.527 -21.022
    4    HB3  MET   9           HB3      MET   9   4.519   1.259 -20.536
    5    HG2  MET   9           HG2      MET   9   4.845  -1.099 -19.331
    6    HG3  MET   9           HG3      MET   9   3.728  -1.623 -20.593
    7    HE2  MET   9           HE1      MET   9   5.533  -0.080 -23.763
    8    HE1  MET   9           HE2      MET   9   4.472   0.773 -22.644
    9    HE3  MET   9           HE3      MET   9   4.064  -0.860 -23.163

  No H/Q in entry =           9
  In of MODEL   55
    1    H    GLY  10           H        GLY  10   1.270   2.108 -19.831
    2    HA3  GLY  10           HA2      GLY  10   2.264   4.750 -19.579
    3    HA2  GLY  10           HA3      GLY  10   0.569   4.310 -19.786

  No H/Q in entry =           3
  In of MODEL   55
    1    H    LEU  11           H        LEU  11   0.151   2.781 -17.504
    2    HA   LEU  11           HA       LEU  11  -0.357   4.758 -15.539
    3    HB2  LEU  11           HB2      LEU  11  -0.325   1.741 -15.392
    4    HB3  LEU  11           HB3      LEU  11  -0.823   2.766 -14.046
    5    HG   LEU  11           HG       LEU  11  -2.059   2.902 -16.810
    6   HD13  LEU  11          HD11      LEU  11  -2.668   0.764 -16.061
    7   HD12  LEU  11          HD12      LEU  11  -4.007   1.770 -15.513
    8   HD11  LEU  11          HD13      LEU  11  -2.757   1.272 -14.374
    9   HD22  LEU  11          HD21      LEU  11  -2.626   4.922 -15.798
   10   HD21  LEU  11          HD22      LEU  11  -2.560   4.250 -14.169
   11   HD23  LEU  11          HD23      LEU  11  -3.939   3.904 -15.212

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  12           H        ILE  12   2.156   2.262 -15.788
    2    HA   ILE  12           HA       ILE  12   3.367   2.778 -13.282
    3    HB   ILE  12           HB       ILE  12   4.606   1.729 -15.848
    4   HG12  ILE  12          HG12      ILE  12   2.585   0.516 -14.704
    5   HG13  ILE  12          HG13      ILE  12   3.976  -0.434 -15.184
    6   HG22  ILE  12          HG21      ILE  12   6.273   0.681 -14.262
    7   HG21  ILE  12          HG22      ILE  12   5.591   1.677 -12.977
    8   HG23  ILE  12          HG23      ILE  12   6.373   2.438 -14.362
    9   HD12  ILE  12          HD11      ILE  12   3.106  -0.959 -12.895
   10   HD11  ILE  12          HD12      ILE  12   3.521   0.683 -12.407
   11   HD13  ILE  12          HD13      ILE  12   4.780  -0.430 -12.895

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  13           H        ILE  13   3.984   4.044 -16.535
    2    HA   ILE  13           HA       ILE  13   6.142   5.736 -15.805
    3    HB   ILE  13           HB       ILE  13   4.114   5.843 -18.051
    4   HG12  ILE  13          HG12      ILE  13   5.918   3.981 -17.792
    5   HG13  ILE  13          HG13      ILE  13   5.715   4.754 -19.361
    6   HG22  ILE  13          HG21      ILE  13   5.906   7.400 -19.110
    7   HG21  ILE  13          HG22      ILE  13   6.441   7.679 -17.457
    8   HG23  ILE  13          HG23      ILE  13   4.796   8.101 -17.930
    9   HD11  ILE  13          HD11      ILE  13   7.703   5.935 -17.437
   10   HD13  ILE  13          HD12      ILE  13   7.712   5.922 -19.197
   11   HD12  ILE  13          HD13      ILE  13   8.127   4.461 -18.307

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ASN  14           H        ASN  14   2.642   6.274 -16.072
    2    HA   ASN  14           HA       ASN  14   2.632   9.018 -15.427
    3    HB2  ASN  14           HB2      ASN  14   0.719   7.401 -16.262
    4    HB3  ASN  14           HB3      ASN  14   0.396   7.222 -14.543
    5   HD21  ASN  14          HD21      ASN  14  -1.610   8.406 -15.972
    6   HD22  ASN  14          HD22      ASN  14  -1.652  10.079 -15.700

  No H/Q in entry =           6
  In of MODEL   55
    1    H    SER  15           H        SER  15   2.303   6.139 -13.359
    2    HA   SER  15           HA       SER  15   2.012   7.506 -10.906
    3    HB2  SER  15           HB2      SER  15   2.538   5.411  -9.863
    4    HB3  SER  15           HB3      SER  15   1.701   5.006 -11.358
    5    HG   SER  15           HG       SER  15   3.430   3.849 -11.689

  No H/Q in entry =           5
  In of MODEL   55
    1    H    GLY  16           H        GLY  16   4.875   6.380 -12.669
    2    HA3  GLY  16           HA2      GLY  16   6.808   7.109 -10.736
    3    HA2  GLY  16           HA3      GLY  16   7.109   6.908 -12.460

  No H/Q in entry =           3
  In of MODEL   55
    1    H    GLN  17           H        GLN  17   5.442   8.888 -13.517
    2    HA   GLN  17           HA       GLN  17   7.046  11.210 -13.202
    3    HB2  GLN  17           HB2      GLN  17   4.290  10.819 -14.403
    4    HB3  GLN  17           HB3      GLN  17   5.171  12.345 -14.473
    5    HG2  GLN  17           HG2      GLN  17   6.241   9.709 -15.515
    6    HG3  GLN  17           HG3      GLN  17   5.485  10.945 -16.520
    7   HE21  GLN  17          HE21      GLN  17   8.474   9.842 -15.789
    8   HE22  GLN  17          HE22      GLN  17   9.359  11.289 -15.861

  No H/Q in entry =           8
  In of MODEL   55
    1    H    ALA  18           H        ALA  18   3.934  10.223 -11.856
    2    HA   ALA  18           HA       ALA  18   3.236  12.616 -10.584
    3    HB1  ALA  18           HB1      ALA  18   2.080  10.173 -10.813
    4    HB2  ALA  18           HB2      ALA  18   1.544  11.395  -9.663
    5    HB3  ALA  18           HB3      ALA  18   2.620  10.100  -9.136

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ARG  19           H        ARG  19   5.079   9.829  -9.312
    2    HA   ARG  19           HA       ARG  19   5.624  10.974  -6.787
    3    HB2  ARG  19           HB2      ARG  19   6.013   8.569  -7.321
    4    HB3  ARG  19           HB3      ARG  19   7.374   9.043  -8.341
    5    HG2  ARG  19           HG2      ARG  19   8.504  10.066  -6.415
    6    HG3  ARG  19           HG3      ARG  19   7.124   9.689  -5.385
    7    HD2  ARG  19           HD2      ARG  19   8.869   8.035  -5.031
    8    HD3  ARG  19           HD3      ARG  19   7.487   7.269  -5.819
    9    HE   ARG  19           HE       ARG  19   9.200   8.076  -7.864
   10   HH21  ARG  19          HH11      ARG  19  10.746   6.657  -8.719
   11   HH22  ARG  19          HH12      ARG  19  11.277   5.301  -7.787
   12   HH11  ARG  19          HH21      ARG  19   9.250   6.037  -5.092
   13   HH12  ARG  19          HH22      ARG  19  10.427   4.949  -5.732

  No H/Q in entry =          13
  In of MODEL   55
    1    H    SER  20           H        SER  20   7.442  10.994  -9.836
    2    HA   SER  20           HA       SER  20   9.701  12.384  -9.008
    3    HB2  SER  20           HB2      SER  20   9.162  11.367 -11.322
    4    HB3  SER  20           HB3      SER  20   8.402  12.917 -11.669
    5    HG   SER  20           HG       SER  20  11.092  12.300 -11.142

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LEU  21           H        LEU  21   6.615  13.687 -10.201
    2    HA   LEU  21           HA       LEU  21   7.312  16.426  -9.969
    3    HB2  LEU  21           HB2      LEU  21   4.628  15.032  -9.887
    4    HB3  LEU  21           HB3      LEU  21   4.818  16.784  -9.899
    5    HG   LEU  21           HG       LEU  21   5.992  14.966 -12.024
    6   HD12  LEU  21          HD11      LEU  21   3.424  16.585 -12.104
    7   HD11  LEU  21          HD12      LEU  21   3.515  14.828 -11.982
    8   HD13  LEU  21          HD13      LEU  21   4.099  15.640 -13.433
    9   HD21  LEU  21          HD21      LEU  21   5.813  17.939 -11.595
   10   HD23  LEU  21          HD22      LEU  21   5.765  17.335 -13.249
   11   HD22  LEU  21          HD23      LEU  21   7.157  16.996 -12.233

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ALA  22           H        ALA  22   5.778  14.145  -7.728
    2    HA   ALA  22           HA       ALA  22   5.192  15.952  -5.656
    3    HB3  ALA  22           HB1      ALA  22   4.408  13.568  -5.825
    4    HB2  ALA  22           HB2      ALA  22   5.001  14.030  -4.229
    5    HB1  ALA  22           HB3      ALA  22   6.015  13.065  -5.303

  No H/Q in entry =           5
  In of MODEL   55
    1    H    TYR  23           H        TYR  23   8.107  13.901  -6.100
    2    HA   TYR  23           HA       TYR  23   9.499  14.901  -3.844
    3    HB2  TYR  23           HB2      TYR  23  10.267  12.890  -5.008
    4    HB3  TYR  23           HB3      TYR  23  10.590  13.830  -6.464
    5    HD1  TYR  23           HD1      TYR  23  11.547  13.478  -2.872
    6    HD2  TYR  23           HD2      TYR  23  12.639  14.978  -6.748
    7    HE1  TYR  23           HE1      TYR  23  13.810  14.032  -2.021
    8    HE2  TYR  23           HE2      TYR  23  14.900  15.533  -5.896
    9    HH   TYR  23           HH       TYR  23  16.064  14.391  -2.894

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ALA  24           H        ALA  24   9.326  16.019  -7.207
    2    HA   ALA  24           HA       ALA  24  11.240  18.087  -6.955
    3    HB2  ALA  24           HB1      ALA  24  10.798  18.159  -9.164
    4    HB3  ALA  24           HB2      ALA  24   9.249  18.921  -8.802
    5    HB1  ALA  24           HB3      ALA  24   9.359  17.167  -8.937

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ALA  25           H        ALA  25   7.759  17.930  -6.335
    2    HA   ALA  25           HA       ALA  25   7.302  20.650  -5.758
    3    HB1  ALA  25           HB1      ALA  25   5.624  18.666  -5.965
    4    HB2  ALA  25           HB2      ALA  25   5.267  19.954  -4.813
    5    HB3  ALA  25           HB3      ALA  25   5.944  18.427  -4.246

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LEU  26           H        LEU  26   8.348  17.957  -3.715
    2    HA   LEU  26           HA       LEU  26   8.464  19.380  -1.275
    3    HB2  LEU  26           HB2      LEU  26   8.541  16.963  -1.276
    4    HB3  LEU  26           HB3      LEU  26  10.011  16.962  -2.246
    5    HG   LEU  26           HG       LEU  26  11.234  18.066  -0.403
    6   HD12  LEU  26          HD11      LEU  26  10.008  18.077   1.857
    7   HD11  LEU  26          HD12      LEU  26   8.519  17.953   0.922
    8   HD13  LEU  26          HD13      LEU  26   9.575  19.352   0.716
    9   HD21  LEU  26          HD21      LEU  26   9.682  15.607   0.463
   10   HD23  LEU  26          HD22      LEU  26  11.202  16.157   1.162
   11   HD22  LEU  26          HD23      LEU  26  11.152  15.602  -0.509

  No H/Q in entry =          11
  In of MODEL   55
    1    H    LYS  27           H        LYS  27  10.877  18.796  -3.801
    2    HA   LYS  27           HA       LYS  27  13.070  20.018  -2.570
    3    HB2  LYS  27           HB2      LYS  27  13.162  18.676  -4.663
    4    HB3  LYS  27           HB3      LYS  27  12.406  20.015  -5.525
    5    HG2  LYS  27           HG2      LYS  27  14.282  21.486  -4.943
    6    HG3  LYS  27           HG3      LYS  27  15.033  20.186  -4.010
    7    HD2  LYS  27           HD2      LYS  27  15.167  18.803  -6.068
    8    HD3  LYS  27           HD3      LYS  27  14.461  20.128  -6.993
    9    HE2  LYS  27           HE2      LYS  27  16.359  21.579  -6.376
   10    HE3  LYS  27           HE3      LYS  27  17.068  20.258  -5.442
   11    HZ3  LYS  27           HZ1      LYS  27  18.059  20.356  -7.628
   12    HZ2  LYS  27           HZ2      LYS  27  16.532  20.250  -8.370
   13    HZ1  LYS  27           HZ3      LYS  27  17.145  18.933  -7.488

  No H/Q in entry =          13
  In of MODEL   55
    1    H    GLN  28           H        GLN  28  10.457  21.423  -4.515
    2    HA   GLN  28           HA       GLN  28  11.435  24.069  -4.661
    3    HB2  GLN  28           HB2      GLN  28   8.593  23.019  -4.550
    4    HB3  GLN  28           HB3      GLN  28   9.020  24.690  -4.925
    5    HG2  GLN  28           HG2      GLN  28   9.988  22.266  -6.471
    6    HG3  GLN  28           HG3      GLN  28   8.671  23.324  -6.976
    7   HE21  GLN  28          HE21      GLN  28  11.788  22.779  -7.727
    8   HE22  GLN  28          HE22      GLN  28  12.307  24.356  -8.081

  No H/Q in entry =           8
  In of MODEL   55
    1    H    ALA  29           H        ALA  29   9.491  22.384  -2.229
    2    HA   ALA  29           HA       ALA  29   8.957  24.575  -0.542
    3    HB2  ALA  29           HB1      ALA  29   8.217  23.008   1.023
    4    HB1  ALA  29           HB2      ALA  29   9.431  21.817   0.555
    5    HB3  ALA  29           HB3      ALA  29   8.047  22.122  -0.493

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LYS  30           H        LYS  30  11.672  22.290  -0.617
    2    HA   LYS  30           HA       LYS  30  12.996  23.230   1.688
    3    HB2  LYS  30           HB2      LYS  30  14.084  21.943  -0.826
    4    HB3  LYS  30           HB3      LYS  30  15.069  22.292   0.597
    5    HG2  LYS  30           HG2      LYS  30  13.507  20.916   1.973
    6    HG3  LYS  30           HG3      LYS  30  12.619  20.504   0.502
    7    HD2  LYS  30           HD2      LYS  30  14.657  19.507  -0.461
    8    HD3  LYS  30           HD3      LYS  30  15.564  19.933   0.991
    9    HE2  LYS  30           HE2      LYS  30  14.050  18.508   2.342
   10    HE3  LYS  30           HE3      LYS  30  13.173  18.061   0.873
   11    HZ2  LYS  30           HZ1      LYS  30  14.955  16.470   1.630
   12    HZ1  LYS  30           HZ2      LYS  30  16.099  17.651   1.182
   13    HZ3  LYS  30           HZ3      LYS  30  15.059  16.976   0.015

  No H/Q in entry =          13
  In of MODEL   55
    1    H    GLN  31           H        GLN  31  12.895  24.444  -1.605
    2    HA   GLN  31           HA       GLN  31  15.060  26.322  -1.179
    3    HB2  GLN  31           HB2      GLN  31  13.017  26.387  -3.404
    4    HB3  GLN  31           HB3      GLN  31  14.641  27.073  -3.403
    5    HG2  GLN  31           HG2      GLN  31  15.086  24.372  -2.834
    6    HG3  GLN  31           HG3      GLN  31  13.782  24.330  -4.013
    7   HE21  GLN  31          HE21      GLN  31  16.620  23.519  -4.419
    8   HE22  GLN  31          HE22      GLN  31  17.198  24.492  -5.683

  No H/Q in entry =           8
  In of MODEL   55
    1    H    GLY  32           H        GLY  32  11.984  26.156  -0.034
    2    HA3  GLY  32           HA2      GLY  32  10.838  27.729   1.243
    3    HA2  GLY  32           HA3      GLY  32  11.972  28.958   0.696

  No H/Q in entry =           3
  In of MODEL   55
    1    H    ASP  33           H        ASP  33  10.595  27.069  -1.801
    2    HA   ASP  33           HA       ASP  33   8.945  29.355  -2.650
    3    HB2  ASP  33           HB2      ASP  33  10.022  26.932  -4.099
    4    HB3  ASP  33           HB3      ASP  33   8.878  28.057  -4.826

  No H/Q in entry =           4
  In of MODEL   55
    1    H    PHE  34           H        PHE  34   7.254  28.886  -1.087
    2    HA   PHE  34           HA       PHE  34   5.858  26.422  -0.998
    3    HB2  PHE  34           HB2      PHE  34   4.915  29.214  -0.311
    4    HB3  PHE  34           HB3      PHE  34   4.057  27.728   0.097
    5    HD1  PHE  34           HD1      PHE  34   6.322  30.109   1.317
    6    HD2  PHE  34           HD2      PHE  34   5.615  25.872   1.253
    7    HE1  PHE  34           HE1      PHE  34   7.712  29.844   3.353
    8    HE2  PHE  34           HE2      PHE  34   7.007  25.612   3.286
    9    HZ   PHE  34           HZ       PHE  34   8.049  27.599   4.336

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ALA  35           H        ALA  35   5.446  29.294  -3.001
    2    HA   ALA  35           HA       ALA  35   2.891  28.699  -4.028
    3    HB1  ALA  35           HB1      ALA  35   3.951  30.089  -6.062
    4    HB3  ALA  35           HB2      ALA  35   5.171  30.440  -4.837
    5    HB2  ALA  35           HB3      ALA  35   3.483  30.859  -4.545

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ALA  36           H        ALA  36   6.115  28.008  -5.384
    2    HA   ALA  36           HA       ALA  36   5.116  26.591  -7.631
    3    HB3  ALA  36           HB1      ALA  36   7.276  26.704  -8.247
    4    HB2  ALA  36           HB2      ALA  36   7.751  25.668  -6.899
    5    HB1  ALA  36           HB3      ALA  36   7.657  27.416  -6.680

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ALA  37           H        ALA  37   6.067  25.582  -4.379
    2    HA   ALA  37           HA       ALA  37   5.991  22.796  -4.815
    3    HB2  ALA  37           HB1      ALA  37   5.741  24.582  -2.432
    4    HB1  ALA  37           HB2      ALA  37   6.866  23.258  -2.728
    5    HB3  ALA  37           HB3      ALA  37   5.203  22.914  -2.258

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LYS  38           H        LYS  38   3.471  25.017  -3.641
    2    HA   LYS  38           HA       LYS  38   1.361  23.216  -3.423
    3    HB2  LYS  38           HB2      LYS  38   1.730  25.969  -3.165
    4    HB3  LYS  38           HB3      LYS  38   0.529  25.833  -4.444
    5    HG2  LYS  38           HG2      LYS  38  -0.928  24.515  -3.004
    6    HG3  LYS  38           HG3      LYS  38   0.316  24.444  -1.748
    7    HD2  LYS  38           HD2      LYS  38   0.144  26.780  -1.295
    8    HD3  LYS  38           HD3      LYS  38  -0.766  27.079  -2.777
    9    HE2  LYS  38           HE2      LYS  38  -2.269  27.117  -0.837
   10    HE3  LYS  38           HE3      LYS  38  -2.651  25.746  -1.882
   11    HZ3  LYS  38           HZ1      LYS  38  -1.935  24.267  -0.353
   12    HZ2  LYS  38           HZ2      LYS  38  -2.278  25.523   0.740
   13    HZ1  LYS  38           HZ3      LYS  38  -0.685  25.264   0.213

  No H/Q in entry =          13
  In of MODEL   55
    1    H    ALA  39           H        ALA  39   2.352  25.120  -6.267
    2    HA   ALA  39           HA       ALA  39   0.271  24.270  -7.972
    3    HB2  ALA  39           HB1      ALA  39   3.011  24.903  -9.024
    4    HB1  ALA  39           HB2      ALA  39   2.052  26.169  -8.256
    5    HB3  ALA  39           HB3      ALA  39   1.434  25.339  -9.684

  No H/Q in entry =           5
  In of MODEL   55
    1    H    MET  40           H        MET  40   3.501  22.949  -7.396
    2    HA   MET  40           HA       MET  40   3.390  20.935  -9.392
    3    HB2  MET  40           HB2      MET  40   5.004  21.142  -6.844
    4    HB3  MET  40           HB3      MET  40   5.246  19.888  -8.061
    5    HG2  MET  40           HG2      MET  40   5.322  22.845  -8.719
    6    HG3  MET  40           HG3      MET  40   6.763  21.933  -8.273
    7    HE3  MET  40           HE1      MET  40   7.621  19.719 -11.087
    8    HE2  MET  40           HE2      MET  40   7.056  19.399  -9.450
    9    HE1  MET  40           HE3      MET  40   8.159  20.740  -9.747

  No H/Q in entry =           9
  In of MODEL   55
    1    H    MET  41           H        MET  41   2.476  20.974  -5.968
    2    HA   MET  41           HA       MET  41   1.927  18.212  -5.698
    3    HB2  MET  41           HB2      MET  41   0.609  20.574  -4.340
    4    HB3  MET  41           HB3      MET  41   0.443  18.895  -3.837
    5    HG2  MET  41           HG2      MET  41   3.155  19.102  -3.874
    6    HG3  MET  41           HG3      MET  41   2.724  20.762  -3.474
    7    HE2  MET  41           HE1      MET  41  -0.323  19.523  -1.751
    8    HE1  MET  41           HE2      MET  41   0.503  21.032  -2.124
    9    HE3  MET  41           HE3      MET  41   0.441  20.458  -0.458

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ASP  42           H        ASP  42  -0.095  20.951  -6.664
    2    HA   ASP  42           HA       ASP  42  -2.544  19.604  -6.804
    3    HB2  ASP  42           HB2      ASP  42  -1.822  22.171  -7.054
    4    HB3  ASP  42           HB3      ASP  42  -1.976  21.782  -8.764

  No H/Q in entry =           4
  In of MODEL   55
    1    H    GLN  43           H        GLN  43  -0.100  20.188  -9.305
    2    HA   GLN  43           HA       GLN  43  -1.495  18.882 -11.397
    3    HB2  GLN  43           HB2      GLN  43   1.466  19.380 -11.015
    4    HB3  GLN  43           HB3      GLN  43   0.749  18.748 -12.499
    5    HG2  GLN  43           HG2      GLN  43  -0.751  20.784 -12.534
    6    HG3  GLN  43           HG3      GLN  43   0.205  21.431 -11.205
    7   HE21  GLN  43          HE21      GLN  43   0.376  23.056 -13.287
    8   HE22  GLN  43          HE22      GLN  43   1.789  22.829 -14.195

  No H/Q in entry =           8
  In of MODEL   55
    1    H    SER  44           H        SER  44   0.850  17.722  -9.010
    2    HA   SER  44           HA       SER  44   1.170  15.116 -10.042
    3    HB2  SER  44           HB2      SER  44   2.073  16.545  -7.802
    4    HB3  SER  44           HB3      SER  44   1.203  15.164  -7.134
    5    HG   SER  44           HG       SER  44   3.311  14.534  -7.563

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ARG  45           H        ARG  45  -1.142  16.441  -7.700
    2    HA   ARG  45           HA       ARG  45  -2.541  14.086  -7.071
    3    HB2  ARG  45           HB2      ARG  45  -2.728  16.253  -5.874
    4    HB3  ARG  45           HB3      ARG  45  -3.581  16.928  -7.259
    5    HG2  ARG  45           HG2      ARG  45  -5.356  15.211  -6.980
    6    HG3  ARG  45           HG3      ARG  45  -4.515  14.590  -5.558
    7    HD2  ARG  45           HD2      ARG  45  -4.709  16.855  -4.496
    8    HD3  ARG  45           HD3      ARG  45  -5.693  17.384  -5.877
    9    HE   ARG  45           HE       ARG  45  -6.816  15.011  -4.843
   10   HH21  ARG  45          HH11      ARG  45  -8.651  15.093  -3.572
   11   HH22  ARG  45          HH12      ARG  45  -9.039  16.532  -2.699
   12   HH11  ARG  45          HH21      ARG  45  -6.253  18.252  -3.811
   13   HH12  ARG  45          HH22      ARG  45  -7.676  18.322  -2.833

  No H/Q in entry =          13
  In of MODEL   55
    1    H    MET  46           H        MET  46  -3.114  16.500  -9.615
    2    HA   MET  46           HA       MET  46  -5.459  15.343 -10.680
    3    HB2  MET  46           HB2      MET  46  -3.348  17.162 -11.848
    4    HB3  MET  46           HB3      MET  46  -4.732  16.615 -12.800
    5    HG2  MET  46           HG2      MET  46  -6.277  17.556 -11.160
    6    HG3  MET  46           HG3      MET  46  -4.935  18.027 -10.123
    7    HE3  MET  46           HE1      MET  46  -5.267  18.409 -14.209
    8    HE2  MET  46           HE2      MET  46  -6.317  19.816 -14.084
    9    HE1  MET  46           HE3      MET  46  -6.790  18.301 -13.317

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ALA  47           H        ALA  47  -2.032  14.848 -11.439
    2    HA   ALA  47           HA       ALA  47  -2.386  13.128 -13.654
    3    HB3  ALA  47           HB1      ALA  47  -0.204  14.006 -13.300
    4    HB2  ALA  47           HB2      ALA  47  -0.071  12.276 -12.971
    5    HB1  ALA  47           HB3      ALA  47  -0.159  13.425 -11.635

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LEU  48           H        LEU  48  -2.120  12.482 -10.182
    2    HA   LEU  48           HA       LEU  48  -2.227   9.643 -10.347
    3    HB2  LEU  48           HB2      LEU  48  -2.982  11.559  -8.129
    4    HB3  LEU  48           HB3      LEU  48  -2.897   9.808  -7.932
    5    HG   LEU  48           HG       LEU  48  -0.590  11.499  -8.925
    6   HD13  LEU  48          HD11      LEU  48  -0.869  12.265  -6.733
    7   HD12  LEU  48          HD12      LEU  48   0.288  10.951  -6.538
    8   HD11  LEU  48          HD13      LEU  48  -1.411  10.696  -6.141
    9   HD22  LEU  48          HD21      LEU  48  -0.101   9.313  -9.572
   10   HD21  LEU  48          HD22      LEU  48  -0.974   8.598  -8.217
   11   HD23  LEU  48          HD23      LEU  48   0.602   9.343  -7.955

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ASN  49           H        ASN  49  -4.679  12.146  -9.939
    2    HA   ASN  49           HA       ASN  49  -6.872  10.491  -9.404
    3    HB2  ASN  49           HB2      ASN  49  -6.916  12.913  -9.075
    4    HB3  ASN  49           HB3      ASN  49  -6.757  13.176 -10.808
    5   HD21  ASN  49          HD21      ASN  49  -8.959  14.253  -9.430
    6   HD22  ASN  49          HD22      ASN  49 -10.367  13.432  -9.897

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLU  50           H        GLU  50  -5.587  11.689 -12.489
    2    HA   GLU  50           HA       GLU  50  -7.547  10.447 -14.138
    3    HB2  GLU  50           HB2      GLU  50  -6.073  12.261 -14.947
    4    HB3  GLU  50           HB3      GLU  50  -4.684  11.182 -14.812
    5    HG2  GLU  50           HG2      GLU  50  -5.664   9.655 -16.452
    6    HG3  GLU  50           HG3      GLU  50  -7.120  10.641 -16.537

  No H/Q in entry =           6
  In of MODEL   55
    1    H    ALA  51           H        ALA  51  -4.382   9.437 -12.934
    2    HA   ALA  51           HA       ALA  51  -4.253   6.987 -14.358
    3    HB2  ALA  51           HB1      ALA  51  -2.274   6.687 -13.259
    4    HB1  ALA  51           HB2      ALA  51  -2.960   7.108 -11.690
    5    HB3  ALA  51           HB3      ALA  51  -2.498   8.380 -12.821

  No H/Q in entry =           5
  In of MODEL   55
    1    H    HIS  52           H        HIS  52  -5.423   7.816 -11.107
    2    HA   HIS  52           HA       HIS  52  -6.121   5.207 -10.283
    3    HB2  HIS  52           HB2      HIS  52  -5.972   7.187  -8.780
    4    HB3  HIS  52           HB3      HIS  52  -7.450   7.814  -9.510
    5    HD1  HIS  52           HD1      HIS  52  -9.652   6.374  -9.146
    6    HD2  HIS  52           HD2      HIS  52  -6.371   5.161  -6.881
    7    HE1  HIS  52           HE1      HIS  52 -10.553   4.839  -7.345
    8    HE2  HIS  52           HE2      HIS  52  -8.565   4.090  -5.954

  No H/Q in entry =           8
  In of MODEL   55
    1    H    LEU  53           H        LEU  53  -7.929   7.679 -12.065
    2    HA   LEU  53           HA       LEU  53 -10.440   6.399 -12.081
    3    HB2  LEU  53           HB2      LEU  53  -9.147   8.377 -13.947
    4    HB3  LEU  53           HB3      LEU  53 -10.750   7.723 -14.269
    5    HG   LEU  53           HG       LEU  53 -10.025   9.027 -11.625
    6   HD11  LEU  53          HD11      LEU  53 -11.120  10.232 -14.173
    7   HD13  LEU  53          HD12      LEU  53  -9.724  10.760 -13.234
    8   HD12  LEU  53          HD13      LEU  53 -11.351  10.986 -12.600
    9   HD21  LEU  53          HD21      LEU  53 -12.592   8.169 -12.973
   10   HD23  LEU  53          HD22      LEU  53 -12.599   9.435 -11.750
   11   HD22  LEU  53          HD23      LEU  53 -12.059   7.820 -11.335

  No H/Q in entry =          11
  In of MODEL   55
    1    H    VAL  54           H        VAL  54  -7.690   6.193 -14.318
    2    HA   VAL  54           HA       VAL  54  -8.922   4.434 -16.166
    3    HB   VAL  54           HB       VAL  54  -6.012   4.923 -15.481
    4   HG12  VAL  54          HG11      VAL  54  -5.770   3.843 -17.873
    5   HG11  VAL  54          HG12      VAL  54  -7.302   3.069 -17.472
    6   HG13  VAL  54          HG13      VAL  54  -5.888   2.804 -16.453
    7   HG22  VAL  54          HG21      VAL  54  -6.771   6.873 -16.522
    8   HG21  VAL  54          HG22      VAL  54  -7.968   6.018 -17.492
    9   HG23  VAL  54          HG23      VAL  54  -6.262   5.930 -17.922

  No H/Q in entry =           9
  In of MODEL   55
    1    H    GLN  55           H        GLN  55  -6.927   3.869 -13.267
    2    HA   GLN  55           HA       GLN  55  -6.852   1.053 -13.530
    3    HB2  GLN  55           HB2      GLN  55  -5.293   1.936 -12.008
    4    HB3  GLN  55           HB3      GLN  55  -6.504   2.907 -11.177
    5    HG2  GLN  55           HG2      GLN  55  -7.203   1.151  -9.864
    6    HG3  GLN  55           HG3      GLN  55  -6.984  -0.034 -11.145
    7   HE21  GLN  55          HE21      GLN  55  -5.369  -1.494 -10.654
    8   HE22  GLN  55          HE22      GLN  55  -3.983  -1.153  -9.740

  No H/Q in entry =           8
  In of MODEL   55
    1    H    THR  56           H        THR  56  -9.172   3.225 -11.911
    2    HA   THR  56           HA       THR  56 -10.768   1.347 -10.627
    3    HB   THR  56           HB       THR  56 -11.851   3.744 -12.129
    4    HG1  THR  56           HG1      THR  56  -9.934   3.835 -10.473
    5   HG23  THR  56          HG21      THR  56 -13.578   2.329 -11.204
    6   HG22  THR  56          HG22      THR  56 -13.433   3.754 -10.173
    7   HG21  THR  56          HG23      THR  56 -12.727   2.219  -9.663

  No H/Q in entry =           7
  In of MODEL   55
    1    H    LYS  57           H        LYS  57 -10.962   2.439 -14.011
    2    HA   LYS  57           HA       LYS  57 -13.127   0.766 -14.770
    3    HB2  LYS  57           HB2      LYS  57 -12.266   2.707 -16.091
    4    HB3  LYS  57           HB3      LYS  57 -10.803   1.793 -16.435
    5    HG2  LYS  57           HG2      LYS  57 -12.227   1.559 -18.346
    6    HG3  LYS  57           HG3      LYS  57 -12.268   0.021 -17.493
    7    HD2  LYS  57           HD2      LYS  57 -14.427   0.464 -16.582
    8    HD3  LYS  57           HD3      LYS  57 -14.349   2.168 -17.022
    9    HE2  LYS  57           HE2      LYS  57 -14.385  -0.116 -19.027
   10    HE3  LYS  57           HE3      LYS  57 -15.809   0.822 -18.576
   11    HZ2  LYS  57           HZ1      LYS  57 -13.333   1.866 -19.835
   12    HZ1  LYS  57           HZ2      LYS  57 -14.632   2.828 -19.309
   13    HZ3  LYS  57           HZ3      LYS  57 -14.854   1.708 -20.570

  No H/Q in entry =          13
  In of MODEL   55
    1    H    LEU  58           H        LEU  58  -9.626   0.315 -14.712
    2    HA   LEU  58           HA       LEU  58  -9.647  -2.199 -16.006
    3    HB2  LEU  58           HB2      LEU  58  -7.607  -0.923 -14.194
    4    HB3  LEU  58           HB3      LEU  58  -7.354  -2.444 -15.051
    5    HG   LEU  58           HG       LEU  58  -8.092   0.168 -16.409
    6   HD11  LEU  58          HD11      LEU  58  -5.453  -1.086 -15.719
    7   HD13  LEU  58          HD12      LEU  58  -5.939   0.608 -15.667
    8   HD12  LEU  58          HD13      LEU  58  -5.603  -0.162 -17.215
    9   HD22  LEU  58          HD21      LEU  58  -8.676  -1.387 -18.004
   10   HD21  LEU  58          HD22      LEU  58  -7.642  -2.642 -17.324
   11   HD23  LEU  58          HD23      LEU  58  -6.943  -1.371 -18.326

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  59           H        ILE  59 -10.466  -1.299 -12.754
    2    HA   ILE  59           HA       ILE  59 -10.131  -4.070 -11.812
    3    HB   ILE  59           HB       ILE  59  -9.674  -1.810 -10.408
    4   HG12  ILE  59          HG12      ILE  59 -11.064  -4.143  -9.077
    5   HG13  ILE  59          HG13      ILE  59  -9.429  -4.253  -9.680
    6   HG21  ILE  59          HG21      ILE  59 -12.207  -1.276 -10.663
    7   HG23  ILE  59          HG22      ILE  59 -11.494  -1.109  -9.075
    8   HG22  ILE  59          HG23      ILE  59 -12.450  -2.534  -9.474
    9   HD11  ILE  59          HD11      ILE  59  -8.808  -2.289  -8.292
   10   HD13  ILE  59          HD12      ILE  59  -9.347  -3.656  -7.327
   11   HD12  ILE  59          HD13      ILE  59 -10.433  -2.295  -7.614

  No H/Q in entry =          11
  In of MODEL   55
    1    H    GLU  60           H        GLU  60 -12.675  -1.739 -12.617
    2    HA   GLU  60           HA       GLU  60 -14.869  -3.245 -11.609
    3    HB2  GLU  60           HB2      GLU  60 -15.114  -0.889 -12.176
    4    HB3  GLU  60           HB3      GLU  60 -14.714  -1.220 -13.859
    5    HG2  GLU  60           HG2      GLU  60 -16.730  -2.687 -14.012
    6    HG3  GLU  60           HG3      GLU  60 -17.154  -2.224 -12.376

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLY  61           H        GLY  61 -13.193  -3.232 -14.722
    2    HA3  GLY  61           HA2      GLY  61 -14.918  -5.466 -15.618
    3    HA2  GLY  61           HA3      GLY  61 -14.066  -4.364 -16.693

  No H/Q in entry =           3
  In of MODEL   55
    1    H    ASP  62           H        ASP  62 -12.703  -5.827 -13.811
    2    HA   ASP  62           HA       ASP  62 -10.413  -6.758 -15.227
    3    HB2  ASP  62           HB2      ASP  62  -9.768  -7.685 -13.032
    4    HB3  ASP  62           HB3      ASP  62 -10.302  -6.013 -12.900

  No H/Q in entry =           4
  In of MODEL   55
    1    H    ALA  63           H        ALA  63 -11.849  -8.070 -16.837
    2    HA   ALA  63           HA       ALA  63 -13.021 -10.549 -16.036
    3    HB3  ALA  63           HB1      ALA  63 -12.608 -11.106 -18.528
    4    HB2  ALA  63           HB2      ALA  63 -11.943  -9.478 -18.655
    5    HB1  ALA  63           HB3      ALA  63 -13.628  -9.709 -18.184

  No H/Q in entry =           5
  In of MODEL   55
    1    H    GLY  64           H        GLY  64  -9.806  -9.600 -17.100
    2    HA3  GLY  64           HA2      GLY  64  -7.756 -10.606 -16.822
    3    HA2  GLY  64           HA3      GLY  64  -8.532 -11.800 -15.790

  No H/Q in entry =           3
  In of MODEL   55
    1    H    GLU  65           H        GLU  65  -6.715 -12.956 -17.211
    2    HA   GLU  65           HA       GLU  65  -7.337 -13.591 -19.891
    3    HB2  GLU  65           HB2      GLU  65  -5.618 -15.009 -17.860
    4    HB3  GLU  65           HB3      GLU  65  -5.731 -15.492 -19.552
    5    HG2  GLU  65           HG2      GLU  65  -4.949 -13.300 -20.274
    6    HG3  GLU  65           HG3      GLU  65  -4.934 -12.726 -18.608

  No H/Q in entry =           6
  In of MODEL   55
    1    H    GLY  66           H        GLY  66  -8.064 -15.188 -16.879
    2    HA3  GLY  66           HA2      GLY  66  -9.638 -17.267 -18.223
    3    HA2  GLY  66           HA3      GLY  66  -9.061 -17.326 -16.569

  No H/Q in entry =           3
  In of MODEL   55
    1    H    LYS  67           H        LYS  67 -11.477 -18.062 -16.667
    2    HA   LYS  67           HA       LYS  67 -13.550 -16.205 -16.881
    3    HB2  LYS  67           HB2      LYS  67 -13.392 -18.780 -15.317
    4    HB3  LYS  67           HB3      LYS  67 -14.886 -17.894 -15.651
    5    HG2  LYS  67           HG2      LYS  67 -14.407 -18.035 -18.084
    6    HG3  LYS  67           HG3      LYS  67 -12.959 -18.974 -17.730
    7    HD2  LYS  67           HD2      LYS  67 -15.717 -19.834 -16.829
    8    HD3  LYS  67           HD3      LYS  67 -15.016 -20.329 -18.372
    9    HE2  LYS  67           HE2      LYS  67 -12.980 -21.115 -17.020
   10    HE3  LYS  67           HE3      LYS  67 -13.994 -20.925 -15.590
   11    HZ2  LYS  67           HZ1      LYS  67 -13.949 -23.195 -16.677
   12    HZ1  LYS  67           HZ2      LYS  67 -14.870 -22.508 -17.927
   13    HZ3  LYS  67           HZ3      LYS  67 -15.478 -22.543 -16.343

  No H/Q in entry =          13
  In of MODEL   55
    1    H    MET  68           H        MET  68 -12.943 -17.737 -13.808
    2    HA   MET  68           HA       MET  68 -14.006 -15.655 -12.238
    3    HB2  MET  68           HB2      MET  68 -12.245 -17.988 -11.486
    4    HB3  MET  68           HB3      MET  68 -13.104 -16.964 -10.337
    5    HG2  MET  68           HG2      MET  68 -14.426 -18.543 -12.562
    6    HG3  MET  68           HG3      MET  68 -14.361 -19.046 -10.872
    7    HE1  MET  68           HE1      MET  68 -14.987 -17.838  -9.036
    8    HE3  MET  68           HE2      MET  68 -16.477 -16.907  -8.887
    9    HE2  MET  68           HE3      MET  68 -14.961 -16.079  -9.236

  No H/Q in entry =           9
  In of MODEL   55
    1    H    LYS  69           H        LYS  69 -10.599 -16.447 -12.984
    2    HA   LYS  69           HA       LYS  69  -9.453 -14.716 -11.093
    3    HB2  LYS  69           HB2      LYS  69  -8.380 -15.874 -13.662
    4    HB3  LYS  69           HB3      LYS  69  -7.388 -14.937 -12.542
    5    HG2  LYS  69           HG2      LYS  69  -7.936 -16.509 -10.724
    6    HG3  LYS  69           HG3      LYS  69  -8.951 -17.438 -11.826
    7    HD2  LYS  69           HD2      LYS  69  -6.985 -17.920 -13.237
    8    HD3  LYS  69           HD3      LYS  69  -5.967 -16.994 -12.133
    9    HE2  LYS  69           HE2      LYS  69  -6.556 -18.535 -10.295
   10    HE3  LYS  69           HE3      LYS  69  -7.566 -19.464 -11.399
   11    HZ3  LYS  69           HZ1      LYS  69  -5.518 -20.569 -11.326
   12    HZ2  LYS  69           HZ2      LYS  69  -4.628 -19.129 -11.456
   13    HZ1  LYS  69           HZ3      LYS  69  -5.497 -19.717 -12.793

  No H/Q in entry =          13
  In of MODEL   55
    1    H    VAL  70           H        VAL  70  -7.711 -12.997 -11.921
    2    HA   VAL  70           HA       VAL  70  -9.076 -11.035 -13.673
    3    HB   VAL  70           HB       VAL  70  -8.310  -9.265 -12.127
    4   HG11  VAL  70          HG11      VAL  70  -9.962 -11.458 -10.833
    5   HG13  VAL  70          HG12      VAL  70 -10.578 -10.185 -11.887
    6   HG12  VAL  70          HG13      VAL  70  -9.920  -9.775 -10.304
    7   HG22  VAL  70          HG21      VAL  70  -6.441 -10.045 -10.960
    8   HG21  VAL  70          HG22      VAL  70  -7.144 -11.644 -10.720
    9   HG23  VAL  70          HG23      VAL  70  -7.692 -10.286  -9.740

  No H/Q in entry =           9
  In of MODEL   55
    1    H    SER  71           H        SER  71  -7.549  -9.319 -14.414
    2    HA   SER  71           HA       SER  71  -5.293 -10.409 -15.721
    3    HB2  SER  71           HB2      SER  71  -6.558  -8.354 -16.442
    4    HB3  SER  71           HB3      SER  71  -5.810  -7.491 -15.101
    5    HG   SER  71           HG       SER  71  -3.763  -8.215 -16.032

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LEU  72           H        LEU  72  -3.277 -10.719 -15.063
    2    HA   LEU  72           HA       LEU  72  -2.558 -10.513 -12.350
    3    HB2  LEU  72           HB2      LEU  72  -0.908 -10.950 -14.834
    4    HB3  LEU  72           HB3      LEU  72  -0.243 -11.024 -13.205
    5    HG   LEU  72           HG       LEU  72  -2.607 -12.705 -14.101
    6   HD13  LEU  72          HD11      LEU  72  -0.799 -13.448 -15.463
    7   HD12  LEU  72          HD12      LEU  72  -0.825 -14.557 -14.093
    8   HD11  LEU  72          HD13      LEU  72   0.365 -13.256 -14.151
    9   HD21  LEU  72          HD21      LEU  72  -0.848 -12.582 -11.658
   10   HD23  LEU  72          HD22      LEU  72  -1.582 -14.113 -12.107
   11   HD22  LEU  72          HD23      LEU  72  -2.601 -12.723 -11.747

  No H/Q in entry =          11
  In of MODEL   55
    1    H    VAL  73           H        VAL  73  -1.827  -8.497 -15.127
    2    HA   VAL  73           HA       VAL  73   0.104  -6.812 -14.019
    3    HB   VAL  73           HB       VAL  73  -0.235  -5.424 -15.887
    4   HG12  VAL  73          HG11      VAL  73  -1.325  -8.009 -16.967
    5   HG11  VAL  73          HG12      VAL  73   0.286  -7.970 -16.250
    6   HG13  VAL  73          HG13      VAL  73  -0.083  -6.956 -17.644
    7   HG23  VAL  73          HG21      VAL  73  -2.393  -5.671 -17.247
    8   HG22  VAL  73          HG22      VAL  73  -2.541  -4.849 -15.695
    9   HG21  VAL  73          HG23      VAL  73  -3.051  -6.530 -15.854

  No H/Q in entry =           9
  In of MODEL   55
    1    H    LEU  74           H        LEU  74  -3.295  -6.907 -13.464
    2    HA   LEU  74           HA       LEU  74  -3.896  -4.248 -12.848
    3    HB2  LEU  74           HB2      LEU  74  -5.639  -5.897 -13.026
    4    HB3  LEU  74           HB3      LEU  74  -4.952  -6.834 -11.701
    5    HG   LEU  74           HG       LEU  74  -5.395  -4.957 -10.148
    6   HD12  LEU  74          HD11      LEU  74  -7.004  -3.178 -11.113
    7   HD11  LEU  74          HD12      LEU  74  -6.409  -3.686 -12.692
    8   HD13  LEU  74          HD13      LEU  74  -5.291  -3.015 -11.503
    9   HD21  LEU  74          HD21      LEU  74  -7.103  -6.797 -10.989
   10   HD23  LEU  74          HD22      LEU  74  -7.933  -5.381 -11.597
   11   HD22  LEU  74          HD23      LEU  74  -7.607  -5.520  -9.887

  No H/Q in entry =          11
  In of MODEL   55
    1    H    VAL  75           H        VAL  75  -2.874  -6.845 -10.690
    2    HA   VAL  75           HA       VAL  75  -2.668  -5.299  -8.343
    3    HB   VAL  75           HB       VAL  75  -1.194  -7.805  -9.139
    4   HG11  VAL  75          HG11      VAL  75  -1.374  -6.340  -6.467
    5   HG13  VAL  75          HG12      VAL  75   0.079  -6.596  -7.422
    6   HG12  VAL  75          HG13      VAL  75  -0.728  -7.965  -6.676
    7   HG21  VAL  75          HG21      VAL  75  -3.705  -7.881  -8.914
    8   HG23  VAL  75          HG22      VAL  75  -3.526  -7.319  -7.252
    9   HG22  VAL  75          HG23      VAL  75  -2.866  -8.885  -7.730

  No H/Q in entry =           9
  In of MODEL   55
    1    H    GLU  76           H        GLU  76  -0.262  -6.071 -10.879
    2    HA   GLU  76           HA       GLU  76   1.932  -4.740  -9.717
    3    HB2  GLU  76           HB2      GLU  76   2.118  -6.215 -11.706
    4    HB3  GLU  76           HB3      GLU  76   1.228  -5.039 -12.660
    5    HG2  GLU  76           HG2      GLU  76   3.582  -4.750 -13.134
    6    HG3  GLU  76           HG3      GLU  76   3.064  -3.362 -12.195

  No H/Q in entry =           6
  In of MODEL   55
    1    H    ALA  77           H        ALA  77  -0.590  -3.518 -11.906
    2    HA   ALA  77           HA       ALA  77   0.417  -0.878 -12.076
    3    HB2  ALA  77           HB1      ALA  77  -1.802  -0.288 -12.913
    4    HB3  ALA  77           HB2      ALA  77  -2.459  -1.807 -12.305
    5    HB1  ALA  77           HB3      ALA  77  -1.285  -1.820 -13.620

  No H/Q in entry =           5
  In of MODEL   55
    1    H    GLN  78           H        GLN  78  -1.863  -2.423  -9.870
    2    HA   GLN  78           HA       GLN  78  -2.657  -0.102  -8.466
    3    HB2  GLN  78           HB2      GLN  78  -3.784  -2.352  -8.385
    4    HB3  GLN  78           HB3      GLN  78  -2.450  -2.925  -7.387
    5    HG2  GLN  78           HG2      GLN  78  -2.951  -1.186  -5.718
    6    HG3  GLN  78           HG3      GLN  78  -4.290  -0.615  -6.712
    7   HE21  GLN  78          HE21      GLN  78  -4.801  -1.559  -4.081
    8   HE22  GLN  78          HE22      GLN  78  -5.646  -3.028  -4.182

  No H/Q in entry =           8
  In of MODEL   55
    1    H    LEU  79           H        LEU  79   0.007  -2.374  -8.017
    2    HA   LEU  79           HA       LEU  79   0.986  -1.488  -5.557
    3    HB2  LEU  79           HB2      LEU  79   1.845  -3.500  -6.627
    4    HB3  LEU  79           HB3      LEU  79   2.498  -2.549  -7.958
    5    HG   LEU  79           HG       LEU  79   4.059  -1.422  -6.451
    6   HD13  LEU  79          HD11      LEU  79   3.053  -1.174  -4.384
    7   HD12  LEU  79          HD12      LEU  79   4.124  -2.530  -4.042
    8   HD11  LEU  79          HD13      LEU  79   2.417  -2.819  -4.374
    9   HD23  LEU  79          HD21      LEU  79   5.256  -3.578  -5.550
   10   HD22  LEU  79          HD22      LEU  79   5.056  -3.375  -7.288
   11   HD21  LEU  79          HD23      LEU  79   3.971  -4.440  -6.398

  No H/Q in entry =          11
  In of MODEL   55
    1    H    HIS  80           H        HIS  80   1.866  -0.370  -8.827
    2    HA   HIS  80           HA       HIS  80   3.683   1.606  -7.899
    3    HB2  HIS  80           HB2      HIS  80   2.393   0.923 -10.485
    4    HB3  HIS  80           HB3      HIS  80   2.996   2.571 -10.311
    5    HD1  HIS  80           HD1      HIS  80   5.400   2.860 -10.829
    6    HD2  HIS  80           HD2      HIS  80   4.559  -1.048  -9.645
    7    HE1  HIS  80           HE1      HIS  80   7.584   1.572 -10.995
    8    HE2  HIS  80           HE2      HIS  80   7.082  -0.813 -10.276

  No H/Q in entry =           8
  In of MODEL   55
    1    H    LEU  81           H        LEU  81   0.281   1.785  -8.883
    2    HA   LEU  81           HA       LEU  81   0.019   4.578  -8.548
    3    HB2  LEU  81           HB2      LEU  81  -2.006   2.342  -8.475
    4    HB3  LEU  81           HB3      LEU  81  -2.450   4.047  -8.381
    5    HG   LEU  81           HG       LEU  81  -0.760   2.893 -10.616
    6   HD12  LEU  81          HD11      LEU  81  -2.989   3.226 -11.918
    7   HD11  LEU  81          HD12      LEU  81  -3.747   3.158 -10.328
    8   HD13  LEU  81          HD13      LEU  81  -2.810   1.787 -10.916
    9   HD23  LEU  81          HD21      LEU  81  -1.845   5.045 -11.712
   10   HD22  LEU  81          HD22      LEU  81  -0.430   5.207 -10.676
   11   HD21  LEU  81          HD23      LEU  81  -2.033   5.562 -10.037

  No H/Q in entry =          11
  In of MODEL   55
    1    H    MET  82           H        MET  82  -0.655   1.891  -6.305
    2    HA   MET  82           HA       MET  82  -1.703   3.478  -4.216
    3    HB2  MET  82           HB2      MET  82  -0.341   0.785  -4.258
    4    HB3  MET  82           HB3      MET  82  -0.918   1.510  -2.760
    5    HG2  MET  82           HG2      MET  82  -2.650   1.028  -5.204
    6    HG3  MET  82           HG3      MET  82  -2.578  -0.048  -3.811
    7    HE3  MET  82           HE1      MET  82  -4.298   1.603  -0.995
    8    HE2  MET  82           HE2      MET  82  -2.566   1.874  -1.177
    9    HE1  MET  82           HE3      MET  82  -3.260   0.321  -1.635

  No H/Q in entry =           9
  In of MODEL   55
    1    H    THR  83           H        THR  83   1.594   2.379  -4.903
    2    HA   THR  83           HA       THR  83   2.813   3.474  -2.599
    3    HB   THR  83           HB       THR  83   4.910   3.413  -4.070
    4    HG1  THR  83           HG1      THR  83   4.671   2.891  -6.095
    5   HG22  THR  83          HG21      THR  83   4.455   0.757  -4.407
    6   HG21  THR  83          HG22      THR  83   3.166   1.140  -3.268
    7   HG23  THR  83          HG23      THR  83   4.846   1.476  -2.846

  No H/Q in entry =           7
  In of MODEL   55
    1    H    SER  84           H        SER  84   2.452   4.761  -5.897
    2    HA   SER  84           HA       SER  84   3.801   7.195  -5.436
    3    HB2  SER  84           HB2      SER  84   1.730   6.375  -7.459
    4    HB3  SER  84           HB3      SER  84   2.415   7.999  -7.430
    5    HG   SER  84           HG       SER  84   3.778   5.519  -7.724

  No H/Q in entry =           5
  In of MODEL   55
    1    H    MET  85           H        MET  85   0.304   6.453  -5.270
    2    HA   MET  85           HA       MET  85  -0.547   9.066  -4.665
    3    HB2  MET  85           HB2      MET  85  -2.076   7.265  -5.340
    4    HB3  MET  85           HB3      MET  85  -1.793   6.454  -3.801
    5    HG2  MET  85           HG2      MET  85  -2.691   8.391  -2.588
    6    HG3  MET  85           HG3      MET  85  -2.919   9.252  -4.109
    7    HE1  MET  85           HE1      MET  85  -3.646   6.327  -1.952
    8    HE3  MET  85           HE2      MET  85  -3.727   5.284  -3.370
    9    HE2  MET  85           HE3      MET  85  -5.196   5.653  -2.471

  No H/Q in entry =           9
  In of MODEL   55
    1    H    LEU  86           H        LEU  86   0.358   6.395  -2.526
    2    HA   LEU  86           HA       LEU  86  -0.173   7.696  -0.082
    3    HB2  LEU  86           HB2      LEU  86   0.280   5.224  -0.480
    4    HB3  LEU  86           HB3      LEU  86   1.989   5.645  -0.572
    5    HG   LEU  86           HG       LEU  86   1.667   6.803   1.698
    6   HD11  LEU  86          HD11      LEU  86  -1.030   6.051   1.222
    7   HD13  LEU  86          HD12      LEU  86  -0.362   6.792   2.675
    8   HD12  LEU  86          HD13      LEU  86  -0.462   5.037   2.552
    9   HD23  LEU  86          HD21      LEU  86   1.223   3.813   1.814
   10   HD22  LEU  86          HD22      LEU  86   2.230   4.815   2.857
   11   HD21  LEU  86          HD23      LEU  86   2.731   4.491   1.198

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ALA  87           H        ALA  87   2.809   7.390  -1.968
    2    HA   ALA  87           HA       ALA  87   4.520   8.787  -0.238
    3    HB3  ALA  87           HB1      ALA  87   4.613   7.780  -2.947
    4    HB2  ALA  87           HB2      ALA  87   5.948   8.101  -1.844
    5    HB1  ALA  87           HB3      ALA  87   5.342   9.387  -2.886

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ARG  88           H        ARG  88   2.582   9.940  -2.958
    2    HA   ARG  88           HA       ARG  88   3.372  12.625  -2.834
    3    HB2  ARG  88           HB2      ARG  88   2.114  11.484  -4.696
    4    HB3  ARG  88           HB3      ARG  88   0.656  11.633  -3.714
    5    HG2  ARG  88           HG2      ARG  88   1.691  14.207  -3.624
    6    HG3  ARG  88           HG3      ARG  88   2.114  13.694  -5.255
    7    HD2  ARG  88           HD2      ARG  88  -0.026  13.789  -5.955
    8    HD3  ARG  88           HD3      ARG  88  -0.620  12.936  -4.530
    9    HE   ARG  88           HE       ARG  88  -0.792  15.716  -4.941
   10   HH21  ARG  88          HH11      ARG  88  -1.313  17.045  -3.201
   11   HH22  ARG  88          HH12      ARG  88  -1.022  16.502  -1.585
   12   HH11  ARG  88          HH21      ARG  88   0.207  13.442  -2.571
   13   HH12  ARG  88          HH22      ARG  88  -0.179  14.457  -1.228

  No H/Q in entry =          13
  In of MODEL   55
    1    H    GLU  89           H        GLU  89   0.657  10.964  -1.201
    2    HA   GLU  89           HA       GLU  89  -0.437  13.280   0.008
    3    HB2  GLU  89           HB2      GLU  89  -1.570  11.048  -0.085
    4    HB3  GLU  89           HB3      GLU  89  -0.451  10.483   1.156
    5    HG2  GLU  89           HG2      GLU  89  -1.261  12.183   2.718
    6    HG3  GLU  89           HG3      GLU  89  -2.308  12.864   1.475

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LEU  90           H        LEU  90   1.997  10.969   1.179
    2    HA   LEU  90           HA       LEU  90   2.359  12.205   3.712
    3    HB2  LEU  90           HB2      LEU  90   4.122  10.422   2.032
    4    HB3  LEU  90           HB3      LEU  90   4.543  10.932   3.673
    5    HG   LEU  90           HG       LEU  90   1.899   9.607   3.006
    6   HD12  LEU  90          HD11      LEU  90   3.024   7.550   4.010
    7   HD11  LEU  90          HD12      LEU  90   4.553   8.396   3.772
    8   HD13  LEU  90          HD13      LEU  90   3.539   7.999   2.383
    9   HD22  LEU  90          HD21      LEU  90   1.639  10.527   5.129
   10   HD21  LEU  90          HD22      LEU  90   3.356  10.406   5.513
   11   HD23  LEU  90          HD23      LEU  90   2.339   8.966   5.557

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  91           H        ILE  91   3.968  12.583   0.587
    2    HA   ILE  91           HA       ILE  91   5.958  14.398   1.433
    3    HB   ILE  91           HB       ILE  91   4.645  13.924  -1.249
    4   HG12  ILE  91          HG12      ILE  91   7.473  13.413  -0.274
    5   HG13  ILE  91          HG13      ILE  91   6.182  12.225  -0.115
    6   HG22  ILE  91          HG21      ILE  91   6.879  15.256  -1.932
    7   HG21  ILE  91          HG22      ILE  91   6.573  16.055  -0.390
    8   HG23  ILE  91          HG23      ILE  91   5.352  16.096  -1.660
    9   HD13  ILE  91          HD11      ILE  91   6.009  11.908  -2.423
   10   HD12  ILE  91          HD12      ILE  91   7.745  12.137  -2.207
   11   HD11  ILE  91          HD13      ILE  91   6.745  13.469  -2.791

  No H/Q in entry =          11
  In of MODEL   55
    1    H    THR  92           H        THR  92   2.600  14.858   0.423
    2    HA   THR  92           HA       THR  92   2.596  17.682   0.370
    3    HB   THR  92           HB       THR  92   0.412  15.702   1.062
    4    HG1  THR  92           HG1      THR  92   0.717  15.526  -1.023
    5   HG22  THR  92          HG21      THR  92  -0.971  17.877   0.344
    6   HG21  THR  92          HG22      THR  92   0.427  18.690   1.044
    7   HG23  THR  92          HG23      THR  92  -0.524  17.573   2.022

  No H/Q in entry =           7
  In of MODEL   55
    1    H    GLU  93           H        GLU  93   2.027  15.380   3.017
    2    HA   GLU  93           HA       GLU  93   1.508  17.283   5.040
    3    HB2  GLU  93           HB2      GLU  93   2.800  14.547   5.270
    4    HB3  GLU  93           HB3      GLU  93   2.115  15.476   6.605
    5    HG2  GLU  93           HG2      GLU  93   0.499  14.717   4.163
    6    HG3  GLU  93           HG3      GLU  93   0.591  13.690   5.589

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LEU  94           H        LEU  94   4.504  15.780   3.889
    2    HA   LEU  94           HA       LEU  94   6.262  16.909   5.782
    3    HB2  LEU  94           HB2      LEU  94   6.658  15.945   2.949
    4    HB3  LEU  94           HB3      LEU  94   7.992  16.590   3.901
    5    HG   LEU  94           HG       LEU  94   6.234  14.405   5.029
    6   HD11  LEU  94          HD11      LEU  94   8.330  14.168   2.899
    7   HD13  LEU  94          HD12      LEU  94   6.876  13.205   3.157
    8   HD12  LEU  94          HD13      LEU  94   8.298  12.938   4.165
    9   HD23  LEU  94          HD21      LEU  94   8.418  13.849   6.182
   10   HD22  LEU  94          HD22      LEU  94   7.764  15.431   6.602
   11   HD21  LEU  94          HD23      LEU  94   9.102  15.303   5.461

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  95           H        ILE  95   5.135  18.097   2.634
    2    HA   ILE  95           HA       ILE  95   6.726  20.442   2.582
    3    HB   ILE  95           HB       ILE  95   4.077  19.783   1.272
    4   HG12  ILE  95          HG12      ILE  95   6.870  20.100   0.138
    5   HG13  ILE  95          HG13      ILE  95   6.208  18.551   0.649
    6   HG21  ILE  95          HG21      ILE  95   5.847  22.236   1.059
    7   HG23  ILE  95          HG22      ILE  95   4.121  22.181   1.414
    8   HG22  ILE  95          HG23      ILE  95   4.702  21.780  -0.203
    9   HD13  ILE  95          HD11      ILE  95   4.649  18.492  -1.082
   10   HD12  ILE  95          HD12      ILE  95   6.005  19.301  -1.867
   11   HD11  ILE  95          HD13      ILE  95   4.640  20.245  -1.273

  No H/Q in entry =          11
  In of MODEL   55
    1    H    GLU  96           H        GLU  96   3.470  19.813   3.872
    2    HA   GLU  96           HA       GLU  96   2.871  22.463   4.629
    3    HB2  GLU  96           HB2      GLU  96   1.182  20.693   4.635
    4    HB3  GLU  96           HB3      GLU  96   2.035  19.856   5.929
    5    HG2  GLU  96           HG2      GLU  96   1.024  21.144   7.501
    6    HG3  GLU  96           HG3      GLU  96   1.572  22.615   6.708

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LEU  97           H        LEU  97   4.691  19.893   6.250
    2    HA   LEU  97           HA       LEU  97   5.057  21.233   8.724
    3    HB2  LEU  97           HB2      LEU  97   6.578  19.055   7.306
    4    HB3  LEU  97           HB3      LEU  97   7.172  19.731   8.820
    5    HG   LEU  97           HG       LEU  97   4.354  18.662   8.504
    6   HD12  LEU  97          HD11      LEU  97   5.276  16.639   9.713
    7   HD11  LEU  97          HD12      LEU  97   6.892  17.257   9.372
    8   HD13  LEU  97          HD13      LEU  97   5.820  16.811   8.044
    9   HD23  LEU  97          HD21      LEU  97   4.801  18.357  11.068
   10   HD22  LEU  97          HD22      LEU  97   4.435  19.974  10.467
   11   HD21  LEU  97          HD23      LEU  97   6.103  19.519  10.813

  No H/Q in entry =          11
  In of MODEL   55
    1    H    HIS  98           H        HIS  98   6.931  21.240   5.701
    2    HA   HIS  98           HA       HIS  98   9.097  22.799   6.606
    3    HB2  HIS  98           HB2      HIS  98   7.804  22.562   3.878
    4    HB3  HIS  98           HB3      HIS  98   9.252  23.528   4.172
    5    HD1  HIS  98           HD1      HIS  98   8.011  19.967   4.182
    6    HD2  HIS  98           HD2      HIS  98  11.609  22.032   4.616
    7    HE1  HIS  98           HE1      HIS  98   9.850  18.222   4.123
    8    HE2  HIS  98           HE2      HIS  98  12.046  19.459   4.387

  No H/Q in entry =           8
  In of MODEL   55
    1    H    GLU  99           H        GLU  99   5.885  23.665   5.429
    2    HA   GLU  99           HA       GLU  99   6.288  26.477   5.379
    3    HB2  GLU  99           HB2      GLU  99   4.400  25.327   4.243
    4    HB3  GLU  99           HB3      GLU  99   3.699  24.968   5.821
    5    HG2  GLU  99           HG2      GLU  99   3.539  27.360   6.327
    6    HG3  GLU  99           HG3      GLU  99   4.321  27.757   4.800

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LYS 100           H        LYS 100   5.135  24.245   7.894
    2    HA   LYS 100           HA       LYS 100   4.565  26.300   9.792
    3    HB2  LYS 100           HB2      LYS 100   5.114  23.343  10.131
    4    HB3  LYS 100           HB3      LYS 100   4.675  24.416  11.466
    5    HG2  LYS 100           HG2      LYS 100   2.616  25.075  10.217
    6    HG3  LYS 100           HG3      LYS 100   3.034  23.905   8.962
    7    HD2  LYS 100           HD2      LYS 100   2.938  22.081  10.619
    8    HD3  LYS 100           HD3      LYS 100   2.537  23.244  11.885
    9    HE2  LYS 100           HE2      LYS 100   0.491  23.887  10.621
   10    HE3  LYS 100           HE3      LYS 100   0.881  22.667   9.403
   11    HZ1  LYS 100           HZ1      LYS 100   0.607  21.996  12.282
   12    HZ3  LYS 100           HZ2      LYS 100   0.583  20.945  10.944
   13    HZ2  LYS 100           HZ3      LYS 100  -0.723  21.995  11.225

  No H/Q in entry =          13
  In of MODEL   55
    1    H    LEU 101           H        LEU 101   7.473  24.480   8.957
    2    HA   LEU 101           HA       LEU 101   9.077  25.300  11.164
    3    HB2  LEU 101           HB2      LEU 101   9.665  24.315   8.384
    4    HB3  LEU 101           HB3      LEU 101  10.972  24.966   9.368
    5    HG   LEU 101           HG       LEU 101   9.120  22.824  10.425
    6   HD12  LEU 101          HD11      LEU 101  11.160  21.311   9.815
    7   HD11  LEU 101          HD12      LEU 101  11.540  22.574   8.646
    8   HD13  LEU 101          HD13      LEU 101  10.003  21.715   8.548
    9   HD21  LEU 101          HD21      LEU 101  11.853  23.905  11.158
   10   HD23  LEU 101          HD22      LEU 101  11.295  22.336  11.733
   11   HD22  LEU 101          HD23      LEU 101  10.415  23.799  12.174

  No H/Q in entry =          11
  In of MODEL   55
    1    H    LYS 102           H        LYS 102   7.513  27.183   9.026
    2    HA   LYS 102           HA       LYS 102   7.612  29.476   8.740
    3    HB2  LYS 102           HB2      LYS 102   9.173  29.341  10.840
    4    HB3  LYS 102           HB3      LYS 102  10.476  29.526   9.682
    5    HG2  LYS 102           HG2      LYS 102   8.388  31.497  10.547
    6    HG3  LYS 102           HG3      LYS 102  10.103  31.741  10.298
    7    HD2  LYS 102           HD2      LYS 102   8.150  31.342   7.995
    8    HD3  LYS 102           HD3      LYS 102   8.548  32.916   8.668
    9    HE2  LYS 102           HE2      LYS 102   9.911  31.724   6.593
   10    HE3  LYS 102           HE3      LYS 102  10.539  33.023   7.608
   11    HZ2  LYS 102           HZ1      LYS 102  12.042  31.104   7.429
   12    HZ1  LYS 102           HZ2      LYS 102  10.870  30.131   8.168
   13    HZ3  LYS 102           HZ3      LYS 102  11.573  31.409   9.031

  No H/Q in entry =          13
  In of MODEL   55
    1    H    ALA 103           H        ALA 103  10.857  28.108   8.176
    2    HA   ALA 103           HA       ALA 103  11.836  29.481   6.104
    3    HB2  ALA 103           HB1      ALA 103  12.701  27.261   5.172
    4    HB1  ALA 103           HB2      ALA 103  11.797  26.492   6.475
    5    HB3  ALA 103           HB3      ALA 103  13.097  27.622   6.852

  No H/Q in entry =           5
  In of MODEL   55
    1    H1   LYS   3           H1       LYS   3 -31.772   5.539 -19.772
    2    H2   LYS   3           H3       LYS   3 -30.776   5.286 -21.123
    3    H3   LYS   3           H2       LYS   3 -32.121   4.284 -20.861
    4    HA   LYS   3           HA       LYS   3 -31.044   2.962 -19.447
    5    HB2  LYS   3           HB2      LYS   3 -28.842   4.473 -20.804
    6    HB3  LYS   3           HB3      LYS   3 -28.452   3.296 -19.550
    7    HG2  LYS   3           HG2      LYS   3 -29.797   1.626 -20.878
    8    HG3  LYS   3           HG3      LYS   3 -29.817   2.814 -22.181
    9    HD2  LYS   3           HD2      LYS   3 -27.332   2.826 -22.140
   10    HD3  LYS   3           HD3      LYS   3 -27.381   1.535 -20.939
   11    HE2  LYS   3           HE2      LYS   3 -28.824   0.268 -22.639
   12    HE3  LYS   3           HE3      LYS   3 -28.269   1.465 -23.808
   13    HZ3  LYS   3           HZ1      LYS   3 -26.412   0.325 -24.073
   14    HZ2  LYS   3           HZ2      LYS   3 -26.979  -0.862 -22.999
   15    HZ1  LYS   3           HZ3      LYS   3 -26.051   0.436 -22.418

  No H/Q in entry =          15
  In of MODEL   55
    1    H    LYS   4           H        LYS   4 -31.082   2.838 -17.385
    2    HA   LYS   4           HA       LYS   4 -30.460   5.174 -15.761
    3    HB2  LYS   4           HB2      LYS   4 -31.524   2.433 -15.029
    4    HB3  LYS   4           HB3      LYS   4 -31.366   3.792 -13.917
    5    HG2  LYS   4           HG2      LYS   4 -33.177   3.616 -16.331
    6    HG3  LYS   4           HG3      LYS   4 -33.662   3.660 -14.637
    7    HD2  LYS   4           HD2      LYS   4 -33.077   5.916 -14.396
    8    HD3  LYS   4           HD3      LYS   4 -32.041   5.894 -15.822
    9    HE2  LYS   4           HE2      LYS   4 -34.033   7.167 -16.290
   10    HE3  LYS   4           HE3      LYS   4 -34.044   5.682 -17.243
   11    HZ3  LYS   4           HZ1      LYS   4 -35.567   4.710 -15.681
   12    HZ2  LYS   4           HZ2      LYS   4 -36.198   6.171 -16.277
   13    HZ1  LYS   4           HZ3      LYS   4 -35.530   6.107 -14.716

  No H/Q in entry =          13
  In of MODEL   55
    1    H    HIS   5           H        HIS   5 -28.991   5.347 -14.176
    2    HA   HIS   5           HA       HIS   5 -26.624   3.627 -14.499
    3    HB2  HIS   5           HB2      HIS   5 -27.008   6.379 -13.319
    4    HB3  HIS   5           HB3      HIS   5 -25.481   5.497 -13.299
    5    HD1  HIS   5           HD1      HIS   5 -24.077   6.750 -14.906
    6    HD2  HIS   5           HD2      HIS   5 -27.850   5.932 -16.438
    7    HE1  HIS   5           HE1      HIS   5 -23.946   7.313 -17.364
    8    HE2  HIS   5           HE2      HIS   5 -26.246   6.802 -18.266

  No H/Q in entry =           8
  In of MODEL   55
    1    H    ILE   6           H        ILE   6 -26.315   2.081 -13.168
    2    HA   ILE   6           HA       ILE   6 -27.292   2.330 -10.402
    3    HB   ILE   6           HB       ILE   6 -26.356  -0.110 -11.919
    4   HG12  ILE   6          HG12      ILE   6 -29.138   0.704 -11.065
    5   HG13  ILE   6          HG13      ILE   6 -28.510   0.879 -12.704
    6   HG23  ILE   6          HG21      ILE   6 -26.662  -1.360 -10.045
    7   HG22  ILE   6          HG22      ILE   6 -27.871  -0.263  -9.371
    8   HG21  ILE   6          HG23      ILE   6 -26.159   0.155  -9.293
    9   HD13  ILE   6          HD11      ILE   6 -28.871  -1.264 -13.181
   10   HD12  ILE   6          HD12      ILE   6 -29.880  -1.281 -11.735
   11   HD11  ILE   6          HD13      ILE   6 -28.199  -1.808 -11.644

  No H/Q in entry =          11
  In of MODEL   55
    1    H    TYR   7           H        TYR   7 -25.560   3.066  -9.129
    2    HA   TYR   7           HA       TYR   7 -22.810   2.232  -9.811
    3    HB2  TYR   7           HB2      TYR   7 -23.881   4.632  -8.350
    4    HB3  TYR   7           HB3      TYR   7 -22.174   4.197  -8.391
    5    HD1  TYR   7           HD1      TYR   7 -23.180   3.175 -11.467
    6    HD2  TYR   7           HD2      TYR   7 -22.671   6.797  -9.280
    7    HE1  TYR   7           HE1      TYR   7 -22.815   4.402 -13.573
    8    HE2  TYR   7           HE2      TYR   7 -22.348   8.028 -11.377
    9    HH   TYR   7           HH       TYR   7 -22.570   7.909 -13.607

  No H/Q in entry =           9
  In of MODEL   55
    1    H    LEU   8           H        LEU   8 -21.777   0.940  -8.472
    2    HA   LEU   8           HA       LEU   8 -22.872   0.420  -5.780
    3    HB2  LEU   8           HB2      LEU   8 -21.101  -1.180  -7.604
    4    HB3  LEU   8           HB3      LEU   8 -21.262  -1.553  -5.889
    5    HG   LEU   8           HG       LEU   8 -23.732  -1.846  -6.298
    6   HD13  LEU   8          HD11      LEU   8 -23.928  -0.658  -8.420
    7   HD12  LEU   8          HD12      LEU   8 -24.379  -2.348  -8.641
    8   HD11  LEU   8          HD13      LEU   8 -22.799  -1.781  -9.177
    9   HD23  LEU   8          HD21      LEU   8 -22.370  -3.842  -7.977
   10   HD22  LEU   8          HD22      LEU   8 -23.443  -4.046  -6.593
   11   HD21  LEU   8          HD23      LEU   8 -21.754  -3.611  -6.341

  No H/Q in entry =          11
  In of MODEL   55
    1    H    PHE   9           H        PHE   9 -21.604   0.890  -3.996
    2    HA   PHE   9           HA       PHE   9 -18.868   1.941  -4.541
    3    HB2  PHE   9           HB2      PHE   9 -20.872   2.949  -2.522
    4    HB3  PHE   9           HB3      PHE   9 -19.203   3.489  -2.644
    5    HD1  PHE   9           HD1      PHE   9 -18.459   4.893  -4.462
    6    HD2  PHE   9           HD2      PHE   9 -22.512   3.498  -4.293
    7    HE1  PHE   9           HE1      PHE   9 -19.084   6.490  -6.249
    8    HE2  PHE   9           HE2      PHE   9 -23.140   5.108  -6.074
    9    HZ   PHE   9           HZ       PHE   9 -21.423   6.600  -7.058

  No H/Q in entry =           9
  In of MODEL   55
    1    H    SER  10           H        SER  10 -17.218   1.112  -3.382
    2    HA   SER  10           HA       SER  10 -17.383   0.266  -0.684
    3    HB2  SER  10           HB2      SER  10 -18.566  -1.665  -1.672
    4    HB3  SER  10           HB3      SER  10 -17.205  -1.931  -2.749
    5    HG   SER  10           HG       SER  10 -16.112  -2.774  -1.167

  No H/Q in entry =           5
  In of MODEL   55
    1    H    SER  11           H        SER  11 -15.350   0.356   0.142
    2    HA   SER  11           HA       SER  11 -13.191   1.232  -1.450
    3    HB2  SER  11           HB2      SER  11 -13.580   0.471   1.385
    4    HB3  SER  11           HB3      SER  11 -11.925   0.467   0.772
    5    HG   SER  11           HG       SER  11 -13.480   2.545   1.429

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ALA  12           H        ALA  12 -14.338  -1.478  -2.158
    2    HA   ALA  12           HA       ALA  12 -11.748  -2.740  -2.602
    3    HB3  ALA  12           HB1      ALA  12 -12.525  -3.757  -0.490
    4    HB2  ALA  12           HB2      ALA  12 -12.453  -4.936  -1.799
    5    HB1  ALA  12           HB3      ALA  12 -14.008  -4.273  -1.299

  No H/Q in entry =           5
  In of MODEL   55
    1    H    GLY  13           H        GLY  13 -12.574  -1.734  -4.671
    2    HA3  GLY  13           HA2      GLY  13 -14.760  -2.641  -6.136
    3    HA2  GLY  13           HA3      GLY  13 -13.257  -2.045  -6.854

  No H/Q in entry =           3
  In of MODEL   55
    1    H    MET  14           H        MET  14 -11.680  -4.247  -5.630
    2    HA   MET  14           HA       MET  14 -11.666  -6.024  -7.778
    3    HB2  MET  14           HB2      MET  14  -9.785  -5.910  -6.197
    4    HB3  MET  14           HB3      MET  14 -10.760  -6.696  -4.956
    5    HG2  MET  14           HG2      MET  14  -9.313  -8.343  -6.049
    6    HG3  MET  14           HG3      MET  14 -10.993  -8.681  -6.467
    7    HE3  MET  14           HE1      MET  14  -7.558  -7.252  -7.622
    8    HE2  MET  14           HE2      MET  14  -7.546  -8.097  -9.169
    9    HE1  MET  14           HE3      MET  14  -7.811  -9.003  -7.681

  No H/Q in entry =           9
  In of MODEL   55
    1    H    SER  15           H        SER  15 -13.347  -6.457  -4.687
    2    HA   SER  15           HA       SER  15 -14.460  -9.006  -5.607
    3    HB2  SER  15           HB2      SER  15 -14.983  -7.495  -3.032
    4    HB3  SER  15           HB3      SER  15 -15.714  -9.037  -3.461
    5    HG   SER  15           HG       SER  15 -12.934  -8.812  -3.684

  No H/Q in entry =           5
  In of MODEL   55
    1    H    THR  16           H        THR  16 -15.582  -5.671  -5.088
    2    HA   THR  16           HA       THR  16 -18.375  -6.150  -5.607
    3    HB   THR  16           HB       THR  16 -16.808  -3.607  -6.155
    4    HG1  THR  16           HG1      THR  16 -17.880  -3.360  -3.851
    5   HG23  THR  16          HG21      THR  16 -19.138  -3.668  -6.962
    6   HG22  THR  16          HG22      THR  16 -18.964  -2.537  -5.610
    7   HG21  THR  16          HG23      THR  16 -19.678  -4.135  -5.354

  No H/Q in entry =           7
  In of MODEL   55
    1    H    SER  17           H        SER  17 -15.549  -5.515  -7.474
    2    HA   SER  17           HA       SER  17 -16.717  -4.856  -9.980
    3    HB2  SER  17           HB2      SER  17 -14.029  -6.068  -9.298
    4    HB3  SER  17           HB3      SER  17 -14.500  -5.610 -10.934
    5    HG   SER  17           HG       SER  17 -13.546  -3.829 -10.228

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LEU  18           H        LEU  18 -15.995  -7.954  -8.501
    2    HA   LEU  18           HA       LEU  18 -16.515  -9.505 -10.839
    3    HB2  LEU  18           HB2      LEU  18 -15.246 -10.379  -8.919
    4    HB3  LEU  18           HB3      LEU  18 -16.691 -10.258  -7.915
    5    HG   LEU  18           HG       LEU  18 -17.823 -11.912  -9.303
    6   HD12  LEU  18          HD11      LEU  18 -16.205 -13.143 -10.956
    7   HD11  LEU  18          HD12      LEU  18 -15.334 -11.609 -10.948
    8   HD13  LEU  18          HD13      LEU  18 -17.015 -11.665 -11.472
    9   HD22  LEU  18          HD21      LEU  18 -16.757 -12.881  -7.502
   10   HD21  LEU  18          HD22      LEU  18 -15.148 -12.590  -8.167
   11   HD23  LEU  18          HD23      LEU  18 -16.184 -13.829  -8.875

  No H/Q in entry =          11
  In of MODEL   55
    1    H    LEU  19           H        LEU  19 -18.533  -8.365  -8.134
    2    HA   LEU  19           HA       LEU  19 -20.939  -9.674  -8.947
    3    HB2  LEU  19           HB2      LEU  19 -20.716  -8.811  -6.705
    4    HB3  LEU  19           HB3      LEU  19 -20.490  -7.175  -7.322
    5    HG   LEU  19           HG       LEU  19 -22.828  -7.123  -8.048
    6   HD13  LEU  19          HD11      LEU  19 -23.199  -9.484  -8.486
    7   HD12  LEU  19          HD12      LEU  19 -24.354  -8.921  -7.278
    8   HD11  LEU  19          HD13      LEU  19 -22.950  -9.863  -6.781
    9   HD22  LEU  19          HD21      LEU  19 -22.218  -6.289  -5.858
   10   HD21  LEU  19          HD22      LEU  19 -22.415  -7.900  -5.167
   11   HD23  LEU  19          HD23      LEU  19 -23.814  -7.038  -5.807

  No H/Q in entry =          11
  In of MODEL   55
    1    H    VAL  20           H        VAL  20 -19.598  -6.452  -9.678
    2    HA   VAL  20           HA       VAL  20 -21.762  -5.529 -11.251
    3    HB   VAL  20           HB       VAL  20 -18.804  -4.796 -11.389
    4   HG12  VAL  20          HG11      VAL  20 -19.551  -2.805 -12.686
    5   HG11  VAL  20          HG12      VAL  20 -21.163  -3.512 -12.792
    6   HG13  VAL  20          HG13      VAL  20 -19.795  -4.315 -13.562
    7   HG22  VAL  20          HG21      VAL  20 -19.599  -4.011  -9.365
    8   HG21  VAL  20          HG22      VAL  20 -21.197  -3.654 -10.015
    9   HG23  VAL  20          HG23      VAL  20 -19.827  -2.627 -10.434

  No H/Q in entry =           9
  In of MODEL   55
    1    H    SER  21           H        SER  21 -18.911  -7.456 -12.267
    2    HA   SER  21           HA       SER  21 -19.707  -7.411 -15.015
    3    HB2  SER  21           HB2      SER  21 -18.179  -9.309 -15.334
    4    HB3  SER  21           HB3      SER  21 -17.408  -8.016 -14.418
    5    HG   SER  21           HG       SER  21 -18.445 -10.460 -13.478

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LYS  22           H        LYS  22 -20.660  -9.618 -12.418
    2    HA   LYS  22           HA       LYS  22 -22.124 -11.328 -14.218
    3    HB2  LYS  22           HB2      LYS  22 -21.348 -12.068 -11.970
    4    HB3  LYS  22           HB3      LYS  22 -22.521 -10.969 -11.248
    5    HG2  LYS  22           HG2      LYS  22 -23.732 -12.883 -11.147
    6    HG3  LYS  22           HG3      LYS  22 -24.196 -12.358 -12.765
    7    HD2  LYS  22           HD2      LYS  22 -23.651 -14.527 -13.222
    8    HD3  LYS  22           HD3      LYS  22 -22.069 -13.778 -13.451
    9    HE2  LYS  22           HE2      LYS  22 -21.394 -15.440 -12.064
   10    HE3  LYS  22           HE3      LYS  22 -21.932 -14.319 -10.813
   11    HZ1  LYS  22           HZ1      LYS  22 -24.059 -15.961 -11.759
   12    HZ3  LYS  22           HZ2      LYS  22 -23.496 -15.721 -10.174
   13    HZ2  LYS  22           HZ3      LYS  22 -22.769 -16.892 -11.165

  No H/Q in entry =          13
  In of MODEL   55
    1    H    MET  23           H        MET  23 -22.980  -8.424 -12.377
    2    HA   MET  23           HA       MET  23 -25.782  -8.640 -12.874
    3    HB2  MET  23           HB2      MET  23 -24.043  -6.242 -12.331
    4    HB3  MET  23           HB3      MET  23 -25.795  -6.156 -12.505
    5    HG2  MET  23           HG2      MET  23 -26.121  -7.456 -10.521
    6    HG3  MET  23           HG3      MET  23 -24.393  -7.786 -10.397
    7    HE2  MET  23           HE1      MET  23 -26.856  -4.234  -9.239
    8    HE1  MET  23           HE2      MET  23 -27.067  -5.228 -10.678
    9    HE3  MET  23           HE3      MET  23 -26.100  -3.755 -10.759

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ARG  24           H        ARG  24 -23.102  -7.103 -14.681
    2    HA   ARG  24           HA       ARG  24 -24.663  -5.894 -16.688
    3    HB2  ARG  24           HB2      ARG  24 -22.237  -5.387 -16.311
    4    HB3  ARG  24           HB3      ARG  24 -21.835  -6.966 -16.938
    5    HG2  ARG  24           HG2      ARG  24 -22.748  -6.342 -19.174
    6    HG3  ARG  24           HG3      ARG  24 -23.159  -4.732 -18.524
    7    HD2  ARG  24           HD2      ARG  24 -20.366  -5.970 -18.541
    8    HD3  ARG  24           HD3      ARG  24 -20.953  -4.775 -19.690
    9    HE   ARG  24           HE       ARG  24 -21.319  -3.466 -17.417
   10   HH21  ARG  24          HH11      ARG  24 -20.027  -1.636 -17.582
   11   HH22  ARG  24          HH12      ARG  24 -18.322  -1.809 -17.817
   12   HH11  ARG  24          HH21      ARG  24 -18.645  -5.282 -18.419
   13   HH12  ARG  24          HH22      ARG  24 -17.513  -3.972 -18.301

  No H/Q in entry =          13
  In of MODEL   55
    1    H    ALA  25           H        ALA  25 -23.390  -9.174 -16.383
    2    HA   ALA  25           HA       ALA  25 -23.986 -10.059 -19.011
    3    HB1  ALA  25           HB1      ALA  25 -23.197 -12.051 -18.297
    4    HB3  ALA  25           HB2      ALA  25 -24.250 -12.065 -16.883
    5    HB2  ALA  25           HB3      ALA  25 -22.734 -11.167 -16.843

  No H/Q in entry =           5
  In of MODEL   55
    1    H    GLN  26           H        GLN  26 -25.802 -10.151 -15.982
    2    HA   GLN  26           HA       GLN  26 -28.091 -11.469 -16.981
    3    HB2  GLN  26           HB2      GLN  26 -27.651  -9.677 -14.610
    4    HB3  GLN  26           HB3      GLN  26 -29.181 -10.473 -14.950
    5    HG2  GLN  26           HG2      GLN  26 -26.531 -11.807 -14.474
    6    HG3  GLN  26           HG3      GLN  26 -27.892 -11.756 -13.362
    7   HE21  GLN  26          HE21      GLN  26 -26.582 -13.875 -14.622
    8   HE22  GLN  26          HE22      GLN  26 -27.578 -14.975 -15.405

  No H/Q in entry =           8
  In of MODEL   55
    1    H    ALA  27           H        ALA  27 -27.310  -8.028 -16.622
    2    HA   ALA  27           HA       ALA  27 -29.848  -7.056 -17.409
    3    HB1  ALA  27           HB1      ALA  27 -28.096  -5.651 -16.312
    4    HB3  ALA  27           HB2      ALA  27 -28.724  -4.925 -17.792
    5    HB2  ALA  27           HB3      ALA  27 -27.151  -5.723 -17.800

  No H/Q in entry =           5
  In of MODEL   55
    1    H    GLU  28           H        GLU  28 -27.099  -8.174 -19.275
    2    HA   GLU  28           HA       GLU  28 -28.086  -7.200 -21.800
    3    HB2  GLU  28           HB2      GLU  28 -25.678  -7.769 -21.177
    4    HB3  GLU  28           HB3      GLU  28 -26.147  -9.458 -21.363
    5    HG2  GLU  28           HG2      GLU  28 -25.041  -8.649 -23.342
    6    HG3  GLU  28           HG3      GLU  28 -26.724  -9.051 -23.682

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LYS  29           H        LYS  29 -28.108 -10.295 -20.116
    2    HA   LYS  29           HA       LYS  29 -29.349 -11.840 -22.105
    3    HB2  LYS  29           HB2      LYS  29 -28.252 -12.758 -20.096
    4    HB3  LYS  29           HB3      LYS  29 -29.552 -12.100 -19.103
    5    HG2  LYS  29           HG2      LYS  29 -31.151 -13.554 -20.154
    6    HG3  LYS  29           HG3      LYS  29 -29.928 -14.145 -21.276
    7    HD2  LYS  29           HD2      LYS  29 -28.730 -15.245 -19.536
    8    HD3  LYS  29           HD3      LYS  29 -29.671 -14.434 -18.286
    9    HE2  LYS  29           HE2      LYS  29 -30.318 -16.817 -18.626
   10    HE3  LYS  29           HE3      LYS  29 -31.649 -15.685 -18.876
   11    HZ1  LYS  29           HZ1      LYS  29 -31.085 -15.815 -21.304
   12    HZ3  LYS  29           HZ2      LYS  29 -31.739 -17.227 -20.625
   13    HZ2  LYS  29           HZ3      LYS  29 -30.074 -17.126 -20.928

  No H/Q in entry =          13
  In of MODEL   55
    1    H    TYR  30           H        TYR  30 -30.828  -9.778 -19.615
    2    HA   TYR  30           HA       TYR  30 -33.471 -10.356 -20.845
    3    HB2  TYR  30           HB2      TYR  30 -32.864  -9.151 -18.135
    4    HB3  TYR  30           HB3      TYR  30 -34.470  -9.486 -18.782
    5    HD1  TYR  30           HD1      TYR  30 -35.277 -11.819 -18.973
    6    HD2  TYR  30           HD2      TYR  30 -31.474 -10.911 -17.287
    7    HE1  TYR  30           HE1      TYR  30 -35.081 -14.134 -18.158
    8    HE2  TYR  30           HE2      TYR  30 -31.280 -13.211 -16.475
    9    HH   TYR  30           HH       TYR  30 -32.814 -15.653 -17.543

  No H/Q in entry =           9
  In of MODEL   55
    1    H    GLU  31           H        GLU  31 -31.398  -8.276 -21.668
    2    HA   GLU  31           HA       GLU  31 -31.425  -6.125 -22.509
    3    HB2  GLU  31           HB2      GLU  31 -34.285  -6.974 -23.007
    4    HB3  GLU  31           HB3      GLU  31 -33.509  -5.577 -23.751
    5    HG2  GLU  31           HG2      GLU  31 -31.977  -6.957 -24.934
    6    HG3  GLU  31           HG3      GLU  31 -32.474  -8.387 -24.033

  No H/Q in entry =           6
  In of MODEL   55
    1    H    VAL  32           H        VAL  32 -31.621  -6.010 -19.777
    2    HA   VAL  32           HA       VAL  32 -33.576  -3.978 -19.131
    3    HB   VAL  32           HB       VAL  32 -31.137  -4.848 -17.549
    4   HG12  VAL  32          HG11      VAL  32 -32.705  -4.080 -15.655
    5   HG11  VAL  32          HG12      VAL  32 -33.581  -3.225 -16.924
    6   HG13  VAL  32          HG13      VAL  32 -31.890  -2.841 -16.611
    7   HG21  VAL  32          HG21      VAL  32 -32.827  -6.654 -18.217
    8   HG23  VAL  32          HG22      VAL  32 -33.901  -5.865 -17.061
    9   HG22  VAL  32          HG23      VAL  32 -32.351  -6.513 -16.525

  No H/Q in entry =           9
  In of MODEL   55
    1    HA   PRO  33           HA       PRO  33 -30.686  -0.927 -20.836
    2    HB2  PRO  33           HB2      PRO  33 -32.299   1.224 -20.726
    3    HB3  PRO  33           HB3      PRO  33 -32.709  -0.107 -21.809
    4    HG2  PRO  33           HG2      PRO  33 -33.694   0.386 -18.998
    5    HG3  PRO  33           HG3      PRO  33 -34.651   0.122 -20.455
    6    HD2  PRO  33           HD2      PRO  33 -34.095  -1.913 -18.774
    7    HD3  PRO  33           HD3      PRO  33 -34.151  -2.172 -20.518

  No H/Q in entry =           7
  In of MODEL   55
    1    H    VAL  34           H        VAL  34 -29.394  -1.396 -18.887
    2    HA   VAL  34           HA       VAL  34 -29.220   1.053 -17.260
    3    HB   VAL  34           HB       VAL  34 -28.566  -0.364 -15.312
    4   HG12  VAL  34          HG11      VAL  34 -30.934  -1.346 -14.991
    5   HG11  VAL  34          HG12      VAL  34 -31.289  -0.614 -16.554
    6   HG13  VAL  34          HG13      VAL  34 -30.780   0.397 -15.203
    7   HG21  VAL  34          HG21      VAL  34 -28.662  -2.413 -17.303
    8   HG23  VAL  34          HG22      VAL  34 -29.697  -2.812 -15.932
    9   HG22  VAL  34          HG23      VAL  34 -27.994  -2.443 -15.671

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ILE  35           H        ILE  35 -27.264   1.587 -16.429
    2    HA   ILE  35           HA       ILE  35 -24.903   0.358 -17.688
    3    HB   ILE  35           HB       ILE  35 -25.436   3.232 -16.899
    4   HG12  ILE  35          HG12      ILE  35 -24.400   1.951 -19.436
    5   HG13  ILE  35          HG13      ILE  35 -26.056   2.497 -19.176
    6   HG21  ILE  35          HG21      ILE  35 -22.806   1.819 -17.203
    7   HG23  ILE  35          HG22      ILE  35 -23.312   2.985 -15.982
    8   HG22  ILE  35          HG23      ILE  35 -22.959   3.524 -17.624
    9   HD11  ILE  35          HD11      ILE  35 -24.759   4.760 -18.597
   10   HD13  ILE  35          HD12      ILE  35 -25.282   4.338 -20.229
   11   HD12  ILE  35          HD13      ILE  35 -23.613   4.052 -19.735

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ILE  36           H        ILE  36 -23.622  -0.594 -16.085
    2    HA   ILE  36           HA       ILE  36 -24.082   0.023 -13.218
    3    HB   ILE  36           HB       ILE  36 -23.131  -2.647 -14.307
    4   HG12  ILE  36          HG12      ILE  36 -25.972  -1.968 -13.540
    5   HG13  ILE  36          HG13      ILE  36 -25.406  -1.935 -15.211
    6   HG23  ILE  36          HG21      ILE  36 -23.437  -3.475 -12.185
    7   HG22  ILE  36          HG22      ILE  36 -24.623  -2.242 -11.753
    8   HG21  ILE  36          HG23      ILE  36 -22.909  -1.829 -11.832
    9   HD13  ILE  36          HD11      ILE  36 -25.466  -4.155 -15.399
   10   HD12  ILE  36          HD12      ILE  36 -26.534  -4.073 -13.998
   11   HD11  ILE  36          HD13      ILE  36 -24.817  -4.410 -13.780

  No H/Q in entry =          11
  In of MODEL   55
    1    H    GLU  37           H        GLU  37 -22.330   0.745 -12.123
    2    HA   GLU  37           HA       GLU  37 -19.608   0.069 -13.041
    3    HB2  GLU  37           HB2      GLU  37 -20.646   2.817 -12.375
    4    HB3  GLU  37           HB3      GLU  37 -18.933   2.412 -12.478
    5    HG2  GLU  37           HG2      GLU  37 -19.121   1.972 -14.821
    6    HG3  GLU  37           HG3      GLU  37 -20.870   2.182 -14.760

  No H/Q in entry =           6
  In of MODEL   55
    1    H    ALA  38           H        ALA  38 -18.107  -0.084 -11.361
    2    HA   ALA  38           HA       ALA  38 -19.137   0.068  -8.589
    3    HB1  ALA  38           HB1      ALA  38 -17.337  -1.799 -10.004
    4    HB3  ALA  38           HB2      ALA  38 -18.369  -2.074  -8.602
    5    HB2  ALA  38           HB3      ALA  38 -16.792  -1.312  -8.399

  No H/Q in entry =           5
  In of MODEL   55
    1    H    PHE  39           H        PHE  39 -17.953   1.348  -7.129
    2    HA   PHE  39           HA       PHE  39 -15.491   2.663  -8.042
    3    HB2  PHE  39           HB2      PHE  39 -17.788   4.146  -6.761
    4    HB3  PHE  39           HB3      PHE  39 -16.244   4.827  -7.268
    5    HD1  PHE  39           HD1      PHE  39 -15.722   5.092  -9.642
    6    HD2  PHE  39           HD2      PHE  39 -19.546   3.759  -8.305
    7    HE1  PHE  39           HE1      PHE  39 -16.674   5.626 -11.868
    8    HE2  PHE  39           HE2      PHE  39 -20.507   4.280 -10.518
    9    HZ   PHE  39           HZ       PHE  39 -19.073   5.186 -12.315

  No H/Q in entry =           9
  In of MODEL   55
    1    HA   PRO  40           HA       PRO  40 -14.505   1.991  -3.753
    2    HB2  PRO  40           HB2      PRO  40 -12.838   4.096  -3.169
    3    HB3  PRO  40           HB3      PRO  40 -12.332   2.778  -4.226
    4    HG2  PRO  40           HG2      PRO  40 -13.490   5.453  -4.995
    5    HG3  PRO  40           HG3      PRO  40 -12.028   4.675  -5.598
    6    HD2  PRO  40           HD2      PRO  40 -14.247   4.470  -6.997
    7    HD3  PRO  40           HD3      PRO  40 -13.221   3.051  -6.797

  No H/Q in entry =           7
  In of MODEL   55
    1    H    GLU  41           H        GLU  41 -15.169   2.954  -1.629
    2    HA   GLU  41           HA       GLU  41 -17.495   4.543  -1.619
    3    HB2  GLU  41           HB2      GLU  41 -17.408   4.415   0.724
    4    HB3  GLU  41           HB3      GLU  41 -16.668   2.914   0.166
    5    HG2  GLU  41           HG2      GLU  41 -14.433   3.947   0.546
    6    HG3  GLU  41           HG3      GLU  41 -15.250   5.344   1.247

  No H/Q in entry =           6
  In of MODEL   55
    1    H    THR  42           H        THR  42 -14.214   5.625  -1.689
    2    HA   THR  42           HA       THR  42 -14.691   8.174  -0.497
    3    HB   THR  42           HB       THR  42 -12.570   8.846  -1.612
    4    HG1  THR  42           HG1      THR  42 -11.627   6.722  -2.616
    5   HG23  THR  42          HG21      THR  42 -11.135   7.306  -0.425
    6   HG22  THR  42          HG22      THR  42 -12.395   6.070  -0.423
    7   HG21  THR  42          HG23      THR  42 -12.599   7.536   0.533

  No H/Q in entry =           7
  In of MODEL   55
    1    H    LEU  43           H        LEU  43 -15.548   7.011  -3.586
    2    HA   LEU  43           HA       LEU  43 -15.943   9.759  -4.578
    3    HB2  LEU  43           HB2      LEU  43 -16.199   7.092  -5.956
    4    HB3  LEU  43           HB3      LEU  43 -16.449   8.662  -6.719
    5    HG   LEU  43           HG       LEU  43 -13.821   7.606  -5.705
    6   HD13  LEU  43          HD11      LEU  43 -13.231   7.255  -7.964
    7   HD12  LEU  43          HD12      LEU  43 -14.651   8.118  -8.550
    8   HD11  LEU  43          HD13      LEU  43 -14.834   6.541  -7.784
    9   HD21  LEU  43          HD21      LEU  43 -14.677  10.191  -6.987
   10   HD23  LEU  43          HD22      LEU  43 -13.015   9.611  -7.095
   11   HD22  LEU  43          HD23      LEU  43 -13.730   9.949  -5.519

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ALA  44           H        ALA  44 -17.789   7.854  -2.703
    2    HA   ALA  44           HA       ALA  44 -20.260   7.578  -4.016
    3    HB2  ALA  44           HB1      ALA  44 -20.060   6.488  -1.911
    4    HB3  ALA  44           HB2      ALA  44 -21.233   7.778  -1.646
    5    HB1  ALA  44           HB3      ALA  44 -19.568   7.975  -1.101

  No H/Q in entry =           5
  In of MODEL   55
    1    H    GLY  45           H        GLY  45 -18.979  10.460  -2.511
    2    HA3  GLY  45           HA2      GLY  45 -21.489  11.832  -2.876
    3    HA2  GLY  45           HA3      GLY  45 -19.977  12.538  -2.310

  No H/Q in entry =           3
  In of MODEL   55
    1    H    GLU  46           H        GLU  46 -18.406  11.660  -4.598
    2    HA   GLU  46           HA       GLU  46 -19.159  13.826  -6.383
    3    HB2  GLU  46           HB2      GLU  46 -16.805  13.414  -5.740
    4    HB3  GLU  46           HB3      GLU  46 -16.882  11.842  -6.536
    5    HG2  GLU  46           HG2      GLU  46 -17.235  12.930  -8.681
    6    HG3  GLU  46           HG3      GLU  46 -17.200  14.509  -7.898

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LYS  47           H        LYS  47 -18.864  10.314  -6.789
    2    HA   LYS  47           HA       LYS  47 -19.979  10.456  -9.463
    3    HB2  LYS  47           HB2      LYS  47 -18.275   8.717  -8.345
    4    HB3  LYS  47           HB3      LYS  47 -19.788   7.877  -8.002
    5    HG2  LYS  47           HG2      LYS  47 -19.127   6.961 -10.011
    6    HG3  LYS  47           HG3      LYS  47 -20.268   8.209 -10.507
    7    HD2  LYS  47           HD2      LYS  47 -18.318   9.752 -10.803
    8    HD3  LYS  47           HD3      LYS  47 -17.262   8.370 -10.524
    9    HE2  LYS  47           HE2      LYS  47 -18.155   7.237 -12.452
   10    HE3  LYS  47           HE3      LYS  47 -19.350   8.512 -12.689
   11    HZ2  LYS  47           HZ1      LYS  47 -16.740   8.386 -13.658
   12    HZ1  LYS  47           HZ2      LYS  47 -16.816   9.679 -12.561
   13    HZ3  LYS  47           HZ3      LYS  47 -17.886   9.619 -13.878

  No H/Q in entry =          13
  In of MODEL   55
    1    H    GLY  48           H        GLY  48 -21.254   9.661  -6.304
    2    HA3  GLY  48           HA2      GLY  48 -23.578   8.351  -7.027
    3    HA2  GLY  48           HA3      GLY  48 -23.399   9.367  -5.598

  No H/Q in entry =           3
  In of MODEL   55
    1    H    GLN  49           H        GLN  49 -22.943  11.802  -7.191
    2    HA   GLN  49           HA       GLN  49 -25.555  12.782  -7.337
    3    HB2  GLN  49           HB2      GLN  49 -23.062  13.761  -8.712
    4    HB3  GLN  49           HB3      GLN  49 -24.570  14.653  -8.631
    5    HG2  GLN  49           HG2      GLN  49 -24.406  14.705  -6.194
    6    HG3  GLN  49           HG3      GLN  49 -22.909  13.792  -6.274
    7   HE21  GLN  49          HE21      GLN  49 -22.900  16.035  -5.020
    8   HE22  GLN  49          HE22      GLN  49 -22.043  17.330  -5.681

  No H/Q in entry =           8
  In of MODEL   55
    1    H    ASN  50           H        ASN  50 -23.791  10.969  -9.712
    2    HA   ASN  50           HA       ASN  50 -25.721  11.728 -11.796
    3    HB2  ASN  50           HB2      ASN  50 -23.067  10.317 -12.025
    4    HB3  ASN  50           HB3      ASN  50 -24.142  10.678 -13.368
    5   HD21  ASN  50          HD21      ASN  50 -21.547  11.668 -11.773
    6   HD22  ASN  50          HD22      ASN  50 -21.396  13.311 -12.130

  No H/Q in entry =           6
  In of MODEL   55
    1    H    ALA  51           H        ALA  51 -25.582   9.395  -9.530
    2    HA   ALA  51           HA       ALA  51 -26.264   7.198 -11.336
    3    HB2  ALA  51           HB1      ALA  51 -25.610   5.894  -9.640
    4    HB3  ALA  51           HB2      ALA  51 -26.768   6.655  -8.551
    5    HB1  ALA  51           HB3      ALA  51 -25.162   7.354  -8.759

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ASP  52           H        ASP  52 -28.214   6.046 -11.181
    2    HA   ASP  52           HA       ASP  52 -30.481   7.775 -10.525
    3    HB2  ASP  52           HB2      ASP  52 -30.172   5.268 -12.174
    4    HB3  ASP  52           HB3      ASP  52 -31.750   5.927 -11.740

  No H/Q in entry =           4
  In of MODEL   55
    1    H    VAL  53           H        VAL  53 -28.738   4.977  -9.488
    2    HA   VAL  53           HA       VAL  53 -30.175   5.055  -6.969
    3    HB   VAL  53           HB       VAL  53 -31.495   3.335  -8.195
    4   HG11  VAL  53          HG11      VAL  53 -29.712   2.550  -9.716
    5   HG13  VAL  53          HG12      VAL  53 -30.479   1.223  -8.842
    6   HG12  VAL  53          HG13      VAL  53 -28.894   1.807  -8.342
    7   HG23  VAL  53          HG21      VAL  53 -30.573   1.415  -6.489
    8   HG22  VAL  53          HG22      VAL  53 -31.764   2.667  -6.129
    9   HG21  VAL  53          HG23      VAL  53 -30.066   2.926  -5.729

  No H/Q in entry =           9
  In of MODEL   55
    1    H    VAL  54           H        VAL  54 -28.839   4.700  -5.315
    2    HA   VAL  54           HA       VAL  54 -26.041   3.982  -5.929
    3    HB   VAL  54           HB       VAL  54 -27.190   5.724  -3.690
    4   HG11  VAL  54          HG11      VAL  54 -24.547   4.429  -3.978
    5   HG13  VAL  54          HG12      VAL  54 -25.328   5.084  -2.539
    6   HG12  VAL  54          HG13      VAL  54 -24.478   6.161  -3.646
    7   HG22  VAL  54          HG21      VAL  54 -26.424   7.569  -4.808
    8   HG21  VAL  54          HG22      VAL  54 -26.927   6.541  -6.149
    9   HG23  VAL  54          HG23      VAL  54 -25.222   6.653  -5.717

  No H/Q in entry =           9
  In of MODEL   55
    1    H    LEU  55           H        LEU  55 -25.355   2.096  -5.271
    2    HA   LEU  55           HA       LEU  55 -26.793   0.733  -3.080
    3    HB2  LEU  55           HB2      LEU  55 -25.188  -0.379  -5.370
    4    HB3  LEU  55           HB3      LEU  55 -25.898  -1.337  -4.071
    5    HG   LEU  55           HG       LEU  55 -27.416   0.161  -6.198
    6   HD13  LEU  55          HD11      LEU  55 -27.031  -1.686  -7.402
    7   HD12  LEU  55          HD12      LEU  55 -27.941  -2.595  -6.197
    8   HD11  LEU  55          HD13      LEU  55 -26.190  -2.445  -6.052
    9   HD23  LEU  55          HD21      LEU  55 -28.610  -1.829  -4.321
   10   HD22  LEU  55          HD22      LEU  55 -29.373  -0.490  -5.178
   11   HD21  LEU  55          HD23      LEU  55 -28.363  -0.173  -3.769

  No H/Q in entry =          11
  In of MODEL   55
    1    H    LEU  56           H        LEU  56 -25.608   0.210  -1.273
    2    HA   LEU  56           HA       LEU  56 -22.696   0.746  -1.336
    3    HB2  LEU  56           HB2      LEU  56 -24.480   0.469   1.070
    4    HB3  LEU  56           HB3      LEU  56 -22.794   0.979   1.051
    5    HG   LEU  56           HG       LEU  56 -25.173   2.538   0.080
    6   HD11  LEU  56          HD11      LEU  56 -24.034   2.231   2.599
    7   HD13  LEU  56          HD12      LEU  56 -25.090   3.548   2.085
    8   HD12  LEU  56          HD13      LEU  56 -23.340   3.736   1.992
    9   HD23  LEU  56          HD21      LEU  56 -23.313   4.325  -0.135
   10   HD22  LEU  56          HD22      LEU  56 -23.646   3.201  -1.452
   11   HD21  LEU  56          HD23      LEU  56 -22.274   2.922  -0.379

  No H/Q in entry =          11
  In of MODEL   55
    1    H    GLY  57           H        GLY  57 -21.239  -0.812  -0.792
    2    HA3  GLY  57           HA2      GLY  57 -22.032  -3.541  -0.963
    3    HA2  GLY  57           HA3      GLY  57 -20.433  -2.965  -0.496

  No H/Q in entry =           3
  In of MODEL   55
    1    HA   PRO  58           HA       PRO  58 -23.179  -4.105   3.233
    2    HB2  PRO  58           HB2      PRO  58 -22.368  -6.669   3.861
    3    HB3  PRO  58           HB3      PRO  58 -23.774  -6.336   2.848
    4    HG2  PRO  58           HG2      PRO  58 -21.010  -7.092   2.060
    5    HG3  PRO  58           HG3      PRO  58 -22.552  -7.632   1.398
    6    HD2  PRO  58           HD2      PRO  58 -21.035  -5.750   0.155
    7    HD3  PRO  58           HD3      PRO  58 -22.797  -5.749   0.058

  No H/Q in entry =           7
  In of MODEL   55
    1    H    GLN  59           H        GLN  59 -19.791  -4.421   2.620
    2    HA   GLN  59           HA       GLN  59 -19.028  -4.379   5.379
    3    HB2  GLN  59           HB2      GLN  59 -17.478  -3.448   2.957
    4    HB3  GLN  59           HB3      GLN  59 -16.818  -3.670   4.565
    5    HG2  GLN  59           HG2      GLN  59 -16.232  -5.540   3.163
    6    HG3  GLN  59           HG3      GLN  59 -17.333  -6.070   4.424
    7   HE21  GLN  59          HE21      GLN  59 -18.221  -7.550   3.463
    8   HE22  GLN  59          HE22      GLN  59 -19.199  -7.843   2.150

  No H/Q in entry =           8
  In of MODEL   55
    1    H    ILE  60           H        ILE  60 -20.088  -1.895   3.152
    2    HA   ILE  60           HA       ILE  60 -19.324   0.118   5.177
    3    HB   ILE  60           HB       ILE  60 -19.643   1.820   3.339
    4   HG12  ILE  60          HG12      ILE  60 -19.356  -0.415   1.373
    5   HG13  ILE  60          HG13      ILE  60 -20.962   0.065   1.924
    6   HG21  ILE  60          HG21      ILE  60 -17.454   0.845   4.076
    7   HG23  ILE  60          HG22      ILE  60 -17.487   1.566   2.467
    8   HG22  ILE  60          HG23      ILE  60 -17.535  -0.187   2.649
    9   HD12  ILE  60          HD11      ILE  60 -18.985   1.609   0.281
   10   HD11  ILE  60          HD12      ILE  60 -20.174   2.470   1.257
   11   HD13  ILE  60          HD13      ILE  60 -20.708   1.351   0.004

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ALA  61           H        ALA  61 -21.702  -1.581   5.268
    2    HA   ALA  61           HA       ALA  61 -24.005  -0.028   4.802
    3    HB1  ALA  61           HB1      ALA  61 -25.145  -1.562   6.145
    4    HB2  ALA  61           HB2      ALA  61 -23.727  -1.876   7.146
    5    HB3  ALA  61           HB3      ALA  61 -23.798  -2.501   5.498

  No H/Q in entry =           5
  In of MODEL   55
    1    H    TYR  62           H        TYR  62 -21.787  -0.011   7.594
    2    HA   TYR  62           HA       TYR  62 -23.415   1.586   9.254
    3    HB2  TYR  62           HB2      TYR  62 -21.378   2.135  10.464
    4    HB3  TYR  62           HB3      TYR  62 -21.386   0.421  10.050
    5    HD1  TYR  62           HD1      TYR  62 -19.784  -0.483   8.419
    6    HD2  TYR  62           HD2      TYR  62 -19.727   3.659   9.467
    7    HE1  TYR  62           HE1      TYR  62 -17.587  -0.241   7.328
    8    HE2  TYR  62           HE2      TYR  62 -17.516   3.896   8.377
    9    HH   TYR  62           HH       TYR  62 -16.145   1.273   6.515

  No H/Q in entry =           9
  In of MODEL   55
    1    H    MET  63           H        MET  63 -21.822   2.496   6.385
    2    HA   MET  63           HA       MET  63 -21.786   5.339   7.055
    3    HB2  MET  63           HB2      MET  63 -21.112   3.819   4.536
    4    HB3  MET  63           HB3      MET  63 -21.011   5.574   4.690
    5    HG2  MET  63           HG2      MET  63 -19.284   5.336   6.379
    6    HG3  MET  63           HG3      MET  63 -19.394   3.582   6.257
    7    HE2  MET  63           HE1      MET  63 -17.526   6.644   3.730
    8    HE1  MET  63           HE2      MET  63 -19.061   6.766   4.587
    9    HE3  MET  63           HE3      MET  63 -19.035   6.286   2.889

  No H/Q in entry =           9
  In of MODEL   55
    1    H    LEU  64           H        LEU  64 -24.264   3.358   6.115
    2    HA   LEU  64           HA       LEU  64 -25.545   4.699   4.029
    3    HB2  LEU  64           HB2      LEU  64 -26.311   2.564   4.968
    4    HB3  LEU  64           HB3      LEU  64 -26.803   3.397   6.442
    5    HG   LEU  64           HG       LEU  64 -28.558   4.561   5.208
    6   HD13  LEU  64          HD11      LEU  64 -28.294   4.794   2.973
    7   HD12  LEU  64          HD12      LEU  64 -28.863   3.130   2.844
    8   HD11  LEU  64          HD13      LEU  64 -27.133   3.471   2.894
    9   HD23  LEU  64          HD21      LEU  64 -28.948   1.720   4.487
   10   HD22  LEU  64          HD22      LEU  64 -29.985   2.815   5.401
   11   HD21  LEU  64          HD23      LEU  64 -28.572   2.093   6.169

  No H/Q in entry =          11
  In of MODEL   55
    1    HA   PRO  65           HA       PRO  65 -27.861   7.774   6.760
    2    HB2  PRO  65           HB2      PRO  65 -25.862   8.044   9.006
    3    HB3  PRO  65           HB3      PRO  65 -27.613   8.245   9.055
    4    HG2  PRO  65           HG2      PRO  65 -26.577   6.044   9.998
    5    HG3  PRO  65           HG3      PRO  65 -27.997   5.937   8.958
    6    HD2  PRO  65           HD2      PRO  65 -25.102   5.449   8.250
    7    HD3  PRO  65           HD3      PRO  65 -26.518   4.493   7.816

  No H/Q in entry =           7
  In of MODEL   55
    1    H    GLU  66           H        GLU  66 -24.305   7.881   6.821
    2    HA   GLU  66           HA       GLU  66 -24.138  10.687   6.390
    3    HB2  GLU  66           HB2      GLU  66 -22.223   8.459   5.752
    4    HB3  GLU  66           HB3      GLU  66 -21.852  10.168   5.529
    5    HG2  GLU  66           HG2      GLU  66 -22.073  10.549   7.894
    6    HG3  GLU  66           HG3      GLU  66 -22.521   8.862   8.141

  No H/Q in entry =           6
  In of MODEL   55
    1    H    ILE  67           H        ILE  67 -24.122   7.920   4.162
    2    HA   ILE  67           HA       ILE  67 -23.791   9.625   1.853
    3    HB   ILE  67           HB       ILE  67 -24.557   6.682   2.061
    4   HG12  ILE  67          HG12      ILE  67 -21.985   7.961   1.119
    5   HG13  ILE  67          HG13      ILE  67 -22.256   7.544   2.810
    6   HG21  ILE  67          HG21      ILE  67 -24.592   8.541  -0.180
    7   HG23  ILE  67          HG22      ILE  67 -25.142   6.867  -0.113
    8   HG22  ILE  67          HG23      ILE  67 -23.449   7.225  -0.450
    9   HD12  ILE  67          HD11      ILE  67 -21.764   5.772   0.474
   10   HD11  ILE  67          HD12      ILE  67 -22.747   5.166   1.805
   11   HD13  ILE  67          HD13      ILE  67 -21.096   5.708   2.105

  No H/Q in entry =          11
  In of MODEL   55
    1    H    GLN  68           H        GLN  68 -26.606   8.459   3.506
    2    HA   GLN  68           HA       GLN  68 -28.481   9.290   1.531
    3    HB2  GLN  68           HB2      GLN  68 -28.710   8.947   4.518
    4    HB3  GLN  68           HB3      GLN  68 -30.059   9.475   3.525
    5    HG2  GLN  68           HG2      GLN  68 -30.002   7.434   2.267
    6    HG3  GLN  68           HG3      GLN  68 -28.525   6.929   3.068
    7   HE21  GLN  68          HE21      GLN  68 -30.643   5.475   2.954
    8   HE22  GLN  68          HE22      GLN  68 -31.446   4.996   4.375

  No H/Q in entry =           8
  In of MODEL   55
    1    H    ARG  69           H        ARG  69 -26.940  11.049   4.248
    2    HA   ARG  69           HA       ARG  69 -28.413  13.466   3.826
    3    HB2  ARG  69           HB2      ARG  69 -26.024  12.652   5.414
    4    HB3  ARG  69           HB3      ARG  69 -26.179  14.364   5.040
    5    HG2  ARG  69           HG2      ARG  69 -28.492  14.315   6.020
    6    HG3  ARG  69           HG3      ARG  69 -28.209  12.640   6.508
    7    HD2  ARG  69           HD2      ARG  69 -26.616  15.074   7.396
    8    HD3  ARG  69           HD3      ARG  69 -27.701  14.129   8.402
    9    HE   ARG  69           HE       ARG  69 -25.055  13.302   7.450
   10   HH21  ARG  69          HH11      ARG  69 -24.167  11.586   8.658
   11   HH22  ARG  69          HH12      ARG  69 -25.156  10.736   9.797
   12   HH11  ARG  69          HH21      ARG  69 -27.980  12.643   9.164
   13   HH12  ARG  69          HH22      ARG  69 -27.314  11.332  10.081

  No H/Q in entry =          13
  In of MODEL   55
    1    H    LEU  70           H        LEU  70 -25.489  12.172   2.467
    2    HA   LEU  70           HA       LEU  70 -24.482  14.572   1.274
    3    HB2  LEU  70           HB2      LEU  70 -23.387  12.305   1.885
    4    HB3  LEU  70           HB3      LEU  70 -23.987  11.799   0.306
    5    HG   LEU  70           HG       LEU  70 -22.458  13.229  -0.798
    6   HD11  LEU  70          HD11      LEU  70 -21.662  14.130   1.980
    7   HD13  LEU  70          HD12      LEU  70 -22.406  15.123   0.726
    8   HD12  LEU  70          HD13      LEU  70 -20.767  14.509   0.505
    9   HD22  LEU  70          HD21      LEU  70 -20.953  11.576  -0.557
   10   HD21  LEU  70          HD22      LEU  70 -21.851  11.027   0.859
   11   HD23  LEU  70          HD23      LEU  70 -20.511  12.159   1.048

  No H/Q in entry =          11
  In of MODEL   55
    1    H    LEU  71           H        LEU  71 -26.530  11.932   0.189
    2    HA   LEU  71           HA       LEU  71 -27.126  13.374  -2.337
    3    HB2  LEU  71           HB2      LEU  71 -27.206  10.387  -1.866
    4    HB3  LEU  71           HB3      LEU  71 -27.376  11.229  -3.405
    5    HG   LEU  71           HG       LEU  71 -24.852  11.360  -1.755
    6   HD12  LEU  71          HD11      LEU  71 -24.847   9.711  -4.173
    7   HD11  LEU  71          HD12      LEU  71 -25.826   9.056  -2.860
    8   HD13  LEU  71          HD13      LEU  71 -24.118   9.410  -2.595
    9   HD22  LEU  71          HD21      LEU  71 -25.035  13.158  -3.263
   10   HD21  LEU  71          HD22      LEU  71 -25.495  12.084  -4.585
   11   HD23  LEU  71          HD23      LEU  71 -23.866  12.010  -3.912

  No H/Q in entry =          11
  In of MODEL   55
    1    HA   PRO  72           HA       PRO  72 -30.961  12.790   0.303
    2    HB2  PRO  72           HB2      PRO  72 -31.921  15.314   0.204
    3    HB3  PRO  72           HB3      PRO  72 -30.591  14.925   1.294
    4    HG2  PRO  72           HG2      PRO  72 -30.464  16.101  -1.470
    5    HG3  PRO  72           HG3      PRO  72 -29.714  16.696   0.011
    6    HD2  PRO  72           HD2      PRO  72 -28.322  15.178  -1.747
    7    HD3  PRO  72           HD3      PRO  72 -28.054  15.036  -0.011

  No H/Q in entry =           7
  In of MODEL   55
    1    H    ASN  73           H        ASN  73 -30.388  13.742  -2.922
    2    HA   ASN  73           HA       ASN  73 -33.236  13.315  -3.539
    3    HB2  ASN  73           HB2      ASN  73 -32.823  14.420  -5.647
    4    HB3  ASN  73           HB3      ASN  73 -32.335  15.432  -4.297
    5   HD21  ASN  73          HD21      ASN  73 -31.552  15.485  -6.978
    6   HD22  ASN  73          HD22      ASN  73 -29.880  15.388  -7.176

  No H/Q in entry =           6
  In of MODEL   55
    1    H    LYS  74           H        LYS  74 -31.167  11.143  -3.103
    2    HA   LYS  74           HA       LYS  74 -31.690   9.705  -5.637
    3    HB2  LYS  74           HB2      LYS  74 -29.141   9.525  -4.024
    4    HB3  LYS  74           HB3      LYS  74 -29.499   8.685  -5.534
    5    HG2  LYS  74           HG2      LYS  74 -29.348  11.665  -5.358
    6    HG3  LYS  74           HG3      LYS  74 -27.936  10.654  -5.659
    7    HD2  LYS  74           HD2      LYS  74 -29.024   9.667  -7.590
    8    HD3  LYS  74           HD3      LYS  74 -30.479  10.611  -7.272
    9    HE2  LYS  74           HE2      LYS  74 -29.334  12.659  -7.736
   10    HE3  LYS  74           HE3      LYS  74 -27.780  11.828  -7.827
   11    HZ2  LYS  74           HZ1      LYS  74 -29.281  12.355  -9.951
   12    HZ1  LYS  74           HZ2      LYS  74 -29.875  10.812  -9.563
   13    HZ3  LYS  74           HZ3      LYS  74 -28.219  11.033  -9.868

  No H/Q in entry =          13
  In of MODEL   55
    1    HA   PRO  75           HA       PRO  75 -32.957   6.694  -2.635
    2    HB2  PRO  75           HB2      PRO  75 -33.187   4.451  -4.197
    3    HB3  PRO  75           HB3      PRO  75 -34.364   5.762  -4.273
    4    HG2  PRO  75           HG2      PRO  75 -32.013   5.239  -6.048
    5    HG3  PRO  75           HG3      PRO  75 -33.678   5.609  -6.493
    6    HD2  PRO  75           HD2      PRO  75 -31.809   7.547  -6.473
    7    HD3  PRO  75           HD3      PRO  75 -33.453   7.889  -5.932

  No H/Q in entry =           7
  In of MODEL   55
    1    H    VAL  76           H        VAL  76 -31.459   5.707  -1.259
    2    HA   VAL  76           HA       VAL  76 -28.955   4.582  -2.366
    3    HB   VAL  76           HB       VAL  76 -29.288   6.060   0.280
    4   HG11  VAL  76          HG11      VAL  76 -26.889   4.850  -1.110
    5   HG13  VAL  76          HG12      VAL  76 -27.562   4.388   0.455
    6   HG12  VAL  76          HG13      VAL  76 -26.776   5.955   0.262
    7   HG22  VAL  76          HG21      VAL  76 -28.695   7.977  -0.626
    8   HG21  VAL  76          HG22      VAL  76 -29.217   7.247  -2.145
    9   HG23  VAL  76          HG23      VAL  76 -27.511   7.228  -1.697

  No H/Q in entry =           9
  In of MODEL   55
    1    H    GLU  77           H        GLU  77 -28.653   2.444  -1.735
    2    HA   GLU  77           HA       GLU  77 -29.400   1.650   0.929
    3    HB2  GLU  77           HB2      GLU  77 -30.945  -0.062   0.419
    4    HB3  GLU  77           HB3      GLU  77 -31.555   1.433  -0.294
    5    HG2  GLU  77           HG2      GLU  77 -30.925   0.680  -2.477
    6    HG3  GLU  77           HG3      GLU  77 -30.225  -0.786  -1.794

  No H/Q in entry =           6
  In of MODEL   55
    1    H    VAL  78           H        VAL  78 -28.992  -0.416   1.606
    2    HA   VAL  78           HA       VAL  78 -26.301  -1.094   0.714
    3    HB   VAL  78           HB       VAL  78 -27.965  -2.021   3.094
    4   HG11  VAL  78          HG11      VAL  78 -25.585  -3.169   1.971
    5   HG13  VAL  78          HG12      VAL  78 -26.469  -3.662   3.417
    6   HG12  VAL  78          HG13      VAL  78 -25.195  -2.450   3.532
    7   HG22  VAL  78          HG21      VAL  78 -26.555  -0.591   4.414
    8   HG21  VAL  78          HG22      VAL  78 -27.333   0.338   3.133
    9   HG23  VAL  78          HG23      VAL  78 -25.637  -0.127   2.982

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ILE  79           H        ILE  79 -25.695  -2.988  -0.176
    2    HA   ILE  79           HA       ILE  79 -27.702  -4.556  -1.503
    3    HB   ILE  79           HB       ILE  79 -24.692  -4.965  -1.288
    4   HG12  ILE  79          HG12      ILE  79 -26.378  -3.946  -3.581
    5   HG13  ILE  79          HG13      ILE  79 -25.539  -2.893  -2.440
    6   HG22  ILE  79          HG21      ILE  79 -25.757  -6.207  -3.592
    7   HG21  ILE  79          HG22      ILE  79 -26.716  -6.754  -2.217
    8   HG23  ILE  79          HG23      ILE  79 -24.965  -6.966  -2.211
    9   HD13  ILE  79          HD11      ILE  79 -24.129  -2.969  -4.262
   10   HD12  ILE  79          HD12      ILE  79 -24.403  -4.691  -4.527
   11   HD11  ILE  79          HD13      ILE  79 -23.433  -4.152  -3.154

  No H/Q in entry =          11
  In of MODEL   55
    1    H    ASP  80           H        ASP  80 -28.490  -6.505  -0.899
    2    HA   ASP  80           HA       ASP  80 -28.393  -7.378   1.755
    3    HB2  ASP  80           HB2      ASP  80 -30.129  -8.037   0.127
    4    HB3  ASP  80           HB3      ASP  80 -28.936  -9.006  -0.736

  No H/Q in entry =           4
  In of MODEL   55
    1    H    SER  81           H        SER  81 -26.811  -8.443   2.890
    2    HA   SER  81           HA       SER  81 -24.294  -9.040   1.695
    3    HB2  SER  81           HB2      SER  81 -23.695 -10.026   3.872
    4    HB3  SER  81           HB3      SER  81 -24.459  -8.450   4.073
    5    HG   SER  81           HG       SER  81 -25.999 -10.779   4.141

  No H/Q in entry =           5
  In of MODEL   55
    1    H    LEU  82           H        LEU  82 -26.921 -11.231   2.047
    2    HA   LEU  82           HA       LEU  82 -25.286 -13.543   1.542
    3    HB2  LEU  82           HB2      LEU  82 -28.244 -13.048   1.280
    4    HB3  LEU  82           HB3      LEU  82 -27.475 -14.624   1.104
    5    HG   LEU  82           HG       LEU  82 -27.501 -12.989   3.623
    6   HD11  LEU  82          HD11      LEU  82 -29.197 -15.259   2.599
    7   HD13  LEU  82          HD12      LEU  82 -29.716 -13.734   3.319
    8   HD12  LEU  82          HD13      LEU  82 -28.983 -14.980   4.328
    9   HD22  LEU  82          HD21      LEU  82 -25.573 -14.326   3.637
   10   HD21  LEU  82          HD22      LEU  82 -26.375 -15.645   2.784
   11   HD23  LEU  82          HD23      LEU  82 -26.769 -15.319   4.472

  No H/Q in entry =          11
  In of MODEL   55
    1    H    LEU  83           H        LEU  83 -27.335 -11.412  -0.391
    2    HA   LEU  83           HA       LEU  83 -27.090 -12.785  -2.849
    3    HB2  LEU  83           HB2      LEU  83 -27.609  -9.889  -2.227
    4    HB3  LEU  83           HB3      LEU  83 -27.622 -10.550  -3.861
    5    HG   LEU  83           HG       LEU  83 -29.632 -10.994  -1.674
    6   HD13  LEU  83          HD11      LEU  83 -30.462  -9.187  -2.753
    7   HD12  LEU  83          HD12      LEU  83 -30.885 -10.329  -4.026
    8   HD11  LEU  83          HD13      LEU  83 -29.386  -9.407  -4.132
    9   HD23  LEU  83          HD21      LEU  83 -29.732 -12.282  -4.387
   10   HD22  LEU  83          HD22      LEU  83 -30.683 -12.655  -2.949
   11   HD21  LEU  83          HD23      LEU  83 -28.976 -13.095  -3.015

  No H/Q in entry =          11
  In of MODEL   55
    1    H    TYR  84           H        TYR  84 -25.223 -10.311  -1.203
    2    HA   TYR  84           HA       TYR  84 -23.389  -9.773  -3.346
    3    HB2  TYR  84           HB2      TYR  84 -23.940  -8.266  -1.369
    4    HB3  TYR  84           HB3      TYR  84 -22.934  -9.336  -0.394
    5    HD1  TYR  84           HD1      TYR  84 -20.519  -9.790  -1.471
    6    HD2  TYR  84           HD2      TYR  84 -22.939  -6.351  -2.216
    7    HE1  TYR  84           HE1      TYR  84 -18.506  -8.540  -2.176
    8    HE2  TYR  84           HE2      TYR  84 -20.938  -5.093  -2.932
    9    HH   TYR  84           HH       TYR  84 -17.843  -6.072  -2.249

  No H/Q in entry =           9
  In of MODEL   55
    1    H    GLY  85           H        GLY  85 -23.063 -11.737  -0.381
    2    HA3  GLY  85           HA2      GLY  85 -20.453 -12.586  -0.864
    3    HA2  GLY  85           HA3      GLY  85 -21.647 -13.469   0.086

  No H/Q in entry =           3
  In of MODEL   55
    1    H    LYS  86           H        LYS  86 -23.485 -13.932  -1.964
    2    HA   LYS  86           HA       LYS  86 -22.346 -16.276  -3.204
    3    HB2  LYS  86           HB2      LYS  86 -25.044 -14.931  -3.289
    4    HB3  LYS  86           HB3      LYS  86 -24.688 -16.468  -4.074
    5    HG2  LYS  86           HG2      LYS  86 -24.284 -17.485  -1.920
    6    HG3  LYS  86           HG3      LYS  86 -24.616 -15.944  -1.127
    7    HD2  LYS  86           HD2      LYS  86 -26.858 -15.913  -2.154
    8    HD3  LYS  86           HD3      LYS  86 -26.524 -17.471  -2.909
    9    HE2  LYS  86           HE2      LYS  86 -26.499 -16.985   0.065
   10    HE3  LYS  86           HE3      LYS  86 -27.874 -17.634  -0.827
   11    HZ1  LYS  86           HZ1      LYS  86 -26.296 -19.384  -1.666
   12    HZ3  LYS  86           HZ2      LYS  86 -26.679 -19.478  -0.013
   13    HZ2  LYS  86           HZ3      LYS  86 -25.185 -18.840  -0.503

  No H/Q in entry =          13
  In of MODEL   55
    1    H    VAL  87           H        VAL  87 -22.460 -13.072  -4.130
    2    HA   VAL  87           HA       VAL  87 -22.214 -11.908  -6.083
    3    HB   VAL  87           HB       VAL  87 -21.072 -14.355  -7.442
    4   HG13  VAL  87          HG11      VAL  87 -19.830 -12.814  -8.661
    5   HG12  VAL  87          HG12      VAL  87 -19.839 -11.624  -7.358
    6   HG11  VAL  87          HG13      VAL  87 -21.285 -11.872  -8.337
    7   HG22  VAL  87          HG21      VAL  87 -20.026 -14.623  -5.362
    8   HG21  VAL  87          HG22      VAL  87 -19.833 -12.887  -5.139
    9   HG23  VAL  87          HG23      VAL  87 -18.864 -13.734  -6.344

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ASP  88           H        ASP  88 -24.702 -12.642  -5.715
    2    HA   ASP  88           HA       ASP  88 -25.784 -13.924  -8.096
    3    HB2  ASP  88           HB2      ASP  88 -26.761 -14.184  -5.765
    4    HB3  ASP  88           HB3      ASP  88 -27.279 -12.502  -5.879

  No H/Q in entry =           4
  In of MODEL   55
    1    H    GLY  89           H        GLY  89 -25.136 -12.657  -9.752
    2    HA3  GLY  89           HA2      GLY  89 -25.425  -9.895  -9.979
    3    HA2  GLY  89           HA3      GLY  89 -25.362 -11.028 -11.329

  No H/Q in entry =           3
  In of MODEL   55
    1    H    LEU  90           H        LEU  90 -27.753 -12.469 -10.856
    2    HA   LEU  90           HA       LEU  90 -29.642 -10.616 -11.982
    3    HB2  LEU  90           HB2      LEU  90 -29.617 -13.019 -12.537
    4    HB3  LEU  90           HB3      LEU  90 -30.101 -13.388 -10.883
    5    HG   LEU  90           HG       LEU  90 -32.263 -12.358 -11.248
    6   HD13  LEU  90          HD11      LEU  90 -32.158 -10.626 -12.740
    7   HD12  LEU  90          HD12      LEU  90 -32.653 -11.894 -13.863
    8   HD11  LEU  90          HD13      LEU  90 -30.955 -11.433 -13.750
    9   HD23  LEU  90          HD21      LEU  90 -32.140 -14.008 -13.667
   10   HD22  LEU  90          HD22      LEU  90 -33.107 -14.196 -12.203
   11   HD21  LEU  90          HD23      LEU  90 -31.430 -14.744 -12.229

  No H/Q in entry =          11
  In of MODEL   55
    1    H    GLY  91           H        GLY  91 -29.403 -12.078  -8.783
    2    HA3  GLY  91           HA2      GLY  91 -31.779 -11.046  -7.745
    3    HA2  GLY  91           HA3      GLY  91 -30.363 -11.516  -6.803

  No H/Q in entry =           3
  In of MODEL   55
    1    H    VAL  92           H        VAL  92 -28.521  -9.625  -7.686
    2    HA   VAL  92           HA       VAL  92 -29.395  -7.340  -6.156
    3    HB   VAL  92           HB       VAL  92 -26.840  -7.726  -7.759
    4   HG12  VAL  92          HG11      VAL  92 -27.068  -5.825  -5.450
    5   HG11  VAL  92          HG12      VAL  92 -27.760  -5.324  -6.994
    6   HG13  VAL  92          HG13      VAL  92 -26.047  -5.723  -6.885
    7   HG22  VAL  92          HG21      VAL  92 -26.548  -9.287  -6.152
    8   HG21  VAL  92          HG22      VAL  92 -27.718  -8.541  -5.061
    9   HG23  VAL  92          HG23      VAL  92 -26.089  -7.878  -5.196

  No H/Q in entry =           9
  In of MODEL   55
    1    H    LEU  93           H        LEU  93 -28.977  -8.020  -9.571
    2    HA   LEU  93           HA       LEU  93 -29.430  -5.410 -10.526
    3    HB2  LEU  93           HB2      LEU  93 -28.722  -7.252 -11.972
    4    HB3  LEU  93           HB3      LEU  93 -30.283  -8.040 -11.734
    5    HG   LEU  93           HG       LEU  93 -31.374  -6.129 -12.873
    6   HD11  LEU  93          HD11      LEU  93 -29.586  -4.457 -12.394
    7   HD13  LEU  93          HD12      LEU  93 -30.031  -4.522 -14.100
    8   HD12  LEU  93          HD13      LEU  93 -28.546  -5.293 -13.548
    9   HD23  LEU  93          HD21      LEU  93 -30.325  -6.678 -15.160
   10   HD22  LEU  93          HD22      LEU  93 -31.113  -7.957 -14.238
   11   HD21  LEU  93          HD23      LEU  93 -29.352  -7.833 -14.248

  No H/Q in entry =          11
  In of MODEL   55
    1    H    LYS  94           H        LYS  94 -31.699  -8.038  -9.640
    2    HA   LYS  94           HA       LYS  94 -34.101  -6.696 -10.267
    3    HB2  LYS  94           HB2      LYS  94 -33.493  -8.838  -8.236
    4    HB3  LYS  94           HB3      LYS  94 -35.118  -8.209  -8.504
    5    HG2  LYS  94           HG2      LYS  94 -35.011  -9.004 -10.831
    6    HG3  LYS  94           HG3      LYS  94 -33.421  -9.690 -10.503
    7    HD2  LYS  94           HD2      LYS  94 -34.480 -11.048  -8.659
    8    HD3  LYS  94           HD3      LYS  94 -36.050 -10.467  -9.213
    9    HE2  LYS  94           HE2      LYS  94 -35.509 -11.399 -11.473
   10    HE3  LYS  94           HE3      LYS  94 -34.060 -12.118 -10.769
   11    HZ3  LYS  94           HZ1      LYS  94 -35.850 -13.713 -10.914
   12    HZ2  LYS  94           HZ2      LYS  94 -36.859 -12.717  -9.978
   13    HZ1  LYS  94           HZ3      LYS  94 -35.468 -13.404  -9.289

  No H/Q in entry =          13
  In of MODEL   55
    1    H    ALA  95           H        ALA  95 -32.261  -6.714  -7.227
    2    HA   ALA  95           HA       ALA  95 -34.163  -5.193  -5.754
    3    HB2  ALA  95           HB1      ALA  95 -31.734  -6.468  -5.215
    4    HB3  ALA  95           HB2      ALA  95 -32.742  -5.591  -4.066
    5    HB1  ALA  95           HB3      ALA  95 -31.430  -4.760  -4.902

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ALA  96           H        ALA  96 -31.567  -4.258  -7.873
    2    HA   ALA  96           HA       ALA  96 -31.575  -1.487  -7.126
    3    HB2  ALA  96           HB1      ALA  96 -30.232  -1.229  -9.245
    4    HB3  ALA  96           HB2      ALA  96 -30.471  -2.950  -9.546
    5    HB1  ALA  96           HB3      ALA  96 -29.569  -2.420  -8.126

  No H/Q in entry =           5
  In of MODEL   55
    1    H    VAL  97           H        VAL  97 -33.051  -3.286  -9.788
    2    HA   VAL  97           HA       VAL  97 -34.215  -1.042 -11.061
    3    HB   VAL  97           HB       VAL  97 -34.911  -3.997 -11.071
    4   HG11  VAL  97          HG11      VAL  97 -36.781  -2.066 -11.568
    5   HG13  VAL  97          HG12      VAL  97 -36.783  -3.666 -12.308
    6   HG12  VAL  97          HG13      VAL  97 -36.086  -2.297 -13.172
    7   HG21  VAL  97          HG21      VAL  97 -33.713  -2.141 -13.130
    8   HG23  VAL  97          HG22      VAL  97 -34.102  -3.840 -13.401
    9   HG22  VAL  97          HG23      VAL  97 -32.864  -3.394 -12.225

  No H/Q in entry =           9
  In of MODEL   55
    1    H    ALA  98           H        ALA  98 -35.302  -3.239  -8.497
    2    HA   ALA  98           HA       ALA  98 -37.902  -2.184  -8.146
    3    HB1  ALA  98           HB1      ALA  98 -36.803  -4.333  -7.097
    4    HB3  ALA  98           HB2      ALA  98 -38.012  -3.446  -6.168
    5    HB2  ALA  98           HB3      ALA  98 -36.297  -3.228  -5.819

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ALA  99           H        ALA  99 -34.848  -1.255  -6.521
    2    HA   ALA  99           HA       ALA  99 -36.043   0.701  -4.872
    3    HB1  ALA  99           HB1      ALA  99 -33.367  -0.097  -5.625
    4    HB2  ALA  99           HB2      ALA  99 -33.938   0.647  -4.130
    5    HB3  ALA  99           HB3      ALA  99 -33.506   1.657  -5.509

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ILE 100           H        ILE 100 -35.024   0.839  -8.234
    2    HA   ILE 100           HA       ILE 100 -35.308   3.676  -8.479
    3    HB   ILE 100           HB       ILE 100 -35.335   1.499 -10.597
    4   HG12  ILE 100          HG12      ILE 100 -33.242   3.576  -9.955
    5   HG13  ILE 100          HG13      ILE 100 -33.215   1.934  -9.310
    6   HG21  ILE 100          HG21      ILE 100 -35.864   4.401 -10.753
    7   HG23  ILE 100          HG22      ILE 100 -36.329   3.104 -11.855
    8   HG22  ILE 100          HG23      ILE 100 -34.700   3.779 -11.923
    9   HD12  ILE 100          HD11      ILE 100 -32.731   2.884 -12.095
   10   HD11  ILE 100          HD12      ILE 100 -33.331   1.249 -11.822
   11   HD13  ILE 100          HD13      ILE 100 -31.798   1.755 -11.114

  No H/Q in entry =          11
  In of MODEL   55
    1    H    LYS 101           H        LYS 101 -37.508   0.979  -9.170
    2    HA   LYS 101           HA       LYS 101 -39.653   2.541 -10.174
    3    HB2  LYS 101           HB2      LYS 101 -39.431  -0.217  -9.022
    4    HB3  LYS 101           HB3      LYS 101 -41.011   0.485  -9.367
    5    HG2  LYS 101           HG2      LYS 101 -40.553   0.616 -11.667
    6    HG3  LYS 101           HG3      LYS 101 -38.842   0.275 -11.418
    7    HD2  LYS 101           HD2      LYS 101 -40.026  -1.686 -12.280
    8    HD3  LYS 101           HD3      LYS 101 -39.380  -1.977 -10.666
    9    HE2  LYS 101           HE2      LYS 101 -41.414  -2.743 -10.143
   10    HE3  LYS 101           HE3      LYS 101 -41.932  -1.056 -10.159
   11    HZ3  LYS 101           HZ1      LYS 101 -42.827  -1.264 -12.270
   12    HZ2  LYS 101           HZ2      LYS 101 -43.231  -2.747 -11.547
   13    HZ1  LYS 101           HZ3      LYS 101 -41.932  -2.661 -12.638

  No H/Q in entry =          13
  In of MODEL   55
    1    H    LYS 102           H        LYS 102 -39.093   1.112  -6.955
    2    HA   LYS 102           HA       LYS 102 -41.377   2.235  -5.756
    3    HB2  LYS 102           HB2      LYS 102 -40.069   0.424  -4.731
    4    HB3  LYS 102           HB3      LYS 102 -38.717   1.531  -4.504
    5    HG2  LYS 102           HG2      LYS 102 -40.076   2.890  -3.013
    6    HG3  LYS 102           HG3      LYS 102 -41.432   1.787  -3.242
    7    HD2  LYS 102           HD2      LYS 102 -40.134  -0.024  -2.206
    8    HD3  LYS 102           HD3      LYS 102 -38.779   1.081  -1.975
    9    HE2  LYS 102           HE2      LYS 102 -40.179   2.521  -0.572
   10    HE3  LYS 102           HE3      LYS 102 -41.554   1.446  -0.825
   11    HZ1  LYS 102           HZ1      LYS 102 -39.766  -0.236   0.185
   12    HZ3  LYS 102           HZ2      LYS 102 -40.904   0.616   1.113
   13    HZ2  LYS 102           HZ3      LYS 102 -39.315   1.197   0.974

  No H/Q in entry =          13
  In of MODEL   55
    1    H    ALA 103           H        ALA 103 -38.480   3.724  -6.795
    2    HA   ALA 103           HA       ALA 103 -38.778   6.044  -5.031
    3    HB2  ALA 103           HB1      ALA 103 -36.822   6.836  -6.623
    4    HB3  ALA 103           HB2      ALA 103 -36.726   5.118  -7.006
    5    HB1  ALA 103           HB3      ALA 103 -36.511   5.663  -5.344

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ALA 104           H        ALA 104 -39.387   5.262  -8.368
    2    HA   ALA 104           HA       ALA 104 -40.076   8.019  -9.011
    3    HB2  ALA 104           HB1      ALA 104 -40.104   7.331 -11.208
    4    HB1  ALA 104           HB2      ALA 104 -40.773   5.747 -10.814
    5    HB3  ALA 104           HB3      ALA 104 -39.060   6.075 -10.544

  No H/Q in entry =           5
  In of MODEL   55
    1    H    ALA 105           H        ALA 105 -41.599   5.873  -7.182
    2    HA   ALA 105           HA       ALA 105 -44.072   7.177  -7.155
    3    HB2  ALA 105           HB1      ALA 105 -44.794   6.274  -9.183
    4    HB3  ALA 105           HB2      ALA 105 -45.382   5.073  -8.035
    5    HB1  ALA 105           HB3      ALA 105 -43.904   4.770  -8.947

  No H/Q in entry =           5
  In of MODEL   56
    1    H1   ALA   1           H3       ALA   1 -12.301 -15.614  -2.409
    2    H2   ALA   1           H2       ALA   1 -11.365 -16.763  -3.247
    3    H3   ALA   1           H1       ALA   1 -12.501 -15.812  -4.083
    4    HA   ALA   1           HA       ALA   1 -13.911 -17.503  -3.845
    5    HB3  ALA   1           HB1      ALA   1 -12.528 -19.283  -3.379
    6    HB1  ALA   1           HB2      ALA   1 -13.286 -19.165  -1.791
    7    HB2  ALA   1           HB3      ALA   1 -11.705 -18.434  -2.070

  No H/Q in entry =           7
  In of MODEL   56
    1    H    GLU   2           H        GLU   2 -15.543 -18.346  -2.192
    2    HA   GLU   2           HA       GLU   2 -17.182 -16.614  -1.138
    3    HB2  GLU   2           HB2      GLU   2 -16.261 -19.044   0.410
    4    HB3  GLU   2           HB3      GLU   2 -17.779 -18.184   0.661
    5    HG2  GLU   2           HG2      GLU   2 -18.763 -19.265  -1.074
    6    HG3  GLU   2           HG3      GLU   2 -17.436 -18.874  -2.157

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLU   3           H        GLU   3 -15.283 -17.977   1.490
    2    HA   GLU   3           HA       GLU   3 -15.492 -15.621   3.045
    3    HB2  GLU   3           HB2      GLU   3 -13.923 -18.178   3.300
    4    HB3  GLU   3           HB3      GLU   3 -13.685 -16.859   4.446
    5    HG2  GLU   3           HG2      GLU   3 -15.881 -16.996   5.261
    6    HG3  GLU   3           HG3      GLU   3 -16.479 -17.793   3.811

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LEU   4           H        LEU   4 -12.544 -17.120   1.660
    2    HA   LEU   4           HA       LEU   4 -10.698 -15.229   2.260
    3    HB2  LEU   4           HB2      LEU   4 -10.933 -16.527  -0.464
    4    HB3  LEU   4           HB3      LEU   4  -9.477 -15.815   0.223
    5    HG   LEU   4           HG       LEU   4 -10.989 -18.202   1.335
    6   HD13  LEU   4          HD11      LEU   4  -9.364 -19.569   0.409
    7   HD12  LEU   4          HD12      LEU   4  -8.145 -18.294   0.384
    8   HD11  LEU   4          HD13      LEU   4  -9.432 -18.308  -0.821
    9   HD23  LEU   4          HD21      LEU   4  -8.741 -18.279   2.721
   10   HD22  LEU   4          HD22      LEU   4 -10.056 -17.230   3.246
   11   HD21  LEU   4          HD23      LEU   4  -8.687 -16.551   2.366

  No H/Q in entry =          11
  In of MODEL   56
    1    H    GLU   5           H        GLU   5 -13.027 -15.009  -0.418
    2    HA   GLU   5           HA       GLU   5 -12.005 -12.532  -1.419
    3    HB2  GLU   5           HB2      GLU   5 -13.359 -14.112  -2.781
    4    HB3  GLU   5           HB3      GLU   5 -14.759 -13.736  -1.776
    5    HG2  GLU   5           HG2      GLU   5 -14.610 -11.370  -2.422
    6    HG3  GLU   5           HG3      GLU   5 -13.187 -11.719  -3.403

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLU   6           H        GLU   6 -14.740 -13.391   0.669
    2    HA   GLU   6           HA       GLU   6 -15.627 -10.708   1.064
    3    HB2  GLU   6           HB2      GLU   6 -17.080 -12.669   1.463
    4    HB3  GLU   6           HB3      GLU   6 -16.043 -13.154   2.803
    5    HG2  GLU   6           HG2      GLU   6 -16.529 -11.052   3.969
    6    HG3  GLU   6           HG3      GLU   6 -17.527 -10.517   2.619

  No H/Q in entry =           6
  In of MODEL   56
    1    H    VAL   7           H        VAL   7 -13.337 -12.833   2.642
    2    HA   VAL   7           HA       VAL   7 -12.865 -11.259   4.969
    3    HB   VAL   7           HB       VAL   7 -11.172 -13.315   3.524
    4   HG11  VAL   7          HG11      VAL   7 -10.699 -11.783   6.088
    5   HG13  VAL   7          HG12      VAL   7  -9.597 -12.006   4.730
    6   HG12  VAL   7          HG13      VAL   7  -9.962 -13.360   5.800
    7   HG21  VAL   7          HG21      VAL   7 -13.429 -13.863   4.740
    8   HG23  VAL   7          HG22      VAL   7 -12.503 -13.594   6.217
    9   HG22  VAL   7          HG23      VAL   7 -12.016 -14.858   5.090

  No H/Q in entry =           9
  In of MODEL   56
    1    H    VAL   8           H        VAL   8 -11.348 -11.386   1.762
    2    HA   VAL   8           HA       VAL   8  -9.274  -9.527   2.257
    3    HB   VAL   8           HB       VAL   8 -10.736 -10.202  -0.307
    4   HG13  VAL   8          HG11      VAL   8  -9.766  -8.086  -0.718
    5   HG12  VAL   8          HG12      VAL   8  -8.550  -9.223  -1.301
    6   HG11  VAL   8          HG13      VAL   8  -8.350  -8.447   0.270
    7   HG23  VAL   8          HG21      VAL   8  -7.908 -11.012   0.114
    8   HG22  VAL   8          HG22      VAL   8  -9.255 -11.937  -0.543
    9   HG21  VAL   8          HG23      VAL   8  -9.056 -11.798   1.201

  No H/Q in entry =           9
  In of MODEL   56
    1    H    MET   9           H        MET   9 -12.614  -9.116   1.090
    2    HA   MET   9           HA       MET   9 -12.531  -6.340   0.653
    3    HB2  MET   9           HB2      MET   9 -14.762  -8.195   1.485
    4    HB3  MET   9           HB3      MET   9 -15.026  -6.466   1.254
    5    HG2  MET   9           HG2      MET   9 -14.187  -6.633  -1.052
    6    HG3  MET   9           HG3      MET   9 -13.886  -8.356  -0.825
    7    HE3  MET   9           HE1      MET   9 -17.839  -6.122  -0.725
    8    HE2  MET   9           HE2      MET   9 -16.773  -5.838  -2.098
    9    HE1  MET   9           HE3      MET   9 -16.189  -5.542  -0.463

  No H/Q in entry =           9
  In of MODEL   56
    1    H    GLY  10           H        GLY  10 -13.213  -8.224   3.581
    2    HA3  GLY  10           HA2      GLY  10 -13.750  -6.035   5.297
    3    HA2  GLY  10           HA3      GLY  10 -13.197  -7.627   5.813

  No H/Q in entry =           3
  In of MODEL   56
    1    H    LEU  11           H        LEU  11 -10.750  -7.768   4.503
    2    HA   LEU  11           HA       LEU  11  -9.044  -6.343   6.262
    3    HB2  LEU  11           HB2      LEU  11  -8.501  -7.773   3.657
    4    HB3  LEU  11           HB3      LEU  11  -7.228  -7.075   4.658
    5    HG   LEU  11           HG       LEU  11  -9.245  -9.095   5.672
    6   HD13  LEU  11          HD11      LEU  11  -8.028 -10.340   4.111
    7   HD12  LEU  11          HD12      LEU  11  -7.097 -10.584   5.589
    8   HD11  LEU  11          HD13      LEU  11  -6.547  -9.423   4.381
    9   HD22  LEU  11          HD21      LEU  11  -8.390  -8.086   7.590
   10   HD21  LEU  11          HD22      LEU  11  -6.848  -7.694   6.830
   11   HD23  LEU  11          HD23      LEU  11  -7.185  -9.348   7.340

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  12           H        ILE  12  -9.935  -5.794   2.870
    2    HA   ILE  12           HA       ILE  12  -8.229  -3.574   2.445
    3    HB   ILE  12           HB       ILE  12 -10.886  -4.225   1.145
    4   HG12  ILE  12          HG12      ILE  12  -8.861  -5.897   1.080
    5   HG13  ILE  12          HG13      ILE  12  -9.722  -5.540  -0.403
    6   HG21  ILE  12          HG21      ILE  12  -8.640  -2.353   0.330
    7   HG23  ILE  12          HG22      ILE  12 -10.308  -1.914   0.678
    8   HG22  ILE  12          HG23      ILE  12  -9.920  -2.865  -0.726
    9   HD11  ILE  12          HD11      ILE  12  -7.192  -4.132   0.493
   10   HD13  ILE  12          HD12      ILE  12  -7.988  -3.994  -1.074
   11   HD12  ILE  12          HD13      ILE  12  -7.218  -5.494  -0.612

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  13           H        ILE  13 -11.594  -3.821   3.532
    2    HA   ILE  13           HA       ILE  13 -12.039  -1.031   3.798
    3    HB   ILE  13           HB       ILE  13 -13.260  -3.446   5.153
    4   HG12  ILE  13          HG12      ILE  13 -13.479  -2.882   2.618
    5   HG13  ILE  13          HG13      ILE  13 -14.905  -3.347   3.520
    6   HG22  ILE  13          HG21      ILE  13 -15.156  -1.741   5.666
    7   HG21  ILE  13          HG22      ILE  13 -13.913  -0.512   5.475
    8   HG23  ILE  13          HG23      ILE  13 -13.745  -1.749   6.719
    9   HD13  ILE  13          HD11      ILE  13 -15.633  -1.061   3.724
   10   HD12  ILE  13          HD12      ILE  13 -15.205  -1.337   2.047
   11   HD11  ILE  13          HD13      ILE  13 -14.093  -0.475   3.087

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ASN  14           H        ASN  14 -10.946  -3.525   6.077
    2    HA   ASN  14           HA       ASN  14 -10.742  -1.886   8.362
    3    HB2  ASN  14           HB2      ASN  14 -10.502  -4.495   8.043
    4    HB3  ASN  14           HB3      ASN  14  -8.791  -4.117   7.889
    5   HD21  ASN  14          HD21      ASN  14  -9.440  -5.636  10.065
    6   HD22  ASN  14          HD22      ASN  14  -9.410  -4.715  11.489

  No H/Q in entry =           6
  In of MODEL   56
    1    H    SER  15           H        SER  15  -8.338  -2.724   5.876
    2    HA   SER  15           HA       SER  15  -6.190  -1.241   6.952
    3    HB2  SER  15           HB2      SER  15  -5.166  -1.462   4.795
    4    HB3  SER  15           HB3      SER  15  -6.127  -2.919   5.021
    5    HG   SER  15           HG       SER  15  -7.827  -1.411   3.974

  No H/Q in entry =           5
  In of MODEL   56
    1    H    GLY  16           H        GLY  16  -8.782  -0.364   4.698
    2    HA3  GLY  16           HA2      GLY  16  -7.911   2.272   4.145
    3    HA2  GLY  16           HA3      GLY  16  -9.564   1.684   3.980

  No H/Q in entry =           3
  In of MODEL   56
    1    H    GLN  17           H        GLN  17 -10.116   0.964   6.630
    2    HA   GLN  17           HA       GLN  17 -10.815   3.473   7.766
    3    HB2  GLN  17           HB2      GLN  17 -10.731   0.692   8.948
    4    HB3  GLN  17           HB3      GLN  17 -11.351   2.094   9.818
    5    HG2  GLN  17           HG2      GLN  17 -12.373   1.163   7.120
    6    HG3  GLN  17           HG3      GLN  17 -13.148   0.797   8.660
    7   HE21  GLN  17          HE21      GLN  17 -13.766   2.806  10.007
    8   HE22  GLN  17          HE22      GLN  17 -14.276   4.184   9.155

  No H/Q in entry =           8
  In of MODEL   56
    1    H    ALA  18           H        ALA  18  -8.197   1.182   8.394
    2    HA   ALA  18           HA       ALA  18  -7.100   2.396  10.666
    3    HB2  ALA  18           HB1      ALA  18  -6.496   0.176   9.302
    4    HB3  ALA  18           HB2      ALA  18  -5.332   0.956  10.375
    5    HB1  ALA  18           HB3      ALA  18  -5.250   1.232   8.634

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ARG  19           H        ARG  19  -6.319   2.913   7.219
    2    HA   ARG  19           HA       ARG  19  -4.414   4.953   7.649
    3    HB2  ARG  19           HB2      ARG  19  -4.740   3.812   5.454
    4    HB3  ARG  19           HB3      ARG  19  -6.279   4.658   5.273
    5    HG2  ARG  19           HG2      ARG  19  -5.143   6.825   5.341
    6    HG3  ARG  19           HG3      ARG  19  -3.598   6.035   5.650
    7    HD2  ARG  19           HD2      ARG  19  -3.715   6.623   3.306
    8    HD3  ARG  19           HD3      ARG  19  -3.806   4.863   3.453
    9    HE   ARG  19           HE       ARG  19  -6.437   5.781   3.439
   10   HH21  ARG  19          HH11      ARG  19  -7.627   5.939   1.517
   11   HH22  ARG  19          HH12      ARG  19  -6.801   6.013   0.000
   12   HH11  ARG  19          HH21      ARG  19  -3.656   5.833   1.411
   13   HH12  ARG  19          HH22      ARG  19  -4.552   5.950  -0.060

  No H/Q in entry =          13
  In of MODEL   56
    1    H    SER  20           H        SER  20  -7.910   5.080   7.041
    2    HA   SER  20           HA       SER  20  -8.258   7.836   6.988
    3    HB2  SER  20           HB2      SER  20 -10.139   6.502   6.449
    4    HB3  SER  20           HB3      SER  20 -10.037   5.609   7.964
    5    HG   SER  20           HG       SER  20 -10.821   8.292   7.521

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LEU  21           H        LEU  21  -8.272   5.657   9.795
    2    HA   LEU  21           HA       LEU  21  -8.712   7.657  11.756
    3    HB2  LEU  21           HB2      LEU  21  -7.368   4.952  11.924
    4    HB3  LEU  21           HB3      LEU  21  -7.677   5.972  13.325
    5    HG   LEU  21           HG       LEU  21  -9.840   5.066  11.400
    6   HD13  LEU  21          HD11      LEU  21 -10.432   3.379  13.050
    7   HD12  LEU  21          HD12      LEU  21  -9.151   3.932  14.127
    8   HD11  LEU  21          HD13      LEU  21  -8.742   3.160  12.594
    9   HD21  LEU  21          HD21      LEU  21  -9.774   6.634  13.965
   10   HD23  LEU  21          HD22      LEU  21 -11.171   5.605  13.658
   11   HD22  LEU  21          HD23      LEU  21 -10.771   6.896  12.536

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ALA  22           H        ALA  22  -5.759   6.274  10.358
    2    HA   ALA  22           HA       ALA  22  -3.881   7.584  11.983
    3    HB2  ALA  22           HB1      ALA  22  -3.465   5.727  10.295
    4    HB1  ALA  22           HB2      ALA  22  -2.266   7.020  10.332
    5    HB3  ALA  22           HB3      ALA  22  -3.480   6.978   9.053

  No H/Q in entry =           5
  In of MODEL   56
    1    H    TYR  23           H        TYR  23  -5.187   8.600   8.796
    2    HA   TYR  23           HA       TYR  23  -3.844  11.093   8.726
    3    HB2  TYR  23           HB2      TYR  23  -4.921  10.183   6.732
    4    HB3  TYR  23           HB3      TYR  23  -6.502  10.292   7.509
    5    HD1  TYR  23           HD1      TYR  23  -3.592  12.334   6.370
    6    HD2  TYR  23           HD2      TYR  23  -7.740  12.301   7.480
    7    HE1  TYR  23           HE1      TYR  23  -3.813  14.683   5.608
    8    HE2  TYR  23           HE2      TYR  23  -7.962  14.651   6.717
    9    HH   TYR  23           HH       TYR  23  -5.225  16.361   5.217

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ALA  24           H        ALA  24  -6.970  10.125  10.098
    2    HA   ALA  24           HA       ALA  24  -7.802  12.718  10.864
    3    HB1  ALA  24           HB1      ALA  24  -9.625  11.472  11.328
    4    HB2  ALA  24           HB2      ALA  24  -8.804  10.900  12.779
    5    HB3  ALA  24           HB3      ALA  24  -8.677   9.986  11.277

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ALA  25           H        ALA  25  -5.810  10.257  12.447
    2    HA   ALA  25           HA       ALA  25  -5.476  11.512  14.948
    3    HB2  ALA  25           HB1      ALA  25  -4.713   9.157  14.132
    4    HB3  ALA  25           HB2      ALA  25  -3.699  10.014  15.295
    5    HB1  ALA  25           HB3      ALA  25  -3.258   9.994  13.586

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LEU  26           H        LEU  26  -3.676  11.802  11.912
    2    HA   LEU  26           HA       LEU  26  -1.716  13.618  12.831
    3    HB2  LEU  26           HB2      LEU  26  -1.411  12.463  10.730
    4    HB3  LEU  26           HB3      LEU  26  -2.881  13.174  10.070
    5    HG   LEU  26           HG       LEU  26  -1.861  15.422  10.205
    6   HD12  LEU  26          HD11      LEU  26   0.676  15.436  10.626
    7   HD11  LEU  26          HD12      LEU  26   0.447  13.857  11.372
    8   HD13  LEU  26          HD13      LEU  26  -0.359  15.274  12.044
    9   HD21  LEU  26          HD21      LEU  26  -0.120  13.361   8.818
   10   HD23  LEU  26          HD22      LEU  26  -0.157  15.082   8.445
   11   HD22  LEU  26          HD23      LEU  26  -1.582  14.088   8.154

  No H/Q in entry =          11
  In of MODEL   56
    1    H    LYS  27           H        LYS  27  -4.892  14.108  11.345
    2    HA   LYS  27           HA       LYS  27  -4.829  16.896  11.143
    3    HB2  LYS  27           HB2      LYS  27  -6.574  15.422  10.155
    4    HB3  LYS  27           HB3      LYS  27  -7.236  15.170  11.769
    5    HG2  LYS  27           HG2      LYS  27  -7.659  17.577  12.001
    6    HG3  LYS  27           HG3      LYS  27  -6.946  17.870  10.412
    7    HD2  LYS  27           HD2      LYS  27  -8.680  16.440   9.372
    8    HD3  LYS  27           HD3      LYS  27  -9.399  16.164  10.961
    9    HE2  LYS  27           HE2      LYS  27  -9.835  18.577  11.199
   10    HE3  LYS  27           HE3      LYS  27  -9.088  18.874   9.626
   11    HZ3  LYS  27           HZ1      LYS  27 -11.465  18.756   9.378
   12    HZ2  LYS  27           HZ2      LYS  27 -11.520  17.241  10.150
   13    HZ1  LYS  27           HZ3      LYS  27 -10.770  17.400   8.630

  No H/Q in entry =          13
  In of MODEL   56
    1    H    GLN  28           H        GLN  28  -5.731  14.816  13.870
    2    HA   GLN  28           HA       GLN  28  -6.625  16.825  15.642
    3    HB2  GLN  28           HB2      GLN  28  -5.491  14.072  15.958
    4    HB3  GLN  28           HB3      GLN  28  -5.623  15.101  17.386
    5    HG2  GLN  28           HG2      GLN  28  -7.642  13.617  16.886
    6    HG3  GLN  28           HG3      GLN  28  -7.981  15.330  17.124
    7   HE21  GLN  28          HE21      GLN  28  -8.270  16.660  15.095
    8   HE22  GLN  28          HE22      GLN  28  -8.845  15.895  13.694

  No H/Q in entry =           8
  In of MODEL   56
    1    H    ALA  29           H        ALA  29  -3.409  15.516  14.962
    2    HA   ALA  29           HA       ALA  29  -1.971  16.911  16.943
    3    HB1  ALA  29           HB1      ALA  29  -0.040  16.211  15.830
    4    HB3  ALA  29           HB2      ALA  29  -0.790  16.336  14.238
    5    HB2  ALA  29           HB3      ALA  29  -1.220  15.006  15.314

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LYS  30           H        LYS  30  -2.816  17.790  13.610
    2    HA   LYS  30           HA       LYS  30  -1.393  20.222  13.510
    3    HB2  LYS  30           HB2      LYS  30  -3.925  19.360  12.096
    4    HB3  LYS  30           HB3      LYS  30  -3.082  20.870  11.753
    5    HG2  LYS  30           HG2      LYS  30  -1.018  19.565  11.246
    6    HG3  LYS  30           HG3      LYS  30  -1.934  18.074  11.490
    7    HD2  LYS  30           HD2      LYS  30  -3.489  18.722   9.691
    8    HD3  LYS  30           HD3      LYS  30  -2.597  20.224   9.448
    9    HE2  LYS  30           HE2      LYS  30  -0.571  18.919   8.875
   10    HE3  LYS  30           HE3      LYS  30  -1.482  17.421   9.087
   11    HZ2  LYS  30           HZ1      LYS  30  -1.295  18.289   6.744
   12    HZ1  LYS  30           HZ2      LYS  30  -2.332  19.558   7.208
   13    HZ3  LYS  30           HZ3      LYS  30  -2.867  17.945   7.280

  No H/Q in entry =          13
  In of MODEL   56
    1    H    GLN  31           H        GLN  31  -4.502  19.391  14.916
    2    HA   GLN  31           HA       GLN  31  -5.248  22.153  15.363
    3    HB2  GLN  31           HB2      GLN  31  -6.447  19.716  16.686
    4    HB3  GLN  31           HB3      GLN  31  -7.196  21.293  16.437
    5    HG2  GLN  31           HG2      GLN  31  -6.485  20.508  13.849
    6    HG3  GLN  31           HG3      GLN  31  -7.021  19.008  14.597
    7   HE21  GLN  31          HE21      GLN  31  -8.416  20.589  12.490
    8   HE22  GLN  31          HE22      GLN  31  -9.928  20.992  13.144

  No H/Q in entry =           8
  In of MODEL   56
    1    H    GLY  32           H        GLY  32  -2.953  20.211  16.690
    2    HA3  GLY  32           HA2      GLY  32  -1.553  20.665  18.495
    3    HA2  GLY  32           HA3      GLY  32  -2.675  21.916  19.015

  No H/Q in entry =           3
  In of MODEL   56
    1    H    ASP  33           H        ASP  33  -4.117  18.887  18.353
    2    HA   ASP  33           HA       ASP  33  -4.537  18.434  21.232
    3    HB2  ASP  33           HB2      ASP  33  -5.945  17.431  18.752
    4    HB3  ASP  33           HB3      ASP  33  -6.299  16.824  20.368

  No H/Q in entry =           4
  In of MODEL   56
    1    H    PHE  34           H        PHE  34  -2.376  17.568  21.543
    2    HA   PHE  34           HA       PHE  34  -1.389  15.311  20.146
    3    HB2  PHE  34           HB2      PHE  34  -0.771  16.293  22.941
    4    HB3  PHE  34           HB3      PHE  34   0.151  15.062  22.077
    5    HD1  PHE  34           HD1      PHE  34   0.002  18.490  22.809
    6    HD2  PHE  34           HD2      PHE  34   0.819  15.778  19.578
    7    HE1  PHE  34           HE1      PHE  34   1.313  20.251  21.657
    8    HE2  PHE  34           HE2      PHE  34   2.125  17.542  18.431
    9    HZ   PHE  34           HZ       PHE  34   2.374  19.775  19.474

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ALA  35           H        ALA  35  -3.433  15.605  23.005
    2    HA   ALA  35           HA       ALA  35  -3.242  12.942  23.903
    3    HB3  ALA  35           HB1      ALA  35  -5.697  13.587  24.755
    4    HB1  ALA  35           HB2      ALA  35  -5.151  15.200  24.299
    5    HB2  ALA  35           HB3      ALA  35  -4.246  14.271  25.493

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ALA  36           H        ALA  36  -5.677  14.475  21.797
    2    HA   ALA  36           HA       ALA  36  -7.109  12.074  21.318
    3    HB1  ALA  36           HB1      ALA  36  -8.552  13.506  20.358
    4    HB3  ALA  36           HB2      ALA  36  -7.374  13.917  19.111
    5    HB2  ALA  36           HB3      ALA  36  -7.395  14.806  20.634

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ALA  37           H        ALA  37  -4.413  13.640  19.654
    2    HA   ALA  37           HA       ALA  37  -4.385  12.003  17.358
    3    HB3  ALA  37           HB1      ALA  37  -2.383  13.701  18.784
    4    HB2  ALA  37           HB2      ALA  37  -2.910  13.760  17.103
    5    HB1  ALA  37           HB3      ALA  37  -1.766  12.521  17.627

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LYS  38           H        LYS  38  -2.637  11.686  20.440
    2    HA   LYS  38           HA       LYS  38  -1.328   9.276  19.955
    3    HB2  LYS  38           HB2      LYS  38  -1.643  11.042  22.099
    4    HB3  LYS  38           HB3      LYS  38  -2.275   9.518  22.715
    5    HG2  LYS  38           HG2      LYS  38  -0.187   8.381  22.184
    6    HG3  LYS  38           HG3      LYS  38   0.434   9.822  21.371
    7    HD2  LYS  38           HD2      LYS  38   0.607  11.040  23.405
    8    HD3  LYS  38           HD3      LYS  38  -0.422   9.898  24.271
    9    HE2  LYS  38           HE2      LYS  38   1.929   9.565  24.895
   10    HE3  LYS  38           HE3      LYS  38   1.317   8.153  24.031
   11    HZ3  LYS  38           HZ1      LYS  38   2.624   8.561  22.252
   12    HZ2  LYS  38           HZ2      LYS  38   3.583   9.383  23.390
   13    HZ1  LYS  38           HZ3      LYS  38   2.512  10.250  22.396

  No H/Q in entry =          13
  In of MODEL   56
    1    H    ALA  39           H        ALA  39  -4.566   9.796  21.351
    2    HA   ALA  39           HA       ALA  39  -5.147   7.081  21.856
    3    HB3  ALA  39           HB1      ALA  39  -7.290   9.041  21.083
    4    HB2  ALA  39           HB2      ALA  39  -6.394   9.262  22.586
    5    HB1  ALA  39           HB3      ALA  39  -7.321   7.784  22.321

  No H/Q in entry =           5
  In of MODEL   56
    1    H    MET  40           H        MET  40  -5.712   9.096  19.007
    2    HA   MET  40           HA       MET  40  -7.199   7.174  17.544
    3    HB2  MET  40           HB2      MET  40  -5.570   9.557  16.642
    4    HB3  MET  40           HB3      MET  40  -6.600   8.605  15.570
    5    HG2  MET  40           HG2      MET  40  -7.631   9.863  18.125
    6    HG3  MET  40           HG3      MET  40  -7.679  10.697  16.574
    7    HE3  MET  40           HE1      MET  40 -10.270   9.095  14.505
    8    HE2  MET  40           HE2      MET  40  -8.516   9.200  14.360
    9    HE1  MET  40           HE3      MET  40  -9.425  10.572  14.991

  No H/Q in entry =           9
  In of MODEL   56
    1    H    MET  41           H        MET  41  -3.703   7.887  17.674
    2    HA   MET  41           HA       MET  41  -2.952   6.126  15.576
    3    HB2  MET  41           HB2      MET  41  -1.336   6.783  18.052
    4    HB3  MET  41           HB3      MET  41  -0.720   6.130  16.538
    5    HG2  MET  41           HG2      MET  41  -1.859   8.320  15.531
    6    HG3  MET  41           HG3      MET  41  -1.623   8.907  17.175
    7    HE2  MET  41           HE1      MET  41   1.280   6.789  17.544
    8    HE1  MET  41           HE2      MET  41   0.498   8.089  18.440
    9    HE3  MET  41           HE3      MET  41   2.125   8.320  17.801

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ASP  42           H        ASP  42  -3.348   5.657  19.062
    2    HA   ASP  42           HA       ASP  42  -2.330   3.057  19.225
    3    HB2  ASP  42           HB2      ASP  42  -3.196   4.823  21.045
    4    HB3  ASP  42           HB3      ASP  42  -4.629   3.807  20.970

  No H/Q in entry =           4
  In of MODEL   56
    1    H    GLN  43           H        GLN  43  -5.655   4.182  18.717
    2    HA   GLN  43           HA       GLN  43  -6.815   1.602  18.521
    3    HB2  GLN  43           HB2      GLN  43  -7.718   4.260  17.388
    4    HB3  GLN  43           HB3      GLN  43  -8.690   2.787  17.365
    5    HG2  GLN  43           HG2      GLN  43  -8.404   2.665  19.873
    6    HG3  GLN  43           HG3      GLN  43  -7.668   4.266  19.802
    7   HE21  GLN  43          HE21      GLN  43  -9.851   4.361  21.298
    8   HE22  GLN  43          HE22      GLN  43 -11.206   4.945  20.463

  No H/Q in entry =           8
  In of MODEL   56
    1    H    SER  44           H        SER  44  -5.455   3.806  16.111
    2    HA   SER  44           HA       SER  44  -6.160   2.326  13.821
    3    HB2  SER  44           HB2      SER  44  -4.889   4.701  14.266
    4    HB3  SER  44           HB3      SER  44  -3.540   3.696  13.740
    5    HG   SER  44           HG       SER  44  -4.642   4.674  11.974

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ARG  45           H        ARG  45  -3.288   2.195  15.908
    2    HA   ARG  45           HA       ARG  45  -1.818   0.230  14.530
    3    HB2  ARG  45           HB2      ARG  45  -0.971   1.647  16.400
    4    HB3  ARG  45           HB3      ARG  45  -1.971   0.723  17.519
    5    HG2  ARG  45           HG2      ARG  45  -0.752  -1.344  16.880
    6    HG3  ARG  45           HG3      ARG  45   0.273  -0.396  15.804
    7    HD2  ARG  45           HD2      ARG  45   1.012   0.981  17.761
    8    HD3  ARG  45           HD3      ARG  45   0.080  -0.087  18.833
    9    HE   ARG  45           HE       ARG  45   1.772  -1.695  17.257
   10   HH21  ARG  45          HH11      ARG  45   3.665  -2.530  18.099
   11   HH22  ARG  45          HH12      ARG  45   4.440  -1.748  19.432
   12   HH11  ARG  45          HH21      ARG  45   2.086   0.771  19.646
   13   HH12  ARG  45          HH22      ARG  45   3.545   0.123  20.305

  No H/Q in entry =          13
  In of MODEL   56
    1    H    MET  46           H        MET  46  -4.223  -0.073  17.125
    2    HA   MET  46           HA       MET  46  -4.075  -2.873  17.433
    3    HB2  MET  46           HB2      MET  46  -6.227  -0.849  18.030
    4    HB3  MET  46           HB3      MET  46  -6.456  -2.568  18.363
    5    HG2  MET  46           HG2      MET  46  -4.478  -2.592  19.794
    6    HG3  MET  46           HG3      MET  46  -4.137  -0.914  19.403
    7    HE1  MET  46           HE1      MET  46  -6.375  -3.470  20.719
    8    HE3  MET  46           HE2      MET  46  -7.863  -2.566  20.453
    9    HE2  MET  46           HE3      MET  46  -7.252  -2.779  22.091

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ALA  47           H        ALA  47  -6.076  -0.843  15.332
    2    HA   ALA  47           HA       ALA  47  -7.705  -2.883  14.263
    3    HB3  ALA  47           HB1      ALA  47  -8.368  -0.641  13.845
    4    HB1  ALA  47           HB2      ALA  47  -7.880  -1.279  12.275
    5    HB2  ALA  47           HB3      ALA  47  -6.794  -0.217  13.174

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LEU  48           H        LEU  48  -4.575  -1.598  13.220
    2    HA   LEU  48           HA       LEU  48  -4.299  -3.191  10.880
    3    HB2  LEU  48           HB2      LEU  48  -2.237  -1.927  12.693
    4    HB3  LEU  48           HB3      LEU  48  -1.870  -2.651  11.128
    5    HG   LEU  48           HG       LEU  48  -3.877  -0.418  11.511
    6   HD13  LEU  48          HD11      LEU  48  -1.751   0.442  12.182
    7   HD12  LEU  48          HD12      LEU  48  -2.017   0.998  10.530
    8   HD11  LEU  48          HD13      LEU  48  -0.930  -0.357  10.841
    9   HD22  LEU  48          HD21      LEU  48  -4.351  -1.399   9.434
   10   HD21  LEU  48          HD22      LEU  48  -2.670  -1.847   9.144
   11   HD23  LEU  48          HD23      LEU  48  -3.176  -0.164   8.983

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ASN  49           H        ASN  49  -3.266  -3.595  14.229
    2    HA   ASN  49           HA       ASN  49  -1.681  -5.871  13.903
    3    HB2  ASN  49           HB2      ASN  49  -1.708  -4.529  15.950
    4    HB3  ASN  49           HB3      ASN  49  -3.366  -5.014  16.273
    5   HD21  ASN  49          HD21      ASN  49  -1.333  -5.530  18.161
    6   HD22  ASN  49          HD22      ASN  49  -1.068  -7.204  18.243

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLU  50           H        GLU  50  -5.149  -5.567  14.565
    2    HA   GLU  50           HA       GLU  50  -5.685  -8.361  14.673
    3    HB2  GLU  50           HB2      GLU  50  -7.259  -6.661  15.545
    4    HB3  GLU  50           HB3      GLU  50  -7.543  -6.094  13.897
    5    HG2  GLU  50           HG2      GLU  50  -8.425  -8.283  13.257
    6    HG3  GLU  50           HG3      GLU  50  -8.054  -8.929  14.851

  No H/Q in entry =           6
  In of MODEL   56
    1    H    ALA  51           H        ALA  51  -5.725  -5.963  12.077
    2    HA   ALA  51           HA       ALA  51  -6.720  -7.682  10.052
    3    HB2  ALA  51           HB1      ALA  51  -6.480  -5.872   8.683
    4    HB1  ALA  51           HB2      ALA  51  -4.839  -5.538   9.236
    5    HB3  ALA  51           HB3      ALA  51  -6.221  -5.014  10.201

  No H/Q in entry =           5
  In of MODEL   56
    1    H    HIS  52           H        HIS  52  -3.424  -6.805  11.045
    2    HA   HIS  52           HA       HIS  52  -2.033  -8.308   9.100
    3    HB2  HIS  52           HB2      HIS  52  -1.005  -6.576  10.563
    4    HB3  HIS  52           HB3      HIS  52  -1.157  -7.681  11.929
    5    HD1  HIS  52           HD1      HIS  52   0.283  -9.895  11.836
    6    HD2  HIS  52           HD2      HIS  52   1.130  -7.145   8.819
    7    HE1  HIS  52           HE1      HIS  52   2.483 -10.615  10.808
    8    HE2  HIS  52           HE2      HIS  52   3.012  -8.949   8.967

  No H/Q in entry =           8
  In of MODEL   56
    1    H    LEU  53           H        LEU  53  -3.263  -9.173  12.309
    2    HA   LEU  53           HA       LEU  53  -2.090 -11.729  12.506
    3    HB2  LEU  53           HB2      LEU  53  -4.567 -10.523  13.713
    4    HB3  LEU  53           HB3      LEU  53  -4.125 -12.203  14.007
    5    HG   LEU  53           HG       LEU  53  -2.208  -9.900  14.489
    6   HD12  LEU  53          HD11      LEU  53  -2.805 -10.272  16.923
    7   HD11  LEU  53          HD12      LEU  53  -4.173 -11.236  16.366
    8   HD13  LEU  53          HD13      LEU  53  -4.077  -9.525  15.961
    9   HD22  LEU  53          HD21      LEU  53  -0.933 -11.880  14.466
   10   HD21  LEU  53          HD22      LEU  53  -2.247 -12.845  15.130
   11   HD23  LEU  53          HD23      LEU  53  -1.351 -11.756  16.172

  No H/Q in entry =          11
  In of MODEL   56
    1    H    VAL  54           H        VAL  54  -5.187 -10.669  11.135
    2    HA   VAL  54           HA       VAL  54  -6.125 -13.254  10.445
    3    HB   VAL  54           HB       VAL  54  -6.741 -10.515   9.309
    4   HG12  VAL  54          HG11      VAL  54  -8.854 -11.871   8.491
    5   HG11  VAL  54          HG12      VAL  54  -7.757 -13.248   8.566
    6   HG13  VAL  54          HG13      VAL  54  -7.380 -11.877   7.525
    7   HG22  VAL  54          HG21      VAL  54  -7.654 -10.543  11.457
    8   HG21  VAL  54          HG22      VAL  54  -7.926 -12.284  11.437
    9   HG23  VAL  54          HG23      VAL  54  -8.994 -11.216  10.528

  No H/Q in entry =           9
  In of MODEL   56
    1    H    GLN  55           H        GLN  55  -4.223 -10.822   8.661
    2    HA   GLN  55           HA       GLN  55  -4.101 -12.288   6.244
    3    HB2  GLN  55           HB2      GLN  55  -3.473 -10.030   6.056
    4    HB3  GLN  55           HB3      GLN  55  -2.367 -10.118   7.424
    5    HG2  GLN  55           HG2      GLN  55  -0.655 -10.982   6.153
    6    HG3  GLN  55           HG3      GLN  55  -1.736 -11.945   5.156
    7   HE21  GLN  55          HE21      GLN  55  -1.740 -11.255   3.035
    8   HE22  GLN  55          HE22      GLN  55  -1.523  -9.653   2.525

  No H/Q in entry =           8
  In of MODEL   56
    1    H    THR  56           H        THR  56  -2.003 -12.289   9.131
    2    HA   THR  56           HA       THR  56   0.060 -13.909   8.220
    3    HB   THR  56           HB       THR  56  -1.194 -14.142  10.964
    4    HG1  THR  56           HG1      THR  56   0.365 -12.155   9.756
    5   HG22  THR  56          HG21      THR  56   1.736 -14.245  10.342
    6   HG21  THR  56          HG22      THR  56   0.743 -15.670  10.029
    7   HG23  THR  56          HG23      THR  56   0.846 -15.006  11.660

  No H/Q in entry =           7
  In of MODEL   56
    1    H    LYS  57           H        LYS  57  -3.074 -14.912   9.574
    2    HA   LYS  57           HA       LYS  57  -2.658 -17.713   9.330
    3    HB2  LYS  57           HB2      LYS  57  -4.467 -16.619  10.675
    4    HB3  LYS  57           HB3      LYS  57  -5.245 -16.132   9.176
    5    HG2  LYS  57           HG2      LYS  57  -5.053 -18.737   8.650
    6    HG3  LYS  57           HG3      LYS  57  -5.041 -18.846  10.408
    7    HD2  LYS  57           HD2      LYS  57  -7.140 -17.279   8.890
    8    HD3  LYS  57           HD3      LYS  57  -7.344 -18.979   9.312
    9    HE2  LYS  57           HE2      LYS  57  -8.396 -17.597  11.035
   10    HE3  LYS  57           HE3      LYS  57  -6.975 -18.374  11.728
   11    HZ3  LYS  57           HZ1      LYS  57  -5.985 -16.426  12.038
   12    HZ2  LYS  57           HZ2      LYS  57  -7.504 -15.717  11.759
   13    HZ1  LYS  57           HZ3      LYS  57  -6.386 -15.860  10.487

  No H/Q in entry =          13
  In of MODEL   56
    1    H    LEU  58           H        LEU  58  -3.956 -15.256   7.150
    2    HA   LEU  58           HA       LEU  58  -4.773 -17.073   5.141
    3    HB2  LEU  58           HB2      LEU  58  -4.133 -14.131   5.007
    4    HB3  LEU  58           HB3      LEU  58  -4.803 -15.061   3.666
    5    HG   LEU  58           HG       LEU  58  -6.089 -14.867   6.409
    6   HD11  LEU  58          HD11      LEU  58  -6.364 -13.217   3.917
    7   HD13  LEU  58          HD12      LEU  58  -6.353 -12.709   5.606
    8   HD12  LEU  58          HD13      LEU  58  -7.782 -13.487   4.929
    9   HD22  LEU  58          HD21      LEU  58  -7.070 -16.765   5.537
   10   HD21  LEU  58          HD22      LEU  58  -6.720 -16.317   3.868
   11   HD23  LEU  58          HD23      LEU  58  -8.078 -15.577   4.714

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  59           H        ILE  59  -1.627 -15.896   6.012
    2    HA   ILE  59           HA       ILE  59  -0.529 -16.636   3.379
    3    HB   ILE  59           HB       ILE  59   0.258 -14.580   4.954
    4   HG12  ILE  59          HG12      ILE  59   2.332 -16.249   3.519
    5   HG13  ILE  59          HG13      ILE  59   1.147 -15.295   2.665
    6   HG23  ILE  59          HG21      ILE  59   2.086 -15.085   6.352
    7   HG22  ILE  59          HG22      ILE  59   2.333 -16.661   5.635
    8   HG21  ILE  59          HG23      ILE  59   0.968 -16.378   6.714
    9   HD12  ILE  59          HD11      ILE  59   3.265 -14.051   2.972
   10   HD11  ILE  59          HD12      ILE  59   3.076 -14.204   4.717
   11   HD13  ILE  59          HD13      ILE  59   1.918 -13.255   3.783

  No H/Q in entry =          11
  In of MODEL   56
    1    H    GLU  60           H        GLU  60  -0.562 -17.741   6.747
    2    HA   GLU  60           HA       GLU  60   1.447 -19.742   6.489
    3    HB2  GLU  60           HB2      GLU  60   0.662 -18.931   8.673
    4    HB3  GLU  60           HB3      GLU  60  -0.930 -19.620   8.365
    5    HG2  GLU  60           HG2      GLU  60   0.069 -21.877   8.239
    6    HG3  GLU  60           HG3      GLU  60   1.662 -21.186   8.544

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLY  61           H        GLY  61  -2.063 -19.801   5.992
    2    HA3  GLY  61           HA2      GLY  61  -1.843 -22.597   5.035
    3    HA2  GLY  61           HA3      GLY  61  -3.322 -21.844   5.623

  No H/Q in entry =           3
  In of MODEL   56
    1    H    ASP  62           H        ASP  62  -1.066 -20.292   3.426
    2    HA   ASP  62           HA       ASP  62  -3.142 -19.701   1.551
    3    HB2  ASP  62           HB2      ASP  62  -1.320 -18.640   0.272
    4    HB3  ASP  62           HB3      ASP  62  -1.293 -18.157   1.964

  No H/Q in entry =           4
  In of MODEL   56
    1    H    ALA  63           H        ALA  63  -3.549 -22.243   1.394
    2    HA   ALA  63           HA       ALA  63  -1.841 -23.820  -0.248
    3    HB2  ALA  63           HB1      ALA  63  -3.714 -24.660   1.217
    4    HB1  ALA  63           HB2      ALA  63  -3.638 -25.355  -0.401
    5    HB3  ALA  63           HB3      ALA  63  -4.832 -24.111  -0.034

  No H/Q in entry =           5
  In of MODEL   56
    1    H    GLY  64           H        GLY  64  -4.551 -21.656  -0.916
    2    HA3  GLY  64           HA2      GLY  64  -5.170 -20.553  -2.839
    3    HA2  GLY  64           HA3      GLY  64  -3.679 -21.108  -3.582

  No H/Q in entry =           3
  In of MODEL   56
    1    H    GLU  65           H        GLU  65  -5.321 -21.207  -5.450
    2    HA   GLU  65           HA       GLU  65  -7.320 -23.193  -5.473
    3    HB2  GLU  65           HB2      GLU  65  -5.799 -21.888  -7.728
    4    HB3  GLU  65           HB3      GLU  65  -7.165 -22.978  -7.969
    5    HG2  GLU  65           HG2      GLU  65  -8.610 -21.512  -6.647
    6    HG3  GLU  65           HG3      GLU  65  -7.251 -20.441  -6.314

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLY  66           H        GLY  66  -3.977 -23.263  -6.485
    2    HA3  GLY  66           HA2      GLY  66  -4.104 -26.164  -6.960
    3    HA2  GLY  66           HA3      GLY  66  -2.917 -25.082  -7.660

  No H/Q in entry =           3
  In of MODEL   56
    1    H    LYS  67           H        LYS  67  -1.770 -27.128  -6.718
    2    HA   LYS  67           HA       LYS  67  -1.306 -27.402  -3.979
    3    HB2  LYS  67           HB2      LYS  67   0.363 -28.193  -6.361
    4    HB3  LYS  67           HB3      LYS  67   0.699 -28.709  -4.703
    5    HG2  LYS  67           HG2      LYS  67  -1.561 -29.676  -4.535
    6    HG3  LYS  67           HG3      LYS  67  -1.913 -29.156  -6.181
    7    HD2  LYS  67           HD2      LYS  67  -0.097 -30.596  -7.028
    8    HD3  LYS  67           HD3      LYS  67   0.254 -31.118  -5.379
    9    HE2  LYS  67           HE2      LYS  67  -2.038 -32.016  -5.174
   10    HE3  LYS  67           HE3      LYS  67  -2.384 -31.504  -6.824
   11    HZ3  LYS  67           HZ1      LYS  67  -1.710 -33.575  -7.304
   12    HZ2  LYS  67           HZ2      LYS  67  -0.819 -33.748  -5.869
   13    HZ1  LYS  67           HZ3      LYS  67  -0.155 -32.910  -7.190

  No H/Q in entry =          13
  In of MODEL   56
    1    H    MET  68           H        MET  68   1.237 -26.401  -6.184
    2    HA   MET  68           HA       MET  68   2.856 -25.185  -4.224
    3    HB2  MET  68           HB2      MET  68   2.842 -25.160  -7.229
    4    HB3  MET  68           HB3      MET  68   4.033 -24.247  -6.304
    5    HG2  MET  68           HG2      MET  68   3.512 -27.206  -5.919
    6    HG3  MET  68           HG3      MET  68   4.798 -26.560  -6.942
    7    HE3  MET  68           HE1      MET  68   5.334 -28.441  -3.857
    8    HE2  MET  68           HE2      MET  68   6.931 -27.838  -4.293
    9    HE1  MET  68           HE3      MET  68   5.797 -28.304  -5.558

  No H/Q in entry =           9
  In of MODEL   56
    1    H    LYS  69           H        LYS  69   0.575 -23.758  -6.552
    2    HA   LYS  69           HA       LYS  69   1.322 -21.078  -6.072
    3    HB2  LYS  69           HB2      LYS  69  -1.169 -22.244  -7.277
    4    HB3  LYS  69           HB3      LYS  69  -0.848 -20.508  -7.185
    5    HG2  LYS  69           HG2      LYS  69   1.261 -20.810  -8.401
    6    HG3  LYS  69           HG3      LYS  69   0.987 -22.550  -8.470
    7    HD2  LYS  69           HD2      LYS  69  -1.105 -22.148  -9.750
    8    HD3  LYS  69           HD3      LYS  69  -0.756 -20.419  -9.735
    9    HE2  LYS  69           HE2      LYS  69   1.038 -22.556 -10.923
   10    HE3  LYS  69           HE3      LYS  69   0.005 -21.462 -11.843
   11    HZ2  LYS  69           HZ1      LYS  69   2.504 -20.926 -10.448
   12    HZ1  LYS  69           HZ2      LYS  69   1.322 -19.708 -10.381
   13    HZ3  LYS  69           HZ3      LYS  69   1.898 -20.256 -11.883

  No H/Q in entry =          13
  In of MODEL   56
    1    H    VAL  70           H        VAL  70  -0.212 -19.340  -5.340
    2    HA   VAL  70           HA       VAL  70  -1.643 -20.137  -2.867
    3    HB   VAL  70           HB       VAL  70  -0.866 -17.999  -1.873
    4   HG11  VAL  70          HG11      VAL  70   0.423 -20.228  -1.734
    5   HG13  VAL  70          HG12      VAL  70   1.307 -18.759  -1.317
    6   HG12  VAL  70          HG13      VAL  70   1.539 -19.510  -2.896
    7   HG23  VAL  70          HG21      VAL  70   1.107 -16.872  -3.106
    8   HG22  VAL  70          HG22      VAL  70  -0.503 -16.588  -3.764
    9   HG21  VAL  70          HG23      VAL  70   0.567 -17.753  -4.537

  No H/Q in entry =           9
  In of MODEL   56
    1    H    SER  71           H        SER  71  -3.186 -18.425  -2.154
    2    HA   SER  71           HA       SER  71  -5.076 -17.801  -4.160
    3    HB2  SER  71           HB2      SER  71  -5.618 -18.017  -1.720
    4    HB3  SER  71           HB3      SER  71  -4.759 -16.510  -1.426
    5    HG   SER  71           HG       SER  71  -6.713 -16.554  -3.422

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LEU  72           H        LEU  72  -5.267 -16.130  -5.483
    2    HA   LEU  72           HA       LEU  72  -3.139 -14.340  -5.959
    3    HB2  LEU  72           HB2      LEU  72  -5.973 -14.515  -6.940
    4    HB3  LEU  72           HB3      LEU  72  -4.922 -13.180  -7.407
    5    HG   LEU  72           HG       LEU  72  -4.114 -16.085  -7.741
    6   HD12  LEU  72          HD11      LEU  72  -5.327 -14.236  -9.817
    7   HD11  LEU  72          HD12      LEU  72  -6.187 -15.562  -9.034
    8   HD13  LEU  72          HD13      LEU  72  -4.802 -15.900 -10.072
    9   HD23  LEU  72          HD21      LEU  72  -2.731 -14.867  -9.616
   10   HD22  LEU  72          HD22      LEU  72  -2.158 -14.770  -7.959
   11   HD21  LEU  72          HD23      LEU  72  -3.040 -13.419  -8.664

  No H/Q in entry =          11
  In of MODEL   56
    1    H    VAL  73           H        VAL  73  -6.232 -13.952  -4.336
    2    HA   VAL  73           HA       VAL  73  -6.250 -11.181  -3.984
    3    HB   VAL  73           HB       VAL  73  -7.968 -11.525  -2.393
    4   HG13  VAL  73          HG11      VAL  73  -9.442 -12.982  -3.584
    5   HG12  VAL  73          HG12      VAL  73  -8.103 -13.955  -4.188
    6   HG11  VAL  73          HG13      VAL  73  -8.343 -12.315  -4.792
    7   HG21  VAL  73          HG21      VAL  73  -6.546 -14.129  -1.959
    8   HG23  VAL  73          HG22      VAL  73  -8.279 -14.048  -1.640
    9   HG22  VAL  73          HG23      VAL  73  -7.170 -12.988  -0.769

  No H/Q in entry =           9
  In of MODEL   56
    1    H    LEU  74           H        LEU  74  -4.339 -13.569  -2.397
    2    HA   LEU  74           HA       LEU  74  -3.922 -12.434   0.127
    3    HB2  LEU  74           HB2      LEU  74  -3.161 -14.660  -0.376
    4    HB3  LEU  74           HB3      LEU  74  -2.093 -14.055  -1.642
    5    HG   LEU  74           HG       LEU  74  -0.783 -12.822   0.053
    6   HD12  LEU  74          HD11      LEU  74  -1.295 -13.536   2.488
    7   HD11  LEU  74          HD12      LEU  74  -2.889 -13.985   1.880
    8   HD13  LEU  74          HD13      LEU  74  -2.341 -12.312   1.768
    9   HD23  LEU  74          HD21      LEU  74  -1.024 -15.568   1.159
   10   HD22  LEU  74          HD22      LEU  74   0.389 -14.667   0.660
   11   HD21  LEU  74          HD23      LEU  74  -0.633 -15.406  -0.551

  No H/Q in entry =          11
  In of MODEL   56
    1    H    VAL  75           H        VAL  75  -2.021 -12.058  -2.826
    2    HA   VAL  75           HA       VAL  75  -0.207 -10.152  -1.811
    3    HB   VAL  75           HB       VAL  75  -1.161 -10.623  -4.637
    4   HG12  VAL  75          HG11      VAL  75   0.909  -9.334  -5.256
    5   HG11  VAL  75          HG12      VAL  75   1.132  -8.945  -3.557
    6   HG13  VAL  75          HG13      VAL  75  -0.275  -8.338  -4.417
    7   HG22  VAL  75          HG21      VAL  75   0.002 -12.530  -3.656
    8   HG21  VAL  75          HG22      VAL  75   1.282 -11.479  -3.047
    9   HG23  VAL  75          HG23      VAL  75   1.097 -11.727  -4.785

  No H/Q in entry =           9
  In of MODEL   56
    1    H    GLU  76           H        GLU  76  -3.350  -9.772  -3.475
    2    HA   GLU  76           HA       GLU  76  -3.374  -6.957  -3.575
    3    HB2  GLU  76           HB2      GLU  76  -5.042  -8.402  -4.734
    4    HB3  GLU  76           HB3      GLU  76  -5.717  -8.855  -3.176
    5    HG2  GLU  76           HG2      GLU  76  -6.359  -6.520  -2.746
    6    HG3  GLU  76           HG3      GLU  76  -5.665  -6.017  -4.275

  No H/Q in entry =           6
  In of MODEL   56
    1    H    ALA  77           H        ALA  77  -4.511  -9.176  -1.038
    2    HA   ALA  77           HA       ALA  77  -5.451  -7.165   0.720
    3    HB2  ALA  77           HB1      ALA  77  -5.225  -8.933   2.476
    4    HB1  ALA  77           HB2      ALA  77  -4.433  -9.960   1.282
    5    HB3  ALA  77           HB3      ALA  77  -6.109  -9.470   1.048

  No H/Q in entry =           5
  In of MODEL   56
    1    H    GLN  78           H        GLN  78  -2.319  -8.746   0.360
    2    HA   GLN  78           HA       GLN  78  -1.054  -7.600   2.613
    3    HB2  GLN  78           HB2      GLN  78  -0.207  -9.549   1.263
    4    HB3  GLN  78           HB3      GLN  78   0.236  -8.411  -0.006
    5    HG2  GLN  78           HG2      GLN  78   1.710  -7.224   1.569
    6    HG3  GLN  78           HG3      GLN  78   1.268  -8.356   2.844
    7   HE21  GLN  78          HE21      GLN  78   3.991  -8.102   1.988
    8   HE22  GLN  78          HE22      GLN  78   4.441  -9.543   1.209

  No H/Q in entry =           8
  In of MODEL   56
    1    H    LEU  79           H        LEU  79  -1.403  -6.533  -0.734
    2    HA   LEU  79           HA       LEU  79   0.307  -4.325  -0.716
    3    HB2  LEU  79           HB2      LEU  79  -0.724  -5.119  -2.772
    4    HB3  LEU  79           HB3      LEU  79  -2.325  -4.711  -2.166
    5    HG   LEU  79           HG       LEU  79  -1.755  -2.330  -2.138
    6   HD13  LEU  79          HD11      LEU  79   0.487  -2.111  -1.621
    7   HD12  LEU  79          HD12      LEU  79   0.543  -1.823  -3.360
    8   HD11  LEU  79          HD13      LEU  79   0.978  -3.406  -2.714
    9   HD23  LEU  79          HD21      LEU  79  -1.113  -2.136  -4.689
   10   HD22  LEU  79          HD22      LEU  79  -2.649  -2.868  -4.233
   11   HD21  LEU  79          HD23      LEU  79  -1.287  -3.891  -4.676

  No H/Q in entry =          11
  In of MODEL   56
    1    H    HIS  80           H        HIS  80  -3.163  -4.449   0.104
    2    HA   HIS  80           HA       HIS  80  -3.324  -1.691   0.769
    3    HB2  HIS  80           HB2      HIS  80  -5.053  -4.081   1.083
    4    HB3  HIS  80           HB3      HIS  80  -5.361  -2.738   2.187
    5    HD1  HIS  80           HD1      HIS  80  -6.958  -1.083   1.277
    6    HD2  HIS  80           HD2      HIS  80  -4.780  -2.918  -1.767
    7    HE1  HIS  80           HE1      HIS  80  -7.783  -0.075  -0.903
    8    HE2  HIS  80           HE2      HIS  80  -6.461  -1.188  -2.768

  No H/Q in entry =           8
  In of MODEL   56
    1    H    LEU  81           H        LEU  81  -2.872  -4.593   2.761
    2    HA   LEU  81           HA       LEU  81  -2.849  -3.247   5.246
    3    HB2  LEU  81           HB2      LEU  81  -1.659  -5.877   4.367
    4    HB3  LEU  81           HB3      LEU  81  -1.630  -5.319   6.041
    5    HG   LEU  81           HG       LEU  81  -4.175  -5.541   4.409
    6   HD12  LEU  81          HD11      LEU  81  -4.505  -7.604   5.954
    7   HD11  LEU  81          HD12      LEU  81  -2.752  -7.554   6.144
    8   HD13  LEU  81          HD13      LEU  81  -3.460  -7.775   4.543
    9   HD23  LEU  81          HD21      LEU  81  -5.025  -5.736   6.908
   10   HD22  LEU  81          HD22      LEU  81  -4.681  -4.151   6.220
   11   HD21  LEU  81          HD23      LEU  81  -3.505  -4.925   7.282

  No H/Q in entry =          11
  In of MODEL   56
    1    H    MET  82           H        MET  82  -0.175  -4.181   3.080
    2    HA   MET  82           HA       MET  82   1.916  -3.312   4.768
    3    HB2  MET  82           HB2      MET  82   1.702  -3.649   1.775
    4    HB3  MET  82           HB3      MET  82   3.189  -3.097   2.542
    5    HG2  MET  82           HG2      MET  82   1.750  -5.670   3.262
    6    HG3  MET  82           HG3      MET  82   3.125  -5.576   2.164
    7    HE3  MET  82           HE1      MET  82   6.146  -4.877   4.154
    8    HE2  MET  82           HE2      MET  82   5.240  -3.498   3.535
    9    HE1  MET  82           HE3      MET  82   5.313  -4.989   2.599

  No H/Q in entry =           9
  In of MODEL   56
    1    H    THR  83           H        THR  83   0.118  -1.647   2.209
    2    HA   THR  83           HA       THR  83   1.560   0.784   2.299
    3    HB   THR  83           HB       THR  83  -0.603   1.736   1.309
    4    HG1  THR  83           HG1      THR  83  -2.269   0.459   1.199
    5   HG22  THR  83          HG21      THR  83  -0.352  -0.084  -0.692
    6   HG21  THR  83          HG22      THR  83   1.144  -0.395   0.188
    7   HG23  THR  83          HG23      THR  83   0.803   1.222  -0.427

  No H/Q in entry =           7
  In of MODEL   56
    1    H    SER  84           H        SER  84  -1.462  -0.212   3.894
    2    HA   SER  84           HA       SER  84  -1.930   2.223   5.239
    3    HB2  SER  84           HB2      SER  84  -2.799  -0.604   5.801
    4    HB3  SER  84           HB3      SER  84  -3.278   0.742   6.834
    5    HG   SER  84           HG       SER  84  -3.735   0.435   4.040

  No H/Q in entry =           5
  In of MODEL   56
    1    H    MET  85           H        MET  85  -0.259  -0.730   6.370
    2    HA   MET  85           HA       MET  85   0.268   0.188   8.976
    3    HB2  MET  85           HB2      MET  85   0.532  -2.159   8.300
    4    HB3  MET  85           HB3      MET  85   1.920  -1.712   7.306
    5    HG2  MET  85           HG2      MET  85   3.112  -0.902   9.298
    6    HG3  MET  85           HG3      MET  85   1.714  -1.288  10.302
    7    HE3  MET  85           HE1      MET  85   3.293  -3.675   7.274
    8    HE2  MET  85           HE2      MET  85   4.708  -4.022   8.266
    9    HE1  MET  85           HE3      MET  85   4.282  -2.352   7.905

  No H/Q in entry =           9
  In of MODEL   56
    1    H    LEU  86           H        LEU  86   2.211   0.421   6.028
    2    HA   LEU  86           HA       LEU  86   4.439   1.703   7.188
    3    HB2  LEU  86           HB2      LEU  86   4.238   0.624   4.879
    4    HB3  LEU  86           HB3      LEU  86   3.450   2.116   4.365
    5    HG   LEU  86           HG       LEU  86   5.492   3.336   5.349
    6   HD11  LEU  86          HD11      LEU  86   6.162   0.715   6.149
    7   HD13  LEU  86          HD12      LEU  86   7.184   2.147   6.249
    8   HD12  LEU  86          HD13      LEU  86   7.282   1.098   4.837
    9   HD23  LEU  86          HD21      LEU  86   6.190   1.564   3.000
   10   HD22  LEU  86          HD22      LEU  86   6.605   3.256   3.263
   11   HD21  LEU  86          HD23      LEU  86   4.947   2.809   2.861

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ALA  87           H        ALA  87   1.546   2.984   5.599
    2    HA   ALA  87           HA       ALA  87   2.175   5.706   5.684
    3    HB1  ALA  87           HB1      ALA  87  -0.154   4.108   5.139
    4    HB3  ALA  87           HB2      ALA  87   0.179   5.765   4.640
    5    HB2  ALA  87           HB3      ALA  87  -0.622   5.453   6.182

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ARG  88           H        ARG  88   0.455   3.726   8.071
    2    HA   ARG  88           HA       ARG  88  -0.033   5.781   9.918
    3    HB2  ARG  88           HB2      ARG  88  -1.002   3.441   9.982
    4    HB3  ARG  88           HB3      ARG  88   0.531   2.921  10.690
    5    HG2  ARG  88           HG2      ARG  88   0.079   5.001  12.310
    6    HG3  ARG  88           HG3      ARG  88  -1.591   4.698  11.851
    7    HD2  ARG  88           HD2      ARG  88  -1.724   2.850  13.097
    8    HD3  ARG  88           HD3      ARG  88  -0.142   2.248  12.568
    9    HE   ARG  88           HE       ARG  88  -0.663   3.517  15.022
   10   HH21  ARG  88          HH11      ARG  88   0.905   4.509  16.263
   11   HH22  ARG  88          HH12      ARG  88   2.431   4.917  15.561
   12   HH11  ARG  88          HH21      ARG  88   1.624   3.670  12.449
   13   HH12  ARG  88          HH22      ARG  88   2.846   4.425  13.413

  No H/Q in entry =          13
  In of MODEL   56
    1    H    GLU  89           H        GLU  89   2.735   3.527   9.699
    2    HA   GLU  89           HA       GLU  89   4.004   4.400  12.045
    3    HB2  GLU  89           HB2      GLU  89   4.640   2.373  10.702
    4    HB3  GLU  89           HB3      GLU  89   5.431   3.458   9.557
    5    HG2  GLU  89           HG2      GLU  89   6.923   4.286  11.303
    6    HG3  GLU  89           HG3      GLU  89   6.075   3.340  12.522

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LEU  90           H        LEU  90   4.341   5.554   8.718
    2    HA   LEU  90           HA       LEU  90   6.295   7.530   9.307
    3    HB2  LEU  90           HB2      LEU  90   4.289   7.224   7.076
    4    HB3  LEU  90           HB3      LEU  90   5.535   8.479   7.099
    5    HG   LEU  90           HG       LEU  90   6.172   5.535   7.434
    6   HD12  LEU  90          HD11      LEU  90   6.927   5.759   4.996
    7   HD11  LEU  90          HD12      LEU  90   5.930   7.212   4.946
    8   HD13  LEU  90          HD13      LEU  90   5.190   5.648   5.287
    9   HD22  LEU  90          HD21      LEU  90   8.082   6.661   8.120
   10   HD21  LEU  90          HD22      LEU  90   7.751   8.070   7.112
   11   HD23  LEU  90          HD23      LEU  90   8.394   6.598   6.386

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  91           H        ILE  91   2.756   7.588   9.152
    2    HA   ILE  91           HA       ILE  91   2.446  10.365   9.602
    3    HB   ILE  91           HB       ILE  91   0.626   8.010  10.141
    4   HG12  ILE  91          HG12      ILE  91   0.409  10.295   8.156
    5   HG13  ILE  91          HG13      ILE  91   1.252   8.790   7.786
    6   HG22  ILE  91          HG21      ILE  91  -1.082  10.089  10.202
    7   HG21  ILE  91          HG22      ILE  91   0.328  10.903  10.877
    8   HG23  ILE  91          HG23      ILE  91  -0.327   9.473  11.672
    9   HD13  ILE  91          HD11      ILE  91  -0.708   7.526   7.826
   10   HD12  ILE  91          HD12      ILE  91  -1.278   9.047   7.144
   11   HD11  ILE  91          HD13      ILE  91  -1.556   8.687   8.848

  No H/Q in entry =          11
  In of MODEL   56
    1    H    THR  92           H        THR  92   2.814   7.619  11.804
    2    HA   THR  92           HA       THR  92   2.382   8.997  14.227
    3    HB   THR  92           HB       THR  92   4.165   6.642  13.566
    4    HG1  THR  92           HG1      THR  92   2.188   5.907  13.461
    5   HG22  THR  92          HG21      THR  92   3.773   6.362  16.199
    6   HG21  THR  92          HG22      THR  92   3.728   8.122  16.125
    7   HG23  THR  92          HG23      THR  92   5.153   7.251  15.555

  No H/Q in entry =           7
  In of MODEL   56
    1    H    GLU  93           H        GLU  93   5.331   8.515  12.299
    2    HA   GLU  93           HA       GLU  93   7.097   9.923  13.999
    3    HB2  GLU  93           HB2      GLU  93   7.188   9.607  10.984
    4    HB3  GLU  93           HB3      GLU  93   8.532  10.123  12.001
    5    HG2  GLU  93           HG2      GLU  93   7.093   7.502  12.446
    6    HG3  GLU  93           HG3      GLU  93   8.481   7.638  11.373

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LEU  94           H        LEU  94   5.065  10.960  11.282
    2    HA   LEU  94           HA       LEU  94   5.899  13.655  11.183
    3    HB2  LEU  94           HB2      LEU  94   3.296  12.317  10.424
    4    HB3  LEU  94           HB3      LEU  94   3.573  14.042  10.183
    5    HG   LEU  94           HG       LEU  94   5.572  12.032   9.137
    6   HD11  LEU  94          HD11      LEU  94   2.838  12.612   8.069
    7   HD13  LEU  94          HD12      LEU  94   3.806  11.145   7.946
    8   HD12  LEU  94          HD13      LEU  94   4.158  12.521   6.902
    9   HD23  LEU  94          HD21      LEU  94   5.845  13.865   7.415
   10   HD22  LEU  94          HD22      LEU  94   6.261  14.354   9.057
   11   HD21  LEU  94          HD23      LEU  94   4.716  14.838   8.356

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  95           H        ILE  95   3.341  12.065  13.069
    2    HA   ILE  95           HA       ILE  95   2.320  14.426  14.262
    3    HB   ILE  95           HB       ILE  95   2.305  11.544  15.187
    4   HG12  ILE  95          HG12      ILE  95   0.105  13.340  14.132
    5   HG13  ILE  95          HG13      ILE  95   1.053  12.270  13.103
    6   HG21  ILE  95          HG21      ILE  95   1.046  14.030  16.385
    7   HG23  ILE  95          HG22      ILE  95   2.080  12.851  17.192
    8   HG22  ILE  95          HG23      ILE  95   0.442  12.406  16.714
    9   HD13  ILE  95          HD11      ILE  95   0.129  10.342  14.021
   10   HD12  ILE  95          HD12      ILE  95  -1.243  11.445  14.093
   11   HD11  ILE  95          HD13      ILE  95  -0.284  11.137  15.541

  No H/Q in entry =          11
  In of MODEL   56
    1    H    GLU  96           H        GLU  96   4.890  12.181  15.263
    2    HA   GLU  96           HA       GLU  96   5.452  13.375  17.756
    3    HB2  GLU  96           HB2      GLU  96   6.380  11.207  17.111
    4    HB3  GLU  96           HB3      GLU  96   7.324  11.971  15.833
    5    HG2  GLU  96           HG2      GLU  96   8.974  12.504  17.299
    6    HG3  GLU  96           HG3      GLU  96   7.833  13.328  18.351

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LEU  97           H        LEU  97   6.541  14.136  14.472
    2    HA   LEU  97           HA       LEU  97   8.444  16.114  15.188
    3    HB2  LEU  97           HB2      LEU  97   6.853  15.580  12.689
    4    HB3  LEU  97           HB3      LEU  97   7.886  17.001  12.813
    5    HG   LEU  97           HG       LEU  97   8.887  14.194  13.376
    6   HD12  LEU  97          HD11      LEU  97   9.891  14.378  11.061
    7   HD11  LEU  97          HD12      LEU  97   8.853  15.778  10.795
    8   HD13  LEU  97          HD13      LEU  97   8.138  14.193  11.088
    9   HD23  LEU  97          HD21      LEU  97  11.070  15.453  12.638
   10   HD22  LEU  97          HD22      LEU  97  10.450  15.729  14.265
   11   HD21  LEU  97          HD23      LEU  97  10.149  16.914  12.996

  No H/Q in entry =          11
  In of MODEL   56
    1    H    HIS  98           H        HIS  98   4.956  16.282  14.525
    2    HA   HIS  98           HA       HIS  98   4.681  19.084  14.659
    3    HB2  HIS  98           HB2      HIS  98   2.770  16.851  15.381
    4    HB3  HIS  98           HB3      HIS  98   2.318  18.556  15.436
    5    HD1  HIS  98           HD1      HIS  98   3.320  15.831  13.034
    6    HD2  HIS  98           HD2      HIS  98   1.980  19.776  12.907
    7    HE1  HIS  98           HE1      HIS  98   2.771  16.323  10.609
    8    HE2  HIS  98           HE2      HIS  98   1.958  18.720  10.510

  No H/Q in entry =           8
  In of MODEL   56
    1    H    GLU  99           H        GLU  99   4.787  16.595  17.159
    2    HA   GLU  99           HA       GLU  99   4.189  18.296  19.355
    3    HB2  GLU  99           HB2      GLU  99   4.077  15.815  19.453
    4    HB3  GLU  99           HB3      GLU  99   5.837  15.754  19.349
    5    HG2  GLU  99           HG2      GLU  99   6.033  17.045  21.423
    6    HG3  GLU  99           HG3      GLU  99   4.281  17.202  21.514

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LYS 100           H        LYS 100   7.238  17.337  17.798
    2    HA   LYS 100           HA       LYS 100   8.901  18.724  19.658
    3    HB2  LYS 100           HB2      LYS 100   9.398  17.794  16.820
    4    HB3  LYS 100           HB3      LYS 100  10.632  18.552  17.831
    5    HG2  LYS 100           HG2      LYS 100  10.236  16.806  19.572
    6    HG3  LYS 100           HG3      LYS 100   9.100  16.012  18.478
    7    HD2  LYS 100           HD2      LYS 100  10.895  15.713  16.815
    8    HD3  LYS 100           HD3      LYS 100  12.036  16.518  17.894
    9    HE2  LYS 100           HE2      LYS 100  11.621  14.767  19.611
   10    HE3  LYS 100           HE3      LYS 100  10.541  13.941  18.484
   11    HZ1  LYS 100           HZ1      LYS 100  13.368  14.585  17.835
   12    HZ3  LYS 100           HZ2      LYS 100  12.317  13.539  17.005
   13    HZ2  LYS 100           HZ3      LYS 100  12.898  13.115  18.544

  No H/Q in entry =          13
  In of MODEL   56
    1    H    LEU 101           H        LEU 101   7.222  19.665  16.698
    2    HA   LEU 101           HA       LEU 101   8.460  22.210  16.365
    3    HB2  LEU 101           HB2      LEU 101   5.856  21.000  15.473
    4    HB3  LEU 101           HB3      LEU 101   6.123  22.729  15.266
    5    HG   LEU 101           HG       LEU 101   8.143  20.694  14.305
    6   HD12  LEU 101          HD11      LEU 101   6.999  21.210  12.017
    7   HD11  LEU 101          HD12      LEU 101   5.602  21.653  12.995
    8   HD13  LEU 101          HD13      LEU 101   6.251  20.016  13.078
    9   HD21  LEU 101          HD21      LEU 101   7.543  23.612  13.747
   10   HD23  LEU 101          HD22      LEU 101   8.517  22.642  12.643
   11   HD22  LEU 101          HD23      LEU 101   9.057  22.896  14.302

  No H/Q in entry =          11
  In of MODEL   56
    1    H    LYS 102           H        LYS 102   6.907  21.087  18.978
    2    HA   LYS 102           HA       LYS 102   6.280  22.185  20.908
    3    HB2  LYS 102           HB2      LYS 102   7.584  24.163  19.786
    4    HB3  LYS 102           HB3      LYS 102   5.991  24.782  19.407
    5    HG2  LYS 102           HG2      LYS 102   7.360  24.515  22.062
    6    HG3  LYS 102           HG3      LYS 102   6.421  25.852  21.431
    7    HD2  LYS 102           HD2      LYS 102   5.151  23.227  22.307
    8    HD3  LYS 102           HD3      LYS 102   5.410  24.586  23.391
    9    HE2  LYS 102           HE2      LYS 102   3.130  24.204  21.897
   10    HE3  LYS 102           HE3      LYS 102   3.646  25.745  22.580
   11    HZ2  LYS 102           HZ1      LYS 102   3.122  25.858  20.199
   12    HZ1  LYS 102           HZ2      LYS 102   4.374  24.764  19.879
   13    HZ3  LYS 102           HZ3      LYS 102   4.730  26.291  20.522

  No H/Q in entry =          13
  In of MODEL   56
    1    H    ALA 103           H        ALA 103   4.663  23.743  18.137
    2    HA   ALA 103           HA       ALA 103   2.212  24.342  19.017
    3    HB1  ALA 103           HB1      ALA 103   1.311  23.509  16.772
    4    HB2  ALA 103           HB2      ALA 103   2.954  22.956  16.446
    5    HB3  ALA 103           HB3      ALA 103   2.635  24.671  16.712

  No H/Q in entry =           5
  In of MODEL   56
    1    H1   ALA   1           H3       ALA   1  10.446 -20.240  -6.234
    2    H2   ALA   1           H2       ALA   1   9.482 -20.437  -7.622
    3    H3   ALA   1           H1       ALA   1   9.035 -21.179  -6.160
    4    HA   ALA   1           HA       ALA   1  10.058 -22.998  -6.897
    5    HB1  ALA   1           HB1      ALA   1  10.161 -22.640  -9.172
    6    HB2  ALA   1           HB2      ALA   1  11.889 -22.507  -8.840
    7    HB3  ALA   1           HB3      ALA   1  10.906 -21.050  -8.993

  No H/Q in entry =           7
  In of MODEL   56
    1    H    GLU   2           H        GLU   2  12.332 -23.971  -6.950
    2    HA   GLU   2           HA       GLU   2  13.710 -23.904  -4.736
    3    HB2  GLU   2           HB2      GLU   2  15.072 -23.786  -7.432
    4    HB3  GLU   2           HB3      GLU   2  15.791 -24.405  -5.946
    5    HG2  GLU   2           HG2      GLU   2  14.754 -26.411  -6.189
    6    HG3  GLU   2           HG3      GLU   2  13.192 -25.649  -6.450

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLU   3           H        GLU   3  15.504 -22.057  -7.134
    2    HA   GLU   3           HA       GLU   3  16.671 -20.382  -5.172
    3    HB2  GLU   3           HB2      GLU   3  16.621 -20.379  -8.182
    4    HB3  GLU   3           HB3      GLU   3  17.379 -19.058  -7.294
    5    HG2  GLU   3           HG2      GLU   3  19.025 -20.449  -6.368
    6    HG3  GLU   3           HG3      GLU   3  18.064 -21.907  -6.590

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LEU   4           H        LEU   4  14.403 -19.511  -7.807
    2    HA   LEU   4           HA       LEU   4  13.962 -16.897  -7.197
    3    HB2  LEU   4           HB2      LEU   4  11.768 -18.849  -7.931
    4    HB3  LEU   4           HB3      LEU   4  11.712 -17.100  -8.130
    5    HG   LEU   4           HG       LEU   4  13.659 -18.983  -9.499
    6   HD13  LEU   4          HD11      LEU   4  12.362 -18.821 -11.411
    7   HD12  LEU   4          HD12      LEU   4  11.670 -17.269 -10.945
    8   HD11  LEU   4          HD13      LEU   4  11.099 -18.754 -10.185
    9   HD23  LEU   4          HD21      LEU   4  14.021 -16.742 -10.850
   10   HD22  LEU   4          HD22      LEU   4  14.876 -16.993  -9.329
   11   HD21  LEU   4          HD23      LEU   4  13.434 -15.982  -9.371

  No H/Q in entry =          11
  In of MODEL   56
    1    H    GLU   5           H        GLU   5  12.446 -19.666  -5.557
    2    HA   GLU   5           HA       GLU   5  10.782 -18.077  -3.857
    3    HB2  GLU   5           HB2      GLU   5  10.336 -20.453  -4.381
    4    HB3  GLU   5           HB3      GLU   5  11.760 -20.901  -3.441
    5    HG2  GLU   5           HG2      GLU   5  10.792 -19.863  -1.441
    6    HG3  GLU   5           HG3      GLU   5   9.379 -19.365  -2.371

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLU   6           H        GLU   6  13.910 -19.689  -3.409
    2    HA   GLU   6           HA       GLU   6  14.267 -18.836  -0.710
    3    HB2  GLU   6           HB2      GLU   6  15.473 -20.764  -1.716
    4    HB3  GLU   6           HB3      GLU   6  16.362 -19.639  -2.745
    5    HG2  GLU   6           HG2      GLU   6  17.257 -18.510  -0.744
    6    HG3  GLU   6           HG3      GLU   6  16.370 -19.632   0.287

  No H/Q in entry =           6
  In of MODEL   56
    1    H    VAL   7           H        VAL   7  15.052 -17.517  -3.858
    2    HA   VAL   7           HA       VAL   7  16.758 -15.408  -2.991
    3    HB   VAL   7           HB       VAL   7  15.053 -15.754  -5.471
    4   HG11  VAL   7          HG11      VAL   7  16.967 -13.560  -4.656
    5   HG13  VAL   7          HG12      VAL   7  15.327 -13.401  -5.282
    6   HG12  VAL   7          HG13      VAL   7  16.633 -13.917  -6.350
    7   HG21  VAL   7          HG21      VAL   7  17.144 -17.232  -4.899
    8   HG23  VAL   7          HG22      VAL   7  18.064 -15.780  -5.295
    9   HG22  VAL   7          HG23      VAL   7  17.023 -16.519  -6.508

  No H/Q in entry =           9
  In of MODEL   56
    1    H    VAL   8           H        VAL   8  13.264 -15.643  -3.554
    2    HA   VAL   8           HA       VAL   8  12.624 -12.928  -3.083
    3    HB   VAL   8           HB       VAL   8  10.987 -15.442  -2.653
    4   HG13  VAL   8          HG11      VAL   8   9.935 -13.812  -1.301
    5   HG12  VAL   8          HG12      VAL   8   9.067 -13.707  -2.832
    6   HG11  VAL   8          HG13      VAL   8  10.298 -12.511  -2.433
    7   HG21  VAL   8          HG21      VAL   8  11.881 -14.355  -5.028
    8   HG23  VAL   8          HG22      VAL   8  10.341 -13.524  -4.825
    9   HG22  VAL   8          HG23      VAL   8  10.391 -15.284  -4.873

  No H/Q in entry =           9
  In of MODEL   56
    1    H    MET   9           H        MET   9  12.859 -15.737  -0.903
    2    HA   MET   9           HA       MET   9  12.052 -14.457   1.466
    3    HB2  MET   9           HB2      MET   9  13.954 -16.742   0.941
    4    HB3  MET   9           HB3      MET   9  13.620 -16.167   2.574
    5    HG2  MET   9           HG2      MET   9  11.218 -16.567   2.243
    6    HG3  MET   9           HG3      MET   9  11.528 -17.107   0.593
    7    HE3  MET   9           HE1      MET   9  12.927 -18.943   4.498
    8    HE2  MET   9           HE2      MET   9  11.210 -18.581   4.345
    9    HE1  MET   9           HE3      MET   9  12.395 -17.297   4.128

  No H/Q in entry =           9
  In of MODEL   56
    1    H    GLY  10           H        GLY  10  15.234 -14.711  -0.085
    2    HA3  GLY  10           HA2      GLY  10  16.702 -13.304   1.888
    3    HA2  GLY  10           HA3      GLY  10  17.167 -13.473   0.195

  No H/Q in entry =           3
  In of MODEL   56
    1    H    LEU  11           H        LEU  11  15.012 -12.233  -1.048
    2    HA   LEU  11           HA       LEU  11  15.721  -9.494  -0.884
    3    HB2  LEU  11           HB2      LEU  11  13.343 -10.883  -2.123
    4    HB3  LEU  11           HB3      LEU  11  13.639  -9.151  -2.282
    5    HG   LEU  11           HG       LEU  11  15.649 -11.277  -3.066
    6   HD13  LEU  11          HD11      LEU  11  13.903 -11.629  -4.590
    7   HD12  LEU  11          HD12      LEU  11  14.918 -10.456  -5.428
    8   HD11  LEU  11          HD13      LEU  11  13.448  -9.925  -4.612
    9   HD22  LEU  11          HD21      LEU  11  16.898  -9.325  -2.838
   10   HD21  LEU  11          HD22      LEU  11  15.532  -8.276  -3.220
   11   HD23  LEU  11          HD23      LEU  11  16.358  -9.152  -4.507

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  12           H        ILE  12  12.934 -11.296   0.378
    2    HA   ILE  12           HA       ILE  12  11.558  -9.060   1.435
    3    HB   ILE  12           HB       ILE  12  11.568 -11.943   2.385
    4   HG12  ILE  12          HG12      ILE  12  10.892 -11.308  -0.064
    5   HG13  ILE  12          HG13      ILE  12   9.851 -12.384   0.847
    6   HG21  ILE  12          HG21      ILE  12   9.673  -9.642   2.954
    7   HG23  ILE  12          HG22      ILE  12  10.622 -10.557   4.126
    8   HG22  ILE  12          HG23      ILE  12   9.282 -11.330   3.280
    9   HD11  ILE  12          HD11      ILE  12   9.458  -9.388   0.628
   10   HD13  ILE  12          HD12      ILE  12   8.346 -10.553   1.343
   11   HD12  ILE  12          HD13      ILE  12   8.639 -10.567  -0.382

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  13           H        ILE  13  13.930 -11.284   2.846
    2    HA   ILE  13           HA       ILE  13  13.970 -10.105   5.426
    3    HB   ILE  13           HB       ILE  13  16.018 -11.694   3.863
    4   HG12  ILE  13          HG12      ILE  13  13.730 -12.636   4.713
    5   HG13  ILE  13          HG13      ILE  13  15.196 -13.577   4.964
    6   HG22  ILE  13          HG21      ILE  13  17.016 -12.059   6.236
    7   HG21  ILE  13          HG22      ILE  13  16.163 -10.583   6.672
    8   HG23  ILE  13          HG23      ILE  13  17.392 -10.549   5.408
    9   HD13  ILE  13          HD11      ILE  13  15.336 -12.892   7.278
   10   HD12  ILE  13          HD12      ILE  13  13.669 -13.380   6.987
   11   HD11  ILE  13          HD13      ILE  13  14.086 -11.672   7.042

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ASN  14           H        ASN  14  15.933  -9.589   2.512
    2    HA   ASN  14           HA       ASN  14  17.689  -7.660   3.577
    3    HB2  ASN  14           HB2      ASN  14  17.662  -8.926   1.261
    4    HB3  ASN  14           HB3      ASN  14  16.780  -7.503   0.722
    5   HD21  ASN  14          HD21      ASN  14  19.221  -7.859  -0.458
    6   HD22  ASN  14          HD22      ASN  14  20.370  -6.784   0.171

  No H/Q in entry =           6
  In of MODEL   56
    1    H    SER  15           H        SER  15  14.584  -7.292   1.878
    2    HA   SER  15           HA       SER  15  14.490  -4.471   1.934
    3    HB2  SER  15           HB2      SER  15  12.156  -4.702   1.437
    4    HB3  SER  15           HB3      SER  15  12.947  -6.070   0.663
    5    HG   SER  15           HG       SER  15  12.482  -7.031   2.927

  No H/Q in entry =           5
  In of MODEL   56
    1    H    GLY  16           H        GLY  16  13.376  -6.923   4.235
    2    HA3  GLY  16           HA2      GLY  16  12.162  -5.167   6.090
    3    HA2  GLY  16           HA3      GLY  16  12.766  -6.779   6.454

  No H/Q in entry =           3
  In of MODEL   56
    1    H    GLN  17           H        GLN  17  15.481  -6.463   5.867
    2    HA   GLN  17           HA       GLN  17  16.439  -5.247   8.250
    3    HB2  GLN  17           HB2      GLN  17  17.864  -6.100   5.715
    4    HB3  GLN  17           HB3      GLN  17  18.705  -5.516   7.151
    5    HG2  GLN  17           HG2      GLN  17  16.790  -7.864   7.130
    6    HG3  GLN  17           HG3      GLN  17  18.545  -8.012   7.060
    7   HE21  GLN  17          HE21      GLN  17  19.746  -6.929   8.967
    8   HE22  GLN  17          HE22      GLN  17  18.992  -6.981  10.487

  No H/Q in entry =           8
  In of MODEL   56
    1    H    ALA  18           H        ALA  18  16.265  -4.169   4.889
    2    HA   ALA  18           HA       ALA  18  17.714  -1.784   5.119
    3    HB1  ALA  18           HB1      ALA  18  16.594  -2.993   3.049
    4    HB3  ALA  18           HB2      ALA  18  16.869  -1.251   3.034
    5    HB2  ALA  18           HB3      ALA  18  15.265  -1.887   3.400

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ARG  19           H        ARG  19  14.210  -2.352   5.508
    2    HA   ARG  19           HA       ARG  19  13.556   0.302   6.221
    3    HB2  ARG  19           HB2      ARG  19  11.866  -1.440   5.631
    4    HB3  ARG  19           HB3      ARG  19  12.199  -2.240   7.169
    5    HG2  ARG  19           HG2      ARG  19  11.498  -0.244   8.406
    6    HG3  ARG  19           HG3      ARG  19  11.256   0.633   6.897
    7    HD2  ARG  19           HD2      ARG  19   9.108  -0.151   7.712
    8    HD3  ARG  19           HD3      ARG  19   9.525  -1.033   6.237
    9    HE   ARG  19           HE       ARG  19  10.470  -2.580   8.345
   10   HH21  ARG  19          HH11      ARG  19   9.210  -4.213   9.281
   11   HH22  ARG  19          HH12      ARG  19   7.490  -4.176   9.106
   12   HH11  ARG  19          HH21      ARG  19   7.486  -1.271   7.242
   13   HH12  ARG  19          HH22      ARG  19   6.515  -2.510   7.948

  No H/Q in entry =          13
  In of MODEL   56
    1    H    SER  20           H        SER  20  14.393  -2.533   8.183
    2    HA   SER  20           HA       SER  20  14.110  -1.432  10.719
    3    HB2  SER  20           HB2      SER  20  14.563  -3.759  10.599
    4    HB3  SER  20           HB3      SER  20  16.019  -3.504   9.640
    5    HG   SER  20           HG       SER  20  15.559  -2.945  12.375

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LEU  21           H        LEU  21  16.958  -1.387   8.590
    2    HA   LEU  21           HA       LEU  21  18.637   0.090  10.332
    3    HB2  LEU  21           HB2      LEU  21  18.621  -0.184   7.318
    4    HB3  LEU  21           HB3      LEU  21  19.877   0.671   8.209
    5    HG   LEU  21           HG       LEU  21  19.123  -2.218   8.736
    6   HD13  LEU  21          HD11      LEU  21  21.094  -2.832   7.442
    7   HD12  LEU  21          HD12      LEU  21  21.468  -1.135   7.144
    8   HD11  LEU  21          HD13      LEU  21  20.026  -1.857   6.432
    9   HD21  LEU  21          HD21      LEU  21  21.211  -0.323   9.784
   10   HD23  LEU  21          HD22      LEU  21  21.623  -2.029   9.663
   11   HD22  LEU  21          HD23      LEU  21  20.272  -1.525  10.665

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ALA  22           H        ALA  22  16.385   1.072   7.771
    2    HA   ALA  22           HA       ALA  22  16.940   3.827   7.786
    3    HB3  ALA  22           HB1      ALA  22  15.534   2.593   6.104
    4    HB2  ALA  22           HB2      ALA  22  14.834   4.110   6.669
    5    HB1  ALA  22           HB3      ALA  22  14.234   2.574   7.295

  No H/Q in entry =           5
  In of MODEL   56
    1    H    TYR  23           H        TYR  23  14.428   2.026   9.614
    2    HA   TYR  23           HA       TYR  23  13.474   4.268  11.061
    3    HB2  TYR  23           HB2      TYR  23  12.226   2.163  11.038
    4    HB3  TYR  23           HB3      TYR  23  13.551   1.343  11.864
    5    HD1  TYR  23           HD1      TYR  23  11.058   4.095  12.226
    6    HD2  TYR  23           HD2      TYR  23  13.750   1.408  14.222
    7    HE1  TYR  23           HE1      TYR  23  10.131   4.793  14.421
    8    HE2  TYR  23           HE2      TYR  23  12.823   2.105  16.413
    9    HH   TYR  23           HH       TYR  23  10.112   4.403  16.613

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ALA  24           H        ALA  24  16.104   1.977  11.705
    2    HA   ALA  24           HA       ALA  24  16.774   2.968  14.270
    3    HB1  ALA  24           HB1      ALA  24  18.120   1.167  14.109
    4    HB3  ALA  24           HB2      ALA  24  19.156   2.082  13.013
    5    HB2  ALA  24           HB3      ALA  24  17.857   1.081  12.368

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ALA  25           H        ALA  25  17.745   3.891  10.994
    2    HA   ALA  25           HA       ALA  25  19.701   5.813  11.645
    3    HB1  ALA  25           HB1      ALA  25  18.984   4.870   9.327
    4    HB3  ALA  25           HB2      ALA  25  19.496   6.554   9.422
    5    HB2  ALA  25           HB3      ALA  25  17.779   6.158   9.348

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LEU  26           H        LEU  26  16.189   6.065  11.274
    2    HA   LEU  26           HA       LEU  26  15.982   8.848  11.725
    3    HB2  LEU  26           HB2      LEU  26  14.114   7.625  10.792
    4    HB3  LEU  26           HB3      LEU  26  14.013   6.598  12.217
    5    HG   LEU  26           HG       LEU  26  13.416   8.559  13.596
    6   HD12  LEU  26          HD11      LEU  26  12.773  10.664  12.269
    7   HD11  LEU  26          HD12      LEU  26  13.753  10.005  10.962
    8   HD13  LEU  26          HD13      LEU  26  14.496  10.385  12.516
    9   HD21  LEU  26          HD21      LEU  26  11.745   8.257  11.082
   10   HD23  LEU  26          HD22      LEU  26  11.186   8.959  12.597
   11   HD22  LEU  26          HD23      LEU  26  11.626   7.255  12.528

  No H/Q in entry =          11
  In of MODEL   56
    1    H    LYS  27           H        LYS  27  15.849   6.069  13.918
    2    HA   LYS  27           HA       LYS  27  15.259   7.439  16.284
    3    HB2  LYS  27           HB2      LYS  27  15.271   4.964  16.019
    4    HB3  LYS  27           HB3      LYS  27  17.035   5.004  15.980
    5    HG2  LYS  27           HG2      LYS  27  17.086   5.989  18.230
    6    HG3  LYS  27           HG3      LYS  27  15.319   6.020  18.271
    7    HD2  LYS  27           HD2      LYS  27  15.277   3.553  18.034
    8    HD3  LYS  27           HD3      LYS  27  17.041   3.530  18.027
    9    HE2  LYS  27           HE2      LYS  27  17.077   4.518  20.284
   10    HE3  LYS  27           HE3      LYS  27  15.311   4.572  20.294
   11    HZ3  LYS  27           HZ1      LYS  27  16.082   2.613  21.447
   12    HZ2  LYS  27           HZ2      LYS  27  16.998   2.128  20.098
   13    HZ1  LYS  27           HZ3      LYS  27  15.300   2.145  20.014

  No H/Q in entry =          13
  In of MODEL   56
    1    H    GLN  28           H        GLN  28  18.376   6.834  14.700
    2    HA   GLN  28           HA       GLN  28  20.063   7.904  16.695
    3    HB2  GLN  28           HB2      GLN  28  20.266   7.504  13.736
    4    HB3  GLN  28           HB3      GLN  28  21.471   8.515  14.536
    5    HG2  GLN  28           HG2      GLN  28  22.038   6.029  14.357
    6    HG3  GLN  28           HG3      GLN  28  22.160   6.737  15.967
    7   HE21  GLN  28          HE21      GLN  28  20.251   6.354  17.452
    8   HE22  GLN  28          HE22      GLN  28  19.321   4.951  17.235

  No H/Q in entry =           8
  In of MODEL   56
    1    H    ALA  29           H        ALA  29  18.329   9.401  13.998
    2    HA   ALA  29           HA       ALA  29  19.349  12.014  14.254
    3    HB2  ALA  29           HB1      ALA  29  17.659  12.664  12.779
    4    HB1  ALA  29           HB2      ALA  29  16.504  11.500  13.427
    5    HB3  ALA  29           HB3      ALA  29  17.832  10.947  12.407

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LYS  30           H        LYS  30  16.555  10.437  15.768
    2    HA   LYS  30           HA       LYS  30  15.557  12.699  17.123
    3    HB2  LYS  30           HB2      LYS  30  15.418   9.759  17.826
    4    HB3  LYS  30           HB3      LYS  30  14.561  11.016  18.718
    5    HG2  LYS  30           HG2      LYS  30  13.447  11.712  16.597
    6    HG3  LYS  30           HG3      LYS  30  14.242  10.369  15.772
    7    HD2  LYS  30           HD2      LYS  30  13.153   8.771  17.297
    8    HD3  LYS  30           HD3      LYS  30  12.367  10.103  18.146
    9    HE2  LYS  30           HE2      LYS  30  11.210  10.746  16.051
   10    HE3  LYS  30           HE3      LYS  30  11.975   9.385  15.222
   11    HZ2  LYS  30           HZ1      LYS  30   9.661   8.996  16.096
   12    HZ1  LYS  30           HZ2      LYS  30  10.325   9.043  17.665
   13    HZ3  LYS  30           HZ3      LYS  30  10.826   7.854  16.555

  No H/Q in entry =          13
  In of MODEL   56
    1    H    GLN  31           H        GLN  31  18.197  10.506  17.866
    2    HA   GLN  31           HA       GLN  31  18.526  11.517  20.562
    3    HB2  GLN  31           HB2      GLN  31  20.539   9.928  18.962
    4    HB3  GLN  31           HB3      GLN  31  20.402  10.054  20.716
    5    HG2  GLN  31           HG2      GLN  31  17.881   9.124  19.940
    6    HG3  GLN  31           HG3      GLN  31  18.978   8.270  18.863
    7   HE21  GLN  31          HE21      GLN  31  17.420   7.137  21.135
    8   HE22  GLN  31          HE22      GLN  31  18.567   6.466  22.188

  No H/Q in entry =           8
  In of MODEL   56
    1    H    GLY  32           H        GLY  32  19.064  12.830  17.597
    2    HA3  GLY  32           HA2      GLY  32  20.068  14.867  17.085
    3    HA2  GLY  32           HA3      GLY  32  20.822  14.864  18.675

  No H/Q in entry =           3
  In of MODEL   56
    1    H    ASP  33           H        ASP  33  21.222  11.968  16.899
    2    HA   ASP  33           HA       ASP  33  24.055  12.619  16.439
    3    HB2  ASP  33           HB2      ASP  33  22.523  10.016  16.551
    4    HB3  ASP  33           HB3      ASP  33  24.211  10.118  16.061

  No H/Q in entry =           4
  In of MODEL   56
    1    H    PHE  34           H        PHE  34  23.590  13.947  14.557
    2    HA   PHE  34           HA       PHE  34  22.238  12.975  12.267
    3    HB2  PHE  34           HB2      PHE  34  24.387  15.090  12.502
    4    HB3  PHE  34           HB3      PHE  34  23.402  14.809  11.068
    5    HD1  PHE  34           HD1      PHE  34  23.663  16.740  13.983
    6    HD2  PHE  34           HD2      PHE  34  20.773  14.650  11.589
    7    HE1  PHE  34           HE1      PHE  34  21.857  18.153  14.926
    8    HE2  PHE  34           HE2      PHE  34  18.971  16.063  12.535
    9    HZ   PHE  34           HZ       PHE  34  19.516  17.815  14.199

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ALA  35           H        ALA  35  25.608  12.758  13.283
    2    HA   ALA  35           HA       ALA  35  26.712  11.928  10.828
    3    HB3  ALA  35           HB1      ALA  35  28.378  10.744  12.552
    4    HB2  ALA  35           HB2      ALA  35  27.521  11.776  13.695
    5    HB1  ALA  35           HB3      ALA  35  28.367  12.493  12.325

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ALA  36           H        ALA  36  25.573   9.981  13.590
    2    HA   ALA  36           HA       ALA  36  26.040   7.489  12.315
    3    HB2  ALA  36           HB1      ALA  36  25.598   6.746  14.390
    4    HB3  ALA  36           HB2      ALA  36  23.914   7.255  14.236
    5    HB1  ALA  36           HB3      ALA  36  25.123   8.377  14.862

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ALA  37           H        ALA  37  23.235   9.638  12.443
    2    HA   ALA  37           HA       ALA  37  21.368   7.884  11.262
    3    HB3  ALA  37           HB1      ALA  37  21.616  10.845  11.555
    4    HB1  ALA  37           HB2      ALA  37  20.295   9.777  12.024
    5    HB2  ALA  37           HB3      ALA  37  20.492  10.248  10.336

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LYS  38           H        LYS  38  23.490  10.329   9.789
    2    HA   LYS  38           HA       LYS  38  22.854   9.907   7.110
    3    HB2  LYS  38           HB2      LYS  38  24.672  11.450   8.560
    4    HB3  LYS  38           HB3      LYS  38  25.700  10.453   7.536
    5    HG2  LYS  38           HG2      LYS  38  24.546  11.232   5.537
    6    HG3  LYS  38           HG3      LYS  38  23.356  12.096   6.516
    7    HD2  LYS  38           HD2      LYS  38  24.961  13.682   7.272
    8    HD3  LYS  38           HD3      LYS  38  26.315  12.686   6.740
    9    HE2  LYS  38           HE2      LYS  38  25.976  14.560   5.188
   10    HE3  LYS  38           HE3      LYS  38  25.631  13.025   4.383
   11    HZ3  LYS  38           HZ1      LYS  38  23.438  13.486   4.247
   12    HZ2  LYS  38           HZ2      LYS  38  23.972  15.097   4.336
   13    HZ1  LYS  38           HZ3      LYS  38  23.389  14.318   5.727

  No H/Q in entry =          13
  In of MODEL   56
    1    H    ALA  39           H        ALA  39  25.351   8.290   9.072
    2    HA   ALA  39           HA       ALA  39  26.414   6.694   7.004
    3    HB2  ALA  39           HB1      ALA  39  26.311   5.731   9.848
    4    HB1  ALA  39           HB2      ALA  39  27.275   7.150   9.434
    5    HB3  ALA  39           HB3      ALA  39  27.618   5.597   8.671

  No H/Q in entry =           5
  In of MODEL   56
    1    H    MET  40           H        MET  40  23.791   6.097   9.296
    2    HA   MET  40           HA       MET  40  23.331   3.395   8.560
    3    HB2  MET  40           HB2      MET  40  21.526   5.451   9.848
    4    HB3  MET  40           HB3      MET  40  21.108   3.745   9.672
    5    HG2  MET  40           HG2      MET  40  23.660   4.668  11.020
    6    HG3  MET  40           HG3      MET  40  22.162   4.402  11.909
    7    HE3  MET  40           HE1      MET  40  21.573   0.773  12.083
    8    HE2  MET  40           HE2      MET  40  20.715   2.082  11.273
    9    HE1  MET  40           HE3      MET  40  21.454   2.364  12.848

  No H/Q in entry =           9
  In of MODEL   56
    1    H    MET  41           H        MET  41  21.941   6.458   7.370
    2    HA   MET  41           HA       MET  41  19.980   5.277   5.693
    3    HB2  MET  41           HB2      MET  41  21.479   7.857   5.184
    4    HB3  MET  41           HB3      MET  41  19.950   7.374   4.462
    5    HG2  MET  41           HG2      MET  41  19.197   7.190   7.011
    6    HG3  MET  41           HG3      MET  41  20.513   8.339   7.237
    7    HE2  MET  41           HE1      MET  41  19.966   9.631   3.899
    8    HE1  MET  41           HE2      MET  41  20.923  10.064   5.313
    9    HE3  MET  41           HE3      MET  41  19.659  11.152   4.746

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ASP  42           H        ASP  42  23.360   6.177   5.148
    2    HA   ASP  42           HA       ASP  42  23.455   5.703   2.391
    3    HB2  ASP  42           HB2      ASP  42  25.208   6.689   4.164
    4    HB3  ASP  42           HB3      ASP  42  25.855   5.059   4.038

  No H/Q in entry =           4
  In of MODEL   56
    1    H    GLN  43           H        GLN  43  24.159   3.543   5.113
    2    HA   GLN  43           HA       GLN  43  24.812   1.282   3.531
    3    HB2  GLN  43           HB2      GLN  43  23.784   1.471   6.372
    4    HB3  GLN  43           HB3      GLN  43  24.355  -0.021   5.618
    5    HG2  GLN  43           HG2      GLN  43  26.527   1.175   5.112
    6    HG3  GLN  43           HG3      GLN  43  25.950   2.506   6.111
    7   HE21  GLN  43          HE21      GLN  43  28.175   1.518   7.153
    8   HE22  GLN  43          HE22      GLN  43  27.890   0.437   8.428

  No H/Q in entry =           8
  In of MODEL   56
    1    H    SER  44           H        SER  44  21.760   2.435   4.909
    2    HA   SER  44           HA       SER  44  20.178   0.202   4.232
    3    HB2  SER  44           HB2      SER  44  19.751   2.733   5.377
    4    HB3  SER  44           HB3      SER  44  18.719   2.698   3.950
    5    HG   SER  44           HG       SER  44  17.615   1.761   5.670

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ARG  45           H        ARG  45  20.945   3.162   2.430
    2    HA   ARG  45           HA       ARG  45  19.422   2.687   0.121
    3    HB2  ARG  45           HB2      ARG  45  20.578   4.815   0.709
    4    HB3  ARG  45           HB3      ARG  45  22.119   4.050   0.327
    5    HG2  ARG  45           HG2      ARG  45  21.338   3.651  -1.990
    6    HG3  ARG  45           HG3      ARG  45  19.810   4.439  -1.606
    7    HD2  ARG  45           HD2      ARG  45  21.073   6.527  -1.019
    8    HD3  ARG  45           HD3      ARG  45  22.565   5.743  -1.584
    9    HE   ARG  45           HE       ARG  45  20.638   5.519  -3.624
   10   HH21  ARG  45          HH11      ARG  45  20.644   6.888  -5.388
   11   HH22  ARG  45          HH12      ARG  45  21.411   8.433  -5.281
   12   HH11  ARG  45          HH21      ARG  45  22.382   8.005  -1.993
   13   HH12  ARG  45          HH22      ARG  45  22.394   9.065  -3.356

  No H/Q in entry =          13
  In of MODEL   56
    1    H    MET  46           H        MET  46  22.778   1.789   0.876
    2    HA   MET  46           HA       MET  46  23.381   0.592  -1.607
    3    HB2  MET  46           HB2      MET  46  24.479   0.258   1.184
    4    HB3  MET  46           HB3      MET  46  25.132  -0.640  -0.189
    5    HG2  MET  46           HG2      MET  46  25.605   1.455  -1.372
    6    HG3  MET  46           HG3      MET  46  24.886   2.381  -0.061
    7    HE1  MET  46           HE1      MET  46  27.325  -0.063  -1.233
    8    HE3  MET  46           HE2      MET  46  27.577  -0.831   0.332
    9    HE2  MET  46           HE3      MET  46  28.833   0.206  -0.346

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ALA  47           H        ALA  47  21.982  -0.731   1.366
    2    HA   ALA  47           HA       ALA  47  21.910  -3.443   0.563
    3    HB2  ALA  47           HB1      ALA  47  21.531  -2.980   2.867
    4    HB3  ALA  47           HB2      ALA  47  19.990  -3.572   2.245
    5    HB1  ALA  47           HB3      ALA  47  20.233  -1.842   2.504

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LEU  48           H        LEU  48  19.578  -0.799   0.202
    2    HA   LEU  48           HA       LEU  48  17.524  -2.316  -1.052
    3    HB2  LEU  48           HB2      LEU  48  18.201   0.633  -1.166
    4    HB3  LEU  48           HB3      LEU  48  16.726  -0.066  -1.835
    5    HG   LEU  48           HG       LEU  48  17.572  -0.375   1.055
    6   HD13  LEU  48          HD11      LEU  48  17.172   1.929   0.867
    7   HD12  LEU  48          HD12      LEU  48  15.608   1.294   1.374
    8   HD11  LEU  48          HD13      LEU  48  15.885   1.714  -0.316
    9   HD22  LEU  48          HD21      LEU  48  16.031  -2.077   0.672
   10   HD21  LEU  48          HD22      LEU  48  15.166  -1.168  -0.568
   11   HD23  LEU  48          HD23      LEU  48  14.954  -0.761   1.135

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ASN  49           H        ASN  49  20.229  -0.410  -2.279
    2    HA   ASN  49           HA       ASN  49  19.581  -0.489  -5.004
    3    HB2  ASN  49           HB2      ASN  49  21.272   1.013  -4.072
    4    HB3  ASN  49           HB3      ASN  49  22.291  -0.358  -3.650
    5   HD21  ASN  49          HD21      ASN  49  23.283   1.664  -5.336
    6   HD22  ASN  49          HD22      ASN  49  23.465   1.045  -6.905

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLU  50           H        GLU  50  21.545  -2.699  -3.038
    2    HA   GLU  50           HA       GLU  50  22.234  -4.461  -5.163
    3    HB2  GLU  50           HB2      GLU  50  23.430  -4.445  -2.995
    4    HB3  GLU  50           HB3      GLU  50  21.981  -5.060  -2.201
    5    HG2  GLU  50           HG2      GLU  50  22.056  -7.094  -3.559
    6    HG3  GLU  50           HG3      GLU  50  23.438  -6.473  -4.459

  No H/Q in entry =           6
  In of MODEL   56
    1    H    ALA  51           H        ALA  51  19.576  -4.373  -2.840
    2    HA   ALA  51           HA       ALA  51  18.391  -6.836  -3.598
    3    HB3  ALA  51           HB1      ALA  51  16.801  -6.317  -2.045
    4    HB1  ALA  51           HB2      ALA  51  16.602  -4.669  -2.644
    5    HB2  ALA  51           HB3      ALA  51  17.956  -5.066  -1.586

  No H/Q in entry =           5
  In of MODEL   56
    1    H    HIS  52           H        HIS  52  17.833  -3.484  -4.635
    2    HA   HIS  52           HA       HIS  52  15.718  -3.994  -6.437
    3    HB2  HIS  52           HB2      HIS  52  16.388  -1.734  -5.634
    4    HB3  HIS  52           HB3      HIS  52  17.839  -1.843  -6.630
    5    HD1  HIS  52           HD1      HIS  52  17.486  -1.903  -9.249
    6    HD2  HIS  52           HD2      HIS  52  14.029  -1.135  -7.049
    7    HE1  HIS  52           HE1      HIS  52  15.769  -1.029 -10.894
    8    HE2  HIS  52           HE2      HIS  52  13.656  -0.556  -9.568

  No H/Q in entry =           8
  In of MODEL   56
    1    H    LEU  53           H        LEU  53  19.236  -4.029  -6.866
    2    HA   LEU  53           HA       LEU  53  19.294  -4.346  -9.666
    3    HB2  LEU  53           HB2      LEU  53  21.218  -5.122  -7.489
    4    HB3  LEU  53           HB3      LEU  53  21.533  -5.512  -9.178
    5    HG   LEU  53           HG       LEU  53  20.887  -2.697  -8.246
    6   HD12  LEU  53          HD11      LEU  53  23.382  -2.335  -8.499
    7   HD11  LEU  53          HD12      LEU  53  23.558  -4.088  -8.562
    8   HD13  LEU  53          HD13      LEU  53  22.920  -3.319  -7.113
    9   HD22  LEU  53          HD21      LEU  53  20.624  -2.736 -10.585
   10   HD21  LEU  53          HD22      LEU  53  21.877  -3.955 -10.798
   11   HD23  LEU  53          HD23      LEU  53  22.322  -2.298 -10.439

  No H/Q in entry =          11
  In of MODEL   56
    1    H    VAL  54           H        VAL  54  19.160  -6.730  -7.039
    2    HA   VAL  54           HA       VAL  54  19.267  -9.027  -8.697
    3    HB   VAL  54           HB       VAL  54  18.113  -8.592  -5.931
    4   HG12  VAL  54          HG11      VAL  54  18.417 -11.213  -5.925
    5   HG11  VAL  54          HG12      VAL  54  18.235 -11.044  -7.670
    6   HG13  VAL  54          HG13      VAL  54  16.949 -10.503  -6.593
    7   HG22  VAL  54          HG21      VAL  54  20.430  -8.399  -5.706
    8   HG21  VAL  54          HG22      VAL  54  20.760  -9.495  -7.046
    9   HG23  VAL  54          HG23      VAL  54  20.224 -10.137  -5.494

  No H/Q in entry =           9
  In of MODEL   56
    1    H    GLN  55           H        GLN  55  16.552  -7.102  -7.418
    2    HA   GLN  55           HA       GLN  55  14.519  -8.752  -8.493
    3    HB2  GLN  55           HB2      GLN  55  13.781  -7.220  -6.868
    4    HB3  GLN  55           HB3      GLN  55  14.585  -5.858  -7.644
    5    HG2  GLN  55           HG2      GLN  55  12.864  -5.522  -9.136
    6    HG3  GLN  55           HG3      GLN  55  12.530  -7.240  -9.305
    7   HE21  GLN  55          HE21      GLN  55  10.518  -7.774  -8.501
    8   HE22  GLN  55          HE22      GLN  55   9.749  -7.013  -7.194

  No H/Q in entry =           8
  In of MODEL   56
    1    H    THR  56           H        THR  56  16.281  -5.966  -9.853
    2    HA   THR  56           HA       THR  56  14.848  -5.595 -12.203
    3    HB   THR  56           HB       THR  56  17.867  -5.529 -12.038
    4    HG1  THR  56           HG1      THR  56  15.879  -3.838 -11.017
    5   HG22  THR  56          HG21      THR  56  16.123  -3.620 -13.553
    6   HG21  THR  56          HG22      THR  56  16.450  -5.213 -14.233
    7   HG23  THR  56          HG23      THR  56  17.784  -4.115 -13.879

  No H/Q in entry =           7
  In of MODEL   56
    1    H    LYS  57           H        LYS  57  17.480  -7.911 -11.587
    2    HA   LYS  57           HA       LYS  57  17.475  -9.107 -14.164
    3    HB2  LYS  57           HB2      LYS  57  19.276  -9.386 -12.458
    4    HB3  LYS  57           HB3      LYS  57  18.165 -10.317 -11.465
    5    HG2  LYS  57           HG2      LYS  57  17.930 -11.741 -13.709
    6    HG3  LYS  57           HG3      LYS  57  19.540 -11.092 -14.001
    7    HD2  LYS  57           HD2      LYS  57  18.784 -12.458 -11.407
    8    HD3  LYS  57           HD3      LYS  57  19.462 -13.333 -12.779
    9    HE2  LYS  57           HE2      LYS  57  21.260 -12.706 -11.226
   10    HE3  LYS  57           HE3      LYS  57  21.451 -11.813 -12.733
   11    HZ3  LYS  57           HZ1      LYS  57  21.073  -9.883 -11.721
   12    HZ2  LYS  57           HZ2      LYS  57  21.368 -10.717 -10.271
   13    HZ1  LYS  57           HZ3      LYS  57  19.775 -10.488 -10.812

  No H/Q in entry =          13
  In of MODEL   56
    1    H    LEU  58           H        LEU  58  15.687  -9.760 -11.190
    2    HA   LEU  58           HA       LEU  58  14.450 -12.126 -12.123
    3    HB2  LEU  58           HB2      LEU  58  13.666 -10.213  -9.930
    4    HB3  LEU  58           HB3      LEU  58  12.850 -11.746 -10.246
    5    HG   LEU  58           HG       LEU  58  15.824 -11.487  -9.689
    6   HD11  LEU  58          HD11      LEU  58  13.449 -11.887  -7.898
    7   HD13  LEU  58          HD12      LEU  58  14.908 -10.933  -7.635
    8   HD12  LEU  58          HD13      LEU  58  14.969 -12.690  -7.498
    9   HD22  LEU  58          HD21      LEU  58  15.693 -13.549 -10.715
   10   HD21  LEU  58          HD22      LEU  58  13.978 -13.747 -10.355
   11   HD23  LEU  58          HD23      LEU  58  15.183 -14.054  -9.105

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  59           H        ILE  59  13.802  -8.785 -12.810
    2    HA   ILE  59           HA       ILE  59  11.083  -9.417 -13.751
    3    HB   ILE  59           HB       ILE  59  11.909  -7.137 -12.549
    4   HG12  ILE  59          HG12      ILE  59   9.989  -7.010 -14.887
    5   HG13  ILE  59          HG13      ILE  59   9.575  -7.773 -13.374
    6   HG23  ILE  59          HG21      ILE  59  12.483  -5.421 -14.064
    7   HG22  ILE  59          HG22      ILE  59  11.975  -6.344 -15.461
    8   HG21  ILE  59          HG23      ILE  59  13.458  -6.763 -14.609
    9   HD12  ILE  59          HD11      ILE  59   8.828  -5.407 -13.458
   10   HD11  ILE  59          HD12      ILE  59  10.511  -4.915 -13.637
   11   HD13  ILE  59          HD13      ILE  59   9.976  -5.699 -12.150

  No H/Q in entry =          11
  In of MODEL   56
    1    H    GLU  60           H        GLU  60  14.293  -8.587 -15.008
    2    HA   GLU  60           HA       GLU  60  13.518  -8.184 -17.717
    3    HB2  GLU  60           HB2      GLU  60  15.706  -7.474 -16.836
    4    HB3  GLU  60           HB3      GLU  60  16.156  -9.159 -16.584
    5    HG2  GLU  60           HG2      GLU  60  15.945  -9.584 -19.008
    6    HG3  GLU  60           HG3      GLU  60  15.489  -7.901 -19.263

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLY  61           H        GLY  61  14.475 -11.070 -15.898
    2    HA3  GLY  61           HA2      GLY  61  13.925 -12.717 -18.299
    3    HA2  GLY  61           HA3      GLY  61  14.953 -13.204 -16.955

  No H/Q in entry =           3
  In of MODEL   56
    1    H    ASP  62           H        ASP  62  11.843 -11.637 -16.587
    2    HA   ASP  62           HA       ASP  62  10.904 -13.691 -14.835
    3    HB2  ASP  62           HB2      ASP  62   8.872 -12.316 -14.715
    4    HB3  ASP  62           HB3      ASP  62  10.324 -11.345 -14.488

  No H/Q in entry =           4
  In of MODEL   56
    1    H    ALA  63           H        ALA  63  11.250 -15.371 -16.742
    2    HA   ALA  63           HA       ALA  63   9.295 -15.538 -18.817
    3    HB1  ALA  63           HB1      ALA  63  11.499 -16.792 -18.692
    4    HB3  ALA  63           HB2      ALA  63  10.108 -17.763 -19.167
    5    HB2  ALA  63           HB3      ALA  63  10.732 -17.864 -17.520

  No H/Q in entry =           5
  In of MODEL   56
    1    H    GLY  64           H        GLY  64   9.468 -16.768 -15.523
    2    HA3  GLY  64           HA2      GLY  64   7.820 -17.474 -14.079
    3    HA2  GLY  64           HA3      GLY  64   6.628 -16.938 -15.255

  No H/Q in entry =           3
  In of MODEL   56
    1    H    GLU  65           H        GLU  65   5.635 -19.021 -14.302
    2    HA   GLU  65           HA       GLU  65   6.709 -21.534 -14.982
    3    HB2  GLU  65           HB2      GLU  65   3.874 -20.686 -14.408
    4    HB3  GLU  65           HB3      GLU  65   4.369 -22.364 -14.622
    5    HG2  GLU  65           HG2      GLU  65   5.948 -22.172 -12.769
    6    HG3  GLU  65           HG3      GLU  65   5.553 -20.464 -12.578

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLY  66           H        GLY  66   4.454 -19.458 -16.647
    2    HA3  GLY  66           HA2      GLY  66   4.466 -21.213 -19.010
    3    HA2  GLY  66           HA3      GLY  66   3.200 -20.067 -18.618

  No H/Q in entry =           3
  In of MODEL   56
    1    H    LYS  67           H        LYS  67   3.910 -19.870 -21.061
    2    HA   LYS  67           HA       LYS  67   6.212 -18.498 -21.799
    3    HB2  LYS  67           HB2      LYS  67   3.490 -18.619 -23.091
    4    HB3  LYS  67           HB3      LYS  67   4.923 -17.933 -23.868
    5    HG2  LYS  67           HG2      LYS  67   6.123 -20.062 -23.561
    6    HG3  LYS  67           HG3      LYS  67   4.709 -20.752 -22.768
    7    HD2  LYS  67           HD2      LYS  67   3.399 -20.445 -24.838
    8    HD3  LYS  67           HD3      LYS  67   4.821 -19.765 -25.633
    9    HE2  LYS  67           HE2      LYS  67   6.047 -21.872 -25.258
   10    HE3  LYS  67           HE3      LYS  67   4.633 -22.556 -24.459
   11    HZ3  LYS  67           HZ1      LYS  67   4.160 -23.287 -26.510
   12    HZ2  LYS  67           HZ2      LYS  67   5.143 -22.133 -27.275
   13    HZ1  LYS  67           HZ3      LYS  67   3.578 -21.715 -26.762

  No H/Q in entry =          13
  In of MODEL   56
    1    H    MET  68           H        MET  68   3.060 -16.982 -22.046
    2    HA   MET  68           HA       MET  68   3.995 -14.329 -22.016
    3    HB2  MET  68           HB2      MET  68   1.288 -15.589 -21.692
    4    HB3  MET  68           HB3      MET  68   1.508 -13.841 -21.599
    5    HG2  MET  68           HG2      MET  68   2.477 -15.533 -23.917
    6    HG3  MET  68           HG3      MET  68   0.938 -14.672 -23.906
    7    HE3  MET  68           HE1      MET  68   3.797 -13.901 -26.069
    8    HE2  MET  68           HE2      MET  68   2.660 -12.585 -26.345
    9    HE1  MET  68           HE3      MET  68   2.055 -14.212 -26.046

  No H/Q in entry =           9
  In of MODEL   56
    1    H    LYS  69           H        LYS  69   2.624 -16.299 -19.365
    2    HA   LYS  69           HA       LYS  69   2.389 -14.154 -17.535
    3    HB2  LYS  69           HB2      LYS  69   2.455 -17.143 -17.143
    4    HB3  LYS  69           HB3      LYS  69   2.170 -16.003 -15.826
    5    HG2  LYS  69           HG2      LYS  69   0.260 -15.045 -17.045
    6    HG3  LYS  69           HG3      LYS  69   0.547 -16.160 -18.381
    7    HD2  LYS  69           HD2      LYS  69   0.171 -18.070 -16.838
    8    HD3  LYS  69           HD3      LYS  69  -0.191 -16.928 -15.543
    9    HE2  LYS  69           HE2      LYS  69  -1.694 -17.132 -18.170
   10    HE3  LYS  69           HE3      LYS  69  -2.262 -17.750 -16.621
   11    HZ2  LYS  69           HZ1      LYS  69  -2.076 -15.002 -17.567
   12    HZ1  LYS  69           HZ2      LYS  69  -1.720 -15.270 -15.928
   13    HZ3  LYS  69           HZ3      LYS  69  -3.230 -15.724 -16.557

  No H/Q in entry =          13
  In of MODEL   56
    1    H    VAL  70           H        VAL  70   3.440 -14.139 -15.305
    2    HA   VAL  70           HA       VAL  70   6.363 -14.604 -15.511
    3    HB   VAL  70           HB       VAL  70   6.657 -12.527 -14.188
    4   HG11  VAL  70          HG11      VAL  70   6.584 -12.633 -16.762
    5   HG13  VAL  70          HG12      VAL  70   6.391 -11.045 -16.023
    6   HG12  VAL  70          HG13      VAL  70   4.980 -11.914 -16.624
    7   HG23  VAL  70          HG21      VAL  70   4.593 -10.977 -14.134
    8   HG22  VAL  70          HG22      VAL  70   4.596 -12.325 -12.998
    9   HG21  VAL  70          HG23      VAL  70   3.637 -12.421 -14.474

  No H/Q in entry =           9
  In of MODEL   56
    1    H    SER  71           H        SER  71   7.408 -14.621 -13.320
    2    HA   SER  71           HA       SER  71   6.283 -16.595 -11.638
    3    HB2  SER  71           HB2      SER  71   8.719 -16.101 -11.788
    4    HB3  SER  71           HB3      SER  71   8.435 -14.570 -10.961
    5    HG   SER  71           HG       SER  71   7.411 -16.904  -9.819

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LEU  72           H        LEU  72   4.921 -16.460  -9.968
    2    HA   LEU  72           HA       LEU  72   3.386 -14.136  -9.527
    3    HB2  LEU  72           HB2      LEU  72   3.637 -16.762  -8.096
    4    HB3  LEU  72           HB3      LEU  72   2.611 -15.477  -7.463
    5    HG   LEU  72           HG       LEU  72   2.392 -16.474 -10.320
    6   HD12  LEU  72          HD11      LEU  72   0.741 -17.318  -7.919
    7   HD11  LEU  72          HD12      LEU  72   1.978 -18.316  -8.683
    8   HD13  LEU  72          HD13      LEU  72   0.529 -17.864  -9.582
    9   HD23  LEU  72          HD21      LEU  72  -0.028 -15.584  -9.818
   10   HD22  LEU  72          HD22      LEU  72   1.231 -14.416 -10.182
   11   HD21  LEU  72          HD23      LEU  72   0.751 -14.699  -8.511

  No H/Q in entry =          11
  In of MODEL   56
    1    H    VAL  73           H        VAL  73   6.030 -15.590  -7.749
    2    HA   VAL  73           HA       VAL  73   5.976 -14.056  -5.418
    3    HB   VAL  73           HB       VAL  73   8.156 -14.877  -4.989
    4   HG13  VAL  73          HG11      VAL  73   7.867 -17.219  -5.348
    5   HG12  VAL  73          HG12      VAL  73   6.925 -16.950  -6.814
    6   HG11  VAL  73          HG13      VAL  73   6.241 -16.550  -5.239
    7   HG21  VAL  73          HG21      VAL  73   8.331 -14.937  -7.982
    8   HG23  VAL  73          HG22      VAL  73   9.309 -16.071  -7.053
    9   HG22  VAL  73          HG23      VAL  73   9.501 -14.336  -6.807

  No H/Q in entry =           9
  In of MODEL   56
    1    H    LEU  74           H        LEU  74   6.978 -13.169  -8.592
    2    HA   LEU  74           HA       LEU  74   8.935 -11.234  -8.097
    3    HB2  LEU  74           HB2      LEU  74   8.472 -11.987 -10.336
    4    HB3  LEU  74           HB3      LEU  74   6.815 -11.392 -10.238
    5    HG   LEU  74           HG       LEU  74   7.653  -9.079 -10.028
    6   HD12  LEU  74          HD11      LEU  74  10.162  -8.824 -10.612
    7   HD11  LEU  74          HD12      LEU  74  10.313 -10.506 -10.111
    8   HD13  LEU  74          HD13      LEU  74   9.759  -9.291  -8.961
    9   HD23  LEU  74          HD21      LEU  74   9.135 -10.178 -12.353
   10   HD22  LEU  74          HD22      LEU  74   7.977  -8.871 -12.262
   11   HD21  LEU  74          HD23      LEU  74   7.410 -10.525 -12.248

  No H/Q in entry =          11
  In of MODEL   56
    1    H    VAL  75           H        VAL  75   5.443 -10.825  -8.457
    2    HA   VAL  75           HA       VAL  75   5.364  -8.068  -7.871
    3    HB   VAL  75           HB       VAL  75   3.257 -10.195  -7.483
    4   HG12  VAL  75          HG11      VAL  75   1.692  -8.221  -7.404
    5   HG11  VAL  75          HG12      VAL  75   3.095  -7.164  -7.346
    6   HG13  VAL  75          HG13      VAL  75   2.785  -8.277  -6.024
    7   HG22  VAL  75          HG21      VAL  75   3.932  -9.883  -9.806
    8   HG21  VAL  75          HG22      VAL  75   3.826  -8.133  -9.638
    9   HG23  VAL  75          HG23      VAL  75   2.363  -9.116  -9.572

  No H/Q in entry =           9
  In of MODEL   56
    1    H    GLU  76           H        GLU  76   5.086 -10.943  -5.762
    2    HA   GLU  76           HA       GLU  76   4.620  -9.578  -3.342
    3    HB2  GLU  76           HB2      GLU  76   4.451 -12.060  -3.623
    4    HB3  GLU  76           HB3      GLU  76   6.197 -12.141  -3.768
    5    HG2  GLU  76           HG2      GLU  76   6.449 -11.255  -1.483
    6    HG3  GLU  76           HG3      GLU  76   4.707 -11.141  -1.309

  No H/Q in entry =           6
  In of MODEL   56
    1    H    ALA  77           H        ALA  77   7.677 -10.506  -4.897
    2    HA   ALA  77           HA       ALA  77   9.368  -9.474  -2.877
    3    HB2  ALA  77           HB1      ALA  77  11.111  -9.475  -4.669
    4    HB3  ALA  77           HB2      ALA  77   9.852  -9.878  -5.837
    5    HB1  ALA  77           HB3      ALA  77  10.242 -11.004  -4.536

  No H/Q in entry =           5
  In of MODEL   56
    1    H    GLN  78           H        GLN  78   7.994  -8.048  -5.795
    2    HA   GLN  78           HA       GLN  78   9.363  -5.578  -5.688
    3    HB2  GLN  78           HB2      GLN  78   8.066  -6.483  -7.649
    4    HB3  GLN  78           HB3      GLN  78   6.584  -6.096  -6.778
    5    HG2  GLN  78           HG2      GLN  78   7.251  -3.730  -6.681
    6    HG3  GLN  78           HG3      GLN  78   8.738  -4.108  -7.549
    7   HE21  GLN  78          HE21      GLN  78   6.827  -2.275  -8.644
    8   HE22  GLN  78          HE22      GLN  78   6.139  -2.984 -10.024

  No H/Q in entry =           8
  In of MODEL   56
    1    H    LEU  79           H        LEU  79   6.332  -6.694  -4.266
    2    HA   LEU  79           HA       LEU  79   5.353  -4.279  -3.261
    3    HB2  LEU  79           HB2      LEU  79   4.023  -6.320  -3.208
    4    HB3  LEU  79           HB3      LEU  79   5.159  -7.068  -2.089
    5    HG   LEU  79           HG       LEU  79   4.614  -5.421  -0.365
    6   HD13  LEU  79          HD11      LEU  79   4.167  -3.404  -1.417
    7   HD12  LEU  79          HD12      LEU  79   2.536  -3.917  -0.983
    8   HD11  LEU  79          HD13      LEU  79   3.120  -4.144  -2.629
    9   HD23  LEU  79          HD21      LEU  79   2.024  -5.894  -0.282
   10   HD22  LEU  79          HD22      LEU  79   3.153  -7.242  -0.170
   11   HD21  LEU  79          HD23      LEU  79   2.346  -6.899  -1.697

  No H/Q in entry =          11
  In of MODEL   56
    1    H    HIS  80           H        HIS  80   7.513  -6.630  -1.670
    2    HA   HIS  80           HA       HIS  80   7.805  -5.089   0.699
    3    HB2  HIS  80           HB2      HIS  80   9.129  -7.464  -0.494
    4    HB3  HIS  80           HB3      HIS  80  10.042  -6.573   0.725
    5    HD1  HIS  80           HD1      HIS  80   9.539  -7.205   3.066
    6    HD2  HIS  80           HD2      HIS  80   6.324  -8.031   0.544
    7    HE1  HIS  80           HE1      HIS  80   7.754  -8.294   4.509
    8    HE2  HIS  80           HE2      HIS  80   5.788  -8.802   2.980

  No H/Q in entry =           8
  In of MODEL   56
    1    H    LEU  81           H        LEU  81   9.818  -5.382  -2.206
    2    HA   LEU  81           HA       LEU  81  11.873  -3.657  -1.321
    3    HB2  LEU  81           HB2      LEU  81  10.955  -4.443  -4.087
    4    HB3  LEU  81           HB3      LEU  81  12.382  -3.448  -3.792
    5    HG   LEU  81           HG       LEU  81  11.963  -6.166  -2.519
    6   HD12  LEU  81          HD11      LEU  81  13.780  -6.807  -4.262
    7   HD11  LEU  81          HD12      LEU  81  13.229  -5.379  -5.136
    8   HD13  LEU  81          HD13      LEU  81  12.106  -6.694  -4.802
    9   HD23  LEU  81          HD21      LEU  81  14.594  -5.872  -2.496
   10   HD22  LEU  81          HD22      LEU  81  13.614  -5.103  -1.249
   11   HD21  LEU  81          HD23      LEU  81  14.205  -4.156  -2.615

  No H/Q in entry =          11
  In of MODEL   56
    1    H    MET  82           H        MET  82   8.962  -2.997  -3.269
    2    HA   MET  82           HA       MET  82   9.527  -0.276  -3.768
    3    HB2  MET  82           HB2      MET  82   6.953  -1.848  -3.652
    4    HB3  MET  82           HB3      MET  82   6.969  -0.124  -4.017
    5    HG2  MET  82           HG2      MET  82   8.557  -2.211  -5.546
    6    HG3  MET  82           HG3      MET  82   6.997  -1.576  -6.064
    7    HE3  MET  82           HE1      MET  82   7.479   1.875  -7.235
    8    HE2  MET  82           HE2      MET  82   7.097   1.652  -5.530
    9    HE1  MET  82           HE3      MET  82   6.427   0.548  -6.727

  No H/Q in entry =           9
  In of MODEL   56
    1    H    THR  83           H        THR  83   7.712  -1.858  -1.169
    2    HA   THR  83           HA       THR  83   6.876   0.498   0.153
    3    HB   THR  83           HB       THR  83   6.721  -1.075   2.171
    4    HG1  THR  83           HG1      THR  83   7.462  -3.031   1.945
    5   HG22  THR  83          HG21      THR  83   5.060  -2.626   0.698
    6   HG21  THR  83          HG22      THR  83   5.302  -1.300  -0.434
    7   HG23  THR  83          HG23      THR  83   4.658  -0.979   1.177

  No H/Q in entry =           7
  In of MODEL   56
    1    H    SER  84           H        SER  84   9.680  -1.624   0.685
    2    HA   SER  84           HA       SER  84  10.744  -0.203   2.877
    3    HB2  SER  84           HB2      SER  84  11.988  -2.057   0.857
    4    HB3  SER  84           HB3      SER  84  12.937  -1.312   2.142
    5    HG   SER  84           HG       SER  84  10.646  -2.981   2.393

  No H/Q in entry =           5
  In of MODEL   56
    1    H    MET  85           H        MET  85  11.512   0.051  -0.609
    2    HA   MET  85           HA       MET  85  13.527   1.998  -0.351
    3    HB2  MET  85           HB2      MET  85  13.131   0.721  -2.417
    4    HB3  MET  85           HB3      MET  85  11.609   1.580  -2.652
    5    HG2  MET  85           HG2      MET  85  12.811   3.720  -2.782
    6    HG3  MET  85           HG3      MET  85  14.338   2.890  -2.497
    7    HE3  MET  85           HE1      MET  85  11.280   1.629  -5.048
    8    HE2  MET  85           HE2      MET  85  11.659   2.950  -6.151
    9    HE1  MET  85           HE3      MET  85  11.278   3.303  -4.470

  No H/Q in entry =           9
  In of MODEL   56
    1    H    LEU  86           H        LEU  86  10.042   2.364  -0.873
    2    HA   LEU  86           HA       LEU  86  10.005   5.178  -1.055
    3    HB2  LEU  86           HB2      LEU  86   8.148   3.535  -1.638
    4    HB3  LEU  86           HB3      LEU  86   7.811   3.449   0.091
    5    HG   LEU  86           HG       LEU  86   7.674   6.011   0.037
    6   HD11  LEU  86          HD11      LEU  86   8.455   5.567  -2.662
    7   HD13  LEU  86          HD12      LEU  86   8.031   7.099  -1.903
    8   HD12  LEU  86          HD13      LEU  86   6.789   6.147  -2.712
    9   HD23  LEU  86          HD21      LEU  86   5.534   4.678  -1.633
   10   HD22  LEU  86          HD22      LEU  86   5.351   5.940  -0.417
   11   HD21  LEU  86          HD23      LEU  86   5.733   4.292   0.077

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ALA  87           H        ALA  87   9.508   3.005   1.690
    2    HA   ALA  87           HA       ALA  87   8.971   4.924   3.656
    3    HB1  ALA  87           HB1      ALA  87   9.752   2.096   3.574
    4    HB3  ALA  87           HB2      ALA  87   8.631   2.920   4.655
    5    HB2  ALA  87           HB3      ALA  87  10.358   2.935   5.005

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ARG  88           H        ARG  88  12.044   3.470   2.687
    2    HA   ARG  88           HA       ARG  88  13.660   4.833   4.525
    3    HB2  ARG  88           HB2      ARG  88  14.315   2.853   3.124
    4    HB3  ARG  88           HB3      ARG  88  14.483   3.944   1.752
    5    HG2  ARG  88           HG2      ARG  88  15.962   5.244   3.703
    6    HG3  ARG  88           HG3      ARG  88  16.264   3.552   4.083
    7    HD2  ARG  88           HD2      ARG  88  17.535   3.243   2.241
    8    HD3  ARG  88           HD3      ARG  88  16.410   4.125   1.204
    9    HE   ARG  88           HE       ARG  88  18.811   5.166   2.259
   10   HH21  ARG  88          HH11      ARG  88  19.178   7.381   2.065
   11   HH22  ARG  88          HH12      ARG  88  17.838   8.466   1.917
   12   HH11  ARG  88          HH21      ARG  88  15.480   5.951   1.969
   13   HH12  ARG  88          HH22      ARG  88  15.743   7.653   1.838

  No H/Q in entry =          13
  In of MODEL   56
    1    H    GLU  89           H        GLU  89  12.707   5.739   1.198
    2    HA   GLU  89           HA       GLU  89  14.277   8.084   1.046
    3    HB2  GLU  89           HB2      GLU  89  13.130   7.054  -0.905
    4    HB3  GLU  89           HB3      GLU  89  11.588   7.610  -0.253
    5    HG2  GLU  89           HG2      GLU  89  12.313   9.941  -0.414
    6    HG3  GLU  89           HG3      GLU  89  13.914   9.434  -0.945

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LEU  90           H        LEU  90  10.939   7.607   2.165
    2    HA   LEU  90           HA       LEU  90  10.448  10.346   2.737
    3    HB2  LEU  90           HB2      LEU  90   9.226   7.784   3.761
    4    HB3  LEU  90           HB3      LEU  90   8.609   9.385   4.182
    5    HG   LEU  90           HG       LEU  90   9.028   8.500   1.314
    6   HD12  LEU  90          HD11      LEU  90   6.491   8.196   1.368
    7   HD11  LEU  90          HD12      LEU  90   6.640   8.185   3.126
    8   HD13  LEU  90          HD13      LEU  90   7.450   6.947   2.164
    9   HD22  LEU  90          HD21      LEU  90   8.756  10.811   1.239
   10   HD21  LEU  90          HD22      LEU  90   7.766  10.853   2.696
   11   HD23  LEU  90          HD23      LEU  90   7.068  10.305   1.172

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  91           H        ILE  91  11.679   7.653   4.665
    2    HA   ILE  91           HA       ILE  91  11.825   9.017   7.133
    3    HB   ILE  91           HB       ILE  91  13.360   6.664   6.015
    4   HG12  ILE  91          HG12      ILE  91  11.338   6.851   8.268
    5   HG13  ILE  91          HG13      ILE  91  10.870   6.574   6.591
    6   HG22  ILE  91          HG21      ILE  91  13.819   6.446   8.657
    7   HG21  ILE  91          HG22      ILE  91  13.760   8.205   8.555
    8   HG23  ILE  91          HG23      ILE  91  14.933   7.306   7.595
    9   HD13  ILE  91          HD11      ILE  91  11.853   4.462   6.524
   10   HD12  ILE  91          HD12      ILE  91  11.255   4.527   8.182
   11   HD11  ILE  91          HD13      ILE  91  12.961   4.824   7.849

  No H/Q in entry =          11
  In of MODEL   56
    1    H    THR  92           H        THR  92  14.049   8.826   4.388
    2    HA   THR  92           HA       THR  92  16.224  10.199   5.554
    3    HB   THR  92           HB       THR  92  15.246  10.082   2.691
    4    HG1  THR  92           HG1      THR  92  16.058   8.178   3.099
    5   HG22  THR  92          HG21      THR  92  17.823  10.748   2.405
    6   HG21  THR  92          HG22      THR  92  17.518  11.573   3.933
    7   HG23  THR  92          HG23      THR  92  16.556  11.969   2.510

  No H/Q in entry =           7
  In of MODEL   56
    1    H    GLU  93           H        GLU  93  13.353  11.379   3.816
    2    HA   GLU  93           HA       GLU  93  13.973  14.134   3.931
    3    HB2  GLU  93           HB2      GLU  93  11.256  12.787   3.937
    4    HB3  GLU  93           HB3      GLU  93  11.561  14.484   3.566
    5    HG2  GLU  93           HG2      GLU  93  12.883  12.229   2.043
    6    HG3  GLU  93           HG3      GLU  93  11.344  12.926   1.551

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LEU  94           H        LEU  94  12.203  11.995   6.138
    2    HA   LEU  94           HA       LEU  94  11.407  13.949   8.011
    3    HB2  LEU  94           HB2      LEU  94  11.954  10.989   8.287
    4    HB3  LEU  94           HB3      LEU  94  11.387  11.971   9.636
    5    HG   LEU  94           HG       LEU  94   9.912  12.036   7.002
    6   HD11  LEU  94          HD11      LEU  94   9.967   9.814   9.008
    7   HD13  LEU  94          HD12      LEU  94   9.671   9.756   7.272
    8   HD12  LEU  94          HD13      LEU  94   8.394  10.285   8.366
    9   HD23  LEU  94          HD21      LEU  94   7.991  12.454   8.597
   10   HD22  LEU  94          HD22      LEU  94   9.242  13.696   8.637
   11   HD21  LEU  94          HD23      LEU  94   9.164  12.480   9.911

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  95           H        ILE  95  14.363  11.992   7.784
    2    HA   ILE  95           HA       ILE  95  15.532  12.904  10.201
    3    HB   ILE  95           HB       ILE  95  16.768  11.822   7.657
    4   HG12  ILE  95          HG12      ILE  95  16.453  10.625  10.424
    5   HG13  ILE  95          HG13      ILE  95  15.288  10.377   9.125
    6   HG21  ILE  95          HG21      ILE  95  18.023  12.618  10.302
    7   HG23  ILE  95          HG22      ILE  95  18.496  13.141   8.684
    8   HG22  ILE  95          HG23      ILE  95  18.785  11.478   9.194
    9   HD13  ILE  95          HD11      ILE  95  16.759   9.084   7.867
   10   HD12  ILE  95          HD12      ILE  95  17.223   8.632   9.504
   11   HD11  ILE  95          HD13      ILE  95  18.190   9.802   8.608

  No H/Q in entry =          11
  In of MODEL   56
    1    H    GLU  96           H        GLU  96  15.708  14.135   6.867
    2    HA   GLU  96           HA       GLU  96  17.573  16.196   7.348
    3    HB2  GLU  96           HB2      GLU  96  16.909  15.539   5.087
    4    HB3  GLU  96           HB3      GLU  96  15.270  16.112   5.383
    5    HG2  GLU  96           HG2      GLU  96  15.858  18.236   4.842
    6    HG3  GLU  96           HG3      GLU  96  17.153  18.224   6.028

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LEU  97           H        LEU  97  14.059  16.042   7.768
    2    HA   LEU  97           HA       LEU  97  13.667  18.780   8.408
    3    HB2  LEU  97           HB2      LEU  97  12.123  16.269   9.018
    4    HB3  LEU  97           HB3      LEU  97  11.622  17.821   9.688
    5    HG   LEU  97           HG       LEU  97  12.110  17.400   6.724
    6   HD12  LEU  97          HD11      LEU  97   9.586  17.296   6.599
    7   HD11  LEU  97          HD12      LEU  97   9.572  17.096   8.349
    8   HD13  LEU  97          HD13      LEU  97  10.344  15.881   7.329
    9   HD23  LEU  97          HD21      LEU  97  10.391  19.380   6.751
   10   HD22  LEU  97          HD22      LEU  97  12.074  19.724   7.148
   11   HD21  LEU  97          HD23      LEU  97  10.880  19.565   8.435

  No H/Q in entry =          11
  In of MODEL   56
    1    H    HIS  98           H        HIS  98  14.456  15.947  10.406
    2    HA   HIS  98           HA       HIS  98  14.303  17.209  12.922
    3    HB2  HIS  98           HB2      HIS  98  16.033  14.935  11.925
    4    HB3  HIS  98           HB3      HIS  98  16.032  15.474  13.606
    5    HD1  HIS  98           HD1      HIS  98  13.825  13.865  11.008
    6    HD2  HIS  98           HD2      HIS  98  13.715  14.787  15.072
    7    HE1  HIS  98           HE1      HIS  98  11.786  12.690  11.955
    8    HE2  HIS  98           HE2      HIS  98  11.699  13.243  14.426

  No H/Q in entry =           8
  In of MODEL   56
    1    H    GLU  99           H        GLU  99  16.862  17.069  10.494
    2    HA   GLU  99           HA       GLU  99  18.856  18.382  12.028
    3    HB2  GLU  99           HB2      GLU  99  19.328  17.089   9.961
    4    HB3  GLU  99           HB3      GLU  99  18.533  18.352   9.017
    5    HG2  GLU  99           HG2      GLU  99  20.155  20.007   9.812
    6    HG3  GLU  99           HG3      GLU  99  20.920  18.797  10.838

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LYS 100           H        LYS 100  16.350  19.568   9.805
    2    HA   LYS 100           HA       LYS 100  17.174  22.298   9.951
    3    HB2  LYS 100           HB2      LYS 100  14.530  21.035   9.189
    4    HB3  LYS 100           HB3      LYS 100  14.847  22.770   9.099
    5    HG2  LYS 100           HG2      LYS 100  16.819  22.302   7.638
    6    HG3  LYS 100           HG3      LYS 100  16.388  20.589   7.655
    7    HD2  LYS 100           HD2      LYS 100  14.201  21.120   6.648
    8    HD3  LYS 100           HD3      LYS 100  14.615  22.835   6.639
    9    HE2  LYS 100           HE2      LYS 100  16.573  22.335   5.184
   10    HE3  LYS 100           HE3      LYS 100  16.090  20.635   5.150
   11    HZ1  LYS 100           HZ1      LYS 100  14.290  22.846   4.310
   12    HZ3  LYS 100           HZ2      LYS 100  14.090  21.178   4.047
   13    HZ2  LYS 100           HZ3      LYS 100  15.311  22.028   3.229

  No H/Q in entry =          13
  In of MODEL   56
    1    H    LEU 101           H        LEU 101  15.050  20.273  11.910
    2    HA   LEU 101           HA       LEU 101  13.901  22.353  13.485
    3    HB2  LEU 101           HB2      LEU 101  14.312  19.399  13.871
    4    HB3  LEU 101           HB3      LEU 101  13.782  20.385  15.230
    5    HG   LEU 101           HG       LEU 101  12.372  20.487  12.557
    6   HD12  LEU 101          HD11      LEU 101  10.694  18.940  13.821
    7   HD11  LEU 101          HD12      LEU 101  12.082  18.513  14.820
    8   HD13  LEU 101          HD13      LEU 101  12.117  18.206  13.083
    9   HD21  LEU 101          HD21      LEU 101  11.716  21.287  15.407
   10   HD23  LEU 101          HD22      LEU 101  10.456  21.074  14.194
   11   HD22  LEU 101          HD23      LEU 101  11.704  22.297  13.959

  No H/Q in entry =          11
  In of MODEL   56
    1    H    LYS 102           H        LYS 102  17.043  21.713  13.057
    2    HA   LYS 102           HA       LYS 102  18.895  22.565  14.135
    3    HB2  LYS 102           HB2      LYS 102  17.094  24.098  15.263
    4    HB3  LYS 102           HB3      LYS 102  17.287  23.034  16.641
    5    HG2  LYS 102           HG2      LYS 102  19.203  25.025  15.476
    6    HG3  LYS 102           HG3      LYS 102  18.814  24.715  17.154
    7    HD2  LYS 102           HD2      LYS 102  20.465  22.785  15.473
    8    HD3  LYS 102           HD3      LYS 102  21.166  24.100  16.408
    9    HE2  LYS 102           HE2      LYS 102  20.739  21.556  17.375
   10    HE3  LYS 102           HE3      LYS 102  20.969  22.995  18.367
   11    HZ2  LYS 102           HZ1      LYS 102  18.986  21.732  18.980
   12    HZ1  LYS 102           HZ2      LYS 102  18.348  21.968  17.429
   13    HZ3  LYS 102           HZ3      LYS 102  18.590  23.296  18.456

  No H/Q in entry =          13
  In of MODEL   56
    1    H    ALA 103           H        ALA 103  16.801  20.981  16.551
    2    HA   ALA 103           HA       ALA 103  18.511  19.752  18.211
    3    HB2  ALA 103           HB1      ALA 103  16.906  17.761  18.201
    4    HB1  ALA 103           HB2      ALA 103  16.022  18.624  16.941
    5    HB3  ALA 103           HB3      ALA 103  16.204  19.343  18.540

  No H/Q in entry =           5
  In of MODEL   56
    1    H1   ALA   1           H3       ALA   1  -1.592  -6.892 -21.463
    2    H2   ALA   1           H2       ALA   1  -2.403  -8.319 -21.013
    3    H3   ALA   1           H1       ALA   1  -0.794  -8.386 -21.563
    4    HA   ALA   1           HA       ALA   1  -1.628  -8.846 -23.562
    5    HB1  ALA   1           HB1      ALA   1  -3.774  -9.541 -23.094
    6    HB2  ALA   1           HB2      ALA   1  -4.194  -8.026 -23.893
    7    HB3  ALA   1           HB3      ALA   1  -4.139  -8.107 -22.134

  No H/Q in entry =           7
  In of MODEL   56
    1    H    GLU   2           H        GLU   2  -2.439  -7.646 -25.553
    2    HA   GLU   2           HA       GLU   2  -1.016  -5.648 -26.427
    3    HB2  GLU   2           HB2      GLU   2  -4.023  -5.682 -26.753
    4    HB3  GLU   2           HB3      GLU   2  -2.890  -4.831 -27.799
    5    HG2  GLU   2           HG2      GLU   2  -2.404  -6.726 -28.953
    6    HG3  GLU   2           HG3      GLU   2  -2.121  -7.635 -27.474

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLU   3           H        GLU   3  -4.165  -4.357 -25.535
    2    HA   GLU   3           HA       GLU   3  -3.093  -1.812 -24.903
    3    HB2  GLU   3           HB2      GLU   3  -5.796  -3.098 -24.579
    4    HB3  GLU   3           HB3      GLU   3  -5.482  -1.486 -23.932
    5    HG2  GLU   3           HG2      GLU   3  -5.109  -0.562 -26.057
    6    HG3  GLU   3           HG3      GLU   3  -4.729  -2.122 -26.780

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LEU   4           H        LEU   4  -4.715  -4.154 -22.729
    2    HA   LEU   4           HA       LEU   4  -4.344  -2.930 -20.336
    3    HB2  LEU   4           HB2      LEU   4  -3.832  -5.877 -20.805
    4    HB3  LEU   4           HB3      LEU   4  -4.234  -5.127 -19.262
    5    HG   LEU   4           HG       LEU   4  -6.000  -5.181 -21.731
    6   HD13  LEU   4          HD11      LEU   4  -7.215  -6.885 -20.738
    7   HD12  LEU   4          HD12      LEU   4  -6.730  -6.431 -19.105
    8   HD11  LEU   4          HD13      LEU   4  -5.600  -7.287 -20.153
    9   HD23  LEU   4          HD21      LEU   4  -7.681  -4.351 -19.868
   10   HD22  LEU   4          HD22      LEU   4  -6.628  -3.191 -20.676
   11   HD21  LEU   4          HD23      LEU   4  -6.213  -3.787 -19.069

  No H/Q in entry =          11
  In of MODEL   56
    1    H    GLU   5           H        GLU   5  -1.861  -4.800 -22.060
    2    HA   GLU   5           HA       GLU   5   0.119  -4.539 -20.018
    3    HB2  GLU   5           HB2      GLU   5   0.181  -6.312 -21.758
    4    HB3  GLU   5           HB3      GLU   5   0.487  -5.076 -22.979
    5    HG2  GLU   5           HG2      GLU   5   2.563  -4.436 -21.847
    6    HG3  GLU   5           HG3      GLU   5   2.254  -5.614 -20.573

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLU   6           H        GLU   6  -0.488  -2.818 -23.064
    2    HA   GLU   6           HA       GLU   6   1.701  -1.010 -22.789
    3    HB2  GLU   6           HB2      GLU   6   0.593  -1.468 -24.957
    4    HB3  GLU   6           HB3      GLU   6  -0.870  -0.687 -24.357
    5    HG2  GLU   6           HG2      GLU   6   0.359   1.418 -24.050
    6    HG3  GLU   6           HG3      GLU   6   1.841   0.644 -24.606

  No H/Q in entry =           6
  In of MODEL   56
    1    H    VAL   7           H        VAL   7  -1.641  -1.045 -21.754
    2    HA   VAL   7           HA       VAL   7  -1.835   1.670 -20.918
    3    HB   VAL   7           HB       VAL   7  -3.327  -0.832 -20.086
    4   HG11  VAL   7          HG11      VAL   7  -3.673   2.061 -19.273
    5   HG13  VAL   7          HG12      VAL   7  -3.592   0.635 -18.238
    6   HG12  VAL   7          HG13      VAL   7  -5.018   0.920 -19.234
    7   HG21  VAL   7          HG21      VAL   7  -3.465   0.247 -22.475
    8   HG23  VAL   7          HG22      VAL   7  -4.399   1.506 -21.665
    9   HG22  VAL   7          HG23      VAL   7  -4.963  -0.165 -21.641

  No H/Q in entry =           9
  In of MODEL   56
    1    H    VAL   8           H        VAL   8  -0.885  -1.326 -19.273
    2    HA   VAL   8           HA       VAL   8  -0.562  -0.251 -16.676
    3    HB   VAL   8           HB       VAL   8   0.819  -2.583 -18.029
    4   HG13  VAL   8          HG11      VAL   8   2.247  -2.001 -16.236
    5   HG12  VAL   8          HG12      VAL   8   1.195  -3.240 -15.553
    6   HG11  VAL   8          HG13      VAL   8   0.899  -1.540 -15.196
    7   HG22  VAL   8          HG21      VAL   8  -0.972  -3.875 -17.353
    8   HG21  VAL   8          HG22      VAL   8  -1.827  -2.335 -17.339
    9   HG23  VAL   8          HG23      VAL   8  -1.167  -2.986 -15.843

  No H/Q in entry =           9
  In of MODEL   56
    1    H    MET   9           H        MET   9   1.691  -0.576 -19.417
    2    HA   MET   9           HA       MET   9   3.985   0.440 -18.149
    3    HB2  MET   9           HB2      MET   9   3.048   0.498 -21.018
    4    HB3  MET   9           HB3      MET   9   4.581   1.217 -20.527
    5    HG2  MET   9           HG2      MET   9   5.313  -0.937 -19.595
    6    HG3  MET   9           HG3      MET   9   3.767  -1.664 -20.037
    7    HE3  MET   9           HE1      MET   9   6.975   0.072 -22.729
    8    HE2  MET   9           HE2      MET   9   7.484  -1.106 -21.521
    9    HE1  MET   9           HE3      MET   9   6.637   0.354 -21.017

  No H/Q in entry =           9
  In of MODEL   56
    1    H    GLY  10           H        GLY  10   1.324   2.074 -19.833
    2    HA3  GLY  10           HA2      GLY  10   2.318   4.716 -19.585
    3    HA2  GLY  10           HA3      GLY  10   0.624   4.276 -19.795

  No H/Q in entry =           3
  In of MODEL   56
    1    H    LEU  11           H        LEU  11   0.200   2.753 -17.510
    2    HA   LEU  11           HA       LEU  11  -0.311   4.735 -15.551
    3    HB2  LEU  11           HB2      LEU  11  -0.281   1.719 -15.396
    4    HB3  LEU  11           HB3      LEU  11  -0.781   2.747 -14.054
    5    HG   LEU  11           HG       LEU  11  -2.011   2.877 -16.821
    6   HD13  LEU  11          HD11      LEU  11  -2.623   0.741 -16.068
    7   HD12  LEU  11          HD12      LEU  11  -3.962   1.749 -15.525
    8   HD11  LEU  11          HD13      LEU  11  -2.715   1.253 -14.382
    9   HD22  LEU  11          HD21      LEU  11  -2.580   4.900 -15.815
   10   HD21  LEU  11          HD22      LEU  11  -2.517   4.232 -14.184
   11   HD23  LEU  11          HD23      LEU  11  -3.894   3.883 -15.230

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  12           H        ILE  12   2.202   2.238 -15.788
    2    HA   ILE  12           HA       ILE  12   3.408   2.760 -13.282
    3    HB   ILE  12           HB       ILE  12   4.655   1.705 -15.843
    4   HG12  ILE  12          HG12      ILE  12   2.626   0.499 -14.697
    5   HG13  ILE  12          HG13      ILE  12   4.013  -0.454 -15.185
    6   HG21  ILE  12          HG21      ILE  12   5.625   1.663 -12.966
    7   HG23  ILE  12          HG22      ILE  12   6.421   2.409 -14.351
    8   HG22  ILE  12          HG23      ILE  12   6.306   0.654 -14.241
    9   HD11  ILE  12          HD11      ILE  12   3.577   0.656 -12.401
   10   HD13  ILE  12          HD12      ILE  12   4.836  -0.470 -12.905
   11   HD12  ILE  12          HD13      ILE  12   3.160  -0.976 -12.892

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  13           H        ILE  13   4.032   4.017 -16.537
    2    HA   ILE  13           HA       ILE  13   6.189   5.711 -15.806
    3    HB   ILE  13           HB       ILE  13   4.164   5.816 -18.057
    4   HG12  ILE  13          HG12      ILE  13   5.982   3.956 -17.772
    5   HG13  ILE  13          HG13      ILE  13   5.744   4.697 -19.351
    6   HG22  ILE  13          HG21      ILE  13   5.971   7.362 -19.115
    7   HG21  ILE  13          HG22      ILE  13   6.495   7.646 -17.459
    8   HG23  ILE  13          HG23      ILE  13   4.855   8.070 -17.946
    9   HD13  ILE  13          HD11      ILE  13   7.695   6.093 -19.084
   10   HD12  ILE  13          HD12      ILE  13   8.166   4.469 -18.593
   11   HD11  ILE  13          HD13      ILE  13   7.812   5.686 -17.373

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ASN  14           H        ASN  14   2.689   6.249 -16.082
    2    HA   ASN  14           HA       ASN  14   2.679   8.995 -15.444
    3    HB2  ASN  14           HB2      ASN  14   0.768   7.377 -16.279
    4    HB3  ASN  14           HB3      ASN  14   0.440   7.201 -14.559
    5   HD21  ASN  14          HD21      ASN  14  -1.562   8.383 -15.996
    6   HD22  ASN  14          HD22      ASN  14  -1.604  10.057 -15.728

  No H/Q in entry =           6
  In of MODEL   56
    1    H    SER  15           H        SER  15   2.344   6.121 -13.369
    2    HA   SER  15           HA       SER  15   2.049   7.494 -10.921
    3    HB2  SER  15           HB2      SER  15   2.570   5.401  -9.871
    4    HB3  SER  15           HB3      SER  15   1.740   4.992 -11.367
    5    HG   SER  15           HG       SER  15   4.104   5.091 -12.175

  No H/Q in entry =           5
  In of MODEL   56
    1    H    GLY  16           H        GLY  16   4.915   6.363 -12.674
    2    HA3  GLY  16           HA2      GLY  16   6.845   7.096 -10.739
    3    HA2  GLY  16           HA3      GLY  16   7.149   6.890 -12.462

  No H/Q in entry =           3
  In of MODEL   56
    1    H    GLN  17           H        GLN  17   5.485   8.868 -13.528
    2    HA   GLN  17           HA       GLN  17   7.089  11.191 -13.215
    3    HB2  GLN  17           HB2      GLN  17   4.338  10.793 -14.422
    4    HB3  GLN  17           HB3      GLN  17   5.212  12.324 -14.490
    5    HG2  GLN  17           HG2      GLN  17   6.307   9.693 -15.522
    6    HG3  GLN  17           HG3      GLN  17   5.533  10.911 -16.534
    7   HE21  GLN  17          HE21      GLN  17   6.597  13.166 -16.439
    8   HE22  GLN  17          HE22      GLN  17   8.283  13.223 -16.252

  No H/Q in entry =           8
  In of MODEL   56
    1    H    ALA  18           H        ALA  18   3.974  10.208 -11.873
    2    HA   ALA  18           HA       ALA  18   3.273  12.605 -10.608
    3    HB1  ALA  18           HB1      ALA  18   2.117  10.161 -10.834
    4    HB2  ALA  18           HB2      ALA  18   1.580  11.387  -9.687
    5    HB3  ALA  18           HB3      ALA  18   2.655  10.092  -9.156

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ARG  19           H        ARG  19   5.114   9.821  -9.326
    2    HA   ARG  19           HA       ARG  19   5.654  10.972  -6.802
    3    HB2  ARG  19           HB2      ARG  19   6.043   8.565  -7.329
    4    HB3  ARG  19           HB3      ARG  19   7.406   9.036  -8.347
    5    HG2  ARG  19           HG2      ARG  19   8.532  10.063  -6.422
    6    HG3  ARG  19           HG3      ARG  19   7.150   9.690  -5.394
    7    HD2  ARG  19           HD2      ARG  19   8.894   8.035  -5.033
    8    HD3  ARG  19           HD3      ARG  19   7.513   7.269  -5.822
    9    HE   ARG  19           HE       ARG  19   9.231   8.070  -7.865
   10   HH21  ARG  19          HH11      ARG  19  10.778   6.648  -8.712
   11   HH22  ARG  19          HH12      ARG  19  11.307   5.294  -7.776
   12   HH11  ARG  19          HH21      ARG  19   9.275   6.038  -5.087
   13   HH12  ARG  19          HH22      ARG  19  10.453   4.948  -5.722

  No H/Q in entry =          13
  In of MODEL   56
    1    H    SER  20           H        SER  20   7.478  10.983  -9.847
    2    HA   SER  20           HA       SER  20   9.735  12.375  -9.018
    3    HB2  SER  20           HB2      SER  20   9.766  11.500 -11.222
    4    HB3  SER  20           HB3      SER  20   8.273  12.329 -11.652
    5    HG   SER  20           HG       SER  20  10.853  13.403 -11.219

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LEU  21           H        LEU  21   6.652  13.676 -10.221
    2    HA   LEU  21           HA       LEU  21   7.350  16.415  -9.995
    3    HB2  LEU  21           HB2      LEU  21   4.667  15.019  -9.920
    4    HB3  LEU  21           HB3      LEU  21   4.852  16.771  -9.925
    5    HG   LEU  21           HG       LEU  21   6.029  14.957 -12.053
    6   HD13  LEU  21          HD11      LEU  21   4.147  15.600 -13.462
    7   HD12  LEU  21          HD12      LEU  21   3.490  16.612 -12.175
    8   HD11  LEU  21          HD13      LEU  21   3.532  14.861 -11.982
    9   HD21  LEU  21          HD21      LEU  21   5.864  17.929 -11.619
   10   HD23  LEU  21          HD22      LEU  21   5.825  17.327 -13.273
   11   HD22  LEU  21          HD23      LEU  21   7.208  16.981 -12.247

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ALA  22           H        ALA  22   5.810  14.140  -7.751
    2    HA   ALA  22           HA       ALA  22   5.220  15.953  -5.684
    3    HB3  ALA  22           HB1      ALA  22   4.437  13.568  -5.850
    4    HB2  ALA  22           HB2      ALA  22   5.026  14.034  -4.254
    5    HB1  ALA  22           HB3      ALA  22   6.042  13.066  -5.323

  No H/Q in entry =           5
  In of MODEL   56
    1    H    TYR  23           H        TYR  23   8.136  13.899  -6.117
    2    HA   TYR  23           HA       TYR  23   9.524  14.905  -3.861
    3    HB2  TYR  23           HB2      TYR  23  10.295  12.890  -5.017
    4    HB3  TYR  23           HB3      TYR  23  10.619  13.826  -6.477
    5    HD1  TYR  23           HD1      TYR  23  11.577  13.473  -2.887
    6    HD2  TYR  23           HD2      TYR  23  12.661  14.987  -6.759
    7    HE1  TYR  23           HE1      TYR  23  13.840  14.031  -2.035
    8    HE2  TYR  23           HE2      TYR  23  14.923  15.546  -5.907
    9    HH   TYR  23           HH       TYR  23  15.885  14.731  -2.578

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ALA  24           H        ALA  24   9.358  16.014  -7.227
    2    HA   ALA  24           HA       ALA  24  11.272  18.083  -6.976
    3    HB2  ALA  24           HB1      ALA  24  10.834  18.149  -9.186
    4    HB3  ALA  24           HB2      ALA  24   9.285  18.912  -8.830
    5    HB1  ALA  24           HB3      ALA  24   9.395  17.158  -8.960

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ALA  25           H        ALA  25   7.790  17.928  -6.363
    2    HA   ALA  25           HA       ALA  25   7.332  20.650  -5.794
    3    HB1  ALA  25           HB1      ALA  25   5.654  18.665  -5.999
    4    HB2  ALA  25           HB2      ALA  25   5.295  19.957  -4.852
    5    HB3  ALA  25           HB3      ALA  25   5.970  18.430  -4.280

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LEU  26           H        LEU  26   8.374  17.961  -3.743
    2    HA   LEU  26           HA       LEU  26   8.485  19.391  -1.305
    3    HB2  LEU  26           HB2      LEU  26   8.561  16.974  -1.300
    4    HB3  LEU  26           HB3      LEU  26  10.033  16.970  -2.267
    5    HG   LEU  26           HG       LEU  26  11.253  18.078  -0.424
    6   HD12  LEU  26          HD11      LEU  26  10.022  18.095   1.833
    7   HD11  LEU  26          HD12      LEU  26   8.535  17.969   0.895
    8   HD13  LEU  26          HD13      LEU  26   9.591  19.367   0.688
    9   HD21  LEU  26          HD21      LEU  26   9.698  15.622   0.445
   10   HD23  LEU  26          HD22      LEU  26  11.216  16.172   1.145
   11   HD22  LEU  26          HD23      LEU  26  11.170  15.614  -0.525

  No H/Q in entry =          11
  In of MODEL   56
    1    H    LYS  27           H        LYS  27  10.902  18.800  -3.825
    2    HA   LYS  27           HA       LYS  27  13.093  20.024  -2.592
    3    HB2  LYS  27           HB2      LYS  27  13.189  18.676  -4.682
    4    HB3  LYS  27           HB3      LYS  27  12.436  20.014  -5.549
    5    HG2  LYS  27           HG2      LYS  27  14.311  21.485  -4.967
    6    HG3  LYS  27           HG3      LYS  27  15.060  20.187  -4.029
    7    HD2  LYS  27           HD2      LYS  27  15.197  18.799  -6.083
    8    HD3  LYS  27           HD3      LYS  27  14.494  20.122  -7.013
    9    HE2  LYS  27           HE2      LYS  27  16.391  21.574  -6.396
   10    HE3  LYS  27           HE3      LYS  27  17.098  20.255  -5.457
   11    HZ3  LYS  27           HZ1      LYS  27  18.093  20.348  -7.641
   12    HZ2  LYS  27           HZ2      LYS  27  16.567  20.240  -8.385
   13    HZ1  LYS  27           HZ3      LYS  27  17.179  18.925  -7.500

  No H/Q in entry =          13
  In of MODEL   56
    1    H    GLN  28           H        GLN  28  10.485  21.425  -4.546
    2    HA   GLN  28           HA       GLN  28  11.464  24.070  -4.697
    3    HB2  GLN  28           HB2      GLN  28   8.759  22.797  -4.851
    4    HB3  GLN  28           HB3      GLN  28   8.856  24.549  -4.684
    5    HG2  GLN  28           HG2      GLN  28   8.812  23.656  -7.078
    6    HG3  GLN  28           HG3      GLN  28  10.122  24.770  -6.693
    7   HE21  GLN  28          HE21      GLN  28  12.286  23.746  -6.195
    8   HE22  GLN  28          HE22      GLN  28  12.659  22.245  -6.893

  No H/Q in entry =           8
  In of MODEL   56
    1    H    ALA  29           H        ALA  29   9.515  22.392  -2.265
    2    HA   ALA  29           HA       ALA  29   8.978  24.587  -0.584
    3    HB2  ALA  29           HB1      ALA  29   8.234  23.024   0.983
    4    HB1  ALA  29           HB2      ALA  29   9.448  21.831   0.520
    5    HB3  ALA  29           HB3      ALA  29   8.067  22.134  -0.531

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LYS  30           H        LYS  30  11.692  22.301  -0.648
    2    HA   LYS  30           HA       LYS  30  13.012  23.246   1.657
    3    HB2  LYS  30           HB2      LYS  30  14.105  21.953  -0.851
    4    HB3  LYS  30           HB3      LYS  30  15.087  22.305   0.573
    5    HG2  LYS  30           HG2      LYS  30  13.521  20.933   1.949
    6    HG3  LYS  30           HG3      LYS  30  12.636  20.517   0.478
    7    HD2  LYS  30           HD2      LYS  30  14.676  19.517  -0.479
    8    HD3  LYS  30           HD3      LYS  30  15.580  19.946   0.974
    9    HE2  LYS  30           HE2      LYS  30  14.063  18.525   2.326
   10    HE3  LYS  30           HE3      LYS  30  13.189  18.076   0.856
   11    HZ2  LYS  30           HZ1      LYS  30  14.968  16.485   1.620
   12    HZ1  LYS  30           HZ2      LYS  30  16.114  17.665   1.171
   13    HZ3  LYS  30           HZ3      LYS  30  15.076  16.988   0.004

  No H/Q in entry =          13
  In of MODEL   56
    1    H    GLN  31           H        GLN  31  12.918  24.452  -1.639
    2    HA   GLN  31           HA       GLN  31  15.082  26.330  -1.214
    3    HB2  GLN  31           HB2      GLN  31  13.044  26.391  -3.442
    4    HB3  GLN  31           HB3      GLN  31  14.669  27.076  -3.440
    5    HG2  GLN  31           HG2      GLN  31  15.112  24.377  -2.864
    6    HG3  GLN  31           HG3      GLN  31  13.810  24.331  -4.045
    7   HE21  GLN  31          HE21      GLN  31  16.649  23.519  -4.443
    8   HE22  GLN  31          HE22      GLN  31  17.230  24.489  -5.708

  No H/Q in entry =           8
  In of MODEL   56
    1    H    GLY  32           H        GLY  32  12.005  26.169  -0.074
    2    HA3  GLY  32           HA2      GLY  32  10.856  27.745   1.197
    3    HA2  GLY  32           HA3      GLY  32  11.991  28.972   0.649

  No H/Q in entry =           3
  In of MODEL   56
    1    H    ASP  33           H        ASP  33  10.619  27.078  -1.846
    2    HA   ASP  33           HA       ASP  33   8.971  29.362  -2.705
    3    HB2  ASP  33           HB2      ASP  33  10.051  26.935  -4.145
    4    HB3  ASP  33           HB3      ASP  33   8.909  28.058  -4.878

  No H/Q in entry =           4
  In of MODEL   56
    1    H    PHE  34           H        PHE  34   7.277  28.897  -1.144
    2    HA   PHE  34           HA       PHE  34   5.881  26.434  -1.052
    3    HB2  PHE  34           HB2      PHE  34   4.937  29.228  -0.374
    4    HB3  PHE  34           HB3      PHE  34   4.077  27.743   0.036
    5    HD1  PHE  34           HD1      PHE  34   6.341  30.126   1.255
    6    HD2  PHE  34           HD2      PHE  34   5.633  25.890   1.200
    7    HE1  PHE  34           HE1      PHE  34   7.726  29.866   3.294
    8    HE2  PHE  34           HE2      PHE  34   7.020  25.634   3.237
    9    HZ   PHE  34           HZ       PHE  34   8.061  27.623   4.284

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ALA  35           H        ALA  35   5.473  29.301  -3.063
    2    HA   ALA  35           HA       ALA  35   2.920  28.704  -4.093
    3    HB1  ALA  35           HB1      ALA  35   3.985  30.089  -6.129
    4    HB3  ALA  35           HB2      ALA  35   5.203  30.442  -4.903
    5    HB2  ALA  35           HB3      ALA  35   3.514  30.862  -4.615

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ALA  36           H        ALA  36   6.146  28.009  -5.441
    2    HA   ALA  36           HA       ALA  36   5.153  26.587  -7.687
    3    HB3  ALA  36           HB1      ALA  36   7.313  26.697  -8.298
    4    HB2  ALA  36           HB2      ALA  36   7.785  25.665  -6.947
    5    HB1  ALA  36           HB3      ALA  36   7.691  27.413  -6.732

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ALA  37           H        ALA  37   6.096  25.586  -4.430
    2    HA   ALA  37           HA       ALA  37   6.020  22.798  -4.859
    3    HB2  ALA  37           HB1      ALA  37   5.766  24.591  -2.482
    4    HB1  ALA  37           HB2      ALA  37   6.891  23.265  -2.772
    5    HB3  ALA  37           HB3      ALA  37   5.226  22.923  -2.304

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LYS  38           H        LYS  38   3.499  25.023  -3.696
    2    HA   LYS  38           HA       LYS  38   1.387  23.223  -3.478
    3    HB2  LYS  38           HB2      LYS  38   1.756  25.977  -3.226
    4    HB3  LYS  38           HB3      LYS  38   0.559  25.838  -4.507
    5    HG2  LYS  38           HG2      LYS  38  -0.902  24.523  -3.067
    6    HG3  LYS  38           HG3      LYS  38   0.339  24.455  -1.809
    7    HD2  LYS  38           HD2      LYS  38   0.167  26.793  -1.361
    8    HD3  LYS  38           HD3      LYS  38  -0.740  27.088  -2.846
    9    HE2  LYS  38           HE2      LYS  38  -2.247  27.132  -0.909
   10    HE3  LYS  38           HE3      LYS  38  -2.628  25.758  -1.952
   11    HZ3  LYS  38           HZ1      LYS  38  -1.915  24.282  -0.417
   12    HZ2  LYS  38           HZ2      LYS  38  -2.259  25.542   0.671
   13    HZ1  LYS  38           HZ3      LYS  38  -0.665  25.281   0.149

  No H/Q in entry =          13
  In of MODEL   56
    1    H    ALA  39           H        ALA  39   2.385  25.119  -6.324
    2    HA   ALA  39           HA       ALA  39   0.307  24.265  -8.031
    3    HB2  ALA  39           HB1      ALA  39   3.049  24.896  -9.080
    4    HB1  ALA  39           HB2      ALA  39   2.089  26.163  -8.316
    5    HB3  ALA  39           HB3      ALA  39   1.474  25.330  -9.744

  No H/Q in entry =           5
  In of MODEL   56
    1    H    MET  40           H        MET  40   3.535  22.946  -7.446
    2    HA   MET  40           HA       MET  40   3.428  20.926  -9.437
    3    HB2  MET  40           HB2      MET  40   5.036  21.140  -6.886
    4    HB3  MET  40           HB3      MET  40   5.281  19.882  -8.100
    5    HG2  MET  40           HG2      MET  40   5.359  22.838  -8.765
    6    HG3  MET  40           HG3      MET  40   6.799  21.926  -8.313
    7    HE3  MET  40           HE1      MET  40   7.662  19.705 -11.120
    8    HE2  MET  40           HE2      MET  40   7.093  19.389  -9.483
    9    HE1  MET  40           HE3      MET  40   8.198  20.730  -9.781

  No H/Q in entry =           9
  In of MODEL   56
    1    H    MET  41           H        MET  41   2.507  20.974  -6.015
    2    HA   MET  41           HA       MET  41   1.957  18.213  -5.739
    3    HB2  MET  41           HB2      MET  41   0.636  20.579  -4.390
    4    HB3  MET  41           HB3      MET  41   0.469  18.902  -3.883
    5    HG2  MET  41           HG2      MET  41   3.181  19.108  -3.915
    6    HG3  MET  41           HG3      MET  41   2.750  20.769  -3.519
    7    HE2  MET  41           HE1      MET  41  -0.301  19.535  -1.800
    8    HE1  MET  41           HE2      MET  41   0.526  21.043  -2.176
    9    HE3  MET  41           HE3      MET  41   0.460  20.473  -0.508

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ASP  42           H        ASP  42  -0.063  20.950  -6.716
    2    HA   ASP  42           HA       ASP  42  -2.512  19.604  -6.858
    3    HB2  ASP  42           HB2      ASP  42  -1.789  22.170  -7.113
    4    HB3  ASP  42           HB3      ASP  42  -1.939  21.776  -8.822

  No H/Q in entry =           4
  In of MODEL   56
    1    H    GLN  43           H        GLN  43  -0.063  20.181  -9.355
    2    HA   GLN  43           HA       GLN  43  -1.453  18.870 -11.447
    3    HB2  GLN  43           HB2      GLN  43   1.507  19.368 -11.060
    4    HB3  GLN  43           HB3      GLN  43   0.793  18.732 -12.544
    5    HG2  GLN  43           HG2      GLN  43  -0.707  20.769 -12.588
    6    HG3  GLN  43           HG3      GLN  43   0.247  21.419 -11.258
    7   HE21  GLN  43          HE21      GLN  43   0.422  23.038 -13.344
    8   HE22  GLN  43          HE22      GLN  43   1.838  22.809 -14.248

  No H/Q in entry =           8
  In of MODEL   56
    1    H    SER  44           H        SER  44   0.886  17.715  -9.052
    2    HA   SER  44           HA       SER  44   1.208  15.107 -10.077
    3    HB2  SER  44           HB2      SER  44   2.106  16.541  -7.838
    4    HB3  SER  44           HB3      SER  44   1.235  15.162  -7.169
    5    HG   SER  44           HG       SER  44   3.343  14.530  -7.592

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ARG  45           H        ARG  45  -1.109  16.439  -7.743
    2    HA   ARG  45           HA       ARG  45  -2.510  14.086  -7.111
    3    HB2  ARG  45           HB2      ARG  45  -2.699  16.255  -5.920
    4    HB3  ARG  45           HB3      ARG  45  -3.548  16.927  -7.308
    5    HG2  ARG  45           HG2      ARG  45  -5.325  15.211  -7.028
    6    HG3  ARG  45           HG3      ARG  45  -4.487  14.594  -5.604
    7    HD2  ARG  45           HD2      ARG  45  -4.683  16.862  -4.548
    8    HD3  ARG  45           HD3      ARG  45  -5.664  17.387  -5.932
    9    HE   ARG  45           HE       ARG  45  -6.789  15.017  -4.895
   10   HH21  ARG  45          HH11      ARG  45  -8.627  15.103  -3.628
   11   HH22  ARG  45          HH12      ARG  45  -9.016  16.544  -2.759
   12   HH11  ARG  45          HH21      ARG  45  -6.228  18.261  -3.869
   13   HH12  ARG  45          HH22      ARG  45  -7.652  18.333  -2.894

  No H/Q in entry =          13
  In of MODEL   56
    1    H    MET  46           H        MET  46  -3.076  16.493  -9.663
    2    HA   MET  46           HA       MET  46  -5.420  15.333 -10.729
    3    HB2  MET  46           HB2      MET  46  -3.307  17.151 -11.896
    4    HB3  MET  46           HB3      MET  46  -4.685  16.599 -12.852
    5    HG2  MET  46           HG2      MET  46  -6.238  17.544 -11.221
    6    HG3  MET  46           HG3      MET  46  -4.901  18.017 -10.179
    7    HE1  MET  46           HE1      MET  46  -6.598  18.123 -13.404
    8    HE3  MET  46           HE2      MET  46  -5.186  18.581 -14.351
    9    HE2  MET  46           HE3      MET  46  -6.451  19.768 -14.038

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ALA  47           H        ALA  47  -1.992  14.836 -11.480
    2    HA   ALA  47           HA       ALA  47  -2.342  13.111 -13.691
    3    HB3  ALA  47           HB1      ALA  47  -0.160  13.989 -13.335
    4    HB2  ALA  47           HB2      ALA  47  -0.029  12.260 -13.001
    5    HB1  ALA  47           HB3      ALA  47  -0.118  13.412 -11.668

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LEU  48           H        LEU  48  -2.082  12.473 -10.217
    2    HA   LEU  48           HA       LEU  48  -2.191   9.634 -10.376
    3    HB2  LEU  48           HB2      LEU  48  -2.950  11.556  -8.163
    4    HB3  LEU  48           HB3      LEU  48  -2.865   9.805  -7.962
    5    HG   LEU  48           HG       LEU  48  -0.556  11.493  -8.955
    6   HD13  LEU  48          HD11      LEU  48  -0.839  12.264  -6.765
    7   HD12  LEU  48          HD12      LEU  48   0.317  10.951  -6.564
    8   HD11  LEU  48          HD13      LEU  48  -1.383  10.697  -6.170
    9   HD22  LEU  48          HD21      LEU  48  -0.067   9.305  -9.595
   10   HD21  LEU  48          HD22      LEU  48  -0.943   8.594  -8.240
   11   HD23  LEU  48          HD23      LEU  48   0.633   9.339  -7.977

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ASN  49           H        ASN  49  -4.642  12.139  -9.979
    2    HA   ASN  49           HA       ASN  49  -6.838  10.485  -9.444
    3    HB2  ASN  49           HB2      ASN  49  -6.875  12.912  -9.124
    4    HB3  ASN  49           HB3      ASN  49  -6.725  13.165 -10.858
    5   HD21  ASN  49          HD21      ASN  49  -8.921  14.240  -9.456
    6   HD22  ASN  49          HD22      ASN  49 -10.330  13.418  -9.920

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLU  50           H        GLU  50  -5.546  11.675 -12.529
    2    HA   GLU  50           HA       GLU  50  -7.503  10.430 -14.179
    3    HB2  GLU  50           HB2      GLU  50  -6.026  12.241 -14.990
    4    HB3  GLU  50           HB3      GLU  50  -4.638  11.162 -14.849
    5    HG2  GLU  50           HG2      GLU  50  -5.615   9.632 -16.488
    6    HG3  GLU  50           HG3      GLU  50  -7.071  10.617 -16.578

  No H/Q in entry =           6
  In of MODEL   56
    1    H    ALA  51           H        ALA  51  -4.340   9.422 -12.966
    2    HA   ALA  51           HA       ALA  51  -4.209   6.968 -14.384
    3    HB2  ALA  51           HB1      ALA  51  -2.232   6.670 -13.279
    4    HB1  ALA  51           HB2      ALA  51  -2.922   7.096 -11.714
    5    HB3  ALA  51           HB3      ALA  51  -2.457   8.364 -12.847

  No H/Q in entry =           5
  In of MODEL   56
    1    H    HIS  52           H        HIS  52  -5.385   7.806 -11.138
    2    HA   HIS  52           HA       HIS  52  -6.086   5.199 -10.308
    3    HB2  HIS  52           HB2      HIS  52  -5.940   7.178  -8.807
    4    HB3  HIS  52           HB3      HIS  52  -7.411   7.811  -9.545
    5    HD1  HIS  52           HD1      HIS  52  -9.629   6.434  -9.149
    6    HD2  HIS  52           HD2      HIS  52  -6.350   5.105  -6.947
    7    HE1  HIS  52           HE1      HIS  52 -10.545   4.893  -7.360
    8    HE2  HIS  52           HE2      HIS  52  -8.556   4.074  -6.009

  No H/Q in entry =           8
  In of MODEL   56
    1    H    LEU  53           H        LEU  53  -7.889   7.667 -12.100
    2    HA   LEU  53           HA       LEU  53 -10.401   6.388 -12.118
    3    HB2  LEU  53           HB2      LEU  53  -9.103   8.359 -13.989
    4    HB3  LEU  53           HB3      LEU  53 -10.708   7.706 -14.308
    5    HG   LEU  53           HG       LEU  53  -9.973   9.027 -11.675
    6   HD12  LEU  53          HD11      LEU  53 -11.261  10.993 -12.615
    7   HD11  LEU  53          HD12      LEU  53 -11.166  10.212 -14.193
    8   HD13  LEU  53          HD13      LEU  53  -9.695  10.718 -13.368
    9   HD22  LEU  53          HD21      LEU  53 -11.975   7.838 -11.326
   10   HD21  LEU  53          HD22      LEU  53 -12.519   8.086 -12.980
   11   HD23  LEU  53          HD23      LEU  53 -12.589   9.407 -11.830

  No H/Q in entry =          11
  In of MODEL   56
    1    H    VAL  54           H        VAL  54  -7.647   6.176 -14.349
    2    HA   VAL  54           HA       VAL  54  -8.875   4.412 -16.195
    3    HB   VAL  54           HB       VAL  54  -5.966   4.902 -15.506
    4   HG12  VAL  54          HG11      VAL  54  -5.719   3.816 -17.894
    5   HG11  VAL  54          HG12      VAL  54  -7.253   3.043 -17.494
    6   HG13  VAL  54          HG13      VAL  54  -5.841   2.781 -16.472
    7   HG22  VAL  54          HG21      VAL  54  -6.722   6.849 -16.552
    8   HG21  VAL  54          HG22      VAL  54  -7.918   5.993 -17.523
    9   HG23  VAL  54          HG23      VAL  54  -6.211   5.903 -17.950

  No H/Q in entry =           9
  In of MODEL   56
    1    H    GLN  55           H        GLN  55  -6.886   3.854 -13.291
    2    HA   GLN  55           HA       GLN  55  -6.812   1.037 -13.547
    3    HB2  GLN  55           HB2      GLN  55  -5.255   1.924 -12.024
    4    HB3  GLN  55           HB3      GLN  55  -6.468   2.897 -11.197
    5    HG2  GLN  55           HG2      GLN  55  -7.170   1.144  -9.881
    6    HG3  GLN  55           HG3      GLN  55  -6.949  -0.044 -11.159
    7   HE21  GLN  55          HE21      GLN  55  -5.335  -1.503 -10.660
    8   HE22  GLN  55          HE22      GLN  55  -3.951  -1.160  -9.745

  No H/Q in entry =           8
  In of MODEL   56
    1    H    THR  56           H        THR  56  -9.134   3.214 -11.938
    2    HA   THR  56           HA       THR  56 -10.733   1.340 -10.653
    3    HB   THR  56           HB       THR  56 -11.803   3.739 -12.161
    4    HG1  THR  56           HG1      THR  56 -10.316   3.493  -9.800
    5   HG22  THR  56          HG21      THR  56 -12.750   2.749  -9.496
    6   HG21  THR  56          HG22      THR  56 -13.272   1.911 -10.958
    7   HG23  THR  56          HG23      THR  56 -13.639   3.623 -10.742

  No H/Q in entry =           7
  In of MODEL   56
    1    H    LYS  57           H        LYS  57 -10.920   2.424 -14.039
    2    HA   LYS  57           HA       LYS  57 -13.084   0.749 -14.798
    3    HB2  LYS  57           HB2      LYS  57 -12.203   2.692 -16.117
    4    HB3  LYS  57           HB3      LYS  57 -10.758   1.755 -16.471
    5    HG2  LYS  57           HG2      LYS  57 -12.554  -0.019 -17.324
    6    HG3  LYS  57           HG3      LYS  57 -13.532   1.429 -17.530
    7    HD2  LYS  57           HD2      LYS  57 -10.722   1.201 -18.629
    8    HD3  LYS  57           HD3      LYS  57 -12.140   0.730 -19.561
    9    HE2  LYS  57           HE2      LYS  57 -11.546   3.039 -20.115
   10    HE3  LYS  57           HE3      LYS  57 -13.071   3.044 -19.233
   11    HZ3  LYS  57           HZ1      LYS  57 -12.169   4.172 -17.567
   12    HZ2  LYS  57           HZ2      LYS  57 -10.854   4.477 -18.599
   13    HZ1  LYS  57           HZ3      LYS  57 -10.796   3.177 -17.504

  No H/Q in entry =          13
  In of MODEL   56
    1    H    LEU  58           H        LEU  58  -9.583   0.297 -14.732
    2    HA   LEU  58           HA       LEU  58  -9.602  -2.220 -16.020
    3    HB2  LEU  58           HB2      LEU  58  -7.565  -0.940 -14.207
    4    HB3  LEU  58           HB3      LEU  58  -7.311  -2.463 -15.060
    5    HG   LEU  58           HG       LEU  58  -8.046   0.145 -16.426
    6   HD11  LEU  58          HD11      LEU  58  -5.409  -1.108 -15.727
    7   HD13  LEU  58          HD12      LEU  58  -5.894   0.586 -15.680
    8   HD12  LEU  58          HD13      LEU  58  -5.555  -0.187 -17.225
    9   HD22  LEU  58          HD21      LEU  58  -8.627  -1.414 -18.018
   10   HD21  LEU  58          HD22      LEU  58  -7.595  -2.668 -17.333
   11   HD23  LEU  58          HD23      LEU  58  -6.894  -1.399 -18.337

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  59           H        ILE  59 -10.427  -1.312 -12.772
    2    HA   ILE  59           HA       ILE  59 -10.095  -4.080 -11.822
    3    HB   ILE  59           HB       ILE  59  -9.646  -1.811 -10.425
    4   HG12  ILE  59          HG12      ILE  59 -11.016  -4.163  -9.102
    5   HG13  ILE  59          HG13      ILE  59  -9.372  -4.241  -9.687
    6   HG23  ILE  59          HG21      ILE  59 -11.477  -1.121  -9.110
    7   HG22  ILE  59          HG22      ILE  59 -12.416  -2.549  -9.485
    8   HG21  ILE  59          HG23      ILE  59 -12.186  -1.293 -10.699
    9   HD12  ILE  59          HD11      ILE  59  -9.465  -3.648  -7.291
   10   HD11  ILE  59          HD12      ILE  59 -10.387  -2.208  -7.702
   11   HD13  ILE  59          HD13      ILE  59  -8.719  -2.373  -8.250

  No H/Q in entry =          11
  In of MODEL   56
    1    H    GLU  60           H        GLU  60 -12.637  -1.750 -12.638
    2    HA   GLU  60           HA       GLU  60 -14.834  -3.254 -11.631
    3    HB2  GLU  60           HB2      GLU  60 -15.025  -0.878 -12.232
    4    HB3  GLU  60           HB3      GLU  60 -14.713  -1.268 -13.919
    5    HG2  GLU  60           HG2      GLU  60 -16.760  -2.648 -13.984
    6    HG3  GLU  60           HG3      GLU  60 -17.077  -2.256 -12.306

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLY  61           H        GLY  61 -13.152  -3.249 -14.741
    2    HA3  GLY  61           HA2      GLY  61 -14.875  -5.485 -15.635
    3    HA2  GLY  61           HA3      GLY  61 -14.020  -4.385 -16.711

  No H/Q in entry =           3
  In of MODEL   56
    1    H    ASP  62           H        ASP  62 -12.663  -5.841 -13.822
    2    HA   ASP  62           HA       ASP  62 -10.409  -6.833 -15.293
    3    HB2  ASP  62           HB2      ASP  62  -9.655  -7.608 -13.074
    4    HB3  ASP  62           HB3      ASP  62 -10.175  -5.927 -13.031

  No H/Q in entry =           4
  In of MODEL   56
    1    H    ALA  63           H        ALA  63 -12.069  -8.212 -16.690
    2    HA   ALA  63           HA       ALA  63 -13.121 -10.645 -15.633
    3    HB1  ALA  63           HB1      ALA  63 -13.682  -9.522 -17.864
    4    HB2  ALA  63           HB2      ALA  63 -13.442 -11.267 -17.937
    5    HB3  ALA  63           HB3      ALA  63 -12.162 -10.176 -18.472

  No H/Q in entry =           5
  In of MODEL   56
    1    H    GLY  64           H        GLY  64 -10.043  -9.748 -17.073
    2    HA3  GLY  64           HA2      GLY  64  -7.970 -10.740 -16.979
    3    HA2  GLY  64           HA3      GLY  64  -8.619 -11.873 -15.801

  No H/Q in entry =           3
  In of MODEL   56
    1    H    GLU  65           H        GLU  65  -7.084 -13.275 -17.169
    2    HA   GLU  65           HA       GLU  65  -7.786 -13.995 -19.801
    3    HB2  GLU  65           HB2      GLU  65  -6.243 -15.488 -17.684
    4    HB3  GLU  65           HB3      GLU  65  -6.412 -16.049 -19.348
    5    HG2  GLU  65           HG2      GLU  65  -5.390 -13.993 -20.182
    6    HG3  GLU  65           HG3      GLU  65  -5.292 -13.351 -18.543

  No H/Q in entry =           6
  In of MODEL   56
    1    H    GLY  66           H        GLY  66  -8.666 -15.367 -16.714
    2    HA3  GLY  66           HA2      GLY  66 -10.569 -17.214 -17.989
    3    HA2  GLY  66           HA3      GLY  66  -9.869 -17.431 -16.397

  No H/Q in entry =           3
  In of MODEL   56
    1    H    LYS  67           H        LYS  67 -12.370 -17.815 -16.312
    2    HA   LYS  67           HA       LYS  67 -14.165 -15.682 -16.270
    3    HB2  LYS  67           HB2      LYS  67 -14.218 -18.341 -14.849
    4    HB3  LYS  67           HB3      LYS  67 -15.594 -17.232 -14.924
    5    HG2  LYS  67           HG2      LYS  67 -15.494 -17.264 -17.391
    6    HG3  LYS  67           HG3      LYS  67 -14.124 -18.371 -17.321
    7    HD2  LYS  67           HD2      LYS  67 -15.533 -20.051 -16.189
    8    HD3  LYS  67           HD3      LYS  67 -16.905 -18.943 -16.261
    9    HE2  LYS  67           HE2      LYS  67 -16.778 -18.924 -18.723
   10    HE3  LYS  67           HE3      LYS  67 -15.391 -20.013 -18.662
   11    HZ3  LYS  67           HZ1      LYS  67 -16.967 -21.580 -18.846
   12    HZ2  LYS  67           HZ2      LYS  67 -18.206 -20.572 -18.272
   13    HZ1  LYS  67           HZ3      LYS  67 -17.161 -21.346 -17.178

  No H/Q in entry =          13
  In of MODEL   56
    1    H    MET  68           H        MET  68 -13.317 -17.410 -13.340
    2    HA   MET  68           HA       MET  68 -14.038 -15.353 -11.560
    3    HB2  MET  68           HB2      MET  68 -12.478 -17.903 -11.278
    4    HB3  MET  68           HB3      MET  68 -12.717 -16.816  -9.910
    5    HG2  MET  68           HG2      MET  68 -14.979 -17.893 -11.614
    6    HG3  MET  68           HG3      MET  68 -14.459 -18.625 -10.094
    7    HE3  MET  68           HE1      MET  68 -17.670 -16.967 -10.686
    8    HE2  MET  68           HE2      MET  68 -17.655 -17.259  -8.948
    9    HE1  MET  68           HE3      MET  68 -16.915 -18.431 -10.039

  No H/Q in entry =           9
  In of MODEL   56
    1    H    LYS  69           H        LYS  69 -10.812 -16.268 -12.806
    2    HA   LYS  69           HA       LYS  69  -9.373 -14.595 -11.034
    3    HB2  LYS  69           HB2      LYS  69  -8.620 -15.890 -13.652
    4    HB3  LYS  69           HB3      LYS  69  -7.472 -14.990 -12.658
    5    HG2  LYS  69           HG2      LYS  69  -7.934 -16.477 -10.751
    6    HG3  LYS  69           HG3      LYS  69  -9.115 -17.360 -11.715
    7    HD2  LYS  69           HD2      LYS  69  -7.316 -17.976 -13.316
    8    HD3  LYS  69           HD3      LYS  69  -6.145 -17.150 -12.286
    9    HE2  LYS  69           HE2      LYS  69  -7.893 -19.479 -11.437
   10    HE3  LYS  69           HE3      LYS  69  -6.177 -19.578 -11.823
   11    HZ2  LYS  69           HZ1      LYS  69  -7.491 -18.486  -9.470
   12    HZ1  LYS  69           HZ2      LYS  69  -6.140 -17.628 -10.037
   13    HZ3  LYS  69           HZ3      LYS  69  -5.993 -19.266  -9.613

  No H/Q in entry =          13
  In of MODEL   56
    1    H    VAL  70           H        VAL  70  -7.764 -12.887 -11.803
    2    HA   VAL  70           HA       VAL  70  -9.064 -10.973 -13.659
    3    HB   VAL  70           HB       VAL  70  -8.281  -9.171 -12.154
    4   HG11  VAL  70          HG11      VAL  70 -10.560 -10.365 -11.964
    5   HG13  VAL  70          HG12      VAL  70 -10.040  -9.410 -10.574
    6   HG12  VAL  70          HG13      VAL  70  -9.882 -11.165 -10.546
    7   HG23  VAL  70          HG21      VAL  70  -7.601  -9.937  -9.789
    8   HG22  VAL  70          HG22      VAL  70  -6.395 -10.150 -11.056
    9   HG21  VAL  70          HG23      VAL  70  -7.337 -11.531 -10.495

  No H/Q in entry =           9
  In of MODEL   56
    1    H    SER  71           H        SER  71  -7.506  -9.300 -14.433
    2    HA   SER  71           HA       SER  71  -5.257 -10.457 -15.691
    3    HB2  SER  71           HB2      SER  71  -6.449  -8.423 -16.515
    4    HB3  SER  71           HB3      SER  71  -5.790  -7.524 -15.152
    5    HG   SER  71           HG       SER  71  -4.043  -9.010 -16.753

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LEU  72           H        LEU  72  -3.237 -10.739 -15.042
    2    HA   LEU  72           HA       LEU  72  -2.524 -10.527 -12.329
    3    HB2  LEU  72           HB2      LEU  72  -0.977 -11.074 -14.841
    4    HB3  LEU  72           HB3      LEU  72  -0.163 -10.940 -13.285
    5    HG   LEU  72           HG       LEU  72  -2.522 -12.794 -13.728
    6   HD12  LEU  72          HD11      LEU  72   0.433 -13.469 -13.865
    7   HD11  LEU  72          HD12      LEU  72  -0.637 -13.363 -15.262
    8   HD13  LEU  72          HD13      LEU  72  -0.910 -14.602 -14.036
    9   HD23  LEU  72          HD21      LEU  72  -1.196 -13.971 -11.787
   10   HD22  LEU  72          HD22      LEU  72  -2.200 -12.585 -11.394
   11   HD21  LEU  72          HD23      LEU  72  -0.458 -12.388 -11.565

  No H/Q in entry =          11
  In of MODEL   56
    1    H    VAL  73           H        VAL  73  -1.786  -8.518 -15.109
    2    HA   VAL  73           HA       VAL  73   0.143  -6.831 -14.001
    3    HB   VAL  73           HB       VAL  73  -0.239  -5.408 -15.859
    4   HG13  VAL  73          HG11      VAL  73  -0.128  -6.958 -17.675
    5   HG12  VAL  73          HG12      VAL  73  -1.096  -8.150 -16.809
    6   HG11  VAL  73          HG13      VAL  73   0.549  -7.800 -16.282
    7   HG21  VAL  73          HG21      VAL  73  -3.006  -6.557 -15.708
    8   HG23  VAL  73          HG22      VAL  73  -2.402  -5.993 -17.265
    9   HG22  VAL  73          HG23      VAL  73  -2.504  -4.878 -15.902

  No H/Q in entry =           9
  In of MODEL   56
    1    H    LEU  74           H        LEU  74  -3.257  -6.924 -13.453
    2    HA   LEU  74           HA       LEU  74  -3.859  -4.263 -12.845
    3    HB2  LEU  74           HB2      LEU  74  -5.595  -5.925 -13.024
    4    HB3  LEU  74           HB3      LEU  74  -4.918  -6.841 -11.681
    5    HG   LEU  74           HG       LEU  74  -5.379  -4.947 -10.157
    6   HD12  LEU  74          HD11      LEU  74  -6.966  -3.171 -11.153
    7   HD11  LEU  74          HD12      LEU  74  -6.373  -3.704 -12.725
    8   HD13  LEU  74          HD13      LEU  74  -5.252  -3.024 -11.544
    9   HD23  LEU  74          HD21      LEU  74  -7.934  -5.365 -11.615
   10   HD22  LEU  74          HD22      LEU  74  -7.559  -5.522  -9.912
   11   HD21  LEU  74          HD23      LEU  74  -7.087  -6.789 -11.019

  No H/Q in entry =          11
  In of MODEL   56
    1    H    VAL  75           H        VAL  75  -2.842  -6.855 -10.678
    2    HA   VAL  75           HA       VAL  75  -2.640  -5.303  -8.335
    3    HB   VAL  75           HB       VAL  75  -1.155  -7.808  -9.118
    4   HG12  VAL  75          HG11      VAL  75  -0.721  -7.961  -6.636
    5   HG11  VAL  75          HG12      VAL  75  -1.373  -6.338  -6.465
    6   HG13  VAL  75          HG13      VAL  75   0.099  -6.595  -7.386
    7   HG22  VAL  75          HG21      VAL  75  -3.571  -8.102  -8.960
    8   HG21  VAL  75          HG22      VAL  75  -3.617  -7.220  -7.435
    9   HG23  VAL  75          HG23      VAL  75  -2.832  -8.798  -7.517

  No H/Q in entry =           9
  In of MODEL   56
    1    H    GLU  76           H        GLU  76  -0.229  -6.082 -10.863
    2    HA   GLU  76           HA       GLU  76   1.962  -4.749  -9.700
    3    HB2  GLU  76           HB2      GLU  76   2.106  -6.239 -11.704
    4    HB3  GLU  76           HB3      GLU  76   1.286  -5.009 -12.653
    5    HG2  GLU  76           HG2      GLU  76   3.138  -3.434 -12.244
    6    HG3  GLU  76           HG3      GLU  76   3.976  -4.631 -11.275

  No H/Q in entry =           6
  In of MODEL   56
    1    H    ALA  77           H        ALA  77  -0.555  -3.532 -11.898
    2    HA   ALA  77           HA       ALA  77   0.454  -0.893 -12.073
    3    HB2  ALA  77           HB1      ALA  77  -1.869  -0.315 -12.798
    4    HB3  ALA  77           HB2      ALA  77  -2.368  -1.952 -12.376
    5    HB1  ALA  77           HB3      ALA  77  -1.192  -1.695 -13.665

  No H/Q in entry =           5
  In of MODEL   56
    1    H    GLN  78           H        GLN  78  -1.831  -2.431  -9.868
    2    HA   GLN  78           HA       GLN  78  -2.627  -0.106  -8.471
    3    HB2  GLN  78           HB2      GLN  78  -3.753  -2.358  -8.388
    4    HB3  GLN  78           HB3      GLN  78  -2.423  -2.926  -7.381
    5    HG2  GLN  78           HG2      GLN  78  -2.932  -1.184  -5.721
    6    HG3  GLN  78           HG3      GLN  78  -4.264  -0.611  -6.724
    7   HE21  GLN  78          HE21      GLN  78  -4.721  -1.592  -4.062
    8   HE22  GLN  78          HE22      GLN  78  -5.600  -3.041  -4.178

  No H/Q in entry =           8
  In of MODEL   56
    1    H    LEU  79           H        LEU  79   0.035  -2.378  -8.010
    2    HA   LEU  79           HA       LEU  79   1.009  -1.486  -5.551
    3    HB2  LEU  79           HB2      LEU  79   1.870  -3.501  -6.614
    4    HB3  LEU  79           HB3      LEU  79   2.526  -2.554  -7.946
    5    HG   LEU  79           HG       LEU  79   4.084  -1.423  -6.438
    6   HD13  LEU  79          HD11      LEU  79   3.074  -1.170  -4.375
    7   HD12  LEU  79          HD12      LEU  79   4.144  -2.526  -4.026
    8   HD11  LEU  79          HD13      LEU  79   2.438  -2.815  -4.361
    9   HD23  LEU  79          HD21      LEU  79   5.279  -3.577  -5.529
   10   HD22  LEU  79          HD22      LEU  79   5.082  -3.379  -7.268
   11   HD21  LEU  79          HD23      LEU  79   3.995  -4.441  -6.378

  No H/Q in entry =          11
  In of MODEL   56
    1    H    HIS  80           H        HIS  80   1.896  -0.377  -8.822
    2    HA   HIS  80           HA       HIS  80   3.712   1.601  -7.895
    3    HB2  HIS  80           HB2      HIS  80   2.427   0.912 -10.482
    4    HB3  HIS  80           HB3      HIS  80   3.031   2.561 -10.310
    5    HD1  HIS  80           HD1      HIS  80   5.436   2.848 -10.825
    6    HD2  HIS  80           HD2      HIS  80   4.591  -1.058  -9.633
    7    HE1  HIS  80           HE1      HIS  80   7.619   1.559 -10.982
    8    HE2  HIS  80           HE2      HIS  80   7.115  -0.825 -10.259

  No H/Q in entry =           8
  In of MODEL   56
    1    H    LEU  81           H        LEU  81   0.312   1.779  -8.886
    2    HA   LEU  81           HA       LEU  81   0.051   4.573  -8.559
    3    HB2  LEU  81           HB2      LEU  81  -1.976   2.338  -8.485
    4    HB3  LEU  81           HB3      LEU  81  -2.420   4.043  -8.395
    5    HG   LEU  81           HG       LEU  81  -0.725   2.883 -10.625
    6   HD12  LEU  81          HD11      LEU  81  -2.951   3.213 -11.932
    7   HD11  LEU  81          HD12      LEU  81  -3.712   3.150 -10.343
    8   HD13  LEU  81          HD13      LEU  81  -2.774   1.777 -10.926
    9   HD23  LEU  81          HD21      LEU  81  -1.807   5.032 -11.727
   10   HD22  LEU  81          HD22      LEU  81  -0.394   5.196 -10.690
   11   HD21  LEU  81          HD23      LEU  81  -1.999   5.553 -10.055

  No H/Q in entry =          11
  In of MODEL   56
    1    H    MET  82           H        MET  82  -0.629   1.891  -6.310
    2    HA   MET  82           HA       MET  82  -1.681   3.484  -4.228
    3    HB2  MET  82           HB2      MET  82  -0.320   0.791  -4.260
    4    HB3  MET  82           HB3      MET  82  -0.900   1.519  -2.765
    5    HG2  MET  82           HG2      MET  82  -2.627   1.032  -5.212
    6    HG3  MET  82           HG3      MET  82  -2.558  -0.041  -3.816
    7    HE3  MET  82           HE1      MET  82  -4.283   1.618  -1.008
    8    HE2  MET  82           HE2      MET  82  -2.551   1.888  -1.187
    9    HE1  MET  82           HE3      MET  82  -3.245   0.334  -1.642

  No H/Q in entry =           9
  In of MODEL   56
    1    H    THR  83           H        THR  83   1.617   2.383  -4.905
    2    HA   THR  83           HA       THR  83   2.832   3.483  -2.601
    3    HB   THR  83           HB       THR  83   4.931   3.417  -4.068
    4    HG1  THR  83           HG1      THR  83   4.696   2.890  -6.092
    5   HG22  THR  83          HG21      THR  83   4.477   0.761  -4.399
    6   HG21  THR  83          HG22      THR  83   3.185   1.147  -3.264
    7   HG23  THR  83          HG23      THR  83   4.864   1.483  -2.839

  No H/Q in entry =           7
  In of MODEL   56
    1    H    SER  84           H        SER  84   2.478   4.762  -5.903
    2    HA   SER  84           HA       SER  84   3.827   7.196  -5.445
    3    HB2  SER  84           HB2      SER  84   1.760   6.372  -7.471
    4    HB3  SER  84           HB3      SER  84   2.445   7.996  -7.445
    5    HG   SER  84           HG       SER  84   3.808   5.515  -7.730

  No H/Q in entry =           5
  In of MODEL   56
    1    H    MET  85           H        MET  85   0.329   6.456  -5.285
    2    HA   MET  85           HA       MET  85  -0.523   9.070  -4.689
    3    HB2  MET  85           HB2      MET  85  -2.049   7.264  -5.362
    4    HB3  MET  85           HB3      MET  85  -1.773   6.464  -3.815
    5    HG2  MET  85           HG2      MET  85  -2.668   8.421  -2.623
    6    HG3  MET  85           HG3      MET  85  -2.904   9.256  -4.158
    7    HE3  MET  85           HE1      MET  85  -3.810   5.252  -3.397
    8    HE2  MET  85           HE2      MET  85  -5.136   5.746  -2.348
    9    HE1  MET  85           HE3      MET  85  -3.506   6.329  -2.029

  No H/Q in entry =           9
  In of MODEL   56
    1    H    LEU  86           H        LEU  86   0.377   6.405  -2.540
    2    HA   LEU  86           HA       LEU  86  -0.158   7.712  -0.101
    3    HB2  LEU  86           HB2      LEU  86   0.295   5.238  -0.492
    4    HB3  LEU  86           HB3      LEU  86   2.004   5.659  -0.581
    5    HG   LEU  86           HG       LEU  86   1.678   6.823   1.685
    6   HD11  LEU  86          HD11      LEU  86  -1.019   6.071   1.205
    7   HD13  LEU  86          HD12      LEU  86  -0.354   6.815   2.658
    8   HD12  LEU  86          HD13      LEU  86  -0.453   5.060   2.539
    9   HD23  LEU  86          HD21      LEU  86   1.233   3.833   1.807
   10   HD22  LEU  86          HD22      LEU  86   2.237   4.838   2.850
   11   HD21  LEU  86          HD23      LEU  86   2.742   4.509   1.193

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ALA  87           H        ALA  87   2.827   7.400  -1.980
    2    HA   ALA  87           HA       ALA  87   4.535   8.802  -0.250
    3    HB3  ALA  87           HB1      ALA  87   4.634   7.787  -2.956
    4    HB2  ALA  87           HB2      ALA  87   5.966   8.110  -1.851
    5    HB1  ALA  87           HB3      ALA  87   5.363   9.394  -2.898

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ARG  88           H        ARG  88   2.604   9.948  -2.977
    2    HA   ARG  88           HA       ARG  88   3.394  12.633  -2.859
    3    HB2  ARG  88           HB2      ARG  88   2.139  11.487  -4.720
    4    HB3  ARG  88           HB3      ARG  88   0.680  11.640  -3.742
    5    HG2  ARG  88           HG2      ARG  88   1.715  14.214  -3.656
    6    HG3  ARG  88           HG3      ARG  88   2.141  13.696  -5.285
    7    HD2  ARG  88           HD2      ARG  88   0.003  13.790  -5.989
    8    HD3  ARG  88           HD3      ARG  88  -0.594  12.941  -4.563
    9    HE   ARG  88           HE       ARG  88  -0.765  15.720  -4.982
   10   HH21  ARG  88          HH11      ARG  88  -1.289  17.053  -3.246
   11   HH22  ARG  88          HH12      ARG  88  -1.001  16.515  -1.628
   12   HH11  ARG  88          HH21      ARG  88   0.229  13.452  -2.604
   13   HH12  ARG  88          HH22      ARG  88  -0.160  14.470  -1.264

  No H/Q in entry =          13
  In of MODEL   56
    1    H    GLU  89           H        GLU  89   0.674  10.977  -1.227
    2    HA   GLU  89           HA       GLU  89  -0.421  13.296  -0.026
    3    HB2  GLU  89           HB2      GLU  89  -1.554  11.065  -0.116
    4    HB3  GLU  89           HB3      GLU  89  -0.438  10.502   1.129
    5    HG2  GLU  89           HG2      GLU  89  -1.251  12.207   2.685
    6    HG3  GLU  89           HG3      GLU  89  -2.295  12.884   1.438

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LEU  90           H        LEU  90   2.010  10.987   1.156
    2    HA   LEU  90           HA       LEU  90   2.367  12.230   3.687
    3    HB2  LEU  90           HB2      LEU  90   4.133  10.442   2.015
    4    HB3  LEU  90           HB3      LEU  90   4.550  10.956   3.655
    5    HG   LEU  90           HG       LEU  90   1.908   9.630   2.986
    6   HD12  LEU  90          HD11      LEU  90   3.030   7.576   3.998
    7   HD11  LEU  90          HD12      LEU  90   4.559   8.420   3.761
    8   HD13  LEU  90          HD13      LEU  90   3.548   8.020   2.371
    9   HD22  LEU  90          HD21      LEU  90   1.644  10.555   5.107
   10   HD21  LEU  90          HD22      LEU  90   3.360  10.435   5.494
   11   HD23  LEU  90          HD23      LEU  90   2.342   8.996   5.540

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  91           H        ILE  91   3.983  12.600   0.565
    2    HA   ILE  91           HA       ILE  91   5.971  14.416   1.410
    3    HB   ILE  91           HB       ILE  91   4.664  13.935  -1.274
    4   HG12  ILE  91          HG12      ILE  91   7.490  13.426  -0.291
    5   HG13  ILE  91          HG13      ILE  91   6.198  12.239  -0.133
    6   HG22  ILE  91          HG21      ILE  91   6.899  15.265  -1.956
    7   HG21  ILE  91          HG22      ILE  91   6.591  16.068  -0.416
    8   HG23  ILE  91          HG23      ILE  91   5.372  16.106  -1.688
    9   HD13  ILE  91          HD11      ILE  91   6.029  11.916  -2.440
   10   HD12  ILE  91          HD12      ILE  91   7.765  12.146  -2.221
   11   HD11  ILE  91          HD13      ILE  91   6.767  13.476  -2.811

  No H/Q in entry =          11
  In of MODEL   56
    1    H    THR  92           H        THR  92   2.616  14.875   0.392
    2    HA   THR  92           HA       THR  92   2.612  17.698   0.331
    3    HB   THR  92           HB       THR  92   0.427  15.721   1.024
    4    HG1  THR  92           HG1      THR  92   0.736  15.540  -1.060
    5   HG22  THR  92          HG21      THR  92  -0.954  17.894   0.297
    6   HG21  THR  92          HG22      THR  92   0.442  18.708   0.999
    7   HG23  THR  92          HG23      THR  92  -0.511  17.594   1.977

  No H/Q in entry =           7
  In of MODEL   56
    1    H    GLU  93           H        GLU  93   2.038  15.403   2.983
    2    HA   GLU  93           HA       GLU  93   1.515  17.311   5.000
    3    HB2  GLU  93           HB2      GLU  93   2.805  14.576   5.240
    4    HB3  GLU  93           HB3      GLU  93   2.118  15.508   6.571
    5    HG2  GLU  93           HG2      GLU  93   0.507  14.744   4.127
    6    HG3  GLU  93           HG3      GLU  93   0.595  13.720   5.556

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LEU  94           H        LEU  94   4.513  15.804   3.860
    2    HA   LEU  94           HA       LEU  94   6.267  16.937   5.753
    3    HB2  LEU  94           HB2      LEU  94   6.669  15.967   2.923
    4    HB3  LEU  94           HB3      LEU  94   8.001  16.614   3.877
    5    HG   LEU  94           HG       LEU  94   6.240  14.432   5.007
    6   HD11  LEU  94          HD11      LEU  94   8.340  14.189   2.882
    7   HD13  LEU  94          HD12      LEU  94   6.885  13.227   3.139
    8   HD12  LEU  94          HD13      LEU  94   8.306  12.962   4.150
    9   HD23  LEU  94          HD21      LEU  94   8.422  13.878   6.166
   10   HD22  LEU  94          HD22      LEU  94   7.767  15.461   6.580
   11   HD21  LEU  94          HD23      LEU  94   9.108  15.330   5.442

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  95           H        ILE  95   5.147  18.118   2.600
    2    HA   ILE  95           HA       ILE  95   6.738  20.463   2.545
    3    HB   ILE  95           HB       ILE  95   4.093  19.801   1.231
    4   HG12  ILE  95          HG12      ILE  95   6.888  20.115   0.103
    5   HG13  ILE  95          HG13      ILE  95   6.224  18.567   0.616
    6   HG21  ILE  95          HG21      ILE  95   5.863  22.253   1.016
    7   HG23  ILE  95          HG22      ILE  95   4.137  22.200   1.367
    8   HG22  ILE  95          HG23      ILE  95   4.721  21.794  -0.247
    9   HD13  ILE  95          HD11      ILE  95   4.669  18.504  -1.118
   10   HD12  ILE  95          HD12      ILE  95   6.027  19.311  -1.902
   11   HD11  ILE  95          HD13      ILE  95   4.661  20.257  -1.314

  No H/Q in entry =          11
  In of MODEL   56
    1    H    GLU  96           H        GLU  96   3.480  19.838   3.830
    2    HA   GLU  96           HA       GLU  96   2.880  22.490   4.579
    3    HB2  GLU  96           HB2      GLU  96   1.191  20.721   4.586
    4    HB3  GLU  96           HB3      GLU  96   2.041  19.886   5.884
    5    HG2  GLU  96           HG2      GLU  96   1.027  21.178   7.450
    6    HG3  GLU  96           HG3      GLU  96   1.577  22.647   6.655

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LEU  97           H        LEU  97   4.696  19.924   6.210
    2    HA   LEU  97           HA       LEU  97   5.058  21.269   8.682
    3    HB2  LEU  97           HB2      LEU  97   6.580  19.087   7.272
    4    HB3  LEU  97           HB3      LEU  97   7.172  19.767   8.786
    5    HG   LEU  97           HG       LEU  97   4.354  18.698   8.467
    6   HD12  LEU  97          HD11      LEU  97   5.273  16.677   9.683
    7   HD11  LEU  97          HD12      LEU  97   6.890  17.294   9.344
    8   HD13  LEU  97          HD13      LEU  97   5.821  16.846   8.014
    9   HD23  LEU  97          HD21      LEU  97   4.796  18.400  11.033
   10   HD22  LEU  97          HD22      LEU  97   4.432  20.015  10.427
   11   HD21  LEU  97          HD23      LEU  97   6.098  19.560  10.777

  No H/Q in entry =          11
  In of MODEL   56
    1    H    HIS  98           H        HIS  98   6.938  21.269   5.662
    2    HA   HIS  98           HA       HIS  98   9.102  22.829   6.568
    3    HB2  HIS  98           HB2      HIS  98   7.815  22.586   3.838
    4    HB3  HIS  98           HB3      HIS  98   9.263  23.551   4.133
    5    HD1  HIS  98           HD1      HIS  98   8.020  19.992   4.149
    6    HD2  HIS  98           HD2      HIS  98  11.618  22.056   4.585
    7    HE1  HIS  98           HE1      HIS  98   9.859  18.246   4.098
    8    HE2  HIS  98           HE2      HIS  98  12.054  19.482   4.364

  No H/Q in entry =           8
  In of MODEL   56
    1    H    GLU  99           H        GLU  99   5.893  23.693   5.383
    2    HA   GLU  99           HA       GLU  99   6.297  26.504   5.326
    3    HB2  GLU  99           HB2      GLU  99   4.411  25.352   4.189
    4    HB3  GLU  99           HB3      GLU  99   3.707  24.997   5.766
    5    HG2  GLU  99           HG2      GLU  99   3.547  27.391   6.267
    6    HG3  GLU  99           HG3      GLU  99   4.331  27.783   4.740

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LYS 100           H        LYS 100   5.138  24.280   7.844
    2    HA   LYS 100           HA       LYS 100   4.565  26.339   9.736
    3    HB2  LYS 100           HB2      LYS 100   5.112  23.383  10.084
    4    HB3  LYS 100           HB3      LYS 100   4.670  24.459  11.415
    5    HG2  LYS 100           HG2      LYS 100   2.614  25.116  10.160
    6    HG3  LYS 100           HG3      LYS 100   3.034  23.943   8.909
    7    HD2  LYS 100           HD2      LYS 100   2.935  22.123  10.570
    8    HD3  LYS 100           HD3      LYS 100   2.532  23.290  11.832
    9    HE2  LYS 100           HE2      LYS 100   0.488  23.930  10.563
   10    HE3  LYS 100           HE3      LYS 100   0.881  22.706   9.348
   11    HZ1  LYS 100           HZ1      LYS 100   0.600  22.042  12.228
   12    HZ3  LYS 100           HZ2      LYS 100   0.579  20.988  10.893
   13    HZ2  LYS 100           HZ3      LYS 100  -0.728  22.040  11.169

  No H/Q in entry =          13
  In of MODEL   56
    1    H    LEU 101           H        LEU 101   7.474  24.516   8.911
    2    HA   LEU 101           HA       LEU 101   9.073  25.341  11.120
    3    HB2  LEU 101           HB2      LEU 101   9.667  24.349   8.344
    4    HB3  LEU 101           HB3      LEU 101  10.972  25.002   9.329
    5    HG   LEU 101           HG       LEU 101   9.117  22.863  10.387
    6   HD12  LEU 101          HD11      LEU 101  11.158  21.349   9.785
    7   HD11  LEU 101          HD12      LEU 101  11.541  22.608   8.614
    8   HD13  LEU 101          HD13      LEU 101  10.004  21.750   8.515
    9   HD21  LEU 101          HD21      LEU 101  11.849  23.945  11.123
   10   HD23  LEU 101          HD22      LEU 101  11.289  22.378  11.701
   11   HD22  LEU 101          HD23      LEU 101  10.409  23.843  12.137

  No H/Q in entry =          11
  In of MODEL   56
    1    H    LYS 102           H        LYS 102   7.515  27.220   8.974
    2    HA   LYS 102           HA       LYS 102   7.615  29.512   8.683
    3    HB2  LYS 102           HB2      LYS 102   9.172  29.382  10.786
    4    HB3  LYS 102           HB3      LYS 102  10.477  29.563   9.631
    5    HG2  LYS 102           HG2      LYS 102   8.388  31.537  10.486
    6    HG3  LYS 102           HG3      LYS 102  10.103  31.780  10.240
    7    HD2  LYS 102           HD2      LYS 102   8.155  31.376   7.934
    8    HD3  LYS 102           HD3      LYS 102   8.552  32.952   8.604
    9    HE2  LYS 102           HE2      LYS 102   9.919  31.754   6.534
   10    HE3  LYS 102           HE3      LYS 102  10.546  33.055   7.547
   11    HZ2  LYS 102           HZ1      LYS 102  12.048  31.135   7.377
   12    HZ1  LYS 102           HZ2      LYS 102  10.874  30.164   8.116
   13    HZ3  LYS 102           HZ3      LYS 102  11.576  31.444   8.977

  No H/Q in entry =          13
  In of MODEL   56
    1    H    ALA 103           H        ALA 103  10.861  28.141   8.128
    2    HA   ALA 103           HA       ALA 103  11.844  29.508   6.056
    3    HB2  ALA 103           HB1      ALA 103  12.711  27.286   5.130
    4    HB1  ALA 103           HB2      ALA 103  11.804  26.520   6.434
    5    HB3  ALA 103           HB3      ALA 103  13.104  27.652   6.811

  No H/Q in entry =           5
  In of MODEL   56
    1    H1   LYS   3           H1       LYS   3 -31.723   5.838 -19.660
    2    H2   LYS   3           H3       LYS   3 -30.737   5.589 -21.020
    3    H3   LYS   3           H2       LYS   3 -32.102   4.612 -20.770
    4    HA   LYS   3           HA       LYS   3 -31.050   3.241 -19.385
    5    HB2  LYS   3           HB2      LYS   3 -28.819   4.729 -20.720
    6    HB3  LYS   3           HB3      LYS   3 -28.451   3.521 -19.490
    7    HG2  LYS   3           HG2      LYS   3 -29.836   1.905 -20.843
    8    HG3  LYS   3           HG3      LYS   3 -29.834   3.117 -22.125
    9    HD2  LYS   3           HD2      LYS   3 -27.350   3.073 -22.091
   10    HD3  LYS   3           HD3      LYS   3 -27.423   1.763 -20.915
   11    HE2  LYS   3           HE2      LYS   3 -28.899   0.559 -22.631
   12    HE3  LYS   3           HE3      LYS   3 -28.320   1.763 -23.781
   13    HZ3  LYS   3           HZ1      LYS   3 -26.490   0.589 -24.072
   14    HZ2  LYS   3           HZ2      LYS   3 -27.079  -0.605 -23.018
   15    HZ1  LYS   3           HZ3      LYS   3 -26.121   0.661 -22.416

  No H/Q in entry =          15
  In of MODEL   56
    1    H    LYS   4           H        LYS   4 -31.085   3.081 -17.325
    2    HA   LYS   4           HA       LYS   4 -30.408   5.373 -15.661
    3    HB2  LYS   4           HB2      LYS   4 -31.528   2.643 -14.974
    4    HB3  LYS   4           HB3      LYS   4 -31.336   3.978 -13.839
    5    HG2  LYS   4           HG2      LYS   4 -33.158   3.885 -16.249
    6    HG3  LYS   4           HG3      LYS   4 -33.639   3.909 -14.553
    7    HD2  LYS   4           HD2      LYS   4 -33.002   6.147 -14.273
    8    HD3  LYS   4           HD3      LYS   4 -31.971   6.129 -15.704
    9    HE2  LYS   4           HE2      LYS   4 -33.938   7.453 -16.142
   10    HE3  LYS   4           HE3      LYS   4 -33.984   5.987 -17.122
   11    HZ3  LYS   4           HZ1      LYS   4 -35.523   5.019 -15.571
   12    HZ2  LYS   4           HZ2      LYS   4 -36.123   6.503 -16.140
   13    HZ1  LYS   4           HZ3      LYS   4 -35.453   6.398 -14.583

  No H/Q in entry =          13
  In of MODEL   56
    1    H    HIS   5           H        HIS   5 -28.931   5.486 -14.078
    2    HA   HIS   5           HA       HIS   5 -26.602   3.722 -14.440
    3    HB2  HIS   5           HB2      HIS   5 -26.922   6.459 -13.210
    4    HB3  HIS   5           HB3      HIS   5 -25.416   5.545 -13.210
    5    HD1  HIS   5           HD1      HIS   5 -23.988   6.795 -14.800
    6    HD2  HIS   5           HD2      HIS   5 -27.783   6.087 -16.333
    7    HE1  HIS   5           HE1      HIS   5 -23.853   7.399 -17.246
    8    HE2  HIS   5           HE2      HIS   5 -26.166   6.954 -18.150

  No H/Q in entry =           8
  In of MODEL   56
    1    H    ILE   6           H        ILE   6 -26.322   2.145 -13.138
    2    HA   ILE   6           HA       ILE   6 -27.285   2.365 -10.365
    3    HB   ILE   6           HB       ILE   6 -26.407  -0.067 -11.928
    4   HG12  ILE   6          HG12      ILE   6 -29.168   0.791 -11.050
    5   HG13  ILE   6          HG13      ILE   6 -28.541   0.983 -12.688
    6   HG23  ILE   6          HG21      ILE   6 -26.735  -1.343 -10.076
    7   HG22  ILE   6          HG22      ILE   6 -27.917  -0.233  -9.379
    8   HG21  ILE   6          HG23      ILE   6 -26.196   0.147  -9.299
    9   HD13  ILE   6          HD11      ILE   6 -28.950  -1.143 -13.202
   10   HD12  ILE   6          HD12      ILE   6 -29.955  -1.164 -11.753
   11   HD11  ILE   6          HD13      ILE   6 -28.286  -1.730 -11.677

  No H/Q in entry =          11
  In of MODEL   56
    1    H    TYR   7           H        TYR   7 -25.534   3.041  -9.085
    2    HA   TYR   7           HA       TYR   7 -22.805   2.159  -9.791
    3    HB2  TYR   7           HB2      TYR   7 -23.819   4.556  -8.283
    4    HB3  TYR   7           HB3      TYR   7 -22.123   4.084  -8.337
    5    HD1  TYR   7           HD1      TYR   7 -23.160   3.141 -11.428
    6    HD2  TYR   7           HD2      TYR   7 -22.565   6.711  -9.178
    7    HE1  TYR   7           HE1      TYR   7 -22.774   4.397 -13.512
    8    HE2  TYR   7           HE2      TYR   7 -22.221   7.972 -11.253
    9    HH   TYR   7           HH       TYR   7 -22.453   7.898 -13.484

  No H/Q in entry =           9
  In of MODEL   56
    1    H    LEU   8           H        LEU   8 -21.795   0.821  -8.479
    2    HA   LEU   8           HA       LEU   8 -22.894   0.277  -5.793
    3    HB2  LEU   8           HB2      LEU   8 -21.163  -1.328  -7.652
    4    HB3  LEU   8           HB3      LEU   8 -21.327  -1.728  -5.941
    5    HG   LEU   8           HG       LEU   8 -23.804  -1.959  -6.349
    6   HD13  LEU   8          HD11      LEU   8 -23.981  -0.730  -8.448
    7   HD12  LEU   8          HD12      LEU   8 -24.471  -2.405  -8.697
    8   HD11  LEU   8          HD13      LEU   8 -22.879  -1.862  -9.229
    9   HD23  LEU   8          HD21      LEU   8 -22.491  -3.955  -8.067
   10   HD22  LEU   8          HD22      LEU   8 -23.564  -4.160  -6.683
   11   HD21  LEU   8          HD23      LEU   8 -21.865  -3.767  -6.430

  No H/Q in entry =          11
  In of MODEL   56
    1    H    PHE   9           H        PHE   9 -21.624   0.685  -4.011
    2    HA   PHE   9           HA       PHE   9 -18.862   1.687  -4.518
    3    HB2  PHE   9           HB2      PHE   9 -20.900   2.694  -2.537
    4    HB3  PHE   9           HB3      PHE   9 -19.201   3.140  -2.507
    5    HD1  PHE   9           HD1      PHE   9 -18.219   4.503  -4.280
    6    HD2  PHE   9           HD2      PHE   9 -22.393   3.509  -4.299
    7    HE1  PHE   9           HE1      PHE   9 -18.622   6.220  -6.020
    8    HE2  PHE   9           HE2      PHE   9 -22.797   5.237  -6.033
    9    HZ   PHE   9           HZ       PHE   9 -20.908   6.589  -6.900

  No H/Q in entry =           9
  In of MODEL   56
    1    H    SER  10           H        SER  10 -17.249   0.750  -3.420
    2    HA   SER  10           HA       SER  10 -17.447  -0.197  -0.742
    3    HB2  SER  10           HB2      SER  10 -18.618  -2.065  -1.889
    4    HB3  SER  10           HB3      SER  10 -17.199  -2.295  -2.898
    5    HG   SER  10           HG       SER  10 -16.835  -3.648  -1.274

  No H/Q in entry =           5
  In of MODEL   56
    1    H    SER  11           H        SER  11 -15.423  -0.115   0.116
    2    HA   SER  11           HA       SER  11 -13.267   0.862  -1.393
    3    HB2  SER  11           HB2      SER  11 -12.813  -0.592   1.176
    4    HB3  SER  11           HB3      SER  11 -12.079   0.898   0.579
    5    HG   SER  11           HG       SER  11 -13.651   1.280   2.213

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ALA  12           H        ALA  12 -14.389  -1.821  -2.297
    2    HA   ALA  12           HA       ALA  12 -11.779  -2.972  -2.875
    3    HB2  ALA  12           HB1      ALA  12 -12.100  -4.378  -1.068
    4    HB3  ALA  12           HB2      ALA  12 -12.857  -5.316  -2.354
    5    HB1  ALA  12           HB3      ALA  12 -13.856  -4.379  -1.244

  No H/Q in entry =           5
  In of MODEL   56
    1    H    GLY  13           H        GLY  13 -12.490  -2.001  -4.904
    2    HA3  GLY  13           HA2      GLY  13 -14.739  -2.650  -6.381
    3    HA2  GLY  13           HA3      GLY  13 -13.178  -2.227  -7.098

  No H/Q in entry =           3
  In of MODEL   56
    1    H    MET  14           H        MET  14 -11.685  -4.523  -6.236
    2    HA   MET  14           HA       MET  14 -12.209  -6.269  -8.336
    3    HB2  MET  14           HB2      MET  14 -10.063  -6.326  -7.148
    4    HB3  MET  14           HB3      MET  14 -10.840  -7.035  -5.733
    5    HG2  MET  14           HG2      MET  14 -11.484  -9.005  -7.094
    6    HG3  MET  14           HG3      MET  14 -10.693  -8.289  -8.499
    7    HE3  MET  14           HE1      MET  14  -7.109  -8.351  -8.013
    8    HE2  MET  14           HE2      MET  14  -7.823  -7.017  -7.109
    9    HE1  MET  14           HE3      MET  14  -8.542  -7.518  -8.638

  No H/Q in entry =           9
  In of MODEL   56
    1    H    SER  15           H        SER  15 -13.270  -6.693  -4.962
    2    HA   SER  15           HA       SER  15 -14.596  -9.183  -5.524
    3    HB2  SER  15           HB2      SER  15 -14.998  -7.300  -3.184
    4    HB3  SER  15           HB3      SER  15 -15.776  -8.871  -3.355
    5    HG   SER  15           HG       SER  15 -13.601  -9.742  -3.576

  No H/Q in entry =           5
  In of MODEL   56
    1    H    THR  16           H        THR  16 -15.760  -5.822  -5.226
    2    HA   THR  16           HA       THR  16 -18.533  -6.421  -5.758
    3    HB   THR  16           HB       THR  16 -17.062  -3.809  -6.257
    4    HG1  THR  16           HG1      THR  16 -18.077  -3.514  -4.008
    5   HG22  THR  16          HG21      THR  16 -19.908  -4.293  -5.371
    6   HG21  THR  16          HG22      THR  16 -19.456  -4.147  -7.079
    7   HG23  THR  16          HG23      THR  16 -19.201  -2.797  -5.966

  No H/Q in entry =           7
  In of MODEL   56
    1    H    SER  17           H        SER  17 -15.707  -5.784  -7.617
    2    HA   SER  17           HA       SER  17 -16.868  -5.054 -10.106
    3    HB2  SER  17           HB2      SER  17 -14.204  -6.334  -9.454
    4    HB3  SER  17           HB3      SER  17 -14.670  -5.841 -11.081
    5    HG   SER  17           HG       SER  17 -13.495  -4.353  -9.391

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LEU  18           H        LEU  18 -16.209  -8.194  -8.686
    2    HA   LEU  18           HA       LEU  18 -16.769  -9.690 -11.050
    3    HB2  LEU  18           HB2      LEU  18 -15.514 -10.644  -9.174
    4    HB3  LEU  18           HB3      LEU  18 -16.928 -10.476  -8.134
    5    HG   LEU  18           HG       LEU  18 -18.157 -12.076  -9.498
    6   HD12  LEU  18          HD11      LEU  18 -16.623 -13.348 -11.208
    7   HD11  LEU  18          HD12      LEU  18 -15.719 -11.834 -11.222
    8   HD13  LEU  18          HD13      LEU  18 -17.418 -11.850 -11.688
    9   HD22  LEU  18          HD21      LEU  18 -16.859 -12.914  -7.656
   10   HD21  LEU  18          HD22      LEU  18 -15.432 -13.042  -8.686
   11   HD23  LEU  18          HD23      LEU  18 -16.835 -14.065  -8.992

  No H/Q in entry =          11
  In of MODEL   56
    1    H    LEU  19           H        LEU  19 -18.753  -8.555  -8.318
    2    HA   LEU  19           HA       LEU  19 -21.189  -9.797  -9.145
    3    HB2  LEU  19           HB2      LEU  19 -20.902  -8.958  -6.886
    4    HB3  LEU  19           HB3      LEU  19 -20.716  -7.316  -7.499
    5    HG   LEU  19           HG       LEU  19 -23.049  -7.238  -8.120
    6   HD11  LEU  19          HD11      LEU  19 -22.924 -10.144  -7.460
    7   HD13  LEU  19          HD12      LEU  19 -23.767  -9.326  -8.774
    8   HD12  LEU  19          HD13      LEU  19 -24.424  -9.273  -7.139
    9   HD21  LEU  19          HD21      LEU  19 -22.560  -8.236  -5.323
   10   HD23  LEU  19          HD22      LEU  19 -24.030  -7.420  -5.857
   11   HD22  LEU  19          HD23      LEU  19 -22.486  -6.567  -5.888

  No H/Q in entry =          11
  In of MODEL   56
    1    H    VAL  20           H        VAL  20 -19.781  -6.593  -9.825
    2    HA   VAL  20           HA       VAL  20 -21.929  -5.596 -11.374
    3    HB   VAL  20           HB       VAL  20 -18.957  -4.924 -11.516
    4   HG11  VAL  20          HG11      VAL  20 -21.300  -3.554 -12.864
    5   HG13  VAL  20          HG12      VAL  20 -19.963  -4.375 -13.669
    6   HG12  VAL  20          HG13      VAL  20 -19.669  -2.891 -12.763
    7   HG21  VAL  20          HG21      VAL  20 -21.317  -3.720 -10.123
    8   HG23  VAL  20          HG22      VAL  20 -19.878  -2.770 -10.483
    9   HG22  VAL  20          HG23      VAL  20 -19.756  -4.198  -9.455

  No H/Q in entry =           9
  In of MODEL   56
    1    H    SER  21           H        SER  21 -19.124  -7.564 -12.433
    2    HA   SER  21           HA       SER  21 -19.928  -7.452 -15.178
    3    HB2  SER  21           HB2      SER  21 -18.442  -9.379 -15.534
    4    HB3  SER  21           HB3      SER  21 -17.640  -8.118 -14.600
    5    HG   SER  21           HG       SER  21 -17.344  -9.527 -13.124

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LYS  22           H        LYS  22 -20.920  -9.685 -12.617
    2    HA   LYS  22           HA       LYS  22 -22.426 -11.331 -14.443
    3    HB2  LYS  22           HB2      LYS  22 -21.607 -11.837 -11.992
    4    HB3  LYS  22           HB3      LYS  22 -23.150 -11.106 -11.555
    5    HG2  LYS  22           HG2      LYS  22 -24.350 -12.783 -12.818
    6    HG3  LYS  22           HG3      LYS  22 -22.834 -13.477 -13.390
    7    HD2  LYS  22           HD2      LYS  22 -22.383 -13.659 -10.770
    8    HD3  LYS  22           HD3      LYS  22 -24.147 -13.696 -10.734
    9    HE2  LYS  22           HE2      LYS  22 -23.220 -15.963 -10.812
   10    HE3  LYS  22           HE3      LYS  22 -24.152 -15.608 -12.267
   11    HZ3  LYS  22           HZ1      LYS  22 -22.314 -15.632 -13.567
   12    HZ2  LYS  22           HZ2      LYS  22 -21.824 -16.751 -12.387
   13    HZ1  LYS  22           HZ3      LYS  22 -21.264 -15.149 -12.323

  No H/Q in entry =          13
  In of MODEL   56
    1    H    MET  23           H        MET  23 -23.214  -8.443 -12.547
    2    HA   MET  23           HA       MET  23 -26.021  -8.588 -13.038
    3    HB2  MET  23           HB2      MET  23 -24.229  -6.239 -12.458
    4    HB3  MET  23           HB3      MET  23 -25.979  -6.112 -12.624
    5    HG2  MET  23           HG2      MET  23 -26.326  -7.440 -10.664
    6    HG3  MET  23           HG3      MET  23 -24.606  -7.809 -10.550
    7    HE2  MET  23           HE1      MET  23 -26.987  -4.226  -9.320
    8    HE1  MET  23           HE2      MET  23 -27.226  -5.189 -10.777
    9    HE3  MET  23           HE3      MET  23 -26.228  -3.737 -10.835

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ARG  24           H        ARG  24 -23.314  -7.078 -14.827
    2    HA   ARG  24           HA       ARG  24 -24.855  -5.799 -16.806
    3    HB2  ARG  24           HB2      ARG  24 -22.012  -6.864 -16.870
    4    HB3  ARG  24           HB3      ARG  24 -22.716  -5.963 -18.189
    5    HG2  ARG  24           HG2      ARG  24 -22.663  -4.739 -15.419
    6    HG3  ARG  24           HG3      ARG  24 -21.224  -4.679 -16.472
    7    HD2  ARG  24           HD2      ARG  24 -24.038  -3.737 -17.205
    8    HD3  ARG  24           HD3      ARG  24 -22.669  -2.704 -16.811
    9    HE   ARG  24           HE       ARG  24 -22.987  -4.045 -19.315
   10   HH21  ARG  24          HH11      ARG  24 -21.080  -4.277 -20.483
   11   HH22  ARG  24          HH12      ARG  24 -19.767  -3.187 -20.203
   12   HH11  ARG  24          HH21      ARG  24 -21.351  -1.833 -17.344
   13   HH12  ARG  24          HH22      ARG  24 -19.941  -1.739 -18.350

  No H/Q in entry =          13
  In of MODEL   56
    1    H    ALA  25           H        ALA  25 -23.651  -9.110 -16.565
    2    HA   ALA  25           HA       ALA  25 -24.274  -9.935 -19.205
    3    HB1  ALA  25           HB1      ALA  25 -23.526 -11.956 -18.531
    4    HB3  ALA  25           HB2      ALA  25 -24.576 -11.972 -17.113
    5    HB2  ALA  25           HB3      ALA  25 -23.041 -11.108 -17.063

  No H/Q in entry =           5
  In of MODEL   56
    1    H    GLN  26           H        GLN  26 -26.083 -10.042 -16.172
    2    HA   GLN  26           HA       GLN  26 -28.403 -11.292 -17.187
    3    HB2  GLN  26           HB2      GLN  26 -27.918  -9.553 -14.787
    4    HB3  GLN  26           HB3      GLN  26 -29.466 -10.310 -15.135
    5    HG2  GLN  26           HG2      GLN  26 -26.844 -11.709 -14.693
    6    HG3  GLN  26           HG3      GLN  26 -28.200 -11.648 -13.575
    7   HE21  GLN  26          HE21      GLN  26 -26.939 -13.772 -14.876
    8   HE22  GLN  26          HE22      GLN  26 -27.961 -14.837 -15.677

  No H/Q in entry =           8
  In of MODEL   56
    1    H    ALA  27           H        ALA  27 -27.546  -7.877 -16.769
    2    HA   ALA  27           HA       ALA  27 -30.065  -6.835 -17.530
    3    HB1  ALA  27           HB1      ALA  27 -28.280  -5.489 -16.413
    4    HB3  ALA  27           HB2      ALA  27 -28.896  -4.723 -17.879
    5    HB2  ALA  27           HB3      ALA  27 -27.341  -5.554 -17.906

  No H/Q in entry =           5
  In of MODEL   56
    1    H    GLU  28           H        GLU  28 -27.346  -7.978 -19.425
    2    HA   GLU  28           HA       GLU  28 -28.320  -6.938 -21.930
    3    HB2  GLU  28           HB2      GLU  28 -25.922  -7.571 -21.324
    4    HB3  GLU  28           HB3      GLU  28 -26.429  -9.245 -21.539
    5    HG2  GLU  28           HG2      GLU  28 -25.313  -8.424 -23.506
    6    HG3  GLU  28           HG3      GLU  28 -27.004  -8.784 -23.848

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LYS  29           H        LYS  29 -28.405 -10.061 -20.301
    2    HA   LYS  29           HA       LYS  29 -29.685 -11.543 -22.313
    3    HB2  LYS  29           HB2      LYS  29 -28.601 -12.521 -20.324
    4    HB3  LYS  29           HB3      LYS  29 -29.883 -11.853 -19.315
    5    HG2  LYS  29           HG2      LYS  29 -31.518 -13.253 -20.387
    6    HG3  LYS  29           HG3      LYS  29 -30.311 -13.850 -21.524
    7    HD2  LYS  29           HD2      LYS  29 -29.132 -15.006 -19.808
    8    HD3  LYS  29           HD3      LYS  29 -30.051 -14.198 -18.540
    9    HE2  LYS  29           HE2      LYS  29 -30.751 -16.560 -18.920
   10    HE3  LYS  29           HE3      LYS  29 -32.058 -15.395 -19.146
   11    HZ1  LYS  29           HZ1      LYS  29 -31.503 -15.493 -21.577
   12    HZ3  LYS  29           HZ2      LYS  29 -32.186 -16.903 -20.922
   13    HZ2  LYS  29           HZ3      LYS  29 -30.520 -16.833 -21.228

  No H/Q in entry =          13
  In of MODEL   56
    1    H    TYR  30           H        TYR  30 -31.111  -9.495 -19.780
    2    HA   TYR  30           HA       TYR  30 -33.769  -9.994 -21.012
    3    HB2  TYR  30           HB2      TYR  30 -33.128  -8.851 -18.284
    4    HB3  TYR  30           HB3      TYR  30 -34.743  -9.141 -18.932
    5    HD1  TYR  30           HD1      TYR  30 -35.600 -11.451 -19.162
    6    HD2  TYR  30           HD2      TYR  30 -31.774 -10.655 -17.472
    7    HE1  TYR  30           HE1      TYR  30 -35.452 -13.783 -18.388
    8    HE2  TYR  30           HE2      TYR  30 -31.628 -12.974 -16.702
    9    HH   TYR  30           HH       TYR  30 -33.217 -15.362 -17.809

  No H/Q in entry =           9
  In of MODEL   56
    1    H    GLU  31           H        GLU  31 -31.655  -7.945 -21.805
    2    HA   GLU  31           HA       GLU  31 -31.636  -5.779 -22.607
    3    HB2  GLU  31           HB2      GLU  31 -34.517  -6.557 -23.112
    4    HB3  GLU  31           HB3      GLU  31 -33.713  -5.163 -23.832
    5    HG2  GLU  31           HG2      GLU  31 -32.213  -6.555 -25.045
    6    HG3  GLU  31           HG3      GLU  31 -32.739  -7.989 -24.168

  No H/Q in entry =           6
  In of MODEL   56
    1    H    VAL  32           H        VAL  32 -31.822  -5.708 -19.873
    2    HA   VAL  32           HA       VAL  32 -33.731  -3.647 -19.183
    3    HB   VAL  32           HB       VAL  32 -31.307  -4.598 -17.625
    4   HG12  VAL  32          HG11      VAL  32 -32.851  -3.830 -15.714
    5   HG11  VAL  32          HG12      VAL  32 -33.713  -2.934 -16.965
    6   HG13  VAL  32          HG13      VAL  32 -32.012  -2.592 -16.650
    7   HG21  VAL  32          HG21      VAL  32 -33.037  -6.354 -18.321
    8   HG23  VAL  32          HG22      VAL  32 -34.090  -5.563 -17.147
    9   HG22  VAL  32          HG23      VAL  32 -32.554  -6.254 -16.628

  No H/Q in entry =           9
  In of MODEL   56
    1    HA   PRO  33           HA       PRO  33 -30.781  -0.630 -20.844
    2    HB2  PRO  33           HB2      PRO  33 -32.346   1.555 -20.690
    3    HB3  PRO  33           HB3      PRO  33 -32.788   0.252 -21.795
    4    HG2  PRO  33           HG2      PRO  33 -33.754   0.717 -18.972
    5    HG3  PRO  33           HG3      PRO  33 -34.720   0.498 -20.430
    6    HD2  PRO  33           HD2      PRO  33 -34.204  -1.578 -18.788
    7    HD3  PRO  33           HD3      PRO  33 -34.270  -1.804 -20.536

  No H/Q in entry =           7
  In of MODEL   56
    1    H    VAL  34           H        VAL  34 -29.493  -1.161 -18.907
    2    HA   VAL  34           HA       VAL  34 -29.261   1.254 -17.238
    3    HB   VAL  34           HB       VAL  34 -28.632  -0.212 -15.318
    4   HG12  VAL  34          HG11      VAL  34 -31.021  -1.148 -15.006
    5   HG11  VAL  34          HG12      VAL  34 -31.364  -0.380 -16.555
    6   HG13  VAL  34          HG13      VAL  34 -30.829   0.596 -15.187
    7   HG21  VAL  34          HG21      VAL  34 -28.778  -2.222 -17.345
    8   HG23  VAL  34          HG22      VAL  34 -29.818  -2.623 -15.977
    9   HG22  VAL  34          HG23      VAL  34 -28.107  -2.295 -15.716

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ILE  35           H        ILE  35 -27.291   1.731 -16.404
    2    HA   ILE  35           HA       ILE  35 -24.961   0.473 -17.693
    3    HB   ILE  35           HB       ILE  35 -25.430   3.344 -16.850
    4   HG12  ILE  35          HG12      ILE  35 -24.429   2.088 -19.414
    5   HG13  ILE  35          HG13      ILE  35 -26.073   2.663 -19.138
    6   HG21  ILE  35          HG21      ILE  35 -22.831   1.880 -17.189
    7   HG23  ILE  35          HG22      ILE  35 -23.309   3.035 -15.946
    8   HG22  ILE  35          HG23      ILE  35 -22.949   3.595 -17.579
    9   HD11  ILE  35          HD11      ILE  35 -24.725   4.887 -18.523
   10   HD13  ILE  35          HD12      ILE  35 -25.261   4.507 -20.160
   11   HD12  ILE  35          HD13      ILE  35 -23.597   4.174 -19.677

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ILE  36           H        ILE  36 -23.696  -0.535 -16.111
    2    HA   ILE  36           HA       ILE  36 -24.136   0.040 -13.231
    3    HB   ILE  36           HB       ILE  36 -23.245  -2.629 -14.372
    4   HG12  ILE  36          HG12      ILE  36 -26.068  -1.903 -13.584
    5   HG13  ILE  36          HG13      ILE  36 -25.507  -1.851 -15.256
    6   HG23  ILE  36          HG21      ILE  36 -23.563  -3.488 -12.265
    7   HG22  ILE  36          HG22      ILE  36 -24.719  -2.238 -11.806
    8   HG21  ILE  36          HG23      ILE  36 -22.998  -1.861 -11.883
    9   HD13  ILE  36          HD11      ILE  36 -25.616  -4.067 -15.483
   10   HD12  ILE  36          HD12      ILE  36 -26.676  -3.986 -14.077
   11   HD11  ILE  36          HD13      ILE  36 -24.966  -4.364 -13.871

  No H/Q in entry =          11
  In of MODEL   56
    1    H    GLU  37           H        GLU  37 -22.365   0.704 -12.131
    2    HA   GLU  37           HA       GLU  37 -19.660  -0.014 -13.069
    3    HB2  GLU  37           HB2      GLU  37 -20.627   2.745 -12.338
    4    HB3  GLU  37           HB3      GLU  37 -18.926   2.298 -12.480
    5    HG2  GLU  37           HG2      GLU  37 -19.200   1.874 -14.836
    6    HG3  GLU  37           HG3      GLU  37 -20.927   2.217 -14.719

  No H/Q in entry =           6
  In of MODEL   56
    1    H    ALA  38           H        ALA  38 -18.157  -0.230 -11.398
    2    HA   ALA  38           HA       ALA  38 -19.176  -0.105  -8.619
    3    HB1  ALA  38           HB1      ALA  38 -17.421  -1.984 -10.074
    4    HB3  ALA  38           HB2      ALA  38 -18.455  -2.262  -8.674
    5    HB2  ALA  38           HB3      ALA  38 -16.861  -1.539  -8.462

  No H/Q in entry =           5
  In of MODEL   56
    1    H    PHE  39           H        PHE  39 -17.960   1.122  -7.141
    2    HA   PHE  39           HA       PHE  39 -15.473   2.400  -8.039
    3    HB2  PHE  39           HB2      PHE  39 -17.916   3.815  -6.986
    4    HB3  PHE  39           HB3      PHE  39 -16.304   4.525  -6.917
    5    HD1  PHE  39           HD1      PHE  39 -15.020   4.585  -9.191
    6    HD2  PHE  39           HD2      PHE  39 -19.252   4.249  -8.793
    7    HE1  PHE  39           HE1      PHE  39 -15.294   5.467 -11.490
    8    HE2  PHE  39           HE2      PHE  39 -19.542   5.121 -11.084
    9    HZ   PHE  39           HZ       PHE  39 -17.568   5.703 -12.452

  No H/Q in entry =           9
  In of MODEL   56
    1    HA   PRO  40           HA       PRO  40 -14.489   1.630  -3.766
    2    HB2  PRO  40           HB2      PRO  40 -12.776   3.687  -3.150
    3    HB3  PRO  40           HB3      PRO  40 -12.301   2.378  -4.232
    4    HG2  PRO  40           HG2      PRO  40 -13.403   5.092  -4.947
    5    HG3  PRO  40           HG3      PRO  40 -11.960   4.294  -5.571
    6    HD2  PRO  40           HD2      PRO  40 -14.187   4.161  -6.965
    7    HD3  PRO  40           HD3      PRO  40 -13.192   2.716  -6.795

  No H/Q in entry =           7
  In of MODEL   56
    1    H    GLU  41           H        GLU  41 -15.125   2.569  -1.623
    2    HA   GLU  41           HA       GLU  41 -17.417   4.207  -1.577
    3    HB2  GLU  41           HB2      GLU  41 -17.382   3.955   0.730
    4    HB3  GLU  41           HB3      GLU  41 -16.516   2.520   0.178
    5    HG2  GLU  41           HG2      GLU  41 -15.281   5.037   1.291
    6    HG3  GLU  41           HG3      GLU  41 -15.440   3.492   2.126

  No H/Q in entry =           6
  In of MODEL   56
    1    H    THR  42           H        THR  42 -14.113   5.219  -1.637
    2    HA   THR  42           HA       THR  42 -14.531   7.756  -0.398
    3    HB   THR  42           HB       THR  42 -12.398   8.403  -1.496
    4    HG1  THR  42           HG1      THR  42 -12.029   7.420  -3.313
    5   HG23  THR  42          HG21      THR  42 -11.042   6.977  -0.222
    6   HG22  THR  42          HG22      THR  42 -12.081   5.580  -0.510
    7   HG21  THR  42          HG23      THR  42 -12.604   6.855   0.588

  No H/Q in entry =           7
  In of MODEL   56
    1    H    LEU  43           H        LEU  43 -15.423   6.668  -3.504
    2    HA   LEU  43           HA       LEU  43 -15.760   9.441  -4.446
    3    HB2  LEU  43           HB2      LEU  43 -16.055   6.798  -5.862
    4    HB3  LEU  43           HB3      LEU  43 -16.317   8.376  -6.602
    5    HG   LEU  43           HG       LEU  43 -13.665   7.363  -5.607
    6   HD12  LEU  43          HD11      LEU  43 -14.395   7.794  -8.476
    7   HD11  LEU  43          HD12      LEU  43 -14.807   6.273  -7.684
    8   HD13  LEU  43          HD13      LEU  43 -13.123   6.787  -7.783
    9   HD21  LEU  43          HD21      LEU  43 -14.614   9.890  -6.923
   10   HD23  LEU  43          HD22      LEU  43 -12.956   9.329  -7.149
   11   HD22  LEU  43          HD23      LEU  43 -13.552   9.692  -5.530

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ALA  44           H        ALA  44 -17.642   7.543  -2.599
    2    HA   ALA  44           HA       ALA  44 -20.123   7.344  -3.908
    3    HB2  ALA  44           HB1      ALA  44 -19.940   6.212  -1.824
    4    HB3  ALA  44           HB2      ALA  44 -21.084   7.522  -1.533
    5    HB1  ALA  44           HB3      ALA  44 -19.413   7.673  -0.989

  No H/Q in entry =           5
  In of MODEL   56
    1    H    GLY  45           H        GLY  45 -18.775  10.170  -2.357
    2    HA3  GLY  45           HA2      GLY  45 -21.255  11.602  -2.690
    3    HA2  GLY  45           HA3      GLY  45 -19.726  12.265  -2.115

  No H/Q in entry =           3
  In of MODEL   56
    1    H    GLU  46           H        GLU  46 -18.183  11.395  -4.423
    2    HA   GLU  46           HA       GLU  46 -18.893  13.609  -6.167
    3    HB2  GLU  46           HB2      GLU  46 -16.638  11.597  -6.207
    4    HB3  GLU  46           HB3      GLU  46 -16.816  12.904  -7.379
    5    HG2  GLU  46           HG2      GLU  46 -16.544  14.551  -5.636
    6    HG3  GLU  46           HG3      GLU  46 -16.477  13.285  -4.411

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LYS  47           H        LYS  47 -18.676  10.099  -6.637
    2    HA   LYS  47           HA       LYS  47 -19.795  10.313  -9.304
    3    HB2  LYS  47           HB2      LYS  47 -19.154   7.920  -7.572
    4    HB3  LYS  47           HB3      LYS  47 -19.723   7.831  -9.239
    5    HG2  LYS  47           HG2      LYS  47 -17.215   9.282  -8.482
    6    HG3  LYS  47           HG3      LYS  47 -17.237   7.557  -8.849
    7    HD2  LYS  47           HD2      LYS  47 -18.252   8.056 -11.035
    8    HD3  LYS  47           HD3      LYS  47 -18.162   9.777 -10.667
    9    HE2  LYS  47           HE2      LYS  47 -15.731   9.618 -10.506
   10    HE3  LYS  47           HE3      LYS  47 -15.819   7.893 -10.862
   11    HZ3  LYS  47           HZ1      LYS  47 -16.328   8.264 -13.020
   12    HZ2  LYS  47           HZ2      LYS  47 -15.393   9.650 -12.727
   13    HZ1  LYS  47           HZ3      LYS  47 -17.089   9.753 -12.721

  No H/Q in entry =          13
  In of MODEL   56
    1    H    GLY  48           H        GLY  48 -21.078   9.488  -6.156
    2    HA3  GLY  48           HA2      GLY  48 -23.432   8.242  -6.895
    3    HA2  GLY  48           HA3      GLY  48 -23.227   9.228  -5.448

  No H/Q in entry =           3
  In of MODEL   56
    1    H    GLN  49           H        GLN  49 -22.722  11.682  -6.998
    2    HA   GLN  49           HA       GLN  49 -25.313  12.721  -7.117
    3    HB2  GLN  49           HB2      GLN  49 -22.803  13.670  -8.483
    4    HB3  GLN  49           HB3      GLN  49 -24.292  14.593  -8.382
    5    HG2  GLN  49           HG2      GLN  49 -24.118  14.597  -5.945
    6    HG3  GLN  49           HG3      GLN  49 -22.642  13.654  -6.045
    7   HE21  GLN  49          HE21      GLN  49 -22.581  15.873  -4.752
    8   HE22  GLN  49          HE22      GLN  49 -21.698  17.160  -5.392

  No H/Q in entry =           8
  In of MODEL   56
    1    H    ASN  50           H        ASN  50 -23.595  10.913  -9.532
    2    HA   ASN  50           HA       ASN  50 -25.515  11.751 -11.595
    3    HB2  ASN  50           HB2      ASN  50 -22.894  10.287 -11.857
    4    HB3  ASN  50           HB3      ASN  50 -23.963  10.696 -13.191
    5   HD21  ASN  50          HD21      ASN  50 -21.343  11.600 -11.587
    6   HD22  ASN  50          HD22      ASN  50 -21.157  13.245 -11.914

  No H/Q in entry =           6
  In of MODEL   56
    1    H    ALA  51           H        ALA  51 -25.420   9.375  -9.371
    2    HA   ALA  51           HA       ALA  51 -26.155   7.226 -11.214
    3    HB2  ALA  51           HB1      ALA  51 -25.524   5.878  -9.544
    4    HB3  ALA  51           HB2      ALA  51 -26.662   6.644  -8.437
    5    HB1  ALA  51           HB3      ALA  51 -25.043   7.312  -8.638

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ASP  52           H        ASP  52 -28.130   6.114 -11.074
    2    HA   ASP  52           HA       ASP  52 -30.356   7.879 -10.378
    3    HB2  ASP  52           HB2      ASP  52 -30.106   5.396 -12.073
    4    HB3  ASP  52           HB3      ASP  52 -31.668   6.081 -11.623

  No H/Q in entry =           4
  In of MODEL   56
    1    H    VAL  53           H        VAL  53 -28.671   5.025  -9.399
    2    HA   VAL  53           HA       VAL  53 -30.099   5.089  -6.874
    3    HB   VAL  53           HB       VAL  53 -31.459   3.422  -8.125
    4   HG11  VAL  53          HG11      VAL  53 -29.699   2.625  -9.666
    5   HG13  VAL  53          HG12      VAL  53 -30.491   1.299  -8.815
    6   HG12  VAL  53          HG13      VAL  53 -28.893   1.841  -8.308
    7   HG23  VAL  53          HG21      VAL  53 -30.574   1.451  -6.457
    8   HG22  VAL  53          HG22      VAL  53 -31.736   2.721  -6.071
    9   HG21  VAL  53          HG23      VAL  53 -30.032   2.936  -5.673

  No H/Q in entry =           9
  In of MODEL   56
    1    H    VAL  54           H        VAL  54 -28.765   4.676  -5.230
    2    HA   VAL  54           HA       VAL  54 -25.986   3.908  -5.866
    3    HB   VAL  54           HB       VAL  54 -27.090   5.635  -3.593
    4   HG11  VAL  54          HG11      VAL  54 -24.476   4.289  -3.912
    5   HG13  VAL  54          HG12      VAL  54 -25.239   4.934  -2.459
    6   HG12  VAL  54          HG13      VAL  54 -24.369   6.012  -3.550
    7   HG22  VAL  54          HG21      VAL  54 -26.287   7.482  -4.679
    8   HG21  VAL  54          HG22      VAL  54 -26.816   6.490  -6.038
    9   HG23  VAL  54          HG23      VAL  54 -25.107   6.557  -5.610

  No H/Q in entry =           9
  In of MODEL   56
    1    H    LEU  55           H        LEU  55 -25.339   1.997  -5.245
    2    HA   LEU  55           HA       LEU  55 -26.799   0.625  -3.073
    3    HB2  LEU  55           HB2      LEU  55 -25.225  -0.479  -5.389
    4    HB3  LEU  55           HB3      LEU  55 -25.953  -1.445  -4.105
    5    HG   LEU  55           HG       LEU  55 -27.444   0.124  -6.199
    6   HD13  LEU  55          HD11      LEU  55 -27.103  -1.709  -7.438
    7   HD12  LEU  55          HD12      LEU  55 -28.029  -2.620  -6.246
    8   HD11  LEU  55          HD13      LEU  55 -26.275  -2.510  -6.105
    9   HD23  LEU  55          HD21      LEU  55 -28.675  -1.874  -4.355
   10   HD22  LEU  55          HD22      LEU  55 -29.412  -0.502  -5.186
   11   HD21  LEU  55          HD23      LEU  55 -28.391  -0.233  -3.773

  No H/Q in entry =          11
  In of MODEL   56
    1    H    LEU  56           H        LEU  56 -25.621   0.045  -1.281
    2    HA   LEU  56           HA       LEU  56 -22.698   0.519  -1.343
    3    HB2  LEU  56           HB2      LEU  56 -24.481   0.237   1.064
    4    HB3  LEU  56           HB3      LEU  56 -22.783   0.712   1.046
    5    HG   LEU  56           HG       LEU  56 -25.131   2.338   0.112
    6   HD11  LEU  56          HD11      LEU  56 -23.991   1.962   2.622
    7   HD13  LEU  56          HD12      LEU  56 -25.021   3.309   2.136
    8   HD12  LEU  56          HD13      LEU  56 -23.267   3.462   2.039
    9   HD23  LEU  56          HD21      LEU  56 -23.234   4.089  -0.077
   10   HD22  LEU  56          HD22      LEU  56 -23.595   2.995  -1.412
   11   HD21  LEU  56          HD23      LEU  56 -22.227   2.668  -0.350

  No H/Q in entry =          11
  In of MODEL   56
    1    H    GLY  57           H        GLY  57 -21.273  -1.079  -0.833
    2    HA3  GLY  57           HA2      GLY  57 -22.126  -3.787  -1.052
    3    HA2  GLY  57           HA3      GLY  57 -20.513  -3.255  -0.579

  No H/Q in entry =           3
  In of MODEL   56
    1    HA   PRO  58           HA       PRO  58 -23.272  -4.402   3.139
    2    HB2  PRO  58           HB2      PRO  58 -22.516  -6.993   3.718
    3    HB3  PRO  58           HB3      PRO  58 -23.916  -6.613   2.716
    4    HG2  PRO  58           HG2      PRO  58 -21.172  -7.413   1.906
    5    HG3  PRO  58           HG3      PRO  58 -22.728  -7.908   1.239
    6    HD2  PRO  58           HD2      PRO  58 -21.175  -6.038   0.024
    7    HD3  PRO  58           HD3      PRO  58 -22.936  -5.997  -0.067

  No H/Q in entry =           7
  In of MODEL   56
    1    H    GLN  59           H        GLN  59 -19.894  -4.780   2.509
    2    HA   GLN  59           HA       GLN  59 -19.122  -4.804   5.265
    3    HB2  GLN  59           HB2      GLN  59 -17.590  -3.928   2.812
    4    HB3  GLN  59           HB3      GLN  59 -16.904  -4.053   4.420
    5    HG2  GLN  59           HG2      GLN  59 -18.070  -6.327   2.823
    6    HG3  GLN  59           HG3      GLN  59 -16.359  -5.985   3.018
    7   HE21  GLN  59          HE21      GLN  59 -18.485  -7.844   3.942
    8   HE22  GLN  59          HE22      GLN  59 -18.234  -8.497   5.451

  No H/Q in entry =           8
  In of MODEL   56
    1    H    ILE  60           H        ILE  60 -20.135  -2.258   3.087
    2    HA   ILE  60           HA       ILE  60 -19.321  -0.299   5.146
    3    HB   ILE  60           HB       ILE  60 -19.614   1.441   3.335
    4   HG12  ILE  60          HG12      ILE  60 -19.353  -0.757   1.329
    5   HG13  ILE  60          HG13      ILE  60 -20.956  -0.283   1.893
    6   HG22  ILE  60          HG21      ILE  60 -17.539  -0.568   2.573
    7   HG21  ILE  60          HG22      ILE  60 -17.446   0.371   4.062
    8   HG23  ILE  60          HG23      ILE  60 -17.459   1.192   2.502
    9   HD13  ILE  60          HD11      ILE  60 -20.706   1.047   0.006
   10   HD12  ILE  60          HD12      ILE  60 -18.979   1.282   0.275
   11   HD11  ILE  60          HD13      ILE  60 -20.153   2.135   1.279

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ALA  61           H        ALA  61 -21.734  -1.948   5.214
    2    HA   ALA  61           HA       ALA  61 -24.005  -0.337   4.784
    3    HB1  ALA  61           HB1      ALA  61 -25.175  -1.870   6.102
    4    HB2  ALA  61           HB2      ALA  61 -23.760  -2.232   7.093
    5    HB3  ALA  61           HB3      ALA  61 -23.851  -2.826   5.435

  No H/Q in entry =           5
  In of MODEL   56
    1    H    TYR  62           H        TYR  62 -21.779  -0.418   7.568
    2    HA   TYR  62           HA       TYR  62 -23.366   1.183   9.263
    3    HB2  TYR  62           HB2      TYR  62 -21.349   1.624  10.506
    4    HB3  TYR  62           HB3      TYR  62 -21.327  -0.059   9.981
    5    HD1  TYR  62           HD1      TYR  62 -19.718  -0.820   8.274
    6    HD2  TYR  62           HD2      TYR  62 -19.700   3.224   9.656
    7    HE1  TYR  62           HE1      TYR  62 -17.518  -0.473   7.216
    8    HE2  TYR  62           HE2      TYR  62 -17.485   3.566   8.599
    9    HH   TYR  62           HH       TYR  62 -16.141   1.218   6.455

  No H/Q in entry =           9
  In of MODEL   56
    1    H    MET  63           H        MET  63 -21.764   2.110   6.406
    2    HA   MET  63           HA       MET  63 -21.664   4.939   7.125
    3    HB2  MET  63           HB2      MET  63 -21.025   3.446   4.581
    4    HB3  MET  63           HB3      MET  63 -20.895   5.197   4.757
    5    HG2  MET  63           HG2      MET  63 -19.171   4.906   6.444
    6    HG3  MET  63           HG3      MET  63 -19.305   3.156   6.287
    7    HE1  MET  63           HE1      MET  63 -16.862   3.850   6.196
    8    HE3  MET  63           HE2      MET  63 -15.974   4.272   4.732
    9    HE2  MET  63           HE3      MET  63 -16.588   2.632   4.949

  No H/Q in entry =           9
  In of MODEL   56
    1    H    LEU  64           H        LEU  64 -24.187   3.030   6.158
    2    HA   LEU  64           HA       LEU  64 -25.445   4.436   4.101
    3    HB2  LEU  64           HB2      LEU  64 -26.255   2.301   5.004
    4    HB3  LEU  64           HB3      LEU  64 -26.723   3.117   6.494
    5    HG   LEU  64           HG       LEU  64 -28.456   4.341   5.288
    6   HD13  LEU  64          HD11      LEU  64 -28.194   4.610   3.056
    7   HD12  LEU  64          HD12      LEU  64 -28.800   2.960   2.899
    8   HD11  LEU  64          HD13      LEU  64 -27.063   3.262   2.950
    9   HD23  LEU  64          HD21      LEU  64 -28.910   1.523   4.517
   10   HD22  LEU  64          HD22      LEU  64 -29.919   2.623   5.454
   11   HD21  LEU  64          HD23      LEU  64 -28.520   1.858   6.204

  No H/Q in entry =          11
  In of MODEL   56
    1    HA   PRO  65           HA       PRO  65 -27.685   7.509   6.895
    2    HB2  PRO  65           HB2      PRO  65 -25.674   7.696   9.138
    3    HB3  PRO  65           HB3      PRO  65 -27.420   7.934   9.197
    4    HG2  PRO  65           HG2      PRO  65 -26.429   5.695  10.097
    5    HG3  PRO  65           HG3      PRO  65 -27.854   5.636   9.060
    6    HD2  PRO  65           HD2      PRO  65 -24.972   5.099   8.333
    7    HD3  PRO  65           HD3      PRO  65 -26.411   4.182   7.887

  No H/Q in entry =           7
  In of MODEL   56
    1    H    GLU  66           H        GLU  66 -24.128   7.540   6.945
    2    HA   GLU  66           HA       GLU  66 -23.901  10.348   6.565
    3    HB2  GLU  66           HB2      GLU  66 -22.037   8.091   5.880
    4    HB3  GLU  66           HB3      GLU  66 -21.629   9.795   5.686
    5    HG2  GLU  66           HG2      GLU  66 -21.834  10.139   8.058
    6    HG3  GLU  66           HG3      GLU  66 -22.319   8.457   8.278

  No H/Q in entry =           6
  In of MODEL   56
    1    H    ILE  67           H        ILE  67 -23.951   7.622   4.288
    2    HA   ILE  67           HA       ILE  67 -23.590   9.361   2.008
    3    HB   ILE  67           HB       ILE  67 -24.419   6.432   2.166
    4   HG12  ILE  67          HG12      ILE  67 -21.823   7.672   1.238
    5   HG13  ILE  67          HG13      ILE  67 -22.098   7.230   2.923
    6   HG21  ILE  67          HG21      ILE  67 -24.420   8.331  -0.042
    7   HG23  ILE  67          HG22      ILE  67 -25.006   6.669  -0.002
    8   HG22  ILE  67          HG23      ILE  67 -23.307   6.996  -0.339
    9   HD12  ILE  67          HD11      ILE  67 -21.652   5.490   0.553
   10   HD11  ILE  67          HD12      ILE  67 -22.644   4.881   1.877
   11   HD13  ILE  67          HD13      ILE  67 -20.980   5.382   2.180

  No H/Q in entry =          11
  In of MODEL   56
    1    H    GLN  68           H        GLN  68 -26.424   8.226   3.649
    2    HA   GLN  68           HA       GLN  68 -28.288   9.133   1.696
    3    HB2  GLN  68           HB2      GLN  68 -28.515   8.742   4.677
    4    HB3  GLN  68           HB3      GLN  68 -29.855   9.316   3.698
    5    HG2  GLN  68           HG2      GLN  68 -29.845   7.298   2.403
    6    HG3  GLN  68           HG3      GLN  68 -28.379   6.747   3.190
    7   HE21  GLN  68          HE21      GLN  68 -30.528   5.342   3.056
    8   HE22  GLN  68          HE22      GLN  68 -31.337   4.854   4.472

  No H/Q in entry =           8
  In of MODEL   56
    1    H    ARG  69           H        ARG  69 -26.701  10.809   4.439
    2    HA   ARG  69           HA       ARG  69 -28.121  13.265   4.066
    3    HB2  ARG  69           HB2      ARG  69 -25.747  12.371   5.630
    4    HB3  ARG  69           HB3      ARG  69 -25.865  14.092   5.288
    5    HG2  ARG  69           HG2      ARG  69 -28.176  14.075   6.275
    6    HG3  ARG  69           HG3      ARG  69 -27.928  12.387   6.732
    7    HD2  ARG  69           HD2      ARG  69 -26.280  14.769   7.656
    8    HD3  ARG  69           HD3      ARG  69 -27.383  13.829   8.649
    9    HE   ARG  69           HE       ARG  69 -24.758  12.962   7.674
   10   HH21  ARG  69          HH11      ARG  69 -23.905  11.206   8.848
   11   HH22  ARG  69          HH12      ARG  69 -24.908  10.358   9.976
   12   HH11  ARG  69          HH21      ARG  69 -27.691  12.336   9.386
   13   HH12  ARG  69          HH22      ARG  69 -27.052  10.995  10.278

  No H/Q in entry =          13
  In of MODEL   56
    1    H    LEU  70           H        LEU  70 -25.231  11.933   2.672
    2    HA   LEU  70           HA       LEU  70 -24.176  14.332   1.521
    3    HB2  LEU  70           HB2      LEU  70 -23.129  12.029   2.087
    4    HB3  LEU  70           HB3      LEU  70 -23.744  11.566   0.501
    5    HG   LEU  70           HG       LEU  70 -22.188  12.981  -0.582
    6   HD11  LEU  70          HD11      LEU  70 -21.363  13.816   2.208
    7   HD13  LEU  70          HD12      LEU  70 -22.089  14.847   0.974
    8   HD12  LEU  70          HD13      LEU  70 -20.465  14.201   0.738
    9   HD22  LEU  70          HD21      LEU  70 -20.717  11.293  -0.375
   10   HD21  LEU  70          HD22      LEU  70 -21.622  10.738   1.032
   11   HD23  LEU  70          HD23      LEU  70 -20.259  11.837   1.238

  No H/Q in entry =          11
  In of MODEL   56
    1    H    LEU  71           H        LEU  71 -26.284  11.755   0.395
    2    HA   LEU  71           HA       LEU  71 -26.856  13.256  -2.104
    3    HB2  LEU  71           HB2      LEU  71 -26.999  10.264  -1.685
    4    HB3  LEU  71           HB3      LEU  71 -27.155  11.136  -3.209
    5    HG   LEU  71           HG       LEU  71 -24.624  11.183  -1.564
    6   HD12  LEU  71          HD11      LEU  71 -24.662   9.578  -4.012
    7   HD11  LEU  71          HD12      LEU  71 -25.651   8.922  -2.709
    8   HD13  LEU  71          HD13      LEU  71 -23.936   9.233  -2.442
    9   HD22  LEU  71          HD21      LEU  71 -24.773  13.011  -3.040
   10   HD21  LEU  71          HD22      LEU  71 -25.260  11.972  -4.379
   11   HD23  LEU  71          HD23      LEU  71 -23.631  11.850  -3.713

  No H/Q in entry =          11
  In of MODEL   56
    1    HA   PRO  72           HA       PRO  72 -30.694  12.708   0.540
    2    HB2  PRO  72           HB2      PRO  72 -31.600  15.253   0.489
    3    HB3  PRO  72           HB3      PRO  72 -30.275  14.815   1.567
    4    HG2  PRO  72           HG2      PRO  72 -30.131  16.040  -1.176
    5    HG3  PRO  72           HG3      PRO  72 -29.364  16.590   0.313
    6    HD2  PRO  72           HD2      PRO  72 -28.011  15.074  -1.478
    7    HD3  PRO  72           HD3      PRO  72 -27.741  14.895   0.255

  No H/Q in entry =           7
  In of MODEL   56
    1    H    ASN  73           H        ASN  73 -30.111  13.705  -2.669
    2    HA   ASN  73           HA       ASN  73 -32.970  13.351  -3.285
    3    HB2  ASN  73           HB2      ASN  73 -32.539  14.485  -5.375
    4    HB3  ASN  73           HB3      ASN  73 -32.025  15.461  -4.008
    5   HD21  ASN  73          HD21      ASN  73 -31.248  15.546  -6.690
    6   HD22  ASN  73          HD22      ASN  73 -29.579  15.417  -6.895

  No H/Q in entry =           6
  In of MODEL   56
    1    H    LYS  74           H        LYS  74 -30.946  11.127  -2.896
    2    HA   LYS  74           HA       LYS  74 -31.508   9.746  -5.453
    3    HB2  LYS  74           HB2      LYS  74 -28.959   9.483  -3.852
    4    HB3  LYS  74           HB3      LYS  74 -29.339   8.678  -5.375
    5    HG2  LYS  74           HG2      LYS  74 -29.124  11.650  -5.147
    6    HG3  LYS  74           HG3      LYS  74 -27.734  10.615  -5.470
    7    HD2  LYS  74           HD2      LYS  74 -28.849   9.686  -7.415
    8    HD3  LYS  74           HD3      LYS  74 -30.283  10.656  -7.076
    9    HE2  LYS  74           HE2      LYS  74 -29.094  12.686  -7.507
   10    HE3  LYS  74           HE3      LYS  74 -27.560  11.824  -7.617
   11    HZ2  LYS  74           HZ1      LYS  74 -29.054  12.421  -9.727
   12    HZ1  LYS  74           HZ2      LYS  74 -29.682  10.885  -9.364
   13    HZ3  LYS  74           HZ3      LYS  74 -28.021  11.076  -9.670

  No H/Q in entry =          13
  In of MODEL   56
    1    HA   PRO  75           HA       PRO  75 -32.831   6.710  -2.501
    2    HB2  PRO  75           HB2      PRO  75 -33.115   4.502  -4.102
    3    HB3  PRO  75           HB3      PRO  75 -34.264   5.838  -4.151
    4    HG2  PRO  75           HG2      PRO  75 -31.929   5.297  -5.943
    5    HG3  PRO  75           HG3      PRO  75 -33.588   5.711  -6.376
    6    HD2  PRO  75           HD2      PRO  75 -31.677   7.607  -6.327
    7    HD3  PRO  75           HD3      PRO  75 -33.312   7.975  -5.775

  No H/Q in entry =           7
  In of MODEL   56
    1    H    VAL  76           H        VAL  76 -31.351   5.666  -1.149
    2    HA   VAL  76           HA       VAL  76 -28.875   4.508  -2.283
    3    HB   VAL  76           HB       VAL  76 -29.169   5.945   0.389
    4   HG11  VAL  76          HG11      VAL  76 -26.801   4.708  -1.030
    5   HG13  VAL  76          HG12      VAL  76 -27.479   4.233   0.528
    6   HG12  VAL  76          HG13      VAL  76 -26.660   5.785   0.362
    7   HG22  VAL  76          HG21      VAL  76 -28.538   7.864  -0.484
    8   HG21  VAL  76          HG22      VAL  76 -29.079   7.174  -2.015
    9   HG23  VAL  76          HG23      VAL  76 -27.373   7.110  -1.572

  No H/Q in entry =           9
  In of MODEL   56
    1    H    GLU  77           H        GLU  77 -28.618   2.352  -1.692
    2    HA   GLU  77           HA       GLU  77 -29.375   1.527   0.960
    3    HB2  GLU  77           HB2      GLU  77 -30.957  -0.141   0.424
    4    HB3  GLU  77           HB3      GLU  77 -31.537   1.379  -0.260
    5    HG2  GLU  77           HG2      GLU  77 -30.930   0.651  -2.458
    6    HG3  GLU  77           HG3      GLU  77 -30.259  -0.841  -1.804

  No H/Q in entry =           6
  In of MODEL   56
    1    H    VAL  78           H        VAL  78 -29.008  -0.560   1.598
    2    HA   VAL  78           HA       VAL  78 -26.336  -1.278   0.685
    3    HB   VAL  78           HB       VAL  78 -28.013  -2.212   3.053
    4   HG11  VAL  78          HG11      VAL  78 -25.661  -3.393   1.902
    5   HG13  VAL  78          HG12      VAL  78 -26.552  -3.892   3.342
    6   HG12  VAL  78          HG13      VAL  78 -25.250  -2.709   3.474
    7   HG22  VAL  78          HG21      VAL  78 -26.568  -0.838   4.395
    8   HG21  VAL  78          HG22      VAL  78 -27.329   0.131   3.133
    9   HG23  VAL  78          HG23      VAL  78 -25.645  -0.367   2.968

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ILE  79           H        ILE  79 -25.773  -3.169  -0.241
    2    HA   ILE  79           HA       ILE  79 -27.817  -4.670  -1.589
    3    HB   ILE  79           HB       ILE  79 -24.818  -5.148  -1.392
    4   HG12  ILE  79          HG12      ILE  79 -26.487  -4.051  -3.660
    5   HG13  ILE  79          HG13      ILE  79 -25.623  -3.037  -2.503
    6   HG22  ILE  79          HG21      ILE  79 -25.915  -6.325  -3.715
    7   HG21  ILE  79          HG22      ILE  79 -26.881  -6.875  -2.346
    8   HG23  ILE  79          HG23      ILE  79 -25.136  -7.125  -2.349
    9   HD13  ILE  79          HD11      ILE  79 -24.219  -3.111  -4.332
   10   HD12  ILE  79          HD12      ILE  79 -24.532  -4.821  -4.626
   11   HD11  ILE  79          HD13      ILE  79 -23.547  -4.329  -3.247

  No H/Q in entry =          11
  In of MODEL   56
    1    H    ASP  80           H        ASP  80 -28.646  -6.612  -1.018
    2    HA   ASP  80           HA       ASP  80 -28.561  -7.534   1.620
    3    HB2  ASP  80           HB2      ASP  80 -30.316  -8.125  -0.013
    4    HB3  ASP  80           HB3      ASP  80 -29.146  -9.105  -0.898

  No H/Q in entry =           4
  In of MODEL   56
    1    H    SER  81           H        SER  81 -26.999  -8.653   2.730
    2    HA   SER  81           HA       SER  81 -24.499  -9.283   1.516
    3    HB2  SER  81           HB2      SER  81 -23.915 -10.320   3.672
    4    HB3  SER  81           HB3      SER  81 -24.645  -8.732   3.906
    5    HG   SER  81           HG       SER  81 -26.503  -9.671   4.550

  No H/Q in entry =           5
  In of MODEL   56
    1    H    LEU  82           H        LEU  82 -27.172 -11.422   1.837
    2    HA   LEU  82           HA       LEU  82 -25.589 -13.760   1.285
    3    HB2  LEU  82           HB2      LEU  82 -28.537 -13.192   1.051
    4    HB3  LEU  82           HB3      LEU  82 -27.806 -14.781   0.828
    5    HG   LEU  82           HG       LEU  82 -27.755 -13.216   3.390
    6   HD11  LEU  82          HD11      LEU  82 -29.516 -15.460   2.391
    7   HD13  LEU  82          HD12      LEU  82 -30.018 -13.874   2.980
    8   HD12  LEU  82          HD13      LEU  82 -29.347 -15.059   4.101
    9   HD21  LEU  82          HD21      LEU  82 -26.758 -15.895   2.465
   10   HD23  LEU  82          HD22      LEU  82 -27.119 -15.599   4.165
   11   HD22  LEU  82          HD23      LEU  82 -25.890 -14.636   3.345

  No H/Q in entry =          11
  In of MODEL   56
    1    H    LEU  83           H        LEU  83 -27.596 -11.551  -0.601
    2    HA   LEU  83           HA       LEU  83 -27.389 -12.884  -3.085
    3    HB2  LEU  83           HB2      LEU  83 -27.843  -9.990  -2.410
    4    HB3  LEU  83           HB3      LEU  83 -27.875 -10.620  -4.055
    5    HG   LEU  83           HG       LEU  83 -29.888 -11.060  -1.869
    6   HD13  LEU  83          HD11      LEU  83 -30.682  -9.216  -2.912
    7   HD12  LEU  83          HD12      LEU  83 -31.134 -10.326  -4.204
    8   HD11  LEU  83          HD13      LEU  83 -29.615  -9.435  -4.299
    9   HD23  LEU  83          HD21      LEU  83 -30.024 -12.297  -4.604
   10   HD22  LEU  83          HD22      LEU  83 -30.979 -12.675  -3.171
   11   HD21  LEU  83          HD23      LEU  83 -29.282 -13.150  -3.250

  No H/Q in entry =          11
  In of MODEL   56
    1    H    TYR  84           H        TYR  84 -25.465 -10.481  -1.401
    2    HA   TYR  84           HA       TYR  84 -23.625  -9.945  -3.540
    3    HB2  TYR  84           HB2      TYR  84 -24.156  -8.487  -1.497
    4    HB3  TYR  84           HB3      TYR  84 -23.105  -9.576  -0.593
    5    HD1  TYR  84           HD1      TYR  84 -20.745  -9.372  -0.699
    6    HD2  TYR  84           HD2      TYR  84 -23.188  -7.147  -3.403
    7    HE1  TYR  84           HE1      TYR  84 -18.757  -8.096  -1.426
    8    HE2  TYR  84           HE2      TYR  84 -21.207  -5.872  -4.147
    9    HH   TYR  84           HH       TYR  84 -18.210  -6.763  -3.786

  No H/Q in entry =           9
  In of MODEL   56
    1    H    GLY  85           H        GLY  85 -23.333 -11.967  -0.612
    2    HA3  GLY  85           HA2      GLY  85 -20.743 -12.864  -1.120
    3    HA2  GLY  85           HA3      GLY  85 -21.953 -13.738  -0.182

  No H/Q in entry =           3
  In of MODEL   56
    1    H    LYS  86           H        LYS  86 -23.807 -14.125  -2.233
    2    HA   LYS  86           HA       LYS  86 -22.723 -16.471  -3.519
    3    HB2  LYS  86           HB2      LYS  86 -25.391 -15.065  -3.567
    4    HB3  LYS  86           HB3      LYS  86 -25.072 -16.594  -4.385
    5    HG2  LYS  86           HG2      LYS  86 -24.731 -17.689  -2.285
    6    HG3  LYS  86           HG3      LYS  86 -24.921 -16.160  -1.427
    7    HD2  LYS  86           HD2      LYS  86 -27.054 -17.171  -1.332
    8    HD3  LYS  86           HD3      LYS  86 -27.180 -15.963  -2.609
    9    HE2  LYS  86           HE2      LYS  86 -27.083 -17.582  -4.303
   10    HE3  LYS  86           HE3      LYS  86 -26.468 -18.817  -3.205
   11    HZ3  LYS  86           HZ1      LYS  86 -28.790 -19.198  -3.620
   12    HZ2  LYS  86           HZ2      LYS  86 -29.184 -17.609  -3.164
   13    HZ1  LYS  86           HZ3      LYS  86 -28.600 -18.705  -2.006

  No H/Q in entry =          13
  In of MODEL   56
    1    H    VAL  87           H        VAL  87 -22.770 -13.249  -4.386
    2    HA   VAL  87           HA       VAL  87 -22.504 -12.055  -6.319
    3    HB   VAL  87           HB       VAL  87 -21.409 -14.527  -7.685
    4   HG11  VAL  87          HG11      VAL  87 -21.635 -12.069  -8.638
    5   HG13  VAL  87          HG12      VAL  87 -20.178 -13.012  -8.955
    6   HG12  VAL  87          HG13      VAL  87 -20.179 -11.791  -7.683
    7   HG23  VAL  87          HG21      VAL  87 -19.184 -13.903  -6.642
    8   HG22  VAL  87          HG22      VAL  87 -20.339 -14.736  -5.603
    9   HG21  VAL  87          HG23      VAL  87 -20.114 -12.995  -5.452

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ASP  88           H        ASP  88 -25.007 -12.741  -5.956
    2    HA   ASP  88           HA       ASP  88 -26.125 -13.957  -8.355
    3    HB2  ASP  88           HB2      ASP  88 -27.099 -14.237  -6.026
    4    HB3  ASP  88           HB3      ASP  88 -27.581 -12.543  -6.109

  No H/Q in entry =           4
  In of MODEL   56
    1    H    GLY  89           H        GLY  89 -25.453 -12.674  -9.991
    2    HA3  GLY  89           HA2      GLY  89 -25.682  -9.902 -10.167
    3    HA2  GLY  89           HA3      GLY  89 -25.649 -11.012 -11.537

  No H/Q in entry =           3
  In of MODEL   56
    1    H    LEU  90           H        LEU  90 -28.069 -12.409 -11.083
    2    HA   LEU  90           HA       LEU  90 -29.921 -10.497 -12.168
    3    HB2  LEU  90           HB2      LEU  90 -29.948 -12.889 -12.767
    4    HB3  LEU  90           HB3      LEU  90 -30.436 -13.277 -11.118
    5    HG   LEU  90           HG       LEU  90 -32.577 -12.193 -11.457
    6   HD13  LEU  90          HD11      LEU  90 -32.437 -10.438 -12.919
    7   HD12  LEU  90          HD12      LEU  90 -32.964 -11.675 -14.063
    8   HD11  LEU  90          HD13      LEU  90 -31.256 -11.252 -13.947
    9   HD23  LEU  90          HD21      LEU  90 -32.496 -13.803 -13.906
   10   HD22  LEU  90          HD22      LEU  90 -33.462 -13.996 -12.443
   11   HD21  LEU  90          HD23      LEU  90 -31.798 -14.580 -12.485

  No H/Q in entry =          11
  In of MODEL   56
    1    H    GLY  91           H        GLY  91 -29.703 -12.021  -8.997
    2    HA3  GLY  91           HA2      GLY  91 -32.053 -10.957  -7.932
    3    HA2  GLY  91           HA3      GLY  91 -30.646 -11.473  -7.004

  No H/Q in entry =           3
  In of MODEL   56
    1    H    VAL  92           H        VAL  92 -28.765  -9.606  -7.859
    2    HA   VAL  92           HA       VAL  92 -29.585  -7.332  -6.286
    3    HB   VAL  92           HB       VAL  92 -27.044  -7.745  -7.904
    4   HG12  VAL  92          HG11      VAL  92 -27.224  -5.881  -5.561
    5   HG11  VAL  92          HG12      VAL  92 -27.909  -5.336  -7.094
    6   HG13  VAL  92          HG13      VAL  92 -26.205  -5.775  -6.997
    7   HG22  VAL  92          HG21      VAL  92 -26.781  -9.340  -6.326
    8   HG21  VAL  92          HG22      VAL  92 -27.930  -8.588  -5.219
    9   HG23  VAL  92          HG23      VAL  92 -26.289  -7.958  -5.347

  No H/Q in entry =           9
  In of MODEL   56
    1    H    LEU  93           H        LEU  93 -29.192  -7.959  -9.714
    2    HA   LEU  93           HA       LEU  93 -29.591  -5.322 -10.621
    3    HB2  LEU  93           HB2      LEU  93 -28.928  -7.154 -12.101
    4    HB3  LEU  93           HB3      LEU  93 -30.504  -7.912 -11.872
    5    HG   LEU  93           HG       LEU  93 -31.558  -5.957 -12.974
    6   HD11  LEU  93          HD11      LEU  93 -29.732  -4.334 -12.470
    7   HD13  LEU  93          HD12      LEU  93 -30.184  -4.358 -14.176
    8   HD12  LEU  93          HD13      LEU  93 -28.713  -5.171 -13.642
    9   HD23  LEU  93          HD21      LEU  93 -30.527  -6.488 -15.273
   10   HD22  LEU  93          HD22      LEU  93 -31.340  -7.767 -14.371
   11   HD21  LEU  93          HD23      LEU  93 -29.577  -7.680 -14.385

  No H/Q in entry =          11
  In of MODEL   56
    1    H    LYS  94           H        LYS  94 -31.914  -7.918  -9.774
    2    HA   LYS  94           HA       LYS  94 -34.288  -6.511 -10.369
    3    HB2  LYS  94           HB2      LYS  94 -33.721  -8.703  -8.380
    4    HB3  LYS  94           HB3      LYS  94 -35.332  -8.034  -8.630
    5    HG2  LYS  94           HG2      LYS  94 -35.249  -8.789 -10.970
    6    HG3  LYS  94           HG3      LYS  94 -33.673  -9.515 -10.660
    7    HD2  LYS  94           HD2      LYS  94 -34.757 -10.884  -8.838
    8    HD3  LYS  94           HD3      LYS  94 -36.315 -10.259  -9.376
    9    HE2  LYS  94           HE2      LYS  94 -35.801 -11.160 -11.654
   10    HE3  LYS  94           HE3      LYS  94 -34.367 -11.924 -10.968
   11    HZ3  LYS  94           HZ1      LYS  94 -36.191 -13.476 -11.136
   12    HZ2  LYS  94           HZ2      LYS  94 -37.176 -12.475 -10.179
   13    HZ1  LYS  94           HZ3      LYS  94 -35.797 -13.205  -9.507

  No H/Q in entry =          13
  In of MODEL   56
    1    H    ALA  95           H        ALA  95 -32.439  -6.625  -7.335
    2    HA   ALA  95           HA       ALA  95 -34.305  -5.090  -5.830
    3    HB2  ALA  95           HB1      ALA  95 -31.902  -6.427  -5.322
    4    HB3  ALA  95           HB2      ALA  95 -32.887  -5.549  -4.153
    5    HB1  ALA  95           HB3      ALA  95 -31.560  -4.731  -4.978

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ALA  96           H        ALA  96 -31.695  -4.173  -7.939
    2    HA   ALA  96           HA       ALA  96 -31.640  -1.416  -7.143
    3    HB2  ALA  96           HB1      ALA  96 -30.299  -1.149  -9.261
    4    HB3  ALA  96           HB2      ALA  96 -30.576  -2.860  -9.592
    5    HB1  ALA  96           HB3      ALA  96 -29.658  -2.375  -8.166

  No H/Q in entry =           5
  In of MODEL   56
    1    H    VAL  97           H        VAL  97 -33.163  -3.135  -9.832
    2    HA   VAL  97           HA       VAL  97 -34.281  -0.844 -11.060
    3    HB   VAL  97           HB       VAL  97 -35.042  -3.782 -11.122
    4   HG11  VAL  97          HG11      VAL  97 -36.871  -1.802 -11.577
    5   HG13  VAL  97          HG12      VAL  97 -36.910  -3.389 -12.346
    6   HG12  VAL  97          HG13      VAL  97 -36.185  -2.020 -13.188
    7   HG21  VAL  97          HG21      VAL  97 -33.809  -1.916 -13.151
    8   HG23  VAL  97          HG22      VAL  97 -34.237  -3.601 -13.450
    9   HG22  VAL  97          HG23      VAL  97 -32.985  -3.204 -12.272

  No H/Q in entry =           9
  In of MODEL   56
    1    H    ALA  98           H        ALA  98 -35.409  -3.063  -8.534
    2    HA   ALA  98           HA       ALA  98 -37.985  -1.959  -8.154
    3    HB1  ALA  98           HB1      ALA  98 -36.928  -4.149  -7.147
    4    HB3  ALA  98           HB2      ALA  98 -38.116  -3.252  -6.199
    5    HB2  ALA  98           HB3      ALA  98 -36.395  -3.078  -5.851

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ALA  99           H        ALA  99 -34.906  -1.125  -6.523
    2    HA   ALA  99           HA       ALA  99 -36.054   0.827  -4.836
    3    HB1  ALA  99           HB1      ALA  99 -33.397  -0.015  -5.611
    4    HB2  ALA  99           HB2      ALA  99 -33.948   0.714  -4.102
    5    HB3  ALA  99           HB3      ALA  99 -33.498   1.739  -5.463

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ILE 100           H        ILE 100 -35.041   1.003  -8.198
    2    HA   ILE 100           HA       ILE 100 -35.265   3.849  -8.390
    3    HB   ILE 100           HB       ILE 100 -35.345   1.713 -10.547
    4   HG12  ILE 100          HG12      ILE 100 -33.206   3.731  -9.875
    5   HG13  ILE 100          HG13      ILE 100 -33.213   2.079  -9.259
    6   HG21  ILE 100          HG21      ILE 100 -35.812   4.627 -10.649
    7   HG23  ILE 100          HG22      ILE 100 -36.307   3.361 -11.772
    8   HG22  ILE 100          HG23      ILE 100 -34.665   4.002 -11.834
    9   HD12  ILE 100          HD11      ILE 100 -32.716   3.068 -12.029
   10   HD11  ILE 100          HD12      ILE 100 -33.351   1.441 -11.784
   11   HD13  ILE 100          HD13      ILE 100 -31.806   1.901 -11.072

  No H/Q in entry =          11
  In of MODEL   56
    1    H    LYS 101           H        LYS 101 -37.525   1.213  -9.122
    2    HA   LYS 101           HA       LYS 101 -39.638   2.840 -10.090
    3    HB2  LYS 101           HB2      LYS 101 -39.472   0.058  -8.990
    4    HB3  LYS 101           HB3      LYS 101 -41.038   0.800  -9.316
    5    HG2  LYS 101           HG2      LYS 101 -40.584   0.962 -11.615
    6    HG3  LYS 101           HG3      LYS 101 -38.880   0.579 -11.378
    7    HD2  LYS 101           HD2      LYS 101 -40.109  -1.339 -12.272
    8    HD3  LYS 101           HD3      LYS 101 -39.464  -1.674 -10.664
    9    HE2  LYS 101           HE2      LYS 101 -41.513  -2.404 -10.149
   10    HE3  LYS 101           HE3      LYS 101 -41.994  -0.707 -10.133
   11    HZ3  LYS 101           HZ1      LYS 101 -42.901  -0.858 -12.244
   12    HZ2  LYS 101           HZ2      LYS 101 -43.334  -2.344 -11.547
   13    HZ1  LYS 101           HZ3      LYS 101 -42.037  -2.267 -12.640

  No H/Q in entry =          13
  In of MODEL   56
    1    H    LYS 102           H        LYS 102 -39.100   1.341  -6.899
    2    HA   LYS 102           HA       LYS 102 -41.355   2.492  -5.673
    3    HB2  LYS 102           HB2      LYS 102 -40.084   0.634  -4.685
    4    HB3  LYS 102           HB3      LYS 102 -38.707   1.708  -4.443
    5    HG2  LYS 102           HG2      LYS 102 -40.032   3.069  -2.923
    6    HG3  LYS 102           HG3      LYS 102 -41.412   1.999  -3.167
    7    HD2  LYS 102           HD2      LYS 102 -40.152   0.143  -2.169
    8    HD3  LYS 102           HD3      LYS 102 -38.772   1.213  -1.922
    9    HE2  LYS 102           HE2      LYS 102 -40.137   2.657  -0.489
   10    HE3  LYS 102           HE3      LYS 102 -41.535   1.618  -0.757
   11    HZ1  LYS 102           HZ1      LYS 102 -39.781  -0.121   0.218
   12    HZ3  LYS 102           HZ2      LYS 102 -40.897   0.740   1.164
   13    HZ2  LYS 102           HZ3      LYS 102 -39.296   1.289   1.030

  No H/Q in entry =          13
  In of MODEL   56
    1    H    ALA 103           H        ALA 103 -38.430   3.936  -6.695
    2    HA   ALA 103           HA       ALA 103 -38.673   6.230  -4.890
    3    HB2  ALA 103           HB1      ALA 103 -36.704   7.009  -6.473
    4    HB3  ALA 103           HB2      ALA 103 -36.647   5.295  -6.887
    5    HB1  ALA 103           HB3      ALA 103 -36.414   5.806  -5.216

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ALA 104           H        ALA 104 -39.308   5.522  -8.238
    2    HA   ALA 104           HA       ALA 104 -39.939   8.303  -8.829
    3    HB2  ALA 104           HB1      ALA 104 -39.988   7.656 -11.038
    4    HB1  ALA 104           HB2      ALA 104 -40.690   6.080 -10.669
    5    HB3  ALA 104           HB3      ALA 104 -38.970   6.365 -10.400

  No H/Q in entry =           5
  In of MODEL   56
    1    H    ALA 105           H        ALA 105 -41.502   6.158  -7.033
    2    HA   ALA 105           HA       ALA 105 -43.947   7.515  -6.975
    3    HB2  ALA 105           HB1      ALA 105 -44.694   6.664  -9.016
    4    HB3  ALA 105           HB2      ALA 105 -45.304   5.456  -7.887
    5    HB1  ALA 105           HB3      ALA 105 -43.837   5.138  -8.810

  No H/Q in entry =           5
  In of MODEL   57
    1    H1   ALA   1           H3       ALA   1 -12.362 -15.522  -2.434
    2    H2   ALA   1           H2       ALA   1 -11.429 -16.674  -3.270
    3    H3   ALA   1           H1       ALA   1 -12.560 -15.718  -4.108
    4    HA   ALA   1           HA       ALA   1 -13.977 -17.403  -3.873
    5    HB3  ALA   1           HB1      ALA   1 -12.602 -19.190  -3.404
    6    HB1  ALA   1           HB2      ALA   1 -13.363 -19.068  -1.818
    7    HB2  ALA   1           HB3      ALA   1 -11.778 -18.344  -2.094

  No H/Q in entry =           7
  In of MODEL   57
    1    H    GLU   2           H        GLU   2 -15.616 -18.239  -2.224
    2    HA   GLU   2           HA       GLU   2 -17.249 -16.501  -1.173
    3    HB2  GLU   2           HB2      GLU   2 -16.342 -18.935   0.377
    4    HB3  GLU   2           HB3      GLU   2 -17.857 -18.068   0.625
    5    HG2  GLU   2           HG2      GLU   2 -18.842 -19.145  -1.113
    6    HG3  GLU   2           HG3      GLU   2 -17.511 -18.760  -2.192

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLU   3           H        GLU   3 -15.361 -17.873   1.458
    2    HA   GLU   3           HA       GLU   3 -15.563 -15.516   3.013
    3    HB2  GLU   3           HB2      GLU   3 -14.006 -18.079   3.272
    4    HB3  GLU   3           HB3      GLU   3 -13.765 -16.761   4.419
    5    HG2  GLU   3           HG2      GLU   3 -15.963 -16.889   5.228
    6    HG3  GLU   3           HG3      GLU   3 -16.561 -17.683   3.778

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LEU   4           H        LEU   4 -12.619 -17.027   1.635
    2    HA   LEU   4           HA       LEU   4 -10.767 -15.143   2.239
    3    HB2  LEU   4           HB2      LEU   4 -11.001 -16.440  -0.486
    4    HB3  LEU   4           HB3      LEU   4  -9.544 -15.735   0.204
    5    HG   LEU   4           HG       LEU   4 -11.068 -18.115   1.312
    6   HD13  LEU   4          HD11      LEU   4  -9.447 -19.489   0.390
    7   HD12  LEU   4          HD12      LEU   4  -8.223 -18.219   0.367
    8   HD11  LEU   4          HD13      LEU   4  -9.507 -18.228  -0.840
    9   HD23  LEU   4          HD21      LEU   4  -8.823 -18.202   2.703
   10   HD22  LEU   4          HD22      LEU   4 -10.135 -17.148   3.226
   11   HD21  LEU   4          HD23      LEU   4  -8.762 -16.475   2.349

  No H/Q in entry =          11
  In of MODEL   57
    1    H    GLU   5           H        GLU   5 -13.089 -14.913  -0.445
    2    HA   GLU   5           HA       GLU   5 -12.055 -12.441  -1.443
    3    HB2  GLU   5           HB2      GLU   5 -13.411 -14.010  -2.813
    4    HB3  GLU   5           HB3      GLU   5 -14.811 -13.640  -1.805
    5    HG2  GLU   5           HG2      GLU   5 -14.679 -11.277  -2.446
    6    HG3  GLU   5           HG3      GLU   5 -13.239 -11.604  -3.408

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLU   6           H        GLU   6 -14.798 -13.288   0.639
    2    HA   GLU   6           HA       GLU   6 -15.674 -10.602   1.033
    3    HB2  GLU   6           HB2      GLU   6 -16.196 -13.233   2.377
    4    HB3  GLU   6           HB3      GLU   6 -16.734 -11.740   3.146
    5    HG2  GLU   6           HG2      GLU   6 -18.537 -12.590   1.756
    6    HG3  GLU   6           HG3      GLU   6 -17.896 -11.124   1.016

  No H/Q in entry =           6
  In of MODEL   57
    1    H    VAL   7           H        VAL   7 -13.397 -12.736   2.615
    2    HA   VAL   7           HA       VAL   7 -12.922 -11.165   4.943
    3    HB   VAL   7           HB       VAL   7 -11.235 -13.228   3.502
    4   HG11  VAL   7          HG11      VAL   7 -10.761 -11.698   6.067
    5   HG13  VAL   7          HG12      VAL   7  -9.658 -11.926   4.711
    6   HG12  VAL   7          HG13      VAL   7 -10.030 -13.278   5.780
    7   HG21  VAL   7          HG21      VAL   7 -13.497 -13.767   4.713
    8   HG23  VAL   7          HG22      VAL   7 -12.573 -13.502   6.192
    9   HG22  VAL   7          HG23      VAL   7 -12.089 -14.768   5.065

  No H/Q in entry =           9
  In of MODEL   57
    1    H    VAL   8           H        VAL   8 -11.399 -11.298   1.739
    2    HA   VAL   8           HA       VAL   8  -9.318  -9.448   2.239
    3    HB   VAL   8           HB       VAL   8 -10.773 -10.190  -0.306
    4   HG13  VAL   8          HG11      VAL   8  -9.959  -8.074  -0.864
    5   HG12  VAL   8          HG12      VAL   8  -8.587  -9.098  -1.292
    6   HG11  VAL   8          HG13      VAL   8  -8.580  -8.205   0.229
    7   HG22  VAL   8          HG21      VAL   8  -8.997 -11.693  -0.682
    8   HG21  VAL   8          HG22      VAL   8  -9.155 -11.783   1.069
    9   HG23  VAL   8          HG23      VAL   8  -7.884 -10.797   0.355

  No H/Q in entry =           9
  In of MODEL   57
    1    H    MET   9           H        MET   9 -12.654  -9.022   1.065
    2    HA   MET   9           HA       MET   9 -12.559  -6.247   0.629
    3    HB2  MET   9           HB2      MET   9 -14.791  -8.106   1.438
    4    HB3  MET   9           HB3      MET   9 -15.060  -6.372   1.246
    5    HG2  MET   9           HG2      MET   9 -14.262  -6.474  -1.064
    6    HG3  MET   9           HG3      MET   9 -13.891  -8.188  -0.882
    7    HE3  MET   9           HE1      MET   9 -17.221  -6.367   0.651
    8    HE2  MET   9           HE2      MET   9 -17.967  -6.131  -0.926
    9    HE1  MET   9           HE3      MET   9 -16.377  -5.446  -0.602

  No H/Q in entry =           9
  In of MODEL   57
    1    H    GLY  10           H        GLY  10 -13.254  -8.128   3.555
    2    HA3  GLY  10           HA2      GLY  10 -13.786  -5.937   5.270
    3    HA2  GLY  10           HA3      GLY  10 -13.241  -7.531   5.787

  No H/Q in entry =           3
  In of MODEL   57
    1    H    LEU  11           H        LEU  11 -10.791  -7.682   4.483
    2    HA   LEU  11           HA       LEU  11  -9.083  -6.266   6.245
    3    HB2  LEU  11           HB2      LEU  11  -8.541  -7.697   3.641
    4    HB3  LEU  11           HB3      LEU  11  -7.267  -7.005   4.645
    5    HG   LEU  11           HG       LEU  11  -9.295  -9.016   5.654
    6   HD13  LEU  11          HD11      LEU  11  -8.080 -10.267   4.096
    7   HD12  LEU  11          HD12      LEU  11  -7.153 -10.514   5.575
    8   HD11  LEU  11          HD13      LEU  11  -6.595  -9.356   4.369
    9   HD22  LEU  11          HD21      LEU  11  -8.439  -8.011   7.574
   10   HD21  LEU  11          HD22      LEU  11  -6.894  -7.626   6.817
   11   HD23  LEU  11          HD23      LEU  11  -7.239  -9.278   7.326

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  12           H        ILE  12  -9.965  -5.712   2.851
    2    HA   ILE  12           HA       ILE  12  -8.249  -3.500   2.430
    3    HB   ILE  12           HB       ILE  12 -10.902  -4.151   1.124
    4   HG12  ILE  12          HG12      ILE  12  -8.879  -5.814   1.052
    5   HG13  ILE  12          HG13      ILE  12  -9.723  -5.442  -0.436
    6   HG22  ILE  12          HG21      ILE  12  -9.993  -2.754  -0.755
    7   HG21  ILE  12          HG22      ILE  12  -8.666  -2.268   0.293
    8   HG23  ILE  12          HG23      ILE  12 -10.306  -1.853   0.697
    9   HD13  ILE  12          HD11      ILE  12  -7.982  -3.884  -1.072
   10   HD12  ILE  12          HD12      ILE  12  -7.222  -5.409  -0.623
   11   HD11  ILE  12          HD13      ILE  12  -7.200  -4.059   0.487

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  13           H        ILE  13 -11.617  -3.732   3.510
    2    HA   ILE  13           HA       ILE  13 -12.050  -0.940   3.775
    3    HB   ILE  13           HB       ILE  13 -13.284  -3.340   5.149
    4   HG12  ILE  13          HG12      ILE  13 -13.479  -2.840   2.602
    5   HG13  ILE  13          HG13      ILE  13 -14.920  -3.270   3.501
    6   HG23  ILE  13          HG21      ILE  13 -13.590  -1.403   6.605
    7   HG22  ILE  13          HG22      ILE  13 -15.125  -1.797   5.841
    8   HG21  ILE  13          HG23      ILE  13 -14.173  -0.435   5.254
    9   HD12  ILE  13          HD11      ILE  13 -14.873  -1.131   1.896
   10   HD11  ILE  13          HD12      ILE  13 -14.214  -0.395   3.344
   11   HD13  ILE  13          HD13      ILE  13 -15.795  -1.143   3.403

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ASN  14           H        ASN  14 -10.973  -3.440   6.057
    2    HA   ASN  14           HA       ASN  14 -10.766  -1.802   8.342
    3    HB2  ASN  14           HB2      ASN  14 -10.537  -4.412   8.023
    4    HB3  ASN  14           HB3      ASN  14  -8.824  -4.041   7.873
    5   HD21  ASN  14          HD21      ASN  14  -9.484  -5.557  10.047
    6   HD22  ASN  14          HD22      ASN  14  -9.453  -4.636  11.471

  No H/Q in entry =           6
  In of MODEL   57
    1    H    SER  15           H        SER  15  -8.361  -2.650   5.861
    2    HA   SER  15           HA       SER  15  -6.209  -1.176   6.941
    3    HB2  SER  15           HB2      SER  15  -5.184  -1.396   4.783
    4    HB3  SER  15           HB3      SER  15  -6.143  -2.853   5.013
    5    HG   SER  15           HG       SER  15  -6.377  -0.922   3.147

  No H/Q in entry =           5
  In of MODEL   57
    1    H    GLY  16           H        GLY  16  -8.793  -0.288   4.682
    2    HA3  GLY  16           HA2      GLY  16  -7.909   2.345   4.132
    3    HA2  GLY  16           HA3      GLY  16  -9.564   1.764   3.963

  No H/Q in entry =           3
  In of MODEL   57
    1    H    GLN  17           H        GLN  17 -10.125   1.047   6.611
    2    HA   GLN  17           HA       GLN  17 -10.816   3.558   7.746
    3    HB2  GLN  17           HB2      GLN  17 -12.082   1.509   8.240
    4    HB3  GLN  17           HB3      GLN  17 -10.680   0.837   9.072
    5    HG2  GLN  17           HG2      GLN  17 -10.745   2.649  10.713
    6    HG3  GLN  17           HG3      GLN  17 -12.085   3.406   9.856
    7   HE21  GLN  17          HE21      GLN  17 -12.301   2.555  12.604
    8   HE22  GLN  17          HE22      GLN  17 -13.424   1.283  12.667

  No H/Q in entry =           8
  In of MODEL   57
    1    H    ALA  18           H        ALA  18  -8.209   1.256   8.379
    2    HA   ALA  18           HA       ALA  18  -7.111   2.465  10.654
    3    HB2  ALA  18           HB1      ALA  18  -6.513   0.243   9.291
    4    HB3  ALA  18           HB2      ALA  18  -5.349   1.017  10.366
    5    HB1  ALA  18           HB3      ALA  18  -5.262   1.293   8.625

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ARG  19           H        ARG  19  -6.320   2.979   7.208
    2    HA   ARG  19           HA       ARG  19  -4.408   5.011   7.643
    3    HB2  ARG  19           HB2      ARG  19  -4.734   3.871   5.447
    4    HB3  ARG  19           HB3      ARG  19  -6.269   4.724   5.263
    5    HG2  ARG  19           HG2      ARG  19  -5.124   6.886   5.334
    6    HG3  ARG  19           HG3      ARG  19  -3.583   6.089   5.646
    7    HD2  ARG  19           HD2      ARG  19  -3.693   6.678   3.301
    8    HD3  ARG  19           HD3      ARG  19  -3.792   4.919   3.448
    9    HE   ARG  19           HE       ARG  19  -6.419   5.848   3.428
   10   HH21  ARG  19          HH11      ARG  19  -7.604   6.011   1.505
   11   HH22  ARG  19          HH12      ARG  19  -6.775   6.081  -0.012
   12   HH11  ARG  19          HH21      ARG  19  -3.634   5.888   1.407
   13   HH12  ARG  19          HH22      ARG  19  -4.526   6.009  -0.067

  No H/Q in entry =          13
  In of MODEL   57
    1    H    SER  20           H        SER  20  -7.902   5.152   7.027
    2    HA   SER  20           HA       SER  20  -8.239   7.911   6.974
    3    HB2  SER  20           HB2      SER  20  -9.975   6.034   6.605
    4    HB3  SER  20           HB3      SER  20 -10.203   6.095   8.352
    5    HG   SER  20           HG       SER  20 -10.538   8.176   6.454

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LEU  21           H        LEU  21  -8.267   5.731   9.781
    2    HA   LEU  21           HA       LEU  21  -8.702   7.732  11.741
    3    HB2  LEU  21           HB2      LEU  21  -7.366   5.024  11.913
    4    HB3  LEU  21           HB3      LEU  21  -7.683   6.044  13.314
    5    HG   LEU  21           HG       LEU  21  -9.837   5.146  11.375
    6   HD12  LEU  21          HD11      LEU  21 -10.467   3.554  13.217
    7   HD11  LEU  21          HD12      LEU  21  -8.951   3.959  14.019
    8   HD13  LEU  21          HD13      LEU  21  -8.930   3.171  12.440
    9   HD23  LEU  21          HD21      LEU  21 -11.193   5.664  13.591
   10   HD22  LEU  21          HD22      LEU  21 -10.740   6.995  12.532
   11   HD21  LEU  21          HD23      LEU  21  -9.804   6.672  13.983

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ALA  22           H        ALA  22  -5.753   6.337  10.349
    2    HA   ALA  22           HA       ALA  22  -3.872   7.639  11.978
    3    HB2  ALA  22           HB1      ALA  22  -3.461   5.780  10.291
    4    HB1  ALA  22           HB2      ALA  22  -2.256   7.068  10.330
    5    HB3  ALA  22           HB3      ALA  22  -3.469   7.031   9.049

  No H/Q in entry =           5
  In of MODEL   57
    1    H    TYR  23           H        TYR  23  -5.167   8.661   8.788
    2    HA   TYR  23           HA       TYR  23  -3.814  11.148   8.722
    3    HB2  TYR  23           HB2      TYR  23  -4.892  10.242   6.725
    4    HB3  TYR  23           HB3      TYR  23  -6.473  10.360   7.499
    5    HD1  TYR  23           HD1      TYR  23  -3.558  12.373   6.334
    6    HD2  TYR  23           HD2      TYR  23  -7.691  12.388   7.497
    7    HE1  TYR  23           HE1      TYR  23  -3.763  14.724   5.570
    8    HE2  TYR  23           HE2      TYR  23  -7.899  14.738   6.733
    9    HH   TYR  23           HH       TYR  23  -5.106  16.612   5.781

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ALA  24           H        ALA  24  -6.946  10.193  10.087
    2    HA   ALA  24           HA       ALA  24  -7.769  12.790  10.851
    3    HB1  ALA  24           HB1      ALA  24  -9.598  11.552  11.312
    4    HB2  ALA  24           HB2      ALA  24  -8.783  10.976  12.764
    5    HB3  ALA  24           HB3      ALA  24  -8.657  10.062  11.262

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ALA  25           H        ALA  25  -5.791  10.320  12.438
    2    HA   ALA  25           HA       ALA  25  -5.457  11.573  14.940
    3    HB2  ALA  25           HB1      ALA  25  -4.702   9.215  14.125
    4    HB3  ALA  25           HB2      ALA  25  -3.687  10.068  15.290
    5    HB1  ALA  25           HB3      ALA  25  -3.243  10.046  13.583

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LEU  26           H        LEU  26  -3.650  11.856  11.908
    2    HA   LEU  26           HA       LEU  26  -1.683  13.664  12.831
    3    HB2  LEU  26           HB2      LEU  26  -1.380  12.508  10.730
    4    HB3  LEU  26           HB3      LEU  26  -2.845  13.225  10.068
    5    HG   LEU  26           HG       LEU  26  -1.816  15.469  10.205
    6   HD12  LEU  26          HD11      LEU  26   0.721  15.471  10.632
    7   HD11  LEU  26          HD12      LEU  26   0.483  13.893  11.377
    8   HD13  LEU  26          HD13      LEU  26  -0.318  15.314  12.047
    9   HD21  LEU  26          HD21      LEU  26  -0.080  13.400   8.821
   10   HD23  LEU  26          HD22      LEU  26  -0.109  15.122   8.449
   11   HD22  LEU  26          HD23      LEU  26  -1.538  14.134   8.155

  No H/Q in entry =          11
  In of MODEL   57
    1    H    LYS  27           H        LYS  27  -4.855  14.167  11.338
    2    HA   LYS  27           HA       LYS  27  -4.779  16.955  11.137
    3    HB2  LYS  27           HB2      LYS  27  -6.529  15.489  10.145
    4    HB3  LYS  27           HB3      LYS  27  -7.195  15.239  11.758
    5    HG2  LYS  27           HG2      LYS  27  -7.608  17.648  11.989
    6    HG3  LYS  27           HG3      LYS  27  -6.891  17.938  10.401
    7    HD2  LYS  27           HD2      LYS  27  -8.628  16.515   9.358
    8    HD3  LYS  27           HD3      LYS  27  -9.352  16.242  10.945
    9    HE2  LYS  27           HE2      LYS  27  -9.778  18.657  11.183
   10    HE3  LYS  27           HE3      LYS  27  -9.026  18.951   9.612
   11    HZ3  LYS  27           HZ1      LYS  27 -11.404  18.843   9.359
   12    HZ2  LYS  27           HZ2      LYS  27 -11.466  17.328  10.130
   13    HZ1  LYS  27           HZ3      LYS  27 -10.713  17.484   8.612

  No H/Q in entry =          13
  In of MODEL   57
    1    H    GLN  28           H        GLN  28  -5.696  14.879  13.862
    2    HA   GLN  28           HA       GLN  28  -6.585  16.891  15.632
    3    HB2  GLN  28           HB2      GLN  28  -5.203  14.252  16.186
    4    HB3  GLN  28           HB3      GLN  28  -5.947  15.262  17.427
    5    HG2  GLN  28           HG2      GLN  28  -7.401  14.155  15.008
    6    HG3  GLN  28           HG3      GLN  28  -7.468  13.455  16.625
    7   HE21  GLN  28          HE21      GLN  28  -9.328  15.274  14.665
    8   HE22  GLN  28          HE22      GLN  28 -10.075  16.290  15.799

  No H/Q in entry =           8
  In of MODEL   57
    1    H    ALA  29           H        ALA  29  -3.373  15.569  14.959
    2    HA   ALA  29           HA       ALA  29  -1.933  16.957  16.943
    3    HB1  ALA  29           HB1      ALA  29  -0.003  16.249  15.833
    4    HB3  ALA  29           HB2      ALA  29  -0.749  16.377  14.241
    5    HB2  ALA  29           HB3      ALA  29  -1.187  15.050  15.315

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LYS  30           H        LYS  30  -2.768  17.840  13.608
    2    HA   LYS  30           HA       LYS  30  -1.334  20.267  13.511
    3    HB2  LYS  30           HB2      LYS  30  -3.867  19.415  12.092
    4    HB3  LYS  30           HB3      LYS  30  -3.017  20.922  11.751
    5    HG2  LYS  30           HG2      LYS  30  -0.957  19.608  11.248
    6    HG3  LYS  30           HG3      LYS  30  -1.879  18.121  11.490
    7    HD2  LYS  30           HD2      LYS  30  -3.429  18.775   9.688
    8    HD3  LYS  30           HD3      LYS  30  -2.530  20.274   9.447
    9    HE2  LYS  30           HE2      LYS  30  -0.508  18.960   8.878
   10    HE3  LYS  30           HE3      LYS  30  -1.426  17.467   9.088
   11    HZ2  LYS  30           HZ1      LYS  30  -1.230  18.333   6.746
   12    HZ1  LYS  30           HZ2      LYS  30  -2.263  19.607   7.208
   13    HZ3  LYS  30           HZ3      LYS  30  -2.804  17.996   7.278

  No H/Q in entry =          13
  In of MODEL   57
    1    H    GLN  31           H        GLN  31  -4.449  19.449  14.911
    2    HA   GLN  31           HA       GLN  31  -5.185  22.214  15.357
    3    HB2  GLN  31           HB2      GLN  31  -6.397  19.782  16.676
    4    HB3  GLN  31           HB3      GLN  31  -7.138  21.361  16.426
    5    HG2  GLN  31           HG2      GLN  31  -6.425  20.574  13.840
    6    HG3  GLN  31           HG3      GLN  31  -6.970  19.076  14.586
    7   HE21  GLN  31          HE21      GLN  31  -8.353  20.664  12.477
    8   HE22  GLN  31          HE22      GLN  31  -9.865  21.073  13.128

  No H/Q in entry =           8
  In of MODEL   57
    1    H    GLY  32           H        GLY  32  -2.900  20.262  16.689
    2    HA3  GLY  32           HA2      GLY  32  -1.502  20.710  18.496
    3    HA2  GLY  32           HA3      GLY  32  -2.620  21.966  19.014

  No H/Q in entry =           3
  In of MODEL   57
    1    H    ASP  33           H        ASP  33  -4.074  18.942  18.349
    2    HA   ASP  33           HA       ASP  33  -4.502  18.491  21.227
    3    HB2  ASP  33           HB2      ASP  33  -5.909  17.494  18.744
    4    HB3  ASP  33           HB3      ASP  33  -6.268  16.889  20.359

  No H/Q in entry =           4
  In of MODEL   57
    1    H    PHE  34           H        PHE  34  -2.345  17.616  21.542
    2    HA   PHE  34           HA       PHE  34  -1.364  15.354  20.147
    3    HB2  PHE  34           HB2      PHE  34  -0.748  16.333  22.944
    4    HB3  PHE  34           HB3      PHE  34   0.170  15.099  22.081
    5    HD1  PHE  34           HD1      PHE  34   0.035  18.527  22.813
    6    HD2  PHE  34           HD2      PHE  34   0.847  15.812  19.584
    7    HE1  PHE  34           HE1      PHE  34   1.355  20.282  21.664
    8    HE2  PHE  34           HE2      PHE  34   2.163  17.571  18.439
    9    HZ   PHE  34           HZ       PHE  34   2.419  19.803  19.483

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ALA  35           H        ALA  35  -3.413  15.657  23.001
    2    HA   ALA  35           HA       ALA  35  -3.236  12.993  23.900
    3    HB3  ALA  35           HB1      ALA  35  -5.690  13.648  24.747
    4    HB1  ALA  35           HB2      ALA  35  -5.136  15.260  24.292
    5    HB2  ALA  35           HB3      ALA  35  -4.237  14.326  25.488

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ALA  36           H        ALA  36  -5.659  14.537  21.789
    2    HA   ALA  36           HA       ALA  36  -7.100  12.142  21.307
    3    HB1  ALA  36           HB1      ALA  36  -8.535  13.581  20.344
    4    HB3  ALA  36           HB2      ALA  36  -7.353  13.987  19.100
    5    HB2  ALA  36           HB3      ALA  36  -7.373  14.875  20.623

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ALA  37           H        ALA  37  -4.395  13.697  19.649
    2    HA   ALA  37           HA       ALA  37  -4.369  12.060  17.353
    3    HB3  ALA  37           HB1      ALA  37  -2.363  13.749  18.783
    4    HB2  ALA  37           HB2      ALA  37  -2.885  13.810  17.101
    5    HB1  ALA  37           HB3      ALA  37  -1.748  12.567  17.627

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LYS  38           H        LYS  38  -2.629  11.735  20.438
    2    HA   LYS  38           HA       LYS  38  -1.329   9.319  19.956
    3    HB2  LYS  38           HB2      LYS  38  -1.641  11.087  22.099
    4    HB3  LYS  38           HB3      LYS  38  -2.280   9.565  22.714
    5    HG2  LYS  38           HG2      LYS  38  -0.197   8.420  22.186
    6    HG3  LYS  38           HG3      LYS  38   0.432   9.858  21.375
    7    HD2  LYS  38           HD2      LYS  38   0.607  11.075  23.410
    8    HD3  LYS  38           HD3      LYS  38  -0.429   9.937  24.273
    9    HE2  LYS  38           HE2      LYS  38   1.920   9.594  24.902
   10    HE3  LYS  38           HE3      LYS  38   1.303   8.185  24.036
   11    HZ3  LYS  38           HZ1      LYS  38   2.615   8.587  22.260
   12    HZ2  LYS  38           HZ2      LYS  38   3.575   9.405  23.401
   13    HZ1  LYS  38           HZ3      LYS  38   2.510  10.277  22.404

  No H/Q in entry =          13
  In of MODEL   57
    1    H    ALA  39           H        ALA  39  -4.568   9.853  21.345
    2    HA   ALA  39           HA       ALA  39  -5.162   7.140  21.848
    3    HB3  ALA  39           HB1      ALA  39  -7.294   9.109  21.071
    4    HB2  ALA  39           HB2      ALA  39  -6.400   9.327  22.576
    5    HB1  ALA  39           HB3      ALA  39  -7.333   7.853  22.309

  No H/Q in entry =           5
  In of MODEL   57
    1    H    MET  40           H        MET  40  -5.711   9.159  18.998
    2    HA   MET  40           HA       MET  40  -7.203   7.243  17.532
    3    HB2  MET  40           HB2      MET  40  -5.562   9.619  16.633
    4    HB3  MET  40           HB3      MET  40  -6.595   8.672  15.559
    5    HG2  MET  40           HG2      MET  40  -7.626   9.933  18.112
    6    HG3  MET  40           HG3      MET  40  -7.667  10.768  16.561
    7    HE3  MET  40           HE1      MET  40 -10.260   9.177  14.487
    8    HE2  MET  40           HE2      MET  40  -8.506   9.274  14.346
    9    HE1  MET  40           HE3      MET  40  -9.410  10.650  14.975

  No H/Q in entry =           9
  In of MODEL   57
    1    H    MET  41           H        MET  41  -3.705   7.941  17.669
    2    HA   MET  41           HA       MET  41  -2.957   6.177  15.573
    3    HB2  MET  41           HB2      MET  41  -1.344   6.827  18.052
    4    HB3  MET  41           HB3      MET  41  -0.727   6.171  16.540
    5    HG2  MET  41           HG2      MET  41  -1.855   8.366  15.530
    6    HG3  MET  41           HG3      MET  41  -1.619   8.952  17.175
    7    HE2  MET  41           HE1      MET  41   1.274   6.821  17.550
    8    HE1  MET  41           HE2      MET  41   0.496   8.124  18.444
    9    HE3  MET  41           HE3      MET  41   2.124   8.349  17.808

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ASP  42           H        ASP  42  -3.362   5.709  19.057
    2    HA   ASP  42           HA       ASP  42  -2.356   3.105  19.223
    3    HB2  ASP  42           HB2      ASP  42  -3.218   4.874  21.041
    4    HB3  ASP  42           HB3      ASP  42  -4.656   3.865  20.963

  No H/Q in entry =           4
  In of MODEL   57
    1    H    GLN  43           H        GLN  43  -5.675   4.244  18.708
    2    HA   GLN  43           HA       GLN  43  -6.845   1.669  18.509
    3    HB2  GLN  43           HB2      GLN  43  -7.735   4.331  17.375
    4    HB3  GLN  43           HB3      GLN  43  -8.714   2.862  17.349
    5    HG2  GLN  43           HG2      GLN  43  -8.432   2.739  19.858
    6    HG3  GLN  43           HG3      GLN  43  -7.690   4.336  19.789
    7   HE21  GLN  43          HE21      GLN  43  -9.875   4.440  21.280
    8   HE22  GLN  43          HE22      GLN  43 -11.226   5.030  20.442

  No H/Q in entry =           8
  In of MODEL   57
    1    H    SER  44           H        SER  44  -5.471   3.868  16.102
    2    HA   SER  44           HA       SER  44  -6.178   2.390  13.811
    3    HB2  SER  44           HB2      SER  44  -4.898   4.760  14.259
    4    HB3  SER  44           HB3      SER  44  -3.552   3.750  13.735
    5    HG   SER  44           HG       SER  44  -4.646   4.733  11.967

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ARG  45           H        ARG  45  -3.311   2.247  15.904
    2    HA   ARG  45           HA       ARG  45  -1.846   0.276  14.529
    3    HB2  ARG  45           HB2      ARG  45  -0.997   1.689  16.401
    4    HB3  ARG  45           HB3      ARG  45  -2.003   0.770  17.517
    5    HG2  ARG  45           HG2      ARG  45  -0.791  -1.303  16.881
    6    HG3  ARG  45           HG3      ARG  45   0.239  -0.359  15.807
    7    HD2  ARG  45           HD2      ARG  45   0.980   1.015  17.765
    8    HD3  ARG  45           HD3      ARG  45   0.041  -0.050  18.835
    9    HE   ARG  45           HE       ARG  45   1.730  -1.664  17.262
   10   HH21  ARG  45          HH11      ARG  45   3.618  -2.507  18.108
   11   HH22  ARG  45          HH12      ARG  45   4.393  -1.729  19.443
   12   HH11  ARG  45          HH21      ARG  45   2.049   0.800  19.653
   13   HH12  ARG  45          HH22      ARG  45   3.505   0.145  20.315

  No H/Q in entry =          13
  In of MODEL   57
    1    H    MET  46           H        MET  46  -4.258  -0.017  17.118
    2    HA   MET  46           HA       MET  46  -4.123  -2.818  17.426
    3    HB2  MET  46           HB2      MET  46  -6.267  -0.784  18.020
    4    HB3  MET  46           HB3      MET  46  -6.504  -2.501  18.351
    5    HG2  MET  46           HG2      MET  46  -4.522  -2.534  19.782
    6    HG3  MET  46           HG3      MET  46  -4.186  -0.852  19.400
    7    HE1  MET  46           HE1      MET  46  -6.504  -3.392  20.552
    8    HE3  MET  46           HE2      MET  46  -7.985  -2.441  20.511
    9    HE2  MET  46           HE3      MET  46  -7.225  -2.805  22.056

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ALA  47           H        ALA  47  -6.111  -0.779  15.322
    2    HA   ALA  47           HA       ALA  47  -7.746  -2.812  14.249
    3    HB3  ALA  47           HB1      ALA  47  -8.399  -0.567  13.830
    4    HB1  ALA  47           HB2      ALA  47  -7.910  -1.206  12.260
    5    HB2  ALA  47           HB3      ALA  47  -6.822  -0.150  13.162

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LEU  48           H        LEU  48  -4.608  -1.539  13.213
    2    HA   LEU  48           HA       LEU  48  -4.335  -3.133  10.873
    3    HB2  LEU  48           HB2      LEU  48  -2.271  -1.879  12.691
    4    HB3  LEU  48           HB3      LEU  48  -1.903  -2.604  11.126
    5    HG   LEU  48           HG       LEU  48  -3.902  -0.363  11.505
    6   HD13  LEU  48          HD11      LEU  48  -1.773   0.488  12.181
    7   HD12  LEU  48          HD12      LEU  48  -2.034   1.045  10.528
    8   HD11  LEU  48          HD13      LEU  48  -0.954  -0.315  10.841
    9   HD22  LEU  48          HD21      LEU  48  -4.375  -1.342   9.427
   10   HD21  LEU  48          HD22      LEU  48  -2.696  -1.797   9.140
   11   HD23  LEU  48          HD23      LEU  48  -3.194  -0.112   8.978

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ASN  49           H        ASN  49  -3.310  -3.542  14.224
    2    HA   ASN  49           HA       ASN  49  -1.734  -5.825  13.901
    3    HB2  ASN  49           HB2      ASN  49  -1.732  -4.510  15.950
    4    HB3  ASN  49           HB3      ASN  49  -3.412  -4.926  16.259
    5   HD21  ASN  49          HD21      ASN  49  -0.178  -6.421  15.913
    6   HD22  ASN  49          HD22      ASN  49  -0.503  -7.727  16.947

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLU  50           H        GLU  50  -5.202  -5.506  14.556
    2    HA   GLU  50           HA       GLU  50  -5.750  -8.299  14.663
    3    HB2  GLU  50           HB2      GLU  50  -7.318  -6.591  15.531
    4    HB3  GLU  50           HB3      GLU  50  -7.597  -6.023  13.883
    5    HG2  GLU  50           HG2      GLU  50  -8.487  -8.208  13.241
    6    HG3  GLU  50           HG3      GLU  50  -8.122  -8.857  14.836

  No H/Q in entry =           6
  In of MODEL   57
    1    H    ALA  51           H        ALA  51  -5.775  -5.900  12.066
    2    HA   ALA  51           HA       ALA  51  -6.773  -7.615  10.040
    3    HB2  ALA  51           HB1      ALA  51  -6.522  -5.806   8.671
    4    HB1  ALA  51           HB2      ALA  51  -4.881  -5.478   9.228
    5    HB3  ALA  51           HB3      ALA  51  -6.262  -4.949  10.190

  No H/Q in entry =           5
  In of MODEL   57
    1    H    HIS  52           H        HIS  52  -3.475  -6.752  11.039
    2    HA   HIS  52           HA       HIS  52  -2.087  -8.260   9.097
    3    HB2  HIS  52           HB2      HIS  52  -1.050  -6.534  10.559
    4    HB3  HIS  52           HB3      HIS  52  -1.216  -7.632  11.928
    5    HD1  HIS  52           HD1      HIS  52   0.266  -9.792  11.921
    6    HD2  HIS  52           HD2      HIS  52   1.032  -7.190   8.755
    7    HE1  HIS  52           HE1      HIS  52   2.450 -10.547  10.887
    8    HE2  HIS  52           HE2      HIS  52   2.932  -8.970   8.955

  No H/Q in entry =           8
  In of MODEL   57
    1    H    LEU  53           H        LEU  53  -3.326  -9.121  12.303
    2    HA   LEU  53           HA       LEU  53  -2.165 -11.681  12.503
    3    HB2  LEU  53           HB2      LEU  53  -4.640 -10.466  13.704
    4    HB3  LEU  53           HB3      LEU  53  -4.204 -12.148  13.999
    5    HG   LEU  53           HG       LEU  53  -2.270  -9.859  14.479
    6   HD13  LEU  53          HD11      LEU  53  -4.110  -9.417  15.945
    7   HD12  LEU  53          HD12      LEU  53  -2.890 -10.237  16.919
    8   HD11  LEU  53          HD13      LEU  53  -4.294 -11.124  16.336
    9   HD23  LEU  53          HD21      LEU  53  -1.427 -11.668  16.174
   10   HD22  LEU  53          HD22      LEU  53  -1.035 -11.866  14.470
   11   HD21  LEU  53          HD23      LEU  53  -2.336 -12.802  15.182

  No H/Q in entry =          11
  In of MODEL   57
    1    H    VAL  54           H        VAL  54  -5.255 -10.608  11.125
    2    HA   VAL  54           HA       VAL  54  -6.202 -13.189  10.433
    3    HB   VAL  54           HB       VAL  54  -6.804 -10.447   9.296
    4   HG12  VAL  54          HG11      VAL  54  -8.922 -11.795   8.473
    5   HG11  VAL  54          HG12      VAL  54  -7.830 -13.176   8.551
    6   HG13  VAL  54          HG13      VAL  54  -7.445 -11.807   7.511
    7   HG22  VAL  54          HG21      VAL  54  -7.722 -10.472  11.443
    8   HG21  VAL  54          HG22      VAL  54  -8.001 -12.211  11.422
    9   HG23  VAL  54          HG23      VAL  54  -9.062 -11.139  10.510

  No H/Q in entry =           9
  In of MODEL   57
    1    H    GLN  55           H        GLN  55  -4.286 -10.765   8.654
    2    HA   GLN  55           HA       GLN  55  -4.165 -12.231   6.237
    3    HB2  GLN  55           HB2      GLN  55  -3.528  -9.976   6.050
    4    HB3  GLN  55           HB3      GLN  55  -2.425 -10.068   7.420
    5    HG2  GLN  55           HG2      GLN  55  -0.714 -10.939   6.153
    6    HG3  GLN  55           HG3      GLN  55  -1.797 -11.899   5.153
    7   HE21  GLN  55          HE21      GLN  55  -1.793 -11.208   3.032
    8   HE22  GLN  55          HE22      GLN  55  -1.569  -9.607   2.523

  No H/Q in entry =           8
  In of MODEL   57
    1    H    THR  56           H        THR  56  -2.074 -12.241   9.128
    2    HA   THR  56           HA       THR  56  -0.015 -13.870   8.221
    3    HB   THR  56           HB       THR  56  -1.274 -14.104  10.963
    4    HG1  THR  56           HG1      THR  56  -0.723 -12.113  11.207
    5   HG23  THR  56          HG21      THR  56   0.900 -14.785  11.676
    6   HG22  THR  56          HG22      THR  56   1.627 -14.307  10.141
    7   HG21  THR  56          HG23      THR  56   0.559 -15.710  10.215

  No H/Q in entry =           7
  In of MODEL   57
    1    H    LYS  57           H        LYS  57  -3.157 -14.860   9.568
    2    HA   LYS  57           HA       LYS  57  -2.752 -17.662   9.325
    3    HB2  LYS  57           HB2      LYS  57  -4.560 -16.544  10.661
    4    HB3  LYS  57           HB3      LYS  57  -5.338 -16.083   9.154
    5    HG2  LYS  57           HG2      LYS  57  -5.599 -18.449   8.543
    6    HG3  LYS  57           HG3      LYS  57  -4.793 -18.933  10.033
    7    HD2  LYS  57           HD2      LYS  57  -6.591 -17.860  11.353
    8    HD3  LYS  57           HD3      LYS  57  -7.405 -17.392   9.860
    9    HE2  LYS  57           HE2      LYS  57  -7.655 -19.766   9.237
   10    HE3  LYS  57           HE3      LYS  57  -6.809 -20.261  10.702
   11    HZ3  LYS  57           HZ1      LYS  57  -9.063 -20.428  11.212
   12    HZ2  LYS  57           HZ2      LYS  57  -9.449 -18.955  10.458
   13    HZ1  LYS  57           HZ3      LYS  57  -8.587 -18.960  11.922

  No H/Q in entry =          13
  In of MODEL   57
    1    H    LEU  58           H        LEU  58  -4.035 -15.200   7.142
    2    HA   LEU  58           HA       LEU  58  -4.855 -17.013   5.132
    3    HB2  LEU  58           HB2      LEU  58  -4.203 -14.074   5.000
    4    HB3  LEU  58           HB3      LEU  58  -4.874 -15.001   3.656
    5    HG   LEU  58           HG       LEU  58  -6.165 -14.801   6.397
    6   HD11  LEU  58          HD11      LEU  58  -6.427 -13.150   3.904
    7   HD13  LEU  58          HD12      LEU  58  -6.418 -12.643   5.593
    8   HD12  LEU  58          HD13      LEU  58  -7.849 -13.414   4.914
    9   HD22  LEU  58          HD21      LEU  58  -7.152 -16.696   5.523
   10   HD21  LEU  58          HD22      LEU  58  -6.797 -16.249   3.854
   11   HD23  LEU  58          HD23      LEU  58  -8.153 -15.503   4.698

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  59           H        ILE  59  -1.706 -15.850   6.009
    2    HA   ILE  59           HA       ILE  59  -0.606 -16.595   3.378
    3    HB   ILE  59           HB       ILE  59   0.186 -14.542   4.955
    4   HG12  ILE  59          HG12      ILE  59   2.251 -16.222   3.518
    5   HG13  ILE  59          HG13      ILE  59   1.076 -15.252   2.668
    6   HG22  ILE  59          HG21      ILE  59   2.239 -16.623   5.653
    7   HG21  ILE  59          HG22      ILE  59   0.886 -16.330   6.723
    8   HG23  ILE  59          HG23      ILE  59   2.023 -15.035   6.350
    9   HD11  ILE  59          HD11      ILE  59   1.856 -13.244   3.921
   10   HD13  ILE  59          HD12      ILE  59   3.121 -13.958   2.923
   11   HD12  ILE  59          HD13      ILE  59   3.105 -14.242   4.664

  No H/Q in entry =          11
  In of MODEL   57
    1    H    GLU  60           H        GLU  60  -0.651 -17.700   6.746
    2    HA   GLU  60           HA       GLU  60   1.350 -19.709   6.492
    3    HB2  GLU  60           HB2      GLU  60   0.587 -18.912   8.678
    4    HB3  GLU  60           HB3      GLU  60  -1.026 -19.549   8.365
    5    HG2  GLU  60           HG2      GLU  60  -0.103 -21.836   8.232
    6    HG3  GLU  60           HG3      GLU  60   1.513 -21.200   8.534

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLY  61           H        GLY  61  -2.159 -19.753   5.988
    2    HA3  GLY  61           HA2      GLY  61  -1.948 -22.549   5.031
    3    HA2  GLY  61           HA3      GLY  61  -3.425 -21.790   5.616

  No H/Q in entry =           3
  In of MODEL   57
    1    H    ASP  62           H        ASP  62  -1.160 -20.247   3.425
    2    HA   ASP  62           HA       ASP  62  -3.156 -19.502   1.580
    3    HB2  ASP  62           HB2      ASP  62  -1.232 -18.810   0.170
    4    HB3  ASP  62           HB3      ASP  62  -1.096 -18.241   1.831

  No H/Q in entry =           4
  In of MODEL   57
    1    H    ALA  63           H        ALA  63  -0.923 -22.274   1.597
    2    HA   ALA  63           HA       ALA  63  -1.892 -23.146  -1.042
    3    HB3  ALA  63           HB1      ALA  63   0.522 -23.303  -0.494
    4    HB2  ALA  63           HB2      ALA  63  -0.202 -24.854  -0.913
    5    HB1  ALA  63           HB3      ALA  63   0.126 -24.463   0.776

  No H/Q in entry =           5
  In of MODEL   57
    1    H    GLY  64           H        GLY  64  -2.318 -25.620  -1.112
    2    HA3  GLY  64           HA2      GLY  64  -3.171 -27.530   0.215
    3    HA2  GLY  64           HA3      GLY  64  -4.082 -26.354   1.147

  No H/Q in entry =           3
  In of MODEL   57
    1    H    GLU  65           H        GLU  65  -4.717 -24.860  -1.422
    2    HA   GLU  65           HA       GLU  65  -7.204 -26.125  -1.902
    3    HB2  GLU  65           HB2      GLU  65  -5.789 -23.933  -3.421
    4    HB3  GLU  65           HB3      GLU  65  -7.456 -24.432  -3.708
    5    HG2  GLU  65           HG2      GLU  65  -6.390 -23.486  -1.034
    6    HG3  GLU  65           HG3      GLU  65  -7.283 -22.471  -2.164

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLY  66           H        GLY  66  -4.211 -26.058  -3.678
    2    HA3  GLY  66           HA2      GLY  66  -4.703 -28.512  -5.024
    3    HA2  GLY  66           HA3      GLY  66  -4.889 -27.154  -6.117

  No H/Q in entry =           3
  In of MODEL   57
    1    H    LYS  67           H        LYS  67  -3.097 -25.907  -6.664
    2    HA   LYS  67           HA       LYS  67  -0.609 -27.376  -6.647
    3    HB2  LYS  67           HB2      LYS  67  -1.520 -24.882  -8.072
    4    HB3  LYS  67           HB3      LYS  67   0.093 -25.580  -8.259
    5    HG2  LYS  67           HG2      LYS  67  -0.904 -27.726  -8.947
    6    HG3  LYS  67           HG3      LYS  67  -2.517 -27.045  -8.752
    7    HD2  LYS  67           HD2      LYS  67  -2.032 -25.381 -10.506
    8    HD3  LYS  67           HD3      LYS  67  -0.413 -26.059 -10.700
    9    HE2  LYS  67           HE2      LYS  67  -1.382 -28.231 -11.332
   10    HE3  LYS  67           HE3      LYS  67  -3.005 -27.579 -11.113
   11    HZ3  LYS  67           HZ1      LYS  67  -2.746 -26.144 -12.918
   12    HZ2  LYS  67           HZ2      LYS  67  -2.083 -27.612 -13.454
   13    HZ1  LYS  67           HZ3      LYS  67  -1.063 -26.343 -12.968

  No H/Q in entry =          13
  In of MODEL   57
    1    H    MET  68           H        MET  68   1.430 -26.496  -6.242
    2    HA   MET  68           HA       MET  68   1.922 -25.580  -3.728
    3    HB2  MET  68           HB2      MET  68   3.562 -25.185  -6.231
    4    HB3  MET  68           HB3      MET  68   4.168 -24.893  -4.600
    5    HG2  MET  68           HG2      MET  68   3.946 -27.171  -3.987
    6    HG3  MET  68           HG3      MET  68   2.903 -27.525  -5.366
    7    HE3  MET  68           HE1      MET  68   5.840 -25.081  -6.085
    8    HE2  MET  68           HE2      MET  68   7.240 -26.132  -5.873
    9    HE1  MET  68           HE3      MET  68   6.177 -25.803  -4.507

  No H/Q in entry =           9
  In of MODEL   57
    1    H    LYS  69           H        LYS  69   0.422 -23.687  -6.033
    2    HA   LYS  69           HA       LYS  69   1.644 -21.173  -5.448
    3    HB2  LYS  69           HB2      LYS  69  -0.893 -21.854  -6.904
    4    HB3  LYS  69           HB3      LYS  69  -0.280 -20.207  -6.718
    5    HG2  LYS  69           HG2      LYS  69   1.847 -20.863  -7.761
    6    HG3  LYS  69           HG3      LYS  69   1.259 -22.517  -7.937
    7    HD2  LYS  69           HD2      LYS  69  -0.567 -21.720  -9.389
    8    HD3  LYS  69           HD3      LYS  69   0.016 -20.064  -9.213
    9    HE2  LYS  69           HE2      LYS  69   2.173 -20.707 -10.221
   10    HE3  LYS  69           HE3      LYS  69   1.601 -22.366 -10.390
   11    HZ1  LYS  69           HZ1      LYS  69  -0.370 -21.038 -11.579
   12    HZ3  LYS  69           HZ2      LYS  69   0.986 -21.639 -12.408
   13    HZ2  LYS  69           HZ3      LYS  69   0.927 -20.007 -11.939

  No H/Q in entry =          13
  In of MODEL   57
    1    H    VAL  70           H        VAL  70  -0.210 -19.292  -5.116
    2    HA   VAL  70           HA       VAL  70  -1.606 -19.902  -2.575
    3    HB   VAL  70           HB       VAL  70  -0.890 -17.669  -1.744
    4   HG12  VAL  70          HG11      VAL  70   1.476 -19.367  -2.580
    5   HG11  VAL  70          HG12      VAL  70   0.399 -19.772  -1.242
    6   HG13  VAL  70          HG13      VAL  70   1.375 -18.305  -1.176
    7   HG21  VAL  70          HG21      VAL  70   0.521 -17.619  -4.418
    8   HG23  VAL  70          HG22      VAL  70   1.180 -16.721  -3.052
    9   HG22  VAL  70          HG23      VAL  70  -0.434 -16.349  -3.648

  No H/Q in entry =           9
  In of MODEL   57
    1    H    SER  71           H        SER  71  -3.248 -18.262  -2.049
    2    HA   SER  71           HA       SER  71  -5.049 -17.773  -4.172
    3    HB2  SER  71           HB2      SER  71  -5.720 -17.931  -1.763
    4    HB3  SER  71           HB3      SER  71  -4.920 -16.391  -1.466
    5    HG   SER  71           HG       SER  71  -6.340 -15.634  -3.269

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LEU  72           H        LEU  72  -5.323 -16.067  -5.493
    2    HA   LEU  72           HA       LEU  72  -3.187 -14.286  -5.965
    3    HB2  LEU  72           HB2      LEU  72  -6.049 -14.299  -6.922
    4    HB3  LEU  72           HB3      LEU  72  -4.833 -13.159  -7.493
    5    HG   LEU  72           HG       LEU  72  -4.464 -16.169  -7.622
    6   HD11  LEU  72          HD11      LEU  72  -5.685 -14.220  -9.574
    7   HD13  LEU  72          HD12      LEU  72  -6.292 -15.796  -9.064
    8   HD12  LEU  72          HD13      LEU  72  -4.896 -15.694 -10.137
    9   HD22  LEU  72          HD21      LEU  72  -2.337 -15.199  -7.868
   10   HD21  LEU  72          HD22      LEU  72  -2.958 -13.774  -8.685
   11   HD23  LEU  72          HD23      LEU  72  -2.882 -15.313  -9.537

  No H/Q in entry =          11
  In of MODEL   57
    1    H    VAL  73           H        VAL  73  -6.282 -13.885  -4.348
    2    HA   VAL  73           HA       VAL  73  -6.289 -11.114  -3.996
    3    HB   VAL  73           HB       VAL  73  -8.037 -11.441  -2.464
    4   HG11  VAL  73          HG11      VAL  73  -8.391 -12.344  -4.807
    5   HG13  VAL  73          HG12      VAL  73  -9.459 -13.021  -3.579
    6   HG12  VAL  73          HG13      VAL  73  -8.075 -13.952  -4.154
    7   HG22  VAL  73          HG21      VAL  73  -7.011 -12.825  -0.807
    8   HG21  VAL  73          HG22      VAL  73  -6.744 -14.130  -1.965
    9   HG23  VAL  73          HG23      VAL  73  -8.380 -13.753  -1.422

  No H/Q in entry =           9
  In of MODEL   57
    1    H    LEU  74           H        LEU  74  -4.392 -13.511  -2.405
    2    HA   LEU  74           HA       LEU  74  -3.974 -12.377   0.120
    3    HB2  LEU  74           HB2      LEU  74  -3.220 -14.605  -0.372
    4    HB3  LEU  74           HB3      LEU  74  -2.157 -14.011  -1.647
    5    HG   LEU  74           HG       LEU  74  -0.836 -12.769   0.037
    6   HD12  LEU  74          HD11      LEU  74  -1.326 -13.483   2.474
    7   HD11  LEU  74          HD12      LEU  74  -2.922 -13.944   1.881
    8   HD13  LEU  74          HD13      LEU  74  -2.387 -12.267   1.762
    9   HD21  LEU  74          HD21      LEU  74  -0.665 -15.336  -0.580
   10   HD23  LEU  74          HD22      LEU  74  -1.089 -15.510   1.109
   11   HD22  LEU  74          HD23      LEU  74   0.357 -14.631   0.671

  No H/Q in entry =          11
  In of MODEL   57
    1    H    VAL  75           H        VAL  75  -2.066 -12.009  -2.829
    2    HA   VAL  75           HA       VAL  75  -0.245 -10.111  -1.810
    3    HB   VAL  75           HB       VAL  75  -1.196 -10.581  -4.637
    4   HG12  VAL  75          HG11      VAL  75   0.878  -9.296  -5.254
    5   HG11  VAL  75          HG12      VAL  75   1.096  -8.904  -3.556
    6   HG13  VAL  75          HG13      VAL  75  -0.308  -8.298  -4.421
    7   HG23  VAL  75          HG21      VAL  75   1.423 -11.309  -3.294
    8   HG22  VAL  75          HG22      VAL  75   0.808 -11.887  -4.843
    9   HG21  VAL  75          HG23      VAL  75   0.045 -12.410  -3.341

  No H/Q in entry =           9
  In of MODEL   57
    1    H    GLU  76           H        GLU  76  -3.384  -9.718  -3.481
    2    HA   GLU  76           HA       GLU  76  -3.395  -6.903  -3.580
    3    HB2  GLU  76           HB2      GLU  76  -5.070  -8.314  -4.751
    4    HB3  GLU  76           HB3      GLU  76  -5.735  -8.808  -3.203
    5    HG2  GLU  76           HG2      GLU  76  -7.163  -7.075  -4.080
    6    HG3  GLU  76           HG3      GLU  76  -6.276  -6.376  -2.739

  No H/Q in entry =           6
  In of MODEL   57
    1    H    ALA  77           H        ALA  77  -4.548  -9.116  -1.046
    2    HA   ALA  77           HA       ALA  77  -5.482  -7.102   0.710
    3    HB3  ALA  77           HB1      ALA  77  -5.624  -8.802   2.355
    4    HB1  ALA  77           HB2      ALA  77  -4.347  -9.753   1.599
    5    HB2  ALA  77           HB3      ALA  77  -5.923  -9.621   0.823

  No H/Q in entry =           5
  In of MODEL   57
    1    H    GLN  78           H        GLN  78  -2.356  -8.696   0.357
    2    HA   GLN  78           HA       GLN  78  -1.091  -7.556   2.613
    3    HB2  GLN  78           HB2      GLN  78  -0.252  -9.508   1.261
    4    HB3  GLN  78           HB3      GLN  78   0.204  -8.369  -0.004
    5    HG2  GLN  78           HG2      GLN  78   1.677  -7.195   1.579
    6    HG3  GLN  78           HG3      GLN  78   1.223  -8.327   2.851
    7   HE21  GLN  78          HE21      GLN  78   3.949  -8.108   2.042
    8   HE22  GLN  78          HE22      GLN  78   4.394  -9.542   1.249

  No H/Q in entry =           8
  In of MODEL   57
    1    H    LEU  79           H        LEU  79  -1.428  -6.488  -0.735
    2    HA   LEU  79           HA       LEU  79   0.291  -4.286  -0.713
    3    HB2  LEU  79           HB2      LEU  79  -0.740  -5.076  -2.772
    4    HB3  LEU  79           HB3      LEU  79  -2.339  -4.661  -2.169
    5    HG   LEU  79           HG       LEU  79  -1.760  -2.282  -2.140
    6   HD13  LEU  79          HD11      LEU  79   0.482  -2.073  -1.618
    7   HD12  LEU  79          HD12      LEU  79   0.542  -1.785  -3.357
    8   HD11  LEU  79          HD13      LEU  79   0.970  -3.370  -2.710
    9   HD23  LEU  79          HD21      LEU  79  -1.112  -2.091  -4.689
   10   HD22  LEU  79          HD22      LEU  79  -2.652  -2.816  -4.237
   11   HD21  LEU  79          HD23      LEU  79  -1.293  -3.845  -4.677

  No H/Q in entry =          11
  In of MODEL   57
    1    H    HIS  80           H        HIS  80  -3.181  -4.396   0.099
    2    HA   HIS  80           HA       HIS  80  -3.333  -1.638   0.764
    3    HB2  HIS  80           HB2      HIS  80  -5.072  -4.020   1.074
    4    HB3  HIS  80           HB3      HIS  80  -5.376  -2.676   2.178
    5    HD1  HIS  80           HD1      HIS  80  -6.965  -1.013   1.265
    6    HD2  HIS  80           HD2      HIS  80  -4.788  -2.858  -1.775
    7    HE1  HIS  80           HE1      HIS  80  -7.780  -0.002  -0.917
    8    HE2  HIS  80           HE2      HIS  80  -6.460  -1.120  -2.779

  No H/Q in entry =           8
  In of MODEL   57
    1    H    LEU  81           H        LEU  81  -2.897  -4.541   2.757
    2    HA   LEU  81           HA       LEU  81  -2.873  -3.196   5.242
    3    HB2  LEU  81           HB2      LEU  81  -1.692  -5.830   4.365
    4    HB3  LEU  81           HB3      LEU  81  -1.664  -5.273   6.040
    5    HG   LEU  81           HG       LEU  81  -4.207  -5.484   4.402
    6   HD12  LEU  81          HD11      LEU  81  -4.549  -7.546   5.947
    7   HD11  LEU  81          HD12      LEU  81  -2.796  -7.503   6.139
    8   HD13  LEU  81          HD13      LEU  81  -3.502  -7.721   4.537
    9   HD23  LEU  81          HD21      LEU  81  -5.063  -5.675   6.899
   10   HD22  LEU  81          HD22      LEU  81  -4.711  -4.092   6.212
   11   HD21  LEU  81          HD23      LEU  81  -3.540  -4.871   7.276

  No H/Q in entry =          11
  In of MODEL   57
    1    H    MET  82           H        MET  82  -0.198  -4.140   3.081
    2    HA   MET  82           HA       MET  82   1.892  -3.281   4.774
    3    HB2  MET  82           HB2      MET  82   1.684  -3.617   1.781
    4    HB3  MET  82           HB3      MET  82   3.172  -3.071   2.550
    5    HG2  MET  82           HG2      MET  82   1.720  -5.638   3.267
    6    HG3  MET  82           HG3      MET  82   3.098  -5.550   2.173
    7    HE3  MET  82           HE1      MET  82   6.117  -4.864   4.168
    8    HE2  MET  82           HE2      MET  82   5.219  -3.481   3.548
    9    HE1  MET  82           HE3      MET  82   5.287  -4.972   2.611

  No H/Q in entry =           9
  In of MODEL   57
    1    H    THR  83           H        THR  83   0.107  -1.608   2.211
    2    HA   THR  83           HA       THR  83   1.559   0.817   2.304
    3    HB   THR  83           HB       THR  83  -0.598   1.778   1.311
    4    HG1  THR  83           HG1      THR  83  -2.269   0.508   1.196
    5   HG22  THR  83          HG21      THR  83  -0.350  -0.043  -0.690
    6   HG21  THR  83          HG22      THR  83   1.142  -0.360   0.192
    7   HG23  THR  83          HG23      THR  83   0.810   1.259  -0.423

  No H/Q in entry =           7
  In of MODEL   57
    1    H    SER  84           H        SER  84  -1.470  -0.167   3.894
    2    HA   SER  84           HA       SER  84  -1.931   2.270   5.238
    3    HB2  SER  84           HB2      SER  84  -2.813  -0.553   5.797
    4    HB3  SER  84           HB3      SER  84  -3.288   0.795   6.829
    5    HG   SER  84           HG       SER  84  -3.741   0.490   4.035

  No H/Q in entry =           5
  In of MODEL   57
    1    H    MET  85           H        MET  85  -0.274  -0.690   6.372
    2    HA   MET  85           HA       MET  85   0.251   0.226   8.979
    3    HB2  MET  85           HB2      MET  85   0.506  -2.122   8.298
    4    HB3  MET  85           HB3      MET  85   1.902  -1.679   7.314
    5    HG2  MET  85           HG2      MET  85   3.090  -0.887   9.310
    6    HG3  MET  85           HG3      MET  85   1.681  -1.249  10.308
    7    HE3  MET  85           HE1      MET  85   3.246  -3.642   7.295
    8    HE2  MET  85           HE2      MET  85   4.638  -4.050   8.296
    9    HE1  MET  85           HE3      MET  85   4.274  -2.363   7.951

  No H/Q in entry =           9
  In of MODEL   57
    1    H    LEU  86           H        LEU  86   2.201   0.451   6.035
    2    HA   LEU  86           HA       LEU  86   4.432   1.723   7.200
    3    HB2  LEU  86           HB2      LEU  86   4.231   0.645   4.890
    4    HB3  LEU  86           HB3      LEU  86   3.450   2.140   4.375
    5    HG   LEU  86           HG       LEU  86   5.496   3.351   5.363
    6   HD11  LEU  86          HD11      LEU  86   6.153   0.728   6.164
    7   HD13  LEU  86          HD12      LEU  86   7.181   2.155   6.266
    8   HD12  LEU  86          HD13      LEU  86   7.278   1.106   4.855
    9   HD23  LEU  86          HD21      LEU  86   6.191   1.577   3.015
   10   HD22  LEU  86          HD22      LEU  86   6.613   3.268   3.279
   11   HD21  LEU  86          HD23      LEU  86   4.954   2.828   2.874

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ALA  87           H        ALA  87   1.548   3.017   5.605
    2    HA   ALA  87           HA       ALA  87   2.188   5.736   5.692
    3    HB1  ALA  87           HB1      ALA  87  -0.147   4.148   5.141
    4    HB3  ALA  87           HB2      ALA  87   0.194   5.804   4.643
    5    HB2  ALA  87           HB3      ALA  87  -0.611   5.495   6.183

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ARG  88           H        ARG  88   0.455   3.763   8.075
    2    HA   ARG  88           HA       ARG  88  -0.028   5.820   9.920
    3    HB2  ARG  88           HB2      ARG  88  -1.007   3.484   9.982
    4    HB3  ARG  88           HB3      ARG  88   0.522   2.958  10.694
    5    HG2  ARG  88           HG2      ARG  88   0.075   5.039  12.313
    6    HG3  ARG  88           HG3      ARG  88  -1.595   4.743  11.850
    7    HD2  ARG  88           HD2      ARG  88  -1.738   2.895  13.096
    8    HD3  ARG  88           HD3      ARG  88  -0.157   2.287  12.571
    9    HE   ARG  88           HE       ARG  88  -0.679   3.558  15.023
   10   HH21  ARG  88          HH11      ARG  88   0.892   4.543  16.268
   11   HH22  ARG  88          HH12      ARG  88   2.421   4.944  15.569
   12   HH11  ARG  88          HH21      ARG  88   1.614   3.702  12.455
   13   HH12  ARG  88          HH22      ARG  88   2.838   4.452  13.422

  No H/Q in entry =          13
  In of MODEL   57
    1    H    GLU  89           H        GLU  89   2.731   3.554   9.707
    2    HA   GLU  89           HA       GLU  89   3.999   4.421  12.056
    3    HB2  GLU  89           HB2      GLU  89   4.628   2.392  10.714
    4    HB3  GLU  89           HB3      GLU  89   5.427   3.474   9.571
    5    HG2  GLU  89           HG2      GLU  89   6.919   4.295  11.320
    6    HG3  GLU  89           HG3      GLU  89   6.064   3.353  12.537

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LEU  90           H        LEU  90   4.347   5.574   8.730
    2    HA   LEU  90           HA       LEU  90   6.308   7.542   9.323
    3    HB2  LEU  90           HB2      LEU  90   4.306   7.244   7.088
    4    HB3  LEU  90           HB3      LEU  90   5.557   8.494   7.114
    5    HG   LEU  90           HG       LEU  90   6.181   5.547   7.450
    6   HD12  LEU  90          HD11      LEU  90   6.942   5.769   5.013
    7   HD11  LEU  90          HD12      LEU  90   5.951   7.226   4.961
    8   HD13  LEU  90          HD13      LEU  90   5.204   5.665   5.301
    9   HD22  LEU  90          HD21      LEU  90   8.094   6.666   8.139
   10   HD21  LEU  90          HD22      LEU  90   7.771   8.076   7.131
   11   HD23  LEU  90          HD23      LEU  90   8.409   6.601   6.406

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  91           H        ILE  91   2.771   7.615   9.160
    2    HA   ILE  91           HA       ILE  91   2.471  10.393   9.610
    3    HB   ILE  91           HB       ILE  91   0.640   8.046  10.146
    4   HG12  ILE  91          HG12      ILE  91   0.436  10.332   8.160
    5   HG13  ILE  91          HG13      ILE  91   1.274   8.824   7.791
    6   HG22  ILE  91          HG21      ILE  91  -1.059  10.132  10.203
    7   HG21  ILE  91          HG22      ILE  91   0.353  10.940  10.881
    8   HG23  ILE  91          HG23      ILE  91  -0.310   9.513  11.675
    9   HD13  ILE  91          HD11      ILE  91  -0.691   7.568   7.828
   10   HD12  ILE  91          HD12      ILE  91  -1.253   9.092   7.144
   11   HD11  ILE  91          HD13      ILE  91  -1.537   8.732   8.848

  No H/Q in entry =          11
  In of MODEL   57
    1    H    THR  92           H        THR  92   2.823   7.645  11.813
    2    HA   THR  92           HA       THR  92   2.391   9.026  14.235
    3    HB   THR  92           HB       THR  92   4.166   6.663  13.577
    4    HG1  THR  92           HG1      THR  92   2.186   5.937  13.469
    5   HG22  THR  92          HG21      THR  92   3.768   6.385  16.209
    6   HG21  THR  92          HG22      THR  92   3.730   8.145  16.136
    7   HG23  THR  92          HG23      THR  92   5.152   7.267  15.569

  No H/Q in entry =           7
  In of MODEL   57
    1    H    GLU  93           H        GLU  93   5.343   8.531  12.313
    2    HA   GLU  93           HA       GLU  93   7.111   9.931  14.017
    3    HB2  GLU  93           HB2      GLU  93   7.207   9.615  11.002
    4    HB3  GLU  93           HB3      GLU  93   8.551  10.125  12.022
    5    HG2  GLU  93           HG2      GLU  93   7.100   7.510  12.464
    6    HG3  GLU  93           HG3      GLU  93   8.490   7.641  11.394

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LEU  94           H        LEU  94   5.089  10.977  11.296
    2    HA   LEU  94           HA       LEU  94   5.935  13.668  11.199
    3    HB2  LEU  94           HB2      LEU  94   3.328  12.342  10.434
    4    HB3  LEU  94           HB3      LEU  94   3.613  14.065  10.194
    5    HG   LEU  94           HG       LEU  94   5.605  12.047   9.152
    6   HD11  LEU  94          HD11      LEU  94   2.876  12.638   8.078
    7   HD13  LEU  94          HD12      LEU  94   3.838  11.168   7.957
    8   HD12  LEU  94          HD13      LEU  94   4.197  12.543   6.914
    9   HD23  LEU  94          HD21      LEU  94   5.889  13.879   7.430
   10   HD22  LEU  94          HD22      LEU  94   6.304  14.366   9.074
   11   HD21  LEU  94          HD23      LEU  94   4.763  14.857   8.369

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  95           H        ILE  95   3.366  12.089  13.080
    2    HA   ILE  95           HA       ILE  95   2.352  14.454  14.270
    3    HB   ILE  95           HB       ILE  95   2.324  11.572  15.195
    4   HG12  ILE  95          HG12      ILE  95   0.134  13.378  14.136
    5   HG13  ILE  95          HG13      ILE  95   1.079  12.304  13.108
    6   HG21  ILE  95          HG21      ILE  95   1.072  14.063  16.391
    7   HG23  ILE  95          HG22      ILE  95   2.100  12.880  17.200
    8   HG22  ILE  95          HG23      ILE  95   0.461  12.442  16.718
    9   HD13  ILE  95          HD11      ILE  95   0.145  10.379  14.024
   10   HD12  ILE  95          HD12      ILE  95  -1.222  11.488  14.094
   11   HD11  ILE  95          HD13      ILE  95  -0.268  11.177  15.543

  No H/Q in entry =          11
  In of MODEL   57
    1    H    GLU  96           H        GLU  96   4.912  12.199  15.277
    2    HA   GLU  96           HA       GLU  96   5.473  13.390  17.771
    3    HB2  GLU  96           HB2      GLU  96   6.393  11.218  17.128
    4    HB3  GLU  96           HB3      GLU  96   7.343  11.978  15.852
    5    HG2  GLU  96           HG2      GLU  96   8.992  12.504  17.321
    6    HG3  GLU  96           HG3      GLU  96   7.853  13.333  18.371

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LEU  97           H        LEU  97   6.572  14.146  14.489
    2    HA   LEU  97           HA       LEU  97   8.482  16.117  15.209
    3    HB2  LEU  97           HB2      LEU  97   6.894  15.589  12.707
    4    HB3  LEU  97           HB3      LEU  97   7.932  17.006  12.833
    5    HG   LEU  97           HG       LEU  97   8.921  14.195  13.398
    6   HD12  LEU  97          HD11      LEU  97   9.930  14.375  11.085
    7   HD11  LEU  97          HD12      LEU  97   8.899  15.779  10.817
    8   HD13  LEU  97          HD13      LEU  97   8.177  14.197  11.109
    9   HD23  LEU  97          HD21      LEU  97  11.110  15.444  12.664
   10   HD22  LEU  97          HD22      LEU  97  10.488  15.722  14.291
   11   HD21  LEU  97          HD23      LEU  97  10.195  16.909  13.021

  No H/Q in entry =          11
  In of MODEL   57
    1    H    HIS  98           H        HIS  98   4.996  16.299  14.540
    2    HA   HIS  98           HA       HIS  98   4.733  19.102  14.673
    3    HB2  HIS  98           HB2      HIS  98   2.810  16.877  15.391
    4    HB3  HIS  98           HB3      HIS  98   2.366  18.584  15.445
    5    HD1  HIS  98           HD1      HIS  98   3.361  15.855  13.045
    6    HD2  HIS  98           HD2      HIS  98   2.038  19.806  12.916
    7    HE1  HIS  98           HE1      HIS  98   2.819  16.350  10.618
    8    HE2  HIS  98           HE2      HIS  98   2.017  18.750  10.519

  No H/Q in entry =           8
  In of MODEL   57
    1    H    GLU  99           H        GLU  99   4.823  16.613  17.173
    2    HA   GLU  99           HA       GLU  99   4.228  18.316  19.368
    3    HB2  GLU  99           HB2      GLU  99   4.105  15.835  19.465
    4    HB3  GLU  99           HB3      GLU  99   5.865  15.767  19.364
    5    HG2  GLU  99           HG2      GLU  99   6.062  17.057  21.439
    6    HG3  GLU  99           HG3      GLU  99   4.311  17.221  21.527

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LYS 100           H        LYS 100   7.275  17.344  17.817
    2    HA   LYS 100           HA       LYS 100   8.941  18.723  19.680
    3    HB2  LYS 100           HB2      LYS 100   9.439  17.792  16.844
    4    HB3  LYS 100           HB3      LYS 100  10.675  18.545  17.857
    5    HG2  LYS 100           HG2      LYS 100  10.268  16.800  19.597
    6    HG3  LYS 100           HG3      LYS 100   9.130  16.011  18.501
    7    HD2  LYS 100           HD2      LYS 100  10.928  15.704  16.841
    8    HD3  LYS 100           HD3      LYS 100  12.071  16.505  17.922
    9    HE2  LYS 100           HE2      LYS 100  11.644  14.755  19.639
   10    HE3  LYS 100           HE3      LYS 100  10.563  13.934  18.509
   11    HZ1  LYS 100           HZ1      LYS 100  13.394  14.566  17.866
   12    HZ3  LYS 100           HZ2      LYS 100  12.340  13.525  17.034
   13    HZ2  LYS 100           HZ3      LYS 100  12.917  13.098  18.574

  No H/Q in entry =          13
  In of MODEL   57
    1    H    LEU 101           H        LEU 101   7.272  19.672  16.717
    2    HA   LEU 101           HA       LEU 101   8.522  22.212  16.387
    3    HB2  LEU 101           HB2      LEU 101   5.914  21.013  15.489
    4    HB3  LEU 101           HB3      LEU 101   6.189  22.741  15.283
    5    HG   LEU 101           HG       LEU 101   8.202  20.697  14.326
    6   HD12  LEU 101          HD11      LEU 101   7.066  21.218  12.036
    7   HD11  LEU 101          HD12      LEU 101   5.668  21.667  13.010
    8   HD13  LEU 101          HD13      LEU 101   6.310  20.028  13.095
    9   HD21  LEU 101          HD21      LEU 101   7.616  23.618  13.767
   10   HD23  LEU 101          HD22      LEU 101   8.588  22.645  12.665
   11   HD22  LEU 101          HD23      LEU 101   9.126  22.895  14.325

  No H/Q in entry =          11
  In of MODEL   57
    1    H    LYS 102           H        LYS 102   6.958  21.096  18.996
    2    HA   LYS 102           HA       LYS 102   6.332  22.196  20.926
    3    HB2  LYS 102           HB2      LYS 102   7.647  24.168  19.807
    4    HB3  LYS 102           HB3      LYS 102   6.058  24.795  19.424
    5    HG2  LYS 102           HG2      LYS 102   7.420  24.521  22.082
    6    HG3  LYS 102           HG3      LYS 102   6.488  25.862  21.449
    7    HD2  LYS 102           HD2      LYS 102   5.205  23.243  22.322
    8    HD3  LYS 102           HD3      LYS 102   5.467  24.600  23.407
    9    HE2  LYS 102           HE2      LYS 102   3.189  24.228  21.908
   10    HE3  LYS 102           HE3      LYS 102   3.710  25.767  22.592
   11    HZ2  LYS 102           HZ1      LYS 102   3.191  25.882  20.210
   12    HZ1  LYS 102           HZ2      LYS 102   4.439  24.783  19.893
   13    HZ3  LYS 102           HZ3      LYS 102   4.800  26.309  20.537

  No H/Q in entry =          13
  In of MODEL   57
    1    H    ALA 103           H        ALA 103   4.727  23.761  18.151
    2    HA   ALA 103           HA       ALA 103   2.278  24.371  19.026
    3    HB1  ALA 103           HB1      ALA 103   1.377  23.541  16.780
    4    HB2  ALA 103           HB2      ALA 103   3.018  22.982  16.457
    5    HB3  ALA 103           HB3      ALA 103   2.706  24.698  16.722

  No H/Q in entry =           5
  In of MODEL   57
    1    H1   ALA   1           H3       ALA   1  10.373 -20.244  -6.212
    2    H2   ALA   1           H2       ALA   1   9.412 -20.437  -7.602
    3    H3   ALA   1           H1       ALA   1   8.958 -21.177  -6.141
    4    HA   ALA   1           HA       ALA   1   9.974 -23.000  -6.876
    5    HB1  ALA   1           HB1      ALA   1  10.084 -22.642  -9.152
    6    HB2  ALA   1           HB2      ALA   1  11.812 -22.517  -8.816
    7    HB3  ALA   1           HB3      ALA   1  10.835 -21.055  -8.970

  No H/Q in entry =           7
  In of MODEL   57
    1    H    GLU   2           H        GLU   2  12.244 -23.983  -6.925
    2    HA   GLU   2           HA       GLU   2  13.618 -23.922  -4.708
    3    HB2  GLU   2           HB2      GLU   2  14.987 -23.810  -7.401
    4    HB3  GLU   2           HB3      GLU   2  15.700 -24.431  -5.914
    5    HG2  GLU   2           HG2      GLU   2  14.655 -26.433  -6.159
    6    HG3  GLU   2           HG3      GLU   2  13.096 -25.665  -6.424

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLU   3           H        GLU   3  15.426 -22.083  -7.102
    2    HA   GLU   3           HA       GLU   3  16.595 -20.413  -5.138
    3    HB2  GLU   3           HB2      GLU   3  16.551 -20.410  -8.148
    4    HB3  GLU   3           HB3      GLU   3  17.313 -19.092  -7.258
    5    HG2  GLU   3           HG2      GLU   3  18.952 -20.490  -6.329
    6    HG3  GLU   3           HG3      GLU   3  17.985 -21.943  -6.553

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LEU   4           H        LEU   4  14.336 -19.532  -7.777
    2    HA   LEU   4           HA       LEU   4  13.906 -16.916  -7.167
    3    HB2  LEU   4           HB2      LEU   4  11.705 -18.859  -7.906
    4    HB3  LEU   4           HB3      LEU   4  11.656 -17.109  -8.105
    5    HG   LEU   4           HG       LEU   4  13.598 -19.001  -9.471
    6   HD13  LEU   4          HD11      LEU   4  12.306 -18.833 -11.386
    7   HD12  LEU   4          HD12      LEU   4  11.619 -17.278 -10.921
    8   HD11  LEU   4          HD13      LEU   4  11.041 -18.760 -10.162
    9   HD23  LEU   4          HD21      LEU   4  13.973 -16.761 -10.821
   10   HD22  LEU   4          HD22      LEU   4  14.823 -17.016  -9.298
   11   HD21  LEU   4          HD23      LEU   4  13.385 -15.998  -9.342

  No H/Q in entry =          11
  In of MODEL   57
    1    H    GLU   5           H        GLU   5  12.374 -19.678  -5.532
    2    HA   GLU   5           HA       GLU   5  10.713 -18.083  -3.835
    3    HB2  GLU   5           HB2      GLU   5  10.253 -20.454  -4.358
    4    HB3  GLU   5           HB3      GLU   5  11.679 -20.912  -3.423
    5    HG2  GLU   5           HG2      GLU   5  10.723 -19.877  -1.415
    6    HG3  GLU   5           HG3      GLU   5   9.312 -19.364  -2.340

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLU   6           H        GLU   6  13.834 -19.708  -3.380
    2    HA   GLU   6           HA       GLU   6  14.189 -18.857  -0.680
    3    HB2  GLU   6           HB2      GLU   6  15.965 -20.022  -2.801
    4    HB3  GLU   6           HB3      GLU   6  16.680 -19.362  -1.328
    5    HG2  GLU   6           HG2      GLU   6  16.262 -21.729  -0.988
    6    HG3  GLU   6           HG3      GLU   6  15.130 -20.813   0.005

  No H/Q in entry =           6
  In of MODEL   57
    1    H    VAL   7           H        VAL   7  14.986 -17.541  -3.827
    2    HA   VAL   7           HA       VAL   7  16.699 -15.439  -2.956
    3    HB   VAL   7           HB       VAL   7  14.997 -15.778  -5.439
    4   HG11  VAL   7          HG11      VAL   7  16.919 -13.592  -4.620
    5   HG13  VAL   7          HG12      VAL   7  15.281 -13.426  -5.249
    6   HG12  VAL   7          HG13      VAL   7  16.587 -13.947  -6.315
    7   HG21  VAL   7          HG21      VAL   7  17.081 -17.264  -4.863
    8   HG23  VAL   7          HG22      VAL   7  18.008 -15.816  -5.257
    9   HG22  VAL   7          HG23      VAL   7  16.966 -16.551  -6.473

  No H/Q in entry =           9
  In of MODEL   57
    1    H    VAL   8           H        VAL   8  13.205 -15.659  -3.526
    2    HA   VAL   8           HA       VAL   8  12.575 -12.942  -3.056
    3    HB   VAL   8           HB       VAL   8  10.975 -15.487  -2.752
    4   HG13  VAL   8          HG11      VAL   8   9.886 -14.119  -1.194
    5   HG12  VAL   8          HG12      VAL   8   9.020 -13.737  -2.681
    6   HG11  VAL   8          HG13      VAL   8  10.263 -12.642  -2.078
    7   HG23  VAL   8          HG21      VAL   8   9.860 -13.692  -4.653
    8   HG22  VAL   8          HG22      VAL   8  10.736 -15.183  -4.990
    9   HG21  VAL   8          HG23      VAL   8  11.601 -13.652  -4.926

  No H/Q in entry =           9
  In of MODEL   57
    1    H    MET   9           H        MET   9  12.795 -15.751  -0.876
    2    HA   MET   9           HA       MET   9  11.988 -14.469   1.491
    3    HB2  MET   9           HB2      MET   9  13.866 -16.769   0.959
    4    HB3  MET   9           HB3      MET   9  13.565 -16.185   2.596
    5    HG2  MET   9           HG2      MET   9  11.169 -16.583   2.338
    6    HG3  MET   9           HG3      MET   9  11.408 -17.070   0.659
    7    HE3  MET   9           HE1      MET   9  13.834 -18.107   3.809
    8    HE2  MET   9           HE2      MET   9  12.635 -19.201   4.494
    9    HE1  MET   9           HE3      MET   9  12.227 -17.508   4.236

  No H/Q in entry =           9
  In of MODEL   57
    1    H    GLY  10           H        GLY  10  15.172 -14.736  -0.053
    2    HA3  GLY  10           HA2      GLY  10  16.642 -13.335   1.923
    3    HA2  GLY  10           HA3      GLY  10  17.109 -13.507   0.231

  No H/Q in entry =           3
  In of MODEL   57
    1    H    LEU  11           H        LEU  11  14.962 -12.257  -1.016
    2    HA   LEU  11           HA       LEU  11  15.683  -9.521  -0.850
    3    HB2  LEU  11           HB2      LEU  11  13.302 -10.900  -2.095
    4    HB3  LEU  11           HB3      LEU  11  13.605  -9.169  -2.253
    5    HG   LEU  11           HG       LEU  11  15.608 -11.304  -3.033
    6   HD13  LEU  11          HD11      LEU  11  13.864 -11.648  -4.560
    7   HD12  LEU  11          HD12      LEU  11  14.885 -10.480  -5.396
    8   HD11  LEU  11          HD13      LEU  11  13.416  -9.942  -4.584
    9   HD22  LEU  11          HD21      LEU  11  16.864  -9.356  -2.802
   10   HD21  LEU  11          HD22      LEU  11  15.504  -8.302  -3.186
   11   HD23  LEU  11          HD23      LEU  11  16.329  -9.181  -4.472

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  12           H        ILE  12  12.886 -11.311   0.406
    2    HA   ILE  12           HA       ILE  12  11.517  -9.070   1.460
    3    HB   ILE  12           HB       ILE  12  11.513 -11.952   2.412
    4   HG12  ILE  12          HG12      ILE  12  10.847 -11.319  -0.040
    5   HG13  ILE  12          HG13      ILE  12   9.797 -12.386   0.869
    6   HG22  ILE  12          HG21      ILE  12   9.241 -11.343   3.321
    7   HG21  ILE  12          HG22      ILE  12   9.602  -9.655   2.961
    8   HG23  ILE  12          HG23      ILE  12  10.577 -10.534   4.138
    9   HD13  ILE  12          HD11      ILE  12   8.305 -10.537   1.364
   10   HD12  ILE  12          HD12      ILE  12   8.591 -10.584  -0.375
   11   HD11  ILE  12          HD13      ILE  12   9.416  -9.400   0.617

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  13           H        ILE  13  13.876 -11.304   2.875
    2    HA   ILE  13           HA       ILE  13  13.916 -10.125   5.456
    3    HB   ILE  13           HB       ILE  13  15.973 -11.714   3.901
    4   HG12  ILE  13          HG12      ILE  13  13.689 -12.682   4.677
    5   HG13  ILE  13          HG13      ILE  13  15.151 -13.604   5.014
    6   HG21  ILE  13          HG21      ILE  13  16.156 -10.405   6.565
    7   HG23  ILE  13          HG22      ILE  13  17.437 -10.824   5.436
    8   HG22  ILE  13          HG23      ILE  13  16.742 -12.065   6.479
    9   HD12  ILE  13          HD11      ILE  13  13.305 -13.069   6.922
   10   HD11  ILE  13          HD12      ILE  13  14.316 -11.637   7.084
   11   HD13  ILE  13          HD13      ILE  13  15.022 -13.235   7.281

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ASN  14           H        ASN  14  15.887  -9.617   2.546
    2    HA   ASN  14           HA       ASN  14  17.649  -7.696   3.615
    3    HB2  ASN  14           HB2      ASN  14  17.622  -8.962   1.299
    4    HB3  ASN  14           HB3      ASN  14  16.747  -7.535   0.758
    5   HD21  ASN  14          HD21      ASN  14  19.189  -7.901  -0.418
    6   HD22  ASN  14          HD22      ASN  14  20.341  -6.831   0.215

  No H/Q in entry =           6
  In of MODEL   57
    1    H    SER  15           H        SER  15  14.550  -7.314   1.909
    2    HA   SER  15           HA       SER  15  14.468  -4.493   1.965
    3    HB2  SER  15           HB2      SER  15  12.136  -4.714   1.459
    4    HB3  SER  15           HB3      SER  15  12.920  -6.089   0.694
    5    HG   SER  15           HG       SER  15  11.061  -6.041   2.647

  No H/Q in entry =           5
  In of MODEL   57
    1    H    GLY  16           H        GLY  16  13.339  -6.941   4.264
    2    HA3  GLY  16           HA2      GLY  16  12.128  -5.179   6.117
    3    HA2  GLY  16           HA3      GLY  16  12.724  -6.794   6.481

  No H/Q in entry =           3
  In of MODEL   57
    1    H    GLN  17           H        GLN  17  15.441  -6.489   5.900
    2    HA   GLN  17           HA       GLN  17  16.401  -5.278   8.285
    3    HB2  GLN  17           HB2      GLN  17  17.636  -7.074   7.141
    4    HB3  GLN  17           HB3      GLN  17  17.912  -6.012   5.759
    5    HG2  GLN  17           HG2      GLN  17  19.195  -4.471   7.152
    6    HG3  GLN  17           HG3      GLN  17  18.853  -5.441   8.584
    7   HE21  GLN  17          HE21      GLN  17  21.546  -4.932   7.690
    8   HE22  GLN  17          HE22      GLN  17  22.215  -6.408   7.186

  No H/Q in entry =           8
  In of MODEL   57
    1    H    ALA  18           H        ALA  18  16.237  -4.199   4.924
    2    HA   ALA  18           HA       ALA  18  17.697  -1.821   5.158
    3    HB1  ALA  18           HB1      ALA  18  16.575  -3.024   3.085
    4    HB3  ALA  18           HB2      ALA  18  16.857  -1.284   3.071
    5    HB2  ALA  18           HB3      ALA  18  15.250  -1.913   3.434

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ARG  19           H        ARG  19  14.189  -2.373   5.539
    2    HA   ARG  19           HA       ARG  19  13.545   0.283   6.251
    3    HB2  ARG  19           HB2      ARG  19  11.849  -1.451   5.657
    4    HB3  ARG  19           HB3      ARG  19  12.176  -2.253   7.196
    5    HG2  ARG  19           HG2      ARG  19  11.480  -0.254   8.432
    6    HG3  ARG  19           HG3      ARG  19  11.245   0.624   6.922
    7    HD2  ARG  19           HD2      ARG  19   9.092  -0.151   7.733
    8    HD3  ARG  19           HD3      ARG  19   9.509  -1.034   6.259
    9    HE   ARG  19           HE       ARG  19  10.443  -2.586   8.368
   10   HH21  ARG  19          HH11      ARG  19   9.173  -4.214   9.301
   11   HH22  ARG  19          HH12      ARG  19   7.454  -4.169   9.123
   12   HH11  ARG  19          HH21      ARG  19   7.466  -1.264   7.260
   13   HH12  ARG  19          HH22      ARG  19   6.488  -2.499   7.963

  No H/Q in entry =          13
  In of MODEL   57
    1    H    SER  20           H        SER  20  14.365  -2.555   8.214
    2    HA   SER  20           HA       SER  20  14.082  -1.453  10.750
    3    HB2  SER  20           HB2      SER  20  14.696  -3.873  10.074
    4    HB3  SER  20           HB3      SER  20  16.362  -3.299  10.066
    5    HG   SER  20           HG       SER  20  14.504  -3.316  12.207

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LEU  21           H        LEU  21  16.935  -1.420   8.627
    2    HA   LEU  21           HA       LEU  21  18.617   0.049  10.373
    3    HB2  LEU  21           HB2      LEU  21  18.606  -0.219   7.359
    4    HB3  LEU  21           HB3      LEU  21  19.867   0.624   8.255
    5    HG   LEU  21           HG       LEU  21  19.089  -2.260   8.782
    6   HD12  LEU  21          HD11      LEU  21  21.221  -2.785   7.554
    7   HD11  LEU  21          HD12      LEU  21  21.285  -1.099   7.043
    8   HD13  LEU  21          HD13      LEU  21  19.951  -2.127   6.522
    9   HD23  LEU  21          HD21      LEU  21  21.566  -2.134   9.697
   10   HD22  LEU  21          HD22      LEU  21  20.258  -1.526  10.703
   11   HD21  LEU  21          HD23      LEU  21  21.253  -0.404   9.792

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ALA  22           H        ALA  22  16.374   1.041   7.807
    2    HA   ALA  22           HA       ALA  22  16.940   3.794   7.823
    3    HB3  ALA  22           HB1      ALA  22  15.533   2.566   6.139
    4    HB2  ALA  22           HB2      ALA  22  14.839   4.085   6.702
    5    HB1  ALA  22           HB3      ALA  22  14.230   2.552   7.327

  No H/Q in entry =           5
  In of MODEL   57
    1    H    TYR  23           H        TYR  23  14.417   2.003   9.647
    2    HA   TYR  23           HA       TYR  23  13.470   4.250  11.092
    3    HB2  TYR  23           HB2      TYR  23  12.214   2.148  11.064
    4    HB3  TYR  23           HB3      TYR  23  13.533   1.325  11.896
    5    HD1  TYR  23           HD1      TYR  23  11.039   4.075  12.245
    6    HD2  TYR  23           HD2      TYR  23  13.735   1.403  14.255
    7    HE1  TYR  23           HE1      TYR  23  10.106   4.779  14.435
    8    HE2  TYR  23           HE2      TYR  23  12.802   2.105  16.442
    9    HH   TYR  23           HH       TYR  23  10.578   4.788  16.714

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ALA  24           H        ALA  24  16.089   1.947  11.741
    2    HA   ALA  24           HA       ALA  24  16.758   2.935  14.307
    3    HB1  ALA  24           HB1      ALA  24  18.096   1.128  14.149
    4    HB3  ALA  24           HB2      ALA  24  19.138   2.039  13.055
    5    HB2  ALA  24           HB3      ALA  24  17.836   1.044  12.407

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ALA  25           H        ALA  25  17.740   3.854  11.033
    2    HA   ALA  25           HA       ALA  25  19.702   5.768  11.688
    3    HB1  ALA  25           HB1      ALA  25  18.986   4.828   9.369
    4    HB3  ALA  25           HB2      ALA  25  19.505   6.510   9.465
    5    HB2  ALA  25           HB3      ALA  25  17.787   6.121   9.388

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LEU  26           H        LEU  26  16.192   6.034  11.310
    2    HA   LEU  26           HA       LEU  26  15.996   8.818  11.761
    3    HB2  LEU  26           HB2      LEU  26  14.125   7.603  10.824
    4    HB3  LEU  26           HB3      LEU  26  14.016   6.577  12.249
    5    HG   LEU  26           HG       LEU  26  13.425   8.540  13.627
    6   HD12  LEU  26          HD11      LEU  26  12.794  10.648  12.299
    7   HD11  LEU  26          HD12      LEU  26  13.773   9.985  10.994
    8   HD13  LEU  26          HD13      LEU  26  14.515  10.362  12.549
    9   HD21  LEU  26          HD21      LEU  26  11.758   8.246  11.109
   10   HD23  LEU  26          HD22      LEU  26  11.198   8.950  12.623
   11   HD22  LEU  26          HD23      LEU  26  11.632   7.243  12.555

  No H/Q in entry =          11
  In of MODEL   57
    1    H    LYS  27           H        LYS  27  15.846   6.040  13.953
    2    HA   LYS  27           HA       LYS  27  15.258   7.412  16.319
    3    HB2  LYS  27           HB2      LYS  27  15.260   4.937  16.053
    4    HB3  LYS  27           HB3      LYS  27  17.024   4.969  16.018
    5    HG2  LYS  27           HG2      LYS  27  17.074   5.954  18.268
    6    HG3  LYS  27           HG3      LYS  27  15.308   5.993  18.306
    7    HD2  LYS  27           HD2      LYS  27  15.255   3.526  18.068
    8    HD3  LYS  27           HD3      LYS  27  17.020   3.495  18.065
    9    HE2  LYS  27           HE2      LYS  27  17.055   4.483  20.322
   10    HE3  LYS  27           HE3      LYS  27  15.289   4.544  20.328
   11    HZ3  LYS  27           HZ1      LYS  27  16.050   2.583  21.482
   12    HZ2  LYS  27           HZ2      LYS  27  16.966   2.093  20.135
   13    HZ1  LYS  27           HZ3      LYS  27  15.269   2.118  20.048

  No H/Q in entry =          13
  In of MODEL   57
    1    H    GLN  28           H        GLN  28  18.375   6.794  14.741
    2    HA   GLN  28           HA       GLN  28  20.062   7.857  16.739
    3    HB2  GLN  28           HB2      GLN  28  20.362   7.805  13.725
    4    HB3  GLN  28           HB3      GLN  28  21.649   8.267  14.840
    5    HG2  GLN  28           HG2      GLN  28  20.206   5.601  14.875
    6    HG3  GLN  28           HG3      GLN  28  21.798   5.875  14.170
    7   HE21  GLN  28          HE21      GLN  28  20.504   4.555  16.850
    8   HE22  GLN  28          HE22      GLN  28  21.677   4.975  18.001

  No H/Q in entry =           8
  In of MODEL   57
    1    H    ALA  29           H        ALA  29  18.341   9.361  14.039
    2    HA   ALA  29           HA       ALA  29  19.371  11.970  14.298
    3    HB2  ALA  29           HB1      ALA  29  17.687  12.628  12.819
    4    HB1  ALA  29           HB2      ALA  29  16.526  11.468  13.464
    5    HB3  ALA  29           HB3      ALA  29  17.854  10.910  12.447

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LYS  30           H        LYS  30  16.568  10.405  15.805
    2    HA   LYS  30           HA       LYS  30  15.576  12.671  17.159
    3    HB2  LYS  30           HB2      LYS  30  15.423   9.731  17.861
    4    HB3  LYS  30           HB3      LYS  30  14.570  10.992  18.751
    5    HG2  LYS  30           HG2      LYS  30  13.463  11.693  16.628
    6    HG3  LYS  30           HG3      LYS  30  14.255  10.347  15.804
    7    HD2  LYS  30           HD2      LYS  30  13.155   8.753  17.327
    8    HD3  LYS  30           HD3      LYS  30  12.374  10.088  18.175
    9    HE2  LYS  30           HE2      LYS  30  11.223  10.736  16.077
   10    HE3  LYS  30           HE3      LYS  30  11.984   9.373  15.249
   11    HZ2  LYS  30           HZ1      LYS  30   9.667   8.993  16.119
   12    HZ1  LYS  30           HZ2      LYS  30  10.328   9.037  17.689
   13    HZ3  LYS  30           HZ3      LYS  30  10.826   7.846  16.581

  No H/Q in entry =          13
  In of MODEL   57
    1    H    GLN  31           H        GLN  31  18.205  10.466  17.907
    2    HA   GLN  31           HA       GLN  31  18.533  11.476  20.603
    3    HB2  GLN  31           HB2      GLN  31  20.543   9.879  19.007
    4    HB3  GLN  31           HB3      GLN  31  20.402  10.004  20.761
    5    HG2  GLN  31           HG2      GLN  31  17.880   9.086  19.980
    6    HG3  GLN  31           HG3      GLN  31  18.975   8.227  18.905
    7   HE21  GLN  31          HE21      GLN  31  17.407   7.101  21.174
    8   HE22  GLN  31          HE22      GLN  31  18.549   6.424  22.229

  No H/Q in entry =           8
  In of MODEL   57
    1    H    GLY  32           H        GLY  32  19.083  12.787  17.639
    2    HA3  GLY  32           HA2      GLY  32  20.097  14.819  17.130
    3    HA2  GLY  32           HA3      GLY  32  20.847  14.813  18.722

  No H/Q in entry =           3
  In of MODEL   57
    1    H    ASP  33           H        ASP  33  21.239  11.916  16.946
    2    HA   ASP  33           HA       ASP  33  24.075  12.554  16.492
    3    HB2  ASP  33           HB2      ASP  33  22.532   9.958  16.601
    4    HB3  ASP  33           HB3      ASP  33  24.222  10.053  16.114

  No H/Q in entry =           4
  In of MODEL   57
    1    H    PHE  34           H        PHE  34  23.620  13.884  14.609
    2    HA   PHE  34           HA       PHE  34  22.268  12.919  12.316
    3    HB2  PHE  34           HB2      PHE  34  24.426  15.025  12.556
    4    HB3  PHE  34           HB3      PHE  34  23.443  14.748  11.120
    5    HD1  PHE  34           HD1      PHE  34  23.706  16.677  14.035
    6    HD2  PHE  34           HD2      PHE  34  20.812  14.600  11.636
    7    HE1  PHE  34           HE1      PHE  34  21.904  18.098  14.975
    8    HE2  PHE  34           HE2      PHE  34  19.014  16.021  12.578
    9    HZ   PHE  34           HZ       PHE  34  19.563  17.770  14.243

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ALA  35           H        ALA  35  25.635  12.687  13.339
    2    HA   ALA  35           HA       ALA  35  26.741  11.853  10.887
    3    HB3  ALA  35           HB1      ALA  35  28.399  10.661  12.613
    4    HB2  ALA  35           HB2      ALA  35  27.543  11.697  13.755
    5    HB1  ALA  35           HB3      ALA  35  28.395  12.410  12.387

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ALA  36           H        ALA  36  25.588   9.910  13.646
    2    HA   ALA  36           HA       ALA  36  26.047   7.417  12.372
    3    HB2  ALA  36           HB1      ALA  36  25.597   6.676  14.445
    4    HB3  ALA  36           HB2      ALA  36  23.916   7.192  14.288
    5    HB1  ALA  36           HB3      ALA  36  25.129   8.308  14.916

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ALA  37           H        ALA  37  23.251   9.578  12.494
    2    HA   ALA  37           HA       ALA  37  21.379   7.832  11.309
    3    HB3  ALA  37           HB1      ALA  37  21.639  10.792  11.603
    4    HB1  ALA  37           HB2      ALA  37  20.312   9.729  12.069
    5    HB2  ALA  37           HB3      ALA  37  20.514  10.199  10.381

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LYS  38           H        LYS  38  23.514  10.268   9.840
    2    HA   LYS  38           HA       LYS  38  22.882   9.848   7.160
    3    HB2  LYS  38           HB2      LYS  38  24.704  11.383   8.614
    4    HB3  LYS  38           HB3      LYS  38  25.729  10.382   7.593
    5    HG2  LYS  38           HG2      LYS  38  24.583  11.167   5.591
    6    HG3  LYS  38           HG3      LYS  38  23.394  12.035   6.567
    7    HD2  LYS  38           HD2      LYS  38  25.005  13.615   7.327
    8    HD3  LYS  38           HD3      LYS  38  26.355  12.613   6.798
    9    HE2  LYS  38           HE2      LYS  38  26.028  14.489   5.245
   10    HE3  LYS  38           HE3      LYS  38  25.678  12.955   4.439
   11    HZ3  LYS  38           HZ1      LYS  38  23.488  13.426   4.299
   12    HZ2  LYS  38           HZ2      LYS  38  24.028  15.034   4.389
   13    HZ1  LYS  38           HZ3      LYS  38  23.439  14.257   5.779

  No H/Q in entry =          13
  In of MODEL   57
    1    H    ALA  39           H        ALA  39  25.368   8.221   9.127
    2    HA   ALA  39           HA       ALA  39  26.429   6.621   7.062
    3    HB2  ALA  39           HB1      ALA  39  26.316   5.658   9.905
    4    HB1  ALA  39           HB2      ALA  39  27.287   7.072   9.493
    5    HB3  ALA  39           HB3      ALA  39  27.624   5.518   8.731

  No H/Q in entry =           5
  In of MODEL   57
    1    H    MET  40           H        MET  40  23.798   6.034   9.348
    2    HA   MET  40           HA       MET  40  23.328   3.334   8.611
    3    HB2  MET  40           HB2      MET  40  21.529   5.398   9.896
    4    HB3  MET  40           HB3      MET  40  21.104   3.694   9.718
    5    HG2  MET  40           HG2      MET  40  23.658   4.606  11.071
    6    HG3  MET  40           HG3      MET  40  22.156   4.347  11.957
    7    HE3  MET  40           HE1      MET  40  21.552   0.719  12.129
    8    HE2  MET  40           HE2      MET  40  20.701   2.032  11.318
    9    HE1  MET  40           HE3      MET  40  21.438   2.311  12.895

  No H/Q in entry =           9
  In of MODEL   57
    1    H    MET  41           H        MET  41  21.954   6.403   7.418
    2    HA   MET  41           HA       MET  41  19.991   5.231   5.737
    3    HB2  MET  41           HB2      MET  41  21.503   7.805   5.231
    4    HB3  MET  41           HB3      MET  41  19.973   7.328   4.506
    5    HG2  MET  41           HG2      MET  41  19.213   7.147   7.054
    6    HG3  MET  41           HG3      MET  41  20.534   8.290   7.282
    7    HE2  MET  41           HE1      MET  41  20.000   9.585   3.943
    8    HE1  MET  41           HE2      MET  41  20.955  10.014   5.359
    9    HE3  MET  41           HE3      MET  41  19.697  11.107   4.790

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ASP  42           H        ASP  42  23.376   6.117   5.199
    2    HA   ASP  42           HA       ASP  42  23.475   5.643   2.442
    3    HB2  ASP  42           HB2      ASP  42  25.229   6.621   4.219
    4    HB3  ASP  42           HB3      ASP  42  25.869   4.988   4.094

  No H/Q in entry =           4
  In of MODEL   57
    1    H    GLN  43           H        GLN  43  24.164   3.480   5.165
    2    HA   GLN  43           HA       GLN  43  24.810   1.215   3.584
    3    HB2  GLN  43           HB2      GLN  43  23.777   1.409   6.423
    4    HB3  GLN  43           HB3      GLN  43  24.343  -0.086   5.670
    5    HG2  GLN  43           HG2      GLN  43  26.522   1.102   5.169
    6    HG3  GLN  43           HG3      GLN  43  25.949   2.435   6.167
    7   HE21  GLN  43          HE21      GLN  43  28.167   1.437   7.213
    8   HE22  GLN  43          HE22      GLN  43  27.875   0.357   8.488

  No H/Q in entry =           8
  In of MODEL   57
    1    H    SER  44           H        SER  44  21.761   2.382   4.956
    2    HA   SER  44           HA       SER  44  20.171   0.155   4.276
    3    HB2  SER  44           HB2      SER  44  19.752   2.689   5.421
    4    HB3  SER  44           HB3      SER  44  18.723   2.657   3.991
    5    HG   SER  44           HG       SER  44  17.612   1.725   5.709

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ARG  45           H        ARG  45  20.954   3.113   2.475
    2    HA   ARG  45           HA       ARG  45  19.434   2.644   0.164
    3    HB2  ARG  45           HB2      ARG  45  20.598   4.767   0.754
    4    HB3  ARG  45           HB3      ARG  45  22.136   3.996   0.375
    5    HG2  ARG  45           HG2      ARG  45  21.358   3.600  -1.943
    6    HG3  ARG  45           HG3      ARG  45  19.833   4.394  -1.563
    7    HD2  ARG  45           HD2      ARG  45  21.103   6.477  -0.973
    8    HD3  ARG  45           HD3      ARG  45  22.594   5.687  -1.535
    9    HE   ARG  45           HE       ARG  45  20.669   5.471  -3.579
   10   HH21  ARG  45          HH11      ARG  45  20.685   6.840  -5.342
   11   HH22  ARG  45          HH12      ARG  45  21.459   8.382  -5.234
   12   HH11  ARG  45          HH21      ARG  45  22.420   7.949  -1.944
   13   HH12  ARG  45          HH22      ARG  45  22.440   9.009  -3.307

  No H/Q in entry =          13
  In of MODEL   57
    1    H    MET  46           H        MET  46  22.784   1.732   0.925
    2    HA   MET  46           HA       MET  46  23.387   0.533  -1.557
    3    HB2  MET  46           HB2      MET  46  24.478   0.194   1.237
    4    HB3  MET  46           HB3      MET  46  25.130  -0.707  -0.136
    5    HG2  MET  46           HG2      MET  46  25.610   1.389  -1.318
    6    HG3  MET  46           HG3      MET  46  24.900   2.315  -0.002
    7    HE1  MET  46           HE1      MET  46  27.236  -0.220  -1.126
    8    HE3  MET  46           HE2      MET  46  27.671  -0.893   0.442
    9    HE2  MET  46           HE3      MET  46  28.806   0.158  -0.402

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ALA  47           H        ALA  47  21.977  -0.785   1.413
    2    HA   ALA  47           HA       ALA  47  21.895  -3.497   0.610
    3    HB2  ALA  47           HB1      ALA  47  21.512  -3.032   2.913
    4    HB3  ALA  47           HB2      ALA  47  19.971  -3.617   2.288
    5    HB1  ALA  47           HB3      ALA  47  20.220  -1.889   2.547

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LEU  48           H        LEU  48  19.575  -0.842   0.244
    2    HA   LEU  48           HA       LEU  48  17.516  -2.351  -1.014
    3    HB2  LEU  48           HB2      LEU  48  18.206   0.595  -1.126
    4    HB3  LEU  48           HB3      LEU  48  16.730  -0.098  -1.798
    5    HG   LEU  48           HG       LEU  48  17.569  -0.410   1.093
    6   HD13  LEU  48          HD11      LEU  48  17.179   1.896   0.905
    7   HD12  LEU  48          HD12      LEU  48  15.611   1.267   1.409
    8   HD11  LEU  48          HD13      LEU  48  15.894   1.686  -0.281
    9   HD22  LEU  48          HD21      LEU  48  16.021  -2.106   0.707
   10   HD21  LEU  48          HD22      LEU  48  15.162  -1.192  -0.534
   11   HD23  LEU  48          HD23      LEU  48  14.949  -0.785   1.168

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ASN  49           H        ASN  49  20.232  -0.456  -2.235
    2    HA   ASN  49           HA       ASN  49  19.589  -0.532  -4.961
    3    HB2  ASN  49           HB2      ASN  49  21.280   0.969  -4.056
    4    HB3  ASN  49           HB3      ASN  49  22.284  -0.394  -3.580
    5   HD21  ASN  49          HD21      ASN  49  20.877   1.169  -6.476
    6   HD22  ASN  49          HD22      ASN  49  22.109   0.673  -7.531

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLU  50           H        GLU  50  21.540  -2.750  -2.992
    2    HA   GLU  50           HA       GLU  50  22.226  -4.515  -5.116
    3    HB2  GLU  50           HB2      GLU  50  23.417  -4.504  -2.945
    4    HB3  GLU  50           HB3      GLU  50  21.964  -5.114  -2.154
    5    HG2  GLU  50           HG2      GLU  50  22.033  -7.148  -3.512
    6    HG3  GLU  50           HG3      GLU  50  23.420  -6.533  -4.409

  No H/Q in entry =           6
  In of MODEL   57
    1    H    ALA  51           H        ALA  51  19.564  -4.416  -2.798
    2    HA   ALA  51           HA       ALA  51  18.369  -6.875  -3.558
    3    HB3  ALA  51           HB1      ALA  51  16.778  -6.349  -2.008
    4    HB1  ALA  51           HB2      ALA  51  16.588  -4.700  -2.608
    5    HB2  ALA  51           HB3      ALA  51  17.938  -5.103  -1.548

  No H/Q in entry =           5
  In of MODEL   57
    1    H    HIS  52           H        HIS  52  17.828  -3.520  -4.596
    2    HA   HIS  52           HA       HIS  52  15.714  -4.021  -6.402
    3    HB2  HIS  52           HB2      HIS  52  16.392  -1.764  -5.598
    4    HB3  HIS  52           HB3      HIS  52  17.846  -1.878  -6.591
    5    HD1  HIS  52           HD1      HIS  52  17.530  -1.837  -9.191
    6    HD2  HIS  52           HD2      HIS  52  14.008  -1.254  -7.039
    7    HE1  HIS  52           HE1      HIS  52  15.813  -0.982 -10.845
    8    HE2  HIS  52           HE2      HIS  52  13.660  -0.621  -9.548

  No H/Q in entry =           8
  In of MODEL   57
    1    H    LEU  53           H        LEU  53  19.234  -4.070  -6.824
    2    HA   LEU  53           HA       LEU  53  19.296  -4.388  -9.624
    3    HB2  LEU  53           HB2      LEU  53  21.212  -5.169  -7.443
    4    HB3  LEU  53           HB3      LEU  53  21.529  -5.566  -9.130
    5    HG   LEU  53           HG       LEU  53  20.883  -2.743  -8.223
    6   HD13  LEU  53          HD11      LEU  53  22.891  -3.345  -7.041
    7   HD12  LEU  53          HD12      LEU  53  23.385  -2.393  -8.441
    8   HD11  LEU  53          HD13      LEU  53  23.555  -4.144  -8.463
    9   HD23  LEU  53          HD21      LEU  53  22.328  -2.323 -10.363
   10   HD22  LEU  53          HD22      LEU  53  20.655  -2.833 -10.566
   11   HD21  LEU  53          HD23      LEU  53  21.954  -3.995 -10.762

  No H/Q in entry =          11
  In of MODEL   57
    1    H    VAL  54           H        VAL  54  19.146  -6.771  -6.998
    2    HA   VAL  54           HA       VAL  54  19.247  -9.068  -8.656
    3    HB   VAL  54           HB       VAL  54  18.089  -8.629  -5.892
    4   HG12  VAL  54          HG11      VAL  54  18.382 -11.251  -5.886
    5   HG11  VAL  54          HG12      VAL  54  18.204 -11.081  -7.632
    6   HG13  VAL  54          HG13      VAL  54  16.919 -10.534  -6.557
    7   HG22  VAL  54          HG21      VAL  54  20.406  -8.446  -5.662
    8   HG21  VAL  54          HG22      VAL  54  20.735  -9.543  -7.002
    9   HG23  VAL  54          HG23      VAL  54  20.192 -10.182  -5.451

  No H/Q in entry =           9
  In of MODEL   57
    1    H    GLN  55           H        GLN  55  16.537  -7.132  -7.382
    2    HA   GLN  55           HA       GLN  55  14.500  -8.773  -8.462
    3    HB2  GLN  55           HB2      GLN  55  13.765  -7.238  -6.838
    4    HB3  GLN  55           HB3      GLN  55  14.576  -5.879  -7.612
    5    HG2  GLN  55           HG2      GLN  55  12.860  -5.536  -9.108
    6    HG3  GLN  55           HG3      GLN  55  12.519  -7.253  -9.278
    7   HE21  GLN  55          HE21      GLN  55  10.503  -7.778  -8.478
    8   HE22  GLN  55          HE22      GLN  55   9.734  -7.014  -7.173

  No H/Q in entry =           8
  In of MODEL   57
    1    H    THR  56           H        THR  56  16.276  -5.994  -9.817
    2    HA   THR  56           HA       THR  56  14.849  -5.617 -12.170
    3    HB   THR  56           HB       THR  56  17.869  -5.563 -11.995
    4    HG1  THR  56           HG1      THR  56  17.582  -4.056 -10.586
    5   HG23  THR  56          HG21      THR  56  17.744  -3.984 -13.771
    6   HG22  THR  56          HG22      THR  56  16.004  -3.782 -13.566
    7   HG21  THR  56          HG23      THR  56  16.646  -5.288 -14.227

  No H/Q in entry =           7
  In of MODEL   57
    1    H    LYS  57           H        LYS  57  17.471  -7.944 -11.549
    2    HA   LYS  57           HA       LYS  57  17.466  -9.141 -14.127
    3    HB2  LYS  57           HB2      LYS  57  19.252  -9.416 -12.389
    4    HB3  LYS  57           HB3      LYS  57  18.135 -10.381 -11.437
    5    HG2  LYS  57           HG2      LYS  57  17.994 -12.042 -13.231
    6    HG3  LYS  57           HG3      LYS  57  19.059 -11.072 -14.241
    7    HD2  LYS  57           HD2      LYS  57  20.868 -11.320 -12.573
    8    HD3  LYS  57           HD3      LYS  57  19.808 -12.311 -11.571
    9    HE2  LYS  57           HE2      LYS  57  19.615 -13.963 -13.409
   10    HE3  LYS  57           HE3      LYS  57  20.691 -12.986 -14.407
   11    HZ3  LYS  57           HZ1      LYS  57  22.055 -14.579 -13.434
   12    HZ2  LYS  57           HZ2      LYS  57  21.317 -14.435 -11.913
   13    HZ1  LYS  57           HZ3      LYS  57  22.316 -13.193 -12.495

  No H/Q in entry =          13
  In of MODEL   57
    1    H    LEU  58           H        LEU  58  15.669  -9.786 -11.156
    2    HA   LEU  58           HA       LEU  58  14.424 -12.147 -12.093
    3    HB2  LEU  58           HB2      LEU  58  13.644 -10.231  -9.901
    4    HB3  LEU  58           HB3      LEU  58  12.821 -11.760 -10.218
    5    HG   LEU  58           HG       LEU  58  15.795 -11.514  -9.655
    6   HD11  LEU  58          HD11      LEU  58  13.415 -11.904  -7.869
    7   HD13  LEU  58          HD12      LEU  58  14.878 -10.956  -7.603
    8   HD12  LEU  58          HD13      LEU  58  14.931 -12.713  -7.466
    9   HD22  LEU  58          HD21      LEU  58  15.658 -13.575 -10.681
   10   HD21  LEU  58          HD22      LEU  58  13.941 -13.765 -10.326
   11   HD23  LEU  58          HD23      LEU  58  15.143 -14.078  -9.073

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  59           H        ILE  59  13.791  -8.803 -12.780
    2    HA   ILE  59           HA       ILE  59  11.072  -9.423 -13.727
    3    HB   ILE  59           HB       ILE  59  11.898  -7.149 -12.521
    4   HG12  ILE  59          HG12      ILE  59  10.000  -7.006 -14.875
    5   HG13  ILE  59          HG13      ILE  59   9.569  -7.772 -13.368
    6   HG22  ILE  59          HG21      ILE  59  11.992  -6.328 -15.410
    7   HG21  ILE  59          HG22      ILE  59  13.463  -6.782 -14.579
    8   HG23  ILE  59          HG23      ILE  59  12.501  -5.422 -14.006
    9   HD11  ILE  59          HD11      ILE  59  10.114  -5.662 -12.159
   10   HD13  ILE  59          HD12      ILE  59   8.799  -5.463 -13.317
   11   HD12  ILE  59          HD13      ILE  59  10.421  -4.896 -13.719

  No H/Q in entry =          11
  In of MODEL   57
    1    H    GLU  60           H        GLU  60  14.288  -8.607 -14.977
    2    HA   GLU  60           HA       GLU  60  13.521  -8.201 -17.688
    3    HB2  GLU  60           HB2      GLU  60  15.703  -7.486 -16.840
    4    HB3  GLU  60           HB3      GLU  60  16.147  -9.160 -16.519
    5    HG2  GLU  60           HG2      GLU  60  15.971  -9.680 -18.924
    6    HG3  GLU  60           HG3      GLU  60  15.509  -8.012 -19.253

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLY  61           H        GLY  61  14.461 -11.091 -15.867
    2    HA3  GLY  61           HA2      GLY  61  13.909 -12.735 -18.269
    3    HA2  GLY  61           HA3      GLY  61  14.932 -13.226 -16.923

  No H/Q in entry =           3
  In of MODEL   57
    1    H    ASP  62           H        ASP  62  11.827 -11.646 -16.564
    2    HA   ASP  62           HA       ASP  62  10.866 -13.539 -14.714
    3    HB2  ASP  62           HB2      ASP  62   8.717 -12.331 -14.969
    4    HB3  ASP  62           HB3      ASP  62  10.081 -11.250 -14.706

  No H/Q in entry =           4
  In of MODEL   57
    1    H    ALA  63           H        ALA  63  10.370 -13.272 -18.233
    2    HA   ALA  63           HA       ALA  63   8.504 -15.561 -18.184
    3    HB3  ALA  63           HB1      ALA  63   8.004 -13.551 -19.591
    4    HB1  ALA  63           HB2      ALA  63   8.104 -15.046 -20.520
    5    HB2  ALA  63           HB3      ALA  63   9.448 -13.904 -20.540

  No H/Q in entry =           5
  In of MODEL   57
    1    H    GLY  64           H        GLY  64   8.894 -17.151 -20.046
    2    HA3  GLY  64           HA2      GLY  64  10.680 -18.161 -21.460
    3    HA2  GLY  64           HA3      GLY  64  11.753 -17.906 -20.089

  No H/Q in entry =           3
  In of MODEL   57
    1    H    GLU  65           H        GLU  65   9.483 -18.693 -18.228
    2    HA   GLU  65           HA       GLU  65  10.206 -21.422 -18.003
    3    HB2  GLU  65           HB2      GLU  65   7.966 -19.885 -16.687
    4    HB3  GLU  65           HB3      GLU  65   8.477 -21.509 -16.230
    5    HG2  GLU  65           HG2      GLU  65  10.332 -19.119 -16.285
    6    HG3  GLU  65           HG3      GLU  65   9.509 -19.684 -14.832

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLY  66           H        GLY  66   7.402 -19.824 -19.299
    2    HA3  GLY  66           HA2      GLY  66   6.692 -21.973 -21.009
    3    HA2  GLY  66           HA3      GLY  66   5.597 -21.886 -19.646

  No H/Q in entry =           3
  In of MODEL   57
    1    H    LYS  67           H        LYS  67   4.201 -20.140 -19.444
    2    HA   LYS  67           HA       LYS  67   3.443 -18.942 -21.960
    3    HB2  LYS  67           HB2      LYS  67   2.153 -18.977 -19.235
    4    HB3  LYS  67           HB3      LYS  67   1.445 -18.190 -20.651
    5    HG2  LYS  67           HG2      LYS  67   1.512 -20.311 -21.890
    6    HG3  LYS  67           HG3      LYS  67   2.267 -21.108 -20.513
    7    HD2  LYS  67           HD2      LYS  67   0.267 -20.648 -19.145
    8    HD3  LYS  67           HD3      LYS  67  -0.491 -19.850 -20.525
    9    HE2  LYS  67           HE2      LYS  67  -0.340 -21.947 -21.822
   10    HE3  LYS  67           HE3      LYS  67   0.403 -22.747 -20.438
   11    HZ3  LYS  67           HZ1      LYS  67  -1.548 -22.580 -19.201
   12    HZ2  LYS  67           HZ2      LYS  67  -2.084 -23.025 -20.749
   13    HZ1  LYS  67           HZ3      LYS  67  -2.225 -21.413 -20.229

  No H/Q in entry =          13
  In of MODEL   57
    1    H    MET  68           H        MET  68   2.934 -16.795 -22.307
    2    HA   MET  68           HA       MET  68   4.858 -14.924 -21.976
    3    HB2  MET  68           HB2      MET  68   1.892 -14.379 -22.148
    4    HB3  MET  68           HB3      MET  68   3.178 -13.243 -22.555
    5    HG2  MET  68           HG2      MET  68   3.952 -15.340 -24.068
    6    HG3  MET  68           HG3      MET  68   2.211 -15.621 -24.051
    7    HE1  MET  68           HE1      MET  68   0.838 -13.415 -23.719
    8    HE3  MET  68           HE2      MET  68   0.762 -12.242 -25.030
    9    HE2  MET  68           HE3      MET  68   1.816 -11.942 -23.652

  No H/Q in entry =           9
  In of MODEL   57
    1    H    LYS  69           H        LYS  69   3.069 -16.046 -19.352
    2    HA   LYS  69           HA       LYS  69   2.781 -13.601 -17.905
    3    HB2  LYS  69           HB2      LYS  69   2.581 -16.490 -17.068
    4    HB3  LYS  69           HB3      LYS  69   2.276 -15.141 -15.971
    5    HG2  LYS  69           HG2      LYS  69   0.559 -14.268 -17.511
    6    HG3  LYS  69           HG3      LYS  69   0.860 -15.613 -18.611
    7    HD2  LYS  69           HD2      LYS  69   0.178 -17.205 -16.854
    8    HD3  LYS  69           HD3      LYS  69  -0.129 -15.859 -15.754
    9    HE2  LYS  69           HE2      LYS  69  -1.819 -14.965 -17.314
   10    HE3  LYS  69           HE3      LYS  69  -1.515 -16.308 -18.414
   11    HZ1  LYS  69           HZ1      LYS  69  -1.981 -17.614 -16.146
   12    HZ3  LYS  69           HZ2      LYS  69  -3.190 -17.246 -17.280
   13    HZ2  LYS  69           HZ3      LYS  69  -2.977 -16.263 -15.910

  No H/Q in entry =          13
  In of MODEL   57
    1    H    VAL  70           H        VAL  70   3.583 -13.990 -15.337
    2    HA   VAL  70           HA       VAL  70   6.529 -14.271 -15.419
    3    HB   VAL  70           HB       VAL  70   6.677 -12.270 -13.946
    4   HG12  VAL  70          HG11      VAL  70   5.224 -11.674 -16.538
    5   HG11  VAL  70          HG12      VAL  70   6.918 -12.160 -16.458
    6   HG13  VAL  70          HG13      VAL  70   6.399 -10.646 -15.719
    7   HG21  VAL  70          HG21      VAL  70   3.691 -12.295 -14.399
    8   HG23  VAL  70          HG22      VAL  70   4.528 -10.772 -14.099
    9   HG22  VAL  70          HG23      VAL  70   4.574 -12.056 -12.892

  No H/Q in entry =           9
  In of MODEL   57
    1    H    SER  71           H        SER  71   7.458 -14.499 -13.228
    2    HA   SER  71           HA       SER  71   6.211 -16.524 -11.700
    3    HB2  SER  71           HB2      SER  71   8.661 -16.129 -11.734
    4    HB3  SER  71           HB3      SER  71   8.413 -14.619 -10.861
    5    HG   SER  71           HG       SER  71   7.234 -16.053  -9.308

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LEU  72           H        LEU  72   4.872 -16.440  -9.957
    2    HA   LEU  72           HA       LEU  72   3.346 -14.110  -9.519
    3    HB2  LEU  72           HB2      LEU  72   3.600 -16.670  -7.949
    4    HB3  LEU  72           HB3      LEU  72   2.446 -15.400  -7.550
    5    HG   LEU  72           HG       LEU  72   2.594 -16.686 -10.295
    6   HD11  LEU  72          HD11      LEU  72   1.037 -17.444  -7.824
    7   HD13  LEU  72          HD12      LEU  72   1.981 -18.485  -8.887
    8   HD12  LEU  72          HD13      LEU  72   0.439 -17.831  -9.438
    9   HD22  LEU  72          HD21      LEU  72   1.387 -14.679 -10.517
   10   HD21  LEU  72          HD22      LEU  72   0.693 -14.790  -8.908
   11   HD23  LEU  72          HD23      LEU  72   0.111 -15.846 -10.191

  No H/Q in entry =          11
  In of MODEL   57
    1    H    VAL  73           H        VAL  73   5.980 -15.575  -7.736
    2    HA   VAL  73           HA       VAL  73   5.928 -14.041  -5.405
    3    HB   VAL  73           HB       VAL  73   8.061 -14.908  -4.943
    4   HG11  VAL  73          HG11      VAL  73   6.208 -16.600  -5.301
    5   HG13  VAL  73          HG12      VAL  73   7.840 -17.244  -5.471
    6   HG12  VAL  73          HG13      VAL  73   6.879 -16.886  -6.905
    7   HG22  VAL  73          HG21      VAL  73   9.333 -14.134  -6.814
    8   HG21  VAL  73          HG22      VAL  73   8.361 -15.069  -7.949
    9   HG23  VAL  73          HG23      VAL  73   9.459 -15.894  -6.842

  No H/Q in entry =           9
  In of MODEL   57
    1    H    LEU  74           H        LEU  74   6.940 -13.158  -8.577
    2    HA   LEU  74           HA       LEU  74   8.904 -11.231  -8.077
    3    HB2  LEU  74           HB2      LEU  74   8.456 -11.970 -10.317
    4    HB3  LEU  74           HB3      LEU  74   6.791 -11.397 -10.223
    5    HG   LEU  74           HG       LEU  74   7.606  -9.073 -10.002
    6   HD12  LEU  74          HD11      LEU  74  10.105  -8.783 -10.591
    7   HD11  LEU  74          HD12      LEU  74  10.281 -10.471 -10.116
    8   HD13  LEU  74          HD13      LEU  74   9.721  -9.280  -8.943
    9   HD21  LEU  74          HD21      LEU  74   7.341 -10.485 -12.223
   10   HD23  LEU  74          HD22      LEU  74   9.062 -10.191 -12.318
   11   HD22  LEU  74          HD23      LEU  74   7.959  -8.835 -12.262

  No H/Q in entry =          11
  In of MODEL   57
    1    H    VAL  75           H        VAL  75   5.415 -10.808  -8.445
    2    HA   VAL  75           HA       VAL  75   5.346  -8.051  -7.859
    3    HB   VAL  75           HB       VAL  75   3.231 -10.170  -7.478
    4   HG12  VAL  75          HG11      VAL  75   1.670  -8.197  -7.388
    5   HG11  VAL  75          HG12      VAL  75   3.073  -7.138  -7.339
    6   HG13  VAL  75          HG13      VAL  75   2.770  -8.249  -6.013
    7   HG23  VAL  75          HG21      VAL  75   3.498  -8.006  -9.583
    8   HG22  VAL  75          HG22      VAL  75   2.412  -9.394  -9.599
    9   HG21  VAL  75          HG23      VAL  75   4.148  -9.629  -9.808

  No H/Q in entry =           9
  In of MODEL   57
    1    H    GLU  76           H        GLU  76   5.052 -10.924  -5.750
    2    HA   GLU  76           HA       GLU  76   4.586  -9.557  -3.331
    3    HB2  GLU  76           HB2      GLU  76   4.382 -12.019  -3.557
    4    HB3  GLU  76           HB3      GLU  76   6.115 -12.142  -3.803
    5    HG2  GLU  76           HG2      GLU  76   5.670 -12.717  -1.503
    6    HG3  GLU  76           HG3      GLU  76   6.444 -11.143  -1.497

  No H/Q in entry =           6
  In of MODEL   57
    1    H    ALA  77           H        ALA  77   7.643 -10.499  -4.880
    2    HA   ALA  77           HA       ALA  77   9.334  -9.474  -2.857
    3    HB2  ALA  77           HB1      ALA  77  11.112  -9.762  -4.397
    4    HB3  ALA  77           HB2      ALA  77  10.043  -9.578  -5.787
    5    HB1  ALA  77           HB3      ALA  77   9.953 -11.030  -4.791

  No H/Q in entry =           5
  In of MODEL   57
    1    H    GLN  78           H        GLN  78   7.972  -8.042  -5.777
    2    HA   GLN  78           HA       GLN  78   9.352  -5.578  -5.667
    3    HB2  GLN  78           HB2      GLN  78   8.056  -6.476  -7.632
    4    HB3  GLN  78           HB3      GLN  78   6.573  -6.086  -6.763
    5    HG2  GLN  78           HG2      GLN  78   7.246  -3.721  -6.663
    6    HG3  GLN  78           HG3      GLN  78   8.734  -4.103  -7.528
    7   HE21  GLN  78          HE21      GLN  78   6.865  -2.259  -8.643
    8   HE22  GLN  78          HE22      GLN  78   6.161  -2.966 -10.017

  No H/Q in entry =           8
  In of MODEL   57
    1    H    LEU  79           H        LEU  79   6.313  -6.680  -4.252
    2    HA   LEU  79           HA       LEU  79   5.342  -4.261  -3.248
    3    HB2  LEU  79           HB2      LEU  79   4.003  -6.297  -3.198
    4    HB3  LEU  79           HB3      LEU  79   5.134  -7.050  -2.077
    5    HG   LEU  79           HG       LEU  79   4.592  -5.401  -0.353
    6   HD13  LEU  79          HD11      LEU  79   4.156  -3.381  -1.407
    7   HD12  LEU  79          HD12      LEU  79   2.522  -3.888  -0.976
    8   HD11  LEU  79          HD13      LEU  79   3.108  -4.117  -2.621
    9   HD23  LEU  79          HD21      LEU  79   2.000  -5.863  -0.277
   10   HD22  LEU  79          HD22      LEU  79   3.123  -7.215  -0.162
   11   HD21  LEU  79          HD23      LEU  79   2.321  -6.869  -1.691

  No H/Q in entry =          11
  In of MODEL   57
    1    H    HIS  80           H        HIS  80   7.489  -6.622  -1.653
    2    HA   HIS  80           HA       HIS  80   7.782  -5.083   0.717
    3    HB2  HIS  80           HB2      HIS  80   9.099  -7.463  -0.474
    4    HB3  HIS  80           HB3      HIS  80  10.014  -6.576   0.747
    5    HD1  HIS  80           HD1      HIS  80   9.503  -7.206   3.088
    6    HD2  HIS  80           HD2      HIS  80   6.290  -8.018   0.558
    7    HE1  HIS  80           HE1      HIS  80   7.710  -8.287   4.527
    8    HE2  HIS  80           HE2      HIS  80   5.745  -8.787   2.993

  No H/Q in entry =           8
  In of MODEL   57
    1    H    LEU  81           H        LEU  81   9.800  -5.384  -2.184
    2    HA   LEU  81           HA       LEU  81  11.861  -3.667  -1.295
    3    HB2  LEU  81           HB2      LEU  81  10.945  -4.450  -4.063
    4    HB3  LEU  81           HB3      LEU  81  12.376  -3.461  -3.765
    5    HG   LEU  81           HG       LEU  81  11.943  -6.176  -2.493
    6   HD12  LEU  81          HD11      LEU  81  13.760  -6.826  -4.232
    7   HD11  LEU  81          HD12      LEU  81  13.217  -5.395  -5.108
    8   HD13  LEU  81          HD13      LEU  81  12.088  -6.705  -4.775
    9   HD23  LEU  81          HD21      LEU  81  14.575  -5.894  -2.464
   10   HD22  LEU  81          HD22      LEU  81  13.595  -5.121  -1.220
   11   HD21  LEU  81          HD23      LEU  81  14.193  -4.177  -2.584

  No H/Q in entry =          11
  In of MODEL   57
    1    H    MET  82           H        MET  82   8.957  -2.995  -3.248
    2    HA   MET  82           HA       MET  82   9.534  -0.276  -3.747
    3    HB2  MET  82           HB2      MET  82   6.954  -1.838  -3.636
    4    HB3  MET  82           HB3      MET  82   6.977  -0.113  -4.000
    5    HG2  MET  82           HG2      MET  82   8.560  -2.208  -5.526
    6    HG3  MET  82           HG3      MET  82   7.004  -1.565  -6.048
    7    HE3  MET  82           HE1      MET  82   7.503   1.883  -7.218
    8    HE2  MET  82           HE2      MET  82   7.116   1.662  -5.513
    9    HE1  MET  82           HE3      MET  82   6.443   0.561  -6.711

  No H/Q in entry =           9
  In of MODEL   57
    1    H    THR  83           H        THR  83   7.707  -1.851  -1.151
    2    HA   THR  83           HA       THR  83   6.879   0.508   0.170
    3    HB   THR  83           HB       THR  83   6.712  -1.064   2.187
    4    HG1  THR  83           HG1      THR  83   7.446  -3.023   1.962
    5   HG22  THR  83          HG21      THR  83   5.048  -2.608   0.710
    6   HG21  THR  83          HG22      THR  83   5.298  -1.283  -0.421
    7   HG23  THR  83          HG23      THR  83   4.652  -0.959   1.188

  No H/Q in entry =           7
  In of MODEL   57
    1    H    SER  84           H        SER  84   9.672  -1.626   0.707
    2    HA   SER  84           HA       SER  84  10.737  -0.209   2.901
    3    HB2  SER  84           HB2      SER  84  11.978  -2.068   0.884
    4    HB3  SER  84           HB3      SER  84  12.927  -1.327   2.170
    5    HG   SER  84           HG       SER  84  10.629  -2.987   2.417

  No H/Q in entry =           5
  In of MODEL   57
    1    H    MET  85           H        MET  85  11.514   0.041  -0.583
    2    HA   MET  85           HA       MET  85  13.537   1.980  -0.321
    3    HB2  MET  85           HB2      MET  85  13.130   0.700  -2.388
    4    HB3  MET  85           HB3      MET  85  11.622   1.583  -2.627
    5    HG2  MET  85           HG2      MET  85  12.852   3.701  -2.761
    6    HG3  MET  85           HG3      MET  85  14.366   2.857  -2.454
    7    HE3  MET  85           HE1      MET  85  11.316   1.618  -4.987
    8    HE2  MET  85           HE2      MET  85  11.726   2.874  -6.151
    9    HE1  MET  85           HE3      MET  85  11.342   3.318  -4.493

  No H/Q in entry =           9
  In of MODEL   57
    1    H    LEU  86           H        LEU  86  10.055   2.361  -0.849
    2    HA   LEU  86           HA       LEU  86  10.030   5.175  -1.032
    3    HB2  LEU  86           HB2      LEU  86   8.167   3.540  -1.618
    4    HB3  LEU  86           HB3      LEU  86   7.826   3.455   0.110
    5    HG   LEU  86           HG       LEU  86   7.700   6.018   0.056
    6   HD11  LEU  86          HD11      LEU  86   8.485   5.571  -2.641
    7   HD13  LEU  86          HD12      LEU  86   8.066   7.104  -1.884
    8   HD12  LEU  86          HD13      LEU  86   6.821   6.158  -2.696
    9   HD23  LEU  86          HD21      LEU  86   5.558   4.694  -1.619
   10   HD22  LEU  86          HD22      LEU  86   5.378   5.957  -0.404
   11   HD21  LEU  86          HD23      LEU  86   5.752   4.307   0.092

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ALA  87           H        ALA  87   9.518   3.004   1.712
    2    HA   ALA  87           HA       ALA  87   8.985   4.925   3.677
    3    HB1  ALA  87           HB1      ALA  87   9.754   2.094   3.596
    4    HB3  ALA  87           HB2      ALA  87   8.634   2.922   4.675
    5    HB2  ALA  87           HB3      ALA  87  10.361   2.930   5.029

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ARG  88           H        ARG  88  12.054   3.458   2.714
    2    HA   ARG  88           HA       ARG  88  13.672   4.814   4.556
    3    HB2  ARG  88           HB2      ARG  88  14.321   2.831   3.156
    4    HB3  ARG  88           HB3      ARG  88  14.496   3.922   1.784
    5    HG2  ARG  88           HG2      ARG  88  15.977   5.216   3.738
    6    HG3  ARG  88           HG3      ARG  88  16.272   3.522   4.119
    7    HD2  ARG  88           HD2      ARG  88  17.545   3.208   2.280
    8    HD3  ARG  88           HD3      ARG  88  16.426   4.095   1.240
    9    HE   ARG  88           HE       ARG  88  18.829   5.125   2.300
   10   HH21  ARG  88          HH11      ARG  88  19.206   7.339   2.107
   11   HH22  ARG  88          HH12      ARG  88  17.871   8.429   1.957
   12   HH11  ARG  88          HH21      ARG  88  15.502   5.924   2.004
   13   HH12  ARG  88          HH22      ARG  88  15.772   7.626   1.873

  No H/Q in entry =          13
  In of MODEL   57
    1    H    GLU  89           H        GLU  89  12.730   5.725   1.227
    2    HA   GLU  89           HA       GLU  89  14.310   8.063   1.079
    3    HB2  GLU  89           HB2      GLU  89  13.162   7.038  -0.875
    4    HB3  GLU  89           HB3      GLU  89  11.621   7.600  -0.226
    5    HG2  GLU  89           HG2      GLU  89  12.356   9.928  -0.385
    6    HG3  GLU  89           HG3      GLU  89  13.956   9.415  -0.913

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LEU  90           H        LEU  90  10.968   7.600   2.190
    2    HA   LEU  90           HA       LEU  90  10.487  10.340   2.762
    3    HB2  LEU  90           HB2      LEU  90   9.252   7.784   3.783
    4    HB3  LEU  90           HB3      LEU  90   8.641   9.388   4.203
    5    HG   LEU  90           HG       LEU  90   9.062   8.502   1.336
    6   HD12  LEU  90          HD11      LEU  90   6.524   8.208   1.385
    7   HD11  LEU  90          HD12      LEU  90   6.669   8.196   3.142
    8   HD13  LEU  90          HD13      LEU  90   7.475   6.955   2.182
    9   HD22  LEU  90          HD21      LEU  90   8.801  10.814   1.261
   10   HD21  LEU  90          HD22      LEU  90   7.807  10.860   2.715
   11   HD23  LEU  90          HD23      LEU  90   7.110  10.314   1.190

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  91           H        ILE  91  11.703   7.642   4.692
    2    HA   ILE  91           HA       ILE  91  11.849   9.006   7.160
    3    HB   ILE  91           HB       ILE  91  13.376   6.646   6.045
    4   HG12  ILE  91          HG12      ILE  91  11.351   6.841   8.294
    5   HG13  ILE  91          HG13      ILE  91  10.885   6.567   6.616
    6   HG22  ILE  91          HG21      ILE  91  13.829   6.426   8.688
    7   HG21  ILE  91          HG22      ILE  91  13.778   8.186   8.587
    8   HG23  ILE  91          HG23      ILE  91  14.949   7.281   7.629
    9   HD13  ILE  91          HD11      ILE  91  11.859   4.451   6.551
   10   HD12  ILE  91          HD12      ILE  91  11.258   4.518   8.208
   11   HD11  ILE  91          HD13      ILE  91  12.966   4.808   7.879

  No H/Q in entry =          11
  In of MODEL   57
    1    H    THR  92           H        THR  92  14.078   8.806   4.420
    2    HA   THR  92           HA       THR  92  16.256  10.169   5.591
    3    HB   THR  92           HB       THR  92  15.283  10.057   2.725
    4    HG1  THR  92           HG1      THR  92  16.087   8.149   3.135
    5   HG22  THR  92          HG21      THR  92  17.864  10.712   2.445
    6   HG21  THR  92          HG22      THR  92  17.559  11.537   3.973
    7   HG23  THR  92          HG23      THR  92  16.602  11.938   2.547

  No H/Q in entry =           7
  In of MODEL   57
    1    H    GLU  93           H        GLU  93  13.394  11.362   3.847
    2    HA   GLU  93           HA       GLU  93  14.026  14.114   3.964
    3    HB2  GLU  93           HB2      GLU  93  11.303  12.779   3.964
    4    HB3  GLU  93           HB3      GLU  93  11.616  14.474   3.594
    5    HG2  GLU  93           HG2      GLU  93  12.931  12.213   2.073
    6    HG3  GLU  93           HG3      GLU  93  11.397  12.917   1.578

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LEU  94           H        LEU  94  12.242  11.982   6.166
    2    HA   LEU  94           HA       LEU  94  11.450  13.940   8.038
    3    HB2  LEU  94           HB2      LEU  94  11.984  10.977   8.315
    4    HB3  LEU  94           HB3      LEU  94  11.419  11.961   9.663
    5    HG   LEU  94           HG       LEU  94   9.949  12.032   7.026
    6   HD11  LEU  94          HD11      LEU  94   9.991   9.811   9.031
    7   HD13  LEU  94          HD12      LEU  94   9.698   9.753   7.295
    8   HD12  LEU  94          HD13      LEU  94   8.421  10.288   8.386
    9   HD23  LEU  94          HD21      LEU  94   8.027  12.459   8.616
   10   HD22  LEU  94          HD22      LEU  94   9.283  13.696   8.660
   11   HD21  LEU  94          HD23      LEU  94   9.197  12.480   9.934

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  95           H        ILE  95  14.398  11.970   7.817
    2    HA   ILE  95           HA       ILE  95  15.566  12.876  10.236
    3    HB   ILE  95           HB       ILE  95  16.803  11.790   7.695
    4   HG12  ILE  95          HG12      ILE  95  16.477  10.594  10.461
    5   HG13  ILE  95          HG13      ILE  95  15.314  10.351   9.160
    6   HG21  ILE  95          HG21      ILE  95  18.056  12.580  10.343
    7   HG23  ILE  95          HG22      ILE  95  18.534  13.101   8.726
    8   HG22  ILE  95          HG23      ILE  95  18.815  11.437   9.236
    9   HD13  ILE  95          HD11      ILE  95  16.782   9.052   7.904
   10   HD12  ILE  95          HD12      ILE  95  17.241   8.597   9.543
   11   HD11  ILE  95          HD13      ILE  95  18.214   9.763   8.648

  No H/Q in entry =          11
  In of MODEL   57
    1    H    GLU  96           H        GLU  96  15.755  14.107   6.903
    2    HA   GLU  96           HA       GLU  96  17.627  16.160   7.388
    3    HB2  GLU  96           HB2      GLU  96  16.965  15.506   5.126
    4    HB3  GLU  96           HB3      GLU  96  15.328  16.086   5.418
    5    HG2  GLU  96           HG2      GLU  96  15.926  18.207   4.879
    6    HG3  GLU  96           HG3      GLU  96  17.219  18.190   6.067

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LEU  97           H        LEU  97  14.112  16.021   7.800
    2    HA   LEU  97           HA       LEU  97  13.730  18.761   8.440
    3    HB2  LEU  97           HB2      LEU  97  12.174  16.256   9.047
    4    HB3  LEU  97           HB3      LEU  97  11.679  17.810   9.715
    5    HG   LEU  97           HG       LEU  97  12.171  17.387   6.753
    6   HD12  LEU  97          HD11      LEU  97   9.646  17.294   6.623
    7   HD11  LEU  97          HD12      LEU  97   9.628  17.095   8.373
    8   HD13  LEU  97          HD13      LEU  97  10.398  15.876   7.355
    9   HD23  LEU  97          HD21      LEU  97  10.460  19.375   6.777
   10   HD22  LEU  97          HD22      LEU  97  12.144  19.711   7.178
   11   HD21  LEU  97          HD23      LEU  97  10.947  19.557   8.462

  No H/Q in entry =          11
  In of MODEL   57
    1    H    HIS  98           H        HIS  98  14.503  15.924  10.440
    2    HA   HIS  98           HA       HIS  98  14.350  17.187  12.955
    3    HB2  HIS  98           HB2      HIS  98  16.073  14.905  11.962
    4    HB3  HIS  98           HB3      HIS  98  16.071  15.444  13.643
    5    HD1  HIS  98           HD1      HIS  98  13.862  13.845  11.040
    6    HD2  HIS  98           HD2      HIS  98  13.748  14.766  15.104
    7    HE1  HIS  98           HE1      HIS  98  11.816  12.678  11.983
    8    HE2  HIS  98           HE2      HIS  98  11.726  13.232  14.454

  No H/Q in entry =           8
  In of MODEL   57
    1    H    GLU  99           H        GLU  99  16.913  17.036  10.533
    2    HA   GLU  99           HA       GLU  99  18.910  18.340  12.071
    3    HB2  GLU  99           HB2      GLU  99  19.381  17.045  10.004
    4    HB3  GLU  99           HB3      GLU  99  18.593  18.311   9.060
    5    HG2  GLU  99           HG2      GLU  99  20.221  19.959   9.858
    6    HG3  GLU  99           HG3      GLU  99  20.978  18.747  10.885

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LYS 100           H        LYS 100  16.413  19.537   9.843
    2    HA   LYS 100           HA       LYS 100  17.249  22.263   9.991
    3    HB2  LYS 100           HB2      LYS 100  14.601  21.011   9.223
    4    HB3  LYS 100           HB3      LYS 100  14.926  22.745   9.134
    5    HG2  LYS 100           HG2      LYS 100  16.899  22.269   7.677
    6    HG3  LYS 100           HG3      LYS 100  16.461  20.558   7.693
    7    HD2  LYS 100           HD2      LYS 100  14.278  21.098   6.682
    8    HD3  LYS 100           HD3      LYS 100  14.699  22.812   6.673
    9    HE2  LYS 100           HE2      LYS 100  16.658  22.303   5.223
   10    HE3  LYS 100           HE3      LYS 100  16.168  20.605   5.188
   11    HZ1  LYS 100           HZ1      LYS 100  14.379  22.824   4.344
   12    HZ3  LYS 100           HZ2      LYS 100  14.172  21.157   4.081
   13    HZ2  LYS 100           HZ3      LYS 100  15.399  22.002   3.265

  No H/Q in entry =          13
  In of MODEL   57
    1    H    LEU 101           H        LEU 101  15.113  20.247  11.946
    2    HA   LEU 101           HA       LEU 101  13.969  22.332  13.518
    3    HB2  LEU 101           HB2      LEU 101  14.367  19.376  13.904
    4    HB3  LEU 101           HB3      LEU 101  13.838  20.364  15.263
    5    HG   LEU 101           HG       LEU 101  12.434  20.473  12.587
    6   HD12  LEU 101          HD11      LEU 101  10.747  18.933  13.848
    7   HD11  LEU 101          HD12      LEU 101  12.130  18.500  14.849
    8   HD13  LEU 101          HD13      LEU 101  12.168  18.193  13.112
    9   HD21  LEU 101          HD21      LEU 101  11.776  21.275  15.436
   10   HD23  LEU 101          HD22      LEU 101  10.517  21.068  14.220
   11   HD22  LEU 101          HD23      LEU 101  11.771  22.285  13.988

  No H/Q in entry =          11
  In of MODEL   57
    1    H    LYS 102           H        LYS 102  17.109  21.679  13.097
    2    HA   LYS 102           HA       LYS 102  18.963  22.522  14.178
    3    HB2  LYS 102           HB2      LYS 102  17.166  24.064  15.303
    4    HB3  LYS 102           HB3      LYS 102  17.351  22.998  16.681
    5    HG2  LYS 102           HG2      LYS 102  19.279  24.981  15.521
    6    HG3  LYS 102           HG3      LYS 102  18.884  24.673  17.198
    7    HD2  LYS 102           HD2      LYS 102  20.531  22.736  15.520
    8    HD3  LYS 102           HD3      LYS 102  21.235  24.048  16.456
    9    HE2  LYS 102           HE2      LYS 102  20.795  21.505  17.422
   10    HE3  LYS 102           HE3      LYS 102  21.030  22.944  18.415
   11    HZ2  LYS 102           HZ1      LYS 102  19.040  21.689  19.023
   12    HZ1  LYS 102           HZ2      LYS 102  18.407  21.928  17.472
   13    HZ3  LYS 102           HZ3      LYS 102  18.652  23.254  18.499

  No H/Q in entry =          13
  In of MODEL   57
    1    H    ALA 103           H        ALA 103  16.857  20.947  16.590
    2    HA   ALA 103           HA       ALA 103  18.558  19.711  18.253
    3    HB2  ALA 103           HB1      ALA 103  16.944  17.727  18.239
    4    HB1  ALA 103           HB2      ALA 103  16.067  18.594  16.978
    5    HB3  ALA 103           HB3      ALA 103  16.249  19.312  18.577

  No H/Q in entry =           5
  In of MODEL   57
    1    H1   ALA   1           H3       ALA   1  -1.576  -6.843 -21.465
    2    H2   ALA   1           H2       ALA   1  -2.394  -8.267 -21.016
    3    H3   ALA   1           H1       ALA   1  -0.785  -8.340 -21.563
    4    HA   ALA   1           HA       ALA   1  -1.616  -8.797 -23.564
    5    HB1  ALA   1           HB1      ALA   1  -3.766  -9.483 -23.101
    6    HB2  ALA   1           HB2      ALA   1  -4.178  -7.966 -23.900
    7    HB3  ALA   1           HB3      ALA   1  -4.127  -8.047 -22.141

  No H/Q in entry =           7
  In of MODEL   57
    1    H    GLU   2           H        GLU   2  -2.418  -7.594 -25.557
    2    HA   GLU   2           HA       GLU   2  -0.985  -5.601 -26.427
    3    HB2  GLU   2           HB2      GLU   2  -3.991  -5.622 -26.759
    4    HB3  GLU   2           HB3      GLU   2  -2.852  -4.776 -27.803
    5    HG2  GLU   2           HG2      GLU   2  -2.372  -6.673 -28.956
    6    HG3  GLU   2           HG3      GLU   2  -2.096  -7.584 -27.477

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLU   3           H        GLU   3  -4.130  -4.297 -25.542
    2    HA   GLU   3           HA       GLU   3  -3.048  -1.757 -24.908
    3    HB2  GLU   3           HB2      GLU   3  -5.757  -3.031 -24.589
    4    HB3  GLU   3           HB3      GLU   3  -5.438  -1.420 -23.941
    5    HG2  GLU   3           HG2      GLU   3  -5.057  -0.498 -26.065
    6    HG3  GLU   3           HG3      GLU   3  -4.682  -2.059 -26.788

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LEU   4           H        LEU   4  -4.685  -4.092 -22.737
    2    HA   LEU   4           HA       LEU   4  -4.314  -2.870 -20.343
    3    HB2  LEU   4           HB2      LEU   4  -3.813  -5.819 -20.811
    4    HB3  LEU   4           HB3      LEU   4  -4.216  -5.067 -19.269
    5    HG   LEU   4           HG       LEU   4  -5.977  -5.113 -21.742
    6   HD13  LEU   4          HD11      LEU   4  -7.201  -6.813 -20.751
    7   HD12  LEU   4          HD12      LEU   4  -6.717  -6.361 -19.117
    8   HD11  LEU   4          HD13      LEU   4  -5.589  -7.221 -20.163
    9   HD23  LEU   4          HD21      LEU   4  -7.658  -4.277 -19.882
   10   HD22  LEU   4          HD22      LEU   4  -6.598  -3.121 -20.687
   11   HD21  LEU   4          HD23      LEU   4  -6.189  -3.718 -19.080

  No H/Q in entry =          11
  In of MODEL   57
    1    H    GLU   5           H        GLU   5  -1.836  -4.750 -22.063
    2    HA   GLU   5           HA       GLU   5   0.142  -4.497 -20.016
    3    HB2  GLU   5           HB2      GLU   5   0.196  -6.270 -21.760
    4    HB3  GLU   5           HB3      GLU   5   0.518  -5.034 -22.976
    5    HG2  GLU   5           HG2      GLU   5   2.593  -4.411 -21.832
    6    HG3  GLU   5           HG3      GLU   5   2.268  -5.590 -20.562

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLU   6           H        GLU   6  -0.452  -2.774 -23.063
    2    HA   GLU   6           HA       GLU   6   1.744  -0.975 -22.784
    3    HB2  GLU   6           HB2      GLU   6  -0.727  -1.077 -24.481
    4    HB3  GLU   6           HB3      GLU   6   0.229   0.404 -24.426
    5    HG2  GLU   6           HG2      GLU   6   1.029  -0.959 -26.268
    6    HG3  GLU   6           HG3      GLU   6   2.257  -0.950 -25.004

  No H/Q in entry =           6
  In of MODEL   57
    1    H    VAL   7           H        VAL   7  -1.600  -0.996 -21.756
    2    HA   VAL   7           HA       VAL   7  -1.784   1.719 -20.919
    3    HB   VAL   7           HB       VAL   7  -3.289  -0.776 -20.091
    4   HG11  VAL   7          HG11      VAL   7  -3.624   2.118 -19.278
    5   HG13  VAL   7          HG12      VAL   7  -3.551   0.692 -18.243
    6   HG12  VAL   7          HG13      VAL   7  -4.974   0.983 -19.242
    7   HG21  VAL   7          HG21      VAL   7  -3.417   0.304 -22.480
    8   HG23  VAL   7          HG22      VAL   7  -4.348   1.566 -21.672
    9   HG22  VAL   7          HG23      VAL   7  -4.919  -0.102 -21.649

  No H/Q in entry =           9
  In of MODEL   57
    1    H    VAL   8           H        VAL   8  -0.850  -1.281 -19.272
    2    HA   VAL   8           HA       VAL   8  -0.528  -0.207 -16.675
    3    HB   VAL   8           HB       VAL   8   0.728  -2.575 -18.068
    4   HG13  VAL   8          HG11      VAL   8   2.384  -2.074 -16.487
    5   HG12  VAL   8          HG12      VAL   8   1.329  -3.166 -15.589
    6   HG11  VAL   8          HG13      VAL   8   1.221  -1.426 -15.330
    7   HG23  VAL   8          HG21      VAL   8  -0.804  -3.301 -15.783
    8   HG22  VAL   8          HG22      VAL   8  -1.246  -3.530 -17.472
    9   HG21  VAL   8          HG23      VAL   8  -1.752  -2.074 -16.621

  No H/Q in entry =           9
  In of MODEL   57
    1    H    MET   9           H        MET   9   1.729  -0.542 -19.411
    2    HA   MET   9           HA       MET   9   4.025   0.465 -18.138
    3    HB2  MET   9           HB2      MET   9   3.092   0.513 -21.007
    4    HB3  MET   9           HB3      MET   9   4.618   1.247 -20.521
    5    HG2  MET   9           HG2      MET   9   5.396  -0.883 -19.609
    6    HG3  MET   9           HG3      MET   9   3.842  -1.633 -19.975
    7    HE3  MET   9           HE1      MET   9   5.864   0.973 -22.435
    8    HE2  MET   9           HE2      MET   9   7.117  -0.211 -22.797
    9    HE1  MET   9           HE3      MET   9   6.799   0.243 -21.125

  No H/Q in entry =           9
  In of MODEL   57
    1    H    GLY  10           H        GLY  10   1.374   2.110 -19.828
    2    HA3  GLY  10           HA2      GLY  10   2.379   4.748 -19.578
    3    HA2  GLY  10           HA3      GLY  10   0.683   4.315 -19.791

  No H/Q in entry =           3
  In of MODEL   57
    1    H    LEU  11           H        LEU  11   0.249   2.793 -17.507
    2    HA   LEU  11           HA       LEU  11  -0.258   4.778 -15.549
    3    HB2  LEU  11           HB2      LEU  11  -0.241   1.761 -15.394
    4    HB3  LEU  11           HB3      LEU  11  -0.739   2.792 -14.054
    5    HG   LEU  11           HG       LEU  11  -1.963   2.927 -16.822
    6   HD13  LEU  11          HD11      LEU  11  -2.586   0.793 -16.071
    7   HD12  LEU  11          HD12      LEU  11  -3.922   1.807 -15.531
    8   HD11  LEU  11          HD13      LEU  11  -2.679   1.305 -14.386
    9   HD22  LEU  11          HD21      LEU  11  -2.526   4.952 -15.817
   10   HD21  LEU  11          HD22      LEU  11  -2.469   4.284 -14.187
   11   HD23  LEU  11          HD23      LEU  11  -3.845   3.941 -15.235

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  12           H        ILE  12   2.245   2.270 -15.781
    2    HA   ILE  12           HA       ILE  12   3.448   2.787 -13.272
    3    HB   ILE  12           HB       ILE  12   4.696   1.727 -15.830
    4   HG12  ILE  12          HG12      ILE  12   2.658   0.529 -14.696
    5   HG13  ILE  12          HG13      ILE  12   4.045  -0.430 -15.175
    6   HG22  ILE  12          HG21      ILE  12   6.347   0.673 -14.235
    7   HG21  ILE  12          HG22      ILE  12   5.658   1.665 -12.951
    8   HG23  ILE  12          HG23      ILE  12   6.453   2.430 -14.325
    9   HD13  ILE  12          HD11      ILE  12   4.856  -0.439 -12.886
   10   HD12  ILE  12          HD12      ILE  12   3.172  -0.961 -12.892
   11   HD11  ILE  12          HD13      ILE  12   3.584   0.666 -12.397

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  13           H        ILE  13   4.084   4.041 -16.526
    2    HA   ILE  13           HA       ILE  13   6.246   5.726 -15.791
    3    HB   ILE  13           HB       ILE  13   4.226   5.845 -18.044
    4   HG12  ILE  13          HG12      ILE  13   5.971   3.950 -17.803
    5   HG13  ILE  13          HG13      ILE  13   5.845   4.763 -19.358
    6   HG22  ILE  13          HG21      ILE  13   6.380   7.304 -18.929
    7   HG21  ILE  13          HG22      ILE  13   6.292   7.806 -17.245
    8   HG23  ILE  13          HG23      ILE  13   4.892   8.010 -18.296
    9   HD12  ILE  13          HD11      ILE  13   8.217   4.390 -18.072
   10   HD11  ILE  13          HD12      ILE  13   7.754   5.961 -17.428
   11   HD13  ILE  13          HD13      ILE  13   7.909   5.736 -19.167

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ASN  14           H        ASN  14   2.749   6.278 -16.073
    2    HA   ASN  14           HA       ASN  14   2.750   9.024 -15.435
    3    HB2  ASN  14           HB2      ASN  14   0.833   7.415 -16.274
    4    HB3  ASN  14           HB3      ASN  14   0.502   7.241 -14.555
    5   HD21  ASN  14          HD21      ASN  14  -1.492   8.431 -15.996
    6   HD22  ASN  14          HD22      ASN  14  -1.528  10.105 -15.728

  No H/Q in entry =           6
  In of MODEL   57
    1    H    SER  15           H        SER  15   2.399   6.152 -13.361
    2    HA   SER  15           HA       SER  15   2.104   7.526 -10.913
    3    HB2  SER  15           HB2      SER  15   2.618   5.431  -9.863
    4    HB3  SER  15           HB3      SER  15   1.783   5.028 -11.358
    5    HG   SER  15           HG       SER  15   4.300   4.440 -10.582

  No H/Q in entry =           5
  In of MODEL   57
    1    H    GLY  16           H        GLY  16   4.969   6.383 -12.661
    2    HA3  GLY  16           HA2      GLY  16   6.898   7.108 -10.722
    3    HA2  GLY  16           HA3      GLY  16   7.205   6.901 -12.444

  No H/Q in entry =           3
  In of MODEL   57
    1    H    GLN  17           H        GLN  17   5.552   8.886 -13.513
    2    HA   GLN  17           HA       GLN  17   7.164  11.202 -13.197
    3    HB2  GLN  17           HB2      GLN  17   5.868  10.774 -15.250
    4    HB3  GLN  17           HB3      GLN  17   4.366  10.952 -14.343
    5    HG2  GLN  17           HG2      GLN  17   4.923  13.274 -13.813
    6    HG3  GLN  17           HG3      GLN  17   6.475  13.110 -14.633
    7   HE21  GLN  17          HE21      GLN  17   4.503  15.052 -15.453
    8   HE22  GLN  17          HE22      GLN  17   3.957  14.614 -16.999

  No H/Q in entry =           8
  In of MODEL   57
    1    H    ALA  18           H        ALA  18   4.043  10.232 -11.862
    2    HA   ALA  18           HA       ALA  18   3.350  12.631 -10.598
    3    HB1  ALA  18           HB1      ALA  18   2.183  10.193 -10.826
    4    HB2  ALA  18           HB2      ALA  18   1.649  11.420  -9.681
    5    HB3  ALA  18           HB3      ALA  18   2.717  10.121  -9.147

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ARG  19           H        ARG  19   5.175   9.839  -9.312
    2    HA   ARG  19           HA       ARG  19   5.715  10.988  -6.787
    3    HB2  ARG  19           HB2      ARG  19   6.095   8.579  -7.314
    4    HB3  ARG  19           HB3      ARG  19   7.462   9.045  -8.329
    5    HG2  ARG  19           HG2      ARG  19   8.589  10.067  -6.401
    6    HG3  ARG  19           HG3      ARG  19   7.203   9.699  -5.376
    7    HD2  ARG  19           HD2      ARG  19   8.939   8.038  -5.011
    8    HD3  ARG  19           HD3      ARG  19   7.557   7.277  -5.803
    9    HE   ARG  19           HE       ARG  19   9.282   8.071  -7.843
   10   HH21  ARG  19          HH11      ARG  19  10.825   6.643  -8.687
   11   HH22  ARG  19          HH12      ARG  19  11.346   5.286  -7.750
   12   HH11  ARG  19          HH21      ARG  19   9.312   6.038  -5.065
   13   HH12  ARG  19          HH22      ARG  19  10.486   4.944  -5.698

  No H/Q in entry =          13
  In of MODEL   57
    1    H    SER  20           H        SER  20   7.545  10.992  -9.828
    2    HA   SER  20           HA       SER  20   9.807  12.374  -8.994
    3    HB2  SER  20           HB2      SER  20   9.275  11.353 -11.309
    4    HB3  SER  20           HB3      SER  20   8.521  12.904 -11.662
    5    HG   SER  20           HG       SER  20  11.207  12.371 -10.933

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LEU  21           H        LEU  21   6.732  13.688 -10.204
    2    HA   LEU  21           HA       LEU  21   7.441  16.424  -9.976
    3    HB2  LEU  21           HB2      LEU  21   4.751  15.041  -9.905
    4    HB3  LEU  21           HB3      LEU  21   4.946  16.792  -9.913
    5    HG   LEU  21           HG       LEU  21   6.117  14.970 -12.036
    6   HD12  LEU  21          HD11      LEU  21   4.227  15.836 -13.452
    7   HD11  LEU  21          HD12      LEU  21   3.516  16.527 -11.993
    8   HD13  LEU  21          HD13      LEU  21   3.704  14.780 -12.139
    9   HD23  LEU  21          HD21      LEU  21   5.940  17.303 -13.274
   10   HD22  LEU  21          HD22      LEU  21   7.303  17.007 -12.199
   11   HD21  LEU  21          HD23      LEU  21   5.939  17.962 -11.641

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ALA  22           H        ALA  22   5.887  14.155  -7.735
    2    HA   ALA  22           HA       ALA  22   5.301  15.970  -5.670
    3    HB3  ALA  22           HB1      ALA  22   4.507  13.589  -5.837
    4    HB2  ALA  22           HB2      ALA  22   5.095  14.052  -4.240
    5    HB1  ALA  22           HB3      ALA  22   6.110  13.080  -5.307

  No H/Q in entry =           5
  In of MODEL   57
    1    H    TYR  23           H        TYR  23   8.208  13.905  -6.097
    2    HA   TYR  23           HA       TYR  23   9.596  14.904  -3.838
    3    HB2  TYR  23           HB2      TYR  23  10.361  12.886  -4.993
    4    HB3  TYR  23           HB3      TYR  23  10.692  13.821  -6.451
    5    HD1  TYR  23           HD1      TYR  23  11.641  13.459  -2.859
    6    HD2  TYR  23           HD2      TYR  23  12.740  14.976  -6.726
    7    HE1  TYR  23           HE1      TYR  23  13.903  14.007  -2.002
    8    HE2  TYR  23           HE2      TYR  23  15.002  15.524  -5.868
    9    HH   TYR  23           HH       TYR  23  15.783  15.281  -2.462

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ALA  24           H        ALA  24   9.442  16.015  -7.204
    2    HA   ALA  24           HA       ALA  24  11.364  18.075  -6.949
    3    HB2  ALA  24           HB1      ALA  24  10.931  18.143  -9.160
    4    HB3  ALA  24           HB2      ALA  24   9.384  18.913  -8.807
    5    HB1  ALA  24           HB3      ALA  24   9.488  17.159  -8.937

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ALA  25           H        ALA  25   7.880  17.935  -6.343
    2    HA   ALA  25           HA       ALA  25   7.432  20.659  -5.775
    3    HB1  ALA  25           HB1      ALA  25   5.747  18.682  -5.984
    4    HB2  ALA  25           HB2      ALA  25   5.391  19.974  -4.836
    5    HB3  ALA  25           HB3      ALA  25   6.058  18.445  -4.263

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LEU  26           H        LEU  26   8.458  17.965  -3.721
    2    HA   LEU  26           HA       LEU  26   8.571  19.394  -1.283
    3    HB2  LEU  26           HB2      LEU  26   8.636  16.977  -1.278
    4    HB3  LEU  26           HB3      LEU  26  10.110  16.967  -2.243
    5    HG   LEU  26           HG       LEU  26  11.331  18.069  -0.397
    6   HD12  LEU  26          HD11      LEU  26  10.096  18.092   1.857
    7   HD11  LEU  26          HD12      LEU  26   8.610  17.972   0.916
    8   HD13  LEU  26          HD13      LEU  26   9.673  19.365   0.712
    9   HD21  LEU  26          HD21      LEU  26   9.764  15.620   0.469
   10   HD23  LEU  26          HD22      LEU  26  11.283  16.164   1.172
   11   HD22  LEU  26          HD23      LEU  26  11.238  15.606  -0.498

  No H/Q in entry =          11
  In of MODEL   57
    1    H    LYS  27           H        LYS  27  10.991  18.793  -3.798
    2    HA   LYS  27           HA       LYS  27  13.184  20.008  -2.561
    3    HB2  LYS  27           HB2      LYS  27  13.279  18.660  -4.651
    4    HB3  LYS  27           HB3      LYS  27  12.533  20.001  -5.519
    5    HG2  LYS  27           HG2      LYS  27  14.413  21.464  -4.933
    6    HG3  LYS  27           HG3      LYS  27  15.155  20.163  -3.994
    7    HD2  LYS  27           HD2      LYS  27  15.290  18.774  -6.047
    8    HD3  LYS  27           HD3      LYS  27  14.594  20.101  -6.978
    9    HE2  LYS  27           HE2      LYS  27  16.496  21.545  -6.358
   10    HE3  LYS  27           HE3      LYS  27  17.196  20.222  -5.418
   11    HZ3  LYS  27           HZ1      LYS  27  18.196  20.311  -7.600
   12    HZ2  LYS  27           HZ2      LYS  27  16.671  20.210  -8.347
   13    HZ1  LYS  27           HZ3      LYS  27  17.275  18.893  -7.460

  No H/Q in entry =          13
  In of MODEL   57
    1    H    GLN  28           H        GLN  28  10.586  21.420  -4.520
    2    HA   GLN  28           HA       GLN  28  11.576  24.061  -4.669
    3    HB2  GLN  28           HB2      GLN  28   8.730  23.024  -4.568
    4    HB3  GLN  28           HB3      GLN  28   9.165  24.691  -4.943
    5    HG2  GLN  28           HG2      GLN  28  10.140  22.267  -6.481
    6    HG3  GLN  28           HG3      GLN  28   8.818  23.314  -6.992
    7   HE21  GLN  28          HE21      GLN  28  11.942  22.788  -7.730
    8   HE22  GLN  28          HE22      GLN  28  12.450  24.367  -8.092

  No H/Q in entry =           8
  In of MODEL   57
    1    H    ALA  29           H        ALA  29   9.616  22.391  -2.241
    2    HA   ALA  29           HA       ALA  29   9.084  24.589  -0.561
    3    HB2  ALA  29           HB1      ALA  29   8.331  23.028   1.004
    4    HB1  ALA  29           HB2      ALA  29   9.541  21.830   0.544
    5    HB3  ALA  29           HB3      ALA  29   8.163  22.140  -0.510

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LYS  30           H        LYS  30  11.789  22.291  -0.620
    2    HA   LYS  30           HA       LYS  30  13.108  23.230   1.689
    3    HB2  LYS  30           HB2      LYS  30  14.200  21.932  -0.817
    4    HB3  LYS  30           HB3      LYS  30  15.181  22.281   0.608
    5    HG2  LYS  30           HG2      LYS  30  13.607  20.915   1.981
    6    HG3  LYS  30           HG3      LYS  30  12.723  20.503   0.508
    7    HD2  LYS  30           HD2      LYS  30  14.761  19.494  -0.445
    8    HD3  LYS  30           HD3      LYS  30  15.664  19.920   1.011
    9    HE2  LYS  30           HE2      LYS  30  14.138  18.505   2.359
   10    HE3  LYS  30           HE3      LYS  30  13.265  18.059   0.887
   11    HZ2  LYS  30           HZ1      LYS  30  15.036  16.461   1.655
   12    HZ1  LYS  30           HZ2      LYS  30  16.188  17.636   1.209
   13    HZ3  LYS  30           HZ3      LYS  30  15.149  16.963   0.039

  No H/Q in entry =          13
  In of MODEL   57
    1    H    GLN  31           H        GLN  31  13.026  24.436  -1.608
    2    HA   GLN  31           HA       GLN  31  15.198  26.306  -1.178
    3    HB2  GLN  31           HB2      GLN  31  13.164  26.375  -3.410
    4    HB3  GLN  31           HB3      GLN  31  14.792  27.053  -3.405
    5    HG2  GLN  31           HG2      GLN  31  15.222  24.352  -2.828
    6    HG3  GLN  31           HG3      GLN  31  13.922  24.313  -4.012
    7   HE21  GLN  31          HE21      GLN  31  16.758  23.488  -4.404
    8   HE22  GLN  31          HE22      GLN  31  17.346  24.455  -5.668

  No H/Q in entry =           8
  In of MODEL   57
    1    H    GLY  32           H        GLY  32  12.117  26.157  -0.045
    2    HA3  GLY  32           HA2      GLY  32  10.973  27.738   1.224
    3    HA2  GLY  32           HA3      GLY  32  12.114  28.961   0.679

  No H/Q in entry =           3
  In of MODEL   57
    1    H    ASP  33           H        ASP  33  10.739  27.072  -1.819
    2    HA   ASP  33           HA       ASP  33   9.103  29.363  -2.681
    3    HB2  ASP  33           HB2      ASP  33  10.175  26.932  -4.119
    4    HB3  ASP  33           HB3      ASP  33   9.039  28.060  -4.854

  No H/Q in entry =           4
  In of MODEL   57
    1    H    PHE  34           H        PHE  34   7.403  28.906  -1.124
    2    HA   PHE  34           HA       PHE  34   5.996  26.449  -1.034
    3    HB2  PHE  34           HB2      PHE  34   5.063  29.246  -0.358
    4    HB3  PHE  34           HB3      PHE  34   4.196  27.765   0.050
    5    HD1  PHE  34           HD1      PHE  34   6.467  30.139   1.273
    6    HD2  PHE  34           HD2      PHE  34   5.741  25.905   1.216
    7    HE1  PHE  34           HE1      PHE  34   7.847  29.873   3.315
    8    HE2  PHE  34           HE2      PHE  34   7.123  25.643   3.257
    9    HZ   PHE  34           HZ       PHE  34   8.170  27.628   4.306

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ALA  35           H        ALA  35   5.605  29.317  -3.047
    2    HA   ALA  35           HA       ALA  35   3.051  28.731  -4.082
    3    HB1  ALA  35           HB1      ALA  35   4.126  30.112  -6.115
    4    HB3  ALA  35           HB2      ALA  35   5.343  30.460  -4.886
    5    HB2  ALA  35           HB3      ALA  35   3.656  30.887  -4.602

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ALA  36           H        ALA  36   6.278  28.023  -5.423
    2    HA   ALA  36           HA       ALA  36   5.282  26.605  -7.671
    3    HB3  ALA  36           HB1      ALA  36   7.445  26.706  -8.278
    4    HB2  ALA  36           HB2      ALA  36   7.910  25.672  -6.926
    5    HB1  ALA  36           HB3      ALA  36   7.822  27.421  -6.711

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ALA  37           H        ALA  37   6.214  25.600  -4.413
    2    HA   ALA  37           HA       ALA  37   6.127  22.812  -4.843
    3    HB2  ALA  37           HB1      ALA  37   5.876  24.606  -2.465
    4    HB1  ALA  37           HB2      ALA  37   6.996  23.276  -2.753
    5    HB3  ALA  37           HB3      ALA  37   5.329  22.940  -2.289

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LYS  38           H        LYS  38   3.614  25.048  -3.684
    2    HA   LYS  38           HA       LYS  38   1.494  23.257  -3.470
    3    HB2  LYS  38           HB2      LYS  38   1.874  26.009  -3.217
    4    HB3  LYS  38           HB3      LYS  38   0.679  25.875  -4.501
    5    HG2  LYS  38           HG2      LYS  38  -0.791  24.567  -3.064
    6    HG3  LYS  38           HG3      LYS  38   0.448  24.494  -1.803
    7    HD2  LYS  38           HD2      LYS  38   0.285  26.832  -1.356
    8    HD3  LYS  38           HD3      LYS  38  -0.618  27.131  -2.842
    9    HE2  LYS  38           HE2      LYS  38  -2.128  27.181  -0.908
   10    HE3  LYS  38           HE3      LYS  38  -2.513  25.809  -1.952
   11    HZ3  LYS  38           HZ1      LYS  38  -1.809  24.330  -0.417
   12    HZ2  LYS  38           HZ2      LYS  38  -2.151  25.591   0.672
   13    HZ1  LYS  38           HZ3      LYS  38  -0.557  25.323   0.153

  No H/Q in entry =          13
  In of MODEL   57
    1    H    ALA  39           H        ALA  39   2.506  25.149  -6.315
    2    HA   ALA  39           HA       ALA  39   0.427  24.305  -8.026
    3    HB2  ALA  39           HB1      ALA  39   3.175  24.923  -9.069
    4    HB1  ALA  39           HB2      ALA  39   2.219  26.195  -8.307
    5    HB3  ALA  39           HB3      ALA  39   1.603  25.364  -9.736

  No H/Q in entry =           5
  In of MODEL   57
    1    H    MET  40           H        MET  40   3.649  22.971  -7.434
    2    HA   MET  40           HA       MET  40   3.538  20.952  -9.426
    3    HB2  MET  40           HB2      MET  40   5.141  21.158  -6.871
    4    HB3  MET  40           HB3      MET  40   5.383  19.900  -8.085
    5    HG2  MET  40           HG2      MET  40   5.475  22.855  -8.749
    6    HG3  MET  40           HG3      MET  40   6.910  21.937  -8.294
    7    HE3  MET  40           HE1      MET  40   7.770  19.713 -11.100
    8    HE2  MET  40           HE2      MET  40   7.196  19.400  -9.465
    9    HE1  MET  40           HE3      MET  40   8.307  20.735  -9.760

  No H/Q in entry =           9
  In of MODEL   57
    1    H    MET  41           H        MET  41   2.609  21.004  -6.006
    2    HA   MET  41           HA       MET  41   2.047  18.245  -5.731
    3    HB2  MET  41           HB2      MET  41   0.734  20.616  -4.384
    4    HB3  MET  41           HB3      MET  41   0.558  18.940  -3.877
    5    HG2  MET  41           HG2      MET  41   3.271  19.134  -3.904
    6    HG3  MET  41           HG3      MET  41   2.846  20.797  -3.509
    7    HE2  MET  41           HE1      MET  41  -0.213  19.576  -1.796
    8    HE1  MET  41           HE2      MET  41   0.621  21.081  -2.170
    9    HE3  MET  41           HE3      MET  41   0.549  20.510  -0.503

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ASP  42           H        ASP  42   0.041  20.991  -6.712
    2    HA   ASP  42           HA       ASP  42  -2.413  19.655  -6.859
    3    HB2  ASP  42           HB2      ASP  42  -1.679  22.218  -7.112
    4    HB3  ASP  42           HB3      ASP  42  -1.827  21.825  -8.821

  No H/Q in entry =           4
  In of MODEL   57
    1    H    GLN  43           H        GLN  43   0.043  20.221  -9.351
    2    HA   GLN  43           HA       GLN  43  -1.349  18.917 -11.446
    3    HB2  GLN  43           HB2      GLN  43   1.613  19.402 -11.052
    4    HB3  GLN  43           HB3      GLN  43   0.899  18.770 -12.538
    5    HG2  GLN  43           HG2      GLN  43  -0.592  20.812 -12.585
    6    HG3  GLN  43           HG3      GLN  43   0.363  21.458 -11.253
    7   HE21  GLN  43          HE21      GLN  43   0.549  23.077 -13.338
    8   HE22  GLN  43          HE22      GLN  43   1.965  22.842 -14.240

  No H/Q in entry =           8
  In of MODEL   57
    1    H    SER  44           H        SER  44   0.981  17.752  -9.046
    2    HA   SER  44           HA       SER  44   1.293  15.142 -10.070
    3    HB2  SER  44           HB2      SER  44   2.194  16.572  -7.830
    4    HB3  SER  44           HB3      SER  44   1.315  15.197  -7.163
    5    HG   SER  44           HG       SER  44   3.421  14.556  -7.581

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ARG  45           H        ARG  45  -1.023  16.484  -7.742
    2    HA   ARG  45           HA       ARG  45  -2.435  14.137  -7.113
    3    HB2  ARG  45           HB2      ARG  45  -2.617  16.306  -5.921
    4    HB3  ARG  45           HB3      ARG  45  -3.460  16.982  -7.311
    5    HG2  ARG  45           HG2      ARG  45  -5.245  15.274  -7.036
    6    HG3  ARG  45           HG3      ARG  45  -4.412  14.653  -5.609
    7    HD2  ARG  45           HD2      ARG  45  -4.601  16.922  -4.554
    8    HD3  ARG  45           HD3      ARG  45  -5.577  17.451  -5.940
    9    HE   ARG  45           HE       ARG  45  -6.714  15.086  -4.905
   10   HH21  ARG  45          HH11      ARG  45  -8.554  15.179  -3.642
   11   HH22  ARG  45          HH12      ARG  45  -8.939  16.623  -2.774
   12   HH11  ARG  45          HH21      ARG  45  -6.141  18.327  -3.878
   13   HH12  ARG  45          HH22      ARG  45  -7.567  18.405  -2.906

  No H/Q in entry =          13
  In of MODEL   57
    1    H    MET  46           H        MET  46  -2.985  16.547  -9.665
    2    HA   MET  46           HA       MET  46  -5.332  15.397 -10.737
    3    HB2  MET  46           HB2      MET  46  -3.209  17.207 -11.898
    4    HB3  MET  46           HB3      MET  46  -4.586  16.660 -12.859
    5    HG2  MET  46           HG2      MET  46  -6.141  17.610 -11.236
    6    HG3  MET  46           HG3      MET  46  -4.809  18.076 -10.185
    7    HE1  MET  46           HE1      MET  46  -6.391  18.115 -13.442
    8    HE3  MET  46           HE2      MET  46  -5.076  18.782 -14.403
    9    HE2  MET  46           HE3      MET  46  -6.445  19.804 -13.966

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ALA  47           H        ALA  47  -1.904  14.885 -11.481
    2    HA   ALA  47           HA       ALA  47  -2.257  13.162 -13.693
    3    HB3  ALA  47           HB1      ALA  47  -0.072  14.031 -13.332
    4    HB2  ALA  47           HB2      ALA  47   0.051  12.301 -12.998
    5    HB1  ALA  47           HB3      ALA  47  -0.036  13.454 -11.665

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LEU  48           H        LEU  48  -2.008  12.523 -10.218
    2    HA   LEU  48           HA       LEU  48  -2.128   9.684 -10.377
    3    HB2  LEU  48           HB2      LEU  48  -2.883  11.609  -8.166
    4    HB3  LEU  48           HB3      LEU  48  -2.806   9.857  -7.965
    5    HG   LEU  48           HG       LEU  48  -0.487  11.536  -8.953
    6   HD13  LEU  48          HD11      LEU  48  -0.772  12.308  -6.763
    7   HD12  LEU  48          HD12      LEU  48   0.378  10.990  -6.560
    8   HD11  LEU  48          HD13      LEU  48  -1.324  10.743  -6.169
    9   HD22  LEU  48          HD21      LEU  48  -0.006   9.346  -9.592
   10   HD21  LEU  48          HD22      LEU  48  -0.888   8.638  -8.239
   11   HD23  LEU  48          HD23      LEU  48   0.690   9.377  -7.973

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ASN  49           H        ASN  49  -4.569  12.199  -9.985
    2    HA   ASN  49           HA       ASN  49  -6.773  10.555  -9.455
    3    HB2  ASN  49           HB2      ASN  49  -6.827  12.969  -9.123
    4    HB3  ASN  49           HB3      ASN  49  -6.622  13.243 -10.848
    5   HD21  ASN  49          HD21      ASN  49  -8.879  11.757  -8.499
    6   HD22  ASN  49          HD22      ASN  49 -10.268  12.019  -9.436

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLU  50           H        GLU  50  -5.469  11.740 -12.537
    2    HA   GLU  50           HA       GLU  50  -7.428  10.503 -14.191
    3    HB2  GLU  50           HB2      GLU  50  -5.942  12.308 -14.999
    4    HB3  GLU  50           HB3      GLU  50  -4.559  11.223 -14.855
    5    HG2  GLU  50           HG2      GLU  50  -5.539   9.697 -16.496
    6    HG3  GLU  50           HG3      GLU  50  -6.991  10.689 -16.590

  No H/Q in entry =           6
  In of MODEL   57
    1    H    ALA  51           H        ALA  51  -4.272   9.481 -12.972
    2    HA   ALA  51           HA       ALA  51  -4.149   7.027 -14.390
    3    HB2  ALA  51           HB1      ALA  51  -2.176   6.721 -13.281
    4    HB1  ALA  51           HB2      ALA  51  -2.867   7.149 -11.717
    5    HB3  ALA  51           HB3      ALA  51  -2.394   8.416 -12.849

  No H/Q in entry =           5
  In of MODEL   57
    1    H    HIS  52           H        HIS  52  -5.328   7.870 -11.146
    2    HA   HIS  52           HA       HIS  52  -6.042   5.266 -10.318
    3    HB2  HIS  52           HB2      HIS  52  -5.890   7.243  -8.816
    4    HB3  HIS  52           HB3      HIS  52  -7.356   7.884  -9.558
    5    HD1  HIS  52           HD1      HIS  52  -9.590   6.592  -9.105
    6    HD2  HIS  52           HD2      HIS  52  -6.307   5.098  -7.019
    7    HE1  HIS  52           HE1      HIS  52 -10.515   5.035  -7.335
    8    HE2  HIS  52           HE2      HIS  52  -8.525   4.115  -6.054

  No H/Q in entry =           8
  In of MODEL   57
    1    H    LEU  53           H        LEU  53  -7.831   7.741 -12.113
    2    HA   LEU  53           HA       LEU  53 -10.348   6.474 -12.137
    3    HB2  LEU  53           HB2      LEU  53  -9.037   8.443 -13.998
    4    HB3  LEU  53           HB3      LEU  53 -10.640   7.792 -14.331
    5    HG   LEU  53           HG       LEU  53  -9.935   9.093 -11.682
    6   HD13  LEU  53          HD11      LEU  53  -9.601  10.810 -13.325
    7   HD12  LEU  53          HD12      LEU  53 -11.208  11.074 -12.644
    8   HD11  LEU  53          HD13      LEU  53 -11.031  10.316 -14.224
    9   HD23  LEU  53          HD21      LEU  53 -12.514   9.516 -11.847
   10   HD22  LEU  53          HD22      LEU  53 -11.951   7.911 -11.399
   11   HD21  LEU  53          HD23      LEU  53 -12.496   8.220 -13.036

  No H/Q in entry =          11
  In of MODEL   57
    1    H    VAL  54           H        VAL  54  -7.590   6.250 -14.362
    2    HA   VAL  54           HA       VAL  54  -8.822   4.491 -16.211
    3    HB   VAL  54           HB       VAL  54  -5.912   4.969 -15.515
    4   HG12  VAL  54          HG11      VAL  54  -5.665   3.881 -17.903
    5   HG11  VAL  54          HG12      VAL  54  -7.203   3.116 -17.507
    6   HG13  VAL  54          HG13      VAL  54  -5.795   2.847 -16.482
    7   HG22  VAL  54          HG21      VAL  54  -6.658   6.919 -16.563
    8   HG21  VAL  54          HG22      VAL  54  -7.855   6.068 -17.537
    9   HG23  VAL  54          HG23      VAL  54  -6.148   5.971 -17.960

  No H/Q in entry =           9
  In of MODEL   57
    1    H    GLN  55           H        GLN  55  -6.842   3.925 -13.302
    2    HA   GLN  55           HA       GLN  55  -6.779   1.107 -13.558
    3    HB2  GLN  55           HB2      GLN  55  -5.221   1.987 -12.032
    4    HB3  GLN  55           HB3      GLN  55  -6.432   2.966 -11.208
    5    HG2  GLN  55           HG2      GLN  55  -7.144   1.215  -9.893
    6    HG3  GLN  55           HG3      GLN  55  -6.925   0.026 -11.171
    7   HE21  GLN  55          HE21      GLN  55  -5.319  -1.440 -10.669
    8   HE22  GLN  55          HE22      GLN  55  -3.935  -1.102  -9.751

  No H/Q in entry =           8
  In of MODEL   57
    1    H    THR  56           H        THR  56  -9.095   3.293 -11.954
    2    HA   THR  56           HA       THR  56 -10.705   1.426 -10.672
    3    HB   THR  56           HB       THR  56 -11.762   3.829 -12.183
    4    HG1  THR  56           HG1      THR  56 -10.582   4.948 -10.885
    5   HG23  THR  56          HG21      THR  56 -13.526   3.805 -10.578
    6   HG22  THR  56          HG22      THR  56 -12.683   2.630  -9.567
    7   HG21  THR  56          HG23      THR  56 -13.349   2.137 -11.124

  No H/Q in entry =           7
  In of MODEL   57
    1    H    LYS  57           H        LYS  57 -10.880   2.511 -14.059
    2    HA   LYS  57           HA       LYS  57 -13.050   0.846 -14.823
    3    HB2  LYS  57           HB2      LYS  57 -12.150   2.787 -16.137
    4    HB3  LYS  57           HB3      LYS  57 -10.716   1.836 -16.495
    5    HG2  LYS  57           HG2      LYS  57 -12.090   0.164 -17.654
    6    HG3  LYS  57           HG3      LYS  57 -13.546   1.074 -17.272
    7    HD2  LYS  57           HD2      LYS  57 -12.698   2.990 -18.584
    8    HD3  LYS  57           HD3      LYS  57 -11.240   2.081 -18.974
    9    HE2  LYS  57           HE2      LYS  57 -12.597   0.369 -20.125
   10    HE3  LYS  57           HE3      LYS  57 -14.073   1.244 -19.723
   11    HZ3  LYS  57           HZ1      LYS  57 -13.554   1.916 -21.870
   12    HZ2  LYS  57           HZ2      LYS  57 -11.892   2.051 -21.542
   13    HZ1  LYS  57           HZ3      LYS  57 -12.983   3.190 -20.907

  No H/Q in entry =          13
  In of MODEL   57
    1    H    LEU  58           H        LEU  58  -9.550   0.379 -14.749
    2    HA   LEU  58           HA       LEU  58  -9.578  -2.138 -16.038
    3    HB2  LEU  58           HB2      LEU  58  -7.539  -0.867 -14.220
    4    HB3  LEU  58           HB3      LEU  58  -7.290  -2.391 -15.073
    5    HG   LEU  58           HG       LEU  58  -8.010   0.221 -16.440
    6   HD11  LEU  58          HD11      LEU  58  -5.380  -1.043 -15.736
    7   HD13  LEU  58          HD12      LEU  58  -5.858   0.653 -15.690
    8   HD12  LEU  58          HD13      LEU  58  -5.519  -0.122 -17.234
    9   HD22  LEU  58          HD21      LEU  58  -8.595  -1.336 -18.034
   10   HD21  LEU  58          HD22      LEU  58  -7.570  -2.594 -17.347
   11   HD23  LEU  58          HD23      LEU  58  -6.861  -1.328 -18.349

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  59           H        ILE  59 -10.406  -1.226 -12.791
    2    HA   ILE  59           HA       ILE  59 -10.088  -3.997 -11.841
    3    HB   ILE  59           HB       ILE  59  -9.628  -1.732 -10.441
    4   HG12  ILE  59          HG12      ILE  59 -11.020  -4.077  -9.128
    5   HG13  ILE  59          HG13      ILE  59  -9.372  -4.161  -9.698
    6   HG22  ILE  59          HG21      ILE  59 -12.402  -2.431  -9.517
    7   HG21  ILE  59          HG22      ILE  59 -12.158  -1.186 -10.719
    8   HG23  ILE  59          HG23      ILE  59 -11.448  -1.024  -9.116
    9   HD11  ILE  59          HD11      ILE  59  -8.799  -2.202  -8.291
   10   HD13  ILE  59          HD12      ILE  59  -9.359  -3.570  -7.338
   11   HD12  ILE  59          HD13      ILE  59 -10.441  -2.213  -7.655

  No H/Q in entry =          11
  In of MODEL   57
    1    H    GLU  60           H        GLU  60 -12.618  -1.656 -12.662
    2    HA   GLU  60           HA       GLU  60 -14.823  -3.150 -11.660
    3    HB2  GLU  60           HB2      GLU  60 -15.045  -0.790 -12.239
    4    HB3  GLU  60           HB3      GLU  60 -14.656  -1.137 -13.921
    5    HG2  GLU  60           HG2      GLU  60 -16.685  -2.563 -14.078
    6    HG3  GLU  60           HG3      GLU  60 -17.087  -2.146 -12.425

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLY  61           H        GLY  61 -13.134  -3.152 -14.766
    2    HA3  GLY  61           HA2      GLY  61 -14.865  -5.380 -15.664
    3    HA2  GLY  61           HA3      GLY  61 -14.004  -4.284 -16.738

  No H/Q in entry =           3
  In of MODEL   57
    1    H    ASP  62           H        ASP  62 -12.657  -5.743 -13.847
    2    HA   ASP  62           HA       ASP  62 -10.333  -6.644 -15.174
    3    HB2  ASP  62           HB2      ASP  62  -9.874  -7.783 -13.006
    4    HB3  ASP  62           HB3      ASP  62 -10.323  -6.093 -12.812

  No H/Q in entry =           4
  In of MODEL   57
    1    H    ALA  63           H        ALA  63 -13.350  -8.354 -14.320
    2    HA   ALA  63           HA       ALA  63 -12.271 -10.891 -15.381
    3    HB3  ALA  63           HB1      ALA  63 -13.611 -10.833 -13.247
    4    HB1  ALA  63           HB2      ALA  63 -14.314 -11.878 -14.481
    5    HB2  ALA  63           HB3      ALA  63 -14.996 -10.277 -14.187

  No H/Q in entry =           5
  In of MODEL   57
    1    H    GLY  64           H        GLY  64 -13.884 -12.141 -16.750
    2    HA3  GLY  64           HA2      GLY  64 -15.774 -11.873 -18.353
    3    HA2  GLY  64           HA3      GLY  64 -15.012 -10.359 -18.823

  No H/Q in entry =           3
  In of MODEL   57
    1    H    GLU  65           H        GLU  65 -12.301 -11.687 -18.517
    2    HA   GLU  65           HA       GLU  65 -11.990 -12.403 -21.236
    3    HB2  GLU  65           HB2      GLU  65 -10.131 -12.785 -18.888
    4    HB3  GLU  65           HB3      GLU  65  -9.680 -13.041 -20.575
    5    HG2  GLU  65           HG2      GLU  65 -10.810 -10.440 -19.506
    6    HG3  GLU  65           HG3      GLU  65  -9.086 -10.758 -19.698

  No H/Q in entry =           6
  In of MODEL   57
    1    H    GLY  66           H        GLY  66 -12.262 -14.288 -18.324
    2    HA3  GLY  66           HA2      GLY  66 -13.223 -16.606 -19.646
    3    HA2  GLY  66           HA3      GLY  66 -11.558 -16.829 -19.147

  No H/Q in entry =           3
  In of MODEL   57
    1    H    LYS  67           H        LYS  67 -11.050 -16.927 -16.961
    2    HA   LYS  67           HA       LYS  67 -13.178 -17.974 -15.312
    3    HB2  LYS  67           HB2      LYS  67 -10.189 -17.828 -14.963
    4    HB3  LYS  67           HB3      LYS  67 -11.279 -18.558 -13.778
    5    HG2  LYS  67           HG2      LYS  67 -12.156 -20.080 -15.507
    6    HG3  LYS  67           HG3      LYS  67 -11.084 -19.351 -16.701
    7    HD2  LYS  67           HD2      LYS  67  -9.124 -20.094 -15.410
    8    HD3  LYS  67           HD3      LYS  67 -10.189 -20.805 -14.195
    9    HE2  LYS  67           HE2      LYS  67 -11.147 -22.308 -15.898
   10    HE3  LYS  67           HE3      LYS  67 -10.106 -21.588 -17.126
   11    HZ3  LYS  67           HZ1      LYS  67  -8.207 -22.466 -16.137
   12    HZ2  LYS  67           HZ2      LYS  67  -9.332 -23.733 -16.037
   13    HZ1  LYS  67           HZ3      LYS  67  -8.990 -22.788 -14.667

  No H/Q in entry =          13
  In of MODEL   57
    1    H    MET  68           H        MET  68 -13.559 -17.454 -13.166
    2    HA   MET  68           HA       MET  68 -14.317 -14.923 -12.567
    3    HB2  MET  68           HB2      MET  68 -13.387 -17.088 -10.684
    4    HB3  MET  68           HB3      MET  68 -14.227 -15.628 -10.164
    5    HG2  MET  68           HG2      MET  68 -16.197 -16.207 -11.360
    6    HG3  MET  68           HG3      MET  68 -15.355 -17.438 -12.303
    7    HE3  MET  68           HE1      MET  68 -14.307 -17.178  -8.566
    8    HE2  MET  68           HE2      MET  68 -15.776 -17.702  -7.743
    9    HE1  MET  68           HE3      MET  68 -15.798 -16.236  -8.723

  No H/Q in entry =           9
  In of MODEL   57
    1    H    LYS  69           H        LYS  69 -11.060 -15.723 -12.897
    2    HA   LYS  69           HA       LYS  69  -9.989 -14.107 -10.798
    3    HB2  LYS  69           HB2      LYS  69  -8.741 -15.370 -13.236
    4    HB3  LYS  69           HB3      LYS  69  -7.812 -14.469 -12.035
    5    HG2  LYS  69           HG2      LYS  69  -8.623 -15.979 -10.262
    6    HG3  LYS  69           HG3      LYS  69  -9.569 -16.873 -11.451
    7    HD2  LYS  69           HD2      LYS  69  -7.498 -17.476 -12.651
    8    HD3  LYS  69           HD3      LYS  69  -6.549 -16.584 -11.460
    9    HE2  LYS  69           HE2      LYS  69  -7.397 -18.064  -9.673
   10    HE3  LYS  69           HE3      LYS  69  -8.342 -18.958 -10.863
   11    HZ1  LYS  69           HZ1      LYS  69  -5.916 -19.019 -11.972
   12    HZ3  LYS  69           HZ2      LYS  69  -6.518 -20.233 -10.948
   13    HZ2  LYS  69           HZ3      LYS  69  -5.495 -19.026 -10.329

  No H/Q in entry =          13
  In of MODEL   57
    1    H    VAL  70           H        VAL  70  -7.937 -12.634 -11.776
    2    HA   VAL  70           HA       VAL  70  -9.144 -10.566 -13.516
    3    HB   VAL  70           HB       VAL  70  -8.159  -8.851 -12.018
    4   HG12  VAL  70          HG11      VAL  70  -9.989 -10.749 -10.523
    5   HG11  VAL  70          HG12      VAL  70 -10.538  -9.667 -11.804
    6   HG13  VAL  70          HG13      VAL  70  -9.872  -9.002 -10.314
    7   HG21  VAL  70          HG21      VAL  70  -7.351 -11.320 -10.475
    8   HG23  VAL  70          HG22      VAL  70  -7.623  -9.796  -9.632
    9   HG22  VAL  70          HG23      VAL  70  -6.378  -9.904 -10.875

  No H/Q in entry =           9
  In of MODEL   57
    1    H    SER  71           H        SER  71  -7.497  -9.071 -14.383
    2    HA   SER  71           HA       SER  71  -5.343 -10.422 -15.624
    3    HB2  SER  71           HB2      SER  71  -6.404  -8.378 -16.553
    4    HB3  SER  71           HB3      SER  71  -5.732  -7.443 -15.220
    5    HG   SER  71           HG       SER  71  -3.650  -8.434 -15.986

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LEU  72           H        LEU  72  -3.251 -10.684 -15.048
    2    HA   LEU  72           HA       LEU  72  -2.542 -10.475 -12.333
    3    HB2  LEU  72           HB2      LEU  72  -0.880 -10.923 -14.807
    4    HB3  LEU  72           HB3      LEU  72  -0.228 -11.002 -13.174
    5    HG   LEU  72           HG       LEU  72  -2.600 -12.666 -14.078
    6   HD11  LEU  72          HD11      LEU  72   0.367 -13.205 -14.189
    7   HD13  LEU  72          HD12      LEU  72  -0.844 -13.459 -15.445
    8   HD12  LEU  72          HD13      LEU  72  -0.795 -14.525 -14.040
    9   HD22  LEU  72          HD21      LEU  72  -2.588 -12.687 -11.729
   10   HD21  LEU  72          HD22      LEU  72  -0.837 -12.582 -11.625
   11   HD23  LEU  72          HD23      LEU  72  -1.601 -14.094 -12.109

  No H/Q in entry =          11
  In of MODEL   57
    1    H    VAL  73           H        VAL  73  -1.790  -8.469 -15.111
    2    HA   VAL  73           HA       VAL  73   0.143  -6.791 -13.999
    3    HB   VAL  73           HB       VAL  73  -0.181  -5.406 -15.871
    4   HG11  VAL  73          HG11      VAL  73   0.469  -7.817 -16.329
    5   HG13  VAL  73          HG12      VAL  73  -0.238  -6.963 -17.699
    6   HG12  VAL  73          HG13      VAL  73  -1.212  -8.104 -16.774
    7   HG22  VAL  73          HG21      VAL  73  -2.492  -4.825 -15.685
    8   HG21  VAL  73          HG22      VAL  73  -2.999  -6.503 -15.856
    9   HG23  VAL  73          HG23      VAL  73  -2.333  -5.639 -17.241

  No H/Q in entry =           9
  In of MODEL   57
    1    H    LEU  74           H        LEU  74  -3.258  -6.869 -13.459
    2    HA   LEU  74           HA       LEU  74  -3.850  -4.206 -12.851
    3    HB2  LEU  74           HB2      LEU  74  -5.597  -5.851 -13.032
    4    HB3  LEU  74           HB3      LEU  74  -4.922  -6.783 -11.700
    5    HG   LEU  74           HG       LEU  74  -5.367  -4.898 -10.158
    6   HD12  LEU  74          HD11      LEU  74  -6.953  -3.110 -11.136
    7   HD11  LEU  74          HD12      LEU  74  -6.364  -3.632 -12.713
    8   HD13  LEU  74          HD13      LEU  74  -5.240  -2.964 -11.528
    9   HD21  LEU  74          HD21      LEU  74  -7.083  -6.731 -11.020
   10   HD23  LEU  74          HD22      LEU  74  -7.902  -5.301 -11.613
   11   HD22  LEU  74          HD23      LEU  74  -7.576  -5.459  -9.904

  No H/Q in entry =          11
  In of MODEL   57
    1    H    VAL  75           H        VAL  75  -2.849  -6.802 -10.683
    2    HA   VAL  75           HA       VAL  75  -2.645  -5.251  -8.339
    3    HB   VAL  75           HB       VAL  75  -1.165  -7.760  -9.117
    4   HG12  VAL  75          HG11      VAL  75  -0.750  -7.917  -6.630
    5   HG11  VAL  75          HG12      VAL  75  -1.391  -6.288  -6.466
    6   HG13  VAL  75          HG13      VAL  75   0.085  -6.558  -7.379
    7   HG23  VAL  75          HG21      VAL  75  -3.484  -7.335  -7.209
    8   HG22  VAL  75          HG22      VAL  75  -2.868  -8.868  -7.824
    9   HG21  VAL  75          HG23      VAL  75  -3.717  -7.761  -8.905

  No H/Q in entry =           9
  In of MODEL   57
    1    H    GLU  76           H        GLU  76  -0.232  -6.040 -10.862
    2    HA   GLU  76           HA       GLU  76   1.963  -4.716  -9.695
    3    HB2  GLU  76           HB2      GLU  76   2.162  -6.195 -11.674
    4    HB3  GLU  76           HB3      GLU  76   1.265  -5.030 -12.637
    5    HG2  GLU  76           HG2      GLU  76   3.611  -4.722 -13.119
    6    HG3  GLU  76           HG3      GLU  76   3.097  -3.340 -12.172

  No H/Q in entry =           6
  In of MODEL   57
    1    H    ALA  77           H        ALA  77  -0.544  -3.489 -11.897
    2    HA   ALA  77           HA       ALA  77   0.476  -0.854 -12.070
    3    HB2  ALA  77           HB1      ALA  77  -1.605  -0.277 -13.065
    4    HB3  ALA  77           HB2      ALA  77  -2.449  -1.589 -12.241
    5    HB1  ALA  77           HB3      ALA  77  -1.309  -1.950 -13.537

  No H/Q in entry =           5
  In of MODEL   57
    1    H    GLN  78           H        GLN  78  -1.821  -2.383  -9.869
    2    HA   GLN  78           HA       GLN  78  -2.610  -0.054  -8.474
    3    HB2  GLN  78           HB2      GLN  78  -3.746  -2.299  -8.393
    4    HB3  GLN  78           HB3      GLN  78  -2.420  -2.876  -7.387
    5    HG2  GLN  78           HG2      GLN  78  -2.920  -1.133  -5.724
    6    HG3  GLN  78           HG3      GLN  78  -4.250  -0.554  -6.725
    7   HE21  GLN  78          HE21      GLN  78  -4.753  -1.509  -4.083
    8   HE22  GLN  78          HE22      GLN  78  -5.620  -2.965  -4.192

  No H/Q in entry =           8
  In of MODEL   57
    1    H    LEU  79           H        LEU  79   0.042  -2.338  -8.008
    2    HA   LEU  79           HA       LEU  79   1.015  -1.450  -5.546
    3    HB2  LEU  79           HB2      LEU  79   1.869  -3.468  -6.608
    4    HB3  LEU  79           HB3      LEU  79   2.532  -2.524  -7.939
    5    HG   LEU  79           HG       LEU  79   4.092  -1.400  -6.428
    6   HD13  LEU  79          HD11      LEU  79   3.079  -1.143  -4.366
    7   HD12  LEU  79          HD12      LEU  79   4.142  -2.503  -4.016
    8   HD11  LEU  79          HD13      LEU  79   2.435  -2.785  -4.354
    9   HD23  LEU  79          HD21      LEU  79   5.276  -3.560  -5.517
   10   HD22  LEU  79          HD22      LEU  79   5.084  -3.360  -7.256
   11   HD21  LEU  79          HD23      LEU  79   3.990  -4.418  -6.368

  No H/Q in entry =          11
  In of MODEL   57
    1    H    HIS  80           H        HIS  80   1.914  -0.344  -8.815
    2    HA   HIS  80           HA       HIS  80   3.736   1.626  -7.885
    3    HB2  HIS  80           HB2      HIS  80   2.453   0.942 -10.474
    4    HB3  HIS  80           HB3      HIS  80   3.063   2.589 -10.301
    5    HD1  HIS  80           HD1      HIS  80   5.471   2.865 -10.811
    6    HD2  HIS  80           HD2      HIS  80   4.607  -1.036  -9.621
    7    HE1  HIS  80           HE1      HIS  80   7.649   1.567 -10.964
    8    HE2  HIS  80           HE2      HIS  80   7.134  -0.814 -10.242

  No H/Q in entry =           8
  In of MODEL   57
    1    H    LEU  81           H        LEU  81   0.339   1.818  -8.883
    2    HA   LEU  81           HA       LEU  81   0.089   4.613  -8.556
    3    HB2  LEU  81           HB2      LEU  81  -1.948   2.387  -8.486
    4    HB3  LEU  81           HB3      LEU  81  -2.384   4.094  -8.398
    5    HG   LEU  81           HG       LEU  81  -0.690   2.927 -10.624
    6   HD12  LEU  81          HD11      LEU  81  -2.912   3.266 -11.935
    7   HD11  LEU  81          HD12      LEU  81  -3.677   3.206 -10.348
    8   HD13  LEU  81          HD13      LEU  81  -2.743   1.829 -10.929
    9   HD23  LEU  81          HD21      LEU  81  -1.761   5.081 -11.728
   10   HD22  LEU  81          HD22      LEU  81  -0.349   5.239 -10.688
   11   HD21  LEU  81          HD23      LEU  81  -1.954   5.602 -10.056

  No H/Q in entry =          11
  In of MODEL   57
    1    H    MET  82           H        MET  82  -0.607   1.934  -6.309
    2    HA   MET  82           HA       MET  82  -1.657   3.531  -4.229
    3    HB2  MET  82           HB2      MET  82  -0.307   0.832  -4.259
    4    HB3  MET  82           HB3      MET  82  -0.887   1.563  -2.765
    5    HG2  MET  82           HG2      MET  82  -2.611   1.083  -5.215
    6    HG3  MET  82           HG3      MET  82  -2.550   0.010  -3.819
    7    HE3  MET  82           HE1      MET  82  -4.273   1.676  -1.014
    8    HE2  MET  82           HE2      MET  82  -2.540   1.939  -1.189
    9    HE1  MET  82           HE3      MET  82  -3.239   0.387  -1.646

  No H/Q in entry =           9
  In of MODEL   57
    1    H    THR  83           H        THR  83   1.638   2.416  -4.899
    2    HA   THR  83           HA       THR  83   2.853   3.511  -2.593
    3    HB   THR  83           HB       THR  83   4.955   3.436  -4.055
    4    HG1  THR  83           HG1      THR  83   4.722   2.911  -6.080
    5   HG22  THR  83          HG21      THR  83   4.490   0.782  -4.388
    6   HG21  THR  83          HG22      THR  83   3.197   1.173  -3.255
    7   HG23  THR  83          HG23      THR  83   4.877   1.503  -2.826

  No H/Q in entry =           7
  In of MODEL   57
    1    H    SER  84           H        SER  84   2.511   4.792  -5.896
    2    HA   SER  84           HA       SER  84   3.869   7.220  -5.435
    3    HB2  SER  84           HB2      SER  84   1.803   6.405  -7.465
    4    HB3  SER  84           HB3      SER  84   2.495   8.026  -7.437
    5    HG   SER  84           HG       SER  84   3.848   5.539  -7.719

  No H/Q in entry =           5
  In of MODEL   57
    1    H    MET  85           H        MET  85   0.368   6.494  -5.282
    2    HA   MET  85           HA       MET  85  -0.474   9.113  -4.687
    3    HB2  MET  85           HB2      MET  85  -2.004   7.310  -5.363
    4    HB3  MET  85           HB3      MET  85  -1.738   6.512  -3.813
    5    HG2  MET  85           HG2      MET  85  -2.634   8.468  -2.627
    6    HG3  MET  85           HG3      MET  85  -2.848   9.313  -4.159
    7    HE3  MET  85           HE1      MET  85  -3.753   5.332  -3.394
    8    HE2  MET  85           HE2      MET  85  -5.144   5.797  -2.415
    9    HE1  MET  85           HE3      MET  85  -3.544   6.411  -2.007

  No H/Q in entry =           9
  In of MODEL   57
    1    H    LEU  86           H        LEU  86   0.410   6.443  -2.537
    2    HA   LEU  86           HA       LEU  86  -0.124   7.752  -0.098
    3    HB2  LEU  86           HB2      LEU  86   0.319   5.277  -0.488
    4    HB3  LEU  86           HB3      LEU  86   2.030   5.690  -0.574
    5    HG   LEU  86           HG       LEU  86   1.704   6.856   1.692
    6   HD11  LEU  86          HD11      LEU  86  -0.995   6.115   1.206
    7   HD13  LEU  86          HD12      LEU  86  -0.329   6.856   2.660
    8   HD12  LEU  86          HD13      LEU  86  -0.436   5.101   2.541
    9   HD23  LEU  86          HD21      LEU  86   1.246   3.867   1.812
   10   HD22  LEU  86          HD22      LEU  86   2.253   4.868   2.858
   11   HD21  LEU  86          HD23      LEU  86   2.759   4.537   1.202

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ALA  87           H        ALA  87   2.864   7.428  -1.971
    2    HA   ALA  87           HA       ALA  87   4.574   8.822  -0.237
    3    HB3  ALA  87           HB1      ALA  87   4.674   7.807  -2.944
    4    HB2  ALA  87           HB2      ALA  87   6.005   8.125  -1.836
    5    HB1  ALA  87           HB3      ALA  87   5.409   9.411  -2.884

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ARG  88           H        ARG  88   2.653   9.977  -2.969
    2    HA   ARG  88           HA       ARG  88   3.455  12.658  -2.848
    3    HB2  ARG  88           HB2      ARG  88   2.198  11.518  -4.712
    4    HB3  ARG  88           HB3      ARG  88   0.738  11.677  -3.737
    5    HG2  ARG  88           HG2      ARG  88   1.784  14.247  -3.649
    6    HG3  ARG  88           HG3      ARG  88   2.211  13.728  -5.277
    7    HD2  ARG  88           HD2      ARG  88   0.074  13.830  -5.986
    8    HD3  ARG  88           HD3      ARG  88  -0.529  12.984  -4.560
    9    HE   ARG  88           HE       ARG  88  -0.687  15.763  -4.980
   10   HH21  ARG  88          HH11      ARG  88  -1.209  17.099  -3.245
   11   HH22  ARG  88          HH12      ARG  88  -0.927  16.559  -1.626
   12   HH11  ARG  88          HH21      ARG  88   0.292  13.491  -2.600
   13   HH12  ARG  88          HH22      ARG  88  -0.095  14.510  -1.261

  No H/Q in entry =          13
  In of MODEL   57
    1    H    GLU  89           H        GLU  89   0.724  11.014  -1.222
    2    HA   GLU  89           HA       GLU  89  -0.364  13.338  -0.023
    3    HB2  GLU  89           HB2      GLU  89  -1.506  11.111  -0.116
    4    HB3  GLU  89           HB3      GLU  89  -0.395  10.543   1.131
    5    HG2  GLU  89           HG2      GLU  89  -1.204  12.251   2.686
    6    HG3  GLU  89           HG3      GLU  89  -2.242  12.934   1.437

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LEU  90           H        LEU  90   2.055  11.018   1.164
    2    HA   LEU  90           HA       LEU  90   2.412  12.259   3.695
    3    HB2  LEU  90           HB2      LEU  90   4.174  10.464   2.027
    4    HB3  LEU  90           HB3      LEU  90   4.590  10.976   3.668
    5    HG   LEU  90           HG       LEU  90   1.944   9.661   2.993
    6   HD12  LEU  90          HD11      LEU  90   3.055   7.602   4.007
    7   HD11  LEU  90          HD12      LEU  90   4.588   8.440   3.773
    8   HD13  LEU  90          HD13      LEU  90   3.578   8.045   2.381
    9   HD22  LEU  90          HD21      LEU  90   1.679  10.587   5.114
   10   HD21  LEU  90          HD22      LEU  90   3.393  10.460   5.505
   11   HD23  LEU  90          HD23      LEU  90   2.370   9.025   5.548

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  91           H        ILE  91   4.036  12.622   0.576
    2    HA   ILE  91           HA       ILE  91   6.030  14.430   1.426
    3    HB   ILE  91           HB       ILE  91   4.727  13.955  -1.261
    4   HG12  ILE  91          HG12      ILE  91   7.548  13.434  -0.272
    5   HG13  ILE  91          HG13      ILE  91   6.251  12.252  -0.116
    6   HG22  ILE  91          HG21      ILE  91   6.969  15.275  -1.938
    7   HG21  ILE  91          HG22      ILE  91   6.661  16.080  -0.398
    8   HG23  ILE  91          HG23      ILE  91   5.445  16.123  -1.673
    9   HD13  ILE  91          HD11      ILE  91   6.086  11.930  -2.424
   10   HD12  ILE  91          HD12      ILE  91   7.822  12.152  -2.202
   11   HD11  ILE  91          HD13      ILE  91   6.831  13.487  -2.793

  No H/Q in entry =          11
  In of MODEL   57
    1    H    THR  92           H        THR  92   2.679  14.903   0.401
    2    HA   THR  92           HA       THR  92   2.688  17.727   0.340
    3    HB   THR  92           HB       THR  92   0.492  15.759   1.029
    4    HG1  THR  92           HG1      THR  92   0.805  15.576  -1.055
    5   HG22  THR  92          HG21      THR  92  -0.878  17.938   0.300
    6   HG21  THR  92          HG22      THR  92   0.521  18.746   1.004
    7   HG23  THR  92          HG23      THR  92  -0.439  17.636   1.980

  No H/Q in entry =           7
  In of MODEL   57
    1    H    GLU  93           H        GLU  93   2.098  15.433   2.991
    2    HA   GLU  93           HA       GLU  93   1.579  17.344   5.007
    3    HB2  GLU  93           HB2      GLU  93   2.857  14.603   5.250
    4    HB3  GLU  93           HB3      GLU  93   2.171  15.538   6.579
    5    HG2  GLU  93           HG2      GLU  93   0.562  14.781   4.132
    6    HG3  GLU  93           HG3      GLU  93   0.643  13.757   5.561

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LEU  94           H        LEU  94   4.573  15.824   3.873
    2    HA   LEU  94           HA       LEU  94   6.328  16.950   5.770
    3    HB2  LEU  94           HB2      LEU  94   6.732  15.978   2.941
    4    HB3  LEU  94           HB3      LEU  94   8.065  16.619   3.897
    5    HG   LEU  94           HG       LEU  94   6.292  14.445   5.023
    6   HD11  LEU  94          HD11      LEU  94   8.395  14.193   2.902
    7   HD13  LEU  94          HD12      LEU  94   6.936  13.237   3.156
    8   HD12  LEU  94          HD13      LEU  94   8.353  12.966   4.171
    9   HD23  LEU  94          HD21      LEU  94   8.469  13.881   6.187
   10   HD22  LEU  94          HD22      LEU  94   7.820  15.467   6.600
   11   HD21  LEU  94          HD23      LEU  94   9.162  15.330   5.464

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  95           H        ILE  95   5.219  18.136   2.614
    2    HA   ILE  95           HA       ILE  95   6.821  20.473   2.563
    3    HB   ILE  95           HB       ILE  95   4.175  19.823   1.244
    4   HG12  ILE  95          HG12      ILE  95   6.974  20.125   0.121
    5   HG13  ILE  95          HG13      ILE  95   6.303  18.580   0.633
    6   HG21  ILE  95          HG21      ILE  95   5.957  22.268   1.033
    7   HG23  ILE  95          HG22      ILE  95   4.229  22.222   1.380
    8   HG22  ILE  95          HG23      ILE  95   4.815  21.814  -0.233
    9   HD13  ILE  95          HD11      ILE  95   4.751  18.524  -1.105
   10   HD12  ILE  95          HD12      ILE  95   6.114  19.325  -1.886
   11   HD11  ILE  95          HD13      ILE  95   4.750  20.277  -1.300

  No H/Q in entry =          11
  In of MODEL   57
    1    H    GLU  96           H        GLU  96   3.558  19.862   3.841
    2    HA   GLU  96           HA       GLU  96   2.967  22.517   4.590
    3    HB2  GLU  96           HB2      GLU  96   1.270  20.755   4.593
    4    HB3  GLU  96           HB3      GLU  96   2.115  19.917   5.892
    5    HG2  GLU  96           HG2      GLU  96   1.102  21.213   7.457
    6    HG3  GLU  96           HG3      GLU  96   1.661  22.680   6.663

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LEU  97           H        LEU  97   4.769  19.943   6.224
    2    HA   LEU  97           HA       LEU  97   5.131  21.286   8.697
    3    HB2  LEU  97           HB2      LEU  97   6.647  19.098   7.290
    4    HB3  LEU  97           HB3      LEU  97   7.238  19.775   8.805
    5    HG   LEU  97           HG       LEU  97   4.417  18.718   8.480
    6   HD12  LEU  97          HD11      LEU  97   5.324  16.694   9.697
    7   HD11  LEU  97          HD12      LEU  97   6.945  17.304   9.362
    8   HD13  LEU  97          HD13      LEU  97   5.876  16.860   8.030
    9   HD23  LEU  97          HD21      LEU  97   4.852  18.418  11.047
   10   HD22  LEU  97          HD22      LEU  97   4.496  20.034  10.440
   11   HD21  LEU  97          HD23      LEU  97   6.160  19.573  10.794

  No H/Q in entry =          11
  In of MODEL   57
    1    H    HIS  98           H        HIS  98   7.017  21.278   5.681
    2    HA   HIS  98           HA       HIS  98   9.187  22.830   6.591
    3    HB2  HIS  98           HB2      HIS  98   7.904  22.591   3.859
    4    HB3  HIS  98           HB3      HIS  98   9.355  23.551   4.157
    5    HD1  HIS  98           HD1      HIS  98   8.097  19.997   4.170
    6    HD2  HIS  98           HD2      HIS  98  11.703  22.046   4.613
    7    HE1  HIS  98           HE1      HIS  98   9.929  18.243   4.122
    8    HE2  HIS  98           HE2      HIS  98  12.129  19.470   4.393

  No H/Q in entry =           8
  In of MODEL   57
    1    H    GLU  99           H        GLU  99   5.983  23.707   5.399
    2    HA   GLU  99           HA       GLU  99   6.400  26.517   5.344
    3    HB2  GLU  99           HB2      GLU  99   4.511  25.373   4.203
    4    HB3  GLU  99           HB3      GLU  99   3.802  25.020   5.779
    5    HG2  GLU  99           HG2      GLU  99   3.651  27.414   6.279
    6    HG3  GLU  99           HG3      GLU  99   4.440  27.804   4.754

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LYS 100           H        LYS 100   5.226  24.296   7.859
    2    HA   LYS 100           HA       LYS 100   4.658  26.358   9.750
    3    HB2  LYS 100           HB2      LYS 100   5.191  23.399  10.099
    4    HB3  LYS 100           HB3      LYS 100   4.752  24.478  11.429
    5    HG2  LYS 100           HG2      LYS 100   2.701  25.143  10.170
    6    HG3  LYS 100           HG3      LYS 100   3.119  23.969   8.920
    7    HD2  LYS 100           HD2      LYS 100   3.008  22.149  10.581
    8    HD3  LYS 100           HD3      LYS 100   2.607  23.317  11.842
    9    HE2  LYS 100           HE2      LYS 100   0.569  23.966  10.569
   10    HE3  LYS 100           HE3      LYS 100   0.959  22.741   9.355
   11    HZ1  LYS 100           HZ1      LYS 100   0.669  22.078  12.234
   12    HZ3  LYS 100           HZ2      LYS 100   0.646  21.024  10.899
   13    HZ2  LYS 100           HZ3      LYS 100  -0.656  22.081  11.172

  No H/Q in entry =          13
  In of MODEL   57
    1    H    LEU 101           H        LEU 101   7.561  24.523   8.931
    2    HA   LEU 101           HA       LEU 101   9.159  25.341  11.144
    3    HB2  LEU 101           HB2      LEU 101   9.754  24.346   8.368
    4    HB3  LEU 101           HB3      LEU 101  11.060  24.994   9.357
    5    HG   LEU 101           HG       LEU 101   9.194  22.863  10.410
    6   HD12  LEU 101          HD11      LEU 101  11.230  21.340   9.813
    7   HD11  LEU 101          HD12      LEU 101  11.620  22.598   8.642
    8   HD13  LEU 101          HD13      LEU 101  10.080  21.746   8.540
    9   HD21  LEU 101          HD21      LEU 101  11.929  23.933  11.152
   10   HD23  LEU 101          HD22      LEU 101  11.361  22.368  11.729
   11   HD22  LEU 101          HD23      LEU 101  10.487  23.837  12.163

  No H/Q in entry =          11
  In of MODEL   57
    1    H    LYS 102           H        LYS 102   7.613  27.227   8.995
    2    HA   LYS 102           HA       LYS 102   7.724  29.518   8.704
    3    HB2  LYS 102           HB2      LYS 102   9.275  29.381  10.810
    4    HB3  LYS 102           HB3      LYS 102  10.584  29.557   9.657
    5    HG2  LYS 102           HG2      LYS 102   8.501  31.539  10.509
    6    HG3  LYS 102           HG3      LYS 102  10.218  31.776  10.266
    7    HD2  LYS 102           HD2      LYS 102   8.273  31.380   7.956
    8    HD3  LYS 102           HD3      LYS 102   8.675  32.954   8.627
    9    HE2  LYS 102           HE2      LYS 102  10.042  31.751   6.560
   10    HE3  LYS 102           HE3      LYS 102  10.671  33.048   7.575
   11    HZ2  LYS 102           HZ1      LYS 102  12.166  31.123   7.407
   12    HZ1  LYS 102           HZ2      LYS 102  10.986  30.157   8.143
   13    HZ3  LYS 102           HZ3      LYS 102  11.692  31.434   9.006

  No H/Q in entry =          13
  In of MODEL   57
    1    H    ALA 103           H        ALA 103  10.964  28.134   8.156
    2    HA   ALA 103           HA       ALA 103  11.958  29.497   6.085
    3    HB2  ALA 103           HB1      ALA 103  12.817  27.271   5.162
    4    HB1  ALA 103           HB2      ALA 103  11.904  26.509   6.463
    5    HB3  ALA 103           HB3      ALA 103  13.208  27.635   6.843

  No H/Q in entry =           5
  In of MODEL   57
    1    H1   LYS   3           H1       LYS   3 -31.809   5.619 -19.712
    2    H2   LYS   3           H3       LYS   3 -30.806   5.393 -21.062
    3    H3   LYS   3           H2       LYS   3 -32.143   4.376 -20.818
    4    HA   LYS   3           HA       LYS   3 -31.062   3.044 -19.418
    5    HB2  LYS   3           HB2      LYS   3 -28.866   4.590 -20.746
    6    HB3  LYS   3           HB3      LYS   3 -28.472   3.400 -19.506
    7    HG2  LYS   3           HG2      LYS   3 -29.799   1.738 -20.861
    8    HG3  LYS   3           HG3      LYS   3 -29.823   2.942 -22.149
    9    HD2  LYS   3           HD2      LYS   3 -27.339   2.973 -22.098
   10    HD3  LYS   3           HD3      LYS   3 -27.381   1.666 -20.915
   11    HE2  LYS   3           HE2      LYS   3 -28.809   0.411 -22.636
   12    HE3  LYS   3           HE3      LYS   3 -28.258   1.626 -23.788
   13    HZ3  LYS   3           HZ1      LYS   3 -26.391   0.506 -24.060
   14    HZ2  LYS   3           HZ2      LYS   3 -26.952  -0.700 -23.004
   15    HZ1  LYS   3           HZ3      LYS   3 -26.037   0.597 -22.402

  No H/Q in entry =          15
  In of MODEL   57
    1    H    LYS   4           H        LYS   4 -31.106   2.893 -17.358
    2    HA   LYS   4           HA       LYS   4 -30.509   5.213 -15.700
    3    HB2  LYS   4           HB2      LYS   4 -31.554   2.453 -15.009
    4    HB3  LYS   4           HB3      LYS   4 -31.410   3.799 -13.879
    5    HG2  LYS   4           HG2      LYS   4 -33.211   3.640 -16.301
    6    HG3  LYS   4           HG3      LYS   4 -33.703   3.657 -14.608
    7    HD2  LYS   4           HD2      LYS   4 -33.137   5.915 -14.335
    8    HD3  LYS   4           HD3      LYS   4 -32.095   5.921 -15.759
    9    HE2  LYS   4           HE2      LYS   4 -34.096   7.183 -16.217
   10    HE3  LYS   4           HE3      LYS   4 -34.092   5.712 -17.189
   11    HZ3  LYS   4           HZ1      LYS   4 -35.613   4.706 -15.646
   12    HZ2  LYS   4           HZ2      LYS   4 -36.253   6.169 -16.225
   13    HZ1  LYS   4           HZ3      LYS   4 -35.591   6.091 -14.663

  No H/Q in entry =          13
  In of MODEL   57
    1    H    HIS   5           H        HIS   5 -29.048   5.376 -14.108
    2    HA   HIS   5           HA       HIS   5 -26.666   3.680 -14.444
    3    HB2  HIS   5           HB2      HIS   5 -27.075   6.413 -13.230
    4    HB3  HIS   5           HB3      HIS   5 -25.543   5.543 -13.215
    5    HD1  HIS   5           HD1      HIS   5 -24.142   6.827 -14.801
    6    HD2  HIS   5           HD2      HIS   5 -27.903   5.999 -16.358
    7    HE1  HIS   5           HE1      HIS   5 -24.007   7.424 -17.250
    8    HE2  HIS   5           HE2      HIS   5 -26.299   6.907 -18.168

  No H/Q in entry =           8
  In of MODEL   57
    1    H    ILE   6           H        ILE   6 -26.350   2.119 -13.133
    2    HA   ILE   6           HA       ILE   6 -27.338   2.324 -10.368
    3    HB   ILE   6           HB       ILE   6 -26.377  -0.089 -11.912
    4   HG12  ILE   6          HG12      ILE   6 -29.168   0.691 -11.059
    5   HG13  ILE   6          HG13      ILE   6 -28.536   0.893 -12.693
    6   HG23  ILE   6          HG21      ILE   6 -26.681  -1.366 -10.056
    7   HG22  ILE   6          HG22      ILE   6 -27.900  -0.288  -9.373
    8   HG21  ILE   6          HG23      ILE   6 -26.191   0.143  -9.283
    9   HD13  ILE   6          HD11      ILE   6 -28.877  -1.246 -13.199
   10   HD12  ILE   6          HD12      ILE   6 -29.892  -1.291 -11.758
   11   HD11  ILE   6          HD13      ILE   6 -28.207  -1.805 -11.666

  No H/Q in entry =          11
  In of MODEL   57
    1    H    TYR   7           H        TYR   7 -25.617   3.057  -9.079
    2    HA   TYR   7           HA       TYR   7 -22.857   2.253  -9.761
    3    HB2  TYR   7           HB2      TYR   7 -23.954   4.626  -8.273
    4    HB3  TYR   7           HB3      TYR   7 -22.243   4.204  -8.313
    5    HD1  TYR   7           HD1      TYR   7 -23.229   3.216 -11.406
    6    HD2  TYR   7           HD2      TYR   7 -22.757   6.813  -9.168
    7    HE1  TYR   7           HE1      TYR   7 -22.866   4.473 -13.494
    8    HE2  TYR   7           HE2      TYR   7 -22.436   8.073 -11.248
    9    HH   TYR   7           HH       TYR   7 -22.649   7.982 -13.480

  No H/Q in entry =           9
  In of MODEL   57
    1    H    LEU   8           H        LEU   8 -21.819   0.952  -8.436
    2    HA   LEU   8           HA       LEU   8 -22.920   0.389  -5.754
    3    HB2  LEU   8           HB2      LEU   8 -21.129  -1.174  -7.593
    4    HB3  LEU   8           HB3      LEU   8 -21.293  -1.571  -5.882
    5    HG   LEU   8           HG       LEU   8 -23.760  -1.878  -6.305
    6   HD13  LEU   8          HD11      LEU   8 -23.957  -0.664  -8.411
    7   HD12  LEU   8          HD12      LEU   8 -24.395  -2.354  -8.657
    8   HD11  LEU   8          HD13      LEU   8 -22.817  -1.766  -9.179
    9   HD23  LEU   8          HD21      LEU   8 -22.375  -3.841  -8.004
   10   HD22  LEU   8          HD22      LEU   8 -23.452  -4.072  -6.628
   11   HD21  LEU   8          HD23      LEU   8 -21.767  -3.626  -6.364

  No H/Q in entry =          11
  In of MODEL   57
    1    H    PHE   9           H        PHE   9 -21.677   0.861  -3.962
    2    HA   PHE   9           HA       PHE   9 -18.941   1.935  -4.469
    3    HB2  PHE   9           HB2      PHE   9 -21.008   2.910  -2.500
    4    HB3  PHE   9           HB3      PHE   9 -19.328   3.428  -2.510
    5    HD1  PHE   9           HD1      PHE   9 -18.446   4.830  -4.284
    6    HD2  PHE   9           HD2      PHE   9 -22.548   3.570  -4.305
    7    HE1  PHE   9           HE1      PHE   9 -18.946   6.484  -6.060
    8    HE2  PHE   9           HE2      PHE   9 -23.049   5.236  -6.075
    9    HZ   PHE   9           HZ       PHE   9 -21.245   6.688  -6.959

  No H/Q in entry =           9
  In of MODEL   57
    1    H    SER  10           H        SER  10 -17.295   1.118  -3.300
    2    HA   SER  10           HA       SER  10 -17.483   0.218  -0.619
    3    HB2  SER  10           HB2      SER  10 -17.149  -2.161  -0.933
    4    HB3  SER  10           HB3      SER  10 -18.630  -1.679  -1.746
    5    HG   SER  10           HG       SER  10 -16.155  -1.721  -3.085

  No H/Q in entry =           5
  In of MODEL   57
    1    H    SER  11           H        SER  11 -15.468   0.383   0.232
    2    HA   SER  11           HA       SER  11 -13.309   1.311  -1.315
    3    HB2  SER  11           HB2      SER  11 -13.833   1.429   1.269
    4    HB3  SER  11           HB3      SER  11 -12.797   0.002   1.305
    5    HG   SER  11           HG       SER  11 -11.546   1.871   1.508

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ALA  12           H        ALA  12 -14.403  -1.426  -2.076
    2    HA   ALA  12           HA       ALA  12 -11.784  -2.609  -2.551
    3    HB3  ALA  12           HB1      ALA  12 -12.496  -3.682  -0.453
    4    HB2  ALA  12           HB2      ALA  12 -12.437  -4.841  -1.780
    5    HB1  ALA  12           HB3      ALA  12 -13.990  -4.210  -1.235

  No H/Q in entry =           5
  In of MODEL   57
    1    H    GLY  13           H        GLY  13 -12.700  -1.578  -4.586
    2    HA3  GLY  13           HA2      GLY  13 -14.860  -2.557  -6.044
    3    HA2  GLY  13           HA3      GLY  13 -13.397  -1.873  -6.766

  No H/Q in entry =           3
  In of MODEL   57
    1    H    MET  14           H        MET  14 -11.777  -4.080  -5.497
    2    HA   MET  14           HA       MET  14 -11.619  -5.787  -7.704
    3    HB2  MET  14           HB2      MET  14  -9.797  -5.655  -6.057
    4    HB3  MET  14           HB3      MET  14 -10.786  -6.506  -4.871
    5    HG2  MET  14           HG2      MET  14  -9.274  -8.094  -5.930
    6    HG3  MET  14           HG3      MET  14 -10.914  -8.443  -6.480
    7    HE2  MET  14           HE1      MET  14  -7.631  -8.691  -7.582
    8    HE1  MET  14           HE2      MET  14  -7.458  -6.972  -7.235
    9    HE3  MET  14           HE3      MET  14  -7.285  -7.550  -8.891

  No H/Q in entry =           9
  In of MODEL   57
    1    H    SER  15           H        SER  15 -13.344  -6.396  -4.664
    2    HA   SER  15           HA       SER  15 -14.367  -8.929  -5.722
    3    HB2  SER  15           HB2      SER  15 -14.724  -7.570  -3.055
    4    HB3  SER  15           HB3      SER  15 -15.757  -8.909  -3.551
    5    HG   SER  15           HG       SER  15 -13.284  -9.606  -4.137

  No H/Q in entry =           5
  In of MODEL   57
    1    H    THR  16           H        THR  16 -15.574  -5.642  -5.121
    2    HA   THR  16           HA       THR  16 -18.355  -6.186  -5.649
    3    HB   THR  16           HB       THR  16 -16.871  -3.588  -6.164
    4    HG1  THR  16           HG1      THR  16 -17.991  -3.539  -3.804
    5   HG23  THR  16          HG21      THR  16 -19.016  -2.579  -5.666
    6   HG22  THR  16          HG22      THR  16 -19.701  -4.153  -5.228
    7   HG21  THR  16          HG23      THR  16 -19.252  -3.806  -6.903

  No H/Q in entry =           7
  In of MODEL   57
    1    H    SER  17           H        SER  17 -15.543  -5.466  -7.498
    2    HA   SER  17           HA       SER  17 -16.708  -4.782  -9.999
    3    HB2  SER  17           HB2      SER  17 -14.010  -5.960  -9.299
    4    HB3  SER  17           HB3      SER  17 -14.474  -5.536 -10.948
    5    HG   SER  17           HG       SER  17 -13.535  -3.738 -10.245

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LEU  18           H        LEU  18 -15.966  -7.895  -8.558
    2    HA   LEU  18           HA       LEU  18 -16.465  -9.419 -10.918
    3    HB2  LEU  18           HB2      LEU  18 -15.196 -10.310  -9.010
    4    HB3  LEU  18           HB3      LEU  18 -16.641 -10.208  -8.005
    5    HG   LEU  18           HG       LEU  18 -17.764 -11.852  -9.411
    6   HD13  LEU  18          HD11      LEU  18 -16.962 -11.587 -11.578
    7   HD12  LEU  18          HD12      LEU  18 -16.131 -13.057 -11.071
    8   HD11  LEU  18          HD13      LEU  18 -15.281 -11.513 -11.054
    9   HD22  LEU  18          HD21      LEU  18 -16.411 -13.784  -8.841
   10   HD21  LEU  18          HD22      LEU  18 -16.463 -12.613  -7.522
   11   HD23  LEU  18          HD23      LEU  18 -15.029 -12.731  -8.540

  No H/Q in entry =          11
  In of MODEL   57
    1    H    LEU  19           H        LEU  19 -18.501  -8.330  -8.206
    2    HA   LEU  19           HA       LEU  19 -20.893  -9.647  -9.045
    3    HB2  LEU  19           HB2      LEU  19 -20.684  -8.811  -6.792
    4    HB3  LEU  19           HB3      LEU  19 -20.473  -7.165  -7.387
    5    HG   LEU  19           HG       LEU  19 -22.812  -7.141  -8.131
    6   HD11  LEU  19          HD11      LEU  19 -22.924  -9.867  -6.828
    7   HD13  LEU  19          HD12      LEU  19 -23.130  -9.525  -8.545
    8   HD12  LEU  19          HD13      LEU  19 -24.321  -8.945  -7.383
    9   HD23  LEU  19          HD21      LEU  19 -22.699  -7.995  -5.259
   10   HD22  LEU  19          HD22      LEU  19 -23.716  -6.765  -6.009
   11   HD21  LEU  19          HD23      LEU  19 -21.987  -6.481  -5.816

  No H/Q in entry =          11
  In of MODEL   57
    1    H    VAL  20           H        VAL  20 -19.577  -6.405  -9.730
    2    HA   VAL  20           HA       VAL  20 -21.742  -5.480 -11.299
    3    HB   VAL  20           HB       VAL  20 -18.790  -4.722 -11.432
    4   HG13  VAL  20          HG11      VAL  20 -19.778  -4.188 -13.582
    5   HG12  VAL  20          HG12      VAL  20 -19.589  -2.696 -12.664
    6   HG11  VAL  20          HG13      VAL  20 -21.175  -3.452 -12.800
    7   HG21  VAL  20          HG21      VAL  20 -21.185  -3.578 -10.046
    8   HG23  VAL  20          HG22      VAL  20 -19.762  -2.598 -10.394
    9   HG22  VAL  20          HG23      VAL  20 -19.618  -4.026  -9.369

  No H/Q in entry =           9
  In of MODEL   57
    1    H    SER  21           H        SER  21 -18.872  -7.370 -12.328
    2    HA   SER  21           HA       SER  21 -19.658  -7.295 -15.079
    3    HB2  SER  21           HB2      SER  21 -18.112  -9.174 -15.418
    4    HB3  SER  21           HB3      SER  21 -17.357  -7.890 -14.476
    5    HG   SER  21           HG       SER  21 -18.507 -10.265 -13.465

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LYS  22           H        LYS  22 -20.603  -9.543 -12.515
    2    HA   LYS  22           HA       LYS  22 -22.046 -11.242 -14.343
    3    HB2  LYS  22           HB2      LYS  22 -21.228 -11.763 -11.921
    4    HB3  LYS  22           HB3      LYS  22 -22.743 -11.001 -11.441
    5    HG2  LYS  22           HG2      LYS  22 -24.003 -12.747 -12.128
    6    HG3  LYS  22           HG3      LYS  22 -22.948 -13.113 -13.492
    7    HD2  LYS  22           HD2      LYS  22 -21.328 -14.144 -11.971
    8    HD3  LYS  22           HD3      LYS  22 -22.375 -13.770 -10.601
    9    HE2  LYS  22           HE2      LYS  22 -24.129 -15.214 -11.561
   10    HE3  LYS  22           HE3      LYS  22 -23.064 -15.600 -12.913
   11    HZ3  LYS  22           HZ1      LYS  22 -22.947 -17.377 -11.400
   12    HZ2  LYS  22           HZ2      LYS  22 -22.720 -16.346 -10.069
   13    HZ1  LYS  22           HZ3      LYS  22 -21.493 -16.518 -11.230

  No H/Q in entry =          13
  In of MODEL   57
    1    H    MET  23           H        MET  23 -22.932  -8.369 -12.468
    2    HA   MET  23           HA       MET  23 -25.730  -8.600 -12.978
    3    HB2  MET  23           HB2      MET  23 -24.013  -6.196 -12.396
    4    HB3  MET  23           HB3      MET  23 -25.766  -6.123 -12.576
    5    HG2  MET  23           HG2      MET  23 -26.087  -7.451 -10.611
    6    HG3  MET  23           HG3      MET  23 -24.357  -7.769 -10.484
    7    HE2  MET  23           HE1      MET  23 -26.852  -4.252  -9.289
    8    HE1  MET  23           HE2      MET  23 -27.053  -5.228 -10.741
    9    HE3  MET  23           HE3      MET  23 -26.096  -3.746 -10.800

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ARG  24           H        ARG  24 -23.057  -7.019 -14.754
    2    HA   ARG  24           HA       ARG  24 -24.620  -5.796 -16.752
    3    HB2  ARG  24           HB2      ARG  24 -21.747  -6.778 -16.792
    4    HB3  ARG  24           HB3      ARG  24 -22.468  -5.900 -18.118
    5    HG2  ARG  24           HG2      ARG  24 -22.461  -4.672 -15.347
    6    HG3  ARG  24           HG3      ARG  24 -21.026  -4.566 -16.401
    7    HD2  ARG  24           HD2      ARG  24 -23.869  -3.715 -17.130
    8    HD3  ARG  24           HD3      ARG  24 -22.532  -2.640 -16.741
    9    HE   ARG  24           HE       ARG  24 -21.506  -3.927 -18.810
   10   HH21  ARG  24          HH11      ARG  24 -21.136  -2.342 -20.360
   11   HH22  ARG  24          HH12      ARG  24 -22.455  -1.391 -20.947
   12   HH11  ARG  24          HH21      ARG  24 -24.617  -2.648 -18.443
   13   HH12  ARG  24          HH22      ARG  24 -24.514  -1.586 -19.812

  No H/Q in entry =          13
  In of MODEL   57
    1    H    ALA  25           H        ALA  25 -23.321  -9.069 -16.484
    2    HA   ALA  25           HA       ALA  25 -23.900  -9.925 -19.125
    3    HB1  ALA  25           HB1      ALA  25 -23.097 -11.919 -18.435
    4    HB3  ALA  25           HB2      ALA  25 -24.156 -11.960 -17.026
    5    HB2  ALA  25           HB3      ALA  25 -22.648 -11.051 -16.968

  No H/Q in entry =           5
  In of MODEL   57
    1    H    GLN  26           H        GLN  26 -25.727 -10.070 -16.104
    2    HA   GLN  26           HA       GLN  26 -28.002 -11.394 -17.129
    3    HB2  GLN  26           HB2      GLN  26 -27.585  -9.629 -14.735
    4    HB3  GLN  26           HB3      GLN  26 -29.108 -10.434 -15.090
    5    HG2  GLN  26           HG2      GLN  26 -26.448 -11.752 -14.623
    6    HG3  GLN  26           HG3      GLN  26 -27.814 -11.726 -13.515
    7   HE21  GLN  26          HE21      GLN  26 -26.481 -13.818 -14.797
    8   HE22  GLN  26          HE22      GLN  26 -27.466 -14.917 -15.598

  No H/Q in entry =           8
  In of MODEL   57
    1    H    ALA  27           H        ALA  27 -27.250  -7.952 -16.723
    2    HA   ALA  27           HA       ALA  27 -29.792  -6.990 -17.507
    3    HB1  ALA  27           HB1      ALA  27 -28.056  -5.586 -16.384
    4    HB3  ALA  27           HB2      ALA  27 -28.684  -4.846 -17.858
    5    HB2  ALA  27           HB3      ALA  27 -27.104  -5.630 -17.870

  No H/Q in entry =           5
  In of MODEL   57
    1    H    GLU  28           H        GLU  28 -27.028  -8.061 -19.377
    2    HA   GLU  28           HA       GLU  28 -28.012  -7.062 -21.893
    3    HB2  GLU  28           HB2      GLU  28 -25.602  -7.621 -21.268
    4    HB3  GLU  28           HB3      GLU  28 -26.058  -9.310 -21.478
    5    HG2  GLU  28           HG2      GLU  28 -24.952  -8.466 -23.441
    6    HG3  GLU  28           HG3      GLU  28 -26.629  -8.877 -23.794

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LYS  29           H        LYS  29 -28.017 -10.179 -20.250
    2    HA   LYS  29           HA       LYS  29 -29.238 -11.707 -22.263
    3    HB2  LYS  29           HB2      LYS  29 -28.140 -12.642 -20.262
    4    HB3  LYS  29           HB3      LYS  29 -29.449 -12.008 -19.265
    5    HG2  LYS  29           HG2      LYS  29 -31.033 -13.462 -20.341
    6    HG3  LYS  29           HG3      LYS  29 -29.801 -14.028 -21.467
    7    HD2  LYS  29           HD2      LYS  29 -28.601 -15.140 -19.737
    8    HD3  LYS  29           HD3      LYS  29 -29.553 -14.354 -18.479
    9    HE2  LYS  29           HE2      LYS  29 -30.179 -16.737 -18.853
   10    HE3  LYS  29           HE3      LYS  29 -31.518 -15.613 -19.094
   11    HZ1  LYS  29           HZ1      LYS  29 -30.944 -15.706 -21.520
   12    HZ3  LYS  29           HZ2      LYS  29 -31.591 -17.132 -20.863
   13    HZ2  LYS  29           HZ3      LYS  29 -29.924 -17.014 -21.158

  No H/Q in entry =          13
  In of MODEL   57
    1    H    TYR  30           H        TYR  30 -30.742  -9.690 -19.751
    2    HA   TYR  30           HA       TYR  30 -33.376 -10.273 -21.000
    3    HB2  TYR  30           HB2      TYR  30 -32.789  -9.099 -18.272
    4    HB3  TYR  30           HB3      TYR  30 -34.389  -9.439 -18.929
    5    HD1  TYR  30           HD1      TYR  30 -35.176 -11.775 -19.154
    6    HD2  TYR  30           HD2      TYR  30 -31.388 -10.859 -17.441
    7    HE1  TYR  30           HE1      TYR  30 -34.965 -14.098 -18.368
    8    HE2  TYR  30           HE2      TYR  30 -31.178 -13.168 -16.659
    9    HH   TYR  30           HH       TYR  30 -32.689 -15.608 -17.766

  No H/Q in entry =           9
  In of MODEL   57
    1    H    GLU  31           H        GLU  31 -31.318  -8.167 -21.787
    2    HA   GLU  31           HA       GLU  31 -31.357  -6.005 -22.600
    3    HB2  GLU  31           HB2      GLU  31 -34.210  -6.871 -23.121
    4    HB3  GLU  31           HB3      GLU  31 -33.442  -5.457 -23.842
    5    HG2  GLU  31           HG2      GLU  31 -31.893  -6.808 -25.038
    6    HG3  GLU  31           HG3      GLU  31 -32.383  -8.255 -24.157

  No H/Q in entry =           6
  In of MODEL   57
    1    H    VAL  32           H        VAL  32 -31.565  -5.926 -19.868
    2    HA   VAL  32           HA       VAL  32 -33.539  -3.920 -19.202
    3    HB   VAL  32           HB       VAL  32 -31.099  -4.791 -17.621
    4   HG12  VAL  32          HG11      VAL  32 -32.679  -4.059 -15.725
    5   HG11  VAL  32          HG12      VAL  32 -33.558  -3.196 -16.986
    6   HG13  VAL  32          HG13      VAL  32 -31.871  -2.802 -16.662
    7   HG21  VAL  32          HG21      VAL  32 -32.771  -6.600 -18.320
    8   HG23  VAL  32          HG22      VAL  32 -33.856  -5.835 -17.158
    9   HG22  VAL  32          HG23      VAL  32 -32.303  -6.478 -16.625

  No H/Q in entry =           9
  In of MODEL   57
    1    HA   PRO  33           HA       PRO  33 -30.667  -0.824 -20.857
    2    HB2  PRO  33           HB2      PRO  33 -32.298   1.313 -20.725
    3    HB3  PRO  33           HB3      PRO  33 -32.694  -0.007 -21.826
    4    HG2  PRO  33           HG2      PRO  33 -33.692   0.442 -19.012
    5    HG3  PRO  33           HG3      PRO  33 -34.641   0.188 -20.476
    6    HD2  PRO  33           HD2      PRO  33 -34.076  -1.864 -18.821
    7    HD3  PRO  33           HD3      PRO  33 -34.122  -2.100 -20.568

  No H/Q in entry =           7
  In of MODEL   57
    1    H    VAL  34           H        VAL  34 -29.379  -1.308 -18.909
    2    HA   VAL  34           HA       VAL  34 -29.230   1.121 -17.249
    3    HB   VAL  34           HB       VAL  34 -28.572  -0.316 -15.316
    4   HG12  VAL  34          HG11      VAL  34 -30.934  -1.321 -15.018
    5   HG11  VAL  34          HG12      VAL  34 -31.289  -0.572 -16.572
    6   HG13  VAL  34          HG13      VAL  34 -30.793   0.427 -15.206
    7   HG21  VAL  34          HG21      VAL  34 -28.644  -2.340 -17.335
    8   HG23  VAL  34          HG22      VAL  34 -29.681  -2.764 -15.973
    9   HG22  VAL  34          HG23      VAL  34 -27.981  -2.385 -15.702

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ILE  35           H        ILE  35 -27.282   1.660 -16.403
    2    HA   ILE  35           HA       ILE  35 -24.906   0.466 -17.669
    3    HB   ILE  35           HB       ILE  35 -25.465   3.325 -16.845
    4   HG12  ILE  35          HG12      ILE  35 -24.409   2.087 -19.394
    5   HG13  ILE  35          HG13      ILE  35 -26.071   2.616 -19.134
    6   HG21  ILE  35          HG21      ILE  35 -22.823   1.938 -17.158
    7   HG23  ILE  35          HG22      ILE  35 -23.343   3.084 -15.924
    8   HG22  ILE  35          HG23      ILE  35 -22.988   3.646 -17.557
    9   HD11  ILE  35          HD11      ILE  35 -24.794   4.881 -18.521
   10   HD13  ILE  35          HD12      ILE  35 -25.307   4.477 -20.159
   11   HD12  ILE  35          HD13      ILE  35 -23.638   4.197 -19.663

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ILE  36           H        ILE  36 -23.622  -0.497 -16.073
    2    HA   ILE  36           HA       ILE  36 -24.099   0.079 -13.200
    3    HB   ILE  36           HB       ILE  36 -23.123  -2.569 -14.321
    4   HG12  ILE  36          HG12      ILE  36 -25.972  -1.923 -13.557
    5   HG13  ILE  36          HG13      ILE  36 -25.399  -1.862 -15.224
    6   HG23  ILE  36          HG21      ILE  36 -23.430  -3.426 -12.212
    7   HG22  ILE  36          HG22      ILE  36 -24.627  -2.209 -11.768
    8   HG21  ILE  36          HG23      ILE  36 -22.917  -1.782 -11.835
    9   HD13  ILE  36          HD11      ILE  36 -25.443  -4.081 -15.442
   10   HD12  ILE  36          HD12      ILE  36 -26.515  -4.025 -14.043
   11   HD11  ILE  36          HD13      ILE  36 -24.796  -4.352 -13.824

  No H/Q in entry =          11
  In of MODEL   57
    1    H    GLU  37           H        GLU  37 -22.358   0.800 -12.090
    2    HA   GLU  37           HA       GLU  37 -19.626   0.159 -13.006
    3    HB2  GLU  37           HB2      GLU  37 -20.677   2.891 -12.293
    4    HB3  GLU  37           HB3      GLU  37 -18.964   2.493 -12.427
    5    HG2  GLU  37           HG2      GLU  37 -19.207   2.065 -14.779
    6    HG3  GLU  37           HG3      GLU  37 -20.947   2.329 -14.677

  No H/Q in entry =           6
  In of MODEL   57
    1    H    ALA  38           H        ALA  38 -18.130  -0.005 -11.323
    2    HA   ALA  38           HA       ALA  38 -19.172   0.102  -8.553
    3    HB1  ALA  38           HB1      ALA  38 -17.352  -1.730  -9.986
    4    HB3  ALA  38           HB2      ALA  38 -18.388  -2.031  -8.591
    5    HB2  ALA  38           HB3      ALA  38 -16.817  -1.261  -8.372

  No H/Q in entry =           5
  In of MODEL   57
    1    H    PHE  39           H        PHE  39 -18.004   1.372  -7.072
    2    HA   PHE  39           HA       PHE  39 -15.549   2.719  -7.959
    3    HB2  PHE  39           HB2      PHE  39 -18.042   4.065  -6.935
    4    HB3  PHE  39           HB3      PHE  39 -16.454   4.824  -6.848
    5    HD1  PHE  39           HD1      PHE  39 -15.143   4.906  -9.110
    6    HD2  PHE  39           HD2      PHE  39 -19.370   4.465  -8.756
    7    HE1  PHE  39           HE1      PHE  39 -15.415   5.775 -11.415
    8    HE2  PHE  39           HE2      PHE  39 -19.657   5.322 -11.053
    9    HZ   PHE  39           HZ       PHE  39 -17.683   5.951 -12.401

  No H/Q in entry =           9
  In of MODEL   57
    1    HA   PRO  40           HA       PRO  40 -14.574   1.999  -3.675
    2    HB2  PRO  40           HB2      PRO  40 -12.927   4.110  -3.057
    3    HB3  PRO  40           HB3      PRO  40 -12.406   2.810  -4.129
    4    HG2  PRO  40           HG2      PRO  40 -13.582   5.485  -4.866
    5    HG3  PRO  40           HG3      PRO  40 -12.111   4.727  -5.475
    6    HD2  PRO  40           HD2      PRO  40 -14.323   4.521  -6.886
    7    HD3  PRO  40           HD3      PRO  40 -13.286   3.109  -6.698

  No H/Q in entry =           7
  In of MODEL   57
    1    H    GLU  41           H        GLU  41 -15.254   2.929  -1.542
    2    HA   GLU  41           HA       GLU  41 -17.593   4.499  -1.519
    3    HB2  GLU  41           HB2      GLU  41 -17.256   4.582   0.931
    4    HB3  GLU  41           HB3      GLU  41 -17.113   2.950   0.275
    5    HG2  GLU  41           HG2      GLU  41 -15.383   3.020   1.795
    6    HG3  GLU  41           HG3      GLU  41 -14.570   3.423   0.283

  No H/Q in entry =           6
  In of MODEL   57
    1    H    THR  42           H        THR  42 -14.320   5.608  -1.562
    2    HA   THR  42           HA       THR  42 -14.822   8.138  -0.338
    3    HB   THR  42           HB       THR  42 -12.700   8.842  -1.419
    4    HG1  THR  42           HG1      THR  42 -11.742   6.750  -2.482
    5   HG21  THR  42          HG21      THR  42 -12.827   7.358   0.677
    6   HG23  THR  42          HG22      THR  42 -11.288   7.396  -0.185
    7   HG22  THR  42          HG23      THR  42 -12.377   6.026  -0.389

  No H/Q in entry =           7
  In of MODEL   57
    1    H    LEU  43           H        LEU  43 -15.658   7.008  -3.445
    2    HA   LEU  43           HA       LEU  43 -16.070   9.766  -4.402
    3    HB2  LEU  43           HB2      LEU  43 -16.255   7.103  -5.800
    4    HB3  LEU  43           HB3      LEU  43 -16.598   8.659  -6.555
    5    HG   LEU  43           HG       LEU  43 -13.896   7.792  -5.554
    6   HD11  LEU  43          HD11      LEU  43 -14.969   6.609  -7.608
    7   HD13  LEU  43          HD12      LEU  43 -13.324   7.230  -7.729
    8   HD12  LEU  43          HD13      LEU  43 -14.662   8.142  -8.425
    9   HD23  LEU  43          HD21      LEU  43 -13.193   9.764  -6.967
   10   HD22  LEU  43          HD22      LEU  43 -14.081  10.172  -5.499
   11   HD21  LEU  43          HD23      LEU  43 -14.896  10.210  -7.061

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ALA  44           H        ALA  44 -17.909   7.821  -2.560
    2    HA   ALA  44           HA       ALA  44 -20.373   7.544  -3.886
    3    HB2  ALA  44           HB1      ALA  44 -20.171   6.427  -1.795
    4    HB3  ALA  44           HB2      ALA  44 -21.355   7.704  -1.518
    5    HB1  ALA  44           HB3      ALA  44 -19.695   7.906  -0.963

  No H/Q in entry =           5
  In of MODEL   57
    1    H    GLY  45           H        GLY  45 -19.120  10.414  -2.339
    2    HA3  GLY  45           HA2      GLY  45 -21.640  11.771  -2.696
    3    HA2  GLY  45           HA3      GLY  45 -20.135  12.483  -2.114

  No H/Q in entry =           3
  In of MODEL   57
    1    H    GLU  46           H        GLU  46 -18.549  11.648  -4.407
    2    HA   GLU  46           HA       GLU  46 -19.313  13.831  -6.167
    3    HB2  GLU  46           HB2      GLU  46 -16.999  11.886  -6.181
    4    HB3  GLU  46           HB3      GLU  46 -17.207  13.182  -7.360
    5    HG2  GLU  46           HG2      GLU  46 -15.715  14.102  -5.870
    6    HG3  GLU  46           HG3      GLU  46 -17.258  14.730  -5.293

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LYS  47           H        LYS  47 -18.988  10.326  -6.618
    2    HA   LYS  47           HA       LYS  47 -20.094  10.494  -9.294
    3    HB2  LYS  47           HB2      LYS  47 -18.806   8.459  -7.623
    4    HB3  LYS  47           HB3      LYS  47 -20.145   7.840  -8.590
    5    HG2  LYS  47           HG2      LYS  47 -18.081   7.552  -9.780
    6    HG3  LYS  47           HG3      LYS  47 -19.073   8.755 -10.602
    7    HD2  LYS  47           HD2      LYS  47 -17.799  10.544  -9.529
    8    HD3  LYS  47           HD3      LYS  47 -16.810   9.345  -8.700
    9    HE2  LYS  47           HE2      LYS  47 -16.008   8.510 -10.843
   10    HE3  LYS  47           HE3      LYS  47 -17.020   9.681 -11.686
   11    HZ1  LYS  47           HZ1      LYS  47 -15.097  10.603  -9.671
   12    HZ3  LYS  47           HZ2      LYS  47 -15.720  11.421 -11.023
   13    HZ2  LYS  47           HZ3      LYS  47 -14.551  10.205 -11.230

  No H/Q in entry =          13
  In of MODEL   57
    1    H    GLY  48           H        GLY  48 -21.374   9.647  -6.151
    2    HA3  GLY  48           HA2      GLY  48 -23.686   8.328  -6.900
    3    HA2  GLY  48           HA3      GLY  48 -23.520   9.327  -5.456

  No H/Q in entry =           3
  In of MODEL   57
    1    H    GLN  49           H        GLN  49 -23.077  11.787  -7.015
    2    HA   GLN  49           HA       GLN  49 -25.697  12.748  -7.158
    3    HB2  GLN  49           HB2      GLN  49 -23.206  13.765  -8.510
    4    HB3  GLN  49           HB3      GLN  49 -24.722  14.643  -8.425
    5    HG2  GLN  49           HG2      GLN  49 -24.567  14.665  -5.987
    6    HG3  GLN  49           HG3      GLN  49 -23.063  13.765  -6.073
    7   HE21  GLN  49          HE21      GLN  49 -23.077  15.991  -4.789
    8   HE22  GLN  49          HE22      GLN  49 -22.228  17.301  -5.430

  No H/Q in entry =           8
  In of MODEL   57
    1    H    ASN  50           H        ASN  50 -23.909  10.980  -9.551
    2    HA   ASN  50           HA       ASN  50 -25.838  11.752 -11.632
    3    HB2  ASN  50           HB2      ASN  50 -23.172  10.365 -11.869
    4    HB3  ASN  50           HB3      ASN  50 -24.244  10.735 -13.212
    5   HD21  ASN  50          HD21      ASN  50 -21.663  11.724 -11.594
    6   HD22  ASN  50          HD22      ASN  50 -21.525  13.373 -11.928

  No H/Q in entry =           6
  In of MODEL   57
    1    H    ALA  51           H        ALA  51 -25.688   9.389  -9.397
    2    HA   ALA  51           HA       ALA  51 -26.346   7.211 -11.234
    3    HB2  ALA  51           HB1      ALA  51 -25.688   5.890  -9.553
    4    HB3  ALA  51           HB2      ALA  51 -26.856   6.627  -8.457
    5    HB1  ALA  51           HB3      ALA  51 -25.255   7.343  -8.650

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ASP  52           H        ASP  52 -28.288   6.041 -11.100
    2    HA   ASP  52           HA       ASP  52 -30.571   7.743 -10.430
    3    HB2  ASP  52           HB2      ASP  52 -30.235   5.261 -12.111
    4    HB3  ASP  52           HB3      ASP  52 -31.819   5.902 -11.676

  No H/Q in entry =           4
  In of MODEL   57
    1    H    VAL  53           H        VAL  53 -28.808   4.946  -9.425
    2    HA   VAL  53           HA       VAL  53 -30.256   4.980  -6.910
    3    HB   VAL  53           HB       VAL  53 -31.558   3.266  -8.163
    4   HG11  VAL  53          HG11      VAL  53 -29.763   2.514  -9.687
    5   HG13  VAL  53          HG12      VAL  53 -30.522   1.170  -8.834
    6   HG12  VAL  53          HG13      VAL  53 -28.944   1.761  -8.320
    7   HG23  VAL  53          HG21      VAL  53 -30.626   1.331  -6.479
    8   HG22  VAL  53          HG22      VAL  53 -31.828   2.568  -6.108
    9   HG21  VAL  53          HG23      VAL  53 -30.134   2.835  -5.697

  No H/Q in entry =           9
  In of MODEL   57
    1    H    VAL  54           H        VAL  54 -28.922   4.614  -5.255
    2    HA   VAL  54           HA       VAL  54 -26.118   3.925  -5.868
    3    HB   VAL  54           HB       VAL  54 -27.289   5.630  -3.611
    4   HG11  VAL  54          HG11      VAL  54 -24.634   4.360  -3.906
    5   HG13  VAL  54          HG12      VAL  54 -25.425   4.989  -2.461
    6   HG12  VAL  54          HG13      VAL  54 -24.579   6.087  -3.551
    7   HG22  VAL  54          HG21      VAL  54 -26.533   7.494  -4.701
    8   HG21  VAL  54          HG22      VAL  54 -27.022   6.482  -6.058
    9   HG23  VAL  54          HG23      VAL  54 -25.320   6.600  -5.618

  No H/Q in entry =           9
  In of MODEL   57
    1    H    LEU  55           H        LEU  55 -25.419   2.037  -5.233
    2    HA   LEU  55           HA       LEU  55 -26.852   0.633  -3.065
    3    HB2  LEU  55           HB2      LEU  55 -25.230  -0.434  -5.363
    4    HB3  LEU  55           HB3      LEU  55 -25.938  -1.416  -4.080
    5    HG   LEU  55           HG       LEU  55 -27.461   0.097  -6.192
    6   HD13  LEU  55          HD11      LEU  55 -27.056  -1.729  -7.419
    7   HD12  LEU  55          HD12      LEU  55 -27.963  -2.662  -6.229
    8   HD11  LEU  55          HD13      LEU  55 -26.214  -2.499  -6.076
    9   HD23  LEU  55          HD21      LEU  55 -28.645  -1.926  -4.347
   10   HD22  LEU  55          HD22      LEU  55 -29.416  -0.582  -5.189
   11   HD21  LEU  55          HD23      LEU  55 -28.414  -0.276  -3.771

  No H/Q in entry =          11
  In of MODEL   57
    1    H    LEU  56           H        LEU  56 -25.671   0.097  -1.261
    2    HA   LEU  56           HA       LEU  56 -22.764   0.657  -1.305
    3    HB2  LEU  56           HB2      LEU  56 -24.554   0.334   1.091
    4    HB3  LEU  56           HB3      LEU  56 -22.872   0.859   1.083
    5    HG   LEU  56           HG       LEU  56 -25.260   2.410   0.123
    6   HD11  LEU  56          HD11      LEU  56 -24.128   2.080   2.644
    7   HD13  LEU  56          HD12      LEU  56 -25.193   3.393   2.143
    8   HD12  LEU  56          HD13      LEU  56 -23.444   3.597   2.058
    9   HD23  LEU  56          HD21      LEU  56 -23.414   4.216  -0.060
   10   HD22  LEU  56          HD22      LEU  56 -23.732   3.105  -1.392
   11   HD21  LEU  56          HD23      LEU  56 -22.363   2.824  -0.319

  No H/Q in entry =          11
  In of MODEL   57
    1    H    GLY  57           H        GLY  57 -21.295  -0.897  -0.777
    2    HA3  GLY  57           HA2      GLY  57 -22.063  -3.630  -0.987
    3    HA2  GLY  57           HA3      GLY  57 -20.473  -3.046  -0.500

  No H/Q in entry =           3
  In of MODEL   57
    1    HA   PRO  58           HA       PRO  58 -23.224  -4.257   3.199
    2    HB2  PRO  58           HB2      PRO  58 -22.396  -6.823   3.795
    3    HB3  PRO  58           HB3      PRO  58 -23.800  -6.488   2.782
    4    HG2  PRO  58           HG2      PRO  58 -21.026  -7.212   1.994
    5    HG3  PRO  58           HG3      PRO  58 -22.562  -7.755   1.319
    6    HD2  PRO  58           HD2      PRO  58 -21.056  -5.845   0.106
    7    HD3  PRO  58           HD3      PRO  58 -22.817  -5.857   0.002

  No H/Q in entry =           7
  In of MODEL   57
    1    H    GLN  59           H        GLN  59 -19.832  -4.539   2.593
    2    HA   GLN  59           HA       GLN  59 -19.079  -4.527   5.355
    3    HB2  GLN  59           HB2      GLN  59 -17.687  -4.092   2.775
    4    HB3  GLN  59           HB3      GLN  59 -16.968  -3.339   4.184
    5    HG2  GLN  59           HG2      GLN  59 -15.972  -5.506   3.762
    6    HG3  GLN  59           HG3      GLN  59 -16.844  -5.520   5.285
    7   HE21  GLN  59          HE21      GLN  59 -17.328  -7.444   5.309
    8   HE22  GLN  59          HE22      GLN  59 -18.265  -8.549   4.492

  No H/Q in entry =           8
  In of MODEL   57
    1    H    ILE  60           H        ILE  60 -20.151  -2.021   3.156
    2    HA   ILE  60           HA       ILE  60 -19.411  -0.029   5.212
    3    HB   ILE  60           HB       ILE  60 -19.731   1.694   3.397
    4   HG12  ILE  60          HG12      ILE  60 -19.418  -0.490   1.385
    5   HG13  ILE  60          HG13      ILE  60 -21.033  -0.072   1.959
    6   HG23  ILE  60          HG21      ILE  60 -17.564   1.568   2.714
    7   HG22  ILE  60          HG22      ILE  60 -17.619  -0.181   2.491
    8   HG21  ILE  60          HG23      ILE  60 -17.545   0.499   4.116
    9   HD13  ILE  60          HD11      ILE  60 -20.801   1.254   0.051
   10   HD12  ILE  60          HD12      ILE  60 -19.103   1.595   0.375
   11   HD11  ILE  60          HD13      ILE  60 -20.357   2.367   1.345

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ALA  61           H        ALA  61 -21.775  -1.749   5.271
    2    HA   ALA  61           HA       ALA  61 -24.089  -0.208   4.817
    3    HB1  ALA  61           HB1      ALA  61 -25.221  -1.769   6.134
    4    HB2  ALA  61           HB2      ALA  61 -23.805  -2.085   7.137
    5    HB3  ALA  61           HB3      ALA  61 -23.865  -2.688   5.482

  No H/Q in entry =           5
  In of MODEL   57
    1    H    TYR  62           H        TYR  62 -21.882  -0.210   7.617
    2    HA   TYR  62           HA       TYR  62 -23.528   1.352   9.292
    3    HB2  TYR  62           HB2      TYR  62 -21.512   1.887  10.527
    4    HB3  TYR  62           HB3      TYR  62 -21.482   0.186  10.064
    5    HD1  TYR  62           HD1      TYR  62 -19.912  -0.598   8.295
    6    HD2  TYR  62           HD2      TYR  62 -19.825   3.432   9.711
    7    HE1  TYR  62           HE1      TYR  62 -17.714  -0.275   7.227
    8    HE2  TYR  62           HE2      TYR  62 -17.612   3.750   8.644
    9    HH   TYR  62           HH       TYR  62 -15.677   2.086   7.968

  No H/Q in entry =           9
  In of MODEL   57
    1    H    MET  63           H        MET  63 -21.932   2.312   6.442
    2    HA   MET  63           HA       MET  63 -21.922   5.146   7.148
    3    HB2  MET  63           HB2      MET  63 -21.232   3.671   4.607
    4    HB3  MET  63           HB3      MET  63 -21.133   5.423   4.797
    5    HG2  MET  63           HG2      MET  63 -19.407   5.161   6.476
    6    HG3  MET  63           HG3      MET  63 -19.524   3.407   6.341
    7    HE2  MET  63           HE1      MET  63 -17.629   6.474   3.839
    8    HE1  MET  63           HE2      MET  63 -19.162   6.603   4.701
    9    HE3  MET  63           HE3      MET  63 -19.144   6.138   2.999

  No H/Q in entry =           9
  In of MODEL   57
    1    H    LEU  64           H        LEU  64 -24.380   3.158   6.173
    2    HA   LEU  64           HA       LEU  64 -25.664   4.517   4.100
    3    HB2  LEU  64           HB2      LEU  64 -26.417   2.363   5.007
    4    HB3  LEU  64           HB3      LEU  64 -26.920   3.173   6.491
    5    HG   LEU  64           HG       LEU  64 -28.680   4.338   5.267
    6   HD13  LEU  64          HD11      LEU  64 -28.409   4.604   3.035
    7   HD12  LEU  64          HD12      LEU  64 -28.965   2.937   2.882
    8   HD11  LEU  64          HD13      LEU  64 -27.239   3.289   2.943
    9   HD23  LEU  64          HD21      LEU  64 -29.044   1.505   4.506
   10   HD22  LEU  64          HD22      LEU  64 -30.093   2.579   5.430
   11   HD21  LEU  64          HD23      LEU  64 -28.677   1.858   6.195

  No H/Q in entry =          11
  In of MODEL   57
    1    HA   PRO  65           HA       PRO  65 -28.014   7.536   6.863
    2    HB2  PRO  65           HB2      PRO  65 -26.027   7.793   9.119
    3    HB3  PRO  65           HB3      PRO  65 -27.778   7.979   9.164
    4    HG2  PRO  65           HG2      PRO  65 -26.729   5.774  10.083
    5    HG3  PRO  65           HG3      PRO  65 -28.144   5.669   9.036
    6    HD2  PRO  65           HD2      PRO  65 -25.242   5.214   8.332
    7    HD3  PRO  65           HD3      PRO  65 -26.650   4.252   7.880

  No H/Q in entry =           7
  In of MODEL   57
    1    H    GLU  66           H        GLU  66 -24.461   7.671   6.938
    2    HA   GLU  66           HA       GLU  66 -24.314  10.484   6.545
    3    HB2  GLU  66           HB2      GLU  66 -22.379   8.279   5.885
    4    HB3  GLU  66           HB3      GLU  66 -22.021   9.994   5.685
    5    HG2  GLU  66           HG2      GLU  66 -22.253  10.343   8.054
    6    HG3  GLU  66           HG3      GLU  66 -22.689   8.649   8.278

  No H/Q in entry =           6
  In of MODEL   57
    1    H    ILE  67           H        ILE  67 -24.267   7.746   4.282
    2    HA   ILE  67           HA       ILE  67 -23.942   9.485   1.996
    3    HB   ILE  67           HB       ILE  67 -24.684   6.533   2.162
    4   HG12  ILE  67          HG12      ILE  67 -22.120   7.845   1.247
    5   HG13  ILE  67          HG13      ILE  67 -22.393   7.403   2.931
    6   HG21  ILE  67          HG21      ILE  67 -24.726   8.421  -0.055
    7   HG23  ILE  67          HG22      ILE  67 -25.263   6.742  -0.011
    8   HG22  ILE  67          HG23      ILE  67 -23.572   7.118  -0.338
    9   HD12  ILE  67          HD11      ILE  67 -21.879   5.666   0.575
   10   HD11  ILE  67          HD12      ILE  67 -22.862   5.034   1.894
   11   HD13  ILE  67          HD13      ILE  67 -21.216   5.585   2.206

  No H/Q in entry =          11
  In of MODEL   57
    1    H    GLN  68           H        GLN  68 -26.753   8.273   3.623
    2    HA   GLN  68           HA       GLN  68 -28.627   9.116   1.652
    3    HB2  GLN  68           HB2      GLN  68 -28.865   8.732   4.633
    4    HB3  GLN  68           HB3      GLN  68 -30.214   9.262   3.641
    5    HG2  GLN  68           HG2      GLN  68 -30.135   7.239   2.357
    6    HG3  GLN  68           HG3      GLN  68 -28.659   6.735   3.158
    7   HE21  GLN  68          HE21      GLN  68 -30.763   5.266   3.015
    8   HE22  GLN  68          HE22      GLN  68 -31.568   4.762   4.428

  No H/Q in entry =           8
  In of MODEL   57
    1    H    ARG  69           H        ARG  69 -27.111  10.851   4.397
    2    HA   ARG  69           HA       ARG  69 -28.601  13.262   4.001
    3    HB2  ARG  69           HB2      ARG  69 -26.212  12.447   5.587
    4    HB3  ARG  69           HB3      ARG  69 -26.379  14.162   5.235
    5    HG2  ARG  69           HG2      ARG  69 -28.696  14.081   6.207
    6    HG3  ARG  69           HG3      ARG  69 -28.401  12.402   6.673
    7    HD2  ARG  69           HD2      ARG  69 -26.831  14.837   7.598
    8    HD3  ARG  69           HD3      ARG  69 -27.912  13.870   8.588
    9    HE   ARG  69           HE       ARG  69 -25.256  13.077   7.635
   10   HH21  ARG  69          HH11      ARG  69 -24.359  11.352   8.824
   11   HH22  ARG  69          HH12      ARG  69 -25.345  10.479   9.948
   12   HH11  ARG  69          HH21      ARG  69 -28.182  12.372   9.330
   13   HH12  ARG  69          HH22      ARG  69 -27.509  11.054  10.232

  No H/Q in entry =          13
  In of MODEL   57
    1    H    LEU  70           H        LEU  70 -25.662  12.009   2.637
    2    HA   LEU  70           HA       LEU  70 -24.670  14.433   1.479
    3    HB2  LEU  70           HB2      LEU  70 -23.560  12.166   2.064
    4    HB3  LEU  70           HB3      LEU  70 -24.150  11.676   0.476
    5    HG   LEU  70           HG       LEU  70 -22.627  13.133  -0.602
    6   HD11  LEU  70          HD11      LEU  70 -21.849  14.004   2.190
    7   HD13  LEU  70          HD12      LEU  70 -22.596  15.008   0.946
    8   HD12  LEU  70          HD13      LEU  70 -20.952  14.410   0.723
    9   HD22  LEU  70          HD21      LEU  70 -21.109  11.489  -0.377
   10   HD21  LEU  70          HD22      LEU  70 -22.008  10.915   1.028
   11   HD23  LEU  70          HD23      LEU  70 -20.679  12.055   1.237

  No H/Q in entry =          11
  In of MODEL   57
    1    H    LEU  71           H        LEU  71 -26.692  11.790   0.352
    2    HA   LEU  71           HA       LEU  71 -27.291  13.261  -2.158
    3    HB2  LEU  71           HB2      LEU  71 -27.349  10.268  -1.725
    4    HB3  LEU  71           HB3      LEU  71 -27.520  11.128  -3.255
    5    HG   LEU  71           HG       LEU  71 -25.004  11.258  -1.593
    6   HD12  LEU  71          HD11      LEU  71 -24.975   9.640  -4.032
    7   HD11  LEU  71          HD12      LEU  71 -25.955   8.962  -2.732
    8   HD13  LEU  71          HD13      LEU  71 -24.250   9.325  -2.456
    9   HD22  LEU  71          HD21      LEU  71 -25.196  13.074  -3.079
   10   HD21  LEU  71          HD22      LEU  71 -25.641  12.014  -4.415
   11   HD23  LEU  71          HD23      LEU  71 -24.015  11.944  -3.738

  No H/Q in entry =          11
  In of MODEL   57
    1    HA   PRO  72           HA       PRO  72 -31.131  12.612   0.461
    2    HB2  PRO  72           HB2      PRO  72 -32.111  15.129   0.391
    3    HB3  PRO  72           HB3      PRO  72 -30.781  14.736   1.480
    4    HG2  PRO  72           HG2      PRO  72 -30.654  15.951  -1.268
    5    HG3  PRO  72           HG3      PRO  72 -29.915  16.532   0.224
    6    HD2  PRO  72           HD2      PRO  72 -28.504  15.048  -1.549
    7    HD3  PRO  72           HD3      PRO  72 -28.241  14.886   0.186

  No H/Q in entry =           7
  In of MODEL   57
    1    H    ASN  73           H        ASN  73 -30.554  13.610  -2.750
    2    HA   ASN  73           HA       ASN  73 -33.396  13.168  -3.383
    3    HB2  ASN  73           HB2      ASN  73 -32.984  14.306  -5.476
    4    HB3  ASN  73           HB3      ASN  73 -32.509  15.303  -4.110
    5   HD21  ASN  73          HD21      ASN  73 -31.717  15.398  -6.788
    6   HD22  ASN  73          HD22      ASN  73 -30.043  15.317  -6.980

  No H/Q in entry =           6
  In of MODEL   57
    1    H    LYS  74           H        LYS  74 -31.311  11.008  -2.968
    2    HA   LYS  74           HA       LYS  74 -31.813   9.599  -5.523
    3    HB2  LYS  74           HB2      LYS  74 -29.269   9.419  -3.903
    4    HB3  LYS  74           HB3      LYS  74 -29.614   8.596  -5.425
    5    HG2  LYS  74           HG2      LYS  74 -29.488  11.575  -5.209
    6    HG3  LYS  74           HG3      LYS  74 -28.067  10.579  -5.517
    7    HD2  LYS  74           HD2      LYS  74 -29.139   9.608  -7.466
    8    HD3  LYS  74           HD3      LYS  74 -30.604  10.536  -7.142
    9    HE2  LYS  74           HE2      LYS  74 -29.473  12.600  -7.574
   10    HE3  LYS  74           HE3      LYS  74 -27.912  11.782  -7.669
   11    HZ2  LYS  74           HZ1      LYS  74 -29.409  12.326  -9.792
   12    HZ1  LYS  74           HZ2      LYS  74 -29.993  10.773  -9.426
   13    HZ3  LYS  74           HZ3      LYS  74 -28.337  11.011  -9.722

  No H/Q in entry =          13
  In of MODEL   57
    1    HA   PRO  75           HA       PRO  75 -33.067   6.539  -2.565
    2    HB2  PRO  75           HB2      PRO  75 -33.274   4.316  -4.158
    3    HB3  PRO  75           HB3      PRO  75 -34.461   5.617  -4.221
    4    HG2  PRO  75           HG2      PRO  75 -32.099   5.136  -5.995
    5    HG3  PRO  75           HG3      PRO  75 -33.765   5.499  -6.439
    6    HD2  PRO  75           HD2      PRO  75 -31.912   7.452  -6.388
    7    HD3  PRO  75           HD3      PRO  75 -33.560   7.774  -5.848

  No H/Q in entry =           7
  In of MODEL   57
    1    H    VAL  76           H        VAL  76 -31.566   5.546  -1.197
    2    HA   VAL  76           HA       VAL  76 -29.049   4.456  -2.309
    3    HB   VAL  76           HB       VAL  76 -29.404   5.896   0.355
    4   HG11  VAL  76          HG11      VAL  76 -26.990   4.725  -1.042
    5   HG13  VAL  76          HG12      VAL  76 -27.666   4.236   0.515
    6   HG12  VAL  76          HG13      VAL  76 -26.892   5.811   0.345
    7   HG22  VAL  76          HG21      VAL  76 -28.824   7.830  -0.523
    8   HG21  VAL  76          HG22      VAL  76 -29.334   7.116  -2.055
    9   HG23  VAL  76          HG23      VAL  76 -27.630   7.105  -1.599

  No H/Q in entry =           9
  In of MODEL   57
    1    H    GLU  77           H        GLU  77 -28.732   2.312  -1.705
    2    HA   GLU  77           HA       GLU  77 -29.483   1.478   0.945
    3    HB2  GLU  77           HB2      GLU  77 -31.013  -0.239   0.407
    4    HB3  GLU  77           HB3      GLU  77 -31.631   1.259  -0.288
    5    HG2  GLU  77           HG2      GLU  77 -30.987   0.540  -2.479
    6    HG3  GLU  77           HG3      GLU  77 -30.277  -0.929  -1.812

  No H/Q in entry =           6
  In of MODEL   57
    1    H    VAL  78           H        VAL  78 -29.059  -0.594   1.597
    2    HA   VAL  78           HA       VAL  78 -26.361  -1.238   0.706
    3    HB   VAL  78           HB       VAL  78 -28.027  -2.211   3.067
    4   HG11  VAL  78          HG11      VAL  78 -25.632  -3.325   1.939
    5   HG13  VAL  78          HG12      VAL  78 -26.518  -3.843   3.375
    6   HG12  VAL  78          HG13      VAL  78 -25.253  -2.623   3.511
    7   HG22  VAL  78          HG21      VAL  78 -26.633  -0.787   4.413
    8   HG21  VAL  78          HG22      VAL  78 -27.412   0.153   3.141
    9   HG23  VAL  78          HG23      VAL  78 -25.713  -0.296   2.989

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ILE  79           H        ILE  79 -25.736  -3.116  -0.206
    2    HA   ILE  79           HA       ILE  79 -27.725  -4.682  -1.561
    3    HB   ILE  79           HB       ILE  79 -24.713  -5.071  -1.341
    4   HG12  ILE  79          HG12      ILE  79 -26.399  -4.034  -3.626
    5   HG13  ILE  79          HG13      ILE  79 -25.573  -2.990  -2.467
    6   HG22  ILE  79          HG21      ILE  79 -25.759  -6.291  -3.665
    7   HG21  ILE  79          HG22      ILE  79 -26.719  -6.863  -2.300
    8   HG23  ILE  79          HG23      ILE  79 -24.967  -7.060  -2.290
    9   HD13  ILE  79          HD11      ILE  79 -24.154  -3.030  -4.286
   10   HD12  ILE  79          HD12      ILE  79 -24.415  -4.751  -4.574
   11   HD11  ILE  79          HD13      ILE  79 -23.455  -4.223  -3.190

  No H/Q in entry =          11
  In of MODEL   57
    1    H    ASP  80           H        ASP  80 -28.500  -6.646  -0.986
    2    HA   ASP  80           HA       ASP  80 -28.406  -7.553   1.658
    3    HB2  ASP  80           HB2      ASP  80 -30.131  -8.203   0.014
    4    HB3  ASP  80           HB3      ASP  80 -28.927  -9.153  -0.858

  No H/Q in entry =           4
  In of MODEL   57
    1    H    SER  81           H        SER  81 -26.820  -8.620   2.784
    2    HA   SER  81           HA       SER  81 -24.294  -9.181   1.591
    3    HB2  SER  81           HB2      SER  81 -23.695 -10.190   3.756
    4    HB3  SER  81           HB3      SER  81 -24.472  -8.623   3.976
    5    HG   SER  81           HG       SER  81 -26.458 -10.040   4.129

  No H/Q in entry =           5
  In of MODEL   57
    1    H    LEU  82           H        LEU  82 -26.905 -11.396   1.903
    2    HA   LEU  82           HA       LEU  82 -25.249 -13.688   1.375
    3    HB2  LEU  82           HB2      LEU  82 -28.203 -13.340   0.923
    4    HB3  LEU  82           HB3      LEU  82 -27.324 -14.859   1.097
    5    HG   LEU  82           HG       LEU  82 -27.756 -12.833   3.273
    6   HD11  LEU  82          HD11      LEU  82 -29.754 -14.206   2.410
    7   HD13  LEU  82          HD12      LEU  82 -29.395 -14.303   4.135
    8   HD12  LEU  82          HD13      LEU  82 -28.906 -15.612   3.056
    9   HD22  LEU  82          HD21      LEU  82 -25.687 -13.964   3.606
   10   HD21  LEU  82          HD22      LEU  82 -26.375 -15.507   3.105
   11   HD23  LEU  82          HD23      LEU  82 -26.864 -14.781   4.635

  No H/Q in entry =          11
  In of MODEL   57
    1    H    LEU  83           H        LEU  83 -27.307 -11.549  -0.538
    2    HA   LEU  83           HA       LEU  83 -27.043 -12.888  -3.013
    3    HB2  LEU  83           HB2      LEU  83 -27.587 -10.004  -2.355
    4    HB3  LEU  83           HB3      LEU  83 -27.588 -10.644  -3.997
    5    HG   LEU  83           HG       LEU  83 -29.603 -11.133  -1.824
    6   HD13  LEU  83          HD11      LEU  83 -30.443  -9.318  -2.882
    7   HD12  LEU  83          HD12      LEU  83 -30.853 -10.447  -4.171
    8   HD11  LEU  83          HD13      LEU  83 -29.361  -9.511  -4.260
    9   HD23  LEU  83          HD21      LEU  83 -29.682 -12.386  -4.553
   10   HD22  LEU  83          HD22      LEU  83 -30.635 -12.786  -3.125
   11   HD21  LEU  83          HD23      LEU  83 -28.926 -13.210  -3.191

  No H/Q in entry =          11
  In of MODEL   57
    1    H    TYR  84           H        TYR  84 -25.202 -10.421  -1.327
    2    HA   TYR  84           HA       TYR  84 -23.364  -9.840  -3.455
    3    HB2  TYR  84           HB2      TYR  84 -23.945  -8.378  -1.441
    4    HB3  TYR  84           HB3      TYR  84 -22.898  -9.440  -0.502
    5    HD1  TYR  84           HD1      TYR  84 -20.483  -9.800  -1.576
    6    HD2  TYR  84           HD2      TYR  84 -23.011  -6.439  -2.318
    7    HE1  TYR  84           HE1      TYR  84 -18.512  -8.490  -2.288
    8    HE2  TYR  84           HE2      TYR  84 -21.051  -5.121  -3.041
    9    HH   TYR  84           HH       TYR  84 -17.891  -6.621  -3.427

  No H/Q in entry =           9
  In of MODEL   57
    1    H    GLY  85           H        GLY  85 -23.032 -11.839  -0.516
    2    HA3  GLY  85           HA2      GLY  85 -20.414 -12.662  -1.000
    3    HA2  GLY  85           HA3      GLY  85 -21.604 -13.566  -0.067

  No H/Q in entry =           3
  In of MODEL   57
    1    H    LYS  86           H        LYS  86 -23.431 -14.018  -2.130
    2    HA   LYS  86           HA       LYS  86 -22.269 -16.336  -3.396
    3    HB2  LYS  86           HB2      LYS  86 -24.697 -15.682  -2.425
    4    HB3  LYS  86           HB3      LYS  86 -24.946 -15.315  -4.131
    5    HG2  LYS  86           HG2      LYS  86 -24.519 -17.569  -4.738
    6    HG3  LYS  86           HG3      LYS  86 -24.052 -17.972  -3.085
    7    HD2  LYS  86           HD2      LYS  86 -26.347 -18.644  -3.405
    8    HD3  LYS  86           HD3      LYS  86 -26.319 -17.246  -2.331
    9    HE2  LYS  86           HE2      LYS  86 -27.143 -15.816  -3.969
   10    HE3  LYS  86           HE3      LYS  86 -26.663 -16.890  -5.284
   11    HZ1  LYS  86           HZ1      LYS  86 -28.774 -17.496  -3.278
   12    HZ3  LYS  86           HZ2      LYS  86 -28.347 -18.457  -4.614
   13    HZ2  LYS  86           HZ3      LYS  86 -29.065 -16.938  -4.856

  No H/Q in entry =          13
  In of MODEL   57
    1    H    VAL  87           H        VAL  87 -22.406 -13.121  -4.279
    2    HA   VAL  87           HA       VAL  87 -22.161 -11.928  -6.216
    3    HB   VAL  87           HB       VAL  87 -20.968 -14.400  -7.515
    4   HG11  VAL  87          HG11      VAL  87 -21.327 -12.074  -8.648
    5   HG13  VAL  87          HG12      VAL  87 -19.762 -12.869  -8.827
    6   HG12  VAL  87          HG13      VAL  87 -19.961 -11.566  -7.656
    7   HG22  VAL  87          HG21      VAL  87 -19.918 -14.395  -5.381
    8   HG21  VAL  87          HG22      VAL  87 -19.685 -12.650  -5.432
    9   HG23  VAL  87          HG23      VAL  87 -18.781 -13.692  -6.529

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ASP  88           H        ASP  88 -24.645 -12.688  -5.867
    2    HA   ASP  88           HA       ASP  88 -25.709 -13.947  -8.269
    3    HB2  ASP  88           HB2      ASP  88 -26.691 -14.246  -5.946
    4    HB3  ASP  88           HB3      ASP  88 -27.222 -12.567  -6.040

  No H/Q in entry =           4
  In of MODEL   57
    1    H    GLY  89           H        GLY  89 -25.063 -12.653  -9.906
    2    HA3  GLY  89           HA2      GLY  89 -25.374  -9.891 -10.098
    3    HA2  GLY  89           HA3      GLY  89 -25.297 -11.005 -11.462

  No H/Q in entry =           3
  In of MODEL   57
    1    H    LEU  90           H        LEU  90 -27.678 -12.471 -11.018
    2    HA   LEU  90           HA       LEU  90 -29.578 -10.620 -12.125
    3    HB2  LEU  90           HB2      LEU  90 -29.531 -13.014 -12.713
    4    HB3  LEU  90           HB3      LEU  90 -30.018 -13.409 -11.065
    5    HG   LEU  90           HG       LEU  90 -32.188 -12.391 -11.424
    6   HD13  LEU  90          HD11      LEU  90 -32.090 -10.639 -12.894
    7   HD12  LEU  90          HD12      LEU  90 -32.571 -11.897 -14.035
    8   HD11  LEU  90          HD13      LEU  90 -30.878 -11.422 -13.910
    9   HD23  LEU  90          HD21      LEU  90 -32.042 -14.008 -13.865
   10   HD22  LEU  90          HD22      LEU  90 -33.013 -14.224 -12.408
   11   HD21  LEU  90          HD23      LEU  90 -31.331 -14.758 -12.434

  No H/Q in entry =          11
  In of MODEL   57
    1    H    GLY  91           H        GLY  91 -29.339 -12.121  -8.946
    2    HA3  GLY  91           HA2      GLY  91 -31.727 -11.123  -7.903
    3    HA2  GLY  91           HA3      GLY  91 -30.312 -11.592  -6.962

  No H/Q in entry =           3
  In of MODEL   57
    1    H    VAL  92           H        VAL  92 -28.481  -9.675  -7.813
    2    HA   VAL  92           HA       VAL  92 -29.379  -7.418  -6.257
    3    HB   VAL  92           HB       VAL  92 -26.815  -7.762  -7.854
    4   HG12  VAL  92          HG11      VAL  92 -27.066  -5.894  -5.523
    5   HG11  VAL  92          HG12      VAL  92 -27.757  -5.378  -7.063
    6   HG13  VAL  92          HG13      VAL  92 -26.041  -5.766  -6.953
    7   HG22  VAL  92          HG21      VAL  92 -26.516  -9.343  -6.267
    8   HG21  VAL  92          HG22      VAL  92 -27.696  -8.621  -5.171
    9   HG23  VAL  92          HG23      VAL  92 -26.073  -7.942  -5.292

  No H/Q in entry =           9
  In of MODEL   57
    1    H    LEU  93           H        LEU  93 -28.943  -8.050  -9.680
    2    HA   LEU  93           HA       LEU  93 -29.413  -5.431 -10.601
    3    HB2  LEU  93           HB2      LEU  93 -28.685  -7.249 -12.068
    4    HB3  LEU  93           HB3      LEU  93 -30.240  -8.052 -11.847
    5    HG   LEU  93           HG       LEU  93 -31.344  -6.134 -12.965
    6   HD11  LEU  93          HD11      LEU  93 -29.570  -4.455 -12.457
    7   HD13  LEU  93          HD12      LEU  93 -30.008  -4.501 -14.165
    8   HD12  LEU  93          HD13      LEU  93 -28.519  -5.267 -13.617
    9   HD23  LEU  93          HD21      LEU  93 -30.280  -6.646 -15.255
   10   HD22  LEU  93          HD22      LEU  93 -31.061  -7.943 -14.352
   11   HD21  LEU  93          HD23      LEU  93 -29.302  -7.805 -14.355

  No H/Q in entry =          11
  In of MODEL   57
    1    H    LYS  94           H        LYS  94 -31.665  -8.090  -9.758
    2    HA   LYS  94           HA       LYS  94 -34.075  -6.757 -10.378
    3    HB2  LYS  94           HB2      LYS  94 -33.457  -8.922  -8.373
    4    HB3  LYS  94           HB3      LYS  94 -35.086  -8.302  -8.638
    5    HG2  LYS  94           HG2      LYS  94 -34.964  -9.065 -10.974
    6    HG3  LYS  94           HG3      LYS  94 -33.369  -9.743 -10.649
    7    HD2  LYS  94           HD2      LYS  94 -34.424 -11.133  -8.827
    8    HD3  LYS  94           HD3      LYS  94 -35.996 -10.559  -9.380
    9    HE2  LYS  94           HE2      LYS  94 -35.440 -11.455 -11.650
   10    HE3  LYS  94           HE3      LYS  94 -33.989 -12.173 -10.949
   11    HZ3  LYS  94           HZ1      LYS  94 -35.764 -13.779 -11.123
   12    HZ2  LYS  94           HZ2      LYS  94 -36.785 -12.804 -10.178
   13    HZ1  LYS  94           HZ3      LYS  94 -35.391 -13.489  -9.492

  No H/Q in entry =          13
  In of MODEL   57
    1    H    ALA  95           H        ALA  95 -32.246  -6.801  -7.330
    2    HA   ALA  95           HA       ALA  95 -34.166  -5.315  -5.845
    3    HB2  ALA  95           HB1      ALA  95 -31.729  -6.578  -5.314
    4    HB3  ALA  95           HB2      ALA  95 -32.748  -5.723  -4.157
    5    HB1  ALA  95           HB3      ALA  95 -31.439  -4.871  -4.976

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ALA  96           H        ALA  96 -31.569  -4.331  -7.941
    2    HA   ALA  96           HA       ALA  96 -31.602  -1.571  -7.158
    3    HB2  ALA  96           HB1      ALA  96 -30.254  -1.274  -9.268
    4    HB3  ALA  96           HB2      ALA  96 -30.478  -2.992  -9.593
    5    HB1  ALA  96           HB3      ALA  96 -29.585  -2.475  -8.163

  No H/Q in entry =           5
  In of MODEL   57
    1    H    VAL  97           H        VAL  97 -33.054  -3.346  -9.849
    2    HA   VAL  97           HA       VAL  97 -34.231  -1.095 -11.097
    3    HB   VAL  97           HB       VAL  97 -34.903  -4.054 -11.149
    4   HG11  VAL  97          HG11      VAL  97 -36.787  -2.132 -11.627
    5   HG13  VAL  97          HG12      VAL  97 -36.773  -3.723 -12.388
    6   HG12  VAL  97          HG13      VAL  97 -36.084  -2.337 -13.232
    7   HG21  VAL  97          HG21      VAL  97 -33.713  -2.163 -13.178
    8   HG23  VAL  97          HG22      VAL  97 -34.087  -3.861 -13.473
    9   HG22  VAL  97          HG23      VAL  97 -32.856  -3.421 -12.287

  No H/Q in entry =           9
  In of MODEL   57
    1    H    ALA  98           H        ALA  98 -35.310  -3.334  -8.567
    2    HA   ALA  98           HA       ALA  98 -37.920  -2.305  -8.211
    3    HB1  ALA  98           HB1      ALA  98 -36.807  -4.459  -7.186
    4    HB3  ALA  98           HB2      ALA  98 -38.027  -3.593  -6.251
    5    HB2  ALA  98           HB3      ALA  98 -36.315  -3.367  -5.892

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ALA  99           H        ALA  99 -34.880  -1.373  -6.563
    2    HA   ALA  99           HA       ALA  99 -36.096   0.552  -4.893
    3    HB1  ALA  99           HB1      ALA  99 -33.411  -0.215  -5.645
    4    HB2  ALA  99           HB2      ALA  99 -33.994   0.505  -4.144
    5    HB3  ALA  99           HB3      ALA  99 -33.565   1.537  -5.507

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ILE 100           H        ILE 100 -35.065   0.741  -8.249
    2    HA   ILE 100           HA       ILE 100 -35.372   3.580  -8.457
    3    HB   ILE 100           HB       ILE 100 -35.372   1.431 -10.604
    4   HG12  ILE 100          HG12      ILE 100 -33.299   3.515  -9.927
    5   HG13  ILE 100          HG13      ILE 100 -33.261   1.866  -9.303
    6   HG21  ILE 100          HG21      ILE 100 -35.925   4.330 -10.723
    7   HG23  ILE 100          HG22      ILE 100 -36.375   3.044 -11.844
    8   HG22  ILE 100          HG23      ILE 100 -34.752   3.733 -11.898
    9   HD12  ILE 100          HD11      ILE 100 -32.775   2.857 -12.074
   10   HD11  ILE 100          HD12      ILE 100 -33.363   1.212 -11.825
   11   HD13  ILE 100          HD13      ILE 100 -31.837   1.722 -11.104

  No H/Q in entry =          11
  In of MODEL   57
    1    H    LYS 101           H        LYS 101 -37.548   0.873  -9.192
    2    HA   LYS 101           HA       LYS 101 -39.701   2.433 -10.183
    3    HB2  LYS 101           HB2      LYS 101 -39.461  -0.338  -9.067
    4    HB3  LYS 101           HB3      LYS 101 -41.046   0.355  -9.409
    5    HG2  LYS 101           HG2      LYS 101 -40.580   0.520 -11.705
    6    HG3  LYS 101           HG3      LYS 101 -38.867   0.189 -11.454
    7    HD2  LYS 101           HD2      LYS 101 -40.032  -1.768 -12.347
    8    HD3  LYS 101           HD3      LYS 101 -39.390  -2.077 -10.734
    9    HE2  LYS 101           HE2      LYS 101 -41.419  -2.865 -10.228
   10    HE3  LYS 101           HE3      LYS 101 -41.951  -1.183 -10.224
   11    HZ3  LYS 101           HZ1      LYS 101 -42.837  -1.370 -12.342
   12    HZ2  LYS 101           HZ2      LYS 101 -43.231  -2.865 -11.640
   13    HZ1  LYS 101           HZ3      LYS 101 -41.929  -2.755 -12.724

  No H/Q in entry =          13
  In of MODEL   57
    1    H    LYS 102           H        LYS 102 -39.142   0.965  -6.981
    2    HA   LYS 102           HA       LYS 102 -41.439   2.055  -5.777
    3    HB2  LYS 102           HB2      LYS 102 -40.120   0.241  -4.771
    4    HB3  LYS 102           HB3      LYS 102 -38.778   1.355  -4.524
    5    HG2  LYS 102           HG2      LYS 102 -40.154   2.684  -3.020
    6    HG3  LYS 102           HG3      LYS 102 -41.500   1.573  -3.269
    7    HD2  LYS 102           HD2      LYS 102 -40.192  -0.242  -2.252
    8    HD3  LYS 102           HD3      LYS 102 -38.846   0.871  -2.001
    9    HE2  LYS 102           HE2      LYS 102 -40.263   2.282  -0.585
   10    HE3  LYS 102           HE3      LYS 102 -41.628   1.199  -0.857
   11    HZ1  LYS 102           HZ1      LYS 102 -39.831  -0.482   0.138
   12    HZ3  LYS 102           HZ2      LYS 102 -40.979   0.349   1.073
   13    HZ2  LYS 102           HZ3      LYS 102 -39.393   0.945   0.947

  No H/Q in entry =          13
  In of MODEL   57
    1    H    ALA 103           H        ALA 103 -38.550   3.581  -6.785
    2    HA   ALA 103           HA       ALA 103 -38.874   5.875  -4.993
    3    HB2  ALA 103           HB1      ALA 103 -36.919   6.704  -6.566
    4    HB3  ALA 103           HB2      ALA 103 -36.807   4.991  -6.972
    5    HB1  ALA 103           HB3      ALA 103 -36.603   5.516  -5.301

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ALA 104           H        ALA 104 -39.464   5.132  -8.342
    2    HA   ALA 104           HA       ALA 104 -40.173   7.891  -8.951
    3    HB2  ALA 104           HB1      ALA 104 -40.187   7.231 -11.156
    4    HB1  ALA 104           HB2      ALA 104 -40.844   5.638 -10.785
    5    HB3  ALA 104           HB3      ALA 104 -39.135   5.975 -10.505

  No H/Q in entry =           5
  In of MODEL   57
    1    H    ALA 105           H        ALA 105 -41.685   5.709  -7.156
    2    HA   ALA 105           HA       ALA 105 -44.168   6.994  -7.122
    3    HB2  ALA 105           HB1      ALA 105 -44.875   6.110  -9.164
    4    HB3  ALA 105           HB2      ALA 105 -45.458   4.890  -8.033
    5    HB1  ALA 105           HB3      ALA 105 -43.975   4.611  -8.944

  No H/Q in entry =           5
  In of MODEL   58
    1    H1   ALA   1           H3       ALA   1 -12.027 -16.134  -2.395
    2    H2   ALA   1           H2       ALA   1 -11.067 -17.263  -3.231
    3    H3   ALA   1           H1       ALA   1 -12.225 -16.340  -4.068
    4    HA   ALA   1           HA       ALA   1 -13.596 -18.062  -3.824
    5    HB3  ALA   1           HB1      ALA   1 -12.173 -19.809  -3.356
    6    HB1  ALA   1           HB2      ALA   1 -12.932 -19.704  -1.768
    7    HB2  ALA   1           HB3      ALA   1 -11.368 -18.939  -2.050

  No H/Q in entry =           7
  In of MODEL   58
    1    H    GLU   2           H        GLU   2 -15.207 -18.937  -2.169
    2    HA   GLU   2           HA       GLU   2 -16.883 -17.240  -1.116
    3    HB2  GLU   2           HB2      GLU   2 -15.906 -19.645   0.437
    4    HB3  GLU   2           HB3      GLU   2 -17.444 -18.819   0.687
    5    HG2  GLU   2           HG2      GLU   2 -18.405 -19.926  -1.045
    6    HG3  GLU   2           HG3      GLU   2 -17.087 -19.508  -2.130

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLU   3           H        GLU   3 -14.951 -18.554   1.512
    2    HA   GLU   3           HA       GLU   3 -15.212 -16.200   3.062
    3    HB2  GLU   3           HB2      GLU   3 -13.586 -18.720   3.322
    4    HB3  GLU   3           HB3      GLU   3 -13.376 -17.393   4.465
    5    HG2  GLU   3           HG2      GLU   3 -15.568 -17.577   5.282
    6    HG3  GLU   3           HG3      GLU   3 -16.149 -18.391   3.835

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LEU   4           H        LEU   4 -12.232 -17.635   1.678
    2    HA   LEU   4           HA       LEU   4 -10.429 -15.701   2.272
    3    HB2  LEU   4           HB2      LEU   4 -10.637 -17.011  -0.449
    4    HB3  LEU   4           HB3      LEU   4  -9.197 -16.265   0.234
    5    HG   LEU   4           HG       LEU   4 -10.654 -18.682   1.353
    6   HD13  LEU   4          HD11      LEU   4  -8.999 -20.015   0.430
    7   HD12  LEU   4          HD12      LEU   4  -7.810 -18.713   0.400
    8   HD11  LEU   4          HD13      LEU   4  -9.097 -18.759  -0.804
    9   HD23  LEU   4          HD21      LEU   4  -8.403 -18.706   2.737
   10   HD22  LEU   4          HD22      LEU   4  -9.741 -17.686   3.262
   11   HD21  LEU   4          HD23      LEU   4  -8.389 -16.978   2.378

  No H/Q in entry =          11
  In of MODEL   58
    1    H    GLU   5           H        GLU   5 -12.765 -15.540  -0.405
    2    HA   GLU   5           HA       GLU   5 -11.800 -13.044  -1.413
    3    HB2  GLU   5           HB2      GLU   5 -13.121 -14.657  -2.769
    4    HB3  GLU   5           HB3      GLU   5 -14.527 -14.309  -1.764
    5    HG2  GLU   5           HG2      GLU   5 -14.424 -11.939  -2.414
    6    HG3  GLU   5           HG3      GLU   5 -13.000 -12.267  -3.403

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLU   6           H        GLU   6 -14.513 -13.958   0.680
    2    HA   GLU   6           HA       GLU   6 -15.460 -11.295   1.070
    3    HB2  GLU   6           HB2      GLU   6 -16.602 -13.630   1.539
    4    HB3  GLU   6           HB3      GLU   6 -15.856 -13.438   3.125
    5    HG2  GLU   6           HG2      GLU   6 -17.605 -11.345   1.802
    6    HG3  GLU   6           HG3      GLU   6 -18.179 -12.501   3.002

  No H/Q in entry =           6
  In of MODEL   58
    1    H    VAL   7           H        VAL   7 -13.121 -13.364   2.650
    2    HA   VAL   7           HA       VAL   7 -12.682 -11.775   4.973
    3    HB   VAL   7           HB       VAL   7 -10.945 -13.796   3.531
    4   HG11  VAL   7          HG11      VAL   7 -10.503 -12.247   6.091
    5   HG13  VAL   7          HG12      VAL   7  -9.399 -12.449   4.732
    6   HG12  VAL   7          HG13      VAL   7  -9.731 -13.808   5.806
    7   HG21  VAL   7          HG21      VAL   7 -13.188 -14.392   4.751
    8   HG23  VAL   7          HG22      VAL   7 -12.266 -14.098   6.226
    9   HG22  VAL   7          HG23      VAL   7 -11.752 -15.354   5.101

  No H/Q in entry =           9
  In of MODEL   58
    1    H    VAL   8           H        VAL   8 -11.166 -11.875   1.765
    2    HA   VAL   8           HA       VAL   8  -9.133  -9.969   2.254
    3    HB   VAL   8           HB       VAL   8 -10.583 -10.690  -0.305
    4   HG12  VAL   8          HG11      VAL   8  -8.391  -9.660  -1.282
    5   HG11  VAL   8          HG12      VAL   8  -8.281  -8.829   0.270
    6   HG13  VAL   8          HG13      VAL   8  -9.681  -8.571  -0.770
    7   HG22  VAL   8          HG21      VAL   8  -9.030 -12.378  -0.554
    8   HG21  VAL   8          HG22      VAL   8  -8.875 -12.234   1.194
    9   HG23  VAL   8          HG23      VAL   8  -7.726 -11.413   0.143

  No H/Q in entry =           9
  In of MODEL   58
    1    H    MET   9           H        MET   9 -12.483  -9.636   1.089
    2    HA   MET   9           HA       MET   9 -12.463  -6.860   0.646
    3    HB2  MET   9           HB2      MET   9 -14.616  -8.818   1.399
    4    HB3  MET   9           HB3      MET   9 -14.969  -7.089   1.342
    5    HG2  MET   9           HG2      MET   9 -13.907  -7.123  -1.000
    6    HG3  MET   9           HG3      MET   9 -14.036  -8.879  -0.903
    7    HE3  MET   9           HE1      MET   9 -17.556  -9.815  -1.117
    8    HE2  MET   9           HE2      MET   9 -16.824  -9.616   0.473
    9    HE1  MET   9           HE3      MET   9 -15.850 -10.213  -0.868

  No H/Q in entry =           9
  In of MODEL   58
    1    H    GLY  10           H        GLY  10 -13.099  -8.752   3.578
    2    HA3  GLY  10           HA2      GLY  10 -13.684  -6.571   5.289
    3    HA2  GLY  10           HA3      GLY  10 -13.095  -8.149   5.809

  No H/Q in entry =           3
  In of MODEL   58
    1    H    LEU  11           H        LEU  11 -10.646  -8.238   4.497
    2    HA   LEU  11           HA       LEU  11  -8.971  -6.771   6.251
    3    HB2  LEU  11           HB2      LEU  11  -8.398  -8.194   3.649
    4    HB3  LEU  11           HB3      LEU  11  -7.141  -7.466   4.646
    5    HG   LEU  11           HG       LEU  11  -9.111  -9.528   5.667
    6   HD13  LEU  11          HD11      LEU  11  -7.868 -10.750   4.108
    7   HD12  LEU  11          HD12      LEU  11  -6.930 -10.968   5.585
    8   HD11  LEU  11          HD13      LEU  11  -6.407  -9.798   4.374
    9   HD22  LEU  11          HD21      LEU  11  -8.276  -8.495   7.582
   10   HD21  LEU  11          HD22      LEU  11  -6.745  -8.071   6.819
   11   HD23  LEU  11          HD23      LEU  11  -7.044  -9.731   7.334

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  12           H        ILE  12  -9.878  -6.250   2.859
    2    HA   ILE  12           HA       ILE  12  -8.223  -3.994   2.427
    3    HB   ILE  12           HB       ILE  12 -10.864  -4.709   1.130
    4   HG12  ILE  12          HG12      ILE  12  -8.808  -6.335   1.065
    5   HG13  ILE  12          HG13      ILE  12  -9.667  -5.992  -0.422
    6   HG23  ILE  12          HG21      ILE  12 -10.329  -2.382   0.679
    7   HG22  ILE  12          HG22      ILE  12  -9.948  -3.309  -0.768
    8   HG21  ILE  12          HG23      ILE  12  -8.684  -2.804   0.316
    9   HD13  ILE  12          HD11      ILE  12  -7.961  -4.401  -1.078
   10   HD12  ILE  12          HD12      ILE  12  -7.171  -5.909  -0.628
   11   HD11  ILE  12          HD13      ILE  12  -7.165  -4.556   0.477

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  13           H        ILE  13 -11.580  -4.313   3.517
    2    HA   ILE  13           HA       ILE  13 -12.087  -1.534   3.777
    3    HB   ILE  13           HB       ILE  13 -13.252  -3.963   5.160
    4   HG12  ILE  13          HG12      ILE  13 -13.471  -3.484   2.616
    5   HG13  ILE  13          HG13      ILE  13 -14.903  -3.929   3.520
    6   HG22  ILE  13          HG21      ILE  13 -15.203  -2.225   5.547
    7   HG21  ILE  13          HG22      ILE  13 -13.904  -1.042   5.475
    8   HG23  ILE  13          HG23      ILE  13 -13.868  -2.315   6.693
    9   HD12  ILE  13          HD11      ILE  13 -14.901  -1.806   1.899
   10   HD11  ILE  13          HD12      ILE  13 -14.240  -1.045   3.333
   11   HD13  ILE  13          HD13      ILE  13 -15.809  -1.814   3.415

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ASN  14           H        ASN  14 -10.936  -3.997   6.061
    2    HA   ASN  14           HA       ASN  14 -10.767  -2.349   8.342
    3    HB2  ASN  14           HB2      ASN  14 -10.468  -4.952   8.029
    4    HB3  ASN  14           HB3      ASN  14  -8.766  -4.536   7.872
    5   HD21  ASN  14          HD21      ASN  14  -9.379  -6.064  10.052
    6   HD22  ASN  14          HD22      ASN  14  -9.369  -5.139  11.474

  No H/Q in entry =           6
  In of MODEL   58
    1    H    SER  15           H        SER  15  -8.347  -3.138   5.856
    2    HA   SER  15           HA       SER  15  -6.232  -1.605   6.925
    3    HB2  SER  15           HB2      SER  15  -5.207  -1.806   4.766
    4    HB3  SER  15           HB3      SER  15  -6.130  -3.285   5.000
    5    HG   SER  15           HG       SER  15  -7.277  -2.754   3.339

  No H/Q in entry =           5
  In of MODEL   58
    1    H    GLY  16           H        GLY  16  -8.845  -0.792   4.672
    2    HA3  GLY  16           HA2      GLY  16  -8.034   1.862   4.112
    3    HA2  GLY  16           HA3      GLY  16  -9.674   1.237   3.951

  No H/Q in entry =           3
  In of MODEL   58
    1    H    GLN  17           H        GLN  17 -10.207   0.511   6.602
    2    HA   GLN  17           HA       GLN  17 -10.961   3.007   7.733
    3    HB2  GLN  17           HB2      GLN  17 -12.152   0.896   8.222
    4    HB3  GLN  17           HB3      GLN  17 -10.737   0.310   9.097
    5    HG2  GLN  17           HG2      GLN  17 -10.913   2.231  10.649
    6    HG3  GLN  17           HG3      GLN  17 -12.348   2.784   9.788
    7   HE21  GLN  17          HE21      GLN  17 -13.994   2.380  11.320
    8   HE22  GLN  17          HE22      GLN  17 -14.293   0.853  12.000

  No H/Q in entry =           8
  In of MODEL   58
    1    H    ALA  18           H        ALA  18  -8.291   0.776   8.364
    2    HA   ALA  18           HA       ALA  18  -7.220   2.020  10.632
    3    HB2  ALA  18           HB1      ALA  18  -6.567  -0.189   9.273
    4    HB3  ALA  18           HB2      ALA  18  -5.420   0.619  10.342
    5    HB1  ALA  18           HB3      ALA  18  -5.346   0.893   8.601

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ARG  19           H        ARG  19  -6.453   2.546   7.182
    2    HA   ARG  19           HA       ARG  19  -4.595   4.630   7.606
    3    HB2  ARG  19           HB2      ARG  19  -4.897   3.476   5.414
    4    HB3  ARG  19           HB3      ARG  19  -6.455   4.287   5.233
    5    HG2  ARG  19           HG2      ARG  19  -5.368   6.480   5.295
    6    HG3  ARG  19           HG3      ARG  19  -3.805   5.725   5.604
    7    HD2  ARG  19           HD2      ARG  19  -3.938   6.304   3.258
    8    HD3  ARG  19           HD3      ARG  19  -3.990   4.544   3.410
    9    HE   ARG  19           HE       ARG  19  -6.640   5.402   3.396
   10   HH21  ARG  19          HH11      ARG  19  -7.835   5.529   1.475
   11   HH22  ARG  19          HH12      ARG  19  -7.013   5.617  -0.043
   12   HH11  ARG  19          HH21      ARG  19  -3.864   5.511   1.365
   13   HH12  ARG  19          HH22      ARG  19  -4.763   5.604  -0.106

  No H/Q in entry =          13
  In of MODEL   58
    1    H    SER  20           H        SER  20  -8.094   4.676   7.001
    2    HA   SER  20           HA       SER  20  -8.504   7.424   6.942
    3    HB2  SER  20           HB2      SER  20 -10.268   5.778   6.449
    4    HB3  SER  20           HB3      SER  20 -10.311   5.319   8.149
    5    HG   SER  20           HG       SER  20 -10.847   7.888   7.057

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LEU  21           H        LEU  21  -8.466   5.252   9.754
    2    HA   LEU  21           HA       LEU  21  -8.948   7.246  11.711
    3    HB2  LEU  21           HB2      LEU  21  -7.541   4.573  11.886
    4    HB3  LEU  21           HB3      LEU  21  -7.877   5.588  13.284
    5    HG   LEU  21           HG       LEU  21 -10.021   4.642  11.358
    6   HD13  LEU  21          HD11      LEU  21  -9.030   2.689  12.416
    7   HD12  LEU  21          HD12      LEU  21 -10.595   3.005  13.164
    8   HD11  LEU  21          HD13      LEU  21  -9.109   3.463  13.999
    9   HD23  LEU  21          HD21      LEU  21 -11.381   5.111  13.573
   10   HD22  LEU  21          HD22      LEU  21 -10.943   6.471  12.543
   11   HD21  LEU  21          HD23      LEU  21 -10.008   6.131  13.991

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ALA  22           H        ALA  22  -5.967   5.926  10.313
    2    HA   ALA  22           HA       ALA  22  -4.116   7.282  11.933
    3    HB2  ALA  22           HB1      ALA  22  -3.661   5.431  10.250
    4    HB1  ALA  22           HB2      ALA  22  -2.491   6.751  10.282
    5    HB3  ALA  22           HB3      ALA  22  -3.706   6.678   9.004

  No H/Q in entry =           5
  In of MODEL   58
    1    H    TYR  23           H        TYR  23  -5.448   8.261   8.745
    2    HA   TYR  23           HA       TYR  23  -4.162  10.783   8.668
    3    HB2  TYR  23           HB2      TYR  23  -5.220   9.844   6.677
    4    HB3  TYR  23           HB3      TYR  23  -6.802   9.920   7.455
    5    HD1  TYR  23           HD1      TYR  23  -3.936  12.029   6.325
    6    HD2  TYR  23           HD2      TYR  23  -8.090  11.896   7.407
    7    HE1  TYR  23           HE1      TYR  23  -4.210  14.371   5.556
    8    HE2  TYR  23           HE2      TYR  23  -8.364  14.238   6.639
    9    HH   TYR  23           HH       TYR  23  -7.326  15.839   5.220

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ALA  24           H        ALA  24  -7.264   9.749  10.046
    2    HA   ALA  24           HA       ALA  24  -8.153  12.324  10.806
    3    HB1  ALA  24           HB1      ALA  24  -9.947  11.039  11.275
    4    HB2  ALA  24           HB2      ALA  24  -9.112  10.489  12.726
    5    HB3  ALA  24           HB3      ALA  24  -8.966   9.574  11.226

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ALA  25           H        ALA  25  -6.105   9.912  12.392
    2    HA   ALA  25           HA       ALA  25  -5.797  11.180  14.890
    3    HB2  ALA  25           HB1      ALA  25  -4.982   8.841  14.079
    4    HB3  ALA  25           HB2      ALA  25  -3.986   9.724  15.239
    5    HB1  ALA  25           HB3      ALA  25  -3.546   9.709  13.530

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LEU  26           H        LEU  26  -4.007  11.504  11.852
    2    HA   LEU  26           HA       LEU  26  -2.087  13.366  12.765
    3    HB2  LEU  26           HB2      LEU  26  -1.759  12.213  10.666
    4    HB3  LEU  26           HB3      LEU  26  -3.245  12.889  10.006
    5    HG   LEU  26           HG       LEU  26  -2.275  15.159  10.135
    6   HD12  LEU  26          HD11      LEU  26   0.262  15.231  10.553
    7   HD11  LEU  26          HD12      LEU  26   0.068  13.649  11.303
    8   HD13  LEU  26          HD13      LEU  26  -0.768  15.050  11.973
    9   HD21  LEU  26          HD21      LEU  26  -0.489  13.135   8.750
   10   HD23  LEU  26          HD22      LEU  26  -0.566  14.854   8.374
   11   HD22  LEU  26          HD23      LEU  26  -1.968  13.827   8.087

  No H/Q in entry =          11
  In of MODEL   58
    1    H    LYS  27           H        LYS  27  -5.275  13.780  11.280
    2    HA   LYS  27           HA       LYS  27  -5.275  16.568  11.072
    3    HB2  LYS  27           HB2      LYS  27  -6.987  15.054  10.089
    4    HB3  LYS  27           HB3      LYS  27  -7.642  14.790  11.705
    5    HG2  LYS  27           HG2      LYS  27  -8.119  17.188  11.931
    6    HG3  LYS  27           HG3      LYS  27  -7.414  17.493  10.341
    7    HD2  LYS  27           HD2      LYS  27  -9.116  16.022   9.307
    8    HD3  LYS  27           HD3      LYS  27  -9.827  15.733  10.896
    9    HE2  LYS  27           HE2      LYS  27 -10.317  18.136  11.130
   10    HE3  LYS  27           HE3      LYS  27  -9.579  18.447   9.555
   11    HZ3  LYS  27           HZ1      LYS  27 -11.953  18.274   9.310
   12    HZ2  LYS  27           HZ2      LYS  27 -11.973  16.760  10.085
   13    HZ1  LYS  27           HZ3      LYS  27 -11.228  16.933   8.564

  No H/Q in entry =          13
  In of MODEL   58
    1    H    GLN  28           H        GLN  28  -6.127  14.475  13.805
    2    HA   GLN  28           HA       GLN  28  -7.064  16.468  15.573
    3    HB2  GLN  28           HB2      GLN  28  -5.610  13.868  16.130
    4    HB3  GLN  28           HB3      GLN  28  -6.380  14.861  17.369
    5    HG2  GLN  28           HG2      GLN  28  -7.804  13.699  14.959
    6    HG3  GLN  28           HG3      GLN  28  -7.855  13.016  16.582
    7   HE21  GLN  28          HE21      GLN  28  -9.730  14.805  14.585
    8   HE22  GLN  28          HE22      GLN  28 -10.516  15.796  15.715

  No H/Q in entry =           8
  In of MODEL   58
    1    H    ALA  29           H        ALA  29  -3.820  15.230  14.893
    2    HA   ALA  29           HA       ALA  29  -2.412  16.661  16.869
    3    HB1  ALA  29           HB1      ALA  29  -0.467  16.002  15.755
    4    HB3  ALA  29           HB2      ALA  29  -1.221  16.107  14.164
    5    HB2  ALA  29           HB3      ALA  29  -1.620  14.770  15.243

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LYS  30           H        LYS  30  -3.280  17.513  13.535
    2    HA   LYS  30           HA       LYS  30  -1.912  19.977  13.428
    3    HB2  LYS  30           HB2      LYS  30  -4.425  19.055  12.018
    4    HB3  LYS  30           HB3      LYS  30  -3.617  20.582  11.670
    5    HG2  LYS  30           HG2      LYS  30  -1.525  19.323  11.164
    6    HG3  LYS  30           HG3      LYS  30  -2.406  17.813  11.413
    7    HD2  LYS  30           HD2      LYS  30  -3.978  18.420   9.614
    8    HD3  LYS  30           HD3      LYS  30  -3.120  19.942   9.367
    9    HE2  LYS  30           HE2      LYS  30  -1.066  18.681   8.795
   10    HE3  LYS  30           HE3      LYS  30  -1.943  17.164   9.011
   11    HZ2  LYS  30           HZ1      LYS  30  -1.777  18.030   6.666
   12    HZ1  LYS  30           HZ2      LYS  30  -2.842  19.277   7.129
   13    HZ3  LYS  30           HZ3      LYS  30  -3.340  17.652   7.205

  No H/Q in entry =          13
  In of MODEL   58
    1    H    GLN  31           H        GLN  31  -5.000  19.079  14.839
    2    HA   GLN  31           HA       GLN  31  -5.808  21.825  15.280
    3    HB2  GLN  31           HB2      GLN  31  -6.950  19.365  16.610
    4    HB3  GLN  31           HB3      GLN  31  -7.735  20.923  16.358
    5    HG2  GLN  31           HG2      GLN  31  -7.009  20.149  13.772
    6    HG3  GLN  31           HG3      GLN  31  -7.511  18.639  14.523
    7   HE21  GLN  31          HE21      GLN  31  -8.942  20.183  12.414
    8   HE22  GLN  31          HE22      GLN  31 -10.463  20.554  13.069

  No H/Q in entry =           8
  In of MODEL   58
    1    H    GLY  32           H        GLY  32  -3.468  19.938  16.610
    2    HA3  GLY  32           HA2      GLY  32  -2.077  20.428  18.412
    3    HA2  GLY  32           HA3      GLY  32  -3.226  21.655  18.930

  No H/Q in entry =           3
  In of MODEL   58
    1    H    ASP  33           H        ASP  33  -4.601  18.592  18.277
    2    HA   ASP  33           HA       ASP  33  -5.008  18.137  21.157
    3    HB2  ASP  33           HB2      ASP  33  -6.395  17.097  18.681
    4    HB3  ASP  33           HB3      ASP  33  -6.733  16.486  20.299

  No H/Q in entry =           4
  In of MODEL   58
    1    H    PHE  34           H        PHE  34  -2.827  17.320  21.468
    2    HA   PHE  34           HA       PHE  34  -1.791  15.082  20.075
    3    HB2  PHE  34           HB2      PHE  34  -1.192  16.085  22.867
    4    HB3  PHE  34           HB3      PHE  34  -0.244  14.873  22.005
    5    HD1  PHE  34           HD1      PHE  34  -0.469  18.298  22.729
    6    HD2  PHE  34           HD2      PHE  34   0.406  15.598  19.504
    7    HE1  PHE  34           HE1      PHE  34   0.801  20.085  21.571
    8    HE2  PHE  34           HE2      PHE  34   1.671  17.388  18.351
    9    HZ   PHE  34           HZ       PHE  34   1.870  19.629  19.389

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ALA  35           H        ALA  35  -3.838  15.337  22.935
    2    HA   ALA  35           HA       ALA  35  -3.587  12.682  23.840
    3    HB3  ALA  35           HB1      ALA  35  -6.055  13.273  24.693
    4    HB1  ALA  35           HB2      ALA  35  -5.545  14.898  24.233
    5    HB2  ALA  35           HB3      ALA  35  -4.619  13.991  25.428

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ALA  36           H        ALA  36  -6.057  14.155  21.733
    2    HA   ALA  36           HA       ALA  36  -7.435  11.721  21.261
    3    HB1  ALA  36           HB1      ALA  36  -8.911  13.118  20.299
    4    HB3  ALA  36           HB2      ALA  36  -7.744  13.552  19.050
    5    HB2  ALA  36           HB3      ALA  36  -7.783  14.444  20.571

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ALA  37           H        ALA  37  -4.777  13.343  19.590
    2    HA   ALA  37           HA       ALA  37  -4.715  11.702  17.298
    3    HB3  ALA  37           HB1      ALA  37  -2.750  13.448  18.718
    4    HB2  ALA  37           HB2      ALA  37  -3.279  13.490  17.037
    5    HB1  ALA  37           HB3      ALA  37  -2.108  12.279  17.563

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LYS  38           H        LYS  38  -2.957  11.431  20.379
    2    HA   LYS  38           HA       LYS  38  -1.595   9.050  19.899
    3    HB2  LYS  38           HB2      LYS  38  -1.947  10.814  22.039
    4    HB3  LYS  38           HB3      LYS  38  -2.543   9.277  22.659
    5    HG2  LYS  38           HG2      LYS  38  -0.432   8.187  22.128
    6    HG3  LYS  38           HG3      LYS  38   0.156   9.639  21.311
    7    HD2  LYS  38           HD2      LYS  38   0.304  10.866  23.342
    8    HD3  LYS  38           HD3      LYS  38  -0.698   9.703  24.212
    9    HE2  LYS  38           HE2      LYS  38   1.661   9.424  24.834
   10    HE3  LYS  38           HE3      LYS  38   1.079   7.997  23.974
   11    HZ3  LYS  38           HZ1      LYS  38   2.375   8.430  22.193
   12    HZ2  LYS  38           HZ2      LYS  38   3.316   9.276  23.328
   13    HZ1  LYS  38           HZ3      LYS  38   2.225  10.116  22.333

  No H/Q in entry =          13
  In of MODEL   58
    1    H    ALA  39           H        ALA  39  -4.842   9.500  21.296
    2    HA   ALA  39           HA       ALA  39  -5.362   6.774  21.808
    3    HB3  ALA  39           HB1      ALA  39  -7.549   8.684  21.033
    4    HB2  ALA  39           HB2      ALA  39  -6.656   8.929  22.534
    5    HB1  ALA  39           HB3      ALA  39  -7.550   7.430  22.274

  No H/Q in entry =           5
  In of MODEL   58
    1    H    MET  40           H        MET  40  -5.974   8.770  18.955
    2    HA   MET  40           HA       MET  40  -7.419   6.811  17.499
    3    HB2  MET  40           HB2      MET  40  -5.845   9.228  16.589
    4    HB3  MET  40           HB3      MET  40  -6.855   8.251  15.520
    5    HG2  MET  40           HG2      MET  40  -7.911   9.491  18.074
    6    HG3  MET  40           HG3      MET  40  -7.979  10.320  16.521
    7    HE3  MET  40           HE1      MET  40 -10.535   8.655  14.458
    8    HE2  MET  40           HE2      MET  40  -8.785   8.799  14.312
    9    HE1  MET  40           HE3      MET  40  -9.724  10.152  14.940

  No H/Q in entry =           9
  In of MODEL   58
    1    H    MET  41           H        MET  41  -3.940   7.603  17.623
    2    HA   MET  41           HA       MET  41  -3.152   5.854  15.529
    3    HB2  MET  41           HB2      MET  41  -1.549   6.553  18.002
    4    HB3  MET  41           HB3      MET  41  -0.919   5.910  16.489
    5    HG2  MET  41           HG2      MET  41  -2.108   8.072  15.477
    6    HG3  MET  41           HG3      MET  41  -1.883   8.668  17.120
    7    HE2  MET  41           HE1      MET  41   1.067   6.617  17.491
    8    HE1  MET  41           HE2      MET  41   0.257   7.901  18.385
    9    HE3  MET  41           HE3      MET  41   1.877   8.168  17.743

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ASP  42           H        ASP  42  -3.533   5.385  19.016
    2    HA   ASP  42           HA       ASP  42  -2.457   2.808  19.185
    3    HB2  ASP  42           HB2      ASP  42  -3.361   4.559  21.001
    4    HB3  ASP  42           HB3      ASP  42  -4.771   3.511  20.930

  No H/Q in entry =           4
  In of MODEL   58
    1    H    GLN  43           H        GLN  43  -5.807   3.858  18.677
    2    HA   GLN  43           HA       GLN  43  -6.909   1.252  18.488
    3    HB2  GLN  43           HB2      GLN  43  -7.873   3.886  17.350
    4    HB3  GLN  43           HB3      GLN  43  -8.812   2.392  17.331
    5    HG2  GLN  43           HG2      GLN  43  -8.520   2.282  19.839
    6    HG3  GLN  43           HG3      GLN  43  -7.821   3.898  19.764
    7   HE21  GLN  43          HE21      GLN  43 -10.003   3.948  21.262
    8   HE22  GLN  43          HE22      GLN  43 -11.372   4.499  20.427

  No H/Q in entry =           8
  In of MODEL   58
    1    H    SER  44           H        SER  44  -5.601   3.480  16.072
    2    HA   SER  44           HA       SER  44  -6.275   1.978  13.786
    3    HB2  SER  44           HB2      SER  44  -5.057   4.383  14.224
    4    HB3  SER  44           HB3      SER  44  -3.687   3.407  13.699
    5    HG   SER  44           HG       SER  44  -4.812   4.356  11.932

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ARG  45           H        ARG  45  -3.399   1.917  15.870
    2    HA   ARG  45           HA       ARG  45  -1.886  -0.017  14.496
    3    HB2  ARG  45           HB2      ARG  45  -1.069   1.423  16.361
    4    HB3  ARG  45           HB3      ARG  45  -2.048   0.479  17.483
    5    HG2  ARG  45           HG2      ARG  45  -0.782  -1.561  16.848
    6    HG3  ARG  45           HG3      ARG  45   0.219  -0.593  15.768
    7    HD2  ARG  45           HD2      ARG  45   0.929   0.805  17.721
    8    HD3  ARG  45           HD3      ARG  45   0.022  -0.282  18.797
    9    HE   ARG  45           HE       ARG  45   1.749  -1.855  17.223
   10   HH21  ARG  45          HH11      ARG  45   3.661  -2.645  18.065
   11   HH22  ARG  45          HH12      ARG  45   4.419  -1.843  19.395
   12   HH11  ARG  45          HH21      ARG  45   2.010   0.623  19.606
   13   HH12  ARG  45          HH22      ARG  45   3.484   0.010  20.265

  No H/Q in entry =          13
  In of MODEL   58
    1    H    MET  46           H        MET  46  -4.282  -0.368  17.093
    2    HA   MET  46           HA       MET  46  -4.070  -3.164  17.408
    3    HB2  MET  46           HB2      MET  46  -6.272  -1.190  18.000
    4    HB3  MET  46           HB3      MET  46  -6.452  -2.913  18.344
    5    HG2  MET  46           HG2      MET  46  -4.474  -2.875  19.772
    6    HG3  MET  46           HG3      MET  46  -4.175  -1.191  19.367
    7    HE1  MET  46           HE1      MET  46  -6.292  -3.803  20.907
    8    HE3  MET  46           HE2      MET  46  -7.738  -3.013  20.287
    9    HE2  MET  46           HE3      MET  46  -7.418  -3.013  22.019

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ALA  47           H        ALA  47  -6.119  -1.184  15.305
    2    HA   ALA  47           HA       ALA  47  -7.703  -3.263  14.242
    3    HB3  ALA  47           HB1      ALA  47  -8.416  -1.037  13.819
    4    HB1  ALA  47           HB2      ALA  47  -7.915  -1.667  12.250
    5    HB2  ALA  47           HB3      ALA  47  -6.853  -0.580  13.146

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LEU  48           H        LEU  48  -4.603  -1.910  13.193
    2    HA   LEU  48           HA       LEU  48  -4.294  -3.501  10.856
    3    HB2  LEU  48           HB2      LEU  48  -2.259  -2.188  12.664
    4    HB3  LEU  48           HB3      LEU  48  -1.877  -2.907  11.100
    5    HG   LEU  48           HG       LEU  48  -3.933  -0.719  11.480
    6   HD13  LEU  48          HD11      LEU  48  -1.826   0.191  12.147
    7   HD12  LEU  48          HD12      LEU  48  -2.106   0.736  10.493
    8   HD11  LEU  48          HD13      LEU  48  -0.990  -0.593  10.807
    9   HD22  LEU  48          HD21      LEU  48  -4.387  -1.715   9.406
   10   HD21  LEU  48          HD22      LEU  48  -2.697  -2.126   9.115
   11   HD23  LEU  48          HD23      LEU  48  -3.241  -0.455   8.950

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ASN  49           H        ASN  49  -3.248  -3.874  14.205
    2    HA   ASN  49           HA       ASN  49  -1.613  -6.115  13.883
    3    HB2  ASN  49           HB2      ASN  49  -1.639  -4.796  15.929
    4    HB3  ASN  49           HB3      ASN  49  -3.306  -5.254  16.243
    5   HD21  ASN  49          HD21      ASN  49  -0.050  -6.696  15.851
    6   HD22  ASN  49          HD22      ASN  49  -0.332  -7.992  16.910

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLU  50           H        GLU  50  -5.086  -5.887  14.548
    2    HA   GLU  50           HA       GLU  50  -5.559  -8.693  14.663
    3    HB2  GLU  50           HB2      GLU  50  -7.170  -7.026  15.532
    4    HB3  GLU  50           HB3      GLU  50  -7.468  -6.470  13.883
    5    HG2  GLU  50           HG2      GLU  50  -8.302  -8.680  13.249
    6    HG3  GLU  50           HG3      GLU  50  -7.914  -9.314  14.845

  No H/Q in entry =           6
  In of MODEL   58
    1    H    ALA  51           H        ALA  51  -5.656  -6.303  12.061
    2    HA   ALA  51           HA       ALA  51  -6.614  -8.049  10.041
    3    HB2  ALA  51           HB1      ALA  51  -6.416  -6.237   8.668
    4    HB1  ALA  51           HB2      ALA  51  -4.782  -5.864   9.218
    5    HB3  ALA  51           HB3      ALA  51  -6.175  -5.369  10.183

  No H/Q in entry =           5
  In of MODEL   58
    1    H    HIS  52           H        HIS  52  -3.337  -7.095  11.029
    2    HA   HIS  52           HA       HIS  52  -1.915  -8.571   9.085
    3    HB2  HIS  52           HB2      HIS  52  -0.896  -6.824  10.509
    4    HB3  HIS  52           HB3      HIS  52  -1.075  -7.878  11.911
    5    HD1  HIS  52           HD1      HIS  52   0.272 -10.209  11.786
    6    HD2  HIS  52           HD2      HIS  52   1.373  -7.336   8.972
    7    HE1  HIS  52           HE1      HIS  52   2.518 -10.930  10.867
    8    HE2  HIS  52           HE2      HIS  52   3.203  -9.189   9.150

  No H/Q in entry =           8
  In of MODEL   58
    1    H    LEU  53           H        LEU  53  -3.121  -9.456  12.298
    2    HA   LEU  53           HA       LEU  53  -1.892 -11.984  12.500
    3    HB2  LEU  53           HB2      LEU  53  -4.390 -10.826  13.708
    4    HB3  LEU  53           HB3      LEU  53  -3.920 -12.499  14.001
    5    HG   LEU  53           HG       LEU  53  -2.034 -10.170  14.480
    6   HD12  LEU  53          HD11      LEU  53  -3.775 -11.598  16.512
    7   HD11  LEU  53          HD12      LEU  53  -4.107  -9.988  15.873
    8   HD13  LEU  53          HD13      LEU  53  -2.658 -10.275  16.829
    9   HD21  LEU  53          HD21      LEU  53  -2.050 -13.110  15.179
   10   HD23  LEU  53          HD22      LEU  53  -1.143 -11.965  16.163
   11   HD22  LEU  53          HD23      LEU  53  -0.744 -12.168  14.467

  No H/Q in entry =          11
  In of MODEL   58
    1    H    VAL  54           H        VAL  54  -5.013 -10.997  11.129
    2    HA   VAL  54           HA       VAL  54  -5.893 -13.604  10.447
    3    HB   VAL  54           HB       VAL  54  -6.572 -10.882   9.305
    4   HG12  VAL  54          HG11      VAL  54  -8.655 -12.288   8.492
    5   HG11  VAL  54          HG12      VAL  54  -7.526 -13.640   8.570
    6   HG13  VAL  54          HG13      VAL  54  -7.182 -12.263   7.525
    7   HG22  VAL  54          HG21      VAL  54  -7.482 -10.926  11.454
    8   HG21  VAL  54          HG22      VAL  54  -7.715 -12.673  11.439
    9   HG23  VAL  54          HG23      VAL  54  -8.807 -11.631  10.528

  No H/Q in entry =           9
  In of MODEL   58
    1    H    GLN  55           H        GLN  55  -4.048 -11.135   8.655
    2    HA   GLN  55           HA       GLN  55  -3.896 -12.603   6.242
    3    HB2  GLN  55           HB2      GLN  55  -3.319 -10.332   6.047
    4    HB3  GLN  55           HB3      GLN  55  -2.210 -10.392   7.415
    5    HG2  GLN  55           HG2      GLN  55  -0.480 -11.220   6.144
    6    HG3  GLN  55           HG3      GLN  55  -1.540 -12.210   5.150
    7   HE21  GLN  55          HE21      GLN  55  -1.561 -11.526   3.027
    8   HE22  GLN  55          HE22      GLN  55  -1.382  -9.920   2.513

  No H/Q in entry =           8
  In of MODEL   58
    1    H    THR  56           H        THR  56  -1.796 -12.550   9.126
    2    HA   THR  56           HA       THR  56   0.303 -14.126   8.217
    3    HB   THR  56           HB       THR  56  -0.942 -14.383  10.963
    4    HG1  THR  56           HG1      THR  56   0.437 -12.323   9.716
    5   HG21  THR  56          HG21      THR  56   1.023 -15.872  10.038
    6   HG23  THR  56          HG22      THR  56   1.129 -15.182  11.659
    7   HG22  THR  56          HG23      THR  56   1.987 -14.422  10.318

  No H/Q in entry =           7
  In of MODEL   58
    1    H    LYS  57           H        LYS  57  -2.807 -15.196   9.577
    2    HA   LYS  57           HA       LYS  57  -2.328 -17.987   9.339
    3    HB2  LYS  57           HB2      LYS  57  -4.157 -16.952  10.688
    4    HB3  LYS  57           HB3      LYS  57  -4.942 -16.450   9.197
    5    HG2  LYS  57           HG2      LYS  57  -6.015 -18.472   9.934
    6    HG3  LYS  57           HG3      LYS  57  -5.047 -18.873   8.518
    7    HD2  LYS  57           HD2      LYS  57  -3.355 -19.910   9.835
    8    HD3  LYS  57           HD3      LYS  57  -3.979 -19.213  11.329
    9    HE2  LYS  57           HE2      LYS  57  -6.013 -20.587  11.147
   10    HE3  LYS  57           HE3      LYS  57  -5.453 -21.258   9.616
   11    HZ3  LYS  57           HZ1      LYS  57  -4.590 -22.842  10.906
   12    HZ2  LYS  57           HZ2      LYS  57  -4.656 -21.893  12.315
   13    HZ1  LYS  57           HZ3      LYS  57  -3.360 -21.718  11.229

  No H/Q in entry =          13
  In of MODEL   58
    1    H    LEU  58           H        LEU  58  -3.683 -15.565   7.154
    2    HA   LEU  58           HA       LEU  58  -4.461 -17.404   5.151
    3    HB2  LEU  58           HB2      LEU  58  -3.888 -14.449   5.009
    4    HB3  LEU  58           HB3      LEU  58  -4.538 -15.397   3.670
    5    HG   LEU  58           HG       LEU  58  -5.825 -15.226   6.415
    6   HD11  LEU  58          HD11      LEU  58  -6.139 -13.588   3.919
    7   HD13  LEU  58          HD12      LEU  58  -6.138 -13.077   5.606
    8   HD12  LEU  58          HD13      LEU  58  -7.550 -13.888   4.934
    9   HD22  LEU  58          HD21      LEU  58  -6.764 -17.148   5.548
   10   HD21  LEU  58          HD22      LEU  58  -6.426 -16.696   3.877
   11   HD23  LEU  58          HD23      LEU  58  -7.799 -15.984   4.723

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  59           H        ILE  59  -1.341 -16.156   6.015
    2    HA   ILE  59           HA       ILE  59  -0.229 -16.877   3.383
    3    HB   ILE  59           HB       ILE  59   0.512 -14.800   4.949
    4   HG12  ILE  59          HG12      ILE  59   2.634 -16.421   3.531
    5   HG13  ILE  59          HG13      ILE  59   1.419 -15.518   2.662
    6   HG23  ILE  59          HG21      ILE  59   2.364 -15.261   6.340
    7   HG22  ILE  59          HG22      ILE  59   2.622 -16.845   5.644
    8   HG21  ILE  59          HG23      ILE  59   1.257 -16.559   6.725
    9   HD12  ILE  59          HD11      ILE  59   3.608 -14.290   3.070
   10   HD11  ILE  59          HD12      ILE  59   3.157 -14.251   4.772
   11   HD13  ILE  59          HD13      ILE  59   2.153 -13.434   3.574

  No H/Q in entry =          11
  In of MODEL   58
    1    H    GLU  60           H        GLU  60  -0.235 -17.975   6.753
    2    HA   GLU  60           HA       GLU  60   1.819 -19.930   6.498
    3    HB2  GLU  60           HB2      GLU  60   1.001 -19.120   8.679
    4    HB3  GLU  60           HB3      GLU  60  -0.560 -19.877   8.374
    5    HG2  GLU  60           HG2      GLU  60   0.547 -22.092   8.248
    6    HG3  GLU  60           HG3      GLU  60   2.099 -21.324   8.580

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLY  61           H        GLY  61  -1.689 -20.069   6.005
    2    HA3  GLY  61           HA2      GLY  61  -1.407 -22.861   5.054
    3    HA2  GLY  61           HA3      GLY  61  -2.902 -22.141   5.642

  No H/Q in entry =           3
  In of MODEL   58
    1    H    ASP  62           H        ASP  62  -0.685 -20.543   3.440
    2    HA   ASP  62           HA       ASP  62  -2.666 -19.788   1.614
    3    HB2  ASP  62           HB2      ASP  62  -0.736 -19.234   0.134
    4    HB3  ASP  62           HB3      ASP  62  -0.561 -18.607   1.770

  No H/Q in entry =           4
  In of MODEL   58
    1    H    ALA  63           H        ALA  63  -1.486 -22.901   2.080
    2    HA   ALA  63           HA       ALA  63  -1.572 -23.756  -0.711
    3    HB3  ALA  63           HB1      ALA  63  -0.021 -24.917   0.672
    4    HB2  ALA  63           HB2      ALA  63  -1.332 -26.038   0.304
    5    HB1  ALA  63           HB3      ALA  63  -1.258 -25.258   1.884

  No H/Q in entry =           5
  In of MODEL   58
    1    H    GLY  64           H        GLY  64  -3.037 -25.642  -1.240
    2    HA3  GLY  64           HA2      GLY  64  -5.175 -26.759  -0.458
    3    HA2  GLY  64           HA3      GLY  64  -5.739 -25.123  -0.164

  No H/Q in entry =           3
  In of MODEL   58
    1    H    GLU  65           H        GLU  65  -5.164 -23.705  -2.347
    2    HA   GLU  65           HA       GLU  65  -7.023 -24.654  -4.249
    3    HB2  GLU  65           HB2      GLU  65  -5.004 -22.418  -4.397
    4    HB3  GLU  65           HB3      GLU  65  -6.224 -22.725  -5.634
    5    HG2  GLU  65           HG2      GLU  65  -8.011 -22.442  -3.994
    6    HG3  GLU  65           HG3      GLU  65  -6.829 -22.236  -2.705

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLY  66           H        GLY  66  -3.553 -24.713  -4.140
    2    HA3  GLY  66           HA2      GLY  66  -3.352 -26.850  -6.026
    3    HA2  GLY  66           HA3      GLY  66  -2.770 -25.336  -6.687

  No H/Q in entry =           3
  In of MODEL   58
    1    H    LYS  67           H        LYS  67  -1.120 -27.478  -6.514
    2    HA   LYS  67           HA       LYS  67   0.361 -28.152  -4.412
    3    HB2  LYS  67           HB2      LYS  67   2.385 -28.076  -6.013
    4    HB3  LYS  67           HB3      LYS  67   0.988 -29.060  -6.468
    5    HG2  LYS  67           HG2      LYS  67   0.110 -27.213  -7.835
    6    HG3  LYS  67           HG3      LYS  67   1.479 -26.204  -7.369
    7    HD2  LYS  67           HD2      LYS  67   3.027 -27.775  -8.456
    8    HD3  LYS  67           HD3      LYS  67   1.672 -28.817  -8.897
    9    HE2  LYS  67           HE2      LYS  67   2.441 -27.244 -10.734
   10    HE3  LYS  67           HE3      LYS  67   0.730 -27.130 -10.327
   11    HZ2  LYS  67           HZ1      LYS  67   1.889 -24.960 -10.528
   12    HZ1  LYS  67           HZ2      LYS  67   2.817 -25.372  -9.167
   13    HZ3  LYS  67           HZ3      LYS  67   1.133 -25.201  -9.031

  No H/Q in entry =          13
  In of MODEL   58
    1    H    MET  68           H        MET  68   2.592 -26.327  -6.050
    2    HA   MET  68           HA       MET  68   3.597 -25.006  -3.774
    3    HB2  MET  68           HB2      MET  68   4.153 -24.568  -6.710
    4    HB3  MET  68           HB3      MET  68   5.119 -23.907  -5.390
    5    HG2  MET  68           HG2      MET  68   4.599 -26.857  -5.869
    6    HG3  MET  68           HG3      MET  68   6.097 -26.009  -6.265
    7    HE1  MET  68           HE1      MET  68   7.195 -24.519  -4.794
    8    HE3  MET  68           HE2      MET  68   7.703 -24.969  -3.167
    9    HE2  MET  68           HE3      MET  68   6.270 -23.970  -3.391

  No H/Q in entry =           9
  In of MODEL   58
    1    H    LYS  69           H        LYS  69   1.611 -23.789  -6.462
    2    HA   LYS  69           HA       LYS  69   1.849 -21.080  -6.032
    3    HB2  LYS  69           HB2      LYS  69  -0.676 -22.442  -6.934
    4    HB3  LYS  69           HB3      LYS  69  -0.182 -20.775  -7.259
    5    HG2  LYS  69           HG2      LYS  69   1.960 -21.824  -8.265
    6    HG3  LYS  69           HG3      LYS  69   1.040 -23.328  -8.295
    7    HD2  LYS  69           HD2      LYS  69   0.618 -20.812  -9.857
    8    HD3  LYS  69           HD3      LYS  69   0.508 -22.492 -10.388
    9    HE2  LYS  69           HE2      LYS  69  -1.533 -22.666  -8.823
   10    HE3  LYS  69           HE3      LYS  69  -1.498 -20.903  -8.788
   11    HZ1  LYS  69           HZ1      LYS  69  -1.451 -21.074 -11.309
   12    HZ3  LYS  69           HZ2      LYS  69  -2.921 -21.425 -10.533
   13    HZ2  LYS  69           HZ3      LYS  69  -1.935 -22.687 -11.101

  No H/Q in entry =          13
  In of MODEL   58
    1    H    VAL  70           H        VAL  70   0.163 -19.505  -5.318
    2    HA   VAL  70           HA       VAL  70  -1.188 -20.350  -2.820
    3    HB   VAL  70           HB       VAL  70  -0.527 -18.151  -1.843
    4   HG11  VAL  70          HG11      VAL  70   0.792 -20.212  -1.406
    5   HG13  VAL  70          HG12      VAL  70   1.799 -18.763  -1.383
    6   HG12  VAL  70          HG13      VAL  70   1.816 -19.827  -2.790
    7   HG23  VAL  70          HG21      VAL  70   1.236 -17.937  -4.320
    8   HG22  VAL  70          HG22      VAL  70   1.245 -16.829  -2.950
    9   HG21  VAL  70          HG23      VAL  70  -0.176 -16.931  -3.985

  No H/Q in entry =           9
  In of MODEL   58
    1    H    SER  71           H        SER  71  -2.813 -18.705  -2.124
    2    HA   SER  71           HA       SER  71  -4.716 -18.171  -4.138
    3    HB2  SER  71           HB2      SER  71  -5.255 -18.379  -1.698
    4    HB3  SER  71           HB3      SER  71  -4.453 -16.837  -1.419
    5    HG   SER  71           HG       SER  71  -6.755 -17.371  -2.988

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LEU  72           H        LEU  72  -4.986 -16.499  -5.475
    2    HA   LEU  72           HA       LEU  72  -2.900 -14.662  -5.958
    3    HB2  LEU  72           HB2      LEU  72  -5.762 -14.756  -6.906
    4    HB3  LEU  72           HB3      LEU  72  -4.582 -13.582  -7.482
    5    HG   LEU  72           HG       LEU  72  -4.132 -16.582  -7.610
    6   HD12  LEU  72          HD11      LEU  72  -5.006 -14.752  -9.861
    7   HD11  LEU  72          HD12      LEU  72  -6.118 -15.782  -8.959
    8   HD13  LEU  72          HD13      LEU  72  -4.826 -16.506  -9.915
    9   HD23  LEU  72          HD21      LEU  72  -2.581 -15.686  -9.529
   10   HD22  LEU  72          HD22      LEU  72  -2.017 -15.548  -7.872
   11   HD21  LEU  72          HD23      LEU  72  -2.708 -14.146  -8.683

  No H/Q in entry =          11
  In of MODEL   58
    1    H    VAL  73           H        VAL  73  -5.999 -14.340  -4.332
    2    HA   VAL  73           HA       VAL  73  -6.079 -11.569  -3.987
    3    HB   VAL  73           HB       VAL  73  -7.788 -11.949  -2.392
    4   HG11  VAL  73          HG11      VAL  73  -8.099 -12.786  -4.809
    5   HG13  VAL  73          HG12      VAL  73  -9.239 -13.378  -3.601
    6   HG12  VAL  73          HG13      VAL  73  -7.911 -14.408  -4.141
    7   HG22  VAL  73          HG21      VAL  73  -6.931 -13.389  -0.773
    8   HG21  VAL  73          HG22      VAL  73  -6.325 -14.536  -1.969
    9   HG23  VAL  73          HG23      VAL  73  -8.052 -14.459  -1.616

  No H/Q in entry =           9
  In of MODEL   58
    1    H    LEU  74           H        LEU  74  -4.114 -13.910  -2.396
    2    HA   LEU  74           HA       LEU  74  -3.720 -12.759   0.125
    3    HB2  LEU  74           HB2      LEU  74  -2.910 -14.971  -0.378
    4    HB3  LEU  74           HB3      LEU  74  -1.852 -14.341  -1.641
    5    HG   LEU  74           HG       LEU  74  -0.579 -13.075   0.058
    6   HD11  LEU  74          HD11      LEU  74  -2.664 -14.290   1.872
    7   HD13  LEU  74          HD12      LEU  74  -2.139 -12.609   1.779
    8   HD12  LEU  74          HD13      LEU  74  -1.080 -13.826   2.492
    9   HD23  LEU  74          HD21      LEU  74  -0.748 -15.829   1.156
   10   HD22  LEU  74          HD22      LEU  74   0.641 -14.891   0.658
   11   HD21  LEU  74          HD23      LEU  74  -0.362 -15.653  -0.554

  No H/Q in entry =          11
  In of MODEL   58
    1    H    VAL  75           H        VAL  75  -1.831 -12.348  -2.831
    2    HA   VAL  75           HA       VAL  75  -0.058 -10.399  -1.823
    3    HB   VAL  75           HB       VAL  75  -1.005 -10.903  -4.646
    4   HG12  VAL  75          HG11      VAL  75   1.039  -9.565  -5.269
    5   HG11  VAL  75          HG12      VAL  75   1.238  -9.154  -3.573
    6   HG13  VAL  75          HG13      VAL  75  -0.180  -8.597  -4.448
    7   HG22  VAL  75          HG21      VAL  75   0.984 -12.195  -4.856
    8   HG21  VAL  75          HG22      VAL  75   0.309 -12.671  -3.297
    9   HG23  VAL  75          HG23      VAL  75   1.663 -11.542  -3.364

  No H/Q in entry =           9
  In of MODEL   58
    1    H    GLU  76           H        GLU  76  -3.211 -10.095  -3.484
    2    HA   GLU  76           HA       GLU  76  -3.298  -7.281  -3.591
    3    HB2  GLU  76           HB2      GLU  76  -4.935  -8.773  -4.742
    4    HB3  GLU  76           HB3      GLU  76  -5.601  -9.225  -3.181
    5    HG2  GLU  76           HG2      GLU  76  -6.296  -6.905  -2.771
    6    HG3  GLU  76           HG3      GLU  76  -5.601  -6.393  -4.296

  No H/Q in entry =           6
  In of MODEL   58
    1    H    ALA  77           H        ALA  77  -4.383  -9.518  -1.048
    2    HA   ALA  77           HA       ALA  77  -5.366  -7.525   0.706
    3    HB1  ALA  77           HB1      ALA  77  -4.342 -10.325   1.191
    4    HB3  ALA  77           HB2      ALA  77  -6.016  -9.781   1.118
    5    HB2  ALA  77           HB3      ALA  77  -4.998  -9.313   2.477

  No H/Q in entry =           5
  In of MODEL   58
    1    H    GLN  78           H        GLN  78  -2.200  -9.036   0.347
    2    HA   GLN  78           HA       GLN  78  -0.958  -7.857   2.596
    3    HB2  GLN  78           HB2      GLN  78  -0.103  -9.792   1.177
    4    HB3  GLN  78           HB3      GLN  78   0.402  -8.587  -0.006
    5    HG2  GLN  78           HG2      GLN  78   1.860  -7.531   1.614
    6    HG3  GLN  78           HG3      GLN  78   1.269  -8.584   2.896
    7   HE21  GLN  78          HE21      GLN  78   2.528  -9.106  -0.462
    8   HE22  GLN  78          HE22      GLN  78   3.590 -10.351  -0.011

  No H/Q in entry =           8
  In of MODEL   58
    1    H    LEU  79           H        LEU  79  -1.334  -6.806  -0.753
    2    HA   LEU  79           HA       LEU  79   0.325  -4.560  -0.742
    3    HB2  LEU  79           HB2      LEU  79  -0.690  -5.382  -2.795
    4    HB3  LEU  79           HB3      LEU  79  -2.299  -5.008  -2.188
    5    HG   LEU  79           HG       LEU  79  -1.782  -2.615  -2.167
    6   HD13  LEU  79          HD11      LEU  79   0.454  -2.344  -1.653
    7   HD12  LEU  79          HD12      LEU  79   0.502  -2.059  -3.392
    8   HD11  LEU  79          HD13      LEU  79   0.974  -3.631  -2.743
    9   HD23  LEU  79          HD21      LEU  79  -1.148  -2.413  -4.719
   10   HD22  LEU  79          HD22      LEU  79  -2.666  -3.178  -4.260
   11   HD21  LEU  79          HD23      LEU  79  -1.282  -4.172  -4.701

  No H/Q in entry =          11
  In of MODEL   58
    1    H    HIS  80           H        HIS  80  -3.140  -4.760   0.082
    2    HA   HIS  80           HA       HIS  80  -3.363  -2.005   0.740
    3    HB2  HIS  80           HB2      HIS  80  -5.037  -4.432   1.062
    4    HB3  HIS  80           HB3      HIS  80  -5.374  -3.094   2.163
    5    HD1  HIS  80           HD1      HIS  80  -7.009  -1.477   1.251
    6    HD2  HIS  80           HD2      HIS  80  -4.793  -3.270  -1.791
    7    HE1  HIS  80           HE1      HIS  80  -7.858  -0.494  -0.930
    8    HE2  HIS  80           HE2      HIS  80  -6.514  -1.581  -2.794

  No H/Q in entry =           8
  In of MODEL   58
    1    H    LEU  81           H        LEU  81  -2.844  -4.891   2.739
    2    HA   LEU  81           HA       LEU  81  -2.848  -3.539   5.221
    3    HB2  LEU  81           HB2      LEU  81  -1.600  -6.143   4.347
    4    HB3  LEU  81           HB3      LEU  81  -1.582  -5.581   6.020
    5    HG   LEU  81           HG       LEU  81  -4.123  -5.865   4.390
    6   HD12  LEU  81          HD11      LEU  81  -4.405  -7.930   5.941
    7   HD11  LEU  81          HD12      LEU  81  -2.654  -7.840   6.128
    8   HD13  LEU  81          HD13      LEU  81  -3.358  -8.081   4.529
    9   HD23  LEU  81          HD21      LEU  81  -4.966  -6.072   6.891
   10   HD22  LEU  81          HD22      LEU  81  -4.658  -4.481   6.198
   11   HD21  LEU  81          HD23      LEU  81  -3.464  -5.227   7.261

  No H/Q in entry =          11
  In of MODEL   58
    1    H    MET  82           H        MET  82  -0.156  -4.417   3.054
    2    HA   MET  82           HA       MET  82   1.916  -3.498   4.738
    3    HB2  MET  82           HB2      MET  82   1.707  -3.847   1.746
    4    HB3  MET  82           HB3      MET  82   3.182  -3.259   2.510
    5    HG2  MET  82           HG2      MET  82   1.802  -5.862   3.237
    6    HG3  MET  82           HG3      MET  82   3.174  -5.740   2.138
    7    HE3  MET  82           HE1      MET  82   6.180  -4.969   4.123
    8    HE2  MET  82           HE2      MET  82   5.243  -3.612   3.502
    9    HE1  MET  82           HE3      MET  82   5.348  -5.103   2.569

  No H/Q in entry =           9
  In of MODEL   58
    1    H    THR  83           H        THR  83   0.079  -1.880   2.177
    2    HA   THR  83           HA       THR  83   1.466   0.583   2.259
    3    HB   THR  83           HB       THR  83  -0.719   1.484   1.270
    4    HG1  THR  83           HG1      THR  83  -2.356   0.169   1.164
    5   HG22  THR  83          HG21      THR  83  -0.429  -0.335  -0.727
    6   HG21  THR  83          HG22      THR  83   1.074  -0.610   0.151
    7   HG23  THR  83          HG23      THR  83   0.697   0.998  -0.467

  No H/Q in entry =           7
  In of MODEL   58
    1    H    SER  84           H        SER  84  -1.531  -0.477   3.860
    2    HA   SER  84           HA       SER  84  -2.053   1.950   5.200
    3    HB2  SER  84           HB2      SER  84  -2.857  -0.895   5.769
    4    HB3  SER  84           HB3      SER  84  -3.365   0.443   6.799
    5    HG   SER  84           HG       SER  84  -3.818   0.119   4.007

  No H/Q in entry =           5
  In of MODEL   58
    1    H    MET  85           H        MET  85  -0.314  -0.962   6.336
    2    HA   MET  85           HA       MET  85   0.194  -0.025   8.939
    3    HB2  MET  85           HB2      MET  85   0.510  -2.368   8.260
    4    HB3  MET  85           HB3      MET  85   1.893  -1.889   7.275
    5    HG2  MET  85           HG2      MET  85   3.060  -1.063   9.269
    6    HG3  MET  85           HG3      MET  85   1.663  -1.458  10.269
    7    HE1  MET  85           HE1      MET  85   4.326  -2.510   7.951
    8    HE3  MET  85           HE2      MET  85   3.319  -3.778   7.258
    9    HE2  MET  85           HE3      MET  85   4.688  -4.209   8.277

  No H/Q in entry =           9
  In of MODEL   58
    1    H    LEU  86           H        LEU  86   2.128   0.244   5.989
    2    HA   LEU  86           HA       LEU  86   4.329   1.578   7.143
    3    HB2  LEU  86           HB2      LEU  86   4.149   0.489   4.837
    4    HB3  LEU  86           HB3      LEU  86   3.327   1.962   4.321
    5    HG   LEU  86           HG       LEU  86   5.343   3.230   5.300
    6   HD11  LEU  86          HD11      LEU  86   6.073   0.627   6.105
    7   HD13  LEU  86          HD12      LEU  86   7.062   2.082   6.200
    8   HD12  LEU  86          HD13      LEU  86   7.182   1.032   4.791
    9   HD23  LEU  86          HD21      LEU  86   6.078   1.469   2.953
   10   HD22  LEU  86          HD22      LEU  86   6.455   3.171   3.212
   11   HD21  LEU  86          HD23      LEU  86   4.807   2.686   2.813

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ALA  87           H        ALA  87   1.406   2.790   5.554
    2    HA   ALA  87           HA       ALA  87   1.973   5.526   5.633
    3    HB1  ALA  87           HB1      ALA  87  -0.320   3.875   5.094
    4    HB3  ALA  87           HB2      ALA  87  -0.025   5.537   4.590
    5    HB2  ALA  87           HB3      ALA  87  -0.816   5.212   6.134

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ARG  88           H        ARG  88   0.301   3.513   8.026
    2    HA   ARG  88           HA       ARG  88  -0.231   5.562   9.868
    3    HB2  ARG  88           HB2      ARG  88  -1.147   3.200   9.939
    4    HB3  ARG  88           HB3      ARG  88   0.398   2.717  10.647
    5    HG2  ARG  88           HG2      ARG  88  -0.100   4.790  12.262
    6    HG3  ARG  88           HG3      ARG  88  -1.763   4.448  11.806
    7    HD2  ARG  88           HD2      ARG  88  -1.853   2.600  13.056
    8    HD3  ARG  88           HD3      ARG  88  -0.258   2.033  12.527
    9    HE   ARG  88           HE       ARG  88  -0.805   3.296  14.978
   10   HH21  ARG  88          HH11      ARG  88   0.742   4.326  16.215
   11   HH22  ARG  88          HH12      ARG  88   2.258   4.766  15.511
   12   HH11  ARG  88          HH21      ARG  88   1.475   3.494  12.402
   13   HH12  ARG  88          HH22      ARG  88   2.681   4.279  13.364

  No H/Q in entry =          13
  In of MODEL   58
    1    H    GLU  89           H        GLU  89   2.587   3.370   9.652
    2    HA   GLU  89           HA       GLU  89   3.838   4.276  11.994
    3    HB2  GLU  89           HB2      GLU  89   4.518   2.262  10.655
    4    HB3  GLU  89           HB3      GLU  89   5.283   3.361   9.507
    5    HG2  GLU  89           HG2      GLU  89   6.758   4.226  11.250
    6    HG3  GLU  89           HG3      GLU  89   5.932   3.264  12.471

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LEU  90           H        LEU  90   4.146   5.430   8.664
    2    HA   LEU  90           HA       LEU  90   6.055   7.451   9.246
    3    HB2  LEU  90           HB2      LEU  90   4.054   7.094   7.018
    4    HB3  LEU  90           HB3      LEU  90   5.271   8.377   7.037
    5    HG   LEU  90           HG       LEU  90   5.975   5.448   7.378
    6   HD12  LEU  90          HD11      LEU  90   6.723   5.684   4.939
    7   HD11  LEU  90          HD12      LEU  90   5.693   7.114   4.886
    8   HD13  LEU  90          HD13      LEU  90   4.989   5.534   5.232
    9   HD22  LEU  90          HD21      LEU  90   7.860   6.619   8.059
   10   HD21  LEU  90          HD22      LEU  90   7.496   8.018   7.049
   11   HD23  LEU  90          HD23      LEU  90   8.171   6.559   6.326

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  91           H        ILE  91   2.516   7.429   9.095
    2    HA   ILE  91           HA       ILE  91   2.144  10.199   9.539
    3    HB   ILE  91           HB       ILE  91   0.378   7.805  10.086
    4   HG12  ILE  91          HG12      ILE  91   0.107  10.079   8.095
    5   HG13  ILE  91          HG13      ILE  91   0.983   8.594   7.727
    6   HG22  ILE  91          HG21      ILE  91  -1.376   9.845  10.143
    7   HG21  ILE  91          HG22      ILE  91   0.015  10.692  10.815
    8   HG23  ILE  91          HG23      ILE  91  -0.606   9.250  11.614
    9   HD13  ILE  91          HD11      ILE  91  -0.947   7.285   7.773
   10   HD12  ILE  91          HD12      ILE  91  -1.552   8.792   7.087
   11   HD11  ILE  91          HD13      ILE  91  -1.821   8.429   8.793

  No H/Q in entry =          11
  In of MODEL   58
    1    H    THR  92           H        THR  92   2.575   7.467  11.747
    2    HA   THR  92           HA       THR  92   2.115   8.842  14.167
    3    HB   THR  92           HB       THR  92   3.950   6.525  13.509
    4    HG1  THR  92           HG1      THR  92   1.989   5.746  13.409
    5   HG22  THR  92          HG21      THR  92   3.567   6.243  16.143
    6   HG21  THR  92          HG22      THR  92   3.483   8.002  16.066
    7   HG23  THR  92          HG23      THR  92   4.926   7.161  15.496

  No H/Q in entry =           7
  In of MODEL   58
    1    H    GLU  93           H        GLU  93   5.072   8.421  12.237
    2    HA   GLU  93           HA       GLU  93   6.808   9.873  13.932
    3    HB2  GLU  93           HB2      GLU  93   6.903   9.551  10.918
    4    HB3  GLU  93           HB3      GLU  93   8.236  10.099  11.932
    5    HG2  GLU  93           HG2      GLU  93   6.857   7.448  12.385
    6    HG3  GLU  93           HG3      GLU  93   8.240   7.613  11.310

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LEU  94           H        LEU  94   4.750  10.857  11.215
    2    HA   LEU  94           HA       LEU  94   5.524  13.570  11.108
    3    HB2  LEU  94           HB2      LEU  94   2.950  12.172  10.355
    4    HB3  LEU  94           HB3      LEU  94   3.189  13.902  10.110
    5    HG   LEU  94           HG       LEU  94   5.230  11.935   9.067
    6   HD11  LEU  94          HD11      LEU  94   2.484  12.450   8.000
    7   HD13  LEU  94          HD12      LEU  94   3.484  11.005   7.880
    8   HD12  LEU  94          HD13      LEU  94   3.804  12.387   6.832
    9   HD23  LEU  94          HD21      LEU  94   5.460  13.770   7.340
   10   HD22  LEU  94          HD22      LEU  94   5.867  14.272   8.981
   11   HD21  LEU  94          HD23      LEU  94   4.312  14.719   8.279

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  95           H        ILE  95   3.004  11.927  13.001
    2    HA   ILE  95           HA       ILE  95   1.931  14.267  14.189
    3    HB   ILE  95           HB       ILE  95   1.982  11.388  15.121
    4   HG12  ILE  95          HG12      ILE  95  -0.259  13.131  14.065
    5   HG13  ILE  95          HG13      ILE  95   0.712  12.081  13.037
    6   HG21  ILE  95          HG21      ILE  95   0.668  13.848  16.315
    7   HG23  ILE  95          HG22      ILE  95   1.730  12.694  17.124
    8   HG22  ILE  95          HG23      ILE  95   0.101  12.211  16.648
    9   HD13  ILE  95          HD11      ILE  95  -0.168  10.134  13.960
   10   HD12  ILE  95          HD12      ILE  95  -1.564  11.206  14.032
   11   HD11  ILE  95          HD13      ILE  95  -0.597  10.924  15.478

  No H/Q in entry =          11
  In of MODEL   58
    1    H    GLU  96           H        GLU  96   4.552  12.084  15.193
    2    HA   GLU  96           HA       GLU  96   5.089  13.296  17.683
    3    HB2  GLU  96           HB2      GLU  96   6.065  11.147  17.042
    4    HB3  GLU  96           HB3      GLU  96   6.990  11.929  15.761
    5    HG2  GLU  96           HG2      GLU  96   8.630  12.503  17.224
    6    HG3  GLU  96           HG3      GLU  96   7.472  13.304  18.275

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LEU  97           H        LEU  97   6.158  14.073  14.396
    2    HA   LEU  97           HA       LEU  97   8.017  16.095  15.105
    3    HB2  LEU  97           HB2      LEU  97   6.436  15.519  12.609
    4    HB3  LEU  97           HB3      LEU  97   7.436  16.964  12.728
    5    HG   LEU  97           HG       LEU  97   8.501  14.181  13.297
    6   HD12  LEU  97          HD11      LEU  97   9.498  14.382  10.980
    7   HD11  LEU  97          HD12      LEU  97   8.429  15.758  10.712
    8   HD13  LEU  97          HD13      LEU  97   7.750  14.158  11.010
    9   HD23  LEU  97          HD21      LEU  97  10.654  15.487  12.553
   10   HD22  LEU  97          HD22      LEU  97  10.029  15.753  14.181
   11   HD21  LEU  97          HD23      LEU  97   9.701  16.928  12.909

  No H/Q in entry =          11
  In of MODEL   58
    1    H    HIS  98           H        HIS  98   4.525  16.182  14.446
    2    HA   HIS  98           HA       HIS  98   4.188  18.978  14.573
    3    HB2  HIS  98           HB2      HIS  98   2.327  16.705  15.303
    4    HB3  HIS  98           HB3      HIS  98   1.837  18.399  15.353
    5    HD1  HIS  98           HD1      HIS  98   2.898  15.691  12.957
    6    HD2  HIS  98           HD2      HIS  98   1.469  19.605  12.822
    7    HE1  HIS  98           HE1      HIS  98   2.335  16.166  10.531
    8    HE2  HIS  98           HE2      HIS  98   1.469  18.543  10.428

  No H/Q in entry =           8
  In of MODEL   58
    1    H    GLU  99           H        GLU  99   4.351  16.498  17.079
    2    HA   GLU  99           HA       GLU  99   3.718  18.190  19.271
    3    HB2  GLU  99           HB2      GLU  99   3.662  15.708  19.375
    4    HB3  GLU  99           HB3      GLU  99   5.423  15.686  19.269
    5    HG2  GLU  99           HG2      GLU  99   5.591  16.986  21.340
    6    HG3  GLU  99           HG3      GLU  99   3.837  17.104  21.433

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LYS 100           H        LYS 100   6.786  17.297  17.713
    2    HA   LYS 100           HA       LYS 100   8.419  18.725  19.568
    3    HB2  LYS 100           HB2      LYS 100   8.934  17.799  16.732
    4    HB3  LYS 100           HB3      LYS 100  10.152  18.588  17.740
    5    HG2  LYS 100           HG2      LYS 100   9.797  16.837  19.485
    6    HG3  LYS 100           HG3      LYS 100   8.677  16.016  18.395
    7    HD2  LYS 100           HD2      LYS 100  10.477  15.753  16.730
    8    HD3  LYS 100           HD3      LYS 100  11.602  16.586  17.806
    9    HE2  LYS 100           HE2      LYS 100  11.227  14.830  19.528
   10    HE3  LYS 100           HE3      LYS 100  10.165  13.977  18.404
   11    HZ1  LYS 100           HZ1      LYS 100  12.977  14.683  17.750
   12    HZ3  LYS 100           HZ2      LYS 100  11.948  13.612  16.923
   13    HZ2  LYS 100           HZ3      LYS 100  12.541  13.205  18.464

  No H/Q in entry =          13
  In of MODEL   58
    1    H    LEU 101           H        LEU 101   6.717  19.621  16.608
    2    HA   LEU 101           HA       LEU 101   7.897  22.193  16.268
    3    HB2  LEU 101           HB2      LEU 101   5.319  20.922  15.381
    4    HB3  LEU 101           HB3      LEU 101   5.547  22.656  15.169
    5    HG   LEU 101           HG       LEU 101   7.611  20.665  14.211
    6   HD12  LEU 101          HD11      LEU 101   6.454  21.149  11.923
    7   HD11  LEU 101          HD12      LEU 101   5.048  21.563  12.901
    8   HD13  LEU 101          HD13      LEU 101   5.734  19.942  12.988
    9   HD21  LEU 101          HD21      LEU 101   6.945  23.567  13.647
   10   HD23  LEU 101          HD22      LEU 101   7.940  22.617  12.544
   11   HD22  LEU 101          HD23      LEU 101   8.476  22.886  14.202

  No H/Q in entry =          11
  In of MODEL   58
    1    H    LYS 102           H        LYS 102   6.372  21.041  18.884
    2    HA   LYS 102           HA       LYS 102   5.723  22.129  20.813
    3    HB2  LYS 102           HB2      LYS 102   6.980  24.134  19.685
    4    HB3  LYS 102           HB3      LYS 102   5.374  24.716  19.306
    5    HG2  LYS 102           HG2      LYS 102   6.751  24.485  21.960
    6    HG3  LYS 102           HG3      LYS 102   5.781  25.800  21.327
    7    HD2  LYS 102           HD2      LYS 102   4.572  23.149  22.211
    8    HD3  LYS 102           HD3      LYS 102   4.801  24.516  23.291
    9    HE2  LYS 102           HE2      LYS 102   2.529  24.080  21.800
   10    HE3  LYS 102           HE3      LYS 102   3.011  25.634  22.479
   11    HZ2  LYS 102           HZ1      LYS 102   2.482  25.728  20.099
   12    HZ1  LYS 102           HZ2      LYS 102   3.758  24.662  19.780
   13    HZ3  LYS 102           HZ3      LYS 102   4.080  26.199  20.419

  No H/Q in entry =          13
  In of MODEL   58
    1    H    ALA 103           H        ALA 103   4.068  23.644  18.040
    2    HA   ALA 103           HA       ALA 103   1.605  24.190  18.920
    3    HB1  ALA 103           HB1      ALA 103   0.721  23.331  16.679
    4    HB2  ALA 103           HB2      ALA 103   2.375  22.815  16.353
    5    HB3  ALA 103           HB3      ALA 103   2.018  24.523  16.614

  No H/Q in entry =           5
  In of MODEL   58
    1    H1   ALA   1           H3       ALA   1  10.814 -20.256  -6.233
    2    H2   ALA   1           H2       ALA   1   9.854 -20.478  -7.620
    3    H3   ALA   1           H1       ALA   1   9.424 -21.226  -6.155
    4    HA   ALA   1           HA       ALA   1  10.487 -23.024  -6.889
    5    HB1  ALA   1           HB1      ALA   1  10.580 -22.669  -9.166
    6    HB2  ALA   1           HB2      ALA   1  12.305 -22.496  -8.835
    7    HB3  ALA   1           HB3      ALA   1  11.289 -21.062  -8.991

  No H/Q in entry =           7
  In of MODEL   58
    1    H    GLU   2           H        GLU   2  12.782 -23.946  -6.943
    2    HA   GLU   2           HA       GLU   2  14.161 -23.842  -4.730
    3    HB2  GLU   2           HB2      GLU   2  15.518 -23.700  -7.428
    4    HB3  GLU   2           HB3      GLU   2  16.252 -24.299  -5.941
    5    HG2  GLU   2           HG2      GLU   2  15.260 -26.328  -6.178
    6    HG3  GLU   2           HG3      GLU   2  13.680 -25.603  -6.440

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLU   3           H        GLU   3  15.911 -21.961  -7.134
    2    HA   GLU   3           HA       GLU   3  17.042 -20.256  -5.178
    3    HB2  GLU   3           HB2      GLU   3  16.988 -20.261  -8.188
    4    HB3  GLU   3           HB3      GLU   3  17.717 -18.921  -7.303
    5    HG2  GLU   3           HG2      GLU   3  19.395 -20.273  -6.376
    6    HG3  GLU   3           HG3      GLU   3  18.467 -21.752  -6.594

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LEU   4           H        LEU   4  14.752 -19.442  -7.812
    2    HA   LEU   4           HA       LEU   4  14.253 -16.838  -7.207
    3    HB2  LEU   4           HB2      LEU   4  12.103 -18.840  -7.935
    4    HB3  LEU   4           HB3      LEU   4  12.007 -17.093  -8.138
    5    HG   LEU   4           HG       LEU   4  13.995 -18.935  -9.505
    6   HD13  LEU   4          HD11      LEU   4  12.693 -18.807 -11.416
    7   HD12  LEU   4          HD12      LEU   4  11.966 -17.269 -10.953
    8   HD11  LEU   4          HD13      LEU   4  11.430 -18.765 -10.188
    9   HD23  LEU   4          HD21      LEU   4  14.305 -16.689 -10.861
   10   HD22  LEU   4          HD22      LEU   4  15.167 -16.918  -9.340
   11   HD21  LEU   4          HD23      LEU   4  13.702 -15.939  -9.383

  No H/Q in entry =          11
  In of MODEL   58
    1    H    GLU   5           H        GLU   5  12.801 -19.635  -5.560
    2    HA   GLU   5           HA       GLU   5  11.103 -18.080  -3.862
    3    HB2  GLU   5           HB2      GLU   5  10.713 -20.469  -4.382
    4    HB3  GLU   5           HB3      GLU   5  12.145 -20.880  -3.436
    5    HG2  GLU   5           HG2      GLU   5  11.147 -19.848  -1.443
    6    HG3  GLU   5           HG3      GLU   5   9.721 -19.402  -2.381

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLU   6           H        GLU   6  14.268 -19.620  -3.413
    2    HA   GLU   6           HA       GLU   6  14.608 -18.753  -0.717
    3    HB2  GLU   6           HB2      GLU   6  15.859 -20.610  -2.116
    4    HB3  GLU   6           HB3      GLU   6  16.940 -19.274  -2.521
    5    HG2  GLU   6           HG2      GLU   6  16.170 -20.045   0.307
    6    HG3  GLU   6           HG3      GLU   6  17.664 -20.545  -0.487

  No H/Q in entry =           6
  In of MODEL   58
    1    H    VAL   7           H        VAL   7  15.360 -17.425  -3.869
    2    HA   VAL   7           HA       VAL   7  17.018 -15.275  -3.008
    3    HB   VAL   7           HB       VAL   7  15.319 -15.666  -5.486
    4   HG11  VAL   7          HG11      VAL   7  17.184 -13.428  -4.677
    5   HG13  VAL   7          HG12      VAL   7  15.541 -13.307  -5.302
    6   HG12  VAL   7          HG13      VAL   7  16.857 -13.796  -6.370
    7   HG21  VAL   7          HG21      VAL   7  17.444 -17.095  -4.912
    8   HG23  VAL   7          HG22      VAL   7  18.331 -15.623  -5.313
    9   HG22  VAL   7          HG23      VAL   7  17.305 -16.389  -6.523

  No H/Q in entry =           9
  In of MODEL   58
    1    H    VAL   8           H        VAL   8  13.530 -15.590  -3.567
    2    HA   VAL   8           HA       VAL   8  12.830 -12.890  -3.102
    3    HB   VAL   8           HB       VAL   8  11.249 -15.437  -2.660
    4   HG12  VAL   8          HG11      VAL   8   9.308 -13.695  -2.896
    5   HG11  VAL   8          HG12      VAL   8  10.528 -12.524  -2.395
    6   HG13  VAL   8          HG13      VAL   8  10.113 -13.870  -1.337
    7   HG22  VAL   8          HG21      VAL   8  10.667 -15.312  -4.886
    8   HG21  VAL   8          HG22      VAL   8  12.124 -14.334  -5.030
    9   HG23  VAL   8          HG23      VAL   8  10.556 -13.553  -4.853

  No H/Q in entry =           9
  In of MODEL   58
    1    H    MET   9           H        MET   9  13.131 -15.687  -0.915
    2    HA   MET   9           HA       MET   9  12.297 -14.420   1.451
    3    HB2  MET   9           HB2      MET   9  14.181 -16.697   0.882
    4    HB3  MET   9           HB3      MET   9  13.987 -16.088   2.525
    5    HG2  MET   9           HG2      MET   9  11.452 -16.338   2.132
    6    HG3  MET   9           HG3      MET   9  11.896 -17.317   0.732
    7    HE3  MET   9           HE1      MET   9  13.378 -20.456   1.929
    8    HE2  MET   9           HE2      MET   9  14.396 -19.086   1.494
    9    HE1  MET   9           HE3      MET   9  12.888 -19.366   0.626

  No H/Q in entry =           9
  In of MODEL   58
    1    H    GLY  10           H        GLY  10  15.482 -14.606  -0.102
    2    HA3  GLY  10           HA2      GLY  10  16.920 -13.162   1.866
    3    HA2  GLY  10           HA3      GLY  10  17.387 -13.325   0.173

  No H/Q in entry =           3
  In of MODEL   58
    1    H    LEU  11           H        LEU  11  15.204 -12.136  -1.071
    2    HA   LEU  11           HA       LEU  11  15.851  -9.381  -0.914
    3    HB2  LEU  11           HB2      LEU  11  13.504 -10.826  -2.148
    4    HB3  LEU  11           HB3      LEU  11  13.761  -9.088  -2.311
    5    HG   LEU  11           HG       LEU  11  15.818 -11.171  -3.092
    6   HD13  LEU  11          HD11      LEU  11  14.078 -11.565  -4.613
    7   HD12  LEU  11          HD12      LEU  11  15.066 -10.372  -5.455
    8   HD11  LEU  11          HD13      LEU  11  13.585  -9.872  -4.639
    9   HD22  LEU  11          HD21      LEU  11  17.022  -9.190  -2.870
   10   HD21  LEU  11          HD22      LEU  11  15.633  -8.173  -3.252
   11   HD23  LEU  11          HD23      LEU  11  16.477  -9.033  -4.539

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  12           H        ILE  12  13.107 -11.242   0.355
    2    HA   ILE  12           HA       ILE  12  11.682  -9.036   1.409
    3    HB   ILE  12           HB       ILE  12  11.758 -11.914   2.366
    4   HG12  ILE  12          HG12      ILE  12  11.068 -11.307  -0.084
    5   HG13  ILE  12          HG13      ILE  12  10.047 -12.397   0.832
    6   HG23  ILE  12          HG21      ILE  12  10.786 -10.528   4.097
    7   HG22  ILE  12          HG22      ILE  12   9.465 -11.357   3.276
    8   HG21  ILE  12          HG23      ILE  12   9.801  -9.664   2.918
    9   HD13  ILE  12          HD11      ILE  12   8.506 -10.591   1.318
   10   HD12  ILE  12          HD12      ILE  12   8.801 -10.621  -0.420
   11   HD11  ILE  12          HD13      ILE  12   9.589  -9.422   0.582

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  13           H        ILE  13  14.105 -11.203   2.822
    2    HA   ILE  13           HA       ILE  13  14.121 -10.017   5.399
    3    HB   ILE  13           HB       ILE  13  16.210 -11.558   3.841
    4   HG12  ILE  13          HG12      ILE  13  13.953 -12.574   4.649
    5   HG13  ILE  13          HG13      ILE  13  15.441 -13.462   4.961
    6   HG22  ILE  13          HG21      ILE  13  17.120 -11.903   6.297
    7   HG21  ILE  13          HG22      ILE  13  16.337 -10.357   6.597
    8   HG23  ILE  13          HG23      ILE  13  17.601 -10.481   5.373
    9   HD12  ILE  13          HD11      ILE  13  13.617 -12.972   6.901
   10   HD11  ILE  13          HD12      ILE  13  14.591 -11.512   7.044
   11   HD13  ILE  13          HD13      ILE  13  15.344 -13.091   7.231

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ASN  14           H        ASN  14  16.069  -9.464   2.481
    2    HA   ASN  14           HA       ASN  14  17.782  -7.493   3.540
    3    HB2  ASN  14           HB2      ASN  14  17.782  -8.765   1.227
    4    HB3  ASN  14           HB3      ASN  14  16.867  -7.363   0.686
    5   HD21  ASN  14          HD21      ASN  14  19.314  -7.667  -0.496
    6   HD22  ASN  14          HD22      ASN  14  20.439  -6.565   0.130

  No H/Q in entry =           6
  In of MODEL   58
    1    H    SER  15           H        SER  15  14.668  -7.199   1.844
    2    HA   SER  15           HA       SER  15  14.511  -4.380   1.893
    3    HB2  SER  15           HB2      SER  15  12.181  -4.666   1.399
    4    HB3  SER  15           HB3      SER  15  13.003  -6.017   0.627
    5    HG   SER  15           HG       SER  15  11.909  -7.299   1.859

  No H/Q in entry =           5
  In of MODEL   58
    1    H    GLY  16           H        GLY  16  13.455  -6.852   4.202
    2    HA3  GLY  16           HA2      GLY  16  12.203  -5.118   6.053
    3    HA2  GLY  16           HA3      GLY  16  12.843  -6.716   6.420

  No H/Q in entry =           3
  In of MODEL   58
    1    H    GLN  17           H        GLN  17  15.550  -6.340   5.830
    2    HA   GLN  17           HA       GLN  17  16.483  -5.098   8.209
    3    HB2  GLN  17           HB2      GLN  17  17.744  -6.872   7.024
    4    HB3  GLN  17           HB3      GLN  17  18.032  -5.760   5.686
    5    HG2  GLN  17           HG2      GLN  17  19.210  -4.222   7.221
    6    HG3  GLN  17           HG3      GLN  17  18.941  -5.350   8.549
    7   HE21  GLN  17          HE21      GLN  17  21.034  -6.160   8.945
    8   HE22  GLN  17          HE22      GLN  17  22.011  -6.881   7.759

  No H/Q in entry =           8
  In of MODEL   58
    1    H    ALA  18           H        ALA  18  16.281  -4.031   4.846
    2    HA   ALA  18           HA       ALA  18  17.677  -1.615   5.069
    3    HB2  ALA  18           HB1      ALA  18  16.582  -2.853   3.003
    4    HB3  ALA  18           HB2      ALA  18  16.817  -1.105   2.983
    5    HB1  ALA  18           HB3      ALA  18  15.228  -1.777   3.352

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ARG  19           H        ARG  19  14.186  -2.260   5.462
    2    HA   ARG  19           HA       ARG  19  13.473   0.380   6.170
    3    HB2  ARG  19           HB2      ARG  19  11.823  -1.400   5.586
    4    HB3  ARG  19           HB3      ARG  19  12.176  -2.189   7.125
    5    HG2  ARG  19           HG2      ARG  19  11.430  -0.207   8.359
    6    HG3  ARG  19           HG3      ARG  19  11.168   0.662   6.848
    7    HD2  ARG  19           HD2      ARG  19   9.039  -0.169   7.667
    8    HD3  ARG  19           HD3      ARG  19   9.474  -1.045   6.193
    9    HE   ARG  19           HE       ARG  19  10.456  -2.566   8.303
   10   HH21  ARG  19          HH11      ARG  19   9.233  -4.224   9.245
   11   HH22  ARG  19          HH12      ARG  19   7.513  -4.226   9.072
   12   HH11  ARG  19          HH21      ARG  19   7.442  -1.326   7.201
   13   HH12  ARG  19          HH22      ARG  19   6.499  -2.585   7.911

  No H/Q in entry =          13
  In of MODEL   58
    1    H    SER  20           H        SER  20  14.376  -2.430   8.137
    2    HA   SER  20           HA       SER  20  14.071  -1.330  10.672
    3    HB2  SER  20           HB2      SER  20  14.619  -3.705  10.282
    4    HB3  SER  20           HB3      SER  20  16.233  -3.242   9.750
    5    HG   SER  20           HG       SER  20  15.067  -2.816  12.306

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LEU  21           H        LEU  21  16.915  -1.226   8.539
    2    HA   LEU  21           HA       LEU  21  18.562   0.293  10.276
    3    HB2  LEU  21           HB2      LEU  21  18.550   0.013   7.263
    4    HB3  LEU  21           HB3      LEU  21  19.788   0.897   8.151
    5    HG   LEU  21           HG       LEU  21  19.096  -2.006   8.695
    6   HD13  LEU  21          HD11      LEU  21  19.949  -1.826   6.421
    7   HD12  LEU  21          HD12      LEU  21  21.213  -2.498   7.451
    8   HD11  LEU  21          HD13      LEU  21  21.279  -0.804   6.966
    9   HD23  LEU  21          HD21      LEU  21  21.571  -1.805   9.599
   10   HD22  LEU  21          HD22      LEU  21  20.250  -1.228  10.607
   11   HD21  LEU  21          HD23      LEU  21  21.211  -0.083   9.685

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ALA  22           H        ALA  22  16.286   1.217   7.715
    2    HA   ALA  22           HA       ALA  22  16.779   3.984   7.723
    3    HB3  ALA  22           HB1      ALA  22  15.399   2.715   6.045
    4    HB2  ALA  22           HB2      ALA  22  14.667   4.217   6.607
    5    HB1  ALA  22           HB3      ALA  22  14.101   2.669   7.238

  No H/Q in entry =           5
  In of MODEL   58
    1    H    TYR  23           H        TYR  23  14.310   2.131   9.558
    2    HA   TYR  23           HA       TYR  23  13.308   4.356  11.001
    3    HB2  TYR  23           HB2      TYR  23  12.107   2.223  10.984
    4    HB3  TYR  23           HB3      TYR  23  13.451   1.435  11.809
    5    HD1  TYR  23           HD1      TYR  23  10.895   4.129  12.170
    6    HD2  TYR  23           HD2      TYR  23  13.654   1.512  14.167
    7    HE1  TYR  23           HE1      TYR  23   9.956   4.810  14.363
    8    HE2  TYR  23           HE2      TYR  23  12.715   2.192  16.358
    9    HH   TYR  23           HH       TYR  23  10.763   3.157  17.300

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ALA  24           H        ALA  24  15.989   2.125  11.647
    2    HA   ALA  24           HA       ALA  24  16.639   3.138  14.210
    3    HB1  ALA  24           HB1      ALA  24  18.025   1.366  14.051
    4    HB3  ALA  24           HB2      ALA  24  19.039   2.302  12.951
    5    HB2  ALA  24           HB3      ALA  24  17.762   1.271  12.310

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ALA  25           H        ALA  25  17.586   4.074  10.930
    2    HA   ALA  25           HA       ALA  25  19.499   6.041  11.574
    3    HB1  ALA  25           HB1      ALA  25  18.801   5.076   9.260
    4    HB3  ALA  25           HB2      ALA  25  19.275   6.772   9.350
    5    HB2  ALA  25           HB3      ALA  25  17.567   6.337   9.279

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LEU  26           H        LEU  26  15.981   6.213  11.207
    2    HA   LEU  26           HA       LEU  26  15.712   8.992  11.651
    3    HB2  LEU  26           HB2      LEU  26  13.872   7.725  10.723
    4    HB3  LEU  26           HB3      LEU  26  13.795   6.699  12.151
    5    HG   LEU  26           HG       LEU  26  13.156   8.650  13.525
    6   HD12  LEU  26          HD11      LEU  26  12.464  10.737  12.194
    7   HD11  LEU  26          HD12      LEU  26  13.457  10.097  10.888
    8   HD13  LEU  26          HD13      LEU  26  14.193  10.497  12.440
    9   HD21  LEU  26          HD21      LEU  26  11.489   8.305  11.014
   10   HD23  LEU  26          HD22      LEU  26  10.916   8.997  12.528
   11   HD22  LEU  26          HD23      LEU  26  11.395   7.303  12.462

  No H/Q in entry =          11
  In of MODEL   58
    1    H    LYS  27           H        LYS  27  15.644   6.216  13.850
    2    HA   LYS  27           HA       LYS  27  15.026   7.578  16.214
    3    HB2  LYS  27           HB2      LYS  27  15.093   5.103  15.955
    4    HB3  LYS  27           HB3      LYS  27  16.856   5.183  15.914
    5    HG2  LYS  27           HG2      LYS  27  16.887   6.174  18.162
    6    HG3  LYS  27           HG3      LYS  27  15.120   6.165  18.205
    7    HD2  LYS  27           HD2      LYS  27  15.133   3.698  17.973
    8    HD3  LYS  27           HD3      LYS  27  16.898   3.714  17.965
    9    HE2  LYS  27           HE2      LYS  27  16.913   4.709  20.219
   10    HE3  LYS  27           HE3      LYS  27  15.147   4.722  20.231
   11    HZ3  LYS  27           HZ1      LYS  27  15.963   2.785  21.387
   12    HZ2  LYS  27           HZ2      LYS  27  16.888   2.316  20.039
   13    HZ1  LYS  27           HZ3      LYS  27  15.190   2.296  19.957

  No H/Q in entry =          13
  In of MODEL   58
    1    H    GLN  28           H        GLN  28  18.154   7.039  14.628
    2    HA   GLN  28           HA       GLN  28  19.818   8.152  16.619
    3    HB2  GLN  28           HB2      GLN  28  20.113   8.107  13.604
    4    HB3  GLN  28           HB3      GLN  28  21.390   8.595  14.717
    5    HG2  GLN  28           HG2      GLN  28  20.004   5.900  14.762
    6    HG3  GLN  28           HG3      GLN  28  21.580   6.205  14.035
    7   HE21  GLN  28          HE21      GLN  28  20.328   4.886  16.748
    8   HE22  GLN  28          HE22      GLN  28  21.518   5.321  17.876

  No H/Q in entry =           8
  In of MODEL   58
    1    H    ALA  29           H        ALA  29  18.049   9.603  13.921
    2    HA   ALA  29           HA       ALA  29  19.010  12.239  14.169
    3    HB2  ALA  29           HB1      ALA  29  17.304  12.848  12.694
    4    HB1  ALA  29           HB2      ALA  29  16.176  11.659  13.346
    5    HB3  ALA  29           HB3      ALA  29  17.516  11.134  12.326

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LYS  30           H        LYS  30  16.254  10.603  15.690
    2    HA   LYS  30           HA       LYS  30  15.206  12.845  17.040
    3    HB2  LYS  30           HB2      LYS  30  15.134   9.904  17.751
    4    HB3  LYS  30           HB3      LYS  30  14.250  11.144  18.640
    5    HG2  LYS  30           HG2      LYS  30  13.119  11.810  16.519
    6    HG3  LYS  30           HG3      LYS  30  13.943  10.483  15.696
    7    HD2  LYS  30           HD2      LYS  30  12.891   8.865  17.226
    8    HD3  LYS  30           HD3      LYS  30  12.077  10.181  18.073
    9    HE2  LYS  30           HE2      LYS  30  10.904  10.793  15.977
   10    HE3  LYS  30           HE3      LYS  30  11.698   9.448  15.151
   11    HZ2  LYS  30           HZ1      LYS  30   9.394   9.008  16.028
   12    HZ1  LYS  30           HZ2      LYS  30  10.059   9.074  17.596
   13    HZ3  LYS  30           HZ3      LYS  30  10.585   7.894  16.489

  No H/Q in entry =          13
  In of MODEL   58
    1    H    GLN  31           H        GLN  31  17.895  10.714  17.786
    2    HA   GLN  31           HA       GLN  31  18.205  11.738  20.479
    3    HB2  GLN  31           HB2      GLN  31  20.251  10.192  18.880
    4    HB3  GLN  31           HB3      GLN  31  20.113  10.318  20.634
    5    HG2  GLN  31           HG2      GLN  31  17.614   9.330  19.864
    6    HG3  GLN  31           HG3      GLN  31  18.728   8.499  18.787
    7   HE21  GLN  31          HE21      GLN  31  17.198   7.336  21.064
    8   HE22  GLN  31          HE22      GLN  31  18.361   6.694  22.117

  No H/Q in entry =           8
  In of MODEL   58
    1    H    GLY  32           H        GLY  32  18.710  13.056  17.510
    2    HA3  GLY  32           HA2      GLY  32  19.668  15.114  16.993
    3    HA2  GLY  32           HA3      GLY  32  20.423  15.132  18.582

  No H/Q in entry =           3
  In of MODEL   58
    1    H    ASP  33           H        ASP  33  20.887  12.242  16.812
    2    HA   ASP  33           HA       ASP  33  23.703  12.954  16.348
    3    HB2  ASP  33           HB2      ASP  33  22.230  10.319  16.468
    4    HB3  ASP  33           HB3      ASP  33  23.915  10.457  15.975

  No H/Q in entry =           4
  In of MODEL   58
    1    H    PHE  34           H        PHE  34  23.206  14.267  14.463
    2    HA   PHE  34           HA       PHE  34  21.874  13.260  12.176
    3    HB2  PHE  34           HB2      PHE  34  23.976  15.423  12.405
    4    HB3  PHE  34           HB3      PHE  34  22.996  15.116  10.972
    5    HD1  PHE  34           HD1      PHE  34  23.216  17.060  13.882
    6    HD2  PHE  34           HD2      PHE  34  20.372  14.900  11.496
    7    HE1  PHE  34           HE1      PHE  34  21.380  18.435  14.823
    8    HE2  PHE  34           HE2      PHE  34  18.539  16.274  12.441
    9    HZ   PHE  34           HZ       PHE  34  19.046  18.042  14.100

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ALA  35           H        ALA  35  25.250  13.121  13.189
    2    HA   ALA  35           HA       ALA  35  26.370  12.310  10.735
    3    HB3  ALA  35           HB1      ALA  35  28.064  11.168  12.460
    4    HB2  ALA  35           HB2      ALA  35  27.184  12.184  13.602
    5    HB1  ALA  35           HB3      ALA  35  28.013  12.916  12.229

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ALA  36           H        ALA  36  25.278  10.345  13.504
    2    HA   ALA  36           HA       ALA  36  25.799   7.861  12.234
    3    HB2  ALA  36           HB1      ALA  36  25.376   7.113  14.310
    4    HB3  ALA  36           HB2      ALA  36  23.681   7.584  14.157
    5    HB1  ALA  36           HB3      ALA  36  24.865   8.734  14.779

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ALA  37           H        ALA  37  22.947   9.947  12.359
    2    HA   ALA  37           HA       ALA  37  21.118   8.148  11.185
    3    HB3  ALA  37           HB1      ALA  37  21.300  11.115  11.471
    4    HB1  ALA  37           HB2      ALA  37  20.004  10.018  11.944
    5    HB2  ALA  37           HB3      ALA  37  20.188  10.489  10.253

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LYS  38           H        LYS  38  23.183  10.637   9.703
    2    HA   LYS  38           HA       LYS  38  22.554  10.194   7.026
    3    HB2  LYS  38           HB2      LYS  38  24.339  11.781   8.470
    4    HB3  LYS  38           HB3      LYS  38  25.388  10.805   7.448
    5    HG2  LYS  38           HG2      LYS  38  24.215  11.554   5.449
    6    HG3  LYS  38           HG3      LYS  38  23.006  12.392   6.426
    7    HD2  LYS  38           HD2      LYS  38  24.576  14.016   7.177
    8    HD3  LYS  38           HD3      LYS  38  25.951  13.049   6.646
    9    HE2  LYS  38           HE2      LYS  38  25.569  14.912   5.090
   10    HE3  LYS  38           HE3      LYS  38  25.258  13.367   4.288
   11    HZ3  LYS  38           HZ1      LYS  38  23.055  13.779   4.154
   12    HZ2  LYS  38           HZ2      LYS  38  23.553  15.402   4.239
   13    HZ1  LYS  38           HZ3      LYS  38  22.989  14.612   5.632

  No H/Q in entry =          13
  In of MODEL   58
    1    H    ALA  39           H        ALA  39  25.089   8.639   8.989
    2    HA   ALA  39           HA       ALA  39  26.186   7.062   6.924
    3    HB2  ALA  39           HB1      ALA  39  26.108   6.103   9.770
    4    HB1  ALA  39           HB2      ALA  39  27.039   7.542   9.352
    5    HB3  ALA  39           HB3      ALA  39  27.415   5.996   8.593

  No H/Q in entry =           5
  In of MODEL   58
    1    H    MET  40           H        MET  40  23.579   6.411   9.220
    2    HA   MET  40           HA       MET  40  23.179   3.698   8.491
    3    HB2  MET  40           HB2      MET  40  21.329   5.716   9.777
    4    HB3  MET  40           HB3      MET  40  20.949   4.000   9.605
    5    HG2  MET  40           HG2      MET  40  23.482   4.984  10.947
    6    HG3  MET  40           HG3      MET  40  21.991   4.687  11.839
    7    HE3  MET  40           HE1      MET  40  21.484   1.045  12.022
    8    HE2  MET  40           HE2      MET  40  20.596   2.333  11.210
    9    HE1  MET  40           HE3      MET  40  21.330   2.635  12.784

  No H/Q in entry =           9
  In of MODEL   58
    1    H    MET  41           H        MET  41  21.719   6.726   7.295
    2    HA   MET  41           HA       MET  41  19.783   5.497   5.623
    3    HB2  MET  41           HB2      MET  41  21.224   8.109   5.107
    4    HB3  MET  41           HB3      MET  41  19.705   7.590   4.387
    5    HG2  MET  41           HG2      MET  41  18.959   7.395   6.938
    6    HG3  MET  41           HG3      MET  41  20.249   8.574   7.159
    7    HE2  MET  41           HE1      MET  41  19.670   9.845   3.819
    8    HE1  MET  41           HE2      MET  41  20.618  10.303   5.231
    9    HE3  MET  41           HE3      MET  41  19.329  11.361   4.663

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ASP  42           H        ASP  42  23.142   6.472   5.073
    2    HA   ASP  42           HA       ASP  42  23.245   5.994   2.316
    3    HB2  ASP  42           HB2      ASP  42  24.977   7.023   4.086
    4    HB3  ASP  42           HB3      ASP  42  25.661   5.408   3.963

  No H/Q in entry =           4
  In of MODEL   58
    1    H    GLN  43           H        GLN  43  24.000   3.857   5.043
    2    HA   GLN  43           HA       GLN  43  24.702   1.606   3.465
    3    HB2  GLN  43           HB2      GLN  43  23.673   1.780   6.307
    4    HB3  GLN  43           HB3      GLN  43  24.276   0.298   5.556
    5    HG2  GLN  43           HG2      GLN  43  26.421   1.542   5.045
    6    HG3  GLN  43           HG3      GLN  43  25.815   2.862   6.041
    7   HE21  GLN  43          HE21      GLN  43  28.063   1.927   7.083
    8   HE22  GLN  43          HE22      GLN  43  27.804   0.843   8.361

  No H/Q in entry =           8
  In of MODEL   58
    1    H    SER  44           H        SER  44  21.626   2.694   4.844
    2    HA   SER  44           HA       SER  44  20.095   0.425   4.174
    3    HB2  SER  44           HB2      SER  44  19.611   2.949   5.314
    4    HB3  SER  44           HB3      SER  44  18.579   2.886   3.888
    5    HG   SER  44           HG       SER  44  17.499   1.929   5.611

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ARG  45           H        ARG  45  20.792   3.397   2.364
    2    HA   ARG  45           HA       ARG  45  19.278   2.882   0.058
    3    HB2  ARG  45           HB2      ARG  45  20.387   5.037   0.640
    4    HB3  ARG  45           HB3      ARG  45  21.944   4.306   0.258
    5    HG2  ARG  45           HG2      ARG  45  21.170   3.884  -2.057
    6    HG3  ARG  45           HG3      ARG  45  19.625   4.638  -1.674
    7    HD2  ARG  45           HD2      ARG  45  20.841   6.755  -1.093
    8    HD3  ARG  45           HD3      ARG  45  22.351   6.004  -1.658
    9    HE   ARG  45           HE       ARG  45  20.427   5.731  -3.695
   10   HH21  ARG  45          HH11      ARG  45  20.400   7.097  -5.462
   11   HH22  ARG  45          HH12      ARG  45  21.133   8.659  -5.360
   12   HH11  ARG  45          HH21      ARG  45  22.116   8.260  -2.072
   13   HH12  ARG  45          HH22      ARG  45  22.103   9.317  -3.438

  No H/Q in entry =          13
  In of MODEL   58
    1    H    MET  46           H        MET  46  22.655   2.062   0.812
    2    HA   MET  46           HA       MET  46  23.282   0.873  -1.669
    3    HB2  MET  46           HB2      MET  46  24.390   0.572   1.122
    4    HB3  MET  46           HB3      MET  46  25.061  -0.317  -0.249
    5    HG2  MET  46           HG2      MET  46  25.498   1.776  -1.438
    6    HG3  MET  46           HG3      MET  46  24.744   2.698  -0.145
    7    HE1  MET  46           HE1      MET  46  27.419   0.439  -1.337
    8    HE3  MET  46           HE2      MET  46  27.346  -0.462   0.174
    9    HE2  MET  46           HE3      MET  46  28.760   0.527  -0.185

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ALA  47           H        ALA  47  21.916  -0.475   1.308
    2    HA   ALA  47           HA       ALA  47  21.904  -3.190   0.512
    3    HB2  ALA  47           HB1      ALA  47  21.517  -2.730   2.815
    4    HB3  ALA  47           HB2      ALA  47  19.990  -3.357   2.196
    5    HB1  ALA  47           HB3      ALA  47  20.193  -1.622   2.451

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LEU  48           H        LEU  48  19.513  -0.599   0.147
    2    HA   LEU  48           HA       LEU  48  17.492  -2.165  -1.101
    3    HB2  LEU  48           HB2      LEU  48  18.103   0.798  -1.223
    4    HB3  LEU  48           HB3      LEU  48  16.643   0.064  -1.889
    5    HG   LEU  48           HG       LEU  48  17.499  -0.218   1.001
    6   HD13  LEU  48          HD11      LEU  48  17.047   2.076   0.809
    7   HD12  LEU  48          HD12      LEU  48  15.498   1.407   1.319
    8   HD11  LEU  48          HD13      LEU  48  15.764   1.829  -0.373
    9   HD22  LEU  48          HD21      LEU  48  15.996  -1.956   0.624
   10   HD21  LEU  48          HD22      LEU  48  15.109  -1.069  -0.617
   11   HD23  LEU  48          HD23      LEU  48  14.890  -0.663   1.085

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ASN  49           H        ASN  49  20.152  -0.201  -2.336
    2    HA   ASN  49           HA       ASN  49  19.503  -0.301  -5.059
    3    HB2  ASN  49           HB2      ASN  49  21.156   1.246  -4.164
    4    HB3  ASN  49           HB3      ASN  49  22.198  -0.088  -3.686
    5   HD21  ASN  49          HD21      ASN  49  20.727   1.406  -6.591
    6   HD22  ASN  49          HD22      ASN  49  21.975   0.948  -7.645

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLU  50           H        GLU  50  21.518  -2.462  -3.091
    2    HA   GLU  50           HA       GLU  50  22.246  -4.213  -5.212
    3    HB2  GLU  50           HB2      GLU  50  23.442  -4.165  -3.046
    4    HB3  GLU  50           HB3      GLU  50  22.009  -4.811  -2.248
    5    HG2  GLU  50           HG2      GLU  50  22.128  -6.846  -3.602
    6    HG3  GLU  50           HG3      GLU  50  23.494  -6.197  -4.504

  No H/Q in entry =           6
  In of MODEL   58
    1    H    ALA  51           H        ALA  51  19.588  -4.179  -2.886
    2    HA   ALA  51           HA       ALA  51  18.458  -6.671  -3.637
    3    HB3  ALA  51           HB1      ALA  51  16.858  -6.184  -2.083
    4    HB1  ALA  51           HB2      ALA  51  16.621  -4.542  -2.687
    5    HB2  ALA  51           HB3      ALA  51  17.986  -4.906  -1.629

  No H/Q in entry =           5
  In of MODEL   58
    1    H    HIS  52           H        HIS  52  17.824  -3.335  -4.681
    2    HA   HIS  52           HA       HIS  52  15.719  -3.896  -6.480
    3    HB2  HIS  52           HB2      HIS  52  16.302  -1.620  -5.702
    4    HB3  HIS  52           HB3      HIS  52  17.793  -1.696  -6.639
    5    HD1  HIS  52           HD1      HIS  52  17.475  -1.980  -9.301
    6    HD2  HIS  52           HD2      HIS  52  14.058  -0.880  -7.181
    7    HE1  HIS  52           HE1      HIS  52  15.824  -1.100 -11.009
    8    HE2  HIS  52           HE2      HIS  52  13.735  -0.425  -9.732

  No H/Q in entry =           8
  In of MODEL   58
    1    H    LEU  53           H        LEU  53  19.237  -3.853  -6.912
    2    HA   LEU  53           HA       LEU  53  19.299  -4.176  -9.712
    3    HB2  LEU  53           HB2      LEU  53  21.241  -4.894  -7.532
    4    HB3  LEU  53           HB3      LEU  53  21.563  -5.297  -9.216
    5    HG   LEU  53           HG       LEU  53  20.857  -2.485  -8.321
    6   HD12  LEU  53          HD11      LEU  53  23.616  -3.654  -8.798
    7   HD11  LEU  53          HD12      LEU  53  22.940  -3.300  -7.207
    8   HD13  LEU  53          HD13      LEU  53  23.244  -1.993  -8.345
    9   HD21  LEU  53          HD21      LEU  53  21.935  -3.733 -10.854
   10   HD23  LEU  53          HD22      LEU  53  22.263  -2.043 -10.480
   11   HD22  LEU  53          HD23      LEU  53  20.608  -2.589 -10.685

  No H/Q in entry =          11
  In of MODEL   58
    1    H    VAL  54           H        VAL  54  19.221  -6.556  -7.079
    2    HA   VAL  54           HA       VAL  54  19.378  -8.853  -8.732
    3    HB   VAL  54           HB       VAL  54  18.217  -8.438  -5.966
    4   HG12  VAL  54          HG11      VAL  54  18.580 -11.051  -5.954
    5   HG11  VAL  54          HG12      VAL  54  18.393 -10.890  -7.700
    6   HG13  VAL  54          HG13      VAL  54  17.096 -10.376  -6.623
    7   HG22  VAL  54          HG21      VAL  54  20.530  -8.193  -5.743
    8   HG21  VAL  54          HG22      VAL  54  20.883  -9.283  -7.081
    9   HG23  VAL  54          HG23      VAL  54  20.363  -9.934  -5.527

  No H/Q in entry =           9
  In of MODEL   58
    1    H    GLN  55           H        GLN  55  16.622  -6.987  -7.455
    2    HA   GLN  55           HA       GLN  55  14.626  -8.685  -8.523
    3    HB2  GLN  55           HB2      GLN  55  13.855  -7.165  -6.901
    4    HB3  GLN  55           HB3      GLN  55  14.627  -5.788  -7.682
    5    HG2  GLN  55           HG2      GLN  55  12.898  -5.494  -9.172
    6    HG3  GLN  55           HG3      GLN  55  12.602  -7.220  -9.337
    7   HE21  GLN  55          HE21      GLN  55  10.604  -7.797  -8.530
    8   HE22  GLN  55          HE22      GLN  55   9.819  -7.050  -7.224

  No H/Q in entry =           8
  In of MODEL   58
    1    H    THR  56           H        THR  56  16.322  -5.863  -9.892
    2    HA   THR  56           HA       THR  56  14.879  -5.530 -12.241
    3    HB   THR  56           HB       THR  56  17.897  -5.396 -12.084
    4    HG1  THR  56           HG1      THR  56  15.891  -3.837 -10.958
    5   HG21  THR  56          HG21      THR  56  16.488  -5.114 -14.280
    6   HG23  THR  56          HG22      THR  56  17.768  -3.957 -13.913
    7   HG22  THR  56          HG23      THR  56  16.084  -3.539 -13.592

  No H/Q in entry =           7
  In of MODEL   58
    1    H    LYS  57           H        LYS  57  17.564  -7.784 -11.623
    2    HA   LYS  57           HA       LYS  57  17.583  -8.987 -14.197
    3    HB2  LYS  57           HB2      LYS  57  19.389  -9.219 -12.487
    4    HB3  LYS  57           HB3      LYS  57  18.300 -10.180 -11.498
    5    HG2  LYS  57           HG2      LYS  57  19.717 -11.707 -12.698
    6    HG3  LYS  57           HG3      LYS  57  18.112 -11.810 -13.411
    7    HD2  LYS  57           HD2      LYS  57  18.757 -10.532 -15.314
    8    HD3  LYS  57           HD3      LYS  57  20.246  -9.988 -14.543
    9    HE2  LYS  57           HE2      LYS  57  21.152 -12.266 -14.602
   10    HE3  LYS  57           HE3      LYS  57  19.647 -12.880 -15.286
   11    HZ3  LYS  57           HZ1      LYS  57  20.673 -12.526 -17.220
   12    HZ2  LYS  57           HZ2      LYS  57  21.800 -11.442 -16.559
   13    HZ1  LYS  57           HZ3      LYS  57  20.248 -10.901 -16.982

  No H/Q in entry =          13
  In of MODEL   58
    1    H    LEU  58           H        LEU  58  15.813  -9.672 -11.219
    2    HA   LEU  58           HA       LEU  58  14.629 -12.068 -12.146
    3    HB2  LEU  58           HB2      LEU  58  13.804 -10.168  -9.956
    4    HB3  LEU  58           HB3      LEU  58  13.022 -11.720 -10.267
    5    HG   LEU  58           HG       LEU  58  15.990 -11.393  -9.714
    6   HD11  LEU  58          HD11      LEU  58  13.626 -11.842  -7.920
    7   HD13  LEU  58          HD12      LEU  58  15.064 -10.855  -7.661
    8   HD12  LEU  58          HD13      LEU  58  15.164 -12.609  -7.520
    9   HD22  LEU  58          HD21      LEU  58  15.905 -13.459 -10.735
   10   HD21  LEU  58          HD22      LEU  58  14.195 -13.695 -10.373
   11   HD23  LEU  58          HD23      LEU  58  15.408 -13.972  -9.123

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  59           H        ILE  59  13.905  -8.744 -12.839
    2    HA   ILE  59           HA       ILE  59  11.200  -9.439 -13.777
    3    HB   ILE  59           HB       ILE  59  11.972  -7.140 -12.580
    4   HG12  ILE  59          HG12      ILE  59  10.058  -7.044 -14.922
    5   HG13  ILE  59          HG13      ILE  59   9.655  -7.836 -13.420
    6   HG23  ILE  59          HG21      ILE  59  12.528  -5.418 -14.088
    7   HG22  ILE  59          HG22      ILE  59  12.016  -6.335 -15.487
    8   HG21  ILE  59          HG23      ILE  59  13.512  -6.746 -14.653
    9   HD12  ILE  59          HD11      ILE  59   8.919  -5.404 -13.622
   10   HD11  ILE  59          HD12      ILE  59  10.628  -4.989 -13.504
   11   HD13  ILE  59          HD13      ILE  59   9.827  -5.817 -12.167

  No H/Q in entry =          11
  In of MODEL   58
    1    H    GLU  60           H        GLU  60  14.389  -8.541 -15.039
    2    HA   GLU  60           HA       GLU  60  13.603  -8.162 -17.748
    3    HB2  GLU  60           HB2      GLU  60  15.772  -7.396 -16.884
    4    HB3  GLU  60           HB3      GLU  60  16.262  -9.065 -16.605
    5    HG2  GLU  60           HG2      GLU  60  16.065  -9.533 -19.023
    6    HG3  GLU  60           HG3      GLU  60  15.573  -7.864 -19.305

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLY  61           H        GLY  61  14.626 -11.021 -15.923
    2    HA3  GLY  61           HA2      GLY  61  14.111 -12.685 -18.319
    3    HA2  GLY  61           HA3      GLY  61  15.151 -13.146 -16.976

  No H/Q in entry =           3
  In of MODEL   58
    1    H    ASP  62           H        ASP  62  12.005 -11.649 -16.612
    2    HA   ASP  62           HA       ASP  62  11.087 -13.489 -14.718
    3    HB2  ASP  62           HB2      ASP  62   8.865 -12.445 -15.135
    4    HB3  ASP  62           HB3      ASP  62  10.151 -11.273 -14.862

  No H/Q in entry =           4
  In of MODEL   58
    1    H    ALA  63           H        ALA  63  11.482 -14.067 -18.016
    2    HA   ALA  63           HA       ALA  63   9.155 -15.811 -18.355
    3    HB3  ALA  63           HB1      ALA  63   9.889 -14.652 -20.323
    4    HB1  ALA  63           HB2      ALA  63  10.312 -16.348 -20.547
    5    HB2  ALA  63           HB3      ALA  63  11.555 -15.184 -20.091

  No H/Q in entry =           5
  In of MODEL   58
    1    H    GLY  64           H        GLY  64   9.559 -18.073 -19.112
    2    HA3  GLY  64           HA2      GLY  64  11.349 -19.882 -19.048
    3    HA2  GLY  64           HA3      GLY  64  11.597 -19.340 -17.394

  No H/Q in entry =           3
  In of MODEL   58
    1    H    GLU  65           H        GLU  65   9.182 -19.106 -16.294
    2    HA   GLU  65           HA       GLU  65   8.395 -21.785 -15.890
    3    HB2  GLU  65           HB2      GLU  65   7.080 -19.192 -15.096
    4    HB3  GLU  65           HB3      GLU  65   6.509 -20.777 -14.576
    5    HG2  GLU  65           HG2      GLU  65   8.667 -21.253 -13.536
    6    HG3  GLU  65           HG3      GLU  65   9.315 -19.722 -14.121

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLY  66           H        GLY  66   7.062 -19.232 -17.827
    2    HA3  GLY  66           HA2      GLY  66   5.650 -21.021 -19.544
    3    HA2  GLY  66           HA3      GLY  66   4.558 -20.110 -18.520

  No H/Q in entry =           3
  In of MODEL   58
    1    H    LYS  67           H        LYS  67   4.363 -19.917 -21.208
    2    HA   LYS  67           HA       LYS  67   5.714 -18.253 -22.772
    3    HB2  LYS  67           HB2      LYS  67   3.425 -17.419 -23.614
    4    HB3  LYS  67           HB3      LYS  67   3.745 -19.158 -23.644
    5    HG2  LYS  67           HG2      LYS  67   2.610 -19.412 -21.469
    6    HG3  LYS  67           HG3      LYS  67   2.291 -17.680 -21.429
    7    HD2  LYS  67           HD2      LYS  67   0.922 -17.869 -23.462
    8    HD3  LYS  67           HD3      LYS  67   1.259 -19.601 -23.535
    9    HE2  LYS  67           HE2      LYS  67  -0.955 -19.005 -22.457
   10    HE3  LYS  67           HE3      LYS  67   0.109 -19.993 -21.457
   11    HZ2  LYS  67           HZ1      LYS  67  -0.910 -18.076 -20.285
   12    HZ1  LYS  67           HZ2      LYS  67  -0.029 -17.035 -21.295
   13    HZ3  LYS  67           HZ3      LYS  67   0.785 -18.088 -20.238

  No H/Q in entry =          13
  In of MODEL   58
    1    H    MET  68           H        MET  68   3.055 -16.363 -22.293
    2    HA   MET  68           HA       MET  68   4.462 -13.961 -21.898
    3    HB2  MET  68           HB2      MET  68   1.525 -14.582 -21.570
    4    HB3  MET  68           HB3      MET  68   2.216 -12.962 -21.663
    5    HG2  MET  68           HG2      MET  68   3.317 -14.275 -23.858
    6    HG3  MET  68           HG3      MET  68   1.651 -14.853 -23.811
    7    HE3  MET  68           HE1      MET  68   2.598 -10.858 -22.630
    8    HE2  MET  68           HE2      MET  68   3.449 -10.794 -24.171
    9    HE1  MET  68           HE3      MET  68   3.817 -12.080 -23.024

  No H/Q in entry =           9
  In of MODEL   58
    1    H    LYS  69           H        LYS  69   2.757 -16.023 -19.546
    2    HA   LYS  69           HA       LYS  69   2.552 -14.224 -17.443
    3    HB2  LYS  69           HB2      LYS  69   2.831 -17.220 -17.487
    4    HB3  LYS  69           HB3      LYS  69   2.579 -16.321 -15.989
    5    HG2  LYS  69           HG2      LYS  69   0.500 -15.428 -16.758
    6    HG3  LYS  69           HG3      LYS  69   0.805 -15.964 -18.410
    7    HD2  LYS  69           HD2      LYS  69  -0.816 -17.374 -16.959
    8    HD3  LYS  69           HD3      LYS  69   0.429 -18.230 -17.869
    9    HE2  LYS  69           HE2      LYS  69   1.813 -18.468 -15.930
   10    HE3  LYS  69           HE3      LYS  69   0.825 -17.337 -15.007
   11    HZ3  LYS  69           HZ1      LYS  69  -0.941 -18.860 -14.920
   12    HZ2  LYS  69           HZ2      LYS  69   0.448 -19.766 -14.553
   13    HZ1  LYS  69           HZ3      LYS  69  -0.255 -19.868 -16.096

  No H/Q in entry =          13
  In of MODEL   58
    1    H    VAL  70           H        VAL  70   3.651 -14.304 -15.274
    2    HA   VAL  70           HA       VAL  70   6.587 -14.637 -15.513
    3    HB   VAL  70           HB       VAL  70   6.823 -12.578 -14.136
    4   HG11  VAL  70          HG11      VAL  70   6.959 -12.518 -16.627
    5   HG13  VAL  70          HG12      VAL  70   6.349 -11.007 -15.951
    6   HG12  VAL  70          HG13      VAL  70   5.234 -12.158 -16.687
    7   HG23  VAL  70          HG21      VAL  70   3.843 -12.241 -14.660
    8   HG22  VAL  70          HG22      VAL  70   4.890 -11.108 -13.809
    9   HG21  VAL  70          HG23      VAL  70   4.537 -12.683 -13.100

  No H/Q in entry =           9
  In of MODEL   58
    1    H    SER  71           H        SER  71   7.635 -14.674 -13.326
    2    HA   SER  71           HA       SER  71   6.554 -16.695 -11.673
    3    HB2  SER  71           HB2      SER  71   8.977 -16.158 -11.813
    4    HB3  SER  71           HB3      SER  71   8.669 -14.637 -10.979
    5    HG   SER  71           HG       SER  71   8.291 -17.286 -10.036

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LEU  72           H        LEU  72   5.202 -16.610  -9.970
    2    HA   LEU  72           HA       LEU  72   3.615 -14.320  -9.533
    3    HB2  LEU  72           HB2      LEU  72   3.943 -16.868  -7.956
    4    HB3  LEU  72           HB3      LEU  72   2.755 -15.628  -7.560
    5    HG   LEU  72           HG       LEU  72   2.934 -16.924 -10.300
    6   HD12  LEU  72          HD11      LEU  72   0.993 -17.597  -8.073
    7   HD11  LEU  72          HD12      LEU  72   2.429 -18.556  -8.428
    8   HD13  LEU  72          HD13      LEU  72   1.153 -18.401  -9.636
    9   HD23  LEU  72          HD21      LEU  72   0.430 -16.155 -10.193
   10   HD22  LEU  72          HD22      LEU  72   1.655 -14.941 -10.529
   11   HD21  LEU  72          HD23      LEU  72   0.982 -15.086  -8.909

  No H/Q in entry =          11
  In of MODEL   58
    1    H    VAL  73           H        VAL  73   6.293 -15.710  -7.755
    2    HA   VAL  73           HA       VAL  73   6.207 -14.172  -5.427
    3    HB   VAL  73           HB       VAL  73   8.404 -14.943  -4.998
    4   HG11  VAL  73          HG11      VAL  73   6.500 -16.655  -5.288
    5   HG13  VAL  73          HG12      VAL  73   8.150 -17.280  -5.306
    6   HG12  VAL  73          HG13      VAL  73   7.270 -17.065  -6.819
    7   HG22  VAL  73          HG21      VAL  73   9.722 -14.359  -6.829
    8   HG21  VAL  73          HG22      VAL  73   8.580 -15.027  -7.993
    9   HG23  VAL  73          HG23      VAL  73   9.601 -16.106  -7.043

  No H/Q in entry =           9
  In of MODEL   58
    1    H    LEU  74           H        LEU  74   7.185 -13.271  -8.605
    2    HA   LEU  74           HA       LEU  74   9.099 -11.290  -8.116
    3    HB2  LEU  74           HB2      LEU  74   8.652 -12.056 -10.352
    4    HB3  LEU  74           HB3      LEU  74   6.981 -11.506 -10.255
    5    HG   LEU  74           HG       LEU  74   7.766  -9.169 -10.040
    6   HD11  LEU  74          HD11      LEU  74  10.456 -10.537 -10.160
    7   HD13  LEU  74          HD12      LEU  74   9.890  -9.338  -8.998
    8   HD12  LEU  74          HD13      LEU  74  10.263  -8.855 -10.652
    9   HD23  LEU  74          HD21      LEU  74   9.240 -10.251 -12.383
   10   HD22  LEU  74          HD22      LEU  74   8.080  -8.948 -12.280
   11   HD21  LEU  74          HD23      LEU  74   7.518 -10.605 -12.259

  No H/Q in entry =          11
  In of MODEL   58
    1    H    VAL  75           H        VAL  75   5.598 -10.962  -8.474
    2    HA   VAL  75           HA       VAL  75   5.458  -8.206  -7.894
    3    HB   VAL  75           HB       VAL  75   3.402 -10.381  -7.502
    4   HG12  VAL  75          HG11      VAL  75   1.789  -8.445  -7.414
    5   HG11  VAL  75          HG12      VAL  75   3.166  -7.353  -7.362
    6   HG13  VAL  75          HG13      VAL  75   2.888  -8.475  -6.039
    7   HG22  VAL  75          HG21      VAL  75   2.581  -9.686  -9.629
    8   HG21  VAL  75          HG22      VAL  75   4.330  -9.773  -9.833
    9   HG23  VAL  75          HG23      VAL  75   3.544  -8.209  -9.608

  No H/Q in entry =           9
  In of MODEL   58
    1    H    GLU  76           H        GLU  76   5.247 -11.081  -5.777
    2    HA   GLU  76           HA       GLU  76   4.752  -9.721  -3.360
    3    HB2  GLU  76           HB2      GLU  76   4.645 -12.211  -3.648
    4    HB3  GLU  76           HB3      GLU  76   6.396 -12.245  -3.770
    5    HG2  GLU  76           HG2      GLU  76   6.595 -11.351  -1.484
    6    HG3  GLU  76           HG3      GLU  76   4.849 -11.276  -1.334

  No H/Q in entry =           6
  In of MODEL   58
    1    H    ALA  77           H        ALA  77   7.828 -10.584  -4.916
    2    HA   ALA  77           HA       ALA  77   9.498  -9.509  -2.901
    3    HB3  ALA  77           HB1      ALA  77   9.924 -10.042  -5.840
    4    HB1  ALA  77           HB2      ALA  77  10.510 -10.976  -4.463
    5    HB2  ALA  77           HB3      ALA  77  11.197  -9.389  -4.809

  No H/Q in entry =           5
  In of MODEL   58
    1    H    GLN  78           H        GLN  78   8.088  -8.121  -5.821
    2    HA   GLN  78           HA       GLN  78   9.403  -5.621  -5.721
    3    HB2  GLN  78           HB2      GLN  78   8.077  -6.614  -7.657
    4    HB3  GLN  78           HB3      GLN  78   6.619  -6.132  -6.791
    5    HG2  GLN  78           HG2      GLN  78   7.286  -3.806  -6.845
    6    HG3  GLN  78           HG3      GLN  78   8.848  -4.226  -7.547
    7   HE21  GLN  78          HE21      GLN  78   5.401  -5.043  -8.315
    8   HE22  GLN  78          HE22      GLN  78   5.553  -4.711  -9.972

  No H/Q in entry =           8
  In of MODEL   58
    1    H    LEU  79           H        LEU  79   6.398  -6.801  -4.293
    2    HA   LEU  79           HA       LEU  79   5.366  -4.406  -3.292
    3    HB2  LEU  79           HB2      LEU  79   4.083  -6.477  -3.234
    4    HB3  LEU  79           HB3      LEU  79   5.236  -7.196  -2.114
    5    HG   LEU  79           HG       LEU  79   4.656  -5.558  -0.393
    6   HD13  LEU  79          HD11      LEU  79   4.162  -3.554  -1.450
    7   HD12  LEU  79          HD12      LEU  79   2.544  -4.102  -1.012
    8   HD11  LEU  79          HD13      LEU  79   3.131  -4.320  -2.659
    9   HD23  LEU  79          HD21      LEU  79   2.077  -6.089  -0.306
   10   HD22  LEU  79          HD22      LEU  79   3.236  -7.411  -0.192
   11   HD21  LEU  79          HD23      LEU  79   2.421  -7.090  -1.719

  No H/Q in entry =          11
  In of MODEL   58
    1    H    HIS  80           H        HIS  80   7.580  -6.704  -1.698
    2    HA   HIS  80           HA       HIS  80   7.840  -5.152   0.667
    3    HB2  HIS  80           HB2      HIS  80   9.216  -7.499  -0.523
    4    HB3  HIS  80           HB3      HIS  80  10.110  -6.585   0.694
    5    HD1  HIS  80           HD1      HIS  80   9.624  -7.222   3.037
    6    HD2  HIS  80           HD2      HIS  80   6.425  -8.127   0.520
    7    HE1  HIS  80           HE1      HIS  80   7.865  -8.348   4.485
    8    HE2  HIS  80           HE2      HIS  80   5.909  -8.903   2.959

  No H/Q in entry =           8
  In of MODEL   58
    1    H    LEU  81           H        LEU  81   9.856  -5.406  -2.240
    2    HA   LEU  81           HA       LEU  81  11.872  -3.633  -1.361
    3    HB2  LEU  81           HB2      LEU  81  10.970  -4.447  -4.124
    4    HB3  LEU  81           HB3      LEU  81  12.374  -3.419  -3.833
    5    HG   LEU  81           HG       LEU  81  12.018  -6.142  -2.553
    6   HD12  LEU  81          HD11      LEU  81  13.847  -6.747  -4.297
    7   HD11  LEU  81          HD12      LEU  81  13.263  -5.333  -5.174
    8   HD13  LEU  81          HD13      LEU  81  12.170  -6.673  -4.835
    9   HD23  LEU  81          HD21      LEU  81  14.641  -5.789  -2.534
   10   HD22  LEU  81          HD22      LEU  81  13.645  -5.040  -1.288
   11   HD21  LEU  81          HD23      LEU  81  14.214  -4.083  -2.656

  No H/Q in entry =          11
  In of MODEL   58
    1    H    MET  82           H        MET  82   8.946  -3.044  -3.307
    2    HA   MET  82           HA       MET  82   9.448  -0.312  -3.814
    3    HB2  MET  82           HB2      MET  82   6.911  -1.941  -3.691
    4    HB3  MET  82           HB3      MET  82   6.888  -0.218  -4.060
    5    HG2  MET  82           HG2      MET  82   8.521  -2.273  -5.586
    6    HG3  MET  82           HG3      MET  82   6.947  -1.674  -6.104
    7    HE3  MET  82           HE1      MET  82   7.350   1.784  -7.284
    8    HE2  MET  82           HE2      MET  82   6.974   1.557  -5.577
    9    HE1  MET  82           HE3      MET  82   6.327   0.435  -6.771

  No H/Q in entry =           9
  In of MODEL   58
    1    H    THR  83           H        THR  83   7.672  -1.928  -1.209
    2    HA   THR  83           HA       THR  83   6.785   0.412   0.109
    3    HB   THR  83           HB       THR  83   6.667  -1.159   2.131
    4    HG1  THR  83           HG1      THR  83   7.452  -3.099   1.908
    5   HG22  THR  83          HG21      THR  83   5.040  -2.752   0.663
    6   HG21  THR  83          HG22      THR  83   5.251  -1.423  -0.472
    7   HG23  THR  83          HG23      THR  83   4.602  -1.112   1.138

  No H/Q in entry =           7
  In of MODEL   58
    1    H    SER  84           H        SER  84   9.636  -1.646   0.643
    2    HA   SER  84           HA       SER  84  10.670  -0.195   2.830
    3    HB2  SER  84           HB2      SER  84  11.954  -2.026   0.813
    4    HB3  SER  84           HB3      SER  84  12.887  -1.256   2.095
    5    HG   SER  84           HG       SER  84  10.634  -2.976   2.353

  No H/Q in entry =           5
  In of MODEL   58
    1    H    MET  85           H        MET  85  11.429   0.067  -0.657
    2    HA   MET  85           HA       MET  85  13.400   2.059  -0.406
    3    HB2  MET  85           HB2      MET  85  13.021   0.764  -2.469
    4    HB3  MET  85           HB3      MET  85  11.489   1.605  -2.706
    5    HG2  MET  85           HG2      MET  85  12.660   3.755  -2.852
    6    HG3  MET  85           HG3      MET  85  14.198   2.955  -2.541
    7    HE1  MET  85           HE1      MET  85  11.169   3.344  -4.586
    8    HE3  MET  85           HE2      MET  85  11.171   1.653  -5.077
    9    HE2  MET  85           HE3      MET  85  11.578   2.899  -6.250

  No H/Q in entry =           9
  In of MODEL   58
    1    H    LEU  86           H        LEU  86   9.907   2.346  -0.925
    2    HA   LEU  86           HA       LEU  86   9.807   5.158  -1.114
    3    HB2  LEU  86           HB2      LEU  86   7.986   3.472  -1.691
    4    HB3  LEU  86           HB3      LEU  86   7.653   3.383   0.039
    5    HG   LEU  86           HG       LEU  86   7.458   5.941  -0.021
    6   HD11  LEU  86          HD11      LEU  86   8.247   5.508  -2.720
    7   HD13  LEU  86          HD12      LEU  86   7.789   7.032  -1.964
    8   HD12  LEU  86          HD13      LEU  86   6.568   6.051  -2.770
    9   HD23  LEU  86          HD21      LEU  86   5.347   4.556  -1.686
   10   HD22  LEU  86          HD22      LEU  86   5.137   5.816  -0.473
   11   HD21  LEU  86          HD23      LEU  86   5.557   4.179   0.025

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ALA  87           H        ALA  87   9.362   2.980   1.636
    2    HA   ALA  87           HA       ALA  87   8.783   4.892   3.599
    3    HB1  ALA  87           HB1      ALA  87   9.627   2.083   3.522
    4    HB3  ALA  87           HB2      ALA  87   8.489   2.883   4.603
    5    HB2  ALA  87           HB3      ALA  87  10.216   2.938   4.951

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ARG  88           H        ARG  88  11.888   3.505   2.630
    2    HA   ARG  88           HA       ARG  88  13.474   4.909   4.463
    3    HB2  ARG  88           HB2      ARG  88  14.172   2.940   3.066
    4    HB3  ARG  88           HB3      ARG  88  14.314   4.032   1.691
    5    HG2  ARG  88           HG2      ARG  88  15.765   5.370   3.637
    6    HG3  ARG  88           HG3      ARG  88  16.106   3.685   4.022
    7    HD2  ARG  88           HD2      ARG  88  17.381   3.400   2.179
    8    HD3  ARG  88           HD3      ARG  88  16.236   4.254   1.140
    9    HE   ARG  88           HE       ARG  88  18.614   5.352   2.191
   10   HH21  ARG  88          HH11      ARG  88  18.931   7.574   1.991
   11   HH22  ARG  88          HH12      ARG  88  17.567   8.628   1.842
   12   HH11  ARG  88          HH21      ARG  88  15.266   6.061   1.903
   13   HH12  ARG  88          HH22      ARG  88  15.490   7.768   1.767

  No H/Q in entry =          13
  In of MODEL   58
    1    H    GLU  89           H        GLU  89  12.498   5.785   1.135
    2    HA   GLU  89           HA       GLU  89  14.014   8.165   0.976
    3    HB2  GLU  89           HB2      GLU  89  12.888   7.104  -0.972
    4    HB3  GLU  89           HB3      GLU  89  11.335   7.627  -0.319
    5    HG2  GLU  89           HG2      GLU  89  12.007   9.973  -0.486
    6    HG3  GLU  89           HG3      GLU  89  13.619   9.501  -1.018

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LEU  90           H        LEU  90  10.689   7.615   2.099
    2    HA   LEU  90           HA       LEU  90  10.138  10.343   2.666
    3    HB2  LEU  90           HB2      LEU  90   8.974   7.757   3.697
    4    HB3  LEU  90           HB3      LEU  90   8.322   9.345   4.114
    5    HG   LEU  90           HG       LEU  90   8.758   8.463   1.249
    6   HD12  LEU  90          HD11      LEU  90   6.228   8.102   1.306
    7   HD11  LEU  90          HD12      LEU  90   6.379   8.098   3.063
    8   HD13  LEU  90          HD13      LEU  90   7.215   6.877   2.104
    9   HD22  LEU  90          HD21      LEU  90   8.434  10.767   1.168
   10   HD21  LEU  90          HD22      LEU  90   7.444  10.790   2.626
   11   HD23  LEU  90          HD23      LEU  90   6.757  10.223   1.105

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  91           H        ILE  91  11.431   7.683   4.598
    2    HA   ILE  91           HA       ILE  91  11.548   9.056   7.063
    3    HB   ILE  91           HB       ILE  91  13.134   6.736   5.949
    4   HG12  ILE  91          HG12      ILE  91  11.111   6.883   8.204
    5   HG13  ILE  91          HG13      ILE  91  10.648   6.591   6.528
    6   HG22  ILE  91          HG21      ILE  91  13.601   6.535   8.591
    7   HG21  ILE  91          HG22      ILE  91  13.503   8.292   8.485
    8   HG23  ILE  91          HG23      ILE  91  14.695   7.417   7.526
    9   HD13  ILE  91          HD11      ILE  91  11.678   4.502   6.465
   10   HD12  ILE  91          HD12      ILE  91  11.080   4.557   8.124
   11   HD11  ILE  91          HD13      ILE  91  12.778   4.892   7.788

  No H/Q in entry =          11
  In of MODEL   58
    1    H    THR  92           H        THR  92  13.773   8.909   4.317
    2    HA   THR  92           HA       THR  92  15.917  10.333   5.477
    3    HB   THR  92           HB       THR  92  14.939  10.188   2.615
    4    HG1  THR  92           HG1      THR  92  15.795   8.303   3.026
    5   HG22  THR  92          HG21      THR  92  17.501  10.911   2.325
    6   HG21  THR  92          HG22      THR  92  17.179  11.732   3.851
    7   HG23  THR  92          HG23      THR  92  16.207  12.103   2.428

  No H/Q in entry =           7
  In of MODEL   58
    1    H    GLU  93           H        GLU  93  13.019  11.444   3.739
    2    HA   GLU  93           HA       GLU  93  13.578  14.213   3.847
    3    HB2  GLU  93           HB2      GLU  93  10.892  12.805   3.859
    4    HB3  GLU  93           HB3      GLU  93  11.158  14.507   3.484
    5    HG2  GLU  93           HG2      GLU  93  12.528  12.279   1.964
    6    HG3  GLU  93           HG3      GLU  93  10.974  12.940   1.472

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LEU  94           H        LEU  94  11.859  12.040   6.060
    2    HA   LEU  94           HA       LEU  94  11.020  13.980   7.930
    3    HB2  LEU  94           HB2      LEU  94  11.634  11.034   8.213
    4    HB3  LEU  94           HB3      LEU  94  11.046  12.005   9.559
    5    HG   LEU  94           HG       LEU  94   9.567  12.031   6.927
    6   HD11  LEU  94          HD11      LEU  94   9.675   9.816   8.938
    7   HD13  LEU  94          HD12      LEU  94   9.378   9.747   7.202
    8   HD12  LEU  94          HD13      LEU  94   8.090  10.250   8.296
    9   HD23  LEU  94          HD21      LEU  94   7.640  12.410   8.523
   10   HD22  LEU  94          HD22      LEU  94   8.862  13.680   8.559
   11   HD21  LEU  94          HD23      LEU  94   8.812  12.466   9.836

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  95           H        ILE  95  14.019  12.089   7.704
    2    HA   ILE  95           HA       ILE  95  15.170  13.033  10.118
    3    HB   ILE  95           HB       ILE  95  16.428  11.973   7.575
    4   HG12  ILE  95          HG12      ILE  95  16.142  10.776  10.345
    5   HG13  ILE  95          HG13      ILE  95  14.981  10.499   9.048
    6   HG21  ILE  95          HG21      ILE  95  17.667  12.803  10.217
    7   HG23  ILE  95          HG22      ILE  95  18.126  13.333   8.598
    8   HG22  ILE  95          HG23      ILE  95  18.453  11.679   9.111
    9   HD13  ILE  95          HD11      ILE  95  16.480   9.237   7.791
   10   HD12  ILE  95          HD12      ILE  95  16.956   8.798   9.429
   11   HD11  ILE  95          HD13      ILE  95  17.895   9.988   8.529

  No H/Q in entry =          11
  In of MODEL   58
    1    H    GLU  96           H        GLU  96  15.315  14.260   6.780
    2    HA   GLU  96           HA       GLU  96  17.133  16.363   7.255
    3    HB2  GLU  96           HB2      GLU  96  16.482  15.686   4.997
    4    HB3  GLU  96           HB3      GLU  96  14.831  16.223   5.292
    5    HG2  GLU  96           HG2      GLU  96  15.371  18.358   4.746
    6    HG3  GLU  96           HG3      GLU  96  16.667  18.378   5.930

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LEU  97           H        LEU  97  13.624  16.132   7.679
    2    HA   LEU  97           HA       LEU  97  13.171  18.861   8.313
    3    HB2  LEU  97           HB2      LEU  97  11.684  16.318   8.931
    4    HB3  LEU  97           HB3      LEU  97  11.150  17.860   9.597
    5    HG   LEU  97           HG       LEU  97  11.644  17.442   6.634
    6   HD12  LEU  97          HD11      LEU  97   9.123  17.281   6.512
    7   HD11  LEU  97          HD12      LEU  97   9.115  17.086   8.262
    8   HD13  LEU  97          HD13      LEU  97   9.914  15.886   7.245
    9   HD23  LEU  97          HD21      LEU  97   9.881  19.384   6.658
   10   HD22  LEU  97          HD22      LEU  97  11.556  19.766   7.053
   11   HD21  LEU  97          HD23      LEU  97  10.368  19.584   8.341

  No H/Q in entry =          11
  In of MODEL   58
    1    H    HIS  98           H        HIS  98  14.025  16.051  10.317
    2    HA   HIS  98           HA       HIS  98  13.847  17.316  12.830
    3    HB2  HIS  98           HB2      HIS  98  15.627  15.079  11.837
    4    HB3  HIS  98           HB3      HIS  98  15.616  15.622  13.517
    5    HD1  HIS  98           HD1      HIS  98  13.442  13.958  10.925
    6    HD2  HIS  98           HD2      HIS  98  13.316  14.886  14.987
    7    HE1  HIS  98           HE1      HIS  98  11.431  12.739  11.877
    8    HE2  HIS  98           HE2      HIS  98  11.335  13.296  14.346

  No H/Q in entry =           8
  In of MODEL   58
    1    H    GLU  99           H        GLU  99  16.406  17.228  10.400
    2    HA   GLU  99           HA       GLU  99  18.371  18.588  11.929
    3    HB2  GLU  99           HB2      GLU  99  18.871  17.302   9.864
    4    HB3  GLU  99           HB3      GLU  99  18.047  18.544   8.918
    5    HG2  GLU  99           HG2      GLU  99  19.632  20.237   9.708
    6    HG3  GLU  99           HG3      GLU  99  20.424  19.047  10.735

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LYS 100           H        LYS 100  15.837  19.713   9.705
    2    HA   LYS 100           HA       LYS 100  16.599  22.461   9.844
    3    HB2  LYS 100           HB2      LYS 100  13.984  21.137   9.088
    4    HB3  LYS 100           HB3      LYS 100  14.262  22.879   8.993
    5    HG2  LYS 100           HG2      LYS 100  16.242  22.451   7.531
    6    HG3  LYS 100           HG3      LYS 100  15.851  20.729   7.552
    7    HD2  LYS 100           HD2      LYS 100  13.651  21.209   6.547
    8    HD3  LYS 100           HD3      LYS 100  14.026  22.932   6.533
    9    HE2  LYS 100           HE2      LYS 100  15.993  22.473   5.078
   10    HE3  LYS 100           HE3      LYS 100  15.549  20.762   5.048
   11    HZ1  LYS 100           HZ1      LYS 100  13.699  22.930   4.205
   12    HZ3  LYS 100           HZ2      LYS 100  13.536  21.258   3.946
   13    HZ2  LYS 100           HZ3      LYS 100  14.737  22.133   3.125

  No H/Q in entry =          13
  In of MODEL   58
    1    H    LEU 101           H        LEU 101  14.524  20.393  11.810
    2    HA   LEU 101           HA       LEU 101  13.330  22.451  13.382
    3    HB2  LEU 101           HB2      LEU 101  13.808  19.508  13.773
    4    HB3  LEU 101           HB3      LEU 101  13.257  20.485  15.131
    5    HG   LEU 101           HG       LEU 101  11.843  20.549  12.459
    6   HD12  LEU 101          HD11      LEU 101  10.201  18.968  13.729
    7   HD11  LEU 101          HD12      LEU 101  11.599  18.575  14.727
    8   HD13  LEU 101          HD13      LEU 101  11.639  18.264  12.991
    9   HD21  LEU 101          HD21      LEU 101  11.172  21.341  15.309
   10   HD23  LEU 101          HD22      LEU 101   9.915  21.097  14.097
   11   HD22  LEU 101          HD23      LEU 101  11.135  22.346  13.858

  No H/Q in entry =          11
  In of MODEL   58
    1    H    LYS 102           H        LYS 102  16.485  21.881  12.952
    2    HA   LYS 102           HA       LYS 102  18.319  22.776  14.025
    3    HB2  LYS 102           HB2      LYS 102  16.485  24.272  15.152
    4    HB3  LYS 102           HB3      LYS 102  16.703  23.215  16.532
    5    HG2  LYS 102           HG2      LYS 102  18.573  25.246  15.361
    6    HG3  LYS 102           HG3      LYS 102  18.192  24.931  17.040
    7    HD2  LYS 102           HD2      LYS 102  19.885  23.035  15.361
    8    HD3  LYS 102           HD3      LYS 102  20.557  24.368  16.292
    9    HE2  LYS 102           HE2      LYS 102  20.188  21.817  17.266
   10    HE3  LYS 102           HE3      LYS 102  20.387  23.264  18.254
   11    HZ2  LYS 102           HZ1      LYS 102  18.433  21.957  18.872
   12    HZ1  LYS 102           HZ2      LYS 102  17.789  22.176  17.322
   13    HZ3  LYS 102           HZ3      LYS 102  18.002  23.511  18.345

  No H/Q in entry =          13
  In of MODEL   58
    1    H    ALA 103           H        ALA 103  16.263  21.152  16.448
    2    HA   ALA 103           HA       ALA 103  18.002  19.966  18.108
    3    HB2  ALA 103           HB1      ALA 103  16.442  17.939  18.105
    4    HB1  ALA 103           HB2      ALA 103  15.538  18.779  16.844
    5    HB3  ALA 103           HB3      ALA 103  15.705  19.506  18.441

  No H/Q in entry =           5
  In of MODEL   58
    1    H1   ALA   1           H3       ALA   1  -1.537  -7.219 -21.481
    2    H2   ALA   1           H2       ALA   1  -2.315  -8.662 -21.026
    3    H3   ALA   1           H1       ALA   1  -0.706  -8.694 -21.578
    4    HA   ALA   1           HA       ALA   1  -1.530  -9.178 -23.575
    5    HB1  ALA   1           HB1      ALA   1  -3.660  -9.920 -23.104
    6    HB2  ALA   1           HB2      ALA   1  -4.115  -8.416 -23.905
    7    HB3  ALA   1           HB3      ALA   1  -4.056  -8.492 -22.146

  No H/Q in entry =           7
  In of MODEL   58
    1    H    GLU   2           H        GLU   2  -2.371  -8.002 -25.568
    2    HA   GLU   2           HA       GLU   2  -0.994  -5.974 -26.448
    3    HB2  GLU   2           HB2      GLU   2  -3.999  -6.076 -26.771
    4    HB3  GLU   2           HB3      GLU   2  -2.887  -5.203 -27.820
    5    HG2  GLU   2           HG2      GLU   2  -2.360  -7.089 -28.970
    6    HG3  GLU   2           HG3      GLU   2  -2.054  -7.988 -27.490

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLU   3           H        GLU   3  -4.170  -4.751 -25.556
    2    HA   GLU   3           HA       GLU   3  -3.154  -2.182 -24.932
    3    HB2  GLU   3           HB2      GLU   3  -5.828  -3.527 -24.602
    4    HB3  GLU   3           HB3      GLU   3  -5.549  -1.907 -23.958
    5    HG2  GLU   3           HG2      GLU   3  -5.200  -0.981 -26.086
    6    HG3  GLU   3           HG3      GLU   3  -4.786  -2.533 -26.806

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LEU   4           H        LEU   4  -4.722  -4.554 -22.750
    2    HA   LEU   4           HA       LEU   4  -4.376  -3.317 -20.361
    3    HB2  LEU   4           HB2      LEU   4  -3.798  -6.253 -20.823
    4    HB3  LEU   4           HB3      LEU   4  -4.215  -5.508 -19.281
    5    HG   LEU   4           HG       LEU   4  -5.982  -5.607 -21.749
    6   HD13  LEU   4          HD11      LEU   4  -7.158  -7.336 -20.750
    7   HD12  LEU   4          HD12      LEU   4  -6.681  -6.868 -19.118
    8   HD11  LEU   4          HD13      LEU   4  -5.534  -7.700 -20.166
    9   HD23  LEU   4          HD21      LEU   4  -7.680  -4.811 -19.886
   10   HD22  LEU   4          HD22      LEU   4  -6.653  -3.630 -20.697
   11   HD21  LEU   4          HD23      LEU   4  -6.224  -4.212 -19.089

  No H/Q in entry =          11
  In of MODEL   58
    1    H    GLU   5           H        GLU   5  -1.854  -5.135 -22.083
    2    HA   GLU   5           HA       GLU   5   0.123  -4.824 -20.043
    3    HB2  GLU   5           HB2      GLU   5   0.226  -6.600 -21.775
    4    HB3  GLU   5           HB3      GLU   5   0.496  -5.363 -23.004
    5    HG2  GLU   5           HG2      GLU   5   2.561  -4.666 -21.890
    6    HG3  GLU   5           HG3      GLU   5   2.286  -5.839 -20.602

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLU   6           H        GLU   6  -0.526  -3.124 -23.093
    2    HA   GLU   6           HA       GLU   6   1.622  -1.267 -22.825
    3    HB2  GLU   6           HB2      GLU   6   0.141  -1.912 -24.909
    4    HB3  GLU   6           HB3      GLU   6  -0.882  -0.599 -24.326
    5    HG2  GLU   6           HG2      GLU   6   2.093  -0.335 -24.832
    6    HG3  GLU   6           HG3      GLU   6   0.851   0.141 -25.988

  No H/Q in entry =           6
  In of MODEL   58
    1    H    VAL   7           H        VAL   7  -1.717  -1.375 -21.786
    2    HA   VAL   7           HA       VAL   7  -1.971   1.337 -20.956
    3    HB   VAL   7           HB       VAL   7  -3.406  -1.196 -20.117
    4   HG11  VAL   7          HG11      VAL   7  -3.816   1.690 -19.310
    5   HG13  VAL   7          HG12      VAL   7  -3.702   0.269 -18.271
    6   HG12  VAL   7          HG13      VAL   7  -5.135   0.520 -19.267
    7   HG21  VAL   7          HG21      VAL   7  -3.571  -0.126 -22.508
    8   HG23  VAL   7          HG22      VAL   7  -4.532   1.113 -21.700
    9   HG22  VAL   7          HG23      VAL   7  -5.059  -0.570 -21.671

  No H/Q in entry =           9
  In of MODEL   58
    1    H    VAL   8           H        VAL   8  -0.953  -1.633 -19.304
    2    HA   VAL   8           HA       VAL   8  -0.652  -0.545 -16.711
    3    HB   VAL   8           HB       VAL   8   0.777  -2.849 -18.061
    4   HG12  VAL   8          HG11      VAL   8   1.120  -3.470 -15.540
    5   HG11  VAL   8          HG12      VAL   8   0.893  -1.743 -15.263
    6   HG13  VAL   8          HG13      VAL   8   2.212  -2.306 -16.288
    7   HG22  VAL   8          HG21      VAL   8  -0.980  -4.180 -17.366
    8   HG21  VAL   8          HG22      VAL   8  -1.869  -2.661 -17.367
    9   HG23  VAL   8          HG23      VAL   8  -1.194  -3.281 -15.865

  No H/Q in entry =           9
  In of MODEL   58
    1    H    MET   9           H        MET   9   1.606  -0.826 -19.453
    2    HA   MET   9           HA       MET   9   3.877   0.245 -18.190
    3    HB2  MET   9           HB2      MET   9   2.928   0.198 -21.046
    4    HB3  MET   9           HB3      MET   9   4.394   1.071 -20.602
    5    HG2  MET   9           HG2      MET   9   5.118  -1.103 -19.420
    6    HG3  MET   9           HG3      MET   9   3.821  -1.881 -20.329
    7    HE3  MET   9           HE1      MET   9   4.752  -1.933 -23.874
    8    HE2  MET   9           HE2      MET   9   3.743  -0.639 -23.232
    9    HE1  MET   9           HE3      MET   9   3.618  -2.263 -22.560

  No H/Q in entry =           9
  In of MODEL   58
    1    H    GLY  10           H        GLY  10   1.179   1.815 -19.875
    2    HA3  GLY  10           HA2      GLY  10   2.113   4.479 -19.635
    3    HA2  GLY  10           HA3      GLY  10   0.429   4.000 -19.841

  No H/Q in entry =           3
  In of MODEL   58
    1    H    LEU  11           H        LEU  11   0.042   2.474 -17.553
    2    HA   LEU  11           HA       LEU  11  -0.512   4.449 -15.598
    3    HB2  LEU  11           HB2      LEU  11  -0.413   1.434 -15.436
    4    HB3  LEU  11           HB3      LEU  11  -0.935   2.454 -14.096
    5    HG   LEU  11           HG       LEU  11  -2.170   2.550 -16.861
    6   HD13  LEU  11          HD11      LEU  11  -2.733   0.402 -16.103
    7   HD12  LEU  11          HD12      LEU  11  -4.094   1.381 -15.561
    8   HD11  LEU  11          HD13      LEU  11  -2.835   0.916 -14.418
    9   HD22  LEU  11          HD21      LEU  11  -2.784   4.561 -15.860
   10   HD21  LEU  11          HD22      LEU  11  -2.704   3.899 -14.227
   11   HD23  LEU  11          HD23      LEU  11  -4.074   3.517 -15.271

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  12           H        ILE  12   2.057   2.008 -15.832
    2    HA   ILE  12           HA       ILE  12   3.253   2.563 -13.328
    3    HB   ILE  12           HB       ILE  12   4.519   1.530 -15.888
    4   HG12  ILE  12          HG12      ILE  12   2.522   0.277 -14.744
    5   HG13  ILE  12          HG13      ILE  12   3.936  -0.644 -15.215
    6   HG23  ILE  12          HG21      ILE  12   6.260   2.295 -14.385
    7   HG22  ILE  12          HG22      ILE  12   6.213   0.535 -14.305
    8   HG21  ILE  12          HG23      ILE  12   5.494   1.496 -13.014
    9   HD13  ILE  12          HD11      ILE  12   4.748  -0.608 -12.926
   10   HD12  ILE  12          HD12      ILE  12   3.083  -1.186 -12.931
   11   HD11  ILE  12          HD13      ILE  12   3.438   0.457 -12.446

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  13           H        ILE  13   3.846   3.826 -16.586
    2    HA   ILE  13           HA       ILE  13   5.965   5.569 -15.863
    3    HB   ILE  13           HB       ILE  13   3.935   5.631 -18.110
    4   HG12  ILE  13          HG12      ILE  13   5.750   3.788 -17.849
    5   HG13  ILE  13          HG13      ILE  13   5.555   4.563 -19.417
    6   HG22  ILE  13          HG21      ILE  13   5.823   7.178 -19.136
    7   HG21  ILE  13          HG22      ILE  13   6.159   7.543 -17.448
    8   HG23  ILE  13          HG23      ILE  13   4.563   7.875 -18.117
    9   HD12  ILE  13          HD11      ILE  13   7.973   4.299 -18.236
   10   HD11  ILE  13          HD12      ILE  13   7.475   5.832 -17.527
   11   HD13  ILE  13          HD13      ILE  13   7.570   5.665 -19.276

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ASN  14           H        ASN  14   2.453   6.028 -16.135
    2    HA   ASN  14           HA       ASN  14   2.382   8.775 -15.504
    3    HB2  ASN  14           HB2      ASN  14   0.507   7.112 -16.333
    4    HB3  ASN  14           HB3      ASN  14   0.185   6.933 -14.613
    5   HD21  ASN  14          HD21      ASN  14  -1.844   8.066 -16.050
    6   HD22  ASN  14          HD22      ASN  14  -1.924   9.739 -15.786

  No H/Q in entry =           6
  In of MODEL   58
    1    H    SER  15           H        SER  15   2.114   5.899 -13.422
    2    HA   SER  15           HA       SER  15   1.791   7.271 -10.976
    3    HB2  SER  15           HB2      SER  15   2.365   5.193  -9.922
    4    HB3  SER  15           HB3      SER  15   1.534   4.764 -11.413
    5    HG   SER  15           HG       SER  15   3.287   3.821 -12.041

  No H/Q in entry =           5
  In of MODEL   58
    1    H    GLY  16           H        GLY  16   4.680   6.201 -12.730
    2    HA3  GLY  16           HA2      GLY  16   6.594   6.981 -10.799
    3    HA2  GLY  16           HA3      GLY  16   6.902   6.778 -12.522

  No H/Q in entry =           3
  In of MODEL   58
    1    H    GLN  17           H        GLN  17   5.193   8.716 -13.590
    2    HA   GLN  17           HA       GLN  17   6.744  11.075 -13.285
    3    HB2  GLN  17           HB2      GLN  17   5.425  10.571 -15.327
    4    HB3  GLN  17           HB3      GLN  17   3.938  10.790 -14.404
    5    HG2  GLN  17           HG2      GLN  17   4.607  13.120 -13.895
    6    HG3  GLN  17           HG3      GLN  17   6.064  12.900 -14.865
    7   HE21  GLN  17          HE21      GLN  17   5.636  14.205 -16.688
    8   HE22  GLN  17          HE22      GLN  17   4.260  14.035 -17.668

  No H/Q in entry =           8
  In of MODEL   58
    1    H    ALA  18           H        ALA  18   3.654  10.026 -11.938
    2    HA   ALA  18           HA       ALA  18   2.900  12.409 -10.677
    3    HB1  ALA  18           HB1      ALA  18   1.799   9.939 -10.896
    4    HB2  ALA  18           HB2      ALA  18   1.235  11.155  -9.752
    5    HB3  ALA  18           HB3      ALA  18   2.339   9.886  -9.218

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ARG  19           H        ARG  19   4.804   9.670  -9.391
    2    HA   ARG  19           HA       ARG  19   5.320  10.839  -6.870
    3    HB2  ARG  19           HB2      ARG  19   5.763   8.440  -7.392
    4    HB3  ARG  19           HB3      ARG  19   7.114   8.939  -8.413
    5    HG2  ARG  19           HG2      ARG  19   8.219   9.996  -6.491
    6    HG3  ARG  19           HG3      ARG  19   6.847   9.594  -5.460
    7    HD2  ARG  19           HD2      ARG  19   8.628   7.980  -5.097
    8    HD3  ARG  19           HD3      ARG  19   7.263   7.181  -5.883
    9    HE   ARG  19           HE       ARG  19   8.961   8.015  -7.930
   10   HH21  ARG  19          HH11      ARG  19  10.539   6.627  -8.775
   11   HH22  ARG  19          HH12      ARG  19  11.099   5.287  -7.837
   12   HH11  ARG  19          HH21      ARG  19   9.053   5.991  -5.147
   13   HH12  ARG  19          HH22      ARG  19  10.255   4.927  -5.781

  No H/Q in entry =          13
  In of MODEL   58
    1    H    SER  20           H        SER  20   7.141  10.884  -9.917
    2    HA   SER  20           HA       SER  20   9.367  12.328  -9.093
    3    HB2  SER  20           HB2      SER  20   9.158  11.330 -11.339
    4    HB3  SER  20           HB3      SER  20   7.936  12.528 -11.753
    5    HG   SER  20           HG       SER  20  10.633  13.025 -11.007

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LEU  21           H        LEU  21   6.255  13.557 -10.297
    2    HA   LEU  21           HA       LEU  21   6.891  16.311 -10.077
    3    HB2  LEU  21           HB2      LEU  21   4.239  14.857  -9.994
    4    HB3  LEU  21           HB3      LEU  21   4.388  16.613 -10.009
    5    HG   LEU  21           HG       LEU  21   5.598  14.812 -12.128
    6   HD13  LEU  21          HD11      LEU  21   3.178  14.572 -12.196
    7   HD12  LEU  21          HD12      LEU  21   3.687  15.592 -13.543
    8   HD11  LEU  21          HD13      LEU  21   2.968  16.321 -12.108
    9   HD23  LEU  21          HD21      LEU  21   5.375  17.124 -13.382
   10   HD22  LEU  21          HD22      LEU  21   6.731  16.887 -12.284
   11   HD21  LEU  21          HD23      LEU  21   5.328  17.804 -11.758

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ALA  22           H        ALA  22   5.405  14.007  -7.826
    2    HA   ALA  22           HA       ALA  22   4.776  15.811  -5.764
    3    HB3  ALA  22           HB1      ALA  22   4.046  13.409  -5.923
    4    HB2  ALA  22           HB2      ALA  22   4.627  13.892  -4.328
    5    HB1  ALA  22           HB3      ALA  22   5.663  12.944  -5.396

  No H/Q in entry =           5
  In of MODEL   58
    1    H    TYR  23           H        TYR  23   7.737  13.823  -6.195
    2    HA   TYR  23           HA       TYR  23   9.104  14.865  -3.942
    3    HB2  TYR  23           HB2      TYR  23   9.918  12.865  -5.097
    4    HB3  TYR  23           HB3      TYR  23  10.223  13.806  -6.557
    5    HD1  TYR  23           HD1      TYR  23  11.180  13.490  -2.961
    6    HD2  TYR  23           HD2      TYR  23  12.245  14.997  -6.841
    7    HE1  TYR  23           HE1      TYR  23  13.429  14.097  -2.109
    8    HE2  TYR  23           HE2      TYR  23  14.492  15.606  -5.988
    9    HH   TYR  23           HH       TYR  23  15.993  15.069  -4.219

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ALA  24           H        ALA  24   8.910  15.962  -7.311
    2    HA   ALA  24           HA       ALA  24  10.777  18.073  -7.067
    3    HB2  ALA  24           HB1      ALA  24  10.336  18.125  -9.277
    4    HB3  ALA  24           HB2      ALA  24   8.770  18.854  -8.921
    5    HB1  ALA  24           HB3      ALA  24   8.920  17.103  -9.047

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ALA  25           H        ALA  25   7.300  17.842  -6.450
    2    HA   ALA  25           HA       ALA  25   6.782  20.554  -5.887
    3    HB1  ALA  25           HB1      ALA  25   5.149  18.532  -6.086
    4    HB2  ALA  25           HB2      ALA  25   4.762  19.818  -4.940
    5    HB3  ALA  25           HB3      ALA  25   5.472  18.308  -4.365

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LEU  26           H        LEU  26   7.885  17.895  -3.830
    2    HA   LEU  26           HA       LEU  26   7.967  19.332  -1.396
    3    HB2  LEU  26           HB2      LEU  26   8.097  16.917  -1.385
    4    HB3  LEU  26           HB3      LEU  26   9.568  16.944  -2.354
    5    HG   LEU  26           HG       LEU  26  10.765  18.084  -0.515
    6   HD12  LEU  26          HD11      LEU  26   9.536  18.079   1.743
    7   HD11  LEU  26          HD12      LEU  26   8.051  17.917   0.807
    8   HD13  LEU  26          HD13      LEU  26   9.076  19.338   0.596
    9   HD21  LEU  26          HD21      LEU  26   9.266  15.596   0.362
   10   HD23  LEU  26          HD22      LEU  26  10.773  16.182   1.059
   11   HD22  LEU  26          HD23      LEU  26  10.737  15.619  -0.609

  No H/Q in entry =          11
  In of MODEL   58
    1    H    LYS  27           H        LYS  27  10.395  18.790  -3.917
    2    HA   LYS  27           HA       LYS  27  12.559  20.066  -2.689
    3    HB2  LYS  27           HB2      LYS  27  12.683  18.716  -4.776
    4    HB3  LYS  27           HB3      LYS  27  11.899  20.034  -5.645
    5    HG2  LYS  27           HG2      LYS  27  13.741  21.549  -5.069
    6    HG3  LYS  27           HG3      LYS  27  14.520  20.270  -4.129
    7    HD2  LYS  27           HD2      LYS  27  14.686  18.880  -6.179
    8    HD3  LYS  27           HD3      LYS  27  13.952  20.185  -7.112
    9    HE2  LYS  27           HE2      LYS  27  15.817  21.681  -6.500
   10    HE3  LYS  27           HE3      LYS  27  16.554  20.380  -5.559
   11    HZ3  LYS  27           HZ1      LYS  27  17.545  20.490  -7.745
   12    HZ2  LYS  27           HZ2      LYS  27  16.021  20.347  -8.487
   13    HZ1  LYS  27           HZ3      LYS  27  16.663  19.048  -7.599

  No H/Q in entry =          13
  In of MODEL   58
    1    H    GLN  28           H        GLN  28   9.918  21.403  -4.644
    2    HA   GLN  28           HA       GLN  28  10.836  24.069  -4.802
    3    HB2  GLN  28           HB2      GLN  28   8.019  22.957  -4.689
    4    HB3  GLN  28           HB3      GLN  28   8.409  24.635  -5.071
    5    HG2  GLN  28           HG2      GLN  28   9.440  22.230  -6.604
    6    HG3  GLN  28           HG3      GLN  28   8.091  23.244  -7.115
    7   HE21  GLN  28          HE21      GLN  28  11.257  22.792  -7.808
    8   HE22  GLN  28          HE22      GLN  28  11.713  24.381  -8.197

  No H/Q in entry =           8
  In of MODEL   58
    1    H    ALA  29           H        ALA  29   8.928  22.353  -2.364
    2    HA   ALA  29           HA       ALA  29   8.344  24.540  -0.688
    3    HB2  ALA  29           HB1      ALA  29   7.637  22.964   0.883
    4    HB1  ALA  29           HB2      ALA  29   8.877  21.798   0.422
    5    HB3  ALA  29           HB3      ALA  29   7.488  22.068  -0.628

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LYS  30           H        LYS  30  11.109  22.316  -0.749
    2    HA   LYS  30           HA       LYS  30  12.409  23.296   1.553
    3    HB2  LYS  30           HB2      LYS  30  13.528  22.021  -0.954
    4    HB3  LYS  30           HB3      LYS  30  14.504  22.399   0.468
    5    HG2  LYS  30           HG2      LYS  30  12.971  20.995   1.849
    6    HG3  LYS  30           HG3      LYS  30  12.094  20.556   0.380
    7    HD2  LYS  30           HD2      LYS  30  14.155  19.600  -0.577
    8    HD3  LYS  30           HD3      LYS  30  15.051  20.053   0.875
    9    HE2  LYS  30           HE2      LYS  30  13.567  18.601   2.231
   10    HE3  LYS  30           HE3      LYS  30  12.702  18.129   0.763
   11    HZ2  LYS  30           HZ1      LYS  30  14.517  16.580   1.529
   12    HZ1  LYS  30           HZ2      LYS  30  15.636  17.784   1.076
   13    HZ3  LYS  30           HZ3      LYS  30  14.612  17.082  -0.088

  No H/Q in entry =          13
  In of MODEL   58
    1    H    GLN  31           H        GLN  31  12.285  24.491  -1.747
    2    HA   GLN  31           HA       GLN  31  14.407  26.419  -1.328
    3    HB2  GLN  31           HB2      GLN  31  12.366  26.428  -3.554
    4    HB3  GLN  31           HB3      GLN  31  13.974  27.149  -3.555
    5    HG2  GLN  31           HG2      GLN  31  14.478  24.462  -2.973
    6    HG3  GLN  31           HG3      GLN  31  13.177  24.385  -4.153
    7   HE21  GLN  31          HE21      GLN  31  16.033  23.636  -4.553
    8   HE22  GLN  31          HE22      GLN  31  16.591  24.615  -5.821

  No H/Q in entry =           8
  In of MODEL   58
    1    H    GLY  32           H        GLY  32  11.335  26.191  -0.185
    2    HA3  GLY  32           HA2      GLY  32  10.153  27.743   1.084
    3    HA2  GLY  32           HA3      GLY  32  11.259  28.995   0.532

  No H/Q in entry =           3
  In of MODEL   58
    1    H    ASP  33           H        ASP  33   9.927  27.064  -1.958
    2    HA   ASP  33           HA       ASP  33   8.228  29.308  -2.820
    3    HB2  ASP  33           HB2      ASP  33   9.361  26.903  -4.255
    4    HB3  ASP  33           HB3      ASP  33   8.193  27.999  -4.989

  No H/Q in entry =           4
  In of MODEL   58
    1    H    PHE  34           H        PHE  34   6.546  28.809  -1.256
    2    HA   PHE  34           HA       PHE  34   5.205  26.316  -1.156
    3    HB2  PHE  34           HB2      PHE  34   4.200  29.089  -0.484
    4    HB3  PHE  34           HB3      PHE  34   3.374  27.586  -0.070
    5    HD1  PHE  34           HD1      PHE  34   5.585  30.023   1.141
    6    HD2  PHE  34           HD2      PHE  34   4.972  25.772   1.097
    7    HE1  PHE  34           HE1      PHE  34   6.977  29.799   3.179
    8    HE2  PHE  34           HE2      PHE  34   6.367  25.552   3.133
    9    HZ   PHE  34           HZ       PHE  34   7.363  27.567   4.174

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ALA  35           H        ALA  35   4.731  29.168  -3.174
    2    HA   ALA  35           HA       ALA  35   2.191  28.511  -4.200
    3    HB3  ALA  35           HB1      ALA  35   3.223  29.915  -6.240
    4    HB2  ALA  35           HB2      ALA  35   4.434  30.298  -5.016
    5    HB1  ALA  35           HB3      ALA  35   2.736  30.681  -4.728

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ALA  36           H        ALA  36   5.431  27.886  -5.550
    2    HA   ALA  36           HA       ALA  36   4.467  26.436  -7.791
    3    HB3  ALA  36           HB1      ALA  36   6.625  26.593  -8.405
    4    HB2  ALA  36           HB2      ALA  36   7.121  25.576  -7.052
    5    HB1  ALA  36           HB3      ALA  36   6.987  27.322  -6.841

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ALA  37           H        ALA  37   5.436  25.465  -4.533
    2    HA   ALA  37           HA       ALA  37   5.422  22.675  -4.956
    3    HB2  ALA  37           HB1      ALA  37   5.130  24.467  -2.582
    4    HB1  ALA  37           HB2      ALA  37   6.285  23.167  -2.870
    5    HB3  ALA  37           HB3      ALA  37   4.629  22.788  -2.400

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LYS  38           H        LYS  38   2.853  24.845  -3.795
    2    HA   LYS  38           HA       LYS  38   0.783  22.999  -3.570
    3    HB2  LYS  38           HB2      LYS  38   1.090  25.761  -3.325
    4    HB3  LYS  38           HB3      LYS  38  -0.105  25.592  -4.605
    5    HG2  LYS  38           HG2      LYS  38  -1.535  24.248  -3.160
    6    HG3  LYS  38           HG3      LYS  38  -0.291  24.211  -1.903
    7    HD2  LYS  38           HD2      LYS  38  -0.515  26.545  -1.461
    8    HD3  LYS  38           HD3      LYS  38  -1.430  26.816  -2.945
    9    HE2  LYS  38           HE2      LYS  38  -2.935  26.831  -1.007
   10    HE3  LYS  38           HE3      LYS  38  -3.286  25.447  -2.046
   11    HZ3  LYS  38           HZ1      LYS  38  -2.539  23.991  -0.509
   12    HZ2  LYS  38           HZ2      LYS  38  -2.911  25.245   0.577
   13    HZ1  LYS  38           HZ3      LYS  38  -1.312  25.019   0.054

  No H/Q in entry =          13
  In of MODEL   58
    1    H    ALA  39           H        ALA  39   1.735  24.910  -6.422
    2    HA   ALA  39           HA       ALA  39  -0.325  24.006  -8.125
    3    HB2  ALA  39           HB1      ALA  39   2.401  24.695  -9.178
    4    HB1  ALA  39           HB2      ALA  39   1.414  25.943  -8.417
    5    HB3  ALA  39           HB3      ALA  39   0.816  25.092  -9.841

  No H/Q in entry =           5
  In of MODEL   58
    1    H    MET  40           H        MET  40   2.932  22.760  -7.540
    2    HA   MET  40           HA       MET  40   2.869  20.734  -9.527
    3    HB2  MET  40           HB2      MET  40   4.474  20.990  -6.977
    4    HB3  MET  40           HB3      MET  40   4.746  19.735  -8.189
    5    HG2  MET  40           HG2      MET  40   4.757  22.690  -8.861
    6    HG3  MET  40           HG3      MET  40   6.217  21.812  -8.408
    7    HE3  MET  40           HE1      MET  40   7.128  19.605 -11.211
    8    HE2  MET  40           HE2      MET  40   6.568  19.280  -9.573
    9    HE1  MET  40           HE3      MET  40   7.642  20.644  -9.875

  No H/Q in entry =           9
  In of MODEL   58
    1    H    MET  41           H        MET  41   1.950  20.770  -6.104
    2    HA   MET  41           HA       MET  41   1.463  17.997  -5.820
    3    HB2  MET  41           HB2      MET  41   0.091  20.336  -4.475
    4    HB3  MET  41           HB3      MET  41  -0.038  18.657  -3.964
    5    HG2  MET  41           HG2      MET  41   2.668  18.924  -3.999
    6    HG3  MET  41           HG3      MET  41   2.200  20.576  -3.608
    7    HE2  MET  41           HE1      MET  41  -0.820  19.278  -1.882
    8    HE1  MET  41           HE2      MET  41  -0.028  20.803  -2.262
    9    HE3  MET  41           HE3      MET  41  -0.079  20.235  -0.593

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ASP  42           H        ASP  42  -0.619  20.686  -6.802
    2    HA   ASP  42           HA       ASP  42  -3.037  19.285  -6.938
    3    HB2  ASP  42           HB2      ASP  42  -2.372  21.866  -7.200
    4    HB3  ASP  42           HB3      ASP  42  -2.515  21.465  -8.907

  No H/Q in entry =           4
  In of MODEL   58
    1    H    GLN  43           H        GLN  43  -0.604  19.911  -9.439
    2    HA   GLN  43           HA       GLN  43  -1.967  18.564 -11.526
    3    HB2  GLN  43           HB2      GLN  43   0.982  19.129 -11.143
    4    HB3  GLN  43           HB3      GLN  43   0.280  18.474 -12.625
    5    HG2  GLN  43           HG2      GLN  43  -1.265  20.476 -12.672
    6    HG3  GLN  43           HG3      GLN  43  -0.324  21.151 -11.345
    7   HE21  GLN  43          HE21      GLN  43  -0.187  22.769 -13.435
    8   HE22  GLN  43          HE22      GLN  43   1.232  22.569 -14.340

  No H/Q in entry =           8
  In of MODEL   58
    1    H    SER  44           H        SER  44   0.400  17.468  -9.131
    2    HA   SER  44           HA       SER  44   0.779  14.865 -10.150
    3    HB2  SER  44           HB2      SER  44   1.648  16.324  -7.916
    4    HB3  SER  44           HB3      SER  44   0.808  14.928  -7.243
    5    HG   SER  44           HG       SER  44   2.929  14.342  -7.666

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ARG  45           H        ARG  45  -1.565  16.150  -7.817
    2    HA   ARG  45           HA       ARG  45  -2.912  13.767  -7.178
    3    HB2  ARG  45           HB2      ARG  45  -3.148  15.935  -5.991
    4    HB3  ARG  45           HB3      ARG  45  -4.014  16.584  -7.380
    5    HG2  ARG  45           HG2      ARG  45  -5.751  14.829  -7.095
    6    HG3  ARG  45           HG3      ARG  45  -4.898  14.235  -5.670
    7    HD2  ARG  45           HD2      ARG  45  -5.143  16.500  -4.619
    8    HD3  ARG  45           HD3      ARG  45  -6.138  17.000  -6.003
    9    HE   ARG  45           HE       ARG  45  -7.208  14.608  -4.959
   10   HH21  ARG  45          HH11      ARG  45  -9.046  14.655  -3.690
   11   HH22  ARG  45          HH12      ARG  45  -9.467  16.090  -2.825
   12   HH11  ARG  45          HH21      ARG  45  -6.719  17.866  -3.942
   13   HH12  ARG  45          HH22      ARG  45  -8.144  17.908  -2.966

  No H/Q in entry =          13
  In of MODEL   58
    1    H    MET  46           H        MET  46  -3.534  16.156  -9.734
    2    HA   MET  46           HA       MET  46  -5.852  14.941 -10.796
    3    HB2  MET  46           HB2      MET  46  -3.781  16.800 -11.973
    4    HB3  MET  46           HB3      MET  46  -5.153  16.219 -12.921
    5    HG2  MET  46           HG2      MET  46  -6.716  17.139 -11.291
    6    HG3  MET  46           HG3      MET  46  -5.389  17.634 -10.248
    7    HE1  MET  46           HE1      MET  46  -7.244  17.889 -13.441
    8    HE3  MET  46           HE2      MET  46  -5.727  17.993 -14.326
    9    HE2  MET  46           HE3      MET  46  -6.776  19.405 -14.221

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ALA  47           H        ALA  47  -2.415  14.519 -11.549
    2    HA   ALA  47           HA       ALA  47  -2.728  12.781 -13.756
    3    HB3  ALA  47           HB1      ALA  47  -0.566  13.709 -13.404
    4    HB2  ALA  47           HB2      ALA  47  -0.396  11.984 -13.066
    5    HB1  ALA  47           HB3      ALA  47  -0.510  13.137 -11.736

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LEU  48           H        LEU  48  -2.451  12.158 -10.280
    2    HA   LEU  48           HA       LEU  48  -2.496   9.317 -10.432
    3    HB2  LEU  48           HB2      LEU  48  -3.295  11.226  -8.224
    4    HB3  LEU  48           HB3      LEU  48  -3.171   9.478  -8.019
    5    HG   LEU  48           HG       LEU  48  -0.901  11.215  -9.018
    6   HD13  LEU  48          HD11      LEU  48  -1.200  11.985  -6.829
    7   HD12  LEU  48          HD12      LEU  48  -0.014  10.698  -6.626
    8   HD11  LEU  48          HD13      LEU  48  -1.708  10.407  -6.230
    9   HD22  LEU  48          HD21      LEU  48  -0.364   9.037  -9.653
   10   HD21  LEU  48          HD22      LEU  48  -1.222   8.309  -8.296
   11   HD23  LEU  48          HD23      LEU  48   0.337   9.091  -8.036

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ASN  49           H        ASN  49  -5.003  11.766 -10.039
    2    HA   ASN  49           HA       ASN  49  -7.159  10.065  -9.498
    3    HB2  ASN  49           HB2      ASN  49  -7.293  12.469  -9.166
    4    HB3  ASN  49           HB3      ASN  49  -7.072  12.758 -10.887
    5   HD21  ASN  49          HD21      ASN  49  -9.316  11.155  -8.595
    6   HD22  ASN  49          HD22      ASN  49 -10.701  11.412  -9.538

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLU  50           H        GLU  50  -5.898  11.277 -12.587
    2    HA   GLU  50           HA       GLU  50  -7.828   9.983 -14.232
    3    HB2  GLU  50           HB2      GLU  50  -6.393  11.826 -15.049
    4    HB3  GLU  50           HB3      GLU  50  -4.981  10.779 -14.906
    5    HG2  GLU  50           HG2      GLU  50  -5.925   9.222 -16.540
    6    HG3  GLU  50           HG3      GLU  50  -7.403  10.175 -16.632

  No H/Q in entry =           6
  In of MODEL   58
    1    H    ALA  51           H        ALA  51  -4.642   9.050 -13.020
    2    HA   ALA  51           HA       ALA  51  -4.458   6.596 -14.432
    3    HB2  ALA  51           HB1      ALA  51  -2.474   6.345 -13.329
    4    HB1  ALA  51           HB2      ALA  51  -3.171   6.759 -11.763
    5    HB3  ALA  51           HB3      ALA  51  -2.736   8.035 -12.900

  No H/Q in entry =           5
  In of MODEL   58
    1    H    HIS  52           H        HIS  52  -5.649   7.415 -11.186
    2    HA   HIS  52           HA       HIS  52  -6.290   4.795 -10.350
    3    HB2  HIS  52           HB2      HIS  52  -6.188   6.738  -8.828
    4    HB3  HIS  52           HB3      HIS  52  -7.629   7.403  -9.596
    5    HD1  HIS  52           HD1      HIS  52  -9.844   5.869  -9.414
    6    HD2  HIS  52           HD2      HIS  52  -6.720   4.856  -6.848
    7    HE1  HIS  52           HE1      HIS  52 -10.843   4.383  -7.621
    8    HE2  HIS  52           HE2      HIS  52  -8.949   3.756  -6.048

  No H/Q in entry =           8
  In of MODEL   58
    1    H    LEU  53           H        LEU  53  -8.150   7.217 -12.146
    2    HA   LEU  53           HA       LEU  53 -10.633   5.883 -12.159
    3    HB2  LEU  53           HB2      LEU  53  -9.380   7.881 -14.030
    4    HB3  LEU  53           HB3      LEU  53 -10.967   7.187 -14.354
    5    HG   LEU  53           HG       LEU  53 -10.281   8.520 -11.715
    6   HD12  LEU  53          HD11      LEU  53 -11.708   9.754 -14.088
    7   HD11  LEU  53          HD12      LEU  53 -10.031  10.090 -13.659
    8   HD13  LEU  53          HD13      LEU  53 -11.331  10.539 -12.559
    9   HD21  LEU  53          HD21      LEU  53 -12.823   7.594 -13.064
   10   HD23  LEU  53          HD22      LEU  53 -12.864   8.866 -11.849
   11   HD22  LEU  53          HD23      LEU  53 -12.286   7.267 -11.422

  No H/Q in entry =          11
  In of MODEL   58
    1    H    VAL  54           H        VAL  54  -7.876   5.727 -14.391
    2    HA   VAL  54           HA       VAL  54  -9.066   3.931 -16.232
    3    HB   VAL  54           HB       VAL  54  -6.168   4.488 -15.547
    4   HG12  VAL  54          HG11      VAL  54  -5.900   3.402 -17.933
    5   HG11  VAL  54          HG12      VAL  54  -7.415   2.596 -17.530
    6   HG13  VAL  54          HG13      VAL  54  -5.997   2.368 -16.508
    7   HG22  VAL  54          HG21      VAL  54  -6.969   6.416 -16.597
    8   HG21  VAL  54          HG22      VAL  54  -8.146   5.530 -17.565
    9   HG23  VAL  54          HG23      VAL  54  -6.438   5.478 -17.993

  No H/Q in entry =           9
  In of MODEL   58
    1    H    GLN  55           H        GLN  55  -7.063   3.426 -13.328
    2    HA   GLN  55           HA       GLN  55  -6.925   0.610 -13.578
    3    HB2  GLN  55           HB2      GLN  55  -5.387   1.535 -12.059
    4    HB3  GLN  55           HB3      GLN  55  -6.621   2.483 -11.233
    5    HG2  GLN  55           HG2      GLN  55  -7.282   0.718  -9.912
    6    HG3  GLN  55           HG3      GLN  55  -7.036  -0.468 -11.187
    7   HE21  GLN  55          HE21      GLN  55  -5.389  -1.889 -10.687
    8   HE22  GLN  55          HE22      GLN  55  -4.012  -1.513  -9.774

  No H/Q in entry =           8
  In of MODEL   58
    1    H    THR  56           H        THR  56  -9.295   2.738 -11.972
    2    HA   THR  56           HA       THR  56 -10.849   0.831 -10.680
    3    HB   THR  56           HB       THR  56 -11.973   3.203 -12.194
    4    HG1  THR  56           HG1      THR  56 -10.379   3.005  -9.931
    5   HG21  THR  56          HG21      THR  56 -13.410   1.354 -11.001
    6   HG23  THR  56          HG22      THR  56 -13.803   3.057 -10.759
    7   HG22  THR  56          HG23      THR  56 -12.895   2.178  -9.529

  No H/Q in entry =           7
  In of MODEL   58
    1    H    LYS  57           H        LYS  57 -11.064   1.903 -14.069
    2    HA   LYS  57           HA       LYS  57 -13.191   0.178 -14.822
    3    HB2  LYS  57           HB2      LYS  57 -12.379   2.128 -16.156
    4    HB3  LYS  57           HB3      LYS  57 -10.888   1.256 -16.486
    5    HG2  LYS  57           HG2      LYS  57 -12.323   0.992 -18.399
    6    HG3  LYS  57           HG3      LYS  57 -12.268  -0.555 -17.561
    7    HD2  LYS  57           HD2      LYS  57 -14.440  -0.243 -16.624
    8    HD3  LYS  57           HD3      LYS  57 -14.462   1.468 -17.049
    9    HE2  LYS  57           HE2      LYS  57 -14.515   0.892 -19.446
   10    HE3  LYS  57           HE3      LYS  57 -14.447  -0.826 -19.056
   11    HZ3  LYS  57           HZ1      LYS  57 -16.661  -0.654 -19.142
   12    HZ2  LYS  57           HZ2      LYS  57 -16.663   1.026 -18.889
   13    HZ1  LYS  57           HZ3      LYS  57 -16.516  -0.036 -17.570

  No H/Q in entry =          13
  In of MODEL   58
    1    H    LEU  58           H        LEU  58  -9.680  -0.195 -14.758
    2    HA   LEU  58           HA       LEU  58  -9.644  -2.715 -16.041
    3    HB2  LEU  58           HB2      LEU  58  -7.635  -1.385 -14.232
    4    HB3  LEU  58           HB3      LEU  58  -7.348  -2.904 -15.082
    5    HG   LEU  58           HG       LEU  58  -8.142  -0.316 -16.454
    6   HD11  LEU  58          HD11      LEU  58  -5.477  -1.508 -15.755
    7   HD13  LEU  58          HD12      LEU  58  -5.999   0.175 -15.711
    8   HD12  LEU  58          HD13      LEU  58  -5.645  -0.594 -17.255
    9   HD22  LEU  58          HD21      LEU  58  -8.689  -1.892 -18.041
   10   HD21  LEU  58          HD22      LEU  58  -7.629  -3.120 -17.355
   11   HD23  LEU  58          HD23      LEU  58  -6.957  -1.838 -18.362

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  59           H        ILE  59 -10.486  -1.817 -12.793
    2    HA   ILE  59           HA       ILE  59 -10.091  -4.576 -11.838
    3    HB   ILE  59           HB       ILE  59  -9.689  -2.297 -10.445
    4   HG12  ILE  59          HG12      ILE  59 -11.018  -4.660  -9.105
    5   HG13  ILE  59          HG13      ILE  59  -9.380  -4.729  -9.706
    6   HG23  ILE  59          HG21      ILE  59 -11.533  -1.625  -9.146
    7   HG22  ILE  59          HG22      ILE  59 -12.437  -3.082  -9.488
    8   HG21  ILE  59          HG23      ILE  59 -12.248  -1.843 -10.726
    9   HD12  ILE  59          HD11      ILE  59  -9.623  -4.090  -7.263
   10   HD11  ILE  59          HD12      ILE  59 -10.307  -2.570  -7.824
   11   HD13  ILE  59          HD13      ILE  59  -8.645  -2.995  -8.238

  No H/Q in entry =          11
  In of MODEL   58
    1    H    GLU  60           H        GLU  60 -12.686  -2.305 -12.657
    2    HA   GLU  60           HA       GLU  60 -14.847  -3.855 -11.643
    3    HB2  GLU  60           HB2      GLU  60 -15.088  -1.485 -12.252
    4    HB3  GLU  60           HB3      GLU  60 -14.776  -1.876 -13.940
    5    HG2  GLU  60           HG2      GLU  60 -16.791  -3.350 -13.935
    6    HG3  GLU  60           HG3      GLU  60 -17.127  -2.837 -12.294

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLY  61           H        GLY  61 -13.168  -3.821 -14.755
    2    HA3  GLY  61           HA2      GLY  61 -14.842  -6.096 -15.642
    3    HA2  GLY  61           HA3      GLY  61 -14.013  -4.981 -16.722

  No H/Q in entry =           3
  In of MODEL   58
    1    H    ASP  62           H        ASP  62 -12.623  -6.401 -13.831
    2    HA   ASP  62           HA       ASP  62 -10.248  -7.183 -15.101
    3    HB2  ASP  62           HB2      ASP  62  -9.855  -8.452 -12.980
    4    HB3  ASP  62           HB3      ASP  62 -10.333  -6.778 -12.721

  No H/Q in entry =           4
  In of MODEL   58
    1    H    ALA  63           H        ALA  63 -13.279  -8.636 -15.437
    2    HA   ALA  63           HA       ALA  63 -12.339 -11.400 -15.669
    3    HB2  ALA  63           HB1      ALA  63 -14.597 -11.085 -14.871
    4    HB1  ALA  63           HB2      ALA  63 -14.722 -11.741 -16.503
    5    HB3  ALA  63           HB3      ALA  63 -14.984 -10.018 -16.220

  No H/Q in entry =           5
  In of MODEL   58
    1    H    GLY  64           H        GLY  64 -12.839 -12.589 -17.696
    2    HA3  GLY  64           HA2      GLY  64 -13.276 -12.185 -20.170
    3    HA2  GLY  64           HA3      GLY  64 -11.981 -11.004 -20.033

  No H/Q in entry =           3
  In of MODEL   58
    1    H    GLU  65           H        GLU  65 -10.034 -12.172 -18.643
    2    HA   GLU  65           HA       GLU  65  -8.910 -13.974 -20.500
    3    HB2  GLU  65           HB2      GLU  65  -8.070 -13.222 -17.703
    4    HB3  GLU  65           HB3      GLU  65  -7.111 -14.253 -18.766
    5    HG2  GLU  65           HG2      GLU  65  -7.008 -12.478 -20.447
    6    HG3  GLU  65           HG3      GLU  65  -8.034 -11.448 -19.450

  No H/Q in entry =           6
  In of MODEL   58
    1    H    GLY  66           H        GLY  66 -10.522 -14.455 -17.469
    2    HA3  GLY  66           HA2      GLY  66 -11.162 -17.176 -18.018
    3    HA2  GLY  66           HA3      GLY  66  -9.938 -17.046 -16.772

  No H/Q in entry =           3
  In of MODEL   58
    1    H    LYS  67           H        LYS  67 -12.273 -18.269 -16.216
    2    HA   LYS  67           HA       LYS  67 -14.510 -17.087 -15.395
    3    HB2  LYS  67           HB2      LYS  67 -14.442 -18.698 -13.387
    4    HB3  LYS  67           HB3      LYS  67 -14.323 -19.386 -15.012
    5    HG2  LYS  67           HG2      LYS  67 -11.859 -19.394 -14.832
    6    HG3  LYS  67           HG3      LYS  67 -11.976 -18.717 -13.209
    7    HD2  LYS  67           HD2      LYS  67 -13.180 -20.714 -12.439
    8    HD3  LYS  67           HD3      LYS  67 -13.124 -21.388 -14.070
    9    HE2  LYS  67           HE2      LYS  67 -11.314 -22.236 -12.495
   10    HE3  LYS  67           HE3      LYS  67 -10.731 -21.557 -14.014
   11    HZ2  LYS  67           HZ1      LYS  67  -9.543 -20.784 -11.974
   12    HZ1  LYS  67           HZ2      LYS  67 -10.967 -19.979 -11.518
   13    HZ3  LYS  67           HZ3      LYS  67 -10.162 -19.543 -12.949

  No H/Q in entry =          13
  In of MODEL   58
    1    H    MET  68           H        MET  68 -13.261 -17.849 -12.440
    2    HA   MET  68           HA       MET  68 -13.865 -15.391 -11.213
    3    HB2  MET  68           HB2      MET  68 -12.249 -17.736 -10.212
    4    HB3  MET  68           HB3      MET  68 -12.849 -16.417  -9.205
    5    HG2  MET  68           HG2      MET  68 -14.578 -18.260 -10.882
    6    HG3  MET  68           HG3      MET  68 -14.366 -18.372  -9.134
    7    HE1  MET  68           HE1      MET  68 -14.497 -16.559  -7.663
    8    HE3  MET  68           HE2      MET  68 -15.918 -15.522  -7.552
    9    HE2  MET  68           HE3      MET  68 -14.466 -14.930  -8.357

  No H/Q in entry =           9
  In of MODEL   58
    1    H    LYS  69           H        LYS  69 -10.712 -16.713 -12.243
    2    HA   LYS  69           HA       LYS  69  -9.037 -14.995 -10.870
    3    HB2  LYS  69           HB2      LYS  69  -8.728 -16.364 -13.534
    4    HB3  LYS  69           HB3      LYS  69  -7.417 -15.443 -12.792
    5    HG2  LYS  69           HG2      LYS  69  -7.379 -16.864 -10.868
    6    HG3  LYS  69           HG3      LYS  69  -8.907 -17.620 -11.313
    7    HD2  LYS  69           HD2      LYS  69  -6.714 -18.923 -11.800
    8    HD3  LYS  69           HD3      LYS  69  -7.929 -18.840 -13.076
    9    HE2  LYS  69           HE2      LYS  69  -6.737 -17.130 -14.239
   10    HE3  LYS  69           HE3      LYS  69  -5.681 -16.830 -12.860
   11    HZ3  LYS  69           HZ1      LYS  69  -4.617 -18.897 -13.163
   12    HZ2  LYS  69           HZ2      LYS  69  -4.700 -18.186 -14.703
   13    HZ1  LYS  69           HZ3      LYS  69  -5.778 -19.430 -14.280

  No H/Q in entry =          13
  In of MODEL   58
    1    H    VAL  70           H        VAL  70  -7.541 -13.299 -11.755
    2    HA   VAL  70           HA       VAL  70  -8.922 -11.404 -13.566
    3    HB   VAL  70           HB       VAL  70  -8.100  -9.577 -12.096
    4   HG11  VAL  70          HG11      VAL  70 -10.401 -10.550 -11.883
    5   HG13  VAL  70          HG12      VAL  70  -9.793  -9.876 -10.370
    6   HG12  VAL  70          HG13      VAL  70  -9.788 -11.621 -10.623
    7   HG23  VAL  70          HG21      VAL  70  -7.380 -11.846 -10.199
    8   HG22  VAL  70          HG22      VAL  70  -7.259 -10.124  -9.847
    9   HG21  VAL  70          HG23      VAL  70  -6.211 -10.850 -11.064

  No H/Q in entry =           9
  In of MODEL   58
    1    H    SER  71           H        SER  71  -7.390  -9.713 -14.373
    2    HA   SER  71           HA       SER  71  -5.151 -10.861 -15.663
    3    HB2  SER  71           HB2      SER  71  -6.365  -8.858 -16.504
    4    HB3  SER  71           HB3      SER  71  -5.732  -7.932 -15.146
    5    HG   SER  71           HG       SER  71  -4.302  -9.184 -17.251

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LEU  72           H        LEU  72  -3.088 -11.086 -15.049
    2    HA   LEU  72           HA       LEU  72  -2.377 -10.852 -12.337
    3    HB2  LEU  72           HB2      LEU  72  -0.714 -11.264 -14.817
    4    HB3  LEU  72           HB3      LEU  72  -0.050 -11.317 -13.187
    5    HG   LEU  72           HG       LEU  72  -2.377 -13.052 -14.075
    6   HD12  LEU  72          HD11      LEU  72   0.535 -13.858 -13.841
    7   HD11  LEU  72          HD12      LEU  72  -0.243 -13.465 -15.373
    8   HD13  LEU  72          HD13      LEU  72  -0.806 -14.844 -14.427
    9   HD23  LEU  72          HD21      LEU  72  -1.336 -14.437 -12.103
   10   HD22  LEU  72          HD22      LEU  72  -2.356 -13.063 -11.707
   11   HD21  LEU  72          HD23      LEU  72  -0.603 -12.906 -11.637

  No H/Q in entry =          11
  In of MODEL   58
    1    H    VAL  73           H        VAL  73  -1.687  -8.833 -15.123
    2    HA   VAL  73           HA       VAL  73   0.204  -7.101 -14.021
    3    HB   VAL  73           HB       VAL  73  -0.211  -5.692 -15.883
    4   HG11  VAL  73          HG11      VAL  73   0.585  -8.119 -16.267
    5   HG13  VAL  73          HG12      VAL  73  -0.002  -7.229 -17.671
    6   HG12  VAL  73          HG13      VAL  73  -1.039  -8.417 -16.883
    7   HG22  VAL  73          HG21      VAL  73  -2.490  -5.215 -15.913
    8   HG21  VAL  73          HG22      VAL  73  -2.950  -6.906 -15.732
    9   HG23  VAL  73          HG23      VAL  73  -2.362  -6.314 -17.286

  No H/Q in entry =           9
  In of MODEL   58
    1    H    LEU  74           H        LEU  74  -3.192  -7.268 -13.470
    2    HA   LEU  74           HA       LEU  74  -3.853  -4.621 -12.867
    3    HB2  LEU  74           HB2      LEU  74  -5.552  -6.321 -13.040
    4    HB3  LEU  74           HB3      LEU  74  -4.853  -7.219 -11.695
    5    HG   LEU  74           HG       LEU  74  -5.355  -5.331 -10.177
    6   HD11  LEU  74          HD11      LEU  74  -6.350  -4.118 -12.753
    7   HD13  LEU  74          HD12      LEU  74  -5.283  -3.403 -11.547
    8   HD12  LEU  74          HD13      LEU  74  -7.001  -3.604 -11.196
    9   HD23  LEU  74          HD21      LEU  74  -7.901  -5.813 -11.629
   10   HD22  LEU  74          HD22      LEU  74  -7.520  -5.956  -9.927
   11   HD21  LEU  74          HD23      LEU  74  -7.021  -7.216 -11.029

  No H/Q in entry =          11
  In of MODEL   58
    1    H    VAL  75           H        VAL  75  -2.776  -7.184 -10.695
    2    HA   VAL  75           HA       VAL  75  -2.607  -5.622  -8.356
    3    HB   VAL  75           HB       VAL  75  -1.072  -8.097  -9.136
    4   HG12  VAL  75          HG11      VAL  75  -0.600  -8.235  -6.669
    5   HG11  VAL  75          HG12      VAL  75  -1.310  -6.639  -6.478
    6   HG13  VAL  75          HG13      VAL  75   0.161  -6.834  -7.416
    7   HG22  VAL  75          HG21      VAL  75  -2.741  -9.252  -7.890
    8   HG21  VAL  75          HG22      VAL  75  -3.644  -8.094  -8.867
    9   HG23  VAL  75          HG23      VAL  75  -3.343  -7.764  -7.159

  No H/Q in entry =           9
  In of MODEL   58
    1    H    GLU  76           H        GLU  76  -0.181  -6.353 -10.885
    2    HA   GLU  76           HA       GLU  76   1.981  -4.968  -9.727
    3    HB2  GLU  76           HB2      GLU  76   2.151  -6.460 -11.730
    4    HB3  GLU  76           HB3      GLU  76   1.310  -5.245 -12.679
    5    HG2  GLU  76           HG2      GLU  76   3.134  -3.637 -12.264
    6    HG3  GLU  76           HG3      GLU  76   3.993  -4.824 -11.301

  No H/Q in entry =           6
  In of MODEL   58
    1    H    ALA  77           H        ALA  77  -0.565  -3.813 -11.925
    2    HA   ALA  77           HA       ALA  77   0.384  -1.152 -12.107
    3    HB3  ALA  77           HB1      ALA  77  -2.356  -2.376 -12.475
    4    HB1  ALA  77           HB2      ALA  77  -1.216  -1.866 -13.721
    5    HB2  ALA  77           HB3      ALA  77  -2.041  -0.659 -12.734

  No H/Q in entry =           5
  In of MODEL   58
    1    H    GLN  78           H        GLN  78  -1.865  -2.737  -9.896
    2    HA   GLN  78           HA       GLN  78  -2.711  -0.427  -8.504
    3    HB2  GLN  78           HB2      GLN  78  -3.737  -2.758  -8.436
    4    HB3  GLN  78           HB3      GLN  78  -2.433  -3.205  -7.339
    5    HG2  GLN  78           HG2      GLN  78  -3.125  -1.514  -5.747
    6    HG3  GLN  78           HG3      GLN  78  -4.344  -0.904  -6.866
    7   HE21  GLN  78          HE21      GLN  78  -3.451  -4.201  -5.657
    8   HE22  GLN  78          HE22      GLN  78  -5.047  -4.632  -5.265

  No H/Q in entry =           8
  In of MODEL   58
    1    H    LEU  79           H        LEU  79   0.002  -2.637  -8.041
    2    HA   LEU  79           HA       LEU  79   0.958  -1.717  -5.584
    3    HB2  LEU  79           HB2      LEU  79   1.863  -3.715  -6.644
    4    HB3  LEU  79           HB3      LEU  79   2.497  -2.757  -7.979
    5    HG   LEU  79           HG       LEU  79   4.030  -1.587  -6.475
    6   HD13  LEU  79          HD11      LEU  79   3.017  -1.352  -4.411
    7   HD12  LEU  79          HD12      LEU  79   4.117  -2.683  -4.061
    8   HD11  LEU  79          HD13      LEU  79   2.418  -3.011  -4.393
    9   HD23  LEU  79          HD21      LEU  79   5.274  -3.712  -5.562
   10   HD22  LEU  79          HD22      LEU  79   5.071  -3.522  -7.301
   11   HD21  LEU  79          HD23      LEU  79   4.009  -4.607  -6.408

  No H/Q in entry =          11
  In of MODEL   58
    1    H    HIS  80           H        HIS  80   1.817  -0.596  -8.859
    2    HA   HIS  80           HA       HIS  80   3.589   1.424  -7.939
    3    HB2  HIS  80           HB2      HIS  80   2.317   0.700 -10.522
    4    HB3  HIS  80           HB3      HIS  80   2.884   2.363 -10.355
    5    HD1  HIS  80           HD1      HIS  80   5.281   2.702 -10.873
    6    HD2  HIS  80           HD2      HIS  80   4.525  -1.218  -9.671
    7    HE1  HIS  80           HE1      HIS  80   7.493   1.462 -11.030
    8    HE2  HIS  80           HE2      HIS  80   7.043  -0.930 -10.301

  No H/Q in entry =           8
  In of MODEL   58
    1    H    LEU  81           H        LEU  81   0.185   1.523  -8.927
    2    HA   LEU  81           HA       LEU  81  -0.139   4.311  -8.606
    3    HB2  LEU  81           HB2      LEU  81  -2.115   2.031  -8.524
    4    HB3  LEU  81           HB3      LEU  81  -2.597   3.727  -8.438
    5    HG   LEU  81           HG       LEU  81  -0.879   2.600 -10.667
    6   HD12  LEU  81          HD11      LEU  81  -3.113   2.876 -11.972
    7   HD11  LEU  81          HD12      LEU  81  -3.871   2.799 -10.382
    8   HD13  LEU  81          HD13      LEU  81  -2.903   1.447 -10.963
    9   HD23  LEU  81          HD21      LEU  81  -2.010   4.721 -11.773
   10   HD22  LEU  81          HD22      LEU  81  -0.599   4.920 -10.737
   11   HD21  LEU  81          HD23      LEU  81  -2.212   5.242 -10.102

  No H/Q in entry =          11
  In of MODEL   58
    1    H    MET  82           H        MET  82  -0.756   1.620  -6.350
    2    HA   MET  82           HA       MET  82  -1.841   3.194  -4.270
    3    HB2  MET  82           HB2      MET  82  -0.420   0.532  -4.298
    4    HB3  MET  82           HB3      MET  82  -1.015   1.251  -2.804
    5    HG2  MET  82           HG2      MET  82  -2.733   0.719  -5.248
    6    HG3  MET  82           HG3      MET  82  -2.639  -0.349  -3.849
    7    HE3  MET  82           HE1      MET  82  -4.398   1.278  -1.043
    8    HE2  MET  82           HE2      MET  82  -2.672   1.586  -1.224
    9    HE1  MET  82           HE3      MET  82  -3.331   0.015  -1.675

  No H/Q in entry =           9
  In of MODEL   58
    1    H    THR  83           H        THR  83   1.480   2.166  -4.948
    2    HA   THR  83           HA       THR  83   2.672   3.299  -2.648
    3    HB   THR  83           HB       THR  83   4.771   3.276  -4.117
    4    HG1  THR  83           HG1      THR  83   4.546   2.740  -6.140
    5   HG22  THR  83          HG21      THR  83   4.376   0.610  -4.442
    6   HG21  THR  83          HG22      THR  83   3.077   0.969  -3.306
    7   HG23  THR  83          HG23      THR  83   4.749   1.344  -2.883

  No H/Q in entry =           7
  In of MODEL   58
    1    H    SER  84           H        SER  84   2.286   4.561  -5.953
    2    HA   SER  84           HA       SER  84   3.580   7.026  -5.503
    3    HB2  SER  84           HB2      SER  84   1.530   6.151  -7.524
    4    HB3  SER  84           HB3      SER  84   2.179   7.790  -7.502
    5    HG   SER  84           HG       SER  84   3.597   5.339  -7.783

  No H/Q in entry =           5
  In of MODEL   58
    1    H    MET  85           H        MET  85   0.100   6.208  -5.337
    2    HA   MET  85           HA       MET  85  -0.810   8.804  -4.746
    3    HB2  MET  85           HB2      MET  85  -2.295   6.963  -5.413
    4    HB3  MET  85           HB3      MET  85  -2.000   6.172  -3.866
    5    HG2  MET  85           HG2      MET  85  -2.944   8.097  -2.672
    6    HG3  MET  85           HG3      MET  85  -3.185   8.943  -4.200
    7    HE1  MET  85           HE1      MET  85  -3.797   6.022  -2.052
    8    HE3  MET  85           HE2      MET  85  -4.000   4.934  -3.424
    9    HE2  MET  85           HE3      MET  85  -5.398   5.384  -2.452

  No H/Q in entry =           9
  In of MODEL   58
    1    H    LEU  86           H        LEU  86   0.152   6.165  -2.592
    2    HA   LEU  86           HA       LEU  86  -0.410   7.465  -0.155
    3    HB2  LEU  86           HB2      LEU  86   0.098   5.001  -0.540
    4    HB3  LEU  86           HB3      LEU  86   1.798   5.460  -0.633
    5    HG   LEU  86           HG       LEU  86   1.447   6.622   1.631
    6   HD11  LEU  86          HD11      LEU  86  -1.232   5.808   1.156
    7   HD13  LEU  86          HD12      LEU  86  -0.582   6.571   2.606
    8   HD12  LEU  86          HD13      LEU  86  -0.643   4.813   2.491
    9   HD23  LEU  86          HD21      LEU  86   1.070   3.623   1.761
   10   HD22  LEU  86          HD22      LEU  86   2.052   4.652   2.801
   11   HD21  LEU  86          HD23      LEU  86   2.563   4.332   1.144

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ALA  87           H        ALA  87   2.580   7.216  -2.037
    2    HA   ALA  87           HA       ALA  87   4.258   8.660  -0.312
    3    HB3  ALA  87           HB1      ALA  87   4.376   7.641  -3.016
    4    HB2  ALA  87           HB2      ALA  87   5.702   7.997  -1.913
    5    HB1  ALA  87           HB3      ALA  87   5.069   9.264  -2.962

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ARG  88           H        ARG  88   2.298   9.756  -3.040
    2    HA   ARG  88           HA       ARG  88   3.028  12.458  -2.928
    3    HB2  ARG  88           HB2      ARG  88   1.797  11.280  -4.785
    4    HB3  ARG  88           HB3      ARG  88   0.336  11.402  -3.806
    5    HG2  ARG  88           HG2      ARG  88   1.313  13.999  -3.727
    6    HG3  ARG  88           HG3      ARG  88   1.749  13.487  -5.355
    7    HD2  ARG  88           HD2      ARG  88  -0.392  13.531  -6.058
    8    HD3  ARG  88           HD3      ARG  88  -0.968  12.672  -4.629
    9    HE   ARG  88           HE       ARG  88  -1.201  15.446  -5.054
   10   HH21  ARG  88          HH11      ARG  88  -1.754  16.771  -3.321
   11   HH22  ARG  88          HH12      ARG  88  -1.452  16.243  -1.702
   12   HH11  ARG  88          HH21      ARG  88  -0.155  13.206  -2.672
   13   HH12  ARG  88          HH22      ARG  88  -0.565  14.218  -1.334

  No H/Q in entry =          13
  In of MODEL   58
    1    H    GLU  89           H        GLU  89   0.348  10.745  -1.290
    2    HA   GLU  89           HA       GLU  89  -0.798  13.042  -0.093
    3    HB2  GLU  89           HB2      GLU  89  -1.881  10.785  -0.176
    4    HB3  GLU  89           HB3      GLU  89  -0.751  10.251   1.068
    5    HG2  GLU  89           HG2      GLU  89  -1.601  11.941   2.622
    6    HG3  GLU  89           HG3      GLU  89  -2.661  12.592   1.374

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LEU  90           H        LEU  90   1.686  10.791   1.092
    2    HA   LEU  90           HA       LEU  90   2.017  12.047   3.619
    3    HB2  LEU  90           HB2      LEU  90   3.821  10.296   1.950
    4    HB3  LEU  90           HB3      LEU  90   4.228  10.823   3.588
    5    HG   LEU  90           HG       LEU  90   1.616   9.436   2.925
    6   HD12  LEU  90          HD11      LEU  90   2.785   7.410   3.941
    7   HD11  LEU  90          HD12      LEU  90   4.294   8.289   3.700
    8   HD13  LEU  90          HD13      LEU  90   3.291   7.862   2.312
    9   HD22  LEU  90          HD21      LEU  90   1.333  10.361   5.044
   10   HD21  LEU  90          HD22      LEU  90   3.051  10.280   5.430
   11   HD23  LEU  90          HD23      LEU  90   2.067   8.818   5.480

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  91           H        ILE  91   3.621  12.446   0.495
    2    HA   ILE  91           HA       ILE  91   5.569  14.309   1.333
    3    HB   ILE  91           HB       ILE  91   4.270  13.792  -1.348
    4   HG12  ILE  91          HG12      ILE  91   7.107  13.349  -0.367
    5   HG13  ILE  91          HG13      ILE  91   5.843  12.133  -0.204
    6   HG22  ILE  91          HG21      ILE  91   6.474  15.170  -2.035
    7   HG21  ILE  91          HG22      ILE  91   6.149  15.970  -0.497
    8   HG23  ILE  91          HG23      ILE  91   4.929  15.977  -1.768
    9   HD13  ILE  91          HD11      ILE  91   5.679  11.802  -2.511
   10   HD12  ILE  91          HD12      ILE  91   7.409  12.071  -2.294
   11   HD11  ILE  91          HD13      ILE  91   6.381  13.377  -2.886

  No H/Q in entry =          11
  In of MODEL   58
    1    H    THR  92           H        THR  92   2.203  14.690   0.318
    2    HA   THR  92           HA       THR  92   2.136  17.512   0.250
    3    HB   THR  92           HB       THR  92  -0.004  15.488   0.950
    4    HG1  THR  92           HG1      THR  92   0.307  15.309  -1.134
    5   HG22  THR  92          HG21      THR  92  -1.434  17.628   0.220
    6   HG21  THR  92          HG22      THR  92  -0.056  18.475   0.918
    7   HG23  THR  92          HG23      THR  92  -0.983  17.342   1.900

  No H/Q in entry =           7
  In of MODEL   58
    1    H    GLU  93           H        GLU  93   1.615  15.210   2.909
    2    HA   GLU  93           HA       GLU  93   1.052  17.111   4.922
    3    HB2  GLU  93           HB2      GLU  93   2.404  14.406   5.167
    4    HB3  GLU  93           HB3      GLU  93   1.697  15.327   6.496
    5    HG2  GLU  93           HG2      GLU  93   0.101  14.520   4.056
    6    HG3  GLU  93           HG3      GLU  93   0.214  13.502   5.487

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LEU  94           H        LEU  94   4.082  15.670   3.781
    2    HA   LEU  94           HA       LEU  94   5.812  16.847   5.670
    3    HB2  LEU  94           HB2      LEU  94   6.233  15.878   2.842
    4    HB3  LEU  94           HB3      LEU  94   7.551  16.557   3.793
    5    HG   LEU  94           HG       LEU  94   5.841  14.340   4.930
    6   HD11  LEU  94          HD11      LEU  94   7.944  14.138   2.803
    7   HD13  LEU  94          HD12      LEU  94   6.511  13.145   3.064
    8   HD12  LEU  94          HD13      LEU  94   7.938  12.915   4.075
    9   HD23  LEU  94          HD21      LEU  94   8.035  13.837   6.088
   10   HD22  LEU  94          HD22      LEU  94   7.345  15.407   6.499
   11   HD21  LEU  94          HD23      LEU  94   8.688  15.303   5.360

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  95           H        ILE  95   4.662  17.994   2.515
    2    HA   ILE  95           HA       ILE  95   6.201  20.374   2.453
    3    HB   ILE  95           HB       ILE  95   3.570  19.649   1.144
    4   HG12  ILE  95          HG12      ILE  95   6.355  20.024   0.012
    5   HG13  ILE  95          HG13      ILE  95   5.727  18.463   0.529
    6   HG21  ILE  95          HG21      ILE  95   5.284  22.141   0.921
    7   HG23  ILE  95          HG22      ILE  95   3.560  22.049   1.274
    8   HG22  ILE  95          HG23      ILE  95   4.152  21.653  -0.340
    9   HD13  ILE  95          HD11      ILE  95   4.172  18.360  -1.203
   10   HD12  ILE  95          HD12      ILE  95   5.511  19.196  -1.990
   11   HD11  ILE  95          HD13      ILE  95   4.124  20.112  -1.403

  No H/Q in entry =          11
  In of MODEL   58
    1    H    GLU  96           H        GLU  96   2.959  19.679   3.743
    2    HA   GLU  96           HA       GLU  96   2.300  22.319   4.487
    3    HB2  GLU  96           HB2      GLU  96   0.651  20.512   4.499
    4    HB3  GLU  96           HB3      GLU  96   1.521  19.700   5.798
    5    HG2  GLU  96           HG2      GLU  96   0.480  20.973   7.363
    6    HG3  GLU  96           HG3      GLU  96   0.996  22.452   6.563

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LEU  97           H        LEU  97   4.175  19.798   6.122
    2    HA   LEU  97           HA       LEU  97   4.508  21.157   8.590
    3    HB2  LEU  97           HB2      LEU  97   6.079  19.006   7.184
    4    HB3  LEU  97           HB3      LEU  97   6.656  19.703   8.696
    5    HG   LEU  97           HG       LEU  97   3.862  18.570   8.382
    6   HD12  LEU  97          HD11      LEU  97   4.828  16.574   9.601
    7   HD11  LEU  97          HD12      LEU  97   6.431  17.226   9.259
    8   HD13  LEU  97          HD13      LEU  97   5.370  16.750   7.932
    9   HD23  LEU  97          HD21      LEU  97   4.314  18.288  10.948
   10   HD22  LEU  97          HD22      LEU  97   3.913  19.893  10.339
   11   HD21  LEU  97          HD23      LEU  97   5.590  19.477  10.688

  No H/Q in entry =          11
  In of MODEL   58
    1    H    HIS  98           H        HIS  98   6.385  21.192   5.568
    2    HA   HIS  98           HA       HIS  98   8.515  22.803   6.468
    3    HB2  HIS  98           HB2      HIS  98   7.231  22.524   3.740
    4    HB3  HIS  98           HB3      HIS  98   8.657  23.522   4.031
    5    HD1  HIS  98           HD1      HIS  98   7.494  19.936   4.057
    6    HD2  HIS  98           HD2      HIS  98  11.046  22.081   4.484
    7    HE1  HIS  98           HE1      HIS  98   9.372  18.231   4.008
    8    HE2  HIS  98           HE2      HIS  98  11.539  19.518   4.269

  No H/Q in entry =           8
  In of MODEL   58
    1    H    GLU  99           H        GLU  99   5.285  23.591   5.284
    2    HA   GLU  99           HA       GLU  99   5.626  26.411   5.220
    3    HB2  GLU  99           HB2      GLU  99   3.766  25.214   4.088
    4    HB3  GLU  99           HB3      GLU  99   3.071  24.847   5.667
    5    HG2  GLU  99           HG2      GLU  99   2.858  27.237   6.162
    6    HG3  GLU  99           HG3      GLU  99   3.632  27.644   4.633

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LYS 100           H        LYS 100   4.521  24.167   7.745
    2    HA   LYS 100           HA       LYS 100   3.903  26.217   9.633
    3    HB2  LYS 100           HB2      LYS 100   4.517  23.275   9.987
    4    HB3  LYS 100           HB3      LYS 100   4.052  24.344  11.316
    5    HG2  LYS 100           HG2      LYS 100   1.981  24.951  10.062
    6    HG3  LYS 100           HG3      LYS 100   2.426  23.785   8.813
    7    HD2  LYS 100           HD2      LYS 100   2.369  21.967  10.478
    8    HD3  LYS 100           HD3      LYS 100   1.941  23.128  11.738
    9    HE2  LYS 100           HE2      LYS 100  -0.118  23.719  10.470
   10    HE3  LYS 100           HE3      LYS 100   0.301  22.502   9.258
   11    HZ1  LYS 100           HZ1      LYS 100   0.038  21.838  12.139
   12    HZ3  LYS 100           HZ2      LYS 100   0.039  20.781  10.807
   13    HZ2  LYS 100           HZ3      LYS 100  -1.290  21.803  11.082

  No H/Q in entry =          13
  In of MODEL   58
    1    H    LEU 101           H        LEU 101   6.851  24.458   8.809
    2    HA   LEU 101           HA       LEU 101   8.434  25.324  11.014
    3    HB2  LEU 101           HB2      LEU 101   9.047  24.339   8.240
    4    HB3  LEU 101           HB3      LEU 101  10.338  25.023   9.222
    5    HG   LEU 101           HG       LEU 101   8.533  22.846  10.287
    6   HD12  LEU 101          HD11      LEU 101  10.607  21.376   9.687
    7   HD11  LEU 101          HD12      LEU 101  10.960  22.641   8.512
    8   HD13  LEU 101          HD13      LEU 101   9.443  21.748   8.417
    9   HD21  LEU 101          HD21      LEU 101  11.241  23.991  11.018
   10   HD23  LEU 101          HD22      LEU 101  10.716  22.413  11.600
   11   HD22  LEU 101          HD23      LEU 101   9.805  23.858  12.033

  No H/Q in entry =          11
  In of MODEL   58
    1    H    LYS 102           H        LYS 102   6.832  27.162   8.866
    2    HA   LYS 102           HA       LYS 102   6.880  29.455   8.569
    3    HB2  LYS 102           HB2      LYS 102   8.441  29.365  10.671
    4    HB3  LYS 102           HB3      LYS 102   9.741  29.573   9.513
    5    HG2  LYS 102           HG2      LYS 102   7.609  31.501  10.366
    6    HG3  LYS 102           HG3      LYS 102   9.318  31.782  10.118
    7    HD2  LYS 102           HD2      LYS 102   7.377  31.329   7.815
    8    HD3  LYS 102           HD3      LYS 102   7.739  32.915   8.480
    9    HE2  LYS 102           HE2      LYS 102   9.131  31.743   6.413
   10    HE3  LYS 102           HE3      LYS 102   9.729  33.060   7.422
   11    HZ2  LYS 102           HZ1      LYS 102  11.274  31.175   7.254
   12    HZ1  LYS 102           HZ2      LYS 102  10.123  30.179   7.997
   13    HZ3  LYS 102           HZ3      LYS 102  10.797  31.477   8.854

  No H/Q in entry =          13
  In of MODEL   58
    1    H    ALA 103           H        ALA 103  10.155  28.156   8.014
    2    HA   ALA 103           HA       ALA 103  11.106  29.541   5.937
    3    HB2  ALA 103           HB1      ALA 103  12.021  27.336   5.016
    4    HB1  ALA 103           HB2      ALA 103  11.133  26.553   6.322
    5    HB3  ALA 103           HB3      ALA 103  12.407  27.714   6.695

  No H/Q in entry =           5
  In of MODEL   58
    1    H1   LYS   3           H1       LYS   3 -31.027   6.571 -19.524
    2    H2   LYS   3           H3       LYS   3 -30.057   6.266 -20.882
    3    H3   LYS   3           H2       LYS   3 -31.470   5.361 -20.628
    4    HA   LYS   3           HA       LYS   3 -30.490   3.942 -19.239
    5    HB2  LYS   3           HB2      LYS   3 -28.186   5.308 -20.582
    6    HB3  LYS   3           HB3      LYS   3 -27.880   4.088 -19.347
    7    HG2  LYS   3           HG2      LYS   3 -29.348   2.541 -20.693
    8    HG3  LYS   3           HG3      LYS   3 -29.285   3.745 -21.978
    9    HD2  LYS   3           HD2      LYS   3 -26.805   3.574 -21.948
   10    HD3  LYS   3           HD3      LYS   3 -26.945   2.273 -20.766
   11    HE2  LYS   3           HE2      LYS   3 -28.484   1.140 -22.476
   12    HE3  LYS   3           HE3      LYS   3 -27.845   2.308 -23.631
   13    HZ3  LYS   3           HZ1      LYS   3 -26.078   1.040 -23.920
   14    HZ2  LYS   3           HZ2      LYS   3 -26.727  -0.118 -22.860
   15    HZ1  LYS   3           HZ3      LYS   3 -25.704   1.100 -22.265

  No H/Q in entry =          15
  In of MODEL   58
    1    H    LYS   4           H        LYS   4 -30.530   3.792 -17.178
    2    HA   LYS   4           HA       LYS   4 -29.733   6.053 -15.523
    3    HB2  LYS   4           HB2      LYS   4 -30.993   3.387 -14.826
    4    HB3  LYS   4           HB3      LYS   4 -30.731   4.714 -13.696
    5    HG2  LYS   4           HG2      LYS   4 -32.558   4.707 -16.103
    6    HG3  LYS   4           HG3      LYS   4 -33.034   4.761 -14.407
    7    HD2  LYS   4           HD2      LYS   4 -32.283   6.965 -14.136
    8    HD3  LYS   4           HD3      LYS   4 -31.257   6.888 -15.568
    9    HE2  LYS   4           HE2      LYS   4 -33.151   8.310 -16.009
   10    HE3  LYS   4           HE3      LYS   4 -33.274   6.844 -16.983
   11    HZ3  LYS   4           HZ1      LYS   4 -34.860   5.964 -15.427
   12    HZ2  LYS   4           HZ2      LYS   4 -35.383   7.475 -16.001
   13    HZ1  LYS   4           HZ3      LYS   4 -34.718   7.340 -14.444

  No H/Q in entry =          13
  In of MODEL   58
    1    H    HIS   5           H        HIS   5 -28.251   6.095 -13.942
    2    HA   HIS   5           HA       HIS   5 -26.017   4.212 -14.300
    3    HB2  HIS   5           HB2      HIS   5 -26.193   6.966 -13.079
    4    HB3  HIS   5           HB3      HIS   5 -24.736   5.975 -13.078
    5    HD1  HIS   5           HD1      HIS   5 -23.248   7.145 -14.674
    6    HD2  HIS   5           HD2      HIS   5 -27.076   6.627 -16.201
    7    HE1  HIS   5           HE1      HIS   5 -23.085   7.731 -17.123
    8    HE2  HIS   5           HE2      HIS   5 -25.418   7.403 -18.023

  No H/Q in entry =           8
  In of MODEL   58
    1    H    ILE   6           H        ILE   6 -25.818   2.628 -12.991
    2    HA   ILE   6           HA       ILE   6 -26.764   2.908 -10.219
    3    HB   ILE   6           HB       ILE   6 -26.016   0.428 -11.774
    4   HG12  ILE   6          HG12      ILE   6 -28.727   1.431 -10.897
    5   HG13  ILE   6          HG13      ILE   6 -28.093   1.583 -12.536
    6   HG23  ILE   6          HG21      ILE   6 -26.407  -0.823  -9.916
    7   HG22  ILE   6          HG22      ILE   6 -27.528   0.350  -9.223
    8   HG21  ILE   6          HG23      ILE   6 -25.790   0.640  -9.145
    9   HD13  ILE   6          HD11      ILE   6 -28.612  -0.521 -13.041
   10   HD12  ILE   6          HD12      ILE   6 -29.615  -0.484 -11.591
   11   HD11  ILE   6          HD13      ILE   6 -27.977  -1.135 -11.514

  No H/Q in entry =          11
  In of MODEL   58
    1    H    TYR   7           H        TYR   7 -24.980   3.497  -8.943
    2    HA   TYR   7           HA       TYR   7 -22.300   2.472  -9.648
    3    HB2  TYR   7           HB2      TYR   7 -23.188   4.924  -8.149
    4    HB3  TYR   7           HB3      TYR   7 -21.517   4.365  -8.203
    5    HD1  TYR   7           HD1      TYR   7 -22.605   3.465 -11.289
    6    HD2  TYR   7           HD2      TYR   7 -21.824   7.008  -9.053
    7    HE1  TYR   7           HE1      TYR   7 -22.158   4.692 -13.378
    8    HE2  TYR   7           HE2      TYR   7 -21.418   8.241 -11.134
    9    HH   TYR   7           HH       TYR   7 -21.657   8.171 -13.364

  No H/Q in entry =           9
  In of MODEL   58
    1    H    LEU   8           H        LEU   8 -21.360   1.089  -8.332
    2    HA   LEU   8           HA       LEU   8 -22.482   0.613  -5.643
    3    HB2  LEU   8           HB2      LEU   8 -20.839  -1.086  -7.497
    4    HB3  LEU   8           HB3      LEU   8 -21.021  -1.471  -5.786
    5    HG   LEU   8           HG       LEU   8 -23.508  -1.576  -6.189
    6   HD13  LEU   8          HD11      LEU   8 -23.622  -0.348  -8.293
    7   HD12  LEU   8          HD12      LEU   8 -24.198  -1.996  -8.536
    8   HD11  LEU   8          HD13      LEU   8 -22.581  -1.538  -9.071
    9   HD23  LEU   8          HD21      LEU   8 -22.301  -3.642  -7.901
   10   HD22  LEU   8          HD22      LEU   8 -23.381  -3.788  -6.516
   11   HD21  LEU   8          HD23      LEU   8 -21.664  -3.481  -6.265

  No H/Q in entry =          11
  In of MODEL   58
    1    H    PHE   9           H        PHE   9 -21.195   0.969  -3.870
    2    HA   PHE   9           HA       PHE   9 -18.388   1.827  -4.392
    3    HB2  PHE   9           HB2      PHE   9 -20.366   2.942  -2.409
    4    HB3  PHE   9           HB3      PHE   9 -18.647   3.307  -2.389
    5    HD1  PHE   9           HD1      PHE   9 -17.610   4.616  -4.169
    6    HD2  PHE   9           HD2      PHE   9 -21.826   3.813  -4.175
    7    HE1  PHE   9           HE1      PHE   9 -17.937   6.340  -5.917
    8    HE2  PHE   9           HE2      PHE   9 -22.153   5.549  -5.918
    9    HZ   PHE   9           HZ       PHE   9 -20.206   6.808  -6.795

  No H/Q in entry =           9
  In of MODEL   58
    1    H    SER  10           H        SER  10 -16.830   0.804  -3.326
    2    HA   SER  10           HA       SER  10 -17.026  -0.117  -0.637
    3    HB2  SER  10           HB2      SER  10 -18.307  -1.929  -1.754
    4    HB3  SER  10           HB3      SER  10 -16.921  -2.231  -2.790
    5    HG   SER  10           HG       SER  10 -17.132  -2.511   0.015

  No H/Q in entry =           5
  In of MODEL   58
    1    H    SER  11           H        SER  11 -15.001  -0.046   0.169
    2    HA   SER  11           HA       SER  11 -12.827   0.799  -1.373
    3    HB2  SER  11           HB2      SER  11 -11.568   0.707   0.598
    4    HB3  SER  11           HB3      SER  11 -13.223   0.966   1.157
    5    HG   SER  11           HG       SER  11 -11.554  -1.215   1.435

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ALA  12           H        ALA  12 -14.081  -1.901  -2.183
    2    HA   ALA  12           HA       ALA  12 -11.510  -3.121  -2.807
    3    HB1  ALA  12           HB1      ALA  12 -13.706  -4.705  -1.453
    4    HB3  ALA  12           HB2      ALA  12 -12.140  -4.296  -0.753
    5    HB2  ALA  12           HB3      ALA  12 -12.226  -5.381  -2.139

  No H/Q in entry =           5
  In of MODEL   58
    1    H    GLY  13           H        GLY  13 -12.180  -2.184  -4.837
    2    HA3  GLY  13           HA2      GLY  13 -14.484  -2.734  -6.279
    3    HA2  GLY  13           HA3      GLY  13 -12.915  -2.382  -7.018

  No H/Q in entry =           3
  In of MODEL   58
    1    H    MET  14           H        MET  14 -11.495  -4.712  -6.213
    2    HA   MET  14           HA       MET  14 -12.098  -6.442  -8.287
    3    HB2  MET  14           HB2      MET  14  -9.958  -6.590  -7.101
    4    HB3  MET  14           HB3      MET  14 -10.762  -7.269  -5.687
    5    HG2  MET  14           HG2      MET  14 -11.482  -9.212  -7.047
    6    HG3  MET  14           HG3      MET  14 -10.670  -8.523  -8.454
    7    HE3  MET  14           HE1      MET  14  -7.066  -8.719  -7.941
    8    HE2  MET  14           HE2      MET  14  -7.798  -7.337  -7.127
    9    HE1  MET  14           HE3      MET  14  -8.468  -7.906  -8.653

  No H/Q in entry =           9
  In of MODEL   58
    1    H    SER  15           H        SER  15 -13.159  -6.888  -4.900
    2    HA   SER  15           HA       SER  15 -14.596  -9.296  -5.553
    3    HB2  SER  15           HB2      SER  15 -14.760  -7.523  -3.107
    4    HB3  SER  15           HB3      SER  15 -15.764  -8.952  -3.334
    5    HG   SER  15           HG       SER  15 -13.121  -8.751  -2.656

  No H/Q in entry =           5
  In of MODEL   58
    1    H    THR  16           H        THR  16 -15.600  -5.899  -5.092
    2    HA   THR  16           HA       THR  16 -18.410  -6.344  -5.558
    3    HB   THR  16           HB       THR  16 -16.818  -3.807  -6.071
    4    HG1  THR  16           HG1      THR  16 -16.386  -3.955  -4.032
    5   HG22  THR  16          HG21      THR  16 -19.018  -2.794  -5.337
    6   HG21  THR  16          HG22      THR  16 -19.716  -4.420  -5.431
    7   HG23  THR  16          HG23      THR  16 -19.068  -3.638  -6.879

  No H/Q in entry =           7
  In of MODEL   58
    1    H    SER  17           H        SER  17 -15.620  -5.819  -7.451
    2    HA   SER  17           HA       SER  17 -16.744  -5.039  -9.942
    3    HB2  SER  17           HB2      SER  17 -14.146  -6.434  -9.267
    4    HB3  SER  17           HB3      SER  17 -14.588  -5.969 -10.910
    5    HG   SER  17           HG       SER  17 -14.694  -4.076  -8.842

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LEU  18           H        LEU  18 -16.247  -8.203  -8.510
    2    HA   LEU  18           HA       LEU  18 -16.887  -9.678 -10.868
    3    HB2  LEU  18           HB2      LEU  18 -15.680 -10.671  -8.968
    4    HB3  LEU  18           HB3      LEU  18 -17.105 -10.457  -7.954
    5    HG   LEU  18           HG       LEU  18 -18.365 -12.004  -9.350
    6   HD13  LEU  18          HD11      LEU  18 -17.567 -11.792 -11.526
    7   HD12  LEU  18          HD12      LEU  18 -16.851 -13.326 -11.034
    8   HD11  LEU  18          HD13      LEU  18 -15.880 -11.856 -11.020
    9   HD23  LEU  18          HD21      LEU  18 -16.924 -14.048  -8.943
   10   HD22  LEU  18          HD22      LEU  18 -17.317 -13.036  -7.552
   11   HD21  LEU  18          HD23      LEU  18 -15.723 -12.927  -8.299

  No H/Q in entry =          11
  In of MODEL   58
    1    H    LEU  19           H        LEU  19 -18.806  -8.431  -8.138
    2    HA   LEU  19           HA       LEU  19 -21.304  -9.549  -8.959
    3    HB2  LEU  19           HB2      LEU  19 -20.989  -8.727  -6.704
    4    HB3  LEU  19           HB3      LEU  19 -20.686  -7.100  -7.313
    5    HG   LEU  19           HG       LEU  19 -23.001  -6.847  -7.937
    6   HD12  LEU  19          HD11      LEU  19 -24.641  -8.632  -7.324
    7   HD11  LEU  19          HD12      LEU  19 -23.281  -9.708  -7.009
    8   HD13  LEU  19          HD13      LEU  19 -23.555  -9.087  -8.637
    9   HD22  LEU  19          HD21      LEU  19 -22.478  -6.219  -5.711
   10   HD21  LEU  19          HD22      LEU  19 -22.542  -7.892  -5.155
   11   HD23  LEU  19          HD23      LEU  19 -24.021  -7.073  -5.661

  No H/Q in entry =          11
  In of MODEL   58
    1    H    VAL  20           H        VAL  20 -19.733  -6.425  -9.652
    2    HA   VAL  20           HA       VAL  20 -21.828  -5.323 -11.202
    3    HB   VAL  20           HB       VAL  20 -18.826  -4.807 -11.360
    4   HG13  VAL  20          HG11      VAL  20 -19.575  -4.084 -13.468
    5   HG12  VAL  20          HG12      VAL  20 -19.665  -2.625 -12.483
    6   HG11  VAL  20          HG13      VAL  20 -21.128  -3.544 -12.833
    7   HG21  VAL  20          HG21      VAL  20 -21.107  -3.456  -9.964
    8   HG23  VAL  20          HG22      VAL  20 -19.592  -2.622 -10.300
    9   HG22  VAL  20          HG23      VAL  20 -19.598  -4.064  -9.284

  No H/Q in entry =           9
  In of MODEL   58
    1    H    SER  21           H        SER  21 -19.130  -7.438 -12.255
    2    HA   SER  21           HA       SER  21 -19.930  -7.296 -15.001
    3    HB2  SER  21           HB2      SER  21 -18.546  -9.297 -15.351
    4    HB3  SER  21           HB3      SER  21 -17.680  -8.076 -14.422
    5    HG   SER  21           HG       SER  21 -17.753  -9.294 -12.696

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LYS  22           H        LYS  22 -21.033  -9.464 -12.430
    2    HA   LYS  22           HA       LYS  22 -22.626 -11.037 -14.248
    3    HB2  LYS  22           HB2      LYS  22 -21.853 -11.746 -11.924
    4    HB3  LYS  22           HB3      LYS  22 -23.136 -10.709 -11.301
    5    HG2  LYS  22           HG2      LYS  22 -23.984 -12.918 -11.305
    6    HG3  LYS  22           HG3      LYS  22 -24.760 -12.073 -12.644
    7    HD2  LYS  22           HD2      LYS  22 -23.391 -13.168 -14.249
    8    HD3  LYS  22           HD3      LYS  22 -22.321 -13.803 -12.999
    9    HE2  LYS  22           HE2      LYS  22 -23.714 -15.604 -13.747
   10    HE3  LYS  22           HE3      LYS  22 -24.251 -15.148 -12.130
   11    HZ1  LYS  22           HZ1      LYS  22 -26.055 -13.888 -13.146
   12    HZ3  LYS  22           HZ2      LYS  22 -26.123 -15.535 -13.557
   13    HZ2  LYS  22           HZ3      LYS  22 -25.555 -14.402 -14.686

  No H/Q in entry =          13
  In of MODEL   58
    1    H    MET  23           H        MET  23 -23.259  -8.104 -12.363
    2    HA   MET  23           HA       MET  23 -26.072  -8.107 -12.852
    3    HB2  MET  23           HB2      MET  23 -24.160  -5.850 -12.281
    4    HB3  MET  23           HB3      MET  23 -25.902  -5.634 -12.447
    5    HG2  MET  23           HG2      MET  23 -26.314  -6.935 -10.481
    6    HG3  MET  23           HG3      MET  23 -24.615  -7.393 -10.368
    7    HE2  MET  23           HE1      MET  23 -26.807  -3.686  -9.149
    8    HE1  MET  23           HE2      MET  23 -27.097  -4.641 -10.602
    9    HE3  MET  23           HE3      MET  23 -26.024  -3.243 -10.666

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ARG  24           H        ARG  24 -23.292  -6.744 -14.648
    2    HA   ARG  24           HA       ARG  24 -24.767  -5.396 -16.632
    3    HB2  ARG  24           HB2      ARG  24 -21.982  -6.603 -16.686
    4    HB3  ARG  24           HB3      ARG  24 -22.639  -5.682 -18.015
    5    HG2  ARG  24           HG2      ARG  24 -22.783  -3.652 -16.617
    6    HG3  ARG  24           HG3      ARG  24 -22.221  -4.589 -15.207
    7    HD2  ARG  24           HD2      ARG  24 -20.282  -3.471 -16.143
    8    HD3  ARG  24           HD3      ARG  24 -20.174  -5.181 -16.543
    9    HE   ARG  24           HE       ARG  24 -20.175  -4.755 -18.709
   10   HH21  ARG  24          HH11      ARG  24 -19.295  -3.200 -20.072
   11   HH22  ARG  24          HH12      ARG  24 -19.956  -1.601 -20.088
   12   HH11  ARG  24          HH21      ARG  24 -21.930  -2.269 -17.227
   13   HH12  ARG  24          HH22      ARG  24 -21.522  -1.064 -18.407

  No H/Q in entry =          13
  In of MODEL   58
    1    H    ALA  25           H        ALA  25 -23.736  -8.765 -16.378
    2    HA   ALA  25           HA       ALA  25 -24.403  -9.565 -19.015
    3    HB1  ALA  25           HB1      ALA  25 -23.761 -11.620 -18.333
    4    HB3  ALA  25           HB2      ALA  25 -24.808 -11.576 -16.915
    5    HB2  ALA  25           HB3      ALA  25 -23.230 -10.793 -16.869

  No H/Q in entry =           5
  In of MODEL   58
    1    H    GLN  26           H        GLN  26 -26.211  -9.567 -15.980
    2    HA   GLN  26           HA       GLN  26 -28.595 -10.698 -16.987
    3    HB2  GLN  26           HB2      GLN  26 -28.018  -8.979 -14.594
    4    HB3  GLN  26           HB3      GLN  26 -29.603  -9.656 -14.938
    5    HG2  GLN  26           HG2      GLN  26 -27.056 -11.187 -14.493
    6    HG3  GLN  26           HG3      GLN  26 -28.406 -11.051 -13.374
    7   HE21  GLN  26          HE21      GLN  26 -27.258 -13.243 -14.669
    8   HE22  GLN  26          HE22      GLN  26 -28.335 -14.257 -15.464

  No H/Q in entry =           8
  In of MODEL   58
    1    H    ALA  27           H        ALA  27 -27.562  -7.331 -16.584
    2    HA   ALA  27           HA       ALA  27 -30.025  -6.164 -17.346
    3    HB1  ALA  27           HB1      ALA  27 -28.171  -4.907 -16.236
    4    HB3  ALA  27           HB2      ALA  27 -28.748  -4.117 -17.704
    5    HB2  ALA  27           HB3      ALA  27 -27.238  -5.027 -17.729

  No H/Q in entry =           5
  In of MODEL   58
    1    H    GLU  28           H        GLU  28 -27.371  -7.453 -19.240
    2    HA   GLU  28           HA       GLU  28 -28.292  -6.373 -21.747
    3    HB2  GLU  28           HB2      GLU  28 -25.930  -7.127 -21.141
    4    HB3  GLU  28           HB3      GLU  28 -26.523  -8.774 -21.349
    5    HG2  GLU  28           HG2      GLU  28 -25.367  -8.019 -23.321
    6    HG3  GLU  28           HG3      GLU  28 -27.075  -8.293 -23.660

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LYS  29           H        LYS  29 -28.536  -9.483 -20.107
    2    HA   LYS  29           HA       LYS  29 -29.894 -10.904 -22.111
    3    HB2  LYS  29           HB2      LYS  29 -28.860 -11.928 -20.119
    4    HB3  LYS  29           HB3      LYS  29 -30.104 -11.191 -19.112
    5    HG2  LYS  29           HG2      LYS  29 -31.810 -12.509 -20.177
    6    HG3  LYS  29           HG3      LYS  29 -30.637 -13.171 -21.312
    7    HD2  LYS  29           HD2      LYS  29 -29.517 -14.380 -19.593
    8    HD3  LYS  29           HD3      LYS  29 -30.392 -13.522 -18.327
    9    HE2  LYS  29           HE2      LYS  29 -31.214 -15.845 -18.698
   10    HE3  LYS  29           HE3      LYS  29 -32.458 -14.615 -18.927
   11    HZ1  LYS  29           HZ1      LYS  29 -31.912 -14.752 -21.359
   12    HZ3  LYS  29           HZ2      LYS  29 -32.668 -16.121 -20.696
   13    HZ2  LYS  29           HZ3      LYS  29 -31.000 -16.138 -21.005

  No H/Q in entry =          13
  In of MODEL   58
    1    H    TYR  30           H        TYR  30 -31.209  -8.774 -19.586
    2    HA   TYR  30           HA       TYR  30 -33.891  -9.140 -20.813
    3    HB2  TYR  30           HB2      TYR  30 -33.188  -8.021 -18.089
    4    HB3  TYR  30           HB3      TYR  30 -34.817  -8.229 -18.734
    5    HD1  TYR  30           HD1      TYR  30 -35.793 -10.493 -18.955
    6    HD2  TYR  30           HD2      TYR  30 -31.929  -9.891 -17.271
    7    HE1  TYR  30           HE1      TYR  30 -35.765 -12.827 -18.172
    8    HE2  TYR  30           HE2      TYR  30 -31.901 -12.211 -16.492
    9    HH   TYR  30           HH       TYR  30 -33.613 -14.518 -17.589

  No H/Q in entry =           9
  In of MODEL   58
    1    H    GLU  31           H        GLU  31 -31.674  -7.206 -21.616
    2    HA   GLU  31           HA       GLU  31 -31.545  -5.046 -22.426
    3    HB2  GLU  31           HB2      GLU  31 -34.462  -5.677 -22.924
    4    HB3  GLU  31           HB3      GLU  31 -33.588  -4.329 -23.650
    5    HG2  GLU  31           HG2      GLU  31 -32.164  -5.800 -24.860
    6    HG3  GLU  31           HG3      GLU  31 -32.762  -7.204 -23.977

  No H/Q in entry =           6
  In of MODEL   58
    1    H    VAL  32           H        VAL  32 -31.724  -4.957 -19.692
    2    HA   VAL  32           HA       VAL  32 -33.523  -2.796 -19.008
    3    HB   VAL  32           HB       VAL  32 -31.149  -3.866 -17.449
    4   HG12  VAL  32          HG11      VAL  32 -32.649  -3.011 -15.538
    5   HG11  VAL  32          HG12      VAL  32 -33.465  -2.077 -16.792
    6   HG13  VAL  32          HG13      VAL  32 -31.749  -1.823 -16.481
    7   HG21  VAL  32          HG21      VAL  32 -32.968  -5.532 -18.136
    8   HG23  VAL  32          HG22      VAL  32 -33.978  -4.684 -16.964
    9   HG22  VAL  32          HG23      VAL  32 -32.478  -5.452 -16.443

  No H/Q in entry =           9
  In of MODEL   58
    1    HA   PRO  33           HA       PRO  33 -30.422   0.059 -20.684
    2    HB2  PRO  33           HB2      PRO  33 -31.872   2.320 -20.536
    3    HB3  PRO  33           HB3      PRO  33 -32.383   1.039 -21.636
    4    HG2  PRO  33           HG2      PRO  33 -33.320   1.563 -18.813
    5    HG3  PRO  33           HG3      PRO  33 -34.298   1.390 -20.271
    6    HD2  PRO  33           HD2      PRO  33 -33.887  -0.705 -18.621
    7    HD3  PRO  33           HD3      PRO  33 -33.967  -0.933 -20.367

  No H/Q in entry =           7
  In of MODEL   58
    1    H    VAL  34           H        VAL  34 -29.162  -0.532 -18.746
    2    HA   VAL  34           HA       VAL  34 -28.803   1.874 -17.085
    3    HB   VAL  34           HB       VAL  34 -28.249   0.385 -15.160
    4   HG12  VAL  34          HG11      VAL  34 -30.682  -0.425 -14.843
    5   HG11  VAL  34          HG12      VAL  34 -30.988   0.353 -16.394
    6   HG13  VAL  34          HG13      VAL  34 -30.400   1.306 -15.031
    7   HG21  VAL  34          HG21      VAL  34 -28.501  -1.623 -17.180
    8   HG23  VAL  34          HG22      VAL  34 -29.558  -1.964 -15.809
    9   HG22  VAL  34          HG23      VAL  34 -27.832  -1.724 -15.552

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ILE  35           H        ILE  35 -26.810   2.251 -16.255
    2    HA   ILE  35           HA       ILE  35 -24.550   0.870 -17.541
    3    HB   ILE  35           HB       ILE  35 -24.869   3.764 -16.710
    4   HG12  ILE  35          HG12      ILE  35 -23.936   2.449 -19.269
    5   HG13  ILE  35          HG13      ILE  35 -25.548   3.110 -18.995
    6   HG21  ILE  35          HG21      ILE  35 -22.349   2.166 -17.045
    7   HG23  ILE  35          HG22      ILE  35 -22.765   3.350 -15.806
    8   HG22  ILE  35          HG23      ILE  35 -22.379   3.884 -17.442
    9   HD11  ILE  35          HD11      ILE  35 -24.087   5.263 -18.389
   10   HD13  ILE  35          HD12      ILE  35 -24.643   4.905 -20.024
   11   HD12  ILE  35          HD13      ILE  35 -22.998   4.488 -19.542

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ILE  36           H        ILE  36 -23.336  -0.196 -15.957
    2    HA   ILE  36           HA       ILE  36 -23.742   0.412 -13.080
    3    HB   ILE  36           HB       ILE  36 -22.993  -2.304 -14.210
    4   HG12  ILE  36          HG12      ILE  36 -25.773  -1.430 -13.423
    5   HG13  ILE  36          HG13      ILE  36 -25.211  -1.414 -15.095
    6   HG23  ILE  36          HG21      ILE  36 -23.352  -3.137 -12.100
    7   HG22  ILE  36          HG22      ILE  36 -24.442  -1.828 -11.646
    8   HG21  ILE  36          HG23      ILE  36 -22.704  -1.540 -11.725
    9   HD13  ILE  36          HD11      ILE  36 -25.436  -3.622 -15.314
   10   HD12  ILE  36          HD12      ILE  36 -26.489  -3.481 -13.907
   11   HD11  ILE  36          HD13      ILE  36 -24.801  -3.947 -13.702

  No H/Q in entry =          11
  In of MODEL   58
    1    H    GLU  37           H        GLU  37 -21.938   0.988 -11.983
    2    HA   GLU  37           HA       GLU  37 -19.275   0.128 -12.922
    3    HB2  GLU  37           HB2      GLU  37 -20.100   2.936 -12.203
    4    HB3  GLU  37           HB3      GLU  37 -18.424   2.402 -12.339
    5    HG2  GLU  37           HG2      GLU  37 -18.730   1.966 -14.697
    6    HG3  GLU  37           HG3      GLU  37 -20.427   2.431 -14.577

  No H/Q in entry =           6
  In of MODEL   58
    1    H    ALA  38           H        ALA  38 -17.784  -0.159 -11.250
    2    HA   ALA  38           HA       ALA  38 -18.793   0.028  -8.472
    3    HB1  ALA  38           HB1      ALA  38 -17.138  -1.945  -9.922
    4    HB3  ALA  38           HB2      ALA  38 -18.184  -2.163  -8.518
    5    HB2  ALA  38           HB3      ALA  38 -16.554  -1.523  -8.311

  No H/Q in entry =           5
  In of MODEL   58
    1    H    PHE  39           H        PHE  39 -17.513   1.196  -6.999
    2    HA   PHE  39           HA       PHE  39 -14.964   2.341  -7.904
    3    HB2  PHE  39           HB2      PHE  39 -17.328   3.884  -6.853
    4    HB3  PHE  39           HB3      PHE  39 -15.682   4.511  -6.792
    5    HD1  PHE  39           HD1      PHE  39 -14.403   4.488  -9.071
    6    HD2  PHE  39           HD2      PHE  39 -18.646   4.385  -8.656
    7    HE1  PHE  39           HE1      PHE  39 -14.637   5.372 -11.374
    8    HE2  PHE  39           HE2      PHE  39 -18.897   5.261 -10.951
    9    HZ   PHE  39           HZ       PHE  39 -16.898   5.729 -12.328

  No H/Q in entry =           9
  In of MODEL   58
    1    HA   PRO  40           HA       PRO  40 -14.016   1.537  -3.629
    2    HB2  PRO  40           HB2      PRO  40 -12.198   3.503  -3.022
    3    HB3  PRO  40           HB3      PRO  40 -11.793   2.170  -4.103
    4    HG2  PRO  40           HG2      PRO  40 -12.759   4.933  -4.822
    5    HG3  PRO  40           HG3      PRO  40 -11.354   4.065  -5.443
    6    HD2  PRO  40           HD2      PRO  40 -13.587   4.034  -6.841
    7    HD3  PRO  40           HD3      PRO  40 -12.666   2.543  -6.662

  No H/Q in entry =           7
  In of MODEL   58
    1    H    GLU  41           H        GLU  41 -14.601   2.515  -1.490
    2    HA   GLU  41           HA       GLU  41 -16.804   4.270  -1.447
    3    HB2  GLU  41           HB2      GLU  41 -16.637   4.186   0.933
    4    HB3  GLU  41           HB3      GLU  41 -16.213   2.589   0.316
    5    HG2  GLU  41           HG2      GLU  41 -13.835   3.099   0.644
    6    HG3  GLU  41           HG3      GLU  41 -14.270   4.686   1.278

  No H/Q in entry =           6
  In of MODEL   58
    1    H    THR  42           H        THR  42 -13.452   5.110  -1.515
    2    HA   THR  42           HA       THR  42 -13.737   7.670  -0.285
    3    HB   THR  42           HB       THR  42 -11.576   8.201  -1.397
    4    HG1  THR  42           HG1      THR  42 -11.865   5.600  -2.509
    5   HG21  THR  42          HG21      THR  42 -11.816   5.485  -0.085
    6   HG23  THR  42          HG22      THR  42 -11.457   7.023   0.702
    7   HG22  THR  42          HG23      THR  42 -10.277   6.294  -0.387

  No H/Q in entry =           7
  In of MODEL   58
    1    H    LEU  43           H        LEU  43 -14.687   6.617  -3.387
    2    HA   LEU  43           HA       LEU  43 -14.883   9.401  -4.337
    3    HB2  LEU  43           HB2      LEU  43 -15.304   6.767  -5.740
    4    HB3  LEU  43           HB3      LEU  43 -15.506   8.351  -6.488
    5    HG   LEU  43           HG       LEU  43 -12.893   7.233  -5.503
    6   HD12  LEU  43          HD11      LEU  43 -13.672   7.666  -8.364
    7   HD11  LEU  43          HD12      LEU  43 -14.050   6.151  -7.546
    8   HD13  LEU  43          HD13      LEU  43 -12.374   6.671  -7.704
    9   HD23  LEU  43          HD21      LEU  43 -12.103   9.160  -7.047
   10   HD22  LEU  43          HD22      LEU  43 -12.694   9.558  -5.433
   11   HD21  LEU  43          HD23      LEU  43 -13.736   9.788  -6.835

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ALA  44           H        ALA  44 -16.857   7.609  -2.483
    2    HA   ALA  44           HA       ALA  44 -19.346   7.534  -3.789
    3    HB2  ALA  44           HB1      ALA  44 -19.220   6.402  -1.700
    4    HB3  ALA  44           HB2      ALA  44 -20.294   7.771  -1.413
    5    HB1  ALA  44           HB3      ALA  44 -18.618   7.837  -0.871

  No H/Q in entry =           5
  In of MODEL   58
    1    H    GLY  45           H        GLY  45 -17.852  10.291  -2.250
    2    HA3  GLY  45           HA2      GLY  45 -20.256  11.850  -2.585
    3    HA2  GLY  45           HA3      GLY  45 -18.694  12.435  -2.014

  No H/Q in entry =           3
  In of MODEL   58
    1    H    GLU  46           H        GLU  46 -17.199  11.478  -4.320
    2    HA   GLU  46           HA       GLU  46 -17.798  13.718  -6.072
    3    HB2  GLU  46           HB2      GLU  46 -15.655  11.586  -6.138
    4    HB3  GLU  46           HB3      GLU  46 -15.758  12.933  -7.274
    5    HG2  GLU  46           HG2      GLU  46 -15.376  13.189  -4.298
    6    HG3  GLU  46           HG3      GLU  46 -14.095  13.299  -5.503

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LYS  47           H        LYS  47 -17.762  10.200  -6.529
    2    HA   LYS  47           HA       LYS  47 -18.872  10.461  -9.196
    3    HB2  LYS  47           HB2      LYS  47 -18.357   8.043  -7.456
    4    HB3  LYS  47           HB3      LYS  47 -18.926   7.981  -9.125
    5    HG2  LYS  47           HG2      LYS  47 -16.349   9.301  -8.363
    6    HG3  LYS  47           HG3      LYS  47 -16.458   7.579  -8.724
    7    HD2  LYS  47           HD2      LYS  47 -17.490   8.161 -10.909
    8    HD3  LYS  47           HD3      LYS  47 -17.201   9.862 -10.546
    9    HE2  LYS  47           HE2      LYS  47 -15.053   7.755 -10.677
   10    HE3  LYS  47           HE3      LYS  47 -15.469   8.845 -11.999
   11    HZ2  LYS  47           HZ1      LYS  47 -13.616   9.372 -10.180
   12    HZ1  LYS  47           HZ2      LYS  47 -14.960  10.097  -9.438
   13    HZ3  LYS  47           HZ3      LYS  47 -14.491  10.574 -11.000

  No H/Q in entry =          13
  In of MODEL   58
    1    H    GLY  48           H        GLY  48 -20.192   9.716  -6.043
    2    HA3  GLY  48           HA2      GLY  48 -22.609   8.591  -6.776
    3    HA2  GLY  48           HA3      GLY  48 -22.350   9.571  -5.332

  No H/Q in entry =           3
  In of MODEL   58
    1    H    GLN  49           H        GLN  49 -21.723  11.988  -6.892
    2    HA   GLN  49           HA       GLN  49 -24.256  13.160  -7.013
    3    HB2  GLN  49           HB2      GLN  49 -21.702  13.973  -8.385
    4    HB3  GLN  49           HB3      GLN  49 -23.141  14.971  -8.285
    5    HG2  GLN  49           HG2      GLN  49 -22.965  14.976  -5.849
    6    HG3  GLN  49           HG3      GLN  49 -21.539  13.958  -5.947
    7   HE21  GLN  49          HE21      GLN  49 -21.362  16.175  -4.662
    8   HE22  GLN  49          HE22      GLN  49 -20.414  17.413  -5.309

  No H/Q in entry =           8
  In of MODEL   58
    1    H    ASN  50           H        ASN  50 -22.637  11.256  -9.422
    2    HA   ASN  50           HA       ASN  50 -24.513  12.184 -11.486
    3    HB2  ASN  50           HB2      ASN  50 -21.971  10.586 -11.746
    4    HB3  ASN  50           HB3      ASN  50 -23.020  11.044 -13.080
    5   HD21  ASN  50          HD21      ASN  50 -20.354  11.819 -11.482
    6   HD22  ASN  50          HD22      ASN  50 -20.085  13.451 -11.816

  No H/Q in entry =           6
  In of MODEL   58
    1    H    ALA  51           H        ALA  51 -24.539   9.815  -9.255
    2    HA   ALA  51           HA       ALA  51 -25.386   7.700 -11.088
    3    HB2  ALA  51           HB1      ALA  51 -24.823   6.327  -9.413
    4    HB3  ALA  51           HB2      ALA  51 -25.919   7.155  -8.309
    5    HB1  ALA  51           HB3      ALA  51 -24.267   7.739  -8.514

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ASP  52           H        ASP  52 -27.414   6.691 -10.941
    2    HA   ASP  52           HA       ASP  52 -29.547   8.572 -10.250
    3    HB2  ASP  52           HB2      ASP  52 -29.427   6.074 -11.936
    4    HB3  ASP  52           HB3      ASP  52 -30.951   6.841 -11.487

  No H/Q in entry =           4
  In of MODEL   58
    1    H    VAL  53           H        VAL  53 -28.010   5.640  -9.262
    2    HA   VAL  53           HA       VAL  53 -29.430   5.787  -6.736
    3    HB   VAL  53           HB       VAL  53 -30.876   4.187  -7.980
    4   HG11  VAL  53          HG11      VAL  53 -29.161   3.294  -9.519
    5   HG13  VAL  53          HG12      VAL  53 -30.020   2.014  -8.661
    6   HG12  VAL  53          HG13      VAL  53 -28.395   2.475  -8.159
    7   HG23  VAL  53          HG21      VAL  53 -30.091   2.181  -6.304
    8   HG22  VAL  53          HG22      VAL  53 -31.186   3.509  -5.923
    9   HG21  VAL  53          HG23      VAL  53 -29.473   3.638  -5.526

  No H/Q in entry =           9
  In of MODEL   58
    1    H    VAL  54           H        VAL  54 -28.117   5.312  -5.092
    2    HA   VAL  54           HA       VAL  54 -25.383   4.399  -5.728
    3    HB   VAL  54           HB       VAL  54 -26.393   6.189  -3.460
    4   HG11  VAL  54          HG11      VAL  54 -23.852   4.707  -3.776
    5   HG13  VAL  54          HG12      VAL  54 -24.579   5.396  -2.325
    6   HG12  VAL  54          HG13      VAL  54 -23.655   6.424  -3.421
    7   HG22  VAL  54          HG21      VAL  54 -25.497   7.987  -4.554
    8   HG21  VAL  54          HG22      VAL  54 -26.078   7.019  -5.909
    9   HG23  VAL  54          HG23      VAL  54 -24.368   7.000  -5.482

  No H/Q in entry =           9
  In of MODEL   58
    1    H    LEU  55           H        LEU  55 -24.834   2.458  -5.099
    2    HA   LEU  55           HA       LEU  55 -26.360   1.173  -2.922
    3    HB2  LEU  55           HB2      LEU  55 -24.848  -0.020  -5.235
    4    HB3  LEU  55           HB3      LEU  55 -25.624  -0.942  -3.946
    5    HG   LEU  55           HG       LEU  55 -27.035   0.694  -6.044
    6   HD13  LEU  55          HD11      LEU  55 -26.790  -1.158  -7.277
    7   HD12  LEU  55          HD12      LEU  55 -27.760  -2.017  -6.080
    8   HD11  LEU  55          HD13      LEU  55 -26.003  -1.997  -5.941
    9   HD23  LEU  55          HD21      LEU  55 -28.365  -1.231  -4.192
   10   HD22  LEU  55          HD22      LEU  55 -29.031   0.173  -5.027
   11   HD21  LEU  55          HD23      LEU  55 -27.996   0.395  -3.616

  No H/Q in entry =          11
  In of MODEL   58
    1    H    LEU  56           H        LEU  56 -25.212   0.539  -1.127
    2    HA   LEU  56           HA       LEU  56 -22.269   0.861  -1.195
    3    HB2  LEU  56           HB2      LEU  56 -24.060   0.681   1.215
    4    HB3  LEU  56           HB3      LEU  56 -22.341   1.067   1.195
    5    HG   LEU  56           HG       LEU  56 -24.603   2.809   0.255
    6   HD11  LEU  56          HD11      LEU  56 -23.481   2.385   2.766
    7   HD13  LEU  56          HD12      LEU  56 -24.440   3.781   2.275
    8   HD12  LEU  56          HD13      LEU  56 -22.681   3.841   2.176
    9   HD23  LEU  56          HD21      LEU  56 -22.617   4.459   0.059
   10   HD22  LEU  56          HD22      LEU  56 -23.036   3.380  -1.272
   11   HD21  LEU  56          HD23      LEU  56 -21.685   2.986  -0.210

  No H/Q in entry =          11
  In of MODEL   58
    1    H    GLY  57           H        GLY  57 -20.927  -0.808  -0.680
    2    HA3  GLY  57           HA2      GLY  57 -21.919  -3.467  -0.886
    3    HA2  GLY  57           HA3      GLY  57 -20.281  -3.018  -0.418

  No H/Q in entry =           3
  In of MODEL   58
    1    HA   PRO  58           HA       PRO  58 -23.091  -4.007   3.308
    2    HB2  PRO  58           HB2      PRO  58 -22.469  -6.631   3.895
    3    HB3  PRO  58           HB3      PRO  58 -23.849  -6.183   2.893
    4    HG2  PRO  58           HG2      PRO  58 -21.151  -7.128   2.084
    5    HG3  PRO  58           HG3      PRO  58 -22.731  -7.544   1.420
    6    HD2  PRO  58           HD2      PRO  58 -21.084  -5.761   0.196
    7    HD3  PRO  58           HD3      PRO  58 -22.841  -5.629   0.107

  No H/Q in entry =           7
  In of MODEL   58
    1    H    GLN  59           H        GLN  59 -19.738  -4.561   2.676
    2    HA   GLN  59           HA       GLN  59 -18.965  -4.615   5.431
    3    HB2  GLN  59           HB2      GLN  59 -17.233  -3.582   3.198
    4    HB3  GLN  59           HB3      GLN  59 -16.739  -4.332   4.702
    5    HG2  GLN  59           HG2      GLN  59 -16.388  -6.058   3.259
    6    HG3  GLN  59           HG3      GLN  59 -18.048  -6.394   3.720
    7   HE21  GLN  59          HE21      GLN  59 -18.538  -7.256   1.974
    8   HE22  GLN  59          HE22      GLN  59 -18.838  -6.837   0.392

  No H/Q in entry =           8
  In of MODEL   58
    1    H    ILE  60           H        ILE  60 -19.848  -2.028   3.244
    2    HA   ILE  60           HA       ILE  60 -18.931  -0.106   5.294
    3    HB   ILE  60           HB       ILE  60 -18.655   1.566   3.664
    4   HG12  ILE  60          HG12      ILE  60 -20.184  -0.145   1.704
    5   HG13  ILE  60          HG13      ILE  60 -20.822   1.270   2.539
    6   HG22  ILE  60          HG21      ILE  60 -17.428   0.413   1.750
    7   HG21  ILE  60          HG22      ILE  60 -17.806  -1.085   2.599
    8   HG23  ILE  60          HG23      ILE  60 -16.847   0.161   3.395
    9   HD12  ILE  60          HD11      ILE  60 -19.981   1.551   0.106
   10   HD11  ILE  60          HD12      ILE  60 -18.369   1.484   0.814
   11   HD13  ILE  60          HD13      ILE  60 -19.493   2.752   1.299

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ALA  61           H        ALA  61 -21.427  -1.628   5.371
    2    HA   ALA  61           HA       ALA  61 -23.611   0.097   4.937
    3    HB1  ALA  61           HB1      ALA  61 -24.856  -1.369   6.263
    4    HB2  ALA  61           HB2      ALA  61 -23.462  -1.800   7.254
    5    HB3  ALA  61           HB3      ALA  61 -23.584  -2.394   5.598

  No H/Q in entry =           5
  In of MODEL   58
    1    H    TYR  62           H        TYR  62 -21.389  -0.088   7.719
    2    HA   TYR  62           HA       TYR  62 -22.890   1.599   9.409
    3    HB2  TYR  62           HB2      TYR  62 -20.830   1.964  10.631
    4    HB3  TYR  62           HB3      TYR  62 -20.936   0.268  10.158
    5    HD1  TYR  62           HD1      TYR  62 -19.425  -0.642   8.415
    6    HD2  TYR  62           HD2      TYR  62 -19.053   3.394   9.770
    7    HE1  TYR  62           HE1      TYR  62 -17.215  -0.487   7.333
    8    HE2  TYR  62           HE2      TYR  62 -16.829   3.542   8.689
    9    HH   TYR  62           HH       TYR  62 -15.721   1.107   6.527

  No H/Q in entry =           9
  In of MODEL   58
    1    H    MET  63           H        MET  63 -21.244   2.431   6.547
    2    HA   MET  63           HA       MET  63 -20.998   5.254   7.256
    3    HB2  MET  63           HB2      MET  63 -20.447   3.728   4.710
    4    HB3  MET  63           HB3      MET  63 -20.211   5.467   4.894
    5    HG2  MET  63           HG2      MET  63 -18.495   5.077   6.558
    6    HG3  MET  63           HG3      MET  63 -18.751   3.338   6.434
    7    HE2  MET  63           HE1      MET  63 -16.634   6.232   3.913
    8    HE1  MET  63           HE2      MET  63 -18.149   6.486   4.778
    9    HE3  MET  63           HE3      MET  63 -18.173   6.019   3.077

  No H/Q in entry =           9
  In of MODEL   58
    1    H    LEU  64           H        LEU  64 -23.616   3.474   6.298
    2    HA   LEU  64           HA       LEU  64 -24.802   4.936   4.237
    3    HB2  LEU  64           HB2      LEU  64 -25.721   2.848   5.149
    4    HB3  LEU  64           HB3      LEU  64 -26.145   3.694   6.637
    5    HG   LEU  64           HG       LEU  64 -27.814   5.000   5.427
    6   HD13  LEU  64          HD11      LEU  64 -27.540   5.247   3.194
    7   HD12  LEU  64          HD12      LEU  64 -28.230   3.630   3.044
    8   HD11  LEU  64          HD13      LEU  64 -26.480   3.842   3.091
    9   HD23  LEU  64          HD21      LEU  64 -28.413   2.207   4.667
   10   HD22  LEU  64          HD22      LEU  64 -29.364   3.362   5.601
   11   HD21  LEU  64          HD23      LEU  64 -28.005   2.528   6.354

  No H/Q in entry =          11
  In of MODEL   58
    1    HA   PRO  65           HA       PRO  65 -26.878   8.132   7.021
    2    HB2  PRO  65           HB2      PRO  65 -24.857   8.223   9.262
    3    HB3  PRO  65           HB3      PRO  65 -26.588   8.551   9.321
    4    HG2  PRO  65           HG2      PRO  65 -25.714   6.266  10.228
    5    HG3  PRO  65           HG3      PRO  65 -27.141   6.278   9.194
    6    HD2  PRO  65           HD2      PRO  65 -24.292   5.589   8.466
    7    HD3  PRO  65           HD3      PRO  65 -25.776   4.746   8.024

  No H/Q in entry =           7
  In of MODEL   58
    1    H    GLU  66           H        GLU  66 -23.324   7.978   7.068
    2    HA   GLU  66           HA       GLU  66 -22.952  10.769   6.677
    3    HB2  GLU  66           HB2      GLU  66 -21.209   8.416   5.999
    4    HB3  GLU  66           HB3      GLU  66 -20.713  10.097   5.798
    5    HG2  GLU  66           HG2      GLU  66 -20.898  10.459   8.169
    6    HG3  GLU  66           HG3      GLU  66 -21.468   8.806   8.395

  No H/Q in entry =           6
  In of MODEL   58
    1    H    ILE  67           H        ILE  67 -23.146   8.040   4.410
    2    HA   ILE  67           HA       ILE  67 -22.699   9.750   2.124
    3    HB   ILE  67           HB       ILE  67 -23.678   6.868   2.294
    4   HG12  ILE  67          HG12      ILE  67 -21.023   7.968   1.358
    5   HG13  ILE  67          HG13      ILE  67 -21.318   7.548   3.044
    6   HG21  ILE  67          HG21      ILE  67 -23.583   8.757   0.078
    7   HG23  ILE  67          HG22      ILE  67 -24.255   7.128   0.124
    8   HG22  ILE  67          HG23      ILE  67 -22.541   7.365  -0.215
    9   HD12  ILE  67          HD11      ILE  67 -20.964   5.778   0.682
   10   HD11  ILE  67          HD12      ILE  67 -21.985   5.228   2.009
   11   HD13  ILE  67          HD13      ILE  67 -20.298   5.642   2.308

  No H/Q in entry =          11
  In of MODEL   58
    1    H    GLN  68           H        GLN  68 -25.586   8.770   3.772
    2    HA   GLN  68           HA       GLN  68 -27.402   9.764   1.817
    3    HB2  GLN  68           HB2      GLN  68 -27.647   9.397   4.799
    4    HB3  GLN  68           HB3      GLN  68 -28.955  10.035   3.819
    5    HG2  GLN  68           HG2      GLN  68 -29.052   8.015   2.533
    6    HG3  GLN  68           HG3      GLN  68 -27.614   7.391   3.321
    7   HE21  GLN  68          HE21      GLN  68 -29.833   6.098   3.194
    8   HE22  GLN  68          HE22      GLN  68 -30.664   5.659   4.613

  No H/Q in entry =           8
  In of MODEL   58
    1    H    ARG  69           H        ARG  69 -25.728  11.366   4.551
    2    HA   ARG  69           HA       ARG  69 -27.019  13.890   4.170
    3    HB2  ARG  69           HB2      ARG  69 -24.692  12.881   5.735
    4    HB3  ARG  69           HB3      ARG  69 -24.722  14.604   5.388
    5    HG2  ARG  69           HG2      ARG  69 -27.029  14.711   6.377
    6    HG3  ARG  69           HG3      ARG  69 -26.869  13.013   6.839
    7    HD2  ARG  69           HD2      ARG  69 -25.099  15.311   7.754
    8    HD3  ARG  69           HD3      ARG  69 -26.248  14.433   8.751
    9    HE   ARG  69           HE       ARG  69 -23.672  13.429   7.777
   10   HH21  ARG  69          HH11      ARG  69 -22.909  11.635   8.956
   11   HH22  ARG  69          HH12      ARG  69 -23.953  10.843  10.089
   12   HH11  ARG  69          HH21      ARG  69 -26.632  12.961   9.494
   13   HH12  ARG  69          HH22      ARG  69 -26.061  11.593  10.390

  No H/Q in entry =          13
  In of MODEL   58
    1    H    LEU  70           H        LEU  70 -24.204  12.405   2.780
    2    HA   LEU  70           HA       LEU  70 -23.027  14.742   1.617
    3    HB2  LEU  70           HB2      LEU  70 -22.100  12.392   2.191
    4    HB3  LEU  70           HB3      LEU  70 -22.741  11.954   0.607
    5    HG   LEU  70           HG       LEU  70 -21.113  13.284  -0.482
    6   HD11  LEU  70          HD11      LEU  70 -20.245  14.084   2.304
    7   HD13  LEU  70          HD12      LEU  70 -20.917  15.147   1.068
    8   HD12  LEU  70          HD13      LEU  70 -19.329  14.418   0.832
    9   HD22  LEU  70          HD21      LEU  70 -19.732  11.522  -0.270
   10   HD21  LEU  70          HD22      LEU  70 -20.664  11.020   1.141
   11   HD23  LEU  70          HD23      LEU  70 -19.244  12.048   1.341

  No H/Q in entry =          11
  In of MODEL   58
    1    H    LEU  71           H        LEU  71 -25.267  12.274   0.504
    2    HA   LEU  71           HA       LEU  71 -25.764  13.793  -2.000
    3    HB2  LEU  71           HB2      LEU  71 -26.061  10.814  -1.569
    4    HB3  LEU  71           HB3      LEU  71 -26.173  11.687  -3.096
    5    HG   LEU  71           HG       LEU  71 -23.642  11.610  -1.455
    6   HD12  LEU  71          HD11      LEU  71 -23.765   9.999  -3.896
    7   HD11  LEU  71          HD12      LEU  71 -24.785   9.400  -2.589
    8   HD13  LEU  71          HD13      LEU  71 -23.055   9.623  -2.326
    9   HD22  LEU  71          HD21      LEU  71 -23.697  13.437  -2.938
   10   HD21  LEU  71          HD22      LEU  71 -24.238  12.420  -4.272
   11   HD23  LEU  71          HD23      LEU  71 -22.617  12.216  -3.607

  No H/Q in entry =          11
  In of MODEL   58
    1    HA   PRO  72           HA       PRO  72 -29.622  13.454   0.649
    2    HB2  PRO  72           HB2      PRO  72 -30.395  16.042   0.589
    3    HB3  PRO  72           HB3      PRO  72 -29.093  15.541   1.667
    4    HG2  PRO  72           HG2      PRO  72 -28.889  16.746  -1.081
    5    HG3  PRO  72           HG3      PRO  72 -28.093  17.263   0.406
    6    HD2  PRO  72           HD2      PRO  72 -26.822  15.670  -1.380
    7    HD3  PRO  72           HD3      PRO  72 -26.560  15.485   0.353

  No H/Q in entry =           7
  In of MODEL   58
    1    H    ASN  73           H        ASN  73 -28.991  14.407  -2.565
    2    HA   ASN  73           HA       ASN  73 -31.865  14.199  -3.176
    3    HB2  ASN  73           HB2      ASN  73 -31.379  15.301  -5.271
    4    HB3  ASN  73           HB3      ASN  73 -30.813  16.255  -3.908
    5   HD21  ASN  73          HD21      ASN  73 -30.037  16.289  -6.591
    6   HD22  ASN  73          HD22      ASN  73 -28.377  16.073  -6.797

  No H/Q in entry =           6
  In of MODEL   58
    1    H    LYS  74           H        LYS  74 -29.960  11.875  -2.780
    2    HA   LYS  74           HA       LYS  74 -30.594  10.516  -5.332
    3    HB2  LYS  74           HB2      LYS  74 -28.060  10.127  -3.732
    4    HB3  LYS  74           HB3      LYS  74 -28.484   9.338  -5.252
    5    HG2  LYS  74           HG2      LYS  74 -28.115  12.295  -5.035
    6    HG3  LYS  74           HG3      LYS  74 -26.781  11.188  -5.355
    7    HD2  LYS  74           HD2      LYS  74 -27.945  10.311  -7.295
    8    HD3  LYS  74           HD3      LYS  74 -29.326  11.355  -6.958
    9    HE2  LYS  74           HE2      LYS  74 -28.034  13.320  -7.399
   10    HE3  LYS  74           HE3      LYS  74 -26.546  12.378  -7.508
   11    HZ2  LYS  74           HZ1      LYS  74 -28.011  13.044  -9.618
   12    HZ1  LYS  74           HZ2      LYS  74 -28.716  11.544  -9.248
   13    HZ3  LYS  74           HZ3      LYS  74 -27.049  11.647  -9.557

  No H/Q in entry =          13
  In of MODEL   58
    1    HA   PRO  75           HA       PRO  75 -32.070   7.563  -2.367
    2    HB2  PRO  75           HB2      PRO  75 -32.469   5.367  -3.959
    3    HB3  PRO  75           HB3      PRO  75 -33.547   6.761  -4.012
    4    HG2  PRO  75           HG2      PRO  75 -31.246   6.093  -5.805
    5    HG3  PRO  75           HG3      PRO  75 -32.880   6.590  -6.236
    6    HD2  PRO  75           HD2      PRO  75 -30.874   8.385  -6.198
    7    HD3  PRO  75           HD3      PRO  75 -32.487   8.838  -5.645

  No H/Q in entry =           7
  In of MODEL   58
    1    H    VAL  76           H        VAL  76 -30.644   6.449  -1.011
    2    HA   VAL  76           HA       VAL  76 -28.232   5.160  -2.144
    3    HB   VAL  76           HB       VAL  76 -28.448   6.620   0.524
    4   HG11  VAL  76          HG11      VAL  76 -26.149   5.258  -0.893
    5   HG13  VAL  76          HG12      VAL  76 -26.849   4.824   0.667
    6   HG12  VAL  76          HG13      VAL  76 -25.951   6.331   0.493
    7   HG22  VAL  76          HG21      VAL  76 -27.719   8.502  -0.358
    8   HG21  VAL  76          HG22      VAL  76 -28.298   7.834  -1.886
    9   HG23  VAL  76          HG23      VAL  76 -26.597   7.683  -1.444

  No H/Q in entry =           9
  In of MODEL   58
    1    H    GLU  77           H        GLU  77 -28.086   2.996  -1.545
    2    HA   GLU  77           HA       GLU  77 -28.881   2.222   1.110
    3    HB2  GLU  77           HB2      GLU  77 -30.549   0.635   0.583
    4    HB3  GLU  77           HB3      GLU  77 -31.049   2.181  -0.105
    5    HG2  GLU  77           HG2      GLU  77 -30.484   1.415  -2.302
    6    HG3  GLU  77           HG3      GLU  77 -29.890  -0.108  -1.642

  No H/Q in entry =           6
  In of MODEL   58
    1    H    VAL  78           H        VAL  78 -28.623   0.121   1.757
    2    HA   VAL  78           HA       VAL  78 -25.992  -0.739   0.844
    3    HB   VAL  78           HB       VAL  78 -27.713  -1.575   3.218
    4   HG11  VAL  78          HG11      VAL  78 -25.426  -2.879   2.069
    5   HG13  VAL  78          HG12      VAL  78 -26.340  -3.326   3.511
    6   HG12  VAL  78          HG13      VAL  78 -24.979  -2.213   3.638
    7   HG22  VAL  78          HG21      VAL  78 -26.197  -0.273   4.552
    8   HG21  VAL  78          HG22      VAL  78 -26.908   0.730   3.288
    9   HG23  VAL  78          HG23      VAL  78 -25.252   0.144   3.123

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ILE  79           H        ILE  79 -25.529  -2.659  -0.076
    2    HA   ILE  79           HA       ILE  79 -27.650  -4.057  -1.415
    3    HB   ILE  79           HB       ILE  79 -24.678  -4.689  -1.220
    4   HG12  ILE  79          HG12      ILE  79 -26.292  -3.516  -3.490
    5   HG13  ILE  79          HG13      ILE  79 -25.374  -2.543  -2.338
    6   HG22  ILE  79          HG21      ILE  79 -25.838  -5.816  -3.537
    7   HG21  ILE  79          HG22      ILE  79 -26.830  -6.311  -2.164
    8   HG23  ILE  79          HG23      ILE  79 -25.099  -6.650  -2.169
    9   HD13  ILE  79          HD11      ILE  79 -23.978  -2.696  -4.167
   10   HD12  ILE  79          HD12      ILE  79 -24.380  -4.389  -4.455
   11   HD11  ILE  79          HD13      ILE  79 -23.369  -3.944  -3.079

  No H/Q in entry =          11
  In of MODEL   58
    1    H    ASP  80           H        ASP  80 -28.577  -5.952  -0.836
    2    HA   ASP  80           HA       ASP  80 -28.536  -6.868   1.806
    3    HB2  ASP  80           HB2      ASP  80 -30.320  -7.373   0.176
    4    HB3  ASP  80           HB3      ASP  80 -29.205  -8.415  -0.707

  No H/Q in entry =           4
  In of MODEL   58
    1    H    SER  81           H        SER  81 -27.033  -8.061   2.918
    2    HA   SER  81           HA       SER  81 -24.571  -8.824   1.704
    3    HB2  SER  81           HB2      SER  81 -24.038  -9.881   3.863
    4    HB3  SER  81           HB3      SER  81 -24.685  -8.257   4.092
    5    HG   SER  81           HG       SER  81 -26.669  -9.173   4.598

  No H/Q in entry =           5
  In of MODEL   58
    1    H    LEU  82           H        LEU  82 -27.350 -10.821   2.036
    2    HA   LEU  82           HA       LEU  82 -25.891 -13.239   1.492
    3    HB2  LEU  82           HB2      LEU  82 -28.805 -12.519   1.262
    4    HB3  LEU  82           HB3      LEU  82 -28.160 -14.144   1.037
    5    HG   LEU  82           HG       LEU  82 -28.023 -12.583   3.599
    6   HD12  LEU  82          HD11      LEU  82 -29.688 -14.404   4.292
    7   HD11  LEU  82          HD12      LEU  82 -29.915 -14.693   2.565
    8   HD13  LEU  82          HD13      LEU  82 -30.309 -13.118   3.254
    9   HD23  LEU  82          HD21      LEU  82 -27.505 -14.997   4.371
   10   HD22  LEU  82          HD22      LEU  82 -26.232 -14.093   3.555
   11   HD21  LEU  82          HD23      LEU  82 -27.156 -15.306   2.670

  No H/Q in entry =          11
  In of MODEL   58
    1    H    LEU  83           H        LEU  83 -27.783 -10.937  -0.402
    2    HA   LEU  83           HA       LEU  83 -27.648 -12.288  -2.880
    3    HB2  LEU  83           HB2      LEU  83 -27.951  -9.372  -2.215
    4    HB3  LEU  83           HB3      LEU  83 -28.017 -10.007  -3.859
    5    HG   LEU  83           HG       LEU  83 -30.048 -10.333  -1.670
    6   HD13  LEU  83          HD11      LEU  83 -30.746  -8.454  -2.719
    7   HD12  LEU  83          HD12      LEU  83 -31.258  -9.545  -4.006
    8   HD11  LEU  83          HD13      LEU  83 -29.695  -8.733  -4.105
    9   HD23  LEU  83          HD21      LEU  83 -30.251 -11.571  -4.399
   10   HD22  LEU  83          HD22      LEU  83 -31.222 -11.895  -2.963
   11   HD21  LEU  83          HD23      LEU  83 -29.553 -12.456  -3.044

  No H/Q in entry =          11
  In of MODEL   58
    1    H    TYR  84           H        TYR  84 -25.600  -9.982  -1.208
    2    HA   TYR  84           HA       TYR  84 -23.738  -9.549  -3.350
    3    HB2  TYR  84           HB2      TYR  84 -24.190  -8.059  -1.312
    4    HB3  TYR  84           HB3      TYR  84 -23.196  -9.196  -0.406
    5    HD1  TYR  84           HD1      TYR  84 -20.837  -9.083  -0.478
    6    HD2  TYR  84           HD2      TYR  84 -23.147  -6.813  -3.260
    7    HE1  TYR  84           HE1      TYR  84 -18.786  -7.914  -1.210
    8    HE2  TYR  84           HE2      TYR  84 -21.104  -5.644  -4.009
    9    HH   TYR  84           HH       TYR  84 -17.950  -6.700  -3.063

  No H/Q in entry =           9
  In of MODEL   58
    1    H    GLY  85           H        GLY  85 -23.547 -11.573  -0.414
    2    HA3  GLY  85           HA2      GLY  85 -21.008 -12.604  -0.921
    3    HA2  GLY  85           HA3      GLY  85 -22.260 -13.412   0.021

  No H/Q in entry =           3
  In of MODEL   58
    1    H    LYS  86           H        LYS  86 -24.134 -13.710  -2.027
    2    HA   LYS  86           HA       LYS  86 -23.174 -16.112  -3.305
    3    HB2  LYS  86           HB2      LYS  86 -25.421 -15.811  -2.301
    4    HB3  LYS  86           HB3      LYS  86 -25.777 -14.601  -3.533
    5    HG2  LYS  86           HG2      LYS  86 -25.698 -16.280  -5.245
    6    HG3  LYS  86           HG3      LYS  86 -25.252 -17.502  -4.053
    7    HD2  LYS  86           HD2      LYS  86 -27.334 -17.052  -2.822
    8    HD3  LYS  86           HD3      LYS  86 -27.781 -15.845  -4.026
    9    HE2  LYS  86           HE2      LYS  86 -27.291 -18.754  -4.644
   10    HE3  LYS  86           HE3      LYS  86 -28.883 -18.053  -4.356
   11    HZ1  LYS  86           HZ1      LYS  86 -27.989 -16.360  -6.165
   12    HZ3  LYS  86           HZ2      LYS  86 -28.786 -17.798  -6.591
   13    HZ2  LYS  86           HZ3      LYS  86 -27.091 -17.722  -6.637

  No H/Q in entry =          13
  In of MODEL   58
    1    H    VAL  87           H        VAL  87 -23.056 -12.896  -4.184
    2    HA   VAL  87           HA       VAL  87 -22.731 -11.724  -6.121
    3    HB   VAL  87           HB       VAL  87 -21.758 -14.272  -7.452
    4   HG11  VAL  87          HG11      VAL  87 -21.904 -11.914  -8.550
    5   HG13  VAL  87          HG12      VAL  87 -20.405 -12.827  -8.726
    6   HG12  VAL  87          HG13      VAL  87 -20.514 -11.529  -7.537
    7   HG23  VAL  87          HG21      VAL  87 -19.507 -13.743  -6.455
    8   HG22  VAL  87          HG22      VAL  87 -20.692 -14.430  -5.346
    9   HG21  VAL  87          HG23      VAL  87 -20.350 -12.702  -5.310

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ASP  88           H        ASP  88 -25.265 -12.279  -5.754
    2    HA   ASP  88           HA       ASP  88 -26.447 -13.445  -8.148
    3    HB2  ASP  88           HB2      ASP  88 -27.432 -13.665  -5.817
    4    HB3  ASP  88           HB3      ASP  88 -27.826 -11.949  -5.905

  No H/Q in entry =           4
  In of MODEL   58
    1    H    GLY  89           H        GLY  89 -25.711 -12.204  -9.789
    2    HA3  GLY  89           HA2      GLY  89 -25.798  -9.427  -9.976
    3    HA2  GLY  89           HA3      GLY  89 -25.823 -10.540 -11.342

  No H/Q in entry =           3
  In of MODEL   58
    1    H    LEU  90           H        LEU  90 -28.311 -11.808 -10.879
    2    HA   LEU  90           HA       LEU  90 -30.063  -9.807 -11.970
    3    HB2  LEU  90           HB2      LEU  90 -30.216 -12.197 -12.560
    4    HB3  LEU  90           HB3      LEU  90 -30.721 -12.553 -10.908
    5    HG   LEU  90           HG       LEU  90 -32.803 -11.363 -11.249
    6   HD13  LEU  90          HD11      LEU  90 -32.575  -9.621 -12.719
    7   HD12  LEU  90          HD12      LEU  90 -33.166 -10.834 -13.857
    8   HD11  LEU  90          HD13      LEU  90 -31.438 -10.500 -13.745
    9   HD23  LEU  90          HD21      LEU  90 -32.809 -12.982 -13.692
   10   HD22  LEU  90          HD22      LEU  90 -33.781 -13.120 -12.228
   11   HD21  LEU  90          HD23      LEU  90 -32.150 -13.789 -12.269

  No H/Q in entry =          11
  In of MODEL   58
    1    H    GLY  91           H        GLY  91 -29.922 -11.328  -8.794
    2    HA3  GLY  91           HA2      GLY  91 -32.212 -10.140  -7.730
    3    HA2  GLY  91           HA3      GLY  91 -30.832 -10.726  -6.802

  No H/Q in entry =           3
  In of MODEL   58
    1    H    VAL  92           H        VAL  92 -28.859  -8.962  -7.665
    2    HA   VAL  92           HA       VAL  92 -29.558  -6.642  -6.100
    3    HB   VAL  92           HB       VAL  92 -27.042  -7.191  -7.719
    4   HG12  VAL  92          HG11      VAL  92 -27.124  -5.311  -5.383
    5   HG11  VAL  92          HG12      VAL  92 -27.783  -4.739  -6.918
    6   HG13  VAL  92          HG13      VAL  92 -26.102  -5.265  -6.821
    7   HG22  VAL  92          HG21      VAL  92 -26.861  -8.793  -6.136
    8   HG21  VAL  92          HG22      VAL  92 -27.970  -7.978  -5.030
    9   HG23  VAL  92          HG23      VAL  92 -26.297  -7.435  -5.162

  No H/Q in entry =           9
  In of MODEL   58
    1    H    LEU  93           H        LEU  93 -29.202  -7.302  -9.527
    2    HA   LEU  93           HA       LEU  93 -29.465  -4.652 -10.442
    3    HB2  LEU  93           HB2      LEU  93 -28.899  -6.521 -11.917
    4    HB3  LEU  93           HB3      LEU  93 -30.512  -7.194 -11.684
    5    HG   LEU  93           HG       LEU  93 -31.465  -5.193 -12.792
    6   HD11  LEU  93          HD11      LEU  93 -29.557  -3.664 -12.296
    7   HD13  LEU  93          HD12      LEU  93 -30.012  -3.671 -14.001
    8   HD12  LEU  93          HD13      LEU  93 -28.584  -4.558 -13.465
    9   HD23  LEU  93          HD21      LEU  93 -30.465  -5.784 -15.090
   10   HD22  LEU  93          HD22      LEU  93 -31.342  -7.016 -14.182
   11   HD21  LEU  93          HD23      LEU  93 -29.577  -7.021 -14.199

  No H/Q in entry =          11
  In of MODEL   58
    1    H    LYS  94           H        LYS  94 -31.919  -7.120  -9.584
    2    HA   LYS  94           HA       LYS  94 -34.217  -5.596 -10.183
    3    HB2  LYS  94           HB2      LYS  94 -33.761  -7.806  -8.185
    4    HB3  LYS  94           HB3      LYS  94 -35.336  -7.055  -8.436
    5    HG2  LYS  94           HG2      LYS  94 -35.296  -7.822 -10.774
    6    HG3  LYS  94           HG3      LYS  94 -33.759  -8.628 -10.462
    7    HD2  LYS  94           HD2      LYS  94 -34.908  -9.931  -8.634
    8    HD3  LYS  94           HD3      LYS  94 -36.434  -9.229  -9.173
    9    HE2  LYS  94           HE2      LYS  94 -35.969 -10.165 -11.448
   10    HE3  LYS  94           HE3      LYS  94 -34.576 -10.999 -10.760
   11    HZ3  LYS  94           HZ1      LYS  94 -36.478 -12.456 -10.920
   12    HZ2  LYS  94           HZ2      LYS  94 -37.408 -11.401  -9.966
   13    HZ1  LYS  94           HZ3      LYS  94 -36.069 -12.199  -9.292

  No H/Q in entry =          13
  In of MODEL   58
    1    H    ALA  95           H        ALA  95 -32.373  -5.792  -7.150
    2    HA   ALA  95           HA       ALA  95 -34.155  -4.157  -5.648
    3    HB2  ALA  95           HB1      ALA  95 -31.823  -5.614  -5.138
    4    HB3  ALA  95           HB2      ALA  95 -32.761  -4.682  -3.972
    5    HB1  ALA  95           HB3      ALA  95 -31.394  -3.938  -4.801

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ALA  96           H        ALA  96 -31.503  -3.385  -7.764
    2    HA   ALA  96           HA       ALA  96 -31.306  -0.632  -6.978
    3    HB2  ALA  96           HB1      ALA  96 -29.955  -0.443  -9.099
    4    HB3  ALA  96           HB2      ALA  96 -30.319  -2.137  -9.423
    5    HB1  ALA  96           HB3      ALA  96 -29.377  -1.695  -7.999

  No H/Q in entry =           5
  In of MODEL   58
    1    H    VAL  97           H        VAL  97 -32.918  -2.279  -9.660
    2    HA   VAL  97           HA       VAL  97 -33.918   0.062 -10.896
    3    HB   VAL  97           HB       VAL  97 -34.830  -2.833 -10.945
    4   HG11  VAL  97          HG11      VAL  97 -36.555  -0.763 -11.405
    5   HG13  VAL  97          HG12      VAL  97 -36.676  -2.348 -12.168
    6   HG12  VAL  97          HG13      VAL  97 -35.882  -1.022 -13.017
    7   HG21  VAL  97          HG21      VAL  97 -33.504  -1.041 -12.982
    8   HG23  VAL  97          HG22      VAL  97 -34.018  -2.703 -13.275
    9   HG22  VAL  97          HG23      VAL  97 -32.747  -2.366 -12.099

  No H/Q in entry =           9
  In of MODEL   58
    1    H    ALA  98           H        ALA  98 -35.156  -2.086  -8.359
    2    HA   ALA  98           HA       ALA  98 -37.670  -0.849  -7.981
    3    HB1  ALA  98           HB1      ALA  98 -36.727  -3.088  -6.966
    4    HB3  ALA  98           HB2      ALA  98 -37.866  -2.126  -6.021
    5    HB2  ALA  98           HB3      ALA  98 -36.138  -2.041  -5.676

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ALA  99           H        ALA  99 -34.551  -0.169  -6.356
    2    HA   ALA  99           HA       ALA  99 -35.594   1.846  -4.676
    3    HB1  ALA  99           HB1      ALA  99 -32.986   0.865  -5.450
    4    HB2  ALA  99           HB2      ALA  99 -33.496   1.627  -3.943
    5    HB3  ALA  99           HB3      ALA  99 -32.996   2.622  -5.309

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ILE 100           H        ILE 100 -34.578   1.956  -8.039
    2    HA   ILE 100           HA       ILE 100 -34.654   4.810  -8.243
    3    HB   ILE 100           HB       ILE 100 -34.847   2.672 -10.392
    4   HG12  ILE 100          HG12      ILE 100 -32.606   4.580  -9.729
    5   HG13  ILE 100          HG13      ILE 100 -32.697   2.932  -9.107
    6   HG21  ILE 100          HG21      ILE 100 -35.163   5.606 -10.503
    7   HG23  ILE 100          HG22      ILE 100 -35.725   4.363 -11.621
    8   HG22  ILE 100          HG23      ILE 100 -34.052   4.917 -11.688
    9   HD12  ILE 100          HD11      ILE 100 -32.154   3.884 -11.881
   10   HD11  ILE 100          HD12      ILE 100 -32.871   2.293 -11.629
   11   HD13  ILE 100          HD13      ILE 100 -31.303   2.676 -10.919

  No H/Q in entry =          11
  In of MODEL   58
    1    H    LYS 101           H        LYS 101 -37.048   2.291  -8.962
    2    HA   LYS 101           HA       LYS 101 -39.076   4.022  -9.935
    3    HB2  LYS 101           HB2      LYS 101 -39.053   1.239  -8.823
    4    HB3  LYS 101           HB3      LYS 101 -40.579   2.059  -9.151
    5    HG2  LYS 101           HG2      LYS 101 -40.119   2.190 -11.452
    6    HG3  LYS 101           HG3      LYS 101 -38.438   1.720 -11.214
    7    HD2  LYS 101           HD2      LYS 101 -39.765  -0.135 -12.099
    8    HD3  LYS 101           HD3      LYS 101 -39.137  -0.498 -10.491
    9    HE2  LYS 101           HE2      LYS 101 -41.219  -1.118  -9.970
   10    HE3  LYS 101           HE3      LYS 101 -41.613   0.601  -9.961
   11    HZ3  LYS 101           HZ1      LYS 101 -42.528   0.489 -12.071
   12    HZ2  LYS 101           HZ2      LYS 101 -43.037  -0.970 -11.367
   13    HZ1  LYS 101           HZ3      LYS 101 -41.739  -0.964 -12.462

  No H/Q in entry =          13
  In of MODEL   58
    1    H    LYS 102           H        LYS 102 -38.612   2.509  -6.738
    2    HA   LYS 102           HA       LYS 102 -40.804   3.779  -5.515
    3    HB2  LYS 102           HB2      LYS 102 -39.629   1.863  -4.520
    4    HB3  LYS 102           HB3      LYS 102 -38.198   2.864  -4.283
    5    HG2  LYS 102           HG2      LYS 102 -39.449   4.297  -2.767
    6    HG3  LYS 102           HG3      LYS 102 -40.884   3.300  -3.007
    7    HD2  LYS 102           HD2      LYS 102 -39.719   1.383  -2.002
    8    HD3  LYS 102           HD3      LYS 102 -38.285   2.383  -1.760
    9    HE2  LYS 102           HE2      LYS 102 -39.572   3.902  -0.332
   10    HE3  LYS 102           HE3      LYS 102 -41.022   2.935  -0.594
   11    HZ1  LYS 102           HZ1      LYS 102 -39.360   1.111   0.385
   12    HZ3  LYS 102           HZ2      LYS 102 -40.429   2.031   1.330
   13    HZ2  LYS 102           HZ3      LYS 102 -38.801   2.496   1.191

  No H/Q in entry =          13
  In of MODEL   58
    1    H    ALA 103           H        ALA 103 -37.808   5.066  -6.545
    2    HA   ALA 103           HA       ALA 103 -37.930   7.377  -4.747
    3    HB2  ALA 103           HB1      ALA 103 -35.927   8.046  -6.336
    4    HB3  ALA 103           HB2      ALA 103 -35.958   6.331  -6.744
    5    HB1  ALA 103           HB3      ALA 103 -35.698   6.836  -5.075

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ALA 104           H        ALA 104 -38.605   6.690  -8.093
    2    HA   ALA 104           HA       ALA 104 -39.092   9.498  -8.694
    3    HB2  ALA 104           HB1      ALA 104 -39.178   8.846 -10.900
    4    HB1  ALA 104           HB2      ALA 104 -39.959   7.309 -10.525
    5    HB3  ALA 104           HB3      ALA 104 -38.227   7.507 -10.258

  No H/Q in entry =           5
  In of MODEL   58
    1    H    ALA 105           H        ALA 105 -40.762   7.444  -6.889
    2    HA   ALA 105           HA       ALA 105 -43.133   8.925  -6.833
    3    HB2  ALA 105           HB1      ALA 105 -43.926   8.107  -8.871
    4    HB3  ALA 105           HB2      ALA 105 -44.597   6.936  -7.736
    5    HB1  ALA 105           HB3      ALA 105 -43.149   6.538  -8.659

  No H/Q in entry =           5
  In of MODEL   59
    1    H1   ALA   1           H3       ALA   1 -12.467 -15.399  -2.227
    2    H2   ALA   1           H2       ALA   1 -11.549 -16.549  -3.082
    3    H3   ALA   1           H1       ALA   1 -12.689 -15.586  -3.899
    4    HA   ALA   1           HA       ALA   1 -14.106 -17.269  -3.653
    5    HB3  ALA   1           HB1      ALA   1 -12.728 -19.061  -3.214
    6    HB1  ALA   1           HB2      ALA   1 -13.467 -18.946  -1.616
    7    HB2  ALA   1           HB3      ALA   1 -11.885 -18.224  -1.910

  No H/Q in entry =           7
  In of MODEL   59
    1    H    GLU   2           H        GLU   2 -15.723 -18.111  -1.987
    2    HA   GLU   2           HA       GLU   2 -17.339 -16.375  -0.903
    3    HB2  GLU   2           HB2      GLU   2 -16.415 -18.819   0.621
    4    HB3  GLU   2           HB3      GLU   2 -17.925 -17.951   0.894
    5    HG2  GLU   2           HG2      GLU   2 -18.936 -19.017  -0.835
    6    HG3  GLU   2           HG3      GLU   2 -17.619 -18.628  -1.931

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLU   3           H        GLU   3 -15.417 -17.765   1.694
    2    HA   GLU   3           HA       GLU   3 -15.593 -15.416   3.264
    3    HB2  GLU   3           HB2      GLU   3 -14.038 -17.984   3.487
    4    HB3  GLU   3           HB3      GLU   3 -13.778 -16.672   4.638
    5    HG2  GLU   3           HG2      GLU   3 -15.965 -16.800   5.477
    6    HG3  GLU   3           HG3      GLU   3 -16.585 -17.585   4.031

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LEU   4           H        LEU   4 -12.672 -16.925   1.837
    2    HA   LEU   4           HA       LEU   4 -10.807 -15.048   2.425
    3    HB2  LEU   4           HB2      LEU   4 -11.082 -16.330  -0.303
    4    HB3  LEU   4           HB3      LEU   4  -9.614 -15.632   0.370
    5    HG   LEU   4           HG       LEU   4 -11.127 -18.015   1.487
    6   HD13  LEU   4          HD11      LEU   4  -9.522 -19.387   0.536
    7   HD12  LEU   4          HD12      LEU   4  -8.296 -18.119   0.502
    8   HD11  LEU   4          HD13      LEU   4  -9.597 -18.119  -0.687
    9   HD23  LEU   4          HD21      LEU   4  -8.863 -18.113   2.846
   10   HD22  LEU   4          HD22      LEU   4 -10.166 -17.060   3.393
   11   HD21  LEU   4          HD23      LEU   4  -8.803 -16.384   2.500

  No H/Q in entry =          11
  In of MODEL   59
    1    H    GLU   5           H        GLU   5 -13.166 -14.799  -0.224
    2    HA   GLU   5           HA       GLU   5 -12.141 -12.324  -1.224
    3    HB2  GLU   5           HB2      GLU   5 -13.524 -13.894  -2.573
    4    HB3  GLU   5           HB3      GLU   5 -14.909 -13.499  -1.554
    5    HG2  GLU   5           HG2      GLU   5 -14.735 -11.136  -2.203
    6    HG3  GLU   5           HG3      GLU   5 -13.325 -11.504  -3.196

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLU   6           H        GLU   6 -14.856 -13.177   0.891
    2    HA   GLU   6           HA       GLU   6 -15.722 -10.491   1.312
    3    HB2  GLU   6           HB2      GLU   6 -16.156 -13.034   2.893
    4    HB3  GLU   6           HB3      GLU   6 -16.929 -11.498   3.280
    5    HG2  GLU   6           HG2      GLU   6 -17.145 -12.894   0.599
    6    HG3  GLU   6           HG3      GLU   6 -18.366 -12.977   1.866

  No H/Q in entry =           6
  In of MODEL   59
    1    H    VAL   7           H        VAL   7 -13.427 -12.638   2.851
    2    HA   VAL   7           HA       VAL   7 -12.917 -11.080   5.180
    3    HB   VAL   7           HB       VAL   7 -11.254 -13.139   3.705
    4   HG11  VAL   7          HG11      VAL   7 -10.741 -11.624   6.271
    5   HG13  VAL   7          HG12      VAL   7  -9.657 -11.846   4.899
    6   HG12  VAL   7          HG13      VAL   7 -10.017 -13.203   5.966
    7   HG21  VAL   7          HG21      VAL   7 -13.500 -13.680   4.944
    8   HG23  VAL   7          HG22      VAL   7 -12.555 -13.425   6.412
    9   HG22  VAL   7          HG23      VAL   7 -12.089 -14.685   5.272

  No H/Q in entry =           9
  In of MODEL   59
    1    H    VAL   8           H        VAL   8 -11.439 -11.199   1.955
    2    HA   VAL   8           HA       VAL   8  -9.347  -9.356   2.436
    3    HB   VAL   8           HB       VAL   8 -10.829 -10.143  -0.073
    4   HG11  VAL   8          HG11      VAL   8  -8.658  -8.088   0.345
    5   HG13  VAL   8          HG12      VAL   8 -10.150  -7.937  -0.586
    6   HG12  VAL   8          HG13      VAL   8  -8.829  -8.934  -1.193
    7   HG22  VAL   8          HG21      VAL   8  -9.348 -11.874   0.023
    8   HG21  VAL   8          HG22      VAL   8  -8.568 -11.167   1.434
    9   HG23  VAL   8          HG23      VAL   8  -8.039 -10.706  -0.181

  No H/Q in entry =           9
  In of MODEL   59
    1    H    MET   9           H        MET   9 -12.698  -8.917   1.311
    2    HA   MET   9           HA       MET   9 -12.603  -6.140   0.888
    3    HB2  MET   9           HB2      MET   9 -14.827  -8.002   1.714
    4    HB3  MET   9           HB3      MET   9 -15.096  -6.266   1.543
    5    HG2  MET   9           HG2      MET   9 -14.242  -6.378  -0.783
    6    HG3  MET   9           HG3      MET   9 -14.036  -8.121  -0.608
    7    HE1  MET   9           HE1      MET   9 -16.311  -5.218  -0.038
    8    HE3  MET   9           HE2      MET   9 -17.894  -5.681  -0.654
    9    HE2  MET   9           HE3      MET   9 -16.574  -5.375  -1.780

  No H/Q in entry =           9
  In of MODEL   59
    1    H    GLY  10           H        GLY  10 -13.262  -8.036   3.813
    2    HA3  GLY  10           HA2      GLY  10 -13.765  -5.852   5.547
    3    HA2  GLY  10           HA3      GLY  10 -13.216  -7.451   6.048

  No H/Q in entry =           3
  In of MODEL   59
    1    H    LEU  11           H        LEU  11 -10.786  -7.600   4.709
    2    HA   LEU  11           HA       LEU  11  -9.050  -6.196   6.455
    3    HB2  LEU  11           HB2      LEU  11  -8.547  -7.614   3.837
    4    HB3  LEU  11           HB3      LEU  11  -7.258  -6.930   4.826
    5    HG   LEU  11           HG       LEU  11  -9.275  -8.942   5.853
    6   HD13  LEU  11          HD11      LEU  11  -8.085 -10.187   4.271
    7   HD12  LEU  11          HD12      LEU  11  -7.138 -10.444   5.736
    8   HD11  LEU  11          HD13      LEU  11  -6.595  -9.280   4.528
    9   HD22  LEU  11          HD21      LEU  11  -8.391  -7.949   7.765
   10   HD21  LEU  11          HD22      LEU  11  -6.856  -7.563   6.989
   11   HD23  LEU  11          HD23      LEU  11  -7.197  -9.217   7.495

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  12           H        ILE  12  -9.978  -5.622   3.077
    2    HA   ILE  12           HA       ILE  12  -8.263  -3.411   2.644
    3    HB   ILE  12           HB       ILE  12 -10.938  -4.042   1.371
    4   HG12  ILE  12          HG12      ILE  12  -8.923  -5.720   1.270
    5   HG13  ILE  12          HG13      ILE  12  -9.794  -5.346  -0.202
    6   HG23  ILE  12          HG21      ILE  12 -10.333  -1.722   0.943
    7   HG22  ILE  12          HG22      ILE  12 -10.020  -2.646  -0.522
    8   HG21  ILE  12          HG23      ILE  12  -8.713  -2.197   0.535
    9   HD13  ILE  12          HD11      ILE  12  -8.058  -3.809  -0.884
   10   HD12  ILE  12          HD12      ILE  12  -7.289  -5.326  -0.423
   11   HD11  ILE  12          HD13      ILE  12  -7.253  -3.960   0.666

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  13           H        ILE  13 -11.616  -3.643   3.769
    2    HA   ILE  13           HA       ILE  13 -12.040  -0.852   4.055
    3    HB   ILE  13           HB       ILE  13 -13.261  -3.269   5.406
    4   HG12  ILE  13          HG12      ILE  13 -13.512  -2.676   2.880
    5   HG13  ILE  13          HG13      ILE  13 -14.929  -3.139   3.798
    6   HG23  ILE  13          HG21      ILE  13 -13.668  -1.560   6.987
    7   HG22  ILE  13          HG22      ILE  13 -15.132  -1.581   6.014
    8   HG21  ILE  13          HG23      ILE  13 -13.916  -0.335   5.746
    9   HD13  ILE  13          HD11      ILE  13 -15.750  -0.940   3.901
   10   HD12  ILE  13          HD12      ILE  13 -15.055  -1.037   2.295
   11   HD11  ILE  13          HD13      ILE  13 -14.157  -0.249   3.573

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ASN  14           H        ASN  14 -10.937  -3.365   6.308
    2    HA   ASN  14           HA       ASN  14 -10.695  -1.740   8.599
    3    HB2  ASN  14           HB2      ASN  14 -10.475  -4.348   8.263
    4    HB3  ASN  14           HB3      ASN  14  -8.764  -3.980   8.091
    5   HD21  ASN  14          HD21      ASN  14  -9.396  -5.507  10.266
    6   HD22  ASN  14          HD22      ASN  14  -9.345  -4.593  11.694

  No H/Q in entry =           6
  In of MODEL   59
    1    H    SER  15           H        SER  15  -8.327  -2.579   6.080
    2    HA   SER  15           HA       SER  15  -6.156  -1.115   7.138
    3    HB2  SER  15           HB2      SER  15  -5.159  -1.333   4.970
    4    HB3  SER  15           HB3      SER  15  -6.128  -2.783   5.197
    5    HG   SER  15           HG       SER  15  -6.361  -0.839   3.347

  No H/Q in entry =           5
  In of MODEL   59
    1    H    GLY  16           H        GLY  16  -8.769  -0.210   4.920
    2    HA3  GLY  16           HA2      GLY  16  -7.888   2.424   4.372
    3    HA2  GLY  16           HA3      GLY  16  -9.547   1.847   4.223

  No H/Q in entry =           3
  In of MODEL   59
    1    H    GLN  17           H        GLN  17 -10.072   1.117   6.875
    2    HA   GLN  17           HA       GLN  17 -10.742   3.623   8.033
    3    HB2  GLN  17           HB2      GLN  17 -10.662   0.833   9.196
    4    HB3  GLN  17           HB3      GLN  17 -11.259   2.236  10.085
    5    HG2  GLN  17           HG2      GLN  17 -12.326   1.332   7.394
    6    HG3  GLN  17           HG3      GLN  17 -13.083   0.960   8.942
    7   HE21  GLN  17          HE21      GLN  17 -13.585   2.947   6.443
    8   HE22  GLN  17          HE22      GLN  17 -14.129   4.343   7.243

  No H/Q in entry =           8
  In of MODEL   59
    1    H    ALA  18           H        ALA  18  -8.131   1.313   8.617
    2    HA   ALA  18           HA       ALA  18  -7.000   2.507  10.883
    3    HB2  ALA  18           HB1      ALA  18  -6.425   0.291   9.500
    4    HB3  ALA  18           HB2      ALA  18  -5.244   1.058  10.563
    5    HB1  ALA  18           HB3      ALA  18  -5.181   1.343   8.823

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ARG  19           H        ARG  19  -6.256   3.038   7.429
    2    HA   ARG  19           HA       ARG  19  -4.333   5.065   7.848
    3    HB2  ARG  19           HB2      ARG  19  -4.693   3.937   5.651
    4    HB3  ARG  19           HB3      ARG  19  -6.228   4.793   5.493
    5    HG2  ARG  19           HG2      ARG  19  -5.078   6.953   5.559
    6    HG3  ARG  19           HG3      ARG  19  -3.534   6.152   5.845
    7    HD2  ARG  19           HD2      ARG  19  -3.675   6.753   3.506
    8    HD3  ARG  19           HD3      ARG  19  -3.776   4.993   3.645
    9    HE   ARG  19           HE       ARG  19  -6.401   5.928   3.666
   10   HH21  ARG  19          HH11      ARG  19  -7.612   6.104   1.760
   11   HH22  ARG  19          HH12      ARG  19  -6.804   6.180   0.233
   12   HH11  ARG  19          HH21      ARG  19  -3.644   5.973   1.607
   13   HH12  ARG  19          HH22      ARG  19  -4.556   6.104   0.146

  No H/Q in entry =          13
  In of MODEL   59
    1    H    SER  20           H        SER  20  -7.836   5.216   7.282
    2    HA   SER  20           HA       SER  20  -8.167   7.975   7.248
    3    HB2  SER  20           HB2      SER  20  -9.948   6.252   6.810
    4    HB3  SER  20           HB3      SER  20 -10.063   6.017   8.552
    5    HG   SER  20           HG       SER  20 -11.479   7.656   7.393

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LEU  21           H        LEU  21  -8.161   5.780  10.043
    2    HA   LEU  21           HA       LEU  21  -8.565   7.772  12.020
    3    HB2  LEU  21           HB2      LEU  21  -7.237   5.057  12.155
    4    HB3  LEU  21           HB3      LEU  21  -7.521   6.071  13.567
    5    HG   LEU  21           HG       LEU  21  -9.717   5.195  11.667
    6   HD13  LEU  21          HD11      LEU  21  -8.972   3.176  12.644
    7   HD12  LEU  21          HD12      LEU  21 -10.305   3.684  13.682
    8   HD11  LEU  21          HD13      LEU  21  -8.638   3.949  14.194
    9   HD21  LEU  21          HD21      LEU  21  -9.616   6.703  14.274
   10   HD23  LEU  21          HD22      LEU  21 -11.040   5.736  13.906
   11   HD22  LEU  21          HD23      LEU  21 -10.576   7.053  12.840

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ALA  22           H        ALA  22  -5.638   6.378  10.580
    2    HA   ALA  22           HA       ALA  22  -3.732   7.668  12.190
    3    HB2  ALA  22           HB1      ALA  22  -3.348   5.818  10.487
    4    HB1  ALA  22           HB2      ALA  22  -2.141   7.103  10.516
    5    HB3  ALA  22           HB3      ALA  22  -3.371   7.075   9.252

  No H/Q in entry =           5
  In of MODEL   59
    1    H    TYR  23           H        TYR  23  -5.070   8.710   9.023
    2    HA   TYR  23           HA       TYR  23  -3.712  11.194   8.951
    3    HB2  TYR  23           HB2      TYR  23  -4.819  10.301   6.965
    4    HB3  TYR  23           HB3      TYR  23  -6.389  10.417   7.761
    5    HD1  TYR  23           HD1      TYR  23  -3.476  12.447   6.607
    6    HD2  TYR  23           HD2      TYR  23  -7.616  12.433   7.748
    7    HE1  TYR  23           HE1      TYR  23  -3.689  14.802   5.860
    8    HE2  TYR  23           HE2      TYR  23  -7.830  14.788   7.000
    9    HH   TYR  23           HH       TYR  23  -5.154  16.451   5.385

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ALA  24           H        ALA  24  -6.827  10.238  10.355
    2    HA   ALA  24           HA       ALA  24  -7.634  12.832  11.144
    3    HB1  ALA  24           HB1      ALA  24  -9.459  11.595  11.623
    4    HB2  ALA  24           HB2      ALA  24  -8.625  11.010  13.061
    5    HB3  ALA  24           HB3      ALA  24  -8.522  10.104  11.553

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ALA  25           H        ALA  25  -5.640  10.350  12.690
    2    HA   ALA  25           HA       ALA  25  -5.268  11.589  15.194
    3    HB2  ALA  25           HB1      ALA  25  -4.529   9.234  14.357
    4    HB3  ALA  25           HB2      ALA  25  -3.496  10.079  15.512
    5    HB1  ALA  25           HB3      ALA  25  -3.076  10.065  13.798

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LEU  26           H        LEU  26  -3.503  11.885  12.139
    2    HA   LEU  26           HA       LEU  26  -1.520  13.684  13.045
    3    HB2  LEU  26           HB2      LEU  26  -1.247  12.539  10.933
    4    HB3  LEU  26           HB3      LEU  26  -2.720  13.262  10.295
    5    HG   LEU  26           HG       LEU  26  -1.685  15.503  10.430
    6   HD12  LEU  26          HD11      LEU  26   0.858  15.498  10.821
    7   HD11  LEU  26          HD12      LEU  26   0.627  13.917  11.561
    8   HD13  LEU  26          HD13      LEU  26  -0.162  15.336  12.251
    9   HD21  LEU  26          HD21      LEU  26   0.027  13.439   9.011
   10   HD23  LEU  26          HD22      LEU  26  -0.004  15.162   8.648
   11   HD22  LEU  26          HD23      LEU  26  -1.438  14.178   8.369

  No H/Q in entry =          11
  In of MODEL   59
    1    H    LYS  27           H        LYS  27  -4.711  14.201  11.598
    2    HA   LYS  27           HA       LYS  27  -4.632  16.990  11.411
    3    HB2  LYS  27           HB2      LYS  27  -6.398  15.533  10.435
    4    HB3  LYS  27           HB3      LYS  27  -7.043  15.275  12.056
    5    HG2  LYS  27           HG2      LYS  27  -7.448  17.684  12.306
    6    HG3  LYS  27           HG3      LYS  27  -6.752  17.982  10.710
    7    HD2  LYS  27           HD2      LYS  27  -8.506  16.567   9.683
    8    HD3  LYS  27           HD3      LYS  27  -9.209  16.287  11.279
    9    HE2  LYS  27           HE2      LYS  27  -9.627  18.702  11.536
   10    HE3  LYS  27           HE3      LYS  27  -8.896  19.003   9.955
   11    HZ3  LYS  27           HZ1      LYS  27 -11.277  18.901   9.735
   12    HZ2  LYS  27           HZ2      LYS  27 -11.332  17.382  10.499
   13    HZ1  LYS  27           HZ3      LYS  27 -10.599  17.544   8.971

  No H/Q in entry =          13
  In of MODEL   59
    1    H    GLN  28           H        GLN  28  -5.515  14.901  14.137
    2    HA   GLN  28           HA       GLN  28  -6.376  16.906  15.930
    3    HB2  GLN  28           HB2      GLN  28  -4.994  14.258  16.448
    4    HB3  GLN  28           HB3      GLN  28  -5.712  15.265  17.707
    5    HG2  GLN  28           HG2      GLN  28  -7.212  14.175  15.308
    6    HG3  GLN  28           HG3      GLN  28  -7.256  13.471  16.924
    7   HE21  GLN  28          HE21      GLN  28  -9.117  15.333  14.987
    8   HE22  GLN  28          HE22      GLN  28  -9.849  16.338  16.142

  No H/Q in entry =           8
  In of MODEL   59
    1    H    ALA  29           H        ALA  29  -3.176  15.580  15.206
    2    HA   ALA  29           HA       ALA  29  -1.706  16.956  17.176
    3    HB1  ALA  29           HB1      ALA  29   0.208  16.249  16.037
    4    HB3  ALA  29           HB2      ALA  29  -0.560  16.388  14.455
    5    HB2  ALA  29           HB3      ALA  29  -0.986  15.055  15.528

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LYS  30           H        LYS  30  -2.585  17.858  13.859
    2    HA   LYS  30           HA       LYS  30  -1.148  20.282  13.755
    3    HB2  LYS  30           HB2      LYS  30  -3.702  19.444  12.366
    4    HB3  LYS  30           HB3      LYS  30  -2.853  20.950  12.021
    5    HG2  LYS  30           HG2      LYS  30  -0.804  19.635  11.483
    6    HG3  LYS  30           HG3      LYS  30  -1.726  18.149  11.730
    7    HD2  LYS  30           HD2      LYS  30  -3.298  18.815   9.953
    8    HD3  LYS  30           HD3      LYS  30  -2.399  20.314   9.708
    9    HE2  LYS  30           HE2      LYS  30  -0.389  18.999   9.104
   10    HE3  LYS  30           HE3      LYS  30  -1.307  17.506   9.318
   11    HZ2  LYS  30           HZ1      LYS  30  -1.142  18.385   6.978
   12    HZ1  LYS  30           HZ2      LYS  30  -2.165  19.658   7.461
   13    HZ3  LYS  30           HZ3      LYS  30  -2.709  18.048   7.531

  No H/Q in entry =          13
  In of MODEL   59
    1    H    GLN  31           H        GLN  31  -4.245  19.463  15.193
    2    HA   GLN  31           HA       GLN  31  -4.969  22.227  15.664
    3    HB2  GLN  31           HB2      GLN  31  -6.167  19.790  16.987
    4    HB3  GLN  31           HB3      GLN  31  -6.909  21.372  16.756
    5    HG2  GLN  31           HG2      GLN  31  -6.233  20.598  14.156
    6    HG3  GLN  31           HG3      GLN  31  -6.770  19.097  14.901
    7   HE21  GLN  31          HE21      GLN  31  -8.180  20.698  12.820
    8   HE22  GLN  31          HE22      GLN  31  -9.682  21.107  13.494

  No H/Q in entry =           8
  In of MODEL   59
    1    H    GLY  32           H        GLY  32  -2.670  20.263  16.953
    2    HA3  GLY  32           HA2      GLY  32  -1.246  20.699  18.744
    3    HA2  GLY  32           HA3      GLY  32  -2.354  21.954  19.284

  No H/Q in entry =           3
  In of MODEL   59
    1    H    ASP  33           H        ASP  33  -3.823  18.937  18.622
    2    HA   ASP  33           HA       ASP  33  -4.212  18.472  21.504
    3    HB2  ASP  33           HB2      ASP  33  -5.656  17.491  19.036
    4    HB3  ASP  33           HB3      ASP  33  -5.994  16.877  20.652

  No H/Q in entry =           4
  In of MODEL   59
    1    H    PHE  34           H        PHE  34  -2.052  17.590  21.785
    2    HA   PHE  34           HA       PHE  34  -1.096  15.334  20.364
    3    HB2  PHE  34           HB2      PHE  34  -0.439  16.297  23.157
    4    HB3  PHE  34           HB3      PHE  34   0.464  15.066  22.275
    5    HD1  PHE  34           HD1      PHE  34   0.346  18.490  23.027
    6    HD2  PHE  34           HD2      PHE  34   1.108  15.791  19.772
    7    HE1  PHE  34           HE1      PHE  34   1.654  20.249  21.869
    8    HE2  PHE  34           HE2      PHE  34   2.411  17.553  18.619
    9    HZ   PHE  34           HZ       PHE  34   2.686  19.779  19.672

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ALA  35           H        ALA  35  -3.104  15.626  23.248
    2    HA   ALA  35           HA       ALA  35  -2.920  12.957  24.130
    3    HB3  ALA  35           HB1      ALA  35  -5.361  13.612  25.014
    4    HB1  ALA  35           HB2      ALA  35  -4.810  15.225  24.561
    5    HB2  ALA  35           HB3      ALA  35  -3.897  14.283  25.738

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ALA  36           H        ALA  36  -5.369  14.517  22.061
    2    HA   ALA  36           HA       ALA  36  -6.822  12.127  21.586
    3    HB1  ALA  36           HB1      ALA  36  -8.267  13.574  20.651
    4    HB3  ALA  36           HB2      ALA  36  -7.101  13.984  19.393
    5    HB2  ALA  36           HB3      ALA  36  -7.099  14.864  20.921

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ALA  37           H        ALA  37  -4.136  13.685  19.899
    2    HA   ALA  37           HA       ALA  37  -4.146  12.061  17.594
    3    HB3  ALA  37           HB1      ALA  37  -2.116  13.738  19.005
    4    HB2  ALA  37           HB2      ALA  37  -2.662  13.809  17.331
    5    HB1  ALA  37           HB3      ALA  37  -1.521  12.561  17.835

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LYS  38           H        LYS  38  -2.364  11.716  20.653
    2    HA   LYS  38           HA       LYS  38  -1.076   9.301  20.140
    3    HB2  LYS  38           HB2      LYS  38  -1.354  11.057  22.297
    4    HB3  LYS  38           HB3      LYS  38  -1.988   9.533  22.912
    5    HG2  LYS  38           HG2      LYS  38   0.086   8.387  22.350
    6    HG3  LYS  38           HG3      LYS  38   0.706   9.828  21.537
    7    HD2  LYS  38           HD2      LYS  38   0.911  11.034  23.576
    8    HD3  LYS  38           HD3      LYS  38  -0.115   9.893  24.448
    9    HE2  LYS  38           HE2      LYS  38   2.242   9.542  25.042
   10    HE3  LYS  38           HE3      LYS  38   1.610   8.139  24.178
   11    HZ3  LYS  38           HZ1      LYS  38   2.899   8.548  22.386
   12    HZ2  LYS  38           HZ2      LYS  38   3.876   9.358  23.517
   13    HZ1  LYS  38           HZ3      LYS  38   2.799  10.237  22.540

  No H/Q in entry =          13
  In of MODEL   59
    1    H    ALA  39           H        ALA  39  -4.294   9.833  21.576
    2    HA   ALA  39           HA       ALA  39  -4.886   7.119  22.073
    3    HB3  ALA  39           HB1      ALA  39  -7.025   9.096  21.337
    4    HB2  ALA  39           HB2      ALA  39  -6.110   9.304  22.830
    5    HB1  ALA  39           HB3      ALA  39  -7.049   7.833  22.568

  No H/Q in entry =           5
  In of MODEL   59
    1    H    MET  40           H        MET  40  -5.471   9.153  19.242
    2    HA   MET  40           HA       MET  40  -6.987   7.249  17.787
    3    HB2  MET  40           HB2      MET  40  -5.354   9.626  16.878
    4    HB3  MET  40           HB3      MET  40  -6.403   8.686  15.813
    5    HG2  MET  40           HG2      MET  40  -7.396   9.937  18.387
    6    HG3  MET  40           HG3      MET  40  -7.457  10.780  16.842
    7    HE3  MET  40           HE1      MET  40 -10.082   9.205  14.795
    8    HE2  MET  40           HE2      MET  40  -8.329   9.299  14.630
    9    HE1  MET  40           HE3      MET  40  -9.222  10.674  15.279

  No H/Q in entry =           9
  In of MODEL   59
    1    H    MET  41           H        MET  41  -3.485   7.939  17.879
    2    HA   MET  41           HA       MET  41  -2.771   6.185  15.763
    3    HB2  MET  41           HB2      MET  41  -1.122   6.818  18.224
    4    HB3  MET  41           HB3      MET  41  -0.527   6.169  16.699
    5    HG2  MET  41           HG2      MET  41  -1.665   8.372  15.717
    6    HG3  MET  41           HG3      MET  41  -1.405   8.948  17.362
    7    HE2  MET  41           HE1      MET  41   1.489   6.811  17.685
    8    HE1  MET  41           HE2      MET  41   0.726   8.110  18.597
    9    HE3  MET  41           HE3      MET  41   2.346   8.335  17.940

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ASP  42           H        ASP  42  -3.128   5.699  19.251
    2    HA   ASP  42           HA       ASP  42  -2.125   3.092  19.389
    3    HB2  ASP  42           HB2      ASP  42  -2.958   4.853  21.228
    4    HB3  ASP  42           HB3      ASP  42  -4.399   3.847  21.164

  No H/Q in entry =           4
  In of MODEL   59
    1    H    GLN  43           H        GLN  43  -5.448   4.241  18.925
    2    HA   GLN  43           HA       GLN  43  -6.627   1.669  18.729
    3    HB2  GLN  43           HB2      GLN  43  -7.526   4.339  17.622
    4    HB3  GLN  43           HB3      GLN  43  -8.508   2.872  17.602
    5    HG2  GLN  43           HG2      GLN  43  -8.193   2.735  20.106
    6    HG3  GLN  43           HG3      GLN  43  -7.448   4.331  20.035
    7   HE21  GLN  43          HE21      GLN  43  -9.612   4.431  21.557
    8   HE22  GLN  43          HE22      GLN  43 -10.973   5.028  20.741

  No H/Q in entry =           8
  In of MODEL   59
    1    H    SER  44           H        SER  44  -5.281   3.878  16.315
    2    HA   SER  44           HA       SER  44  -6.023   2.414  14.026
    3    HB2  SER  44           HB2      SER  44  -4.732   4.779  14.469
    4    HB3  SER  44           HB3      SER  44  -3.396   3.769  13.921
    5    HG   SER  44           HG       SER  44  -4.512   4.763  12.174

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ARG  45           H        ARG  45  -3.127   2.254  16.078
    2    HA   ARG  45           HA       ARG  45  -1.686   0.288  14.672
    3    HB2  ARG  45           HB2      ARG  45  -0.808   1.689  16.540
    4    HB3  ARG  45           HB3      ARG  45  -1.801   0.765  17.665
    5    HG2  ARG  45           HG2      ARG  45  -0.602  -1.306  17.001
    6    HG3  ARG  45           HG3      ARG  45   0.416  -0.358  15.918
    7    HD2  ARG  45           HD2      ARG  45   1.186   1.003  17.873
    8    HD3  ARG  45           HD3      ARG  45   0.260  -0.065  18.950
    9    HE   ARG  45           HE       ARG  45   1.924  -1.675  17.346
   10   HH21  ARG  45          HH11      ARG  45   3.821  -2.526  18.161
   11   HH22  ARG  45          HH12      ARG  45   4.617  -1.756  19.489
   12   HH11  ARG  45          HH21      ARG  45   2.281   0.776  19.745
   13   HH12  ARG  45          HH22      ARG  45   3.744   0.115  20.383

  No H/Q in entry =          13
  In of MODEL   59
    1    H    MET  46           H        MET  46  -4.063  -0.015  17.293
    2    HA   MET  46           HA       MET  46  -3.928  -2.818  17.585
    3    HB2  MET  46           HB2      MET  46  -6.082  -0.798  18.205
    4    HB3  MET  46           HB3      MET  46  -6.278  -2.516  18.563
    5    HG2  MET  46           HG2      MET  46  -4.229  -2.476  19.926
    6    HG3  MET  46           HG3      MET  46  -4.004  -0.772  19.559
    7    HE3  MET  46           HE1      MET  46  -3.971  -1.555  22.540
    8    HE2  MET  46           HE2      MET  46  -5.009  -0.287  23.184
    9    HE1  MET  46           HE3      MET  46  -3.894   0.080  21.873

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ALA  47           H        ALA  47  -5.941  -0.764  15.519
    2    HA   ALA  47           HA       ALA  47  -7.596  -2.787  14.458
    3    HB3  ALA  47           HB1      ALA  47  -8.249  -0.539  14.060
    4    HB1  ALA  47           HB2      ALA  47  -7.783  -1.171  12.481
    5    HB2  ALA  47           HB3      ALA  47  -6.681  -0.121  13.373

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LEU  48           H        LEU  48  -4.469  -1.516  13.385
    2    HA   LEU  48           HA       LEU  48  -4.232  -3.097  11.033
    3    HB2  LEU  48           HB2      LEU  48  -2.141  -1.857  12.829
    4    HB3  LEU  48           HB3      LEU  48  -1.796  -2.574  11.255
    5    HG   LEU  48           HG       LEU  48  -3.785  -0.331  11.674
    6   HD13  LEU  48          HD11      LEU  48  -1.645   0.512  12.325
    7   HD12  LEU  48          HD12      LEU  48  -1.927   1.078  10.679
    8   HD11  LEU  48          HD13      LEU  48  -0.846  -0.285  10.970
    9   HD22  LEU  48          HD21      LEU  48  -4.289  -1.298   9.598
   10   HD21  LEU  48          HD22      LEU  48  -2.615  -1.755   9.285
   11   HD23  LEU  48          HD23      LEU  48  -3.112  -0.068   9.139

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ASN  49           H        ASN  49  -3.161  -3.526  14.368
    2    HA   ASN  49           HA       ASN  49  -1.594  -5.810  14.011
    3    HB2  ASN  49           HB2      ASN  49  -1.595  -4.475  16.065
    4    HB3  ASN  49           HB3      ASN  49  -3.249  -4.963  16.406
    5   HD21  ASN  49          HD21      ASN  49  -2.828  -6.136  18.331
    6   HD22  ASN  49          HD22      ASN  49  -1.880  -7.541  18.370

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLU  50           H        GLU  50  -5.052  -5.488  14.716
    2    HA   GLU  50           HA       GLU  50  -5.605  -8.280  14.815
    3    HB2  GLU  50           HB2      GLU  50  -7.158  -6.575  15.714
    4    HB3  GLU  50           HB3      GLU  50  -7.458  -5.997  14.073
    5    HG2  GLU  50           HG2      GLU  50  -8.361  -8.177  13.432
    6    HG3  GLU  50           HG3      GLU  50  -7.975  -8.835  15.018

  No H/Q in entry =           6
  In of MODEL   59
    1    H    ALA  51           H        ALA  51  -5.661  -5.868  12.232
    2    HA   ALA  51           HA       ALA  51  -6.690  -7.570  10.210
    3    HB2  ALA  51           HB1      ALA  51  -6.455  -5.754   8.848
    4    HB1  ALA  51           HB2      ALA  51  -4.806  -5.432   9.384
    5    HB3  ALA  51           HB3      ALA  51  -6.172  -4.905  10.367

  No H/Q in entry =           5
  In of MODEL   59
    1    H    HIS  52           H        HIS  52  -3.377  -6.719  11.168
    2    HA   HIS  52           HA       HIS  52  -2.019  -8.219   9.199
    3    HB2  HIS  52           HB2      HIS  52  -0.941  -6.511  10.631
    4    HB3  HIS  52           HB3      HIS  52  -1.124  -7.581  12.020
    5    HD1  HIS  52           HD1      HIS  52   0.151  -9.954  11.824
    6    HD2  HIS  52           HD2      HIS  52   1.303  -7.043   9.069
    7    HE1  HIS  52           HE1      HIS  52   2.368 -10.712  10.864
    8    HE2  HIS  52           HE2      HIS  52   3.083  -8.949   9.182

  No H/Q in entry =           8
  In of MODEL   59
    1    H    LEU  53           H        LEU  53  -3.216  -9.094  12.417
    2    HA   LEU  53           HA       LEU  53  -2.057 -11.658  12.587
    3    HB2  LEU  53           HB2      LEU  53  -4.514 -10.446  13.830
    4    HB3  LEU  53           HB3      LEU  53  -4.075 -12.129  14.110
    5    HG   LEU  53           HG       LEU  53  -2.125  -9.850  14.569
    6   HD11  LEU  53          HD11      LEU  53  -4.189 -11.065  16.410
    7   HD13  LEU  53          HD12      LEU  53  -3.891  -9.360  16.075
    8   HD12  LEU  53          HD13      LEU  53  -2.739 -10.285  17.032
    9   HD23  LEU  53          HD21      LEU  53  -1.276 -11.661  16.258
   10   HD22  LEU  53          HD22      LEU  53  -0.908 -11.868  14.550
   11   HD21  LEU  53          HD23      LEU  53  -2.206 -12.791  15.282

  No H/Q in entry =          11
  In of MODEL   59
    1    H    VAL  54           H        VAL  54  -5.163 -10.572  11.258
    2    HA   VAL  54           HA       VAL  54  -6.125 -13.147  10.566
    3    HB   VAL  54           HB       VAL  54  -6.738 -10.398   9.452
    4   HG12  VAL  54          HG11      VAL  54  -8.869 -11.737   8.652
    5   HG11  VAL  54          HG12      VAL  54  -7.779 -13.121   8.707
    6   HG13  VAL  54          HG13      VAL  54  -7.406 -11.747   7.669
    7   HG22  VAL  54          HG21      VAL  54  -7.626 -10.432  11.611
    8   HG21  VAL  54          HG22      VAL  54  -7.909 -12.171  11.585
    9   HG23  VAL  54          HG23      VAL  54  -8.980 -11.092  10.694

  No H/Q in entry =           9
  In of MODEL   59
    1    H    GLN  55           H        GLN  55  -4.230 -10.717   8.773
    2    HA   GLN  55           HA       GLN  55  -4.145 -12.170   6.347
    3    HB2  GLN  55           HB2      GLN  55  -3.505  -9.915   6.163
    4    HB3  GLN  55           HB3      GLN  55  -2.384 -10.018   7.518
    5    HG2  GLN  55           HG2      GLN  55  -0.692 -10.885   6.222
    6    HG3  GLN  55           HG3      GLN  55  -1.791 -11.837   5.232
    7   HE21  GLN  55          HE21      GLN  55  -1.815 -11.135   3.115
    8   HE22  GLN  55          HE22      GLN  55  -1.595  -9.532   2.611

  No H/Q in entry =           8
  In of MODEL   59
    1    H    THR  56           H        THR  56  -2.014 -12.200   9.209
    2    HA   THR  56           HA       THR  56   0.029 -13.829   8.264
    3    HB   THR  56           HB       THR  56  -1.192 -14.075  11.022
    4    HG1  THR  56           HG1      THR  56  -0.450 -11.893   9.945
    5   HG21  THR  56          HG21      THR  56   1.508 -14.634   9.802
    6   HG23  THR  56          HG22      THR  56   0.490 -15.712  10.759
    7   HG22  THR  56          HG23      THR  56   1.324 -14.365  11.535

  No H/Q in entry =           7
  In of MODEL   59
    1    H    LYS  57           H        LYS  57  -3.096 -14.819   9.650
    2    HA   LYS  57           HA       LYS  57  -2.700 -17.621   9.386
    3    HB2  LYS  57           HB2      LYS  57  -4.487 -16.513  10.755
    4    HB3  LYS  57           HB3      LYS  57  -5.283 -16.031   9.264
    5    HG2  LYS  57           HG2      LYS  57  -5.564 -18.387   8.630
    6    HG3  LYS  57           HG3      LYS  57  -4.740 -18.894  10.103
    7    HD2  LYS  57           HD2      LYS  57  -6.515 -17.818  11.458
    8    HD3  LYS  57           HD3      LYS  57  -7.350 -17.343   9.980
    9    HE2  LYS  57           HE2      LYS  57  -7.561 -19.739   9.347
   10    HE3  LYS  57           HE3      LYS  57  -6.768 -20.207  10.849
   11    HZ3  LYS  57           HZ1      LYS  57  -8.627 -19.891  11.997
   12    HZ2  LYS  57           HZ2      LYS  57  -9.433 -19.845  10.502
   13    HZ1  LYS  57           HZ3      LYS  57  -8.953 -18.400  11.254

  No H/Q in entry =          13
  In of MODEL   59
    1    H    LEU  58           H        LEU  58  -4.008 -15.144   7.235
    2    HA   LEU  58           HA       LEU  58  -4.860 -16.945   5.226
    3    HB2  LEU  58           HB2      LEU  58  -4.204 -14.007   5.101
    4    HB3  LEU  58           HB3      LEU  58  -4.895 -14.925   3.762
    5    HG   LEU  58           HG       LEU  58  -6.147 -14.738   6.521
    6   HD11  LEU  58          HD11      LEU  58  -6.441 -13.073   4.041
    7   HD13  LEU  58          HD12      LEU  58  -6.407 -12.574   5.732
    8   HD12  LEU  58          HD13      LEU  58  -7.849 -13.339   5.069
    9   HD22  LEU  58          HD21      LEU  58  -7.150 -16.625   5.651
   10   HD21  LEU  58          HD22      LEU  58  -6.818 -16.171   3.979
   11   HD23  LEU  58          HD23      LEU  58  -8.161 -15.426   4.846

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  59           H        ILE  59  -1.696 -15.793   6.066
    2    HA   ILE  59           HA       ILE  59  -0.634 -16.525   3.416
    3    HB   ILE  59           HB       ILE  59   0.183 -14.481   4.989
    4   HG12  ILE  59          HG12      ILE  59   2.224 -16.167   3.521
    5   HG13  ILE  59          HG13      ILE  59   1.047 -15.182   2.692
    6   HG22  ILE  59          HG21      ILE  59   2.242 -16.566   5.657
    7   HG21  ILE  59          HG22      ILE  59   0.899 -16.282   6.741
    8   HG23  ILE  59          HG23      ILE  59   2.030 -14.983   6.366
    9   HD11  ILE  59          HD11      ILE  59   1.859 -13.182   3.901
   10   HD13  ILE  59          HD12      ILE  59   3.138 -13.934   2.952
   11   HD12  ILE  59          HD13      ILE  59   3.072 -14.181   4.696

  No H/Q in entry =          11
  In of MODEL   59
    1    H    GLU  60           H        GLU  60  -0.635 -17.649   6.778
    2    HA   GLU  60           HA       GLU  60   1.359 -19.660   6.486
    3    HB2  GLU  60           HB2      GLU  60   0.813 -20.280   8.637
    4    HB3  GLU  60           HB3      GLU  60   0.124 -18.658   8.617
    5    HG2  GLU  60           HG2      GLU  60  -2.067 -19.725   7.871
    6    HG3  GLU  60           HG3      GLU  60  -1.331 -21.285   8.232

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLY  61           H        GLY  61  -2.157 -19.695   6.030
    2    HA3  GLY  61           HA2      GLY  61  -1.966 -22.486   5.055
    3    HA2  GLY  61           HA3      GLY  61  -3.433 -21.728   5.665

  No H/Q in entry =           3
  In of MODEL   59
    1    H    ASP  62           H        ASP  62  -1.196 -20.175   3.451
    2    HA   ASP  62           HA       ASP  62  -3.214 -19.422   1.635
    3    HB2  ASP  62           HB2      ASP  62  -1.320 -18.707   0.211
    4    HB3  ASP  62           HB3      ASP  62  -1.133 -18.175   1.879

  No H/Q in entry =           4
  In of MODEL   59
    1    H    ALA  63           H        ALA  63  -1.001 -22.206   1.627
    2    HA   ALA  63           HA       ALA  63  -1.958 -23.055  -1.020
    3    HB2  ALA  63           HB1      ALA  63  -0.317 -24.825  -0.839
    4    HB1  ALA  63           HB2      ALA  63  -0.003 -24.398   0.842
    5    HB3  ALA  63           HB3      ALA  63   0.439 -23.280  -0.448

  No H/Q in entry =           5
  In of MODEL   59
    1    H    GLY  64           H        GLY  64  -2.479 -25.495  -1.128
    2    HA3  GLY  64           HA2      GLY  64  -3.497 -27.413  -0.113
    3    HA2  GLY  64           HA3      GLY  64  -4.063 -26.383   1.191

  No H/Q in entry =           3
  In of MODEL   59
    1    H    GLU  65           H        GLU  65  -4.818 -24.417  -1.142
    2    HA   GLU  65           HA       GLU  65  -7.557 -25.094  -1.162
    3    HB2  GLU  65           HB2      GLU  65  -5.985 -23.167  -2.871
    4    HB3  GLU  65           HB3      GLU  65  -7.745 -23.296  -2.893
    5    HG2  GLU  65           HG2      GLU  65  -7.856 -22.758  -0.517
    6    HG3  GLU  65           HG3      GLU  65  -6.098 -22.736  -0.412

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLY  66           H        GLY  66  -5.017 -25.589  -3.489
    2    HA3  GLY  66           HA2      GLY  66  -6.329 -27.780  -4.752
    3    HA2  GLY  66           HA3      GLY  66  -6.338 -26.355  -5.772

  No H/Q in entry =           3
  In of MODEL   59
    1    H    LYS  67           H        LYS  67  -4.419 -25.587  -6.636
    2    HA   LYS  67           HA       LYS  67  -2.382 -27.627  -6.980
    3    HB2  LYS  67           HB2      LYS  67  -2.961 -25.035  -8.404
    4    HB3  LYS  67           HB3      LYS  67  -1.605 -26.093  -8.811
    5    HG2  LYS  67           HG2      LYS  67  -3.155 -27.968  -9.173
    6    HG3  LYS  67           HG3      LYS  67  -4.518 -26.938  -8.742
    7    HD2  LYS  67           HD2      LYS  67  -4.014 -25.468 -10.661
    8    HD3  LYS  67           HD3      LYS  67  -2.655 -26.507 -11.095
    9    HE2  LYS  67           HE2      LYS  67  -4.195 -28.413 -11.381
   10    HE3  LYS  67           HE3      LYS  67  -5.555 -27.382 -10.943
   11    HZ3  LYS  67           HZ1      LYS  67  -5.692 -26.808 -13.060
   12    HZ2  LYS  67           HZ2      LYS  67  -4.285 -27.676 -13.449
   13    HZ1  LYS  67           HZ3      LYS  67  -4.176 -26.058 -12.941

  No H/Q in entry =          13
  In of MODEL   59
    1    H    MET  68           H        MET  68  -0.191 -26.338  -7.679
    2    HA   MET  68           HA       MET  68   1.142 -25.847  -5.239
    3    HB2  MET  68           HB2      MET  68   2.005 -25.340  -8.089
    4    HB3  MET  68           HB3      MET  68   3.076 -25.325  -6.687
    5    HG2  MET  68           HG2      MET  68   1.683 -27.721  -6.427
    6    HG3  MET  68           HG3      MET  68   1.987 -27.600  -8.162
    7    HE2  MET  68           HE1      MET  68   4.687 -27.669  -4.610
    8    HE1  MET  68           HE2      MET  68   3.248 -26.694  -4.900
    9    HE3  MET  68           HE3      MET  68   4.830 -26.078  -5.372

  No H/Q in entry =           9
  In of MODEL   59
    1    H    LYS  69           H        LYS  69  -0.797 -23.727  -6.985
    2    HA   LYS  69           HA       LYS  69   0.750 -21.344  -6.514
    3    HB2  LYS  69           HB2      LYS  69  -2.096 -21.542  -7.467
    4    HB3  LYS  69           HB3      LYS  69  -1.038 -20.130  -7.562
    5    HG2  LYS  69           HG2      LYS  69  -0.387 -22.806  -8.822
    6    HG3  LYS  69           HG3      LYS  69  -1.138 -21.470  -9.694
    7    HD2  LYS  69           HD2      LYS  69   0.871 -20.069  -8.818
    8    HD3  LYS  69           HD3      LYS  69   1.630 -21.635  -8.526
    9    HE2  LYS  69           HE2      LYS  69   2.318 -21.196 -10.713
   10    HE3  LYS  69           HE3      LYS  69   0.860 -22.149 -10.987
   11    HZ2  LYS  69           HZ1      LYS  69   1.119 -19.196 -11.067
   12    HZ1  LYS  69           HZ2      LYS  69  -0.372 -20.011 -11.101
   13    HZ3  LYS  69           HZ3      LYS  69   0.749 -20.231 -12.358

  No H/Q in entry =          13
  In of MODEL   59
    1    H    VAL  70           H        VAL  70  -0.829 -19.361  -5.772
    2    HA   VAL  70           HA       VAL  70  -1.919 -20.063  -3.107
    3    HB   VAL  70           HB       VAL  70  -0.904 -17.971  -2.235
    4   HG13  VAL  70          HG11      VAL  70   1.388 -18.792  -2.113
    5   HG12  VAL  70          HG12      VAL  70   1.135 -19.790  -3.546
    6   HG11  VAL  70          HG13      VAL  70   0.279 -20.162  -2.049
    7   HG21  VAL  70          HG21      VAL  70   0.092 -17.786  -5.083
    8   HG23  VAL  70          HG22      VAL  70   1.021 -17.060  -3.773
    9   HG22  VAL  70          HG23      VAL  70  -0.628 -16.525  -4.079

  No H/Q in entry =           9
  In of MODEL   59
    1    H    SER  71           H        SER  71  -3.319 -18.343  -2.238
    2    HA   SER  71           HA       SER  71  -5.359 -17.570  -4.037
    3    HB2  SER  71           HB2      SER  71  -5.588 -17.855  -1.514
    4    HB3  SER  71           HB3      SER  71  -4.776 -16.303  -1.340
    5    HG   SER  71           HG       SER  71  -6.832 -16.319  -3.164

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LEU  72           H        LEU  72  -5.473 -15.942  -5.386
    2    HA   LEU  72           HA       LEU  72  -3.340 -14.162  -5.878
    3    HB2  LEU  72           HB2      LEU  72  -6.186 -14.313  -6.827
    4    HB3  LEU  72           HB3      LEU  72  -5.133 -12.983  -7.299
    5    HG   LEU  72           HG       LEU  72  -4.421 -15.912  -7.684
    6   HD11  LEU  72          HD11      LEU  72  -6.449 -14.899  -8.998
    7   HD13  LEU  72          HD12      LEU  72  -5.211 -15.787  -9.886
    8   HD12  LEU  72          HD13      LEU  72  -5.205 -14.024  -9.890
    9   HD23  LEU  72          HD21      LEU  72  -2.936 -14.648  -9.491
   10   HD22  LEU  72          HD22      LEU  72  -2.371 -14.780  -7.833
   11   HD21  LEU  72          HD23      LEU  72  -3.129 -13.290  -8.386

  No H/Q in entry =          11
  In of MODEL   59
    1    H    VAL  73           H        VAL  73  -6.411 -13.764  -4.216
    2    HA   VAL  73           HA       VAL  73  -6.408 -10.995  -3.849
    3    HB   VAL  73           HB       VAL  73  -8.134 -11.326  -2.294
    4   HG11  VAL  73          HG11      VAL  73  -8.437 -12.278  -4.673
    5   HG13  VAL  73          HG12      VAL  73  -9.591 -12.794  -3.443
    6   HG12  VAL  73          HG13      VAL  73  -8.274 -13.865  -3.919
    7   HG23  VAL  73          HG21      VAL  73  -8.462 -13.673  -1.290
    8   HG22  VAL  73          HG22      VAL  73  -7.125 -12.717  -0.650
    9   HG21  VAL  73          HG23      VAL  73  -6.812 -14.003  -1.816

  No H/Q in entry =           9
  In of MODEL   59
    1    H    LEU  74           H        LEU  74  -4.493 -13.403  -2.298
    2    HA   LEU  74           HA       LEU  74  -4.039 -12.284   0.227
    3    HB2  LEU  74           HB2      LEU  74  -3.298 -14.513  -0.296
    4    HB3  LEU  74           HB3      LEU  74  -2.242 -13.907  -1.572
    5    HG   LEU  74           HG       LEU  74  -0.907 -12.686   0.115
    6   HD11  LEU  74          HD11      LEU  74  -2.981 -13.876   1.965
    7   HD13  LEU  74          HD12      LEU  74  -2.454 -12.195   1.852
    8   HD12  LEU  74          HD13      LEU  74  -1.383 -13.411   2.549
    9   HD23  LEU  74          HD21      LEU  74  -1.151 -15.452   1.183
   10   HD22  LEU  74          HD22      LEU  74   0.266 -14.542   0.708
   11   HD21  LEU  74          HD23      LEU  74  -0.752 -15.254  -0.523

  No H/Q in entry =          11
  In of MODEL   59
    1    H    VAL  75           H        VAL  75  -2.171 -11.904  -2.746
    2    HA   VAL  75           HA       VAL  75  -0.333 -10.015  -1.742
    3    HB   VAL  75           HB       VAL  75  -1.323 -10.476  -4.557
    4   HG13  VAL  75          HG11      VAL  75  -0.442  -8.187  -4.379
    5   HG12  VAL  75          HG12      VAL  75   0.751  -9.195  -5.181
    6   HG11  VAL  75          HG13      VAL  75   0.960  -8.771  -3.490
    7   HG23  VAL  75          HG21      VAL  75   0.890 -11.604  -4.759
    8   HG22  VAL  75          HG22      VAL  75  -0.128 -12.369  -3.538
    9   HG21  VAL  75          HG23      VAL  75   1.185 -11.298  -3.045

  No H/Q in entry =           9
  In of MODEL   59
    1    H    GLU  76           H        GLU  76  -3.493  -9.607  -3.367
    2    HA   GLU  76           HA       GLU  76  -3.500  -6.791  -3.451
    3    HB2  GLU  76           HB2      GLU  76  -5.193  -8.198  -4.605
    4    HB3  GLU  76           HB3      GLU  76  -5.841  -8.691  -3.048
    5    HG2  GLU  76           HG2      GLU  76  -7.274  -6.952  -3.898
    6    HG3  GLU  76           HG3      GLU  76  -6.361  -6.253  -2.575

  No H/Q in entry =           6
  In of MODEL   59
    1    H    ALA  77           H        ALA  77  -4.622  -9.016  -0.914
    2    HA   ALA  77           HA       ALA  77  -5.528  -7.009   0.866
    3    HB2  ALA  77           HB1      ALA  77  -5.302  -8.786   2.609
    4    HB1  ALA  77           HB2      ALA  77  -4.515  -9.811   1.409
    5    HB3  ALA  77           HB3      ALA  77  -6.193  -9.317   1.184

  No H/Q in entry =           5
  In of MODEL   59
    1    H    GLN  78           H        GLN  78  -2.410  -8.608   0.461
    2    HA   GLN  78           HA       GLN  78  -1.111  -7.482   2.705
    3    HB2  GLN  78           HB2      GLN  78  -0.294  -9.429   1.334
    4    HB3  GLN  78           HB3      GLN  78   0.143  -8.285   0.067
    5    HG2  GLN  78           HG2      GLN  78   1.643  -7.119   1.631
    6    HG3  GLN  78           HG3      GLN  78   1.206  -8.253   2.906
    7   HE21  GLN  78          HE21      GLN  78   3.923  -8.008   2.004
    8   HE22  GLN  78          HE22      GLN  78   4.352  -9.453   1.223

  No H/Q in entry =           8
  In of MODEL   59
    1    H    LEU  79           H        LEU  79  -1.493  -6.395  -0.631
    2    HA   LEU  79           HA       LEU  79   0.231  -4.197  -0.622
    3    HB2  LEU  79           HB2      LEU  79  -0.830  -4.974  -2.670
    4    HB3  LEU  79           HB3      LEU  79  -2.420  -4.558  -2.043
    5    HG   LEU  79           HG       LEU  79  -1.835  -2.181  -2.009
    6   HD13  LEU  79          HD11      LEU  79   0.414  -1.979  -1.517
    7   HD12  LEU  79          HD12      LEU  79   0.450  -1.682  -3.255
    8   HD11  LEU  79          HD13      LEU  79   0.884  -3.271  -2.623
    9   HD23  LEU  79          HD21      LEU  79  -1.223  -1.978  -4.566
   10   HD22  LEU  79          HD22      LEU  79  -2.757  -2.702  -4.096
   11   HD21  LEU  79          HD23      LEU  79  -1.407  -3.732  -4.560

  No H/Q in entry =          11
  In of MODEL   59
    1    H    HIS  80           H        HIS  80  -3.230  -4.304   0.238
    2    HA   HIS  80           HA       HIS  80  -3.367  -1.549   0.919
    3    HB2  HIS  80           HB2      HIS  80  -5.107  -3.930   1.241
    4    HB3  HIS  80           HB3      HIS  80  -5.393  -2.591   2.356
    5    HD1  HIS  80           HD1      HIS  80  -6.990  -0.921   1.474
    6    HD2  HIS  80           HD2      HIS  80  -4.860  -2.753  -1.606
    7    HE1  HIS  80           HE1      HIS  80  -7.834   0.104  -0.690
    8    HE2  HIS  80           HE2      HIS  80  -6.542  -1.007  -2.577

  No H/Q in entry =           8
  In of MODEL   59
    1    H    LEU  81           H        LEU  81  -2.909  -4.464   2.891
    2    HA   LEU  81           HA       LEU  81  -2.848  -3.132   5.383
    3    HB2  LEU  81           HB2      LEU  81  -1.685  -5.765   4.476
    4    HB3  LEU  81           HB3      LEU  81  -1.633  -5.216   6.152
    5    HG   LEU  81           HG       LEU  81  -4.199  -5.414   4.549
    6   HD12  LEU  81          HD11      LEU  81  -4.523  -7.483   6.087
    7   HD11  LEU  81          HD12      LEU  81  -2.768  -7.444   6.256
    8   HD13  LEU  81          HD13      LEU  81  -3.496  -7.653   4.663
    9   HD23  LEU  81          HD21      LEU  81  -5.020  -5.617   7.057
   10   HD22  LEU  81          HD22      LEU  81  -4.674  -4.030   6.373
   11   HD21  LEU  81          HD23      LEU  81  -3.491  -4.818   7.417

  No H/Q in entry =          11
  In of MODEL   59
    1    H    MET  82           H        MET  82  -0.206  -4.071   3.180
    2    HA   MET  82           HA       MET  82   1.910  -3.224   4.848
    3    HB2  MET  82           HB2      MET  82   1.659  -3.544   1.856
    4    HB3  MET  82           HB3      MET  82   3.159  -3.005   2.608
    5    HG2  MET  82           HG2      MET  82   1.712  -5.573   3.331
    6    HG3  MET  82           HG3      MET  82   3.074  -5.481   2.218
    7    HE3  MET  82           HE1      MET  82   6.122  -4.812   4.175
    8    HE2  MET  82           HE2      MET  82   5.219  -3.424   3.575
    9    HE1  MET  82           HE3      MET  82   5.271  -4.910   2.629

  No H/Q in entry =           9
  In of MODEL   59
    1    H    THR  83           H        THR  83   0.093  -1.534   2.319
    2    HA   THR  83           HA       THR  83   1.550   0.887   2.405
    3    HB   THR  83           HB       THR  83  -0.618   1.858   1.447
    4    HG1  THR  83           HG1      THR  83  -2.293   0.592   1.349
    5   HG22  THR  83          HG21      THR  83  -0.401   0.047  -0.567
    6   HG21  THR  83          HG22      THR  83   1.102  -0.278   0.293
    7   HG23  THR  83          HG23      THR  83   0.765   1.345  -0.309

  No H/Q in entry =           7
  In of MODEL   59
    1    H    SER  84           H        SER  84  -1.458  -0.099   4.031
    2    HA   SER  84           HA       SER  84  -1.895   2.332   5.394
    3    HB2  SER  84           HB2      SER  84  -2.775  -0.493   5.951
    4    HB3  SER  84           HB3      SER  84  -3.233   0.850   6.997
    5    HG   SER  84           HG       SER  84  -3.726   0.562   4.207

  No H/Q in entry =           5
  In of MODEL   59
    1    H    MET  85           H        MET  85  -0.229  -0.638   6.490
    2    HA   MET  85           HA       MET  85   0.334   0.263   9.094
    3    HB2  MET  85           HB2      MET  85   0.575  -2.081   8.406
    4    HB3  MET  85           HB3      MET  85   1.950  -1.640   7.392
    5    HG2  MET  85           HG2      MET  85   3.166  -0.828   9.380
    6    HG3  MET  85           HG3      MET  85   1.788  -1.250  10.396
    7    HE3  MET  85           HE1      MET  85   4.987  -2.995  10.873
    8    HE2  MET  85           HE2      MET  85   3.739  -3.804  11.819
    9    HE1  MET  85           HE3      MET  85   3.680  -2.058  11.605

  No H/Q in entry =           9
  In of MODEL   59
    1    H    LEU  86           H        LEU  86   2.243   0.500   6.125
    2    HA   LEU  86           HA       LEU  86   4.493   1.762   7.265
    3    HB2  LEU  86           HB2      LEU  86   4.258   0.696   4.952
    4    HB3  LEU  86           HB3      LEU  86   3.473   2.196   4.456
    5    HG   LEU  86           HG       LEU  86   5.534   3.398   5.423
    6   HD11  LEU  86          HD11      LEU  86   6.198   0.769   6.201
    7   HD13  LEU  86          HD12      LEU  86   7.230   2.194   6.296
    8   HD12  LEU  86          HD13      LEU  86   7.304   1.152   4.878
    9   HD23  LEU  86          HD21      LEU  86   6.194   1.635   3.055
   10   HD22  LEU  86          HD22      LEU  86   6.622   3.323   3.323
   11   HD21  LEU  86          HD23      LEU  86   4.957   2.889   2.938

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ALA  87           H        ALA  87   1.589   3.069   5.717
    2    HA   ALA  87           HA       ALA  87   2.236   5.787   5.810
    3    HB1  ALA  87           HB1      ALA  87  -0.109   4.207   5.283
    4    HB3  ALA  87           HB2      ALA  87   0.228   5.864   4.789
    5    HB2  ALA  87           HB3      ALA  87  -0.556   5.549   6.339

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ARG  88           H        ARG  88   0.533   3.804   8.206
    2    HA   ARG  88           HA       ARG  88   0.079   5.853  10.069
    3    HB2  ARG  88           HB2      ARG  88  -0.903   3.518  10.132
    4    HB3  ARG  88           HB3      ARG  88   0.635   2.985  10.820
    5    HG2  ARG  88           HG2      ARG  88   0.214   5.059  12.456
    6    HG3  ARG  88           HG3      ARG  88  -1.463   4.768  12.015
    7    HD2  ARG  88           HD2      ARG  88  -1.593   2.914  13.252
    8    HD3  ARG  88           HD3      ARG  88  -0.020   2.305  12.702
    9    HE   ARG  88           HE       ARG  88  -0.505   3.565  15.168
   10   HH21  ARG  88          HH11      ARG  88   1.084   4.540  16.396
   11   HH22  ARG  88          HH12      ARG  88   2.604   4.942  15.678
   12   HH11  ARG  88          HH21      ARG  88   1.752   3.717  12.569
   13   HH12  ARG  88          HH22      ARG  88   2.991   4.460  13.523

  No H/Q in entry =          13
  In of MODEL   59
    1    H    GLU  89           H        GLU  89   2.830   3.583   9.805
    2    HA   GLU  89           HA       GLU  89   4.132   4.435  12.141
    3    HB2  GLU  89           HB2      GLU  89   4.739   2.412  10.780
    4    HB3  GLU  89           HB3      GLU  89   5.524   3.497   9.631
    5    HG2  GLU  89           HG2      GLU  89   7.042   4.307  11.364
    6    HG3  GLU  89           HG3      GLU  89   6.202   3.359  12.588

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LEU  90           H        LEU  90   4.437   5.605   8.816
    2    HA   LEU  90           HA       LEU  90   6.410   7.566   9.393
    3    HB2  LEU  90           HB2      LEU  90   4.376   7.284   7.184
    4    HB3  LEU  90           HB3      LEU  90   5.630   8.531   7.200
    5    HG   LEU  90           HG       LEU  90   6.253   5.581   7.511
    6   HD12  LEU  90          HD11      LEU  90   6.981   5.814   5.065
    7   HD11  LEU  90          HD12      LEU  90   5.992   7.273   5.035
    8   HD13  LEU  90          HD13      LEU  90   5.246   5.712   5.376
    9   HD22  LEU  90          HD21      LEU  90   8.177   6.692   8.180
   10   HD21  LEU  90          HD22      LEU  90   7.843   8.108   7.184
   11   HD23  LEU  90          HD23      LEU  90   8.469   6.636   6.443

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  91           H        ILE  91   2.871   7.647   9.280
    2    HA   ILE  91           HA       ILE  91   2.583  10.422   9.749
    3    HB   ILE  91           HB       ILE  91   0.755   8.076  10.297
    4   HG12  ILE  91          HG12      ILE  91   0.528  10.373   8.327
    5   HG13  ILE  91          HG13      ILE  91   1.357   8.865   7.938
    6   HG22  ILE  91          HG21      ILE  91  -0.939  10.165  10.389
    7   HG21  ILE  91          HG22      ILE  91   0.484  10.966  11.052
    8   HG23  ILE  91          HG23      ILE  91  -0.171   9.536  11.847
    9   HD13  ILE  91          HD11      ILE  91  -0.609   7.613   7.995
   10   HD12  ILE  91          HD12      ILE  91  -1.178   9.142   7.328
   11   HD11  ILE  91          HD13      ILE  91  -1.438   8.773   9.033

  No H/Q in entry =          11
  In of MODEL   59
    1    H    THR  92           H        THR  92   2.960   7.662  11.931
    2    HA   THR  92           HA       THR  92   2.565   9.030  14.367
    3    HB   THR  92           HB       THR  92   4.325   6.668  13.672
    4    HG1  THR  92           HG1      THR  92   2.342   5.946  13.587
    5   HG22  THR  92          HG21      THR  92   3.963   6.376  16.308
    6   HG21  THR  92          HG22      THR  92   3.928   8.137  16.244
    7   HG23  THR  92          HG23      THR  92   5.340   7.259  15.653

  No H/Q in entry =           7
  In of MODEL   59
    1    H    GLU  93           H        GLU  93   5.488   8.541  12.402
    2    HA   GLU  93           HA       GLU  93   7.283   9.928  14.088
    3    HB2  GLU  93           HB2      GLU  93   7.336   9.628  11.071
    4    HB3  GLU  93           HB3      GLU  93   8.696  10.129  12.075
    5    HG2  GLU  93           HG2      GLU  93   7.245   7.515  12.523
    6    HG3  GLU  93           HG3      GLU  93   8.621   7.649  11.434

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LEU  94           H        LEU  94   5.225  10.992  11.401
    2    HA   LEU  94           HA       LEU  94   6.075  13.682  11.307
    3    HB2  LEU  94           HB2      LEU  94   3.455  12.365  10.571
    4    HB3  LEU  94           HB3      LEU  94   3.740  14.089  10.336
    5    HG   LEU  94           HG       LEU  94   5.713  12.073   9.256
    6   HD11  LEU  94          HD11      LEU  94   2.971  12.675   8.223
    7   HD13  LEU  94          HD12      LEU  94   3.928  11.203   8.081
    8   HD12  LEU  94          HD13      LEU  94   4.276  12.583   7.040
    9   HD23  LEU  94          HD21      LEU  94   5.977  13.914   7.540
   10   HD22  LEU  94          HD22      LEU  94   6.416  14.391   9.181
   11   HD21  LEU  94          HD23      LEU  94   4.867  14.888   8.500

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  95           H        ILE  95   3.529  12.098  13.214
    2    HA   ILE  95           HA       ILE  95   2.537  14.458  14.431
    3    HB   ILE  95           HB       ILE  95   2.516  11.572  15.341
    4   HG12  ILE  95          HG12      ILE  95   0.314  13.387  14.323
    5   HG13  ILE  95          HG13      ILE  95   1.243  12.318  13.276
    6   HG21  ILE  95          HG21      ILE  95   1.286  14.059  16.568
    7   HG23  ILE  95          HG22      ILE  95   2.322  12.869  17.356
    8   HG22  ILE  95          HG23      ILE  95   0.675  12.437  16.895
    9   HD13  ILE  95          HD11      ILE  95   0.318  10.389  14.194
   10   HD12  ILE  95          HD12      ILE  95  -1.046  11.501  14.289
   11   HD11  ILE  95          HD13      ILE  95  -0.072  11.179  15.723

  No H/Q in entry =          11
  In of MODEL   59
    1    H    GLU  96           H        GLU  96   5.105  12.193  15.391
    2    HA   GLU  96           HA       GLU  96   5.704  13.370  17.883
    3    HB2  GLU  96           HB2      GLU  96   6.611  11.199  17.215
    4    HB3  GLU  96           HB3      GLU  96   7.544  11.964  15.930
    5    HG2  GLU  96           HG2      GLU  96   9.215  12.479  17.380
    6    HG3  GLU  96           HG3      GLU  96   8.091  13.305  18.450

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LEU  97           H        LEU  97   6.759  14.141  14.591
    2    HA   LEU  97           HA       LEU  97   8.683  16.104  15.294
    3    HB2  LEU  97           HB2      LEU  97   7.059  15.593  12.812
    4    HB3  LEU  97           HB3      LEU  97   8.102  17.007  12.931
    5    HG   LEU  97           HG       LEU  97   9.092  14.191  13.467
    6   HD12  LEU  97          HD11      LEU  97  10.070  14.382  11.141
    7   HD11  LEU  97          HD12      LEU  97   9.038  15.790  10.895
    8   HD13  LEU  97          HD13      LEU  97   8.316  14.207  11.188
    9   HD23  LEU  97          HD21      LEU  97  11.274  15.440  12.710
   10   HD22  LEU  97          HD22      LEU  97  10.675  15.711  14.346
   11   HD21  LEU  97          HD23      LEU  97  10.367  16.905  13.086

  No H/Q in entry =          11
  In of MODEL   59
    1    H    HIS  98           H        HIS  98   5.188  16.297  14.674
    2    HA   HIS  98           HA       HIS  98   4.933  19.100  14.826
    3    HB2  HIS  98           HB2      HIS  98   3.015  16.875  15.559
    4    HB3  HIS  98           HB3      HIS  98   2.575  18.582  15.628
    5    HD1  HIS  98           HD1      HIS  98   3.532  15.864  13.200
    6    HD2  HIS  98           HD2      HIS  98   2.215  19.818  13.110
    7    HE1  HIS  98           HE1      HIS  98   2.957  16.373  10.783
    8    HE2  HIS  98           HE2      HIS  98   2.158  18.776  10.708

  No H/Q in entry =           8
  In of MODEL   59
    1    H    GLU  99           H        GLU  99   5.051  16.597  17.311
    2    HA   GLU  99           HA       GLU  99   4.490  18.289  19.523
    3    HB2  GLU  99           HB2      GLU  99   4.365  15.808  19.609
    4    HB3  GLU  99           HB3      GLU  99   6.122  15.737  19.484
    5    HG2  GLU  99           HG2      GLU  99   6.351  17.016  21.562
    6    HG3  GLU  99           HG3      GLU  99   4.601  17.183  21.675

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LYS 100           H        LYS 100   7.515  17.320  17.925
    2    HA   LYS 100           HA       LYS 100   9.208  18.686  19.772
    3    HB2  LYS 100           HB2      LYS 100   9.666  17.768  16.924
    4    HB3  LYS 100           HB3      LYS 100  10.917  18.514  17.924
    5    HG2  LYS 100           HG2      LYS 100  10.530  16.761  19.660
    6    HG3  LYS 100           HG3      LYS 100   9.376  15.980  18.576
    7    HD2  LYS 100           HD2      LYS 100  11.150  15.678  16.890
    8    HD3  LYS 100           HD3      LYS 100  12.309  16.471  17.960
    9    HE2  LYS 100           HE2      LYS 100  11.902  14.713  19.673
   10    HE3  LYS 100           HE3      LYS 100  10.804  13.900  18.554
   11    HZ1  LYS 100           HZ1      LYS 100  13.628  14.530  17.874
   12    HZ3  LYS 100           HZ2      LYS 100  12.560  13.495  17.051
   13    HZ2  LYS 100           HZ3      LYS 100  13.157  13.059  18.582

  No H/Q in entry =          13
  In of MODEL   59
    1    H    LEU 101           H        LEU 101   7.501  19.653  16.838
    2    HA   LEU 101           HA       LEU 101   8.751  22.193  16.504
    3    HB2  LEU 101           HB2      LEU 101   6.128  21.004  15.636
    4    HB3  LEU 101           HB3      LEU 101   6.404  22.732  15.435
    5    HG   LEU 101           HG       LEU 101   8.399  20.690  14.440
    6   HD12  LEU 101          HD11      LEU 101   7.232  21.225  12.168
    7   HD11  LEU 101          HD12      LEU 101   5.849  21.672  13.164
    8   HD13  LEU 101          HD13      LEU 101   6.489  20.031  13.232
    9   HD21  LEU 101          HD21      LEU 101   7.811  23.615  13.905
   10   HD23  LEU 101          HD22      LEU 101   8.766  22.645  12.784
   11   HD22  LEU 101          HD23      LEU 101   9.328  22.886  14.438

  No H/Q in entry =          11
  In of MODEL   59
    1    H    LYS 102           H        LYS 102   7.221  21.066  19.129
    2    HA   LYS 102           HA       LYS 102   6.624  22.157  21.072
    3    HB2  LYS 102           HB2      LYS 102   7.927  24.133  19.946
    4    HB3  LYS 102           HB3      LYS 102   6.334  24.764  19.589
    5    HG2  LYS 102           HG2      LYS 102   7.732  24.473  22.226
    6    HG3  LYS 102           HG3      LYS 102   6.794  25.820  21.613
    7    HD2  LYS 102           HD2      LYS 102   5.518  23.198  22.490
    8    HD3  LYS 102           HD3      LYS 102   5.798  24.550  23.578
    9    HE2  LYS 102           HE2      LYS 102   3.499  24.190  22.109
   10    HE3  LYS 102           HE3      LYS 102   4.032  25.724  22.794
   11    HZ2  LYS 102           HZ1      LYS 102   3.481  25.853  20.420
   12    HZ1  LYS 102           HZ2      LYS 102   4.722  24.753  20.080
   13    HZ3  LYS 102           HZ3      LYS 102   5.095  26.275  20.727

  No H/Q in entry =          13
  In of MODEL   59
    1    H    ALA 103           H        ALA 103   4.984  23.740  18.329
    2    HA   ALA 103           HA       ALA 103   2.548  24.349  19.241
    3    HB1  ALA 103           HB1      ALA 103   1.615  23.534  17.003
    4    HB2  ALA 103           HB2      ALA 103   3.250  22.973  16.654
    5    HB3  ALA 103           HB3      ALA 103   2.945  24.689  16.933

  No H/Q in entry =           5
  In of MODEL   59
    1    H1   ALA   1           H3       ALA   1  10.203 -20.145  -6.345
    2    H2   ALA   1           H2       ALA   1   9.222 -20.328  -7.723
    3    H3   ALA   1           H1       ALA   1   8.787 -21.075  -6.259
    4    HA   ALA   1           HA       ALA   1   9.790 -22.896  -7.018
    5    HB1  ALA   1           HB1      ALA   1   9.869 -22.527  -9.293
    6    HB2  ALA   1           HB2      ALA   1  11.602 -22.406  -8.980
    7    HB3  ALA   1           HB3      ALA   1  10.626 -20.942  -9.114

  No H/Q in entry =           7
  In of MODEL   59
    1    H    GLU   2           H        GLU   2  12.057 -23.884  -7.104
    2    HA   GLU   2           HA       GLU   2  13.462 -23.837  -4.906
    3    HB2  GLU   2           HB2      GLU   2  14.793 -23.713  -7.617
    4    HB3  GLU   2           HB3      GLU   2  15.526 -24.344  -6.143
    5    HG2  GLU   2           HG2      GLU   2  14.474 -26.342  -6.384
    6    HG3  GLU   2           HG3      GLU   2  12.912 -25.569  -6.623

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLU   3           H        GLU   3  15.239 -21.988  -7.315
    2    HA   GLU   3           HA       GLU   3  16.440 -20.331  -5.358
    3    HB2  GLU   3           HB2      GLU   3  16.354 -20.312  -8.367
    4    HB3  GLU   3           HB3      GLU   3  17.130 -19.000  -7.480
    5    HG2  GLU   3           HG2      GLU   3  18.779 -20.406  -6.582
    6    HG3  GLU   3           HG3      GLU   3  17.806 -21.856  -6.801

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LEU   4           H        LEU   4  14.146 -19.431  -7.961
    2    HA   LEU   4           HA       LEU   4  13.729 -16.819  -7.331
    3    HB2  LEU   4           HB2      LEU   4  11.514 -18.753  -8.050
    4    HB3  LEU   4           HB3      LEU   4  11.466 -17.002  -8.239
    5    HG   LEU   4           HG       LEU   4  13.386 -18.890  -9.641
    6   HD13  LEU   4          HD11      LEU   4  12.068 -18.709 -11.537
    7   HD12  LEU   4          HD12      LEU   4  11.390 -17.155 -11.055
    8   HD11  LEU   4          HD13      LEU   4  10.820 -18.641 -10.296
    9   HD23  LEU   4          HD21      LEU   4  13.746 -16.643 -10.984
   10   HD22  LEU   4          HD22      LEU   4  14.617 -16.908  -9.475
   11   HD21  LEU   4          HD23      LEU   4  13.181 -15.888  -9.494

  No H/Q in entry =          11
  In of MODEL   59
    1    H    GLU   5           H        GLU   5  12.215 -19.586  -5.689
    2    HA   GLU   5           HA       GLU   5  10.581 -17.997  -3.961
    3    HB2  GLU   5           HB2      GLU   5  10.103 -20.360  -4.486
    4    HB3  GLU   5           HB3      GLU   5  11.546 -20.832  -3.586
    5    HG2  GLU   5           HG2      GLU   5  10.641 -19.840  -1.546
    6    HG3  GLU   5           HG3      GLU   5   9.227 -19.265  -2.429

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLU   6           H        GLU   6  13.705 -19.630  -3.558
    2    HA   GLU   6           HA       GLU   6  14.098 -18.795  -0.859
    3    HB2  GLU   6           HB2      GLU   6  16.023 -19.749  -2.990
    4    HB3  GLU   6           HB3      GLU   6  16.491 -19.429  -1.320
    5    HG2  GLU   6           HG2      GLU   6  14.313 -21.366  -2.147
    6    HG3  GLU   6           HG3      GLU   6  15.961 -21.836  -1.732

  No H/Q in entry =           6
  In of MODEL   59
    1    H    VAL   7           H        VAL   7  14.854 -17.464  -4.010
    2    HA   VAL   7           HA       VAL   7  16.583 -15.369  -3.151
    3    HB   VAL   7           HB       VAL   7  14.847 -15.692  -5.613
    4   HG11  VAL   7          HG11      VAL   7  16.784 -13.514  -4.808
    5   HG13  VAL   7          HG12      VAL   7  15.138 -13.342  -5.414
    6   HG12  VAL   7          HG13      VAL   7  16.428 -13.859  -6.500
    7   HG21  VAL   7          HG21      VAL   7  16.936 -17.185  -5.073
    8   HG23  VAL   7          HG22      VAL   7  17.860 -15.737  -5.473
    9   HG22  VAL   7          HG23      VAL   7  16.800 -16.463  -6.677

  No H/Q in entry =           9
  In of MODEL   59
    1    H    VAL   8           H        VAL   8  13.081 -15.580  -3.674
    2    HA   VAL   8           HA       VAL   8  12.464 -12.864  -3.181
    3    HB   VAL   8           HB       VAL   8  10.843 -15.392  -2.813
    4   HG11  VAL   8          HG11      VAL   8  10.146 -12.498  -2.328
    5   HG13  VAL   8          HG12      VAL   8   9.801 -13.899  -1.315
    6   HG12  VAL   8          HG13      VAL   8   8.907 -13.653  -2.814
    7   HG21  VAL   8          HG21      VAL   8  11.613 -14.384  -5.153
    8   HG23  VAL   8          HG22      VAL   8  10.332 -13.218  -4.838
    9   HG22  VAL   8          HG23      VAL   8   9.951 -14.933  -4.945

  No H/Q in entry =           9
  In of MODEL   59
    1    H    MET   9           H        MET   9  12.708 -15.685  -1.019
    2    HA   MET   9           HA       MET   9  11.936 -14.414   1.366
    3    HB2  MET   9           HB2      MET   9  13.801 -16.715   0.794
    4    HB3  MET   9           HB3      MET   9  13.527 -16.139   2.438
    5    HG2  MET   9           HG2      MET   9  11.093 -16.481   2.145
    6    HG3  MET   9           HG3      MET   9  11.384 -17.086   0.514
    7    HE1  MET   9           HE1      MET   9  12.400 -17.215   4.077
    8    HE3  MET   9           HE2      MET   9  12.609 -18.910   4.507
    9    HE2  MET   9           HE3      MET   9  10.990 -18.267   4.256

  No H/Q in entry =           9
  In of MODEL   59
    1    H    GLY  10           H        GLY  10  15.098 -14.679  -0.223
    2    HA3  GLY  10           HA2      GLY  10  16.598 -13.292   1.739
    3    HA2  GLY  10           HA3      GLY  10  17.042 -13.455   0.040

  No H/Q in entry =           3
  In of MODEL   59
    1    H    LEU  11           H        LEU  11  14.880 -12.194  -1.171
    2    HA   LEU  11           HA       LEU  11  15.609  -9.461  -1.000
    3    HB2  LEU  11           HB2      LEU  11  13.208 -10.828  -2.219
    4    HB3  LEU  11           HB3      LEU  11  13.513  -9.097  -2.372
    5    HG   LEU  11           HG       LEU  11  15.500 -11.232  -3.191
    6   HD13  LEU  11          HD11      LEU  11  13.734 -11.564  -4.696
    7   HD12  LEU  11          HD12      LEU  11  14.746 -10.393  -5.540
    8   HD11  LEU  11          HD13      LEU  11  13.289  -9.857  -4.704
    9   HD22  LEU  11          HD21      LEU  11  16.763  -9.288  -2.967
   10   HD21  LEU  11          HD22      LEU  11  15.400  -8.229  -3.327
   11   HD23  LEU  11          HD23      LEU  11  16.205  -9.103  -4.629

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  12           H        ILE  12  12.826 -11.252   0.285
    2    HA   ILE  12           HA       ILE  12  11.476  -9.014   1.370
    3    HB   ILE  12           HB       ILE  12  11.480 -11.901   2.306
    4   HG12  ILE  12          HG12      ILE  12  10.780 -11.248  -0.133
    5   HG13  ILE  12          HG13      ILE  12   9.747 -12.326   0.783
    6   HG23  ILE  12          HG21      ILE  12  10.562 -10.515   4.060
    7   HG22  ILE  12          HG22      ILE  12   9.205 -11.278   3.234
    8   HG21  ILE  12          HG23      ILE  12   9.605  -9.593   2.901
    9   HD13  ILE  12          HD11      ILE  12   8.267 -10.470   1.327
   10   HD12  ILE  12          HD12      ILE  12   8.503 -10.530  -0.419
   11   HD11  ILE  12          HD13      ILE  12   9.355  -9.340   0.540

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  13           H        ILE  13  13.850 -11.260   2.741
    2    HA   ILE  13           HA       ILE  13  13.928 -10.096   5.327
    3    HB   ILE  13           HB       ILE  13  15.948 -11.690   3.731
    4   HG12  ILE  13          HG12      ILE  13  13.670 -12.630   4.592
    5   HG13  ILE  13          HG13      ILE  13  15.135 -13.572   4.848
    6   HG23  ILE  13          HG21      ILE  13  17.335 -10.546   5.259
    7   HG22  ILE  13          HG22      ILE  13  16.995 -12.065   6.080
    8   HG21  ILE  13          HG23      ILE  13  16.131 -10.599   6.546
    9   HD13  ILE  13          HD11      ILE  13  15.190 -13.097   7.149
   10   HD12  ILE  13          HD12      ILE  13  13.460 -13.181   6.841
   11   HD11  ILE  13          HD13      ILE  13  14.256 -11.617   6.954

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ASN  14           H        ASN  14  15.860  -9.576   2.392
    2    HA   ASN  14           HA       ASN  14  17.640  -7.663   3.447
    3    HB2  ASN  14           HB2      ASN  14  17.579  -8.917   1.125
    4    HB3  ASN  14           HB3      ASN  14  16.699  -7.485   0.604
    5   HD21  ASN  14          HD21      ASN  14  19.123  -7.850  -0.607
    6   HD22  ASN  14          HD22      ASN  14  20.287  -6.786   0.014

  No H/Q in entry =           6
  In of MODEL   59
    1    H    SER  15           H        SER  15  14.518  -7.267   1.787
    2    HA   SER  15           HA       SER  15  14.443  -4.445   1.859
    3    HB2  SER  15           HB2      SER  15  12.106  -4.659   1.381
    4    HB3  SER  15           HB3      SER  15  12.875  -6.036   0.601
    5    HG   SER  15           HG       SER  15  11.031  -5.993   2.559

  No H/Q in entry =           5
  In of MODEL   59
    1    H    GLY  16           H        GLY  16  13.341  -6.904   4.160
    2    HA3  GLY  16           HA2      GLY  16  12.159  -5.150   6.039
    3    HA2  GLY  16           HA3      GLY  16  12.757  -6.767   6.386

  No H/Q in entry =           3
  In of MODEL   59
    1    H    GLN  17           H        GLN  17  15.467  -6.465   5.769
    2    HA   GLN  17           HA       GLN  17  16.461  -5.269   8.147
    3    HB2  GLN  17           HB2      GLN  17  17.848  -6.120   5.591
    4    HB3  GLN  17           HB3      GLN  17  18.713  -5.543   7.016
    5    HG2  GLN  17           HG2      GLN  17  16.786  -7.881   7.016
    6    HG3  GLN  17           HG3      GLN  17  18.539  -8.037   6.925
    7   HE21  GLN  17          HE21      GLN  17  16.223  -8.468   9.128
    8   HE22  GLN  17          HE22      GLN  17  16.986  -7.883  10.525

  No H/Q in entry =           8
  In of MODEL   59
    1    H    ALA  18           H        ALA  18  16.254  -4.171   4.795
    2    HA   ALA  18           HA       ALA  18  17.721  -1.797   5.020
    3    HB1  ALA  18           HB1      ALA  18  16.568  -2.987   2.957
    4    HB3  ALA  18           HB2      ALA  18  16.854  -1.247   2.948
    5    HB2  ALA  18           HB3      ALA  18  15.250  -1.875   3.330

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ARG  19           H        ARG  19  14.218  -2.345   5.448
    2    HA   ARG  19           HA       ARG  19  13.589   0.309   6.183
    3    HB2  ARG  19           HB2      ARG  19  11.881  -1.419   5.603
    4    HB3  ARG  19           HB3      ARG  19  12.228  -2.229   7.133
    5    HG2  ARG  19           HG2      ARG  19  11.553  -0.236   8.389
    6    HG3  ARG  19           HG3      ARG  19  11.299   0.651   6.887
    7    HD2  ARG  19           HD2      ARG  19   9.156  -0.124   7.724
    8    HD3  ARG  19           HD3      ARG  19   9.551  -1.000   6.239
    9    HE   ARG  19           HE       ARG  19  10.511  -2.565   8.327
   10   HH21  ARG  19          HH11      ARG  19   9.251  -4.195   9.269
   11   HH22  ARG  19          HH12      ARG  19   7.530  -4.146   9.115
   12   HH11  ARG  19          HH21      ARG  19   7.522  -1.231   7.267
   13   HH12  ARG  19          HH22      ARG  19   6.551  -2.469   7.977

  No H/Q in entry =          13
  In of MODEL   59
    1    H    SER  20           H        SER  20  14.431  -2.541   8.119
    2    HA   SER  20           HA       SER  20  14.185  -1.452  10.664
    3    HB2  SER  20           HB2      SER  20  14.762  -3.868  10.005
    4    HB3  SER  20           HB3      SER  20  16.432  -3.315   9.903
    5    HG   SER  20           HG       SER  20  15.690  -4.175  11.995

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LEU  21           H        LEU  21  17.008  -1.413   8.502
    2    HA   LEU  21           HA       LEU  21  18.717   0.043  10.232
    3    HB2  LEU  21           HB2      LEU  21  18.664  -0.214   7.217
    4    HB3  LEU  21           HB3      LEU  21  19.935   0.630   8.098
    5    HG   LEU  21           HG       LEU  21  19.170  -2.258   8.623
    6   HD13  LEU  21          HD11      LEU  21  20.025  -2.290   6.419
    7   HD12  LEU  21          HD12      LEU  21  21.432  -2.646   7.422
    8   HD11  LEU  21          HD13      LEU  21  21.207  -1.026   6.767
    9   HD21  LEU  21          HD21      LEU  21  21.317  -0.392   9.622
   10   HD23  LEU  21          HD22      LEU  21  21.663  -2.115   9.534
   11   HD22  LEU  21          HD23      LEU  21  20.344  -1.538  10.538

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ALA  22           H        ALA  22  16.441   1.053   7.703
    2    HA   ALA  22           HA       ALA  22  17.013   3.805   7.726
    3    HB3  ALA  22           HB1      ALA  22  15.580   2.588   6.055
    4    HB2  ALA  22           HB2      ALA  22  14.897   4.106   6.636
    5    HB1  ALA  22           HB3      ALA  22  14.294   2.571   7.261

  No H/Q in entry =           5
  In of MODEL   59
    1    H    TYR  23           H        TYR  23  14.511   2.009   9.575
    2    HA   TYR  23           HA       TYR  23  13.589   4.250  11.045
    3    HB2  TYR  23           HB2      TYR  23  12.328   2.150  11.024
    4    HB3  TYR  23           HB3      TYR  23  13.658   1.321  11.833
    5    HD1  TYR  23           HD1      TYR  23  11.200   4.102  12.232
    6    HD2  TYR  23           HD2      TYR  23  13.864   1.358  14.187
    7    HE1  TYR  23           HE1      TYR  23  10.298   4.797  14.437
    8    HE2  TYR  23           HE2      TYR  23  12.962   2.051  16.390
    9    HH   TYR  23           HH       TYR  23  10.236   4.305  16.634

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ALA  24           H        ALA  24  16.212   1.939  11.645
    2    HA   ALA  24           HA       ALA  24  16.918   2.912  14.208
    3    HB1  ALA  24           HB1      ALA  24  18.251   1.103  14.020
    4    HB3  ALA  24           HB2      ALA  24  19.280   2.017  12.917
    5    HB2  ALA  24           HB3      ALA  24  17.967   1.029  12.282

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ALA  25           H        ALA  25  17.857   3.846  10.925
    2    HA   ALA  25           HA       ALA  25  19.832   5.753  11.563
    3    HB1  ALA  25           HB1      ALA  25  19.082   4.826   9.249
    4    HB3  ALA  25           HB2      ALA  25  19.606   6.507   9.346
    5    HB2  ALA  25           HB3      ALA  25  17.886   6.122   9.291

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LEU  26           H        LEU  26  16.317   6.028  11.235
    2    HA   LEU  26           HA       LEU  26  16.133   8.810  11.703
    3    HB2  LEU  26           HB2      LEU  26  14.247   7.604  10.786
    4    HB3  LEU  26           HB3      LEU  26  14.156   6.569  12.207
    5    HG   LEU  26           HG       LEU  26  13.588   8.527  13.603
    6   HD12  LEU  26          HD11      LEU  26  12.942  10.643  12.295
    7   HD11  LEU  26          HD12      LEU  26  13.902   9.985  10.973
    8   HD13  LEU  26          HD13      LEU  26  14.666  10.352  12.520
    9   HD21  LEU  26          HD21      LEU  26  11.886   8.249  11.107
   10   HD23  LEU  26          HD22      LEU  26  11.348   8.946  12.633
   11   HD22  LEU  26          HD23      LEU  26  11.778   7.239  12.549

  No H/Q in entry =          11
  In of MODEL   59
    1    H    LYS  27           H        LYS  27  16.008   6.020  13.882
    2    HA   LYS  27           HA       LYS  27  15.456   7.381  16.263
    3    HB2  LYS  27           HB2      LYS  27  15.449   4.907  15.985
    4    HB3  LYS  27           HB3      LYS  27  17.212   4.936  15.925
    5    HG2  LYS  27           HG2      LYS  27  17.296   5.909  18.180
    6    HG3  LYS  27           HG3      LYS  27  15.530   5.951  18.242
    7    HD2  LYS  27           HD2      LYS  27  15.469   3.485  17.992
    8    HD3  LYS  27           HD3      LYS  27  17.234   3.451  17.964
    9    HE2  LYS  27           HE2      LYS  27  17.302   4.427  20.225
   10    HE3  LYS  27           HE3      LYS  27  15.537   4.491  20.256
   11    HZ3  LYS  27           HZ1      LYS  27  16.309   2.522  21.389
   12    HZ2  LYS  27           HZ2      LYS  27  17.206   2.038  20.027
   13    HZ1  LYS  27           HZ3      LYS  27  15.508   2.067  19.964

  No H/Q in entry =          13
  In of MODEL   59
    1    H    GLN  28           H        GLN  28  18.549   6.765  14.639
    2    HA   GLN  28           HA       GLN  28  20.266   7.814  16.620
    3    HB2  GLN  28           HB2      GLN  28  20.524   7.778  13.602
    4    HB3  GLN  28           HB3      GLN  28  21.828   8.231  14.701
    5    HG2  GLN  28           HG2      GLN  28  20.376   5.570  14.754
    6    HG3  GLN  28           HG3      GLN  28  21.951   5.839  14.008
    7   HE21  GLN  28          HE21      GLN  28  20.691   4.553  16.739
    8   HE22  GLN  28          HE22      GLN  28  21.910   4.950  17.851

  No H/Q in entry =           8
  In of MODEL   59
    1    H    ALA  29           H        ALA  29  18.511   9.336  13.952
    2    HA   ALA  29           HA       ALA  29  19.549  11.941  14.210
    3    HB2  ALA  29           HB1      ALA  29  17.847  12.610  12.758
    4    HB1  ALA  29           HB2      ALA  29  16.692  11.450  13.413
    5    HB3  ALA  29           HB3      ALA  29  18.005  10.894  12.375

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LYS  30           H        LYS  30  16.764  10.373  15.748
    2    HA   LYS  30           HA       LYS  30  15.796  12.634  17.127
    3    HB2  LYS  30           HB2      LYS  30  15.647   9.691  17.815
    4    HB3  LYS  30           HB3      LYS  30  14.808  10.949  18.724
    5    HG2  LYS  30           HG2      LYS  30  13.674  11.663  16.620
    6    HG3  LYS  30           HG3      LYS  30  14.451  10.320  15.778
    7    HD2  LYS  30           HD2      LYS  30  13.369   8.720  17.308
    8    HD3  LYS  30           HD3      LYS  30  12.603  10.052  18.174
    9    HE2  LYS  30           HE2      LYS  30  11.425  10.714  16.095
   10    HE3  LYS  30           HE3      LYS  30  12.171   9.353  15.250
   11    HZ2  LYS  30           HZ1      LYS  30   9.865   8.974  16.149
   12    HZ1  LYS  30           HZ2      LYS  30  10.548   9.008  17.710
   13    HZ3  LYS  30           HZ3      LYS  30  11.028   7.822  16.589

  No H/Q in entry =          13
  In of MODEL   59
    1    H    GLN  31           H        GLN  31  18.430  10.421  17.827
    2    HA   GLN  31           HA       GLN  31  18.798  11.415  20.524
    3    HB2  GLN  31           HB2      GLN  31  20.782   9.823  18.891
    4    HB3  GLN  31           HB3      GLN  31  20.666   9.939  20.648
    5    HG2  GLN  31           HG2      GLN  31  18.131   9.029  19.897
    6    HG3  GLN  31           HG3      GLN  31  19.210   8.175  18.802
    7   HE21  GLN  31          HE21      GLN  31  17.671   7.039  21.087
    8   HE22  GLN  31          HE22      GLN  31  18.827   6.355  22.122

  No H/Q in entry =           8
  In of MODEL   59
    1    H    GLY  32           H        GLY  32  19.310  12.741  17.560
    2    HA3  GLY  32           HA2      GLY  32  20.320  14.774  17.047
    3    HA2  GLY  32           HA3      GLY  32  21.092  14.758  18.628

  No H/Q in entry =           3
  In of MODEL   59
    1    H    ASP  33           H        ASP  33  21.454  11.870  16.831
    2    HA   ASP  33           HA       ASP  33  24.285  12.505  16.342
    3    HB2  ASP  33           HB2      ASP  33  22.738   9.911  16.458
    4    HB3  ASP  33           HB3      ASP  33  24.421  10.005  15.948

  No H/Q in entry =           4
  In of MODEL   59
    1    H    PHE  34           H        PHE  34  23.806  13.846  14.473
    2    HA   PHE  34           HA       PHE  34  22.421  12.895  12.193
    3    HB2  PHE  34           HB2      PHE  34  24.586  14.996  12.415
    4    HB3  PHE  34           HB3      PHE  34  23.583  14.728  10.991
    5    HD1  PHE  34           HD1      PHE  34  23.890  16.642  13.912
    6    HD2  PHE  34           HD2      PHE  34  20.959  14.583  11.542
    7    HE1  PHE  34           HE1      PHE  34  22.103  18.061  14.884
    8    HE2  PHE  34           HE2      PHE  34  19.176  16.002  12.517
    9    HZ   PHE  34           HZ       PHE  34  19.752  17.742  14.184

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ALA  35           H        ALA  35  25.801  12.651  13.168
    2    HA   ALA  35           HA       ALA  35  26.871  11.828  10.696
    3    HB3  ALA  35           HB1      ALA  35  28.550  10.624  12.394
    4    HB2  ALA  35           HB2      ALA  35  27.713  11.656  13.553
    5    HB1  ALA  35           HB3      ALA  35  28.547  12.374  12.176

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ALA  36           H        ALA  36  25.753   9.873  13.461
    2    HA   ALA  36           HA       ALA  36  26.189   7.386  12.167
    3    HB2  ALA  36           HB1      ALA  36  25.767   6.634  14.243
    4    HB3  ALA  36           HB2      ALA  36  24.085   7.154  14.111
    5    HB1  ALA  36           HB3      ALA  36  25.308   8.265  14.729

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ALA  37           H        ALA  37  23.399   9.551  12.339
    2    HA   ALA  37           HA       ALA  37  21.507   7.815  11.171
    3    HB3  ALA  37           HB1      ALA  37  21.778  10.773  11.478
    4    HB1  ALA  37           HB2      ALA  37  20.455   9.710  11.957
    5    HB2  ALA  37           HB3      ALA  37  20.635  10.189  10.268

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LYS  38           H        LYS  38  23.627  10.255   9.686
    2    HA   LYS  38           HA       LYS  38  22.957   9.851   7.013
    3    HB2  LYS  38           HB2      LYS  38  24.802  11.375   8.449
    4    HB3  LYS  38           HB3      LYS  38  25.811  10.377   7.409
    5    HG2  LYS  38           HG2      LYS  38  24.639  11.175   5.428
    6    HG3  LYS  38           HG3      LYS  38  23.465  12.040   6.425
    7    HD2  LYS  38           HD2      LYS  38  25.089  13.613   7.171
    8    HD3  LYS  38           HD3      LYS  38  26.431  12.611   6.617
    9    HE2  LYS  38           HE2      LYS  38  26.085  14.496   5.079
   10    HE3  LYS  38           HE3      LYS  38  25.722  12.967   4.270
   11    HZ3  LYS  38           HZ1      LYS  38  23.530  13.443   4.163
   12    HZ2  LYS  38           HZ2      LYS  38  24.075  15.050   4.254
   13    HZ1  LYS  38           HZ3      LYS  38  23.504  14.266   5.648

  No H/Q in entry =          13
  In of MODEL   59
    1    H    ALA  39           H        ALA  39  25.467   8.208   8.936
    2    HA   ALA  39           HA       ALA  39  26.495   6.617   6.848
    3    HB2  ALA  39           HB1      ALA  39  26.420   5.639   9.687
    4    HB1  ALA  39           HB2      ALA  39  27.388   7.054   9.270
    5    HB3  ALA  39           HB3      ALA  39  27.711   5.504   8.495

  No H/Q in entry =           5
  In of MODEL   59
    1    H    MET  40           H        MET  40  23.896   6.024   9.167
    2    HA   MET  40           HA       MET  40  23.410   3.329   8.422
    3    HB2  MET  40           HB2      MET  40  21.633   5.389   9.743
    4    HB3  MET  40           HB3      MET  40  21.202   3.686   9.563
    5    HG2  MET  40           HG2      MET  40  23.776   4.586  10.885
    6    HG3  MET  40           HG3      MET  40  22.287   4.325  11.790
    7    HE3  MET  40           HE1      MET  40  21.677   0.698  11.951
    8    HE2  MET  40           HE2      MET  40  20.818   2.017  11.159
    9    HE1  MET  40           HE3      MET  40  21.577   2.286  12.727

  No H/Q in entry =           9
  In of MODEL   59
    1    H    MET  41           H        MET  41  22.025   6.407   7.265
    2    HA   MET  41           HA       MET  41  20.037   5.247   5.606
    3    HB2  MET  41           HB2      MET  41  21.547   7.821   5.093
    4    HB3  MET  41           HB3      MET  41  20.006   7.351   4.386
    5    HG2  MET  41           HG2      MET  41  19.282   7.158   6.943
    6    HG3  MET  41           HG3      MET  41  20.607   8.297   7.159
    7    HE2  MET  41           HE1      MET  41  20.030   9.611   3.835
    8    HE1  MET  41           HE2      MET  41  21.006  10.030   5.240
    9    HE3  MET  41           HE3      MET  41  19.742  11.129   4.694

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ASP  42           H        ASP  42  23.416   6.130   5.026
    2    HA   ASP  42           HA       ASP  42  23.476   5.670   2.265
    3    HB2  ASP  42           HB2      ASP  42  25.256   6.635   4.023
    4    HB3  ASP  42           HB3      ASP  42  25.891   5.002   3.880

  No H/Q in entry =           4
  In of MODEL   59
    1    H    GLN  43           H        GLN  43  24.198   3.491   4.966
    2    HA   GLN  43           HA       GLN  43  24.818   1.234   3.365
    3    HB2  GLN  43           HB2      GLN  43  23.825   1.414   6.219
    4    HB3  GLN  43           HB3      GLN  43  24.378  -0.078   5.450
    5    HG2  GLN  43           HG2      GLN  43  26.551   1.108   4.925
    6    HG3  GLN  43           HG3      GLN  43  25.995   2.437   5.938
    7   HE21  GLN  43          HE21      GLN  43  28.225   1.430   6.948
    8   HE22  GLN  43          HE22      GLN  43  27.949   0.343   8.220

  No H/Q in entry =           8
  In of MODEL   59
    1    H    SER  44           H        SER  44  21.790   2.399   4.785
    2    HA   SER  44           HA       SER  44  20.187   0.179   4.115
    3    HB2  SER  44           HB2      SER  44  19.788   2.707   5.279
    4    HB3  SER  44           HB3      SER  44  18.740   2.685   3.863
    5    HG   SER  44           HG       SER  44  17.651   1.746   5.591

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ARG  45           H        ARG  45  20.950   3.145   2.320
    2    HA   ARG  45           HA       ARG  45  19.397   2.691   0.027
    3    HB2  ARG  45           HB2      ARG  45  20.574   4.809   0.612
    4    HB3  ARG  45           HB3      ARG  45  22.105   4.037   0.208
    5    HG2  ARG  45           HG2      ARG  45  21.294   3.655  -2.101
    6    HG3  ARG  45           HG3      ARG  45  19.776   4.450  -1.696
    7    HD2  ARG  45           HD2      ARG  45  21.059   6.527  -1.112
    8    HD3  ARG  45           HD3      ARG  45  22.540   5.737  -1.699
    9    HE   ARG  45           HE       ARG  45  20.587   5.536  -3.718
   10   HH21  ARG  45          HH11      ARG  45  20.581   6.915  -5.473
   11   HH22  ARG  45          HH12      ARG  45  21.359   8.454  -5.368
   12   HH11  ARG  45          HH21      ARG  45  22.365   8.002  -2.094
   13   HH12  ARG  45          HH22      ARG  45  22.368   9.069  -3.452

  No H/Q in entry =          13
  In of MODEL   59
    1    H    MET  46           H        MET  46  22.757   1.768   0.737
    2    HA   MET  46           HA       MET  46  23.322   0.582  -1.760
    3    HB2  MET  46           HB2      MET  46  24.451   0.210   1.017
    4    HB3  MET  46           HB3      MET  46  25.089  -0.661  -0.381
    5    HG2  MET  46           HG2      MET  46  25.507   1.482  -1.533
    6    HG3  MET  46           HG3      MET  46  24.865   2.356  -0.149
    7    HE3  MET  46           HE1      MET  46  27.641   3.217  -1.107
    8    HE2  MET  46           HE2      MET  46  28.482   3.299   0.438
    9    HE1  MET  46           HE3      MET  46  26.795   3.799   0.333

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ALA  47           H        ALA  47  21.951  -0.749   1.223
    2    HA   ALA  47           HA       ALA  47  21.852  -3.457   0.406
    3    HB2  ALA  47           HB1      ALA  47  21.503  -3.004   2.716
    4    HB3  ALA  47           HB2      ALA  47  19.952  -3.582   2.110
    5    HB1  ALA  47           HB3      ALA  47  20.208  -1.856   2.375

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LEU  48           H        LEU  48  19.533  -0.796   0.087
    2    HA   LEU  48           HA       LEU  48  17.454  -2.294  -1.151
    3    HB2  LEU  48           HB2      LEU  48  18.148   0.652  -1.257
    4    HB3  LEU  48           HB3      LEU  48  16.661  -0.035  -1.912
    5    HG   LEU  48           HG       LEU  48  17.540  -0.364   0.966
    6   HD13  LEU  48          HD11      LEU  48  17.152   1.943   0.795
    7   HD12  LEU  48          HD12      LEU  48  15.590   1.315   1.317
    8   HD11  LEU  48          HD13      LEU  48  15.850   1.742  -0.374
    9   HD22  LEU  48          HD21      LEU  48  15.983  -2.055   0.592
   10   HD21  LEU  48          HD22      LEU  48  15.109  -1.133  -0.632
   11   HD23  LEU  48          HD23      LEU  48  14.920  -0.734   1.075

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ASN  49           H        ASN  49  20.156  -0.397  -2.400
    2    HA   ASN  49           HA       ASN  49  19.476  -0.457  -5.117
    3    HB2  ASN  49           HB2      ASN  49  21.189   1.026  -4.188
    4    HB3  ASN  49           HB3      ASN  49  22.207  -0.356  -3.803
    5   HD21  ASN  49          HD21      ASN  49  23.940   0.159  -5.217
    6   HD22  ASN  49          HD22      ASN  49  23.776   0.200  -6.905

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLU  50           H        GLU  50  21.449  -2.690  -3.187
    2    HA   GLU  50           HA       GLU  50  22.102  -4.445  -5.329
    3    HB2  GLU  50           HB2      GLU  50  23.323  -4.448  -3.175
    4    HB3  GLU  50           HB3      GLU  50  21.880  -5.059  -2.367
    5    HG2  GLU  50           HG2      GLU  50  21.926  -7.086  -3.737
    6    HG3  GLU  50           HG3      GLU  50  23.301  -6.469  -4.650

  No H/Q in entry =           6
  In of MODEL   59
    1    H    ALA  51           H        ALA  51  19.472  -4.353  -2.974
    2    HA   ALA  51           HA       ALA  51  18.263  -6.805  -3.731
    3    HB3  ALA  51           HB1      ALA  51  16.694  -6.284  -2.156
    4    HB1  ALA  51           HB2      ALA  51  16.499  -4.632  -2.745
    5    HB2  ALA  51           HB3      ALA  51  17.863  -5.043  -1.705

  No H/Q in entry =           5
  In of MODEL   59
    1    H    HIS  52           H        HIS  52  17.714  -3.444  -4.743
    2    HA   HIS  52           HA       HIS  52  15.574  -3.931  -6.523
    3    HB2  HIS  52           HB2      HIS  52  16.232  -1.679  -5.733
    4    HB3  HIS  52           HB3      HIS  52  17.709  -1.790  -6.690
    5    HD1  HIS  52           HD1      HIS  52  17.337  -2.069  -9.354
    6    HD2  HIS  52           HD2      HIS  52  14.005  -0.836  -7.174
    7    HE1  HIS  52           HE1      HIS  52  15.694  -1.122 -11.032
    8    HE2  HIS  52           HE2      HIS  52  13.656  -0.365  -9.718

  No H/Q in entry =           8
  In of MODEL   59
    1    H    LEU  53           H        LEU  53  19.087  -3.985  -6.993
    2    HA   LEU  53           HA       LEU  53  19.110  -4.287  -9.796
    3    HB2  LEU  53           HB2      LEU  53  21.056  -5.094  -7.648
    4    HB3  LEU  53           HB3      LEU  53  21.348  -5.465  -9.345
    5    HG   LEU  53           HG       LEU  53  20.714  -2.656  -8.390
    6   HD11  LEU  53          HD11      LEU  53  23.357  -4.106  -8.598
    7   HD13  LEU  53          HD12      LEU  53  22.723  -3.178  -7.240
    8   HD12  LEU  53          HD13      LEU  53  23.250  -2.352  -8.701
    9   HD23  LEU  53          HD21      LEU  53  22.138  -2.207 -10.538
   10   HD22  LEU  53          HD22      LEU  53  20.463  -2.711 -10.732
   11   HD21  LEU  53          HD23      LEU  53  21.757  -3.872 -10.957

  No H/Q in entry =          11
  In of MODEL   59
    1    H    VAL  54           H        VAL  54  18.992  -6.685  -7.180
    2    HA   VAL  54           HA       VAL  54  19.065  -8.973  -8.852
    3    HB   VAL  54           HB       VAL  54  17.946  -8.547  -6.070
    4   HG12  VAL  54          HG11      VAL  54  18.234 -11.169  -6.082
    5   HG11  VAL  54          HG12      VAL  54  18.033 -10.989  -7.824
    6   HG13  VAL  54          HG13      VAL  54  16.763 -10.446  -6.729
    7   HG22  VAL  54          HG21      VAL  54  20.267  -8.369  -5.871
    8   HG21  VAL  54          HG22      VAL  54  20.575  -9.459  -7.221
    9   HG23  VAL  54          HG23      VAL  54  20.052 -10.106  -5.666

  No H/Q in entry =           9
  In of MODEL   59
    1    H    GLN  55           H        GLN  55  16.377  -7.039  -7.531
    2    HA   GLN  55           HA       GLN  55  14.322  -8.670  -8.590
    3    HB2  GLN  55           HB2      GLN  55  13.612  -7.142  -6.948
    4    HB3  GLN  55           HB3      GLN  55  14.416  -5.781  -7.727
    5    HG2  GLN  55           HG2      GLN  55  12.680  -5.426  -9.196
    6    HG3  GLN  55           HG3      GLN  55  12.333  -7.141  -9.371
    7   HE21  GLN  55          HE21      GLN  55  10.327  -7.667  -8.546
    8   HE22  GLN  55          HE22      GLN  55   9.578  -6.908  -7.226

  No H/Q in entry =           8
  In of MODEL   59
    1    H    THR  56           H        THR  56  16.085  -5.887  -9.956
    2    HA   THR  56           HA       THR  56  14.626  -5.495 -12.286
    3    HB   THR  56           HB       THR  56  17.648  -5.448 -12.159
    4    HG1  THR  56           HG1      THR  56  16.072  -4.224 -10.558
    5   HG21  THR  56          HG21      THR  56  15.543  -4.129 -13.867
    6   HG23  THR  56          HG22      THR  56  16.945  -5.068 -14.380
    7   HG22  THR  56          HG23      THR  56  17.164  -3.448 -13.715

  No H/Q in entry =           7
  In of MODEL   59
    1    H    LYS  57           H        LYS  57  17.251  -7.830 -11.714
    2    HA   LYS  57           HA       LYS  57  17.208  -9.013 -14.298
    3    HB2  LYS  57           HB2      LYS  57  19.017  -9.300 -12.584
    4    HB3  LYS  57           HB3      LYS  57  17.910 -10.272 -11.625
    5    HG2  LYS  57           HG2      LYS  57  17.739 -11.910 -13.449
    6    HG3  LYS  57           HG3      LYS  57  18.821 -10.938 -14.441
    7    HD2  LYS  57           HD2      LYS  57  20.617 -11.229 -12.762
    8    HD3  LYS  57           HD3      LYS  57  19.540 -12.225 -11.785
    9    HE2  LYS  57           HE2      LYS  57  19.351 -13.855 -13.630
   10    HE3  LYS  57           HE3      LYS  57  20.413 -12.866 -14.632
   11    HZ3  LYS  57           HZ1      LYS  57  22.205 -13.618 -13.588
   12    HZ2  LYS  57           HZ2      LYS  57  21.208 -14.837 -12.956
   13    HZ1  LYS  57           HZ3      LYS  57  21.515 -13.435 -12.050

  No H/Q in entry =          13
  In of MODEL   59
    1    H    LEU  58           H        LEU  58  15.451  -9.670 -11.306
    2    HA   LEU  58           HA       LEU  58  14.189 -12.024 -12.238
    3    HB2  LEU  58           HB2      LEU  58  13.443 -10.118 -10.025
    4    HB3  LEU  58           HB3      LEU  58  12.613 -11.644 -10.339
    5    HG   LEU  58           HG       LEU  58  15.595 -11.407  -9.816
    6   HD11  LEU  58          HD11      LEU  58  13.239 -11.801  -7.999
    7   HD13  LEU  58          HD12      LEU  58  14.707 -10.858  -7.749
    8   HD12  LEU  58          HD13      LEU  58  14.758 -12.616  -7.622
    9   HD22  LEU  58          HD21      LEU  58  15.440 -13.462 -10.851
   10   HD21  LEU  58          HD22      LEU  58  13.727 -13.651 -10.473
   11   HD23  LEU  58          HD23      LEU  58  14.945 -13.973  -9.238

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  59           H        ILE  59  13.553  -8.675 -12.898
    2    HA   ILE  59           HA       ILE  59  10.820  -9.284 -13.811
    3    HB   ILE  59           HB       ILE  59  11.664  -7.020 -12.603
    4   HG12  ILE  59          HG12      ILE  59   9.742  -6.859 -14.937
    5   HG13  ILE  59          HG13      ILE  59   9.324  -7.629 -13.428
    6   HG21  ILE  59          HG21      ILE  59  13.196  -6.631 -14.673
    7   HG23  ILE  59          HG22      ILE  59  12.242  -5.282 -14.098
    8   HG22  ILE  59          HG23      ILE  59  11.722  -6.201 -15.508
    9   HD11  ILE  59          HD11      ILE  59   9.857  -5.539 -12.209
   10   HD13  ILE  59          HD12      ILE  59   8.569  -5.305 -13.389
   11   HD12  ILE  59          HD13      ILE  59  10.206  -4.760 -13.753

  No H/Q in entry =          11
  In of MODEL   59
    1    H    GLU  60           H        GLU  60  14.020  -8.468 -15.101
    2    HA   GLU  60           HA       GLU  60  13.216  -8.046 -17.799
    3    HB2  GLU  60           HB2      GLU  60  15.468  -7.902 -18.264
    4    HB3  GLU  60           HB3      GLU  60  15.524  -7.663 -16.519
    5    HG2  GLU  60           HG2      GLU  60  15.836 -10.175 -16.292
    6    HG3  GLU  60           HG3      GLU  60  16.054 -10.227 -18.039

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLY  61           H        GLY  61  14.176 -10.948 -16.007
    2    HA3  GLY  61           HA2      GLY  61  13.587 -12.577 -18.410
    3    HA2  GLY  61           HA3      GLY  61  14.628 -13.078 -17.081

  No H/Q in entry =           3
  In of MODEL   59
    1    H    ASP  62           H        ASP  62  11.533 -11.493 -16.667
    2    HA   ASP  62           HA       ASP  62  10.587 -13.398 -14.821
    3    HB2  ASP  62           HB2      ASP  62   8.443 -12.183 -15.034
    4    HB3  ASP  62           HB3      ASP  62   9.812 -11.100 -14.800

  No H/Q in entry =           4
  In of MODEL   59
    1    H    ALA  63           H        ALA  63  10.042 -13.099 -18.332
    2    HA   ALA  63           HA       ALA  63   8.151 -15.357 -18.295
    3    HB1  ALA  63           HB1      ALA  63   7.881 -14.882 -20.684
    4    HB2  ALA  63           HB2      ALA  63   9.190 -13.704 -20.613
    5    HB3  ALA  63           HB3      ALA  63   7.684 -13.402 -19.744

  No H/Q in entry =           5
  In of MODEL   59
    1    H    GLY  64           H        GLY  64   8.535 -16.989 -20.119
    2    HA3  GLY  64           HA2      GLY  64  10.090 -18.281 -21.416
    3    HA2  GLY  64           HA3      GLY  64  11.383 -17.693 -20.377

  No H/Q in entry =           3
  In of MODEL   59
    1    H    GLU  65           H        GLU  65   9.302 -18.247 -18.083
    2    HA   GLU  65           HA       GLU  65  10.459 -20.693 -17.286
    3    HB2  GLU  65           HB2      GLU  65   8.042 -19.214 -16.255
    4    HB3  GLU  65           HB3      GLU  65   8.713 -20.651 -15.484
    5    HG2  GLU  65           HG2      GLU  65  10.859 -19.537 -15.179
    6    HG3  GLU  65           HG3      GLU  65  10.279 -18.118 -16.050

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLY  66           H        GLY  66   7.406 -19.934 -18.769
    2    HA3  GLY  66           HA2      GLY  66   7.067 -22.529 -19.882
    3    HA2  GLY  66           HA3      GLY  66   5.963 -22.268 -18.546

  No H/Q in entry =           3
  In of MODEL   59
    1    H    LYS  67           H        LYS  67   4.309 -20.766 -18.740
    2    HA   LYS  67           HA       LYS  67   3.432 -20.327 -21.469
    3    HB2  LYS  67           HB2      LYS  67   2.057 -20.071 -18.800
    4    HB3  LYS  67           HB3      LYS  67   1.274 -19.707 -20.342
    5    HG2  LYS  67           HG2      LYS  67   1.805 -21.979 -21.152
    6    HG3  LYS  67           HG3      LYS  67   2.583 -22.346 -19.614
    7    HD2  LYS  67           HD2      LYS  67   0.438 -21.989 -18.444
    8    HD3  LYS  67           HD3      LYS  67  -0.340 -21.636 -19.988
    9    HE2  LYS  67           HE2      LYS  67   0.237 -23.883 -20.809
   10    HE3  LYS  67           HE3      LYS  67   1.041 -24.241 -19.282
   11    HZ3  LYS  67           HZ1      LYS  67  -0.903 -24.891 -18.489
   12    HZ2  LYS  67           HZ2      LYS  67  -1.694 -24.438 -19.921
   13    HZ1  LYS  67           HZ3      LYS  67  -1.498 -23.313 -18.663

  No H/Q in entry =          13
  In of MODEL   59
    1    H    MET  68           H        MET  68   1.783 -18.291 -21.399
    2    HA   MET  68           HA       MET  68   3.392 -16.032 -21.877
    3    HB2  MET  68           HB2      MET  68   0.400 -16.299 -21.566
    4    HB3  MET  68           HB3      MET  68   1.221 -14.867 -22.188
    5    HG2  MET  68           HG2      MET  68   1.428 -17.647 -23.380
    6    HG3  MET  68           HG3      MET  68   0.438 -16.337 -24.023
    7    HE3  MET  68           HE1      MET  68   2.601 -13.724 -25.300
    8    HE2  MET  68           HE2      MET  68   2.694 -13.678 -23.541
    9    HE1  MET  68           HE3      MET  68   1.182 -14.133 -24.324

  No H/Q in entry =           9
  In of MODEL   59
    1    H    LYS  69           H        LYS  69   2.317 -17.157 -18.866
    2    HA   LYS  69           HA       LYS  69   1.841 -14.571 -17.681
    3    HB2  LYS  69           HB2      LYS  69   2.113 -17.255 -16.318
    4    HB3  LYS  69           HB3      LYS  69   1.421 -15.785 -15.627
    5    HG2  LYS  69           HG2      LYS  69   0.375 -17.116 -18.139
    6    HG3  LYS  69           HG3      LYS  69  -0.298 -17.388 -16.533
    7    HD2  LYS  69           HD2      LYS  69  -0.485 -14.791 -16.429
    8    HD3  LYS  69           HD3      LYS  69  -0.326 -14.873 -18.184
    9    HE2  LYS  69           HE2      LYS  69  -2.639 -15.024 -17.934
   10    HE3  LYS  69           HE3      LYS  69  -2.183 -16.727 -17.973
   11    HZ2  LYS  69           HZ1      LYS  69  -2.706 -15.079 -15.564
   12    HZ1  LYS  69           HZ2      LYS  69  -2.086 -16.658 -15.520
   13    HZ3  LYS  69           HZ3      LYS  69  -3.643 -16.370 -16.137

  No H/Q in entry =          13
  In of MODEL   59
    1    H    VAL  70           H        VAL  70   2.902 -14.539 -15.205
    2    HA   VAL  70           HA       VAL  70   5.842 -14.636 -15.546
    3    HB   VAL  70           HB       VAL  70   5.968 -12.473 -14.337
    4   HG13  VAL  70          HG11      VAL  70   5.291 -11.077 -16.221
    5   HG12  VAL  70          HG12      VAL  70   4.211 -12.342 -16.806
    6   HG11  VAL  70          HG13      VAL  70   5.955 -12.589 -16.838
    7   HG21  VAL  70          HG21      VAL  70   2.960 -12.763 -14.436
    8   HG23  VAL  70          HG22      VAL  70   3.700 -11.164 -14.376
    9   HG22  VAL  70          HG23      VAL  70   3.978 -12.312 -13.066

  No H/Q in entry =           9
  In of MODEL   59
    1    H    SER  71           H        SER  71   6.984 -14.517 -13.440
    2    HA   SER  71           HA       SER  71   6.081 -16.460 -11.597
    3    HB2  SER  71           HB2      SER  71   8.479 -15.729 -11.975
    4    HB3  SER  71           HB3      SER  71   8.106 -14.283 -11.039
    5    HG   SER  71           HG       SER  71   7.269 -16.628  -9.882

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LEU  72           H        LEU  72   4.659 -16.310  -9.993
    2    HA   LEU  72           HA       LEU  72   3.144 -13.979  -9.522
    3    HB2  LEU  72           HB2      LEU  72   3.395 -16.613  -8.107
    4    HB3  LEU  72           HB3      LEU  72   2.382 -15.325  -7.457
    5    HG   LEU  72           HG       LEU  72   2.135 -16.385 -10.293
    6   HD11  LEU  72          HD11      LEU  72   1.605 -17.982  -8.289
    7   HD13  LEU  72          HD12      LEU  72   0.419 -17.817  -9.581
    8   HD12  LEU  72          HD13      LEU  72   0.195 -16.947  -8.064
    9   HD23  LEU  72          HD21      LEU  72  -0.258 -15.342  -9.778
   10   HD22  LEU  72          HD22      LEU  72   1.047 -14.309 -10.338
   11   HD21  LEU  72          HD23      LEU  72   0.652 -14.374  -8.624

  No H/Q in entry =          11
  In of MODEL   59
    1    H    VAL  73           H        VAL  73   5.799 -15.459  -7.783
    2    HA   VAL  73           HA       VAL  73   5.783 -13.937  -5.443
    3    HB   VAL  73           HB       VAL  73   7.922 -14.809  -5.017
    4   HG11  VAL  73          HG11      VAL  73   6.004 -16.475  -5.439
    5   HG13  VAL  73          HG12      VAL  73   7.643 -17.124  -5.454
    6   HG12  VAL  73          HG13      VAL  73   6.801 -16.817  -6.972
    7   HG23  VAL  73          HG21      VAL  73   9.270 -15.810  -6.958
    8   HG22  VAL  73          HG22      VAL  73   9.186 -14.049  -6.889
    9   HG21  VAL  73          HG23      VAL  73   8.172 -14.937  -8.028

  No H/Q in entry =           9
  In of MODEL   59
    1    H    LEU  74           H        LEU  74   6.752 -13.040  -8.624
    2    HA   LEU  74           HA       LEU  74   8.727 -11.119  -8.142
    3    HB2  LEU  74           HB2      LEU  74   8.240 -11.850 -10.379
    4    HB3  LEU  74           HB3      LEU  74   6.583 -11.263 -10.259
    5    HG   LEU  74           HG       LEU  74   7.419  -8.947 -10.040
    6   HD11  LEU  74          HD11      LEU  74  10.078 -10.371 -10.178
    7   HD13  LEU  74          HD12      LEU  74   9.544  -9.162  -9.012
    8   HD12  LEU  74          HD13      LEU  74   9.920  -8.684 -10.667
    9   HD23  LEU  74          HD21      LEU  74   8.851 -10.060 -12.397
   10   HD22  LEU  74          HD22      LEU  74   7.741  -8.715 -12.281
   11   HD21  LEU  74          HD23      LEU  74   7.118 -10.349 -12.265

  No H/Q in entry =          11
  In of MODEL   59
    1    H    VAL  75           H        VAL  75   5.233 -10.687  -8.459
    2    HA   VAL  75           HA       VAL  75   5.179  -7.933  -7.857
    3    HB   VAL  75           HB       VAL  75   3.068 -10.055  -7.471
    4   HG13  VAL  75          HG11      VAL  75   2.619  -8.158  -5.959
    5   HG12  VAL  75          HG12      VAL  75   1.518  -8.088  -7.326
    6   HG11  VAL  75          HG13      VAL  75   2.913  -7.022  -7.271
    7   HG23  VAL  75          HG21      VAL  75   2.153  -8.999  -9.528
    8   HG22  VAL  75          HG22      VAL  75   3.767  -9.652  -9.799
    9   HG21  VAL  75          HG23      VAL  75   3.543  -7.917  -9.580

  No H/Q in entry =           9
  In of MODEL   59
    1    H    GLU  76           H        GLU  76   4.908 -10.817  -5.759
    2    HA   GLU  76           HA       GLU  76   4.479  -9.462  -3.327
    3    HB2  GLU  76           HB2      GLU  76   4.268 -11.925  -3.568
    4    HB3  GLU  76           HB3      GLU  76   6.000 -12.046  -3.830
    5    HG2  GLU  76           HG2      GLU  76   5.595 -12.631  -1.532
    6    HG3  GLU  76           HG3      GLU  76   6.338 -11.043  -1.518

  No H/Q in entry =           6
  In of MODEL   59
    1    H    ALA  77           H        ALA  77   7.511 -10.401  -4.923
    2    HA   ALA  77           HA       ALA  77   9.233  -9.391  -2.918
    3    HB2  ALA  77           HB1      ALA  77  10.960  -9.408  -4.714
    4    HB3  ALA  77           HB2      ALA  77   9.692  -9.762  -5.886
    5    HB1  ALA  77           HB3      ALA  77  10.060 -10.921  -4.611

  No H/Q in entry =           5
  In of MODEL   59
    1    H    GLN  78           H        GLN  78   7.833  -7.940  -5.812
    2    HA   GLN  78           HA       GLN  78   9.220  -5.480  -5.708
    3    HB2  GLN  78           HB2      GLN  78   7.898  -6.361  -7.660
    4    HB3  GLN  78           HB3      GLN  78   6.425  -5.981  -6.769
    5    HG2  GLN  78           HG2      GLN  78   7.095  -3.616  -6.661
    6    HG3  GLN  78           HG3      GLN  78   8.574  -3.989  -7.547
    7   HE21  GLN  78          HE21      GLN  78   6.651  -2.145  -8.605
    8   HE22  GLN  78          HE22      GLN  78   5.948  -2.841  -9.985

  No H/Q in entry =           8
  In of MODEL   59
    1    H    LEU  79           H        LEU  79   6.198  -6.584  -4.256
    2    HA   LEU  79           HA       LEU  79   5.246  -4.168  -3.226
    3    HB2  LEU  79           HB2      LEU  79   3.904  -6.202  -3.169
    4    HB3  LEU  79           HB3      LEU  79   5.049  -6.963  -2.067
    5    HG   LEU  79           HG       LEU  79   4.534  -5.322  -0.328
    6   HD13  LEU  79          HD11      LEU  79   4.087  -3.296  -1.364
    7   HD12  LEU  79          HD12      LEU  79   2.459  -3.801  -0.913
    8   HD11  LEU  79          HD13      LEU  79   3.022  -4.023  -2.568
    9   HD23  LEU  79          HD21      LEU  79   1.942  -5.779  -0.217
   10   HD22  LEU  79          HD22      LEU  79   3.064  -7.135  -0.125
   11   HD21  LEU  79          HD23      LEU  79   2.242  -6.778  -1.641

  No H/Q in entry =          11
  In of MODEL   59
    1    H    HIS  80           H        HIS  80   7.410  -6.542  -1.674
    2    HA   HIS  80           HA       HIS  80   7.740  -5.016   0.700
    3    HB2  HIS  80           HB2      HIS  80   9.034  -7.392  -0.522
    4    HB3  HIS  80           HB3      HIS  80   9.968  -6.514   0.691
    5    HD1  HIS  80           HD1      HIS  80   9.488  -7.155   3.035
    6    HD2  HIS  80           HD2      HIS  80   6.239  -7.948   0.547
    7    HE1  HIS  80           HE1      HIS  80   7.713  -8.241   4.493
    8    HE2  HIS  80           HE2      HIS  80   5.726  -8.728   2.985

  No H/Q in entry =           8
  In of MODEL   59
    1    H    LEU  81           H        LEU  81   9.716  -5.305  -2.231
    2    HA   LEU  81           HA       LEU  81  11.792  -3.597  -1.361
    3    HB2  LEU  81           HB2      LEU  81  10.837  -4.363  -4.120
    4    HB3  LEU  81           HB3      LEU  81  12.274  -3.378  -3.836
    5    HG   LEU  81           HG       LEU  81  11.853  -6.100  -2.573
    6   HD12  LEU  81          HD11      LEU  81  13.645  -6.744  -4.341
    7   HD11  LEU  81          HD12      LEU  81  13.093  -5.307  -5.201
    8   HD13  LEU  81          HD13      LEU  81  11.965  -6.617  -4.860
    9   HD23  LEU  81          HD21      LEU  81  14.485  -5.823  -2.579
   10   HD22  LEU  81          HD22      LEU  81  13.525  -5.055  -1.317
   11   HD21  LEU  81          HD23      LEU  81  14.106  -4.104  -2.684

  No H/Q in entry =          11
  In of MODEL   59
    1    H    MET  82           H        MET  82   8.863  -2.909  -3.270
    2    HA   MET  82           HA       MET  82   9.439  -0.189  -3.762
    3    HB2  MET  82           HB2      MET  82   6.857  -1.746  -3.623
    4    HB3  MET  82           HB3      MET  82   6.879  -0.020  -3.979
    5    HG2  MET  82           HG2      MET  82   8.436  -2.109  -5.538
    6    HG3  MET  82           HG3      MET  82   6.874  -1.461  -6.034
    7    HE3  MET  82           HE1      MET  82   7.364   1.993  -7.192
    8    HE2  MET  82           HE2      MET  82   7.000   1.764  -5.484
    9    HE1  MET  82           HE3      MET  82   6.309   0.670  -6.678

  No H/Q in entry =           9
  In of MODEL   59
    1    H    THR  83           H        THR  83   7.645  -1.774  -1.150
    2    HA   THR  83           HA       THR  83   6.840   0.580   0.195
    3    HB   THR  83           HB       THR  83   6.698  -1.003   2.206
    4    HG1  THR  83           HG1      THR  83   7.424  -2.962   1.961
    5   HG22  THR  83          HG21      THR  83   5.010  -2.536   0.744
    6   HG21  THR  83          HG22      THR  83   5.247  -1.205  -0.383
    7   HG23  THR  83          HG23      THR  83   4.625  -0.889   1.237

  No H/Q in entry =           7
  In of MODEL   59
    1    H    SER  84           H        SER  84   9.636  -1.563   0.683
    2    HA   SER  84           HA       SER  84  10.734  -0.159   2.869
    3    HB2  SER  84           HB2      SER  84  11.943  -2.010   0.825
    4    HB3  SER  84           HB3      SER  84  12.911  -1.278   2.102
    5    HG   SER  84           HG       SER  84  10.613  -2.934   2.372

  No H/Q in entry =           5
  In of MODEL   59
    1    H    MET  85           H        MET  85  11.463   0.108  -0.624
    2    HA   MET  85           HA       MET  85  13.493   2.041  -0.379
    3    HB2  MET  85           HB2      MET  85  13.071   0.782  -2.449
    4    HB3  MET  85           HB3      MET  85  11.545   1.641  -2.659
    5    HG2  MET  85           HG2      MET  85  12.754   3.785  -2.778
    6    HG3  MET  85           HG3      MET  85  14.282   2.941  -2.546
    7    HE3  MET  85           HE1      MET  85  13.674   4.702  -5.723
    8    HE2  MET  85           HE2      MET  85  15.139   3.734  -5.850
    9    HE1  MET  85           HE3      MET  85  14.721   4.481  -4.313

  No H/Q in entry =           9
  In of MODEL   59
    1    H    LEU  86           H        LEU  86  10.005   2.432  -0.858
    2    HA   LEU  86           HA       LEU  86   9.983   5.247  -1.025
    3    HB2  LEU  86           HB2      LEU  86   8.109   3.619  -1.594
    4    HB3  LEU  86           HB3      LEU  86   7.792   3.525   0.138
    5    HG   LEU  86           HG       LEU  86   7.670   6.088   0.100
    6   HD11  LEU  86          HD11      LEU  86   8.417   5.654  -2.611
    7   HD13  LEU  86          HD12      LEU  86   8.011   7.184  -1.839
    8   HD12  LEU  86          HD13      LEU  86   6.754   6.245  -2.639
    9   HD23  LEU  86          HD21      LEU  86   5.502   4.778  -1.552
   10   HD22  LEU  86          HD22      LEU  86   5.342   6.034  -0.328
   11   HD21  LEU  86          HD23      LEU  86   5.719   4.381   0.153

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ALA  87           H        ALA  87   9.505   3.062   1.714
    2    HA   ALA  87           HA       ALA  87   9.003   4.974   3.697
    3    HB1  ALA  87           HB1      ALA  87   9.765   2.142   3.590
    4    HB3  ALA  87           HB2      ALA  87   8.662   2.966   4.689
    5    HB2  ALA  87           HB3      ALA  87  10.394   2.969   5.019

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ARG  88           H        ARG  88  12.056   3.506   2.684
    2    HA   ARG  88           HA       ARG  88  13.702   4.849   4.510
    3    HB2  ARG  88           HB2      ARG  88  14.327   2.873   3.091
    4    HB3  ARG  88           HB3      ARG  88  14.486   3.970   1.722
    5    HG2  ARG  88           HG2      ARG  88  15.996   5.250   3.663
    6    HG3  ARG  88           HG3      ARG  88  16.292   3.554   4.030
    7    HD2  ARG  88           HD2      ARG  88  17.539   3.247   2.172
    8    HD3  ARG  88           HD3      ARG  88  16.408   4.142   1.152
    9    HE   ARG  88           HE       ARG  88  18.827   5.162   2.185
   10   HH21  ARG  88          HH11      ARG  88  19.206   7.376   1.998
   11   HH22  ARG  88          HH12      ARG  88  17.871   8.470   1.872
   12   HH11  ARG  88          HH21      ARG  88  15.498   5.969   1.939
   13   HH12  ARG  88          HH22      ARG  88  15.770   7.671   1.814

  No H/Q in entry =          13
  In of MODEL   59
    1    H    GLU  89           H        GLU  89  12.715   5.779   1.199
    2    HA   GLU  89           HA       GLU  89  14.298   8.115   1.041
    3    HB2  GLU  89           HB2      GLU  89  13.121   7.103  -0.902
    4    HB3  GLU  89           HB3      GLU  89  11.591   7.665  -0.228
    5    HG2  GLU  89           HG2      GLU  89  12.328   9.992  -0.385
    6    HG3  GLU  89           HG3      GLU  89  13.919   9.479  -0.938

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LEU  90           H        LEU  90  10.971   7.653   2.197
    2    HA   LEU  90           HA       LEU  90  10.504  10.391   2.790
    3    HB2  LEU  90           HB2      LEU  90   9.277   7.831   3.815
    4    HB3  LEU  90           HB3      LEU  90   8.675   9.434   4.251
    5    HG   LEU  90           HG       LEU  90   9.055   8.562   1.374
    6   HD12  LEU  90          HD11      LEU  90   6.517   8.274   1.456
    7   HD11  LEU  90          HD12      LEU  90   6.687   8.252   3.212
    8   HD13  LEU  90          HD13      LEU  90   7.477   7.014   2.234
    9   HD22  LEU  90          HD21      LEU  90   8.797  10.875   1.315
   10   HD21  LEU  90          HD22      LEU  90   7.824  10.916   2.783
   11   HD23  LEU  90          HD23      LEU  90   7.105  10.380   1.265

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  91           H        ILE  91  11.740   7.680   4.688
    2    HA   ILE  91           HA       ILE  91  11.923   9.030   7.162
    3    HB   ILE  91           HB       ILE  91  13.430   6.673   6.013
    4   HG12  ILE  91          HG12      ILE  91  11.436   6.861   8.291
    5   HG13  ILE  91          HG13      ILE  91  10.947   6.596   6.618
    6   HG22  ILE  91          HG21      ILE  91  13.919   6.438   8.648
    7   HG21  ILE  91          HG22      ILE  91  13.871   8.199   8.557
    8   HG23  ILE  91          HG23      ILE  91  15.027   7.297   7.578
    9   HD13  ILE  91          HD11      ILE  91  11.916   4.479   6.528
   10   HD12  ILE  91          HD12      ILE  91  11.338   4.538   8.193
   11   HD11  ILE  91          HD13      ILE  91  13.041   4.826   7.842

  No H/Q in entry =          11
  In of MODEL   59
    1    H    THR  92           H        THR  92  14.114   8.840   4.390
    2    HA   THR  92           HA       THR  92  16.311  10.193   5.538
    3    HB   THR  92           HB       THR  92  15.298  10.098   2.685
    4    HG1  THR  92           HG1      THR  92  16.103   8.186   3.073
    5   HG22  THR  92          HG21      THR  92  17.876  10.750   2.373
    6   HG21  THR  92          HG22      THR  92  17.594  11.568   3.909
    7   HG23  THR  92          HG23      THR  92  16.618  11.978   2.499

  No H/Q in entry =           7
  In of MODEL   59
    1    H    GLU  93           H        GLU  93  13.427  11.401   3.840
    2    HA   GLU  93           HA       GLU  93  14.066  14.151   3.963
    3    HB2  GLU  93           HB2      GLU  93  11.341  12.821   3.993
    4    HB3  GLU  93           HB3      GLU  93  11.652  14.518   3.628
    5    HG2  GLU  93           HG2      GLU  93  12.941  12.263   2.077
    6    HG3  GLU  93           HG3      GLU  93  11.402  12.972   1.607

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LEU  94           H        LEU  94  12.309  12.011   6.178
    2    HA   LEU  94           HA       LEU  94  11.547  13.960   8.071
    3    HB2  LEU  94           HB2      LEU  94  12.078  10.995   8.325
    4    HB3  LEU  94           HB3      LEU  94  11.534  11.972   9.685
    5    HG   LEU  94           HG       LEU  94  10.028  12.061   7.070
    6   HD11  LEU  94          HD11      LEU  94  10.093   9.829   9.062
    7   HD13  LEU  94          HD12      LEU  94   9.776   9.781   7.330
    8   HD12  LEU  94          HD13      LEU  94   8.515  10.312   8.442
    9   HD23  LEU  94          HD21      LEU  94   8.129  12.483   8.689
   10   HD22  LEU  94          HD22      LEU  94   9.388  13.717   8.721
   11   HD21  LEU  94          HD23      LEU  94   9.317  12.495   9.990

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  95           H        ILE  95  14.488  11.986   7.798
    2    HA   ILE  95           HA       ILE  95  15.691  12.877  10.206
    3    HB   ILE  95           HB       ILE  95  16.890  11.802   7.642
    4   HG12  ILE  95          HG12      ILE  95  16.600  10.591  10.406
    5   HG13  ILE  95          HG13      ILE  95  15.418  10.358   9.120
    6   HG21  ILE  95          HG21      ILE  95  18.181  12.575  10.277
    7   HG23  ILE  95          HG22      ILE  95  18.638  13.104   8.656
    8   HG22  ILE  95          HG23      ILE  95  18.922  11.437   9.154
    9   HD13  ILE  95          HD11      ILE  95  16.867   9.063   7.837
   10   HD12  ILE  95          HD12      ILE  95  17.347   8.598   9.467
   11   HD11  ILE  95          HD13      ILE  95  18.310   9.767   8.565

  No H/Q in entry =          11
  In of MODEL   59
    1    H    GLU  96           H        GLU  96  15.835  14.125   6.877
    2    HA   GLU  96           HA       GLU  96  17.719  16.172   7.348
    3    HB2  GLU  96           HB2      GLU  96  17.024  15.532   5.091
    4    HB3  GLU  96           HB3      GLU  96  15.392  16.113   5.409
    5    HG2  GLU  96           HG2      GLU  96  15.987  18.236   4.873
    6    HG3  GLU  96           HG3      GLU  96  17.296  18.210   6.043

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LEU  97           H        LEU  97  14.209  16.038   7.808
    2    HA   LEU  97           HA       LEU  97  13.841  18.774   8.467
    3    HB2  LEU  97           HB2      LEU  97  12.289  16.270   9.082
    4    HB3  LEU  97           HB3      LEU  97  11.806  17.821   9.766
    5    HG   LEU  97           HG       LEU  97  12.256  17.413   6.795
    6   HD12  LEU  97          HD11      LEU  97   9.730  17.325   6.699
    7   HD11  LEU  97          HD12      LEU  97   9.736  17.116   8.448
    8   HD13  LEU  97          HD13      LEU  97  10.488  15.902   7.413
    9   HD23  LEU  97          HD21      LEU  97  10.550  19.404   6.853
   10   HD22  LEU  97          HD22      LEU  97  12.240  19.735   7.232
   11   HD21  LEU  97          HD23      LEU  97  11.060  19.576   8.532

  No H/Q in entry =          11
  In of MODEL   59
    1    H    HIS  98           H        HIS  98  14.636  15.925  10.441
    2    HA   HIS  98           HA       HIS  98  14.521  17.175  12.965
    3    HB2  HIS  98           HB2      HIS  98  16.225  14.896  11.936
    4    HB3  HIS  98           HB3      HIS  98  16.247  15.425  13.620
    5    HD1  HIS  98           HD1      HIS  98  13.999  13.844  11.039
    6    HD2  HIS  98           HD2      HIS  98  13.944  14.744  15.109
    7    HE1  HIS  98           HE1      HIS  98  11.964  12.677  12.004
    8    HE2  HIS  98           HE2      HIS  98  11.910  13.217  14.479

  No H/Q in entry =           8
  In of MODEL   59
    1    H    GLU  99           H        GLU  99  17.050  17.032  10.506
    2    HA   GLU  99           HA       GLU  99  19.070  18.324  12.024
    3    HB2  GLU  99           HB2      GLU  99  19.510  17.040   9.944
    4    HB3  GLU  99           HB3      GLU  99  18.712  18.312   9.017
    5    HG2  GLU  99           HG2      GLU  99  20.354  19.953   9.802
    6    HG3  GLU  99           HG3      GLU  99  21.123  18.733  10.811

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LYS 100           H        LYS 100  16.545  19.538   9.837
    2    HA   LYS 100           HA       LYS 100  17.388  22.262   9.988
    3    HB2  LYS 100           HB2      LYS 100  14.728  21.019   9.250
    4    HB3  LYS 100           HB3      LYS 100  15.055  22.753   9.166
    5    HG2  LYS 100           HG2      LYS 100  17.006  22.280   7.679
    6    HG3  LYS 100           HG3      LYS 100  16.565  20.570   7.692
    7    HD2  LYS 100           HD2      LYS 100  14.370  21.120   6.714
    8    HD3  LYS 100           HD3      LYS 100  14.794  22.833   6.709
    9    HE2  LYS 100           HE2      LYS 100  16.732  22.328   5.229
   10    HE3  LYS 100           HE3      LYS 100  16.238  20.632   5.191
   11    HZ1  LYS 100           HZ1      LYS 100  14.442  22.858   4.384
   12    HZ3  LYS 100           HZ2      LYS 100  14.228  21.193   4.115
   13    HZ2  LYS 100           HZ3      LYS 100  15.445  22.040   3.287

  No H/Q in entry =          13
  In of MODEL   59
    1    H    LEU 101           H        LEU 101  15.276  20.239  11.961
    2    HA   LEU 101           HA       LEU 101  14.158  22.318  13.561
    3    HB2  LEU 101           HB2      LEU 101  14.555  19.359  13.925
    4    HB3  LEU 101           HB3      LEU 101  14.047  20.341  15.296
    5    HG   LEU 101           HG       LEU 101  12.607  20.467  12.641
    6   HD12  LEU 101          HD11      LEU 101  10.934  18.924  13.917
    7   HD11  LEU 101          HD12      LEU 101  12.330  18.482  14.896
    8   HD13  LEU 101          HD13      LEU 101  12.343  18.185  13.157
    9   HD21  LEU 101          HD21      LEU 101  11.989  21.255  15.503
   10   HD23  LEU 101          HD22      LEU 101  10.714  21.057  14.303
   11   HD22  LEU 101          HD23      LEU 101  11.966  22.273  14.060

  No H/Q in entry =          11
  In of MODEL   59
    1    H    LYS 102           H        LYS 102  17.291  21.661  13.092
    2    HA   LYS 102           HA       LYS 102  19.161  22.495  14.152
    3    HB2  LYS 102           HB2      LYS 102  17.383  24.034  15.310
    4    HB3  LYS 102           HB3      LYS 102  17.585  22.960  16.680
    5    HG2  LYS 102           HG2      LYS 102  19.500  24.946  15.503
    6    HG3  LYS 102           HG3      LYS 102  19.128  24.629  17.184
    7    HD2  LYS 102           HD2      LYS 102  20.748  22.698  15.473
    8    HD3  LYS 102           HD3      LYS 102  21.468  24.004  16.406
    9    HE2  LYS 102           HE2      LYS 102  21.036  21.457  17.365
   10    HE3  LYS 102           HE3      LYS 102  21.287  22.890  18.362
   11    HZ2  LYS 102           HZ1      LYS 102  19.303  21.635  18.992
   12    HZ1  LYS 102           HZ2      LYS 102  18.649  21.884  17.450
   13    HZ3  LYS 102           HZ3      LYS 102  18.911  23.204  18.480

  No H/Q in entry =          13
  In of MODEL   59
    1    H    ALA 103           H        ALA 103  17.085  20.911  16.585
    2    HA   ALA 103           HA       ALA 103  18.807  19.663  18.217
    3    HB2  ALA 103           HB1      ALA 103  17.189  17.682  18.216
    4    HB1  ALA 103           HB2      ALA 103  16.297  18.557  16.971
    5    HB3  ALA 103           HB3      ALA 103  16.501  19.266  18.571

  No H/Q in entry =           5
  In of MODEL   59
    1    H1   ALA   1           H3       ALA   1  -1.929  -6.639 -21.359
    2    H2   ALA   1           H2       ALA   1  -2.744  -8.063 -20.906
    3    H3   ALA   1           H1       ALA   1  -1.142  -8.137 -21.476
    4    HA   ALA   1           HA       ALA   1  -2.002  -8.581 -23.467
    5    HB1  ALA   1           HB1      ALA   1  -4.147  -9.265 -22.978
    6    HB2  ALA   1           HB2      ALA   1  -4.567  -7.743 -23.764
    7    HB3  ALA   1           HB3      ALA   1  -4.491  -7.834 -22.006

  No H/Q in entry =           7
  In of MODEL   59
    1    H    GLU   2           H        GLU   2  -2.829  -7.366 -25.443
    2    HA   GLU   2           HA       GLU   2  -1.404  -5.372 -26.322
    3    HB2  GLU   2           HB2      GLU   2  -4.415  -5.385 -26.613
    4    HB3  GLU   2           HB3      GLU   2  -3.289  -4.536 -27.668
    5    HG2  GLU   2           HG2      GLU   2  -2.828  -6.428 -28.837
    6    HG3  GLU   2           HG3      GLU   2  -2.533  -7.346 -27.368

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLU   3           H        GLU   3  -4.534  -4.066 -25.387
    2    HA   GLU   3           HA       GLU   3  -3.438  -1.531 -24.754
    3    HB2  GLU   3           HB2      GLU   3  -6.145  -2.802 -24.405
    4    HB3  GLU   3           HB3      GLU   3  -5.814  -1.195 -23.752
    5    HG2  GLU   3           HG2      GLU   3  -5.461  -0.263 -25.876
    6    HG3  GLU   3           HG3      GLU   3  -5.099  -1.821 -26.613

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LEU   4           H        LEU   4  -5.050  -3.875 -22.573
    2    HA   LEU   4           HA       LEU   4  -4.643  -2.667 -20.178
    3    HB2  LEU   4           HB2      LEU   4  -4.155  -5.614 -20.669
    4    HB3  LEU   4           HB3      LEU   4  -4.534  -4.870 -19.117
    5    HG   LEU   4           HG       LEU   4  -6.330  -4.899 -21.566
    6   HD13  LEU   4          HD11      LEU   4  -7.543  -6.601 -20.567
    7   HD12  LEU   4          HD12      LEU   4  -7.036  -6.159 -18.937
    8   HD11  LEU   4          HD13      LEU   4  -5.924  -7.016 -20.004
    9   HD23  LEU   4          HD21      LEU   4  -7.983  -4.069 -19.679
   10   HD22  LEU   4          HD22      LEU   4  -6.932  -2.912 -20.492
   11   HD21  LEU   4          HD23      LEU   4  -6.502  -3.518 -18.893

  No H/Q in entry =          11
  In of MODEL   59
    1    H    GLU   5           H        GLU   5  -2.193  -4.543 -21.942
    2    HA   GLU   5           HA       GLU   5  -0.186  -4.304 -19.921
    3    HB2  GLU   5           HB2      GLU   5  -0.175  -6.063 -21.692
    4    HB3  GLU   5           HB3      GLU   5   0.167  -4.815 -22.889
    5    HG2  GLU   5           HG2      GLU   5   2.247  -4.236 -21.725
    6    HG3  GLU   5           HG3      GLU   5   1.906  -5.440 -20.484

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLU   6           H        GLU   6  -0.819  -2.563 -22.951
    2    HA   GLU   6           HA       GLU   6   1.385  -0.770 -22.692
    3    HB2  GLU   6           HB2      GLU   6  -1.192  -0.603 -24.272
    4    HB3  GLU   6           HB3      GLU   6   0.113   0.579 -24.395
    5    HG2  GLU   6           HG2      GLU   6   0.445  -2.395 -24.879
    6    HG3  GLU   6           HG3      GLU   6   0.232  -1.197 -26.155

  No H/Q in entry =           6
  In of MODEL   59
    1    H    VAL   7           H        VAL   7  -1.945  -0.790 -21.618
    2    HA   VAL   7           HA       VAL   7  -2.112   1.921 -20.765
    3    HB   VAL   7           HB       VAL   7  -3.610  -0.576 -19.929
    4   HG11  VAL   7          HG11      VAL   7  -3.928   2.314 -19.096
    5   HG13  VAL   7          HG12      VAL   7  -3.844   0.882 -18.070
    6   HG12  VAL   7          HG13      VAL   7  -5.280   1.182 -19.047
    7   HG21  VAL   7          HG21      VAL   7  -3.769   0.517 -22.310
    8   HG23  VAL   7          HG22      VAL   7  -4.686   1.777 -21.483
    9   HG22  VAL   7          HG23      VAL   7  -5.260   0.109 -21.460

  No H/Q in entry =           9
  In of MODEL   59
    1    H    VAL   8           H        VAL   8  -1.162  -1.090 -19.147
    2    HA   VAL   8           HA       VAL   8  -0.802  -0.031 -16.548
    3    HB   VAL   8           HB       VAL   8   0.429  -2.394 -17.973
    4   HG11  VAL   8          HG11      VAL   8   0.933  -1.297 -15.207
    5   HG13  VAL   8          HG12      VAL   8   2.105  -1.848 -16.403
    6   HG12  VAL   8          HG13      VAL   8   1.105  -3.018 -15.545
    7   HG22  VAL   8          HG21      VAL   8  -1.547  -3.352 -17.347
    8   HG21  VAL   8          HG22      VAL   8  -2.018  -1.890 -16.488
    9   HG23  VAL   8          HG23      VAL   8  -1.071  -3.124 -15.665

  No H/Q in entry =           9
  In of MODEL   59
    1    H    MET   9           H        MET   9   1.417  -0.355 -19.318
    2    HA   MET   9           HA       MET   9   3.732   0.640 -18.071
    3    HB2  MET   9           HB2      MET   9   2.760   0.708 -20.927
    4    HB3  MET   9           HB3      MET   9   4.297   1.432 -20.456
    5    HG2  MET   9           HG2      MET   9   5.018  -0.736 -19.502
    6    HG3  MET   9           HG3      MET   9   3.489  -1.457 -20.009
    7    HE1  MET   9           HE1      MET   9   6.366   0.673 -20.974
    8    HE3  MET   9           HE2      MET   9   6.895   0.158 -22.573
    9    HE2  MET   9           HE3      MET   9   7.201  -0.872 -21.178

  No H/Q in entry =           9
  In of MODEL   59
    1    H    GLY  10           H        GLY  10   1.062   2.300 -19.715
    2    HA3  GLY  10           HA2      GLY  10   2.075   4.934 -19.465
    3    HA2  GLY  10           HA3      GLY  10   0.376   4.506 -19.657

  No H/Q in entry =           3
  In of MODEL   59
    1    H    LEU  11           H        LEU  11  -0.030   2.973 -17.376
    2    HA   LEU  11           HA       LEU  11  -0.506   4.947 -15.400
    3    HB2  LEU  11           HB2      LEU  11  -0.492   1.930 -15.261
    4    HB3  LEU  11           HB3      LEU  11  -0.970   2.954 -13.909
    5    HG   LEU  11           HG       LEU  11  -2.232   3.107 -16.659
    6   HD13  LEU  11          HD11      LEU  11  -2.848   0.970 -15.911
    7   HD12  LEU  11          HD12      LEU  11  -4.175   1.984 -15.347
    8   HD11  LEU  11          HD13      LEU  11  -2.917   1.474 -14.222
    9   HD22  LEU  11          HD21      LEU  11  -2.776   5.127 -15.636
   10   HD21  LEU  11          HD22      LEU  11  -2.698   4.450 -14.010
   11   HD23  LEU  11          HD23      LEU  11  -4.090   4.116 -15.041

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  12           H        ILE  12   1.989   2.436 -15.680
    2    HA   ILE  12           HA       ILE  12   3.227   2.937 -13.185
    3    HB   ILE  12           HB       ILE  12   4.435   1.887 -15.766
    4   HG12  ILE  12          HG12      ILE  12   2.416   0.684 -14.610
    5   HG13  ILE  12          HG13      ILE  12   3.798  -0.274 -15.102
    6   HG23  ILE  12          HG21      ILE  12   6.224   2.577 -14.297
    7   HG22  ILE  12          HG22      ILE  12   6.107   0.821 -14.191
    8   HG21  ILE  12          HG23      ILE  12   5.442   1.828 -12.906
    9   HD13  ILE  12          HD11      ILE  12   4.632  -0.285 -12.823
   10   HD12  ILE  12          HD12      ILE  12   2.947  -0.803 -12.811
   11   HD11  ILE  12          HD13      ILE  12   3.368   0.824 -12.322

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  13           H        ILE  13   3.821   4.208 -16.441
    2    HA   ILE  13           HA       ILE  13   5.997   5.884 -15.727
    3    HB   ILE  13           HB       ILE  13   3.947   6.009 -17.953
    4   HG12  ILE  13          HG12      ILE  13   5.760   4.143 -17.705
    5   HG13  ILE  13          HG13      ILE  13   5.518   4.902 -19.274
    6   HG23  ILE  13          HG21      ILE  13   4.646   8.260 -17.790
    7   HG22  ILE  13          HG22      ILE  13   5.694   7.586 -19.034
    8   HG21  ILE  13          HG23      ILE  13   6.309   7.817 -17.398
    9   HD13  ILE  13          HD11      ILE  13   7.526   6.116 -19.139
   10   HD12  ILE  13          HD12      ILE  13   7.953   4.626 -18.305
   11   HD11  ILE  13          HD13      ILE  13   7.539   6.062 -17.377

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ASN  14           H        ASN  14   2.497   6.445 -15.958
    2    HA   ASN  14           HA       ASN  14   2.512   9.188 -15.305
    3    HB2  ASN  14           HB2      ASN  14   0.581   7.586 -16.126
    4    HB3  ASN  14           HB3      ASN  14   0.273   7.403 -14.404
    5   HD21  ASN  14          HD21      ASN  14  -1.739   8.605 -15.810
    6   HD22  ASN  14          HD22      ASN  14  -1.768  10.278 -15.533

  No H/Q in entry =           6
  In of MODEL   59
    1    H    SER  15           H        SER  15   2.184   6.305 -13.242
    2    HA   SER  15           HA       SER  15   1.926   7.666 -10.783
    3    HB2  SER  15           HB2      SER  15   2.446   5.565  -9.751
    4    HB3  SER  15           HB3      SER  15   1.596   5.169 -11.240
    5    HG   SER  15           HG       SER  15   4.098   4.544 -10.490

  No H/Q in entry =           5
  In of MODEL   59
    1    H    GLY  16           H        GLY  16   4.764   6.527 -12.576
    2    HA3  GLY  16           HA2      GLY  16   6.721   7.237 -10.660
    3    HA2  GLY  16           HA3      GLY  16   7.004   7.039 -12.388

  No H/Q in entry =           3
  In of MODEL   59
    1    H    GLN  17           H        GLN  17   5.340   9.033 -13.423
    2    HA   GLN  17           HA       GLN  17   6.962  11.345 -13.117
    3    HB2  GLN  17           HB2      GLN  17   4.193  10.971 -14.292
    4    HB3  GLN  17           HB3      GLN  17   5.079  12.496 -14.364
    5    HG2  GLN  17           HG2      GLN  17   6.130   9.860 -15.427
    6    HG3  GLN  17           HG3      GLN  17   5.369  11.101 -16.420
    7   HE21  GLN  17          HE21      GLN  17   8.349   9.989 -15.845
    8   HE22  GLN  17          HE22      GLN  17   9.242  11.433 -15.867

  No H/Q in entry =           8
  In of MODEL   59
    1    H    ALA  18           H        ALA  18   3.857  10.374 -11.744
    2    HA   ALA  18           HA       ALA  18   3.186  12.767 -10.457
    3    HB1  ALA  18           HB1      ALA  18   2.012  10.332 -10.682
    4    HB2  ALA  18           HB2      ALA  18   1.496  11.555  -9.523
    5    HB3  ALA  18           HB3      ALA  18   2.569  10.251  -9.011

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ARG  19           H        ARG  19   5.024   9.965  -9.212
    2    HA   ARG  19           HA       ARG  19   5.601  11.099  -6.689
    3    HB2  ARG  19           HB2      ARG  19   5.968   8.692  -7.233
    4    HB3  ARG  19           HB3      ARG  19   7.322   9.161  -8.265
    5    HG2  ARG  19           HG2      ARG  19   8.478  10.171  -6.348
    6    HG3  ARG  19           HG3      ARG  19   7.106   9.800  -5.305
    7    HD2  ARG  19           HD2      ARG  19   8.843   8.133  -4.973
    8    HD3  ARG  19           HD3      ARG  19   7.448   7.379  -5.750
    9    HE   ARG  19           HE       ARG  19   9.147   8.180  -7.809
   10   HH21  ARG  19          HH11      ARG  19  10.675   6.754  -8.683
   11   HH22  ARG  19          HH12      ARG  19  11.206   5.392  -7.760
   12   HH11  ARG  19          HH21      ARG  19   9.211   6.133  -5.043
   13   HH12  ARG  19          HH22      ARG  19  10.374   5.040  -5.698

  No H/Q in entry =          13
  In of MODEL   59
    1    H    SER  20           H        SER  20   7.389  11.116  -9.755
    2    HA   SER  20           HA       SER  20   9.665  12.489  -8.945
    3    HB2  SER  20           HB2      SER  20   9.260  11.487 -11.223
    4    HB3  SER  20           HB3      SER  20   8.263  12.890 -11.592
    5    HG   SER  20           HG       SER  20  10.665  12.867 -12.105

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LEU  21           H        LEU  21   6.576  13.816 -10.105
    2    HA   LEU  21           HA       LEU  21   7.294  16.549  -9.872
    3    HB2  LEU  21           HB2      LEU  21   4.604  15.167  -9.776
    4    HB3  LEU  21           HB3      LEU  21   4.798  16.918  -9.768
    5    HG   LEU  21           HG       LEU  21   5.945  15.120 -11.924
    6   HD13  LEU  21          HD11      LEU  21   3.612  14.861 -12.172
    7   HD12  LEU  21          HD12      LEU  21   4.002  16.187 -13.269
    8   HD11  LEU  21          HD13      LEU  21   3.287  16.528 -11.694
    9   HD21  LEU  21          HD21      LEU  21   5.771  18.093 -11.473
   10   HD23  LEU  21          HD22      LEU  21   5.742  17.491 -13.128
   11   HD22  LEU  21          HD23      LEU  21   7.124  17.152 -12.098

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ALA  22           H        ALA  22   5.766  14.271  -7.622
    2    HA   ALA  22           HA       ALA  22   5.212  16.076  -5.539
    3    HB3  ALA  22           HB1      ALA  22   4.412  13.697  -5.708
    4    HB2  ALA  22           HB2      ALA  22   5.022  14.151  -4.117
    5    HB1  ALA  22           HB3      ALA  22   6.020  13.182  -5.203

  No H/Q in entry =           5
  In of MODEL   59
    1    H    TYR  23           H        TYR  23   8.109  14.007  -6.017
    2    HA   TYR  23           HA       TYR  23   9.530  14.992  -3.772
    3    HB2  TYR  23           HB2      TYR  23  10.274  12.979  -4.949
    4    HB3  TYR  23           HB3      TYR  23  10.587  13.921  -6.406
    5    HD1  TYR  23           HD1      TYR  23  11.571  13.576  -2.819
    6    HD2  TYR  23           HD2      TYR  23  12.648  15.033  -6.714
    7    HE1  TYR  23           HE1      TYR  23  13.845  14.114  -1.989
    8    HE2  TYR  23           HE2      TYR  23  14.922  15.572  -5.884
    9    HH   TYR  23           HH       TYR  23  15.944  14.676  -2.616

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ALA  24           H        ALA  24   9.331  16.121  -7.131
    2    HA   ALA  24           HA       ALA  24  11.261  18.176  -6.891
    3    HB2  ALA  24           HB1      ALA  24  10.798  18.257  -9.095
    4    HB3  ALA  24           HB2      ALA  24   9.258  19.028  -8.717
    5    HB1  ALA  24           HB3      ALA  24   9.355  17.274  -8.858

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ALA  25           H        ALA  25   7.786  18.039  -6.237
    2    HA   ALA  25           HA       ALA  25   7.351  20.761  -5.649
    3    HB1  ALA  25           HB1      ALA  25   5.659  18.788  -5.845
    4    HB2  ALA  25           HB2      ALA  25   5.321  20.075  -4.686
    5    HB3  ALA  25           HB3      ALA  25   5.994  18.541  -4.130

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LEU  26           H        LEU  26   8.400  18.054  -3.624
    2    HA   LEU  26           HA       LEU  26   8.549  19.470  -1.180
    3    HB2  LEU  26           HB2      LEU  26   8.610  17.053  -1.189
    4    HB3  LEU  26           HB3      LEU  26  10.071  17.045  -2.174
    5    HG   LEU  26           HG       LEU  26  11.319  18.135  -0.339
    6   HD12  LEU  26          HD11      LEU  26  10.115  18.148   1.932
    7   HD11  LEU  26          HD12      LEU  26   8.617  18.036   1.011
    8   HD13  LEU  26          HD13      LEU  26   9.679  19.428   0.800
    9   HD21  LEU  26          HD21      LEU  26   9.759  15.684   0.535
   10   HD23  LEU  26          HD22      LEU  26  11.289  16.221   1.221
   11   HD22  LEU  26          HD23      LEU  26  11.220  15.672  -0.452

  No H/Q in entry =          11
  In of MODEL   59
    1    H    LYS  27           H        LYS  27  10.933  18.878  -3.731
    2    HA   LYS  27           HA       LYS  27  13.146  20.082  -2.518
    3    HB2  LYS  27           HB2      LYS  27  13.209  18.745  -4.616
    4    HB3  LYS  27           HB3      LYS  27  12.454  20.092  -5.467
    5    HG2  LYS  27           HG2      LYS  27  14.345  21.548  -4.899
    6    HG3  LYS  27           HG3      LYS  27  15.096  20.241  -3.977
    7    HD2  LYS  27           HD2      LYS  27  15.201  18.863  -6.040
    8    HD3  LYS  27           HD3      LYS  27  14.495  20.196  -6.954
    9    HE2  LYS  27           HE2      LYS  27  16.408  21.632  -6.352
   10    HE3  LYS  27           HE3      LYS  27  17.118  20.304  -5.429
   11    HZ3  LYS  27           HZ1      LYS  27  18.088  20.402  -7.624
   12    HZ2  LYS  27           HZ2      LYS  27  16.553  20.308  -8.351
   13    HZ1  LYS  27           HZ3      LYS  27  17.167  18.985  -7.480

  No H/Q in entry =          13
  In of MODEL   59
    1    H    GLN  28           H        GLN  28  10.524  21.509  -4.434
    2    HA   GLN  28           HA       GLN  28  11.517  24.149  -4.582
    3    HB2  GLN  28           HB2      GLN  28   8.671  23.117  -4.448
    4    HB3  GLN  28           HB3      GLN  28   9.103  24.785  -4.819
    5    HG2  GLN  28           HG2      GLN  28  10.069  22.374  -6.383
    6    HG3  GLN  28           HG3      GLN  28   8.723  23.404  -6.867
    7   HE21  GLN  28          HE21      GLN  28  11.859  22.927  -7.634
    8   HE22  GLN  28          HE22      GLN  28  12.328  24.514  -8.012

  No H/Q in entry =           8
  In of MODEL   59
    1    H    ALA  29           H        ALA  29   9.587  22.470  -2.136
    2    HA   ALA  29           HA       ALA  29   9.083  24.660  -0.437
    3    HB2  ALA  29           HB1      ALA  29   8.349  23.092   1.130
    4    HB1  ALA  29           HB2      ALA  29   9.550  21.895   0.646
    5    HB3  ALA  29           HB3      ALA  29   8.157  22.212  -0.387

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LYS  30           H        LYS  30  11.782  22.357  -0.546
    2    HA   LYS  30           HA       LYS  30  13.135  23.281   1.749
    3    HB2  LYS  30           HB2      LYS  30  14.190  21.995  -0.779
    4    HB3  LYS  30           HB3      LYS  30  15.191  22.333   0.635
    5    HG2  LYS  30           HG2      LYS  30  13.633  20.963   2.023
    6    HG3  LYS  30           HG3      LYS  30  12.729  20.561   0.559
    7    HD2  LYS  30           HD2      LYS  30  14.751  19.553  -0.427
    8    HD3  LYS  30           HD3      LYS  30  15.674  19.969   1.018
    9    HE2  LYS  30           HE2      LYS  30  14.165  18.550   2.380
   10    HE3  LYS  30           HE3      LYS  30  13.270  18.114   0.918
   11    HZ2  LYS  30           HZ1      LYS  30  15.048  16.509   1.653
   12    HZ1  LYS  30           HZ2      LYS  30  16.196  17.683   1.196
   13    HZ3  LYS  30           HZ3      LYS  30  15.141  17.019   0.038

  No H/Q in entry =          13
  In of MODEL   59
    1    H    GLN  31           H        GLN  31  13.009  24.505  -1.540
    2    HA   GLN  31           HA       GLN  31  15.191  26.368  -1.129
    3    HB2  GLN  31           HB2      GLN  31  13.127  26.454  -3.333
    4    HB3  GLN  31           HB3      GLN  31  14.756  27.128  -3.346
    5    HG2  GLN  31           HG2      GLN  31  15.188  24.423  -2.790
    6    HG3  GLN  31           HG3      GLN  31  13.872  24.393  -3.956
    7   HE21  GLN  31          HE21      GLN  31  16.701  23.565  -4.392
    8   HE22  GLN  31          HE22      GLN  31  17.273  24.538  -5.659

  No H/Q in entry =           8
  In of MODEL   59
    1    H    GLY  32           H        GLY  32  12.126  26.219   0.045
    2    HA3  GLY  32           HA2      GLY  32  11.002  27.795   1.338
    3    HA2  GLY  32           HA3      GLY  32  12.138  29.019   0.784

  No H/Q in entry =           3
  In of MODEL   59
    1    H    ASP  33           H        ASP  33  10.725  27.146  -1.705
    2    HA   ASP  33           HA       ASP  33   9.082  29.445  -2.532
    3    HB2  ASP  33           HB2      ASP  33  10.129  27.020  -3.998
    4    HB3  ASP  33           HB3      ASP  33   8.986  28.154  -4.711

  No H/Q in entry =           4
  In of MODEL   59
    1    H    PHE  34           H        PHE  34   7.403  28.983  -0.954
    2    HA   PHE  34           HA       PHE  34   5.992  26.528  -0.858
    3    HB2  PHE  34           HB2      PHE  34   5.074  29.324  -0.154
    4    HB3  PHE  34           HB3      PHE  34   4.210  27.842   0.258
    5    HD1  PHE  34           HD1      PHE  34   6.503  30.205   1.463
    6    HD2  PHE  34           HD2      PHE  34   5.768  25.973   1.393
    7    HE1  PHE  34           HE1      PHE  34   7.910  29.925   3.484
    8    HE2  PHE  34           HE2      PHE  34   7.177  25.697   3.413
    9    HZ   PHE  34           HZ       PHE  34   8.243  27.675   4.458

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ALA  35           H        ALA  35   5.579  29.408  -2.849
    2    HA   ALA  35           HA       ALA  35   3.010  28.832  -3.852
    3    HB1  ALA  35           HB1      ALA  35   4.060  30.222  -5.893
    4    HB3  ALA  35           HB2      ALA  35   5.294  30.561  -4.679
    5    HB2  ALA  35           HB3      ALA  35   3.612  30.990  -4.369

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ALA  36           H        ALA  36   6.216  28.125  -5.242
    2    HA   ALA  36           HA       ALA  36   5.187  26.721  -7.483
    3    HB3  ALA  36           HB1      ALA  36   7.341  26.821  -8.120
    4    HB2  ALA  36           HB2      ALA  36   7.823  25.779  -6.780
    5    HB1  ALA  36           HB3      ALA  36   7.742  27.527  -6.554

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ALA  37           H        ALA  37   6.162  25.697  -4.243
    2    HA   ALA  37           HA       ALA  37   6.064  22.912  -4.687
    3    HB2  ALA  37           HB1      ALA  37   5.849  24.693  -2.296
    4    HB1  ALA  37           HB2      ALA  37   6.962  23.363  -2.607
    5    HB3  ALA  37           HB3      ALA  37   5.301  23.028  -2.121

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LYS  38           H        LYS  38   3.571  25.146  -3.482
    2    HA   LYS  38           HA       LYS  38   1.451  23.358  -3.248
    3    HB2  LYS  38           HB2      LYS  38   1.840  26.108  -2.986
    4    HB3  LYS  38           HB3      LYS  38   0.626  25.983  -4.253
    5    HG2  LYS  38           HG2      LYS  38  -0.826  24.671  -2.804
    6    HG3  LYS  38           HG3      LYS  38   0.430  24.588  -1.560
    7    HD2  LYS  38           HD2      LYS  38   0.278  26.924  -1.098
    8    HD3  LYS  38           HD3      LYS  38  -0.644  27.233  -2.570
    9    HE2  LYS  38           HE2      LYS  38  -2.128  27.275  -0.615
   10    HE3  LYS  38           HE3      LYS  38  -2.530  25.910  -1.661
   11    HZ3  LYS  38           HZ1      LYS  38  -1.808  24.421  -0.143
   12    HZ2  LYS  38           HZ2      LYS  38  -2.132  25.677   0.956
   13    HZ1  LYS  38           HZ3      LYS  38  -0.546  25.409   0.414

  No H/Q in entry =          13
  In of MODEL   59
    1    H    ALA  39           H        ALA  39   2.427  25.264  -6.096
    2    HA   ALA  39           HA       ALA  39   0.323  24.432  -7.783
    3    HB2  ALA  39           HB1      ALA  39   3.057  25.051  -8.860
    4    HB1  ALA  39           HB2      ALA  39   2.114  26.320  -8.079
    5    HB3  ALA  39           HB3      ALA  39   1.477  25.499  -9.503

  No H/Q in entry =           5
  In of MODEL   59
    1    H    MET  40           H        MET  40   3.550  23.089  -7.243
    2    HA   MET  40           HA       MET  40   3.407  21.081  -9.244
    3    HB2  MET  40           HB2      MET  40   5.046  21.271  -6.710
    4    HB3  MET  40           HB3      MET  40   5.269  20.018  -7.934
    5    HG2  MET  40           HG2      MET  40   5.357  22.977  -8.584
    6    HG3  MET  40           HG3      MET  40   6.796  22.054  -8.154
    7    HE3  MET  40           HE1      MET  40   7.613  19.843 -10.983
    8    HE2  MET  40           HE2      MET  40   7.062  19.522  -9.341
    9    HE1  MET  40           HE3      MET  40   8.171  20.857  -9.645

  No H/Q in entry =           9
  In of MODEL   59
    1    H    MET  41           H        MET  41   2.526  21.116  -5.811
    2    HA   MET  41           HA       MET  41   1.962  18.357  -5.543
    3    HB2  MET  41           HB2      MET  41   0.672  20.724  -4.166
    4    HB3  MET  41           HB3      MET  41   0.501  19.045  -3.665
    5    HG2  MET  41           HG2      MET  41   3.213  19.234  -3.728
    6    HG3  MET  41           HG3      MET  41   2.797  20.896  -3.319
    7    HE2  MET  41           HE1      MET  41  -0.241  19.671  -1.570
    8    HE1  MET  41           HE2      MET  41   0.591  21.176  -1.948
    9    HE3  MET  41           HE3      MET  41   0.541  20.597  -0.282

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ASP  42           H        ASP  42  -0.052  21.112  -6.482
    2    HA   ASP  42           HA       ASP  42  -2.510  19.782  -6.601
    3    HB2  ASP  42           HB2      ASP  42  -1.774  22.345  -6.851
    4    HB3  ASP  42           HB3      ASP  42  -1.947  21.961  -8.560

  No H/Q in entry =           4
  In of MODEL   59
    1    H    GLN  43           H        GLN  43  -0.087  20.357  -9.124
    2    HA   GLN  43           HA       GLN  43  -1.511  19.066 -11.207
    3    HB2  GLN  43           HB2      GLN  43   1.457  19.544 -10.851
    4    HB3  GLN  43           HB3      GLN  43   0.721  18.921 -12.330
    5    HG2  GLN  43           HG2      GLN  43  -0.766  20.967 -12.346
    6    HG3  GLN  43           HG3      GLN  43   0.208  21.604 -11.024
    7   HE21  GLN  43          HE21      GLN  43   0.369  23.233 -13.103
    8   HE22  GLN  43          HE22      GLN  43   1.772  23.000 -14.025

  No H/Q in entry =           8
  In of MODEL   59
    1    H    SER  44           H        SER  44   0.849  17.884  -8.846
    2    HA   SER  44           HA       SER  44   1.142  15.280  -9.888
    3    HB2  SER  44           HB2      SER  44   2.077  16.695  -7.653
    4    HB3  SER  44           HB3      SER  44   1.204  15.318  -6.981
    5    HG   SER  44           HG       SER  44   3.303  14.676  -7.432

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ARG  45           H        ARG  45  -1.138  16.613  -7.520
    2    HA   ARG  45           HA       ARG  45  -2.547  14.265  -6.884
    3    HB2  ARG  45           HB2      ARG  45  -2.707  16.429  -5.679
    4    HB3  ARG  45           HB3      ARG  45  -3.569  17.114  -7.054
    5    HG2  ARG  45           HG2      ARG  45  -5.353  15.407  -6.762
    6    HG3  ARG  45           HG3      ARG  45  -4.502  14.777  -5.351
    7    HD2  ARG  45           HD2      ARG  45  -4.671  17.041  -4.281
    8    HD3  ARG  45           HD3      ARG  45  -5.665  17.580  -5.651
    9    HE   ARG  45           HE       ARG  45  -6.793  15.211  -4.612
   10   HH21  ARG  45          HH11      ARG  45  -8.615  15.301  -3.323
   11   HH22  ARG  45          HH12      ARG  45  -8.985  16.741  -2.443
   12   HH11  ARG  45          HH21      ARG  45  -6.199  18.445  -3.576
   13   HH12  ARG  45          HH22      ARG  45  -7.612  18.521  -2.584

  No H/Q in entry =          13
  In of MODEL   59
    1    H    MET  46           H        MET  46  -3.128  16.690  -9.416
    2    HA   MET  46           HA       MET  46  -5.491  15.551 -10.461
    3    HB2  MET  46           HB2      MET  46  -3.379  17.357 -11.650
    4    HB3  MET  46           HB3      MET  46  -4.781  16.826 -12.583
    5    HG2  MET  46           HG2      MET  46  -6.285  17.756 -10.876
    6    HG3  MET  46           HG3      MET  46  -4.901  18.263  -9.914
    7    HE3  MET  46           HE1      MET  46  -6.987  20.442 -10.524
    8    HE2  MET  46           HE2      MET  46  -5.909  21.748 -11.006
    9    HE1  MET  46           HE3      MET  46  -5.432  20.654  -9.708

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ALA  47           H        ALA  47  -2.075  15.036 -11.255
    2    HA   ALA  47           HA       ALA  47  -2.462  13.325 -13.471
    3    HB3  ALA  47           HB1      ALA  47  -0.271  14.188 -13.136
    4    HB2  ALA  47           HB2      ALA  47  -0.146  12.456 -12.813
    5    HB1  ALA  47           HB3      ALA  47  -0.213  13.602 -11.473

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LEU  48           H        LEU  48  -2.166  12.667 -10.004
    2    HA   LEU  48           HA       LEU  48  -2.294   9.830 -10.176
    3    HB2  LEU  48           HB2      LEU  48  -3.014  11.744  -7.945
    4    HB3  LEU  48           HB3      LEU  48  -2.938   9.991  -7.754
    5    HG   LEU  48           HG       LEU  48  -0.630  11.670  -8.765
    6   HD13  LEU  48          HD11      LEU  48  -0.883  12.432  -6.568
    7   HD12  LEU  48          HD12      LEU  48   0.268  11.110  -6.387
    8   HD11  LEU  48          HD13      LEU  48  -1.430  10.864  -5.975
    9   HD22  LEU  48          HD21      LEU  48  -0.162   9.483  -9.422
   10   HD21  LEU  48          HD22      LEU  48  -1.027   8.770  -8.062
   11   HD23  LEU  48          HD23      LEU  48   0.557   9.504  -7.813

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ASN  49           H        ASN  49  -4.725  12.347  -9.737
    2    HA   ASN  49           HA       ASN  49  -6.924  10.704  -9.185
    3    HB2  ASN  49           HB2      ASN  49  -6.928  13.136  -8.858
    4    HB3  ASN  49           HB3      ASN  49  -6.823  13.387 -10.596
    5   HD21  ASN  49          HD21      ASN  49  -8.864  14.413 -10.858
    6   HD22  ASN  49          HD22      ASN  49 -10.336  13.625 -10.562

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLU  50           H        GLU  50  -5.661  11.903 -12.279
    2    HA   GLU  50           HA       GLU  50  -7.645  10.679 -13.912
    3    HB2  GLU  50           HB2      GLU  50  -6.166  12.486 -14.731
    4    HB3  GLU  50           HB3      GLU  50  -4.783  11.398 -14.612
    5    HG2  GLU  50           HG2      GLU  50  -5.790   9.882 -16.247
    6    HG3  GLU  50           HG3      GLU  50  -7.240  10.877 -16.315

  No H/Q in entry =           6
  In of MODEL   59
    1    H    ALA  51           H        ALA  51  -4.474   9.645 -12.743
    2    HA   ALA  51           HA       ALA  51  -4.376   7.198 -14.175
    3    HB2  ALA  51           HB1      ALA  51  -2.388   6.882 -13.095
    4    HB1  ALA  51           HB2      ALA  51  -3.056   7.303 -11.519
    5    HB3  ALA  51           HB3      ALA  51  -2.597   8.575 -12.651

  No H/Q in entry =           5
  In of MODEL   59
    1    H    HIS  52           H        HIS  52  -5.508   8.025 -10.910
    2    HA   HIS  52           HA       HIS  52  -6.215   5.419 -10.086
    3    HB2  HIS  52           HB2      HIS  52  -6.040   7.352  -8.556
    4    HB3  HIS  52           HB3      HIS  52  -7.478   8.055  -9.297
    5    HD1  HIS  52           HD1      HIS  52  -9.720   6.553  -9.101
    6    HD2  HIS  52           HD2      HIS  52  -6.587   5.485  -6.569
    7    HE1  HIS  52           HE1      HIS  52 -10.725   5.082  -7.300
    8    HE2  HIS  52           HE2      HIS  52  -8.827   4.422  -5.747

  No H/Q in entry =           8
  In of MODEL   59
    1    H    LEU  53           H        LEU  53  -8.024   7.907 -11.844
    2    HA   LEU  53           HA       LEU  53 -10.544   6.644 -11.839
    3    HB2  LEU  53           HB2      LEU  53  -9.256   8.619 -13.712
    4    HB3  LEU  53           HB3      LEU  53 -10.866   7.975 -14.020
    5    HG   LEU  53           HG       LEU  53 -10.115   9.258 -11.375
    6   HD11  LEU  53          HD11      LEU  53 -11.175  10.496 -13.920
    7   HD13  LEU  53          HD12      LEU  53  -9.793  11.009 -12.950
    8   HD12  LEU  53          HD13      LEU  53 -11.431  11.238 -12.344
    9   HD23  LEU  53          HD21      LEU  53 -12.696   9.706 -11.514
   10   HD22  LEU  53          HD22      LEU  53 -12.136   8.099 -11.065
   11   HD21  LEU  53          HD23      LEU  53 -12.696   8.405 -12.698

  No H/Q in entry =          11
  In of MODEL   59
    1    H    VAL  54           H        VAL  54  -7.817   6.427 -14.103
    2    HA   VAL  54           HA       VAL  54  -9.078   4.681 -15.944
    3    HB   VAL  54           HB       VAL  54  -6.158   5.149 -15.287
    4   HG12  VAL  54          HG11      VAL  54  -5.947   4.074 -17.684
    5   HG11  VAL  54          HG12      VAL  54  -7.480   3.309 -17.270
    6   HG13  VAL  54          HG13      VAL  54  -6.059   3.032 -16.266
    7   HG22  VAL  54          HG21      VAL  54  -6.915   7.107 -16.314
    8   HG21  VAL  54          HG22      VAL  54  -8.127   6.263 -17.275
    9   HG23  VAL  54          HG23      VAL  54  -6.426   6.165 -17.722

  No H/Q in entry =           9
  In of MODEL   59
    1    H    GLN  55           H        GLN  55  -7.059   4.095 -13.067
    2    HA   GLN  55           HA       GLN  55  -7.006   1.279 -13.339
    3    HB2  GLN  55           HB2      GLN  55  -5.425   2.148 -11.830
    4    HB3  GLN  55           HB3      GLN  55  -6.622   3.124 -10.983
    5    HG2  GLN  55           HG2      GLN  55  -7.320   1.368  -9.669
    6    HG3  GLN  55           HG3      GLN  55  -7.121   0.186 -10.955
    7   HE21  GLN  55          HE21      GLN  55  -5.511  -1.286 -10.484
    8   HE22  GLN  55          HE22      GLN  55  -4.114  -0.957  -9.583

  No H/Q in entry =           8
  In of MODEL   59
    1    H    THR  56           H        THR  56  -9.295   3.461 -11.691
    2    HA   THR  56           HA       THR  56 -10.890   1.590 -10.397
    3    HB   THR  56           HB       THR  56 -11.977   3.995 -11.881
    4    HG1  THR  56           HG1      THR  56 -10.047   4.016 -10.182
    5   HG21  THR  56          HG21      THR  56 -12.860   2.312  -9.550
    6   HG23  THR  56          HG22      THR  56 -13.780   2.794 -10.976
    7   HG22  THR  56          HG23      THR  56 -13.418   3.976  -9.717

  No H/Q in entry =           7
  In of MODEL   59
    1    H    LYS  57           H        LYS  57 -11.110   2.693 -13.775
    2    HA   LYS  57           HA       LYS  57 -13.294   1.037 -14.518
    3    HB2  LYS  57           HB2      LYS  57 -12.410   2.983 -15.834
    4    HB3  LYS  57           HB3      LYS  57 -10.982   2.033 -16.216
    5    HG2  LYS  57           HG2      LYS  57 -12.383   0.361 -17.356
    6    HG3  LYS  57           HG3      LYS  57 -13.825   1.291 -16.965
    7    HD2  LYS  57           HD2      LYS  57 -12.947   3.196 -18.284
    8    HD3  LYS  57           HD3      LYS  57 -11.518   2.252 -18.694
    9    HE2  LYS  57           HE2      LYS  57 -12.942   0.567 -19.814
   10    HE3  LYS  57           HE3      LYS  57 -14.383   1.499 -19.407
   11    HZ3  LYS  57           HZ1      LYS  57 -14.018   2.898 -21.072
   12    HZ2  LYS  57           HZ2      LYS  57 -12.891   1.769 -21.657
   13    HZ1  LYS  57           HZ3      LYS  57 -12.373   3.074 -20.698

  No H/Q in entry =          13
  In of MODEL   59
    1    H    LEU  58           H        LEU  58  -9.795   0.563 -14.495
    2    HA   LEU  58           HA       LEU  58  -9.845  -1.947 -15.796
    3    HB2  LEU  58           HB2      LEU  58  -7.779  -0.690 -14.000
    4    HB3  LEU  58           HB3      LEU  58  -7.545  -2.210 -14.864
    5    HG   LEU  58           HG       LEU  58  -8.279   0.410 -16.208
    6   HD11  LEU  58          HD11      LEU  58  -5.642  -0.863 -15.547
    7   HD13  LEU  58          HD12      LEU  58  -6.115   0.834 -15.485
    8   HD12  LEU  58          HD13      LEU  58  -5.800   0.067 -17.038
    9   HD22  LEU  58          HD21      LEU  58  -8.888  -1.136 -17.801
   10   HD21  LEU  58          HD22      LEU  58  -7.856  -2.400 -17.135
   11   HD23  LEU  58          HD23      LEU  58  -7.159  -1.130 -18.141

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  59           H        ILE  59 -10.626  -1.052 -12.534
    2    HA   ILE  59           HA       ILE  59 -10.300  -3.828 -11.603
    3    HB   ILE  59           HB       ILE  59  -9.819  -1.570 -10.198
    4   HG12  ILE  59          HG12      ILE  59 -11.190  -3.922  -8.878
    5   HG13  ILE  59          HG13      ILE  59  -9.551  -4.002  -9.473
    6   HG23  ILE  59          HG21      ILE  59 -11.631  -0.872  -8.861
    7   HG22  ILE  59          HG22      ILE  59 -12.583  -2.291  -9.230
    8   HG21  ILE  59          HG23      ILE  59 -12.358  -1.032 -10.442
    9   HD11  ILE  59          HD11      ILE  59  -8.928  -2.090  -8.056
   10   HD13  ILE  59          HD12      ILE  59  -9.546  -3.425  -7.092
   11   HD12  ILE  59          HD13      ILE  59 -10.573  -2.029  -7.429

  No H/Q in entry =          11
  In of MODEL   59
    1    H    GLU  60           H        GLU  60 -12.837  -1.477 -12.377
    2    HA   GLU  60           HA       GLU  60 -15.031  -2.972 -11.351
    3    HB2  GLU  60           HB2      GLU  60 -16.349  -1.342 -12.302
    4    HB3  GLU  60           HB3      GLU  60 -14.809  -0.488 -12.315
    5    HG2  GLU  60           HG2      GLU  60 -14.442  -1.429 -14.654
    6    HG3  GLU  60           HG3      GLU  60 -16.115  -1.944 -14.618

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLY  61           H        GLY  61 -13.386  -2.962 -14.481
    2    HA3  GLY  61           HA2      GLY  61 -15.133  -5.181 -15.367
    3    HA2  GLY  61           HA3      GLY  61 -14.285  -4.081 -16.447

  No H/Q in entry =           3
  In of MODEL   59
    1    H    ASP  62           H        ASP  62 -12.901  -5.558 -13.582
    2    HA   ASP  62           HA       ASP  62 -10.597  -6.456 -14.948
    3    HB2  ASP  62           HB2      ASP  62 -10.080  -7.573 -12.800
    4    HB3  ASP  62           HB3      ASP  62 -10.591  -5.904 -12.570

  No H/Q in entry =           4
  In of MODEL   59
    1    H    ALA  63           H        ALA  63 -13.609  -8.158 -14.072
    2    HA   ALA  63           HA       ALA  63 -12.555 -10.708 -15.112
    3    HB1  ALA  63           HB1      ALA  63 -14.691 -11.632 -14.310
    4    HB3  ALA  63           HB2      ALA  63 -15.280 -10.008 -13.963
    5    HB2  ALA  63           HB3      ALA  63 -13.937 -10.677 -13.035

  No H/Q in entry =           5
  In of MODEL   59
    1    H    GLY  64           H        GLY  64 -14.148 -11.940 -16.520
    2    HA3  GLY  64           HA2      GLY  64 -15.806 -11.903 -18.259
    3    HA2  GLY  64           HA3      GLY  64 -15.453 -10.197 -18.506

  No H/Q in entry =           3
  In of MODEL   59
    1    H    GLU  65           H        GLU  65 -12.477 -11.123 -18.156
    2    HA   GLU  65           HA       GLU  65 -11.874 -11.122 -20.911
    3    HB2  GLU  65           HB2      GLU  65 -10.187 -11.826 -18.512
    4    HB3  GLU  65           HB3      GLU  65  -9.553 -11.714 -20.155
    5    HG2  GLU  65           HG2      GLU  65 -10.273  -9.390 -20.317
    6    HG3  GLU  65           HG3      GLU  65 -11.023  -9.483 -18.725

  No H/Q in entry =           6
  In of MODEL   59
    1    H    GLY  66           H        GLY  66 -12.135 -13.696 -18.589
    2    HA3  GLY  66           HA2      GLY  66 -12.657 -15.691 -20.545
    3    HA2  GLY  66           HA3      GLY  66 -11.042 -15.865 -19.887

  No H/Q in entry =           3
  In of MODEL   59
    1    H    LYS  67           H        LYS  67 -10.767 -16.474 -17.748
    2    HA   LYS  67           HA       LYS  67 -12.967 -18.033 -16.672
    3    HB2  LYS  67           HB2      LYS  67 -10.027 -17.906 -16.022
    4    HB3  LYS  67           HB3      LYS  67 -11.174 -18.952 -15.174
    5    HG2  LYS  67           HG2      LYS  67 -11.833 -19.979 -17.319
    6    HG3  LYS  67           HG3      LYS  67 -10.693 -18.939 -18.170
    7    HD2  LYS  67           HD2      LYS  67  -8.825 -19.955 -16.916
    8    HD3  LYS  67           HD3      LYS  67  -9.968 -20.999 -16.066
    9    HE2  LYS  67           HE2      LYS  67 -10.669 -22.001 -18.200
   10    HE3  LYS  67           HE3      LYS  67  -9.568 -20.935 -19.074
   11    HZ3  LYS  67           HZ1      LYS  67  -7.991 -22.434 -18.761
   12    HZ2  LYS  67           HZ2      LYS  67  -9.015 -23.392 -17.804
   13    HZ1  LYS  67           HZ3      LYS  67  -8.080 -22.169 -17.089

  No H/Q in entry =          13
  In of MODEL   59
    1    H    MET  68           H        MET  68 -12.529 -18.278 -14.109
    2    HA   MET  68           HA       MET  68 -13.865 -16.114 -12.915
    3    HB2  MET  68           HB2      MET  68 -12.358 -18.418 -11.677
    4    HB3  MET  68           HB3      MET  68 -13.434 -17.334 -10.799
    5    HG2  MET  68           HG2      MET  68 -14.242 -19.031 -13.178
    6    HG3  MET  68           HG3      MET  68 -14.591 -19.416 -11.492
    7    HE3  MET  68           HE1      MET  68 -16.934 -16.939 -10.191
    8    HE2  MET  68           HE2      MET  68 -15.358 -16.174 -10.383
    9    HE1  MET  68           HE3      MET  68 -15.454 -17.874  -9.928

  No H/Q in entry =           9
  In of MODEL   59
    1    H    LYS  69           H        LYS  69 -10.549 -16.304 -13.635
    2    HA   LYS  69           HA       LYS  69  -9.615 -14.896 -11.303
    3    HB2  LYS  69           HB2      LYS  69  -8.156 -15.476 -13.886
    4    HB3  LYS  69           HB3      LYS  69  -7.424 -14.990 -12.355
    5    HG2  LYS  69           HG2      LYS  69  -9.117 -17.480 -12.707
    6    HG3  LYS  69           HG3      LYS  69  -7.355 -17.473 -12.762
    7    HD2  LYS  69           HD2      LYS  69  -7.514 -16.294 -10.447
    8    HD3  LYS  69           HD3      LYS  69  -9.167 -16.912 -10.423
    9    HE2  LYS  69           HE2      LYS  69  -8.005 -18.665  -9.408
   10    HE3  LYS  69           HE3      LYS  69  -8.026 -19.185 -11.092
   11    HZ2  LYS  69           HZ1      LYS  69  -5.811 -17.805  -9.679
   12    HZ1  LYS  69           HZ2      LYS  69  -5.831 -18.111 -11.349
   13    HZ3  LYS  69           HZ3      LYS  69  -5.820 -19.404 -10.246

  No H/Q in entry =          13
  In of MODEL   59
    1    H    VAL  70           H        VAL  70  -7.792 -13.072 -12.043
    2    HA   VAL  70           HA       VAL  70  -9.239 -10.981 -13.561
    3    HB   VAL  70           HB       VAL  70  -8.467  -9.344 -11.871
    4   HG13  VAL  70          HG11      VAL  70 -10.103  -9.931 -10.170
    5   HG12  VAL  70          HG12      VAL  70 -10.023 -11.632 -10.632
    6   HG11  VAL  70          HG13      VAL  70 -10.719 -10.451 -11.739
    7   HG21  VAL  70          HG21      VAL  70  -7.313 -11.844 -10.634
    8   HG23  VAL  70          HG22      VAL  70  -7.779 -10.488  -9.610
    9   HG22  VAL  70          HG23      VAL  70  -6.549 -10.270 -10.854

  No H/Q in entry =           9
  In of MODEL   59
    1    H    SER  71           H        SER  71  -7.782  -9.202 -14.225
    2    HA   SER  71           HA       SER  71  -5.506 -10.136 -15.620
    3    HB2  SER  71           HB2      SER  71  -6.892  -8.077 -16.169
    4    HB3  SER  71           HB3      SER  71  -6.066  -7.268 -14.840
    5    HG   SER  71           HG       SER  71  -4.401  -8.621 -16.553

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LEU  72           H        LEU  72  -3.523 -10.511 -14.940
    2    HA   LEU  72           HA       LEU  72  -2.776 -10.318 -12.234
    3    HB2  LEU  72           HB2      LEU  72  -1.264 -10.863 -14.767
    4    HB3  LEU  72           HB3      LEU  72  -0.429 -10.740 -13.222
    5    HG   LEU  72           HG       LEU  72  -2.778 -12.602 -13.708
    6   HD11  LEU  72          HD11      LEU  72  -0.563 -12.996 -15.041
    7   HD13  LEU  72          HD12      LEU  72  -1.274 -14.346 -14.159
    8   HD12  LEU  72          HD13      LEU  72   0.095 -13.469 -13.475
    9   HD23  LEU  72          HD21      LEU  72  -1.491 -13.723 -11.678
   10   HD22  LEU  72          HD22      LEU  72  -2.616 -12.408 -11.371
   11   HD21  LEU  72          HD23      LEU  72  -0.884 -12.090 -11.427

  No H/Q in entry =          11
  In of MODEL   59
    1    H    VAL  73           H        VAL  73  -2.058  -8.299 -15.012
    2    HA   VAL  73           HA       VAL  73  -0.106  -6.630 -13.918
    3    HB   VAL  73           HB       VAL  73  -0.450  -5.237 -15.779
    4   HG11  VAL  73          HG11      VAL  73   0.120  -7.713 -16.211
    5   HG13  VAL  73          HG12      VAL  73  -0.454  -6.773 -17.587
    6   HG12  VAL  73          HG13      VAL  73  -1.549  -7.876 -16.755
    7   HG23  VAL  73          HG21      VAL  73  -2.624  -5.450 -17.115
    8   HG22  VAL  73          HG22      VAL  73  -2.749  -4.639 -15.555
    9   HG21  VAL  73          HG23      VAL  73  -3.277  -6.314 -15.723

  No H/Q in entry =           9
  In of MODEL   59
    1    H    LEU  74           H        LEU  74  -3.500  -6.704 -13.330
    2    HA   LEU  74           HA       LEU  74  -4.078  -4.043 -12.701
    3    HB2  LEU  74           HB2      LEU  74  -5.829  -5.688 -12.867
    4    HB3  LEU  74           HB3      LEU  74  -5.139  -6.623 -11.543
    5    HG   LEU  74           HG       LEU  74  -5.565  -4.742  -9.994
    6   HD11  LEU  74          HD11      LEU  74  -6.581  -3.466 -12.536
    7   HD13  LEU  74          HD12      LEU  74  -5.443  -2.807 -11.362
    8   HD12  LEU  74          HD13      LEU  74  -7.154  -2.942 -10.952
    9   HD23  LEU  74          HD21      LEU  74  -8.143  -5.130 -11.422
   10   HD22  LEU  74          HD22      LEU  74  -7.747  -5.301  -9.726
   11   HD21  LEU  74          HD23      LEU  74  -7.298  -6.564 -10.846

  No H/Q in entry =          11
  In of MODEL   59
    1    H    VAL  75           H        VAL  75  -3.052  -6.653 -10.560
    2    HA   VAL  75           HA       VAL  75  -2.812  -5.115  -8.211
    3    HB   VAL  75           HB       VAL  75  -1.361  -7.628  -9.028
    4   HG13  VAL  75          HG11      VAL  75  -0.056  -6.433  -7.310
    5   HG12  VAL  75          HG12      VAL  75  -0.885  -7.792  -6.566
    6   HG11  VAL  75          HG13      VAL  75  -1.514  -6.166  -6.361
    7   HG23  VAL  75          HG21      VAL  75  -3.010  -8.640  -7.459
    8   HG22  VAL  75          HG22      VAL  75  -3.808  -7.839  -8.813
    9   HG21  VAL  75          HG23      VAL  75  -3.751  -7.055  -7.234

  No H/Q in entry =           9
  In of MODEL   59
    1    H    GLU  76           H        GLU  76  -0.436  -5.895 -10.772
    2    HA   GLU  76           HA       GLU  76   1.777  -4.582  -9.628
    3    HB2  GLU  76           HB2      GLU  76   1.940  -6.052 -11.620
    4    HB3  GLU  76           HB3      GLU  76   1.040  -4.874 -12.563
    5    HG2  GLU  76           HG2      GLU  76   3.372  -4.562 -13.079
    6    HG3  GLU  76           HG3      GLU  76   2.893  -3.198 -12.089

  No H/Q in entry =           6
  In of MODEL   59
    1    H    ALA  77           H        ALA  77  -0.758  -3.338 -11.789
    2    HA   ALA  77           HA       ALA  77   0.265  -0.704 -11.961
    3    HB2  ALA  77           HB1      ALA  77  -2.064  -0.108 -12.655
    4    HB3  ALA  77           HB2      ALA  77  -2.567  -1.745 -12.237
    5    HB1  ALA  77           HB3      ALA  77  -1.405  -1.486 -13.538

  No H/Q in entry =           5
  In of MODEL   59
    1    H    GLN  78           H        GLN  78  -2.004  -2.240  -9.738
    2    HA   GLN  78           HA       GLN  78  -2.769   0.082  -8.319
    3    HB2  GLN  78           HB2      GLN  78  -3.908  -2.162  -8.234
    4    HB3  GLN  78           HB3      GLN  78  -2.570  -2.746  -7.249
    5    HG2  GLN  78           HG2      GLN  78  -3.045  -1.010  -5.570
    6    HG3  GLN  78           HG3      GLN  78  -4.387  -0.423  -6.551
    7   HE21  GLN  78          HE21      GLN  78  -4.796  -1.429  -3.883
    8   HE22  GLN  78          HE22      GLN  78  -5.691  -2.867  -3.998

  No H/Q in entry =           8
  In of MODEL   59
    1    H    LEU  79           H        LEU  79  -0.115  -2.209  -7.902
    2    HA   LEU  79           HA       LEU  79   0.893  -1.336  -5.449
    3    HB2  LEU  79           HB2      LEU  79   1.729  -3.350  -6.534
    4    HB3  LEU  79           HB3      LEU  79   2.375  -2.401  -7.868
    5    HG   LEU  79           HG       LEU  79   3.958  -1.288  -6.373
    6   HD13  LEU  79          HD11      LEU  79   2.974  -1.039  -4.296
    7   HD12  LEU  79          HD12      LEU  79   4.039  -2.404  -3.968
    8   HD11  LEU  79          HD13      LEU  79   2.327  -2.681  -4.284
    9   HD23  LEU  79          HD21      LEU  79   5.150  -3.454  -5.490
   10   HD22  LEU  79          HD22      LEU  79   4.934  -3.245  -7.225
   11   HD21  LEU  79          HD23      LEU  79   3.850  -4.306  -6.328

  No H/Q in entry =          11
  In of MODEL   59
    1    H    HIS  80           H        HIS  80   1.749  -0.215  -8.725
    2    HA   HIS  80           HA       HIS  80   3.588   1.747  -7.809
    3    HB2  HIS  80           HB2      HIS  80   2.268   1.080 -10.384
    4    HB3  HIS  80           HB3      HIS  80   2.884   2.724 -10.211
    5    HD1  HIS  80           HD1      HIS  80   5.284   2.998 -10.752
    6    HD2  HIS  80           HD2      HIS  80   4.429  -0.908  -9.571
    7    HE1  HIS  80           HE1      HIS  80   7.458   1.697 -10.942
    8    HE2  HIS  80           HE2      HIS  80   6.948  -0.687 -10.226

  No H/Q in entry =           8
  In of MODEL   59
    1    H    LEU  81           H        LEU  81   0.178   1.951  -8.759
    2    HA   LEU  81           HA       LEU  81  -0.063   4.745  -8.413
    3    HB2  LEU  81           HB2      LEU  81  -2.102   2.522  -8.327
    4    HB3  LEU  81           HB3      LEU  81  -2.534   4.230  -8.224
    5    HG   LEU  81           HG       LEU  81  -0.873   3.071 -10.479
    6   HD12  LEU  81          HD11      LEU  81  -3.112   3.422 -11.758
    7   HD11  LEU  81          HD12      LEU  81  -3.855   3.355 -10.160
    8   HD13  LEU  81          HD13      LEU  81  -2.933   1.979 -10.762
    9   HD23  LEU  81          HD21      LEU  81  -1.955   5.233 -11.557
   10   HD22  LEU  81          HD22      LEU  81  -0.528   5.383 -10.535
   11   HD21  LEU  81          HD23      LEU  81  -2.123   5.746  -9.880

  No H/Q in entry =          11
  In of MODEL   59
    1    H    MET  82           H        MET  82  -0.733   2.055  -6.171
    2    HA   MET  82           HA       MET  82  -1.750   3.643  -4.068
    3    HB2  MET  82           HB2      MET  82  -0.406   0.941  -4.131
    4    HB3  MET  82           HB3      MET  82  -0.964   1.666  -2.625
    5    HG2  MET  82           HG2      MET  82  -2.722   1.202  -5.054
    6    HG3  MET  82           HG3      MET  82  -2.644   0.121  -3.665
    7    HE3  MET  82           HE1      MET  82  -4.325   1.776  -0.827
    8    HE2  MET  82           HE2      MET  82  -2.594   2.036  -1.025
    9    HE1  MET  82           HE3      MET  82  -3.303   0.488  -1.481

  No H/Q in entry =           9
  In of MODEL   59
    1    H    THR  83           H        THR  83   1.533   2.525  -4.790
    2    HA   THR  83           HA       THR  83   2.782   3.605  -2.495
    3    HB   THR  83           HB       THR  83   4.863   3.534  -3.986
    4    HG1  THR  83           HG1      THR  83   4.601   3.020  -6.011
    5   HG22  THR  83          HG21      THR  83   4.388   0.883  -4.327
    6   HG21  THR  83          HG22      THR  83   3.112   1.271  -3.174
    7   HG23  THR  83          HG23      THR  83   4.799   1.594  -2.767

  No H/Q in entry =           7
  In of MODEL   59
    1    H    SER  84           H        SER  84   2.397   4.904  -5.786
    2    HA   SER  84           HA       SER  84   3.766   7.328  -5.331
    3    HB2  SER  84           HB2      SER  84   1.671   6.527  -7.336
    4    HB3  SER  84           HB3      SER  84   2.366   8.147  -7.309
    5    HG   SER  84           HG       SER  84   3.710   5.659  -7.624

  No H/Q in entry =           5
  In of MODEL   59
    1    H    MET  85           H        MET  85   0.266   6.608  -5.133
    2    HA   MET  85           HA       MET  85  -0.562   9.224  -4.513
    3    HB2  MET  85           HB2      MET  85  -2.116   7.448  -5.177
    4    HB3  MET  85           HB3      MET  85  -1.813   6.613  -3.655
    5    HG2  MET  85           HG2      MET  85  -2.670   8.551  -2.404
    6    HG3  MET  85           HG3      MET  85  -2.940   9.415  -3.915
    7    HE3  MET  85           HE1      MET  85  -5.799   8.543  -1.782
    8    HE2  MET  85           HE2      MET  85  -6.412   9.125  -3.327
    9    HE1  MET  85           HE3      MET  85  -4.934   9.812  -2.659

  No H/Q in entry =           9
  In of MODEL   59
    1    H    LEU  86           H        LEU  86   0.346   6.542  -2.389
    2    HA   LEU  86           HA       LEU  86  -0.152   7.839   0.063
    3    HB2  LEU  86           HB2      LEU  86   0.281   5.365  -0.346
    4    HB3  LEU  86           HB3      LEU  86   1.992   5.775  -0.454
    5    HG   LEU  86           HG       LEU  86   1.699   6.929   1.823
    6   HD11  LEU  86          HD11      LEU  86  -1.007   6.196   1.371
    7   HD13  LEU  86          HD12      LEU  86  -0.321   6.928   2.819
    8   HD12  LEU  86          HD13      LEU  86  -0.433   5.174   2.692
    9   HD23  LEU  86          HD21      LEU  86   1.237   3.941   1.934
   10   HD22  LEU  86          HD22      LEU  86   2.260   4.934   2.970
   11   HD21  LEU  86          HD23      LEU  86   2.743   4.611   1.306

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ALA  87           H        ALA  87   2.809   7.519  -1.853
    2    HA   ALA  87           HA       ALA  87   4.546   8.900  -0.135
    3    HB3  ALA  87           HB1      ALA  87   4.606   7.900  -2.848
    4    HB2  ALA  87           HB2      ALA  87   5.954   8.209  -1.757
    5    HB1  ALA  87           HB3      ALA  87   5.346   9.502  -2.790

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ARG  88           H        ARG  88   2.590  10.073  -2.833
    2    HA   ARG  88           HA       ARG  88   3.398  12.752  -2.710
    3    HB2  ARG  88           HB2      ARG  88   2.114  11.625  -4.562
    4    HB3  ARG  88           HB3      ARG  88   0.667  11.781  -3.566
    5    HG2  ARG  88           HG2      ARG  88   1.720  14.348  -3.478
    6    HG3  ARG  88           HG3      ARG  88   2.123  13.837  -5.115
    7    HD2  ARG  88           HD2      ARG  88  -0.023  13.948  -5.794
    8    HD3  ARG  88           HD3      ARG  88  -0.608  13.095  -4.365
    9    HE   ARG  88           HE       ARG  88  -0.766  15.877  -4.767
   10   HH21  ARG  88          HH11      ARG  88  -1.261  17.204  -3.018
   11   HH22  ARG  88          HH12      ARG  88  -0.958  16.655  -1.406
   12   HH11  ARG  88          HH21      ARG  88   0.241  13.590  -2.413
   13   HH12  ARG  88          HH22      ARG  88  -0.125  14.603  -1.064

  No H/Q in entry =          13
  In of MODEL   59
    1    H    GLU  89           H        GLU  89   0.688  11.104  -1.055
    2    HA   GLU  89           HA       GLU  89  -0.379  13.424   0.171
    3    HB2  GLU  89           HB2      GLU  89  -1.527  11.200   0.083
    4    HB3  GLU  89           HB3      GLU  89  -0.400  10.624   1.311
    5    HG2  GLU  89           HG2      GLU  89  -1.184  12.325   2.886
    6    HG3  GLU  89           HG3      GLU  89  -2.238  13.016   1.655

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LEU  90           H        LEU  90   2.052  11.094   1.312
    2    HA   LEU  90           HA       LEU  90   2.446  12.320   3.845
    3    HB2  LEU  90           HB2      LEU  90   4.181  10.531   2.143
    4    HB3  LEU  90           HB3      LEU  90   4.621  11.033   3.781
    5    HG   LEU  90           HG       LEU  90   1.962   9.727   3.136
    6   HD12  LEU  90          HD11      LEU  90   3.083   7.660   4.124
    7   HD11  LEU  90          HD12      LEU  90   4.615   8.497   3.873
    8   HD13  LEU  90          HD13      LEU  90   3.585   8.111   2.493
    9   HD22  LEU  90          HD21      LEU  90   1.729  10.642   5.265
   10   HD21  LEU  90          HD22      LEU  90   3.449  10.510   5.631
   11   HD23  LEU  90          HD23      LEU  90   2.423   9.076   5.681

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  91           H        ILE  91   4.027  12.697   0.706
    2    HA   ILE  91           HA       ILE  91   6.037  14.496   1.538
    3    HB   ILE  91           HB       ILE  91   4.695  14.038  -1.133
    4   HG12  ILE  91          HG12      ILE  91   7.529  13.506  -0.187
    5   HG13  ILE  91          HG13      ILE  91   6.232  12.326  -0.019
    6   HG22  ILE  91          HG21      ILE  91   6.931  15.358  -1.834
    7   HG21  ILE  91          HG22      ILE  91   6.645  16.154  -0.286
    8   HG23  ILE  91          HG23      ILE  91   5.412  16.207  -1.544
    9   HD13  ILE  91          HD11      ILE  91   6.034  12.017  -2.326
   10   HD12  ILE  91          HD12      ILE  91   7.773  12.235  -2.127
   11   HD11  ILE  91          HD13      ILE  91   6.777  13.575  -2.697

  No H/Q in entry =          11
  In of MODEL   59
    1    H    THR  92           H        THR  92   2.673  14.982   0.562
    2    HA   THR  92           HA       THR  92   2.686  17.805   0.516
    3    HB   THR  92           HB       THR  92   0.497  15.838   1.224
    4    HG1  THR  92           HG1      THR  92   0.780  15.666  -0.864
    5   HG22  THR  92          HG21      THR  92  -0.879  18.023   0.526
    6   HG21  THR  92          HG22      THR  92   0.531  18.825   1.215
    7   HG23  THR  92          HG23      THR  92  -0.418  17.712   2.199

  No H/Q in entry =           7
  In of MODEL   59
    1    H    GLU  93           H        GLU  93   2.128  15.499   3.163
    2    HA   GLU  93           HA       GLU  93   1.641  17.399   5.196
    3    HB2  GLU  93           HB2      GLU  93   2.917  14.655   5.406
    4    HB3  GLU  93           HB3      GLU  93   2.251  15.584   6.750
    5    HG2  GLU  93           HG2      GLU  93   0.607  14.843   4.321
    6    HG3  GLU  93           HG3      GLU  93   0.706  13.811   5.743

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LEU  94           H        LEU  94   4.616  15.880   4.012
    2    HA   LEU  94           HA       LEU  94   6.399  16.992   5.890
    3    HB2  LEU  94           HB2      LEU  94   6.762  16.034   3.051
    4    HB3  LEU  94           HB3      LEU  94   8.109  16.668   3.992
    5    HG   LEU  94           HG       LEU  94   6.348  14.491   5.131
    6   HD11  LEU  94          HD11      LEU  94   8.421  14.246   2.980
    7   HD13  LEU  94          HD12      LEU  94   6.964  13.292   3.249
    8   HD12  LEU  94          HD13      LEU  94   8.394  13.013   4.242
    9   HD23  LEU  94          HD21      LEU  94   8.540  13.917   6.261
   10   HD22  LEU  94          HD22      LEU  94   7.899  15.502   6.691
   11   HD21  LEU  94          HD23      LEU  94   9.226  15.369   5.537

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  95           H        ILE  95   5.250  18.197   2.757
    2    HA   ILE  95           HA       ILE  95   6.855  20.532   2.696
    3    HB   ILE  95           HB       ILE  95   4.190  19.893   1.410
    4   HG12  ILE  95          HG12      ILE  95   6.973  20.196   0.250
    5   HG13  ILE  95          HG13      ILE  95   6.306  18.650   0.763
    6   HG21  ILE  95          HG21      ILE  95   5.973  22.336   1.187
    7   HG23  ILE  95          HG22      ILE  95   4.251  22.291   1.558
    8   HG22  ILE  95          HG23      ILE  95   4.814  21.891  -0.065
    9   HD13  ILE  95          HD11      ILE  95   4.730  18.606  -0.953
   10   HD12  ILE  95          HD12      ILE  95   6.084  19.409  -1.749
   11   HD11  ILE  95          HD13      ILE  95   4.731  20.360  -1.139

  No H/Q in entry =          11
  In of MODEL   59
    1    H    GLU  96           H        GLU  96   3.609  19.920   4.016
    2    HA   GLU  96           HA       GLU  96   3.034  22.572   4.787
    3    HB2  GLU  96           HB2      GLU  96   1.334  20.813   4.804
    4    HB3  GLU  96           HB3      GLU  96   2.194  19.966   6.087
    5    HG2  GLU  96           HG2      GLU  96   1.206  21.256   7.672
    6    HG3  GLU  96           HG3      GLU  96   1.757  22.726   6.878

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LEU  97           H        LEU  97   4.853  19.986   6.382
    2    HA   LEU  97           HA       LEU  97   5.252  21.315   8.857
    3    HB2  LEU  97           HB2      LEU  97   6.744  19.132   7.417
    4    HB3  LEU  97           HB3      LEU  97   7.358  19.800   8.928
    5    HG   LEU  97           HG       LEU  97   4.529  18.749   8.636
    6   HD12  LEU  97          HD11      LEU  97   5.450  16.717   9.830
    7   HD11  LEU  97          HD12      LEU  97   7.067  17.326   9.475
    8   HD13  LEU  97          HD13      LEU  97   5.979  16.891   8.156
    9   HD23  LEU  97          HD21      LEU  97   5.000  18.435  11.195
   10   HD22  LEU  97          HD22      LEU  97   4.639  20.055  10.602
   11   HD21  LEU  97          HD23      LEU  97   6.307  19.589  10.930

  No H/Q in entry =          11
  In of MODEL   59
    1    H    HIS  98           H        HIS  98   7.096  21.320   5.815
    2    HA   HIS  98           HA       HIS  98   9.281  22.862   6.703
    3    HB2  HIS  98           HB2      HIS  98   7.960  22.641   3.988
    4    HB3  HIS  98           HB3      HIS  98   9.417  23.596   4.270
    5    HD1  HIS  98           HD1      HIS  98   8.153  20.044   4.282
    6    HD2  HIS  98           HD2      HIS  98  11.769  22.084   4.687
    7    HE1  HIS  98           HE1      HIS  98   9.980  18.287   4.200
    8    HE2  HIS  98           HE2      HIS  98  12.186  19.508   4.446

  No H/Q in entry =           8
  In of MODEL   59
    1    H    GLU  99           H        GLU  99   6.063  23.752   5.561
    2    HA   GLU  99           HA       GLU  99   6.484  26.561   5.514
    3    HB2  GLU  99           HB2      GLU  99   4.578  25.427   4.394
    4    HB3  GLU  99           HB3      GLU  99   3.890  25.067   5.977
    5    HG2  GLU  99           HG2      GLU  99   3.751  27.459   6.492
    6    HG3  GLU  99           HG3      GLU  99   4.520  27.855   4.959

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LYS 100           H        LYS 100   5.342  24.330   8.034
    2    HA   LYS 100           HA       LYS 100   4.803  26.382   9.944
    3    HB2  LYS 100           HB2      LYS 100   5.336  23.421  10.269
    4    HB3  LYS 100           HB3      LYS 100   4.917  24.493  11.611
    5    HG2  LYS 100           HG2      LYS 100   2.850  25.169  10.384
    6    HG3  LYS 100           HG3      LYS 100   3.248  24.000   9.122
    7    HD2  LYS 100           HD2      LYS 100   3.157  22.172  10.774
    8    HD3  LYS 100           HD3      LYS 100   2.776  23.334  12.048
    9    HE2  LYS 100           HE2      LYS 100   0.722  23.994  10.806
   10    HE3  LYS 100           HE3      LYS 100   1.092  22.775   9.580
   11    HZ1  LYS 100           HZ1      LYS 100   0.841  22.097  12.460
   12    HZ3  LYS 100           HZ2      LYS 100   0.798  21.050  11.119
   13    HZ2  LYS 100           HZ3      LYS 100  -0.499  22.108  11.416

  No H/Q in entry =          13
  In of MODEL   59
    1    H    LEU 101           H        LEU 101   7.691  24.546   9.075
    2    HA   LEU 101           HA       LEU 101   9.322  25.349  11.269
    3    HB2  LEU 101           HB2      LEU 101   9.877  24.368   8.481
    4    HB3  LEU 101           HB3      LEU 101  11.197  25.008   9.454
    5    HG   LEU 101           HG       LEU 101   9.341  22.875  10.522
    6   HD12  LEU 101          HD11      LEU 101  11.366  21.351   9.888
    7   HD11  LEU 101          HD12      LEU 101  11.742  22.614   8.719
    8   HD13  LEU 101          HD13      LEU 101  10.199  21.766   8.634
    9   HD21  LEU 101          HD21      LEU 101  12.088  23.936  11.232
   10   HD23  LEU 101          HD22      LEU 101  11.525  22.369  11.808
   11   HD22  LEU 101          HD23      LEU 101  10.660  23.837  12.262

  No H/Q in entry =          11
  In of MODEL   59
    1    H    LYS 102           H        LYS 102   7.750  27.249   9.152
    2    HA   LYS 102           HA       LYS 102   7.861  29.542   8.872
    3    HB2  LYS 102           HB2      LYS 102   9.442  29.390  10.955
    4    HB3  LYS 102           HB3      LYS 102  10.734  29.570   9.786
    5    HG2  LYS 102           HG2      LYS 102   8.667  31.552  10.676
    6    HG3  LYS 102           HG3      LYS 102  10.382  31.786  10.411
    7    HD2  LYS 102           HD2      LYS 102   8.404  31.407   8.126
    8    HD3  LYS 102           HD3      LYS 102   8.818  32.976   8.800
    9    HE2  LYS 102           HE2      LYS 102  10.154  31.781   6.708
   10    HE3  LYS 102           HE3      LYS 102  10.800  33.072   7.721
   11    HZ2  LYS 102           HZ1      LYS 102  12.288  31.145   7.522
   12    HZ1  LYS 102           HZ2      LYS 102  11.117  30.177   8.270
   13    HZ3  LYS 102           HZ3      LYS 102  11.837  31.448   9.129

  No H/Q in entry =          13
  In of MODEL   59
    1    H    ALA 103           H        ALA 103  11.091  28.154   8.271
    2    HA   ALA 103           HA       ALA 103  12.059  29.526   6.195
    3    HB2  ALA 103           HB1      ALA 103  12.900  27.304   5.247
    4    HB1  ALA 103           HB2      ALA 103  12.004  26.537   6.557
    5    HB3  ALA 103           HB3      ALA 103  13.315  27.658   6.925

  No H/Q in entry =           5
  In of MODEL   59
    1    H1   LYS   3           H1       LYS   3 -31.362   5.191 -20.155
    2    H2   LYS   3           H3       LYS   3 -30.335   4.921 -21.480
    3    H3   LYS   3           H2       LYS   3 -31.688   3.925 -21.237
    4    HA   LYS   3           HA       LYS   3 -30.649   2.616 -19.786
    5    HB2  LYS   3           HB2      LYS   3 -28.411   4.106 -21.105
    6    HB3  LYS   3           HB3      LYS   3 -28.053   2.942 -19.830
    7    HG2  LYS   3           HG2      LYS   3 -29.372   1.262 -21.172
    8    HG3  LYS   3           HG3      LYS   3 -29.359   2.435 -22.488
    9    HD2  LYS   3           HD2      LYS   3 -26.875   2.441 -22.388
   10    HD3  LYS   3           HD3      LYS   3 -26.956   1.164 -21.176
   11    HE2  LYS   3           HE2      LYS   3 -28.362  -0.118 -22.893
   12    HE3  LYS   3           HE3      LYS   3 -27.776   1.063 -24.063
   13    HZ3  LYS   3           HZ1      LYS   3 -25.917  -0.083 -24.272
   14    HZ2  LYS   3           HZ2      LYS   3 -26.512  -1.257 -23.199
   15    HZ1  LYS   3           HZ3      LYS   3 -25.594   0.045 -22.610

  No H/Q in entry =          15
  In of MODEL   59
    1    H    LYS   4           H        LYS   4 -30.735   2.515 -17.723
    2    HA   LYS   4           HA       LYS   4 -30.145   4.867 -16.110
    3    HB2  LYS   4           HB2      LYS   4 -31.232   2.136 -15.373
    4    HB3  LYS   4           HB3      LYS   4 -31.096   3.507 -14.273
    5    HG2  LYS   4           HG2      LYS   4 -32.852   3.309 -16.725
    6    HG3  LYS   4           HG3      LYS   4 -33.377   3.372 -15.045
    7    HD2  LYS   4           HD2      LYS   4 -32.790   5.629 -14.814
    8    HD3  LYS   4           HD3      LYS   4 -31.721   5.590 -16.216
    9    HE2  LYS   4           HE2      LYS   4 -33.698   6.862 -16.744
   10    HE3  LYS   4           HE3      LYS   4 -33.691   5.368 -17.681
   11    HZ3  LYS   4           HZ1      LYS   4 -35.254   4.416 -16.144
   12    HZ2  LYS   4           HZ2      LYS   4 -35.866   5.872 -16.771
   13    HZ1  LYS   4           HZ3      LYS   4 -35.235   5.824 -15.194

  No H/Q in entry =          13
  In of MODEL   59
    1    H    HIS   5           H        HIS   5 -28.713   5.053 -14.493
    2    HA   HIS   5           HA       HIS   5 -26.343   3.325 -14.743
    3    HB2  HIS   5           HB2      HIS   5 -26.746   6.090 -13.601
    4    HB3  HIS   5           HB3      HIS   5 -25.224   5.204 -13.537
    5    HD1  HIS   5           HD1      HIS   5 -23.779   6.436 -15.124
    6    HD2  HIS   5           HD2      HIS   5 -27.516   5.610 -16.735
    7    HE1  HIS   5           HE1      HIS   5 -23.589   6.972 -17.584
    8    HE2  HIS   5           HE2      HIS   5 -25.868   6.457 -18.534

  No H/Q in entry =           8
  In of MODEL   59
    1    H    ILE   6           H        ILE   6 -26.070   1.792 -13.388
    2    HA   ILE   6           HA       ILE   6 -27.109   2.073 -10.648
    3    HB   ILE   6           HB       ILE   6 -26.145  -0.385 -12.116
    4   HG12  ILE   6          HG12      ILE   6 -28.944   0.445 -11.337
    5   HG13  ILE   6          HG13      ILE   6 -28.277   0.601 -12.962
    6   HG23  ILE   6          HG21      ILE   6 -26.498  -1.614 -10.236
    7   HG22  ILE   6          HG22      ILE   6 -27.719  -0.507  -9.604
    8   HG21  ILE   6          HG23      ILE   6 -26.008  -0.091  -9.489
    9   HD13  ILE   6          HD11      ILE   6 -28.633  -1.547 -13.424
   10   HD12  ILE   6          HD12      ILE   6 -29.676  -1.545 -12.001
   11   HD11  ILE   6          HD13      ILE   6 -27.999  -2.076 -11.866

  No H/Q in entry =          11
  In of MODEL   59
    1    H    TYR   7           H        TYR   7 -25.406   2.820  -9.343
    2    HA   TYR   7           HA       TYR   7 -22.642   1.971  -9.952
    3    HB2  TYR   7           HB2      TYR   7 -23.742   4.390  -8.543
    4    HB3  TYR   7           HB3      TYR   7 -22.036   3.949  -8.539
    5    HD1  TYR   7           HD1      TYR   7 -22.972   2.897 -11.626
    6    HD2  TYR   7           HD2      TYR   7 -22.504   6.542  -9.467
    7    HE1  TYR   7           HE1      TYR   7 -22.554   4.099 -13.735
    8    HE2  TYR   7           HE2      TYR   7 -22.128   7.749 -11.569
    9    HH   TYR   7           HH       TYR   7 -22.299   7.605 -13.803

  No H/Q in entry =           9
  In of MODEL   59
    1    H    LEU   8           H        LEU   8 -21.644   0.690  -8.576
    2    HA   LEU   8           HA       LEU   8 -22.804   0.203  -5.904
    3    HB2  LEU   8           HB2      LEU   8 -20.995  -1.421  -7.669
    4    HB3  LEU   8           HB3      LEU   8 -21.196  -1.775  -5.954
    5    HG   LEU   8           HG       LEU   8 -23.657  -2.065  -6.417
    6   HD13  LEU   8          HD11      LEU   8 -23.800  -0.901  -8.555
    7   HD12  LEU   8          HD12      LEU   8 -24.252  -2.592  -8.769
    8   HD11  LEU   8          HD13      LEU   8 -22.658  -2.035  -9.275
    9   HD23  LEU   8          HD21      LEU   8 -22.263  -4.084  -8.042
   10   HD22  LEU   8          HD22      LEU   8 -23.367  -4.270  -6.681
   11   HD21  LEU   8          HD23      LEU   8 -21.683  -3.836  -6.395

  No H/Q in entry =          11
  In of MODEL   59
    1    H    PHE   9           H        PHE   9 -21.594   0.694  -4.106
    2    HA   PHE   9           HA       PHE   9 -18.836   1.732  -4.565
    3    HB2  PHE   9           HB2      PHE   9 -20.960   2.775  -2.697
    4    HB3  PHE   9           HB3      PHE   9 -19.269   3.248  -2.615
    5    HD1  PHE   9           HD1      PHE   9 -18.240   4.576  -4.382
    6    HD2  PHE   9           HD2      PHE   9 -22.387   3.491  -4.559
    7    HE1  PHE   9           HE1      PHE   9 -18.595   6.224  -6.197
    8    HE2  PHE   9           HE2      PHE   9 -22.744   5.150  -6.369
    9    HZ   PHE   9           HZ       PHE   9 -20.844   6.513  -7.194

  No H/Q in entry =           9
  In of MODEL   59
    1    H    SER  10           H        SER  10 -17.239   0.917  -3.349
    2    HA   SER  10           HA       SER  10 -17.506   0.064  -0.654
    3    HB2  SER  10           HB2      SER  10 -18.605  -1.880  -1.715
    4    HB3  SER  10           HB3      SER  10 -17.185  -2.113  -2.722
    5    HG   SER  10           HG       SER  10 -17.436  -3.322  -0.619

  No H/Q in entry =           5
  In of MODEL   59
    1    H    SER  11           H        SER  11 -15.515   0.227   0.258
    2    HA   SER  11           HA       SER  11 -13.320   1.169  -1.215
    3    HB2  SER  11           HB2      SER  11 -13.905   1.238   1.356
    4    HB3  SER  11           HB3      SER  11 -12.869  -0.190   1.393
    5    HG   SER  11           HG       SER  11 -11.530   1.386  -0.066

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ALA  12           H        ALA  12 -14.387  -1.564  -2.047
    2    HA   ALA  12           HA       ALA  12 -11.758  -2.710  -2.527
    3    HB2  ALA  12           HB1      ALA  12 -12.130  -3.973  -0.599
    4    HB3  ALA  12           HB2      ALA  12 -12.716  -5.034  -1.878
    5    HB1  ALA  12           HB3      ALA  12 -13.863  -4.113  -0.906

  No H/Q in entry =           5
  In of MODEL   59
    1    H    GLY  13           H        GLY  13 -12.613  -1.752  -4.574
    2    HA3  GLY  13           HA2      GLY  13 -14.801  -2.656  -6.024
    3    HA2  GLY  13           HA3      GLY  13 -13.300  -2.074  -6.756

  No H/Q in entry =           3
  In of MODEL   59
    1    H    MET  14           H        MET  14 -11.714  -4.302  -5.558
    2    HA   MET  14           HA       MET  14 -11.825  -6.081  -7.718
    3    HB2  MET  14           HB2      MET  14  -9.843  -5.963  -6.269
    4    HB3  MET  14           HB3      MET  14 -10.736  -6.726  -4.954
    5    HG2  MET  14           HG2      MET  14  -9.376  -8.398  -6.116
    6    HG3  MET  14           HG3      MET  14 -11.082  -8.729  -6.423
    7    HE3  MET  14           HE1      MET  14  -7.723  -7.296  -7.837
    8    HE2  MET  14           HE2      MET  14  -7.809  -8.213  -9.341
    9    HE1  MET  14           HE3      MET  14  -7.969  -9.049  -7.799

  No H/Q in entry =           9
  In of MODEL   59
    1    H    SER  15           H        SER  15 -13.211  -6.569  -4.484
    2    HA   SER  15           HA       SER  15 -14.367  -9.119  -5.216
    3    HB2  SER  15           HB2      SER  15 -14.835  -7.361  -2.800
    4    HB3  SER  15           HB3      SER  15 -15.735  -8.846  -3.095
    5    HG   SER  15           HG       SER  15 -13.087  -8.469  -2.352

  No H/Q in entry =           5
  In of MODEL   59
    1    H    THR  16           H        THR  16 -15.584  -5.786  -4.978
    2    HA   THR  16           HA       THR  16 -18.344  -6.410  -5.569
    3    HB   THR  16           HB       THR  16 -16.864  -3.805  -6.080
    4    HG1  THR  16           HG1      THR  16 -17.212  -5.088  -3.792
    5   HG22  THR  16          HG21      THR  16 -19.737  -4.270  -5.272
    6   HG21  THR  16          HG22      THR  16 -19.233  -4.178  -6.969
    7   HG23  THR  16          HG23      THR  16 -19.012  -2.792  -5.894

  No H/Q in entry =           7
  In of MODEL   59
    1    H    SER  17           H        SER  17 -15.459  -5.768  -7.362
    2    HA   SER  17           HA       SER  17 -16.567  -5.134  -9.901
    3    HB2  SER  17           HB2      SER  17 -13.897  -6.312  -9.112
    4    HB3  SER  17           HB3      SER  17 -14.321  -5.945 -10.784
    5    HG   SER  17           HG       SER  17 -13.285  -4.313  -9.080

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LEU  18           H        LEU  18 -15.888  -8.217  -8.373
    2    HA   LEU  18           HA       LEU  18 -16.358  -9.793 -10.705
    3    HB2  LEU  18           HB2      LEU  18 -15.136 -10.670  -8.773
    4    HB3  LEU  18           HB3      LEU  18 -16.575 -10.493  -7.772
    5    HG   LEU  18           HG       LEU  18 -17.744 -12.099  -9.300
    6   HD11  LEU  18          HD11      LEU  18 -14.974 -12.189 -10.477
    7   HD13  LEU  18          HD12      LEU  18 -16.519 -12.011 -11.308
    8   HD12  LEU  18          HD13      LEU  18 -16.068 -13.564 -10.608
    9   HD21  LEU  18          HD21      LEU  18 -15.309 -12.956  -7.777
   10   HD23  LEU  18          HD22      LEU  18 -16.499 -14.084  -8.429
   11   HD22  LEU  18          HD23      LEU  18 -16.983 -12.892  -7.224

  No H/Q in entry =          11
  In of MODEL   59
    1    H    LEU  19           H        LEU  19 -18.434  -8.618  -8.060
    2    HA   LEU  19           HA       LEU  19 -20.825  -9.929  -8.915
    3    HB2  LEU  19           HB2      LEU  19 -20.655  -9.045  -6.679
    4    HB3  LEU  19           HB3      LEU  19 -20.404  -7.416  -7.305
    5    HG   LEU  19           HG       LEU  19 -22.723  -7.359  -8.093
    6   HD13  LEU  19          HD11      LEU  19 -23.120  -9.710  -8.514
    7   HD12  LEU  19          HD12      LEU  19 -24.275  -9.142  -7.309
    8   HD11  LEU  19          HD13      LEU  19 -22.876 -10.089  -6.809
    9   HD22  LEU  19          HD21      LEU  19 -23.669  -6.943  -5.997
   10   HD21  LEU  19          HD22      LEU  19 -21.939  -6.699  -5.761
   11   HD23  LEU  19          HD23      LEU  19 -22.702  -8.191  -5.212

  No H/Q in entry =          11
  In of MODEL   59
    1    H    VAL  20           H        VAL  20 -19.458  -6.719  -9.650
    2    HA   VAL  20           HA       VAL  20 -21.582  -5.808 -11.283
    3    HB   VAL  20           HB       VAL  20 -18.621  -5.086 -11.376
    4   HG12  VAL  20          HG11      VAL  20 -19.410  -3.060 -12.651
    5   HG11  VAL  20          HG12      VAL  20 -20.968  -3.862 -12.843
    6   HG13  VAL  20          HG13      VAL  20 -19.519  -4.571 -13.554
    7   HG21  VAL  20          HG21      VAL  20 -21.028  -3.896 -10.055
    8   HG23  VAL  20          HG22      VAL  20 -19.604  -2.922 -10.416
    9   HG22  VAL  20          HG23      VAL  20 -19.467  -4.322  -9.350

  No H/Q in entry =           9
  In of MODEL   59
    1    H    SER  21           H        SER  21 -18.714  -7.753 -12.210
    2    HA   SER  21           HA       SER  21 -19.446  -7.736 -14.977
    3    HB2  SER  21           HB2      SER  21 -17.916  -9.642 -15.239
    4    HB3  SER  21           HB3      SER  21 -17.164  -8.340 -14.319
    5    HG   SER  21           HG       SER  21 -17.003  -9.605 -12.686

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LYS  22           H        LYS  22 -20.464  -9.912 -12.379
    2    HA   LYS  22           HA       LYS  22 -21.892 -11.639 -14.193
    3    HB2  LYS  22           HB2      LYS  22 -22.264 -11.236 -11.222
    4    HB3  LYS  22           HB3      LYS  22 -22.990 -12.522 -12.183
    5    HG2  LYS  22           HG2      LYS  22 -20.020 -12.156 -11.831
    6    HG3  LYS  22           HG3      LYS  22 -21.013 -13.222 -10.837
    7    HD2  LYS  22           HD2      LYS  22 -21.652 -14.486 -12.851
    8    HD3  LYS  22           HD3      LYS  22 -20.623 -13.433 -13.824
    9    HE2  LYS  22           HE2      LYS  22 -18.653 -14.193 -12.567
   10    HE3  LYS  22           HE3      LYS  22 -19.678 -15.238 -11.585
   11    HZ2  LYS  22           HZ1      LYS  22 -18.984 -15.506 -14.441
   12    HZ1  LYS  22           HZ2      LYS  22 -20.310 -16.322 -13.764
   13    HZ3  LYS  22           HZ3      LYS  22 -18.743 -16.620 -13.182

  No H/Q in entry =          13
  In of MODEL   59
    1    H    MET  23           H        MET  23 -22.783  -8.712 -12.405
    2    HA   MET  23           HA       MET  23 -25.573  -8.926 -12.965
    3    HB2  MET  23           HB2      MET  23 -23.841  -6.527 -12.407
    4    HB3  MET  23           HB3      MET  23 -25.588  -6.439 -12.623
    5    HG2  MET  23           HG2      MET  23 -25.963  -7.717 -10.634
    6    HG3  MET  23           HG3      MET  23 -24.239  -8.049 -10.465
    7    HE2  MET  23           HE1      MET  23 -26.718  -4.478  -9.403
    8    HE1  MET  23           HE2      MET  23 -26.900  -5.488 -10.836
    9    HE3  MET  23           HE3      MET  23 -25.927  -4.018 -10.912

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ARG  24           H        ARG  24 -22.848  -7.416 -14.725
    2    HA   ARG  24           HA       ARG  24 -24.358  -6.225 -16.781
    3    HB2  ARG  24           HB2      ARG  24 -21.495  -7.240 -16.746
    4    HB3  ARG  24           HB3      ARG  24 -22.184  -6.380 -18.101
    5    HG2  ARG  24           HG2      ARG  24 -22.514  -4.355 -16.705
    6    HG3  ARG  24           HG3      ARG  24 -21.868  -5.240 -15.298
    7    HD2  ARG  24           HD2      ARG  24 -19.756  -5.664 -16.584
    8    HD3  ARG  24           HD3      ARG  24 -20.410  -4.689 -17.894
    9    HE   ARG  24           HE       ARG  24 -20.454  -3.036 -15.729
   10   HH21  ARG  24          HH11      ARG  24 -19.421  -1.182 -16.468
   11   HH22  ARG  24          HH12      ARG  24 -17.845  -1.301 -17.172
   12   HH11  ARG  24          HH21      ARG  24 -18.033  -4.833 -17.267
   13   HH12  ARG  24          HH22      ARG  24 -17.029  -3.465 -17.630

  No H/Q in entry =          13
  In of MODEL   59
    1    H    ALA  25           H        ALA  25 -23.100  -9.506 -16.412
    2    HA   ALA  25           HA       ALA  25 -23.638 -10.417 -19.041
    3    HB1  ALA  25           HB1      ALA  25 -22.871 -12.403 -18.289
    4    HB3  ALA  25           HB2      ALA  25 -23.957 -12.398 -16.900
    5    HB2  ALA  25           HB3      ALA  25 -22.440 -11.505 -16.834

  No H/Q in entry =           5
  In of MODEL   59
    1    H    GLN  26           H        GLN  26 -25.523 -10.471 -16.055
    2    HA   GLN  26           HA       GLN  26 -27.793 -11.793 -17.092
    3    HB2  GLN  26           HB2      GLN  26 -27.404  -9.977 -14.733
    4    HB3  GLN  26           HB3      GLN  26 -28.928 -10.774 -15.099
    5    HG2  GLN  26           HG2      GLN  26 -26.293 -12.109 -14.548
    6    HG3  GLN  26           HG3      GLN  26 -27.679 -12.042 -13.467
    7   HE21  GLN  26          HE21      GLN  26 -26.346 -14.178 -14.674
    8   HE22  GLN  26          HE22      GLN  26 -27.327 -15.284 -15.468

  No H/Q in entry =           8
  In of MODEL   59
    1    H    ALA  27           H        ALA  27 -27.011  -8.352 -16.754
    2    HA   ALA  27           HA       ALA  27 -29.527  -7.382 -17.610
    3    HB1  ALA  27           HB1      ALA  27 -27.798  -5.969 -16.487
    4    HB3  ALA  27           HB2      ALA  27 -28.389  -5.259 -17.990
    5    HB2  ALA  27           HB3      ALA  27 -26.819  -6.060 -17.953

  No H/Q in entry =           5
  In of MODEL   59
    1    H    GLU  28           H        GLU  28 -26.739  -8.527 -19.400
    2    HA   GLU  28           HA       GLU  28 -27.663  -7.579 -21.958
    3    HB2  GLU  28           HB2      GLU  28 -25.272  -8.147 -21.272
    4    HB3  GLU  28           HB3      GLU  28 -25.742  -9.837 -21.450
    5    HG2  GLU  28           HG2      GLU  28 -24.588  -9.052 -23.411
    6    HG3  GLU  28           HG3      GLU  28 -26.264  -9.453 -23.787

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LYS  29           H        LYS  29 -27.735 -10.655 -20.241
    2    HA   LYS  29           HA       LYS  29 -28.932 -12.218 -22.241
    3    HB2  LYS  29           HB2      LYS  29 -27.885 -13.117 -20.196
    4    HB3  LYS  29           HB3      LYS  29 -29.205 -12.445 -19.241
    5    HG2  LYS  29           HG2      LYS  29 -30.785 -13.907 -20.314
    6    HG3  LYS  29           HG3      LYS  29 -29.537 -14.513 -21.401
    7    HD2  LYS  29           HD2      LYS  29 -28.383 -15.596 -19.622
    8    HD3  LYS  29           HD3      LYS  29 -29.351 -14.769 -18.402
    9    HE2  LYS  29           HE2      LYS  29 -29.996 -17.154 -18.731
   10    HE3  LYS  29           HE3      LYS  29 -31.317 -16.023 -19.025
   11    HZ1  LYS  29           HZ1      LYS  29 -30.696 -16.180 -21.437
   12    HZ3  LYS  29           HZ2      LYS  29 -31.371 -17.583 -20.759
   13    HZ2  LYS  29           HZ3      LYS  29 -29.699 -17.489 -21.023

  No H/Q in entry =          13
  In of MODEL   59
    1    H    TYR  30           H        TYR  30 -30.463 -10.126 -19.808
    2    HA   TYR  30           HA       TYR  30 -33.078 -10.711 -21.094
    3    HB2  TYR  30           HB2      TYR  30 -32.532  -9.478 -18.384
    4    HB3  TYR  30           HB3      TYR  30 -34.123  -9.816 -19.064
    5    HD1  TYR  30           HD1      TYR  30 -34.932 -12.149 -19.249
    6    HD2  TYR  30           HD2      TYR  30 -31.167 -11.231 -17.483
    7    HE1  TYR  30           HE1      TYR  30 -34.761 -14.455 -18.404
    8    HE2  TYR  30           HE2      TYR  30 -30.998 -13.523 -16.643
    9    HH   TYR  30           HH       TYR  30 -32.513 -15.973 -17.720

  No H/Q in entry =           9
  In of MODEL   59
    1    H    GLU  31           H        GLU  31 -30.982  -8.645 -21.891
    2    HA   GLU  31           HA       GLU  31 -30.983  -6.503 -22.756
    3    HB2  GLU  31           HB2      GLU  31 -33.833  -7.351 -23.311
    4    HB3  GLU  31           HB3      GLU  31 -33.036  -5.963 -24.051
    5    HG2  GLU  31           HG2      GLU  31 -31.480  -7.360 -25.184
    6    HG3  GLU  31           HG3      GLU  31 -32.002  -8.779 -24.278

  No H/Q in entry =           6
  In of MODEL   59
    1    H    VAL  32           H        VAL  32 -31.243  -6.357 -20.031
    2    HA   VAL  32           HA       VAL  32 -33.206  -4.314 -19.451
    3    HB   VAL  32           HB       VAL  32 -30.807  -5.173 -17.804
    4   HG12  VAL  32          HG11      VAL  32 -32.416  -4.380 -15.956
    5   HG11  VAL  32          HG12      VAL  32 -33.260  -3.537 -17.255
    6   HG13  VAL  32          HG13      VAL  32 -31.576  -3.154 -16.906
    7   HG21  VAL  32          HG21      VAL  32 -32.486  -6.981 -18.491
    8   HG23  VAL  32          HG22      VAL  32 -33.584  -6.178 -17.370
    9   HG22  VAL  32          HG23      VAL  32 -32.048  -6.824 -16.790

  No H/Q in entry =           9
  In of MODEL   59
    1    HA   PRO  33           HA       PRO  33 -30.270  -1.290 -21.123
    2    HB2  PRO  33           HB2      PRO  33 -31.878   0.867 -21.074
    3    HB3  PRO  33           HB3      PRO  33 -32.267  -0.476 -22.151
    4    HG2  PRO  33           HG2      PRO  33 -33.315   0.053 -19.369
    5    HG3  PRO  33           HG3      PRO  33 -34.239  -0.226 -20.846
    6    HD2  PRO  33           HD2      PRO  33 -33.728  -2.244 -19.130
    7    HD3  PRO  33           HD3      PRO  33 -33.743  -2.522 -20.871

  No H/Q in entry =           7
  In of MODEL   59
    1    H    VAL  34           H        VAL  34 -29.024  -1.740 -19.139
    2    HA   VAL  34           HA       VAL  34 -28.881   0.727 -17.534
    3    HB   VAL  34           HB       VAL  34 -28.276  -0.671 -15.557
    4   HG12  VAL  34          HG11      VAL  34 -30.654  -1.643 -15.280
    5   HG11  VAL  34          HG12      VAL  34 -30.971  -0.928 -16.860
    6   HG13  VAL  34          HG13      VAL  34 -30.490   0.098 -15.508
    7   HG21  VAL  34          HG21      VAL  34 -28.331  -2.741 -17.527
    8   HG23  VAL  34          HG22      VAL  34 -29.399  -3.122 -16.175
    9   HG22  VAL  34          HG23      VAL  34 -27.701  -2.755 -15.880

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ILE  35           H        ILE  35 -26.943   1.265 -16.665
    2    HA   ILE  35           HA       ILE  35 -24.557   0.015 -17.855
    3    HB   ILE  35           HB       ILE  35 -25.100   2.899 -17.109
    4   HG12  ILE  35          HG12      ILE  35 -24.009   1.589 -19.608
    5   HG13  ILE  35          HG13      ILE  35 -25.670   2.141 -19.393
    6   HG21  ILE  35          HG21      ILE  35 -22.468   1.476 -17.337
    7   HG23  ILE  35          HG22      ILE  35 -22.999   2.658 -16.141
    8   HG22  ILE  35          HG23      ILE  35 -22.607   3.177 -17.780
    9   HD11  ILE  35          HD11      ILE  35 -24.379   4.407 -18.808
   10   HD13  ILE  35          HD12      ILE  35 -24.865   3.970 -20.446
   11   HD12  ILE  35          HD13      ILE  35 -23.209   3.684 -19.911

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ILE  36           H        ILE  36 -23.315  -0.921 -16.211
    2    HA   ILE  36           HA       ILE  36 -23.842  -0.273 -13.363
    3    HB   ILE  36           HB       ILE  36 -22.873  -2.956 -14.400
    4   HG12  ILE  36          HG12      ILE  36 -25.729  -2.262 -13.708
    5   HG13  ILE  36          HG13      ILE  36 -25.123  -2.248 -15.365
    6   HG23  ILE  36          HG21      ILE  36 -23.231  -3.760 -12.278
    7   HG22  ILE  36          HG22      ILE  36 -24.422  -2.519 -11.887
    8   HG21  ILE  36          HG23      ILE  36 -22.706  -2.112 -11.930
    9   HD13  ILE  36          HD11      ILE  36 -25.187  -4.471 -15.530
   10   HD12  ILE  36          HD12      ILE  36 -26.285  -4.370 -14.155
   11   HD11  ILE  36          HD13      ILE  36 -24.574  -4.709 -13.894

  No H/Q in entry =          11
  In of MODEL   59
    1    H    GLU  37           H        GLU  37 -22.114   0.457 -12.236
    2    HA   GLU  37           HA       GLU  37 -19.372  -0.235 -13.083
    3    HB2  GLU  37           HB2      GLU  37 -20.273   2.534 -12.305
    4    HB3  GLU  37           HB3      GLU  37 -18.633   2.042 -12.726
    5    HG2  GLU  37           HG2      GLU  37 -20.990   2.154 -14.585
    6    HG3  GLU  37           HG3      GLU  37 -19.658   3.306 -14.509

  No H/Q in entry =           6
  In of MODEL   59
    1    H    ALA  38           H        ALA  38 -17.911  -0.373 -11.366
    2    HA   ALA  38           HA       ALA  38 -19.005  -0.189  -8.621
    3    HB1  ALA  38           HB1      ALA  38 -17.177  -2.075  -9.974
    4    HB3  ALA  38           HB2      ALA  38 -18.244  -2.332  -8.593
    5    HB2  ALA  38           HB3      ALA  38 -16.669  -1.573  -8.362

  No H/Q in entry =           5
  In of MODEL   59
    1    H    PHE  39           H        PHE  39 -17.852   1.103  -7.148
    2    HA   PHE  39           HA       PHE  39 -15.366   2.402  -8.018
    3    HB2  PHE  39           HB2      PHE  39 -17.692   3.903  -6.811
    4    HB3  PHE  39           HB3      PHE  39 -16.132   4.577  -7.278
    5    HD1  PHE  39           HD1      PHE  39 -15.531   4.781  -9.651
    6    HD2  PHE  39           HD2      PHE  39 -19.414   3.548  -8.390
    7    HE1  PHE  39           HE1      PHE  39 -16.415   5.298 -11.907
    8    HE2  PHE  39           HE2      PHE  39 -20.309   4.054 -10.635
    9    HZ   PHE  39           HZ       PHE  39 -18.811   4.901 -12.409

  No H/Q in entry =           9
  In of MODEL   59
    1    HA   PRO  40           HA       PRO  40 -14.482   1.775  -3.700
    2    HB2  PRO  40           HB2      PRO  40 -12.823   3.882  -3.099
    3    HB3  PRO  40           HB3      PRO  40 -12.296   2.552  -4.131
    4    HG2  PRO  40           HG2      PRO  40 -13.431   5.221  -4.952
    5    HG3  PRO  40           HG3      PRO  40 -11.955   4.437  -5.514
    6    HD2  PRO  40           HD2      PRO  40 -14.142   4.218  -6.964
    7    HD3  PRO  40           HD3      PRO  40 -13.124   2.799  -6.724

  No H/Q in entry =           7
  In of MODEL   59
    1    H    GLU  41           H        GLU  41 -15.193   2.763  -1.603
    2    HA   GLU  41           HA       GLU  41 -17.514   4.359  -1.664
    3    HB2  GLU  41           HB2      GLU  41 -17.369   4.383   0.737
    4    HB3  GLU  41           HB3      GLU  41 -16.909   2.781   0.161
    5    HG2  GLU  41           HG2      GLU  41 -14.566   3.282   0.535
    6    HG3  GLU  41           HG3      GLU  41 -14.973   4.929   1.018

  No H/Q in entry =           6
  In of MODEL   59
    1    H    THR  42           H        THR  42 -14.229   5.431  -1.669
    2    HA   THR  42           HA       THR  42 -14.727   7.995  -0.517
    3    HB   THR  42           HB       THR  42 -12.578   8.650  -1.592
    4    HG1  THR  42           HG1      THR  42 -11.698   6.391  -2.505
    5   HG21  THR  42          HG21      THR  42 -12.581   5.929  -0.262
    6   HG23  THR  42          HG22      THR  42 -12.526   7.489   0.562
    7   HG22  THR  42          HG23      THR  42 -11.169   6.972  -0.436

  No H/Q in entry =           7
  In of MODEL   59
    1    H    LEU  43           H        LEU  43 -15.515   6.800  -3.611
    2    HA   LEU  43           HA       LEU  43 -15.879   9.538  -4.642
    3    HB2  LEU  43           HB2      LEU  43 -16.101   6.854  -5.993
    4    HB3  LEU  43           HB3      LEU  43 -16.346   8.412  -6.781
    5    HG   LEU  43           HG       LEU  43 -13.730   7.396  -5.697
    6   HD11  LEU  43          HD11      LEU  43 -14.809   6.352  -7.827
    7   HD13  LEU  43          HD12      LEU  43 -13.122   6.858  -7.865
    8   HD12  LEU  43          HD13      LEU  43 -14.363   7.885  -8.579
    9   HD23  LEU  43          HD21      LEU  43 -12.929   9.379  -7.140
   10   HD22  LEU  43          HD22      LEU  43 -13.644   9.736  -5.566
   11   HD21  LEU  43          HD23      LEU  43 -14.595   9.947  -7.036

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ALA  44           H        ALA  44 -17.774   7.658  -2.790
    2    HA   ALA  44           HA       ALA  44 -20.214   7.375  -4.158
    3    HB2  ALA  44           HB1      ALA  44 -20.066   6.307  -2.037
    4    HB3  ALA  44           HB2      ALA  44 -21.241   7.602  -1.814
    5    HB1  ALA  44           HB3      ALA  44 -19.589   7.801  -1.230

  No H/Q in entry =           5
  In of MODEL   59
    1    H    GLY  45           H        GLY  45 -18.960  10.268  -2.655
    2    HA3  GLY  45           HA2      GLY  45 -21.458  11.642  -3.093
    3    HA2  GLY  45           HA3      GLY  45 -19.956  12.352  -2.500

  No H/Q in entry =           3
  In of MODEL   59
    1    H    GLU  46           H        GLU  46 -18.336  11.445  -4.740
    2    HA   GLU  46           HA       GLU  46 -19.041  13.593  -6.565
    3    HB2  GLU  46           HB2      GLU  46 -16.755  11.613  -6.543
    4    HB3  GLU  46           HB3      GLU  46 -16.918  12.947  -7.685
    5    HG2  GLU  46           HG2      GLU  46 -16.631  13.231  -4.701
    6    HG3  GLU  46           HG3      GLU  46 -15.332  13.434  -5.878

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LYS  47           H        LYS  47 -18.746  10.076  -6.927
    2    HA   LYS  47           HA       LYS  47 -19.798  10.191  -9.627
    3    HB2  LYS  47           HB2      LYS  47 -19.121   7.882  -7.801
    4    HB3  LYS  47           HB3      LYS  47 -19.706   7.699  -9.455
    5    HG2  LYS  47           HG2      LYS  47 -17.191   9.167  -8.721
    6    HG3  LYS  47           HG3      LYS  47 -17.244   7.465  -9.179
    7    HD2  LYS  47           HD2      LYS  47 -18.481   8.257 -11.275
    8    HD3  LYS  47           HD3      LYS  47 -17.927   9.871 -10.836
    9    HE2  LYS  47           HE2      LYS  47 -16.113   7.499 -11.217
   10    HE3  LYS  47           HE3      LYS  47 -16.452   8.704 -12.459
   11    HZ3  LYS  47           HZ1      LYS  47 -15.056  10.125 -11.532
   12    HZ2  LYS  47           HZ2      LYS  47 -14.493   8.835 -10.581
   13    HZ1  LYS  47           HZ3      LYS  47 -15.688   9.882  -9.975

  No H/Q in entry =          13
  In of MODEL   59
    1    H    GLY  48           H        GLY  48 -21.149   9.433  -6.490
    2    HA3  GLY  48           HA2      GLY  48 -23.459   8.122  -7.254
    3    HA2  GLY  48           HA3      GLY  48 -23.310   9.152  -5.831

  No H/Q in entry =           3
  In of MODEL   59
    1    H    GLN  49           H        GLN  49 -22.811  11.570  -7.439
    2    HA   GLN  49           HA       GLN  49 -25.416  12.555  -7.657
    3    HB2  GLN  49           HB2      GLN  49 -22.889  13.512  -8.984
    4    HB3  GLN  49           HB3      GLN  49 -24.396  14.409  -8.949
    5    HG2  GLN  49           HG2      GLN  49 -24.288  14.487  -6.510
    6    HG3  GLN  49           HG3      GLN  49 -22.793  13.570  -6.543
    7   HE21  GLN  49          HE21      GLN  49 -22.807  15.826  -5.316
    8   HE22  GLN  49          HE22      GLN  49 -21.931  17.111  -5.970

  No H/Q in entry =           8
  In of MODEL   59
    1    H    ASN  50           H        ASN  50 -23.602  10.711  -9.971
    2    HA   ASN  50           HA       ASN  50 -25.481  11.452 -12.108
    3    HB2  ASN  50           HB2      ASN  50 -22.827  10.032 -12.259
    4    HB3  ASN  50           HB3      ASN  50 -23.868  10.381 -13.631
    5   HD21  ASN  50          HD21      ASN  50 -21.308  11.382 -11.987
    6   HD22  ASN  50          HD22      ASN  50 -21.145  13.020 -12.358

  No H/Q in entry =           6
  In of MODEL   59
    1    H    ALA  51           H        ALA  51 -25.401   9.143  -9.814
    2    HA   ALA  51           HA       ALA  51 -26.047   6.928 -11.611
    3    HB2  ALA  51           HB1      ALA  51 -25.436   5.642  -9.887
    4    HB3  ALA  51           HB2      ALA  51 -26.617   6.417  -8.832
    5    HB1  ALA  51           HB3      ALA  51 -25.005   7.111  -9.010

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ASP  52           H        ASP  52 -28.004   5.782 -11.488
    2    HA   ASP  52           HA       ASP  52 -30.281   7.525 -10.904
    3    HB2  ASP  52           HB2      ASP  52 -29.940   4.999 -12.518
    4    HB3  ASP  52           HB3      ASP  52 -31.525   5.667 -12.129

  No H/Q in entry =           4
  In of MODEL   59
    1    H    VAL  53           H        VAL  53 -28.569   4.734  -9.798
    2    HA   VAL  53           HA       VAL  53 -30.065   4.843  -7.314
    3    HB   VAL  53           HB       VAL  53 -31.360   3.113  -8.550
    4   HG11  VAL  53          HG11      VAL  53 -29.545   2.307 -10.020
    5   HG13  VAL  53          HG12      VAL  53 -30.335   0.992  -9.152
    6   HG12  VAL  53          HG13      VAL  53 -28.760   1.577  -8.620
    7   HG23  VAL  53          HG21      VAL  53 -30.483   1.210  -6.803
    8   HG22  VAL  53          HG22      VAL  53 -31.679   2.467  -6.485
    9   HG21  VAL  53          HG23      VAL  53 -29.990   2.727  -6.048

  No H/Q in entry =           9
  In of MODEL   59
    1    H    VAL  54           H        VAL  54 -28.768   4.503  -5.624
    2    HA   VAL  54           HA       VAL  54 -25.959   3.771  -6.164
    3    HB   VAL  54           HB       VAL  54 -27.156   5.540  -3.973
    4   HG11  VAL  54          HG11      VAL  54 -24.509   4.236  -4.185
    5   HG13  VAL  54          HG12      VAL  54 -25.322   4.908  -2.772
    6   HG12  VAL  54          HG13      VAL  54 -24.442   5.970  -3.870
    7   HG22  VAL  54          HG21      VAL  54 -26.357   7.371  -5.092
    8   HG21  VAL  54          HG22      VAL  54 -26.832   6.330  -6.435
    9   HG23  VAL  54          HG23      VAL  54 -25.137   6.442  -5.964

  No H/Q in entry =           9
  In of MODEL   59
    1    H    LEU  55           H        LEU  55 -25.293   1.891  -5.472
    2    HA   LEU  55           HA       LEU  55 -26.785   0.555  -3.300
    3    HB2  LEU  55           HB2      LEU  55 -25.131  -0.585  -5.540
    4    HB3  LEU  55           HB3      LEU  55 -25.874  -1.528  -4.247
    5    HG   LEU  55           HG       LEU  55 -27.338  -0.050  -6.424
    6   HD13  LEU  55          HD11      LEU  55 -26.930  -1.910  -7.599
    7   HD12  LEU  55          HD12      LEU  55 -27.870  -2.804  -6.406
    8   HD11  LEU  55          HD13      LEU  55 -26.122  -2.656  -6.222
    9   HD23  LEU  55          HD21      LEU  55 -28.581  -2.016  -4.555
   10   HD22  LEU  55          HD22      LEU  55 -29.319  -0.684  -5.444
   11   HD21  LEU  55          HD23      LEU  55 -28.341  -0.354  -4.014

  No H/Q in entry =          11
  In of MODEL   59
    1    H    LEU  56           H        LEU  56 -25.645   0.049  -1.460
    2    HA   LEU  56           HA       LEU  56 -22.731   0.578  -1.460
    3    HB2  LEU  56           HB2      LEU  56 -24.570   0.331   0.907
    4    HB3  LEU  56           HB3      LEU  56 -22.882   0.838   0.920
    5    HG   LEU  56           HG       LEU  56 -25.235   2.390  -0.123
    6   HD11  LEU  56          HD11      LEU  56 -24.155   2.109   2.426
    7   HD13  LEU  56          HD12      LEU  56 -25.196   3.422   1.873
    8   HD12  LEU  56          HD13      LEU  56 -23.444   3.604   1.818
    9   HD23  LEU  56          HD21      LEU  56 -23.365   4.172  -0.314
   10   HD22  LEU  56          HD22      LEU  56 -23.671   3.033  -1.625
   11   HD21  LEU  56          HD23      LEU  56 -22.325   2.763  -0.518

  No H/Q in entry =          11
  In of MODEL   59
    1    H    GLY  57           H        GLY  57 -21.290  -0.978  -0.867
    2    HA3  GLY  57           HA2      GLY  57 -22.084  -3.706  -1.026
    3    HA2  GLY  57           HA3      GLY  57 -20.497  -3.129  -0.522

  No H/Q in entry =           3
  In of MODEL   59
    1    HA   PRO  58           HA       PRO  58 -23.333  -4.222   3.149
    2    HB2  PRO  58           HB2      PRO  58 -22.544  -6.781   3.822
    3    HB3  PRO  58           HB3      PRO  58 -23.925  -6.455   2.774
    4    HG2  PRO  58           HG2      PRO  58 -21.144  -7.227   2.060
    5    HG3  PRO  58           HG3      PRO  58 -22.673  -7.771   1.367
    6    HD2  PRO  58           HD2      PRO  58 -21.123  -5.906   0.139
    7    HD3  PRO  58           HD3      PRO  58 -22.882  -5.902   0.001

  No H/Q in entry =           7
  In of MODEL   59
    1    H    GLN  59           H        GLN  59 -19.932  -4.554   2.618
    2    HA   GLN  59           HA       GLN  59 -19.233  -4.483   5.392
    3    HB2  GLN  59           HB2      GLN  59 -17.661  -3.668   2.945
    4    HB3  GLN  59           HB3      GLN  59 -17.009  -3.693   4.571
    5    HG2  GLN  59           HG2      GLN  59 -18.079  -6.078   3.072
    6    HG3  GLN  59           HG3      GLN  59 -16.381  -5.676   3.275
    7   HE21  GLN  59          HE21      GLN  59 -18.423  -7.578   4.242
    8   HE22  GLN  59          HE22      GLN  59 -18.188  -8.139   5.791

  No H/Q in entry =           8
  In of MODEL   59
    1    H    ILE  60           H        ILE  60 -20.235  -2.021   3.115
    2    HA   ILE  60           HA       ILE  60 -19.513   0.013   5.136
    3    HB   ILE  60           HB       ILE  60 -19.786   1.694   3.270
    4   HG12  ILE  60          HG12      ILE  60 -19.441  -0.552   1.330
    5   HG13  ILE  60          HG13      ILE  60 -21.064  -0.095   1.846
    6   HG22  ILE  60          HG21      ILE  60 -17.663  -0.381   2.837
    7   HG21  ILE  60          HG22      ILE  60 -17.613   0.912   4.035
    8   HG23  ILE  60          HG23      ILE  60 -17.615   1.304   2.316
    9   HD13  ILE  60          HD11      ILE  60 -20.788   1.185  -0.076
   10   HD12  ILE  60          HD12      ILE  60 -19.078   1.475   0.240
   11   HD11  ILE  60          HD13      ILE  60 -20.305   2.321   1.184

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ALA  61           H        ALA  61 -21.896  -1.680   5.190
    2    HA   ALA  61           HA       ALA  61 -24.185  -0.126   4.653
    3    HB1  ALA  61           HB1      ALA  61 -25.359  -1.643   5.985
    4    HB2  ALA  61           HB2      ALA  61 -23.966  -1.949   7.023
    5    HB3  ALA  61           HB3      ALA  61 -24.001  -2.591   5.381

  No H/Q in entry =           5
  In of MODEL   59
    1    H    TYR  62           H        TYR  62 -22.031  -0.084   7.496
    2    HA   TYR  62           HA       TYR  62 -23.693   1.535   9.100
    3    HB2  TYR  62           HB2      TYR  62 -21.711   2.059  10.375
    4    HB3  TYR  62           HB3      TYR  62 -21.658   0.358   9.917
    5    HD1  TYR  62           HD1      TYR  62 -19.995  -0.453   8.290
    6    HD2  TYR  62           HD2      TYR  62 -20.062   3.646   9.494
    7    HE1  TYR  62           HE1      TYR  62 -17.773  -0.122   7.273
    8    HE2  TYR  62           HE2      TYR  62 -17.827   3.973   8.479
    9    HH   TYR  62           HH       TYR  62 -16.238   3.055   7.282

  No H/Q in entry =           9
  In of MODEL   59
    1    H    MET  63           H        MET  63 -22.032   2.409   6.260
    2    HA   MET  63           HA       MET  63 -22.005   5.259   6.899
    3    HB2  MET  63           HB2      MET  63 -21.280   3.718   4.406
    4    HB3  MET  63           HB3      MET  63 -21.166   5.471   4.558
    5    HG2  MET  63           HG2      MET  63 -19.472   5.235   6.268
    6    HG3  MET  63           HG3      MET  63 -19.612   3.480   6.187
    7    HE1  MET  63           HE1      MET  63 -19.195   6.610   4.440
    8    HE3  MET  63           HE2      MET  63 -19.105   6.096   2.756
    9    HE2  MET  63           HE3      MET  63 -17.625   6.444   3.651

  No H/Q in entry =           9
  In of MODEL   59
    1    H    LEU  64           H        LEU  64 -24.464   3.275   5.923
    2    HA   LEU  64           HA       LEU  64 -25.693   4.596   3.793
    3    HB2  LEU  64           HB2      LEU  64 -26.487   2.474   4.737
    4    HB3  LEU  64           HB3      LEU  64 -27.010   3.324   6.190
    5    HG   LEU  64           HG       LEU  64 -28.733   4.478   4.903
    6   HD13  LEU  64          HD11      LEU  64 -28.415   4.687   2.672
    7   HD12  LEU  64          HD12      LEU  64 -28.987   3.022   2.548
    8   HD11  LEU  64          HD13      LEU  64 -27.257   3.359   2.635
    9   HD23  LEU  64          HD21      LEU  64 -29.113   1.631   4.204
   10   HD22  LEU  64          HD22      LEU  64 -30.168   2.738   5.082
   11   HD21  LEU  64          HD23      LEU  64 -28.776   2.021   5.890

  No H/Q in entry =          11
  In of MODEL   59
    1    HA   PRO  65           HA       PRO  65 -28.062   7.706   6.435
    2    HB2  PRO  65           HB2      PRO  65 -26.117   7.996   8.724
    3    HB3  PRO  65           HB3      PRO  65 -27.866   8.202   8.731
    4    HG2  PRO  65           HG2      PRO  65 -26.859   6.009   9.722
    5    HG3  PRO  65           HG3      PRO  65 -28.255   5.894   8.650
    6    HD2  PRO  65           HD2      PRO  65 -25.346   5.390   8.015
    7    HD3  PRO  65           HD3      PRO  65 -26.755   4.433   7.558

  No H/Q in entry =           7
  In of MODEL   59
    1    H    GLU  66           H        GLU  66 -24.509   7.806   6.578
    2    HA   GLU  66           HA       GLU  66 -24.324  10.606   6.121
    3    HB2  GLU  66           HB2      GLU  66 -22.401   8.367   5.552
    4    HB3  GLU  66           HB3      GLU  66 -22.020  10.072   5.319
    5    HG2  GLU  66           HG2      GLU  66 -22.295  10.480   7.673
    6    HG3  GLU  66           HG3      GLU  66 -22.753   8.796   7.929

  No H/Q in entry =           6
  In of MODEL   59
    1    H    ILE  67           H        ILE  67 -24.265   7.815   3.924
    2    HA   ILE  67           HA       ILE  67 -23.875   9.494   1.605
    3    HB   ILE  67           HB       ILE  67 -24.654   6.555   1.827
    4   HG12  ILE  67          HG12      ILE  67 -22.058   7.817   0.931
    5   HG13  ILE  67          HG13      ILE  67 -22.368   7.419   2.621
    6   HG21  ILE  67          HG21      ILE  67 -24.631   8.390  -0.434
    7   HG23  ILE  67          HG22      ILE  67 -25.187   6.718  -0.361
    8   HG22  ILE  67          HG23      ILE  67 -23.486   7.068  -0.663
    9   HD12  ILE  67          HD11      ILE  67 -21.827   5.620   0.316
   10   HD11  ILE  67          HD12      ILE  67 -22.843   5.032   1.630
   11   HD13  ILE  67          HD13      ILE  67 -21.197   5.573   1.963

  No H/Q in entry =          11
  In of MODEL   59
    1    H    GLN  68           H        GLN  68 -26.730   8.352   3.204
    2    HA   GLN  68           HA       GLN  68 -28.557   9.167   1.178
    3    HB2  GLN  68           HB2      GLN  68 -28.857   8.858   4.162
    4    HB3  GLN  68           HB3      GLN  68 -30.180   9.377   3.132
    5    HG2  GLN  68           HG2      GLN  68 -30.100   7.323   1.898
    6    HG3  GLN  68           HG3      GLN  68 -28.644   6.823   2.739
    7   HE21  GLN  68          HE21      GLN  68 -30.762   5.374   2.590
    8   HE22  GLN  68          HE22      GLN  68 -31.599   4.912   3.998

  No H/Q in entry =           8
  In of MODEL   59
    1    H    ARG  69           H        ARG  69 -27.076  10.951   3.910
    2    HA   ARG  69           HA       ARG  69 -28.530  13.367   3.428
    3    HB2  ARG  69           HB2      ARG  69 -26.182  12.565   5.080
    4    HB3  ARG  69           HB3      ARG  69 -26.323  14.273   4.684
    5    HG2  ARG  69           HG2      ARG  69 -28.659  14.241   5.610
    6    HG3  ARG  69           HG3      ARG  69 -28.392  12.570   6.123
    7    HD2  ARG  69           HD2      ARG  69 -26.813  15.009   7.020
    8    HD3  ARG  69           HD3      ARG  69 -27.925  14.078   8.012
    9    HE   ARG  69           HE       ARG  69 -25.259  13.234   7.130
   10   HH21  ARG  69          HH11      ARG  69 -24.404  11.529   8.377
   11   HH22  ARG  69          HH12      ARG  69 -25.421  10.695   9.503
   12   HH11  ARG  69          HH21      ARG  69 -28.225  12.602   8.783
   13   HH12  ARG  69          HH22      ARG  69 -27.584  11.300   9.730

  No H/Q in entry =          13
  In of MODEL   59
    1    H    LEU  70           H        LEU  70 -25.579  12.052   2.151
    2    HA   LEU  70           HA       LEU  70 -24.538  14.436   0.957
    3    HB2  LEU  70           HB2      LEU  70 -23.465  12.172   1.617
    4    HB3  LEU  70           HB3      LEU  70 -24.029  11.651   0.030
    5    HG   LEU  70           HG       LEU  70 -22.471  13.065  -1.052
    6   HD11  LEU  70          HD11      LEU  70 -21.737  13.994   1.732
    7   HD13  LEU  70          HD12      LEU  70 -22.448  14.975   0.451
    8   HD12  LEU  70          HD13      LEU  70 -20.807  14.355   0.275
    9   HD22  LEU  70          HD21      LEU  70 -20.975  11.412  -0.759
   10   HD21  LEU  70          HD22      LEU  70 -21.908  10.881   0.642
   11   HD23  LEU  70          HD23      LEU  70 -20.571  12.011   0.849

  No H/Q in entry =          11
  In of MODEL   59
    1    H    LEU  71           H        LEU  71 -26.568  11.789  -0.147
    2    HA   LEU  71           HA       LEU  71 -27.102  13.205  -2.703
    3    HB2  LEU  71           HB2      LEU  71 -27.200  10.223  -2.200
    4    HB3  LEU  71           HB3      LEU  71 -27.332  11.049  -3.752
    5    HG   LEU  71           HG       LEU  71 -24.847  11.192  -2.045
    6   HD12  LEU  71          HD11      LEU  71 -24.790   9.516  -4.444
    7   HD11  LEU  71          HD12      LEU  71 -25.801   8.879  -3.148
    8   HD13  LEU  71          HD13      LEU  71 -24.099   9.231  -2.847
    9   HD22  LEU  71          HD21      LEU  71 -24.990  12.973  -3.577
   10   HD21  LEU  71          HD22      LEU  71 -25.421  11.886  -4.897
   11   HD23  LEU  71          HD23      LEU  71 -23.809  11.816  -4.186

  No H/Q in entry =          11
  In of MODEL   59
    1    HA   PRO  72           HA       PRO  72 -30.998  12.659  -0.145
    2    HB2  PRO  72           HB2      PRO  72 -31.949  15.184  -0.295
    3    HB3  PRO  72           HB3      PRO  72 -30.646  14.803   0.830
    4    HG2  PRO  72           HG2      PRO  72 -30.451  15.950  -1.944
    5    HG3  PRO  72           HG3      PRO  72 -29.734  16.559  -0.452
    6    HD2  PRO  72           HD2      PRO  72 -28.306  15.018  -2.161
    7    HD3  PRO  72           HD3      PRO  72 -28.078  14.894  -0.417

  No H/Q in entry =           7
  In of MODEL   59
    1    H    ASN  73           H        ASN  73 -30.348  13.574  -3.367
    2    HA   ASN  73           HA       ASN  73 -33.182  13.147  -4.046
    3    HB2  ASN  73           HB2      ASN  73 -32.717  14.229  -6.155
    4    HB3  ASN  73           HB3      ASN  73 -32.257  15.254  -4.805
    5   HD21  ASN  73          HD21      ASN  73 -31.412  15.276  -7.467
    6   HD22  ASN  73          HD22      ASN  73 -29.736  15.173  -7.625

  No H/Q in entry =           6
  In of MODEL   59
    1    H    LYS  74           H        LYS  74 -31.130  10.975  -3.538
    2    HA   LYS  74           HA       LYS  74 -31.597   9.511  -6.068
    3    HB2  LYS  74           HB2      LYS  74 -29.087   9.342  -4.394
    4    HB3  LYS  74           HB3      LYS  74 -29.412   8.487  -5.902
    5    HG2  LYS  74           HG2      LYS  74 -29.257  11.468  -5.755
    6    HG3  LYS  74           HG3      LYS  74 -27.841  10.451  -6.012
    7    HD2  LYS  74           HD2      LYS  74 -28.886   9.444  -7.957
    8    HD3  LYS  74           HD3      LYS  74 -30.346  10.397  -7.684
    9    HE2  LYS  74           HE2      LYS  74 -29.184  12.436  -8.143
   10    HE3  LYS  74           HE3      LYS  74 -27.632  11.600  -8.189
   11    HZ2  LYS  74           HZ1      LYS  74 -29.081  12.108 -10.352
   12    HZ1  LYS  74           HZ2      LYS  74 -29.689  10.571  -9.962
   13    HZ3  LYS  74           HZ3      LYS  74 -28.025  10.785 -10.230

  No H/Q in entry =          13
  In of MODEL   59
    1    HA   PRO  75           HA       PRO  75 -32.942   6.537  -3.063
    2    HB2  PRO  75           HB2      PRO  75 -33.142   4.278  -4.606
    3    HB3  PRO  75           HB3      PRO  75 -34.314   5.590  -4.724
    4    HG2  PRO  75           HG2      PRO  75 -31.923   5.042  -6.437
    5    HG3  PRO  75           HG3      PRO  75 -33.576   5.411  -6.925
    6    HD2  PRO  75           HD2      PRO  75 -31.703   7.345  -6.883
    7    HD3  PRO  75           HD3      PRO  75 -33.358   7.696  -6.384

  No H/Q in entry =           7
  In of MODEL   59
    1    H    VAL  76           H        VAL  76 -31.479   5.560  -1.642
    2    HA   VAL  76           HA       VAL  76 -28.953   4.418  -2.678
    3    HB   VAL  76           HB       VAL  76 -29.344   5.925  -0.056
    4   HG11  VAL  76          HG11      VAL  76 -26.917   4.695  -1.377
    5   HG13  VAL  76          HG12      VAL  76 -27.627   4.251   0.176
    6   HG12  VAL  76          HG13      VAL  76 -26.833   5.813  -0.015
    7   HG22  VAL  76          HG21      VAL  76 -28.725   7.831  -0.970
    8   HG21  VAL  76          HG22      VAL  76 -29.213   7.086  -2.493
    9   HG23  VAL  76          HG23      VAL  76 -27.518   7.067  -2.004

  No H/Q in entry =           9
  In of MODEL   59
    1    H    GLU  77           H        GLU  77 -28.673   2.285  -2.017
    2    HA   GLU  77           HA       GLU  77 -29.483   1.523   0.637
    3    HB2  GLU  77           HB2      GLU  77 -31.020  -0.190   0.110
    4    HB3  GLU  77           HB3      GLU  77 -31.608   1.298  -0.633
    5    HG2  GLU  77           HG2      GLU  77 -30.931   0.519  -2.793
    6    HG3  GLU  77           HG3      GLU  77 -30.250  -0.940  -2.077

  No H/Q in entry =           6
  In of MODEL   59
    1    H    VAL  78           H        VAL  78 -29.095  -0.538   1.346
    2    HA   VAL  78           HA       VAL  78 -26.387  -1.231   0.525
    3    HB   VAL  78           HB       VAL  78 -28.109  -2.127   2.875
    4   HG11  VAL  78          HG11      VAL  78 -25.706  -3.294   1.821
    5   HG13  VAL  78          HG12      VAL  78 -26.625  -3.769   3.250
    6   HG12  VAL  78          HG13      VAL  78 -25.350  -2.559   3.382
    7   HG22  VAL  78          HG21      VAL  78 -26.726  -0.688   4.212
    8   HG21  VAL  78          HG22      VAL  78 -27.471   0.230   2.904
    9   HG23  VAL  78          HG23      VAL  78 -25.773  -0.240   2.797

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ILE  79           H        ILE  79 -25.765  -3.136  -0.330
    2    HA   ILE  79           HA       ILE  79 -27.746  -4.713  -1.686
    3    HB   ILE  79           HB       ILE  79 -24.742  -5.128  -1.397
    4   HG12  ILE  79          HG12      ILE  79 -26.372  -4.130  -3.739
    5   HG13  ILE  79          HG13      ILE  79 -25.557  -3.066  -2.591
    6   HG22  ILE  79          HG21      ILE  79 -25.756  -6.393  -3.712
    7   HG21  ILE  79          HG22      ILE  79 -26.748  -6.921  -2.354
    8   HG23  ILE  79          HG23      ILE  79 -24.999  -7.138  -2.304
    9   HD13  ILE  79          HD11      ILE  79 -24.104  -3.165  -4.379
   10   HD12  ILE  79          HD12      ILE  79 -24.377  -4.889  -4.631
   11   HD11  ILE  79          HD13      ILE  79 -23.439  -4.339  -3.242

  No H/Q in entry =          11
  In of MODEL   59
    1    H    ASP  80           H        ASP  80 -28.552  -6.655  -1.080
    2    HA   ASP  80           HA       ASP  80 -28.520  -7.498   1.585
    3    HB2  ASP  80           HB2      ASP  80 -30.220  -8.169  -0.075
    4    HB3  ASP  80           HB3      ASP  80 -29.009  -9.152  -0.901

  No H/Q in entry =           4
  In of MODEL   59
    1    H    SER  81           H        SER  81 -26.968  -8.554   2.768
    2    HA   SER  81           HA       SER  81 -24.426  -9.171   1.638
    3    HB2  SER  81           HB2      SER  81 -23.882 -10.137   3.840
    4    HB3  SER  81           HB3      SER  81 -24.640  -8.554   4.005
    5    HG   SER  81           HG       SER  81 -26.495  -9.495   4.639

  No H/Q in entry =           5
  In of MODEL   59
    1    H    LEU  82           H        LEU  82 -27.066 -11.351   1.952
    2    HA   LEU  82           HA       LEU  82 -25.426 -13.672   1.511
    3    HB2  LEU  82           HB2      LEU  82 -28.366 -13.303   0.995
    4    HB3  LEU  82           HB3      LEU  82 -27.508 -14.827   1.220
    5    HG   LEU  82           HG       LEU  82 -27.967 -12.746   3.337
    6   HD11  LEU  82          HD11      LEU  82 -29.926 -14.203   2.424
    7   HD13  LEU  82          HD12      LEU  82 -29.667 -14.124   4.168
    8   HD12  LEU  82          HD13      LEU  82 -29.106 -15.526   3.255
    9   HD22  LEU  82          HD21      LEU  82 -25.913 -13.866   3.753
   10   HD21  LEU  82          HD22      LEU  82 -26.580 -15.420   3.253
   11   HD23  LEU  82          HD23      LEU  82 -27.114 -14.677   4.761

  No H/Q in entry =          11
  In of MODEL   59
    1    H    LEU  83           H        LEU  83 -27.423 -11.557  -0.491
    2    HA   LEU  83           HA       LEU  83 -27.125 -12.958  -2.929
    3    HB2  LEU  83           HB2      LEU  83 -27.650 -10.055  -2.351
    4    HB3  LEU  83           HB3      LEU  83 -27.627 -10.733  -3.977
    5    HG   LEU  83           HG       LEU  83 -29.688 -11.148  -1.832
    6   HD13  LEU  83          HD11      LEU  83 -30.488  -9.351  -2.950
    7   HD12  LEU  83          HD12      LEU  83 -30.885 -10.507  -4.219
    8   HD11  LEU  83          HD13      LEU  83 -29.382  -9.588  -4.301
    9   HD23  LEU  83          HD21      LEU  83 -29.729 -12.466  -4.532
   10   HD22  LEU  83          HD22      LEU  83 -30.713 -12.821  -3.114
   11   HD21  LEU  83          HD23      LEU  83 -29.007 -13.265  -3.136

  No H/Q in entry =          11
  In of MODEL   59
    1    H    TYR  84           H        TYR  84 -25.290 -10.471  -1.267
    2    HA   TYR  84           HA       TYR  84 -23.405  -9.961  -3.371
    3    HB2  TYR  84           HB2      TYR  84 -23.977  -8.408  -1.461
    4    HB3  TYR  84           HB3      TYR  84 -23.066  -9.486  -0.407
    5    HD1  TYR  84           HD1      TYR  84 -20.594  -9.878  -0.949
    6    HD2  TYR  84           HD2      TYR  84 -22.879  -6.705  -2.664
    7    HE1  TYR  84           HE1      TYR  84 -18.500  -8.710  -1.550
    8    HE2  TYR  84           HE2      TYR  84 -20.794  -5.532  -3.281
    9    HH   TYR  84           HH       TYR  84 -18.541  -5.480  -2.920

  No H/Q in entry =           9
  In of MODEL   59
    1    H    GLY  85           H        GLY  85 -23.153 -11.893  -0.379
    2    HA3  GLY  85           HA2      GLY  85 -20.534 -12.754  -0.792
    3    HA2  GLY  85           HA3      GLY  85 -21.753 -13.623   0.139

  No H/Q in entry =           3
  In of MODEL   59
    1    H    LYS  86           H        LYS  86 -23.544 -14.104  -1.947
    2    HA   LYS  86           HA       LYS  86 -22.383 -16.465  -3.136
    3    HB2  LYS  86           HB2      LYS  86 -24.676 -16.286  -2.195
    4    HB3  LYS  86           HB3      LYS  86 -25.079 -15.152  -3.482
    5    HG2  LYS  86           HG2      LYS  86 -24.750 -16.916  -5.123
    6    HG3  LYS  86           HG3      LYS  86 -24.391 -18.046  -3.816
    7    HD2  LYS  86           HD2      LYS  86 -26.915 -16.403  -3.896
    8    HD3  LYS  86           HD3      LYS  86 -26.805 -18.000  -4.633
    9    HE2  LYS  86           HE2      LYS  86 -25.937 -18.755  -2.320
   10    HE3  LYS  86           HE3      LYS  86 -26.634 -17.242  -1.742
   11    HZ1  LYS  86           HZ1      LYS  86 -28.731 -17.946  -2.905
   12    HZ3  LYS  86           HZ2      LYS  86 -28.309 -18.871  -1.542
   13    HZ2  LYS  86           HZ3      LYS  86 -28.026 -19.480  -3.101

  No H/Q in entry =          13
  In of MODEL   59
    1    H    VAL  87           H        VAL  87 -22.467 -13.271  -4.097
    2    HA   VAL  87           HA       VAL  87 -22.172 -12.129  -6.057
    3    HB   VAL  87           HB       VAL  87 -21.002 -14.602  -7.348
    4   HG13  VAL  87          HG11      VAL  87 -19.694 -13.076  -8.546
    5   HG12  VAL  87          HG12      VAL  87 -19.836 -11.831  -7.303
    6   HG11  VAL  87          HG13      VAL  87 -21.206 -12.189  -8.355
    7   HG23  VAL  87          HG21      VAL  87 -18.813 -13.889  -6.218
    8   HG22  VAL  87          HG22      VAL  87 -19.964 -14.837  -5.279
    9   HG21  VAL  87          HG23      VAL  87 -19.846 -13.096  -5.031

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ASP  88           H        ASP  88 -24.670 -12.853  -5.740
    2    HA   ASP  88           HA       ASP  88 -25.700 -14.158  -8.131
    3    HB2  ASP  88           HB2      ASP  88 -26.732 -14.390  -5.821
    4    HB3  ASP  88           HB3      ASP  88 -27.243 -12.708  -5.965

  No H/Q in entry =           4
  In of MODEL   59
    1    H    GLY  89           H        GLY  89 -25.010 -12.910  -9.785
    2    HA3  GLY  89           HA2      GLY  89 -25.287 -10.151 -10.049
    3    HA2  GLY  89           HA3      GLY  89 -25.196 -11.298 -11.384

  No H/Q in entry =           3
  In of MODEL   59
    1    H    LEU  90           H        LEU  90 -27.600 -12.728 -10.952
    2    HA   LEU  90           HA       LEU  90 -29.457 -10.884 -12.141
    3    HB2  LEU  90           HB2      LEU  90 -29.426 -13.291 -12.670
    4    HB3  LEU  90           HB3      LEU  90 -29.950 -13.642 -11.023
    5    HG   LEU  90           HG       LEU  90 -32.100 -12.610 -11.450
    6   HD13  LEU  90          HD11      LEU  90 -31.955 -10.895 -12.958
    7   HD12  LEU  90          HD12      LEU  90 -32.428 -12.175 -14.078
    8   HD11  LEU  90          HD13      LEU  90 -30.731 -11.715 -13.931
    9   HD23  LEU  90          HD21      LEU  90 -31.925 -14.287 -13.847
   10   HD22  LEU  90          HD22      LEU  90 -32.926 -14.457 -12.405
   11   HD21  LEU  90          HD23      LEU  90 -31.251 -15.009 -12.386

  No H/Q in entry =          11
  In of MODEL   59
    1    H    GLY  91           H        GLY  91 -29.297 -12.310  -8.922
    2    HA3  GLY  91           HA2      GLY  91 -31.694 -11.262  -7.950
    3    HA2  GLY  91           HA3      GLY  91 -30.302 -11.724  -6.971

  No H/Q in entry =           3
  In of MODEL   59
    1    H    VAL  92           H        VAL  92 -28.434  -9.847  -7.831
    2    HA   VAL  92           HA       VAL  92 -29.338  -7.544  -6.347
    3    HB   VAL  92           HB       VAL  92 -26.746  -7.954  -7.886
    4   HG12  VAL  92          HG11      VAL  92 -27.023  -6.027  -5.604
    5   HG11  VAL  92          HG12      VAL  92 -27.678  -5.541  -7.170
    6   HG13  VAL  92          HG13      VAL  92 -25.969  -5.944  -7.016
    7   HG22  VAL  92          HG21      VAL  92 -26.496  -9.498  -6.256
    8   HG21  VAL  92          HG22      VAL  92 -27.689  -8.738  -5.201
    9   HG23  VAL  92          HG23      VAL  92 -26.056  -8.079  -5.305

  No H/Q in entry =           9
  In of MODEL   59
    1    H    LEU  93           H        LEU  93 -28.842  -8.262  -9.745
    2    HA   LEU  93           HA       LEU  93 -29.265  -5.662 -10.737
    3    HB2  LEU  93           HB2      LEU  93 -28.529  -7.522 -12.146
    4    HB3  LEU  93           HB3      LEU  93 -30.097  -8.302 -11.936
    5    HG   LEU  93           HG       LEU  93 -31.157  -6.402 -13.122
    6   HD11  LEU  93          HD11      LEU  93 -29.375  -4.729 -12.619
    7   HD13  LEU  93          HD12      LEU  93 -29.781  -4.812 -14.334
    8   HD12  LEU  93          HD13      LEU  93 -28.311  -5.580 -13.739
    9   HD23  LEU  93          HD21      LEU  93 -30.055  -6.979 -15.377
   10   HD22  LEU  93          HD22      LEU  93 -30.868  -8.246 -14.459
   11   HD21  LEU  93          HD23      LEU  93 -29.108  -8.126 -14.430

  No H/Q in entry =          11
  In of MODEL   59
    1    H    LYS  94           H        LYS  94 -31.562  -8.275  -9.876
    2    HA   LYS  94           HA       LYS  94 -33.945  -6.933 -10.575
    3    HB2  LYS  94           HB2      LYS  94 -33.390  -9.055  -8.507
    4    HB3  LYS  94           HB3      LYS  94 -35.006  -8.424  -8.818
    5    HG2  LYS  94           HG2      LYS  94 -34.847  -9.245 -11.133
    6    HG3  LYS  94           HG3      LYS  94 -33.267  -9.931 -10.760
    7    HD2  LYS  94           HD2      LYS  94 -34.373 -11.267  -8.928
    8    HD3  LYS  94           HD3      LYS  94 -35.927 -10.688  -9.525
    9    HE2  LYS  94           HE2      LYS  94 -35.336 -11.646 -11.760
   10    HE3  LYS  94           HE3      LYS  94 -33.907 -12.361 -11.015
   11    HZ3  LYS  94           HZ1      LYS  94 -35.697 -13.952 -11.185
   12    HZ2  LYS  94           HZ2      LYS  94 -36.725 -12.943 -10.284
   13    HZ1  LYS  94           HZ3      LYS  94 -35.352 -13.626  -9.555

  No H/Q in entry =          13
  In of MODEL   59
    1    H    ALA  95           H        ALA  95 -32.176  -6.923  -7.491
    2    HA   ALA  95           HA       ALA  95 -34.109  -5.381  -6.081
    3    HB2  ALA  95           HB1      ALA  95 -31.695  -6.656  -5.471
    4    HB3  ALA  95           HB2      ALA  95 -32.727  -5.764  -4.355
    5    HB1  ALA  95           HB3      ALA  95 -31.394  -4.945  -5.169

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ALA  96           H        ALA  96 -31.460  -4.475  -8.147
    2    HA   ALA  96           HA       ALA  96 -31.478  -1.697  -7.432
    3    HB2  ALA  96           HB1      ALA  96 -30.085  -1.465  -9.520
    4    HB3  ALA  96           HB2      ALA  96 -30.322  -3.189  -9.809
    5    HB1  ALA  96           HB3      ALA  96 -29.452  -2.646  -8.374

  No H/Q in entry =           5
  In of MODEL   59
    1    H    VAL  97           H        VAL  97 -32.896  -3.521 -10.107
    2    HA   VAL  97           HA       VAL  97 -34.024  -1.288 -11.432
    3    HB   VAL  97           HB       VAL  97 -34.729  -4.241 -11.426
    4   HG11  VAL  97          HG11      VAL  97 -36.582  -2.311 -11.987
    5   HG13  VAL  97          HG12      VAL  97 -36.570  -3.920 -12.710
    6   HG12  VAL  97          HG13      VAL  97 -35.849  -2.562 -13.572
    7   HG21  VAL  97          HG21      VAL  97 -33.477  -2.411 -13.476
    8   HG23  VAL  97          HG22      VAL  97 -33.865  -4.112 -13.737
    9   HG22  VAL  97          HG23      VAL  97 -32.653  -3.657 -12.538

  No H/Q in entry =           9
  In of MODEL   59
    1    H    ALA  98           H        ALA  98 -35.177  -3.455  -8.870
    2    HA   ALA  98           HA       ALA  98 -37.783  -2.390  -8.590
    3    HB1  ALA  98           HB1      ALA  98 -36.713  -4.530  -7.492
    4    HB3  ALA  98           HB2      ALA  98 -37.942  -3.629  -6.602
    5    HB2  ALA  98           HB3      ALA  98 -36.235  -3.412  -6.216

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ALA  99           H        ALA  99 -34.764  -1.450  -6.906
    2    HA   ALA  99           HA       ALA  99 -35.992   0.527  -5.307
    3    HB1  ALA  99           HB1      ALA  99 -33.301  -0.286  -5.988
    4    HB2  ALA  99           HB2      ALA  99 -33.904   0.475  -4.515
    5    HB3  ALA  99           HB3      ALA  99 -33.437   1.470  -5.894

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ILE 100           H        ILE 100 -34.894   0.625  -8.645
    2    HA   ILE 100           HA       ILE 100 -35.164   3.460  -8.926
    3    HB   ILE 100           HB       ILE 100 -35.148   1.261 -11.022
    4   HG12  ILE 100          HG12      ILE 100 -33.065   3.339 -10.353
    5   HG13  ILE 100          HG13      ILE 100 -33.057   1.705  -9.690
    6   HG21  ILE 100          HG21      ILE 100 -35.665   4.161 -11.221
    7   HG23  ILE 100          HG22      ILE 100 -36.108   2.854 -12.319
    8   HG22  ILE 100          HG23      ILE 100 -34.477   3.524 -12.357
    9   HD12  ILE 100          HD11      ILE 100 -32.507   2.623 -12.473
   10   HD11  ILE 100          HD12      ILE 100 -33.117   0.992 -12.196
   11   HD13  ILE 100          HD13      ILE 100 -31.600   1.502 -11.459

  No H/Q in entry =          11
  In of MODEL   59
    1    H    LYS 101           H        LYS 101 -37.355   0.761  -9.639
    2    HA   LYS 101           HA       LYS 101 -39.472   2.318 -10.710
    3    HB2  LYS 101           HB2      LYS 101 -39.284  -0.428  -9.524
    4    HB3  LYS 101           HB3      LYS 101 -40.854   0.275  -9.913
    5    HG2  LYS 101           HG2      LYS 101 -40.342   0.379 -12.203
    6    HG3  LYS 101           HG3      LYS 101 -38.638   0.037 -11.910
    7    HD2  LYS 101           HD2      LYS 101 -39.808  -1.930 -12.779
    8    HD3  LYS 101           HD3      LYS 101 -39.200  -2.207 -11.146
    9    HE2  LYS 101           HE2      LYS 101 -41.247  -2.961 -10.662
   10    HE3  LYS 101           HE3      LYS 101 -41.761  -1.274 -10.709
   11    HZ3  LYS 101           HZ1      LYS 101 -42.607  -1.503 -12.839
   12    HZ2  LYS 101           HZ2      LYS 101 -43.032  -2.977 -12.109
   13    HZ1  LYS 101           HZ3      LYS 101 -41.707  -2.905 -13.170

  No H/Q in entry =          13
  In of MODEL   59
    1    H    LYS 102           H        LYS 102 -38.991   0.923  -7.463
    2    HA   LYS 102           HA       LYS 102 -41.299   2.064  -6.331
    3    HB2  LYS 102           HB2      LYS 102 -40.020   0.261  -5.256
    4    HB3  LYS 102           HB3      LYS 102 -38.671   1.368  -5.009
    5    HG2  LYS 102           HG2      LYS 102 -40.060   2.747  -3.565
    6    HG3  LYS 102           HG3      LYS 102 -41.414   1.644  -3.814
    7    HD2  LYS 102           HD2      LYS 102 -40.146  -0.159  -2.729
    8    HD3  LYS 102           HD3      LYS 102 -38.793   0.946  -2.477
    9    HE2  LYS 102           HE2      LYS 102 -40.222   2.404  -1.124
   10    HE3  LYS 102           HE3      LYS 102 -41.593   1.330  -1.396
   11    HZ1  LYS 102           HZ1      LYS 102 -39.834  -0.346  -0.327
   12    HZ3  LYS 102           HZ2      LYS 102 -40.991   0.520   0.565
   13    HZ2  LYS 102           HZ3      LYS 102 -39.397   1.096   0.457

  No H/Q in entry =          13
  In of MODEL   59
    1    H    ALA 103           H        ALA 103 -38.374   3.535  -7.318
    2    HA   ALA 103           HA       ALA 103 -38.708   5.875  -5.588
    3    HB2  ALA 103           HB1      ALA 103 -36.713   6.645  -7.142
    4    HB3  ALA 103           HB2      ALA 103 -36.613   4.922  -7.504
    5    HB1  ALA 103           HB3      ALA 103 -36.435   5.485  -5.843

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ALA 104           H        ALA 104 -39.240   5.058  -8.929
    2    HA   ALA 104           HA       ALA 104 -39.906   7.809  -9.618
    3    HB2  ALA 104           HB1      ALA 104 -39.886   7.097 -11.807
    4    HB1  ALA 104           HB2      ALA 104 -40.568   5.520 -11.411
    5    HB3  ALA 104           HB3      ALA 104 -38.860   5.846 -11.105

  No H/Q in entry =           5
  In of MODEL   59
    1    H    ALA 105           H        ALA 105 -41.478   5.687  -7.801
    2    HA   ALA 105           HA       ALA 105 -43.948   6.998  -7.846
    3    HB2  ALA 105           HB1      ALA 105 -44.625   6.074  -9.881
    4    HB3  ALA 105           HB2      ALA 105 -45.242   4.887  -8.732
    5    HB1  ALA 105           HB3      ALA 105 -43.745   4.570  -9.607

  No H/Q in entry =           5
  In of MODEL   60
    1    H1   ALA   1           H3       ALA   1 -12.189 -15.883  -2.202
    2    H2   ALA   1           H2       ALA   1 -11.250 -17.015  -3.059
    3    H3   ALA   1           H1       ALA   1 -12.412 -16.076  -3.874
    4    HA   ALA   1           HA       ALA   1 -13.794 -17.788  -3.623
    5    HB3  ALA   1           HB1      ALA   1 -12.379 -19.550  -3.186
    6    HB1  ALA   1           HB2      ALA   1 -13.115 -19.450  -1.587
    7    HB2  ALA   1           HB3      ALA   1 -11.549 -18.696  -1.885

  No H/Q in entry =           7
  In of MODEL   60
    1    H    GLU   2           H        GLU   2 -15.389 -18.661  -1.951
    2    HA   GLU   2           HA       GLU   2 -17.036 -16.957  -0.865
    3    HB2  GLU   2           HB2      GLU   2 -16.059 -19.381   0.658
    4    HB3  GLU   2           HB3      GLU   2 -17.586 -18.544   0.935
    5    HG2  GLU   2           HG2      GLU   2 -18.579 -19.631  -0.791
    6    HG3  GLU   2           HG3      GLU   2 -17.273 -19.216  -1.891

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLU   3           H        GLU   3 -15.080 -18.306   1.728
    2    HA   GLU   3           HA       GLU   3 -15.299 -15.960   3.297
    3    HB2  GLU   3           HB2      GLU   3 -13.691 -18.495   3.518
    4    HB3  GLU   3           HB3      GLU   3 -13.455 -17.178   4.667
    5    HG2  GLU   3           HG2      GLU   3 -15.637 -17.350   5.512
    6    HG3  GLU   3           HG3      GLU   3 -16.244 -18.149   4.068

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LEU   4           H        LEU   4 -12.352 -17.411   1.863
    2    HA   LEU   4           HA       LEU   4 -10.524 -15.496   2.445
    3    HB2  LEU   4           HB2      LEU   4 -10.780 -16.785  -0.282
    4    HB3  LEU   4           HB3      LEU   4  -9.325 -16.056   0.387
    5    HG   LEU   4           HG       LEU   4 -10.786 -18.468   1.510
    6   HD13  LEU   4          HD11      LEU   4  -9.156 -19.808   0.554
    7   HD12  LEU   4          HD12      LEU   4  -7.956 -18.516   0.517
    8   HD11  LEU   4          HD13      LEU   4  -9.260 -18.543  -0.669
    9   HD23  LEU   4          HD21      LEU   4  -8.517 -18.520   2.862
   10   HD22  LEU   4          HD22      LEU   4  -9.839 -17.493   3.412
   11   HD21  LEU   4          HD23      LEU   4  -8.493 -16.790   2.515

  No H/Q in entry =          11
  In of MODEL   60
    1    H    GLU   5           H        GLU   5 -12.895 -15.296  -0.199
    2    HA   GLU   5           HA       GLU   5 -11.923 -12.802  -1.202
    3    HB2  GLU   5           HB2      GLU   5 -13.271 -14.389  -2.557
    4    HB3  GLU   5           HB3      GLU   5 -14.661 -14.049  -1.525
    5    HG2  GLU   5           HG2      GLU   5 -14.566 -11.673  -2.149
    6    HG3  GLU   5           HG3      GLU   5 -13.157 -11.989  -3.161

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLU   6           H        GLU   6 -14.614 -13.708   0.921
    2    HA   GLU   6           HA       GLU   6 -15.534 -11.040   1.342
    3    HB2  GLU   6           HB2      GLU   6 -15.913 -13.594   2.919
    4    HB3  GLU   6           HB3      GLU   6 -16.710 -12.073   3.320
    5    HG2  GLU   6           HG2      GLU   6 -17.794 -12.016   1.139
    6    HG3  GLU   6           HG3      GLU   6 -16.922 -13.461   0.634

  No H/Q in entry =           6
  In of MODEL   60
    1    H    VAL   7           H        VAL   7 -13.191 -13.139   2.876
    2    HA   VAL   7           HA       VAL   7 -12.707 -11.569   5.203
    3    HB   VAL   7           HB       VAL   7 -11.007 -13.595   3.724
    4   HG11  VAL   7          HG11      VAL   7 -10.517 -12.068   6.288
    5   HG13  VAL   7          HG12      VAL   7  -9.433 -12.269   4.913
    6   HG12  VAL   7          HG13      VAL   7  -9.762 -13.632   5.982
    7   HG21  VAL   7          HG21      VAL   7 -13.237 -14.180   4.970
    8   HG23  VAL   7          HG22      VAL   7 -12.294 -13.905   6.435
    9   HG22  VAL   7          HG23      VAL   7 -11.806 -15.157   5.295

  No H/Q in entry =           9
  In of MODEL   60
    1    H    VAL   8           H        VAL   8 -11.235 -11.661   1.974
    2    HA   VAL   8           HA       VAL   8  -9.180  -9.774   2.448
    3    HB   VAL   8           HB       VAL   8 -10.652 -10.599  -0.055
    4   HG11  VAL   8          HG11      VAL   8  -8.535  -8.485   0.350
    5   HG13  VAL   8          HG12      VAL   8 -10.032  -8.379  -0.576
    6   HG12  VAL   8          HG13      VAL   8  -8.686  -9.341  -1.185
    7   HG23  VAL   8          HG21      VAL   8  -7.857 -11.094  -0.184
    8   HG22  VAL   8          HG22      VAL   8  -9.133 -12.286   0.043
    9   HG21  VAL   8          HG23      VAL   8  -8.347 -11.566   1.444

  No H/Q in entry =           9
  In of MODEL   60
    1    H    MET   9           H        MET   9 -12.543  -9.405   1.332
    2    HA   MET   9           HA       MET   9 -12.506  -6.627   0.907
    3    HB2  MET   9           HB2      MET   9 -14.670  -8.563   1.693
    4    HB3  MET   9           HB3      MET   9 -15.001  -6.830   1.619
    5    HG2  MET   9           HG2      MET   9 -13.965  -6.903  -0.731
    6    HG3  MET   9           HG3      MET   9 -14.113  -8.657  -0.615
    7    HE1  MET   9           HE1      MET   9 -15.950  -9.973  -0.577
    8    HE3  MET   9           HE2      MET   9 -17.650  -9.552  -0.768
    9    HE2  MET   9           HE3      MET   9 -16.873  -9.356   0.801

  No H/Q in entry =           9
  In of MODEL   60
    1    H    GLY  10           H        GLY  10 -13.118  -8.534   3.835
    2    HA3  GLY  10           HA2      GLY  10 -13.661  -6.360   5.569
    3    HA2  GLY  10           HA3      GLY  10 -13.078  -7.946   6.070

  No H/Q in entry =           3
  In of MODEL   60
    1    H    LEU  11           H        LEU  11 -10.648  -8.046   4.724
    2    HA   LEU  11           HA       LEU  11  -8.937  -6.606   6.464
    3    HB2  LEU  11           HB2      LEU  11  -8.412  -8.016   3.845
    4    HB3  LEU  11           HB3      LEU  11  -7.135  -7.305   4.830
    5    HG   LEU  11           HG       LEU  11  -9.108  -9.357   5.864
    6   HD13  LEU  11          HD11      LEU  11  -7.896 -10.579   4.280
    7   HD12  LEU  11          HD12      LEU  11  -6.941 -10.815   5.742
    8   HD11  LEU  11          HD13      LEU  11  -6.425  -9.641   4.532
    9   HD22  LEU  11          HD21      LEU  11  -8.239  -8.345   7.774
   10   HD21  LEU  11          HD22      LEU  11  -6.714  -7.928   6.993
   11   HD23  LEU  11          HD23      LEU  11  -7.020  -9.589   7.500

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  12           H        ILE  12  -9.886  -6.054   3.088
    2    HA   ILE  12           HA       ILE  12  -8.218  -3.808   2.649
    3    HB   ILE  12           HB       ILE  12 -10.881  -4.499   1.384
    4   HG12  ILE  12          HG12      ILE  12  -8.831  -6.129   1.275
    5   HG13  ILE  12          HG13      ILE  12  -9.712  -5.772  -0.196
    6   HG22  ILE  12          HG21      ILE  12 -10.032  -3.080  -0.502
    7   HG21  ILE  12          HG22      ILE  12  -8.684  -2.586   0.515
    8   HG23  ILE  12          HG23      ILE  12 -10.318  -2.189   0.960
    9   HD12  ILE  12          HD11      ILE  12  -7.211  -5.696  -0.431
   10   HD11  ILE  12          HD12      ILE  12  -7.197  -4.338   0.693
   11   HD13  ILE  12          HD13      ILE  12  -7.998  -4.187  -0.854

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  13           H        ILE  13 -11.562  -4.108   3.783
    2    HA   ILE  13           HA       ILE  13 -12.042  -1.326   4.069
    3    HB   ILE  13           HB       ILE  13 -13.208  -3.759   5.443
    4   HG12  ILE  13          HG12      ILE  13 -13.472  -3.263   2.916
    5   HG13  ILE  13          HG13      ILE  13 -14.902  -3.667   3.840
    6   HG22  ILE  13          HG21      ILE  13 -15.136  -2.009   5.892
    7   HG21  ILE  13          HG22      ILE  13 -13.829  -0.836   5.810
    8   HG23  ILE  13          HG23      ILE  13 -13.780  -2.126   7.010
    9   HD11  ILE  13          HD11      ILE  13 -14.210  -0.779   3.709
   10   HD13  ILE  13          HD12      ILE  13 -15.772  -1.575   3.684
   11   HD12  ILE  13          HD13      ILE  13 -14.807  -1.532   2.225

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ASN  14           H        ASN  14 -10.881  -3.815   6.320
    2    HA   ASN  14           HA       ASN  14 -10.667  -2.183   8.609
    3    HB2  ASN  14           HB2      ASN  14 -10.394  -4.787   8.275
    4    HB3  ASN  14           HB3      ASN  14  -8.691  -4.384   8.098
    5   HD21  ASN  14          HD21      ASN  14  -9.287  -5.922  10.276
    6   HD22  ASN  14          HD22      ASN  14  -9.250  -5.006  11.703

  No H/Q in entry =           6
  In of MODEL   60
    1    H    SER  15           H        SER  15  -8.288  -2.976   6.085
    2    HA   SER  15           HA       SER  15  -6.146  -1.467   7.136
    3    HB2  SER  15           HB2      SER  15  -5.150  -1.665   4.965
    4    HB3  SER  15           HB3      SER  15  -6.089  -3.135   5.196
    5    HG   SER  15           HG       SER  15  -7.449  -2.518   3.701

  No H/Q in entry =           5
  In of MODEL   60
    1    H    GLY  16           H        GLY  16  -8.783  -0.617   4.924
    2    HA3  GLY  16           HA2      GLY  16  -7.957   2.034   4.372
    3    HA2  GLY  16           HA3      GLY  16  -9.604   1.424   4.228

  No H/Q in entry =           3
  In of MODEL   60
    1    H    GLN  17           H        GLN  17 -10.107   0.684   6.882
    2    HA   GLN  17           HA       GLN  17 -10.824   3.178   8.040
    3    HB2  GLN  17           HB2      GLN  17 -10.686   0.389   9.202
    4    HB3  GLN  17           HB3      GLN  17 -11.305   1.779  10.096
    5    HG2  GLN  17           HG2      GLN  17 -13.017   2.154   8.389
    6    HG3  GLN  17           HG3      GLN  17 -12.368   0.834   7.418
    7   HE21  GLN  17          HE21      GLN  17 -15.077   1.167   8.826
    8   HE22  GLN  17          HE22      GLN  17 -15.229  -0.241   9.762

  No H/Q in entry =           8
  In of MODEL   60
    1    H    ALA  18           H        ALA  18  -8.165   0.921   8.619
    2    HA   ALA  18           HA       ALA  18  -7.052   2.140  10.880
    3    HB2  ALA  18           HB1      ALA  18  -6.437  -0.065   9.497
    4    HB3  ALA  18           HB2      ALA  18  -5.269   0.726  10.557
    5    HB1  ALA  18           HB3      ALA  18  -5.216   1.012   8.816

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ARG  19           H        ARG  19  -6.329   2.683   7.424
    2    HA   ARG  19           HA       ARG  19  -4.447   4.749   7.837
    3    HB2  ARG  19           HB2      ARG  19  -4.789   3.613   5.642
    4    HB3  ARG  19           HB3      ARG  19  -6.343   4.437   5.487
    5    HG2  ARG  19           HG2      ARG  19  -5.236   6.621   5.549
    6    HG3  ARG  19           HG3      ARG  19  -3.676   5.851   5.831
    7    HD2  ARG  19           HD2      ARG  19  -3.835   6.448   3.492
    8    HD3  ARG  19           HD3      ARG  19  -3.900   4.686   3.632
    9    HE   ARG  19           HE       ARG  19  -6.543   5.567   3.660
   10   HH21  ARG  19          HH11      ARG  19  -7.763   5.717   1.757
   11   HH22  ARG  19          HH12      ARG  19  -6.961   5.809   0.228
   12   HH11  ARG  19          HH21      ARG  19  -3.794   5.667   1.593
   13   HH12  ARG  19          HH22      ARG  19  -4.712   5.778   0.135

  No H/Q in entry =          13
  In of MODEL   60
    1    H    SER  20           H        SER  20  -7.953   4.828   7.280
    2    HA   SER  20           HA       SER  20  -8.341   7.580   7.245
    3    HB2  SER  20           HB2      SER  20 -10.211   6.222   6.727
    4    HB3  SER  20           HB3      SER  20 -10.072   5.322   8.235
    5    HG   SER  20           HG       SER  20 -10.289   7.912   8.801

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LEU  21           H        LEU  21  -8.283   5.388  10.042
    2    HA   LEU  21           HA       LEU  21  -8.722   7.372  12.019
    3    HB2  LEU  21           HB2      LEU  21  -7.458   4.638  12.081
    4    HB3  LEU  21           HB3      LEU  21  -7.505   5.657  13.516
    5    HG   LEU  21           HG       LEU  21  -9.961   4.923  11.893
    6   HD13  LEU  21          HD11      LEU  21 -10.449   3.272  13.610
    7   HD12  LEU  21          HD12      LEU  21  -9.005   3.731  14.512
    8   HD11  LEU  21          HD13      LEU  21  -8.850   2.940  12.942
    9   HD21  LEU  21          HD21      LEU  21  -9.446   6.495  14.397
   10   HD23  LEU  21          HD22      LEU  21 -10.922   5.537  14.328
   11   HD22  LEU  21          HD23      LEU  21 -10.634   6.789  13.131

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ALA  22           H        ALA  22  -5.771   6.038  10.571
    2    HA   ALA  22           HA       ALA  22  -3.887   7.367  12.175
    3    HB2  ALA  22           HB1      ALA  22  -3.470   5.524  10.473
    4    HB1  ALA  22           HB2      ALA  22  -2.289   6.834  10.498
    5    HB3  ALA  22           HB3      ALA  22  -3.522   6.780   9.236

  No H/Q in entry =           5
  In of MODEL   60
    1    H    TYR  23           H        TYR  23  -5.254   8.379   9.012
    2    HA   TYR  23           HA       TYR  23  -3.948  10.891   8.934
    3    HB2  TYR  23           HB2      TYR  23  -5.041   9.975   6.952
    4    HB3  TYR  23           HB3      TYR  23  -6.612  10.058   7.752
    5    HD1  TYR  23           HD1      TYR  23  -3.746  12.148   6.588
    6    HD2  TYR  23           HD2      TYR  23  -7.881  12.048   7.745
    7    HE1  TYR  23           HE1      TYR  23  -4.011  14.497   5.840
    8    HE2  TYR  23           HE2      TYR  23  -8.147  14.398   6.997
    9    HH   TYR  23           HH       TYR  23  -7.113  15.992   5.552

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ALA  24           H        ALA  24  -7.039   9.873  10.347
    2    HA   ALA  24           HA       ALA  24  -7.897  12.450  11.137
    3    HB1  ALA  24           HB1      ALA  24  -9.695  11.176  11.622
    4    HB2  ALA  24           HB2      ALA  24  -8.845  10.610  13.058
    5    HB3  ALA  24           HB3      ALA  24  -8.727   9.704  11.550

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ALA  25           H        ALA  25  -5.848  10.010  12.679
    2    HA   ALA  25           HA       ALA  25  -5.495  11.258  15.181
    3    HB2  ALA  25           HB1      ALA  25  -4.710   8.918  14.343
    4    HB3  ALA  25           HB2      ALA  25  -3.691   9.784  15.495
    5    HB1  ALA  25           HB3      ALA  25  -3.275   9.778  13.780

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LEU  26           H        LEU  26  -3.744  11.588  12.121
    2    HA   LEU  26           HA       LEU  26  -1.796  13.428  13.020
    3    HB2  LEU  26           HB2      LEU  26  -1.506  12.287  10.909
    4    HB3  LEU  26           HB3      LEU  26  -2.995  12.979  10.274
    5    HG   LEU  26           HG       LEU  26  -2.005  15.241  10.405
    6   HD12  LEU  26          HD11      LEU  26   0.538  15.289  10.789
    7   HD11  LEU  26          HD12      LEU  26   0.342  13.703  11.530
    8   HD13  LEU  26          HD13      LEU  26  -0.474  15.106  12.221
    9   HD21  LEU  26          HD21      LEU  26  -0.255  13.211   8.983
   10   HD23  LEU  26          HD22      LEU  26  -0.322  14.933   8.618
   11   HD22  LEU  26          HD23      LEU  26  -1.737  13.920   8.344

  No H/Q in entry =          11
  In of MODEL   60
    1    H    LYS  27           H        LYS  27  -5.000  13.879  11.582
    2    HA   LYS  27           HA       LYS  27  -4.979  16.668  11.393
    3    HB2  LYS  27           HB2      LYS  27  -6.718  15.175  10.423
    4    HB3  LYS  27           HB3      LYS  27  -7.353  14.905  12.046
    5    HG2  LYS  27           HG2      LYS  27  -7.806  17.306  12.295
    6    HG3  LYS  27           HG3      LYS  27  -7.121  17.616  10.697
    7    HD2  LYS  27           HD2      LYS  27  -8.849  16.166   9.676
    8    HD3  LYS  27           HD3      LYS  27  -9.541  15.872  11.274
    9    HE2  LYS  27           HE2      LYS  27 -10.008  18.278  11.530
   10    HE3  LYS  27           HE3      LYS  27  -9.288  18.593   9.948
   11    HZ3  LYS  27           HZ1      LYS  27 -11.666  18.442   9.734
   12    HZ2  LYS  27           HZ2      LYS  27 -11.688  16.923  10.499
   13    HZ1  LYS  27           HZ3      LYS  27 -10.963  17.099   8.969

  No H/Q in entry =          13
  In of MODEL   60
    1    H    GLN  28           H        GLN  28  -5.812  14.564  14.123
    2    HA   GLN  28           HA       GLN  28  -6.708  16.552  15.917
    3    HB2  GLN  28           HB2      GLN  28  -5.271  13.933  16.432
    4    HB3  GLN  28           HB3      GLN  28  -6.007  14.926  17.693
    5    HG2  GLN  28           HG2      GLN  28  -7.483  13.788  15.302
    6    HG3  GLN  28           HG3      GLN  28  -7.522  13.109  16.929
    7   HE21  GLN  28          HE21      GLN  28  -9.392  14.928  14.948
    8   HE22  GLN  28          HE22      GLN  28 -10.152  15.930  16.086

  No H/Q in entry =           8
  In of MODEL   60
    1    H    ALA  29           H        ALA  29  -3.484  15.291  15.184
    2    HA   ALA  29           HA       ALA  29  -2.037  16.698  17.150
    3    HB1  ALA  29           HB1      ALA  29  -0.113  16.030  16.006
    4    HB3  ALA  29           HB2      ALA  29  -0.888  16.152  14.426
    5    HB2  ALA  29           HB3      ALA  29  -1.283  14.811  15.501

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LYS  30           H        LYS  30  -2.943  17.579  13.834
    2    HA   LYS  30           HA       LYS  30  -1.557  20.033  13.725
    3    HB2  LYS  30           HB2      LYS  30  -4.096  19.141  12.344
    4    HB3  LYS  30           HB3      LYS  30  -3.280  20.664  11.996
    5    HG2  LYS  30           HG2      LYS  30  -1.206  19.391  11.452
    6    HG3  LYS  30           HG3      LYS  30  -2.096  17.886  11.703
    7    HD2  LYS  30           HD2      LYS  30  -3.687  18.519   9.930
    8    HD3  LYS  30           HD3      LYS  30  -2.820  20.036   9.681
    9    HE2  LYS  30           HE2      LYS  30  -0.784  18.762   9.073
   10    HE3  LYS  30           HE3      LYS  30  -1.671  17.251   9.290
   11    HZ2  LYS  30           HZ1      LYS  30  -1.530  18.131   6.949
   12    HZ1  LYS  30           HZ2      LYS  30  -2.579  19.384   7.435
   13    HZ3  LYS  30           HZ3      LYS  30  -3.089  17.762   7.507

  No H/Q in entry =          13
  In of MODEL   60
    1    H    GLN  31           H        GLN  31  -4.632  19.151  15.172
    2    HA   GLN  31           HA       GLN  31  -5.411  21.900  15.643
    3    HB2  GLN  31           HB2      GLN  31  -6.556  19.440  16.972
    4    HB3  GLN  31           HB3      GLN  31  -7.330  21.007  16.741
    5    HG2  GLN  31           HG2      GLN  31  -6.646  20.244  14.140
    6    HG3  GLN  31           HG3      GLN  31  -7.151  18.733  14.888
    7   HE21  GLN  31          HE21      GLN  31  -8.598  20.304  12.810
    8   HE22  GLN  31          HE22      GLN  31 -10.106  20.683  13.487

  No H/Q in entry =           8
  In of MODEL   60
    1    H    GLY  32           H        GLY  32  -3.069  19.985  16.928
    2    HA3  GLY  32           HA2      GLY  32  -1.650  20.450  18.714
    3    HA2  GLY  32           HA3      GLY  32  -2.781  21.683  19.256

  No H/Q in entry =           3
  In of MODEL   60
    1    H    ASP  33           H        ASP  33  -4.190  18.636  18.601
    2    HA   ASP  33           HA       ASP  33  -4.562  18.165  21.484
    3    HB2  ASP  33           HB2      ASP  33  -5.992  17.153  19.020
    4    HB3  ASP  33           HB3      ASP  33  -6.313  16.534  20.638

  No H/Q in entry =           4
  In of MODEL   60
    1    H    PHE  34           H        PHE  34  -2.384  17.328  21.759
    2    HA   PHE  34           HA       PHE  34  -1.386  15.091  20.337
    3    HB2  PHE  34           HB2      PHE  34  -0.741  16.069  23.128
    4    HB3  PHE  34           HB3      PHE  34   0.185  14.856  22.244
    5    HD1  PHE  34           HD1      PHE  34  -0.001  18.278  22.994
    6    HD2  PHE  34           HD2      PHE  34   0.807  15.593  19.739
    7    HE1  PHE  34           HE1      PHE  34   1.268  20.062  21.831
    8    HE2  PHE  34           HE2      PHE  34   2.071  17.380  18.581
    9    HZ   PHE  34           HZ       PHE  34   2.304  19.612  19.631

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ALA  35           H        ALA  35  -3.391  15.344  23.226
    2    HA   ALA  35           HA       ALA  35  -3.150  12.680  24.110
    3    HB3  ALA  35           HB1      ALA  35  -5.601  13.286  25.000
    4    HB1  ALA  35           HB2      ALA  35  -5.085  14.909  24.544
    5    HB2  ALA  35           HB3      ALA  35  -4.149  13.987  25.720

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ALA  36           H        ALA  36  -5.636  14.188  22.047
    2    HA   ALA  36           HA       ALA  36  -7.041  11.768  21.577
    3    HB1  ALA  36           HB1      ALA  36  -8.518  13.185  20.645
    4    HB3  ALA  36           HB2      ALA  36  -7.365  13.618  19.383
    5    HB2  ALA  36           HB3      ALA  36  -7.376  14.499  20.911

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ALA  37           H        ALA  37  -4.393  13.380  19.881
    2    HA   ALA  37           HA       ALA  37  -4.376  11.754  17.578
    3    HB3  ALA  37           HB1      ALA  37  -2.377  13.474  18.982
    4    HB2  ALA  37           HB2      ALA  37  -2.929  13.533  17.309
    5    HB1  ALA  37           HB3      ALA  37  -1.760  12.308  17.811

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LYS  38           H        LYS  38  -2.578  11.448  20.632
    2    HA   LYS  38           HA       LYS  38  -1.243   9.059  20.117
    3    HB2  LYS  38           HB2      LYS  38  -1.551  10.811  22.273
    4    HB3  LYS  38           HB3      LYS  38  -2.152   9.275  22.891
    5    HG2  LYS  38           HG2      LYS  38  -0.057   8.171  22.324
    6    HG3  LYS  38           HG3      LYS  38   0.532   9.623  21.509
    7    HD2  LYS  38           HD2      LYS  38   0.718  10.835  23.547
    8    HD3  LYS  38           HD3      LYS  38  -0.282   9.674  24.422
    9    HE2  LYS  38           HE2      LYS  38   2.083   9.372  25.010
   10    HE3  LYS  38           HE3      LYS  38   1.477   7.955  24.148
   11    HZ3  LYS  38           HZ1      LYS  38   2.752   8.390  22.352
   12    HZ2  LYS  38           HZ2      LYS  38   3.716   9.220  23.480
   13    HZ1  LYS  38           HZ3      LYS  38   2.619  10.076  22.506

  No H/Q in entry =          13
  In of MODEL   60
    1    H    ALA  39           H        ALA  39  -4.467   9.526  21.562
    2    HA   ALA  39           HA       ALA  39  -5.002   6.801  22.062
    3    HB3  ALA  39           HB1      ALA  39  -7.184   8.734  21.330
    4    HB2  ALA  39           HB2      ALA  39  -6.268   8.961  22.821
    5    HB1  ALA  39           HB3      ALA  39  -7.178   7.472  22.563

  No H/Q in entry =           5
  In of MODEL   60
    1    H    MET  40           H        MET  40  -5.637   8.822  19.231
    2    HA   MET  40           HA       MET  40  -7.117   6.885  17.782
    3    HB2  MET  40           HB2      MET  40  -5.536   9.295  16.867
    4    HB3  MET  40           HB3      MET  40  -6.568   8.333  15.806
    5    HG2  MET  40           HG2      MET  40  -7.579   9.565  18.381
    6    HG3  MET  40           HG3      MET  40  -7.662  10.405  16.835
    7    HE3  MET  40           HE1      MET  40 -10.260   8.776  14.797
    8    HE2  MET  40           HE2      MET  40  -8.510   8.906  14.627
    9    HE1  MET  40           HE3      MET  40  -9.429  10.262  15.278

  No H/Q in entry =           9
  In of MODEL   60
    1    H    MET  41           H        MET  41  -3.630   7.647  17.864
    2    HA   MET  41           HA       MET  41  -2.886   5.906  15.747
    3    HB2  MET  41           HB2      MET  41  -1.243   6.575  18.202
    4    HB3  MET  41           HB3      MET  41  -0.640   5.937  16.677
    5    HG2  MET  41           HG2      MET  41  -1.825   8.116  15.696
    6    HG3  MET  41           HG3      MET  41  -1.572   8.698  17.340
    7    HE2  MET  41           HE1      MET  41   1.365   6.620  17.656
    8    HE1  MET  41           HE2      MET  41   0.578   7.905  18.570
    9    HE3  MET  41           HE3      MET  41   2.192   8.162  17.908

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ASP  42           H        ASP  42  -3.224   5.416  19.236
    2    HA   ASP  42           HA       ASP  42  -2.167   2.830  19.372
    3    HB2  ASP  42           HB2      ASP  42  -3.031   4.575  21.213
    4    HB3  ASP  42           HB3      ASP  42  -4.451   3.540  21.154

  No H/Q in entry =           4
  In of MODEL   60
    1    H    GLN  43           H        GLN  43  -5.514   3.910  18.918
    2    HA   GLN  43           HA       GLN  43  -6.641   1.315  18.726
    3    HB2  GLN  43           HB2      GLN  43  -7.598   3.965  17.620
    4    HB3  GLN  43           HB3      GLN  43  -8.550   2.478  17.603
    5    HG2  GLN  43           HG2      GLN  43  -8.224   2.349  20.107
    6    HG3  GLN  43           HG3      GLN  43  -7.513   3.960  20.033
    7   HE21  GLN  43          HE21      GLN  43  -9.674   4.017  21.560
    8   HE22  GLN  43          HE22      GLN  43 -11.049   4.586  20.748

  No H/Q in entry =           8
  In of MODEL   60
    1    H    SER  44           H        SER  44  -5.347   3.549  16.307
    2    HA   SER  44           HA       SER  44  -6.065   2.069  14.021
    3    HB2  SER  44           HB2      SER  44  -4.821   4.460  14.459
    4    HB3  SER  44           HB3      SER  44  -3.467   3.477  13.908
    5    HG   SER  44           HG       SER  44  -4.608   4.447  12.163

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ARG  45           H        ARG  45  -3.161   1.969  16.065
    2    HA   ARG  45           HA       ARG  45  -1.684   0.032  14.657
    3    HB2  ARG  45           HB2      ARG  45  -0.830   1.452  16.521
    4    HB3  ARG  45           HB3      ARG  45  -1.800   0.509  17.650
    5    HG2  ARG  45           HG2      ARG  45  -0.561  -1.537  16.983
    6    HG3  ARG  45           HG3      ARG  45   0.434  -0.570  15.897
    7    HD2  ARG  45           HD2      ARG  45   1.182   0.808  17.849
    8    HD3  ARG  45           HD3      ARG  45   0.281  -0.278  18.929
    9    HE   ARG  45           HE       ARG  45   1.973  -1.854  17.321
   10   HH21  ARG  45          HH11      ARG  45   3.889  -2.666  18.132
   11   HH22  ARG  45          HH12      ARG  45   4.672  -1.880  19.457
   12   HH11  ARG  45          HH21      ARG  45   2.286   0.604  19.718
   13   HH12  ARG  45          HH22      ARG  45   3.764  -0.026  20.352

  No H/Q in entry =          13
  In of MODEL   60
    1    H    MET  46           H        MET  46  -4.047  -0.317  17.285
    2    HA   MET  46           HA       MET  46  -3.854  -3.116  17.577
    3    HB2  MET  46           HB2      MET  46  -6.037  -1.133  18.210
    4    HB3  MET  46           HB3      MET  46  -6.216  -2.855  18.553
    5    HG2  MET  46           HG2      MET  46  -4.171  -2.809  19.919
    6    HG3  MET  46           HG3      MET  46  -3.956  -1.102  19.562
    7    HE2  MET  46           HE1      MET  46  -4.145   0.009  22.047
    8    HE1  MET  46           HE2      MET  46  -3.679  -1.679  22.225
    9    HE3  MET  46           HE3      MET  46  -4.913  -0.999  23.280

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ALA  47           H        ALA  47  -5.914  -1.106  15.516
    2    HA   ALA  47           HA       ALA  47  -7.530  -3.163  14.461
    3    HB3  ALA  47           HB1      ALA  47  -8.231  -0.929  14.063
    4    HB1  ALA  47           HB2      ALA  47  -7.756  -1.552  12.483
    5    HB2  ALA  47           HB3      ALA  47  -6.673  -0.480  13.371

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LEU  48           H        LEU  48  -4.434  -1.829  13.379
    2    HA   LEU  48           HA       LEU  48  -4.170  -3.407  11.027
    3    HB2  LEU  48           HB2      LEU  48  -2.100  -2.123  12.816
    4    HB3  LEU  48           HB3      LEU  48  -1.745  -2.834  11.242
    5    HG   LEU  48           HG       LEU  48  -3.778  -0.632  11.665
    6   HD13  LEU  48          HD11      LEU  48  -1.654   0.255  12.309
    7   HD12  LEU  48          HD12      LEU  48  -1.952   0.814  10.663
    8   HD11  LEU  48          HD13      LEU  48  -0.843  -0.526  10.952
    9   HD22  LEU  48          HD21      LEU  48  -4.268  -1.610   9.591
   10   HD21  LEU  48          HD22      LEU  48  -2.586  -2.033   9.273
   11   HD23  LEU  48          HD23      LEU  48  -3.118  -0.357   9.128

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ASN  49           H        ASN  49  -3.082  -3.812  14.359
    2    HA   ASN  49           HA       ASN  49  -1.470  -6.063  13.999
    3    HB2  ASN  49           HB2      ASN  49  -1.464  -4.753  16.053
    4    HB3  ASN  49           HB3      ASN  49  -3.126  -5.212  16.390
    5   HD21  ASN  49          HD21      ASN  49   0.140  -6.616  15.988
    6   HD22  ASN  49          HD22      ASN  49  -0.135  -7.939  17.016

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLU  50           H        GLU  50  -4.932  -5.812  14.713
    2    HA   GLU  50           HA       GLU  50  -5.427  -8.614  14.815
    3    HB2  GLU  50           HB2      GLU  50  -7.012  -6.940  15.718
    4    HB3  GLU  50           HB3      GLU  50  -7.328  -6.370  14.077
    5    HG2  GLU  50           HG2      GLU  50  -8.188  -8.568  13.440
    6    HG3  GLU  50           HG3      GLU  50  -7.784  -9.217  15.026

  No H/Q in entry =           6
  In of MODEL   60
    1    H    ALA  51           H        ALA  51  -5.539  -6.205  12.231
    2    HA   ALA  51           HA       ALA  51  -6.539  -7.929  10.213
    3    HB2  ALA  51           HB1      ALA  51  -6.345  -6.110   8.850
    4    HB1  ALA  51           HB2      ALA  51  -4.701  -5.754   9.380
    5    HB3  ALA  51           HB3      ALA  51  -6.075  -5.255  10.367

  No H/Q in entry =           5
  In of MODEL   60
    1    H    HIS  52           H        HIS  52  -3.242  -7.010  11.162
    2    HA   HIS  52           HA       HIS  52  -1.858  -8.484   9.190
    3    HB2  HIS  52           HB2      HIS  52  -0.778  -6.768  10.576
    4    HB3  HIS  52           HB3      HIS  52  -0.996  -7.778  12.006
    5    HD1  HIS  52           HD1      HIS  52   0.118 -10.319  11.674
    6    HD2  HIS  52           HD2      HIS  52   1.650  -7.216   9.350
    7    HE1  HIS  52           HE1      HIS  52   2.393 -11.085  10.865
    8    HE2  HIS  52           HE2      HIS  52   3.339  -9.204   9.446

  No H/Q in entry =           8
  In of MODEL   60
    1    H    LEU  53           H        LEU  53  -3.028  -9.381  12.412
    2    HA   LEU  53           HA       LEU  53  -1.817 -11.921  12.580
    3    HB2  LEU  53           HB2      LEU  53  -4.307 -10.773  13.823
    4    HB3  LEU  53           HB3      LEU  53  -3.802 -12.435  14.118
    5    HG   LEU  53           HG       LEU  53  -1.960 -10.063  14.560
    6   HD11  LEU  53          HD11      LEU  53  -3.855 -11.456  16.469
    7   HD13  LEU  53          HD12      LEU  53  -3.814  -9.742  16.056
    8   HD12  LEU  53          HD13      LEU  53  -2.512 -10.451  17.003
    9   HD22  LEU  53          HD21      LEU  53  -0.613 -11.993  14.529
   10   HD21  LEU  53          HD22      LEU  53  -1.883 -13.005  15.205
   11   HD23  LEU  53          HD23      LEU  53  -1.016 -11.884  16.238

  No H/Q in entry =          11
  In of MODEL   60
    1    H    VAL  54           H        VAL  54  -4.948 -10.898  11.259
    2    HA   VAL  54           HA       VAL  54  -5.860 -13.493  10.571
    3    HB   VAL  54           HB       VAL  54  -6.531 -10.758   9.457
    4   HG12  VAL  54          HG11      VAL  54  -8.637 -12.141   8.664
    5   HG11  VAL  54          HG12      VAL  54  -7.519 -13.503   8.717
    6   HG13  VAL  54          HG13      VAL  54  -7.177 -12.121   7.677
    7   HG22  VAL  54          HG21      VAL  54  -7.412 -10.809  11.619
    8   HG21  VAL  54          HG22      VAL  54  -7.660 -12.553  11.594
    9   HG23  VAL  54          HG23      VAL  54  -8.755 -11.497  10.706

  No H/Q in entry =           9
  In of MODEL   60
    1    H    GLN  55           H        GLN  55  -4.019 -11.027   8.771
    2    HA   GLN  55           HA       GLN  55  -3.911 -12.480   6.346
    3    HB2  GLN  55           HB2      GLN  55  -3.318 -10.212   6.159
    4    HB3  GLN  55           HB3      GLN  55  -2.191 -10.290   7.511
    5    HG2  GLN  55           HG2      GLN  55  -0.486 -11.124   6.211
    6    HG3  GLN  55           HG3      GLN  55  -1.568 -12.099   5.225
    7   HE21  GLN  55          HE21      GLN  55  -1.612 -11.399   3.107
    8   HE22  GLN  55          HE22      GLN  55  -1.426  -9.792   2.602

  No H/Q in entry =           8
  In of MODEL   60
    1    H    THR  56           H        THR  56  -1.772 -12.464   9.202
    2    HA   THR  56           HA       THR  56   0.301 -14.051   8.253
    3    HB   THR  56           HB       THR  56  -0.911 -14.309  11.014
    4    HG1  THR  56           HG1      THR  56   1.160 -12.542  10.365
    5   HG21  THR  56          HG21      THR  56   1.110 -15.737   9.933
    6   HG23  THR  56          HG22      THR  56   1.062 -15.286  11.638
    7   HG22  THR  56          HG23      THR  56   2.013 -14.333  10.498

  No H/Q in entry =           7
  In of MODEL   60
    1    H    LYS  57           H        LYS  57  -2.799 -15.104   9.648
    2    HA   LYS  57           HA       LYS  57  -2.347 -17.897   9.384
    3    HB2  LYS  57           HB2      LYS  57  -4.154 -16.809  10.754
    4    HB3  LYS  57           HB3      LYS  57  -4.967 -16.372   9.259
    5    HG2  LYS  57           HG2      LYS  57  -5.183 -18.746   8.659
    6    HG3  LYS  57           HG3      LYS  57  -4.345 -19.206  10.139
    7    HD2  LYS  57           HD2      LYS  57  -6.145 -18.178  11.483
    8    HD3  LYS  57           HD3      LYS  57  -6.989 -17.715  10.007
    9    HE2  LYS  57           HE2      LYS  57  -7.956 -19.792  10.889
   10    HE3  LYS  57           HE3      LYS  57  -7.132 -20.140   9.370
   11    HZ1  LYS  57           HZ1      LYS  57  -5.326 -20.343  11.538
   12    HZ3  LYS  57           HZ2      LYS  57  -5.780 -21.524  10.403
   13    HZ2  LYS  57           HZ3      LYS  57  -6.686 -21.316  11.826

  No H/Q in entry =          13
  In of MODEL   60
    1    H    LEU  58           H        LEU  58  -3.712 -15.450   7.235
    2    HA   LEU  58           HA       LEU  58  -4.531 -17.268   5.230
    3    HB2  LEU  58           HB2      LEU  58  -3.936 -14.317   5.101
    4    HB3  LEU  58           HB3      LEU  58  -4.612 -15.250   3.765
    5    HG   LEU  58           HG       LEU  58  -5.860 -15.087   6.528
    6   HD11  LEU  58          HD11      LEU  58  -6.194 -13.430   4.047
    7   HD13  LEU  58          HD12      LEU  58  -6.166 -12.930   5.738
    8   HD12  LEU  58          HD13      LEU  58  -7.594 -13.725   5.079
    9   HD22  LEU  58          HD21      LEU  58  -6.827 -16.995   5.661
   10   HD21  LEU  58          HD22      LEU  58  -6.508 -16.535   3.989
   11   HD23  LEU  58          HD23      LEU  58  -7.864 -15.817   4.858

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  59           H        ILE  59  -1.390 -16.051   6.060
    2    HA   ILE  59           HA       ILE  59  -0.321 -16.764   3.408
    3    HB   ILE  59           HB       ILE  59   0.460 -14.706   4.987
    4   HG12  ILE  59          HG12      ILE  59   2.520 -16.336   3.487
    5   HG13  ILE  59          HG13      ILE  59   1.315 -15.369   2.678
    6   HG23  ILE  59          HG21      ILE  59   2.335 -15.197   6.335
    7   HG22  ILE  59          HG22      ILE  59   2.568 -16.774   5.614
    8   HG21  ILE  59          HG23      ILE  59   1.228 -16.492   6.724
    9   HD11  ILE  59          HD11      ILE  59   2.099 -13.378   3.987
   10   HD13  ILE  59          HD12      ILE  59   3.316 -14.028   2.890
   11   HD12  ILE  59          HD13      ILE  59   3.406 -14.380   4.616

  No H/Q in entry =          11
  In of MODEL   60
    1    H    GLU  60           H        GLU  60  -0.289 -17.885   6.771
    2    HA   GLU  60           HA       GLU  60   1.745 -19.855   6.474
    3    HB2  GLU  60           HB2      GLU  60   1.223 -20.476   8.629
    4    HB3  GLU  60           HB3      GLU  60   0.483 -18.877   8.606
    5    HG2  GLU  60           HG2      GLU  60  -1.677 -19.998   7.886
    6    HG3  GLU  60           HG3      GLU  60  -0.894 -21.545   8.208

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLY  61           H        GLY  61  -1.771 -19.962   6.028
    2    HA3  GLY  61           HA2      GLY  61  -1.526 -22.750   5.055
    3    HA2  GLY  61           HA3      GLY  61  -3.006 -22.021   5.668

  No H/Q in entry =           3
  In of MODEL   60
    1    H    ASP  62           H        ASP  62  -0.805 -20.429   3.445
    2    HA   ASP  62           HA       ASP  62  -2.912 -19.838   1.612
    3    HB2  ASP  62           HB2      ASP  62  -1.054 -18.839   0.269
    4    HB3  ASP  62           HB3      ASP  62  -1.108 -18.265   1.932

  No H/Q in entry =           4
  In of MODEL   60
    1    H    ALA  63           H        ALA  63  -1.535 -22.754   2.059
    2    HA   ALA  63           HA       ALA  63  -0.654 -23.619  -0.482
    3    HB1  ALA  63           HB1      ALA  63  -2.191 -25.381   1.398
    4    HB2  ALA  63           HB2      ALA  63  -0.556 -24.838   1.775
    5    HB3  ALA  63           HB3      ALA  63  -0.851 -25.803   0.328

  No H/Q in entry =           5
  In of MODEL   60
    1    H    GLY  64           H        GLY  64  -3.869 -23.444   0.982
    2    HA3  GLY  64           HA2      GLY  64  -5.983 -23.704   0.129
    3    HA2  GLY  64           HA3      GLY  64  -5.326 -22.950  -1.314

  No H/Q in entry =           3
  In of MODEL   60
    1    H    GLU  65           H        GLU  65  -6.030 -24.121  -3.022
    2    HA   GLU  65           HA       GLU  65  -6.852 -26.768  -2.962
    3    HB2  GLU  65           HB2      GLU  65  -5.756 -25.191  -5.293
    4    HB3  GLU  65           HB3      GLU  65  -6.612 -26.727  -5.431
    5    HG2  GLU  65           HG2      GLU  65  -8.360 -25.215  -5.713
    6    HG3  GLU  65           HG3      GLU  65  -8.437 -25.510  -3.977

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLY  66           H        GLY  66  -5.736 -28.161  -4.918
    2    HA3  GLY  66           HA2      GLY  66  -3.613 -29.553  -3.713
    3    HA2  GLY  66           HA3      GLY  66  -4.195 -29.777  -5.352

  No H/Q in entry =           3
  In of MODEL   60
    1    H    LYS  67           H        LYS  67  -3.626 -27.057  -6.158
    2    HA   LYS  67           HA       LYS  67  -1.015 -27.424  -7.139
    3    HB2  LYS  67           HB2      LYS  67  -2.867 -25.047  -7.159
    4    HB3  LYS  67           HB3      LYS  67  -1.324 -25.088  -8.019
    5    HG2  LYS  67           HG2      LYS  67  -2.035 -27.119  -9.220
    6    HG3  LYS  67           HG3      LYS  67  -3.575 -27.093  -8.364
    7    HD2  LYS  67           HD2      LYS  67  -4.057 -24.862  -9.359
    8    HD3  LYS  67           HD3      LYS  67  -2.552 -24.973 -10.274
    9    HE2  LYS  67           HE2      LYS  67  -4.777 -27.025 -10.427
   10    HE3  LYS  67           HE3      LYS  67  -4.574 -25.706 -11.578
   11    HZ3  LYS  67           HZ1      LYS  67  -3.396 -27.325 -12.620
   12    HZ2  LYS  67           HZ2      LYS  67  -2.939 -28.098 -11.178
   13    HZ1  LYS  67           HZ3      LYS  67  -2.152 -26.674 -11.669

  No H/Q in entry =          13
  In of MODEL   60
    1    H    MET  68           H        MET  68   0.870 -26.344  -6.863
    2    HA   MET  68           HA       MET  68   1.732 -25.865  -4.240
    3    HB2  MET  68           HB2      MET  68   2.999 -25.112  -6.876
    4    HB3  MET  68           HB3      MET  68   3.823 -25.099  -5.316
    5    HG2  MET  68           HG2      MET  68   2.494 -27.530  -6.546
    6    HG3  MET  68           HG3      MET  68   4.228 -27.206  -6.585
    7    HE3  MET  68           HE1      MET  68   5.595 -27.650  -3.247
    8    HE2  MET  68           HE2      MET  68   4.914 -26.051  -3.541
    9    HE1  MET  68           HE3      MET  68   5.674 -26.934  -4.864

  No H/Q in entry =           9
  In of MODEL   60
    1    H    LYS  69           H        LYS  69   0.889 -23.542  -6.807
    2    HA   LYS  69           HA       LYS  69   1.838 -21.215  -5.757
    3    HB2  LYS  69           HB2      LYS  69   0.116 -20.026  -6.987
    4    HB3  LYS  69           HB3      LYS  69   0.765 -21.367  -7.939
    5    HG2  LYS  69           HG2      LYS  69  -1.127 -22.776  -7.316
    6    HG3  LYS  69           HG3      LYS  69  -1.763 -21.506  -6.271
    7    HD2  LYS  69           HD2      LYS  69  -3.002 -21.335  -8.298
    8    HD3  LYS  69           HD3      LYS  69  -1.818 -20.027  -8.364
    9    HE2  LYS  69           HE2      LYS  69  -0.411 -21.234  -9.858
   10    HE3  LYS  69           HE3      LYS  69  -1.266 -22.747  -9.558
   11    HZ3  LYS  69           HZ1      LYS  69  -2.634 -22.272 -11.209
   12    HZ2  LYS  69           HZ2      LYS  69  -1.794 -20.827 -11.515
   13    HZ1  LYS  69           HZ3      LYS  69  -3.112 -20.836 -10.443

  No H/Q in entry =          13
  In of MODEL   60
    1    H    VAL  70           H        VAL  70  -0.038 -19.339  -5.270
    2    HA   VAL  70           HA       VAL  70  -1.374 -20.160  -2.755
    3    HB   VAL  70           HB       VAL  70  -0.690 -17.961  -1.797
    4   HG11  VAL  70          HG11      VAL  70   0.653 -20.179  -1.620
    5   HG13  VAL  70          HG12      VAL  70   1.454 -18.681  -1.143
    6   HG12  VAL  70          HG13      VAL  70   1.791 -19.401  -2.718
    7   HG21  VAL  70          HG21      VAL  70   0.614 -17.718  -4.501
    8   HG23  VAL  70          HG22      VAL  70   1.397 -16.972  -3.111
    9   HG22  VAL  70          HG23      VAL  70  -0.236 -16.490  -3.561

  No H/Q in entry =           9
  In of MODEL   60
    1    H    SER  71           H        SER  71  -2.991 -18.517  -2.058
    2    HA   SER  71           HA       SER  71  -4.900 -17.979  -4.067
    3    HB2  SER  71           HB2      SER  71  -5.435 -18.195  -1.627
    4    HB3  SER  71           HB3      SER  71  -4.632 -16.656  -1.343
    5    HG   SER  71           HG       SER  71  -6.265 -16.209  -3.309

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LEU  72           H        LEU  72  -5.195 -16.285  -5.381
    2    HA   LEU  72           HA       LEU  72  -3.100 -14.463  -5.880
    3    HB2  LEU  72           HB2      LEU  72  -5.977 -14.515  -6.789
    4    HB3  LEU  72           HB3      LEU  72  -4.783 -13.362  -7.379
    5    HG   LEU  72           HG       LEU  72  -4.397 -16.370  -7.519
    6   HD11  LEU  72          HD11      LEU  72  -5.516 -14.420  -9.549
    7   HD13  LEU  72          HD12      LEU  72  -6.303 -15.858  -8.896
    8   HD12  LEU  72          HD13      LEU  72  -4.918 -16.024  -9.974
    9   HD22  LEU  72          HD21      LEU  72  -2.274 -15.388  -7.779
   10   HD21  LEU  72          HD22      LEU  72  -2.910 -13.967  -8.591
   11   HD23  LEU  72          HD23      LEU  72  -2.834 -15.506  -9.444

  No H/Q in entry =          11
  In of MODEL   60
    1    H    VAL  73           H        VAL  73  -6.174 -14.126  -4.210
    2    HA   VAL  73           HA       VAL  73  -6.226 -11.357  -3.844
    3    HB   VAL  73           HB       VAL  73  -7.943 -11.722  -2.287
    4   HG13  VAL  73          HG11      VAL  73  -9.352 -13.323  -3.387
    5   HG12  VAL  73          HG12      VAL  73  -7.963 -14.231  -3.978
    6   HG11  VAL  73          HG13      VAL  73  -8.311 -12.629  -4.631
    7   HG23  VAL  73          HG21      VAL  73  -8.220 -14.061  -1.263
    8   HG22  VAL  73          HG22      VAL  73  -6.884 -13.090  -0.646
    9   HG21  VAL  73          HG23      VAL  73  -6.574 -14.378  -1.810

  No H/Q in entry =           9
  In of MODEL   60
    1    H    LEU  74           H        LEU  74  -4.258 -13.725  -2.297
    2    HA   LEU  74           HA       LEU  74  -3.820 -12.595   0.226
    3    HB2  LEU  74           HB2      LEU  74  -3.034 -14.808  -0.295
    4    HB3  LEU  74           HB3      LEU  74  -1.998 -14.185  -1.578
    5    HG   LEU  74           HG       LEU  74  -0.669 -12.944   0.091
    6   HD13  LEU  74          HD11      LEU  74  -2.207 -12.438   1.828
    7   HD12  LEU  74          HD12      LEU  74  -1.135 -13.646   2.539
    8   HD11  LEU  74          HD13      LEU  74  -2.734 -14.116   1.959
    9   HD23  LEU  74          HD21      LEU  74  -0.872 -15.687   1.215
   10   HD22  LEU  74          HD22      LEU  74   0.526 -14.777   0.688
   11   HD21  LEU  74          HD23      LEU  74  -0.510 -15.529  -0.502

  No H/Q in entry =          11
  In of MODEL   60
    1    H    VAL  75           H        VAL  75  -1.968 -12.179  -2.753
    2    HA   VAL  75           HA       VAL  75  -0.166 -10.252  -1.755
    3    HB   VAL  75           HB       VAL  75  -1.156 -10.720  -4.570
    4   HG12  VAL  75          HG11      VAL  75   0.905  -9.410  -5.203
    5   HG11  VAL  75          HG12      VAL  75   1.125  -9.018  -3.504
    6   HG13  VAL  75          HG13      VAL  75  -0.291  -8.431  -4.362
    7   HG23  VAL  75          HG21      VAL  75   1.497 -11.425  -3.285
    8   HG22  VAL  75          HG22      VAL  75   0.850 -12.009  -4.817
    9   HG21  VAL  75          HG23      VAL  75   0.131 -12.540  -3.297

  No H/Q in entry =           9
  In of MODEL   60
    1    H    GLU  76           H        GLU  76  -3.339  -9.910  -3.371
    2    HA   GLU  76           HA       GLU  76  -3.403  -7.095  -3.457
    3    HB2  GLU  76           HB2      GLU  76  -5.072  -8.524  -4.609
    4    HB3  GLU  76           HB3      GLU  76  -5.698  -9.051  -3.055
    5    HG2  GLU  76           HG2      GLU  76  -7.178  -7.338  -3.888
    6    HG3  GLU  76           HG3      GLU  76  -6.285  -6.638  -2.552

  No H/Q in entry =           6
  In of MODEL   60
    1    H    ALA  77           H        ALA  77  -4.472  -9.341  -0.915
    2    HA   ALA  77           HA       ALA  77  -5.415  -7.352   0.866
    3    HB3  ALA  77           HB1      ALA  77  -5.558  -9.058   2.475
    4    HB1  ALA  77           HB2      ALA  77  -4.206  -9.952   1.783
    5    HB2  ALA  77           HB3      ALA  77  -5.757  -9.914   0.946

  No H/Q in entry =           5
  In of MODEL   60
    1    H    GLN  78           H        GLN  78  -2.266  -8.886   0.453
    2    HA   GLN  78           HA       GLN  78  -0.984  -7.733   2.693
    3    HB2  GLN  78           HB2      GLN  78  -0.131  -9.663   1.321
    4    HB3  GLN  78           HB3      GLN  78   0.281  -8.511   0.052
    5    HG2  GLN  78           HG2      GLN  78   1.755  -7.313   1.618
    6    HG3  GLN  78           HG3      GLN  78   1.350  -8.465   2.887
    7   HE21  GLN  78          HE21      GLN  78   4.056  -8.160   1.997
    8   HE22  GLN  78          HE22      GLN  78   4.517  -9.586   1.197

  No H/Q in entry =           8
  In of MODEL   60
    1    H    LEU  79           H        LEU  79  -1.397  -6.656  -0.643
    2    HA   LEU  79           HA       LEU  79   0.281  -4.423  -0.640
    3    HB2  LEU  79           HB2      LEU  79  -0.769  -5.223  -2.685
    4    HB3  LEU  79           HB3      LEU  79  -2.366  -4.840  -2.053
    5    HG   LEU  79           HG       LEU  79  -1.829  -2.451  -2.023
    6   HD13  LEU  79          HD11      LEU  79   0.417  -2.203  -1.537
    7   HD12  LEU  79          HD12      LEU  79   0.443  -1.906  -3.275
    8   HD11  LEU  79          HD13      LEU  79   0.910  -3.486  -2.643
    9   HD23  LEU  79          HD21      LEU  79  -1.228  -2.237  -4.582
   10   HD22  LEU  79          HD22      LEU  79  -2.746  -2.992  -4.107
   11   HD21  LEU  79          HD23      LEU  79  -1.376  -3.995  -4.574

  No H/Q in entry =          11
  In of MODEL   60
    1    H    HIS  80           H        HIS  80  -3.174  -4.601   0.230
    2    HA   HIS  80           HA       HIS  80  -3.365  -1.849   0.910
    3    HB2  HIS  80           HB2      HIS  80  -5.055  -4.264   1.238
    4    HB3  HIS  80           HB3      HIS  80  -5.365  -2.931   2.353
    5    HD1  HIS  80           HD1      HIS  80  -6.999  -1.294   1.474
    6    HD2  HIS  80           HD2      HIS  80  -4.840  -3.084  -1.610
    7    HE1  HIS  80           HE1      HIS  80  -7.870  -0.288  -0.689
    8    HE2  HIS  80           HE2      HIS  80  -6.560  -1.374  -2.578

  No H/Q in entry =           8
  In of MODEL   60
    1    H    LEU  81           H        LEU  81  -2.843  -4.752   2.882
    2    HA   LEU  81           HA       LEU  81  -2.802  -3.418   5.372
    3    HB2  LEU  81           HB2      LEU  81  -1.588  -6.026   4.464
    4    HB3  LEU  81           HB3      LEU  81  -1.542  -5.476   6.140
    5    HG   LEU  81           HG       LEU  81  -4.108  -5.727   4.544
    6   HD12  LEU  81          HD11      LEU  81  -4.385  -7.801   6.084
    7   HD11  LEU  81          HD12      LEU  81  -2.631  -7.727   6.248
    8   HD13  LEU  81          HD13      LEU  81  -3.360  -7.951   4.657
    9   HD23  LEU  81          HD21      LEU  81  -4.918  -5.945   7.054
   10   HD22  LEU  81          HD22      LEU  81  -4.606  -4.351   6.368
   11   HD21  LEU  81          HD23      LEU  81  -3.404  -5.114   7.409

  No H/Q in entry =          11
  In of MODEL   60
    1    H    MET  82           H        MET  82  -0.147  -4.303   3.163
    2    HA   MET  82           HA       MET  82   1.956  -3.413   4.824
    3    HB2  MET  82           HB2      MET  82   1.703  -3.740   1.834
    4    HB3  MET  82           HB3      MET  82   3.193  -3.169   2.581
    5    HG2  MET  82           HG2      MET  82   1.802  -5.766   3.310
    6    HG3  MET  82           HG3      MET  82   3.159  -5.647   2.193
    7    HE3  MET  82           HE1      MET  82   6.198  -4.915   4.141
    8    HE2  MET  82           HE2      MET  82   5.264  -3.546   3.542
    9    HE1  MET  82           HE3      MET  82   5.344  -5.031   2.598

  No H/Q in entry =           9
  In of MODEL   60
    1    H    THR  83           H        THR  83   0.097  -1.762   2.300
    2    HA   THR  83           HA       THR  83   1.506   0.689   2.380
    3    HB   THR  83           HB       THR  83  -0.685   1.614   1.427
    4    HG1  THR  83           HG1      THR  83  -2.334   0.315   1.335
    5   HG22  THR  83          HG21      THR  83  -0.437  -0.193  -0.586
    6   HG21  THR  83          HG22      THR  83   1.075  -0.487   0.270
    7   HG23  THR  83          HG23      THR  83   0.703   1.129  -0.332

  No H/Q in entry =           7
  In of MODEL   60
    1    H    SER  84           H        SER  84  -1.478  -0.357   4.015
    2    HA   SER  84           HA       SER  84  -1.961   2.065   5.378
    3    HB2  SER  84           HB2      SER  84  -2.781  -0.777   5.939
    4    HB3  SER  84           HB3      SER  84  -3.264   0.558   6.985
    5    HG   SER  84           HG       SER  84  -3.758   0.257   4.197

  No H/Q in entry =           5
  In of MODEL   60
    1    H    MET  85           H        MET  85  -0.231  -0.870   6.471
    2    HA   MET  85           HA       MET  85   0.320   0.045   9.072
    3    HB2  MET  85           HB2      MET  85   0.608  -2.296   8.373
    4    HB3  MET  85           HB3      MET  85   1.981  -1.822   7.372
    5    HG2  MET  85           HG2      MET  85   3.175  -1.009   9.363
    6    HG3  MET  85           HG3      MET  85   1.790  -1.424  10.374
    7    HE3  MET  85           HE1      MET  85   3.412  -3.781   7.324
    8    HE2  MET  85           HE2      MET  85   4.838  -4.067   8.318
    9    HE1  MET  85           HE3      MET  85   4.347  -2.417   7.948

  No H/Q in entry =           9
  In of MODEL   60
    1    H    LEU  86           H        LEU  86   2.216   0.318   6.098
    2    HA   LEU  86           HA       LEU  86   4.443   1.626   7.231
    3    HB2  LEU  86           HB2      LEU  86   4.223   0.555   4.920
    4    HB3  LEU  86           HB3      LEU  86   3.407   2.038   4.425
    5    HG   LEU  86           HG       LEU  86   5.446   3.282   5.385
    6   HD11  LEU  86          HD11      LEU  86   6.165   0.668   6.163
    7   HD13  LEU  86          HD12      LEU  86   7.168   2.114   6.254
    8   HD12  LEU  86          HD13      LEU  86   7.260   1.072   4.836
    9   HD23  LEU  86          HD21      LEU  86   6.134   1.532   3.017
   10   HD22  LEU  86          HD22      LEU  86   6.529   3.228   3.282
   11   HD21  LEU  86          HD23      LEU  86   4.872   2.760   2.903

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ALA  87           H        ALA  87   1.509   2.874   5.691
    2    HA   ALA  87           HA       ALA  87   2.101   5.604   5.780
    3    HB1  ALA  87           HB1      ALA  87  -0.213   3.976   5.261
    4    HB3  ALA  87           HB2      ALA  87   0.089   5.639   4.765
    5    HB2  ALA  87           HB3      ALA  87  -0.684   5.309   6.317

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ARG  88           H        ARG  88   0.445   3.589   8.182
    2    HA   ARG  88           HA       ARG  88  -0.046   5.629  10.045
    3    HB2  ARG  88           HB2      ARG  88  -0.980   3.275  10.112
    4    HB3  ARG  88           HB3      ARG  88   0.570   2.773  10.796
    5    HG2  ARG  88           HG2      ARG  88   0.112   4.839  12.432
    6    HG3  ARG  88           HG3      ARG  88  -1.560   4.514  11.996
    7    HD2  ARG  88           HD2      ARG  88  -1.648   2.659  13.235
    8    HD3  ARG  88           HD3      ARG  88  -0.065   2.082  12.680
    9    HE   ARG  88           HE       ARG  88  -0.569   3.333  15.147
   10   HH21  ARG  88          HH11      ARG  88   1.004   4.341  16.370
   11   HH22  ARG  88          HH12      ARG  88   2.513   4.773  15.648
   12   HH11  ARG  88          HH21      ARG  88   1.678   3.530  12.542
   13   HH12  ARG  88          HH22      ARG  88   2.903   4.298  13.492

  No H/Q in entry =          13
  In of MODEL   60
    1    H    GLU  89           H        GLU  89   2.751   3.415   9.775
    2    HA   GLU  89           HA       GLU  89   4.041   4.295  12.107
    3    HB2  GLU  89           HB2      GLU  89   4.686   2.284  10.745
    4    HB3  GLU  89           HB3      GLU  89   5.445   3.385   9.593
    5    HG2  GLU  89           HG2      GLU  89   6.951   4.226  11.322
    6    HG3  GLU  89           HG3      GLU  89   6.134   3.262  12.548

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LEU  90           H        LEU  90   4.313   5.469   8.780
    2    HA   LEU  90           HA       LEU  90   6.247   7.470   9.350
    3    HB2  LEU  90           HB2      LEU  90   4.213   7.145   7.147
    4    HB3  LEU  90           HB3      LEU  90   5.441   8.418   7.158
    5    HG   LEU  90           HG       LEU  90   6.125   5.481   7.470
    6   HD12  LEU  90          HD11      LEU  90   6.841   5.727   5.022
    7   HD11  LEU  90          HD12      LEU  90   5.823   7.166   4.993
    8   HD13  LEU  90          HD13      LEU  90   5.111   5.590   5.338
    9   HD22  LEU  90          HD21      LEU  90   8.029   6.632   8.133
   10   HD21  LEU  90          HD22      LEU  90   7.663   8.040   7.137
   11   HD23  LEU  90          HD23      LEU  90   8.316   6.580   6.395

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  91           H        ILE  91   2.707   7.478   9.247
    2    HA   ILE  91           HA       ILE  91   2.364  10.248   9.715
    3    HB   ILE  91           HB       ILE  91   0.586   7.866  10.269
    4   HG12  ILE  91          HG12      ILE  91   0.306  10.156   8.298
    5   HG13  ILE  91          HG13      ILE  91   1.165   8.665   7.909
    6   HG22  ILE  91          HG21      ILE  91  -1.151   9.919  10.365
    7   HG21  ILE  91          HG22      ILE  91   0.257  10.750  11.023
    8   HG23  ILE  91          HG23      ILE  91  -0.366   9.308  11.821
    9   HD13  ILE  91          HD11      ILE  91  -0.775   7.373   7.972
   10   HD12  ILE  91          HD12      ILE  91  -1.377   8.889   7.305
   11   HD11  ILE  91          HD13      ILE  91  -1.625   8.517   9.011

  No H/Q in entry =          11
  In of MODEL   60
    1    H    THR  92           H        THR  92   2.802   7.498  11.898
    2    HA   THR  92           HA       THR  92   2.386   8.859  14.334
    3    HB   THR  92           HB       THR  92   4.193   6.533  13.635
    4    HG1  THR  92           HG1      THR  92   2.225   5.770  13.556
    5   HG22  THR  92          HG21      THR  92   3.844   6.235  16.272
    6   HG21  THR  92          HG22      THR  92   3.773   7.995  16.208
    7   HG23  THR  92          HG23      THR  92   5.201   7.146  15.613

  No H/Q in entry =           7
  In of MODEL   60
    1    H    GLU  93           H        GLU  93   5.314   8.428  12.361
    2    HA   GLU  93           HA       GLU  93   7.085   9.853  14.042
    3    HB2  GLU  93           HB2      GLU  93   7.136   9.552  11.024
    4    HB3  GLU  93           HB3      GLU  93   8.487  10.081  12.024
    5    HG2  GLU  93           HG2      GLU  93   7.092   7.439  12.478
    6    HG3  GLU  93           HG3      GLU  93   8.461   7.600  11.385

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LEU  94           H        LEU  94   4.998  10.873  11.360
    2    HA   LEU  94           HA       LEU  94   5.793  13.580  11.261
    3    HB2  LEU  94           HB2      LEU  94   3.198  12.209  10.534
    4    HB3  LEU  94           HB3      LEU  94   3.447  13.938  10.297
    5    HG   LEU  94           HG       LEU  94   5.458  11.962   9.213
    6   HD11  LEU  94          HD11      LEU  94   2.701  12.507   8.187
    7   HD13  LEU  94          HD12      LEU  94   3.688  11.055   8.043
    8   HD12  LEU  94          HD13      LEU  94   4.005  12.441   7.000
    9   HD23  LEU  94          HD21      LEU  94   5.680  13.807   7.495
   10   HD22  LEU  94          HD22      LEU  94   6.113  14.294   9.134
   11   HD21  LEU  94          HD23      LEU  94   4.552  14.759   8.457

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  95           H        ILE  95   3.285  11.945  13.177
    2    HA   ILE  95           HA       ILE  95   2.248  14.286  14.395
    3    HB   ILE  95           HB       ILE  95   2.288  11.400  15.307
    4   HG12  ILE  95          HG12      ILE  95   0.048  13.169  14.293
    5   HG13  ILE  95          HG13      ILE  95   0.995  12.118  13.245
    6   HG21  ILE  95          HG21      ILE  95   1.011  13.862  16.535
    7   HG23  ILE  95          HG22      ILE  95   2.074  12.694  17.321
    8   HG22  ILE  95          HG23      ILE  95   0.435  12.229  16.865
    9   HD13  ILE  95          HD11      ILE  95   0.112  10.172  14.167
   10   HD12  ILE  95          HD12      ILE  95  -1.274  11.255  14.265
   11   HD11  ILE  95          HD13      ILE  95  -0.289  10.955  15.696

  No H/Q in entry =          11
  In of MODEL   60
    1    H    GLU  96           H        GLU  96   4.865  12.074  15.348
    2    HA   GLU  96           HA       GLU  96   5.446  13.264  17.838
    3    HB2  GLU  96           HB2      GLU  96   6.395  11.112  17.170
    4    HB3  GLU  96           HB3      GLU  96   7.309  11.895  15.882
    5    HG2  GLU  96           HG2      GLU  96   8.973  12.445  17.326
    6    HG3  GLU  96           HG3      GLU  96   7.836  13.248  18.399

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LEU  97           H        LEU  97   6.476  14.055  14.543
    2    HA   LEU  97           HA       LEU  97   8.361  16.057  15.240
    3    HB2  LEU  97           HB2      LEU  97   6.741  15.511  12.762
    4    HB3  LEU  97           HB3      LEU  97   7.756  16.947  12.877
    5    HG   LEU  97           HG       LEU  97   8.805  14.152  13.412
    6   HD12  LEU  97          HD11      LEU  97   9.772  14.360  11.084
    7   HD11  LEU  97          HD12      LEU  97   8.710  15.747  10.839
    8   HD13  LEU  97          HD13      LEU  97   8.023  14.150  11.136
    9   HD23  LEU  97          HD21      LEU  97  10.958  15.444  12.648
   10   HD22  LEU  97          HD22      LEU  97  10.358  15.704  14.286
   11   HD21  LEU  97          HD23      LEU  97  10.023  16.891  13.027

  No H/Q in entry =          11
  In of MODEL   60
    1    H    HIS  98           H        HIS  98   4.861  16.178  14.629
    2    HA   HIS  98           HA       HIS  98   4.550  18.975  14.780
    3    HB2  HIS  98           HB2      HIS  98   2.680  16.712  15.520
    4    HB3  HIS  98           HB3      HIS  98   2.205  18.410  15.588
    5    HD1  HIS  98           HD1      HIS  98   3.211  15.710  13.160
    6    HD2  HIS  98           HD2      HIS  98   1.813  19.637  13.071
    7    HE1  HIS  98           HE1      HIS  98   2.619  16.206  10.745
    8    HE2  HIS  98           HE2      HIS  98   1.771  18.592  10.670

  No H/Q in entry =           8
  In of MODEL   60
    1    H    GLU  99           H        GLU  99   4.727  16.477  17.266
    2    HA   GLU  99           HA       GLU  99   4.137  18.159  19.479
    3    HB2  GLU  99           HB2      GLU  99   4.062  15.676  19.566
    4    HB3  GLU  99           HB3      GLU  99   5.821  15.641  19.436
    5    HG2  GLU  99           HG2      GLU  99   6.028  16.925  21.513
    6    HG3  GLU  99           HG3      GLU  99   4.277  17.056  21.631

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LYS 100           H        LYS 100   7.176  17.251  17.873
    2    HA   LYS 100           HA       LYS 100   8.847  18.652  19.715
    3    HB2  LYS 100           HB2      LYS 100   9.315  17.742  16.866
    4    HB3  LYS 100           HB3      LYS 100  10.553  18.514  17.862
    5    HG2  LYS 100           HG2      LYS 100  10.207  16.754  19.600
    6    HG3  LYS 100           HG3      LYS 100   9.066  15.949  18.520
    7    HD2  LYS 100           HD2      LYS 100  10.841  15.683  16.829
    8    HD3  LYS 100           HD3      LYS 100  11.987  16.500  17.895
    9    HE2  LYS 100           HE2      LYS 100  11.621  14.735  19.610
   10    HE3  LYS 100           HE3      LYS 100  10.536  13.899  18.494
   11    HZ1  LYS 100           HZ1      LYS 100  13.345  14.586  17.807
   12    HZ3  LYS 100           HZ2      LYS 100  12.296  13.529  16.987
   13    HZ2  LYS 100           HZ3      LYS 100  12.906  13.106  18.517

  No H/Q in entry =          13
  In of MODEL   60
    1    H    LEU 101           H        LEU 101   7.112  19.583  16.784
    2    HA   LEU 101           HA       LEU 101   8.308  22.147  16.445
    3    HB2  LEU 101           HB2      LEU 101   5.709  20.904  15.585
    4    HB3  LEU 101           HB3      LEU 101   5.948  22.637  15.383
    5    HG   LEU 101           HG       LEU 101   7.982  20.636  14.383
    6   HD12  LEU 101          HD11      LEU 101   6.798  21.146  12.115
    7   HD11  LEU 101          HD12      LEU 101   5.409  21.564  13.114
    8   HD13  LEU 101          HD13      LEU 101   6.082  19.937  13.181
    9   HD21  LEU 101          HD21      LEU 101   7.333  23.547  13.848
   10   HD23  LEU 101          HD22      LEU 101   8.305  22.597  12.725
   11   HD22  LEU 101          HD23      LEU 101   8.866  22.850  14.377

  No H/Q in entry =          11
  In of MODEL   60
    1    H    LYS 102           H        LYS 102   6.810  20.990  19.075
    2    HA   LYS 102           HA       LYS 102   6.196  22.070  21.020
    3    HB2  LYS 102           HB2      LYS 102   7.455  24.072  19.888
    4    HB3  LYS 102           HB3      LYS 102   5.848  24.670  19.535
    5    HG2  LYS 102           HG2      LYS 102   7.260  24.410  22.169
    6    HG3  LYS 102           HG3      LYS 102   6.293  25.736  21.557
    7    HD2  LYS 102           HD2      LYS 102   5.073  23.090  22.440
    8    HD3  LYS 102           HD3      LYS 102   5.328  24.448  23.526
    9    HE2  LYS 102           HE2      LYS 102   3.033  24.040  22.064
   10    HE3  LYS 102           HE3      LYS 102   3.536  25.585  22.747
   11    HZ2  LYS 102           HZ1      LYS 102   2.976  25.701  20.374
   12    HZ1  LYS 102           HZ2      LYS 102   4.238  24.627  20.031
   13    HZ3  LYS 102           HZ3      LYS 102   4.582  26.156  20.676

  No H/Q in entry =          13
  In of MODEL   60
    1    H    ALA 103           H        ALA 103   4.516  23.618  18.280
    2    HA   ALA 103           HA       ALA 103   2.071  24.178  19.198
    3    HB1  ALA 103           HB1      ALA 103   1.148  23.342  16.963
    4    HB2  ALA 103           HB2      ALA 103   2.794  22.815  16.610
    5    HB3  ALA 103           HB3      ALA 103   2.455  24.524  16.889

  No H/Q in entry =           5
  In of MODEL   60
    1    H1   ALA   1           H3       ALA   1  10.562 -20.168  -6.381
    2    H2   ALA   1           H2       ALA   1   9.581 -20.372  -7.756
    3    H3   ALA   1           H1       ALA   1   9.165 -21.127  -6.290
    4    HA   ALA   1           HA       ALA   1  10.203 -22.928  -7.051
    5    HB1  ALA   1           HB1      ALA   1  10.268 -22.558  -9.326
    6    HB2  ALA   1           HB2      ALA   1  11.999 -22.402  -9.018
    7    HB3  ALA   1           HB3      ALA   1  10.993 -20.959  -9.150

  No H/Q in entry =           7
  In of MODEL   60
    1    H    GLU   2           H        GLU   2  12.489 -23.869  -7.142
    2    HA   GLU   2           HA       GLU   2  13.899 -23.792  -4.948
    3    HB2  GLU   2           HB2      GLU   2  15.220 -23.643  -7.663
    4    HB3  GLU   2           HB3      GLU   2  15.969 -24.258  -6.190
    5    HG2  GLU   2           HG2      GLU   2  14.957 -26.277  -6.428
    6    HG3  GLU   2           HG3      GLU   2  13.380 -25.537  -6.663

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLU   3           H        GLU   3  15.632 -21.909  -7.363
    2    HA   GLU   3           HA       GLU   3  16.803 -20.227  -5.411
    3    HB2  GLU   3           HB2      GLU   3  16.709 -20.211  -8.420
    4    HB3  GLU   3           HB3      GLU   3  17.461 -18.883  -7.536
    5    HG2  GLU   3           HG2      GLU   3  19.140 -20.255  -6.641
    6    HG3  GLU   3           HG3      GLU   3  18.197 -21.725  -6.856

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LEU   4           H        LEU   4  14.484 -19.376  -8.008
    2    HA   LEU   4           HA       LEU   4  14.016 -16.772  -7.379
    3    HB2  LEU   4           HB2      LEU   4  11.839 -18.751  -8.090
    4    HB3  LEU   4           HB3      LEU   4  11.755 -17.002  -8.280
    5    HG   LEU   4           HG       LEU   4  13.709 -18.851  -9.686
    6   HD13  LEU   4          HD11      LEU   4  12.382 -18.699 -11.579
    7   HD12  LEU   4          HD12      LEU   4  11.674 -17.159 -11.096
    8   HD11  LEU   4          HD13      LEU   4  11.136 -18.655 -10.334
    9   HD23  LEU   4          HD21      LEU   4  14.019 -16.599 -11.032
   10   HD22  LEU   4          HD22      LEU   4  14.900 -16.845  -9.525
   11   HD21  LEU   4          HD23      LEU   4  13.443 -15.854  -9.541

  No H/Q in entry =          11
  In of MODEL   60
    1    H    GLU   5           H        GLU   5  12.563 -19.568  -5.731
    2    HA   GLU   5           HA       GLU   5  10.902 -18.011  -3.999
    3    HB2  GLU   5           HB2      GLU   5  10.479 -20.390  -4.526
    4    HB3  GLU   5           HB3      GLU   5  11.926 -20.824  -3.614
    5    HG2  GLU   5           HG2      GLU   5  10.979 -19.811  -1.590
    6    HG3  GLU   5           HG3      GLU   5   9.544 -19.326  -2.493

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLU   6           H        GLU   6  14.059 -19.581  -3.604
    2    HA   GLU   6           HA       GLU   6  14.443 -18.735  -0.907
    3    HB2  GLU   6           HB2      GLU   6  16.377 -19.658  -3.044
    4    HB3  GLU   6           HB3      GLU   6  16.851 -19.316  -1.379
    5    HG2  GLU   6           HG2      GLU   6  15.317 -21.016  -0.548
    6    HG3  GLU   6           HG3      GLU   6  14.707 -21.305  -2.177

  No H/Q in entry =           6
  In of MODEL   60
    1    H    VAL   7           H        VAL   7  15.163 -17.391  -4.060
    2    HA   VAL   7           HA       VAL   7  16.851 -15.261  -3.207
    3    HB   VAL   7           HB       VAL   7  15.115 -15.621  -5.664
    4   HG11  VAL   7          HG11      VAL   7  17.010 -13.404  -4.866
    5   HG13  VAL   7          HG12      VAL   7  15.359 -13.265  -5.468
    6   HG12  VAL   7          HG13      VAL   7  16.657 -13.757  -6.557
    7   HG21  VAL   7          HG21      VAL   7  17.236 -17.071  -5.129
    8   HG23  VAL   7          HG22      VAL   7  18.129 -15.604  -5.532
    9   HG22  VAL   7          HG23      VAL   7  17.081 -16.353  -6.733

  No H/Q in entry =           9
  In of MODEL   60
    1    H    VAL   8           H        VAL   8  13.353 -15.544  -3.720
    2    HA   VAL   8           HA       VAL   8  12.682 -12.841  -3.228
    3    HB   VAL   8           HB       VAL   8  11.115 -15.402  -2.854
    4   HG11  VAL   8          HG11      VAL   8  10.363 -12.523  -2.361
    5   HG13  VAL   8          HG12      VAL   8  10.043 -13.935  -1.354
    6   HG12  VAL   8          HG13      VAL   8   9.144 -13.698  -2.852
    7   HG22  VAL   8          HG21      VAL   8  10.209 -14.961  -4.988
    8   HG21  VAL   8          HG22      VAL   8  11.860 -14.380  -5.185
    9   HG23  VAL   8          HG23      VAL   8  10.556 -13.235  -4.887

  No H/Q in entry =           9
  In of MODEL   60
    1    H    MET   9           H        MET   9  12.989 -15.655  -1.064
    2    HA   MET   9           HA       MET   9  12.199 -14.398   1.322
    3    HB2  MET   9           HB2      MET   9  14.074 -16.677   0.723
    4    HB3  MET   9           HB3      MET   9  13.868 -16.088   2.373
    5    HG2  MET   9           HG2      MET   9  11.334 -16.332   1.948
    6    HG3  MET   9           HG3      MET   9  11.795 -17.301   0.547
    7    HE1  MET   9           HE1      MET   9  12.750 -19.357   0.437
    8    HE3  MET   9           HE2      MET   9  13.225 -20.458   1.728
    9    HE2  MET   9           HE3      MET   9  14.267 -19.102   1.308

  No H/Q in entry =           9
  In of MODEL   60
    1    H    GLY  10           H        GLY  10  15.361 -14.600  -0.276
    2    HA3  GLY  10           HA2      GLY  10  16.838 -13.181   1.681
    3    HA2  GLY  10           HA3      GLY  10  17.280 -13.336  -0.018

  No H/Q in entry =           3
  In of MODEL   60
    1    H    LEU  11           H        LEU  11  15.090 -12.120  -1.224
    2    HA   LEU  11           HA       LEU  11  15.762  -9.373  -1.057
    3    HB2  LEU  11           HB2      LEU  11  13.387 -10.789  -2.269
    4    HB3  LEU  11           HB3      LEU  11  13.656  -9.053  -2.424
    5    HG   LEU  11           HG       LEU  11  15.684 -11.147  -3.247
    6   HD13  LEU  11          HD11      LEU  11  13.921 -11.516  -4.746
    7   HD12  LEU  11          HD12      LEU  11  14.907 -10.326  -5.594
    8   HD11  LEU  11          HD13      LEU  11  13.441  -9.819  -4.755
    9   HD22  LEU  11          HD21      LEU  11  16.908  -9.178  -3.028
   10   HD21  LEU  11          HD22      LEU  11  15.523  -8.147  -3.385
   11   HD23  LEU  11          HD23      LEU  11  16.342  -9.005  -4.688

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  12           H        ILE  12  13.020 -11.219   0.237
    2    HA   ILE  12           HA       ILE  12  11.628  -9.008   1.324
    3    HB   ILE  12           HB       ILE  12  11.693 -11.895   2.260
    4   HG12  ILE  12          HG12      ILE  12  10.973 -11.257  -0.176
    5   HG13  ILE  12          HG13      ILE  12   9.962 -12.353   0.744
    6   HG22  ILE  12          HG21      ILE  12   9.422 -11.328   3.208
    7   HG21  ILE  12          HG22      ILE  12   9.757  -9.633   2.858
    8   HG23  ILE  12          HG23      ILE  12  10.761 -10.511   4.012
    9   HD12  ILE  12          HD11      ILE  12   8.699 -10.563  -0.467
   10   HD11  ILE  12          HD12      ILE  12   9.524  -9.365   0.528
   11   HD13  ILE  12          HD13      ILE  12   8.448 -10.530   1.269

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  13           H        ILE  13  14.052 -11.205   2.689
    2    HA   ILE  13           HA       ILE  13  14.113 -10.037   5.274
    3    HB   ILE  13           HB       ILE  13  16.168 -11.585   3.677
    4   HG12  ILE  13          HG12      ILE  13  13.926 -12.603   4.488
    5   HG13  ILE  13          HG13      ILE  13  15.411 -13.490   4.822
    6   HG22  ILE  13          HG21      ILE  13  17.131 -11.956   6.096
    7   HG21  ILE  13          HG22      ILE  13  16.334 -10.430   6.455
    8   HG23  ILE  13          HG23      ILE  13  17.575 -10.502   5.203
    9   HD11  ILE  13          HD11      ILE  13  14.599 -11.534   6.913
   10   HD13  ILE  13          HD12      ILE  13  15.253 -13.160   7.076
   11   HD12  ILE  13          HD13      ILE  13  13.546 -12.934   6.717

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ASN  14           H        ASN  14  16.026  -9.480   2.334
    2    HA   ASN  14           HA       ASN  14  17.770  -7.531   3.382
    3    HB2  ASN  14           HB2      ASN  14  17.727  -8.787   1.061
    4    HB3  ASN  14           HB3      ASN  14  16.817  -7.374   0.542
    5   HD21  ASN  14          HD21      ASN  14  19.245  -7.690  -0.676
    6   HD22  ASN  14          HD22      ASN  14  20.388  -6.602  -0.058

  No H/Q in entry =           6
  In of MODEL   60
    1    H    SER  15           H        SER  15  14.635  -7.199   1.731
    2    HA   SER  15           HA       SER  15  14.503  -4.380   1.802
    3    HB2  SER  15           HB2      SER  15  12.166  -4.643   1.335
    4    HB3  SER  15           HB3      SER  15  12.964  -5.997   0.547
    5    HG   SER  15           HG       SER  15  12.076  -7.335   1.921

  No H/Q in entry =           5
  In of MODEL   60
    1    H    GLY  16           H        GLY  16  13.457  -6.858   4.107
    2    HA3  GLY  16           HA2      GLY  16  12.246  -5.128   5.988
    3    HA2  GLY  16           HA3      GLY  16  12.877  -6.733   6.335

  No H/Q in entry =           3
  In of MODEL   60
    1    H    GLN  17           H        GLN  17  15.578  -6.375   5.710
    2    HA   GLN  17           HA       GLN  17  16.555  -5.157   8.084
    3    HB2  GLN  17           HB2      GLN  17  17.946  -5.992   5.526
    4    HB3  GLN  17           HB3      GLN  17  18.808  -5.381   6.938
    5    HG2  GLN  17           HG2      GLN  17  17.913  -7.188   8.314
    6    HG3  GLN  17           HG3      GLN  17  16.947  -7.774   6.961
    7   HE21  GLN  17          HE21      GLN  17  19.274  -9.070   8.488
    8   HE22  GLN  17          HE22      GLN  17  20.370  -9.513   7.270

  No H/Q in entry =           8
  In of MODEL   60
    1    H    ALA  18           H        ALA  18  16.316  -4.066   4.732
    2    HA   ALA  18           HA       ALA  18  17.734  -1.663   4.952
    3    HB2  ALA  18           HB1      ALA  18  16.601  -2.878   2.893
    4    HB3  ALA  18           HB2      ALA  18  16.851  -1.132   2.882
    5    HB1  ALA  18           HB3      ALA  18  15.262  -1.793   3.269

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ARG  19           H        ARG  19  14.245  -2.282   5.389
    2    HA   ARG  19           HA       ARG  19  13.563   0.359   6.125
    3    HB2  ARG  19           HB2      ARG  19  11.890  -1.404   5.551
    4    HB3  ARG  19           HB3      ARG  19  12.257  -2.206   7.080
    5    HG2  ARG  19           HG2      ARG  19  11.546  -0.226   8.337
    6    HG3  ARG  19           HG3      ARG  19  11.270   0.655   6.836
    7    HD2  ARG  19           HD2      ARG  19   9.145  -0.163   7.678
    8    HD3  ARG  19           HD3      ARG  19   9.553  -1.032   6.193
    9    HE   ARG  19           HE       ARG  19  10.551  -2.576   8.279
   10   HH21  ARG  19          HH11      ARG  19   9.327  -4.231   9.226
   11   HH22  ARG  19          HH12      ARG  19   7.605  -4.217   9.076
   12   HH11  ARG  19          HH21      ARG  19   7.532  -1.304   7.227
   13   HH12  ARG  19          HH22      ARG  19   6.589  -2.560   7.940

  No H/Q in entry =          13
  In of MODEL   60
    1    H    SER  20           H        SER  20  14.469  -2.472   8.060
    2    HA   SER  20           HA       SER  20  14.208  -1.387  10.606
    3    HB2  SER  20           HB2      SER  20  14.692  -3.706  10.471
    4    HB3  SER  20           HB3      SER  20  16.127  -3.429   9.488
    5    HG   SER  20           HG       SER  20  16.372  -2.044  11.740

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LEU  21           H        LEU  21  17.024  -1.291   8.435
    2    HA   LEU  21           HA       LEU  21  18.707   0.201  10.160
    3    HB2  LEU  21           HB2      LEU  21  18.640  -0.208   7.174
    4    HB3  LEU  21           HB3      LEU  21  19.813   0.873   7.922
    5    HG   LEU  21           HG       LEU  21  19.445  -2.027   8.731
    6   HD13  LEU  21          HD11      LEU  21  21.428  -2.513   7.410
    7   HD12  LEU  21          HD12      LEU  21  21.594  -0.814   6.967
    8   HD11  LEU  21          HD13      LEU  21  20.226  -1.751   6.367
    9   HD21  LEU  21          HD21      LEU  21  21.260   0.209   9.564
   10   HD23  LEU  21          HD22      LEU  21  21.953  -1.407   9.502
   11   HD22  LEU  21          HD23      LEU  21  20.577  -1.084  10.544

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ALA  22           H        ALA  22  16.404   1.162   7.636
    2    HA   ALA  22           HA       ALA  22  16.920   3.925   7.656
    3    HB3  ALA  22           HB1      ALA  22  15.507   2.679   5.989
    4    HB2  ALA  22           HB2      ALA  22  14.795   4.183   6.572
    5    HB1  ALA  22           HB3      ALA  22  14.225   2.636   7.199

  No H/Q in entry =           5
  In of MODEL   60
    1    H    TYR  23           H        TYR  23  14.461   2.080   9.513
    2    HA   TYR  23           HA       TYR  23  13.497   4.302  10.984
    3    HB2  TYR  23           HB2      TYR  23  12.277   2.182  10.970
    4    HB3  TYR  23           HB3      TYR  23  13.627   1.374  11.770
    5    HD1  TYR  23           HD1      TYR  23  11.128   4.118  12.191
    6    HD2  TYR  23           HD2      TYR  23  13.838   1.401  14.122
    7    HE1  TYR  23           HE1      TYR  23  10.227   4.790  14.403
    8    HE2  TYR  23           HE2      TYR  23  12.937   2.073  16.333
    9    HH   TYR  23           HH       TYR  23  11.025   3.075  17.310

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ALA  24           H        ALA  24  16.168   2.046  11.579
    2    HA   ALA  24           HA       ALA  24  16.862   3.035  14.138
    3    HB1  ALA  24           HB1      ALA  24  18.230   1.253  13.949
    4    HB3  ALA  24           HB2      ALA  24  19.237   2.188  12.842
    5    HB2  ALA  24           HB3      ALA  24  17.943   1.172  12.212

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ALA  25           H        ALA  25  17.771   3.986  10.853
    2    HA   ALA  25           HA       ALA  25  19.709   5.933  11.484
    3    HB1  ALA  25           HB1      ALA  25  18.972   4.990   9.173
    4    HB3  ALA  25           HB2      ALA  25  19.462   6.681   9.268
    5    HB2  ALA  25           HB3      ALA  25  17.749   6.261   9.217

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LEU  26           H        LEU  26  16.189   6.136  11.166
    2    HA   LEU  26           HA       LEU  26  15.949   8.914  11.633
    3    HB2  LEU  26           HB2      LEU  26  14.085   7.669  10.722
    4    HB3  LEU  26           HB3      LEU  26  14.020   6.634  12.143
    5    HG   LEU  26           HG       LEU  26  13.416   8.580  13.540
    6   HD12  LEU  26          HD11      LEU  26  12.723  10.682  12.232
    7   HD11  LEU  26          HD12      LEU  26  13.693  10.043  10.908
    8   HD13  LEU  26          HD13      LEU  26  14.453  10.426  12.453
    9   HD21  LEU  26          HD21      LEU  26  11.712   8.266  11.049
   10   HD23  LEU  26          HD22      LEU  26  11.165   8.953  12.575
   11   HD22  LEU  26          HD23      LEU  26  11.629   7.255  12.492

  No H/Q in entry =          11
  In of MODEL   60
    1    H    LYS  27           H        LYS  27  15.887   6.124  13.814
    2    HA   LYS  27           HA       LYS  27  15.314   7.475  16.195
    3    HB2  LYS  27           HB2      LYS  27  15.356   5.001  15.918
    4    HB3  LYS  27           HB3      LYS  27  17.119   5.066  15.854
    5    HG2  LYS  27           HG2      LYS  27  17.189   6.042  18.108
    6    HG3  LYS  27           HG3      LYS  27  15.423   6.047  18.174
    7    HD2  LYS  27           HD2      LYS  27  15.411   3.581  17.926
    8    HD3  LYS  27           HD3      LYS  27  17.176   3.583  17.894
    9    HE2  LYS  27           HE2      LYS  27  17.231   4.562  20.154
   10    HE3  LYS  27           HE3      LYS  27  15.465   4.590  20.190
   11    HZ3  LYS  27           HZ1      LYS  27  16.280   2.638  21.322
   12    HZ2  LYS  27           HZ2      LYS  27  17.183   2.171  19.958
   13    HZ1  LYS  27           HZ3      LYS  27  15.484   2.165  19.899

  No H/Q in entry =          13
  In of MODEL   60
    1    H    GLN  28           H        GLN  28  18.415   6.921  14.563
    2    HA   GLN  28           HA       GLN  28  20.115   8.006  16.538
    3    HB2  GLN  28           HB2      GLN  28  20.367   7.977  13.519
    4    HB3  GLN  28           HB3      GLN  28  21.664   8.451  14.616
    5    HG2  GLN  28           HG2      GLN  28  20.263   5.763  14.653
    6    HG3  GLN  28           HG3      GLN  28  21.839   6.067  13.928
    7   HE21  GLN  28          HE21      GLN  28  20.556   4.759  16.646
    8   HE22  GLN  28          HE22      GLN  28  21.759   5.166  17.772

  No H/Q in entry =           8
  In of MODEL   60
    1    H    ALA  29           H        ALA  29  18.322   9.490  13.874
    2    HA   ALA  29           HA       ALA  29  19.308  12.116  14.128
    3    HB2  ALA  29           HB1      ALA  29  17.588  12.749  12.680
    4    HB1  ALA  29           HB2      ALA  29  16.459  11.566  13.339
    5    HB3  ALA  29           HB3      ALA  29  17.780  11.036  12.298

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LYS  30           H        LYS  30  16.559  10.493  15.675
    2    HA   LYS  30           HA       LYS  30  15.549  12.734  17.055
    3    HB2  LYS  30           HB2      LYS  30  15.462   9.789  17.746
    4    HB3  LYS  30           HB3      LYS  30  14.600  11.030  18.656
    5    HG2  LYS  30           HG2      LYS  30  13.446  11.720  16.554
    6    HG3  LYS  30           HG3      LYS  30  14.248  10.392  15.711
    7    HD2  LYS  30           HD2      LYS  30  13.203   8.772  17.245
    8    HD3  LYS  30           HD3      LYS  30  12.412  10.088  18.112
    9    HE2  LYS  30           HE2      LYS  30  11.215  10.725  16.037
   10    HE3  LYS  30           HE3      LYS  30  11.987   9.379  15.190
   11    HZ2  LYS  30           HZ1      LYS  30   9.692   8.953  16.096
   12    HZ1  LYS  30           HZ2      LYS  30  10.378   9.002  17.655
   13    HZ3  LYS  30           HZ3      LYS  30  10.879   7.825  16.533

  No H/Q in entry =          13
  In of MODEL   60
    1    H    GLN  31           H        GLN  31  18.230  10.575  17.749
    2    HA   GLN  31           HA       GLN  31  18.585  11.579  20.444
    3    HB2  GLN  31           HB2      GLN  31  20.596  10.026  18.807
    4    HB3  GLN  31           HB3      GLN  31  20.483  10.142  20.564
    5    HG2  GLN  31           HG2      GLN  31  17.965   9.180  19.821
    6    HG3  GLN  31           HG3      GLN  31  19.058   8.346  18.723
    7   HE21  GLN  31          HE21      GLN  31  17.549   7.181  21.013
    8   HE22  GLN  31          HE22      GLN  31  18.721   6.522  22.046

  No H/Q in entry =           8
  In of MODEL   60
    1    H    GLY  32           H        GLY  32  19.061  12.913  17.478
    2    HA3  GLY  32           HA2      GLY  32  20.028  14.966  16.961
    3    HA2  GLY  32           HA3      GLY  32  20.805  14.967  18.540

  No H/Q in entry =           3
  In of MODEL   60
    1    H    ASP  33           H        ASP  33  21.220  12.085  16.744
    2    HA   ASP  33           HA       ASP  33  24.036  12.778  16.247
    3    HB2  ASP  33           HB2      ASP  33  22.543  10.153  16.369
    4    HB3  ASP  33           HB3      ASP  33  24.223  10.281  15.854

  No H/Q in entry =           4
  In of MODEL   60
    1    H    PHE  34           H        PHE  34  23.525  14.107  14.378
    2    HA   PHE  34           HA       PHE  34  22.153  13.127  12.102
    3    HB2  PHE  34           HB2      PHE  34  24.276  15.271  12.317
    4    HB3  PHE  34           HB3      PHE  34  23.274  14.982  10.896
    5    HD1  PHE  34           HD1      PHE  34  23.551  16.904  13.815
    6    HD2  PHE  34           HD2      PHE  34  20.656  14.784  11.454
    7    HE1  PHE  34           HE1      PHE  34  21.738  18.287  14.791
    8    HE2  PHE  34           HE2      PHE  34  18.847  16.167  12.433
    9    HZ   PHE  34           HZ       PHE  34  19.392  17.919  14.097

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ALA  35           H        ALA  35  25.541  12.953  13.068
    2    HA   ALA  35           HA       ALA  35  26.621  12.150  10.594
    3    HB3  ALA  35           HB1      ALA  35  28.329  10.982  12.287
    4    HB2  ALA  35           HB2      ALA  35  27.473  11.997  13.448
    5    HB1  ALA  35           HB3      ALA  35  28.289  12.731  12.069

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ALA  36           H        ALA  36  25.550  10.174  13.363
    2    HA   ALA  36           HA       ALA  36  26.033   7.696  12.070
    3    HB2  ALA  36           HB1      ALA  36  25.632   6.937  14.147
    4    HB3  ALA  36           HB2      ALA  36  23.940   7.423  14.020
    5    HB1  ALA  36           HB3      ALA  36  25.141   8.558  14.633

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ALA  37           H        ALA  37  23.201   9.804  12.248
    2    HA   ALA  37           HA       ALA  37  21.341   8.029  11.087
    3    HB3  ALA  37           HB1      ALA  37  21.552  10.992  11.390
    4    HB1  ALA  37           HB2      ALA  37  20.253   9.903  11.874
    5    HB2  ALA  37           HB3      ALA  37  20.418  10.384  10.184

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LYS  38           H        LYS  38  23.407  10.510   9.594
    2    HA   LYS  38           HA       LYS  38  22.737  10.091   6.923
    3    HB2  LYS  38           HB2      LYS  38  24.555  11.653   8.353
    4    HB3  LYS  38           HB3      LYS  38  25.581  10.675   7.310
    5    HG2  LYS  38           HG2      LYS  38  24.387  11.448   5.332
    6    HG3  LYS  38           HG3      LYS  38  23.199  12.290   6.332
    7    HD2  LYS  38           HD2      LYS  38  24.793  13.895   7.072
    8    HD3  LYS  38           HD3      LYS  38  26.153  12.921   6.516
    9    HE2  LYS  38           HE2      LYS  38  25.765  14.797   4.978
   10    HE3  LYS  38           HE3      LYS  38  25.430  13.261   4.170
   11    HZ3  LYS  38           HZ1      LYS  38  23.229  13.691   4.069
   12    HZ2  LYS  38           HZ2      LYS  38  23.742  15.310   4.158
   13    HZ1  LYS  38           HZ3      LYS  38  23.190  14.515   5.553

  No H/Q in entry =          13
  In of MODEL   60
    1    H    ALA  39           H        ALA  39  25.286   8.501   8.840
    2    HA   ALA  39           HA       ALA  39  26.340   6.930   6.750
    3    HB2  ALA  39           HB1      ALA  39  26.293   5.952   9.590
    4    HB1  ALA  39           HB2      ALA  39  27.231   7.386   9.169
    5    HB3  ALA  39           HB3      ALA  39  27.584   5.842   8.394

  No H/Q in entry =           5
  In of MODEL   60
    1    H    MET  40           H        MET  40  23.760   6.285   9.077
    2    HA   MET  40           HA       MET  40  23.327   3.580   8.335
    3    HB2  MET  40           HB2      MET  40  21.512   5.605   9.659
    4    HB3  MET  40           HB3      MET  40  21.116   3.893   9.481
    5    HG2  MET  40           HG2      MET  40  23.675   4.847  10.796
    6    HG3  MET  40           HG3      MET  40  22.193   4.556  11.706
    7    HE3  MET  40           HE1      MET  40  21.658   0.917  11.870
    8    HE2  MET  40           HE2      MET  40  20.770   2.218  11.080
    9    HE1  MET  40           HE3      MET  40  21.528   2.503  12.645

  No H/Q in entry =           9
  In of MODEL   60
    1    H    MET  41           H        MET  41  21.877   6.629   7.180
    2    HA   MET  41           HA       MET  41  19.908   5.427   5.526
    3    HB2  MET  41           HB2      MET  41  21.364   8.031   5.008
    4    HB3  MET  41           HB3      MET  41  19.831   7.529   4.305
    5    HG2  MET  41           HG2      MET  41  19.118   7.323   6.865
    6    HG3  MET  41           HG3      MET  41  20.421   8.489   7.076
    7    HE2  MET  41           HE1      MET  41  19.807   9.789   3.753
    8    HE1  MET  41           HE2      MET  41  20.778  10.229   5.155
    9    HE3  MET  41           HE3      MET  41  19.490  11.301   4.612

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ASP  42           H        ASP  42  23.267   6.378   4.936
    2    HA   ASP  42           HA       ASP  42  23.328   5.918   2.176
    3    HB2  ASP  42           HB2      ASP  42  25.093   6.920   3.928
    4    HB3  ASP  42           HB3      ASP  42  25.761   5.300   3.785

  No H/Q in entry =           4
  In of MODEL   60
    1    H    GLN  43           H        GLN  43  24.102   3.756   4.877
    2    HA   GLN  43           HA       GLN  43  24.764   1.511   3.275
    3    HB2  GLN  43           HB2      GLN  43  23.775   1.673   6.132
    4    HB3  GLN  43           HB3      GLN  43  24.356   0.192   5.362
    5    HG2  GLN  43           HG2      GLN  43  26.504   1.422   4.831
    6    HG3  GLN  43           HG3      GLN  43  25.923   2.740   5.844
    7   HE21  GLN  43          HE21      GLN  43  28.176   1.779   6.848
    8   HE22  GLN  43          HE22      GLN  43  27.926   0.688   8.122

  No H/Q in entry =           8
  In of MODEL   60
    1    H    SER  44           H        SER  44  21.717   2.615   4.703
    2    HA   SER  44           HA       SER  44  20.157   0.363   4.039
    3    HB2  SER  44           HB2      SER  44  19.710   2.882   5.202
    4    HB3  SER  44           HB3      SER  44  18.659   2.838   3.789
    5    HG   SER  44           HG       SER  44  17.594   1.879   5.521

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ARG  45           H        ARG  45  20.855   3.341   2.239
    2    HA   ARG  45           HA       ARG  45  19.305   2.855  -0.049
    3    HB2  ARG  45           HB2      ARG  45  20.440   4.997   0.532
    4    HB3  ARG  45           HB3      ARG  45  21.985   4.256   0.123
    5    HG2  ARG  45           HG2      ARG  45  21.176   3.855  -2.183
    6    HG3  ARG  45           HG3      ARG  45  19.643   4.620  -1.774
    7    HD2  ARG  45           HD2      ARG  45  20.885   6.723  -1.195
    8    HD3  ARG  45           HD3      ARG  45  22.380   5.963  -1.786
    9    HE   ARG  45           HE       ARG  45  20.426   5.721  -3.799
   10   HH21  ARG  45          HH11      ARG  45  20.387   7.098  -5.555
   11   HH22  ARG  45          HH12      ARG  45  21.134   8.653  -5.453
   12   HH11  ARG  45          HH21      ARG  45  22.158   8.224  -2.181
   13   HH12  ARG  45          HH22      ARG  45  22.136   9.290  -3.540

  No H/Q in entry =          13
  In of MODEL   60
    1    H    MET  46           H        MET  46  22.685   2.001   0.652
    2    HA   MET  46           HA       MET  46  23.268   0.825  -1.845
    3    HB2  MET  46           HB2      MET  46  24.412   0.480   0.928
    4    HB3  MET  46           HB3      MET  46  25.063  -0.382  -0.470
    5    HG2  MET  46           HG2      MET  46  25.440   1.763  -1.626
    6    HG3  MET  46           HG3      MET  46  24.776   2.631  -0.248
    7    HE2  MET  46           HE1      MET  46  26.905   4.113   0.523
    8    HE1  MET  46           HE2      MET  46  27.169   3.661  -1.158
    9    HE3  MET  46           HE3      MET  46  28.496   3.548  -0.004

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ALA  47           H        ALA  47  21.932  -0.532   1.142
    2    HA   ALA  47           HA       ALA  47  21.886  -3.241   0.327
    3    HB2  ALA  47           HB1      ALA  47  21.534  -2.794   2.639
    4    HB3  ALA  47           HB2      ALA  47  19.993  -3.404   2.037
    5    HB1  ALA  47           HB3      ALA  47  20.215  -1.673   2.300

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LEU  48           H        LEU  48  19.512  -0.628   0.013
    2    HA   LEU  48           HA       LEU  48  17.461  -2.169  -1.218
    3    HB2  LEU  48           HB2      LEU  48  18.095   0.790  -1.328
    4    HB3  LEU  48           HB3      LEU  48  16.620   0.073  -1.979
    5    HG   LEU  48           HG       LEU  48  17.513  -0.237   0.897
    6   HD13  LEU  48          HD11      LEU  48  17.078   2.062   0.726
    7   HD12  LEU  48          HD12      LEU  48  15.531   1.402   1.253
    8   HD11  LEU  48          HD13      LEU  48  15.777   1.834  -0.440
    9   HD22  LEU  48          HD21      LEU  48  15.990  -1.959   0.529
   10   HD21  LEU  48          HD22      LEU  48  15.094  -1.056  -0.694
   11   HD23  LEU  48          HD23      LEU  48  14.902  -0.661   1.014

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ASN  49           H        ASN  49  20.120  -0.219  -2.475
    2    HA   ASN  49           HA       ASN  49  19.434  -0.295  -5.191
    3    HB2  ASN  49           HB2      ASN  49  21.112   1.232  -4.299
    4    HB3  ASN  49           HB3      ASN  49  22.152  -0.119  -3.860
    5   HD21  ASN  49          HD21      ASN  49  20.633   1.419  -6.717
    6   HD22  ASN  49          HD22      ASN  49  21.862   0.972  -7.799

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLU  50           H        GLU  50  21.457  -2.486  -3.265
    2    HA   GLU  50           HA       GLU  50  22.141  -4.228  -5.408
    3    HB2  GLU  50           HB2      GLU  50  23.367  -4.205  -3.257
    4    HB3  GLU  50           HB3      GLU  50  21.939  -4.845  -2.445
    5    HG2  GLU  50           HG2      GLU  50  22.023  -6.871  -3.814
    6    HG3  GLU  50           HG3      GLU  50  23.382  -6.227  -4.730

  No H/Q in entry =           6
  In of MODEL   60
    1    H    ALA  51           H        ALA  51  19.516  -4.188  -3.046
    2    HA   ALA  51           HA       ALA  51  18.354  -6.665  -3.798
    3    HB3  ALA  51           HB1      ALA  51  16.780  -6.175  -2.219
    4    HB1  ALA  51           HB2      ALA  51  16.549  -4.528  -2.808
    5    HB2  ALA  51           HB3      ALA  51  17.925  -4.910  -1.772

  No H/Q in entry =           5
  In of MODEL   60
    1    H    HIS  52           H        HIS  52  17.734  -3.317  -4.810
    2    HA   HIS  52           HA       HIS  52  15.600  -3.848  -6.584
    3    HB2  HIS  52           HB2      HIS  52  16.175  -1.583  -5.818
    4    HB3  HIS  52           HB3      HIS  52  17.692  -1.663  -6.714
    5    HD1  HIS  52           HD1      HIS  52  17.288  -2.252  -9.416
    6    HD2  HIS  52           HD2      HIS  52  14.137  -0.497  -7.326
    7    HE1  HIS  52           HE1      HIS  52  15.733  -1.269 -11.157
    8    HE2  HIS  52           HE2      HIS  52  13.808  -0.195  -9.898

  No H/Q in entry =           8
  In of MODEL   60
    1    H    LEU  53           H        LEU  53  19.112  -3.831  -7.064
    2    HA   LEU  53           HA       LEU  53  19.133  -4.135  -9.866
    3    HB2  LEU  53           HB2      LEU  53  21.103  -4.916  -7.729
    4    HB3  LEU  53           HB3      LEU  53  21.397  -5.253  -9.432
    5    HG   LEU  53           HG       LEU  53  20.718  -2.477  -8.409
    6   HD11  LEU  53          HD11      LEU  53  23.410  -3.804  -8.819
    7   HD13  LEU  53          HD12      LEU  53  22.778  -3.106  -7.329
    8   HD12  LEU  53          HD13      LEU  53  23.195  -2.061  -8.682
    9   HD22  LEU  53          HD21      LEU  53  20.408  -2.473 -10.748
   10   HD21  LEU  53          HD22      LEU  53  21.701  -3.638 -11.013
   11   HD23  LEU  53          HD23      LEU  53  22.090  -1.976 -10.611

  No H/Q in entry =          11
  In of MODEL   60
    1    H    VAL  54           H        VAL  54  19.071  -6.533  -7.249
    2    HA   VAL  54           HA       VAL  54  19.186  -8.820  -8.919
    3    HB   VAL  54           HB       VAL  54  18.067  -8.414  -6.135
    4   HG12  VAL  54          HG11      VAL  54  18.408 -11.030  -6.145
    5   HG11  VAL  54          HG12      VAL  54  18.198 -10.856  -7.887
    6   HG13  VAL  54          HG13      VAL  54  16.921 -10.338  -6.789
    7   HG22  VAL  54          HG21      VAL  54  20.384  -8.189  -5.942
    8   HG21  VAL  54          HG22      VAL  54  20.710  -9.274  -7.293
    9   HG23  VAL  54          HG23      VAL  54  20.206  -9.930  -5.735

  No H/Q in entry =           9
  In of MODEL   60
    1    H    GLN  55           H        GLN  55  16.464  -6.940  -7.592
    2    HA   GLN  55           HA       GLN  55  14.439  -8.613  -8.644
    3    HB2  GLN  55           HB2      GLN  55  13.703  -7.099  -7.002
    4    HB3  GLN  55           HB3      GLN  55  14.476  -5.722  -7.783
    5    HG2  GLN  55           HG2      GLN  55  12.729  -5.404  -9.248
    6    HG3  GLN  55           HG3      GLN  55  12.417  -7.126  -9.420
    7   HE21  GLN  55          HE21      GLN  55  10.425  -7.692  -8.590
    8   HE22  GLN  55          HE22      GLN  55   9.664  -6.948  -7.268

  No H/Q in entry =           8
  In of MODEL   60
    1    H    THR  56           H        THR  56  16.141  -5.796 -10.017
    2    HA   THR  56           HA       THR  56  14.668  -5.435 -12.344
    3    HB   THR  56           HB       THR  56  17.689  -5.324 -12.210
    4    HG1  THR  56           HG1      THR  56  16.018  -3.135 -11.720
    5   HG21  THR  56          HG21      THR  56  16.097  -4.981 -14.363
    6   HG23  THR  56          HG22      THR  56  17.590  -4.076 -14.123
    7   HG22  THR  56          HG23      THR  56  16.041  -3.349 -13.693

  No H/Q in entry =           7
  In of MODEL   60
    1    H    LYS  57           H        LYS  57  17.342  -7.716 -11.777
    2    HA   LYS  57           HA       LYS  57  17.316  -8.901 -14.360
    3    HB2  LYS  57           HB2      LYS  57  19.134  -9.149 -12.647
    4    HB3  LYS  57           HB3      LYS  57  18.049 -10.148 -11.690
    5    HG2  LYS  57           HG2      LYS  57  17.917 -11.788 -13.509
    6    HG3  LYS  57           HG3      LYS  57  18.962 -10.788 -14.510
    7    HD2  LYS  57           HD2      LYS  57  20.781 -11.029 -12.851
    8    HD3  LYS  57           HD3      LYS  57  19.741 -12.051 -11.861
    9    HE2  LYS  57           HE2      LYS  57  21.225 -13.455 -13.225
   10    HE3  LYS  57           HE3      LYS  57  19.560 -13.669 -13.764
   11    HZ1  LYS  57           HZ1      LYS  57  20.779 -11.503 -15.121
   12    HZ3  LYS  57           HZ2      LYS  57  20.088 -12.918 -15.757
   13    HZ2  LYS  57           HZ3      LYS  57  21.721 -12.904 -15.291

  No H/Q in entry =          13
  In of MODEL   60
    1    H    LEU  58           H        LEU  58  15.581  -9.592 -11.363
    2    HA   LEU  58           HA       LEU  58  14.364 -11.972 -12.290
    3    HB2  LEU  58           HB2      LEU  58  13.586 -10.080 -10.076
    4    HB3  LEU  58           HB3      LEU  58  12.786 -11.623 -10.387
    5    HG   LEU  58           HG       LEU  58  15.764 -11.324  -9.872
    6   HD11  LEU  58          HD11      LEU  58  13.422 -11.766  -8.049
    7   HD13  LEU  58          HD12      LEU  58  14.871 -10.793  -7.803
    8   HD12  LEU  58          HD13      LEU  58  14.959 -12.549  -7.675
    9   HD22  LEU  58          HD21      LEU  58  15.648 -13.383 -10.906
   10   HD21  LEU  58          HD22      LEU  58  13.941 -13.607 -10.522
   11   HD23  LEU  58          HD23      LEU  58  15.169 -13.903  -9.291

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  59           H        ILE  59  13.659  -8.637 -12.950
    2    HA   ILE  59           HA       ILE  59  10.935  -9.303 -13.855
    3    HB   ILE  59           HB       ILE  59  11.745  -7.017 -12.654
    4   HG12  ILE  59          HG12      ILE  59   9.792  -6.916 -14.965
    5   HG13  ILE  59          HG13      ILE  59   9.410  -7.676 -13.442
    6   HG23  ILE  59          HG21      ILE  59  12.272  -5.285 -14.170
    7   HG22  ILE  59          HG22      ILE  59  11.763  -6.212 -15.563
    8   HG21  ILE  59          HG23      ILE  59  13.263  -6.610 -14.730
    9   HD11  ILE  59          HD11      ILE  59   9.975  -5.538 -12.272
   10   HD13  ILE  59          HD12      ILE  59   8.597  -5.396 -13.362
   11   HD12  ILE  59          HD13      ILE  59  10.178  -4.788 -13.856

  No H/Q in entry =          11
  In of MODEL   60
    1    H    GLU  60           H        GLU  60  14.115  -8.422 -15.155
    2    HA   GLU  60           HA       GLU  60  13.295  -8.018 -17.850
    3    HB2  GLU  60           HB2      GLU  60  15.543  -7.833 -18.323
    4    HB3  GLU  60           HB3      GLU  60  15.597  -7.584 -16.580
    5    HG2  GLU  60           HG2      GLU  60  15.965 -10.086 -16.339
    6    HG3  GLU  60           HG3      GLU  60  16.174 -10.146 -18.088

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLY  61           H        GLY  61  14.319 -10.899 -16.060
    2    HA3  GLY  61           HA2      GLY  61  13.757 -12.542 -18.459
    3    HA2  GLY  61           HA3      GLY  61  14.811 -13.020 -17.133

  No H/Q in entry =           3
  In of MODEL   60
    1    H    ASP  62           H        ASP  62  11.684 -11.500 -16.717
    2    HA   ASP  62           HA       ASP  62  10.806 -13.546 -14.934
    3    HB2  ASP  62           HB2      ASP  62   8.688 -12.221 -14.926
    4    HB3  ASP  62           HB3      ASP  62  10.124 -11.274 -14.549

  No H/Q in entry =           4
  In of MODEL   60
    1    H    ALA  63           H        ALA  63  11.052 -13.806 -18.181
    2    HA   ALA  63           HA       ALA  63   8.533 -14.669 -19.115
    3    HB1  ALA  63           HB1      ALA  63  11.116 -15.964 -19.968
    4    HB3  ALA  63           HB2      ALA  63  10.750 -14.297 -20.408
    5    HB2  ALA  63           HB3      ALA  63   9.690 -15.602 -20.940

  No H/Q in entry =           5
  In of MODEL   60
    1    H    GLY  64           H        GLY  64  11.141 -16.409 -17.484
    2    HA3  GLY  64           HA2      GLY  64  11.250 -18.475 -16.494
    3    HA2  GLY  64           HA3      GLY  64   9.569 -18.194 -16.058

  No H/Q in entry =           3
  In of MODEL   60
    1    H    GLU  65           H        GLU  65   8.515 -20.059 -16.502
    2    HA   GLU  65           HA       GLU  65   9.253 -21.982 -18.346
    3    HB2  GLU  65           HB2      GLU  65   6.485 -21.324 -17.338
    4    HB3  GLU  65           HB3      GLU  65   6.919 -22.805 -18.193
    5    HG2  GLU  65           HG2      GLU  65   7.166 -23.490 -15.988
    6    HG3  GLU  65           HG3      GLU  65   8.806 -22.956 -16.354

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLY  66           H        GLY  66   7.231 -22.656 -19.915
    2    HA3  GLY  66           HA2      GLY  66   7.654 -21.253 -22.311
    3    HA2  GLY  66           HA3      GLY  66   6.441 -22.488 -22.041

  No H/Q in entry =           3
  In of MODEL   60
    1    H    LYS  67           H        LYS  67   5.073 -21.051 -19.955
    2    HA   LYS  67           HA       LYS  67   3.195 -19.663 -21.509
    3    HB2  LYS  67           HB2      LYS  67   3.587 -19.855 -18.526
    4    HB3  LYS  67           HB3      LYS  67   2.184 -19.088 -19.283
    5    HG2  LYS  67           HG2      LYS  67   1.699 -21.170 -20.513
    6    HG3  LYS  67           HG3      LYS  67   3.098 -21.941 -19.771
    7    HD2  LYS  67           HD2      LYS  67   2.076 -21.601 -17.535
    8    HD3  LYS  67           HD3      LYS  67   0.654 -20.899 -18.311
    9    HE2  LYS  67           HE2      LYS  67   1.700 -23.681 -18.906
   10    HE3  LYS  67           HE3      LYS  67   0.401 -23.344 -17.762
   11    HZ3  LYS  67           HZ1      LYS  67  -0.798 -23.709 -19.644
   12    HZ2  LYS  67           HZ2      LYS  67   0.414 -23.127 -20.680
   13    HZ1  LYS  67           HZ3      LYS  67  -0.552 -22.039 -19.803

  No H/Q in entry =          13
  In of MODEL   60
    1    H    MET  68           H        MET  68   2.529 -17.587 -21.596
    2    HA   MET  68           HA       MET  68   4.472 -15.590 -21.881
    3    HB2  MET  68           HB2      MET  68   1.469 -15.370 -21.653
    4    HB3  MET  68           HB3      MET  68   2.537 -14.082 -22.208
    5    HG2  MET  68           HG2      MET  68   2.326 -16.822 -23.487
    6    HG3  MET  68           HG3      MET  68   1.550 -15.361 -24.100
    7    HE3  MET  68           HE1      MET  68   4.087 -13.152 -25.473
    8    HE2  MET  68           HE2      MET  68   3.853 -12.991 -23.736
    9    HE1  MET  68           HE3      MET  68   2.486 -13.409 -24.766

  No H/Q in entry =           9
  In of MODEL   60
    1    H    LYS  69           H        LYS  69   2.175 -16.125 -19.189
    2    HA   LYS  69           HA       LYS  69   2.402 -13.756 -17.837
    3    HB2  LYS  69           HB2      LYS  69   1.796 -14.984 -15.810
    4    HB3  LYS  69           HB3      LYS  69   0.888 -15.579 -17.204
    5    HG2  LYS  69           HG2      LYS  69   2.436 -17.449 -17.462
    6    HG3  LYS  69           HG3      LYS  69   3.438 -16.835 -16.147
    7    HD2  LYS  69           HD2      LYS  69   2.089 -18.544 -15.177
    8    HD3  LYS  69           HD3      LYS  69   1.354 -17.021 -14.671
    9    HE2  LYS  69           HE2      LYS  69  -0.386 -17.204 -16.284
   10    HE3  LYS  69           HE3      LYS  69   0.457 -18.483 -17.158
   11    HZ3  LYS  69           HZ1      LYS  69  -0.547 -19.971 -15.895
   12    HZ2  LYS  69           HZ2      LYS  69  -1.375 -18.741 -15.067
   13    HZ1  LYS  69           HZ3      LYS  69   0.127 -19.289 -14.496

  No H/Q in entry =          13
  In of MODEL   60
    1    H    VAL  70           H        VAL  70   3.346 -14.043 -15.280
    2    HA   VAL  70           HA       VAL  70   6.274 -14.397 -15.555
    3    HB   VAL  70           HB       VAL  70   6.549 -12.366 -14.138
    4   HG11  VAL  70          HG11      VAL  70   6.469 -12.427 -16.742
    5   HG13  VAL  70          HG12      VAL  70   6.377 -10.860 -15.939
    6   HG12  VAL  70          HG13      VAL  70   4.912 -11.621 -16.556
    7   HG21  VAL  70          HG21      VAL  70   3.546 -12.409 -14.346
    8   HG23  VAL  70          HG22      VAL  70   4.370 -10.854 -14.256
    9   HG22  VAL  70          HG23      VAL  70   4.557 -12.026 -12.952

  No H/Q in entry =           9
  In of MODEL   60
    1    H    SER  71           H        SER  71   7.343 -14.504 -13.387
    2    HA   SER  71           HA       SER  71   6.241 -16.527 -11.753
    3    HB2  SER  71           HB2      SER  71   8.673 -16.022 -11.914
    4    HB3  SER  71           HB3      SER  71   8.395 -14.519 -11.037
    5    HG   SER  71           HG       SER  71   7.213 -16.329  -9.619

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LEU  72           H        LEU  72   4.930 -16.450 -10.016
    2    HA   LEU  72           HA       LEU  72   3.369 -14.150  -9.542
    3    HB2  LEU  72           HB2      LEU  72   3.698 -16.706  -7.978
    4    HB3  LEU  72           HB3      LEU  72   2.517 -15.462  -7.572
    5    HG   LEU  72           HG       LEU  72   2.674 -16.765 -10.310
    6   HD11  LEU  72          HD11      LEU  72   1.028 -17.477  -7.870
    7   HD13  LEU  72          HD12      LEU  72   2.128 -18.523  -8.766
    8   HD12  LEU  72          HD13      LEU  72   0.611 -18.005  -9.500
    9   HD22  LEU  72          HD21      LEU  72   1.431 -14.788 -10.560
   10   HD21  LEU  72          HD22      LEU  72   0.762 -14.871  -8.938
   11   HD23  LEU  72          HD23      LEU  72   0.173 -15.961 -10.190

  No H/Q in entry =          11
  In of MODEL   60
    1    H    VAL  73           H        VAL  73   6.059 -15.574  -7.810
    2    HA   VAL  73           HA       VAL  73   6.018 -14.051  -5.470
    3    HB   VAL  73           HB       VAL  73   8.175 -14.881  -5.049
    4   HG13  VAL  73          HG11      VAL  73   7.984 -17.219  -5.581
    5   HG12  VAL  73          HG12      VAL  73   6.991 -16.873  -6.997
    6   HG11  VAL  73          HG13      VAL  73   6.346 -16.601  -5.379
    7   HG23  VAL  73          HG21      VAL  73   9.543 -15.849  -6.989
    8   HG22  VAL  73          HG22      VAL  73   9.415 -14.091  -6.928
    9   HG21  VAL  73          HG23      VAL  73   8.422 -15.008  -8.061

  No H/Q in entry =           9
  In of MODEL   60
    1    H    LEU  74           H        LEU  74   6.960 -13.137  -8.655
    2    HA   LEU  74           HA       LEU  74   8.897 -11.176  -8.179
    3    HB2  LEU  74           HB2      LEU  74   8.421 -11.916 -10.414
    4    HB3  LEU  74           HB3      LEU  74   6.751 -11.368 -10.290
    5    HG   LEU  74           HG       LEU  74   7.520  -9.035 -10.090
    6   HD13  LEU  74          HD11      LEU  74   9.635  -9.192  -9.025
    7   HD12  LEU  74          HD12      LEU  74  10.017  -8.694 -10.672
    8   HD11  LEU  74          HD13      LEU  74  10.227 -10.377 -10.189
    9   HD23  LEU  74          HD21      LEU  74   9.027 -10.100 -12.419
   10   HD22  LEU  74          HD22      LEU  74   7.849  -8.810 -12.326
   11   HD21  LEU  74          HD23      LEU  74   7.309 -10.473 -12.312

  No H/Q in entry =          11
  In of MODEL   60
    1    H    VAL  75           H        VAL  75   5.394 -10.815  -8.486
    2    HA   VAL  75           HA       VAL  75   5.285  -8.062  -7.886
    3    HB   VAL  75           HB       VAL  75   3.216 -10.223  -7.482
    4   HG12  VAL  75          HG11      VAL  75   1.623  -8.267  -7.366
    5   HG11  VAL  75          HG12      VAL  75   3.016  -7.197  -7.303
    6   HG13  VAL  75          HG13      VAL  75   2.729  -8.334  -5.997
    7   HG23  VAL  75          HG21      VAL  75   3.370  -8.036  -9.571
    8   HG22  VAL  75          HG22      VAL  75   2.361  -9.481  -9.589
    9   HG21  VAL  75          HG23      VAL  75   4.104  -9.619  -9.824

  No H/Q in entry =           9
  In of MODEL   60
    1    H    GLU  76           H        GLU  76   5.079 -10.950  -5.786
    2    HA   GLU  76           HA       GLU  76   4.628  -9.603  -3.353
    3    HB2  GLU  76           HB2      GLU  76   4.467 -12.068  -3.591
    4    HB3  GLU  76           HB3      GLU  76   6.198 -12.156  -3.861
    5    HG2  GLU  76           HG2      GLU  76   5.785 -12.751  -1.556
    6    HG3  GLU  76           HG3      GLU  76   6.548 -11.172  -1.557

  No H/Q in entry =           6
  In of MODEL   60
    1    H    ALA  77           H        ALA  77   7.675 -10.481  -4.958
    2    HA   ALA  77           HA       ALA  77   9.381  -9.434  -2.958
    3    HB2  ALA  77           HB1      ALA  77  11.135  -9.742  -4.490
    4    HB3  ALA  77           HB2      ALA  77  10.090  -9.461  -5.882
    5    HB1  ALA  77           HB3      ALA  77   9.952 -10.960  -4.966

  No H/Q in entry =           5
  In of MODEL   60
    1    H    GLN  78           H        GLN  78   7.944  -8.014  -5.849
    2    HA   GLN  78           HA       GLN  78   9.281  -5.526  -5.750
    3    HB2  GLN  78           HB2      GLN  78   7.973  -6.435  -7.698
    4    HB3  GLN  78           HB3      GLN  78   6.495  -6.086  -6.804
    5    HG2  GLN  78           HG2      GLN  78   7.121  -3.706  -6.692
    6    HG3  GLN  78           HG3      GLN  78   8.595  -4.050  -7.596
    7   HE21  GLN  78          HE21      GLN  78   6.656  -2.239  -8.648
    8   HE22  GLN  78          HE22      GLN  78   5.939  -2.950 -10.013

  No H/Q in entry =           8
  In of MODEL   60
    1    H    LEU  79           H        LEU  79   6.286  -6.690  -4.289
    2    HA   LEU  79           HA       LEU  79   5.288  -4.294  -3.258
    3    HB2  LEU  79           HB2      LEU  79   3.988  -6.355  -3.196
    4    HB3  LEU  79           HB3      LEU  79   5.151  -7.091  -2.097
    5    HG   LEU  79           HG       LEU  79   4.608  -5.460  -0.357
    6   HD13  LEU  79          HD11      LEU  79   4.117  -3.444  -1.393
    7   HD12  LEU  79          HD12      LEU  79   2.500  -3.983  -0.938
    8   HD11  LEU  79          HD13      LEU  79   3.063  -4.194  -2.594
    9   HD23  LEU  79          HD21      LEU  79   2.026  -5.970  -0.239
   10   HD22  LEU  79          HD22      LEU  79   3.175  -7.302  -0.149
   11   HD21  LEU  79          HD23      LEU  79   2.342  -6.964  -1.663

  No H/Q in entry =          11
  In of MODEL   60
    1    H    HIS  80           H        HIS  80   7.504  -6.622  -1.710
    2    HA   HIS  80           HA       HIS  80   7.809  -5.088   0.662
    3    HB2  HIS  80           HB2      HIS  80   9.149  -7.438  -0.562
    4    HB3  HIS  80           HB3      HIS  80  10.067  -6.540   0.648
    5    HD1  HIS  80           HD1      HIS  80   9.608  -7.189   2.993
    6    HD2  HIS  80           HD2      HIS  80   6.368  -8.050   0.514
    7    HE1  HIS  80           HE1      HIS  80   7.859  -8.310   4.457
    8    HE2  HIS  80           HE2      HIS  80   5.878  -8.839   2.954

  No H/Q in entry =           8
  In of MODEL   60
    1    H    LEU  81           H        LEU  81   9.783  -5.339  -2.274
    2    HA   LEU  81           HA       LEU  81  11.826  -3.588  -1.411
    3    HB2  LEU  81           HB2      LEU  81  10.879  -4.375  -4.167
    4    HB3  LEU  81           HB3      LEU  81  12.296  -3.361  -3.888
    5    HG   LEU  81           HG       LEU  81  11.934  -6.090  -2.622
    6   HD12  LEU  81          HD11      LEU  81  13.735  -6.698  -4.395
    7   HD11  LEU  81          HD12      LEU  81  13.151  -5.274  -5.254
    8   HD13  LEU  81          HD13      LEU  81  12.051  -6.607  -4.909
    9   HD23  LEU  81          HD21      LEU  81  14.561  -5.759  -2.636
   10   HD22  LEU  81          HD22      LEU  81  13.588  -5.010  -1.372
   11   HD21  LEU  81          HD23      LEU  81  14.146  -4.049  -2.741

  No H/Q in entry =          11
  In of MODEL   60
    1    H    MET  82           H        MET  82   8.879  -2.961  -3.313
    2    HA   MET  82           HA       MET  82   9.397  -0.230  -3.808
    3    HB2  MET  82           HB2      MET  82   6.848  -1.840  -3.661
    4    HB3  MET  82           HB3      MET  82   6.834  -0.114  -4.018
    5    HG2  MET  82           HG2      MET  82   8.429  -2.171  -5.580
    6    HG3  MET  82           HG3      MET  82   6.853  -1.556  -6.072
    7    HE3  MET  82           HE1      MET  82   7.269   1.907  -7.234
    8    HE2  MET  82           HE2      MET  82   6.914   1.671  -5.525
    9    HE1  MET  82           HE3      MET  82   6.242   0.563  -6.716

  No H/Q in entry =           9
  In of MODEL   60
    1    H    THR  83           H        THR  83   7.643  -1.850  -1.190
    2    HA   THR  83           HA       THR  83   6.794   0.488   0.156
    3    HB   THR  83           HB       THR  83   6.690  -1.096   2.168
    4    HG1  THR  83           HG1      THR  83   7.455  -3.041   1.922
    5   HG22  THR  83          HG21      THR  83   5.030  -2.664   0.712
    6   HG21  THR  83          HG22      THR  83   5.236  -1.330  -0.417
    7   HG23  THR  83          HG23      THR  83   4.612  -1.025   1.205

  No H/Q in entry =           7
  In of MODEL   60
    1    H    SER  84           H        SER  84   9.634  -1.597   0.637
    2    HA   SER  84           HA       SER  84  10.710  -0.170   2.819
    3    HB2  SER  84           HB2      SER  84  11.951  -1.997   0.773
    4    HB3  SER  84           HB3      SER  84  12.907  -1.244   2.047
    5    HG   SER  84           HG       SER  84  10.644  -2.947   2.324

  No H/Q in entry =           5
  In of MODEL   60
    1    H    MET  85           H        MET  85  11.423   0.110  -0.676
    2    HA   MET  85           HA       MET  85  13.414   2.084  -0.438
    3    HB2  MET  85           HB2      MET  85  12.996   0.805  -2.505
    4    HB3  MET  85           HB3      MET  85  11.469   1.663  -2.715
    5    HG2  MET  85           HG2      MET  85  12.666   3.805  -2.849
    6    HG3  MET  85           HG3      MET  85  14.197   2.977  -2.587
    7    HE3  MET  85           HE1      MET  85  11.120   1.703  -5.124
    8    HE2  MET  85           HE2      MET  85  11.466   3.058  -6.197
    9    HE1  MET  85           HE3      MET  85  11.102   3.361  -4.502

  No H/Q in entry =           9
  In of MODEL   60
    1    H    LEU  86           H        LEU  86   9.918   2.404  -0.907
    2    HA   LEU  86           HA       LEU  86   9.838   5.217  -1.076
    3    HB2  LEU  86           HB2      LEU  86   7.996   3.551  -1.639
    4    HB3  LEU  86           HB3      LEU  86   7.685   3.452   0.094
    5    HG   LEU  86           HG       LEU  86   7.512   6.012   0.054
    6   HD11  LEU  86          HD11      LEU  86   8.260   5.592  -2.658
    7   HD13  LEU  86          HD12      LEU  86   7.825   7.114  -1.886
    8   HD12  LEU  86          HD13      LEU  86   6.584   6.148  -2.681
    9   HD23  LEU  86          HD21      LEU  86   5.366   4.656  -1.590
   10   HD22  LEU  86          HD22      LEU  86   5.183   5.910  -0.367
   11   HD21  LEU  86          HD23      LEU  86   5.596   4.266   0.115

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ALA  87           H        ALA  87   9.413   3.025   1.665
    2    HA   ALA  87           HA       ALA  87   8.877   4.928   3.649
    3    HB1  ALA  87           HB1      ALA  87   9.696   2.112   3.542
    4    HB3  ALA  87           HB2      ALA  87   8.580   2.914   4.643
    5    HB2  ALA  87           HB3      ALA  87  10.312   2.952   4.968

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ARG  88           H        ARG  88  11.956   3.522   2.628
    2    HA   ARG  88           HA       ARG  88  13.579   4.899   4.448
    3    HB2  ARG  88           HB2      ARG  88  14.241   2.935   3.029
    4    HB3  ARG  88           HB3      ARG  88  14.373   4.034   1.659
    5    HG2  ARG  88           HG2      ARG  88  15.862   5.347   3.595
    6    HG3  ARG  88           HG3      ARG  88  16.194   3.657   3.963
    7    HD2  ARG  88           HD2      ARG  88  17.442   3.374   2.101
    8    HD3  ARG  88           HD3      ARG  88  16.290   4.245   1.084
    9    HE   ARG  88           HE       ARG  88  18.691   5.315   2.109
   10   HH21  ARG  88          HH11      ARG  88  19.024   7.536   1.920
   11   HH22  ARG  88          HH12      ARG  88  17.667   8.602   1.797
   12   HH11  ARG  88          HH21      ARG  88  15.346   6.054   1.872
   13   HH12  ARG  88          HH22      ARG  88  15.582   7.761   1.745

  No H/Q in entry =          13
  In of MODEL   60
    1    H    GLU  89           H        GLU  89  12.565   5.807   1.140
    2    HA   GLU  89           HA       GLU  89  14.099   8.175   0.976
    3    HB2  GLU  89           HB2      GLU  89  12.938   7.137  -0.963
    4    HB3  GLU  89           HB3      GLU  89  11.398   7.668  -0.285
    5    HG2  GLU  89           HG2      GLU  89  12.087  10.009  -0.446
    6    HG3  GLU  89           HG3      GLU  89  13.687   9.528  -1.003

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LEU  90           H        LEU  90  10.785   7.645   2.141
    2    HA   LEU  90           HA       LEU  90  10.264  10.374   2.734
    3    HB2  LEU  90           HB2      LEU  90   9.093   7.790   3.764
    4    HB3  LEU  90           HB3      LEU  90   8.460   9.381   4.201
    5    HG   LEU  90           HG       LEU  90   8.849   8.515   1.323
    6   HD12  LEU  90          HD11      LEU  90   6.318   8.174   1.413
    7   HD11  LEU  90          HD12      LEU  90   6.493   8.157   3.168
    8   HD13  LEU  90          HD13      LEU  90   7.305   6.935   2.189
    9   HD22  LEU  90          HD21      LEU  90   8.544  10.822   1.263
   10   HD21  LEU  90          HD22      LEU  90   7.574  10.843   2.734
   11   HD23  LEU  90          HD23      LEU  90   6.862  10.292   1.219

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  91           H        ILE  91  11.561   7.690   4.630
    2    HA   ILE  91           HA       ILE  91  11.723   9.045   7.103
    3    HB   ILE  91           HB       ILE  91  13.275   6.719   5.951
    4   HG12  ILE  91          HG12      ILE  91  11.284   6.867   8.234
    5   HG13  ILE  91          HG13      ILE  91  10.795   6.591   6.563
    6   HG22  ILE  91          HG21      ILE  91  13.776   6.496   8.586
    7   HG21  ILE  91          HG22      ILE  91  13.691   8.254   8.493
    8   HG23  ILE  91          HG23      ILE  91  14.862   7.376   7.511
    9   HD13  ILE  91          HD11      ILE  91  11.807   4.494   6.472
   10   HD12  ILE  91          HD12      ILE  91  11.232   4.542   8.139
   11   HD11  ILE  91          HD13      ILE  91  12.929   4.865   7.783

  No H/Q in entry =          11
  In of MODEL   60
    1    H    THR  92           H        THR  92  13.909   8.898   4.325
    2    HA   THR  92           HA       THR  92  16.081  10.296   5.466
    3    HB   THR  92           HB       THR  92  15.063  10.179   2.616
    4    HG1  THR  92           HG1      THR  92  15.908   8.284   3.003
    5   HG22  THR  92          HG21      THR  92  17.626  10.882   2.296
    6   HG21  THR  92          HG22      THR  92  17.332  11.695   3.833
    7   HG23  THR  92          HG23      THR  92  16.344  12.084   2.425

  No H/Q in entry =           7
  In of MODEL   60
    1    H    GLU  93           H        GLU  93  13.169  11.443   3.775
    2    HA   GLU  93           HA       GLU  93  13.752  14.206   3.895
    3    HB2  GLU  93           HB2      GLU  93  11.055  12.821   3.934
    4    HB3  GLU  93           HB3      GLU  93  11.331  14.523   3.566
    5    HG2  GLU  93           HG2      GLU  93  12.661  12.294   2.013
    6    HG3  GLU  93           HG3      GLU  93  11.106  12.972   1.547

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LEU  94           H        LEU  94  12.045  12.033   6.116
    2    HA   LEU  94           HA       LEU  94  11.248  13.967   8.010
    3    HB2  LEU  94           HB2      LEU  94  11.841  11.014   8.265
    4    HB3  LEU  94           HB3      LEU  94  11.281  11.981   9.626
    5    HG   LEU  94           HG       LEU  94   9.766  12.037   7.014
    6   HD11  LEU  94          HD11      LEU  94   9.882   9.807   9.008
    7   HD13  LEU  94          HD12      LEU  94   9.561   9.752   7.276
    8   HD12  LEU  94          HD13      LEU  94   8.293  10.258   8.391
    9   HD23  LEU  94          HD21      LEU  94   7.863  12.420   8.638
   10   HD22  LEU  94          HD22      LEU  94   9.097  13.680   8.666
   11   HD21  LEU  94          HD23      LEU  94   9.055  12.458   9.936

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  95           H        ILE  95  14.228  12.053   7.730
    2    HA   ILE  95           HA       ILE  95  15.420  12.970  10.134
    3    HB   ILE  95           HB       ILE  95  16.634  11.918   7.567
    4   HG12  ILE  95          HG12      ILE  95  16.376  10.703  10.333
    5   HG13  ILE  95          HG13      ILE  95  15.195  10.445   9.050
    6   HG21  ILE  95          HG21      ILE  95  17.916  12.719  10.198
    7   HG23  ILE  95          HG22      ILE  95  18.357  13.256   8.576
    8   HG22  ILE  95          HG23      ILE  95  18.677  11.595   9.074
    9   HD13  ILE  95          HD11      ILE  95  16.667   9.179   7.765
   10   HD12  ILE  95          HD12      ILE  95  17.161   8.725   9.393
   11   HD11  ILE  95          HD13      ILE  95  18.098   9.913   8.488

  No H/Q in entry =          11
  In of MODEL   60
    1    H    GLU  96           H        GLU  96  15.529  14.218   6.804
    2    HA   GLU  96           HA       GLU  96  17.372  16.303   7.268
    3    HB2  GLU  96           HB2      GLU  96  16.684  15.648   5.014
    4    HB3  GLU  96           HB3      GLU  96  15.042  16.196   5.336
    5    HG2  GLU  96           HG2      GLU  96  15.592  18.330   4.797
    6    HG3  GLU  96           HG3      GLU  96  16.904  18.331   5.963

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LEU  97           H        LEU  97  13.867  16.098   7.738
    2    HA   LEU  97           HA       LEU  97  13.446  18.827   8.397
    3    HB2  LEU  97           HB2      LEU  97  11.946  16.292   9.018
    4    HB3  LEU  97           HB3      LEU  97  11.434  17.833   9.702
    5    HG   LEU  97           HG       LEU  97  11.884  17.432   6.729
    6   HD12  LEU  97          HD11      LEU  97   9.360  17.293   6.641
    7   HD11  LEU  97          HD12      LEU  97   9.375  17.086   8.390
    8   HD13  LEU  97          HD13      LEU  97  10.149  15.887   7.353
    9   HD23  LEU  97          HD21      LEU  97  10.137  19.388   6.791
   10   HD22  LEU  97          HD22      LEU  97  11.822  19.754   7.165
   11   HD21  LEU  97          HD23      LEU  97  10.649  19.572   8.468

  No H/Q in entry =          11
  In of MODEL   60
    1    H    HIS  98           H        HIS  98  14.304  15.996  10.370
    2    HA   HIS  98           HA       HIS  98  14.170  17.245  12.893
    3    HB2  HIS  98           HB2      HIS  98  15.918  15.000  11.861
    4    HB3  HIS  98           HB3      HIS  98  15.934  15.532  13.544
    5    HD1  HIS  98           HD1      HIS  98  13.711  13.903  10.971
    6    HD2  HIS  98           HD2      HIS  98  13.648  14.805  15.041
    7    HE1  HIS  98           HE1      HIS  98  11.703  12.695  11.942
    8    HE2  HIS  98           HE2      HIS  98  11.645  13.236  14.417

  No H/Q in entry =           8
  In of MODEL   60
    1    H    GLU  99           H        GLU  99  16.695  17.152  10.428
    2    HA   GLU  99           HA       GLU  99  18.692  18.486  11.939
    3    HB2  GLU  99           HB2      GLU  99  19.153  17.210   9.859
    4    HB3  GLU  99           HB3      GLU  99  18.326  18.465   8.933
    5    HG2  GLU  99           HG2      GLU  99  19.936  20.139   9.712
    6    HG3  GLU  99           HG3      GLU  99  20.733  18.936  10.721

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LYS 100           H        LYS 100  16.137  19.647   9.758
    2    HA   LYS 100           HA       LYS 100  16.925  22.387   9.905
    3    HB2  LYS 100           HB2      LYS 100  14.289  21.090   9.176
    4    HB3  LYS 100           HB3      LYS 100  14.580  22.830   9.090
    5    HG2  LYS 100           HG2      LYS 100  16.536  22.397   7.598
    6    HG3  LYS 100           HG3      LYS 100  16.130  20.678   7.613
    7    HD2  LYS 100           HD2      LYS 100  13.921  21.182   6.641
    8    HD3  LYS 100           HD3      LYS 100  14.310  22.903   6.633
    9    HE2  LYS 100           HE2      LYS 100  16.254  22.437   5.148
   10    HE3  LYS 100           HE3      LYS 100  15.795  20.731   5.113
   11    HZ1  LYS 100           HZ1      LYS 100  13.951  22.920   4.310
   12    HZ3  LYS 100           HZ2      LYS 100  13.771  21.251   4.042
   13    HZ2  LYS 100           HZ3      LYS 100  14.968  22.121   3.210

  No H/Q in entry =          13
  In of MODEL   60
    1    H    LEU 101           H        LEU 101  14.859  20.324  11.886
    2    HA   LEU 101           HA       LEU 101  13.704  22.380  13.487
    3    HB2  LEU 101           HB2      LEU 101  14.162  19.430  13.852
    4    HB3  LEU 101           HB3      LEU 101  13.639  20.402  15.224
    5    HG   LEU 101           HG       LEU 101  12.188  20.497  12.572
    6   HD12  LEU 101          HD11      LEU 101  10.551  18.921  13.854
    7   HD11  LEU 101          HD12      LEU 101  11.959  18.509  14.830
    8   HD13  LEU 101          HD13      LEU 101  11.973  18.210  13.091
    9   HD21  LEU 101          HD21      LEU 101  11.563  21.275  15.436
   10   HD23  LEU 101          HD22      LEU 101  10.288  21.049  14.240
   11   HD22  LEU 101          HD23      LEU 101  11.515  22.290  13.993

  No H/Q in entry =          11
  In of MODEL   60
    1    H    LYS 102           H        LYS 102  16.848  21.787  13.010
    2    HA   LYS 102           HA       LYS 102  18.704  22.660  14.065
    3    HB2  LYS 102           HB2      LYS 102  16.898  24.162  15.226
    4    HB3  LYS 102           HB3      LYS 102  17.125  23.095  16.596
    5    HG2  LYS 102           HG2      LYS 102  18.997  25.118  15.413
    6    HG3  LYS 102           HG3      LYS 102  18.636  24.795  17.095
    7    HD2  LYS 102           HD2      LYS 102  20.290  22.896  15.381
    8    HD3  LYS 102           HD3      LYS 102  20.985  24.217  16.311
    9    HE2  LYS 102           HE2      LYS 102  20.608  21.662  17.273
   10    HE3  LYS 102           HE3      LYS 102  20.833  23.100  18.268
   11    HZ2  LYS 102           HZ1      LYS 102  18.877  21.806  18.904
   12    HZ1  LYS 102           HZ2      LYS 102  18.214  22.041  17.364
   13    HZ3  LYS 102           HZ3      LYS 102  18.451  23.367  18.393

  No H/Q in entry =          13
  In of MODEL   60
    1    H    ALA 103           H        ALA 103  16.668  21.035  16.504
    2    HA   ALA 103           HA       ALA 103  18.419  19.824  18.132
    3    HB2  ALA 103           HB1      ALA 103  16.842  17.810  18.136
    4    HB1  ALA 103           HB2      ALA 103  15.928  18.666  16.894
    5    HB3  ALA 103           HB3      ALA 103  16.123  19.380  18.493

  No H/Q in entry =           5
  In of MODEL   60
    1    H1   ALA   1           H3       ALA   1  -1.885  -6.923 -21.370
    2    H2   ALA   1           H2       ALA   1  -2.670  -8.363 -20.914
    3    H3   ALA   1           H1       ALA   1  -1.068  -8.405 -21.488
    4    HA   ALA   1           HA       ALA   1  -1.924  -8.868 -23.476
    5    HB1  ALA   1           HB1      ALA   1  -4.053  -9.596 -22.981
    6    HB2  ALA   1           HB2      ALA   1  -4.506  -8.083 -23.766
    7    HB3  ALA   1           HB3      ALA   1  -4.425  -8.171 -22.008

  No H/Q in entry =           7
  In of MODEL   60
    1    H    GLU   2           H        GLU   2  -2.782  -7.671 -25.450
    2    HA   GLU   2           HA       GLU   2  -1.400  -5.649 -26.335
    3    HB2  GLU   2           HB2      GLU   2  -4.411  -5.724 -26.617
    4    HB3  GLU   2           HB3      GLU   2  -3.305  -4.853 -27.676
    5    HG2  GLU   2           HG2      GLU   2  -2.809  -6.735 -28.845
    6    HG3  GLU   2           HG3      GLU   2  -2.492  -7.647 -27.376

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLU   3           H        GLU   3  -4.554  -4.406 -25.391
    2    HA   GLU   3           HA       GLU   3  -3.508  -1.850 -24.763
    3    HB2  GLU   3           HB2      GLU   3  -6.188  -3.175 -24.406
    4    HB3  GLU   3           HB3      GLU   3  -5.887  -1.562 -23.755
    5    HG2  GLU   3           HG2      GLU   3  -5.559  -0.624 -25.881
    6    HG3  GLU   3           HG3      GLU   3  -5.167  -2.174 -26.618

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LEU   4           H        LEU   4  -5.065  -4.224 -22.576
    2    HA   LEU   4           HA       LEU   4  -4.676  -3.006 -20.184
    3    HB2  LEU   4           HB2      LEU   4  -4.130  -5.944 -20.674
    4    HB3  LEU   4           HB3      LEU   4  -4.520  -5.206 -19.122
    5    HG   LEU   4           HG       LEU   4  -6.321  -5.274 -21.565
    6   HD13  LEU   4          HD11      LEU   4  -7.497  -7.000 -20.562
    7   HD12  LEU   4          HD12      LEU   4  -6.994  -6.546 -18.934
    8   HD11  LEU   4          HD13      LEU   4  -5.868  -7.381 -20.003
    9   HD23  LEU   4          HD21      LEU   4  -7.986  -4.477 -19.674
   10   HD22  LEU   4          HD22      LEU   4  -6.961  -3.298 -20.491
   11   HD21  LEU   4          HD23      LEU   4  -6.514  -3.895 -18.893

  No H/Q in entry =          11
  In of MODEL   60
    1    H    GLU   5           H        GLU   5  -2.193  -4.833 -21.953
    2    HA   GLU   5           HA       GLU   5  -0.186  -4.553 -19.938
    3    HB2  GLU   5           HB2      GLU   5  -0.140  -6.313 -21.703
    4    HB3  GLU   5           HB3      GLU   5   0.164  -5.061 -22.907
    5    HG2  GLU   5           HG2      GLU   5   2.239  -4.432 -21.767
    6    HG3  GLU   5           HG3      GLU   5   1.932  -5.628 -20.508

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLU   6           H        GLU   6  -0.863  -2.827 -22.967
    2    HA   GLU   6           HA       GLU   6   1.304  -0.989 -22.716
    3    HB2  GLU   6           HB2      GLU   6  -1.274  -0.897 -24.294
    4    HB3  GLU   6           HB3      GLU   6  -0.021   0.338 -24.408
    5    HG2  GLU   6           HG2      GLU   6   1.607  -1.322 -25.137
    6    HG3  GLU   6           HG3      GLU   6   0.431  -2.615 -24.916

  No H/Q in entry =           6
  In of MODEL   60
    1    H    VAL   7           H        VAL   7  -2.021  -1.076 -21.632
    2    HA   VAL   7           HA       VAL   7  -2.241   1.631 -20.780
    3    HB   VAL   7           HB       VAL   7  -3.686  -0.895 -19.939
    4   HG11  VAL   7          HG11      VAL   7  -4.060   1.989 -19.106
    5   HG13  VAL   7          HG12      VAL   7  -3.944   0.560 -18.079
    6   HG12  VAL   7          HG13      VAL   7  -5.389   0.829 -19.053
    7   HG21  VAL   7          HG21      VAL   7  -3.874   0.193 -22.320
    8   HG23  VAL   7          HG22      VAL   7  -4.814   1.434 -21.491
    9   HG22  VAL   7          HG23      VAL   7  -5.354  -0.245 -21.466

  No H/Q in entry =           9
  In of MODEL   60
    1    H    VAL   8           H        VAL   8  -1.225  -1.358 -19.163
    2    HA   VAL   8           HA       VAL   8  -0.880  -0.290 -16.566
    3    HB   VAL   8           HB       VAL   8   0.385  -2.632 -17.995
    4   HG11  VAL   8          HG11      VAL   8   0.909  -1.510 -15.244
    5   HG13  VAL   8          HG12      VAL   8   2.072  -2.060 -16.450
    6   HG12  VAL   8          HG13      VAL   8   1.098  -3.233 -15.568
    7   HG23  VAL   8          HG21      VAL   8  -1.065  -3.405 -15.679
    8   HG22  VAL   8          HG22      VAL   8  -1.567  -3.604 -17.355
    9   HG21  VAL   8          HG23      VAL   8  -2.054  -2.171 -16.457

  No H/Q in entry =           9
  In of MODEL   60
    1    H    MET   9           H        MET   9   1.338  -0.571 -19.341
    2    HA   MET   9           HA       MET   9   3.635   0.472 -18.102
    3    HB2  MET   9           HB2      MET   9   2.648   0.460 -20.946
    4    HB3  MET   9           HB3      MET   9   4.132   1.306 -20.513
    5    HG2  MET   9           HG2      MET   9   4.830  -0.894 -19.356
    6    HG3  MET   9           HG3      MET   9   3.517  -1.639 -20.268
    7    HE1  MET   9           HE1      MET   9   3.315  -2.017 -22.503
    8    HE3  MET   9           HE2      MET   9   4.428  -1.658 -23.821
    9    HE2  MET   9           HE3      MET   9   3.429  -0.374 -23.145

  No H/Q in entry =           9
  In of MODEL   60
    1    H    GLY  10           H        GLY  10   0.927   2.076 -19.740
    2    HA3  GLY  10           HA2      GLY  10   1.887   4.730 -19.494
    3    HA2  GLY  10           HA3      GLY  10   0.196   4.267 -19.681

  No H/Q in entry =           3
  In of MODEL   60
    1    H    LEU  11           H        LEU  11  -0.172   2.728 -17.397
    2    HA   LEU  11           HA       LEU  11  -0.683   4.694 -15.422
    3    HB2  LEU  11           HB2      LEU  11  -0.607   1.678 -15.281
    4    HB3  LEU  11           HB3      LEU  11  -1.102   2.693 -13.928
    5    HG   LEU  11           HG       LEU  11  -2.374   2.818 -16.675
    6   HD13  LEU  11          HD11      LEU  11  -2.944   0.669 -15.924
    7   HD12  LEU  11          HD12      LEU  11  -4.290   1.656 -15.357
    8   HD11  LEU  11          HD13      LEU  11  -3.019   1.172 -14.234
    9   HD22  LEU  11          HD21      LEU  11  -2.957   4.827 -15.651
   10   HD21  LEU  11          HD22      LEU  11  -2.861   4.153 -14.025
   11   HD23  LEU  11          HD23      LEU  11  -4.248   3.789 -15.052

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  12           H        ILE  12   1.862   2.234 -15.707
    2    HA   ILE  12           HA       ILE  12   3.097   2.761 -13.216
    3    HB   ILE  12           HB       ILE  12   4.322   1.737 -15.799
    4   HG12  ILE  12          HG12      ILE  12   2.326   0.495 -14.641
    5   HG13  ILE  12          HG13      ILE  12   3.724  -0.436 -15.140
    6   HG22  ILE  12          HG21      ILE  12   6.027   0.715 -14.253
    7   HG21  ILE  12          HG22      ILE  12   5.332   1.659 -12.936
    8   HG23  ILE  12          HG23      ILE  12   6.082   2.476 -14.306
    9   HD12  ILE  12          HD11      ILE  12   2.891  -0.990 -12.848
   10   HD11  ILE  12          HD12      ILE  12   3.276   0.658 -12.353
   11   HD13  ILE  12          HD13      ILE  12   4.553  -0.427 -12.857

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  13           H        ILE  13   3.656   4.042 -16.474
    2    HA   ILE  13           HA       ILE  13   5.799   5.763 -15.767
    3    HB   ILE  13           HB       ILE  13   3.739   5.855 -17.986
    4   HG12  ILE  13          HG12      ILE  13   5.532   3.994 -17.777
    5   HG13  ILE  13          HG13      ILE  13   5.350   4.802 -19.329
    6   HG22  ILE  13          HG21      ILE  13   5.581   7.406 -19.043
    7   HG21  ILE  13          HG22      ILE  13   6.015   7.732 -17.369
    8   HG23  ILE  13          HG23      ILE  13   4.390   8.102 -17.943
    9   HD11  ILE  13          HD11      ILE  13   7.293   6.064 -17.462
   10   HD13  ILE  13          HD12      ILE  13   7.402   5.794 -19.197
   11   HD12  ILE  13          HD13      ILE  13   7.741   4.477 -18.082

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ASN  14           H        ASN  14   2.288   6.252 -15.989
    2    HA   ASN  14           HA       ASN  14   2.249   8.995 -15.338
    3    HB2  ASN  14           HB2      ASN  14   0.348   7.354 -16.153
    4    HB3  ASN  14           HB3      ASN  14   0.049   7.166 -14.429
    5   HD21  ASN  14          HD21      ASN  14  -1.991   8.325 -15.831
    6   HD22  ASN  14          HD22      ASN  14  -2.053   9.997 -15.554

  No H/Q in entry =           6
  In of MODEL   60
    1    H    SER  15           H        SER  15   1.985   6.107 -13.272
    2    HA   SER  15           HA       SER  15   1.706   7.465 -10.813
    3    HB2  SER  15           HB2      SER  15   2.269   5.375  -9.781
    4    HB3  SER  15           HB3      SER  15   1.428   4.960 -11.270
    5    HG   SER  15           HG       SER  15   3.216   4.184 -12.077

  No H/Q in entry =           5
  In of MODEL   60
    1    H    GLY  16           H        GLY  16   4.562   6.383 -12.614
    2    HA3  GLY  16           HA2      GLY  16   6.509   7.134 -10.703
    3    HA2  GLY  16           HA3      GLY  16   6.791   6.941 -12.432

  No H/Q in entry =           3
  In of MODEL   60
    1    H    GLN  17           H        GLN  17   5.084   8.900 -13.463
    2    HA   GLN  17           HA       GLN  17   6.659  11.244 -13.164
    3    HB2  GLN  17           HB2      GLN  17   3.900  10.804 -14.336
    4    HB3  GLN  17           HB3      GLN  17   4.740  12.354 -14.401
    5    HG2  GLN  17           HG2      GLN  17   6.597  11.344 -15.621
    6    HG3  GLN  17           HG3      GLN  17   5.850   9.753 -15.488
    7   HE21  GLN  17          HE21      GLN  17   6.461  11.464 -17.950
    8   HE22  GLN  17          HE22      GLN  17   4.974  11.570 -18.763

  No H/Q in entry =           8
  In of MODEL   60
    1    H    ALA  18           H        ALA  18   3.579  10.211 -11.781
    2    HA   ALA  18           HA       ALA  18   2.863  12.591 -10.494
    3    HB1  ALA  18           HB1      ALA  18   1.738  10.132 -10.715
    4    HB2  ALA  18           HB2      ALA  18   1.200  11.345  -9.555
    5    HB3  ALA  18           HB3      ALA  18   2.301  10.063  -9.045

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ARG  19           H        ARG  19   4.761   9.828  -9.252
    2    HA   ARG  19           HA       ARG  19   5.321  10.975  -6.732
    3    HB2  ARG  19           HB2      ARG  19   5.736   8.576  -7.276
    4    HB3  ARG  19           HB3      ARG  19   7.078   9.071  -8.311
    5    HG2  ARG  19           HG2      ARG  19   8.218  10.105  -6.398
    6    HG3  ARG  19           HG3      ARG  19   6.857   9.708  -5.351
    7    HD2  ARG  19           HD2      ARG  19   8.628   8.077  -5.023
    8    HD3  ARG  19           HD3      ARG  19   7.247   7.294  -5.796
    9    HE   ARG  19           HE       ARG  19   8.923   8.128  -7.860
   10   HH21  ARG  19          HH11      ARG  19  10.478   6.733  -8.737
   11   HH22  ARG  19          HH12      ARG  19  11.039   5.382  -7.815
   12   HH11  ARG  19          HH21      ARG  19   9.037   6.085  -5.093
   13   HH12  ARG  19          HH22      ARG  19  10.221   5.015  -5.750

  No H/Q in entry =          13
  In of MODEL   60
    1    H    SER  20           H        SER  20   7.100  11.026  -9.803
    2    HA   SER  20           HA       SER  20   9.350  12.446  -9.000
    3    HB2  SER  20           HB2      SER  20   9.361  11.583 -11.208
    4    HB3  SER  20           HB3      SER  20   7.850  12.389 -11.612
    5    HG   SER  20           HG       SER  20   9.586  14.220 -10.783

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LEU  21           H        LEU  21   6.232  13.708 -10.152
    2    HA   LEU  21           HA       LEU  21   6.894  16.456  -9.923
    3    HB2  LEU  21           HB2      LEU  21   4.284  14.950  -9.940
    4    HB3  LEU  21           HB3      LEU  21   4.332  16.694  -9.701
    5    HG   LEU  21           HG       LEU  21   5.620  15.284 -12.058
    6   HD13  LEU  21          HD11      LEU  21   3.692  15.989 -13.367
    7   HD12  LEU  21          HD12      LEU  21   2.982  16.777 -11.957
    8   HD11  LEU  21          HD13      LEU  21   3.132  15.022 -12.002
    9   HD21  LEU  21          HD21      LEU  21   5.304  18.139 -11.186
   10   HD23  LEU  21          HD22      LEU  21   5.224  17.803 -12.913
   11   HD22  LEU  21          HD23      LEU  21   6.666  17.377 -12.004

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ALA  22           H        ALA  22   5.420  14.149  -7.667
    2    HA   ALA  22           HA       ALA  22   4.834  15.944  -5.584
    3    HB3  ALA  22           HB1      ALA  22   4.082  13.549  -5.749
    4    HB2  ALA  22           HB2      ALA  22   4.688  14.016  -4.160
    5    HB1  ALA  22           HB3      ALA  22   5.702  13.067  -5.248

  No H/Q in entry =           5
  In of MODEL   60
    1    H    TYR  23           H        TYR  23   7.772  13.934  -6.069
    2    HA   TYR  23           HA       TYR  23   9.178  14.949  -3.829
    3    HB2  TYR  23           HB2      TYR  23   9.961  12.951  -5.005
    4    HB3  TYR  23           HB3      TYR  23  10.249  13.896  -6.465
    5    HD1  TYR  23           HD1      TYR  23  11.256  13.570  -2.883
    6    HD2  TYR  23           HD2      TYR  23  12.282  15.061  -6.779
    7    HE1  TYR  23           HE1      TYR  23  13.523  14.157  -2.063
    8    HE2  TYR  23           HE2      TYR  23  14.547  15.648  -5.960
    9    HH   TYR  23           HH       TYR  23  16.068  15.097  -4.210

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ALA  24           H        ALA  24   8.948  16.071  -7.187
    2    HA   ALA  24           HA       ALA  24  10.835  18.165  -6.954
    3    HB2  ALA  24           HB1      ALA  24  10.365  18.236  -9.157
    4    HB3  ALA  24           HB2      ALA  24   8.810  18.975  -8.775
    5    HB1  ALA  24           HB3      ALA  24   8.943  17.224  -8.915

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ALA  25           H        ALA  25   7.366  17.959  -6.291
    2    HA   ALA  25           HA       ALA  25   6.877  20.671  -5.702
    3    HB1  ALA  25           HB1      ALA  25   5.225  18.664  -5.892
    4    HB2  ALA  25           HB2      ALA  25   4.864  19.945  -4.733
    5    HB3  ALA  25           HB3      ALA  25   5.570  18.425  -4.178

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LEU  26           H        LEU  26   7.987  17.988  -3.679
    2    HA   LEU  26           HA       LEU  26   8.114  19.408  -1.237
    3    HB2  LEU  26           HB2      LEU  26   8.224  16.992  -1.244
    4    HB3  LEU  26           HB3      LEU  26   9.682  17.014  -2.233
    5    HG   LEU  26           HG       LEU  26  10.912  18.131  -0.403
    6   HD12  LEU  26          HD11      LEU  26   9.715  18.120   1.872
    7   HD11  LEU  26          HD12      LEU  26   8.216  17.977   0.956
    8   HD13  LEU  26          HD13      LEU  26   9.249  19.391   0.740
    9   HD21  LEU  26          HD21      LEU  26   9.405  15.649   0.478
   10   HD23  LEU  26          HD22      LEU  26  10.926  16.218   1.159
   11   HD22  LEU  26          HD23      LEU  26  10.863  15.666  -0.513

  No H/Q in entry =          11
  In of MODEL   60
    1    H    LYS  27           H        LYS  27  10.502  18.863  -3.794
    2    HA   LYS  27           HA       LYS  27  12.693  20.112  -2.588
    3    HB2  LYS  27           HB2      LYS  27  12.778  18.776  -4.685
    4    HB3  LYS  27           HB3      LYS  27  11.993  20.106  -5.534
    5    HG2  LYS  27           HG2      LYS  27  13.855  21.602  -4.973
    6    HG3  LYS  27           HG3      LYS  27  14.636  20.310  -4.052
    7    HD2  LYS  27           HD2      LYS  27  14.763  18.933  -6.114
    8    HD3  LYS  27           HD3      LYS  27  14.027  20.251  -7.028
    9    HE2  LYS  27           HE2      LYS  27  15.912  21.727  -6.432
   10    HE3  LYS  27           HE3      LYS  27  16.652  20.413  -5.510
   11    HZ3  LYS  27           HZ1      LYS  27  17.614  20.530  -7.708
   12    HZ2  LYS  27           HZ2      LYS  27  16.079  20.405  -8.430
   13    HZ1  LYS  27           HZ3      LYS  27  16.722  19.094  -7.559

  No H/Q in entry =          13
  In of MODEL   60
    1    H    GLN  28           H        GLN  28  10.037  21.485  -4.497
    2    HA   GLN  28           HA       GLN  28  10.976  24.145  -4.650
    3    HB2  GLN  28           HB2      GLN  28   8.150  23.060  -4.501
    4    HB3  GLN  28           HB3      GLN  28   8.553  24.733  -4.887
    5    HG2  GLN  28           HG2      GLN  28   9.545  22.323  -6.437
    6    HG3  GLN  28           HG3      GLN  28   8.189  23.338  -6.925
    7   HE21  GLN  28          HE21      GLN  28  11.339  22.882  -7.676
    8   HE22  GLN  28          HE22      GLN  28  11.791  24.470  -8.071

  No H/Q in entry =           8
  In of MODEL   60
    1    H    ALA  29           H        ALA  29   9.087  22.428  -2.197
    2    HA   ALA  29           HA       ALA  29   8.544  24.608  -0.498
    3    HB2  ALA  29           HB1      ALA  29   7.846  23.027   1.072
    4    HB1  ALA  29           HB2      ALA  29   9.070  21.854   0.586
    5    HB3  ALA  29           HB3      ALA  29   7.668  22.142  -0.443

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LYS  30           H        LYS  30  11.289  22.361  -0.613
    2    HA   LYS  30           HA       LYS  30  12.629  23.314   1.678
    3    HB2  LYS  30           HB2      LYS  30  13.703  22.048  -0.852
    4    HB3  LYS  30           HB3      LYS  30  14.701  22.408   0.559
    5    HG2  LYS  30           HG2      LYS  30  13.175  21.007   1.951
    6    HG3  LYS  30           HG3      LYS  30  12.275  20.585   0.491
    7    HD2  LYS  30           HD2      LYS  30  14.314  19.619  -0.501
    8    HD3  LYS  30           HD3      LYS  30  15.233  20.054   0.942
    9    HE2  LYS  30           HE2      LYS  30  13.757  18.606   2.308
   10    HE3  LYS  30           HE3      LYS  30  12.867  18.150   0.849
   11    HZ2  LYS  30           HZ1      LYS  30  14.680  16.582   1.580
   12    HZ1  LYS  30           HZ2      LYS  30  15.802  17.780   1.120
   13    HZ3  LYS  30           HZ3      LYS  30  14.757  17.093  -0.035

  No H/Q in entry =          13
  In of MODEL   60
    1    H    GLN  31           H        GLN  31  12.469  24.533  -1.612
    2    HA   GLN  31           HA       GLN  31  14.613  26.440  -1.208
    3    HB2  GLN  31           HB2      GLN  31  12.542  26.482  -3.407
    4    HB3  GLN  31           HB3      GLN  31  14.157  27.190  -3.425
    5    HG2  GLN  31           HG2      GLN  31  14.646  24.495  -2.868
    6    HG3  GLN  31           HG3      GLN  31  13.328  24.436  -4.030
    7   HE21  GLN  31          HE21      GLN  31  16.172  23.666  -4.474
    8   HE22  GLN  31          HE22      GLN  31  16.720  24.650  -5.743

  No H/Q in entry =           8
  In of MODEL   60
    1    H    GLY  32           H        GLY  32  11.555  26.230  -0.025
    2    HA3  GLY  32           HA2      GLY  32  10.404  27.783   1.270
    3    HA2  GLY  32           HA3      GLY  32  11.513  29.030   0.711

  No H/Q in entry =           3
  In of MODEL   60
    1    H    ASP  33           H        ASP  33  10.131  27.127  -1.772
    2    HA   ASP  33           HA       ASP  33   8.439  29.391  -2.596
    3    HB2  ASP  33           HB2      ASP  33   9.532  26.987  -4.063
    4    HB3  ASP  33           HB3      ASP  33   8.363  28.097  -4.774

  No H/Q in entry =           4
  In of MODEL   60
    1    H    PHE  34           H        PHE  34   6.774  28.896  -1.013
    2    HA   PHE  34           HA       PHE  34   5.414  26.413  -0.912
    3    HB2  PHE  34           HB2      PHE  34   4.441  29.190  -0.207
    4    HB3  PHE  34           HB3      PHE  34   3.609  27.691   0.208
    5    HD1  PHE  34           HD1      PHE  34   5.856  30.100   1.405
    6    HD2  PHE  34           HD2      PHE  34   5.207  25.855   1.341
    7    HE1  PHE  34           HE1      PHE  34   7.275  29.851   3.423
    8    HE2  PHE  34           HE2      PHE  34   6.628  25.609   3.356
    9    HZ   PHE  34           HZ       PHE  34   7.655  27.609   4.397

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ALA  35           H        ALA  35   4.937  29.282  -2.903
    2    HA   ALA  35           HA       ALA  35   2.377  28.654  -3.899
    3    HB3  ALA  35           HB1      ALA  35   3.393  30.063  -5.943
    4    HB2  ALA  35           HB2      ALA  35   4.623  30.428  -4.733
    5    HB1  ALA  35           HB3      ALA  35   2.934  30.823  -4.419

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ALA  36           H        ALA  36   5.593  28.011  -5.297
    2    HA   ALA  36           HA       ALA  36   4.587  26.585  -7.535
    3    HB3  ALA  36           HB1      ALA  36   6.737  26.728  -8.177
    4    HB2  ALA  36           HB2      ALA  36   7.243  25.697  -6.838
    5    HB1  ALA  36           HB3      ALA  36   7.127  27.443  -6.613

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ALA  37           H        ALA  37   5.592  25.583  -4.297
    2    HA   ALA  37           HA       ALA  37   5.549  22.796  -4.738
    3    HB2  ALA  37           HB1      ALA  37   5.305  24.574  -2.348
    4    HB1  ALA  37           HB2      ALA  37   6.444  23.267  -2.661
    5    HB3  ALA  37           HB3      ALA  37   4.791  22.898  -2.171

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LYS  38           H        LYS  38   3.014  24.979  -3.528
    2    HA   LYS  38           HA       LYS  38   0.932  23.149  -3.287
    3    HB2  LYS  38           HB2      LYS  38   1.266  25.907  -3.028
    4    HB3  LYS  38           HB3      LYS  38   0.051  25.756  -4.292
    5    HG2  LYS  38           HG2      LYS  38  -1.370  24.415  -2.837
    6    HG3  LYS  38           HG3      LYS  38  -0.109  24.359  -1.597
    7    HD2  LYS  38           HD2      LYS  38  -0.307  26.692  -1.136
    8    HD3  LYS  38           HD3      LYS  38  -1.240  26.981  -2.606
    9    HE2  LYS  38           HE2      LYS  38  -2.719  26.994  -0.647
   10    HE3  LYS  38           HE3      LYS  38  -3.096  25.620  -1.691
   11    HZ3  LYS  38           HZ1      LYS  38  -2.339  24.148  -0.174
   12    HZ2  LYS  38           HZ2      LYS  38  -2.686  25.397   0.926
   13    HZ1  LYS  38           HZ3      LYS  38  -1.096  25.161   0.379

  No H/Q in entry =          13
  In of MODEL   60
    1    H    ALA  39           H        ALA  39   1.860  25.072  -6.139
    2    HA   ALA  39           HA       ALA  39  -0.230  24.197  -7.820
    3    HB2  ALA  39           HB1      ALA  39   2.488  24.871  -8.905
    4    HB1  ALA  39           HB2      ALA  39   1.521  26.121  -8.122
    5    HB3  ALA  39           HB3      ALA  39   0.897  25.286  -9.544

  No H/Q in entry =           5
  In of MODEL   60
    1    H    MET  40           H        MET  40   3.025  22.920  -7.287
    2    HA   MET  40           HA       MET  40   2.917  20.909  -9.287
    3    HB2  MET  40           HB2      MET  40   4.559  21.133  -6.758
    4    HB3  MET  40           HB3      MET  40   4.804  19.885  -7.981
    5    HG2  MET  40           HG2      MET  40   4.830  22.844  -8.633
    6    HG3  MET  40           HG3      MET  40   6.289  21.951  -8.207
    7    HE3  MET  40           HE1      MET  40   7.143  19.755 -11.037
    8    HE2  MET  40           HE2      MET  40   6.603  19.424  -9.394
    9    HE1  MET  40           HE3      MET  40   7.684  20.781  -9.701

  No H/Q in entry =           9
  In of MODEL   60
    1    H    MET  41           H        MET  41   2.046  20.928  -5.851
    2    HA   MET  41           HA       MET  41   1.539  18.158  -5.580
    3    HB2  MET  41           HB2      MET  41   0.205  20.499  -4.201
    4    HB3  MET  41           HB3      MET  41   0.069  18.817  -3.699
    5    HG2  MET  41           HG2      MET  41   2.777  19.062  -3.769
    6    HG3  MET  41           HG3      MET  41   2.328  20.715  -3.360
    7    HE2  MET  41           HE1      MET  41  -0.679  19.430  -1.602
    8    HE1  MET  41           HE2      MET  41   0.121  20.951  -1.983
    9    HE3  MET  41           HE3      MET  41   0.087  20.372  -0.317

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ASP  42           H        ASP  42  -0.534  20.870  -6.515
    2    HA   ASP  42           HA       ASP  42  -2.965  19.491  -6.627
    3    HB2  ASP  42           HB2      ASP  42  -2.282  22.068  -6.880
    4    HB3  ASP  42           HB3      ASP  42  -2.452  21.680  -8.589

  No H/Q in entry =           4
  In of MODEL   60
    1    H    GLN  43           H        GLN  43  -0.561  20.113  -9.157
    2    HA   GLN  43           HA       GLN  43  -1.964  18.792 -11.235
    3    HB2  GLN  43           HB2      GLN  43   0.995  19.331 -10.888
    4    HB3  GLN  43           HB3      GLN  43   0.268  18.692 -12.364
    5    HG2  GLN  43           HG2      GLN  43  -1.261  20.707 -12.377
    6    HG3  GLN  43           HG3      GLN  43  -0.297  21.364 -11.058
    7   HE21  GLN  43          HE21      GLN  43  -0.175  22.996 -13.139
    8   HE22  GLN  43          HE22      GLN  43   1.230  22.790 -14.065

  No H/Q in entry =           8
  In of MODEL   60
    1    H    SER  44           H        SER  44   0.426  17.660  -8.879
    2    HA   SER  44           HA       SER  44   0.770  15.061  -9.921
    3    HB2  SER  44           HB2      SER  44   1.681  16.497  -7.689
    4    HB3  SER  44           HB3      SER  44   0.839  15.103  -7.014
    5    HG   SER  44           HG       SER  44   2.949  14.503  -7.470

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ARG  45           H        ARG  45  -1.531  16.349  -7.548
    2    HA   ARG  45           HA       ARG  45  -2.889  13.974  -6.906
    3    HB2  ARG  45           HB2      ARG  45  -3.091  16.135  -5.702
    4    HB3  ARG  45           HB3      ARG  45  -3.970  16.801  -7.075
    5    HG2  ARG  45           HG2      ARG  45  -5.718  15.059  -6.777
    6    HG3  ARG  45           HG3      ARG  45  -4.850  14.447  -5.368
    7    HD2  ARG  45           HD2      ARG  45  -5.063  16.707  -4.299
    8    HD3  ARG  45           HD3      ARG  45  -6.072  17.225  -5.666
    9    HE   ARG  45           HE       ARG  45  -7.148  14.835  -4.623
   10   HH21  ARG  45          HH11      ARG  45  -8.968  14.888  -3.329
   11   HH22  ARG  45          HH12      ARG  45  -9.364  16.320  -2.448
   12   HH11  ARG  45          HH21      ARG  45  -6.617  18.081  -3.591
   13   HH12  ARG  45          HH22      ARG  45  -8.028  18.129  -2.595

  No H/Q in entry =          13
  In of MODEL   60
    1    H    MET  46           H        MET  46  -3.527  16.385  -9.438
    2    HA   MET  46           HA       MET  46  -5.869  15.197 -10.476
    3    HB2  MET  46           HB2      MET  46  -3.797  17.039 -11.681
    4    HB3  MET  46           HB3      MET  46  -5.202  16.486 -12.597
    5    HG2  MET  46           HG2      MET  46  -6.699  17.398 -10.874
    6    HG3  MET  46           HG3      MET  46  -5.313  17.922  -9.926
    7    HE2  MET  46           HE1      MET  46  -5.686  20.614  -9.874
    8    HE1  MET  46           HE2      MET  46  -7.246  19.870 -10.209
    9    HE3  MET  46           HE3      MET  46  -6.735  21.283 -11.131

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ALA  47           H        ALA  47  -2.446  14.752 -11.279
    2    HA   ALA  47           HA       ALA  47  -2.803  13.031 -13.493
    3    HB3  ALA  47           HB1      ALA  47  -0.630  13.939 -13.164
    4    HB2  ALA  47           HB2      ALA  47  -0.469  12.210 -12.840
    5    HB1  ALA  47           HB3      ALA  47  -0.555  13.355 -11.501

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LEU  48           H        LEU  48  -2.484  12.382 -10.026
    2    HA   LEU  48           HA       LEU  48  -2.555   9.542 -10.196
    3    HB2  LEU  48           HB2      LEU  48  -3.308  11.443  -7.964
    4    HB3  LEU  48           HB3      LEU  48  -3.196   9.692  -7.773
    5    HG   LEU  48           HG       LEU  48  -0.925  11.417  -8.791
    6   HD13  LEU  48          HD11      LEU  48  -1.187  12.175  -6.593
    7   HD12  LEU  48          HD12      LEU  48  -0.010  10.877  -6.415
    8   HD11  LEU  48          HD13      LEU  48  -1.701  10.597  -5.998
    9   HD22  LEU  48          HD21      LEU  48  -0.415   9.239  -9.448
   10   HD21  LEU  48          HD22      LEU  48  -1.261   8.510  -8.084
   11   HD23  LEU  48          HD23      LEU  48   0.308   9.276  -7.841

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ASN  49           H        ASN  49  -5.036  12.010  -9.752
    2    HA   ASN  49           HA       ASN  49  -7.199  10.323  -9.193
    3    HB2  ASN  49           HB2      ASN  49  -7.285  12.737  -8.852
    4    HB3  ASN  49           HB3      ASN  49  -7.128  13.018 -10.582
    5   HD21  ASN  49          HD21      ASN  49  -9.295  11.459  -8.192
    6   HD22  ASN  49          HD22      ASN  49 -10.711  11.703  -9.091

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLU  50           H        GLU  50  -5.969  11.545 -12.291
    2    HA   GLU  50           HA       GLU  50  -7.933  10.280 -13.918
    3    HB2  GLU  50           HB2      GLU  50  -6.494  12.116 -14.742
    4    HB3  GLU  50           HB3      GLU  50  -5.088  11.056 -14.626
    5    HG2  GLU  50           HG2      GLU  50  -6.068   9.519 -16.257
    6    HG3  GLU  50           HG3      GLU  50  -7.539  10.484 -16.322

  No H/Q in entry =           6
  In of MODEL   60
    1    H    ALA  51           H        ALA  51  -4.738   9.311 -12.756
    2    HA   ALA  51           HA       ALA  51  -4.594   6.866 -14.187
    3    HB2  ALA  51           HB1      ALA  51  -2.597   6.591 -13.113
    4    HB1  ALA  51           HB2      ALA  51  -3.269   7.000 -11.535
    5    HB3  ALA  51           HB3      ALA  51  -2.839   8.280 -12.669

  No H/Q in entry =           5
  In of MODEL   60
    1    H    HIS  52           H        HIS  52  -5.734   7.672 -10.920
    2    HA   HIS  52           HA       HIS  52  -6.386   5.052 -10.092
    3    HB2  HIS  52           HB2      HIS  52  -6.250   6.940  -8.534
    4    HB3  HIS  52           HB3      HIS  52  -7.648   7.689  -9.306
    5    HD1  HIS  52           HD1      HIS  52  -9.847   5.944  -9.371
    6    HD2  HIS  52           HD2      HIS  52  -6.986   5.371  -6.394
    7    HE1  HIS  52           HE1      HIS  52 -10.961   4.563  -7.563
    8    HE2  HIS  52           HE2      HIS  52  -9.230   4.204  -5.741

  No H/Q in entry =           8
  In of MODEL   60
    1    H    LEU  53           H        LEU  53  -8.249   7.502 -11.846
    2    HA   LEU  53           HA       LEU  53 -10.743   6.188 -11.834
    3    HB2  LEU  53           HB2      LEU  53  -9.506   8.173 -13.736
    4    HB3  LEU  53           HB3      LEU  53 -11.119   7.515 -13.995
    5    HG   LEU  53           HG       LEU  53 -10.294   8.841 -11.392
    6   HD11  LEU  53          HD11      LEU  53 -11.577  10.026 -13.867
    7   HD13  LEU  53          HD12      LEU  53 -10.070  10.528 -13.097
    8   HD12  LEU  53          HD13      LEU  53 -11.611  10.806 -12.291
    9   HD22  LEU  53          HD21      LEU  53 -12.282   7.634 -10.987
   10   HD21  LEU  53          HD22      LEU  53 -12.891   7.917 -12.614
   11   HD23  LEU  53          HD23      LEU  53 -12.906   9.216 -11.436

  No H/Q in entry =          11
  In of MODEL   60
    1    H    VAL  54           H        VAL  54  -8.019   6.025 -14.106
    2    HA   VAL  54           HA       VAL  54  -9.249   4.252 -15.942
    3    HB   VAL  54           HB       VAL  54  -6.338   4.780 -15.293
    4   HG12  VAL  54          HG11      VAL  54  -6.110   3.708 -17.690
    5   HG11  VAL  54          HG12      VAL  54  -7.627   2.912 -17.271
    6   HG13  VAL  54          HG13      VAL  54  -6.197   2.665 -16.271
    7   HG22  VAL  54          HG21      VAL  54  -7.136   6.722 -16.319
    8   HG21  VAL  54          HG22      VAL  54  -8.334   5.853 -17.277
    9   HG23  VAL  54          HG23      VAL  54  -6.632   5.789 -17.728

  No H/Q in entry =           9
  In of MODEL   60
    1    H    GLN  55           H        GLN  55  -7.210   3.710 -13.070
    2    HA   GLN  55           HA       GLN  55  -7.100   0.895 -13.340
    3    HB2  GLN  55           HB2      GLN  55  -5.534   1.797 -11.836
    4    HB3  GLN  55           HB3      GLN  55  -6.748   2.749 -10.987
    5    HG2  GLN  55           HG2      GLN  55  -7.406   0.980  -9.669
    6    HG3  GLN  55           HG3      GLN  55  -7.187  -0.199 -10.956
    7   HE21  GLN  55          HE21      GLN  55  -5.546  -1.637 -10.488
    8   HE22  GLN  55          HE22      GLN  55  -4.153  -1.279  -9.591

  No H/Q in entry =           8
  In of MODEL   60
    1    H    THR  56           H        THR  56  -9.429   3.031 -11.687
    2    HA   THR  56           HA       THR  56 -10.982   1.129 -10.388
    3    HB   THR  56           HB       THR  56 -12.096   3.526 -11.867
    4    HG1  THR  56           HG1      THR  56 -11.286   3.550  -9.186
    5   HG21  THR  56          HG21      THR  56 -13.392   1.560 -10.460
    6   HG23  THR  56          HG22      THR  56 -13.994   3.206 -10.670
    7   HG22  THR  56          HG23      THR  56 -13.106   2.770  -9.210

  No H/Q in entry =           7
  In of MODEL   60
    1    H    LYS  57           H        LYS  57 -11.234   2.225 -13.766
    2    HA   LYS  57           HA       LYS  57 -13.385   0.524 -14.501
    3    HB2  LYS  57           HB2      LYS  57 -12.540   2.488 -15.820
    4    HB3  LYS  57           HB3      LYS  57 -11.099   1.560 -16.210
    5    HG2  LYS  57           HG2      LYS  57 -12.465  -0.124 -17.355
    6    HG3  LYS  57           HG3      LYS  57 -13.931   0.754 -16.935
    7    HD2  LYS  57           HD2      LYS  57 -13.145   2.697 -18.249
    8    HD3  LYS  57           HD3      LYS  57 -11.681   1.816 -18.679
    9    HE2  LYS  57           HE2      LYS  57 -13.294   1.633 -20.511
   10    HE3  LYS  57           HE3      LYS  57 -13.112   0.049 -19.758
   11    HZ1  LYS  57           HZ1      LYS  57 -15.128   1.568 -18.463
   12    HZ3  LYS  57           HZ2      LYS  57 -15.234   0.039 -19.198
   13    HZ2  LYS  57           HZ3      LYS  57 -15.448   1.448 -20.125

  No H/Q in entry =          13
  In of MODEL   60
    1    H    LEU  58           H        LEU  58  -9.877   0.121 -14.488
    2    HA   LEU  58           HA       LEU  58  -9.880  -2.390 -15.788
    3    HB2  LEU  58           HB2      LEU  58  -7.835  -1.090 -13.998
    4    HB3  LEU  58           HB3      LEU  58  -7.572  -2.605 -14.862
    5    HG   LEU  58           HG       LEU  58  -8.363  -0.002 -16.205
    6   HD11  LEU  58          HD11      LEU  58  -5.699  -1.220 -15.551
    7   HD13  LEU  58          HD12      LEU  58  -6.207   0.467 -15.489
    8   HD12  LEU  58          HD13      LEU  58  -5.880  -0.295 -17.042
    9   HD22  LEU  58          HD21      LEU  58  -8.945  -1.561 -17.796
   10   HD21  LEU  58          HD22      LEU  58  -7.886  -2.803 -17.132
   11   HD23  LEU  58          HD23      LEU  58  -7.218  -1.520 -18.140

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  59           H        ILE  59 -10.670  -1.508 -12.523
    2    HA   ILE  59           HA       ILE  59 -10.285  -4.276 -11.592
    3    HB   ILE  59           HB       ILE  59  -9.849  -2.006 -10.190
    4   HG12  ILE  59          HG12      ILE  59 -11.158  -4.392  -8.868
    5   HG13  ILE  59          HG13      ILE  59  -9.519  -4.429  -9.465
    6   HG23  ILE  59          HG21      ILE  59 -11.672  -1.362  -8.834
    7   HG22  ILE  59          HG22      ILE  59 -12.599  -2.792  -9.227
    8   HG21  ILE  59          HG23      ILE  59 -12.391  -1.513 -10.420
    9   HD11  ILE  59          HD11      ILE  59  -9.000  -2.434  -8.061
   10   HD13  ILE  59          HD12      ILE  59  -9.444  -3.850  -7.116
   11   HD12  ILE  59          HD13      ILE  59 -10.615  -2.556  -7.370

  No H/Q in entry =          11
  In of MODEL   60
    1    H    GLU  60           H        GLU  60 -12.872  -1.979 -12.360
    2    HA   GLU  60           HA       GLU  60 -15.032  -3.518 -11.328
    3    HB2  GLU  60           HB2      GLU  60 -16.379  -1.907 -12.262
    4    HB3  GLU  60           HB3      GLU  60 -14.854  -1.029 -12.309
    5    HG2  GLU  60           HG2      GLU  60 -14.504  -1.951 -14.644
    6    HG3  GLU  60           HG3      GLU  60 -16.151  -2.547 -14.578

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLY  61           H        GLY  61 -13.395  -3.476 -14.462
    2    HA3  GLY  61           HA2      GLY  61 -15.100  -5.731 -15.341
    3    HA2  GLY  61           HA3      GLY  61 -14.277  -4.615 -16.425

  No H/Q in entry =           3
  In of MODEL   60
    1    H    ASP  62           H        ASP  62 -12.859  -6.066 -13.563
    2    HA   ASP  62           HA       ASP  62 -10.594  -6.989 -15.046
    3    HB2  ASP  62           HB2      ASP  62  -9.910  -7.902 -12.810
    4    HB3  ASP  62           HB3      ASP  62 -10.295  -6.185 -12.793

  No H/Q in entry =           4
  In of MODEL   60
    1    H    ALA  63           H        ALA  63 -13.595  -8.306 -15.035
    2    HA   ALA  63           HA       ALA  63 -13.294 -11.038 -14.407
    3    HB1  ALA  63           HB1      ALA  63 -14.898 -10.074 -16.780
    4    HB2  ALA  63           HB2      ALA  63 -15.401  -9.667 -15.140
    5    HB3  ALA  63           HB3      ALA  63 -15.291 -11.357 -15.637

  No H/Q in entry =           5
  In of MODEL   60
    1    H    GLY  64           H        GLY  64 -12.620  -9.241 -17.366
    2    HA3  GLY  64           HA2      GLY  64 -11.497  -9.773 -19.294
    3    HA2  GLY  64           HA3      GLY  64 -10.450 -10.719 -18.244

  No H/Q in entry =           3
  In of MODEL   60
    1    H    GLU  65           H        GLU  65 -10.171 -12.647 -19.226
    2    HA   GLU  65           HA       GLU  65 -11.862 -13.838 -21.058
    3    HB2  GLU  65           HB2      GLU  65  -9.926 -15.173 -19.163
    4    HB3  GLU  65           HB3      GLU  65 -10.662 -15.952 -20.566
    5    HG2  GLU  65           HG2      GLU  65  -8.652 -15.191 -21.466
    6    HG3  GLU  65           HG3      GLU  65  -9.740 -13.860 -21.858

  No H/Q in entry =           6
  In of MODEL   60
    1    H    GLY  66           H        GLY  66 -12.362 -16.361 -20.419
    2    HA3  GLY  66           HA2      GLY  66 -14.898 -16.319 -19.206
    3    HA2  GLY  66           HA3      GLY  66 -13.998 -17.750 -19.666

  No H/Q in entry =           3
  In of MODEL   60
    1    H    LYS  67           H        LYS  67 -11.751 -17.170 -17.943
    2    HA   LYS  67           HA       LYS  67 -12.583 -18.547 -15.641
    3    HB2  LYS  67           HB2      LYS  67 -10.024 -17.105 -16.308
    4    HB3  LYS  67           HB3      LYS  67 -10.242 -18.091 -14.856
    5    HG2  LYS  67           HG2      LYS  67 -10.863 -20.026 -16.249
    6    HG3  LYS  67           HG3      LYS  67 -10.667 -19.048 -17.703
    7    HD2  LYS  67           HD2      LYS  67  -8.274 -18.706 -17.124
    8    HD3  LYS  67           HD3      LYS  67  -8.487 -19.754 -15.719
    9    HE2  LYS  67           HE2      LYS  67  -9.079 -20.614 -18.566
   10    HE3  LYS  67           HE3      LYS  67  -7.556 -20.942 -17.738
   11    HZ3  LYS  67           HZ1      LYS  67  -8.710 -22.823 -17.239
   12    HZ2  LYS  67           HZ2      LYS  67 -10.221 -22.050 -17.246
   13    HZ1  LYS  67           HZ3      LYS  67  -9.176 -21.866 -15.920

  No H/Q in entry =          13
  In of MODEL   60
    1    H    MET  68           H        MET  68 -12.698 -18.040 -13.528
    2    HA   MET  68           HA       MET  68 -14.016 -15.683 -12.797
    3    HB2  MET  68           HB2      MET  68 -12.615 -17.736 -11.083
    4    HB3  MET  68           HB3      MET  68 -13.734 -16.512 -10.484
    5    HG2  MET  68           HG2      MET  68 -14.416 -18.597 -12.577
    6    HG3  MET  68           HG3      MET  68 -14.853 -18.701 -10.871
    7    HE3  MET  68           HE1      MET  68 -17.456 -16.275 -10.156
    8    HE2  MET  68           HE2      MET  68 -15.819 -15.626 -10.064
    9    HE1  MET  68           HE3      MET  68 -16.118 -17.307  -9.626

  No H/Q in entry =           9
  In of MODEL   60
    1    H    LYS  69           H        LYS  69 -10.574 -16.549 -12.336
    2    HA   LYS  69           HA       LYS  69  -9.790 -14.604 -10.582
    3    HB2  LYS  69           HB2      LYS  69  -7.536 -14.835 -11.508
    4    HB3  LYS  69           HB3      LYS  69  -8.339 -16.403 -11.410
    5    HG2  LYS  69           HG2      LYS  69  -8.924 -16.292 -13.783
    6    HG3  LYS  69           HG3      LYS  69  -8.227 -14.677 -13.902
    7    HD2  LYS  69           HD2      LYS  69  -6.556 -16.150 -14.747
    8    HD3  LYS  69           HD3      LYS  69  -6.028 -15.731 -13.116
    9    HE2  LYS  69           HE2      LYS  69  -6.756 -17.816 -12.230
   10    HE3  LYS  69           HE3      LYS  69  -7.701 -18.185 -13.671
   11    HZ3  LYS  69           HZ1      LYS  69  -5.939 -19.178 -14.528
   12    HZ2  LYS  69           HZ2      LYS  69  -5.026 -18.811 -13.145
   13    HZ1  LYS  69           HZ3      LYS  69  -5.059 -17.731 -14.457

  No H/Q in entry =          13
  In of MODEL   60
    1    H    VAL  70           H        VAL  70  -7.826 -12.974 -11.567
    2    HA   VAL  70           HA       VAL  70  -9.207 -11.050 -13.346
    3    HB   VAL  70           HB       VAL  70  -8.321  -9.237 -11.891
    4   HG11  VAL  70          HG11      VAL  70 -10.630 -10.434 -11.649
    5   HG13  VAL  70          HG12      VAL  70 -10.098  -9.361 -10.355
    6   HG12  VAL  70          HG13      VAL  70  -9.940 -11.107 -10.173
    7   HG21  VAL  70          HG21      VAL  70  -7.285 -11.617 -10.371
    8   HG23  VAL  70          HG22      VAL  70  -7.755 -10.175  -9.474
    9   HG22  VAL  70          HG23      VAL  70  -6.490 -10.078 -10.697

  No H/Q in entry =           9
  In of MODEL   60
    1    H    SER  71           H        SER  71  -7.664  -9.400 -14.198
    2    HA   SER  71           HA       SER  71  -5.463 -10.590 -15.513
    3    HB2  SER  71           HB2      SER  71  -6.660  -8.570 -16.342
    4    HB3  SER  71           HB3      SER  71  -5.984  -7.648 -15.002
    5    HG   SER  71           HG       SER  71  -3.964  -8.883 -16.082

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LEU  72           H        LEU  72  -3.382 -10.823 -14.943
    2    HA   LEU  72           HA       LEU  72  -2.631 -10.613 -12.240
    3    HB2  LEU  72           HB2      LEU  72  -0.999 -11.015 -14.741
    4    HB3  LEU  72           HB3      LEU  72  -0.324 -11.098 -13.117
    5    HG   LEU  72           HG       LEU  72  -2.675 -12.794 -14.017
    6   HD11  LEU  72          HD11      LEU  72   0.298 -13.378 -14.024
    7   HD13  LEU  72          HD12      LEU  72  -0.809 -13.438 -15.395
    8   HD12  LEU  72          HD13      LEU  72  -0.937 -14.635 -14.107
    9   HD22  LEU  72          HD21      LEU  72  -2.650 -12.813 -11.663
   10   HD21  LEU  72          HD22      LEU  72  -0.899 -12.709 -11.572
   11   HD23  LEU  72          HD23      LEU  72  -1.666 -14.217 -12.060

  No H/Q in entry =          11
  In of MODEL   60
    1    H    VAL  73           H        VAL  73  -1.963  -8.581 -15.021
    2    HA   VAL  73           HA       VAL  73  -0.042  -6.872 -13.933
    3    HB   VAL  73           HB       VAL  73  -0.421  -5.488 -15.794
    4   HG13  VAL  73          HG11      VAL  73  -0.509  -7.042 -17.632
    5   HG12  VAL  73          HG12      VAL  73  -1.417  -8.209 -16.672
    6   HG11  VAL  73          HG13      VAL  73   0.269  -7.871 -16.286
    7   HG23  VAL  73          HG21      VAL  73  -2.593  -5.746 -17.125
    8   HG22  VAL  73          HG22      VAL  73  -2.732  -4.938 -15.564
    9   HG21  VAL  73          HG23      VAL  73  -3.224  -6.624 -15.731

  No H/Q in entry =           9
  In of MODEL   60
    1    H    LEU  74           H        LEU  74  -3.432  -7.015 -13.336
    2    HA   LEU  74           HA       LEU  74  -4.063  -4.366 -12.707
    3    HB2  LEU  74           HB2      LEU  74  -5.782  -6.041 -12.866
    4    HB3  LEU  74           HB3      LEU  74  -5.068  -6.968 -11.549
    5    HG   LEU  74           HG       LEU  74  -5.526  -5.108  -9.988
    6   HD13  LEU  74          HD11      LEU  74  -5.430  -3.163 -11.345
    7   HD12  LEU  74          HD12      LEU  74  -7.134  -3.320 -10.922
    8   HD11  LEU  74          HD13      LEU  74  -6.570  -3.825 -12.516
    9   HD23  LEU  74          HD21      LEU  74  -8.099  -5.522 -11.417
   10   HD22  LEU  74          HD22      LEU  74  -7.700  -5.701  -9.722
   11   HD21  LEU  74          HD23      LEU  74  -7.233  -6.948 -10.854

  No H/Q in entry =          11
  In of MODEL   60
    1    H    VAL  75           H        VAL  75  -2.978  -6.953 -10.567
    2    HA   VAL  75           HA       VAL  75  -2.763  -5.409  -8.220
    3    HB   VAL  75           HB       VAL  75  -1.258  -7.890  -9.037
    4   HG12  VAL  75          HG11      VAL  75  -0.770  -8.048  -6.569
    5   HG11  VAL  75          HG12      VAL  75  -1.450  -6.440  -6.371
    6   HG13  VAL  75          HG13      VAL  75   0.008  -6.660  -7.322
    7   HG23  VAL  75          HG21      VAL  75  -3.522  -7.524  -7.057
    8   HG22  VAL  75          HG22      VAL  75  -2.917  -9.034  -7.737
    9   HG21  VAL  75          HG23      VAL  75  -3.814  -7.905  -8.754

  No H/Q in entry =           9
  In of MODEL   60
    1    H    GLU  76           H        GLU  76  -0.379  -6.142 -10.787
    2    HA   GLU  76           HA       GLU  76   1.810  -4.783  -9.650
    3    HB2  GLU  76           HB2      GLU  76   2.005  -6.248 -11.639
    4    HB3  GLU  76           HB3      GLU  76   1.070  -5.099 -12.581
    5    HG2  GLU  76           HG2      GLU  76   3.395  -4.735 -13.107
    6    HG3  GLU  76           HG3      GLU  76   2.875  -3.373 -12.134

  No H/Q in entry =           6
  In of MODEL   60
    1    H    ALA  77           H        ALA  77  -0.755  -3.592 -11.804
    2    HA   ALA  77           HA       ALA  77   0.213  -0.938 -11.982
    3    HB2  ALA  77           HB1      ALA  77  -1.846  -0.413 -12.996
    4    HB3  ALA  77           HB2      ALA  77  -2.712  -1.653 -12.089
    5    HB1  ALA  77           HB3      ALA  77  -1.612  -2.117 -13.386

  No H/Q in entry =           5
  In of MODEL   60
    1    H    GLN  78           H        GLN  78  -2.018  -2.519  -9.751
    2    HA   GLN  78           HA       GLN  78  -2.826  -0.212  -8.332
    3    HB2  GLN  78           HB2      GLN  78  -3.918  -2.479  -8.242
    4    HB3  GLN  78           HB3      GLN  78  -2.566  -3.034  -7.259
    5    HG2  GLN  78           HG2      GLN  78  -3.073  -1.309  -5.580
    6    HG3  GLN  78           HG3      GLN  78  -4.427  -0.747  -6.561
    7   HE21  GLN  78          HE21      GLN  78  -4.836  -1.747  -3.900
    8   HE22  GLN  78          HE22      GLN  78  -5.697  -3.207  -4.011

  No H/Q in entry =           8
  In of MODEL   60
    1    H    LEU  79           H        LEU  79  -0.125  -2.448  -7.920
    2    HA   LEU  79           HA       LEU  79   0.872  -1.553  -5.471
    3    HB2  LEU  79           HB2      LEU  79   1.746  -3.551  -6.556
    4    HB3  LEU  79           HB3      LEU  79   2.369  -2.589  -7.893
    5    HG   LEU  79           HG       LEU  79   3.932  -1.442  -6.403
    6   HD13  LEU  79          HD11      LEU  79   2.950  -1.213  -4.324
    7   HD12  LEU  79          HD12      LEU  79   4.043  -2.555  -3.997
    8   HD11  LEU  79          HD13      LEU  79   2.337  -2.867  -4.309
    9   HD23  LEU  79          HD21      LEU  79   5.171  -3.584  -5.522
   10   HD22  LEU  79          HD22      LEU  79   4.946  -3.380  -7.257
   11   HD21  LEU  79          HD23      LEU  79   3.887  -4.462  -6.356

  No H/Q in entry =          11
  In of MODEL   60
    1    H    HIS  80           H        HIS  80   1.696  -0.416  -8.749
    2    HA   HIS  80           HA       HIS  80   3.497   1.583  -7.840
    3    HB2  HIS  80           HB2      HIS  80   2.184   0.887 -10.411
    4    HB3  HIS  80           HB3      HIS  80   2.766   2.543 -10.240
    5    HD1  HIS  80           HD1      HIS  80   5.159   2.867 -10.789
    6    HD2  HIS  80           HD2      HIS  80   4.387  -1.055  -9.603
    7    HE1  HIS  80           HE1      HIS  80   7.358   1.610 -10.984
    8    HE2  HIS  80           HE2      HIS  80   6.899  -0.784 -10.265

  No H/Q in entry =           8
  In of MODEL   60
    1    H    LEU  81           H        LEU  81   0.081   1.716  -8.781
    2    HA   LEU  81           HA       LEU  81  -0.216   4.505  -8.436
    3    HB2  LEU  81           HB2      LEU  81  -2.209   2.241  -8.343
    4    HB3  LEU  81           HB3      LEU  81  -2.676   3.940  -8.239
    5    HG   LEU  81           HG       LEU  81  -0.998   2.814 -10.499
    6   HD12  LEU  81          HD11      LEU  81  -3.247   3.118 -11.771
    7   HD11  LEU  81          HD12      LEU  81  -3.984   3.037 -10.172
    8   HD13  LEU  81          HD13      LEU  81  -3.035   1.680 -10.775
    9   HD23  LEU  81          HD21      LEU  81  -2.126   4.952 -11.575
   10   HD22  LEU  81          HD22      LEU  81  -0.700   5.132 -10.557
   11   HD21  LEU  81          HD23      LEU  81  -2.301   5.463  -9.898

  No H/Q in entry =          11
  In of MODEL   60
    1    H    MET  82           H        MET  82  -0.825   1.804  -6.191
    2    HA   MET  82           HA       MET  82  -1.868   3.372  -4.086
    3    HB2  MET  82           HB2      MET  82  -0.470   0.698  -4.151
    4    HB3  MET  82           HB3      MET  82  -1.038   1.412  -2.644
    5    HG2  MET  82           HG2      MET  82  -2.793   0.911  -5.067
    6    HG3  MET  82           HG3      MET  82  -2.689  -0.167  -3.677
    7    HE3  MET  82           HE1      MET  82  -4.396   1.455  -0.837
    8    HE2  MET  82           HE2      MET  82  -2.671   1.751  -1.040
    9    HE1  MET  82           HE3      MET  82  -3.349   0.188  -1.492

  No H/Q in entry =           9
  In of MODEL   60
    1    H    THR  83           H        THR  83   1.435   2.321  -4.816
    2    HA   THR  83           HA       THR  83   2.667   3.428  -2.525
    3    HB   THR  83           HB       THR  83   4.746   3.398  -4.022
    4    HG1  THR  83           HG1      THR  83   4.489   2.878  -6.046
    5   HG22  THR  83          HG21      THR  83   4.324   0.737  -4.360
    6   HG21  THR  83          HG22      THR  83   3.044   1.100  -3.204
    7   HG23  THR  83          HG23      THR  83   4.724   1.458  -2.802

  No H/Q in entry =           7
  In of MODEL   60
    1    H    SER  84           H        SER  84   2.248   4.716  -5.816
    2    HA   SER  84           HA       SER  84   3.568   7.168  -5.366
    3    HB2  SER  84           HB2      SER  84   1.484   6.323  -7.365
    4    HB3  SER  84           HB3      SER  84   2.146   7.957  -7.341
    5    HG   SER  84           HG       SER  84   3.540   5.497  -7.658

  No H/Q in entry =           5
  In of MODEL   60
    1    H    MET  85           H        MET  85   0.084   6.377  -5.158
    2    HA   MET  85           HA       MET  85  -0.796   8.976  -4.537
    3    HB2  MET  85           HB2      MET  85  -2.306   7.152  -5.196
    4    HB3  MET  85           HB3      MET  85  -1.996   6.348  -3.659
    5    HG2  MET  85           HG2      MET  85  -2.901   8.285  -2.442
    6    HG3  MET  85           HG3      MET  85  -3.170   9.126  -3.967
    7    HE3  MET  85           HE1      MET  85  -4.039   5.101  -3.188
    8    HE2  MET  85           HE2      MET  85  -5.337   5.610  -2.110
    9    HE1  MET  85           HE3      MET  85  -3.697   6.195  -1.840

  No H/Q in entry =           9
  In of MODEL   60
    1    H    LEU  86           H        LEU  86   0.173   6.314  -2.415
    2    HA   LEU  86           HA       LEU  86  -0.345   7.602   0.039
    3    HB2  LEU  86           HB2      LEU  86   0.137   5.137  -0.371
    4    HB3  LEU  86           HB3      LEU  86   1.839   5.583  -0.483
    5    HG   LEU  86           HG       LEU  86   1.529   6.732   1.794
    6   HD11  LEU  86          HD11      LEU  86  -1.163   5.943   1.349
    7   HD13  LEU  86          HD12      LEU  86  -0.487   6.691   2.795
    8   HD12  LEU  86          HD13      LEU  86  -0.564   4.934   2.670
    9   HD23  LEU  86          HD21      LEU  86   1.129   3.735   1.908
   10   HD22  LEU  86          HD22      LEU  86   2.134   4.749   2.941
   11   HD21  LEU  86          HD23      LEU  86   2.619   4.436   1.275

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ALA  87           H        ALA  87   2.617   7.342  -1.885
    2    HA   ALA  87           HA       ALA  87   4.330   8.759  -0.174
    3    HB3  ALA  87           HB1      ALA  87   4.403   7.759  -2.886
    4    HB2  ALA  87           HB2      ALA  87   5.747   8.096  -1.799
    5    HB1  ALA  87           HB3      ALA  87   5.110   9.375  -2.831

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ARG  88           H        ARG  88   2.343   9.891  -2.867
    2    HA   ARG  88           HA       ARG  88   3.097  12.586  -2.747
    3    HB2  ARG  88           HB2      ARG  88   1.831  11.431  -4.595
    4    HB3  ARG  88           HB3      ARG  88   0.384  11.559  -3.595
    5    HG2  ARG  88           HG2      ARG  88   1.384  14.147  -3.512
    6    HG3  ARG  88           HG3      ARG  88   1.793  13.643  -5.150
    7    HD2  ARG  88           HD2      ARG  88  -0.356  13.709  -5.823
    8    HD3  ARG  88           HD3      ARG  88  -0.920  12.845  -4.392
    9    HE   ARG  88           HE       ARG  88  -1.136  15.623  -4.795
   10   HH21  ARG  88          HH11      ARG  88  -1.653  16.941  -3.046
   11   HH22  ARG  88          HH12      ARG  88  -1.334  16.399  -1.434
   12   HH11  ARG  88          HH21      ARG  88  -0.076  13.358  -2.443
   13   HH12  ARG  88          HH22      ARG  88  -0.459  14.365  -1.093

  No H/Q in entry =          13
  In of MODEL   60
    1    H    GLU  89           H        GLU  89   0.425  10.884  -1.084
    2    HA   GLU  89           HA       GLU  89  -0.686  13.182   0.144
    3    HB2  GLU  89           HB2      GLU  89  -1.788  10.935   0.060
    4    HB3  GLU  89           HB3      GLU  89  -0.646  10.383   1.285
    5    HG2  GLU  89           HG2      GLU  89  -1.460  12.069   2.861
    6    HG3  GLU  89           HG3      GLU  89  -2.532  12.737   1.633

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LEU  90           H        LEU  90   1.795  10.903   1.279
    2    HA   LEU  90           HA       LEU  90   2.172  12.138   3.810
    3    HB2  LEU  90           HB2      LEU  90   3.938  10.384   2.105
    4    HB3  LEU  90           HB3      LEU  90   4.372  10.896   3.741
    5    HG   LEU  90           HG       LEU  90   1.739   9.536   3.104
    6   HD12  LEU  90          HD11      LEU  90   2.905   7.493   4.090
    7   HD11  LEU  90          HD12      LEU  90   4.418   8.361   3.834
    8   HD13  LEU  90          HD13      LEU  90   3.393   7.952   2.457
    9   HD22  LEU  90          HD21      LEU  90   1.493  10.448   5.233
   10   HD21  LEU  90          HD22      LEU  90   3.216  10.350   5.595
   11   HD23  LEU  90          HD23      LEU  90   2.220   8.896   5.648

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  91           H        ILE  91   3.736  12.546   0.667
    2    HA   ILE  91           HA       ILE  91   5.711  14.386   1.491
    3    HB   ILE  91           HB       ILE  91   4.371  13.899  -1.175
    4   HG12  ILE  91          HG12      ILE  91   7.218  13.425  -0.236
    5   HG13  ILE  91          HG13      ILE  91   5.946  12.219  -0.064
    6   HG22  ILE  91          HG21      ILE  91   6.577  15.263  -1.884
    7   HG21  ILE  91          HG22      ILE  91   6.280  16.055  -0.335
    8   HG23  ILE  91          HG23      ILE  91   5.043  16.081  -1.590
    9   HD13  ILE  91          HD11      ILE  91   5.748  11.905  -2.371
   10   HD12  ILE  91          HD12      ILE  91   7.483  12.158  -2.176
   11   HD11  ILE  91          HD13      ILE  91   6.458  13.477  -2.745

  No H/Q in entry =          11
  In of MODEL   60
    1    H    THR  92           H        THR  92   2.335  14.802   0.525
    2    HA   THR  92           HA       THR  92   2.291  17.625   0.477
    3    HB   THR  92           HB       THR  92   0.143  15.614   1.192
    4    HG1  THR  92           HG1      THR  92   0.425  15.447  -0.897
    5   HG22  THR  92          HG21      THR  92  -1.279  17.771   0.497
    6   HG21  THR  92          HG22      THR  92   0.117  18.601   1.181
    7   HG23  THR  92          HG23      THR  92  -0.807  17.470   2.169

  No H/Q in entry =           7
  In of MODEL   60
    1    H    GLU  93           H        GLU  93   1.787  15.310   3.127
    2    HA   GLU  93           HA       GLU  93   1.267  17.201   5.160
    3    HB2  GLU  93           HB2      GLU  93   2.599  14.483   5.368
    4    HB3  GLU  93           HB3      GLU  93   1.918  15.400   6.713
    5    HG2  GLU  93           HG2      GLU  93   0.282  14.624   4.290
    6    HG3  GLU  93           HG3      GLU  93   0.407  13.595   5.712

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LEU  94           H        LEU  94   4.269  15.742   3.969
    2    HA   LEU  94           HA       LEU  94   6.034  16.892   5.841
    3    HB2  LEU  94           HB2      LEU  94   6.409  15.940   3.002
    4    HB3  LEU  94           HB3      LEU  94   7.745  16.601   3.939
    5    HG   LEU  94           HG       LEU  94   6.032  14.390   5.084
    6   HD11  LEU  94          HD11      LEU  94   8.104  14.186   2.927
    7   HD13  LEU  94          HD12      LEU  94   6.667  13.202   3.201
    8   HD12  LEU  94          HD13      LEU  94   8.106  12.953   4.190
    9   HD23  LEU  94          HD21      LEU  94   8.238  13.861   6.208
   10   HD22  LEU  94          HD22      LEU  94   7.567  15.434   6.640
   11   HD21  LEU  94          HD23      LEU  94   8.893  15.326   5.481

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  95           H        ILE  95   4.852  18.071   2.710
    2    HA   ILE  95           HA       ILE  95   6.409  20.438   2.643
    3    HB   ILE  95           HB       ILE  95   3.754  19.744   1.366
    4   HG12  ILE  95          HG12      ILE  95   6.527  20.103   0.198
    5   HG13  ILE  95          HG13      ILE  95   5.893  18.544   0.713
    6   HG21  ILE  95          HG21      ILE  95   5.486  22.223   1.136
    7   HG23  ILE  95          HG22      ILE  95   3.766  22.143   1.512
    8   HG22  ILE  95          HG23      ILE  95   4.333  21.753  -0.112
    9   HD13  ILE  95          HD11      ILE  95   4.314  18.466  -0.998
   10   HD12  ILE  95          HD12      ILE  95   5.649  19.296  -1.798
   11   HD11  ILE  95          HD13      ILE  95   4.278  20.220  -1.185

  No H/Q in entry =          11
  In of MODEL   60
    1    H    GLU  96           H        GLU  96   3.179  19.761   3.973
    2    HA   GLU  96           HA       GLU  96   2.553  22.401   4.744
    3    HB2  GLU  96           HB2      GLU  96   0.889  20.608   4.767
    4    HB3  GLU  96           HB3      GLU  96   1.770  19.780   6.048
    5    HG2  GLU  96           HG2      GLU  96   0.761  21.050   7.635
    6    HG3  GLU  96           HG3      GLU  96   1.278  22.531   6.839

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LEU  97           H        LEU  97   4.429  19.853   6.336
    2    HA   LEU  97           HA       LEU  97   4.807  21.193   8.808
    3    HB2  LEU  97           HB2      LEU  97   6.340  19.039   7.366
    4    HB3  LEU  97           HB3      LEU  97   6.943  19.720   8.875
    5    HG   LEU  97           HG       LEU  97   4.137  18.612   8.591
    6   HD12  LEU  97          HD11      LEU  97   5.102  16.600   9.784
    7   HD11  LEU  97          HD12      LEU  97   6.705  17.241   9.424
    8   HD13  LEU  97          HD13      LEU  97   5.623  16.784   8.109
    9   HD23  LEU  97          HD21      LEU  97   4.621  18.309  11.149
   10   HD22  LEU  97          HD22      LEU  97   4.225  19.921  10.556
   11   HD21  LEU  97          HD23      LEU  97   5.903  19.489  10.880

  No H/Q in entry =          11
  In of MODEL   60
    1    H    HIS  98           H        HIS  98   6.642  21.233   5.761
    2    HA   HIS  98           HA       HIS  98   8.798  22.820   6.643
    3    HB2  HIS  98           HB2      HIS  98   7.475  22.570   3.931
    4    HB3  HIS  98           HB3      HIS  98   8.913  23.555   4.209
    5    HD1  HIS  98           HD1      HIS  98   7.721  19.978   4.227
    6    HD2  HIS  98           HD2      HIS  98  11.295  22.091   4.620
    7    HE1  HIS  98           HE1      HIS  98   9.583  18.258   4.140
    8    HE2  HIS  98           HE2      HIS  98  11.765  19.525   4.380

  No H/Q in entry =           8
  In of MODEL   60
    1    H    GLU  99           H        GLU  99   5.559  23.643   5.509
    2    HA   GLU  99           HA       GLU  99   5.923  26.460   5.459
    3    HB2  GLU  99           HB2      GLU  99   4.037  25.286   4.345
    4    HB3  GLU  99           HB3      GLU  99   3.361  24.914   5.930
    5    HG2  GLU  99           HG2      GLU  99   3.175  27.303   6.444
    6    HG3  GLU  99           HG3      GLU  99   3.931  27.714   4.908

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LYS 100           H        LYS 100   4.833  24.208   7.984
    2    HA   LYS 100           HA       LYS 100   4.258  26.250   9.894
    3    HB2  LYS 100           HB2      LYS 100   4.852  23.300  10.219
    4    HB3  LYS 100           HB3      LYS 100   4.415  24.365  11.561
    5    HG2  LYS 100           HG2      LYS 100   2.332  24.997  10.340
    6    HG3  LYS 100           HG3      LYS 100   2.750  23.836   9.077
    7    HD2  LYS 100           HD2      LYS 100   2.700  22.008  10.731
    8    HD3  LYS 100           HD3      LYS 100   2.299  23.163  12.005
    9    HE2  LYS 100           HE2      LYS 100   0.229  23.780  10.768
   10    HE3  LYS 100           HE3      LYS 100   0.621  22.567   9.542
   11    HZ1  LYS 100           HZ1      LYS 100   0.391  21.886  12.423
   12    HZ3  LYS 100           HZ2      LYS 100   0.366  20.838  11.084
   13    HZ2  LYS 100           HZ3      LYS 100  -0.952  21.870  11.383

  No H/Q in entry =          13
  In of MODEL   60
    1    H    LEU 101           H        LEU 101   7.181  24.473   9.018
    2    HA   LEU 101           HA       LEU 101   8.800  25.310  11.207
    3    HB2  LEU 101           HB2      LEU 101   9.368  24.339   8.417
    4    HB3  LEU 101           HB3      LEU 101  10.678  25.006   9.387
    5    HG   LEU 101           HG       LEU 101   8.868  22.836  10.462
    6   HD12  LEU 101          HD11      LEU 101  10.922  21.354   9.823
    7   HD11  LEU 101          HD12      LEU 101  11.269  22.624   8.652
    8   HD13  LEU 101          HD13      LEU 101   9.744  21.744   8.572
    9   HD21  LEU 101          HD21      LEU 101  11.595  23.954  11.163
   10   HD23  LEU 101          HD22      LEU 101  11.066  22.376  11.742
   11   HD22  LEU 101          HD23      LEU 101  10.172  23.826  12.197

  No H/Q in entry =          11
  In of MODEL   60
    1    H    LYS 102           H        LYS 102   7.184  27.176   9.093
    2    HA   LYS 102           HA       LYS 102   7.248  29.471   8.811
    3    HB2  LYS 102           HB2      LYS 102   8.837  29.353  10.890
    4    HB3  LYS 102           HB3      LYS 102  10.122  29.559   9.717
    5    HG2  LYS 102           HG2      LYS 102   8.018  31.498  10.612
    6    HG3  LYS 102           HG3      LYS 102   9.726  31.767  10.342
    7    HD2  LYS 102           HD2      LYS 102   7.751  31.346   8.063
    8    HD3  LYS 102           HD3      LYS 102   8.134  32.924   8.734
    9    HE2  LYS 102           HE2      LYS 102   9.488  31.755   6.640
   10    HE3  LYS 102           HE3      LYS 102  10.111  33.060   7.650
   11    HZ2  LYS 102           HZ1      LYS 102  11.638  31.163   7.448
   12    HZ1  LYS 102           HZ2      LYS 102  10.488  30.172   8.199
   13    HZ3  LYS 102           HZ3      LYS 102  11.185  31.458   9.056

  No H/Q in entry =          13
  In of MODEL   60
    1    H    ALA 103           H        ALA 103  10.504  28.149   8.203
    2    HA   ALA 103           HA       ALA 103  11.438  29.539   6.122
    3    HB2  ALA 103           HB1      ALA 103  12.322  27.333   5.174
    4    HB1  ALA 103           HB2      ALA 103  11.445  26.549   6.487
    5    HB3  ALA 103           HB3      ALA 103  12.734  27.697   6.850

  No H/Q in entry =           5
  In of MODEL   60
    1    H1   LYS   3           H1       LYS   3 -30.847   5.713 -20.160
    2    H2   LYS   3           H3       LYS   3 -29.833   5.377 -21.479
    3    H3   LYS   3           H2       LYS   3 -31.233   4.451 -21.228
    4    HA   LYS   3           HA       LYS   3 -30.262   3.110 -19.757
    5    HB2  LYS   3           HB2      LYS   3 -27.952   4.474 -21.093
    6    HB3  LYS   3           HB3      LYS   3 -27.654   3.309 -19.802
    7    HG2  LYS   3           HG2      LYS   3 -29.052   1.679 -21.125
    8    HG3  LYS   3           HG3      LYS   3 -28.979   2.834 -22.455
    9    HD2  LYS   3           HD2      LYS   3 -26.498   2.719 -22.352
   10    HD3  LYS   3           HD3      LYS   3 -26.642   1.462 -21.124
   11    HE2  LYS   3           HE2      LYS   3 -28.109   0.230 -22.828
   12    HE3  LYS   3           HE3      LYS   3 -27.465   1.367 -24.011
   13    HZ3  LYS   3           HZ1      LYS   3 -25.663   0.128 -24.202
   14    HZ2  LYS   3           HZ2      LYS   3 -26.316  -1.003 -23.115
   15    HZ1  LYS   3           HZ3      LYS   3 -25.336   0.260 -22.541

  No H/Q in entry =          15
  In of MODEL   60
    1    H    LYS   4           H        LYS   4 -30.355   3.039 -17.694
    2    HA   LYS   4           HA       LYS   4 -29.652   5.380 -16.109
    3    HB2  LYS   4           HB2      LYS   4 -30.874   2.715 -15.341
    4    HB3  LYS   4           HB3      LYS   4 -30.671   4.092 -14.258
    5    HG2  LYS   4           HG2      LYS   4 -32.431   3.950 -16.710
    6    HG3  LYS   4           HG3      LYS   4 -32.954   4.060 -15.031
    7    HD2  LYS   4           HD2      LYS   4 -32.258   6.288 -14.828
    8    HD3  LYS   4           HD3      LYS   4 -31.190   6.178 -16.227
    9    HE2  LYS   4           HE2      LYS   4 -33.103   7.540 -16.775
   10    HE3  LYS   4           HE3      LYS   4 -33.168   6.035 -17.693
   11    HZ3  LYS   4           HZ1      LYS   4 -34.777   5.180 -16.146
   12    HZ2  LYS   4           HZ2      LYS   4 -35.315   6.656 -16.792
   13    HZ1  LYS   4           HZ3      LYS   4 -34.691   6.598 -15.214

  No H/Q in entry =          13
  In of MODEL   60
    1    H    HIS   5           H        HIS   5 -28.215   5.516 -14.494
    2    HA   HIS   5           HA       HIS   5 -25.932   3.671 -14.717
    3    HB2  HIS   5           HB2      HIS   5 -26.201   6.466 -13.611
    4    HB3  HIS   5           HB3      HIS   5 -24.723   5.509 -13.532
    5    HD1  HIS   5           HD1      HIS   5 -23.218   6.647 -15.133
    6    HD2  HIS   5           HD2      HIS   5 -26.990   5.987 -16.739
    7    HE1  HIS   5           HE1      HIS   5 -22.999   7.143 -17.598
    8    HE2  HIS   5           HE2      HIS   5 -25.300   6.728 -18.545

  No H/Q in entry =           8
  In of MODEL   60
    1    H    ILE   6           H        ILE   6 -25.736   2.144 -13.342
    2    HA   ILE   6           HA       ILE   6 -26.763   2.511 -10.609
    3    HB   ILE   6           HB       ILE   6 -25.920  -0.011 -12.044
    4   HG12  ILE   6          HG12      ILE   6 -28.675   0.965 -11.280
    5   HG13  ILE   6          HG13      ILE   6 -28.000   1.068 -12.905
    6   HG23  ILE   6          HG21      ILE   6 -26.335  -1.197 -10.149
    7   HG22  ILE   6          HG22      ILE   6 -27.500  -0.023  -9.532
    8   HG21  ILE   6          HG23      ILE   6 -25.771   0.308  -9.421
    9   HD13  ILE   6          HD11      ILE   6 -28.460  -1.066 -13.341
   10   HD12  ILE   6          HD12      ILE   6 -29.503  -0.995 -11.921
   11   HD11  ILE   6          HD13      ILE   6 -27.854  -1.606 -11.775

  No H/Q in entry =          11
  In of MODEL   60
    1    H    TYR   7           H        TYR   7 -25.027   3.189  -9.311
    2    HA   TYR   7           HA       TYR   7 -22.308   2.197  -9.902
    3    HB2  TYR   7           HB2      TYR   7 -23.288   4.685  -8.526
    4    HB3  TYR   7           HB3      TYR   7 -21.606   4.161  -8.514
    5    HD1  TYR   7           HD1      TYR   7 -22.589   3.117 -11.590
    6    HD2  TYR   7           HD2      TYR   7 -21.946   6.762  -9.474
    7    HE1  TYR   7           HE1      TYR   7 -22.111   4.272 -13.712
    8    HE2  TYR   7           HE2      TYR   7 -21.509   7.922 -11.591
    9    HH   TYR   7           HH       TYR   7 -21.684   7.760 -13.823

  No H/Q in entry =           9
  In of MODEL   60
    1    H    LEU   8           H        LEU   8 -21.375   0.887  -8.510
    2    HA   LEU   8           HA       LEU   8 -22.561   0.491  -5.834
    3    HB2  LEU   8           HB2      LEU   8 -20.830  -1.242  -7.576
    4    HB3  LEU   8           HB3      LEU   8 -21.052  -1.564  -5.855
    5    HG   LEU   8           HG       LEU   8 -23.523  -1.740  -6.320
    6   HD13  LEU   8          HD11      LEU   8 -23.607  -0.597  -8.473
    7   HD12  LEU   8          HD12      LEU   8 -24.140  -2.266  -8.666
    8   HD11  LEU   8          HD13      LEU   8 -22.520  -1.794  -9.176
    9   HD23  LEU   8          HD21      LEU   8 -22.227  -3.844  -7.917
   10   HD22  LEU   8          HD22      LEU   8 -23.342  -3.959  -6.556
   11   HD21  LEU   8          HD23      LEU   8 -21.638  -3.604  -6.273

  No H/Q in entry =          11
  In of MODEL   60
    1    H    PHE   9           H        PHE   9 -21.326   0.958  -4.039
    2    HA   PHE   9           HA       PHE   9 -18.521   1.846  -4.529
    3    HB2  PHE   9           HB2      PHE   9 -20.574   3.009  -2.650
    4    HB3  PHE   9           HB3      PHE   9 -18.862   3.403  -2.592
    5    HD1  PHE   9           HD1      PHE   9 -17.793   4.665  -4.382
    6    HD2  PHE   9           HD2      PHE   9 -21.988   3.770  -4.507
    7    HE1  PHE   9           HE1      PHE   9 -18.090   6.310  -6.210
    8    HE2  PHE   9           HE2      PHE   9 -22.286   5.426  -6.330
    9    HZ   PHE   9           HZ       PHE   9 -20.334   6.692  -7.187

  No H/Q in entry =           9
  In of MODEL   60
    1    H    SER  10           H        SER  10 -16.953   0.922  -3.342
    2    HA   SER  10           HA       SER  10 -17.245   0.109  -0.630
    3    HB2  SER  10           HB2      SER  10 -18.455  -1.774  -1.684
    4    HB3  SER  10           HB3      SER  10 -17.052  -2.089  -2.691
    5    HG   SER  10           HG       SER  10 -16.834  -1.950   0.108

  No H/Q in entry =           5
  In of MODEL   60
    1    H    SER  11           H        SER  11 -15.246   0.171   0.267
    2    HA   SER  11           HA       SER  11 -13.017   0.998  -1.220
    3    HB2  SER  11           HB2      SER  11 -11.838   0.979   0.801
    4    HB3  SER  11           HB3      SER  11 -13.513   1.250   1.284
    5    HG   SER  11           HG       SER  11 -11.849  -0.824   1.838

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ALA  12           H        ALA  12 -14.200  -1.670  -2.060
    2    HA   ALA  12           HA       ALA  12 -11.629  -2.947  -2.517
    3    HB2  ALA  12           HB1      ALA  12 -12.530  -5.205  -1.841
    4    HB1  ALA  12           HB2      ALA  12 -13.868  -4.363  -1.061
    5    HB3  ALA  12           HB3      ALA  12 -12.216  -4.099  -0.503

  No H/Q in entry =           5
  In of MODEL   60
    1    H    GLY  13           H        GLY  13 -12.370  -1.969  -4.584
    2    HA3  GLY  13           HA2      GLY  13 -14.606  -2.707  -6.056
    3    HA2  GLY  13           HA3      GLY  13 -13.053  -2.254  -6.773

  No H/Q in entry =           3
  In of MODEL   60
    1    H    MET  14           H        MET  14 -11.531  -4.497  -5.783
    2    HA   MET  14           HA       MET  14 -11.894  -6.304  -7.864
    3    HB2  MET  14           HB2      MET  14  -9.823  -6.301  -6.567
    4    HB3  MET  14           HB3      MET  14 -10.663  -6.959  -5.163
    5    HG2  MET  14           HG2      MET  14 -11.217  -8.993  -6.478
    6    HG3  MET  14           HG3      MET  14 -10.346  -8.326  -7.860
    7    HE2  MET  14           HE1      MET  14  -7.655  -6.992  -6.671
    8    HE1  MET  14           HE2      MET  14  -8.126  -7.892  -8.111
    9    HE3  MET  14           HE3      MET  14  -6.760  -8.444  -7.145

  No H/Q in entry =           9
  In of MODEL   60
    1    H    SER  15           H        SER  15 -13.131  -6.705  -4.541
    2    HA   SER  15           HA       SER  15 -14.430  -9.199  -5.217
    3    HB2  SER  15           HB2      SER  15 -14.722  -7.425  -2.785
    4    HB3  SER  15           HB3      SER  15 -15.681  -8.880  -3.037
    5    HG   SER  15           HG       SER  15 -14.001  -9.785  -2.120

  No H/Q in entry =           5
  In of MODEL   60
    1    H    THR  16           H        THR  16 -15.560  -5.822  -4.839
    2    HA   THR  16           HA       THR  16 -18.340  -6.360  -5.364
    3    HB   THR  16           HB       THR  16 -16.803  -3.805  -5.943
    4    HG1  THR  16           HG1      THR  16 -16.765  -4.933  -3.710
    5   HG23  THR  16          HG21      THR  16 -19.037  -3.722  -6.811
    6   HG22  THR  16          HG22      THR  16 -19.056  -2.824  -5.283
    7   HG21  THR  16          HG23      THR  16 -19.690  -4.474  -5.361

  No H/Q in entry =           7
  In of MODEL   60
    1    H    SER  17           H        SER  17 -15.516  -5.852  -7.204
    2    HA   SER  17           HA       SER  17 -16.589  -5.195  -9.753
    3    HB2  SER  17           HB2      SER  17 -13.976  -6.451  -8.909
    4    HB3  SER  17           HB3      SER  17 -14.375  -6.179 -10.605
    5    HG   SER  17           HG       SER  17 -13.202  -4.442  -9.735

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LEU  18           H        LEU  18 -16.063  -8.288  -8.185
    2    HA   LEU  18           HA       LEU  18 -16.607  -9.868 -10.498
    3    HB2  LEU  18           HB2      LEU  18 -15.431 -10.772  -8.544
    4    HB3  LEU  18           HB3      LEU  18 -16.873 -10.528  -7.560
    5    HG   LEU  18           HG       LEU  18 -18.097 -12.153  -8.891
    6   HD12  LEU  18          HD11      LEU  18 -16.587 -13.521 -10.525
    7   HD11  LEU  18          HD12      LEU  18 -15.596 -12.061 -10.549
    8   HD13  LEU  18          HD13      LEU  18 -17.279 -11.995 -11.070
    9   HD21  LEU  18          HD21      LEU  18 -15.419 -13.109  -7.929
   10   HD23  LEU  18          HD22      LEU  18 -16.787 -14.157  -8.312
   11   HD22  LEU  18          HD23      LEU  18 -16.914 -12.985  -6.999

  No H/Q in entry =          11
  In of MODEL   60
    1    H    LEU  19           H        LEU  19 -18.626  -8.560  -7.872
    2    HA   LEU  19           HA       LEU  19 -21.077  -9.763  -8.714
    3    HB2  LEU  19           HB2      LEU  19 -20.824  -8.839  -6.484
    4    HB3  LEU  19           HB3      LEU  19 -20.570  -7.230  -7.160
    5    HG   LEU  19           HG       LEU  19 -22.877  -7.085  -7.827
    6   HD11  LEU  19          HD11      LEU  19 -22.901  -9.981  -7.072
    7   HD13  LEU  19          HD12      LEU  19 -23.588  -9.189  -8.489
    8   HD12  LEU  19          HD13      LEU  19 -24.379  -9.030  -6.921
    9   HD21  LEU  19          HD21      LEU  19 -22.319  -7.940  -5.013
   10   HD23  LEU  19          HD22      LEU  19 -23.929  -7.424  -5.514
   11   HD22  LEU  19          HD23      LEU  19 -22.564  -6.316  -5.656

  No H/Q in entry =          11
  In of MODEL   60
    1    H    VAL  20           H        VAL  20 -19.554  -6.634  -9.487
    2    HA   VAL  20           HA       VAL  20 -21.628  -5.641 -11.135
    3    HB   VAL  20           HB       VAL  20 -18.636  -5.063 -11.215
    4   HG13  VAL  20          HG11      VAL  20 -19.391  -4.513 -13.404
    5   HG12  VAL  20          HG12      VAL  20 -19.388  -2.993 -12.511
    6   HG11  VAL  20          HG13      VAL  20 -20.905  -3.846 -12.794
    7   HG21  VAL  20          HG21      VAL  20 -21.002  -3.707  -9.976
    8   HG23  VAL  20          HG22      VAL  20 -19.501  -2.843 -10.305
    9   HG22  VAL  20          HG23      VAL  20 -19.499  -4.229  -9.215

  No H/Q in entry =           9
  In of MODEL   60
    1    H    SER  21           H        SER  21 -18.859  -7.735 -12.033
    2    HA   SER  21           HA       SER  21 -19.585  -7.716 -14.802
    3    HB2  SER  21           HB2      SER  21 -18.156  -9.709 -15.030
    4    HB3  SER  21           HB3      SER  21 -17.338  -8.423 -14.146
    5    HG   SER  21           HG       SER  21 -18.066 -10.920 -13.347

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LYS  22           H        LYS  22 -20.712  -9.808 -12.178
    2    HA   LYS  22           HA       LYS  22 -22.221 -11.484 -13.974
    3    HB2  LYS  22           HB2      LYS  22 -22.564 -11.026 -11.008
    4    HB3  LYS  22           HB3      LYS  22 -23.370 -12.280 -11.950
    5    HG2  LYS  22           HG2      LYS  22 -20.381 -12.083 -11.618
    6    HG3  LYS  22           HG3      LYS  22 -21.427 -13.075 -10.602
    7    HD2  LYS  22           HD2      LYS  22 -22.154 -14.324 -12.597
    8    HD3  LYS  22           HD3      LYS  22 -21.066 -13.351 -13.588
    9    HE2  LYS  22           HE2      LYS  22 -19.137 -14.231 -12.405
   10    HE3  LYS  22           HE3      LYS  22 -20.182 -15.117 -11.295
   11    HZ2  LYS  22           HZ1      LYS  22 -19.116 -15.997 -13.691
   12    HZ1  LYS  22           HZ2      LYS  22 -20.787 -15.829 -13.953
   13    HZ3  LYS  22           HZ3      LYS  22 -20.219 -16.808 -12.685

  No H/Q in entry =          13
  In of MODEL   60
    1    H    MET  23           H        MET  23 -22.968  -8.496 -12.224
    2    HA   MET  23           HA       MET  23 -25.765  -8.579 -12.785
    3    HB2  MET  23           HB2      MET  23 -23.918  -6.262 -12.255
    4    HB3  MET  23           HB3      MET  23 -25.660  -6.091 -12.475
    5    HG2  MET  23           HG2      MET  23 -26.098  -7.323 -10.471
    6    HG3  MET  23           HG3      MET  23 -24.393  -7.738 -10.294
    7    HE2  MET  23           HE1      MET  23 -26.695  -4.036  -9.281
    8    HE1  MET  23           HE2      MET  23 -26.924  -5.053 -10.702
    9    HE3  MET  23           HE3      MET  23 -25.881  -3.635 -10.794

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ARG  24           H        ARG  24 -22.967  -7.228 -14.560
    2    HA   ARG  24           HA       ARG  24 -24.415  -5.990 -16.633
    3    HB2  ARG  24           HB2      ARG  24 -21.606  -7.141 -16.575
    4    HB3  ARG  24           HB3      ARG  24 -22.248  -6.273 -17.948
    5    HG2  ARG  24           HG2      ARG  24 -22.458  -4.203 -16.623
    6    HG3  ARG  24           HG3      ARG  24 -21.928  -5.084 -15.165
    7    HD2  ARG  24           HD2      ARG  24 -19.984  -3.951 -16.093
    8    HD3  ARG  24           HD3      ARG  24 -19.826  -5.679 -16.389
    9    HE   ARG  24           HE       ARG  24 -19.758  -5.379 -18.575
   10   HH21  ARG  24          HH11      ARG  24 -18.858  -3.885 -19.994
   11   HH22  ARG  24          HH12      ARG  24 -19.547  -2.305 -20.127
   12   HH11  ARG  24          HH21      ARG  24 -21.612  -2.850 -17.304
   13   HH12  ARG  24          HH22      ARG  24 -21.182  -1.706 -18.536

  No H/Q in entry =          13
  In of MODEL   60
    1    H    ALA  25           H        ALA  25 -23.320  -9.322 -16.220
    2    HA   ALA  25           HA       ALA  25 -23.899 -10.240 -18.840
    3    HB1  ALA  25           HB1      ALA  25 -23.232 -12.250 -18.061
    4    HB3  ALA  25           HB2      ALA  25 -24.318 -12.175 -16.674
    5    HB2  ALA  25           HB3      ALA  25 -22.758 -11.356 -16.617

  No H/Q in entry =           5
  In of MODEL   60
    1    H    GLN  26           H        GLN  26 -25.789 -10.164 -15.856
    2    HA   GLN  26           HA       GLN  26 -28.119 -11.386 -16.881
    3    HB2  GLN  26           HB2      GLN  26 -27.645  -9.562 -14.543
    4    HB3  GLN  26           HB3      GLN  26 -29.204 -10.287 -14.902
    5    HG2  GLN  26           HG2      GLN  26 -26.639 -11.743 -14.330
    6    HG3  GLN  26           HG3      GLN  26 -28.021 -11.594 -13.253
    7   HE21  GLN  26          HE21      GLN  26 -26.793 -13.809 -14.430
    8   HE22  GLN  26          HE22      GLN  26 -27.825 -14.876 -15.213

  No H/Q in entry =           8
  In of MODEL   60
    1    H    ALA  27           H        ALA  27 -27.169  -7.983 -16.583
    2    HA   ALA  27           HA       ALA  27 -29.634  -6.902 -17.457
    3    HB1  ALA  27           HB1      ALA  27 -27.839  -5.562 -16.348
    4    HB3  ALA  27           HB2      ALA  27 -28.392  -4.843 -17.861
    5    HB2  ALA  27           HB3      ALA  27 -26.863  -5.719 -17.811

  No H/Q in entry =           5
  In of MODEL   60
    1    H    GLU  28           H        GLU  28 -26.903  -8.204 -19.227
    2    HA   GLU  28           HA       GLU  28 -27.777  -7.243 -21.798
    3    HB2  GLU  28           HB2      GLU  28 -25.417  -7.921 -21.101
    4    HB3  GLU  28           HB3      GLU  28 -25.970  -9.587 -21.259
    5    HG2  GLU  28           HG2      GLU  28 -24.777  -8.884 -23.227
    6    HG3  GLU  28           HG3      GLU  28 -26.469  -9.208 -23.601

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LYS  29           H        LYS  29 -28.001 -10.291 -20.043
    2    HA   LYS  29           HA       LYS  29 -29.272 -11.819 -22.025
    3    HB2  LYS  29           HB2      LYS  29 -28.272 -12.742 -19.968
    4    HB3  LYS  29           HB3      LYS  29 -29.559 -11.994 -19.024
    5    HG2  LYS  29           HG2      LYS  29 -31.207 -13.391 -20.081
    6    HG3  LYS  29           HG3      LYS  29 -29.989 -14.070 -21.158
    7    HD2  LYS  29           HD2      LYS  29 -28.891 -15.186 -19.363
    8    HD3  LYS  29           HD3      LYS  29 -29.819 -14.299 -18.156
    9    HE2  LYS  29           HE2      LYS  29 -30.580 -16.653 -18.456
   10    HE3  LYS  29           HE3      LYS  29 -31.844 -15.461 -18.766
   11    HZ1  LYS  29           HZ1      LYS  29 -31.229 -15.679 -21.176
   12    HZ3  LYS  29           HZ2      LYS  29 -31.973 -17.038 -20.481
   13    HZ2  LYS  29           HZ3      LYS  29 -30.297 -17.030 -20.743

  No H/Q in entry =          13
  In of MODEL   60
    1    H    TYR  30           H        TYR  30 -30.702  -9.623 -19.621
    2    HA   TYR  30           HA       TYR  30 -33.340 -10.096 -20.904
    3    HB2  TYR  30           HB2      TYR  30 -32.737  -8.857 -18.209
    4    HB3  TYR  30           HB3      TYR  30 -34.342  -9.126 -18.888
    5    HD1  TYR  30           HD1      TYR  30 -35.264 -11.418 -19.045
    6    HD2  TYR  30           HD2      TYR  30 -31.460 -10.664 -17.285
    7    HE1  TYR  30           HE1      TYR  30 -35.207 -13.719 -18.171
    8    HE2  TYR  30           HE2      TYR  30 -31.405 -12.951 -16.415
    9    HH   TYR  30           HH       TYR  30 -33.038 -15.336 -17.465

  No H/Q in entry =           9
  In of MODEL   60
    1    H    GLU  31           H        GLU  31 -31.144  -8.145 -21.723
    2    HA   GLU  31           HA       GLU  31 -31.039  -6.018 -22.614
    3    HB2  GLU  31           HB2      GLU  31 -33.927  -6.731 -23.165
    4    HB3  GLU  31           HB3      GLU  31 -33.062  -5.394 -23.921
    5    HG2  GLU  31           HG2      GLU  31 -31.574  -6.879 -25.033
    6    HG3  GLU  31           HG3      GLU  31 -32.168  -8.259 -24.111

  No H/Q in entry =           6
  In of MODEL   60
    1    H    VAL  32           H        VAL  32 -31.294  -5.824 -19.892
    2    HA   VAL  32           HA       VAL  32 -33.157  -3.681 -19.342
    3    HB   VAL  32           HB       VAL  32 -30.804  -4.635 -17.679
    4   HG12  VAL  32          HG11      VAL  32 -32.375  -3.741 -15.845
    5   HG11  VAL  32          HG12      VAL  32 -33.175  -2.875 -17.155
    6   HG13  VAL  32          HG13      VAL  32 -31.473  -2.570 -16.809
    7   HG21  VAL  32          HG21      VAL  32 -32.568  -6.367 -18.348
    8   HG23  VAL  32          HG22      VAL  32 -33.627  -5.497 -17.238
    9   HG22  VAL  32          HG23      VAL  32 -32.127  -6.210 -16.648

  No H/Q in entry =           9
  In of MODEL   60
    1    HA   PRO  33           HA       PRO  33 -30.073  -0.825 -21.046
    2    HB2  PRO  33           HB2      PRO  33 -31.574   1.409 -21.026
    3    HB3  PRO  33           HB3      PRO  33 -32.026   0.074 -22.087
    4    HG2  PRO  33           HG2      PRO  33 -33.051   0.687 -19.315
    5    HG3  PRO  33           HG3      PRO  33 -33.986   0.435 -20.788
    6    HD2  PRO  33           HD2      PRO  33 -33.576  -1.584 -19.047
    7    HD3  PRO  33           HD3      PRO  33 -33.603  -1.882 -20.785

  No H/Q in entry =           7
  In of MODEL   60
    1    H    VAL  34           H        VAL  34 -28.853  -1.311 -19.054
    2    HA   VAL  34           HA       VAL  34 -28.591   1.165 -17.481
    3    HB   VAL  34           HB       VAL  34 -28.059  -0.234 -15.485
    4   HG12  VAL  34          HG11      VAL  34 -30.482  -1.086 -15.200
    5   HG11  VAL  34          HG12      VAL  34 -30.761  -0.376 -16.789
    6   HG13  VAL  34          HG13      VAL  34 -30.232   0.642 -15.449
    7   HG21  VAL  34          HG21      VAL  34 -28.212  -2.325 -17.429
    8   HG23  VAL  34          HG22      VAL  34 -29.300  -2.637 -16.075
    9   HG22  VAL  34          HG23      VAL  34 -27.586  -2.348 -15.781

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ILE  35           H        ILE  35 -26.630   1.619 -16.613
    2    HA   ILE  35           HA       ILE  35 -24.306   0.239 -17.784
    3    HB   ILE  35           HB       ILE  35 -24.709   3.156 -17.076
    4   HG12  ILE  35          HG12      ILE  35 -23.680   1.763 -19.555
    5   HG13  ILE  35          HG13      ILE  35 -25.312   2.398 -19.351
    6   HG21  ILE  35          HG21      ILE  35 -22.149   1.603 -17.281
    7   HG23  ILE  35          HG22      ILE  35 -22.623   2.824 -16.101
    8   HG22  ILE  35          HG23      ILE  35 -22.204   3.302 -17.746
    9   HD11  ILE  35          HD11      ILE  35 -23.913   4.605 -18.792
   10   HD13  ILE  35          HD12      ILE  35 -24.418   4.172 -20.425
   11   HD12  ILE  35          HD13      ILE  35 -22.779   3.811 -19.883

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ILE  36           H        ILE  36 -23.114  -0.737 -16.127
    2    HA   ILE  36           HA       ILE  36 -23.611  -0.027 -13.288
    3    HB   ILE  36           HB       ILE  36 -22.774  -2.767 -14.290
    4   HG12  ILE  36          HG12      ILE  36 -25.593  -1.926 -13.612
    5   HG13  ILE  36          HG13      ILE  36 -24.987  -1.963 -15.268
    6   HG23  ILE  36          HG21      ILE  36 -23.174  -3.525 -12.159
    7   HG22  ILE  36          HG22      ILE  36 -24.303  -2.224 -11.785
    8   HG21  ILE  36          HG23      ILE  36 -22.570  -1.901 -11.830
    9   HD13  ILE  36          HD11      ILE  36 -25.158  -4.181 -15.405
   10   HD12  ILE  36          HD12      ILE  36 -26.252  -4.010 -14.033
   11   HD11  ILE  36          HD13      ILE  36 -24.561  -4.428 -13.765

  No H/Q in entry =          11
  In of MODEL   60
    1    H    GLU  37           H        GLU  37 -21.851   0.631 -12.167
    2    HA   GLU  37           HA       GLU  37 -19.146  -0.205 -13.001
    3    HB2  GLU  37           HB2      GLU  37 -20.055   2.609 -12.422
    4    HB3  GLU  37           HB3      GLU  37 -18.363   2.112 -12.477
    5    HG2  GLU  37           HG2      GLU  37 -18.579   1.568 -14.825
    6    HG3  GLU  37           HG3      GLU  37 -20.286   2.005 -14.783

  No H/Q in entry =           6
  In of MODEL   60
    1    H    ALA  38           H        ALA  38 -17.695  -0.394 -11.280
    2    HA   ALA  38           HA       ALA  38 -18.783  -0.121  -8.539
    3    HB1  ALA  38           HB1      ALA  38 -17.048  -2.112  -9.865
    4    HB3  ALA  38           HB2      ALA  38 -18.127  -2.298  -8.483
    5    HB2  ALA  38           HB3      ALA  38 -16.517  -1.614  -8.258

  No H/Q in entry =           5
  In of MODEL   60
    1    H    PHE  39           H        PHE  39 -17.569   1.132  -7.080
    2    HA   PHE  39           HA       PHE  39 -15.021   2.297  -7.962
    3    HB2  PHE  39           HB2      PHE  39 -17.356   3.879  -6.880
    4    HB3  PHE  39           HB3      PHE  39 -15.728   4.510  -7.120
    5    HD1  PHE  39           HD1      PHE  39 -14.833   4.810  -9.379
    6    HD2  PHE  39           HD2      PHE  39 -18.870   3.625  -8.684
    7    HE1  PHE  39           HE1      PHE  39 -15.408   5.449 -11.704
    8    HE2  PHE  39           HE2      PHE  39 -19.458   4.252 -10.998
    9    HZ   PHE  39           HZ       PHE  39 -17.726   5.136 -12.525

  No H/Q in entry =           9
  In of MODEL   60
    1    HA   PRO  40           HA       PRO  40 -14.175   1.680  -3.635
    2    HB2  PRO  40           HB2      PRO  40 -12.413   3.706  -3.056
    3    HB3  PRO  40           HB3      PRO  40 -11.952   2.344  -4.077
    4    HG2  PRO  40           HG2      PRO  40 -12.964   5.057  -4.922
    5    HG3  PRO  40           HG3      PRO  40 -11.519   4.207  -5.468
    6    HD2  PRO  40           HD2      PRO  40 -13.711   4.058  -6.932
    7    HD3  PRO  40           HD3      PRO  40 -12.761   2.597  -6.665

  No H/Q in entry =           7
  In of MODEL   60
    1    H    GLU  41           H        GLU  41 -14.838   2.728  -1.552
    2    HA   GLU  41           HA       GLU  41 -17.078   4.435  -1.637
    3    HB2  GLU  41           HB2      GLU  41 -16.740   4.613   0.827
    4    HB3  GLU  41           HB3      GLU  41 -16.771   2.954   0.228
    5    HG2  GLU  41           HG2      GLU  41 -15.043   2.886   1.747
    6    HG3  GLU  41           HG3      GLU  41 -14.189   3.163   0.230

  No H/Q in entry =           6
  In of MODEL   60
    1    H    THR  42           H        THR  42 -13.744   5.345  -1.649
    2    HA   THR  42           HA       THR  42 -14.117   7.944  -0.529
    3    HB   THR  42           HB       THR  42 -11.936   8.479  -1.589
    4    HG1  THR  42           HG1      THR  42 -12.605   6.164  -2.978
    5   HG22  THR  42          HG21      THR  42 -10.615   6.707  -0.455
    6   HG21  THR  42          HG22      THR  42 -12.092   5.758  -0.269
    7   HG23  THR  42          HG23      THR  42 -11.930   7.308   0.555

  No H/Q in entry =           7
  In of MODEL   60
    1    H    LEU  43           H        LEU  43 -14.959   6.750  -3.611
    2    HA   LEU  43           HA       LEU  43 -15.187   9.490  -4.675
    3    HB2  LEU  43           HB2      LEU  43 -15.488   6.788  -5.973
    4    HB3  LEU  43           HB3      LEU  43 -15.751   8.324  -6.795
    5    HG   LEU  43           HG       LEU  43 -13.105   7.378  -5.722
    6   HD13  LEU  43          HD11      LEU  43 -12.519   6.763  -7.899
    7   HD12  LEU  43          HD12      LEU  43 -13.879   7.631  -8.609
    8   HD11  LEU  43          HD13      LEU  43 -14.157   6.135  -7.719
    9   HD21  LEU  43          HD21      LEU  43 -14.011   9.802  -7.267
   10   HD23  LEU  43          HD22      LEU  43 -12.332   9.260  -7.270
   11   HD22  LEU  43          HD23      LEU  43 -13.100   9.740  -5.758

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ALA  44           H        ALA  44 -17.174   7.728  -2.804
    2    HA   ALA  44           HA       ALA  44 -19.624   7.548  -4.172
    3    HB2  ALA  44           HB1      ALA  44 -19.531   6.500  -2.038
    4    HB3  ALA  44           HB2      ALA  44 -20.641   7.854  -1.833
    5    HB1  ALA  44           HB3      ALA  44 -18.982   7.979  -1.249

  No H/Q in entry =           5
  In of MODEL   60
    1    H    GLY  45           H        GLY  45 -18.232  10.395  -2.703
    2    HA3  GLY  45           HA2      GLY  45 -20.658  11.885  -3.164
    3    HA2  GLY  45           HA3      GLY  45 -19.125  12.527  -2.575

  No H/Q in entry =           3
  In of MODEL   60
    1    H    GLU  46           H        GLU  46 -17.547  11.513  -4.802
    2    HA   GLU  46           HA       GLU  46 -18.144  13.671  -6.656
    3    HB2  GLU  46           HB2      GLU  46 -15.831  13.156  -5.945
    4    HB3  GLU  46           HB3      GLU  46 -15.971  11.569  -6.703
    5    HG2  GLU  46           HG2      GLU  46 -16.217  12.617  -8.883
    6    HG3  GLU  46           HG3      GLU  46 -16.117  14.212  -8.139

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LYS  47           H        LYS  47 -18.022  10.139  -6.972
    2    HA   LYS  47           HA       LYS  47 -19.065  10.272  -9.675
    3    HB2  LYS  47           HB2      LYS  47 -18.536   7.939  -7.827
    4    HB3  LYS  47           HB3      LYS  47 -19.074   7.792  -9.500
    5    HG2  LYS  47           HG2      LYS  47 -16.540   9.202  -8.754
    6    HG3  LYS  47           HG3      LYS  47 -16.605   7.464  -9.043
    7    HD2  LYS  47           HD2      LYS  47 -17.528   7.869 -11.272
    8    HD3  LYS  47           HD3      LYS  47 -17.460   9.606 -10.985
    9    HE2  LYS  47           HE2      LYS  47 -15.033   9.472 -10.745
   10    HE3  LYS  47           HE3      LYS  47 -15.100   7.734 -11.029
   11    HZ3  LYS  47           HZ1      LYS  47 -15.439   8.010 -13.210
   12    HZ2  LYS  47           HZ2      LYS  47 -14.690   9.509 -12.940
   13    HZ1  LYS  47           HZ3      LYS  47 -16.384   9.407 -13.018

  No H/Q in entry =          13
  In of MODEL   60
    1    H    GLY  48           H        GLY  48 -20.454   9.620  -6.532
    2    HA3  GLY  48           HA2      GLY  48 -22.825   8.413  -7.283
    3    HA2  GLY  48           HA3      GLY  48 -22.628   9.454  -5.873

  No H/Q in entry =           3
  In of MODEL   60
    1    H    GLN  49           H        GLN  49 -22.008  11.824  -7.511
    2    HA   GLN  49           HA       GLN  49 -24.562  12.933  -7.744
    3    HB2  GLN  49           HB2      GLN  49 -21.989  13.749  -9.080
    4    HB3  GLN  49           HB3      GLN  49 -23.451  14.717  -9.058
    5    HG2  GLN  49           HG2      GLN  49 -23.342  14.821  -6.620
    6    HG3  GLN  49           HG3      GLN  49 -21.892  13.832  -6.640
    7   HE21  GLN  49          HE21      GLN  49 -21.798  16.100  -5.439
    8   HE22  GLN  49          HE22      GLN  49 -20.859  17.333  -6.108

  No H/Q in entry =           8
  In of MODEL   60
    1    H    ASN  50           H        ASN  50 -22.837  10.973 -10.033
    2    HA   ASN  50           HA       ASN  50 -24.676  11.779 -12.181
    3    HB2  ASN  50           HB2      ASN  50 -22.094  10.228 -12.311
    4    HB3  ASN  50           HB3      ASN  50 -23.115  10.611 -13.689
    5   HD21  ASN  50          HD21      ASN  50 -20.511  11.506 -12.053
    6   HD22  ASN  50          HD22      ASN  50 -20.268  13.129 -12.443

  No H/Q in entry =           6
  In of MODEL   60
    1    H    ALA  51           H        ALA  51 -24.712   9.498  -9.859
    2    HA   ALA  51           HA       ALA  51 -25.464   7.295 -11.630
    3    HB2  ALA  51           HB1      ALA  51 -24.918   6.001  -9.888
    4    HB3  ALA  51           HB2      ALA  51 -26.061   6.846  -8.846
    5    HB1  ALA  51           HB3      ALA  51 -24.417   7.458  -9.030

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ASP  52           H        ASP  52 -27.474   6.248 -11.496
    2    HA   ASP  52           HA       ASP  52 -29.664   8.106 -10.937
    3    HB2  ASP  52           HB2      ASP  52 -29.444   5.547 -12.520
    4    HB3  ASP  52           HB3      ASP  52 -30.996   6.297 -12.141

  No H/Q in entry =           4
  In of MODEL   60
    1    H    VAL  53           H        VAL  53 -28.092   5.249  -9.794
    2    HA   VAL  53           HA       VAL  53 -29.583   5.462  -7.313
    3    HB   VAL  53           HB       VAL  53 -30.961   3.783  -8.531
    4   HG11  VAL  53          HG11      VAL  53 -29.186   2.870  -9.988
    5   HG13  VAL  53          HG12      VAL  53 -30.041   1.606  -9.103
    6   HG12  VAL  53          HG13      VAL  53 -28.440   2.121  -8.577
    7   HG23  VAL  53          HG21      VAL  53 -30.180   1.862  -6.758
    8   HG22  VAL  53          HG22      VAL  53 -31.313   3.180  -6.458
    9   HG21  VAL  53          HG23      VAL  53 -29.614   3.362  -6.022

  No H/Q in entry =           9
  In of MODEL   60
    1    H    VAL  54           H        VAL  54 -28.306   5.081  -5.618
    2    HA   VAL  54           HA       VAL  54 -25.537   4.205  -6.145
    3    HB   VAL  54           HB       VAL  54 -26.647   6.058  -3.976
    4   HG11  VAL  54          HG11      VAL  54 -24.068   4.624  -4.167
    5   HG13  VAL  54          HG12      VAL  54 -24.848   5.352  -2.764
    6   HG12  VAL  54          HG13      VAL  54 -23.916   6.357  -3.875
    7   HG22  VAL  54          HG21      VAL  54 -25.759   7.833  -5.117
    8   HG21  VAL  54          HG22      VAL  54 -26.282   6.800  -6.447
    9   HG23  VAL  54          HG23      VAL  54 -24.584   6.836  -5.975

  No H/Q in entry =           9
  In of MODEL   60
    1    H    LEU  55           H        LEU  55 -24.965   2.304  -5.426
    2    HA   LEU  55           HA       LEU  55 -26.522   1.070  -3.241
    3    HB2  LEU  55           HB2      LEU  55 -24.923  -0.178  -5.463
    4    HB3  LEU  55           HB3      LEU  55 -25.713  -1.067  -4.160
    5    HG   LEU  55           HG       LEU  55 -27.101   0.454  -6.359
    6   HD13  LEU  55          HD11      LEU  55 -26.783  -1.439  -7.510
    7   HD12  LEU  55          HD12      LEU  55 -27.768  -2.270  -6.307
    8   HD11  LEU  55          HD13      LEU  55 -26.015  -2.206  -6.122
    9   HD23  LEU  55          HD21      LEU  55 -28.440  -1.426  -4.468
   10   HD22  LEU  55          HD22      LEU  55 -29.113  -0.070  -5.374
   11   HD21  LEU  55          HD23      LEU  55 -28.121   0.229  -3.947

  No H/Q in entry =          11
  In of MODEL   60
    1    H    LEU  56           H        LEU  56 -25.410   0.532  -1.393
    2    HA   LEU  56           HA       LEU  56 -22.473   0.916  -1.395
    3    HB2  LEU  56           HB2      LEU  56 -24.326   0.790   0.971
    4    HB3  LEU  56           HB3      LEU  56 -22.616   1.214   0.982
    5    HG   LEU  56           HG       LEU  56 -24.888   2.867  -0.085
    6   HD11  LEU  56          HD11      LEU  56 -23.826   2.565   2.470
    7   HD13  LEU  56          HD12      LEU  56 -24.801   3.920   1.899
    8   HD12  LEU  56          HD13      LEU  56 -23.041   4.016   1.844
    9   HD23  LEU  56          HD21      LEU  56 -22.933   4.552  -0.293
   10   HD22  LEU  56          HD22      LEU  56 -23.292   3.413  -1.591
   11   HD21  LEU  56          HD23      LEU  56 -21.963   3.092  -0.479

  No H/Q in entry =          11
  In of MODEL   60
    1    H    GLY  57           H        GLY  57 -21.111  -0.701  -0.779
    2    HA3  GLY  57           HA2      GLY  57 -22.039  -3.388  -0.907
    3    HA2  GLY  57           HA3      GLY  57 -20.426  -2.884  -0.409

  No H/Q in entry =           3
  In of MODEL   60
    1    HA   PRO  58           HA       PRO  58 -23.315  -3.789   3.272
    2    HB2  PRO  58           HB2      PRO  58 -22.654  -6.375   3.979
    3    HB3  PRO  58           HB3      PRO  58 -24.016  -5.996   2.925
    4    HG2  PRO  58           HG2      PRO  58 -21.277  -6.912   2.224
    5    HG3  PRO  58           HG3      PRO  58 -22.829  -7.389   1.537
    6    HD2  PRO  58           HD2      PRO  58 -21.188  -5.618   0.288
    7    HD3  PRO  58           HD3      PRO  58 -22.944  -5.529   0.146

  No H/Q in entry =           7
  In of MODEL   60
    1    H    GLN  59           H        GLN  59 -19.934  -4.294   2.751
    2    HA   GLN  59           HA       GLN  59 -19.237  -4.223   5.527
    3    HB2  GLN  59           HB2      GLN  59 -17.646  -3.569   3.048
    4    HB3  GLN  59           HB3      GLN  59 -16.977  -3.503   4.665
    5    HG2  GLN  59           HG2      GLN  59 -18.121  -5.951   3.331
    6    HG3  GLN  59           HG3      GLN  59 -16.414  -5.584   3.505
    7   HE21  GLN  59          HE21      GLN  59 -18.700  -7.201   4.678
    8   HE22  GLN  59          HE22      GLN  59 -18.436  -7.698   6.243

  No H/Q in entry =           8
  In of MODEL   60
    1    H    ILE  60           H        ILE  60 -20.114  -1.743   3.216
    2    HA   ILE  60           HA       ILE  60 -19.295   0.277   5.213
    3    HB   ILE  60           HB       ILE  60 -19.499   1.944   3.317
    4   HG12  ILE  60          HG12      ILE  60 -19.223  -0.358   1.432
    5   HG13  ILE  60          HG13      ILE  60 -20.829   0.191   1.909
    6   HG22  ILE  60          HG21      ILE  60 -17.445  -0.181   2.829
    7   HG21  ILE  60          HG22      ILE  60 -17.371   0.982   4.153
    8   HG23  ILE  60          HG23      ILE  60 -17.327   1.544   2.482
    9   HD11  ILE  60          HD11      ILE  60 -19.884   2.553   1.211
   10   HD13  ILE  60          HD12      ILE  60 -20.498   1.437  -0.008
   11   HD12  ILE  60          HD13      ILE  60 -18.761   1.583   0.258

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ALA  61           H        ALA  61 -21.758  -1.296   5.284
    2    HA   ALA  61           HA       ALA  61 -23.967   0.362   4.725
    3    HB1  ALA  61           HB1      ALA  61 -25.216  -1.078   6.074
    4    HB2  ALA  61           HB2      ALA  61 -23.841  -1.440   7.117
    5    HB3  ALA  61           HB3      ALA  61 -23.905  -2.100   5.483

  No H/Q in entry =           5
  In of MODEL   60
    1    H    TYR  62           H        TYR  62 -21.818   0.334   7.569
    2    HA   TYR  62           HA       TYR  62 -23.400   2.051   9.152
    3    HB2  TYR  62           HB2      TYR  62 -21.395   2.496  10.423
    4    HB3  TYR  62           HB3      TYR  62 -21.428   0.787   9.988
    5    HD1  TYR  62           HD1      TYR  62 -19.826  -0.115   8.328
    6    HD2  TYR  62           HD2      TYR  62 -19.647   3.971   9.568
    7    HE1  TYR  62           HE1      TYR  62 -17.591   0.092   7.311
    8    HE2  TYR  62           HE2      TYR  62 -17.397   4.171   8.552
    9    HH   TYR  62           HH       TYR  62 -15.780   3.114   7.524

  No H/Q in entry =           9
  In of MODEL   60
    1    H    MET  63           H        MET  63 -21.695   2.808   6.303
    2    HA   MET  63           HA       MET  63 -21.528   5.662   6.906
    3    HB2  MET  63           HB2      MET  63 -20.876   4.051   4.438
    4    HB3  MET  63           HB3      MET  63 -20.681   5.801   4.562
    5    HG2  MET  63           HG2      MET  63 -19.001   5.517   6.276
    6    HG3  MET  63           HG3      MET  63 -19.223   3.769   6.228
    7    HE1  MET  63           HE1      MET  63 -18.668   6.840   4.414
    8    HE3  MET  63           HE2      MET  63 -18.601   6.282   2.741
    9    HE2  MET  63           HE3      MET  63 -17.107   6.589   3.630

  No H/Q in entry =           9
  In of MODEL   60
    1    H    LEU  64           H        LEU  64 -24.081   3.788   5.951
    2    HA   LEU  64           HA       LEU  64 -25.241   5.142   3.803
    3    HB2  LEU  64           HB2      LEU  64 -26.139   3.071   4.772
    4    HB3  LEU  64           HB3      LEU  64 -26.621   3.965   6.213
    5    HG   LEU  64           HG       LEU  64 -28.285   5.186   4.910
    6   HD13  LEU  64          HD11      LEU  64 -27.956   5.351   2.677
    7   HD12  LEU  64          HD12      LEU  64 -28.606   3.715   2.572
    8   HD11  LEU  64          HD13      LEU  64 -26.864   3.967   2.657
    9   HD23  LEU  64          HD21      LEU  64 -28.803   2.352   4.245
   10   HD22  LEU  64          HD22      LEU  64 -29.804   3.521   5.107
   11   HD21  LEU  64          HD23      LEU  64 -28.449   2.747   5.927

  No H/Q in entry =          11
  In of MODEL   60
    1    HA   PRO  65           HA       PRO  65 -27.459   8.396   6.403
    2    HB2  PRO  65           HB2      PRO  65 -25.503   8.619   8.691
    3    HB3  PRO  65           HB3      PRO  65 -27.241   8.910   8.692
    4    HG2  PRO  65           HG2      PRO  65 -26.344   6.683   9.712
    5    HG3  PRO  65           HG3      PRO  65 -27.742   6.623   8.639
    6    HD2  PRO  65           HD2      PRO  65 -24.860   5.971   8.015
    7    HD3  PRO  65           HD3      PRO  65 -26.314   5.077   7.568

  No H/Q in entry =           7
  In of MODEL   60
    1    H    GLU  66           H        GLU  66 -23.905   8.323   6.549
    2    HA   GLU  66           HA       GLU  66 -23.583  11.106   6.058
    3    HB2  GLU  66           HB2      GLU  66 -21.771   8.767   5.520
    4    HB3  GLU  66           HB3      GLU  66 -21.306  10.449   5.266
    5    HG2  GLU  66           HG2      GLU  66 -21.563  10.899   7.616
    6    HG3  GLU  66           HG3      GLU  66 -22.104   9.244   7.892

  No H/Q in entry =           6
  In of MODEL   60
    1    H    ILE  67           H        ILE  67 -23.657   8.287   3.897
    2    HA   ILE  67           HA       ILE  67 -23.184   9.915   1.557
    3    HB   ILE  67           HB       ILE  67 -24.106   7.022   1.815
    4   HG12  ILE  67          HG12      ILE  67 -21.450   8.143   0.908
    5   HG13  ILE  67          HG13      ILE  67 -21.781   7.783   2.601
    6   HG21  ILE  67          HG21      ILE  67 -23.990   8.825  -0.469
    7   HG23  ILE  67          HG22      ILE  67 -24.627   7.183  -0.377
    8   HG22  ILE  67          HG23      ILE  67 -22.911   7.446  -0.680
    9   HD12  ILE  67          HD11      ILE  67 -21.326   5.930   0.320
   10   HD11  ILE  67          HD12      ILE  67 -22.371   5.409   1.640
   11   HD13  ILE  67          HD13      ILE  67 -20.702   5.873   1.968

  No H/Q in entry =          11
  In of MODEL   60
    1    H    GLN  68           H        GLN  68 -26.093   8.936   3.166
    2    HA   GLN  68           HA       GLN  68 -27.875   9.813   1.126
    3    HB2  GLN  68           HB2      GLN  68 -28.193   9.557   4.113
    4    HB3  GLN  68           HB3      GLN  68 -29.488  10.127   3.075
    5    HG2  GLN  68           HG2      GLN  68 -29.506   8.056   1.866
    6    HG3  GLN  68           HG3      GLN  68 -28.079   7.496   2.716
    7   HE21  GLN  68          HE21      GLN  68 -30.264   6.151   2.582
    8   HE22  GLN  68          HE22      GLN  68 -31.125   5.748   3.995

  No H/Q in entry =           8
  In of MODEL   60
    1    H    ARG  69           H        ARG  69 -26.310  11.557   3.838
    2    HA   ARG  69           HA       ARG  69 -27.645  14.035   3.324
    3    HB2  ARG  69           HB2      ARG  69 -25.340  13.140   4.990
    4    HB3  ARG  69           HB3      ARG  69 -25.397  14.847   4.572
    5    HG2  ARG  69           HG2      ARG  69 -27.732  14.941   5.495
    6    HG3  ARG  69           HG3      ARG  69 -27.549  13.266   6.029
    7    HD2  ARG  69           HD2      ARG  69 -25.853  15.636   6.899
    8    HD3  ARG  69           HD3      ARG  69 -27.010  14.773   7.899
    9    HE   ARG  69           HE       ARG  69 -24.388  13.789   7.033
   10   HH21  ARG  69          HH11      ARG  69 -23.620  12.059   8.303
   11   HH22  ARG  69          HH12      ARG  69 -24.677  11.289   9.437
   12   HH11  ARG  69          HH21      ARG  69 -27.383  13.322   8.689
   13   HH12  ARG  69          HH22      ARG  69 -26.808  12.002   9.653

  No H/Q in entry =          13
  In of MODEL   60
    1    H    LEU  70           H        LEU  70 -24.761  12.560   2.068
    2    HA   LEU  70           HA       LEU  70 -23.602  14.876   0.846
    3    HB2  LEU  70           HB2      LEU  70 -22.642  12.570   1.537
    4    HB3  LEU  70           HB3      LEU  70 -23.230  12.058  -0.045
    5    HG   LEU  70           HG       LEU  70 -21.602  13.380  -1.143
    6   HD11  LEU  70          HD11      LEU  70 -20.827  14.307   1.632
    7   HD13  LEU  70          HD12      LEU  70 -21.488  15.306   0.337
    8   HD12  LEU  70          HD13      LEU  70 -19.879  14.604   0.172
    9   HD22  LEU  70          HD21      LEU  70 -20.191  11.659  -0.825
   10   HD21  LEU  70          HD22      LEU  70 -21.150  11.191   0.580
   11   HD23  LEU  70          HD23      LEU  70 -19.758  12.258   0.777

  No H/Q in entry =          11
  In of MODEL   60
    1    H    LEU  71           H        LEU  71 -25.759  12.317  -0.228
    2    HA   LEU  71           HA       LEU  71 -26.219  13.726  -2.802
    3    HB2  LEU  71           HB2      LEU  71 -26.464  10.761  -2.262
    4    HB3  LEU  71           HB3      LEU  71 -26.553  11.570  -3.825
    5    HG   LEU  71           HG       LEU  71 -24.067  11.613  -2.116
    6   HD12  LEU  71          HD11      LEU  71 -24.090   9.907  -4.494
    7   HD11  LEU  71          HD12      LEU  71 -25.132   9.336  -3.191
    8   HD13  LEU  71          HD13      LEU  71 -23.415   9.607  -2.891
    9   HD22  LEU  71          HD21      LEU  71 -24.121  13.380  -3.670
   10   HD21  LEU  71          HD22      LEU  71 -24.603  12.300  -4.977
   11   HD23  LEU  71          HD23      LEU  71 -22.997  12.158  -4.262

  No H/Q in entry =          11
  In of MODEL   60
    1    HA   PRO  72           HA       PRO  72 -30.140  13.405  -0.244
    2    HB2  PRO  72           HB2      PRO  72 -30.966  15.971  -0.427
    3    HB3  PRO  72           HB3      PRO  72 -29.684  15.541   0.705
    4    HG2  PRO  72           HG2      PRO  72 -29.430  16.642  -2.083
    5    HG3  PRO  72           HG3      PRO  72 -28.687  17.234  -0.597
    6    HD2  PRO  72           HD2      PRO  72 -27.334  15.603  -2.284
    7    HD3  PRO  72           HD3      PRO  72 -27.115  15.491  -0.539

  No H/Q in entry =           7
  In of MODEL   60
    1    H    ASN  73           H        ASN  73 -29.442  14.246  -3.475
    2    HA   ASN  73           HA       ASN  73 -32.294  13.950  -4.155
    3    HB2  ASN  73           HB2      ASN  73 -31.773  14.981  -6.277
    4    HB3  ASN  73           HB3      ASN  73 -31.266  16.000  -4.939
    5   HD21  ASN  73          HD21      ASN  73 -30.417  15.946  -7.600
    6   HD22  ASN  73          HD22      ASN  73 -28.748  15.760  -7.753

  No H/Q in entry =           6
  In of MODEL   60
    1    H    LYS  74           H        LYS  74 -30.350  11.686  -3.616
    2    HA   LYS  74           HA       LYS  74 -30.886  10.215  -6.128
    3    HB2  LYS  74           HB2      LYS  74 -28.389   9.946  -4.448
    4    HB3  LYS  74           HB3      LYS  74 -28.754   9.088  -5.947
    5    HG2  LYS  74           HG2      LYS  74 -28.454  12.060  -5.836
    6    HG3  LYS  74           HG3      LYS  74 -27.088  10.970  -6.078
    7    HD2  LYS  74           HD2      LYS  74 -28.180   9.993  -8.012
    8    HD3  LYS  74           HD3      LYS  74 -29.591  11.018  -7.754
    9    HE2  LYS  74           HE2      LYS  74 -28.331  12.993  -8.236
   10    HE3  LYS  74           HE3      LYS  74 -26.820  12.082  -8.268
   11    HZ2  LYS  74           HZ1      LYS  74 -28.241  12.632 -10.441
   12    HZ1  LYS  74           HZ2      LYS  74 -28.923  11.131 -10.032
   13    HZ3  LYS  74           HZ3      LYS  74 -27.251  11.260 -10.300

  No H/Q in entry =          13
  In of MODEL   60
    1    HA   PRO  75           HA       PRO  75 -32.379   7.348  -3.090
    2    HB2  PRO  75           HB2      PRO  75 -32.688   5.083  -4.604
    3    HB3  PRO  75           HB3      PRO  75 -33.794   6.449  -4.741
    4    HG2  PRO  75           HG2      PRO  75 -31.431   5.763  -6.444
    5    HG3  PRO  75           HG3      PRO  75 -33.064   6.207  -6.938
    6    HD2  PRO  75           HD2      PRO  75 -31.097   8.047  -6.917
    7    HD3  PRO  75           HD3      PRO  75 -32.734   8.485  -6.425

  No H/Q in entry =           7
  In of MODEL   60
    1    H    VAL  76           H        VAL  76 -30.968   6.320  -1.653
    2    HA   VAL  76           HA       VAL  76 -28.498   5.042  -2.671
    3    HB   VAL  76           HB       VAL  76 -28.819   6.599  -0.070
    4   HG11  VAL  76          HG11      VAL  76 -26.453   5.234  -1.370
    5   HG13  VAL  76          HG12      VAL  76 -27.187   4.846   0.188
    6   HG12  VAL  76          HG13      VAL  76 -26.316   6.364  -0.022
    7   HG22  VAL  76          HG21      VAL  76 -28.106   8.460  -1.004
    8   HG21  VAL  76          HG22      VAL  76 -28.628   7.721  -2.519
    9   HG23  VAL  76          HG23      VAL  76 -26.938   7.626  -2.028

  No H/Q in entry =           9
  In of MODEL   60
    1    H    GLU  77           H        GLU  77 -28.323   2.906  -1.983
    2    HA   GLU  77           HA       GLU  77 -29.174   2.218   0.679
    3    HB2  GLU  77           HB2      GLU  77 -30.793   0.576   0.171
    4    HB3  GLU  77           HB3      GLU  77 -31.307   2.081  -0.592
    5    HG2  GLU  77           HG2      GLU  77 -30.665   1.243  -2.741
    6    HG3  GLU  77           HG3      GLU  77 -30.058  -0.239  -2.005

  No H/Q in entry =           6
  In of MODEL   60
    1    H    VAL  78           H        VAL  78 -28.889   0.150   1.414
    2    HA   VAL  78           HA       VAL  78 -26.216  -0.686   0.606
    3    HB   VAL  78           HB       VAL  78 -27.983  -1.467   2.964
    4   HG11  VAL  78          HG11      VAL  78 -25.640  -2.764   1.928
    5   HG13  VAL  78          HG12      VAL  78 -26.582  -3.174   3.363
    6   HG12  VAL  78          HG13      VAL  78 -25.249  -2.027   3.482
    7   HG22  VAL  78          HG21      VAL  78 -26.533  -0.081   4.286
    8   HG21  VAL  78          HG22      VAL  78 -27.230   0.856   2.964
    9   HG23  VAL  78          HG23      VAL  78 -25.558   0.303   2.867

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ILE  79           H        ILE  79 -25.687  -2.629  -0.224
    2    HA   ILE  79           HA       ILE  79 -27.742  -4.124  -1.564
    3    HB   ILE  79           HB       ILE  79 -24.763  -4.682  -1.264
    4   HG12  ILE  79          HG12      ILE  79 -26.339  -3.634  -3.622
    5   HG13  ILE  79          HG13      ILE  79 -25.473  -2.598  -2.485
    6   HG22  ILE  79          HG21      ILE  79 -25.834  -5.925  -3.566
    7   HG21  ILE  79          HG22      ILE  79 -26.854  -6.387  -2.202
    8   HG23  ILE  79          HG23      ILE  79 -25.117  -6.688  -2.147
    9   HD13  ILE  79          HD11      ILE  79 -24.026  -2.791  -4.269
   10   HD12  ILE  79          HD12      ILE  79 -24.383  -4.503  -4.500
   11   HD11  ILE  79          HD13      ILE  79 -23.420  -3.981  -3.117

  No H/Q in entry =          11
  In of MODEL   60
    1    H    ASP  80           H        ASP  80 -28.644  -6.016  -0.935
    2    HA   ASP  80           HA       ASP  80 -28.656  -6.827   1.741
    3    HB2  ASP  80           HB2      ASP  80 -30.384  -7.435   0.086
    4    HB3  ASP  80           HB3      ASP  80 -29.222  -8.487  -0.725

  No H/Q in entry =           4
  In of MODEL   60
    1    H    SER  81           H        SER  81 -27.158  -7.944   2.939
    2    HA   SER  81           HA       SER  81 -24.648  -8.698   1.822
    3    HB2  SER  81           HB2      SER  81 -24.154  -9.660   4.036
    4    HB3  SER  81           HB3      SER  81 -24.836  -8.041   4.181
    5    HG   SER  81           HG       SER  81 -26.385 -10.384   4.345

  No H/Q in entry =           5
  In of MODEL   60
    1    H    LEU  82           H        LEU  82 -27.393 -10.742   2.158
    2    HA   LEU  82           HA       LEU  82 -25.868 -13.146   1.749
    3    HB2  LEU  82           HB2      LEU  82 -28.789 -12.504   1.408
    4    HB3  LEU  82           HB3      LEU  82 -28.100 -14.121   1.276
    5    HG   LEU  82           HG       LEU  82 -28.090 -12.441   3.765
    6   HD13  LEU  82          HD11      LEU  82 -30.356 -13.148   3.160
    7   HD12  LEU  82          HD12      LEU  82 -29.776 -14.076   4.544
    8   HD11  LEU  82          HD13      LEU  82 -29.792 -14.805   2.938
    9   HD21  LEU  82          HD21      LEU  82 -27.083 -15.159   2.985
   10   HD23  LEU  82          HD22      LEU  82 -27.521 -14.810   4.656
   11   HD22  LEU  82          HD23      LEU  82 -26.249 -13.879   3.867

  No H/Q in entry =          11
  In of MODEL   60
    1    H    LEU  83           H        LEU  83 -27.757 -10.961  -0.283
    2    HA   LEU  83           HA       LEU  83 -27.524 -12.405  -2.703
    3    HB2  LEU  83           HB2      LEU  83 -27.907  -9.472  -2.161
    4    HB3  LEU  83           HB3      LEU  83 -27.915 -10.172  -3.780
    5    HG   LEU  83           HG       LEU  83 -29.998 -10.458  -1.633
    6   HD13  LEU  83          HD11      LEU  83 -30.707  -8.637  -2.774
    7   HD12  LEU  83          HD12      LEU  83 -31.159  -9.788  -4.030
    8   HD11  LEU  83          HD13      LEU  83 -29.612  -8.946  -4.121
    9   HD23  LEU  83          HD21      LEU  83 -30.100 -11.806  -4.317
   10   HD22  LEU  83          HD22      LEU  83 -31.103 -12.094  -2.896
   11   HD21  LEU  83          HD23      LEU  83 -29.420 -12.621  -2.909

  No H/Q in entry =          11
  In of MODEL   60
    1    H    TYR  84           H        TYR  84 -25.573  -9.989  -1.068
    2    HA   TYR  84           HA       TYR  84 -23.662  -9.599  -3.176
    3    HB2  TYR  84           HB2      TYR  84 -24.213  -8.056  -1.187
    4    HB3  TYR  84           HB3      TYR  84 -23.179  -9.125  -0.241
    5    HD1  TYR  84           HD1      TYR  84 -20.837  -8.880  -0.272
    6    HD2  TYR  84           HD2      TYR  84 -23.201  -6.869  -3.206
    7    HE1  TYR  84           HE1      TYR  84 -18.830  -7.653  -1.032
    8    HE2  TYR  84           HE2      TYR  84 -21.202  -5.645  -3.983
    9    HH   TYR  84           HH       TYR  84 -18.478  -5.330  -2.238

  No H/Q in entry =           9
  In of MODEL   60
    1    H    GLY  85           H        GLY  85 -23.508 -11.504  -0.159
    2    HA3  GLY  85           HA2      GLY  85 -20.935 -12.497  -0.557
    3    HA2  GLY  85           HA3      GLY  85 -22.195 -13.294   0.383

  No H/Q in entry =           3
  In of MODEL   60
    1    H    LYS  86           H        LYS  86 -24.006 -13.713  -1.701
    2    HA   LYS  86           HA       LYS  86 -22.961 -16.142  -2.857
    3    HB2  LYS  86           HB2      LYS  86 -25.584 -14.664  -3.052
    4    HB3  LYS  86           HB3      LYS  86 -25.285 -16.245  -3.773
    5    HG2  LYS  86           HG2      LYS  86 -24.993 -17.204  -1.577
    6    HG3  LYS  86           HG3      LYS  86 -25.262 -15.621  -0.845
    7    HD2  LYS  86           HD2      LYS  86 -27.475 -15.503  -1.881
    8    HD3  LYS  86           HD3      LYS  86 -27.208 -17.063  -2.655
    9    HE2  LYS  86           HE2      LYS  86 -28.582 -17.339  -0.674
   10    HE3  LYS  86           HE3      LYS  86 -27.013 -18.105  -0.432
   11    HZ1  LYS  86           HZ1      LYS  86 -26.642 -15.531   0.400
   12    HZ3  LYS  86           HZ2      LYS  86 -26.872 -16.882   1.406
   13    HZ2  LYS  86           HZ3      LYS  86 -28.195 -15.911   0.971

  No H/Q in entry =          13
  In of MODEL   60
    1    H    VAL  87           H        VAL  87 -22.887 -12.961  -3.859
    2    HA   VAL  87           HA       VAL  87 -22.534 -11.858  -5.832
    3    HB   VAL  87           HB       VAL  87 -21.467 -14.440  -7.020
    4   HG11  VAL  87          HG11      VAL  87 -21.660 -12.073  -8.180
    5   HG13  VAL  87          HG12      VAL  87 -20.206 -13.049  -8.397
    6   HG12  VAL  87          HG13      VAL  87 -20.215 -11.724  -7.235
    7   HG23  VAL  87          HG21      VAL  87 -19.238 -13.653  -6.004
    8   HG22  VAL  87          HG22      VAL  87 -20.368 -14.535  -4.977
    9   HG21  VAL  87          HG23      VAL  87 -20.245 -12.781  -4.850

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ASP  88           H        ASP  88 -25.064 -12.454  -5.510
    2    HA   ASP  88           HA       ASP  88 -26.155 -13.738  -7.886
    3    HB2  ASP  88           HB2      ASP  88 -27.200 -13.890  -5.575
    4    HB3  ASP  88           HB3      ASP  88 -27.626 -12.188  -5.742

  No H/Q in entry =           4
  In of MODEL   60
    1    H    GLY  89           H        GLY  89 -25.402 -12.547  -9.555
    2    HA3  GLY  89           HA2      GLY  89 -25.542  -9.780  -9.854
    3    HA2  GLY  89           HA3      GLY  89 -25.507 -10.947 -11.175

  No H/Q in entry =           3
  In of MODEL   60
    1    H    LEU  90           H        LEU  90 -27.979 -12.252 -10.729
    2    HA   LEU  90           HA       LEU  90 -29.742 -10.333 -11.943
    3    HB2  LEU  90           HB2      LEU  90 -29.829 -12.748 -12.443
    4    HB3  LEU  90           HB3      LEU  90 -30.371 -13.050 -10.793
    5    HG   LEU  90           HG       LEU  90 -32.467 -11.919 -11.235
    6   HD13  LEU  90          HD11      LEU  90 -32.236 -10.232 -12.765
    7   HD12  LEU  90          HD12      LEU  90 -32.770 -11.502 -13.870
    8   HD11  LEU  90          HD13      LEU  90 -31.053 -11.125 -13.726
    9   HD23  LEU  90          HD21      LEU  90 -32.372 -13.633 -13.612
   10   HD22  LEU  90          HD22      LEU  90 -33.381 -13.735 -12.169
   11   HD21  LEU  90          HD23      LEU  90 -31.735 -14.369 -12.141

  No H/Q in entry =          11
  In of MODEL   60
    1    H    GLY  91           H        GLY  91 -29.655 -11.726  -8.707
    2    HA3  GLY  91           HA2      GLY  91 -31.999 -10.549  -7.753
    3    HA2  GLY  91           HA3      GLY  91 -30.633 -11.067  -6.766

  No H/Q in entry =           3
  In of MODEL   60
    1    H    VAL  92           H        VAL  92 -28.675  -9.295  -7.645
    2    HA   VAL  92           HA       VAL  92 -29.466  -6.932  -6.192
    3    HB   VAL  92           HB       VAL  92 -26.895  -7.488  -7.721
    4   HG12  VAL  92          HG11      VAL  92 -27.080  -5.521  -5.463
    5   HG11  VAL  92          HG12      VAL  92 -27.708  -5.023  -7.036
    6   HG13  VAL  92          HG13      VAL  92 -26.021  -5.508  -6.875
    7   HG22  VAL  92          HG21      VAL  92 -26.724  -9.022  -6.071
    8   HG21  VAL  92          HG22      VAL  92 -27.879  -8.190  -5.028
    9   HG23  VAL  92          HG23      VAL  92 -26.215  -7.615  -5.137

  No H/Q in entry =           9
  In of MODEL   60
    1    H    LEU  93           H        LEU  93 -29.002  -7.717  -9.580
    2    HA   LEU  93           HA       LEU  93 -29.295  -5.111 -10.605
    3    HB2  LEU  93           HB2      LEU  93 -28.650  -7.022 -11.990
    4    HB3  LEU  93           HB3      LEU  93 -30.255  -7.723 -11.772
    5    HG   LEU  93           HG       LEU  93 -31.219  -5.787 -12.984
    6   HD11  LEU  93          HD11      LEU  93 -29.358  -4.197 -12.498
    7   HD13  LEU  93          HD12      LEU  93 -29.765  -4.282 -14.213
    8   HD12  LEU  93          HD13      LEU  93 -28.335  -5.113 -13.605
    9   HD23  LEU  93          HD21      LEU  93 -30.144  -6.445 -15.229
   10   HD22  LEU  93          HD22      LEU  93 -31.020  -7.660 -14.297
   11   HD21  LEU  93          HD23      LEU  93 -29.255  -7.625 -14.267

  No H/Q in entry =          11
  In of MODEL   60
    1    H    LYS  94           H        LYS  94 -31.719  -7.597  -9.715
    2    HA   LYS  94           HA       LYS  94 -34.032  -6.149 -10.435
    3    HB2  LYS  94           HB2      LYS  94 -33.584  -8.270  -8.339
    4    HB3  LYS  94           HB3      LYS  94 -35.168  -7.565  -8.662
    5    HG2  LYS  94           HG2      LYS  94 -35.047  -8.420 -10.966
    6    HG3  LYS  94           HG3      LYS  94 -33.503  -9.179 -10.582
    7    HD2  LYS  94           HD2      LYS  94 -34.674 -10.435  -8.735
    8    HD3  LYS  94           HD3      LYS  94 -36.198  -9.789  -9.341
    9    HE2  LYS  94           HE2      LYS  94 -35.651 -10.802 -11.565
   10    HE3  LYS  94           HE3      LYS  94 -34.261 -11.578 -10.807
   11    HZ3  LYS  94           HZ1      LYS  94 -36.126 -13.081 -10.961
   12    HZ2  LYS  94           HZ2      LYS  94 -37.104 -12.011 -10.074
   13    HZ1  LYS  94           HZ3      LYS  94 -35.768 -12.752  -9.334

  No H/Q in entry =          13
  In of MODEL   60
    1    H    ALA  95           H        ALA  95 -32.268  -6.187  -7.348
    2    HA   ALA  95           HA       ALA  95 -34.125  -4.534  -5.960
    3    HB2  ALA  95           HB1      ALA  95 -31.778  -5.919  -5.331
    4    HB3  ALA  95           HB2      ALA  95 -32.766  -4.963  -4.228
    5    HB1  ALA  95           HB3      ALA  95 -31.393  -4.221  -5.050

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ALA  96           H        ALA  96 -31.434  -3.786  -8.034
    2    HA   ALA  96           HA       ALA  96 -31.316  -1.000  -7.353
    3    HB2  ALA  96           HB1      ALA  96 -29.911  -0.864  -9.442
    4    HB3  ALA  96           HB2      ALA  96 -30.231  -2.577  -9.708
    5    HB1  ALA  96           HB3      ALA  96 -29.337  -2.060  -8.280

  No H/Q in entry =           5
  In of MODEL   60
    1    H    VAL  97           H        VAL  97 -32.819  -2.787 -10.008
    2    HA   VAL  97           HA       VAL  97 -33.834  -0.518 -11.362
    3    HB   VAL  97           HB       VAL  97 -34.682  -3.433 -11.320
    4   HG11  VAL  97          HG11      VAL  97 -36.437  -1.421 -11.908
    5   HG13  VAL  97          HG12      VAL  97 -36.504  -3.038 -12.612
    6   HG12  VAL  97          HG13      VAL  97 -35.717  -1.728 -13.490
    7   HG21  VAL  97          HG21      VAL  97 -33.340  -1.692 -13.391
    8   HG23  VAL  97          HG22      VAL  97 -33.811  -3.376 -13.632
    9   HG22  VAL  97          HG23      VAL  97 -32.580  -2.964 -12.437

  No H/Q in entry =           9
  In of MODEL   60
    1    H    ALA  98           H        ALA  98 -35.094  -2.593  -8.776
    2    HA   ALA  98           HA       ALA  98 -37.645  -1.398  -8.514
    3    HB1  ALA  98           HB1      ALA  98 -36.682  -3.574  -7.387
    4    HB3  ALA  98           HB2      ALA  98 -37.866  -2.603  -6.511
    5    HB2  ALA  98           HB3      ALA  98 -36.152  -2.466  -6.124

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ALA  99           H        ALA  99 -34.586  -0.587  -6.836
    2    HA   ALA  99           HA       ALA  99 -35.717   1.468  -5.264
    3    HB1  ALA  99           HB1      ALA  99 -33.069   0.516  -5.929
    4    HB2  ALA  99           HB2      ALA  99 -33.635   1.325  -4.468
    5    HB3  ALA  99           HB3      ALA  99 -33.119   2.278  -5.858

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ILE 100           H        ILE 100 -34.612   1.470  -8.601
    2    HA   ILE 100           HA       ILE 100 -34.743   4.312  -8.919
    3    HB   ILE 100           HB       ILE 100 -34.831   2.088 -10.985
    4   HG12  ILE 100          HG12      ILE 100 -32.650   4.069 -10.340
    5   HG13  ILE 100          HG13      ILE 100 -32.724   2.446  -9.656
    6   HG21  ILE 100          HG21      ILE 100 -35.207   5.008 -11.222
    7   HG23  ILE 100          HG22      ILE 100 -35.711   3.710 -12.304
    8   HG22  ILE 100          HG23      ILE 100 -34.048   4.299 -12.348
    9   HD12  ILE 100          HD11      ILE 100 -32.125   3.301 -12.450
   10   HD11  ILE 100          HD12      ILE 100 -32.815   1.705 -12.153
   11   HD13  ILE 100          HD13      ILE 100 -31.276   2.149 -11.420

  No H/Q in entry =          11
  In of MODEL   60
    1    H    LYS 101           H        LYS 101 -37.063   1.714  -9.601
    2    HA   LYS 101           HA       LYS 101 -39.099   3.360 -10.695
    3    HB2  LYS 101           HB2      LYS 101 -39.047   0.623  -9.474
    4    HB3  LYS 101           HB3      LYS 101 -40.581   1.396  -9.874
    5    HG2  LYS 101           HG2      LYS 101 -40.061   1.447 -12.165
    6    HG3  LYS 101           HG3      LYS 101 -38.378   1.025 -11.865
    7    HD2  LYS 101           HD2      LYS 101 -39.640  -0.893 -12.711
    8    HD3  LYS 101           HD3      LYS 101 -39.048  -1.178 -11.075
    9    HE2  LYS 101           HE2      LYS 101 -41.131  -1.825 -10.585
   10    HE3  LYS 101           HE3      LYS 101 -41.561  -0.115 -10.653
   11    HZ3  LYS 101           HZ1      LYS 101 -42.415  -0.328 -12.781
   12    HZ2  LYS 101           HZ2      LYS 101 -42.912  -1.770 -12.034
   13    HZ1  LYS 101           HZ3      LYS 101 -41.585  -1.779 -13.093

  No H/Q in entry =          13
  In of MODEL   60
    1    H    LYS 102           H        LYS 102 -38.691   1.982  -7.431
    2    HA   LYS 102           HA       LYS 102 -40.942   3.251  -6.316
    3    HB2  LYS 102           HB2      LYS 102 -39.754   1.400  -5.216
    4    HB3  LYS 102           HB3      LYS 102 -38.352   2.443  -4.981
    5    HG2  LYS 102           HG2      LYS 102 -39.674   3.905  -3.556
    6    HG3  LYS 102           HG3      LYS 102 -41.080   2.868  -3.795
    7    HD2  LYS 102           HD2      LYS 102 -39.903   1.018  -2.684
    8    HD3  LYS 102           HD3      LYS 102 -38.498   2.059  -2.444
    9    HE2  LYS 102           HE2      LYS 102 -39.855   3.602  -1.111
   10    HE3  LYS 102           HE3      LYS 102 -41.276   2.594  -1.373
   11    HZ1  LYS 102           HZ1      LYS 102 -39.603   0.847  -0.280
   12    HZ3  LYS 102           HZ2      LYS 102 -40.717   1.779   0.599
   13    HZ2  LYS 102           HZ3      LYS 102 -39.097   2.275   0.486

  No H/Q in entry =          13
  In of MODEL   60
    1    H    ALA 103           H        ALA 103 -37.947   4.564  -7.316
    2    HA   ALA 103           HA       ALA 103 -38.168   6.938  -5.615
    3    HB2  ALA 103           HB1      ALA 103 -36.135   7.590  -7.176
    4    HB3  ALA 103           HB2      ALA 103 -36.119   5.860  -7.516
    5    HB1  ALA 103           HB3      ALA 103 -35.916   6.435  -5.862

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ALA 104           H        ALA 104 -38.736   6.107  -8.948
    2    HA   ALA 104           HA       ALA 104 -39.265   8.878  -9.671
    3    HB2  ALA 104           HB1      ALA 104 -39.277   8.139 -11.852
    4    HB1  ALA 104           HB2      ALA 104 -40.035   6.601 -11.437
    5    HB3  ALA 104           HB3      ALA 104 -38.315   6.847 -11.133

  No H/Q in entry =           5
  In of MODEL   60
    1    H    ALA 105           H        ALA 105 -40.941   6.858  -7.831
    2    HA   ALA 105           HA       ALA 105 -43.344   8.288  -7.898
    3    HB2  ALA 105           HB1      ALA 105 -44.062   7.374  -9.921
    4    HB3  ALA 105           HB2      ALA 105 -44.739   6.233  -8.759
    5    HB1  ALA 105           HB3      ALA 105 -43.258   5.833  -9.627

  No H/Q in entry =           5
  In of MODEL   61
    1    H1   ALA   1           H3       ALA   1 -12.055 -16.124  -2.389
    2    H2   ALA   1           H2       ALA   1 -11.096 -17.256  -3.223
    3    H3   ALA   1           H1       ALA   1 -12.252 -16.332  -4.062
    4    HA   ALA   1           HA       ALA   1 -13.626 -18.051  -3.818
    5    HB3  ALA   1           HB1      ALA   1 -12.205 -19.800  -3.346
    6    HB1  ALA   1           HB2      ALA   1 -12.965 -19.692  -1.759
    7    HB2  ALA   1           HB3      ALA   1 -11.400 -18.930  -2.040

  No H/Q in entry =           7
  In of MODEL   61
    1    H    GLU   2           H        GLU   2 -15.239 -18.923  -2.162
    2    HA   GLU   2           HA       GLU   2 -16.914 -17.222  -1.113
    3    HB2  GLU   2           HB2      GLU   2 -15.941 -19.628   0.443
    4    HB3  GLU   2           HB3      GLU   2 -17.478 -18.799   0.691
    5    HG2  GLU   2           HG2      GLU   2 -18.439 -19.907  -1.040
    6    HG3  GLU   2           HG3      GLU   2 -17.120 -19.491  -2.124

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLU   3           H        GLU   3 -14.986 -18.537   1.518
    2    HA   GLU   3           HA       GLU   3 -15.244 -16.180   3.066
    3    HB2  GLU   3           HB2      GLU   3 -13.622 -18.703   3.329
    4    HB3  GLU   3           HB3      GLU   3 -13.412 -17.375   4.471
    5    HG2  GLU   3           HG2      GLU   3 -15.604 -17.555   5.287
    6    HG3  GLU   3           HG3      GLU   3 -16.185 -18.370   3.840

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LEU   4           H        LEU   4 -12.266 -17.622   1.685
    2    HA   LEU   4           HA       LEU   4 -10.460 -15.689   2.279
    3    HB2  LEU   4           HB2      LEU   4 -10.668 -17.001  -0.441
    4    HB3  LEU   4           HB3      LEU   4  -9.227 -16.257   0.243
    5    HG   LEU   4           HG       LEU   4 -10.688 -18.671   1.363
    6   HD13  LEU   4          HD11      LEU   4  -9.035 -20.007   0.442
    7   HD12  LEU   4          HD12      LEU   4  -7.844 -18.706   0.412
    8   HD11  LEU   4          HD13      LEU   4  -9.130 -18.752  -0.793
    9   HD23  LEU   4          HD21      LEU   4  -8.439 -18.696   2.749
   10   HD22  LEU   4          HD22      LEU   4  -9.775 -17.674   3.271
   11   HD21  LEU   4          HD23      LEU   4  -8.422 -16.969   2.388

  No H/Q in entry =          11
  In of MODEL   61
    1    H    GLU   5           H        GLU   5 -12.793 -15.527  -0.400
    2    HA   GLU   5           HA       GLU   5 -11.825 -13.034  -1.409
    3    HB2  GLU   5           HB2      GLU   5 -13.144 -14.643  -2.769
    4    HB3  GLU   5           HB3      GLU   5 -14.551 -14.301  -1.761
    5    HG2  GLU   5           HG2      GLU   5 -14.458 -11.931  -2.408
    6    HG3  GLU   5           HG3      GLU   5 -13.031 -12.248  -3.393

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLU   6           H        GLU   6 -14.540 -13.943   0.682
    2    HA   GLU   6           HA       GLU   6 -15.484 -11.278   1.069
    3    HB2  GLU   6           HB2      GLU   6 -15.939 -13.919   2.413
    4    HB3  GLU   6           HB3      GLU   6 -16.502 -12.442   3.193
    5    HG2  GLU   6           HG2      GLU   6 -18.301 -13.311   1.817
    6    HG3  GLU   6           HG3      GLU   6 -17.686 -11.841   1.065

  No H/Q in entry =           6
  In of MODEL   61
    1    H    VAL   7           H        VAL   7 -13.149 -13.348   2.653
    2    HA   VAL   7           HA       VAL   7 -12.710 -11.757   4.974
    3    HB   VAL   7           HB       VAL   7 -10.974 -13.782   3.536
    4   HG11  VAL   7          HG11      VAL   7 -10.533 -12.232   6.095
    5   HG13  VAL   7          HG12      VAL   7  -9.427 -12.436   4.737
    6   HG12  VAL   7          HG13      VAL   7  -9.763 -13.793   5.812
    7   HG21  VAL   7          HG21      VAL   7 -13.219 -14.374   4.754
    8   HG23  VAL   7          HG22      VAL   7 -12.298 -14.080   6.230
    9   HG22  VAL   7          HG23      VAL   7 -11.785 -15.337   5.107

  No H/Q in entry =           9
  In of MODEL   61
    1    H    VAL   8           H        VAL   8 -11.191 -11.863   1.767
    2    HA   VAL   8           HA       VAL   8  -9.156  -9.959   2.256
    3    HB   VAL   8           HB       VAL   8 -10.605 -10.680  -0.302
    4   HG11  VAL   8          HG11      VAL   8  -8.351  -8.783   0.290
    5   HG13  VAL   8          HG12      VAL   8  -9.701  -8.593  -0.829
    6   HG12  VAL   8          HG13      VAL   8  -8.361  -9.665  -1.238
    7   HG23  VAL   8          HG21      VAL   8  -7.753 -11.407   0.128
    8   HG22  VAL   8          HG22      VAL   8  -9.067 -12.369  -0.541
    9   HG21  VAL   8          HG23      VAL   8  -8.885 -12.227   1.204

  No H/Q in entry =           9
  In of MODEL   61
    1    H    MET   9           H        MET   9 -12.505  -9.622   1.089
    2    HA   MET   9           HA       MET   9 -12.481  -6.847   0.642
    3    HB2  MET   9           HB2      MET   9 -14.636  -8.804   1.392
    4    HB3  MET   9           HB3      MET   9 -14.988  -7.075   1.342
    5    HG2  MET   9           HG2      MET   9 -13.921  -7.102  -1.001
    6    HG3  MET   9           HG3      MET   9 -14.063  -8.858  -0.910
    7    HE3  MET   9           HE1      MET   9 -17.707  -9.676  -0.835
    8    HE2  MET   9           HE2      MET   9 -16.725  -9.488   0.615
    9    HE1  MET   9           HE3      MET   9 -16.014 -10.191  -0.836

  No H/Q in entry =           9
  In of MODEL   61
    1    H    GLY  10           H        GLY  10 -13.122  -8.735   3.577
    2    HA3  GLY  10           HA2      GLY  10 -13.705  -6.552   5.285
    3    HA2  GLY  10           HA3      GLY  10 -13.119  -8.130   5.807

  No H/Q in entry =           3
  In of MODEL   61
    1    H    LEU  11           H        LEU  11 -10.669  -8.223   4.497
    2    HA   LEU  11           HA       LEU  11  -8.993  -6.758   6.251
    3    HB2  LEU  11           HB2      LEU  11  -8.420  -8.184   3.650
    4    HB3  LEU  11           HB3      LEU  11  -7.163  -7.456   4.648
    5    HG   LEU  11           HG       LEU  11  -9.136  -9.515   5.669
    6   HD13  LEU  11          HD11      LEU  11  -7.894 -10.740   4.112
    7   HD12  LEU  11          HD12      LEU  11  -6.958 -10.958   5.590
    8   HD11  LEU  11          HD13      LEU  11  -6.432  -9.790   4.379
    9   HD22  LEU  11          HD21      LEU  11  -8.302  -8.481   7.583
   10   HD21  LEU  11          HD22      LEU  11  -6.769  -8.060   6.822
   11   HD23  LEU  11          HD23      LEU  11  -7.071  -9.719   7.338

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  12           H        ILE  12  -9.897  -6.238   2.857
    2    HA   ILE  12           HA       ILE  12  -8.238  -3.985   2.424
    3    HB   ILE  12           HB       ILE  12 -10.878  -4.703   1.126
    4   HG12  ILE  12          HG12      ILE  12  -8.813  -6.320   1.061
    5   HG13  ILE  12          HG13      ILE  12  -9.679  -5.984  -0.424
    6   HG22  ILE  12          HG21      ILE  12  -9.978  -3.303  -0.766
    7   HG21  ILE  12          HG22      ILE  12  -8.687  -2.766   0.301
    8   HG23  ILE  12          HG23      ILE  12 -10.348  -2.402   0.672
    9   HD13  ILE  12          HD11      ILE  12  -7.982  -4.388  -1.089
   10   HD12  ILE  12          HD12      ILE  12  -7.181  -5.890  -0.631
   11   HD11  ILE  12          HD13      ILE  12  -7.183  -4.530   0.466

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  13           H        ILE  13 -11.597  -4.299   3.512
    2    HA   ILE  13           HA       ILE  13 -12.100  -1.518   3.769
    3    HB   ILE  13           HB       ILE  13 -13.270  -3.954   5.134
    4   HG12  ILE  13          HG12      ILE  13 -13.501  -3.405   2.596
    5   HG13  ILE  13          HG13      ILE  13 -14.916  -3.898   3.500
    6   HG23  ILE  13          HG21      ILE  13 -13.726  -2.210   6.678
    7   HG22  ILE  13          HG22      ILE  13 -15.192  -2.333   5.713
    8   HG21  ILE  13          HG23      ILE  13 -14.040  -1.037   5.401
    9   HD11  ILE  13          HD11      ILE  13 -14.178  -0.996   3.064
   10   HD13  ILE  13          HD12      ILE  13 -15.672  -1.644   3.712
   11   HD12  ILE  13          HD13      ILE  13 -15.287  -1.896   2.024

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ASN  14           H        ASN  14 -10.954  -3.981   6.057
    2    HA   ASN  14           HA       ASN  14 -10.784  -2.330   8.335
    3    HB2  ASN  14           HB2      ASN  14 -10.489  -4.935   8.025
    4    HB3  ASN  14           HB3      ASN  14  -8.786  -4.521   7.870
    5   HD21  ASN  14          HD21      ASN  14  -9.403  -6.046  10.051
    6   HD22  ASN  14          HD22      ASN  14  -9.393  -5.120  11.471

  No H/Q in entry =           6
  In of MODEL   61
    1    H    SER  15           H        SER  15  -8.364  -3.126   5.852
    2    HA   SER  15           HA       SER  15  -6.248  -1.594   6.922
    3    HB2  SER  15           HB2      SER  15  -5.219  -1.801   4.766
    4    HB3  SER  15           HB3      SER  15  -6.150  -3.277   4.997
    5    HG   SER  15           HG       SER  15  -6.341  -1.682   2.996

  No H/Q in entry =           5
  In of MODEL   61
    1    H    GLY  16           H        GLY  16  -8.858  -0.780   4.666
    2    HA3  GLY  16           HA2      GLY  16  -8.043   1.873   4.104
    3    HA2  GLY  16           HA3      GLY  16  -9.683   1.250   3.942

  No H/Q in entry =           3
  In of MODEL   61
    1    H    GLN  17           H        GLN  17 -10.219   0.527   6.594
    2    HA   GLN  17           HA       GLN  17 -10.971   3.024   7.722
    3    HB2  GLN  17           HB2      GLN  17 -12.157   0.902   8.206
    4    HB3  GLN  17           HB3      GLN  17 -10.747   0.337   9.102
    5    HG2  GLN  17           HG2      GLN  17 -12.369   1.266  10.670
    6    HG3  GLN  17           HG3      GLN  17 -10.956   2.320  10.604
    7   HE21  GLN  17          HE21      GLN  17 -11.959   4.345  11.018
    8   HE22  GLN  17          HE22      GLN  17 -13.167   5.006  10.024

  No H/Q in entry =           8
  In of MODEL   61
    1    H    ALA  18           H        ALA  18  -8.305   0.791   8.357
    2    HA   ALA  18           HA       ALA  18  -7.233   2.035  10.624
    3    HB2  ALA  18           HB1      ALA  18  -6.582  -0.176   9.268
    4    HB3  ALA  18           HB2      ALA  18  -5.436   0.632  10.337
    5    HB1  ALA  18           HB3      ALA  18  -5.359   0.904   8.596

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ARG  19           H        ARG  19  -6.464   2.557   7.175
    2    HA   ARG  19           HA       ARG  19  -4.602   4.639   7.598
    3    HB2  ARG  19           HB2      ARG  19  -4.905   3.483   5.407
    4    HB3  ARG  19           HB3      ARG  19  -6.462   4.296   5.224
    5    HG2  ARG  19           HG2      ARG  19  -5.371   6.487   5.284
    6    HG3  ARG  19           HG3      ARG  19  -3.810   5.731   5.595
    7    HD2  ARG  19           HD2      ARG  19  -3.940   6.308   3.249
    8    HD3  ARG  19           HD3      ARG  19  -3.994   4.548   3.403
    9    HE   ARG  19           HE       ARG  19  -6.643   5.410   3.386
   10   HH21  ARG  19          HH11      ARG  19  -7.837   5.536   1.464
   11   HH22  ARG  19          HH12      ARG  19  -7.013   5.622  -0.054
   12   HH11  ARG  19          HH21      ARG  19  -3.865   5.513   1.357
   13   HH12  ARG  19          HH22      ARG  19  -4.763   5.606  -0.115

  No H/Q in entry =          13
  In of MODEL   61
    1    H    SER  20           H        SER  20  -8.101   4.689   6.990
    2    HA   SER  20           HA       SER  20  -8.507   7.438   6.928
    3    HB2  SER  20           HB2      SER  20 -10.359   6.063   6.394
    4    HB3  SER  20           HB3      SER  20 -10.237   5.176   7.911
    5    HG   SER  20           HG       SER  20 -10.629   7.348   8.885

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LEU  21           H        LEU  21  -8.474   5.268   9.743
    2    HA   LEU  21           HA       LEU  21  -8.955   7.265  11.697
    3    HB2  LEU  21           HB2      LEU  21  -7.554   4.589  11.873
    4    HB3  LEU  21           HB3      LEU  21  -7.886   5.607  13.272
    5    HG   LEU  21           HG       LEU  21 -10.030   4.654  11.349
    6   HD11  LEU  21          HD11      LEU  21  -9.078   3.490  13.978
    7   HD13  LEU  21          HD12      LEU  21  -9.099   2.695  12.404
    8   HD12  LEU  21          HD13      LEU  21 -10.615   3.068  13.224
    9   HD22  LEU  21          HD21      LEU  21 -10.961   6.478  12.487
   10   HD21  LEU  21          HD22      LEU  21 -10.024   6.192  13.950
   11   HD23  LEU  21          HD23      LEU  21 -11.394   5.160  13.572

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ALA  22           H        ALA  22  -5.975   5.939  10.303
    2    HA   ALA  22           HA       ALA  22  -4.124   7.295  11.923
    3    HB2  ALA  22           HB1      ALA  22  -3.669   5.441  10.242
    4    HB1  ALA  22           HB2      ALA  22  -2.498   6.759  10.273
    5    HB3  ALA  22           HB3      ALA  22  -3.712   6.687   8.995

  No H/Q in entry =           5
  In of MODEL   61
    1    H    TYR  23           H        TYR  23  -5.452   8.273   8.733
    2    HA   TYR  23           HA       TYR  23  -4.162  10.793   8.654
    3    HB2  TYR  23           HB2      TYR  23  -5.221   9.851   6.664
    4    HB3  TYR  23           HB3      TYR  23  -6.803   9.933   7.441
    5    HD1  TYR  23           HD1      TYR  23  -3.937  12.022   6.282
    6    HD2  TYR  23           HD2      TYR  23  -8.078  11.923   7.416
    7    HE1  TYR  23           HE1      TYR  23  -4.204  14.365   5.511
    8    HE2  TYR  23           HE2      TYR  23  -8.346  14.264   6.643
    9    HH   TYR  23           HH       TYR  23  -5.577  16.099   5.347

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ALA  24           H        ALA  24  -7.266   9.764  10.031
    2    HA   ALA  24           HA       ALA  24  -8.153  12.341  10.788
    3    HB1  ALA  24           HB1      ALA  24  -9.949  11.058  11.257
    4    HB2  ALA  24           HB2      ALA  24  -9.116  10.509  12.709
    5    HB3  ALA  24           HB3      ALA  24  -8.970   9.593  11.210

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ALA  25           H        ALA  25  -6.109   9.928  12.378
    2    HA   ALA  25           HA       ALA  25  -5.801  11.198  14.875
    3    HB2  ALA  25           HB1      ALA  25  -4.989   8.857  14.067
    4    HB3  ALA  25           HB2      ALA  25  -3.992   9.739  15.226
    5    HB1  ALA  25           HB3      ALA  25  -3.552   9.722  13.518

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LEU  26           H        LEU  26  -4.009  11.516  11.838
    2    HA   LEU  26           HA       LEU  26  -2.087  13.376  12.751
    3    HB2  LEU  26           HB2      LEU  26  -1.758  12.221  10.653
    4    HB3  LEU  26           HB3      LEU  26  -3.243  12.898   9.991
    5    HG   LEU  26           HG       LEU  26  -2.271  15.168  10.119
    6   HD12  LEU  26          HD11      LEU  26   0.266  15.236  10.539
    7   HD11  LEU  26          HD12      LEU  26   0.070  13.655  11.290
    8   HD13  LEU  26          HD13      LEU  26  -0.765  15.058  11.958
    9   HD21  LEU  26          HD21      LEU  26  -0.486  13.139   8.738
   10   HD23  LEU  26          HD22      LEU  26  -0.560  14.858   8.359
   11   HD22  LEU  26          HD23      LEU  26  -1.964  13.833   8.072

  No H/Q in entry =          11
  In of MODEL   61
    1    H    LYS  27           H        LYS  27  -5.273  13.793  11.263
    2    HA   LYS  27           HA       LYS  27  -5.269  16.582  11.052
    3    HB2  LYS  27           HB2      LYS  27  -6.983  15.068  10.069
    4    HB3  LYS  27           HB3      LYS  27  -7.639  14.807  11.685
    5    HG2  LYS  27           HG2      LYS  27  -8.113  17.206  11.909
    6    HG3  LYS  27           HG3      LYS  27  -7.406  17.509  10.318
    7    HD2  LYS  27           HD2      LYS  27  -9.110  16.038   9.284
    8    HD3  LYS  27           HD3      LYS  27  -9.822  15.753  10.874
    9    HE2  LYS  27           HE2      LYS  27 -10.309  18.157  11.104
   10    HE3  LYS  27           HE3      LYS  27  -9.569  18.464   9.530
   11    HZ3  LYS  27           HZ1      LYS  27 -11.943  18.295   9.283
   12    HZ2  LYS  27           HZ2      LYS  27 -11.966  16.782  10.060
   13    HZ1  LYS  27           HZ3      LYS  27 -11.220  16.951   8.539

  No H/Q in entry =          13
  In of MODEL   61
    1    H    GLN  28           H        GLN  28  -6.126  14.492  13.787
    2    HA   GLN  28           HA       GLN  28  -7.062  16.488  15.551
    3    HB2  GLN  28           HB2      GLN  28  -5.615  13.885  16.109
    4    HB3  GLN  28           HB3      GLN  28  -6.375  14.881  17.350
    5    HG2  GLN  28           HG2      GLN  28  -7.813  13.726  14.945
    6    HG3  GLN  28           HG3      GLN  28  -7.862  13.042  16.569
    7   HE21  GLN  28          HE21      GLN  28  -9.723  14.856  14.573
    8   HE22  GLN  28          HE22      GLN  28 -10.507  15.844  15.707

  No H/Q in entry =           8
  In of MODEL   61
    1    H    ALA  29           H        ALA  29  -3.819  15.245  14.876
    2    HA   ALA  29           HA       ALA  29  -2.410  16.676  16.851
    3    HB1  ALA  29           HB1      ALA  29  -0.465  16.013  15.740
    4    HB3  ALA  29           HB2      ALA  29  -1.218  16.117  14.148
    5    HB2  ALA  29           HB3      ALA  29  -1.620  14.783  15.228

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LYS  30           H        LYS  30  -3.275  17.526  13.516
    2    HA   LYS  30           HA       LYS  30  -1.904  19.988  13.407
    3    HB2  LYS  30           HB2      LYS  30  -4.417  19.068  11.997
    4    HB3  LYS  30           HB3      LYS  30  -3.606  20.594  11.648
    5    HG2  LYS  30           HG2      LYS  30  -1.515  19.331  11.145
    6    HG3  LYS  30           HG3      LYS  30  -2.399  17.822  11.394
    7    HD2  LYS  30           HD2      LYS  30  -3.969  18.430   9.593
    8    HD3  LYS  30           HD3      LYS  30  -3.108  19.951   9.346
    9    HE2  LYS  30           HE2      LYS  30  -1.055  18.687   8.776
   10    HE3  LYS  30           HE3      LYS  30  -1.934  17.171   8.993
   11    HZ2  LYS  30           HZ1      LYS  30  -1.766  18.034   6.648
   12    HZ1  LYS  30           HZ2      LYS  30  -2.830  19.283   7.108
   13    HZ3  LYS  30           HZ3      LYS  30  -3.330  17.659   7.185

  No H/Q in entry =          13
  In of MODEL   61
    1    H    GLN  31           H        GLN  31  -4.994  19.096  14.817
    2    HA   GLN  31           HA       GLN  31  -5.798  21.843  15.255
    3    HB2  GLN  31           HB2      GLN  31  -6.945  19.386  16.586
    4    HB3  GLN  31           HB3      GLN  31  -7.727  20.945  16.332
    5    HG2  GLN  31           HG2      GLN  31  -7.000  20.167  13.747
    6    HG3  GLN  31           HG3      GLN  31  -7.505  18.658  14.499
    7   HE21  GLN  31          HE21      GLN  31  -8.933  20.203  12.388
    8   HE22  GLN  31          HE22      GLN  31 -10.453  20.576  13.041

  No H/Q in entry =           8
  In of MODEL   61
    1    H    GLY  32           H        GLY  32  -3.462  19.955  16.588
    2    HA3  GLY  32           HA2      GLY  32  -2.072  20.444  18.391
    3    HA2  GLY  32           HA3      GLY  32  -3.219  21.673  18.907

  No H/Q in entry =           3
  In of MODEL   61
    1    H    ASP  33           H        ASP  33  -4.598  18.611  18.255
    2    HA   ASP  33           HA       ASP  33  -5.008  18.160  21.136
    3    HB2  ASP  33           HB2      ASP  33  -6.395  17.119  18.660
    4    HB3  ASP  33           HB3      ASP  33  -6.735  16.510  20.278

  No H/Q in entry =           4
  In of MODEL   61
    1    H    PHE  34           H        PHE  34  -2.828  17.340  21.449
    2    HA   PHE  34           HA       PHE  34  -1.794  15.100  20.060
    3    HB2  PHE  34           HB2      PHE  34  -1.196  16.104  22.851
    4    HB3  PHE  34           HB3      PHE  34  -0.249  14.890  21.991
    5    HD1  PHE  34           HD1      PHE  34  -0.470  18.316  22.711
    6    HD2  PHE  34           HD2      PHE  34   0.404  15.612  19.489
    7    HE1  PHE  34           HE1      PHE  34   0.803  20.100  21.553
    8    HE2  PHE  34           HE2      PHE  34   1.672  17.399  18.336
    9    HZ   PHE  34           HZ       PHE  34   1.873  19.640  19.372

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ALA  35           H        ALA  35  -3.843  15.360  22.918
    2    HA   ALA  35           HA       ALA  35  -3.596  12.705  23.825
    3    HB3  ALA  35           HB1      ALA  35  -6.064  13.300  24.675
    4    HB1  ALA  35           HB2      ALA  35  -5.552  14.924  24.214
    5    HB2  ALA  35           HB3      ALA  35  -4.628  14.017  25.411

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ALA  36           H        ALA  36  -6.063  14.179  21.715
    2    HA   ALA  36           HA       ALA  36  -7.444  11.747  21.244
    3    HB1  ALA  36           HB1      ALA  36  -8.917  13.145  20.280
    4    HB3  ALA  36           HB2      ALA  36  -7.748  13.577  19.031
    5    HB2  ALA  36           HB3      ALA  36  -7.788  14.470  20.551

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ALA  37           H        ALA  37  -4.782  13.364  19.574
    2    HA   ALA  37           HA       ALA  37  -4.721  11.720  17.284
    3    HB3  ALA  37           HB1      ALA  37  -2.754  13.465  18.703
    4    HB2  ALA  37           HB2      ALA  37  -3.282  13.507  17.022
    5    HB1  ALA  37           HB3      ALA  37  -2.113  12.294  17.550

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LYS  38           H        LYS  38  -2.966  11.450  20.366
    2    HA   LYS  38           HA       LYS  38  -1.606   9.067  19.889
    3    HB2  LYS  38           HB2      LYS  38  -1.958  10.833  22.027
    4    HB3  LYS  38           HB3      LYS  38  -2.557   9.298  22.648
    5    HG2  LYS  38           HG2      LYS  38  -0.446   8.204  22.120
    6    HG3  LYS  38           HG3      LYS  38   0.144   9.655  21.302
    7    HD2  LYS  38           HD2      LYS  38   0.292  10.883  23.333
    8    HD3  LYS  38           HD3      LYS  38  -0.712   9.722  24.202
    9    HE2  LYS  38           HE2      LYS  38   1.646   9.441  24.827
   10    HE3  LYS  38           HE3      LYS  38   1.063   8.013  23.967
   11    HZ3  LYS  38           HZ1      LYS  38   2.361   8.443  22.187
   12    HZ2  LYS  38           HZ2      LYS  38   3.302   9.289  23.322
   13    HZ1  LYS  38           HZ3      LYS  38   2.213  10.130  22.325

  No H/Q in entry =          13
  In of MODEL   61
    1    H    ALA  39           H        ALA  39  -4.854   9.523  21.284
    2    HA   ALA  39           HA       ALA  39  -5.378   6.798  21.798
    3    HB3  ALA  39           HB1      ALA  39  -7.562   8.710  21.019
    4    HB2  ALA  39           HB2      ALA  39  -6.670   8.955  22.521
    5    HB1  ALA  39           HB3      ALA  39  -7.565   7.457  22.261

  No H/Q in entry =           5
  In of MODEL   61
    1    H    MET  40           H        MET  40  -5.985   8.792  18.942
    2    HA   MET  40           HA       MET  40  -7.431   6.834  17.486
    3    HB2  MET  40           HB2      MET  40  -5.853   9.248  16.575
    4    HB3  MET  40           HB3      MET  40  -6.864   8.270  15.507
    5    HG2  MET  40           HG2      MET  40  -7.920   9.514  18.058
    6    HG3  MET  40           HG3      MET  40  -7.986  10.342  16.505
    7    HE3  MET  40           HE1      MET  40 -10.543   8.679  14.442
    8    HE2  MET  40           HE2      MET  40  -8.792   8.820  14.296
    9    HE1  MET  40           HE3      MET  40  -9.730  10.175  14.923

  No H/Q in entry =           9
  In of MODEL   61
    1    H    MET  41           H        MET  41  -3.951   7.621  17.613
    2    HA   MET  41           HA       MET  41  -3.164   5.869  15.521
    3    HB2  MET  41           HB2      MET  41  -1.562   6.568  17.994
    4    HB3  MET  41           HB3      MET  41  -0.932   5.923  16.482
    5    HG2  MET  41           HG2      MET  41  -2.118   8.085  15.468
    6    HG3  MET  41           HG3      MET  41  -1.893   8.682  17.110
    7    HE2  MET  41           HE1      MET  41   1.054   6.627  17.486
    8    HE1  MET  41           HE2      MET  41   0.245   7.913  18.377
    9    HE3  MET  41           HE3      MET  41   1.866   8.177  17.737

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ASP  42           H        ASP  42  -3.549   5.403  19.008
    2    HA   ASP  42           HA       ASP  42  -2.476   2.825  19.180
    3    HB2  ASP  42           HB2      ASP  42  -3.379   4.579  20.994
    4    HB3  ASP  42           HB3      ASP  42  -4.791   3.533  20.923

  No H/Q in entry =           4
  In of MODEL   61
    1    H    GLN  43           H        GLN  43  -5.824   3.879  18.669
    2    HA   GLN  43           HA       GLN  43  -6.930   1.274  18.482
    3    HB2  GLN  43           HB2      GLN  43  -7.889   3.909  17.341
    4    HB3  GLN  43           HB3      GLN  43  -8.830   2.416  17.322
    5    HG2  GLN  43           HG2      GLN  43  -8.540   2.308  19.831
    6    HG3  GLN  43           HG3      GLN  43  -7.839   3.923  19.755
    7   HE21  GLN  43          HE21      GLN  43 -10.023   3.977  21.250
    8   HE22  GLN  43          HE22      GLN  43 -11.390   4.530  20.414

  No H/Q in entry =           8
  In of MODEL   61
    1    H    SER  44           H        SER  44  -5.617   3.499  16.064
    2    HA   SER  44           HA       SER  44  -6.291   1.996  13.779
    3    HB2  SER  44           HB2      SER  44  -5.071   4.399  14.216
    4    HB3  SER  44           HB3      SER  44  -3.701   3.421  13.693
    5    HG   SER  44           HG       SER  44  -4.824   4.370  11.924

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ARG  45           H        ARG  45  -3.417   1.932  15.866
    2    HA   ARG  45           HA       ARG  45  -1.905  -0.005  14.494
    3    HB2  ARG  45           HB2      ARG  45  -1.088   1.435  16.359
    4    HB3  ARG  45           HB3      ARG  45  -2.069   0.494  17.481
    5    HG2  ARG  45           HG2      ARG  45  -0.806  -1.549  16.849
    6    HG3  ARG  45           HG3      ARG  45   0.198  -0.583  15.769
    7    HD2  ARG  45           HD2      ARG  45   0.908   0.816  17.721
    8    HD3  ARG  45           HD3      ARG  45  -0.001  -0.268  18.797
    9    HE   ARG  45           HE       ARG  45   1.725  -1.845  17.226
   10   HH21  ARG  45          HH11      ARG  45   3.635  -2.637  18.071
   11   HH22  ARG  45          HH12      ARG  45   4.394  -1.835  19.400
   12   HH11  ARG  45          HH21      ARG  45   1.987   0.635  19.607
   13   HH12  ARG  45          HH22      ARG  45   3.460   0.020  20.268

  No H/Q in entry =          13
  In of MODEL   61
    1    H    MET  46           H        MET  46  -4.304  -0.351  17.090
    2    HA   MET  46           HA       MET  46  -4.096  -3.146  17.408
    3    HB2  MET  46           HB2      MET  46  -6.358  -1.219  17.959
    4    HB3  MET  46           HB3      MET  46  -6.422  -2.926  18.399
    5    HG2  MET  46           HG2      MET  46  -4.061  -2.395  19.481
    6    HG3  MET  46           HG3      MET  46  -4.681  -0.752  19.502
    7    HE2  MET  46           HE1      MET  46  -8.012  -2.472  19.781
    8    HE1  MET  46           HE2      MET  46  -7.430  -0.814  19.672
    9    HE3  MET  46           HE3      MET  46  -8.194  -1.375  21.156

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ALA  47           H        ALA  47  -6.140  -1.166  15.301
    2    HA   ALA  47           HA       ALA  47  -7.726  -3.243  14.239
    3    HB3  ALA  47           HB1      ALA  47  -8.437  -1.017  13.814
    4    HB1  ALA  47           HB2      ALA  47  -7.935  -1.649  12.246
    5    HB2  ALA  47           HB3      ALA  47  -6.872  -0.562  13.141

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LEU  48           H        LEU  48  -4.624  -1.895  13.191
    2    HA   LEU  48           HA       LEU  48  -4.315  -3.490  10.856
    3    HB2  LEU  48           HB2      LEU  48  -2.280  -2.177  12.665
    4    HB3  LEU  48           HB3      LEU  48  -1.898  -2.898  11.101
    5    HG   LEU  48           HG       LEU  48  -3.951  -0.707  11.478
    6   HD13  LEU  48          HD11      LEU  48  -1.843   0.200  12.146
    7   HD12  LEU  48          HD12      LEU  48  -2.122   0.744  10.491
    8   HD11  LEU  48          HD13      LEU  48  -1.007  -0.586  10.807
    9   HD22  LEU  48          HD21      LEU  48  -4.405  -1.705   9.405
   10   HD21  LEU  48          HD22      LEU  48  -2.715  -2.118   9.115
   11   HD23  LEU  48          HD23      LEU  48  -3.256  -0.447   8.948

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ASN  49           H        ASN  49  -3.273  -3.861  14.206
    2    HA   ASN  49           HA       ASN  49  -1.640  -6.104  13.888
    3    HB2  ASN  49           HB2      ASN  49  -1.713  -4.741  15.930
    4    HB3  ASN  49           HB3      ASN  49  -3.347  -5.297  16.260
    5   HD21  ASN  49          HD21      ASN  49  -2.668  -6.279  18.284
    6   HD22  ASN  49          HD22      ASN  49  -1.754  -7.708  18.305

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLU  50           H        GLU  50  -5.113  -5.871  14.550
    2    HA   GLU  50           HA       GLU  50  -5.591  -8.676  14.667
    3    HB2  GLU  50           HB2      GLU  50  -7.200  -7.006  15.533
    4    HB3  GLU  50           HB3      GLU  50  -7.496  -6.451  13.884
    5    HG2  GLU  50           HG2      GLU  50  -8.332  -8.660  13.251
    6    HG3  GLU  50           HG3      GLU  50  -7.947  -9.293  14.848

  No H/Q in entry =           6
  In of MODEL   61
    1    H    ALA  51           H        ALA  51  -5.682  -6.288  12.063
    2    HA   ALA  51           HA       ALA  51  -6.641  -8.035  10.044
    3    HB2  ALA  51           HB1      ALA  51  -6.439  -6.224   8.669
    4    HB1  ALA  51           HB2      ALA  51  -4.806  -5.854   9.220
    5    HB3  ALA  51           HB3      ALA  51  -6.198  -5.356  10.184

  No H/Q in entry =           5
  In of MODEL   61
    1    H    HIS  52           H        HIS  52  -3.364  -7.085  11.033
    2    HA   HIS  52           HA       HIS  52  -1.942  -8.564   9.092
    3    HB2  HIS  52           HB2      HIS  52  -0.931  -6.814  10.526
    4    HB3  HIS  52           HB3      HIS  52  -1.095  -7.883  11.918
    5    HD1  HIS  52           HD1      HIS  52   0.245 -10.223  11.736
    6    HD2  HIS  52           HD2      HIS  52   1.348  -7.280   8.997
    7    HE1  HIS  52           HE1      HIS  52   2.494 -10.920  10.803
    8    HE2  HIS  52           HE2      HIS  52   3.180  -9.135   9.132

  No H/Q in entry =           8
  In of MODEL   61
    1    H    LEU  53           H        LEU  53  -3.152  -9.445  12.305
    2    HA   LEU  53           HA       LEU  53  -1.926 -11.974  12.510
    3    HB2  LEU  53           HB2      LEU  53  -4.424 -10.813  13.716
    4    HB3  LEU  53           HB3      LEU  53  -3.955 -12.485  14.010
    5    HG   LEU  53           HG       LEU  53  -2.060 -10.163  14.484
    6   HD12  LEU  53          HD11      LEU  53  -2.670 -10.445  16.902
    7   HD11  LEU  53          HD12      LEU  53  -3.989 -11.500  16.400
    8   HD13  LEU  53          HD13      LEU  53  -3.985  -9.807  15.921
    9   HD21  LEU  53          HD21      LEU  53  -2.111 -13.092  15.240
   10   HD23  LEU  53          HD22      LEU  53  -1.170 -11.933  16.173
   11   HD22  LEU  53          HD23      LEU  53  -0.805 -12.192  14.477

  No H/Q in entry =          11
  In of MODEL   61
    1    H    VAL  54           H        VAL  54  -5.045 -10.984  11.136
    2    HA   VAL  54           HA       VAL  54  -5.928 -13.591  10.456
    3    HB   VAL  54           HB       VAL  54  -6.602 -10.869   9.310
    4   HG12  VAL  54          HG11      VAL  54  -8.686 -12.273   8.497
    5   HG11  VAL  54          HG12      VAL  54  -7.560 -13.626   8.577
    6   HG13  VAL  54          HG13      VAL  54  -7.212 -12.251   7.531
    7   HG22  VAL  54          HG21      VAL  54  -7.514 -10.910  11.459
    8   HG21  VAL  54          HG22      VAL  54  -7.749 -12.656  11.445
    9   HG23  VAL  54          HG23      VAL  54  -8.839 -11.614  10.532

  No H/Q in entry =           9
  In of MODEL   61
    1    H    GLN  55           H        GLN  55  -4.078 -11.125   8.663
    2    HA   GLN  55           HA       GLN  55  -3.926 -12.596   6.251
    3    HB2  GLN  55           HB2      GLN  55  -3.346 -10.326   6.055
    4    HB3  GLN  55           HB3      GLN  55  -2.238 -10.386   7.423
    5    HG2  GLN  55           HG2      GLN  55  -0.508 -11.218   6.154
    6    HG3  GLN  55           HG3      GLN  55  -1.569 -12.208   5.161
    7   HE21  GLN  55          HE21      GLN  55  -1.587 -11.525   3.037
    8   HE22  GLN  55          HE22      GLN  55  -1.405  -9.920   2.522

  No H/Q in entry =           8
  In of MODEL   61
    1    H    THR  56           H        THR  56  -1.828 -12.543   9.137
    2    HA   THR  56           HA       THR  56   0.269 -14.123   8.231
    3    HB   THR  56           HB       THR  56  -1.036 -14.149  10.965
    4    HG1  THR  56           HG1      THR  56  -0.020 -12.181   9.924
    5   HG23  THR  56          HG21      THR  56   0.336 -16.135  10.682
    6   HG22  THR  56          HG22      THR  56   1.199 -14.990  11.710
    7   HG21  THR  56          HG23      THR  56   1.652 -15.171  10.014

  No H/Q in entry =           7
  In of MODEL   61
    1    H    LYS  57           H        LYS  57  -2.843 -15.187   9.589
    2    HA   LYS  57           HA       LYS  57  -2.368 -17.979   9.354
    3    HB2  LYS  57           HB2      LYS  57  -4.241 -16.692  10.613
    4    HB3  LYS  57           HB3      LYS  57  -5.062 -16.646   9.059
    5    HG2  LYS  57           HG2      LYS  57  -4.037 -19.280  10.028
    6    HG3  LYS  57           HG3      LYS  57  -5.488 -18.626  10.784
    7    HD2  LYS  57           HD2      LYS  57  -6.550 -18.417   8.558
    8    HD3  LYS  57           HD3      LYS  57  -5.104 -19.088   7.805
    9    HE2  LYS  57           HE2      LYS  57  -5.406 -21.179   9.106
   10    HE3  LYS  57           HE3      LYS  57  -6.867 -20.520   9.837
   11    HZ2  LYS  57           HZ1      LYS  57  -6.391 -21.274   7.025
   12    HZ1  LYS  57           HZ2      LYS  57  -7.632 -20.192   7.443
   13    HZ3  LYS  57           HZ3      LYS  57  -7.635 -21.772   8.066

  No H/Q in entry =          13
  In of MODEL   61
    1    H    LEU  58           H        LEU  58  -3.718 -15.558   7.166
    2    HA   LEU  58           HA       LEU  58  -4.496 -17.398   5.164
    3    HB2  LEU  58           HB2      LEU  58  -3.919 -14.444   5.020
    4    HB3  LEU  58           HB3      LEU  58  -4.570 -15.392   3.682
    5    HG   LEU  58           HG       LEU  58  -5.859 -15.216   6.425
    6   HD11  LEU  58          HD11      LEU  58  -6.169 -13.581   3.927
    7   HD13  LEU  58          HD12      LEU  58  -6.169 -13.067   5.614
    8   HD12  LEU  58          HD13      LEU  58  -7.581 -13.877   4.941
    9   HD22  LEU  58          HD21      LEU  58  -6.800 -17.138   5.560
   10   HD21  LEU  58          HD22      LEU  58  -6.460 -16.688   3.888
   11   HD23  LEU  58          HD23      LEU  58  -7.833 -15.973   4.733

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  59           H        ILE  59  -1.376 -16.153   6.030
    2    HA   ILE  59           HA       ILE  59  -0.263 -16.878   3.399
    3    HB   ILE  59           HB       ILE  59   0.480 -14.798   4.957
    4   HG12  ILE  59          HG12      ILE  59   2.593 -16.445   3.549
    5   HG13  ILE  59          HG13      ILE  59   1.399 -15.513   2.683
    6   HG23  ILE  59          HG21      ILE  59   2.307 -15.253   6.374
    7   HG22  ILE  59          HG22      ILE  59   2.592 -16.830   5.674
    8   HG21  ILE  59          HG23      ILE  59   1.212 -16.566   6.740
    9   HD12  ILE  59          HD11      ILE  59   3.565 -14.292   3.057
   10   HD11  ILE  59          HD12      ILE  59   3.213 -14.332   4.783
   11   HD13  ILE  59          HD13      ILE  59   2.151 -13.449   3.685

  No H/Q in entry =          11
  In of MODEL   61
    1    H    GLU  60           H        GLU  60  -0.273 -17.972   6.770
    2    HA   GLU  60           HA       GLU  60   1.779 -19.931   6.519
    3    HB2  GLU  60           HB2      GLU  60   0.996 -19.143   8.703
    4    HB3  GLU  60           HB3      GLU  60  -0.598 -19.830   8.396
    5    HG2  GLU  60           HG2      GLU  60   0.402 -22.089   8.265
    6    HG3  GLU  60           HG3      GLU  60   1.994 -21.398   8.576

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLY  61           H        GLY  61  -1.729 -20.066   6.023
    2    HA3  GLY  61           HA2      GLY  61  -1.450 -22.859   5.075
    3    HA2  GLY  61           HA3      GLY  61  -2.945 -22.136   5.662

  No H/Q in entry =           3
  In of MODEL   61
    1    H    ASP  62           H        ASP  62  -0.724 -20.543   3.460
    2    HA   ASP  62           HA       ASP  62  -2.776 -19.919   1.603
    3    HB2  ASP  62           HB2      ASP  62  -0.903 -19.032   0.240
    4    HB3  ASP  62           HB3      ASP  62  -0.840 -18.478   1.910

  No H/Q in entry =           4
  In of MODEL   61
    1    H    ALA  63           H        ALA  63  -0.385 -22.533   1.711
    2    HA   ALA  63           HA       ALA  63  -0.507 -23.397  -0.968
    3    HB2  ALA  63           HB1      ALA  63   0.146 -25.615  -0.069
    4    HB1  ALA  63           HB2      ALA  63  -0.120 -24.995   1.560
    5    HB3  ALA  63           HB3      ALA  63   1.144 -24.295   0.547

  No H/Q in entry =           5
  In of MODEL   61
    1    H    GLY  64           H        GLY  64  -2.739 -23.680   1.682
    2    HA3  GLY  64           HA2      GLY  64  -4.903 -24.434   1.808
    3    HA2  GLY  64           HA3      GLY  64  -4.923 -24.456   0.052

  No H/Q in entry =           3
  In of MODEL   61
    1    H    GLU  65           H        GLU  65  -5.450 -26.416  -0.728
    2    HA   GLU  65           HA       GLU  65  -5.760 -28.727   0.663
    3    HB2  GLU  65           HB2      GLU  65  -4.930 -28.401  -2.218
    4    HB3  GLU  65           HB3      GLU  65  -5.432 -29.938  -1.514
    5    HG2  GLU  65           HG2      GLU  65  -7.600 -28.998  -0.905
    6    HG3  GLU  65           HG3      GLU  65  -7.104 -27.412  -1.489

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLY  66           H        GLY  66  -3.037 -28.429  -1.534
    2    HA3  GLY  66           HA2      GLY  66  -1.014 -29.121   0.326
    3    HA2  GLY  66           HA3      GLY  66  -1.485 -30.525  -0.612

  No H/Q in entry =           3
  In of MODEL   61
    1    H    LYS  67           H        LYS  67  -1.890 -27.743  -2.407
    2    HA   LYS  67           HA       LYS  67   0.411 -28.379  -4.056
    3    HB2  LYS  67           HB2      LYS  67  -0.673 -26.984  -5.730
    4    HB3  LYS  67           HB3      LYS  67  -1.830 -28.131  -5.042
    5    HG2  LYS  67           HG2      LYS  67  -2.584 -26.372  -3.449
    6    HG3  LYS  67           HG3      LYS  67  -1.490 -25.229  -4.224
    7    HD2  LYS  67           HD2      LYS  67  -2.694 -25.488  -6.349
    8    HD3  LYS  67           HD3      LYS  67  -3.768 -26.676  -5.607
    9    HE2  LYS  67           HE2      LYS  67  -4.850 -24.473  -5.624
   10    HE3  LYS  67           HE3      LYS  67  -4.504 -24.963  -3.966
   11    HZ3  LYS  67           HZ1      LYS  67  -3.861 -22.679  -4.331
   12    HZ2  LYS  67           HZ2      LYS  67  -2.857 -23.132  -5.625
   13    HZ1  LYS  67           HZ3      LYS  67  -2.485 -23.626  -4.043

  No H/Q in entry =          13
  In of MODEL   61
    1    H    MET  68           H        MET  68   1.804 -26.858  -4.961
    2    HA   MET  68           HA       MET  68   3.103 -25.184  -3.114
    3    HB2  MET  68           HB2      MET  68   3.352 -25.355  -6.119
    4    HB3  MET  68           HB3      MET  68   4.488 -24.521  -5.057
    5    HG2  MET  68           HG2      MET  68   3.774 -27.461  -4.858
    6    HG3  MET  68           HG3      MET  68   5.240 -26.830  -5.611
    7    HE3  MET  68           HE1      MET  68   7.428 -25.506  -3.030
    8    HE2  MET  68           HE2      MET  68   6.175 -24.367  -3.519
    9    HE1  MET  68           HE3      MET  68   6.842 -25.492  -4.700

  No H/Q in entry =           9
  In of MODEL   61
    1    H    LYS  69           H        LYS  69   0.895 -24.375  -5.784
    2    HA   LYS  69           HA       LYS  69   1.300 -21.616  -5.789
    3    HB2  LYS  69           HB2      LYS  69   0.146 -22.814  -7.580
    4    HB3  LYS  69           HB3      LYS  69  -1.248 -23.042  -6.518
    5    HG2  LYS  69           HG2      LYS  69  -1.499 -20.622  -6.275
    6    HG3  LYS  69           HG3      LYS  69  -0.066 -20.353  -7.267
    7    HD2  LYS  69           HD2      LYS  69  -1.181 -21.444  -9.179
    8    HD3  LYS  69           HD3      LYS  69  -2.618 -21.706  -8.187
    9    HE2  LYS  69           HE2      LYS  69  -3.112 -19.713  -9.353
   10    HE3  LYS  69           HE3      LYS  69  -2.551 -19.148  -7.780
   11    HZ2  LYS  69           HZ1      LYS  69  -1.581 -18.168  -9.982
   12    HZ1  LYS  69           HZ2      LYS  69  -0.579 -19.539  -9.910
   13    HZ3  LYS  69           HZ3      LYS  69  -0.585 -18.419  -8.632

  No H/Q in entry =          13
  In of MODEL   61
    1    H    VAL  70           H        VAL  70   0.204 -19.830  -4.987
    2    HA   VAL  70           HA       VAL  70  -1.349 -20.305  -2.504
    3    HB   VAL  70           HB       VAL  70  -0.530 -18.070  -1.797
    4   HG12  VAL  70          HG11      VAL  70   1.696 -19.942  -2.653
    5   HG11  VAL  70          HG12      VAL  70   0.721 -20.127  -1.194
    6   HG13  VAL  70          HG13      VAL  70   1.790 -18.735  -1.369
    7   HG22  VAL  70          HG21      VAL  70  -0.212 -17.029  -4.000
    8   HG21  VAL  70          HG22      VAL  70   1.037 -18.207  -4.400
    9   HG23  VAL  70          HG23      VAL  70   1.326 -17.015  -3.134

  No H/Q in entry =           9
  In of MODEL   61
    1    H    SER  71           H        SER  71  -2.958 -18.657  -2.011
    2    HA   SER  71           HA       SER  71  -4.769 -18.173  -4.137
    3    HB2  SER  71           HB2      SER  71  -5.449 -18.340  -1.734
    4    HB3  SER  71           HB3      SER  71  -4.634 -16.811  -1.420
    5    HG   SER  71           HG       SER  71  -6.809 -17.282  -3.189

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LEU  72           H        LEU  72  -5.013 -16.502  -5.463
    2    HA   LEU  72           HA       LEU  72  -2.923 -14.669  -5.946
    3    HB2  LEU  72           HB2      LEU  72  -5.786 -14.756  -6.897
    4    HB3  LEU  72           HB3      LEU  72  -4.599 -13.589  -7.475
    5    HG   LEU  72           HG       LEU  72  -4.161 -16.591  -7.594
    6   HD13  LEU  72          HD11      LEU  72  -4.857 -16.516  -9.901
    7   HD12  LEU  72          HD12      LEU  72  -5.029 -14.761  -9.847
    8   HD11  LEU  72          HD13      LEU  72  -6.146 -15.785  -8.944
    9   HD23  LEU  72          HD21      LEU  72  -2.605 -15.709  -9.512
   10   HD22  LEU  72          HD22      LEU  72  -2.043 -15.563  -7.855
   11   HD21  LEU  72          HD23      LEU  72  -2.729 -14.164  -8.677

  No H/Q in entry =          11
  In of MODEL   61
    1    H    VAL  73           H        VAL  73  -6.023 -14.341  -4.323
    2    HA   VAL  73           HA       VAL  73  -6.100 -11.570  -3.980
    3    HB   VAL  73           HB       VAL  73  -7.814 -11.943  -2.397
    4   HG11  VAL  73          HG11      VAL  73  -8.135 -12.793  -4.798
    5   HG13  VAL  73          HG12      VAL  73  -9.255 -13.412  -3.585
    6   HG12  VAL  73          HG13      VAL  73  -7.910 -14.412  -4.136
    7   HG21  VAL  73          HG21      VAL  73  -6.341 -14.516  -1.937
    8   HG23  VAL  73          HG22      VAL  73  -8.070 -14.450  -1.601
    9   HG22  VAL  73          HG23      VAL  73  -6.966 -13.365  -0.757

  No H/Q in entry =           9
  In of MODEL   61
    1    H    LEU  74           H        LEU  74  -4.139 -13.911  -2.386
    2    HA   LEU  74           HA       LEU  74  -3.745 -12.759   0.134
    3    HB2  LEU  74           HB2      LEU  74  -2.937 -14.971  -0.362
    4    HB3  LEU  74           HB3      LEU  74  -1.883 -14.347  -1.630
    5    HG   LEU  74           HG       LEU  74  -0.608 -13.072   0.067
    6   HD13  LEU  74          HD11      LEU  74  -2.160 -12.618   1.796
    7   HD12  LEU  74          HD12      LEU  74  -1.097 -13.838   2.500
    8   HD11  LEU  74          HD13      LEU  74  -2.684 -14.300   1.882
    9   HD23  LEU  74          HD21      LEU  74  -0.765 -15.835   1.150
   10   HD22  LEU  74          HD22      LEU  74   0.621 -14.885   0.664
   11   HD21  LEU  74          HD23      LEU  74  -0.374 -15.642  -0.558

  No H/Q in entry =          11
  In of MODEL   61
    1    H    VAL  75           H        VAL  75  -1.853 -12.353  -2.821
    2    HA   VAL  75           HA       VAL  75  -0.079 -10.406  -1.813
    3    HB   VAL  75           HB       VAL  75  -1.025 -10.903  -4.638
    4   HG12  VAL  75          HG11      VAL  75   1.039  -9.585  -5.249
    5   HG11  VAL  75          HG12      VAL  75   1.223  -9.171  -3.551
    6   HG13  VAL  75          HG13      VAL  75  -0.182  -8.608  -4.441
    7   HG23  VAL  75          HG21      VAL  75   1.251 -11.962  -4.785
    8   HG22  VAL  75          HG22      VAL  75   0.174 -12.787  -3.658
    9   HG21  VAL  75          HG23      VAL  75   1.436 -11.714  -3.048

  No H/Q in entry =           9
  In of MODEL   61
    1    H    GLU  76           H        GLU  76  -3.230 -10.098  -3.477
    2    HA   GLU  76           HA       GLU  76  -3.313  -7.285  -3.586
    3    HB2  GLU  76           HB2      GLU  76  -4.952  -8.757  -4.744
    4    HB3  GLU  76           HB3      GLU  76  -5.610  -9.238  -3.187
    5    HG2  GLU  76           HG2      GLU  76  -7.068  -7.545  -4.099
    6    HG3  GLU  76           HG3      GLU  76  -6.201  -6.811  -2.764

  No H/Q in entry =           6
  In of MODEL   61
    1    H    ALA  77           H        ALA  77  -4.403  -9.518  -1.042
    2    HA   ALA  77           HA       ALA  77  -5.385  -7.522   0.710
    3    HB2  ALA  77           HB1      ALA  77  -5.925  -9.914   0.962
    4    HB3  ALA  77           HB2      ALA  77  -5.249  -9.249   2.447
    5    HB1  ALA  77           HB3      ALA  77  -4.248 -10.245   1.393

  No H/Q in entry =           5
  In of MODEL   61
    1    H    GLN  78           H        GLN  78  -2.220  -9.038   0.355
    2    HA   GLN  78           HA       GLN  78  -0.979  -7.858   2.604
    3    HB2  GLN  78           HB2      GLN  78  -0.096  -9.793   1.252
    4    HB3  GLN  78           HB3      GLN  78   0.334  -8.643  -0.012
    5    HG2  GLN  78           HG2      GLN  78   1.774  -7.433   1.579
    6    HG3  GLN  78           HG3      GLN  78   1.350  -8.585   2.843
    7   HE21  GLN  78          HE21      GLN  78   4.072  -8.256   1.980
    8   HE22  GLN  78          HE22      GLN  78   4.554  -9.686   1.202

  No H/Q in entry =           8
  In of MODEL   61
    1    H    LEU  79           H        LEU  79  -1.351  -6.810  -0.747
    2    HA   LEU  79           HA       LEU  79   0.312  -4.565  -0.737
    3    HB2  LEU  79           HB2      LEU  79  -0.703  -5.389  -2.790
    4    HB3  LEU  79           HB3      LEU  79  -2.312  -5.011  -2.185
    5    HG   LEU  79           HG       LEU  79  -1.792  -2.619  -2.165
    6   HD13  LEU  79          HD11      LEU  79   0.445  -2.351  -1.650
    7   HD12  LEU  79          HD12      LEU  79   0.494  -2.068  -3.390
    8   HD11  LEU  79          HD13      LEU  79   0.963  -3.639  -2.738
    9   HD23  LEU  79          HD21      LEU  79  -1.156  -2.421  -4.717
   10   HD22  LEU  79          HD22      LEU  79  -2.675  -3.183  -4.258
   11   HD21  LEU  79          HD23      LEU  79  -1.292  -4.179  -4.698

  No H/Q in entry =          11
  In of MODEL   61
    1    H    HIS  80           H        HIS  80  -3.154  -4.760   0.084
    2    HA   HIS  80           HA       HIS  80  -3.374  -2.004   0.740
    3    HB2  HIS  80           HB2      HIS  80  -5.052  -4.429   1.062
    4    HB3  HIS  80           HB3      HIS  80  -5.388  -3.089   2.162
    5    HD1  HIS  80           HD1      HIS  80  -7.020  -1.471   1.247
    6    HD2  HIS  80           HD2      HIS  80  -4.804  -3.270  -1.792
    7    HE1  HIS  80           HE1      HIS  80  -7.866  -0.488  -0.936
    8    HE2  HIS  80           HE2      HIS  80  -6.522  -1.579  -2.798

  No H/Q in entry =           8
  In of MODEL   61
    1    H    LEU  81           H        LEU  81  -2.861  -4.889   2.742
    2    HA   LEU  81           HA       LEU  81  -2.865  -3.535   5.222
    3    HB2  LEU  81           HB2      LEU  81  -1.620  -6.142   4.352
    4    HB3  LEU  81           HB3      LEU  81  -1.602  -5.578   6.024
    5    HG   LEU  81           HG       LEU  81  -4.143  -5.859   4.393
    6   HD12  LEU  81          HD11      LEU  81  -4.428  -7.923   5.945
    7   HD11  LEU  81          HD12      LEU  81  -2.677  -7.835   6.134
    8   HD13  LEU  81          HD13      LEU  81  -3.381  -8.077   4.535
    9   HD23  LEU  81          HD21      LEU  81  -4.988  -6.063   6.893
   10   HD22  LEU  81          HD22      LEU  81  -4.677  -4.473   6.199
   11   HD21  LEU  81          HD23      LEU  81  -3.485  -5.220   7.263

  No H/Q in entry =          11
  In of MODEL   61
    1    H    MET  82           H        MET  82  -0.172  -4.419   3.058
    2    HA   MET  82           HA       MET  82   1.900  -3.501   4.743
    3    HB2  MET  82           HB2      MET  82   1.693  -3.852   1.751
    4    HB3  MET  82           HB3      MET  82   3.168  -3.266   2.515
    5    HG2  MET  82           HG2      MET  82   1.784  -5.866   3.245
    6    HG3  MET  82           HG3      MET  82   3.156  -5.747   2.147
    7    HE3  MET  82           HE1      MET  82   6.162  -4.978   4.133
    8    HE2  MET  82           HE2      MET  82   5.227  -3.621   3.510
    9    HE1  MET  82           HE3      MET  82   5.331  -5.113   2.578

  No H/Q in entry =           9
  In of MODEL   61
    1    H    THR  83           H        THR  83   0.067  -1.882   2.179
    2    HA   THR  83           HA       THR  83   1.457   0.579   2.260
    3    HB   THR  83           HB       THR  83  -0.726   1.481   1.268
    4    HG1  THR  83           HG1      THR  83  -2.365   0.169   1.162
    5   HG22  THR  83          HG21      THR  83  -0.437  -0.340  -0.727
    6   HG21  THR  83          HG22      THR  83   1.065  -0.616   0.153
    7   HG23  THR  83          HG23      THR  83   0.691   0.992  -0.467

  No H/Q in entry =           7
  In of MODEL   61
    1    H    SER  84           H        SER  84  -1.543  -0.476   3.860
    2    HA   SER  84           HA       SER  84  -2.062   1.954   5.197
    3    HB2  SER  84           HB2      SER  84  -2.871  -0.890   5.768
    4    HB3  SER  84           HB3      SER  84  -3.378   0.450   6.796
    5    HG   SER  84           HG       SER  84  -3.829   0.124   4.004

  No H/Q in entry =           5
  In of MODEL   61
    1    H    MET  85           H        MET  85  -0.329  -0.960   6.337
    2    HA   MET  85           HA       MET  85   0.179  -0.022   8.940
    3    HB2  MET  85           HB2      MET  85   0.493  -2.365   8.268
    4    HB3  MET  85           HB3      MET  85   1.873  -1.892   7.276
    5    HG2  MET  85           HG2      MET  85   3.033  -1.041   9.277
    6    HG3  MET  85           HG3      MET  85   1.647  -1.479  10.273
    7    HE3  MET  85           HE1      MET  85   4.715  -4.229   8.276
    8    HE2  MET  85           HE2      MET  85   5.029  -2.621   8.924
    9    HE1  MET  85           HE3      MET  85   3.974  -2.810   7.528

  No H/Q in entry =           9
  In of MODEL   61
    1    H    LEU  86           H        LEU  86   2.116   0.242   5.991
    2    HA   LEU  86           HA       LEU  86   4.317   1.575   7.145
    3    HB2  LEU  86           HB2      LEU  86   4.138   0.484   4.840
    4    HB3  LEU  86           HB3      LEU  86   3.319   1.957   4.322
    5    HG   LEU  86           HG       LEU  86   5.335   3.223   5.301
    6   HD11  LEU  86          HD11      LEU  86   6.061   0.620   6.110
    7   HD13  LEU  86          HD12      LEU  86   7.052   2.073   6.204
    8   HD12  LEU  86          HD13      LEU  86   7.172   1.022   4.796
    9   HD23  LEU  86          HD21      LEU  86   6.070   1.459   2.957
   10   HD22  LEU  86          HD22      LEU  86   6.449   3.160   3.214
   11   HD21  LEU  86          HD23      LEU  86   4.801   2.677   2.815

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ALA  87           H        ALA  87   1.397   2.789   5.553
    2    HA   ALA  87           HA       ALA  87   1.968   5.524   5.629
    3    HB1  ALA  87           HB1      ALA  87  -0.326   3.876   5.090
    4    HB3  ALA  87           HB2      ALA  87  -0.029   5.537   4.585
    5    HB2  ALA  87           HB3      ALA  87  -0.822   5.214   6.128

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ARG  88           H        ARG  88   0.292   3.516   8.023
    2    HA   ARG  88           HA       ARG  88  -0.240   5.567   9.863
    3    HB2  ARG  88           HB2      ARG  88  -1.159   3.207   9.935
    4    HB3  ARG  88           HB3      ARG  88   0.385   2.722  10.645
    5    HG2  ARG  88           HG2      ARG  88  -0.111   4.797  12.258
    6    HG3  ARG  88           HG3      ARG  88  -1.774   4.457  11.800
    7    HD2  ARG  88           HD2      ARG  88  -1.868   2.611  13.052
    8    HD3  ARG  88           HD3      ARG  88  -0.273   2.040  12.525
    9    HE   ARG  88           HE       ARG  88  -0.821   3.307  14.975
   10   HH21  ARG  88          HH11      ARG  88   0.727   4.336  16.212
   11   HH22  ARG  88          HH12      ARG  88   2.244   4.773  15.508
   12   HH11  ARG  88          HH21      ARG  88   1.462   3.499  12.400
   13   HH12  ARG  88          HH22      ARG  88   2.668   4.284  13.362

  No H/Q in entry =          13
  In of MODEL   61
    1    H    GLU  89           H        GLU  89   2.576   3.371   9.651
    2    HA   GLU  89           HA       GLU  89   3.826   4.278  11.993
    3    HB2  GLU  89           HB2      GLU  89   4.504   2.261  10.657
    4    HB3  GLU  89           HB3      GLU  89   5.272   3.358   9.508
    5    HG2  GLU  89           HG2      GLU  89   6.747   4.223  11.251
    6    HG3  GLU  89           HG3      GLU  89   5.919   3.264  12.473

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LEU  90           H        LEU  90   4.138   5.428   8.662
    2    HA   LEU  90           HA       LEU  90   6.050   7.447   9.244
    3    HB2  LEU  90           HB2      LEU  90   4.050   7.091   7.015
    4    HB3  LEU  90           HB3      LEU  90   5.269   8.372   7.034
    5    HG   LEU  90           HG       LEU  90   5.969   5.443   7.378
    6   HD12  LEU  90          HD11      LEU  90   6.719   5.675   4.939
    7   HD11  LEU  90          HD12      LEU  90   5.690   7.106   4.884
    8   HD13  LEU  90          HD13      LEU  90   4.984   5.528   5.231
    9   HD22  LEU  90          HD21      LEU  90   7.854   6.612   8.059
   10   HD21  LEU  90          HD22      LEU  90   7.493   8.010   7.047
   11   HD23  LEU  90          HD23      LEU  90   8.167   6.549   6.326

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  91           H        ILE  91   2.511   7.430   9.090
    2    HA   ILE  91           HA       ILE  91   2.142  10.200   9.531
    3    HB   ILE  91           HB       ILE  91   0.373   7.810  10.079
    4   HG12  ILE  91          HG12      ILE  91   0.106  10.082   8.086
    5   HG13  ILE  91          HG13      ILE  91   0.981   8.595   7.720
    6   HG22  ILE  91          HG21      ILE  91  -1.379   9.852  10.133
    7   HG21  ILE  91          HG22      ILE  91   0.013  10.698  10.805
    8   HG23  ILE  91          HG23      ILE  91  -0.611   9.257  11.605
    9   HD13  ILE  91          HD11      ILE  91  -0.951   7.289   7.766
   10   HD12  ILE  91          HD12      ILE  91  -1.554   8.797   7.078
   11   HD11  ILE  91          HD13      ILE  91  -1.824   8.436   8.783

  No H/Q in entry =          11
  In of MODEL   61
    1    H    THR  92           H        THR  92   2.568   7.470  11.742
    2    HA   THR  92           HA       THR  92   2.108   8.848  14.160
    3    HB   THR  92           HB       THR  92   3.940   6.528  13.506
    4    HG1  THR  92           HG1      THR  92   1.979   5.752  13.405
    5   HG22  THR  92          HG21      THR  92   3.555   6.249  16.141
    6   HG21  THR  92          HG22      THR  92   3.473   8.008  16.061
    7   HG23  THR  92          HG23      THR  92   4.915   7.164  15.494

  No H/Q in entry =           7
  In of MODEL   61
    1    H    GLU  93           H        GLU  93   5.066   8.422  12.233
    2    HA   GLU  93           HA       GLU  93   6.802   9.872  13.928
    3    HB2  GLU  93           HB2      GLU  93   6.899   9.548  10.914
    4    HB3  GLU  93           HB3      GLU  93   8.233  10.095  11.929
    5    HG2  GLU  93           HG2      GLU  93   6.849   7.446  12.384
    6    HG3  GLU  93           HG3      GLU  93   8.233   7.608  11.309

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LEU  94           H        LEU  94   4.748  10.856  11.209
    2    HA   LEU  94           HA       LEU  94   5.525  13.568  11.100
    3    HB2  LEU  94           HB2      LEU  94   2.951  12.173  10.346
    4    HB3  LEU  94           HB3      LEU  94   3.192  13.902  10.099
    5    HG   LEU  94           HG       LEU  94   5.232  11.932   9.060
    6   HD11  LEU  94          HD11      LEU  94   2.486  12.450   7.990
    7   HD13  LEU  94          HD12      LEU  94   3.485  11.004   7.872
    8   HD12  LEU  94          HD13      LEU  94   3.807  12.384   6.823
    9   HD23  LEU  94          HD21      LEU  94   5.465  13.765   7.331
   10   HD22  LEU  94          HD22      LEU  94   5.872  14.268   8.972
   11   HD21  LEU  94          HD23      LEU  94   4.317  14.717   8.269

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  95           H        ILE  95   3.002  11.931  12.992
    2    HA   ILE  95           HA       ILE  95   1.931  14.273  14.177
    3    HB   ILE  95           HB       ILE  95   1.978  11.395  15.112
    4   HG12  ILE  95          HG12      ILE  95  -0.260  13.141  14.052
    5   HG13  ILE  95          HG13      ILE  95   0.710  12.088  13.026
    6   HG21  ILE  95          HG21      ILE  95   0.666  13.858  16.302
    7   HG23  ILE  95          HG22      ILE  95   1.726  12.704  17.113
    8   HG22  ILE  95          HG23      ILE  95   0.097  12.223  16.637
    9   HD13  ILE  95          HD11      ILE  95  -0.173  10.143  13.950
   10   HD12  ILE  95          HD12      ILE  95  -1.568  11.217  14.020
   11   HD11  ILE  95          HD13      ILE  95  -0.602  10.935  15.468

  No H/Q in entry =          11
  In of MODEL   61
    1    H    GLU  96           H        GLU  96   4.549  12.087  15.186
    2    HA   GLU  96           HA       GLU  96   5.085  13.301  17.674
    3    HB2  GLU  96           HB2      GLU  96   6.059  11.151  17.036
    4    HB3  GLU  96           HB3      GLU  96   6.986  11.930  15.755
    5    HG2  GLU  96           HG2      GLU  96   8.625  12.503  17.219
    6    HG3  GLU  96           HG3      GLU  96   7.467  13.306  18.269

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LEU  97           H        LEU  97   6.157  14.073  14.387
    2    HA   LEU  97           HA       LEU  97   8.019  16.094  15.096
    3    HB2  LEU  97           HB2      LEU  97   6.439  15.517  12.600
    4    HB3  LEU  97           HB3      LEU  97   7.441  16.961  12.718
    5    HG   LEU  97           HG       LEU  97   8.502  14.178  13.290
    6   HD12  LEU  97          HD11      LEU  97   9.501  14.375  10.974
    7   HD11  LEU  97          HD12      LEU  97   8.434  15.752  10.704
    8   HD13  LEU  97          HD13      LEU  97   7.753  14.153  11.003
    9   HD23  LEU  97          HD21      LEU  97  10.657  15.480  12.547
   10   HD22  LEU  97          HD22      LEU  97  10.032  15.748  14.174
   11   HD21  LEU  97          HD23      LEU  97   9.706  16.922  12.901

  No H/Q in entry =          11
  In of MODEL   61
    1    H    HIS  98           H        HIS  98   4.527  16.186  14.434
    2    HA   HIS  98           HA       HIS  98   4.194  18.982  14.558
    3    HB2  HIS  98           HB2      HIS  98   2.330  16.711  15.289
    4    HB3  HIS  98           HB3      HIS  98   1.842  18.406  15.337
    5    HD1  HIS  98           HD1      HIS  98   2.901  15.695  12.944
    6    HD2  HIS  98           HD2      HIS  98   1.478  19.611  12.805
    7    HE1  HIS  98           HE1      HIS  98   2.341  16.168  10.517
    8    HE2  HIS  98           HE2      HIS  98   1.478  18.547  10.411

  No H/Q in entry =           8
  In of MODEL   61
    1    H    GLU  99           H        GLU  99   4.352  16.504  17.067
    2    HA   GLU  99           HA       GLU  99   3.719  18.199  19.257
    3    HB2  GLU  99           HB2      GLU  99   3.660  15.717  19.363
    4    HB3  GLU  99           HB3      GLU  99   5.421  15.693  19.259
    5    HG2  GLU  99           HG2      GLU  99   5.589  16.994  21.328
    6    HG3  GLU  99           HG3      GLU  99   3.835  17.114  21.420

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LYS 100           H        LYS 100   6.787  17.300  17.702
    2    HA   LYS 100           HA       LYS 100   8.421  18.727  19.557
    3    HB2  LYS 100           HB2      LYS 100   8.937  17.799  16.722
    4    HB3  LYS 100           HB3      LYS 100  10.155  18.587  17.730
    5    HG2  LYS 100           HG2      LYS 100   9.797  16.838  19.477
    6    HG3  LYS 100           HG3      LYS 100   8.677  16.017  18.386
    7    HD2  LYS 100           HD2      LYS 100  10.478  15.750  16.724
    8    HD3  LYS 100           HD3      LYS 100  11.602  16.583  17.799
    9    HE2  LYS 100           HE2      LYS 100  11.224  14.829  19.523
   10    HE3  LYS 100           HE3      LYS 100  10.161  13.976  18.399
   11    HZ1  LYS 100           HZ1      LYS 100  12.975  14.678  17.747
   12    HZ3  LYS 100           HZ2      LYS 100  11.946  13.607  16.920
   13    HZ2  LYS 100           HZ3      LYS 100  12.536  13.201  18.461

  No H/Q in entry =          13
  In of MODEL   61
    1    H    LEU 101           H        LEU 101   6.722  19.623  16.595
    2    HA   LEU 101           HA       LEU 101   7.906  22.193  16.253
    3    HB2  LEU 101           HB2      LEU 101   5.328  20.925  15.365
    4    HB3  LEU 101           HB3      LEU 101   5.558  22.658  15.152
    5    HG   LEU 101           HG       LEU 101   7.620  20.663  14.198
    6   HD12  LEU 101          HD11      LEU 101   6.466  21.147  11.909
    7   HD11  LEU 101          HD12      LEU 101   5.059  21.564  12.885
    8   HD13  LEU 101          HD13      LEU 101   5.743  19.942  12.974
    9   HD21  LEU 101          HD21      LEU 101   6.959  23.566  13.630
   10   HD23  LEU 101          HD22      LEU 101   7.953  22.614  12.529
   11   HD22  LEU 101          HD23      LEU 101   8.488  22.884  14.187

  No H/Q in entry =          11
  In of MODEL   61
    1    H    LYS 102           H        LYS 102   6.378  21.046  18.869
    2    HA   LYS 102           HA       LYS 102   5.728  22.137  20.796
    3    HB2  LYS 102           HB2      LYS 102   6.990  24.138  19.668
    4    HB3  LYS 102           HB3      LYS 102   5.384  24.723  19.287
    5    HG2  LYS 102           HG2      LYS 102   6.759  24.493  21.942
    6    HG3  LYS 102           HG3      LYS 102   5.792  25.808  21.307
    7    HD2  LYS 102           HD2      LYS 102   4.578  23.160  22.192
    8    HD3  LYS 102           HD3      LYS 102   4.808  24.527  23.271
    9    HE2  LYS 102           HE2      LYS 102   2.536  24.092  21.780
   10    HE3  LYS 102           HE3      LYS 102   3.020  25.646  22.457
   11    HZ2  LYS 102           HZ1      LYS 102   2.493  25.740  20.076
   12    HZ1  LYS 102           HZ2      LYS 102   3.768  24.672  19.759
   13    HZ3  LYS 102           HZ3      LYS 102   4.091  26.208  20.397

  No H/Q in entry =          13
  In of MODEL   61
    1    H    ALA 103           H        ALA 103   4.078  23.651  18.021
    2    HA   ALA 103           HA       ALA 103   1.615  24.201  18.899
    3    HB1  ALA 103           HB1      ALA 103   0.731  23.342  16.658
    4    HB2  ALA 103           HB2      ALA 103   2.385  22.823  16.333
    5    HB3  ALA 103           HB3      ALA 103   2.030  24.532  16.593

  No H/Q in entry =           5
  In of MODEL   61
    1    H1   ALA   1           H3       ALA   1  10.783 -20.282  -6.205
    2    H2   ALA   1           H2       ALA   1   9.824 -20.503  -7.592
    3    H3   ALA   1           H1       ALA   1   9.392 -21.249  -6.127
    4    HA   ALA   1           HA       ALA   1  10.453 -23.049  -6.858
    5    HB1  ALA   1           HB1      ALA   1  10.549 -22.697  -9.135
    6    HB2  ALA   1           HB2      ALA   1  12.274 -22.526  -8.804
    7    HB3  ALA   1           HB3      ALA   1  11.260 -21.091  -8.961

  No H/Q in entry =           7
  In of MODEL   61
    1    H    GLU   2           H        GLU   2  12.747 -23.975  -6.909
    2    HA   GLU   2           HA       GLU   2  14.124 -23.870  -4.695
    3    HB2  GLU   2           HB2      GLU   2  15.483 -23.733  -7.393
    4    HB3  GLU   2           HB3      GLU   2  16.215 -24.331  -5.904
    5    HG2  GLU   2           HG2      GLU   2  15.221 -26.360  -6.140
    6    HG3  GLU   2           HG3      GLU   2  13.642 -25.632  -6.404

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLU   3           H        GLU   3  15.879 -21.995  -7.100
    2    HA   GLU   3           HA       GLU   3  17.010 -20.288  -5.144
    3    HB2  GLU   3           HB2      GLU   3  16.959 -20.297  -8.154
    4    HB3  GLU   3           HB3      GLU   3  17.689 -18.957  -7.270
    5    HG2  GLU   3           HG2      GLU   3  19.365 -20.310  -6.340
    6    HG3  GLU   3           HG3      GLU   3  18.435 -21.788  -6.558

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LEU   4           H        LEU   4  14.723 -19.474  -7.782
    2    HA   LEU   4           HA       LEU   4  14.228 -16.869  -7.180
    3    HB2  LEU   4           HB2      LEU   4  12.075 -18.869  -7.907
    4    HB3  LEU   4           HB3      LEU   4  11.982 -17.121  -8.111
    5    HG   LEU   4           HG       LEU   4  13.968 -18.968  -9.475
    6   HD13  LEU   4          HD11      LEU   4  12.668 -18.840 -11.388
    7   HD12  LEU   4          HD12      LEU   4  11.943 -17.301 -10.927
    8   HD11  LEU   4          HD13      LEU   4  11.404 -18.795 -10.161
    9   HD23  LEU   4          HD21      LEU   4  14.283 -16.724 -10.834
   10   HD22  LEU   4          HD22      LEU   4  15.143 -16.952  -9.312
   11   HD21  LEU   4          HD23      LEU   4  13.680 -15.971  -9.357

  No H/Q in entry =          11
  In of MODEL   61
    1    H    GLU   5           H        GLU   5  12.770 -19.663  -5.531
    2    HA   GLU   5           HA       GLU   5  11.074 -18.104  -3.836
    3    HB2  GLU   5           HB2      GLU   5  10.657 -20.478  -4.339
    4    HB3  GLU   5           HB3      GLU   5  12.111 -20.910  -3.437
    5    HG2  GLU   5           HG2      GLU   5  11.177 -19.911  -1.404
    6    HG3  GLU   5           HG3      GLU   5   9.739 -19.414  -2.294

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLU   6           H        GLU   6  14.236 -19.648  -3.383
    2    HA   GLU   6           HA       GLU   6  14.575 -18.779  -0.687
    3    HB2  GLU   6           HB2      GLU   6  16.370 -19.912  -2.806
    4    HB3  GLU   6           HB3      GLU   6  17.078 -19.221  -1.345
    5    HG2  GLU   6           HG2      GLU   6  16.731 -21.585  -0.963
    6    HG3  GLU   6           HG3      GLU   6  15.557 -20.697   0.007

  No H/Q in entry =           6
  In of MODEL   61
    1    H    VAL   7           H        VAL   7  15.331 -17.454  -3.840
    2    HA   VAL   7           HA       VAL   7  16.992 -15.306  -2.980
    3    HB   VAL   7           HB       VAL   7  15.294 -15.697  -5.458
    4   HG11  VAL   7          HG11      VAL   7  17.162 -13.460  -4.651
    5   HG13  VAL   7          HG12      VAL   7  15.519 -13.338  -5.277
    6   HG12  VAL   7          HG13      VAL   7  16.835 -13.829  -6.343
    7   HG21  VAL   7          HG21      VAL   7  17.417 -17.128  -4.881
    8   HG23  VAL   7          HG22      VAL   7  18.306 -15.658  -5.283
    9   HG22  VAL   7          HG23      VAL   7  17.280 -16.424  -6.493

  No H/Q in entry =           9
  In of MODEL   61
    1    H    VAL   8           H        VAL   8  13.504 -15.617  -3.541
    2    HA   VAL   8           HA       VAL   8  12.807 -12.915  -3.079
    3    HB   VAL   8           HB       VAL   8  11.230 -15.466  -2.653
    4   HG11  VAL   8          HG11      VAL   8  10.524 -12.567  -2.295
    5   HG13  VAL   8          HG12      VAL   8  10.060 -13.956  -1.312
    6   HG12  VAL   8          HG13      VAL   8   9.295 -13.689  -2.877
    7   HG23  VAL   8          HG21      VAL   8  10.521 -13.546  -4.813
    8   HG22  VAL   8          HG22      VAL   8  10.623 -15.304  -4.861
    9   HG21  VAL   8          HG23      VAL   8  12.085 -14.336  -5.019

  No H/Q in entry =           9
  In of MODEL   61
    1    H    MET   9           H        MET   9  13.102 -15.710  -0.890
    2    HA   MET   9           HA       MET   9  12.268 -14.440   1.475
    3    HB2  MET   9           HB2      MET   9  14.157 -16.717   0.914
    4    HB3  MET   9           HB3      MET   9  13.947 -16.109   2.557
    5    HG2  MET   9           HG2      MET   9  11.412 -16.363   2.127
    6    HG3  MET   9           HG3      MET   9  11.881 -17.350   0.741
    7    HE3  MET   9           HE1      MET   9  13.471 -20.441   2.035
    8    HE2  MET   9           HE2      MET   9  14.394 -19.024   1.543
    9    HE1  MET   9           HE3      MET   9  12.909 -19.437   0.691

  No H/Q in entry =           9
  In of MODEL   61
    1    H    GLY  10           H        GLY  10  15.454 -14.632  -0.075
    2    HA3  GLY  10           HA2      GLY  10  16.893 -13.187   1.892
    3    HA2  GLY  10           HA3      GLY  10  17.361 -13.353   0.200

  No H/Q in entry =           3
  In of MODEL   61
    1    H    LEU  11           H        LEU  11  15.180 -12.162  -1.047
    2    HA   LEU  11           HA       LEU  11  15.831  -9.409  -0.892
    3    HB2  LEU  11           HB2      LEU  11  13.483 -10.851  -2.126
    4    HB3  LEU  11           HB3      LEU  11  13.742  -9.114  -2.291
    5    HG   LEU  11           HG       LEU  11  15.797 -11.200  -3.069
    6   HD13  LEU  11          HD11      LEU  11  14.058 -11.594  -4.590
    7   HD12  LEU  11          HD12      LEU  11  15.048 -10.403  -5.433
    8   HD11  LEU  11          HD13      LEU  11  13.567  -9.900  -4.619
    9   HD22  LEU  11          HD21      LEU  11  17.004  -9.221  -2.847
   10   HD21  LEU  11          HD22      LEU  11  15.617  -8.203  -3.232
   11   HD23  LEU  11          HD23      LEU  11  16.461  -9.065  -4.517

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  12           H        ILE  12  13.083 -11.265   0.377
    2    HA   ILE  12           HA       ILE  12  11.660  -9.055   1.427
    3    HB   ILE  12           HB       ILE  12  11.732 -11.934   2.386
    4   HG12  ILE  12          HG12      ILE  12  11.043 -11.324  -0.065
    5   HG13  ILE  12          HG13      ILE  12  10.022 -12.415   0.851
    6   HG22  ILE  12          HG21      ILE  12   9.441 -11.374   3.293
    7   HG21  ILE  12          HG22      ILE  12   9.774  -9.679   2.942
    8   HG23  ILE  12          HG23      ILE  12  10.765 -10.548   4.114
    9   HD13  ILE  12          HD11      ILE  12   8.482 -10.609   1.340
   10   HD12  ILE  12          HD12      ILE  12   8.773 -10.639  -0.398
   11   HD11  ILE  12          HD13      ILE  12   9.563  -9.440   0.602

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  13           H        ILE  13  14.079 -11.224   2.844
    2    HA   ILE  13           HA       ILE  13  14.095 -10.035   5.420
    3    HB   ILE  13           HB       ILE  13  16.174 -11.588   3.862
    4   HG12  ILE  13          HG12      ILE  13  13.912 -12.578   4.714
    5   HG13  ILE  13          HG13      ILE  13  15.399 -13.481   4.986
    6   HG23  ILE  13          HG21      ILE  13  17.486 -10.350   5.404
    7   HG22  ILE  13          HG22      ILE  13  17.244 -11.907   6.185
    8   HG21  ILE  13          HG23      ILE  13  16.291 -10.511   6.691
    9   HD11  ILE  13          HD11      ILE  13  14.215 -11.588   7.047
   10   HD13  ILE  13          HD12      ILE  13  15.521 -12.746   7.273
   11   HD12  ILE  13          HD13      ILE  13  13.880 -13.318   7.005

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ASN  14           H        ASN  14  16.046  -9.488   2.504
    2    HA   ASN  14           HA       ASN  14  17.761  -7.518   3.562
    3    HB2  ASN  14           HB2      ASN  14  17.761  -8.793   1.250
    4    HB3  ASN  14           HB3      ASN  14  16.849  -7.390   0.707
    5   HD21  ASN  14          HD21      ASN  14  19.296  -7.699  -0.473
    6   HD22  ASN  14          HD22      ASN  14  20.422  -6.597   0.152

  No H/Q in entry =           6
  In of MODEL   61
    1    H    SER  15           H        SER  15  14.649  -7.221   1.862
    2    HA   SER  15           HA       SER  15  14.496  -4.403   1.909
    3    HB2  SER  15           HB2      SER  15  12.169  -4.685   1.409
    4    HB3  SER  15           HB3      SER  15  12.986  -6.042   0.646
    5    HG   SER  15           HG       SER  15  11.023  -6.225   2.273

  No H/Q in entry =           5
  In of MODEL   61
    1    H    GLY  16           H        GLY  16  13.434  -6.871   4.219
    2    HA3  GLY  16           HA2      GLY  16  12.183  -5.134   6.068
    3    HA2  GLY  16           HA3      GLY  16  12.821  -6.732   6.437

  No H/Q in entry =           3
  In of MODEL   61
    1    H    GLN  17           H        GLN  17  15.528  -6.360   5.849
    2    HA   GLN  17           HA       GLN  17  16.462  -5.117   8.227
    3    HB2  GLN  17           HB2      GLN  17  17.710  -6.899   7.018
    4    HB3  GLN  17           HB3      GLN  17  18.030  -5.759   5.710
    5    HG2  GLN  17           HG2      GLN  17  19.952  -5.834   7.215
    6    HG3  GLN  17           HG3      GLN  17  19.170  -4.258   7.335
    7   HE21  GLN  17          HE21      GLN  17  19.590  -3.741   9.529
    8   HE22  GLN  17          HE22      GLN  17  19.086  -4.707  10.830

  No H/Q in entry =           8
  In of MODEL   61
    1    H    ALA  18           H        ALA  18  16.264  -4.054   4.863
    2    HA   ALA  18           HA       ALA  18  17.663  -1.638   5.084
    3    HB2  ALA  18           HB1      ALA  18  16.567  -2.877   3.019
    4    HB3  ALA  18           HB2      ALA  18  16.805  -1.130   2.998
    5    HB1  ALA  18           HB3      ALA  18  15.215  -1.799   3.366

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ARG  19           H        ARG  19  14.171  -2.279   5.476
    2    HA   ARG  19           HA       ARG  19  13.461   0.363   6.181
    3    HB2  ARG  19           HB2      ARG  19  11.808  -1.416   5.597
    4    HB3  ARG  19           HB3      ARG  19  12.159  -2.203   7.137
    5    HG2  ARG  19           HG2      ARG  19  11.415  -0.219   8.368
    6    HG3  ARG  19           HG3      ARG  19  11.155   0.648   6.856
    7    HD2  ARG  19           HD2      ARG  19   9.024  -0.178   7.674
    8    HD3  ARG  19           HD3      ARG  19   9.460  -1.056   6.202
    9    HE   ARG  19           HE       ARG  19  10.438  -2.577   8.314
   10   HH21  ARG  19          HH11      ARG  19   9.212  -4.232   9.256
   11   HH22  ARG  19          HH12      ARG  19   7.492  -4.232   9.082
   12   HH11  ARG  19          HH21      ARG  19   7.426  -1.334   7.209
   13   HH12  ARG  19          HH22      ARG  19   6.481  -2.591   7.918

  No H/Q in entry =          13
  In of MODEL   61
    1    H    SER  20           H        SER  20  14.358  -2.447   8.151
    2    HA   SER  20           HA       SER  20  14.052  -1.343  10.684
    3    HB2  SER  20           HB2      SER  20  14.555  -3.661  10.572
    4    HB3  SER  20           HB3      SER  20  16.004  -3.379   9.611
    5    HG   SER  20           HG       SER  20  16.721  -2.136  11.538

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LEU  21           H        LEU  21  16.899  -1.245   8.554
    2    HA   LEU  21           HA       LEU  21  18.547   0.272  10.291
    3    HB2  LEU  21           HB2      LEU  21  18.536  -0.010   7.278
    4    HB3  LEU  21           HB3      LEU  21  19.776   0.872   8.168
    5    HG   LEU  21           HG       LEU  21  19.078  -2.028   8.715
    6   HD11  LEU  21          HD11      LEU  21  21.215  -0.817   6.940
    7   HD13  LEU  21          HD12      LEU  21  19.922  -1.914   6.456
    8   HD12  LEU  21          HD13      LEU  21  21.231  -2.495   7.484
    9   HD22  LEU  21          HD21      LEU  21  20.227  -1.284  10.614
   10   HD21  LEU  21          HD22      LEU  21  21.177  -0.104   9.719
   11   HD23  LEU  21          HD23      LEU  21  21.576  -1.810   9.612

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ALA  22           H        ALA  22  16.274   1.198   7.727
    2    HA   ALA  22           HA       ALA  22  16.770   3.964   7.733
    3    HB3  ALA  22           HB1      ALA  22  15.390   2.695   6.055
    4    HB2  ALA  22           HB2      ALA  22  14.659   4.198   6.615
    5    HB1  ALA  22           HB3      ALA  22  14.091   2.652   7.247

  No H/Q in entry =           5
  In of MODEL   61
    1    H    TYR  23           H        TYR  23  14.297   2.116   9.568
    2    HA   TYR  23           HA       TYR  23  13.297   4.343  11.008
    3    HB2  TYR  23           HB2      TYR  23  12.095   2.210  10.990
    4    HB3  TYR  23           HB3      TYR  23  13.436   1.424  11.823
    5    HD1  TYR  23           HD1      TYR  23  10.881   4.121  12.167
    6    HD2  TYR  23           HD2      TYR  23  13.631   1.507  14.180
    7    HE1  TYR  23           HE1      TYR  23   9.935   4.810  14.355
    8    HE2  TYR  23           HE2      TYR  23  12.685   2.194  16.367
    9    HH   TYR  23           HH       TYR  23  10.069   4.614  16.557

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ALA  24           H        ALA  24  15.975   2.110  11.658
    2    HA   ALA  24           HA       ALA  24  16.624   3.124  14.220
    3    HB1  ALA  24           HB1      ALA  24  18.008   1.351  14.064
    4    HB3  ALA  24           HB2      ALA  24  19.024   2.284  12.965
    5    HB2  ALA  24           HB3      ALA  24  17.746   1.254  12.324

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ALA  25           H        ALA  25  17.575   4.056  10.940
    2    HA   ALA  25           HA       ALA  25  19.490   6.021  11.584
    3    HB1  ALA  25           HB1      ALA  25  18.793   5.055   9.270
    4    HB3  ALA  25           HB2      ALA  25  19.269   6.750   9.359
    5    HB2  ALA  25           HB3      ALA  25  17.561   6.318   9.287

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LEU  26           H        LEU  26  15.973   6.197  11.214
    2    HA   LEU  26           HA       LEU  26  15.707   8.977  11.655
    3    HB2  LEU  26           HB2      LEU  26  13.866   7.711  10.727
    4    HB3  LEU  26           HB3      LEU  26  13.787   6.687  12.155
    5    HG   LEU  26           HG       LEU  26  13.149   8.640  13.528
    6   HD12  LEU  26          HD11      LEU  26  12.461  10.727  12.194
    7   HD11  LEU  26          HD12      LEU  26  13.454  10.084  10.889
    8   HD13  LEU  26          HD13      LEU  26  14.190  10.485  12.442
    9   HD21  LEU  26          HD21      LEU  26  11.484   8.295  11.015
   10   HD23  LEU  26          HD22      LEU  26  10.910   8.990  12.528
   11   HD22  LEU  26          HD23      LEU  26  11.387   7.295  12.465

  No H/Q in entry =          11
  In of MODEL   61
    1    H    LYS  27           H        LYS  27  15.633   6.204  13.857
    2    HA   LYS  27           HA       LYS  27  15.016   7.569  16.219
    3    HB2  LYS  27           HB2      LYS  27  15.080   5.093  15.963
    4    HB3  LYS  27           HB3      LYS  27  16.842   5.170  15.923
    5    HG2  LYS  27           HG2      LYS  27  16.873   6.164  18.170
    6    HG3  LYS  27           HG3      LYS  27  15.106   6.158  18.211
    7    HD2  LYS  27           HD2      LYS  27  15.116   3.690  17.982
    8    HD3  LYS  27           HD3      LYS  27  16.880   3.704  17.975
    9    HE2  LYS  27           HE2      LYS  27  16.895   4.700  20.228
   10    HE3  LYS  27           HE3      LYS  27  15.129   4.716  20.239
   11    HZ3  LYS  27           HZ1      LYS  27  15.941   2.779  21.398
   12    HZ2  LYS  27           HZ2      LYS  27  16.867   2.308  20.050
   13    HZ1  LYS  27           HZ3      LYS  27  15.169   2.289  19.967

  No H/Q in entry =          13
  In of MODEL   61
    1    H    GLN  28           H        GLN  28  18.144   7.024  14.636
    2    HA   GLN  28           HA       GLN  28  19.808   8.137  16.627
    3    HB2  GLN  28           HB2      GLN  28  20.103   8.083  13.613
    4    HB3  GLN  28           HB3      GLN  28  21.380   8.580  14.723
    5    HG2  GLN  28           HG2      GLN  28  20.002   5.880  14.772
    6    HG3  GLN  28           HG3      GLN  28  21.584   6.190  14.058
    7   HE21  GLN  28          HE21      GLN  28  20.278   4.909  16.783
    8   HE22  GLN  28          HE22      GLN  28  21.470   5.336  17.913

  No H/Q in entry =           8
  In of MODEL   61
    1    H    ALA  29           H        ALA  29  18.043   9.587  13.926
    2    HA   ALA  29           HA       ALA  29  19.007  12.222  14.173
    3    HB2  ALA  29           HB1      ALA  29  17.304  12.832  12.696
    4    HB1  ALA  29           HB2      ALA  29  16.174  11.646  13.348
    5    HB3  ALA  29           HB3      ALA  29  17.513  11.117  12.330

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LYS  30           H        LYS  30  16.248  10.591  15.693
    2    HA   LYS  30           HA       LYS  30  15.202  12.836  17.040
    3    HB2  LYS  30           HB2      LYS  30  15.126   9.896  17.753
    4    HB3  LYS  30           HB3      LYS  30  14.242  11.138  18.641
    5    HG2  LYS  30           HG2      LYS  30  13.114  11.803  16.518
    6    HG3  LYS  30           HG3      LYS  30  13.937  10.475  15.697
    7    HD2  LYS  30           HD2      LYS  30  12.882   8.859  17.228
    8    HD3  LYS  30           HD3      LYS  30  12.069  10.177  18.073
    9    HE2  LYS  30           HE2      LYS  30  10.898  10.788  15.976
   10    HE3  LYS  30           HE3      LYS  30  11.691   9.441  15.151
   11    HZ2  LYS  30           HZ1      LYS  30   9.386   9.006  16.027
   12    HZ1  LYS  30           HZ2      LYS  30  10.049   9.073  17.596
   13    HZ3  LYS  30           HZ3      LYS  30  10.574   7.890  16.490

  No H/Q in entry =          13
  In of MODEL   61
    1    H    GLN  31           H        GLN  31  17.888  10.702  17.790
    2    HA   GLN  31           HA       GLN  31  18.197  11.729  20.482
    3    HB2  GLN  31           HB2      GLN  31  20.242  10.178  18.887
    4    HB3  GLN  31           HB3      GLN  31  20.103  10.306  20.641
    5    HG2  GLN  31           HG2      GLN  31  17.603   9.321  19.869
    6    HG3  GLN  31           HG3      GLN  31  18.717   8.486  18.794
    7   HE21  GLN  31          HE21      GLN  31  17.183   7.329  21.071
    8   HE22  GLN  31          HE22      GLN  31  18.345   6.685  22.126

  No H/Q in entry =           8
  In of MODEL   61
    1    H    GLY  32           H        GLY  32  18.706  13.043  17.513
    2    HA3  GLY  32           HA2      GLY  32  19.667  15.098  16.994
    3    HA2  GLY  32           HA3      GLY  32  20.421  15.117  18.584

  No H/Q in entry =           3
  In of MODEL   61
    1    H    ASP  33           H        ASP  33  20.882  12.225  16.817
    2    HA   ASP  33           HA       ASP  33  23.700  12.933  16.355
    3    HB2  ASP  33           HB2      ASP  33  22.223  10.299  16.476
    4    HB3  ASP  33           HB3      ASP  33  23.909  10.435  15.984

  No H/Q in entry =           4
  In of MODEL   61
    1    H    PHE  34           H        PHE  34  23.207  14.245  14.468
    2    HA   PHE  34           HA       PHE  34  21.875  13.237  12.181
    3    HB2  PHE  34           HB2      PHE  34  23.979  15.398  12.409
    4    HB3  PHE  34           HB3      PHE  34  23.000  15.091  10.976
    5    HD1  PHE  34           HD1      PHE  34  23.221  17.037  13.884
    6    HD2  PHE  34           HD2      PHE  34  20.375  14.878  11.499
    7    HE1  PHE  34           HE1      PHE  34  21.385  18.415  14.823
    8    HE2  PHE  34           HE2      PHE  34  18.543  16.256  12.440
    9    HZ   PHE  34           HZ       PHE  34  19.052  18.025  14.098

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ALA  35           H        ALA  35  25.249  13.094  13.197
    2    HA   ALA  35           HA       ALA  35  26.370  12.280  10.745
    3    HB3  ALA  35           HB1      ALA  35  28.061  11.137  12.472
    4    HB2  ALA  35           HB2      ALA  35  27.182  12.155  13.612
    5    HB1  ALA  35           HB3      ALA  35  28.013  12.884  12.239

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ALA  36           H        ALA  36  25.273  10.318  13.514
    2    HA   ALA  36           HA       ALA  36  25.792   7.833  12.247
    3    HB2  ALA  36           HB1      ALA  36  25.366   7.088  14.324
    4    HB3  ALA  36           HB2      ALA  36  23.672   7.560  14.169
    5    HB1  ALA  36           HB3      ALA  36  24.857   8.709  14.791

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ALA  37           H        ALA  37  22.943   9.923  12.368
    2    HA   ALA  37           HA       ALA  37  21.113   8.125  11.194
    3    HB3  ALA  37           HB1      ALA  37  21.299  11.092  11.477
    4    HB1  ALA  37           HB2      ALA  37  20.000   9.998  11.950
    5    HB2  ALA  37           HB3      ALA  37  20.186  10.467  10.260

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LYS  38           H        LYS  38  23.182  10.610   9.712
    2    HA   LYS  38           HA       LYS  38  22.555  10.165   7.034
    3    HB2  LYS  38           HB2      LYS  38  24.340  11.751   8.479
    4    HB3  LYS  38           HB3      LYS  38  25.389  10.772   7.458
    5    HG2  LYS  38           HG2      LYS  38  24.218  11.521   5.457
    6    HG3  LYS  38           HG3      LYS  38  23.010  12.362   6.433
    7    HD2  LYS  38           HD2      LYS  38  24.582  13.985   7.184
    8    HD3  LYS  38           HD3      LYS  38  25.956  13.016   6.654
    9    HE2  LYS  38           HE2      LYS  38  25.577  14.877   5.096
   10    HE3  LYS  38           HE3      LYS  38  25.265  13.332   4.296
   11    HZ3  LYS  38           HZ1      LYS  38  23.063  13.747   4.160
   12    HZ2  LYS  38           HZ2      LYS  38  23.563  15.369   4.243
   13    HZ1  LYS  38           HZ3      LYS  38  22.997  14.582   5.637

  No H/Q in entry =          13
  In of MODEL   61
    1    H    ALA  39           H        ALA  39  25.086   8.608   9.001
    2    HA   ALA  39           HA       ALA  39  26.182   7.028   6.939
    3    HB2  ALA  39           HB1      ALA  39  26.100   6.073   9.785
    4    HB1  ALA  39           HB2      ALA  39  27.034   7.510   9.367
    5    HB3  ALA  39           HB3      ALA  39  27.409   5.962   8.609

  No H/Q in entry =           5
  In of MODEL   61
    1    H    MET  40           H        MET  40  23.573   6.383   9.233
    2    HA   MET  40           HA       MET  40  23.169   3.670   8.506
    3    HB2  MET  40           HB2      MET  40  21.321   5.692   9.788
    4    HB3  MET  40           HB3      MET  40  20.939   3.976   9.618
    5    HG2  MET  40           HG2      MET  40  23.472   4.958  10.962
    6    HG3  MET  40           HG3      MET  40  21.980   4.664  11.852
    7    HE3  MET  40           HE1      MET  40  21.468   1.023  12.038
    8    HE2  MET  40           HE2      MET  40  20.582   2.311  11.225
    9    HE1  MET  40           HE3      MET  40  21.316   2.613  12.798

  No H/Q in entry =           9
  In of MODEL   61
    1    H    MET  41           H        MET  41  21.715   6.699   7.307
    2    HA   MET  41           HA       MET  41  19.779   5.471   5.634
    3    HB2  MET  41           HB2      MET  41  21.223   8.080   5.116
    4    HB3  MET  41           HB3      MET  41  19.704   7.563   4.396
    5    HG2  MET  41           HG2      MET  41  18.956   7.371   6.946
    6    HG3  MET  41           HG3      MET  41  20.247   8.548   7.167
    7    HE2  MET  41           HE1      MET  41  19.673   9.818   3.825
    8    HE1  MET  41           HE2      MET  41  20.620  10.275   5.238
    9    HE3  MET  41           HE3      MET  41  19.333  11.334   4.667

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ASP  42           H        ASP  42  23.138   6.441   5.085
    2    HA   ASP  42           HA       ASP  42  23.243   5.960   2.329
    3    HB2  ASP  42           HB2      ASP  42  24.976   6.988   4.099
    4    HB3  ASP  42           HB3      ASP  42  25.657   5.372   3.978

  No H/Q in entry =           4
  In of MODEL   61
    1    H    GLN  43           H        GLN  43  23.993   3.824   5.058
    2    HA   GLN  43           HA       GLN  43  24.694   1.571   3.484
    3    HB2  GLN  43           HB2      GLN  43  23.662   1.749   6.325
    4    HB3  GLN  43           HB3      GLN  43  24.264   0.266   5.576
    5    HG2  GLN  43           HG2      GLN  43  26.411   1.507   5.065
    6    HG3  GLN  43           HG3      GLN  43  25.807   2.828   6.060
    7   HE21  GLN  43          HE21      GLN  43  28.052   1.891   7.104
    8   HE22  GLN  43          HE22      GLN  43  27.790   0.808   8.383

  No H/Q in entry =           8
  In of MODEL   61
    1    H    SER  44           H        SER  44  21.618   2.665   4.859
    2    HA   SER  44           HA       SER  44  20.084   0.397   4.190
    3    HB2  SER  44           HB2      SER  44  19.603   2.922   5.327
    4    HB3  SER  44           HB3      SER  44  18.572   2.860   3.900
    5    HG   SER  44           HG       SER  44  17.489   1.906   5.623

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ARG  45           H        ARG  45  20.787   3.366   2.378
    2    HA   ARG  45           HA       ARG  45  19.274   2.851   0.071
    3    HB2  ARG  45           HB2      ARG  45  20.386   5.006   0.651
    4    HB3  ARG  45           HB3      ARG  45  21.942   4.272   0.271
    5    HG2  ARG  45           HG2      ARG  45  21.169   3.848  -2.044
    6    HG3  ARG  45           HG3      ARG  45  19.625   4.605  -1.662
    7    HD2  ARG  45           HD2      ARG  45  20.844   6.721  -1.082
    8    HD3  ARG  45           HD3      ARG  45  22.352   5.967  -1.645
    9    HE   ARG  45           HE       ARG  45  20.430   5.695  -3.684
   10   HH21  ARG  45          HH11      ARG  45  20.406   7.059  -5.452
   11   HH22  ARG  45          HH12      ARG  45  21.141   8.620  -5.351
   12   HH11  ARG  45          HH21      ARG  45  22.121   8.223  -2.062
   13   HH12  ARG  45          HH22      ARG  45  22.110   9.279  -3.429

  No H/Q in entry =          13
  In of MODEL   61
    1    H    MET  46           H        MET  46  22.649   2.027   0.828
    2    HA   MET  46           HA       MET  46  23.276   0.835  -1.651
    3    HB2  MET  46           HB2      MET  46  24.383   0.545   1.141
    4    HB3  MET  46           HB3      MET  46  25.049  -0.361  -0.221
    5    HG2  MET  46           HG2      MET  46  25.677   1.622  -1.374
    6    HG3  MET  46           HG3      MET  46  24.676   2.635  -0.342
    7    HE1  MET  46           HE1      MET  46  27.238  -0.199   0.002
    8    HE3  MET  46           HE2      MET  46  26.436  -0.219   1.571
    9    HE2  MET  46           HE3      MET  46  28.140   0.219   1.465

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ALA  47           H        ALA  47  21.907  -0.508   1.326
    2    HA   ALA  47           HA       ALA  47  21.892  -3.224   0.532
    3    HB2  ALA  47           HB1      ALA  47  21.503  -2.761   2.835
    4    HB3  ALA  47           HB2      ALA  47  19.975  -3.387   2.216
    5    HB1  ALA  47           HB3      ALA  47  20.181  -1.652   2.469

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LEU  48           H        LEU  48  19.504  -0.630   0.164
    2    HA   LEU  48           HA       LEU  48  17.482  -2.195  -1.085
    3    HB2  LEU  48           HB2      LEU  48  18.097   0.767  -1.209
    4    HB3  LEU  48           HB3      LEU  48  16.636   0.035  -1.875
    5    HG   LEU  48           HG       LEU  48  17.490  -0.246   1.016
    6   HD13  LEU  48          HD11      LEU  48  17.042   2.049   0.820
    7   HD12  LEU  48          HD12      LEU  48  15.491   1.382   1.330
    8   HD11  LEU  48          HD13      LEU  48  15.759   1.802  -0.362
    9   HD22  LEU  48          HD21      LEU  48  15.984  -1.981   0.639
   10   HD21  LEU  48          HD22      LEU  48  15.100  -1.095  -0.604
   11   HD23  LEU  48          HD23      LEU  48  14.880  -0.687   1.098

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ASN  49           H        ASN  49  20.146  -0.236  -2.319
    2    HA   ASN  49           HA       ASN  49  19.499  -0.337  -5.043
    3    HB2  ASN  49           HB2      ASN  49  21.163   1.198  -4.096
    4    HB3  ASN  49           HB3      ASN  49  22.216  -0.158  -3.707
    5   HD21  ASN  49          HD21      ASN  49  23.894   0.722  -5.114
    6   HD22  ASN  49          HD22      ASN  49  23.757   0.626  -6.802

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLU  50           H        GLU  50  21.510  -2.499  -3.071
    2    HA   GLU  50           HA       GLU  50  22.236  -4.253  -5.190
    3    HB2  GLU  50           HB2      GLU  50  23.431  -4.205  -3.023
    4    HB3  GLU  50           HB3      GLU  50  21.996  -4.848  -2.226
    5    HG2  GLU  50           HG2      GLU  50  22.113  -6.885  -3.577
    6    HG3  GLU  50           HG3      GLU  50  23.482  -6.238  -4.479

  No H/Q in entry =           6
  In of MODEL   61
    1    H    ALA  51           H        ALA  51  19.577  -4.214  -2.867
    2    HA   ALA  51           HA       ALA  51  18.444  -6.704  -3.616
    3    HB3  ALA  51           HB1      ALA  51  16.843  -6.213  -2.064
    4    HB1  ALA  51           HB2      ALA  51  16.609  -4.572  -2.669
    5    HB2  ALA  51           HB3      ALA  51  17.972  -4.937  -1.610

  No H/Q in entry =           5
  In of MODEL   61
    1    H    HIS  52           H        HIS  52  17.815  -3.368  -4.664
    2    HA   HIS  52           HA       HIS  52  15.711  -3.929  -6.463
    3    HB2  HIS  52           HB2      HIS  52  16.310  -1.653  -5.679
    4    HB3  HIS  52           HB3      HIS  52  17.787  -1.733  -6.639
    5    HD1  HIS  52           HD1      HIS  52  17.417  -2.045  -9.299
    6    HD2  HIS  52           HD2      HIS  52  14.058  -0.880  -7.122
    7    HE1  HIS  52           HE1      HIS  52  15.745  -1.156 -10.981
    8    HE2  HIS  52           HE2      HIS  52  13.692  -0.441  -9.669

  No H/Q in entry =           8
  In of MODEL   61
    1    H    LEU  53           H        LEU  53  19.229  -3.890  -6.893
    2    HA   LEU  53           HA       LEU  53  19.293  -4.216  -9.692
    3    HB2  LEU  53           HB2      LEU  53  21.234  -4.945  -7.513
    4    HB3  LEU  53           HB3      LEU  53  21.556  -5.332  -9.202
    5    HG   LEU  53           HG       LEU  53  20.840  -2.528  -8.290
    6   HD12  LEU  53          HD11      LEU  53  23.309  -2.087  -8.464
    7   HD11  LEU  53          HD12      LEU  53  23.562  -3.827  -8.592
    8   HD13  LEU  53          HD13      LEU  53  22.876  -3.143  -7.123
    9   HD21  LEU  53          HD21      LEU  53  21.975  -3.753 -10.814
   10   HD23  LEU  53          HD22      LEU  53  22.258  -2.059 -10.428
   11   HD22  LEU  53          HD23      LEU  53  20.620  -2.641 -10.664

  No H/Q in entry =          11
  In of MODEL   61
    1    H    VAL  54           H        VAL  54  19.210  -6.593  -7.057
    2    HA   VAL  54           HA       VAL  54  19.365  -8.893  -8.708
    3    HB   VAL  54           HB       VAL  54  18.203  -8.474  -5.943
    4   HG12  VAL  54          HG11      VAL  54  18.562 -11.087  -5.928
    5   HG11  VAL  54          HG12      VAL  54  18.376 -10.928  -7.674
    6   HG13  VAL  54          HG13      VAL  54  17.079 -10.410  -6.599
    7   HG22  VAL  54          HG21      VAL  54  20.515  -8.231  -5.719
    8   HG21  VAL  54          HG22      VAL  54  20.868  -9.323  -7.056
    9   HG23  VAL  54          HG23      VAL  54  20.346  -9.971  -5.501

  No H/Q in entry =           9
  In of MODEL   61
    1    H    GLN  55           H        GLN  55  16.610  -7.022  -7.435
    2    HA   GLN  55           HA       GLN  55  14.613  -8.718  -8.503
    3    HB2  GLN  55           HB2      GLN  55  13.842  -7.196  -6.883
    4    HB3  GLN  55           HB3      GLN  55  14.617  -5.820  -7.664
    5    HG2  GLN  55           HG2      GLN  55  12.890  -5.525  -9.157
    6    HG3  GLN  55           HG3      GLN  55  12.592  -7.251  -9.320
    7   HE21  GLN  55          HE21      GLN  55  10.592  -7.824  -8.514
    8   HE22  GLN  55          HE22      GLN  55   9.807  -7.075  -7.209

  No H/Q in entry =           8
  In of MODEL   61
    1    H    THR  56           H        THR  56  16.314  -5.899  -9.873
    2    HA   THR  56           HA       THR  56  14.873  -5.567 -12.224
    3    HB   THR  56           HB       THR  56  17.870  -5.362 -11.829
    4    HG1  THR  56           HG1      THR  56  16.249  -4.037 -10.601
    5   HG23  THR  56          HG21      THR  56  17.373  -5.511 -14.197
    6   HG22  THR  56          HG22      THR  56  17.729  -3.829 -13.807
    7   HG21  THR  56          HG23      THR  56  16.057  -4.348 -14.033

  No H/Q in entry =           7
  In of MODEL   61
    1    H    LYS  57           H        LYS  57  17.554  -7.824 -11.601
    2    HA   LYS  57           HA       LYS  57  17.574  -9.029 -14.174
    3    HB2  LYS  57           HB2      LYS  57  19.280  -9.203 -12.220
    4    HB3  LYS  57           HB3      LYS  57  18.219 -10.454 -11.588
    5    HG2  LYS  57           HG2      LYS  57  19.076 -10.650 -14.444
    6    HG3  LYS  57           HG3      LYS  57  20.249 -11.060 -13.198
    7    HD2  LYS  57           HD2      LYS  57  18.648 -12.683 -12.229
    8    HD3  LYS  57           HD3      LYS  57  17.491 -12.292 -13.501
    9    HE2  LYS  57           HE2      LYS  57  19.113 -13.053 -15.214
   10    HE3  LYS  57           HE3      LYS  57  20.267 -13.463 -13.946
   11    HZ2  LYS  57           HZ1      LYS  57  17.680 -14.730 -14.564
   12    HZ1  LYS  57           HZ2      LYS  57  18.374 -14.881 -13.022
   13    HZ3  LYS  57           HZ3      LYS  57  19.206 -15.450 -14.388

  No H/Q in entry =          13
  In of MODEL   61
    1    H    LEU  58           H        LEU  58  15.801  -9.709 -11.197
    2    HA   LEU  58           HA       LEU  58  14.614 -12.104 -12.122
    3    HB2  LEU  58           HB2      LEU  58  13.790 -10.201  -9.935
    4    HB3  LEU  58           HB3      LEU  58  13.006 -11.752 -10.245
    5    HG   LEU  58           HG       LEU  58  15.974 -11.429  -9.690
    6   HD11  LEU  58          HD11      LEU  58  13.608 -11.872  -7.897
    7   HD13  LEU  58          HD12      LEU  58  15.048 -10.887  -7.638
    8   HD12  LEU  58          HD13      LEU  58  15.145 -12.641  -7.495
    9   HD22  LEU  58          HD21      LEU  58  15.887 -13.496 -10.709
   10   HD21  LEU  58          HD22      LEU  58  14.176 -13.729 -10.349
   11   HD23  LEU  58          HD23      LEU  58  15.388 -14.007  -9.097

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  59           H        ILE  59  13.895  -8.780 -12.820
    2    HA   ILE  59           HA       ILE  59  11.190  -9.472 -13.758
    3    HB   ILE  59           HB       ILE  59  11.957  -7.175 -12.561
    4   HG12  ILE  59          HG12      ILE  59  10.061  -7.087 -14.919
    5   HG13  ILE  59          HG13      ILE  59   9.644  -7.854 -13.408
    6   HG23  ILE  59          HG21      ILE  59  12.516  -5.450 -14.071
    7   HG22  ILE  59          HG22      ILE  59  12.038  -6.381 -15.473
    8   HG21  ILE  59          HG23      ILE  59  13.520  -6.775 -14.607
    9   HD12  ILE  59          HD11      ILE  59   8.902  -5.444 -13.613
   10   HD11  ILE  59          HD12      ILE  59  10.609  -5.004 -13.566
   11   HD13  ILE  59          HD13      ILE  59   9.867  -5.808 -12.181

  No H/Q in entry =          11
  In of MODEL   61
    1    H    GLU  60           H        GLU  60  14.382  -8.579 -15.019
    2    HA   GLU  60           HA       GLU  60  13.598  -8.202 -17.729
    3    HB2  GLU  60           HB2      GLU  60  15.770  -7.443 -16.851
    4    HB3  GLU  60           HB3      GLU  60  16.256  -9.116 -16.593
    5    HG2  GLU  60           HG2      GLU  60  16.038  -9.553 -19.021
    6    HG3  GLU  60           HG3      GLU  60  15.573  -7.872 -19.275

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLY  61           H        GLY  61  14.616 -11.061 -15.901
    2    HA3  GLY  61           HA2      GLY  61  14.100 -12.727 -18.296
    3    HA2  GLY  61           HA3      GLY  61  15.138 -13.187 -16.951

  No H/Q in entry =           3
  In of MODEL   61
    1    H    ASP  62           H        ASP  62  11.995 -11.685 -16.589
    2    HA   ASP  62           HA       ASP  62  11.094 -13.663 -14.768
    3    HB2  ASP  62           HB2      ASP  62   8.961 -12.427 -14.867
    4    HB3  ASP  62           HB3      ASP  62  10.339 -11.354 -14.633

  No H/Q in entry =           4
  In of MODEL   61
    1    H    ALA  63           H        ALA  63  10.586 -13.242 -18.258
    2    HA   ALA  63           HA       ALA  63   8.374 -14.952 -18.623
    3    HB1  ALA  63           HB1      ALA  63   9.279 -15.250 -20.938
    4    HB2  ALA  63           HB2      ALA  63  10.740 -14.403 -20.434
    5    HB3  ALA  63           HB3      ALA  63   9.189 -13.561 -20.436

  No H/Q in entry =           5
  In of MODEL   61
    1    H    GLY  64           H        GLY  64  11.715 -15.598 -17.961
    2    HA3  GLY  64           HA2      GLY  64  12.845 -17.527 -17.445
    3    HA2  GLY  64           HA3      GLY  64  11.281 -18.313 -17.277

  No H/Q in entry =           3
  In of MODEL   61
    1    H    GLU  65           H        GLU  65  11.128 -20.061 -18.552
    2    HA   GLU  65           HA       GLU  65  12.839 -20.883 -20.485
    3    HB2  GLU  65           HB2      GLU  65   9.862 -21.338 -20.361
    4    HB3  GLU  65           HB3      GLU  65  10.940 -22.208 -21.451
    5    HG2  GLU  65           HG2      GLU  65  12.232 -23.055 -19.565
    6    HG3  GLU  65           HG3      GLU  65  11.259 -22.112 -18.439

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLY  66           H        GLY  66   9.690 -19.695 -21.471
    2    HA3  GLY  66           HA2      GLY  66  10.618 -17.747 -23.312
    3    HA2  GLY  66           HA3      GLY  66  10.193 -19.229 -24.146

  No H/Q in entry =           3
  In of MODEL   61
    1    H    LYS  67           H        LYS  67   8.326 -18.858 -21.406
    2    HA   LYS  67           HA       LYS  67   5.989 -18.205 -22.997
    3    HB2  LYS  67           HB2      LYS  67   4.724 -19.002 -21.072
    4    HB3  LYS  67           HB3      LYS  67   5.995 -20.155 -21.499
    5    HG2  LYS  67           HG2      LYS  67   7.471 -19.123 -19.780
    6    HG3  LYS  67           HG3      LYS  67   6.152 -18.051 -19.319
    7    HD2  LYS  67           HD2      LYS  67   4.776 -19.985 -18.687
    8    HD3  LYS  67           HD3      LYS  67   6.072 -21.078 -19.181
    9    HE2  LYS  67           HE2      LYS  67   6.152 -20.739 -16.753
   10    HE3  LYS  67           HE3      LYS  67   7.575 -20.023 -17.510
   11    HZ3  LYS  67           HZ1      LYS  67   6.619 -18.517 -15.902
   12    HZ2  LYS  67           HZ2      LYS  67   5.118 -18.572 -16.692
   13    HZ1  LYS  67           HZ3      LYS  67   6.461 -17.872 -17.462

  No H/Q in entry =          13
  In of MODEL   61
    1    H    MET  68           H        MET  68   4.368 -16.782 -22.374
    2    HA   MET  68           HA       MET  68   5.211 -14.158 -21.848
    3    HB2  MET  68           HB2      MET  68   2.445 -15.370 -21.810
    4    HB3  MET  68           HB3      MET  68   2.790 -13.641 -21.824
    5    HG2  MET  68           HG2      MET  68   3.711 -15.604 -23.942
    6    HG3  MET  68           HG3      MET  68   2.334 -14.516 -24.105
    7    HE3  MET  68           HE1      MET  68   3.524 -11.112 -24.427
    8    HE2  MET  68           HE2      MET  68   3.484 -11.634 -22.746
    9    HE1  MET  68           HE3      MET  68   2.286 -12.252 -23.880

  No H/Q in entry =           9
  In of MODEL   61
    1    H    LYS  69           H        LYS  69   3.620 -16.507 -19.672
    2    HA   LYS  69           HA       LYS  69   3.021 -14.727 -17.599
    3    HB2  LYS  69           HB2      LYS  69   2.064 -16.978 -17.797
    4    HB3  LYS  69           HB3      LYS  69   3.628 -17.676 -17.369
    5    HG2  LYS  69           HG2      LYS  69   3.587 -16.523 -15.209
    6    HG3  LYS  69           HG3      LYS  69   2.062 -15.745 -15.635
    7    HD2  LYS  69           HD2      LYS  69   0.974 -17.954 -15.782
    8    HD3  LYS  69           HD3      LYS  69   2.498 -18.733 -15.348
    9    HE2  LYS  69           HE2      LYS  69   1.348 -18.580 -13.290
   10    HE3  LYS  69           HE3      LYS  69   2.449 -17.204 -13.259
   11    HZ2  LYS  69           HZ1      LYS  69  -0.069 -16.904 -12.717
   12    HZ1  LYS  69           HZ2      LYS  69  -0.225 -16.847 -14.407
   13    HZ3  LYS  69           HZ3      LYS  69   0.764 -15.723 -13.603

  No H/Q in entry =          13
  In of MODEL   61
    1    H    VAL  70           H        VAL  70   3.925 -14.259 -15.562
    2    HA   VAL  70           HA       VAL  70   6.870 -14.585 -15.404
    3    HB   VAL  70           HB       VAL  70   6.822 -12.512 -14.040
    4   HG12  VAL  70          HG11      VAL  70   5.428 -12.244 -16.723
    5   HG11  VAL  70          HG12      VAL  70   7.169 -12.418 -16.499
    6   HG13  VAL  70          HG13      VAL  70   6.343 -10.979 -15.903
    7   HG22  VAL  70          HG21      VAL  70   4.559 -12.676 -13.114
    8   HG21  VAL  70          HG22      VAL  70   3.864 -12.568 -14.731
    9   HG23  VAL  70          HG23      VAL  70   4.685 -11.174 -14.030

  No H/Q in entry =           9
  In of MODEL   61
    1    H    SER  71           H        SER  71   7.747 -14.726 -13.215
    2    HA   SER  71           HA       SER  71   6.535 -16.736 -11.632
    3    HB2  SER  71           HB2      SER  71   8.975 -16.293 -11.660
    4    HB3  SER  71           HB3      SER  71   8.691 -14.755 -10.848
    5    HG   SER  71           HG       SER  71   8.070 -17.361  -9.898

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LEU  72           H        LEU  72   5.179 -16.631  -9.950
    2    HA   LEU  72           HA       LEU  72   3.595 -14.339  -9.516
    3    HB2  LEU  72           HB2      LEU  72   3.918 -16.886  -7.937
    4    HB3  LEU  72           HB3      LEU  72   2.732 -15.644  -7.542
    5    HG   LEU  72           HG       LEU  72   2.909 -16.940 -10.282
    6   HD13  LEU  72          HD11      LEU  72   1.143 -18.429  -9.618
    7   HD12  LEU  72          HD12      LEU  72   0.960 -17.614  -8.066
    8   HD11  LEU  72          HD13      LEU  72   2.408 -18.563  -8.396
    9   HD23  LEU  72          HD21      LEU  72   0.409 -16.170 -10.181
   10   HD22  LEU  72          HD22      LEU  72   1.633 -14.951 -10.503
   11   HD21  LEU  72          HD23      LEU  72   0.953 -15.109  -8.886

  No H/Q in entry =          11
  In of MODEL   61
    1    H    VAL  73           H        VAL  73   6.270 -15.731  -7.734
    2    HA   VAL  73           HA       VAL  73   6.184 -14.190  -5.408
    3    HB   VAL  73           HB       VAL  73   8.374 -14.969  -4.972
    4   HG11  VAL  73          HG11      VAL  73   6.490 -16.685  -5.256
    5   HG13  VAL  73          HG12      VAL  73   8.138 -17.311  -5.325
    6   HG12  VAL  73          HG13      VAL  73   7.223 -17.070  -6.813
    7   HG21  VAL  73          HG21      VAL  73   8.567 -15.027  -7.966
    8   HG23  VAL  73          HG22      VAL  73   9.576 -16.123  -7.025
    9   HG22  VAL  73          HG23      VAL  73   9.710 -14.381  -6.787

  No H/Q in entry =           9
  In of MODEL   61
    1    H    LEU  74           H        LEU  74   7.166 -13.293  -8.586
    2    HA   LEU  74           HA       LEU  74   9.082 -11.315  -8.097
    3    HB2  LEU  74           HB2      LEU  74   8.640 -12.079 -10.333
    4    HB3  LEU  74           HB3      LEU  74   6.967 -11.535 -10.238
    5    HG   LEU  74           HG       LEU  74   7.745  -9.195 -10.024
    6   HD13  LEU  74          HD11      LEU  74   9.866  -9.352  -8.982
    7   HD12  LEU  74          HD12      LEU  74  10.242  -8.879 -10.638
    8   HD11  LEU  74          HD13      LEU  74  10.438 -10.558 -10.134
    9   HD23  LEU  74          HD21      LEU  74   9.219 -10.284 -12.366
   10   HD22  LEU  74          HD22      LEU  74   8.067  -8.971 -12.265
   11   HD21  LEU  74          HD23      LEU  74   7.494 -10.624 -12.241

  No H/Q in entry =          11
  In of MODEL   61
    1    H    VAL  75           H        VAL  75   5.582 -10.982  -8.458
    2    HA   VAL  75           HA       VAL  75   5.445  -8.225  -7.882
    3    HB   VAL  75           HB       VAL  75   3.386 -10.397  -7.492
    4   HG12  VAL  75          HG11      VAL  75   1.772  -8.475  -7.385
    5   HG11  VAL  75          HG12      VAL  75   3.138  -7.370  -7.366
    6   HG13  VAL  75          HG13      VAL  75   2.891  -8.478  -6.026
    7   HG23  VAL  75          HG21      VAL  75   2.463  -9.322  -9.572
    8   HG22  VAL  75          HG22      VAL  75   4.040 -10.072  -9.815
    9   HG21  VAL  75          HG23      VAL  75   3.911  -8.320  -9.646

  No H/Q in entry =           9
  In of MODEL   61
    1    H    GLU  76           H        GLU  76   5.228 -11.098  -5.762
    2    HA   GLU  76           HA       GLU  76   4.734  -9.735  -3.347
    3    HB2  GLU  76           HB2      GLU  76   4.599 -12.208  -3.582
    4    HB3  GLU  76           HB3      GLU  76   6.339 -12.277  -3.798
    5    HG2  GLU  76           HG2      GLU  76   5.875 -12.858  -1.504
    6    HG3  GLU  76           HG3      GLU  76   6.598 -11.260  -1.490

  No H/Q in entry =           6
  In of MODEL   61
    1    H    ALA  77           H        ALA  77   7.809 -10.604  -4.900
    2    HA   ALA  77           HA       ALA  77   9.479  -9.529  -2.884
    3    HB1  ALA  77           HB1      ALA  77  10.285 -11.072  -4.636
    4    HB2  ALA  77           HB2      ALA  77  11.247  -9.595  -4.576
    5    HB3  ALA  77           HB3      ALA  77  10.043  -9.812  -5.846

  No H/Q in entry =           5
  In of MODEL   61
    1    H    GLN  78           H        GLN  78   8.074  -8.142  -5.806
    2    HA   GLN  78           HA       GLN  78   9.391  -5.644  -5.708
    3    HB2  GLN  78           HB2      GLN  78   8.115  -6.580  -7.667
    4    HB3  GLN  78           HB3      GLN  78   6.625  -6.228  -6.797
    5    HG2  GLN  78           HG2      GLN  78   7.228  -3.847  -6.706
    6    HG3  GLN  78           HG3      GLN  78   8.730  -4.188  -7.564
    7   HE21  GLN  78          HE21      GLN  78   6.769  -2.408  -8.669
    8   HE22  GLN  78          HE22      GLN  78   6.112  -3.137 -10.055

  No H/Q in entry =           8
  In of MODEL   61
    1    H    LEU  79           H        LEU  79   6.385  -6.818  -4.281
    2    HA   LEU  79           HA       LEU  79   5.355  -4.421  -3.283
    3    HB2  LEU  79           HB2      LEU  79   4.068  -6.491  -3.224
    4    HB3  LEU  79           HB3      LEU  79   5.220  -7.210  -2.103
    5    HG   LEU  79           HG       LEU  79   4.641  -5.569  -0.383
    6   HD13  LEU  79          HD11      LEU  79   4.151  -3.565  -1.443
    7   HD12  LEU  79          HD12      LEU  79   2.531  -4.111  -1.006
    8   HD11  LEU  79          HD13      LEU  79   3.120  -4.332  -2.652
    9   HD23  LEU  79          HD21      LEU  79   2.061  -6.097  -0.299
   10   HD22  LEU  79          HD22      LEU  79   3.218  -7.420  -0.182
   11   HD21  LEU  79          HD23      LEU  79   2.405  -7.099  -1.710

  No H/Q in entry =          11
  In of MODEL   61
    1    H    HIS  80           H        HIS  80   7.564  -6.721  -1.686
    2    HA   HIS  80           HA       HIS  80   7.824  -5.167   0.678
    3    HB2  HIS  80           HB2      HIS  80   9.198  -7.516  -0.508
    4    HB3  HIS  80           HB3      HIS  80  10.093  -6.603   0.708
    5    HD1  HIS  80           HD1      HIS  80   9.603  -7.237   3.052
    6    HD2  HIS  80           HD2      HIS  80   6.406  -8.140   0.533
    7    HE1  HIS  80           HE1      HIS  80   7.842  -8.359   4.499
    8    HE2  HIS  80           HE2      HIS  80   5.887  -8.913   2.972

  No H/Q in entry =           8
  In of MODEL   61
    1    H    LEU  81           H        LEU  81   9.843  -5.426  -2.227
    2    HA   LEU  81           HA       LEU  81  11.861  -3.655  -1.348
    3    HB2  LEU  81           HB2      LEU  81  10.959  -4.470  -4.111
    4    HB3  LEU  81           HB3      LEU  81  12.365  -3.444  -3.820
    5    HG   LEU  81           HG       LEU  81  12.004  -6.166  -2.538
    6   HD12  LEU  81          HD11      LEU  81  13.833  -6.774  -4.279
    7   HD11  LEU  81          HD12      LEU  81  13.252  -5.361  -5.158
    8   HD13  LEU  81          HD13      LEU  81  12.157  -6.699  -4.818
    9   HD23  LEU  81          HD21      LEU  81  14.628  -5.816  -2.516
   10   HD22  LEU  81          HD22      LEU  81  13.632  -5.064  -1.272
   11   HD21  LEU  81          HD23      LEU  81  14.202  -4.110  -2.640

  No H/Q in entry =          11
  In of MODEL   61
    1    H    MET  82           H        MET  82   8.936  -3.064  -3.297
    2    HA   MET  82           HA       MET  82   9.443  -0.333  -3.806
    3    HB2  MET  82           HB2      MET  82   6.904  -1.959  -3.684
    4    HB3  MET  82           HB3      MET  82   6.883  -0.236  -4.054
    5    HG2  MET  82           HG2      MET  82   8.514  -2.294  -5.576
    6    HG3  MET  82           HG3      MET  82   6.941  -1.694  -6.096
    7    HE3  MET  82           HE1      MET  82   7.350   1.762  -7.279
    8    HE2  MET  82           HE2      MET  82   6.973   1.537  -5.573
    9    HE1  MET  82           HE3      MET  82   6.326   0.415  -6.766

  No H/Q in entry =           9
  In of MODEL   61
    1    H    THR  83           H        THR  83   7.663  -1.944  -1.201
    2    HA   THR  83           HA       THR  83   6.778   0.398   0.114
    3    HB   THR  83           HB       THR  83   6.656  -1.171   2.137
    4    HG1  THR  83           HG1      THR  83   7.438  -3.112   1.917
    5   HG22  THR  83          HG21      THR  83   5.028  -2.762   0.669
    6   HG21  THR  83          HG22      THR  83   5.242  -1.435  -0.467
    7   HG23  THR  83          HG23      THR  83   4.592  -1.122   1.143

  No H/Q in entry =           7
  In of MODEL   61
    1    H    SER  84           H        SER  84   9.625  -1.663   0.652
    2    HA   SER  84           HA       SER  84  10.660  -0.212   2.839
    3    HB2  SER  84           HB2      SER  84  11.942  -2.046   0.825
    4    HB3  SER  84           HB3      SER  84  12.875  -1.277   2.107
    5    HG   SER  84           HG       SER  84  10.620  -2.993   2.365

  No H/Q in entry =           5
  In of MODEL   61
    1    H    MET  85           H        MET  85  11.421   0.046  -0.648
    2    HA   MET  85           HA       MET  85  13.395   2.036  -0.397
    3    HB2  MET  85           HB2      MET  85  13.019   0.741  -2.459
    4    HB3  MET  85           HB3      MET  85  11.486   1.578  -2.697
    5    HG2  MET  85           HG2      MET  85  12.666   3.736  -2.819
    6    HG3  MET  85           HG3      MET  85  14.202   2.915  -2.555
    7    HE3  MET  85           HE1      MET  85  11.540   2.871  -6.279
    8    HE2  MET  85           HE2      MET  85  11.782   4.244  -5.202
    9    HE1  MET  85           HE3      MET  85  10.977   2.799  -4.602

  No H/Q in entry =           9
  In of MODEL   61
    1    H    LEU  86           H        LEU  86   9.903   2.327  -0.919
    2    HA   LEU  86           HA       LEU  86   9.807   5.138  -1.111
    3    HB2  LEU  86           HB2      LEU  86   7.984   3.455  -1.687
    4    HB3  LEU  86           HB3      LEU  86   7.649   3.367   0.042
    5    HG   LEU  86           HG       LEU  86   7.459   5.926  -0.021
    6   HD11  LEU  86          HD11      LEU  86   8.249   5.490  -2.718
    7   HD13  LEU  86          HD12      LEU  86   7.792   7.014  -1.965
    8   HD12  LEU  86          HD13      LEU  86   6.570   6.034  -2.770
    9   HD23  LEU  86          HD21      LEU  86   5.347   4.542  -1.685
   10   HD22  LEU  86          HD22      LEU  86   5.138   5.804  -0.474
   11   HD21  LEU  86          HD23      LEU  86   5.555   4.167   0.026

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ALA  87           H        ALA  87   9.357   2.965   1.641
    2    HA   ALA  87           HA       ALA  87   8.779   4.879   3.602
    3    HB1  ALA  87           HB1      ALA  87   9.620   2.068   3.528
    4    HB3  ALA  87           HB2      ALA  87   8.481   2.871   4.607
    5    HB2  ALA  87           HB3      ALA  87  10.208   2.924   4.957

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ARG  88           H        ARG  88  11.882   3.487   2.636
    2    HA   ARG  88           HA       ARG  88  13.470   4.890   4.469
    3    HB2  ARG  88           HB2      ARG  88  14.165   2.919   3.075
    4    HB3  ARG  88           HB3      ARG  88  14.310   4.009   1.699
    5    HG2  ARG  88           HG2      ARG  88  15.761   5.347   3.645
    6    HG3  ARG  88           HG3      ARG  88  16.100   3.663   4.031
    7    HD2  ARG  88           HD2      ARG  88  17.376   3.374   2.190
    8    HD3  ARG  88           HD3      ARG  88  16.233   4.229   1.150
    9    HE   ARG  88           HE       ARG  88  18.612   5.324   2.201
   10   HH21  ARG  88          HH11      ARG  88  18.932   7.546   1.999
   11   HH22  ARG  88          HH12      ARG  88  17.569   8.601   1.848
   12   HH11  ARG  88          HH21      ARG  88  15.265   6.037   1.909
   13   HH12  ARG  88          HH22      ARG  88  15.492   7.744   1.772

  No H/Q in entry =          13
  In of MODEL   61
    1    H    GLU  89           H        GLU  89  12.497   5.765   1.139
    2    HA   GLU  89           HA       GLU  89  14.017   8.142   0.979
    3    HB2  GLU  89           HB2      GLU  89  12.891   7.081  -0.968
    4    HB3  GLU  89           HB3      GLU  89  11.338   7.606  -0.317
    5    HG2  GLU  89           HG2      GLU  89  12.013   9.951  -0.486
    6    HG3  GLU  89           HG3      GLU  89  13.624   9.477  -1.016

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LEU  90           H        LEU  90  10.690   7.598   2.100
    2    HA   LEU  90           HA       LEU  90  10.142  10.327   2.664
    3    HB2  LEU  90           HB2      LEU  90   8.974   7.744   3.697
    4    HB3  LEU  90           HB3      LEU  90   8.323   9.333   4.112
    5    HG   LEU  90           HG       LEU  90   8.761   8.448   1.248
    6   HD12  LEU  90          HD11      LEU  90   6.230   8.090   1.304
    7   HD11  LEU  90          HD12      LEU  90   6.380   8.088   3.061
    8   HD13  LEU  90          HD13      LEU  90   7.215   6.864   2.103
    9   HD22  LEU  90          HD21      LEU  90   8.440  10.752   1.165
   10   HD21  LEU  90          HD22      LEU  90   7.449  10.778   2.622
   11   HD23  LEU  90          HD23      LEU  90   6.763  10.210   1.100

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  91           H        ILE  91  11.429   7.668   4.600
    2    HA   ILE  91           HA       ILE  91  11.547   9.043   7.064
    3    HB   ILE  91           HB       ILE  91  13.131   6.719   5.953
    4   HG12  ILE  91          HG12      ILE  91  11.106   6.871   8.206
    5   HG13  ILE  91          HG13      ILE  91  10.644   6.578   6.530
    6   HG22  ILE  91          HG21      ILE  91  13.595   6.520   8.596
    7   HG21  ILE  91          HG22      ILE  91  13.499   8.277   8.488
    8   HG23  ILE  91          HG23      ILE  91  14.691   7.400   7.531
    9   HD13  ILE  91          HD11      ILE  91  11.671   4.488   6.470
   10   HD12  ILE  91          HD12      ILE  91  11.072   4.545   8.128
   11   HD11  ILE  91          HD13      ILE  91  12.771   4.877   7.794

  No H/Q in entry =          11
  In of MODEL   61
    1    H    THR  92           H        THR  92  13.774   8.890   4.319
    2    HA   THR  92           HA       THR  92  15.919  10.312   5.480
    3    HB   THR  92           HB       THR  92  14.943  10.165   2.617
    4    HG1  THR  92           HG1      THR  92  15.796   8.280   3.031
    5   HG22  THR  92          HG21      THR  92  17.506  10.885   2.328
    6   HG21  THR  92          HG22      THR  92  17.184  11.707   3.854
    7   HG23  THR  92          HG23      THR  92  16.213  12.078   2.429

  No H/Q in entry =           7
  In of MODEL   61
    1    H    GLU  93           H        GLU  93  13.024  11.426   3.738
    2    HA   GLU  93           HA       GLU  93  13.586  14.194   3.845
    3    HB2  GLU  93           HB2      GLU  93  10.898  12.789   3.856
    4    HB3  GLU  93           HB3      GLU  93  11.167  14.491   3.479
    5    HG2  GLU  93           HG2      GLU  93  12.536  12.259   1.963
    6    HG3  GLU  93           HG3      GLU  93  10.983  12.922   1.469

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LEU  94           H        LEU  94  11.862  12.025   6.058
    2    HA   LEU  94           HA       LEU  94  11.025  13.968   7.925
    3    HB2  LEU  94           HB2      LEU  94  11.634  11.021   8.212
    4    HB3  LEU  94           HB3      LEU  94  11.047  11.995   9.557
    5    HG   LEU  94           HG       LEU  94   9.570  12.020   6.924
    6   HD11  LEU  94          HD11      LEU  94   9.673   9.807   8.936
    7   HD13  LEU  94          HD12      LEU  94   9.377   9.736   7.201
    8   HD12  LEU  94          HD13      LEU  94   8.090  10.242   8.293
    9   HD23  LEU  94          HD21      LEU  94   7.642  12.403   8.517
   10   HD22  LEU  94          HD22      LEU  94   8.866  13.672   8.553
   11   HD21  LEU  94          HD23      LEU  94   8.814  12.459   9.831

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  95           H        ILE  95  14.022  12.073   7.704
    2    HA   ILE  95           HA       ILE  95  15.172  13.017  10.117
    3    HB   ILE  95           HB       ILE  95  16.430  11.954   7.577
    4   HG12  ILE  95          HG12      ILE  95  16.140  10.759  10.348
    5   HG13  ILE  95          HG13      ILE  95  14.980  10.483   9.050
    6   HG21  ILE  95          HG21      ILE  95  17.668  12.784  10.219
    7   HG23  ILE  95          HG22      ILE  95  18.129  13.312   8.600
    8   HG22  ILE  95          HG23      ILE  95  18.453  11.657   9.115
    9   HD13  ILE  95          HD11      ILE  95  16.479   9.217   7.796
   10   HD12  ILE  95          HD12      ILE  95  16.952   8.779   9.435
   11   HD11  ILE  95          HD13      ILE  95  17.894   9.967   8.534

  No H/Q in entry =          11
  In of MODEL   61
    1    H    GLU  96           H        GLU  96  15.321  14.240   6.779
    2    HA   GLU  96           HA       GLU  96  17.142  16.342   7.254
    3    HB2  GLU  96           HB2      GLU  96  16.491  15.664   4.995
    4    HB3  GLU  96           HB3      GLU  96  14.841  16.203   5.289
    5    HG2  GLU  96           HG2      GLU  96  15.384  18.337   4.741
    6    HG3  GLU  96           HG3      GLU  96  16.679  18.357   5.926

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LEU  97           H        LEU  97  13.632  16.116   7.674
    2    HA   LEU  97           HA       LEU  97  13.182  18.847   8.305
    3    HB2  LEU  97           HB2      LEU  97  11.692  16.306   8.924
    4    HB3  LEU  97           HB3      LEU  97  11.159  17.849   9.589
    5    HG   LEU  97           HG       LEU  97  11.655  17.428   6.627
    6   HD12  LEU  97          HD11      LEU  97   9.133  17.271   6.503
    7   HD11  LEU  97          HD12      LEU  97   9.124  17.077   8.254
    8   HD13  LEU  97          HD13      LEU  97   9.922  15.875   7.238
    9   HD23  LEU  97          HD21      LEU  97   9.894  19.372   6.648
   10   HD22  LEU  97          HD22      LEU  97  11.570  19.752   7.043
   11   HD21  LEU  97          HD23      LEU  97  10.380  19.573   8.331

  No H/Q in entry =          11
  In of MODEL   61
    1    H    HIS  98           H        HIS  98  14.031  16.037  10.313
    2    HA   HIS  98           HA       HIS  98  13.852  17.305  12.824
    3    HB2  HIS  98           HB2      HIS  98  15.631  15.065  11.835
    4    HB3  HIS  98           HB3      HIS  98  15.618  15.609  13.514
    5    HD1  HIS  98           HD1      HIS  98  13.445  13.945  10.922
    6    HD2  HIS  98           HD2      HIS  98  13.317  14.878  14.983
    7    HE1  HIS  98           HE1      HIS  98  11.431  12.730  11.874
    8    HE2  HIS  98           HE2      HIS  98  11.333  13.290  14.343

  No H/Q in entry =           8
  In of MODEL   61
    1    H    GLU  99           H        GLU  99  16.413  17.211  10.396
    2    HA   GLU  99           HA       GLU  99  18.379  18.570  11.926
    3    HB2  GLU  99           HB2      GLU  99  18.879  17.281   9.862
    4    HB3  GLU  99           HB3      GLU  99  18.057  18.523   8.915
    5    HG2  GLU  99           HG2      GLU  99  19.644  20.215   9.704
    6    HG3  GLU  99           HG3      GLU  99  20.434  19.025  10.733

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LYS 100           H        LYS 100  15.848  19.696   9.699
    2    HA   LYS 100           HA       LYS 100  16.614  22.443   9.836
    3    HB2  LYS 100           HB2      LYS 100  13.998  21.122   9.079
    4    HB3  LYS 100           HB3      LYS 100  14.278  22.863   8.983
    5    HG2  LYS 100           HG2      LYS 100  16.259  22.432   7.523
    6    HG3  LYS 100           HG3      LYS 100  15.865  20.710   7.545
    7    HD2  LYS 100           HD2      LYS 100  13.667  21.192   6.538
    8    HD3  LYS 100           HD3      LYS 100  14.044  22.915   6.522
    9    HE2  LYS 100           HE2      LYS 100  16.012  22.451   5.069
   10    HE3  LYS 100           HE3      LYS 100  15.566  20.741   5.041
   11    HZ1  LYS 100           HZ1      LYS 100  13.719  22.911   4.194
   12    HZ3  LYS 100           HZ2      LYS 100  13.554  21.238   3.937
   13    HZ2  LYS 100           HZ3      LYS 100  14.757  22.111   3.116

  No H/Q in entry =          13
  In of MODEL   61
    1    H    LEU 101           H        LEU 101  14.535  20.380  11.803
    2    HA   LEU 101           HA       LEU 101  13.342  22.441  13.371
    3    HB2  LEU 101           HB2      LEU 101  13.816  19.497  13.766
    4    HB3  LEU 101           HB3      LEU 101  13.265  20.476  15.122
    5    HG   LEU 101           HG       LEU 101  11.853  20.540  12.449
    6   HD12  LEU 101          HD11      LEU 101  10.208  18.963  13.719
    7   HD11  LEU 101          HD12      LEU 101  11.604  18.568  14.719
    8   HD13  LEU 101          HD13      LEU 101  11.646  18.256  12.983
    9   HD21  LEU 101          HD21      LEU 101  11.181  21.335  15.297
   10   HD23  LEU 101          HD22      LEU 101   9.925  21.092  14.085
   11   HD22  LEU 101          HD23      LEU 101  11.147  22.340  13.845

  No H/Q in entry =          11
  In of MODEL   61
    1    H    LYS 102           H        LYS 102  16.497  21.866  12.944
    2    HA   LYS 102           HA       LYS 102  18.331  22.760  14.018
    3    HB2  LYS 102           HB2      LYS 102  16.498  24.259  15.142
    4    HB3  LYS 102           HB3      LYS 102  16.713  23.204  16.523
    5    HG2  LYS 102           HG2      LYS 102  18.587  25.231  15.352
    6    HG3  LYS 102           HG3      LYS 102  18.205  24.918  17.031
    7    HD2  LYS 102           HD2      LYS 102  19.896  23.018  15.355
    8    HD3  LYS 102           HD3      LYS 102  20.569  24.351  16.285
    9    HE2  LYS 102           HE2      LYS 102  20.196  21.801  17.262
   10    HE3  LYS 102           HE3      LYS 102  20.397  23.249  18.249
   11    HZ2  LYS 102           HZ1      LYS 102  18.440  21.946  18.866
   12    HZ1  LYS 102           HZ2      LYS 102  17.798  22.164  17.315
   13    HZ3  LYS 102           HZ3      LYS 102  18.011  23.499  18.337

  No H/Q in entry =          13
  In of MODEL   61
    1    H    ALA 103           H        ALA 103  16.271  21.141  16.440
    2    HA   ALA 103           HA       ALA 103  18.007  19.954  18.104
    3    HB2  ALA 103           HB1      ALA 103  16.444  17.930  18.101
    4    HB1  ALA 103           HB2      ALA 103  15.543  18.769  16.838
    5    HB3  ALA 103           HB3      ALA 103  15.709  19.497  18.435

  No H/Q in entry =           5
  In of MODEL   61
    1    H1   ALA   1           H3       ALA   1  -1.537  -7.242 -21.475
    2    H2   ALA   1           H2       ALA   1  -2.318  -8.684 -21.020
    3    H3   ALA   1           H1       ALA   1  -0.708  -8.719 -21.570
    4    HA   ALA   1           HA       ALA   1  -1.532  -9.203 -23.567
    5    HB1  ALA   1           HB1      ALA   1  -3.663  -9.941 -23.097
    6    HB2  ALA   1           HB2      ALA   1  -4.115  -8.438 -23.900
    7    HB3  ALA   1           HB3      ALA   1  -4.058  -8.512 -22.141

  No H/Q in entry =           7
  In of MODEL   61
    1    H    GLU   2           H        GLU   2  -2.369  -8.028 -25.562
    2    HA   GLU   2           HA       GLU   2  -0.989  -6.002 -26.443
    3    HB2  GLU   2           HB2      GLU   2  -3.994  -6.101 -26.768
    4    HB3  GLU   2           HB3      GLU   2  -2.880  -5.230 -27.818
    5    HG2  GLU   2           HG2      GLU   2  -2.354  -7.118 -28.965
    6    HG3  GLU   2           HG3      GLU   2  -2.051  -8.016 -27.484

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLU   3           H        GLU   3  -4.164  -4.775 -25.555
    2    HA   GLU   3           HA       GLU   3  -3.145  -2.206 -24.932
    3    HB2  GLU   3           HB2      GLU   3  -5.821  -3.547 -24.603
    4    HB3  GLU   3           HB3      GLU   3  -5.541  -1.927 -23.961
    5    HG2  GLU   3           HG2      GLU   3  -5.188  -1.003 -26.089
    6    HG3  GLU   3           HG3      GLU   3  -4.776  -2.557 -26.807

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LEU   4           H        LEU   4  -4.718  -4.574 -22.749
    2    HA   LEU   4           HA       LEU   4  -4.372  -3.335 -20.361
    3    HB2  LEU   4           HB2      LEU   4  -3.798  -6.272 -20.820
    4    HB3  LEU   4           HB3      LEU   4  -4.216  -5.525 -19.279
    5    HG   LEU   4           HG       LEU   4  -5.981  -5.625 -21.748
    6   HD13  LEU   4          HD11      LEU   4  -7.159  -7.351 -20.748
    7   HD12  LEU   4          HD12      LEU   4  -6.683  -6.882 -19.117
    8   HD11  LEU   4          HD13      LEU   4  -5.536  -7.716 -20.163
    9   HD23  LEU   4          HD21      LEU   4  -7.678  -4.825 -19.887
   10   HD22  LEU   4          HD22      LEU   4  -6.650  -3.646 -20.699
   11   HD21  LEU   4          HD23      LEU   4  -6.222  -4.227 -19.090

  No H/Q in entry =          11
  In of MODEL   61
    1    H    GLU   5           H        GLU   5  -1.851  -5.158 -22.079
    2    HA   GLU   5           HA       GLU   5   0.124  -4.848 -20.038
    3    HB2  GLU   5           HB2      GLU   5   0.228  -6.626 -21.768
    4    HB3  GLU   5           HB3      GLU   5   0.497  -5.392 -22.998
    5    HG2  GLU   5           HG2      GLU   5   2.560  -4.688 -21.872
    6    HG3  GLU   5           HG3      GLU   5   2.289  -5.878 -20.600

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLU   6           H        GLU   6  -0.520  -3.150 -23.090
    2    HA   GLU   6           HA       GLU   6   1.631  -1.296 -22.822
    3    HB2  GLU   6           HB2      GLU   6  -0.837  -1.476 -24.516
    4    HB3  GLU   6           HB3      GLU   6   0.068   0.038 -24.463
    5    HG2  GLU   6           HG2      GLU   6   0.919  -1.291 -26.302
    6    HG3  GLU   6           HG3      GLU   6   2.141  -1.254 -25.035

  No H/Q in entry =           6
  In of MODEL   61
    1    H    VAL   7           H        VAL   7  -1.710  -1.398 -21.786
    2    HA   VAL   7           HA       VAL   7  -1.961   1.315 -20.958
    3    HB   VAL   7           HB       VAL   7  -3.400  -1.215 -20.118
    4   HG11  VAL   7          HG11      VAL   7  -3.806   1.672 -19.314
    5   HG13  VAL   7          HG12      VAL   7  -3.695   0.252 -18.274
    6   HG12  VAL   7          HG13      VAL   7  -5.127   0.504 -19.271
    7   HG21  VAL   7          HG21      VAL   7  -3.561  -0.147 -22.510
    8   HG23  VAL   7          HG22      VAL   7  -4.521   1.094 -21.705
    9   HG22  VAL   7          HG23      VAL   7  -5.050  -0.588 -21.674

  No H/Q in entry =           9
  In of MODEL   61
    1    H    VAL   8           H        VAL   8  -0.948  -1.655 -19.303
    2    HA   VAL   8           HA       VAL   8  -0.647  -0.564 -16.710
    3    HB   VAL   8           HB       VAL   8   0.778  -2.872 -18.058
    4   HG11  VAL   8          HG11      VAL   8   0.930  -1.729 -15.285
    5   HG13  VAL   8          HG12      VAL   8   2.222  -2.380 -16.294
    6   HG12  VAL   8          HG13      VAL   8   1.083  -3.472 -15.506
    7   HG23  VAL   8          HG21      VAL   8  -1.182  -3.315 -15.859
    8   HG22  VAL   8          HG22      VAL   8  -0.978  -4.188 -17.375
    9   HG21  VAL   8          HG23      VAL   8  -1.878  -2.677 -17.348

  No H/Q in entry =           9
  In of MODEL   61
    1    H    MET   9           H        MET   9   1.612  -0.851 -19.451
    2    HA   MET   9           HA       MET   9   3.884   0.218 -18.187
    3    HB2  MET   9           HB2      MET   9   2.938   0.177 -21.045
    4    HB3  MET   9           HB3      MET   9   4.410   1.036 -20.597
    5    HG2  MET   9           HG2      MET   9   5.102  -1.152 -19.410
    6    HG3  MET   9           HG3      MET   9   3.813  -1.911 -20.345
    7    HE3  MET   9           HE1      MET   9   4.786  -1.772 -23.926
    8    HE2  MET   9           HE2      MET   9   3.735  -0.589 -23.153
    9    HE1  MET   9           HE3      MET   9   3.673  -2.275 -22.649

  No H/Q in entry =           9
  In of MODEL   61
    1    H    GLY  10           H        GLY  10   1.189   1.789 -19.876
    2    HA3  GLY  10           HA2      GLY  10   2.127   4.453 -19.637
    3    HA2  GLY  10           HA3      GLY  10   0.442   3.976 -19.845

  No H/Q in entry =           3
  In of MODEL   61
    1    H    LEU  11           H        LEU  11   0.052   2.452 -17.555
    2    HA   LEU  11           HA       LEU  11  -0.501   4.430 -15.602
    3    HB2  LEU  11           HB2      LEU  11  -0.407   1.415 -15.437
    4    HB3  LEU  11           HB3      LEU  11  -0.928   2.437 -14.099
    5    HG   LEU  11           HG       LEU  11  -2.161   2.532 -16.865
    6   HD13  LEU  11          HD11      LEU  11  -2.728   0.386 -16.105
    7   HD12  LEU  11          HD12      LEU  11  -4.088   1.367 -15.566
    8   HD11  LEU  11          HD13      LEU  11  -2.830   0.901 -14.421
    9   HD22  LEU  11          HD21      LEU  11  -2.773   4.545 -15.866
   10   HD21  LEU  11          HD22      LEU  11  -2.695   3.884 -14.233
   11   HD23  LEU  11          HD23      LEU  11  -4.065   3.503 -15.277

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  12           H        ILE  12   2.064   1.986 -15.832
    2    HA   ILE  12           HA       ILE  12   3.260   2.541 -13.327
    3    HB   ILE  12           HB       ILE  12   4.527   1.504 -15.885
    4   HG12  ILE  12          HG12      ILE  12   2.526   0.256 -14.745
    5   HG13  ILE  12          HG13      ILE  12   3.939  -0.669 -15.212
    6   HG22  ILE  12          HG21      ILE  12   6.210   0.500 -14.292
    7   HG21  ILE  12          HG22      ILE  12   5.501   1.480 -13.009
    8   HG23  ILE  12          HG23      ILE  12   6.271   2.258 -14.390
    9   HD13  ILE  12          HD11      ILE  12   4.742  -0.649 -12.925
   10   HD12  ILE  12          HD12      ILE  12   3.067  -1.197 -12.925
   11   HD11  ILE  12          HD13      ILE  12   3.454   0.440 -12.446

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  13           H        ILE  13   3.856   3.800 -16.587
    2    HA   ILE  13           HA       ILE  13   5.977   5.541 -15.863
    3    HB   ILE  13           HB       ILE  13   3.950   5.597 -18.113
    4   HG12  ILE  13          HG12      ILE  13   5.806   3.775 -17.824
    5   HG13  ILE  13          HG13      ILE  13   5.555   4.509 -19.405
    6   HG23  ILE  13          HG21      ILE  13   4.611   7.870 -17.924
    7   HG22  ILE  13          HG22      ILE  13   5.635   7.214 -19.197
    8   HG21  ILE  13          HG23      ILE  13   6.289   7.447 -17.577
    9   HD11  ILE  13          HD11      ILE  13   7.630   5.514 -17.422
   10   HD13  ILE  13          HD12      ILE  13   7.446   5.971 -19.111
   11   HD12  ILE  13          HD13      ILE  13   7.977   4.346 -18.695

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ASN  14           H        ASN  14   2.467   6.004 -16.139
    2    HA   ASN  14           HA       ASN  14   2.399   8.752 -15.510
    3    HB2  ASN  14           HB2      ASN  14   0.522   7.091 -16.339
    4    HB3  ASN  14           HB3      ASN  14   0.199   6.914 -14.619
    5   HD21  ASN  14          HD21      ASN  14  -1.828   8.049 -16.059
    6   HD22  ASN  14          HD22      ASN  14  -1.906   9.722 -15.796

  No H/Q in entry =           6
  In of MODEL   61
    1    H    SER  15           H        SER  15   2.125   5.879 -13.426
    2    HA   SER  15           HA       SER  15   1.801   7.253 -10.982
    3    HB2  SER  15           HB2      SER  15   2.371   5.176  -9.925
    4    HB3  SER  15           HB3      SER  15   1.543   4.746 -11.417
    5    HG   SER  15           HG       SER  15   3.853   3.905 -10.709

  No H/Q in entry =           5
  In of MODEL   61
    1    H    GLY  16           H        GLY  16   4.690   6.177 -12.732
    2    HA3  GLY  16           HA2      GLY  16   6.605   6.957 -10.800
    3    HA2  GLY  16           HA3      GLY  16   6.913   6.752 -12.523

  No H/Q in entry =           3
  In of MODEL   61
    1    H    GLN  17           H        GLN  17   5.207   8.691 -13.594
    2    HA   GLN  17           HA       GLN  17   6.762  11.048 -13.290
    3    HB2  GLN  17           HB2      GLN  17   5.428  10.525 -15.328
    4    HB3  GLN  17           HB3      GLN  17   3.951  10.789 -14.401
    5    HG2  GLN  17           HG2      GLN  17   4.509  12.815 -15.648
    6    HG3  GLN  17           HG3      GLN  17   4.691  13.110 -13.920
    7   HE21  GLN  17          HE21      GLN  17   6.392  14.654 -13.948
    8   HE22  GLN  17          HE22      GLN  17   7.923  14.342 -14.611

  No H/Q in entry =           8
  In of MODEL   61
    1    H    ALA  18           H        ALA  18   3.669  10.004 -11.944
    2    HA   ALA  18           HA       ALA  18   2.918  12.390 -10.687
    3    HB1  ALA  18           HB1      ALA  18   1.813   9.921 -10.904
    4    HB2  ALA  18           HB2      ALA  18   1.251  11.139  -9.762
    5    HB3  ALA  18           HB3      ALA  18   2.352   9.869  -9.226

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ARG  19           H        ARG  19   4.817   9.649  -9.396
    2    HA   ARG  19           HA       ARG  19   5.333  10.820  -6.876
    3    HB2  ARG  19           HB2      ARG  19   5.772   8.420  -7.395
    4    HB3  ARG  19           HB3      ARG  19   7.125   8.917  -8.415
    5    HG2  ARG  19           HG2      ARG  19   8.230   9.974  -6.494
    6    HG3  ARG  19           HG3      ARG  19   6.856   9.575  -5.464
    7    HD2  ARG  19           HD2      ARG  19   8.635   7.959  -5.098
    8    HD3  ARG  19           HD3      ARG  19   7.270   7.160  -5.884
    9    HE   ARG  19           HE       ARG  19   8.970   7.991  -7.930
   10   HH21  ARG  19          HH11      ARG  19  10.547   6.599  -8.773
   11   HH22  ARG  19          HH12      ARG  19  11.104   5.260  -7.833
   12   HH11  ARG  19          HH21      ARG  19   9.058   5.969  -5.145
   13   HH12  ARG  19          HH22      ARG  19  10.258   4.903  -5.777

  No H/Q in entry =          13
  In of MODEL   61
    1    H    SER  20           H        SER  20   7.155  10.860  -9.922
    2    HA   SER  20           HA       SER  20   9.384  12.302  -9.098
    3    HB2  SER  20           HB2      SER  20   9.432  11.421 -11.299
    4    HB3  SER  20           HB3      SER  20   7.922  12.216 -11.732
    5    HG   SER  20           HG       SER  20   9.166  14.225 -11.251

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LEU  21           H        LEU  21   6.273  13.533 -10.305
    2    HA   LEU  21           HA       LEU  21   6.913  16.287 -10.087
    3    HB2  LEU  21           HB2      LEU  21   4.259  14.836 -10.004
    4    HB3  LEU  21           HB3      LEU  21   4.409  16.591 -10.021
    5    HG   LEU  21           HG       LEU  21   5.626  14.793 -12.137
    6   HD11  LEU  21          HD11      LEU  21   2.975  16.265 -12.092
    7   HD13  LEU  21          HD12      LEU  21   3.224  14.525 -12.239
    8   HD12  LEU  21          HD13      LEU  21   3.706  15.598 -13.552
    9   HD22  LEU  21          HD21      LEU  21   6.750  16.838 -12.323
   10   HD21  LEU  21          HD22      LEU  21   5.374  17.778 -11.754
   11   HD23  LEU  21          HD23      LEU  21   5.376  17.130 -13.387

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ALA  22           H        ALA  22   5.422  13.987  -7.835
    2    HA   ALA  22           HA       ALA  22   4.795  15.794  -5.775
    3    HB3  ALA  22           HB1      ALA  22   4.062  13.393  -5.932
    4    HB2  ALA  22           HB2      ALA  22   4.641  13.877  -4.338
    5    HB1  ALA  22           HB3      ALA  22   5.678  12.927  -5.404

  No H/Q in entry =           5
  In of MODEL   61
    1    H    TYR  23           H        TYR  23   7.753  13.802  -6.201
    2    HA   TYR  23           HA       TYR  23   9.119  14.844  -3.949
    3    HB2  TYR  23           HB2      TYR  23   9.931  12.842  -5.101
    4    HB3  TYR  23           HB3      TYR  23  10.239  13.781  -6.561
    5    HD1  TYR  23           HD1      TYR  23  11.194  13.462  -2.967
    6    HD2  TYR  23           HD2      TYR  23  12.261  14.975  -6.844
    7    HE1  TYR  23           HE1      TYR  23  13.443  14.067  -2.113
    8    HE2  TYR  23           HE2      TYR  23  14.509  15.580  -5.989
    9    HH   TYR  23           HH       TYR  23  15.384  15.035  -2.575

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ALA  24           H        ALA  24   8.930  15.938  -7.319
    2    HA   ALA  24           HA       ALA  24  10.799  18.047  -7.076
    3    HB2  ALA  24           HB1      ALA  24  10.360  18.097  -9.286
    4    HB3  ALA  24           HB2      ALA  24   8.795  18.829  -8.932
    5    HB1  ALA  24           HB3      ALA  24   8.942  17.077  -9.056

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ALA  25           H        ALA  25   7.322  17.821  -6.461
    2    HA   ALA  25           HA       ALA  25   6.806  20.535  -5.901
    3    HB1  ALA  25           HB1      ALA  25   5.171  18.515  -6.099
    4    HB2  ALA  25           HB2      ALA  25   4.785  19.802  -4.955
    5    HB3  ALA  25           HB3      ALA  25   5.492  18.292  -4.378

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LEU  26           H        LEU  26   7.905  17.875  -3.841
    2    HA   LEU  26           HA       LEU  26   7.987  19.315  -1.408
    3    HB2  LEU  26           HB2      LEU  26   8.113  16.900  -1.395
    4    HB3  LEU  26           HB3      LEU  26   9.585  16.924  -2.363
    5    HG   LEU  26           HG       LEU  26  10.782  18.064  -0.524
    6   HD12  LEU  26          HD11      LEU  26   9.551  18.063   1.734
    7   HD11  LEU  26          HD12      LEU  26   8.067  17.902   0.797
    8   HD13  LEU  26          HD13      LEU  26   9.094  19.321   0.585
    9   HD21  LEU  26          HD21      LEU  26   9.279  15.579   0.354
   10   HD23  LEU  26          HD22      LEU  26  10.786  16.164   1.053
   11   HD22  LEU  26          HD23      LEU  26  10.751  15.599  -0.616

  No H/Q in entry =          11
  In of MODEL   61
    1    H    LYS  27           H        LYS  27  10.416  18.767  -3.926
    2    HA   LYS  27           HA       LYS  27  12.580  20.041  -2.698
    3    HB2  LYS  27           HB2      LYS  27  12.704  18.689  -4.784
    4    HB3  LYS  27           HB3      LYS  27  11.923  20.008  -5.655
    5    HG2  LYS  27           HG2      LYS  27  13.767  21.520  -5.079
    6    HG3  LYS  27           HG3      LYS  27  14.543  20.242  -4.136
    7    HD2  LYS  27           HD2      LYS  27  14.709  18.850  -6.186
    8    HD3  LYS  27           HD3      LYS  27  13.977  20.155  -7.120
    9    HE2  LYS  27           HE2      LYS  27  15.843  21.649  -6.508
   10    HE3  LYS  27           HE3      LYS  27  16.579  20.347  -5.565
   11    HZ3  LYS  27           HZ1      LYS  27  17.571  20.454  -7.750
   12    HZ2  LYS  27           HZ2      LYS  27  16.048  20.312  -8.493
   13    HZ1  LYS  27           HZ3      LYS  27  16.687  19.013  -7.604

  No H/Q in entry =          13
  In of MODEL   61
    1    H    GLN  28           H        GLN  28   9.943  21.380  -4.656
    2    HA   GLN  28           HA       GLN  28  10.865  24.045  -4.817
    3    HB2  GLN  28           HB2      GLN  28   8.047  22.936  -4.706
    4    HB3  GLN  28           HB3      GLN  28   8.438  24.613  -5.086
    5    HG2  GLN  28           HG2      GLN  28   9.463  22.206  -6.620
    6    HG3  GLN  28           HG3      GLN  28   8.123  23.230  -7.132
    7   HE21  GLN  28          HE21      GLN  28  11.291  22.758  -7.809
    8   HE22  GLN  28          HE22      GLN  28  11.758  24.343  -8.199

  No H/Q in entry =           8
  In of MODEL   61
    1    H    ALA  29           H        ALA  29   8.953  22.334  -2.378
    2    HA   ALA  29           HA       ALA  29   8.370  24.524  -0.705
    3    HB2  ALA  29           HB1      ALA  29   7.660  22.950   0.868
    4    HB1  ALA  29           HB2      ALA  29   8.899  21.782   0.409
    5    HB3  ALA  29           HB3      ALA  29   7.511  22.052  -0.643

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LYS  30           H        LYS  30  11.132  22.295  -0.762
    2    HA   LYS  30           HA       LYS  30  12.432  23.276   1.540
    3    HB2  LYS  30           HB2      LYS  30  13.551  21.997  -0.964
    4    HB3  LYS  30           HB3      LYS  30  14.526  22.375   0.458
    5    HG2  LYS  30           HG2      LYS  30  12.990  20.974   1.840
    6    HG3  LYS  30           HG3      LYS  30  12.114  20.535   0.370
    7    HD2  LYS  30           HD2      LYS  30  14.174  19.575  -0.584
    8    HD3  LYS  30           HD3      LYS  30  15.069  20.028   0.868
    9    HE2  LYS  30           HE2      LYS  30  13.583  18.580   2.224
   10    HE3  LYS  30           HE3      LYS  30  12.718  18.107   0.756
   11    HZ2  LYS  30           HZ1      LYS  30  14.531  16.557   1.525
   12    HZ1  LYS  30           HZ2      LYS  30  15.651  17.759   1.072
   13    HZ3  LYS  30           HZ3      LYS  30  14.628  17.057  -0.092

  No H/Q in entry =          13
  In of MODEL   61
    1    H    GLN  31           H        GLN  31  12.311  24.468  -1.761
    2    HA   GLN  31           HA       GLN  31  14.436  26.393  -1.342
    3    HB2  GLN  31           HB2      GLN  31  12.397  26.403  -3.570
    4    HB3  GLN  31           HB3      GLN  31  14.006  27.122  -3.570
    5    HG2  GLN  31           HG2      GLN  31  14.506  24.435  -2.985
    6    HG3  GLN  31           HG3      GLN  31  13.205  24.358  -4.166
    7   HE21  GLN  31          HE21      GLN  31  16.061  23.605  -4.562
    8   HE22  GLN  31          HE22      GLN  31  16.621  24.582  -5.831

  No H/Q in entry =           8
  In of MODEL   61
    1    H    GLY  32           H        GLY  32  11.363  26.170  -0.201
    2    HA3  GLY  32           HA2      GLY  32  10.182  27.726   1.065
    3    HA2  GLY  32           HA3      GLY  32  11.290  28.975   0.513

  No H/Q in entry =           3
  In of MODEL   61
    1    H    ASP  33           H        ASP  33   9.958  27.044  -1.975
    2    HA   ASP  33           HA       ASP  33   8.262  29.290  -2.841
    3    HB2  ASP  33           HB2      ASP  33   9.393  26.882  -4.274
    4    HB3  ASP  33           HB3      ASP  33   8.227  27.978  -5.010

  No H/Q in entry =           4
  In of MODEL   61
    1    H    PHE  34           H        PHE  34   6.578  28.795  -1.279
    2    HA   PHE  34           HA       PHE  34   5.234  26.303  -1.177
    3    HB2  PHE  34           HB2      PHE  34   4.232  29.078  -0.508
    4    HB3  PHE  34           HB3      PHE  34   3.404  27.577  -0.094
    5    HD1  PHE  34           HD1      PHE  34   5.617  30.012   1.117
    6    HD2  PHE  34           HD2      PHE  34   4.998  25.761   1.076
    7    HE1  PHE  34           HE1      PHE  34   7.008  29.788   3.157
    8    HE2  PHE  34           HE2      PHE  34   6.391  25.542   3.114
    9    HZ   PHE  34           HZ       PHE  34   7.390  27.556   4.154

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ALA  35           H        ALA  35   4.766  29.154  -3.198
    2    HA   ALA  35           HA       ALA  35   2.226  28.499  -4.226
    3    HB3  ALA  35           HB1      ALA  35   3.261  29.900  -6.266
    4    HB2  ALA  35           HB2      ALA  35   4.471  30.283  -5.041
    5    HB1  ALA  35           HB3      ALA  35   2.774  30.668  -4.755

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ALA  36           H        ALA  36   5.466  27.868  -5.572
    2    HA   ALA  36           HA       ALA  36   4.502  26.418  -7.813
    3    HB3  ALA  36           HB1      ALA  36   6.660  26.572  -8.425
    4    HB2  ALA  36           HB2      ALA  36   7.154  25.554  -7.071
    5    HB1  ALA  36           HB3      ALA  36   7.022  27.301  -6.861

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ALA  37           H        ALA  37   5.466  25.448  -4.553
    2    HA   ALA  37           HA       ALA  37   5.449  22.658  -4.973
    3    HB2  ALA  37           HB1      ALA  37   5.158  24.453  -2.601
    4    HB1  ALA  37           HB2      ALA  37   6.311  23.151  -2.887
    5    HB3  ALA  37           HB3      ALA  37   4.654  22.774  -2.418

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LYS  38           H        LYS  38   2.882  24.833  -3.817
    2    HA   LYS  38           HA       LYS  38   0.809  22.990  -3.591
    3    HB2  LYS  38           HB2      LYS  38   1.120  25.751  -3.349
    4    HB3  LYS  38           HB3      LYS  38  -0.075  25.583  -4.629
    5    HG2  LYS  38           HG2      LYS  38  -1.507  24.243  -3.185
    6    HG3  LYS  38           HG3      LYS  38  -0.264  24.205  -1.926
    7    HD2  LYS  38           HD2      LYS  38  -0.485  26.540  -1.487
    8    HD3  LYS  38           HD3      LYS  38  -1.399  26.811  -2.972
    9    HE2  LYS  38           HE2      LYS  38  -2.906  26.829  -1.035
   10    HE3  LYS  38           HE3      LYS  38  -3.258  25.444  -2.073
   11    HZ3  LYS  38           HZ1      LYS  38  -2.514  23.989  -0.534
   12    HZ2  LYS  38           HZ2      LYS  38  -2.884  25.245   0.551
   13    HZ1  LYS  38           HZ3      LYS  38  -1.285  25.016   0.029

  No H/Q in entry =          13
  In of MODEL   61
    1    H    ALA  39           H        ALA  39   1.766  24.897  -6.445
    2    HA   ALA  39           HA       ALA  39  -0.294  23.994  -8.148
    3    HB2  ALA  39           HB1      ALA  39   2.434  24.679  -9.200
    4    HB1  ALA  39           HB2      ALA  39   1.448  25.928  -8.440
    5    HB3  ALA  39           HB3      ALA  39   0.850  25.077  -9.865

  No H/Q in entry =           5
  In of MODEL   61
    1    H    MET  40           H        MET  40   2.962  22.744  -7.559
    2    HA   MET  40           HA       MET  40   2.897  20.716  -9.544
    3    HB2  MET  40           HB2      MET  40   4.501  20.972  -6.994
    4    HB3  MET  40           HB3      MET  40   4.772  19.716  -8.203
    5    HG2  MET  40           HG2      MET  40   4.787  22.671  -8.878
    6    HG3  MET  40           HG3      MET  40   6.246  21.791  -8.424
    7    HE3  MET  40           HE1      MET  40   7.155  19.579 -11.224
    8    HE2  MET  40           HE2      MET  40   6.594  19.257  -9.586
    9    HE1  MET  40           HE3      MET  40   7.670  20.620  -9.888

  No H/Q in entry =           9
  In of MODEL   61
    1    H    MET  41           H        MET  41   1.976  20.756  -6.122
    2    HA   MET  41           HA       MET  41   1.484  17.985  -5.836
    3    HB2  MET  41           HB2      MET  41   0.114  20.327  -4.495
    4    HB3  MET  41           HB3      MET  41  -0.018  18.649  -3.982
    5    HG2  MET  41           HG2      MET  41   2.689  18.912  -4.015
    6    HG3  MET  41           HG3      MET  41   2.223  20.565  -3.625
    7    HE2  MET  41           HE1      MET  41  -0.800  19.272  -1.901
    8    HE1  MET  41           HE2      MET  41  -0.005  20.796  -2.282
    9    HE3  MET  41           HE3      MET  41  -0.059  20.230  -0.612

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ASP  42           H        ASP  42  -0.593  20.676  -6.822
    2    HA   ASP  42           HA       ASP  42  -3.013  19.278  -6.958
    3    HB2  ASP  42           HB2      ASP  42  -2.345  21.858  -7.222
    4    HB3  ASP  42           HB3      ASP  42  -2.487  21.455  -8.930

  No H/Q in entry =           4
  In of MODEL   61
    1    H    GLN  43           H        GLN  43  -0.577  19.898  -9.458
    2    HA   GLN  43           HA       GLN  43  -1.940  18.551 -11.545
    3    HB2  GLN  43           HB2      GLN  43   1.009  19.113 -11.160
    4    HB3  GLN  43           HB3      GLN  43   0.308  18.457 -12.642
    5    HG2  GLN  43           HG2      GLN  43  -1.235  20.461 -12.692
    6    HG3  GLN  43           HG3      GLN  43  -0.294  21.136 -11.365
    7   HE21  GLN  43          HE21      GLN  43  -0.154  22.752 -13.456
    8   HE22  GLN  43          HE22      GLN  43   1.266  22.549 -14.361

  No H/Q in entry =           8
  In of MODEL   61
    1    H    SER  44           H        SER  44   0.423  17.454  -9.147
    2    HA   SER  44           HA       SER  44   0.800  14.849 -10.163
    3    HB2  SER  44           HB2      SER  44   1.669  16.309  -7.930
    4    HB3  SER  44           HB3      SER  44   0.826  14.915  -7.256
    5    HG   SER  44           HG       SER  44   2.947  14.326  -7.677

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ARG  45           H        ARG  45  -1.544  16.140  -7.833
    2    HA   ARG  45           HA       ARG  45  -2.895  13.760  -7.193
    3    HB2  ARG  45           HB2      ARG  45  -3.129  15.929  -6.009
    4    HB3  ARG  45           HB3      ARG  45  -3.993  16.578  -7.399
    5    HG2  ARG  45           HG2      ARG  45  -5.733  14.826  -7.113
    6    HG3  ARG  45           HG3      ARG  45  -4.881  14.231  -5.687
    7    HD2  ARG  45           HD2      ARG  45  -5.125  16.498  -4.639
    8    HD3  ARG  45           HD3      ARG  45  -6.118  16.998  -6.024
    9    HE   ARG  45           HE       ARG  45  -7.192  14.608  -4.978
   10   HH21  ARG  45          HH11      ARG  45  -9.031  14.659  -3.711
   11   HH22  ARG  45          HH12      ARG  45  -9.450  16.095  -2.848
   12   HH11  ARG  45          HH21      ARG  45  -6.699  17.866  -3.964
   13   HH12  ARG  45          HH22      ARG  45  -8.125  17.912  -2.989

  No H/Q in entry =          13
  In of MODEL   61
    1    H    MET  46           H        MET  46  -3.513  16.146  -9.752
    2    HA   MET  46           HA       MET  46  -5.831  14.934 -10.815
    3    HB2  MET  46           HB2      MET  46  -3.760  16.800 -11.976
    4    HB3  MET  46           HB3      MET  46  -5.110  16.205 -12.946
    5    HG2  MET  46           HG2      MET  46  -6.718  17.219 -11.531
    6    HG3  MET  46           HG3      MET  46  -5.550  17.468 -10.239
    7    HE1  MET  46           HE1      MET  46  -5.855  17.999 -14.030
    8    HE3  MET  46           HE2      MET  46  -4.114  18.076 -13.779
    9    HE2  MET  46           HE3      MET  46  -4.983  19.511 -14.318

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ALA  47           H        ALA  47  -2.394  14.507 -11.565
    2    HA   ALA  47           HA       ALA  47  -2.707  12.767 -13.770
    3    HB3  ALA  47           HB1      ALA  47  -0.545  13.692 -13.417
    4    HB2  ALA  47           HB2      ALA  47  -0.377  11.967 -13.078
    5    HB1  ALA  47           HB3      ALA  47  -0.490  13.122 -11.748

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LEU  48           H        LEU  48  -2.434  12.147 -10.294
    2    HA   LEU  48           HA       LEU  48  -2.483   9.305 -10.443
    3    HB2  LEU  48           HB2      LEU  48  -3.281  11.218  -8.237
    4    HB3  LEU  48           HB3      LEU  48  -3.160   9.470  -8.030
    5    HG   LEU  48           HG       LEU  48  -0.887  11.203  -9.029
    6   HD13  LEU  48          HD11      LEU  48  -1.186  11.975  -6.841
    7   HD12  LEU  48          HD12      LEU  48  -0.002  10.687  -6.636
    8   HD11  LEU  48          HD13      LEU  48  -1.696  10.399  -6.241
    9   HD22  LEU  48          HD21      LEU  48  -0.352   9.023  -9.662
   10   HD21  LEU  48          HD22      LEU  48  -1.212   8.298  -8.304
   11   HD23  LEU  48          HD23      LEU  48   0.348   9.078  -8.044

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ASN  49           H        ASN  49  -4.986  11.759 -10.054
    2    HA   ASN  49           HA       ASN  49  -7.146  10.061  -9.513
    3    HB2  ASN  49           HB2      ASN  49  -7.226  12.492  -9.205
    4    HB3  ASN  49           HB3      ASN  49  -7.098  12.735 -10.943
    5   HD21  ASN  49          HD21      ASN  49  -9.188  13.816 -10.994
    6   HD22  ASN  49          HD22      ASN  49 -10.632  12.942 -10.825

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLU  50           H        GLU  50  -5.880  11.268 -12.602
    2    HA   GLU  50           HA       GLU  50  -7.811   9.976 -14.247
    3    HB2  GLU  50           HB2      GLU  50  -6.373  11.815 -15.065
    4    HB3  GLU  50           HB3      GLU  50  -4.962  10.766 -14.920
    5    HG2  GLU  50           HG2      GLU  50  -5.907   9.210 -16.554
    6    HG3  GLU  50           HG3      GLU  50  -7.383  10.164 -16.647

  No H/Q in entry =           6
  In of MODEL   61
    1    H    ALA  51           H        ALA  51  -4.627   9.039 -13.032
    2    HA   ALA  51           HA       ALA  51  -4.445   6.584 -14.442
    3    HB2  ALA  51           HB1      ALA  51  -2.462   6.331 -13.337
    4    HB1  ALA  51           HB2      ALA  51  -3.160   6.748 -11.772
    5    HB3  ALA  51           HB3      ALA  51  -2.723   8.022 -12.910

  No H/Q in entry =           5
  In of MODEL   61
    1    H    HIS  52           H        HIS  52  -5.638   7.407 -11.198
    2    HA   HIS  52           HA       HIS  52  -6.283   4.789 -10.359
    3    HB2  HIS  52           HB2      HIS  52  -6.179   6.750  -8.850
    4    HB3  HIS  52           HB3      HIS  52  -7.637   7.391  -9.607
    5    HD1  HIS  52           HD1      HIS  52  -9.821   5.801  -9.410
    6    HD2  HIS  52           HD2      HIS  52  -6.668   4.892  -6.840
    7    HE1  HIS  52           HE1      HIS  52 -10.780   4.315  -7.597
    8    HE2  HIS  52           HE2      HIS  52  -8.869   3.752  -6.022

  No H/Q in entry =           8
  In of MODEL   61
    1    H    LEU  53           H        LEU  53  -8.138   7.212 -12.159
    2    HA   LEU  53           HA       LEU  53 -10.623   5.881 -12.172
    3    HB2  LEU  53           HB2      LEU  53  -9.367   7.873 -14.048
    4    HB3  LEU  53           HB3      LEU  53 -10.957   7.185 -14.368
    5    HG   LEU  53           HG       LEU  53 -10.263   8.515 -11.730
    6   HD12  LEU  53          HD11      LEU  53 -11.518  10.486 -12.655
    7   HD11  LEU  53          HD12      LEU  53 -11.481   9.706 -14.237
    8   HD13  LEU  53          HD13      LEU  53  -9.979  10.195 -13.456
    9   HD21  LEU  53          HD21      LEU  53 -12.815   7.625 -13.088
   10   HD23  LEU  53          HD22      LEU  53 -12.837   8.877 -11.851
   11   HD22  LEU  53          HD23      LEU  53 -12.277   7.265 -11.453

  No H/Q in entry =          11
  In of MODEL   61
    1    H    VAL  54           H        VAL  54  -7.865   5.719 -14.403
    2    HA   VAL  54           HA       VAL  54  -9.056   3.924 -16.243
    3    HB   VAL  54           HB       VAL  54  -6.158   4.477 -15.556
    4   HG12  VAL  54          HG11      VAL  54  -5.889   3.388 -17.941
    5   HG11  VAL  54          HG12      VAL  54  -7.406   2.585 -17.538
    6   HG13  VAL  54          HG13      VAL  54  -5.989   2.356 -16.515
    7   HG22  VAL  54          HG21      VAL  54  -6.955   6.405 -16.609
    8   HG21  VAL  54          HG22      VAL  54  -8.133   5.520 -17.577
    9   HG23  VAL  54          HG23      VAL  54  -6.424   5.465 -18.003

  No H/Q in entry =           9
  In of MODEL   61
    1    H    GLN  55           H        GLN  55  -7.055   3.418 -13.337
    2    HA   GLN  55           HA       GLN  55  -6.922   0.602 -13.584
    3    HB2  GLN  55           HB2      GLN  55  -5.384   1.527 -12.064
    4    HB3  GLN  55           HB3      GLN  55  -6.617   2.477 -11.240
    5    HG2  GLN  55           HG2      GLN  55  -7.281   0.714  -9.918
    6    HG3  GLN  55           HG3      GLN  55  -7.035  -0.474 -11.192
    7   HE21  GLN  55          HE21      GLN  55  -5.391  -1.897 -10.689
    8   HE22  GLN  55          HE22      GLN  55  -4.014  -1.521  -9.776

  No H/Q in entry =           8
  In of MODEL   61
    1    H    THR  56           H        THR  56  -9.289   2.734 -11.982
    2    HA   THR  56           HA       THR  56 -10.848   0.831 -10.690
    3    HB   THR  56           HB       THR  56 -11.766   3.322 -12.157
    4    HG1  THR  56           HG1      THR  56 -10.201   3.326 -10.289
    5   HG23  THR  56          HG21      THR  56 -13.654   1.839 -11.775
    6   HG22  THR  56          HG22      THR  56 -13.730   3.169 -10.619
    7   HG21  THR  56          HG23      THR  56 -13.156   1.581 -10.104

  No H/Q in entry =           7
  In of MODEL   61
    1    H    LYS  57           H        LYS  57 -11.058   1.900 -14.080
    2    HA   LYS  57           HA       LYS  57 -13.187   0.178 -14.833
    3    HB2  LYS  57           HB2      LYS  57 -12.123   2.187 -16.091
    4    HB3  LYS  57           HB3      LYS  57 -10.920   1.030 -16.641
    5    HG2  LYS  57           HG2      LYS  57 -13.807   0.325 -16.969
    6    HG3  LYS  57           HG3      LYS  57 -13.112   1.511 -18.066
    7    HD2  LYS  57           HD2      LYS  57 -11.330  -0.101 -18.672
    8    HD3  LYS  57           HD3      LYS  57 -12.048  -1.295 -17.594
    9    HE2  LYS  57           HE2      LYS  57 -14.139  -1.241 -18.922
   10    HE3  LYS  57           HE3      LYS  57 -13.426  -0.053 -20.011
   11    HZ2  LYS  57           HZ1      LYS  57 -12.694  -2.884 -19.635
   12    HZ1  LYS  57           HZ2      LYS  57 -11.585  -1.778 -20.296
   13    HZ3  LYS  57           HZ3      LYS  57 -13.071  -2.063 -21.070

  No H/Q in entry =          13
  In of MODEL   61
    1    H    LEU  58           H        LEU  58  -9.677  -0.200 -14.766
    2    HA   LEU  58           HA       LEU  58  -9.643  -2.722 -16.045
    3    HB2  LEU  58           HB2      LEU  58  -7.633  -1.393 -14.237
    4    HB3  LEU  58           HB3      LEU  58  -7.348  -2.913 -15.085
    5    HG   LEU  58           HG       LEU  58  -8.137  -0.326 -16.460
    6   HD11  LEU  58          HD11      LEU  58  -5.474  -1.520 -15.758
    7   HD13  LEU  58          HD12      LEU  58  -5.995   0.164 -15.716
    8   HD12  LEU  58          HD13      LEU  58  -5.640  -0.608 -17.259
    9   HD22  LEU  58          HD21      LEU  58  -8.685  -1.902 -18.046
   10   HD21  LEU  58          HD22      LEU  58  -7.627  -3.131 -17.357
   11   HD23  LEU  58          HD23      LEU  58  -6.953  -1.851 -18.366

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  59           H        ILE  59 -10.487  -1.820 -12.800
    2    HA   ILE  59           HA       ILE  59 -10.096  -4.578 -11.841
    3    HB   ILE  59           HB       ILE  59  -9.682  -2.308 -10.446
    4   HG12  ILE  59          HG12      ILE  59 -11.051  -4.653  -9.114
    5   HG13  ILE  59          HG13      ILE  59  -9.408  -4.738  -9.697
    6   HG23  ILE  59          HG21      ILE  59 -11.523  -1.593  -9.178
    7   HG22  ILE  59          HG22      ILE  59 -12.439  -3.050  -9.486
    8   HG21  ILE  59          HG23      ILE  59 -12.244  -1.838 -10.750
    9   HD12  ILE  59          HD11      ILE  59  -9.616  -4.106  -7.272
   10   HD11  ILE  59          HD12      ILE  59 -10.366  -2.605  -7.796
   11   HD13  ILE  59          HD13      ILE  59  -8.696  -2.959  -8.241

  No H/Q in entry =          11
  In of MODEL   61
    1    H    GLU  60           H        GLU  60 -12.687  -2.305 -12.664
    2    HA   GLU  60           HA       GLU  60 -14.851  -3.851 -11.651
    3    HB2  GLU  60           HB2      GLU  60 -15.098  -1.485 -12.256
    4    HB3  GLU  60           HB3      GLU  60 -14.767  -1.866 -13.942
    5    HG2  GLU  60           HG2      GLU  60 -16.780  -3.337 -13.976
    6    HG3  GLU  60           HG3      GLU  60 -17.132  -2.852 -12.330

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLY  61           H        GLY  61 -13.170  -3.821 -14.762
    2    HA3  GLY  61           HA2      GLY  61 -14.845  -6.096 -15.648
    3    HA2  GLY  61           HA3      GLY  61 -14.015  -4.982 -16.728

  No H/Q in entry =           3
  In of MODEL   61
    1    H    ASP  62           H        ASP  62 -12.624  -6.396 -13.835
    2    HA   ASP  62           HA       ASP  62 -10.311  -7.288 -15.226
    3    HB2  ASP  62           HB2      ASP  62  -9.697  -8.246 -13.024
    4    HB3  ASP  62           HB3      ASP  62 -10.224  -6.572 -12.897

  No H/Q in entry =           4
  In of MODEL   61
    1    H    ALA  63           H        ALA  63 -13.283  -8.955 -14.205
    2    HA   ALA  63           HA       ALA  63 -12.452 -11.637 -14.449
    3    HB1  ALA  63           HB1      ALA  63 -14.868 -12.091 -14.918
    4    HB3  ALA  63           HB2      ALA  63 -15.130 -10.358 -15.109
    5    HB2  ALA  63           HB3      ALA  63 -14.647 -11.011 -13.542

  No H/Q in entry =           5
  In of MODEL   61
    1    H    GLY  64           H        GLY  64 -13.140  -9.206 -16.817
    2    HA3  GLY  64           HA2      GLY  64 -12.869  -9.134 -19.093
    3    HA2  GLY  64           HA3      GLY  64 -11.940 -10.620 -18.958

  No H/Q in entry =           3
  In of MODEL   61
    1    H    GLU  65           H        GLU  65 -12.755 -12.181 -20.215
    2    HA   GLU  65           HA       GLU  65 -15.076 -12.206 -21.598
    3    HB2  GLU  65           HB2      GLU  65 -13.650 -14.575 -20.393
    4    HB3  GLU  65           HB3      GLU  65 -14.945 -14.713 -21.582
    5    HG2  GLU  65           HG2      GLU  65 -13.666 -13.392 -23.186
    6    HG3  GLU  65           HG3      GLU  65 -12.392 -13.135 -21.995

  No H/Q in entry =           6
  In of MODEL   61
    1    H    GLY  66           H        GLY  66 -14.828 -14.331 -18.820
    2    HA3  GLY  66           HA2      GLY  66 -17.155 -13.419 -17.475
    3    HA2  GLY  66           HA3      GLY  66 -17.507 -14.860 -18.410

  No H/Q in entry =           3
  In of MODEL   61
    1    H    LYS  67           H        LYS  67 -14.326 -14.856 -17.383
    2    HA   LYS  67           HA       LYS  67 -14.879 -16.935 -15.434
    3    HB2  LYS  67           HB2      LYS  67 -12.503 -17.449 -15.629
    4    HB3  LYS  67           HB3      LYS  67 -13.243 -17.305 -17.229
    5    HG2  LYS  67           HG2      LYS  67 -12.479 -14.942 -17.348
    6    HG3  LYS  67           HG3      LYS  67 -11.687 -15.137 -15.787
    7    HD2  LYS  67           HD2      LYS  67 -10.243 -16.898 -16.724
    8    HD3  LYS  67           HD3      LYS  67 -11.047 -16.727 -18.287
    9    HE2  LYS  67           HE2      LYS  67  -8.953 -15.441 -18.279
   10    HE3  LYS  67           HE3      LYS  67 -10.336 -14.349 -18.377
   11    HZ3  LYS  67           HZ1      LYS  67  -8.778 -13.547 -16.752
   12    HZ2  LYS  67           HZ2      LYS  67  -8.798 -15.033 -15.931
   13    HZ1  LYS  67           HZ3      LYS  67 -10.187 -14.057 -15.959

  No H/Q in entry =          13
  In of MODEL   61
    1    H    MET  68           H        MET  68 -13.869 -17.124 -13.441
    2    HA   MET  68           HA       MET  68 -14.142 -14.913 -11.737
    3    HB2  MET  68           HB2      MET  68 -12.762 -17.562 -11.294
    4    HB3  MET  68           HB3      MET  68 -13.182 -16.416 -10.020
    5    HG2  MET  68           HG2      MET  68 -15.162 -17.685 -11.935
    6    HG3  MET  68           HG3      MET  68 -14.897 -18.193 -10.265
    7    HE3  MET  68           HE1      MET  68 -16.222 -15.672  -8.024
    8    HE2  MET  68           HE2      MET  68 -14.610 -15.265  -8.610
    9    HE1  MET  68           HE3      MET  68 -15.051 -16.954  -8.366

  No H/Q in entry =           9
  In of MODEL   61
    1    H    LYS  69           H        LYS  69 -11.163 -16.364 -13.088
    2    HA   LYS  69           HA       LYS  69  -9.342 -14.962 -11.498
    3    HB2  LYS  69           HB2      LYS  69  -8.767 -16.934 -12.841
    4    HB3  LYS  69           HB3      LYS  69  -8.929 -15.976 -14.314
    5    HG2  LYS  69           HG2      LYS  69  -7.147 -14.466 -13.555
    6    HG3  LYS  69           HG3      LYS  69  -7.006 -15.368 -12.048
    7    HD2  LYS  69           HD2      LYS  69  -6.357 -17.386 -13.317
    8    HD3  LYS  69           HD3      LYS  69  -6.483 -16.475 -14.822
    9    HE2  LYS  69           HE2      LYS  69  -4.181 -16.370 -14.297
   10    HE3  LYS  69           HE3      LYS  69  -4.812 -14.826 -13.731
   11    HZ2  LYS  69           HZ1      LYS  69  -3.330 -16.317 -12.201
   12    HZ1  LYS  69           HZ2      LYS  69  -4.804 -17.095 -11.878
   13    HZ3  LYS  69           HZ3      LYS  69  -4.627 -15.435 -11.559

  No H/Q in entry =          13
  In of MODEL   61
    1    H    VAL  70           H        VAL  70  -7.950 -13.191 -11.818
    2    HA   VAL  70           HA       VAL  70  -8.987 -11.113 -13.664
    3    HB   VAL  70           HB       VAL  70  -8.061  -9.495 -12.034
    4   HG12  VAL  70          HG11      VAL  70  -9.912 -11.542 -10.776
    5   HG11  VAL  70          HG12      VAL  70 -10.423 -10.276 -11.893
    6   HG13  VAL  70          HG13      VAL  70  -9.770  -9.847 -10.313
    7   HG22  VAL  70          HG21      VAL  70  -6.261 -10.872 -11.079
    8   HG21  VAL  70          HG22      VAL  70  -7.449 -12.001 -10.431
    9   HG23  VAL  70          HG23      VAL  70  -7.347 -10.363  -9.786

  No H/Q in entry =           9
  In of MODEL   61
    1    H    SER  71           H        SER  71  -7.362  -9.593 -14.458
    2    HA   SER  71           HA       SER  71  -5.139 -10.867 -15.673
    3    HB2  SER  71           HB2      SER  71  -6.246  -8.851 -16.611
    4    HB3  SER  71           HB3      SER  71  -5.643  -7.908 -15.250
    5    HG   SER  71           HG       SER  71  -4.101  -9.328 -17.170

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LEU  72           H        LEU  72  -3.099 -11.101 -15.041
    2    HA   LEU  72           HA       LEU  72  -2.390 -10.865 -12.328
    3    HB2  LEU  72           HB2      LEU  72  -0.719 -11.276 -14.804
    4    HB3  LEU  72           HB3      LEU  72  -0.066 -11.339 -13.170
    5    HG   LEU  72           HG       LEU  72  -2.394 -13.061 -14.078
    6   HD13  LEU  72          HD11      LEU  72  -0.841 -14.847 -14.471
    7   HD12  LEU  72          HD12      LEU  72   0.499 -13.907 -13.817
    8   HD11  LEU  72          HD13      LEU  72  -0.227 -13.451 -15.358
    9   HD23  LEU  72          HD21      LEU  72  -1.392 -14.463 -12.112
   10   HD22  LEU  72          HD22      LEU  72  -2.372 -13.063 -11.704
   11   HD21  LEU  72          HD23      LEU  72  -0.615 -12.956 -11.640

  No H/Q in entry =          11
  In of MODEL   61
    1    H    VAL  73           H        VAL  73  -1.695  -8.850 -15.115
    2    HA   VAL  73           HA       VAL  73   0.198  -7.119 -14.014
    3    HB   VAL  73           HB       VAL  73  -0.206  -5.718 -15.879
    4   HG11  VAL  73          HG11      VAL  73   0.588  -8.125 -16.282
    5   HG13  VAL  73          HG12      VAL  73  -0.058  -7.266 -17.680
    6   HG12  VAL  73          HG13      VAL  73  -1.051  -8.456 -16.841
    7   HG21  VAL  73          HG21      VAL  73  -2.960  -6.888 -15.704
    8   HG23  VAL  73          HG22      VAL  73  -2.372  -6.340 -17.273
    9   HG22  VAL  73          HG23      VAL  73  -2.473  -5.207 -15.925

  No H/Q in entry =           9
  In of MODEL   61
    1    H    LEU  74           H        LEU  74  -3.199  -7.282 -13.465
    2    HA   LEU  74           HA       LEU  74  -3.857  -4.632 -12.865
    3    HB2  LEU  74           HB2      LEU  74  -5.560  -6.326 -13.037
    4    HB3  LEU  74           HB3      LEU  74  -4.861  -7.230 -11.697
    5    HG   LEU  74           HG       LEU  74  -5.356  -5.346 -10.171
    6   HD13  LEU  74          HD11      LEU  74  -5.283  -3.417 -11.536
    7   HD12  LEU  74          HD12      LEU  74  -6.996  -3.612 -11.173
    8   HD11  LEU  74          HD13      LEU  74  -6.363  -4.122 -12.739
    9   HD23  LEU  74          HD21      LEU  74  -7.896  -5.845 -11.638
   10   HD22  LEU  74          HD22      LEU  74  -7.536  -5.944  -9.927
   11   HD21  LEU  74          HD23      LEU  74  -7.019  -7.228 -10.993

  No H/Q in entry =          11
  In of MODEL   61
    1    H    VAL  75           H        VAL  75  -2.786  -7.195 -10.690
    2    HA   VAL  75           HA       VAL  75  -2.616  -5.631  -8.352
    3    HB   VAL  75           HB       VAL  75  -1.080  -8.107  -9.127
    4   HG12  VAL  75          HG11      VAL  75  -0.640  -8.243  -6.645
    5   HG11  VAL  75          HG12      VAL  75  -1.324  -6.633  -6.480
    6   HG13  VAL  75          HG13      VAL  75   0.151  -6.863  -7.402
    7   HG23  VAL  75          HG21      VAL  75  -2.727  -9.129  -7.529
    8   HG22  VAL  75          HG22      VAL  75  -3.493  -8.448  -8.964
    9   HG21  VAL  75          HG23      VAL  75  -3.547  -7.570  -7.433

  No H/Q in entry =           9
  In of MODEL   61
    1    H    GLU  76           H        GLU  76  -0.189  -6.368 -10.878
    2    HA   GLU  76           HA       GLU  76   1.974  -4.984  -9.721
    3    HB2  GLU  76           HB2      GLU  76   2.188  -6.469 -11.703
    4    HB3  GLU  76           HB3      GLU  76   1.285  -5.309 -12.664
    5    HG2  GLU  76           HG2      GLU  76   3.626  -4.971 -13.137
    6    HG3  GLU  76           HG3      GLU  76   3.099  -3.602 -12.177

  No H/Q in entry =           6
  In of MODEL   61
    1    H    ALA  77           H        ALA  77  -0.569  -3.828 -11.921
    2    HA   ALA  77           HA       ALA  77   0.384  -1.169 -12.105
    3    HB1  ALA  77           HB1      ALA  77  -1.284  -2.127 -13.658
    4    HB2  ALA  77           HB2      ALA  77  -1.865  -0.631 -12.927
    5    HB3  ALA  77           HB3      ALA  77  -2.462  -2.185 -12.346

  No H/Q in entry =           5
  In of MODEL   61
    1    H    GLN  78           H        GLN  78  -1.868  -2.748  -9.895
    2    HA   GLN  78           HA       GLN  78  -2.713  -0.436  -8.506
    3    HB2  GLN  78           HB2      GLN  78  -3.792  -2.709  -8.413
    4    HB3  GLN  78           HB3      GLN  78  -2.449  -3.248  -7.408
    5    HG2  GLN  78           HG2      GLN  78  -2.991  -1.515  -5.748
    6    HG3  GLN  78           HG3      GLN  78  -4.334  -0.967  -6.752
    7   HE21  GLN  78          HE21      GLN  78  -4.792  -1.942  -4.097
    8   HE22  GLN  78          HE22      GLN  78  -5.636  -3.411  -4.208

  No H/Q in entry =           8
  In of MODEL   61
    1    H    LEU  79           H        LEU  79  -0.003  -2.650  -8.038
    2    HA   LEU  79           HA       LEU  79   0.952  -1.728  -5.582
    3    HB2  LEU  79           HB2      LEU  79   1.856  -3.728  -6.638
    4    HB3  LEU  79           HB3      LEU  79   2.491  -2.772  -7.974
    5    HG   LEU  79           HG       LEU  79   4.025  -1.604  -6.470
    6   HD13  LEU  79          HD11      LEU  79   3.011  -1.365  -4.407
    7   HD12  LEU  79          HD12      LEU  79   4.109  -2.697  -4.054
    8   HD11  LEU  79          HD13      LEU  79   2.409  -3.023  -4.388
    9   HD23  LEU  79          HD21      LEU  79   5.266  -3.729  -5.554
   10   HD22  LEU  79          HD22      LEU  79   5.064  -3.541  -7.294
   11   HD21  LEU  79          HD23      LEU  79   4.000  -4.623  -6.400

  No H/Q in entry =          11
  In of MODEL   61
    1    H    HIS  80           H        HIS  80   1.815  -0.612  -8.856
    2    HA   HIS  80           HA       HIS  80   3.589   1.407  -7.937
    3    HB2  HIS  80           HB2      HIS  80   2.319   0.682 -10.521
    4    HB3  HIS  80           HB3      HIS  80   2.887   2.344 -10.355
    5    HD1  HIS  80           HD1      HIS  80   5.285   2.680 -10.871
    6    HD2  HIS  80           HD2      HIS  80   4.524  -1.238  -9.666
    7    HE1  HIS  80           HE1      HIS  80   7.496   1.437 -11.025
    8    HE2  HIS  80           HE2      HIS  80   7.042  -0.955 -10.294

  No H/Q in entry =           8
  In of MODEL   61
    1    H    LEU  81           H        LEU  81   0.186   1.509  -8.928
    2    HA   LEU  81           HA       LEU  81  -0.134   4.299  -8.610
    3    HB2  LEU  81           HB2      LEU  81  -2.113   2.022  -8.527
    4    HB3  LEU  81           HB3      LEU  81  -2.593   3.717  -8.444
    5    HG   LEU  81           HG       LEU  81  -0.874   2.586 -10.670
    6   HD12  LEU  81          HD11      LEU  81  -3.107   2.864 -11.977
    7   HD11  LEU  81          HD12      LEU  81  -3.867   2.790 -10.388
    8   HD13  LEU  81          HD13      LEU  81  -2.900   1.436 -10.966
    9   HD23  LEU  81          HD21      LEU  81  -2.002   4.708 -11.779
   10   HD22  LEU  81          HD22      LEU  81  -0.592   4.905 -10.742
   11   HD21  LEU  81          HD23      LEU  81  -2.204   5.230 -10.109

  No H/Q in entry =          11
  In of MODEL   61
    1    H    MET  82           H        MET  82  -0.757   1.610  -6.352
    2    HA   MET  82           HA       MET  82  -1.842   3.188  -4.275
    3    HB2  MET  82           HB2      MET  82  -0.424   0.524  -4.299
    4    HB3  MET  82           HB3      MET  82  -1.019   1.245  -2.805
    5    HG2  MET  82           HG2      MET  82  -2.735   0.713  -5.250
    6    HG3  MET  82           HG3      MET  82  -2.644  -0.354  -3.850
    7    HE3  MET  82           HE1      MET  82  -4.403   1.278  -1.047
    8    HE2  MET  82           HE2      MET  82  -2.677   1.584  -1.228
    9    HE1  MET  82           HE3      MET  82  -3.338   0.014  -1.678

  No H/Q in entry =           9
  In of MODEL   61
    1    H    THR  83           H        THR  83   1.479   2.154  -4.949
    2    HA   THR  83           HA       THR  83   2.670   3.288  -2.649
    3    HB   THR  83           HB       THR  83   4.771   3.261  -4.116
    4    HG1  THR  83           HG1      THR  83   4.546   2.723  -6.139
    5   HG22  THR  83          HG21      THR  83   4.372   0.595  -4.439
    6   HG21  THR  83          HG22      THR  83   3.073   0.957  -3.304
    7   HG23  THR  83          HG23      THR  83   4.745   1.330  -2.881

  No H/Q in entry =           7
  In of MODEL   61
    1    H    SER  84           H        SER  84   2.289   4.548  -5.956
    2    HA   SER  84           HA       SER  84   3.586   7.012  -5.506
    3    HB2  SER  84           HB2      SER  84   1.537   6.137  -7.529
    4    HB3  SER  84           HB3      SER  84   2.188   7.775  -7.508
    5    HG   SER  84           HG       SER  84   3.602   5.322  -7.785

  No H/Q in entry =           5
  In of MODEL   61
    1    H    MET  85           H        MET  85   0.105   6.198  -5.343
    2    HA   MET  85           HA       MET  85  -0.802   8.796  -4.754
    3    HB2  MET  85           HB2      MET  85  -2.292   6.959  -5.421
    4    HB3  MET  85           HB3      MET  85  -1.995   6.164  -3.876
    5    HG2  MET  85           HG2      MET  85  -2.921   8.113  -2.684
    6    HG3  MET  85           HG3      MET  85  -3.196   8.927  -4.223
    7    HE3  MET  85           HE1      MET  85  -5.432   5.347  -2.444
    8    HE2  MET  85           HE2      MET  85  -4.734   6.687  -1.537
    9    HE1  MET  85           HE3      MET  85  -3.680   5.580  -2.410

  No H/Q in entry =           9
  In of MODEL   61
    1    H    LEU  86           H        LEU  86   0.155   6.157  -2.597
    2    HA   LEU  86           HA       LEU  86  -0.408   7.461  -0.162
    3    HB2  LEU  86           HB2      LEU  86   0.097   4.996  -0.545
    4    HB3  LEU  86           HB3      LEU  86   1.798   5.453  -0.636
    5    HG   LEU  86           HG       LEU  86   1.447   6.617   1.626
    6   HD11  LEU  86          HD11      LEU  86  -1.233   5.806   1.150
    7   HD13  LEU  86          HD12      LEU  86  -0.583   6.569   2.599
    8   HD12  LEU  86          HD13      LEU  86  -0.646   4.812   2.486
    9   HD23  LEU  86          HD21      LEU  86   1.066   3.619   1.759
   10   HD22  LEU  86          HD22      LEU  86   2.049   4.648   2.798
   11   HD21  LEU  86          HD23      LEU  86   2.560   4.325   1.142

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ALA  87           H        ALA  87   2.584   7.206  -2.041
    2    HA   ALA  87           HA       ALA  87   4.262   8.649  -0.316
    3    HB3  ALA  87           HB1      ALA  87   4.381   7.628  -3.019
    4    HB2  ALA  87           HB2      ALA  87   5.707   7.983  -1.916
    5    HB1  ALA  87           HB3      ALA  87   5.076   9.250  -2.966

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ARG  88           H        ARG  88   2.306   9.745  -3.047
    2    HA   ARG  88           HA       ARG  88   3.040  12.446  -2.937
    3    HB2  ARG  88           HB2      ARG  88   1.808  11.268  -4.794
    4    HB3  ARG  88           HB3      ARG  88   0.346  11.393  -3.816
    5    HG2  ARG  88           HG2      ARG  88   1.327  13.989  -3.739
    6    HG3  ARG  88           HG3      ARG  88   1.764  13.475  -5.367
    7    HD2  ARG  88           HD2      ARG  88  -0.376  13.521  -6.071
    8    HD3  ARG  88           HD3      ARG  88  -0.955  12.665  -4.641
    9    HE   ARG  88           HE       ARG  88  -1.184  15.438  -5.070
   10   HH21  ARG  88          HH11      ARG  88  -1.736  16.766  -3.339
   11   HH22  ARG  88          HH12      ARG  88  -1.437  16.239  -1.718
   12   HH11  ARG  88          HH21      ARG  88  -0.143  13.199  -2.685
   13   HH12  ARG  88          HH22      ARG  88  -0.552  14.213  -1.348

  No H/Q in entry =          13
  In of MODEL   61
    1    H    GLU  89           H        GLU  89   0.356  10.739  -1.299
    2    HA   GLU  89           HA       GLU  89  -0.788  13.039  -0.106
    3    HB2  GLU  89           HB2      GLU  89  -1.874  10.783  -0.188
    4    HB3  GLU  89           HB3      GLU  89  -0.746  10.248   1.058
    5    HG2  GLU  89           HG2      GLU  89  -1.595  11.941   2.609
    6    HG3  GLU  89           HG3      GLU  89  -2.653  12.592   1.360

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LEU  90           H        LEU  90   1.692  10.785   1.083
    2    HA   LEU  90           HA       LEU  90   2.023  12.043   3.609
    3    HB2  LEU  90           HB2      LEU  90   3.825  10.288   1.943
    4    HB3  LEU  90           HB3      LEU  90   4.232  10.816   3.581
    5    HG   LEU  90           HG       LEU  90   1.618   9.432   2.918
    6   HD12  LEU  90          HD11      LEU  90   2.784   7.406   3.936
    7   HD11  LEU  90          HD12      LEU  90   4.295   8.282   3.696
    8   HD13  LEU  90          HD13      LEU  90   3.292   7.856   2.308
    9   HD22  LEU  90          HD21      LEU  90   1.335  10.359   5.035
   10   HD21  LEU  90          HD22      LEU  90   3.053  10.277   5.423
   11   HD23  LEU  90          HD23      LEU  90   2.067   8.816   5.473

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  91           H        ILE  91   3.630  12.437   0.486
    2    HA   ILE  91           HA       ILE  91   5.579  14.298   1.324
    3    HB   ILE  91           HB       ILE  91   4.282  13.780  -1.357
    4   HG12  ILE  91          HG12      ILE  91   7.118  13.334  -0.374
    5   HG13  ILE  91          HG13      ILE  91   5.852  12.120  -0.211
    6   HG22  ILE  91          HG21      ILE  91   6.489  15.155  -2.045
    7   HG21  ILE  91          HG22      ILE  91   6.164  15.956  -0.507
    8   HG23  ILE  91          HG23      ILE  91   4.944  15.964  -1.779
    9   HD13  ILE  91          HD11      ILE  91   5.689  11.787  -2.517
   10   HD12  ILE  91          HD12      ILE  91   7.420  12.054  -2.300
   11   HD11  ILE  91          HD13      ILE  91   6.394  13.361  -2.893

  No H/Q in entry =          11
  In of MODEL   61
    1    H    THR  92           H        THR  92   2.215  14.682   0.306
    2    HA   THR  92           HA       THR  92   2.152  17.505   0.235
    3    HB   THR  92           HB       THR  92   0.008  15.484   0.935
    4    HG1  THR  92           HG1      THR  92   0.321  15.302  -1.148
    5   HG22  THR  92          HG21      THR  92  -1.418  17.625   0.202
    6   HG21  THR  92          HG22      THR  92  -0.039  18.471   0.900
    7   HG23  THR  92          HG23      THR  92  -0.968  17.341   1.883

  No H/Q in entry =           7
  In of MODEL   61
    1    H    GLU  93           H        GLU  93   1.626  15.206   2.896
    2    HA   GLU  93           HA       GLU  93   1.064  17.110   4.906
    3    HB2  GLU  93           HB2      GLU  93   2.411  14.403   5.155
    4    HB3  GLU  93           HB3      GLU  93   1.705  15.326   6.483
    5    HG2  GLU  93           HG2      GLU  93   0.109  14.519   4.042
    6    HG3  GLU  93           HG3      GLU  93   0.220  13.502   5.474

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LEU  94           H        LEU  94   4.092  15.663   3.770
    2    HA   LEU  94           HA       LEU  94   5.823  16.840   5.659
    3    HB2  LEU  94           HB2      LEU  94   6.245  15.868   2.832
    4    HB3  LEU  94           HB3      LEU  94   7.563  16.546   3.783
    5    HG   LEU  94           HG       LEU  94   5.848  14.332   4.921
    6   HD11  LEU  94          HD11      LEU  94   7.953  14.126   2.796
    7   HD13  LEU  94          HD12      LEU  94   6.519  13.134   3.057
    8   HD12  LEU  94          HD13      LEU  94   7.945  12.903   4.069
    9   HD23  LEU  94          HD21      LEU  94   8.042  13.827   6.081
   10   HD22  LEU  94          HD22      LEU  94   7.353  15.398   6.490
   11   HD21  LEU  94          HD23      LEU  94   8.697  15.291   5.352

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  95           H        ILE  95   4.677  17.986   2.502
    2    HA   ILE  95           HA       ILE  95   6.219  20.363   2.439
    3    HB   ILE  95           HB       ILE  95   3.588  19.641   1.128
    4   HG12  ILE  95          HG12      ILE  95   6.375  20.010  -0.002
    5   HG13  ILE  95          HG13      ILE  95   5.744  18.451   0.516
    6   HG21  ILE  95          HG21      ILE  95   5.306  22.130   0.904
    7   HG23  ILE  95          HG22      ILE  95   3.581  22.041   1.256
    8   HG22  ILE  95          HG23      ILE  95   4.174  21.642  -0.357
    9   HD13  ILE  95          HD11      ILE  95   4.190  18.349  -1.217
   10   HD12  ILE  95          HD12      ILE  95   5.531  19.182  -2.004
   11   HD11  ILE  95          HD13      ILE  95   4.145  20.101  -1.419

  No H/Q in entry =          11
  In of MODEL   61
    1    H    GLU  96           H        GLU  96   2.975  19.674   3.727
    2    HA   GLU  96           HA       GLU  96   2.319  22.315   4.467
    3    HB2  GLU  96           HB2      GLU  96   0.667  20.511   4.481
    4    HB3  GLU  96           HB3      GLU  96   1.536  19.699   5.781
    5    HG2  GLU  96           HG2      GLU  96   0.494  20.974   7.343
    6    HG3  GLU  96           HG3      GLU  96   1.013  22.452   6.543

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LEU  97           H        LEU  97   4.189  19.793   6.106
    2    HA   LEU  97           HA       LEU  97   4.523  21.155   8.574
    3    HB2  LEU  97           HB2      LEU  97   6.091  19.000   7.171
    4    HB3  LEU  97           HB3      LEU  97   6.668  19.698   8.682
    5    HG   LEU  97           HG       LEU  97   3.873  18.568   8.367
    6   HD12  LEU  97          HD11      LEU  97   4.835  16.572   9.590
    7   HD11  LEU  97          HD12      LEU  97   6.439  17.222   9.248
    8   HD13  LEU  97          HD13      LEU  97   5.379  16.746   7.921
    9   HD23  LEU  97          HD21      LEU  97   4.322  18.288  10.934
   10   HD22  LEU  97          HD22      LEU  97   3.924  19.893  10.323
   11   HD21  LEU  97          HD23      LEU  97   5.600  19.475  10.674

  No H/Q in entry =          11
  In of MODEL   61
    1    H    HIS  98           H        HIS  98   6.402  21.184   5.553
    2    HA   HIS  98           HA       HIS  98   8.533  22.793   6.453
    3    HB2  HIS  98           HB2      HIS  98   7.251  22.513   3.725
    4    HB3  HIS  98           HB3      HIS  98   8.678  23.510   4.016
    5    HD1  HIS  98           HD1      HIS  98   7.510  19.925   4.044
    6    HD2  HIS  98           HD2      HIS  98  11.064  22.066   4.472
    7    HE1  HIS  98           HE1      HIS  98   9.386  18.218   3.998
    8    HE2  HIS  98           HE2      HIS  98  11.555  19.501   4.259

  No H/Q in entry =           8
  In of MODEL   61
    1    H    GLU  99           H        GLU  99   5.305  23.584   5.266
    2    HA   GLU  99           HA       GLU  99   5.650  26.404   5.200
    3    HB2  GLU  99           HB2      GLU  99   3.789  25.208   4.067
    4    HB3  GLU  99           HB3      GLU  99   3.093  24.843   5.646
    5    HG2  GLU  99           HG2      GLU  99   2.882  27.235   6.138
    6    HG3  GLU  99           HG3      GLU  99   3.658  27.639   4.610

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LYS 100           H        LYS 100   4.539  24.163   7.726
    2    HA   LYS 100           HA       LYS 100   3.923  26.216   9.611
    3    HB2  LYS 100           HB2      LYS 100   4.533  23.273   9.968
    4    HB3  LYS 100           HB3      LYS 100   4.069  24.345  11.296
    5    HG2  LYS 100           HG2      LYS 100   1.999  24.954  10.040
    6    HG3  LYS 100           HG3      LYS 100   2.443  23.786   8.792
    7    HD2  LYS 100           HD2      LYS 100   2.383  21.970  10.459
    8    HD3  LYS 100           HD3      LYS 100   1.955  23.132  11.718
    9    HE2  LYS 100           HE2      LYS 100  -0.101  23.724  10.447
   10    HE3  LYS 100           HE3      LYS 100   0.316  22.505   9.236
   11    HZ1  LYS 100           HZ1      LYS 100   0.050  21.845  12.119
   12    HZ3  LYS 100           HZ2      LYS 100   0.051  20.787  10.787
   13    HZ2  LYS 100           HZ3      LYS 100  -1.277  21.811  11.060

  No H/Q in entry =          13
  In of MODEL   61
    1    H    LEU 101           H        LEU 101   6.870  24.453   8.791
    2    HA   LEU 101           HA       LEU 101   8.452  25.319  10.997
    3    HB2  LEU 101           HB2      LEU 101   9.066  24.330   8.224
    4    HB3  LEU 101           HB3      LEU 101  10.357  25.014   9.207
    5    HG   LEU 101           HG       LEU 101   8.548  22.840  10.272
    6   HD12  LEU 101          HD11      LEU 101  10.621  21.367   9.675
    7   HD11  LEU 101          HD12      LEU 101  10.976  22.630   8.499
    8   HD13  LEU 101          HD13      LEU 101   9.458  21.739   8.404
    9   HD21  LEU 101          HD21      LEU 101  11.257  23.982  11.004
   10   HD23  LEU 101          HD22      LEU 101  10.730  22.405  11.588
   11   HD22  LEU 101          HD23      LEU 101   9.820  23.852  12.018

  No H/Q in entry =          11
  In of MODEL   61
    1    H    LYS 102           H        LYS 102   6.854  27.157   8.845
    2    HA   LYS 102           HA       LYS 102   6.906  29.449   8.546
    3    HB2  LYS 102           HB2      LYS 102   8.465  29.359  10.649
    4    HB3  LYS 102           HB3      LYS 102   9.766  29.565   9.493
    5    HG2  LYS 102           HG2      LYS 102   7.635  31.496  10.342
    6    HG3  LYS 102           HG3      LYS 102   9.346  31.775  10.095
    7    HD2  LYS 102           HD2      LYS 102   7.406  31.322   7.791
    8    HD3  LYS 102           HD3      LYS 102   7.769  32.908   8.455
    9    HE2  LYS 102           HE2      LYS 102   9.162  31.732   6.390
   10    HE3  LYS 102           HE3      LYS 102   9.760  33.049   7.398
   11    HZ2  LYS 102           HZ1      LYS 102  11.303  31.162   7.234
   12    HZ1  LYS 102           HZ2      LYS 102  10.150  30.168   7.976
   13    HZ3  LYS 102           HZ3      LYS 102  10.825  31.466   8.833

  No H/Q in entry =          13
  In of MODEL   61
    1    H    ALA 103           H        ALA 103  10.179  28.146   7.995
    2    HA   ALA 103           HA       ALA 103  11.133  29.526   5.918
    3    HB2  ALA 103           HB1      ALA 103  12.046  27.319   5.000
    4    HB1  ALA 103           HB2      ALA 103  11.156  26.539   6.306
    5    HB3  ALA 103           HB3      ALA 103  12.432  27.699   6.679

  No H/Q in entry =           5
  In of MODEL   61
    1    H1   LYS   3           H1       LYS   3 -30.987   6.611 -19.544
    2    H2   LYS   3           H3       LYS   3 -30.011   6.313 -20.900
    3    H3   LYS   3           H2       LYS   3 -31.423   5.403 -20.654
    4    HA   LYS   3           HA       LYS   3 -30.444   3.982 -19.266
    5    HB2  LYS   3           HB2      LYS   3 -28.139   5.357 -20.597
    6    HB3  LYS   3           HB3      LYS   3 -27.835   4.133 -19.365
    7    HG2  LYS   3           HG2      LYS   3 -29.296   2.587 -20.721
    8    HG3  LYS   3           HG3      LYS   3 -29.230   3.797 -22.003
    9    HD2  LYS   3           HD2      LYS   3 -26.750   3.631 -21.964
   10    HD3  LYS   3           HD3      LYS   3 -26.892   2.325 -20.788
   11    HE2  LYS   3           HE2      LYS   3 -28.422   1.195 -22.506
   12    HE3  LYS   3           HE3      LYS   3 -27.782   2.369 -23.655
   13    HZ3  LYS   3           HZ1      LYS   3 -26.012   1.106 -23.942
   14    HZ2  LYS   3           HZ2      LYS   3 -26.662  -0.057 -22.890
   15    HZ1  LYS   3           HZ3      LYS   3 -25.644   1.160 -22.286

  No H/Q in entry =          15
  In of MODEL   61
    1    H    LYS   4           H        LYS   4 -30.492   3.825 -17.205
    2    HA   LYS   4           HA       LYS   4 -29.705   6.081 -15.540
    3    HB2  LYS   4           HB2      LYS   4 -30.962   3.410 -14.857
    4    HB3  LYS   4           HB3      LYS   4 -30.707   4.734 -13.722
    5    HG2  LYS   4           HG2      LYS   4 -32.526   4.731 -16.135
    6    HG3  LYS   4           HG3      LYS   4 -33.008   4.779 -14.440
    7    HD2  LYS   4           HD2      LYS   4 -32.261   6.983 -14.159
    8    HD3  LYS   4           HD3      LYS   4 -31.230   6.913 -15.587
    9    HE2  LYS   4           HE2      LYS   4 -33.126   8.333 -16.030
   10    HE3  LYS   4           HE3      LYS   4 -33.243   6.871 -17.010
   11    HZ3  LYS   4           HZ1      LYS   4 -34.832   5.981 -15.464
   12    HZ2  LYS   4           HZ2      LYS   4 -35.356   7.494 -16.033
   13    HZ1  LYS   4           HZ3      LYS   4 -34.696   7.355 -14.474

  No H/Q in entry =          13
  In of MODEL   61
    1    H    HIS   5           H        HIS   5 -28.228   6.121 -13.955
    2    HA   HIS   5           HA       HIS   5 -25.989   4.242 -14.311
    3    HB2  HIS   5           HB2      HIS   5 -26.175   6.992 -13.082
    4    HB3  HIS   5           HB3      HIS   5 -24.716   6.004 -13.079
    5    HD1  HIS   5           HD1      HIS   5 -23.226   7.182 -14.666
    6    HD2  HIS   5           HD2      HIS   5 -27.047   6.662 -16.208
    7    HE1  HIS   5           HE1      HIS   5 -23.055   7.778 -17.112
    8    HE2  HIS   5           HE2      HIS   5 -25.385   7.448 -18.021

  No H/Q in entry =           8
  In of MODEL   61
    1    H    ILE   6           H        ILE   6 -25.792   2.654 -13.007
    2    HA   ILE   6           HA       ILE   6 -26.749   2.923 -10.237
    3    HB   ILE   6           HB       ILE   6 -25.990   0.450 -11.798
    4   HG12  ILE   6          HG12      ILE   6 -28.706   1.444 -10.928
    5   HG13  ILE   6          HG13      ILE   6 -28.067   1.604 -12.563
    6   HG23  ILE   6          HG21      ILE   6 -26.385  -0.808  -9.946
    7   HG22  ILE   6          HG22      ILE   6 -27.511   0.359  -9.253
    8   HG21  ILE   6          HG23      ILE   6 -25.774   0.653  -9.168
    9   HD13  ILE   6          HD11      ILE   6 -28.579  -0.499 -13.078
   10   HD12  ILE   6          HD12      ILE   6 -29.588  -0.470 -11.631
   11   HD11  ILE   6          HD13      ILE   6 -27.949  -1.118 -11.551

  No H/Q in entry =          11
  In of MODEL   61
    1    H    TYR   7           H        TYR   7 -24.970   3.511  -8.953
    2    HA   TYR   7           HA       TYR   7 -22.286   2.494  -9.652
    3    HB2  TYR   7           HB2      TYR   7 -23.184   4.938  -8.148
    4    HB3  TYR   7           HB3      TYR   7 -21.512   4.383  -8.198
    5    HD1  TYR   7           HD1      TYR   7 -22.588   3.491 -11.292
    6    HD2  TYR   7           HD2      TYR   7 -21.821   7.028  -9.040
    7    HE1  TYR   7           HE1      TYR   7 -22.135   4.727 -13.374
    8    HE2  TYR   7           HE2      TYR   7 -21.410   8.269 -11.115
    9    HH   TYR   7           HH       TYR   7 -21.640   8.206 -13.346

  No H/Q in entry =           9
  In of MODEL   61
    1    H    LEU   8           H        LEU   8 -21.347   1.108  -8.339
    2    HA   LEU   8           HA       LEU   8 -22.478   0.619  -5.654
    3    HB2  LEU   8           HB2      LEU   8 -20.824  -1.070  -7.509
    4    HB3  LEU   8           HB3      LEU   8 -21.012  -1.461  -5.800
    5    HG   LEU   8           HG       LEU   8 -23.498  -1.570  -6.212
    6   HD13  LEU   8          HD11      LEU   8 -23.607  -0.334  -8.312
    7   HD12  LEU   8          HD12      LEU   8 -24.178  -1.982  -8.563
    8   HD11  LEU   8          HD13      LEU   8 -22.561  -1.520  -9.091
    9   HD23  LEU   8          HD21      LEU   8 -22.281  -3.628  -7.928
   10   HD22  LEU   8          HD22      LEU   8 -23.366  -3.780  -6.547
   11   HD21  LEU   8          HD23      LEU   8 -21.650  -3.471  -6.289

  No H/Q in entry =          11
  In of MODEL   61
    1    H    PHE   9           H        PHE   9 -21.184   0.978  -3.867
    2    HA   PHE   9           HA       PHE   9 -18.380   1.844  -4.399
    3    HB2  PHE   9           HB2      PHE   9 -20.347   2.940  -2.392
    4    HB3  PHE   9           HB3      PHE   9 -18.630   3.320  -2.399
    5    HD1  PHE   9           HD1      PHE   9 -17.634   4.639  -4.195
    6    HD2  PHE   9           HD2      PHE   9 -21.842   3.802  -4.130
    7    HE1  PHE   9           HE1      PHE   9 -18.004   6.363  -5.935
    8    HE2  PHE   9           HE2      PHE   9 -22.213   5.537  -5.865
    9    HZ   PHE   9           HZ       PHE   9 -20.292   6.813  -6.774

  No H/Q in entry =           9
  In of MODEL   61
    1    H    SER  10           H        SER  10 -16.817   0.819  -3.348
    2    HA   SER  10           HA       SER  10 -16.991  -0.098  -0.656
    3    HB2  SER  10           HB2      SER  10 -18.265  -1.927  -1.718
    4    HB3  SER  10           HB3      SER  10 -16.925  -2.204  -2.819
    5    HG   SER  10           HG       SER  10 -16.970  -2.479  -0.002

  No H/Q in entry =           5
  In of MODEL   61
    1    H    SER  11           H        SER  11 -14.968   0.046   0.129
    2    HA   SER  11           HA       SER  11 -12.796   0.852  -1.434
    3    HB2  SER  11           HB2      SER  11 -11.491   0.689   0.546
    4    HB3  SER  11           HB3      SER  11 -13.117   1.161   1.044
    5    HG   SER  11           HG       SER  11 -11.691  -1.092   1.608

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ALA  12           H        ALA  12 -14.050  -1.848  -2.198
    2    HA   ALA  12           HA       ALA  12 -11.491  -3.118  -2.776
    3    HB2  ALA  12           HB1      ALA  12 -11.948  -5.220  -1.861
    4    HB1  ALA  12           HB2      ALA  12 -13.670  -4.883  -1.691
    5    HB3  ALA  12           HB3      ALA  12 -12.512  -4.110  -0.609

  No H/Q in entry =           5
  In of MODEL   61
    1    H    GLY  13           H        GLY  13 -12.238  -2.136  -4.802
    2    HA3  GLY  13           HA2      GLY  13 -14.513  -2.765  -6.247
    3    HA2  GLY  13           HA3      GLY  13 -12.953  -2.381  -6.987

  No H/Q in entry =           3
  In of MODEL   61
    1    H    MET  14           H        MET  14 -11.521  -4.709  -6.047
    2    HA   MET  14           HA       MET  14 -11.983  -6.463  -8.136
    3    HB2  MET  14           HB2      MET  14  -9.928  -6.622  -6.838
    4    HB3  MET  14           HB3      MET  14 -10.812  -7.224  -5.438
    5    HG2  MET  14           HG2      MET  14 -11.494  -9.218  -6.744
    6    HG3  MET  14           HG3      MET  14 -10.600  -8.607  -8.137
    7    HE2  MET  14           HE1      MET  14  -7.801  -7.448  -6.969
    8    HE1  MET  14           HE2      MET  14  -8.368  -8.292  -8.409
    9    HE3  MET  14           HE3      MET  14  -7.025  -8.954  -7.481

  No H/Q in entry =           9
  In of MODEL   61
    1    H    SER  15           H        SER  15 -13.204  -6.950  -4.809
    2    HA   SER  15           HA       SER  15 -14.652  -9.317  -5.585
    3    HB2  SER  15           HB2      SER  15 -14.159  -9.255  -3.267
    4    HB3  SER  15           HB3      SER  15 -14.769  -7.611  -3.101
    5    HG   SER  15           HG       SER  15 -16.090  -9.871  -2.742

  No H/Q in entry =           5
  In of MODEL   61
    1    H    THR  16           H        THR  16 -15.601  -5.907  -5.088
    2    HA   THR  16           HA       THR  16 -18.414  -6.284  -5.580
    3    HB   THR  16           HB       THR  16 -16.763  -3.789  -6.105
    4    HG1  THR  16           HG1      THR  16 -16.440  -3.700  -4.060
    5   HG23  THR  16          HG21      THR  16 -18.840  -2.632  -5.648
    6   HG22  THR  16          HG22      THR  16 -19.638  -4.152  -5.206
    7   HG21  THR  16          HG23      THR  16 -19.145  -3.852  -6.878

  No H/Q in entry =           7
  In of MODEL   61
    1    H    SER  17           H        SER  17 -15.597  -5.793  -7.462
    2    HA   SER  17           HA       SER  17 -16.714  -5.006  -9.954
    3    HB2  SER  17           HB2      SER  17 -14.116  -6.393  -9.270
    4    HB3  SER  17           HB3      SER  17 -14.551  -5.936 -10.916
    5    HG   SER  17           HG       SER  17 -13.572  -4.419  -8.912

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LEU  18           H        LEU  18 -16.216  -8.175  -8.532
    2    HA   LEU  18           HA       LEU  18 -16.845  -9.642 -10.896
    3    HB2  LEU  18           HB2      LEU  18 -15.643 -10.660  -9.021
    4    HB3  LEU  18           HB3      LEU  18 -17.045 -10.415  -7.981
    5    HG   LEU  18           HG       LEU  18 -18.353 -11.889  -9.536
    6   HD13  LEU  18          HD11      LEU  18 -17.139 -11.820 -11.559
    7   HD12  LEU  18          HD12      LEU  18 -16.819 -13.430 -10.915
    8   HD11  LEU  18          HD13      LEU  18 -15.610 -12.159 -10.749
    9   HD21  LEU  18          HD21      LEU  18 -17.314 -12.610  -7.396
   10   HD23  LEU  18          HD22      LEU  18 -15.950 -13.220  -8.334
   11   HD22  LEU  18          HD23      LEU  18 -17.560 -13.898  -8.576

  No H/Q in entry =          11
  In of MODEL   61
    1    H    LEU  19           H        LEU  19 -18.776  -8.409  -8.170
    2    HA   LEU  19           HA       LEU  19 -21.269  -9.528  -9.003
    3    HB2  LEU  19           HB2      LEU  19 -20.975  -8.719  -6.746
    4    HB3  LEU  19           HB3      LEU  19 -20.652  -7.091  -7.340
    5    HG   LEU  19           HG       LEU  19 -22.971  -6.845  -8.017
    6   HD11  LEU  19          HD11      LEU  19 -23.302  -9.645  -6.926
    7   HD13  LEU  19          HD12      LEU  19 -23.483  -9.151  -8.609
    8   HD12  LEU  19          HD13      LEU  19 -24.624  -8.576  -7.396
    9   HD21  LEU  19          HD21      LEU  19 -22.301  -7.633  -5.221
   10   HD23  LEU  19          HD22      LEU  19 -23.963  -7.214  -5.637
   11   HD22  LEU  19          HD23      LEU  19 -22.669  -6.042  -5.887

  No H/Q in entry =          11
  In of MODEL   61
    1    H    VAL  20           H        VAL  20 -19.702  -6.398  -9.679
    2    HA   VAL  20           HA       VAL  20 -21.794  -5.296 -11.233
    3    HB   VAL  20           HB       VAL  20 -18.792  -4.774 -11.393
    4   HG11  VAL  20          HG11      VAL  20 -21.081  -3.256 -12.673
    5   HG13  VAL  20          HG12      VAL  20 -19.819  -4.148 -13.521
    6   HG12  VAL  20          HG13      VAL  20 -19.411  -2.697 -12.606
    7   HG22  VAL  20          HG21      VAL  20 -19.473  -4.009  -9.322
    8   HG21  VAL  20          HG22      VAL  20 -21.059  -3.518  -9.911
    9   HG23  VAL  20          HG23      VAL  20 -19.632  -2.573 -10.334

  No H/Q in entry =           9
  In of MODEL   61
    1    H    SER  21           H        SER  21 -19.087  -7.402 -12.285
    2    HA   SER  21           HA       SER  21 -19.878  -7.251 -15.033
    3    HB2  SER  21           HB2      SER  21 -18.489  -9.248 -15.386
    4    HB3  SER  21           HB3      SER  21 -17.628  -8.029 -14.447
    5    HG   SER  21           HG       SER  21 -18.031  -9.195 -12.604

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LYS  22           H        LYS  22 -20.987  -9.430 -12.474
    2    HA   LYS  22           HA       LYS  22 -22.569 -10.999 -14.302
    3    HB2  LYS  22           HB2      LYS  22 -21.803 -11.713 -11.976
    4    HB3  LYS  22           HB3      LYS  22 -23.094 -10.684 -11.356
    5    HG2  LYS  22           HG2      LYS  22 -23.931 -12.897 -11.373
    6    HG3  LYS  22           HG3      LYS  22 -24.704 -12.052 -12.714
    7    HD2  LYS  22           HD2      LYS  22 -23.327 -13.139 -14.315
    8    HD3  LYS  22           HD3      LYS  22 -22.250 -13.763 -13.064
    9    HE2  LYS  22           HE2      LYS  22 -23.647 -15.565 -13.846
   10    HE3  LYS  22           HE3      LYS  22 -24.131 -15.151 -12.202
   11    HZ3  LYS  22           HZ1      LYS  22 -26.174 -15.075 -13.008
   12    HZ2  LYS  22           HZ2      LYS  22 -25.646 -15.074 -14.623
   13    HZ1  LYS  22           HZ3      LYS  22 -25.739 -13.615 -13.760

  No H/Q in entry =          13
  In of MODEL   61
    1    H    MET  23           H        MET  23 -23.215  -8.075 -12.410
    2    HA   MET  23           HA       MET  23 -26.025  -8.080 -12.906
    3    HB2  MET  23           HB2      MET  23 -24.121  -5.823 -12.323
    4    HB3  MET  23           HB3      MET  23 -25.862  -5.610 -12.493
    5    HG2  MET  23           HG2      MET  23 -26.279  -6.918 -10.533
    6    HG3  MET  23           HG3      MET  23 -24.578  -7.374 -10.416
    7    HE2  MET  23           HE1      MET  23 -26.783  -3.675  -9.191
    8    HE1  MET  23           HE2      MET  23 -27.065  -4.626 -10.648
    9    HE3  MET  23           HE3      MET  23 -25.995  -3.225 -10.705

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ARG  24           H        ARG  24 -23.242  -6.707 -14.688
    2    HA   ARG  24           HA       ARG  24 -24.713  -5.354 -16.673
    3    HB2  ARG  24           HB2      ARG  24 -22.258  -5.026 -16.291
    4    HB3  ARG  24           HB3      ARG  24 -21.968  -6.620 -16.941
    5    HG2  ARG  24           HG2      ARG  24 -22.782  -5.917 -19.170
    6    HG3  ARG  24           HG3      ARG  24 -23.169  -4.307 -18.510
    7    HD2  ARG  24           HD2      ARG  24 -20.983  -4.156 -19.558
    8    HD3  ARG  24           HD3      ARG  24 -20.765  -4.117 -17.813
    9    HE   ARG  24           HE       ARG  24 -20.411  -6.713 -18.346
   10   HH21  ARG  24          HH11      ARG  24 -18.353  -7.168 -17.564
   11   HH22  ARG  24          HH12      ARG  24 -16.996  -6.273 -18.155
   12   HH11  ARG  24          HH21      ARG  24 -19.099  -3.961 -19.814
   13   HH12  ARG  24          HH22      ARG  24 -17.447  -4.385 -19.493

  No H/Q in entry =          13
  In of MODEL   61
    1    H    ALA  25           H        ALA  25 -23.677  -8.722 -16.428
    2    HA   ALA  25           HA       ALA  25 -24.334  -9.515 -19.070
    3    HB1  ALA  25           HB1      ALA  25 -23.689 -11.570 -18.393
    4    HB3  ALA  25           HB2      ALA  25 -24.741 -11.533 -16.978
    5    HB2  ALA  25           HB3      ALA  25 -23.165 -10.748 -16.924

  No H/Q in entry =           5
  In of MODEL   61
    1    H    GLN  26           H        GLN  26 -26.153  -9.531 -16.040
    2    HA   GLN  26           HA       GLN  26 -28.530 -10.664 -17.060
    3    HB2  GLN  26           HB2      GLN  26 -27.964  -8.950 -14.660
    4    HB3  GLN  26           HB3      GLN  26 -29.547  -9.629 -15.011
    5    HG2  GLN  26           HG2      GLN  26 -26.999 -11.157 -14.562
    6    HG3  GLN  26           HG3      GLN  26 -28.353 -11.028 -13.448
    7   HE21  GLN  26          HE21      GLN  26 -27.197 -13.213 -14.747
    8   HE22  GLN  26          HE22      GLN  26 -28.268 -14.226 -15.549

  No H/Q in entry =           8
  In of MODEL   61
    1    H    ALA  27           H        ALA  27 -27.505  -7.295 -16.642
    2    HA   ALA  27           HA       ALA  27 -29.967  -6.130 -17.409
    3    HB1  ALA  27           HB1      ALA  27 -28.120  -4.873 -16.288
    4    HB3  ALA  27           HB2      ALA  27 -28.694  -4.079 -17.755
    5    HB2  ALA  27           HB3      ALA  27 -27.182  -4.986 -17.778

  No H/Q in entry =           5
  In of MODEL   61
    1    H    GLU  28           H        GLU  28 -27.304  -7.407 -19.297
    2    HA   GLU  28           HA       GLU  28 -28.218  -6.320 -21.803
    3    HB2  GLU  28           HB2      GLU  28 -25.857  -7.071 -21.193
    4    HB3  GLU  28           HB3      GLU  28 -26.447  -8.719 -21.409
    5    HG2  GLU  28           HG2      GLU  28 -25.285  -7.955 -23.373
    6    HG3  GLU  28           HG3      GLU  28 -26.992  -8.230 -23.719

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LYS  29           H        LYS  29 -28.463  -9.436 -20.175
    2    HA   LYS  29           HA       LYS  29 -29.810 -10.852 -22.189
    3    HB2  LYS  29           HB2      LYS  29 -28.781 -11.882 -20.197
    4    HB3  LYS  29           HB3      LYS  29 -30.030 -11.151 -19.193
    5    HG2  LYS  29           HG2      LYS  29 -31.731 -12.468 -20.268
    6    HG3  LYS  29           HG3      LYS  29 -30.552 -13.125 -21.401
    7    HD2  LYS  29           HD2      LYS  29 -29.436 -14.338 -19.683
    8    HD3  LYS  29           HD3      LYS  29 -30.317 -13.485 -18.417
    9    HE2  LYS  29           HE2      LYS  29 -31.132 -15.809 -18.798
   10    HE3  LYS  29           HE3      LYS  29 -32.378 -14.580 -19.028
   11    HZ1  LYS  29           HZ1      LYS  29 -31.824 -14.707 -21.457
   12    HZ3  LYS  29           HZ2      LYS  29 -32.579 -16.080 -20.803
   13    HZ2  LYS  29           HZ3      LYS  29 -30.910 -16.093 -21.106

  No H/Q in entry =          13
  In of MODEL   61
    1    H    TYR  30           H        TYR  30 -31.138  -8.734 -19.661
    2    HA   TYR  30           HA       TYR  30 -33.816  -9.101 -20.899
    3    HB2  TYR  30           HB2      TYR  30 -33.125  -7.992 -18.169
    4    HB3  TYR  30           HB3      TYR  30 -34.751  -8.199 -18.820
    5    HD1  TYR  30           HD1      TYR  30 -35.722 -10.465 -19.052
    6    HD2  TYR  30           HD2      TYR  30 -31.864  -9.860 -17.353
    7    HE1  TYR  30           HE1      TYR  30 -35.691 -12.802 -18.278
    8    HE2  TYR  30           HE2      TYR  30 -31.835 -12.183 -16.583
    9    HH   TYR  30           HH       TYR  30 -33.539 -14.489 -17.694

  No H/Q in entry =           9
  In of MODEL   61
    1    H    GLU  31           H        GLU  31 -31.600  -7.159 -21.686
    2    HA   GLU  31           HA       GLU  31 -31.472  -4.997 -22.488
    3    HB2  GLU  31           HB2      GLU  31 -34.386  -5.632 -23.000
    4    HB3  GLU  31           HB3      GLU  31 -33.512  -4.280 -23.718
    5    HG2  GLU  31           HG2      GLU  31 -32.081  -5.744 -24.928
    6    HG3  GLU  31           HG3      GLU  31 -32.680  -7.151 -24.052

  No H/Q in entry =           6
  In of MODEL   61
    1    H    VAL  32           H        VAL  32 -31.661  -4.917 -19.755
    2    HA   VAL  32           HA       VAL  32 -33.466  -2.763 -19.071
    3    HB   VAL  32           HB       VAL  32 -31.096  -3.833 -17.506
    4   HG12  VAL  32          HG11      VAL  32 -32.604  -2.989 -15.598
    5   HG11  VAL  32          HG12      VAL  32 -33.417  -2.051 -16.851
    6   HG13  VAL  32          HG13      VAL  32 -31.702  -1.795 -16.533
    7   HG21  VAL  32          HG21      VAL  32 -32.909  -5.501 -18.206
    8   HG23  VAL  32          HG22      VAL  32 -33.925  -4.659 -17.034
    9   HG22  VAL  32          HG23      VAL  32 -32.425  -5.426 -16.512

  No H/Q in entry =           9
  In of MODEL   61
    1    HA   PRO  33           HA       PRO  33 -30.365   0.103 -20.724
    2    HB2  PRO  33           HB2      PRO  33 -31.820   2.362 -20.575
    3    HB3  PRO  33           HB3      PRO  33 -32.323   1.083 -21.680
    4    HG2  PRO  33           HG2      PRO  33 -33.272   1.596 -18.860
    5    HG3  PRO  33           HG3      PRO  33 -34.244   1.426 -20.320
    6    HD2  PRO  33           HD2      PRO  33 -33.836  -0.673 -18.677
    7    HD3  PRO  33           HD3      PRO  33 -33.909  -0.896 -20.424

  No H/Q in entry =           7
  In of MODEL   61
    1    H    VAL  34           H        VAL  34 -29.110  -0.492 -18.785
    2    HA   VAL  34           HA       VAL  34 -28.762   1.910 -17.115
    3    HB   VAL  34           HB       VAL  34 -28.212   0.415 -15.193
    4   HG12  VAL  34          HG11      VAL  34 -30.643  -0.401 -14.887
    5   HG11  VAL  34          HG12      VAL  34 -30.945   0.382 -16.437
    6   HG13  VAL  34          HG13      VAL  34 -30.365   1.330 -15.068
    7   HG21  VAL  34          HG21      VAL  34 -28.452  -1.587 -17.220
    8   HG23  VAL  34          HG22      VAL  34 -29.514  -1.934 -15.855
    9   HG22  VAL  34          HG23      VAL  34 -27.789  -1.692 -15.590

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ILE  35           H        ILE  35 -26.772   2.288 -16.276
    2    HA   ILE  35           HA       ILE  35 -24.505   0.915 -17.559
    3    HB   ILE  35           HB       ILE  35 -24.831   3.805 -16.719
    4   HG12  ILE  35          HG12      ILE  35 -23.889   2.500 -19.280
    5   HG13  ILE  35          HG13      ILE  35 -25.503   3.158 -19.009
    6   HG21  ILE  35          HG21      ILE  35 -22.309   2.214 -17.051
    7   HG23  ILE  35          HG22      ILE  35 -22.731   3.392 -15.809
    8   HG22  ILE  35          HG23      ILE  35 -22.340   3.933 -17.441
    9   HD11  ILE  35          HD11      ILE  35 -24.047   5.312 -18.390
   10   HD13  ILE  35          HD12      ILE  35 -24.598   4.959 -20.028
   11   HD12  ILE  35          HD13      ILE  35 -22.954   4.544 -19.541

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ILE  36           H        ILE  36 -23.295  -0.154 -15.974
    2    HA   ILE  36           HA       ILE  36 -23.712   0.443 -13.097
    3    HB   ILE  36           HB       ILE  36 -22.953  -2.268 -14.234
    4   HG12  ILE  36          HG12      ILE  36 -25.739  -1.403 -13.454
    5   HG13  ILE  36          HG13      ILE  36 -25.171  -1.379 -15.123
    6   HG23  ILE  36          HG21      ILE  36 -23.318  -3.109 -12.128
    7   HG22  ILE  36          HG22      ILE  36 -24.413  -1.804 -11.673
    8   HG21  ILE  36          HG23      ILE  36 -22.675  -1.513 -11.745
    9   HD13  ILE  36          HD11      ILE  36 -25.391  -3.586 -15.351
   10   HD12  ILE  36          HD12      ILE  36 -26.449  -3.453 -13.948
   11   HD11  ILE  36          HD13      ILE  36 -24.760  -3.915 -13.737

  No H/Q in entry =          11
  In of MODEL   61
    1    H    GLU  37           H        GLU  37 -21.913   1.018 -11.992
    2    HA   GLU  37           HA       GLU  37 -19.245   0.166 -12.924
    3    HB2  GLU  37           HB2      GLU  37 -20.186   2.959 -12.369
    4    HB3  GLU  37           HB3      GLU  37 -18.492   2.509 -12.164
    5    HG2  GLU  37           HG2      GLU  37 -18.657   3.539 -14.260
    6    HG3  GLU  37           HG3      GLU  37 -18.493   1.809 -14.564

  No H/Q in entry =           6
  In of MODEL   61
    1    H    ALA  38           H        ALA  38 -17.759  -0.124 -11.249
    2    HA   ALA  38           HA       ALA  38 -18.777   0.052  -8.473
    3    HB1  ALA  38           HB1      ALA  38 -17.114  -1.913  -9.924
    4    HB3  ALA  38           HB2      ALA  38 -18.165  -2.138  -8.525
    5    HB2  ALA  38           HB3      ALA  38 -16.537  -1.495  -8.311

  No H/Q in entry =           5
  In of MODEL   61
    1    H    PHE  39           H        PHE  39 -17.505   1.217  -6.992
    2    HA   PHE  39           HA       PHE  39 -14.956   2.369  -7.884
    3    HB2  PHE  39           HB2      PHE  39 -17.306   3.914  -6.798
    4    HB3  PHE  39           HB3      PHE  39 -15.660   4.541  -6.803
    5    HD1  PHE  39           HD1      PHE  39 -14.464   4.628  -9.076
    6    HD2  PHE  39           HD2      PHE  39 -18.686   4.259  -8.608
    7    HE1  PHE  39           HE1      PHE  39 -14.781   5.487 -11.379
    8    HE2  PHE  39           HE2      PHE  39 -19.019   5.108 -10.903
    9    HZ   PHE  39           HZ       PHE  39 -17.071   5.696 -12.307

  No H/Q in entry =           9
  In of MODEL   61
    1    HA   PRO  40           HA       PRO  40 -14.021   1.552  -3.609
    2    HB2  PRO  40           HB2      PRO  40 -12.207   3.520  -2.988
    3    HB3  PRO  40           HB3      PRO  40 -11.797   2.191  -4.071
    4    HG2  PRO  40           HG2      PRO  40 -12.763   4.955  -4.786
    5    HG3  PRO  40           HG3      PRO  40 -11.357   4.089  -5.406
    6    HD2  PRO  40           HD2      PRO  40 -13.585   4.063  -6.809
    7    HD3  PRO  40           HD3      PRO  40 -12.662   2.572  -6.634

  No H/Q in entry =           7
  In of MODEL   61
    1    H    GLU  41           H        GLU  41 -14.614   2.522  -1.468
    2    HA   GLU  41           HA       GLU  41 -16.821   4.272  -1.427
    3    HB2  GLU  41           HB2      GLU  41 -16.786   4.045   0.890
    4    HB3  GLU  41           HB3      GLU  41 -16.043   2.546   0.329
    5    HG2  GLU  41           HG2      GLU  41 -14.769   3.249   2.178
    6    HG3  GLU  41           HG3      GLU  41 -13.806   3.631   0.750

  No H/Q in entry =           6
  In of MODEL   61
    1    H    THR  42           H        THR  42 -13.471   5.119  -1.480
    2    HA   THR  42           HA       THR  42 -13.766   7.674  -0.242
    3    HB   THR  42           HB       THR  42 -11.601   8.212  -1.339
    4    HG1  THR  42           HG1      THR  42 -11.484   7.217  -3.218
    5   HG23  THR  42          HG21      THR  42 -11.340   7.082   0.716
    6   HG22  THR  42          HG22      THR  42 -10.348   6.154  -0.412
    7   HG21  THR  42          HG23      THR  42 -11.942   5.562   0.052

  No H/Q in entry =           7
  In of MODEL   61
    1    H    LEU  43           H        LEU  43 -14.702   6.630  -3.349
    2    HA   LEU  43           HA       LEU  43 -14.899   9.417  -4.292
    3    HB2  LEU  43           HB2      LEU  43 -15.283   6.779  -5.695
    4    HB3  LEU  43           HB3      LEU  43 -15.537   8.353  -6.446
    5    HG   LEU  43           HG       LEU  43 -12.881   7.331  -5.472
    6   HD12  LEU  43          HD11      LEU  43 -13.683   7.687  -8.335
    7   HD11  LEU  43          HD12      LEU  43 -14.032   6.179  -7.491
    8   HD13  LEU  43          HD13      LEU  43 -12.366   6.731  -7.658
    9   HD23  LEU  43          HD21      LEU  43 -12.187   9.257  -7.076
   10   HD22  LEU  43          HD22      LEU  43 -12.744   9.656  -5.451
   11   HD21  LEU  43          HD23      LEU  43 -13.834   9.835  -6.826

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ALA  44           H        ALA  44 -16.878   7.615  -2.451
    2    HA   ALA  44           HA       ALA  44 -19.362   7.540  -3.766
    3    HB2  ALA  44           HB1      ALA  44 -19.241   6.401  -1.681
    4    HB3  ALA  44           HB2      ALA  44 -20.318   7.766  -1.391
    5    HB1  ALA  44           HB3      ALA  44 -18.644   7.834  -0.843

  No H/Q in entry =           5
  In of MODEL   61
    1    H    GLY  45           H        GLY  45 -17.878  10.295  -2.211
    2    HA3  GLY  45           HA2      GLY  45 -20.284  11.849  -2.549
    3    HA2  GLY  45           HA3      GLY  45 -18.725  12.435  -1.971

  No H/Q in entry =           3
  In of MODEL   61
    1    H    GLU  46           H        GLU  46 -17.221  11.489  -4.276
    2    HA   GLU  46           HA       GLU  46 -17.816  13.735  -6.021
    3    HB2  GLU  46           HB2      GLU  46 -15.498  13.133  -5.382
    4    HB3  GLU  46           HB3      GLU  46 -15.690  11.596  -6.225
    5    HG2  GLU  46           HG2      GLU  46 -15.966  12.777  -8.335
    6    HG3  GLU  46           HG3      GLU  46 -15.803  14.321  -7.500

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LYS  47           H        LYS  47 -17.773  10.219  -6.490
    2    HA   LYS  47           HA       LYS  47 -18.875  10.487  -9.160
    3    HB2  LYS  47           HB2      LYS  47 -17.735   8.353  -7.511
    4    HB3  LYS  47           HB3      LYS  47 -19.133   7.840  -8.456
    5    HG2  LYS  47           HG2      LYS  47 -17.155   7.382  -9.705
    6    HG3  LYS  47           HG3      LYS  47 -18.009   8.715 -10.480
    7    HD2  LYS  47           HD2      LYS  47 -16.525  10.306  -9.317
    8    HD3  LYS  47           HD3      LYS  47 -15.642   8.945  -8.628
    9    HE2  LYS  47           HE2      LYS  47 -15.958   9.474 -11.575
   10    HE3  LYS  47           HE3      LYS  47 -14.543   9.908 -10.619
   11    HZ2  LYS  47           HZ1      LYS  47 -14.944   7.552 -11.893
   12    HZ1  LYS  47           HZ2      LYS  47 -15.324   7.180 -10.281
   13    HZ3  LYS  47           HZ3      LYS  47 -13.805   7.836 -10.665

  No H/Q in entry =          13
  In of MODEL   61
    1    H    GLY  48           H        GLY  48 -20.204   9.728  -6.015
    2    HA3  GLY  48           HA2      GLY  48 -22.616   8.600  -6.759
    3    HA2  GLY  48           HA3      GLY  48 -22.365   9.576  -5.311

  No H/Q in entry =           3
  In of MODEL   61
    1    H    GLN  49           H        GLN  49 -21.736  12.001  -6.861
    2    HA   GLN  49           HA       GLN  49 -24.270  13.168  -6.987
    3    HB2  GLN  49           HB2      GLN  49 -21.714  13.991  -8.346
    4    HB3  GLN  49           HB3      GLN  49 -23.154  14.986  -8.248
    5    HG2  GLN  49           HG2      GLN  49 -22.987  14.983  -5.811
    6    HG3  GLN  49           HG3      GLN  49 -21.559  13.966  -5.909
    7   HE21  GLN  49          HE21      GLN  49 -21.391  16.181  -4.616
    8   HE22  GLN  49          HE22      GLN  49 -20.443  17.422  -5.253

  No H/Q in entry =           8
  In of MODEL   61
    1    H    ASN  50           H        ASN  50 -22.639  11.276  -9.397
    2    HA   ASN  50           HA       ASN  50 -24.510  12.208 -11.464
    3    HB2  ASN  50           HB2      ASN  50 -21.965  10.616 -11.721
    4    HB3  ASN  50           HB3      ASN  50 -23.010  11.076 -13.057
    5   HD21  ASN  50          HD21      ASN  50 -20.351  11.850 -11.447
    6   HD22  ASN  50          HD22      ASN  50 -20.083  13.483 -11.774

  No H/Q in entry =           6
  In of MODEL   61
    1    H    ALA  51           H        ALA  51 -24.539   9.831  -9.240
    2    HA   ALA  51           HA       ALA  51 -25.377   7.720 -11.085
    3    HB2  ALA  51           HB1      ALA  51 -24.817   6.343  -9.413
    4    HB3  ALA  51           HB2      ALA  51 -25.917   7.165  -8.309
    5    HB1  ALA  51           HB3      ALA  51 -24.267   7.752  -8.506

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ASP  52           H        ASP  52 -27.403   6.708 -10.948
    2    HA   ASP  52           HA       ASP  52 -29.542   8.582 -10.258
    3    HB2  ASP  52           HB2      ASP  52 -29.411   6.090 -11.952
    4    HB3  ASP  52           HB3      ASP  52 -30.938   6.853 -11.505

  No H/Q in entry =           4
  In of MODEL   61
    1    H    VAL  53           H        VAL  53 -28.003   5.649  -9.275
    2    HA   VAL  53           HA       VAL  53 -29.431   5.784  -6.753
    3    HB   VAL  53           HB       VAL  53 -30.871   4.186  -8.008
    4   HG11  VAL  53          HG11      VAL  53 -29.148   3.302  -9.544
    5   HG13  VAL  53          HG12      VAL  53 -30.008   2.017  -8.694
    6   HG12  VAL  53          HG13      VAL  53 -28.385   2.479  -8.185
    7   HG23  VAL  53          HG21      VAL  53 -30.088   2.175  -6.337
    8   HG22  VAL  53          HG22      VAL  53 -31.186   3.501  -5.954
    9   HG21  VAL  53          HG23      VAL  53 -29.475   3.630  -5.551

  No H/Q in entry =           9
  In of MODEL   61
    1    H    VAL  54           H        VAL  54 -28.123   5.306  -5.106
    2    HA   VAL  54           HA       VAL  54 -25.385   4.400  -5.736
    3    HB   VAL  54           HB       VAL  54 -26.408   6.180  -3.465
    4   HG11  VAL  54          HG11      VAL  54 -23.862   4.705  -3.779
    5   HG13  VAL  54          HG12      VAL  54 -24.595   5.388  -2.328
    6   HG12  VAL  54          HG13      VAL  54 -23.670   6.420  -3.417
    7   HG22  VAL  54          HG21      VAL  54 -25.510   7.985  -4.550
    8   HG21  VAL  54          HG22      VAL  54 -26.085   7.020  -5.910
    9   HG23  VAL  54          HG23      VAL  54 -24.376   7.002  -5.478

  No H/Q in entry =           9
  In of MODEL   61
    1    H    LEU  55           H        LEU  55 -24.836   2.459  -5.113
    2    HA   LEU  55           HA       LEU  55 -26.366   1.163  -2.945
    3    HB2  LEU  55           HB2      LEU  55 -24.844  -0.019  -5.256
    4    HB3  LEU  55           HB3      LEU  55 -25.622  -0.949  -3.974
    5    HG   LEU  55           HG       LEU  55 -27.029   0.692  -6.071
    6   HD13  LEU  55          HD11      LEU  55 -26.776  -1.154  -7.310
    7   HD12  LEU  55          HD12      LEU  55 -27.749  -2.019  -6.120
    8   HD11  LEU  55          HD13      LEU  55 -25.993  -1.996  -5.974
    9   HD23  LEU  55          HD21      LEU  55 -28.362  -1.241  -4.231
   10   HD22  LEU  55          HD22      LEU  55 -29.028   0.166  -5.063
   11   HD21  LEU  55          HD23      LEU  55 -27.998   0.384  -3.649

  No H/Q in entry =          11
  In of MODEL   61
    1    H    LEU  56           H        LEU  56 -25.223   0.524  -1.149
    2    HA   LEU  56           HA       LEU  56 -22.281   0.851  -1.206
    3    HB2  LEU  56           HB2      LEU  56 -24.080   0.660   1.198
    4    HB3  LEU  56           HB3      LEU  56 -22.361   1.050   1.184
    5    HG   LEU  56           HG       LEU  56 -24.623   2.791   0.244
    6   HD11  LEU  56          HD11      LEU  56 -23.510   2.358   2.757
    7   HD13  LEU  56          HD12      LEU  56 -24.469   3.755   2.268
    8   HD12  LEU  56          HD13      LEU  56 -22.710   3.820   2.175
    9   HD23  LEU  56          HD21      LEU  56 -22.640   4.445   0.061
   10   HD22  LEU  56          HD22      LEU  56 -23.052   3.370  -1.275
   11   HD21  LEU  56          HD23      LEU  56 -21.704   2.975  -0.211

  No H/Q in entry =          11
  In of MODEL   61
    1    H    GLY  57           H        GLY  57 -20.937  -0.815  -0.692
    2    HA3  GLY  57           HA2      GLY  57 -21.923  -3.477  -0.911
    3    HA2  GLY  57           HA3      GLY  57 -20.288  -3.026  -0.433

  No H/Q in entry =           3
  In of MODEL   61
    1    HA   PRO  58           HA       PRO  58 -23.109  -4.033   3.277
    2    HB2  PRO  58           HB2      PRO  58 -22.485  -6.659   3.857
    3    HB3  PRO  58           HB3      PRO  58 -23.861  -6.209   2.853
    4    HG2  PRO  58           HG2      PRO  58 -21.159  -7.146   2.049
    5    HG3  PRO  58           HG3      PRO  58 -22.736  -7.563   1.378
    6    HD2  PRO  58           HD2      PRO  58 -21.088  -5.772   0.167
    7    HD3  PRO  58           HD3      PRO  58 -22.845  -5.643   0.072

  No H/Q in entry =           7
  In of MODEL   61
    1    H    GLN  59           H        GLN  59 -19.752  -4.580   2.655
    2    HA   GLN  59           HA       GLN  59 -18.989  -4.642   5.412
    3    HB2  GLN  59           HB2      GLN  59 -17.238  -3.581   3.212
    4    HB3  GLN  59           HB3      GLN  59 -16.766  -4.382   4.697
    5    HG2  GLN  59           HG2      GLN  59 -16.446  -6.118   3.295
    6    HG3  GLN  59           HG3      GLN  59 -18.161  -6.365   3.575
    7   HE21  GLN  59          HE21      GLN  59 -15.896  -5.436   1.474
    8   HE22  GLN  59          HE22      GLN  59 -16.530  -5.289  -0.057

  No H/Q in entry =           8
  In of MODEL   61
    1    H    ILE  60           H        ILE  60 -19.869  -2.049   3.231
    2    HA   ILE  60           HA       ILE  60 -18.963  -0.131   5.292
    3    HB   ILE  60           HB       ILE  60 -19.156   1.621   3.486
    4   HG12  ILE  60          HG12      ILE  60 -19.022  -0.573   1.465
    5   HG13  ILE  60          HG13      ILE  60 -20.597  -0.029   2.044
    6   HG23  ILE  60          HG21      ILE  60 -17.009   1.319   2.772
    7   HG22  ILE  60          HG22      ILE  60 -17.200  -0.423   2.583
    8   HG21  ILE  60          HG23      ILE  60 -17.065   0.279   4.195
    9   HD13  ILE  60          HD11      ILE  60 -20.275   1.286   0.147
   10   HD12  ILE  60          HD12      ILE  60 -18.548   1.478   0.452
   11   HD11  ILE  60          HD13      ILE  60 -19.720   2.350   1.439

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ALA  61           H        ALA  61 -21.455  -1.658   5.355
    2    HA   ALA  61           HA       ALA  61 -23.642   0.064   4.919
    3    HB1  ALA  61           HB1      ALA  61 -24.889  -1.410   6.235
    4    HB2  ALA  61           HB2      ALA  61 -23.498  -1.841   7.229
    5    HB3  ALA  61           HB3      ALA  61 -23.613  -2.429   5.570

  No H/Q in entry =           5
  In of MODEL   61
    1    H    TYR  62           H        TYR  62 -21.429  -0.127   7.709
    2    HA   TYR  62           HA       TYR  62 -22.939   1.550   9.399
    3    HB2  TYR  62           HB2      TYR  62 -20.898   1.900  10.640
    4    HB3  TYR  62           HB3      TYR  62 -20.974   0.214  10.134
    5    HD1  TYR  62           HD1      TYR  62 -19.429  -0.643   8.397
    6    HD2  TYR  62           HD2      TYR  62 -19.142   3.379   9.810
    7    HE1  TYR  62           HE1      TYR  62 -17.214  -0.433   7.336
    8    HE2  TYR  62           HE2      TYR  62 -16.911   3.582   8.752
    9    HH   TYR  62           HH       TYR  62 -15.508   2.628   7.308

  No H/Q in entry =           9
  In of MODEL   61
    1    H    MET  63           H        MET  63 -21.286   2.396   6.546
    2    HA   MET  63           HA       MET  63 -21.047   5.217   7.265
    3    HB2  MET  63           HB2      MET  63 -20.478   3.694   4.722
    4    HB3  MET  63           HB3      MET  63 -20.260   5.436   4.900
    5    HG2  MET  63           HG2      MET  63 -18.540   5.079   6.556
    6    HG3  MET  63           HG3      MET  63 -18.788   3.336   6.469
    7    HE1  MET  63           HE1      MET  63 -18.219   6.448   4.735
    8    HE3  MET  63           HE2      MET  63 -18.199   5.947   3.045
    9    HE2  MET  63           HE3      MET  63 -16.681   6.193   3.910

  No H/Q in entry =           9
  In of MODEL   61
    1    H    LEU  64           H        LEU  64 -23.659   3.435   6.292
    2    HA   LEU  64           HA       LEU  64 -24.840   4.902   4.231
    3    HB2  LEU  64           HB2      LEU  64 -25.757   2.810   5.134
    4    HB3  LEU  64           HB3      LEU  64 -26.189   3.649   6.623
    5    HG   LEU  64           HG       LEU  64 -27.856   4.957   5.412
    6   HD13  LEU  64          HD11      LEU  64 -27.575   5.213   3.181
    7   HD12  LEU  64          HD12      LEU  64 -28.262   3.595   3.023
    8   HD11  LEU  64          HD13      LEU  64 -26.513   3.810   3.077
    9   HD23  LEU  64          HD21      LEU  64 -28.447   2.166   4.640
   10   HD22  LEU  64          HD22      LEU  64 -29.404   3.315   5.575
   11   HD21  LEU  64          HD23      LEU  64 -28.046   2.480   6.329

  No H/Q in entry =          11
  In of MODEL   61
    1    HA   PRO  65           HA       PRO  65 -26.931   8.084   7.020
    2    HB2  PRO  65           HB2      PRO  65 -24.919   8.171   9.268
    3    HB3  PRO  65           HB3      PRO  65 -26.651   8.496   9.324
    4    HG2  PRO  65           HG2      PRO  65 -25.775   6.210  10.226
    5    HG3  PRO  65           HG3      PRO  65 -27.199   6.223   9.186
    6    HD2  PRO  65           HD2      PRO  65 -24.347   5.542   8.466
    7    HD3  PRO  65           HD3      PRO  65 -25.827   4.697   8.016

  No H/Q in entry =           7
  In of MODEL   61
    1    H    GLU  66           H        GLU  66 -23.378   7.937   7.079
    2    HA   GLU  66           HA       GLU  66 -23.010  10.731   6.699
    3    HB2  GLU  66           HB2      GLU  66 -21.260   8.383   6.019
    4    HB3  GLU  66           HB3      GLU  66 -20.767  10.065   5.825
    5    HG2  GLU  66           HG2      GLU  66 -20.961  10.419   8.197
    6    HG3  GLU  66           HG3      GLU  66 -21.528   8.764   8.415

  No H/Q in entry =           6
  In of MODEL   61
    1    H    ILE  67           H        ILE  67 -23.191   8.010   4.422
    2    HA   ILE  67           HA       ILE  67 -22.739   9.728   2.143
    3    HB   ILE  67           HB       ILE  67 -23.713   6.844   2.299
    4   HG12  ILE  67          HG12      ILE  67 -21.057   7.952   1.378
    5   HG13  ILE  67          HG13      ILE  67 -21.356   7.525   3.061
    6   HG21  ILE  67          HG21      ILE  67 -23.615   8.741   0.091
    7   HG23  ILE  67          HG22      ILE  67 -24.283   7.110   0.129
    8   HG22  ILE  67          HG23      ILE  67 -22.568   7.352  -0.203
    9   HD12  ILE  67          HD11      ILE  67 -20.993   5.765   0.694
   10   HD11  ILE  67          HD12      ILE  67 -22.016   5.208   2.015
   11   HD13  ILE  67          HD13      ILE  67 -20.331   5.624   2.322

  No H/Q in entry =          11
  In of MODEL   61
    1    H    GLN  68           H        GLN  68 -25.630   8.736   3.778
    2    HA   GLN  68           HA       GLN  68 -27.441   9.734   1.821
    3    HB2  GLN  68           HB2      GLN  68 -27.695   9.356   4.801
    4    HB3  GLN  68           HB3      GLN  68 -29.001   9.995   3.819
    5    HG2  GLN  68           HG2      GLN  68 -29.091   7.979   2.524
    6    HG3  GLN  68           HG3      GLN  68 -27.654   7.356   3.315
    7   HE21  GLN  68          HE21      GLN  68 -29.869   6.059   3.176
    8   HE22  GLN  68          HE22      GLN  68 -30.706   5.613   4.590

  No H/Q in entry =           8
  In of MODEL   61
    1    H    ARG  69           H        ARG  69 -25.779  11.330   4.567
    2    HA   ARG  69           HA       ARG  69 -27.075  13.853   4.190
    3    HB2  ARG  69           HB2      ARG  69 -24.752  12.842   5.759
    4    HB3  ARG  69           HB3      ARG  69 -24.783  14.567   5.418
    5    HG2  ARG  69           HG2      ARG  69 -27.094  14.666   6.399
    6    HG3  ARG  69           HG3      ARG  69 -26.931  12.967   6.856
    7    HD2  ARG  69           HD2      ARG  69 -25.169  15.264   7.785
    8    HD3  ARG  69           HD3      ARG  69 -26.320  14.381   8.776
    9    HE   ARG  69           HE       ARG  69 -23.738  13.384   7.807
   10   HH21  ARG  69          HH11      ARG  69 -22.976  11.587   8.982
   11   HH22  ARG  69          HH12      ARG  69 -24.023  10.790  10.107
   12   HH11  ARG  69          HH21      ARG  69 -26.704  12.905   9.511
   13   HH12  ARG  69          HH22      ARG  69 -26.133  11.535  10.405

  No H/Q in entry =          13
  In of MODEL   61
    1    H    LEU  70           H        LEU  70 -24.251  12.378   2.804
    2    HA   LEU  70           HA       LEU  70 -23.074  14.721   1.653
    3    HB2  LEU  70           HB2      LEU  70 -22.145  12.371   2.222
    4    HB3  LEU  70           HB3      LEU  70 -22.779  11.938   0.635
    5    HG   LEU  70           HG       LEU  70 -21.152  13.274  -0.444
    6   HD11  LEU  70          HD11      LEU  70 -20.294  14.067   2.348
    7   HD13  LEU  70          HD12      LEU  70 -20.964  15.132   1.113
    8   HD12  LEU  70          HD13      LEU  70 -19.374  14.407   0.880
    9   HD22  LEU  70          HD21      LEU  70 -19.768  11.514  -0.234
   10   HD21  LEU  70          HD22      LEU  70 -20.703  11.005   1.172
   11   HD23  LEU  70          HD23      LEU  70 -19.287  12.035   1.380

  No H/Q in entry =          11
  In of MODEL   61
    1    H    LEU  71           H        LEU  71 -25.306  12.253   0.524
    2    HA   LEU  71           HA       LEU  71 -25.797  13.780  -1.977
    3    HB2  LEU  71           HB2      LEU  71 -26.090  10.799  -1.557
    4    HB3  LEU  71           HB3      LEU  71 -26.199  11.678  -3.082
    5    HG   LEU  71           HG       LEU  71 -23.672  11.599  -1.432
    6   HD12  LEU  71          HD11      LEU  71 -23.785   9.997  -3.879
    7   HD11  LEU  71          HD12      LEU  71 -24.808   9.391  -2.578
    8   HD13  LEU  71          HD13      LEU  71 -23.080   9.616  -2.307
    9   HD22  LEU  71          HD21      LEU  71 -23.727  13.432  -2.907
   10   HD21  LEU  71          HD22      LEU  71 -24.262  12.418  -4.248
   11   HD23  LEU  71          HD23      LEU  71 -22.642  12.215  -3.579

  No H/Q in entry =          11
  In of MODEL   61
    1    HA   PRO  72           HA       PRO  72 -29.664  13.425   0.659
    2    HB2  PRO  72           HB2      PRO  72 -30.442  16.011   0.605
    3    HB3  PRO  72           HB3      PRO  72 -29.142  15.508   1.686
    4    HG2  PRO  72           HG2      PRO  72 -28.931  16.723  -1.057
    5    HG3  PRO  72           HG3      PRO  72 -28.142  17.236   0.434
    6    HD2  PRO  72           HD2      PRO  72 -26.861  15.654  -1.353
    7    HD3  PRO  72           HD3      PRO  72 -26.604  15.462   0.380

  No H/Q in entry =           7
  In of MODEL   61
    1    H    ASN  73           H        ASN  73 -29.024  14.390  -2.550
    2    HA   ASN  73           HA       ASN  73 -31.895  14.178  -3.172
    3    HB2  ASN  73           HB2      ASN  73 -31.403  15.290  -5.261
    4    HB3  ASN  73           HB3      ASN  73 -30.844  16.239  -3.893
    5   HD21  ASN  73          HD21      ASN  73 -30.059  16.285  -6.573
    6   HD22  ASN  73          HD22      ASN  73 -28.398  16.072  -6.775

  No H/Q in entry =           6
  In of MODEL   61
    1    H    LYS  74           H        LYS  74 -29.987  11.857  -2.778
    2    HA   LYS  74           HA       LYS  74 -30.609  10.506  -5.336
    3    HB2  LYS  74           HB2      LYS  74 -28.081  10.116  -3.729
    4    HB3  LYS  74           HB3      LYS  74 -28.497   9.331  -5.254
    5    HG2  LYS  74           HG2      LYS  74 -28.135  12.289  -5.025
    6    HG3  LYS  74           HG3      LYS  74 -26.798  11.185  -5.344
    7    HD2  LYS  74           HD2      LYS  74 -27.953  10.313  -7.292
    8    HD3  LYS  74           HD3      LYS  74 -29.337  11.353  -6.956
    9    HE2  LYS  74           HE2      LYS  74 -28.048  13.321  -7.384
   10    HE3  LYS  74           HE3      LYS  74 -26.558  12.384  -7.492
   11    HZ2  LYS  74           HZ1      LYS  74 -28.017  13.054  -9.604
   12    HZ1  LYS  74           HZ2      LYS  74 -28.720  11.551  -9.243
   13    HZ3  LYS  74           HZ3      LYS  74 -27.052  11.658  -9.546

  No H/Q in entry =          13
  In of MODEL   61
    1    HA   PRO  75           HA       PRO  75 -32.090   7.540  -2.387
    2    HB2  PRO  75           HB2      PRO  75 -32.480   5.348  -3.989
    3    HB3  PRO  75           HB3      PRO  75 -33.560   6.740  -4.040
    4    HG2  PRO  75           HG2      PRO  75 -31.251   6.083  -5.827
    5    HG3  PRO  75           HG3      PRO  75 -32.886   6.578  -6.263
    6    HD2  PRO  75           HD2      PRO  75 -30.883   8.377  -6.211
    7    HD3  PRO  75           HD3      PRO  75 -32.498   8.826  -5.662

  No H/Q in entry =           7
  In of MODEL   61
    1    H    VAL  76           H        VAL  76 -30.667   6.424  -1.031
    2    HA   VAL  76           HA       VAL  76 -28.249   5.143  -2.159
    3    HB   VAL  76           HB       VAL  76 -28.477   6.594   0.513
    4   HG11  VAL  76          HG11      VAL  76 -26.170   5.241  -0.901
    5   HG13  VAL  76          HG12      VAL  76 -26.874   4.799   0.655
    6   HG12  VAL  76          HG13      VAL  76 -25.979   6.309   0.490
    7   HG22  VAL  76          HG21      VAL  76 -27.749   8.479  -0.359
    8   HG21  VAL  76          HG22      VAL  76 -28.320   7.816  -1.892
    9   HG23  VAL  76          HG23      VAL  76 -26.621   7.667  -1.445

  No H/Q in entry =           9
  In of MODEL   61
    1    H    GLU  77           H        GLU  77 -28.101   2.978  -1.568
    2    HA   GLU  77           HA       GLU  77 -28.903   2.192   1.082
    3    HB2  GLU  77           HB2      GLU  77 -30.566   0.605   0.543
    4    HB3  GLU  77           HB3      GLU  77 -31.067   2.151  -0.142
    5    HG2  GLU  77           HG2      GLU  77 -30.492   1.394  -2.339
    6    HG3  GLU  77           HG3      GLU  77 -29.899  -0.130  -1.683

  No H/Q in entry =           6
  In of MODEL   61
    1    H    VAL  78           H        VAL  78 -28.643   0.090   1.722
    2    HA   VAL  78           HA       VAL  78 -26.008  -0.762   0.815
    3    HB   VAL  78           HB       VAL  78 -27.735  -1.611   3.179
    4   HG11  VAL  78          HG11      VAL  78 -25.442  -2.906   2.034
    5   HG13  VAL  78          HG12      VAL  78 -26.359  -3.359   3.472
    6   HG12  VAL  78          HG13      VAL  78 -25.001  -2.244   3.608
    7   HG22  VAL  78          HG21      VAL  78 -26.226  -0.309   4.524
    8   HG21  VAL  78          HG22      VAL  78 -26.935   0.696   3.261
    9   HG23  VAL  78          HG23      VAL  78 -25.277   0.114   3.099

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ILE  79           H        ILE  79 -25.538  -2.678  -0.110
    2    HA   ILE  79           HA       ILE  79 -27.651  -4.075  -1.462
    3    HB   ILE  79           HB       ILE  79 -24.679  -4.703  -1.259
    4   HG12  ILE  79          HG12      ILE  79 -26.287  -3.524  -3.529
    5   HG13  ILE  79          HG13      ILE  79 -25.375  -2.554  -2.371
    6   HG22  ILE  79          HG21      ILE  79 -25.829  -5.824  -3.583
    7   HG21  ILE  79          HG22      ILE  79 -26.824  -6.325  -2.216
    8   HG23  ILE  79          HG23      ILE  79 -25.093  -6.661  -2.216
    9   HD13  ILE  79          HD11      ILE  79 -23.973  -2.697  -4.196
   10   HD12  ILE  79          HD12      ILE  79 -24.370  -4.391  -4.491
   11   HD11  ILE  79          HD13      ILE  79 -23.365  -3.948  -3.111

  No H/Q in entry =          11
  In of MODEL   61
    1    H    ASP  80           H        ASP  80 -28.577  -5.974  -0.893
    2    HA   ASP  80           HA       ASP  80 -28.543  -6.899   1.746
    3    HB2  ASP  80           HB2      ASP  80 -30.322  -7.402   0.108
    4    HB3  ASP  80           HB3      ASP  80 -29.200  -8.440  -0.774

  No H/Q in entry =           4
  In of MODEL   61
    1    H    SER  81           H        SER  81 -27.041  -8.094   2.860
    2    HA   SER  81           HA       SER  81 -24.573  -8.848   1.651
    3    HB2  SER  81           HB2      SER  81 -24.049  -9.914   3.809
    4    HB3  SER  81           HB3      SER  81 -24.695  -8.289   4.039
    5    HG   SER  81           HG       SER  81 -25.551  -9.998   5.413

  No H/Q in entry =           5
  In of MODEL   61
    1    H    LEU  82           H        LEU  82 -27.351 -10.851   1.966
    2    HA   LEU  82           HA       LEU  82 -25.884 -13.265   1.418
    3    HB2  LEU  82           HB2      LEU  82 -28.799 -12.548   1.183
    4    HB3  LEU  82           HB3      LEU  82 -28.151 -14.170   0.951
    5    HG   LEU  82           HG       LEU  82 -28.023 -12.624   3.521
    6   HD13  LEU  82          HD11      LEU  82 -30.314 -13.169   3.125
    7   HD12  LEU  82          HD12      LEU  82 -29.695 -14.412   4.215
    8   HD11  LEU  82          HD13      LEU  82 -29.895 -14.764   2.498
    9   HD21  LEU  82          HD21      LEU  82 -27.152 -15.341   2.581
   10   HD23  LEU  82          HD22      LEU  82 -27.503 -15.040   4.282
   11   HD22  LEU  82          HD23      LEU  82 -26.227 -14.131   3.471

  No H/Q in entry =          11
  In of MODEL   61
    1    H    LEU  83           H        LEU  83 -27.775 -10.959  -0.473
    2    HA   LEU  83           HA       LEU  83 -27.629 -12.302  -2.956
    3    HB2  LEU  83           HB2      LEU  83 -27.940  -9.387  -2.282
    4    HB3  LEU  83           HB3      LEU  83 -27.999 -10.016  -3.928
    5    HG   LEU  83           HG       LEU  83 -30.037 -10.354  -1.746
    6   HD13  LEU  83          HD11      LEU  83 -30.735  -8.474  -2.792
    7   HD12  LEU  83          HD12      LEU  83 -31.239  -9.560  -4.085
    8   HD11  LEU  83          HD13      LEU  83 -29.678  -8.746  -4.176
    9   HD23  LEU  83          HD21      LEU  83 -30.228 -11.584  -4.481
   10   HD22  LEU  83          HD22      LEU  83 -31.203 -11.914  -3.050
   11   HD21  LEU  83          HD23      LEU  83 -29.533 -12.473  -3.126

  No H/Q in entry =          11
  In of MODEL   61
    1    H    TYR  84           H        TYR  84 -25.591  -9.997  -1.268
    2    HA   TYR  84           HA       TYR  84 -23.722  -9.553  -3.402
    3    HB2  TYR  84           HB2      TYR  84 -24.185  -8.071  -1.361
    4    HB3  TYR  84           HB3      TYR  84 -23.191  -9.210  -0.455
    5    HD1  TYR  84           HD1      TYR  84 -20.851  -9.749  -1.703
    6    HD2  TYR  84           HD2      TYR  84 -23.121  -6.156  -2.119
    7    HE1  TYR  84           HE1      TYR  84 -18.813  -8.562  -2.445
    8    HE2  TYR  84           HE2      TYR  84 -21.095  -4.959  -2.871
    9    HH   TYR  84           HH       TYR  84 -18.179  -5.804  -2.325

  No H/Q in entry =           9
  In of MODEL   61
    1    H    GLY  85           H        GLY  85 -23.538 -11.587  -0.474
    2    HA3  GLY  85           HA2      GLY  85 -20.995 -12.611  -0.976
    3    HA2  GLY  85           HA3      GLY  85 -22.249 -13.424  -0.040

  No H/Q in entry =           3
  In of MODEL   61
    1    H    LYS  86           H        LYS  86 -24.115 -13.719  -2.095
    2    HA   LYS  86           HA       LYS  86 -23.146 -16.116  -3.379
    3    HB2  LYS  86           HB2      LYS  86 -25.512 -15.267  -2.396
    4    HB3  LYS  86           HB3      LYS  86 -25.736 -14.888  -4.102
    5    HG2  LYS  86           HG2      LYS  86 -25.490 -17.171  -4.702
    6    HG3  LYS  86           HG3      LYS  86 -25.050 -17.604  -3.050
    7    HD2  LYS  86           HD2      LYS  86 -27.391 -18.095  -3.360
    8    HD3  LYS  86           HD3      LYS  86 -27.250 -16.700  -2.291
    9    HE2  LYS  86           HE2      LYS  86 -27.948 -15.211  -3.945
   10    HE3  LYS  86           HE3      LYS  86 -27.589 -16.345  -5.246
   11    HZ2  LYS  86           HZ1      LYS  86 -29.791 -16.520  -3.262
   12    HZ1  LYS  86           HZ2      LYS  86 -29.372 -17.791  -4.310
   13    HZ3  LYS  86           HZ3      LYS  86 -29.930 -16.319  -4.943

  No H/Q in entry =          13
  In of MODEL   61
    1    H    VAL  87           H        VAL  87 -23.031 -12.896  -4.246
    2    HA   VAL  87           HA       VAL  87 -22.701 -11.716  -6.179
    3    HB   VAL  87           HB       VAL  87 -21.547 -14.393  -7.079
    4   HG12  VAL  87          HG11      VAL  87 -20.365 -12.513  -8.664
    5   HG11  VAL  87          HG12      VAL  87 -21.996 -11.855  -8.532
    6   HG13  VAL  87          HG13      VAL  87 -21.750 -13.483  -9.162
    7   HG22  VAL  87          HG21      VAL  87 -19.464 -13.606  -6.464
    8   HG21  VAL  87          HG22      VAL  87 -20.494 -12.987  -5.176
    9   HG23  VAL  87          HG23      VAL  87 -19.978 -11.922  -6.481

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ASP  88           H        ASP  88 -25.236 -12.278  -5.821
    2    HA   ASP  88           HA       ASP  88 -26.407 -13.436  -8.224
    3    HB2  ASP  88           HB2      ASP  88 -27.400 -13.668  -5.897
    4    HB3  ASP  88           HB3      ASP  88 -27.796 -11.952  -5.980

  No H/Q in entry =           4
  In of MODEL   61
    1    H    GLY  89           H        GLY  89 -25.668 -12.189  -9.858
    2    HA3  GLY  89           HA2      GLY  89 -25.760  -9.410 -10.035
    3    HA2  GLY  89           HA3      GLY  89 -25.779 -10.520 -11.405

  No H/Q in entry =           3
  In of MODEL   61
    1    H    LEU  90           H        LEU  90 -28.266 -11.794 -10.956
    2    HA   LEU  90           HA       LEU  90 -30.018  -9.793 -12.045
    3    HB2  LEU  90           HB2      LEU  90 -30.163 -12.180 -12.644
    4    HB3  LEU  90           HB3      LEU  90 -30.673 -12.544 -10.996
    5    HG   LEU  90           HG       LEU  90 -32.756 -11.355 -11.340
    6   HD13  LEU  90          HD11      LEU  90 -32.527  -9.608 -12.802
    7   HD12  LEU  90          HD12      LEU  90 -33.111 -10.819 -13.947
    8   HD11  LEU  90          HD13      LEU  90 -31.385 -10.481 -13.827
    9   HD23  LEU  90          HD21      LEU  90 -32.751 -12.966 -13.789
   10   HD22  LEU  90          HD22      LEU  90 -33.728 -13.111 -12.328
   11   HD21  LEU  90          HD23      LEU  90 -32.095 -13.777 -12.366

  No H/Q in entry =          11
  In of MODEL   61
    1    H    GLY  91           H        GLY  91 -29.883 -11.325  -8.874
    2    HA3  GLY  91           HA2      GLY  91 -32.180 -10.145  -7.815
    3    HA2  GLY  91           HA3      GLY  91 -30.802 -10.730  -6.883

  No H/Q in entry =           3
  In of MODEL   61
    1    H    VAL  92           H        VAL  92 -28.829  -8.960  -7.734
    2    HA   VAL  92           HA       VAL  92 -29.539  -6.648  -6.163
    3    HB   VAL  92           HB       VAL  92 -27.017  -7.186  -7.774
    4   HG12  VAL  92          HG11      VAL  92 -27.109  -5.315  -5.433
    5   HG11  VAL  92          HG12      VAL  92 -27.763  -4.738  -6.967
    6   HG13  VAL  92          HG13      VAL  92 -26.083  -5.262  -6.867
    7   HG22  VAL  92          HG21      VAL  92 -26.837  -8.793  -6.196
    8   HG21  VAL  92          HG22      VAL  92 -27.951  -7.984  -5.091
    9   HG23  VAL  92          HG23      VAL  92 -26.280  -7.437  -5.216

  No H/Q in entry =           9
  In of MODEL   61
    1    H    LEU  93           H        LEU  93 -29.169  -7.293  -9.591
    2    HA   LEU  93           HA       LEU  93 -29.434  -4.641 -10.497
    3    HB2  LEU  93           HB2      LEU  93 -28.859  -6.504 -11.977
    4    HB3  LEU  93           HB3      LEU  93 -30.472  -7.182 -11.751
    5    HG   LEU  93           HG       LEU  93 -31.425  -5.178 -12.855
    6   HD11  LEU  93          HD11      LEU  93 -29.521  -3.646 -12.348
    7   HD13  LEU  93          HD12      LEU  93 -29.970  -3.649 -14.054
    8   HD12  LEU  93          HD13      LEU  93 -28.543  -4.534 -13.516
    9   HD23  LEU  93          HD21      LEU  93 -30.416  -5.759 -15.153
   10   HD22  LEU  93          HD22      LEU  93 -31.294  -6.996 -14.252
   11   HD21  LEU  93          HD23      LEU  93 -29.529  -6.997 -14.262

  No H/Q in entry =          11
  In of MODEL   61
    1    H    LYS  94           H        LYS  94 -31.885  -7.117  -9.656
    2    HA   LYS  94           HA       LYS  94 -34.185  -5.595 -10.257
    3    HB2  LYS  94           HB2      LYS  94 -33.732  -7.812  -8.265
    4    HB3  LYS  94           HB3      LYS  94 -35.307  -7.063  -8.520
    5    HG2  LYS  94           HG2      LYS  94 -35.257  -7.821 -10.860
    6    HG3  LYS  94           HG3      LYS  94 -33.720  -8.625 -10.546
    7    HD2  LYS  94           HD2      LYS  94 -34.874  -9.938  -8.726
    8    HD3  LYS  94           HD3      LYS  94 -36.398  -9.237  -9.268
    9    HE2  LYS  94           HE2      LYS  94 -35.924 -10.163 -11.545
   10    HE3  LYS  94           HE3      LYS  94 -34.532 -10.997 -10.855
   11    HZ3  LYS  94           HZ1      LYS  94 -36.430 -12.456 -11.028
   12    HZ2  LYS  94           HZ2      LYS  94 -37.366 -11.408 -10.073
   13    HZ1  LYS  94           HZ3      LYS  94 -36.028 -12.204  -9.397

  No H/Q in entry =          13
  In of MODEL   61
    1    H    ALA  95           H        ALA  95 -32.352  -5.799  -7.218
    2    HA   ALA  95           HA       ALA  95 -34.142  -4.173  -5.718
    3    HB2  ALA  95           HB1      ALA  95 -31.809  -5.627  -5.204
    4    HB3  ALA  95           HB2      ALA  95 -32.753  -4.701  -4.038
    5    HB1  ALA  95           HB3      ALA  95 -31.384  -3.952  -4.860

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ALA  96           H        ALA  96 -31.484  -3.388  -7.821
    2    HA   ALA  96           HA       ALA  96 -31.294  -0.637  -7.026
    3    HB2  ALA  96           HB1      ALA  96 -29.937  -0.438  -9.140
    4    HB3  ALA  96           HB2      ALA  96 -30.297  -2.132  -9.472
    5    HB1  ALA  96           HB3      ALA  96 -29.360  -1.693  -8.044

  No H/Q in entry =           5
  In of MODEL   61
    1    H    VAL  97           H        VAL  97 -32.895  -2.278  -9.718
    2    HA   VAL  97           HA       VAL  97 -33.895   0.066 -10.949
    3    HB   VAL  97           HB       VAL  97 -34.801  -2.831 -11.011
    4   HG11  VAL  97          HG11      VAL  97 -36.527  -0.763 -11.471
    5   HG13  VAL  97          HG12      VAL  97 -36.643  -2.345 -12.240
    6   HG12  VAL  97          HG13      VAL  97 -35.850  -1.015 -13.081
    7   HG21  VAL  97          HG21      VAL  97 -33.472  -1.029 -13.038
    8   HG23  VAL  97          HG22      VAL  97 -33.982  -2.691 -13.339
    9   HG22  VAL  97          HG23      VAL  97 -32.715  -2.356 -12.156

  No H/Q in entry =           9
  In of MODEL   61
    1    H    ALA  98           H        ALA  98 -35.137  -2.094  -8.425
    2    HA   ALA  98           HA       ALA  98 -37.656  -0.862  -8.051
    3    HB1  ALA  98           HB1      ALA  98 -36.711  -3.104  -7.041
    4    HB3  ALA  98           HB2      ALA  98 -37.856  -2.148  -6.096
    5    HB2  ALA  98           HB3      ALA  98 -36.129  -2.060  -5.745

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ALA  99           H        ALA  99 -34.543  -0.183  -6.413
    2    HA   ALA  99           HA       ALA  99 -35.595   1.823  -4.728
    3    HB1  ALA  99           HB1      ALA  99 -32.983   0.851  -5.498
    4    HB2  ALA  99           HB2      ALA  99 -33.500   1.606  -3.989
    5    HB3  ALA  99           HB3      ALA  99 -32.997   2.608  -5.350

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ILE 100           H        ILE 100 -34.568   1.948  -8.088
    2    HA   ILE 100           HA       ILE 100 -34.649   4.803  -8.282
    3    HB   ILE 100           HB       ILE 100 -34.830   2.672 -10.439
    4   HG12  ILE 100          HG12      ILE 100 -32.595   4.582  -9.761
    5   HG13  ILE 100          HG13      ILE 100 -32.686   2.932  -9.146
    6   HG21  ILE 100          HG21      ILE 100 -35.152   5.606 -10.541
    7   HG23  ILE 100          HG22      ILE 100 -35.707   4.366 -11.666
    8   HG22  ILE 100          HG23      ILE 100 -34.035   4.924 -11.724
    9   HD12  ILE 100          HD11      ILE 100 -32.134   3.894 -11.914
   10   HD11  ILE 100          HD12      ILE 100 -32.849   2.301 -11.670
   11   HD13  ILE 100          HD13      ILE 100 -31.285   2.683 -10.954

  No H/Q in entry =          11
  In of MODEL   61
    1    H    LYS 101           H        LYS 101 -37.037   2.282  -9.018
    2    HA   LYS 101           HA       LYS 101 -39.063   4.012  -9.992
    3    HB2  LYS 101           HB2      LYS 101 -39.039   1.225  -8.890
    4    HB3  LYS 101           HB3      LYS 101 -40.565   2.044  -9.220
    5    HG2  LYS 101           HG2      LYS 101 -40.098   2.183 -11.519
    6    HG3  LYS 101           HG3      LYS 101 -38.416   1.716 -11.277
    7    HD2  LYS 101           HD2      LYS 101 -39.736  -0.139 -12.174
    8    HD3  LYS 101           HD3      LYS 101 -39.114  -0.506 -10.565
    9    HE2  LYS 101           HE2      LYS 101 -41.197  -1.132 -10.054
   10    HE3  LYS 101           HE3      LYS 101 -41.593   0.587 -10.039
   11    HZ3  LYS 101           HZ1      LYS 101 -42.501   0.480 -12.153
   12    HZ2  LYS 101           HZ2      LYS 101 -43.010  -0.982 -11.456
   13    HZ1  LYS 101           HZ3      LYS 101 -41.708  -0.970 -12.547

  No H/Q in entry =          13
  In of MODEL   61
    1    H    LYS 102           H        LYS 102 -38.608   2.488  -6.799
    2    HA   LYS 102           HA       LYS 102 -40.806   3.750  -5.579
    3    HB2  LYS 102           HB2      LYS 102 -39.631   1.832  -4.588
    4    HB3  LYS 102           HB3      LYS 102 -38.203   2.836  -4.341
    5    HG2  LYS 102           HG2      LYS 102 -39.462   4.262  -2.825
    6    HG3  LYS 102           HG3      LYS 102 -40.893   3.262  -3.073
    7    HD2  LYS 102           HD2      LYS 102 -39.729   1.344  -2.071
    8    HD3  LYS 102           HD3      LYS 102 -38.298   2.345  -1.821
    9    HE2  LYS 102           HE2      LYS 102 -39.593   3.857  -0.391
   10    HE3  LYS 102           HE3      LYS 102 -41.040   2.887  -0.662
   11    HZ1  LYS 102           HZ1      LYS 102 -39.377   1.064   0.316
   12    HZ3  LYS 102           HZ2      LYS 102 -40.451   1.979   1.261
   13    HZ2  LYS 102           HZ3      LYS 102 -38.824   2.448   1.130

  No H/Q in entry =          13
  In of MODEL   61
    1    H    ALA 103           H        ALA 103 -37.809   5.047  -6.594
    2    HA   ALA 103           HA       ALA 103 -37.943   7.350  -4.788
    3    HB2  ALA 103           HB1      ALA 103 -35.934   8.029  -6.368
    4    HB3  ALA 103           HB2      ALA 103 -35.961   6.316  -6.782
    5    HB1  ALA 103           HB3      ALA 103 -35.707   6.815  -5.110

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ALA 104           H        ALA 104 -38.604   6.674  -8.139
    2    HA   ALA 104           HA       ALA 104 -39.094   9.484  -8.731
    3    HB2  ALA 104           HB1      ALA 104 -39.171   8.839 -10.939
    4    HB1  ALA 104           HB2      ALA 104 -39.951   7.300 -10.573
    5    HB3  ALA 104           HB3      ALA 104 -38.220   7.500 -10.300

  No H/Q in entry =           5
  In of MODEL   61
    1    H    ALA 105           H        ALA 105 -40.767   7.419  -6.939
    2    HA   ALA 105           HA       ALA 105 -43.141   8.897  -6.886
    3    HB2  ALA 105           HB1      ALA 105 -43.925   8.083  -8.930
    4    HB3  ALA 105           HB2      ALA 105 -44.598   6.907  -7.802
    5    HB1  ALA 105           HB3      ALA 105 -43.146   6.516  -8.721

  No H/Q in entry =           5
  In of MODEL   62
    1    H1   ALA   1           H3       ALA   1 -12.604 -15.094  -2.329
    2    H2   ALA   1           H2       ALA   1 -11.696 -16.255  -3.180
    3    H3   ALA   1           H1       ALA   1 -12.818 -15.276  -4.003
    4    HA   ALA   1           HA       ALA   1 -14.259 -16.941  -3.769
    5    HB3  ALA   1           HB1      ALA   1 -12.907 -18.751  -3.323
    6    HB1  ALA   1           HB2      ALA   1 -13.655 -18.629  -1.730
    7    HB2  ALA   1           HB3      ALA   1 -12.061 -17.927  -2.013

  No H/Q in entry =           7
  In of MODEL   62
    1    H    GLU   2           H        GLU   2 -15.897 -17.764  -2.113
    2    HA   GLU   2           HA       GLU   2 -17.497 -16.008  -1.038
    3    HB2  GLU   2           HB2      GLU   2 -16.615 -18.467   0.488
    4    HB3  GLU   2           HB3      GLU   2 -18.115 -17.579   0.753
    5    HG2  GLU   2           HG2      GLU   2 -19.129 -18.629  -0.984
    6    HG3  GLU   2           HG3      GLU   2 -17.800 -18.256  -2.071

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLU   3           H        GLU   3 -15.610 -17.427   1.569
    2    HA   GLU   3           HA       GLU   3 -15.765 -15.078   3.142
    3    HB2  GLU   3           HB2      GLU   3 -14.245 -17.666   3.371
    4    HB3  GLU   3           HB3      GLU   3 -13.976 -16.360   4.525
    5    HG2  GLU   3           HG2      GLU   3 -16.169 -16.460   5.351
    6    HG3  GLU   3           HG3      GLU   3 -16.790 -17.235   3.899

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LEU   4           H        LEU   4 -12.855 -16.624   1.731
    2    HA   LEU   4           HA       LEU   4 -10.970 -14.772   2.334
    3    HB2  LEU   4           HB2      LEU   4 -11.244 -16.046  -0.398
    4    HB3  LEU   4           HB3      LEU   4  -9.771 -15.368   0.286
    5    HG   LEU   4           HG       LEU   4 -11.322 -17.733   1.389
    6   HD13  LEU   4          HD11      LEU   4  -9.729 -19.124   0.446
    7   HD12  LEU   4          HD12      LEU   4  -8.487 -17.873   0.422
    8   HD11  LEU   4          HD13      LEU   4  -9.780 -17.854  -0.776
    9   HD23  LEU   4          HD21      LEU   4  -9.069 -17.863   2.762
   10   HD22  LEU   4          HD22      LEU   4 -10.361 -16.793   3.303
   11   HD21  LEU   4          HD23      LEU   4  -8.984 -16.134   2.419

  No H/Q in entry =          11
  In of MODEL   62
    1    H    GLU   5           H        GLU   5 -13.308 -14.488  -0.330
    2    HA   GLU   5           HA       GLU   5 -12.244 -12.026  -1.319
    3    HB2  GLU   5           HB2      GLU   5 -13.691 -13.648  -2.616
    4    HB3  GLU   5           HB3      GLU   5 -15.061 -13.061  -1.673
    5    HG2  GLU   5           HG2      GLU   5 -15.022 -11.789  -3.713
    6    HG3  GLU   5           HG3      GLU   5 -14.458 -10.724  -2.425

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLU   6           H        GLU   6 -14.983 -12.846   0.777
    2    HA   GLU   6           HA       GLU   6 -15.817 -10.149   1.197
    3    HB2  GLU   6           HB2      GLU   6 -17.283 -12.121   1.588
    4    HB3  GLU   6           HB3      GLU   6 -16.267 -12.574   2.955
    5    HG2  GLU   6           HG2      GLU   6 -18.140 -11.339   3.835
    6    HG3  GLU   6           HG3      GLU   6 -16.725 -10.293   3.938

  No H/Q in entry =           6
  In of MODEL   62
    1    H    VAL   7           H        VAL   7 -13.560 -12.329   2.747
    2    HA   VAL   7           HA       VAL   7 -13.044 -10.781   5.082
    3    HB   VAL   7           HB       VAL   7 -11.400 -12.859   3.614
    4   HG11  VAL   7          HG11      VAL   7 -10.883 -11.355   6.185
    5   HG13  VAL   7          HG12      VAL   7  -9.793 -11.589   4.819
    6   HG12  VAL   7          HG13      VAL   7 -10.178 -12.943   5.882
    7   HG21  VAL   7          HG21      VAL   7 -13.660 -13.372   4.838
    8   HG23  VAL   7          HG22      VAL   7 -12.721 -13.131   6.312
    9   HG22  VAL   7          HG23      VAL   7 -12.265 -14.397   5.173

  No H/Q in entry =           9
  In of MODEL   62
    1    H    VAL   8           H        VAL   8 -11.548 -10.915   1.866
    2    HA   VAL   8           HA       VAL   8  -9.435  -9.099   2.363
    3    HB   VAL   8           HB       VAL   8 -10.911  -9.869  -0.155
    4   HG11  VAL   8          HG11      VAL   8  -8.735  -7.823   0.277
    5   HG13  VAL   8          HG12      VAL   8 -10.213  -7.674  -0.674
    6   HG12  VAL   8          HG13      VAL   8  -8.885  -8.676  -1.260
    7   HG21  VAL   8          HG21      VAL   8  -8.640 -10.902   1.360
    8   HG23  VAL   8          HG22      VAL   8  -8.142 -10.455  -0.269
    9   HG22  VAL   8          HG23      VAL   8  -9.446 -11.616  -0.038

  No H/Q in entry =           9
  In of MODEL   62
    1    H    MET   9           H        MET   9 -12.773  -8.615   1.217
    2    HA   MET   9           HA       MET   9 -12.639  -5.839   0.799
    3    HB2  MET   9           HB2      MET   9 -14.894  -7.668   1.615
    4    HB3  MET   9           HB3      MET   9 -15.136  -5.930   1.430
    5    HG2  MET   9           HG2      MET   9 -14.275  -6.066  -0.888
    6    HG3  MET   9           HG3      MET   9 -14.078  -7.808  -0.701
    7    HE3  MET   9           HE1      MET   9 -17.899  -5.342  -0.608
    8    HE2  MET   9           HE2      MET   9 -16.756  -5.092  -1.925
    9    HE1  MET   9           HE3      MET   9 -16.230  -4.870  -0.259

  No H/Q in entry =           9
  In of MODEL   62
    1    H    GLY  10           H        GLY  10 -13.341  -7.730   3.717
    2    HA3  GLY  10           HA2      GLY  10 -13.826  -5.543   5.451
    3    HA2  GLY  10           HA3      GLY  10 -13.302  -7.149   5.953

  No H/Q in entry =           3
  In of MODEL   62
    1    H    LEU  11           H        LEU  11 -10.865  -7.328   4.629
    2    HA   LEU  11           HA       LEU  11  -9.122  -5.949   6.388
    3    HB2  LEU  11           HB2      LEU  11  -8.621  -7.370   3.771
    4    HB3  LEU  11           HB3      LEU  11  -7.329  -6.705   4.769
    5    HG   LEU  11           HG       LEU  11  -9.379  -8.692   5.780
    6   HD13  LEU  11          HD11      LEU  11  -8.195  -9.950   4.204
    7   HD12  LEU  11          HD12      LEU  11  -7.261 -10.221   5.674
    8   HD11  LEU  11          HD13      LEU  11  -6.695  -9.063   4.472
    9   HD22  LEU  11          HD21      LEU  11  -8.494  -7.713   7.700
   10   HD21  LEU  11          HD22      LEU  11  -6.949  -7.346   6.934
   11   HD23  LEU  11          HD23      LEU  11  -7.316  -8.996   7.435

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  12           H        ILE  12 -10.021  -5.358   3.005
    2    HA   ILE  12           HA       ILE  12  -8.274  -3.169   2.586
    3    HB   ILE  12           HB       ILE  12 -10.938  -3.811   1.296
    4   HG12  ILE  12          HG12      ILE  12  -8.912  -5.444   1.157
    5   HG13  ILE  12          HG13      ILE  12  -9.736  -5.018  -0.328
    6   HG22  ILE  12          HG21      ILE  12  -9.858  -2.397  -0.598
    7   HG21  ILE  12          HG22      ILE  12  -8.821  -1.748   0.666
    8   HG23  ILE  12          HG23      ILE  12 -10.549  -1.566   0.762
    9   HD13  ILE  12          HD11      ILE  12  -7.992  -3.396  -0.846
   10   HD12  ILE  12          HD12      ILE  12  -7.251  -4.960  -0.514
   11   HD11  ILE  12          HD13      ILE  12  -7.214  -3.700   0.695

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  13           H        ILE  13 -11.637  -3.359   3.689
    2    HA   ILE  13           HA       ILE  13 -12.027  -0.563   3.977
    3    HB   ILE  13           HB       ILE  13 -13.286  -2.958   5.335
    4   HG12  ILE  13          HG12      ILE  13 -13.495  -2.380   2.791
    5   HG13  ILE  13          HG13      ILE  13 -14.918  -2.855   3.695
    6   HG22  ILE  13          HG21      ILE  13 -15.157  -1.178   5.801
    7   HG21  ILE  13          HG22      ILE  13 -13.844  -0.014   5.679
    8   HG23  ILE  13          HG23      ILE  13 -13.783  -1.284   6.899
    9   HD12  ILE  13          HD11      ILE  13 -15.058  -0.731   2.177
   10   HD11  ILE  13          HD12      ILE  13 -14.172   0.030   3.484
   11   HD13  ILE  13          HD13      ILE  13 -15.744  -0.666   3.803

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ASN  14           H        ASN  14 -10.970  -3.094   6.233
    2    HA   ASN  14           HA       ASN  14 -10.722  -1.475   8.528
    3    HB2  ASN  14           HB2      ASN  14 -10.534  -4.086   8.190
    4    HB3  ASN  14           HB3      ASN  14  -8.817  -3.740   8.029
    5   HD21  ASN  14          HD21      ASN  14  -9.483  -5.261  10.198
    6   HD22  ASN  14          HD22      ASN  14  -9.428  -4.351  11.628

  No H/Q in entry =           6
  In of MODEL   62
    1    H    SER  15           H        SER  15  -8.349  -2.342   6.024
    2    HA   SER  15           HA       SER  15  -6.166  -0.908   7.097
    3    HB2  SER  15           HB2      SER  15  -5.156  -1.140   4.938
    4    HB3  SER  15           HB3      SER  15  -6.153  -2.574   5.151
    5    HG   SER  15           HG       SER  15  -7.029  -1.956   3.349

  No H/Q in entry =           5
  In of MODEL   62
    1    H    GLY  16           H        GLY  16  -8.753   0.035   4.864
    2    HA3  GLY  16           HA2      GLY  16  -7.834   2.657   4.325
    3    HA2  GLY  16           HA3      GLY  16  -9.499   2.103   4.165

  No H/Q in entry =           3
  In of MODEL   62
    1    H    GLN  17           H        GLN  17 -10.050   1.375   6.812
    2    HA   GLN  17           HA       GLN  17 -10.695   3.889   7.970
    3    HB2  GLN  17           HB2      GLN  17 -11.960   1.807   8.438
    4    HB3  GLN  17           HB3      GLN  17 -10.570   1.183   9.327
    5    HG2  GLN  17           HG2      GLN  17 -12.150   2.161  10.906
    6    HG3  GLN  17           HG3      GLN  17 -10.703   3.166  10.840
    7   HE21  GLN  17          HE21      GLN  17 -11.648   5.216  11.279
    8   HE22  GLN  17          HE22      GLN  17 -12.832   5.925  10.290

  No H/Q in entry =           8
  In of MODEL   62
    1    H    ALA  18           H        ALA  18  -8.118   1.543   8.567
    2    HA   ALA  18           HA       ALA  18  -6.985   2.720  10.842
    3    HB2  ALA  18           HB1      ALA  18  -6.431   0.498   9.459
    4    HB3  ALA  18           HB2      ALA  18  -5.247   1.248  10.531
    5    HB1  ALA  18           HB3      ALA  18  -5.169   1.535   8.791

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ARG  19           H        ARG  19  -6.213   3.246   7.394
    2    HA   ARG  19           HA       ARG  19  -4.266   5.246   7.828
    3    HB2  ARG  19           HB2      ARG  19  -4.627   4.126   5.627
    4    HB3  ARG  19           HB3      ARG  19  -6.150   5.003   5.460
    5    HG2  ARG  19           HG2      ARG  19  -4.972   7.148   5.537
    6    HG3  ARG  19           HG3      ARG  19  -3.440   6.325   5.832
    7    HD2  ARG  19           HD2      ARG  19  -3.559   6.932   3.493
    8    HD3  ARG  19           HD3      ARG  19  -3.683   5.174   3.628
    9    HE   ARG  19           HE       ARG  19  -6.296   6.143   3.635
   10   HH21  ARG  19          HH11      ARG  19  -7.493   6.337   1.721
   11   HH22  ARG  19          HH12      ARG  19  -6.674   6.405   0.199
   12   HH11  ARG  19          HH21      ARG  19  -3.526   6.155   1.592
   13   HH12  ARG  19          HH22      ARG  19  -4.427   6.299   0.126

  No H/Q in entry =          13
  In of MODEL   62
    1    H    SER  20           H        SER  20  -7.763   5.444   7.240
    2    HA   SER  20           HA       SER  20  -8.058   8.207   7.208
    3    HB2  SER  20           HB2      SER  20  -9.965   6.909   6.670
    4    HB3  SER  20           HB3      SER  20  -9.875   6.010   8.182
    5    HG   SER  20           HG       SER  20 -10.623   8.701   7.742

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LEU  21           H        LEU  21  -8.099   6.009  10.000
    2    HA   LEU  21           HA       LEU  21  -8.489   8.003  11.977
    3    HB2  LEU  21           HB2      LEU  21  -7.192   5.273  12.122
    4    HB3  LEU  21           HB3      LEU  21  -7.485   6.288  13.530
    5    HG   LEU  21           HG       LEU  21  -9.666   5.443  11.601
    6   HD13  LEU  21          HD11      LEU  21  -8.886   3.416  12.584
    7   HD12  LEU  21          HD12      LEU  21 -10.297   3.885  13.531
    8   HD11  LEU  21          HD13      LEU  21  -8.676   4.177  14.162
    9   HD21  LEU  21          HD21      LEU  21  -9.573   6.933  14.216
   10   HD23  LEU  21          HD22      LEU  21 -10.997   5.966  13.846
   11   HD22  LEU  21          HD23      LEU  21 -10.534   7.285  12.783

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ALA  22           H        ALA  22  -5.572   6.573  10.553
    2    HA   ALA  22           HA       ALA  22  -3.659   7.835  12.177
    3    HB2  ALA  22           HB1      ALA  22  -3.289   5.982  10.474
    4    HB1  ALA  22           HB2      ALA  22  -2.064   7.252  10.513
    5    HB3  ALA  22           HB3      ALA  22  -3.287   7.242   9.241

  No H/Q in entry =           5
  In of MODEL   62
    1    H    TYR  23           H        TYR  23  -4.962   8.899   9.004
    2    HA   TYR  23           HA       TYR  23  -3.572  11.366   8.944
    3    HB2  TYR  23           HB2      TYR  23  -4.677  10.490   6.950
    4    HB3  TYR  23           HB3      TYR  23  -6.251  10.624   7.736
    5    HD1  TYR  23           HD1      TYR  23  -3.295  12.637   6.650
    6    HD2  TYR  23           HD2      TYR  23  -7.466  12.639   7.676
    7    HE1  TYR  23           HE1      TYR  23  -3.475  14.996   5.906
    8    HE2  TYR  23           HE2      TYR  23  -7.647  14.998   6.930
    9    HH   TYR  23           HH       TYR  23  -5.151  16.560   5.157

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ALA  24           H        ALA  24  -6.708  10.449  10.327
    2    HA   ALA  24           HA       ALA  24  -7.486  13.052  11.115
    3    HB1  ALA  24           HB1      ALA  24  -9.330  11.838  11.581
    4    HB2  ALA  24           HB2      ALA  24  -8.513  11.240  13.023
    5    HB3  ALA  24           HB3      ALA  24  -8.412  10.334  11.514

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ALA  25           H        ALA  25  -5.534  10.541  12.670
    2    HA   ALA  25           HA       ALA  25  -5.162  11.772  15.178
    3    HB2  ALA  25           HB1      ALA  25  -4.449   9.409  14.341
    4    HB3  ALA  25           HB2      ALA  25  -3.412  10.238  15.504
    5    HB1  ALA  25           HB3      ALA  25  -2.981  10.221  13.794

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LEU  26           H        LEU  26  -3.374  12.049  12.134
    2    HA   LEU  26           HA       LEU  26  -1.373  13.820  13.055
    3    HB2  LEU  26           HB2      LEU  26  -1.102  12.674  10.944
    4    HB3  LEU  26           HB3      LEU  26  -2.562  13.418  10.297
    5    HG   LEU  26           HG       LEU  26  -1.498  15.645  10.443
    6   HD12  LEU  26          HD11      LEU  26   1.042  15.607  10.850
    7   HD11  LEU  26          HD12      LEU  26   0.786  14.027  11.586
    8   HD13  LEU  26          HD13      LEU  26   0.011  15.455  12.272
    9   HD21  LEU  26          HD21      LEU  26   0.196  13.561   9.031
   10   HD23  LEU  26          HD22      LEU  26   0.190  15.285   8.671
   11   HD22  LEU  26          HD23      LEU  26  -1.256  14.320   8.381

  No H/Q in entry =          11
  In of MODEL   62
    1    H    LYS  27           H        LYS  27  -4.548  14.382  11.590
    2    HA   LYS  27           HA       LYS  27  -4.431  17.169  11.407
    3    HB2  LYS  27           HB2      LYS  27  -6.210  15.737  10.418
    4    HB3  LYS  27           HB3      LYS  27  -6.868  15.486  12.034
    5    HG2  LYS  27           HG2      LYS  27  -7.243  17.899  12.285
    6    HG3  LYS  27           HG3      LYS  27  -6.533  18.190  10.694
    7    HD2  LYS  27           HD2      LYS  27  -8.300  16.800   9.654
    8    HD3  LYS  27           HD3      LYS  27  -9.016  16.527  11.245
    9    HE2  LYS  27           HE2      LYS  27  -9.404  18.946  11.503
   10    HE3  LYS  27           HE3      LYS  27  -8.659  19.240   9.928
   11    HZ3  LYS  27           HZ1      LYS  27 -11.040  19.170   9.692
   12    HZ2  LYS  27           HZ2      LYS  27 -11.120  17.650  10.453
   13    HZ1  LYS  27           HZ3      LYS  27 -10.375  17.806   8.930

  No H/Q in entry =          13
  In of MODEL   62
    1    H    GLN  28           H        GLN  28  -5.359  15.088  14.125
    2    HA   GLN  28           HA       GLN  28  -6.204  17.101  15.915
    3    HB2  GLN  28           HB2      GLN  28  -4.866  14.433  16.431
    4    HB3  GLN  28           HB3      GLN  28  -5.566  15.448  17.693
    5    HG2  GLN  28           HG2      GLN  28  -7.082  14.387  15.292
    6    HG3  GLN  28           HG3      GLN  28  -7.143  13.686  16.909
    7   HE21  GLN  28          HE21      GLN  28  -8.972  15.571  14.970
    8   HE22  GLN  28          HE22      GLN  28  -9.685  16.595  16.120

  No H/Q in entry =           8
  In of MODEL   62
    1    H    ALA  29           H        ALA  29  -3.018  15.735  15.209
    2    HA   ALA  29           HA       ALA  29  -1.542  17.088  17.191
    3    HB1  ALA  29           HB1      ALA  29   0.369  16.359  16.062
    4    HB3  ALA  29           HB2      ALA  29  -0.387  16.509  14.476
    5    HB2  ALA  29           HB3      ALA  29  -0.837  15.181  15.544

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LYS  30           H        LYS  30  -2.388  18.007  13.869
    2    HA   LYS  30           HA       LYS  30  -0.919  20.412  13.778
    3    HB2  LYS  30           HB2      LYS  30  -3.475  19.609  12.372
    4    HB3  LYS  30           HB3      LYS  30  -2.605  21.105  12.034
    5    HG2  LYS  30           HG2      LYS  30  -0.569  19.763  11.507
    6    HG3  LYS  30           HG3      LYS  30  -1.512  18.289  11.746
    7    HD2  LYS  30           HD2      LYS  30  -3.065  18.979   9.960
    8    HD3  LYS  30           HD3      LYS  30  -2.145  20.466   9.723
    9    HE2  LYS  30           HE2      LYS  30  -0.147  19.126   9.130
   10    HE3  LYS  30           HE3      LYS  30  -1.086  17.645   9.336
   11    HZ2  LYS  30           HZ1      LYS  30  -0.895  18.525   6.998
   12    HZ1  LYS  30           HZ2      LYS  30  -1.905  19.811   7.477
   13    HZ3  LYS  30           HZ3      LYS  30  -2.470  18.207   7.541

  No H/Q in entry =          13
  In of MODEL   62
    1    H    GLN  31           H        GLN  31  -4.036  19.631  15.195
    2    HA   GLN  31           HA       GLN  31  -4.726  22.404  15.666
    3    HB2  GLN  31           HB2      GLN  31  -5.965  19.981  16.978
    4    HB3  GLN  31           HB3      GLN  31  -6.684  21.573  16.744
    5    HG2  GLN  31           HG2      GLN  31  -6.002  20.794  14.147
    6    HG3  GLN  31           HG3      GLN  31  -6.564  19.299  14.887
    7   HE21  GLN  31          HE21      GLN  31  -7.939  20.922  12.799
    8   HE22  GLN  31          HE22      GLN  31  -9.440  21.349  13.465

  No H/Q in entry =           8
  In of MODEL   62
    1    H    GLY  32           H        GLY  32  -2.461  20.409  16.967
    2    HA3  GLY  32           HA2      GLY  32  -1.043  20.823  18.767
    3    HA2  GLY  32           HA3      GLY  32  -2.138  22.092  19.302

  No H/Q in entry =           3
  In of MODEL   62
    1    H    ASP  33           H        ASP  33  -3.642  19.095  18.626
    2    HA   ASP  33           HA       ASP  33  -4.056  18.631  21.505
    3    HB2  ASP  33           HB2      ASP  33  -5.496  17.672  19.026
    4    HB3  ASP  33           HB3      ASP  33  -5.853  17.061  20.640

  No H/Q in entry =           4
  In of MODEL   62
    1    H    PHE  34           H        PHE  34  -1.910  17.721  21.798
    2    HA   PHE  34           HA       PHE  34  -0.974  15.454  20.380
    3    HB2  PHE  34           HB2      PHE  34  -0.322  16.405  23.178
    4    HB3  PHE  34           HB3      PHE  34   0.571  15.163  22.300
    5    HD1  PHE  34           HD1      PHE  34   0.492  18.587  23.057
    6    HD2  PHE  34           HD2      PHE  34   1.240  15.883  19.803
    7    HE1  PHE  34           HE1      PHE  34   1.831  20.330  21.909
    8    HE2  PHE  34           HE2      PHE  34   2.573  17.629  18.660
    9    HZ   PHE  34           HZ       PHE  34   2.871  19.850  19.718

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ALA  35           H        ALA  35  -2.997  15.768  23.251
    2    HA   ALA  35           HA       ALA  35  -2.853  13.095  24.131
    3    HB3  ALA  35           HB1      ALA  35  -5.290  13.781  25.000
    4    HB1  ALA  35           HB2      ALA  35  -4.715  15.388  24.553
    5    HB2  ALA  35           HB3      ALA  35  -3.822  14.432  25.735

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ALA  36           H        ALA  36  -5.268  14.690  22.049
    2    HA   ALA  36           HA       ALA  36  -6.749  12.321  21.561
    3    HB1  ALA  36           HB1      ALA  36  -8.169  13.788  20.619
    4    HB3  ALA  36           HB2      ALA  36  -6.990  14.184  19.368
    5    HB2  ALA  36           HB3      ALA  36  -6.986  15.063  20.898

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ALA  37           H        ALA  37  -4.033  13.846  19.893
    2    HA   ALA  37           HA       ALA  37  -4.049  12.225  17.585
    3    HB3  ALA  37           HB1      ALA  37  -2.007  13.874  19.012
    4    HB2  ALA  37           HB2      ALA  37  -2.541  13.955  17.334
    5    HB1  ALA  37           HB3      ALA  37  -1.419  12.691  17.844

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LYS  38           H        LYS  38  -2.291  11.852  20.655
    2    HA   LYS  38           HA       LYS  38  -1.031   9.421  20.147
    3    HB2  LYS  38           HB2      LYS  38  -1.300  11.178  22.304
    4    HB3  LYS  38           HB3      LYS  38  -1.958   9.662  22.913
    5    HG2  LYS  38           HG2      LYS  38   0.104   8.489  22.363
    6    HG3  LYS  38           HG3      LYS  38   0.748   9.923  21.556
    7    HD2  LYS  38           HD2      LYS  38   0.956  11.123  23.598
    8    HD3  LYS  38           HD3      LYS  38  -0.090   9.995  24.461
    9    HE2  LYS  38           HE2      LYS  38   2.258   9.612  25.070
   10    HE3  LYS  38           HE3      LYS  38   1.613   8.218  24.199
   11    HZ3  LYS  38           HZ1      LYS  38   2.918   8.614  22.416
   12    HZ2  LYS  38           HZ2      LYS  38   3.899   9.409  23.555
   13    HZ1  LYS  38           HZ3      LYS  38   2.840  10.304  22.573

  No H/Q in entry =          13
  In of MODEL   62
    1    H    ALA  39           H        ALA  39  -4.251   9.993  21.564
    2    HA   ALA  39           HA       ALA  39  -4.882   7.287  22.053
    3    HB3  ALA  39           HB1      ALA  39  -6.991   9.293  21.305
    4    HB2  ALA  39           HB2      ALA  39  -6.082   9.486  22.805
    5    HB1  ALA  39           HB3      ALA  39  -7.039   8.029  22.535

  No H/Q in entry =           5
  In of MODEL   62
    1    H    MET  40           H        MET  40  -5.423   9.333  19.221
    2    HA   MET  40           HA       MET  40  -6.954   7.450  17.753
    3    HB2  MET  40           HB2      MET  40  -5.284   9.808  16.858
    4    HB3  MET  40           HB3      MET  40  -6.339   8.883  15.786
    5    HG2  MET  40           HG2      MET  40  -7.332  10.143  18.355
    6    HG3  MET  40           HG3      MET  40  -7.372  10.989  16.810
    7    HE3  MET  40           HE1      MET  40 -10.004   9.452  14.745
    8    HE2  MET  40           HE2      MET  40  -8.249   9.523  14.591
    9    HE1  MET  40           HE3      MET  40  -9.129  10.908  15.237

  No H/Q in entry =           9
  In of MODEL   62
    1    H    MET  41           H        MET  41  -3.445   8.095  17.869
    2    HA   MET  41           HA       MET  41  -2.739   6.334  15.755
    3    HB2  MET  41           HB2      MET  41  -1.098   6.942  18.226
    4    HB3  MET  41           HB3      MET  41  -0.503   6.288  16.705
    5    HG2  MET  41           HG2      MET  41  -1.605   8.507  15.718
    6    HG3  MET  41           HG3      MET  41  -1.348   9.077  17.366
    7    HE2  MET  41           HE1      MET  41   1.515   6.901  17.704
    8    HE1  MET  41           HE2      MET  41   0.764   8.209  18.613
    9    HE3  MET  41           HE3      MET  41   2.391   8.414  17.967

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ASP  42           H        ASP  42  -3.125   5.849  19.239
    2    HA   ASP  42           HA       ASP  42  -2.157   3.228  19.379
    3    HB2  ASP  42           HB2      ASP  42  -2.979   4.998  21.216
    4    HB3  ASP  42           HB3      ASP  42  -4.432   4.010  21.141

  No H/Q in entry =           4
  In of MODEL   62
    1    H    GLN  43           H        GLN  43  -5.462   4.421  18.897
    2    HA   GLN  43           HA       GLN  43  -6.673   1.865  18.689
    3    HB2  GLN  43           HB2      GLN  43  -7.531   4.548  17.580
    4    HB3  GLN  43           HB3      GLN  43  -8.532   3.094  17.552
    5    HG2  GLN  43           HG2      GLN  43  -8.234   2.949  20.057
    6    HG3  GLN  43           HG3      GLN  43  -7.468   4.536  19.994
    7   HE21  GLN  43          HE21      GLN  43  -9.640   4.662  21.502
    8   HE22  GLN  43          HE22      GLN  43 -10.988   5.278  20.679

  No H/Q in entry =           8
  In of MODEL   62
    1    H    SER  44           H        SER  44  -5.284   4.060  16.287
    2    HA   SER  44           HA       SER  44  -6.030   2.609  13.991
    3    HB2  SER  44           HB2      SER  44  -4.711   4.956  14.446
    4    HB3  SER  44           HB3      SER  44  -3.385   3.929  13.905
    5    HG   SER  44           HG       SER  44  -4.477   4.941  12.152

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ARG  45           H        ARG  45  -3.150   2.408  16.061
    2    HA   ARG  45           HA       ARG  45  -1.725   0.425  14.662
    3    HB2  ARG  45           HB2      ARG  45  -0.841   1.812  16.537
    4    HB3  ARG  45           HB3      ARG  45  -1.853   0.900  17.654
    5    HG2  ARG  45           HG2      ARG  45  -0.677  -1.186  16.995
    6    HG3  ARG  45           HG3      ARG  45   0.360  -0.250  15.919
    7    HD2  ARG  45           HD2      ARG  45   1.136   1.098  17.881
    8    HD3  ARG  45           HD3      ARG  45   0.189   0.041  18.951
    9    HE   ARG  45           HE       ARG  45   1.842  -1.588  17.355
   10   HH21  ARG  45          HH11      ARG  45   3.722  -2.466  18.181
   11   HH22  ARG  45          HH12      ARG  45   4.519  -1.709  19.514
   12   HH11  ARG  45          HH21      ARG  45   2.216   0.854  19.760
   13   HH12  ARG  45          HH22      ARG  45   3.666   0.173  20.406

  No H/Q in entry =          13
  In of MODEL   62
    1    H    MET  46           H        MET  46  -4.122   0.150  17.267
    2    HA   MET  46           HA       MET  46  -4.027  -2.655  17.555
    3    HB2  MET  46           HB2      MET  46  -6.144  -0.598  18.173
    4    HB3  MET  46           HB3      MET  46  -6.389  -2.315  18.507
    5    HG2  MET  46           HG2      MET  46  -4.389  -2.359  19.914
    6    HG3  MET  46           HG3      MET  46  -4.053  -0.677  19.534
    7    HE2  MET  46           HE1      MET  46  -7.086  -2.604  22.230
    8    HE1  MET  46           HE2      MET  46  -6.324  -3.234  20.774
    9    HE3  MET  46           HE3      MET  46  -7.813  -2.304  20.647

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ALA  47           H        ALA  47  -5.999  -0.572  15.480
    2    HA   ALA  47           HA       ALA  47  -7.674  -2.572  14.406
    3    HB3  ALA  47           HB1      ALA  47  -8.295  -0.315  14.006
    4    HB2  ALA  47           HB2      ALA  47  -7.827  -0.950  12.429
    5    HB1  ALA  47           HB3      ALA  47  -6.717   0.083  13.330

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LEU  48           H        LEU  48  -4.524  -1.340  13.354
    2    HA   LEU  48           HA       LEU  48  -4.292  -2.921  11.002
    3    HB2  LEU  48           HB2      LEU  48  -2.197  -1.711  12.812
    4    HB3  LEU  48           HB3      LEU  48  -1.852  -2.430  11.239
    5    HG   LEU  48           HG       LEU  48  -3.813  -0.162  11.650
    6   HD13  LEU  48          HD11      LEU  48  -1.667   0.652  12.315
    7   HD12  LEU  48          HD12      LEU  48  -1.931   1.224  10.668
    8   HD11  LEU  48          HD13      LEU  48  -0.869  -0.154  10.964
    9   HD22  LEU  48          HD21      LEU  48  -4.317  -1.119   9.569
   10   HD21  LEU  48          HD22      LEU  48  -2.647  -1.598   9.266
   11   HD23  LEU  48          HD23      LEU  48  -3.121   0.096   9.119

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ASN  49           H        ASN  49  -3.249  -3.369  14.342
    2    HA   ASN  49           HA       ASN  49  -1.710  -5.673  13.992
    3    HB2  ASN  49           HB2      ASN  49  -1.692  -4.353  16.049
    4    HB3  ASN  49           HB3      ASN  49  -3.363  -4.790  16.373
    5   HD21  ASN  49          HD21      ASN  49  -1.361  -5.380  18.262
    6   HD22  ASN  49          HD22      ASN  49  -1.140  -7.060  18.330

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLU  50           H        GLU  50  -5.168  -5.306  14.675
    2    HA   GLU  50           HA       GLU  50  -5.757  -8.091  14.766
    3    HB2  GLU  50           HB2      GLU  50  -7.293  -6.366  15.658
    4    HB3  GLU  50           HB3      GLU  50  -7.575  -5.783  14.016
    5    HG2  GLU  50           HG2      GLU  50  -8.503  -7.950  13.366
    6    HG3  GLU  50           HG3      GLU  50  -8.136  -8.614  14.954

  No H/Q in entry =           6
  In of MODEL   62
    1    H    ALA  51           H        ALA  51  -5.765  -5.674  12.187
    2    HA   ALA  51           HA       ALA  51  -6.804  -7.360  10.156
    3    HB3  ALA  51           HB1      ALA  51  -6.537  -5.545   8.798
    4    HB1  ALA  51           HB2      ALA  51  -4.886  -5.246   9.344
    5    HB2  ALA  51           HB3      ALA  51  -6.252  -4.702  10.320

  No H/Q in entry =           5
  In of MODEL   62
    1    H    HIS  52           H        HIS  52  -3.486  -6.553  11.136
    2    HA   HIS  52           HA       HIS  52  -2.135  -8.069   9.173
    3    HB2  HIS  52           HB2      HIS  52  -1.070  -6.366  10.649
    4    HB3  HIS  52           HB3      HIS  52  -1.228  -7.485  12.002
    5    HD1  HIS  52           HD1      HIS  52   0.268  -9.617  11.982
    6    HD2  HIS  52           HD2      HIS  52   0.947  -7.051   8.767
    7    HE1  HIS  52           HE1      HIS  52   2.423 -10.385  10.896
    8    HE2  HIS  52           HE2      HIS  52   2.851  -8.831   8.933

  No H/Q in entry =           8
  In of MODEL   62
    1    H    LEU  53           H        LEU  53  -3.364  -8.933  12.383
    2    HA   LEU  53           HA       LEU  53  -2.240 -11.512  12.556
    3    HB2  LEU  53           HB2      LEU  53  -4.684 -10.265  13.786
    4    HB3  LEU  53           HB3      LEU  53  -4.278 -11.957  14.062
    5    HG   LEU  53           HG       LEU  53  -2.296  -9.712  14.547
    6   HD11  LEU  53          HD11      LEU  53  -4.275 -10.991  16.453
    7   HD13  LEU  53          HD12      LEU  53  -4.187  -9.290  15.999
    8   HD12  LEU  53          HD13      LEU  53  -2.908 -10.010  16.969
    9   HD21  LEU  53          HD21      LEU  53  -2.443 -12.648  15.248
   10   HD23  LEU  53          HD22      LEU  53  -1.480 -11.546  16.224
   11   HD22  LEU  53          HD23      LEU  53  -1.100 -11.769  14.527

  No H/Q in entry =          11
  In of MODEL   62
    1    H    VAL  54           H        VAL  54  -5.323 -10.383  11.209
    2    HA   VAL  54           HA       VAL  54  -6.315 -12.944  10.507
    3    HB   VAL  54           HB       VAL  54  -6.884 -10.186   9.393
    4   HG12  VAL  54          HG11      VAL  54  -9.027 -11.495   8.577
    5   HG11  VAL  54          HG12      VAL  54  -7.956 -12.894   8.637
    6   HG13  VAL  54          HG13      VAL  54  -7.559 -11.523   7.604
    7   HG22  VAL  54          HG21      VAL  54  -7.786 -10.212  11.546
    8   HG21  VAL  54          HG22      VAL  54  -8.091 -11.946  11.516
    9   HG23  VAL  54          HG23      VAL  54  -9.143 -10.852  10.620

  No H/Q in entry =           9
  In of MODEL   62
    1    H    GLN  55           H        GLN  55  -4.376 -10.537   8.730
    2    HA   GLN  55           HA       GLN  55  -4.295 -11.988   6.302
    3    HB2  GLN  55           HB2      GLN  55  -3.625  -9.741   6.126
    4    HB3  GLN  55           HB3      GLN  55  -2.513  -9.860   7.487
    5    HG2  GLN  55           HG2      GLN  55  -0.825 -10.748   6.200
    6    HG3  GLN  55           HG3      GLN  55  -1.930 -11.683   5.203
    7   HE21  GLN  55          HE21      GLN  55  -1.932 -10.979   3.086
    8   HE22  GLN  55          HE22      GLN  55  -1.687  -9.377   2.586

  No H/Q in entry =           8
  In of MODEL   62
    1    H    THR  56           H        THR  56  -2.182 -12.049   9.177
    2    HA   THR  56           HA       THR  56  -0.155 -13.703   8.243
    3    HB   THR  56           HB       THR  56  -1.444 -13.735  10.987
    4    HG1  THR  56           HG1      THR  56   0.789 -12.345   9.927
    5   HG23  THR  56          HG21      THR  56  -0.140 -15.663  10.989
    6   HG22  THR  56          HG22      THR  56   1.033 -14.455  11.516
    7   HG21  THR  56          HG23      THR  56   1.019 -15.000   9.838

  No H/Q in entry =           7
  In of MODEL   62
    1    H    LYS  57           H        LYS  57  -3.302 -14.655   9.608
    2    HA   LYS  57           HA       LYS  57  -2.941 -17.461   9.342
    3    HB2  LYS  57           HB2      LYS  57  -4.722 -16.327  10.700
    4    HB3  LYS  57           HB3      LYS  57  -5.503 -15.841   9.202
    5    HG2  LYS  57           HG2      LYS  57  -6.678 -17.777   9.751
    6    HG3  LYS  57           HG3      LYS  57  -5.458 -18.394   8.638
    7    HD2  LYS  57           HD2      LYS  57  -5.188 -19.912  10.356
    8    HD3  LYS  57           HD3      LYS  57  -4.064 -18.671  10.907
    9    HE2  LYS  57           HE2      LYS  57  -5.295 -18.873  12.845
   10    HE3  LYS  57           HE3      LYS  57  -6.340 -17.714  12.026
   11    HZ3  LYS  57           HZ1      LYS  57  -7.688 -19.515  11.212
   12    HZ2  LYS  57           HZ2      LYS  57  -7.561 -19.618  12.904
   13    HZ1  LYS  57           HZ3      LYS  57  -6.653 -20.662  11.917

  No H/Q in entry =          13
  In of MODEL   62
    1    H    LEU  58           H        LEU  58  -4.203 -14.965   7.186
    2    HA   LEU  58           HA       LEU  58  -5.065 -16.751   5.169
    3    HB2  LEU  58           HB2      LEU  58  -4.370 -13.821   5.052
    4    HB3  LEU  58           HB3      LEU  58  -5.065 -14.728   3.708
    5    HG   LEU  58           HG       LEU  58  -6.332 -14.529   6.460
    6   HD11  LEU  58          HD11      LEU  58  -6.588 -12.856   3.980
    7   HD13  LEU  58          HD12      LEU  58  -6.558 -12.361   5.672
    8   HD12  LEU  58          HD13      LEU  58  -8.006 -13.106   4.999
    9   HD22  LEU  58          HD21      LEU  58  -7.354 -16.402   5.580
   10   HD21  LEU  58          HD22      LEU  58  -7.005 -15.949   3.912
   11   HD23  LEU  58          HD23      LEU  58  -8.343 -15.188   4.771

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  59           H        ILE  59  -1.892 -15.642   6.031
    2    HA   ILE  59           HA       ILE  59  -0.823 -16.384   3.386
    3    HB   ILE  59           HB       ILE  59   0.011 -14.354   4.970
    4   HG12  ILE  59          HG12      ILE  59   2.040 -16.058   3.509
    5   HG13  ILE  59          HG13      ILE  59   0.875 -15.063   2.674
    6   HG23  ILE  59          HG21      ILE  59   1.841 -14.905   6.352
    7   HG22  ILE  59          HG22      ILE  59   2.044 -16.486   5.630
    8   HG21  ILE  59          HG23      ILE  59   0.693 -16.171   6.718
    9   HD11  ILE  59          HD11      ILE  59   2.868 -14.065   4.708
   10   HD13  ILE  59          HD12      ILE  59   1.699 -13.062   3.851
   11   HD12  ILE  59          HD13      ILE  59   3.003 -13.854   2.964

  No H/Q in entry =          11
  In of MODEL   62
    1    H    GLU  60           H        GLU  60  -0.860 -17.512   6.747
    2    HA   GLU  60           HA       GLU  60   1.109 -19.549   6.464
    3    HB2  GLU  60           HB2      GLU  60   0.458 -18.835   8.671
    4    HB3  GLU  60           HB3      GLU  60  -1.226 -19.255   8.366
    5    HG2  GLU  60           HG2      GLU  60   0.924 -21.355   8.154
    6    HG3  GLU  60           HG3      GLU  60   0.250 -20.923   9.725

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLY  61           H        GLY  61  -2.404 -19.537   5.986
    2    HA3  GLY  61           HA2      GLY  61  -2.243 -22.329   5.008
    3    HA2  GLY  61           HA3      GLY  61  -3.704 -21.553   5.610

  No H/Q in entry =           3
  In of MODEL   62
    1    H    ASP  62           H        ASP  62  -1.434 -20.025   3.413
    2    HA   ASP  62           HA       ASP  62  -3.519 -19.438   1.532
    3    HB2  ASP  62           HB2      ASP  62  -1.653 -18.370   0.261
    4    HB3  ASP  62           HB3      ASP  62  -1.773 -17.816   1.929

  No H/Q in entry =           4
  In of MODEL   62
    1    H    ALA  63           H        ALA  63  -2.521 -22.358   1.975
    2    HA   ALA  63           HA       ALA  63  -1.223 -23.350  -0.291
    3    HB3  ALA  63           HB1      ALA  63  -2.182 -25.470   0.222
    4    HB2  ALA  63           HB2      ALA  63  -3.517 -24.721   1.098
    5    HB1  ALA  63           HB3      ALA  63  -1.882 -24.652   1.758

  No H/Q in entry =           5
  In of MODEL   62
    1    H    GLY  64           H        GLY  64  -4.697 -22.809   0.257
    2    HA3  GLY  64           HA2      GLY  64  -6.480 -22.635  -1.173
    3    HA2  GLY  64           HA3      GLY  64  -5.343 -21.906  -2.294

  No H/Q in entry =           3
  In of MODEL   62
    1    H    GLU  65           H        GLU  65  -5.679 -22.848  -4.238
    2    HA   GLU  65           HA       GLU  65  -6.832 -25.299  -4.727
    3    HB2  GLU  65           HB2      GLU  65  -4.778 -23.841  -6.390
    4    HB3  GLU  65           HB3      GLU  65  -5.745 -25.202  -6.962
    5    HG2  GLU  65           HG2      GLU  65  -6.895 -22.626  -5.854
    6    HG3  GLU  65           HG3      GLU  65  -6.738 -22.991  -7.570

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLY  66           H        GLY  66  -5.772 -27.091  -5.962
    2    HA3  GLY  66           HA2      GLY  66  -4.118 -28.605  -4.261
    3    HA2  GLY  66           HA3      GLY  66  -4.570 -29.022  -5.903

  No H/Q in entry =           3
  In of MODEL   62
    1    H    LYS  67           H        LYS  67  -3.387 -26.744  -7.145
    2    HA   LYS  67           HA       LYS  67  -0.642 -27.683  -7.224
    3    HB2  LYS  67           HB2      LYS  67  -0.525 -26.305  -9.292
    4    HB3  LYS  67           HB3      LYS  67  -1.832 -27.495  -9.311
    5    HG2  LYS  67           HG2      LYS  67  -3.412 -25.744  -8.526
    6    HG3  LYS  67           HG3      LYS  67  -2.108 -24.560  -8.595
    7    HD2  LYS  67           HD2      LYS  67  -1.870 -24.945 -11.014
    8    HD3  LYS  67           HD3      LYS  67  -3.158 -26.150 -10.953
    9    HE2  LYS  67           HE2      LYS  67  -4.734 -24.431 -10.144
   10    HE3  LYS  67           HE3      LYS  67  -3.450 -23.225 -10.204
   11    HZ2  LYS  67           HZ1      LYS  67  -4.940 -23.260 -12.178
   12    HZ1  LYS  67           HZ2      LYS  67  -4.331 -24.799 -12.557
   13    HZ3  LYS  67           HZ3      LYS  67  -3.295 -23.452 -12.544

  No H/Q in entry =          13
  In of MODEL   62
    1    H    MET  68           H        MET  68   1.044 -26.026  -7.786
    2    HA   MET  68           HA       MET  68   1.853 -24.633  -5.590
    3    HB2  MET  68           HB2      MET  68   2.465 -24.045  -8.488
    4    HB3  MET  68           HB3      MET  68   3.380 -23.408  -7.121
    5    HG2  MET  68           HG2      MET  68   3.212 -26.136  -6.589
    6    HG3  MET  68           HG3      MET  68   3.475 -26.063  -8.333
    7    HE2  MET  68           HE1      MET  68   5.814 -24.558  -4.848
    8    HE1  MET  68           HE2      MET  68   4.100 -24.363  -5.209
    9    HE3  MET  68           HE3      MET  68   5.253 -23.155  -5.769

  No H/Q in entry =           9
  In of MODEL   62
    1    H    LYS  69           H        LYS  69  -0.768 -23.694  -7.486
    2    HA   LYS  69           HA       LYS  69  -0.483 -20.888  -7.458
    3    HB2  LYS  69           HB2      LYS  69  -1.994 -22.008  -8.994
    4    HB3  LYS  69           HB3      LYS  69  -3.027 -22.486  -7.643
    5    HG2  LYS  69           HG2      LYS  69  -3.928 -20.455  -8.643
    6    HG3  LYS  69           HG3      LYS  69  -3.289 -20.081  -7.042
    7    HD2  LYS  69           HD2      LYS  69  -1.405 -18.985  -7.908
    8    HD3  LYS  69           HD3      LYS  69  -1.546 -19.782  -9.477
    9    HE2  LYS  69           HE2      LYS  69  -3.615 -18.524  -9.941
   10    HE3  LYS  69           HE3      LYS  69  -3.487 -17.731  -8.371
   11    HZ3  LYS  69           HZ1      LYS  69  -1.644 -16.540  -9.020
   12    HZ2  LYS  69           HZ2      LYS  69  -2.567 -16.552 -10.446
   13    HZ1  LYS  69           HZ3      LYS  69  -1.246 -17.608 -10.276

  No H/Q in entry =          13
  In of MODEL   62
    1    H    VAL  70           H        VAL  70  -1.196 -19.258  -6.173
    2    HA   VAL  70           HA       VAL  70  -2.285 -20.008  -3.514
    3    HB   VAL  70           HB       VAL  70  -1.076 -18.016  -2.645
    4   HG11  VAL  70          HG11      VAL  70  -0.080 -20.400  -2.830
    5   HG13  VAL  70          HG12      VAL  70   1.033 -19.068  -2.515
    6   HG12  VAL  70          HG13      VAL  70   0.896 -19.737  -4.141
    7   HG22  VAL  70          HG21      VAL  70  -0.861 -16.544  -4.495
    8   HG21  VAL  70          HG22      VAL  70  -0.229 -17.815  -5.539
    9   HG23  VAL  70          HG23      VAL  70   0.784 -17.142  -4.266

  No H/Q in entry =           9
  In of MODEL   62
    1    H    SER  71           H        SER  71  -3.512 -18.257  -2.474
    2    HA   SER  71           HA       SER  71  -5.623 -17.283  -4.075
    3    HB2  SER  71           HB2      SER  71  -5.631 -17.658  -1.534
    4    HB3  SER  71           HB3      SER  71  -4.780 -16.122  -1.404
    5    HG   SER  71           HG       SER  71  -7.270 -16.532  -2.714

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LEU  72           H        LEU  72  -5.598 -15.724  -5.445
    2    HA   LEU  72           HA       LEU  72  -3.439 -13.972  -5.921
    3    HB2  LEU  72           HB2      LEU  72  -6.307 -13.934  -6.857
    4    HB3  LEU  72           HB3      LEU  72  -5.078 -12.809  -7.430
    5    HG   LEU  72           HG       LEU  72  -4.746 -15.823  -7.576
    6   HD13  LEU  72          HD11      LEU  72  -5.427 -15.669  -9.911
    7   HD12  LEU  72          HD12      LEU  72  -5.657 -13.927  -9.760
    8   HD11  LEU  72          HD13      LEU  72  -6.720 -15.035  -8.892
    9   HD22  LEU  72          HD21      LEU  72  -2.617 -14.854  -7.848
   10   HD21  LEU  72          HD22      LEU  72  -3.246 -13.438  -8.674
   11   HD23  LEU  72          HD23      LEU  72  -3.185 -14.988  -9.509

  No H/Q in entry =          11
  In of MODEL   62
    1    H    VAL  73           H        VAL  73  -6.515 -13.536  -4.278
    2    HA   VAL  73           HA       VAL  73  -6.477 -10.768  -3.906
    3    HB   VAL  73           HB       VAL  73  -8.221 -11.077  -2.369
    4   HG11  VAL  73          HG11      VAL  73  -8.486 -12.063  -4.755
    5   HG13  VAL  73          HG12      VAL  73  -9.687 -12.499  -3.541
    6   HG12  VAL  73          HG13      VAL  73  -8.402 -13.634  -3.956
    7   HG21  VAL  73          HG21      VAL  73  -6.958 -13.783  -1.882
    8   HG23  VAL  73          HG22      VAL  73  -8.586 -13.387  -1.331
    9   HG22  VAL  73          HG23      VAL  73  -7.203 -12.479  -0.721

  No H/Q in entry =           9
  In of MODEL   62
    1    H    LEU  74           H        LEU  74  -4.605 -13.203  -2.347
    2    HA   LEU  74           HA       LEU  74  -4.152 -12.094   0.183
    3    HB2  LEU  74           HB2      LEU  74  -3.436 -14.330  -0.335
    4    HB3  LEU  74           HB3      LEU  74  -2.367 -13.740  -1.608
    5    HG   LEU  74           HG       LEU  74  -1.023 -12.536   0.083
    6   HD12  LEU  74          HD11      LEU  74  -1.523 -13.275   2.516
    7   HD11  LEU  74          HD12      LEU  74  -3.133 -13.677   1.916
    8   HD13  LEU  74          HD13      LEU  74  -2.545 -12.016   1.822
    9   HD23  LEU  74          HD21      LEU  74  -1.297 -15.291   1.162
   10   HD22  LEU  74          HD22      LEU  74   0.127 -14.406   0.665
   11   HD21  LEU  74          HD23      LEU  74  -0.913 -15.113  -0.549

  No H/Q in entry =          11
  In of MODEL   62
    1    H    VAL  75           H        VAL  75  -2.260 -11.734  -2.778
    2    HA   VAL  75           HA       VAL  75  -0.404  -9.871  -1.760
    3    HB   VAL  75           HB       VAL  75  -1.382 -10.318  -4.581
    4   HG11  VAL  75          HG11      VAL  75   0.927  -8.637  -3.509
    5   HG13  VAL  75          HG12      VAL  75  -0.479  -8.047  -4.381
    6   HG12  VAL  75          HG13      VAL  75   0.702  -9.054  -5.203
    7   HG21  VAL  75          HG21      VAL  75  -0.169 -12.179  -3.369
    8   HG23  VAL  75          HG22      VAL  75   1.208 -11.091  -3.196
    9   HG22  VAL  75          HG23      VAL  75   0.674 -11.590  -4.803

  No H/Q in entry =           9
  In of MODEL   62
    1    H    GLU  76           H        GLU  76  -3.548  -9.419  -3.404
    2    HA   GLU  76           HA       GLU  76  -3.518  -6.603  -3.484
    3    HB2  GLU  76           HB2      GLU  76  -5.220  -8.038  -4.633
    4    HB3  GLU  76           HB3      GLU  76  -5.909  -8.435  -3.067
    5    HG2  GLU  76           HG2      GLU  76  -6.446  -6.053  -2.687
    6    HG3  GLU  76           HG3      GLU  76  -5.778  -5.634  -4.253

  No H/Q in entry =           6
  In of MODEL   62
    1    H    ALA  77           H        ALA  77  -4.684  -8.817  -0.957
    2    HA   ALA  77           HA       ALA  77  -5.576  -6.801   0.820
    3    HB2  ALA  77           HB1      ALA  77  -6.179  -9.204   1.019
    4    HB3  ALA  77           HB2      ALA  77  -5.552  -8.538   2.525
    5    HB1  ALA  77           HB3      ALA  77  -4.525  -9.555   1.517

  No H/Q in entry =           5
  In of MODEL   62
    1    H    GLN  78           H        GLN  78  -2.477  -8.440   0.433
    2    HA   GLN  78           HA       GLN  78  -1.177  -7.334   2.687
    3    HB2  GLN  78           HB2      GLN  78  -0.411  -9.290   1.242
    4    HB3  GLN  78           HB3      GLN  78   0.142  -8.094   0.072
    5    HG2  GLN  78           HG2      GLN  78   1.646  -7.118   1.703
    6    HG3  GLN  78           HG3      GLN  78   1.015  -8.166   2.972
    7   HE21  GLN  78          HE21      GLN  78   2.219  -8.709  -0.403
    8   HE22  GLN  78          HE22      GLN  78   3.241  -9.995   0.027

  No H/Q in entry =           8
  In of MODEL   62
    1    H    LEU  79           H        LEU  79  -1.524  -6.238  -0.651
    2    HA   LEU  79           HA       LEU  79   0.229  -4.063  -0.627
    3    HB2  LEU  79           HB2      LEU  79  -0.829  -4.823  -2.683
    4    HB3  LEU  79           HB3      LEU  79  -2.418  -4.387  -2.066
    5    HG   LEU  79           HG       LEU  79  -1.802  -2.018  -2.024
    6   HD13  LEU  79          HD11      LEU  79   0.447  -1.846  -1.518
    7   HD12  LEU  79          HD12      LEU  79   0.498  -1.547  -3.255
    8   HD11  LEU  79          HD13      LEU  79   0.907  -3.143  -2.622
    9   HD23  LEU  79          HD21      LEU  79  -1.171  -1.819  -4.577
   10   HD22  LEU  79          HD22      LEU  79  -2.717  -2.524  -4.118
   11   HD21  LEU  79          HD23      LEU  79  -1.378  -3.570  -4.575

  No H/Q in entry =          11
  In of MODEL   62
    1    H    HIS  80           H        HIS  80  -3.238  -4.126   0.211
    2    HA   HIS  80           HA       HIS  80  -3.343  -1.370   0.896
    3    HB2  HIS  80           HB2      HIS  80  -5.116  -3.728   1.203
    4    HB3  HIS  80           HB3      HIS  80  -5.392  -2.387   2.318
    5    HD1  HIS  80           HD1      HIS  80  -6.962  -0.695   1.429
    6    HD2  HIS  80           HD2      HIS  80  -4.836  -2.550  -1.641
    7    HE1  HIS  80           HE1      HIS  80  -7.778   0.344  -0.740
    8    HE2  HIS  80           HE2      HIS  80  -6.489  -0.781  -2.620

  No H/Q in entry =           8
  In of MODEL   62
    1    H    LEU  81           H        LEU  81  -2.937  -4.293   2.865
    2    HA   LEU  81           HA       LEU  81  -2.874  -2.966   5.359
    3    HB2  LEU  81           HB2      LEU  81  -1.740  -5.612   4.456
    4    HB3  LEU  81           HB3      LEU  81  -1.691  -5.067   6.134
    5    HG   LEU  81           HG       LEU  81  -4.249  -5.228   4.513
    6   HD12  LEU  81          HD11      LEU  81  -4.610  -7.295   6.047
    7   HD11  LEU  81          HD12      LEU  81  -2.856  -7.280   6.226
    8   HD13  LEU  81          HD13      LEU  81  -3.577  -7.476   4.628
    9   HD23  LEU  81          HD21      LEU  81  -5.089  -5.424   7.016
   10   HD22  LEU  81          HD22      LEU  81  -4.717  -3.841   6.337
   11   HD21  LEU  81          HD23      LEU  81  -3.551  -4.646   7.387

  No H/Q in entry =          11
  In of MODEL   62
    1    H    MET  82           H        MET  82  -0.230  -3.936   3.172
    2    HA   MET  82           HA       MET  82   1.886  -3.120   4.854
    3    HB2  MET  82           HB2      MET  82   1.650  -3.432   1.861
    4    HB3  MET  82           HB3      MET  82   3.152  -2.913   2.623
    5    HG2  MET  82           HG2      MET  82   1.667  -5.463   3.333
    6    HG3  MET  82           HG3      MET  82   3.037  -5.388   2.229
    7    HE3  MET  82           HE1      MET  82   6.082  -4.762   4.206
    8    HE2  MET  82           HE2      MET  82   5.200  -3.361   3.602
    9    HE1  MET  82           HE3      MET  82   5.238  -4.847   2.655

  No H/Q in entry =           9
  In of MODEL   62
    1    H    THR  83           H        THR  83   0.107  -1.402   2.317
    2    HA   THR  83           HA       THR  83   1.596   1.000   2.416
    3    HB   THR  83           HB       THR  83  -0.553   2.000   1.445
    4    HG1  THR  83           HG1      THR  83  -2.244   0.756   1.335
    5   HG22  THR  83          HG21      THR  83  -0.348   0.190  -0.570
    6   HG21  THR  83          HG22      THR  83   1.146  -0.156   0.299
    7   HG23  THR  83          HG23      THR  83   0.834   1.472  -0.303

  No H/Q in entry =           7
  In of MODEL   62
    1    H    SER  84           H        SER  84  -1.435   0.051   4.021
    2    HA   SER  84           HA       SER  84  -1.849   2.485   5.385
    3    HB2  SER  84           HB2      SER  84  -2.770  -0.329   5.932
    4    HB3  SER  84           HB3      SER  84  -3.217   1.019   6.977
    5    HG   SER  84           HG       SER  84  -3.695   0.741   4.184

  No H/Q in entry =           5
  In of MODEL   62
    1    H    MET  85           H        MET  85  -0.229  -0.508   6.487
    2    HA   MET  85           HA       MET  85   0.329   0.382   9.096
    3    HB2  MET  85           HB2      MET  85   0.544  -1.965   8.396
    4    HB3  MET  85           HB3      MET  85   1.940  -1.536   7.405
    5    HG2  MET  85           HG2      MET  85   3.144  -0.764   9.408
    6    HG3  MET  85           HG3      MET  85   1.741  -1.140  10.406
    7    HE2  MET  85           HE1      MET  85   5.144  -2.737   9.094
    8    HE1  MET  85           HE2      MET  85   4.060  -2.322   7.768
    9    HE3  MET  85           HE3      MET  85   4.429  -4.012   8.100

  No H/Q in entry =           9
  In of MODEL   62
    1    H    LEU  86           H        LEU  86   2.260   0.598   6.139
    2    HA   LEU  86           HA       LEU  86   4.519   1.828   7.295
    3    HB2  LEU  86           HB2      LEU  86   4.285   0.770   4.980
    4    HB3  LEU  86           HB3      LEU  86   3.523   2.280   4.481
    5    HG   LEU  86           HG       LEU  86   5.594   3.453   5.462
    6   HD11  LEU  86          HD11      LEU  86   6.217   0.815   6.240
    7   HD13  LEU  86          HD12      LEU  86   7.267   2.226   6.344
    8   HD12  LEU  86          HD13      LEU  86   7.337   1.185   4.925
    9   HD23  LEU  86          HD21      LEU  86   6.245   1.685   3.096
   10   HD22  LEU  86          HD22      LEU  86   6.693   3.367   3.369
   11   HD21  LEU  86          HD23      LEU  86   5.025   2.955   2.974

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ALA  87           H        ALA  87   1.643   3.176   5.731
    2    HA   ALA  87           HA       ALA  87   2.325   5.885   5.832
    3    HB1  ALA  87           HB1      ALA  87  -0.038   4.336   5.289
    4    HB3  ALA  87           HB2      ALA  87   0.325   5.990   4.799
    5    HB2  ALA  87           HB3      ALA  87  -0.473   5.683   6.343

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ARG  88           H        ARG  88   0.580   3.922   8.215
    2    HA   ARG  88           HA       ARG  88   0.142   5.973  10.078
    3    HB2  ARG  88           HB2      ARG  88  -0.872   3.652  10.131
    4    HB3  ARG  88           HB3      ARG  88   0.655   3.097  10.828
    5    HG2  ARG  88           HG2      ARG  88   0.251   5.174  12.464
    6    HG3  ARG  88           HG3      ARG  88  -1.427   4.906  12.012
    7    HD2  ARG  88           HD2      ARG  88  -1.589   3.052  13.246
    8    HD3  ARG  88           HD3      ARG  88  -0.021   2.423  12.705
    9    HE   ARG  88           HE       ARG  88  -0.505   3.686  15.170
   10   HH21  ARG  88          HH11      ARG  88   1.090   4.638  16.409
   11   HH22  ARG  88          HH12      ARG  88   2.619   5.021  15.702
   12   HH11  ARG  88          HH21      ARG  88   1.771   3.812  12.585
   13   HH12  ARG  88          HH22      ARG  88   3.013   4.537  13.548

  No H/Q in entry =          13
  In of MODEL   62
    1    H    GLU  89           H        GLU  89   2.865   3.667   9.828
    2    HA   GLU  89           HA       GLU  89   4.163   4.499  12.173
    3    HB2  GLU  89           HB2      GLU  89   4.752   2.470  10.813
    4    HB3  GLU  89           HB3      GLU  89   5.558   3.547   9.671
    5    HG2  GLU  89           HG2      GLU  89   7.075   4.334  11.415
    6    HG3  GLU  89           HG3      GLU  89   6.215   3.396  12.631

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LEU  90           H        LEU  90   4.504   5.669   8.852
    2    HA   LEU  90           HA       LEU  90   6.499   7.604   9.444
    3    HB2  LEU  90           HB2      LEU  90   4.475   7.352   7.222
    4    HB3  LEU  90           HB3      LEU  90   5.745   8.582   7.248
    5    HG   LEU  90           HG       LEU  90   6.327   5.624   7.558
    6   HD12  LEU  90          HD11      LEU  90   7.074   5.851   5.117
    7   HD11  LEU  90          HD12      LEU  90   6.104   7.323   5.083
    8   HD13  LEU  90          HD13      LEU  90   5.336   5.771   5.418
    9   HD22  LEU  90          HD21      LEU  90   8.262   6.709   8.241
   10   HD21  LEU  90          HD22      LEU  90   7.953   8.131   7.245
   11   HD23  LEU  90          HD23      LEU  90   8.564   6.651   6.506

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  91           H        ILE  91   2.962   7.731   9.309
    2    HA   ILE  91           HA       ILE  91   2.708  10.510   9.780
    3    HB   ILE  91           HB       ILE  91   0.845   8.187  10.313
    4   HG12  ILE  91          HG12      ILE  91   0.661  10.489   8.345
    5   HG13  ILE  91          HG13      ILE  91   1.473   8.972   7.960
    6   HG22  ILE  91          HG21      ILE  91  -0.822  10.298  10.398
    7   HG21  ILE  91          HG22      ILE  91   0.607  11.080  11.071
    8   HG23  ILE  91          HG23      ILE  91  -0.071   9.657  11.860
    9   HD13  ILE  91          HD11      ILE  91  -0.510   7.745   8.003
   10   HD12  ILE  91          HD12      ILE  91  -1.055   9.282   7.334
   11   HD11  ILE  91          HD13      ILE  91  -1.331   8.915   9.037

  No H/Q in entry =          11
  In of MODEL   62
    1    H    THR  92           H        THR  92   3.034   7.742  11.961
    2    HA   THR  92           HA       THR  92   2.641   9.111  14.396
    3    HB   THR  92           HB       THR  92   4.375   6.727  13.708
    4    HG1  THR  92           HG1      THR  92   2.383   6.031  13.610
    5   HG22  THR  92          HG21      THR  92   3.992   6.436  16.342
    6   HG21  THR  92          HG22      THR  92   3.981   8.197  16.280
    7   HG23  THR  92          HG23      THR  92   5.385   7.302  15.697

  No H/Q in entry =           7
  In of MODEL   62
    1    H    GLU  93           H        GLU  93   5.571   8.586  12.449
    2    HA   GLU  93           HA       GLU  93   7.373   9.947  14.149
    3    HB2  GLU  93           HB2      GLU  93   7.441   9.651  11.131
    4    HB3  GLU  93           HB3      GLU  93   8.801  10.133  12.144
    5    HG2  GLU  93           HG2      GLU  93   7.314   7.538  12.579
    6    HG3  GLU  93           HG3      GLU  93   8.697   7.655  11.499

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LEU  94           H        LEU  94   5.346  11.042  11.450
    2    HA   LEU  94           HA       LEU  94   6.232  13.721  11.365
    3    HB2  LEU  94           HB2      LEU  94   3.599  12.440  10.611
    4    HB3  LEU  94           HB3      LEU  94   3.909  14.160  10.381
    5    HG   LEU  94           HG       LEU  94   5.862  12.120   9.310
    6   HD11  LEU  94          HD11      LEU  94   3.134  12.759   8.261
    7   HD13  LEU  94          HD12      LEU  94   4.073  11.275   8.122
    8   HD12  LEU  94          HD13      LEU  94   4.446  12.652   7.086
    9   HD23  LEU  94          HD21      LEU  94   6.161  13.959   7.599
   10   HD22  LEU  94          HD22      LEU  94   6.596  14.429   9.242
   11   HD21  LEU  94          HD23      LEU  94   5.057  14.947   8.553

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  95           H        ILE  95   3.654  12.168  13.254
    2    HA   ILE  95           HA       ILE  95   2.685  14.539  14.469
    3    HB   ILE  95           HB       ILE  95   2.620  11.652  15.374
    4   HG12  ILE  95          HG12      ILE  95   0.449  13.497  14.344
    5   HG13  ILE  95          HG13      ILE  95   1.370  12.417  13.302
    6   HG21  ILE  95          HG21      ILE  95   1.415  14.153  16.597
    7   HG23  ILE  95          HG22      ILE  95   2.431  12.949  17.390
    8   HG22  ILE  95          HG23      ILE  95   0.781  12.539  16.917
    9   HD13  ILE  95          HD11      ILE  95   0.414  10.500  14.211
   10   HD12  ILE  95          HD12      ILE  95  -0.935  11.629  14.300
   11   HD11  ILE  95          HD13      ILE  95   0.025  11.293  15.739

  No H/Q in entry =          11
  In of MODEL   62
    1    H    GLU  96           H        GLU  96   5.217  12.239  15.441
    2    HA   GLU  96           HA       GLU  96   5.815  13.404  17.938
    3    HB2  GLU  96           HB2      GLU  96   6.697  11.223  17.274
    4    HB3  GLU  96           HB3      GLU  96   7.649  11.977  15.996
    5    HG2  GLU  96           HG2      GLU  96   9.317  12.468  17.456
    6    HG3  GLU  96           HG3      GLU  96   8.198  13.307  18.520

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LEU  97           H        LEU  97   6.901  14.167  14.654
    2    HA   LEU  97           HA       LEU  97   8.846  16.103  15.373
    3    HB2  LEU  97           HB2      LEU  97   7.231  15.617  12.879
    4    HB3  LEU  97           HB3      LEU  97   8.292  17.017  13.007
    5    HG   LEU  97           HG       LEU  97   9.242  14.188  13.545
    6   HD12  LEU  97          HD11      LEU  97  10.236  14.368  11.226
    7   HD11  LEU  97          HD12      LEU  97   9.224  15.790  10.975
    8   HD13  LEU  97          HD13      LEU  97   8.481  14.217  11.262
    9   HD23  LEU  97          HD21      LEU  97  11.444  15.409  12.804
   10   HD22  LEU  97          HD22      LEU  97  10.838  15.685  14.436
   11   HD21  LEU  97          HD23      LEU  97  10.554  16.885  13.177

  No H/Q in entry =          11
  In of MODEL   62
    1    H    HIS  98           H        HIS  98   5.358  16.342  14.731
    2    HA   HIS  98           HA       HIS  98   5.138  19.148  14.885
    3    HB2  HIS  98           HB2      HIS  98   3.188  16.948  15.603
    4    HB3  HIS  98           HB3      HIS  98   2.769  18.660  15.671
    5    HD1  HIS  98           HD1      HIS  98   3.706  15.933  13.245
    6    HD2  HIS  98           HD2      HIS  98   2.441  19.905  13.153
    7    HE1  HIS  98           HE1      HIS  98   3.153  16.454  10.826
    8    HE2  HIS  98           HE2      HIS  98   2.386  18.867  10.749

  No H/Q in entry =           8
  In of MODEL   62
    1    H    GLU  99           H        GLU  99   5.209  16.640  17.368
    2    HA   GLU  99           HA       GLU  99   4.656  18.337  19.579
    3    HB2  GLU  99           HB2      GLU  99   4.497  15.857  19.660
    4    HB3  GLU  99           HB3      GLU  99   6.255  15.764  19.545
    5    HG2  GLU  99           HG2      GLU  99   6.486  17.036  21.627
    6    HG3  GLU  99           HG3      GLU  99   4.739  17.226  21.730

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LYS 100           H        LYS 100   7.677  17.330  17.998
    2    HA   LYS 100           HA       LYS 100   9.377  18.671  19.858
    3    HB2  LYS 100           HB2      LYS 100   9.840  17.752  17.012
    4    HB3  LYS 100           HB3      LYS 100  11.095  18.480  18.021
    5    HG2  LYS 100           HG2      LYS 100  10.674  16.729  19.751
    6    HG3  LYS 100           HG3      LYS 100   9.517  15.965  18.659
    7    HD2  LYS 100           HD2      LYS 100  11.297  15.642  16.984
    8    HD3  LYS 100           HD3      LYS 100  12.460  16.418  18.062
    9    HE2  LYS 100           HE2      LYS 100  12.019  14.663  19.769
   10    HE3  LYS 100           HE3      LYS 100  10.917  13.866  18.642
   11    HZ1  LYS 100           HZ1      LYS 100  13.754  14.460  17.982
   12    HZ3  LYS 100           HZ2      LYS 100  12.678  13.440  17.150
   13    HZ2  LYS 100           HZ3      LYS 100  13.259  12.994  18.684

  No H/Q in entry =          13
  In of MODEL   62
    1    H    LEU 101           H        LEU 101   7.701  19.665  16.914
    2    HA   LEU 101           HA       LEU 101   8.986  22.189  16.592
    3    HB2  LEU 101           HB2      LEU 101   6.354  21.036  15.706
    4    HB3  LEU 101           HB3      LEU 101   6.653  22.760  15.509
    5    HG   LEU 101           HG       LEU 101   8.628  20.694  14.523
    6   HD12  LEU 101          HD11      LEU 101   7.483  21.247  12.246
    7   HD11  LEU 101          HD12      LEU 101   6.099  21.710  13.234
    8   HD13  LEU 101          HD13      LEU 101   6.717  20.061  13.302
    9   HD21  LEU 101          HD21      LEU 101   8.082  23.626  13.989
   10   HD23  LEU 101          HD22      LEU 101   9.031  22.646  12.873
   11   HD22  LEU 101          HD23      LEU 101   9.585  22.877  14.531

  No H/Q in entry =          11
  In of MODEL   62
    1    H    LYS 102           H        LYS 102   7.426  21.078  19.205
    2    HA   LYS 102           HA       LYS 102   6.831  22.174  21.147
    3    HB2  LYS 102           HB2      LYS 102   8.166  24.134  20.032
    4    HB3  LYS 102           HB3      LYS 102   6.584  24.787  19.665
    5    HG2  LYS 102           HG2      LYS 102   7.962  24.474  22.311
    6    HG3  LYS 102           HG3      LYS 102   7.045  25.833  21.694
    7    HD2  LYS 102           HD2      LYS 102   5.729  23.228  22.560
    8    HD3  LYS 102           HD3      LYS 102   6.020  24.574  23.651
    9    HE2  LYS 102           HE2      LYS 102   3.726  24.246  22.167
   10    HE3  LYS 102           HE3      LYS 102   4.275  25.772  22.858
   11    HZ2  LYS 102           HZ1      LYS 102   3.740  25.912  20.481
   12    HZ1  LYS 102           HZ2      LYS 102   4.969  24.796  20.146
   13    HZ3  LYS 102           HZ3      LYS 102   5.358  26.312  20.798

  No H/Q in entry =          13
  In of MODEL   62
    1    H    ALA 103           H        ALA 103   5.229  23.782  18.396
    2    HA   ALA 103           HA       ALA 103   2.795  24.423  19.293
    3    HB1  ALA 103           HB1      ALA 103   1.866  23.622  17.048
    4    HB2  ALA 103           HB2      ALA 103   3.496  23.041  16.709
    5    HB3  ALA 103           HB3      ALA 103   3.211  24.760  16.988

  No H/Q in entry =           5
  In of MODEL   62
    1    H1   ALA   1           H3       ALA   1  10.027 -20.132  -6.312
    2    H2   ALA   1           H2       ALA   1   9.053 -20.300  -7.696
    3    H3   ALA   1           H1       ALA   1   8.599 -21.043  -6.236
    4    HA   ALA   1           HA       ALA   1   9.582 -22.877  -6.992
    5    HB1  ALA   1           HB1      ALA   1   9.681 -22.505  -9.265
    6    HB2  ALA   1           HB2      ALA   1  11.413 -22.407  -8.941
    7    HB3  ALA   1           HB3      ALA   1  10.457 -20.930  -9.079

  No H/Q in entry =           7
  In of MODEL   62
    1    H    GLU   2           H        GLU   2  11.837 -23.893  -7.064
    2    HA   GLU   2           HA       GLU   2  13.228 -23.868  -4.857
    3    HB2  GLU   2           HB2      GLU   2  14.578 -23.758  -7.560
    4    HB3  GLU   2           HB3      GLU   2  15.293 -24.400  -6.082
    5    HG2  GLU   2           HG2      GLU   2  14.216 -26.385  -6.333
    6    HG3  GLU   2           HG3      GLU   2  12.667 -25.591  -6.581

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLU   3           H        GLU   3  15.045 -22.040  -7.252
    2    HA   GLU   3           HA       GLU   3  16.254 -20.401  -5.285
    3    HB2  GLU   3           HB2      GLU   3  16.188 -20.376  -8.295
    4    HB3  GLU   3           HB3      GLU   3  16.976 -19.076  -7.401
    5    HG2  GLU   3           HG2      GLU   3  18.600 -20.506  -6.495
    6    HG3  GLU   3           HG3      GLU   3  17.610 -21.942  -6.722

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LEU   4           H        LEU   4  13.989 -19.468  -7.902
    2    HA   LEU   4           HA       LEU   4  13.603 -16.851  -7.271
    3    HB2  LEU   4           HB2      LEU   4  11.367 -18.755  -8.006
    4    HB3  LEU   4           HB3      LEU   4  11.343 -17.003  -8.193
    5    HG   LEU   4           HG       LEU   4  13.247 -18.914  -9.586
    6   HD13  LEU   4          HD11      LEU   4  11.943 -18.713 -11.490
    7   HD12  LEU   4          HD12      LEU   4  11.283 -17.151 -11.009
    8   HD11  LEU   4          HD13      LEU   4  10.688 -18.630 -10.256
    9   HD23  LEU   4          HD21      LEU   4  13.645 -16.670 -10.923
   10   HD22  LEU   4          HD22      LEU   4  14.503 -16.949  -9.409
   11   HD21  LEU   4          HD23      LEU   4  13.080 -15.910  -9.435

  No H/Q in entry =          11
  In of MODEL   62
    1    H    GLU   5           H        GLU   5  12.042 -19.601  -5.642
    2    HA   GLU   5           HA       GLU   5  10.418 -17.992  -3.922
    3    HB2  GLU   5           HB2      GLU   5   9.995 -20.396  -4.498
    4    HB3  GLU   5           HB3      GLU   5  11.344 -20.820  -3.442
    5    HG2  GLU   5           HG2      GLU   5   9.346 -20.989  -2.119
    6    HG3  GLU   5           HG3      GLU   5  10.184 -19.527  -1.605

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLU   6           H        GLU   6  13.517 -19.667  -3.502
    2    HA   GLU   6           HA       GLU   6  13.905 -18.841  -0.799
    3    HB2  GLU   6           HB2      GLU   6  15.067 -20.784  -1.830
    4    HB3  GLU   6           HB3      GLU   6  15.976 -19.667  -2.849
    5    HG2  GLU   6           HG2      GLU   6  17.358 -20.186  -0.945
    6    HG3  GLU   6           HG3      GLU   6  16.779 -18.533  -0.742

  No H/Q in entry =           6
  In of MODEL   62
    1    H    VAL   7           H        VAL   7  14.698 -17.515  -3.943
    2    HA   VAL   7           HA       VAL   7  16.449 -15.445  -3.070
    3    HB   VAL   7           HB       VAL   7  14.724 -15.741  -5.543
    4   HG11  VAL   7          HG11      VAL   7  16.685 -13.590  -4.723
    5   HG13  VAL   7          HG12      VAL   7  15.045 -13.395  -5.339
    6   HG12  VAL   7          HG13      VAL   7  16.335 -13.928  -6.418
    7   HG21  VAL   7          HG21      VAL   7  16.790 -17.263  -4.992
    8   HG23  VAL   7          HG22      VAL   7  17.736 -15.826  -5.384
    9   HG22  VAL   7          HG23      VAL   7  16.673 -16.537  -6.596

  No H/Q in entry =           9
  In of MODEL   62
    1    H    VAL   8           H        VAL   8  12.948 -15.609  -3.615
    2    HA   VAL   8           HA       VAL   8  12.363 -12.886  -3.122
    3    HB   VAL   8           HB       VAL   8  10.729 -15.409  -2.827
    4   HG11  VAL   8          HG11      VAL   8  10.040 -12.553  -2.152
    5   HG13  VAL   8          HG12      VAL   8   9.699 -14.017  -1.231
    6   HG12  VAL   8          HG13      VAL   8   8.792 -13.669  -2.702
    7   HG21  VAL   8          HG21      VAL   8  11.359 -13.558  -4.991
    8   HG23  VAL   8          HG22      VAL   8   9.625 -13.575  -4.687
    9   HG22  VAL   8          HG23      VAL   8  10.464 -15.076  -5.066

  No H/Q in entry =           9
  In of MODEL   62
    1    H    MET   9           H        MET   9  12.556 -15.713  -0.963
    2    HA   MET   9           HA       MET   9  11.787 -14.435   1.419
    3    HB2  MET   9           HB2      MET   9  13.632 -16.757   0.861
    4    HB3  MET   9           HB3      MET   9  13.339 -16.183   2.502
    5    HG2  MET   9           HG2      MET   9  10.911 -16.505   2.184
    6    HG3  MET   9           HG3      MET   9  11.209 -17.093   0.546
    7    HE3  MET   9           HE1      MET   9  12.496 -18.886   4.512
    8    HE2  MET   9           HE2      MET   9  10.799 -18.461   4.303
    9    HE1  MET   9           HE3      MET   9  12.040 -17.229   4.098

  No H/Q in entry =           9
  In of MODEL   62
    1    H    GLY  10           H        GLY  10  14.954 -14.740  -0.151
    2    HA3  GLY  10           HA2      GLY  10  16.460 -13.375   1.823
    3    HA2  GLY  10           HA3      GLY  10  16.913 -13.542   0.127

  No H/Q in entry =           3
  In of MODEL   62
    1    H    LEU  11           H        LEU  11  14.776 -12.251  -1.096
    2    HA   LEU  11           HA       LEU  11  15.538  -9.527  -0.916
    3    HB2  LEU  11           HB2      LEU  11  13.127 -10.861  -2.152
    4    HB3  LEU  11           HB3      LEU  11  13.456  -9.134  -2.301
    5    HG   LEU  11           HG       LEU  11  15.421 -11.293  -3.111
    6   HD13  LEU  11          HD11      LEU  11  13.660 -11.600  -4.627
    7   HD12  LEU  11          HD12      LEU  11  14.693 -10.442  -5.463
    8   HD11  LEU  11          HD13      LEU  11  13.237  -9.888  -4.635
    9   HD22  LEU  11          HD21      LEU  11  16.708  -9.367  -2.876
   10   HD21  LEU  11          HD22      LEU  11  15.361  -8.289  -3.243
   11   HD23  LEU  11          HD23      LEU  11  16.163  -9.172  -4.540

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  12           H        ILE  12  12.724 -11.284   0.349
    2    HA   ILE  12           HA       ILE  12  11.397  -9.030   1.429
    3    HB   ILE  12           HB       ILE  12  11.358 -11.933   2.308
    4   HG12  ILE  12          HG12      ILE  12  10.611 -11.233  -0.078
    5   HG13  ILE  12          HG13      ILE  12   9.521 -12.238   0.855
    6   HG22  ILE  12          HG21      ILE  12   9.035 -11.173   3.213
    7   HG21  ILE  12          HG22      ILE  12   9.711  -9.546   3.149
    8   HG23  ILE  12          HG23      ILE  12  10.471 -10.778   4.157
    9   HD13  ILE  12          HD11      ILE  12   8.189 -10.286   1.436
   10   HD12  ILE  12          HD12      ILE  12   8.388 -10.350  -0.314
   11   HD11  ILE  12          HD13      ILE  12   9.341  -9.231   0.636

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  13           H        ILE  13  13.733 -11.309   2.811
    2    HA   ILE  13           HA       ILE  13  13.810 -10.149   5.399
    3    HB   ILE  13           HB       ILE  13  15.829 -11.759   3.818
    4   HG12  ILE  13          HG12      ILE  13  13.518 -12.669   4.647
    5   HG13  ILE  13          HG13      ILE  13  14.966 -13.643   4.882
    6   HG22  ILE  13          HG21      ILE  13  16.751 -12.173   6.246
    7   HG21  ILE  13          HG22      ILE  13  15.999 -10.623   6.603
    8   HG23  ILE  13          HG23      ILE  13  17.252 -10.730   5.366
    9   HD12  ILE  13          HD11      ILE  13  13.314 -13.283   6.908
   10   HD11  ILE  13          HD12      ILE  13  14.106 -11.716   7.022
   11   HD13  ILE  13          HD13      ILE  13  15.052 -13.190   7.180

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ASN  14           H        ASN  14  15.767  -9.651   2.477
    2    HA   ASN  14           HA       ASN  14  17.566  -7.763   3.546
    3    HB2  ASN  14           HB2      ASN  14  17.502  -9.012   1.222
    4    HB3  ASN  14           HB3      ASN  14  16.645  -7.569   0.698
    5   HD21  ASN  14          HD21      ASN  14  19.071  -7.964  -0.499
    6   HD22  ASN  14          HD22      ASN  14  20.245  -6.915   0.132

  No H/Q in entry =           6
  In of MODEL   62
    1    H    SER  15           H        SER  15  14.459  -7.323   1.867
    2    HA   SER  15           HA       SER  15  14.421  -4.501   1.943
    3    HB2  SER  15           HB2      SER  15  12.083  -4.683   1.451
    4    HB3  SER  15           HB3      SER  15  12.840  -6.067   0.672
    5    HG   SER  15           HG       SER  15  11.461  -7.171   1.805

  No H/Q in entry =           5
  In of MODEL   62
    1    H    GLY  16           H        GLY  16  13.272  -6.948   4.233
    2    HA3  GLY  16           HA2      GLY  16  12.102  -5.181   6.107
    3    HA2  GLY  16           HA3      GLY  16  12.676  -6.807   6.456

  No H/Q in entry =           3
  In of MODEL   62
    1    H    GLN  17           H        GLN  17  15.393  -6.539   5.857
    2    HA   GLN  17           HA       GLN  17  16.388  -5.360   8.242
    3    HB2  GLN  17           HB2      GLN  17  17.559  -7.177   7.013
    4    HB3  GLN  17           HB3      GLN  17  17.912  -6.043   5.709
    5    HG2  GLN  17           HG2      GLN  17  19.847  -6.181   7.177
    6    HG3  GLN  17           HG3      GLN  17  19.108  -4.592   7.354
    7   HE21  GLN  17          HE21      GLN  17  19.608  -4.159   9.554
    8   HE22  GLN  17          HE22      GLN  17  19.090  -5.141  10.838

  No H/Q in entry =           8
  In of MODEL   62
    1    H    ALA  18           H        ALA  18  16.216  -4.254   4.890
    2    HA   ALA  18           HA       ALA  18  17.713  -1.900   5.129
    3    HB1  ALA  18           HB1      ALA  18  16.558  -3.072   3.057
    4    HB3  ALA  18           HB2      ALA  18  16.867  -1.336   3.052
    5    HB2  ALA  18           HB3      ALA  18  15.253  -1.944   3.423

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ARG  19           H        ARG  19  14.200  -2.403   5.533
    2    HA   ARG  19           HA       ARG  19  13.601   0.258   6.268
    3    HB2  ARG  19           HB2      ARG  19  11.875  -1.446   5.675
    4    HB3  ARG  19           HB3      ARG  19  12.201  -2.263   7.206
    5    HG2  ARG  19           HG2      ARG  19  11.545  -0.264   8.461
    6    HG3  ARG  19           HG3      ARG  19  11.312   0.629   6.959
    7    HD2  ARG  19           HD2      ARG  19   9.154  -0.119   7.781
    8    HD3  ARG  19           HD3      ARG  19   9.546  -0.998   6.297
    9    HE   ARG  19           HE       ARG  19  10.472  -2.579   8.389
   10   HH21  ARG  19          HH11      ARG  19   9.185  -4.193   9.320
   11   HH22  ARG  19          HH12      ARG  19   7.466  -4.122   9.155
   12   HH11  ARG  19          HH21      ARG  19   7.508  -1.204   7.312
   13   HH12  ARG  19          HH22      ARG  19   6.517  -2.430   8.014

  No H/Q in entry =          13
  In of MODEL   62
    1    H    SER  20           H        SER  20  14.394  -2.606   8.206
    2    HA   SER  20           HA       SER  20  14.146  -1.517  10.751
    3    HB2  SER  20           HB2      SER  20  14.553  -3.851  10.615
    4    HB3  SER  20           HB3      SER  20  16.005  -3.620   9.645
    5    HG   SER  20           HG       SER  20  15.581  -3.102  12.390

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LEU  21           H        LEU  21  16.984  -1.512   8.606
    2    HA   LEU  21           HA       LEU  21  18.700  -0.081  10.350
    3    HB2  LEU  21           HB2      LEU  21  18.663  -0.330   7.334
    4    HB3  LEU  21           HB3      LEU  21  19.942   0.490   8.226
    5    HG   LEU  21           HG       LEU  21  19.128  -2.384   8.749
    6   HD13  LEU  21          HD11      LEU  21  19.966  -2.380   6.519
    7   HD12  LEU  21          HD12      LEU  21  21.334  -2.857   7.525
    8   HD11  LEU  21          HD13      LEU  21  21.225  -1.208   6.913
    9   HD21  LEU  21          HD21      LEU  21  21.303  -0.550   9.739
   10   HD23  LEU  21          HD22      LEU  21  21.636  -2.275   9.639
   11   HD22  LEU  21          HD23      LEU  21  20.327  -1.693  10.656

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ALA  22           H        ALA  22  16.454   0.962   7.807
    2    HA   ALA  22           HA       ALA  22  17.061   3.706   7.839
    3    HB3  ALA  22           HB1      ALA  22  15.623   2.511   6.156
    4    HB2  ALA  22           HB2      ALA  22  14.956   4.037   6.736
    5    HB1  ALA  22           HB3      ALA  22  14.329   2.509   7.354

  No H/Q in entry =           5
  In of MODEL   62
    1    H    TYR  23           H        TYR  23  14.525   1.941   9.669
    2    HA   TYR  23           HA       TYR  23  13.623   4.191  11.136
    3    HB2  TYR  23           HB2      TYR  23  12.333   2.112  11.106
    4    HB3  TYR  23           HB3      TYR  23  13.647   1.260  11.916
    5    HD1  TYR  23           HD1      TYR  23  11.244   4.090  12.322
    6    HD2  TYR  23           HD2      TYR  23  13.832   1.269  14.270
    7    HE1  TYR  23           HE1      TYR  23  10.346   4.787  14.527
    8    HE2  TYR  23           HE2      TYR  23  12.934   1.966  16.473
    9    HH   TYR  23           HH       TYR  23  10.147   4.000  16.761

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ALA  24           H        ALA  24  16.212   1.845  11.750
    2    HA   ALA  24           HA       ALA  24  16.914   2.805  14.318
    3    HB3  ALA  24           HB1      ALA  24  18.224   0.979  14.137
    4    HB2  ALA  24           HB2      ALA  24  19.272   1.882  13.041
    5    HB1  ALA  24           HB3      ALA  24  17.950   0.911  12.397

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ALA  25           H        ALA  25  17.885   3.732  11.043
    2    HA   ALA  25           HA       ALA  25  19.882   5.612  11.696
    3    HB1  ALA  25           HB1      ALA  25  19.134   4.698   9.376
    4    HB3  ALA  25           HB2      ALA  25  19.679   6.372   9.479
    5    HB2  ALA  25           HB3      ALA  25  17.955   6.009   9.413

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LEU  26           H        LEU  26  16.373   5.933  11.347
    2    HA   LEU  26           HA       LEU  26  16.222   8.717  11.818
    3    HB2  LEU  26           HB2      LEU  26  14.326   7.536  10.887
    4    HB3  LEU  26           HB3      LEU  26  14.213   6.502  12.305
    5    HG   LEU  26           HG       LEU  26  13.662   8.465  13.701
    6   HD12  LEU  26          HD11      LEU  26  13.052  10.591  12.392
    7   HD11  LEU  26          HD12      LEU  26  14.012   9.922  11.075
    8   HD13  LEU  26          HD13      LEU  26  14.771  10.276  12.628
    9   HD21  LEU  26          HD21      LEU  26  11.972   8.213  11.194
   10   HD23  LEU  26          HD22      LEU  26  11.434   8.914  12.717
   11   HD22  LEU  26          HD23      LEU  26  11.841   7.202  12.634

  No H/Q in entry =          11
  In of MODEL   62
    1    H    LYS  27           H        LYS  27  16.047   5.926  13.992
    2    HA   LYS  27           HA       LYS  27  15.497   7.290  16.371
    3    HB2  LYS  27           HB2      LYS  27  15.460   4.817  16.089
    4    HB3  LYS  27           HB3      LYS  27  17.224   4.823  16.041
    5    HG2  LYS  27           HG2      LYS  27  17.306   5.791  18.297
    6    HG3  LYS  27           HG3      LYS  27  15.540   5.856  18.348
    7    HD2  LYS  27           HD2      LYS  27  15.449   3.392  18.094
    8    HD3  LYS  27           HD3      LYS  27  17.213   3.335  18.077
    9    HE2  LYS  27           HE2      LYS  27  17.280   4.307  20.340
   10    HE3  LYS  27           HE3      LYS  27  15.515   4.394  20.361
   11    HZ3  LYS  27           HZ1      LYS  27  16.254   2.413  21.495
   12    HZ2  LYS  27           HZ2      LYS  27  17.154   1.919  20.138
   13    HZ1  LYS  27           HZ3      LYS  27  15.456   1.970  20.064

  No H/Q in entry =          13
  In of MODEL   62
    1    H    GLN  28           H        GLN  28  18.593   6.636  14.766
    2    HA   GLN  28           HA       GLN  28  20.311   7.660  16.759
    3    HB2  GLN  28           HB2      GLN  28  20.587   7.624  13.742
    4    HB3  GLN  28           HB3      GLN  28  21.889   8.060  14.849
    5    HG2  GLN  28           HG2      GLN  28  20.406   5.416  14.890
    6    HG3  GLN  28           HG3      GLN  28  21.990   5.667  14.158
    7   HE21  GLN  28          HE21      GLN  28  20.731   4.349  16.851
    8   HE22  GLN  28          HE22      GLN  28  21.927   4.750  17.985

  No H/Q in entry =           8
  In of MODEL   62
    1    H    ALA  29           H        ALA  29  18.593   9.209  14.082
    2    HA   ALA  29           HA       ALA  29  19.664  11.799  14.351
    3    HB2  ALA  29           HB1      ALA  29  17.979  12.493  12.889
    4    HB1  ALA  29           HB2      ALA  29  16.805  11.347  13.535
    5    HB3  ALA  29           HB3      ALA  29  18.117  10.775  12.504

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LYS  30           H        LYS  30  16.848  10.266  15.869
    2    HA   LYS  30           HA       LYS  30  15.901  12.537  17.245
    3    HB2  LYS  30           HB2      LYS  30  15.709   9.595  17.928
    4    HB3  LYS  30           HB3      LYS  30  14.881  10.863  18.833
    5    HG2  LYS  30           HG2      LYS  30  13.770  11.595  16.723
    6    HG3  LYS  30           HG3      LYS  30  14.535  10.243  15.884
    7    HD2  LYS  30           HD2      LYS  30  13.422   8.655  17.405
    8    HD3  LYS  30           HD3      LYS  30  12.668   9.996  18.268
    9    HE2  LYS  30           HE2      LYS  30  11.512  10.676  16.183
   10    HE3  LYS  30           HE3      LYS  30  12.246   9.307  15.340
   11    HZ2  LYS  30           HZ1      LYS  30   9.929   8.956  16.225
   12    HZ1  LYS  30           HZ2      LYS  30  10.603   8.979  17.790
   13    HZ3  LYS  30           HZ3      LYS  30  11.074   7.788  16.670

  No H/Q in entry =          13
  In of MODEL   62
    1    H    GLN  31           H        GLN  31  18.502  10.288  17.958
    2    HA   GLN  31           HA       GLN  31  18.866  11.274  20.659
    3    HB2  GLN  31           HB2      GLN  31  20.839   9.658  19.036
    4    HB3  GLN  31           HB3      GLN  31  20.713   9.773  20.792
    5    HG2  GLN  31           HG2      GLN  31  18.171   8.898  20.024
    6    HG3  GLN  31           HG3      GLN  31  19.246   8.031  18.935
    7   HE21  GLN  31          HE21      GLN  31  17.678   6.912  21.208
    8   HE22  GLN  31          HE22      GLN  31  18.817   6.212  22.250

  No H/Q in entry =           8
  In of MODEL   62
    1    H    GLY  32           H        GLY  32  19.413  12.597  17.700
    2    HA3  GLY  32           HA2      GLY  32  20.453  14.617  17.197
    3    HA2  GLY  32           HA3      GLY  32  21.215  14.589  18.783

  No H/Q in entry =           3
  In of MODEL   62
    1    H    ASP  33           H        ASP  33  21.550  11.699  16.984
    2    HA   ASP  33           HA       ASP  33  24.392  12.297  16.514
    3    HB2  ASP  33           HB2      ASP  33  22.811   9.724  16.616
    4    HB3  ASP  33           HB3      ASP  33  24.498   9.797  16.117

  No H/Q in entry =           4
  In of MODEL   62
    1    H    PHE  34           H        PHE  34  23.943  13.647  14.643
    2    HA   PHE  34           HA       PHE  34  22.560  12.718  12.354
    3    HB2  PHE  34           HB2      PHE  34  24.751  14.790  12.592
    4    HB3  PHE  34           HB3      PHE  34  23.753  14.538  11.161
    5    HD1  PHE  34           HD1      PHE  34  24.067  16.443  14.088
    6    HD2  PHE  34           HD2      PHE  34  21.124  14.426  11.696
    7    HE1  PHE  34           HE1      PHE  34  22.293  17.884  15.050
    8    HE2  PHE  34           HE2      PHE  34  19.355  15.867  12.662
    9    HZ   PHE  34           HZ       PHE  34  19.943  17.596  14.334

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ALA  35           H        ALA  35  25.931  12.429  13.349
    2    HA   ALA  35           HA       ALA  35  27.005  11.595  10.883
    3    HB3  ALA  35           HB1      ALA  35  28.658  10.367  12.589
    4    HB2  ALA  35           HB2      ALA  35  27.826  11.408  13.745
    5    HB1  ALA  35           HB3      ALA  35  28.679  12.117  12.375

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ALA  36           H        ALA  36  25.844   9.651  13.638
    2    HA   ALA  36           HA       ALA  36  26.255   7.160  12.343
    3    HB2  ALA  36           HB1      ALA  36  25.810   6.411  14.415
    4    HB3  ALA  36           HB2      ALA  36  24.136   6.953  14.274
    5    HB1  ALA  36           HB3      ALA  36  25.370   8.047  14.900

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ALA  37           H        ALA  37  23.494   9.362  12.501
    2    HA   ALA  37           HA       ALA  37  21.586   7.652  11.318
    3    HB3  ALA  37           HB1      ALA  37  21.894  10.606  11.631
    4    HB1  ALA  37           HB2      ALA  37  20.554   9.560  12.100
    5    HB2  ALA  37           HB3      ALA  37  20.751  10.039  10.413

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LYS  38           H        LYS  38  23.747  10.066   9.851
    2    HA   LYS  38           HA       LYS  38  23.089   9.675   7.172
    3    HB2  LYS  38           HB2      LYS  38  24.944  11.172   8.623
    4    HB3  LYS  38           HB3      LYS  38  25.947  10.163   7.587
    5    HG2  LYS  38           HG2      LYS  38  24.798  10.979   5.600
    6    HG3  LYS  38           HG3      LYS  38  23.630  11.858   6.591
    7    HD2  LYS  38           HD2      LYS  38  25.269  13.408   7.349
    8    HD3  LYS  38           HD3      LYS  38  26.601  12.389   6.803
    9    HE2  LYS  38           HE2      LYS  38  26.290  14.281   5.266
   10    HE3  LYS  38           HE3      LYS  38  25.911  12.758   4.451
   11    HZ3  LYS  38           HZ1      LYS  38  23.727  13.263   4.331
   12    HZ2  LYS  38           HZ2      LYS  38  24.293  14.863   4.429
   13    HZ1  LYS  38           HZ3      LYS  38  23.702  14.084   5.817

  No H/Q in entry =          13
  In of MODEL   62
    1    H    ALA  39           H        ALA  39  25.565   7.997   9.109
    2    HA   ALA  39           HA       ALA  39  26.585   6.395   7.025
    3    HB2  ALA  39           HB1      ALA  39  26.480   5.414   9.862
    4    HB1  ALA  39           HB2      ALA  39  27.468   6.817   9.453
    5    HB3  ALA  39           HB3      ALA  39  27.776   5.263   8.677

  No H/Q in entry =           5
  In of MODEL   62
    1    H    MET  40           H        MET  40  23.964   5.832   9.327
    2    HA   MET  40           HA       MET  40  23.447   3.145   8.575
    3    HB2  MET  40           HB2      MET  40  21.689   5.227   9.887
    4    HB3  MET  40           HB3      MET  40  21.237   3.530   9.701
    5    HG2  MET  40           HG2      MET  40  23.815   4.394  11.041
    6    HG3  MET  40           HG3      MET  40  22.316   4.151  11.937
    7    HE3  MET  40           HE1      MET  40  21.658   0.533  12.088
    8    HE2  MET  40           HE2      MET  40  20.821   1.864  11.293
    9    HE1  MET  40           HE3      MET  40  21.574   2.120  12.866

  No H/Q in entry =           9
  In of MODEL   62
    1    H    MET  41           H        MET  41  22.111   6.243   7.414
    2    HA   MET  41           HA       MET  41  20.118   5.111   5.739
    3    HB2  MET  41           HB2      MET  41  21.664   7.666   5.240
    4    HB3  MET  41           HB3      MET  41  20.122   7.217   4.523
    5    HG2  MET  41           HG2      MET  41  19.379   7.030   7.075
    6    HG3  MET  41           HG3      MET  41  20.718   8.152   7.301
    7    HE2  MET  41           HE1      MET  41  20.179   9.478   3.976
    8    HE1  MET  41           HE2      MET  41  21.151   9.882   5.387
    9    HE3  MET  41           HE3      MET  41  19.905  10.998   4.835

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ASP  42           H        ASP  42  23.512   5.950   5.182
    2    HA   ASP  42           HA       ASP  42  23.583   5.494   2.421
    3    HB2  ASP  42           HB2      ASP  42  25.365   6.433   4.192
    4    HB3  ASP  42           HB3      ASP  42  25.979   4.792   4.050

  No H/Q in entry =           4
  In of MODEL   62
    1    H    GLN  43           H        GLN  43  24.259   3.302   5.124
    2    HA   GLN  43           HA       GLN  43  24.860   1.039   3.523
    3    HB2  GLN  43           HB2      GLN  43  23.851   1.228   6.371
    4    HB3  GLN  43           HB3      GLN  43  24.389  -0.269   5.603
    5    HG2  GLN  43           HG2      GLN  43  26.581   0.889   5.094
    6    HG3  GLN  43           HG3      GLN  43  26.036   2.223   6.105
    7   HE21  GLN  43          HE21      GLN  43  28.246   1.185   7.127
    8   HE22  GLN  43          HE22      GLN  43  27.948   0.101   8.397

  No H/Q in entry =           8
  In of MODEL   62
    1    H    SER  44           H        SER  44  21.838   2.242   4.926
    2    HA   SER  44           HA       SER  44  20.210   0.044   4.242
    3    HB2  SER  44           HB2      SER  44  19.838   2.576   5.407
    4    HB3  SER  44           HB3      SER  44  18.798   2.570   3.985
    5    HG   SER  44           HG       SER  44  17.686   1.643   5.705

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ARG  45           H        ARG  45  21.024   3.002   2.456
    2    HA   ARG  45           HA       ARG  45  19.480   2.572   0.153
    3    HB2  ARG  45           HB2      ARG  45  20.681   4.674   0.749
    4    HB3  ARG  45           HB3      ARG  45  22.204   3.882   0.353
    5    HG2  ARG  45           HG2      ARG  45  21.403   3.514  -1.962
    6    HG3  ARG  45           HG3      ARG  45  19.892   4.328  -1.565
    7    HD2  ARG  45           HD2      ARG  45  21.199   6.387  -0.970
    8    HD3  ARG  45           HD3      ARG  45  22.673   5.579  -1.549
    9    HE   ARG  45           HE       ARG  45  20.730   5.406  -3.580
   10   HH21  ARG  45          HH11      ARG  45  20.754   6.788  -5.333
   11   HH22  ARG  45          HH12      ARG  45  21.551   8.317  -5.220
   12   HH11  ARG  45          HH21      ARG  45  22.531   7.847  -1.941
   13   HH12  ARG  45          HH22      ARG  45  22.556   8.916  -3.297

  No H/Q in entry =          13
  In of MODEL   62
    1    H    MET  46           H        MET  46  22.822   1.604   0.883
    2    HA   MET  46           HA       MET  46  23.388   0.414  -1.612
    3    HB2  MET  46           HB2      MET  46  24.495   0.035   1.171
    4    HB3  MET  46           HB3      MET  46  25.125  -0.860  -0.216
    5    HG2  MET  46           HG2      MET  46  25.616   1.247  -1.380
    6    HG3  MET  46           HG3      MET  46  24.939   2.164  -0.040
    7    HE2  MET  46           HE1      MET  46  28.821  -0.049  -0.490
    8    HE1  MET  46           HE2      MET  46  27.273  -0.334  -1.279
    9    HE3  MET  46           HE3      MET  46  27.621  -1.106   0.267

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ALA  47           H        ALA  47  21.980  -0.903   1.360
    2    HA   ALA  47           HA       ALA  47  21.851  -3.608   0.538
    3    HB2  ALA  47           HB1      ALA  47  21.493  -3.154   2.847
    4    HB3  ALA  47           HB2      ALA  47  19.939  -3.711   2.230
    5    HB1  ALA  47           HB3      ALA  47  20.216  -1.988   2.499

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LEU  48           H        LEU  48  19.569  -0.916   0.209
    2    HA   LEU  48           HA       LEU  48  17.479  -2.385  -1.045
    3    HB2  LEU  48           HB2      LEU  48  18.212   0.551  -1.142
    4    HB3  LEU  48           HB3      LEU  48  16.720  -0.114  -1.807
    5    HG   LEU  48           HG       LEU  48  17.576  -0.459   1.075
    6   HD13  LEU  48          HD11      LEU  48  17.220   1.853   0.906
    7   HD12  LEU  48          HD12      LEU  48  15.647   1.245   1.417
    8   HD11  LEU  48          HD13      LEU  48  15.923   1.671  -0.272
    9   HD22  LEU  48          HD21      LEU  48  16.000  -2.129   0.689
   10   HD21  LEU  48          HD22      LEU  48  15.146  -1.194  -0.539
   11   HD23  LEU  48          HD23      LEU  48  14.952  -0.796   1.168

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ASN  49           H        ASN  49  20.213  -0.522  -2.273
    2    HA   ASN  49           HA       ASN  49  19.550  -0.569  -4.995
    3    HB2  ASN  49           HB2      ASN  49  21.274   0.893  -4.063
    4    HB3  ASN  49           HB3      ASN  49  22.269  -0.500  -3.655
    5   HD21  ASN  49          HD21      ASN  49  23.292   1.513  -5.333
    6   HD22  ASN  49          HD22      ASN  49  23.450   0.903  -6.908

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLU  50           H        GLU  50  21.481  -2.831  -3.056
    2    HA   GLU  50           HA       GLU  50  22.125  -4.591  -5.197
    3    HB2  GLU  50           HB2      GLU  50  23.332  -4.613  -3.035
    4    HB3  GLU  50           HB3      GLU  50  21.876  -5.206  -2.237
    5    HG2  GLU  50           HG2      GLU  50  21.904  -7.232  -3.610
    6    HG3  GLU  50           HG3      GLU  50  23.293  -6.631  -4.513

  No H/Q in entry =           6
  In of MODEL   62
    1    H    ALA  51           H        ALA  51  19.481  -4.468  -2.858
    2    HA   ALA  51           HA       ALA  51  18.244  -6.903  -3.626
    3    HB3  ALA  51           HB1      ALA  51  16.673  -6.364  -2.061
    4    HB1  ALA  51           HB2      ALA  51  16.503  -4.708  -2.648
    5    HB2  ALA  51           HB3      ALA  51  17.855  -5.139  -1.600

  No H/Q in entry =           5
  In of MODEL   62
    1    H    HIS  52           H        HIS  52  17.746  -3.533  -4.637
    2    HA   HIS  52           HA       HIS  52  15.612  -3.989  -6.431
    3    HB2  HIS  52           HB2      HIS  52  16.336  -1.749  -5.613
    4    HB3  HIS  52           HB3      HIS  52  17.772  -1.879  -6.628
    5    HD1  HIS  52           HD1      HIS  52  17.435  -1.768  -9.213
    6    HD2  HIS  52           HD2      HIS  52  13.926  -1.237  -7.025
    7    HE1  HIS  52           HE1      HIS  52  15.703  -0.886 -10.838
    8    HE2  HIS  52           HE2      HIS  52  13.559  -0.556  -9.519

  No H/Q in entry =           8
  In of MODEL   62
    1    H    LEU  53           H        LEU  53  19.127  -4.089  -6.879
    2    HA   LEU  53           HA       LEU  53  19.163  -4.388  -9.682
    3    HB2  LEU  53           HB2      LEU  53  21.083  -5.211  -7.519
    4    HB3  LEU  53           HB3      LEU  53  21.382  -5.604  -9.210
    5    HG   LEU  53           HG       LEU  53  20.786  -2.776  -8.287
    6   HD11  LEU  53          HD11      LEU  53  23.448  -4.195  -8.589
    7   HD13  LEU  53          HD12      LEU  53  22.793  -3.463  -7.124
    8   HD12  LEU  53          HD13      LEU  53  23.275  -2.446  -8.476
    9   HD21  LEU  53          HD21      LEU  53  21.866  -4.038 -10.816
   10   HD23  LEU  53          HD22      LEU  53  22.212  -2.356 -10.427
   11   HD22  LEU  53          HD23      LEU  53  20.554  -2.877 -10.661

  No H/Q in entry =          11
  In of MODEL   62
    1    H    VAL  54           H        VAL  54  18.997  -6.787  -7.071
    2    HA   VAL  54           HA       VAL  54  19.051  -9.074  -8.745
    3    HB   VAL  54           HB       VAL  54  17.920  -8.637  -5.970
    4   HG12  VAL  54          HG11      VAL  54  18.173 -11.262  -5.984
    5   HG11  VAL  54          HG12      VAL  54  17.985 -11.078  -7.727
    6   HG13  VAL  54          HG13      VAL  54  16.716 -10.519  -6.640
    7   HG22  VAL  54          HG21      VAL  54  20.242  -8.490  -5.756
    8   HG21  VAL  54          HG22      VAL  54  20.544  -9.582  -7.106
    9   HG23  VAL  54          HG23      VAL  54  20.003 -10.224  -5.555

  No H/Q in entry =           9
  In of MODEL   62
    1    H    GLN  55           H        GLN  55  16.380  -7.106  -7.438
    2    HA   GLN  55           HA       GLN  55  14.310  -8.709  -8.513
    3    HB2  GLN  55           HB2      GLN  55  13.611  -7.174  -6.874
    4    HB3  GLN  55           HB3      GLN  55  14.437  -5.822  -7.645
    5    HG2  GLN  55           HG2      GLN  55  12.715  -5.442  -9.125
    6    HG3  GLN  55           HG3      GLN  55  12.346  -7.153  -9.304
    7   HE21  GLN  55          HE21      GLN  55  10.329  -7.653  -8.493
    8   HE22  GLN  55          HE22      GLN  55   9.582  -6.887  -7.176

  No H/Q in entry =           8
  In of MODEL   62
    1    H    THR  56           H        THR  56  16.118  -5.947  -9.863
    2    HA   THR  56           HA       THR  56  14.680  -5.533 -12.203
    3    HB   THR  56           HB       THR  56  17.688  -5.462 -11.845
    4    HG1  THR  56           HG1      THR  56  15.672  -3.479 -11.654
    5   HG23  THR  56          HG21      THR  56  17.430  -5.396 -14.157
    6   HG22  THR  56          HG22      THR  56  17.311  -3.685 -13.747
    7   HG21  THR  56          HG23      THR  56  15.847  -4.621 -14.058

  No H/Q in entry =           7
  In of MODEL   62
    1    H    LYS  57           H        LYS  57  17.270  -7.903 -11.618
    2    HA   LYS  57           HA       LYS  57  17.228  -9.081 -14.203
    3    HB2  LYS  57           HB2      LYS  57  19.019  -9.392 -12.467
    4    HB3  LYS  57           HB3      LYS  57  17.892 -10.364 -11.532
    5    HG2  LYS  57           HG2      LYS  57  19.090 -11.993 -12.692
    6    HG3  LYS  57           HG3      LYS  57  17.677 -11.780 -13.719
    7    HD2  LYS  57           HD2      LYS  57  19.313 -11.605 -15.331
    8    HD3  LYS  57           HD3      LYS  57  19.249  -9.915 -14.835
    9    HE2  LYS  57           HE2      LYS  57  21.521 -10.238 -14.607
   10    HE3  LYS  57           HE3      LYS  57  21.036 -10.815 -13.015
   11    HZ3  LYS  57           HZ1      LYS  57  21.009 -13.056 -13.836
   12    HZ2  LYS  57           HZ2      LYS  57  22.520 -12.356 -14.171
   13    HZ1  LYS  57           HZ3      LYS  57  21.372 -12.535 -15.409

  No H/Q in entry =          13
  In of MODEL   62
    1    H    LEU  58           H        LEU  58  15.444  -9.720 -11.223
    2    HA   LEU  58           HA       LEU  58  14.156 -12.055 -12.167
    3    HB2  LEU  58           HB2      LEU  58  13.421 -10.143  -9.956
    4    HB3  LEU  58           HB3      LEU  58  12.574 -11.657 -10.277
    5    HG   LEU  58           HG       LEU  58  15.555 -11.460  -9.735
    6   HD11  LEU  58          HD11      LEU  58  13.182 -11.826  -7.934
    7   HD13  LEU  58          HD12      LEU  58  14.661 -10.903  -7.673
    8   HD12  LEU  58          HD13      LEU  58  14.689 -12.661  -7.548
    9   HD22  LEU  58          HD21      LEU  58  15.379 -13.512 -10.775
   10   HD21  LEU  58          HD22      LEU  58  13.662 -13.679 -10.407
   11   HD23  LEU  58          HD23      LEU  58  14.868 -14.019  -9.165

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  59           H        ILE  59  13.569  -8.697 -12.826
    2    HA   ILE  59           HA       ILE  59  10.833  -9.270 -13.757
    3    HB   ILE  59           HB       ILE  59  11.708  -7.015 -12.544
    4   HG12  ILE  59          HG12      ILE  59   9.783  -6.835 -14.873
    5   HG13  ILE  59          HG13      ILE  59   9.359  -7.599 -13.362
    6   HG23  ILE  59          HG21      ILE  59  12.309  -5.298 -14.049
    7   HG22  ILE  59          HG22      ILE  59  11.781  -6.203 -15.449
    8   HG21  ILE  59          HG23      ILE  59  13.258  -6.656 -14.605
    9   HD11  ILE  59          HD11      ILE  59  10.318  -4.752 -13.655
   10   HD13  ILE  59          HD12      ILE  59   9.862  -5.524 -12.138
   11   HD12  ILE  59          HD13      ILE  59   8.644  -5.237 -13.382

  No H/Q in entry =          11
  In of MODEL   62
    1    H    GLU  60           H        GLU  60  14.052  -8.494 -15.025
    2    HA   GLU  60           HA       GLU  60  13.271  -8.057 -17.728
    3    HB2  GLU  60           HB2      GLU  60  15.457  -7.351 -16.999
    4    HB3  GLU  60           HB3      GLU  60  15.878  -8.989 -16.503
    5    HG2  GLU  60           HG2      GLU  60  15.103  -8.436 -19.359
    6    HG3  GLU  60           HG3      GLU  60  16.745  -8.108 -18.810

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLY  61           H        GLY  61  14.181 -10.973 -15.934
    2    HA3  GLY  61           HA2      GLY  61  13.586 -12.592 -18.343
    3    HA2  GLY  61           HA3      GLY  61  14.612 -13.108 -17.008

  No H/Q in entry =           3
  In of MODEL   62
    1    H    ASP  62           H        ASP  62  11.537 -11.483 -16.610
    2    HA   ASP  62           HA       ASP  62  10.562 -13.568 -14.899
    3    HB2  ASP  62           HB2      ASP  62   8.543 -12.115 -14.767
    4    HB3  ASP  62           HB3      ASP  62  10.041 -11.275 -14.376

  No H/Q in entry =           4
  In of MODEL   62
    1    H    ALA  63           H        ALA  63  10.930 -14.026 -17.970
    2    HA   ALA  63           HA       ALA  63   8.475 -14.397 -19.252
    3    HB2  ALA  63           HB1      ALA  63   9.602 -15.970 -20.671
    4    HB1  ALA  63           HB2      ALA  63  10.807 -16.317 -19.433
    5    HB3  ALA  63           HB3      ALA  63  10.789 -14.743 -20.229

  No H/Q in entry =           5
  In of MODEL   62
    1    H    GLY  64           H        GLY  64  10.257 -16.652 -17.169
    2    HA3  GLY  64           HA2      GLY  64   9.619 -18.528 -16.016
    3    HA2  GLY  64           HA3      GLY  64   8.063 -17.730 -15.834

  No H/Q in entry =           3
  In of MODEL   62
    1    H    GLU  65           H        GLU  65   6.543 -19.226 -16.312
    2    HA   GLU  65           HA       GLU  65   6.838 -21.478 -17.863
    3    HB2  GLU  65           HB2      GLU  65   4.334 -19.847 -17.435
    4    HB3  GLU  65           HB3      GLU  65   4.369 -21.490 -18.077
    5    HG2  GLU  65           HG2      GLU  65   5.550 -20.697 -15.403
    6    HG3  GLU  65           HG3      GLU  65   3.937 -21.380 -15.600

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLY  66           H        GLY  66   5.538 -21.992 -19.825
    2    HA3  GLY  66           HA2      GLY  66   6.606 -20.721 -22.091
    3    HA2  GLY  66           HA3      GLY  66   5.334 -21.925 -22.090

  No H/Q in entry =           3
  In of MODEL   62
    1    H    LYS  67           H        LYS  67   3.443 -20.452 -20.582
    2    HA   LYS  67           HA       LYS  67   2.424 -18.752 -22.694
    3    HB2  LYS  67           HB2      LYS  67   0.322 -18.834 -21.372
    4    HB3  LYS  67           HB3      LYS  67   0.965 -20.435 -21.762
    5    HG2  LYS  67           HG2      LYS  67   2.067 -20.517 -19.539
    6    HG3  LYS  67           HG3      LYS  67   1.365 -18.951 -19.146
    7    HD2  LYS  67           HD2      LYS  67  -0.895 -19.887 -19.364
    8    HD3  LYS  67           HD3      LYS  67  -0.212 -21.455 -19.804
    9    HE2  LYS  67           HE2      LYS  67   0.934 -21.574 -17.623
   10    HE3  LYS  67           HE3      LYS  67   0.256 -20.008 -17.179
   11    HZ2  LYS  67           HZ1      LYS  67  -0.988 -21.966 -16.318
   12    HZ1  LYS  67           HZ2      LYS  67  -1.396 -22.355 -17.920
   13    HZ3  LYS  67           HZ3      LYS  67  -1.926 -20.892 -17.236

  No H/Q in entry =          13
  In of MODEL   62
    1    H    MET  68           H        MET  68   1.098 -16.853 -22.057
    2    HA   MET  68           HA       MET  68   2.580 -14.687 -21.401
    3    HB2  MET  68           HB2      MET  68  -0.368 -15.108 -20.908
    4    HB3  MET  68           HB3      MET  68   0.434 -13.538 -20.900
    5    HG2  MET  68           HG2      MET  68   0.431 -15.465 -23.239
    6    HG3  MET  68           HG3      MET  68  -0.600 -14.041 -23.103
    7    HE3  MET  68           HE1      MET  68   1.505 -11.062 -23.235
    8    HE2  MET  68           HE2      MET  68   1.748 -11.855 -21.682
    9    HE1  MET  68           HE3      MET  68   0.162 -11.904 -22.449

  No H/Q in entry =           9
  In of MODEL   62
    1    H    LYS  69           H        LYS  69   1.767 -17.051 -19.104
    2    HA   LYS  69           HA       LYS  69   1.345 -15.437 -16.821
    3    HB2  LYS  69           HB2      LYS  69   0.652 -17.776 -16.930
    4    HB3  LYS  69           HB3      LYS  69   2.343 -18.284 -16.966
    5    HG2  LYS  69           HG2      LYS  69   1.520 -18.436 -14.676
    6    HG3  LYS  69           HG3      LYS  69   2.697 -17.126 -14.782
    7    HD2  LYS  69           HD2      LYS  69   1.043 -15.462 -14.669
    8    HD3  LYS  69           HD3      LYS  69  -0.242 -16.575 -15.142
    9    HE2  LYS  69           HE2      LYS  69   0.004 -17.778 -13.003
   10    HE3  LYS  69           HE3      LYS  69   1.291 -16.672 -12.527
   11    HZ3  LYS  69           HZ1      LYS  69  -0.162 -14.929 -12.291
   12    HZ2  LYS  69           HZ2      LYS  69  -1.118 -16.227 -11.759
   13    HZ1  LYS  69           HZ3      LYS  69  -1.327 -15.599 -13.323

  No H/Q in entry =          13
  In of MODEL   62
    1    H    VAL  70           H        VAL  70   2.615 -14.685 -15.163
    2    HA   VAL  70           HA       VAL  70   5.554 -14.869 -15.535
    3    HB   VAL  70           HB       VAL  70   5.653 -12.628 -14.478
    4   HG11  VAL  70          HG11      VAL  70   5.373 -13.064 -17.012
    5   HG13  VAL  70          HG12      VAL  70   5.050 -11.430 -16.431
    6   HG12  VAL  70          HG13      VAL  70   3.711 -12.519 -16.787
    7   HG22  VAL  70          HG21      VAL  70   3.713 -12.483 -13.120
    8   HG21  VAL  70          HG22      VAL  70   2.659 -13.017 -14.427
    9   HG23  VAL  70          HG23      VAL  70   3.346 -11.393 -14.457

  No H/Q in entry =           9
  In of MODEL   62
    1    H    SER  71           H        SER  71   6.783 -14.577 -13.498
    2    HA   SER  71           HA       SER  71   6.035 -16.430 -11.500
    3    HB2  SER  71           HB2      SER  71   8.384 -15.615 -12.050
    4    HB3  SER  71           HB3      SER  71   7.997 -14.158 -11.138
    5    HG   SER  71           HG       SER  71   7.766 -16.819 -10.163

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LEU  72           H        LEU  72   4.557 -16.219  -9.989
    2    HA   LEU  72           HA       LEU  72   3.070 -13.869  -9.523
    3    HB2  LEU  72           HB2      LEU  72   3.297 -16.443  -7.971
    4    HB3  LEU  72           HB3      LEU  72   2.164 -15.158  -7.557
    5    HG   LEU  72           HG       LEU  72   2.274 -16.423 -10.314
    6   HD13  LEU  72          HD11      LEU  72   0.353 -17.780  -9.621
    7   HD12  LEU  72          HD12      LEU  72   0.429 -17.090  -8.002
    8   HD11  LEU  72          HD13      LEU  72   1.738 -18.120  -8.582
    9   HD22  LEU  72          HD21      LEU  72   1.073 -14.416 -10.516
   10   HD21  LEU  72          HD22      LEU  72   0.418 -14.513  -8.890
   11   HD23  LEU  72          HD23      LEU  72  -0.209 -15.565 -10.156

  No H/Q in entry =          11
  In of MODEL   62
    1    H    VAL  73           H        VAL  73   5.695 -15.386  -7.770
    2    HA   VAL  73           HA       VAL  73   5.683 -13.868  -5.428
    3    HB   VAL  73           HB       VAL  73   7.804 -14.772  -4.987
    4   HG11  VAL  73          HG11      VAL  73   5.845 -16.402  -5.489
    5   HG13  VAL  73          HG12      VAL  73   7.474 -17.069  -5.390
    6   HG12  VAL  73          HG13      VAL  73   6.733 -16.778  -6.963
    7   HG21  VAL  73          HG21      VAL  73   8.082 -14.899  -7.996
    8   HG23  VAL  73          HG22      VAL  73   9.167 -15.769  -6.914
    9   HG22  VAL  73          HG23      VAL  73   9.085 -14.008  -6.853

  No H/Q in entry =           9
  In of MODEL   62
    1    H    LEU  74           H        LEU  74   6.684 -12.979  -8.602
    2    HA   LEU  74           HA       LEU  74   8.681 -11.085  -8.104
    3    HB2  LEU  74           HB2      LEU  74   8.195 -11.809 -10.345
    4    HB3  LEU  74           HB3      LEU  74   6.548 -11.193 -10.234
    5    HG   LEU  74           HG       LEU  74   7.416  -8.893 -10.015
    6   HD12  LEU  74          HD11      LEU  74   9.929  -8.671 -10.609
    7   HD11  LEU  74          HD12      LEU  74  10.055 -10.355 -10.106
    8   HD13  LEU  74          HD13      LEU  74   9.522  -9.129  -8.956
    9   HD23  LEU  74          HD21      LEU  74   8.871 -10.015 -12.350
   10   HD22  LEU  74          HD22      LEU  74   7.757  -8.671 -12.249
   11   HD21  LEU  74          HD23      LEU  74   7.136 -10.306 -12.242

  No H/Q in entry =          11
  In of MODEL   62
    1    H    VAL  75           H        VAL  75   5.196 -10.606  -8.442
    2    HA   VAL  75           HA       VAL  75   5.173  -7.853  -7.837
    3    HB   VAL  75           HB       VAL  75   3.033  -9.948  -7.467
    4   HG11  VAL  75          HG11      VAL  75   2.909  -6.907  -7.260
    5   HG13  VAL  75          HG12      VAL  75   2.605  -8.054  -5.963
    6   HG12  VAL  75          HG13      VAL  75   1.503  -7.964  -7.328
    7   HG21  VAL  75          HG21      VAL  75   3.883  -9.433  -9.792
    8   HG23  VAL  75          HG22      VAL  75   3.389  -7.759  -9.541
    9   HG22  VAL  75          HG23      VAL  75   2.180  -9.043  -9.555

  No H/Q in entry =           9
  In of MODEL   62
    1    H    GLU  76           H        GLU  76   4.851 -10.736  -5.745
    2    HA   GLU  76           HA       GLU  76   4.424  -9.379  -3.313
    3    HB2  GLU  76           HB2      GLU  76   4.204 -11.854  -3.608
    4    HB3  GLU  76           HB3      GLU  76   5.948 -11.970  -3.769
    5    HG2  GLU  76           HG2      GLU  76   6.241 -11.111  -1.480
    6    HG3  GLU  76           HG3      GLU  76   4.505 -10.953  -1.289

  No H/Q in entry =           6
  In of MODEL   62
    1    H    ALA  77           H        ALA  77   7.455 -10.356  -4.892
    2    HA   ALA  77           HA       ALA  77   9.177  -9.371  -2.874
    3    HB1  ALA  77           HB1      ALA  77   9.883 -10.929  -4.676
    4    HB2  ALA  77           HB2      ALA  77  10.936  -9.520  -4.549
    5    HB3  ALA  77           HB3      ALA  77   9.738  -9.611  -5.840

  No H/Q in entry =           5
  In of MODEL   62
    1    H    GLN  78           H        GLN  78   7.814  -7.898  -5.775
    2    HA   GLN  78           HA       GLN  78   9.232  -5.456  -5.658
    3    HB2  GLN  78           HB2      GLN  78   7.858  -6.374  -7.597
    4    HB3  GLN  78           HB3      GLN  78   6.425  -5.841  -6.721
    5    HG2  GLN  78           HG2      GLN  78   7.187  -3.544  -6.756
    6    HG3  GLN  78           HG3      GLN  78   8.728  -4.022  -7.468
    7   HE21  GLN  78          HE21      GLN  78   5.247  -4.687  -8.227
    8   HE22  GLN  78          HE22      GLN  78   5.404  -4.345  -9.882

  No H/Q in entry =           8
  In of MODEL   62
    1    H    LEU  79           H        LEU  79   6.187  -6.522  -4.227
    2    HA   LEU  79           HA       LEU  79   5.261  -4.096  -3.200
    3    HB2  LEU  79           HB2      LEU  79   3.892  -6.112  -3.154
    4    HB3  LEU  79           HB3      LEU  79   5.019  -6.889  -2.046
    5    HG   LEU  79           HG       LEU  79   4.515  -5.244  -0.307
    6   HD13  LEU  79          HD11      LEU  79   4.102  -3.211  -1.344
    7   HD12  LEU  79          HD12      LEU  79   2.464  -3.696  -0.904
    8   HD11  LEU  79          HD13      LEU  79   3.034  -3.923  -2.555
    9   HD23  LEU  79          HD21      LEU  79   1.917  -5.668  -0.214
   10   HD22  LEU  79          HD22      LEU  79   3.020  -7.038  -0.117
   11   HD21  LEU  79          HD23      LEU  79   2.212  -6.669  -1.638

  No H/Q in entry =          11
  In of MODEL   62
    1    H    HIS  80           H        HIS  80   7.383  -6.500  -1.637
    2    HA   HIS  80           HA       HIS  80   7.718  -4.982   0.741
    3    HB2  HIS  80           HB2      HIS  80   8.989  -7.373  -0.476
    4    HB3  HIS  80           HB3      HIS  80   9.926  -6.509   0.744
    5    HD1  HIS  80           HD1      HIS  80   9.424  -7.147   3.084
    6    HD2  HIS  80           HD2      HIS  80   6.180  -7.893   0.573
    7    HE1  HIS  80           HE1      HIS  80   7.625  -8.211   4.529
    8    HE2  HIS  80           HE2      HIS  80   5.642  -8.670   3.007

  No H/Q in entry =           8
  In of MODEL   62
    1    H    LEU  81           H        LEU  81   9.709  -5.293  -2.178
    2    HA   LEU  81           HA       LEU  81  11.802  -3.614  -1.292
    3    HB2  LEU  81           HB2      LEU  81  10.854  -4.363  -4.058
    4    HB3  LEU  81           HB3      LEU  81  12.302  -3.398  -3.764
    5    HG   LEU  81           HG       LEU  81  11.837  -6.115  -2.508
    6   HD12  LEU  81          HD11      LEU  81  13.632  -6.780  -4.265
    7   HD11  LEU  81          HD12      LEU  81  13.104  -5.335  -5.126
    8   HD13  LEU  81          HD13      LEU  81  11.957  -6.630  -4.795
    9   HD23  LEU  81          HD21      LEU  81  14.473  -5.873  -2.497
   10   HD22  LEU  81          HD22      LEU  81  13.515  -5.094  -1.240
   11   HD21  LEU  81          HD23      LEU  81  14.117  -4.149  -2.602

  No H/Q in entry =          11
  In of MODEL   62
    1    H    MET  82           H        MET  82   8.894  -2.884  -3.219
    2    HA   MET  82           HA       MET  82   9.508  -0.171  -3.703
    3    HB2  MET  82           HB2      MET  82   6.906  -1.694  -3.583
    4    HB3  MET  82           HB3      MET  82   6.953   0.032  -3.936
    5    HG2  MET  82           HG2      MET  82   8.492  -2.075  -5.488
    6    HG3  MET  82           HG3      MET  82   6.942  -1.406  -5.993
    7    HE3  MET  82           HE1      MET  82   7.484   2.043  -7.143
    8    HE2  MET  82           HE2      MET  82   7.107   1.816  -5.437
    9    HE1  MET  82           HE3      MET  82   6.409   0.733  -6.638

  No H/Q in entry =           9
  In of MODEL   62
    1    H    THR  83           H        THR  83   7.677  -1.736  -1.105
    2    HA   THR  83           HA       THR  83   6.895   0.626   0.239
    3    HB   THR  83           HB       THR  83   6.720  -0.957   2.247
    4    HG1  THR  83           HG1      THR  83   7.421  -2.926   2.003
    5   HG22  THR  83          HG21      THR  83   5.021  -2.466   0.772
    6   HG21  THR  83          HG22      THR  83   5.283  -1.137  -0.352
    7   HG23  THR  83          HG23      THR  83   4.654  -0.815   1.264

  No H/Q in entry =           7
  In of MODEL   62
    1    H    SER  84           H        SER  84   9.659  -1.554   0.741
    2    HA   SER  84           HA       SER  84  10.762  -0.168   2.936
    3    HB2  SER  84           HB2      SER  84  11.960  -2.032   0.897
    4    HB3  SER  84           HB3      SER  84  12.929  -1.314   2.181
    5    HG   SER  84           HG       SER  84  10.608  -2.941   2.434

  No H/Q in entry =           5
  In of MODEL   62
    1    H    MET  85           H        MET  85  11.516   0.095  -0.552
    2    HA   MET  85           HA       MET  85  13.570   2.000  -0.291
    3    HB2  MET  85           HB2      MET  85  13.134   0.743  -2.365
    4    HB3  MET  85           HB3      MET  85  11.632   1.642  -2.586
    5    HG2  MET  85           HG2      MET  85  12.890   3.753  -2.702
    6    HG3  MET  85           HG3      MET  85  14.395   2.879  -2.437
    7    HE2  MET  85           HE1      MET  85  12.070   4.241  -5.356
    8    HE1  MET  85           HE2      MET  85  11.223   3.067  -4.352
    9    HE3  MET  85           HE3      MET  85  11.590   2.673  -6.027

  No H/Q in entry =           9
  In of MODEL   62
    1    H    LEU  86           H        LEU  86  10.091   2.438  -0.791
    2    HA   LEU  86           HA       LEU  86  10.107   5.253  -0.954
    3    HB2  LEU  86           HB2      LEU  86   8.215   3.650  -1.538
    4    HB3  LEU  86           HB3      LEU  86   7.886   3.559   0.192
    5    HG   LEU  86           HG       LEU  86   7.798   6.123   0.157
    6   HD11  LEU  86          HD11      LEU  86   8.556   5.683  -2.549
    7   HD13  LEU  86          HD12      LEU  86   8.166   7.218  -1.778
    8   HD12  LEU  86          HD13      LEU  86   6.901   6.296  -2.587
    9   HD23  LEU  86          HD21      LEU  86   5.624   4.844  -1.510
   10   HD22  LEU  86          HD22      LEU  86   5.472   6.100  -0.285
   11   HD21  LEU  86          HD23      LEU  86   5.825   4.442   0.196

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ALA  87           H        ALA  87   9.583   3.070   1.778
    2    HA   ALA  87           HA       ALA  87   9.094   4.986   3.761
    3    HB1  ALA  87           HB1      ALA  87   9.819   2.145   3.655
    4    HB3  ALA  87           HB2      ALA  87   8.720   2.982   4.748
    5    HB2  ALA  87           HB3      ALA  87  10.449   2.961   5.089

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ARG  88           H        ARG  88  12.133   3.480   2.765
    2    HA   ARG  88           HA       ARG  88  13.785   4.799   4.603
    3    HB2  ARG  88           HB2      ARG  88  14.393   2.816   3.185
    4    HB3  ARG  88           HB3      ARG  88  14.575   3.913   1.819
    5    HG2  ARG  88           HG2      ARG  88  16.089   5.171   3.771
    6    HG3  ARG  88           HG3      ARG  88  16.361   3.470   4.138
    7    HD2  ARG  88           HD2      ARG  88  17.615   3.150   2.287
    8    HD3  ARG  88           HD3      ARG  88  16.503   4.061   1.262
    9    HE   ARG  88           HE       ARG  88  18.929   5.048   2.311
   10   HH21  ARG  88          HH11      ARG  88  19.338   7.257   2.130
   11   HH22  ARG  88          HH12      ARG  88  18.018   8.368   1.997
   12   HH11  ARG  88          HH21      ARG  88  15.612   5.899   2.045
   13   HH12  ARG  88          HH22      ARG  88  15.907   7.597   1.924

  No H/Q in entry =          13
  In of MODEL   62
    1    H    GLU  89           H        GLU  89  12.831   5.746   1.288
    2    HA   GLU  89           HA       GLU  89  14.446   8.062   1.144
    3    HB2  GLU  89           HB2      GLU  89  13.268   7.067  -0.809
    4    HB3  GLU  89           HB3      GLU  89  11.741   7.648  -0.144
    5    HG2  GLU  89           HG2      GLU  89  12.510   9.966  -0.292
    6    HG3  GLU  89           HG3      GLU  89  14.098   9.433  -0.836

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LEU  90           H        LEU  90  11.105   7.641   2.277
    2    HA   LEU  90           HA       LEU  90  10.671  10.384   2.872
    3    HB2  LEU  90           HB2      LEU  90   9.404   7.840   3.885
    4    HB3  LEU  90           HB3      LEU  90   8.821   9.450   4.319
    5    HG   LEU  90           HG       LEU  90   9.207   8.577   1.444
    6   HD12  LEU  90          HD11      LEU  90   6.665   8.321   1.510
    7   HD11  LEU  90          HD12      LEU  90   6.823   8.295   3.266
    8   HD13  LEU  90          HD13      LEU  90   7.604   7.049   2.291
    9   HD22  LEU  90          HD21      LEU  90   8.980  10.893   1.386
   10   HD21  LEU  90          HD22      LEU  90   7.998  10.944   2.849
   11   HD23  LEU  90          HD23      LEU  90   7.282  10.420   1.325

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  91           H        ILE  91  11.860   7.655   4.773
    2    HA   ILE  91           HA       ILE  91  12.045   8.999   7.250
    3    HB   ILE  91           HB       ILE  91  13.528   6.624   6.107
    4   HG12  ILE  91          HG12      ILE  91  11.522   6.834   8.373
    5   HG13  ILE  91          HG13      ILE  91  11.040   6.578   6.696
    6   HG22  ILE  91          HG21      ILE  91  13.997   6.379   8.745
    7   HG21  ILE  91          HG22      ILE  91  13.972   8.140   8.656
    8   HG23  ILE  91          HG23      ILE  91  15.122   7.225   7.683
    9   HD13  ILE  91          HD11      ILE  91  11.981   4.449   6.610
   10   HD12  ILE  91          HD12      ILE  91  11.394   4.513   8.271
   11   HD11  ILE  91          HD13      ILE  91  13.103   4.779   7.931

  No H/Q in entry =          11
  In of MODEL   62
    1    H    THR  92           H        THR  92  14.250   8.784   4.492
    2    HA   THR  92           HA       THR  92  16.457  10.106   5.656
    3    HB   THR  92           HB       THR  92  15.461  10.029   2.797
    4    HG1  THR  92           HG1      THR  92  16.239   8.106   3.187
    5   HG22  THR  92          HG21      THR  92  18.050  10.647   2.501
    6   HG21  THR  92          HG22      THR  92  17.769  11.466   4.037
    7   HG23  THR  92          HG23      THR  92  16.807  11.891   2.621

  No H/Q in entry =           7
  In of MODEL   62
    1    H    GLU  93           H        GLU  93  13.601  11.354   3.941
    2    HA   GLU  93           HA       GLU  93  14.275  14.096   4.073
    3    HB2  GLU  93           HB2      GLU  93  11.532  12.801   4.084
    4    HB3  GLU  93           HB3      GLU  93  11.868  14.494   3.723
    5    HG2  GLU  93           HG2      GLU  93  13.137  12.225   2.177
    6    HG3  GLU  93           HG3      GLU  93  11.610  12.955   1.698

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LEU  94           H        LEU  94  12.476  11.976   6.274
    2    HA   LEU  94           HA       LEU  94  11.727  13.932   8.165
    3    HB2  LEU  94           HB2      LEU  94  12.218  10.960   8.418
    4    HB3  LEU  94           HB3      LEU  94  11.678  11.942   9.776
    5    HG   LEU  94           HG       LEU  94  10.190  12.055   7.151
    6   HD11  LEU  94          HD11      LEU  94  10.213   9.819   9.141
    7   HD13  LEU  94          HD12      LEU  94   9.906   9.778   7.406
    8   HD12  LEU  94          HD13      LEU  94   8.645  10.324   8.511
    9   HD23  LEU  94          HD21      LEU  94   8.286  12.499   8.759
   10   HD22  LEU  94          HD22      LEU  94   9.561  13.716   8.801
   11   HD21  LEU  94          HD23      LEU  94   9.466  12.493  10.067

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  95           H        ILE  95  14.643  11.919   7.907
    2    HA   ILE  95           HA       ILE  95  15.843  12.791  10.324
    3    HB   ILE  95           HB       ILE  95  17.044  11.704   7.766
    4   HG12  ILE  95          HG12      ILE  95  16.721  10.494  10.526
    5   HG13  ILE  95          HG13      ILE  95  15.544  10.278   9.232
    6   HG21  ILE  95          HG21      ILE  95  18.329  12.457  10.410
    7   HG23  ILE  95          HG22      ILE  95  18.802  12.982   8.793
    8   HG22  ILE  95          HG23      ILE  95  19.062  11.310   9.290
    9   HD13  ILE  95          HD11      ILE  95  16.984   8.965   7.957
   10   HD12  ILE  95          HD12      ILE  95  17.447   8.492   9.589
   11   HD11  ILE  95          HD13      ILE  95  18.432   9.650   8.695

  No H/Q in entry =          11
  In of MODEL   62
    1    H    GLU  96           H        GLU  96  16.025  14.042   6.998
    2    HA   GLU  96           HA       GLU  96  17.932  16.063   7.484
    3    HB2  GLU  96           HB2      GLU  96  17.243  15.436   5.222
    4    HB3  GLU  96           HB3      GLU  96  15.617  16.038   5.530
    5    HG2  GLU  96           HG2      GLU  96  16.243  18.153   5.001
    6    HG3  GLU  96           HG3      GLU  96  17.545  18.108   6.180

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LEU  97           H        LEU  97  14.418  15.975   7.921
    2    HA   LEU  97           HA       LEU  97  14.082  18.715   8.583
    3    HB2  LEU  97           HB2      LEU  97  12.493  16.230   9.184
    4    HB3  LEU  97           HB3      LEU  97  12.027  17.786   9.867
    5    HG   LEU  97           HG       LEU  97  12.490  17.377   6.898
    6   HD12  LEU  97          HD11      LEU  97   9.964  17.323   6.786
    7   HD11  LEU  97          HD12      LEU  97   9.956  17.111   8.535
    8   HD13  LEU  97          HD13      LEU  97  10.699  15.889   7.503
    9   HD23  LEU  97          HD21      LEU  97  10.810  19.390   6.948
   10   HD22  LEU  97          HD22      LEU  97  12.502  19.698   7.339
   11   HD21  LEU  97          HD23      LEU  97  11.312  19.553   8.631

  No H/Q in entry =          11
  In of MODEL   62
    1    H    HIS  98           H        HIS  98  14.827  15.853  10.557
    2    HA   HIS  98           HA       HIS  98  14.712  17.100  13.082
    3    HB2  HIS  98           HB2      HIS  98  16.393  14.800  12.060
    4    HB3  HIS  98           HB3      HIS  98  16.412  15.327  13.745
    5    HD1  HIS  98           HD1      HIS  98  14.159  13.780  11.148
    6    HD2  HIS  98           HD2      HIS  98  14.089  14.674  15.219
    7    HE1  HIS  98           HE1      HIS  98  12.103  12.638  12.098
    8    HE2  HIS  98           HE2      HIS  98  12.040  13.175  14.573

  No H/Q in entry =           8
  In of MODEL   62
    1    H    GLU  99           H        GLU  99  17.255  16.928  10.639
    2    HA   GLU  99           HA       GLU  99  19.282  18.191  12.172
    3    HB2  GLU  99           HB2      GLU  99  19.718  16.904  10.092
    4    HB3  GLU  99           HB3      GLU  99  18.943  18.188   9.162
    5    HG2  GLU  99           HG2      GLU  99  20.601  19.806   9.960
    6    HG3  GLU  99           HG3      GLU  99  21.347  18.575  10.972

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LYS 100           H        LYS 100  16.787  19.441   9.970
    2    HA   LYS 100           HA       LYS 100  17.665  22.153  10.131
    3    HB2  LYS 100           HB2      LYS 100  14.993  20.947   9.375
    4    HB3  LYS 100           HB3      LYS 100  15.343  22.676   9.295
    5    HG2  LYS 100           HG2      LYS 100  17.298  22.180   7.820
    6    HG3  LYS 100           HG3      LYS 100  16.834  20.476   7.827
    7    HD2  LYS 100           HD2      LYS 100  14.652  21.056   6.837
    8    HD3  LYS 100           HD3      LYS 100  15.099  22.763   6.837
    9    HE2  LYS 100           HE2      LYS 100  17.039  22.235   5.368
   10    HE3  LYS 100           HE3      LYS 100  16.524  20.545   5.325
   11    HZ1  LYS 100           HZ1      LYS 100  14.762  22.796   4.510
   12    HZ3  LYS 100           HZ2      LYS 100  14.528  21.135   4.237
   13    HZ2  LYS 100           HZ3      LYS 100  15.761  21.967   3.418

  No H/Q in entry =          13
  In of MODEL   62
    1    H    LEU 101           H        LEU 101  15.514  20.156  12.088
    2    HA   LEU 101           HA       LEU 101  14.413  22.247  13.684
    3    HB2  LEU 101           HB2      LEU 101  14.769  19.283  14.046
    4    HB3  LEU 101           HB3      LEU 101  14.266  20.269  15.415
    5    HG   LEU 101           HG       LEU 101  12.844  20.417  12.751
    6   HD12  LEU 101          HD11      LEU 101  11.142  18.895  14.014
    7   HD11  LEU 101          HD12      LEU 101  12.527  18.434  15.002
    8   HD13  LEU 101          HD13      LEU 101  12.547  18.138  13.262
    9   HD21  LEU 101          HD21      LEU 101  12.218  21.210  15.610
   10   HD23  LEU 101          HD22      LEU 101  10.948  21.030  14.402
   11   HD22  LEU 101          HD23      LEU 101  12.218  22.229  14.169

  No H/Q in entry =          11
  In of MODEL   62
    1    H    LYS 102           H        LYS 102  17.540  21.549  13.234
    2    HA   LYS 102           HA       LYS 102  19.414  22.357  14.307
    3    HB2  LYS 102           HB2      LYS 102  17.649  23.917  15.456
    4    HB3  LYS 102           HB3      LYS 102  17.828  22.840  16.825
    5    HG2  LYS 102           HG2      LYS 102  19.777  24.802  15.664
    6    HG3  LYS 102           HG3      LYS 102  19.390  24.487  17.342
    7    HD2  LYS 102           HD2      LYS 102  20.995  22.538  15.638
    8    HD3  LYS 102           HD3      LYS 102  21.726  23.832  16.578
    9    HE2  LYS 102           HE2      LYS 102  21.255  21.290  17.530
   10    HE3  LYS 102           HE3      LYS 102  21.519  22.718  18.530
   11    HZ2  LYS 102           HZ1      LYS 102  19.515  21.489  19.145
   12    HZ1  LYS 102           HZ2      LYS 102  18.873  21.749  17.600
   13    HZ3  LYS 102           HZ3      LYS 102  19.146  23.064  18.634

  No H/Q in entry =          13
  In of MODEL   62
    1    H    ALA 103           H        ALA 103  17.302  20.797  16.724
    2    HA   ALA 103           HA       ALA 103  18.997  19.524  18.365
    3    HB2  ALA 103           HB1      ALA 103  17.354  17.565  18.350
    4    HB1  ALA 103           HB2      ALA 103  16.480  18.453  17.101
    5    HB3  ALA 103           HB3      ALA 103  16.684  19.157  18.704

  No H/Q in entry =           5
  In of MODEL   62
    1    H1   ALA   1           H3       ALA   1  -1.832  -6.446 -21.381
    2    H2   ALA   1           H2       ALA   1  -2.668  -7.860 -20.936
    3    H3   ALA   1           H1       ALA   1  -1.064  -7.954 -21.496
    4    HA   ALA   1           HA       ALA   1  -1.917  -8.384 -23.493
    5    HB1  ALA   1           HB1      ALA   1  -4.073  -9.041 -23.018
    6    HB2  ALA   1           HB2      ALA   1  -4.468  -7.512 -23.804
    7    HB3  ALA   1           HB3      ALA   1  -4.405  -7.607 -22.046

  No H/Q in entry =           7
  In of MODEL   62
    1    H    GLU   2           H        GLU   2  -2.715  -7.155 -25.472
    2    HA   GLU   2           HA       GLU   2  -1.258  -5.179 -26.339
    3    HB2  GLU   2           HB2      GLU   2  -4.267  -5.152 -26.649
    4    HB3  GLU   2           HB3      GLU   2  -3.123  -4.316 -27.695
    5    HG2  GLU   2           HG2      GLU   2  -2.681  -6.212 -28.865
    6    HG3  GLU   2           HG3      GLU   2  -2.407  -7.137 -27.394

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLU   3           H        GLU   3  -4.377  -3.833 -25.421
    2    HA   GLU   3           HA       GLU   3  -3.252  -1.314 -24.778
    3    HB2  GLU   3           HB2      GLU   3  -5.978  -2.549 -24.448
    4    HB3  GLU   3           HB3      GLU   3  -5.629  -0.948 -23.791
    5    HG2  GLU   3           HG2      GLU   3  -5.251  -0.018 -25.911
    6    HG3  GLU   3           HG3      GLU   3  -4.905  -1.579 -26.648

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LEU   4           H        LEU   4  -4.908  -3.639 -22.610
    2    HA   LEU   4           HA       LEU   4  -4.500  -2.440 -20.212
    3    HB2  LEU   4           HB2      LEU   4  -4.048  -5.393 -20.703
    4    HB3  LEU   4           HB3      LEU   4  -4.427  -4.646 -19.153
    5    HG   LEU   4           HG       LEU   4  -6.207  -4.648 -21.613
    6   HD13  LEU   4          HD11      LEU   4  -7.449  -6.336 -20.624
    7   HD12  LEU   4          HD12      LEU   4  -6.947  -5.903 -18.991
    8   HD11  LEU   4          HD13      LEU   4  -5.840  -6.772 -20.052
    9   HD23  LEU   4          HD21      LEU   4  -7.862  -3.800 -19.735
   10   HD22  LEU   4          HD22      LEU   4  -6.790  -2.655 -20.540
   11   HD21  LEU   4          HD23      LEU   4  -6.379  -3.269 -18.940

  No H/Q in entry =          11
  In of MODEL   62
    1    H    GLU   5           H        GLU   5  -2.064  -4.345 -21.962
    2    HA   GLU   5           HA       GLU   5  -0.067  -4.137 -19.929
    3    HB2  GLU   5           HB2      GLU   5  -0.122  -5.872 -21.765
    4    HB3  GLU   5           HB3      GLU   5   0.372  -4.606 -22.888
    5    HG2  GLU   5           HG2      GLU   5   2.371  -5.739 -22.185
    6    HG3  GLU   5           HG3      GLU   5   2.357  -4.174 -21.372

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLU   6           H        GLU   6  -0.658  -2.383 -22.960
    2    HA   GLU   6           HA       GLU   6   1.568  -0.620 -22.685
    3    HB2  GLU   6           HB2      GLU   6   0.418  -1.053 -24.846
    4    HB3  GLU   6           HB3      GLU   6  -1.005  -0.213 -24.231
    5    HG2  GLU   6           HG2      GLU   6   0.255   1.376 -25.530
    6    HG3  GLU   6           HG3      GLU   6   0.469   1.801 -23.833

  No H/Q in entry =           6
  In of MODEL   62
    1    H    VAL   7           H        VAL   7  -1.769  -0.597 -21.631
    2    HA   VAL   7           HA       VAL   7  -1.906   2.115 -20.775
    3    HB   VAL   7           HB       VAL   7  -3.442  -0.363 -19.953
    4   HG11  VAL   7          HG11      VAL   7  -3.727   2.529 -19.117
    5   HG13  VAL   7          HG12      VAL   7  -3.668   1.095 -18.092
    6   HG12  VAL   7          HG13      VAL   7  -5.094   1.415 -19.079
    7   HG21  VAL   7          HG21      VAL   7  -3.572   0.734 -22.333
    8   HG23  VAL   7          HG22      VAL   7  -4.477   2.005 -21.509
    9   HG22  VAL   7          HG23      VAL   7  -5.073   0.345 -21.493

  No H/Q in entry =           9
  In of MODEL   62
    1    H    VAL   8           H        VAL   8  -1.005  -0.911 -19.156
    2    HA   VAL   8           HA       VAL   8  -0.648   0.140 -16.554
    3    HB   VAL   8           HB       VAL   8   0.610  -2.226 -17.958
    4   HG11  VAL   8          HG11      VAL   8   0.981  -1.137 -15.173
    5   HG13  VAL   8          HG12      VAL   8   2.201  -1.736 -16.297
    6   HG12  VAL   8          HG13      VAL   8   1.123  -2.868 -15.481
    7   HG23  VAL   8          HG21      VAL   8  -1.334  -2.325 -15.639
    8   HG22  VAL   8          HG22      VAL   8  -1.053  -3.518 -16.903
    9   HG21  VAL   8          HG23      VAL   8  -1.949  -2.047 -17.268

  No H/Q in entry =           9
  In of MODEL   62
    1    H    MET   9           H        MET   9   1.584  -0.210 -19.309
    2    HA   MET   9           HA       MET   9   3.904   0.754 -18.047
    3    HB2  MET   9           HB2      MET   9   2.952   0.841 -20.909
    4    HB3  MET   9           HB3      MET   9   4.497   1.540 -20.425
    5    HG2  MET   9           HG2      MET   9   5.181  -0.640 -19.476
    6    HG3  MET   9           HG3      MET   9   3.642  -1.337 -19.984
    7    HE3  MET   9           HE1      MET   9   6.958   0.414 -22.531
    8    HE2  MET   9           HE2      MET   9   7.410  -0.798 -21.335
    9    HE1  MET   9           HE3      MET   9   6.567   0.662 -20.825

  No H/Q in entry =           9
  In of MODEL   62
    1    H    GLY  10           H        GLY  10   1.266   2.450 -19.705
    2    HA3  GLY  10           HA2      GLY  10   2.312   5.071 -19.444
    3    HA2  GLY  10           HA3      GLY  10   0.609   4.665 -19.647

  No H/Q in entry =           3
  In of MODEL   62
    1    H    LEU  11           H        LEU  11   0.168   3.134 -17.371
    2    HA   LEU  11           HA       LEU  11  -0.294   5.112 -15.396
    3    HB2  LEU  11           HB2      LEU  11  -0.321   2.095 -15.262
    4    HB3  LEU  11           HB3      LEU  11  -0.794   3.123 -13.910
    5    HG   LEU  11           HG       LEU  11  -2.036   3.296 -16.669
    6   HD13  LEU  11          HD11      LEU  11  -2.685   1.167 -15.927
    7   HD12  LEU  11          HD12      LEU  11  -4.002   2.197 -15.370
    8   HD11  LEU  11          HD13      LEU  11  -2.758   1.669 -14.238
    9   HD22  LEU  11          HD21      LEU  11  -2.561   5.322 -15.646
   10   HD21  LEU  11          HD22      LEU  11  -2.502   4.642 -14.020
   11   HD23  LEU  11          HD23      LEU  11  -3.891   4.327 -15.060

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  12           H        ILE  12   2.169   2.569 -15.664
    2    HA   ILE  12           HA       ILE  12   3.398   3.049 -13.160
    3    HB   ILE  12           HB       ILE  12   4.567   1.964 -15.744
    4   HG12  ILE  12          HG12      ILE  12   2.594   0.770 -14.553
    5   HG13  ILE  12          HG13      ILE  12   3.994  -0.196 -14.970
    6   HG22  ILE  12          HG21      ILE  12   6.198   0.870 -14.025
    7   HG21  ILE  12          HG22      ILE  12   5.689   2.173 -12.951
    8   HG23  ILE  12          HG23      ILE  12   6.465   2.550 -14.487
    9   HD13  ILE  12          HD11      ILE  12   4.795  -0.045 -12.673
   10   HD12  ILE  12          HD12      ILE  12   3.134  -0.635 -12.677
   11   HD11  ILE  12          HD13      ILE  12   3.472   1.030 -12.259

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  13           H        ILE  13   4.029   4.317 -16.410
    2    HA   ILE  13           HA       ILE  13   6.222   5.964 -15.680
    3    HB   ILE  13           HB       ILE  13   4.188   6.126 -17.917
    4   HG12  ILE  13          HG12      ILE  13   5.961   4.224 -17.662
    5   HG13  ILE  13          HG13      ILE  13   5.742   4.989 -19.232
    6   HG22  ILE  13          HG21      ILE  13   6.070   7.627 -18.959
    7   HG21  ILE  13          HG22      ILE  13   6.526   7.924 -17.285
    8   HG23  ILE  13          HG23      ILE  13   4.911   8.356 -17.847
    9   HD12  ILE  13          HD11      ILE  13   8.185   4.675 -18.267
   10   HD11  ILE  13          HD12      ILE  13   7.775   6.102 -17.322
   11   HD13  ILE  13          HD13      ILE  13   7.749   6.177 -19.081

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ASN  14           H        ASN  14   2.732   6.571 -15.932
    2    HA   ASN  14           HA       ASN  14   2.779   9.312 -15.275
    3    HB2  ASN  14           HB2      ASN  14   0.832   7.737 -16.111
    4    HB3  ASN  14           HB3      ASN  14   0.510   7.556 -14.391
    5   HD21  ASN  14          HD21      ASN  14  -1.476   8.786 -15.808
    6   HD22  ASN  14          HD22      ASN  14  -1.485  10.459 -15.528

  No H/Q in entry =           6
  In of MODEL   62
    1    H    SER  15           H        SER  15   2.399   6.431 -13.218
    2    HA   SER  15           HA       SER  15   2.144   7.792 -10.759
    3    HB2  SER  15           HB2      SER  15   2.626   5.682  -9.727
    4    HB3  SER  15           HB3      SER  15   1.786   5.299 -11.226
    5    HG   SER  15           HG       SER  15   3.491   4.133 -11.603

  No H/Q in entry =           5
  In of MODEL   62
    1    H    GLY  16           H        GLY  16   4.978   6.618 -12.536
    2    HA3  GLY  16           HA2      GLY  16   6.932   7.300 -10.607
    3    HA2  GLY  16           HA3      GLY  16   7.223   7.101 -12.333

  No H/Q in entry =           3
  In of MODEL   62
    1    H    GLN  17           H        GLN  17   5.592   9.118 -13.375
    2    HA   GLN  17           HA       GLN  17   7.242  11.407 -13.056
    3    HB2  GLN  17           HB2      GLN  17   5.882  10.962 -15.092
    4    HB3  GLN  17           HB3      GLN  17   4.419  11.269 -14.156
    5    HG2  GLN  17           HG2      GLN  17   5.024  13.294 -15.364
    6    HG3  GLN  17           HG3      GLN  17   5.272  13.555 -13.638
    7   HE21  GLN  17          HE21      GLN  17   7.026  15.041 -13.722
    8   HE22  GLN  17          HE22      GLN  17   8.525  14.670 -14.427

  No H/Q in entry =           8
  In of MODEL   62
    1    H    ALA  18           H        ALA  18   4.116  10.475 -11.703
    2    HA   ALA  18           HA       ALA  18   3.469  12.876 -10.418
    3    HB1  ALA  18           HB1      ALA  18   2.264  10.456 -10.654
    4    HB2  ALA  18           HB2      ALA  18   1.757  11.684  -9.496
    5    HB3  ALA  18           HB3      ALA  18   2.809  10.365  -8.980

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ARG  19           H        ARG  19   5.262  10.048  -9.165
    2    HA   ARG  19           HA       ARG  19   5.837  11.170  -6.637
    3    HB2  ARG  19           HB2      ARG  19   6.177   8.760  -7.183
    4    HB3  ARG  19           HB3      ARG  19   7.544   9.212  -8.205
    5    HG2  ARG  19           HG2      ARG  19   8.700  10.204  -6.279
    6    HG3  ARG  19           HG3      ARG  19   7.317   9.850  -5.245
    7    HD2  ARG  19           HD2      ARG  19   9.030   8.160  -4.905
    8    HD3  ARG  19           HD3      ARG  19   7.630   7.425  -5.692
    9    HE   ARG  19           HE       ARG  19   9.352   8.207  -7.739
   10   HH21  ARG  19          HH11      ARG  19  10.867   6.762  -8.605
   11   HH22  ARG  19          HH12      ARG  19  11.374   5.391  -7.681
   12   HH11  ARG  19          HH21      ARG  19   9.372   6.155  -4.976
   13   HH12  ARG  19          HH22      ARG  19  10.525   5.048  -5.625

  No H/Q in entry =          13
  In of MODEL   62
    1    H    SER  20           H        SER  20   7.645  11.168  -9.692
    2    HA   SER  20           HA       SER  20   9.934  12.510  -8.865
    3    HB2  SER  20           HB2      SER  20   9.929  11.648 -11.076
    4    HB3  SER  20           HB3      SER  20   8.456  12.517 -11.493
    5    HG   SER  20           HG       SER  20  11.063  13.524 -11.060

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LEU  21           H        LEU  21   6.870  13.879 -10.042
    2    HA   LEU  21           HA       LEU  21   7.622  16.602  -9.801
    3    HB2  LEU  21           HB2      LEU  21   4.914  15.255  -9.725
    4    HB3  LEU  21           HB3      LEU  21   5.130  17.004  -9.711
    5    HG   LEU  21           HG       LEU  21   6.273  15.200 -11.865
    6   HD13  LEU  21          HD11      LEU  21   3.897  14.983 -12.037
    7   HD12  LEU  21          HD12      LEU  21   4.363  16.183 -13.243
    8   HD11  LEU  21          HD13      LEU  21   3.649  16.700 -11.717
    9   HD21  LEU  21          HD21      LEU  21   6.111  18.175 -11.412
   10   HD23  LEU  21          HD22      LEU  21   6.100  17.570 -13.067
   11   HD22  LEU  21          HD23      LEU  21   7.466  17.228 -12.018

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ALA  22           H        ALA  22   6.051  14.341  -7.564
    2    HA   ALA  22           HA       ALA  22   5.507  16.151  -5.482
    3    HB3  ALA  22           HB1      ALA  22   4.676  13.783  -5.660
    4    HB2  ALA  22           HB2      ALA  22   5.283  14.226  -4.064
    5    HB1  ALA  22           HB3      ALA  22   6.275  13.246  -5.145

  No H/Q in entry =           5
  In of MODEL   62
    1    H    TYR  23           H        TYR  23   8.380  14.045  -5.945
    2    HA   TYR  23           HA       TYR  23   9.799  15.007  -3.690
    3    HB2  TYR  23           HB2      TYR  23  10.525  12.986  -4.864
    4    HB3  TYR  23           HB3      TYR  23  10.858  13.924  -6.319
    5    HD1  TYR  23           HD1      TYR  23  11.815  13.576  -2.723
    6    HD2  TYR  23           HD2      TYR  23  12.937  15.002  -6.617
    7    HE1  TYR  23           HE1      TYR  23  14.091  14.084  -1.881
    8    HE2  TYR  23           HE2      TYR  23  15.214  15.511  -5.775
    9    HH   TYR  23           HH       TYR  23  16.320  14.416  -2.697

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ALA  24           H        ALA  24   9.637  16.143  -7.047
    2    HA   ALA  24           HA       ALA  24  11.591  18.172  -6.793
    3    HB2  ALA  24           HB1      ALA  24  11.143  18.263  -8.999
    4    HB3  ALA  24           HB2      ALA  24   9.611  19.053  -8.629
    5    HB1  ALA  24           HB3      ALA  24   9.687  17.298  -8.772

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ALA  25           H        ALA  25   8.111  18.081  -6.161
    2    HA   ALA  25           HA       ALA  25   7.708  20.807  -5.571
    3    HB1  ALA  25           HB1      ALA  25   5.992  18.857  -5.780
    4    HB2  ALA  25           HB2      ALA  25   5.663  20.147  -4.622
    5    HB3  ALA  25           HB3      ALA  25   6.312  18.603  -4.064

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LEU  26           H        LEU  26   8.709  18.084  -3.544
    2    HA   LEU  26           HA       LEU  26   8.861  19.494  -1.097
    3    HB2  LEU  26           HB2      LEU  26   8.890  17.076  -1.109
    4    HB3  LEU  26           HB3      LEU  26  10.356  17.050  -2.085
    5    HG   LEU  26           HG       LEU  26  11.607  18.122  -0.241
    6   HD12  LEU  26          HD11      LEU  26  10.389  18.147   2.023
    7   HD11  LEU  26          HD12      LEU  26   8.895  18.056   1.093
    8   HD13  LEU  26          HD13      LEU  26   9.977  19.435   0.890
    9   HD21  LEU  26          HD21      LEU  26  10.010  15.690   0.620
   10   HD23  LEU  26          HD22      LEU  26  11.543  16.206   1.316
   11   HD22  LEU  26          HD23      LEU  26  11.477  15.661  -0.358

  No H/Q in entry =          11
  In of MODEL   62
    1    H    LYS  27           H        LYS  27  11.253  18.874  -3.634
    2    HA   LYS  27           HA       LYS  27  13.474  20.047  -2.405
    3    HB2  LYS  27           HB2      LYS  27  13.532  18.712  -4.505
    4    HB3  LYS  27           HB3      LYS  27  12.800  20.071  -5.358
    5    HG2  LYS  27           HG2      LYS  27  14.707  21.501  -4.776
    6    HG3  LYS  27           HG3      LYS  27  15.435  20.183  -3.852
    7    HD2  LYS  27           HD2      LYS  27  15.534  18.807  -5.916
    8    HD3  LYS  27           HD3      LYS  27  14.852  20.150  -6.832
    9    HE2  LYS  27           HE2      LYS  27  16.780  21.560  -6.216
   10    HE3  LYS  27           HE3      LYS  27  17.467  20.221  -5.290
   11    HZ3  LYS  27           HZ1      LYS  27  18.452  20.310  -7.480
   12    HZ2  LYS  27           HZ2      LYS  27  16.920  20.237  -8.216
   13    HZ1  LYS  27           HZ3      LYS  27  17.511  18.905  -7.343

  No H/Q in entry =          13
  In of MODEL   62
    1    H    GLN  28           H        GLN  28  10.883  21.512  -4.335
    2    HA   GLN  28           HA       GLN  28  11.911  24.139  -4.473
    3    HB2  GLN  28           HB2      GLN  28   9.053  23.138  -4.363
    4    HB3  GLN  28           HB3      GLN  28   9.503  24.805  -4.717
    5    HG2  GLN  28           HG2      GLN  28  10.444  22.394  -6.296
    6    HG3  GLN  28           HG3      GLN  28   9.128  23.461  -6.783
    7   HE21  GLN  28          HE21      GLN  28  12.255  22.915  -7.530
    8   HE22  GLN  28          HE22      GLN  28  12.770  24.495  -7.881

  No H/Q in entry =           8
  In of MODEL   62
    1    H    ALA  29           H        ALA  29   9.944  22.481  -2.042
    2    HA   ALA  29           HA       ALA  29   9.458  24.675  -0.343
    3    HB2  ALA  29           HB1      ALA  29   8.693  23.115   1.217
    4    HB1  ALA  29           HB2      ALA  29   9.881  21.903   0.740
    5    HB3  ALA  29           HB3      ALA  29   8.500  22.240  -0.302

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LYS  30           H        LYS  30  12.128  22.337  -0.438
    2    HA   LYS  30           HA       LYS  30  13.478  23.241   1.867
    3    HB2  LYS  30           HB2      LYS  30  14.531  21.944  -0.656
    4    HB3  LYS  30           HB3      LYS  30  15.528  22.267   0.765
    5    HG2  LYS  30           HG2      LYS  30  13.944  20.916   2.140
    6    HG3  LYS  30           HG3      LYS  30  13.043  20.528   0.671
    7    HD2  LYS  30           HD2      LYS  30  15.058  19.495  -0.305
    8    HD3  LYS  30           HD3      LYS  30  15.978  19.896   1.147
    9    HE2  LYS  30           HE2      LYS  30  14.441  18.496   2.497
   10    HE3  LYS  30           HE3      LYS  30  13.550  18.073   1.029
   11    HZ2  LYS  30           HZ1      LYS  30  15.303  16.443   1.772
   12    HZ1  LYS  30           HZ2      LYS  30  16.469  17.604   1.325
   13    HZ3  LYS  30           HZ3      LYS  30  15.412  16.955   0.159

  No H/Q in entry =          13
  In of MODEL   62
    1    H    GLN  31           H        GLN  31  13.389  24.471  -1.421
    2    HA   GLN  31           HA       GLN  31  15.592  26.304  -0.994
    3    HB2  GLN  31           HB2      GLN  31  13.543  26.420  -3.210
    4    HB3  GLN  31           HB3      GLN  31  15.181  27.073  -3.212
    5    HG2  GLN  31           HG2      GLN  31  15.574  24.362  -2.657
    6    HG3  GLN  31           HG3      GLN  31  14.265  24.350  -3.832
    7   HE21  GLN  31          HE21      GLN  31  17.086  23.486  -4.251
    8   HE22  GLN  31          HE22      GLN  31  17.679  24.453  -5.513

  No H/Q in entry =           8
  In of MODEL   62
    1    H    GLY  32           H        GLY  32  12.518  26.194   0.161
    2    HA3  GLY  32           HA2      GLY  32  11.407  27.783   1.450
    3    HA2  GLY  32           HA3      GLY  32  12.562  28.992   0.904

  No H/Q in entry =           3
  In of MODEL   62
    1    H    ASP  33           H        ASP  33  11.140  27.142  -1.596
    2    HA   ASP  33           HA       ASP  33   9.533  29.463  -2.430
    3    HB2  ASP  33           HB2      ASP  33  10.558  27.027  -3.893
    4    HB3  ASP  33           HB3      ASP  33   9.433  28.177  -4.612

  No H/Q in entry =           4
  In of MODEL   62
    1    H    PHE  34           H        PHE  34   7.838  29.021  -0.864
    2    HA   PHE  34           HA       PHE  34   6.395  26.585  -0.780
    3    HB2  PHE  34           HB2      PHE  34   5.509  29.391  -0.078
    4    HB3  PHE  34           HB3      PHE  34   4.623  27.920   0.326
    5    HD1  PHE  34           HD1      PHE  34   6.939  30.251   1.549
    6    HD2  PHE  34           HD2      PHE  34   6.149  26.029   1.469
    7    HE1  PHE  34           HE1      PHE  34   8.330  29.950   3.579
    8    HE2  PHE  34           HE2      PHE  34   7.542  25.732   3.497
    9    HZ   PHE  34           HZ       PHE  34   8.626  27.694   4.551

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ALA  35           H        ALA  35   6.032  29.473  -2.769
    2    HA   ALA  35           HA       ALA  35   3.462  28.932  -3.789
    3    HB1  ALA  35           HB1      ALA  35   4.543  30.311  -5.821
    4    HB3  ALA  35           HB2      ALA  35   5.774  30.632  -4.599
    5    HB2  ALA  35           HB3      ALA  35   4.095  31.083  -4.300

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ALA  36           H        ALA  36   6.667  28.185  -5.160
    2    HA   ALA  36           HA       ALA  36   5.634  26.798  -7.410
    3    HB3  ALA  36           HB1      ALA  36   7.793  26.871  -8.033
    4    HB2  ALA  36           HB2      ALA  36   8.253  25.820  -6.691
    5    HB1  ALA  36           HB3      ALA  36   8.193  27.569  -6.463

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ALA  37           H        ALA  37   6.575  25.756  -4.166
    2    HA   ALA  37           HA       ALA  37   6.443  22.973  -4.614
    3    HB2  ALA  37           HB1      ALA  37   6.237  24.754  -2.222
    4    HB1  ALA  37           HB2      ALA  37   7.334  23.409  -2.528
    5    HB3  ALA  37           HB3      ALA  37   5.666  23.095  -2.053

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LYS  38           H        LYS  38   3.972  25.238  -3.421
    2    HA   LYS  38           HA       LYS  38   1.827  23.478  -3.204
    3    HB2  LYS  38           HB2      LYS  38   2.251  26.222  -2.935
    4    HB3  LYS  38           HB3      LYS  38   1.044  26.115  -4.210
    5    HG2  LYS  38           HG2      LYS  38  -0.435  24.820  -2.772
    6    HG3  LYS  38           HG3      LYS  38   0.812  24.719  -1.520
    7    HD2  LYS  38           HD2      LYS  38   0.688  27.056  -1.056
    8    HD3  LYS  38           HD3      LYS  38  -0.221  27.379  -2.533
    9    HE2  LYS  38           HE2      LYS  38  -1.716  27.438  -0.588
   10    HE3  LYS  38           HE3      LYS  38  -2.129  26.079  -1.638
   11    HZ3  LYS  38           HZ1      LYS  38  -1.437  24.579  -0.118
   12    HZ2  LYS  38           HZ2      LYS  38  -1.751  25.838   0.981
   13    HZ1  LYS  38           HZ3      LYS  38  -0.165  25.549   0.449

  No H/Q in entry =          13
  In of MODEL   62
    1    H    ALA  39           H        ALA  39   2.846  25.375  -6.043
    2    HA   ALA  39           HA       ALA  39   0.743  24.573  -7.744
    3    HB2  ALA  39           HB1      ALA  39   3.491  25.158  -8.803
    4    HB1  ALA  39           HB2      ALA  39   2.560  26.438  -8.026
    5    HB3  ALA  39           HB3      ALA  39   1.921  25.627  -9.455

  No H/Q in entry =           5
  In of MODEL   62
    1    H    MET  40           H        MET  40   3.948  23.187  -7.185
    2    HA   MET  40           HA       MET  40   3.791  21.184  -9.190
    3    HB2  MET  40           HB2      MET  40   5.417  21.349  -6.646
    4    HB3  MET  40           HB3      MET  40   5.631  20.095  -7.870
    5    HG2  MET  40           HG2      MET  40   5.762  23.053  -8.515
    6    HG3  MET  40           HG3      MET  40   7.186  22.111  -8.078
    7    HE3  MET  40           HE1      MET  40   7.991  19.894 -10.905
    8    HE2  MET  40           HE2      MET  40   7.426  19.577  -9.267
    9    HE1  MET  40           HE3      MET  40   8.554  20.898  -9.562

  No H/Q in entry =           9
  In of MODEL   62
    1    H    MET  41           H        MET  41   2.890  21.226  -5.763
    2    HA   MET  41           HA       MET  41   2.287  18.474  -5.502
    3    HB2  MET  41           HB2      MET  41   1.020  20.855  -4.130
    4    HB3  MET  41           HB3      MET  41   0.823  19.178  -3.633
    5    HG2  MET  41           HG2      MET  41   3.538  19.332  -3.679
    6    HG3  MET  41           HG3      MET  41   3.142  20.999  -3.270
    7    HE2  MET  41           HE1      MET  41   0.077  19.811  -1.542
    8    HE1  MET  41           HE2      MET  41   0.931  21.306  -1.912
    9    HE3  MET  41           HE3      MET  41   0.863  20.725  -0.248

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ASP  42           H        ASP  42   0.316  21.256  -6.450
    2    HA   ASP  42           HA       ASP  42  -2.159  19.959  -6.587
    3    HB2  ASP  42           HB2      ASP  42  -1.388  22.513  -6.828
    4    HB3  ASP  42           HB3      ASP  42  -1.555  22.134  -8.539

  No H/Q in entry =           4
  In of MODEL   62
    1    H    GLN  43           H        GLN  43   0.287  20.506  -9.094
    2    HA   GLN  43           HA       GLN  43  -1.140  19.237 -11.187
    3    HB2  GLN  43           HB2      GLN  43   1.832  19.675 -10.813
    4    HB3  GLN  43           HB3      GLN  43   1.097  19.064 -12.297
    5    HG2  GLN  43           HG2      GLN  43  -0.363  21.129 -12.319
    6    HG3  GLN  43           HG3      GLN  43   0.611  21.751 -10.990
    7   HE21  GLN  43          HE21      GLN  43   0.806  23.382 -13.065
    8   HE22  GLN  43          HE22      GLN  43   2.212  23.131 -13.979

  No H/Q in entry =           8
  In of MODEL   62
    1    H    SER  44           H        SER  44   1.189  18.021  -8.813
    2    HA   SER  44           HA       SER  44   1.455  15.414  -9.858
    3    HB2  SER  44           HB2      SER  44   2.393  16.814  -7.615
    4    HB3  SER  44           HB3      SER  44   1.499  15.448  -6.950
    5    HG   SER  44           HG       SER  44   3.592  14.778  -7.389

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ARG  45           H        ARG  45  -0.823  16.773  -7.502
    2    HA   ARG  45           HA       ARG  45  -2.266  14.444  -6.879
    3    HB2  ARG  45           HB2      ARG  45  -2.406  16.607  -5.671
    4    HB3  ARG  45           HB3      ARG  45  -3.250  17.305  -7.050
    5    HG2  ARG  45           HG2      ARG  45  -5.058  15.622  -6.773
    6    HG3  ARG  45           HG3      ARG  45  -4.224  14.979  -5.357
    7    HD2  ARG  45           HD2      ARG  45  -4.370  17.243  -4.284
    8    HD3  ARG  45           HD3      ARG  45  -5.349  17.797  -5.660
    9    HE   ARG  45           HE       ARG  45  -6.514  15.442  -4.632
   10   HH21  ARG  45          HH11      ARG  45  -8.343  15.554  -3.354
   11   HH22  ARG  45          HH12      ARG  45  -8.699  16.997  -2.474
   12   HH11  ARG  45          HH21      ARG  45  -5.884  18.667  -3.588
   13   HH12  ARG  45          HH22      ARG  45  -7.302  18.760  -2.604

  No H/Q in entry =          13
  In of MODEL   62
    1    H    MET  46           H        MET  46  -2.799  16.880  -9.410
    2    HA   MET  46           HA       MET  46  -5.170  15.773 -10.472
    3    HB2  MET  46           HB2      MET  46  -3.028  17.555 -11.643
    4    HB3  MET  46           HB3      MET  46  -4.428  17.040 -12.589
    5    HG2  MET  46           HG2      MET  46  -5.942  18.004 -10.930
    6    HG3  MET  46           HG3      MET  46  -4.582  18.449  -9.905
    7    HE2  MET  46           HE1      MET  46  -6.206  20.219 -13.695
    8    HE1  MET  46           HE2      MET  46  -6.271  18.556 -13.123
    9    HE3  MET  46           HE3      MET  46  -4.903  19.093 -14.096

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ALA  47           H        ALA  47  -1.757  15.215 -11.245
    2    HA   ALA  47           HA       ALA  47  -2.152  13.512 -13.466
    3    HB3  ALA  47           HB1      ALA  47   0.048  14.345 -13.116
    4    HB2  ALA  47           HB2      ALA  47   0.148  12.612 -12.795
    5    HB1  ALA  47           HB3      ALA  47   0.088  13.756 -11.453

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LEU  48           H        LEU  48  -1.886  12.845  -9.998
    2    HA   LEU  48           HA       LEU  48  -2.050  10.010 -10.176
    3    HB2  LEU  48           HB2      LEU  48  -2.760  11.930  -7.946
    4    HB3  LEU  48           HB3      LEU  48  -2.708  10.177  -7.758
    5    HG   LEU  48           HG       LEU  48  -0.372  11.826  -8.751
    6   HD13  LEU  48          HD11      LEU  48  -0.628  12.588  -6.554
    7   HD12  LEU  48          HD12      LEU  48   0.503  11.251  -6.369
    8   HD11  LEU  48          HD13      LEU  48  -1.200  11.027  -5.967
    9   HD22  LEU  48          HD21      LEU  48   0.071   9.634  -9.409
   10   HD21  LEU  48          HD22      LEU  48  -0.811   8.930  -8.055
   11   HD23  LEU  48          HD23      LEU  48   0.780   9.643  -7.795

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ASN  49           H        ASN  49  -4.451  12.558  -9.748
    2    HA   ASN  49           HA       ASN  49  -6.675  10.944  -9.213
    3    HB2  ASN  49           HB2      ASN  49  -6.673  13.365  -8.872
    4    HB3  ASN  49           HB3      ASN  49  -6.510  13.634 -10.603
    5   HD21  ASN  49          HD21      ASN  49  -8.690  14.732  -9.185
    6   HD22  ASN  49          HD22      ASN  49 -10.113  13.947  -9.670

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLU  50           H        GLU  50  -5.377  12.131 -12.296
    2    HA   GLU  50           HA       GLU  50  -7.366  10.935 -13.944
    3    HB2  GLU  50           HB2      GLU  50  -5.859  12.723 -14.751
    4    HB3  GLU  50           HB3      GLU  50  -4.491  11.617 -14.625
    5    HG2  GLU  50           HG2      GLU  50  -5.507  10.117 -16.269
    6    HG3  GLU  50           HG3      GLU  50  -6.944  11.131 -16.345

  No H/Q in entry =           6
  In of MODEL   62
    1    H    ALA  51           H        ALA  51  -4.217   9.857 -12.756
    2    HA   ALA  51           HA       ALA  51  -4.142   7.412 -14.191
    3    HB2  ALA  51           HB1      ALA  51  -2.165   7.068 -13.100
    4    HB1  ALA  51           HB2      ALA  51  -2.838   7.496 -11.527
    5    HB3  ALA  51           HB3      ALA  51  -2.355   8.763 -12.654

  No H/Q in entry =           5
  In of MODEL   62
    1    H    HIS  52           H        HIS  52  -5.284   8.249 -10.933
    2    HA   HIS  52           HA       HIS  52  -6.030   5.651 -10.117
    3    HB2  HIS  52           HB2      HIS  52  -5.837   7.622  -8.608
    4    HB3  HIS  52           HB3      HIS  52  -7.308   8.279  -9.328
    5    HD1  HIS  52           HD1      HIS  52  -9.548   7.037  -8.828
    6    HD2  HIS  52           HD2      HIS  52  -6.248   5.436  -6.847
    7    HE1  HIS  52           HE1      HIS  52 -10.463   5.469  -7.063
    8    HE2  HIS  52           HE2      HIS  52  -8.464   4.485  -5.845

  No H/Q in entry =           8
  In of MODEL   62
    1    H    LEU  53           H        LEU  53  -7.795   8.165 -11.882
    2    HA   LEU  53           HA       LEU  53 -10.332   6.936 -11.896
    3    HB2  LEU  53           HB2      LEU  53  -9.004   8.899 -13.752
    4    HB3  LEU  53           HB3      LEU  53 -10.617   8.274 -14.080
    5    HG   LEU  53           HG       LEU  53  -9.880   9.543 -11.424
    6   HD11  LEU  53          HD11      LEU  53 -11.028  10.815 -13.925
    7   HD13  LEU  53          HD12      LEU  53  -9.520  11.237 -13.114
    8   HD12  LEU  53          HD13      LEU  53 -11.065  11.569 -12.336
    9   HD21  LEU  53          HD21      LEU  53 -12.459   8.767 -12.801
   10   HD23  LEU  53          HD22      LEU  53 -12.439  10.008 -11.554
   11   HD22  LEU  53          HD23      LEU  53 -11.942   8.372 -11.167

  No H/Q in entry =          11
  In of MODEL   62
    1    H    VAL  54           H        VAL  54  -7.594   6.686 -14.143
    2    HA   VAL  54           HA       VAL  54  -8.866   4.959 -15.994
    3    HB   VAL  54           HB       VAL  54  -5.944   5.388 -15.318
    4   HG12  VAL  54          HG11      VAL  54  -5.731   4.314 -17.715
    5   HG11  VAL  54          HG12      VAL  54  -7.277   3.568 -17.312
    6   HG13  VAL  54          HG13      VAL  54  -5.866   3.271 -16.299
    7   HG22  VAL  54          HG21      VAL  54  -6.668   7.357 -16.347
    8   HG21  VAL  54          HG22      VAL  54  -7.885   6.531 -17.317
    9   HG23  VAL  54          HG23      VAL  54  -6.183   6.411 -17.753

  No H/Q in entry =           9
  In of MODEL   62
    1    H    GLN  55           H        GLN  55  -6.872   4.343 -13.105
    2    HA   GLN  55           HA       GLN  55  -6.854   1.526 -13.381
    3    HB2  GLN  55           HB2      GLN  55  -5.272   2.372 -11.861
    4    HB3  GLN  55           HB3      GLN  55  -6.462   3.363 -11.020
    5    HG2  GLN  55           HG2      GLN  55  -7.190   1.614  -9.713
    6    HG3  GLN  55           HG3      GLN  55  -6.999   0.431 -11.000
    7   HE21  GLN  55          HE21      GLN  55  -5.412  -1.062 -10.521
    8   HE22  GLN  55          HE22      GLN  55  -4.016  -0.752  -9.610

  No H/Q in entry =           8
  In of MODEL   62
    1    H    THR  56           H        THR  56  -9.125   3.736 -11.744
    2    HA   THR  56           HA       THR  56 -10.753   1.884 -10.463
    3    HB   THR  56           HB       THR  56 -11.616   4.405 -11.913
    4    HG1  THR  56           HG1      THR  56 -10.858   3.889  -9.229
    5   HG23  THR  56          HG21      THR  56 -13.632   3.346 -11.477
    6   HG22  THR  56          HG22      THR  56 -13.387   4.214  -9.961
    7   HG21  THR  56          HG23      THR  56 -13.000   2.496 -10.068

  No H/Q in entry =           7
  In of MODEL   62
    1    H    LYS  57           H        LYS  57 -10.937   2.995 -13.841
    2    HA   LYS  57           HA       LYS  57 -13.138   1.369 -14.600
    3    HB2  LYS  57           HB2      LYS  57 -12.215   3.306 -15.906
    4    HB3  LYS  57           HB3      LYS  57 -10.802   2.331 -16.286
    5    HG2  LYS  57           HG2      LYS  57 -12.128   2.022 -18.178
    6    HG3  LYS  57           HG3      LYS  57 -12.539   0.612 -17.209
    7    HD2  LYS  57           HD2      LYS  57 -14.671   1.332 -17.716
    8    HD3  LYS  57           HD3      LYS  57 -14.407   2.282 -16.255
    9    HE2  LYS  57           HE2      LYS  57 -15.032   4.009 -17.647
   10    HE3  LYS  57           HE3      LYS  57 -13.320   3.980 -18.070
   11    HZ3  LYS  57           HZ1      LYS  57 -13.815   2.552 -19.928
   12    HZ2  LYS  57           HZ2      LYS  57 -14.761   3.961 -20.020
   13    HZ1  LYS  57           HZ3      LYS  57 -15.456   2.498 -19.503

  No H/Q in entry =          13
  In of MODEL   62
    1    H    LEU  58           H        LEU  58  -9.645   0.848 -14.556
    2    HA   LEU  58           HA       LEU  58  -9.721  -1.659 -15.861
    3    HB2  LEU  58           HB2      LEU  58  -7.649  -0.431 -14.050
    4    HB3  LEU  58           HB3      LEU  58  -7.430  -1.953 -14.915
    5    HG   LEU  58           HG       LEU  58  -8.121   0.679 -16.259
    6   HD11  LEU  58          HD11      LEU  58  -5.505  -0.630 -15.584
    7   HD13  LEU  58          HD12      LEU  58  -5.956   1.073 -15.523
    8   HD12  LEU  58          HD13      LEU  58  -5.641   0.304 -17.075
    9   HD22  LEU  58          HD21      LEU  58  -8.740  -0.858 -17.859
   10   HD21  LEU  58          HD22      LEU  58  -7.729  -2.136 -17.189
   11   HD23  LEU  58          HD23      LEU  58  -7.009  -0.873 -18.187

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  59           H        ILE  59 -10.510  -0.757 -12.602
    2    HA   ILE  59           HA       ILE  59 -10.227  -3.539 -11.674
    3    HB   ILE  59           HB       ILE  59  -9.726  -1.289 -10.263
    4   HG12  ILE  59          HG12      ILE  59 -11.133  -3.626  -8.953
    5   HG13  ILE  59          HG13      ILE  59  -9.493  -3.727  -9.542
    6   HG23  ILE  59          HG21      ILE  59 -11.538  -0.577  -8.929
    7   HG22  ILE  59          HG22      ILE  59 -12.507  -1.979  -9.319
    8   HG21  ILE  59          HG23      ILE  59 -12.253  -0.714 -10.518
    9   HD11  ILE  59          HD11      ILE  59 -10.485  -1.718  -7.531
   10   HD13  ILE  59          HD12      ILE  59  -8.827  -1.846  -8.104
   11   HD12  ILE  59          HD13      ILE  59  -9.532  -3.148  -7.143

  No H/Q in entry =          11
  In of MODEL   62
    1    H    GLU  60           H        GLU  60 -12.728  -1.154 -12.460
    2    HA   GLU  60           HA       GLU  60 -14.947  -2.622 -11.451
    3    HB2  GLU  60           HB2      GLU  60 -15.203  -0.281 -11.984
    4    HB3  GLU  60           HB3      GLU  60 -14.721  -0.557 -13.655
    5    HG2  GLU  60           HG2      GLU  60 -17.106  -1.999 -12.521
    6    HG3  GLU  60           HG3      GLU  60 -17.265  -0.356 -13.107

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLY  61           H        GLY  61 -13.282  -2.628 -14.570
    2    HA3  GLY  61           HA2      GLY  61 -15.053  -4.824 -15.470
    3    HA2  GLY  61           HA3      GLY  61 -14.183  -3.733 -16.543

  No H/Q in entry =           3
  In of MODEL   62
    1    H    ASP  62           H        ASP  62 -12.838  -5.233 -13.672
    2    HA   ASP  62           HA       ASP  62 -10.630  -6.287 -15.184
    3    HB2  ASP  62           HB2      ASP  62  -9.894  -7.099 -12.933
    4    HB3  ASP  62           HB3      ASP  62 -10.231  -5.373 -12.984

  No H/Q in entry =           4
  In of MODEL   62
    1    H    ALA  63           H        ALA  63 -13.529  -7.452 -15.445
    2    HA   ALA  63           HA       ALA  63 -13.696 -10.064 -14.476
    3    HB3  ALA  63           HB1      ALA  63 -15.222 -10.479 -16.307
    4    HB1  ALA  63           HB2      ALA  63 -14.497  -9.195 -17.272
    5    HB2  ALA  63           HB3      ALA  63 -15.434  -8.795 -15.830

  No H/Q in entry =           5
  In of MODEL   62
    1    H    GLY  64           H        GLY  64 -12.210  -8.907 -17.478
    2    HA3  GLY  64           HA2      GLY  64 -10.690  -9.838 -18.918
    3    HA2  GLY  64           HA3      GLY  64  -9.998 -10.594 -17.489

  No H/Q in entry =           3
  In of MODEL   62
    1    H    GLU  65           H        GLU  65  -9.657 -12.687 -18.002
    2    HA   GLU  65           HA       GLU  65 -10.903 -14.179 -19.935
    3    HB2  GLU  65           HB2      GLU  65  -9.760 -15.148 -17.315
    4    HB3  GLU  65           HB3      GLU  65 -10.159 -16.189 -18.682
    5    HG2  GLU  65           HG2      GLU  65  -8.236 -13.848 -18.809
    6    HG3  GLU  65           HG3      GLU  65  -7.750 -15.534 -18.641

  No H/Q in entry =           6
  In of MODEL   62
    1    H    GLY  66           H        GLY  66 -12.129 -16.221 -19.546
    2    HA3  GLY  66           HA2      GLY  66 -14.776 -15.652 -18.780
    3    HA2  GLY  66           HA3      GLY  66 -14.141 -17.228 -19.210

  No H/Q in entry =           3
  In of MODEL   62
    1    H    LYS  67           H        LYS  67 -12.209 -17.392 -17.134
    2    HA   LYS  67           HA       LYS  67 -13.958 -18.216 -14.974
    3    HB2  LYS  67           HB2      LYS  67 -11.931 -19.376 -14.136
    4    HB3  LYS  67           HB3      LYS  67 -12.331 -19.796 -15.808
    5    HG2  LYS  67           HG2      LYS  67 -10.716 -18.082 -16.603
    6    HG3  LYS  67           HG3      LYS  67 -10.281 -17.739 -14.931
    7    HD2  LYS  67           HD2      LYS  67  -9.503 -20.058 -14.646
    8    HD3  LYS  67           HD3      LYS  67  -9.959 -20.418 -16.313
    9    HE2  LYS  67           HE2      LYS  67  -8.382 -18.700 -17.123
   10    HE3  LYS  67           HE3      LYS  67  -7.926 -18.333 -15.459
   11    HZ2  LYS  67           HZ1      LYS  67  -6.405 -19.888 -16.640
   12    HZ1  LYS  67           HZ2      LYS  67  -7.665 -21.026 -16.672
   13    HZ3  LYS  67           HZ3      LYS  67  -7.032 -20.496 -15.188

  No H/Q in entry =          13
  In of MODEL   62
    1    H    MET  68           H        MET  68 -13.102 -18.087 -12.737
    2    HA   MET  68           HA       MET  68 -13.350 -15.626 -11.642
    3    HB2  MET  68           HB2      MET  68 -11.701 -17.932 -10.607
    4    HB3  MET  68           HB3      MET  68 -12.197 -16.545  -9.638
    5    HG2  MET  68           HG2      MET  68 -14.094 -18.409 -11.094
    6    HG3  MET  68           HG3      MET  68 -13.745 -18.468  -9.366
    7    HE3  MET  68           HE1      MET  68 -15.062 -15.455  -7.800
    8    HE2  MET  68           HE2      MET  68 -13.642 -15.013  -8.744
    9    HE1  MET  68           HE3      MET  68 -13.709 -16.586  -7.951

  No H/Q in entry =           9
  In of MODEL   62
    1    H    LYS  69           H        LYS  69 -10.632 -16.485 -13.494
    2    HA   LYS  69           HA       LYS  69  -8.601 -15.107 -12.096
    3    HB2  LYS  69           HB2      LYS  69  -8.134 -16.825 -13.772
    4    HB3  LYS  69           HB3      LYS  69  -8.757 -15.767 -15.040
    5    HG2  LYS  69           HG2      LYS  69  -6.325 -15.581 -14.974
    6    HG3  LYS  69           HG3      LYS  69  -7.034 -14.068 -14.413
    7    HD2  LYS  69           HD2      LYS  69  -6.497 -14.502 -12.166
    8    HD3  LYS  69           HD3      LYS  69  -6.298 -16.231 -12.452
    9    HE2  LYS  69           HE2      LYS  69  -4.285 -15.786 -13.803
   10    HE3  LYS  69           HE3      LYS  69  -4.484 -14.055 -13.536
   11    HZ3  LYS  69           HZ1      LYS  69  -3.933 -14.240 -11.324
   12    HZ2  LYS  69           HZ2      LYS  69  -2.909 -15.401 -12.023
   13    HZ1  LYS  69           HZ3      LYS  69  -4.335 -15.886 -11.236

  No H/Q in entry =          13
  In of MODEL   62
    1    H    VAL  70           H        VAL  70  -7.668 -13.104 -12.224
    2    HA   VAL  70           HA       VAL  70  -9.129 -11.036 -13.773
    3    HB   VAL  70           HB       VAL  70  -8.456  -9.475 -11.969
    4   HG11  VAL  70          HG11      VAL  70 -10.615 -10.920 -11.992
    5   HG13  VAL  70          HG12      VAL  70 -10.171 -10.127 -10.480
    6   HG12  VAL  70          HG13      VAL  70  -9.833 -11.842 -10.708
    7   HG22  VAL  70          HG21      VAL  70  -6.487 -10.403 -11.027
    8   HG21  VAL  70          HG22      VAL  70  -7.220 -11.997 -10.865
    9   HG23  VAL  70          HG23      VAL  70  -7.700 -10.693  -9.781

  No H/Q in entry =           9
  In of MODEL   62
    1    H    SER  71           H        SER  71  -7.779  -9.133 -14.302
    2    HA   SER  71           HA       SER  71  -5.444  -9.832 -15.737
    3    HB2  SER  71           HB2      SER  71  -6.955  -7.826 -16.153
    4    HB3  SER  71           HB3      SER  71  -6.172  -7.061 -14.772
    5    HG   SER  71           HG       SER  71  -4.837  -8.114 -17.049

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LEU  72           H        LEU  72  -3.516 -10.306 -14.978
    2    HA   LEU  72           HA       LEU  72  -2.784 -10.127 -12.267
    3    HB2  LEU  72           HB2      LEU  72  -1.151 -10.585 -14.758
    4    HB3  LEU  72           HB3      LEU  72  -0.482 -10.680 -13.132
    5    HG   LEU  72           HG       LEU  72  -2.886 -12.308 -14.016
    6   HD13  LEU  72          HD11      LEU  72  -1.343 -14.182 -14.320
    7   HD12  LEU  72          HD12      LEU  72   0.023 -13.155 -13.885
    8   HD11  LEU  72          HD13      LEU  72  -0.868 -12.850 -15.376
    9   HD22  LEU  72          HD21      LEU  72  -2.848 -12.336 -11.667
   10   HD21  LEU  72          HD22      LEU  72  -1.094 -12.259 -11.584
   11   HD23  LEU  72          HD23      LEU  72  -1.888 -13.757 -12.065

  No H/Q in entry =          11
  In of MODEL   62
    1    H    VAL  73           H        VAL  73  -2.023  -8.113 -15.037
    2    HA   VAL  73           HA       VAL  73  -0.056  -6.472 -13.929
    3    HB   VAL  73           HB       VAL  73  -0.364  -5.078 -15.792
    4   HG11  VAL  73          HG11      VAL  73   0.111  -7.605 -16.194
    5   HG13  VAL  73          HG12      VAL  73  -0.329  -6.606 -17.579
    6   HG12  VAL  73          HG13      VAL  73  -1.533  -7.652 -16.829
    7   HG21  VAL  73          HG21      VAL  73  -3.211  -6.096 -15.751
    8   HG23  VAL  73          HG22      VAL  73  -2.534  -5.241 -17.135
    9   HG22  VAL  73          HG23      VAL  73  -2.653  -4.432 -15.572

  No H/Q in entry =           9
  In of MODEL   62
    1    H    LEU  74           H        LEU  74  -3.453  -6.502 -13.363
    2    HA   LEU  74           HA       LEU  74  -4.001  -3.835 -12.733
    3    HB2  LEU  74           HB2      LEU  74  -5.773  -5.454 -12.912
    4    HB3  LEU  74           HB3      LEU  74  -5.103  -6.403 -11.588
    5    HG   LEU  74           HG       LEU  74  -5.516  -4.528 -10.032
    6   HD12  LEU  74          HD11      LEU  74  -7.078  -2.703 -11.009
    7   HD11  LEU  74          HD12      LEU  74  -6.458  -3.211 -12.579
    8   HD13  LEU  74          HD13      LEU  74  -5.355  -2.575 -11.358
    9   HD23  LEU  74          HD21      LEU  74  -8.087  -4.853 -11.487
   10   HD22  LEU  74          HD22      LEU  74  -7.709  -5.050  -9.789
   11   HD21  LEU  74          HD23      LEU  74  -7.275  -6.310 -10.919

  No H/Q in entry =          11
  In of MODEL   62
    1    H    VAL  75           H        VAL  75  -3.023  -6.461 -10.589
    2    HA   VAL  75           HA       VAL  75  -2.778  -4.930  -8.237
    3    HB   VAL  75           HB       VAL  75  -1.360  -7.462  -9.050
    4   HG11  VAL  75          HG11      VAL  75  -1.488  -6.000  -6.374
    5   HG13  VAL  75          HG12      VAL  75  -0.047  -6.291  -7.338
    6   HG12  VAL  75          HG13      VAL  75  -0.884  -7.640  -6.588
    7   HG21  VAL  75          HG21      VAL  75  -3.877  -7.465  -8.801
    8   HG23  VAL  75          HG22      VAL  75  -3.657  -6.948  -7.129
    9   HG22  VAL  75          HG23      VAL  75  -3.047  -8.517  -7.655

  No H/Q in entry =           9
  In of MODEL   62
    1    H    GLU  76           H        GLU  76  -0.396  -5.737 -10.784
    2    HA   GLU  76           HA       GLU  76   1.827  -4.455  -9.623
    3    HB2  GLU  76           HB2      GLU  76   1.933  -5.934 -11.638
    4    HB3  GLU  76           HB3      GLU  76   1.129  -4.684 -12.574
    5    HG2  GLU  76           HG2      GLU  76   3.011  -3.143 -12.163
    6    HG3  GLU  76           HG3      GLU  76   3.835  -4.364 -11.213

  No H/Q in entry =           6
  In of MODEL   62
    1    H    ALA  77           H        ALA  77  -0.678  -3.174 -11.798
    2    HA   ALA  77           HA       ALA  77   0.381  -0.554 -11.961
    3    HB1  ALA  77           HB1      ALA  77  -1.358  -1.486 -13.491
    4    HB2  ALA  77           HB2      ALA  77  -1.804   0.082 -12.815
    5    HB3  ALA  77           HB3      ALA  77  -2.524  -1.392 -12.169

  No H/Q in entry =           5
  In of MODEL   62
    1    H    GLN  78           H        GLN  78  -1.922  -2.063  -9.754
    2    HA   GLN  78           HA       GLN  78  -2.665   0.267  -8.337
    3    HB2  GLN  78           HB2      GLN  78  -3.786  -2.021  -8.287
    4    HB3  GLN  78           HB3      GLN  78  -2.499  -2.531  -7.197
    5    HG2  GLN  78           HG2      GLN  78  -3.118  -0.839  -5.584
    6    HG3  GLN  78           HG3      GLN  78  -4.300  -0.150  -6.695
    7   HE21  GLN  78          HE21      GLN  78  -3.577  -3.494  -5.502
    8   HE22  GLN  78          HE22      GLN  78  -5.194  -3.854  -5.133

  No H/Q in entry =           8
  In of MODEL   62
    1    H    LEU  79           H        LEU  79  -0.045  -2.060  -7.906
    2    HA   LEU  79           HA       LEU  79   0.959  -1.203  -5.446
    3    HB2  LEU  79           HB2      LEU  79   1.775  -3.227  -6.528
    4    HB3  LEU  79           HB3      LEU  79   2.442  -2.284  -7.857
    5    HG   LEU  79           HG       LEU  79   4.030  -1.194  -6.350
    6   HD13  LEU  79          HD11      LEU  79   3.037  -0.936  -4.279
    7   HD12  LEU  79          HD12      LEU  79   4.081  -2.315  -3.946
    8   HD11  LEU  79          HD13      LEU  79   2.368  -2.569  -4.274
    9   HD23  LEU  79          HD21      LEU  79   5.188  -3.377  -5.463
   10   HD22  LEU  79          HD22      LEU  79   4.986  -3.163  -7.199
   11   HD21  LEU  79          HD23      LEU  79   3.883  -4.210  -6.311

  No H/Q in entry =          11
  In of MODEL   62
    1    H    HIS  80           H        HIS  80   1.850  -0.089  -8.714
    2    HA   HIS  80           HA       HIS  80   3.709   1.847  -7.784
    3    HB2  HIS  80           HB2      HIS  80   2.397   1.201 -10.368
    4    HB3  HIS  80           HB3      HIS  80   3.033   2.837 -10.188
    5    HD1  HIS  80           HD1      HIS  80   5.441   3.080 -10.714
    6    HD2  HIS  80           HD2      HIS  80   4.527  -0.816  -9.545
    7    HE1  HIS  80           HE1      HIS  80   7.598   1.751 -10.893
    8    HE2  HIS  80           HE2      HIS  80   7.052  -0.628 -10.183

  No H/Q in entry =           8
  In of MODEL   62
    1    H    LEU  81           H        LEU  81   0.308   2.097  -8.755
    2    HA   LEU  81           HA       LEU  81   0.102   4.894  -8.407
    3    HB2  LEU  81           HB2      LEU  81  -1.967   2.698  -8.337
    4    HB3  LEU  81           HB3      LEU  81  -2.377   4.411  -8.233
    5    HG   LEU  81           HG       LEU  81  -0.717   3.234 -10.480
    6   HD12  LEU  81          HD11      LEU  81  -2.943   3.616 -11.772
    7   HD11  LEU  81          HD12      LEU  81  -3.697   3.556 -10.180
    8   HD13  LEU  81          HD13      LEU  81  -2.789   2.169 -10.777
    9   HD23  LEU  81          HD21      LEU  81  -1.764   5.411 -11.562
   10   HD22  LEU  81          HD22      LEU  81  -0.341   5.541 -10.531
   11   HD21  LEU  81          HD23      LEU  81  -1.936   5.924  -9.885

  No H/Q in entry =          11
  In of MODEL   62
    1    H    MET  82           H        MET  82  -0.617   2.210  -6.173
    2    HA   MET  82           HA       MET  82  -1.627   3.808  -4.074
    3    HB2  MET  82           HB2      MET  82  -0.318   1.089  -4.133
    4    HB3  MET  82           HB3      MET  82  -0.876   1.818  -2.629
    5    HG2  MET  82           HG2      MET  82  -2.625   1.382  -5.070
    6    HG3  MET  82           HG3      MET  82  -2.570   0.297  -3.681
    7    HE3  MET  82           HE1      MET  82  -4.247   1.970  -0.852
    8    HE2  MET  82           HE2      MET  82  -2.511   2.208  -1.039
    9    HE1  MET  82           HE3      MET  82  -3.237   0.670  -1.501

  No H/Q in entry =           9
  In of MODEL   62
    1    H    THR  83           H        THR  83   1.646   2.648  -4.777
    2    HA   THR  83           HA       THR  83   2.894   3.708  -2.472
    3    HB   THR  83           HB       THR  83   4.984   3.612  -3.951
    4    HG1  THR  83           HG1      THR  83   4.728   3.104  -5.977
    5   HG22  THR  83          HG21      THR  83   4.476   0.967  -4.298
    6   HG21  THR  83          HG22      THR  83   3.198   1.370  -3.153
    7   HG23  THR  83          HG23      THR  83   4.886   1.671  -2.735

  No H/Q in entry =           7
  In of MODEL   62
    1    H    SER  84           H        SER  84   2.547   5.017  -5.764
    2    HA   SER  84           HA       SER  84   3.945   7.422  -5.296
    3    HB2  SER  84           HB2      SER  84   1.852   6.651  -7.316
    4    HB3  SER  84           HB3      SER  84   2.569   8.262  -7.282
    5    HG   SER  84           HG       SER  84   3.882   5.757  -7.592

  No H/Q in entry =           5
  In of MODEL   62
    1    H    MET  85           H        MET  85   0.435   6.747  -5.122
    2    HA   MET  85           HA       MET  85  -0.363   9.374  -4.502
    3    HB2  MET  85           HB2      MET  85  -1.928   7.604  -5.179
    4    HB3  MET  85           HB3      MET  85  -1.658   6.785  -3.642
    5    HG2  MET  85           HG2      MET  85  -2.502   8.755  -2.428
    6    HG3  MET  85           HG3      MET  85  -2.744   9.597  -3.957
    7    HE2  MET  85           HE1      MET  85  -4.658   7.273  -1.343
    8    HE1  MET  85           HE2      MET  85  -3.259   6.462  -2.044
    9    HE3  MET  85           HE3      MET  85  -4.881   5.879  -2.406

  No H/Q in entry =           9
  In of MODEL   62
    1    H    LEU  86           H        LEU  86   0.497   6.676  -2.377
    2    HA   LEU  86           HA       LEU  86   0.000   7.976   0.074
    3    HB2  LEU  86           HB2      LEU  86   0.403   5.497  -0.337
    4    HB3  LEU  86           HB3      LEU  86   2.120   5.886  -0.433
    5    HG   LEU  86           HG       LEU  86   1.828   7.040   1.844
    6   HD11  LEU  86          HD11      LEU  86  -0.885   6.343   1.373
    7   HD13  LEU  86          HD12      LEU  86  -0.198   7.064   2.827
    8   HD12  LEU  86          HD13      LEU  86  -0.332   5.312   2.697
    9   HD23  LEU  86          HD21      LEU  86   1.326   4.058   1.947
   10   HD22  LEU  86          HD22      LEU  86   2.355   5.036   2.992
   11   HD21  LEU  86          HD23      LEU  86   2.844   4.709   1.330

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ALA  87           H        ALA  87   2.969   7.620  -1.824
    2    HA   ALA  87           HA       ALA  87   4.713   8.976  -0.094
    3    HB3  ALA  87           HB1      ALA  87   4.777   7.979  -2.807
    4    HB2  ALA  87           HB2      ALA  87   6.121   8.269  -1.707
    5    HB1  ALA  87           HB3      ALA  87   5.537   9.571  -2.742

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ARG  88           H        ARG  88   2.789  10.179  -2.802
    2    HA   ARG  88           HA       ARG  88   3.632  12.847  -2.669
    3    HB2  ARG  88           HB2      ARG  88   2.345  11.739  -4.531
    4    HB3  ARG  88           HB3      ARG  88   0.894  11.913  -3.544
    5    HG2  ARG  88           HG2      ARG  88   1.979  14.466  -3.446
    6    HG3  ARG  88           HG3      ARG  88   2.387  13.952  -5.081
    7    HD2  ARG  88           HD2      ARG  88   0.247  14.091  -5.773
    8    HD3  ARG  88           HD3      ARG  88  -0.359  13.244  -4.349
    9    HE   ARG  88           HE       ARG  88  -0.478  16.029  -4.748
   10   HH21  ARG  88          HH11      ARG  88  -0.967  17.360  -3.000
   11   HH22  ARG  88          HH12      ARG  88  -0.681  16.804  -1.387
   12   HH11  ARG  88          HH21      ARG  88   0.484  13.725  -2.391
   13   HH12  ARG  88          HH22      ARG  88   0.123  14.741  -1.042

  No H/Q in entry =          13
  In of MODEL   62
    1    H    GLU  89           H        GLU  89   0.890  11.232  -1.034
    2    HA   GLU  89           HA       GLU  89  -0.155  13.564   0.189
    3    HB2  GLU  89           HB2      GLU  89  -1.331  11.355   0.090
    4    HB3  GLU  89           HB3      GLU  89  -0.219  10.763   1.324
    5    HG2  GLU  89           HG2      GLU  89  -0.991  12.472   2.897
    6    HG3  GLU  89           HG3      GLU  89  -2.028  13.178   1.661

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LEU  90           H        LEU  90   2.238  11.200   1.342
    2    HA   LEU  90           HA       LEU  90   2.633  12.418   3.879
    3    HB2  LEU  90           HB2      LEU  90   4.354  10.608   2.185
    4    HB3  LEU  90           HB3      LEU  90   4.791  11.102   3.826
    5    HG   LEU  90           HG       LEU  90   2.120   9.832   3.163
    6   HD12  LEU  90          HD11      LEU  90   3.207   7.750   4.154
    7   HD11  LEU  90          HD12      LEU  90   4.751   8.566   3.914
    8   HD13  LEU  90          HD13      LEU  90   3.725   8.196   2.527
    9   HD22  LEU  90          HD21      LEU  90   1.885  10.748   5.291
   10   HD21  LEU  90          HD22      LEU  90   3.600  10.592   5.668
   11   HD23  LEU  90          HD23      LEU  90   2.555   9.172   5.709

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  91           H        ILE  91   4.239  12.778   0.750
    2    HA   ILE  91           HA       ILE  91   6.266  14.550   1.597
    3    HB   ILE  91           HB       ILE  91   4.935  14.113  -1.083
    4   HG12  ILE  91          HG12      ILE  91   7.756  13.543  -0.119
    5   HG13  ILE  91          HG13      ILE  91   6.443  12.379   0.039
    6   HG22  ILE  91          HG21      ILE  91   7.192  15.404  -1.768
    7   HG21  ILE  91          HG22      ILE  91   6.908  16.202  -0.220
    8   HG23  ILE  91          HG23      ILE  91   5.683  16.273  -1.486
    9   HD13  ILE  91          HD11      ILE  91   6.255  12.077  -2.270
   10   HD12  ILE  91          HD12      ILE  91   7.996  12.271  -2.059
   11   HD11  ILE  91          HD13      ILE  91   7.021  13.625  -2.634

  No H/Q in entry =          11
  In of MODEL   62
    1    H    THR  92           H        THR  92   2.915  15.081   0.601
    2    HA   THR  92           HA       THR  92   2.966  17.904   0.560
    3    HB   THR  92           HB       THR  92   0.746  15.964   1.251
    4    HG1  THR  92           HG1      THR  92   1.041  15.792  -0.836
    5   HG22  THR  92          HG21      THR  92  -0.597  18.169   0.547
    6   HG21  THR  92          HG22      THR  92   0.819  18.951   1.246
    7   HG23  THR  92          HG23      THR  92  -0.150  17.849   2.223

  No H/Q in entry =           7
  In of MODEL   62
    1    H    GLU  93           H        GLU  93   2.361  15.601   3.199
    2    HA   GLU  93           HA       GLU  93   1.886  17.505   5.232
    3    HB2  GLU  93           HB2      GLU  93   3.124  14.744   5.446
    4    HB3  GLU  93           HB3      GLU  93   2.462  15.680   6.787
    5    HG2  GLU  93           HG2      GLU  93   0.824  14.964   4.347
    6    HG3  GLU  93           HG3      GLU  93   0.900  13.929   5.768

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LEU  94           H        LEU  94   4.848  15.949   4.065
    2    HA   LEU  94           HA       LEU  94   6.634  17.034   5.956
    3    HB2  LEU  94           HB2      LEU  94   7.002  16.076   3.117
    4    HB3  LEU  94           HB3      LEU  94   8.352  16.690   4.068
    5    HG   LEU  94           HG       LEU  94   6.555  14.536   5.192
    6   HD11  LEU  94          HD11      LEU  94   8.638  14.267   3.054
    7   HD13  LEU  94          HD12      LEU  94   7.166  13.331   3.313
    8   HD12  LEU  94          HD13      LEU  94   8.587  13.032   4.314
    9   HD23  LEU  94          HD21      LEU  94   8.731  13.931   6.336
   10   HD22  LEU  94          HD22      LEU  94   8.109  15.524   6.764
   11   HD21  LEU  94          HD23      LEU  94   9.441  15.374   5.618

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  95           H        ILE  95   5.520  18.259   2.817
    2    HA   ILE  95           HA       ILE  95   7.156  20.572   2.770
    3    HB   ILE  95           HB       ILE  95   4.491  19.971   1.466
    4   HG12  ILE  95          HG12      ILE  95   7.286  20.239   0.325
    5   HG13  ILE  95          HG13      ILE  95   6.595  18.701   0.830
    6   HG21  ILE  95          HG21      ILE  95   6.308  22.390   1.259
    7   HG23  ILE  95          HG22      ILE  95   4.582  22.368   1.619
    8   HG22  ILE  95          HG23      ILE  95   5.150  21.962  -0.002
    9   HD13  ILE  95          HD11      ILE  95   5.030  18.680  -0.895
   10   HD12  ILE  95          HD12      ILE  95   6.399  19.466  -1.681
   11   HD11  ILE  95          HD13      ILE  95   5.054  20.434  -1.079

  No H/Q in entry =          11
  In of MODEL   62
    1    H    GLU  96           H        GLU  96   3.894  20.002   4.069
    2    HA   GLU  96           HA       GLU  96   3.349  22.659   4.840
    3    HB2  GLU  96           HB2      GLU  96   1.626  20.923   4.843
    4    HB3  GLU  96           HB3      GLU  96   2.467  20.063   6.131
    5    HG2  GLU  96           HG2      GLU  96   1.486  21.364   7.712
    6    HG3  GLU  96           HG3      GLU  96   2.061  22.828   6.923

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LEU  97           H        LEU  97   5.124  20.047   6.443
    2    HA   LEU  97           HA       LEU  97   5.524  21.368   8.922
    3    HB2  LEU  97           HB2      LEU  97   6.997  19.167   7.489
    4    HB3  LEU  97           HB3      LEU  97   7.610  19.825   9.004
    5    HG   LEU  97           HG       LEU  97   4.770  18.812   8.693
    6   HD12  LEU  97          HD11      LEU  97   5.656  16.766   9.889
    7   HD11  LEU  97          HD12      LEU  97   7.283  17.354   9.546
    8   HD13  LEU  97          HD13      LEU  97   6.198  16.935   8.219
    9   HD23  LEU  97          HD21      LEU  97   5.220  18.488  11.254
   10   HD22  LEU  97          HD22      LEU  97   4.884  20.113  10.661
   11   HD21  LEU  97          HD23      LEU  97   6.543  19.625  10.999

  No H/Q in entry =          11
  In of MODEL   62
    1    H    HIS  98           H        HIS  98   7.388  21.353   5.892
    2    HA   HIS  98           HA       HIS  98   9.587  22.865   6.796
    3    HB2  HIS  98           HB2      HIS  98   8.281  22.665   4.072
    4    HB3  HIS  98           HB3      HIS  98   9.749  23.601   4.365
    5    HD1  HIS  98           HD1      HIS  98   8.437  20.065   4.364
    6    HD2  HIS  98           HD2      HIS  98  12.077  22.057   4.794
    7    HE1  HIS  98           HE1      HIS  98  10.242  18.285   4.290
    8    HE2  HIS  98           HE2      HIS  98  12.462  19.477   4.552

  No H/Q in entry =           8
  In of MODEL   62
    1    H    GLU  99           H        GLU  99   6.388  23.799   5.635
    2    HA   GLU  99           HA       GLU  99   6.847  26.602   5.595
    3    HB2  GLU  99           HB2      GLU  99   4.933  25.494   4.461
    4    HB3  GLU  99           HB3      GLU  99   4.231  25.142   6.039
    5    HG2  GLU  99           HG2      GLU  99   4.120  27.534   6.557
    6    HG3  GLU  99           HG3      GLU  99   4.903  27.923   5.029

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LYS 100           H        LYS 100   5.659  24.382   8.104
    2    HA   LYS 100           HA       LYS 100   5.136  26.439  10.014
    3    HB2  LYS 100           HB2      LYS 100   5.627  23.470  10.338
    4    HB3  LYS 100           HB3      LYS 100   5.214  24.546  11.678
    5    HG2  LYS 100           HG2      LYS 100   3.164  25.251  10.440
    6    HG3  LYS 100           HG3      LYS 100   3.555  24.079   9.178
    7    HD2  LYS 100           HD2      LYS 100   3.429  22.249  10.827
    8    HD3  LYS 100           HD3      LYS 100   3.055  23.415  12.100
    9    HE2  LYS 100           HE2      LYS 100   1.018  24.103  10.846
   10    HE3  LYS 100           HE3      LYS 100   1.380  22.881   9.621
   11    HZ1  LYS 100           HZ1      LYS 100   1.102  22.202  12.498
   12    HZ3  LYS 100           HZ2      LYS 100   1.053  21.158  11.156
   13    HZ2  LYS 100           HZ3      LYS 100  -0.231  22.233  11.446

  No H/Q in entry =          13
  In of MODEL   62
    1    H    LEU 101           H        LEU 101   8.005  24.566   9.160
    2    HA   LEU 101           HA       LEU 101   9.632  25.344  11.366
    3    HB2  LEU 101           HB2      LEU 101  10.191  24.360   8.579
    4    HB3  LEU 101           HB3      LEU 101  11.514  24.981   9.562
    5    HG   LEU 101           HG       LEU 101   9.623  22.871  10.615
    6   HD12  LEU 101          HD11      LEU 101  11.632  21.322   9.992
    7   HD11  LEU 101          HD12      LEU 101  12.032  22.582   8.827
    8   HD13  LEU 101          HD13      LEU 101  10.479  21.754   8.731
    9   HD21  LEU 101          HD21      LEU 101  12.380  23.895  11.344
   10   HD23  LEU 101          HD22      LEU 101  11.793  22.335  11.914
   11   HD22  LEU 101          HD23      LEU 101  10.944  23.813  12.365

  No H/Q in entry =          11
  In of MODEL   62
    1    H    LYS 102           H        LYS 102   8.098  27.268   9.242
    2    HA   LYS 102           HA       LYS 102   8.241  29.559   8.966
    3    HB2  LYS 102           HB2      LYS 102   9.806  29.384  11.059
    4    HB3  LYS 102           HB3      LYS 102  11.109  29.549   9.898
    5    HG2  LYS 102           HG2      LYS 102   9.062  31.556  10.779
    6    HG3  LYS 102           HG3      LYS 102  10.781  31.768  10.525
    7    HD2  LYS 102           HD2      LYS 102   8.813  31.418   8.227
    8    HD3  LYS 102           HD3      LYS 102   9.244  32.981   8.905
    9    HE2  LYS 102           HE2      LYS 102  10.577  31.772   6.820
   10    HE3  LYS 102           HE3      LYS 102  11.233  33.053   7.839
   11    HZ2  LYS 102           HZ1      LYS 102  12.697  31.106   7.647
   12    HZ1  LYS 102           HZ2      LYS 102  11.509  30.153   8.385
   13    HZ3  LYS 102           HZ3      LYS 102  12.240  31.413   9.251

  No H/Q in entry =          13
  In of MODEL   62
    1    H    ALA 103           H        ALA 103  11.456  28.130   8.384
    2    HA   ALA 103           HA       ALA 103  12.455  29.493   6.315
    3    HB2  ALA 103           HB1      ALA 103  13.274  27.260   5.370
    4    HB1  ALA 103           HB2      ALA 103  12.359  26.503   6.673
    5    HB3  ALA 103           HB3      ALA 103  13.682  27.607   7.050

  No H/Q in entry =           5
  In of MODEL   62
    1    H1   LYS   3           H1       LYS   3 -32.018   4.623 -20.166
    2    H2   LYS   3           H3       LYS   3 -31.015   4.360 -21.511
    3    H3   LYS   3           H2       LYS   3 -32.338   3.336 -21.225
    4    HA   LYS   3           HA       LYS   3 -31.236   2.071 -19.780
    5    HB2  LYS   3           HB2      LYS   3 -29.065   3.596 -21.171
    6    HB3  LYS   3           HB3      LYS   3 -28.650   2.457 -19.889
    7    HG2  LYS   3           HG2      LYS   3 -29.959   0.729 -21.178
    8    HG3  LYS   3           HG3      LYS   3 -30.003   1.884 -22.508
    9    HD2  LYS   3           HD2      LYS   3 -27.519   1.950 -22.467
   10    HD3  LYS   3           HD3      LYS   3 -27.541   0.688 -21.236
   11    HE2  LYS   3           HE2      LYS   3 -28.956  -0.650 -22.904
   12    HE3  LYS   3           HE3      LYS   3 -28.425   0.529 -24.102
   13    HZ3  LYS   3           HZ1      LYS   3 -26.544  -0.576 -24.339
   14    HZ2  LYS   3           HZ2      LYS   3 -27.085  -1.749 -23.238
   15    HZ1  LYS   3           HZ3      LYS   3 -26.186  -0.418 -22.687

  No H/Q in entry =          15
  In of MODEL   62
    1    H    LYS   4           H        LYS   4 -31.272   1.995 -17.715
    2    HA   LYS   4           HA       LYS   4 -30.703   4.382 -16.146
    3    HB2  LYS   4           HB2      LYS   4 -31.708   1.637 -15.350
    4    HB3  LYS   4           HB3      LYS   4 -31.579   3.025 -14.271
    5    HG2  LYS   4           HG2      LYS   4 -33.385   2.753 -16.679
    6    HG3  LYS   4           HG3      LYS   4 -33.873   2.826 -14.988
    7    HD2  LYS   4           HD2      LYS   4 -33.335   5.100 -14.799
    8    HD3  LYS   4           HD3      LYS   4 -32.298   5.067 -16.225
    9    HE2  LYS   4           HE2      LYS   4 -34.317   6.284 -16.724
   10    HE3  LYS   4           HE3      LYS   4 -34.295   4.778 -17.641
   11    HZ3  LYS   4           HZ1      LYS   4 -35.798   3.810 -16.057
   12    HZ2  LYS   4           HZ2      LYS   4 -36.459   5.242 -16.689
   13    HZ1  LYS   4           HZ3      LYS   4 -35.793   5.231 -15.127

  No H/Q in entry =          13
  In of MODEL   62
    1    H    HIS   5           H        HIS   5 -29.239   4.624 -14.566
    2    HA   HIS   5           HA       HIS   5 -26.835   2.948 -14.847
    3    HB2  HIS   5           HB2      HIS   5 -27.278   5.718 -13.733
    4    HB3  HIS   5           HB3      HIS   5 -25.734   4.870 -13.691
    5    HD1  HIS   5           HD1      HIS   5 -24.355   6.114 -15.328
    6    HD2  HIS   5           HD2      HIS   5 -28.108   5.179 -16.840
    7    HE1  HIS   5           HE1      HIS   5 -24.234   6.622 -17.797
    8    HE2  HIS   5           HE2      HIS   5 -26.522   6.040 -18.687

  No H/Q in entry =           8
  In of MODEL   62
    1    H    ILE   6           H        ILE   6 -26.494   1.441 -13.479
    2    HA   ILE   6           HA       ILE   6 -27.478   1.735 -10.721
    3    HB   ILE   6           HB       ILE   6 -26.490  -0.720 -12.178
    4   HG12  ILE   6          HG12      ILE   6 -29.289   0.054 -11.345
    5   HG13  ILE   6          HG13      ILE   6 -28.663   0.204 -12.988
    6   HG23  ILE   6          HG21      ILE   6 -26.770  -1.931 -10.275
    7   HG22  ILE   6          HG22      ILE   6 -28.002  -0.844  -9.628
    8   HG21  ILE   6          HG23      ILE   6 -26.301  -0.388  -9.559
    9   HD13  ILE   6          HD11      ILE   6 -28.977  -1.957 -13.414
   10   HD12  ILE   6          HD12      ILE   6 -29.988  -1.962 -11.968
   11   HD11  ILE   6          HD13      ILE   6 -28.296  -2.450 -11.863

  No H/Q in entry =          11
  In of MODEL   62
    1    H    TYR   7           H        TYR   7 -25.765   2.538  -9.465
    2    HA   TYR   7           HA       TYR   7 -22.996   1.746 -10.125
    3    HB2  TYR   7           HB2      TYR   7 -24.120   4.158  -8.723
    4    HB3  TYR   7           HB3      TYR   7 -22.405   3.758  -8.752
    5    HD1  TYR   7           HD1      TYR   7 -23.385   2.642 -11.803
    6    HD2  TYR   7           HD2      TYR   7 -22.955   6.326  -9.702
    7    HE1  TYR   7           HE1      TYR   7 -23.044   3.826 -13.937
    8    HE2  TYR   7           HE2      TYR   7 -22.656   7.513 -11.828
    9    HH   TYR   7           HH       TYR   7 -22.874   7.336 -14.055

  No H/Q in entry =           9
  In of MODEL   62
    1    H    LEU   8           H        LEU   8 -21.937   0.509  -8.756
    2    HA   LEU   8           HA       LEU   8 -23.023   0.030  -6.052
    3    HB2  LEU   8           HB2      LEU   8 -21.216  -1.574  -7.837
    4    HB3  LEU   8           HB3      LEU   8 -21.370  -1.909  -6.112
    5    HG   LEU   8           HG       LEU   8 -23.834  -2.264  -6.517
    6   HD13  LEU   8          HD11      LEU   8 -24.053  -1.133  -8.665
    7   HD12  LEU   8          HD12      LEU   8 -24.468  -2.837  -8.847
    8   HD11  LEU   8          HD13      LEU   8 -22.900  -2.248  -9.397
    9   HD23  LEU   8          HD21      LEU   8 -22.428  -4.271  -8.147
   10   HD22  LEU   8          HD22      LEU   8 -23.497  -4.465  -6.758
   11   HD21  LEU   8          HD23      LEU   8 -21.818  -3.987  -6.517

  No H/Q in entry =          11
  In of MODEL   62
    1    H    PHE   9           H        PHE   9 -21.771   0.561  -4.282
    2    HA   PHE   9           HA       PHE   9 -19.053   1.658  -4.827
    3    HB2  PHE   9           HB2      PHE   9 -21.135   2.670  -2.895
    4    HB3  PHE   9           HB3      PHE   9 -19.456   3.192  -2.895
    5    HD1  PHE   9           HD1      PHE   9 -18.545   4.526  -4.719
    6    HD2  PHE   9           HD2      PHE   9 -22.661   3.315  -4.705
    7    HE1  PHE   9           HE1      PHE   9 -19.026   6.136  -6.538
    8    HE2  PHE   9           HE2      PHE   9 -23.144   4.938  -6.519
    9    HZ   PHE   9           HZ       PHE   9 -21.323   6.344  -7.442

  No H/Q in entry =           9
  In of MODEL   62
    1    H    SER  10           H        SER  10 -17.395   0.898  -3.642
    2    HA   SER  10           HA       SER  10 -17.578   0.036  -0.941
    3    HB2  SER  10           HB2      SER  10 -17.370  -2.298  -1.136
    4    HB3  SER  10           HB3      SER  10 -18.631  -1.890  -2.288
    5    HG   SER  10           HG       SER  10 -15.882  -2.117  -2.927

  No H/Q in entry =           5
  In of MODEL   62
    1    H    SER  11           H        SER  11 -15.563   0.272  -0.069
    2    HA   SER  11           HA       SER  11 -13.440   1.265  -1.616
    3    HB2  SER  11           HB2      SER  11 -12.227   1.378   0.378
    4    HB3  SER  11           HB3      SER  11 -13.908   1.508   0.898
    5    HG   SER  11           HG       SER  11 -12.332  -0.862   0.828

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ALA  12           H        ALA  12 -14.412  -1.453  -2.435
    2    HA   ALA  12           HA       ALA  12 -11.773  -2.563  -2.931
    3    HB1  ALA  12           HB1      ALA  12 -13.752  -3.882  -1.143
    4    HB2  ALA  12           HB2      ALA  12 -11.991  -3.938  -1.113
    5    HB3  ALA  12           HB3      ALA  12 -12.881  -4.907  -2.286

  No H/Q in entry =           5
  In of MODEL   62
    1    H    GLY  13           H        GLY  13 -12.593  -1.671  -4.982
    2    HA3  GLY  13           HA2      GLY  13 -14.802  -2.485  -6.420
    3    HA2  GLY  13           HA3      GLY  13 -13.263  -2.033  -7.167

  No H/Q in entry =           3
  In of MODEL   62
    1    H    MET  14           H        MET  14 -11.723  -4.275  -6.102
    2    HA   MET  14           HA       MET  14 -12.154  -6.110  -8.172
    3    HB2  MET  14           HB2      MET  14 -10.012  -6.035  -6.983
    4    HB3  MET  14           HB3      MET  14 -10.764  -6.708  -5.537
    5    HG2  MET  14           HG2      MET  14 -11.217  -8.795  -6.670
    6    HG3  MET  14           HG3      MET  14 -10.742  -8.114  -8.228
    7    HE3  MET  14           HE1      MET  14  -7.138  -8.446  -8.525
    8    HE2  MET  14           HE2      MET  14  -8.295  -7.124  -8.677
    9    HE1  MET  14           HE3      MET  14  -8.735  -8.738  -9.230

  No H/Q in entry =           9
  In of MODEL   62
    1    H    SER  15           H        SER  15 -13.188  -6.461  -4.771
    2    HA   SER  15           HA       SER  15 -14.421  -9.008  -5.224
    3    HB2  SER  15           HB2      SER  15 -13.992  -8.531  -2.932
    4    HB3  SER  15           HB3      SER  15 -14.809  -6.974  -3.029
    5    HG   SER  15           HG       SER  15 -16.381  -9.100  -3.780

  No H/Q in entry =           5
  In of MODEL   62
    1    H    THR  16           H        THR  16 -15.698  -5.687  -5.198
    2    HA   THR  16           HA       THR  16 -18.439  -6.423  -5.752
    3    HB   THR  16           HB       THR  16 -17.073  -3.780  -6.365
    4    HG1  THR  16           HG1      THR  16 -17.205  -4.978  -4.048
    5   HG21  THR  16          HG21      THR  16 -19.520  -4.430  -7.067
    6   HG23  THR  16          HG22      THR  16 -19.218  -2.852  -6.319
    7   HG22  THR  16          HG23      THR  16 -19.868  -4.188  -5.359

  No H/Q in entry =           7
  In of MODEL   62
    1    H    SER  17           H        SER  17 -15.573  -5.784  -7.601
    2    HA   SER  17           HA       SER  17 -16.752  -5.210 -10.123
    3    HB2  SER  17           HB2      SER  17 -14.038  -6.316  -9.381
    4    HB3  SER  17           HB3      SER  17 -14.509  -5.979 -11.047
    5    HG   SER  17           HG       SER  17 -13.482  -4.303  -9.368

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LEU  18           H        LEU  18 -15.966  -8.256  -8.569
    2    HA   LEU  18           HA       LEU  18 -16.450  -9.873 -10.870
    3    HB2  LEU  18           HB2      LEU  18 -15.163 -10.721  -8.984
    4    HB3  LEU  18           HB3      LEU  18 -16.554 -10.519  -7.919
    5    HG   LEU  18           HG       LEU  18 -17.791 -12.167  -9.347
    6   HD13  LEU  18          HD11      LEU  18 -16.653 -12.110 -11.415
    7   HD12  LEU  18          HD12      LEU  18 -16.194 -13.660 -10.706
    8   HD11  LEU  18          HD13      LEU  18 -15.077 -12.298 -10.647
    9   HD21  LEU  18          HD21      LEU  18 -16.646 -12.707  -7.217
   10   HD23  LEU  18          HD22      LEU  18 -15.253 -13.239  -8.161
   11   HD22  LEU  18          HD23      LEU  18 -16.801 -14.066  -8.332

  No H/Q in entry =          11
  In of MODEL   62
    1    H    LEU  19           H        LEU  19 -18.493  -8.713  -8.195
    2    HA   LEU  19           HA       LEU  19 -20.870 -10.091  -8.976
    3    HB2  LEU  19           HB2      LEU  19 -20.653  -9.163  -6.755
    4    HB3  LEU  19           HB3      LEU  19 -20.489  -7.538  -7.420
    5    HG   LEU  19           HG       LEU  19 -22.858  -7.707  -8.213
    6   HD11  LEU  19          HD11      LEU  19 -23.027 -10.169  -8.200
    7   HD13  LEU  19          HD12      LEU  19 -24.282  -9.421  -7.211
    8   HD12  LEU  19          HD13      LEU  19 -22.876 -10.157  -6.442
    9   HD22  LEU  19          HD21      LEU  19 -22.311  -6.461  -6.245
   10   HD21  LEU  19          HD22      LEU  19 -22.265  -7.930  -5.270
   11   HD23  LEU  19          HD23      LEU  19 -23.795  -7.365  -5.941

  No H/Q in entry =          11
  In of MODEL   62
    1    H    VAL  20           H        VAL  20 -19.598  -6.861  -9.785
    2    HA   VAL  20           HA       VAL  20 -21.780  -6.023 -11.380
    3    HB   VAL  20           HB       VAL  20 -18.839  -5.230 -11.546
    4   HG13  VAL  20          HG11      VAL  20 -19.622  -4.661 -13.684
    5   HG12  VAL  20          HG12      VAL  20 -19.880  -3.182 -12.760
    6   HG11  VAL  20          HG13      VAL  20 -21.234  -4.262 -13.091
    7   HG21  VAL  20          HG21      VAL  20 -21.244  -4.110 -10.171
    8   HG23  VAL  20          HG22      VAL  20 -19.894  -3.068 -10.616
    9   HG22  VAL  20          HG23      VAL  20 -19.633  -4.431  -9.527

  No H/Q in entry =           9
  In of MODEL   62
    1    H    SER  21           H        SER  21 -18.888  -7.911 -12.347
    2    HA   SER  21           HA       SER  21 -19.683  -7.947 -15.097
    3    HB2  SER  21           HB2      SER  21 -18.112  -9.817 -15.371
    4    HB3  SER  21           HB3      SER  21 -17.372  -8.489 -14.480
    5    HG   SER  21           HG       SER  21 -17.040  -9.816 -12.936

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LYS  22           H        LYS  22 -20.589 -10.113 -12.449
    2    HA   LYS  22           HA       LYS  22 -22.016 -11.897 -14.208
    3    HB2  LYS  22           HB2      LYS  22 -22.349 -11.464 -11.237
    4    HB3  LYS  22           HB3      LYS  22 -23.035 -12.793 -12.171
    5    HG2  LYS  22           HG2      LYS  22 -20.081 -12.300 -11.837
    6    HG3  LYS  22           HG3      LYS  22 -21.025 -13.410 -10.846
    7    HD2  LYS  22           HD2      LYS  22 -21.608 -14.695 -12.863
    8    HD3  LYS  22           HD3      LYS  22 -20.627 -13.596 -13.834
    9    HE2  LYS  22           HE2      LYS  22 -18.624 -14.273 -12.589
   10    HE3  LYS  22           HE3      LYS  22 -19.598 -15.356 -11.595
   11    HZ3  LYS  22           HZ1      LYS  22 -19.797 -16.861 -13.259
   12    HZ2  LYS  22           HZ2      LYS  22 -18.272 -16.222 -13.652
   13    HZ1  LYS  22           HZ3      LYS  22 -19.652 -15.709 -14.499

  No H/Q in entry =          13
  In of MODEL   62
    1    H    MET  23           H        MET  23 -22.935  -8.968 -12.437
    2    HA   MET  23           HA       MET  23 -25.731  -9.256 -12.930
    3    HB2  MET  23           HB2      MET  23 -24.046  -6.808 -12.443
    4    HB3  MET  23           HB3      MET  23 -25.799  -6.766 -12.620
    5    HG2  MET  23           HG2      MET  23 -26.097  -8.024 -10.607
    6    HG3  MET  23           HG3      MET  23 -24.362  -8.314 -10.473
    7    HE2  MET  23           HE1      MET  23 -26.903  -4.788  -9.400
    8    HE1  MET  23           HE2      MET  23 -27.092  -5.821 -10.816
    9    HE3  MET  23           HE3      MET  23 -26.157  -4.330 -10.932

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ARG  24           H        ARG  24 -23.084  -7.705 -14.772
    2    HA   ARG  24           HA       ARG  24 -24.668  -6.578 -16.808
    3    HB2  ARG  24           HB2      ARG  24 -21.781  -7.514 -16.806
    4    HB3  ARG  24           HB3      ARG  24 -22.513  -6.720 -18.177
    5    HG2  ARG  24           HG2      ARG  24 -22.916  -4.671 -16.798
    6    HG3  ARG  24           HG3      ARG  24 -22.137  -5.492 -15.419
    7    HD2  ARG  24           HD2      ARG  24 -20.836  -5.060 -18.148
    8    HD3  ARG  24           HD3      ARG  24 -20.576  -4.035 -16.742
    9    HE   ARG  24           HE       ARG  24 -19.850  -6.355 -15.731
   10   HH21  ARG  24          HH11      ARG  24 -17.672  -6.130 -15.219
   11   HH22  ARG  24          HH12      ARG  24 -16.534  -5.755 -16.466
   12   HH11  ARG  24          HH21      ARG  24 -19.123  -5.098 -18.787
   13   HH12  ARG  24          HH22      ARG  24 -17.401  -5.156 -18.576

  No H/Q in entry =          13
  In of MODEL   62
    1    H    ALA  25           H        ALA  25 -23.325  -9.822 -16.424
    2    HA   ALA  25           HA       ALA  25 -23.899 -10.782 -19.030
    3    HB1  ALA  25           HB1      ALA  25 -23.068 -12.739 -18.269
    4    HB3  ALA  25           HB2      ALA  25 -24.123 -12.741 -16.855
    5    HB2  ALA  25           HB3      ALA  25 -22.626 -11.810 -16.836

  No H/Q in entry =           5
  In of MODEL   62
    1    H    GLN  26           H        GLN  26 -25.715 -10.841 -16.000
    2    HA   GLN  26           HA       GLN  26 -27.976 -12.230 -16.968
    3    HB2  GLN  26           HB2      GLN  26 -27.577 -10.374 -14.642
    4    HB3  GLN  26           HB3      GLN  26 -29.089 -11.210 -14.963
    5    HG2  GLN  26           HG2      GLN  26 -26.411 -12.476 -14.454
    6    HG3  GLN  26           HG3      GLN  26 -27.774 -12.427 -13.344
    7   HE21  GLN  26          HE21      GLN  26 -26.417 -14.547 -14.552
    8   HE22  GLN  26          HE22      GLN  26 -27.388 -15.687 -15.310

  No H/Q in entry =           8
  In of MODEL   62
    1    H    ALA  27           H        ALA  27 -27.268  -8.767 -16.692
    2    HA   ALA  27           HA       ALA  27 -29.826  -7.868 -17.503
    3    HB1  ALA  27           HB1      ALA  27 -28.106  -6.399 -16.438
    4    HB3  ALA  27           HB2      ALA  27 -28.748  -5.724 -17.937
    5    HB2  ALA  27           HB3      ALA  27 -27.158  -6.487 -17.924

  No H/Q in entry =           5
  In of MODEL   62
    1    H    GLU  28           H        GLU  28 -27.052  -8.970 -19.340
    2    HA   GLU  28           HA       GLU  28 -28.057  -8.078 -21.889
    3    HB2  GLU  28           HB2      GLU  28 -25.638  -8.581 -21.252
    4    HB3  GLU  28           HB3      GLU  28 -26.072 -10.283 -21.396
    5    HG2  GLU  28           HG2      GLU  28 -24.982  -9.498 -23.393
    6    HG3  GLU  28           HG3      GLU  28 -26.655  -9.944 -23.725

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LYS  29           H        LYS  29 -28.015 -11.132 -20.132
    2    HA   LYS  29           HA       LYS  29 -29.220 -12.750 -22.083
    3    HB2  LYS  29           HB2      LYS  29 -28.106 -13.596 -20.052
    4    HB3  LYS  29           HB3      LYS  29 -29.420 -12.943 -19.076
    5    HG2  LYS  29           HG2      LYS  29 -30.988 -14.456 -20.093
    6    HG3  LYS  29           HG3      LYS  29 -29.751 -15.047 -21.200
    7    HD2  LYS  29           HD2      LYS  29 -28.531 -16.079 -19.434
    8    HD3  LYS  29           HD3      LYS  29 -29.490 -15.259 -18.204
    9    HE2  LYS  29           HE2      LYS  29 -30.085 -17.663 -18.487
   10    HE3  LYS  29           HE3      LYS  29 -31.440 -16.566 -18.765
   11    HZ1  LYS  29           HZ1      LYS  29 -30.870 -16.741 -21.188
   12    HZ3  LYS  29           HZ2      LYS  29 -31.496 -18.150 -20.476
   13    HZ2  LYS  29           HZ3      LYS  29 -29.832 -18.021 -20.781

  No H/Q in entry =          13
  In of MODEL   62
    1    H    TYR  30           H        TYR  30 -30.745 -10.662 -19.643
    2    HA   TYR  30           HA       TYR  30 -33.375 -11.326 -20.861
    3    HB2  TYR  30           HB2      TYR  30 -32.796 -10.044 -18.181
    4    HB3  TYR  30           HB3      TYR  30 -34.394 -10.429 -18.820
    5    HD1  TYR  30           HD1      TYR  30 -35.150 -12.783 -18.956
    6    HD2  TYR  30           HD2      TYR  30 -31.369 -11.753 -17.289
    7    HE1  TYR  30           HE1      TYR  30 -34.906 -15.072 -18.085
    8    HE2  TYR  30           HE2      TYR  30 -31.126 -14.028 -16.423
    9    HH   TYR  30           HH       TYR  30 -32.607 -16.527 -17.434

  No H/Q in entry =           9
  In of MODEL   62
    1    H    GLU  31           H        GLU  31 -31.347  -9.223 -21.732
    2    HA   GLU  31           HA       GLU  31 -31.418  -7.093 -22.624
    3    HB2  GLU  31           HB2      GLU  31 -34.259  -8.016 -23.103
    4    HB3  GLU  31           HB3      GLU  31 -33.513  -6.619 -23.879
    5    HG2  GLU  31           HG2      GLU  31 -31.950  -7.993 -25.029
    6    HG3  GLU  31           HG3      GLU  31 -32.417  -9.412 -24.093

  No H/Q in entry =           6
  In of MODEL   62
    1    H    VAL  32           H        VAL  32 -31.619  -6.916 -19.896
    2    HA   VAL  32           HA       VAL  32 -33.618  -4.912 -19.298
    3    HB   VAL  32           HB       VAL  32 -31.162  -5.692 -17.695
    4   HG12  VAL  32          HG11      VAL  32 -32.748  -4.913 -15.822
    5   HG11  VAL  32          HG12      VAL  32 -33.641  -4.107 -17.111
    6   HG13  VAL  32          HG13      VAL  32 -31.959  -3.680 -16.806
    7   HG21  VAL  32          HG21      VAL  32 -32.813  -7.549 -18.321
    8   HG23  VAL  32          HG22      VAL  32 -33.904  -6.756 -17.185
    9   HG22  VAL  32          HG23      VAL  32 -32.342  -7.359 -16.632

  No H/Q in entry =           9
  In of MODEL   62
    1    HA   PRO  33           HA       PRO  33 -30.793  -1.842 -21.075
    2    HB2  PRO  33           HB2      PRO  33 -32.452   0.276 -21.018
    3    HB3  PRO  33           HB3      PRO  33 -32.832  -1.089 -22.067
    4    HG2  PRO  33           HG2      PRO  33 -33.830  -0.550 -19.269
    5    HG3  PRO  33           HG3      PRO  33 -34.780  -0.869 -20.721
    6    HD2  PRO  33           HD2      PRO  33 -34.182  -2.852 -18.991
    7    HD3  PRO  33           HD3      PRO  33 -34.230  -3.153 -20.728

  No H/Q in entry =           7
  In of MODEL   62
    1    H    VAL  34           H        VAL  34 -29.493  -2.237 -19.114
    2    HA   VAL  34           HA       VAL  34 -29.372   0.254 -17.546
    3    HB   VAL  34           HB       VAL  34 -28.691  -1.102 -15.564
    4   HG12  VAL  34          HG11      VAL  34 -31.037  -2.126 -15.221
    5   HG11  VAL  34          HG12      VAL  34 -31.407  -1.440 -16.802
    6   HG13  VAL  34          HG13      VAL  34 -30.920  -0.385 -15.475
    7   HG21  VAL  34          HG21      VAL  34 -28.740  -3.199 -17.507
    8   HG23  VAL  34          HG22      VAL  34 -29.768  -3.588 -16.127
    9   HG22  VAL  34          HG23      VAL  34 -28.072  -3.176 -15.874

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ILE  35           H        ILE  35 -27.430   0.849 -16.728
    2    HA   ILE  35           HA       ILE  35 -25.041  -0.359 -17.956
    3    HB   ILE  35           HB       ILE  35 -25.637   2.521 -17.236
    4   HG12  ILE  35          HG12      ILE  35 -24.571   1.204 -19.742
    5   HG13  ILE  35          HG13      ILE  35 -26.239   1.720 -19.495
    6   HG21  ILE  35          HG21      ILE  35 -22.976   1.158 -17.506
    7   HG23  ILE  35          HG22      ILE  35 -23.509   2.342 -16.312
    8   HG22  ILE  35          HG23      ILE  35 -23.166   2.849 -17.967
    9   HD11  ILE  35          HD11      ILE  35 -24.991   4.023 -18.969
   10   HD13  ILE  35          HD12      ILE  35 -25.502   3.552 -20.591
   11   HD12  ILE  35          HD13      ILE  35 -23.828   3.312 -20.089

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ILE  36           H        ILE  36 -23.741  -1.244 -16.330
    2    HA   ILE  36           HA       ILE  36 -24.217  -0.570 -13.478
    3    HB   ILE  36           HB       ILE  36 -23.209  -3.243 -14.504
    4   HG12  ILE  36          HG12      ILE  36 -26.063  -2.608 -13.755
    5   HG13  ILE  36          HG13      ILE  36 -25.497  -2.601 -15.425
    6   HG23  ILE  36          HG21      ILE  36 -23.498  -4.026 -12.363
    7   HG22  ILE  36          HG22      ILE  36 -24.711  -2.810 -11.961
    8   HG21  ILE  36          HG23      ILE  36 -23.007  -2.362 -12.049
    9   HD13  ILE  36          HD11      ILE  36 -25.510  -4.827 -15.561
   10   HD12  ILE  36          HD12      ILE  36 -26.580  -4.734 -14.161
   11   HD11  ILE  36          HD13      ILE  36 -24.856  -5.029 -13.936

  No H/Q in entry =          11
  In of MODEL   62
    1    H    GLU  37           H        GLU  37 -22.483   0.215 -12.401
    2    HA   GLU  37           HA       GLU  37 -19.745  -0.423 -13.302
    3    HB2  GLU  37           HB2      GLU  37 -20.818   2.322 -12.668
    4    HB3  GLU  37           HB3      GLU  37 -19.105   1.933 -12.829
    5    HG2  GLU  37           HG2      GLU  37 -21.152   1.720 -15.018
    6    HG3  GLU  37           HG3      GLU  37 -20.021   3.054 -14.797

  No H/Q in entry =           6
  In of MODEL   62
    1    H    ALA  38           H        ALA  38 -18.242  -0.504 -11.618
    2    HA   ALA  38           HA       ALA  38 -19.279  -0.308  -8.851
    3    HB1  ALA  38           HB1      ALA  38 -17.438  -2.168 -10.220
    4    HB3  ALA  38           HB2      ALA  38 -18.466  -2.431  -8.812
    5    HB2  ALA  38           HB3      ALA  38 -16.904  -1.633  -8.627

  No H/Q in entry =           5
  In of MODEL   62
    1    H    PHE  39           H        PHE  39 -18.124   1.031  -7.421
    2    HA   PHE  39           HA       PHE  39 -15.690   2.377  -8.364
    3    HB2  PHE  39           HB2      PHE  39 -18.129   3.772  -7.258
    4    HB3  PHE  39           HB3      PHE  39 -16.551   4.529  -7.462
    5    HD1  PHE  39           HD1      PHE  39 -15.595   4.719  -9.776
    6    HD2  PHE  39           HD2      PHE  39 -19.653   3.653  -9.015
    7    HE1  PHE  39           HE1      PHE  39 -16.186   5.353 -12.098
    8    HE2  PHE  39           HE2      PHE  39 -20.256   4.274 -11.326
    9    HZ   PHE  39           HZ       PHE  39 -18.523   5.097 -12.885

  No H/Q in entry =           9
  In of MODEL   62
    1    HA   PRO  40           HA       PRO  40 -14.694   1.828  -4.060
    2    HB2  PRO  40           HB2      PRO  40 -13.073   3.982  -3.525
    3    HB3  PRO  40           HB3      PRO  40 -12.538   2.650  -4.550
    4    HG2  PRO  40           HG2      PRO  40 -13.752   5.281  -5.383
    5    HG3  PRO  40           HG3      PRO  40 -12.273   4.521  -5.967
    6    HD2  PRO  40           HD2      PRO  40 -14.486   4.235  -7.361
    7    HD3  PRO  40           HD3      PRO  40 -13.431   2.843  -7.129

  No H/Q in entry =           7
  In of MODEL   62
    1    H    GLU  41           H        GLU  41 -15.380   2.828  -1.960
    2    HA   GLU  41           HA       GLU  41 -17.740   4.366  -1.988
    3    HB2  GLU  41           HB2      GLU  41 -17.576   4.390   0.395
    4    HB3  GLU  41           HB3      GLU  41 -17.005   2.817  -0.161
    5    HG2  GLU  41           HG2      GLU  41 -15.445   3.298   1.441
    6    HG3  GLU  41           HG3      GLU  41 -14.650   3.935   0.001

  No H/Q in entry =           6
  In of MODEL   62
    1    H    THR  42           H        THR  42 -14.482   5.516  -2.083
    2    HA   THR  42           HA       THR  42 -15.016   8.082  -0.952
    3    HB   THR  42           HB       THR  42 -12.908   8.774  -2.083
    4    HG1  THR  42           HG1      THR  42 -12.508   6.159  -2.960
    5   HG22  THR  42          HG21      THR  42 -12.450   6.029  -0.950
    6   HG21  THR  42          HG22      THR  42 -13.071   7.320   0.080
    7   HG23  THR  42          HG23      THR  42 -11.507   7.500  -0.713

  No H/Q in entry =           7
  In of MODEL   62
    1    H    LEU  43           H        LEU  43 -15.844   6.828  -4.012
    2    HA   LEU  43           HA       LEU  43 -16.297   9.543  -5.069
    3    HB2  LEU  43           HB2      LEU  43 -16.480   6.835  -6.379
    4    HB3  LEU  43           HB3      LEU  43 -16.789   8.373  -7.182
    5    HG   LEU  43           HG       LEU  43 -14.114   7.485  -6.132
    6   HD13  LEU  43          HD11      LEU  43 -13.525   6.899  -8.307
    7   HD12  LEU  43          HD12      LEU  43 -14.878   7.780  -9.014
    8   HD11  LEU  43          HD13      LEU  43 -15.164   6.265  -8.160
    9   HD21  LEU  43          HD21      LEU  43 -15.123   9.929  -7.560
   10   HD23  LEU  43          HD22      LEU  43 -13.441   9.418  -7.714
   11   HD22  LEU  43          HD23      LEU  43 -14.098   9.824  -6.129

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ALA  44           H        ALA  44 -18.104   7.643  -3.150
    2    HA   ALA  44           HA       ALA  44 -20.567   7.283  -4.458
    3    HB2  ALA  44           HB1      ALA  44 -20.346   6.248  -2.327
    4    HB3  ALA  44           HB2      ALA  44 -21.546   7.519  -2.094
    5    HB1  ALA  44           HB3      ALA  44 -19.887   7.763  -1.552

  No H/Q in entry =           5
  In of MODEL   62
    1    H    GLY  45           H        GLY  45 -19.350  10.226  -3.022
    2    HA3  GLY  45           HA2      GLY  45 -21.888  11.536  -3.421
    3    HA2  GLY  45           HA3      GLY  45 -20.392  12.288  -2.870

  No H/Q in entry =           3
  In of MODEL   62
    1    H    GLU  46           H        GLU  46 -18.800  11.389  -5.136
    2    HA   GLU  46           HA       GLU  46 -19.598  13.495  -6.972
    3    HB2  GLU  46           HB2      GLU  46 -17.240  13.182  -6.341
    4    HB3  GLU  46           HB3      GLU  46 -17.273  11.562  -7.037
    5    HG2  GLU  46           HG2      GLU  46 -16.183  12.994  -8.584
    6    HG3  GLU  46           HG3      GLU  46 -17.769  12.597  -9.246

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LYS  47           H        LYS  47 -19.228   9.982  -7.294
    2    HA   LYS  47           HA       LYS  47 -20.342  10.036  -9.972
    3    HB2  LYS  47           HB2      LYS  47 -19.606   7.748  -8.139
    4    HB3  LYS  47           HB3      LYS  47 -20.165   7.564  -9.801
    5    HG2  LYS  47           HG2      LYS  47 -17.721   9.146  -9.094
    6    HG3  LYS  47           HG3      LYS  47 -17.674   7.411  -9.405
    7    HD2  LYS  47           HD2      LYS  47 -18.756   7.831 -11.602
    8    HD3  LYS  47           HD3      LYS  47 -18.623   9.562 -11.290
    9    HE2  LYS  47           HE2      LYS  47 -16.311   7.636 -11.411
   10    HE3  LYS  47           HE3      LYS  47 -16.804   8.717 -12.712
   11    HZ3  LYS  47           HZ1      LYS  47 -16.383  10.594 -11.291
   12    HZ2  LYS  47           HZ2      LYS  47 -14.991   9.626 -11.399
   13    HZ1  LYS  47           HZ3      LYS  47 -15.959   9.571 -10.003

  No H/Q in entry =          13
  In of MODEL   62
    1    H    GLY  48           H        GLY  48 -21.603   9.288  -6.796
    2    HA3  GLY  48           HA2      GLY  48 -23.899   7.912  -7.488
    3    HA2  GLY  48           HA3      GLY  48 -23.742   8.966  -6.083

  No H/Q in entry =           3
  In of MODEL   62
    1    H    GLN  49           H        GLN  49 -23.337  11.372  -7.733
    2    HA   GLN  49           HA       GLN  49 -25.969  12.292  -7.903
    3    HB2  GLN  49           HB2      GLN  49 -23.497  13.291  -9.300
    4    HB3  GLN  49           HB3      GLN  49 -25.024  14.152  -9.242
    5    HG2  GLN  49           HG2      GLN  49 -24.862  14.266  -6.807
    6    HG3  GLN  49           HG3      GLN  49 -23.347  13.384  -6.864
    7   HE21  GLN  49          HE21      GLN  49 -23.387  15.655  -5.664
    8   HE22  GLN  49          HE22      GLN  49 -22.558  16.952  -6.355

  No H/Q in entry =           8
  In of MODEL   62
    1    H    ASN  50           H        ASN  50 -24.164  10.461 -10.235
    2    HA   ASN  50           HA       ASN  50 -26.108  11.128 -12.337
    3    HB2  ASN  50           HB2      ASN  50 -23.425   9.770 -12.530
    4    HB3  ASN  50           HB3      ASN  50 -24.505  10.076 -13.883
    5   HD21  ASN  50          HD21      ASN  50 -21.934  11.159 -12.311
    6   HD22  ASN  50          HD22      ASN  50 -21.818  12.795 -12.707

  No H/Q in entry =           6
  In of MODEL   62
    1    H    ALA  51           H        ALA  51 -25.922   8.854 -10.015
    2    HA   ALA  51           HA       ALA  51 -26.555   6.600 -11.770
    3    HB2  ALA  51           HB1      ALA  51 -25.874   5.351 -10.043
    4    HB3  ALA  51           HB2      ALA  51 -27.049   6.112  -8.972
    5    HB1  ALA  51           HB3      ALA  51 -25.459   6.842  -9.196

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ASP  52           H        ASP  52 -28.479   5.410 -11.588
    2    HA   ASP  52           HA       ASP  52 -30.785   7.105 -10.974
    3    HB2  ASP  52           HB2      ASP  52 -30.420   4.567 -12.562
    4    HB3  ASP  52           HB3      ASP  52 -32.012   5.203 -12.145

  No H/Q in entry =           4
  In of MODEL   62
    1    H    VAL  53           H        VAL  53 -28.982   4.370  -9.871
    2    HA   VAL  53           HA       VAL  53 -30.423   4.478  -7.354
    3    HB   VAL  53           HB       VAL  53 -31.705   2.702  -8.539
    4   HG11  VAL  53          HG11      VAL  53 -29.904   1.918 -10.039
    5   HG13  VAL  53          HG12      VAL  53 -30.643   0.597  -9.136
    6   HG12  VAL  53          HG13      VAL  53 -29.071   1.228  -8.648
    7   HG23  VAL  53          HG21      VAL  53 -30.743   0.843  -6.787
    8   HG22  VAL  53          HG22      VAL  53 -31.960   2.076  -6.458
    9   HG21  VAL  53          HG23      VAL  53 -30.270   2.381  -6.064

  No H/Q in entry =           9
  In of MODEL   62
    1    H    VAL  54           H        VAL  54 -29.080   4.192  -5.691
    2    HA   VAL  54           HA       VAL  54 -26.268   3.518  -6.286
    3    HB   VAL  54           HB       VAL  54 -27.457   5.289  -4.090
    4   HG11  VAL  54          HG11      VAL  54 -24.785   4.045  -4.346
    5   HG13  VAL  54          HG12      VAL  54 -25.581   4.717  -2.923
    6   HG12  VAL  54          HG13      VAL  54 -24.753   5.785  -4.056
    7   HG22  VAL  54          HG21      VAL  54 -26.728   7.122  -5.251
    8   HG21  VAL  54          HG22      VAL  54 -27.208   6.053  -6.569
    9   HG23  VAL  54          HG23      VAL  54 -25.505   6.211  -6.139

  No H/Q in entry =           9
  In of MODEL   62
    1    H    LEU  55           H        LEU  55 -25.542   1.665  -5.584
    2    HA   LEU  55           HA       LEU  55 -26.951   0.324  -3.362
    3    HB2  LEU  55           HB2      LEU  55 -25.321  -0.807  -5.624
    4    HB3  LEU  55           HB3      LEU  55 -26.012  -1.751  -4.303
    5    HG   LEU  55           HG       LEU  55 -27.560  -0.336  -6.465
    6   HD13  LEU  55          HD11      LEU  55 -27.134  -2.202  -7.625
    7   HD12  LEU  55          HD12      LEU  55 -28.026  -3.102  -6.399
    8   HD11  LEU  55          HD13      LEU  55 -26.279  -2.910  -6.257
    9   HD23  LEU  55          HD21      LEU  55 -28.713  -2.306  -4.543
   10   HD22  LEU  55          HD22      LEU  55 -29.504  -1.004  -5.431
   11   HD21  LEU  55          HD23      LEU  55 -28.502  -0.632  -4.029

  No H/Q in entry =          11
  In of MODEL   62
    1    H    LEU  56           H        LEU  56 -25.758  -0.131  -1.543
    2    HA   LEU  56           HA       LEU  56 -22.859   0.466  -1.616
    3    HB2  LEU  56           HB2      LEU  56 -24.638   0.208   0.794
    4    HB3  LEU  56           HB3      LEU  56 -22.963   0.754   0.763
    5    HG   LEU  56           HG       LEU  56 -25.374   2.237  -0.246
    6   HD11  LEU  56          HD11      LEU  56 -24.231   2.016   2.281
    7   HD13  LEU  56          HD12      LEU  56 -25.315   3.295   1.735
    8   HD12  LEU  56          HD13      LEU  56 -23.570   3.519   1.637
    9   HD23  LEU  56          HD21      LEU  56 -23.553   4.059  -0.502
   10   HD22  LEU  56          HD22      LEU  56 -23.861   2.896  -1.792
   11   HD21  LEU  56          HD23      LEU  56 -22.484   2.673  -0.713

  No H/Q in entry =          11
  In of MODEL   62
    1    H    GLY  57           H        GLY  57 -21.368  -1.047  -1.036
    2    HA3  GLY  57           HA2      GLY  57 -22.103  -3.796  -1.142
    3    HA2  GLY  57           HA3      GLY  57 -20.517  -3.175  -0.688

  No H/Q in entry =           3
  In of MODEL   62
    1    HA   PRO  58           HA       PRO  58 -23.241  -4.284   3.066
    2    HB2  PRO  58           HB2      PRO  58 -22.377  -6.815   3.755
    3    HB3  PRO  58           HB3      PRO  58 -23.787  -6.536   2.734
    4    HG2  PRO  58           HG2      PRO  58 -21.007  -7.251   1.966
    5    HG3  PRO  58           HG3      PRO  58 -22.537  -7.839   1.316
    6    HD2  PRO  58           HD2      PRO  58 -21.060  -5.956   0.029
    7    HD3  PRO  58           HD3      PRO  58 -22.821  -5.996  -0.069

  No H/Q in entry =           7
  In of MODEL   62
    1    H    GLN  59           H        GLN  59 -19.847  -4.542   2.462
    2    HA   GLN  59           HA       GLN  59 -19.087  -4.418   5.219
    3    HB2  GLN  59           HB2      GLN  59 -17.719  -4.142   2.623
    4    HB3  GLN  59           HB3      GLN  59 -17.019  -3.208   3.929
    5    HG2  GLN  59           HG2      GLN  59 -15.847  -5.200   4.019
    6    HG3  GLN  59           HG3      GLN  59 -17.079  -5.422   5.250
    7   HE21  GLN  59          HE21      GLN  59 -16.128  -7.457   4.447
    8   HE22  GLN  59          HE22      GLN  59 -16.876  -8.610   3.512

  No H/Q in entry =           8
  In of MODEL   62
    1    H    ILE  60           H        ILE  60 -20.198  -2.011   2.933
    2    HA   ILE  60           HA       ILE  60 -19.480   0.066   4.911
    3    HB   ILE  60           HB       ILE  60 -19.851   1.712   3.021
    4   HG12  ILE  60          HG12      ILE  60 -19.455  -0.567   1.128
    5   HG13  ILE  60          HG13      ILE  60 -21.084  -0.136   1.645
    6   HG21  ILE  60          HG21      ILE  60 -17.639   1.004   3.780
    7   HG23  ILE  60          HG22      ILE  60 -17.678   1.401   2.062
    8   HG22  ILE  60          HG23      ILE  60 -17.658  -0.285   2.577
    9   HD13  ILE  60          HD11      ILE  60 -20.880   1.121  -0.289
   10   HD12  ILE  60          HD12      ILE  60 -19.160   1.414  -0.041
   11   HD11  ILE  60          HD13      ILE  60 -20.351   2.287   0.924

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ALA  61           H        ALA  61 -21.820  -1.682   5.041
    2    HA   ALA  61           HA       ALA  61 -24.156  -0.190   4.537
    3    HB1  ALA  61           HB1      ALA  61 -25.264  -1.715   5.915
    4    HB2  ALA  61           HB2      ALA  61 -23.841  -1.976   6.925
    5    HB3  ALA  61           HB3      ALA  61 -23.897  -2.640   5.292

  No H/Q in entry =           5
  In of MODEL   62
    1    H    TYR  62           H        TYR  62 -21.941  -0.058   7.329
    2    HA   TYR  62           HA       TYR  62 -23.604   1.542   8.951
    3    HB2  TYR  62           HB2      TYR  62 -21.611   2.125  10.176
    4    HB3  TYR  62           HB3      TYR  62 -21.521   0.422   9.731
    5    HD1  TYR  62           HD1      TYR  62 -19.845  -0.369   8.126
    6    HD2  TYR  62           HD2      TYR  62 -20.053   3.764   9.194
    7    HE1  TYR  62           HE1      TYR  62 -17.656   0.014   7.058
    8    HE2  TYR  62           HE2      TYR  62 -17.850   4.142   8.127
    9    HH   TYR  62           HH       TYR  62 -16.293   1.606   6.282

  No H/Q in entry =           9
  In of MODEL   62
    1    H    MET  63           H        MET  63 -22.030   2.417   6.061
    2    HA   MET  63           HA       MET  63 -22.056   5.275   6.663
    3    HB2  MET  63           HB2      MET  63 -21.349   3.714   4.177
    4    HB3  MET  63           HB3      MET  63 -21.279   5.474   4.297
    5    HG2  MET  63           HG2      MET  63 -19.556   5.288   6.007
    6    HG3  MET  63           HG3      MET  63 -19.623   3.532   5.886
    7    HE2  MET  63           HE1      MET  63 -16.940   3.051   4.646
    8    HE1  MET  63           HE2      MET  63 -17.176   4.386   5.773
    9    HE3  MET  63           HE3      MET  63 -16.312   4.654   4.258

  No H/Q in entry =           9
  In of MODEL   62
    1    H    LEU  64           H        LEU  64 -24.488   3.220   5.769
    2    HA   LEU  64           HA       LEU  64 -25.797   4.484   3.650
    3    HB2  LEU  64           HB2      LEU  64 -26.518   2.355   4.640
    4    HB3  LEU  64           HB3      LEU  64 -27.028   3.213   6.094
    5    HG   LEU  64           HG       LEU  64 -28.807   4.309   4.833
    6   HD13  LEU  64          HD11      LEU  64 -28.545   4.495   2.593
    7   HD12  LEU  64          HD12      LEU  64 -29.078   2.816   2.503
    8   HD11  LEU  64          HD13      LEU  64 -27.357   3.194   2.545
    9   HD23  LEU  64          HD21      LEU  64 -29.135   1.444   4.178
   10   HD22  LEU  64          HD22      LEU  64 -30.195   2.538   5.066
   11   HD21  LEU  64          HD23      LEU  64 -28.768   1.865   5.852

  No H/Q in entry =          11
  In of MODEL   62
    1    HA   PRO  65           HA       PRO  65 -28.180   7.572   6.308
    2    HB2  PRO  65           HB2      PRO  65 -26.189   7.938   8.547
    3    HB3  PRO  65           HB3      PRO  65 -27.944   8.103   8.591
    4    HG2  PRO  65           HG2      PRO  65 -26.862   5.947   9.587
    5    HG3  PRO  65           HG3      PRO  65 -28.278   5.785   8.549
    6    HD2  PRO  65           HD2      PRO  65 -25.373   5.343   7.854
    7    HD3  PRO  65           HD3      PRO  65 -26.769   4.346   7.442

  No H/Q in entry =           7
  In of MODEL   62
    1    H    GLU  66           H        GLU  66 -24.628   7.757   6.367
    2    HA   GLU  66           HA       GLU  66 -24.520  10.554   5.869
    3    HB2  GLU  66           HB2      GLU  66 -22.557   8.354   5.286
    4    HB3  GLU  66           HB3      GLU  66 -22.222  10.065   5.021
    5    HG2  GLU  66           HG2      GLU  66 -22.454  10.497   7.377
    6    HG3  GLU  66           HG3      GLU  66 -22.866   8.808   7.665

  No H/Q in entry =           6
  In of MODEL   62
    1    H    ILE  67           H        ILE  67 -24.443   7.736   3.709
    2    HA   ILE  67           HA       ILE  67 -24.146   9.392   1.360
    3    HB   ILE  67           HB       ILE  67 -24.850   6.440   1.637
    4   HG12  ILE  67          HG12      ILE  67 -22.305   7.751   0.666
    5   HG13  ILE  67          HG13      ILE  67 -22.567   7.368   2.366
    6   HG21  ILE  67          HG21      ILE  67 -24.922   8.244  -0.648
    7   HG23  ILE  67          HG22      ILE  67 -25.436   6.561  -0.541
    8   HG22  ILE  67          HG23      ILE  67 -23.751   6.947  -0.886
    9   HD12  ILE  67          HD11      ILE  67 -22.036   5.552   0.073
   10   HD11  ILE  67          HD12      ILE  67 -23.007   4.957   1.419
   11   HD13  ILE  67          HD13      ILE  67 -21.368   5.542   1.705

  No H/Q in entry =          11
  In of MODEL   62
    1    H    GLN  68           H        GLN  68 -26.937   8.206   3.039
    2    HA   GLN  68           HA       GLN  68 -28.828   8.949   1.044
    3    HB2  GLN  68           HB2      GLN  68 -29.053   8.673   4.038
    4    HB3  GLN  68           HB3      GLN  68 -30.410   9.148   3.032
    5    HG2  GLN  68           HG2      GLN  68 -30.308   7.080   1.823
    6    HG3  GLN  68           HG3      GLN  68 -28.822   6.626   2.636
    7   HE21  GLN  68          HE21      GLN  68 -30.909   5.124   2.556
    8   HE22  GLN  68          HE22      GLN  68 -31.703   4.662   3.988

  No H/Q in entry =           8
  In of MODEL   62
    1    H    ARG  69           H        ARG  69 -27.328  10.805   3.718
    2    HA   ARG  69           HA       ARG  69 -28.851  13.180   3.238
    3    HB2  ARG  69           HB2      ARG  69 -26.448  12.455   4.846
    4    HB3  ARG  69           HB3      ARG  69 -26.638  14.154   4.432
    5    HG2  ARG  69           HG2      ARG  69 -28.950  14.079   5.412
    6    HG3  ARG  69           HG3      ARG  69 -28.632  12.422   5.940
    7    HD2  ARG  69           HD2      ARG  69 -27.092  14.909   6.770
    8    HD3  ARG  69           HD3      ARG  69 -28.159  13.965   7.798
    9    HE   ARG  69           HE       ARG  69 -25.495  13.173   6.866
   10   HH21  ARG  69          HH11      ARG  69 -24.571  11.506   8.115
   11   HH22  ARG  69          HH12      ARG  69 -25.542  10.662   9.275
   12   HH11  ARG  69          HH21      ARG  69 -28.406  12.493   8.595
   13   HH12  ARG  69          HH22      ARG  69 -27.713  11.219   9.543

  No H/Q in entry =          13
  In of MODEL   62
    1    H    LEU  70           H        LEU  70 -25.900  11.916   1.912
    2    HA   LEU  70           HA       LEU  70 -24.942  14.309   0.662
    3    HB2  LEU  70           HB2      LEU  70 -23.800  12.080   1.327
    4    HB3  LEU  70           HB3      LEU  70 -24.387  11.524  -0.239
    5    HG   LEU  70           HG       LEU  70 -22.889  12.960  -1.375
    6   HD11  LEU  70          HD11      LEU  70 -22.115  13.945   1.380
    7   HD13  LEU  70          HD12      LEU  70 -22.878  14.891   0.102
    8   HD12  LEU  70          HD13      LEU  70 -21.227  14.307  -0.103
    9   HD22  LEU  70          HD21      LEU  70 -21.348  11.347  -1.094
   10   HD21  LEU  70          HD22      LEU  70 -22.235  10.812   0.333
   11   HD23  LEU  70          HD23      LEU  70 -20.921  11.977   0.495

  No H/Q in entry =          11
  In of MODEL   62
    1    H    LEU  71           H        LEU  71 -26.933  11.600  -0.360
    2    HA   LEU  71           HA       LEU  71 -27.557  12.968  -2.920
    3    HB2  LEU  71           HB2      LEU  71 -27.573   9.994  -2.377
    4    HB3  LEU  71           HB3      LEU  71 -27.760  10.793  -3.937
    5    HG   LEU  71           HG       LEU  71 -25.241  11.019  -2.289
    6   HD12  LEU  71          HD11      LEU  71 -25.198   9.312  -4.667
    7   HD11  LEU  71          HD12      LEU  71 -26.164   8.669  -3.340
    8   HD13  LEU  71          HD13      LEU  71 -24.464   9.064  -3.082
    9   HD22  LEU  71          HD21      LEU  71 -25.461  12.775  -3.840
   10   HD21  LEU  71          HD22      LEU  71 -25.896  11.661  -5.135
   11   HD23  LEU  71          HD23      LEU  71 -24.267  11.638  -4.461

  No H/Q in entry =          11
  In of MODEL   62
    1    HA   PRO  72           HA       PRO  72 -31.381  12.365  -0.268
    2    HB2  PRO  72           HB2      PRO  72 -32.395  14.865  -0.427
    3    HB3  PRO  72           HB3      PRO  72 -31.058  14.530   0.672
    4    HG2  PRO  72           HG2      PRO  72 -30.954  15.644  -2.121
    5    HG3  PRO  72           HG3      PRO  72 -30.218  16.289  -0.653
    6    HD2  PRO  72           HD2      PRO  72 -28.793  14.760  -2.374
    7    HD3  PRO  72           HD3      PRO  72 -28.523  14.665  -0.635

  No H/Q in entry =           7
  In of MODEL   62
    1    H    ASN  73           H        ASN  73 -30.827  13.252  -3.514
    2    HA   ASN  73           HA       ASN  73 -33.663  12.749  -4.122
    3    HB2  ASN  73           HB2      ASN  73 -33.272  13.814  -6.257
    4    HB3  ASN  73           HB3      ASN  73 -32.807  14.867  -4.930
    5   HD21  ASN  73          HD21      ASN  73 -32.022  14.873  -7.612
    6   HD22  ASN  73          HD22      ASN  73 -30.349  14.807  -7.807

  No H/Q in entry =           6
  In of MODEL   62
    1    H    LYS  74           H        LYS  74 -31.549  10.633  -3.634
    2    HA   LYS  74           HA       LYS  74 -32.038   9.124  -6.134
    3    HB2  LYS  74           HB2      LYS  74 -29.488   9.039  -4.516
    4    HB3  LYS  74           HB3      LYS  74 -29.826   8.156  -6.005
    5    HG2  LYS  74           HG2      LYS  74 -29.739  11.140  -5.900
    6    HG3  LYS  74           HG3      LYS  74 -28.305  10.153  -6.176
    7    HD2  LYS  74           HD2      LYS  74 -29.370   9.098  -8.083
    8    HD3  LYS  74           HD3      LYS  74 -30.846  10.018  -7.789
    9    HE2  LYS  74           HE2      LYS  74 -29.743  12.078  -8.302
   10    HE3  LYS  74           HE3      LYS  74 -28.172  11.279  -8.372
   11    HZ2  LYS  74           HZ1      LYS  74 -29.682  11.723 -10.509
   12    HZ1  LYS  74           HZ2      LYS  74 -30.243  10.177 -10.083
   13    HZ3  LYS  74           HZ3      LYS  74 -28.593  10.426 -10.394

  No H/Q in entry =          13
  In of MODEL   62
    1    HA   PRO  75           HA       PRO  75 -33.243   6.160  -3.062
    2    HB2  PRO  75           HB2      PRO  75 -33.424   3.877  -4.570
    3    HB3  PRO  75           HB3      PRO  75 -34.630   5.158  -4.677
    4    HG2  PRO  75           HG2      PRO  75 -32.265   4.644  -6.439
    5    HG3  PRO  75           HG3      PRO  75 -33.938   4.969  -6.893
    6    HD2  PRO  75           HD2      PRO  75 -32.111   6.946  -6.919
    7    HD3  PRO  75           HD3      PRO  75 -33.762   7.265  -6.387

  No H/Q in entry =           7
  In of MODEL   62
    1    H    VAL  76           H        VAL  76 -31.726   5.238  -1.662
    2    HA   VAL  76           HA       VAL  76 -29.197   4.141  -2.740
    3    HB   VAL  76           HB       VAL  76 -29.564   5.674  -0.131
    4   HG11  VAL  76          HG11      VAL  76 -27.140   4.484  -1.490
    5   HG13  VAL  76          HG12      VAL  76 -27.804   4.045   0.085
    6   HG12  VAL  76          HG13      VAL  76 -27.051   5.622  -0.145
    7   HG22  VAL  76          HG21      VAL  76 -29.012   7.581  -1.081
    8   HG21  VAL  76          HG22      VAL  76 -29.516   6.805  -2.584
    9   HG23  VAL  76          HG23      VAL  76 -27.811   6.833  -2.134

  No H/Q in entry =           9
  In of MODEL   62
    1    H    GLU  77           H        GLU  77 -28.850   2.025  -2.059
    2    HA   GLU  77           HA       GLU  77 -29.582   1.280   0.623
    3    HB2  GLU  77           HB2      GLU  77 -31.090  -0.477   0.153
    4    HB3  GLU  77           HB3      GLU  77 -31.731   0.987  -0.595
    5    HG2  GLU  77           HG2      GLU  77 -31.083   0.196  -2.760
    6    HG3  GLU  77           HG3      GLU  77 -30.352  -1.238  -2.041

  No H/Q in entry =           6
  In of MODEL   62
    1    H    VAL  78           H        VAL  78 -29.129  -0.761   1.350
    2    HA   VAL  78           HA       VAL  78 -26.424  -1.402   0.475
    3    HB   VAL  78           HB       VAL  78 -28.071  -2.307   2.875
    4   HG11  VAL  78          HG11      VAL  78 -25.665  -3.431   1.781
    5   HG13  VAL  78          HG12      VAL  78 -26.540  -3.908   3.237
    6   HG12  VAL  78          HG13      VAL  78 -25.292  -2.666   3.325
    7   HG22  VAL  78          HG21      VAL  78 -26.693  -0.817   4.162
    8   HG21  VAL  78          HG22      VAL  78 -27.488   0.065   2.858
    9   HG23  VAL  78          HG23      VAL  78 -25.784  -0.366   2.720

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ILE  79           H        ILE  79 -25.777  -3.303  -0.370
    2    HA   ILE  79           HA       ILE  79 -27.748  -4.945  -1.659
    3    HB   ILE  79           HB       ILE  79 -24.731  -5.285  -1.434
    4   HG12  ILE  79          HG12      ILE  79 -26.437  -4.355  -3.750
    5   HG13  ILE  79          HG13      ILE  79 -25.622  -3.259  -2.635
    6   HG22  ILE  79          HG21      ILE  79 -25.766  -6.604  -3.709
    7   HG21  ILE  79          HG22      ILE  79 -26.715  -7.137  -2.321
    8   HG23  ILE  79          HG23      ILE  79 -24.960  -7.311  -2.309
    9   HD13  ILE  79          HD11      ILE  79 -24.208  -3.348  -4.455
   10   HD12  ILE  79          HD12      ILE  79 -24.445  -5.081  -4.678
   11   HD11  ILE  79          HD13      ILE  79 -23.489  -4.489  -3.318

  No H/Q in entry =          11
  In of MODEL   62
    1    H    ASP  80           H        ASP  80 -28.496  -6.896  -1.010
    2    HA   ASP  80           HA       ASP  80 -28.382  -7.703   1.664
    3    HB2  ASP  80           HB2      ASP  80 -30.102  -8.437   0.053
    4    HB3  ASP  80           HB3      ASP  80 -28.888  -9.401  -0.788

  No H/Q in entry =           4
  In of MODEL   62
    1    H    SER  81           H        SER  81 -26.779  -8.706   2.825
    2    HA   SER  81           HA       SER  81 -24.249  -9.277   1.645
    3    HB2  SER  81           HB2      SER  81 -23.632 -10.199   3.846
    4    HB3  SER  81           HB3      SER  81 -24.426  -8.634   4.008
    5    HG   SER  81           HG       SER  81 -25.784  -9.581   5.233

  No H/Q in entry =           5
  In of MODEL   62
    1    H    LEU  82           H        LEU  82 -26.829 -11.515   2.047
    2    HA   LEU  82           HA       LEU  82 -25.143 -13.802   1.599
    3    HB2  LEU  82           HB2      LEU  82 -28.103 -13.513   1.143
    4    HB3  LEU  82           HB3      LEU  82 -27.203 -15.010   1.373
    5    HG   LEU  82           HG       LEU  82 -27.673 -12.908   3.467
    6   HD12  LEU  82          HD11      LEU  82 -28.819 -15.690   3.120
    7   HD11  LEU  82          HD12      LEU  82 -29.696 -14.184   2.843
    8   HD13  LEU  82          HD13      LEU  82 -29.140 -14.597   4.466
    9   HD23  LEU  82          HD21      LEU  82 -26.739 -14.801   4.900
   10   HD22  LEU  82          HD22      LEU  82 -25.585 -13.956   3.869
   11   HD21  LEU  82          HD23      LEU  82 -26.202 -15.536   3.389

  No H/Q in entry =          11
  In of MODEL   62
    1    H    LEU  83           H        LEU  83 -27.236 -11.763  -0.384
    2    HA   LEU  83           HA       LEU  83 -26.960 -13.189  -2.810
    3    HB2  LEU  83           HB2      LEU  83 -27.542 -10.291  -2.257
    4    HB3  LEU  83           HB3      LEU  83 -27.538 -10.991  -3.875
    5    HG   LEU  83           HG       LEU  83 -29.540 -11.425  -1.678
    6   HD13  LEU  83          HD11      LEU  83 -30.408  -9.663  -2.800
    7   HD12  LEU  83          HD12      LEU  83 -30.806 -10.843  -4.045
    8   HD11  LEU  83          HD13      LEU  83 -29.326  -9.892  -4.173
    9   HD23  LEU  83          HD21      LEU  83 -29.610 -12.779  -4.359
   10   HD22  LEU  83          HD22      LEU  83 -30.554 -13.139  -2.914
   11   HD21  LEU  83          HD23      LEU  83 -28.838 -13.542  -2.970

  No H/Q in entry =          11
  In of MODEL   62
    1    H    TYR  84           H        TYR  84 -25.148 -10.637  -1.222
    2    HA   TYR  84           HA       TYR  84 -23.323 -10.110  -3.376
    3    HB2  TYR  84           HB2      TYR  84 -23.881  -8.536  -1.488
    4    HB3  TYR  84           HB3      TYR  84 -22.948  -9.585  -0.423
    5    HD1  TYR  84           HD1      TYR  84 -20.481  -9.879  -0.851
    6    HD2  TYR  84           HD2      TYR  84 -22.809  -6.915  -2.858
    7    HE1  TYR  84           HE1      TYR  84 -18.406  -8.698  -1.486
    8    HE2  TYR  84           HE2      TYR  84 -20.742  -5.731  -3.510
    9    HH   TYR  84           HH       TYR  84 -18.445  -5.983  -3.677

  No H/Q in entry =           9
  In of MODEL   62
    1    H    GLY  85           H        GLY  85 -22.957 -11.996  -0.365
    2    HA3  GLY  85           HA2      GLY  85 -20.329 -12.799  -0.827
    3    HA2  GLY  85           HA3      GLY  85 -21.505 -13.685   0.143

  No H/Q in entry =           3
  In of MODEL   62
    1    H    LYS  86           H        LYS  86 -23.331 -14.237  -1.896
    2    HA   LYS  86           HA       LYS  86 -22.141 -16.585  -3.080
    3    HB2  LYS  86           HB2      LYS  86 -24.404 -16.488  -2.098
    4    HB3  LYS  86           HB3      LYS  86 -24.875 -15.329  -3.341
    5    HG2  LYS  86           HG2      LYS  86 -24.615 -17.021  -5.039
    6    HG3  LYS  86           HG3      LYS  86 -24.106 -18.184  -3.812
    7    HD2  LYS  86           HD2      LYS  86 -26.236 -17.886  -2.636
    8    HD3  LYS  86           HD3      LYS  86 -26.746 -16.711  -3.848
    9    HE2  LYS  86           HE2      LYS  86 -27.741 -18.879  -4.305
   10    HE3  LYS  86           HE3      LYS  86 -26.595 -18.456  -5.575
   11    HZ1  LYS  86           HZ1      LYS  86 -25.117 -19.756  -3.649
   12    HZ3  LYS  86           HZ2      LYS  86 -25.595 -20.378  -5.156
   13    HZ2  LYS  86           HZ3      LYS  86 -26.549 -20.661  -3.781

  No H/Q in entry =          13
  In of MODEL   62
    1    H    VAL  87           H        VAL  87 -22.323 -13.406  -4.081
    2    HA   VAL  87           HA       VAL  87 -22.100 -12.284  -6.061
    3    HB   VAL  87           HB       VAL  87 -20.878 -14.783  -7.277
    4   HG11  VAL  87          HG11      VAL  87 -21.270 -12.437  -8.431
    5   HG13  VAL  87          HG12      VAL  87 -19.753 -13.304  -8.682
    6   HG12  VAL  87          HG13      VAL  87 -19.833 -11.981  -7.518
    7   HG21  VAL  87          HG21      VAL  87 -19.604 -12.949  -5.260
    8   HG23  VAL  87          HG22      VAL  87 -18.701 -14.034  -6.316
    9   HG22  VAL  87          HG23      VAL  87 -19.835 -14.692  -5.137

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ASP  88           H        ASP  88 -24.572 -13.063  -5.677
    2    HA   ASP  88           HA       ASP  88 -25.625 -14.424  -8.027
    3    HB2  ASP  88           HB2      ASP  88 -26.598 -14.649  -5.691
    4    HB3  ASP  88           HB3      ASP  88 -27.152 -12.982  -5.846

  No H/Q in entry =           4
  In of MODEL   62
    1    H    GLY  89           H        GLY  89 -25.001 -13.182  -9.713
    2    HA3  GLY  89           HA2      GLY  89 -25.350 -10.434 -10.006
    3    HA2  GLY  89           HA3      GLY  89 -25.262 -11.596 -11.328

  No H/Q in entry =           3
  In of MODEL   62
    1    H    LEU  90           H        LEU  90 -27.622 -13.077 -10.823
    2    HA   LEU  90           HA       LEU  90 -29.549 -11.293 -11.991
    3    HB2  LEU  90           HB2      LEU  90 -29.472 -13.707 -12.490
    4    HB3  LEU  90           HB3      LEU  90 -29.949 -14.047 -10.827
    5    HG   LEU  90           HG       LEU  90 -32.133 -13.072 -11.217
    6   HD13  LEU  90          HD11      LEU  90 -32.063 -11.374 -12.752
    7   HD12  LEU  90          HD12      LEU  90 -32.530 -12.680 -13.843
    8   HD11  LEU  90          HD13      LEU  90 -30.843 -12.179 -13.741
    9   HD23  LEU  90          HD21      LEU  90 -31.972 -14.777 -13.597
   10   HD22  LEU  90          HD22      LEU  90 -32.935 -14.951 -12.130
   11   HD21  LEU  90          HD23      LEU  90 -31.247 -15.463 -12.143

  No H/Q in entry =          11
  In of MODEL   62
    1    H    GLY  91           H        GLY  91 -29.281 -12.672  -8.759
    2    HA3  GLY  91           HA2      GLY  91 -31.680 -11.668  -7.747
    3    HA2  GLY  91           HA3      GLY  91 -30.255 -12.084  -6.793

  No H/Q in entry =           3
  In of MODEL   62
    1    H    VAL  92           H        VAL  92 -28.454 -10.174  -7.720
    2    HA   VAL  92           HA       VAL  92 -29.378  -7.874  -6.246
    3    HB   VAL  92           HB       VAL  92 -26.813  -8.243  -7.838
    4   HG12  VAL  92          HG11      VAL  92 -27.084  -6.294  -5.576
    5   HG11  VAL  92          HG12      VAL  92 -27.785  -5.844  -7.131
    6   HG13  VAL  92          HG13      VAL  92 -26.064  -6.205  -7.012
    7   HG22  VAL  92          HG21      VAL  92 -26.489  -9.759  -6.194
    8   HG21  VAL  92          HG22      VAL  92 -27.675  -9.013  -5.122
    9   HG23  VAL  92          HG23      VAL  92 -26.062  -8.319  -5.273

  No H/Q in entry =           9
  In of MODEL   62
    1    H    LEU  93           H        LEU  93 -28.942  -8.627  -9.644
    2    HA   LEU  93           HA       LEU  93 -29.449  -6.049 -10.661
    3    HB2  LEU  93           HB2      LEU  93 -28.701  -7.910 -12.062
    4    HB3  LEU  93           HB3      LEU  93 -30.245  -8.725 -11.806
    5    HG   LEU  93           HG       LEU  93 -31.377  -6.867 -12.991
    6   HD11  LEU  93          HD11      LEU  93 -29.625  -5.145 -12.551
    7   HD13  LEU  93          HD12      LEU  93 -30.067  -5.260 -14.256
    8   HD12  LEU  93          HD13      LEU  93 -28.566  -5.987 -13.684
    9   HD23  LEU  93          HD21      LEU  93 -30.313  -7.447 -15.263
   10   HD22  LEU  93          HD22      LEU  93 -31.075  -8.720 -14.310
   11   HD21  LEU  93          HD23      LEU  93 -29.317  -8.558 -14.324

  No H/Q in entry =          11
  In of MODEL   62
    1    H    LYS  94           H        LYS  94 -31.663  -8.705  -9.713
    2    HA   LYS  94           HA       LYS  94 -34.093  -7.430 -10.373
    3    HB2  LYS  94           HB2      LYS  94 -33.441  -9.510  -8.292
    4    HB3  LYS  94           HB3      LYS  94 -35.078  -8.921  -8.575
    5    HG2  LYS  94           HG2      LYS  94 -34.953  -9.769 -10.882
    6    HG3  LYS  94           HG3      LYS  94 -33.348 -10.413 -10.537
    7    HD2  LYS  94           HD2      LYS  94 -34.379 -11.749  -8.662
    8    HD3  LYS  94           HD3      LYS  94 -35.961 -11.215  -9.231
    9    HE2  LYS  94           HE2      LYS  94 -35.397 -12.188 -11.467
   10    HE3  LYS  94           HE3      LYS  94 -33.935 -12.860 -10.746
   11    HZ3  LYS  94           HZ1      LYS  94 -35.690 -14.496 -10.854
   12    HZ2  LYS  94           HZ2      LYS  94 -36.721 -13.499  -9.942
   13    HZ1  LYS  94           HZ3      LYS  94 -35.316 -14.140  -9.236

  No H/Q in entry =          13
  In of MODEL   62
    1    H    ALA  95           H        ALA  95 -32.255  -7.336  -7.333
    2    HA   ALA  95           HA       ALA  95 -34.192  -5.821  -5.898
    3    HB2  ALA  95           HB1      ALA  95 -31.736  -7.031  -5.327
    4    HB3  ALA  95           HB2      ALA  95 -32.764  -6.148  -4.199
    5    HB1  ALA  95           HB3      ALA  95 -31.469  -5.310  -5.054

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ALA  96           H        ALA  96 -31.613  -4.881  -8.036
    2    HA   ALA  96           HA       ALA  96 -31.681  -2.095  -7.356
    3    HB2  ALA  96           HB1      ALA  96 -30.343  -1.858  -9.479
    4    HB3  ALA  96           HB2      ALA  96 -30.544  -3.591  -9.739
    5    HB1  ALA  96           HB3      ALA  96 -29.656  -3.008  -8.332

  No H/Q in entry =           5
  In of MODEL   62
    1    H    VAL  97           H        VAL  97 -33.116  -3.987  -9.976
    2    HA   VAL  97           HA       VAL  97 -34.326  -1.799 -11.302
    3    HB   VAL  97           HB       VAL  97 -34.960  -4.768 -11.241
    4   HG11  VAL  97          HG11      VAL  97 -36.870  -2.890 -11.785
    5   HG13  VAL  97          HG12      VAL  97 -36.837  -4.507 -12.487
    6   HG12  VAL  97          HG13      VAL  97 -36.168  -3.145 -13.383
    7   HG21  VAL  97          HG21      VAL  97 -33.799  -2.936 -13.344
    8   HG23  VAL  97          HG22      VAL  97 -34.152  -4.650 -13.574
    9   HG22  VAL  97          HG23      VAL  97 -32.924  -4.150 -12.409

  No H/Q in entry =           9
  In of MODEL   62
    1    H    ALA  98           H        ALA  98 -35.369  -3.958  -8.687
    2    HA   ALA  98           HA       ALA  98 -37.992  -2.951  -8.361
    3    HB1  ALA  98           HB1      ALA  98 -36.847  -5.051  -7.261
    4    HB2  ALA  98           HB2      ALA  98 -38.076  -4.167  -6.354
    5    HB3  ALA  98           HB3      ALA  98 -36.367  -3.905  -6.010

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ALA  99           H        ALA  99 -34.960  -1.918  -6.758
    2    HA   ALA  99           HA       ALA  99 -36.198   0.051  -5.157
    3    HB1  ALA  99           HB1      ALA  99 -33.505  -0.707  -5.888
    4    HB2  ALA  99           HB2      ALA  99 -34.093   0.059  -4.412
    5    HB3  ALA  99           HB3      ALA  99 -33.681   1.046  -5.815

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ILE 100           H        ILE 100 -35.179   0.130  -8.520
    2    HA   ILE 100           HA       ILE 100 -35.523   2.953  -8.832
    3    HB   ILE 100           HB       ILE 100 -35.501   0.727 -10.898
    4   HG12  ILE 100          HG12      ILE 100 -33.454   2.863 -10.306
    5   HG13  ILE 100          HG13      ILE 100 -33.393   1.238  -9.621
    6   HG21  ILE 100          HG21      ILE 100 -36.093   3.612 -11.123
    7   HG23  ILE 100          HG22      ILE 100 -36.529   2.280 -12.194
    8   HG22  ILE 100          HG23      ILE 100 -34.915   2.987 -12.278
    9   HD12  ILE 100          HD11      ILE 100 -32.927   2.132 -12.428
   10   HD11  ILE 100          HD12      ILE 100 -33.492   0.491 -12.117
   11   HD13  ILE 100          HD13      ILE 100 -31.971   1.046 -11.421

  No H/Q in entry =          11
  In of MODEL   62
    1    H    LYS 101           H        LYS 101 -37.664   0.194  -9.460
    2    HA   LYS 101           HA       LYS 101 -39.841   1.686 -10.502
    3    HB2  LYS 101           HB2      LYS 101 -39.561  -1.038  -9.285
    4    HB3  LYS 101           HB3      LYS 101 -41.156  -0.379  -9.647
    5    HG2  LYS 101           HG2      LYS 101 -40.699  -0.293 -11.950
    6    HG3  LYS 101           HG3      LYS 101 -38.981  -0.591 -11.691
    7    HD2  LYS 101           HD2      LYS 101 -40.122  -2.596 -12.507
    8    HD3  LYS 101           HD3      LYS 101 -39.471  -2.836 -10.886
    9    HE2  LYS 101           HE2      LYS 101 -41.488  -3.632 -10.346
   10    HE3  LYS 101           HE3      LYS 101 -42.042  -1.958 -10.402
   11    HZ3  LYS 101           HZ1      LYS 101 -42.932  -2.235 -12.509
   12    HZ2  LYS 101           HZ2      LYS 101 -43.305  -3.709 -11.751
   13    HZ1  LYS 101           HZ3      LYS 101 -42.007  -3.621 -12.842

  No H/Q in entry =          13
  In of MODEL   62
    1    H    LYS 102           H        LYS 102 -39.254   0.345  -7.250
    2    HA   LYS 102           HA       LYS 102 -41.563   1.448  -6.079
    3    HB2  LYS 102           HB2      LYS 102 -40.217  -0.310  -5.011
    4    HB3  LYS 102           HB3      LYS 102 -38.889   0.831  -4.809
    5    HG2  LYS 102           HG2      LYS 102 -40.279   2.196  -3.351
    6    HG3  LYS 102           HG3      LYS 102 -41.610   1.059  -3.555
    7    HD2  LYS 102           HD2      LYS 102 -40.275  -0.699  -2.476
    8    HD3  LYS 102           HD3      LYS 102 -38.944   0.440  -2.269
    9    HE2  LYS 102           HE2      LYS 102 -40.376   1.882  -0.903
   10    HE3  LYS 102           HE3      LYS 102 -41.727   0.773  -1.130
   11    HZ1  LYS 102           HZ1      LYS 102 -39.905  -0.846  -0.079
   12    HZ3  LYS 102           HZ2      LYS 102 -41.061   0.004   0.827
   13    HZ2  LYS 102           HZ3      LYS 102 -39.484   0.615   0.675

  No H/Q in entry =          13
  In of MODEL   62
    1    H    ALA 103           H        ALA 103 -38.697   2.974  -7.152
    2    HA   ALA 103           HA       ALA 103 -39.047   5.329  -5.444
    3    HB2  ALA 103           HB1      ALA 103 -37.107   6.124  -7.053
    4    HB3  ALA 103           HB2      ALA 103 -36.973   4.399  -7.396
    5    HB1  ALA 103           HB3      ALA 103 -36.772   4.989  -5.747

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ALA 104           H        ALA 104 -39.636   4.455  -8.762
    2    HA   ALA 104           HA       ALA 104 -40.383   7.179  -9.471
    3    HB2  ALA 104           HB1      ALA 104 -40.394   6.439 -11.650
    4    HB1  ALA 104           HB2      ALA 104 -41.029   4.850 -11.218
    5    HB3  ALA 104           HB3      ALA 104 -39.324   5.221 -10.956

  No H/Q in entry =           5
  In of MODEL   62
    1    H    ALA 105           H        ALA 105 -41.862   5.045  -7.591
    2    HA   ALA 105           HA       ALA 105 -44.362   6.297  -7.597
    3    HB2  ALA 105           HB1      ALA 105 -45.062   5.329  -9.602
    4    HB3  ALA 105           HB2      ALA 105 -45.625   4.144  -8.425
    5    HB1  ALA 105           HB3      ALA 105 -44.141   3.851  -9.330

  No H/Q in entry =           5
  In of MODEL   63
    1    H1   ALA   1           H3       ALA   1 -12.318 -15.718  -2.127
    2    H2   ALA   1           H2       ALA   1 -11.389 -16.856  -2.987
    3    H3   ALA   1           H1       ALA   1 -12.546 -15.909  -3.799
    4    HA   ALA   1           HA       ALA   1 -13.940 -17.611  -3.544
    5    HB3  ALA   1           HB1      ALA   1 -12.537 -19.383  -3.111
    6    HB1  ALA   1           HB2      ALA   1 -13.268 -19.277  -1.510
    7    HB2  ALA   1           HB3      ALA   1 -11.697 -18.535  -1.812

  No H/Q in entry =           7
  In of MODEL   63
    1    H    GLU   2           H        GLU   2 -15.537 -18.472  -1.868
    2    HA   GLU   2           HA       GLU   2 -17.169 -16.756  -0.778
    3    HB2  GLU   2           HB2      GLU   2 -16.206 -19.188   0.743
    4    HB3  GLU   2           HB3      GLU   2 -17.726 -18.339   1.024
    5    HG2  GLU   2           HG2      GLU   2 -18.732 -19.419  -0.699
    6    HG3  GLU   2           HG3      GLU   2 -17.426 -19.013  -1.803

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLU   3           H        GLU   3 -15.216 -18.119   1.810
    2    HA   GLU   3           HA       GLU   3 -15.415 -15.772   3.380
    3    HB2  GLU   3           HB2      GLU   3 -13.825 -18.319   3.596
    4    HB3  GLU   3           HB3      GLU   3 -13.576 -17.004   4.745
    5    HG2  GLU   3           HG2      GLU   3 -15.757 -17.159   5.596
    6    HG3  GLU   3           HG3      GLU   3 -16.374 -17.954   4.153

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LEU   4           H        LEU   4 -12.481 -17.244   1.938
    2    HA   LEU   4           HA       LEU   4 -10.638 -15.343   2.516
    3    HB2  LEU   4           HB2      LEU   4 -10.910 -16.630  -0.210
    4    HB3  LEU   4           HB3      LEU   4  -9.448 -15.912   0.455
    5    HG   LEU   4           HG       LEU   4 -10.924 -18.314   1.581
    6   HD13  LEU   4          HD11      LEU   4  -9.306 -19.665   0.622
    7   HD12  LEU   4          HD12      LEU   4  -8.097 -18.382   0.581
    8   HD11  LEU   4          HD13      LEU   4  -9.404 -18.399  -0.602
    9   HD23  LEU   4          HD21      LEU   4  -8.652 -18.382   2.928
   10   HD22  LEU   4          HD22      LEU   4  -9.965 -17.345   3.481
   11   HD21  LEU   4          HD23      LEU   4  -8.617 -16.652   2.581

  No H/Q in entry =          11
  In of MODEL   63
    1    H    GLU   5           H        GLU   5 -13.014 -15.126  -0.122
    2    HA   GLU   5           HA       GLU   5 -12.026 -12.638  -1.128
    3    HB2  GLU   5           HB2      GLU   5 -13.392 -14.218  -2.476
    4    HB3  GLU   5           HB3      GLU   5 -14.776 -13.862  -1.443
    5    HG2  GLU   5           HG2      GLU   5 -14.668 -11.494  -2.078
    6    HG3  GLU   5           HG3      GLU   5 -13.251 -11.815  -3.077

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLU   6           H        GLU   6 -14.719 -13.525   1.002
    2    HA   GLU   6           HA       GLU   6 -15.617 -10.850   1.426
    3    HB2  GLU   6           HB2      GLU   6 -17.038 -12.843   1.838
    4    HB3  GLU   6           HB3      GLU   6 -15.985 -13.294   3.179
    5    HG2  GLU   6           HG2      GLU   6 -16.500 -11.187   4.322
    6    HG3  GLU   6           HG3      GLU   6 -17.512 -10.683   2.970

  No H/Q in entry =           6
  In of MODEL   63
    1    H    VAL   7           H        VAL   7 -13.286 -12.967   2.954
    2    HA   VAL   7           HA       VAL   7 -12.785 -11.401   5.280
    3    HB   VAL   7           HB       VAL   7 -11.103 -13.438   3.797
    4   HG11  VAL   7          HG11      VAL   7 -10.596 -11.915   6.359
    5   HG13  VAL   7          HG12      VAL   7  -9.517 -12.124   4.981
    6   HG12  VAL   7          HG13      VAL   7  -9.854 -13.485   6.051
    7   HG21  VAL   7          HG21      VAL   7 -13.335 -14.008   5.048
    8   HG23  VAL   7          HG22      VAL   7 -12.386 -13.739   6.510
    9   HG22  VAL   7          HG23      VAL   7 -11.910 -14.995   5.369

  No H/Q in entry =           9
  In of MODEL   63
    1    H    VAL   8           H        VAL   8 -11.322 -11.503   2.047
    2    HA   VAL   8           HA       VAL   8  -9.252  -9.632   2.516
    3    HB   VAL   8           HB       VAL   8 -10.754 -10.302  -0.026
    4   HG11  VAL   8          HG11      VAL   8  -8.350  -8.552   0.511
    5   HG13  VAL   8          HG12      VAL   8  -9.796  -8.169  -0.425
    6   HG12  VAL   8          HG13      VAL   8  -8.609  -9.307  -1.063
    7   HG21  VAL   8          HG21      VAL   8  -9.055 -11.905   1.437
    8   HG23  VAL   8          HG22      VAL   8  -7.919 -11.094   0.366
    9   HG22  VAL   8          HG23      VAL   8  -9.248 -12.027  -0.312

  No H/Q in entry =           9
  In of MODEL   63
    1    H    MET   9           H        MET   9 -12.615  -9.238   1.408
    2    HA   MET   9           HA       MET   9 -12.558  -6.459   0.983
    3    HB2  MET   9           HB2      MET   9 -14.734  -8.381   1.772
    4    HB3  MET   9           HB3      MET   9 -15.054  -6.647   1.705
    5    HG2  MET   9           HG2      MET   9 -14.040  -6.708  -0.649
    6    HG3  MET   9           HG3      MET   9 -14.167  -8.464  -0.540
    7    HE3  MET   9           HE1      MET   9 -17.652  -9.425  -0.771
    8    HE2  MET   9           HE2      MET   9 -16.974  -9.214   0.840
    9    HE1  MET   9           HE3      MET   9 -15.950  -9.795  -0.470

  No H/Q in entry =           9
  In of MODEL   63
    1    H    GLY  10           H        GLY  10 -13.177  -8.362   3.913
    2    HA3  GLY  10           HA2      GLY  10 -13.699  -6.184   5.648
    3    HA2  GLY  10           HA3      GLY  10 -13.127  -7.775   6.147

  No H/Q in entry =           3
  In of MODEL   63
    1    H    LEU  11           H        LEU  11 -10.701  -7.893   4.795
    2    HA   LEU  11           HA       LEU  11  -8.975  -6.465   6.531
    3    HB2  LEU  11           HB2      LEU  11  -8.467  -7.879   3.911
    4    HB3  LEU  11           HB3      LEU  11  -7.182  -7.177   4.892
    5    HG   LEU  11           HG       LEU  11  -9.168  -9.215   5.931
    6   HD13  LEU  11          HD11      LEU  11  -7.970 -10.445   4.344
    7   HD12  LEU  11          HD12      LEU  11  -7.012 -10.689   5.804
    8   HD11  LEU  11          HD13      LEU  11  -6.490  -9.519   4.593
    9   HD22  LEU  11          HD21      LEU  11  -8.287  -8.209   7.839
   10   HD21  LEU  11          HD22      LEU  11  -6.761  -7.804   7.054
   11   HD23  LEU  11          HD23      LEU  11  -7.078  -9.462   7.562

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  12           H        ILE  12  -9.928  -5.906   3.158
    2    HA   ILE  12           HA       ILE  12  -8.245  -3.673   2.714
    3    HB   ILE  12           HB       ILE  12 -10.918  -4.341   1.456
    4   HG12  ILE  12          HG12      ILE  12  -8.875  -5.987   1.346
    5   HG13  ILE  12          HG13      ILE  12  -9.768  -5.634  -0.119
    6   HG21  ILE  12          HG21      ILE  12  -8.706  -2.443   0.606
    7   HG23  ILE  12          HG22      ILE  12 -10.366  -2.016   1.000
    8   HG22  ILE  12          HG23      ILE  12 -10.010  -2.956  -0.421
    9   HD12  ILE  12          HD11      ILE  12  -7.269  -5.572  -0.379
   10   HD11  ILE  12          HD12      ILE  12  -7.237  -4.209   0.737
   11   HD13  ILE  12          HD13      ILE  12  -8.053  -4.061  -0.802

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  13           H        ILE  13 -11.589  -3.948   3.857
    2    HA   ILE  13           HA       ILE  13 -12.048  -1.162   4.144
    3    HB   ILE  13           HB       ILE  13 -13.229  -3.592   5.510
    4   HG12  ILE  13          HG12      ILE  13 -13.503  -3.060   2.988
    5   HG13  ILE  13          HG13      ILE  13 -14.929  -3.470   3.917
    6   HG22  ILE  13          HG21      ILE  13 -15.135  -1.819   5.982
    7   HG21  ILE  13          HG22      ILE  13 -13.807  -0.667   5.920
    8   HG23  ILE  13          HG23      ILE  13 -13.782  -1.978   7.098
    9   HD13  ILE  13          HD11      ILE  13 -15.812  -1.360   3.759
   10   HD12  ILE  13          HD12      ILE  13 -14.789  -1.306   2.337
   11   HD11  ILE  13          HD13      ILE  13 -14.220  -0.597   3.831

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ASN  14           H        ASN  14 -10.899  -3.660   6.392
    2    HA   ASN  14           HA       ASN  14 -10.667  -2.030   8.681
    3    HB2  ASN  14           HB2      ASN  14 -10.415  -4.636   8.345
    4    HB3  ASN  14           HB3      ASN  14  -8.709  -4.245   8.164
    5   HD21  ASN  14          HD21      ASN  14  -9.310  -5.779  10.344
    6   HD22  ASN  14          HD22      ASN  14  -9.263  -4.864  11.771

  No H/Q in entry =           6
  In of MODEL   63
    1    H    SER  15           H        SER  15  -8.301  -2.840   6.150
    2    HA   SER  15           HA       SER  15  -6.144  -1.347   7.196
    3    HB2  SER  15           HB2      SER  15  -5.154  -1.556   5.025
    4    HB3  SER  15           HB3      SER  15  -6.109  -3.016   5.253
    5    HG   SER  15           HG       SER  15  -7.018  -2.424   3.457

  No H/Q in entry =           5
  In of MODEL   63
    1    H    GLY  16           H        GLY  16  -8.781  -0.477   4.991
    2    HA3  GLY  16           HA2      GLY  16  -7.937   2.167   4.436
    3    HA2  GLY  16           HA3      GLY  16  -9.588   1.569   4.297

  No H/Q in entry =           3
  In of MODEL   63
    1    H    GLN  17           H        GLN  17 -10.090   0.833   6.952
    2    HA   GLN  17           HA       GLN  17 -10.786   3.332   8.112
    3    HB2  GLN  17           HB2      GLN  17 -11.999   1.232   8.604
    4    HB3  GLN  17           HB3      GLN  17 -10.581   0.626   9.459
    5    HG2  GLN  17           HG2      GLN  17 -10.714   2.537  11.024
    6    HG3  GLN  17           HG3      GLN  17 -12.146   3.121  10.178
    7   HE21  GLN  17          HE21      GLN  17 -14.061   2.489  11.164
    8   HE22  GLN  17          HE22      GLN  17 -14.267   1.071  12.075

  No H/Q in entry =           8
  In of MODEL   63
    1    H    ALA  18           H        ALA  18  -8.143   1.056   8.684
    2    HA   ALA  18           HA       ALA  18  -7.015   2.266  10.942
    3    HB2  ALA  18           HB1      ALA  18  -6.419   0.057   9.558
    4    HB3  ALA  18           HB2      ALA  18  -5.243   0.840  10.614
    5    HB1  ALA  18           HB3      ALA  18  -5.192   1.125   8.874

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ARG  19           H        ARG  19  -6.296   2.805   7.485
    2    HA   ARG  19           HA       ARG  19  -4.398   4.856   7.893
    3    HB2  ARG  19           HB2      ARG  19  -4.754   3.722   5.698
    4    HB3  ARG  19           HB3      ARG  19  -6.302   4.559   5.547
    5    HG2  ARG  19           HG2      ARG  19  -5.179   6.734   5.607
    6    HG3  ARG  19           HG3      ARG  19  -3.624   5.952   5.885
    7    HD2  ARG  19           HD2      ARG  19  -3.785   6.551   3.546
    8    HD3  ARG  19           HD3      ARG  19  -3.862   4.790   3.687
    9    HE   ARG  19           HE       ARG  19  -6.499   5.690   3.721
   10   HH21  ARG  19          HH11      ARG  19  -7.722   5.849   1.821
   11   HH22  ARG  19          HH12      ARG  19  -6.924   5.935   0.290
   12   HH11  ARG  19          HH21      ARG  19  -3.754   5.770   1.647
   13   HH12  ARG  19          HH22      ARG  19  -4.675   5.887   0.191

  No H/Q in entry =          13
  In of MODEL   63
    1    H    SER  20           H        SER  20  -7.905   4.961   7.345
    2    HA   SER  20           HA       SER  20  -8.273   7.716   7.311
    3    HB2  SER  20           HB2      SER  20 -10.072   6.106   6.833
    4    HB3  SER  20           HB3      SER  20 -10.092   5.627   8.529
    5    HG   SER  20           HG       SER  20 -10.659   8.186   7.436

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LEU  21           H        LEU  21  -8.224   5.524  10.107
    2    HA   LEU  21           HA       LEU  21  -8.643   7.511  12.086
    3    HB2  LEU  21           HB2      LEU  21  -7.274   4.816  12.219
    4    HB3  LEU  21           HB3      LEU  21  -7.574   5.827  13.630
    5    HG   LEU  21           HG       LEU  21  -9.759   4.920  11.731
    6   HD12  LEU  21          HD11      LEU  21 -10.332   3.294  13.549
    7   HD11  LEU  21          HD12      LEU  21  -8.823   3.722  14.354
    8   HD13  LEU  21          HD13      LEU  21  -8.788   2.950  12.768
    9   HD22  LEU  21          HD21      LEU  21 -10.681   6.716  12.898
   10   HD21  LEU  21          HD22      LEU  21  -9.682   6.456  14.324
   11   HD23  LEU  21          HD23      LEU  21 -11.056   5.408  14.016

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ALA  22           H        ALA  22  -5.706   6.155  10.630
    2    HA   ALA  22           HA       ALA  22  -3.808   7.470  12.229
    3    HB2  ALA  22           HB1      ALA  22  -3.409   5.624  10.526
    4    HB1  ALA  22           HB2      ALA  22  -2.218   6.925  10.548
    5    HB3  ALA  22           HB3      ALA  22  -3.454   6.880   9.290

  No H/Q in entry =           5
  In of MODEL   63
    1    H    TYR  23           H        TYR  23  -5.176   8.492   9.070
    2    HA   TYR  23           HA       TYR  23  -3.851  10.994   8.989
    3    HB2  TYR  23           HB2      TYR  23  -4.955  10.087   7.009
    4    HB3  TYR  23           HB3      TYR  23  -6.523  10.180   7.814
    5    HD1  TYR  23           HD1      TYR  23  -3.642  12.262   6.669
    6    HD2  TYR  23           HD2      TYR  23  -7.788  12.168   7.784
    7    HE1  TYR  23           HE1      TYR  23  -3.894  14.614   5.924
    8    HE2  TYR  23           HE2      TYR  23  -8.042  14.519   7.037
    9    HH   TYR  23           HH       TYR  23  -5.342  16.266   5.518

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ALA  24           H        ALA  24  -6.946   9.999  10.410
    2    HA   ALA  24           HA       ALA  24  -7.783  12.582  11.202
    3    HB1  ALA  24           HB1      ALA  24  -9.589  11.322  11.691
    4    HB2  ALA  24           HB2      ALA  24  -8.740  10.749  13.125
    5    HB3  ALA  24           HB3      ALA  24  -8.632   9.843  11.617

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ALA  25           H        ALA  25  -5.748  10.128  12.738
    2    HA   ALA  25           HA       ALA  25  -5.379  11.373  15.240
    3    HB2  ALA  25           HB1      ALA  25  -4.614   9.027  14.400
    4    HB3  ALA  25           HB2      ALA  25  -3.586   9.886  15.549
    5    HB1  ALA  25           HB3      ALA  25  -3.174   9.876  13.833

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LEU  26           H        LEU  26  -3.634  11.690  12.175
    2    HA   LEU  26           HA       LEU  26  -1.670  13.515  13.069
    3    HB2  LEU  26           HB2      LEU  26  -1.394  12.372  10.957
    4    HB3  LEU  26           HB3      LEU  26  -2.879  13.076  10.326
    5    HG   LEU  26           HG       LEU  26  -1.872  15.330  10.455
    6   HD12  LEU  26          HD11      LEU  26   0.672  15.359  10.832
    7   HD11  LEU  26          HD12      LEU  26   0.466  13.775  11.574
    8   HD13  LEU  26          HD13      LEU  26  -0.338  15.184  12.267
    9   HD21  LEU  26          HD21      LEU  26  -0.141  13.287   9.028
   10   HD23  LEU  26          HD22      LEU  26  -0.197  15.010   8.664
   11   HD22  LEU  26          HD23      LEU  26  -1.620  14.007   8.393

  No H/Q in entry =          11
  In of MODEL   63
    1    H    LYS  27           H        LYS  27  -4.875  13.990  11.639
    2    HA   LYS  27           HA       LYS  27  -4.833  16.779  11.450
    3    HB2  LYS  27           HB2      LYS  27  -6.586  15.298  10.484
    4    HB3  LYS  27           HB3      LYS  27  -7.218  15.034  12.109
    5    HG2  LYS  27           HG2      LYS  27  -7.653  17.437  12.359
    6    HG3  LYS  27           HG3      LYS  27  -6.969  17.742  10.760
    7    HD2  LYS  27           HD2      LYS  27  -8.711  16.305   9.743
    8    HD3  LYS  27           HD3      LYS  27  -9.401  16.017  11.342
    9    HE2  LYS  27           HE2      LYS  27  -9.849  18.426  11.600
   10    HE3  LYS  27           HE3      LYS  27  -9.131  18.735  10.016
   11    HZ3  LYS  27           HZ1      LYS  27 -11.511  18.602   9.808
   12    HZ2  LYS  27           HZ2      LYS  27 -11.543  17.083  10.573
   13    HZ1  LYS  27           HZ3      LYS  27 -10.820  17.254   9.042

  No H/Q in entry =          13
  In of MODEL   63
    1    H    GLN  28           H        GLN  28  -5.675  14.681  14.182
    2    HA   GLN  28           HA       GLN  28  -6.552  16.675  15.978
    3    HB2  GLN  28           HB2      GLN  28  -5.131  14.048  16.493
    4    HB3  GLN  28           HB3      GLN  28  -5.862  15.045  17.753
    5    HG2  GLN  28           HG2      GLN  28  -7.355  13.946  15.355
    6    HG3  GLN  28           HG3      GLN  28  -7.372  13.217  16.960
    7   HE21  GLN  28          HE21      GLN  28  -9.277  15.081  15.063
    8   HE22  GLN  28          HE22      GLN  28 -10.022  16.050  16.241

  No H/Q in entry =           8
  In of MODEL   63
    1    H    ALA  29           H        ALA  29  -3.339  15.391  15.238
    2    HA   ALA  29           HA       ALA  29  -1.876  16.786  17.200
    3    HB1  ALA  29           HB1      ALA  29   0.040  16.105  16.050
    4    HB3  ALA  29           HB2      ALA  29  -0.738  16.232  14.473
    5    HB2  ALA  29           HB3      ALA  29  -1.141  14.895  15.549

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LYS  30           H        LYS  30  -2.785  17.675  13.886
    2    HA   LYS  30           HA       LYS  30  -1.380  20.118  13.774
    3    HB2  LYS  30           HB2      LYS  30  -3.930  19.245  12.399
    4    HB3  LYS  30           HB3      LYS  30  -3.103  20.762  12.048
    5    HG2  LYS  30           HG2      LYS  30  -1.040  19.474  11.500
    6    HG3  LYS  30           HG3      LYS  30  -1.941  17.976  11.753
    7    HD2  LYS  30           HD2      LYS  30  -3.531  18.621   9.984
    8    HD3  LYS  30           HD3      LYS  30  -2.653  20.131   9.733
    9    HE2  LYS  30           HE2      LYS  30  -0.629  18.842   9.119
   10    HE3  LYS  30           HE3      LYS  30  -1.526  17.337   9.339
   11    HZ2  LYS  30           HZ1      LYS  30  -1.385  18.217   6.998
   12    HZ1  LYS  30           HZ2      LYS  30  -2.423  19.477   7.486
   13    HZ3  LYS  30           HZ3      LYS  30  -2.945  17.859   7.559

  No H/Q in entry =          13
  In of MODEL   63
    1    H    GLN  31           H        GLN  31  -4.459  19.259  15.229
    2    HA   GLN  31           HA       GLN  31  -5.216  22.014  15.702
    3    HB2  GLN  31           HB2      GLN  31  -6.375  19.562  17.033
    4    HB3  GLN  31           HB3      GLN  31  -7.139  21.135  16.804
    5    HG2  GLN  31           HG2      GLN  31  -6.467  20.367  14.201
    6    HG3  GLN  31           HG3      GLN  31  -6.980  18.860  14.951
    7   HE21  GLN  31          HE21      GLN  31  -8.421  20.442  12.876
    8   HE22  GLN  31          HE22      GLN  31  -9.925  20.831  13.558

  No H/Q in entry =           8
  In of MODEL   63
    1    H    GLY  32           H        GLY  32  -2.885  20.081  16.980
    2    HA3  GLY  32           HA2      GLY  32  -1.457  20.536  18.763
    3    HA2  GLY  32           HA3      GLY  32  -2.578  21.777  19.308

  No H/Q in entry =           3
  In of MODEL   63
    1    H    ASP  33           H        ASP  33  -4.011  18.741  18.656
    2    HA   ASP  33           HA       ASP  33  -4.379  18.272  21.540
    3    HB2  ASP  33           HB2      ASP  33  -5.823  17.271  19.080
    4    HB3  ASP  33           HB3      ASP  33  -6.144  16.655  20.699

  No H/Q in entry =           4
  In of MODEL   63
    1    H    PHE  34           H        PHE  34  -2.207  17.419  21.810
    2    HA   PHE  34           HA       PHE  34  -1.229  15.175  20.385
    3    HB2  PHE  34           HB2      PHE  34  -0.570  16.148  23.174
    4    HB3  PHE  34           HB3      PHE  34   0.345  14.928  22.288
    5    HD1  PHE  34           HD1      PHE  34   0.186  18.351  23.039
    6    HD2  PHE  34           HD2      PHE  34   0.966  15.660  19.782
    7    HE1  PHE  34           HE1      PHE  34   1.465  20.126  21.873
    8    HE2  PHE  34           HE2      PHE  34   2.240  17.439  18.620
    9    HZ   PHE  34           HZ       PHE  34   2.492  19.669  19.670

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ALA  35           H        ALA  35  -3.225  15.442  23.280
    2    HA   ALA  35           HA       ALA  35  -3.002  12.776  24.162
    3    HB3  ALA  35           HB1      ALA  35  -5.446  13.401  25.059
    4    HB1  ALA  35           HB2      ALA  35  -4.918  15.020  24.601
    5    HB2  ALA  35           HB3      ALA  35  -3.987  14.091  25.775

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ALA  36           H        ALA  36  -5.482  14.303  22.105
    2    HA   ALA  36           HA       ALA  36  -6.906  11.894  21.640
    3    HB1  ALA  36           HB1      ALA  36  -8.375  13.322  20.711
    4    HB3  ALA  36           HB2      ALA  36  -7.221  13.746  19.446
    5    HB2  ALA  36           HB3      ALA  36  -7.222  14.628  20.974

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ALA  37           H        ALA  37  -4.250  13.487  19.937
    2    HA   ALA  37           HA       ALA  37  -4.250  11.861  17.633
    3    HB3  ALA  37           HB1      ALA  37  -2.235  13.565  19.033
    4    HB2  ALA  37           HB2      ALA  37  -2.791  13.628  17.361
    5    HB1  ALA  37           HB3      ALA  37  -1.631  12.395  17.860

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LYS  38           H        LYS  38  -2.447  11.541  20.683
    2    HA   LYS  38           HA       LYS  38  -1.131   9.142  20.165
    3    HB2  LYS  38           HB2      LYS  38  -1.421  10.896  22.322
    4    HB3  LYS  38           HB3      LYS  38  -2.031   9.365  22.941
    5    HG2  LYS  38           HG2      LYS  38   0.054   8.245  22.369
    6    HG3  LYS  38           HG3      LYS  38   0.651   9.693  21.552
    7    HD2  LYS  38           HD2      LYS  38   0.852  10.903  23.589
    8    HD3  LYS  38           HD3      LYS  38  -0.155   9.750  24.467
    9    HE2  LYS  38           HE2      LYS  38   2.209   9.430  25.049
   10    HE3  LYS  38           HE3      LYS  38   1.591   8.018  24.188
   11    HZ3  LYS  38           HZ1      LYS  38   2.865   8.443  22.390
   12    HZ2  LYS  38           HZ2      LYS  38   3.838   9.266  23.515
   13    HZ1  LYS  38           HZ3      LYS  38   2.744  10.131  22.543

  No H/Q in entry =          13
  In of MODEL   63
    1    H    ALA  39           H        ALA  39  -4.348   9.633  21.618
    2    HA   ALA  39           HA       ALA  39  -4.902   6.912  22.119
    3    HB3  ALA  39           HB1      ALA  39  -7.071   8.861  21.393
    4    HB2  ALA  39           HB2      ALA  39  -6.150   9.081  22.881
    5    HB1  ALA  39           HB3      ALA  39  -7.072   7.599  22.625

  No H/Q in entry =           5
  In of MODEL   63
    1    H    MET  40           H        MET  40  -5.529   8.937  19.290
    2    HA   MET  40           HA       MET  40  -7.027   7.012  17.844
    3    HB2  MET  40           HB2      MET  40  -5.430   9.410  16.925
    4    HB3  MET  40           HB3      MET  40  -6.473   8.456  15.867
    5    HG2  MET  40           HG2      MET  40  -7.468   9.695  18.445
    6    HG3  MET  40           HG3      MET  40  -7.548  10.536  16.899
    7    HE3  MET  40           HE1      MET  40 -10.163   8.926  14.867
    8    HE2  MET  40           HE2      MET  40  -8.413   9.043  14.693
    9    HE1  MET  40           HE3      MET  40  -9.321  10.406  15.346

  No H/Q in entry =           9
  In of MODEL   63
    1    H    MET  41           H        MET  41  -3.535   7.748  17.917
    2    HA   MET  41           HA       MET  41  -2.808   6.002  15.799
    3    HB2  MET  41           HB2      MET  41  -1.155   6.658  18.250
    4    HB3  MET  41           HB3      MET  41  -0.560   6.016  16.723
    5    HG2  MET  41           HG2      MET  41  -1.731   8.203  15.745
    6    HG3  MET  41           HG3      MET  41  -1.470   8.784  17.388
    7    HE2  MET  41           HE1      MET  41   1.453   6.684  17.697
    8    HE1  MET  41           HE2      MET  41   0.678   7.974  18.613
    9    HE3  MET  41           HE3      MET  41   2.291   8.220  17.947

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ASP  42           H        ASP  42  -3.141   5.514  19.288
    2    HA   ASP  42           HA       ASP  42  -2.103   2.920  19.422
    3    HB2  ASP  42           HB2      ASP  42  -2.949   4.672  21.265
    4    HB3  ASP  42           HB3      ASP  42  -4.377   3.646  21.209

  No H/Q in entry =           4
  In of MODEL   63
    1    H    GLN  43           H        GLN  43  -5.444   4.025  18.976
    2    HA   GLN  43           HA       GLN  43  -6.589   1.438  18.787
    3    HB2  GLN  43           HB2      GLN  43  -7.530   4.095  17.683
    4    HB3  GLN  43           HB3      GLN  43  -8.493   2.616  17.669
    5    HG2  GLN  43           HG2      GLN  43  -8.162   2.484  20.172
    6    HG3  GLN  43           HG3      GLN  43  -7.439   4.090  20.096
    7   HE21  GLN  43          HE21      GLN  43  -9.596   4.163  21.629
    8   HE22  GLN  43          HE22      GLN  43 -10.969   4.741  20.820

  No H/Q in entry =           8
  In of MODEL   63
    1    H    SER  44           H        SER  44  -5.286   3.663  16.365
    2    HA   SER  44           HA       SER  44  -6.020   2.188  14.080
    3    HB2  SER  44           HB2      SER  44  -4.758   4.570  14.516
    4    HB3  SER  44           HB3      SER  44  -3.412   3.576  13.961
    5    HG   SER  44           HG       SER  44  -4.550   4.556  12.219

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ARG  45           H        ARG  45  -3.112   2.067  16.118
    2    HA   ARG  45           HA       ARG  45  -1.652   0.119  14.705
    3    HB2  ARG  45           HB2      ARG  45  -0.783   1.532  16.568
    4    HB3  ARG  45           HB3      ARG  45  -1.758   0.597  17.698
    5    HG2  ARG  45           HG2      ARG  45  -0.536  -1.459  17.029
    6    HG3  ARG  45           HG3      ARG  45   0.464  -0.499  15.940
    7    HD2  ARG  45           HD2      ARG  45   1.227   0.874  17.890
    8    HD3  ARG  45           HD3      ARG  45   0.321  -0.206  18.973
    9    HE   ARG  45           HE       ARG  45   1.997  -1.795  17.361
   10   HH21  ARG  45          HH11      ARG  45   3.909  -2.621  18.166
   11   HH22  ARG  45          HH12      ARG  45   4.702  -1.840  19.489
   12   HH11  ARG  45          HH21      ARG  45   2.335   0.662  19.756
   13   HH12  ARG  45          HH22      ARG  45   3.810   0.021  20.387

  No H/Q in entry =          13
  In of MODEL   63
    1    H    MET  46           H        MET  46  -4.011  -0.213  17.339
    2    HA   MET  46           HA       MET  46  -3.839  -3.014  17.631
    3    HB2  MET  46           HB2      MET  46  -6.000  -1.011  18.272
    4    HB3  MET  46           HB3      MET  46  -6.200  -2.732  18.609
    5    HG2  MET  46           HG2      MET  46  -4.146  -2.714  19.968
    6    HG3  MET  46           HG3      MET  46  -3.924  -1.005  19.626
    7    HE1  MET  46           HE1      MET  46  -3.709  -0.345  21.899
    8    HE3  MET  46           HE2      MET  46  -4.003  -1.875  22.718
    9    HE2  MET  46           HE3      MET  46  -4.901  -0.441  23.200

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ALA  47           H        ALA  47  -5.889  -0.988  15.575
    2    HA   ALA  47           HA       ALA  47  -7.523  -3.033  14.524
    3    HB3  ALA  47           HB1      ALA  47  -8.208  -0.794  14.128
    4    HB1  ALA  47           HB2      ALA  47  -7.742  -1.421  12.547
    5    HB2  ALA  47           HB3      ALA  47  -6.649  -0.356  13.433

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LEU  48           H        LEU  48  -4.419  -1.722  13.434
    2    HA   LEU  48           HA       LEU  48  -4.173  -3.302  11.082
    3    HB2  LEU  48           HB2      LEU  48  -2.089  -2.033  12.866
    4    HB3  LEU  48           HB3      LEU  48  -1.744  -2.747  11.290
    5    HG   LEU  48           HG       LEU  48  -3.759  -0.529  11.719
    6   HD13  LEU  48          HD11      LEU  48  -1.627   0.342  12.358
    7   HD12  LEU  48          HD12      LEU  48  -1.925   0.903  10.712
    8   HD11  LEU  48          HD13      LEU  48  -0.825  -0.446  10.999
    9   HD22  LEU  48          HD21      LEU  48  -4.261  -1.504   9.646
   10   HD21  LEU  48          HD22      LEU  48  -2.584  -1.940   9.324
   11   HD23  LEU  48          HD23      LEU  48  -3.103  -0.259   9.180

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ASN  49           H        ASN  49  -3.080  -3.715  14.411
    2    HA   ASN  49           HA       ASN  49  -1.485  -5.978  14.047
    3    HB2  ASN  49           HB2      ASN  49  -1.496  -4.638  16.101
    4    HB3  ASN  49           HB3      ASN  49  -3.138  -5.155  16.451
    5   HD21  ASN  49          HD21      ASN  49  -2.453  -6.167  18.460
    6   HD22  ASN  49          HD22      ASN  49  -1.575  -7.619  18.457

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLU  50           H        GLU  50  -4.943  -5.701  14.770
    2    HA   GLU  50           HA       GLU  50  -5.459  -8.500  14.873
    3    HB2  GLU  50           HB2      GLU  50  -7.029  -6.814  15.780
    4    HB3  GLU  50           HB3      GLU  50  -7.345  -6.241  14.140
    5    HG2  GLU  50           HG2      GLU  50  -8.223  -8.433  13.505
    6    HG3  GLU  50           HG3      GLU  50  -7.820  -9.085  15.090

  No H/Q in entry =           6
  In of MODEL   63
    1    H    ALA  51           H        ALA  51  -5.560  -6.090  12.289
    2    HA   ALA  51           HA       ALA  51  -6.578  -7.806  10.274
    3    HB2  ALA  51           HB1      ALA  51  -6.374  -5.988   8.910
    4    HB1  ALA  51           HB2      ALA  51  -4.726  -5.645   9.436
    5    HB3  ALA  51           HB3      ALA  51  -6.094  -5.135  10.427

  No H/Q in entry =           5
  In of MODEL   63
    1    H    HIS  52           H        HIS  52  -3.271  -6.911  11.214
    2    HA   HIS  52           HA       HIS  52  -1.904  -8.395   9.238
    3    HB2  HIS  52           HB2      HIS  52  -0.810  -6.686  10.627
    4    HB3  HIS  52           HB3      HIS  52  -1.027  -7.699  12.053
    5    HD1  HIS  52           HD1      HIS  52   0.153 -10.168  11.852
    6    HD2  HIS  52           HD2      HIS  52   1.529  -7.220   9.244
    7    HE1  HIS  52           HE1      HIS  52   2.399 -10.963  10.991
    8    HE2  HIS  52           HE2      HIS  52   3.251  -9.178   9.400

  No H/Q in entry =           8
  In of MODEL   63
    1    H    LEU  53           H        LEU  53  -3.072  -9.284  12.464
    2    HA   LEU  53           HA       LEU  53  -1.879 -11.832  12.629
    3    HB2  LEU  53           HB2      LEU  53  -4.345 -10.652  13.884
    4    HB3  LEU  53           HB3      LEU  53  -3.882 -12.328  14.163
    5    HG   LEU  53           HG       LEU  53  -1.965 -10.020  14.614
    6   HD11  LEU  53          HD11      LEU  53  -3.987 -11.284  16.469
    7   HD13  LEU  53          HD12      LEU  53  -3.736  -9.571  16.130
    8   HD12  LEU  53          HD13      LEU  53  -2.551 -10.465  17.076
    9   HD23  LEU  53          HD21      LEU  53  -1.086 -11.832  16.298
   10   HD22  LEU  53          HD22      LEU  53  -0.701 -12.002  14.588
   11   HD21  LEU  53          HD23      LEU  53  -1.985 -12.966  15.295

  No H/Q in entry =          11
  In of MODEL   63
    1    H    VAL  54           H        VAL  54  -5.006 -10.787  11.316
    2    HA   VAL  54           HA       VAL  54  -5.938 -13.375  10.630
    3    HB   VAL  54           HB       VAL  54  -6.592 -10.635   9.518
    4   HG12  VAL  54          HG11      VAL  54  -8.710 -12.002   8.730
    5   HG11  VAL  54          HG12      VAL  54  -7.602 -13.372   8.780
    6   HG13  VAL  54          HG13      VAL  54  -7.253 -11.994   7.739
    7   HG22  VAL  54          HG21      VAL  54  -7.468 -10.680  11.682
    8   HG21  VAL  54          HG22      VAL  54  -7.729 -12.422  11.658
    9   HG23  VAL  54          HG23      VAL  54  -8.819 -11.357  10.772

  No H/Q in entry =           9
  In of MODEL   63
    1    H    GLN  55           H        GLN  55  -4.084 -10.922   8.826
    2    HA   GLN  55           HA       GLN  55  -3.993 -12.376   6.400
    3    HB2  GLN  55           HB2      GLN  55  -3.384 -10.113   6.212
    4    HB3  GLN  55           HB3      GLN  55  -2.254 -10.199   7.560
    5    HG2  GLN  55           HG2      GLN  55  -0.559 -11.046   6.256
    6    HG3  GLN  55           HG3      GLN  55  -1.650 -12.012   5.273
    7   HE21  GLN  55          HE21      GLN  55  -1.694 -11.312   3.155
    8   HE22  GLN  55          HE22      GLN  55  -1.498  -9.706   2.650

  No H/Q in entry =           8
  In of MODEL   63
    1    H    THR  56           H        THR  56  -1.847 -12.376   9.250
    2    HA   THR  56           HA       THR  56   0.212 -13.978   8.296
    3    HB   THR  56           HB       THR  56  -1.047 -14.008  11.052
    4    HG1  THR  56           HG1      THR  56   1.262 -12.690  10.078
    5   HG22  THR  56          HG21      THR  56   1.414 -14.737  11.590
    6   HG21  THR  56          HG22      THR  56   1.425 -15.269   9.907
    7   HG23  THR  56          HG23      THR  56   0.253 -15.945  11.039

  No H/Q in entry =           7
  In of MODEL   63
    1    H    LYS  57           H        LYS  57  -2.892 -15.008   9.699
    2    HA   LYS  57           HA       LYS  57  -2.461 -17.805   9.434
    3    HB2  LYS  57           HB2      LYS  57  -4.247 -16.813  10.830
    4    HB3  LYS  57           HB3      LYS  57  -5.029 -16.186   9.388
    5    HG2  LYS  57           HG2      LYS  57  -6.182 -18.201  10.021
    6    HG3  LYS  57           HG3      LYS  57  -5.256 -18.555   8.565
    7    HD2  LYS  57           HD2      LYS  57  -3.570 -19.719   9.805
    8    HD3  LYS  57           HD3      LYS  57  -4.196 -19.128  11.345
    9    HE2  LYS  57           HE2      LYS  57  -4.952 -21.405  11.119
   10    HE3  LYS  57           HE3      LYS  57  -6.359 -20.388  10.819
   11    HZ1  LYS  57           HZ1      LYS  57  -4.829 -20.906   8.453
   12    HZ3  LYS  57           HZ2      LYS  57  -6.495 -21.086   8.732
   13    HZ2  LYS  57           HZ3      LYS  57  -5.421 -22.326   9.172

  No H/Q in entry =          13
  In of MODEL   63
    1    H    LEU  58           H        LEU  58  -3.813 -15.347   7.289
    2    HA   LEU  58           HA       LEU  58  -4.652 -17.160   5.286
    3    HB2  LEU  58           HB2      LEU  58  -4.035 -14.213   5.155
    4    HB3  LEU  58           HB3      LEU  58  -4.721 -15.141   3.820
    5    HG   LEU  58           HG       LEU  58  -5.961 -14.969   6.587
    6   HD11  LEU  58          HD11      LEU  58  -6.289 -13.309   4.107
    7   HD13  LEU  58          HD12      LEU  58  -6.253 -12.809   5.798
    8   HD12  LEU  58          HD13      LEU  58  -7.689 -13.594   5.143
    9   HD22  LEU  58          HD21      LEU  58  -6.944 -16.870   5.722
   10   HD21  LEU  58          HD22      LEU  58  -6.626 -16.412   4.049
   11   HD23  LEU  58          HD23      LEU  58  -7.974 -15.684   4.922

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  59           H        ILE  59  -1.499 -15.966   6.108
    2    HA   ILE  59           HA       ILE  59  -0.442 -16.686   3.453
    3    HB   ILE  59           HB       ILE  59   0.358 -14.629   5.008
    4   HG12  ILE  59          HG12      ILE  59   2.438 -16.292   3.576
    5   HG13  ILE  59          HG13      ILE  59   1.236 -15.365   2.718
    6   HG21  ILE  59          HG21      ILE  59   1.111 -16.436   6.753
    7   HG23  ILE  59          HG22      ILE  59   2.182 -15.095   6.416
    8   HG22  ILE  59          HG23      ILE  59   2.469 -16.672   5.679
    9   HD12  ILE  59          HD11      ILE  59   3.271 -14.287   4.665
   10   HD11  ILE  59          HD12      ILE  59   1.978 -13.320   3.959
   11   HD13  ILE  59          HD13      ILE  59   3.234 -14.006   2.925

  No H/Q in entry =          11
  In of MODEL   63
    1    H    GLU  60           H        GLU  60  -0.410 -17.807   6.816
    2    HA   GLU  60           HA       GLU  60   1.608 -19.793   6.514
    3    HB2  GLU  60           HB2      GLU  60   1.070 -20.436   8.666
    4    HB3  GLU  60           HB3      GLU  60   0.391 -18.809   8.654
    5    HG2  GLU  60           HG2      GLU  60  -1.365 -20.121   9.524
    6    HG3  GLU  60           HG3      GLU  60  -1.786 -19.964   7.820

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLY  61           H        GLY  61  -1.909 -19.874   6.077
    2    HA3  GLY  61           HA2      GLY  61  -1.687 -22.663   5.103
    3    HA2  GLY  61           HA3      GLY  61  -3.160 -21.923   5.720

  No H/Q in entry =           3
  In of MODEL   63
    1    H    ASP  62           H        ASP  62  -0.954 -20.346   3.492
    2    HA   ASP  62           HA       ASP  62  -2.980 -19.588   1.697
    3    HB2  ASP  62           HB2      ASP  62  -0.723 -18.503   2.026
    4    HB3  ASP  62           HB3      ASP  62  -0.030 -19.825   1.090

  No H/Q in entry =           4
  In of MODEL   63
    1    H    ALA  63           H        ALA  63  -0.703 -22.340   1.572
    2    HA   ALA  63           HA       ALA  63  -1.191 -23.218  -1.047
    3    HB2  ALA  63           HB1      ALA  63  -0.424 -25.383  -0.323
    4    HB1  ALA  63           HB2      ALA  63  -0.738 -24.973   1.362
    5    HB3  ALA  63           HB3      ALA  63   0.543 -24.143   0.479

  No H/Q in entry =           5
  In of MODEL   63
    1    H    GLY  64           H        GLY  64  -2.215 -25.787  -0.847
    2    HA3  GLY  64           HA2      GLY  64  -4.191 -27.002  -0.255
    3    HA2  GLY  64           HA3      GLY  64  -4.972 -25.480   0.139

  No H/Q in entry =           3
  In of MODEL   63
    1    H    GLU  65           H        GLU  65  -4.346 -24.046  -2.238
    2    HA   GLU  65           HA       GLU  65  -6.427 -25.000  -3.912
    3    HB2  GLU  65           HB2      GLU  65  -4.349 -22.859  -4.366
    4    HB3  GLU  65           HB3      GLU  65  -5.712 -23.165  -5.443
    5    HG2  GLU  65           HG2      GLU  65  -6.579 -21.505  -4.048
    6    HG3  GLU  65           HG3      GLU  65  -7.139 -22.973  -3.252

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLY  66           H        GLY  66  -2.958 -25.136  -4.125
    2    HA3  GLY  66           HA2      GLY  66  -2.928 -27.417  -5.812
    3    HA2  GLY  66           HA3      GLY  66  -2.514 -25.976  -6.719

  No H/Q in entry =           3
  In of MODEL   63
    1    H    LYS  67           H        LYS  67  -0.658 -27.748  -6.799
    2    HA   LYS  67           HA       LYS  67   1.138 -28.160  -4.765
    3    HB2  LYS  67           HB2      LYS  67   1.597 -27.915  -7.734
    4    HB3  LYS  67           HB3      LYS  67   2.819 -28.503  -6.598
    5    HG2  LYS  67           HG2      LYS  67   1.204 -30.222  -5.795
    6    HG3  LYS  67           HG3      LYS  67   0.048 -29.673  -7.006
    7    HD2  LYS  67           HD2      LYS  67   2.829 -30.618  -7.730
    8    HD3  LYS  67           HD3      LYS  67   1.443 -31.711  -7.646
    9    HE2  LYS  67           HE2      LYS  67   0.244 -30.100  -9.222
   10    HE3  LYS  67           HE3      LYS  67   1.806 -29.321  -9.466
   11    HZ2  LYS  67           HZ1      LYS  67   1.050 -32.113 -10.098
   12    HZ1  LYS  67           HZ2      LYS  67   2.664 -31.587 -10.056
   13    HZ3  LYS  67           HZ3      LYS  67   1.575 -30.908 -11.169

  No H/Q in entry =          13
  In of MODEL   63
    1    H    MET  68           H        MET  68   1.641 -25.759  -7.305
    2    HA   MET  68           HA       MET  68   3.419 -24.217  -5.539
    3    HB2  MET  68           HB2      MET  68   3.170 -24.344  -8.541
    4    HB3  MET  68           HB3      MET  68   4.218 -23.210  -7.689
    5    HG2  MET  68           HG2      MET  68   4.336 -26.221  -7.359
    6    HG3  MET  68           HG3      MET  68   5.407 -25.294  -8.411
    7    HE1  MET  68           HE1      MET  68   6.480 -27.169  -6.511
    8    HE3  MET  68           HE2      MET  68   5.376 -27.028  -5.144
    9    HE2  MET  68           HE3      MET  68   7.076 -26.610  -4.943

  No H/Q in entry =           9
  In of MODEL   63
    1    H    LYS  69           H        LYS  69   0.273 -24.092  -6.701
    2    HA   LYS  69           HA       LYS  69   0.153 -21.253  -7.158
    3    HB2  LYS  69           HB2      LYS  69  -2.002 -23.343  -7.074
    4    HB3  LYS  69           HB3      LYS  69  -2.301 -21.632  -7.403
    5    HG2  LYS  69           HG2      LYS  69  -0.734 -21.700  -9.291
    6    HG3  LYS  69           HG3      LYS  69  -0.391 -23.398  -8.961
    7    HD2  LYS  69           HD2      LYS  69  -2.794 -23.926  -9.341
    8    HD3  LYS  69           HD3      LYS  69  -3.071 -22.235  -9.765
    9    HE2  LYS  69           HE2      LYS  69  -1.077 -24.034 -11.172
   10    HE3  LYS  69           HE3      LYS  69  -2.706 -23.706 -11.764
   11    HZ3  LYS  69           HZ1      LYS  69  -1.822 -21.945 -12.756
   12    HZ2  LYS  69           HZ2      LYS  69  -0.365 -22.075 -11.893
   13    HZ1  LYS  69           HZ3      LYS  69  -1.682 -21.241 -11.220

  No H/Q in entry =          13
  In of MODEL   63
    1    H    VAL  70           H        VAL  70  -0.936 -19.659  -6.020
    2    HA   VAL  70           HA       VAL  70  -1.742 -20.289  -3.241
    3    HB   VAL  70           HB       VAL  70  -0.637 -18.175  -2.523
    4   HG11  VAL  70          HG11      VAL  70   1.098 -20.262  -3.869
    5   HG13  VAL  70          HG12      VAL  70   0.590 -20.220  -2.179
    6   HG12  VAL  70          HG13      VAL  70   1.732 -19.022  -2.788
    7   HG23  VAL  70          HG21      VAL  70   1.094 -17.215  -4.150
    8   HG22  VAL  70          HG22      VAL  70  -0.590 -16.897  -4.562
    9   HG21  VAL  70          HG23      VAL  70   0.299 -18.155  -5.416

  No H/Q in entry =           9
  In of MODEL   63
    1    H    SER  71           H        SER  71  -3.070 -18.577  -2.288
    2    HA   SER  71           HA       SER  71  -5.224 -17.777  -3.943
    3    HB2  SER  71           HB2      SER  71  -5.303 -18.107  -1.419
    4    HB3  SER  71           HB3      SER  71  -4.464 -16.567  -1.264
    5    HG   SER  71           HG       SER  71  -6.770 -16.388  -1.167

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LEU  72           H        LEU  72  -5.334 -16.171  -5.323
    2    HA   LEU  72           HA       LEU  72  -3.227 -14.365  -5.828
    3    HB2  LEU  72           HB2      LEU  72  -6.105 -14.408  -6.731
    4    HB3  LEU  72           HB3      LEU  72  -4.917 -13.246  -7.316
    5    HG   LEU  72           HG       LEU  72  -4.511 -16.252  -7.475
    6   HD13  LEU  72          HD11      LEU  72  -5.291 -16.185  -9.730
    7   HD12  LEU  72          HD12      LEU  72  -5.348 -14.423  -9.733
    8   HD11  LEU  72          HD13      LEU  72  -6.514 -15.341  -8.780
    9   HD22  LEU  72          HD21      LEU  72  -2.400 -15.260  -7.752
   10   HD21  LEU  72          HD22      LEU  72  -3.050 -13.828  -8.533
   11   HD23  LEU  72          HD23      LEU  72  -2.976 -15.353  -9.413

  No H/Q in entry =          11
  In of MODEL   63
    1    H    VAL  73           H        VAL  73  -6.295 -14.005  -4.150
    2    HA   VAL  73           HA       VAL  73  -6.325 -11.236  -3.784
    3    HB   VAL  73           HB       VAL  73  -8.005 -11.604  -2.150
    4   HG13  VAL  73          HG11      VAL  73  -9.516 -12.912  -3.386
    5   HG12  VAL  73          HG12      VAL  73  -8.263 -14.039  -3.901
    6   HG11  VAL  73          HG13      VAL  73  -8.334 -12.421  -4.600
    7   HG23  VAL  73          HG21      VAL  73  -8.299 -14.146  -1.449
    8   HG22  VAL  73          HG22      VAL  73  -7.182 -13.099  -0.575
    9   HG21  VAL  73          HG23      VAL  73  -6.573 -14.214  -1.798

  No H/Q in entry =           9
  In of MODEL   63
    1    H    LEU  74           H        LEU  74  -4.372 -13.618  -2.242
    2    HA   LEU  74           HA       LEU  74  -3.918 -12.492   0.280
    3    HB2  LEU  74           HB2      LEU  74  -3.151 -14.711  -0.249
    4    HB3  LEU  74           HB3      LEU  74  -2.107 -14.091  -1.527
    5    HG   LEU  74           HG       LEU  74  -0.833 -12.806   0.203
    6   HD13  LEU  74          HD11      LEU  74  -2.334 -12.509   2.001
    7   HD12  LEU  74          HD12      LEU  74  -1.239 -13.760   2.593
    8   HD11  LEU  74          HD13      LEU  74  -2.833 -14.200   1.978
    9   HD23  LEU  74          HD21      LEU  74  -0.926 -15.675   1.035
   10   HD22  LEU  74          HD22      LEU  74   0.448 -14.629   0.752
   11   HD21  LEU  74          HD23      LEU  74  -0.447 -15.262  -0.610

  No H/Q in entry =          11
  In of MODEL   63
    1    H    VAL  75           H        VAL  75  -2.071 -12.089  -2.704
    2    HA   VAL  75           HA       VAL  75  -0.252 -10.176  -1.711
    3    HB   VAL  75           HB       VAL  75  -1.253 -10.634  -4.523
    4   HG12  VAL  75          HG11      VAL  75   0.802  -9.336  -5.169
    5   HG11  VAL  75          HG12      VAL  75   1.058  -8.963  -3.471
    6   HG13  VAL  75          HG13      VAL  75  -0.364  -8.350  -4.297
    7   HG21  VAL  75          HG21      VAL  75  -0.022 -12.500  -3.353
    8   HG23  VAL  75          HG22      VAL  75   1.344 -11.403  -3.149
    9   HG22  VAL  75          HG23      VAL  75   0.827 -11.876  -4.768

  No H/Q in entry =           9
  In of MODEL   63
    1    H    GLU  76           H        GLU  76  -3.427  -9.810  -3.318
    2    HA   GLU  76           HA       GLU  76  -3.471  -6.995  -3.404
    3    HB2  GLU  76           HB2      GLU  76  -5.151  -8.423  -4.548
    4    HB3  GLU  76           HB3      GLU  76  -5.783  -8.926  -2.988
    5    HG2  GLU  76           HG2      GLU  76  -7.244  -7.204  -3.836
    6    HG3  GLU  76           HG3      GLU  76  -6.339  -6.498  -2.511

  No H/Q in entry =           6
  In of MODEL   63
    1    H    ALA  77           H        ALA  77  -4.550  -9.232  -0.860
    2    HA   ALA  77           HA       ALA  77  -5.473  -7.237   0.924
    3    HB2  ALA  77           HB1      ALA  77  -5.039  -9.066   2.675
    4    HB1  ALA  77           HB2      ALA  77  -4.527 -10.073   1.321
    5    HB3  ALA  77           HB3      ALA  77  -6.174  -9.446   1.380

  No H/Q in entry =           5
  In of MODEL   63
    1    H    GLN  78           H        GLN  78  -2.337  -8.795   0.503
    2    HA   GLN  78           HA       GLN  78  -1.041  -7.651   2.740
    3    HB2  GLN  78           HB2      GLN  78  -0.207  -9.587   1.362
    4    HB3  GLN  78           HB3      GLN  78   0.214  -8.436   0.095
    5    HG2  GLN  78           HG2      GLN  78   1.707  -7.258   1.651
    6    HG3  GLN  78           HG3      GLN  78   1.281  -8.390   2.931
    7   HE21  GLN  78          HE21      GLN  78   3.994  -8.141   2.052
    8   HE22  GLN  78          HE22      GLN  78   4.435  -9.579   1.264

  No H/Q in entry =           8
  In of MODEL   63
    1    H    LEU  79           H        LEU  79  -1.454  -6.571  -0.595
    2    HA   LEU  79           HA       LEU  79   0.241  -4.351  -0.596
    3    HB2  LEU  79           HB2      LEU  79  -0.820  -5.143  -2.638
    4    HB3  LEU  79           HB3      LEU  79  -2.413  -4.747  -2.003
    5    HG   LEU  79           HG       LEU  79  -1.859  -2.363  -1.974
    6   HD13  LEU  79          HD11      LEU  79   0.390  -2.131  -1.494
    7   HD12  LEU  79          HD12      LEU  79   0.414  -1.835  -3.232
    8   HD11  LEU  79          HD13      LEU  79   0.871  -3.418  -2.601
    9   HD23  LEU  79          HD21      LEU  79  -1.262  -2.153  -4.534
   10   HD22  LEU  79          HD22      LEU  79  -2.785  -2.897  -4.056
   11   HD21  LEU  79          HD23      LEU  79  -1.423  -3.909  -4.526

  No H/Q in entry =          11
  In of MODEL   63
    1    H    HIS  80           H        HIS  80  -3.213  -4.502   0.282
    2    HA   HIS  80           HA       HIS  80  -3.382  -1.749   0.963
    3    HB2  HIS  80           HB2      HIS  80  -5.089  -4.152   1.295
    4    HB3  HIS  80           HB3      HIS  80  -5.387  -2.816   2.411
    5    HD1  HIS  80           HD1      HIS  80  -7.011  -1.167   1.536
    6    HD2  HIS  80           HD2      HIS  80  -4.873  -2.973  -1.554
    7    HE1  HIS  80           HE1      HIS  80  -7.879  -0.155  -0.624
    8    HE2  HIS  80           HE2      HIS  80  -6.583  -1.250  -2.517

  No H/Q in entry =           8
  In of MODEL   63
    1    H    LEU  81           H        LEU  81  -2.877  -4.656   2.933
    2    HA   LEU  81           HA       LEU  81  -2.820  -3.322   5.424
    3    HB2  LEU  81           HB2      LEU  81  -1.627  -5.940   4.512
    4    HB3  LEU  81           HB3      LEU  81  -1.573  -5.390   6.188
    5    HG   LEU  81           HG       LEU  81  -4.144  -5.622   4.598
    6   HD12  LEU  81          HD11      LEU  81  -4.433  -7.694   6.139
    7   HD11  LEU  81          HD12      LEU  81  -2.679  -7.632   6.299
    8   HD13  LEU  81          HD13      LEU  81  -3.413  -7.851   4.710
    9   HD23  LEU  81          HD21      LEU  81  -4.950  -5.834   7.111
   10   HD22  LEU  81          HD22      LEU  81  -4.628  -4.243   6.424
   11   HD21  LEU  81          HD23      LEU  81  -3.429  -5.014   7.462

  No H/Q in entry =          11
  In of MODEL   63
    1    H    MET  82           H        MET  82  -0.177  -4.227   3.208
    2    HA   MET  82           HA       MET  82   1.936  -3.352   4.864
    3    HB2  MET  82           HB2      MET  82   1.674  -3.677   1.873
    4    HB3  MET  82           HB3      MET  82   3.170  -3.118   2.617
    5    HG2  MET  82           HG2      MET  82   1.761  -5.704   3.350
    6    HG3  MET  82           HG3      MET  82   3.116  -5.596   2.229
    7    HE3  MET  82           HE1      MET  82   6.166  -4.886   4.170
    8    HE2  MET  82           HE2      MET  82   5.241  -3.510   3.573
    9    HE1  MET  82           HE3      MET  82   5.307  -4.996   2.629

  No H/Q in entry =           9
  In of MODEL   63
    1    H    THR  83           H        THR  83   0.084  -1.688   2.344
    2    HA   THR  83           HA       THR  83   1.510   0.752   2.421
    3    HB   THR  83           HB       THR  83  -0.676   1.694   1.473
    4    HG1  THR  83           HG1      THR  83  -2.335   0.407   1.385
    5   HG22  THR  83          HG21      THR  83  -0.446  -0.115  -0.541
    6   HG21  THR  83          HG22      THR  83   1.066  -0.420   0.311
    7   HG23  THR  83          HG23      THR  83   0.704   1.199  -0.290

  No H/Q in entry =           7
  In of MODEL   63
    1    H    SER  84           H        SER  84  -1.476  -0.272   4.063
    2    HA   SER  84           HA       SER  84  -1.938   2.154   5.427
    3    HB2  SER  84           HB2      SER  84  -2.778  -0.682   5.990
    4    HB3  SER  84           HB3      SER  84  -3.248   0.656   7.037
    5    HG   SER  84           HG       SER  84  -3.751   0.359   4.251

  No H/Q in entry =           5
  In of MODEL   63
    1    H    MET  85           H        MET  85  -0.228  -0.793   6.515
    2    HA   MET  85           HA       MET  85   0.338   0.117   9.116
    3    HB2  MET  85           HB2      MET  85   0.606  -2.225   8.418
    4    HB3  MET  85           HB3      MET  85   1.978  -1.763   7.411
    5    HG2  MET  85           HG2      MET  85   3.176  -0.943   9.405
    6    HG3  MET  85           HG3      MET  85   1.799  -1.380  10.415
    7    HE1  MET  85           HE1      MET  85   0.790  -3.792  10.507
    8    HE3  MET  85           HE2      MET  85   1.914  -3.396  11.806
    9    HE2  MET  85           HE3      MET  85   1.970  -4.988  11.054

  No H/Q in entry =           9
  In of MODEL   63
    1    H    LEU  86           H        LEU  86   2.228   0.377   6.137
    2    HA   LEU  86           HA       LEU  86   4.467   1.668   7.264
    3    HB2  LEU  86           HB2      LEU  86   4.234   0.599   4.953
    4    HB3  LEU  86           HB3      LEU  86   3.427   2.087   4.461
    5    HG   LEU  86           HG       LEU  86   5.477   3.317   5.416
    6   HD11  LEU  86          HD11      LEU  86   6.179   0.697   6.191
    7   HD13  LEU  86          HD12      LEU  86   7.193   2.135   6.280
    8   HD12  LEU  86          HD13      LEU  86   7.274   1.093   4.862
    9   HD23  LEU  86          HD21      LEU  86   6.147   1.561   3.046
   10   HD22  LEU  86          HD22      LEU  86   6.555   3.255   3.310
   11   HD21  LEU  86          HD23      LEU  86   4.893   2.798   2.935

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ALA  87           H        ALA  87   1.538   2.937   5.731
    2    HA   ALA  87           HA       ALA  87   2.150   5.663   5.819
    3    HB1  ALA  87           HB1      ALA  87  -0.177   4.052   5.306
    4    HB3  ALA  87           HB2      ALA  87   0.136   5.713   4.809
    5    HB2  ALA  87           HB3      ALA  87  -0.635   5.389   6.363

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ARG  88           H        ARG  88   0.486   3.660   8.225
    2    HA   ARG  88           HA       ARG  88   0.015   5.703  10.089
    3    HB2  ARG  88           HB2      ARG  88  -0.936   3.356  10.159
    4    HB3  ARG  88           HB3      ARG  88   0.612   2.843  10.839
    5    HG2  ARG  88           HG2      ARG  88   0.173   4.913  12.476
    6    HG3  ARG  88           HG3      ARG  88  -1.502   4.600  12.044
    7    HD2  ARG  88           HD2      ARG  88  -1.601   2.745  13.283
    8    HD3  ARG  88           HD3      ARG  88  -0.024   2.157  12.725
    9    HE   ARG  88           HE       ARG  88  -0.512   3.411  15.193
   10   HH21  ARG  88          HH11      ARG  88   1.071   4.408  16.412
   11   HH22  ARG  88          HH12      ARG  88   2.582   4.829  15.686
   12   HH11  ARG  88          HH21      ARG  88   1.729   3.592  12.582
   13   HH12  ARG  88          HH22      ARG  88   2.963   4.351  13.529

  No H/Q in entry =          13
  In of MODEL   63
    1    H    GLU  89           H        GLU  89   2.795   3.469   9.812
    2    HA   GLU  89           HA       GLU  89   4.097   4.339  12.141
    3    HB2  GLU  89           HB2      GLU  89   4.724   2.324  10.777
    4    HB3  GLU  89           HB3      GLU  89   5.488   3.419   9.624
    5    HG2  GLU  89           HG2      GLU  89   7.004   4.249  11.349
    6    HG3  GLU  89           HG3      GLU  89   6.183   3.291  12.577

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LEU  90           H        LEU  90   4.370   5.511   8.814
    2    HA   LEU  90           HA       LEU  90   6.320   7.498   9.378
    3    HB2  LEU  90           HB2      LEU  90   4.278   7.188   7.181
    4    HB3  LEU  90           HB3      LEU  90   5.515   8.452   7.189
    5    HG   LEU  90           HG       LEU  90   6.178   5.510   7.499
    6   HD12  LEU  90          HD11      LEU  90   6.890   5.751   5.049
    7   HD11  LEU  90          HD12      LEU  90   5.882   7.198   5.023
    8   HD13  LEU  90          HD13      LEU  90   5.159   5.627   5.370
    9   HD22  LEU  90          HD21      LEU  90   8.092   6.647   8.157
   10   HD21  LEU  90          HD22      LEU  90   7.734   8.058   7.162
   11   HD23  LEU  90          HD23      LEU  90   8.375   6.593   6.418

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  91           H        ILE  91   2.779   7.533   9.284
    2    HA   ILE  91           HA       ILE  91   2.458  10.305   9.753
    3    HB   ILE  91           HB       ILE  91   0.663   7.936  10.312
    4   HG12  ILE  91          HG12      ILE  91   0.396  10.228   8.342
    5   HG13  ILE  91          HG13      ILE  91   1.243   8.731   7.950
    6   HG22  ILE  91          HG21      ILE  91  -1.057  10.002  10.412
    7   HG21  ILE  91          HG22      ILE  91   0.358  10.822  11.067
    8   HG23  ILE  91          HG23      ILE  91  -0.273   9.385  11.867
    9   HD13  ILE  91          HD11      ILE  91  -0.707   7.453   8.018
   10   HD12  ILE  91          HD12      ILE  91  -1.299   8.974   7.353
   11   HD11  ILE  91          HD13      ILE  91  -1.546   8.603   9.060

  No H/Q in entry =          11
  In of MODEL   63
    1    H    THR  92           H        THR  92   2.882   7.551  11.935
    2    HA   THR  92           HA       THR  92   2.482   8.916  14.372
    3    HB   THR  92           HB       THR  92   4.269   6.576  13.669
    4    HG1  THR  92           HG1      THR  92   2.295   5.828  13.595
    5   HG22  THR  92          HG21      THR  92   3.925   6.281  16.307
    6   HG21  THR  92          HG22      THR  92   3.867   8.041  16.242
    7   HG23  THR  92          HG23      THR  92   5.287   7.182  15.644

  No H/Q in entry =           7
  In of MODEL   63
    1    H    GLU  93           H        GLU  93   5.401   8.463  12.392
    2    HA   GLU  93           HA       GLU  93   7.186   9.875  14.068
    3    HB2  GLU  93           HB2      GLU  93   7.228   9.573  11.050
    4    HB3  GLU  93           HB3      GLU  93   8.586  10.093  12.047
    5    HG2  GLU  93           HG2      GLU  93   7.172   7.460  12.504
    6    HG3  GLU  93           HG3      GLU  93   8.540   7.611  11.408

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LEU  94           H        LEU  94   5.101  10.910  11.391
    2    HA   LEU  94           HA       LEU  94   5.915  13.611  11.291
    3    HB2  LEU  94           HB2      LEU  94   3.309  12.259  10.570
    4    HB3  LEU  94           HB3      LEU  94   3.570  13.987  10.333
    5    HG   LEU  94           HG       LEU  94   5.563  11.996   9.243
    6   HD11  LEU  94          HD11      LEU  94   2.808  12.562   8.225
    7   HD13  LEU  94          HD12      LEU  94   3.784  11.102   8.078
    8   HD12  LEU  94          HD13      LEU  94   4.108  12.486   7.035
    9   HD23  LEU  94          HD21      LEU  94   5.794  13.839   7.525
   10   HD22  LEU  94          HD22      LEU  94   6.236  14.323   9.162
   11   HD21  LEU  94          HD23      LEU  94   4.676  14.800   8.490

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  95           H        ILE  95   3.400  11.995  13.213
    2    HA   ILE  95           HA       ILE  95   2.384  14.343  14.434
    3    HB   ILE  95           HB       ILE  95   2.405  11.457  15.346
    4   HG12  ILE  95          HG12      ILE  95   0.175  13.243  14.337
    5   HG13  ILE  95          HG13      ILE  95   1.112  12.185  13.286
    6   HG21  ILE  95          HG21      ILE  95   1.149  13.929  16.577
    7   HG23  ILE  95          HG22      ILE  95   2.206  12.753  17.361
    8   HG22  ILE  95          HG23      ILE  95   0.562  12.299  16.908
    9   HD13  ILE  95          HD11      ILE  95   0.217  10.245  14.211
   10   HD12  ILE  95          HD12      ILE  95  -1.161  11.339  14.312
   11   HD11  ILE  95          HD13      ILE  95  -0.175  11.031  15.741

  No H/Q in entry =          11
  In of MODEL   63
    1    H    GLU  96           H        GLU  96   4.987  12.112  15.381
    2    HA   GLU  96           HA       GLU  96   5.583  13.298  17.869
    3    HB2  GLU  96           HB2      GLU  96   6.514  11.139  17.198
    4    HB3  GLU  96           HB3      GLU  96   7.431  11.915  15.908
    5    HG2  GLU  96           HG2      GLU  96   9.102  12.452  17.347
    6    HG3  GLU  96           HG3      GLU  96   7.974  13.264  18.423

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LEU  97           H        LEU  97   6.610  14.081  14.571
    2    HA   LEU  97           HA       LEU  97   8.512  16.069  15.263
    3    HB2  LEU  97           HB2      LEU  97   6.882  15.535  12.789
    4    HB3  LEU  97           HB3      LEU  97   7.907  16.963  12.902
    5    HG   LEU  97           HG       LEU  97   8.937  14.161  13.435
    6   HD12  LEU  97          HD11      LEU  97   9.899  14.362  11.104
    7   HD11  LEU  97          HD12      LEU  97   8.848  15.757  10.862
    8   HD13  LEU  97          HD13      LEU  97   8.149  14.165  11.160
    9   HD23  LEU  97          HD21      LEU  97  11.098  15.437  12.665
   10   HD22  LEU  97          HD22      LEU  97  10.504  15.701  14.304
   11   HD21  LEU  97          HD23      LEU  97  10.174  16.891  13.046

  No H/Q in entry =          11
  In of MODEL   63
    1    H    HIS  98           H        HIS  98   5.012  16.216  14.661
    2    HA   HIS  98           HA       HIS  98   4.721  19.015  14.813
    3    HB2  HIS  98           HB2      HIS  98   2.837  16.766  15.557
    4    HB3  HIS  98           HB3      HIS  98   2.375  18.467  15.627
    5    HD1  HIS  98           HD1      HIS  98   3.354  15.761  13.196
    6    HD2  HIS  98           HD2      HIS  98   1.985  19.698  13.111
    7    HE1  HIS  98           HE1      HIS  98   2.760  16.261  10.783
    8    HE2  HIS  98           HE2      HIS  98   1.929  18.653  10.710

  No H/Q in entry =           8
  In of MODEL   63
    1    H    GLU  99           H        GLU  99   4.886  16.516  17.299
    2    HA   GLU  99           HA       GLU  99   4.314  18.202  19.513
    3    HB2  GLU  99           HB2      GLU  99   4.221  15.720  19.601
    4    HB3  GLU  99           HB3      GLU  99   5.979  15.672  19.466
    5    HG2  GLU  99           HG2      GLU  99   6.202  16.954  21.543
    6    HG3  GLU  99           HG3      GLU  99   4.451  17.098  21.665

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LYS 100           H        LYS 100   7.342  17.271  17.899
    2    HA   LYS 100           HA       LYS 100   9.028  18.661  19.737
    3    HB2  LYS 100           HB2      LYS 100   9.482  17.747  16.887
    4    HB3  LYS 100           HB3      LYS 100  10.729  18.510  17.880
    5    HG2  LYS 100           HG2      LYS 100  10.374  16.752  19.619
    6    HG3  LYS 100           HG3      LYS 100   9.224  15.956  18.541
    7    HD2  LYS 100           HD2      LYS 100  10.993  15.677  16.846
    8    HD3  LYS 100           HD3      LYS 100  12.147  16.485  17.909
    9    HE2  LYS 100           HE2      LYS 100  11.773  14.723  19.625
   10    HE3  LYS 100           HE3      LYS 100  10.679  13.895  18.512
   11    HZ1  LYS 100           HZ1      LYS 100  13.491  14.561  17.818
   12    HZ3  LYS 100           HZ2      LYS 100  12.433  13.512  17.001
   13    HZ2  LYS 100           HZ3      LYS 100  13.043  13.085  18.528

  No H/Q in entry =          13
  In of MODEL   63
    1    H    LEU 101           H        LEU 101   7.292  19.604  16.811
    2    HA   LEU 101           HA       LEU 101   8.507  22.160  16.469
    3    HB2  LEU 101           HB2      LEU 101   5.896  20.936  15.616
    4    HB3  LEU 101           HB3      LEU 101   6.148  22.667  15.412
    5    HG   LEU 101           HG       LEU 101   8.165  20.651  14.407
    6   HD12  LEU 101          HD11      LEU 101   6.979  21.169  12.142
    7   HD11  LEU 101          HD12      LEU 101   5.595  21.598  13.145
    8   HD13  LEU 101          HD13      LEU 101   6.257  19.966  13.210
    9   HD21  LEU 101          HD21      LEU 101   7.535  23.567  13.874
   10   HD23  LEU 101          HD22      LEU 101   8.497  22.609  12.748
   11   HD22  LEU 101          HD23      LEU 101   9.064  22.858  14.399

  No H/Q in entry =          11
  In of MODEL   63
    1    H    LYS 102           H        LYS 102   7.007  21.014  19.102
    2    HA   LYS 102           HA       LYS 102   6.406  22.098  21.048
    3    HB2  LYS 102           HB2      LYS 102   7.677  24.090  19.914
    4    HB3  LYS 102           HB3      LYS 102   6.074  24.701  19.565
    5    HG2  LYS 102           HG2      LYS 102   7.490  24.430  22.195
    6    HG3  LYS 102           HG3      LYS 102   6.531  25.763  21.586
    7    HD2  LYS 102           HD2      LYS 102   5.294  23.126  22.472
    8    HD3  LYS 102           HD3      LYS 102   5.562  24.482  23.557
    9    HE2  LYS 102           HE2      LYS 102   3.260  24.091  22.101
   10    HE3  LYS 102           HE3      LYS 102   3.777  25.633  22.782
   11    HZ2  LYS 102           HZ1      LYS 102   3.211  25.753  20.411
   12    HZ1  LYS 102           HZ2      LYS 102   4.465  24.669  20.065
   13    HZ3  LYS 102           HZ3      LYS 102   4.821  26.196  20.709

  No H/Q in entry =          13
  In of MODEL   63
    1    H    ALA 103           H        ALA 103   4.731  23.658  18.313
    2    HA   ALA 103           HA       ALA 103   2.292  24.237  19.237
    3    HB1  ALA 103           HB1      ALA 103   1.357  23.407  17.005
    4    HB2  ALA 103           HB2      ALA 103   2.998  22.868  16.648
    5    HB3  ALA 103           HB3      ALA 103   2.672  24.579  16.927

  No H/Q in entry =           5
  In of MODEL   63
    1    H1   ALA   1           H3       ALA   1  10.390 -20.171  -6.364
    2    H2   ALA   1           H2       ALA   1   9.404 -20.367  -7.736
    3    H3   ALA   1           H1       ALA   1   8.987 -21.119  -6.270
    4    HA   ALA   1           HA       ALA   1  10.009 -22.928  -7.033
    5    HB1  ALA   1           HB1      ALA   1  10.071 -22.559  -9.308
    6    HB2  ALA   1           HB2      ALA   1  11.804 -22.415  -9.005
    7    HB3  ALA   1           HB3      ALA   1  10.808 -20.964  -9.134

  No H/Q in entry =           7
  In of MODEL   63
    1    H    GLU   2           H        GLU   2  12.288 -23.886  -7.130
    2    HA   GLU   2           HA       GLU   2  13.704 -23.819  -4.939
    3    HB2  GLU   2           HB2      GLU   2  15.019 -23.679  -7.658
    4    HB3  GLU   2           HB3      GLU   2  15.768 -24.300  -6.187
    5    HG2  GLU   2           HG2      GLU   2  14.740 -26.312  -6.421
    6    HG3  GLU   2           HG3      GLU   2  13.168 -25.560  -6.653

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLU   3           H        GLU   3  15.445 -21.949  -7.359
    2    HA   GLU   3           HA       GLU   3  16.633 -20.275  -5.409
    3    HB2  GLU   3           HB2      GLU   3  16.532 -20.259  -8.418
    4    HB3  GLU   3           HB3      GLU   3  17.296 -18.936  -7.536
    5    HG2  GLU   3           HG2      GLU   3  18.967 -20.321  -6.646
    6    HG3  GLU   3           HG3      GLU   3  18.012 -21.783  -6.859

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LEU   4           H        LEU   4  14.315 -19.407  -8.001
    2    HA   LEU   4           HA       LEU   4  13.867 -16.799  -7.370
    3    HB2  LEU   4           HB2      LEU   4  11.674 -18.763  -8.076
    4    HB3  LEU   4           HB3      LEU   4  11.602 -17.013  -8.266
    5    HG   LEU   4           HG       LEU   4  13.538 -18.877  -9.677
    6   HD13  LEU   4          HD11      LEU   4  12.208 -18.714 -11.566
    7   HD12  LEU   4          HD12      LEU   4  11.513 -17.169 -11.081
    8   HD11  LEU   4          HD13      LEU   4  10.966 -18.661 -10.318
    9   HD23  LEU   4          HD21      LEU   4  13.862 -16.626 -11.023
   10   HD22  LEU   4          HD22      LEU   4  14.744 -16.879  -9.518
   11   HD21  LEU   4          HD23      LEU   4  13.295 -15.877  -9.531

  No H/Q in entry =          11
  In of MODEL   63
    1    H    GLU   5           H        GLU   5  12.397 -19.586  -5.719
    2    HA   GLU   5           HA       GLU   5  10.752 -18.016  -3.983
    3    HB2  GLU   5           HB2      GLU   5  10.309 -20.390  -4.508
    4    HB3  GLU   5           HB3      GLU   5  11.757 -20.836  -3.602
    5    HG2  GLU   5           HG2      GLU   5  10.828 -19.829  -1.572
    6    HG3  GLU   5           HG3      GLU   5   9.398 -19.314  -2.466

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLU   6           H        GLU   6  13.899 -19.609  -3.596
    2    HA   GLU   6           HA       GLU   6  14.296 -18.766  -0.899
    3    HB2  GLU   6           HB2      GLU   6  15.499 -20.681  -1.924
    4    HB3  GLU   6           HB3      GLU   6  16.355 -19.552  -2.978
    5    HG2  GLU   6           HG2      GLU   6  17.327 -18.429  -1.034
    6    HG3  GLU   6           HG3      GLU   6  16.422 -19.484   0.052

  No H/Q in entry =           6
  In of MODEL   63
    1    H    VAL   7           H        VAL   7  15.018 -17.428  -4.054
    2    HA   VAL   7           HA       VAL   7  16.724 -15.311  -3.206
    3    HB   VAL   7           HB       VAL   7  14.979 -15.657  -5.658
    4   HG11  VAL   7          HG11      VAL   7  16.892 -13.454  -4.865
    5   HG13  VAL   7          HG12      VAL   7  15.241 -13.303  -5.463
    6   HG12  VAL   7          HG13      VAL   7  16.532 -13.805  -6.555
    7   HG21  VAL   7          HG21      VAL   7  17.090 -17.123  -5.129
    8   HG23  VAL   7          HG22      VAL   7  17.993 -15.663  -5.534
    9   HG22  VAL   7          HG23      VAL   7  16.936 -16.404  -6.733

  No H/Q in entry =           9
  In of MODEL   63
    1    H    VAL   8           H        VAL   8  13.223 -15.567  -3.710
    2    HA   VAL   8           HA       VAL   8  12.572 -12.859  -3.216
    3    HB   VAL   8           HB       VAL   8  10.963 -15.387  -2.776
    4   HG11  VAL   8          HG11      VAL   8  10.248 -12.464  -2.519
    5   HG13  VAL   8          HG12      VAL   8   9.927 -13.774  -1.384
    6   HG12  VAL   8          HG13      VAL   8   9.025 -13.678  -2.895
    7   HG21  VAL   8          HG21      VAL   8  11.801 -14.256  -5.155
    8   HG23  VAL   8          HG22      VAL   8  10.249 -13.459  -4.912
    9   HG22  VAL   8          HG23      VAL   8  10.331 -15.216  -4.983

  No H/Q in entry =           9
  In of MODEL   63
    1    H    MET   9           H        MET   9  12.864 -15.676  -1.053
    2    HA   MET   9           HA       MET   9  12.089 -14.413   1.335
    3    HB2  MET   9           HB2      MET   9  13.944 -16.708   0.730
    4    HB3  MET   9           HB3      MET   9  13.751 -16.115   2.380
    5    HG2  MET   9           HG2      MET   9  11.216 -16.341   1.977
    6    HG3  MET   9           HG3      MET   9  11.653 -17.304   0.565
    7    HE3  MET   9           HE1      MET   9  13.008 -20.498   1.695
    8    HE2  MET   9           HE2      MET   9  14.095 -19.173   1.287
    9    HE1  MET   9           HE3      MET   9  12.572 -19.352   0.422

  No H/Q in entry =           9
  In of MODEL   63
    1    H    GLY  10           H        GLY  10  15.245 -14.638  -0.271
    2    HA3  GLY  10           HA2      GLY  10  16.738 -13.230   1.683
    3    HA2  GLY  10           HA3      GLY  10  17.175 -13.388  -0.018

  No H/Q in entry =           3
  In of MODEL   63
    1    H    LEU  11           H        LEU  11  14.991 -12.157  -1.219
    2    HA   LEU  11           HA       LEU  11  15.684  -9.414  -1.053
    3    HB2  LEU  11           HB2      LEU  11  13.295 -10.813  -2.258
    4    HB3  LEU  11           HB3      LEU  11  13.576  -9.078  -2.414
    5    HG   LEU  11           HG       LEU  11  15.587 -11.187  -3.243
    6   HD13  LEU  11          HD11      LEU  11  13.817 -11.544  -4.738
    7   HD12  LEU  11          HD12      LEU  11  14.810 -10.360  -5.588
    8   HD11  LEU  11          HD13      LEU  11  13.350  -9.843  -4.744
    9   HD22  LEU  11          HD21      LEU  11  16.826  -9.227  -3.027
   10   HD21  LEU  11          HD22      LEU  11  15.447  -8.186  -3.380
   11   HD23  LEU  11          HD23      LEU  11  16.257  -9.050  -4.685

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  12           H        ILE  12  12.931 -11.240   0.248
    2    HA   ILE  12           HA       ILE  12  11.558  -9.019   1.339
    3    HB   ILE  12           HB       ILE  12  11.605 -11.905   2.275
    4   HG12  ILE  12          HG12      ILE  12  10.881 -11.254  -0.161
    5   HG13  ILE  12          HG13      ILE  12   9.875 -12.357   0.758
    6   HG21  ILE  12          HG21      ILE  12   9.698  -9.624   2.881
    7   HG23  ILE  12          HG22      ILE  12  10.679 -10.526   4.036
    8   HG22  ILE  12          HG23      ILE  12   9.333 -11.316   3.214
    9   HD12  ILE  12          HD11      ILE  12   8.599 -10.568  -0.434
   10   HD11  ILE  12          HD12      ILE  12   9.433  -9.367   0.548
   11   HD13  ILE  12          HD13      ILE  12   8.366 -10.530   1.305

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  13           H        ILE  13  13.969 -11.234   2.698
    2    HA   ILE  13           HA       ILE  13  14.045 -10.066   5.283
    3    HB   ILE  13           HB       ILE  13  16.083 -11.630   3.679
    4   HG12  ILE  13          HG12      ILE  13  13.830 -12.622   4.514
    5   HG13  ILE  13          HG13      ILE  13  15.310 -13.528   4.816
    6   HG22  ILE  13          HG21      ILE  13  17.032 -12.004   6.117
    7   HG21  ILE  13          HG22      ILE  13  16.279 -10.447   6.439
    8   HG23  ILE  13          HG23      ILE  13  17.519 -10.585   5.192
    9   HD13  ILE  13          HD11      ILE  13  15.203 -13.184   7.098
   10   HD12  ILE  13          HD12      ILE  13  13.490 -12.981   6.744
   11   HD11  ILE  13          HD13      ILE  13  14.525 -11.569   6.911

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ASN  14           H        ASN  14  15.955  -9.523   2.337
    2    HA   ASN  14           HA       ASN  14  17.716  -7.587   3.382
    3    HB2  ASN  14           HB2      ASN  14  17.658  -8.843   1.061
    4    HB3  ASN  14           HB3      ASN  14  16.757  -7.423   0.544
    5   HD21  ASN  14          HD21      ASN  14  19.179  -7.757  -0.680
    6   HD22  ASN  14          HD22      ASN  14  20.332  -6.677  -0.065

  No H/Q in entry =           6
  In of MODEL   63
    1    H    SER  15           H        SER  15  14.580  -7.232   1.738
    2    HA   SER  15           HA       SER  15  14.468  -4.412   1.809
    3    HB2  SER  15           HB2      SER  15  12.126  -4.657   1.355
    4    HB3  SER  15           HB3      SER  15  12.914  -6.012   0.556
    5    HG   SER  15           HG       SER  15  11.560  -7.149   1.693

  No H/Q in entry =           5
  In of MODEL   63
    1    H    GLY  16           H        GLY  16  13.410  -6.883   4.118
    2    HA3  GLY  16           HA2      GLY  16  12.216  -5.143   6.001
    3    HA2  GLY  16           HA3      GLY  16  12.837  -6.753   6.346

  No H/Q in entry =           3
  In of MODEL   63
    1    H    GLN  17           H        GLN  17  15.539  -6.416   5.715
    2    HA   GLN  17           HA       GLN  17  16.531  -5.205   8.087
    3    HB2  GLN  17           HB2      GLN  17  17.742  -6.991   6.867
    4    HB3  GLN  17           HB3      GLN  17  18.031  -5.871   5.534
    5    HG2  GLN  17           HG2      GLN  17  19.253  -4.367   7.072
    6    HG3  GLN  17           HG3      GLN  17  18.988  -5.509   8.389
    7   HE21  GLN  17          HE21      GLN  17  20.738  -6.878   8.720
    8   HE22  GLN  17          HE22      GLN  17  21.827  -7.375   7.518

  No H/Q in entry =           8
  In of MODEL   63
    1    H    ALA  18           H        ALA  18  16.291  -4.112   4.735
    2    HA   ALA  18           HA       ALA  18  17.728  -1.719   4.951
    3    HB2  ALA  18           HB1      ALA  18  16.580  -2.925   2.895
    4    HB3  ALA  18           HB2      ALA  18  16.843  -1.182   2.884
    5    HB1  ALA  18           HB3      ALA  18  15.250  -1.831   3.274

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ARG  19           H        ARG  19  14.235  -2.312   5.398
    2    HA   ARG  19           HA       ARG  19  13.575   0.334   6.134
    3    HB2  ARG  19           HB2      ARG  19  11.887  -1.417   5.565
    4    HB3  ARG  19           HB3      ARG  19  12.252  -2.221   7.093
    5    HG2  ARG  19           HG2      ARG  19  11.559  -0.237   8.352
    6    HG3  ARG  19           HG3      ARG  19  11.285   0.646   6.851
    7    HD2  ARG  19           HD2      ARG  19   9.157  -0.156   7.699
    8    HD3  ARG  19           HD3      ARG  19   9.555  -1.028   6.213
    9    HE   ARG  19           HE       ARG  19  10.546  -2.579   8.297
   10   HH21  ARG  19          HH11      ARG  19   9.313  -4.225   9.246
   11   HH22  ARG  19          HH12      ARG  19   7.590  -4.199   9.101
   12   HH11  ARG  19          HH21      ARG  19   7.535  -1.285   7.252
   13   HH12  ARG  19          HH22      ARG  19   6.584  -2.534   7.968

  No H/Q in entry =          13
  In of MODEL   63
    1    H    SER  20           H        SER  20  14.465  -2.504   8.068
    2    HA   SER  20           HA       SER  20  14.218  -1.417  10.614
    3    HB2  SER  20           HB2      SER  20  14.720  -3.797  10.208
    4    HB3  SER  20           HB3      SER  20  16.328  -3.359   9.638
    5    HG   SER  20           HG       SER  20  15.228  -2.953  12.225

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LEU  21           H        LEU  21  17.029  -1.342   8.436
    2    HA   LEU  21           HA       LEU  21  18.728   0.137  10.157
    3    HB2  LEU  21           HB2      LEU  21  18.662  -0.119   7.142
    4    HB3  LEU  21           HB3      LEU  21  19.929   0.736   8.018
    5    HG   LEU  21           HG       LEU  21  19.199  -2.155   8.563
    6   HD12  LEU  21          HD11      LEU  21  21.275  -2.680   7.261
    7   HD11  LEU  21          HD12      LEU  21  21.348  -0.989   6.768
    8   HD13  LEU  21          HD13      LEU  21  19.988  -1.994   6.269
    9   HD22  LEU  21          HD21      LEU  21  20.408  -1.442  10.435
   10   HD21  LEU  21          HD22      LEU  21  21.351  -0.269   9.523
   11   HD23  LEU  21          HD23      LEU  21  21.723  -1.980   9.396

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ALA  22           H        ALA  22  16.425   1.116   7.639
    2    HA   ALA  22           HA       ALA  22  16.962   3.875   7.658
    3    HB3  ALA  22           HB1      ALA  22  15.535   2.639   5.994
    4    HB2  ALA  22           HB2      ALA  22  14.836   4.148   6.579
    5    HB1  ALA  22           HB3      ALA  22  14.256   2.605   7.207

  No H/Q in entry =           5
  In of MODEL   63
    1    H    TYR  23           H        TYR  23  14.493   2.048   9.521
    2    HA   TYR  23           HA       TYR  23  13.550   4.277  10.994
    3    HB2  TYR  23           HB2      TYR  23  12.315   2.164  10.983
    4    HB3  TYR  23           HB3      TYR  23  13.660   1.349  11.780
    5    HD1  TYR  23           HD1      TYR  23  11.179   4.107  12.204
    6    HD2  TYR  23           HD2      TYR  23  13.879   1.377  14.132
    7    HE1  TYR  23           HE1      TYR  23  10.288   4.786  14.419
    8    HE2  TYR  23           HE2      TYR  23  12.987   2.056  16.344
    9    HH   TYR  23           HH       TYR  23  10.296   4.372  16.607

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ALA  24           H        ALA  24  16.206   2.001  11.582
    2    HA   ALA  24           HA       ALA  24  16.913   2.984  14.140
    3    HB1  ALA  24           HB1      ALA  24  18.268   1.193  13.947
    4    HB3  ALA  24           HB2      ALA  24  19.279   2.120  12.837
    5    HB2  ALA  24           HB3      ALA  24  17.976   1.114  12.210

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ALA  25           H        ALA  25  17.822   3.929  10.852
    2    HA   ALA  25           HA       ALA  25  19.775   5.862  11.478
    3    HB1  ALA  25           HB1      ALA  25  19.025   4.924   9.169
    4    HB3  ALA  25           HB2      ALA  25  19.528   6.611   9.263
    5    HB2  ALA  25           HB3      ALA  25  17.812   6.204   9.217

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LEU  26           H        LEU  26  16.256   6.091  11.169
    2    HA   LEU  26           HA       LEU  26  16.038   8.871  11.637
    3    HB2  LEU  26           HB2      LEU  26  14.163   7.639  10.730
    4    HB3  LEU  26           HB3      LEU  26  14.093   6.605  12.152
    5    HG   LEU  26           HG       LEU  26  13.507   8.556  13.550
    6   HD12  LEU  26          HD11      LEU  26  12.827  10.662  12.244
    7   HD11  LEU  26          HD12      LEU  26  13.788  10.016  10.918
    8   HD13  LEU  26          HD13      LEU  26  14.555  10.394  12.461
    9   HD21  LEU  26          HD21      LEU  26  11.795   8.254  11.064
   10   HD23  LEU  26          HD22      LEU  26  11.257   8.945  12.592
   11   HD22  LEU  26          HD23      LEU  26  11.708   7.244  12.507

  No H/Q in entry =          11
  In of MODEL   63
    1    H    LYS  27           H        LYS  27  15.961   6.081  13.818
    2    HA   LYS  27           HA       LYS  27  15.403   7.436  16.201
    3    HB2  LYS  27           HB2      LYS  27  15.427   4.962  15.924
    4    HB3  LYS  27           HB3      LYS  27  17.189   5.014  15.855
    5    HG2  LYS  27           HG2      LYS  27  17.273   5.989  18.108
    6    HG3  LYS  27           HG3      LYS  27  15.507   6.008  18.180
    7    HD2  LYS  27           HD2      LYS  27  15.477   3.542  17.932
    8    HD3  LYS  27           HD3      LYS  27  17.241   3.531  17.894
    9    HE2  LYS  27           HE2      LYS  27  17.309   4.509  20.155
   10    HE3  LYS  27           HE3      LYS  27  15.543   4.550  20.195
   11    HZ3  LYS  27           HZ1      LYS  27  16.347   2.592  21.325
   12    HZ2  LYS  27           HZ2      LYS  27  17.243   2.119  19.959
   13    HZ1  LYS  27           HZ3      LYS  27  15.544   2.125  19.904

  No H/Q in entry =          13
  In of MODEL   63
    1    H    GLN  28           H        GLN  28  18.496   6.859  14.561
    2    HA   GLN  28           HA       GLN  28  20.210   7.932  16.532
    3    HB2  GLN  28           HB2      GLN  28  20.454   7.902  13.512
    4    HB3  GLN  28           HB3      GLN  28  21.757   8.364  14.607
    5    HG2  GLN  28           HG2      GLN  28  20.331   5.690  14.667
    6    HG3  GLN  28           HG3      GLN  28  21.893   5.973  13.903
    7   HE21  GLN  28          HE21      GLN  28  20.712   4.635  16.624
    8   HE22  GLN  28          HE22      GLN  28  21.924   5.058  17.731

  No H/Q in entry =           8
  In of MODEL   63
    1    H    ALA  29           H        ALA  29  18.420   9.429  13.872
    2    HA   ALA  29           HA       ALA  29  19.426  12.047  14.123
    3    HB2  ALA  29           HB1      ALA  29  17.707  12.693  12.680
    4    HB1  ALA  29           HB2      ALA  29  16.571  11.518  13.342
    5    HB3  ALA  29           HB3      ALA  29  17.886  10.979  12.297

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LYS  30           H        LYS  30  16.670  10.445  15.677
    2    HA   LYS  30           HA       LYS  30  15.679  12.693  17.060
    3    HB2  LYS  30           HB2      LYS  30  15.573   9.749  17.751
    4    HB3  LYS  30           HB3      LYS  30  14.722  10.996  18.663
    5    HG2  LYS  30           HG2      LYS  30  13.568  11.695  16.565
    6    HG3  LYS  30           HG3      LYS  30  14.358  10.361  15.720
    7    HD2  LYS  30           HD2      LYS  30  13.305   8.748  17.256
    8    HD3  LYS  30           HD3      LYS  30  12.526  10.071  18.125
    9    HE2  LYS  30           HE2      LYS  30  11.328  10.716  16.053
   10    HE3  LYS  30           HE3      LYS  30  12.088   9.364  15.204
   11    HZ2  LYS  30           HZ1      LYS  30   9.792   8.955  16.116
   12    HZ1  LYS  30           HZ2      LYS  30  10.483   8.999  17.673
   13    HZ3  LYS  30           HZ3      LYS  30  10.972   7.819  16.550

  No H/Q in entry =          13
  In of MODEL   63
    1    H    GLN  31           H        GLN  31  18.346  10.515  17.747
    2    HA   GLN  31           HA       GLN  31  18.715  11.515  20.441
    3    HB2  GLN  31           HB2      GLN  31  20.711   9.948  18.799
    4    HB3  GLN  31           HB3      GLN  31  20.603  10.064  20.556
    5    HG2  GLN  31           HG2      GLN  31  18.076   9.121  19.820
    6    HG3  GLN  31           HG3      GLN  31  19.160   8.280  18.719
    7   HE21  GLN  31          HE21      GLN  31  17.649   7.126  21.013
    8   HE22  GLN  31          HE22      GLN  31  18.818   6.457  22.043

  No H/Q in entry =           8
  In of MODEL   63
    1    H    GLY  32           H        GLY  32  19.194  12.846  17.474
    2    HA3  GLY  32           HA2      GLY  32  20.175  14.892  16.955
    3    HA2  GLY  32           HA3      GLY  32  20.956  14.887  18.532

  No H/Q in entry =           3
  In of MODEL   63
    1    H    ASP  33           H        ASP  33  21.345  12.002  16.735
    2    HA   ASP  33           HA       ASP  33  24.165  12.674  16.230
    3    HB2  ASP  33           HB2      ASP  33  22.653  10.061  16.356
    4    HB3  ASP  33           HB3      ASP  33  24.332  10.176  15.837

  No H/Q in entry =           4
  In of MODEL   63
    1    H    PHE  34           H        PHE  34  23.659  14.007  14.362
    2    HA   PHE  34           HA       PHE  34  22.274  13.037  12.091
    3    HB2  PHE  34           HB2      PHE  34  24.413  15.166  12.300
    4    HB3  PHE  34           HB3      PHE  34  23.406  14.885  10.881
    5    HD1  PHE  34           HD1      PHE  34  23.703  16.804  13.800
    6    HD2  PHE  34           HD2      PHE  34  20.787  14.705  11.447
    7    HE1  PHE  34           HE1      PHE  34  21.904  18.201  14.781
    8    HE2  PHE  34           HE2      PHE  34  18.991  16.102  12.430
    9    HZ   PHE  34           HZ       PHE  34  19.553  17.850  14.092

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ALA  35           H        ALA  35  25.663  12.838  13.048
    2    HA   ALA  35           HA       ALA  35  26.730  12.028  10.571
    3    HB3  ALA  35           HB1      ALA  35  28.434  10.847  12.260
    4    HB2  ALA  35           HB2      ALA  35  27.589  11.868  13.423
    5    HB1  ALA  35           HB3      ALA  35  28.407  12.597  12.042

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ALA  36           H        ALA  36  25.652  10.060  13.343
    2    HA   ALA  36           HA       ALA  36  26.114   7.578  12.048
    3    HB2  ALA  36           HB1      ALA  36  25.712   6.822  14.126
    4    HB3  ALA  36           HB2      ALA  36  24.023   7.320  14.003
    5    HB1  ALA  36           HB3      ALA  36  25.235   8.447  14.614

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ALA  37           H        ALA  37  23.297   9.707  12.234
    2    HA   ALA  37           HA       ALA  37  21.422   7.945  11.077
    3    HB3  ALA  37           HB1      ALA  37  21.655  10.907  11.380
    4    HB1  ALA  37           HB2      ALA  37  20.349   9.827  11.867
    5    HB2  ALA  37           HB3      ALA  37  20.514  10.307  10.177

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LYS  38           H        LYS  38  23.502  10.412   9.579
    2    HA   LYS  38           HA       LYS  38  22.822   9.998   6.909
    3    HB2  LYS  38           HB2      LYS  38  24.655  11.546   8.335
    4    HB3  LYS  38           HB3      LYS  38  25.672  10.561   7.290
    5    HG2  LYS  38           HG2      LYS  38  24.479  11.342   5.315
    6    HG3  LYS  38           HG3      LYS  38  23.299  12.193   6.318
    7    HD2  LYS  38           HD2      LYS  38  24.907  13.786   7.054
    8    HD3  LYS  38           HD3      LYS  38  26.258  12.802   6.494
    9    HE2  LYS  38           HE2      LYS  38  25.880  14.681   4.957
   10    HE3  LYS  38           HE3      LYS  38  25.532  13.148   4.150
   11    HZ3  LYS  38           HZ1      LYS  38  23.334  13.594   4.054
   12    HZ2  LYS  38           HZ2      LYS  38  23.858  15.209   4.142
   13    HZ1  LYS  38           HZ3      LYS  38  23.304  14.418   5.539

  No H/Q in entry =          13
  In of MODEL   63
    1    H    ALA  39           H        ALA  39  25.364   8.389   8.821
    2    HA   ALA  39           HA       ALA  39  26.402   6.810   6.728
    3    HB2  ALA  39           HB1      ALA  39  26.355   5.833   9.568
    4    HB1  ALA  39           HB2      ALA  39  27.302   7.260   9.144
    5    HB3  ALA  39           HB3      ALA  39  27.641   5.713   8.368

  No H/Q in entry =           5
  In of MODEL   63
    1    H    MET  40           H        MET  40  23.823   6.184   9.061
    2    HA   MET  40           HA       MET  40  23.368   3.482   8.320
    3    HB2  MET  40           HB2      MET  40  21.571   5.520   9.649
    4    HB3  MET  40           HB3      MET  40  21.162   3.812   9.472
    5    HG2  MET  40           HG2      MET  40  23.731   4.746  10.780
    6    HG3  MET  40           HG3      MET  40  22.250   4.466  11.694
    7    HE3  MET  40           HE1      MET  40  21.688   0.832  11.860
    8    HE2  MET  40           HE2      MET  40  20.808   2.139  11.072
    9    HE1  MET  40           HE3      MET  40  21.572   2.418  12.635

  No H/Q in entry =           9
  In of MODEL   63
    1    H    MET  41           H        MET  41  21.937   6.541   7.169
    2    HA   MET  41           HA       MET  41  19.956   5.355   5.520
    3    HB2  MET  41           HB2      MET  41  21.429   7.947   4.998
    4    HB3  MET  41           HB3      MET  41  19.890   7.457   4.300
    5    HG2  MET  41           HG2      MET  41  19.182   7.256   6.861
    6    HG3  MET  41           HG3      MET  41  20.494   8.413   7.069
    7    HE2  MET  41           HE1      MET  41  19.882   9.717   3.747
    8    HE1  MET  41           HE2      MET  41  20.860  10.150   5.147
    9    HE3  MET  41           HE3      MET  41  19.579  11.232   4.607

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ASP  42           H        ASP  42  23.319   6.281   4.922
    2    HA   ASP  42           HA       ASP  42  23.371   5.820   2.161
    3    HB2  ASP  42           HB2      ASP  42  25.148   6.809   3.909
    4    HB3  ASP  42           HB3      ASP  42  25.803   5.185   3.764

  No H/Q in entry =           4
  In of MODEL   63
    1    H    GLN  43           H        GLN  43  24.135   3.652   4.860
    2    HA   GLN  43           HA       GLN  43  24.777   1.403   3.256
    3    HB2  GLN  43           HB2      GLN  43  23.796   1.572   6.116
    4    HB3  GLN  43           HB3      GLN  43  24.364   0.087   5.345
    5    HG2  GLN  43           HG2      GLN  43  26.519   1.301   4.808
    6    HG3  GLN  43           HG3      GLN  43  25.951   2.623   5.822
    7   HE21  GLN  43          HE21      GLN  43  28.200   1.645   6.821
    8   HE22  GLN  43          HE22      GLN  43  27.944   0.556   8.096

  No H/Q in entry =           8
  In of MODEL   63
    1    H    SER  44           H        SER  44  21.741   2.529   4.692
    2    HA   SER  44           HA       SER  44  20.163   0.288   4.032
    3    HB2  SER  44           HB2      SER  44  19.738   2.811   5.196
    4    HB3  SER  44           HB3      SER  44  18.683   2.775   3.786
    5    HG   SER  44           HG       SER  44  17.615   1.823   5.521

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ARG  45           H        ARG  45  20.879   3.262   2.231
    2    HA   ARG  45           HA       ARG  45  19.320   2.787  -0.053
    3    HB2  ARG  45           HB2      ARG  45  20.472   4.921   0.524
    4    HB3  ARG  45           HB3      ARG  45  22.010   4.168   0.112
    5    HG2  ARG  45           HG2      ARG  45  21.193   3.774  -2.192
    6    HG3  ARG  45           HG3      ARG  45  19.666   4.549  -1.779
    7    HD2  ARG  45           HD2      ARG  45  20.925   6.643  -1.203
    8    HD3  ARG  45           HD3      ARG  45  22.413   5.873  -1.798
    9    HE   ARG  45           HE       ARG  45  20.452   5.645  -3.806
   10   HH21  ARG  45          HH11      ARG  45  20.419   7.022  -5.562
   11   HH22  ARG  45          HH12      ARG  45  21.177   8.572  -5.462
   12   HH11  ARG  45          HH21      ARG  45  22.207   8.135  -2.193
   13   HH12  ARG  45          HH22      ARG  45  22.189   9.201  -3.551

  No H/Q in entry =          13
  In of MODEL   63
    1    H    MET  46           H        MET  46  22.694   1.909   0.639
    2    HA   MET  46           HA       MET  46  23.262   0.728  -1.860
    3    HB2  MET  46           HB2      MET  46  24.411   0.380   0.911
    4    HB3  MET  46           HB3      MET  46  25.049  -0.495  -0.484
    5    HG2  MET  46           HG2      MET  46  25.435   1.646  -1.654
    6    HG3  MET  46           HG3      MET  46  24.799   2.522  -0.267
    7    HE1  MET  46           HE1      MET  46  26.670   3.960  -0.048
    8    HE3  MET  46           HE2      MET  46  27.752   3.310  -1.276
    9    HE2  MET  46           HE3      MET  46  28.340   3.552   0.368

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ALA  47           H        ALA  47  21.924  -0.619   1.131
    2    HA   ALA  47           HA       ALA  47  21.856  -3.328   0.316
    3    HB2  ALA  47           HB1      ALA  47  21.513  -2.878   2.628
    4    HB3  ALA  47           HB2      ALA  47  19.967  -3.477   2.030
    5    HB1  ALA  47           HB3      ALA  47  20.202  -1.748   2.293

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LEU  48           H        LEU  48  19.500  -0.698   0.008
    2    HA   LEU  48           HA       LEU  48  17.435  -2.223  -1.218
    3    HB2  LEU  48           HB2      LEU  48  18.090   0.731  -1.329
    4    HB3  LEU  48           HB3      LEU  48  16.609   0.025  -1.976
    5    HG   LEU  48           HG       LEU  48  17.507  -0.291   0.897
    6   HD13  LEU  48          HD11      LEU  48  17.088   2.011   0.727
    7   HD12  LEU  48          HD12      LEU  48  15.537   1.363   1.258
    8   HD11  LEU  48          HD13      LEU  48  15.783   1.792  -0.435
    9   HD22  LEU  48          HD21      LEU  48  15.970  -2.002   0.533
   10   HD21  LEU  48          HD22      LEU  48  15.078  -1.093  -0.688
   11   HD23  LEU  48          HD23      LEU  48  14.893  -0.696   1.021

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ASN  49           H        ASN  49  20.106  -0.293  -2.482
    2    HA   ASN  49           HA       ASN  49  19.412  -0.363  -5.196
    3    HB2  ASN  49           HB2      ASN  49  21.113   1.139  -4.261
    4    HB3  ASN  49           HB3      ASN  49  22.154  -0.235  -3.907
    5   HD21  ASN  49          HD21      ASN  49  23.829   0.582  -5.337
    6   HD22  ASN  49          HD22      ASN  49  23.652   0.530  -7.023

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLU  50           H        GLU  50  21.424  -2.569  -3.275
    2    HA   GLU  50           HA       GLU  50  22.089  -4.316  -5.420
    3    HB2  GLU  50           HB2      GLU  50  23.321  -4.302  -3.272
    4    HB3  GLU  50           HB3      GLU  50  21.891  -4.932  -2.456
    5    HG2  GLU  50           HG2      GLU  50  21.955  -6.959  -3.825
    6    HG3  GLU  50           HG3      GLU  50  23.318  -6.324  -4.745

  No H/Q in entry =           6
  In of MODEL   63
    1    H    ALA  51           H        ALA  51  19.470  -4.257  -3.051
    2    HA   ALA  51           HA       ALA  51  18.289  -6.725  -3.800
    3    HB3  ALA  51           HB1      ALA  51  16.722  -6.224  -2.217
    4    HB1  ALA  51           HB2      ALA  51  16.502  -4.575  -2.805
    5    HB2  ALA  51           HB3      ALA  51  17.877  -4.968  -1.773

  No H/Q in entry =           5
  In of MODEL   63
    1    H    HIS  52           H        HIS  52  17.691  -3.372  -4.811
    2    HA   HIS  52           HA       HIS  52  15.548  -3.888  -6.579
    3    HB2  HIS  52           HB2      HIS  52  16.137  -1.627  -5.818
    4    HB3  HIS  52           HB3      HIS  52  17.656  -1.717  -6.708
    5    HD1  HIS  52           HD1      HIS  52  17.329  -2.173  -9.404
    6    HD2  HIS  52           HD2      HIS  52  14.039  -0.658  -7.340
    7    HE1  HIS  52           HE1      HIS  52  15.767  -1.213 -11.151
    8    HE2  HIS  52           HE2      HIS  52  13.757  -0.284  -9.909

  No H/Q in entry =           8
  In of MODEL   63
    1    H    LEU  53           H        LEU  53  19.059  -3.897  -7.068
    2    HA   LEU  53           HA       LEU  53  19.071  -4.201  -9.870
    3    HB2  LEU  53           HB2      LEU  53  21.037  -4.978  -7.732
    4    HB3  LEU  53           HB3      LEU  53  21.326  -5.351  -9.429
    5    HG   LEU  53           HG       LEU  53  20.665  -2.548  -8.476
    6   HD11  LEU  53          HD11      LEU  53  23.333  -3.949  -8.739
    7   HD13  LEU  53          HD12      LEU  53  22.695  -3.080  -7.344
    8   HD12  LEU  53          HD13      LEU  53  23.181  -2.195  -8.785
    9   HD23  LEU  53          HD21      LEU  53  22.059  -2.082 -10.639
   10   HD22  LEU  53          HD22      LEU  53  20.390  -2.615 -10.816
   11   HD21  LEU  53          HD23      LEU  53  21.701  -3.755 -11.051

  No H/Q in entry =          11
  In of MODEL   63
    1    H    VAL  54           H        VAL  54  18.998  -6.598  -7.253
    2    HA   VAL  54           HA       VAL  54  19.092  -8.886  -8.924
    3    HB   VAL  54           HB       VAL  54  17.983  -8.472  -6.136
    4   HG12  VAL  54          HG11      VAL  54  18.305 -11.090  -6.148
    5   HG11  VAL  54          HG12      VAL  54  18.092 -10.915  -7.889
    6   HG13  VAL  54          HG13      VAL  54  16.821 -10.387  -6.788
    7   HG22  VAL  54          HG21      VAL  54  20.302  -8.265  -5.950
    8   HG21  VAL  54          HG22      VAL  54  20.617  -9.351  -7.301
    9   HG23  VAL  54          HG23      VAL  54  20.111 -10.004  -5.743

  No H/Q in entry =           9
  In of MODEL   63
    1    H    GLN  55           H        GLN  55  16.386  -6.986  -7.589
    2    HA   GLN  55           HA       GLN  55  14.347  -8.644  -8.637
    3    HB2  GLN  55           HB2      GLN  55  13.626  -7.125  -6.992
    4    HB3  GLN  55           HB3      GLN  55  14.407  -5.754  -7.776
    5    HG2  GLN  55           HG2      GLN  55  12.659  -5.422  -9.236
    6    HG3  GLN  55           HG3      GLN  55  12.334  -7.142  -9.408
    7   HE21  GLN  55          HE21      GLN  55  10.340  -7.693  -8.572
    8   HE22  GLN  55          HE22      GLN  55   9.588  -6.944  -7.249

  No H/Q in entry =           8
  In of MODEL   63
    1    H    THR  56           H        THR  56  16.066  -5.840 -10.013
    2    HA   THR  56           HA       THR  56  14.590  -5.468 -12.337
    3    HB   THR  56           HB       THR  56  17.596  -5.311 -11.992
    4    HG1  THR  56           HG1      THR  56  15.592  -3.308 -11.940
    5   HG22  THR  56          HG21      THR  56  17.206  -3.598 -13.934
    6   HG21  THR  56          HG22      THR  56  15.739  -4.531 -14.220
    7   HG23  THR  56          HG23      THR  56  17.315  -5.319 -14.310

  No H/Q in entry =           7
  In of MODEL   63
    1    H    LYS  57           H        LYS  57  17.249  -7.769 -11.777
    2    HA   LYS  57           HA       LYS  57  17.207  -8.953 -14.360
    3    HB2  LYS  57           HB2      LYS  57  19.055  -9.249 -12.741
    4    HB3  LYS  57           HB3      LYS  57  17.974 -10.118 -11.661
    5    HG2  LYS  57           HG2      LYS  57  19.267 -11.757 -12.853
    6    HG3  LYS  57           HG3      LYS  57  17.627 -11.818 -13.489
    7    HD2  LYS  57           HD2      LYS  57  18.245 -10.613 -15.462
    8    HD3  LYS  57           HD3      LYS  57  19.813 -10.173 -14.789
    9    HE2  LYS  57           HE2      LYS  57  20.209 -11.988 -16.325
   10    HE3  LYS  57           HE3      LYS  57  20.356 -12.670 -14.706
   11    HZ1  LYS  57           HZ1      LYS  57  17.677 -12.710 -15.755
   12    HZ3  LYS  57           HZ2      LYS  57  18.569 -13.939 -14.997
   13    HZ2  LYS  57           HZ3      LYS  57  18.774 -13.639 -16.655

  No H/Q in entry =          13
  In of MODEL   63
    1    H    LEU  58           H        LEU  58  15.475  -9.632 -11.358
    2    HA   LEU  58           HA       LEU  58  14.238 -12.002 -12.282
    3    HB2  LEU  58           HB2      LEU  58  13.479 -10.105 -10.066
    4    HB3  LEU  58           HB3      LEU  58  12.668 -11.641 -10.375
    5    HG   LEU  58           HG       LEU  58  15.649 -11.365  -9.868
    6   HD11  LEU  58          HD11      LEU  58  13.308 -11.789  -8.039
    7   HD13  LEU  58          HD12      LEU  58  14.765 -10.827  -7.796
    8   HD12  LEU  58          HD13      LEU  58  14.840 -12.584  -7.669
    9   HD22  LEU  58          HD21      LEU  58  15.515 -13.423 -10.901
   10   HD21  LEU  58          HD22      LEU  58  13.807 -13.634 -10.514
   11   HD23  LEU  58          HD23      LEU  58  15.036 -13.939  -9.285

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  59           H        ILE  59  13.556  -8.662 -12.941
    2    HA   ILE  59           HA       ILE  59  10.825  -9.308 -13.839
    3    HB   ILE  59           HB       ILE  59  11.649  -7.031 -12.638
    4   HG12  ILE  59          HG12      ILE  59   9.708  -6.886 -14.955
    5   HG13  ILE  59          HG13      ILE  59   9.311  -7.680 -13.454
    6   HG21  ILE  59          HG21      ILE  59  13.156  -6.629 -14.728
    7   HG23  ILE  59          HG22      ILE  59  12.200  -5.289 -14.135
    8   HG22  ILE  59          HG23      ILE  59  11.668  -6.207 -15.541
    9   HD12  ILE  59          HD11      ILE  59  10.117  -4.792 -13.782
   10   HD11  ILE  59          HD12      ILE  59   9.857  -5.575 -12.224
   11   HD13  ILE  59          HD13      ILE  59   8.512  -5.386 -13.351

  No H/Q in entry =          11
  In of MODEL   63
    1    H    GLU  60           H        GLU  60  14.008  -8.451 -15.146
    2    HA   GLU  60           HA       GLU  60  13.184  -8.041 -17.840
    3    HB2  GLU  60           HB2      GLU  60  15.438  -7.898 -18.328
    4    HB3  GLU  60           HB3      GLU  60  15.485  -7.603 -16.593
    5    HG2  GLU  60           HG2      GLU  60  17.142  -9.250 -16.894
    6    HG3  GLU  60           HG3      GLU  60  15.737 -10.187 -16.389

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLY  61           H        GLY  61  14.191 -10.929 -16.052
    2    HA3  GLY  61           HA2      GLY  61  13.611 -12.568 -18.450
    3    HA2  GLY  61           HA3      GLY  61  14.665 -13.054 -17.127

  No H/Q in entry =           3
  In of MODEL   63
    1    H    ASP  62           H        ASP  62  11.552 -11.510 -16.698
    2    HA   ASP  62           HA       ASP  62  10.636 -13.395 -14.829
    3    HB2  ASP  62           HB2      ASP  62   9.872 -11.010 -15.100
    4    HB3  ASP  62           HB3      ASP  62   8.922 -11.543 -16.483

  No H/Q in entry =           4
  In of MODEL   63
    1    H    ALA  63           H        ALA  63   9.963 -13.131 -18.338
    2    HA   ALA  63           HA       ALA  63   7.922 -15.053 -18.544
    3    HB1  ALA  63           HB1      ALA  63   8.549 -15.241 -20.879
    4    HB2  ALA  63           HB2      ALA  63  10.144 -14.570 -20.546
    5    HB3  ALA  63           HB3      ALA  63   8.711 -13.555 -20.390

  No H/Q in entry =           5
  In of MODEL   63
    1    H    GLY  64           H        GLY  64   8.830 -17.014 -20.251
    2    HA3  GLY  64           HA2      GLY  64  10.348 -18.868 -20.383
    3    HA2  GLY  64           HA3      GLY  64  10.817 -18.554 -18.718

  No H/Q in entry =           3
  In of MODEL   63
    1    H    GLU  65           H        GLU  65   8.209 -18.316 -17.592
    2    HA   GLU  65           HA       GLU  65   7.654 -21.066 -17.163
    3    HB2  GLU  65           HB2      GLU  65   6.144 -18.584 -16.354
    4    HB3  GLU  65           HB3      GLU  65   5.725 -20.212 -15.821
    5    HG2  GLU  65           HG2      GLU  65   7.112 -19.498 -14.088
    6    HG3  GLU  65           HG3      GLU  65   8.254 -20.344 -15.132

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLY  66           H        GLY  66   6.077 -18.584 -19.024
    2    HA3  GLY  66           HA2      GLY  66   4.853 -20.403 -20.824
    3    HA2  GLY  66           HA3      GLY  66   3.668 -19.743 -19.716

  No H/Q in entry =           3
  In of MODEL   63
    1    H    LYS  67           H        LYS  67   3.087 -19.247 -22.165
    2    HA   LYS  67           HA       LYS  67   4.258 -17.249 -23.630
    3    HB2  LYS  67           HB2      LYS  67   1.351 -17.993 -23.358
    4    HB3  LYS  67           HB3      LYS  67   1.970 -16.896 -24.597
    5    HG2  LYS  67           HG2      LYS  67   3.562 -18.656 -25.333
    6    HG3  LYS  67           HG3      LYS  67   2.875 -19.755 -24.139
    7    HD2  LYS  67           HD2      LYS  67   1.199 -18.435 -26.282
    8    HD3  LYS  67           HD3      LYS  67   1.977 -20.003 -26.512
    9    HE2  LYS  67           HE2      LYS  67   0.844 -20.736 -24.346
   10    HE3  LYS  67           HE3      LYS  67  -0.114 -19.261 -24.456
   11    HZ2  LYS  67           HZ1      LYS  67  -0.031 -21.518 -26.369
   12    HZ1  LYS  67           HZ2      LYS  67  -0.710 -20.012 -26.761
   13    HZ3  LYS  67           HZ3      LYS  67  -1.363 -20.939 -25.495

  No H/Q in entry =          13
  In of MODEL   63
    1    H    MET  68           H        MET  68   1.432 -16.709 -21.591
    2    HA   MET  68           HA       MET  68   2.111 -13.858 -21.336
    3    HB2  MET  68           HB2      MET  68  -0.486 -15.357 -21.005
    4    HB3  MET  68           HB3      MET  68  -0.287 -13.642 -20.646
    5    HG2  MET  68           HG2      MET  68   0.333 -14.909 -23.328
    6    HG3  MET  68           HG3      MET  68  -1.163 -14.054 -22.950
    7    HE1  MET  68           HE1      MET  68   0.389 -13.396 -25.310
    8    HE3  MET  68           HE2      MET  68   2.042 -13.638 -24.752
    9    HE2  MET  68           HE3      MET  68   1.523 -12.039 -25.280

  No H/Q in entry =           9
  In of MODEL   63
    1    H    LYS  69           H        LYS  69   2.315 -16.673 -19.473
    2    HA   LYS  69           HA       LYS  69   1.564 -15.489 -16.954
    3    HB2  LYS  69           HB2      LYS  69   2.776 -18.159 -17.659
    4    HB3  LYS  69           HB3      LYS  69   2.372 -17.676 -16.010
    5    HG2  LYS  69           HG2      LYS  69   0.038 -17.286 -16.676
    6    HG3  LYS  69           HG3      LYS  69   0.429 -17.731 -18.337
    7    HD2  LYS  69           HD2      LYS  69   1.112 -19.988 -17.541
    8    HD3  LYS  69           HD3      LYS  69   0.616 -19.535 -15.907
    9    HE2  LYS  69           HE2      LYS  69  -1.226 -19.461 -18.314
   10    HE3  LYS  69           HE3      LYS  69  -1.144 -20.808 -17.180
   11    HZ3  LYS  69           HZ1      LYS  69  -2.610 -19.699 -15.966
   12    HZ2  LYS  69           HZ2      LYS  69  -2.448 -18.291 -16.902
   13    HZ1  LYS  69           HZ3      LYS  69  -1.387 -18.581 -15.607

  No H/Q in entry =          13
  In of MODEL   63
    1    H    VAL  70           H        VAL  70   2.828 -15.025 -15.133
    2    HA   VAL  70           HA       VAL  70   5.754 -14.835 -15.545
    3    HB   VAL  70           HB       VAL  70   5.686 -12.638 -14.380
    4   HG11  VAL  70          HG11      VAL  70   4.032 -12.912 -16.905
    5   HG13  VAL  70          HG12      VAL  70   5.772 -12.644 -16.805
    6   HG12  VAL  70          HG13      VAL  70   4.655 -11.377 -16.301
    7   HG23  VAL  70          HG21      VAL  70   3.400 -11.506 -14.279
    8   HG22  VAL  70          HG22      VAL  70   3.638 -12.813 -13.120
    9   HG21  VAL  70          HG23      VAL  70   2.685 -13.091 -14.577

  No H/Q in entry =           9
  In of MODEL   63
    1    H    SER  71           H        SER  71   6.941 -14.613 -13.497
    2    HA   SER  71           HA       SER  71   6.214 -16.549 -11.565
    3    HB2  SER  71           HB2      SER  71   8.554 -15.726 -12.060
    4    HB3  SER  71           HB3      SER  71   8.152 -14.259 -11.169
    5    HG   SER  71           HG       SER  71   9.145 -15.900  -9.870

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LEU  72           H        LEU  72   4.777 -16.410  -9.984
    2    HA   LEU  72           HA       LEU  72   3.234 -14.099  -9.506
    3    HB2  LEU  72           HB2      LEU  72   3.547 -16.667  -7.959
    4    HB3  LEU  72           HB3      LEU  72   2.391 -15.410  -7.522
    5    HG   LEU  72           HG       LEU  72   2.487 -16.681 -10.278
    6   HD13  LEU  72          HD11      LEU  72   0.729 -18.155  -9.598
    7   HD12  LEU  72          HD12      LEU  72   0.538 -17.324  -8.055
    8   HD11  LEU  72          HD13      LEU  72   1.981 -18.290  -8.362
    9   HD22  LEU  72          HD21      LEU  72   1.263 -14.687 -10.482
   10   HD21  LEU  72          HD22      LEU  72   0.622 -14.781  -8.850
   11   HD23  LEU  72          HD23      LEU  72  -0.003 -15.848 -10.104

  No H/Q in entry =          11
  In of MODEL   63
    1    H    VAL  73           H        VAL  73   5.918 -15.543  -7.781
    2    HA   VAL  73           HA       VAL  73   5.894 -14.020  -5.441
    3    HB   VAL  73           HB       VAL  73   8.091 -14.824  -5.058
    4   HG13  VAL  73          HG11      VAL  73   7.765 -17.144  -5.319
    5   HG12  VAL  73          HG12      VAL  73   6.925 -16.943  -6.856
    6   HG11  VAL  73          HG13      VAL  73   6.128 -16.494  -5.350
    7   HG23  VAL  73          HG21      VAL  73   9.196 -16.021  -7.152
    8   HG22  VAL  73          HG22      VAL  73   9.402 -14.289  -6.897
    9   HG21  VAL  73          HG23      VAL  73   8.204 -14.873  -8.052

  No H/Q in entry =           9
  In of MODEL   63
    1    H    LEU  74           H        LEU  74   6.834 -13.113  -8.628
    2    HA   LEU  74           HA       LEU  74   8.787 -11.166  -8.157
    3    HB2  LEU  74           HB2      LEU  74   8.286 -11.915 -10.391
    4    HB3  LEU  74           HB3      LEU  74   6.630 -11.325 -10.263
    5    HG   LEU  74           HG       LEU  74   7.526  -9.004  -9.988
    6   HD13  LEU  74          HD11      LEU  74   9.717  -9.299  -9.141
    7   HD12  LEU  74          HD12      LEU  74   9.975  -8.799 -10.810
    8   HD11  LEU  74          HD13      LEU  74  10.122 -10.499 -10.367
    9   HD23  LEU  74          HD21      LEU  74   8.695 -10.177 -12.474
   10   HD22  LEU  74          HD22      LEU  74   7.756  -8.718 -12.254
   11   HD21  LEU  74          HD23      LEU  74   6.956 -10.274 -12.200

  No H/Q in entry =          11
  In of MODEL   63
    1    H    VAL  75           H        VAL  75   5.286 -10.780  -8.456
    2    HA   VAL  75           HA       VAL  75   5.199  -8.026  -7.856
    3    HB   VAL  75           HB       VAL  75   3.114 -10.168  -7.438
    4   HG12  VAL  75          HG11      VAL  75   1.537  -8.203  -7.330
    5   HG11  VAL  75          HG12      VAL  75   2.934  -7.137  -7.293
    6   HG13  VAL  75          HG13      VAL  75   2.654  -8.256  -5.968
    7   HG21  VAL  75          HG21      VAL  75   3.912  -9.708  -9.781
    8   HG23  VAL  75          HG22      VAL  75   3.431  -8.026  -9.568
    9   HG22  VAL  75          HG23      VAL  75   2.214  -9.302  -9.535

  No H/Q in entry =           9
  In of MODEL   63
    1    H    GLU  76           H        GLU  76   4.977 -10.912  -5.755
    2    HA   GLU  76           HA       GLU  76   4.543  -9.562  -3.321
    3    HB2  GLU  76           HB2      GLU  76   4.367 -12.030  -3.569
    4    HB3  GLU  76           HB3      GLU  76   6.101 -12.124  -3.824
    5    HG2  GLU  76           HG2      GLU  76   5.680 -12.715  -1.525
    6    HG3  GLU  76           HG3      GLU  76   6.422 -11.126  -1.513

  No H/Q in entry =           6
  In of MODEL   63
    1    H    ALA  77           H        ALA  77   7.579 -10.462  -4.933
    2    HA   ALA  77           HA       ALA  77   9.298  -9.428  -2.937
    3    HB2  ALA  77           HB1      ALA  77  10.958  -9.305  -4.893
    4    HB3  ALA  77           HB2      ALA  77   9.657  -9.973  -5.880
    5    HB1  ALA  77           HB3      ALA  77  10.283 -10.890  -4.511

  No H/Q in entry =           5
  In of MODEL   63
    1    H    GLN  78           H        GLN  78   7.864  -7.997  -5.825
    2    HA   GLN  78           HA       GLN  78   9.219  -5.519  -5.729
    3    HB2  GLN  78           HB2      GLN  78   7.897  -6.420  -7.673
    4    HB3  GLN  78           HB3      GLN  78   6.426  -6.056  -6.775
    5    HG2  GLN  78           HG2      GLN  78   7.057  -3.684  -6.678
    6    HG3  GLN  78           HG3      GLN  78   8.545  -4.035  -7.556
    7   HE21  GLN  78          HE21      GLN  78   6.642  -2.219  -8.650
    8   HE22  GLN  78          HE22      GLN  78   5.938  -2.930 -10.021

  No H/Q in entry =           8
  In of MODEL   63
    1    H    LEU  79           H        LEU  79   6.220  -6.662  -4.261
    2    HA   LEU  79           HA       LEU  79   5.242  -4.258  -3.227
    3    HB2  LEU  79           HB2      LEU  79   3.927  -6.309  -3.162
    4    HB3  LEU  79           HB3      LEU  79   5.087  -7.054  -2.066
    5    HG   LEU  79           HG       LEU  79   4.560  -5.419  -0.324
    6   HD13  LEU  79          HD11      LEU  79   4.081  -3.400  -1.360
    7   HD12  LEU  79          HD12      LEU  79   2.462  -3.926  -0.900
    8   HD11  LEU  79          HD13      LEU  79   3.019  -4.142  -2.557
    9   HD23  LEU  79          HD21      LEU  79   1.975  -5.910  -0.200
   10   HD22  LEU  79          HD22      LEU  79   3.115  -7.251  -0.113
   11   HD21  LEU  79          HD23      LEU  79   2.280  -6.906  -1.625

  No H/Q in entry =          11
  In of MODEL   63
    1    H    HIS  80           H        HIS  80   7.445  -6.602  -1.685
    2    HA   HIS  80           HA       HIS  80   7.767  -5.070   0.686
    3    HB2  HIS  80           HB2      HIS  80   9.086  -7.430  -0.541
    4    HB3  HIS  80           HB3      HIS  80  10.014  -6.540   0.666
    5    HD1  HIS  80           HD1      HIS  80   9.556  -7.185   3.013
    6    HD2  HIS  80           HD2      HIS  80   6.304  -8.022   0.542
    7    HE1  HIS  80           HE1      HIS  80   7.803  -8.293   4.481
    8    HE2  HIS  80           HE2      HIS  80   5.814  -8.807   2.983

  No H/Q in entry =           8
  In of MODEL   63
    1    H    LEU  81           H        LEU  81   9.732  -5.336  -2.255
    2    HA   LEU  81           HA       LEU  81  11.790  -3.601  -1.397
    3    HB2  LEU  81           HB2      LEU  81  10.830  -4.381  -4.150
    4    HB3  LEU  81           HB3      LEU  81  12.255  -3.377  -3.875
    5    HG   LEU  81           HG       LEU  81  11.876  -6.103  -2.608
    6   HD12  LEU  81          HD11      LEU  81  13.667  -6.724  -4.385
    7   HD11  LEU  81          HD12      LEU  81  13.092  -5.296  -5.243
    8   HD13  LEU  81          HD13      LEU  81  11.983  -6.620  -4.895
    9   HD23  LEU  81          HD21      LEU  81  14.505  -5.792  -2.629
   10   HD22  LEU  81          HD22      LEU  81  13.541  -5.035  -1.362
   11   HD21  LEU  81          HD23      LEU  81  14.102  -4.078  -2.732

  No H/Q in entry =          11
  In of MODEL   63
    1    H    MET  82           H        MET  82   8.842  -2.952  -3.291
    2    HA   MET  82           HA       MET  82   9.379  -0.225  -3.787
    3    HB2  MET  82           HB2      MET  82   6.819  -1.815  -3.634
    4    HB3  MET  82           HB3      MET  82   6.817  -0.089  -3.991
    5    HG2  MET  82           HG2      MET  82   8.393  -2.158  -5.557
    6    HG3  MET  82           HG3      MET  82   6.820  -1.531  -6.045
    7    HE3  MET  82           HE1      MET  82   7.258   1.928  -7.208
    8    HE2  MET  82           HE2      MET  82   6.906   1.695  -5.498
    9    HE1  MET  82           HE3      MET  82   6.223   0.592  -6.688

  No H/Q in entry =           9
  In of MODEL   63
    1    H    THR  83           H        THR  83   7.620  -1.831  -1.165
    2    HA   THR  83           HA       THR  83   6.791   0.513   0.183
    3    HB   THR  83           HB       THR  83   6.681  -1.070   2.196
    4    HG1  THR  83           HG1      THR  83   7.431  -3.021   1.947
    5   HG22  THR  83          HG21      THR  83   5.005  -2.626   0.743
    6   HG21  THR  83          HG22      THR  83   5.219  -1.293  -0.386
    7   HG23  THR  83          HG23      THR  83   4.601  -0.984   1.237

  No H/Q in entry =           7
  In of MODEL   63
    1    H    SER  84           H        SER  84   9.618  -1.593   0.656
    2    HA   SER  84           HA       SER  84  10.709  -0.174   2.836
    3    HB2  SER  84           HB2      SER  84  11.931  -2.011   0.787
    4    HB3  SER  84           HB3      SER  84  12.897  -1.265   2.059
    5    HG   SER  84           HG       SER  84  10.622  -2.951   2.341

  No H/Q in entry =           5
  In of MODEL   63
    1    H    MET  85           H        MET  85  11.416   0.101  -0.660
    2    HA   MET  85           HA       MET  85  13.422   2.060  -0.428
    3    HB2  MET  85           HB2      MET  85  13.000   0.791  -2.493
    4    HB3  MET  85           HB3      MET  85  11.467   1.640  -2.698
    5    HG2  MET  85           HG2      MET  85  12.664   3.792  -2.822
    6    HG3  MET  85           HG3      MET  85  14.197   2.955  -2.597
    7    HE1  MET  85           HE1      MET  85  15.000   1.001  -4.129
    8    HE3  MET  85           HE2      MET  85  15.677   2.576  -4.539
    9    HE2  MET  85           HE3      MET  85  15.167   1.488  -5.823

  No H/Q in entry =           9
  In of MODEL   63
    1    H    LEU  86           H        LEU  86   9.927   2.405  -0.888
    2    HA   LEU  86           HA       LEU  86   9.867   5.219  -1.057
    3    HB2  LEU  86           HB2      LEU  86   8.011   3.567  -1.615
    4    HB3  LEU  86           HB3      LEU  86   7.705   3.470   0.119
    5    HG   LEU  86           HG       LEU  86   7.550   6.031   0.080
    6   HD11  LEU  86          HD11      LEU  86   8.288   5.605  -2.634
    7   HD13  LEU  86          HD12      LEU  86   7.866   7.131  -1.861
    8   HD12  LEU  86          HD13      LEU  86   6.617   6.174  -2.654
    9   HD23  LEU  86          HD21      LEU  86   5.390   4.692  -1.560
   10   HD22  LEU  86          HD22      LEU  86   5.220   5.947  -0.335
   11   HD21  LEU  86          HD23      LEU  86   5.621   4.299   0.145

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ALA  87           H        ALA  87   9.433   3.030   1.686
    2    HA   ALA  87           HA       ALA  87   8.916   4.937   3.671
    3    HB1  ALA  87           HB1      ALA  87   9.714   2.115   3.561
    4    HB3  ALA  87           HB2      ALA  87   8.606   2.925   4.666
    5    HB2  ALA  87           HB3      ALA  87  10.339   2.950   4.986

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ARG  88           H        ARG  88  11.982   3.508   2.642
    2    HA   ARG  88           HA       ARG  88  13.620   4.874   4.458
    3    HB2  ARG  88           HB2      ARG  88  14.264   2.904   3.037
    4    HB3  ARG  88           HB3      ARG  88  14.401   4.003   1.667
    5    HG2  ARG  88           HG2      ARG  88  15.904   5.304   3.599
    6    HG3  ARG  88           HG3      ARG  88  16.225   3.612   3.966
    7    HD2  ARG  88           HD2      ARG  88  17.465   3.320   2.101
    8    HD3  ARG  88           HD3      ARG  88  16.317   4.200   1.087
    9    HE   ARG  88           HE       ARG  88  18.729   5.252   2.106
   10   HH21  ARG  88          HH11      ARG  88  19.078   7.471   1.916
   11   HH22  ARG  88          HH12      ARG  88  17.728   8.547   1.796
   12   HH11  ARG  88          HH21      ARG  88  15.388   6.016   1.877
   13   HH12  ARG  88          HH22      ARG  88  15.637   7.720   1.750

  No H/Q in entry =          13
  In of MODEL   63
    1    H    GLU  89           H        GLU  89  12.604   5.789   1.153
    2    HA   GLU  89           HA       GLU  89  14.155   8.145   0.985
    3    HB2  GLU  89           HB2      GLU  89  12.981   7.116  -0.951
    4    HB3  GLU  89           HB3      GLU  89  11.447   7.659  -0.270
    5    HG2  GLU  89           HG2      GLU  89  12.153   9.995  -0.432
    6    HG3  GLU  89           HG3      GLU  89  13.748   9.502  -0.993

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LEU  90           H        LEU  90  10.840   7.640   2.158
    2    HA   LEU  90           HA       LEU  90  10.341  10.372   2.753
    3    HB2  LEU  90           HB2      LEU  90   9.153   7.798   3.785
    4    HB3  LEU  90           HB3      LEU  90   8.533   9.393   4.224
    5    HG   LEU  90           HG       LEU  90   8.909   8.524   1.345
    6   HD12  LEU  90          HD11      LEU  90   6.375   8.202   1.441
    7   HD11  LEU  90          HD12      LEU  90   6.554   8.184   3.196
    8   HD13  LEU  90          HD13      LEU  90   7.356   6.956   2.215
    9   HD22  LEU  90          HD21      LEU  90   8.620  10.833   1.286
   10   HD21  LEU  90          HD22      LEU  90   7.654  10.862   2.760
   11   HD23  LEU  90          HD23      LEU  90   6.935  10.316   1.246

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  91           H        ILE  91  11.623   7.679   4.645
    2    HA   ILE  91           HA       ILE  91  11.802   9.033   7.117
    3    HB   ILE  91           HB       ILE  91  13.333   6.695   5.962
    4   HG12  ILE  91          HG12      ILE  91  11.349   6.858   8.250
    5   HG13  ILE  91          HG13      ILE  91  10.854   6.586   6.580
    6   HG22  ILE  91          HG21      ILE  91  13.839   6.468   8.595
    7   HG21  ILE  91          HG22      ILE  91  13.767   8.228   8.503
    8   HG23  ILE  91          HG23      ILE  91  14.929   7.341   7.518
    9   HD13  ILE  91          HD11      ILE  91  11.850   4.481   6.487
   10   HD12  ILE  91          HD12      ILE  91  11.280   4.534   8.155
   11   HD11  ILE  91          HD13      ILE  91  12.978   4.844   7.794

  No H/Q in entry =          11
  In of MODEL   63
    1    H    THR  92           H        THR  92  13.979   8.870   4.334
    2    HA   THR  92           HA       THR  92  16.164  10.252   5.469
    3    HB   THR  92           HB       THR  92  15.138  10.142   2.622
    4    HG1  THR  92           HG1      THR  92  15.970   8.241   3.007
    5   HG22  THR  92          HG21      THR  92  17.706  10.827   2.296
    6   HG21  THR  92          HG22      THR  92  17.421  11.642   3.833
    7   HG23  THR  92          HG23      THR  92  16.432  12.038   2.428

  No H/Q in entry =           7
  In of MODEL   63
    1    H    GLU  93           H        GLU  93  13.257  11.421   3.786
    2    HA   GLU  93           HA       GLU  93  13.860  14.179   3.904
    3    HB2  GLU  93           HB2      GLU  93  11.153  12.814   3.950
    4    HB3  GLU  93           HB3      GLU  93  11.440  14.514   3.582
    5    HG2  GLU  93           HG2      GLU  93  12.750  12.275   2.026
    6    HG3  GLU  93           HG3      GLU  93  11.199  12.964   1.563

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LEU  94           H        LEU  94  12.143  12.018   6.130
    2    HA   LEU  94           HA       LEU  94  11.365  13.958   8.026
    3    HB2  LEU  94           HB2      LEU  94  11.937  11.000   8.279
    4    HB3  LEU  94           HB3      LEU  94  11.387  11.971   9.641
    5    HG   LEU  94           HG       LEU  94   9.866  12.039   7.034
    6   HD11  LEU  94          HD11      LEU  94   9.971   9.809   9.027
    7   HD13  LEU  94          HD12      LEU  94   9.645   9.756   7.296
    8   HD12  LEU  94          HD13      LEU  94   8.384  10.271   8.415
    9   HD23  LEU  94          HD21      LEU  94   7.971  12.437   8.663
   10   HD22  LEU  94          HD22      LEU  94   9.213  13.687   8.688
   11   HD21  LEU  94          HD23      LEU  94   9.165  12.465   9.958

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  95           H        ILE  95  14.330  12.022   7.739
    2    HA   ILE  95           HA       ILE  95  15.535  12.930  10.140
    3    HB   ILE  95           HB       ILE  95  16.734  11.869   7.570
    4   HG12  ILE  95          HG12      ILE  95  16.474  10.657  10.336
    5   HG13  ILE  95          HG13      ILE  95  15.289  10.407   9.056
    6   HG21  ILE  95          HG21      ILE  95  18.029  12.661  10.197
    7   HG23  ILE  95          HG22      ILE  95  18.470  13.195   8.574
    8   HG22  ILE  95          HG23      ILE  95  18.779  11.532   9.071
    9   HD13  ILE  95          HD11      ILE  95  16.747   9.130   7.767
   10   HD12  ILE  95          HD12      ILE  95  17.242   8.673   9.394
   11   HD11  ILE  95          HD13      ILE  95  18.185   9.854   8.486

  No H/Q in entry =          11
  In of MODEL   63
    1    H    GLU  96           H        GLU  96  15.645  14.178   6.809
    2    HA   GLU  96           HA       GLU  96  17.504  16.249   7.269
    3    HB2  GLU  96           HB2      GLU  96  16.806  15.599   5.016
    4    HB3  GLU  96           HB3      GLU  96  15.168  16.159   5.342
    5    HG2  GLU  96           HG2      GLU  96  15.733  18.289   4.802
    6    HG3  GLU  96           HG3      GLU  96  17.048  18.281   5.965

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LEU  97           H        LEU  97  13.999  16.070   7.747
    2    HA   LEU  97           HA       LEU  97  13.599  18.802   8.407
    3    HB2  LEU  97           HB2      LEU  97  12.083  16.278   9.032
    4    HB3  LEU  97           HB3      LEU  97  11.584  17.823   9.717
    5    HG   LEU  97           HG       LEU  97  12.023  17.419   6.744
    6   HD12  LEU  97          HD11      LEU  97   9.498  17.298   6.661
    7   HD11  LEU  97          HD12      LEU  97   9.516  17.091   8.411
    8   HD13  LEU  97          HD13      LEU  97  10.279  15.886   7.372
    9   HD23  LEU  97          HD21      LEU  97  10.291  19.388   6.810
   10   HD22  LEU  97          HD22      LEU  97  11.979  19.741   7.180
   11   HD21  LEU  97          HD23      LEU  97  10.808  19.568   8.486

  No H/Q in entry =          11
  In of MODEL   63
    1    H    HIS  98           H        HIS  98  14.441  15.965  10.378
    2    HA   HIS  98           HA       HIS  98  14.323  17.215  12.902
    3    HB2  HIS  98           HB2      HIS  98  16.052  14.957  11.865
    4    HB3  HIS  98           HB3      HIS  98  16.076  15.488  13.548
    5    HD1  HIS  98           HD1      HIS  98  13.835  13.876  10.981
    6    HD2  HIS  98           HD2      HIS  98  13.789  14.778  15.051
    7    HE1  HIS  98           HE1      HIS  98  11.821  12.683  11.957
    8    HE2  HIS  98           HE2      HIS  98  11.773  13.224  14.432

  No H/Q in entry =           8
  In of MODEL   63
    1    H    GLU  99           H        GLU  99  16.841  17.103  10.430
    2    HA   GLU  99           HA       GLU  99  18.852  18.422  11.936
    3    HB2  GLU  99           HB2      GLU  99  19.298  17.142   9.855
    4    HB3  GLU  99           HB3      GLU  99  18.478  18.404   8.931
    5    HG2  GLU  99           HG2      GLU  99  20.103  20.066   9.706
    6    HG3  GLU  99           HG3      GLU  99  20.893  18.857  10.712

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LYS 100           H        LYS 100  16.300  19.602   9.762
    2    HA   LYS 100           HA       LYS 100  17.108  22.336   9.907
    3    HB2  LYS 100           HB2      LYS 100  14.461  21.059   9.184
    4    HB3  LYS 100           HB3      LYS 100  14.765  22.797   9.097
    5    HG2  LYS 100           HG2      LYS 100  16.714  22.348   7.600
    6    HG3  LYS 100           HG3      LYS 100  16.295  20.633   7.616
    7    HD2  LYS 100           HD2      LYS 100  14.088  21.154   6.650
    8    HD3  LYS 100           HD3      LYS 100  14.489  22.871   6.642
    9    HE2  LYS 100           HE2      LYS 100  16.426  22.391   5.152
   10    HE3  LYS 100           HE3      LYS 100  15.954  20.688   5.117
   11    HZ1  LYS 100           HZ1      LYS 100  14.125  22.891   4.319
   12    HZ3  LYS 100           HZ2      LYS 100  13.931  21.223   4.052
   13    HZ2  LYS 100           HZ3      LYS 100  15.133  22.085   3.217

  No H/Q in entry =          13
  In of MODEL   63
    1    H    LEU 101           H        LEU 101  15.033  20.288  11.893
    2    HA   LEU 101           HA       LEU 101  13.897  22.352  13.497
    3    HB2  LEU 101           HB2      LEU 101  14.334  19.400  13.861
    4    HB3  LEU 101           HB3      LEU 101  13.821  20.375  15.234
    5    HG   LEU 101           HG       LEU 101  12.365  20.481  12.586
    6   HD12  LEU 101          HD11      LEU 101  10.719  18.917  13.872
    7   HD11  LEU 101          HD12      LEU 101  12.126  18.495  14.844
    8   HD13  LEU 101          HD13      LEU 101  12.134  18.196  13.106
    9   HD21  LEU 101          HD21      LEU 101  11.752  21.263  15.451
   10   HD23  LEU 101          HD22      LEU 101  10.473  21.047  14.258
   11   HD22  LEU 101          HD23      LEU 101  11.709  22.279  14.008

  No H/Q in entry =          11
  In of MODEL   63
    1    H    LYS 102           H        LYS 102  17.035  21.736  13.012
    2    HA   LYS 102           HA       LYS 102  18.900  22.595  14.062
    3    HB2  LYS 102           HB2      LYS 102  17.108  24.111  15.228
    4    HB3  LYS 102           HB3      LYS 102  17.331  23.042  16.597
    5    HG2  LYS 102           HG2      LYS 102  19.214  25.052  15.410
    6    HG3  LYS 102           HG3      LYS 102  18.856  24.731  17.093
    7    HD2  LYS 102           HD2      LYS 102  20.491  22.820  15.374
    8    HD3  LYS 102           HD3      LYS 102  21.199  24.136  16.303
    9    HE2  LYS 102           HE2      LYS 102  20.805  21.584  17.265
   10    HE3  LYS 102           HE3      LYS 102  21.043  23.020  18.260
   11    HZ2  LYS 102           HZ1      LYS 102  19.079  21.740  18.901
   12    HZ1  LYS 102           HZ2      LYS 102  18.414  21.980  17.362
   13    HZ3  LYS 102           HZ3      LYS 102  18.664  23.304  18.391

  No H/Q in entry =          13
  In of MODEL   63
    1    H    ALA 103           H        ALA 103  16.858  20.986  16.506
    2    HA   ALA 103           HA       ALA 103  18.604  19.761  18.130
    3    HB2  ALA 103           HB1      ALA 103  17.013  17.760  18.138
    4    HB1  ALA 103           HB2      ALA 103  16.102  18.622  16.898
    5    HB3  ALA 103           HB3      ALA 103  16.306  19.335  18.497

  No H/Q in entry =           5
  In of MODEL   63
    1    H1   ALA   1           H3       ALA   1  -1.997  -6.834 -21.321
    2    H2   ALA   1           H2       ALA   1  -2.790  -8.268 -20.863
    3    H3   ALA   1           H1       ALA   1  -1.191  -8.322 -21.441
    4    HA   ALA   1           HA       ALA   1  -2.056  -8.778 -23.427
    5    HB1  ALA   1           HB1      ALA   1  -4.188  -9.490 -22.926
    6    HB2  ALA   1           HB2      ALA   1  -4.633  -7.974 -23.710
    7    HB3  ALA   1           HB3      ALA   1  -4.547  -8.063 -21.953

  No H/Q in entry =           7
  In of MODEL   63
    1    H    GLU   2           H        GLU   2  -2.909  -7.575 -25.399
    2    HA   GLU   2           HA       GLU   2  -1.515  -5.563 -26.287
    3    HB2  GLU   2           HB2      GLU   2  -4.526  -5.616 -26.562
    4    HB3  GLU   2           HB3      GLU   2  -3.417  -4.752 -27.623
    5    HG2  GLU   2           HG2      GLU   2  -2.938  -6.639 -28.794
    6    HG3  GLU   2           HG3      GLU   2  -2.624  -7.553 -27.325

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLU   3           H        GLU   3  -4.657  -4.297 -25.335
    2    HA   GLU   3           HA       GLU   3  -3.590  -1.748 -24.710
    3    HB2  GLU   3           HB2      GLU   3  -6.279  -3.054 -24.346
    4    HB3  GLU   3           HB3      GLU   3  -5.965  -1.443 -23.696
    5    HG2  GLU   3           HG2      GLU   3  -5.635  -0.507 -25.822
    6    HG3  GLU   3           HG3      GLU   3  -5.257  -2.060 -26.560

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LEU   4           H        LEU   4  -5.160  -4.111 -22.519
    2    HA   LEU   4           HA       LEU   4  -4.756  -2.896 -20.128
    3    HB2  LEU   4           HB2      LEU   4  -4.232  -5.837 -20.619
    4    HB3  LEU   4           HB3      LEU   4  -4.613  -5.097 -19.066
    5    HG   LEU   4           HG       LEU   4  -6.421  -5.151 -21.505
    6   HD13  LEU   4          HD11      LEU   4  -7.607  -6.869 -20.498
    7   HD12  LEU   4          HD12      LEU   4  -7.097  -6.419 -18.872
    8   HD11  LEU   4          HD13      LEU   4  -5.979  -7.262 -19.944
    9   HD23  LEU   4          HD21      LEU   4  -8.075  -4.342 -19.609
   10   HD22  LEU   4          HD22      LEU   4  -7.043  -3.171 -20.429
   11   HD21  LEU   4          HD23      LEU   4  -6.597  -3.771 -18.832

  No H/Q in entry =          11
  In of MODEL   63
    1    H    GLU   5           H        GLU   5  -2.291  -4.741 -21.903
    2    HA   GLU   5           HA       GLU   5  -0.277  -4.476 -19.893
    3    HB2  GLU   5           HB2      GLU   5  -0.247  -6.236 -21.658
    4    HB3  GLU   5           HB3      GLU   5   0.061  -4.986 -22.863
    5    HG2  GLU   5           HG2      GLU   5   2.144  -4.371 -21.725
    6    HG3  GLU   5           HG3      GLU   5   1.833  -5.570 -20.471

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLU   6           H        GLU   6  -0.948  -2.745 -22.920
    2    HA   GLU   6           HA       GLU   6   1.233  -0.923 -22.675
    3    HB2  GLU   6           HB2      GLU   6   0.086  -1.382 -24.824
    4    HB3  GLU   6           HB3      GLU   6  -1.367  -0.605 -24.195
    5    HG2  GLU   6           HG2      GLU   6  -0.158   1.504 -23.922
    6    HG3  GLU   6           HG3      GLU   6   1.336   0.740 -24.463

  No H/Q in entry =           6
  In of MODEL   63
    1    H    VAL   7           H        VAL   7  -2.090  -0.986 -21.583
    2    HA   VAL   7           HA       VAL   7  -2.288   1.723 -20.730
    3    HB   VAL   7           HB       VAL   7  -3.749  -0.792 -19.885
    4   HG11  VAL   7          HG11      VAL   7  -4.100   2.094 -19.052
    5   HG13  VAL   7          HG12      VAL   7  -3.992   0.664 -18.025
    6   HG12  VAL   7          HG13      VAL   7  -5.437   0.945 -18.995
    7   HG21  VAL   7          HG21      VAL   7  -3.935   0.297 -22.266
    8   HG23  VAL   7          HG22      VAL   7  -4.864   1.545 -21.434
    9   HG22  VAL   7          HG23      VAL   7  -5.416  -0.130 -21.408

  No H/Q in entry =           9
  In of MODEL   63
    1    H    VAL   8           H        VAL   8  -1.290  -1.274 -19.116
    2    HA   VAL   8           HA       VAL   8  -0.930  -0.208 -16.520
    3    HB   VAL   8           HB       VAL   8   0.447  -2.523 -17.906
    4   HG11  VAL   8          HG11      VAL   8   0.532  -1.524 -15.053
    5   HG13  VAL   8          HG12      VAL   8   1.888  -1.901 -16.118
    6   HG12  VAL   8          HG13      VAL   8   0.893  -3.202 -15.463
    7   HG21  VAL   8          HG21      VAL   8  -2.203  -2.295 -17.161
    8   HG23  VAL   8          HG22      VAL   8  -1.488  -2.966 -15.698
    9   HG22  VAL   8          HG23      VAL   8  -1.331  -3.826 -17.226

  No H/Q in entry =           9
  In of MODEL   63
    1    H    MET   9           H        MET   9   1.278  -0.505 -19.300
    2    HA   MET   9           HA       MET   9   3.587   0.521 -18.067
    3    HB2  MET   9           HB2      MET   9   2.591   0.510 -20.908
    4    HB3  MET   9           HB3      MET   9   4.079   1.353 -20.481
    5    HG2  MET   9           HG2      MET   9   4.784  -0.841 -19.328
    6    HG3  MET   9           HG3      MET   9   3.458  -1.590 -20.219
    7    HE3  MET   9           HE1      MET   9   4.334  -1.699 -23.759
    8    HE2  MET   9           HE2      MET   9   3.357  -0.373 -23.137
    9    HE1  MET   9           HE3      MET   9   3.212  -1.975 -22.422

  No H/Q in entry =           9
  In of MODEL   63
    1    H    GLY  10           H        GLY  10   0.886   2.144 -19.698
    2    HA3  GLY  10           HA2      GLY  10   1.866   4.792 -19.454
    3    HA2  GLY  10           HA3      GLY  10   0.172   4.341 -19.637

  No H/Q in entry =           3
  In of MODEL   63
    1    H    LEU  11           H        LEU  11  -0.202   2.804 -17.352
    2    HA   LEU  11           HA       LEU  11  -0.693   4.774 -15.375
    3    HB2  LEU  11           HB2      LEU  11  -0.640   1.758 -15.235
    4    HB3  LEU  11           HB3      LEU  11  -1.123   2.776 -13.881
    5    HG   LEU  11           HG       LEU  11  -2.402   2.910 -16.625
    6   HD13  LEU  11          HD11      LEU  11  -2.986   0.767 -15.872
    7   HD12  LEU  11          HD12      LEU  11  -4.323   1.763 -15.302
    8   HD11  LEU  11          HD13      LEU  11  -3.053   1.270 -14.182
    9   HD22  LEU  11          HD21      LEU  11  -2.967   4.924 -15.599
   10   HD21  LEU  11          HD22      LEU  11  -2.872   4.249 -13.973
   11   HD23  LEU  11          HD23      LEU  11  -4.264   3.896 -14.997

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  12           H        ILE  12   1.832   2.296 -15.668
    2    HA   ILE  12           HA       ILE  12   3.078   2.814 -13.180
    3    HB   ILE  12           HB       ILE  12   4.288   1.780 -15.766
    4   HG12  ILE  12          HG12      ILE  12   2.286   0.553 -14.602
    5   HG13  ILE  12          HG13      ILE  12   3.675  -0.388 -15.106
    6   HG21  ILE  12          HG21      ILE  12   5.304   1.716 -12.906
    7   HG23  ILE  12          HG22      ILE  12   6.070   2.494 -14.290
    8   HG22  ILE  12          HG23      ILE  12   5.977   0.736 -14.206
    9   HD12  ILE  12          HD11      ILE  12   2.838  -0.930 -12.808
   10   HD11  ILE  12          HD12      ILE  12   3.256   0.711 -12.317
   11   HD13  ILE  12          HD13      ILE  12   4.510  -0.398 -12.830

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  13           H        ILE  13   3.638   4.090 -16.439
    2    HA   ILE  13           HA       ILE  13   5.795   5.795 -15.738
    3    HB   ILE  13           HB       ILE  13   3.731   5.900 -17.951
    4   HG12  ILE  13          HG12      ILE  13   5.526   4.034 -17.735
    5   HG13  ILE  13          HG13      ILE  13   5.322   4.827 -19.293
    6   HG22  ILE  13          HG21      ILE  13   5.591   7.439 -19.008
    7   HG21  ILE  13          HG22      ILE  13   6.010   7.770 -17.332
    8   HG23  ILE  13          HG23      ILE  13   4.391   8.142 -17.922
    9   HD13  ILE  13          HD11      ILE  13   7.385   5.861 -19.179
   10   HD12  ILE  13          HD12      ILE  13   7.731   4.512 -18.102
   11   HD11  ILE  13          HD13      ILE  13   7.278   6.075 -17.433

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ASN  14           H        ASN  14   2.287   6.310 -15.950
    2    HA   ASN  14           HA       ASN  14   2.270   9.053 -15.299
    3    HB2  ASN  14           HB2      ASN  14   0.355   7.426 -16.109
    4    HB3  ASN  14           HB3      ASN  14   0.059   7.241 -14.385
    5   HD21  ASN  14          HD21      ASN  14  -1.975   8.415 -15.781
    6   HD22  ASN  14          HD22      ASN  14  -2.025  10.087 -15.504

  No H/Q in entry =           6
  In of MODEL   63
    1    H    SER  15           H        SER  15   1.990   6.168 -13.232
    2    HA   SER  15           HA       SER  15   1.728   7.527 -10.773
    3    HB2  SER  15           HB2      SER  15   2.277   5.433  -9.742
    4    HB3  SER  15           HB3      SER  15   1.429   5.025 -11.230
    5    HG   SER  15           HG       SER  15   3.160   3.901 -11.622

  No H/Q in entry =           5
  In of MODEL   63
    1    H    GLY  16           H        GLY  16   4.571   6.424 -12.581
    2    HA3  GLY  16           HA2      GLY  16   6.529   7.161 -10.675
    3    HA2  GLY  16           HA3      GLY  16   6.805   6.966 -12.404

  No H/Q in entry =           3
  In of MODEL   63
    1    H    GLN  17           H        GLN  17   5.109   8.937 -13.432
    2    HA   GLN  17           HA       GLN  17   6.703  11.270 -13.136
    3    HB2  GLN  17           HB2      GLN  17   5.348  10.806 -15.160
    4    HB3  GLN  17           HB3      GLN  17   3.877  11.029 -14.213
    5    HG2  GLN  17           HG2      GLN  17   4.563  13.347 -13.697
    6    HG3  GLN  17           HG3      GLN  17   6.017  13.126 -14.669
    7   HE21  GLN  17          HE21      GLN  17   5.800  13.889 -16.772
    8   HE22  GLN  17          HE22      GLN  17   4.337  13.978 -17.629

  No H/Q in entry =           8
  In of MODEL   63
    1    H    ALA  18           H        ALA  18   3.618  10.259 -11.745
    2    HA   ALA  18           HA       ALA  18   2.923  12.645 -10.457
    3    HB1  ALA  18           HB1      ALA  18   1.779  10.194 -10.674
    4    HB2  ALA  18           HB2      ALA  18   1.254  11.411  -9.513
    5    HB3  ALA  18           HB3      ALA  18   2.346  10.121  -9.006

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ARG  19           H        ARG  19   4.804   9.867  -9.220
    2    HA   ARG  19           HA       ARG  19   5.379  11.010  -6.701
    3    HB2  ARG  19           HB2      ARG  19   5.775   8.608  -7.246
    4    HB3  ARG  19           HB3      ARG  19   7.117   9.094  -8.285
    5    HG2  ARG  19           HG2      ARG  19   8.270  10.120  -6.374
    6    HG3  ARG  19           HG3      ARG  19   6.908   9.732  -5.324
    7    HD2  ARG  19           HD2      ARG  19   8.669   8.088  -5.001
    8    HD3  ARG  19           HD3      ARG  19   7.280   7.315  -5.770
    9    HE   ARG  19           HE       ARG  19   8.957   8.138  -7.838
   10   HH21  ARG  19          HH11      ARG  19  10.499   6.731  -8.719
   11   HH22  ARG  19          HH12      ARG  19  11.053   5.376  -7.798
   12   HH11  ARG  19          HH21      ARG  19   9.062   6.093  -5.071
   13   HH12  ARG  19          HH22      ARG  19  10.236   5.014  -5.732

  No H/Q in entry =          13
  In of MODEL   63
    1    H    SER  20           H        SER  20   7.150  11.048  -9.776
    2    HA   SER  20           HA       SER  20   9.413  12.451  -8.979
    3    HB2  SER  20           HB2      SER  20   9.155  11.473 -11.228
    4    HB3  SER  20           HB3      SER  20   7.941  12.688 -11.612
    5    HG   SER  20           HG       SER  20  10.674  13.105 -10.966

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LEU  21           H        LEU  21   6.301  13.737 -10.123
    2    HA   LEU  21           HA       LEU  21   6.984  16.479  -9.895
    3    HB2  LEU  21           HB2      LEU  21   4.309  15.069  -9.775
    4    HB3  LEU  21           HB3      LEU  21   4.488  16.821  -9.787
    5    HG   LEU  21           HG       LEU  21   5.642  15.014 -11.932
    6   HD12  LEU  21          HD11      LEU  21   3.711  15.818 -13.313
    7   HD11  LEU  21          HD12      LEU  21   3.020  16.537 -11.857
    8   HD13  LEU  21          HD13      LEU  21   3.222  14.789 -11.967
    9   HD22  LEU  21          HD21      LEU  21   6.788  17.043 -12.136
   10   HD21  LEU  21          HD22      LEU  21   5.439  18.000 -11.530
   11   HD23  LEU  21          HD23      LEU  21   5.395  17.362 -13.166

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ALA  22           H        ALA  22   5.498  14.183  -7.636
    2    HA   ALA  22           HA       ALA  22   4.932  15.983  -5.551
    3    HB3  ALA  22           HB1      ALA  22   4.161  13.594  -5.715
    4    HB2  ALA  22           HB2      ALA  22   4.775  14.056  -4.127
    5    HB1  ALA  22           HB3      ALA  22   5.779  13.100  -5.218

  No H/Q in entry =           5
  In of MODEL   63
    1    H    TYR  23           H        TYR  23   7.853  13.952  -6.044
    2    HA   TYR  23           HA       TYR  23   9.272  14.956  -3.807
    3    HB2  TYR  23           HB2      TYR  23  10.037  12.952  -4.986
    4    HB3  TYR  23           HB3      TYR  23  10.330  13.896  -6.446
    5    HD1  TYR  23           HD1      TYR  23  11.344  13.556  -2.868
    6    HD2  TYR  23           HD2      TYR  23  12.367  15.051  -6.764
    7    HE1  TYR  23           HE1      TYR  23  13.617  14.125  -2.054
    8    HE2  TYR  23           HE2      TYR  23  14.639  15.621  -5.948
    9    HH   TYR  23           HH       TYR  23  15.655  14.821  -2.633

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ALA  24           H        ALA  24   9.042  16.080  -7.165
    2    HA   ALA  24           HA       ALA  24  10.945  18.160  -6.937
    3    HB2  ALA  24           HB1      ALA  24  10.470  18.234  -9.139
    4    HB3  ALA  24           HB2      ALA  24   8.922  18.985  -8.752
    5    HB1  ALA  24           HB3      ALA  24   9.041  17.232  -8.893

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ALA  25           H        ALA  25   7.476  17.979  -6.265
    2    HA   ALA  25           HA       ALA  25   7.009  20.695  -5.675
    3    HB1  ALA  25           HB1      ALA  25   5.342  18.700  -5.861
    4    HB2  ALA  25           HB2      ALA  25   4.993  19.984  -4.701
    5    HB3  ALA  25           HB3      ALA  25   5.689  18.459  -4.148

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LEU  26           H        LEU  26   8.104  18.004  -3.655
    2    HA   LEU  26           HA       LEU  26   8.248  19.423  -1.212
    3    HB2  LEU  26           HB2      LEU  26   8.340  17.006  -1.220
    4    HB3  LEU  26           HB3      LEU  26   9.795  17.017  -2.213
    5    HG   LEU  26           HG       LEU  26  11.039  18.124  -0.386
    6   HD12  LEU  26          HD11      LEU  26   9.847  18.123   1.892
    7   HD11  LEU  26          HD12      LEU  26   8.345  17.991   0.979
    8   HD13  LEU  26          HD13      LEU  26   9.388  19.397   0.762
    9   HD21  LEU  26          HD21      LEU  26   9.516  15.654   0.499
   10   HD23  LEU  26          HD22      LEU  26  11.042  16.211   1.176
   11   HD22  LEU  26          HD23      LEU  26  10.971  15.661  -0.496

  No H/Q in entry =          11
  In of MODEL   63
    1    H    LYS  27           H        LYS  27  10.625  18.860  -3.776
    2    HA   LYS  27           HA       LYS  27  12.829  20.093  -2.575
    3    HB2  LYS  27           HB2      LYS  27  12.898  18.756  -4.673
    4    HB3  LYS  27           HB3      LYS  27  12.121  20.092  -5.520
    5    HG2  LYS  27           HG2      LYS  27  13.996  21.574  -4.964
    6    HG3  LYS  27           HG3      LYS  27  14.769  20.277  -4.045
    7    HD2  LYS  27           HD2      LYS  27  14.880  18.899  -6.107
    8    HD3  LYS  27           HD3      LYS  27  14.152  20.222  -7.019
    9    HE2  LYS  27           HE2      LYS  27  16.050  21.684  -6.427
   10    HE3  LYS  27           HE3      LYS  27  16.782  20.365  -5.507
   11    HZ3  LYS  27           HZ1      LYS  27  17.739  20.474  -7.708
   12    HZ2  LYS  27           HZ2      LYS  27  16.201  20.360  -8.426
   13    HZ1  LYS  27           HZ3      LYS  27  16.837  19.045  -7.557

  No H/Q in entry =          13
  In of MODEL   63
    1    H    GLN  28           H        GLN  28  10.178  21.485  -4.478
    2    HA   GLN  28           HA       GLN  28  11.136  24.138  -4.633
    3    HB2  GLN  28           HB2      GLN  28   8.305  23.067  -4.483
    4    HB3  GLN  28           HB3      GLN  28   8.712  24.742  -4.856
    5    HG2  GLN  28           HG2      GLN  28   9.696  22.343  -6.427
    6    HG3  GLN  28           HG3      GLN  28   8.340  23.365  -6.905
    7   HE21  GLN  28          HE21      GLN  28  11.461  22.906  -7.709
    8   HE22  GLN  28          HE22      GLN  28  11.927  24.498  -8.074

  No H/Q in entry =           8
  In of MODEL   63
    1    H    ALA  29           H        ALA  29   9.241  22.435  -2.175
    2    HA   ALA  29           HA       ALA  29   8.718  24.619  -0.475
    3    HB2  ALA  29           HB1      ALA  29   8.012  23.043   1.096
    4    HB1  ALA  29           HB2      ALA  29   9.226  21.861   0.608
    5    HB3  ALA  29           HB3      ALA  29   7.824  22.160  -0.418

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LYS  30           H        LYS  30  11.446  22.352  -0.597
    2    HA   LYS  30           HA       LYS  30  12.799  23.295   1.690
    3    HB2  LYS  30           HB2      LYS  30  13.857  22.021  -0.842
    4    HB3  LYS  30           HB3      LYS  30  14.861  22.373   0.566
    5    HG2  LYS  30           HG2      LYS  30  13.329  20.984   1.962
    6    HG3  LYS  30           HG3      LYS  30  12.421  20.569   0.504
    7    HD2  LYS  30           HD2      LYS  30  14.451  19.587  -0.492
    8    HD3  LYS  30           HD3      LYS  30  15.377  20.016   0.948
    9    HE2  LYS  30           HE2      LYS  30  13.893  18.578   2.318
   10    HE3  LYS  30           HE3      LYS  30  12.997  18.130   0.861
   11    HZ2  LYS  30           HZ1      LYS  30  14.800  16.548   1.588
   12    HZ1  LYS  30           HZ2      LYS  30  15.930  17.737   1.125
   13    HZ3  LYS  30           HZ3      LYS  30  14.876  17.059  -0.028

  No H/Q in entry =          13
  In of MODEL   63
    1    H    GLN  31           H        GLN  31  12.640  24.515  -1.598
    2    HA   GLN  31           HA       GLN  31  14.799  26.406  -1.201
    3    HB2  GLN  31           HB2      GLN  31  12.722  26.464  -3.394
    4    HB3  GLN  31           HB3      GLN  31  14.342  27.159  -3.416
    5    HG2  GLN  31           HG2      GLN  31  14.813  24.461  -2.860
    6    HG3  GLN  31           HG3      GLN  31  13.491  24.412  -4.019
    7   HE21  GLN  31          HE21      GLN  31  16.328  23.621  -4.470
    8   HE22  GLN  31          HE22      GLN  31  16.881  24.600  -5.740

  No H/Q in entry =           8
  In of MODEL   63
    1    H    GLY  32           H        GLY  32  11.742  26.219  -0.010
    2    HA3  GLY  32           HA2      GLY  32  10.605  27.781   1.288
    3    HA2  GLY  32           HA3      GLY  32  11.722  29.019   0.727

  No H/Q in entry =           3
  In of MODEL   63
    1    H    ASP  33           H        ASP  33  10.320  27.126  -1.753
    2    HA   ASP  33           HA       ASP  33   8.643  29.403  -2.572
    3    HB2  ASP  33           HB2      ASP  33   9.714  26.991  -4.043
    4    HB3  ASP  33           HB3      ASP  33   8.552  28.109  -4.750

  No H/Q in entry =           4
  In of MODEL   63
    1    H    PHE  34           H        PHE  34   6.978  28.920  -0.986
    2    HA   PHE  34           HA       PHE  34   5.601  26.447  -0.881
    3    HB2  PHE  34           HB2      PHE  34   4.650  29.231  -0.173
    4    HB3  PHE  34           HB3      PHE  34   3.808  27.738   0.244
    5    HD1  PHE  34           HD1      PHE  34   6.075  30.131   1.435
    6    HD2  PHE  34           HD2      PHE  34   5.395  25.891   1.372
    7    HE1  PHE  34           HE1      PHE  34   7.497  29.871   3.449
    8    HE2  PHE  34           HE2      PHE  34   6.819  25.635   3.384
    9    HZ   PHE  34           HZ       PHE  34   7.864  27.626   4.422

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ALA  35           H        ALA  35   5.139  29.320  -2.871
    2    HA   ALA  35           HA       ALA  35   2.573  28.710  -3.860
    3    HB1  ALA  35           HB1      ALA  35   3.593  30.112  -5.907
    4    HB3  ALA  35           HB2      ALA  35   4.830  30.468  -4.700
    5    HB2  ALA  35           HB3      ALA  35   3.144  30.875  -4.382

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ALA  36           H        ALA  36   5.780  28.044  -5.267
    2    HA   ALA  36           HA       ALA  36   4.758  26.625  -7.502
    3    HB3  ALA  36           HB1      ALA  36   6.907  26.753  -8.150
    4    HB2  ALA  36           HB2      ALA  36   7.409  25.718  -6.811
    5    HB1  ALA  36           HB3      ALA  36   7.307  27.465  -6.586

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ALA  37           H        ALA  37   5.763  25.616  -4.266
    2    HA   ALA  37           HA       ALA  37   5.699  22.830  -4.708
    3    HB2  ALA  37           HB1      ALA  37   5.474  24.609  -2.317
    4    HB1  ALA  37           HB2      ALA  37   6.602  23.293  -2.633
    5    HB3  ALA  37           HB3      ALA  37   4.949  22.937  -2.138

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LYS  38           H        LYS  38   3.183  25.032  -3.491
    2    HA   LYS  38           HA       LYS  38   1.088  23.217  -3.245
    3    HB2  LYS  38           HB2      LYS  38   1.443  25.972  -2.986
    4    HB3  LYS  38           HB3      LYS  38   0.224  25.830  -4.247
    5    HG2  LYS  38           HG2      LYS  38  -1.203  24.500  -2.789
    6    HG3  LYS  38           HG3      LYS  38   0.060  24.434  -1.552
    7    HD2  LYS  38           HD2      LYS  38  -0.119  26.768  -1.091
    8    HD3  LYS  38           HD3      LYS  38  -1.054  27.064  -2.558
    9    HE2  LYS  38           HE2      LYS  38  -2.527  27.088  -0.595
   10    HE3  LYS  38           HE3      LYS  38  -2.917  25.717  -1.638
   11    HZ3  LYS  38           HZ1      LYS  38  -2.168  24.239  -0.123
   12    HZ2  LYS  38           HZ2      LYS  38  -2.502  25.491   0.977
   13    HZ1  LYS  38           HZ3      LYS  38  -0.916  25.243   0.426

  No H/Q in entry =          13
  In of MODEL   63
    1    H    ALA  39           H        ALA  39   2.024  25.133  -6.099
    2    HA   ALA  39           HA       ALA  39  -0.077  24.273  -7.774
    3    HB2  ALA  39           HB1      ALA  39   2.642  24.927  -8.866
    4    HB1  ALA  39           HB2      ALA  39   1.687  26.184  -8.081
    5    HB3  ALA  39           HB3      ALA  39   1.053  25.354  -9.501

  No H/Q in entry =           5
  In of MODEL   63
    1    H    MET  40           H        MET  40   3.169  22.972  -7.250
    2    HA   MET  40           HA       MET  40   3.042  20.962  -9.249
    3    HB2  MET  40           HB2      MET  40   4.692  21.174  -6.725
    4    HB3  MET  40           HB3      MET  40   4.925  19.924  -7.949
    5    HG2  MET  40           HG2      MET  40   4.971  22.883  -8.601
    6    HG3  MET  40           HG3      MET  40   6.424  21.979  -8.178
    7    HE3  MET  40           HE1      MET  40   7.254  19.777 -11.010
    8    HE2  MET  40           HE2      MET  40   6.716  19.450  -9.366
    9    HE1  MET  40           HE3      MET  40   7.806  20.799  -9.676

  No H/Q in entry =           9
  In of MODEL   63
    1    H    MET  41           H        MET  41   2.179  20.987  -5.812
    2    HA   MET  41           HA       MET  41   1.652  18.221  -5.539
    3    HB2  MET  41           HB2      MET  41   0.339  20.571  -4.157
    4    HB3  MET  41           HB3      MET  41   0.192  18.891  -3.654
    5    HG2  MET  41           HG2      MET  41   2.902  19.116  -3.732
    6    HG3  MET  41           HG3      MET  41   2.466  20.772  -3.322
    7    HE2  MET  41           HE1      MET  41  -0.546  19.509  -1.556
    8    HE1  MET  41           HE2      MET  41   0.264  21.025  -1.939
    9    HE3  MET  41           HE3      MET  41   0.230  20.446  -0.273

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ASP  42           H        ASP  42  -0.402  20.949  -6.469
    2    HA   ASP  42           HA       ASP  42  -2.844  19.587  -6.575
    3    HB2  ASP  42           HB2      ASP  42  -2.143  22.159  -6.830
    4    HB3  ASP  42           HB3      ASP  42  -2.320  21.772  -8.538

  No H/Q in entry =           4
  In of MODEL   63
    1    H    GLN  43           H        GLN  43  -0.442  20.192  -9.111
    2    HA   GLN  43           HA       GLN  43  -1.860  18.881 -11.185
    3    HB2  GLN  43           HB2      GLN  43   1.104  19.398 -10.846
    4    HB3  GLN  43           HB3      GLN  43   0.368  18.764 -12.320
    5    HG2  GLN  43           HG2      GLN  43  -1.146  20.791 -12.329
    6    HG3  GLN  43           HG3      GLN  43  -0.173  21.441 -11.013
    7   HE21  GLN  43          HE21      GLN  43  -0.045  23.071 -13.094
    8   HE22  GLN  43          HE22      GLN  43   1.356  22.856 -14.023

  No H/Q in entry =           8
  In of MODEL   63
    1    H    SER  44           H        SER  44   0.528  17.732  -8.836
    2    HA   SER  44           HA       SER  44   0.850  15.130  -9.878
    3    HB2  SER  44           HB2      SER  44   1.777  16.560  -7.649
    4    HB3  SER  44           HB3      SER  44   0.926  15.172  -6.972
    5    HG   SER  44           HG       SER  44   3.031  14.556  -7.433

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ARG  45           H        ARG  45  -1.436  16.435  -7.499
    2    HA   ARG  45           HA       ARG  45  -2.810  14.070  -6.854
    3    HB2  ARG  45           HB2      ARG  45  -2.992  16.232  -5.650
    4    HB3  ARG  45           HB3      ARG  45  -3.870  16.905  -7.020
    5    HG2  ARG  45           HG2      ARG  45  -5.630  15.175  -6.718
    6    HG3  ARG  45           HG3      ARG  45  -4.763  14.558  -5.311
    7    HD2  ARG  45           HD2      ARG  45  -4.956  16.819  -4.241
    8    HD3  ARG  45           HD3      ARG  45  -5.965  17.344  -5.606
    9    HE   ARG  45           HE       ARG  45  -7.056  14.962  -4.560
   10   HH21  ARG  45          HH11      ARG  45  -8.872  15.029  -3.262
   11   HH22  ARG  45          HH12      ARG  45  -9.256  16.464  -2.380
   12   HH11  ARG  45          HH21      ARG  45  -6.499  18.204  -3.530
   13   HH12  ARG  45          HH22      ARG  45  -7.907  18.262  -2.530

  No H/Q in entry =          13
  In of MODEL   63
    1    H    MET  46           H        MET  46  -3.436  16.486  -9.384
    2    HA   MET  46           HA       MET  46  -5.789  15.315 -10.416
    3    HB2  MET  46           HB2      MET  46  -3.709  17.153 -11.609
    4    HB3  MET  46           HB3      MET  46  -5.100  16.595 -12.545
    5    HG2  MET  46           HG2      MET  46  -6.622  17.496 -10.834
    6    HG3  MET  46           HG3      MET  46  -5.246  18.040  -9.882
    7    HE1  MET  46           HE1      MET  46  -5.991  20.276  -9.656
    8    HE3  MET  46           HE2      MET  46  -7.442  20.270 -10.652
    9    HE2  MET  46           HE3      MET  46  -6.211  21.504 -10.910

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ALA  47           H        ALA  47  -2.372  14.844 -11.228
    2    HA   ALA  47           HA       ALA  47  -2.748  13.127 -13.441
    3    HB3  ALA  47           HB1      ALA  47  -0.566  14.018 -13.118
    4    HB2  ALA  47           HB2      ALA  47  -0.417  12.289 -12.795
    5    HB1  ALA  47           HB3      ALA  47  -0.492  13.434 -11.455

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LEU  48           H        LEU  48  -2.425  12.475  -9.975
    2    HA   LEU  48           HA       LEU  48  -2.516   9.636 -10.145
    3    HB2  LEU  48           HB2      LEU  48  -3.250  11.542  -7.911
    4    HB3  LEU  48           HB3      LEU  48  -3.150   9.791  -7.720
    5    HG   LEU  48           HG       LEU  48  -0.870  11.499  -8.744
    6   HD13  LEU  48          HD11      LEU  48  -1.120  12.258  -6.546
    7   HD12  LEU  48          HD12      LEU  48   0.048  10.952  -6.371
    8   HD11  LEU  48          HD13      LEU  48  -1.644  10.684  -5.949
    9   HD22  LEU  48          HD21      LEU  48  -0.377   9.317  -9.403
   10   HD21  LEU  48          HD22      LEU  48  -1.225   8.594  -8.037
   11   HD23  LEU  48          HD23      LEU  48   0.350   9.349  -7.797

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ASN  49           H        ASN  49  -4.978  12.122  -9.695
    2    HA   ASN  49           HA       ASN  49  -7.152  10.451  -9.130
    3    HB2  ASN  49           HB2      ASN  49  -7.190  12.882  -8.803
    4    HB3  ASN  49           HB3      ASN  49  -7.091  13.135 -10.541
    5   HD21  ASN  49          HD21      ASN  49  -9.163  14.237 -10.572
    6   HD22  ASN  49          HD22      ASN  49 -10.617  13.387 -10.371

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLU  50           H        GLU  50  -5.921  11.664 -12.231
    2    HA   GLU  50           HA       GLU  50  -7.898  10.413 -13.853
    3    HB2  GLU  50           HB2      GLU  50  -6.448  12.239 -14.681
    4    HB3  GLU  50           HB3      GLU  50  -5.050  11.168 -14.568
    5    HG2  GLU  50           HG2      GLU  50  -6.045   9.639 -16.198
    6    HG3  GLU  50           HG3      GLU  50  -7.509  10.615 -16.259

  No H/Q in entry =           6
  In of MODEL   63
    1    H    ALA  51           H        ALA  51  -4.708   9.421 -12.700
    2    HA   ALA  51           HA       ALA  51  -4.586   6.975 -14.131
    3    HB2  ALA  51           HB1      ALA  51  -2.588   6.685 -13.062
    4    HB1  ALA  51           HB2      ALA  51  -3.253   7.099 -11.483
    5    HB3  ALA  51           HB3      ALA  51  -2.817   8.376 -12.618

  No H/Q in entry =           5
  In of MODEL   63
    1    H    HIS  52           H        HIS  52  -5.711   7.790 -10.861
    2    HA   HIS  52           HA       HIS  52  -6.380   5.175 -10.032
    3    HB2  HIS  52           HB2      HIS  52  -6.227   7.062  -8.475
    4    HB3  HIS  52           HB3      HIS  52  -7.622   7.820  -9.242
    5    HD1  HIS  52           HD1      HIS  52  -9.880   6.238  -9.214
    6    HD2  HIS  52           HD2      HIS  52  -6.919   5.350  -6.418
    7    HE1  HIS  52           HE1      HIS  52 -10.984   4.825  -7.425
    8    HE2  HIS  52           HE2      HIS  52  -9.191   4.276  -5.712

  No H/Q in entry =           8
  In of MODEL   63
    1    H    LEU  53           H        LEU  53  -8.230   7.638 -11.781
    2    HA   LEU  53           HA       LEU  53 -10.734   6.343 -11.763
    3    HB2  LEU  53           HB2      LEU  53  -9.482   8.330 -13.648
    4    HB3  LEU  53           HB3      LEU  53 -11.089   7.669 -13.938
    5    HG   LEU  53           HG       LEU  53 -10.323   8.963 -11.303
    6   HD11  LEU  53          HD11      LEU  53 -11.420  10.187 -13.840
    7   HD13  LEU  53          HD12      LEU  53 -10.033  10.715 -12.884
    8   HD12  LEU  53          HD13      LEU  53 -11.668  10.929 -12.264
    9   HD23  LEU  53          HD21      LEU  53 -12.903   9.383 -11.399
   10   HD22  LEU  53          HD22      LEU  53 -12.330   7.773 -10.984
   11   HD21  LEU  53          HD23      LEU  53 -12.915   8.101 -12.604

  No H/Q in entry =          11
  In of MODEL   63
    1    H    VAL  54           H        VAL  54  -8.016   6.159 -14.041
    2    HA   VAL  54           HA       VAL  54  -9.264   4.396 -15.874
    3    HB   VAL  54           HB       VAL  54  -6.347   4.902 -15.232
    4   HG12  VAL  54          HG11      VAL  54  -6.134   3.829 -17.630
    5   HG11  VAL  54          HG12      VAL  54  -7.655   3.044 -17.208
    6   HG13  VAL  54          HG13      VAL  54  -6.225   2.786 -16.211
    7   HG22  VAL  54          HG21      VAL  54  -7.134   6.849 -16.257
    8   HG21  VAL  54          HG22      VAL  54  -8.341   5.989 -17.211
    9   HG23  VAL  54          HG23      VAL  54  -6.641   5.913 -17.667

  No H/Q in entry =           9
  In of MODEL   63
    1    H    GLN  55           H        GLN  55  -7.222   3.838 -13.007
    2    HA   GLN  55           HA       GLN  55  -7.133   1.023 -13.278
    3    HB2  GLN  55           HB2      GLN  55  -5.557   1.913 -11.777
    4    HB3  GLN  55           HB3      GLN  55  -6.762   2.874 -10.925
    5    HG2  GLN  55           HG2      GLN  55  -7.429   1.110  -9.606
    6    HG3  GLN  55           HG3      GLN  55  -7.222  -0.071 -10.893
    7   HE21  GLN  55          HE21      GLN  55  -5.590  -1.521 -10.429
    8   HE22  GLN  55          HE22      GLN  55  -4.193  -1.173  -9.536

  No H/Q in entry =           8
  In of MODEL   63
    1    H    THR  56           H        THR  56  -9.443   3.176 -11.619
    2    HA   THR  56           HA       THR  56 -11.006   1.285 -10.315
    3    HB   THR  56           HB       THR  56 -11.920   3.796 -11.749
    4    HG1  THR  56           HG1      THR  56 -11.389   3.333  -9.007
    5   HG22  THR  56          HG21      THR  56 -13.738   3.558  -9.869
    6   HG21  THR  56          HG22      THR  56 -13.299   1.850  -9.929
    7   HG23  THR  56          HG23      THR  56 -13.915   2.656 -11.373

  No H/Q in entry =           7
  In of MODEL   63
    1    H    LYS  57           H        LYS  57 -11.258   2.383 -13.693
    2    HA   LYS  57           HA       LYS  57 -13.424   0.698 -14.423
    3    HB2  LYS  57           HB2      LYS  57 -12.655   2.624 -15.778
    4    HB3  LYS  57           HB3      LYS  57 -11.132   1.801 -16.083
    5    HG2  LYS  57           HG2      LYS  57 -12.519   1.484 -18.019
    6    HG3  LYS  57           HG3      LYS  57 -12.438  -0.057 -17.174
    7    HD2  LYS  57           HD2      LYS  57 -14.633   0.231 -16.250
    8    HD3  LYS  57           HD3      LYS  57 -14.699   1.917 -16.757
    9    HE2  LYS  57           HE2      LYS  57 -16.021   0.655 -18.336
   10    HE3  LYS  57           HE3      LYS  57 -14.529   1.094 -19.167
   11    HZ1  LYS  57           HZ1      LYS  57 -14.381  -1.389 -17.718
   12    HZ3  LYS  57           HZ2      LYS  57 -13.892  -1.020 -19.302
   13    HZ2  LYS  57           HZ3      LYS  57 -15.516  -1.401 -18.977

  No H/Q in entry =          13
  In of MODEL   63
    1    H    LEU  58           H        LEU  58  -9.919   0.269 -14.419
    2    HA   LEU  58           HA       LEU  58  -9.944  -2.242 -15.718
    3    HB2  LEU  58           HB2      LEU  58  -7.885  -0.957 -13.934
    4    HB3  LEU  58           HB3      LEU  58  -7.635  -2.474 -14.798
    5    HG   LEU  58           HG       LEU  58  -8.410   0.136 -16.139
    6   HD11  LEU  58          HD11      LEU  58  -5.753  -1.102 -15.492
    7   HD13  LEU  58          HD12      LEU  58  -6.249   0.588 -15.429
    8   HD12  LEU  58          HD13      LEU  58  -5.931  -0.176 -16.983
    9   HD22  LEU  58          HD21      LEU  58  -9.008  -1.420 -17.729
   10   HD21  LEU  58          HD22      LEU  58  -7.956  -2.670 -17.068
   11   HD23  LEU  58          HD23      LEU  58  -7.281  -1.391 -18.077

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  59           H        ILE  59 -10.719  -1.354 -12.452
    2    HA   ILE  59           HA       ILE  59 -10.352  -4.125 -11.521
    3    HB   ILE  59           HB       ILE  59  -9.890  -1.863 -10.119
    4   HG12  ILE  59          HG12      ILE  59 -11.239  -4.212  -8.773
    5   HG13  ILE  59          HG13      ILE  59  -9.614  -4.306  -9.403
    6   HG21  ILE  59          HG21      ILE  59 -12.436  -1.358 -10.334
    7   HG23  ILE  59          HG22      ILE  59 -11.694  -1.177  -8.761
    8   HG22  ILE  59          HG23      ILE  59 -12.641  -2.614  -9.136
    9   HD12  ILE  59          HD11      ILE  59 -10.610  -2.388  -7.311
   10   HD11  ILE  59          HD12      ILE  59  -9.002  -2.310  -8.018
   11   HD13  ILE  59          HD13      ILE  59  -9.477  -3.711  -7.057

  No H/Q in entry =          11
  In of MODEL   63
    1    H    GLU  60           H        GLU  60 -12.924  -1.809 -12.283
    2    HA   GLU  60           HA       GLU  60 -15.092  -3.332 -11.245
    3    HB2  GLU  60           HB2      GLU  60 -16.438  -1.723 -12.196
    4    HB3  GLU  60           HB3      GLU  60 -14.911  -0.846 -12.205
    5    HG2  GLU  60           HG2      GLU  60 -15.708  -0.570 -14.408
    6    HG3  GLU  60           HG3      GLU  60 -14.571  -1.894 -14.554

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLY  61           H        GLY  61 -13.464  -3.301 -14.384
    2    HA3  GLY  61           HA2      GLY  61 -15.187  -5.544 -15.259
    3    HA2  GLY  61           HA3      GLY  61 -14.358  -4.434 -16.344

  No H/Q in entry =           3
  In of MODEL   63
    1    H    ASP  62           H        ASP  62 -12.943  -5.895 -13.486
    2    HA   ASP  62           HA       ASP  62 -10.620  -6.734 -14.841
    3    HB2  ASP  62           HB2      ASP  62 -10.878  -6.222 -12.379
    4    HB3  ASP  62           HB3      ASP  62 -11.668  -7.786 -12.207

  No H/Q in entry =           4
  In of MODEL   63
    1    H    ALA  63           H        ALA  63 -13.547  -8.582 -13.900
    2    HA   ALA  63           HA       ALA  63 -12.670 -11.180 -14.522
    3    HB3  ALA  63           HB1      ALA  63 -15.024 -11.733 -14.733
    4    HB1  ALA  63           HB2      ALA  63 -15.437 -10.051 -15.063
    5    HB2  ALA  63           HB3      ALA  63 -14.875 -10.523 -13.459

  No H/Q in entry =           5
  In of MODEL   63
    1    H    GLY  64           H        GLY  64 -14.332 -12.153 -16.471
    2    HA3  GLY  64           HA2      GLY  64 -14.837 -11.980 -18.808
    3    HA2  GLY  64           HA3      GLY  64 -13.555 -10.785 -18.960

  No H/Q in entry =           3
  In of MODEL   63
    1    H    GLU  65           H        GLU  65 -11.520 -12.161 -17.540
    2    HA   GLU  65           HA       GLU  65 -10.525 -13.804 -19.623
    3    HB2  GLU  65           HB2      GLU  65  -9.545 -13.366 -16.802
    4    HB3  GLU  65           HB3      GLU  65  -8.664 -14.289 -18.020
    5    HG2  GLU  65           HG2      GLU  65  -7.741 -12.165 -18.289
    6    HG3  GLU  65           HG3      GLU  65  -9.021 -12.155 -19.501

  No H/Q in entry =           6
  In of MODEL   63
    1    H    GLY  66           H        GLY  66 -11.928 -14.514 -16.515
    2    HA3  GLY  66           HA2      GLY  66 -12.832 -17.097 -17.260
    3    HA2  GLY  66           HA3      GLY  66 -11.435 -17.215 -16.208

  No H/Q in entry =           3
  In of MODEL   63
    1    H    LYS  67           H        LYS  67 -13.488 -18.410 -15.238
    2    HA   LYS  67           HA       LYS  67 -15.547 -17.112 -13.978
    3    HB2  LYS  67           HB2      LYS  67 -14.039 -19.587 -13.151
    4    HB3  LYS  67           HB3      LYS  67 -15.562 -19.071 -12.415
    5    HG2  LYS  67           HG2      LYS  67 -16.618 -19.050 -14.668
    6    HG3  LYS  67           HG3      LYS  67 -15.109 -19.640 -15.361
    7    HD2  LYS  67           HD2      LYS  67 -16.569 -21.124 -13.167
    8    HD3  LYS  67           HD3      LYS  67 -16.884 -21.411 -14.880
    9    HE2  LYS  67           HE2      LYS  67 -14.369 -21.767 -15.149
   10    HE3  LYS  67           HE3      LYS  67 -14.279 -21.797 -13.387
   11    HZ2  LYS  67           HZ1      LYS  67 -15.772 -23.643 -15.159
   12    HZ1  LYS  67           HZ2      LYS  67 -16.027 -23.570 -13.482
   13    HZ3  LYS  67           HZ3      LYS  67 -14.508 -24.019 -14.093

  No H/Q in entry =          13
  In of MODEL   63
    1    H    MET  68           H        MET  68 -12.642 -18.163 -12.280
    2    HA   MET  68           HA       MET  68 -13.059 -16.109 -10.217
    3    HB2  MET  68           HB2      MET  68 -11.513 -18.698 -10.211
    4    HB3  MET  68           HB3      MET  68 -11.493 -17.539  -8.883
    5    HG2  MET  68           HG2      MET  68 -14.007 -18.807 -10.007
    6    HG3  MET  68           HG3      MET  68 -13.171 -19.363  -8.555
    7    HE1  MET  68           HE1      MET  68 -16.026 -18.815  -8.547
    8    HE3  MET  68           HE2      MET  68 -16.146 -17.445  -9.649
    9    HE2  MET  68           HE3      MET  68 -16.631 -17.256  -7.965

  No H/Q in entry =           9
  In of MODEL   63
    1    H    LYS  69           H        LYS  69 -11.074 -16.604 -12.915
    2    HA   LYS  69           HA       LYS  69  -8.658 -15.527 -11.770
    3    HB2  LYS  69           HB2      LYS  69  -9.429 -16.257 -14.594
    4    HB3  LYS  69           HB3      LYS  69  -7.838 -15.628 -14.158
    5    HG2  LYS  69           HG2      LYS  69  -7.536 -17.477 -12.556
    6    HG3  LYS  69           HG3      LYS  69  -9.132 -18.100 -12.966
    7    HD2  LYS  69           HD2      LYS  69  -8.382 -18.385 -15.324
    8    HD3  LYS  69           HD3      LYS  69  -6.768 -17.853 -14.848
    9    HE2  LYS  69           HE2      LYS  69  -8.206 -20.220 -13.615
   10    HE3  LYS  69           HE3      LYS  69  -7.015 -20.352 -14.908
   11    HZ3  LYS  69           HZ1      LYS  69  -5.508 -20.425 -13.295
   12    HZ2  LYS  69           HZ2      LYS  69  -6.620 -19.938 -12.108
   13    HZ1  LYS  69           HZ3      LYS  69  -5.806 -18.775 -13.042

  No H/Q in entry =          13
  In of MODEL   63
    1    H    VAL  70           H        VAL  70  -7.569 -13.598 -12.219
    2    HA   VAL  70           HA       VAL  70  -9.136 -11.434 -13.493
    3    HB   VAL  70           HB       VAL  70  -8.343  -9.921 -11.689
    4   HG11  VAL  70          HG11      VAL  70  -9.931 -12.359 -10.838
    5   HG13  VAL  70          HG12      VAL  70 -10.575 -10.859 -11.509
    6   HG12  VAL  70          HG13      VAL  70  -9.844 -10.865  -9.905
    7   HG23  VAL  70          HG21      VAL  70  -7.490 -11.070  -9.572
    8   HG22  VAL  70          HG22      VAL  70  -6.358 -11.051 -10.923
    9   HG21  VAL  70          HG23      VAL  70  -7.258 -12.520 -10.549

  No H/Q in entry =           9
  In of MODEL   63
    1    H    SER  71           H        SER  71  -7.782  -9.589 -14.111
    2    HA   SER  71           HA       SER  71  -5.483 -10.337 -15.585
    3    HB2  SER  71           HB2      SER  71  -6.978  -8.344 -16.044
    4    HB3  SER  71           HB3      SER  71  -6.213  -7.546 -14.672
    5    HG   SER  71           HG       SER  71  -5.220  -7.102 -16.734

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LEU  72           H        LEU  72  -3.506 -10.722 -14.891
    2    HA   LEU  72           HA       LEU  72  -2.747 -10.518 -12.189
    3    HB2  LEU  72           HB2      LEU  72  -1.137 -10.944 -14.700
    4    HB3  LEU  72           HB3      LEU  72  -0.440 -11.007 -13.084
    5    HG   LEU  72           HG       LEU  72  -2.806 -12.711 -13.927
    6   HD13  LEU  72          HD11      LEU  72  -1.285 -14.509 -14.361
    7   HD12  LEU  72          HD12      LEU  72   0.079 -13.597 -13.715
    8   HD11  LEU  72          HD13      LEU  72  -0.655 -13.117 -15.245
    9   HD22  LEU  72          HD21      LEU  72  -2.752 -12.714 -11.578
   10   HD21  LEU  72          HD22      LEU  72  -1.000 -12.584 -11.507
   11   HD23  LEU  72          HD23      LEU  72  -1.751 -14.110 -11.967

  No H/Q in entry =          11
  In of MODEL   63
    1    H    VAL  73           H        VAL  73  -2.071  -8.491 -14.971
    2    HA   VAL  73           HA       VAL  73  -0.135  -6.796 -13.889
    3    HB   VAL  73           HB       VAL  73  -0.566  -5.362 -15.731
    4   HG13  VAL  73          HG11      VAL  73  -0.338  -6.880 -17.514
    5   HG12  VAL  73          HG12      VAL  73  -1.438  -8.048 -16.781
    6   HG11  VAL  73          HG13      VAL  73   0.180  -7.824 -16.118
    7   HG23  VAL  73          HG21      VAL  73  -2.744  -5.984 -17.108
    8   HG22  VAL  73          HG22      VAL  73  -2.834  -4.864 -15.751
    9   HG21  VAL  73          HG23      VAL  73  -3.313  -6.547 -15.536

  No H/Q in entry =           9
  In of MODEL   63
    1    H    LEU  74           H        LEU  74  -3.524  -6.914 -13.283
    2    HA   LEU  74           HA       LEU  74  -4.133  -4.260 -12.652
    3    HB2  LEU  74           HB2      LEU  74  -5.861  -5.932 -12.809
    4    HB3  LEU  74           HB3      LEU  74  -5.155  -6.851 -11.482
    5    HG   LEU  74           HG       LEU  74  -5.569  -4.903  -9.969
    6   HD13  LEU  74          HD11      LEU  74  -5.643  -3.021 -11.395
    7   HD12  LEU  74          HD12      LEU  74  -7.330  -3.269 -10.949
    8   HD11  LEU  74          HD13      LEU  74  -6.746  -3.810 -12.524
    9   HD23  LEU  74          HD21      LEU  74  -8.139  -5.609 -11.326
   10   HD22  LEU  74          HD22      LEU  74  -7.758  -5.500  -9.620
   11   HD21  LEU  74          HD23      LEU  74  -7.186  -6.868 -10.544

  No H/Q in entry =          11
  In of MODEL   63
    1    H    VAL  75           H        VAL  75  -3.062  -6.856 -10.515
    2    HA   VAL  75           HA       VAL  75  -2.830  -5.313  -8.169
    3    HB   VAL  75           HB       VAL  75  -1.337  -7.802  -8.987
    4   HG12  VAL  75          HG11      VAL  75  -0.862  -7.967  -6.517
    5   HG11  VAL  75          HG12      VAL  75  -1.538  -6.357  -6.319
    6   HG13  VAL  75          HG13      VAL  75  -0.075  -6.581  -7.264
    7   HG21  VAL  75          HG21      VAL  75  -3.840  -7.927  -8.765
    8   HG23  VAL  75          HG22      VAL  75  -3.684  -7.347  -7.108
    9   HG22  VAL  75          HG23      VAL  75  -2.993  -8.905  -7.567

  No H/Q in entry =           9
  In of MODEL   63
    1    H    GLU  76           H        GLU  76  -0.457  -6.064 -10.742
    2    HA   GLU  76           HA       GLU  76   1.744  -4.721  -9.610
    3    HB2  GLU  76           HB2      GLU  76   1.923  -6.188 -11.600
    4    HB3  GLU  76           HB3      GLU  76   0.994  -5.032 -12.540
    5    HG2  GLU  76           HG2      GLU  76   3.315  -4.679 -13.074
    6    HG3  GLU  76           HG3      GLU  76   2.817  -3.319 -12.087

  No H/Q in entry =           6
  In of MODEL   63
    1    H    ALA  77           H        ALA  77  -0.818  -3.511 -11.758
    2    HA   ALA  77           HA       ALA  77   0.170  -0.865 -11.938
    3    HB2  ALA  77           HB1      ALA  77  -2.296  -0.348 -12.479
    4    HB3  ALA  77           HB2      ALA  77  -2.566  -2.082 -12.306
    5    HB1  ALA  77           HB3      ALA  77  -1.457  -1.482 -13.538

  No H/Q in entry =           5
  In of MODEL   63
    1    H    GLN  78           H        GLN  78  -2.067  -2.429  -9.701
    2    HA   GLN  78           HA       GLN  78  -2.855  -0.116  -8.280
    3    HB2  GLN  78           HB2      GLN  78  -3.966  -2.373  -8.187
    4    HB3  GLN  78           HB3      GLN  78  -2.613  -2.940  -7.210
    5    HG2  GLN  78           HG2      GLN  78  -3.100  -1.209  -5.529
    6    HG3  GLN  78           HG3      GLN  78  -4.457  -0.642  -6.502
    7   HE21  GLN  78          HE21      GLN  78  -4.897  -1.613  -3.854
    8   HE22  GLN  78          HE22      GLN  78  -5.747  -3.080  -3.953

  No H/Q in entry =           8
  In of MODEL   63
    1    H    LEU  79           H        LEU  79  -0.169  -2.372  -7.876
    2    HA   LEU  79           HA       LEU  79   0.840  -1.484  -5.429
    3    HB2  LEU  79           HB2      LEU  79   1.697  -3.488  -6.517
    4    HB3  LEU  79           HB3      LEU  79   2.323  -2.531  -7.855
    5    HG   LEU  79           HG       LEU  79   3.899  -1.396  -6.369
    6   HD13  LEU  79          HD11      LEU  79   2.924  -1.160  -4.287
    7   HD12  LEU  79          HD12      LEU  79   4.008  -2.510  -3.963
    8   HD11  LEU  79          HD13      LEU  79   2.298  -2.809  -4.270
    9   HD23  LEU  79          HD21      LEU  79   5.124  -3.547  -5.491
   10   HD22  LEU  79          HD22      LEU  79   4.896  -3.341  -7.225
   11   HD21  LEU  79          HD23      LEU  79   3.832  -4.415  -6.322

  No H/Q in entry =          11
  In of MODEL   63
    1    H    HIS  80           H        HIS  80   1.664  -0.354  -8.709
    2    HA   HIS  80           HA       HIS  80   3.482   1.632  -7.805
    3    HB2  HIS  80           HB2      HIS  80   2.158   0.946 -10.372
    4    HB3  HIS  80           HB3      HIS  80   2.753   2.598 -10.203
    5    HD1  HIS  80           HD1      HIS  80   5.147   2.904 -10.757
    6    HD2  HIS  80           HD2      HIS  80   4.349  -1.013  -9.570
    7    HE1  HIS  80           HE1      HIS  80   7.336   1.630 -10.958
    8    HE2  HIS  80           HE2      HIS  80   6.861  -0.760 -10.238

  No H/Q in entry =           8
  In of MODEL   63
    1    H    LEU  81           H        LEU  81   0.065   1.791  -8.737
    2    HA   LEU  81           HA       LEU  81  -0.210   4.582  -8.391
    3    HB2  LEU  81           HB2      LEU  81  -2.220   2.333  -8.293
    4    HB3  LEU  81           HB3      LEU  81  -2.674   4.035  -8.188
    5    HG   LEU  81           HG       LEU  81  -1.010   2.896 -10.452
    6   HD12  LEU  81          HD11      LEU  81  -3.260   3.217 -11.719
    7   HD11  LEU  81          HD12      LEU  81  -3.994   3.141 -10.117
    8   HD13  LEU  81          HD13      LEU  81  -3.056   1.778 -10.723
    9   HD23  LEU  81          HD21      LEU  81  -2.125   5.043 -11.525
   10   HD22  LEU  81          HD22      LEU  81  -0.695   5.212 -10.511
   11   HD21  LEU  81          HD23      LEU  81  -2.291   5.555  -9.847

  No H/Q in entry =          11
  In of MODEL   63
    1    H    MET  82           H        MET  82  -0.833   1.885  -6.144
    2    HA   MET  82           HA       MET  82  -1.860   3.461  -4.036
    3    HB2  MET  82           HB2      MET  82  -0.481   0.777  -4.105
    4    HB3  MET  82           HB3      MET  82  -1.040   1.495  -2.597
    5    HG2  MET  82           HG2      MET  82  -2.806   1.007  -5.016
    6    HG3  MET  82           HG3      MET  82  -2.706  -0.072  -3.626
    7    HE3  MET  82           HE1      MET  82  -4.393   1.563  -0.781
    8    HE2  MET  82           HE2      MET  82  -2.667   1.845  -0.988
    9    HE1  MET  82           HE3      MET  82  -3.357   0.288  -1.439

  No H/Q in entry =           9
  In of MODEL   63
    1    H    THR  83           H        THR  83   1.433   2.385  -4.775
    2    HA   THR  83           HA       THR  83   2.680   3.483  -2.488
    3    HB   THR  83           HB       THR  83   4.755   3.438  -3.990
    4    HG1  THR  83           HG1      THR  83   4.488   2.919  -6.013
    5   HG22  THR  83          HG21      THR  83   4.312   0.781  -4.327
    6   HG21  THR  83          HG22      THR  83   3.038   1.152  -3.167
    7   HG23  THR  83          HG23      THR  83   4.722   1.498  -2.769

  No H/Q in entry =           7
  In of MODEL   63
    1    H    SER  84           H        SER  84   2.261   4.775  -5.777
    2    HA   SER  84           HA       SER  84   3.601   7.216  -5.331
    3    HB2  SER  84           HB2      SER  84   1.505   6.387  -7.325
    4    HB3  SER  84           HB3      SER  84   2.180   8.016  -7.302
    5    HG   SER  84           HG       SER  84   3.554   5.545  -7.622

  No H/Q in entry =           5
  In of MODEL   63
    1    H    MET  85           H        MET  85   0.112   6.451  -5.114
    2    HA   MET  85           HA       MET  85  -0.747   9.057  -4.490
    3    HB2  MET  85           HB2      MET  85  -2.276   7.248  -5.146
    4    HB3  MET  85           HB3      MET  85  -1.963   6.435  -3.613
    5    HG2  MET  85           HG2      MET  85  -2.840   8.387  -2.388
    6    HG3  MET  85           HG3      MET  85  -3.131   9.217  -3.915
    7    HE1  MET  85           HE1      MET  85  -4.599   8.229  -5.833
    8    HE3  MET  85           HE2      MET  85  -5.429   9.375  -4.783
    9    HE2  MET  85           HE3      MET  85  -6.264   7.920  -5.321

  No H/Q in entry =           9
  In of MODEL   63
    1    H    LEU  86           H        LEU  86   0.207   6.388  -2.371
    2    HA   LEU  86           HA       LEU  86  -0.295   7.680   0.084
    3    HB2  LEU  86           HB2      LEU  86   0.168   5.211  -0.326
    4    HB3  LEU  86           HB3      LEU  86   1.873   5.644  -0.443
    5    HG   LEU  86           HG       LEU  86   1.577   6.795   1.834
    6   HD11  LEU  86          HD11      LEU  86  -1.122   6.027   1.397
    7   HD13  LEU  86          HD12      LEU  86  -0.437   6.769   2.841
    8   HD12  LEU  86          HD13      LEU  86  -0.527   5.013   2.716
    9   HD23  LEU  86          HD21      LEU  86   1.155   3.802   1.949
   10   HD22  LEU  86          HD22      LEU  86   2.170   4.808   2.980
   11   HD21  LEU  86          HD23      LEU  86   2.649   4.491   1.313

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ALA  87           H        ALA  87   2.660   7.397  -1.848
    2    HA   ALA  87           HA       ALA  87   4.388   8.802  -0.140
    3    HB3  ALA  87           HB1      ALA  87   4.447   7.801  -2.853
    4    HB2  ALA  87           HB2      ALA  87   5.796   8.128  -1.769
    5    HB1  ALA  87           HB3      ALA  87   5.166   9.412  -2.799

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ARG  88           H        ARG  88   2.402   9.948  -2.829
    2    HA   ARG  88           HA       ARG  88   3.177  12.637  -2.711
    3    HB2  ARG  88           HB2      ARG  88   1.897  11.492  -4.556
    4    HB3  ARG  88           HB3      ARG  88   0.454  11.630  -3.552
    5    HG2  ARG  88           HG2      ARG  88   1.473  14.211  -3.471
    6    HG3  ARG  88           HG3      ARG  88   1.875  13.704  -5.110
    7    HD2  ARG  88           HD2      ARG  88  -0.276  13.786  -5.777
    8    HD3  ARG  88           HD3      ARG  88  -0.843  12.927  -4.345
    9    HE   ARG  88           HE       ARG  88  -1.039  15.706  -4.748
   10   HH21  ARG  88          HH11      ARG  88  -1.542  17.028  -2.997
   11   HH22  ARG  88          HH12      ARG  88  -1.223  16.484  -1.386
   12   HH11  ARG  88          HH21      ARG  88   0.010  13.434  -2.398
   13   HH12  ARG  88          HH22      ARG  88  -0.362  14.443  -1.047

  No H/Q in entry =          13
  In of MODEL   63
    1    H    GLU  89           H        GLU  89   0.496  10.955  -1.041
    2    HA   GLU  89           HA       GLU  89  -0.594  13.262   0.190
    3    HB2  GLU  89           HB2      GLU  89  -1.713  11.023   0.109
    4    HB3  GLU  89           HB3      GLU  89  -0.572  10.462   1.331
    5    HG2  GLU  89           HG2      GLU  89  -1.370  12.154   2.910
    6    HG3  GLU  89           HG3      GLU  89  -2.440  12.830   1.684

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LEU  90           H        LEU  90   1.873  10.964   1.319
    2    HA   LEU  90           HA       LEU  90   2.265  12.197   3.849
    3    HB2  LEU  90           HB2      LEU  90   4.013  10.430   2.139
    4    HB3  LEU  90           HB3      LEU  90   4.456  10.938   3.774
    5    HG   LEU  90           HG       LEU  90   1.811   9.597   3.144
    6   HD12  LEU  90          HD11      LEU  90   2.964   7.546   4.127
    7   HD11  LEU  90          HD12      LEU  90   4.483   8.402   3.868
    8   HD13  LEU  90          HD13      LEU  90   3.452   8.002   2.493
    9   HD22  LEU  90          HD21      LEU  90   1.577  10.511   5.273
   10   HD21  LEU  90          HD22      LEU  90   3.300  10.401   5.631
   11   HD23  LEU  90          HD23      LEU  90   2.293   8.954   5.687

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  91           H        ILE  91   3.824  12.593   0.702
    2    HA   ILE  91           HA       ILE  91   5.814  14.418   1.521
    3    HB   ILE  91           HB       ILE  91   4.465  13.941  -1.142
    4   HG12  ILE  91          HG12      ILE  91   7.310  13.447  -0.210
    5   HG13  ILE  91          HG13      ILE  91   6.030  12.250  -0.035
    6   HG22  ILE  91          HG21      ILE  91   6.679  15.289  -1.856
    7   HG21  ILE  91          HG22      ILE  91   6.392  16.083  -0.307
    8   HG23  ILE  91          HG23      ILE  91   5.151  16.119  -1.558
    9   HD13  ILE  91          HD11      ILE  91   5.823  11.937  -2.341
   10   HD12  ILE  91          HD12      ILE  91   7.561  12.177  -2.151
   11   HD11  ILE  91          HD13      ILE  91   6.544  13.504  -2.717

  No H/Q in entry =          11
  In of MODEL   63
    1    H    THR  92           H        THR  92   2.439  14.859   0.563
    2    HA   THR  92           HA       THR  92   2.416  17.683   0.516
    3    HB   THR  92           HB       THR  92   0.256  15.687   1.237
    4    HG1  THR  92           HG1      THR  92   0.530  15.518  -0.853
    5   HG22  THR  92          HG21      THR  92  -1.152  17.854   0.545
    6   HG21  THR  92          HG22      THR  92   0.251  18.675   1.226
    7   HG23  THR  92          HG23      THR  92  -0.678  17.550   2.215

  No H/Q in entry =           7
  In of MODEL   63
    1    H    GLU  93           H        GLU  93   1.902  15.371   3.167
    2    HA   GLU  93           HA       GLU  93   1.401  17.266   5.201
    3    HB2  GLU  93           HB2      GLU  93   2.714  14.538   5.406
    4    HB3  GLU  93           HB3      GLU  93   2.043  15.460   6.753
    5    HG2  GLU  93           HG2      GLU  93   0.395  14.696   4.334
    6    HG3  GLU  93           HG3      GLU  93   0.515  13.666   5.756

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LEU  94           H        LEU  94   4.389  15.785   4.002
    2    HA   LEU  94           HA       LEU  94   6.168  16.921   5.871
    3    HB2  LEU  94           HB2      LEU  94   6.528  15.967   3.030
    4    HB3  LEU  94           HB3      LEU  94   7.872  16.618   3.964
    5    HG   LEU  94           HG       LEU  94   6.145  14.420   5.113
    6   HD11  LEU  94          HD11      LEU  94   8.210  14.200   2.951
    7   HD13  LEU  94          HD12      LEU  94   6.766  13.227   3.229
    8   HD12  LEU  94          HD13      LEU  94   8.205  12.968   4.214
    9   HD23  LEU  94          HD21      LEU  94   8.350  13.874   6.232
   10   HD22  LEU  94          HD22      LEU  94   7.691  15.452   6.665
   11   HD21  LEU  94          HD23      LEU  94   9.013  15.335   5.503

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  95           H        ILE  95   4.986  18.109   2.743
    2    HA   ILE  95           HA       ILE  95   6.560  20.465   2.672
    3    HB   ILE  95           HB       ILE  95   3.897  19.791   1.401
    4   HG12  ILE  95          HG12      ILE  95   6.670  20.129   0.226
    5   HG13  ILE  95          HG13      ILE  95   6.026  18.575   0.743
    6   HG21  ILE  95          HG21      ILE  95   5.647  22.257   1.167
    7   HG23  ILE  95          HG22      ILE  95   3.927  22.190   1.547
    8   HG22  ILE  95          HG23      ILE  95   4.487  21.796  -0.079
    9   HD13  ILE  95          HD11      ILE  95   4.442  18.509  -0.964
   10   HD12  ILE  95          HD12      ILE  95   5.780  19.329  -1.768
   11   HD11  ILE  95          HD13      ILE  95   4.418  20.263  -1.152

  No H/Q in entry =          11
  In of MODEL   63
    1    H    GLU  96           H        GLU  96   3.329  19.812   4.010
    2    HA   GLU  96           HA       GLU  96   2.724  22.456   4.782
    3    HB2  GLU  96           HB2      GLU  96   1.047  20.675   4.809
    4    HB3  GLU  96           HB3      GLU  96   1.925  19.841   6.088
    5    HG2  GLU  96           HG2      GLU  96   0.929  21.119   7.678
    6    HG3  GLU  96           HG3      GLU  96   1.456  22.595   6.880

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LEU  97           H        LEU  97   4.585  19.895   6.369
    2    HA   LEU  97           HA       LEU  97   4.980  21.231   8.841
    3    HB2  LEU  97           HB2      LEU  97   6.493  19.066   7.395
    4    HB3  LEU  97           HB3      LEU  97   7.105  19.743   8.902
    5    HG   LEU  97           HG       LEU  97   4.289  18.656   8.625
    6   HD12  LEU  97          HD11      LEU  97   5.243  16.636   9.816
    7   HD11  LEU  97          HD12      LEU  97   6.850  17.266   9.452
    8   HD13  LEU  97          HD13      LEU  97   5.761  16.816   8.139
    9   HD23  LEU  97          HD21      LEU  97   4.778  18.349  11.182
   10   HD22  LEU  97          HD22      LEU  97   4.392  19.964  10.590
   11   HD21  LEU  97          HD23      LEU  97   6.068  19.520  10.909

  No H/Q in entry =          11
  In of MODEL   63
    1    H    HIS  98           H        HIS  98   6.807  21.258   5.789
    2    HA   HIS  98           HA       HIS  98   8.977  22.829   6.665
    3    HB2  HIS  98           HB2      HIS  98   7.645  22.589   3.957
    4    HB3  HIS  98           HB3      HIS  98   9.091  23.563   4.231
    5    HD1  HIS  98           HD1      HIS  98   7.872  19.995   4.252
    6    HD2  HIS  98           HD2      HIS  98  11.464  22.082   4.636
    7    HE1  HIS  98           HE1      HIS  98   9.722  18.262   4.161
    8    HE2  HIS  98           HE2      HIS  98  11.913  19.512   4.395

  No H/Q in entry =           8
  In of MODEL   63
    1    H    GLU  99           H        GLU  99   5.741  23.676   5.539
    2    HA   GLU  99           HA       GLU  99   6.126  26.490   5.489
    3    HB2  GLU  99           HB2      GLU  99   4.229  25.331   4.379
    4    HB3  GLU  99           HB3      GLU  99   3.554  24.963   5.966
    5    HG2  GLU  99           HG2      GLU  99   3.386  27.353   6.481
    6    HG3  GLU  99           HG3      GLU  99   4.142  27.759   4.943

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LYS 100           H        LYS 100   5.026  24.246   8.016
    2    HA   LYS 100           HA       LYS 100   4.471  26.292   9.927
    3    HB2  LYS 100           HB2      LYS 100   5.044  23.338  10.251
    4    HB3  LYS 100           HB3      LYS 100   4.618  24.406  11.595
    5    HG2  LYS 100           HG2      LYS 100   2.536  25.054  10.379
    6    HG3  LYS 100           HG3      LYS 100   2.943  23.890   9.115
    7    HD2  LYS 100           HD2      LYS 100   2.884  22.062  10.769
    8    HD3  LYS 100           HD3      LYS 100   2.494  23.220  12.044
    9    HE2  LYS 100           HE2      LYS 100   0.425  23.852  10.812
   10    HE3  LYS 100           HE3      LYS 100   0.805  22.637   9.586
   11    HZ1  LYS 100           HZ1      LYS 100   0.578  21.957  12.467
   12    HZ3  LYS 100           HZ2      LYS 100   0.541  20.909  11.127
   13    HZ2  LYS 100           HZ3      LYS 100  -0.767  21.951  11.430

  No H/Q in entry =          13
  In of MODEL   63
    1    H    LEU 101           H        LEU 101   7.378  24.494   9.044
    2    HA   LEU 101           HA       LEU 101   9.009  25.319  11.229
    3    HB2  LEU 101           HB2      LEU 101   9.562  24.344   8.438
    4    HB3  LEU 101           HB3      LEU 101  10.879  25.001   9.404
    5    HG   LEU 101           HG       LEU 101   9.057  22.845  10.484
    6   HD12  LEU 101          HD11      LEU 101  11.098  21.347   9.840
    7   HD11  LEU 101          HD12      LEU 101  11.452  22.615   8.668
    8   HD13  LEU 101          HD13      LEU 101   9.919  21.746   8.591
    9   HD21  LEU 101          HD21      LEU 101  11.794  23.942  11.178
   10   HD23  LEU 101          HD22      LEU 101  11.254  22.368  11.758
   11   HD22  LEU 101          HD23      LEU 101  10.373  23.825  12.215

  No H/Q in entry =          11
  In of MODEL   63
    1    H    LYS 102           H        LYS 102   7.401  27.197   9.119
    2    HA   LYS 102           HA       LYS 102   7.481  29.491   8.837
    3    HB2  LYS 102           HB2      LYS 102   9.075  29.361  10.913
    4    HB3  LYS 102           HB3      LYS 102  10.359  29.558   9.736
    5    HG2  LYS 102           HG2      LYS 102   8.271  31.513  10.637
    6    HG3  LYS 102           HG3      LYS 102   9.981  31.769  10.362
    7    HD2  LYS 102           HD2      LYS 102   7.996  31.362   8.088
    8    HD3  LYS 102           HD3      LYS 102   8.393  32.937   8.758
    9    HE2  LYS 102           HE2      LYS 102   9.733  31.759   6.660
   10    HE3  LYS 102           HE3      LYS 102  10.368  33.059   7.669
   11    HZ2  LYS 102           HZ1      LYS 102  11.880  31.150   7.463
   12    HZ1  LYS 102           HZ2      LYS 102  10.725  30.168   8.217
   13    HZ3  LYS 102           HZ3      LYS 102  11.434  31.449   9.073

  No H/Q in entry =          13
  In of MODEL   63
    1    H    ALA 103           H        ALA 103  10.726  28.145   8.221
    2    HA   ALA 103           HA       ALA 103  11.665  29.529   6.138
    3    HB2  ALA 103           HB1      ALA 103  12.530  27.316   5.187
    4    HB1  ALA 103           HB2      ALA 103  11.651  26.538   6.502
    5    HB3  ALA 103           HB3      ALA 103  12.949  27.677   6.862

  No H/Q in entry =           5
  In of MODEL   63
    1    H1   LYS   3           H1       LYS   3 -30.758   5.544 -20.328
    2    H2   LYS   3           H3       LYS   3 -29.724   5.219 -21.635
    3    H3   LYS   3           H2       LYS   3 -31.119   4.282 -21.403
    4    HA   LYS   3           HA       LYS   3 -30.154   2.945 -19.924
    5    HB2  LYS   3           HB2      LYS   3 -27.840   4.332 -21.226
    6    HB3  LYS   3           HB3      LYS   3 -27.548   3.167 -19.935
    7    HG2  LYS   3           HG2      LYS   3 -28.915   1.528 -21.280
    8    HG3  LYS   3           HG3      LYS   3 -28.835   2.686 -22.605
    9    HD2  LYS   3           HD2      LYS   3 -26.355   2.592 -22.471
   10    HD3  LYS   3           HD3      LYS   3 -26.503   1.332 -21.248
   11    HE2  LYS   3           HE2      LYS   3 -27.938   0.091 -22.973
   12    HE3  LYS   3           HE3      LYS   3 -27.288   1.237 -24.146
   13    HZ3  LYS   3           HZ1      LYS   3 -25.474   0.013 -24.318
   14    HZ2  LYS   3           HZ2      LYS   3 -26.131  -1.125 -23.242
   15    HZ1  LYS   3           HZ3      LYS   3 -25.170   0.145 -22.652

  No H/Q in entry =          15
  In of MODEL   63
    1    H    LYS   4           H        LYS   4 -30.273   2.868 -17.862
    2    HA   LYS   4           HA       LYS   4 -29.611   5.212 -16.263
    3    HB2  LYS   4           HB2      LYS   4 -30.818   2.533 -15.517
    4    HB3  LYS   4           HB3      LYS   4 -30.642   3.908 -14.427
    5    HG2  LYS   4           HG2      LYS   4 -32.369   3.758 -16.903
    6    HG3  LYS   4           HG3      LYS   4 -32.914   3.858 -15.230
    7    HD2  LYS   4           HD2      LYS   4 -32.240   6.093 -15.012
    8    HD3  LYS   4           HD3      LYS   4 -31.154   5.996 -16.398
    9    HE2  LYS   4           HE2      LYS   4 -33.071   7.342 -16.967
   10    HE3  LYS   4           HE3      LYS   4 -33.112   5.840 -17.889
   11    HZ3  LYS   4           HZ1      LYS   4 -34.732   4.966 -16.366
   12    HZ2  LYS   4           HZ2      LYS   4 -35.276   6.439 -17.015
   13    HZ1  LYS   4           HZ3      LYS   4 -34.670   6.382 -15.429

  No H/Q in entry =          13
  In of MODEL   63
    1    H    HIS   5           H        HIS   5 -28.194   5.356 -14.629
    2    HA   HIS   5           HA       HIS   5 -25.894   3.530 -14.827
    3    HB2  HIS   5           HB2      HIS   5 -26.201   6.321 -13.718
    4    HB3  HIS   5           HB3      HIS   5 -24.716   5.375 -13.623
    5    HD1  HIS   5           HD1      HIS   5 -23.200   6.531 -15.202
    6    HD2  HIS   5           HD2      HIS   5 -26.947   5.842 -16.857
    7    HE1  HIS   5           HE1      HIS   5 -22.955   7.035 -17.663
    8    HE2  HIS   5           HE2      HIS   5 -25.241   6.603 -18.641

  No H/Q in entry =           8
  In of MODEL   63
    1    H    ILE   6           H        ILE   6 -25.702   2.001 -13.454
    2    HA   ILE   6           HA       ILE   6 -26.767   2.352 -10.733
    3    HB   ILE   6           HB       ILE   6 -25.883  -0.158 -12.163
    4   HG12  ILE   6          HG12      ILE   6 -28.656   0.792 -11.432
    5   HG13  ILE   6          HG13      ILE   6 -27.962   0.904 -13.049
    6   HG23  ILE   6          HG21      ILE   6 -26.312  -1.352 -10.277
    7   HG22  ILE   6          HG22      ILE   6 -27.495  -0.191  -9.672
    8   HG21  ILE   6          HG23      ILE   6 -25.771   0.155  -9.538
    9   HD13  ILE   6          HD11      ILE   6 -28.397  -1.232 -13.496
   10   HD12  ILE   6          HD12      ILE   6 -29.459  -1.174 -12.089
   11   HD11  ILE   6          HD13      ILE   6 -27.807  -1.770 -11.923

  No H/Q in entry =          11
  In of MODEL   63
    1    H    TYR   7           H        TYR   7 -25.053   3.041  -9.411
    2    HA   TYR   7           HA       TYR   7 -22.318   2.076  -9.972
    3    HB2  TYR   7           HB2      TYR   7 -23.337   4.552  -8.602
    4    HB3  TYR   7           HB3      TYR   7 -21.651   4.042  -8.569
    5    HD1  TYR   7           HD1      TYR   7 -22.587   2.998 -11.659
    6    HD2  TYR   7           HD2      TYR   7 -22.001   6.641  -9.528
    7    HE1  TYR   7           HE1      TYR   7 -22.091   4.162 -13.773
    8    HE2  TYR   7           HE2      TYR   7 -21.548   7.811 -11.635
    9    HH   TYR   7           HH       TYR   7 -21.693   7.653 -13.870

  No H/Q in entry =           9
  In of MODEL   63
    1    H    LEU   8           H        LEU   8 -21.391   0.771  -8.570
    2    HA   LEU   8           HA       LEU   8 -22.607   0.357  -5.910
    3    HB2  LEU   8           HB2      LEU   8 -20.841  -1.356  -7.634
    4    HB3  LEU   8           HB3      LEU   8 -21.081  -1.685  -5.918
    5    HG   LEU   8           HG       LEU   8 -23.545  -1.881  -6.415
    6   HD13  LEU   8          HD11      LEU   8 -23.610  -0.733  -8.565
    7   HD12  LEU   8          HD12      LEU   8 -24.127  -2.406  -8.769
    8   HD11  LEU   8          HD13      LEU   8 -22.504  -1.918  -9.257
    9   HD23  LEU   8          HD21      LEU   8 -22.210  -3.969  -8.000
   10   HD22  LEU   8          HD22      LEU   8 -23.341  -4.098  -6.653
   11   HD21  LEU   8          HD23      LEU   8 -21.644  -3.729  -6.347

  No H/Q in entry =          11
  In of MODEL   63
    1    H    PHE   9           H        PHE   9 -21.409   0.838  -4.103
    2    HA   PHE   9           HA       PHE   9 -18.608   1.761  -4.544
    3    HB2  PHE   9           HB2      PHE   9 -20.711   2.894  -2.705
    4    HB3  PHE   9           HB3      PHE   9 -19.006   3.313  -2.614
    5    HD1  PHE   9           HD1      PHE   9 -17.921   4.593  -4.380
    6    HD2  PHE   9           HD2      PHE   9 -22.098   3.632  -4.591
    7    HE1  PHE   9           HE1      PHE   9 -18.206   6.232  -6.215
    8    HE2  PHE   9           HE2      PHE   9 -22.384   5.284  -6.420
    9    HZ   PHE   9           HZ       PHE   9 -20.437   6.579  -7.238

  No H/Q in entry =           9
  In of MODEL   63
    1    H    SER  10           H        SER  10 -17.054   0.884  -3.328
    2    HA   SER  10           HA       SER  10 -17.343   0.081  -0.622
    3    HB2  SER  10           HB2      SER  10 -17.157  -2.311  -0.842
    4    HB3  SER  10           HB3      SER  10 -18.560  -1.785  -1.757
    5    HG   SER  10           HG       SER  10 -17.641  -2.459  -3.503

  No H/Q in entry =           5
  In of MODEL   63
    1    H    SER  11           H        SER  11 -15.345   0.214   0.256
    2    HA   SER  11           HA       SER  11 -13.119   0.992  -1.255
    3    HB2  SER  11           HB2      SER  11 -13.643   1.233   1.285
    4    HB3  SER  11           HB3      SER  11 -12.791  -0.307   1.416
    5    HG   SER  11           HG       SER  11 -11.702   2.028   1.319

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ALA  12           H        ALA  12 -14.296  -1.690  -2.034
    2    HA   ALA  12           HA       ALA  12 -11.721  -2.991  -2.432
    3    HB2  ALA  12           HB1      ALA  12 -12.699  -5.233  -1.768
    4    HB1  ALA  12           HB2      ALA  12 -14.012  -4.342  -0.999
    5    HB3  ALA  12           HB3      ALA  12 -12.355  -4.128  -0.436

  No H/Q in entry =           5
  In of MODEL   63
    1    H    GLY  13           H        GLY  13 -12.451  -1.989  -4.516
    2    HA3  GLY  13           HA2      GLY  13 -14.636  -2.744  -6.037
    3    HA2  GLY  13           HA3      GLY  13 -13.067  -2.296  -6.722

  No H/Q in entry =           3
  In of MODEL   63
    1    H    MET  14           H        MET  14 -11.585  -4.562  -5.649
    2    HA   MET  14           HA       MET  14 -11.925  -6.366  -7.747
    3    HB2  MET  14           HB2      MET  14  -9.866  -6.351  -6.416
    4    HB3  MET  14           HB3      MET  14 -10.725  -7.034  -5.036
    5    HG2  MET  14           HG2      MET  14  -9.527  -8.801  -6.247
    6    HG3  MET  14           HG3      MET  14 -11.266  -9.044  -6.424
    7    HE3  MET  14           HE1      MET  14  -7.942  -7.849  -8.108
    8    HE2  MET  14           HE2      MET  14  -8.192  -8.783  -9.581
    9    HE1  MET  14           HE3      MET  14  -8.292  -9.582  -8.014

  No H/Q in entry =           9
  In of MODEL   63
    1    H    SER  15           H        SER  15 -13.188  -6.743  -4.438
    2    HA   SER  15           HA       SER  15 -14.471  -9.249  -5.080
    3    HB2  SER  15           HB2      SER  15 -14.779  -7.411  -2.703
    4    HB3  SER  15           HB3      SER  15 -15.803  -8.824  -2.940
    5    HG   SER  15           HG       SER  15 -13.180  -9.403  -3.361

  No H/Q in entry =           5
  In of MODEL   63
    1    H    THR  16           H        THR  16 -15.607  -5.877  -4.832
    2    HA   THR  16           HA       THR  16 -18.377  -6.427  -5.425
    3    HB   THR  16           HB       THR  16 -16.825  -3.874  -5.974
    4    HG1  THR  16           HG1      THR  16 -16.645  -3.667  -3.921
    5   HG22  THR  16          HG21      THR  16 -19.728  -4.376  -5.272
    6   HG21  THR  16          HG22      THR  16 -19.130  -4.040  -6.906
    7   HG23  THR  16          HG23      THR  16 -18.997  -2.817  -5.635

  No H/Q in entry =           7
  In of MODEL   63
    1    H    SER  17           H        SER  17 -15.491  -5.921  -7.207
    2    HA   SER  17           HA       SER  17 -16.536  -5.267  -9.768
    3    HB2  SER  17           HB2      SER  17 -13.924  -6.511  -8.900
    4    HB3  SER  17           HB3      SER  17 -14.307  -6.220 -10.597
    5    HG   SER  17           HG       SER  17 -13.126  -4.510  -9.543

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LEU  18           H        LEU  18 -16.005  -8.361  -8.200
    2    HA   LEU  18           HA       LEU  18 -16.506  -9.939 -10.524
    3    HB2  LEU  18           HB2      LEU  18 -15.346 -10.842  -8.563
    4    HB3  LEU  18           HB3      LEU  18 -16.797 -10.604  -7.590
    5    HG   LEU  18           HG       LEU  18 -17.997 -12.182  -9.116
    6   HD11  LEU  18          HD11      LEU  18 -15.221 -12.375 -10.268
    7   HD13  LEU  18          HD12      LEU  18 -16.750 -12.134 -11.114
    8   HD12  LEU  18          HD13      LEU  18 -16.370 -13.704 -10.410
    9   HD21  LEU  18          HD21      LEU  18 -15.579 -13.191  -7.647
   10   HD23  LEU  18          HD22      LEU  18 -16.927 -14.192  -8.192
   11   HD22  LEU  18          HD23      LEU  18 -17.196 -12.926  -6.993

  No H/Q in entry =          11
  In of MODEL   63
    1    H    LEU  19           H        LEU  19 -18.570  -8.654  -7.920
    2    HA   LEU  19           HA       LEU  19 -20.998  -9.876  -8.796
    3    HB2  LEU  19           HB2      LEU  19 -20.788  -8.960  -6.563
    4    HB3  LEU  19           HB3      LEU  19 -20.527  -7.347  -7.225
    5    HG   LEU  19           HG       LEU  19 -22.824  -7.206  -7.933
    6   HD11  LEU  19          HD11      LEU  19 -22.869 -10.098  -7.150
    7   HD13  LEU  19          HD12      LEU  19 -23.494  -9.328  -8.608
    8   HD12  LEU  19          HD13      LEU  19 -24.348  -9.140  -7.076
    9   HD22  LEU  19          HD21      LEU  19 -22.702  -6.401  -5.804
   10   HD21  LEU  19          HD22      LEU  19 -22.186  -7.946  -5.127
   11   HD23  LEU  19          HD23      LEU  19 -23.875  -7.697  -5.572

  No H/Q in entry =          11
  In of MODEL   63
    1    H    VAL  20           H        VAL  20 -19.493  -6.732  -9.543
    2    HA   VAL  20           HA       VAL  20 -21.555  -5.753 -11.214
    3    HB   VAL  20           HB       VAL  20 -18.565  -5.151 -11.270
    4   HG13  VAL  20          HG11      VAL  20 -19.247  -4.536 -13.436
    5   HG12  VAL  20          HG12      VAL  20 -19.413  -3.042 -12.515
    6   HG11  VAL  20          HG13      VAL  20 -20.838  -4.011 -12.885
    7   HG21  VAL  20          HG21      VAL  20 -20.942  -3.879  -9.979
    8   HG23  VAL  20          HG22      VAL  20 -19.508  -2.930 -10.363
    9   HG22  VAL  20          HG23      VAL  20 -19.384  -4.311  -9.274

  No H/Q in entry =           9
  In of MODEL   63
    1    H    SER  21           H        SER  21 -18.756  -7.820 -12.082
    2    HA   SER  21           HA       SER  21 -19.448  -7.801 -14.860
    3    HB2  SER  21           HB2      SER  21 -17.992  -9.768 -15.082
    4    HB3  SER  21           HB3      SER  21 -17.201  -8.491 -14.161
    5    HG   SER  21           HG       SER  21 -18.442 -10.823 -13.167

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LYS  22           H        LYS  22 -20.590  -9.909 -12.256
    2    HA   LYS  22           HA       LYS  22 -22.061 -11.594 -14.075
    3    HB2  LYS  22           HB2      LYS  22 -21.369 -12.224 -11.718
    4    HB3  LYS  22           HB3      LYS  22 -22.665 -11.170 -11.154
    5    HG2  LYS  22           HG2      LYS  22 -23.538 -13.355 -11.098
    6    HG3  LYS  22           HG3      LYS  22 -24.248 -12.589 -12.518
    7    HD2  LYS  22           HD2      LYS  22 -22.795 -13.770 -13.990
    8    HD3  LYS  22           HD3      LYS  22 -21.802 -14.344 -12.648
    9    HE2  LYS  22           HE2      LYS  22 -23.172 -16.172 -13.380
   10    HE3  LYS  22           HE3      LYS  22 -23.789 -15.629 -11.819
   11    HZ1  LYS  22           HZ1      LYS  22 -25.399 -14.253 -13.237
   12    HZ3  LYS  22           HZ2      LYS  22 -25.680 -15.920 -13.066
   13    HZ2  LYS  22           HZ3      LYS  22 -24.981 -15.319 -14.491

  No H/Q in entry =          13
  In of MODEL   63
    1    H    MET  23           H        MET  23 -22.857  -8.617 -12.327
    2    HA   MET  23           HA       MET  23 -25.645  -8.723 -12.924
    3    HB2  MET  23           HB2      MET  23 -23.826  -6.390 -12.364
    4    HB3  MET  23           HB3      MET  23 -25.564  -6.234 -12.606
    5    HG2  MET  23           HG2      MET  23 -26.018  -7.476 -10.610
    6    HG3  MET  23           HG3      MET  23 -24.311  -7.876 -10.414
    7    HE2  MET  23           HE1      MET  23 -26.658  -4.198  -9.420
    8    HE1  MET  23           HE2      MET  23 -26.862  -5.213 -10.847
    9    HE3  MET  23           HE3      MET  23 -25.828  -3.784 -10.922

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ARG  24           H        ARG  24 -22.836  -7.342 -14.660
    2    HA   ARG  24           HA       ARG  24 -24.269  -6.111 -16.749
    3    HB2  ARG  24           HB2      ARG  24 -21.771  -5.833 -16.193
    4    HB3  ARG  24           HB3      ARG  24 -21.517  -7.339 -17.039
    5    HG2  ARG  24           HG2      ARG  24 -22.376  -6.344 -19.149
    6    HG3  ARG  24           HG3      ARG  24 -22.675  -4.814 -18.282
    7    HD2  ARG  24           HD2      ARG  24 -20.513  -4.610 -19.356
    8    HD3  ARG  24           HD3      ARG  24 -20.245  -4.827 -17.632
    9    HE   ARG  24           HE       ARG  24 -20.028  -7.336 -18.533
   10   HH21  ARG  24          HH11      ARG  24 -17.971  -7.982 -17.894
   11   HH22  ARG  24          HH12      ARG  24 -16.592  -7.073 -18.402
   12   HH11  ARG  24          HH21      ARG  24 -18.630  -4.463 -19.649
   13   HH12  ARG  24          HH22      ARG  24 -16.991  -4.997 -19.449

  No H/Q in entry =          13
  In of MODEL   63
    1    H    ALA  25           H        ALA  25 -23.150  -9.436 -16.329
    2    HA   ALA  25           HA       ALA  25 -23.688 -10.352 -18.958
    3    HB1  ALA  25           HB1      ALA  25 -23.013 -12.358 -18.176
    4    HB3  ALA  25           HB2      ALA  25 -24.117 -12.296 -16.802
    5    HB2  ALA  25           HB3      ALA  25 -22.566 -11.464 -16.724

  No H/Q in entry =           5
  In of MODEL   63
    1    H    GLN  26           H        GLN  26 -25.616 -10.300 -15.998
    2    HA   GLN  26           HA       GLN  26 -27.922 -11.540 -17.056
    3    HB2  GLN  26           HB2      GLN  26 -27.493  -9.717 -14.708
    4    HB3  GLN  26           HB3      GLN  26 -29.042 -10.455 -15.089
    5    HG2  GLN  26           HG2      GLN  26 -26.471 -11.890 -14.487
    6    HG3  GLN  26           HG3      GLN  26 -27.869 -11.756 -13.428
    7   HE21  GLN  26          HE21      GLN  26 -26.607 -13.957 -14.594
    8   HE22  GLN  26          HE22      GLN  26 -27.620 -15.030 -15.392

  No H/Q in entry =           8
  In of MODEL   63
    1    H    ALA  27           H        ALA  27 -27.006  -8.130 -16.739
    2    HA   ALA  27           HA       ALA  27 -29.469  -7.068 -17.639
    3    HB1  ALA  27           HB1      ALA  27 -27.700  -5.714 -16.505
    4    HB3  ALA  27           HB2      ALA  27 -28.241  -4.996 -18.023
    5    HB2  ALA  27           HB3      ALA  27 -26.704  -5.859 -17.956

  No H/Q in entry =           5
  In of MODEL   63
    1    H    GLU  28           H        GLU  28 -26.705  -8.342 -19.378
    2    HA   GLU  28           HA       GLU  28 -27.555  -7.381 -21.958
    3    HB2  GLU  28           HB2      GLU  28 -25.198  -8.040 -21.234
    4    HB3  GLU  28           HB3      GLU  28 -25.734  -9.711 -21.402
    5    HG2  GLU  28           HG2      GLU  28 -24.522  -8.993 -23.354
    6    HG3  GLU  28           HG3      GLU  28 -26.207  -9.330 -23.750

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LYS  29           H        LYS  29 -27.773 -10.436 -20.214
    2    HA   LYS  29           HA       LYS  29 -29.006 -11.969 -22.216
    3    HB2  LYS  29           HB2      LYS  29 -28.025 -12.890 -20.148
    4    HB3  LYS  29           HB3      LYS  29 -29.330 -12.155 -19.219
    5    HG2  LYS  29           HG2      LYS  29 -30.952 -13.562 -20.300
    6    HG3  LYS  29           HG3      LYS  29 -29.715 -14.229 -21.363
    7    HD2  LYS  29           HD2      LYS  29 -28.630 -15.340 -19.557
    8    HD3  LYS  29           HD3      LYS  29 -29.580 -14.463 -18.359
    9    HE2  LYS  29           HE2      LYS  29 -30.318 -16.824 -18.675
   10    HE3  LYS  29           HE3      LYS  29 -31.588 -15.641 -18.998
   11    HZ1  LYS  29           HZ1      LYS  29 -30.941 -15.848 -21.400
   12    HZ3  LYS  29           HZ2      LYS  29 -31.682 -17.216 -20.717
   13    HZ2  LYS  29           HZ3      LYS  29 -30.002 -17.193 -20.959

  No H/Q in entry =          13
  In of MODEL   63
    1    H    TYR  30           H        TYR  30 -30.484  -9.792 -19.825
    2    HA   TYR  30           HA       TYR  30 -33.103 -10.285 -21.142
    3    HB2  TYR  30           HB2      TYR  30 -32.545  -9.048 -18.436
    4    HB3  TYR  30           HB3      TYR  30 -34.139  -9.328 -19.136
    5    HD1  TYR  30           HD1      TYR  30 -35.038 -11.627 -19.311
    6    HD2  TYR  30           HD2      TYR  30 -31.265 -10.846 -17.501
    7    HE1  TYR  30           HE1      TYR  30 -34.973 -13.930 -18.441
    8    HE2  TYR  30           HE2      TYR  30 -31.200 -13.134 -16.635
    9    HH   TYR  30           HH       TYR  30 -32.798 -15.531 -17.711

  No H/Q in entry =           9
  In of MODEL   63
    1    H    GLU  31           H        GLU  31 -30.914  -8.313 -21.928
    2    HA   GLU  31           HA       GLU  31 -30.815  -6.181 -22.813
    3    HB2  GLU  31           HB2      GLU  31 -33.691  -6.919 -23.401
    4    HB3  GLU  31           HB3      GLU  31 -32.828  -5.572 -24.143
    5    HG2  GLU  31           HG2      GLU  31 -31.313  -7.041 -25.240
    6    HG3  GLU  31           HG3      GLU  31 -31.906  -8.429 -24.328

  No H/Q in entry =           6
  In of MODEL   63
    1    H    VAL  32           H        VAL  32 -31.108  -5.998 -20.093
    2    HA   VAL  32           HA       VAL  32 -32.995  -3.872 -19.562
    3    HB   VAL  32           HB       VAL  32 -30.656  -4.810 -17.872
    4   HG12  VAL  32          HG11      VAL  32 -32.257  -3.934 -16.055
    5   HG11  VAL  32          HG12      VAL  32 -33.048  -3.072 -17.374
    6   HG13  VAL  32          HG13      VAL  32 -31.354  -2.753 -17.004
    7   HG21  VAL  32          HG21      VAL  32 -32.396  -6.556 -18.567
    8   HG23  VAL  32          HG22      VAL  32 -33.476  -5.697 -17.468
    9   HG22  VAL  32          HG23      VAL  32 -31.977  -6.399 -16.861

  No H/Q in entry =           9
  In of MODEL   63
    1    HA   PRO  33           HA       PRO  33 -29.914  -0.985 -21.220
    2    HB2  PRO  33           HB2      PRO  33 -31.436   1.235 -21.214
    3    HB3  PRO  33           HB3      PRO  33 -31.863  -0.101 -22.283
    4    HG2  PRO  33           HG2      PRO  33 -32.928   0.497 -19.522
    5    HG3  PRO  33           HG3      PRO  33 -33.841   0.240 -21.009
    6    HD2  PRO  33           HD2      PRO  33 -33.436  -1.780 -19.267
    7    HD3  PRO  33           HD3      PRO  33 -33.439  -2.073 -21.006

  No H/Q in entry =           7
  In of MODEL   63
    1    H    VAL  34           H        VAL  34 -28.716  -1.466 -19.213
    2    HA   VAL  34           HA       VAL  34 -28.495   1.009 -17.631
    3    HB   VAL  34           HB       VAL  34 -27.976  -0.392 -15.632
    4   HG12  VAL  34          HG11      VAL  34 -30.395  -1.264 -15.380
    5   HG11  VAL  34          HG12      VAL  34 -30.661  -0.553 -16.969
    6   HG13  VAL  34          HG13      VAL  34 -30.157   0.466 -15.621
    7   HG21  VAL  34          HG21      VAL  34 -28.087  -2.478 -17.583
    8   HG23  VAL  34          HG22      VAL  34 -29.188  -2.803 -16.244
    9   HG22  VAL  34          HG23      VAL  34 -27.482  -2.500 -15.927

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ILE  35           H        ILE  35 -26.551   1.477 -16.738
    2    HA   ILE  35           HA       ILE  35 -24.199   0.121 -17.882
    3    HB   ILE  35           HB       ILE  35 -24.637   3.032 -17.172
    4   HG12  ILE  35          HG12      ILE  35 -23.565   1.654 -19.642
    5   HG13  ILE  35          HG13      ILE  35 -25.205   2.275 -19.456
    6   HG21  ILE  35          HG21      ILE  35 -22.060   1.502 -17.348
    7   HG23  ILE  35          HG22      ILE  35 -22.560   2.715 -16.172
    8   HG22  ILE  35          HG23      ILE  35 -22.124   3.202 -17.809
    9   HD11  ILE  35          HD11      ILE  35 -23.832   4.492 -18.874
   10   HD13  ILE  35          HD12      ILE  35 -24.312   4.058 -20.515
   11   HD12  ILE  35          HD13      ILE  35 -22.676   3.711 -19.953

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ILE  36           H        ILE  36 -23.021  -0.849 -16.212
    2    HA   ILE  36           HA       ILE  36 -23.560  -0.151 -13.378
    3    HB   ILE  36           HB       ILE  36 -22.686  -2.882 -14.377
    4   HG12  ILE  36          HG12      ILE  36 -25.520  -2.067 -13.732
    5   HG13  ILE  36          HG13      ILE  36 -24.893  -2.093 -15.380
    6   HG23  ILE  36          HG21      ILE  36 -23.105  -3.649 -12.252
    7   HG22  ILE  36          HG22      ILE  36 -24.251  -2.358 -11.890
    8   HG21  ILE  36          HG23      ILE  36 -22.519  -2.020 -11.912
    9   HD13  ILE  36          HD11      ILE  36 -25.043  -4.313 -15.525
   10   HD12  ILE  36          HD12      ILE  36 -26.156  -4.155 -14.167
   11   HD11  ILE  36          HD13      ILE  36 -24.464  -4.560 -13.878

  No H/Q in entry =          11
  In of MODEL   63
    1    H    GLU  37           H        GLU  37 -21.819   0.519 -12.233
    2    HA   GLU  37           HA       GLU  37 -19.097  -0.291 -13.035
    3    HB2  GLU  37           HB2      GLU  37 -20.016   2.515 -12.431
    4    HB3  GLU  37           HB3      GLU  37 -18.326   2.018 -12.527
    5    HG2  GLU  37           HG2      GLU  37 -20.293   1.933 -14.797
    6    HG3  GLU  37           HG3      GLU  37 -19.098   3.199 -14.525

  No H/Q in entry =           6
  In of MODEL   63
    1    H    ALA  38           H        ALA  38 -17.666  -0.472 -11.297
    2    HA   ALA  38           HA       ALA  38 -18.791  -0.216  -8.569
    3    HB1  ALA  38           HB1      ALA  38 -17.021  -2.187  -9.878
    4    HB3  ALA  38           HB2      ALA  38 -18.116  -2.387  -8.510
    5    HB2  ALA  38           HB3      ALA  38 -16.515  -1.690  -8.263

  No H/Q in entry =           5
  In of MODEL   63
    1    H    PHE  39           H        PHE  39 -17.606   1.044  -7.092
    2    HA   PHE  39           HA       PHE  39 -15.058   2.233  -7.939
    3    HB2  PHE  39           HB2      PHE  39 -17.241   3.888  -6.686
    4    HB3  PHE  39           HB3      PHE  39 -15.713   4.442  -7.369
    5    HD1  PHE  39           HD1      PHE  39 -15.503   4.967  -9.641
    6    HD2  PHE  39           HD2      PHE  39 -19.020   3.032  -8.199
    7    HE1  PHE  39           HE1      PHE  39 -16.617   5.396 -11.814
    8    HE2  PHE  39           HE2      PHE  39 -20.140   3.447 -10.360
    9    HZ   PHE  39           HZ       PHE  39 -18.936   4.601 -12.184

  No H/Q in entry =           9
  In of MODEL   63
    1    HA   PRO  40           HA       PRO  40 -14.261   1.613  -3.602
    2    HB2  PRO  40           HB2      PRO  40 -12.526   3.656  -2.998
    3    HB3  PRO  40           HB3      PRO  40 -12.038   2.297  -4.011
    4    HG2  PRO  40           HG2      PRO  40 -13.056   5.002  -4.871
    5    HG3  PRO  40           HG3      PRO  40 -11.602   4.155  -5.403
    6    HD2  PRO  40           HD2      PRO  40 -13.776   4.007  -6.884
    7    HD3  PRO  40           HD3      PRO  40 -12.819   2.551  -6.616

  No H/Q in entry =           7
  In of MODEL   63
    1    H    GLU  41           H        GLU  41 -14.959   2.650  -1.525
    2    HA   GLU  41           HA       GLU  41 -17.213   4.337  -1.634
    3    HB2  GLU  41           HB2      GLU  41 -17.155   4.326   0.744
    4    HB3  GLU  41           HB3      GLU  41 -16.620   2.732   0.213
    5    HG2  GLU  41           HG2      GLU  41 -14.306   3.335   0.660
    6    HG3  GLU  41           HG3      GLU  41 -14.806   4.958   1.135

  No H/Q in entry =           6
  In of MODEL   63
    1    H    THR  42           H        THR  42 -13.888   5.276  -1.602
    2    HA   THR  42           HA       THR  42 -14.297   7.870  -0.480
    3    HB   THR  42           HB       THR  42 -12.108   8.426  -1.498
    4    HG1  THR  42           HG1      THR  42 -11.426   6.041  -2.429
    5   HG23  THR  42          HG21      THR  42 -11.982   7.302   0.606
    6   HG22  THR  42          HG22      THR  42 -10.810   6.508  -0.447
    7   HG21  THR  42          HG23      THR  42 -12.367   5.746  -0.130

  No H/Q in entry =           7
  In of MODEL   63
    1    H    LEU  43           H        LEU  43 -15.089   6.676  -3.575
    2    HA   LEU  43           HA       LEU  43 -15.327   9.416  -4.637
    3    HB2  LEU  43           HB2      LEU  43 -15.627   6.727  -5.961
    4    HB3  LEU  43           HB3      LEU  43 -15.821   8.280  -6.770
    5    HG   LEU  43           HG       LEU  43 -13.248   7.181  -5.663
    6   HD12  LEU  43          HD11      LEU  43 -14.011   7.666  -8.534
    7   HD11  LEU  43          HD12      LEU  43 -14.213   6.103  -7.747
    8   HD13  LEU  43          HD13      LEU  43 -12.605   6.805  -7.911
    9   HD21  LEU  43          HD21      LEU  43 -14.037   9.790  -6.915
   10   HD23  LEU  43          HD22      LEU  43 -12.403   9.159  -7.134
   11   HD22  LEU  43          HD23      LEU  43 -13.011   9.489  -5.513

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ALA  44           H        ALA  44 -17.322   7.632  -2.795
    2    HA   ALA  44           HA       ALA  44 -19.754   7.434  -4.194
    3    HB2  ALA  44           HB1      ALA  44 -19.679   6.382  -2.062
    4    HB3  ALA  44           HB2      ALA  44 -20.803   7.726  -1.867
    5    HB1  ALA  44           HB3      ALA  44 -19.152   7.864  -1.263

  No H/Q in entry =           5
  In of MODEL   63
    1    H    GLY  45           H        GLY  45 -18.405  10.290  -2.701
    2    HA3  GLY  45           HA2      GLY  45 -20.838  11.760  -3.188
    3    HA2  GLY  45           HA3      GLY  45 -19.318  12.414  -2.579

  No H/Q in entry =           3
  In of MODEL   63
    1    H    GLU  46           H        GLU  46 -17.704  11.419  -4.788
    2    HA   GLU  46           HA       GLU  46 -18.296  13.576  -6.643
    3    HB2  GLU  46           HB2      GLU  46 -15.989  13.123  -5.935
    4    HB3  GLU  46           HB3      GLU  46 -16.098  11.500  -6.618
    5    HG2  GLU  46           HG2      GLU  46 -14.865  12.840  -8.136
    6    HG3  GLU  46           HG3      GLU  46 -16.448  12.542  -8.853

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LYS  47           H        LYS  47 -18.139  10.047  -6.968
    2    HA   LYS  47           HA       LYS  47 -19.148  10.177  -9.683
    3    HB2  LYS  47           HB2      LYS  47 -18.629   7.843  -7.835
    4    HB3  LYS  47           HB3      LYS  47 -19.134   7.700  -9.519
    5    HG2  LYS  47           HG2      LYS  47 -16.625   9.123  -8.714
    6    HG3  LYS  47           HG3      LYS  47 -16.673   7.388  -9.022
    7    HD2  LYS  47           HD2      LYS  47 -17.575   7.822 -11.263
    8    HD3  LYS  47           HD3      LYS  47 -17.487   9.555 -10.954
    9    HE2  LYS  47           HE2      LYS  47 -15.068   9.389 -10.689
   10    HE3  LYS  47           HE3      LYS  47 -15.151   7.652 -10.975
   11    HZ3  LYS  47           HZ1      LYS  47 -14.563   8.648 -12.999
   12    HZ2  LYS  47           HZ2      LYS  47 -15.770   9.836 -12.868
   13    HZ1  LYS  47           HZ3      LYS  47 -16.198   8.217 -13.155

  No H/Q in entry =          13
  In of MODEL   63
    1    H    GLY  48           H        GLY  48 -20.571   9.506  -6.559
    2    HA3  GLY  48           HA2      GLY  48 -22.922   8.281  -7.344
    3    HA2  GLY  48           HA3      GLY  48 -22.752   9.319  -5.928

  No H/Q in entry =           3
  In of MODEL   63
    1    H    GLN  49           H        GLN  49 -22.132  11.698  -7.552
    2    HA   GLN  49           HA       GLN  49 -24.692  12.785  -7.816
    3    HB2  GLN  49           HB2      GLN  49 -22.110  13.627  -9.115
    4    HB3  GLN  49           HB3      GLN  49 -23.580  14.584  -9.110
    5    HG2  GLN  49           HG2      GLN  49 -23.503  14.682  -6.670
    6    HG3  GLN  49           HG3      GLN  49 -22.046  13.705  -6.675
    7   HE21  GLN  49          HE21      GLN  49 -21.986  15.971  -5.468
    8   HE22  GLN  49          HE22      GLN  49 -21.049  17.214  -6.122

  No H/Q in entry =           8
  In of MODEL   63
    1    H    ASN  50           H        ASN  50 -22.922  10.847 -10.087
    2    HA   ASN  50           HA       ASN  50 -24.739  11.642 -12.256
    3    HB2  ASN  50           HB2      ASN  50 -22.143  10.115 -12.357
    4    HB3  ASN  50           HB3      ASN  50 -23.151  10.491 -13.747
    5   HD21  ASN  50          HD21      ASN  50 -20.575  11.405 -12.075
    6   HD22  ASN  50          HD22      ASN  50 -20.341  13.031 -12.459

  No H/Q in entry =           6
  In of MODEL   63
    1    H    ALA  51           H        ALA  51 -24.786   9.354  -9.940
    2    HA   ALA  51           HA       ALA  51 -25.495   7.150 -11.725
    3    HB2  ALA  51           HB1      ALA  51 -24.961   5.856  -9.981
    4    HB3  ALA  51           HB2      ALA  51 -26.125   6.690  -8.950
    5    HB1  ALA  51           HB3      ALA  51 -24.483   7.316  -9.113

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ASP  52           H        ASP  52 -27.498   6.086 -11.620
    2    HA   ASP  52           HA       ASP  52 -29.711   7.924 -11.085
    3    HB2  ASP  52           HB2      ASP  52 -29.450   5.370 -12.670
    4    HB3  ASP  52           HB3      ASP  52 -31.013   6.105 -12.310

  No H/Q in entry =           4
  In of MODEL   63
    1    H    VAL  53           H        VAL  53 -28.130   5.077  -9.928
    2    HA   VAL  53           HA       VAL  53 -29.653   5.271  -7.466
    3    HB   VAL  53           HB       VAL  53 -31.001   3.583  -8.706
    4   HG11  VAL  53          HG11      VAL  53 -29.200   2.690 -10.142
    5   HG13  VAL  53          HG12      VAL  53 -30.054   1.415  -9.272
    6   HG12  VAL  53          HG13      VAL  53 -28.465   1.944  -8.724
    7   HG23  VAL  53          HG21      VAL  53 -30.226   1.664  -6.928
    8   HG22  VAL  53          HG22      VAL  53 -31.374   2.972  -6.639
    9   HG21  VAL  53          HG23      VAL  53 -29.682   3.167  -6.180

  No H/Q in entry =           9
  In of MODEL   63
    1    H    VAL  54           H        VAL  54 -28.395   4.897  -5.756
    2    HA   VAL  54           HA       VAL  54 -25.611   4.045  -6.250
    3    HB   VAL  54           HB       VAL  54 -26.765   5.885  -4.092
    4   HG11  VAL  54          HG11      VAL  54 -24.171   4.472  -4.253
    5   HG13  VAL  54          HG12      VAL  54 -24.975   5.190  -2.858
    6   HG12  VAL  54          HG13      VAL  54 -24.039   6.205  -3.955
    7   HG22  VAL  54          HG21      VAL  54 -25.878   7.670  -5.216
    8   HG21  VAL  54          HG22      VAL  54 -26.375   6.636  -6.556
    9   HG23  VAL  54          HG23      VAL  54 -24.684   6.684  -6.061

  No H/Q in entry =           9
  In of MODEL   63
    1    H    LEU  55           H        LEU  55 -25.033   2.148  -5.529
    2    HA   LEU  55           HA       LEU  55 -26.606   0.894  -3.366
    3    HB2  LEU  55           HB2      LEU  55 -24.968  -0.333  -5.572
    4    HB3  LEU  55           HB3      LEU  55 -25.767  -1.233  -4.281
    5    HG   LEU  55           HG       LEU  55 -27.140   0.282  -6.492
    6   HD13  LEU  55          HD11      LEU  55 -26.791  -1.605  -7.644
    7   HD12  LEU  55          HD12      LEU  55 -27.783  -2.448  -6.456
    8   HD11  LEU  55          HD13      LEU  55 -26.034  -2.369  -6.249
    9   HD23  LEU  55          HD21      LEU  55 -28.487  -1.614  -4.623
   10   HD22  LEU  55          HD22      LEU  55 -29.159  -0.262  -5.535
   11   HD21  LEU  55          HD23      LEU  55 -28.189   0.042  -4.095

  No H/Q in entry =          11
  In of MODEL   63
    1    H    LEU  56           H        LEU  56 -25.513   0.362  -1.506
    2    HA   LEU  56           HA       LEU  56 -22.581   0.771  -1.470
    3    HB2  LEU  56           HB2      LEU  56 -24.462   0.624   0.873
    4    HB3  LEU  56           HB3      LEU  56 -22.754   1.062   0.906
    5    HG   LEU  56           HG       LEU  56 -25.028   2.698  -0.186
    6   HD11  LEU  56          HD11      LEU  56 -23.996   2.399   2.382
    7   HD13  LEU  56          HD12      LEU  56 -24.975   3.746   1.802
    8   HD12  LEU  56          HD13      LEU  56 -23.216   3.857   1.769
    9   HD23  LEU  56          HD21      LEU  56 -23.084   4.400  -0.365
   10   HD22  LEU  56          HD22      LEU  56 -23.418   3.261  -1.671
   11   HD21  LEU  56          HD23      LEU  56 -22.100   2.949  -0.543

  No H/Q in entry =          11
  In of MODEL   63
    1    H    GLY  57           H        GLY  57 -21.212  -0.835  -0.841
    2    HA3  GLY  57           HA2      GLY  57 -22.117  -3.531  -0.986
    3    HA2  GLY  57           HA3      GLY  57 -20.513  -3.013  -0.469

  No H/Q in entry =           3
  In of MODEL   63
    1    HA   PRO  58           HA       PRO  58 -23.441  -3.953   3.176
    2    HB2  PRO  58           HB2      PRO  58 -22.766  -6.535   3.883
    3    HB3  PRO  58           HB3      PRO  58 -24.117  -6.164   2.813
    4    HG2  PRO  58           HG2      PRO  58 -21.362  -7.055   2.146
    5    HG3  PRO  58           HG3      PRO  58 -22.900  -7.543   1.437
    6    HD2  PRO  58           HD2      PRO  58 -21.259  -5.756   0.213
    7    HD3  PRO  58           HD3      PRO  58 -23.014  -5.681   0.050

  No H/Q in entry =           7
  In of MODEL   63
    1    H    GLN  59           H        GLN  59 -20.049  -4.427   2.696
    2    HA   GLN  59           HA       GLN  59 -19.387  -4.357   5.480
    3    HB2  GLN  59           HB2      GLN  59 -17.644  -3.425   3.200
    4    HB3  GLN  59           HB3      GLN  59 -17.129  -3.919   4.800
    5    HG2  GLN  59           HG2      GLN  59 -16.615  -5.782   3.574
    6    HG3  GLN  59           HG3      GLN  59 -18.230  -6.194   4.131
    7   HE21  GLN  59          HE21      GLN  59 -18.972  -7.178   2.617
    8   HE22  GLN  59          HE22      GLN  59 -19.278  -7.053   0.987

  No H/Q in entry =           8
  In of MODEL   63
    1    H    ILE  60           H        ILE  60 -20.256  -1.879   3.165
    2    HA   ILE  60           HA       ILE  60 -19.481   0.143   5.176
    3    HB   ILE  60           HB       ILE  60 -19.668   1.814   3.286
    4   HG12  ILE  60          HG12      ILE  60 -19.362  -0.471   1.387
    5   HG13  ILE  60          HG13      ILE  60 -20.978   0.054   1.859
    6   HG22  ILE  60          HG21      ILE  60 -17.600  -0.278   2.745
    7   HG21  ILE  60          HG22      ILE  60 -17.549   0.790   4.146
    8   HG23  ILE  60          HG23      ILE  60 -17.485   1.467   2.519
    9   HD11  ILE  60          HD11      ILE  60 -20.074   2.432   1.184
   10   HD13  ILE  60          HD12      ILE  60 -20.637   1.311  -0.055
   11   HD12  ILE  60          HD13      ILE  60 -18.909   1.497   0.246

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ALA  61           H        ALA  61 -21.931  -1.451   5.213
    2    HA   ALA  61           HA       ALA  61 -24.146   0.188   4.629
    3    HB1  ALA  61           HB1      ALA  61 -25.400  -1.267   5.958
    4    HB2  ALA  61           HB2      ALA  61 -24.035  -1.618   7.019
    5    HB3  ALA  61           HB3      ALA  61 -24.073  -2.276   5.383

  No H/Q in entry =           5
  In of MODEL   63
    1    H    TYR  62           H        TYR  62 -22.033   0.172   7.501
    2    HA   TYR  62           HA       TYR  62 -23.649   1.872   9.067
    3    HB2  TYR  62           HB2      TYR  62 -21.651   2.346  10.353
    4    HB3  TYR  62           HB3      TYR  62 -21.691   0.631   9.944
    5    HD1  TYR  62           HD1      TYR  62 -20.047  -0.329   8.391
    6    HD2  TYR  62           HD2      TYR  62 -19.920   3.819   9.410
    7    HE1  TYR  62           HE1      TYR  62 -17.802  -0.157   7.389
    8    HE2  TYR  62           HE2      TYR  62 -17.660   3.986   8.411
    9    HH   TYR  62           HH       TYR  62 -15.937   2.797   7.632

  No H/Q in entry =           9
  In of MODEL   63
    1    H    MET  63           H        MET  63 -21.916   2.651   6.243
    2    HA   MET  63           HA       MET  63 -21.781   5.503   6.854
    3    HB2  MET  63           HB2      MET  63 -21.083   3.905   4.390
    4    HB3  MET  63           HB3      MET  63 -20.906   5.656   4.520
    5    HG2  MET  63           HG2      MET  63 -19.247   5.380   6.261
    6    HG3  MET  63           HG3      MET  63 -19.448   3.631   6.196
    7    HE1  MET  63           HE1      MET  63 -18.890   6.726   4.424
    8    HE3  MET  63           HE2      MET  63 -18.824   6.185   2.748
    9    HE2  MET  63           HE3      MET  63 -17.330   6.492   3.633

  No H/Q in entry =           9
  In of MODEL   63
    1    H    LEU  64           H        LEU  64 -24.306   3.610   5.862
    2    HA   LEU  64           HA       LEU  64 -25.450   4.960   3.703
    3    HB2  LEU  64           HB2      LEU  64 -26.343   2.879   4.655
    4    HB3  LEU  64           HB3      LEU  64 -26.851   3.764   6.092
    5    HG   LEU  64           HG       LEU  64 -28.507   4.975   4.771
    6   HD13  LEU  64          HD11      LEU  64 -28.151   5.148   2.543
    7   HD12  LEU  64          HD12      LEU  64 -28.788   3.507   2.426
    8   HD11  LEU  64          HD13      LEU  64 -27.047   3.775   2.534
    9   HD23  LEU  64          HD21      LEU  64 -28.993   2.138   4.093
   10   HD22  LEU  64          HD22      LEU  64 -30.014   3.296   4.945
   11   HD21  LEU  64          HD23      LEU  64 -28.663   2.531   5.781

  No H/Q in entry =          11
  In of MODEL   63
    1    HA   PRO  65           HA       PRO  65 -27.729   8.188   6.282
    2    HB2  PRO  65           HB2      PRO  65 -25.804   8.422   8.596
    3    HB3  PRO  65           HB3      PRO  65 -27.545   8.698   8.575
    4    HG2  PRO  65           HG2      PRO  65 -26.640   6.476   9.601
    5    HG3  PRO  65           HG3      PRO  65 -28.025   6.407   8.511
    6    HD2  PRO  65           HD2      PRO  65 -25.130   5.780   7.922
    7    HD3  PRO  65           HD3      PRO  65 -26.569   4.876   7.455

  No H/Q in entry =           7
  In of MODEL   63
    1    H    GLU  66           H        GLU  66 -24.177   8.145   6.474
    2    HA   GLU  66           HA       GLU  66 -23.872  10.932   5.994
    3    HB2  GLU  66           HB2      GLU  66 -22.034   8.610   5.474
    4    HB3  GLU  66           HB3      GLU  66 -21.581  10.297   5.229
    5    HG2  GLU  66           HG2      GLU  66 -21.871  10.739   7.576
    6    HG3  GLU  66           HG3      GLU  66 -22.401   9.078   7.842

  No H/Q in entry =           6
  In of MODEL   63
    1    H    ILE  67           H        ILE  67 -23.894   8.119   3.825
    2    HA   ILE  67           HA       ILE  67 -23.405   9.757   1.495
    3    HB   ILE  67           HB       ILE  67 -24.305   6.854   1.734
    4   HG12  ILE  67          HG12      ILE  67 -21.648   8.002   0.863
    5   HG13  ILE  67          HG13      ILE  67 -21.998   7.633   2.552
    6   HG21  ILE  67          HG21      ILE  67 -24.177   8.664  -0.545
    7   HG23  ILE  67          HG22      ILE  67 -24.801   7.017  -0.463
    8   HG22  ILE  67          HG23      ILE  67 -23.083   7.295  -0.744
    9   HD12  ILE  67          HD11      ILE  67 -21.499   5.792   0.272
   10   HD11  ILE  67          HD12      ILE  67 -22.554   5.257   1.578
   11   HD13  ILE  67          HD13      ILE  67 -20.894   5.734   1.927

  No H/Q in entry =          11
  In of MODEL   63
    1    H    GLN  68           H        GLN  68 -26.326   8.748   3.065
    2    HA   GLN  68           HA       GLN  68 -28.090   9.615   1.005
    3    HB2  GLN  68           HB2      GLN  68 -28.444   9.348   3.987
    4    HB3  GLN  68           HB3      GLN  68 -29.730   9.910   2.933
    5    HG2  GLN  68           HG2      GLN  68 -29.715   7.842   1.719
    6    HG3  GLN  68           HG3      GLN  68 -28.293   7.293   2.587
    7   HE21  GLN  68          HE21      GLN  68 -30.466   5.928   2.421
    8   HE22  GLN  68          HE22      GLN  68 -31.341   5.514   3.821

  No H/Q in entry =           8
  In of MODEL   63
    1    H    ARG  69           H        ARG  69 -26.575  11.365   3.741
    2    HA   ARG  69           HA       ARG  69 -27.925  13.834   3.216
    3    HB2  ARG  69           HB2      ARG  69 -25.634  12.953   4.907
    4    HB3  ARG  69           HB3      ARG  69 -25.700  14.661   4.495
    5    HG2  ARG  69           HG2      ARG  69 -28.048  14.733   5.388
    6    HG3  ARG  69           HG3      ARG  69 -27.856  13.058   5.920
    7    HD2  ARG  69           HD2      ARG  69 -26.192  15.440   6.817
    8    HD3  ARG  69           HD3      ARG  69 -27.354  14.565   7.800
    9    HE   ARG  69           HE       ARG  69 -24.713  13.606   6.966
   10   HH21  ARG  69          HH11      ARG  69 -23.946  11.880   8.240
   11   HH22  ARG  69          HH12      ARG  69 -25.011  11.098   9.358
   12   HH11  ARG  69          HH21      ARG  69 -27.724  13.109   8.581
   13   HH12  ARG  69          HH22      ARG  69 -27.150  11.792   9.550

  No H/Q in entry =          13
  In of MODEL   63
    1    H    LEU  70           H        LEU  70 -25.012  12.387   1.993
    2    HA   LEU  70           HA       LEU  70 -23.859  14.715   0.791
    3    HB2  LEU  70           HB2      LEU  70 -22.887  12.416   1.489
    4    HB3  LEU  70           HB3      LEU  70 -23.450  11.903  -0.101
    5    HG   LEU  70           HG       LEU  70 -21.820  13.242  -1.176
    6   HD11  LEU  70          HD11      LEU  70 -21.088  14.169   1.611
    7   HD13  LEU  70          HD12      LEU  70 -21.741  15.165   0.310
    8   HD12  LEU  70          HD13      LEU  70 -20.124  14.477   0.164
    9   HD22  LEU  70          HD21      LEU  70 -20.398  11.532  -0.844
   10   HD21  LEU  70          HD22      LEU  70 -21.370  11.053   0.547
   11   HD23  LEU  70          HD23      LEU  70 -19.992  12.130   0.763

  No H/Q in entry =          11
  In of MODEL   63
    1    H    LEU  71           H        LEU  71 -25.978  12.141  -0.317
    2    HA   LEU  71           HA       LEU  71 -26.419  13.552  -2.892
    3    HB2  LEU  71           HB2      LEU  71 -26.645  10.583  -2.363
    4    HB3  LEU  71           HB3      LEU  71 -26.722  11.396  -3.926
    5    HG   LEU  71           HG       LEU  71 -24.257  11.456  -2.183
    6   HD12  LEU  71          HD11      LEU  71 -24.234   9.756  -4.566
    7   HD11  LEU  71          HD12      LEU  71 -25.289   9.173  -3.278
    8   HD13  LEU  71          HD13      LEU  71 -23.578   9.459  -2.956
    9   HD22  LEU  71          HD21      LEU  71 -24.307  13.227  -3.734
   10   HD21  LEU  71          HD22      LEU  71 -24.763  12.145  -5.050
   11   HD23  LEU  71          HD23      LEU  71 -23.165  12.017  -4.315

  No H/Q in entry =          11
  In of MODEL   63
    1    HA   PRO  72           HA       PRO  72 -30.369  13.191  -0.386
    2    HB2  PRO  72           HB2      PRO  72 -31.215  15.749  -0.573
    3    HB3  PRO  72           HB3      PRO  72 -29.943  15.327   0.574
    4    HG2  PRO  72           HG2      PRO  72 -29.664  16.438  -2.207
    5    HG3  PRO  72           HG3      PRO  72 -28.944  17.032  -0.711
    6    HD2  PRO  72           HD2      PRO  72 -27.556  15.418  -2.384
    7    HD3  PRO  72           HD3      PRO  72 -27.358  15.303  -0.637

  No H/Q in entry =           7
  In of MODEL   63
    1    H    ASN  73           H        ASN  73 -29.638  14.046  -3.606
    2    HA   ASN  73           HA       ASN  73 -32.477  13.726  -4.322
    3    HB2  ASN  73           HB2      ASN  73 -31.939  14.768  -6.435
    4    HB3  ASN  73           HB3      ASN  73 -31.457  15.787  -5.088
    5   HD21  ASN  73          HD21      ASN  73 -30.575  15.748  -7.738
    6   HD22  ASN  73          HD22      ASN  73 -28.903  15.576  -7.871

  No H/Q in entry =           6
  In of MODEL   63
    1    H    LYS  74           H        LYS  74 -30.521  11.478  -3.764
    2    HA   LYS  74           HA       LYS  74 -31.012  10.009  -6.287
    3    HB2  LYS  74           HB2      LYS  74 -28.535   9.757  -4.575
    4    HB3  LYS  74           HB3      LYS  74 -28.873   8.901  -6.080
    5    HG2  LYS  74           HG2      LYS  74 -28.600  11.874  -5.959
    6    HG3  LYS  74           HG3      LYS  74 -27.223  10.797  -6.186
    7    HD2  LYS  74           HD2      LYS  74 -28.281   9.815  -8.136
    8    HD3  LYS  74           HD3      LYS  74 -29.704  10.827  -7.893
    9    HE2  LYS  74           HE2      LYS  74 -28.455  12.815  -8.355
   10    HE3  LYS  74           HE3      LYS  74 -26.937  11.916  -8.370
   11    HZ2  LYS  74           HZ1      LYS  74 -28.335  12.460 -10.560
   12    HZ1  LYS  74           HZ2      LYS  74 -29.009  10.952 -10.162
   13    HZ3  LYS  74           HZ3      LYS  74 -27.334  11.096 -10.410

  No H/Q in entry =          13
  In of MODEL   63
    1    HA   PRO  75           HA       PRO  75 -32.518   7.122  -3.274
    2    HB2  PRO  75           HB2      PRO  75 -32.789   4.858  -4.798
    3    HB3  PRO  75           HB3      PRO  75 -33.905   6.215  -4.945
    4    HG2  PRO  75           HG2      PRO  75 -31.514   5.553  -6.619
    5    HG3  PRO  75           HG3      PRO  75 -33.144   5.984  -7.134
    6    HD2  PRO  75           HD2      PRO  75 -31.195   7.841  -7.083
    7    HD3  PRO  75           HD3      PRO  75 -32.841   8.264  -6.611

  No H/Q in entry =           7
  In of MODEL   63
    1    H    VAL  76           H        VAL  76 -31.117   6.102  -1.823
    2    HA   VAL  76           HA       VAL  76 -28.624   4.848  -2.812
    3    HB   VAL  76           HB       VAL  76 -28.990   6.396  -0.211
    4   HG11  VAL  76          HG11      VAL  76 -26.598   5.055  -1.485
    5   HG13  VAL  76          HG12      VAL  76 -27.347   4.656   0.062
    6   HG12  VAL  76          HG13      VAL  76 -26.487   6.183  -0.132
    7   HG22  VAL  76          HG21      VAL  76 -28.282   8.265  -1.132
    8   HG21  VAL  76          HG22      VAL  76 -28.779   7.526  -2.655
    9   HG23  VAL  76          HG23      VAL  76 -27.094   7.444  -2.143

  No H/Q in entry =           9
  In of MODEL   63
    1    H    GLU  77           H        GLU  77 -28.440   2.712  -2.127
    2    HA   GLU  77           HA       GLU  77 -29.318   2.010   0.523
    3    HB2  GLU  77           HB2      GLU  77 -30.915   0.355  -0.011
    4    HB3  GLU  77           HB3      GLU  77 -31.433   1.859  -0.775
    5    HG2  GLU  77           HG2      GLU  77 -30.757   1.031  -2.918
    6    HG3  GLU  77           HG3      GLU  77 -30.146  -0.448  -2.179

  No H/Q in entry =           6
  In of MODEL   63
    1    H    VAL  78           H        VAL  78 -29.024  -0.057   1.256
    2    HA   VAL  78           HA       VAL  78 -26.334  -0.868   0.480
    3    HB   VAL  78           HB       VAL  78 -28.123  -1.671   2.813
    4   HG11  VAL  78          HG11      VAL  78 -25.756  -2.944   1.805
    5   HG13  VAL  78          HG12      VAL  78 -26.713  -3.366   3.225
    6   HG12  VAL  78          HG13      VAL  78 -25.392  -2.207   3.364
    7   HG22  VAL  78          HG21      VAL  78 -26.702  -0.274   4.157
    8   HG21  VAL  78          HG22      VAL  78 -27.391   0.659   2.829
    9   HG23  VAL  78          HG23      VAL  78 -25.713   0.120   2.752

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ILE  79           H        ILE  79 -25.778  -2.804  -0.348
    2    HA   ILE  79           HA       ILE  79 -27.801  -4.314  -1.718
    3    HB   ILE  79           HB       ILE  79 -24.822  -4.847  -1.382
    4   HG12  ILE  79          HG12      ILE  79 -26.378  -3.807  -3.756
    5   HG13  ILE  79          HG13      ILE  79 -25.535  -2.766  -2.606
    6   HG22  ILE  79          HG21      ILE  79 -25.854  -6.093  -3.699
    7   HG21  ILE  79          HG22      ILE  79 -26.886  -6.568  -2.349
    8   HG23  ILE  79          HG23      ILE  79 -25.148  -6.854  -2.274
    9   HD13  ILE  79          HD11      ILE  79 -24.063  -2.941  -4.373
   10   HD12  ILE  79          HD12      ILE  79 -24.403  -4.656  -4.612
   11   HD11  ILE  79          HD13      ILE  79 -23.462  -4.130  -3.215

  No H/Q in entry =          11
  In of MODEL   63
    1    H    ASP  80           H        ASP  80 -28.695  -6.215  -1.104
    2    HA   ASP  80           HA       ASP  80 -28.734  -7.033   1.569
    3    HB2  ASP  80           HB2      ASP  80 -30.436  -7.652  -0.109
    4    HB3  ASP  80           HB3      ASP  80 -29.256  -8.691  -0.909

  No H/Q in entry =           4
  In of MODEL   63
    1    H    SER  81           H        SER  81 -27.242  -8.140   2.783
    2    HA   SER  81           HA       SER  81 -24.711  -8.869   1.696
    3    HB2  SER  81           HB2      SER  81 -24.172  -9.724   3.893
    4    HB3  SER  81           HB3      SER  81 -25.060  -8.214   4.086
    5    HG   SER  81           HG       SER  81 -25.869  -9.730   5.489

  No H/Q in entry =           5
  In of MODEL   63
    1    H    LEU  82           H        LEU  82 -27.443 -10.937   1.992
    2    HA   LEU  82           HA       LEU  82 -25.891 -13.327   1.596
    3    HB2  LEU  82           HB2      LEU  82 -28.808 -12.850   1.029
    4    HB3  LEU  82           HB3      LEU  82 -28.012 -14.401   1.293
    5    HG   LEU  82           HG       LEU  82 -28.432 -12.271   3.368
    6   HD11  LEU  82          HD11      LEU  82 -30.455 -13.587   2.510
    7   HD13  LEU  82          HD12      LEU  82 -30.137 -13.672   4.245
    8   HD12  LEU  82          HD13      LEU  82 -29.677 -15.014   3.197
    9   HD22  LEU  82          HD21      LEU  82 -26.434 -13.431   3.870
   10   HD21  LEU  82          HD22      LEU  82 -27.103 -14.972   3.332
   11   HD23  LEU  82          HD23      LEU  82 -27.680 -14.236   4.828

  No H/Q in entry =          11
  In of MODEL   63
    1    H    LEU  83           H        LEU  83 -27.774 -11.154  -0.454
    2    HA   LEU  83           HA       LEU  83 -27.498 -12.589  -2.874
    3    HB2  LEU  83           HB2      LEU  83 -27.914  -9.662  -2.330
    4    HB3  LEU  83           HB3      LEU  83 -27.895 -10.357  -3.950
    5    HG   LEU  83           HG       LEU  83 -30.002 -10.667  -1.831
    6   HD13  LEU  83          HD11      LEU  83 -30.713  -8.850  -2.977
    7   HD12  LEU  83          HD12      LEU  83 -31.138 -10.000  -4.241
    8   HD11  LEU  83          HD13      LEU  83 -29.598  -9.145  -4.310
    9   HD23  LEU  83          HD21      LEU  83 -30.058 -12.008  -4.519
   10   HD22  LEU  83          HD22      LEU  83 -31.075 -12.309  -3.111
   11   HD21  LEU  83          HD23      LEU  83 -29.389 -12.822  -3.104

  No H/Q in entry =          11
  In of MODEL   63
    1    H    TYR  84           H        TYR  84 -25.588 -10.162  -1.208
    2    HA   TYR  84           HA       TYR  84 -23.654  -9.749  -3.291
    3    HB2  TYR  84           HB2      TYR  84 -24.256  -8.234  -1.280
    4    HB3  TYR  84           HB3      TYR  84 -23.181  -9.282  -0.358
    5    HD1  TYR  84           HD1      TYR  84 -20.860  -8.930  -0.377
    6    HD2  TYR  84           HD2      TYR  84 -23.290  -7.039  -3.335
    7    HE1  TYR  84           HE1      TYR  84 -18.897  -7.641  -1.148
    8    HE2  TYR  84           HE2      TYR  84 -21.335  -5.751  -4.122
    9    HH   TYR  84           HH       TYR  84 -18.793  -5.143  -2.511

  No H/Q in entry =           9
  In of MODEL   63
    1    H    GLY  85           H        GLY  85 -23.522 -11.660  -0.278
    2    HA3  GLY  85           HA2      GLY  85 -20.936 -12.630  -0.645
    3    HA2  GLY  85           HA3      GLY  85 -22.201 -13.441   0.277

  No H/Q in entry =           3
  In of MODEL   63
    1    H    LYS  86           H        LYS  86 -23.981 -13.869  -1.830
    2    HA   LYS  86           HA       LYS  86 -22.900 -16.287  -2.980
    3    HB2  LYS  86           HB2      LYS  86 -25.185 -16.063  -2.087
    4    HB3  LYS  86           HB3      LYS  86 -25.536 -14.853  -3.320
    5    HG2  LYS  86           HG2      LYS  86 -25.313 -16.537  -5.041
    6    HG3  LYS  86           HG3      LYS  86 -24.952 -17.749  -3.810
    7    HD2  LYS  86           HD2      LYS  86 -27.110 -17.284  -2.727
    8    HD3  LYS  86           HD3      LYS  86 -27.470 -16.081  -3.964
    9    HE2  LYS  86           HE2      LYS  86 -28.600 -18.168  -4.473
   10    HE3  LYS  86           HE3      LYS  86 -27.356 -17.845  -5.679
   11    HZ3  LYS  86           HZ1      LYS  86 -26.191 -19.631  -5.062
   12    HZ2  LYS  86           HZ2      LYS  86 -27.610 -20.145  -4.280
   13    HZ1  LYS  86           HZ3      LYS  86 -26.405 -19.330  -3.404

  No H/Q in entry =          13
  In of MODEL   63
    1    H    VAL  87           H        VAL  87 -22.842 -13.101  -3.972
    2    HA   VAL  87           HA       VAL  87 -22.473 -11.991  -5.939
    3    HB   VAL  87           HB       VAL  87 -21.387 -14.523  -7.191
    4   HG12  VAL  87          HG11      VAL  87 -20.150 -11.776  -7.148
    5   HG11  VAL  87          HG12      VAL  87 -21.471 -12.148  -8.256
    6   HG13  VAL  87          HG13      VAL  87 -19.960 -13.051  -8.349
    7   HG21  VAL  87          HG21      VAL  87 -20.565 -14.552  -4.881
    8   HG23  VAL  87          HG22      VAL  87 -19.940 -12.918  -5.092
    9   HG22  VAL  87          HG23      VAL  87 -19.272 -14.246  -6.039

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ASP  88           H        ASP  88 -25.002 -12.611  -5.649
    2    HA   ASP  88           HA       ASP  88 -26.053 -13.897  -8.043
    3    HB2  ASP  88           HB2      ASP  88 -27.123 -14.065  -5.746
    4    HB3  ASP  88           HB3      ASP  88 -27.564 -12.366  -5.914

  No H/Q in entry =           4
  In of MODEL   63
    1    H    GLY  89           H        GLY  89 -25.288 -12.695  -9.699
    2    HA3  GLY  89           HA2      GLY  89 -25.449  -9.929  -9.993
    3    HA2  GLY  89           HA3      GLY  89 -25.386 -11.093 -11.316

  No H/Q in entry =           3
  In of MODEL   63
    1    H    LEU  90           H        LEU  90 -27.853 -12.420 -10.905
    2    HA   LEU  90           HA       LEU  90 -29.618 -10.514 -12.137
    3    HB2  LEU  90           HB2      LEU  90 -29.676 -12.927 -12.643
    4    HB3  LEU  90           HB3      LEU  90 -30.235 -13.239 -11.000
    5    HG   LEU  90           HG       LEU  90 -32.336 -12.126 -11.467
    6   HD13  LEU  90          HD11      LEU  90 -32.101 -10.433 -12.990
    7   HD12  LEU  90          HD12      LEU  90 -32.609 -11.703 -14.105
    8   HD11  LEU  90          HD13      LEU  90 -30.898 -11.312 -13.937
    9   HD23  LEU  90          HD21      LEU  90 -32.197 -13.832 -13.847
   10   HD22  LEU  90          HD22      LEU  90 -33.223 -13.947 -12.417
   11   HD21  LEU  90          HD23      LEU  90 -31.573 -14.566 -12.369

  No H/Q in entry =          11
  In of MODEL   63
    1    H    GLY  91           H        GLY  91 -29.558 -11.914  -8.903
    2    HA3  GLY  91           HA2      GLY  91 -31.924 -10.760  -7.975
    3    HA2  GLY  91           HA3      GLY  91 -30.566 -11.268  -6.972

  No H/Q in entry =           3
  In of MODEL   63
    1    H    VAL  92           H        VAL  92 -28.612  -9.477  -7.824
    2    HA   VAL  92           HA       VAL  92 -29.442  -7.125  -6.375
    3    HB   VAL  92           HB       VAL  92 -26.848  -7.654  -7.871
    4   HG12  VAL  92          HG11      VAL  92 -27.079  -5.696  -5.612
    5   HG11  VAL  92          HG12      VAL  92 -27.692  -5.198  -7.191
    6   HG13  VAL  92          HG13      VAL  92 -26.003  -5.669  -7.010
    7   HG22  VAL  92          HG21      VAL  92 -26.684  -9.191  -6.223
    8   HG21  VAL  92          HG22      VAL  92 -27.859  -8.373  -5.193
    9   HG23  VAL  92          HG23      VAL  92 -26.200  -7.782  -5.280

  No H/Q in entry =           9
  In of MODEL   63
    1    H    LEU  93           H        LEU  93 -28.929  -7.896  -9.757
    2    HA   LEU  93           HA       LEU  93 -29.232  -5.290 -10.780
    3    HB2  LEU  93           HB2      LEU  93 -28.553  -7.193 -12.161
    4    HB3  LEU  93           HB3      LEU  93 -30.154  -7.907 -11.966
    5    HG   LEU  93           HG       LEU  93 -31.120  -5.978 -13.184
    6   HD11  LEU  93          HD11      LEU  93 -29.278  -4.373 -12.672
    7   HD13  LEU  93          HD12      LEU  93 -29.663  -4.456 -14.391
    8   HD12  LEU  93          HD13      LEU  93 -28.235  -5.278 -13.768
    9   HD23  LEU  93          HD21      LEU  93 -30.011  -6.621 -15.418
   10   HD22  LEU  93          HD22      LEU  93 -30.888  -7.845 -14.500
   11   HD21  LEU  93          HD23      LEU  93 -29.123  -7.796 -14.447

  No H/Q in entry =          11
  In of MODEL   63
    1    H    LYS  94           H        LYS  94 -31.645  -7.800  -9.927
    2    HA   LYS  94           HA       LYS  94 -33.961  -6.371 -10.672
    3    HB2  LYS  94           HB2      LYS  94 -33.522  -8.492  -8.577
    4    HB3  LYS  94           HB3      LYS  94 -35.107  -7.800  -8.917
    5    HG2  LYS  94           HG2      LYS  94 -34.950  -8.649 -11.222
    6    HG3  LYS  94           HG3      LYS  94 -33.404  -9.396 -10.820
    7    HD2  LYS  94           HD2      LYS  94 -34.587 -10.667  -8.991
    8    HD3  LYS  94           HD3      LYS  94 -36.109 -10.032  -9.615
    9    HE2  LYS  94           HE2      LYS  94 -35.527 -11.034 -11.833
   10    HE3  LYS  94           HE3      LYS  94 -34.139 -11.800 -11.061
   11    HZ3  LYS  94           HZ1      LYS  94 -35.988 -13.319 -11.242
   12    HZ2  LYS  94           HZ2      LYS  94 -36.987 -12.261 -10.365
   13    HZ1  LYS  94           HZ3      LYS  94 -35.653 -12.991  -9.611

  No H/Q in entry =          13
  In of MODEL   63
    1    H    ALA  95           H        ALA  95 -32.237  -6.401  -7.564
    2    HA   ALA  95           HA       ALA  95 -34.124  -4.768  -6.195
    3    HB2  ALA  95           HB1      ALA  95 -31.774  -6.134  -5.540
    4    HB3  ALA  95           HB2      ALA  95 -32.785  -5.189  -4.447
    5    HB1  ALA  95           HB3      ALA  95 -31.408  -4.433  -5.250

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ALA  96           H        ALA  96 -31.414  -3.990  -8.232
    2    HA   ALA  96           HA       ALA  96 -31.329  -1.206  -7.543
    3    HB2  ALA  96           HB1      ALA  96 -29.900  -1.052  -9.615
    4    HB3  ALA  96           HB2      ALA  96 -30.202  -2.768  -9.890
    5    HB1  ALA  96           HB3      ALA  96 -29.330  -2.247  -8.448

  No H/Q in entry =           5
  In of MODEL   63
    1    H    VAL  97           H        VAL  97 -32.783  -2.999 -10.222
    2    HA   VAL  97           HA       VAL  97 -33.801  -0.736 -11.583
    3    HB   VAL  97           HB       VAL  97 -34.624  -3.657 -11.559
    4   HG11  VAL  97          HG11      VAL  97 -36.389  -1.660 -12.165
    5   HG13  VAL  97          HG12      VAL  97 -36.433  -3.275 -12.873
    6   HG12  VAL  97          HG13      VAL  97 -35.646  -1.956 -13.737
    7   HG21  VAL  97          HG21      VAL  97 -33.271  -1.900 -13.609
    8   HG23  VAL  97          HG22      VAL  97 -33.724  -3.587 -13.860
    9   HG22  VAL  97          HG23      VAL  97 -32.511  -3.169 -12.648

  No H/Q in entry =           9
  In of MODEL   63
    1    H    ALA  98           H        ALA  98 -35.076  -2.828  -9.018
    2    HA   ALA  98           HA       ALA  98 -37.640  -1.656  -8.786
    3    HB1  ALA  98           HB1      ALA  98 -36.672  -3.826  -7.653
    4    HB3  ALA  98           HB2      ALA  98 -37.876  -2.868  -6.789
    5    HB2  ALA  98           HB3      ALA  98 -36.167  -2.717  -6.380

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ALA  99           H        ALA  99 -34.610  -0.822  -7.066
    2    HA   ALA  99           HA       ALA  99 -35.778   1.218  -5.504
    3    HB1  ALA  99           HB1      ALA  99 -33.113   0.292  -6.139
    4    HB2  ALA  99           HB2      ALA  99 -33.705   1.091  -4.683
    5    HB3  ALA  99           HB3      ALA  99 -33.180   2.052  -6.064

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ILE 100           H        ILE 100 -34.631   1.239  -8.827
    2    HA   ILE 100           HA       ILE 100 -34.783   4.080  -9.139
    3    HB   ILE 100           HB       ILE 100 -34.825   1.860 -11.213
    4   HG12  ILE 100          HG12      ILE 100 -32.669   3.859 -10.535
    5   HG13  ILE 100          HG13      ILE 100 -32.738   2.233  -9.856
    6   HG21  ILE 100          HG21      ILE 100 -35.223   4.778 -11.446
    7   HG23  ILE 100          HG22      ILE 100 -35.702   3.479 -12.539
    8   HG22  ILE 100          HG23      ILE 100 -34.044   4.082 -12.560
    9   HD12  ILE 100          HD11      ILE 100 -32.111   3.101 -12.640
   10   HD11  ILE 100          HD12      ILE 100 -32.791   1.498 -12.357
   11   HD13  ILE 100          HD13      ILE 100 -31.265   1.954 -11.602

  No H/Q in entry =          11
  In of MODEL   63
    1    H    LYS 101           H        LYS 101 -37.071   1.464  -9.858
    2    HA   LYS 101           HA       LYS 101 -39.107   3.095 -10.973
    3    HB2  LYS 101           HB2      LYS 101 -39.048   0.356  -9.759
    4    HB3  LYS 101           HB3      LYS 101 -40.582   1.117 -10.177
    5    HG2  LYS 101           HG2      LYS 101 -40.034   1.177 -12.461
    6    HG3  LYS 101           HG3      LYS 101 -38.351   0.770 -12.140
    7    HD2  LYS 101           HD2      LYS 101 -39.586  -1.157 -13.007
    8    HD3  LYS 101           HD3      LYS 101 -39.013  -1.442 -11.364
    9    HE2  LYS 101           HE2      LYS 101 -41.095  -2.107 -10.902
   10    HE3  LYS 101           HE3      LYS 101 -41.540  -0.401 -10.971
   11    HZ3  LYS 101           HZ1      LYS 101 -42.365  -0.617 -13.110
   12    HZ2  LYS 101           HZ2      LYS 101 -42.858  -2.065 -12.374
   13    HZ1  LYS 101           HZ3      LYS 101 -41.519  -2.058 -13.416

  No H/Q in entry =          13
  In of MODEL   63
    1    H    LYS 102           H        LYS 102 -38.728   1.713  -7.707
    2    HA   LYS 102           HA       LYS 102 -41.004   2.959  -6.619
    3    HB2  LYS 102           HB2      LYS 102 -39.814   1.116  -5.509
    4    HB3  LYS 102           HB3      LYS 102 -38.424   2.170  -5.253
    5    HG2  LYS 102           HG2      LYS 102 -39.778   3.617  -3.842
    6    HG3  LYS 102           HG3      LYS 102 -41.171   2.568  -4.100
    7    HD2  LYS 102           HD2      LYS 102 -39.992   0.726  -2.979
    8    HD3  LYS 102           HD3      LYS 102 -38.599   1.778  -2.719
    9    HE2  LYS 102           HE2      LYS 102 -39.986   3.306  -1.399
   10    HE3  LYS 102           HE3      LYS 102 -41.395   2.286  -1.682
   11    HZ1  LYS 102           HZ1      LYS 102 -39.722   0.552  -0.572
   12    HZ3  LYS 102           HZ2      LYS 102 -40.855   1.471   0.296
   13    HZ2  LYS 102           HZ3      LYS 102 -39.237   1.981   0.204

  No H/Q in entry =          13
  In of MODEL   63
    1    H    ALA 103           H        ALA 103 -38.008   4.300  -7.577
    2    HA   ALA 103           HA       ALA 103 -38.271   6.669  -5.874
    3    HB2  ALA 103           HB1      ALA 103 -36.225   7.342  -7.406
    4    HB3  ALA 103           HB2      ALA 103 -36.189   5.613  -7.751
    5    HB1  ALA 103           HB3      ALA 103 -36.012   6.185  -6.093

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ALA 104           H        ALA 104 -38.790   5.841  -9.215
    2    HA   ALA 104           HA       ALA 104 -39.335   8.609  -9.939
    3    HB2  ALA 104           HB1      ALA 104 -39.312   7.876 -12.121
    4    HB1  ALA 104           HB2      ALA 104 -40.063   6.331 -11.719
    5    HB3  ALA 104           HB3      ALA 104 -38.348   6.591 -11.393

  No H/Q in entry =           5
  In of MODEL   63
    1    H    ALA 105           H        ALA 105 -41.016   6.571  -8.125
    2    HA   ALA 105           HA       ALA 105 -43.429   7.980  -8.218
    3    HB2  ALA 105           HB1      ALA 105 -44.114   7.063 -10.253
    4    HB3  ALA 105           HB2      ALA 105 -44.796   5.914  -9.103
    5    HB1  ALA 105           HB3      ALA 105 -43.300   5.529  -9.953

  No H/Q in entry =           5
  In of MODEL   64
    1    H1   ALA   1           H3       ALA   1 -12.043 -16.178  -2.465
    2    H2   ALA   1           H2       ALA   1 -11.076 -17.309  -3.292
    3    H3   ALA   1           H1       ALA   1 -12.230 -16.388  -4.139
    4    HA   ALA   1           HA       ALA   1 -13.601 -18.111  -3.899
    5    HB3  ALA   1           HB1      ALA   1 -12.179 -19.856  -3.417
    6    HB1  ALA   1           HB2      ALA   1 -12.949 -19.747  -1.834
    7    HB2  ALA   1           HB3      ALA   1 -11.384 -18.982  -2.108

  No H/Q in entry =           7
  In of MODEL   64
    1    H    GLU   2           H        GLU   2 -15.222 -18.983  -2.251
    2    HA   GLU   2           HA       GLU   2 -16.906 -17.285  -1.214
    3    HB2  GLU   2           HB2      GLU   2 -15.937 -19.685   0.351
    4    HB3  GLU   2           HB3      GLU   2 -17.477 -18.859   0.590
    5    HG2  GLU   2           HG2      GLU   2 -18.426 -19.972  -1.145
    6    HG3  GLU   2           HG3      GLU   2 -17.102 -19.555  -2.223

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLU   3           H        GLU   3 -14.990 -18.590   1.430
    2    HA   GLU   3           HA       GLU   3 -15.262 -16.232   2.972
    3    HB2  GLU   3           HB2      GLU   3 -13.636 -18.750   3.249
    4    HB3  GLU   3           HB3      GLU   3 -13.435 -17.421   4.390
    5    HG2  GLU   3           HG2      GLU   3 -15.631 -17.604   5.193
    6    HG3  GLU   3           HG3      GLU   3 -16.202 -18.422   3.745

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LEU   4           H        LEU   4 -12.273 -17.669   1.611
    2    HA   LEU   4           HA       LEU   4 -10.475 -15.732   2.211
    3    HB2  LEU   4           HB2      LEU   4 -10.664 -17.049  -0.508
    4    HB3  LEU   4           HB3      LEU   4  -9.230 -16.300   0.183
    5    HG   LEU   4           HG       LEU   4 -10.691 -18.715   1.299
    6   HD13  LEU   4          HD11      LEU   4  -9.030 -20.049   0.389
    7   HD12  LEU   4          HD12      LEU   4  -7.842 -18.746   0.364
    8   HD11  LEU   4          HD13      LEU   4  -9.121 -18.797  -0.848
    9   HD23  LEU   4          HD21      LEU   4  -8.449 -18.733   2.697
   10   HD22  LEU   4          HD22      LEU   4  -9.791 -17.713   3.211
   11   HD21  LEU   4          HD23      LEU   4  -8.434 -17.007   2.334

  No H/Q in entry =          11
  In of MODEL   64
    1    H    GLU   5           H        GLU   5 -12.794 -15.579  -0.481
    2    HA   GLU   5           HA       GLU   5 -11.825 -13.085  -1.489
    3    HB2  GLU   5           HB2      GLU   5 -13.130 -14.694  -2.857
    4    HB3  GLU   5           HB3      GLU   5 -14.543 -14.365  -1.854
    5    HG2  GLU   5           HG2      GLU   5 -14.477 -11.998  -2.498
    6    HG3  GLU   5           HG3      GLU   5 -13.032 -12.290  -3.465

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLU   6           H        GLU   6 -14.550 -13.997   0.589
    2    HA   GLU   6           HA       GLU   6 -15.501 -11.333   0.966
    3    HB2  GLU   6           HB2      GLU   6 -16.900 -13.342   1.366
    4    HB3  GLU   6           HB3      GLU   6 -15.869 -13.769   2.730
    5    HG2  GLU   6           HG2      GLU   6 -16.438 -11.665   3.851
    6    HG3  GLU   6           HG3      GLU   6 -17.426 -11.180   2.475

  No H/Q in entry =           6
  In of MODEL   64
    1    H    VAL   7           H        VAL   7 -13.171 -13.396   2.566
    2    HA   VAL   7           HA       VAL   7 -12.748 -11.800   4.888
    3    HB   VAL   7           HB       VAL   7 -11.000 -13.824   3.462
    4   HG11  VAL   7          HG11      VAL   7 -10.576 -12.268   6.021
    5   HG13  VAL   7          HG12      VAL   7  -9.463 -12.472   4.669
    6   HG12  VAL   7          HG13      VAL   7  -9.801 -13.829   5.745
    7   HG21  VAL   7          HG21      VAL   7 -13.250 -14.418   4.669
    8   HG23  VAL   7          HG22      VAL   7 -12.339 -14.120   6.150
    9   HG22  VAL   7          HG23      VAL   7 -11.816 -15.378   5.031

  No H/Q in entry =           9
  In of MODEL   64
    1    H    VAL   8           H        VAL   8 -11.211 -11.908   1.689
    2    HA   VAL   8           HA       VAL   8  -9.183  -9.999   2.186
    3    HB   VAL   8           HB       VAL   8 -10.616 -10.722  -0.381
    4   HG12  VAL   8          HG11      VAL   8  -8.341  -9.714  -1.284
    5   HG11  VAL   8          HG12      VAL   8  -8.383  -8.813   0.233
    6   HG13  VAL   8          HG13      VAL   8  -9.705  -8.654  -0.924
    7   HG22  VAL   8          HG21      VAL   8  -9.068 -12.417  -0.616
    8   HG21  VAL   8          HG22      VAL   8  -8.927 -12.271   1.133
    9   HG23  VAL   8          HG23      VAL   8  -7.767 -11.456   0.090

  No H/Q in entry =           9
  In of MODEL   64
    1    H    MET   9           H        MET   9 -12.526  -9.671   0.999
    2    HA   MET   9           HA       MET   9 -12.506  -6.896   0.549
    3    HB2  MET   9           HB2      MET   9 -14.672  -8.840   1.320
    4    HB3  MET   9           HB3      MET   9 -15.012  -7.111   1.204
    5    HG2  MET   9           HG2      MET   9 -13.778  -7.344  -1.122
    6    HG3  MET   9           HG3      MET   9 -14.237  -9.039  -0.957
    7    HE1  MET   9           HE1      MET   9 -16.522  -9.457   0.336
    8    HE3  MET   9           HE2      MET   9 -18.042  -8.724  -0.169
    9    HE2  MET   9           HE3      MET   9 -17.044  -7.921   1.041

  No H/Q in entry =           9
  In of MODEL   64
    1    H    GLY  10           H        GLY  10 -13.159  -8.781   3.482
    2    HA3  GLY  10           HA2      GLY  10 -13.756  -6.596   5.184
    3    HA2  GLY  10           HA3      GLY  10 -13.169  -8.172   5.712

  No H/Q in entry =           3
  In of MODEL   64
    1    H    LEU  11           H        LEU  11 -10.712  -8.263   4.415
    2    HA   LEU  11           HA       LEU  11  -9.049  -6.790   6.176
    3    HB2  LEU  11           HB2      LEU  11  -8.459  -8.220   3.582
    4    HB3  LEU  11           HB3      LEU  11  -7.208  -7.488   4.585
    5    HG   LEU  11           HG       LEU  11  -9.183  -9.549   5.599
    6   HD13  LEU  11          HD11      LEU  11  -7.929 -10.774   4.051
    7   HD12  LEU  11          HD12      LEU  11  -7.001 -10.988   5.534
    8   HD11  LEU  11          HD13      LEU  11  -6.471  -9.821   4.324
    9   HD22  LEU  11          HD21      LEU  11  -8.362  -8.510   7.516
   10   HD21  LEU  11          HD22      LEU  11  -6.826  -8.087   6.762
   11   HD23  LEU  11          HD23      LEU  11  -7.127  -9.745   7.279

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  12           H        ILE  12  -9.935  -6.279   2.777
    2    HA   ILE  12           HA       ILE  12  -8.279  -4.022   2.349
    3    HB   ILE  12           HB       ILE  12 -10.897  -4.796   1.040
    4   HG12  ILE  12          HG12      ILE  12  -8.806  -6.341   0.935
    5   HG13  ILE  12          HG13      ILE  12  -9.618  -5.954  -0.567
    6   HG22  ILE  12          HG21      ILE  12  -9.957  -3.343  -0.851
    7   HG21  ILE  12          HG22      ILE  12  -8.834  -2.689   0.334
    8   HG23  ILE  12          HG23      ILE  12 -10.551  -2.505   0.550
    9   HD13  ILE  12          HD11      ILE  12  -7.932  -4.267  -1.062
   10   HD12  ILE  12          HD12      ILE  12  -7.133  -5.797  -0.704
   11   HD11  ILE  12          HD13      ILE  12  -7.173  -4.528   0.497

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  13           H        ILE  13 -11.643  -4.342   3.419
    2    HA   ILE  13           HA       ILE  13 -12.154  -1.562   3.669
    3    HB   ILE  13           HB       ILE  13 -13.325  -3.990   5.047
    4   HG12  ILE  13          HG12      ILE  13 -13.516  -3.356   2.472
    5   HG13  ILE  13          HG13      ILE  13 -14.860  -4.055   3.349
    6   HG22  ILE  13          HG21      ILE  13 -15.267  -2.355   5.531
    7   HG21  ILE  13          HG22      ILE  13 -14.094  -1.071   5.274
    8   HG23  ILE  13          HG23      ILE  13 -13.845  -2.243   6.565
    9   HD12  ILE  13          HD11      ILE  13 -15.430  -1.999   1.952
   10   HD11  ILE  13          HD12      ILE  13 -14.459  -1.089   3.093
   11   HD13  ILE  13          HD13      ILE  13 -15.892  -1.918   3.656

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ASN  14           H        ASN  14 -11.016  -4.019   5.967
    2    HA   ASN  14           HA       ASN  14 -10.862  -2.364   8.244
    3    HB2  ASN  14           HB2      ASN  14 -10.559  -4.968   7.939
    4    HB3  ASN  14           HB3      ASN  14  -8.857  -4.551   7.793
    5   HD21  ASN  14          HD21      ASN  14  -9.482  -6.074   9.973
    6   HD22  ASN  14          HD22      ASN  14  -9.482  -5.145  11.392

  No H/Q in entry =           6
  In of MODEL   64
    1    H    SER  15           H        SER  15  -8.426  -3.158   5.775
    2    HA   SER  15           HA       SER  15  -6.319  -1.620   6.854
    3    HB2  SER  15           HB2      SER  15  -5.279  -1.828   4.704
    4    HB3  SER  15           HB3      SER  15  -6.206  -3.305   4.933
    5    HG   SER  15           HG       SER  15  -7.906  -2.278   3.744

  No H/Q in entry =           5
  In of MODEL   64
    1    H    GLY  16           H        GLY  16  -8.918  -0.815   4.583
    2    HA3  GLY  16           HA2      GLY  16  -8.105   1.838   4.021
    3    HA2  GLY  16           HA3      GLY  16  -9.744   1.211   3.851

  No H/Q in entry =           3
  In of MODEL   64
    1    H    GLN  17           H        GLN  17 -10.293   0.492   6.500
    2    HA   GLN  17           HA       GLN  17 -11.056   2.990   7.620
    3    HB2  GLN  17           HB2      GLN  17 -12.246   0.876   8.106
    4    HB3  GLN  17           HB3      GLN  17 -10.838   0.299   8.996
    5    HG2  GLN  17           HG2      GLN  17 -12.460   1.229  10.567
    6    HG3  GLN  17           HG3      GLN  17 -11.034   2.264  10.515
    7   HE21  GLN  17          HE21      GLN  17 -14.465   2.130   9.871
    8   HE22  GLN  17          HE22      GLN  17 -14.623   3.733   9.332

  No H/Q in entry =           8
  In of MODEL   64
    1    H    ALA  18           H        ALA  18  -8.389   0.763   8.274
    2    HA   ALA  18           HA       ALA  18  -7.333   2.013  10.545
    3    HB2  ALA  18           HB1      ALA  18  -6.670  -0.198   9.196
    4    HB3  ALA  18           HB2      ALA  18  -5.531   0.613  10.271
    5    HB1  ALA  18           HB3      ALA  18  -5.445   0.883   8.529

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ARG  19           H        ARG  19  -6.545   2.531   7.099
    2    HA   ARG  19           HA       ARG  19  -4.691   4.618   7.530
    3    HB2  ARG  19           HB2      ARG  19  -4.979   3.458   5.339
    4    HB3  ARG  19           HB3      ARG  19  -6.536   4.267   5.145
    5    HG2  ARG  19           HG2      ARG  19  -5.451   6.461   5.209
    6    HG3  ARG  19           HG3      ARG  19  -3.889   5.708   5.529
    7    HD2  ARG  19           HD2      ARG  19  -4.007   6.281   3.182
    8    HD3  ARG  19           HD3      ARG  19  -4.059   4.521   3.338
    9    HE   ARG  19           HE       ARG  19  -6.710   5.377   3.304
   10   HH21  ARG  19          HH11      ARG  19  -7.893   5.498   1.376
   11   HH22  ARG  19          HH12      ARG  19  -7.061   5.583  -0.138
   12   HH11  ARG  19          HH21      ARG  19  -3.921   5.484   1.291
   13   HH12  ARG  19          HH22      ARG  19  -4.810   5.572  -0.186

  No H/Q in entry =          13
  In of MODEL   64
    1    H    SER  20           H        SER  20  -8.186   4.659   6.902
    2    HA   SER  20           HA       SER  20  -8.598   7.407   6.833
    3    HB2  SER  20           HB2      SER  20 -10.444   6.028   6.291
    4    HB3  SER  20           HB3      SER  20 -10.328   5.143   7.809
    5    HG   SER  20           HG       SER  20 -10.845   7.159   8.855

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LEU  21           H        LEU  21  -8.576   5.242   9.651
    2    HA   LEU  21           HA       LEU  21  -9.072   7.241  11.600
    3    HB2  LEU  21           HB2      LEU  21  -7.667   4.569  11.787
    4    HB3  LEU  21           HB3      LEU  21  -8.007   5.588  13.182
    5    HG   LEU  21           HG       LEU  21 -10.145   4.637  11.252
    6   HD11  LEU  21          HD11      LEU  21  -9.052   3.413  13.781
    7   HD13  LEU  21          HD12      LEU  21  -9.371   2.637  12.231
    8   HD12  LEU  21          HD13      LEU  21 -10.714   3.115  13.271
    9   HD21  LEU  21          HD21      LEU  21 -10.125   6.144  13.863
   10   HD23  LEU  21          HD22      LEU  21 -11.514   5.135  13.474
   11   HD22  LEU  21          HD23      LEU  21 -11.075   6.467  12.416

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ALA  22           H        ALA  22  -6.081   5.920  10.225
    2    HA   ALA  22           HA       ALA  22  -4.242   7.282  11.853
    3    HB2  ALA  22           HB1      ALA  22  -3.774   5.426  10.177
    4    HB1  ALA  22           HB2      ALA  22  -2.606   6.747  10.213
    5    HB3  ALA  22           HB3      ALA  22  -3.812   6.670   8.928

  No H/Q in entry =           5
  In of MODEL   64
    1    H    TYR  23           H        TYR  23  -5.554   8.251   8.654
    2    HA   TYR  23           HA       TYR  23  -4.270  10.774   8.578
    3    HB2  TYR  23           HB2      TYR  23  -5.315   9.829   6.583
    4    HB3  TYR  23           HB3      TYR  23  -6.901   9.905   7.351
    5    HD1  TYR  23           HD1      TYR  23  -4.041  11.999   6.192
    6    HD2  TYR  23           HD2      TYR  23  -8.180  11.895   7.332
    7    HE1  TYR  23           HE1      TYR  23  -4.312  14.340   5.417
    8    HE2  TYR  23           HE2      TYR  23  -8.453  14.235   6.556
    9    HH   TYR  23           HH       TYR  23  -6.003  15.860   4.726

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ALA  24           H        ALA  24  -7.379   9.741   9.939
    2    HA   ALA  24           HA       ALA  24  -8.276  12.317  10.687
    3    HB1  ALA  24           HB1      ALA  24 -10.071  11.031  11.148
    4    HB2  ALA  24           HB2      ALA  24  -9.246  10.486  12.606
    5    HB3  ALA  24           HB3      ALA  24  -9.089   9.568  11.109

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ALA  25           H        ALA  25  -6.236   9.911  12.292
    2    HA   ALA  25           HA       ALA  25  -5.944  11.186  14.789
    3    HB2  ALA  25           HB1      ALA  25  -5.122   8.845  13.989
    4    HB3  ALA  25           HB2      ALA  25  -4.134   9.732  15.153
    5    HB1  ALA  25           HB3      ALA  25  -3.684   9.713  13.447

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LEU  26           H        LEU  26  -4.136  11.503  11.761
    2    HA   LEU  26           HA       LEU  26  -2.223  13.369  12.681
    3    HB2  LEU  26           HB2      LEU  26  -1.880  12.211  10.587
    4    HB3  LEU  26           HB3      LEU  26  -3.362  12.884   9.916
    5    HG   LEU  26           HG       LEU  26  -2.396  15.156  10.046
    6   HD12  LEU  26          HD11      LEU  26   0.138  15.230  10.480
    7   HD11  LEU  26          HD12      LEU  26  -0.058  13.650  11.233
    8   HD13  LEU  26          HD13      LEU  26  -0.901  15.052  11.893
    9   HD21  LEU  26          HD21      LEU  26  -0.599  13.129   8.678
   10   HD23  LEU  26          HD22      LEU  26  -0.675  14.847   8.296
   11   HD22  LEU  26          HD23      LEU  26  -2.075  13.818   8.003

  No H/Q in entry =          11
  In of MODEL   64
    1    H    LYS  27           H        LYS  27  -5.402  13.777  11.176
    2    HA   LYS  27           HA       LYS  27  -5.402  16.565  10.960
    3    HB2  LYS  27           HB2      LYS  27  -7.107  15.046   9.970
    4    HB3  LYS  27           HB3      LYS  27  -7.772  14.786  11.582
    5    HG2  LYS  27           HG2      LYS  27  -8.252  17.184  11.800
    6    HG3  LYS  27           HG3      LYS  27  -7.538  17.486  10.213
    7    HD2  LYS  27           HD2      LYS  27  -9.232  16.010   9.172
    8    HD3  LYS  27           HD3      LYS  27  -9.953  15.725  10.758
    9    HE2  LYS  27           HE2      LYS  27 -10.447  18.129  10.982
   10    HE3  LYS  27           HE3      LYS  27  -9.698  18.435   9.411
   11    HZ3  LYS  27           HZ1      LYS  27 -12.070  18.261   9.151
   12    HZ2  LYS  27           HZ2      LYS  27 -12.094  16.748   9.930
   13    HZ1  LYS  27           HZ3      LYS  27 -11.340  16.917   8.413

  No H/Q in entry =          13
  In of MODEL   64
    1    H    GLN  28           H        GLN  28  -6.271  14.478  13.693
    2    HA   GLN  28           HA       GLN  28  -7.220  16.474  15.450
    3    HB2  GLN  28           HB2      GLN  28  -5.772  13.874  16.018
    4    HB3  GLN  28           HB3      GLN  28  -6.539  14.872  17.255
    5    HG2  GLN  28           HG2      GLN  28  -7.958  13.697  14.846
    6    HG3  GLN  28           HG3      GLN  28  -8.025  13.036  16.480
    7   HE21  GLN  28          HE21      GLN  28  -9.864  14.823  14.439
    8   HE22  GLN  28          HE22      GLN  28 -10.658  15.828  15.551

  No H/Q in entry =           8
  In of MODEL   64
    1    H    ALA  29           H        ALA  29  -3.971  15.237  14.794
    2    HA   ALA  29           HA       ALA  29  -2.576  16.675  16.775
    3    HB1  ALA  29           HB1      ALA  29  -0.624  16.014  15.675
    4    HB3  ALA  29           HB2      ALA  29  -1.368  16.114  14.079
    5    HB2  ALA  29           HB3      ALA  29  -1.773  14.780  15.159

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LYS  30           H        LYS  30  -3.424  17.517  13.433
    2    HA   LYS  30           HA       LYS  30  -2.058  19.982  13.328
    3    HB2  LYS  30           HB2      LYS  30  -4.561  19.054  11.905
    4    HB3  LYS  30           HB3      LYS  30  -3.752  20.581  11.559
    5    HG2  LYS  30           HG2      LYS  30  -1.655  19.322  11.069
    6    HG3  LYS  30           HG3      LYS  30  -2.537  17.812  11.316
    7    HD2  LYS  30           HD2      LYS  30  -4.098  18.414   9.506
    8    HD3  LYS  30           HD3      LYS  30  -3.239  19.936   9.260
    9    HE2  LYS  30           HE2      LYS  30  -1.180  18.675   8.704
   10    HE3  LYS  30           HE3      LYS  30  -2.058  17.158   8.919
   11    HZ2  LYS  30           HZ1      LYS  30  -1.878  18.018   6.573
   12    HZ1  LYS  30           HZ2      LYS  30  -2.947  19.265   7.025
   13    HZ3  LYS  30           HZ3      LYS  30  -3.444  17.639   7.103

  No H/Q in entry =          13
  In of MODEL   64
    1    H    GLN  31           H        GLN  31  -5.154  19.086  14.722
    2    HA   GLN  31           HA       GLN  31  -5.967  21.832  15.151
    3    HB2  GLN  31           HB2      GLN  31  -7.115  19.374  16.480
    4    HB3  GLN  31           HB3      GLN  31  -7.899  20.931  16.219
    5    HG2  GLN  31           HG2      GLN  31  -7.156  20.151  13.639
    6    HG3  GLN  31           HG3      GLN  31  -7.662  18.642  14.391
    7   HE21  GLN  31          HE21      GLN  31  -9.081  20.180  12.270
    8   HE22  GLN  31          HE22      GLN  31 -10.606  20.551  12.913

  No H/Q in entry =           8
  In of MODEL   64
    1    H    GLY  32           H        GLY  32  -3.633  19.950  16.500
    2    HA3  GLY  32           HA2      GLY  32  -2.254  20.446  18.310
    3    HA2  GLY  32           HA3      GLY  32  -3.407  21.673  18.818

  No H/Q in entry =           3
  In of MODEL   64
    1    H    ASP  33           H        ASP  33  -4.776  18.607  18.163
    2    HA   ASP  33           HA       ASP  33  -5.201  18.160  21.043
    3    HB2  ASP  33           HB2      ASP  33  -6.572  17.111  18.561
    4    HB3  ASP  33           HB3      ASP  33  -6.920  16.505  20.178

  No H/Q in entry =           4
  In of MODEL   64
    1    H    PHE  34           H        PHE  34  -3.021  17.345  21.370
    2    HA   PHE  34           HA       PHE  34  -1.975  15.105  19.989
    3    HB2  PHE  34           HB2      PHE  34  -1.395  16.115  22.783
    4    HB3  PHE  34           HB3      PHE  34  -0.440  14.902  21.929
    5    HD1  PHE  34           HD1      PHE  34  -0.672  18.328  22.643
    6    HD2  PHE  34           HD2      PHE  34   0.225  15.621  19.430
    7    HE1  PHE  34           HE1      PHE  34   0.603  20.114  21.489
    8    HE2  PHE  34           HE2      PHE  34   1.496  17.409  18.281
    9    HZ   PHE  34           HZ       PHE  34   1.687  19.652  19.314

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ALA  35           H        ALA  35  -4.040  15.365  22.835
    2    HA   ALA  35           HA       ALA  35  -3.793  12.712  23.749
    3    HB3  ALA  35           HB1      ALA  35  -6.267  13.304  24.584
    4    HB1  ALA  35           HB2      ALA  35  -5.755  14.928  24.123
    5    HB2  ALA  35           HB3      ALA  35  -4.836  14.025  25.326

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ALA  36           H        ALA  36  -6.250  14.178  21.622
    2    HA   ALA  36           HA       ALA  36  -7.624  11.741  21.148
    3    HB1  ALA  36           HB1      ALA  36  -9.095  13.135  20.173
    4    HB3  ALA  36           HB2      ALA  36  -7.920  13.567  18.930
    5    HB2  ALA  36           HB3      ALA  36  -7.970  14.463  20.449

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ALA  37           H        ALA  37  -4.956  13.362  19.490
    2    HA   ALA  37           HA       ALA  37  -4.878  11.714  17.203
    3    HB3  ALA  37           HB1      ALA  37  -2.924  13.466  18.630
    4    HB2  ALA  37           HB2      ALA  37  -3.442  13.504  16.946
    5    HB1  ALA  37           HB3      ALA  37  -2.273  12.295  17.483

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LYS  38           H        LYS  38  -3.140  11.453  20.295
    2    HA   LYS  38           HA       LYS  38  -1.773   9.072  19.830
    3    HB2  LYS  38           HB2      LYS  38  -2.140  10.841  21.963
    4    HB3  LYS  38           HB3      LYS  38  -2.739   9.306  22.583
    5    HG2  LYS  38           HG2      LYS  38  -0.623   8.216  22.069
    6    HG3  LYS  38           HG3      LYS  38  -0.032   9.666  21.251
    7    HD2  LYS  38           HD2      LYS  38   0.103  10.898  23.281
    8    HD3  LYS  38           HD3      LYS  38  -0.904   9.737  24.146
    9    HE2  LYS  38           HE2      LYS  38   1.451   9.462  24.785
   10    HE3  LYS  38           HE3      LYS  38   0.876   8.031  23.924
   11    HZ3  LYS  38           HZ1      LYS  38   2.183   8.461  22.151
   12    HZ2  LYS  38           HZ2      LYS  38   3.116   9.310  23.290
   13    HZ1  LYS  38           HZ3      LYS  38   2.031  10.147  22.285

  No H/Q in entry =          13
  In of MODEL   64
    1    H    ALA  39           H        ALA  39  -5.029   9.523  21.205
    2    HA   ALA  39           HA       ALA  39  -5.550   6.798  21.721
    3    HB3  ALA  39           HB1      ALA  39  -7.734   8.704  20.927
    4    HB2  ALA  39           HB2      ALA  39  -6.851   8.953  22.433
    5    HB1  ALA  39           HB3      ALA  39  -7.742   7.453  22.171

  No H/Q in entry =           5
  In of MODEL   64
    1    H    MET  40           H        MET  40  -6.146   8.786  18.859
    2    HA   MET  40           HA       MET  40  -7.580   6.822  17.398
    3    HB2  MET  40           HB2      MET  40  -6.001   9.238  16.492
    4    HB3  MET  40           HB3      MET  40  -7.004   8.257  15.420
    5    HG2  MET  40           HG2      MET  40  -8.078   9.503  17.963
    6    HG3  MET  40           HG3      MET  40  -8.137  10.328  16.407
    7    HE3  MET  40           HE1      MET  40 -10.678   8.656  14.333
    8    HE2  MET  40           HE2      MET  40  -8.927   8.801  14.197
    9    HE1  MET  40           HE3      MET  40  -9.871  10.155  14.816

  No H/Q in entry =           9
  In of MODEL   64
    1    H    MET  41           H        MET  41  -4.102   7.617  17.543
    2    HA   MET  41           HA       MET  41  -3.299   5.864  15.458
    3    HB2  MET  41           HB2      MET  41  -1.712   6.570  17.939
    4    HB3  MET  41           HB3      MET  41  -1.073   5.924  16.432
    5    HG2  MET  41           HG2      MET  41  -2.257   8.082  15.407
    6    HG3  MET  41           HG3      MET  41  -2.043   8.683  17.050
    7    HE2  MET  41           HE1      MET  41   0.906   6.635  17.445
    8    HE1  MET  41           HE2      MET  41   0.089   7.920  18.330
    9    HE3  MET  41           HE3      MET  41   1.713   8.187  17.698

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ASP  42           H        ASP  42  -3.703   5.403  18.944
    2    HA   ASP  42           HA       ASP  42  -2.625   2.828  19.126
    3    HB2  ASP  42           HB2      ASP  42  -3.542   4.583  20.932
    4    HB3  ASP  42           HB3      ASP  42  -4.951   3.533  20.855

  No H/Q in entry =           4
  In of MODEL   64
    1    H    GLN  43           H        GLN  43  -5.973   3.873  18.594
    2    HA   GLN  43           HA       GLN  43  -7.071   1.266  18.405
    3    HB2  GLN  43           HB2      GLN  43  -8.030   3.896  17.255
    4    HB3  GLN  43           HB3      GLN  43  -8.968   2.401  17.233
    5    HG2  GLN  43           HG2      GLN  43  -8.692   2.298  19.744
    6    HG3  GLN  43           HG3      GLN  43  -7.994   3.915  19.669
    7   HE21  GLN  43          HE21      GLN  43 -10.186   3.966  21.152
    8   HE22  GLN  43          HE22      GLN  43 -11.549   4.515  20.307

  No H/Q in entry =           8
  In of MODEL   64
    1    H    SER  44           H        SER  44  -5.750   3.489  15.991
    2    HA   SER  44           HA       SER  44  -6.408   1.981  13.705
    3    HB2  SER  44           HB2      SER  44  -5.195   4.387  14.145
    4    HB3  SER  44           HB3      SER  44  -3.821   3.411  13.631
    5    HG   SER  44           HG       SER  44  -4.936   4.355  11.854

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ARG  45           H        ARG  45  -3.545   1.927  15.808
    2    HA   ARG  45           HA       ARG  45  -2.022  -0.009  14.448
    3    HB2  ARG  45           HB2      ARG  45  -1.219   1.436  16.316
    4    HB3  ARG  45           HB3      ARG  45  -2.203   0.495  17.433
    5    HG2  ARG  45           HG2      ARG  45  -0.933  -1.546  16.812
    6    HG3  ARG  45           HG3      ARG  45   0.075  -0.580  15.736
    7    HD2  ARG  45           HD2      ARG  45   0.771   0.823  17.690
    8    HD3  ARG  45           HD3      ARG  45  -0.141  -0.261  18.762
    9    HE   ARG  45           HE       ARG  45   1.597  -1.837  17.203
   10   HH21  ARG  45          HH11      ARG  45   3.504  -2.623  18.060
   11   HH22  ARG  45          HH12      ARG  45   4.253  -1.817  19.392
   12   HH11  ARG  45          HH21      ARG  45   1.840   0.647  19.582
   13   HH12  ARG  45          HH22      ARG  45   3.311   0.037  20.252

  No H/Q in entry =          13
  In of MODEL   64
    1    H    MET  46           H        MET  46  -4.434  -0.356  17.031
    2    HA   MET  46           HA       MET  46  -4.223  -3.150  17.355
    3    HB2  MET  46           HB2      MET  46  -6.425  -1.174  17.930
    4    HB3  MET  46           HB3      MET  46  -6.615  -2.896  18.271
    5    HG2  MET  46           HG2      MET  46  -4.632  -2.861  19.703
    6    HG3  MET  46           HG3      MET  46  -4.352  -1.171  19.319
    7    HE2  MET  46           HE1      MET  46  -7.273  -3.229  22.000
    8    HE1  MET  46           HE2      MET  46  -6.563  -3.792  20.491
    9    HE3  MET  46           HE3      MET  46  -8.089  -2.913  20.463

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ALA  47           H        ALA  47  -6.259  -1.178  15.234
    2    HA   ALA  47           HA       ALA  47  -7.835  -3.260  14.166
    3    HB3  ALA  47           HB1      ALA  47  -8.547  -1.036  13.733
    4    HB1  ALA  47           HB2      ALA  47  -8.036  -1.670  12.169
    5    HB2  ALA  47           HB3      ALA  47  -6.980  -0.579  13.068

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LEU  48           H        LEU  48  -4.729  -1.907  13.133
    2    HA   LEU  48           HA       LEU  48  -4.404  -3.505  10.803
    3    HB2  LEU  48           HB2      LEU  48  -2.382  -2.185  12.620
    4    HB3  LEU  48           HB3      LEU  48  -1.989  -2.908  11.060
    5    HG   LEU  48           HG       LEU  48  -4.050  -0.720  11.422
    6   HD13  LEU  48          HD11      LEU  48  -1.948   0.192  12.099
    7   HD12  LEU  48          HD12      LEU  48  -2.218   0.733  10.443
    8   HD11  LEU  48          HD13      LEU  48  -1.102  -0.595  10.767
    9   HD22  LEU  48          HD21      LEU  48  -4.489  -1.723   9.348
   10   HD21  LEU  48          HD22      LEU  48  -2.798  -2.133   9.068
   11   HD23  LEU  48          HD23      LEU  48  -3.341  -0.463   8.896

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ASN  49           H        ASN  49  -3.380  -3.869  14.159
    2    HA   ASN  49           HA       ASN  49  -1.740  -6.108  13.853
    3    HB2  ASN  49           HB2      ASN  49  -1.789  -4.776  15.894
    4    HB3  ASN  49           HB3      ASN  49  -3.452  -5.253  16.203
    5   HD21  ASN  49          HD21      ASN  49  -0.342  -5.928  17.123
    6   HD22  ASN  49          HD22      ASN  49  -0.543  -7.533  17.636

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLU  50           H        GLU  50  -5.218  -5.882  14.495
    2    HA   GLU  50           HA       GLU  50  -5.690  -8.688  14.615
    3    HB2  GLU  50           HB2      GLU  50  -7.307  -7.020  15.469
    4    HB3  GLU  50           HB3      GLU  50  -7.596  -6.468  13.817
    5    HG2  GLU  50           HG2      GLU  50  -8.423  -8.680  13.184
    6    HG3  GLU  50           HG3      GLU  50  -8.045  -9.310  14.783

  No H/Q in entry =           6
  In of MODEL   64
    1    H    ALA  51           H        ALA  51  -5.771  -6.304  12.006
    2    HA   ALA  51           HA       ALA  51  -6.715  -8.056   9.985
    3    HB2  ALA  51           HB1      ALA  51  -6.510  -6.248   8.608
    4    HB1  ALA  51           HB2      ALA  51  -4.880  -5.873   9.168
    5    HB3  ALA  51           HB3      ALA  51  -6.279  -5.376  10.123

  No H/Q in entry =           5
  In of MODEL   64
    1    H    HIS  52           H        HIS  52  -3.446  -7.098  10.990
    2    HA   HIS  52           HA       HIS  52  -2.010  -8.577   9.060
    3    HB2  HIS  52           HB2      HIS  52  -1.000  -6.827  10.483
    4    HB3  HIS  52           HB3      HIS  52  -1.189  -7.873  11.890
    5    HD1  HIS  52           HD1      HIS  52   0.253 -10.089  11.928
    6    HD2  HIS  52           HD2      HIS  52   1.184  -7.464   8.826
    7    HE1  HIS  52           HE1      HIS  52   2.481 -10.846  10.993
    8    HE2  HIS  52           HE2      HIS  52   3.062  -9.257   9.101

  No H/Q in entry =           8
  In of MODEL   64
    1    H    LEU  53           H        LEU  53  -3.236  -9.455  12.267
    2    HA   LEU  53           HA       LEU  53  -2.006 -11.982  12.484
    3    HB2  LEU  53           HB2      LEU  53  -4.517 -10.829  13.671
    4    HB3  LEU  53           HB3      LEU  53  -4.036 -12.496  13.976
    5    HG   LEU  53           HG       LEU  53  -2.174 -10.147  14.454
    6   HD13  LEU  53          HD11      LEU  53  -2.804 -10.240  16.799
    7   HD12  LEU  53          HD12      LEU  53  -3.899 -11.586  16.489
    8   HD11  LEU  53          HD13      LEU  53  -4.260  -9.991  15.841
    9   HD21  LEU  53          HD21      LEU  53  -2.164 -13.084  15.170
   10   HD23  LEU  53          HD22      LEU  53  -1.270 -11.923  16.147
   11   HD22  LEU  53          HD23      LEU  53  -0.867 -12.135  14.454

  No H/Q in entry =          11
  In of MODEL   64
    1    H    VAL  54           H        VAL  54  -5.119 -11.001  11.091
    2    HA   VAL  54           HA       VAL  54  -5.993 -13.610  10.409
    3    HB   VAL  54           HB       VAL  54  -6.666 -10.892   9.256
    4   HG12  VAL  54          HG11      VAL  54  -8.743 -12.301   8.434
    5   HG11  VAL  54          HG12      VAL  54  -7.614 -13.652   8.522
    6   HG13  VAL  54          HG13      VAL  54  -7.264 -12.278   7.476
    7   HG22  VAL  54          HG21      VAL  54  -7.590 -10.931  11.400
    8   HG21  VAL  54          HG22      VAL  54  -7.821 -12.677  11.387
    9   HG23  VAL  54          HG23      VAL  54  -8.909 -11.639  10.467

  No H/Q in entry =           9
  In of MODEL   64
    1    H    GLN  55           H        GLN  55  -4.139 -11.144   8.623
    2    HA   GLN  55           HA       GLN  55  -3.969 -12.618   6.214
    3    HB2  GLN  55           HB2      GLN  55  -3.393 -10.347   6.018
    4    HB3  GLN  55           HB3      GLN  55  -2.293 -10.402   7.392
    5    HG2  GLN  55           HG2      GLN  55  -0.554 -11.233   6.135
    6    HG3  GLN  55           HG3      GLN  55  -1.607 -12.226   5.137
    7   HE21  GLN  55          HE21      GLN  55  -1.615 -11.547   3.012
    8   HE22  GLN  55          HE22      GLN  55  -1.434  -9.943   2.495

  No H/Q in entry =           8
  In of MODEL   64
    1    H    THR  56           H        THR  56  -1.888 -12.556   9.112
    2    HA   THR  56           HA       THR  56   0.218 -14.133   8.220
    3    HB   THR  56           HB       THR  56  -1.041 -14.390  10.959
    4    HG1  THR  56           HG1      THR  56   0.036 -12.254   9.715
    5   HG23  THR  56          HG21      THR  56   1.052 -15.145  11.673
    6   HG22  THR  56          HG22      THR  56   1.888 -14.420  10.299
    7   HG21  THR  56          HG23      THR  56   0.922 -15.879  10.076

  No H/Q in entry =           7
  In of MODEL   64
    1    H    LYS  57           H        LYS  57  -2.900 -15.201   9.563
    2    HA   LYS  57           HA       LYS  57  -2.417 -17.993   9.335
    3    HB2  LYS  57           HB2      LYS  57  -4.252 -16.987  10.676
    4    HB3  LYS  57           HB3      LYS  57  -5.020 -16.437   9.195
    5    HG2  LYS  57           HG2      LYS  57  -6.129 -18.461   9.868
    6    HG3  LYS  57           HG3      LYS  57  -5.152 -18.841   8.452
    7    HD2  LYS  57           HD2      LYS  57  -3.477 -19.918   9.773
    8    HD3  LYS  57           HD3      LYS  57  -4.138 -19.271  11.274
    9    HE2  LYS  57           HE2      LYS  57  -6.167 -20.631  10.998
   10    HE3  LYS  57           HE3      LYS  57  -5.578 -21.247   9.455
   11    HZ2  LYS  57           HZ1      LYS  57  -4.480 -21.733  12.157
   12    HZ1  LYS  57           HZ2      LYS  57  -3.583 -22.045  10.748
   13    HZ3  LYS  57           HZ3      LYS  57  -5.044 -22.868  11.028

  No H/Q in entry =          13
  In of MODEL   64
    1    H    LEU  58           H        LEU  58  -3.761 -15.578   7.136
    2    HA   LEU  58           HA       LEU  58  -4.524 -17.423   5.132
    3    HB2  LEU  58           HB2      LEU  58  -3.952 -14.468   4.987
    4    HB3  LEU  58           HB3      LEU  58  -4.593 -15.420   3.646
    5    HG   LEU  58           HG       LEU  58  -5.898 -15.242   6.382
    6   HD11  LEU  58          HD11      LEU  58  -6.197 -13.611   3.880
    7   HD13  LEU  58          HD12      LEU  58  -6.208 -13.095   5.566
    8   HD12  LEU  58          HD13      LEU  58  -7.615 -13.909   4.886
    9   HD22  LEU  58          HD21      LEU  58  -6.829 -17.167   5.514
   10   HD21  LEU  58          HD22      LEU  58  -6.482 -16.720   3.844
   11   HD23  LEU  58          HD23      LEU  58  -7.861 -16.006   4.680

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  59           H        ILE  59  -1.411 -16.169   6.013
    2    HA   ILE  59           HA       ILE  59  -0.282 -16.897   3.390
    3    HB   ILE  59           HB       ILE  59   0.448 -14.814   4.953
    4   HG12  ILE  59          HG12      ILE  59   2.575 -16.448   3.554
    5   HG13  ILE  59          HG13      ILE  59   1.375 -15.532   2.679
    6   HG22  ILE  59          HG21      ILE  59   2.553 -16.829   5.684
    7   HG21  ILE  59          HG22      ILE  59   1.182 -16.570   6.740
    8   HG23  ILE  59          HG23      ILE  59   2.283 -15.244   6.369
    9   HD11  ILE  59          HD11      ILE  59   2.078 -13.499   4.018
   10   HD13  ILE  59          HD12      ILE  59   3.285 -14.101   2.884
   11   HD12  ILE  59          HD13      ILE  59   3.432 -14.463   4.605

  No H/Q in entry =          11
  In of MODEL   64
    1    H    GLU  60           H        GLU  60  -0.308 -17.985   6.763
    2    HA   GLU  60           HA       GLU  60   1.749 -19.940   6.526
    3    HB2  GLU  60           HB2      GLU  60   0.928 -19.133   8.701
    4    HB3  GLU  60           HB3      GLU  60  -0.641 -19.871   8.388
    5    HG2  GLU  60           HG2      GLU  60   0.430 -22.099   8.278
    6    HG3  GLU  60           HG3      GLU  60   1.997 -21.355   8.598

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLY  61           H        GLY  61  -1.755 -20.083   6.011
    2    HA3  GLY  61           HA2      GLY  61  -1.465 -22.878   5.070
    3    HA2  GLY  61           HA3      GLY  61  -2.965 -22.157   5.646

  No H/Q in entry =           3
  In of MODEL   64
    1    H    ASP  62           H        ASP  62  -0.735 -20.563   3.454
    2    HA   ASP  62           HA       ASP  62  -2.812 -20.035   1.562
    3    HB2  ASP  62           HB2      ASP  62  -0.950 -18.993   0.262
    4    HB3  ASP  62           HB3      ASP  62  -1.061 -18.410   1.920

  No H/Q in entry =           4
  In of MODEL   64
    1    H    ALA  63           H        ALA  63  -0.102 -22.344   1.650
    2    HA   ALA  63           HA       ALA  63  -0.249 -23.195  -1.058
    3    HB1  ALA  63           HB1      ALA  63   0.582 -24.867   1.309
    4    HB2  ALA  63           HB2      ALA  63   1.624 -23.680   0.523
    5    HB3  ALA  63           HB3      ALA  63   1.052 -25.084  -0.379

  No H/Q in entry =           5
  In of MODEL   64
    1    H    GLY  64           H        GLY  64  -1.882 -24.221   1.903
    2    HA3  GLY  64           HA2      GLY  64  -3.625 -25.662   2.302
    3    HA2  GLY  64           HA3      GLY  64  -4.272 -25.037   0.794

  No H/Q in entry =           3
  In of MODEL   64
    1    H    GLU  65           H        GLU  65  -4.268 -26.344  -1.018
    2    HA   GLU  65           HA       GLU  65  -4.127 -29.109  -0.660
    3    HB2  GLU  65           HB2      GLU  65  -3.996 -27.497  -3.208
    4    HB3  GLU  65           HB3      GLU  65  -4.230 -29.244  -3.140
    5    HG2  GLU  65           HG2      GLU  65  -6.027 -27.209  -1.795
    6    HG3  GLU  65           HG3      GLU  65  -6.387 -28.012  -3.320

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLY  66           H        GLY  66  -2.854 -30.202  -2.733
    2    HA3  GLY  66           HA2      GLY  66  -0.246 -30.680  -1.814
    3    HA2  GLY  66           HA3      GLY  66  -0.910 -31.207  -3.349

  No H/Q in entry =           3
  In of MODEL   64
    1    H    LYS  67           H        LYS  67  -1.431 -28.575  -4.354
    2    HA   LYS  67           HA       LYS  67   1.049 -28.063  -5.601
    3    HB2  LYS  67           HB2      LYS  67  -0.135 -26.303  -6.780
    4    HB3  LYS  67           HB3      LYS  67  -1.158 -27.741  -6.658
    5    HG2  LYS  67           HG2      LYS  67  -2.228 -26.765  -4.626
    6    HG3  LYS  67           HG3      LYS  67  -1.272 -25.303  -4.855
    7    HD2  LYS  67           HD2      LYS  67  -2.319 -24.952  -7.058
    8    HD3  LYS  67           HD3      LYS  67  -3.271 -26.423  -6.841
    9    HE2  LYS  67           HE2      LYS  67  -4.759 -24.759  -6.120
   10    HE3  LYS  67           HE3      LYS  67  -4.036 -25.302  -4.607
   11    HZ2  LYS  67           HZ1      LYS  67  -3.212 -22.933  -6.194
   12    HZ1  LYS  67           HZ2      LYS  67  -2.440 -23.476  -4.782
   13    HZ3  LYS  67           HZ3      LYS  67  -4.041 -22.911  -4.714

  No H/Q in entry =          13
  In of MODEL   64
    1    H    MET  68           H        MET  68   2.564 -26.604  -5.396
    2    HA   MET  68           HA       MET  68   3.033 -25.337  -2.908
    3    HB2  MET  68           HB2      MET  68   4.405 -25.140  -5.586
    4    HB3  MET  68           HB3      MET  68   5.009 -24.363  -4.123
    5    HG2  MET  68           HG2      MET  68   5.082 -26.559  -2.991
    6    HG3  MET  68           HG3      MET  68   4.501 -27.335  -4.467
    7    HE2  MET  68           HE1      MET  68   7.979 -28.650  -4.756
    8    HE1  MET  68           HE2      MET  68   6.256 -28.917  -4.498
    9    HE3  MET  68           HE3      MET  68   7.263 -28.357  -3.165

  No H/Q in entry =           9
  In of MODEL   64
    1    H    LYS  69           H        LYS  69   1.115 -24.283  -5.474
    2    HA   LYS  69           HA       LYS  69   1.736 -21.514  -5.444
    3    HB2  LYS  69           HB2      LYS  69  -0.664 -22.987  -6.486
    4    HB3  LYS  69           HB3      LYS  69  -0.424 -21.245  -6.672
    5    HG2  LYS  69           HG2      LYS  69   1.800 -21.712  -7.714
    6    HG3  LYS  69           HG3      LYS  69   1.431 -23.435  -7.646
    7    HD2  LYS  69           HD2      LYS  69  -0.337 -21.413  -9.041
    8    HD3  LYS  69           HD3      LYS  69   0.919 -22.337  -9.867
    9    HE2  LYS  69           HE2      LYS  69  -0.207 -24.428  -8.869
   10    HE3  LYS  69           HE3      LYS  69  -1.572 -23.371  -8.512
   11    HZ3  LYS  69           HZ1      LYS  69  -2.138 -23.237 -10.657
   12    HZ2  LYS  69           HZ2      LYS  69  -1.216 -24.653 -10.837
   13    HZ1  LYS  69           HZ3      LYS  69  -0.534 -23.139 -11.196

  No H/Q in entry =          13
  In of MODEL   64
    1    H    VAL  70           H        VAL  70   0.297 -19.733  -4.888
    2    HA   VAL  70           HA       VAL  70  -1.242 -20.241  -2.401
    3    HB   VAL  70           HB       VAL  70  -0.547 -17.943  -1.714
    4   HG11  VAL  70          HG11      VAL  70   0.708 -19.991  -1.008
    5   HG13  VAL  70          HG12      VAL  70   1.720 -18.547  -1.078
    6   HG12  VAL  70          HG13      VAL  70   1.800 -19.743  -2.371
    7   HG21  VAL  70          HG21      VAL  70   1.189 -18.117  -4.212
    8   HG23  VAL  70          HG22      VAL  70   1.362 -16.891  -2.959
    9   HG22  VAL  70          HG23      VAL  70  -0.112 -16.961  -3.921

  No H/Q in entry =           9
  In of MODEL   64
    1    H    SER  71           H        SER  71  -2.920 -18.632  -1.979
    2    HA   SER  71           HA       SER  71  -4.676 -18.235  -4.167
    3    HB2  SER  71           HB2      SER  71  -5.430 -18.382  -1.788
    4    HB3  SER  71           HB3      SER  71  -4.663 -16.829  -1.470
    5    HG   SER  71           HG       SER  71  -6.862 -17.429  -3.144

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LEU  72           H        LEU  72  -4.982 -16.545  -5.499
    2    HA   LEU  72           HA       LEU  72  -2.894 -14.708  -5.973
    3    HB2  LEU  72           HB2      LEU  72  -5.751 -14.803  -6.940
    4    HB3  LEU  72           HB3      LEU  72  -4.564 -13.634  -7.513
    5    HG   LEU  72           HG       LEU  72  -4.123 -16.636  -7.626
    6   HD11  LEU  72          HD11      LEU  72  -5.252 -14.720  -9.681
    7   HD13  LEU  72          HD12      LEU  72  -6.009 -16.181  -9.044
    8   HD12  LEU  72          HD13      LEU  72  -4.600 -16.305 -10.097
    9   HD22  LEU  72          HD21      LEU  72  -2.013 -15.650  -7.873
   10   HD21  LEU  72          HD22      LEU  72  -2.649 -14.211  -8.652
   11   HD23  LEU  72          HD23      LEU  72  -2.556 -15.726  -9.545

  No H/Q in entry =          11
  In of MODEL   64
    1    H    VAL  73           H        VAL  73  -6.004 -14.385  -4.368
    2    HA   VAL  73           HA       VAL  73  -6.089 -11.613  -4.030
    3    HB   VAL  73           HB       VAL  73  -7.807 -11.989  -2.447
    4   HG12  VAL  73          HG11      VAL  73  -7.971 -14.476  -4.133
    5   HG11  VAL  73          HG12      VAL  73  -8.039 -12.885  -4.886
    6   HG13  VAL  73          HG13      VAL  73  -9.255 -13.349  -3.695
    7   HG21  VAL  73          HG21      VAL  73  -6.365 -14.594  -2.022
    8   HG23  VAL  73          HG22      VAL  73  -8.083 -14.475  -1.643
    9   HG22  VAL  73          HG23      VAL  73  -6.925 -13.428  -0.823

  No H/Q in entry =           9
  In of MODEL   64
    1    H    LEU  74           H        LEU  74  -4.132 -13.948  -2.421
    2    HA   LEU  74           HA       LEU  74  -3.754 -12.790   0.099
    3    HB2  LEU  74           HB2      LEU  74  -2.936 -14.998  -0.375
    4    HB3  LEU  74           HB3      LEU  74  -1.890 -14.386  -1.655
    5    HG   LEU  74           HG       LEU  74  -0.596 -13.104   0.012
    6   HD11  LEU  74          HD11      LEU  74  -2.654 -14.295   1.878
    7   HD13  LEU  74          HD12      LEU  74  -2.170 -12.605   1.724
    8   HD12  LEU  74          HD13      LEU  74  -1.073 -13.773   2.461
    9   HD22  LEU  74          HD21      LEU  74   0.635 -14.929   0.660
   10   HD21  LEU  74          HD22      LEU  74  -0.395 -15.664  -0.547
   11   HD23  LEU  74          HD23      LEU  74  -0.788 -15.849   1.147

  No H/Q in entry =          11
  In of MODEL   64
    1    H    VAL  75           H        VAL  75  -1.847 -12.385  -2.846
    2    HA   VAL  75           HA       VAL  75  -0.083 -10.432  -1.831
    3    HB   VAL  75           HB       VAL  75  -1.011 -10.940  -4.660
    4   HG13  VAL  75          HG11      VAL  75  -0.178  -8.630  -4.468
    5   HG12  VAL  75          HG12      VAL  75   1.040  -9.619  -5.260
    6   HG11  VAL  75          HG13      VAL  75   1.225  -9.191  -3.567
    7   HG22  VAL  75          HG21      VAL  75   0.957 -12.253  -4.854
    8   HG21  VAL  75          HG22      VAL  75   0.298 -12.701  -3.280
    9   HG23  VAL  75          HG23      VAL  75   1.656 -11.579  -3.380

  No H/Q in entry =           9
  In of MODEL   64
    1    H    GLU  76           H        GLU  76  -3.225 -10.134  -3.513
    2    HA   GLU  76           HA       GLU  76  -3.314  -7.321  -3.628
    3    HB2  GLU  76           HB2      GLU  76  -4.945  -8.782  -4.798
    4    HB3  GLU  76           HB3      GLU  76  -5.599  -9.291  -3.250
    5    HG2  GLU  76           HG2      GLU  76  -7.075  -7.601  -4.133
    6    HG3  GLU  76           HG3      GLU  76  -6.213  -6.874  -2.791

  No H/Q in entry =           6
  In of MODEL   64
    1    H    ALA  77           H        ALA  77  -4.413  -9.553  -1.086
    2    HA   ALA  77           HA       ALA  77  -5.409  -7.556   0.657
    3    HB2  ALA  77           HB1      ALA  77  -5.136  -9.313   2.425
    4    HB1  ALA  77           HB2      ALA  77  -4.336 -10.328   1.227
    5    HB3  ALA  77           HB3      ALA  77  -6.022  -9.865   1.003

  No H/Q in entry =           5
  In of MODEL   64
    1    H    GLN  78           H        GLN  78  -2.239  -9.066   0.322
    2    HA   GLN  78           HA       GLN  78  -1.012  -7.879   2.576
    3    HB2  GLN  78           HB2      GLN  78  -0.118  -9.815   1.230
    4    HB3  GLN  78           HB3      GLN  78   0.318  -8.665  -0.030
    5    HG2  GLN  78           HG2      GLN  78   1.749  -7.454   1.563
    6    HG3  GLN  78           HG3      GLN  78   1.312  -8.595   2.831
    7   HE21  GLN  78          HE21      GLN  78   4.041  -8.301   2.027
    8   HE22  GLN  78          HE22      GLN  78   4.526  -9.729   1.247

  No H/Q in entry =           8
  In of MODEL   64
    1    H    LEU  79           H        LEU  79  -1.368  -6.838  -0.778
    2    HA   LEU  79           HA       LEU  79   0.290  -4.590  -0.763
    3    HB2  LEU  79           HB2      LEU  79  -0.712  -5.418  -2.820
    4    HB3  LEU  79           HB3      LEU  79  -2.325  -5.044  -2.225
    5    HG   LEU  79           HG       LEU  79  -1.810  -2.650  -2.206
    6   HD13  LEU  79          HD11      LEU  79   0.423  -2.376  -1.679
    7   HD12  LEU  79          HD12      LEU  79   0.481  -2.096  -3.419
    8   HD11  LEU  79          HD13      LEU  79   0.950  -3.665  -2.762
    9   HD23  LEU  79          HD21      LEU  79  -1.160  -2.454  -4.755
   10   HD22  LEU  79          HD22      LEU  79  -2.680  -3.219  -4.303
   11   HD21  LEU  79          HD23      LEU  79  -1.292  -4.213  -4.733

  No H/Q in entry =          11
  In of MODEL   64
    1    H    HIS  80           H        HIS  80  -3.181  -4.791   0.039
    2    HA   HIS  80           HA       HIS  80  -3.410  -2.034   0.689
    3    HB2  HIS  80           HB2      HIS  80  -5.085  -4.462   1.006
    4    HB3  HIS  80           HB3      HIS  80  -5.429  -3.121   2.102
    5    HD1  HIS  80           HD1      HIS  80  -7.060  -1.508   1.175
    6    HD2  HIS  80           HD2      HIS  80  -4.823  -3.307  -1.848
    7    HE1  HIS  80           HE1      HIS  80  -7.896  -0.531  -1.014
    8    HE2  HIS  80           HE2      HIS  80  -6.539  -1.622  -2.867

  No H/Q in entry =           8
  In of MODEL   64
    1    H    LEU  81           H        LEU  81  -2.901  -4.914   2.699
    2    HA   LEU  81           HA       LEU  81  -2.923  -3.556   5.177
    3    HB2  LEU  81           HB2      LEU  81  -1.667  -6.162   4.318
    4    HB3  LEU  81           HB3      LEU  81  -1.660  -5.595   5.989
    5    HG   LEU  81           HG       LEU  81  -4.191  -5.885   4.344
    6   HD12  LEU  81          HD11      LEU  81  -4.480  -7.947   5.898
    7   HD11  LEU  81          HD12      LEU  81  -2.731  -7.855   6.097
    8   HD13  LEU  81          HD13      LEU  81  -3.425  -8.100   4.494
    9   HD23  LEU  81          HD21      LEU  81  -5.049  -6.087   6.840
   10   HD22  LEU  81          HD22      LEU  81  -4.738  -4.497   6.145
   11   HD21  LEU  81          HD23      LEU  81  -3.550  -5.239   7.217

  No H/Q in entry =          11
  In of MODEL   64
    1    H    MET  82           H        MET  82  -0.216  -4.438   3.029
    2    HA   MET  82           HA       MET  82   1.845  -3.512   4.724
    3    HB2  MET  82           HB2      MET  82   1.655  -3.869   1.732
    4    HB3  MET  82           HB3      MET  82   3.125  -3.279   2.503
    5    HG2  MET  82           HG2      MET  82   1.742  -5.881   3.229
    6    HG3  MET  82           HG3      MET  82   3.120  -5.760   2.138
    7    HE3  MET  82           HE1      MET  82   6.113  -4.981   4.140
    8    HE2  MET  82           HE2      MET  82   5.179  -3.627   3.509
    9    HE1  MET  82           HE3      MET  82   5.291  -5.120   2.581

  No H/Q in entry =           9
  In of MODEL   64
    1    H    THR  83           H        THR  83   0.023  -1.902   2.147
    2    HA   THR  83           HA       THR  83   1.407   0.562   2.232
    3    HB   THR  83           HB       THR  83  -0.773   1.458   1.226
    4    HG1  THR  83           HG1      THR  83  -2.408   0.142   1.114
    5   HG22  THR  83          HG21      THR  83  -0.468  -0.365  -0.764
    6   HG21  THR  83          HG22      THR  83   1.029  -0.637   0.125
    7   HG23  THR  83          HG23      THR  83   0.655   0.969  -0.500

  No H/Q in entry =           7
  In of MODEL   64
    1    H    SER  84           H        SER  84  -1.599  -0.496   3.817
    2    HA   SER  84           HA       SER  84  -2.132   1.934   5.147
    3    HB2  SER  84           HB2      SER  84  -2.937  -0.910   5.718
    4    HB3  SER  84           HB3      SER  84  -3.453   0.430   6.742
    5    HG   SER  84           HG       SER  84  -3.888   0.098   3.948

  No H/Q in entry =           5
  In of MODEL   64
    1    H    MET  85           H        MET  85  -0.398  -0.974   6.302
    2    HA   MET  85           HA       MET  85   0.093  -0.030   8.905
    3    HB2  MET  85           HB2      MET  85   0.415  -2.374   8.241
    4    HB3  MET  85           HB3      MET  85   1.799  -1.899   7.254
    5    HG2  MET  85           HG2      MET  85   2.955  -1.049   9.253
    6    HG3  MET  85           HG3      MET  85   1.562  -1.473  10.248
    7    HE3  MET  85           HE1      MET  85   3.289  -3.927   7.267
    8    HE2  MET  85           HE2      MET  85   4.720  -4.013   8.291
    9    HE1  MET  85           HE3      MET  85   4.083  -2.444   7.808

  No H/Q in entry =           9
  In of MODEL   64
    1    H    LEU  86           H        LEU  86   2.046   0.233   5.967
    2    HA   LEU  86           HA       LEU  86   4.238   1.572   7.132
    3    HB2  LEU  86           HB2      LEU  86   4.074   0.477   4.827
    4    HB3  LEU  86           HB3      LEU  86   3.254   1.948   4.302
    5    HG   LEU  86           HG       LEU  86   5.262   3.220   5.290
    6   HD11  LEU  86          HD11      LEU  86   5.989   0.619   6.107
    7   HD13  LEU  86          HD12      LEU  86   6.977   2.075   6.205
    8   HD12  LEU  86          HD13      LEU  86   7.107   1.022   4.799
    9   HD23  LEU  86          HD21      LEU  86   6.014   1.453   2.953
   10   HD22  LEU  86          HD22      LEU  86   6.388   3.156   3.210
   11   HD21  LEU  86          HD23      LEU  86   4.743   2.669   2.802

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ALA  87           H        ALA  87   1.324   2.778   5.521
    2    HA   ALA  87           HA       ALA  87   1.889   5.514   5.596
    3    HB1  ALA  87           HB1      ALA  87  -0.399   3.859   5.046
    4    HB3  ALA  87           HB2      ALA  87  -0.102   5.521   4.540
    5    HB2  ALA  87           HB3      ALA  87  -0.904   5.199   6.080

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ARG  88           H        ARG  88   0.203   3.506   7.983
    2    HA   ARG  88           HA       ARG  88  -0.343   5.559   9.817
    3    HB2  ARG  88           HB2      ARG  88  -1.257   3.197   9.888
    4    HB3  ARG  88           HB3      ARG  88   0.284   2.716  10.607
    5    HG2  ARG  88           HG2      ARG  88  -0.226   4.793  12.214
    6    HG3  ARG  88           HG3      ARG  88  -1.886   4.449  11.747
    7    HD2  ARG  88           HD2      ARG  88  -1.982   2.604  13.002
    8    HD3  ARG  88           HD3      ARG  88  -0.383   2.037  12.485
    9    HE   ARG  88           HE       ARG  88  -0.947   3.306  14.929
   10   HH21  ARG  88          HH11      ARG  88   0.591   4.340  16.174
   11   HH22  ARG  88          HH12      ARG  88   2.111   4.780  15.478
   12   HH11  ARG  88          HH21      ARG  88   1.349   3.499  12.367
   13   HH12  ARG  88          HH22      ARG  88   2.548   4.287  13.334

  No H/Q in entry =          13
  In of MODEL   64
    1    H    GLU  89           H        GLU  89   2.478   3.369   9.624
    2    HA   GLU  89           HA       GLU  89   3.714   4.282  11.972
    3    HB2  GLU  89           HB2      GLU  89   4.404   2.265  10.643
    4    HB3  GLU  89           HB3      GLU  89   5.176   3.361   9.496
    5    HG2  GLU  89           HG2      GLU  89   6.639   4.233  11.247
    6    HG3  GLU  89           HG3      GLU  89   5.806   3.273  12.465

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LEU  90           H        LEU  90   4.042   5.427   8.641
    2    HA   LEU  90           HA       LEU  90   5.946   7.452   9.230
    3    HB2  LEU  90           HB2      LEU  90   3.960   7.087   6.990
    4    HB3  LEU  90           HB3      LEU  90   5.176   8.371   7.014
    5    HG   LEU  90           HG       LEU  90   5.880   5.444   7.367
    6   HD12  LEU  90          HD11      LEU  90   6.643   5.674   4.932
    7   HD11  LEU  90          HD12      LEU  90   5.612   7.103   4.869
    8   HD13  LEU  90          HD13      LEU  90   4.907   5.524   5.215
    9   HD22  LEU  90          HD21      LEU  90   7.759   6.618   8.057
   10   HD21  LEU  90          HD22      LEU  90   7.401   8.014   7.040
   11   HD23  LEU  90          HD23      LEU  90   8.082   6.553   6.325

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  91           H        ILE  91   2.408   7.426   9.056
    2    HA   ILE  91           HA       ILE  91   2.031  10.197   9.491
    3    HB   ILE  91           HB       ILE  91   0.264   7.804  10.032
    4   HG12  ILE  91          HG12      ILE  91   0.003  10.072   8.034
    5   HG13  ILE  91          HG13      ILE  91   0.883   8.586   7.676
    6   HG22  ILE  91          HG21      ILE  91  -1.493   9.842  10.073
    7   HG21  ILE  91          HG22      ILE  91  -0.106  10.692  10.752
    8   HG23  ILE  91          HG23      ILE  91  -0.732   9.251  11.551
    9   HD13  ILE  91          HD11      ILE  91  -1.046   7.276   7.713
   10   HD12  ILE  91          HD12      ILE  91  -1.648   8.781   7.020
   11   HD11  ILE  91          HD13      ILE  91  -1.927   8.422   8.724

  No H/Q in entry =          11
  In of MODEL   64
    1    H    THR  92           H        THR  92   2.451   7.471  11.709
    2    HA   THR  92           HA       THR  92   1.973   8.852  14.122
    3    HB   THR  92           HB       THR  92   3.814   6.535  13.482
    4    HG1  THR  92           HG1      THR  92   1.855   5.754  13.371
    5   HG22  THR  92          HG21      THR  92   3.415   6.260  16.115
    6   HG21  THR  92          HG22      THR  92   3.330   8.018  16.032
    7   HG23  THR  92          HG23      THR  92   4.777   7.176  15.474

  No H/Q in entry =           7
  In of MODEL   64
    1    H    GLU  93           H        GLU  93   4.944   8.429  12.212
    2    HA   GLU  93           HA       GLU  93   6.667   9.886  13.915
    3    HB2  GLU  93           HB2      GLU  93   6.782   9.557  10.902
    4    HB3  GLU  93           HB3      GLU  93   8.108  10.109  11.923
    5    HG2  GLU  93           HG2      GLU  93   6.728   7.457  12.374
    6    HG3  GLU  93           HG3      GLU  93   8.118   7.621  11.307

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LEU  94           H        LEU  94   4.626  10.861  11.182
    2    HA   LEU  94           HA       LEU  94   5.398  13.575  11.073
    3    HB2  LEU  94           HB2      LEU  94   2.831  12.173  10.307
    4    HB3  LEU  94           HB3      LEU  94   3.069  13.902  10.059
    5    HG   LEU  94           HG       LEU  94   5.119  11.935   9.034
    6   HD11  LEU  94          HD11      LEU  94   2.379  12.445   7.948
    7   HD13  LEU  94          HD12      LEU  94   3.381  11.000   7.838
    8   HD12  LEU  94          HD13      LEU  94   3.706  12.379   6.789
    9   HD23  LEU  94          HD21      LEU  94   5.359  13.765   7.303
   10   HD22  LEU  94          HD22      LEU  94   5.755  14.271   8.946
   11   HD21  LEU  94          HD23      LEU  94   4.203  14.716   8.233

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  95           H        ILE  95   2.867  11.935  12.954
    2    HA   ILE  95           HA       ILE  95   1.785  14.277  14.129
    3    HB   ILE  95           HB       ILE  95   1.833  11.401  15.069
    4   HG12  ILE  95          HG12      ILE  95  -0.403  13.139  13.994
    5   HG13  ILE  95          HG13      ILE  95   0.575  12.087  12.974
    6   HG21  ILE  95          HG21      ILE  95   0.509  13.862  16.248
    7   HG23  ILE  95          HG22      ILE  95   1.567  12.712  17.066
    8   HG22  ILE  95          HG23      ILE  95  -0.059  12.226  16.581
    9   HD13  ILE  95          HD11      ILE  95  -0.309  10.142  13.897
   10   HD12  ILE  95          HD12      ILE  95  -1.706  11.213  13.957
   11   HD11  ILE  95          HD13      ILE  95  -0.748  10.935  15.411

  No H/Q in entry =          11
  In of MODEL   64
    1    H    GLU  96           H        GLU  96   4.402  12.098  15.156
    2    HA   GLU  96           HA       GLU  96   4.922  13.317  17.645
    3    HB2  GLU  96           HB2      GLU  96   5.904  11.168  17.016
    4    HB3  GLU  96           HB3      GLU  96   6.836  11.947  15.739
    5    HG2  GLU  96           HG2      GLU  96   8.466  12.526  17.211
    6    HG3  GLU  96           HG3      GLU  96   7.300  13.329  18.253

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LEU  97           H        LEU  97   6.011  14.087  14.363
    2    HA   LEU  97           HA       LEU  97   7.864  16.113  15.079
    3    HB2  LEU  97           HB2      LEU  97   6.299  15.528  12.574
    4    HB3  LEU  97           HB3      LEU  97   7.297  16.974  12.696
    5    HG   LEU  97           HG       LEU  97   8.361  14.194  13.279
    6   HD12  LEU  97          HD11      LEU  97   9.372  14.390  10.968
    7   HD11  LEU  97          HD12      LEU  97   8.304  15.764  10.689
    8   HD13  LEU  97          HD13      LEU  97   7.625  14.164  10.987
    9   HD23  LEU  97          HD21      LEU  97  10.518  15.500  12.546
   10   HD22  LEU  97          HD22      LEU  97   9.882  15.769  14.168
   11   HD21  LEU  97          HD23      LEU  97   9.561  16.941  12.891

  No H/Q in entry =          11
  In of MODEL   64
    1    H    HIS  98           H        HIS  98   4.376  16.195  14.397
    2    HA   HIS  98           HA       HIS  98   4.036  18.991  14.515
    3    HB2  HIS  98           HB2      HIS  98   2.172  16.718  15.239
    4    HB3  HIS  98           HB3      HIS  98   1.681  18.412  15.282
    5    HD1  HIS  98           HD1      HIS  98   2.759  15.699  12.899
    6    HD2  HIS  98           HD2      HIS  98   1.328  19.611  12.745
    7    HE1  HIS  98           HE1      HIS  98   2.212  16.167  10.469
    8    HE2  HIS  98           HE2      HIS  98   1.344  18.543  10.354

  No H/Q in entry =           8
  In of MODEL   64
    1    H    GLU  99           H        GLU  99   4.185  16.518  17.028
    2    HA   GLU  99           HA       GLU  99   3.536  18.215  19.212
    3    HB2  GLU  99           HB2      GLU  99   3.482  15.732  19.322
    4    HB3  GLU  99           HB3      GLU  99   5.243  15.712  19.227
    5    HG2  GLU  99           HG2      GLU  99   5.397  17.018  21.296
    6    HG3  GLU  99           HG3      GLU  99   3.642  17.134  21.377

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LYS 100           H        LYS 100   6.615  17.320  17.676
    2    HA   LYS 100           HA       LYS 100   8.235  18.754  19.537
    3    HB2  LYS 100           HB2      LYS 100   8.769  17.822  16.707
    4    HB3  LYS 100           HB3      LYS 100   9.980  18.614  17.721
    5    HG2  LYS 100           HG2      LYS 100   9.615  16.867  19.468
    6    HG3  LYS 100           HG3      LYS 100   8.503  16.042  18.373
    7    HD2  LYS 100           HD2      LYS 100  10.314  15.776  16.721
    8    HD3  LYS 100           HD3      LYS 100  11.431  16.614  17.801
    9    HE2  LYS 100           HE2      LYS 100  11.047  14.862  19.526
   10    HE3  LYS 100           HE3      LYS 100   9.992  14.005  18.397
   11    HZ1  LYS 100           HZ1      LYS 100  12.808  14.711  17.759
   12    HZ3  LYS 100           HZ2      LYS 100  11.786  13.637  16.929
   13    HZ2  LYS 100           HZ3      LYS 100  12.368  13.234  18.474

  No H/Q in entry =          13
  In of MODEL   64
    1    H    LEU 101           H        LEU 101   6.551  19.641  16.564
    2    HA   LEU 101           HA       LEU 101   7.731  22.213  16.225
    3    HB2  LEU 101           HB2      LEU 101   5.161  20.938  15.325
    4    HB3  LEU 101           HB3      LEU 101   5.389  22.671  15.110
    5    HG   LEU 101           HG       LEU 101   7.460  20.679  14.171
    6   HD12  LEU 101          HD11      LEU 101   6.318  21.157  11.874
    7   HD11  LEU 101          HD12      LEU 101   4.905  21.572  12.842
    8   HD13  LEU 101          HD13      LEU 101   5.591  19.952  12.937
    9   HD21  LEU 101          HD21      LEU 101   6.796  23.580  13.595
   10   HD23  LEU 101          HD22      LEU 101   7.798  22.628  12.501
   11   HD22  LEU 101          HD23      LEU 101   8.324  22.902  14.161

  No H/Q in entry =          11
  In of MODEL   64
    1    H    LYS 102           H        LYS 102   6.191  21.067  18.835
    2    HA   LYS 102           HA       LYS 102   5.528  22.160  20.756
    3    HB2  LYS 102           HB2      LYS 102   6.791  24.162  19.631
    4    HB3  LYS 102           HB3      LYS 102   5.187  24.742  19.240
    5    HG2  LYS 102           HG2      LYS 102   6.547  24.519  21.904
    6    HG3  LYS 102           HG3      LYS 102   5.581  25.831  21.261
    7    HD2  LYS 102           HD2      LYS 102   4.368  23.182  22.144
    8    HD3  LYS 102           HD3      LYS 102   4.589  24.552  23.222
    9    HE2  LYS 102           HE2      LYS 102   2.327  24.110  21.719
   10    HE3  LYS 102           HE3      LYS 102   2.803  25.666  22.396
   11    HZ2  LYS 102           HZ1      LYS 102   2.289  25.754  20.012
   12    HZ1  LYS 102           HZ2      LYS 102   3.568  24.688  19.704
   13    HZ3  LYS 102           HZ3      LYS 102   3.885  26.227  20.342

  No H/Q in entry =          13
  In of MODEL   64
    1    H    ALA 103           H        ALA 103   3.890  23.665  17.969
    2    HA   ALA 103           HA       ALA 103   1.422  24.212  18.832
    3    HB1  ALA 103           HB1      ALA 103   0.552  23.347  16.588
    4    HB2  ALA 103           HB2      ALA 103   2.209  22.831  16.273
    5    HB3  ALA 103           HB3      ALA 103   1.849  24.540  16.528

  No H/Q in entry =           5
  In of MODEL   64
    1    H1   ALA   1           H3       ALA   1  10.825 -20.292  -6.147
    2    H2   ALA   1           H2       ALA   1   9.874 -20.518  -7.539
    3    H3   ALA   1           H1       ALA   1   9.436 -21.263  -6.075
    4    HA   ALA   1           HA       ALA   1  10.505 -23.061  -6.797
    5    HB1  ALA   1           HB1      ALA   1  10.612 -22.712  -9.074
    6    HB2  ALA   1           HB2      ALA   1  12.335 -22.537  -8.733
    7    HB3  ALA   1           HB3      ALA   1  11.319 -21.104  -8.899

  No H/Q in entry =           7
  In of MODEL   64
    1    H    GLU   2           H        GLU   2  12.801 -23.982  -6.834
    2    HA   GLU   2           HA       GLU   2  14.165 -23.871  -4.613
    3    HB2  GLU   2           HB2      GLU   2  15.539 -23.735  -7.302
    4    HB3  GLU   2           HB3      GLU   2  16.264 -24.329  -5.809
    5    HG2  GLU   2           HG2      GLU   2  15.276 -26.360  -6.047
    6    HG3  GLU   2           HG3      GLU   2  13.697 -25.637  -6.321

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLU   3           H        GLU   3  15.929 -21.995  -7.011
    2    HA   GLU   3           HA       GLU   3  17.046 -20.284  -5.051
    3    HB2  GLU   3           HB2      GLU   3  17.012 -20.297  -8.062
    4    HB3  GLU   3           HB3      GLU   3  17.734 -18.954  -7.176
    5    HG2  GLU   3           HG2      GLU   3  19.408 -20.302  -6.234
    6    HG3  GLU   3           HG3      GLU   3  18.482 -21.782  -6.454

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LEU   4           H        LEU   4  14.773 -19.478  -7.703
    2    HA   LEU   4           HA       LEU   4  14.268 -16.873  -7.108
    3    HB2  LEU   4           HB2      LEU   4  12.124 -18.879  -7.844
    4    HB3  LEU   4           HB3      LEU   4  12.028 -17.132  -8.052
    5    HG   LEU   4           HG       LEU   4  14.026 -18.977  -9.401
    6   HD13  LEU   4          HD11      LEU   4  12.736 -18.854 -11.321
    7   HD12  LEU   4          HD12      LEU   4  12.005 -17.316 -10.867
    8   HD11  LEU   4          HD13      LEU   4  11.465 -18.810 -10.102
    9   HD23  LEU   4          HD21      LEU   4  14.343 -16.734 -10.762
   10   HD22  LEU   4          HD22      LEU   4  15.195 -16.958  -9.235
   11   HD21  LEU   4          HD23      LEU   4  13.730 -15.981  -9.289

  No H/Q in entry =          11
  In of MODEL   64
    1    H    GLU   5           H        GLU   5  12.807 -19.668  -5.462
    2    HA   GLU   5           HA       GLU   5  11.098 -18.109  -3.779
    3    HB2  GLU   5           HB2      GLU   5  10.713 -20.499  -4.295
    4    HB3  GLU   5           HB3      GLU   5  12.140 -20.907  -3.341
    5    HG2  GLU   5           HG2      GLU   5  11.131 -19.887  -1.353
    6    HG3  GLU   5           HG3      GLU   5   9.718 -19.417  -2.297

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLU   6           H        GLU   6  14.261 -19.646  -3.306
    2    HA   GLU   6           HA       GLU   6  14.583 -18.772  -0.610
    3    HB2  GLU   6           HB2      GLU   6  15.840 -20.676  -1.590
    4    HB3  GLU   6           HB3      GLU   6  16.702 -19.542  -2.634
    5    HG2  GLU   6           HG2      GLU   6  17.596 -18.380  -0.666
    6    HG3  GLU   6           HG3      GLU   6  16.702 -19.466   0.398

  No H/Q in entry =           6
  In of MODEL   64
    1    H    VAL   7           H        VAL   7  15.354 -17.451  -3.761
    2    HA   VAL   7           HA       VAL   7  17.005 -15.298  -2.895
    3    HB   VAL   7           HB       VAL   7  15.322 -15.696  -5.382
    4   HG11  VAL   7          HG11      VAL   7  17.180 -13.454  -4.568
    5   HG13  VAL   7          HG12      VAL   7  15.541 -13.336  -5.204
    6   HG12  VAL   7          HG13      VAL   7  16.864 -13.827  -6.262
    7   HG21  VAL   7          HG21      VAL   7  17.444 -17.122  -4.791
    8   HG23  VAL   7          HG22      VAL   7  18.333 -15.651  -5.190
    9   HG22  VAL   7          HG23      VAL   7  17.315 -16.420  -6.405

  No H/Q in entry =           9
  In of MODEL   64
    1    H    VAL   8           H        VAL   8  13.521 -15.617  -3.475
    2    HA   VAL   8           HA       VAL   8  12.815 -12.916  -3.022
    3    HB   VAL   8           HB       VAL   8  11.235 -15.464  -2.587
    4   HG12  VAL   8          HG11      VAL   8   9.307 -13.682  -2.864
    5   HG11  VAL   8          HG12      VAL   8  10.532 -12.559  -2.274
    6   HG13  VAL   8          HG13      VAL   8  10.051 -13.937  -1.286
    7   HG22  VAL   8          HG21      VAL   8  10.647 -15.331  -4.813
    8   HG21  VAL   8          HG22      VAL   8  12.122 -14.377  -4.951
    9   HG23  VAL   8          HG23      VAL   8  10.567 -13.569  -4.782

  No H/Q in entry =           9
  In of MODEL   64
    1    H    MET   9           H        MET   9  13.105 -15.707  -0.826
    2    HA   MET   9           HA       MET   9  12.255 -14.435   1.532
    3    HB2  MET   9           HB2      MET   9  14.193 -16.687   1.015
    4    HB3  MET   9           HB3      MET   9  13.881 -16.101   2.649
    5    HG2  MET   9           HG2      MET   9  11.351 -16.368   1.919
    6    HG3  MET   9           HG3      MET   9  12.033 -17.503   0.752
    7    HE1  MET   9           HE1      MET   9  14.176 -18.821   1.576
    8    HE3  MET   9           HE2      MET   9  14.202 -19.768   3.062
    9    HE2  MET   9           HE3      MET   9  14.721 -18.085   3.088

  No H/Q in entry =           9
  In of MODEL   64
    1    H    GLY  10           H        GLY  10  15.450 -14.622  -0.001
    2    HA3  GLY  10           HA2      GLY  10  16.875 -13.171   1.972
    3    HA2  GLY  10           HA3      GLY  10  17.352 -13.339   0.283

  No H/Q in entry =           3
  In of MODEL   64
    1    H    LEU  11           H        LEU  11  15.176 -12.155  -0.978
    2    HA   LEU  11           HA       LEU  11  15.820  -9.399  -0.823
    3    HB2  LEU  11           HB2      LEU  11  13.482 -10.849  -2.068
    4    HB3  LEU  11           HB3      LEU  11  13.739  -9.112  -2.235
    5    HG   LEU  11           HG       LEU  11  15.802 -11.195  -2.997
    6   HD13  LEU  11          HD11      LEU  11  14.073 -11.594  -4.528
    7   HD12  LEU  11          HD12      LEU  11  15.064 -10.403  -5.367
    8   HD11  LEU  11          HD13      LEU  11  13.578  -9.901  -4.562
    9   HD22  LEU  11          HD21      LEU  11  17.003  -9.212  -2.773
   10   HD21  LEU  11          HD22      LEU  11  15.616  -8.198  -3.167
   11   HD23  LEU  11          HD23      LEU  11  16.469  -9.060  -4.445

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  12           H        ILE  12  13.069 -11.259   0.433
    2    HA   ILE  12           HA       ILE  12  11.636  -9.051   1.471
    3    HB   ILE  12           HB       ILE  12  11.711 -11.943   2.385
    4   HG12  ILE  12          HG12      ILE  12  10.961 -11.308  -0.016
    5   HG13  ILE  12          HG13      ILE  12   9.898 -12.341   0.920
    6   HG22  ILE  12          HG21      ILE  12   9.378 -11.314   3.295
    7   HG21  ILE  12          HG22      ILE  12   9.904  -9.638   3.147
    8   HG23  ILE  12          HG23      ILE  12  10.776 -10.746   4.207
    9   HD13  ILE  12          HD11      ILE  12   8.500 -10.417   1.467
   10   HD12  ILE  12          HD12      ILE  12   8.696 -10.527  -0.281
   11   HD11  ILE  12          HD13      ILE  12   9.612  -9.346   0.631

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  13           H        ILE  13  14.051 -11.212   2.906
    2    HA   ILE  13           HA       ILE  13  14.050 -10.020   5.480
    3    HB   ILE  13           HB       ILE  13  16.148 -11.565   3.938
    4   HG12  ILE  13          HG12      ILE  13  13.859 -12.540   4.795
    5   HG13  ILE  13          HG13      ILE  13  15.344 -13.465   5.001
    6   HG22  ILE  13          HG21      ILE  13  17.167 -11.898   6.282
    7   HG21  ILE  13          HG22      ILE  13  16.228 -10.494   6.769
    8   HG23  ILE  13          HG23      ILE  13  17.450 -10.341   5.506
    9   HD12  ILE  13          HD11      ILE  13  13.839 -13.305   7.076
   10   HD11  ILE  13          HD12      ILE  13  14.279 -11.602   7.133
   11   HD13  ILE  13          HD13      ILE  13  15.521 -12.835   7.308

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ASN  14           H        ASN  14  16.016  -9.473   2.573
    2    HA   ASN  14           HA       ASN  14  17.721  -7.498   3.638
    3    HB2  ASN  14           HB2      ASN  14  17.736  -8.776   1.328
    4    HB3  ASN  14           HB3      ASN  14  16.824  -7.376   0.778
    5   HD21  ASN  14          HD21      ASN  14  19.279  -7.681  -0.388
    6   HD22  ASN  14          HD22      ASN  14  20.399  -6.576   0.242

  No H/Q in entry =           6
  In of MODEL   64
    1    H    SER  15           H        SER  15  14.618  -7.210   1.921
    2    HA   SER  15           HA       SER  15  14.458  -4.392   1.962
    3    HB2  SER  15           HB2      SER  15  12.133  -4.680   1.453
    4    HB3  SER  15           HB3      SER  15  12.959  -6.034   0.692
    5    HG   SER  15           HG       SER  15  12.436  -7.270   2.563

  No H/Q in entry =           5
  In of MODEL   64
    1    H    GLY  16           H        GLY  16  13.389  -6.858   4.270
    2    HA3  GLY  16           HA2      GLY  16  12.124  -5.121   6.109
    3    HA2  GLY  16           HA3      GLY  16  12.764  -6.717   6.484

  No H/Q in entry =           3
  In of MODEL   64
    1    H    GLN  17           H        GLN  17  15.473  -6.341   5.910
    2    HA   GLN  17           HA       GLN  17  16.391  -5.091   8.292
    3    HB2  GLN  17           HB2      GLN  17  17.656  -6.870   7.109
    4    HB3  GLN  17           HB3      GLN  17  17.963  -5.750   5.781
    5    HG2  GLN  17           HG2      GLN  17  19.893  -5.781   7.275
    6    HG3  GLN  17           HG3      GLN  17  19.096  -4.213   7.380
    7   HE21  GLN  17          HE21      GLN  17  19.958  -7.082   9.178
    8   HE22  GLN  17          HE22      GLN  17  19.288  -6.591  10.659

  No H/Q in entry =           8
  In of MODEL   64
    1    H    ALA  18           H        ALA  18  16.209  -4.034   4.925
    2    HA   ALA  18           HA       ALA  18  17.601  -1.616   5.150
    3    HB2  ALA  18           HB1      ALA  18  16.520  -2.860   3.081
    4    HB3  ALA  18           HB2      ALA  18  16.755  -1.112   3.058
    5    HB1  ALA  18           HB3      ALA  18  15.164  -1.784   3.419

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ARG  19           H        ARG  19  14.109  -2.263   5.524
    2    HA   ARG  19           HA       ARG  19  13.389   0.379   6.220
    3    HB2  ARG  19           HB2      ARG  19  11.744  -1.405   5.629
    4    HB3  ARG  19           HB3      ARG  19  12.088  -2.189   7.173
    5    HG2  ARG  19           HG2      ARG  19  11.333  -0.204   8.397
    6    HG3  ARG  19           HG3      ARG  19  11.079   0.660   6.882
    7    HD2  ARG  19           HD2      ARG  19   8.946  -0.170   7.690
    8    HD3  ARG  19           HD3      ARG  19   9.391  -1.049   6.221
    9    HE   ARG  19           HE       ARG  19  10.361  -2.564   8.342
   10   HH21  ARG  19          HH11      ARG  19   9.133  -4.221   9.279
   11   HH22  ARG  19          HH12      ARG  19   7.415  -4.225   9.095
   12   HH11  ARG  19          HH21      ARG  19   7.353  -1.330   7.217
   13   HH12  ARG  19          HH22      ARG  19   6.407  -2.588   7.923

  No H/Q in entry =          13
  In of MODEL   64
    1    H    SER  20           H        SER  20  14.282  -2.426   8.200
    2    HA   SER  20           HA       SER  20  13.959  -1.319  10.729
    3    HB2  SER  20           HB2      SER  20  14.467  -3.635  10.625
    4    HB3  SER  20           HB3      SER  20  15.920  -3.352   9.670
    5    HG   SER  20           HG       SER  20  16.754  -2.230  11.527

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LEU  21           H        LEU  21  16.818  -1.218   8.615
    2    HA   LEU  21           HA       LEU  21  18.452   0.306  10.358
    3    HB2  LEU  21           HB2      LEU  21  18.459   0.021   7.346
    4    HB3  LEU  21           HB3      LEU  21  19.693   0.903   8.242
    5    HG   LEU  21           HG       LEU  21  18.994  -1.997   8.784
    6   HD11  LEU  21          HD11      LEU  21  21.009  -0.737   6.925
    7   HD13  LEU  21          HD12      LEU  21  19.872  -2.044   6.594
    8   HD12  LEU  21          HD13      LEU  21  21.280  -2.340   7.612
    9   HD21  LEU  21          HD21      LEU  21  21.075  -0.063   9.788
   10   HD23  LEU  21          HD22      LEU  21  21.481  -1.774   9.710
   11   HD22  LEU  21          HD23      LEU  21  20.135  -1.238  10.702

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ALA  22           H        ALA  22  16.192   1.222   7.780
    2    HA   ALA  22           HA       ALA  22  16.682   3.990   7.784
    3    HB3  ALA  22           HB1      ALA  22  15.314   2.715   6.101
    4    HB2  ALA  22           HB2      ALA  22  14.577   4.217   6.655
    5    HB1  ALA  22           HB3      ALA  22  14.009   2.671   7.285

  No H/Q in entry =           5
  In of MODEL   64
    1    H    TYR  23           H        TYR  23  14.203   2.139   9.609
    2    HA   TYR  23           HA       TYR  23  13.190   4.367  11.039
    3    HB2  TYR  23           HB2      TYR  23  11.991   2.233  11.020
    4    HB3  TYR  23           HB3      TYR  23  13.330   1.448  11.858
    5    HD1  TYR  23           HD1      TYR  23  10.760   4.129  12.190
    6    HD2  TYR  23           HD2      TYR  23  13.527   1.544  14.216
    7    HE1  TYR  23           HE1      TYR  23   9.804   4.817  14.374
    8    HE2  TYR  23           HE2      TYR  23  12.571   2.231  16.399
    9    HH   TYR  23           HH       TYR  23   9.654   4.104  16.619

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ALA  24           H        ALA  24  15.869   2.140  11.708
    2    HA   ALA  24           HA       ALA  24  16.502   3.159  14.272
    3    HB1  ALA  24           HB1      ALA  24  17.890   1.389  14.127
    4    HB3  ALA  24           HB2      ALA  24  18.910   2.323  13.031
    5    HB2  ALA  24           HB3      ALA  24  17.638   1.289  12.385

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ALA  25           H        ALA  25  17.469   4.088  10.996
    2    HA   ALA  25           HA       ALA  25  19.376   6.059  11.647
    3    HB1  ALA  25           HB1      ALA  25  18.694   5.087   9.331
    4    HB3  ALA  25           HB2      ALA  25  19.166   6.784   9.419
    5    HB2  ALA  25           HB3      ALA  25  17.459   6.347   9.339

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LEU  26           H        LEU  26  15.861   6.227  11.257
    2    HA   LEU  26           HA       LEU  26  15.586   9.006  11.692
    3    HB2  LEU  26           HB2      LEU  26  13.753   7.735  10.756
    4    HB3  LEU  26           HB3      LEU  26  13.668   6.713  12.186
    5    HG   LEU  26           HG       LEU  26  13.019   8.667  13.551
    6   HD12  LEU  26          HD11      LEU  26  12.333  10.750  12.211
    7   HD11  LEU  26          HD12      LEU  26  13.335  10.107  10.912
    8   HD13  LEU  26          HD13      LEU  26  14.061  10.512  12.468
    9   HD21  LEU  26          HD21      LEU  26  11.368   8.314  11.030
   10   HD23  LEU  26          HD22      LEU  26  10.784   9.010  12.539
   11   HD22  LEU  26          HD23      LEU  26  11.265   7.316  12.481

  No H/Q in entry =          11
  In of MODEL   64
    1    H    LYS  27           H        LYS  27  15.506   6.236  13.898
    2    HA   LYS  27           HA       LYS  27  14.873   7.604  16.255
    3    HB2  LYS  27           HB2      LYS  27  14.943   5.128  16.003
    4    HB3  LYS  27           HB3      LYS  27  16.706   5.209  15.973
    5    HG2  LYS  27           HG2      LYS  27  16.722   6.206  18.218
    6    HG3  LYS  27           HG3      LYS  27  14.955   6.196  18.249
    7    HD2  LYS  27           HD2      LYS  27  14.971   3.728  18.025
    8    HD3  LYS  27           HD3      LYS  27  16.736   3.746  18.027
    9    HE2  LYS  27           HE2      LYS  27  16.736   4.746  20.279
   10    HE3  LYS  27           HE3      LYS  27  14.970   4.758  20.279
   11    HZ3  LYS  27           HZ1      LYS  27  15.780   2.824  21.446
   12    HZ2  LYS  27           HZ2      LYS  27  16.714   2.354  20.105
   13    HZ1  LYS  27           HZ3      LYS  27  15.017   2.331  20.012

  No H/Q in entry =          13
  In of MODEL   64
    1    H    GLN  28           H        GLN  28  18.011   7.063  14.690
    2    HA   GLN  28           HA       GLN  28  19.662   8.183  16.689
    3    HB2  GLN  28           HB2      GLN  28  19.975   8.131  13.676
    4    HB3  GLN  28           HB3      GLN  28  21.245   8.621  14.797
    5    HG2  GLN  28           HG2      GLN  28  19.861   5.924  14.827
    6    HG3  GLN  28           HG3      GLN  28  21.449   6.234  14.127
    7   HE21  GLN  28          HE21      GLN  28  20.152   4.911  16.818
    8   HE22  GLN  28          HE22      GLN  28  21.322   5.347  17.966

  No H/Q in entry =           8
  In of MODEL   64
    1    H    ALA  29           H        ALA  29  17.909   9.626  13.975
    2    HA   ALA  29           HA       ALA  29  18.865  12.262  14.223
    3    HB2  ALA  29           HB1      ALA  29  17.169  12.866  12.736
    4    HB1  ALA  29           HB2      ALA  29  16.038  11.679  13.384
    5    HB3  ALA  29           HB3      ALA  29  17.384  11.152  12.373

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LYS  30           H        LYS  30  16.101  10.629  15.730
    2    HA   LYS  30           HA       LYS  30  15.043  12.873  17.069
    3    HB2  LYS  30           HB2      LYS  30  14.969   9.934  17.786
    4    HB3  LYS  30           HB3      LYS  30  14.078  11.176  18.666
    5    HG2  LYS  30           HG2      LYS  30  12.960  11.835  16.536
    6    HG3  LYS  30           HG3      LYS  30  13.790  10.507  15.722
    7    HD2  LYS  30           HD2      LYS  30  12.730   8.891  17.250
    8    HD3  LYS  30           HD3      LYS  30  11.910  10.209  18.088
    9    HE2  LYS  30           HE2      LYS  30  10.749  10.814  15.983
   10    HE3  LYS  30           HE3      LYS  30  11.550   9.468  15.165
   11    HZ2  LYS  30           HZ1      LYS  30   9.241   9.029  16.029
   12    HZ1  LYS  30           HZ2      LYS  30   9.895   9.099  17.601
   13    HZ3  LYS  30           HZ3      LYS  30  10.429   7.917  16.501

  No H/Q in entry =          13
  In of MODEL   64
    1    H    GLN  31           H        GLN  31  17.729  10.746  17.837
    2    HA   GLN  31           HA       GLN  31  18.021  11.778  20.529
    3    HB2  GLN  31           HB2      GLN  31  20.079  10.229  18.947
    4    HB3  GLN  31           HB3      GLN  31  19.929  10.359  20.700
    5    HG2  GLN  31           HG2      GLN  31  17.435   9.368  19.916
    6    HG3  GLN  31           HG3      GLN  31  18.557   8.534  18.849
    7   HE21  GLN  31          HE21      GLN  31  17.013   7.377  21.119
    8   HE22  GLN  31          HE22      GLN  31  18.170   6.737  22.181

  No H/Q in entry =           8
  In of MODEL   64
    1    H    GLY  32           H        GLY  32  18.544  13.088  17.560
    2    HA3  GLY  32           HA2      GLY  32  19.503  15.145  17.044
    3    HA2  GLY  32           HA3      GLY  32  20.248  15.168  18.637

  No H/Q in entry =           3
  In of MODEL   64
    1    H    ASP  33           H        ASP  33  20.725  12.274  16.878
    2    HA   ASP  33           HA       ASP  33  23.544  12.988  16.430
    3    HB2  ASP  33           HB2      ASP  33  22.073  10.351  16.547
    4    HB3  ASP  33           HB3      ASP  33  23.761  10.489  16.065

  No H/Q in entry =           4
  In of MODEL   64
    1    H    PHE  34           H        PHE  34  23.059  14.295  14.539
    2    HA   PHE  34           HA       PHE  34  21.742  13.281  12.246
    3    HB2  PHE  34           HB2      PHE  34  23.840  15.446  12.482
    4    HB3  PHE  34           HB3      PHE  34  22.870  15.135  11.044
    5    HD1  PHE  34           HD1      PHE  34  23.070  17.086  13.950
    6    HD2  PHE  34           HD2      PHE  34  20.242  14.918  11.552
    7    HE1  PHE  34           HE1      PHE  34  21.226  18.462  14.876
    8    HE2  PHE  34           HE2      PHE  34  18.402  16.293  12.482
    9    HZ   PHE  34           HZ       PHE  34  18.898  18.066  14.139

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ALA  35           H        ALA  35  25.111  13.147  13.281
    2    HA   ALA  35           HA       ALA  35  26.247  12.331  10.836
    3    HB3  ALA  35           HB1      ALA  35  27.931  11.194  12.575
    4    HB2  ALA  35           HB2      ALA  35  27.044  12.212  13.709
    5    HB1  ALA  35           HB3      ALA  35  27.880  12.942  12.339

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ALA  36           H        ALA  36  25.139  10.372  13.602
    2    HA   ALA  36           HA       ALA  36  25.670   7.886  12.343
    3    HB2  ALA  36           HB1      ALA  36  25.235   7.143  14.418
    4    HB3  ALA  36           HB2      ALA  36  23.541   7.611  14.253
    5    HB1  ALA  36           HB3      ALA  36  24.720   8.764  14.879

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ALA  37           H        ALA  37  22.816   9.969  12.444
    2    HA   ALA  37           HA       ALA  37  20.996   8.166  11.263
    3    HB3  ALA  37           HB1      ALA  37  21.174  11.133  11.542
    4    HB1  ALA  37           HB2      ALA  37  19.875  10.037  12.010
    5    HB2  ALA  37           HB3      ALA  37  20.070  10.504  10.320

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LYS  38           H        LYS  38  23.069  10.652   9.788
    2    HA   LYS  38           HA       LYS  38  22.457  10.202   7.108
    3    HB2  LYS  38           HB2      LYS  38  24.231  11.794   8.560
    4    HB3  LYS  38           HB3      LYS  38  25.287  10.816   7.547
    5    HG2  LYS  38           HG2      LYS  38  24.126  11.559   5.538
    6    HG3  LYS  38           HG3      LYS  38  22.911  12.399   6.506
    7    HD2  LYS  38           HD2      LYS  38  24.475  14.026   7.262
    8    HD3  LYS  38           HD3      LYS  38  25.854  13.059   6.742
    9    HE2  LYS  38           HE2      LYS  38  25.480  14.917   5.179
   10    HE3  LYS  38           HE3      LYS  38  25.176  13.371   4.380
   11    HZ3  LYS  38           HZ1      LYS  38  22.973  13.780   4.230
   12    HZ2  LYS  38           HZ2      LYS  38  23.469  15.403   4.314
   13    HZ1  LYS  38           HZ3      LYS  38  22.897  14.617   5.706

  No H/Q in entry =          13
  In of MODEL   64
    1    H    ALA  39           H        ALA  39  24.981   8.654   9.091
    2    HA   ALA  39           HA       ALA  39  26.091   7.073   7.038
    3    HB2  ALA  39           HB1      ALA  39  25.996   6.122   9.885
    4    HB1  ALA  39           HB2      ALA  39  26.929   7.560   9.470
    5    HB3  ALA  39           HB3      ALA  39  27.311   6.012   8.716

  No H/Q in entry =           5
  In of MODEL   64
    1    H    MET  40           H        MET  40  23.471   6.426   9.319
    2    HA   MET  40           HA       MET  40  23.077   3.710   8.594
    3    HB2  MET  40           HB2      MET  40  21.218   5.730   9.862
    4    HB3  MET  40           HB3      MET  40  20.841   4.014   9.693
    5    HG2  MET  40           HG2      MET  40  23.364   5.003  11.049
    6    HG3  MET  40           HG3      MET  40  21.867   4.707  11.932
    7    HE3  MET  40           HE1      MET  40  21.362   1.066  12.121
    8    HE2  MET  40           HE2      MET  40  20.478   2.350  11.300
    9    HE1  MET  40           HE3      MET  40  21.202   2.657  12.877

  No H/Q in entry =           9
  In of MODEL   64
    1    H    MET  41           H        MET  41  21.623   6.734   7.381
    2    HA   MET  41           HA       MET  41  19.699   5.499   5.700
    3    HB2  MET  41           HB2      MET  41  21.141   8.111   5.186
    4    HB3  MET  41           HB3      MET  41  19.627   7.589   4.458
    5    HG2  MET  41           HG2      MET  41  18.864   7.400   7.004
    6    HG3  MET  41           HG3      MET  41  20.152   8.580   7.231
    7    HE2  MET  41           HE1      MET  41  19.594   9.843   3.884
    8    HE1  MET  41           HE2      MET  41  20.532  10.305   5.300
    9    HE3  MET  41           HE3      MET  41  19.246  11.360   4.721

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ASP  42           H        ASP  42  23.060   6.476   5.168
    2    HA   ASP  42           HA       ASP  42  23.181   5.990   2.414
    3    HB2  ASP  42           HB2      ASP  42  24.901   7.025   4.192
    4    HB3  ASP  42           HB3      ASP  42  25.587   5.410   4.077

  No H/Q in entry =           4
  In of MODEL   64
    1    H    GLN  43           H        GLN  43  23.920   3.861   5.150
    2    HA   GLN  43           HA       GLN  43  24.634   1.607   3.584
    3    HB2  GLN  43           HB2      GLN  43  23.587   1.787   6.418
    4    HB3  GLN  43           HB3      GLN  43  24.196   0.304   5.675
    5    HG2  GLN  43           HG2      GLN  43  26.343   1.549   5.175
    6    HG3  GLN  43           HG3      GLN  43  25.730   2.870   6.163
    7   HE21  GLN  43          HE21      GLN  43  27.971   1.940   7.222
    8   HE22  GLN  43          HE22      GLN  43  27.705   0.859   8.501

  No H/Q in entry =           8
  In of MODEL   64
    1    H    SER  44           H        SER  44  21.549   2.696   4.940
    2    HA   SER  44           HA       SER  44  20.023   0.423   4.266
    3    HB2  SER  44           HB2      SER  44  19.531   2.950   5.396
    4    HB3  SER  44           HB3      SER  44  18.508   2.883   3.963
    5    HG   SER  44           HG       SER  44  17.417   1.929   5.682

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ARG  45           H        ARG  45  20.730   3.392   2.453
    2    HA   ARG  45           HA       ARG  45  19.231   2.869   0.139
    3    HB2  ARG  45           HB2      ARG  45  20.335   5.027   0.721
    4    HB3  ARG  45           HB3      ARG  45  21.895   4.296   0.351
    5    HG2  ARG  45           HG2      ARG  45  21.136   3.867  -1.967
    6    HG3  ARG  45           HG3      ARG  45  19.588   4.621  -1.596
    7    HD2  ARG  45           HD2      ARG  45  20.799   6.741  -1.012
    8    HD3  ARG  45           HD3      ARG  45  22.312   5.989  -1.566
    9    HE   ARG  45           HE       ARG  45  20.401   5.710  -3.615
   10   HH21  ARG  45          HH11      ARG  45  20.385   7.070  -5.385
   11   HH22  ARG  45          HH12      ARG  45  21.116   8.634  -5.283
   12   HH11  ARG  45          HH21      ARG  45  22.078   8.244  -1.988
   13   HH12  ARG  45          HH22      ARG  45  22.073   9.297  -3.356

  No H/Q in entry =          13
  In of MODEL   64
    1    H    MET  46           H        MET  46  22.603   2.054   0.915
    2    HA   MET  46           HA       MET  46  23.247   0.859  -1.558
    3    HB2  MET  46           HB2      MET  46  24.338   0.569   1.241
    4    HB3  MET  46           HB3      MET  46  25.017  -0.327  -0.122
    5    HG2  MET  46           HG2      MET  46  25.442   1.774  -1.321
    6    HG3  MET  46           HG3      MET  46  24.710   2.690  -0.009
    7    HE2  MET  46           HE1      MET  46  28.671   0.656  -0.420
    8    HE1  MET  46           HE2      MET  46  27.122   0.228  -1.140
    9    HE3  MET  46           HE3      MET  46  27.574  -0.447   0.423

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ALA  47           H        ALA  47  21.864  -0.482   1.414
    2    HA   ALA  47           HA       ALA  47  21.859  -3.199   0.625
    3    HB2  ALA  47           HB1      ALA  47  21.457  -2.733   2.924
    4    HB3  ALA  47           HB2      ALA  47  19.934  -3.363   2.297
    5    HB1  ALA  47           HB3      ALA  47  20.134  -1.628   2.548

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LEU  48           H        LEU  48  19.468  -0.611   0.238
    2    HA   LEU  48           HA       LEU  48  17.456  -2.183  -1.019
    3    HB2  LEU  48           HB2      LEU  48  18.065   0.781  -1.144
    4    HB3  LEU  48           HB3      LEU  48  16.610   0.044  -1.818
    5    HG   LEU  48           HG       LEU  48  17.448  -0.230   1.078
    6   HD13  LEU  48          HD11      LEU  48  16.996   2.063   0.877
    7   HD12  LEU  48          HD12      LEU  48  15.444   1.394   1.379
    8   HD11  LEU  48          HD13      LEU  48  15.721   1.812  -0.313
    9   HD22  LEU  48          HD21      LEU  48  15.949  -1.969   0.696
   10   HD21  LEU  48          HD22      LEU  48  15.070  -1.086  -0.553
   11   HD23  LEU  48          HD23      LEU  48  14.839  -0.677   1.147

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ASN  49           H        ASN  49  20.123  -0.219  -2.242
    2    HA   ASN  49           HA       ASN  49  19.491  -0.327  -4.969
    3    HB2  ASN  49           HB2      ASN  49  21.139   1.222  -4.056
    4    HB3  ASN  49           HB3      ASN  49  22.182  -0.115  -3.588
    5   HD21  ASN  49          HD21      ASN  49  21.829   2.200  -5.925
    6   HD22  ASN  49          HD22      ASN  49  22.609   1.422  -7.215

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLU  50           H        GLU  50  21.496  -2.481  -2.982
    2    HA   GLU  50           HA       GLU  50  22.238  -4.237  -5.094
    3    HB2  GLU  50           HB2      GLU  50  23.421  -4.182  -2.920
    4    HB3  GLU  50           HB3      GLU  50  21.982  -4.828  -2.131
    5    HG2  GLU  50           HG2      GLU  50  22.112  -6.866  -3.478
    6    HG3  GLU  50           HG3      GLU  50  23.484  -6.218  -4.373

  No H/Q in entry =           6
  In of MODEL   64
    1    H    ALA  51           H        ALA  51  19.565  -4.199  -2.786
    2    HA   ALA  51           HA       ALA  51  18.442  -6.694  -3.537
    3    HB3  ALA  51           HB1      ALA  51  16.832  -6.204  -1.995
    4    HB1  ALA  51           HB2      ALA  51  16.598  -4.564  -2.604
    5    HB2  ALA  51           HB3      ALA  51  17.956  -4.924  -1.537

  No H/Q in entry =           5
  In of MODEL   64
    1    H    HIS  52           H        HIS  52  17.812  -3.361  -4.594
    2    HA   HIS  52           HA       HIS  52  15.719  -3.929  -6.404
    3    HB2  HIS  52           HB2      HIS  52  16.285  -1.650  -5.634
    4    HB3  HIS  52           HB3      HIS  52  17.793  -1.726  -6.544
    5    HD1  HIS  52           HD1      HIS  52  17.589  -1.821  -9.181
    6    HD2  HIS  52           HD2      HIS  52  13.999  -1.113  -7.184
    7    HE1  HIS  52           HE1      HIS  52  15.949  -1.000 -10.927
    8    HE2  HIS  52           HE2      HIS  52  13.755  -0.563  -9.725

  No H/Q in entry =           8
  In of MODEL   64
    1    H    LEU  53           H        LEU  53  19.240  -3.883  -6.815
    2    HA   LEU  53           HA       LEU  53  19.319  -4.213  -9.613
    3    HB2  LEU  53           HB2      LEU  53  21.251  -4.939  -7.423
    4    HB3  LEU  53           HB3      LEU  53  21.583  -5.320  -9.111
    5    HG   LEU  53           HG       LEU  53  20.861  -2.522  -8.187
    6   HD13  LEU  53          HD11      LEU  53  23.247  -2.017  -8.191
    7   HD12  LEU  53          HD12      LEU  53  23.625  -3.675  -8.656
    8   HD11  LEU  53          HD13      LEU  53  22.941  -3.340  -7.070
    9   HD21  LEU  53          HD21      LEU  53  21.972  -3.734 -10.724
   10   HD23  LEU  53          HD22      LEU  53  22.275  -2.046 -10.330
   11   HD22  LEU  53          HD23      LEU  53  20.629  -2.610 -10.557

  No H/Q in entry =          11
  In of MODEL   64
    1    H    VAL  54           H        VAL  54  19.227  -6.587  -6.974
    2    HA   VAL  54           HA       VAL  54  19.396  -8.888  -8.620
    3    HB   VAL  54           HB       VAL  54  18.218  -8.467  -5.863
    4   HG12  VAL  54          HG11      VAL  54  18.582 -11.080  -5.841
    5   HG11  VAL  54          HG12      VAL  54  18.406 -10.924  -7.589
    6   HG13  VAL  54          HG13      VAL  54  17.102 -10.407  -6.522
    7   HG22  VAL  54          HG21      VAL  54  20.528  -8.219  -5.626
    8   HG21  VAL  54          HG22      VAL  54  20.891  -9.313  -6.959
    9   HG23  VAL  54          HG23      VAL  54  20.361  -9.960  -5.406

  No H/Q in entry =           9
  In of MODEL   64
    1    H    GLN  55           H        GLN  55  16.630  -7.021  -7.366
    2    HA   GLN  55           HA       GLN  55  14.643  -8.723  -8.443
    3    HB2  GLN  55           HB2      GLN  55  13.860  -7.200  -6.829
    4    HB3  GLN  55           HB3      GLN  55  14.636  -5.824  -7.608
    5    HG2  GLN  55           HG2      GLN  55  12.916  -5.536  -9.111
    6    HG3  GLN  55           HG3      GLN  55  12.623  -7.262  -9.273
    7   HE21  GLN  55          HE21      GLN  55  10.620  -7.838  -8.477
    8   HE22  GLN  55          HE22      GLN  55   9.826  -7.089  -7.178

  No H/Q in entry =           8
  In of MODEL   64
    1    H    THR  56           H        THR  56  16.346  -5.904  -9.807
    2    HA   THR  56           HA       THR  56  14.917  -5.578 -12.167
    3    HB   THR  56           HB       THR  56  17.933  -5.440 -11.982
    4    HG1  THR  56           HG1      THR  56  16.035  -4.081 -10.648
    5   HG23  THR  56          HG21      THR  56  17.819  -4.004 -13.823
    6   HG22  THR  56          HG22      THR  56  16.124  -3.613 -13.535
    7   HG21  THR  56          HG23      THR  56  16.565  -5.187 -14.199

  No H/Q in entry =           7
  In of MODEL   64
    1    H    LYS  57           H        LYS  57  17.600  -7.829 -11.525
    2    HA   LYS  57           HA       LYS  57  17.636  -9.038 -14.097
    3    HB2  LYS  57           HB2      LYS  57  19.443  -9.277 -12.408
    4    HB3  LYS  57           HB3      LYS  57  18.350 -10.190 -11.378
    5    HG2  LYS  57           HG2      LYS  57  19.731 -11.775 -12.543
    6    HG3  LYS  57           HG3      LYS  57  18.116 -11.876 -13.236
    7    HD2  LYS  57           HD2      LYS  57  18.762 -10.658 -15.181
    8    HD3  LYS  57           HD3      LYS  57  20.276 -10.134 -14.445
    9    HE2  LYS  57           HE2      LYS  57  21.115 -12.441 -14.449
   10    HE3  LYS  57           HE3      LYS  57  19.588 -13.026 -15.107
   11    HZ2  LYS  57           HZ1      LYS  57  21.579 -11.275 -16.416
   12    HZ1  LYS  57           HZ2      LYS  57  20.001 -11.465 -17.009
   13    HZ3  LYS  57           HZ3      LYS  57  21.041 -12.803 -16.914

  No H/Q in entry =          13
  In of MODEL   64
    1    H    LEU  58           H        LEU  58  15.848  -9.717 -11.128
    2    HA   LEU  58           HA       LEU  58  14.671 -12.116 -12.056
    3    HB2  LEU  58           HB2      LEU  58  13.831 -10.211  -9.877
    4    HB3  LEU  58           HB3      LEU  58  13.052 -11.764 -10.189
    5    HG   LEU  58           HG       LEU  58  16.017 -11.433  -9.618
    6   HD11  LEU  58          HD11      LEU  58  13.642 -11.879  -7.837
    7   HD13  LEU  58          HD12      LEU  58  15.077 -10.891  -7.571
    8   HD12  LEU  58          HD13      LEU  58  15.178 -12.644  -7.425
    9   HD22  LEU  58          HD21      LEU  58  15.940 -13.503 -10.634
   10   HD21  LEU  58          HD22      LEU  58  14.227 -13.739 -10.282
   11   HD23  LEU  58          HD23      LEU  58  15.433 -14.012  -9.024

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  59           H        ILE  59  13.949  -8.795 -12.763
    2    HA   ILE  59           HA       ILE  59  11.251  -9.494 -13.715
    3    HB   ILE  59           HB       ILE  59  12.008  -7.192 -12.519
    4   HG12  ILE  59          HG12      ILE  59  10.120  -7.113 -14.882
    5   HG13  ILE  59          HG13      ILE  59   9.701  -7.882 -13.373
    6   HG22  ILE  59          HG21      ILE  59  12.104  -6.395 -15.415
    7   HG21  ILE  59          HG22      ILE  59  13.577  -6.785 -14.557
    8   HG23  ILE  59          HG23      ILE  59  12.560  -5.454 -14.016
    9   HD11  ILE  59          HD11      ILE  59  10.262  -5.721 -12.196
   10   HD13  ILE  59          HD12      ILE  59   8.858  -5.634 -13.259
   11   HD12  ILE  59          HD13      ILE  59  10.409  -4.981 -13.791

  No H/Q in entry =          11
  In of MODEL   64
    1    H    GLU  60           H        GLU  60  14.448  -8.596 -14.959
    2    HA   GLU  60           HA       GLU  60  13.678  -8.225 -17.675
    3    HB2  GLU  60           HB2      GLU  60  15.843  -7.461 -16.784
    4    HB3  GLU  60           HB3      GLU  60  16.331  -9.132 -16.524
    5    HG2  GLU  60           HG2      GLU  60  16.134  -9.571 -18.950
    6    HG3  GLU  60           HG3      GLU  60  15.655  -7.894 -19.210

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLY  61           H        GLY  61  14.692 -11.079 -15.836
    2    HA3  GLY  61           HA2      GLY  61  14.193 -12.750 -18.231
    3    HA2  GLY  61           HA3      GLY  61  15.225 -13.206 -16.880

  No H/Q in entry =           3
  In of MODEL   64
    1    H    ASP  62           H        ASP  62  12.078 -11.709 -16.534
    2    HA   ASP  62           HA       ASP  62  11.175 -13.767 -14.773
    3    HB2  ASP  62           HB2      ASP  62   9.063 -12.448 -14.778
    4    HB3  ASP  62           HB3      ASP  62  10.489 -11.486 -14.401

  No H/Q in entry =           4
  In of MODEL   64
    1    H    ALA  63           H        ALA  63  10.442 -12.963 -18.178
    2    HA   ALA  63           HA       ALA  63   8.248 -14.732 -18.521
    3    HB1  ALA  63           HB1      ALA  63  10.302 -13.955 -20.605
    4    HB3  ALA  63           HB2      ALA  63   8.950 -12.931 -20.126
    5    HB2  ALA  63           HB3      ALA  63   8.646 -14.488 -20.893

  No H/Q in entry =           5
  In of MODEL   64
    1    H    GLY  64           H        GLY  64  11.733 -15.155 -18.834
    2    HA3  GLY  64           HA2      GLY  64  13.058 -17.004 -19.140
    3    HA2  GLY  64           HA3      GLY  64  11.886 -17.814 -18.109

  No H/Q in entry =           3
  In of MODEL   64
    1    H    GLU  65           H        GLU  65  10.513 -19.314 -18.998
    2    HA   GLU  65           HA       GLU  65  11.166 -20.493 -21.430
    3    HB2  GLU  65           HB2      GLU  65   8.584 -20.644 -19.875
    4    HB3  GLU  65           HB3      GLU  65   9.005 -21.705 -21.218
    5    HG2  GLU  65           HG2      GLU  65  10.653 -21.375 -18.697
    6    HG3  GLU  65           HG3      GLU  65   9.554 -22.716 -19.010

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLY  66           H        GLY  66   8.971 -21.027 -22.822
    2    HA3  GLY  66           HA2      GLY  66   8.773 -18.958 -24.708
    3    HA2  GLY  66           HA3      GLY  66   7.769 -20.393 -24.646

  No H/Q in entry =           3
  In of MODEL   64
    1    H    LYS  67           H        LYS  67   6.657 -19.854 -22.061
    2    HA   LYS  67           HA       LYS  67   4.422 -18.317 -22.833
    3    HB2  LYS  67           HB2      LYS  67   3.578 -18.790 -20.609
    4    HB3  LYS  67           HB3      LYS  67   4.359 -20.231 -21.271
    5    HG2  LYS  67           HG2      LYS  67   6.457 -19.597 -20.074
    6    HG3  LYS  67           HG3      LYS  67   5.598 -18.245 -19.341
    7    HD2  LYS  67           HD2      LYS  67   4.021 -19.812 -18.279
    8    HD3  LYS  67           HD3      LYS  67   4.874 -21.170 -19.017
    9    HE2  LYS  67           HE2      LYS  67   5.847 -21.067 -16.884
   10    HE3  LYS  67           HE3      LYS  67   6.987 -20.155 -17.872
   11    HZ2  LYS  67           HZ1      LYS  67   4.831 -19.026 -16.174
   12    HZ1  LYS  67           HZ2      LYS  67   5.826 -18.115 -17.204
   13    HZ3  LYS  67           HZ3      LYS  67   6.498 -18.940 -15.879

  No H/Q in entry =          13
  In of MODEL   64
    1    H    MET  68           H        MET  68   3.758 -16.357 -22.482
    2    HA   MET  68           HA       MET  68   5.552 -14.259 -21.902
    3    HB2  MET  68           HB2      MET  68   2.553 -14.346 -22.202
    4    HB3  MET  68           HB3      MET  68   3.467 -12.851 -22.005
    5    HG2  MET  68           HG2      MET  68   4.811 -13.417 -24.004
    6    HG3  MET  68           HG3      MET  68   3.863 -14.890 -24.213
    7    HE2  MET  68           HE1      MET  68   2.325 -13.147 -27.121
    8    HE1  MET  68           HE2      MET  68   3.299 -14.456 -26.457
    9    HE3  MET  68           HE3      MET  68   4.011 -12.860 -26.673

  No H/Q in entry =           9
  In of MODEL   64
    1    H    LYS  69           H        LYS  69   3.904 -16.230 -19.685
    2    HA   LYS  69           HA       LYS  69   3.232 -14.276 -17.729
    3    HB2  LYS  69           HB2      LYS  69   3.539 -17.271 -17.566
    4    HB3  LYS  69           HB3      LYS  69   2.985 -16.275 -16.218
    5    HG2  LYS  69           HG2      LYS  69   1.197 -15.346 -17.709
    6    HG3  LYS  69           HG3      LYS  69   1.697 -16.493 -18.952
    7    HD2  LYS  69           HD2      LYS  69   0.851 -17.326 -16.168
    8    HD3  LYS  69           HD3      LYS  69  -0.256 -17.261 -17.540
    9    HE2  LYS  69           HE2      LYS  69   1.449 -18.749 -18.766
   10    HE3  LYS  69           HE3      LYS  69   2.169 -19.025 -17.181
   11    HZ3  LYS  69           HZ1      LYS  69   0.467 -20.301 -16.535
   12    HZ2  LYS  69           HZ2      LYS  69   0.163 -20.472 -18.197
   13    HZ1  LYS  69           HZ3      LYS  69  -0.704 -19.331 -17.284

  No H/Q in entry =          13
  In of MODEL   64
    1    H    VAL  70           H        VAL  70   4.051 -14.173 -15.480
    2    HA   VAL  70           HA       VAL  70   7.002 -14.468 -15.354
    3    HB   VAL  70           HB       VAL  70   6.968 -12.449 -13.896
    4   HG11  VAL  70          HG11      VAL  70   7.390 -12.301 -16.352
    5   HG13  VAL  70          HG12      VAL  70   6.633 -10.843 -15.709
    6   HG12  VAL  70          HG13      VAL  70   5.668 -12.017 -16.603
    7   HG21  VAL  70          HG21      VAL  70   4.034 -12.363 -14.708
    8   HG23  VAL  70          HG22      VAL  70   4.891 -11.061 -13.885
    9   HG22  VAL  70          HG23      VAL  70   4.651 -12.607 -13.073

  No H/Q in entry =           9
  In of MODEL   64
    1    H    SER  71           H        SER  71   7.846 -14.687 -13.151
    2    HA   SER  71           HA       SER  71   6.581 -16.732 -11.656
    3    HB2  SER  71           HB2      SER  71   9.026 -16.322 -11.626
    4    HB3  SER  71           HB3      SER  71   8.748 -14.805 -10.774
    5    HG   SER  71           HG       SER  71   8.266 -17.457  -9.921

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LEU  72           H        LEU  72   5.234 -16.660  -9.929
    2    HA   LEU  72           HA       LEU  72   3.643 -14.370  -9.508
    3    HB2  LEU  72           HB2      LEU  72   3.963 -16.912  -7.919
    4    HB3  LEU  72           HB3      LEU  72   2.769 -15.673  -7.539
    5    HG   LEU  72           HG       LEU  72   2.975 -16.993 -10.265
    6   HD11  LEU  72          HD11      LEU  72   1.308 -17.696  -7.838
    7   HD13  LEU  72          HD12      LEU  72   2.403 -18.747  -8.735
    8   HD12  LEU  72          HD13      LEU  72   0.889 -18.220  -9.470
    9   HD22  LEU  72          HD21      LEU  72   1.729 -15.027 -10.559
   10   HD21  LEU  72          HD22      LEU  72   1.042 -15.087  -8.944
   11   HD23  LEU  72          HD23      LEU  72   0.467 -16.195 -10.186

  No H/Q in entry =          11
  In of MODEL   64
    1    H    VAL  73           H        VAL  73   6.311 -15.753  -7.709
    2    HA   VAL  73           HA       VAL  73   6.209 -14.209  -5.385
    3    HB   VAL  73           HB       VAL  73   8.404 -14.978  -4.941
    4   HG12  VAL  73          HG11      VAL  73   7.377 -17.142  -6.758
    5   HG11  VAL  73          HG12      VAL  73   6.457 -16.679  -5.325
    6   HG13  VAL  73          HG13      VAL  73   8.103 -17.288  -5.159
    7   HG21  VAL  73          HG21      VAL  73   8.594 -15.104  -7.938
    8   HG23  VAL  73          HG22      VAL  73   9.634 -16.131  -6.954
    9   HG22  VAL  73          HG23      VAL  73   9.713 -14.378  -6.786

  No H/Q in entry =           9
  In of MODEL   64
    1    H    LEU  74           H        LEU  74   7.206 -13.316  -8.559
    2    HA   LEU  74           HA       LEU  74   9.115 -11.332  -8.063
    3    HB2  LEU  74           HB2      LEU  74   8.691 -12.098 -10.300
    4    HB3  LEU  74           HB3      LEU  74   7.014 -11.565 -10.215
    5    HG   LEU  74           HG       LEU  74   7.764  -9.221 -10.011
    6   HD11  LEU  74          HD11      LEU  74  10.479 -10.544 -10.090
    7   HD13  LEU  74          HD12      LEU  74   9.873  -9.367  -8.926
    8   HD12  LEU  74          HD13      LEU  74  10.262  -8.862 -10.570
    9   HD22  LEU  74          HD21      LEU  74   8.111  -8.999 -12.266
   10   HD21  LEU  74          HD22      LEU  74   7.587 -10.665 -12.206
   11   HD23  LEU  74          HD23      LEU  74   9.295 -10.302 -12.322

  No H/Q in entry =          11
  In of MODEL   64
    1    H    VAL  75           H        VAL  75   5.616 -11.007  -8.444
    2    HA   VAL  75           HA       VAL  75   5.470  -8.250  -7.873
    3    HB   VAL  75           HB       VAL  75   3.411 -10.423  -7.481
    4   HG13  VAL  75          HG11      VAL  75   2.869  -8.504  -6.038
    5   HG12  VAL  75          HG12      VAL  75   1.814  -8.478  -7.443
    6   HG11  VAL  75          HG13      VAL  75   3.190  -7.390  -7.363
    7   HG22  VAL  75          HG21      VAL  75   2.626  -9.785  -9.626
    8   HG21  VAL  75          HG22      VAL  75   4.379  -9.807  -9.809
    9   HG23  VAL  75          HG23      VAL  75   3.533  -8.273  -9.605

  No H/Q in entry =           9
  In of MODEL   64
    1    H    GLU  76           H        GLU  76   5.248 -11.120  -5.750
    2    HA   GLU  76           HA       GLU  76   4.737  -9.754  -3.339
    3    HB2  GLU  76           HB2      GLU  76   4.602 -12.223  -3.556
    4    HB3  GLU  76           HB3      GLU  76   6.340 -12.297  -3.791
    5    HG2  GLU  76           HG2      GLU  76   5.907 -12.872  -1.492
    6    HG3  GLU  76           HG3      GLU  76   6.622 -11.270  -1.487

  No H/Q in entry =           6
  In of MODEL   64
    1    H    ALA  77           H        ALA  77   7.823 -10.619  -4.874
    2    HA   ALA  77           HA       ALA  77   9.479  -9.537  -2.851
    3    HB2  ALA  77           HB1      ALA  77  11.215  -9.466  -4.685
    4    HB3  ALA  77           HB2      ALA  77   9.958 -10.004  -5.798
    5    HB1  ALA  77           HB3      ALA  77  10.445 -11.036  -4.453

  No H/Q in entry =           5
  In of MODEL   64
    1    H    GLN  78           H        GLN  78   8.088  -8.158  -5.783
    2    HA   GLN  78           HA       GLN  78   9.399  -5.657  -5.681
    3    HB2  GLN  78           HB2      GLN  78   8.134  -6.602  -7.645
    4    HB3  GLN  78           HB3      GLN  78   6.639  -6.245  -6.784
    5    HG2  GLN  78           HG2      GLN  78   7.243  -3.864  -6.700
    6    HG3  GLN  78           HG3      GLN  78   8.751  -4.209  -7.545
    7   HE21  GLN  78          HE21      GLN  78   6.833  -2.428  -8.689
    8   HE22  GLN  78          HE22      GLN  78   6.171  -3.163 -10.069

  No H/Q in entry =           8
  In of MODEL   64
    1    H    LEU  79           H        LEU  79   6.387  -6.835  -4.270
    2    HA   LEU  79           HA       LEU  79   5.347  -4.439  -3.282
    3    HB2  LEU  79           HB2      LEU  79   4.064  -6.511  -3.226
    4    HB3  LEU  79           HB3      LEU  79   5.212  -7.226  -2.097
    5    HG   LEU  79           HG       LEU  79   4.619  -5.584  -0.384
    6   HD13  LEU  79          HD11      LEU  79   4.130  -3.582  -1.449
    7   HD12  LEU  79          HD12      LEU  79   2.510  -4.131  -1.020
    8   HD11  LEU  79          HD13      LEU  79   3.108  -4.353  -2.663
    9   HD23  LEU  79          HD21      LEU  79   2.040  -6.116  -0.312
   10   HD22  LEU  79          HD22      LEU  79   3.199  -7.437  -0.187
   11   HD21  LEU  79          HD23      LEU  79   2.393  -7.120  -1.721

  No H/Q in entry =          11
  In of MODEL   64
    1    H    HIS  80           H        HIS  80   7.552  -6.731  -1.668
    2    HA   HIS  80           HA       HIS  80   7.795  -5.172   0.695
    3    HB2  HIS  80           HB2      HIS  80   9.181  -7.521  -0.479
    4    HB3  HIS  80           HB3      HIS  80  10.067  -6.604   0.740
    5    HD1  HIS  80           HD1      HIS  80   9.566  -7.235   3.082
    6    HD2  HIS  80           HD2      HIS  80   6.384  -8.149   0.547
    7    HE1  HIS  80           HE1      HIS  80   7.799  -8.358   4.521
    8    HE2  HIS  80           HE2      HIS  80   5.853  -8.919   2.984

  No H/Q in entry =           8
  In of MODEL   64
    1    H    LEU  81           H        LEU  81   9.830  -5.432  -2.198
    2    HA   LEU  81           HA       LEU  81  11.840  -3.655  -1.311
    3    HB2  LEU  81           HB2      LEU  81  10.956  -4.477  -4.078
    4    HB3  LEU  81           HB3      LEU  81  12.357  -3.447  -3.781
    5    HG   LEU  81           HG       LEU  81  11.995  -6.167  -2.496
    6   HD12  LEU  81          HD11      LEU  81  13.836  -6.775  -4.226
    7   HD11  LEU  81          HD12      LEU  81  13.256  -5.364  -5.110
    8   HD13  LEU  81          HD13      LEU  81  12.162  -6.704  -4.775
    9   HD23  LEU  81          HD21      LEU  81  14.618  -5.812  -2.460
   10   HD22  LEU  81          HD22      LEU  81  13.613  -5.060  -1.223
   11   HD21  LEU  81          HD23      LEU  81  14.190  -4.107  -2.590

  No H/Q in entry =          11
  In of MODEL   64
    1    H    MET  82           H        MET  82   8.925  -3.073  -3.277
    2    HA   MET  82           HA       MET  82   9.429  -0.342  -3.788
    3    HB2  MET  82           HB2      MET  82   6.892  -1.974  -3.677
    4    HB3  MET  82           HB3      MET  82   6.870  -0.251  -4.050
    5    HG2  MET  82           HG2      MET  82   8.514  -2.309  -5.560
    6    HG3  MET  82           HG3      MET  82   6.943  -1.712  -6.090
    7    HE3  MET  82           HE1      MET  82   7.351   1.743  -7.276
    8    HE2  MET  82           HE2      MET  82   6.964   1.520  -5.572
    9    HE1  MET  82           HE3      MET  82   6.326   0.394  -6.766

  No H/Q in entry =           9
  In of MODEL   64
    1    H    THR  83           H        THR  83   7.637  -1.953  -1.190
    2    HA   THR  83           HA       THR  83   6.740   0.389   0.116
    3    HB   THR  83           HB       THR  83   6.610  -1.177   2.141
    4    HG1  THR  83           HG1      THR  83   7.398  -3.117   1.928
    5   HG22  THR  83          HG21      THR  83   4.994  -2.774   0.667
    6   HG21  THR  83          HG22      THR  83   5.211  -1.448  -0.470
    7   HG23  THR  83          HG23      THR  83   4.551  -1.134   1.135

  No H/Q in entry =           7
  In of MODEL   64
    1    H    SER  84           H        SER  84   9.589  -1.665   0.673
    2    HA   SER  84           HA       SER  84  10.608  -0.208   2.863
    3    HB2  SER  84           HB2      SER  84  11.906  -2.043   0.859
    4    HB3  SER  84           HB3      SER  84  12.830  -1.269   2.145
    5    HG   SER  84           HG       SER  84  10.577  -2.990   2.394

  No H/Q in entry =           5
  In of MODEL   64
    1    H    MET  85           H        MET  85  11.389   0.046  -0.619
    2    HA   MET  85           HA       MET  85  13.356   2.041  -0.361
    3    HB2  MET  85           HB2      MET  85  12.993   0.740  -2.423
    4    HB3  MET  85           HB3      MET  85  11.461   1.578  -2.672
    5    HG2  MET  85           HG2      MET  85  12.642   3.734  -2.795
    6    HG3  MET  85           HG3      MET  85  14.175   2.917  -2.510
    7    HE3  MET  85           HE1      MET  85  11.149   1.617  -5.161
    8    HE2  MET  85           HE2      MET  85  11.489   3.054  -6.123
    9    HE1  MET  85           HE3      MET  85  11.088   3.223  -4.418

  No H/Q in entry =           9
  In of MODEL   64
    1    H    LEU  86           H        LEU  86   9.867   2.323  -0.903
    2    HA   LEU  86           HA       LEU  86   9.766   5.134  -1.100
    3    HB2  LEU  86           HB2      LEU  86   7.950   3.446  -1.684
    4    HB3  LEU  86           HB3      LEU  86   7.606   3.361   0.044
    5    HG   LEU  86           HG       LEU  86   7.410   5.918  -0.024
    6   HD11  LEU  86          HD11      LEU  86   8.216   5.479  -2.716
    7   HD13  LEU  86          HD12      LEU  86   7.752   7.005  -1.968
    8   HD12  LEU  86          HD13      LEU  86   6.536   6.020  -2.779
    9   HD23  LEU  86          HD21      LEU  86   5.310   4.528  -1.698
   10   HD22  LEU  86          HD22      LEU  86   5.091   5.791  -0.491
   11   HD21  LEU  86          HD23      LEU  86   5.509   4.155   0.015

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ALA  87           H        ALA  87   9.305   2.964   1.653
    2    HA   ALA  87           HA       ALA  87   8.712   4.880   3.607
    3    HB1  ALA  87           HB1      ALA  87   9.559   2.071   3.543
    4    HB3  ALA  87           HB2      ALA  87   8.413   2.873   4.615
    5    HB2  ALA  87           HB3      ALA  87  10.138   2.930   4.974

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ARG  88           H        ARG  88  11.824   3.493   2.662
    2    HA   ARG  88           HA       ARG  88  13.398   4.903   4.501
    3    HB2  ARG  88           HB2      ARG  88  14.106   2.931   3.114
    4    HB3  ARG  88           HB3      ARG  88  14.255   4.019   1.736
    5    HG2  ARG  88           HG2      ARG  88  15.693   5.363   3.689
    6    HG3  ARG  88           HG3      ARG  88  16.033   3.681   4.079
    7    HD2  ARG  88           HD2      ARG  88  17.321   3.392   2.246
    8    HD3  ARG  88           HD3      ARG  88  16.181   4.242   1.198
    9    HE   ARG  88           HE       ARG  88  18.552   5.344   2.260
   10   HH21  ARG  88          HH11      ARG  88  18.868   7.566   2.057
   11   HH22  ARG  88          HH12      ARG  88  17.504   8.619   1.896
   12   HH11  ARG  88          HH21      ARG  88  15.205   6.050   1.949
   13   HH12  ARG  88          HH22      ARG  88  15.429   7.757   1.811

  No H/Q in entry =          13
  In of MODEL   64
    1    H    GLU  89           H        GLU  89  12.442   5.770   1.164
    2    HA   GLU  89           HA       GLU  89  13.957   8.150   1.009
    3    HB2  GLU  89           HB2      GLU  89  12.845   7.084  -0.943
    4    HB3  GLU  89           HB3      GLU  89  11.287   7.607  -0.302
    5    HG2  GLU  89           HG2      GLU  89  11.958   9.953  -0.471
    6    HG3  GLU  89           HG3      GLU  89  13.573   9.482  -0.991

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LEU  90           H        LEU  90  10.626   7.601   2.112
    2    HA   LEU  90           HA       LEU  90  10.068  10.330   2.669
    3    HB2  LEU  90           HB2      LEU  90   8.900   7.746   3.699
    4    HB3  LEU  90           HB3      LEU  90   8.244   9.334   4.108
    5    HG   LEU  90           HG       LEU  90   8.699   8.445   1.248
    6   HD12  LEU  90          HD11      LEU  90   6.169   8.082   1.290
    7   HD11  LEU  90          HD12      LEU  90   6.309   8.083   3.048
    8   HD13  LEU  90          HD13      LEU  90   7.153   6.860   2.097
    9   HD22  LEU  90          HD21      LEU  90   8.374  10.749   1.159
   10   HD21  LEU  90          HD22      LEU  90   7.375  10.775   2.610
   11   HD23  LEU  90          HD23      LEU  90   6.698  10.203   1.086

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  91           H        ILE  91  11.351   7.676   4.616
    2    HA   ILE  91           HA       ILE  91  11.451   9.056   7.078
    3    HB   ILE  91           HB       ILE  91  13.047   6.733   5.980
    4   HG12  ILE  91          HG12      ILE  91  11.009   6.884   8.221
    5   HG13  ILE  91          HG13      ILE  91  10.557   6.588   6.543
    6   HG22  ILE  91          HG21      ILE  91  13.497   6.540   8.626
    7   HG21  ILE  91          HG22      ILE  91  13.398   8.297   8.515
    8   HG23  ILE  91          HG23      ILE  91  14.597   7.420   7.565
    9   HD13  ILE  91          HD11      ILE  91  11.589   4.500   6.493
   10   HD12  ILE  91          HD12      ILE  91  10.981   4.559   8.147
   11   HD11  ILE  91          HD13      ILE  91  12.681   4.894   7.822

  No H/Q in entry =          11
  In of MODEL   64
    1    H    THR  92           H        THR  92  13.694   8.903   4.346
    2    HA   THR  92           HA       THR  92  15.830  10.332   5.516
    3    HB   THR  92           HB       THR  92  14.870  10.178   2.648
    4    HG1  THR  92           HG1      THR  92  15.724   8.295   3.070
    5   HG22  THR  92          HG21      THR  92  17.433  10.903   2.373
    6   HG21  THR  92          HG22      THR  92  17.100  11.727   3.895
    7   HG23  THR  92          HG23      THR  92  16.137  12.094   2.464

  No H/Q in entry =           7
  In of MODEL   64
    1    H    GLU  93           H        GLU  93  12.942  11.436   3.757
    2    HA   GLU  93           HA       GLU  93  13.498  14.206   3.862
    3    HB2  GLU  93           HB2      GLU  93  10.813  12.796   3.860
    4    HB3  GLU  93           HB3      GLU  93  11.080  14.497   3.482
    5    HG2  GLU  93           HG2      GLU  93  12.462  12.266   1.977
    6    HG3  GLU  93           HG3      GLU  93  10.910  12.925   1.474

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LEU  94           H        LEU  94  11.766  12.037   6.069
    2    HA   LEU  94           HA       LEU  94  10.914  13.981   7.928
    3    HB2  LEU  94           HB2      LEU  94  11.529  11.036   8.223
    4    HB3  LEU  94           HB3      LEU  94  10.932  12.011   9.563
    5    HG   LEU  94           HG       LEU  94   9.470  12.028   6.922
    6   HD11  LEU  94          HD11      LEU  94   9.566   9.819   8.939
    7   HD13  LEU  94          HD12      LEU  94   9.280   9.745   7.201
    8   HD12  LEU  94          HD13      LEU  94   7.985  10.249   8.286
    9   HD23  LEU  94          HD21      LEU  94   7.531  12.410   8.504
   10   HD22  LEU  94          HD22      LEU  94   8.752  13.681   8.544
   11   HD21  LEU  94          HD23      LEU  94   8.696  12.470   9.825

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  95           H        ILE  95  13.916  12.092   7.727
    2    HA   ILE  95           HA       ILE  95  15.051  13.043  10.145
    3    HB   ILE  95           HB       ILE  95  16.325  11.978   7.613
    4   HG12  ILE  95          HG12      ILE  95  16.023  10.787  10.384
    5   HG13  ILE  95          HG13      ILE  95  14.871  10.506   9.081
    6   HG21  ILE  95          HG21      ILE  95  17.547  12.816  10.261
    7   HG23  ILE  95          HG22      ILE  95  18.016  13.342   8.643
    8   HG22  ILE  95          HG23      ILE  95  18.341  11.689   9.163
    9   HD13  ILE  95          HD11      ILE  95  16.379   9.242   7.837
   10   HD12  ILE  95          HD12      ILE  95  16.844   8.808   9.479
   11   HD11  ILE  95          HD13      ILE  95  17.789   9.996   8.582

  No H/Q in entry =          11
  In of MODEL   64
    1    H    GLU  96           H        GLU  96  15.216  14.261   6.806
    2    HA   GLU  96           HA       GLU  96  17.030  16.367   7.287
    3    HB2  GLU  96           HB2      GLU  96  16.393  15.684   5.026
    4    HB3  GLU  96           HB3      GLU  96  14.740  16.220   5.310
    5    HG2  GLU  96           HG2      GLU  96  15.282  18.354   4.761
    6    HG3  GLU  96           HG3      GLU  96  16.570  18.379   5.954

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LEU  97           H        LEU  97  13.518  16.134   7.688
    2    HA   LEU  97           HA       LEU  97  13.059  18.865   8.312
    3    HB2  LEU  97           HB2      LEU  97  11.570  16.322   8.927
    4    HB3  LEU  97           HB3      LEU  97  11.031  17.865   9.586
    5    HG   LEU  97           HG       LEU  97  11.544  17.441   6.628
    6   HD12  LEU  97          HD11      LEU  97   9.023  17.277   6.490
    7   HD11  LEU  97          HD12      LEU  97   9.005  17.087   8.241
    8   HD13  LEU  97          HD13      LEU  97   9.811  15.885   7.232
    9   HD23  LEU  97          HD21      LEU  97   9.779  19.381   6.636
   10   HD22  LEU  97          HD22      LEU  97  11.452  19.765   7.040
   11   HD21  LEU  97          HD23      LEU  97  10.255  19.585   8.321

  No H/Q in entry =          11
  In of MODEL   64
    1    H    HIS  98           H        HIS  98  13.903  16.061  10.330
    2    HA   HIS  98           HA       HIS  98  13.707  17.332  12.838
    3    HB2  HIS  98           HB2      HIS  98  15.496  15.094  11.862
    4    HB3  HIS  98           HB3      HIS  98  15.473  15.641  13.540
    5    HD1  HIS  98           HD1      HIS  98  13.318  13.968  10.939
    6    HD2  HIS  98           HD2      HIS  98  13.165  14.907  14.998
    7    HE1  HIS  98           HE1      HIS  98  11.301  12.751  11.881
    8    HE2  HIS  98           HE2      HIS  98  11.189  13.314  14.349

  No H/Q in entry =           8
  In of MODEL   64
    1    H    GLU  99           H        GLU  99  16.282  17.240  10.424
    2    HA   GLU  99           HA       GLU  99  18.236  18.606  11.962
    3    HB2  GLU  99           HB2      GLU  99  18.750  17.314   9.904
    4    HB3  GLU  99           HB3      GLU  99  17.931  18.553   8.950
    5    HG2  GLU  99           HG2      GLU  99  19.510  20.250   9.745
    6    HG3  GLU  99           HG3      GLU  99  20.297  19.063  10.780

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LYS 100           H        LYS 100  15.715  19.723   9.720
    2    HA   LYS 100           HA       LYS 100  16.475  22.471   9.856
    3    HB2  LYS 100           HB2      LYS 100  13.866  21.143   9.087
    4    HB3  LYS 100           HB3      LYS 100  14.143  22.885   8.990
    5    HG2  LYS 100           HG2      LYS 100  16.132  22.455   7.541
    6    HG3  LYS 100           HG3      LYS 100  15.742  20.733   7.564
    7    HD2  LYS 100           HD2      LYS 100  13.548  21.208   6.544
    8    HD3  LYS 100           HD3      LYS 100  13.922  22.932   6.528
    9    HE2  LYS 100           HE2      LYS 100  15.899  22.471   5.086
   10    HE3  LYS 100           HE3      LYS 100  15.456  20.760   5.058
   11    HZ1  LYS 100           HZ1      LYS 100  13.610  22.924   4.197
   12    HZ3  LYS 100           HZ2      LYS 100  13.449  21.251   3.942
   13    HZ2  LYS 100           HZ3      LYS 100  14.655  22.124   3.126

  No H/Q in entry =          13
  In of MODEL   64
    1    H    LEU 101           H        LEU 101  14.389  20.407  11.815
    2    HA   LEU 101           HA       LEU 101  13.183  22.468  13.373
    3    HB2  LEU 101           HB2      LEU 101  13.660  19.526  13.775
    4    HB3  LEU 101           HB3      LEU 101  13.101  20.506  15.127
    5    HG   LEU 101           HG       LEU 101  11.703  20.562  12.446
    6   HD12  LEU 101          HD11      LEU 101  10.054  18.983  13.710
    7   HD11  LEU 101          HD12      LEU 101  11.446  18.594  14.718
    8   HD13  LEU 101          HD13      LEU 101  11.498  18.279  12.982
    9   HD21  LEU 101          HD21      LEU 101  11.013  21.361  15.289
   10   HD23  LEU 101          HD22      LEU 101   9.765  21.113  14.070
   11   HD22  LEU 101          HD23      LEU 101  10.985  22.363  13.835

  No H/Q in entry =          11
  In of MODEL   64
    1    H    LYS 102           H        LYS 102  16.341  21.899  12.965
    2    HA   LYS 102           HA       LYS 102  18.168  22.799  14.047
    3    HB2  LYS 102           HB2      LYS 102  16.325  24.296  15.159
    4    HB3  LYS 102           HB3      LYS 102  16.535  23.243  16.543
    5    HG2  LYS 102           HG2      LYS 102  18.411  25.273  15.378
    6    HG3  LYS 102           HG3      LYS 102  18.019  24.962  17.056
    7    HD2  LYS 102           HD2      LYS 102  19.725  23.063  15.393
    8    HD3  LYS 102           HD3      LYS 102  20.389  24.398  16.324
    9    HE2  LYS 102           HE2      LYS 102  20.016  21.849  17.303
   10    HE3  LYS 102           HE3      LYS 102  20.208  23.299  18.288
   11    HZ2  LYS 102           HZ1      LYS 102  18.251  21.993  18.897
   12    HZ1  LYS 102           HZ2      LYS 102  17.617  22.207  17.342
   13    HZ3  LYS 102           HZ3      LYS 102  17.822  23.544  18.363

  No H/Q in entry =          13
  In of MODEL   64
    1    H    ALA 103           H        ALA 103  16.097  21.179  16.461
    2    HA   ALA 103           HA       ALA 103  17.827  19.999  18.136
    3    HB2  ALA 103           HB1      ALA 103  16.268  17.971  18.127
    4    HB1  ALA 103           HB2      ALA 103  15.372  18.807  16.858
    5    HB3  ALA 103           HB3      ALA 103  15.528  19.538  18.455

  No H/Q in entry =           5
  In of MODEL   64
    1    H1   ALA   1           H3       ALA   1  -1.438  -7.304 -21.507
    2    H2   ALA   1           H2       ALA   1  -2.218  -8.746 -21.053
    3    H3   ALA   1           H1       ALA   1  -0.605  -8.779 -21.595
    4    HA   ALA   1           HA       ALA   1  -1.417  -9.268 -23.595
    5    HB1  ALA   1           HB1      ALA   1  -3.549 -10.011 -23.136
    6    HB2  ALA   1           HB2      ALA   1  -4.000  -8.510 -23.944
    7    HB3  ALA   1           HB3      ALA   1  -3.952  -8.581 -22.185

  No H/Q in entry =           7
  In of MODEL   64
    1    H    GLU   2           H        GLU   2  -2.245  -8.098 -25.597
    2    HA   GLU   2           HA       GLU   2  -0.864  -6.071 -26.473
    3    HB2  GLU   2           HB2      GLU   2  -3.868  -6.177 -26.815
    4    HB3  GLU   2           HB3      GLU   2  -2.749  -5.305 -27.860
    5    HG2  GLU   2           HG2      GLU   2  -2.213  -7.194 -29.001
    6    HG3  GLU   2           HG3      GLU   2  -1.917  -8.089 -27.517

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLU   3           H        GLU   3  -4.047  -4.849 -25.605
    2    HA   GLU   3           HA       GLU   3  -3.038  -2.277 -24.981
    3    HB2  GLU   3           HB2      GLU   3  -5.712  -3.624 -24.664
    4    HB3  GLU   3           HB3      GLU   3  -5.439  -2.002 -24.023
    5    HG2  GLU   3           HG2      GLU   3  -5.077  -1.081 -26.151
    6    HG3  GLU   3           HG3      GLU   3  -4.657  -2.634 -26.865

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LEU   4           H        LEU   4  -4.617  -4.645 -22.803
    2    HA   LEU   4           HA       LEU   4  -4.287  -3.402 -20.415
    3    HB2  LEU   4           HB2      LEU   4  -3.704  -6.338 -20.865
    4    HB3  LEU   4           HB3      LEU   4  -4.132  -5.589 -19.329
    5    HG   LEU   4           HG       LEU   4  -5.883  -5.697 -21.807
    6   HD13  LEU   4          HD11      LEU   4  -7.063  -7.424 -20.811
    7   HD12  LEU   4          HD12      LEU   4  -6.598  -6.951 -19.178
    8   HD11  LEU   4          HD13      LEU   4  -5.443  -7.785 -20.216
    9   HD23  LEU   4          HD21      LEU   4  -7.593  -4.897 -19.957
   10   HD22  LEU   4          HD22      LEU   4  -6.563  -3.717 -20.765
   11   HD21  LEU   4          HD23      LEU   4  -6.142  -4.295 -19.153

  No H/Q in entry =          11
  In of MODEL   64
    1    H    GLU   5           H        GLU   5  -1.753  -5.222 -22.116
    2    HA   GLU   5           HA       GLU   5   0.211  -4.904 -20.065
    3    HB2  GLU   5           HB2      GLU   5   0.310  -6.681 -21.809
    4    HB3  GLU   5           HB3      GLU   5   0.622  -5.438 -23.021
    5    HG2  GLU   5           HG2      GLU   5   2.670  -4.774 -21.849
    6    HG3  GLU   5           HG3      GLU   5   2.354  -5.962 -20.586

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLU   6           H        GLU   6  -0.420  -3.213 -23.123
    2    HA   GLU   6           HA       GLU   6   1.725  -1.353 -22.846
    3    HB2  GLU   6           HB2      GLU   6   0.635  -1.850 -25.015
    4    HB3  GLU   6           HB3      GLU   6  -0.845  -1.094 -24.428
    5    HG2  GLU   6           HG2      GLU   6   0.338   1.036 -24.130
    6    HG3  GLU   6           HG3      GLU   6   1.841   0.290 -24.669

  No H/Q in entry =           6
  In of MODEL   64
    1    H    VAL   7           H        VAL   7  -1.621  -1.461 -21.828
    2    HA   VAL   7           HA       VAL   7  -1.883   1.253 -21.006
    3    HB   VAL   7           HB       VAL   7  -3.321  -1.279 -20.170
    4   HG11  VAL   7          HG11      VAL   7  -3.738   1.609 -19.373
    5   HG13  VAL   7          HG12      VAL   7  -3.630   0.191 -18.330
    6   HG12  VAL   7          HG13      VAL   7  -5.057   0.438 -19.335
    7   HG21  VAL   7          HG21      VAL   7  -3.471  -0.216 -22.565
    8   HG23  VAL   7          HG22      VAL   7  -4.439   1.025 -21.767
    9   HG22  VAL   7          HG23      VAL   7  -4.964  -0.658 -21.736

  No H/Q in entry =           9
  In of MODEL   64
    1    H    VAL   8           H        VAL   8  -0.872  -1.712 -19.341
    2    HA   VAL   8           HA       VAL   8  -0.589  -0.617 -16.748
    3    HB   VAL   8           HB       VAL   8   0.854  -2.922 -18.082
    4   HG12  VAL   8          HG11      VAL   8   1.132  -3.520 -15.526
    5   HG11  VAL   8          HG12      VAL   8   0.975  -1.777 -15.308
    6   HG13  VAL   8          HG13      VAL   8   2.277  -2.426 -16.304
    7   HG22  VAL   8          HG21      VAL   8  -0.913  -4.251 -17.411
    8   HG21  VAL   8          HG22      VAL   8  -1.801  -2.732 -17.404
    9   HG23  VAL   8          HG23      VAL   8  -1.132  -3.363 -15.904

  No H/Q in entry =           9
  In of MODEL   64
    1    H    MET   9           H        MET   9   1.686  -0.903 -19.475
    2    HA   MET   9           HA       MET   9   3.949   0.173 -18.201
    3    HB2  MET   9           HB2      MET   9   3.017   0.080 -21.057
    4    HB3  MET   9           HB3      MET   9   4.452   1.010 -20.628
    5    HG2  MET   9           HG2      MET   9   5.636  -0.884 -19.935
    6    HG3  MET   9           HG3      MET   9   4.166  -1.819 -19.651
    7    HE3  MET   9           HE1      MET   9   4.039   0.268 -22.977
    8    HE2  MET   9           HE2      MET   9   5.424  -0.416 -23.824
    9    HE1  MET   9           HE3      MET   9   5.660   0.411 -22.286

  No H/Q in entry =           9
  In of MODEL   64
    1    H    GLY  10           H        GLY  10   1.260   1.736 -19.907
    2    HA3  GLY  10           HA2      GLY  10   2.191   4.401 -19.667
    3    HA2  GLY  10           HA3      GLY  10   0.508   3.921 -19.884

  No H/Q in entry =           3
  In of MODEL   64
    1    H    LEU  11           H        LEU  11   0.108   2.400 -17.594
    2    HA   LEU  11           HA       LEU  11  -0.460   4.380 -15.647
    3    HB2  LEU  11           HB2      LEU  11  -0.360   1.366 -15.477
    4    HB3  LEU  11           HB3      LEU  11  -0.891   2.389 -14.143
    5    HG   LEU  11           HG       LEU  11  -2.109   2.476 -16.917
    6   HD13  LEU  11          HD11      LEU  11  -2.675   0.330 -16.156
    7   HD12  LEU  11          HD12      LEU  11  -4.040   1.309 -15.626
    8   HD11  LEU  11          HD13      LEU  11  -2.788   0.848 -14.474
    9   HD22  LEU  11          HD21      LEU  11  -2.730   4.490 -15.924
   10   HD21  LEU  11          HD22      LEU  11  -2.660   3.832 -14.289
   11   HD23  LEU  11          HD23      LEU  11  -4.023   3.446 -15.340

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  12           H        ILE  12   2.112   1.941 -15.859
    2    HA   ILE  12           HA       ILE  12   3.292   2.503 -13.348
    3    HB   ILE  12           HB       ILE  12   4.534   1.438 -15.906
    4   HG12  ILE  12          HG12      ILE  12   2.601   0.173 -14.720
    5   HG13  ILE  12          HG13      ILE  12   4.046  -0.736 -15.111
    6   HG22  ILE  12          HG21      ILE  12   6.231   0.459 -14.233
    7   HG21  ILE  12          HG22      ILE  12   5.609   1.642 -13.084
    8   HG23  ILE  12          HG23      ILE  12   6.361   2.182 -14.583
    9   HD13  ILE  12          HD11      ILE  12   4.818  -0.510 -12.805
   10   HD12  ILE  12          HD12      ILE  12   3.192  -1.190 -12.822
   11   HD11  ILE  12          HD13      ILE  12   3.433   0.496 -12.421

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  13           H        ILE  13   3.905   3.758 -16.606
    2    HA   ILE  13           HA       ILE  13   6.017   5.505 -15.874
    3    HB   ILE  13           HB       ILE  13   4.002   5.559 -18.134
    4   HG12  ILE  13          HG12      ILE  13   5.882   3.745 -17.807
    5   HG13  ILE  13          HG13      ILE  13   5.581   4.428 -19.401
    6   HG22  ILE  13          HG21      ILE  13   5.733   7.142 -19.207
    7   HG21  ILE  13          HG22      ILE  13   6.334   7.409 -17.574
    8   HG23  ILE  13          HG23      ILE  13   4.671   7.834 -17.979
    9   HD12  ILE  13          HD11      ILE  13   8.046   4.316 -18.683
   10   HD11  ILE  13          HD12      ILE  13   7.649   5.571 -17.514
   11   HD13  ILE  13          HD13      ILE  13   7.470   5.888 -19.235

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ASN  14           H        ASN  14   2.507   5.960 -16.170
    2    HA   ASN  14           HA       ASN  14   2.430   8.708 -15.546
    3    HB2  ASN  14           HB2      ASN  14   0.561   7.042 -16.383
    4    HB3  ASN  14           HB3      ASN  14   0.229   6.867 -14.664
    5   HD21  ASN  14          HD21      ASN  14  -1.792   7.995 -16.117
    6   HD22  ASN  14          HD22      ASN  14  -1.875   9.668 -15.858

  No H/Q in entry =           6
  In of MODEL   64
    1    H    SER  15           H        SER  15   2.151   5.838 -13.458
    2    HA   SER  15           HA       SER  15   1.811   7.215 -11.019
    3    HB2  SER  15           HB2      SER  15   2.381   5.141  -9.956
    4    HB3  SER  15           HB3      SER  15   1.559   4.707 -11.450
    5    HG   SER  15           HG       SER  15   3.661   4.520 -12.405

  No H/Q in entry =           5
  In of MODEL   64
    1    H    GLY  16           H        GLY  16   4.712   6.143 -12.751
    2    HA3  GLY  16           HA2      GLY  16   6.614   6.930 -10.810
    3    HA2  GLY  16           HA3      GLY  16   6.932   6.723 -12.530

  No H/Q in entry =           3
  In of MODEL   64
    1    H    GLN  17           H        GLN  17   5.228   8.657 -13.615
    2    HA   GLN  17           HA       GLN  17   6.776  11.018 -13.306
    3    HB2  GLN  17           HB2      GLN  17   5.467  10.502 -15.353
    4    HB3  GLN  17           HB3      GLN  17   3.976  10.733 -14.439
    5    HG2  GLN  17           HG2      GLN  17   4.503  12.779 -15.662
    6    HG3  GLN  17           HG3      GLN  17   4.678  13.065 -13.931
    7   HE21  GLN  17          HE21      GLN  17   6.394  12.969 -16.976
    8   HE22  GLN  17          HE22      GLN  17   7.914  13.392 -16.352

  No H/Q in entry =           8
  In of MODEL   64
    1    H    ALA  18           H        ALA  18   3.678   9.969 -11.975
    2    HA   ALA  18           HA       ALA  18   2.914  12.355 -10.726
    3    HB1  ALA  18           HB1      ALA  18   1.817   9.884 -10.945
    4    HB2  ALA  18           HB2      ALA  18   1.245  11.102  -9.808
    5    HB3  ALA  18           HB3      ALA  18   2.346   9.836  -9.264

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ARG  19           H        ARG  19   4.812   9.621  -9.420
    2    HA   ARG  19           HA       ARG  19   5.311  10.797  -6.900
    3    HB2  ARG  19           HB2      ARG  19   5.759   8.397  -7.412
    4    HB3  ARG  19           HB3      ARG  19   7.117   8.895  -8.425
    5    HG2  ARG  19           HG2      ARG  19   8.209   9.957  -6.499
    6    HG3  ARG  19           HG3      ARG  19   6.830   9.557  -5.476
    7    HD2  ARG  19           HD2      ARG  19   8.610   7.946  -5.098
    8    HD3  ARG  19           HD3      ARG  19   7.251   7.143  -5.890
    9    HE   ARG  19           HE       ARG  19   8.961   7.973  -7.928
   10   HH21  ARG  19          HH11      ARG  19  10.545   6.584  -8.760
   11   HH22  ARG  19          HH12      ARG  19  11.100   5.247  -7.814
   12   HH11  ARG  19          HH21      ARG  19   9.037   5.957  -5.140
   13   HH12  ARG  19          HH22      ARG  19  10.244   4.892  -5.763

  No H/Q in entry =          13
  In of MODEL   64
    1    H    SER  20           H        SER  20   7.151  10.835  -9.935
    2    HA   SER  20           HA       SER  20   9.371  12.283  -9.101
    3    HB2  SER  20           HB2      SER  20   9.434  11.399 -11.300
    4    HB3  SER  20           HB3      SER  20   7.924  12.190 -11.743
    5    HG   SER  20           HG       SER  20   9.061  14.202 -11.425

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LEU  21           H        LEU  21   6.265  13.507 -10.327
    2    HA   LEU  21           HA       LEU  21   6.898  16.262 -10.111
    3    HB2  LEU  21           HB2      LEU  21   4.247  14.805 -10.041
    4    HB3  LEU  21           HB3      LEU  21   4.393  16.561 -10.058
    5    HG   LEU  21           HG       LEU  21   5.631  14.766 -12.165
    6   HD11  LEU  21          HD11      LEU  21   2.922  16.088 -12.006
    7   HD13  LEU  21          HD12      LEU  21   3.312  14.423 -12.444
    8   HD12  LEU  21          HD13      LEU  21   3.677  15.737 -13.561
    9   HD21  LEU  21          HD21      LEU  21   5.326  17.742 -11.784
   10   HD23  LEU  21          HD22      LEU  21   5.388  17.094 -13.421
   11   HD22  LEU  21          HD23      LEU  21   6.741  16.844 -12.329

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ALA  22           H        ALA  22   5.400  13.963  -7.863
    2    HA   ALA  22           HA       ALA  22   4.757  15.772  -5.809
    3    HB3  ALA  22           HB1      ALA  22   4.030  13.368  -5.967
    4    HB2  ALA  22           HB2      ALA  22   4.599  13.856  -4.370
    5    HB1  ALA  22           HB3      ALA  22   5.644  12.907  -5.429

  No H/Q in entry =           5
  In of MODEL   64
    1    H    TYR  23           H        TYR  23   7.721  13.785  -6.216
    2    HA   TYR  23           HA       TYR  23   9.073  14.833  -3.958
    3    HB2  TYR  23           HB2      TYR  23   9.898  12.833  -5.098
    4    HB3  TYR  23           HB3      TYR  23  10.206  13.766  -6.562
    5    HD1  TYR  23           HD1      TYR  23  11.166  13.435  -2.972
    6    HD2  TYR  23           HD2      TYR  23  12.213  14.996  -6.835
    7    HE1  TYR  23           HE1      TYR  23  13.410  14.051  -2.115
    8    HE2  TYR  23           HE2      TYR  23  14.456  15.614  -5.977
    9    HH   TYR  23           HH       TYR  23  15.580  14.567  -2.852

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ALA  24           H        ALA  24   8.900  15.922  -7.331
    2    HA   ALA  24           HA       ALA  24  10.763  18.036  -7.080
    3    HB2  ALA  24           HB1      ALA  24  10.337  18.081  -9.293
    4    HB3  ALA  24           HB2      ALA  24   8.768  18.810  -8.949
    5    HB1  ALA  24           HB3      ALA  24   8.920  17.058  -9.069

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ALA  25           H        ALA  25   7.283  17.803  -6.485
    2    HA   ALA  25           HA       ALA  25   6.759  20.516  -5.932
    3    HB1  ALA  25           HB1      ALA  25   5.129  18.492  -6.136
    4    HB2  ALA  25           HB2      ALA  25   4.733  19.781  -4.996
    5    HB3  ALA  25           HB3      ALA  25   5.441  18.273  -4.413

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LEU  26           H        LEU  26   7.852  17.863  -3.861
    2    HA   LEU  26           HA       LEU  26   7.917  19.307  -1.430
    3    HB2  LEU  26           HB2      LEU  26   8.048  16.892  -1.412
    4    HB3  LEU  26           HB3      LEU  26   9.526  16.918  -2.372
    5    HG   LEU  26           HG       LEU  26  10.709  18.063  -0.529
    6   HD12  LEU  26          HD11      LEU  26   9.466  18.063   1.722
    7   HD11  LEU  26          HD12      LEU  26   7.988  17.897   0.777
    8   HD13  LEU  26          HD13      LEU  26   9.012  19.318   0.569
    9   HD21  LEU  26          HD21      LEU  26   9.207  15.576   0.345
   10   HD23  LEU  26          HD22      LEU  26  10.709  16.165   1.051
   11   HD22  LEU  26          HD23      LEU  26  10.685  15.597  -0.617

  No H/Q in entry =          11
  In of MODEL   64
    1    H    LYS  27           H        LYS  27  10.361  18.760  -3.934
    2    HA   LYS  27           HA       LYS  27  12.516  20.040  -2.697
    3    HB2  LYS  27           HB2      LYS  27  12.654  18.685  -4.779
    4    HB3  LYS  27           HB3      LYS  27  11.875  20.001  -5.656
    5    HG2  LYS  27           HG2      LYS  27  13.712  21.518  -5.072
    6    HG3  LYS  27           HG3      LYS  27  14.486  20.243  -4.124
    7    HD2  LYS  27           HD2      LYS  27  14.666  18.848  -6.170
    8    HD3  LYS  27           HD3      LYS  27  13.937  20.150  -7.110
    9    HE2  LYS  27           HE2      LYS  27  15.797  21.649  -6.491
   10    HE3  LYS  27           HE3      LYS  27  16.529  20.351  -5.541
   11    HZ3  LYS  27           HZ1      LYS  27  17.534  20.455  -7.721
   12    HZ2  LYS  27           HZ2      LYS  27  16.015  20.309  -8.472
   13    HZ1  LYS  27           HZ3      LYS  27  16.652  19.013  -7.577

  No H/Q in entry =          13
  In of MODEL   64
    1    H    GLN  28           H        GLN  28   9.886  21.371  -4.671
    2    HA   GLN  28           HA       GLN  28  10.804  24.037  -4.831
    3    HB2  GLN  28           HB2      GLN  28   7.987  22.924  -4.733
    4    HB3  GLN  28           HB3      GLN  28   8.378  24.600  -5.117
    5    HG2  GLN  28           HG2      GLN  28   9.416  22.190  -6.636
    6    HG3  GLN  28           HG3      GLN  28   8.074  23.206  -7.159
    7   HE21  GLN  28          HE21      GLN  28  11.246  22.745  -7.824
    8   HE22  GLN  28          HE22      GLN  28  11.707  24.330  -8.215

  No H/Q in entry =           8
  In of MODEL   64
    1    H    ALA  29           H        ALA  29   8.882  22.326  -2.400
    2    HA   ALA  29           HA       ALA  29   8.284  24.517  -0.733
    3    HB2  ALA  29           HB1      ALA  29   7.569  22.944   0.837
    4    HB1  ALA  29           HB2      ALA  29   8.813  21.778   0.387
    5    HB3  ALA  29           HB3      ALA  29   7.430  22.044  -0.673

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LYS  30           H        LYS  30  11.052  22.294  -0.771
    2    HA   LYS  30           HA       LYS  30  12.337  23.282   1.536
    3    HB2  LYS  30           HB2      LYS  30  13.473  22.001  -0.960
    4    HB3  LYS  30           HB3      LYS  30  14.439  22.384   0.467
    5    HG2  LYS  30           HG2      LYS  30  12.898  20.982   1.842
    6    HG3  LYS  30           HG3      LYS  30  12.031  20.538   0.368
    7    HD2  LYS  30           HD2      LYS  30  14.099  19.581  -0.573
    8    HD3  LYS  30           HD3      LYS  30  14.985  20.039   0.883
    9    HE2  LYS  30           HE2      LYS  30  13.494  18.590   2.234
   10    HE3  LYS  30           HE3      LYS  30  12.638  18.112   0.762
   11    HZ2  LYS  30           HZ1      LYS  30  14.450  16.568   1.544
   12    HZ1  LYS  30           HZ2      LYS  30  15.571  17.771   1.095
   13    HZ3  LYS  30           HZ3      LYS  30  14.555  17.065  -0.074

  No H/Q in entry =          13
  In of MODEL   64
    1    H    GLN  31           H        GLN  31  12.232  24.468  -1.767
    2    HA   GLN  31           HA       GLN  31  14.350  26.398  -1.340
    3    HB2  GLN  31           HB2      GLN  31  12.323  26.401  -3.579
    4    HB3  GLN  31           HB3      GLN  31  13.931  27.123  -3.572
    5    HG2  GLN  31           HG2      GLN  31  14.434  24.438  -2.980
    6    HG3  GLN  31           HG3      GLN  31  13.140  24.356  -4.167
    7   HE21  GLN  31          HE21      GLN  31  15.999  23.609  -4.547
    8   HE22  GLN  31          HE22      GLN  31  16.564  24.585  -5.814

  No H/Q in entry =           8
  In of MODEL   64
    1    H    GLY  32           H        GLY  32  11.271  26.171  -0.216
    2    HA3  GLY  32           HA2      GLY  32  10.080  27.726   1.041
    3    HA2  GLY  32           HA3      GLY  32  11.188  28.977   0.493

  No H/Q in entry =           3
  In of MODEL   64
    1    H    ASP  33           H        ASP  33   9.874  27.038  -2.000
    2    HA   ASP  33           HA       ASP  33   8.178  29.279  -2.878
    3    HB2  ASP  33           HB2      ASP  33   9.322  26.871  -4.301
    4    HB3  ASP  33           HB3      ASP  33   8.158  27.964  -5.045

  No H/Q in entry =           4
  In of MODEL   64
    1    H    PHE  34           H        PHE  34   6.487  28.783  -1.325
    2    HA   PHE  34           HA       PHE  34   5.148  26.289  -1.227
    3    HB2  PHE  34           HB2      PHE  34   4.136  29.063  -0.568
    4    HB3  PHE  34           HB3      PHE  34   3.309  27.561  -0.155
    5    HD1  PHE  34           HD1      PHE  34   5.510  30.002   1.064
    6    HD2  PHE  34           HD2      PHE  34   4.900  25.750   1.026
    7    HE1  PHE  34           HE1      PHE  34   6.889  29.785   3.111
    8    HE2  PHE  34           HE2      PHE  34   6.282  25.537   3.072
    9    HZ   PHE  34           HZ       PHE  34   7.271  27.555   4.114

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ALA  35           H        ALA  35   4.685  29.135  -3.255
    2    HA   ALA  35           HA       ALA  35   2.151  28.474  -4.295
    3    HB3  ALA  35           HB1      ALA  35   3.195  29.873  -6.332
    4    HB2  ALA  35           HB2      ALA  35   4.398  30.261  -5.101
    5    HB1  ALA  35           HB3      ALA  35   2.698  30.643  -4.825

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ALA  36           H        ALA  36   5.400  27.848  -5.623
    2    HA   ALA  36           HA       ALA  36   4.452  26.391  -7.866
    3    HB3  ALA  36           HB1      ALA  36   6.613  26.549  -8.467
    4    HB2  ALA  36           HB2      ALA  36   7.102  25.535  -7.108
    5    HB1  ALA  36           HB3      ALA  36   6.965  27.282  -6.902

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ALA  37           H        ALA  37   5.401  25.429  -4.600
    2    HA   ALA  37           HA       ALA  37   5.392  22.638  -5.015
    3    HB2  ALA  37           HB1      ALA  37   5.084  24.436  -2.648
    4    HB1  ALA  37           HB2      ALA  37   6.241  23.136  -2.925
    5    HB3  ALA  37           HB3      ALA  37   4.582  22.757  -2.464

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LYS  38           H        LYS  38   2.814  24.809  -3.876
    2    HA   LYS  38           HA       LYS  38   0.744  22.962  -3.660
    3    HB2  LYS  38           HB2      LYS  38   1.047  25.725  -3.420
    4    HB3  LYS  38           HB3      LYS  38  -0.140  25.551  -4.707
    5    HG2  LYS  38           HG2      LYS  38  -1.578  24.211  -3.268
    6    HG3  LYS  38           HG3      LYS  38  -0.342  24.178  -2.003
    7    HD2  LYS  38           HD2      LYS  38  -0.570  26.513  -1.568
    8    HD3  LYS  38           HD3      LYS  38  -1.476  26.779  -3.059
    9    HE2  LYS  38           HE2      LYS  38  -2.994  26.798  -1.130
   10    HE3  LYS  38           HE3      LYS  38  -3.337  25.410  -2.168
   11    HZ3  LYS  38           HZ1      LYS  38  -2.598  23.959  -0.622
   12    HZ2  LYS  38           HZ2      LYS  38  -2.978  25.216   0.458
   13    HZ1  LYS  38           HZ3      LYS  38  -1.376  24.989  -0.054

  No H/Q in entry =          13
  In of MODEL   64
    1    H    ALA  39           H        ALA  39   1.712  24.867  -6.511
    2    HA   ALA  39           HA       ALA  39  -0.336  23.956  -8.224
    3    HB2  ALA  39           HB1      ALA  39   2.396  24.645  -9.262
    4    HB1  ALA  39           HB2      ALA  39   1.403  25.894  -8.510
    5    HB3  ALA  39           HB3      ALA  39   0.815  25.039  -9.936

  No H/Q in entry =           5
  In of MODEL   64
    1    H    MET  40           H        MET  40   2.919  22.715  -7.615
    2    HA   MET  40           HA       MET  40   2.869  20.684  -9.597
    3    HB2  MET  40           HB2      MET  40   4.458  20.947  -7.038
    4    HB3  MET  40           HB3      MET  40   4.739  19.689  -8.244
    5    HG2  MET  40           HG2      MET  40   4.751  22.643  -8.924
    6    HG3  MET  40           HG3      MET  40   6.209  21.767  -8.460
    7    HE3  MET  40           HE1      MET  40   7.139  19.553 -11.251
    8    HE2  MET  40           HE2      MET  40   6.569  19.232  -9.616
    9    HE1  MET  40           HE3      MET  40   7.644  20.596  -9.914

  No H/Q in entry =           9
  In of MODEL   64
    1    H    MET  41           H        MET  41   1.929  20.727  -6.180
    2    HA   MET  41           HA       MET  41   1.441  17.955  -5.892
    3    HB2  MET  41           HB2      MET  41   0.059  20.296  -4.563
    4    HB3  MET  41           HB3      MET  41  -0.072  18.618  -4.047
    5    HG2  MET  41           HG2      MET  41   2.635  18.887  -4.066
    6    HG3  MET  41           HG3      MET  41   2.163  20.540  -3.682
    7    HE2  MET  41           HE1      MET  41  -0.867  19.244  -1.972
    8    HE1  MET  41           HE2      MET  41  -0.074  20.769  -2.351
    9    HE3  MET  41           HE3      MET  41  -0.135  20.205  -0.681

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ASP  42           H        ASP  42  -0.636  20.640  -6.894
    2    HA   ASP  42           HA       ASP  42  -3.052  19.236  -7.042
    3    HB2  ASP  42           HB2      ASP  42  -2.388  21.817  -7.306
    4    HB3  ASP  42           HB3      ASP  42  -2.519  21.412  -9.014

  No H/Q in entry =           4
  In of MODEL   64
    1    H    GLN  43           H        GLN  43  -0.604  19.857  -9.529
    2    HA   GLN  43           HA       GLN  43  -1.952  18.504 -11.622
    3    HB2  GLN  43           HB2      GLN  43   0.994  19.073 -11.221
    4    HB3  GLN  43           HB3      GLN  43   0.302  18.414 -12.706
    5    HG2  GLN  43           HG2      GLN  43  -1.244  20.414 -12.768
    6    HG3  GLN  43           HG3      GLN  43  -0.312  21.093 -11.437
    7   HE21  GLN  43          HE21      GLN  43  -0.164  22.706 -13.530
    8   HE22  GLN  43          HE22      GLN  43   1.261  22.505 -14.426

  No H/Q in entry =           8
  In of MODEL   64
    1    H    SER  44           H        SER  44   0.400  17.416  -9.208
    2    HA   SER  44           HA       SER  44   0.788  14.811 -10.218
    3    HB2  SER  44           HB2      SER  44   1.641  16.276  -7.983
    4    HB3  SER  44           HB3      SER  44   0.798  14.881  -7.311
    5    HG   SER  44           HG       SER  44   2.923  14.296  -7.719

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ARG  45           H        ARG  45  -1.572  16.100  -7.904
    2    HA   ARG  45           HA       ARG  45  -2.921  13.718  -7.267
    3    HB2  ARG  45           HB2      ARG  45  -3.166  15.888  -6.088
    4    HB3  ARG  45           HB3      ARG  45  -4.024  16.533  -7.484
    5    HG2  ARG  45           HG2      ARG  45  -5.761  14.778  -7.205
    6    HG3  ARG  45           HG3      ARG  45  -4.917  14.188  -5.773
    7    HD2  ARG  45           HD2      ARG  45  -5.171  16.456  -4.729
    8    HD3  ARG  45           HD3      ARG  45  -6.157  16.951  -6.122
    9    HE   ARG  45           HE       ARG  45  -7.232  14.561  -5.078
   10   HH21  ARG  45          HH11      ARG  45  -9.078  14.610  -3.821
   11   HH22  ARG  45          HH12      ARG  45  -9.505  16.046  -2.962
   12   HH11  ARG  45          HH21      ARG  45  -6.752  17.822  -4.066
   13   HH12  ARG  45          HH22      ARG  45  -8.183  17.866  -3.099

  No H/Q in entry =          13
  In of MODEL   64
    1    H    MET  46           H        MET  46  -3.529  16.099  -9.834
    2    HA   MET  46           HA       MET  46  -5.839  14.880 -10.907
    3    HB2  MET  46           HB2      MET  46  -3.762  16.740 -12.073
    4    HB3  MET  46           HB3      MET  46  -5.125  16.152 -13.032
    5    HG2  MET  46           HG2      MET  46  -6.703  17.064 -11.400
    6    HG3  MET  46           HG3      MET  46  -5.374  17.588 -10.371
    7    HE2  MET  46           HE1      MET  46  -7.103  19.195 -14.156
    8    HE1  MET  46           HE2      MET  46  -6.978  17.523 -13.620
    9    HE3  MET  46           HE3      MET  46  -5.691  18.226 -14.599

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ALA  47           H        ALA  47  -2.397  14.459 -11.637
    2    HA   ALA  47           HA       ALA  47  -2.694  12.715 -13.841
    3    HB3  ALA  47           HB1      ALA  47  -0.536  13.645 -13.478
    4    HB2  ALA  47           HB2      ALA  47  -0.366  11.921 -13.134
    5    HB1  ALA  47           HB3      ALA  47  -0.489  13.078 -11.808

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LEU  48           H        LEU  48  -2.439  12.101 -10.362
    2    HA   LEU  48           HA       LEU  48  -2.480   9.259 -10.507
    3    HB2  LEU  48           HB2      LEU  48  -3.296  11.174  -8.309
    4    HB3  LEU  48           HB3      LEU  48  -3.172   9.426  -8.098
    5    HG   LEU  48           HG       LEU  48  -0.897  11.162  -9.087
    6   HD13  LEU  48          HD11      LEU  48  -1.209  11.938  -6.903
    7   HD12  LEU  48          HD12      LEU  48  -0.024  10.653  -6.689
    8   HD11  LEU  48          HD13      LEU  48  -1.720  10.361  -6.302
    9   HD22  LEU  48          HD21      LEU  48  -0.353   8.983  -9.713
   10   HD21  LEU  48          HD22      LEU  48  -1.220   8.259  -8.360
   11   HD23  LEU  48          HD23      LEU  48   0.337   9.042  -8.092

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ASN  49           H        ASN  49  -4.992  11.708 -10.136
    2    HA   ASN  49           HA       ASN  49  -7.151  10.006  -9.604
    3    HB2  ASN  49           HB2      ASN  49  -7.269  12.422  -9.287
    4    HB3  ASN  49           HB3      ASN  49  -7.073  12.689 -11.014
    5   HD21  ASN  49          HD21      ASN  49  -9.384  12.619  -8.643
    6   HD22  ASN  49          HD22      ASN  49 -10.739  12.224  -9.583

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLU  50           H        GLU  50  -5.870  11.211 -12.688
    2    HA   GLU  50           HA       GLU  50  -7.789   9.912 -14.342
    3    HB2  GLU  50           HB2      GLU  50  -6.350  11.753 -15.155
    4    HB3  GLU  50           HB3      GLU  50  -4.938  10.708 -15.001
    5    HG2  GLU  50           HG2      GLU  50  -5.871   9.146 -16.637
    6    HG3  GLU  50           HG3      GLU  50  -7.349  10.097 -16.740

  No H/Q in entry =           6
  In of MODEL   64
    1    H    ALA  51           H        ALA  51  -4.610   8.984 -13.108
    2    HA   ALA  51           HA       ALA  51  -4.415   6.527 -14.512
    3    HB2  ALA  51           HB1      ALA  51  -2.437   6.281 -13.396
    4    HB1  ALA  51           HB2      ALA  51  -3.145   6.698 -11.836
    5    HB3  ALA  51           HB3      ALA  51  -2.704   7.971 -12.973

  No H/Q in entry =           5
  In of MODEL   64
    1    H    HIS  52           H        HIS  52  -5.627   7.353 -11.276
    2    HA   HIS  52           HA       HIS  52  -6.272   4.735 -10.437
    3    HB2  HIS  52           HB2      HIS  52  -6.181   6.674  -8.916
    4    HB3  HIS  52           HB3      HIS  52  -7.610   7.348  -9.699
    5    HD1  HIS  52           HD1      HIS  52  -9.868   5.979  -9.425
    6    HD2  HIS  52           HD2      HIS  52  -6.712   4.644  -7.051
    7    HE1  HIS  52           HE1      HIS  52 -10.883   4.461  -7.671
    8    HE2  HIS  52           HE2      HIS  52  -8.971   3.638  -6.215

  No H/Q in entry =           8
  In of MODEL   64
    1    H    LEU  53           H        LEU  53  -8.122   7.151 -12.251
    2    HA   LEU  53           HA       LEU  53 -10.604   5.814 -12.276
    3    HB2  LEU  53           HB2      LEU  53  -9.342   7.807 -14.148
    4    HB3  LEU  53           HB3      LEU  53 -10.927   7.114 -14.476
    5    HG   LEU  53           HG       LEU  53 -10.248   8.456 -11.839
    6   HD13  LEU  53          HD11      LEU  53 -11.318  10.467 -12.697
    7   HD12  LEU  53          HD12      LEU  53 -11.657   9.671 -14.233
    8   HD11  LEU  53          HD13      LEU  53  -9.996  10.030 -13.772
    9   HD21  LEU  53          HD21      LEU  53 -12.788   7.526 -13.190
   10   HD23  LEU  53          HD22      LEU  53 -12.830   8.800 -11.978
   11   HD22  LEU  53          HD23      LEU  53 -12.253   7.202 -11.547

  No H/Q in entry =          11
  In of MODEL   64
    1    H    VAL  54           H        VAL  54  -7.833   5.655 -14.491
    2    HA   VAL  54           HA       VAL  54  -9.010   3.854 -16.335
    3    HB   VAL  54           HB       VAL  54  -6.117   4.415 -15.632
    4   HG12  VAL  54          HG11      VAL  54  -5.832   3.323 -18.014
    5   HG11  VAL  54          HG12      VAL  54  -7.349   2.517 -17.618
    6   HG13  VAL  54          HG13      VAL  54  -5.938   2.292 -16.587
    7   HG22  VAL  54          HG21      VAL  54  -6.912   6.339 -16.693
    8   HG21  VAL  54          HG22      VAL  54  -8.083   5.450 -17.666
    9   HG23  VAL  54          HG23      VAL  54  -6.372   5.398 -18.083

  No H/Q in entry =           9
  In of MODEL   64
    1    H    GLN  55           H        GLN  55  -7.024   3.357 -13.417
    2    HA   GLN  55           HA       GLN  55  -6.883   0.541 -13.658
    3    HB2  GLN  55           HB2      GLN  55  -5.356   1.472 -12.132
    4    HB3  GLN  55           HB3      GLN  55  -6.595   2.420 -11.316
    5    HG2  GLN  55           HG2      GLN  55  -7.263   0.658  -9.995
    6    HG3  GLN  55           HG3      GLN  55  -7.008  -0.531 -11.266
    7   HE21  GLN  55          HE21      GLN  55  -5.363  -1.950 -10.751
    8   HE22  GLN  55          HE22      GLN  55  -3.992  -1.570  -9.830

  No H/Q in entry =           8
  In of MODEL   64
    1    H    THR  56           H        THR  56  -9.264   2.671 -12.073
    2    HA   THR  56           HA       THR  56 -10.826   0.767 -10.786
    3    HB   THR  56           HB       THR  56 -11.952   3.127 -12.314
    4    HG1  THR  56           HG1      THR  56 -10.175   3.034 -10.289
    5   HG23  THR  56          HG21      THR  56 -13.770   2.995 -10.859
    6   HG22  THR  56          HG22      THR  56 -12.858   2.107  -9.639
    7   HG21  THR  56          HG23      THR  56 -13.389   1.293 -11.112

  No H/Q in entry =           7
  In of MODEL   64
    1    H    LYS  57           H        LYS  57 -11.019   1.829 -14.179
    2    HA   LYS  57           HA       LYS  57 -13.140   0.101 -14.941
    3    HB2  LYS  57           HB2      LYS  57 -12.351   2.036 -16.287
    4    HB3  LYS  57           HB3      LYS  57 -10.829   1.206 -16.574
    5    HG2  LYS  57           HG2      LYS  57 -12.198   0.880 -18.521
    6    HG3  LYS  57           HG3      LYS  57 -12.134  -0.655 -17.664
    7    HD2  LYS  57           HD2      LYS  57 -14.339  -0.373 -16.789
    8    HD3  LYS  57           HD3      LYS  57 -14.386   1.327 -17.248
    9    HE2  LYS  57           HE2      LYS  57 -14.375   0.716 -19.628
   10    HE3  LYS  57           HE3      LYS  57 -14.244  -0.994 -19.218
   11    HZ2  LYS  57           HZ1      LYS  57 -16.516   0.834 -18.723
   12    HZ1  LYS  57           HZ2      LYS  57 -16.365  -0.660 -17.926
   13    HZ3  LYS  57           HZ3      LYS  57 -16.499  -0.606 -19.619

  No H/Q in entry =          13
  In of MODEL   64
    1    H    LEU  58           H        LEU  58  -9.630  -0.269 -14.854
    2    HA   LEU  58           HA       LEU  58  -9.584  -2.792 -16.130
    3    HB2  LEU  58           HB2      LEU  58  -7.587  -1.456 -14.312
    4    HB3  LEU  58           HB3      LEU  58  -7.293  -2.978 -15.156
    5    HG   LEU  58           HG       LEU  58  -8.080  -0.394 -16.539
    6   HD11  LEU  58          HD11      LEU  58  -5.419  -1.581 -15.820
    7   HD13  LEU  58          HD12      LEU  58  -5.943   0.101 -15.785
    8   HD12  LEU  58          HD13      LEU  58  -5.578  -0.672 -17.324
    9   HD22  LEU  58          HD21      LEU  58  -8.616  -1.974 -18.126
   10   HD21  LEU  58          HD22      LEU  58  -7.559  -3.200 -17.430
   11   HD23  LEU  58          HD23      LEU  58  -6.883  -1.920 -18.436

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  59           H        ILE  59 -10.447  -1.887 -12.890
    2    HA   ILE  59           HA       ILE  59 -10.056  -4.643 -11.925
    3    HB   ILE  59           HB       ILE  59  -9.659  -2.366 -10.534
    4   HG12  ILE  59          HG12      ILE  59 -11.015  -4.716  -9.199
    5   HG13  ILE  59          HG13      ILE  59  -9.372  -4.796  -9.782
    6   HG22  ILE  59          HG21      ILE  59 -12.402  -3.110  -9.577
    7   HG21  ILE  59          HG22      ILE  59 -12.225  -1.915 -10.842
    8   HG23  ILE  59          HG23      ILE  59 -11.494  -1.651  -9.260
    9   HD11  ILE  59          HD11      ILE  59  -8.875  -2.733  -8.419
   10   HD13  ILE  59          HD12      ILE  59  -9.235  -4.172  -7.474
   11   HD12  ILE  59          HD13      ILE  59 -10.466  -2.926  -7.688

  No H/Q in entry =          11
  In of MODEL   64
    1    H    GLU  60           H        GLU  60 -12.647  -2.377 -12.766
    2    HA   GLU  60           HA       GLU  60 -14.813  -3.926 -11.763
    3    HB2  GLU  60           HB2      GLU  60 -15.046  -1.555 -12.382
    4    HB3  GLU  60           HB3      GLU  60 -14.734  -1.956 -14.068
    5    HG2  GLU  60           HG2      GLU  60 -16.754  -3.388 -14.096
    6    HG3  GLU  60           HG3      GLU  60 -17.075  -2.960 -12.429

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLY  61           H        GLY  61 -13.115  -3.898 -14.864
    2    HA3  GLY  61           HA2      GLY  61 -14.781  -6.177 -15.756
    3    HA2  GLY  61           HA3      GLY  61 -13.947  -5.063 -16.833

  No H/Q in entry =           3
  In of MODEL   64
    1    H    ASP  62           H        ASP  62 -12.570  -6.472 -13.930
    2    HA   ASP  62           HA       ASP  62 -10.282  -7.412 -15.372
    3    HB2  ASP  62           HB2      ASP  62  -9.606  -8.259 -13.112
    4    HB3  ASP  62           HB3      ASP  62 -10.009  -6.545 -13.138

  No H/Q in entry =           4
  In of MODEL   64
    1    H    ALA  63           H        ALA  63 -13.137  -9.024 -13.944
    2    HA   ALA  63           HA       ALA  63 -12.250 -11.710 -14.215
    3    HB1  ALA  63           HB1      ALA  63 -15.095 -10.685 -14.497
    4    HB2  ALA  63           HB2      ALA  63 -14.291 -10.890 -12.942
    5    HB3  ALA  63           HB3      ALA  63 -14.593 -12.291 -13.972

  No H/Q in entry =           5
  In of MODEL   64
    1    H    GLY  64           H        GLY  64 -13.907  -9.500 -16.395
    2    HA3  GLY  64           HA2      GLY  64 -14.448  -9.610 -18.622
    3    HA2  GLY  64           HA3      GLY  64 -12.915 -10.455 -18.788

  No H/Q in entry =           3
  In of MODEL   64
    1    H    GLU  65           H        GLU  65 -12.909 -12.630 -19.203
    2    HA   GLU  65           HA       GLU  65 -15.178 -13.822 -20.282
    3    HB2  GLU  65           HB2      GLU  65 -12.683 -15.127 -19.194
    4    HB3  GLU  65           HB3      GLU  65 -13.896 -15.948 -20.177
    5    HG2  GLU  65           HG2      GLU  65 -12.384 -13.464 -21.031
    6    HG3  GLU  65           HG3      GLU  65 -11.981 -15.105 -21.531

  No H/Q in entry =           6
  In of MODEL   64
    1    H    GLY  66           H        GLY  66 -15.431 -16.311 -19.411
    2    HA3  GLY  66           HA2      GLY  66 -17.351 -16.197 -17.375
    3    HA2  GLY  66           HA3      GLY  66 -16.642 -17.657 -18.038

  No H/Q in entry =           3
  In of MODEL   64
    1    H    LYS  67           H        LYS  67 -13.956 -17.070 -17.259
    2    HA   LYS  67           HA       LYS  67 -13.953 -18.224 -14.688
    3    HB2  LYS  67           HB2      LYS  67 -11.535 -18.113 -14.856
    4    HB3  LYS  67           HB3      LYS  67 -12.222 -18.597 -16.411
    5    HG2  LYS  67           HG2      LYS  67 -12.143 -16.211 -17.147
    6    HG3  LYS  67           HG3      LYS  67 -11.343 -15.801 -15.631
    7    HD2  LYS  67           HD2      LYS  67  -9.477 -17.310 -16.198
    8    HD3  LYS  67           HD3      LYS  67 -10.279 -17.731 -17.713
    9    HE2  LYS  67           HE2      LYS  67  -8.805 -16.029 -18.382
   10    HE3  LYS  67           HE3      LYS  67 -10.315 -15.154 -18.130
   11    HZ2  LYS  67           HZ1      LYS  67  -8.075 -15.390 -16.196
   12    HZ1  LYS  67           HZ2      LYS  67  -9.555 -14.622 -15.878
   13    HZ3  LYS  67           HZ3      LYS  67  -8.510 -14.001 -17.065

  No H/Q in entry =          13
  In of MODEL   64
    1    H    MET  68           H        MET  68 -13.675 -17.525 -12.729
    2    HA   MET  68           HA       MET  68 -14.237 -14.856 -12.006
    3    HB2  MET  68           HB2      MET  68 -13.238 -17.222 -10.428
    4    HB3  MET  68           HB3      MET  68 -13.680 -15.680  -9.693
    5    HG2  MET  68           HG2      MET  68 -15.940 -15.866 -10.683
    6    HG3  MET  68           HG3      MET  68 -15.497 -17.423 -11.384
    7    HE2  MET  68           HE1      MET  68 -17.746 -18.884  -8.795
    8    HE1  MET  68           HE2      MET  68 -17.360 -18.558 -10.483
    9    HE3  MET  68           HE3      MET  68 -18.085 -17.293  -9.493

  No H/Q in entry =           9
  In of MODEL   64
    1    H    LYS  69           H        LYS  69 -11.255 -16.121 -13.013
    2    HA   LYS  69           HA       LYS  69  -9.540 -14.729 -11.218
    3    HB2  LYS  69           HB2      LYS  69  -9.051 -16.024 -13.897
    4    HB3  LYS  69           HB3      LYS  69  -7.765 -15.314 -12.920
    5    HG2  LYS  69           HG2      LYS  69  -8.491 -16.780 -11.012
    6    HG3  LYS  69           HG3      LYS  69  -9.631 -17.561 -12.106
    7    HD2  LYS  69           HD2      LYS  69  -6.655 -17.405 -12.645
    8    HD3  LYS  69           HD3      LYS  69  -7.426 -18.774 -11.843
    9    HE2  LYS  69           HE2      LYS  69  -9.003 -18.859 -13.874
   10    HE3  LYS  69           HE3      LYS  69  -7.848 -17.790 -14.666
   11    HZ3  LYS  69           HZ1      LYS  69  -6.347 -19.422 -14.870
   12    HZ2  LYS  69           HZ2      LYS  69  -7.681 -20.455 -14.681
   13    HZ1  LYS  69           HZ3      LYS  69  -6.689 -20.091 -13.349

  No H/Q in entry =          13
  In of MODEL   64
    1    H    VAL  70           H        VAL  70  -7.895 -13.103 -11.789
    2    HA   VAL  70           HA       VAL  70  -8.950 -11.037 -13.639
    3    HB   VAL  70           HB       VAL  70  -7.948  -9.385 -12.071
    4   HG11  VAL  70          HG11      VAL  70 -10.354 -10.096 -11.952
    5   HG13  VAL  70          HG12      VAL  70  -9.711  -9.548 -10.404
    6   HG12  VAL  70          HG13      VAL  70  -9.899 -11.272 -10.720
    7   HG21  VAL  70          HG21      VAL  70  -7.494 -11.847 -10.338
    8   HG23  VAL  70          HG22      VAL  70  -7.302 -10.181  -9.796
    9   HG22  VAL  70          HG23      VAL  70  -6.236 -10.831 -11.039

  No H/Q in entry =           9
  In of MODEL   64
    1    H    SER  71           H        SER  71  -7.295  -9.590 -14.501
    2    HA   SER  71           HA       SER  71  -5.110 -10.955 -15.677
    3    HB2  SER  71           HB2      SER  71  -6.172  -8.936 -16.666
    4    HB3  SER  71           HB3      SER  71  -5.522  -7.972 -15.343
    5    HG   SER  71           HG       SER  71  -4.158  -9.350 -17.398

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LEU  72           H        LEU  72  -3.027 -11.156 -15.075
    2    HA   LEU  72           HA       LEU  72  -2.334 -10.914 -12.359
    3    HB2  LEU  72           HB2      LEU  72  -0.656 -11.332 -14.828
    4    HB3  LEU  72           HB3      LEU  72  -0.001 -11.377 -13.194
    5    HG   LEU  72           HG       LEU  72  -2.314 -13.122 -14.099
    6   HD11  LEU  72          HD11      LEU  72   0.670 -13.630 -14.070
    7   HD13  LEU  72          HD12      LEU  72  -0.445 -13.807 -15.424
    8   HD12  LEU  72          HD13      LEU  72  -0.517 -14.936 -14.072
    9   HD22  LEU  72          HD21      LEU  72  -2.352 -13.116 -11.753
   10   HD21  LEU  72          HD22      LEU  72  -0.609 -12.938 -11.613
   11   HD23  LEU  72          HD23      LEU  72  -1.299 -14.487 -12.089

  No H/Q in entry =          11
  In of MODEL   64
    1    H    VAL  73           H        VAL  73  -1.628  -8.902 -15.145
    2    HA   VAL  73           HA       VAL  73   0.255  -7.165 -14.036
    3    HB   VAL  73           HB       VAL  73  -0.153  -5.760 -15.903
    4   HG12  VAL  73          HG11      VAL  73  -0.981  -8.449 -16.969
    5   HG11  VAL  73          HG12      VAL  73   0.610  -8.236 -16.241
    6   HG13  VAL  73          HG13      VAL  73   0.153  -7.286 -17.654
    7   HG21  VAL  73          HG21      VAL  73  -2.887  -6.995 -15.782
    8   HG23  VAL  73          HG22      VAL  73  -2.285  -6.384 -17.322
    9   HG22  VAL  73          HG23      VAL  73  -2.440  -5.297 -15.941

  No H/Q in entry =           9
  In of MODEL   64
    1    H    LEU  74           H        LEU  74  -3.144  -7.334 -13.506
    2    HA   LEU  74           HA       LEU  74  -3.811  -4.685 -12.914
    3    HB2  LEU  74           HB2      LEU  74  -5.515  -6.373 -13.091
    4    HB3  LEU  74           HB3      LEU  74  -4.816  -7.288 -11.757
    5    HG   LEU  74           HG       LEU  74  -5.319  -5.429 -10.212
    6   HD11  LEU  74          HD11      LEU  74  -6.303  -4.158 -12.767
    7   HD13  LEU  74          HD12      LEU  74  -5.212  -3.481 -11.560
    8   HD12  LEU  74          HD13      LEU  74  -6.929  -3.658 -11.195
    9   HD22  LEU  74          HD21      LEU  74  -7.528  -6.017  -9.986
   10   HD21  LEU  74          HD22      LEU  74  -6.979  -7.263 -11.086
   11   HD23  LEU  74          HD23      LEU  74  -7.849  -5.884 -11.712

  No H/Q in entry =          11
  In of MODEL   64
    1    H    VAL  75           H        VAL  75  -2.746  -7.242 -10.729
    2    HA   VAL  75           HA       VAL  75  -2.593  -5.674  -8.392
    3    HB   VAL  75           HB       VAL  75  -1.045  -8.147  -9.154
    4   HG13  VAL  75          HG11      VAL  75   0.175  -6.901  -7.411
    5   HG12  VAL  75          HG12      VAL  75  -0.637  -8.275  -6.675
    6   HG11  VAL  75          HG13      VAL  75  -1.318  -6.665  -6.507
    7   HG22  VAL  75          HG21      VAL  75  -2.733  -9.315  -7.971
    8   HG21  VAL  75          HG22      VAL  75  -3.633  -8.119  -8.902
    9   HG23  VAL  75          HG23      VAL  75  -3.323  -7.850  -7.186

  No H/Q in entry =           9
  In of MODEL   64
    1    H    GLU  76           H        GLU  76  -0.151  -6.409 -10.904
    2    HA   GLU  76           HA       GLU  76   2.003  -5.019  -9.736
    3    HB2  GLU  76           HB2      GLU  76   2.251  -6.502 -11.707
    4    HB3  GLU  76           HB3      GLU  76   1.323  -5.371 -12.679
    5    HG2  GLU  76           HG2      GLU  76   3.655  -4.989 -13.162
    6    HG3  GLU  76           HG3      GLU  76   3.101  -3.622 -12.215

  No H/Q in entry =           6
  In of MODEL   64
    1    H    ALA  77           H        ALA  77  -0.530  -3.873 -11.953
    2    HA   ALA  77           HA       ALA  77   0.418  -1.212 -12.136
    3    HB2  ALA  77           HB1      ALA  77  -1.972  -0.708 -12.814
    4    HB3  ALA  77           HB2      ALA  77  -2.341  -2.403 -12.493
    5    HB1  ALA  77           HB3      ALA  77  -1.181  -1.978 -13.751

  No H/Q in entry =           5
  In of MODEL   64
    1    H    GLN  78           H        GLN  78  -1.843  -2.792  -9.936
    2    HA   GLN  78           HA       GLN  78  -2.701  -0.479  -8.555
    3    HB2  GLN  78           HB2      GLN  78  -3.773  -2.758  -8.466
    4    HB3  GLN  78           HB3      GLN  78  -2.436  -3.287  -7.447
    5    HG2  GLN  78           HG2      GLN  78  -2.999  -1.549  -5.801
    6    HG3  GLN  78           HG3      GLN  78  -4.335  -1.012  -6.817
    7   HE21  GLN  78          HE21      GLN  78  -4.831  -1.965  -4.170
    8   HE22  GLN  78          HE22      GLN  78  -5.660  -3.443  -4.278

  No H/Q in entry =           8
  In of MODEL   64
    1    H    LEU  79           H        LEU  79   0.012  -2.686  -8.069
    2    HA   LEU  79           HA       LEU  79   0.951  -1.759  -5.608
    3    HB2  LEU  79           HB2      LEU  79   1.865  -3.759  -6.657
    4    HB3  LEU  79           HB3      LEU  79   2.506  -2.804  -7.990
    5    HG   LEU  79           HG       LEU  79   4.029  -1.629  -6.480
    6   HD13  LEU  79          HD11      LEU  79   3.002  -1.389  -4.423
    7   HD12  LEU  79          HD12      LEU  79   4.101  -2.718  -4.062
    8   HD11  LEU  79          HD13      LEU  79   2.404  -3.049  -4.405
    9   HD23  LEU  79          HD21      LEU  79   5.268  -3.751  -5.554
   10   HD22  LEU  79          HD22      LEU  79   5.077  -3.565  -7.295
   11   HD21  LEU  79          HD23      LEU  79   4.009  -4.648  -6.406

  No H/Q in entry =          11
  In of MODEL   64
    1    H    HIS  80           H        HIS  80   1.830  -0.646  -8.880
    2    HA   HIS  80           HA       HIS  80   3.594   1.378  -7.955
    3    HB2  HIS  80           HB2      HIS  80   2.340   0.646 -10.544
    4    HB3  HIS  80           HB3      HIS  80   2.904   2.310 -10.378
    5    HD1  HIS  80           HD1      HIS  80   5.304   2.650 -10.881
    6    HD2  HIS  80           HD2      HIS  80   4.544  -1.268  -9.674
    7    HE1  HIS  80           HE1      HIS  80   7.518   1.411 -11.021
    8    HE2  HIS  80           HE2      HIS  80   7.066  -0.980 -10.288

  No H/Q in entry =           8
  In of MODEL   64
    1    H    LEU  81           H        LEU  81   0.197   1.472  -8.964
    2    HA   LEU  81           HA       LEU  81  -0.132   4.261  -8.653
    3    HB2  LEU  81           HB2      LEU  81  -2.106   1.979  -8.578
    4    HB3  LEU  81           HB3      LEU  81  -2.590   3.674  -8.500
    5    HG   LEU  81           HG       LEU  81  -0.857   2.543 -10.714
    6   HD12  LEU  81          HD11      LEU  81  -3.083   2.814 -12.034
    7   HD11  LEU  81          HD12      LEU  81  -3.851   2.741 -10.449
    8   HD13  LEU  81          HD13      LEU  81  -2.878   1.388 -11.020
    9   HD23  LEU  81          HD21      LEU  81  -1.983   4.660 -11.833
   10   HD22  LEU  81          HD22      LEU  81  -0.579   4.863 -10.789
   11   HD21  LEU  81          HD23      LEU  81  -2.195   5.185 -10.164

  No H/Q in entry =          11
  In of MODEL   64
    1    H    MET  82           H        MET  82  -0.761   1.575  -6.394
    2    HA   MET  82           HA       MET  82  -1.861   3.153  -4.325
    3    HB2  MET  82           HB2      MET  82  -0.437   0.492  -4.337
    4    HB3  MET  82           HB3      MET  82  -1.042   1.215  -2.848
    5    HG2  MET  82           HG2      MET  82  -2.744   0.675  -5.302
    6    HG3  MET  82           HG3      MET  82  -2.658  -0.389  -3.900
    7    HE3  MET  82           HE1      MET  82  -4.436   1.244  -1.109
    8    HE2  MET  82           HE2      MET  82  -2.710   1.553  -1.280
    9    HE1  MET  82           HE3      MET  82  -3.364  -0.020  -1.731

  No H/Q in entry =           9
  In of MODEL   64
    1    H    THR  83           H        THR  83   1.466   2.126  -4.980
    2    HA   THR  83           HA       THR  83   2.642   3.266  -2.675
    3    HB   THR  83           HB       THR  83   4.750   3.241  -4.130
    4    HG1  THR  83           HG1      THR  83   4.539   2.699  -6.153
    5   HG22  THR  83          HG21      THR  83   4.360   0.573  -4.451
    6   HG21  THR  83          HG22      THR  83   3.053   0.935  -3.324
    7   HG23  THR  83          HG23      THR  83   4.722   1.312  -2.892

  No H/Q in entry =           7
  In of MODEL   64
    1    H    SER  84           H        SER  84   2.277   4.519  -5.986
    2    HA   SER  84           HA       SER  84   3.566   6.987  -5.533
    3    HB2  SER  84           HB2      SER  84   1.529   6.104  -7.565
    4    HB3  SER  84           HB3      SER  84   2.177   7.744  -7.543
    5    HG   SER  84           HG       SER  84   3.598   5.294  -7.809

  No H/Q in entry =           5
  In of MODEL   64
    1    H    MET  85           H        MET  85   0.085   6.166  -5.387
    2    HA   MET  85           HA       MET  85  -0.830   8.763  -4.809
    3    HB2  MET  85           HB2      MET  85  -2.311   6.921  -5.480
    4    HB3  MET  85           HB3      MET  85  -2.024   6.131  -3.931
    5    HG2  MET  85           HG2      MET  85  -2.966   8.074  -2.749
    6    HG3  MET  85           HG3      MET  85  -3.222   8.893  -4.288
    7    HE3  MET  85           HE1      MET  85  -4.108   4.854  -3.460
    8    HE2  MET  85           HE2      MET  85  -5.372   5.421  -2.372
    9    HE1  MET  85           HE3      MET  85  -3.717   5.978  -2.153

  No H/Q in entry =           9
  In of MODEL   64
    1    H    LEU  86           H        LEU  86   0.120   6.130  -2.642
    2    HA   LEU  86           HA       LEU  86  -0.459   7.436  -0.212
    3    HB2  LEU  86           HB2      LEU  86   0.054   4.972  -0.588
    4    HB3  LEU  86           HB3      LEU  86   1.753   5.432  -0.671
    5    HG   LEU  86           HG       LEU  86   1.388   6.599   1.588
    6   HD11  LEU  86          HD11      LEU  86  -1.288   5.782   1.098
    7   HD13  LEU  86          HD12      LEU  86  -0.648   6.549   2.550
    8   HD12  LEU  86          HD13      LEU  86  -0.707   4.791   2.440
    9   HD23  LEU  86          HD21      LEU  86   1.012   3.600   1.723
   10   HD22  LEU  86          HD22      LEU  86   1.987   4.633   2.766
   11   HD21  LEU  86          HD23      LEU  86   2.508   4.308   1.114

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ALA  87           H        ALA  87   2.543   7.185  -2.074
    2    HA   ALA  87           HA       ALA  87   4.209   8.634  -0.342
    3    HB3  ALA  87           HB1      ALA  87   4.345   7.609  -3.043
    4    HB2  ALA  87           HB2      ALA  87   5.664   7.968  -1.932
    5    HB1  ALA  87           HB3      ALA  87   5.036   9.232  -2.988

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ARG  88           H        ARG  88   2.266   9.721  -3.085
    2    HA   ARG  88           HA       ARG  88   2.993  12.424  -2.976
    3    HB2  ARG  88           HB2      ARG  88   1.775  11.241  -4.838
    4    HB3  ARG  88           HB3      ARG  88   0.307  11.364  -3.868
    5    HG2  ARG  88           HG2      ARG  88   1.281  13.962  -3.790
    6    HG3  ARG  88           HG3      ARG  88   1.728  13.447  -5.414
    7    HD2  ARG  88           HD2      ARG  88  -0.408  13.487  -6.130
    8    HD3  ARG  88           HD3      ARG  88  -0.993  12.631  -4.703
    9    HE   ARG  88           HE       ARG  88  -1.225  15.403  -5.137
   10   HH21  ARG  88          HH11      ARG  88  -1.790  16.733  -3.411
   11   HH22  ARG  88          HH12      ARG  88  -1.498  16.209  -1.788
   12   HH11  ARG  88          HH21      ARG  88  -0.192  13.171  -2.742
   13   HH12  ARG  88          HH22      ARG  88  -0.611  14.186  -1.410

  No H/Q in entry =          13
  In of MODEL   64
    1    H    GLU  89           H        GLU  89   0.304  10.714  -1.350
    2    HA   GLU  89           HA       GLU  89  -0.852  13.013  -0.167
    3    HB2  GLU  89           HB2      GLU  89  -1.932  10.755  -0.251
    4    HB3  GLU  89           HB3      GLU  89  -0.810  10.225   1.002
    5    HG2  GLU  89           HG2      GLU  89  -1.671  11.918   2.545
    6    HG3  GLU  89           HG3      GLU  89  -2.724  12.565   1.289

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LEU  90           H        LEU  90   1.626  10.767   1.040
    2    HA   LEU  90           HA       LEU  90   1.940  12.030   3.566
    3    HB2  LEU  90           HB2      LEU  90   3.756  10.276   1.913
    4    HB3  LEU  90           HB3      LEU  90   4.153  10.808   3.552
    5    HG   LEU  90           HG       LEU  90   1.546   9.417   2.876
    6   HD12  LEU  90          HD11      LEU  90   2.710   7.394   3.904
    7   HD11  LEU  90          HD12      LEU  90   4.220   8.273   3.671
    8   HD13  LEU  90          HD13      LEU  90   3.226   7.843   2.278
    9   HD22  LEU  90          HD21      LEU  90   1.249  10.346   4.991
   10   HD21  LEU  90          HD22      LEU  90   2.965  10.268   5.388
   11   HD23  LEU  90          HD23      LEU  90   1.981   8.806   5.435

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  91           H        ILE  91   3.564  12.422   0.450
    2    HA   ILE  91           HA       ILE  91   5.505  14.288   1.297
    3    HB   ILE  91           HB       ILE  91   4.224  13.764  -1.391
    4   HG12  ILE  91          HG12      ILE  91   7.055  13.326  -0.391
    5   HG13  ILE  91          HG13      ILE  91   5.791  12.109  -0.233
    6   HG22  ILE  91          HG21      ILE  91   6.431  15.142  -2.068
    7   HG21  ILE  91          HG22      ILE  91   6.096  15.945  -0.534
    8   HG23  ILE  91          HG23      ILE  91   4.883  15.948  -1.813
    9   HD13  ILE  91          HD11      ILE  91   5.642  11.771  -2.540
   10   HD12  ILE  91          HD12      ILE  91   7.370  12.042  -2.313
   11   HD11  ILE  91          HD13      ILE  91   6.345  13.347  -2.915

  No H/Q in entry =          11
  In of MODEL   64
    1    H    THR  92           H        THR  92   2.145  14.664   0.259
    2    HA   THR  92           HA       THR  92   2.076  17.486   0.183
    3    HB   THR  92           HB       THR  92  -0.066  15.462   0.875
    4    HG1  THR  92           HG1      THR  92   0.259  15.278  -1.207
    5   HG22  THR  92          HG21      THR  92  -1.494  17.599   0.130
    6   HG21  THR  92          HG22      THR  92  -0.120  18.449   0.835
    7   HG23  THR  92          HG23      THR  92  -1.052  17.318   1.814

  No H/Q in entry =           7
  In of MODEL   64
    1    H    GLU  93           H        GLU  93   1.541  15.191   2.844
    2    HA   GLU  93           HA       GLU  93   0.963  17.097   4.849
    3    HB2  GLU  93           HB2      GLU  93   2.315  14.393   5.109
    4    HB3  GLU  93           HB3      GLU  93   1.599  15.316   6.432
    5    HG2  GLU  93           HG2      GLU  93   0.019  14.502   3.984
    6    HG3  GLU  93           HG3      GLU  93   0.124  13.488   5.418

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LEU  94           H        LEU  94   4.001  15.655   3.732
    2    HA   LEU  94           HA       LEU  94   5.718  16.838   5.628
    3    HB2  LEU  94           HB2      LEU  94   6.158  15.862   2.806
    4    HB3  LEU  94           HB3      LEU  94   7.470  16.545   3.763
    5    HG   LEU  94           HG       LEU  94   5.754  14.329   4.895
    6   HD11  LEU  94          HD11      LEU  94   7.870  14.124   2.782
    7   HD13  LEU  94          HD12      LEU  94   6.437  13.130   3.036
    8   HD12  LEU  94          HD13      LEU  94   7.858  12.903   4.056
    9   HD23  LEU  94          HD21      LEU  94   7.942  13.831   6.068
   10   HD22  LEU  94          HD22      LEU  94   7.248  15.401   6.471
   11   HD21  LEU  94          HD23      LEU  94   8.597  15.295   5.340

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  95           H        ILE  95   4.588  17.976   2.463
    2    HA   ILE  95           HA       ILE  95   6.125  20.357   2.405
    3    HB   ILE  95           HB       ILE  95   3.503  19.627   1.081
    4   HG12  ILE  95          HG12      ILE  95   6.295  20.000  -0.035
    5   HG13  ILE  95          HG13      ILE  95   5.665  18.440   0.483
    6   HG21  ILE  95          HG21      ILE  95   5.217  22.119   0.862
    7   HG23  ILE  95          HG22      ILE  95   3.490  22.027   1.204
    8   HG22  ILE  95          HG23      ILE  95   4.093  21.627  -0.405
    9   HD13  ILE  95          HD11      ILE  95   4.121  18.332  -1.259
   10   HD12  ILE  95          HD12      ILE  95   5.465  19.167  -2.040
   11   HD11  ILE  95          HD13      ILE  95   4.073  20.084  -1.464

  No H/Q in entry =          11
  In of MODEL   64
    1    H    GLU  96           H        GLU  96   2.876  19.663   3.676
    2    HA   GLU  96           HA       GLU  96   2.210  22.304   4.408
    3    HB2  GLU  96           HB2      GLU  96   0.562  20.496   4.415
    4    HB3  GLU  96           HB3      GLU  96   1.425  19.688   5.722
    5    HG2  GLU  96           HG2      GLU  96   0.372  20.964   7.276
    6    HG3  GLU  96           HG3      GLU  96   0.892  22.441   6.476

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LEU  97           H        LEU  97   4.076  19.789   6.062
    2    HA   LEU  97           HA       LEU  97   4.393  21.155   8.529
    3    HB2  LEU  97           HB2      LEU  97   5.974  19.002   7.138
    4    HB3  LEU  97           HB3      LEU  97   6.541  19.703   8.652
    5    HG   LEU  97           HG       LEU  97   3.750  18.566   8.323
    6   HD12  LEU  97          HD11      LEU  97   4.709  16.574   9.554
    7   HD11  LEU  97          HD12      LEU  97   6.314  17.227   9.220
    8   HD13  LEU  97          HD13      LEU  97   5.262  16.747   7.888
    9   HD23  LEU  97          HD21      LEU  97   4.186  18.292  10.893
   10   HD22  LEU  97          HD22      LEU  97   3.787  19.894  10.277
   11   HD21  LEU  97          HD23      LEU  97   5.462  19.481  10.638

  No H/Q in entry =          11
  In of MODEL   64
    1    H    HIS  98           H        HIS  98   6.289  21.183   5.519
    2    HA   HIS  98           HA       HIS  98   8.412  22.798   6.428
    3    HB2  HIS  98           HB2      HIS  98   7.145  22.511   3.693
    4    HB3  HIS  98           HB3      HIS  98   8.568  23.511   3.990
    5    HD1  HIS  98           HD1      HIS  98   7.409  19.924   4.018
    6    HD2  HIS  98           HD2      HIS  98  10.955  22.074   4.462
    7    HE1  HIS  98           HE1      HIS  98   9.288  18.221   3.985
    8    HE2  HIS  98           HE2      HIS  98  11.453  19.510   4.256

  No H/Q in entry =           8
  In of MODEL   64
    1    H    GLU  99           H        GLU  99   5.189  23.581   5.221
    2    HA   GLU  99           HA       GLU  99   5.528  26.401   5.152
    3    HB2  GLU  99           HB2      GLU  99   3.676  25.199   4.012
    4    HB3  GLU  99           HB3      GLU  99   2.972  24.836   5.587
    5    HG2  GLU  99           HG2      GLU  99   2.753  27.227   6.074
    6    HG3  GLU  99           HG3      GLU  99   3.536  27.630   4.550

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LYS 100           H        LYS 100   4.408  24.162   7.676
    2    HA   LYS 100           HA       LYS 100   3.777  26.217   9.554
    3    HB2  LYS 100           HB2      LYS 100   4.391  23.276   9.920
    4    HB3  LYS 100           HB3      LYS 100   3.917  24.348  11.243
    5    HG2  LYS 100           HG2      LYS 100   1.853  24.951   9.974
    6    HG3  LYS 100           HG3      LYS 100   2.307  23.782   8.731
    7    HD2  LYS 100           HD2      LYS 100   2.241  21.968  10.401
    8    HD3  LYS 100           HD3      LYS 100   1.804  23.131  11.655
    9    HE2  LYS 100           HE2      LYS 100  -0.247  23.718  10.372
   10    HE3  LYS 100           HE3      LYS 100   0.180  22.497   9.166
   11    HZ1  LYS 100           HZ1      LYS 100  -0.101  21.841  12.048
   12    HZ3  LYS 100           HZ2      LYS 100  -0.090  20.781  10.718
   13    HZ2  LYS 100           HZ3      LYS 100  -1.422  21.803  10.982

  No H/Q in entry =          13
  In of MODEL   64
    1    H    LEU 101           H        LEU 101   6.732  24.458   8.754
    2    HA   LEU 101           HA       LEU 101   8.300  25.331  10.967
    3    HB2  LEU 101           HB2      LEU 101   8.932  24.339   8.199
    4    HB3  LEU 101           HB3      LEU 101  10.216  25.027   9.188
    5    HG   LEU 101           HG       LEU 101   8.405  22.851  10.247
    6   HD12  LEU 101          HD11      LEU 101  10.484  21.382   9.664
    7   HD11  LEU 101          HD12      LEU 101  10.844  22.644   8.488
    8   HD13  LEU 101          HD13      LEU 101   9.328  21.749   8.385
    9   HD21  LEU 101          HD21      LEU 101  11.107  24.000  10.992
   10   HD23  LEU 101          HD22      LEU 101  10.581  22.423  11.575
   11   HD22  LEU 101          HD23      LEU 101   9.665  23.869  11.998

  No H/Q in entry =          11
  In of MODEL   64
    1    H    LYS 102           H        LYS 102   6.709  27.162   8.804
    2    HA   LYS 102           HA       LYS 102   6.758  29.455   8.501
    3    HB2  LYS 102           HB2      LYS 102   8.306  29.371  10.613
    4    HB3  LYS 102           HB3      LYS 102   9.613  29.577   9.464
    5    HG2  LYS 102           HG2      LYS 102   7.473  31.506  10.298
    6    HG3  LYS 102           HG3      LYS 102   9.184  31.788  10.059
    7    HD2  LYS 102           HD2      LYS 102   7.259  31.327   7.745
    8    HD3  LYS 102           HD3      LYS 102   7.615  32.915   8.409
    9    HE2  LYS 102           HE2      LYS 102   9.021  31.739   6.353
   10    HE3  LYS 102           HE3      LYS 102   9.611  33.059   7.363
   11    HZ2  LYS 102           HZ1      LYS 102  11.159  31.174   7.210
   12    HZ1  LYS 102           HZ2      LYS 102  10.004  30.180   7.948
   13    HZ3  LYS 102           HZ3      LYS 102  10.671  31.480   8.806

  No H/Q in entry =          13
  In of MODEL   64
    1    H    ALA 103           H        ALA 103  10.037  28.157   7.971
    2    HA   ALA 103           HA       ALA 103  11.000  29.536   5.896
    3    HB2  ALA 103           HB1      ALA 103  11.923  27.330   4.987
    4    HB1  ALA 103           HB2      ALA 103  11.027  26.550   6.289
    5    HB3  ALA 103           HB3      ALA 103  12.298  27.713   6.667

  No H/Q in entry =           5
  In of MODEL   64
    1    H1   LYS   3           H1       LYS   3 -30.892   6.791 -19.399
    2    H2   LYS   3           H3       LYS   3 -29.934   6.479 -20.765
    3    H3   LYS   3           H2       LYS   3 -31.358   5.591 -20.506
    4    HA   LYS   3           HA       LYS   3 -30.386   4.155 -19.131
    5    HB2  LYS   3           HB2      LYS   3 -28.074   5.496 -20.483
    6    HB3  LYS   3           HB3      LYS   3 -27.776   4.264 -19.256
    7    HG2  LYS   3           HG2      LYS   3 -29.273   2.744 -20.600
    8    HG3  LYS   3           HG3      LYS   3 -29.203   3.954 -21.880
    9    HD2  LYS   3           HD2      LYS   3 -26.726   3.750 -21.868
   10    HD3  LYS   3           HD3      LYS   3 -26.874   2.446 -20.691
   11    HE2  LYS   3           HE2      LYS   3 -28.439   1.342 -22.395
   12    HE3  LYS   3           HE3      LYS   3 -27.794   2.507 -23.549
   13    HZ3  LYS   3           HZ1      LYS   3 -26.046   1.217 -23.856
   14    HZ2  LYS   3           HZ2      LYS   3 -26.702   0.063 -22.799
   15    HZ1  LYS   3           HZ3      LYS   3 -25.660   1.264 -22.203

  No H/Q in entry =          15
  In of MODEL   64
    1    H    LYS   4           H        LYS   4 -30.414   3.994 -17.070
    2    HA   LYS   4           HA       LYS   4 -29.576   6.236 -15.410
    3    HB2  LYS   4           HB2      LYS   4 -30.866   3.583 -14.717
    4    HB3  LYS   4           HB3      LYS   4 -30.580   4.901 -13.582
    5    HG2  LYS   4           HG2      LYS   4 -32.423   4.930 -15.977
    6    HG3  LYS   4           HG3      LYS   4 -32.886   4.982 -14.278
    7    HD2  LYS   4           HD2      LYS   4 -32.105   7.174 -14.002
    8    HD3  LYS   4           HD3      LYS   4 -31.089   7.091 -15.440
    9    HE2  LYS   4           HE2      LYS   4 -32.969   8.540 -15.861
   10    HE3  LYS   4           HE3      LYS   4 -33.118   7.081 -16.841
   11    HZ3  LYS   4           HZ1      LYS   4 -34.703   6.214 -15.279
   12    HZ2  LYS   4           HZ2      LYS   4 -35.210   7.734 -15.842
   13    HZ1  LYS   4           HZ3      LYS   4 -34.536   7.584 -14.291

  No H/Q in entry =          13
  In of MODEL   64
    1    H    HIS   5           H        HIS   5 -28.083   6.251 -13.840
    2    HA   HIS   5           HA       HIS   5 -25.876   4.340 -14.222
    3    HB2  HIS   5           HB2      HIS   5 -26.008   7.090 -12.986
    4    HB3  HIS   5           HB3      HIS   5 -24.564   6.081 -13.001
    5    HD1  HIS   5           HD1      HIS   5 -23.072   7.237 -14.601
    6    HD2  HIS   5           HD2      HIS   5 -26.916   6.778 -16.104
    7    HE1  HIS   5           HE1      HIS   5 -22.918   7.835 -17.048
    8    HE2  HIS   5           HE2      HIS   5 -25.262   7.542 -17.933

  No H/Q in entry =           8
  In of MODEL   64
    1    H    ILE   6           H        ILE   6 -25.689   2.746 -12.922
    2    HA   ILE   6           HA       ILE   6 -26.613   3.025 -10.142
    3    HB   ILE   6           HB       ILE   6 -25.908   0.544 -11.714
    4   HG12  ILE   6          HG12      ILE   6 -28.600   1.578 -10.814
    5   HG13  ILE   6          HG13      ILE   6 -27.975   1.730 -12.455
    6   HG23  ILE   6          HG21      ILE   6 -26.302  -0.711  -9.859
    7   HG22  ILE   6          HG22      ILE   6 -27.404   0.473  -9.153
    8   HG21  ILE   6          HG23      ILE   6 -25.662   0.740  -9.086
    9   HD13  ILE   6          HD11      ILE   6 -28.525  -0.364 -12.968
   10   HD12  ILE   6          HD12      ILE   6 -29.517  -0.322 -11.511
   11   HD11  ILE   6          HD13      ILE   6 -27.887  -0.994 -11.449

  No H/Q in entry =          11
  In of MODEL   64
    1    H    TYR   7           H        TYR   7 -24.812   3.585  -8.875
    2    HA   TYR   7           HA       TYR   7 -22.151   2.529  -9.604
    3    HB2  TYR   7           HB2      TYR   7 -22.996   4.985  -8.087
    4    HB3  TYR   7           HB3      TYR   7 -21.334   4.404  -8.155
    5    HD1  TYR   7           HD1      TYR   7 -22.455   3.533 -11.238
    6    HD2  TYR   7           HD2      TYR   7 -21.612   7.055  -8.991
    7    HE1  TYR   7           HE1      TYR   7 -22.005   4.764 -13.325
    8    HE2  TYR   7           HE2      TYR   7 -21.203   8.293 -11.068
    9    HH   TYR   7           HH       TYR   7 -21.458   8.237 -13.297

  No H/Q in entry =           9
  In of MODEL   64
    1    H    LEU   8           H        LEU   8 -21.220   1.127  -8.302
    2    HA   LEU   8           HA       LEU   8 -22.330   0.652  -5.607
    3    HB2  LEU   8           HB2      LEU   8 -20.722  -1.060  -7.480
    4    HB3  LEU   8           HB3      LEU   8 -20.898  -1.451  -5.770
    5    HG   LEU   8           HG       LEU   8 -23.388  -1.521  -6.157
    6   HD13  LEU   8          HD11      LEU   8 -23.501  -0.280  -8.253
    7   HD12  LEU   8          HD12      LEU   8 -24.100  -1.920  -8.501
    8   HD11  LEU   8          HD13      LEU   8 -22.482  -1.480  -9.045
    9   HD23  LEU   8          HD21      LEU   8 -22.221  -3.594  -7.887
   10   HD22  LEU   8          HD22      LEU   8 -23.293  -3.732  -6.495
   11   HD21  LEU   8          HD23      LEU   8 -21.571  -3.449  -6.255

  No H/Q in entry =          11
  In of MODEL   64
    1    H    PHE   9           H        PHE   9 -21.012   0.992  -3.832
    2    HA   PHE   9           HA       PHE   9 -18.205   1.825  -4.397
    3    HB2  PHE   9           HB2      PHE   9 -20.154   2.934  -2.383
    4    HB3  PHE   9           HB3      PHE   9 -18.427   3.265  -2.346
    5    HD1  PHE   9           HD1      PHE   9 -17.349   4.540  -4.148
    6    HD2  PHE   9           HD2      PHE   9 -21.593   3.913  -4.085
    7    HE1  PHE   9           HE1      PHE   9 -17.635   6.302  -5.865
    8    HE2  PHE   9           HE2      PHE   9 -21.879   5.687  -5.797
    9    HZ   PHE   9           HZ       PHE   9 -19.899   6.877  -6.693

  No H/Q in entry =           9
  In of MODEL   64
    1    H    SER  10           H        SER  10 -16.648   0.738  -3.405
    2    HA   SER  10           HA       SER  10 -16.795  -0.188  -0.708
    3    HB2  SER  10           HB2      SER  10 -18.089  -1.992  -1.833
    4    HB3  SER  10           HB3      SER  10 -16.707  -2.288  -2.875
    5    HG   SER  10           HG       SER  10 -15.606  -3.097  -1.232

  No H/Q in entry =           5
  In of MODEL   64
    1    H    SER  11           H        SER  11 -14.767  -0.032   0.050
    2    HA   SER  11           HA       SER  11 -12.617   0.795  -1.522
    3    HB2  SER  11           HB2      SER  11 -11.356   0.775   0.431
    4    HB3  SER  11           HB3      SER  11 -13.008   0.934   1.032
    5    HG   SER  11           HG       SER  11 -13.017  -1.325   1.357

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ALA  12           H        ALA  12 -13.875  -1.948  -2.245
    2    HA   ALA  12           HA       ALA  12 -11.309  -3.156  -2.922
    3    HB1  ALA  12           HB1      ALA  12 -13.392  -5.005  -1.807
    4    HB3  ALA  12           HB2      ALA  12 -12.278  -4.178  -0.719
    5    HB2  ALA  12           HB3      ALA  12 -11.651  -5.248  -1.972

  No H/Q in entry =           5
  In of MODEL   64
    1    H    GLY  13           H        GLY  13 -12.079  -2.235  -4.917
    2    HA3  GLY  13           HA2      GLY  13 -14.392  -2.820  -6.316
    3    HA2  GLY  13           HA3      GLY  13 -12.840  -2.469  -7.088

  No H/Q in entry =           3
  In of MODEL   64
    1    H    MET  14           H        MET  14 -11.414  -4.810  -6.238
    2    HA   MET  14           HA       MET  14 -11.979  -6.544  -8.307
    3    HB2  MET  14           HB2      MET  14  -9.885  -6.744  -7.073
    4    HB3  MET  14           HB3      MET  14 -10.735  -7.355  -5.655
    5    HG2  MET  14           HG2      MET  14 -11.479  -9.321  -6.965
    6    HG3  MET  14           HG3      MET  14 -10.627  -8.699  -8.379
    7    HE3  MET  14           HE1      MET  14  -7.034  -9.038  -7.822
    8    HE2  MET  14           HE2      MET  14  -7.763  -7.564  -7.188
    9    HE1  MET  14           HE3      MET  14  -8.404  -8.294  -8.658

  No H/Q in entry =           9
  In of MODEL   64
    1    H    SER  15           H        SER  15 -13.093  -7.038  -4.951
    2    HA   SER  15           HA       SER  15 -14.592  -9.388  -5.668
    3    HB2  SER  15           HB2      SER  15 -14.047  -9.330  -3.369
    4    HB3  SER  15           HB3      SER  15 -14.598  -7.666  -3.196
    5    HG   SER  15           HG       SER  15 -16.034 -10.045  -3.193

  No H/Q in entry =           5
  In of MODEL   64
    1    H    THR  16           H        THR  16 -15.530  -5.967  -5.122
    2    HA   THR  16           HA       THR  16 -18.347  -6.352  -5.577
    3    HB   THR  16           HB       THR  16 -16.711  -3.846  -6.106
    4    HG1  THR  16           HG1      THR  16 -17.308  -5.171  -3.775
    5   HG22  THR  16          HG21      THR  16 -19.573  -4.234  -5.196
    6   HG21  THR  16          HG22      THR  16 -19.095  -3.885  -6.867
    7   HG23  THR  16          HG23      THR  16 -18.792  -2.706  -5.583

  No H/Q in entry =           7
  In of MODEL   64
    1    H    SER  17           H        SER  17 -15.565  -5.860  -7.494
    2    HA   SER  17           HA       SER  17 -16.697  -5.054  -9.974
    3    HB2  SER  17           HB2      SER  17 -14.111  -6.474  -9.311
    4    HB3  SER  17           HB3      SER  17 -14.557  -6.023 -10.957
    5    HG   SER  17           HG       SER  17 -14.878  -3.960  -9.241

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LEU  18           H        LEU  18 -16.231  -8.231  -8.560
    2    HA   LEU  18           HA       LEU  18 -16.907  -9.685 -10.920
    3    HB2  LEU  18           HB2      LEU  18 -15.700 -10.716  -9.049
    4    HB3  LEU  18           HB3      LEU  18 -17.100 -10.466  -8.006
    5    HG   LEU  18           HG       LEU  18 -18.427 -11.973  -9.404
    6   HD12  LEU  18          HD11      LEU  18 -16.978 -13.362 -11.074
    7   HD11  LEU  18          HD12      LEU  18 -15.916 -11.954 -11.049
    8   HD13  LEU  18          HD13      LEU  18 -17.589 -11.786 -11.575
    9   HD22  LEU  18          HD21      LEU  18 -17.417 -14.005  -8.724
   10   HD21  LEU  18          HD22      LEU  18 -17.066 -12.785  -7.497
   11   HD23  LEU  18          HD23      LEU  18 -15.821 -13.256  -8.654

  No H/Q in entry =          11
  In of MODEL   64
    1    H    LEU  19           H        LEU  19 -18.791  -8.428  -8.172
    2    HA   LEU  19           HA       LEU  19 -21.309  -9.508  -8.981
    3    HB2  LEU  19           HB2      LEU  19 -20.950  -8.693  -6.723
    4    HB3  LEU  19           HB3      LEU  19 -20.662  -7.066  -7.335
    5    HG   LEU  19           HG       LEU  19 -22.990  -6.833  -7.941
    6   HD11  LEU  19          HD11      LEU  19 -23.050  -9.741  -7.281
    7   HD13  LEU  19          HD12      LEU  19 -23.851  -8.868  -8.586
    8   HD12  LEU  19          HD13      LEU  19 -24.487  -8.775  -6.944
    9   HD23  LEU  19          HD21      LEU  19 -23.010  -7.964  -5.174
   10   HD22  LEU  19          HD22      LEU  19 -23.805  -6.520  -5.801
   11   HD21  LEU  19          HD23      LEU  19 -22.059  -6.527  -5.553

  No H/Q in entry =          11
  In of MODEL   64
    1    H    VAL  20           H        VAL  20 -19.702  -6.400  -9.669
    2    HA   VAL  20           HA       VAL  20 -21.793  -5.264 -11.199
    3    HB   VAL  20           HB       VAL  20 -18.785  -4.788 -11.379
    4   HG13  VAL  20          HG11      VAL  20 -19.663  -4.103 -13.496
    5   HG12  VAL  20          HG12      VAL  20 -19.491  -2.637 -12.533
    6   HG11  VAL  20          HG13      VAL  20 -21.079  -3.369 -12.745
    7   HG21  VAL  20          HG21      VAL  20 -21.035  -3.422  -9.947
    8   HG23  VAL  20          HG22      VAL  20 -19.519  -2.597 -10.300
    9   HG22  VAL  20          HG23      VAL  20 -19.520  -4.044  -9.291

  No H/Q in entry =           9
  In of MODEL   64
    1    H    SER  21           H        SER  21 -19.130  -7.410 -12.282
    2    HA   SER  21           HA       SER  21 -19.946  -7.242 -15.021
    3    HB2  SER  21           HB2      SER  21 -18.593  -9.262 -15.390
    4    HB3  SER  21           HB3      SER  21 -17.704  -8.056 -14.463
    5    HG   SER  21           HG       SER  21 -17.747  -9.291 -12.759

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LYS  22           H        LYS  22 -21.061  -9.409 -12.453
    2    HA   LYS  22           HA       LYS  22 -22.685 -10.951 -14.268
    3    HB2  LYS  22           HB2      LYS  22 -22.931 -10.615 -11.276
    4    HB3  LYS  22           HB3      LYS  22 -23.788 -11.808 -12.250
    5    HG2  LYS  22           HG2      LYS  22 -20.790 -11.689 -11.958
    6    HG3  LYS  22           HG3      LYS  22 -21.847 -12.724 -10.999
    7    HD2  LYS  22           HD2      LYS  22 -22.612 -13.833 -13.058
    8    HD3  LYS  22           HD3      LYS  22 -21.517 -12.816 -13.999
    9    HE2  LYS  22           HE2      LYS  22 -19.594 -13.788 -12.832
   10    HE3  LYS  22           HE3      LYS  22 -20.674 -14.784 -11.858
   11    HZ2  LYS  22           HZ1      LYS  22 -19.510 -15.483 -14.220
   12    HZ1  LYS  22           HZ2      LYS  22 -21.115 -15.136 -14.653
   13    HZ3  LYS  22           HZ3      LYS  22 -20.791 -16.292 -13.451

  No H/Q in entry =          13
  In of MODEL   64
    1    H    MET  23           H        MET  23 -23.268  -8.021 -12.365
    2    HA   MET  23           HA       MET  23 -26.084  -7.983 -12.833
    3    HB2  MET  23           HB2      MET  23 -24.139  -5.756 -12.265
    4    HB3  MET  23           HB3      MET  23 -25.878  -5.515 -12.418
    5    HG2  MET  23           HG2      MET  23 -26.295  -6.821 -10.455
    6    HG3  MET  23           HG3      MET  23 -24.601  -7.301 -10.356
    7    HE2  MET  23           HE1      MET  23 -26.735  -3.572  -9.104
    8    HE1  MET  23           HE2      MET  23 -27.047  -4.516 -10.559
    9    HE3  MET  23           HE3      MET  23 -25.957  -3.132 -10.625

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ARG  24           H        ARG  24 -23.299  -6.650 -14.642
    2    HA   ARG  24           HA       ARG  24 -24.769  -5.271 -16.609
    3    HB2  ARG  24           HB2      ARG  24 -22.305  -4.982 -16.251
    4    HB3  ARG  24           HB3      ARG  24 -22.046  -6.579 -16.910
    5    HG2  ARG  24           HG2      ARG  24 -22.924  -5.837 -19.123
    6    HG3  ARG  24           HG3      ARG  24 -23.188  -4.211 -18.441
    7    HD2  ARG  24           HD2      ARG  24 -20.726  -4.215 -17.767
    8    HD3  ARG  24           HD3      ARG  24 -20.562  -5.680 -18.725
    9    HE   ARG  24           HE       ARG  24 -21.557  -4.053 -20.551
   10   HH21  ARG  24          HH11      ARG  24 -19.971  -3.907 -22.138
   11   HH22  ARG  24          HH12      ARG  24 -18.401  -3.312 -21.727
   12   HH11  ARG  24          HH21      ARG  24 -19.138  -3.428 -18.268
   13   HH12  ARG  24          HH22      ARG  24 -17.921  -3.022 -19.437

  No H/Q in entry =          13
  In of MODEL   64
    1    H    ALA  25           H        ALA  25 -23.781  -8.655 -16.379
    2    HA   ALA  25           HA       ALA  25 -24.478  -9.434 -19.014
    3    HB1  ALA  25           HB1      ALA  25 -23.857 -11.499 -18.347
    4    HB3  ALA  25           HB2      ALA  25 -24.893 -11.449 -16.922
    5    HB2  ALA  25           HB3      ALA  25 -23.305 -10.687 -16.883

  No H/Q in entry =           5
  In of MODEL   64
    1    H    GLN  26           H        GLN  26 -26.264  -9.427 -15.967
    2    HA   GLN  26           HA       GLN  26 -28.669 -10.522 -16.964
    3    HB2  GLN  26           HB2      GLN  26 -28.054  -8.822 -14.566
    4    HB3  GLN  26           HB3      GLN  26 -29.649  -9.476 -14.903
    5    HG2  GLN  26           HG2      GLN  26 -27.120 -11.043 -14.482
    6    HG3  GLN  26           HG3      GLN  26 -28.461 -10.895 -13.354
    7   HE21  GLN  26          HE21      GLN  26 -27.351 -13.095 -14.667
    8   HE22  GLN  26          HE22      GLN  26 -28.446 -14.091 -15.459

  No H/Q in entry =           8
  In of MODEL   64
    1    H    ALA  27           H        ALA  27 -27.589  -7.171 -16.551
    2    HA   ALA  27           HA       ALA  27 -30.042  -5.967 -17.291
    3    HB1  ALA  27           HB1      ALA  27 -28.164  -4.740 -16.187
    4    HB3  ALA  27           HB2      ALA  27 -28.741  -3.935 -17.648
    5    HB2  ALA  27           HB3      ALA  27 -27.243  -4.864 -17.687

  No H/Q in entry =           5
  In of MODEL   64
    1    H    GLU  28           H        GLU  28 -27.418  -7.281 -19.209
    2    HA   GLU  28           HA       GLU  28 -28.342  -6.177 -21.704
    3    HB2  GLU  28           HB2      GLU  28 -25.986  -6.965 -21.119
    4    HB3  GLU  28           HB3      GLU  28 -26.602  -8.603 -21.331
    5    HG2  GLU  28           HG2      GLU  28 -25.449  -7.854 -23.306
    6    HG3  GLU  28           HG3      GLU  28 -27.164  -8.103 -23.635

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LYS  29           H        LYS  29 -28.616  -9.291 -20.077
    2    HA   LYS  29           HA       LYS  29 -30.005 -10.684 -22.079
    3    HB2  LYS  29           HB2      LYS  29 -28.971 -11.733 -20.100
    4    HB3  LYS  29           HB3      LYS  29 -30.199 -10.984 -19.080
    5    HG2  LYS  29           HG2      LYS  29 -31.929 -12.274 -20.140
    6    HG3  LYS  29           HG3      LYS  29 -30.773 -12.947 -21.287
    7    HD2  LYS  29           HD2      LYS  29 -29.658 -14.178 -19.582
    8    HD3  LYS  29           HD3      LYS  29 -30.513 -13.314 -18.305
    9    HE2  LYS  29           HE2      LYS  29 -31.368 -15.626 -18.682
   10    HE3  LYS  29           HE3      LYS  29 -32.597 -14.378 -18.896
   11    HZ1  LYS  29           HZ1      LYS  29 -32.069 -14.509 -21.332
   12    HZ3  LYS  29           HZ2      LYS  29 -32.839 -15.872 -20.672
   13    HZ2  LYS  29           HZ3      LYS  29 -31.173 -15.910 -20.991

  No H/Q in entry =          13
  In of MODEL   64
    1    H    TYR  30           H        TYR  30 -31.275  -8.550 -19.534
    2    HA   TYR  30           HA       TYR  30 -33.971  -8.875 -20.745
    3    HB2  TYR  30           HB2      TYR  30 -33.235  -7.779 -18.021
    4    HB3  TYR  30           HB3      TYR  30 -34.869  -7.963 -18.655
    5    HD1  TYR  30           HD1      TYR  30 -35.878 -10.212 -18.880
    6    HD2  TYR  30           HD2      TYR  30 -31.994  -9.669 -17.221
    7    HE1  TYR  30           HE1      TYR  30 -35.874 -12.550 -18.109
    8    HE2  TYR  30           HE2      TYR  30 -31.992 -11.993 -16.453
    9    HH   TYR  30           HH       TYR  30 -33.742 -14.271 -17.550

  No H/Q in entry =           9
  In of MODEL   64
    1    H    GLU  31           H        GLU  31 -31.734  -6.966 -21.553
    2    HA   GLU  31           HA       GLU  31 -31.582  -4.804 -22.353
    3    HB2  GLU  31           HB2      GLU  31 -34.510  -5.394 -22.835
    4    HB3  GLU  31           HB3      GLU  31 -33.623  -4.055 -23.561
    5    HG2  GLU  31           HG2      GLU  31 -32.228  -5.539 -24.788
    6    HG3  GLU  31           HG3      GLU  31 -32.838  -6.938 -23.906

  No H/Q in entry =           6
  In of MODEL   64
    1    H    VAL  32           H        VAL  32 -31.741  -4.725 -19.619
    2    HA   VAL  32           HA       VAL  32 -33.506  -2.546 -18.912
    3    HB   VAL  32           HB       VAL  32 -31.136  -3.654 -17.374
    4   HG12  VAL  32          HG11      VAL  32 -32.612  -2.789 -15.450
    5   HG11  VAL  32          HG12      VAL  32 -33.424  -1.838 -16.693
    6   HG13  VAL  32          HG13      VAL  32 -31.703  -1.607 -16.392
    7   HG21  VAL  32          HG21      VAL  32 -32.982  -5.292 -18.056
    8   HG23  VAL  32          HG22      VAL  32 -33.972  -4.437 -16.874
    9   HG22  VAL  32          HG23      VAL  32 -32.479  -5.228 -16.368

  No H/Q in entry =           9
  In of MODEL   64
    1    HA   PRO  33           HA       PRO  33 -30.380   0.276 -20.595
    2    HB2  PRO  33           HB2      PRO  33 -31.799   2.557 -20.427
    3    HB3  PRO  33           HB3      PRO  33 -32.334   1.287 -21.528
    4    HG2  PRO  33           HG2      PRO  33 -33.244   1.809 -18.698
    5    HG3  PRO  33           HG3      PRO  33 -34.234   1.657 -20.148
    6    HD2  PRO  33           HD2      PRO  33 -33.841  -0.451 -18.511
    7    HD3  PRO  33           HD3      PRO  33 -33.935  -0.670 -20.259

  No H/Q in entry =           7
  In of MODEL   64
    1    H    VAL  34           H        VAL  34 -29.114  -0.340 -18.669
    2    HA   VAL  34           HA       VAL  34 -28.712   2.053 -16.999
    3    HB   VAL  34           HB       VAL  34 -28.164   0.548 -15.085
    4   HG12  VAL  34          HG11      VAL  34 -30.606  -0.232 -14.755
    5   HG11  VAL  34          HG12      VAL  34 -30.911   0.558 -16.300
    6   HG13  VAL  34          HG13      VAL  34 -30.303   1.495 -14.937
    7   HG21  VAL  34          HG21      VAL  34 -28.457  -1.447 -17.113
    8   HG23  VAL  34          HG22      VAL  34 -29.509  -1.781 -15.736
    9   HG22  VAL  34          HG23      VAL  34 -27.777  -1.566 -15.490

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ILE  35           H        ILE  35 -26.710   2.400 -16.182
    2    HA   ILE  35           HA       ILE  35 -24.476   0.995 -17.490
    3    HB   ILE  35           HB       ILE  35 -24.750   3.889 -16.642
    4   HG12  ILE  35          HG12      ILE  35 -23.854   2.573 -19.214
    5   HG13  ILE  35          HG13      ILE  35 -25.455   3.255 -18.925
    6   HG21  ILE  35          HG21      ILE  35 -22.256   2.261 -17.002
    7   HG23  ILE  35          HG22      ILE  35 -22.647   3.442 -15.754
    8   HG22  ILE  35          HG23      ILE  35 -22.265   3.980 -17.390
    9   HD11  ILE  35          HD11      ILE  35 -23.960   5.386 -18.319
   10   HD13  ILE  35          HD12      ILE  35 -24.533   5.043 -19.951
   11   HD12  ILE  35          HD13      ILE  35 -22.891   4.604 -19.482

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ILE  36           H        ILE  36 -23.266  -0.094 -15.918
    2    HA   ILE  36           HA       ILE  36 -23.644   0.505 -13.036
    3    HB   ILE  36           HB       ILE  36 -22.938  -2.215 -14.185
    4   HG12  ILE  36          HG12      ILE  36 -25.701  -1.310 -13.374
    5   HG13  ILE  36          HG13      ILE  36 -25.152  -1.292 -15.050
    6   HG23  ILE  36          HG21      ILE  36 -23.293  -3.054 -12.076
    7   HG22  ILE  36          HG22      ILE  36 -24.364  -1.733 -11.607
    8   HG21  ILE  36          HG23      ILE  36 -22.622  -1.468 -11.698
    9   HD13  ILE  36          HD11      ILE  36 -25.406  -3.495 -15.278
   10   HD12  ILE  36          HD12      ILE  36 -26.448  -3.347 -13.863
   11   HD11  ILE  36          HD13      ILE  36 -24.765  -3.836 -13.672

  No H/Q in entry =          11
  In of MODEL   64
    1    H    GLU  37           H        GLU  37 -21.825   1.051 -11.949
    2    HA   GLU  37           HA       GLU  37 -19.180   0.161 -12.910
    3    HB2  GLU  37           HB2      GLU  37 -20.071   2.966 -12.340
    4    HB3  GLU  37           HB3      GLU  37 -18.384   2.491 -12.156
    5    HG2  GLU  37           HG2      GLU  37 -18.551   3.522 -14.247
    6    HG3  GLU  37           HG3      GLU  37 -18.430   1.791 -14.559

  No H/Q in entry =           6
  In of MODEL   64
    1    H    ALA  38           H        ALA  38 -17.681  -0.154 -11.250
    2    HA   ALA  38           HA       ALA  38 -18.668   0.033  -8.464
    3    HB1  ALA  38           HB1      ALA  38 -17.050  -1.954  -9.935
    4    HB3  ALA  38           HB2      ALA  38 -18.089  -2.166  -8.526
    5    HB2  ALA  38           HB3      ALA  38 -16.449  -1.548  -8.327

  No H/Q in entry =           5
  In of MODEL   64
    1    H    PHE  39           H        PHE  39 -17.363   1.177  -6.995
    2    HA   PHE  39           HA       PHE  39 -14.805   2.292  -7.913
    3    HB2  PHE  39           HB2      PHE  39 -17.149   3.857  -6.852
    4    HB3  PHE  39           HB3      PHE  39 -15.496   4.463  -6.770
    5    HD1  PHE  39           HD1      PHE  39 -14.197   4.439  -9.041
    6    HD2  PHE  39           HD2      PHE  39 -18.444   4.405  -8.657
    7    HE1  PHE  39           HE1      PHE  39 -14.400   5.351 -11.337
    8    HE2  PHE  39           HE2      PHE  39 -18.663   5.308 -10.945
    9    HZ   PHE  39           HZ       PHE  39 -16.647   5.755 -12.303

  No H/Q in entry =           9
  In of MODEL   64
    1    HA   PRO  40           HA       PRO  40 -13.840   1.454  -3.648
    2    HB2  PRO  40           HB2      PRO  40 -11.991   3.395  -3.043
    3    HB3  PRO  40           HB3      PRO  40 -11.611   2.060  -4.132
    4    HG2  PRO  40           HG2      PRO  40 -12.545   4.840  -4.835
    5    HG3  PRO  40           HG3      PRO  40 -11.156   3.955  -5.468
    6    HD2  PRO  40           HD2      PRO  40 -13.399   3.964  -6.849
    7    HD3  PRO  40           HD3      PRO  40 -12.497   2.457  -6.685

  No H/Q in entry =           7
  In of MODEL   64
    1    H    GLU  41           H        GLU  41 -14.396   2.430  -1.499
    2    HA   GLU  41           HA       GLU  41 -16.575   4.214  -1.433
    3    HB2  GLU  41           HB2      GLU  41 -16.429   4.083   0.930
    4    HB3  GLU  41           HB3      GLU  41 -15.947   2.501   0.316
    5    HG2  GLU  41           HG2      GLU  41 -13.582   3.116   0.656
    6    HG3  GLU  41           HG3      GLU  41 -14.101   4.659   1.332

  No H/Q in entry =           6
  In of MODEL   64
    1    H    THR  42           H        THR  42 -13.214   5.009  -1.520
    2    HA   THR  42           HA       THR  42 -13.457   7.567  -0.276
    3    HB   THR  42           HB       THR  42 -11.293   8.073  -1.365
    4    HG1  THR  42           HG1      THR  42 -10.423   6.583  -2.791
    5   HG23  THR  42          HG21      THR  42 -11.288   6.752   0.702
    6   HG22  THR  42          HG22      THR  42  -9.999   6.213  -0.377
    7   HG21  THR  42          HG23      THR  42 -11.481   5.270  -0.236

  No H/Q in entry =           7
  In of MODEL   64
    1    H    LEU  43           H        LEU  43 -14.441   6.542  -3.375
    2    HA   LEU  43           HA       LEU  43 -14.606   9.332  -4.312
    3    HB2  LEU  43           HB2      LEU  43 -15.070   6.711  -5.723
    4    HB3  LEU  43           HB3      LEU  43 -15.260   8.299  -6.463
    5    HG   LEU  43           HG       LEU  43 -12.654   7.138  -5.509
    6   HD12  LEU  43          HD11      LEU  43 -13.405   7.644  -8.361
    7   HD11  LEU  43          HD12      LEU  43 -13.877   6.136  -7.579
    8   HD13  LEU  43          HD13      LEU  43 -12.173   6.567  -7.703
    9   HD22  LEU  43          HD21      LEU  43 -12.383   9.444  -5.408
   10   HD21  LEU  43          HD22      LEU  43 -13.483   9.735  -6.757
   11   HD23  LEU  43          HD23      LEU  43 -11.873   9.085  -7.058

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ALA  44           H        ALA  44 -16.593   7.558  -2.452
    2    HA   ALA  44           HA       ALA  44 -19.091   7.522  -3.741
    3    HB2  ALA  44           HB1      ALA  44 -18.965   6.378  -1.659
    4    HB3  ALA  44           HB2      ALA  44 -20.019   7.759  -1.357
    5    HB1  ALA  44           HB3      ALA  44 -18.339   7.801  -0.826

  No H/Q in entry =           5
  In of MODEL   64
    1    H    GLY  45           H        GLY  45 -17.550  10.252  -2.199
    2    HA3  GLY  45           HA2      GLY  45 -19.935  11.843  -2.510
    3    HA2  GLY  45           HA3      GLY  45 -18.363  12.405  -1.947

  No H/Q in entry =           3
  In of MODEL   64
    1    H    GLU  46           H        GLU  46 -16.896  11.439  -4.268
    2    HA   GLU  46           HA       GLU  46 -17.476  13.697  -6.005
    3    HB2  GLU  46           HB2      GLU  46 -15.362  11.538  -6.094
    4    HB3  GLU  46           HB3      GLU  46 -15.455  12.888  -7.225
    5    HG2  GLU  46           HG2      GLU  46 -15.060  13.141  -4.251
    6    HG3  GLU  46           HG3      GLU  46 -13.776  13.220  -5.458

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LYS  47           H        LYS  47 -17.490  10.181  -6.479
    2    HA   LYS  47           HA       LYS  47 -18.615  10.470  -9.137
    3    HB2  LYS  47           HB2      LYS  47 -18.089   8.049  -7.406
    4    HB3  LYS  47           HB3      LYS  47 -18.720   7.979  -9.052
    5    HG2  LYS  47           HG2      LYS  47 -16.101   9.272  -8.389
    6    HG3  LYS  47           HG3      LYS  47 -16.248   7.553  -8.750
    7    HD2  LYS  47           HD2      LYS  47 -17.302   8.113 -10.902
    8    HD3  LYS  47           HD3      LYS  47 -17.088   9.826 -10.544
    9    HE2  LYS  47           HE2      LYS  47 -14.663   9.495 -10.454
   10    HE3  LYS  47           HE3      LYS  47 -14.886   7.787 -10.827
   11    HZ2  LYS  47           HZ1      LYS  47 -14.329   9.225 -12.754
   12    HZ1  LYS  47           HZ2      LYS  47 -15.839   9.980 -12.570
   13    HZ3  LYS  47           HZ3      LYS  47 -15.756   8.323 -12.939

  No H/Q in entry =          13
  In of MODEL   64
    1    H    GLY  48           H        GLY  48 -19.923   9.726  -5.979
    2    HA3  GLY  48           HA2      GLY  48 -22.359   8.636  -6.699
    3    HA2  GLY  48           HA3      GLY  48 -22.079   9.605  -5.253

  No H/Q in entry =           3
  In of MODEL   64
    1    H    GLN  49           H        GLN  49 -21.429  12.023  -6.806
    2    HA   GLN  49           HA       GLN  49 -23.948  13.228  -6.903
    3    HB2  GLN  49           HB2      GLN  49 -21.393  14.014  -8.289
    4    HB3  GLN  49           HB3      GLN  49 -22.818  15.030  -8.175
    5    HG2  GLN  49           HG2      GLN  49 -22.625  15.022  -5.740
    6    HG3  GLN  49           HG3      GLN  49 -21.214  13.985  -5.853
    7   HE21  GLN  49          HE21      GLN  49 -20.999  16.193  -4.558
    8   HE22  GLN  49          HE22      GLN  49 -20.039  17.421  -5.206

  No H/Q in entry =           8
  In of MODEL   64
    1    H    ASN  50           H        ASN  50 -22.370  11.315  -9.333
    2    HA   ASN  50           HA       ASN  50 -24.248  12.279 -11.380
    3    HB2  ASN  50           HB2      ASN  50 -21.729  10.648 -11.665
    4    HB3  ASN  50           HB3      ASN  50 -22.781  11.126 -12.990
    5   HD21  ASN  50          HD21      ASN  50 -20.095  11.858 -11.406
    6   HD22  ASN  50          HD22      ASN  50 -19.806  13.488 -11.734

  No H/Q in entry =           6
  In of MODEL   64
    1    H    ALA  51           H        ALA  51 -24.290   9.898  -9.160
    2    HA   ALA  51           HA       ALA  51 -25.177   7.804 -10.998
    3    HB2  ALA  51           HB1      ALA  51 -24.622   6.415  -9.334
    4    HB3  ALA  51           HB2      ALA  51 -25.698   7.252  -8.217
    5    HB1  ALA  51           HB3      ALA  51 -24.041   7.815  -8.430

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ASP  52           H        ASP  52 -27.218   6.821 -10.841
    2    HA   ASP  52           HA       ASP  52 -29.321   8.727 -10.126
    3    HB2  ASP  52           HB2      ASP  52 -29.245   6.235 -11.826
    4    HB3  ASP  52           HB3      ASP  52 -30.756   7.019 -11.362

  No H/Q in entry =           4
  In of MODEL   64
    1    H    VAL  53           H        VAL  53 -27.815   5.769  -9.163
    2    HA   VAL  53           HA       VAL  53 -29.216   5.922  -6.626
    3    HB   VAL  53           HB       VAL  53 -30.692   4.348  -7.868
    4   HG11  VAL  53          HG11      VAL  53 -28.999   3.440  -9.423
    5   HG13  VAL  53          HG12      VAL  53 -29.869   2.167  -8.566
    6   HG12  VAL  53          HG13      VAL  53 -28.235   2.604  -8.073
    7   HG23  VAL  53          HG21      VAL  53 -29.923   2.322  -6.209
    8   HG22  VAL  53          HG22      VAL  53 -30.997   3.664  -5.812
    9   HG21  VAL  53          HG23      VAL  53 -29.279   3.767  -5.427

  No H/Q in entry =           9
  In of MODEL   64
    1    H    VAL  54           H        VAL  54 -27.898   5.422  -4.994
    2    HA   VAL  54           HA       VAL  54 -25.181   4.476  -5.653
    3    HB   VAL  54           HB       VAL  54 -26.153   6.268  -3.370
    4   HG11  VAL  54          HG11      VAL  54 -23.633   4.755  -3.711
    5   HG13  VAL  54          HG12      VAL  54 -24.341   5.447  -2.252
    6   HG12  VAL  54          HG13      VAL  54 -23.412   6.467  -3.349
    7   HG22  VAL  54          HG21      VAL  54 -25.239   8.060  -4.461
    8   HG21  VAL  54          HG22      VAL  54 -25.843   7.107  -5.817
    9   HG23  VAL  54          HG23      VAL  54 -24.130   7.062  -5.402

  No H/Q in entry =           9
  In of MODEL   64
    1    H    LEU  55           H        LEU  55 -24.655   2.526  -5.039
    2    HA   LEU  55           HA       LEU  55 -26.181   1.250  -2.857
    3    HB2  LEU  55           HB2      LEU  55 -24.702   0.048  -5.185
    4    HB3  LEU  55           HB3      LEU  55 -25.480  -0.870  -3.896
    5    HG   LEU  55           HG       LEU  55 -26.883   0.794  -5.976
    6   HD13  LEU  55          HD11      LEU  55 -26.672  -1.055  -7.220
    7   HD12  LEU  55          HD12      LEU  55 -27.646  -1.905  -6.021
    8   HD11  LEU  55          HD13      LEU  55 -25.886  -1.910  -5.893
    9   HD23  LEU  55          HD21      LEU  55 -28.227  -1.121  -4.124
   10   HD22  LEU  55          HD22      LEU  55 -28.880   0.296  -4.947
   11   HD21  LEU  55          HD23      LEU  55 -27.832   0.496  -3.543

  No H/Q in entry =          11
  In of MODEL   64
    1    H    LEU  56           H        LEU  56 -25.030   0.592  -1.073
    2    HA   LEU  56           HA       LEU  56 -22.083   0.875  -1.160
    3    HB2  LEU  56           HB2      LEU  56 -23.861   0.707   1.262
    4    HB3  LEU  56           HB3      LEU  56 -22.136   1.071   1.231
    5    HG   LEU  56           HG       LEU  56 -24.382   2.847   0.317
    6   HD11  LEU  56          HD11      LEU  56 -23.249   2.394   2.817
    7   HD13  LEU  56          HD12      LEU  56 -24.191   3.806   2.339
    8   HD12  LEU  56          HD13      LEU  56 -22.433   3.844   2.229
    9   HD23  LEU  56          HD21      LEU  56 -22.375   4.471   0.114
   10   HD22  LEU  56          HD22      LEU  56 -22.818   3.404  -1.219
   11   HD21  LEU  56          HD23      LEU  56 -21.465   2.988  -0.168

  No H/Q in entry =          11
  In of MODEL   64
    1    H    GLY  57           H        GLY  57 -20.760  -0.813  -0.662
    2    HA3  GLY  57           HA2      GLY  57 -21.788  -3.460  -0.875
    3    HA2  GLY  57           HA3      GLY  57 -20.142  -3.033  -0.412

  No H/Q in entry =           3
  In of MODEL   64
    1    HA   PRO  58           HA       PRO  58 -22.939  -4.003   3.325
    2    HB2  PRO  58           HB2      PRO  58 -22.348  -6.639   3.895
    3    HB3  PRO  58           HB3      PRO  58 -23.728  -6.166   2.906
    4    HG2  PRO  58           HG2      PRO  58 -21.048  -7.144   2.072
    5    HG3  PRO  58           HG3      PRO  58 -22.638  -7.535   1.418
    6    HD2  PRO  58           HD2      PRO  58 -20.977  -5.769   0.192
    7    HD3  PRO  58           HD3      PRO  58 -22.732  -5.613   0.116

  No H/Q in entry =           7
  In of MODEL   64
    1    H    GLN  59           H        GLN  59 -19.597  -4.599   2.666
    2    HA   GLN  59           HA       GLN  59 -18.806  -4.677   5.416
    3    HB2  GLN  59           HB2      GLN  59 -17.168  -3.775   3.045
    4    HB3  GLN  59           HB3      GLN  59 -16.557  -4.226   4.623
    5    HG2  GLN  59           HG2      GLN  59 -17.967  -6.069   2.699
    6    HG3  GLN  59           HG3      GLN  59 -16.229  -5.979   2.935
    7   HE21  GLN  59          HE21      GLN  59 -18.574  -7.679   3.576
    8   HE22  GLN  59          HE22      GLN  59 -18.431  -8.571   4.973

  No H/Q in entry =           8
  In of MODEL   64
    1    H    ILE  60           H        ILE  60 -19.670  -2.067   3.248
    2    HA   ILE  60           HA       ILE  60 -18.715  -0.167   5.301
    3    HB   ILE  60           HB       ILE  60 -18.915   1.589   3.491
    4   HG12  ILE  60          HG12      ILE  60 -18.822  -0.648   1.506
    5   HG13  ILE  60          HG13      ILE  60 -20.374  -0.013   2.052
    6   HG22  ILE  60          HG21      ILE  60 -16.956  -0.352   2.468
    7   HG21  ILE  60          HG22      ILE  60 -16.845   0.078   4.174
    8   HG23  ILE  60          HG23      ILE  60 -16.758   1.335   2.942
    9   HD11  ILE  60          HD11      ILE  60 -19.271   2.306   1.410
   10   HD13  ILE  60          HD12      ILE  60 -20.026   1.290   0.183
   11   HD12  ILE  60          HD13      ILE  60 -18.274   1.287   0.372

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ALA  61           H        ALA  61 -21.228  -1.657   5.388
    2    HA   ALA  61           HA       ALA  61 -23.393   0.098   4.977
    3    HB1  ALA  61           HB1      ALA  61 -24.649  -1.357   6.305
    4    HB2  ALA  61           HB2      ALA  61 -23.253  -1.812   7.284
    5    HB3  ALA  61           HB3      ALA  61 -23.395  -2.396   5.626

  No H/Q in entry =           5
  In of MODEL   64
    1    H    TYR  62           H        TYR  62 -21.155  -0.130   7.744
    2    HA   TYR  62           HA       TYR  62 -22.621   1.568   9.452
    3    HB2  TYR  62           HB2      TYR  62 -20.557   1.893  10.668
    4    HB3  TYR  62           HB3      TYR  62 -20.674   0.205  10.172
    5    HD1  TYR  62           HD1      TYR  62 -19.113  -0.737   8.538
    6    HD2  TYR  62           HD2      TYR  62 -18.836   3.369   9.690
    7    HE1  TYR  62           HE1      TYR  62 -16.907  -0.585   7.449
    8    HE2  TYR  62           HE2      TYR  62 -16.616   3.515   8.601
    9    HH   TYR  62           HH       TYR  62 -15.567   1.598   6.404

  No H/Q in entry =           9
  In of MODEL   64
    1    H    MET  63           H        MET  63 -20.985   2.393   6.583
    2    HA   MET  63           HA       MET  63 -20.697   5.209   7.303
    3    HB2  MET  63           HB2      MET  63 -20.188   3.696   4.741
    4    HB3  MET  63           HB3      MET  63 -19.917   5.427   4.944
    5    HG2  MET  63           HG2      MET  63 -18.204   4.977   6.602
    6    HG3  MET  63           HG3      MET  63 -18.487   3.245   6.438
    7    HE3  MET  63           HE1      MET  63 -18.149   6.139   3.514
    8    HE2  MET  63           HE2      MET  63 -16.388   6.050   3.582
    9    HE1  MET  63           HE3      MET  63 -17.309   6.426   5.039

  No H/Q in entry =           9
  In of MODEL   64
    1    H    LEU  64           H        LEU  64 -23.345   3.468   6.355
    2    HA   LEU  64           HA       LEU  64 -24.526   4.956   4.309
    3    HB2  LEU  64           HB2      LEU  64 -25.465   2.877   5.218
    4    HB3  LEU  64           HB3      LEU  64 -25.868   3.720   6.712
    5    HG   LEU  64           HG       LEU  64 -27.528   5.054   5.521
    6   HD13  LEU  64          HD11      LEU  64 -27.266   5.308   3.287
    7   HD12  LEU  64          HD12      LEU  64 -27.978   3.702   3.135
    8   HD11  LEU  64          HD13      LEU  64 -26.226   3.890   3.171
    9   HD23  LEU  64          HD21      LEU  64 -28.168   2.273   4.751
   10   HD22  LEU  64          HD22      LEU  64 -29.098   3.435   5.698
   11   HD21  LEU  64          HD23      LEU  64 -27.745   2.580   6.436

  No H/Q in entry =          11
  In of MODEL   64
    1    HA   PRO  65           HA       PRO  65 -26.540   8.165   7.123
    2    HB2  PRO  65           HB2      PRO  65 -24.503   8.218   9.351
    3    HB3  PRO  65           HB3      PRO  65 -26.228   8.568   9.424
    4    HG2  PRO  65           HG2      PRO  65 -25.378   6.268  10.314
    5    HG3  PRO  65           HG3      PRO  65 -26.812   6.304   9.289
    6    HD2  PRO  65           HD2      PRO  65 -23.977   5.581   8.539
    7    HD3  PRO  65           HD3      PRO  65 -25.476   4.760   8.104

  No H/Q in entry =           7
  In of MODEL   64
    1    H    GLU  66           H        GLU  66 -22.987   7.964   7.145
    2    HA   GLU  66           HA       GLU  66 -22.582  10.752   6.765
    3    HB2  GLU  66           HB2      GLU  66 -20.874   8.379   6.064
    4    HB3  GLU  66           HB3      GLU  66 -20.358  10.055   5.868
    5    HG2  GLU  66           HG2      GLU  66 -20.522  10.407   8.241
    6    HG3  GLU  66           HG3      GLU  66 -21.112   8.761   8.464

  No H/Q in entry =           6
  In of MODEL   64
    1    H    ILE  67           H        ILE  67 -22.828   8.038   4.486
    2    HA   ILE  67           HA       ILE  67 -22.373   9.752   2.205
    3    HB   ILE  67           HB       ILE  67 -23.389   6.883   2.368
    4   HG12  ILE  67          HG12      ILE  67 -20.726   7.953   1.419
    5   HG13  ILE  67          HG13      ILE  67 -21.015   7.528   3.106
    6   HG21  ILE  67          HG21      ILE  67 -23.285   8.781   0.161
    7   HG23  ILE  67          HG22      ILE  67 -23.977   7.160   0.205
    8   HG22  ILE  67          HG23      ILE  67 -22.264   7.377  -0.146
    9   HD12  ILE  67          HD11      ILE  67 -20.702   5.766   0.732
   10   HD11  ILE  67          HD12      ILE  67 -21.720   5.222   2.063
   11   HD13  ILE  67          HD13      ILE  67 -20.025   5.612   2.354

  No H/Q in entry =          11
  In of MODEL   64
    1    H    GLN  68           H        GLN  68 -25.262   8.801   3.869
    2    HA   GLN  68           HA       GLN  68 -27.077   9.830   1.931
    3    HB2  GLN  68           HB2      GLN  68 -27.307   9.451   4.913
    4    HB3  GLN  68           HB3      GLN  68 -28.614  10.111   3.946
    5    HG2  GLN  68           HG2      GLN  68 -28.746   8.098   2.649
    6    HG3  GLN  68           HG3      GLN  68 -27.311   7.453   3.425
    7   HE21  GLN  68          HE21      GLN  68 -29.548   6.189   3.308
    8   HE22  GLN  68          HE22      GLN  68 -30.375   5.754   4.729

  No H/Q in entry =           8
  In of MODEL   64
    1    H    ARG  69           H        ARG  69 -25.364  11.396   4.662
    2    HA   ARG  69           HA       ARG  69 -26.625  13.940   4.302
    3    HB2  ARG  69           HB2      ARG  69 -24.300  12.892   5.846
    4    HB3  ARG  69           HB3      ARG  69 -24.310  14.617   5.507
    5    HG2  ARG  69           HG2      ARG  69 -26.609  14.750   6.512
    6    HG3  ARG  69           HG3      ARG  69 -26.468  13.047   6.965
    7    HD2  ARG  69           HD2      ARG  69 -24.661  15.316   7.879
    8    HD3  ARG  69           HD3      ARG  69 -25.814  14.449   8.881
    9    HE   ARG  69           HE       ARG  69 -23.259  13.416   7.883
   10   HH21  ARG  69          HH11      ARG  69 -22.512  11.606   9.048
   11   HH22  ARG  69          HH12      ARG  69 -23.559  10.822  10.183
   12   HH11  ARG  69          HH21      ARG  69 -26.213  12.978   9.617
   13   HH12  ARG  69          HH22      ARG  69 -25.654  11.597  10.503

  No H/Q in entry =          13
  In of MODEL   64
    1    H    LEU  70           H        LEU  70 -23.838  12.423   2.885
    2    HA   LEU  70           HA       LEU  70 -22.639  14.751   1.725
    3    HB2  LEU  70           HB2      LEU  70 -21.739  12.385   2.281
    4    HB3  LEU  70           HB3      LEU  70 -22.396  11.965   0.700
    5    HG   LEU  70           HG       LEU  70 -20.759  13.278  -0.394
    6   HD11  LEU  70          HD11      LEU  70 -19.861  14.054   2.390
    7   HD13  LEU  70          HD12      LEU  70 -20.528  15.131   1.164
    8   HD12  LEU  70          HD13      LEU  70 -18.952  14.381   0.913
    9   HD22  LEU  70          HD21      LEU  70 -19.400  11.497  -0.200
   10   HD21  LEU  70          HD22      LEU  70 -20.329  11.001   1.214
   11   HD23  LEU  70          HD23      LEU  70 -18.895  12.008   1.409

  No H/Q in entry =          11
  In of MODEL   64
    1    H    LEU  71           H        LEU  71 -24.919  12.319   0.616
    2    HA   LEU  71           HA       LEU  71 -25.412  13.856  -1.877
    3    HB2  LEU  71           HB2      LEU  71 -25.746  10.879  -1.459
    4    HB3  LEU  71           HB3      LEU  71 -25.857  11.761  -2.982
    5    HG   LEU  71           HG       LEU  71 -23.315  11.642  -1.358
    6   HD12  LEU  71          HD11      LEU  71 -23.478  10.045  -3.805
    7   HD11  LEU  71          HD12      LEU  71 -24.496   9.454  -2.494
    8   HD13  LEU  71          HD13      LEU  71 -22.762   9.652  -2.242
    9   HD22  LEU  71          HD21      LEU  71 -23.358  13.478  -2.831
   10   HD21  LEU  71          HD22      LEU  71 -23.921  12.474  -4.166
   11   HD23  LEU  71          HD23      LEU  71 -22.298  12.246  -3.514

  No H/Q in entry =          11
  In of MODEL   64
    1    HA   PRO  72           HA       PRO  72 -29.257  13.554   0.796
    2    HB2  PRO  72           HB2      PRO  72 -29.996  16.153   0.755
    3    HB3  PRO  72           HB3      PRO  72 -28.694  15.629   1.822
    4    HG2  PRO  72           HG2      PRO  72 -28.493  16.845  -0.921
    5    HG3  PRO  72           HG3      PRO  72 -27.679  17.343   0.561
    6    HD2  PRO  72           HD2      PRO  72 -26.442  15.744  -1.240
    7    HD3  PRO  72           HD3      PRO  72 -26.171  15.546   0.490

  No H/Q in entry =           7
  In of MODEL   64
    1    H    ASN  73           H        ASN  73 -28.637  14.515  -2.416
    2    HA   ASN  73           HA       ASN  73 -31.517  14.347  -3.009
    3    HB2  ASN  73           HB2      ASN  73 -31.029  15.454  -5.102
    4    HB3  ASN  73           HB3      ASN  73 -30.442  16.394  -3.739
    5   HD21  ASN  73          HD21      ASN  73 -29.684  16.430  -6.427
    6   HD22  ASN  73          HD22      ASN  73 -28.028  16.194  -6.646

  No H/Q in entry =           6
  In of MODEL   64
    1    H    LYS  74           H        LYS  74 -29.639  11.997  -2.638
    2    HA   LYS  74           HA       LYS  74 -30.308  10.659  -5.191
    3    HB2  LYS  74           HB2      LYS  74 -27.769  10.229  -3.611
    4    HB3  LYS  74           HB3      LYS  74 -28.214   9.452  -5.132
    5    HG2  LYS  74           HG2      LYS  74 -27.804  12.404  -4.902
    6    HG3  LYS  74           HG3      LYS  74 -26.487  11.281  -5.239
    7    HD2  LYS  74           HD2      LYS  74 -27.675  10.428  -7.175
    8    HD3  LYS  74           HD3      LYS  74 -29.041  11.489  -6.823
    9    HE2  LYS  74           HE2      LYS  74 -27.726  13.439  -7.262
   10    HE3  LYS  74           HE3      LYS  74 -26.252  12.478  -7.386
   11    HZ2  LYS  74           HZ1      LYS  74 -27.722  13.174  -9.483
   12    HZ1  LYS  74           HZ2      LYS  74 -28.444  11.682  -9.116
   13    HZ3  LYS  74           HZ3      LYS  74 -26.778  11.764  -9.436

  No H/Q in entry =          13
  In of MODEL   64
    1    HA   PRO  75           HA       PRO  75 -31.802   7.712  -2.231
    2    HB2  PRO  75           HB2      PRO  75 -32.242   5.529  -3.831
    3    HB3  PRO  75           HB3      PRO  75 -33.302   6.936  -3.869
    4    HG2  PRO  75           HG2      PRO  75 -31.021   6.246  -5.681
    5    HG3  PRO  75           HG3      PRO  75 -32.653   6.768  -6.099
    6    HD2  PRO  75           HD2      PRO  75 -30.623   8.536  -6.066
    7    HD3  PRO  75           HD3      PRO  75 -32.226   9.009  -5.500

  No H/Q in entry =           7
  In of MODEL   64
    1    H    VAL  76           H        VAL  76 -30.383   6.573  -0.890
    2    HA   VAL  76           HA       VAL  76 -27.996   5.257  -2.047
    3    HB   VAL  76           HB       VAL  76 -28.174   6.706   0.630
    4   HG11  VAL  76          HG11      VAL  76 -25.903   5.322  -0.810
    5   HG13  VAL  76          HG12      VAL  76 -26.598   4.888   0.754
    6   HG12  VAL  76          HG13      VAL  76 -25.681   6.385   0.581
    7   HG22  VAL  76          HG21      VAL  76 -27.426   8.582  -0.247
    8   HG21  VAL  76          HG22      VAL  76 -28.025   7.930  -1.774
    9   HG23  VAL  76          HG23      VAL  76 -26.323   7.755  -1.346

  No H/Q in entry =           9
  In of MODEL   64
    1    H    GLU  77           H        GLU  77 -27.874   3.089  -1.459
    2    HA   GLU  77           HA       GLU  77 -28.661   2.312   1.198
    3    HB2  GLU  77           HB2      GLU  77 -30.353   0.750   0.675
    4    HB3  GLU  77           HB3      GLU  77 -30.838   2.305  -0.003
    5    HG2  GLU  77           HG2      GLU  77 -30.298   1.542  -2.207
    6    HG3  GLU  77           HG3      GLU  77 -29.719   0.008  -1.559

  No H/Q in entry =           6
  In of MODEL   64
    1    H    VAL  78           H        VAL  78 -28.426   0.204   1.833
    2    HA   VAL  78           HA       VAL  78 -25.813  -0.685   0.898
    3    HB   VAL  78           HB       VAL  78 -27.529  -1.511   3.279
    4   HG11  VAL  78          HG11      VAL  78 -25.267  -2.840   2.108
    5   HG13  VAL  78          HG12      VAL  78 -26.176  -3.282   3.554
    6   HG12  VAL  78          HG13      VAL  78 -24.800  -2.187   3.677
    7   HG22  VAL  78          HG21      VAL  78 -25.986  -0.235   4.609
    8   HG21  VAL  78          HG22      VAL  78 -26.693   0.783   3.354
    9   HG23  VAL  78          HG23      VAL  78 -25.046   0.177   3.176

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ILE  79           H        ILE  79 -25.381  -2.607  -0.034
    2    HA   ILE  79           HA       ILE  79 -27.530  -3.970  -1.367
    3    HB   ILE  79           HB       ILE  79 -24.566  -4.642  -1.195
    4   HG12  ILE  79          HG12      ILE  79 -26.179  -3.436  -3.448
    5   HG13  ILE  79          HG13      ILE  79 -25.241  -2.483  -2.298
    6   HG22  ILE  79          HG21      ILE  79 -25.755  -5.743  -3.508
    7   HG21  ILE  79          HG22      ILE  79 -26.745  -6.231  -2.132
    8   HG23  ILE  79          HG23      ILE  79 -25.019  -6.593  -2.151
    9   HD13  ILE  79          HD11      ILE  79 -23.860  -2.644  -4.138
   10   HD12  ILE  79          HD12      ILE  79 -24.285  -4.331  -4.430
   11   HD11  ILE  79          HD13      ILE  79 -23.259  -3.905  -3.059

  No H/Q in entry =          11
  In of MODEL   64
    1    H    ASP  80           H        ASP  80 -28.478  -5.855  -0.790
    2    HA   ASP  80           HA       ASP  80 -28.431  -6.785   1.847
    3    HB2  ASP  80           HB2      ASP  80 -30.234  -7.259   0.228
    4    HB3  ASP  80           HB3      ASP  80 -29.138  -8.312  -0.669

  No H/Q in entry =           4
  In of MODEL   64
    1    H    SER  81           H        SER  81 -26.936  -8.004   2.943
    2    HA   SER  81           HA       SER  81 -24.492  -8.793   1.708
    3    HB2  SER  81           HB2      SER  81 -23.956  -9.863   3.858
    4    HB3  SER  81           HB3      SER  81 -24.589  -8.235   4.101
    5    HG   SER  81           HG       SER  81 -26.296  -9.014   5.028

  No H/Q in entry =           5
  In of MODEL   64
    1    H    LEU  82           H        LEU  82 -27.296 -10.755   2.049
    2    HA   LEU  82           HA       LEU  82 -25.871 -13.190   1.483
    3    HB2  LEU  82           HB2      LEU  82 -28.780 -12.442   1.254
    4    HB3  LEU  82           HB3      LEU  82 -28.144 -14.075   1.059
    5    HG   LEU  82           HG       LEU  82 -28.028 -12.464   3.592
    6   HD11  LEU  82          HD11      LEU  82 -29.925 -14.531   2.518
    7   HD13  LEU  82          HD12      LEU  82 -30.284 -13.028   3.371
    8   HD12  LEU  82          HD13      LEU  82 -29.638 -14.411   4.254
    9   HD21  LEU  82          HD21      LEU  82 -27.101 -15.184   2.721
   10   HD23  LEU  82          HD22      LEU  82 -27.481 -14.860   4.411
   11   HD22  LEU  82          HD23      LEU  82 -26.212 -13.941   3.601

  No H/Q in entry =          11
  In of MODEL   64
    1    H    LEU  83           H        LEU  83 -27.747 -10.852  -0.385
    2    HA   LEU  83           HA       LEU  83 -27.647 -12.194  -2.871
    3    HB2  LEU  83           HB2      LEU  83 -27.907  -9.276  -2.190
    4    HB3  LEU  83           HB3      LEU  83 -27.992  -9.903  -3.836
    5    HG   LEU  83           HG       LEU  83 -30.012 -10.213  -1.635
    6   HD13  LEU  83          HD11      LEU  83 -30.692  -8.320  -2.670
    7   HD12  LEU  83          HD12      LEU  83 -31.227  -9.398  -3.958
    8   HD11  LEU  83          HD13      LEU  83 -29.655  -8.606  -4.065
    9   HD23  LEU  83          HD21      LEU  83 -30.250 -11.436  -4.369
   10   HD22  LEU  83          HD22      LEU  83 -31.216 -11.752  -2.928
   11   HD21  LEU  83          HD23      LEU  83 -29.555 -12.336  -3.022

  No H/Q in entry =          11
  In of MODEL   64
    1    H    TYR  84           H        TYR  84 -25.557  -9.923  -1.201
    2    HA   TYR  84           HA       TYR  84 -23.704  -9.504  -3.355
    3    HB2  TYR  84           HB2      TYR  84 -24.110  -8.000  -1.333
    4    HB3  TYR  84           HB3      TYR  84 -23.170  -9.167  -0.404
    5    HD1  TYR  84           HD1      TYR  84 -20.829  -9.794  -1.593
    6    HD2  TYR  84           HD2      TYR  84 -22.972  -6.137  -2.113
    7    HE1  TYR  84           HE1      TYR  84 -18.740  -8.687  -2.315
    8    HE2  TYR  84           HE2      TYR  84 -20.894  -5.021  -2.846
    9    HH   TYR  84           HH       TYR  84 -18.021  -5.945  -2.228

  No H/Q in entry =           9
  In of MODEL   64
    1    H    GLY  85           H        GLY  85 -23.519 -11.545  -0.431
    2    HA3  GLY  85           HA2      GLY  85 -20.998 -12.607  -0.960
    3    HA2  GLY  85           HA3      GLY  85 -22.254 -13.402  -0.013

  No H/Q in entry =           3
  In of MODEL   64
    1    H    LYS  86           H        LYS  86 -24.146 -13.665  -2.050
    2    HA   LYS  86           HA       LYS  86 -23.226 -16.074  -3.346
    3    HB2  LYS  86           HB2      LYS  86 -25.799 -14.500  -3.379
    4    HB3  LYS  86           HB3      LYS  86 -25.583 -16.051  -4.189
    5    HG2  LYS  86           HG2      LYS  86 -25.264 -17.135  -2.063
    6    HG3  LYS  86           HG3      LYS  86 -25.425 -15.586  -1.235
    7    HD2  LYS  86           HD2      LYS  86 -27.596 -16.436  -1.138
    8    HD3  LYS  86           HD3      LYS  86 -27.653 -15.387  -2.552
    9    HE2  LYS  86           HE2      LYS  86 -28.712 -17.634  -2.872
   10    HE3  LYS  86           HE3      LYS  86 -27.442 -17.247  -4.032
   11    HZ2  LYS  86           HZ1      LYS  86 -27.563 -19.474  -2.444
   12    HZ1  LYS  86           HZ2      LYS  86 -26.401 -18.494  -1.683
   13    HZ3  LYS  86           HZ3      LYS  86 -26.205 -18.932  -3.311

  No H/Q in entry =          13
  In of MODEL   64
    1    H    VAL  87           H        VAL  87 -23.072 -12.855  -4.210
    2    HA   VAL  87           HA       VAL  87 -22.744 -11.679  -6.144
    3    HB   VAL  87           HB       VAL  87 -21.809 -14.245  -7.472
    4   HG11  VAL  87          HG11      VAL  87 -21.966 -11.916  -8.616
    5   HG13  VAL  87          HG12      VAL  87 -20.460 -12.819  -8.781
    6   HG12  VAL  87          HG13      VAL  87 -20.574 -11.497  -7.619
    7   HG22  VAL  87          HG21      VAL  87 -19.703 -14.142  -6.438
    8   HG21  VAL  87          HG22      VAL  87 -20.870 -14.007  -5.125
    9   HG23  VAL  87          HG23      VAL  87 -20.041 -12.569  -5.716

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ASP  88           H        ASP  88 -25.283 -12.201  -5.762
    2    HA   ASP  88           HA       ASP  88 -26.497 -13.340  -8.152
    3    HB2  ASP  88           HB2      ASP  88 -27.469 -13.559  -5.816
    4    HB3  ASP  88           HB3      ASP  88 -27.841 -11.837  -5.894

  No H/Q in entry =           4
  In of MODEL   64
    1    H    GLY  89           H        GLY  89 -25.756 -12.101  -9.793
    2    HA3  GLY  89           HA2      GLY  89 -25.808  -9.321  -9.965
    3    HA2  GLY  89           HA3      GLY  89 -25.857 -10.428 -11.336

  No H/Q in entry =           3
  In of MODEL   64
    1    H    LEU  90           H        LEU  90 -28.359 -11.666 -10.864
    2    HA   LEU  90           HA       LEU  90 -30.091  -9.636 -11.932
    3    HB2  LEU  90           HB2      LEU  90 -30.280 -12.020 -12.533
    4    HB3  LEU  90           HB3      LEU  90 -30.778 -12.378 -10.879
    5    HG   LEU  90           HG       LEU  90 -32.845 -11.159 -11.201
    6   HD13  LEU  90          HD11      LEU  90 -32.605  -9.413 -12.662
    7   HD12  LEU  90          HD12      LEU  90 -33.220 -10.612 -13.802
    8   HD11  LEU  90          HD13      LEU  90 -31.488 -10.302 -13.700
    9   HD23  LEU  90          HD21      LEU  90 -32.890 -12.766 -13.651
   10   HD22  LEU  90          HD22      LEU  90 -33.854 -12.898 -12.181
   11   HD21  LEU  90          HD23      LEU  90 -32.232 -13.589 -12.236

  No H/Q in entry =          11
  In of MODEL   64
    1    H    GLY  91           H        GLY  91 -29.947 -11.174  -8.764
    2    HA3  GLY  91           HA2      GLY  91 -32.215  -9.962  -7.679
    3    HA2  GLY  91           HA3      GLY  91 -30.836 -10.570  -6.763

  No H/Q in entry =           3
  In of MODEL   64
    1    H    VAL  92           H        VAL  92 -28.846  -8.828  -7.632
    2    HA   VAL  92           HA       VAL  92 -29.504  -6.507  -6.051
    3    HB   VAL  92           HB       VAL  92 -27.007  -7.081  -7.689
    4   HG12  VAL  92          HG11      VAL  92 -27.047  -5.212  -5.344
    5   HG11  VAL  92          HG12      VAL  92 -27.709  -4.623  -6.871
    6   HG13  VAL  92          HG13      VAL  92 -26.036  -5.172  -6.788
    7   HG22  VAL  92          HG21      VAL  92 -26.836  -8.692  -6.115
    8   HG21  VAL  92          HG22      VAL  92 -27.926  -7.869  -4.997
    9   HG23  VAL  92          HG23      VAL  92 -26.248  -7.347  -5.139

  No H/Q in entry =           9
  In of MODEL   64
    1    H    LEU  93           H        LEU  93 -29.180  -7.154  -9.483
    2    HA   LEU  93           HA       LEU  93 -29.414  -4.497 -10.384
    3    HB2  LEU  93           HB2      LEU  93 -28.883  -6.365 -11.872
    4    HB3  LEU  93           HB3      LEU  93 -30.503  -7.019 -11.630
    5    HG   LEU  93           HG       LEU  93 -31.438  -5.000 -12.722
    6   HD11  LEU  93          HD11      LEU  93 -29.506  -3.498 -12.232
    7   HD13  LEU  93          HD12      LEU  93 -29.972  -3.491 -13.934
    8   HD12  LEU  93          HD13      LEU  93 -28.554  -4.398 -13.412
    9   HD23  LEU  93          HD21      LEU  93 -30.462  -5.593 -15.030
   10   HD22  LEU  93          HD22      LEU  93 -31.349  -6.818 -14.122
   11   HD21  LEU  93          HD23      LEU  93 -29.584  -6.845 -14.150

  No H/Q in entry =          11
  In of MODEL   64
    1    H    LYS  94           H        LYS  94 -31.894  -6.936  -9.520
    2    HA   LYS  94           HA       LYS  94 -34.177  -5.379 -10.095
    3    HB2  LYS  94           HB2      LYS  94 -33.736  -7.605  -8.112
    4    HB3  LYS  94           HB3      LYS  94 -35.303  -6.833  -8.349
    5    HG2  LYS  94           HG2      LYS  94 -35.289  -7.588 -10.691
    6    HG3  LYS  94           HG3      LYS  94 -33.760  -8.415 -10.393
    7    HD2  LYS  94           HD2      LYS  94 -34.915  -9.712  -8.563
    8    HD3  LYS  94           HD3      LYS  94 -36.434  -8.988  -9.089
    9    HE2  LYS  94           HE2      LYS  94 -35.998  -9.918 -11.371
   10    HE3  LYS  94           HE3      LYS  94 -34.611 -10.774 -10.696
   11    HZ3  LYS  94           HZ1      LYS  94 -36.533 -12.205 -10.851
   12    HZ2  LYS  94           HZ2      LYS  94 -37.443 -11.143  -9.886
   13    HZ1  LYS  94           HZ3      LYS  94 -36.109 -11.961  -9.225

  No H/Q in entry =          13
  In of MODEL   64
    1    H    ALA  95           H        ALA  95 -32.315  -5.615  -7.077
    2    HA   ALA  95           HA       ALA  95 -34.065  -3.964  -5.555
    3    HB2  ALA  95           HB1      ALA  95 -31.749  -5.454  -5.067
    4    HB3  ALA  95           HB2      ALA  95 -32.666  -4.516  -3.891
    5    HB1  ALA  95           HB3      ALA  95 -31.296  -3.785  -4.725

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ALA  96           H        ALA  96 -31.418  -3.216  -7.685
    2    HA   ALA  96           HA       ALA  96 -31.178  -0.469  -6.888
    3    HB2  ALA  96           HB1      ALA  96 -29.840  -0.288  -9.016
    4    HB3  ALA  96           HB2      ALA  96 -30.229  -1.976  -9.346
    5    HB1  ALA  96           HB3      ALA  96 -29.271  -1.554  -7.928

  No H/Q in entry =           5
  In of MODEL   64
    1    H    VAL  97           H        VAL  97 -32.831  -2.083  -9.565
    2    HA   VAL  97           HA       VAL  97 -33.809   0.278 -10.784
    3    HB   VAL  97           HB       VAL  97 -34.758  -2.604 -10.840
    4   HG11  VAL  97          HG11      VAL  97 -36.459  -0.510 -11.279
    5   HG13  VAL  97          HG12      VAL  97 -36.606  -2.091 -12.049
    6   HG12  VAL  97          HG13      VAL  97 -35.801  -0.770 -12.895
    7   HG21  VAL  97          HG21      VAL  97 -33.424  -0.821 -12.877
    8   HG23  VAL  97          HG22      VAL  97 -33.962  -2.474 -13.175
    9   HG22  VAL  97          HG23      VAL  97 -32.678  -2.160 -12.006

  No H/Q in entry =           9
  In of MODEL   64
    1    H    ALA  98           H        ALA  98 -35.057  -1.866  -8.248
    2    HA   ALA  98           HA       ALA  98 -37.553  -0.598  -7.847
    3    HB1  ALA  98           HB1      ALA  98 -36.632  -2.854  -6.850
    4    HB3  ALA  98           HB2      ALA  98 -37.752  -1.883  -5.892
    5    HB2  ALA  98           HB3      ALA  98 -36.021  -1.822  -5.559

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ALA  99           H        ALA  99 -34.413   0.032  -6.241
    2    HA   ALA  99           HA       ALA  99 -35.418   2.052  -4.543
    3    HB1  ALA  99           HB1      ALA  99 -32.829   1.041  -5.340
    4    HB2  ALA  99           HB2      ALA  99 -33.318   1.802  -3.826
    5    HB3  ALA  99           HB3      ALA  99 -32.814   2.798  -5.190

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ILE 100           H        ILE 100 -34.424   2.165  -7.913
    2    HA   ILE 100           HA       ILE 100 -34.464   5.022  -8.102
    3    HB   ILE 100           HB       ILE 100 -34.700   2.897 -10.260
    4   HG12  ILE 100          HG12      ILE 100 -32.429   4.772  -9.604
    5   HG13  ILE 100          HG13      ILE 100 -32.538   3.122  -8.989
    6   HG21  ILE 100          HG21      ILE 100 -34.978   5.835 -10.355
    7   HG23  ILE 100          HG22      ILE 100 -35.563   4.605 -11.476
    8   HG22  ILE 100          HG23      ILE 100 -33.883   5.138 -11.550
    9   HD12  ILE 100          HD11      ILE 100 -32.001   4.081 -11.762
   10   HD11  ILE 100          HD12      ILE 100 -32.737   2.498 -11.512
   11   HD13  ILE 100          HD13      ILE 100 -31.160   2.857 -10.813

  No H/Q in entry =          11
  In of MODEL   64
    1    H    LYS 101           H        LYS 101 -36.896   2.538  -8.817
    2    HA   LYS 101           HA       LYS 101 -38.907   4.300  -9.768
    3    HB2  LYS 101           HB2      LYS 101 -38.913   1.511  -8.669
    4    HB3  LYS 101           HB3      LYS 101 -40.430   2.354  -8.983
    5    HG2  LYS 101           HG2      LYS 101 -39.985   2.489 -11.285
    6    HG3  LYS 101           HG3      LYS 101 -38.307   1.996 -11.062
    7    HD2  LYS 101           HD2      LYS 101 -39.665   0.163 -11.947
    8    HD3  LYS 101           HD3      LYS 101 -39.031  -0.215 -10.346
    9    HE2  LYS 101           HE2      LYS 101 -41.118  -0.812  -9.814
   10    HE3  LYS 101           HE3      LYS 101 -41.489   0.913  -9.793
   11    HZ3  LYS 101           HZ1      LYS 101 -42.419   0.824 -11.897
   12    HZ2  LYS 101           HZ2      LYS 101 -42.942  -0.633 -11.197
   13    HZ1  LYS 101           HZ3      LYS 101 -41.652  -0.638 -12.300

  No H/Q in entry =          13
  In of MODEL   64
    1    H    LYS 102           H        LYS 102 -38.442   2.765  -6.582
    2    HA   LYS 102           HA       LYS 102 -40.607   4.058  -5.337
    3    HB2  LYS 102           HB2      LYS 102 -39.451   2.121  -4.360
    4    HB3  LYS 102           HB3      LYS 102 -38.006   3.103  -4.128
    5    HG2  LYS 102           HG2      LYS 102 -39.227   4.544  -2.596
    6    HG3  LYS 102           HG3      LYS 102 -40.676   3.567  -2.831
    7    HD2  LYS 102           HD2      LYS 102 -39.530   1.631  -1.844
    8    HD3  LYS 102           HD3      LYS 102 -38.082   2.611  -1.607
    9    HE2  LYS 102           HE2      LYS 102 -39.339   4.138  -0.162
   10    HE3  LYS 102           HE3      LYS 102 -40.803   3.191  -0.418
   11    HZ1  LYS 102           HZ1      LYS 102 -39.158   1.342   0.540
   12    HZ3  LYS 102           HZ2      LYS 102 -40.209   2.271   1.497
   13    HZ2  LYS 102           HZ3      LYS 102 -38.576   2.717   1.349

  No H/Q in entry =          13
  In of MODEL   64
    1    H    ALA 103           H        ALA 103 -37.602   5.311  -6.381
    2    HA   ALA 103           HA       ALA 103 -37.682   7.613  -4.571
    3    HB2  ALA 103           HB1      ALA 103 -35.680   8.265  -6.170
    4    HB3  ALA 103           HB2      ALA 103 -35.737   6.552  -6.587
    5    HB1  ALA 103           HB3      ALA 103 -35.459   7.045  -4.917

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ALA 104           H        ALA 104 -38.388   6.952  -7.915
    2    HA   ALA 104           HA       ALA 104 -38.842   9.770  -8.499
    3    HB2  ALA 104           HB1      ALA 104 -38.952   9.129 -10.707
    4    HB1  ALA 104           HB2      ALA 104 -39.751   7.601 -10.335
    5    HB3  ALA 104           HB3      ALA 104 -38.014   7.775 -10.079

  No H/Q in entry =           5
  In of MODEL   64
    1    H    ALA 105           H        ALA 105 -40.527   7.728  -6.692
    2    HA   ALA 105           HA       ALA 105 -42.878   9.241  -6.614
    3    HB2  ALA 105           HB1      ALA 105 -43.695   8.442  -8.649
    4    HB3  ALA 105           HB2      ALA 105 -44.373   7.274  -7.516
    5    HB1  ALA 105           HB3      ALA 105 -42.937   6.863  -8.450

  No H/Q in entry =           5
  In of MODEL   65
    1    H1   ALA   1           H3       ALA   1 -12.467 -15.327  -2.396
    2    H2   ALA   1           H2       ALA   1 -11.545 -16.480  -3.243
    3    H3   ALA   1           H1       ALA   1 -12.676 -15.513  -4.071
    4    HA   ALA   1           HA       ALA   1 -14.100 -17.193  -3.835
    5    HB3  ALA   1           HB1      ALA   1 -12.731 -18.988  -3.384
    6    HB1  ALA   1           HB2      ALA   1 -13.483 -18.871  -1.793
    7    HB2  ALA   1           HB3      ALA   1 -11.896 -18.154  -2.074

  No H/Q in entry =           7
  In of MODEL   65
    1    H    GLU   2           H        GLU   2 -15.733 -18.029  -2.182
    2    HA   GLU   2           HA       GLU   2 -17.352 -16.288  -1.112
    3    HB2  GLU   2           HB2      GLU   2 -16.448 -18.735   0.420
    4    HB3  GLU   2           HB3      GLU   2 -17.958 -17.862   0.681
    5    HG2  GLU   2           HG2      GLU   2 -18.958 -18.925  -1.056
    6    HG3  GLU   2           HG3      GLU   2 -17.631 -18.541  -2.142

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLU   3           H        GLU   3 -15.456 -17.683   1.501
    2    HA   GLU   3           HA       GLU   3 -15.638 -15.333   3.069
    3    HB2  GLU   3           HB2      GLU   3 -14.092 -17.905   3.306
    4    HB3  GLU   3           HB3      GLU   3 -13.838 -16.594   4.458
    5    HG2  GLU   3           HG2      GLU   3 -16.032 -16.715   5.280
    6    HG3  GLU   3           HG3      GLU   3 -16.642 -17.499   3.828

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LEU   4           H        LEU   4 -12.709 -16.851   1.666
    2    HA   LEU   4           HA       LEU   4 -10.844 -14.980   2.269
    3    HB2  LEU   4           HB2      LEU   4 -11.100 -16.262  -0.461
    4    HB3  LEU   4           HB3      LEU   4  -9.636 -15.567   0.224
    5    HG   LEU   4           HG       LEU   4 -11.165 -17.945   1.329
    6   HD13  LEU   4          HD11      LEU   4  -9.556 -19.322   0.391
    7   HD12  LEU   4          HD12      LEU   4  -8.327 -18.059   0.368
    8   HD11  LEU   4          HD13      LEU   4  -9.618 -18.055  -0.833
    9   HD23  LEU   4          HD21      LEU   4  -8.913 -18.050   2.707
   10   HD22  LEU   4          HD22      LEU   4 -10.217 -16.992   3.243
   11   HD21  LEU   4          HD23      LEU   4  -8.845 -16.321   2.361

  No H/Q in entry =          11
  In of MODEL   65
    1    H    GLU   5           H        GLU   5 -13.180 -14.724  -0.400
    2    HA   GLU   5           HA       GLU   5 -12.140 -12.253  -1.391
    3    HB2  GLU   5           HB2      GLU   5 -13.515 -13.815  -2.755
    4    HB3  GLU   5           HB3      GLU   5 -14.908 -13.426  -1.744
    5    HG2  GLU   5           HG2      GLU   5 -14.737 -11.061  -2.385
    6    HG3  GLU   5           HG3      GLU   5 -13.315 -11.420  -3.365

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLU   6           H        GLU   6 -14.875 -13.097   0.702
    2    HA   GLU   6           HA       GLU   6 -15.736 -10.408   1.115
    3    HB2  GLU   6           HB2      GLU   6 -16.879 -12.785   1.611
    4    HB3  GLU   6           HB3      GLU   6 -16.221 -12.461   3.214
    5    HG2  GLU   6           HG2      GLU   6 -17.953 -10.537   1.636
    6    HG3  GLU   6           HG3      GLU   6 -18.531 -11.569   2.942

  No H/Q in entry =           6
  In of MODEL   65
    1    H    VAL   7           H        VAL   7 -13.460 -12.562   2.673
    2    HA   VAL   7           HA       VAL   7 -12.965 -11.005   5.006
    3    HB   VAL   7           HB       VAL   7 -11.296 -13.069   3.545
    4   HG11  VAL   7          HG11      VAL   7 -10.799 -11.554   6.114
    5   HG13  VAL   7          HG12      VAL   7  -9.705 -11.780   4.751
    6   HG12  VAL   7          HG13      VAL   7 -10.078 -13.136   5.815
    7   HG21  VAL   7          HG21      VAL   7 -13.554 -13.602   4.766
    8   HG23  VAL   7          HG22      VAL   7 -12.620 -13.350   6.241
    9   HG22  VAL   7          HG23      VAL   7 -12.149 -14.612   5.105

  No H/Q in entry =           9
  In of MODEL   65
    1    H    VAL   8           H        VAL   8 -11.461 -11.129   1.793
    2    HA   VAL   8           HA       VAL   8  -9.368  -9.291   2.290
    3    HB   VAL   8           HB       VAL   8 -10.832 -10.077  -0.231
    4   HG11  VAL   8          HG11      VAL   8  -8.665  -8.021   0.204
    5   HG13  VAL   8          HG12      VAL   8 -10.147  -7.874  -0.742
    6   HG12  VAL   8          HG13      VAL   8  -8.818  -8.871  -1.334
    7   HG23  VAL   8          HG21      VAL   8  -8.045 -10.644  -0.319
    8   HG22  VAL   8          HG22      VAL   8  -9.357 -11.801  -0.126
    9   HG21  VAL   8          HG23      VAL   8  -8.578 -11.113   1.296

  No H/Q in entry =           9
  In of MODEL   65
    1    H    MET   9           H        MET   9 -12.708  -8.844   1.137
    2    HA   MET   9           HA       MET   9 -12.602  -6.066   0.715
    3    HB2  MET   9           HB2      MET   9 -14.834  -7.926   1.515
    4    HB3  MET   9           HB3      MET   9 -15.102  -6.190   1.358
    5    HG2  MET   9           HG2      MET   9 -14.206  -6.294  -0.964
    6    HG3  MET   9           HG3      MET   9 -14.052  -8.043  -0.799
    7    HE2  MET   9           HE1      MET   9 -16.590  -5.221  -1.965
    8    HE1  MET   9           HE2      MET   9 -16.189  -5.076  -0.256
    9    HE3  MET   9           HE3      MET   9 -17.832  -5.494  -0.736

  No H/Q in entry =           9
  In of MODEL   65
    1    H    GLY  10           H        GLY  10 -13.290  -7.960   3.635
    2    HA3  GLY  10           HA2      GLY  10 -13.801  -5.774   5.364
    3    HA2  GLY  10           HA3      GLY  10 -13.261  -7.374   5.870

  No H/Q in entry =           3
  In of MODEL   65
    1    H    LEU  11           H        LEU  11 -10.819  -7.530   4.551
    2    HA   LEU  11           HA       LEU  11  -9.094  -6.131   6.311
    3    HB2  LEU  11           HB2      LEU  11  -8.574  -7.552   3.697
    4    HB3  LEU  11           HB3      LEU  11  -7.291  -6.871   4.696
    5    HG   LEU  11           HG       LEU  11  -9.323  -8.877   5.707
    6   HD13  LEU  11          HD11      LEU  11  -8.123 -10.126   4.135
    7   HD12  LEU  11          HD12      LEU  11  -7.189 -10.385   5.608
    8   HD11  LEU  11          HD13      LEU  11  -6.632  -9.223   4.404
    9   HD22  LEU  11          HD21      LEU  11  -8.451  -7.886   7.627
   10   HD21  LEU  11          HD22      LEU  11  -6.909  -7.504   6.863
   11   HD23  LEU  11          HD23      LEU  11  -7.259  -9.158   7.366

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  12           H        ILE  12  -9.993  -5.555   2.925
    2    HA   ILE  12           HA       ILE  12  -8.268  -3.350   2.505
    3    HB   ILE  12           HB       ILE  12 -10.930  -3.988   1.211
    4   HG12  ILE  12          HG12      ILE  12  -8.908  -5.649   1.114
    5   HG13  ILE  12          HG13      ILE  12  -9.759  -5.264  -0.368
    6   HG22  ILE  12          HG21      ILE  12  -9.981  -2.589  -0.675
    7   HG21  ILE  12          HG22      ILE  12  -8.713  -2.066   0.427
    8   HG23  ILE  12          HG23      ILE  12 -10.381  -1.702   0.762
    9   HD11  ILE  12          HD11      ILE  12  -7.235  -3.876   0.569
   10   HD13  ILE  12          HD12      ILE  12  -8.023  -3.702  -0.997
   11   HD12  ILE  12          HD13      ILE  12  -7.257  -5.213  -0.566

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  13           H        ILE  13 -11.631  -3.571   3.603
    2    HA   ILE  13           HA       ILE  13 -12.049  -0.779   3.885
    3    HB   ILE  13           HB       ILE  13 -13.288  -3.190   5.231
    4   HG12  ILE  13          HG12      ILE  13 -13.511  -2.602   2.698
    5   HG13  ILE  13          HG13      ILE  13 -14.935  -3.070   3.603
    6   HG22  ILE  13          HG21      ILE  13 -15.170  -1.387   5.683
    7   HG21  ILE  13          HG22      ILE  13 -13.822  -0.259   5.644
    8   HG23  ILE  13          HG23      ILE  13 -13.835  -1.573   6.817
    9   HD12  ILE  13          HD11      ILE  13 -15.224  -1.011   2.136
   10   HD11  ILE  13          HD12      ILE  13 -14.114  -0.205   3.227
   11   HD13  ILE  13          HD13      ILE  13 -15.643  -0.793   3.839

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ASN  14           H        ASN  14 -10.971  -3.295   6.147
    2    HA   ASN  14           HA       ASN  14 -10.743  -1.669   8.439
    3    HB2  ASN  14           HB2      ASN  14 -10.529  -4.279   8.106
    4    HB3  ASN  14           HB3      ASN  14  -8.814  -3.916   7.948
    5   HD21  ASN  14          HD21      ASN  14  -9.470  -5.440  10.119
    6   HD22  ASN  14          HD22      ASN  14  -9.427  -4.526  11.547

  No H/Q in entry =           6
  In of MODEL   65
    1    H    SER  15           H        SER  15  -8.357  -2.517   5.941
    2    HA   SER  15           HA       SER  15  -6.191  -1.059   7.016
    3    HB2  SER  15           HB2      SER  15  -5.176  -1.282   4.858
    4    HB3  SER  15           HB3      SER  15  -6.155  -2.728   5.074
    5    HG   SER  15           HG       SER  15  -6.467  -0.602   3.342

  No H/Q in entry =           5
  In of MODEL   65
    1    H    GLY  16           H        GLY  16  -8.783  -0.146   4.776
    2    HA3  GLY  16           HA2      GLY  16  -7.890   2.485   4.234
    3    HA2  GLY  16           HA3      GLY  16  -9.549   1.913   4.072

  No H/Q in entry =           3
  In of MODEL   65
    1    H    GLN  17           H        GLN  17 -10.098   1.184   6.720
    2    HA   GLN  17           HA       GLN  17 -10.770   3.694   7.872
    3    HB2  GLN  17           HB2      GLN  17 -12.011   1.595   8.339
    4    HB3  GLN  17           HB3      GLN  17 -10.618   0.995   9.239
    5    HG2  GLN  17           HG2      GLN  17 -12.219   1.959  10.804
    6    HG3  GLN  17           HG3      GLN  17 -10.786   2.985  10.739
    7   HE21  GLN  17          HE21      GLN  17 -11.772   5.020  11.170
    8   HE22  GLN  17          HE22      GLN  17 -12.958   5.707  10.167

  No H/Q in entry =           8
  In of MODEL   65
    1    H    ALA  18           H        ALA  18  -8.171   1.375   8.478
    2    HA   ALA  18           HA       ALA  18  -7.054   2.567  10.752
    3    HB2  ALA  18           HB1      ALA  18  -6.475   0.349   9.375
    4    HB3  ALA  18           HB2      ALA  18  -5.301   1.113  10.447
    5    HB1  ALA  18           HB3      ALA  18  -5.222   1.397   8.707

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ARG  19           H        ARG  19  -6.281   3.095   7.305
    2    HA   ARG  19           HA       ARG  19  -4.356   5.116   7.739
    3    HB2  ARG  19           HB2      ARG  19  -4.700   3.988   5.539
    4    HB3  ARG  19           HB3      ARG  19  -6.232   4.849   5.368
    5    HG2  ARG  19           HG2      ARG  19  -5.076   7.006   5.443
    6    HG3  ARG  19           HG3      ARG  19  -3.537   6.200   5.742
    7    HD2  ARG  19           HD2      ARG  19  -3.657   6.801   3.402
    8    HD3  ARG  19           HD3      ARG  19  -3.764   5.042   3.540
    9    HE   ARG  19           HE       ARG  19  -6.387   5.984   3.540
   10   HH21  ARG  19          HH11      ARG  19  -7.582   6.163   1.624
   11   HH22  ARG  19          HH12      ARG  19  -6.761   6.236   0.104
   12   HH11  ARG  19          HH21      ARG  19  -3.613   6.021   1.503
   13   HH12  ARG  19          HH22      ARG  19  -4.513   6.153   0.035

  No H/Q in entry =          13
  In of MODEL   65
    1    H    SER  20           H        SER  20  -7.853   5.277   7.144
    2    HA   SER  20           HA       SER  20  -8.176   8.037   7.107
    3    HB2  SER  20           HB2      SER  20 -10.071   6.724   6.567
    4    HB3  SER  20           HB3      SER  20  -9.970   5.820   8.077
    5    HG   SER  20           HG       SER  20 -10.739   7.540   9.164

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LEU  21           H        LEU  21  -8.200   5.844   9.902
    2    HA   LEU  21           HA       LEU  21  -8.614   7.837  11.875
    3    HB2  LEU  21           HB2      LEU  21  -7.296   5.118  12.022
    4    HB3  LEU  21           HB3      LEU  21  -7.586   6.133  13.431
    5    HG   LEU  21           HG       LEU  21  -9.780   5.289  11.516
    6   HD11  LEU  21          HD11      LEU  21  -8.652   3.955  13.965
    7   HD13  LEU  21          HD12      LEU  21  -9.115   3.235  12.424
    8   HD12  LEU  21          HD13      LEU  21 -10.358   3.764  13.558
    9   HD23  LEU  21          HD21      LEU  21 -11.088   5.762  13.766
   10   HD22  LEU  21          HD22      LEU  21 -10.636   7.118  12.739
   11   HD21  LEU  21          HD23      LEU  21  -9.679   6.742  14.163

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ALA  22           H        ALA  22  -5.679   6.434  10.459
    2    HA   ALA  22           HA       ALA  22  -3.783   7.719  12.084
    3    HB2  ALA  22           HB1      ALA  22  -3.390   5.867  10.385
    4    HB1  ALA  22           HB2      ALA  22  -2.179   7.149  10.424
    5    HB3  ALA  22           HB3      ALA  22  -3.399   7.124   9.149

  No H/Q in entry =           5
  In of MODEL   65
    1    H    TYR  23           H        TYR  23  -5.091   8.764   8.907
    2    HA   TYR  23           HA       TYR  23  -3.726  11.244   8.845
    3    HB2  TYR  23           HB2      TYR  23  -4.818  10.353   6.851
    4    HB3  TYR  23           HB3      TYR  23  -6.395  10.475   7.634
    5    HD1  TYR  23           HD1      TYR  23  -3.468  12.494   6.501
    6    HD2  TYR  23           HD2      TYR  23  -7.616  12.495   7.612
    7    HE1  TYR  23           HE1      TYR  23  -3.668  14.850   5.751
    8    HE2  TYR  23           HE2      TYR  23  -7.818  14.849   6.861
    9    HH   TYR  23           HH       TYR  23  -5.196  16.469   5.173

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ALA  24           H        ALA  24  -6.855  10.298  10.224
    2    HA   ALA  24           HA       ALA  24  -7.661  12.894  11.006
    3    HB1  ALA  24           HB1      ALA  24  -9.493  11.663  11.470
    4    HB2  ALA  24           HB2      ALA  24  -8.673  11.076  12.915
    5    HB3  ALA  24           HB3      ALA  24  -8.560  10.168  11.408

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ALA  25           H        ALA  25  -5.686  10.407  12.568
    2    HA   ALA  25           HA       ALA  25  -5.331  11.645  15.075
    3    HB2  ALA  25           HB1      ALA  25  -4.593   9.288  14.244
    4    HB3  ALA  25           HB2      ALA  25  -3.566  10.130  15.407
    5    HB1  ALA  25           HB3      ALA  25  -3.132  10.114  13.698

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LEU  26           H        LEU  26  -3.540  11.935  12.034
    2    HA   LEU  26           HA       LEU  26  -1.559  13.729  12.955
    3    HB2  LEU  26           HB2      LEU  26  -1.273  12.582  10.847
    4    HB3  LEU  26           HB3      LEU  26  -2.739  13.309  10.196
    5    HG   LEU  26           HG       LEU  26  -1.698  15.547  10.339
    6   HD12  LEU  26          HD11      LEU  26   0.841  15.535  10.751
    7   HD11  LEU  26          HD12      LEU  26   0.600  13.955  11.490
    8   HD13  LEU  26          HD13      LEU  26  -0.190  15.376  12.172
    9   HD21  LEU  26          HD21      LEU  26   0.020  13.478   8.935
   10   HD23  LEU  26          HD22      LEU  26  -0.004  15.201   8.571
   11   HD22  LEU  26          HD23      LEU  26  -1.439  14.221   8.280

  No H/Q in entry =          11
  In of MODEL   65
    1    H    LYS  27           H        LYS  27  -4.737  14.255  11.483
    2    HA   LYS  27           HA       LYS  27  -4.649  17.043  11.295
    3    HB2  LYS  27           HB2      LYS  27  -6.411  15.591  10.306
    4    HB3  LYS  27           HB3      LYS  27  -7.069  15.336  11.922
    5    HG2  LYS  27           HG2      LYS  27  -7.470  17.746  12.167
    6    HG3  LYS  27           HG3      LYS  27  -6.760  18.041  10.577
    7    HD2  LYS  27           HD2      LYS  27  -8.510  16.631   9.537
    8    HD3  LYS  27           HD3      LYS  27  -9.226  16.354  11.126
    9    HE2  LYS  27           HE2      LYS  27  -9.639  18.769  11.379
   10    HE3  LYS  27           HE3      LYS  27  -8.895  19.068   9.805
   11    HZ3  LYS  27           HZ1      LYS  27 -11.274  18.973   9.565
   12    HZ2  LYS  27           HZ2      LYS  27 -11.340  17.454  10.329
   13    HZ1  LYS  27           HZ3      LYS  27 -10.594  17.614   8.807

  No H/Q in entry =          13
  In of MODEL   65
    1    H    GLN  28           H        GLN  28  -5.560  14.958  14.015
    2    HA   GLN  28           HA       GLN  28  -6.429  16.965  15.800
    3    HB2  GLN  28           HB2      GLN  28  -5.057  14.316  16.333
    4    HB3  GLN  28           HB3      GLN  28  -5.790  15.324  17.583
    5    HG2  GLN  28           HG2      GLN  28  -7.276  14.272  15.162
    6    HG3  GLN  28           HG3      GLN  28  -7.308  13.508  16.751
    7   HE21  GLN  28          HE21      GLN  28  -7.420  15.860  18.384
    8   HE22  GLN  28          HE22      GLN  28  -8.903  16.633  18.102

  No H/Q in entry =           8
  In of MODEL   65
    1    H    ALA  29           H        ALA  29  -3.227  15.631  15.102
    2    HA   ALA  29           HA       ALA  29  -1.769  17.002  17.085
    3    HB1  ALA  29           HB1      ALA  29   0.151  16.290  15.961
    4    HB3  ALA  29           HB2      ALA  29  -0.603  16.430  14.373
    5    HB2  ALA  29           HB3      ALA  29  -1.042  15.099  15.443

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LYS  30           H        LYS  30  -2.619  17.906  13.760
    2    HA   LYS  30           HA       LYS  30  -1.174  20.326  13.667
    3    HB2  LYS  30           HB2      LYS  30  -3.719  19.494  12.258
    4    HB3  LYS  30           HB3      LYS  30  -2.863  20.998  11.919
    5    HG2  LYS  30           HG2      LYS  30  -0.813  19.677  11.398
    6    HG3  LYS  30           HG3      LYS  30  -1.741  18.193  11.638
    7    HD2  LYS  30           HD2      LYS  30  -3.298  18.864   9.848
    8    HD3  LYS  30           HD3      LYS  30  -2.393  20.360   9.610
    9    HE2  LYS  30           HE2      LYS  30  -0.381  19.039   9.022
   10    HE3  LYS  30           HE3      LYS  30  -1.305  17.549   9.230
   11    HZ2  LYS  30           HZ1      LYS  30  -1.118  18.427   6.891
   12    HZ1  LYS  30           HZ2      LYS  30  -2.142  19.703   7.365
   13    HZ3  LYS  30           HZ3      LYS  30  -2.691  18.094   7.431

  No H/Q in entry =          13
  In of MODEL   65
    1    H    GLN  31           H        GLN  31  -4.285  19.516  15.080
    2    HA   GLN  31           HA       GLN  31  -5.005  22.282  15.544
    3    HB2  GLN  31           HB2      GLN  31  -6.221  19.849  16.858
    4    HB3  GLN  31           HB3      GLN  31  -6.956  21.434  16.620
    5    HG2  GLN  31           HG2      GLN  31  -6.262  20.656  14.026
    6    HG3  GLN  31           HG3      GLN  31  -6.809  19.157  14.768
    7   HE21  GLN  31          HE21      GLN  31  -8.197  20.762  12.675
    8   HE22  GLN  31          HE22      GLN  31  -9.703  21.175  13.336

  No H/Q in entry =           8
  In of MODEL   65
    1    H    GLY  32           H        GLY  32  -2.722  20.313  16.853
    2    HA3  GLY  32           HA2      GLY  32  -1.312  20.744  18.655
    3    HA2  GLY  32           HA3      GLY  32  -2.420  22.003  19.186

  No H/Q in entry =           3
  In of MODEL   65
    1    H    ASP  33           H        ASP  33  -3.893  18.990  18.513
    2    HA   ASP  33           HA       ASP  33  -4.306  18.527  21.391
    3    HB2  ASP  33           HB2      ASP  33  -5.733  17.549  18.912
    4    HB3  ASP  33           HB3      ASP  33  -6.086  16.938  20.526

  No H/Q in entry =           4
  In of MODEL   65
    1    H    PHE  34           H        PHE  34  -2.152  17.639  21.690
    2    HA   PHE  34           HA       PHE  34  -1.191  15.380  20.278
    3    HB2  PHE  34           HB2      PHE  34  -0.554  16.342  23.075
    4    HB3  PHE  34           HB3      PHE  34   0.354  15.107  22.201
    5    HD1  PHE  34           HD1      PHE  34   0.239  18.532  22.952
    6    HD2  PHE  34           HD2      PHE  34   1.020  15.830  19.704
    7    HE1  PHE  34           HE1      PHE  34   1.562  20.287  21.803
    8    HE2  PHE  34           HE2      PHE  34   2.338  17.588  18.561
    9    HZ   PHE  34           HZ       PHE  34   2.610  19.813  19.615

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ALA  35           H        ALA  35  -3.221  15.678  23.145
    2    HA   ALA  35           HA       ALA  35  -3.052  13.009  24.029
    3    HB3  ALA  35           HB1      ALA  35  -5.498  13.672  24.893
    4    HB1  ALA  35           HB2      ALA  35  -4.939  15.283  24.444
    5    HB2  ALA  35           HB3      ALA  35  -4.038  14.339  25.629

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ALA  36           H        ALA  36  -5.480  14.575  21.940
    2    HA   ALA  36           HA       ALA  36  -6.936  12.190  21.454
    3    HB1  ALA  36           HB1      ALA  36  -8.369  13.640  20.507
    4    HB3  ALA  36           HB2      ALA  36  -7.192  14.047  19.258
    5    HB2  ALA  36           HB3      ALA  36  -7.199  14.928  20.785

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ALA  37           H        ALA  37  -4.232  13.740  19.788
    2    HA   ALA  37           HA       ALA  37  -4.227  12.115  17.484
    3    HB3  ALA  37           HB1      ALA  37  -2.205  13.787  18.911
    4    HB2  ALA  37           HB2      ALA  37  -2.737  13.859  17.232
    5    HB1  ALA  37           HB3      ALA  37  -1.603  12.607  17.746

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LYS  38           H        LYS  38  -2.471  11.765  20.558
    2    HA   LYS  38           HA       LYS  38  -1.186   9.346  20.056
    3    HB2  LYS  38           HB2      LYS  38  -1.477  11.104  22.210
    4    HB3  LYS  38           HB3      LYS  38  -2.120   9.582  22.820
    5    HG2  LYS  38           HG2      LYS  38  -0.045   8.430  22.275
    6    HG3  LYS  38           HG3      LYS  38   0.586   9.868  21.467
    7    HD2  LYS  38           HD2      LYS  38   0.778  11.075  23.507
    8    HD3  LYS  38           HD3      LYS  38  -0.259   9.937  24.371
    9    HE2  LYS  38           HE2      LYS  38   2.092   9.580  24.985
   10    HE3  LYS  38           HE3      LYS  38   1.463   8.178  24.115
   11    HZ3  LYS  38           HZ1      LYS  38   2.768   8.583  22.334
   12    HZ2  LYS  38           HZ2      LYS  38   3.738   9.390  23.473
   13    HZ1  LYS  38           HZ3      LYS  38   2.672  10.272  22.487

  No H/Q in entry =          13
  In of MODEL   65
    1    H    ALA  39           H        ALA  39  -4.414   9.888  21.466
    2    HA   ALA  39           HA       ALA  39  -5.018   7.176  21.958
    3    HB3  ALA  39           HB1      ALA  39  -7.146   9.159  21.204
    4    HB2  ALA  39           HB2      ALA  39  -6.242   9.365  22.704
    5    HB1  ALA  39           HB3      ALA  39  -7.183   7.897  22.436

  No H/Q in entry =           5
  In of MODEL   65
    1    H    MET  40           H        MET  40  -5.574   9.212  19.122
    2    HA   MET  40           HA       MET  40  -7.084   7.311  17.655
    3    HB2  MET  40           HB2      MET  40  -5.437   9.683  16.759
    4    HB3  MET  40           HB3      MET  40  -6.480   8.746  15.686
    5    HG2  MET  40           HG2      MET  40  -7.490  10.000  18.251
    6    HG3  MET  40           HG3      MET  40  -7.536  10.843  16.705
    7    HE3  MET  40           HE1      MET  40 -10.149   9.275  14.637
    8    HE2  MET  40           HE2      MET  40  -8.394   9.365  14.487
    9    HE1  MET  40           HE3      MET  40  -9.289  10.742  15.128

  No H/Q in entry =           9
  In of MODEL   65
    1    H    MET  41           H        MET  41  -3.581   7.991  17.776
    2    HA   MET  41           HA       MET  41  -2.854   6.234  15.666
    3    HB2  MET  41           HB2      MET  41  -1.224   6.863  18.140
    4    HB3  MET  41           HB3      MET  41  -0.619   6.212  16.620
    5    HG2  MET  41           HG2      MET  41  -1.742   8.418  15.628
    6    HG3  MET  41           HG3      MET  41  -1.494   8.994  17.275
    7    HE2  MET  41           HE1      MET  41   1.391   6.848  17.622
    8    HE1  MET  41           HE2      MET  41   0.624   8.150  18.528
    9    HE3  MET  41           HE3      MET  41   2.250   8.370  17.883

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ASP  42           H        ASP  42  -3.242   5.751  19.151
    2    HA   ASP  42           HA       ASP  42  -2.247   3.140  19.297
    3    HB2  ASP  42           HB2      ASP  42  -3.090   4.905  21.129
    4    HB3  ASP  42           HB3      ASP  42  -4.533   3.903  21.054

  No H/Q in entry =           4
  In of MODEL   65
    1    H    GLN  43           H        GLN  43  -5.563   4.299  18.807
    2    HA   GLN  43           HA       GLN  43  -6.748   1.731  18.602
    3    HB2  GLN  43           HB2      GLN  43  -7.631   4.402  17.486
    4    HB3  GLN  43           HB3      GLN  43  -8.617   2.939  17.459
    5    HG2  GLN  43           HG2      GLN  43  -8.322   2.801  19.965
    6    HG3  GLN  43           HG3      GLN  43  -7.572   4.395  19.900
    7   HE21  GLN  43          HE21      GLN  43  -9.748   4.502  21.404
    8   HE22  GLN  43          HE22      GLN  43 -11.101   5.103  20.577

  No H/Q in entry =           8
  In of MODEL   65
    1    H    SER  44           H        SER  44  -5.376   3.934  16.198
    2    HA   SER  44           HA       SER  44  -6.103   2.472  13.903
    3    HB2  SER  44           HB2      SER  44  -4.809   4.834  14.356
    4    HB3  SER  44           HB3      SER  44  -3.472   3.819  13.820
    5    HG   SER  44           HG       SER  44  -4.571   4.817  12.063

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ARG  45           H        ARG  45  -3.225   2.304  15.979
    2    HA   ARG  45           HA       ARG  45  -1.778   0.334  14.586
    3    HB2  ARG  45           HB2      ARG  45  -0.911   1.733  16.460
    4    HB3  ARG  45           HB3      ARG  45  -1.916   0.812  17.577
    5    HG2  ARG  45           HG2      ARG  45  -0.718  -1.262  16.923
    6    HG3  ARG  45           HG3      ARG  45   0.311  -0.318  15.848
    7    HD2  ARG  45           HD2      ARG  45   1.070   1.042  17.809
    8    HD3  ARG  45           HD3      ARG  45   0.132  -0.024  18.879
    9    HE   ARG  45           HE       ARG  45   1.804  -1.639  17.289
   10   HH21  ARG  45          HH11      ARG  45   3.692  -2.495  18.120
   11   HH22  ARG  45          HH12      ARG  45   4.479  -1.728  19.454
   12   HH11  ARG  45          HH21      ARG  45   2.149   0.812  19.690
   13   HH12  ARG  45          HH22      ARG  45   3.605   0.147  20.340

  No H/Q in entry =          13
  In of MODEL   65
    1    H    MET  46           H        MET  46  -4.177   0.039  17.187
    2    HA   MET  46           HA       MET  46  -4.053  -2.764  17.481
    3    HB2  MET  46           HB2      MET  46  -6.200  -0.733  18.087
    4    HB3  MET  46           HB3      MET  46  -6.416  -2.451  18.434
    5    HG2  MET  46           HG2      MET  46  -4.392  -2.443  19.826
    6    HG3  MET  46           HG3      MET  46  -4.125  -0.747  19.456
    7    HE1  MET  46           HE1      MET  46  -4.011   0.083  21.764
    8    HE3  MET  46           HE2      MET  46  -4.153  -1.533  22.446
    9    HE2  MET  46           HE3      MET  46  -5.156  -0.231  23.074

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ALA  47           H        ALA  47  -6.043  -0.705  15.398
    2    HA   ALA  47           HA       ALA  47  -7.695  -2.725  14.324
    3    HB3  ALA  47           HB1      ALA  47  -8.339  -0.474  13.920
    4    HB1  ALA  47           HB2      ALA  47  -7.862  -1.108  12.345
    5    HB2  ALA  47           HB3      ALA  47  -6.764  -0.062  13.246

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LEU  48           H        LEU  48  -4.556  -1.462  13.276
    2    HA   LEU  48           HA       LEU  48  -4.304  -3.045  10.927
    3    HB2  LEU  48           HB2      LEU  48  -2.224  -1.810  12.739
    4    HB3  LEU  48           HB3      LEU  48  -1.869  -2.529  11.169
    5    HG   LEU  48           HG       LEU  48  -3.854  -0.280  11.571
    6   HD13  LEU  48          HD11      LEU  48  -1.717   0.557  12.239
    7   HD12  LEU  48          HD12      LEU  48  -1.985   1.123  10.590
    8   HD11  LEU  48          HD13      LEU  48  -0.910  -0.243  10.890
    9   HD22  LEU  48          HD21      LEU  48  -4.344  -1.246   9.491
   10   HD21  LEU  48          HD22      LEU  48  -2.669  -1.708   9.192
   11   HD23  LEU  48          HD23      LEU  48  -3.160  -0.020   9.041

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ASN  49           H        ASN  49  -3.262  -3.477  14.270
    2    HA   ASN  49           HA       ASN  49  -1.699  -5.765  13.927
    3    HB2  ASN  49           HB2      ASN  49  -1.712  -4.429  15.981
    4    HB3  ASN  49           HB3      ASN  49  -3.370  -4.911  16.308
    5   HD21  ASN  49          HD21      ASN  49  -2.756  -5.948  18.320
    6   HD22  ASN  49          HD22      ASN  49  -1.897  -7.412  18.334

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLU  50           H        GLU  50  -5.162  -5.433  14.603
    2    HA   GLU  50           HA       GLU  50  -5.723  -8.223  14.699
    3    HB2  GLU  50           HB2      GLU  50  -7.278  -6.513  15.585
    4    HB3  GLU  50           HB3      GLU  50  -7.563  -5.935  13.941
    5    HG2  GLU  50           HG2      GLU  50  -8.468  -8.112  13.293
    6    HG3  GLU  50           HG3      GLU  50  -8.096  -8.770  14.883

  No H/Q in entry =           6
  In of MODEL   65
    1    H    ALA  51           H        ALA  51  -5.751  -5.811  12.115
    2    HA   ALA  51           HA       ALA  51  -6.769  -7.511  10.085
    3    HB2  ALA  51           HB1      ALA  51  -6.517  -5.696   8.725
    4    HB1  ALA  51           HB2      ALA  51  -4.871  -5.379   9.273
    5    HB3  ALA  51           HB3      ALA  51  -6.245  -4.848  10.246

  No H/Q in entry =           5
  In of MODEL   65
    1    H    HIS  52           H        HIS  52  -3.461  -6.669  11.070
    2    HA   HIS  52           HA       HIS  52  -2.092  -8.174   9.112
    3    HB2  HIS  52           HB2      HIS  52  -1.045  -6.458  10.585
    4    HB3  HIS  52           HB3      HIS  52  -1.196  -7.575  11.941
    5    HD1  HIS  52           HD1      HIS  52   0.248  -9.775  11.844
    6    HD2  HIS  52           HD2      HIS  52   1.055  -7.046   8.797
    7    HE1  HIS  52           HE1      HIS  52   2.431 -10.505  10.789
    8    HE2  HIS  52           HE2      HIS  52   2.937  -8.852   8.929

  No H/Q in entry =           8
  In of MODEL   65
    1    H    LEU  53           H        LEU  53  -3.317  -9.045  12.321
    2    HA   LEU  53           HA       LEU  53  -2.167 -11.612  12.501
    3    HB2  LEU  53           HB2      LEU  53  -4.624 -10.385  13.726
    4    HB3  LEU  53           HB3      LEU  53  -4.208 -12.074  14.004
    5    HG   LEU  53           HG       LEU  53  -2.239  -9.816  14.491
    6   HD13  LEU  53          HD11      LEU  53  -4.111  -9.384  15.949
    7   HD12  LEU  53          HD12      LEU  53  -2.850 -10.145  16.918
    8   HD11  LEU  53          HD13      LEU  53  -4.236 -11.087  16.379
    9   HD23  LEU  53          HD21      LEU  53  -1.419 -11.651  16.173
   10   HD22  LEU  53          HD22      LEU  53  -1.034 -11.841  14.466
   11   HD21  LEU  53          HD23      LEU  53  -2.347 -12.763  15.174

  No H/Q in entry =          11
  In of MODEL   65
    1    H    VAL  54           H        VAL  54  -5.259 -10.517  11.147
    2    HA   VAL  54           HA       VAL  54  -6.223 -13.089  10.447
    3    HB   VAL  54           HB       VAL  54  -6.818 -10.339   9.327
    4   HG12  VAL  54          HG11      VAL  54  -8.947 -11.672   8.510
    5   HG11  VAL  54          HG12      VAL  54  -7.862 -13.059   8.574
    6   HG13  VAL  54          HG13      VAL  54  -7.476 -11.686   7.539
    7   HG22  VAL  54          HG21      VAL  54  -7.724 -10.370  11.479
    8   HG21  VAL  54          HG22      VAL  54  -8.012 -12.108  11.451
    9   HG23  VAL  54          HG23      VAL  54  -9.073 -11.026  10.551

  No H/Q in entry =           9
  In of MODEL   65
    1    H    GLN  55           H        GLN  55  -4.306 -10.666   8.669
    2    HA   GLN  55           HA       GLN  55  -4.206 -12.120   6.244
    3    HB2  GLN  55           HB2      GLN  55  -3.558  -9.867   6.065
    4    HB3  GLN  55           HB3      GLN  55  -2.448  -9.972   7.429
    5    HG2  GLN  55           HG2      GLN  55  -0.749 -10.845   6.147
    6    HG3  GLN  55           HG3      GLN  55  -1.842 -11.794   5.149
    7   HE21  GLN  55          HE21      GLN  55  -1.847 -11.093   3.031
    8   HE22  GLN  55          HE22      GLN  55  -1.618  -9.490   2.529

  No H/Q in entry =           8
  In of MODEL   65
    1    H    THR  56           H        THR  56  -2.098 -12.155   9.123
    2    HA   THR  56           HA       THR  56  -0.052 -13.790   8.196
    3    HB   THR  56           HB       THR  56  -1.295 -14.036  10.943
    4    HG1  THR  56           HG1      THR  56   0.177 -12.012   9.722
    5   HG21  THR  56          HG21      THR  56   0.627 -15.565  10.004
    6   HG23  THR  56          HG22      THR  56   0.764 -14.884  11.625
    7   HG22  THR  56          HG23      THR  56   1.628 -14.141  10.279

  No H/Q in entry =           7
  In of MODEL   65
    1    H    LYS  57           H        LYS  57  -3.191 -14.771   9.556
    2    HA   LYS  57           HA       LYS  57  -2.802 -17.574   9.296
    3    HB2  LYS  57           HB2      LYS  57  -4.597 -16.453  10.648
    4    HB3  LYS  57           HB3      LYS  57  -5.381 -15.981   9.149
    5    HG2  LYS  57           HG2      LYS  57  -5.699 -18.320   8.530
    6    HG3  LYS  57           HG3      LYS  57  -4.826 -18.846   9.968
    7    HD2  LYS  57           HD2      LYS  57  -6.556 -17.800  11.397
    8    HD3  LYS  57           HD3      LYS  57  -7.440 -17.298   9.956
    9    HE2  LYS  57           HE2      LYS  57  -8.512 -19.311  10.577
   10    HE3  LYS  57           HE3      LYS  57  -7.398 -19.833   9.315
   11    HZ2  LYS  57           HZ1      LYS  57  -7.492 -21.087  11.562
   12    HZ1  LYS  57           HZ2      LYS  57  -6.505 -19.817  12.113
   13    HZ3  LYS  57           HZ3      LYS  57  -5.993 -20.795  10.821

  No H/Q in entry =          13
  In of MODEL   65
    1    H    LEU  58           H        LEU  58  -4.085 -15.094   7.134
    2    HA   LEU  58           HA       LEU  58  -4.925 -16.893   5.119
    3    HB2  LEU  58           HB2      LEU  58  -4.260 -13.956   4.998
    4    HB3  LEU  58           HB3      LEU  58  -4.943 -14.873   3.654
    5    HG   LEU  58           HG       LEU  58  -6.217 -14.681   6.403
    6   HD11  LEU  58          HD11      LEU  58  -6.485 -13.016   3.920
    7   HD13  LEU  58          HD12      LEU  58  -6.464 -12.517   5.611
    8   HD12  LEU  58          HD13      LEU  58  -7.903 -13.279   4.936
    9   HD22  LEU  58          HD21      LEU  58  -7.218 -16.566   5.525
   10   HD21  LEU  58          HD22      LEU  58  -6.871 -16.113   3.856
   11   HD23  LEU  58          HD23      LEU  58  -8.219 -15.364   4.711

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  59           H        ILE  59  -1.766 -15.750   5.984
    2    HA   ILE  59           HA       ILE  59  -0.684 -16.486   3.343
    3    HB   ILE  59           HB       ILE  59   0.127 -14.443   4.915
    4   HG12  ILE  59          HG12      ILE  59   2.186 -16.140   3.489
    5   HG13  ILE  59          HG13      ILE  59   1.017 -15.170   2.631
    6   HG21  ILE  59          HG21      ILE  59   0.829 -16.235   6.675
    7   HG23  ILE  59          HG22      ILE  59   1.958 -14.948   6.316
    8   HG22  ILE  59          HG23      ILE  59   2.176 -16.547   5.606
    9   HD12  ILE  59          HD11      ILE  59   3.033 -14.155   4.633
   10   HD11  ILE  59          HD12      ILE  59   1.802 -13.154   3.866
   11   HD13  ILE  59          HD13      ILE  59   3.076 -13.889   2.892

  No H/Q in entry =          11
  In of MODEL   65
    1    H    GLU  60           H        GLU  60  -0.716 -17.608   6.705
    2    HA   GLU  60           HA       GLU  60   1.275 -19.626   6.430
    3    HB2  GLU  60           HB2      GLU  60   0.819 -19.217   8.652
    4    HB3  GLU  60           HB3      GLU  60  -0.911 -19.023   8.371
    5    HG2  GLU  60           HG2      GLU  60  -0.275 -21.134   9.621
    6    HG3  GLU  60           HG3      GLU  60  -1.217 -21.405   8.155

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLY  61           H        GLY  61  -2.237 -19.650   5.945
    2    HA3  GLY  61           HA2      GLY  61  -2.046 -22.443   4.973
    3    HA2  GLY  61           HA3      GLY  61  -3.516 -21.680   5.571

  No H/Q in entry =           3
  In of MODEL   65
    1    H    ASP  62           H        ASP  62  -1.258 -20.131   3.376
    2    HA   ASP  62           HA       ASP  62  -3.292 -19.445   1.520
    3    HB2  ASP  62           HB2      ASP  62  -1.198 -18.146   1.937
    4    HB3  ASP  62           HB3      ASP  62  -0.292 -19.420   1.128

  No H/Q in entry =           4
  In of MODEL   65
    1    H    ALA  63           H        ALA  63  -3.268 -22.314   1.848
    2    HA   ALA  63           HA       ALA  63  -1.940 -23.652  -0.285
    3    HB2  ALA  63           HB1      ALA  63  -4.553 -24.484   0.958
    4    HB1  ALA  63           HB2      ALA  63  -2.991 -24.718   1.743
    5    HB3  ALA  63           HB3      ALA  63  -3.331 -25.513   0.205

  No H/Q in entry =           5
  In of MODEL   65
    1    H    GLY  64           H        GLY  64  -5.114 -22.126   0.036
    2    HA3  GLY  64           HA2      GLY  64  -6.705 -21.510  -1.495
    3    HA2  GLY  64           HA3      GLY  64  -5.382 -21.364  -2.640

  No H/Q in entry =           3
  In of MODEL   65
    1    H    GLU  65           H        GLU  65  -6.015 -22.378  -4.472
    2    HA   GLU  65           HA       GLU  65  -7.823 -24.590  -4.432
    3    HB2  GLU  65           HB2      GLU  65  -6.185 -23.368  -6.650
    4    HB3  GLU  65           HB3      GLU  65  -7.340 -24.680  -6.892
    5    HG2  GLU  65           HG2      GLU  65  -9.150 -23.298  -6.005
    6    HG3  GLU  65           HG3      GLU  65  -8.015 -21.997  -5.656

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLY  66           H        GLY  66  -7.527 -26.658  -5.162
    2    HA3  GLY  66           HA2      GLY  66  -5.882 -28.385  -4.087
    3    HA2  GLY  66           HA3      GLY  66  -6.387 -28.596  -5.751

  No H/Q in entry =           3
  In of MODEL   65
    1    H    LYS  67           H        LYS  67  -4.923 -26.536  -6.932
    2    HA   LYS  67           HA       LYS  67  -2.366 -27.817  -7.156
    3    HB2  LYS  67           HB2      LYS  67  -3.613 -25.464  -8.566
    4    HB3  LYS  67           HB3      LYS  67  -2.019 -26.115  -8.965
    5    HG2  LYS  67           HG2      LYS  67  -3.010 -28.337  -9.354
    6    HG3  LYS  67           HG3      LYS  67  -4.603 -27.704  -8.945
    7    HD2  LYS  67           HD2      LYS  67  -4.480 -26.146 -10.852
    8    HD3  LYS  67           HD3      LYS  67  -2.881 -26.773 -11.260
    9    HE2  LYS  67           HE2      LYS  67  -3.837 -29.023 -11.585
   10    HE3  LYS  67           HE3      LYS  67  -5.435 -28.406 -11.170
   11    HZ3  LYS  67           HZ1      LYS  67  -5.555 -27.170 -13.099
   12    HZ2  LYS  67           HZ2      LYS  67  -4.779 -28.585 -13.629
   13    HZ1  LYS  67           HZ3      LYS  67  -3.879 -27.172 -13.345

  No H/Q in entry =          13
  In of MODEL   65
    1    H    MET  68           H        MET  68  -0.342 -26.854  -7.090
    2    HA   MET  68           HA       MET  68   0.450 -25.712  -4.747
    3    HB2  MET  68           HB2      MET  68   1.711 -25.560  -7.480
    4    HB3  MET  68           HB3      MET  68   2.524 -25.018  -6.011
    5    HG2  MET  68           HG2      MET  68   2.289 -27.249  -5.027
    6    HG3  MET  68           HG3      MET  68   1.405 -27.804  -6.450
    7    HE1  MET  68           HE1      MET  68   4.437 -26.471  -4.877
    8    HE3  MET  68           HE2      MET  68   4.765 -25.449  -6.274
    9    HE2  MET  68           HE3      MET  68   5.811 -26.826  -5.933

  No H/Q in entry =           9
  In of MODEL   65
    1    H    LYS  69           H        LYS  69  -1.359 -24.061  -7.045
    2    HA   LYS  69           HA       LYS  69  -0.201 -21.497  -6.948
    3    HB2  LYS  69           HB2      LYS  69  -1.776 -22.191  -8.689
    4    HB3  LYS  69           HB3      LYS  69  -3.085 -22.155  -7.501
    5    HG2  LYS  69           HG2      LYS  69  -2.670 -19.787  -7.065
    6    HG3  LYS  69           HG3      LYS  69  -1.304 -19.799  -8.180
    7    HD2  LYS  69           HD2      LYS  69  -2.820 -20.376 -10.037
    8    HD3  LYS  69           HD3      LYS  69  -4.188 -20.365  -8.922
    9    HE2  LYS  69           HE2      LYS  69  -4.072 -18.215 -10.085
   10    HE3  LYS  69           HE3      LYS  69  -3.688 -17.987  -8.379
   11    HZ1  LYS  69           HZ1      LYS  69  -1.293 -18.567  -9.557
   12    HZ3  LYS  69           HZ2      LYS  69  -1.828 -17.030  -9.071
   13    HZ2  LYS  69           HZ3      LYS  69  -2.055 -17.544 -10.674

  No H/Q in entry =          13
  In of MODEL   65
    1    H    VAL  70           H        VAL  70  -0.652 -19.613  -5.854
    2    HA   VAL  70           HA       VAL  70  -1.888 -19.958  -3.197
    3    HB   VAL  70           HB       VAL  70  -0.750 -17.717  -2.770
    4   HG11  VAL  70          HG11      VAL  70   0.811 -20.197  -3.514
    5   HG13  VAL  70          HG12      VAL  70   0.311 -19.667  -1.907
    6   HG12  VAL  70          HG13      VAL  70   1.577 -18.792  -2.770
    7   HG22  VAL  70          HG21      VAL  70   0.819 -16.847  -4.342
    8   HG21  VAL  70          HG22      VAL  70  -0.591 -17.259  -5.315
    9   HG23  VAL  70          HG23      VAL  70   0.809 -18.329  -5.299

  No H/Q in entry =           9
  In of MODEL   65
    1    H    SER  71           H        SER  71  -3.298 -18.329  -2.387
    2    HA   SER  71           HA       SER  71  -5.366 -17.511  -4.131
    3    HB2  SER  71           HB2      SER  71  -5.539 -17.820  -1.606
    4    HB3  SER  71           HB3      SER  71  -4.710 -16.275  -1.438
    5    HG   SER  71           HG       SER  71  -7.285 -16.856  -2.295

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LEU  72           H        LEU  72  -5.449 -15.891  -5.498
    2    HA   LEU  72           HA       LEU  72  -3.307 -14.118  -5.973
    3    HB2  LEU  72           HB2      LEU  72  -6.174 -14.109  -6.915
    4    HB3  LEU  72           HB3      LEU  72  -4.954 -12.974  -7.487
    5    HG   LEU  72           HG       LEU  72  -4.604 -15.987  -7.630
    6   HD13  LEU  72          HD11      LEU  72  -5.259 -15.825  -9.977
    7   HD12  LEU  72          HD12      LEU  72  -5.510 -14.086  -9.813
    8   HD11  LEU  72          HD13      LEU  72  -6.567 -15.214  -8.964
    9   HD23  LEU  72          HD21      LEU  72  -3.036 -15.147  -9.551
   10   HD22  LEU  72          HD22      LEU  72  -2.461 -15.003  -7.898
   11   HD21  LEU  72          HD23      LEU  72  -3.120 -13.594  -8.725

  No H/Q in entry =          11
  In of MODEL   65
    1    H    VAL  73           H        VAL  73  -6.391 -13.710  -4.337
    2    HA   VAL  73           HA       VAL  73  -6.382 -10.941  -3.970
    3    HB   VAL  73           HB       VAL  73  -8.123 -11.267  -2.432
    4   HG12  VAL  73          HG11      VAL  73  -8.183 -13.770  -4.130
    5   HG11  VAL  73          HG12      VAL  73  -8.489 -12.160  -4.778
    6   HG13  VAL  73          HG13      VAL  73  -9.560 -12.833  -3.548
    7   HG23  VAL  73          HG21      VAL  73  -8.471 -13.580  -1.398
    8   HG22  VAL  73          HG22      VAL  73  -7.092 -12.665  -0.788
    9   HG21  VAL  73          HG23      VAL  73  -6.842 -13.966  -1.951

  No H/Q in entry =           9
  In of MODEL   65
    1    H    LEU  74           H        LEU  74  -4.488 -13.354  -2.403
    2    HA   LEU  74           HA       LEU  74  -4.050 -12.236   0.125
    3    HB2  LEU  74           HB2      LEU  74  -3.310 -14.466  -0.388
    4    HB3  LEU  74           HB3      LEU  74  -2.246 -13.867  -1.659
    5    HG   LEU  74           HG       LEU  74  -0.952 -12.611   0.065
    6   HD12  LEU  74          HD11      LEU  74  -1.392 -13.434   2.467
    7   HD11  LEU  74          HD12      LEU  74  -2.969 -13.958   1.871
    8   HD13  LEU  74          HD13      LEU  74  -2.526 -12.252   1.815
    9   HD23  LEU  74          HD21      LEU  74  -1.134 -15.451   0.964
   10   HD22  LEU  74          HD22      LEU  74   0.270 -14.458   0.648
   11   HD21  LEU  74          HD23      LEU  74  -0.648 -15.102  -0.693

  No H/Q in entry =          11
  In of MODEL   65
    1    H    VAL  75           H        VAL  75  -2.157 -11.862  -2.833
    2    HA   VAL  75           HA       VAL  75  -0.321  -9.978  -1.815
    3    HB   VAL  75           HB       VAL  75  -1.292 -10.411  -4.642
    4   HG12  VAL  75          HG11      VAL  75   0.801  -9.159  -5.255
    5   HG11  VAL  75          HG12      VAL  75   1.044  -8.801  -3.552
    6   HG13  VAL  75          HG13      VAL  75  -0.353  -8.148  -4.391
    7   HG22  VAL  75          HG21      VAL  75   0.836 -11.639  -4.848
    8   HG21  VAL  75          HG22      VAL  75  -0.146 -12.332  -3.557
    9   HG23  VAL  75          HG23      VAL  75   1.218 -11.284  -3.162

  No H/Q in entry =           9
  In of MODEL   65
    1    H    GLU  76           H        GLU  76  -3.468  -9.561  -3.465
    2    HA   GLU  76           HA       GLU  76  -3.466  -6.746  -3.550
    3    HB2  GLU  76           HB2      GLU  76  -5.154  -8.133  -4.722
    4    HB3  GLU  76           HB3      GLU  76  -5.807  -8.650  -3.175
    5    HG2  GLU  76           HG2      GLU  76  -7.247  -6.906  -4.000
    6    HG3  GLU  76           HG3      GLU  76  -6.331  -6.214  -2.675

  No H/Q in entry =           6
  In of MODEL   65
    1    H    ALA  77           H        ALA  77  -4.614  -8.967  -1.021
    2    HA   ALA  77           HA       ALA  77  -5.529  -6.957   0.751
    3    HB1  ALA  77           HB1      ALA  77  -4.410  -9.634   1.587
    4    HB2  ALA  77           HB2      ALA  77  -6.010  -9.452   0.873
    5    HB3  ALA  77           HB3      ALA  77  -5.636  -8.667   2.405

  No H/Q in entry =           5
  In of MODEL   65
    1    H    GLN  78           H        GLN  78  -2.413  -8.564   0.372
    2    HA   GLN  78           HA       GLN  78  -1.129  -7.442   2.626
    3    HB2  GLN  78           HB2      GLN  78  -0.307  -9.391   1.260
    4    HB3  GLN  78           HB3      GLN  78   0.147  -8.248  -0.002
    5    HG2  GLN  78           HG2      GLN  78   1.631  -7.086   1.585
    6    HG3  GLN  78           HG3      GLN  78   1.184  -8.231   2.846
    7   HE21  GLN  78          HE21      GLN  78   3.906  -7.998   2.004
    8   HE22  GLN  78          HE22      GLN  78   4.342  -9.428   1.199

  No H/Q in entry =           8
  In of MODEL   65
    1    H    LEU  79           H        LEU  79  -1.480  -6.355  -0.714
    2    HA   LEU  79           HA       LEU  79   0.250  -4.162  -0.691
    3    HB2  LEU  79           HB2      LEU  79  -0.796  -4.936  -2.748
    4    HB3  LEU  79           HB3      LEU  79  -2.391  -4.516  -2.134
    5    HG   LEU  79           HG       LEU  79  -1.799  -2.140  -2.096
    6   HD13  LEU  79          HD11      LEU  79   0.446  -1.945  -1.586
    7   HD12  LEU  79          HD12      LEU  79   0.498  -1.648  -3.323
    8   HD11  LEU  79          HD13      LEU  79   0.922  -3.239  -2.687
    9   HD23  LEU  79          HD21      LEU  79  -1.165  -1.940  -4.648
   10   HD22  LEU  79          HD22      LEU  79  -2.706  -2.659  -4.190
   11   HD21  LEU  79          HD23      LEU  79  -1.354  -3.693  -4.643

  No H/Q in entry =          11
  In of MODEL   65
    1    H    HIS  80           H        HIS  80  -3.218  -4.259   0.141
    2    HA   HIS  80           HA       HIS  80  -3.352  -1.503   0.820
    3    HB2  HIS  80           HB2      HIS  80  -5.102  -3.878   1.128
    4    HB3  HIS  80           HB3      HIS  80  -5.393  -2.538   2.241
    5    HD1  HIS  80           HD1      HIS  80  -6.979  -0.864   1.345
    6    HD2  HIS  80           HD2      HIS  80  -4.828  -2.703  -1.717
    7    HE1  HIS  80           HE1      HIS  80  -7.802   0.163  -0.827
    8    HE2  HIS  80           HE2      HIS  80  -6.497  -0.953  -2.702

  No H/Q in entry =           8
  In of MODEL   65
    1    H    LEU  81           H        LEU  81  -2.920  -4.419   2.796
    2    HA   LEU  81           HA       LEU  81  -2.875  -3.086   5.288
    3    HB2  LEU  81           HB2      LEU  81  -1.712  -5.722   4.391
    4    HB3  LEU  81           HB3      LEU  81  -1.672  -5.174   6.068
    5    HG   LEU  81           HG       LEU  81  -4.225  -5.364   4.443
    6   HD12  LEU  81          HD11      LEU  81  -4.568  -7.432   5.980
    7   HD11  LEU  81          HD12      LEU  81  -2.814  -7.398   6.163
    8   HD13  LEU  81          HD13      LEU  81  -3.530  -7.605   4.564
    9   HD23  LEU  81          HD21      LEU  81  -5.068  -5.564   6.945
   10   HD22  LEU  81          HD22      LEU  81  -4.711  -3.978   6.263
   11   HD21  LEU  81          HD23      LEU  81  -3.539  -4.769   7.317

  No H/Q in entry =          11
  In of MODEL   65
    1    H    MET  82           H        MET  82  -0.217  -4.033   3.107
    2    HA   MET  82           HA       MET  82   1.887  -3.192   4.792
    3    HB2  MET  82           HB2      MET  82   1.660  -3.512   1.798
    4    HB3  MET  82           HB3      MET  82   3.155  -2.977   2.562
    5    HG2  MET  82           HG2      MET  82   1.695  -5.540   3.274
    6    HG3  MET  82           HG3      MET  82   3.066  -5.453   2.172
    7    HE3  MET  82           HE1      MET  82   6.100  -4.792   4.154
    8    HE2  MET  82           HE2      MET  82   5.205  -3.402   3.545
    9    HE1  MET  82           HE3      MET  82   5.261  -4.889   2.601

  No H/Q in entry =           9
  In of MODEL   65
    1    H    THR  83           H        THR  83   0.096  -1.497   2.248
    2    HA   THR  83           HA       THR  83   1.560   0.920   2.345
    3    HB   THR  83           HB       THR  83  -0.598   1.896   1.368
    4    HG1  THR  83           HG1      THR  83  -2.276   0.635   1.258
    5   HG22  THR  83          HG21      THR  83  -0.370   0.084  -0.643
    6   HG21  THR  83          HG22      THR  83   1.125  -0.245   0.229
    7   HG23  THR  83          HG23      THR  83   0.797   1.379  -0.376

  No H/Q in entry =           7
  In of MODEL   65
    1    H    SER  84           H        SER  84  -1.465  -0.057   3.947
    2    HA   SER  84           HA       SER  84  -1.906   2.375   5.306
    3    HB2  SER  84           HB2      SER  84  -2.799  -0.447   5.856
    4    HB3  SER  84           HB3      SER  84  -3.261   0.898   6.897
    5    HG   SER  84           HG       SER  84  -3.732   0.610   4.104

  No H/Q in entry =           5
  In of MODEL   65
    1    H    MET  85           H        MET  85  -0.258  -0.599   6.415
    2    HA   MET  85           HA       MET  85   0.287   0.301   9.024
    3    HB2  MET  85           HB2      MET  85   0.527  -2.044   8.333
    4    HB3  MET  85           HB3      MET  85   1.916  -1.606   7.338
    5    HG2  MET  85           HG2      MET  85   3.119  -0.815   9.334
    6    HG3  MET  85           HG3      MET  85   1.720  -1.200  10.338
    7    HE2  MET  85           HE1      MET  85   4.700  -3.944   8.293
    8    HE1  MET  85           HE2      MET  85   4.307  -2.262   7.946
    9    HE3  MET  85           HE3      MET  85   3.300  -3.549   7.289

  No H/Q in entry =           9
  In of MODEL   65
    1    H    LEU  86           H        LEU  86   2.221   0.531   6.070
    2    HA   LEU  86           HA       LEU  86   4.465   1.787   7.228
    3    HB2  LEU  86           HB2      LEU  86   4.246   0.722   4.914
    4    HB3  LEU  86           HB3      LEU  86   3.469   2.223   4.411
    5    HG   LEU  86           HG       LEU  86   5.526   3.419   5.394
    6   HD11  LEU  86          HD11      LEU  86   6.176   0.789   6.178
    7   HD13  LEU  86          HD12      LEU  86   7.211   2.211   6.281
    8   HD12  LEU  86          HD13      LEU  86   7.294   1.168   4.864
    9   HD23  LEU  86          HD21      LEU  86   6.200   1.654   3.033
   10   HD22  LEU  86          HD22      LEU  86   6.631   3.341   3.303
   11   HD21  LEU  86          HD23      LEU  86   4.968   2.911   2.905

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ALA  87           H        ALA  87   1.578   3.103   5.657
    2    HA   ALA  87           HA       ALA  87   2.232   5.818   5.754
    3    HB1  ALA  87           HB1      ALA  87  -0.113   4.245   5.209
    4    HB3  ALA  87           HB2      ALA  87   0.233   5.901   4.717
    5    HB2  ALA  87           HB3      ALA  87  -0.565   5.589   6.260

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ARG  88           H        ARG  88   0.503   3.842   8.136
    2    HA   ARG  88           HA       ARG  88   0.041   5.892   9.995
    3    HB2  ARG  88           HB2      ARG  88  -0.949   3.560  10.051
    4    HB3  ARG  88           HB3      ARG  88   0.581   3.023  10.751
    5    HG2  ARG  88           HG2      ARG  88   0.154   5.098  12.383
    6    HG3  ARG  88           HG3      ARG  88  -1.520   4.812  11.929
    7    HD2  ARG  88           HD2      ARG  88  -1.666   2.959  13.166
    8    HD3  ARG  88           HD3      ARG  88  -0.091   2.346  12.628
    9    HE   ARG  88           HE       ARG  88  -0.592   3.607  15.090
   10   HH21  ARG  88          HH11      ARG  88   0.991   4.578  16.331
   11   HH22  ARG  88          HH12      ARG  88   2.518   4.975  15.625
   12   HH11  ARG  88          HH21      ARG  88   1.687   3.752  12.509
   13   HH12  ARG  88          HH22      ARG  88   2.920   4.491  13.473

  No H/Q in entry =          13
  In of MODEL   65
    1    H    GLU  89           H        GLU  89   2.787   3.614   9.755
    2    HA   GLU  89           HA       GLU  89   4.073   4.462  12.101
    3    HB2  GLU  89           HB2      GLU  89   4.685   2.437  10.745
    4    HB3  GLU  89           HB3      GLU  89   5.482   3.520   9.602
    5    HG2  GLU  89           HG2      GLU  89   6.988   4.326  11.348
    6    HG3  GLU  89           HG3      GLU  89   6.135   3.381  12.564

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LEU  90           H        LEU  90   4.408   5.631   8.778
    2    HA   LEU  90           HA       LEU  90   6.382   7.586   9.370
    3    HB2  LEU  90           HB2      LEU  90   4.365   7.309   7.145
    4    HB3  LEU  90           HB3      LEU  90   5.622   8.553   7.170
    5    HG   LEU  90           HG       LEU  90   6.234   5.601   7.488
    6   HD12  LEU  90          HD11      LEU  90   6.983   5.831   5.048
    7   HD11  LEU  90          HD12      LEU  90   5.998   7.294   5.009
    8   HD13  LEU  90          HD13      LEU  90   5.245   5.735   5.345
    9   HD22  LEU  90          HD21      LEU  90   8.156   6.707   8.172
   10   HD21  LEU  90          HD22      LEU  90   7.835   8.124   7.173
   11   HD23  LEU  90          HD23      LEU  90   8.462   6.649   6.437

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  91           H        ILE  91   2.844   7.677   9.228
    2    HA   ILE  91           HA       ILE  91   2.561  10.454   9.694
    3    HB   ILE  91           HB       ILE  91   0.721   8.114  10.228
    4   HG12  ILE  91          HG12      ILE  91   0.517  10.410   8.255
    5   HG13  ILE  91          HG13      ILE  91   1.345   8.900   7.874
    6   HG22  ILE  91          HG21      ILE  91  -0.968  10.207  10.305
    7   HG21  ILE  91          HG22      ILE  91   0.452  11.005  10.980
    8   HG23  ILE  91          HG23      ILE  91  -0.213   9.577  11.770
    9   HD13  ILE  91          HD11      ILE  91  -0.625   7.653   7.915
   10   HD12  ILE  91          HD12      ILE  91  -1.184   9.183   7.243
   11   HD11  ILE  91          HD13      ILE  91  -1.460   8.816   8.946

  No H/Q in entry =          11
  In of MODEL   65
    1    H    THR  92           H        THR  92   2.911   7.693  11.880
    2    HA   THR  92           HA       THR  92   2.500   9.063  14.312
    3    HB   THR  92           HB       THR  92   4.259   6.695  13.632
    4    HG1  THR  92           HG1      THR  92   2.275   5.979  13.531
    5   HG22  THR  92          HG21      THR  92   3.875   6.406  16.265
    6   HG21  THR  92          HG22      THR  92   3.846   8.166  16.201
    7   HG23  THR  92          HG23      THR  92   5.260   7.284  15.621

  No H/Q in entry =           7
  In of MODEL   65
    1    H    GLU  93           H        GLU  93   5.438   8.564  12.371
    2    HA   GLU  93           HA       GLU  93   7.223   9.947  14.072
    3    HB2  GLU  93           HB2      GLU  93   7.300   9.646  11.055
    4    HB3  GLU  93           HB3      GLU  93   8.653  10.144  12.070
    5    HG2  GLU  93           HG2      GLU  93   7.192   7.534  12.507
    6    HG3  GLU  93           HG3      GLU  93   8.576   7.663  11.429

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LEU  94           H        LEU  94   5.191  11.016  11.368
    2    HA   LEU  94           HA       LEU  94   6.049  13.704  11.279
    3    HB2  LEU  94           HB2      LEU  94   3.431  12.394  10.523
    4    HB3  LEU  94           HB3      LEU  94   3.723  14.117  10.290
    5    HG   LEU  94           HG       LEU  94   5.699  12.095   9.227
    6   HD11  LEU  94          HD11      LEU  94   2.967  12.705   8.171
    7   HD13  LEU  94          HD12      LEU  94   3.921  11.230   8.037
    8   HD12  LEU  94          HD13      LEU  94   4.282  12.609   6.999
    9   HD23  LEU  94          HD21      LEU  94   5.983  13.935   7.512
   10   HD22  LEU  94          HD22      LEU  94   6.410  14.411   9.156
   11   HD21  LEU  94          HD23      LEU  94   4.867  14.913   8.462

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  95           H        ILE  95   3.483  12.128  13.167
    2    HA   ILE  95           HA       ILE  95   2.488  14.492  14.375
    3    HB   ILE  95           HB       ILE  95   2.451  11.606  15.286
    4   HG12  ILE  95          HG12      ILE  95   0.263  13.427  14.248
    5   HG13  ILE  95          HG13      ILE  95   1.198  12.354  13.210
    6   HG21  ILE  95          HG21      ILE  95   1.218  14.096  16.501
    7   HG23  ILE  95          HG22      ILE  95   2.245  12.904  17.298
    8   HG22  ILE  95          HG23      ILE  95   0.601  12.477  16.824
    9   HD13  ILE  95          HD11      ILE  95   0.259  10.429  14.121
   10   HD12  ILE  95          HD12      ILE  95  -1.102  11.544  14.205
   11   HD11  ILE  95          HD13      ILE  95  -0.141  11.221  15.647

  No H/Q in entry =          11
  In of MODEL   65
    1    H    GLU  96           H        GLU  96   5.042  12.219  15.356
    2    HA   GLU  96           HA       GLU  96   5.623  13.395  17.852
    3    HB2  GLU  96           HB2      GLU  96   6.529  11.221  17.193
    4    HB3  GLU  96           HB3      GLU  96   7.475  11.983  15.916
    5    HG2  GLU  96           HG2      GLU  96   9.136  12.493  17.378
    6    HG3  GLU  96           HG3      GLU  96   8.006  13.323  18.439

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LEU  97           H        LEU  97   6.707  14.162  14.569
    2    HA   LEU  97           HA       LEU  97   8.631  16.120  15.287
    3    HB2  LEU  97           HB2      LEU  97   7.026  15.612  12.792
    4    HB3  LEU  97           HB3      LEU  97   8.072  17.024  12.919
    5    HG   LEU  97           HG       LEU  97   9.050  14.205  13.464
    6   HD12  LEU  97          HD11      LEU  97  10.047  14.392  11.146
    7   HD11  LEU  97          HD12      LEU  97   9.021  15.803  10.891
    8   HD13  LEU  97          HD13      LEU  97   8.293  14.222  11.179
    9   HD23  LEU  97          HD21      LEU  97  11.242  15.447  12.724
   10   HD22  LEU  97          HD22      LEU  97  10.630  15.720  14.355
   11   HD21  LEU  97          HD23      LEU  97  10.336  16.915  13.093

  No H/Q in entry =          11
  In of MODEL   65
    1    H    HIS  98           H        HIS  98   5.142  16.322  14.639
    2    HA   HIS  98           HA       HIS  98   4.894  19.126  14.788
    3    HB2  HIS  98           HB2      HIS  98   2.964  16.907  15.506
    4    HB3  HIS  98           HB3      HIS  98   2.529  18.615  15.570
    5    HD1  HIS  98           HD1      HIS  98   3.497  15.894  13.151
    6    HD2  HIS  98           HD2      HIS  98   2.193  19.852  13.049
    7    HE1  HIS  98           HE1      HIS  98   2.943  16.404  10.730
    8    HE2  HIS  98           HE2      HIS  98   2.152  18.809  10.647

  No H/Q in entry =           8
  In of MODEL   65
    1    H    GLU  99           H        GLU  99   4.985  16.623  17.275
    2    HA   GLU  99           HA       GLU  99   4.411  18.318  19.481
    3    HB2  GLU  99           HB2      GLU  99   4.278  15.838  19.567
    4    HB3  GLU  99           HB3      GLU  99   6.036  15.761  19.456
    5    HG2  GLU  99           HG2      GLU  99   6.251  17.040  21.536
    6    HG3  GLU  99           HG3      GLU  99   4.501  17.212  21.635

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LYS 100           H        LYS 100   7.445  17.340  17.908
    2    HA   LYS 100           HA       LYS 100   9.128  18.701  19.769
    3    HB2  LYS 100           HB2      LYS 100   9.606  17.782  16.925
    4    HB3  LYS 100           HB3      LYS 100  10.851  18.524  17.935
    5    HG2  LYS 100           HG2      LYS 100  10.445  16.772  19.668
    6    HG3  LYS 100           HG3      LYS 100   9.298  15.994  18.575
    7    HD2  LYS 100           HD2      LYS 100  11.084  15.687  16.904
    8    HD3  LYS 100           HD3      LYS 100  12.237  16.477  17.982
    9    HE2  LYS 100           HE2      LYS 100  11.811  14.720  19.692
   10    HE3  LYS 100           HE3      LYS 100  10.720  13.910  18.564
   11    HZ1  LYS 100           HZ1      LYS 100  13.551  14.531  17.908
   12    HZ3  LYS 100           HZ2      LYS 100  12.487  13.499  17.077
   13    HZ2  LYS 100           HZ3      LYS 100  13.070  13.062  18.612

  No H/Q in entry =          13
  In of MODEL   65
    1    H    LEU 101           H        LEU 101   7.447  19.673  16.820
    2    HA   LEU 101           HA       LEU 101   8.707  22.209  16.496
    3    HB2  LEU 101           HB2      LEU 101   6.089  21.027  15.607
    4    HB3  LEU 101           HB3      LEU 101   6.371  22.754  15.408
    5    HG   LEU 101           HG       LEU 101   8.369  20.706  14.429
    6   HD12  LEU 101          HD11      LEU 101   7.222  21.244  12.148
    7   HD11  LEU 101          HD12      LEU 101   5.832  21.695  13.133
    8   HD13  LEU 101          HD13      LEU 101   6.466  20.052  13.206
    9   HD21  LEU 101          HD21      LEU 101   7.793  23.632  13.889
   10   HD23  LEU 101          HD22      LEU 101   8.755  22.660  12.776
   11   HD22  LEU 101          HD23      LEU 101   9.303  22.899  14.434

  No H/Q in entry =          11
  In of MODEL   65
    1    H    LYS 102           H        LYS 102   7.153  21.087  19.108
    2    HA   LYS 102           HA       LYS 102   6.544  22.180  21.047
    3    HB2  LYS 102           HB2      LYS 102   7.861  24.152  19.930
    4    HB3  LYS 102           HB3      LYS 102   6.273  24.788  19.560
    5    HG2  LYS 102           HG2      LYS 102   7.649  24.493  22.209
    6    HG3  LYS 102           HG3      LYS 102   6.720  25.842  21.588
    7    HD2  LYS 102           HD2      LYS 102   5.429  23.225  22.455
    8    HD3  LYS 102           HD3      LYS 102   5.704  24.576  23.545
    9    HE2  LYS 102           HE2      LYS 102   3.416  24.223  22.058
   10    HE3  LYS 102           HE3      LYS 102   3.948  25.756  22.747
   11    HZ2  LYS 102           HZ1      LYS 102   3.417  25.885  20.368
   12    HZ1  LYS 102           HZ2      LYS 102   4.657  24.782  20.038
   13    HZ3  LYS 102           HZ3      LYS 102   5.030  26.302  20.688

  No H/Q in entry =          13
  In of MODEL   65
    1    H    ALA 103           H        ALA 103   4.931  23.767  18.290
    2    HA   ALA 103           HA       ALA 103   2.489  24.384  19.181
    3    HB1  ALA 103           HB1      ALA 103   1.572  23.571  16.936
    4    HB2  ALA 103           HB2      ALA 103   3.208  23.005  16.601
    5    HB3  ALA 103           HB3      ALA 103   2.906  24.721  16.877

  No H/Q in entry =           5
  In of MODEL   65
    1    H1   ALA   1           H3       ALA   1  10.222 -20.140  -6.329
    2    H2   ALA   1           H2       ALA   1   9.252 -20.321  -7.714
    3    H3   ALA   1           H1       ALA   1   8.802 -21.066  -6.254
    4    HA   ALA   1           HA       ALA   1   9.806 -22.891  -7.004
    5    HB1  ALA   1           HB1      ALA   1   9.905 -22.522  -9.278
    6    HB2  ALA   1           HB2      ALA   1  11.635 -22.407  -8.952
    7    HB3  ALA   1           HB3      ALA   1  10.664 -20.940  -9.093

  No H/Q in entry =           7
  In of MODEL   65
    1    H    GLU   2           H        GLU   2  12.071 -23.885  -7.071
    2    HA   GLU   2           HA       GLU   2  13.457 -23.841  -4.861
    3    HB2  GLU   2           HB2      GLU   2  14.811 -23.722  -7.562
    4    HB3  GLU   2           HB3      GLU   2  15.530 -24.355  -6.082
    5    HG2  GLU   2           HG2      GLU   2  14.474 -26.350  -6.331
    6    HG3  GLU   2           HG3      GLU   2  12.917 -25.573  -6.583

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLU   3           H        GLU   3  15.260 -21.999  -7.257
    2    HA   GLU   3           HA       GLU   3  16.449 -20.345  -5.290
    3    HB2  GLU   3           HB2      GLU   3  16.388 -20.326  -8.300
    4    HB3  GLU   3           HB3      GLU   3  17.161 -19.016  -7.408
    5    HG2  GLU   3           HG2      GLU   3  18.798 -20.427  -6.495
    6    HG3  GLU   3           HG3      GLU   3  17.823 -21.874  -6.722

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LEU   4           H        LEU   4  14.180 -19.439  -7.913
    2    HA   LEU   4           HA       LEU   4  13.765 -16.825  -7.287
    3    HB2  LEU   4           HB2      LEU   4  11.551 -18.753  -8.023
    4    HB3  LEU   4           HB3      LEU   4  11.509 -17.002  -8.213
    5    HG   LEU   4           HG       LEU   4  13.435 -18.896  -9.599
    6   HD13  LEU   4          HD11      LEU   4  12.133 -18.712 -11.506
    7   HD12  LEU   4          HD12      LEU   4  11.456 -17.156 -11.029
    8   HD11  LEU   4          HD13      LEU   4  10.875 -18.639 -10.274
    9   HD23  LEU   4          HD21      LEU   4  13.813 -16.651 -10.940
   10   HD22  LEU   4          HD22      LEU   4  14.670 -16.918  -9.423
   11   HD21  LEU   4          HD23      LEU   4  13.237 -15.893  -9.454

  No H/Q in entry =          11
  In of MODEL   65
    1    H    GLU   5           H        GLU   5  12.229 -19.588  -5.656
    2    HA   GLU   5           HA       GLU   5  10.586 -17.992  -3.942
    3    HB2  GLU   5           HB2      GLU   5  10.113 -20.359  -4.474
    4    HB3  GLU   5           HB3      GLU   5  11.540 -20.828  -3.549
    5    HG2  GLU   5           HG2      GLU   5  10.602 -19.813  -1.530
    6    HG3  GLU   5           HG3      GLU   5   9.195 -19.265  -2.442

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLU   6           H        GLU   6  13.702 -19.635  -3.514
    2    HA   GLU   6           HA       GLU   6  14.076 -18.800  -0.812
    3    HB2  GLU   6           HB2      GLU   6  15.284 -20.649  -2.336
    4    HB3  GLU   6           HB3      GLU   6  16.438 -19.330  -2.539
    5    HG2  GLU   6           HG2      GLU   6  15.446 -20.355   0.135
    6    HG3  GLU   6           HG3      GLU   6  16.993 -20.784  -0.594

  No H/Q in entry =           6
  In of MODEL   65
    1    H    VAL   7           H        VAL   7  14.861 -17.472  -3.956
    2    HA   VAL   7           HA       VAL   7  16.589 -15.383  -3.084
    3    HB   VAL   7           HB       VAL   7  14.872 -15.701  -5.560
    4   HG11  VAL   7          HG11      VAL   7  16.809 -13.528  -4.740
    5   HG13  VAL   7          HG12      VAL   7  15.169 -13.351  -5.359
    6   HG12  VAL   7          HG13      VAL   7  16.466 -13.873  -6.435
    7   HG21  VAL   7          HG21      VAL   7  16.952 -17.200  -5.002
    8   HG23  VAL   7          HG22      VAL   7  17.884 -15.755  -5.395
    9   HG22  VAL   7          HG23      VAL   7  16.831 -16.478  -6.608

  No H/Q in entry =           9
  In of MODEL   65
    1    H    VAL   8           H        VAL   8  13.091 -15.583  -3.635
    2    HA   VAL   8           HA       VAL   8  12.478 -12.865  -3.148
    3    HB   VAL   8           HB       VAL   8  10.868 -15.404  -2.851
    4   HG11  VAL   8          HG11      VAL   8  10.112 -12.542  -2.243
    5   HG13  VAL   8          HG12      VAL   8   9.871 -13.972  -1.240
    6   HG12  VAL   8          HG13      VAL   8   8.903 -13.743  -2.695
    7   HG23  VAL   8          HG21      VAL   8   9.748 -13.588  -4.729
    8   HG22  VAL   8          HG22      VAL   8  10.614 -15.081  -5.084
    9   HG21  VAL   8          HG23      VAL   8  11.488 -13.555  -5.015

  No H/Q in entry =           9
  In of MODEL   65
    1    H    MET   9           H        MET   9  12.696 -15.687  -0.983
    2    HA   MET   9           HA       MET   9  11.909 -14.412   1.395
    3    HB2  MET   9           HB2      MET   9  13.768 -16.720   0.837
    4    HB3  MET   9           HB3      MET   9  13.489 -16.141   2.479
    5    HG2  MET   9           HG2      MET   9  11.049 -16.464   2.161
    6    HG3  MET   9           HG3      MET   9  11.360 -17.097   0.544
    7    HE2  MET   9           HE1      MET   9  10.921 -18.276   4.317
    8    HE1  MET   9           HE2      MET   9  12.258 -17.147   4.111
    9    HE3  MET   9           HE3      MET   9  12.585 -18.814   4.578

  No H/Q in entry =           9
  In of MODEL   65
    1    H    GLY  10           H        GLY  10  15.082 -14.687  -0.169
    2    HA3  GLY  10           HA2      GLY  10  16.571 -13.304   1.806
    3    HA2  GLY  10           HA3      GLY  10  17.028 -13.469   0.111

  No H/Q in entry =           3
  In of MODEL   65
    1    H    LEU  11           H        LEU  11  14.880 -12.202  -1.119
    2    HA   LEU  11           HA       LEU  11  15.615  -9.471  -0.942
    3    HB2  LEU  11           HB2      LEU  11  13.220 -10.831  -2.180
    4    HB3  LEU  11           HB3      LEU  11  13.531  -9.101  -2.332
    5    HG   LEU  11           HG       LEU  11  15.519 -11.242  -3.134
    6   HD13  LEU  11          HD11      LEU  11  13.764 -11.570  -4.653
    7   HD12  LEU  11          HD12      LEU  11  14.787 -10.402  -5.489
    8   HD11  LEU  11          HD13      LEU  11  13.324  -9.861  -4.665
    9   HD22  LEU  11          HD21      LEU  11  16.786  -9.302  -2.901
   10   HD21  LEU  11          HD22      LEU  11  15.429  -8.239  -3.271
   11   HD23  LEU  11          HD23      LEU  11  16.242  -9.115  -4.566

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  12           H        ILE  12  12.816 -11.253   0.320
    2    HA   ILE  12           HA       ILE  12  11.464  -9.011   1.394
    3    HB   ILE  12           HB       ILE  12  11.453 -11.909   2.292
    4   HG12  ILE  12          HG12      ILE  12  10.718 -11.212  -0.113
    5   HG13  ILE  12          HG13      ILE  12   9.663 -12.267   0.807
    6   HG22  ILE  12          HG21      ILE  12   9.191 -11.274   3.262
    7   HG21  ILE  12          HG22      ILE  12   9.634  -9.587   3.003
    8   HG23  ILE  12          HG23      ILE  12  10.582 -10.590   4.101
    9   HD11  ILE  12          HD11      ILE  12   9.379  -9.257   0.604
   10   HD13  ILE  12          HD12      ILE  12   8.262 -10.363   1.400
   11   HD12  ILE  12          HD13      ILE  12   8.457 -10.415  -0.339

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  13           H        ILE  13  13.821 -11.264   2.784
    2    HA   ILE  13           HA       ILE  13  13.881 -10.099   5.370
    3    HB   ILE  13           HB       ILE  13  15.905 -11.702   3.791
    4   HG12  ILE  13          HG12      ILE  13  13.609 -12.615   4.667
    5   HG13  ILE  13          HG13      ILE  13  15.068 -13.578   4.885
    6   HG22  ILE  13          HG21      ILE  13  16.844 -12.076   6.229
    7   HG21  ILE  13          HG22      ILE  13  16.108 -10.510   6.547
    8   HG23  ILE  13          HG23      ILE  13  17.350 -10.665   5.303
    9   HD12  ILE  13          HD11      ILE  13  13.575 -13.367   6.956
   10   HD11  ILE  13          HD12      ILE  13  14.036 -11.669   6.994
   11   HD13  ILE  13          HD13      ILE  13  15.263 -12.913   7.186

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ASN  14           H        ASN  14  15.838  -9.585   2.451
    2    HA   ASN  14           HA       ASN  14  17.616  -7.678   3.520
    3    HB2  ASN  14           HB2      ASN  14  17.569  -8.932   1.198
    4    HB3  ASN  14           HB3      ASN  14  16.698  -7.498   0.670
    5   HD21  ASN  14          HD21      ASN  14  19.131  -7.870  -0.522
    6   HD22  ASN  14          HD22      ASN  14  20.292  -6.809   0.109

  No H/Q in entry =           6
  In of MODEL   65
    1    H    SER  15           H        SER  15  14.508  -7.272   1.834
    2    HA   SER  15           HA       SER  15  14.441  -4.451   1.905
    3    HB2  SER  15           HB2      SER  15  12.102  -4.659   1.416
    4    HB3  SER  15           HB3      SER  15  12.878  -6.029   0.631
    5    HG   SER  15           HG       SER  15  11.145  -5.946   2.772

  No H/Q in entry =           5
  In of MODEL   65
    1    H    GLY  16           H        GLY  16  13.312  -6.905   4.198
    2    HA3  GLY  16           HA2      GLY  16  12.121  -5.147   6.066
    3    HA2  GLY  16           HA3      GLY  16  12.711  -6.766   6.419

  No H/Q in entry =           3
  In of MODEL   65
    1    H    GLN  17           H        GLN  17  15.427  -6.472   5.824
    2    HA   GLN  17           HA       GLN  17  16.405  -5.278   8.210
    3    HB2  GLN  17           HB2      GLN  17  17.596  -7.087   6.985
    4    HB3  GLN  17           HB3      GLN  17  17.941  -5.949   5.682
    5    HG2  GLN  17           HG2      GLN  17  19.874  -6.070   7.156
    6    HG3  GLN  17           HG3      GLN  17  19.121  -4.485   7.325
    7   HE21  GLN  17          HE21      GLN  17  19.640  -4.056   9.527
    8   HE22  GLN  17          HE22      GLN  17  19.113  -5.033  10.812

  No H/Q in entry =           8
  In of MODEL   65
    1    H    ALA  18           H        ALA  18  16.228  -4.180   4.856
    2    HA   ALA  18           HA       ALA  18  17.700  -1.811   5.093
    3    HB1  ALA  18           HB1      ALA  18  16.561  -2.998   3.020
    4    HB3  ALA  18           HB2      ALA  18  16.852  -1.259   3.013
    5    HB2  ALA  18           HB3      ALA  18  15.244  -1.882   3.382

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ARG  19           H        ARG  19  14.192  -2.348   5.491
    2    HA   ARG  19           HA       ARG  19  13.565   0.308   6.221
    3    HB2  ARG  19           HB2      ARG  19  11.857  -1.416   5.628
    4    HB3  ARG  19           HB3      ARG  19  12.189  -2.226   7.160
    5    HG2  ARG  19           HG2      ARG  19  11.510  -0.231   8.411
    6    HG3  ARG  19           HG3      ARG  19  11.271   0.657   6.907
    7    HD2  ARG  19           HD2      ARG  19   9.119  -0.112   7.726
    8    HD3  ARG  19           HD3      ARG  19   9.523  -0.990   6.244
    9    HE   ARG  19           HE       ARG  19  10.461  -2.557   8.340
   10   HH21  ARG  19          HH11      ARG  19   9.189  -4.183   9.273
   11   HH22  ARG  19          HH12      ARG  19   7.469  -4.129   9.104
   12   HH11  ARG  19          HH21      ARG  19   7.485  -1.215   7.256
   13   HH12  ARG  19          HH22      ARG  19   6.505  -2.449   7.958

  No H/Q in entry =          13
  In of MODEL   65
    1    H    SER  20           H        SER  20  14.383  -2.545   8.164
    2    HA   SER  20           HA       SER  20  14.119  -1.454  10.708
    3    HB2  SER  20           HB2      SER  20  14.551  -3.784  10.575
    4    HB3  SER  20           HB3      SER  20  16.004  -3.539   9.610
    5    HG   SER  20           HG       SER  20  17.072  -2.856  11.373

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LEU  21           H        LEU  21  16.961  -1.424   8.568
    2    HA   LEU  21           HA       LEU  21  18.659   0.028  10.312
    3    HB2  LEU  21           HB2      LEU  21  18.629  -0.234   7.297
    4    HB3  LEU  21           HB3      LEU  21  19.895   0.611   8.184
    5    HG   LEU  21           HG       LEU  21  19.126  -2.270   8.730
    6   HD11  LEU  21          HD11      LEU  21  21.087  -1.056   6.798
    7   HD13  LEU  21          HD12      LEU  21  19.972  -2.399   6.550
    8   HD12  LEU  21          HD13      LEU  21  21.421  -2.628   7.527
    9   HD23  LEU  21          HD21      LEU  21  21.607  -2.152   9.612
   10   HD22  LEU  21          HD22      LEU  21  20.324  -1.506  10.627
   11   HD21  LEU  21          HD23      LEU  21  21.322  -0.416   9.679

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ALA  22           H        ALA  22  16.407   1.044   7.763
    2    HA   ALA  22           HA       ALA  22  16.987   3.794   7.791
    3    HB3  ALA  22           HB1      ALA  22  15.564   2.581   6.108
    4    HB2  ALA  22           HB2      ALA  22  14.880   4.101   6.683
    5    HB1  ALA  22           HB3      ALA  22  14.268   2.568   7.304

  No H/Q in entry =           5
  In of MODEL   65
    1    H    TYR  23           H        TYR  23  14.465   2.006   9.619
    2    HA   TYR  23           HA       TYR  23  13.538   4.250  11.081
    3    HB2  TYR  23           HB2      TYR  23  12.270   2.156  11.052
    4    HB3  TYR  23           HB3      TYR  23  13.590   1.320  11.869
    5    HD1  TYR  23           HD1      TYR  23  11.136   4.106  12.255
    6    HD2  TYR  23           HD2      TYR  23  13.788   1.358  14.225
    7    HE1  TYR  23           HE1      TYR  23  10.223   4.800  14.456
    8    HE2  TYR  23           HE2      TYR  23  12.874   2.053  16.423
    9    HH   TYR  23           HH       TYR  23  10.104   4.219  16.661

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ALA  24           H        ALA  24  16.149   1.931  11.704
    2    HA   ALA  24           HA       ALA  24  16.837   2.903  14.272
    3    HB1  ALA  24           HB1      ALA  24  18.166   1.090  14.096
    4    HB3  ALA  24           HB2      ALA  24  19.206   2.001  13.000
    5    HB2  ALA  24           HB3      ALA  24  17.895   1.016  12.355

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ALA  25           H        ALA  25  17.805   3.834  10.996
    2    HA   ALA  25           HA       ALA  25  19.780   5.735  11.650
    3    HB1  ALA  25           HB1      ALA  25  19.047   4.810   9.330
    4    HB3  ALA  25           HB2      ALA  25  19.574   6.489   9.431
    5    HB2  ALA  25           HB3      ALA  25  17.854   6.109   9.362

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LEU  26           H        LEU  26  16.269   6.020  11.294
    2    HA   LEU  26           HA       LEU  26  16.089   8.803  11.759
    3    HB2  LEU  26           HB2      LEU  26  14.207   7.601  10.827
    4    HB3  LEU  26           HB3      LEU  26  14.102   6.568  12.247
    5    HG   LEU  26           HG       LEU  26  13.528   8.528  13.638
    6   HD12  LEU  26          HD11      LEU  26  12.899  10.645  12.325
    7   HD11  LEU  26          HD12      LEU  26  13.868   9.984  11.011
    8   HD13  LEU  26          HD13      LEU  26  14.621  10.349  12.564
    9   HD21  LEU  26          HD21      LEU  26  11.845   8.254  11.129
   10   HD23  LEU  26          HD22      LEU  26  11.298   8.953  12.650
   11   HD22  LEU  26          HD23      LEU  26  11.722   7.245  12.570

  No H/Q in entry =          11
  In of MODEL   65
    1    H    LYS  27           H        LYS  27  15.939   6.014  13.938
    2    HA   LYS  27           HA       LYS  27  15.371   7.377  16.314
    3    HB2  LYS  27           HB2      LYS  27  15.359   4.903  16.036
    4    HB3  LYS  27           HB3      LYS  27  17.122   4.927  15.991
    5    HG2  LYS  27           HG2      LYS  27  17.191   5.900  18.246
    6    HG3  LYS  27           HG3      LYS  27  15.425   5.947  18.293
    7    HD2  LYS  27           HD2      LYS  27  15.359   3.482  18.044
    8    HD3  LYS  27           HD3      LYS  27  17.123   3.443  18.030
    9    HE2  LYS  27           HE2      LYS  27  17.176   4.419  20.292
   10    HE3  LYS  27           HE3      LYS  27  15.411   4.488  20.309
   11    HZ3  LYS  27           HZ1      LYS  27  16.168   2.517  21.448
   12    HZ2  LYS  27           HZ2      LYS  27  17.075   2.030  20.094
   13    HZ1  LYS  27           HZ3      LYS  27  15.377   2.064  20.016

  No H/Q in entry =          13
  In of MODEL   65
    1    H    GLN  28           H        GLN  28  18.475   6.751  14.715
    2    HA   GLN  28           HA       GLN  28  20.180   7.796  16.709
    3    HB2  GLN  28           HB2      GLN  28  20.465   7.766  13.694
    4    HB3  GLN  28           HB3      GLN  28  21.761   8.201  14.808
    5    HG2  GLN  28           HG2      GLN  28  20.283   5.557  14.864
    6    HG3  GLN  28           HG3      GLN  28  21.845   5.805  14.087
    7   HE21  GLN  28          HE21      GLN  28  23.068   7.521  16.018
    8   HE22  GLN  28          HE22      GLN  28  23.276   6.646  17.456

  No H/Q in entry =           8
  In of MODEL   65
    1    H    ALA  29           H        ALA  29  18.450   9.323  14.027
    2    HA   ALA  29           HA       ALA  29  19.494  11.924  14.293
    3    HB2  ALA  29           HB1      ALA  29  17.805  12.598  12.827
    4    HB1  ALA  29           HB2      ALA  29  16.642  11.441  13.473
    5    HB3  ALA  29           HB3      ALA  29  17.962  10.881  12.445

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LYS  30           H        LYS  30  16.692  10.365  15.808
    2    HA   LYS  30           HA       LYS  30  15.719  12.629  17.179
    3    HB2  LYS  30           HB2      LYS  30  15.556   9.687  17.867
    4    HB3  LYS  30           HB3      LYS  30  14.714  10.948  18.768
    5    HG2  LYS  30           HG2      LYS  30  13.599  11.664  16.655
    6    HG3  LYS  30           HG3      LYS  30  14.379  10.319  15.820
    7    HD2  LYS  30           HD2      LYS  30  13.280   8.723  17.341
    8    HD3  LYS  30           HD3      LYS  30  12.510  10.057  18.200
    9    HE2  LYS  30           HE2      LYS  30  11.351  10.722  16.112
   10    HE3  LYS  30           HE3      LYS  30  12.100   9.359  15.273
   11    HZ2  LYS  30           HZ1      LYS  30   9.786   8.986  16.154
   12    HZ1  LYS  30           HZ2      LYS  30  10.456   9.019  17.721
   13    HZ3  LYS  30           HZ3      LYS  30  10.942   7.831  16.604

  No H/Q in entry =          13
  In of MODEL   65
    1    H    GLN  31           H        GLN  31  18.342  10.408  17.901
    2    HA   GLN  31           HA       GLN  31  18.690  11.402  20.600
    3    HB2  GLN  31           HB2      GLN  31  20.683   9.804  18.985
    4    HB3  GLN  31           HB3      GLN  31  20.553   9.921  20.740
    5    HG2  GLN  31           HG2      GLN  31  18.021   9.019  19.969
    6    HG3  GLN  31           HG3      GLN  31  19.106   8.160  18.883
    7   HE21  GLN  31          HE21      GLN  31  17.546   7.030  21.155
    8   HE22  GLN  31          HE22      GLN  31  18.691   6.343  22.201

  No H/Q in entry =           8
  In of MODEL   65
    1    H    GLY  32           H        GLY  32  19.230  12.726  17.640
    2    HA3  GLY  32           HA2      GLY  32  20.250  14.756  17.136
    3    HA2  GLY  32           HA3      GLY  32  21.009  14.738  18.723

  No H/Q in entry =           3
  In of MODEL   65
    1    H    ASP  33           H        ASP  33  21.377  11.848  16.930
    2    HA   ASP  33           HA       ASP  33  24.214  12.475  16.463
    3    HB2  ASP  33           HB2      ASP  33  22.658   9.886  16.568
    4    HB3  ASP  33           HB3      ASP  33  24.346   9.975  16.071

  No H/Q in entry =           4
  In of MODEL   65
    1    H    PHE  34           H        PHE  34  23.754  13.817  14.590
    2    HA   PHE  34           HA       PHE  34  22.385  12.869  12.299
    3    HB2  PHE  34           HB2      PHE  34  24.554  14.964  12.538
    4    HB3  PHE  34           HB3      PHE  34  23.562  14.699  11.106
    5    HD1  PHE  34           HD1      PHE  34  23.851  16.612  14.029
    6    HD2  PHE  34           HD2      PHE  34  20.933  14.561  11.636
    7    HE1  PHE  34           HE1      PHE  34  22.061  18.037  14.986
    8    HE2  PHE  34           HE2      PHE  34  19.147  15.986  12.596
    9    HZ   PHE  34           HZ       PHE  34  19.714  17.724  14.266

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ALA  35           H        ALA  35  25.756  12.616  13.302
    2    HA   ALA  35           HA       ALA  35  26.844  11.789  10.839
    3    HB3  ALA  35           HB1      ALA  35  28.506  10.580  12.550
    4    HB2  ALA  35           HB2      ALA  35  27.662  11.615  13.702
    5    HB1  ALA  35           HB3      ALA  35  28.509  12.331  12.332

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ALA  36           H        ALA  36  25.698   9.838  13.595
    2    HA   ALA  36           HA       ALA  36  26.137   7.349  12.306
    3    HB2  ALA  36           HB1      ALA  36  25.695   6.599  14.378
    4    HB3  ALA  36           HB2      ALA  36  24.016   7.124  14.232
    5    HB1  ALA  36           HB3      ALA  36  25.237   8.232  14.860

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ALA  37           H        ALA  37  23.352   9.523  12.454
    2    HA   ALA  37           HA       ALA  37  21.465   7.792  11.272
    3    HB3  ALA  37           HB1      ALA  37  21.741  10.749  11.579
    4    HB1  ALA  37           HB2      ALA  37  20.412   9.690  12.048
    5    HB2  ALA  37           HB3      ALA  37  20.607  10.168  10.361

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LYS  38           H        LYS  38  23.604  10.225   9.803
    2    HA   LYS  38           HA       LYS  38  22.954   9.822   7.124
    3    HB2  LYS  38           HB2      LYS  38  24.792  11.341   8.575
    4    HB3  LYS  38           HB3      LYS  38  25.807  10.340   7.543
    5    HG2  LYS  38           HG2      LYS  38  24.653  11.141   5.553
    6    HG3  LYS  38           HG3      LYS  38  23.474  12.010   6.540
    7    HD2  LYS  38           HD2      LYS  38  25.096  13.577   7.299
    8    HD3  LYS  38           HD3      LYS  38  26.439  12.572   6.756
    9    HE2  LYS  38           HE2      LYS  38  26.112  14.457   5.215
   10    HE3  LYS  38           HE3      LYS  38  25.750  12.929   4.403
   11    HZ3  LYS  38           HZ1      LYS  38  23.561  13.411   4.278
   12    HZ2  LYS  38           HZ2      LYS  38  24.110  15.017   4.373
   13    HZ1  LYS  38           HZ3      LYS  38  23.525  14.235   5.762

  No H/Q in entry =          13
  In of MODEL   65
    1    H    ALA  39           H        ALA  39  25.444   8.173   9.069
    2    HA   ALA  39           HA       ALA  39  26.484   6.578   6.989
    3    HB2  ALA  39           HB1      ALA  39  26.383   5.601   9.828
    4    HB1  ALA  39           HB2      ALA  39  27.358   7.013   9.418
    5    HB3  ALA  39           HB3      ALA  39  27.684   5.461   8.646

  No H/Q in entry =           5
  In of MODEL   65
    1    H    MET  40           H        MET  40  23.864   5.993   9.288
    2    HA   MET  40           HA       MET  40  23.377   3.299   8.539
    3    HB2  MET  40           HB2      MET  40  21.595   5.365   9.845
    4    HB3  MET  40           HB3      MET  40  21.161   3.663   9.661
    5    HG2  MET  40           HG2      MET  40  23.727   4.556  11.004
    6    HG3  MET  40           HG3      MET  40  22.229   4.300  11.898
    7    HE3  MET  40           HE1      MET  40  21.607   0.675  12.055
    8    HE2  MET  40           HE2      MET  40  20.759   1.996  11.255
    9    HE1  MET  40           HE3      MET  40  21.506   2.263  12.829

  No H/Q in entry =           9
  In of MODEL   65
    1    H    MET  41           H        MET  41  22.010   6.381   7.370
    2    HA   MET  41           HA       MET  41  20.032   5.226   5.695
    3    HB2  MET  41           HB2      MET  41  21.554   7.795   5.193
    4    HB3  MET  41           HB3      MET  41  20.017   7.330   4.474
    5    HG2  MET  41           HG2      MET  41  19.272   7.140   7.025
    6    HG3  MET  41           HG3      MET  41  20.599   8.275   7.252
    7    HE2  MET  41           HE1      MET  41  20.053   9.589   3.923
    8    HE1  MET  41           HE2      MET  41  21.018  10.006   5.335
    9    HE3  MET  41           HE3      MET  41  19.762  11.109   4.779

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ASP  42           H        ASP  42  23.418   6.099   5.142
    2    HA   ASP  42           HA       ASP  42  23.499   5.638   2.382
    3    HB2  ASP  42           HB2      ASP  42  25.268   6.598   4.154
    4    HB3  ASP  42           HB3      ASP  42  25.900   4.963   4.017

  No H/Q in entry =           4
  In of MODEL   65
    1    H    GLN  43           H        GLN  43  24.193   3.458   5.090
    2    HA   GLN  43           HA       GLN  43  24.820   1.198   3.494
    3    HB2  GLN  43           HB2      GLN  43  23.804   1.383   6.340
    4    HB3  GLN  43           HB3      GLN  43  24.358  -0.111   5.576
    5    HG2  GLN  43           HG2      GLN  43  26.540   1.068   5.069
    6    HG3  GLN  43           HG3      GLN  43  25.979   2.399   6.076
    7   HE21  GLN  43          HE21      GLN  43  28.198   1.385   7.104
    8   HE22  GLN  43          HE22      GLN  43  27.908   0.300   8.375

  No H/Q in entry =           8
  In of MODEL   65
    1    H    SER  44           H        SER  44  21.784   2.372   4.889
    2    HA   SER  44           HA       SER  44  20.179   0.158   4.207
    3    HB2  SER  44           HB2      SER  44  19.779   2.687   5.366
    4    HB3  SER  44           HB3      SER  44  18.742   2.668   3.943
    5    HG   SER  44           HG       SER  44  17.636   1.733   5.662

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ARG  45           H        ARG  45  20.966   3.120   2.417
    2    HA   ARG  45           HA       ARG  45  19.431   2.671   0.112
    3    HB2  ARG  45           HB2      ARG  45  20.609   4.785   0.706
    4    HB3  ARG  45           HB3      ARG  45  22.141   4.008   0.314
    5    HG2  ARG  45           HG2      ARG  45  21.348   3.628  -2.002
    6    HG3  ARG  45           HG3      ARG  45  19.828   4.427  -1.609
    7    HD2  ARG  45           HD2      ARG  45  21.113   6.501  -1.015
    8    HD3  ARG  45           HD3      ARG  45  22.596   5.707  -1.590
    9    HE   ARG  45           HE       ARG  45  20.659   5.510  -3.624
   10   HH21  ARG  45          HH11      ARG  45  20.671   6.889  -5.380
   11   HH22  ARG  45          HH12      ARG  45  21.453   8.426  -5.269
   12   HH11  ARG  45          HH21      ARG  45  22.431   7.972  -1.987
   13   HH12  ARG  45          HH22      ARG  45  22.449   9.039  -3.344

  No H/Q in entry =          13
  In of MODEL   65
    1    H    MET  46           H        MET  46  22.781   1.738   0.849
    2    HA   MET  46           HA       MET  46  23.364   0.549  -1.642
    3    HB2  MET  46           HB2      MET  46  24.469   0.176   1.143
    4    HB3  MET  46           HB3      MET  46  25.114  -0.700  -0.248
    5    HG2  MET  46           HG2      MET  46  25.568   1.428  -1.398
    6    HG3  MET  46           HG3      MET  46  24.890   2.319  -0.043
    7    HE1  MET  46           HE1      MET  46  26.810   3.767   0.415
    8    HE3  MET  46           HE2      MET  46  27.711   3.145  -0.965
    9    HE2  MET  46           HE3      MET  46  28.499   3.277   0.606

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ALA  47           H        ALA  47  21.964  -0.777   1.329
    2    HA   ALA  47           HA       ALA  47  21.864  -3.485   0.512
    3    HB2  ALA  47           HB1      ALA  47  21.497  -3.030   2.820
    4    HB3  ALA  47           HB2      ALA  47  19.950  -3.604   2.201
    5    HB1  ALA  47           HB3      ALA  47  20.209  -1.878   2.468

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LEU  48           H        LEU  48  19.555  -0.817   0.174
    2    HA   LEU  48           HA       LEU  48  17.482  -2.309  -1.081
    3    HB2  LEU  48           HB2      LEU  48  18.186   0.634  -1.182
    4    HB3  LEU  48           HB3      LEU  48  16.702  -0.048  -1.849
    5    HG   LEU  48           HG       LEU  48  17.556  -0.379   1.036
    6   HD13  LEU  48          HD11      LEU  48  17.177   1.930   0.862
    7   HD12  LEU  48          HD12      LEU  48  15.609   1.306   1.372
    8   HD11  LEU  48          HD13      LEU  48  15.884   1.732  -0.318
    9   HD22  LEU  48          HD21      LEU  48  15.998  -2.065   0.650
   10   HD21  LEU  48          HD22      LEU  48  15.137  -1.141  -0.581
   11   HD23  LEU  48          HD23      LEU  48  14.935  -0.742   1.124

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ASN  49           H        ASN  49  20.200  -0.421  -2.308
    2    HA   ASN  49           HA       ASN  49  19.542  -0.480  -5.030
    3    HB2  ASN  49           HB2      ASN  49  21.253   0.997  -4.084
    4    HB3  ASN  49           HB3      ASN  49  22.264  -0.389  -3.697
    5   HD21  ASN  49          HD21      ASN  49  23.983   0.364  -5.099
    6   HD22  ASN  49          HD22      ASN  49  23.837   0.315  -6.788

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLU  50           H        GLU  50  21.492  -2.718  -3.084
    2    HA   GLU  50           HA       GLU  50  22.158  -4.475  -5.220
    3    HB2  GLU  50           HB2      GLU  50  23.362  -4.481  -3.057
    4    HB3  GLU  50           HB3      GLU  50  21.910  -5.088  -2.260
    5    HG2  GLU  50           HG2      GLU  50  21.961  -7.115  -3.629
    6    HG3  GLU  50           HG3      GLU  50  23.346  -6.502  -4.530

  No H/Q in entry =           6
  In of MODEL   65
    1    H    ALA  51           H        ALA  51  19.509  -4.375  -2.887
    2    HA   ALA  51           HA       ALA  51  18.299  -6.823  -3.653
    3    HB3  ALA  51           HB1      ALA  51  16.719  -6.298  -2.091
    4    HB1  ALA  51           HB2      ALA  51  16.533  -4.645  -2.681
    5    HB2  ALA  51           HB3      ALA  51  17.888  -5.060  -1.631

  No H/Q in entry =           5
  In of MODEL   65
    1    H    HIS  52           H        HIS  52  17.768  -3.461  -4.670
    2    HA   HIS  52           HA       HIS  52  15.642  -3.942  -6.467
    3    HB2  HIS  52           HB2      HIS  52  16.338  -1.693  -5.654
    4    HB3  HIS  52           HB3      HIS  52  17.781  -1.809  -6.660
    5    HD1  HIS  52           HD1      HIS  52  17.420  -1.829  -9.273
    6    HD2  HIS  52           HD2      HIS  52  13.967  -1.089  -7.056
    7    HE1  HIS  52           HE1      HIS  52  15.698  -0.937 -10.903
    8    HE2  HIS  52           HE2      HIS  52  13.589  -0.480  -9.566

  No H/Q in entry =           8
  In of MODEL   65
    1    H    LEU  53           H        LEU  53  19.158  -4.007  -6.909
    2    HA   LEU  53           HA       LEU  53  19.203  -4.310  -9.711
    3    HB2  LEU  53           HB2      LEU  53  21.128  -5.112  -7.544
    4    HB3  LEU  53           HB3      LEU  53  21.433  -5.501  -9.235
    5    HG   LEU  53           HG       LEU  53  20.805  -2.681  -8.311
    6   HD13  LEU  53          HD11      LEU  53  22.817  -3.314  -7.142
    7   HD12  LEU  53          HD12      LEU  53  23.302  -2.333  -8.525
    8   HD11  LEU  53          HD13      LEU  53  23.474  -4.084  -8.583
    9   HD23  LEU  53          HD21      LEU  53  22.244  -2.257 -10.456
   10   HD22  LEU  53          HD22      LEU  53  20.566  -2.755 -10.653
   11   HD21  LEU  53          HD23      LEU  53  21.857  -3.925 -10.861

  No H/Q in entry =          11
  In of MODEL   65
    1    H    VAL  54           H        VAL  54  19.056  -6.707  -7.096
    2    HA   VAL  54           HA       VAL  54  19.136  -8.995  -8.766
    3    HB   VAL  54           HB       VAL  54  17.996  -8.565  -5.994
    4   HG12  VAL  54          HG11      VAL  54  18.277 -11.188  -6.002
    5   HG11  VAL  54          HG12      VAL  54  18.090 -11.008  -7.746
    6   HG13  VAL  54          HG13      VAL  54  16.813 -10.461  -6.662
    7   HG22  VAL  54          HG21      VAL  54  20.316  -8.394  -5.776
    8   HG21  VAL  54          HG22      VAL  54  20.631  -9.485  -7.123
    9   HG23  VAL  54          HG23      VAL  54  20.095 -10.131  -5.572

  No H/Q in entry =           9
  In of MODEL   65
    1    H    GLN  55           H        GLN  55  16.444  -7.053  -7.467
    2    HA   GLN  55           HA       GLN  55  14.392  -8.678  -8.543
    3    HB2  GLN  55           HB2      GLN  55  13.674  -7.148  -6.908
    4    HB3  GLN  55           HB3      GLN  55  14.487  -5.789  -7.680
    5    HG2  GLN  55           HG2      GLN  55  12.765  -5.430  -9.164
    6    HG3  GLN  55           HG3      GLN  55  12.414  -7.144  -9.340
    7   HE21  GLN  55          HE21      GLN  55  10.400  -7.663  -8.532
    8   HE22  GLN  55          HE22      GLN  55   9.643  -6.902  -7.218

  No H/Q in entry =           8
  In of MODEL   65
    1    H    THR  56           H        THR  56  16.174  -5.901  -9.895
    2    HA   THR  56           HA       THR  56  14.736  -5.505 -12.238
    3    HB   THR  56           HB       THR  56  17.757  -5.468 -12.088
    4    HG1  THR  56           HG1      THR  56  15.809  -3.876 -10.922
    5   HG21  THR  56          HG21      THR  56  16.354  -5.125 -14.279
    6   HG23  THR  56          HG22      THR  56  17.669  -4.011 -13.907
    7   HG22  THR  56          HG23      THR  56  16.000  -3.545 -13.578

  No H/Q in entry =           7
  In of MODEL   65
    1    H    LYS  57           H        LYS  57  17.349  -7.848 -11.644
    2    HA   LYS  57           HA       LYS  57  17.324  -9.031 -14.227
    3    HB2  LYS  57           HB2      LYS  57  19.116  -9.321 -12.490
    4    HB3  LYS  57           HB3      LYS  57  17.998 -10.300 -11.551
    5    HG2  LYS  57           HG2      LYS  57  17.865 -11.943 -13.354
    6    HG3  LYS  57           HG3      LYS  57  18.903 -10.953 -14.371
    7    HD2  LYS  57           HD2      LYS  57  20.742 -11.198 -12.736
    8    HD3  LYS  57           HD3      LYS  57  19.707 -12.206 -11.724
    9    HE2  LYS  57           HE2      LYS  57  20.956 -13.782 -12.970
   10    HE3  LYS  57           HE3      LYS  57  19.435 -13.691 -13.856
   11    HZ2  LYS  57           HZ1      LYS  57  21.688 -13.478 -15.095
   12    HZ1  LYS  57           HZ2      LYS  57  21.614 -11.864 -14.572
   13    HZ3  LYS  57           HZ3      LYS  57  20.376 -12.502 -15.543

  No H/Q in entry =          13
  In of MODEL   65
    1    H    LEU  58           H        LEU  58  15.541  -9.683 -11.250
    2    HA   LEU  58           HA       LEU  58  14.279 -12.033 -12.191
    3    HB2  LEU  58           HB2      LEU  58  13.521 -10.124  -9.985
    4    HB3  LEU  58           HB3      LEU  58  12.689 -11.648 -10.305
    5    HG   LEU  58           HG       LEU  58  15.667 -11.419  -9.758
    6   HD11  LEU  58          HD11      LEU  58  13.295 -11.806  -7.960
    7   HD13  LEU  58          HD12      LEU  58  14.764 -10.867  -7.698
    8   HD12  LEU  58          HD13      LEU  58  14.809 -12.625  -7.570
    9   HD22  LEU  58          HD21      LEU  58  15.514 -13.474 -10.794
   10   HD21  LEU  58          HD22      LEU  58  13.798 -13.658 -10.429
   11   HD23  LEU  58          HD23      LEU  58  15.005 -13.983  -9.185

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  59           H        ILE  59  13.659  -8.682 -12.857
    2    HA   ILE  59           HA       ILE  59  10.931  -9.284 -13.792
    3    HB   ILE  59           HB       ILE  59  11.772  -7.021 -12.578
    4   HG12  ILE  59          HG12      ILE  59   9.872  -6.845 -14.928
    5   HG13  ILE  59          HG13      ILE  59   9.437  -7.630 -13.432
    6   HG21  ILE  59          HG21      ILE  59  13.327  -6.629 -14.622
    7   HG23  ILE  59          HG22      ILE  59  12.353  -5.281 -14.077
    8   HG22  ILE  59          HG23      ILE  59  11.866  -6.217 -15.488
    9   HD12  ILE  59          HD11      ILE  59  10.311  -4.759 -13.734
   10   HD11  ILE  59          HD12      ILE  59   9.979  -5.542 -12.190
   11   HD13  ILE  59          HD13      ILE  59   8.679  -5.314 -13.360

  No H/Q in entry =          11
  In of MODEL   65
    1    H    GLU  60           H        GLU  60  14.144  -8.478 -15.056
    2    HA   GLU  60           HA       GLU  60  13.363  -8.054 -17.761
    3    HB2  GLU  60           HB2      GLU  60  15.515  -7.307 -17.375
    4    HB3  GLU  60           HB3      GLU  60  15.918  -8.674 -16.339
    5    HG2  GLU  60           HG2      GLU  60  17.068  -8.695 -18.595
    6    HG3  GLU  60           HG3      GLU  60  16.134 -10.146 -18.238

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLY  61           H        GLY  61  14.300 -10.958 -15.960
    2    HA3  GLY  61           HA2      GLY  61  13.726 -12.587 -18.367
    3    HA2  GLY  61           HA3      GLY  61  14.754 -13.090 -17.030

  No H/Q in entry =           3
  In of MODEL   65
    1    H    ASP  62           H        ASP  62  11.662 -11.496 -16.640
    2    HA   ASP  62           HA       ASP  62  10.699 -13.476 -14.850
    3    HB2  ASP  62           HB2      ASP  62  10.080 -11.066 -14.793
    4    HB3  ASP  62           HB3      ASP  62   9.144 -11.307 -16.264

  No H/Q in entry =           4
  In of MODEL   65
    1    H    ALA  63           H        ALA  63  11.350 -14.765 -17.341
    2    HA   ALA  63           HA       ALA  63   9.050 -15.264 -18.955
    3    HB3  ALA  63           HB1      ALA  63  11.346 -17.169 -18.456
    4    HB2  ALA  63           HB2      ALA  63  11.456 -15.790 -19.547
    5    HB1  ALA  63           HB3      ALA  63  10.308 -17.086 -19.880

  No H/Q in entry =           5
  In of MODEL   65
    1    H    GLY  64           H        GLY  64  10.406 -16.835 -16.102
    2    HA3  GLY  64           HA2      GLY  64   9.564 -18.372 -14.626
    3    HA2  GLY  64           HA3      GLY  64   7.978 -17.748 -15.059

  No H/Q in entry =           3
  In of MODEL   65
    1    H    GLU  65           H        GLU  65   6.709 -19.485 -15.440
    2    HA   GLU  65           HA       GLU  65   7.746 -21.941 -16.455
    3    HB2  GLU  65           HB2      GLU  65   4.920 -20.978 -16.037
    4    HB3  GLU  65           HB3      GLU  65   5.333 -22.610 -16.562
    5    HG2  GLU  65           HG2      GLU  65   6.650 -22.968 -14.539
    6    HG3  GLU  65           HG3      GLU  65   6.356 -21.309 -14.021

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLY  66           H        GLY  66   7.209 -23.029 -18.317
    2    HA3  GLY  66           HA2      GLY  66   7.780 -22.165 -20.728
    3    HA2  GLY  66           HA3      GLY  66   6.495 -23.334 -20.505

  No H/Q in entry =           3
  In of MODEL   65
    1    H    LYS  67           H        LYS  67   4.558 -21.698 -19.366
    2    HA   LYS  67           HA       LYS  67   3.523 -20.435 -21.719
    3    HB2  LYS  67           HB2      LYS  67   2.416 -20.821 -18.943
    4    HB3  LYS  67           HB3      LYS  67   1.513 -20.067 -20.262
    5    HG2  LYS  67           HG2      LYS  67   1.835 -22.074 -21.651
    6    HG3  LYS  67           HG3      LYS  67   2.762 -22.830 -20.357
    7    HD2  LYS  67           HD2      LYS  67   0.785 -22.755 -18.887
    8    HD3  LYS  67           HD3      LYS  67  -0.146 -21.995 -20.180
    9    HE2  LYS  67           HE2      LYS  67   0.215 -23.960 -21.616
   10    HE3  LYS  67           HE3      LYS  67   1.174 -24.721 -20.348
   11    HZ3  LYS  67           HZ1      LYS  67  -0.669 -25.007 -19.006
   12    HZ2  LYS  67           HZ2      LYS  67  -1.293 -25.324 -20.552
   13    HZ1  LYS  67           HZ3      LYS  67  -1.581 -23.823 -19.809

  No H/Q in entry =          13
  In of MODEL   65
    1    H    MET  68           H        MET  68   2.671 -18.381 -21.918
    2    HA   MET  68           HA       MET  68   4.311 -16.249 -21.535
    3    HB2  MET  68           HB2      MET  68   1.307 -16.320 -21.769
    4    HB3  MET  68           HB3      MET  68   2.253 -14.834 -21.861
    5    HG2  MET  68           HG2      MET  68   3.521 -15.732 -23.759
    6    HG3  MET  68           HG3      MET  68   2.631 -17.251 -23.653
    7    HE1  MET  68           HE1      MET  68   2.729 -13.632 -24.137
    8    HE3  MET  68           HE2      MET  68   1.168 -13.398 -23.356
    9    HE2  MET  68           HE3      MET  68   1.319 -13.160 -25.096

  No H/Q in entry =           9
  In of MODEL   65
    1    H    LYS  69           H        LYS  69   2.747 -17.757 -18.953
    2    HA   LYS  69           HA       LYS  69   2.035 -15.523 -17.371
    3    HB2  LYS  69           HB2      LYS  69   1.134 -17.777 -17.008
    4    HB3  LYS  69           HB3      LYS  69   2.722 -18.319 -16.458
    5    HG2  LYS  69           HG2      LYS  69   2.684 -16.682 -14.636
    6    HG3  LYS  69           HG3      LYS  69   1.130 -16.068 -15.200
    7    HD2  LYS  69           HD2      LYS  69   0.112 -18.283 -14.796
    8    HD3  LYS  69           HD3      LYS  69   1.665 -18.884 -14.211
    9    HE2  LYS  69           HE2      LYS  69   0.270 -18.224 -12.308
   10    HE3  LYS  69           HE3      LYS  69   1.650 -17.136 -12.444
   11    HZ1  LYS  69           HZ1      LYS  69  -0.250 -15.994 -14.022
   12    HZ3  LYS  69           HZ2      LYS  69   0.161 -15.509 -12.447
   13    HZ2  LYS  69           HZ3      LYS  69  -1.142 -16.569 -12.700

  No H/Q in entry =          13
  In of MODEL   65
    1    H    VAL  70           H        VAL  70   2.970 -14.489 -15.601
    2    HA   VAL  70           HA       VAL  70   5.919 -14.553 -15.532
    3    HB   VAL  70           HB       VAL  70   5.568 -12.408 -14.206
    4   HG11  VAL  70          HG11      VAL  70   4.614 -12.726 -17.058
    5   HG13  VAL  70          HG12      VAL  70   6.205 -12.211 -16.497
    6   HG12  VAL  70          HG13      VAL  70   4.815 -11.144 -16.307
    7   HG22  VAL  70          HG21      VAL  70   3.408 -11.413 -14.097
    8   HG21  VAL  70          HG22      VAL  70   3.123 -13.102 -13.684
    9   HG23  VAL  70          HG23      VAL  70   2.746 -12.516 -15.304

  No H/Q in entry =           9
  In of MODEL   65
    1    H    SER  71           H        SER  71   7.010 -14.509 -13.486
    2    HA   SER  71           HA       SER  71   6.153 -16.445 -11.614
    3    HB2  SER  71           HB2      SER  71   8.535 -15.705 -12.018
    4    HB3  SER  71           HB3      SER  71   8.161 -14.236 -11.121
    5    HG   SER  71           HG       SER  71   8.436 -16.866 -10.254

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LEU  72           H        LEU  72   4.719 -16.290 -10.023
    2    HA   LEU  72           HA       LEU  72   3.207 -13.955  -9.564
    3    HB2  LEU  72           HB2      LEU  72   3.458 -16.519  -7.999
    4    HB3  LEU  72           HB3      LEU  72   2.303 -15.248  -7.605
    5    HG   LEU  72           HG       LEU  72   2.455 -16.536 -10.348
    6   HD13  LEU  72          HD11      LEU  72   0.561 -17.919  -9.667
    7   HD12  LEU  72          HD12      LEU  72   0.572 -17.191  -8.062
    8   HD11  LEU  72          HD13      LEU  72   1.917 -18.209  -8.577
    9   HD23  LEU  72          HD21      LEU  72  -0.022 -15.707 -10.256
   10   HD22  LEU  72          HD22      LEU  72   1.230 -14.512 -10.555
   11   HD21  LEU  72          HD23      LEU  72   0.533 -14.672  -8.945

  No H/Q in entry =          11
  In of MODEL   65
    1    H    VAL  73           H        VAL  73   5.844 -15.442  -7.804
    2    HA   VAL  73           HA       VAL  73   5.812 -13.919  -5.464
    3    HB   VAL  73           HB       VAL  73   7.943 -14.800  -5.019
    4   HG12  VAL  73          HG11      VAL  73   6.765 -16.775  -6.986
    5   HG11  VAL  73          HG12      VAL  73   6.063 -16.472  -5.396
    6   HG13  VAL  73          HG13      VAL  73   7.696 -17.126  -5.530
    7   HG23  VAL  73          HG21      VAL  73   9.320 -15.788  -6.934
    8   HG22  VAL  73          HG22      VAL  73   9.214 -14.030  -6.891
    9   HG21  VAL  73          HG23      VAL  73   8.225 -14.944  -8.028

  No H/Q in entry =           9
  In of MODEL   65
    1    H    LEU  74           H        LEU  74   6.810 -13.026  -8.638
    2    HA   LEU  74           HA       LEU  74   8.787 -11.111  -8.139
    3    HB2  LEU  74           HB2      LEU  74   8.311 -11.845 -10.380
    4    HB3  LEU  74           HB3      LEU  74   6.658 -11.244 -10.274
    5    HG   LEU  74           HG       LEU  74   7.559  -8.930  -9.992
    6   HD12  LEU  74          HD11      LEU  74  10.019  -8.715 -10.739
    7   HD11  LEU  74          HD12      LEU  74  10.163 -10.425 -10.337
    8   HD13  LEU  74          HD13      LEU  74   9.733  -9.258  -9.086
    9   HD23  LEU  74          HD21      LEU  74   8.786 -10.102 -12.450
   10   HD22  LEU  74          HD22      LEU  74   7.830  -8.651 -12.252
   11   HD21  LEU  74          HD23      LEU  74   7.043 -10.213 -12.216

  No H/Q in entry =          11
  In of MODEL   65
    1    H    VAL  75           H        VAL  75   5.297 -10.669  -8.485
    2    HA   VAL  75           HA       VAL  75   5.246  -7.914  -7.885
    3    HB   VAL  75           HB       VAL  75   3.120 -10.022  -7.496
    4   HG12  VAL  75          HG11      VAL  75   1.576  -8.030  -7.412
    5   HG11  VAL  75          HG12      VAL  75   2.991  -6.989  -7.355
    6   HG13  VAL  75          HG13      VAL  75   2.670  -8.101  -6.034
    7   HG22  VAL  75          HG21      VAL  75   2.247  -9.076  -9.592
    8   HG21  VAL  75          HG22      VAL  75   3.903  -9.629  -9.826
    9   HG23  VAL  75          HG23      VAL  75   3.567  -7.908  -9.635

  No H/Q in entry =           9
  In of MODEL   65
    1    H    GLU  76           H        GLU  76   4.949 -10.797  -5.789
    2    HA   GLU  76           HA       GLU  76   4.504  -9.440  -3.360
    3    HB2  GLU  76           HB2      GLU  76   4.284 -11.899  -3.594
    4    HB3  GLU  76           HB3      GLU  76   6.015 -12.031  -3.857
    5    HG2  GLU  76           HG2      GLU  76   5.603 -12.614  -1.558
    6    HG3  GLU  76           HG3      GLU  76   6.364 -11.034  -1.546

  No H/Q in entry =           6
  In of MODEL   65
    1    H    ALA  77           H        ALA  77   7.547 -10.389  -4.931
    2    HA   ALA  77           HA       ALA  77   9.255  -9.382  -2.913
    3    HB3  ALA  77           HB1      ALA  77   9.918  -9.507  -5.857
    4    HB1  ALA  77           HB2      ALA  77   9.883 -10.935  -4.823
    5    HB2  ALA  77           HB3      ALA  77  11.026  -9.634  -4.490

  No H/Q in entry =           5
  In of MODEL   65
    1    H    GLN  78           H        GLN  78   7.883  -7.929  -5.818
    2    HA   GLN  78           HA       GLN  78   9.276  -5.472  -5.703
    3    HB2  GLN  78           HB2      GLN  78   7.961  -6.358  -7.663
    4    HB3  GLN  78           HB3      GLN  78   6.487  -5.956  -6.785
    5    HG2  GLN  78           HG2      GLN  78   7.179  -3.598  -6.686
    6    HG3  GLN  78           HG3      GLN  78   8.663  -3.990  -7.553
    7   HE21  GLN  78          HE21      GLN  78   6.807  -2.131  -8.662
    8   HE22  GLN  78          HE22      GLN  78   6.097  -2.829 -10.038

  No H/Q in entry =           8
  In of MODEL   65
    1    H    LEU  79           H        LEU  79   6.240  -6.567  -4.276
    2    HA   LEU  79           HA       LEU  79   5.286  -4.149  -3.254
    3    HB2  LEU  79           HB2      LEU  79   3.938  -6.178  -3.208
    4    HB3  LEU  79           HB3      LEU  79   5.071  -6.942  -2.097
    5    HG   LEU  79           HG       LEU  79   4.547  -5.299  -0.362
    6   HD13  LEU  79          HD11      LEU  79   4.115  -3.272  -1.402
    7   HD12  LEU  79          HD12      LEU  79   2.481  -3.773  -0.964
    8   HD11  LEU  79          HD13      LEU  79   3.057  -3.997  -2.614
    9   HD23  LEU  79          HD21      LEU  79   1.953  -5.749  -0.272
   10   HD22  LEU  79          HD22      LEU  79   3.070  -7.107  -0.171
   11   HD21  LEU  79          HD23      LEU  79   2.261  -6.749  -1.693

  No H/Q in entry =          11
  In of MODEL   65
    1    H    HIS  80           H        HIS  80   7.430  -6.528  -1.684
    2    HA   HIS  80           HA       HIS  80   7.745  -5.002   0.692
    3    HB2  HIS  80           HB2      HIS  80   9.043  -7.382  -0.519
    4    HB3  HIS  80           HB3      HIS  80   9.969  -6.507   0.702
    5    HD1  HIS  80           HD1      HIS  80   9.469  -7.146   3.042
    6    HD2  HIS  80           HD2      HIS  80   6.237  -7.929   0.527
    7    HE1  HIS  80           HE1      HIS  80   7.679  -8.226   4.486
    8    HE2  HIS  80           HE2      HIS  80   5.703  -8.707   2.961

  No H/Q in entry =           8
  In of MODEL   65
    1    H    LEU  81           H        LEU  81   9.745  -5.298  -2.222
    2    HA   LEU  81           HA       LEU  81  11.819  -3.596  -1.336
    3    HB2  LEU  81           HB2      LEU  81  10.884  -4.360  -4.103
    4    HB3  LEU  81           HB3      LEU  81  12.321  -3.379  -3.808
    5    HG   LEU  81           HG       LEU  81  11.882  -6.100  -2.547
    6   HD12  LEU  81          HD11      LEU  81  13.686  -6.749  -4.300
    7   HD11  LEU  81          HD12      LEU  81  13.145  -5.311  -5.165
    8   HD13  LEU  81          HD13      LEU  81  12.011  -6.618  -4.833
    9   HD23  LEU  81          HD21      LEU  81  14.515  -5.830  -2.532
   10   HD22  LEU  81          HD22      LEU  81  13.546  -5.059  -1.278
   11   HD21  LEU  81          HD23      LEU  81  14.141  -4.110  -2.640

  No H/Q in entry =          11
  In of MODEL   65
    1    H    MET  82           H        MET  82   8.907  -2.900  -3.269
    2    HA   MET  82           HA       MET  82   9.495  -0.182  -3.757
    3    HB2  MET  82           HB2      MET  82   6.908  -1.731  -3.639
    4    HB3  MET  82           HB3      MET  82   6.938  -0.005  -3.995
    5    HG2  MET  82           HG2      MET  82   8.501  -2.099  -5.541
    6    HG3  MET  82           HG3      MET  82   6.945  -1.446  -6.050
    7    HE3  MET  82           HE1      MET  82   7.455   2.006  -7.205
    8    HE2  MET  82           HE2      MET  82   7.076   1.778  -5.500
    9    HE1  MET  82           HE3      MET  82   6.391   0.686  -6.699

  No H/Q in entry =           9
  In of MODEL   65
    1    H    THR  83           H        THR  83   7.675  -1.760  -1.159
    2    HA   THR  83           HA       THR  83   6.866   0.596   0.178
    3    HB   THR  83           HB       THR  83   6.703  -0.985   2.189
    4    HG1  THR  83           HG1      THR  83   7.426  -2.947   1.950
    5   HG22  THR  83          HG21      THR  83   5.023  -2.514   0.713
    6   HG21  THR  83          HG22      THR  83   5.273  -1.184  -0.412
    7   HG23  THR  83          HG23      THR  83   4.638  -0.866   1.202

  No H/Q in entry =           7
  In of MODEL   65
    1    H    SER  84           H        SER  84   9.651  -1.554   0.689
    2    HA   SER  84           HA       SER  84  10.736  -0.154   2.884
    3    HB2  SER  84           HB2      SER  84  11.956  -2.009   0.850
    4    HB3  SER  84           HB3      SER  84  12.916  -1.279   2.135
    5    HG   SER  84           HG       SER  84  10.611  -2.928   2.387

  No H/Q in entry =           5
  In of MODEL   65
    1    H    MET  85           H        MET  85  11.494   0.110  -0.603
    2    HA   MET  85           HA       MET  85  13.528   2.038  -0.342
    3    HB2  MET  85           HB2      MET  85  13.103   0.771  -2.414
    4    HB3  MET  85           HB3      MET  85  11.598   1.661  -2.640
    5    HG2  MET  85           HG2      MET  85  12.847   3.778  -2.754
    6    HG3  MET  85           HG3      MET  85  14.356   2.910  -2.488
    7    HE2  MET  85           HE1      MET  85  11.659   3.057  -6.131
    8    HE1  MET  85           HE2      MET  85  11.285   3.412  -4.447
    9    HE3  MET  85           HE3      MET  85  11.249   1.747  -5.013

  No H/Q in entry =           9
  In of MODEL   65
    1    H    LEU  86           H        LEU  86  10.045   2.439  -0.849
    2    HA   LEU  86           HA       LEU  86  10.033   5.253  -1.018
    3    HB2  LEU  86           HB2      LEU  86   8.158   3.631  -1.602
    4    HB3  LEU  86           HB3      LEU  86   7.827   3.539   0.128
    5    HG   LEU  86           HG       LEU  86   7.713   6.102   0.088
    6   HD11  LEU  86          HD11      LEU  86   8.481   5.665  -2.616
    7   HD13  LEU  86          HD12      LEU  86   8.073   7.197  -1.848
    8   HD12  LEU  86          HD13      LEU  86   6.820   6.261  -2.658
    9   HD23  LEU  86          HD21      LEU  86   5.555   4.797  -1.581
   10   HD22  LEU  86          HD22      LEU  86   5.388   6.055  -0.359
   11   HD21  LEU  86          HD23      LEU  86   5.757   4.401   0.126

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ALA  87           H        ALA  87   9.526   3.071   1.718
    2    HA   ALA  87           HA       ALA  87   9.014   4.985   3.696
    3    HB1  ALA  87           HB1      ALA  87   9.768   2.151   3.597
    4    HB3  ALA  87           HB2      ALA  87   8.659   2.978   4.686
    5    HB2  ALA  87           HB3      ALA  87  10.387   2.976   5.030

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ARG  88           H        ARG  88  12.070   3.508   2.709
    2    HA   ARG  88           HA       ARG  88  13.705   4.847   4.547
    3    HB2  ARG  88           HB2      ARG  88  14.336   2.868   3.134
    4    HB3  ARG  88           HB3      ARG  88  14.509   3.964   1.766
    5    HG2  ARG  88           HG2      ARG  88  16.007   5.241   3.719
    6    HG3  ARG  88           HG3      ARG  88  16.296   3.544   4.089
    7    HD2  ARG  88           HD2      ARG  88  17.557   3.233   2.241
    8    HD3  ARG  88           HD3      ARG  88  16.436   4.130   1.212
    9    HE   ARG  88           HE       ARG  88  18.850   5.144   2.264
   10   HH21  ARG  88          HH11      ARG  88  19.237   7.357   2.080
   11   HH22  ARG  88          HH12      ARG  88  17.907   8.454   1.943
   12   HH11  ARG  88          HH21      ARG  88  15.526   5.961   1.991
   13   HH12  ARG  88          HH22      ARG  88  15.804   7.661   1.867

  No H/Q in entry =          13
  In of MODEL   65
    1    H    GLU  89           H        GLU  89  12.748   5.779   1.229
    2    HA   GLU  89           HA       GLU  89  14.339   8.110   1.083
    3    HB2  GLU  89           HB2      GLU  89  13.175   7.100  -0.869
    4    HB3  GLU  89           HB3      GLU  89  11.641   7.667  -0.208
    5    HG2  GLU  89           HG2      GLU  89  12.386   9.992  -0.360
    6    HG3  GLU  89           HG3      GLU  89  13.981   9.474  -0.900

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LEU  90           H        LEU  90  11.001   7.658   2.211
    2    HA   LEU  90           HA       LEU  90  10.537  10.397   2.800
    3    HB2  LEU  90           HB2      LEU  90   9.295   7.842   3.815
    4    HB3  LEU  90           HB3      LEU  90   8.694   9.446   4.246
    5    HG   LEU  90           HG       LEU  90   9.095   8.573   1.373
    6   HD12  LEU  90          HD11      LEU  90   6.556   8.291   1.435
    7   HD11  LEU  90          HD12      LEU  90   6.711   8.269   3.191
    8   HD13  LEU  90          HD13      LEU  90   7.506   7.029   2.220
    9   HD22  LEU  90          HD21      LEU  90   8.844  10.886   1.311
   10   HD21  LEU  90          HD22      LEU  90   7.859  10.930   2.771
   11   HD23  LEU  90          HD23      LEU  90   7.151  10.395   1.247

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  91           H        ILE  91  11.750   7.683   4.709
    2    HA   ILE  91           HA       ILE  91  11.917   9.033   7.184
    3    HB   ILE  91           HB       ILE  91  13.427   6.672   6.048
    4   HG12  ILE  91          HG12      ILE  91  11.415   6.866   8.309
    5   HG13  ILE  91          HG13      ILE  91  10.939   6.602   6.632
    6   HG22  ILE  91          HG21      ILE  91  13.894   6.437   8.687
    7   HG21  ILE  91          HG22      ILE  91  13.851   8.197   8.595
    8   HG23  ILE  91          HG23      ILE  91  15.012   7.292   7.625
    9   HD13  ILE  91          HD11      ILE  91  11.902   4.482   6.551
   10   HD12  ILE  91          HD12      ILE  91  11.310   4.543   8.212
   11   HD11  ILE  91          HD13      ILE  91  13.017   4.826   7.874

  No H/Q in entry =          11
  In of MODEL   65
    1    H    THR  92           H        THR  92  14.130   8.836   4.430
    2    HA   THR  92           HA       THR  92  16.321  10.183   5.595
    3    HB   THR  92           HB       THR  92  15.332  10.091   2.734
    4    HG1  THR  92           HG1      THR  92  16.128   8.176   3.129
    5   HG22  THR  92          HG21      THR  92  17.914  10.734   2.443
    6   HG21  THR  92          HG22      THR  92  17.622  11.553   3.976
    7   HG23  THR  92          HG23      THR  92  16.658  11.966   2.558

  No H/Q in entry =           7
  In of MODEL   65
    1    H    GLU  93           H        GLU  93  13.455  11.399   3.873
    2    HA   GLU  93           HA       GLU  93  14.101  14.147   4.001
    3    HB2  GLU  93           HB2      GLU  93  11.372  12.825   4.009
    4    HB3  GLU  93           HB3      GLU  93  11.691  14.521   3.646
    5    HG2  GLU  93           HG2      GLU  93  12.986  12.262   2.106
    6    HG3  GLU  93           HG3      GLU  93  11.453  12.975   1.624

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LEU  94           H        LEU  94  12.320  12.013   6.202
    2    HA   LEU  94           HA       LEU  94  11.548  13.965   8.088
    3    HB2  LEU  94           HB2      LEU  94  12.069  10.998   8.348
    4    HB3  LEU  94           HB3      LEU  94  11.516  11.978   9.703
    5    HG   LEU  94           HG       LEU  94  10.032  12.070   7.076
    6   HD11  LEU  94          HD11      LEU  94  10.074   9.838   9.069
    7   HD13  LEU  94          HD12      LEU  94   9.771   9.791   7.334
    8   HD12  LEU  94          HD13      LEU  94   8.502  10.326   8.435
    9   HD23  LEU  94          HD21      LEU  94   8.121  12.498   8.679
   10   HD22  LEU  94          HD22      LEU  94   9.383  13.728   8.721
   11   HD21  LEU  94          HD23      LEU  94   9.298  12.507   9.990

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  95           H        ILE  95  14.485  11.982   7.840
    2    HA   ILE  95           HA       ILE  95  15.671  12.870  10.258
    3    HB   ILE  95           HB       ILE  95  16.888  11.791   7.703
    4   HG12  ILE  95          HG12      ILE  95  16.572  10.582  10.465
    5   HG13  ILE  95          HG13      ILE  95  15.400  10.352   9.170
    6   HG21  ILE  95          HG21      ILE  95  18.160  12.561  10.349
    7   HG23  ILE  95          HG22      ILE  95  18.631  13.088   8.732
    8   HG22  ILE  95          HG23      ILE  95  18.907  11.420   9.232
    9   HD13  ILE  95          HD11      ILE  95  16.855   9.052   7.899
   10   HD12  ILE  95          HD12      ILE  95  17.320   8.586   9.533
   11   HD11  ILE  95          HD13      ILE  95  18.295   9.752   8.639

  No H/Q in entry =          11
  In of MODEL   65
    1    H    GLU  96           H        GLU  96  15.846  14.117   6.929
    2    HA   GLU  96           HA       GLU  96  17.732  16.158   7.415
    3    HB2  GLU  96           HB2      GLU  96  17.053  15.519   5.153
    4    HB3  GLU  96           HB3      GLU  96  15.421  16.105   5.457
    5    HG2  GLU  96           HG2      GLU  96  16.027  18.226   4.925
    6    HG3  GLU  96           HG3      GLU  96  17.326  18.197   6.106

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LEU  97           H        LEU  97  14.218  16.035   7.846
    2    HA   LEU  97           HA       LEU  97  13.853  18.772   8.502
    3    HB2  LEU  97           HB2      LEU  97  12.288  16.272   9.105
    4    HB3  LEU  97           HB3      LEU  97  11.805  17.825   9.784
    5    HG   LEU  97           HG       LEU  97  12.278  17.415   6.817
    6   HD12  LEU  97          HD11      LEU  97   9.752  17.335   6.700
    7   HD11  LEU  97          HD12      LEU  97   9.743  17.127   8.450
    8   HD13  LEU  97          HD13      LEU  97  10.501  15.910   7.421
    9   HD23  LEU  97          HD21      LEU  97  10.577  19.411   6.861
   10   HD22  LEU  97          HD22      LEU  97  12.265  19.737   7.253
   11   HD21  LEU  97          HD23      LEU  97  11.074  19.583   8.544

  No H/Q in entry =          11
  In of MODEL   65
    1    H    HIS  98           H        HIS  98  14.623  15.922  10.483
    2    HA   HIS  98           HA       HIS  98  14.491  17.173  13.005
    3    HB2  HIS  98           HB2      HIS  98  16.198  14.888  11.991
    4    HB3  HIS  98           HB3      HIS  98  16.208  15.418  13.674
    5    HD1  HIS  98           HD1      HIS  98  13.976  13.843  11.076
    6    HD2  HIS  98           HD2      HIS  98  13.890  14.744  15.146
    7    HE1  HIS  98           HE1      HIS  98  11.930  12.682  12.025
    8    HE2  HIS  98           HE2      HIS  98  11.857  13.223  14.499

  No H/Q in entry =           8
  In of MODEL   65
    1    H    GLU  99           H        GLU  99  17.040  17.022  10.567
    2    HA   GLU  99           HA       GLU  99  19.052  18.308  12.101
    3    HB2  GLU  99           HB2      GLU  99  19.505  17.022  10.025
    4    HB3  GLU  99           HB3      GLU  99  18.718  18.296   9.091
    5    HG2  GLU  99           HG2      GLU  99  20.358  19.932   9.889
    6    HG3  GLU  99           HG3      GLU  99  21.115  18.711  10.905

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LYS 100           H        LYS 100  16.548  19.529   9.893
    2    HA   LYS 100           HA       LYS 100  17.398  22.250  10.050
    3    HB2  LYS 100           HB2      LYS 100  14.740  21.015   9.291
    4    HB3  LYS 100           HB3      LYS 100  15.073  22.748   9.209
    5    HG2  LYS 100           HG2      LYS 100  17.035  22.269   7.739
    6    HG3  LYS 100           HG3      LYS 100  16.589  20.560   7.748
    7    HD2  LYS 100           HD2      LYS 100  14.403  21.117   6.753
    8    HD3  LYS 100           HD3      LYS 100  14.832  22.828   6.750
    9    HE2  LYS 100           HE2      LYS 100  16.780  22.317   5.286
   10    HE3  LYS 100           HE3      LYS 100  16.282  20.622   5.245
   11    HZ1  LYS 100           HZ1      LYS 100  14.499  22.853   4.423
   12    HZ3  LYS 100           HZ2      LYS 100  14.282  21.189   4.152
   13    HZ2  LYS 100           HZ3      LYS 100  15.509  22.032   3.334

  No H/Q in entry =          13
  In of MODEL   65
    1    H    LEU 101           H        LEU 101  15.263  20.234  12.007
    2    HA   LEU 101           HA       LEU 101  14.139  22.317  13.597
    3    HB2  LEU 101           HB2      LEU 101  14.524  19.357  13.965
    4    HB3  LEU 101           HB3      LEU 101  14.008  20.341  15.332
    5    HG   LEU 101           HG       LEU 101  12.590  20.470  12.665
    6   HD12  LEU 101          HD11      LEU 101  10.902  18.932  13.927
    7   HD11  LEU 101          HD12      LEU 101  12.289  18.487  14.919
    8   HD13  LEU 101          HD13      LEU 101  12.315  18.189  13.180
    9   HD21  LEU 101          HD21      LEU 101  11.951  21.261  15.521
   10   HD23  LEU 101          HD22      LEU 101  10.685  21.066  14.311
   11   HD22  LEU 101          HD23      LEU 101  11.943  22.278  14.078

  No H/Q in entry =          11
  In of MODEL   65
    1    H    LYS 102           H        LYS 102  17.273  21.650  13.154
    2    HA   LYS 102           HA       LYS 102  19.137  22.479  14.229
    3    HB2  LYS 102           HB2      LYS 102  17.354  24.024  15.372
    4    HB3  LYS 102           HB3      LYS 102  17.542  22.950  16.743
    5    HG2  LYS 102           HG2      LYS 102  19.473  24.930  15.582
    6    HG3  LYS 102           HG3      LYS 102  19.086  24.615  17.260
    7    HD2  LYS 102           HD2      LYS 102  20.714  22.679  15.563
    8    HD3  LYS 102           HD3      LYS 102  21.430  23.982  16.501
    9    HE2  LYS 102           HE2      LYS 102  20.983  21.437  17.458
   10    HE3  LYS 102           HE3      LYS 102  21.231  22.869  18.456
   11    HZ2  LYS 102           HZ1      LYS 102  19.238  21.621  19.069
   12    HZ1  LYS 102           HZ2      LYS 102  18.597  21.871  17.522
   13    HZ3  LYS 102           HZ3      LYS 102  18.854  23.191  18.555

  No H/Q in entry =          13
  In of MODEL   65
    1    H    ALA 103           H        ALA 103  17.037  20.902  16.645
    2    HA   ALA 103           HA       ALA 103  18.742  19.650  18.292
    3    HB2  ALA 103           HB1      ALA 103  17.119  17.673  18.277
    4    HB1  ALA 103           HB2      ALA 103  16.239  18.551  17.025
    5    HB3  ALA 103           HB3      ALA 103  16.432  19.260  18.627

  No H/Q in entry =           5
  In of MODEL   65
    1    H1   ALA   1           H3       ALA   1  -1.748  -6.604 -21.445
    2    H2   ALA   1           H2       ALA   1  -2.571  -8.025 -20.998
    3    H3   ALA   1           H1       ALA   1  -0.965  -8.104 -21.555
    4    HA   ALA   1           HA       ALA   1  -1.810  -8.547 -23.553
    5    HB1  ALA   1           HB1      ALA   1  -3.960  -9.224 -23.081
    6    HB2  ALA   1           HB2      ALA   1  -4.369  -7.701 -23.870
    7    HB3  ALA   1           HB3      ALA   1  -4.309  -7.792 -22.112

  No H/Q in entry =           7
  In of MODEL   65
    1    H    GLU   2           H        GLU   2  -2.617  -7.329 -25.535
    2    HA   GLU   2           HA       GLU   2  -1.179  -5.339 -26.404
    3    HB2  GLU   2           HB2      GLU   2  -4.187  -5.344 -26.719
    4    HB3  GLU   2           HB3      GLU   2  -3.050  -4.499 -27.765
    5    HG2  GLU   2           HG2      GLU   2  -2.586  -6.392 -28.930
    6    HG3  GLU   2           HG3      GLU   2  -2.306  -7.311 -27.458

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLU   3           H        GLU   3  -4.313  -4.024 -25.494
    2    HA   GLU   3           HA       GLU   3  -3.215  -1.493 -24.853
    3    HB2  GLU   3           HB2      GLU   3  -5.928  -2.755 -24.526
    4    HB3  GLU   3           HB3      GLU   3  -5.598  -1.150 -23.871
    5    HG2  GLU   3           HG2      GLU   3  -5.224  -0.219 -25.992
    6    HG3  GLU   3           HG3      GLU   3  -4.861  -1.778 -26.725

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LEU   4           H        LEU   4  -4.851  -3.831 -22.684
    2    HA   LEU   4           HA       LEU   4  -4.460  -2.623 -20.287
    3    HB2  LEU   4           HB2      LEU   4  -3.977  -5.572 -20.773
    4    HB3  LEU   4           HB3      LEU   4  -4.366  -4.826 -19.225
    5    HG   LEU   4           HG       LEU   4  -6.142  -4.851 -21.688
    6   HD13  LEU   4          HD11      LEU   4  -7.368  -6.549 -20.698
    7   HD12  LEU   4          HD12      LEU   4  -6.873  -6.108 -19.065
    8   HD11  LEU   4          HD13      LEU   4  -5.755  -6.969 -20.122
    9   HD23  LEU   4          HD21      LEU   4  -7.808  -4.016 -19.814
   10   HD22  LEU   4          HD22      LEU   4  -6.747  -2.862 -20.619
   11   HD21  LEU   4          HD23      LEU   4  -6.332  -3.469 -19.017

  No H/Q in entry =          11
  In of MODEL   65
    1    H    GLU   5           H        GLU   5  -2.001  -4.507 -22.030
    2    HA   GLU   5           HA       GLU   5  -0.010  -4.274 -19.993
    3    HB2  GLU   5           HB2      GLU   5   0.018  -6.035 -21.754
    4    HB3  GLU   5           HB3      GLU   5   0.355  -4.792 -22.959
    5    HG2  GLU   5           HG2      GLU   5   2.435  -4.202 -21.806
    6    HG3  GLU   5           HG3      GLU   5   2.095  -5.389 -20.547

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLU   6           H        GLU   6  -0.613  -2.532 -23.028
    2    HA   GLU   6           HA       GLU   6   1.594  -0.745 -22.753
    3    HB2  GLU   6           HB2      GLU   6  -0.026  -1.338 -24.808
    4    HB3  GLU   6           HB3      GLU   6  -0.838   0.117 -24.233
    5    HG2  GLU   6           HG2      GLU   6   2.119  -0.073 -24.868
    6    HG3  GLU   6           HG3      GLU   6   0.904   0.616 -25.943

  No H/Q in entry =           6
  In of MODEL   65
    1    H    VAL   7           H        VAL   7  -1.745  -0.755 -21.705
    2    HA   VAL   7           HA       VAL   7  -1.911   1.957 -20.854
    3    HB   VAL   7           HB       VAL   7  -3.423  -0.535 -20.030
    4   HG11  VAL   7          HG11      VAL   7  -3.739   2.356 -19.200
    5   HG13  VAL   7          HG12      VAL   7  -3.668   0.924 -18.173
    6   HG12  VAL   7          HG13      VAL   7  -5.095   1.228 -19.162
    7   HG21  VAL   7          HG21      VAL   7  -3.560   0.557 -22.412
    8   HG23  VAL   7          HG22      VAL   7  -4.479   1.820 -21.593
    9   HG22  VAL   7          HG23      VAL   7  -5.059   0.154 -21.575

  No H/Q in entry =           9
  In of MODEL   65
    1    H    VAL   8           H        VAL   8  -0.983  -1.056 -19.228
    2    HA   VAL   8           HA       VAL   8  -0.641   0.003 -16.627
    3    HB   VAL   8           HB       VAL   8   0.638  -2.355 -18.026
    4   HG11  VAL   8          HG11      VAL   8   0.979  -1.288 -15.222
    5   HG13  VAL   8          HG12      VAL   8   2.224  -1.794 -16.363
    6   HG12  VAL   8          HG13      VAL   8   1.202  -2.999 -15.583
    7   HG22  VAL   8          HG21      VAL   8  -1.013  -3.666 -16.949
    8   HG21  VAL   8          HG22      VAL   8  -1.908  -2.199 -17.338
    9   HG23  VAL   8          HG23      VAL   8  -1.304  -2.452 -15.705

  No H/Q in entry =           9
  In of MODEL   65
    1    H    MET   9           H        MET   9   1.600  -0.329 -19.378
    2    HA   MET   9           HA       MET   9   3.907   0.660 -18.113
    3    HB2  MET   9           HB2      MET   9   2.957   0.718 -20.974
    4    HB3  MET   9           HB3      MET   9   4.485   1.457 -20.498
    5    HG2  MET   9           HG2      MET   9   5.207  -0.706 -19.519
    6    HG3  MET   9           HG3      MET   9   3.694  -1.439 -20.058
    7    HE2  MET   9           HE1      MET   9   7.440  -0.831 -21.206
    8    HE1  MET   9           HE2      MET   9   6.585   0.681 -20.915
    9    HE3  MET   9           HE3      MET   9   7.103   0.268 -22.548

  No H/Q in entry =           9
  In of MODEL   65
    1    H    GLY  10           H        GLY  10   1.256   2.327 -19.779
    2    HA3  GLY  10           HA2      GLY  10   2.274   4.958 -19.521
    3    HA2  GLY  10           HA3      GLY  10   0.575   4.535 -19.727

  No H/Q in entry =           3
  In of MODEL   65
    1    H    LEU  11           H        LEU  11   0.146   3.004 -17.448
    2    HA   LEU  11           HA       LEU  11  -0.340   4.980 -15.477
    3    HB2  LEU  11           HB2      LEU  11  -0.336   1.963 -15.338
    4    HB3  LEU  11           HB3      LEU  11  -0.822   2.989 -13.989
    5    HG   LEU  11           HG       LEU  11  -2.061   3.144 -16.750
    6   HD13  LEU  11          HD11      LEU  11  -2.689   1.010 -16.006
    7   HD12  LEU  11          HD12      LEU  11  -4.018   2.027 -15.454
    8   HD11  LEU  11          HD13      LEU  11  -2.771   1.514 -14.318
    9   HD22  LEU  11          HD21      LEU  11  -2.608   5.167 -15.732
   10   HD21  LEU  11          HD22      LEU  11  -2.545   4.490 -14.105
   11   HD23  LEU  11          HD23      LEU  11  -3.929   4.159 -15.147

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  12           H        ILE  12   2.150   2.462 -15.737
    2    HA   ILE  12           HA       ILE  12   3.369   2.960 -13.232
    3    HB   ILE  12           HB       ILE  12   4.566   1.889 -15.809
    4   HG12  ILE  12          HG12      ILE  12   2.581   0.683 -14.623
    5   HG13  ILE  12          HG13      ILE  12   3.979  -0.272 -15.073
    6   HG22  ILE  12          HG21      ILE  12   6.262   0.852 -14.228
    7   HG21  ILE  12          HG22      ILE  12   5.632   1.913 -12.968
    8   HG23  ILE  12          HG23      ILE  12   6.384   2.600 -14.406
    9   HD11  ILE  12          HD11      ILE  12   3.497   0.922 -12.331
   10   HD13  ILE  12          HD12      ILE  12   4.799  -0.175 -12.784
   11   HD12  ILE  12          HD13      ILE  12   3.143  -0.739 -12.772

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  13           H        ILE  13   3.993   4.228 -16.483
    2    HA   ILE  13           HA       ILE  13   6.168   5.898 -15.752
    3    HB   ILE  13           HB       ILE  13   4.137   6.028 -17.994
    4   HG12  ILE  13          HG12      ILE  13   5.950   4.160 -17.725
    5   HG13  ILE  13          HG13      ILE  13   5.708   4.908 -19.299
    6   HG22  ILE  13          HG21      ILE  13   6.045   7.547 -19.015
    7   HG21  ILE  13          HG22      ILE  13   6.406   7.889 -17.326
    8   HG23  ILE  13          HG23      ILE  13   4.811   8.261 -17.975
    9   HD12  ILE  13          HD11      ILE  13   8.151   4.682 -18.551
   10   HD11  ILE  13          HD12      ILE  13   7.782   5.891 -17.328
   11   HD13  ILE  13          HD13      ILE  13   7.643   6.299 -19.033

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ASN  14           H        ASN  14   2.672   6.469 -16.011
    2    HA   ASN  14           HA       ASN  14   2.690   9.212 -15.359
    3    HB2  ASN  14           HB2      ASN  14   0.761   7.615 -16.196
    4    HB3  ASN  14           HB3      ASN  14   0.438   7.434 -14.476
    5   HD21  ASN  14          HD21      ASN  14  -1.558   8.641 -15.899
    6   HD22  ASN  14          HD22      ASN  14  -1.585  10.314 -15.622

  No H/Q in entry =           6
  In of MODEL   65
    1    H    SER  15           H        SER  15   2.336   6.330 -13.298
    2    HA   SER  15           HA       SER  15   2.062   7.693 -10.841
    3    HB2  SER  15           HB2      SER  15   2.569   5.591  -9.804
    4    HB3  SER  15           HB3      SER  15   1.728   5.198 -11.300
    5    HG   SER  15           HG       SER  15   4.378   4.827 -10.583

  No H/Q in entry =           5
  In of MODEL   65
    1    H    GLY  16           H        GLY  16   4.912   6.546 -12.611
    2    HA3  GLY  16           HA2      GLY  16   6.855   7.251 -10.679
    3    HA2  GLY  16           HA3      GLY  16   7.151   7.051 -12.405

  No H/Q in entry =           3
  In of MODEL   65
    1    H    GLN  17           H        GLN  17   5.502   9.050 -13.454
    2    HA   GLN  17           HA       GLN  17   7.128  11.356 -13.136
    3    HB2  GLN  17           HB2      GLN  17   5.775  10.892 -15.173
    4    HB3  GLN  17           HB3      GLN  17   4.307  11.187 -14.241
    5    HG2  GLN  17           HG2      GLN  17   4.899  13.216 -15.455
    6    HG3  GLN  17           HG3      GLN  17   5.134  13.482 -13.728
    7   HE21  GLN  17          HE21      GLN  17   6.872  14.991 -13.810
    8   HE22  GLN  17          HE22      GLN  17   8.379  14.631 -14.504

  No H/Q in entry =           8
  In of MODEL   65
    1    H    ALA  18           H        ALA  18   4.009  10.395 -11.787
    2    HA   ALA  18           HA       ALA  18   3.335  12.791 -10.507
    3    HB1  ALA  18           HB1      ALA  18   2.155  10.359 -10.741
    4    HB2  ALA  18           HB2      ALA  18   1.634  11.584  -9.587
    5    HB3  ALA  18           HB3      ALA  18   2.698  10.277  -9.065

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ARG  19           H        ARG  19   5.154   9.984  -9.246
    2    HA   ARG  19           HA       ARG  19   5.714  11.117  -6.719
    3    HB2  ARG  19           HB2      ARG  19   6.079   8.709  -7.259
    4    HB3  ARG  19           HB3      ARG  19   7.443   9.173  -8.280
    5    HG2  ARG  19           HG2      ARG  19   8.586  10.180  -6.354
    6    HG3  ARG  19           HG3      ARG  19   7.204   9.814  -5.322
    7    HD2  ARG  19           HD2      ARG  19   8.933   8.142  -4.976
    8    HD3  ARG  19           HD3      ARG  19   7.543   7.392  -5.764
    9    HE   ARG  19           HE       ARG  19   9.260   8.187  -7.809
   10   HH21  ARG  19          HH11      ARG  19  10.791   6.756  -8.670
   11   HH22  ARG  19          HH12      ARG  19  11.311   5.393  -7.742
   12   HH11  ARG  19          HH21      ARG  19   9.296   6.141  -5.042
   13   HH12  ARG  19          HH22      ARG  19  10.461   5.044  -5.687

  No H/Q in entry =          13
  In of MODEL   65
    1    H    SER  20           H        SER  20   7.527  11.127  -9.770
    2    HA   SER  20           HA       SER  20   9.800  12.494  -8.942
    3    HB2  SER  20           HB2      SER  20   9.809  11.628 -11.151
    4    HB3  SER  20           HB3      SER  20   8.328  12.480 -11.571
    5    HG   SER  20           HG       SER  20   9.423  14.355 -11.675

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LEU  21           H        LEU  21   6.725  13.829 -10.127
    2    HA   LEU  21           HA       LEU  21   7.449  16.560  -9.889
    3    HB2  LEU  21           HB2      LEU  21   4.755  15.185  -9.818
    4    HB3  LEU  21           HB3      LEU  21   4.951  16.935  -9.803
    5    HG   LEU  21           HG       LEU  21   6.130  15.153 -11.954
    6   HD11  LEU  21          HD11      LEU  21   3.432  16.463 -11.704
    7   HD13  LEU  21          HD12      LEU  21   3.833  14.845 -12.282
    8   HD12  LEU  21          HD13      LEU  21   4.167  16.249 -13.294
    9   HD23  LEU  21          HD21      LEU  21   5.903  17.492 -13.168
   10   HD22  LEU  21          HD22      LEU  21   7.271  17.221 -12.092
   11   HD21  LEU  21          HD23      LEU  21   5.883  18.138 -11.529

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ALA  22           H        ALA  22   5.896  14.288  -7.651
    2    HA   ALA  22           HA       ALA  22   5.330  16.095  -5.573
    3    HB3  ALA  22           HB1      ALA  22   4.524  13.719  -5.748
    4    HB2  ALA  22           HB2      ALA  22   5.124  14.171  -4.152
    5    HB1  ALA  22           HB3      ALA  22   6.127  13.199  -5.230

  No H/Q in entry =           5
  In of MODEL   65
    1    H    TYR  23           H        TYR  23   8.225  14.018  -6.027
    2    HA   TYR  23           HA       TYR  23   9.630  14.999  -3.771
    3    HB2  TYR  23           HB2      TYR  23  10.379  12.983  -4.940
    4    HB3  TYR  23           HB3      TYR  23  10.706  13.923  -6.396
    5    HD1  TYR  23           HD1      TYR  23  11.672  13.552  -2.809
    6    HD2  TYR  23           HD2      TYR  23  12.761  15.059  -6.682
    7    HE1  TYR  23           HE1      TYR  23  13.942  14.084  -1.964
    8    HE2  TYR  23           HE2      TYR  23  15.030  15.593  -5.835
    9    HH   TYR  23           HH       TYR  23  16.083  14.583  -2.638

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ALA  24           H        ALA  24   9.463  16.127  -7.131
    2    HA   ALA  24           HA       ALA  24  11.396  18.177  -6.877
    3    HB2  ALA  24           HB1      ALA  24  10.951  18.259  -9.085
    4    HB3  ALA  24           HB2      ALA  24   9.410  19.034  -8.719
    5    HB1  ALA  24           HB3      ALA  24   9.504  17.280  -8.858

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ALA  25           H        ALA  25   7.915  18.051  -6.251
    2    HA   ALA  25           HA       ALA  25   7.484  20.774  -5.667
    3    HB1  ALA  25           HB1      ALA  25   5.788  18.806  -5.876
    4    HB2  ALA  25           HB2      ALA  25   5.444  20.094  -4.720
    5    HB3  ALA  25           HB3      ALA  25   6.108  18.559  -4.159

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LEU  26           H        LEU  26   8.509  18.065  -3.633
    2    HA   LEU  26           HA       LEU  26   8.642  19.481  -1.189
    3    HB2  LEU  26           HB2      LEU  26   8.696  17.063  -1.196
    4    HB3  LEU  26           HB3      LEU  26  10.164  17.051  -2.169
    5    HG   LEU  26           HG       LEU  26  11.401  18.138  -0.325
    6   HD12  LEU  26          HD11      LEU  26  10.178  18.155   1.937
    7   HD11  LEU  26          HD12      LEU  26   8.687  18.047   1.004
    8   HD13  LEU  26          HD13      LEU  26   9.755  19.436   0.801
    9   HD21  LEU  26          HD21      LEU  26   9.827  15.692   0.538
   10   HD23  LEU  26          HD22      LEU  26  11.353  16.225   1.235
   11   HD22  LEU  26          HD23      LEU  26  11.295  15.676  -0.437

  No H/Q in entry =          11
  In of MODEL   65
    1    H    LYS  27           H        LYS  27  11.045  18.881  -3.720
    2    HA   LYS  27           HA       LYS  27  13.251  20.078  -2.489
    3    HB2  LYS  27           HB2      LYS  27  13.327  18.741  -4.586
    4    HB3  LYS  27           HB3      LYS  27  12.583  20.090  -5.443
    5    HG2  LYS  27           HG2      LYS  27  14.474  21.541  -4.861
    6    HG3  LYS  27           HG3      LYS  27  15.214  20.231  -3.933
    7    HD2  LYS  27           HD2      LYS  27  15.331  18.853  -5.994
    8    HD3  LYS  27           HD3      LYS  27  14.636  20.187  -6.914
    9    HE2  LYS  27           HE2      LYS  27  16.549  21.619  -6.297
   10    HE3  LYS  27           HE3      LYS  27  17.247  20.288  -5.368
   11    HZ3  LYS  27           HZ1      LYS  27  18.236  20.383  -7.555
   12    HZ2  LYS  27           HZ2      LYS  27  16.706  20.293  -8.294
   13    HZ1  LYS  27           HZ3      LYS  27  17.309  18.968  -7.417

  No H/Q in entry =          13
  In of MODEL   65
    1    H    GLN  28           H        GLN  28  10.649  21.513  -4.426
    2    HA   GLN  28           HA       GLN  28  11.651  24.150  -4.568
    3    HB2  GLN  28           HB2      GLN  28   8.801  23.126  -4.456
    4    HB3  GLN  28           HB3      GLN  28   9.241  24.793  -4.824
    5    HG2  GLN  28           HG2      GLN  28  10.230  22.387  -6.378
    6    HG3  GLN  28           HG3      GLN  28   8.870  23.394  -6.870
    7   HE21  GLN  28          HE21      GLN  28   9.904  25.964  -6.182
    8   HE22  GLN  28          HE22      GLN  28  11.246  26.288  -7.169

  No H/Q in entry =           8
  In of MODEL   65
    1    H    ALA  29           H        ALA  29   9.696  22.477  -2.137
    2    HA   ALA  29           HA       ALA  29   9.185  24.669  -0.443
    3    HB2  ALA  29           HB1      ALA  29   8.433  23.104   1.119
    4    HB1  ALA  29           HB2      ALA  29   9.635  21.903   0.645
    5    HB3  ALA  29           HB3      ALA  29   8.252  22.224  -0.399

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LYS  30           H        LYS  30  11.878  22.359  -0.528
    2    HA   LYS  30           HA       LYS  30  13.215  23.280   1.777
    3    HB2  LYS  30           HB2      LYS  30  14.287  21.989  -0.742
    4    HB3  LYS  30           HB3      LYS  30  15.277  22.325   0.680
    5    HG2  LYS  30           HG2      LYS  30  13.704  20.960   2.055
    6    HG3  LYS  30           HG3      LYS  30  12.810  20.560   0.585
    7    HD2  LYS  30           HD2      LYS  30  14.837  19.546  -0.385
    8    HD3  LYS  30           HD3      LYS  30  15.750  19.960   1.068
    9    HE2  LYS  30           HE2      LYS  30  14.225  18.546   2.417
   10    HE3  LYS  30           HE3      LYS  30  13.342  18.112   0.948
   11    HZ2  LYS  30           HZ1      LYS  30  15.109  16.501   1.698
   12    HZ1  LYS  30           HZ2      LYS  30  16.264  17.672   1.251
   13    HZ3  LYS  30           HZ3      LYS  30  15.216  17.011   0.084

  No H/Q in entry =          13
  In of MODEL   65
    1    H    GLN  31           H        GLN  31  13.120  24.503  -1.513
    2    HA   GLN  31           HA       GLN  31  15.303  26.359  -1.086
    3    HB2  GLN  31           HB2      GLN  31  13.257  26.450  -3.306
    4    HB3  GLN  31           HB3      GLN  31  14.888  27.120  -3.306
    5    HG2  GLN  31           HG2      GLN  31  15.308  24.414  -2.746
    6    HG3  GLN  31           HG3      GLN  31  14.002  24.387  -3.922
    7   HE21  GLN  31          HE21      GLN  31  16.832  23.551  -4.335
    8   HE22  GLN  31          HE22      GLN  31  17.417  24.521  -5.598

  No H/Q in entry =           8
  In of MODEL   65
    1    H    GLY  32           H        GLY  32  12.228  26.220   0.064
    2    HA3  GLY  32           HA2      GLY  32  11.099  27.800   1.348
    3    HA2  GLY  32           HA3      GLY  32  12.243  29.020   0.802

  No H/Q in entry =           3
  In of MODEL   65
    1    H    ASP  33           H        ASP  33  10.844  27.151  -1.698
    2    HA   ASP  33           HA       ASP  33   9.215  29.454  -2.539
    3    HB2  ASP  33           HB2      ASP  33  10.267  27.025  -3.995
    4    HB3  ASP  33           HB3      ASP  33   9.132  28.163  -4.718

  No H/Q in entry =           4
  In of MODEL   65
    1    H    PHE  34           H        PHE  34   7.522  28.997  -0.974
    2    HA   PHE  34           HA       PHE  34   6.103  26.546  -0.889
    3    HB2  PHE  34           HB2      PHE  34   5.188  29.345  -0.193
    4    HB3  PHE  34           HB3      PHE  34   4.316  27.866   0.212
    5    HD1  PHE  34           HD1      PHE  34   6.606  30.222   1.435
    6    HD2  PHE  34           HD2      PHE  34   5.859  25.993   1.360
    7    HE1  PHE  34           HE1      PHE  34   7.996  29.939   3.467
    8    HE2  PHE  34           HE2      PHE  34   7.251  25.714   3.391
    9    HZ   PHE  34           HZ       PHE  34   8.313  27.688   4.444

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ALA  35           H        ALA  35   5.715  29.427  -2.884
    2    HA   ALA  35           HA       ALA  35   3.152  28.859  -3.908
    3    HB1  ALA  35           HB1      ALA  35   4.223  30.244  -5.940
    4    HB3  ALA  35           HB2      ALA  35   5.448  30.580  -4.717
    5    HB2  ALA  35           HB3      ALA  35   3.765  31.014  -4.421

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ALA  36           H        ALA  36   6.368  28.141  -5.272
    2    HA   ALA  36           HA       ALA  36   5.353  26.740  -7.521
    3    HB3  ALA  36           HB1      ALA  36   7.512  26.833  -8.140
    4    HB2  ALA  36           HB2      ALA  36   7.980  25.790  -6.795
    5    HB1  ALA  36           HB3      ALA  36   7.902  27.538  -6.571

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ALA  37           H        ALA  37   6.298  25.714  -4.273
    2    HA   ALA  37           HA       ALA  37   6.195  22.929  -4.716
    3    HB2  ALA  37           HB1      ALA  37   5.966  24.711  -2.328
    4    HB1  ALA  37           HB2      ALA  37   7.078  23.378  -2.629
    5    HB3  ALA  37           HB3      ALA  37   5.412  23.047  -2.157

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LYS  38           H        LYS  38   3.699  25.170  -3.532
    2    HA   LYS  38           HA       LYS  38   1.572  23.389  -3.315
    3    HB2  LYS  38           HB2      LYS  38   1.967  26.138  -3.051
    4    HB3  LYS  38           HB3      LYS  38   0.763  26.016  -4.328
    5    HG2  LYS  38           HG2      LYS  38  -0.704  24.708  -2.890
    6    HG3  LYS  38           HG3      LYS  38   0.541  24.622  -1.636
    7    HD2  LYS  38           HD2      LYS  38   0.392  26.959  -1.176
    8    HD3  LYS  38           HD3      LYS  38  -0.517  27.270  -2.655
    9    HE2  LYS  38           HE2      LYS  38  -2.017  27.317  -0.713
   10    HE3  LYS  38           HE3      LYS  38  -2.414  25.953  -1.761
   11    HZ3  LYS  38           HZ1      LYS  38  -1.709  24.463  -0.237
   12    HZ2  LYS  38           HZ2      LYS  38  -2.038  25.720   0.859
   13    HZ1  LYS  38           HZ3      LYS  38  -0.448  25.447   0.330

  No H/Q in entry =          13
  In of MODEL   65
    1    H    ALA  39           H        ALA  39   2.576  25.291  -6.156
    2    HA   ALA  39           HA       ALA  39   0.485  24.465  -7.860
    3    HB2  ALA  39           HB1      ALA  39   3.229  25.076  -8.915
    4    HB1  ALA  39           HB2      ALA  39   2.283  26.348  -8.141
    5    HB3  ALA  39           HB3      ALA  39   1.655  25.528  -9.571

  No H/Q in entry =           5
  In of MODEL   65
    1    H    MET  40           H        MET  40   3.703  23.113  -7.293
    2    HA   MET  40           HA       MET  40   3.570  21.105  -9.294
    3    HB2  MET  40           HB2      MET  40   5.189  21.290  -6.747
    4    HB3  MET  40           HB3      MET  40   5.418  20.037  -7.969
    5    HG2  MET  40           HG2      MET  40   5.521  22.995  -8.619
    6    HG3  MET  40           HG3      MET  40   6.954  22.068  -8.177
    7    HE3  MET  40           HE1      MET  40   7.787  19.854 -10.999
    8    HE2  MET  40           HE2      MET  40   7.221  19.534  -9.362
    9    HE1  MET  40           HE3      MET  40   8.337  20.866  -9.656

  No H/Q in entry =           9
  In of MODEL   65
    1    H    MET  41           H        MET  41   2.662  21.143  -5.869
    2    HA   MET  41           HA       MET  41   2.087  18.386  -5.604
    3    HB2  MET  41           HB2      MET  41   0.793  20.756  -4.238
    4    HB3  MET  41           HB3      MET  41   0.613  19.079  -3.739
    5    HG2  MET  41           HG2      MET  41   3.326  19.260  -3.780
    6    HG3  MET  41           HG3      MET  41   2.912  20.923  -3.375
    7    HE2  MET  41           HE1      MET  41  -0.144  19.708  -1.650
    8    HE1  MET  41           HE2      MET  41   0.696  21.210  -2.021
    9    HE3  MET  41           HE3      MET  41   0.630  20.632  -0.356

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ASP  42           H        ASP  42   0.089  21.146  -6.560
    2    HA   ASP  42           HA       ASP  42  -2.372  19.824  -6.700
    3    HB2  ASP  42           HB2      ASP  42  -1.627  22.384  -6.944
    4    HB3  ASP  42           HB3      ASP  42  -1.787  22.001  -8.654

  No H/Q in entry =           4
  In of MODEL   65
    1    H    GLN  43           H        GLN  43   0.073  20.391  -9.203
    2    HA   GLN  43           HA       GLN  43  -1.337  19.103 -11.297
    3    HB2  GLN  43           HB2      GLN  43   1.629  19.573 -10.917
    4    HB3  GLN  43           HB3      GLN  43   0.903  18.951 -12.402
    5    HG2  GLN  43           HG2      GLN  43  -0.578  21.001 -12.430
    6    HG3  GLN  43           HG3      GLN  43   0.387  21.636 -11.100
    7   HE21  GLN  43          HE21      GLN  43   0.570  23.264 -13.178
    8   HE22  GLN  43          HE22      GLN  43   1.979  23.027 -14.089

  No H/Q in entry =           8
  In of MODEL   65
    1    H    SER  44           H        SER  44   1.000  17.915  -8.916
    2    HA   SER  44           HA       SER  44   1.294  15.309  -9.955
    3    HB2  SER  44           HB2      SER  44   2.214  16.723  -7.713
    4    HB3  SER  44           HB3      SER  44   1.332  15.349  -7.048
    5    HG   SER  44           HG       SER  44   3.433  14.700  -7.481

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ARG  45           H        ARG  45  -1.002  16.650  -7.606
    2    HA   ARG  45           HA       ARG  45  -2.422  14.307  -6.981
    3    HB2  ARG  45           HB2      ARG  45  -2.587  16.471  -5.778
    4    HB3  ARG  45           HB3      ARG  45  -3.435  17.158  -7.160
    5    HG2  ARG  45           HG2      ARG  45  -5.226  15.457  -6.883
    6    HG3  ARG  45           HG3      ARG  45  -4.388  14.825  -5.464
    7    HD2  ARG  45           HD2      ARG  45  -4.560  17.089  -4.396
    8    HD3  ARG  45           HD3      ARG  45  -5.541  17.631  -5.774
    9    HE   ARG  45           HE       ARG  45  -6.684  15.266  -4.744
   10   HH21  ARG  45          HH11      ARG  45  -8.517  15.361  -3.470
   11   HH22  ARG  45          HH12      ARG  45  -8.889  16.802  -2.593
   12   HH11  ARG  45          HH21      ARG  45  -6.089  18.499  -3.704
   13   HH12  ARG  45          HH22      ARG  45  -7.510  18.579  -2.724

  No H/Q in entry =          13
  In of MODEL   65
    1    H    MET  46           H        MET  46  -2.976  16.733  -9.518
    2    HA   MET  46           HA       MET  46  -5.333  15.600 -10.582
    3    HB2  MET  46           HB2      MET  46  -3.206  17.394 -11.762
    4    HB3  MET  46           HB3      MET  46  -4.612  16.874 -12.696
    5    HG2  MET  46           HG2      MET  46  -6.110  17.818 -10.993
    6    HG3  MET  46           HG3      MET  46  -4.726  18.310 -10.026
    7    HE1  MET  46           HE1      MET  46  -5.286  20.671  -9.812
    8    HE3  MET  46           HE2      MET  46  -6.811  20.518 -10.677
    9    HE2  MET  46           HE3      MET  46  -5.688  21.808 -11.106

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ALA  47           H        ALA  47  -1.913  15.075 -11.348
    2    HA   ALA  47           HA       ALA  47  -2.287  13.364 -13.567
    3    HB3  ALA  47           HB1      ALA  47  -0.096  14.221 -13.214
    4    HB2  ALA  47           HB2      ALA  47   0.021  12.489 -12.890
    5    HB1  ALA  47           HB3      ALA  47  -0.053  13.635 -11.550

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LEU  48           H        LEU  48  -2.021  12.707 -10.097
    2    HA   LEU  48           HA       LEU  48  -2.155   9.869 -10.270
    3    HB2  LEU  48           HB2      LEU  48  -2.889  11.786  -8.045
    4    HB3  LEU  48           HB3      LEU  48  -2.820  10.034  -7.853
    5    HG   LEU  48           HG       LEU  48  -0.498  11.705  -8.846
    6   HD13  LEU  48          HD11      LEU  48  -0.766  12.468  -6.651
    7   HD12  LEU  48          HD12      LEU  48   0.378  11.143  -6.461
    8   HD11  LEU  48          HD13      LEU  48  -1.323  10.903  -6.062
    9   HD22  LEU  48          HD21      LEU  48  -0.032   9.516  -9.499
   10   HD21  LEU  48          HD22      LEU  48  -0.909   8.806  -8.145
   11   HD23  LEU  48          HD23      LEU  48   0.674   9.536  -7.883

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ASN  49           H        ASN  49  -4.583  12.394  -9.851
    2    HA   ASN  49           HA       ASN  49  -6.791  10.758  -9.317
    3    HB2  ASN  49           HB2      ASN  49  -6.796  13.188  -8.989
    4    HB3  ASN  49           HB3      ASN  49  -6.667  13.441 -10.725
    5   HD21  ASN  49          HD21      ASN  49  -8.721  14.578 -10.782
    6   HD22  ASN  49          HD22      ASN  49 -10.191  13.751 -10.602

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLU  50           H        GLU  50  -5.499  11.952 -12.400
    2    HA   GLU  50           HA       GLU  50  -7.474  10.733 -14.049
    3    HB2  GLU  50           HB2      GLU  50  -5.983  12.536 -14.857
    4    HB3  GLU  50           HB3      GLU  50  -4.604  11.443 -14.726
    5    HG2  GLU  50           HG2      GLU  50  -5.602   9.930 -16.369
    6    HG3  GLU  50           HG3      GLU  50  -7.049  10.929 -16.449

  No H/Q in entry =           6
  In of MODEL   65
    1    H    ALA  51           H        ALA  51  -4.316   9.690 -12.854
    2    HA   ALA  51           HA       ALA  51  -4.213   7.243 -14.284
    3    HB2  ALA  51           HB1      ALA  51  -2.235   6.921 -13.189
    4    HB1  ALA  51           HB2      ALA  51  -2.914   7.345 -11.618
    5    HB3  ALA  51           HB3      ALA  51  -2.442   8.615 -12.747

  No H/Q in entry =           5
  In of MODEL   65
    1    H    HIS  52           H        HIS  52  -5.369   8.074 -11.029
    2    HA   HIS  52           HA       HIS  52  -6.091   5.470 -10.210
    3    HB2  HIS  52           HB2      HIS  52  -5.921   7.444  -8.703
    4    HB3  HIS  52           HB3      HIS  52  -7.393   8.087  -9.429
    5    HD1  HIS  52           HD1      HIS  52  -9.619   6.747  -9.005
    6    HD2  HIS  52           HD2      HIS  52  -6.328   5.340  -6.870
    7    HE1  HIS  52           HE1      HIS  52 -10.531   5.195  -7.223
    8    HE2  HIS  52           HE2      HIS  52  -8.536   4.329  -5.912

  No H/Q in entry =           8
  In of MODEL   65
    1    H    LEU  53           H        LEU  53  -7.878   7.963 -11.983
    2    HA   LEU  53           HA       LEU  53 -10.402   6.708 -11.999
    3    HB2  LEU  53           HB2      LEU  53  -9.091   8.680 -13.858
    4    HB3  LEU  53           HB3      LEU  53 -10.699   8.039 -14.185
    5    HG   LEU  53           HG       LEU  53  -9.976   9.317 -11.530
    6   HD13  LEU  53          HD11      LEU  53  -9.624  11.039 -13.168
    7   HD12  LEU  53          HD12      LEU  53 -11.219  11.322 -12.468
    8   HD11  LEU  53          HD13      LEU  53 -11.070  10.573 -14.056
    9   HD23  LEU  53          HD21      LEU  53 -12.547   9.766 -11.678
   10   HD22  LEU  53          HD22      LEU  53 -12.004   8.145 -11.263
   11   HD21  LEU  53          HD23      LEU  53 -12.551   8.494 -12.892

  No H/Q in entry =          11
  In of MODEL   65
    1    H    VAL  54           H        VAL  54  -7.657   6.482 -14.241
    2    HA   VAL  54           HA       VAL  54  -8.908   4.739 -16.092
    3    HB   VAL  54           HB       VAL  54  -5.992   5.199 -15.410
    4   HG12  VAL  54          HG11      VAL  54  -5.764   4.122 -17.805
    5   HG11  VAL  54          HG12      VAL  54  -7.303   3.362 -17.404
    6   HG13  VAL  54          HG13      VAL  54  -5.891   3.081 -16.388
    7   HG22  VAL  54          HG21      VAL  54  -6.735   7.158 -16.444
    8   HG21  VAL  54          HG22      VAL  54  -7.941   6.318 -17.415
    9   HG23  VAL  54          HG23      VAL  54  -6.237   6.215 -17.848

  No H/Q in entry =           9
  In of MODEL   65
    1    H    GLN  55           H        GLN  55  -6.914   4.148 -13.197
    2    HA   GLN  55           HA       GLN  55  -6.867   1.331 -13.468
    3    HB2  GLN  55           HB2      GLN  55  -5.296   2.196 -11.946
    4    HB3  GLN  55           HB3      GLN  55  -6.497   3.176 -11.110
    5    HG2  GLN  55           HG2      GLN  55  -7.210   1.423  -9.801
    6    HG3  GLN  55           HG3      GLN  55  -7.005   0.239 -11.085
    7   HE21  GLN  55          HE21      GLN  55  -5.403  -1.237 -10.600
    8   HE22  GLN  55          HE22      GLN  55  -4.012  -0.911  -9.688

  No H/Q in entry =           8
  In of MODEL   65
    1    H    THR  56           H        THR  56  -9.163   3.521 -11.840
    2    HA   THR  56           HA       THR  56 -10.774   1.655 -10.558
    3    HB   THR  56           HB       THR  56 -11.836   4.066 -12.052
    4    HG1  THR  56           HG1      THR  56 -10.231   3.817  -9.798
    5   HG21  THR  56          HG21      THR  56 -13.308   2.255 -10.837
    6   HG23  THR  56          HG22      THR  56 -13.654   3.968 -10.601
    7   HG22  THR  56          HG23      THR  56 -12.756   3.072  -9.375

  No H/Q in entry =           7
  In of MODEL   65
    1    H    LYS  57           H        LYS  57 -10.963   2.758 -13.938
    2    HA   LYS  57           HA       LYS  57 -13.146   1.108 -14.698
    3    HB2  LYS  57           HB2      LYS  57 -12.228   3.056 -16.001
    4    HB3  LYS  57           HB3      LYS  57 -10.819   2.080 -16.388
    5    HG2  LYS  57           HG2      LYS  57 -12.212   0.460 -17.566
    6    HG3  LYS  57           HG3      LYS  57 -13.667   1.339 -17.112
    7    HD2  LYS  57           HD2      LYS  57 -12.895   3.298 -18.400
    8    HD3  LYS  57           HD3      LYS  57 -11.430   2.431 -18.853
    9    HE2  LYS  57           HE2      LYS  57 -12.855   2.113 -20.716
   10    HE3  LYS  57           HE3      LYS  57 -13.050   0.617 -19.805
   11    HZ2  LYS  57           HZ1      LYS  57 -15.115   1.922 -20.613
   12    HZ1  LYS  57           HZ2      LYS  57 -14.824   2.890 -19.245
   13    HZ3  LYS  57           HZ3      LYS  57 -15.113   1.225 -19.067

  No H/Q in entry =          13
  In of MODEL   65
    1    H    LEU  58           H        LEU  58  -9.648   0.623 -14.647
    2    HA   LEU  58           HA       LEU  58  -9.696  -1.887 -15.948
    3    HB2  LEU  58           HB2      LEU  58  -7.641  -0.635 -14.135
    4    HB3  LEU  58           HB3      LEU  58  -7.404  -2.156 -14.997
    5    HG   LEU  58           HG       LEU  58  -8.119   0.466 -16.347
    6   HD11  LEU  58          HD11      LEU  58  -5.491  -0.815 -15.665
    7   HD13  LEU  58          HD12      LEU  58  -5.960   0.883 -15.607
    8   HD12  LEU  58          HD13      LEU  58  -5.634   0.115 -17.157
    9   HD22  LEU  58          HD21      LEU  58  -8.720  -1.080 -17.945
   10   HD21  LEU  58          HD22      LEU  58  -7.697  -2.346 -17.270
   11   HD23  LEU  58          HD23      LEU  58  -6.988  -1.078 -18.270

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  59           H        ILE  59 -10.501  -0.988 -12.692
    2    HA   ILE  59           HA       ILE  59 -10.191  -3.765 -11.758
    3    HB   ILE  59           HB       ILE  59  -9.706  -1.517 -10.346
    4   HG12  ILE  59          HG12      ILE  59 -11.131  -3.837  -9.029
    5   HG13  ILE  59          HG13      ILE  59  -9.492  -3.960  -9.619
    6   HG21  ILE  59          HG21      ILE  59 -12.246  -0.967 -10.609
    7   HG23  ILE  59          HG22      ILE  59 -11.513  -0.772  -9.034
    8   HG22  ILE  59          HG23      ILE  59 -12.483  -2.198  -9.392
    9   HD12  ILE  59          HD11      ILE  59 -10.491  -1.986  -7.577
   10   HD11  ILE  59          HD12      ILE  59  -8.850  -2.016  -8.210
   11   HD13  ILE  59          HD13      ILE  59  -9.450  -3.369  -7.251

  No H/Q in entry =          11
  In of MODEL   65
    1    H    GLU  60           H        GLU  60 -12.714  -1.407 -12.553
    2    HA   GLU  60           HA       GLU  60 -14.920  -2.896 -11.545
    3    HB2  GLU  60           HB2      GLU  60 -15.609  -0.766 -12.025
    4    HB3  GLU  60           HB3      GLU  60 -14.515  -0.610 -13.397
    5    HG2  GLU  60           HG2      GLU  60 -16.950  -0.679 -14.042
    6    HG3  GLU  60           HG3      GLU  60 -15.985  -1.934 -14.793

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLY  61           H        GLY  61 -13.250  -2.891 -14.661
    2    HA3  GLY  61           HA2      GLY  61 -14.996  -5.105 -15.560
    3    HA2  GLY  61           HA3      GLY  61 -14.136  -4.008 -16.634

  No H/Q in entry =           3
  In of MODEL   65
    1    H    ASP  62           H        ASP  62 -12.780  -5.488 -13.758
    2    HA   ASP  62           HA       ASP  62 -10.503  -6.445 -15.174
    3    HB2  ASP  62           HB2      ASP  62 -10.513  -5.702 -12.792
    4    HB3  ASP  62           HB3      ASP  62 -11.449  -7.136 -12.384

  No H/Q in entry =           4
  In of MODEL   65
    1    H    ALA  63           H        ALA  63 -12.895  -7.595 -16.331
    2    HA   ALA  63           HA       ALA  63 -13.376 -10.272 -15.488
    3    HB2  ALA  63           HB1      ALA  63 -13.530  -9.172 -18.316
    4    HB3  ALA  63           HB2      ALA  63 -14.782  -8.908 -17.103
    5    HB1  ALA  63           HB3      ALA  63 -14.425 -10.543 -17.662

  No H/Q in entry =           5
  In of MODEL   65
    1    H    GLY  64           H        GLY  64 -11.096  -8.825 -17.748
    2    HA3  GLY  64           HA2      GLY  64  -9.220  -9.618 -18.796
    3    HA2  GLY  64           HA3      GLY  64  -9.068 -10.721 -17.434

  No H/Q in entry =           3
  In of MODEL   65
    1    H    GLU  65           H        GLU  65  -8.680 -12.692 -18.289
    2    HA   GLU  65           HA       GLU  65  -9.710 -13.499 -20.822
    3    HB2  GLU  65           HB2      GLU  65  -8.319 -15.045 -18.637
    4    HB3  GLU  65           HB3      GLU  65  -8.760 -15.736 -20.199
    5    HG2  GLU  65           HG2      GLU  65  -7.405 -14.073 -21.361
    6    HG3  GLU  65           HG3      GLU  65  -7.026 -13.278 -19.835

  No H/Q in entry =           6
  In of MODEL   65
    1    H    GLY  66           H        GLY  66 -11.037 -15.225 -21.307
    2    HA3  GLY  66           HA2      GLY  66 -13.568 -15.332 -20.619
    3    HA2  GLY  66           HA3      GLY  66 -12.705 -16.808 -21.002

  No H/Q in entry =           3
  In of MODEL   65
    1    H    LYS  67           H        LYS  67 -11.113 -17.026 -18.735
    2    HA   LYS  67           HA       LYS  67 -13.005 -18.163 -16.908
    3    HB2  LYS  67           HB2      LYS  67  -9.993 -18.074 -16.944
    4    HB3  LYS  67           HB3      LYS  67 -10.937 -18.946 -15.728
    5    HG2  LYS  67           HG2      LYS  67 -12.059 -20.233 -17.504
    6    HG3  LYS  67           HG3      LYS  67 -11.139 -19.359 -18.728
    7    HD2  LYS  67           HD2      LYS  67  -9.039 -20.262 -17.808
    8    HD3  LYS  67           HD3      LYS  67  -9.954 -21.128 -16.570
    9    HE2  LYS  67           HE2      LYS  67 -11.147 -22.393 -18.317
   10    HE3  LYS  67           HE3      LYS  67 -10.258 -21.517 -19.564
   11    HZ3  LYS  67           HZ1      LYS  67  -8.289 -22.553 -19.011
   12    HZ2  LYS  67           HZ2      LYS  67  -9.414 -23.807 -18.807
   13    HZ1  LYS  67           HZ3      LYS  67  -8.810 -22.977 -17.455

  No H/Q in entry =          13
  In of MODEL   65
    1    H    MET  68           H        MET  68 -13.140 -17.882 -14.706
    2    HA   MET  68           HA       MET  68 -13.709 -15.422 -13.721
    3    HB2  MET  68           HB2      MET  68 -12.712 -17.862 -12.259
    4    HB3  MET  68           HB3      MET  68 -13.361 -16.441 -11.442
    5    HG2  MET  68           HG2      MET  68 -15.474 -16.680 -12.672
    6    HG3  MET  68           HG3      MET  68 -14.827 -18.077 -13.533
    7    HE1  MET  68           HE1      MET  68 -15.802 -16.396 -10.430
    8    HE3  MET  68           HE2      MET  68 -14.474 -17.134  -9.537
    9    HE2  MET  68           HE3      MET  68 -16.131 -17.633  -9.207

  No H/Q in entry =           9
  In of MODEL   65
    1    H    LYS  69           H        LYS  69 -10.533 -16.343 -14.458
    2    HA   LYS  69           HA       LYS  69  -9.116 -15.119 -12.349
    3    HB2  LYS  69           HB2      LYS  69  -8.135 -16.779 -13.869
    4    HB3  LYS  69           HB3      LYS  69  -8.194 -15.605 -15.186
    5    HG2  LYS  69           HG2      LYS  69  -6.716 -14.095 -13.942
    6    HG3  LYS  69           HG3      LYS  69  -6.702 -15.204 -12.574
    7    HD2  LYS  69           HD2      LYS  69  -5.655 -16.937 -13.991
    8    HD3  LYS  69           HD3      LYS  69  -5.649 -15.814 -15.352
    9    HE2  LYS  69           HE2      LYS  69  -3.455 -15.795 -14.269
   10    HE3  LYS  69           HE3      LYS  69  -4.253 -14.245 -14.018
   11    HZ1  LYS  69           HZ1      LYS  69  -5.091 -15.765 -11.922
   12    HZ3  LYS  69           HZ2      LYS  69  -3.870 -14.586 -11.870
   13    HZ2  LYS  69           HZ3      LYS  69  -3.467 -16.220 -12.101

  No H/Q in entry =          13
  In of MODEL   65
    1    H    VAL  70           H        VAL  70  -7.990 -13.184 -12.112
    2    HA   VAL  70           HA       VAL  70  -9.093 -10.908 -13.632
    3    HB   VAL  70           HB       VAL  70  -8.041  -9.597 -11.728
    4   HG11  VAL  70          HG11      VAL  70 -10.189 -11.673 -11.252
    5   HG13  VAL  70          HG12      VAL  70 -10.402  -9.973 -11.672
    6   HG12  VAL  70          HG13      VAL  70  -9.811 -10.419 -10.072
    7   HG22  VAL  70          HG21      VAL  70  -7.199 -10.731  -9.812
    8   HG21  VAL  70          HG22      VAL  70  -6.492 -11.605 -11.168
    9   HG23  VAL  70          HG23      VAL  70  -7.885 -12.275 -10.319

  No H/Q in entry =           9
  In of MODEL   65
    1    H    SER  71           H        SER  71  -7.674  -9.224 -14.333
    2    HA   SER  71           HA       SER  71  -5.376 -10.084 -15.738
    3    HB2  SER  71           HB2      SER  71  -6.794  -8.051 -16.269
    4    HB3  SER  71           HB3      SER  71  -6.018  -7.247 -14.907
    5    HG   SER  71           HG       SER  71  -5.016  -7.954 -17.395

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LEU  72           H        LEU  72  -3.405 -10.469 -15.037
    2    HA   LEU  72           HA       LEU  72  -2.680 -10.278 -12.326
    3    HB2  LEU  72           HB2      LEU  72  -1.029 -10.717 -14.810
    4    HB3  LEU  72           HB3      LEU  72  -0.375 -10.816 -13.178
    5    HG   LEU  72           HG       LEU  72  -2.761 -12.454 -14.094
    6   HD13  LEU  72          HD11      LEU  72  -1.209 -14.313 -14.409
    7   HD12  LEU  72          HD12      LEU  72   0.149 -13.294 -13.937
    8   HD11  LEU  72          HD13      LEU  72  -0.718 -12.967 -15.437
    9   HD23  LEU  72          HD21      LEU  72  -1.798 -13.912 -12.153
   10   HD22  LEU  72          HD22      LEU  72  -2.715 -12.478 -11.717
   11   HD21  LEU  72          HD23      LEU  72  -0.955 -12.446 -11.670

  No H/Q in entry =          11
  In of MODEL   65
    1    H    VAL  73           H        VAL  73  -1.934  -8.261 -15.098
    2    HA   VAL  73           HA       VAL  73   0.014  -6.598 -13.989
    3    HB   VAL  73           HB       VAL  73  -0.311  -5.204 -15.852
    4   HG12  VAL  73          HG11      VAL  73  -1.365  -7.896 -16.754
    5   HG11  VAL  73          HG12      VAL  73   0.322  -7.610 -16.332
    6   HG13  VAL  73          HG13      VAL  73  -0.405  -6.752 -17.690
    7   HG23  VAL  73          HG21      VAL  73  -2.471  -5.401 -17.206
    8   HG22  VAL  73          HG22      VAL  73  -2.617  -4.608 -15.639
    9   HG21  VAL  73          HG23      VAL  73  -3.140  -6.282 -15.832

  No H/Q in entry =           9
  In of MODEL   65
    1    H    LEU  74           H        LEU  74  -3.384  -6.662 -13.429
    2    HA   LEU  74           HA       LEU  74  -3.960  -3.999 -12.805
    3    HB2  LEU  74           HB2      LEU  74  -5.715  -5.637 -12.985
    4    HB3  LEU  74           HB3      LEU  74  -5.038  -6.576 -11.657
    5    HG   LEU  74           HG       LEU  74  -5.440  -4.641 -10.129
    6   HD12  LEU  74          HD11      LEU  74  -7.122  -2.939 -11.095
    7   HD11  LEU  74          HD12      LEU  74  -6.582  -3.491 -12.679
    8   HD13  LEU  74          HD13      LEU  74  -5.433  -2.749 -11.564
    9   HD23  LEU  74          HD21      LEU  74  -8.007  -5.253 -11.530
   10   HD22  LEU  74          HD22      LEU  74  -7.642  -5.198  -9.820
   11   HD21  LEU  74          HD23      LEU  74  -7.099  -6.557 -10.774

  No H/Q in entry =          11
  In of MODEL   65
    1    H    VAL  75           H        VAL  75  -2.959  -6.611 -10.655
    2    HA   VAL  75           HA       VAL  75  -2.734  -5.073  -8.305
    3    HB   VAL  75           HB       VAL  75  -1.269  -7.585  -9.103
    4   HG12  VAL  75          HG11      VAL  75  -0.844  -7.757  -6.619
    5   HG11  VAL  75          HG12      VAL  75  -1.480  -6.127  -6.443
    6   HG13  VAL  75          HG13      VAL  75  -0.009  -6.397  -7.363
    7   HG22  VAL  75          HG21      VAL  75  -2.953  -8.643  -7.657
    8   HG21  VAL  75          HG22      VAL  75  -3.756  -7.724  -8.930
    9   HG23  VAL  75          HG23      VAL  75  -3.661  -7.069  -7.295

  No H/Q in entry =           9
  In of MODEL   65
    1    H    GLU  76           H        GLU  76  -0.339  -5.861 -10.846
    2    HA   GLU  76           HA       GLU  76   1.868  -4.554  -9.684
    3    HB2  GLU  76           HB2      GLU  76   2.058  -6.021 -11.668
    4    HB3  GLU  76           HB3      GLU  76   1.148  -4.860 -12.622
    5    HG2  GLU  76           HG2      GLU  76   3.477  -4.527 -13.135
    6    HG3  GLU  76           HG3      GLU  76   2.981  -3.161 -12.154

  No H/Q in entry =           6
  In of MODEL   65
    1    H    ALA  77           H        ALA  77  -0.645  -3.303 -11.866
    2    HA   ALA  77           HA       ALA  77   0.387  -0.672 -12.031
    3    HB3  ALA  77           HB1      ALA  77  -2.539  -1.417 -12.197
    4    HB1  ALA  77           HB2      ALA  77  -1.400  -1.733 -13.506
    5    HB2  ALA  77           HB3      ALA  77  -1.714  -0.076 -12.992

  No H/Q in entry =           5
  In of MODEL   65
    1    H    GLN  78           H        GLN  78  -1.905  -2.201  -9.825
    2    HA   GLN  78           HA       GLN  78  -2.674   0.124  -8.414
    3    HB2  GLN  78           HB2      GLN  78  -3.819  -2.119  -8.338
    4    HB3  GLN  78           HB3      GLN  78  -2.492  -2.703  -7.338
    5    HG2  GLN  78           HG2      GLN  78  -2.981  -0.972  -5.664
    6    HG3  GLN  78           HG3      GLN  78  -4.304  -0.370  -6.663
    7   HE21  GLN  78          HE21      GLN  78  -4.812  -1.344  -4.025
    8   HE22  GLN  78          HE22      GLN  78  -5.699  -2.786  -4.146

  No H/Q in entry =           8
  In of MODEL   65
    1    H    LEU  79           H        LEU  79  -0.031  -2.175  -7.974
    2    HA   LEU  79           HA       LEU  79   0.960  -1.304  -5.514
    3    HB2  LEU  79           HB2      LEU  79   1.799  -3.321  -6.591
    4    HB3  LEU  79           HB3      LEU  79   2.458  -2.374  -7.920
    5    HG   LEU  79           HG       LEU  79   4.032  -1.265  -6.413
    6   HD13  LEU  79          HD11      LEU  79   3.032  -1.013  -4.344
    7   HD12  LEU  79          HD12      LEU  79   4.090  -2.381  -4.006
    8   HD11  LEU  79          HD13      LEU  79   2.380  -2.653  -4.337
    9   HD23  LEU  79          HD21      LEU  79   5.210  -3.435  -5.519
   10   HD22  LEU  79          HD22      LEU  79   5.009  -3.225  -7.256
   11   HD21  LEU  79          HD23      LEU  79   3.915  -4.283  -6.368

  No H/Q in entry =          11
  In of MODEL   65
    1    H    HIS  80           H        HIS  80   1.845  -0.186  -8.782
    2    HA   HIS  80           HA       HIS  80   3.683   1.770  -7.852
    3    HB2  HIS  80           HB2      HIS  80   2.382   1.106 -10.438
    4    HB3  HIS  80           HB3      HIS  80   3.001   2.748 -10.260
    5    HD1  HIS  80           HD1      HIS  80   5.407   3.016 -10.782
    6    HD2  HIS  80           HD2      HIS  80   4.531  -0.888  -9.607
    7    HE1  HIS  80           HE1      HIS  80   7.578   1.708 -10.954
    8    HE2  HIS  80           HE2      HIS  80   7.055  -0.675 -10.241

  No H/Q in entry =           8
  In of MODEL   65
    1    H    LEU  81           H        LEU  81   0.281   1.984  -8.830
    2    HA   LEU  81           HA       LEU  81   0.046   4.779  -8.487
    3    HB2  LEU  81           HB2      LEU  81  -2.000   2.562  -8.417
    4    HB3  LEU  81           HB3      LEU  81  -2.428   4.271  -8.318
    5    HG   LEU  81           HG       LEU  81  -0.752   3.107 -10.559
    6   HD12  LEU  81          HD11      LEU  81  -2.980   3.463 -11.856
    7   HD11  LEU  81          HD12      LEU  81  -3.736   3.399 -10.265
    8   HD13  LEU  81          HD13      LEU  81  -2.813   2.021 -10.858
    9   HD23  LEU  81          HD21      LEU  81  -1.819   5.271 -11.647
   10   HD22  LEU  81          HD22      LEU  81  -0.400   5.417 -10.613
   11   HD21  LEU  81          HD23      LEU  81  -2.000   5.785  -9.971

  No H/Q in entry =          11
  In of MODEL   65
    1    H    MET  82           H        MET  82  -0.650   2.091  -6.250
    2    HA   MET  82           HA       MET  82  -1.680   3.683  -4.156
    3    HB2  MET  82           HB2      MET  82  -0.343   0.977  -4.207
    4    HB3  MET  82           HB3      MET  82  -0.911   1.704  -2.706
    5    HG2  MET  82           HG2      MET  82  -2.651   1.245  -5.149
    6    HG3  MET  82           HG3      MET  82  -2.588   0.164  -3.758
    7    HE3  MET  82           HE1      MET  82  -4.287   1.825  -0.935
    8    HE2  MET  82           HE2      MET  82  -2.553   2.080  -1.119
    9    HE1  MET  82           HE3      MET  82  -3.263   0.534  -1.580

  No H/Q in entry =           9
  In of MODEL   65
    1    H    THR  83           H        THR  83   1.606   2.555  -4.851
    2    HA   THR  83           HA       THR  83   2.839   3.632  -2.546
    3    HB   THR  83           HB       THR  83   4.932   3.555  -4.020
    4    HG1  THR  83           HG1      THR  83   4.685   3.041  -6.046
    5   HG22  THR  83          HG21      THR  83   4.452   0.905  -4.364
    6   HG21  THR  83          HG22      THR  83   3.168   1.297  -3.222
    7   HG23  THR  83          HG23      THR  83   4.852   1.615  -2.801

  No H/Q in entry =           7
  In of MODEL   65
    1    H    SER  84           H        SER  84   2.485   4.931  -5.840
    2    HA   SER  84           HA       SER  84   3.857   7.351  -5.374
    3    HB2  SER  84           HB2      SER  84   1.776   6.556  -7.397
    4    HB3  SER  84           HB3      SER  84   2.476   8.174  -7.365
    5    HG   SER  84           HG       SER  84   3.815   5.682  -7.667

  No H/Q in entry =           5
  In of MODEL   65
    1    H    MET  85           H        MET  85   0.353   6.642  -5.205
    2    HA   MET  85           HA       MET  85  -0.472   9.261  -4.592
    3    HB2  MET  85           HB2      MET  85  -2.019   7.476  -5.269
    4    HB3  MET  85           HB3      MET  85  -1.741   6.659  -3.731
    5    HG2  MET  85           HG2      MET  85  -2.611   8.615  -2.517
    6    HG3  MET  85           HG3      MET  85  -2.851   9.464  -4.043
    7    HE2  MET  85           HE1      MET  85  -5.137   5.989  -2.232
    8    HE1  MET  85           HE2      MET  85  -3.512   6.569  -1.872
    9    HE3  MET  85           HE3      MET  85  -3.770   5.483  -3.233

  No H/Q in entry =           9
  In of MODEL   65
    1    H    LEU  86           H        LEU  86   0.411   6.576  -2.461
    2    HA   LEU  86           HA       LEU  86  -0.103   7.875  -0.013
    3    HB2  LEU  86           HB2      LEU  86   0.326   5.400  -0.418
    4    HB3  LEU  86           HB3      LEU  86   2.039   5.806  -0.512
    5    HG   LEU  86           HG       LEU  86   1.731   6.961   1.762
    6   HD11  LEU  86          HD11      LEU  86  -0.974   6.235   1.288
    7   HD13  LEU  86          HD12      LEU  86  -0.297   6.966   2.742
    8   HD12  LEU  86          HD13      LEU  86  -0.413   5.212   2.615
    9   HD23  LEU  86          HD21      LEU  86   1.259   3.974   1.870
   10   HD22  LEU  86          HD22      LEU  86   2.276   4.964   2.915
   11   HD21  LEU  86          HD23      LEU  86   2.772   4.640   1.254

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ALA  87           H        ALA  87   2.873   7.546  -1.904
    2    HA   ALA  87           HA       ALA  87   4.599   8.923  -0.173
    3    HB3  ALA  87           HB1      ALA  87   4.679   7.922  -2.885
    4    HB2  ALA  87           HB2      ALA  87   6.018   8.227  -1.783
    5    HB1  ALA  87           HB3      ALA  87   5.423   9.521  -2.821

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ARG  88           H        ARG  88   2.669  10.101  -2.888
    2    HA   ARG  88           HA       ARG  88   3.484  12.778  -2.758
    3    HB2  ARG  88           HB2      ARG  88   2.212  11.653  -4.620
    4    HB3  ARG  88           HB3      ARG  88   0.757  11.814  -3.636
    5    HG2  ARG  88           HG2      ARG  88   1.816  14.378  -3.541
    6    HG3  ARG  88           HG3      ARG  88   2.232  13.866  -5.174
    7    HD2  ARG  88           HD2      ARG  88   0.092  13.982  -5.870
    8    HD3  ARG  88           HD3      ARG  88  -0.508  13.131  -4.446
    9    HE   ARG  88           HE       ARG  88  -0.654  15.914  -4.850
   10   HH21  ARG  88          HH11      ARG  88  -1.160  17.243  -3.106
   11   HH22  ARG  88          HH12      ARG  88  -0.871  16.693  -1.491
   12   HH11  ARG  88          HH21      ARG  88   0.327  13.624  -2.488
   13   HH12  ARG  88          HH22      ARG  88  -0.047  14.639  -1.141

  No H/Q in entry =          13
  In of MODEL   65
    1    H    GLU  89           H        GLU  89   0.755  11.138  -1.125
    2    HA   GLU  89           HA       GLU  89  -0.315  13.462   0.092
    3    HB2  GLU  89           HB2      GLU  89  -1.468  11.241  -0.005
    4    HB3  GLU  89           HB3      GLU  89  -0.353  10.662   1.232
    5    HG2  GLU  89           HG2      GLU  89  -1.145  12.365   2.800
    6    HG3  GLU  89           HG3      GLU  89  -2.187  13.059   1.561

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LEU  90           H        LEU  90   2.100  11.124   1.253
    2    HA   LEU  90           HA       LEU  90   2.477  12.350   3.789
    3    HB2  LEU  90           HB2      LEU  90   4.220  10.556   2.102
    4    HB3  LEU  90           HB3      LEU  90   4.649  11.057   3.743
    5    HG   LEU  90           HG       LEU  90   1.992   9.758   3.076
    6   HD12  LEU  90          HD11      LEU  90   3.099   7.689   4.074
    7   HD11  LEU  90          HD12      LEU  90   4.635   8.521   3.835
    8   HD13  LEU  90          HD13      LEU  90   3.615   8.137   2.447
    9   HD22  LEU  90          HD21      LEU  90   1.744  10.675   5.203
   10   HD21  LEU  90          HD22      LEU  90   3.460  10.538   5.584
   11   HD23  LEU  90          HD23      LEU  90   2.429   9.107   5.625

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  91           H        ILE  91   4.085  12.722   0.663
    2    HA   ILE  91           HA       ILE  91   6.093  14.515   1.510
    3    HB   ILE  91           HB       ILE  91   4.772  14.060  -1.171
    4   HG12  ILE  91          HG12      ILE  91   7.596  13.520  -0.202
    5   HG13  ILE  91          HG13      ILE  91   6.294  12.344  -0.044
    6   HG22  ILE  91          HG21      ILE  91   7.017  15.373  -1.855
    7   HG21  ILE  91          HG22      ILE  91   6.721  16.171  -0.309
    8   HG23  ILE  91          HG23      ILE  91   5.498  16.227  -1.577
    9   HD13  ILE  91          HD11      ILE  91   6.114  12.035  -2.353
   10   HD12  ILE  91          HD12      ILE  91   7.852  12.247  -2.139
   11   HD11  ILE  91          HD13      ILE  91   6.865  13.590  -2.718

  No H/Q in entry =          11
  In of MODEL   65
    1    H    THR  92           H        THR  92   2.738  15.010   0.507
    2    HA   THR  92           HA       THR  92   2.760  17.834   0.460
    3    HB   THR  92           HB       THR  92   0.559  15.873   1.151
    4    HG1  THR  92           HG1      THR  92   0.860  15.700  -0.935
    5   HG22  THR  92          HG21      THR  92  -0.805  18.062   0.441
    6   HG21  THR  92          HG22      THR  92   0.602  18.860   1.141
    7   HG23  THR  92          HG23      THR  92  -0.358  17.750   2.118

  No H/Q in entry =           7
  In of MODEL   65
    1    H    GLU  93           H        GLU  93   2.174  15.530   3.103
    2    HA   GLU  93           HA       GLU  93   1.676  17.432   5.132
    3    HB2  GLU  93           HB2      GLU  93   2.942  14.684   5.353
    4    HB3  GLU  93           HB3      GLU  93   2.268  15.616   6.691
    5    HG2  GLU  93           HG2      GLU  93   0.641  14.879   4.249
    6    HG3  GLU  93           HG3      GLU  93   0.726  13.847   5.672

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LEU  94           H        LEU  94   4.656  15.904   3.972
    2    HA   LEU  94           HA       LEU  94   6.427  17.011   5.865
    3    HB2  LEU  94           HB2      LEU  94   6.810  16.052   3.029
    4    HB3  LEU  94           HB3      LEU  94   8.152  16.681   3.981
    5    HG   LEU  94           HG       LEU  94   6.375  14.511   5.106
    6   HD11  LEU  94          HD11      LEU  94   8.465  14.259   2.972
    7   HD13  LEU  94          HD12      LEU  94   7.002  13.309   3.229
    8   HD12  LEU  94          HD13      LEU  94   8.424  13.026   4.234
    9   HD23  LEU  94          HD21      LEU  94   8.556  13.930   6.254
   10   HD22  LEU  94          HD22      LEU  94   7.916  15.517   6.679
   11   HD21  LEU  94          HD23      LEU  94   9.252  15.379   5.535

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  95           H        ILE  95   5.307  18.219   2.722
    2    HA   ILE  95           HA       ILE  95   6.920  20.549   2.673
    3    HB   ILE  95           HB       ILE  95   4.263  19.918   1.366
    4   HG12  ILE  95          HG12      ILE  95   7.057  20.212   0.229
    5   HG13  ILE  95          HG13      ILE  95   6.381  18.668   0.736
    6   HG21  ILE  95          HG21      ILE  95   6.055  22.355   1.157
    7   HG23  ILE  95          HG22      ILE  95   4.330  22.316   1.514
    8   HG22  ILE  95          HG23      ILE  95   4.905  21.913  -0.104
    9   HD13  ILE  95          HD11      ILE  95   4.819  18.628  -0.992
   10   HD12  ILE  95          HD12      ILE  95   6.181  19.426  -1.777
   11   HD11  ILE  95          HD13      ILE  95   4.826  20.382  -1.179

  No H/Q in entry =          11
  In of MODEL   65
    1    H    GLU  96           H        GLU  96   3.661  19.947   3.967
    2    HA   GLU  96           HA       GLU  96   3.087  22.600   4.732
    3    HB2  GLU  96           HB2      GLU  96   1.382  20.847   4.736
    4    HB3  GLU  96           HB3      GLU  96   2.229  19.998   6.026
    5    HG2  GLU  96           HG2      GLU  96   1.233  21.291   7.603
    6    HG3  GLU  96           HG3      GLU  96   1.793  22.759   6.813

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LEU  97           H        LEU  97   4.886  20.009   6.343
    2    HA   LEU  97           HA       LEU  97   5.268  21.339   8.820
    3    HB2  LEU  97           HB2      LEU  97   6.766  19.150   7.394
    4    HB3  LEU  97           HB3      LEU  97   7.369  19.817   8.909
    5    HG   LEU  97           HG       LEU  97   4.540  18.775   8.595
    6   HD12  LEU  97          HD11      LEU  97   5.445  16.740   9.797
    7   HD11  LEU  97          HD12      LEU  97   7.067  17.344   9.455
    8   HD13  LEU  97          HD13      LEU  97   5.988  16.912   8.128
    9   HD23  LEU  97          HD21      LEU  97   4.989  18.460  11.158
   10   HD22  LEU  97          HD22      LEU  97   4.637  20.081  10.561
   11   HD21  LEU  97          HD23      LEU  97   6.301  19.610  10.903

  No H/Q in entry =          11
  In of MODEL   65
    1    H    HIS  98           H        HIS  98   7.137  21.337   5.794
    2    HA   HIS  98           HA       HIS  98   9.319  22.873   6.700
    3    HB2  HIS  98           HB2      HIS  98   8.020  22.655   3.973
    4    HB3  HIS  98           HB3      HIS  98   9.478  23.606   4.268
    5    HD1  HIS  98           HD1      HIS  98   8.203  20.058   4.270
    6    HD2  HIS  98           HD2      HIS  98  11.821  22.087   4.703
    7    HE1  HIS  98           HE1      HIS  98  10.026  18.295   4.203
    8    HE2  HIS  98           HE2      HIS  98  12.233  19.510   4.467

  No H/Q in entry =           8
  In of MODEL   65
    1    H    GLU  99           H        GLU  99   6.114  23.772   5.531
    2    HA   GLU  99           HA       GLU  99   6.544  26.580   5.487
    3    HB2  GLU  99           HB2      GLU  99   4.643  25.451   4.351
    4    HB3  GLU  99           HB3      GLU  99   3.941  25.094   5.929
    5    HG2  GLU  99           HG2      GLU  99   3.805  27.486   6.442
    6    HG3  GLU  99           HG3      GLU  99   4.587  27.880   4.915

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LYS 100           H        LYS 100   5.374  24.353   7.998
    2    HA   LYS 100           HA       LYS 100   4.826  26.407   9.903
    3    HB2  LYS 100           HB2      LYS 100   5.347  23.444  10.233
    4    HB3  LYS 100           HB3      LYS 100   4.920  24.518  11.571
    5    HG2  LYS 100           HG2      LYS 100   2.866  25.200  10.328
    6    HG3  LYS 100           HG3      LYS 100   3.271  24.030   9.069
    7    HD2  LYS 100           HD2      LYS 100   3.160  22.202  10.721
    8    HD3  LYS 100           HD3      LYS 100   2.772  23.366  11.991
    9    HE2  LYS 100           HE2      LYS 100   0.731  24.031  10.732
   10    HE3  LYS 100           HE3      LYS 100   1.107  22.811   9.510
   11    HZ1  LYS 100           HZ1      LYS 100   0.831  22.134  12.387
   12    HZ3  LYS 100           HZ2      LYS 100   0.795  21.087  11.047
   13    HZ2  LYS 100           HZ3      LYS 100  -0.501  22.149  11.333

  No H/Q in entry =          13
  In of MODEL   65
    1    H    LEU 101           H        LEU 101   7.715  24.562   9.058
    2    HA   LEU 101           HA       LEU 101   9.330  25.361  11.265
    3    HB2  LEU 101           HB2      LEU 101   9.905  24.378   8.481
    4    HB3  LEU 101           HB3      LEU 101  11.219  25.014   9.465
    5    HG   LEU 101           HG       LEU 101   9.348  22.887  10.519
    6   HD12  LEU 101          HD11      LEU 101  11.374  21.357   9.902
    7   HD11  LEU 101          HD12      LEU 101  11.764  22.619   8.735
    8   HD13  LEU 101          HD13      LEU 101  10.219  21.775   8.638
    9   HD21  LEU 101          HD21      LEU 101  12.093  23.940  11.251
   10   HD23  LEU 101          HD22      LEU 101  11.521  22.375  11.823
   11   HD22  LEU 101          HD23      LEU 101  10.656  23.845  12.269

  No H/Q in entry =          11
  In of MODEL   65
    1    H    LYS 102           H        LYS 102   7.781  27.265   9.134
    2    HA   LYS 102           HA       LYS 102   7.901  29.558   8.854
    3    HB2  LYS 102           HB2      LYS 102   9.465  29.402  10.951
    4    HB3  LYS 102           HB3      LYS 102  10.767  29.578   9.792
    5    HG2  LYS 102           HG2      LYS 102   8.699  31.566  10.665
    6    HG3  LYS 102           HG3      LYS 102  10.416  31.795  10.414
    7    HD2  LYS 102           HD2      LYS 102   8.456  31.421   8.113
    8    HD3  LYS 102           HD3      LYS 102   8.869  32.989   8.789
    9    HE2  LYS 102           HE2      LYS 102  10.218  31.790   6.709
   10    HE3  LYS 102           HE3      LYS 102  10.860  33.079   7.727
   11    HZ2  LYS 102           HZ1      LYS 102  12.344  31.147   7.541
   12    HZ1  LYS 102           HZ2      LYS 102  11.164  30.183   8.279
   13    HZ3  LYS 102           HZ3      LYS 102  11.881  31.452   9.144

  No H/Q in entry =          13
  In of MODEL   65
    1    H    ALA 103           H        ALA 103  11.132  28.160   8.281
    2    HA   ALA 103           HA       ALA 103  12.121  29.529   6.212
    3    HB2  ALA 103           HB1      ALA 103  12.963  27.303   5.272
    4    HB1  ALA 103           HB2      ALA 103  12.055  26.540   6.574
    5    HB3  ALA 103           HB3      ALA 103  13.366  27.657   6.953

  No H/Q in entry =           5
  In of MODEL   65
    1    H1   LYS   3           H1       LYS   3 -31.697   5.150 -19.895
    2    H2   LYS   3           H3       LYS   3 -30.691   4.891 -21.237
    3    H3   LYS   3           H2       LYS   3 -32.035   3.887 -20.977
    4    HA   LYS   3           HA       LYS   3 -30.965   2.578 -19.546
    5    HB2  LYS   3           HB2      LYS   3 -28.757   4.084 -20.899
    6    HB3  LYS   3           HB3      LYS   3 -28.373   2.916 -19.634
    7    HG2  LYS   3           HG2      LYS   3 -29.706   1.234 -20.959
    8    HG3  LYS   3           HG3      LYS   3 -29.720   2.413 -22.271
    9    HD2  LYS   3           HD2      LYS   3 -27.234   2.431 -22.213
   10    HD3  LYS   3           HD3      LYS   3 -27.289   1.149 -21.004
   11    HE2  LYS   3           HE2      LYS   3 -28.718  -0.133 -22.702
   12    HE3  LYS   3           HE3      LYS   3 -28.157   1.055 -23.878
   13    HZ3  LYS   3           HZ1      LYS   3 -26.297  -0.081 -24.122
   14    HZ2  LYS   3           HZ2      LYS   3 -26.868  -1.263 -23.043
   15    HZ1  LYS   3           HZ3      LYS   3 -25.946   0.041 -22.464

  No H/Q in entry =          15
  In of MODEL   65
    1    H    LYS   4           H        LYS   4 -31.018   2.469 -17.483
    2    HA   LYS   4           HA       LYS   4 -30.412   4.818 -15.871
    3    HB2  LYS   4           HB2      LYS   4 -31.474   2.079 -15.128
    4    HB3  LYS   4           HB3      LYS   4 -31.325   3.446 -14.024
    5    HG2  LYS   4           HG2      LYS   4 -33.121   3.249 -16.449
    6    HG3  LYS   4           HG3      LYS   4 -33.618   3.303 -14.758
    7    HD2  LYS   4           HD2      LYS   4 -33.039   5.563 -14.529
    8    HD3  LYS   4           HD3      LYS   4 -31.993   5.534 -15.949
    9    HE2  LYS   4           HE2      LYS   4 -33.986   6.798 -16.439
   10    HE3  LYS   4           HE3      LYS   4 -33.987   5.307 -17.382
   11    HZ3  LYS   4           HZ1      LYS   4 -35.519   4.342 -15.823
   12    HZ2  LYS   4           HZ2      LYS   4 -36.147   5.797 -16.434
   13    HZ1  LYS   4           HZ3      LYS   4 -35.491   5.747 -14.869

  No H/Q in entry =          13
  In of MODEL   65
    1    H    HIS   5           H        HIS   5 -28.954   5.005 -14.278
    2    HA   HIS   5           HA       HIS   5 -26.580   3.289 -14.574
    3    HB2  HIS   5           HB2      HIS   5 -26.978   6.048 -13.416
    4    HB3  HIS   5           HB3      HIS   5 -25.451   5.170 -13.379
    5    HD1  HIS   5           HD1      HIS   5 -24.038   6.415 -14.986
    6    HD2  HIS   5           HD2      HIS   5 -27.798   5.576 -16.537
    7    HE1  HIS   5           HE1      HIS   5 -23.892   6.960 -17.446
    8    HE2  HIS   5           HE2      HIS   5 -26.185   6.437 -18.361

  No H/Q in entry =           8
  In of MODEL   65
    1    H    ILE   6           H        ILE   6 -26.278   1.753 -13.228
    2    HA   ILE   6           HA       ILE   6 -27.273   2.020 -10.472
    3    HB   ILE   6           HB       ILE   6 -26.322  -0.429 -11.965
    4   HG12  ILE   6          HG12      ILE   6 -29.111   0.385 -11.136
    5   HG13  ILE   6          HG13      ILE   6 -28.473   0.549 -12.771
    6   HG23  ILE   6          HG21      ILE   6 -26.637  -1.666 -10.083
    7   HG22  ILE   6          HG22      ILE   6 -27.853  -0.567  -9.427
    8   HG21  ILE   6          HG23      ILE   6 -26.142  -0.145  -9.339
    9   HD13  ILE   6          HD11      ILE   6 -28.824  -1.597 -13.235
   10   HD12  ILE   6          HD12      ILE   6 -29.843  -1.607 -11.795
   11   HD11  ILE   6          HD13      ILE   6 -28.162  -2.130 -11.689

  No H/Q in entry =          11
  In of MODEL   65
    1    H    TYR   7           H        TYR   7 -25.552   2.769  -9.193
    2    HA   TYR   7           HA       TYR   7 -22.795   1.936  -9.850
    3    HB2  TYR   7           HB2      TYR   7 -23.882   4.344  -8.413
    4    HB3  TYR   7           HB3      TYR   7 -22.174   3.914  -8.439
    5    HD1  TYR   7           HD1      TYR   7 -23.156   2.867 -11.516
    6    HD2  TYR   7           HD2      TYR   7 -22.670   6.506  -9.350
    7    HE1  TYR   7           HE1      TYR   7 -22.779   4.079 -13.626
    8    HE2  TYR   7           HE2      TYR   7 -22.335   7.722 -11.454
    9    HH   TYR   7           HH       TYR   7 -22.542   7.587 -13.685

  No H/Q in entry =           9
  In of MODEL   65
    1    H    LEU   8           H        LEU   8 -21.768   0.656  -8.496
    2    HA   LEU   8           HA       LEU   8 -22.881   0.154  -5.806
    3    HB2  LEU   8           HB2      LEU   8 -21.093  -1.456  -7.607
    4    HB3  LEU   8           HB3      LEU   8 -21.264  -1.816  -5.890
    5    HG   LEU   8           HG       LEU   8 -23.731  -2.118  -6.313
    6   HD13  LEU   8          HD11      LEU   8 -23.916  -0.947  -8.445
    7   HD12  LEU   8          HD12      LEU   8 -24.362  -2.639  -8.657
    8   HD11  LEU   8          HD13      LEU   8 -22.779  -2.071  -9.187
    9   HD23  LEU   8          HD21      LEU   8 -22.354  -4.123  -7.969
   10   HD22  LEU   8          HD22      LEU   8 -23.435  -4.320  -6.590
   11   HD21  LEU   8          HD23      LEU   8 -21.749  -3.878  -6.331

  No H/Q in entry =          11
  In of MODEL   65
    1    H    PHE   9           H        PHE   9 -21.635   0.639  -4.023
    2    HA   PHE   9           HA       PHE   9 -18.894   1.694  -4.536
    3    HB2  PHE   9           HB2      PHE   9 -20.971   2.712  -2.601
    4    HB3  PHE   9           HB3      PHE   9 -19.284   3.204  -2.580
    5    HD1  PHE   9           HD1      PHE   9 -18.338   4.552  -4.377
    6    HD2  PHE   9           HD2      PHE   9 -22.473   3.410  -4.411
    7    HE1  PHE   9           HE1      PHE   9 -18.778   6.199  -6.173
    8    HE2  PHE   9           HE2      PHE   9 -22.916   5.069  -6.203
    9    HZ   PHE   9           HZ       PHE   9 -21.065   6.459  -7.089

  No H/Q in entry =           9
  In of MODEL   65
    1    H    SER  10           H        SER  10 -17.270   0.841  -3.398
    2    HA   SER  10           HA       SER  10 -17.456  -0.028  -0.694
    3    HB2  SER  10           HB2      SER  10 -17.299  -2.364  -0.911
    4    HB3  SER  10           HB3      SER  10 -18.557  -1.918  -2.052
    5    HG   SER  10           HG       SER  10 -16.471  -3.289  -2.594

  No H/Q in entry =           5
  In of MODEL   65
    1    H    SER  11           H        SER  11 -15.448   0.183   0.161
    2    HA   SER  11           HA       SER  11 -13.312   1.164  -1.349
    3    HB2  SER  11           HB2      SER  11 -12.160   1.289   0.636
    4    HB3  SER  11           HB3      SER  11 -13.818   1.170   1.229
    5    HG   SER  11           HG       SER  11 -12.208  -1.110   0.755

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ALA  12           H        ALA  12 -14.353  -1.577  -2.231
    2    HA   ALA  12           HA       ALA  12 -11.708  -2.639  -2.802
    3    HB2  ALA  12           HB1      ALA  12 -11.922  -4.024  -0.974
    4    HB3  ALA  12           HB2      ALA  12 -12.708  -5.013  -2.203
    5    HB1  ALA  12           HB3      ALA  12 -13.683  -4.071  -1.077

  No H/Q in entry =           5
  In of MODEL   65
    1    H    GLY  13           H        GLY  13 -12.511  -1.741  -4.836
    2    HA3  GLY  13           HA2      GLY  13 -14.728  -2.550  -6.285
    3    HA2  GLY  13           HA3      GLY  13 -13.193  -2.065  -7.021

  No H/Q in entry =           3
  In of MODEL   65
    1    H    MET  14           H        MET  14 -11.603  -4.251  -6.046
    2    HA   MET  14           HA       MET  14 -11.948  -6.091  -8.099
    3    HB2  MET  14           HB2      MET  14  -9.875  -5.941  -6.709
    4    HB3  MET  14           HB3      MET  14 -10.706  -6.819  -5.425
    5    HG2  MET  14           HG2      MET  14  -9.635  -8.563  -6.536
    6    HG3  MET  14           HG3      MET  14 -11.183  -8.556  -7.382
    7    HE1  MET  14           HE1      MET  14  -7.763  -9.053  -7.772
    8    HE3  MET  14           HE2      MET  14  -7.448  -7.355  -7.416
    9    HE2  MET  14           HE3      MET  14  -7.079  -7.995  -9.015

  No H/Q in entry =           9
  In of MODEL   65
    1    H    SER  15           H        SER  15 -13.055  -6.534  -4.739
    2    HA   SER  15           HA       SER  15 -14.282  -9.068  -5.314
    3    HB2  SER  15           HB2      SER  15 -13.710  -8.557  -2.990
    4    HB3  SER  15           HB3      SER  15 -14.816  -7.185  -3.001
    5    HG   SER  15           HG       SER  15 -15.515  -9.417  -2.174

  No H/Q in entry =           5
  In of MODEL   65
    1    H    THR  16           H        THR  16 -15.583  -5.754  -5.026
    2    HA   THR  16           HA       THR  16 -18.329  -6.458  -5.550
    3    HB   THR  16           HB       THR  16 -16.951  -3.809  -6.106
    4    HG1  THR  16           HG1      THR  16 -17.646  -3.332  -3.935
    5   HG23  THR  16          HG21      THR  16 -19.156  -2.877  -5.730
    6   HG22  THR  16          HG22      THR  16 -19.796  -4.467  -5.279
    7   HG21  THR  16          HG23      THR  16 -19.285  -4.146  -6.942

  No H/Q in entry =           7
  In of MODEL   65
    1    H    SER  17           H        SER  17 -15.532  -5.776  -7.408
    2    HA   SER  17           HA       SER  17 -16.685  -5.138  -9.925
    3    HB2  SER  17           HB2      SER  17 -13.994  -6.272  -9.154
    4    HB3  SER  17           HB3      SER  17 -14.440  -5.981 -10.835
    5    HG   SER  17           HG       SER  17 -14.842  -3.917  -9.011

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LEU  18           H        LEU  18 -15.966  -8.224  -8.419
    2    HA   LEU  18           HA       LEU  18 -16.466  -9.793 -10.750
    3    HB2  LEU  18           HB2      LEU  18 -15.208 -10.661  -8.830
    4    HB3  LEU  18           HB3      LEU  18 -16.645 -10.514  -7.819
    5    HG   LEU  18           HG       LEU  18 -17.800 -12.178  -9.173
    6   HD12  LEU  18          HD11      LEU  18 -16.242 -13.444 -10.835
    7   HD11  LEU  18          HD12      LEU  18 -15.310 -11.947 -10.834
    8   HD13  LEU  18          HD13      LEU  18 -16.995 -11.937 -11.353
    9   HD22  LEU  18          HD21      LEU  18 -16.560 -14.098  -8.496
   10   HD21  LEU  18          HD22      LEU  18 -16.390 -12.843  -7.266
   11   HD23  LEU  18          HD23      LEU  18 -15.072 -13.155  -8.394

  No H/Q in entry =          11
  In of MODEL   65
    1    H    LEU  19           H        LEU  19 -18.505  -8.638  -8.067
    2    HA   LEU  19           HA       LEU  19 -20.902  -9.958  -8.886
    3    HB2  LEU  19           HB2      LEU  19 -20.686  -9.073  -6.649
    4    HB3  LEU  19           HB3      LEU  19 -20.479  -7.441  -7.283
    5    HG   LEU  19           HG       LEU  19 -22.842  -7.533  -8.091
    6   HD13  LEU  19          HD11      LEU  19 -24.315  -9.239  -7.122
    7   HD12  LEU  19          HD12      LEU  19 -22.918 -10.040  -6.405
    8   HD11  LEU  19          HD13      LEU  19 -23.091  -9.976  -8.158
    9   HD21  LEU  19          HD21      LEU  19 -22.178  -7.781  -5.174
   10   HD23  LEU  19          HD22      LEU  19 -23.785  -7.339  -5.751
   11   HD22  LEU  19          HD23      LEU  19 -22.400  -6.316  -6.131

  No H/Q in entry =          11
  In of MODEL   65
    1    H    VAL  20           H        VAL  20 -19.564  -6.739  -9.633
    2    HA   VAL  20           HA       VAL  20 -21.718  -5.833 -11.227
    3    HB   VAL  20           HB       VAL  20 -18.764  -5.098 -11.432
    4   HG11  VAL  20          HG11      VAL  20 -21.213  -3.845 -12.693
    5   HG13  VAL  20          HG12      VAL  20 -19.794  -4.491 -13.518
    6   HG12  VAL  20          HG13      VAL  20 -19.662  -3.018 -12.557
    7   HG21  VAL  20          HG21      VAL  20 -21.063  -4.028  -9.859
    8   HG23  VAL  20          HG22      VAL  20 -19.745  -2.962 -10.341
    9   HG22  VAL  20          HG23      VAL  20 -19.412  -4.377  -9.342

  No H/Q in entry =           9
  In of MODEL   65
    1    H    SER  21           H        SER  21 -18.857  -7.760 -12.209
    2    HA   SER  21           HA       SER  21 -19.635  -7.737 -14.964
    3    HB2  SER  21           HB2      SER  21 -18.102  -9.636 -15.255
    4    HB3  SER  21           HB3      SER  21 -17.339  -8.332 -14.349
    5    HG   SER  21           HG       SER  21 -17.516  -9.477 -12.517

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LYS  22           H        LYS  22 -20.600  -9.927 -12.357
    2    HA   LYS  22           HA       LYS  22 -22.048 -11.653 -14.154
    3    HB2  LYS  22           HB2      LYS  22 -21.270 -12.332 -11.864
    4    HB3  LYS  22           HB3      LYS  22 -22.521 -11.282 -11.198
    5    HG2  LYS  22           HG2      LYS  22 -23.812 -13.098 -11.187
    6    HG3  LYS  22           HG3      LYS  22 -23.940 -12.863 -12.930
    7    HD2  LYS  22           HD2      LYS  22 -21.794 -14.534 -11.627
    8    HD3  LYS  22           HD3      LYS  22 -23.325 -15.192 -12.203
    9    HE2  LYS  22           HE2      LYS  22 -22.774 -14.312 -14.478
   10    HE3  LYS  22           HE3      LYS  22 -21.193 -13.832 -13.865
   11    HZ3  LYS  22           HZ1      LYS  22 -20.486 -15.835 -14.387
   12    HZ2  LYS  22           HZ2      LYS  22 -22.050 -16.353 -14.801
   13    HZ1  LYS  22           HZ3      LYS  22 -21.508 -16.491 -13.198

  No H/Q in entry =          13
  In of MODEL   65
    1    H    MET  23           H        MET  23 -22.923  -8.738 -12.340
    2    HA   MET  23           HA       MET  23 -25.722  -8.964 -12.854
    3    HB2  MET  23           HB2      MET  23 -23.992  -6.558 -12.316
    4    HB3  MET  23           HB3      MET  23 -25.743  -6.478 -12.504
    5    HG2  MET  23           HG2      MET  23 -26.078  -7.765 -10.512
    6    HG3  MET  23           HG3      MET  23 -24.351  -8.090 -10.373
    7    HE2  MET  23           HE1      MET  23 -26.830  -4.535  -9.257
    8    HE1  MET  23           HE2      MET  23 -27.029  -5.539 -10.692
    9    HE3  MET  23           HE3      MET  23 -26.065  -4.065 -10.777

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ARG  24           H        ARG  24 -23.033  -7.434 -14.655
    2    HA   ARG  24           HA       ARG  24 -24.583  -6.244 -16.680
    3    HB2  ARG  24           HB2      ARG  24 -22.166  -5.718 -16.299
    4    HB3  ARG  24           HB3      ARG  24 -21.749  -7.307 -16.890
    5    HG2  ARG  24           HG2      ARG  24 -22.669  -6.724 -19.146
    6    HG3  ARG  24           HG3      ARG  24 -23.045  -5.095 -18.526
    7    HD2  ARG  24           HD2      ARG  24 -20.631  -4.825 -17.889
    8    HD3  ARG  24           HD3      ARG  24 -20.311  -6.390 -18.625
    9    HE   ARG  24           HE       ARG  24 -21.440  -4.898 -20.614
   10   HH21  ARG  24          HH11      ARG  24 -20.019  -5.168 -22.335
   11   HH22  ARG  24          HH12      ARG  24 -18.337  -4.831 -22.118
   12   HH11  ARG  24          HH21      ARG  24 -18.735  -4.529 -18.614
   13   HH12  ARG  24          HH22      ARG  24 -17.589  -4.445 -19.914

  No H/Q in entry =          13
  In of MODEL   65
    1    H    ALA  25           H        ALA  25 -23.304  -9.518 -16.344
    2    HA   ALA  25           HA       ALA  25 -23.880 -10.423 -18.968
    3    HB1  ALA  25           HB1      ALA  25 -23.092 -12.408 -18.235
    4    HB3  ALA  25           HB2      ALA  25 -24.155 -12.413 -16.828
    5    HB2  ALA  25           HB3      ALA  25 -22.641 -11.512 -16.784

  No H/Q in entry =           5
  In of MODEL   65
    1    H    GLN  26           H        GLN  26 -25.717 -10.498 -15.950
    2    HA   GLN  26           HA       GLN  26 -27.996 -11.828 -16.955
    3    HB2  GLN  26           HB2      GLN  26 -27.577 -10.018 -14.595
    4    HB3  GLN  26           HB3      GLN  26 -29.102 -10.820 -14.940
    5    HG2  GLN  26           HG2      GLN  26 -26.452 -12.144 -14.437
    6    HG3  GLN  26           HG3      GLN  26 -27.821 -12.088 -13.333
    7   HE21  GLN  26          HE21      GLN  26 -26.497 -14.213 -14.569
    8   HE22  GLN  26          HE22      GLN  26 -27.486 -15.322 -15.351

  No H/Q in entry =           8
  In of MODEL   65
    1    H    ALA  27           H        ALA  27 -27.225  -8.383 -16.617
    2    HA   ALA  27           HA       ALA  27 -29.760  -7.423 -17.428
    3    HB1  ALA  27           HB1      ALA  27 -28.019  -6.005 -16.329
    4    HB3  ALA  27           HB2      ALA  27 -28.638  -5.292 -17.819
    5    HB2  ALA  27           HB3      ALA  27 -27.064  -6.086 -17.810

  No H/Q in entry =           5
  In of MODEL   65
    1    H    GLU  28           H        GLU  28 -26.996  -8.547 -19.266
    2    HA   GLU  28           HA       GLU  28 -27.968  -7.594 -21.806
    3    HB2  GLU  28           HB2      GLU  28 -25.562  -8.154 -21.163
    4    HB3  GLU  28           HB3      GLU  28 -26.027  -9.844 -21.339
    5    HG2  GLU  28           HG2      GLU  28 -24.910  -9.047 -23.316
    6    HG3  GLU  28           HG3      GLU  28 -26.590  -9.456 -23.665

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LYS  29           H        LYS  29 -27.995 -10.677 -20.100
    2    HA   LYS  29           HA       LYS  29 -29.218 -12.239 -22.085
    3    HB2  LYS  29           HB2      LYS  29 -28.133 -13.140 -20.061
    4    HB3  LYS  29           HB3      LYS  29 -29.441 -12.478 -19.083
    5    HG2  LYS  29           HG2      LYS  29 -31.031 -13.943 -20.135
    6    HG3  LYS  29           HG3      LYS  29 -29.798 -14.540 -21.244
    7    HD2  LYS  29           HD2      LYS  29 -28.610 -15.623 -19.488
    8    HD3  LYS  29           HD3      LYS  29 -29.560 -14.806 -18.249
    9    HE2  LYS  29           HE2      LYS  29 -30.200 -17.193 -18.576
   10    HE3  LYS  29           HE3      LYS  29 -31.531 -16.066 -18.844
   11    HZ1  LYS  29           HZ1      LYS  29 -30.950 -16.212 -21.267
   12    HZ3  LYS  29           HZ2      LYS  29 -31.606 -17.620 -20.582
   13    HZ2  LYS  29           HZ3      LYS  29 -29.939 -17.518 -20.875

  No H/Q in entry =          13
  In of MODEL   65
    1    H    TYR  30           H        TYR  30 -30.719 -10.163 -19.620
    2    HA   TYR  30           HA       TYR  30 -33.352 -10.756 -20.864
    3    HB2  TYR  30           HB2      TYR  30 -32.766  -9.530 -18.160
    4    HB3  TYR  30           HB3      TYR  30 -34.367  -9.873 -18.815
    5    HD1  TYR  30           HD1      TYR  30 -35.167 -12.209 -18.994
    6    HD2  TYR  30           HD2      TYR  30 -31.378 -11.280 -17.289
    7    HE1  TYR  30           HE1      TYR  30 -34.971 -14.517 -18.161
    8    HE2  TYR  30           HE2      TYR  30 -31.184 -13.574 -16.458
    9    HH   TYR  30           HH       TYR  30 -32.706 -16.027 -17.520

  No H/Q in entry =           9
  In of MODEL   65
    1    H    GLU  31           H        GLU  31 -31.280  -8.677 -21.688
    2    HA   GLU  31           HA       GLU  31 -31.305  -6.532 -22.544
    3    HB2  GLU  31           HB2      GLU  31 -34.160  -7.392 -23.056
    4    HB3  GLU  31           HB3      GLU  31 -33.382  -5.998 -23.804
    5    HG2  GLU  31           HG2      GLU  31 -31.838  -7.383 -24.967
    6    HG3  GLU  31           HG3      GLU  31 -32.338  -8.807 -24.059

  No H/Q in entry =           6
  In of MODEL   65
    1    H    VAL  32           H        VAL  32 -31.520  -6.398 -19.815
    2    HA   VAL  32           HA       VAL  32 -33.484  -4.366 -19.196
    3    HB   VAL  32           HB       VAL  32 -31.054  -5.219 -17.591
    4   HG12  VAL  32          HG11      VAL  32 -32.635  -4.440 -15.715
    5   HG11  VAL  32          HG12      VAL  32 -33.505  -3.597 -16.996
    6   HG13  VAL  32          HG13      VAL  32 -31.817  -3.207 -16.674
    7   HG21  VAL  32          HG21      VAL  32 -32.734  -7.033 -18.259
    8   HG23  VAL  32          HG22      VAL  32 -33.818  -6.238 -17.115
    9   HG22  VAL  32          HG23      VAL  32 -32.270  -6.879 -16.564

  No H/Q in entry =           9
  In of MODEL   65
    1    HA   PRO  33           HA       PRO  33 -30.590  -1.321 -20.905
    2    HB2  PRO  33           HB2      PRO  33 -32.207   0.827 -20.821
    3    HB3  PRO  33           HB3      PRO  33 -32.607  -0.512 -21.897
    4    HG2  PRO  33           HG2      PRO  33 -33.612  -0.001 -19.096
    5    HG3  PRO  33           HG3      PRO  33 -34.559  -0.278 -20.558
    6    HD2  PRO  33           HD2      PRO  33 -34.010  -2.300 -18.858
    7    HD3  PRO  33           HD3      PRO  33 -34.052  -2.571 -20.601

  No H/Q in entry =           7
  In of MODEL   65
    1    H    VAL  34           H        VAL  34 -29.309  -1.773 -18.943
    2    HA   VAL  34           HA       VAL  34 -29.152   0.689 -17.333
    3    HB   VAL  34           HB       VAL  34 -28.508  -0.712 -15.370
    4   HG12  VAL  34          HG11      VAL  34 -30.876  -1.698 -15.058
    5   HG11  VAL  34          HG12      VAL  34 -31.222  -0.978 -16.629
    6   HG13  VAL  34          HG13      VAL  34 -30.724   0.045 -15.282
    7   HG21  VAL  34          HG21      VAL  34 -28.586  -2.776 -17.348
    8   HG23  VAL  34          HG22      VAL  34 -29.629  -3.167 -15.980
    9   HG22  VAL  34          HG23      VAL  34 -27.928  -2.793 -15.710

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ILE  35           H        ILE  35 -27.203   1.234 -16.493
    2    HA   ILE  35           HA       ILE  35 -24.830   0.001 -17.727
    3    HB   ILE  35           HB       ILE  35 -25.376   2.879 -16.962
    4   HG12  ILE  35          HG12      ILE  35 -24.319   1.583 -19.483
    5   HG13  ILE  35          HG13      ILE  35 -25.979   2.126 -19.239
    6   HG21  ILE  35          HG21      ILE  35 -22.740   1.470 -17.239
    7   HG23  ILE  35          HG22      ILE  35 -23.257   2.644 -16.030
    8   HG22  ILE  35          HG23      ILE  35 -22.895   3.171 -17.673
    9   HD11  ILE  35          HD11      ILE  35 -24.690   4.396 -18.666
   10   HD13  ILE  35          HD12      ILE  35 -25.201   3.962 -20.299
   11   HD12  ILE  35          HD13      ILE  35 -23.535   3.683 -19.791

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ILE  36           H        ILE  36 -23.557  -0.937 -16.108
    2    HA   ILE  36           HA       ILE  36 -24.040  -0.300 -13.248
    3    HB   ILE  36           HB       ILE  36 -23.075  -2.975 -14.312
    4   HG12  ILE  36          HG12      ILE  36 -25.922  -2.298 -13.570
    5   HG13  ILE  36          HG13      ILE  36 -25.345  -2.275 -15.236
    6   HG23  ILE  36          HG21      ILE  36 -23.393  -3.788 -12.187
    7   HG22  ILE  36          HG22      ILE  36 -24.584  -2.556 -11.771
    8   HG21  ILE  36          HG23      ILE  36 -22.871  -2.139 -11.841
    9   HD13  ILE  36          HD11      ILE  36 -25.399  -4.498 -15.409
   10   HD12  ILE  36          HD12      ILE  36 -26.476  -4.406 -14.015
   11   HD11  ILE  36          HD13      ILE  36 -24.759  -4.739 -13.784

  No H/Q in entry =          11
  In of MODEL   65
    1    H    GLU  37           H        GLU  37 -22.296   0.434 -12.148
    2    HA   GLU  37           HA       GLU  37 -19.566  -0.242 -13.043
    3    HB2  GLU  37           HB2      GLU  37 -20.608   2.510 -12.393
    4    HB3  GLU  37           HB3      GLU  37 -18.895   2.101 -12.503
    5    HG2  GLU  37           HG2      GLU  37 -19.132   1.609 -14.850
    6    HG3  GLU  37           HG3      GLU  37 -20.865   1.915 -14.762

  No H/Q in entry =           6
  In of MODEL   65
    1    H    ALA  38           H        ALA  38 -18.075  -0.380 -11.352
    2    HA   ALA  38           HA       ALA  38 -19.126  -0.211  -8.588
    3    HB1  ALA  38           HB1      ALA  38 -17.311  -2.082  -9.978
    4    HB3  ALA  38           HB2      ALA  38 -18.353  -2.349  -8.580
    5    HB2  ALA  38           HB3      ALA  38 -16.779  -1.584  -8.372

  No H/Q in entry =           5
  In of MODEL   65
    1    H    PHE  39           H        PHE  39 -17.954   1.083  -7.129
    2    HA   PHE  39           HA       PHE  39 -15.490   2.397  -8.035
    3    HB2  PHE  39           HB2      PHE  39 -17.990   3.769  -7.076
    4    HB3  PHE  39           HB3      PHE  39 -16.403   4.522  -6.943
    5    HD1  PHE  39           HD1      PHE  39 -15.062   4.855  -9.061
    6    HD2  PHE  39           HD2      PHE  39 -19.215   3.893  -9.041
    7    HE1  PHE  39           HE1      PHE  39 -15.258   5.709 -11.380
    8    HE2  PHE  39           HE2      PHE  39 -19.427   4.735 -11.353
    9    HZ   PHE  39           HZ       PHE  39 -17.447   5.616 -12.541

  No H/Q in entry =           9
  In of MODEL   65
    1    HA   PRO  40           HA       PRO  40 -14.531   1.759  -3.734
    2    HB2  PRO  40           HB2      PRO  40 -12.873   3.870  -3.154
    3    HB3  PRO  40           HB3      PRO  40 -12.357   2.548  -4.199
    4    HG2  PRO  40           HG2      PRO  40 -13.519   5.214  -4.992
    5    HG3  PRO  40           HG3      PRO  40 -12.048   4.441  -5.579
    6    HD2  PRO  40           HD2      PRO  40 -14.256   4.213  -6.996
    7    HD3  PRO  40           HD3      PRO  40 -13.226   2.799  -6.776

  No H/Q in entry =           7
  In of MODEL   65
    1    H    GLU  41           H        GLU  41 -15.211   2.735  -1.623
    2    HA   GLU  41           HA       GLU  41 -17.541   4.319  -1.640
    3    HB2  GLU  41           HB2      GLU  41 -17.094   4.515   0.839
    4    HB3  GLU  41           HB3      GLU  41 -17.195   2.871   0.207
    5    HG2  GLU  41           HG2      GLU  41 -15.403   2.746   1.658
    6    HG3  GLU  41           HG3      GLU  41 -14.618   2.994   0.098

  No H/Q in entry =           6
  In of MODEL   65
    1    H    THR  42           H        THR  42 -14.263   5.408  -1.694
    2    HA   THR  42           HA       THR  42 -14.753   7.965  -0.524
    3    HB   THR  42           HB       THR  42 -12.625   8.635  -1.620
    4    HG1  THR  42           HG1      THR  42 -12.949   7.375  -3.527
    5   HG23  THR  42          HG21      THR  42 -11.197   7.104  -0.421
    6   HG22  THR  42          HG22      THR  42 -12.444   5.854  -0.442
    7   HG21  THR  42          HG23      THR  42 -12.673   7.311   0.523

  No H/Q in entry =           7
  In of MODEL   65
    1    H    LEU  43           H        LEU  43 -15.586   6.778  -3.610
    2    HA   LEU  43           HA       LEU  43 -15.980   9.517  -4.624
    3    HB2  LEU  43           HB2      LEU  43 -16.013   6.803  -5.911
    4    HB3  LEU  43           HB3      LEU  43 -16.622   8.240  -6.729
    5    HG   LEU  43           HG       LEU  43 -13.772   7.911  -5.835
    6   HD13  LEU  43          HD11      LEU  43 -13.766   6.355  -7.495
    7   HD12  LEU  43          HD12      LEU  43 -13.641   7.797  -8.502
    8   HD11  LEU  43          HD13      LEU  43 -15.206   7.020  -8.269
    9   HD21  LEU  43          HD21      LEU  43 -15.250   9.899  -7.559
   10   HD23  LEU  43          HD22      LEU  43 -13.492   9.752  -7.553
   11   HD22  LEU  43          HD23      LEU  43 -14.342  10.209  -6.079

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ALA  44           H        ALA  44 -17.835   7.621  -2.749
    2    HA   ALA  44           HA       ALA  44 -20.297   7.330  -4.077
    3    HB2  ALA  44           HB1      ALA  44 -20.109   6.255  -1.962
    4    HB3  ALA  44           HB2      ALA  44 -21.286   7.545  -1.714
    5    HB1  ALA  44           HB3      ALA  44 -19.625   7.749  -1.159

  No H/Q in entry =           5
  In of MODEL   65
    1    H    GLY  45           H        GLY  45 -19.032  10.226  -2.584
    2    HA3  GLY  45           HA2      GLY  45 -21.543  11.589  -2.976
    3    HA2  GLY  45           HA3      GLY  45 -20.036  12.303  -2.404

  No H/Q in entry =           3
  In of MODEL   65
    1    H    GLU  46           H        GLU  46 -18.449  11.413  -4.675
    2    HA   GLU  46           HA       GLU  46 -19.194  13.563  -6.480
    3    HB2  GLU  46           HB2      GLU  46 -16.843  13.161  -5.818
    4    HB3  GLU  46           HB3      GLU  46 -16.912  11.584  -6.606
    5    HG2  GLU  46           HG2      GLU  46 -17.243  12.652  -8.760
    6    HG3  GLU  46           HG3      GLU  46 -17.236  14.239  -7.990

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LYS  47           H        LYS  47 -18.888  10.050  -6.860
    2    HA   LYS  47           HA       LYS  47 -19.985  10.169  -9.542
    3    HB2  LYS  47           HB2      LYS  47 -19.347   7.815  -7.756
    4    HB3  LYS  47           HB3      LYS  47 -19.827   7.710  -9.450
    5    HG2  LYS  47           HG2      LYS  47 -17.409   9.257  -8.619
    6    HG3  LYS  47           HG3      LYS  47 -17.343   7.512  -8.863
    7    HD2  LYS  47           HD2      LYS  47 -18.029   7.718 -11.130
    8    HD3  LYS  47           HD3      LYS  47 -18.433   9.421 -10.917
    9    HE2  LYS  47           HE2      LYS  47 -16.324   9.181 -12.097
   10    HE3  LYS  47           HE3      LYS  47 -16.072   9.926 -10.519
   11    HZ2  LYS  47           HZ1      LYS  47 -15.083   7.456 -11.544
   12    HZ1  LYS  47           HZ2      LYS  47 -15.851   7.260 -10.042
   13    HZ3  LYS  47           HZ3      LYS  47 -14.565   8.359 -10.201

  No H/Q in entry =          13
  In of MODEL   65
    1    H    GLY  48           H        GLY  48 -21.280   9.394  -6.386
    2    HA3  GLY  48           HA2      GLY  48 -23.596   8.073  -7.116
    3    HA2  GLY  48           HA3      GLY  48 -23.428   9.100  -5.692

  No H/Q in entry =           3
  In of MODEL   65
    1    H    GLN  49           H        GLN  49 -22.968  11.525  -7.299
    2    HA   GLN  49           HA       GLN  49 -25.581  12.498  -7.469
    3    HB2  GLN  49           HB2      GLN  49 -23.081  13.473  -8.835
    4    HB3  GLN  49           HB3      GLN  49 -24.592  14.362  -8.771
    5    HG2  GLN  49           HG2      GLN  49 -24.444  14.432  -6.334
    6    HG3  GLN  49           HG3      GLN  49 -22.944  13.522  -6.397
    7   HE21  GLN  49          HE21      GLN  49 -22.950  15.774  -5.160
    8   HE22  GLN  49          HE22      GLN  49 -22.090  17.065  -5.824

  No H/Q in entry =           8
  In of MODEL   65
    1    H    ASN  50           H        ASN  50 -23.797  10.672  -9.821
    2    HA   ASN  50           HA       ASN  50 -25.714  11.411 -11.923
    3    HB2  ASN  50           HB2      ASN  50 -23.056  10.005 -12.124
    4    HB3  ASN  50           HB3      ASN  50 -24.122  10.354 -13.476
    5   HD21  ASN  50          HD21      ASN  50 -21.540  11.362 -11.872
    6   HD22  ASN  50          HD22      ASN  50 -21.391  13.001 -12.240

  No H/Q in entry =           6
  In of MODEL   65
    1    H    ALA  51           H        ALA  51 -25.586   9.095  -9.640
    2    HA   ALA  51           HA       ALA  51 -26.251   6.883 -11.434
    3    HB2  ALA  51           HB1      ALA  51 -25.604   5.593  -9.724
    4    HB3  ALA  51           HB2      ALA  51 -26.771   6.359  -8.648
    5    HB1  ALA  51           HB3      ALA  51 -25.167   7.061  -8.850

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ASP  52           H        ASP  52 -28.199   5.728 -11.283
    2    HA   ASP  52           HA       ASP  52 -30.474   7.456 -10.655
    3    HB2  ASP  52           HB2      ASP  52 -30.148   4.938 -12.283
    4    HB3  ASP  52           HB3      ASP  52 -31.730   5.597 -11.866

  No H/Q in entry =           4
  In of MODEL   65
    1    H    VAL  53           H        VAL  53 -28.732   4.669  -9.587
    2    HA   VAL  53           HA       VAL  53 -30.185   4.763  -7.078
    3    HB   VAL  53           HB       VAL  53 -31.494   3.031  -8.300
    4   HG11  VAL  53          HG11      VAL  53 -29.699   2.238  -9.803
    5   HG13  VAL  53          HG12      VAL  53 -30.469   0.916  -8.925
    6   HG12  VAL  53          HG13      VAL  53 -28.888   1.508  -8.418
    7   HG23  VAL  53          HG21      VAL  53 -30.579   1.126  -6.574
    8   HG22  VAL  53          HG22      VAL  53 -31.774   2.376  -6.232
    9   HG21  VAL  53          HG23      VAL  53 -30.080   2.642  -5.821

  No H/Q in entry =           9
  In of MODEL   65
    1    H    VAL  54           H        VAL  54 -28.859   4.423  -5.412
    2    HA   VAL  54           HA       VAL  54 -26.057   3.706  -6.001
    3    HB   VAL  54           HB       VAL  54 -27.226   5.463  -3.784
    4   HG11  VAL  54          HG11      VAL  54 -24.576   4.172  -4.044
    5   HG13  VAL  54          HG12      VAL  54 -25.369   4.835  -2.615
    6   HG12  VAL  54          HG13      VAL  54 -24.513   5.905  -3.725
    7   HG22  VAL  54          HG21      VAL  54 -26.455   7.300  -4.909
    8   HG21  VAL  54          HG22      VAL  54 -26.946   6.263  -6.248
    9   HG23  VAL  54          HG23      VAL  54 -25.244   6.382  -5.804

  No H/Q in entry =           9
  In of MODEL   65
    1    H    LEU  55           H        LEU  55 -25.371   1.827  -5.326
    2    HA   LEU  55           HA       LEU  55 -26.819   0.477  -3.135
    3    HB2  LEU  55           HB2      LEU  55 -25.196  -0.648  -5.407
    4    HB3  LEU  55           HB3      LEU  55 -25.914  -1.599  -4.105
    5    HG   LEU  55           HG       LEU  55 -27.420  -0.120  -6.252
    6   HD13  LEU  55          HD11      LEU  55 -27.023  -1.974  -7.441
    7   HD12  LEU  55          HD12      LEU  55 -27.939  -2.876  -6.235
    8   HD11  LEU  55          HD13      LEU  55 -26.190  -2.721  -6.080
    9   HD23  LEU  55          HD21      LEU  55 -28.623  -2.099  -4.370
   10   HD22  LEU  55          HD22      LEU  55 -29.383  -0.767  -5.242
   11   HD21  LEU  55          HD23      LEU  55 -28.383  -0.438  -3.828

  No H/Q in entry =          11
  In of MODEL   65
    1    H    LEU  56           H        LEU  56 -25.647  -0.031  -1.316
    2    HA   LEU  56           HA       LEU  56 -22.735   0.512  -1.363
    3    HB2  LEU  56           HB2      LEU  56 -24.535   0.249   1.033
    4    HB3  LEU  56           HB3      LEU  56 -22.849   0.763   1.020
    5    HG   LEU  56           HG       LEU  56 -25.226   2.308   0.023
    6   HD11  LEU  56          HD11      LEU  56 -24.103   2.022   2.552
    7   HD13  LEU  56          HD12      LEU  56 -25.159   3.332   2.021
    8   HD12  LEU  56          HD13      LEU  56 -23.408   3.524   1.937
    9   HD23  LEU  56          HD21      LEU  56 -23.368   4.099  -0.192
   10   HD22  LEU  56          HD22      LEU  56 -23.690   2.963  -1.503
   11   HD21  LEU  56          HD23      LEU  56 -22.324   2.696  -0.420

  No H/Q in entry =          11
  In of MODEL   65
    1    H    GLY  57           H        GLY  57 -21.277  -1.039  -0.800
    2    HA3  GLY  57           HA2      GLY  57 -22.061  -3.771  -0.956
    3    HA2  GLY  57           HA3      GLY  57 -20.469  -3.186  -0.476

  No H/Q in entry =           3
  In of MODEL   65
    1    HA   PRO  58           HA       PRO  58 -23.237  -4.307   3.238
    2    HB2  PRO  58           HB2      PRO  58 -22.426  -6.864   3.888
    3    HB3  PRO  58           HB3      PRO  58 -23.825  -6.542   2.864
    4    HG2  PRO  58           HG2      PRO  58 -21.053  -7.297   2.101
    5    HG3  PRO  58           HG3      PRO  58 -22.591  -7.845   1.432
    6    HD2  PRO  58           HD2      PRO  58 -21.069  -5.970   0.185
    7    HD3  PRO  58           HD3      PRO  58 -22.830  -5.974   0.077

  No H/Q in entry =           7
  In of MODEL   65
    1    H    GLN  59           H        GLN  59 -19.845  -4.620   2.649
    2    HA   GLN  59           HA       GLN  59 -19.101  -4.556   5.413
    3    HB2  GLN  59           HB2      GLN  59 -17.591  -3.772   2.919
    4    HB3  GLN  59           HB3      GLN  59 -16.899  -3.706   4.527
    5    HG2  GLN  59           HG2      GLN  59 -17.961  -6.190   3.193
    6    HG3  GLN  59           HG3      GLN  59 -16.268  -5.731   3.276
    7   HE21  GLN  59          HE21      GLN  59 -18.342  -7.526   4.526
    8   HE22  GLN  59          HE22      GLN  59 -17.973  -8.015   6.074

  No H/Q in entry =           8
  In of MODEL   65
    1    H    ILE  60           H        ILE  60 -20.152  -2.090   3.161
    2    HA   ILE  60           HA       ILE  60 -19.406  -0.061   5.177
    3    HB   ILE  60           HB       ILE  60 -19.729   1.624   3.316
    4   HG12  ILE  60          HG12      ILE  60 -19.372  -0.619   1.375
    5   HG13  ILE  60          HG13      ILE  60 -20.996  -0.182   1.904
    6   HG22  ILE  60          HG21      ILE  60 -17.583  -0.371   2.704
    7   HG21  ILE  60          HG22      ILE  60 -17.540   0.710   4.096
    8   HG23  ILE  60          HG23      ILE  60 -17.557   1.376   2.464
    9   HD12  ILE  60          HD11      ILE  60 -19.055   1.386   0.251
   10   HD11  ILE  60          HD12      ILE  60 -20.235   2.247   1.238
   11   HD13  ILE  60          HD13      ILE  60 -20.780   1.116  -0.001

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ALA  61           H        ALA  61 -21.780  -1.765   5.264
    2    HA   ALA  61           HA       ALA  61 -24.084  -0.221   4.771
    3    HB1  ALA  61           HB1      ALA  61 -25.229  -1.747   6.117
    4    HB2  ALA  61           HB2      ALA  61 -23.818  -2.051   7.130
    5    HB3  ALA  61           HB3      ALA  61 -23.876  -2.688   5.486

  No H/Q in entry =           5
  In of MODEL   65
    1    H    TYR  62           H        TYR  62 -21.885  -0.178   7.578
    2    HA   TYR  62           HA       TYR  62 -23.527   1.426   9.216
    3    HB2  TYR  62           HB2      TYR  62 -21.527   1.956  10.460
    4    HB3  TYR  62           HB3      TYR  62 -21.474   0.257   9.995
    5    HD1  TYR  62           HD1      TYR  62 -19.840  -0.535   8.322
    6    HD2  TYR  62           HD2      TYR  62 -19.895   3.550   9.572
    7    HE1  TYR  62           HE1      TYR  62 -17.638  -0.190   7.270
    8    HE2  TYR  62           HE2      TYR  62 -17.677   3.892   8.521
    9    HH   TYR  62           HH       TYR  62 -16.301   1.538   6.435

  No H/Q in entry =           9
  In of MODEL   65
    1    H    MET  63           H        MET  63 -21.918   2.320   6.352
    2    HA   MET  63           HA       MET  63 -21.893   5.167   7.000
    3    HB2  MET  63           HB2      MET  63 -21.202   3.635   4.492
    4    HB3  MET  63           HB3      MET  63 -21.097   5.391   4.644
    5    HG2  MET  63           HG2      MET  63 -19.371   5.169   6.319
    6    HG3  MET  63           HG3      MET  63 -19.504   3.413   6.253
    7    HE1  MET  63           HE1      MET  63 -19.134   6.532   4.477
    8    HE3  MET  63           HE2      MET  63 -19.051   6.012   2.794
    9    HE2  MET  63           HE3      MET  63 -17.568   6.371   3.680

  No H/Q in entry =           9
  In of MODEL   65
    1    H    LEU  64           H        LEU  64 -24.359   3.174   6.057
    2    HA   LEU  64           HA       LEU  64 -25.630   4.498   3.953
    3    HB2  LEU  64           HB2      LEU  64 -26.397   2.367   4.903
    4    HB3  LEU  64           HB3      LEU  64 -26.900   3.209   6.367
    5    HG   LEU  64           HG       LEU  64 -28.650   4.359   5.113
    6   HD13  LEU  64          HD11      LEU  64 -28.371   4.579   2.879
    7   HD12  LEU  64          HD12      LEU  64 -28.936   2.912   2.758
    8   HD11  LEU  64          HD13      LEU  64 -27.208   3.256   2.817
    9   HD23  LEU  64          HD21      LEU  64 -29.028   1.514   4.410
   10   HD22  LEU  64          HD22      LEU  64 -30.074   2.612   5.309
   11   HD21  LEU  64          HD23      LEU  64 -28.665   1.899   6.093

  No H/Q in entry =          11
  In of MODEL   65
    1    HA   PRO  65           HA       PRO  65 -27.970   7.586   6.647
    2    HB2  PRO  65           HB2      PRO  65 -25.987   7.877   8.904
    3    HB3  PRO  65           HB3      PRO  65 -27.738   8.074   8.940
    4    HG2  PRO  65           HG2      PRO  65 -26.704   5.882   9.905
    5    HG3  PRO  65           HG3      PRO  65 -28.117   5.764   8.857
    6    HD2  PRO  65           HD2      PRO  65 -25.216   5.278   8.172
    7    HD3  PRO  65           HD3      PRO  65 -26.627   4.315   7.735

  No H/Q in entry =           7
  In of MODEL   65
    1    H    GLU  66           H        GLU  66 -24.416   7.702   6.730
    2    HA   GLU  66           HA       GLU  66 -24.252  10.505   6.281
    3    HB2  GLU  66           HB2      GLU  66 -22.328   8.277   5.672
    4    HB3  GLU  66           HB3      GLU  66 -21.959   9.986   5.438
    5    HG2  GLU  66           HG2      GLU  66 -22.196  10.383   7.799
    6    HG3  GLU  66           HG3      GLU  66 -22.642   8.697   8.056

  No H/Q in entry =           6
  In of MODEL   65
    1    H    ILE  67           H        ILE  67 -24.214   7.722   4.073
    2    HA   ILE  67           HA       ILE  67 -23.872   9.411   1.754
    3    HB   ILE  67           HB       ILE  67 -24.633   6.468   1.979
    4   HG12  ILE  67          HG12      ILE  67 -22.058   7.746   1.044
    5   HG13  ILE  67          HG13      ILE  67 -22.338   7.340   2.736
    6   HG21  ILE  67          HG21      ILE  67 -24.656   8.311  -0.277
    7   HG23  ILE  67          HG22      ILE  67 -25.203   6.637  -0.201
    8   HG22  ILE  67          HG23      ILE  67 -23.509   6.996  -0.529
    9   HD12  ILE  67          HD11      ILE  67 -21.827   5.553   0.417
   10   HD11  ILE  67          HD12      ILE  67 -22.817   4.954   1.746
   11   HD13  ILE  67          HD13      ILE  67 -21.170   5.502   2.053

  No H/Q in entry =          11
  In of MODEL   65
    1    H    GLN  68           H        GLN  68 -26.695   8.250   3.396
    2    HA   GLN  68           HA       GLN  68 -28.559   9.063   1.403
    3    HB2  GLN  68           HB2      GLN  68 -28.808   8.741   4.391
    4    HB3  GLN  68           HB3      GLN  68 -30.150   9.258   3.384
    5    HG2  GLN  68           HG2      GLN  68 -30.080   7.209   2.141
    6    HG3  GLN  68           HG3      GLN  68 -28.608   6.713   2.957
    7   HE21  GLN  68          HE21      GLN  68 -30.721   5.254   2.838
    8   HE22  GLN  68          HE22      GLN  68 -31.533   4.783   4.258

  No H/Q in entry =           8
  In of MODEL   65
    1    H    ARG  69           H        ARG  69 -27.040  10.845   4.117
    2    HA   ARG  69           HA       ARG  69 -28.516  13.256   3.667
    3    HB2  ARG  69           HB2      ARG  69 -26.136  12.459   5.277
    4    HB3  ARG  69           HB3      ARG  69 -26.292  14.168   4.891
    5    HG2  ARG  69           HG2      ARG  69 -28.611  14.121   5.856
    6    HG3  ARG  69           HG3      ARG  69 -28.328  12.450   6.357
    7    HD2  ARG  69           HD2      ARG  69 -26.746  14.893   7.238
    8    HD3  ARG  69           HD3      ARG  69 -27.837  13.953   8.244
    9    HE   ARG  69           HE       ARG  69 -25.182  13.125   7.315
   10   HH21  ARG  69          HH11      ARG  69 -24.299  11.420   8.541
   11   HH22  ARG  69          HH12      ARG  69 -25.293  10.576   9.681
   12   HH11  ARG  69          HH21      ARG  69 -28.117  12.472   9.014
   13   HH12  ARG  69          HH22      ARG  69 -27.454  11.170   9.946

  No H/Q in entry =          13
  In of MODEL   65
    1    H    LEU  70           H        LEU  70 -25.580  11.958   2.337
    2    HA   LEU  70           HA       LEU  70 -24.570  14.352   1.135
    3    HB2  LEU  70           HB2      LEU  70 -23.475  12.091   1.769
    4    HB3  LEU  70           HB3      LEU  70 -24.062  11.574   0.190
    5    HG   LEU  70           HG       LEU  70 -22.529  12.999  -0.914
    6   HD11  LEU  70          HD11      LEU  70 -21.754  13.922   1.863
    7   HD13  LEU  70          HD12      LEU  70 -22.491  14.904   0.596
    8   HD12  LEU  70          HD13      LEU  70 -20.850  14.292   0.392
    9   HD22  LEU  70          HD21      LEU  70 -21.022  11.351  -0.650
   10   HD21  LEU  70          HD22      LEU  70 -21.928  10.810   0.762
   11   HD23  LEU  70          HD23      LEU  70 -20.592  11.947   0.953

  No H/Q in entry =          11
  In of MODEL   65
    1    H    LEU  71           H        LEU  71 -26.604  11.699   0.055
    2    HA   LEU  71           HA       LEU  71 -27.187  13.122  -2.486
    3    HB2  LEU  71           HB2      LEU  71 -27.263  10.139  -1.993
    4    HB3  LEU  71           HB3      LEU  71 -27.425  10.968  -3.539
    5    HG   LEU  71           HG       LEU  71 -24.912  11.117  -1.873
    6   HD12  LEU  71          HD11      LEU  71 -24.887   9.450  -4.279
    7   HD11  LEU  71          HD12      LEU  71 -25.873   8.804  -2.969
    8   HD13  LEU  71          HD13      LEU  71 -24.169   9.163  -2.694
    9   HD22  LEU  71          HD21      LEU  71 -25.090  12.904  -3.396
   10   HD21  LEU  71          HD22      LEU  71 -25.538  11.820  -4.712
   11   HD23  LEU  71          HD23      LEU  71 -23.914  11.754  -4.029

  No H/Q in entry =          11
  In of MODEL   65
    1    HA   PRO  72           HA       PRO  72 -31.038  12.548   0.133
    2    HB2  PRO  72           HB2      PRO  72 -32.004  15.069   0.009
    3    HB3  PRO  72           HB3      PRO  72 -30.680  14.690   1.111
    4    HG2  PRO  72           HG2      PRO  72 -30.537  15.848  -1.661
    5    HG3  PRO  72           HG3      PRO  72 -29.798  16.455  -0.179
    6    HD2  PRO  72           HD2      PRO  72 -28.392  14.927  -1.917
    7    HD3  PRO  72           HD3      PRO  72 -28.135  14.798  -0.179

  No H/Q in entry =           7
  In of MODEL   65
    1    H    ASN  73           H        ASN  73 -30.446  13.478  -3.094
    2    HA   ASN  73           HA       ASN  73 -33.288  13.039  -3.729
    3    HB2  ASN  73           HB2      ASN  73 -32.864  14.131  -5.842
    4    HB3  ASN  73           HB3      ASN  73 -32.386  15.154  -4.495
    5   HD21  ASN  73          HD21      ASN  73 -31.585  15.189  -7.171
    6   HD22  ASN  73          HD22      ASN  73 -29.912  15.095  -7.357

  No H/Q in entry =           6
  In of MODEL   65
    1    H    LYS  74           H        LYS  74 -31.217  10.875  -3.263
    2    HA   LYS  74           HA       LYS  74 -31.720   9.418  -5.790
    3    HB2  LYS  74           HB2      LYS  74 -29.182   9.257  -4.158
    4    HB3  LYS  74           HB3      LYS  74 -29.527   8.405  -5.664
    5    HG2  LYS  74           HG2      LYS  74 -29.385  11.386  -5.509
    6    HG3  LYS  74           HG3      LYS  74 -27.968  10.376  -5.793
    7    HD2  LYS  74           HD2      LYS  74 -29.041   9.373  -7.724
    8    HD3  LYS  74           HD3      LYS  74 -30.500  10.316  -7.423
    9    HE2  LYS  74           HE2      LYS  74 -29.356  12.363  -7.895
   10    HE3  LYS  74           HE3      LYS  74 -27.800  11.535  -7.968
   11    HZ2  LYS  74           HZ1      LYS  74 -29.288  12.043 -10.107
   12    HZ1  LYS  74           HZ2      LYS  74 -29.882  10.502  -9.711
   13    HZ3  LYS  74           HZ3      LYS  74 -28.224  10.725 -10.007

  No H/Q in entry =          13
  In of MODEL   65
    1    HA   PRO  75           HA       PRO  75 -33.000   6.427  -2.774
    2    HB2  PRO  75           HB2      PRO  75 -33.216   4.172  -4.322
    3    HB3  PRO  75           HB3      PRO  75 -34.395   5.479  -4.416
    4    HG2  PRO  75           HG2      PRO  75 -32.030   4.949  -6.172
    5    HG3  PRO  75           HG3      PRO  75 -33.694   5.312  -6.629
    6    HD2  PRO  75           HD2      PRO  75 -31.829   7.254  -6.612
    7    HD3  PRO  75           HD3      PRO  75 -33.477   7.596  -6.083

  No H/Q in entry =           7
  In of MODEL   65
    1    H    VAL  76           H        VAL  76 -31.510   5.453  -1.382
    2    HA   VAL  76           HA       VAL  76 -28.995   4.326  -2.463
    3    HB   VAL  76           HB       VAL  76 -29.350   5.822   0.170
    4   HG11  VAL  76          HG11      VAL  76 -26.939   4.609  -1.195
    5   HG13  VAL  76          HG12      VAL  76 -27.622   4.156   0.368
    6   HG12  VAL  76          HG13      VAL  76 -26.838   5.723   0.170
    7   HG22  VAL  76          HG21      VAL  76 -28.756   7.734  -0.746
    8   HG21  VAL  76          HG22      VAL  76 -29.266   6.992  -2.264
    9   HG23  VAL  76          HG23      VAL  76 -27.563   6.980  -1.803

  No H/Q in entry =           9
  In of MODEL   65
    1    H    GLU  77           H        GLU  77 -28.693   2.193  -1.815
    2    HA   GLU  77           HA       GLU  77 -29.456   1.417   0.849
    3    HB2  GLU  77           HB2      GLU  77 -30.994  -0.302   0.342
    4    HB3  GLU  77           HB3      GLU  77 -31.601   1.186  -0.386
    5    HG2  GLU  77           HG2      GLU  77 -30.956   0.418  -2.560
    6    HG3  GLU  77           HG3      GLU  77 -30.257  -1.041  -1.860

  No H/Q in entry =           6
  In of MODEL   65
    1    H    VAL  78           H        VAL  78 -29.048  -0.644   1.545
    2    HA   VAL  78           HA       VAL  78 -26.349  -1.321   0.675
    3    HB   VAL  78           HB       VAL  78 -28.028  -2.235   3.050
    4   HG11  VAL  78          HG11      VAL  78 -25.637  -3.386   1.952
    5   HG13  VAL  78          HG12      VAL  78 -26.529  -3.871   3.395
    6   HG12  VAL  78          HG13      VAL  78 -25.259  -2.654   3.511
    7   HG22  VAL  78          HG21      VAL  78 -26.630  -0.793   4.370
    8   HG21  VAL  78          HG22      VAL  78 -27.400   0.125   3.077
    9   HG23  VAL  78          HG23      VAL  78 -25.703  -0.336   2.941

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ILE  79           H        ILE  79 -25.732  -3.220  -0.197
    2    HA   ILE  79           HA       ILE  79 -27.727  -4.803  -1.526
    3    HB   ILE  79           HB       ILE  79 -24.718  -5.203  -1.288
    4   HG12  ILE  79          HG12      ILE  79 -26.391  -4.205  -3.598
    5   HG13  ILE  79          HG13      ILE  79 -25.562  -3.141  -2.460
    6   HG22  ILE  79          HG21      ILE  79 -25.764  -6.465  -3.590
    7   HG21  ILE  79          HG22      ILE  79 -26.731  -7.003  -2.218
    8   HG23  ILE  79          HG23      ILE  79 -24.980  -7.211  -2.198
    9   HD13  ILE  79          HD11      ILE  79 -24.139  -3.227  -4.273
   10   HD12  ILE  79          HD12      ILE  79 -24.408  -4.952  -4.526
   11   HD11  ILE  79          HD13      ILE  79 -23.449  -4.401  -3.151

  No H/Q in entry =          11
  In of MODEL   65
    1    H    ASP  80           H        ASP  80 -28.515  -6.750  -0.913
    2    HA   ASP  80           HA       ASP  80 -28.433  -7.603   1.748
    3    HB2  ASP  80           HB2      ASP  80 -30.158  -8.277   0.114
    4    HB3  ASP  80           HB3      ASP  80 -28.957  -9.250  -0.735

  No H/Q in entry =           4
  In of MODEL   65
    1    H    SER  81           H        SER  81 -26.857  -8.656   2.900
    2    HA   SER  81           HA       SER  81 -24.331  -9.255   1.728
    3    HB2  SER  81           HB2      SER  81 -23.742 -10.218   3.914
    4    HB3  SER  81           HB3      SER  81 -24.521  -8.648   4.102
    5    HG   SER  81           HG       SER  81 -25.453 -11.197   4.706

  No H/Q in entry =           5
  In of MODEL   65
    1    H    LEU  82           H        LEU  82 -26.956 -11.450   2.077
    2    HA   LEU  82           HA       LEU  82 -25.311 -13.762   1.600
    3    HB2  LEU  82           HB2      LEU  82 -28.262 -13.405   1.133
    4    HB3  LEU  82           HB3      LEU  82 -27.394 -14.925   1.339
    5    HG   LEU  82           HG       LEU  82 -27.824 -12.855   3.473
    6   HD11  LEU  82          HD11      LEU  82 -29.851 -14.155   2.711
    7   HD13  LEU  82          HD12      LEU  82 -29.408 -14.404   4.401
    8   HD12  LEU  82          HD13      LEU  82 -29.003 -15.625   3.194
    9   HD21  LEU  82          HD21      LEU  82 -26.439 -15.531   3.355
   10   HD23  LEU  82          HD22      LEU  82 -26.942 -14.787   4.873
   11   HD22  LEU  82          HD23      LEU  82 -25.760 -13.977   3.844

  No H/Q in entry =          11
  In of MODEL   65
    1    H    LEU  83           H        LEU  83 -27.352 -11.649  -0.362
    2    HA   LEU  83           HA       LEU  83 -27.088 -13.040  -2.809
    3    HB2  LEU  83           HB2      LEU  83 -27.618 -10.141  -2.211
    4    HB3  LEU  83           HB3      LEU  83 -27.617 -10.814  -3.840
    5    HG   LEU  83           HG       LEU  83 -29.642 -11.246  -1.663
    6   HD13  LEU  83          HD11      LEU  83 -30.468  -9.449  -2.760
    7   HD12  LEU  83          HD12      LEU  83 -30.881 -10.602  -4.028
    8   HD11  LEU  83          HD13      LEU  83 -29.383  -9.676  -4.131
    9   HD23  LEU  83          HD21      LEU  83 -29.720 -12.555  -4.367
   10   HD22  LEU  83          HD22      LEU  83 -30.680 -12.920  -2.934
   11   HD21  LEU  83          HD23      LEU  83 -28.972 -13.355  -2.986

  No H/Q in entry =          11
  In of MODEL   65
    1    H    TYR  84           H        TYR  84 -25.238 -10.550  -1.168
    2    HA   TYR  84           HA       TYR  84 -23.390 -10.023  -3.301
    3    HB2  TYR  84           HB2      TYR  84 -23.940  -8.482  -1.373
    4    HB3  TYR  84           HB3      TYR  84 -23.000  -9.557  -0.342
    5    HD1  TYR  84           HD1      TYR  84 -20.538  -9.895  -0.874
    6    HD2  TYR  84           HD2      TYR  84 -22.878  -6.797  -2.652
    7    HE1  TYR  84           HE1      TYR  84 -18.464  -8.710  -1.510
    8    HE2  TYR  84           HE2      TYR  84 -20.814  -5.608  -3.303
    9    HH   TYR  84           HH       TYR  84 -18.185  -6.578  -3.724

  No H/Q in entry =           9
  In of MODEL   65
    1    H    GLY  85           H        GLY  85 -23.080 -11.963  -0.321
    2    HA3  GLY  85           HA2      GLY  85 -20.464 -12.810  -0.781
    3    HA2  GLY  85           HA3      GLY  85 -21.662 -13.690   0.168

  No H/Q in entry =           3
  In of MODEL   65
    1    H    LYS  86           H        LYS  86 -23.486 -14.172  -1.891
    2    HA   LYS  86           HA       LYS  86 -22.333 -16.522  -3.107
    3    HB2  LYS  86           HB2      LYS  86 -24.705 -16.021  -2.112
    4    HB3  LYS  86           HB3      LYS  86 -25.025 -15.373  -3.719
    5    HG2  LYS  86           HG2      LYS  86 -24.674 -17.506  -4.710
    6    HG3  LYS  86           HG3      LYS  86 -24.158 -18.183  -3.164
    7    HD2  LYS  86           HD2      LYS  86 -26.478 -18.746  -3.490
    8    HD3  LYS  86           HD3      LYS  86 -26.376 -17.536  -2.213
    9    HE2  LYS  86           HE2      LYS  86 -27.210 -15.844  -3.579
   10    HE3  LYS  86           HE3      LYS  86 -26.824 -16.722  -5.059
   11    HZ2  LYS  86           HZ1      LYS  86 -28.959 -17.350  -3.095
   12    HZ1  LYS  86           HZ2      LYS  86 -28.494 -18.411  -4.337
   13    HZ3  LYS  86           HZ3      LYS  86 -29.151 -16.894  -4.720

  No H/Q in entry =          13
  In of MODEL   65
    1    H    VAL  87           H        VAL  87 -22.449 -13.326  -4.056
    2    HA   VAL  87           HA       VAL  87 -22.191 -12.174  -6.015
    3    HB   VAL  87           HB       VAL  87 -21.007 -14.680  -7.257
    4   HG12  VAL  87          HG11      VAL  87 -19.946 -11.878  -7.468
    5   HG11  VAL  87          HG12      VAL  87 -21.359 -12.346  -8.417
    6   HG13  VAL  87          HG13      VAL  87 -19.830 -13.199  -8.628
    7   HG21  VAL  87          HG21      VAL  87 -19.854 -12.988  -5.080
    8   HG23  VAL  87          HG22      VAL  87 -18.806 -13.744  -6.277
    9   HG22  VAL  87          HG23      VAL  87 -19.844 -14.741  -5.259

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ASP  88           H        ASP  88 -24.681 -12.912  -5.659
    2    HA   ASP  88           HA       ASP  88 -25.745 -14.213  -8.037
    3    HB2  ASP  88           HB2      ASP  88 -26.736 -14.459  -5.712
    4    HB3  ASP  88           HB3      ASP  88 -27.257 -12.779  -5.842

  No H/Q in entry =           4
  In of MODEL   65
    1    H    GLY  89           H        GLY  89 -25.087 -12.957  -9.698
    2    HA3  GLY  89           HA2      GLY  89 -25.381 -10.197  -9.948
    3    HA2  GLY  89           HA3      GLY  89 -25.307 -11.340 -11.289

  No H/Q in entry =           3
  In of MODEL   65
    1    H    LEU  90           H        LEU  90 -27.697 -12.782 -10.822
    2    HA   LEU  90           HA       LEU  90 -29.583 -10.943 -11.973
    3    HB2  LEU  90           HB2      LEU  90 -29.548 -13.349 -12.511
    4    HB3  LEU  90           HB3      LEU  90 -30.043 -13.708 -10.858
    5    HG   LEU  90           HG       LEU  90 -32.205 -12.686 -11.244
    6   HD13  LEU  90          HD11      LEU  90 -32.092 -10.963 -12.749
    7   HD12  LEU  90          HD12      LEU  90 -32.578 -12.241 -13.866
    8   HD11  LEU  90          HD13      LEU  90 -30.882 -11.775 -13.745
    9   HD23  LEU  90          HD21      LEU  90 -32.061 -14.352 -13.651
   10   HD22  LEU  90          HD22      LEU  90 -33.037 -14.533 -12.193
   11   HD21  LEU  90          HD23      LEU  90 -31.360 -15.076 -12.204

  No H/Q in entry =          11
  In of MODEL   65
    1    H    GLY  91           H        GLY  91 -29.362 -12.381  -8.763
    2    HA3  GLY  91           HA2      GLY  91 -31.747 -11.348  -7.748
    3    HA2  GLY  91           HA3      GLY  91 -30.337 -11.807  -6.793

  No H/Q in entry =           3
  In of MODEL   65
    1    H    VAL  92           H        VAL  92 -28.493  -9.917  -7.677
    2    HA   VAL  92           HA       VAL  92 -29.383  -7.624  -6.170
    3    HB   VAL  92           HB       VAL  92 -26.816  -8.016  -7.753
    4   HG12  VAL  92          HG11      VAL  92 -27.064  -6.098  -5.459
    5   HG11  VAL  92          HG12      VAL  92 -27.747  -5.610  -7.012
    6   HG13  VAL  92          HG13      VAL  92 -26.033  -6.006  -6.889
    7   HG22  VAL  92          HG21      VAL  92 -26.531  -9.565  -6.132
    8   HG21  VAL  92          HG22      VAL  92 -27.709  -8.813  -5.055
    9   HG23  VAL  92          HG23      VAL  92 -26.082  -8.147  -5.184

  No H/Q in entry =           9
  In of MODEL   65
    1    H    LEU  93           H        LEU  93 -28.940  -8.328  -9.578
    2    HA   LEU  93           HA       LEU  93 -29.392  -5.726 -10.554
    3    HB2  LEU  93           HB2      LEU  93 -28.671  -7.577 -11.981
    4    HB3  LEU  93           HB3      LEU  93 -30.231  -8.366 -11.748
    5    HG   LEU  93           HG       LEU  93 -31.320  -6.466 -12.909
    6   HD11  LEU  93          HD11      LEU  93 -29.538  -4.787 -12.430
    7   HD13  LEU  93          HD12      LEU  93 -29.972  -4.866 -14.138
    8   HD12  LEU  93          HD13      LEU  93 -28.488  -5.629 -13.570
    9   HD23  LEU  93          HD21      LEU  93 -30.253  -7.030 -15.185
   10   HD22  LEU  93          HD22      LEU  93 -31.045  -8.304 -14.258
   11   HD21  LEU  93          HD23      LEU  93 -29.283  -8.175 -14.258

  No H/Q in entry =          11
  In of MODEL   65
    1    H    LYS  94           H        LYS  94 -31.662  -8.353  -9.664
    2    HA   LYS  94           HA       LYS  94 -34.063  -7.021 -10.318
    3    HB2  LYS  94           HB2      LYS  94 -33.463  -9.147  -8.267
    4    HB3  LYS  94           HB3      LYS  94 -35.087  -8.523  -8.550
    5    HG2  LYS  94           HG2      LYS  94 -34.963  -9.335 -10.870
    6    HG3  LYS  94           HG3      LYS  94 -33.373 -10.015 -10.527
    7    HD2  LYS  94           HD2      LYS  94 -34.442 -11.362  -8.680
    8    HD3  LYS  94           HD3      LYS  94 -36.009 -10.789  -9.249
    9    HE2  LYS  94           HE2      LYS  94 -35.450 -11.735 -11.498
   10    HE3  LYS  94           HE3      LYS  94 -34.006 -12.446 -10.779
   11    HZ3  LYS  94           HZ1      LYS  94 -35.791 -14.047 -10.925
   12    HZ2  LYS  94           HZ2      LYS  94 -36.809 -13.046 -10.004
   13    HZ1  LYS  94           HZ3      LYS  94 -35.420 -13.724  -9.300

  No H/Q in entry =          13
  In of MODEL   65
    1    H    ALA  95           H        ALA  95 -32.243  -7.013  -7.265
    2    HA   ALA  95           HA       ALA  95 -34.159  -5.486  -5.816
    3    HB2  ALA  95           HB1      ALA  95 -31.730  -6.751  -5.251
    4    HB3  ALA  95           HB2      ALA  95 -32.748  -5.867  -4.115
    5    HB1  ALA  95           HB3      ALA  95 -31.432  -5.039  -4.948

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ALA  96           H        ALA  96 -31.550  -4.560  -7.923
    2    HA   ALA  96           HA       ALA  96 -31.569  -1.783  -7.197
    3    HB2  ALA  96           HB1      ALA  96 -30.213  -1.538  -9.308
    4    HB3  ALA  96           HB2      ALA  96 -30.445  -3.262  -9.598
    5    HB1  ALA  96           HB3      ALA  96 -29.554  -2.719  -8.176

  No H/Q in entry =           5
  In of MODEL   65
    1    H    VAL  97           H        VAL  97 -33.024  -3.605  -9.856
    2    HA   VAL  97           HA       VAL  97 -34.183  -1.373 -11.153
    3    HB   VAL  97           HB       VAL  97 -34.874  -4.329 -11.146
    4   HG11  VAL  97          HG11      VAL  97 -36.744  -2.406 -11.670
    5   HG13  VAL  97          HG12      VAL  97 -36.737  -4.013 -12.398
    6   HG12  VAL  97          HG13      VAL  97 -36.037  -2.648 -13.268
    7   HG21  VAL  97          HG21      VAL  97 -33.664  -2.486 -13.210
    8   HG23  VAL  97          HG22      VAL  97 -34.049  -4.188 -13.472
    9   HG22  VAL  97          HG23      VAL  97 -32.819  -3.731 -12.291

  No H/Q in entry =           9
  In of MODEL   65
    1    H    ALA  98           H        ALA  98 -35.283  -3.555  -8.581
    2    HA   ALA  98           HA       ALA  98 -37.889  -2.504  -8.254
    3    HB1  ALA  98           HB1      ALA  98 -36.790  -4.642  -7.182
    4    HB3  ALA  98           HB2      ALA  98 -38.009  -3.751  -6.269
    5    HB2  ALA  98           HB3      ALA  98 -36.296  -3.527  -5.909

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ALA  99           H        ALA  99 -34.848  -1.555  -6.615
    2    HA   ALA  99           HA       ALA  99 -36.058   0.410  -4.989
    3    HB1  ALA  99           HB1      ALA  99 -33.375  -0.386  -5.718
    4    HB2  ALA  99           HB2      ALA  99 -33.957   0.367  -4.232
    5    HB3  ALA  99           HB3      ALA  99 -33.519   1.368  -5.615

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ILE 100           H        ILE 100 -35.016   0.526  -8.345
    2    HA   ILE 100           HA       ILE 100 -35.305   3.361  -8.613
    3    HB   ILE 100           HB       ILE 100 -35.312   1.169 -10.715
    4   HG12  ILE 100          HG12      ILE 100 -33.229   3.255 -10.074
    5   HG13  ILE 100          HG13      ILE 100 -33.203   1.618  -9.417
    6   HG21  ILE 100          HG21      ILE 100 -35.847   4.068 -10.895
    7   HG23  ILE 100          HG22      ILE 100 -36.301   2.762 -11.991
    8   HG22  ILE 100          HG23      ILE 100 -34.674   3.441 -12.053
    9   HD12  ILE 100          HD11      ILE 100 -32.701   2.550 -12.205
   10   HD11  ILE 100          HD12      ILE 100 -33.300   0.914 -11.925
   11   HD13  ILE 100          HD13      ILE 100 -31.773   1.430 -11.210

  No H/Q in entry =          11
  In of MODEL   65
    1    H    LYS 101           H        LYS 101 -37.494   0.653  -9.299
    2    HA   LYS 101           HA       LYS 101 -39.636   2.204 -10.328
    3    HB2  LYS 101           HB2      LYS 101 -39.415  -0.545  -9.155
    4    HB3  LYS 101           HB3      LYS 101 -40.995   0.151  -9.516
    5    HG2  LYS 101           HG2      LYS 101 -40.521   0.266 -11.813
    6    HG3  LYS 101           HG3      LYS 101 -38.812  -0.069 -11.550
    7    HD2  LYS 101           HD2      LYS 101 -39.985  -2.038 -12.406
    8    HD3  LYS 101           HD3      LYS 101 -39.349  -2.318 -10.785
    9    HE2  LYS 101           HE2      LYS 101 -41.385  -3.084 -10.271
   10    HE3  LYS 101           HE3      LYS 101 -41.907  -1.399 -10.302
   11    HZ3  LYS 101           HZ1      LYS 101 -42.787  -1.624 -12.418
   12    HZ2  LYS 101           HZ2      LYS 101 -43.192  -3.102 -11.687
   13    HZ1  LYS 101           HZ3      LYS 101 -41.886  -3.021 -12.769

  No H/Q in entry =          13
  In of MODEL   65
    1    H    LYS 102           H        LYS 102 -39.094   0.798  -7.095
    2    HA   LYS 102           HA       LYS 102 -41.389   1.925  -5.920
    3    HB2  LYS 102           HB2      LYS 102 -40.084   0.124  -4.873
    4    HB3  LYS 102           HB3      LYS 102 -38.735   1.237  -4.645
    5    HG2  LYS 102           HG2      LYS 102 -40.108   2.603  -3.173
    6    HG3  LYS 102           HG3      LYS 102 -41.460   1.496  -3.403
    7    HD2  LYS 102           HD2      LYS 102 -40.166  -0.305  -2.345
    8    HD3  LYS 102           HD3      LYS 102 -38.814   0.805  -2.112
    9    HE2  LYS 102           HE2      LYS 102 -40.227   2.252  -0.730
   10    HE3  LYS 102           HE3      LYS 102 -41.598   1.171  -0.984
   11    HZ1  LYS 102           HZ1      LYS 102 -39.813  -0.499   0.050
   12    HZ3  LYS 102           HZ2      LYS 102 -40.959   0.357   0.964
   13    HZ2  LYS 102           HZ3      LYS 102 -39.370   0.942   0.831

  No H/Q in entry =          13
  In of MODEL   65
    1    H    ALA 103           H        ALA 103 -38.488   3.414  -6.950
    2    HA   ALA 103           HA       ALA 103 -38.804   5.746  -5.206
    3    HB2  ALA 103           HB1      ALA 103 -36.839   6.531  -6.790
    4    HB3  ALA 103           HB2      ALA 103 -36.736   4.810  -7.160
    5    HB1  ALA 103           HB3      ALA 103 -36.533   5.368  -5.500

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ALA 104           H        ALA 104 -39.389   4.939  -8.540
    2    HA   ALA 104           HA       ALA 104 -40.079   7.688  -9.208
    3    HB2  ALA 104           HB1      ALA 104 -40.091   6.984 -11.400
    4    HB1  ALA 104           HB2      ALA 104 -40.759   5.402 -10.999
    5    HB3  ALA 104           HB3      ALA 104 -39.048   5.736 -10.720

  No H/Q in entry =           5
  In of MODEL   65
    1    H    ALA 105           H        ALA 105 -41.609   5.552  -7.374
    2    HA   ALA 105           HA       ALA 105 -44.086   6.851  -7.373
    3    HB2  ALA 105           HB1      ALA 105 -44.792   5.932  -9.400
    4    HB3  ALA 105           HB2      ALA 105 -45.385   4.737  -8.245
    5    HB1  ALA 105           HB3      ALA 105 -43.901   4.432  -9.146

  No H/Q in entry =           5
  In of MODEL   66
    1    H1   ALA   1           H3       ALA   1 -12.246 -15.765  -2.237
    2    H2   ALA   1           H2       ALA   1 -11.311 -16.902  -3.091
    3    H3   ALA   1           H1       ALA   1 -12.467 -15.958  -3.909
    4    HA   ALA   1           HA       ALA   1 -13.858 -17.663  -3.659
    5    HB3  ALA   1           HB1      ALA   1 -12.452 -19.432  -3.218
    6    HB1  ALA   1           HB2      ALA   1 -13.191 -19.327  -1.621
    7    HB2  ALA   1           HB3      ALA   1 -11.620 -18.581  -1.917

  No H/Q in entry =           7
  In of MODEL   66
    1    H    GLU   2           H        GLU   2 -15.460 -18.527  -1.990
    2    HA   GLU   2           HA       GLU   2 -17.101 -16.814  -0.907
    3    HB2  GLU   2           HB2      GLU   2 -16.138 -19.242   0.619
    4    HB3  GLU   2           HB3      GLU   2 -17.661 -18.397   0.893
    5    HG2  GLU   2           HG2      GLU   2 -18.657 -19.480  -0.834
    6    HG3  GLU   2           HG3      GLU   2 -17.348 -19.073  -1.932

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLU   3           H        GLU   3 -15.156 -18.170   1.690
    2    HA   GLU   3           HA       GLU   3 -15.366 -15.822   3.257
    3    HB2  GLU   3           HB2      GLU   3 -13.771 -18.366   3.482
    4    HB3  GLU   3           HB3      GLU   3 -13.531 -17.049   4.631
    5    HG2  GLU   3           HG2      GLU   3 -15.714 -17.209   5.473
    6    HG3  GLU   3           HG3      GLU   3 -16.323 -18.006   4.028

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LEU   4           H        LEU   4 -12.423 -17.289   1.829
    2    HA   LEU   4           HA       LEU   4 -10.587 -15.383   2.413
    3    HB2  LEU   4           HB2      LEU   4 -10.845 -16.672  -0.313
    4    HB3  LEU   4           HB3      LEU   4  -9.387 -15.950   0.358
    5    HG   LEU   4           HG       LEU   4 -10.862 -18.355   1.479
    6   HD13  LEU   4          HD11      LEU   4  -9.237 -19.703   0.528
    7   HD12  LEU   4          HD12      LEU   4  -8.031 -18.417   0.492
    8   HD11  LEU   4          HD13      LEU   4  -9.333 -18.439  -0.697
    9   HD23  LEU   4          HD21      LEU   4  -8.596 -18.417   2.836
   10   HD22  LEU   4          HD22      LEU   4  -9.914 -17.382   3.383
   11   HD21  LEU   4          HD23      LEU   4  -8.563 -16.687   2.488

  No H/Q in entry =          11
  In of MODEL   66
    1    H    GLU   5           H        GLU   5 -12.952 -15.174  -0.235
    2    HA   GLU   5           HA       GLU   5 -11.966 -12.684  -1.239
    3    HB2  GLU   5           HB2      GLU   5 -13.322 -14.270  -2.591
    4    HB3  GLU   5           HB3      GLU   5 -14.712 -13.914  -1.565
    5    HG2  GLU   5           HG2      GLU   5 -14.597 -11.543  -2.199
    6    HG3  GLU   5           HG3      GLU   5 -13.184 -11.871  -3.203

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLU   6           H        GLU   6 -14.666 -13.576   0.880
    2    HA   GLU   6           HA       GLU   6 -15.572 -10.903   1.298
    3    HB2  GLU   6           HB2      GLU   6 -16.991 -12.897   1.706
    4    HB3  GLU   6           HB3      GLU   6 -15.942 -13.348   3.050
    5    HG2  GLU   6           HG2      GLU   6 -16.464 -11.246   4.196
    6    HG3  GLU   6           HG3      GLU   6 -17.466 -10.736   2.840

  No H/Q in entry =           6
  In of MODEL   66
    1    H    VAL   7           H        VAL   7 -13.243 -13.013   2.838
    2    HA   VAL   7           HA       VAL   7 -12.755 -11.444   5.165
    3    HB   VAL   7           HB       VAL   7 -11.062 -13.479   3.690
    4   HG11  VAL   7          HG11      VAL   7 -10.570 -11.952   6.254
    5   HG13  VAL   7          HG12      VAL   7  -9.484 -12.160   4.881
    6   HG12  VAL   7          HG13      VAL   7  -9.822 -13.521   5.950
    7   HG21  VAL   7          HG21      VAL   7 -13.298 -14.052   4.933
    8   HG23  VAL   7          HG22      VAL   7 -12.356 -13.780   6.399
    9   HG22  VAL   7          HG23      VAL   7 -11.872 -15.035   5.260

  No H/Q in entry =           9
  In of MODEL   66
    1    H    VAL   8           H        VAL   8 -11.278 -11.545   1.938
    2    HA   VAL   8           HA       VAL   8  -9.215  -9.668   2.414
    3    HB   VAL   8           HB       VAL   8 -10.688 -10.479  -0.093
    4   HG11  VAL   8          HG11      VAL   8  -8.530  -8.405   0.316
    5   HG13  VAL   8          HG12      VAL   8 -10.036  -8.257  -0.592
    6   HG12  VAL   8          HG13      VAL   8  -8.719  -9.245  -1.225
    7   HG23  VAL   8          HG21      VAL   8  -7.891 -11.003  -0.199
    8   HG22  VAL   8          HG22      VAL   8  -9.187 -12.180  -0.006
    9   HG21  VAL   8          HG23      VAL   8  -8.413 -11.489   1.416

  No H/Q in entry =           9
  In of MODEL   66
    1    H    MET   9           H        MET   9 -12.574  -9.283   1.292
    2    HA   MET   9           HA       MET   9 -12.522  -6.505   0.865
    3    HB2  MET   9           HB2      MET   9 -14.705  -8.418   1.669
    4    HB3  MET   9           HB3      MET   9 -15.016  -6.685   1.553
    5    HG2  MET   9           HG2      MET   9 -13.934  -6.847  -0.791
    6    HG3  MET   9           HG3      MET   9 -14.172  -8.586  -0.628
    7    HE3  MET   9           HE1      MET   9 -17.895  -9.143  -0.408
    8    HE2  MET   9           HE2      MET   9 -16.767  -9.020   0.939
    9    HE1  MET   9           HE3      MET   9 -16.263  -9.813  -0.551

  No H/Q in entry =           9
  In of MODEL   66
    1    H    GLY  10           H        GLY  10 -13.148  -8.407   3.794
    2    HA3  GLY  10           HA2      GLY  10 -13.683  -6.229   5.525
    3    HA2  GLY  10           HA3      GLY  10 -13.109  -7.818   6.028

  No H/Q in entry =           3
  In of MODEL   66
    1    H    LEU  11           H        LEU  11 -10.678  -7.931   4.686
    2    HA   LEU  11           HA       LEU  11  -8.962  -6.498   6.429
    3    HB2  LEU  11           HB2      LEU  11  -8.440  -7.912   3.811
    4    HB3  LEU  11           HB3      LEU  11  -7.161  -7.207   4.798
    5    HG   LEU  11           HG       LEU  11  -9.146  -9.249   5.830
    6   HD13  LEU  11          HD11      LEU  11  -7.938 -10.477   4.249
    7   HD12  LEU  11          HD12      LEU  11  -6.986 -10.718   5.713
    8   HD11  LEU  11          HD13      LEU  11  -6.462  -9.547   4.503
    9   HD22  LEU  11          HD21      LEU  11  -8.275  -8.239   7.740
   10   HD21  LEU  11          HD22      LEU  11  -6.747  -7.831   6.962
   11   HD23  LEU  11          HD23      LEU  11  -7.062  -9.490   7.470

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  12           H        ILE  12  -9.902  -5.944   3.051
    2    HA   ILE  12           HA       ILE  12  -8.222  -3.707   2.613
    3    HB   ILE  12           HB       ILE  12 -10.891  -4.368   1.343
    4   HG12  ILE  12          HG12      ILE  12  -8.864  -6.036   1.255
    5   HG13  ILE  12          HG13      ILE  12  -9.746  -5.684  -0.216
    6   HG23  ILE  12          HG21      ILE  12 -10.361  -2.076   0.844
    7   HG22  ILE  12          HG22      ILE  12  -9.890  -3.002  -0.576
    8   HG21  ILE  12          HG23      ILE  12  -8.692  -2.474   0.570
    9   HD11  ILE  12          HD11      ILE  12  -7.216  -4.253   0.635
   10   HD13  ILE  12          HD12      ILE  12  -8.026  -4.149  -0.926
   11   HD12  ILE  12          HD13      ILE  12  -7.238  -5.633  -0.446

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  13           H        ILE  13 -11.571  -3.989   3.741
    2    HA   ILE  13           HA       ILE  13 -12.037  -1.204   4.024
    3    HB   ILE  13           HB       ILE  13 -13.219  -3.635   5.385
    4   HG12  ILE  13          HG12      ILE  13 -13.484  -3.100   2.863
    5   HG13  ILE  13          HG13      ILE  13 -14.911  -3.518   3.786
    6   HG22  ILE  13          HG21      ILE  13 -15.106  -2.027   6.010
    7   HG21  ILE  13          HG22      ILE  13 -13.988  -0.715   5.666
    8   HG23  ILE  13          HG23      ILE  13 -13.622  -1.868   6.947
    9   HD13  ILE  13          HD11      ILE  13 -15.792  -1.398   3.658
   10   HD12  ILE  13          HD12      ILE  13 -14.805  -1.365   2.210
   11   HD11  ILE  13          HD13      ILE  13 -14.196  -0.641   3.681

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ASN  14           H        ASN  14 -10.893  -3.697   6.279
    2    HA   ASN  14           HA       ASN  14 -10.674  -2.065   8.567
    3    HB2  ASN  14           HB2      ASN  14 -10.414  -4.670   8.235
    4    HB3  ASN  14           HB3      ASN  14  -8.708  -4.276   8.061
    5   HD21  ASN  14          HD21      ASN  14  -9.316  -5.809  10.239
    6   HD22  ASN  14          HD22      ASN  14  -9.276  -4.893  11.666

  No H/Q in entry =           6
  In of MODEL   66
    1    H    SER  15           H        SER  15  -8.295  -2.871   6.048
    2    HA   SER  15           HA       SER  15  -6.147  -1.373   7.102
    3    HB2  SER  15           HB2      SER  15  -5.148  -1.577   4.932
    4    HB3  SER  15           HB3      SER  15  -6.095  -3.042   5.163
    5    HG   SER  15           HG       SER  15  -6.980  -2.456   3.349

  No H/Q in entry =           5
  In of MODEL   66
    1    H    GLY  16           H        GLY  16  -8.775  -0.511   4.885
    2    HA3  GLY  16           HA2      GLY  16  -7.935   2.135   4.332
    3    HA2  GLY  16           HA3      GLY  16  -9.585   1.533   4.186

  No H/Q in entry =           3
  In of MODEL   66
    1    H    GLN  17           H        GLN  17 -10.096   0.798   6.839
    2    HA   GLN  17           HA       GLN  17 -10.804   3.296   7.994
    3    HB2  GLN  17           HB2      GLN  17 -10.679   0.511   9.164
    4    HB3  GLN  17           HB3      GLN  17 -11.300   1.904  10.047
    5    HG2  GLN  17           HG2      GLN  17 -12.349   0.958   7.364
    6    HG3  GLN  17           HG3      GLN  17 -13.106   0.606   8.916
    7   HE21  GLN  17          HE21      GLN  17 -13.536   2.590   6.365
    8   HE22  GLN  17          HE22      GLN  17 -14.132   3.974   7.146

  No H/Q in entry =           8
  In of MODEL   66
    1    H    ALA  18           H        ALA  18  -8.157   1.026   8.579
    2    HA   ALA  18           HA       ALA  18  -7.042   2.241  10.842
    3    HB2  ALA  18           HB1      ALA  18  -6.435   0.033   9.461
    4    HB3  ALA  18           HB2      ALA  18  -5.265   0.819  10.522
    5    HB1  ALA  18           HB3      ALA  18  -5.207   1.102   8.781

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ARG  19           H        ARG  19  -6.309   2.779   7.387
    2    HA   ARG  19           HA       ARG  19  -4.418   4.835   7.801
    3    HB2  ARG  19           HB2      ARG  19  -4.762   3.699   5.606
    4    HB3  ARG  19           HB3      ARG  19  -6.311   4.531   5.448
    5    HG2  ARG  19           HG2      ARG  19  -5.194   6.709   5.510
    6    HG3  ARG  19           HG3      ARG  19  -3.637   5.932   5.796
    7    HD2  ARG  19           HD2      ARG  19  -3.790   6.528   3.456
    8    HD3  ARG  19           HD3      ARG  19  -3.864   4.767   3.597
    9    HE   ARG  19           HE       ARG  19  -6.503   5.661   3.620
   10   HH21  ARG  19          HH11      ARG  19  -7.718   5.815   1.715
   11   HH22  ARG  19          HH12      ARG  19  -6.913   5.902   0.187
   12   HH11  ARG  19          HH21      ARG  19  -3.749   5.746   1.557
   13   HH12  ARG  19          HH22      ARG  19  -4.664   5.860   0.098

  No H/Q in entry =          13
  In of MODEL   66
    1    H    SER  20           H        SER  20  -7.923   4.932   7.238
    2    HA   SER  20           HA       SER  20  -8.297   7.685   7.200
    3    HB2  SER  20           HB2      SER  20 -10.171   6.335   6.680
    4    HB3  SER  20           HB3      SER  20 -10.042   5.438   8.191
    5    HG   SER  20           HG       SER  20 -11.097   7.959   7.667

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LEU  21           H        LEU  21  -8.255   5.495   9.999
    2    HA   LEU  21           HA       LEU  21  -8.687   7.483  11.974
    3    HB2  LEU  21           HB2      LEU  21  -7.318   4.789  12.111
    4    HB3  LEU  21           HB3      LEU  21  -7.614   5.801  13.522
    5    HG   LEU  21           HG       LEU  21  -9.803   4.898  11.627
    6   HD13  LEU  21          HD11      LEU  21 -10.359   3.195  13.286
    7   HD12  LEU  21          HD12      LEU  21  -9.028   3.725  14.314
    8   HD11  LEU  21          HD13      LEU  21  -8.691   2.974  12.754
    9   HD23  LEU  21          HD21      LEU  21 -11.119   5.385  13.867
   10   HD22  LEU  21          HD22      LEU  21 -10.682   6.736  12.826
   11   HD21  LEU  21          HD23      LEU  21  -9.724   6.387  14.257

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ALA  22           H        ALA  22  -5.741   6.132  10.532
    2    HA   ALA  22           HA       ALA  22  -3.853   7.454  12.138
    3    HB2  ALA  22           HB1      ALA  22  -3.442   5.607  10.438
    4    HB1  ALA  22           HB2      ALA  22  -2.254   6.911  10.464
    5    HB3  ALA  22           HB3      ALA  22  -3.485   6.863   9.200

  No H/Q in entry =           5
  In of MODEL   66
    1    H    TYR  23           H        TYR  23  -5.209   8.470   8.972
    2    HA   TYR  23           HA       TYR  23  -3.890  10.975   8.895
    3    HB2  TYR  23           HB2      TYR  23  -4.985  10.062   6.911
    4    HB3  TYR  23           HB3      TYR  23  -6.556  10.156   7.709
    5    HD1  TYR  23           HD1      TYR  23  -3.684  12.219   6.522
    6    HD2  TYR  23           HD2      TYR  23  -7.807  12.161   7.722
    7    HE1  TYR  23           HE1      TYR  23  -3.934  14.570   5.771
    8    HE2  TYR  23           HE2      TYR  23  -8.059  14.511   6.970
    9    HH   TYR  23           HH       TYR  23  -5.763  16.567   6.570

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ALA  24           H        ALA  24  -6.989   9.974  10.303
    2    HA   ALA  24           HA       ALA  24  -7.835  12.556  11.090
    3    HB1  ALA  24           HB1      ALA  24  -9.640  11.291  11.572
    4    HB2  ALA  24           HB2      ALA  24  -8.796  10.722  13.010
    5    HB3  ALA  24           HB3      ALA  24  -8.680   9.814  11.503

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ALA  25           H        ALA  25  -5.801  10.107  12.637
    2    HA   ALA  25           HA       ALA  25  -5.446  11.355  15.139
    3    HB2  ALA  25           HB1      ALA  25  -4.672   9.011  14.304
    4    HB3  ALA  25           HB2      ALA  25  -3.650   9.872  15.456
    5    HB1  ALA  25           HB3      ALA  25  -3.232   9.863  13.743

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LEU  26           H        LEU  26  -3.688  11.674  12.081
    2    HA   LEU  26           HA       LEU  26  -1.732  13.504  12.982
    3    HB2  LEU  26           HB2      LEU  26  -1.444  12.360  10.872
    4    HB3  LEU  26           HB3      LEU  26  -2.929  13.060  10.234
    5    HG   LEU  26           HG       LEU  26  -1.928  15.317  10.366
    6   HD12  LEU  26          HD11      LEU  26   0.615  15.352  10.754
    7   HD11  LEU  26          HD12      LEU  26   0.409  13.768  11.496
    8   HD13  LEU  26          HD13      LEU  26  -0.401  15.176  12.185
    9   HD21  LEU  26          HD21      LEU  26  -0.186  13.277   8.948
   10   HD23  LEU  26          HD22      LEU  26  -0.244  14.999   8.582
   11   HD22  LEU  26          HD23      LEU  26  -1.663  13.993   8.306

  No H/Q in entry =          11
  In of MODEL   66
    1    H    LYS  27           H        LYS  27  -4.932  13.970  11.538
    2    HA   LYS  27           HA       LYS  27  -4.897  16.760  11.347
    3    HB2  LYS  27           HB2      LYS  27  -6.641  15.274  10.375
    4    HB3  LYS  27           HB3      LYS  27  -7.280  15.009  11.997
    5    HG2  LYS  27           HG2      LYS  27  -7.722  17.412  12.244
    6    HG3  LYS  27           HG3      LYS  27  -7.032  17.717  10.647
    7    HD2  LYS  27           HD2      LYS  27  -8.766  16.275   9.624
    8    HD3  LYS  27           HD3      LYS  27  -9.462  15.987  11.221
    9    HE2  LYS  27           HE2      LYS  27  -9.917  18.394  11.475
   10    HE3  LYS  27           HE3      LYS  27  -9.193  18.705   9.893
   11    HZ3  LYS  27           HZ1      LYS  27 -11.572  18.566   9.675
   12    HZ2  LYS  27           HZ2      LYS  27 -11.603  17.047  10.441
   13    HZ1  LYS  27           HZ3      LYS  27 -10.874  17.219   8.913

  No H/Q in entry =          13
  In of MODEL   66
    1    H    GLN  28           H        GLN  28  -5.745  14.661  14.078
    2    HA   GLN  28           HA       GLN  28  -6.634  16.655  15.868
    3    HB2  GLN  28           HB2      GLN  28  -5.213  14.029  16.386
    4    HB3  GLN  28           HB3      GLN  28  -5.941  15.027  17.647
    5    HG2  GLN  28           HG2      GLN  28  -7.435  13.917  15.254
    6    HG3  GLN  28           HG3      GLN  28  -7.461  13.209  16.868
    7   HE21  GLN  28          HE21      GLN  28  -9.398  14.991  14.968
    8   HE22  GLN  28          HE22      GLN  28 -10.123  16.007  16.118

  No H/Q in entry =           8
  In of MODEL   66
    1    H    ALA  29           H        ALA  29  -3.415  15.378  15.142
    2    HA   ALA  29           HA       ALA  29  -1.964  16.778  17.110
    3    HB1  ALA  29           HB1      ALA  29  -0.042  16.100  15.969
    4    HB3  ALA  29           HB2      ALA  29  -0.813  16.225  14.388
    5    HB2  ALA  29           HB3      ALA  29  -1.217  14.887  15.463

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LYS  30           H        LYS  30  -2.861  17.662  13.791
    2    HA   LYS  30           HA       LYS  30  -1.461  20.108  13.683
    3    HB2  LYS  30           HB2      LYS  30  -4.003  19.229  12.298
    4    HB3  LYS  30           HB3      LYS  30  -3.179  20.747  11.950
    5    HG2  LYS  30           HG2      LYS  30  -1.110  19.463  11.411
    6    HG3  LYS  30           HG3      LYS  30  -2.008  17.963  11.662
    7    HD2  LYS  30           HD2      LYS  30  -3.593  18.603   9.885
    8    HD3  LYS  30           HD3      LYS  30  -2.717  20.115   9.637
    9    HE2  LYS  30           HE2      LYS  30  -0.687  18.830   9.033
   10    HE3  LYS  30           HE3      LYS  30  -1.582  17.324   9.250
   11    HZ2  LYS  30           HZ1      LYS  30  -1.433  18.202   6.909
   12    HZ1  LYS  30           HZ2      LYS  30  -2.475  19.460   7.391
   13    HZ3  LYS  30           HZ3      LYS  30  -2.994  17.841   7.464

  No H/Q in entry =          13
  In of MODEL   66
    1    H    GLN  31           H        GLN  31  -4.544  19.243  15.125
    2    HA   GLN  31           HA       GLN  31  -5.310  21.997  15.593
    3    HB2  GLN  31           HB2      GLN  31  -6.469  19.544  16.921
    4    HB3  GLN  31           HB3      GLN  31  -7.235  21.114  16.688
    5    HG2  GLN  31           HG2      GLN  31  -6.550  20.346  14.089
    6    HG3  GLN  31           HG3      GLN  31  -7.064  18.838  14.837
    7   HE21  GLN  31          HE21      GLN  31  -8.500  20.415  12.755
    8   HE22  GLN  31          HE22      GLN  31 -10.007  20.801  13.430

  No H/Q in entry =           8
  In of MODEL   66
    1    H    GLY  32           H        GLY  32  -2.979  20.071  16.883
    2    HA3  GLY  32           HA2      GLY  32  -1.561  20.530  18.672
    3    HA2  GLY  32           HA3      GLY  32  -2.687  21.769  19.211

  No H/Q in entry =           3
  In of MODEL   66
    1    H    ASP  33           H        ASP  33  -4.110  18.729  18.555
    2    HA   ASP  33           HA       ASP  33  -4.489  18.262  21.438
    3    HB2  ASP  33           HB2      ASP  33  -5.920  17.255  18.972
    4    HB3  ASP  33           HB3      ASP  33  -6.247  16.639  20.590

  No H/Q in entry =           4
  In of MODEL   66
    1    H    PHE  34           H        PHE  34  -2.316  17.414  21.718
    2    HA   PHE  34           HA       PHE  34  -1.327  15.171  20.299
    3    HB2  PHE  34           HB2      PHE  34  -0.682  16.148  23.090
    4    HB3  PHE  34           HB3      PHE  34   0.240  14.929  22.209
    5    HD1  PHE  34           HD1      PHE  34   0.069  18.353  22.956
    6    HD2  PHE  34           HD2      PHE  34   0.870  15.661  19.704
    7    HE1  PHE  34           HE1      PHE  34   1.349  20.130  21.794
    8    HE2  PHE  34           HE2      PHE  34   2.145  17.441  18.547
    9    HZ   PHE  34           HZ       PHE  34   2.386  19.673  19.596

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ALA  35           H        ALA  35  -3.336  15.436  23.185
    2    HA   ALA  35           HA       ALA  35  -3.110  12.771  24.070
    3    HB3  ALA  35           HB1      ALA  35  -5.560  13.390  24.956
    4    HB1  ALA  35           HB2      ALA  35  -5.034  15.011  24.499
    5    HB2  ALA  35           HB3      ALA  35  -4.105  14.085  25.678

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ALA  36           H        ALA  36  -5.585  14.290  22.002
    2    HA   ALA  36           HA       ALA  36  -7.001  11.878  21.532
    3    HB1  ALA  36           HB1      ALA  36  -8.469  13.301  20.596
    4    HB3  ALA  36           HB2      ALA  36  -7.311  13.727  19.336
    5    HB2  ALA  36           HB3      ALA  36  -7.321  14.610  20.862

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ALA  37           H        ALA  37  -4.342  13.475  19.839
    2    HA   ALA  37           HA       ALA  37  -4.329  11.847  17.537
    3    HB3  ALA  37           HB1      ALA  37  -2.324  13.558  18.943
    4    HB2  ALA  37           HB2      ALA  37  -2.872  13.618  17.269
    5    HB1  ALA  37           HB3      ALA  37  -1.711  12.388  17.774

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LYS  38           H        LYS  38  -2.538  11.534  20.595
    2    HA   LYS  38           HA       LYS  38  -1.214   9.138  20.083
    3    HB2  LYS  38           HB2      LYS  38  -1.517  10.893  22.238
    4    HB3  LYS  38           HB3      LYS  38  -2.126   9.361  22.856
    5    HG2  LYS  38           HG2      LYS  38  -0.036   8.246  22.293
    6    HG3  LYS  38           HG3      LYS  38   0.561   9.695  21.478
    7    HD2  LYS  38           HD2      LYS  38   0.750  10.907  23.515
    8    HD3  LYS  38           HD3      LYS  38  -0.258   9.752  24.389
    9    HE2  LYS  38           HE2      LYS  38   2.105   9.438  24.982
   10    HE3  LYS  38           HE3      LYS  38   1.494   8.024  24.120
   11    HZ3  LYS  38           HZ1      LYS  38   2.774   8.451  22.326
   12    HZ2  LYS  38           HZ2      LYS  38   3.740   9.277  23.455
   13    HZ1  LYS  38           HZ3      LYS  38   2.649  10.138  22.478

  No H/Q in entry =          13
  In of MODEL   66
    1    H    ALA  39           H        ALA  39  -4.438   9.623  21.522
    2    HA   ALA  39           HA       ALA  39  -4.988   6.901  22.024
    3    HB3  ALA  39           HB1      ALA  39  -7.158   8.844  21.286
    4    HB2  ALA  39           HB2      ALA  39  -6.244   9.068  22.778
    5    HB1  ALA  39           HB3      ALA  39  -7.161   7.583  22.520

  No H/Q in entry =           5
  In of MODEL   66
    1    H    MET  40           H        MET  40  -5.607   8.922  19.190
    2    HA   MET  40           HA       MET  40  -7.095   6.992  17.739
    3    HB2  MET  40           HB2      MET  40  -5.500   9.394  16.825
    4    HB3  MET  40           HB3      MET  40  -6.535   8.436  15.763
    5    HG2  MET  40           HG2      MET  40  -7.545   9.674  18.336
    6    HG3  MET  40           HG3      MET  40  -7.620  10.514  16.789
    7    HE3  MET  40           HE1      MET  40 -10.223   8.897  14.748
    8    HE2  MET  40           HE2      MET  40  -8.472   9.018  14.581
    9    HE1  MET  40           HE3      MET  40  -9.385  10.379  15.229

  No H/Q in entry =           9
  In of MODEL   66
    1    H    MET  41           H        MET  41  -3.604   7.736  17.827
    2    HA   MET  41           HA       MET  41  -2.865   5.991  15.713
    3    HB2  MET  41           HB2      MET  41  -1.223   6.652  18.171
    4    HB3  MET  41           HB3      MET  41  -0.621   6.011  16.646
    5    HG2  MET  41           HG2      MET  41  -1.793   8.194  15.662
    6    HG3  MET  41           HG3      MET  41  -1.540   8.777  17.306
    7    HE2  MET  41           HE1      MET  41   1.386   6.684  17.629
    8    HE1  MET  41           HE2      MET  41   0.604   7.973  18.540
    9    HE3  MET  41           HE3      MET  41   2.220   8.223  17.881

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ASP  42           H        ASP  42  -3.211   5.505  19.201
    2    HA   ASP  42           HA       ASP  42  -2.168   2.913  19.342
    3    HB2  ASP  42           HB2      ASP  42  -3.026   4.664  21.179
    4    HB3  ASP  42           HB3      ASP  42  -4.451   3.636  21.118

  No H/Q in entry =           4
  In of MODEL   66
    1    H    GLN  43           H        GLN  43  -5.509   4.010  18.880
    2    HA   GLN  43           HA       GLN  43  -6.648   1.420  18.689
    3    HB2  GLN  43           HB2      GLN  43  -7.590   4.074  17.579
    4    HB3  GLN  43           HB3      GLN  43  -8.549   2.592  17.562
    5    HG2  GLN  43           HG2      GLN  43  -8.229   2.464  20.066
    6    HG3  GLN  43           HG3      GLN  43  -7.509   4.071  19.992
    7   HE21  GLN  43          HE21      GLN  43  -9.673   4.140  21.516
    8   HE22  GLN  43          HE22      GLN  43 -11.044   4.715  20.700

  No H/Q in entry =           8
  In of MODEL   66
    1    H    SER  44           H        SER  44  -5.339   3.646  16.270
    2    HA   SER  44           HA       SER  44  -6.060   2.168  13.984
    3    HB2  SER  44           HB2      SER  44  -4.806   4.553  14.423
    4    HB3  SER  44           HB3      SER  44  -3.455   3.562  13.875
    5    HG   SER  44           HG       SER  44  -4.588   4.537  12.127

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ARG  45           H        ARG  45  -3.161   2.055  16.033
    2    HA   ARG  45           HA       ARG  45  -1.690   0.109  14.629
    3    HB2  ARG  45           HB2      ARG  45  -0.833   1.527  16.494
    4    HB3  ARG  45           HB3      ARG  45  -1.810   0.589  17.621
    5    HG2  ARG  45           HG2      ARG  45  -0.580  -1.464  16.959
    6    HG3  ARG  45           HG3      ARG  45   0.422  -0.502  15.873
    7    HD2  ARG  45           HD2      ARG  45   1.173   0.874  17.826
    8    HD3  ARG  45           HD3      ARG  45   0.265  -0.207  18.905
    9    HE   ARG  45           HE       ARG  45   1.952  -1.793  17.301
   10   HH21  ARG  45          HH11      ARG  45   3.863  -2.614  18.116
   11   HH22  ARG  45          HH12      ARG  45   4.648  -1.831  19.442
   12   HH11  ARG  45          HH21      ARG  45   2.274   0.666  19.697
   13   HH12  ARG  45          HH22      ARG  45   3.747   0.029  20.334

  No H/Q in entry =          13
  In of MODEL   66
    1    H    MET  46           H        MET  46  -4.060  -0.226  17.253
    2    HA   MET  46           HA       MET  46  -3.882  -3.026  17.548
    3    HB2  MET  46           HB2      MET  46  -6.052  -1.028  18.177
    4    HB3  MET  46           HB3      MET  46  -6.248  -2.750  18.515
    5    HG2  MET  46           HG2      MET  46  -4.174  -2.713  19.866
    6    HG3  MET  46           HG3      MET  46  -4.002  -0.993  19.551
    7    HE1  MET  46           HE1      MET  46  -5.305   0.829  20.466
    8    HE3  MET  46           HE2      MET  46  -4.258   0.256  21.761
    9    HE2  MET  46           HE3      MET  46  -5.918   0.722  22.121

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ALA  47           H        ALA  47  -5.928  -1.006  15.482
    2    HA   ALA  47           HA       ALA  47  -7.553  -3.057  14.425
    3    HB3  ALA  47           HB1      ALA  47  -8.241  -0.819  14.024
    4    HB1  ALA  47           HB2      ALA  47  -7.767  -1.446  12.446
    5    HB2  ALA  47           HB3      ALA  47  -6.680  -0.379  13.335

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LEU  48           H        LEU  48  -4.447  -1.738  13.347
    2    HA   LEU  48           HA       LEU  48  -4.188  -3.320  10.997
    3    HB2  LEU  48           HB2      LEU  48  -2.114  -2.044  12.789
    4    HB3  LEU  48           HB3      LEU  48  -1.760  -2.759  11.216
    5    HG   LEU  48           HG       LEU  48  -3.782  -0.546  11.634
    6   HD13  LEU  48          HD11      LEU  48  -1.655   0.331  12.281
    7   HD12  LEU  48          HD12      LEU  48  -1.948   0.890  10.634
    8   HD11  LEU  48          HD13      LEU  48  -0.845  -0.456  10.927
    9   HD22  LEU  48          HD21      LEU  48  -4.274  -1.524   9.560
   10   HD21  LEU  48          HD22      LEU  48  -2.594  -1.955   9.246
   11   HD23  LEU  48          HD23      LEU  48  -3.116  -0.276   9.098

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ASN  49           H        ASN  49  -3.108  -3.728  14.331
    2    HA   ASN  49           HA       ASN  49  -1.506  -5.988  13.976
    3    HB2  ASN  49           HB2      ASN  49  -1.532  -4.644  16.029
    4    HB3  ASN  49           HB3      ASN  49  -3.172  -5.171  16.373
    5   HD21  ASN  49          HD21      ASN  49  -2.506  -6.189  18.380
    6   HD22  ASN  49          HD22      ASN  49  -1.611  -7.630  18.383

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLU  50           H        GLU  50  -4.968  -5.718  14.684
    2    HA   GLU  50           HA       GLU  50  -5.477  -8.518  14.787
    3    HB2  GLU  50           HB2      GLU  50  -7.055  -6.835  15.686
    4    HB3  GLU  50           HB3      GLU  50  -7.366  -6.265  14.044
    5    HG2  GLU  50           HG2      GLU  50  -8.236  -8.459  13.407
    6    HG3  GLU  50           HG3      GLU  50  -7.838  -9.108  14.994

  No H/Q in entry =           6
  In of MODEL   66
    1    H    ALA  51           H        ALA  51  -5.572  -6.110  12.201
    2    HA   ALA  51           HA       ALA  51  -6.578  -7.831  10.183
    3    HB2  ALA  51           HB1      ALA  51  -6.372  -6.013   8.818
    4    HB1  ALA  51           HB2      ALA  51  -4.727  -5.666   9.351
    5    HB3  ALA  51           HB3      ALA  51  -6.101  -5.158  10.336

  No H/Q in entry =           5
  In of MODEL   66
    1    H    HIS  52           H        HIS  52  -3.277  -6.927  11.137
    2    HA   HIS  52           HA       HIS  52  -1.898  -8.409   9.168
    3    HB2  HIS  52           HB2      HIS  52  -0.895  -6.664  10.663
    4    HB3  HIS  52           HB3      HIS  52  -0.965  -7.827  11.986
    5    HD1  HIS  52           HD1      HIS  52   0.124 -10.333  11.061
    6    HD2  HIS  52           HD2      HIS  52   1.602  -6.754   9.514
    7    HE1  HIS  52           HE1      HIS  52   2.413 -10.853  10.111
    8    HE2  HIS  52           HE2      HIS  52   3.327  -8.682   9.163

  No H/Q in entry =           8
  In of MODEL   66
    1    H    LEU  53           H        LEU  53  -3.078  -9.298  12.389
    2    HA   LEU  53           HA       LEU  53  -1.880 -11.844  12.561
    3    HB2  LEU  53           HB2      LEU  53  -4.353 -10.667  13.804
    4    HB3  LEU  53           HB3      LEU  53  -3.891 -12.343  14.086
    5    HG   LEU  53           HG       LEU  53  -1.993 -10.020  14.554
    6   HD11  LEU  53          HD11      LEU  53  -4.020 -11.320  16.372
    7   HD13  LEU  53          HD12      LEU  53  -3.729  -9.603  16.099
    8   HD12  LEU  53          HD13      LEU  53  -2.572 -10.557  17.019
    9   HD22  LEU  53          HD21      LEU  53  -0.685 -11.973  14.510
   10   HD21  LEU  53          HD22      LEU  53  -1.981 -12.971  15.159
   11   HD23  LEU  53          HD23      LEU  53  -1.100 -11.886  16.218

  No H/Q in entry =          11
  In of MODEL   66
    1    H    VAL  54           H        VAL  54  -5.004 -10.807  11.234
    2    HA   VAL  54           HA       VAL  54  -5.927 -13.398  10.546
    3    HB   VAL  54           HB       VAL  54  -6.582 -10.660   9.428
    4   HG12  VAL  54          HG11      VAL  54  -8.694 -12.033   8.632
    5   HG11  VAL  54          HG12      VAL  54  -7.583 -13.400   8.688
    6   HG13  VAL  54          HG13      VAL  54  -7.232 -12.021   7.648
    7   HG22  VAL  54          HG21      VAL  54  -7.468 -10.705  11.589
    8   HG21  VAL  54          HG22      VAL  54  -7.724 -12.448  11.565
    9   HG23  VAL  54          HG23      VAL  54  -8.813 -11.387  10.674

  No H/Q in entry =           9
  In of MODEL   66
    1    H    GLN  55           H        GLN  55  -4.071 -10.942   8.748
    2    HA   GLN  55           HA       GLN  55  -3.966 -12.397   6.323
    3    HB2  GLN  55           HB2      GLN  55  -3.361 -10.133   6.136
    4    HB3  GLN  55           HB3      GLN  55  -2.237 -10.216   7.490
    5    HG2  GLN  55           HG2      GLN  55  -0.534 -11.059   6.193
    6    HG3  GLN  55           HG3      GLN  55  -1.619 -12.029   5.206
    7   HE21  GLN  55          HE21      GLN  55  -1.656 -11.331   3.088
    8   HE22  GLN  55          HE22      GLN  55  -1.461  -9.725   2.582

  No H/Q in entry =           8
  In of MODEL   66
    1    H    THR  56           H        THR  56  -1.832 -12.390   9.183
    2    HA   THR  56           HA       THR  56   0.235 -13.988   8.239
    3    HB   THR  56           HB       THR  56  -1.037 -14.016  10.990
    4    HG1  THR  56           HG1      THR  56   0.219 -12.141   9.754
    5   HG21  THR  56          HG21      THR  56   1.431 -15.291   9.852
    6   HG23  THR  56          HG22      THR  56   0.264 -15.948  11.001
    7   HG22  THR  56          HG23      THR  56   1.434 -14.737  11.525

  No H/Q in entry =           7
  In of MODEL   66
    1    H    LYS  57           H        LYS  57  -2.873 -15.025   9.629
    2    HA   LYS  57           HA       LYS  57  -2.434 -17.820   9.369
    3    HB2  LYS  57           HB2      LYS  57  -4.237 -16.735  10.737
    4    HB3  LYS  57           HB3      LYS  57  -5.042 -16.272   9.246
    5    HG2  LYS  57           HG2      LYS  57  -5.309 -18.624   8.622
    6    HG3  LYS  57           HG3      LYS  57  -4.440 -19.127  10.070
    7    HD2  LYS  57           HD2      LYS  57  -6.199 -18.098  11.479
    8    HD3  LYS  57           HD3      LYS  57  -7.078 -17.620  10.027
    9    HE2  LYS  57           HE2      LYS  57  -6.374 -20.493  10.726
   10    HE3  LYS  57           HE3      LYS  57  -7.944 -19.761  11.045
   11    HZ1  LYS  57           HZ1      LYS  57  -6.784 -19.683   8.338
   12    HZ3  LYS  57           HZ2      LYS  57  -8.413 -19.579   8.811
   13    HZ2  LYS  57           HZ3      LYS  57  -7.599 -21.069   8.884

  No H/Q in entry =          13
  In of MODEL   66
    1    H    LEU  58           H        LEU  58  -3.783 -15.367   7.215
    2    HA   LEU  58           HA       LEU  58  -4.608 -17.183   5.210
    3    HB2  LEU  58           HB2      LEU  58  -3.998 -14.236   5.080
    4    HB3  LEU  58           HB3      LEU  58  -4.676 -15.166   3.743
    5    HG   LEU  58           HG       LEU  58  -5.928 -14.995   6.504
    6   HD11  LEU  58          HD11      LEU  58  -6.250 -13.338   4.021
    7   HD13  LEU  58          HD12      LEU  58  -6.222 -12.836   5.712
    8   HD12  LEU  58          HD13      LEU  58  -7.653 -13.625   5.051
    9   HD22  LEU  58          HD21      LEU  58  -6.903 -16.899   5.637
   10   HD21  LEU  58          HD22      LEU  58  -6.579 -16.441   3.964
   11   HD23  LEU  58          HD23      LEU  58  -7.933 -15.716   4.831

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  59           H        ILE  59  -1.462 -15.982   6.045
    2    HA   ILE  59           HA       ILE  59  -0.392 -16.702   3.395
    3    HB   ILE  59           HB       ILE  59   0.396 -14.642   4.960
    4   HG12  ILE  59          HG12      ILE  59   2.485 -16.289   3.522
    5   HG13  ILE  59          HG13      ILE  59   1.274 -15.371   2.664
    6   HG21  ILE  59          HG21      ILE  59   1.152 -16.418   6.713
    7   HG23  ILE  59          HG22      ILE  59   2.256 -15.115   6.337
    8   HG22  ILE  59          HG23      ILE  59   2.489 -16.712   5.627
    9   HD12  ILE  59          HD11      ILE  59   3.287 -14.269   4.623
   10   HD11  ILE  59          HD12      ILE  59   2.000 -13.317   3.886
   11   HD13  ILE  59          HD13      ILE  59   3.276 -14.005   2.881

  No H/Q in entry =          11
  In of MODEL   66
    1    H    GLU  60           H        GLU  60  -0.372 -17.820   6.759
    2    HA   GLU  60           HA       GLU  60   1.652 -19.801   6.467
    3    HB2  GLU  60           HB2      GLU  60   0.936 -19.044   8.670
    4    HB3  GLU  60           HB3      GLU  60  -0.693 -19.647   8.378
    5    HG2  GLU  60           HG2      GLU  60   1.679 -21.500   8.204
    6    HG3  GLU  60           HG3      GLU  60   0.941 -21.129   9.761

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLY  61           H        GLY  61  -1.863 -19.890   6.015
    2    HA3  GLY  61           HA2      GLY  61  -1.630 -22.680   5.044
    3    HA2  GLY  61           HA3      GLY  61  -3.108 -21.943   5.654

  No H/Q in entry =           3
  In of MODEL   66
    1    H    ASP  62           H        ASP  62  -0.897 -20.360   3.436
    2    HA   ASP  62           HA       ASP  62  -3.009 -19.818   1.577
    3    HB2  ASP  62           HB2      ASP  62  -1.193 -18.220   2.021
    4    HB3  ASP  62           HB3      ASP  62  -0.023 -19.364   1.372

  No H/Q in entry =           4
  In of MODEL   66
    1    H    ALA  63           H        ALA  63  -3.777 -21.314   0.169
    2    HA   ALA  63           HA       ALA  63  -1.806 -23.056  -1.217
    3    HB3  ALA  63           HB1      ALA  63  -3.610 -24.770  -1.337
    4    HB2  ALA  63           HB2      ALA  63  -4.571 -23.769  -0.250
    5    HB1  ALA  63           HB3      ALA  63  -3.041 -24.452   0.303

  No H/Q in entry =           5
  In of MODEL   66
    1    H    GLY  64           H        GLY  64  -4.623 -21.027  -1.319
    2    HA3  GLY  64           HA2      GLY  64  -5.646 -19.932  -3.067
    3    HA2  GLY  64           HA3      GLY  64  -4.379 -20.534  -4.123

  No H/Q in entry =           3
  In of MODEL   66
    1    H    GLU  65           H        GLU  65  -6.046 -20.856  -5.749
    2    HA   GLU  65           HA       GLU  65  -8.284 -22.511  -5.341
    3    HB2  GLU  65           HB2      GLU  65  -6.777 -21.842  -7.868
    4    HB3  GLU  65           HB3      GLU  65  -8.319 -22.699  -7.831
    5    HG2  GLU  65           HG2      GLU  65  -9.024 -20.492  -8.095
    6    HG3  GLU  65           HG3      GLU  65  -9.092 -20.678  -6.345

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLY  66           H        GLY  66  -5.056 -23.230  -6.447
    2    HA3  GLY  66           HA2      GLY  66  -5.618 -26.106  -6.586
    3    HA2  GLY  66           HA3      GLY  66  -4.237 -25.295  -7.299

  No H/Q in entry =           3
  In of MODEL   66
    1    H    LYS  67           H        LYS  67  -3.557 -27.440  -6.081
    2    HA   LYS  67           HA       LYS  67  -3.225 -27.409  -3.293
    3    HB2  LYS  67           HB2      LYS  67  -1.282 -29.096  -4.086
    4    HB3  LYS  67           HB3      LYS  67  -2.996 -29.527  -4.057
    5    HG2  LYS  67           HG2      LYS  67  -3.264 -29.086  -6.372
    6    HG3  LYS  67           HG3      LYS  67  -1.745 -28.198  -6.462
    7    HD2  LYS  67           HD2      LYS  67  -1.395 -30.365  -7.472
    8    HD3  LYS  67           HD3      LYS  67  -0.552 -30.357  -5.921
    9    HE2  LYS  67           HE2      LYS  67  -2.363 -31.561  -4.857
   10    HE3  LYS  67           HE3      LYS  67  -3.360 -31.428  -6.304
   11    HZ1  LYS  67           HZ1      LYS  67  -0.767 -32.615  -6.740
   12    HZ3  LYS  67           HZ2      LYS  67  -2.296 -33.109  -7.288
   13    HZ2  LYS  67           HZ3      LYS  67  -1.779 -33.519  -5.724

  No H/Q in entry =          13
  In of MODEL   66
    1    H    MET  68           H        MET  68  -0.554 -27.300  -5.581
    2    HA   MET  68           HA       MET  68   1.346 -26.265  -3.773
    3    HB2  MET  68           HB2      MET  68   1.261 -26.571  -6.762
    4    HB3  MET  68           HB3      MET  68   2.651 -25.857  -5.942
    5    HG2  MET  68           HG2      MET  68   1.482 -28.567  -5.255
    6    HG3  MET  68           HG3      MET  68   2.876 -28.330  -6.310
    7    HE3  MET  68           HE1      MET  68   5.685 -27.168  -4.348
    8    HE2  MET  68           HE2      MET  68   4.578 -25.844  -4.709
    9    HE1  MET  68           HE3      MET  68   4.783 -27.156  -5.869

  No H/Q in entry =           9
  In of MODEL   66
    1    H    LYS  69           H        LYS  69  -0.612 -24.639  -6.259
    2    HA   LYS  69           HA       LYS  69   0.679 -22.183  -6.262
    3    HB2  LYS  69           HB2      LYS  69  -2.191 -22.849  -6.830
    4    HB3  LYS  69           HB3      LYS  69  -1.495 -21.244  -7.086
    5    HG2  LYS  69           HG2      LYS  69   0.222 -22.202  -8.557
    6    HG3  LYS  69           HG3      LYS  69  -0.435 -23.817  -8.290
    7    HD2  LYS  69           HD2      LYS  69  -2.596 -23.075  -9.265
    8    HD3  LYS  69           HD3      LYS  69  -1.883 -21.494  -9.593
    9    HE2  LYS  69           HE2      LYS  69  -0.782 -24.110 -10.657
   10    HE3  LYS  69           HE3      LYS  69  -1.826 -23.027 -11.575
   11    HZ3  LYS  69           HZ1      LYS  69  -0.209 -21.298 -11.406
   12    HZ2  LYS  69           HZ2      LYS  69   0.563 -22.689 -12.001
   13    HZ1  LYS  69           HZ3      LYS  69   0.768 -22.229 -10.378

  No H/Q in entry =          13
  In of MODEL   66
    1    H    VAL  70           H        VAL  70  -0.870 -20.095  -5.756
    2    HA   VAL  70           HA       VAL  70  -1.540 -20.178  -2.873
    3    HB   VAL  70           HB       VAL  70  -0.468 -17.924  -2.669
    4   HG13  VAL  70          HG11      VAL  70   1.745 -18.765  -2.415
    5   HG12  VAL  70          HG12      VAL  70   1.518 -19.954  -3.698
    6   HG11  VAL  70          HG13      VAL  70   0.687 -20.152  -2.156
    7   HG23  VAL  70          HG21      VAL  70   1.156 -17.269  -4.491
    8   HG22  VAL  70          HG22      VAL  70  -0.532 -17.201  -4.995
    9   HG21  VAL  70          HG23      VAL  70   0.480 -18.555  -5.493

  No H/Q in entry =           9
  In of MODEL   66
    1    H    SER  71           H        SER  71  -2.901 -18.382  -2.206
    2    HA   SER  71           HA       SER  71  -5.045 -17.859  -4.046
    3    HB2  SER  71           HB2      SER  71  -5.304 -18.112  -1.527
    4    HB3  SER  71           HB3      SER  71  -4.540 -16.533  -1.361
    5    HG   SER  71           HG       SER  71  -6.691 -16.132  -1.464

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LEU  72           H        LEU  72  -5.248 -16.205  -5.403
    2    HA   LEU  72           HA       LEU  72  -3.143 -14.393  -5.899
    3    HB2  LEU  72           HB2      LEU  72  -6.018 -14.436  -6.813
    4    HB3  LEU  72           HB3      LEU  72  -4.822 -13.283  -7.400
    5    HG   LEU  72           HG       LEU  72  -4.445 -16.293  -7.547
    6   HD11  LEU  72          HD11      LEU  72  -5.579 -14.325  -9.546
    7   HD13  LEU  72          HD12      LEU  72  -6.321 -15.808  -8.948
    8   HD12  LEU  72          HD13      LEU  72  -4.925 -15.892 -10.021
    9   HD21  LEU  72          HD21      LEU  72  -2.953 -13.886  -8.574
   10   HD23  LEU  72          HD22      LEU  72  -2.864 -15.394  -9.470
   11   HD22  LEU  72          HD23      LEU  72  -2.311 -15.331  -7.799

  No H/Q in entry =          11
  In of MODEL   66
    1    H    VAL  73           H        VAL  73  -6.218 -14.040  -4.235
    2    HA   VAL  73           HA       VAL  73  -6.257 -11.271  -3.872
    3    HB   VAL  73           HB       VAL  73  -7.978 -11.626  -2.315
    4   HG13  VAL  73          HG11      VAL  73  -9.411 -13.120  -3.462
    5   HG12  VAL  73          HG12      VAL  73  -8.078 -14.171  -3.933
    6   HG11  VAL  73          HG13      VAL  73  -8.264 -12.589  -4.693
    7   HG22  VAL  73          HG21      VAL  73  -6.910 -13.003  -0.680
    8   HG21  VAL  73          HG22      VAL  73  -6.640 -14.298  -1.845
    9   HG23  VAL  73          HG23      VAL  73  -8.274 -13.948  -1.279

  No H/Q in entry =           9
  In of MODEL   66
    1    H    LEU  74           H        LEU  74  -4.304 -13.647  -2.319
    2    HA   LEU  74           HA       LEU  74  -3.865 -12.517   0.204
    3    HB2  LEU  74           HB2      LEU  74  -3.090 -14.735  -0.320
    4    HB3  LEU  74           HB3      LEU  74  -2.042 -14.113  -1.594
    5    HG   LEU  74           HG       LEU  74  -0.784 -12.820   0.145
    6   HD11  LEU  74          HD11      LEU  74  -2.766 -14.253   1.912
    7   HD13  LEU  74          HD12      LEU  74  -2.306 -12.550   1.936
    8   HD12  LEU  74          HD13      LEU  74  -1.185 -13.776   2.528
    9   HD21  LEU  74          HD21      LEU  74  -0.362 -15.256  -0.682
   10   HD23  LEU  74          HD22      LEU  74  -0.873 -15.678   0.937
   11   HD22  LEU  74          HD23      LEU  74   0.526 -14.654   0.716

  No H/Q in entry =          11
  In of MODEL   66
    1    H    VAL  75           H        VAL  75  -2.006 -12.113  -2.772
    2    HA   VAL  75           HA       VAL  75  -0.196 -10.194  -1.773
    3    HB   VAL  75           HB       VAL  75  -1.182 -10.666  -4.587
    4   HG11  VAL  75          HG11      VAL  75   1.101  -8.945  -3.525
    5   HG13  VAL  75          HG12      VAL  75  -0.320  -8.380  -4.390
    6   HG12  VAL  75          HG13      VAL  75   0.875  -9.365  -5.219
    7   HG21  VAL  75          HG21      VAL  75   0.037 -12.540  -3.507
    8   HG23  VAL  75          HG22      VAL  75   1.363 -11.444  -3.118
    9   HG22  VAL  75          HG23      VAL  75   0.995 -11.820  -4.803

  No H/Q in entry =           9
  In of MODEL   66
    1    H    GLU  76           H        GLU  76  -3.364  -9.837  -3.395
    2    HA   GLU  76           HA       GLU  76  -3.414  -7.022  -3.483
    3    HB2  GLU  76           HB2      GLU  76  -5.083  -8.503  -4.617
    4    HB3  GLU  76           HB3      GLU  76  -5.746  -8.924  -3.046
    5    HG2  GLU  76           HG2      GLU  76  -6.355  -6.561  -2.657
    6    HG3  GLU  76           HG3      GLU  76  -5.711  -6.119  -4.227

  No H/Q in entry =           6
  In of MODEL   66
    1    H    ALA  77           H        ALA  77  -4.499  -9.261  -0.941
    2    HA   ALA  77           HA       ALA  77  -5.434  -7.266   0.837
    3    HB1  ALA  77           HB1      ALA  77  -4.304  -9.989   1.527
    4    HB2  ALA  77           HB2      ALA  77  -5.973  -9.680   1.051
    5    HB3  ALA  77           HB3      ALA  77  -5.344  -8.997   2.548

  No H/Q in entry =           5
  In of MODEL   66
    1    H    GLN  78           H        GLN  78  -2.293  -8.816   0.431
    2    HA   GLN  78           HA       GLN  78  -1.009  -7.668   2.672
    3    HB2  GLN  78           HB2      GLN  78  -0.164  -9.603   1.302
    4    HB3  GLN  78           HB3      GLN  78   0.257  -8.454   0.034
    5    HG2  GLN  78           HG2      GLN  78   1.733  -7.261   1.604
    6    HG3  GLN  78           HG3      GLN  78   1.322  -8.414   2.871
    7   HE21  GLN  78          HE21      GLN  78   4.024  -8.188   2.098
    8   HE22  GLN  78          HE22      GLN  78   4.483  -9.584   1.248

  No H/Q in entry =           8
  In of MODEL   66
    1    H    LEU  79           H        LEU  79  -1.411  -6.591  -0.666
    2    HA   LEU  79           HA       LEU  79   0.279  -4.367  -0.661
    3    HB2  LEU  79           HB2      LEU  79  -0.771  -5.163  -2.707
    4    HB3  LEU  79           HB3      LEU  79  -2.367  -4.771  -2.079
    5    HG   LEU  79           HG       LEU  79  -1.819  -2.385  -2.049
    6   HD13  LEU  79          HD11      LEU  79   0.427  -2.148  -1.560
    7   HD12  LEU  79          HD12      LEU  79   0.458  -1.853  -3.298
    8   HD11  LEU  79          HD13      LEU  79   0.916  -3.434  -2.664
    9   HD23  LEU  79          HD21      LEU  79  -1.212  -2.176  -4.607
   10   HD22  LEU  79          HD22      LEU  79  -2.735  -2.924  -4.134
   11   HD21  LEU  79          HD23      LEU  79  -1.369  -3.933  -4.598

  No H/Q in entry =          11
  In of MODEL   66
    1    H    HIS  80           H        HIS  80  -3.178  -4.527   0.203
    2    HA   HIS  80           HA       HIS  80  -3.357  -1.773   0.880
    3    HB2  HIS  80           HB2      HIS  80  -5.060  -4.180   1.207
    4    HB3  HIS  80           HB3      HIS  80  -5.365  -2.844   2.321
    5    HD1  HIS  80           HD1      HIS  80  -6.989  -1.199   1.438
    6    HD2  HIS  80           HD2      HIS  80  -4.834  -3.003  -1.641
    7    HE1  HIS  80           HE1      HIS  80  -7.851  -0.191  -0.727
    8    HE2  HIS  80           HE2      HIS  80  -6.544  -1.285  -2.613

  No H/Q in entry =           8
  In of MODEL   66
    1    H    LEU  81           H        LEU  81  -2.853  -4.678   2.855
    2    HA   LEU  81           HA       LEU  81  -2.810  -3.341   5.345
    3    HB2  LEU  81           HB2      LEU  81  -1.607  -5.957   4.441
    4    HB3  LEU  81           HB3      LEU  81  -1.561  -5.405   6.116
    5    HG   LEU  81           HG       LEU  81  -4.125  -5.645   4.516
    6   HD12  LEU  81          HD11      LEU  81  -4.416  -7.716   6.057
    7   HD11  LEU  81          HD12      LEU  81  -2.662  -7.651   6.224
    8   HD13  LEU  81          HD13      LEU  81  -3.389  -7.872   4.632
    9   HD23  LEU  81          HD21      LEU  81  -4.942  -5.857   7.025
   10   HD22  LEU  81          HD22      LEU  81  -4.620  -4.265   6.339
   11   HD21  LEU  81          HD23      LEU  81  -3.424  -5.033   7.382

  No H/Q in entry =          11
  In of MODEL   66
    1    H    MET  82           H        MET  82  -0.155  -4.242   3.141
    2    HA   MET  82           HA       MET  82   1.949  -3.361   4.806
    3    HB2  MET  82           HB2      MET  82   1.700  -3.689   1.814
    4    HB3  MET  82           HB3      MET  82   3.192  -3.125   2.564
    5    HG2  MET  82           HG2      MET  82   1.786  -5.714   3.292
    6    HG3  MET  82           HG3      MET  82   3.145  -5.603   2.178
    7    HE3  MET  82           HE1      MET  82   6.185  -4.885   4.131
    8    HE2  MET  82           HE2      MET  82   5.259  -3.512   3.529
    9    HE1  MET  82           HE3      MET  82   5.333  -4.998   2.586

  No H/Q in entry =           9
  In of MODEL   66
    1    H    THR  83           H        THR  83   0.103  -1.702   2.276
    2    HA   THR  83           HA       THR  83   1.524   0.741   2.358
    3    HB   THR  83           HB       THR  83  -0.660   1.677   1.400
    4    HG1  THR  83           HG1      THR  83  -2.316   0.385   1.306
    5   HG22  THR  83          HG21      THR  83  -0.418  -0.133  -0.612
    6   HG21  THR  83          HG22      THR  83   1.091  -0.434   0.247
    7   HG23  THR  83          HG23      THR  83   0.728   1.183  -0.357

  No H/Q in entry =           7
  In of MODEL   66
    1    H    SER  84           H        SER  84  -1.468  -0.289   3.988
    2    HA   SER  84           HA       SER  84  -1.941   2.137   5.348
    3    HB2  SER  84           HB2      SER  84  -2.777  -0.701   5.910
    4    HB3  SER  84           HB3      SER  84  -3.254   0.637   6.954
    5    HG   SER  84           HG       SER  84  -3.745   0.337   4.166

  No H/Q in entry =           5
  In of MODEL   66
    1    H    MET  85           H        MET  85  -0.228  -0.805   6.446
    2    HA   MET  85           HA       MET  85   0.324   0.108   9.048
    3    HB2  MET  85           HB2      MET  85   0.600  -2.234   8.357
    4    HB3  MET  85           HB3      MET  85   1.973  -1.770   7.350
    5    HG2  MET  85           HG2      MET  85   3.163  -0.938   9.347
    6    HG3  MET  85           HG3      MET  85   1.788  -1.390  10.355
    7    HE3  MET  85           HE1      MET  85   2.111  -3.273  11.823
    8    HE2  MET  85           HE2      MET  85   2.155  -4.914  11.182
    9    HE1  MET  85           HE3      MET  85   0.895  -3.803  10.655

  No H/Q in entry =           9
  In of MODEL   66
    1    H    LEU  86           H        LEU  86   2.226   0.370   6.077
    2    HA   LEU  86           HA       LEU  86   4.458   1.668   7.213
    3    HB2  LEU  86           HB2      LEU  86   4.236   0.596   4.902
    4    HB3  LEU  86           HB3      LEU  86   3.428   2.082   4.405
    5    HG   LEU  86           HG       LEU  86   5.472   3.317   5.367
    6   HD11  LEU  86          HD11      LEU  86   6.176   0.700   6.148
    7   HD13  LEU  86          HD12      LEU  86   7.186   2.140   6.241
    8   HD12  LEU  86          HD13      LEU  86   7.275   1.098   4.824
    9   HD23  LEU  86          HD21      LEU  86   6.156   1.561   3.002
   10   HD22  LEU  86          HD22      LEU  86   6.558   3.256   3.266
   11   HD21  LEU  86          HD23      LEU  86   4.899   2.795   2.884

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ALA  87           H        ALA  87   1.532   2.928   5.666
    2    HA   ALA  87           HA       ALA  87   2.138   5.656   5.754
    3    HB1  ALA  87           HB1      ALA  87  -0.184   4.039   5.233
    4    HB3  ALA  87           HB2      ALA  87   0.128   5.700   4.736
    5    HB2  ALA  87           HB3      ALA  87  -0.650   5.375   6.287

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ARG  88           H        ARG  88   0.467   3.650   8.155
    2    HA   ARG  88           HA       ARG  88  -0.016   5.694  10.016
    3    HB2  ARG  88           HB2      ARG  88  -0.963   3.345  10.083
    4    HB3  ARG  88           HB3      ARG  88   0.584   2.836  10.770
    5    HG2  ARG  88           HG2      ARG  88   0.134   4.906  12.404
    6    HG3  ARG  88           HG3      ARG  88  -1.539   4.589  11.965
    7    HD2  ARG  88           HD2      ARG  88  -1.639   2.735  13.205
    8    HD3  ARG  88           HD3      ARG  88  -0.058   2.150  12.654
    9    HE   ARG  88           HE       ARG  88  -0.560   3.405  15.119
   10   HH21  ARG  88          HH11      ARG  88   1.016   4.406  16.344
   11   HH22  ARG  88          HH12      ARG  88   2.529   4.830  15.624
   12   HH11  ARG  88          HH21      ARG  88   1.692   3.589  12.517
   13   HH12  ARG  88          HH22      ARG  88   2.920   4.351  13.469

  No H/Q in entry =          13
  In of MODEL   66
    1    H    GLU  89           H        GLU  89   2.770   3.467   9.753
    2    HA   GLU  89           HA       GLU  89   4.060   4.342  12.086
    3    HB2  GLU  89           HB2      GLU  89   4.697   2.326  10.727
    4    HB3  GLU  89           HB3      GLU  89   5.464   3.422   9.576
    5    HG2  GLU  89           HG2      GLU  89   6.971   4.257  11.306
    6    HG3  GLU  89           HG3      GLU  89   6.147   3.299  12.532

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LEU  90           H        LEU  90   4.344   5.512   8.759
    2    HA   LEU  90           HA       LEU  90   6.287   7.504   9.331
    3    HB2  LEU  90           HB2      LEU  90   4.255   7.187   7.125
    4    HB3  LEU  90           HB3      LEU  90   5.490   8.454   7.137
    5    HG   LEU  90           HG       LEU  90   6.158   5.514   7.452
    6   HD12  LEU  90          HD11      LEU  90   6.880   5.755   5.005
    7   HD11  LEU  90          HD12      LEU  90   5.869   7.199   4.973
    8   HD13  LEU  90          HD13      LEU  90   5.148   5.627   5.318
    9   HD22  LEU  90          HD21      LEU  90   8.066   6.655   8.117
   10   HD21  LEU  90          HD22      LEU  90   7.710   8.065   7.120
   11   HD23  LEU  90          HD23      LEU  90   8.357   6.601   6.380

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  91           H        ILE  91   2.747   7.530   9.221
    2    HA   ILE  91           HA       ILE  91   2.417  10.301   9.687
    3    HB   ILE  91           HB       ILE  91   0.626   7.928  10.240
    4   HG12  ILE  91          HG12      ILE  91   0.362  10.218   8.267
    5   HG13  ILE  91          HG13      ILE  91   1.213   8.723   7.880
    6   HG22  ILE  91          HG21      ILE  91  -1.100   9.991  10.331
    7   HG21  ILE  91          HG22      ILE  91   0.311  10.815  10.991
    8   HG23  ILE  91          HG23      ILE  91  -0.321   9.376  11.789
    9   HD13  ILE  91          HD11      ILE  91  -0.733   7.440   7.941
   10   HD12  ILE  91          HD12      ILE  91  -1.326   8.960   7.271
   11   HD11  ILE  91          HD13      ILE  91  -1.579   8.590   8.977

  No H/Q in entry =          11
  In of MODEL   66
    1    H    THR  92           H        THR  92   2.838   7.551  11.873
    2    HA   THR  92           HA       THR  92   2.425   8.916  14.307
    3    HB   THR  92           HB       THR  92   4.220   6.580  13.613
    4    HG1  THR  92           HG1      THR  92   2.249   5.827  13.531
    5   HG22  THR  92          HG21      THR  92   3.865   6.286  16.250
    6   HG21  THR  92          HG22      THR  92   3.804   8.046  16.184
    7   HG23  THR  92          HG23      THR  92   5.228   7.189  15.592

  No H/Q in entry =           7
  In of MODEL   66
    1    H    GLU  93           H        GLU  93   5.353   8.468  12.339
    2    HA   GLU  93           HA       GLU  93   7.128   9.886  14.022
    3    HB2  GLU  93           HB2      GLU  93   7.183   9.582  11.005
    4    HB3  GLU  93           HB3      GLU  93   8.536  10.106  12.007
    5    HG2  GLU  93           HG2      GLU  93   7.126   7.470  12.460
    6    HG3  GLU  93           HG3      GLU  93   8.498   7.624  11.369

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LEU  94           H        LEU  94   5.052  10.914  11.336
    2    HA   LEU  94           HA       LEU  94   5.860  13.617  11.236
    3    HB2  LEU  94           HB2      LEU  94   3.260  12.258  10.506
    4    HB3  LEU  94           HB3      LEU  94   3.518  13.986  10.268
    5    HG   LEU  94           HG       LEU  94   5.521  11.999   9.189
    6   HD11  LEU  94          HD11      LEU  94   2.769  12.558   8.158
    7   HD13  LEU  94          HD12      LEU  94   3.748  11.100   8.017
    8   HD12  LEU  94          HD13      LEU  94   4.074  12.484   6.973
    9   HD23  LEU  94          HD21      LEU  94   5.755  13.842   7.470
   10   HD22  LEU  94          HD22      LEU  94   6.188  14.328   9.109
   11   HD21  LEU  94          HD23      LEU  94   4.630  14.800   8.429

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  95           H        ILE  95   3.341  11.996  13.149
    2    HA   ILE  95           HA       ILE  95   2.314  14.343  14.364
    3    HB   ILE  95           HB       ILE  95   2.338  11.458  15.278
    4   HG12  ILE  95          HG12      ILE  95   0.108  13.237  14.259
    5   HG13  ILE  95          HG13      ILE  95   1.052  12.181  13.213
    6   HG21  ILE  95          HG21      ILE  95   1.071  13.927  16.502
    7   HG23  ILE  95          HG22      ILE  95   2.126  12.755  17.291
    8   HG22  ILE  95          HG23      ILE  95   0.486  12.297  16.832
    9   HD13  ILE  95          HD11      ILE  95   0.157  10.240  14.135
   10   HD12  ILE  95          HD12      ILE  95  -1.223  11.330  14.230
   11   HD11  ILE  95          HD13      ILE  95  -0.243  11.026  15.663

  No H/Q in entry =          11
  In of MODEL   66
    1    H    GLU  96           H        GLU  96   4.917  12.119  15.323
    2    HA   GLU  96           HA       GLU  96   5.500  13.308  17.813
    3    HB2  GLU  96           HB2      GLU  96   6.440  11.151  17.148
    4    HB3  GLU  96           HB3      GLU  96   7.360  11.928  15.861
    5    HG2  GLU  96           HG2      GLU  96   9.024  12.470  17.308
    6    HG3  GLU  96           HG3      GLU  96   7.889  13.280  18.378

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LEU  97           H        LEU  97   6.540  14.091  14.519
    2    HA   LEU  97           HA       LEU  97   8.434  16.084  15.218
    3    HB2  LEU  97           HB2      LEU  97   6.816  15.544  12.738
    4    HB3  LEU  97           HB3      LEU  97   7.837  16.975  12.854
    5    HG   LEU  97           HG       LEU  97   8.871  14.175  13.393
    6   HD12  LEU  97          HD11      LEU  97   9.843  14.377  11.066
    7   HD11  LEU  97          HD12      LEU  97   8.789  15.769  10.818
    8   HD13  LEU  97          HD13      LEU  97   8.093  14.176  11.115
    9   HD23  LEU  97          HD21      LEU  97  11.033  15.457  12.631
   10   HD22  LEU  97          HD22      LEU  97  10.431  15.720  14.268
   11   HD21  LEU  97          HD23      LEU  97  10.103  16.908  13.007

  No H/Q in entry =          11
  In of MODEL   66
    1    H    HIS  98           H        HIS  98   4.936  16.222  14.601
    2    HA   HIS  98           HA       HIS  98   4.638  19.021  14.749
    3    HB2  HIS  98           HB2      HIS  98   2.756  16.768  15.487
    4    HB3  HIS  98           HB3      HIS  98   2.289  18.468  15.554
    5    HD1  HIS  98           HD1      HIS  98   3.285  15.762  13.129
    6    HD2  HIS  98           HD2      HIS  98   1.908  19.695  13.035
    7    HE1  HIS  98           HE1      HIS  98   2.700  16.259  10.713
    8    HE2  HIS  98           HE2      HIS  98   1.865  18.649  10.635

  No H/Q in entry =           8
  In of MODEL   66
    1    H    GLU  99           H        GLU  99   4.798  16.524  17.238
    2    HA   GLU  99           HA       GLU  99   4.213  18.210  19.448
    3    HB2  GLU  99           HB2      GLU  99   4.125  15.728  19.537
    4    HB3  GLU  99           HB3      GLU  99   5.884  15.684  19.410
    5    HG2  GLU  99           HG2      GLU  99   6.094  16.969  21.487
    6    HG3  GLU  99           HG3      GLU  99   4.343  17.109  21.602

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LYS 100           H        LYS 100   7.250  17.286  17.848
    2    HA   LYS 100           HA       LYS 100   8.924  18.680  19.692
    3    HB2  LYS 100           HB2      LYS 100   9.393  17.766  16.845
    4    HB3  LYS 100           HB3      LYS 100  10.633  18.532  17.842
    5    HG2  LYS 100           HG2      LYS 100  10.276  16.775  19.581
    6    HG3  LYS 100           HG3      LYS 100   9.133  15.975  18.499
    7    HD2  LYS 100           HD2      LYS 100  10.909  15.699  16.812
    8    HD3  LYS 100           HD3      LYS 100  12.057  16.511  17.879
    9    HE2  LYS 100           HE2      LYS 100  11.679  14.749  19.595
   10    HE3  LYS 100           HE3      LYS 100  10.592  13.917  18.478
   11    HZ1  LYS 100           HZ1      LYS 100  13.406  14.590  17.795
   12    HZ3  LYS 100           HZ2      LYS 100  12.353  13.537  16.974
   13    HZ2  LYS 100           HZ3      LYS 100  12.958  13.113  18.505

  No H/Q in entry =          13
  In of MODEL   66
    1    H    LEU 101           H        LEU 101   7.199  19.617  16.758
    2    HA   LEU 101           HA       LEU 101   8.409  22.176  16.419
    3    HB2  LEU 101           HB2      LEU 101   5.805  20.945  15.555
    4    HB3  LEU 101           HB3      LEU 101   6.054  22.677  15.352
    5    HG   LEU 101           HG       LEU 101   8.079  20.664  14.357
    6   HD12  LEU 101          HD11      LEU 101   6.902  21.178  12.086
    7   HD11  LEU 101          HD12      LEU 101   5.513  21.605  13.083
    8   HD13  LEU 101          HD13      LEU 101   6.178  19.974  13.152
    9   HD21  LEU 101          HD21      LEU 101   7.446  23.578  13.819
   10   HD23  LEU 101          HD22      LEU 101   8.414  22.622  12.698
   11   HD22  LEU 101          HD23      LEU 101   8.974  22.874  14.351

  No H/Q in entry =          11
  In of MODEL   66
    1    H    LYS 102           H        LYS 102   6.900  21.028  19.047
    2    HA   LYS 102           HA       LYS 102   6.289  22.113  20.990
    3    HB2  LYS 102           HB2      LYS 102   7.560  24.107  19.859
    4    HB3  LYS 102           HB3      LYS 102   5.957  24.713  19.503
    5    HG2  LYS 102           HG2      LYS 102   7.362  24.447  22.139
    6    HG3  LYS 102           HG3      LYS 102   6.403  25.778  21.525
    7    HD2  LYS 102           HD2      LYS 102   5.168  23.139  22.407
    8    HD3  LYS 102           HD3      LYS 102   5.428  24.496  23.493
    9    HE2  LYS 102           HE2      LYS 102   3.133  24.099  22.027
   10    HE3  LYS 102           HE3      LYS 102   3.644  25.642  22.709
   11    HZ2  LYS 102           HZ1      LYS 102   3.088  25.759  20.336
   12    HZ1  LYS 102           HZ2      LYS 102   4.346  24.678  19.995
   13    HZ3  LYS 102           HZ3      LYS 102   4.696  26.206  20.640

  No H/Q in entry =          13
  In of MODEL   66
    1    H    ALA 103           H        ALA 103   4.622  23.666  18.246
    2    HA   ALA 103           HA       ALA 103   2.177  24.240  19.159
    3    HB1  ALA 103           HB1      ALA 103   1.255  23.407  16.923
    4    HB2  ALA 103           HB2      ALA 103   2.898  22.871  16.574
    5    HB3  ALA 103           HB3      ALA 103   2.567  24.582  16.850

  No H/Q in entry =           5
  In of MODEL   66
    1    H1   ALA   1           H3       ALA   1  10.490 -20.167  -6.372
    2    H2   ALA   1           H2       ALA   1   9.511 -20.368  -7.749
    3    H3   ALA   1           H1       ALA   1   9.089 -21.119  -6.284
    4    HA   ALA   1           HA       ALA   1  10.119 -22.926  -7.041
    5    HB1  ALA   1           HB1      ALA   1  10.190 -22.558  -9.316
    6    HB2  ALA   1           HB2      ALA   1  11.921 -22.411  -9.006
    7    HB3  ALA   1           HB3      ALA   1  10.922 -20.962  -9.140

  No H/Q in entry =           7
  In of MODEL   66
    1    H    GLU   2           H        GLU   2  12.401 -23.879  -7.128
    2    HA   GLU   2           HA       GLU   2  13.806 -23.807  -4.931
    3    HB2  GLU   2           HB2      GLU   2  15.133 -23.666  -7.644
    4    HB3  GLU   2           HB3      GLU   2  15.877 -24.284  -6.170
    5    HG2  GLU   2           HG2      GLU   2  14.855 -26.299  -6.407
    6    HG3  GLU   2           HG3      GLU   2  13.282 -25.550  -6.646

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLU   3           H        GLU   3  15.553 -21.935  -7.344
    2    HA   GLU   3           HA       GLU   3  16.730 -20.257  -5.391
    3    HB2  GLU   3           HB2      GLU   3  16.641 -20.243  -8.400
    4    HB3  GLU   3           HB3      GLU   3  17.398 -18.918  -7.516
    5    HG2  GLU   3           HG2      GLU   3  19.069 -20.297  -6.617
    6    HG3  GLU   3           HG3      GLU   3  18.118 -21.763  -6.833

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LEU   4           H        LEU   4  14.420 -19.396  -7.993
    2    HA   LEU   4           HA       LEU   4  13.963 -16.789  -7.367
    3    HB2  LEU   4           HB2      LEU   4  11.778 -18.758  -8.081
    4    HB3  LEU   4           HB3      LEU   4  11.703 -17.008  -8.272
    5    HG   LEU   4           HG       LEU   4  13.650 -18.869  -9.673
    6   HD13  LEU   4          HD11      LEU   4  12.327 -18.711 -11.568
    7   HD12  LEU   4          HD12      LEU   4  11.626 -17.167 -11.087
    8   HD11  LEU   4          HD13      LEU   4  11.079 -18.660 -10.326
    9   HD23  LEU   4          HD21      LEU   4  13.974 -16.619 -11.020
   10   HD22  LEU   4          HD22      LEU   4  14.850 -16.868  -9.511
   11   HD21  LEU   4          HD23      LEU   4  13.399 -15.870  -9.530

  No H/Q in entry =          11
  In of MODEL   66
    1    H    GLU   5           H        GLU   5  12.493 -19.577  -5.719
    2    HA   GLU   5           HA       GLU   5  10.837 -18.010  -3.992
    3    HB2  GLU   5           HB2      GLU   5  10.393 -20.381  -4.512
    4    HB3  GLU   5           HB3      GLU   5  11.846 -20.830  -3.616
    5    HG2  GLU   5           HG2      GLU   5  10.925 -19.817  -1.578
    6    HG3  GLU   5           HG3      GLU   5   9.485 -19.321  -2.465

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLU   6           H        GLU   6  13.986 -19.595  -3.590
    2    HA   GLU   6           HA       GLU   6  14.370 -18.750  -0.892
    3    HB2  GLU   6           HB2      GLU   6  15.584 -20.662  -1.896
    4    HB3  GLU   6           HB3      GLU   6  16.430 -19.543  -2.967
    5    HG2  GLU   6           HG2      GLU   6  17.406 -18.392  -1.040
    6    HG3  GLU   6           HG3      GLU   6  16.515 -19.441   0.062

  No H/Q in entry =           6
  In of MODEL   66
    1    H    VAL   7           H        VAL   7  15.102 -17.412  -4.045
    2    HA   VAL   7           HA       VAL   7  16.799 -15.290  -3.191
    3    HB   VAL   7           HB       VAL   7  15.066 -15.643  -5.651
    4   HG11  VAL   7          HG11      VAL   7  16.970 -13.434  -4.851
    5   HG13  VAL   7          HG12      VAL   7  15.321 -13.288  -5.456
    6   HG12  VAL   7          HG13      VAL   7  16.618 -13.787  -6.542
    7   HG21  VAL   7          HG21      VAL   7  17.178 -17.103  -5.111
    8   HG23  VAL   7          HG22      VAL   7  18.079 -15.641  -5.514
    9   HG22  VAL   7          HG23      VAL   7  17.029 -16.386  -6.716

  No H/Q in entry =           9
  In of MODEL   66
    1    H    VAL   8           H        VAL   8  13.300 -15.555  -3.710
    2    HA   VAL   8           HA       VAL   8  12.642 -12.848  -3.221
    3    HB   VAL   8           HB       VAL   8  11.079 -15.415  -2.901
    4   HG11  VAL   8          HG11      VAL   8  10.286 -12.563  -2.296
    5   HG13  VAL   8          HG12      VAL   8  10.061 -13.997  -1.295
    6   HG12  VAL   8          HG13      VAL   8   9.088 -13.775  -2.748
    7   HG23  VAL   8          HG21      VAL   8   9.923 -13.618  -4.782
    8   HG22  VAL   8          HG22      VAL   8  10.789 -15.112  -5.130
    9   HG21  VAL   8          HG23      VAL   8  11.660 -13.583  -5.084

  No H/Q in entry =           9
  In of MODEL   66
    1    H    MET   9           H        MET   9  12.931 -15.663  -1.055
    2    HA   MET   9           HA       MET   9  12.143 -14.400   1.329
    3    HB2  MET   9           HB2      MET   9  14.014 -16.687   0.739
    4    HB3  MET   9           HB3      MET   9  13.794 -16.097   2.387
    5    HG2  MET   9           HG2      MET   9  11.260 -16.330   1.924
    6    HG3  MET   9           HG3      MET   9  11.744 -17.321   0.546
    7    HE3  MET   9           HE1      MET   9  13.484 -20.345   1.947
    8    HE2  MET   9           HE2      MET   9  14.257 -18.876   1.356
    9    HE1  MET   9           HE3      MET   9  12.808 -19.484   0.560

  No H/Q in entry =           9
  In of MODEL   66
    1    H    GLY  10           H        GLY  10  15.306 -14.619  -0.263
    2    HA3  GLY  10           HA2      GLY  10  16.787 -13.206   1.696
    3    HA2  GLY  10           HA3      GLY  10  17.232 -13.364  -0.003

  No H/Q in entry =           3
  In of MODEL   66
    1    H    LEU  11           H        LEU  11  15.050 -12.139  -1.214
    2    HA   LEU  11           HA       LEU  11  15.736  -9.394  -1.048
    3    HB2  LEU  11           HB2      LEU  11  13.355 -10.800  -2.262
    4    HB3  LEU  11           HB3      LEU  11  13.633  -9.065  -2.418
    5    HG   LEU  11           HG       LEU  11  15.653 -11.170  -3.236
    6   HD13  LEU  11          HD11      LEU  11  13.890 -11.531  -4.738
    7   HD12  LEU  11          HD12      LEU  11  14.883 -10.346  -5.585
    8   HD11  LEU  11          HD13      LEU  11  13.419  -9.831  -4.749
    9   HD22  LEU  11          HD21      LEU  11  16.886  -9.206  -3.016
   10   HD21  LEU  11          HD22      LEU  11  15.506  -8.169  -3.376
   11   HD23  LEU  11          HD23      LEU  11  16.324  -9.032  -4.677

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  12           H        ILE  12  12.982 -11.226   0.243
    2    HA   ILE  12           HA       ILE  12  11.599  -9.008   1.326
    3    HB   ILE  12           HB       ILE  12  11.648 -11.893   2.267
    4   HG12  ILE  12          HG12      ILE  12  10.938 -11.250  -0.175
    5   HG13  ILE  12          HG13      ILE  12   9.927 -12.351   0.742
    6   HG23  ILE  12          HG21      ILE  12  10.692 -10.582   4.029
    7   HG22  ILE  12          HG22      ILE  12   9.327 -11.265   3.149
    8   HG21  ILE  12          HG23      ILE  12   9.791  -9.584   2.890
    9   HD11  ILE  12          HD11      ILE  12   9.479  -9.362   0.543
   10   HD13  ILE  12          HD12      ILE  12   8.399 -10.547   1.274
   11   HD12  ILE  12          HD13      ILE  12   8.664 -10.553  -0.456

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  13           H        ILE  13  14.009 -11.215   2.697
    2    HA   ILE  13           HA       ILE  13  14.072 -10.046   5.282
    3    HB   ILE  13           HB       ILE  13  16.118 -11.608   3.687
    4   HG12  ILE  13          HG12      ILE  13  13.863 -12.599   4.525
    5   HG13  ILE  13          HG13      ILE  13  15.343 -13.504   4.823
    6   HG22  ILE  13          HG21      ILE  13  17.212 -11.969   5.973
    7   HG21  ILE  13          HG22      ILE  13  16.264 -10.602   6.544
    8   HG23  ILE  13          HG23      ILE  13  17.444 -10.377   5.252
    9   HD13  ILE  13          HD11      ILE  13  15.256 -13.141   7.107
   10   HD12  ILE  13          HD12      ILE  13  13.538 -12.983   6.757
   11   HD11  ILE  13          HD13      ILE  13  14.536 -11.544   6.915

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ASN  14           H        ASN  14  15.993  -9.501   2.344
    2    HA   ASN  14           HA       ASN  14  17.744  -7.559   3.394
    3    HB2  ASN  14           HB2      ASN  14  17.700  -8.817   1.074
    4    HB3  ASN  14           HB3      ASN  14  16.798  -7.400   0.552
    5   HD21  ASN  14          HD21      ASN  14  19.226  -7.729  -0.661
    6   HD22  ASN  14          HD22      ASN  14  20.373  -6.646  -0.042

  No H/Q in entry =           6
  In of MODEL   66
    1    H    SER  15           H        SER  15  14.615  -7.213   1.737
    2    HA   SER  15           HA       SER  15  14.496  -4.393   1.805
    3    HB2  SER  15           HB2      SER  15  12.159  -4.643   1.334
    4    HB3  SER  15           HB3      SER  15  12.951  -6.004   0.550
    5    HG   SER  15           HG       SER  15  11.569  -7.118   1.684

  No H/Q in entry =           5
  In of MODEL   66
    1    H    GLY  16           H        GLY  16  13.434  -6.865   4.111
    2    HA3  GLY  16           HA2      GLY  16  12.228  -5.127   5.988
    3    HA2  GLY  16           HA3      GLY  16  12.851  -6.734   6.338

  No H/Q in entry =           3
  In of MODEL   66
    1    H    GLN  17           H        GLN  17  15.555  -6.391   5.718
    2    HA   GLN  17           HA       GLN  17  16.533  -5.176   8.093
    3    HB2  GLN  17           HB2      GLN  17  17.927  -6.014   5.536
    4    HB3  GLN  17           HB3      GLN  17  18.788  -5.416   6.956
    5    HG2  GLN  17           HG2      GLN  17  16.910  -7.794   6.957
    6    HG3  GLN  17           HG3      GLN  17  18.668  -7.905   6.895
    7   HE21  GLN  17          HE21      GLN  17  16.249  -8.273   9.057
    8   HE22  GLN  17          HE22      GLN  17  17.006  -7.705  10.466

  No H/Q in entry =           8
  In of MODEL   66
    1    H    ALA  18           H        ALA  18  16.305  -4.086   4.739
    2    HA   ALA  18           HA       ALA  18  17.736  -1.690   4.960
    3    HB2  ALA  18           HB1      ALA  18  16.600  -2.901   2.899
    4    HB3  ALA  18           HB2      ALA  18  16.859  -1.156   2.888
    5    HB1  ALA  18           HB3      ALA  18  15.266  -1.809   3.272

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ARG  19           H        ARG  19  14.242  -2.291   5.391
    2    HA   ARG  19           HA       ARG  19  13.573   0.354   6.123
    3    HB2  ARG  19           HB2      ARG  19  11.892  -1.401   5.548
    4    HB3  ARG  19           HB3      ARG  19  12.252  -2.204   7.078
    5    HG2  ARG  19           HG2      ARG  19  11.549  -0.220   8.333
    6    HG3  ARG  19           HG3      ARG  19  11.280   0.662   6.830
    7    HD2  ARG  19           HD2      ARG  19   9.150  -0.145   7.670
    8    HD3  ARG  19           HD3      ARG  19   9.556  -1.018   6.186
    9    HE   ARG  19           HE       ARG  19  10.542  -2.565   8.275
   10   HH21  ARG  19          HH11      ARG  19   9.308  -4.213   9.220
   11   HH22  ARG  19          HH12      ARG  19   7.587  -4.190   9.068
   12   HH11  ARG  19          HH21      ARG  19   7.532  -1.278   7.216
   13   HH12  ARG  19          HH22      ARG  19   6.581  -2.529   7.929

  No H/Q in entry =          13
  In of MODEL   66
    1    H    SER  20           H        SER  20  14.461  -2.481   8.063
    2    HA   SER  20           HA       SER  20  14.201  -1.392  10.607
    3    HB2  SER  20           HB2      SER  20  14.674  -3.714  10.476
    4    HB3  SER  20           HB3      SER  20  16.110  -3.444   9.493
    5    HG   SER  20           HG       SER  20  15.726  -3.195  12.235

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LEU  21           H        LEU  21  17.021  -1.312   8.441
    2    HA   LEU  21           HA       LEU  21  18.709   0.173  10.168
    3    HB2  LEU  21           HB2      LEU  21  18.656  -0.095   7.154
    4    HB3  LEU  21           HB3      LEU  21  19.913   0.777   8.027
    5    HG   LEU  21           HG       LEU  21  19.205  -2.119   8.581
    6   HD13  LEU  21          HD11      LEU  21  21.173  -2.709   7.249
    7   HD12  LEU  21          HD12      LEU  21  21.471  -1.007   6.895
    8   HD11  LEU  21          HD13      LEU  21  20.033  -1.800   6.256
    9   HD23  LEU  21          HD21      LEU  21  21.696  -1.941   9.443
   10   HD22  LEU  21          HD22      LEU  21  20.400  -1.344  10.473
   11   HD21  LEU  21          HD23      LEU  21  21.358  -0.216   9.529

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ALA  22           H        ALA  22  16.415   1.144   7.639
    2    HA   ALA  22           HA       ALA  22  16.945   3.904   7.658
    3    HB3  ALA  22           HB1      ALA  22  15.529   2.663   5.990
    4    HB2  ALA  22           HB2      ALA  22  14.823   4.171   6.570
    5    HB1  ALA  22           HB3      ALA  22  14.244   2.628   7.197

  No H/Q in entry =           5
  In of MODEL   66
    1    H    TYR  23           H        TYR  23  14.473   2.073   9.512
    2    HA   TYR  23           HA       TYR  23  13.518   4.301  10.980
    3    HB2  TYR  23           HB2      TYR  23  12.290   2.182  10.963
    4    HB3  TYR  23           HB3      TYR  23  13.633   1.374  11.773
    5    HD1  TYR  23           HD1      TYR  23  11.113   4.097  12.168
    6    HD2  TYR  23           HD2      TYR  23  13.860   1.439  14.128
    7    HE1  TYR  23           HE1      TYR  23  10.203   4.781  14.373
    8    HE2  TYR  23           HE2      TYR  23  12.950   2.122  16.331
    9    HH   TYR  23           HH       TYR  23  11.428   4.703  16.970

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ALA  24           H        ALA  24  16.177   2.031  11.581
    2    HA   ALA  24           HA       ALA  24  16.871   3.019  14.141
    3    HB1  ALA  24           HB1      ALA  24  18.231   1.230  13.955
    4    HB3  ALA  24           HB2      ALA  24  19.244   2.159  12.849
    5    HB2  ALA  24           HB3      ALA  24  17.946   1.149  12.217

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ALA  25           H        ALA  25  17.791   3.963  10.856
    2    HA   ALA  25           HA       ALA  25  19.737   5.900  11.489
    3    HB1  ALA  25           HB1      ALA  25  19.000   4.959   9.178
    4    HB3  ALA  25           HB2      ALA  25  19.497   6.648   9.272
    5    HB2  ALA  25           HB3      ALA  25  17.783   6.236   9.219

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LEU  26           H        LEU  26  16.218   6.121  11.165
    2    HA   LEU  26           HA       LEU  26  15.992   8.901  11.629
    3    HB2  LEU  26           HB2      LEU  26  14.124   7.664  10.716
    4    HB3  LEU  26           HB3      LEU  26  14.050   6.630  12.138
    5    HG   LEU  26           HG       LEU  26  13.454   8.581  13.532
    6   HD12  LEU  26          HD11      LEU  26  12.774  10.685  12.222
    7   HD11  LEU  26          HD12      LEU  26  13.743  10.040  10.900
    8   HD13  LEU  26          HD13      LEU  26  14.503  10.421  12.446
    9   HD21  LEU  26          HD21      LEU  26  11.753   8.274  11.039
   10   HD23  LEU  26          HD22      LEU  26  11.207   8.964  12.564
   11   HD22  LEU  26          HD23      LEU  26  11.662   7.264  12.482

  No H/Q in entry =          11
  In of MODEL   66
    1    H    LYS  27           H        LYS  27  15.913   6.112  13.813
    2    HA   LYS  27           HA       LYS  27  15.341   7.468  16.192
    3    HB2  LYS  27           HB2      LYS  27  15.372   4.994  15.917
    4    HB3  LYS  27           HB3      LYS  27  17.135   5.050  15.856
    5    HG2  LYS  27           HG2      LYS  27  17.206   6.027  18.109
    6    HG3  LYS  27           HG3      LYS  27  15.440   6.041  18.172
    7    HD2  LYS  27           HD2      LYS  27  15.417   3.575  17.926
    8    HD3  LYS  27           HD3      LYS  27  17.181   3.568  17.896
    9    HE2  LYS  27           HE2      LYS  27  17.237   4.548  20.156
   10    HE3  LYS  27           HE3      LYS  27  15.471   4.585  20.189
   11    HZ3  LYS  27           HZ1      LYS  27  16.275   2.630  21.324
   12    HZ2  LYS  27           HZ2      LYS  27  17.178   2.158  19.962
   13    HZ1  LYS  27           HZ3      LYS  27  15.479   2.160  19.900

  No H/Q in entry =          13
  In of MODEL   66
    1    H    GLN  28           H        GLN  28  18.442   6.897  14.566
    2    HA   GLN  28           HA       GLN  28  20.145   7.975  16.543
    3    HB2  GLN  28           HB2      GLN  28  20.400   7.939  13.525
    4    HB3  GLN  28           HB3      GLN  28  21.697   8.413  14.622
    5    HG2  GLN  28           HG2      GLN  28  20.287   5.732  14.692
    6    HG3  GLN  28           HG3      GLN  28  21.848   6.020  13.926
    7   HE21  GLN  28          HE21      GLN  28  20.688   4.673  16.643
    8   HE22  GLN  28          HE22      GLN  28  21.893   5.115  17.754

  No H/Q in entry =           8
  In of MODEL   66
    1    H    ALA  29           H        ALA  29  18.364   9.467  13.875
    2    HA   ALA  29           HA       ALA  29  19.362  12.087  14.128
    3    HB2  ALA  29           HB1      ALA  29  17.648  12.728  12.677
    4    HB1  ALA  29           HB2      ALA  29  16.512  11.551  13.335
    5    HB3  ALA  29           HB3      ALA  29  17.832  11.014  12.296

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LYS  30           H        LYS  30  16.603  10.479  15.671
    2    HA   LYS  30           HA       LYS  30  15.601  12.727  17.048
    3    HB2  LYS  30           HB2      LYS  30  15.499   9.783  17.741
    4    HB3  LYS  30           HB3      LYS  30  14.642  11.029  18.648
    5    HG2  LYS  30           HG2      LYS  30  13.495  11.723  16.545
    6    HG3  LYS  30           HG3      LYS  30  14.291  10.390  15.704
    7    HD2  LYS  30           HD2      LYS  30  13.236   8.776  17.237
    8    HD3  LYS  30           HD3      LYS  30  12.450  10.098  18.102
    9    HE2  LYS  30           HE2      LYS  30  11.260  10.738  16.024
   10    HE3  LYS  30           HE3      LYS  30  12.026   9.388  15.179
   11    HZ2  LYS  30           HZ1      LYS  30   9.727   8.974  16.082
   12    HZ1  LYS  30           HZ2      LYS  30  10.411   9.021  17.642
   13    HZ3  LYS  30           HZ3      LYS  30  10.908   7.841  16.522

  No H/Q in entry =          13
  In of MODEL   66
    1    H    GLN  31           H        GLN  31  18.271  10.555  17.748
    2    HA   GLN  31           HA       GLN  31  18.626  11.559  20.443
    3    HB2  GLN  31           HB2      GLN  31  20.632   9.995  18.811
    4    HB3  GLN  31           HB3      GLN  31  20.516  10.112  20.567
    5    HG2  GLN  31           HG2      GLN  31  17.995   9.162  19.821
    6    HG3  GLN  31           HG3      GLN  31  19.086   8.323  18.726
    7   HE21  GLN  31          HE21      GLN  31  17.567   7.167  21.014
    8   HE22  GLN  31          HE22      GLN  31  18.734   6.502  22.049

  No H/Q in entry =           8
  In of MODEL   66
    1    H    GLY  32           H        GLY  32  19.114  12.888  17.477
    2    HA3  GLY  32           HA2      GLY  32  20.092  14.936  16.961
    3    HA2  GLY  32           HA3      GLY  32  20.866  14.934  18.541

  No H/Q in entry =           3
  In of MODEL   66
    1    H    ASP  33           H        ASP  33  21.270  12.049  16.748
    2    HA   ASP  33           HA       ASP  33  24.091  12.727  16.255
    3    HB2  ASP  33           HB2      ASP  33  22.584  10.110  16.376
    4    HB3  ASP  33           HB3      ASP  33  24.265  10.229  15.864

  No H/Q in entry =           4
  In of MODEL   66
    1    H    PHE  34           H        PHE  34  23.589  14.058  14.384
    2    HA   PHE  34           HA       PHE  34  22.217  13.082  12.107
    3    HB2  PHE  34           HB2      PHE  34  24.349  15.217  12.323
    4    HB3  PHE  34           HB3      PHE  34  23.349  14.932  10.901
    5    HD1  PHE  34           HD1      PHE  34  23.630  16.854  13.820
    6    HD2  PHE  34           HD2      PHE  34  20.728  14.747  11.455
    7    HE1  PHE  34           HE1      PHE  34  21.823  18.247  14.791
    8    HE2  PHE  34           HE2      PHE  34  18.925  16.140  12.430
    9    HZ   PHE  34           HZ       PHE  34  19.476  17.890  14.093

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ALA  35           H        ALA  35  25.601  12.892  13.079
    2    HA   ALA  35           HA       ALA  35  26.682  12.082  10.607
    3    HB3  ALA  35           HB1      ALA  35  28.381  10.906  12.304
    4    HB2  ALA  35           HB2      ALA  35  27.528  11.927  13.463
    5    HB1  ALA  35           HB3      ALA  35  28.350  12.656  12.085

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ALA  36           H        ALA  36  25.596  10.114  13.376
    2    HA   ALA  36           HA       ALA  36  26.069   7.632  12.085
    3    HB2  ALA  36           HB1      ALA  36  25.661   6.877  14.162
    4    HB3  ALA  36           HB2      ALA  36  23.971   7.371  14.032
    5    HB1  ALA  36           HB3      ALA  36  25.177   8.501  14.646

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ALA  37           H        ALA  37  23.247   9.755  12.257
    2    HA   ALA  37           HA       ALA  37  21.380   7.988  11.093
    3    HB3  ALA  37           HB1      ALA  37  21.606  10.950  11.395
    4    HB1  ALA  37           HB2      ALA  37  20.300   9.868  11.877
    5    HB2  ALA  37           HB3      ALA  37  20.471  10.347  10.188

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LYS  38           H        LYS  38  23.461  10.458   9.603
    2    HA   LYS  38           HA       LYS  38  22.794  10.040   6.931
    3    HB2  LYS  38           HB2      LYS  38  24.617  11.594   8.363
    4    HB3  LYS  38           HB3      LYS  38  25.641  10.610   7.323
    5    HG2  LYS  38           HG2      LYS  38  24.454  11.387   5.342
    6    HG3  LYS  38           HG3      LYS  38  23.268  12.236   6.339
    7    HD2  LYS  38           HD2      LYS  38  24.869  13.834   7.081
    8    HD3  LYS  38           HD3      LYS  38  26.225  12.852   6.527
    9    HE2  LYS  38           HE2      LYS  38  25.849  14.729   4.987
   10    HE3  LYS  38           HE3      LYS  38  25.508  13.194   4.180
   11    HZ3  LYS  38           HZ1      LYS  38  23.309  13.636   4.075
   12    HZ2  LYS  38           HZ2      LYS  38  23.830  15.251   4.164
   13    HZ1  LYS  38           HZ3      LYS  38  23.272  14.461   5.559

  No H/Q in entry =          13
  In of MODEL   66
    1    H    ALA  39           H        ALA  39  25.331   8.439   8.854
    2    HA   ALA  39           HA       ALA  39  26.382   6.861   6.767
    3    HB2  ALA  39           HB1      ALA  39  26.325   5.886   9.607
    4    HB1  ALA  39           HB2      ALA  39  27.270   7.315   9.187
    5    HB3  ALA  39           HB3      ALA  39  27.617   5.768   8.413

  No H/Q in entry =           5
  In of MODEL   66
    1    H    MET  40           H        MET  40  23.794   6.230   9.089
    2    HA   MET  40           HA       MET  40  23.349   3.527   8.349
    3    HB2  MET  40           HB2      MET  40  21.542   5.562   9.668
    4    HB3  MET  40           HB3      MET  40  21.137   3.853   9.491
    5    HG2  MET  40           HG2      MET  40  23.699   4.794  10.809
    6    HG3  MET  40           HG3      MET  40  22.214   4.511  11.716
    7    HE3  MET  40           HE1      MET  40  21.661   0.876  11.883
    8    HE2  MET  40           HE2      MET  40  20.781   2.180  11.090
    9    HE1  MET  40           HE3      MET  40  21.537   2.462  12.656

  No H/Q in entry =           9
  In of MODEL   66
    1    H    MET  41           H        MET  41  21.916   6.582   7.189
    2    HA   MET  41           HA       MET  41  19.944   5.389   5.533
    3    HB2  MET  41           HB2      MET  41  21.414   7.985   5.015
    4    HB3  MET  41           HB3      MET  41  19.880   7.491   4.310
    5    HG2  MET  41           HG2      MET  41  19.161   7.290   6.868
    6    HG3  MET  41           HG3      MET  41  20.469   8.450   7.081
    7    HE2  MET  41           HE1      MET  41  19.868   9.750   3.756
    8    HE1  MET  41           HE2      MET  41  20.839  10.186   5.159
    9    HE3  MET  41           HE3      MET  41  19.558  11.265   4.613

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ASP  42           H        ASP  42  23.309   6.323   4.948
    2    HA   ASP  42           HA       ASP  42  23.373   5.860   2.188
    3    HB2  ASP  42           HB2      ASP  42  25.140   6.855   3.942
    4    HB3  ASP  42           HB3      ASP  42  25.800   5.232   3.801

  No H/Q in entry =           4
  In of MODEL   66
    1    H    GLN  43           H        GLN  43  24.131   3.697   4.891
    2    HA   GLN  43           HA       GLN  43  24.784   1.447   3.292
    3    HB2  GLN  43           HB2      GLN  43  23.791   1.616   6.148
    4    HB3  GLN  43           HB3      GLN  43  24.366   0.132   5.380
    5    HG2  GLN  43           HG2      GLN  43  26.521   1.350   4.851
    6    HG3  GLN  43           HG3      GLN  43  25.945   2.672   5.863
    7   HE21  GLN  43          HE21      GLN  43  28.192   1.700   6.872
    8   HE22  GLN  43          HE22      GLN  43  27.933   0.612   8.146

  No H/Q in entry =           8
  In of MODEL   66
    1    H    SER  44           H        SER  44  21.740   2.567   4.714
    2    HA   SER  44           HA       SER  44  20.170   0.323   4.049
    3    HB2  SER  44           HB2      SER  44  19.734   2.845   5.210
    4    HB3  SER  44           HB3      SER  44  18.685   2.806   3.795
    5    HG   SER  44           HG       SER  44  17.612   1.852   5.526

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ARG  45           H        ARG  45  20.886   3.297   2.249
    2    HA   ARG  45           HA       ARG  45  19.338   2.816  -0.042
    3    HB2  ARG  45           HB2      ARG  45  20.483   4.953   0.539
    4    HB3  ARG  45           HB3      ARG  45  22.025   4.204   0.134
    5    HG2  ARG  45           HG2      ARG  45  21.218   3.806  -2.173
    6    HG3  ARG  45           HG3      ARG  45  19.688   4.578  -1.767
    7    HD2  ARG  45           HD2      ARG  45  20.939   6.675  -1.188
    8    HD3  ARG  45           HD3      ARG  45  22.432   5.907  -1.775
    9    HE   ARG  45           HE       ARG  45  20.480   5.673  -3.792
   10   HH21  ARG  45          HH11      ARG  45  20.451   7.050  -5.549
   11   HH22  ARG  45          HH12      ARG  45  21.206   8.601  -5.446
   12   HH11  ARG  45          HH21      ARG  45  22.222   8.169  -2.173
   13   HH12  ARG  45          HH22      ARG  45  22.207   9.234  -3.532

  No H/Q in entry =          13
  In of MODEL   66
    1    H    MET  46           H        MET  46  22.712   1.946   0.666
    2    HA   MET  46           HA       MET  46  23.294   0.765  -1.829
    3    HB2  MET  46           HB2      MET  46  24.431   0.431   0.946
    4    HB3  MET  46           HB3      MET  46  25.073  -0.458  -0.438
    5    HG2  MET  46           HG2      MET  46  25.445   1.687  -1.628
    6    HG3  MET  46           HG3      MET  46  24.842   2.560  -0.225
    7    HE1  MET  46           HE1      MET  46  25.924   2.889   1.912
    8    HE3  MET  46           HE2      MET  46  26.735   3.929   0.746
    9    HE2  MET  46           HE3      MET  46  27.681   3.082   1.969

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ALA  47           H        ALA  47  21.946  -0.583   1.156
    2    HA   ALA  47           HA       ALA  47  21.888  -3.293   0.343
    3    HB2  ALA  47           HB1      ALA  47  21.534  -2.842   2.654
    4    HB3  ALA  47           HB2      ALA  47  19.991  -3.445   2.049
    5    HB1  ALA  47           HB3      ALA  47  20.221  -1.715   2.312

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LEU  48           H        LEU  48  19.527  -0.668   0.023
    2    HA   LEU  48           HA       LEU  48  17.471  -2.200  -1.211
    3    HB2  LEU  48           HB2      LEU  48  18.120   0.756  -1.321
    4    HB3  LEU  48           HB3      LEU  48  16.642   0.046  -1.974
    5    HG   LEU  48           HG       LEU  48  17.529  -0.266   0.903
    6   HD13  LEU  48          HD11      LEU  48  17.106   2.035   0.730
    7   HD12  LEU  48          HD12      LEU  48  15.554   1.384   1.255
    8   HD11  LEU  48          HD13      LEU  48  15.805   1.812  -0.438
    9   HD22  LEU  48          HD21      LEU  48  15.998  -1.981   0.534
   10   HD21  LEU  48          HD22      LEU  48  15.109  -1.074  -0.691
   11   HD23  LEU  48          HD23      LEU  48  14.915  -0.677   1.016

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ASN  49           H        ASN  49  20.142  -0.264  -2.465
    2    HA   ASN  49           HA       ASN  49  19.460  -0.338  -5.181
    3    HB2  ASN  49           HB2      ASN  49  21.153   1.171  -4.249
    4    HB3  ASN  49           HB3      ASN  49  22.194  -0.197  -3.874
    5   HD21  ASN  49          HD21      ASN  49  23.882   0.595  -5.293
    6   HD22  ASN  49          HD22      ASN  49  23.720   0.542  -6.982

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLU  50           H        GLU  50  21.469  -2.537  -3.250
    2    HA   GLU  50           HA       GLU  50  22.148  -4.285  -5.390
    3    HB2  GLU  50           HB2      GLU  50  23.371  -4.266  -3.238
    4    HB3  GLU  50           HB3      GLU  50  21.938  -4.898  -2.428
    5    HG2  GLU  50           HG2      GLU  50  22.013  -6.926  -3.795
    6    HG3  GLU  50           HG3      GLU  50  23.378  -6.289  -4.710

  No H/Q in entry =           6
  In of MODEL   66
    1    H    ALA  51           H        ALA  51  19.519  -4.230  -3.033
    2    HA   ALA  51           HA       ALA  51  18.346  -6.702  -3.785
    3    HB3  ALA  51           HB1      ALA  51  16.771  -6.203  -2.210
    4    HB1  ALA  51           HB2      ALA  51  16.550  -4.555  -2.800
    5    HB2  ALA  51           HB3      ALA  51  17.922  -4.943  -1.761

  No H/Q in entry =           5
  In of MODEL   66
    1    H    HIS  52           H        HIS  52  17.745  -3.351  -4.802
    2    HA   HIS  52           HA       HIS  52  15.611  -3.873  -6.578
    3    HB2  HIS  52           HB2      HIS  52  16.319  -1.611  -5.755
    4    HB3  HIS  52           HB3      HIS  52  17.704  -1.704  -6.842
    5    HD1  HIS  52           HD1      HIS  52  16.776  -2.524  -9.446
    6    HD2  HIS  52           HD2      HIS  52  14.276  -0.254  -7.000
    7    HE1  HIS  52           HE1      HIS  52  15.059  -1.453 -10.970
    8    HE2  HIS  52           HE2      HIS  52  13.529  -0.066  -9.495

  No H/Q in entry =           8
  In of MODEL   66
    1    H    LEU  53           H        LEU  53  19.124  -3.874  -7.052
    2    HA   LEU  53           HA       LEU  53  19.148  -4.180  -9.854
    3    HB2  LEU  53           HB2      LEU  53  21.108  -4.947  -7.706
    4    HB3  LEU  53           HB3      LEU  53  21.404  -5.327  -9.400
    5    HG   LEU  53           HG       LEU  53  20.749  -2.522  -8.442
    6   HD11  LEU  53          HD11      LEU  53  23.394  -3.953  -8.717
    7   HD13  LEU  53          HD12      LEU  53  22.795  -3.012  -7.352
    8   HD12  LEU  53          HD13      LEU  53  23.276  -2.200  -8.837
    9   HD22  LEU  53          HD21      LEU  53  20.437  -2.555 -10.777
   10   HD21  LEU  53          HD22      LEU  53  21.704  -3.753 -11.021
   11   HD23  LEU  53          HD23      LEU  53  22.130  -2.091 -10.659

  No H/Q in entry =          11
  In of MODEL   66
    1    H    VAL  54           H        VAL  54  19.070  -6.575  -7.235
    2    HA   VAL  54           HA       VAL  54  19.176  -8.864  -8.904
    3    HB   VAL  54           HB       VAL  54  18.054  -8.451  -6.121
    4   HG12  VAL  54          HG11      VAL  54  18.382 -11.068  -6.130
    5   HG11  VAL  54          HG12      VAL  54  18.176 -10.895  -7.872
    6   HG13  VAL  54          HG13      VAL  54  16.900 -10.369  -6.777
    7   HG22  VAL  54          HG21      VAL  54  20.372  -8.238  -5.925
    8   HG21  VAL  54          HG22      VAL  54  20.695  -9.325  -7.274
    9   HG23  VAL  54          HG23      VAL  54  20.185  -9.978  -5.717

  No H/Q in entry =           9
  In of MODEL   66
    1    H    GLN  55           H        GLN  55  16.461  -6.970  -7.583
    2    HA   GLN  55           HA       GLN  55  14.430  -8.634  -8.638
    3    HB2  GLN  55           HB2      GLN  55  13.698  -7.114  -6.997
    4    HB3  GLN  55           HB3      GLN  55  14.480  -5.742  -7.778
    5    HG2  GLN  55           HG2      GLN  55  12.737  -5.416  -9.247
    6    HG3  GLN  55           HG3      GLN  55  12.416  -7.137  -9.418
    7   HE21  GLN  55          HE21      GLN  55  10.420  -7.692  -8.591
    8   HE22  GLN  55          HE22      GLN  55   9.661  -6.943  -7.271

  No H/Q in entry =           8
  In of MODEL   66
    1    H    THR  56           H        THR  56  16.148  -5.826 -10.009
    2    HA   THR  56           HA       THR  56  14.681  -5.460 -12.339
    3    HB   THR  56           HB       THR  56  17.685  -5.295 -11.983
    4    HG1  THR  56           HG1      THR  56  15.796  -3.909 -10.915
    5   HG21  THR  56          HG21      THR  56  15.836  -4.540 -14.223
    6   HG23  THR  56          HG22      THR  56  17.431  -5.290 -14.299
    7   HG22  THR  56          HG23      THR  56  17.282  -3.572 -13.921

  No H/Q in entry =           7
  In of MODEL   66
    1    H    LYS  57           H        LYS  57  17.343  -7.753 -11.766
    2    HA   LYS  57           HA       LYS  57  17.315  -8.940 -14.348
    3    HB2  LYS  57           HB2      LYS  57  19.127  -9.194 -12.625
    4    HB3  LYS  57           HB3      LYS  57  18.035 -10.195 -11.678
    5    HG2  LYS  57           HG2      LYS  57  17.913 -11.833 -13.493
    6    HG3  LYS  57           HG3      LYS  57  18.946 -10.827 -14.500
    7    HD2  LYS  57           HD2      LYS  57  20.778 -11.058 -12.853
    8    HD3  LYS  57           HD3      LYS  57  19.750 -12.088 -11.858
    9    HE2  LYS  57           HE2      LYS  57  20.499 -12.708 -14.736
   10    HE3  LYS  57           HE3      LYS  57  21.325 -13.394 -13.338
   11    HZ1  LYS  57           HZ1      LYS  57  18.400 -13.614 -13.616
   12    HZ3  LYS  57           HZ2      LYS  57  19.464 -14.579 -12.711
   13    HZ2  LYS  57           HZ3      LYS  57  19.428 -14.708 -14.404

  No H/Q in entry =          13
  In of MODEL   66
    1    H    LEU  58           H        LEU  58  15.572  -9.620 -11.353
    2    HA   LEU  58           HA       LEU  58  14.345 -11.994 -12.280
    3    HB2  LEU  58           HB2      LEU  58  13.571 -10.097 -10.070
    4    HB3  LEU  58           HB3      LEU  58  12.765 -11.636 -10.381
    5    HG   LEU  58           HG       LEU  58  15.744 -11.352  -9.861
    6   HD11  LEU  58          HD11      LEU  58  13.395 -11.781  -8.041
    7   HD13  LEU  58          HD12      LEU  58  14.849 -10.815  -7.793
    8   HD12  LEU  58          HD13      LEU  58  14.928 -12.571  -7.664
    9   HD22  LEU  58          HD21      LEU  58  15.619 -13.411 -10.893
   10   HD21  LEU  58          HD22      LEU  58  13.910 -13.626 -10.513
   11   HD23  LEU  58          HD23      LEU  58  15.134 -13.928  -9.279

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  59           H        ILE  59  13.657  -8.657 -12.945
    2    HA   ILE  59           HA       ILE  59  10.932  -9.310 -13.854
    3    HB   ILE  59           HB       ILE  59  11.734  -7.032 -12.648
    4   HG12  ILE  59          HG12      ILE  59   9.834  -6.861 -14.994
    5   HG13  ILE  59          HG13      ILE  59   9.410  -7.693 -13.521
    6   HG21  ILE  59          HG21      ILE  59  13.278  -6.617 -14.698
    7   HG23  ILE  59          HG22      ILE  59  12.290  -5.284 -14.143
    8   HG22  ILE  59          HG23      ILE  59  11.808  -6.220 -15.555
    9   HD12  ILE  59          HD11      ILE  59  10.199  -4.792 -13.773
   10   HD11  ILE  59          HD12      ILE  59   9.937  -5.611 -12.234
   11   HD13  ILE  59          HD13      ILE  59   8.598  -5.411 -13.365

  No H/Q in entry =          11
  In of MODEL   66
    1    H    GLU  60           H        GLU  60  14.118  -8.446 -15.148
    2    HA   GLU  60           HA       GLU  60  13.305  -8.040 -17.846
    3    HB2  GLU  60           HB2      GLU  60  15.486  -7.290 -17.057
    4    HB3  GLU  60           HB3      GLU  60  15.957  -8.949 -16.696
    5    HG2  GLU  60           HG2      GLU  60  15.101  -8.183 -19.482
    6    HG3  GLU  60           HG3      GLU  60  16.756  -7.902 -18.945

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLY  61           H        GLY  61  14.311 -10.924 -16.051
    2    HA3  GLY  61           HA2      GLY  61  13.745 -12.566 -18.451
    3    HA2  GLY  61           HA3      GLY  61  14.795 -13.049 -17.122

  No H/Q in entry =           3
  In of MODEL   66
    1    H    ASP  62           H        ASP  62  11.676 -11.511 -16.708
    2    HA   ASP  62           HA       ASP  62  10.777 -13.602 -14.969
    3    HB2  ASP  62           HB2      ASP  62  10.217 -11.256 -14.566
    4    HB3  ASP  62           HB3      ASP  62   9.326 -11.197 -16.083

  No H/Q in entry =           4
  In of MODEL   66
    1    H    ALA  63           H        ALA  63  10.000 -15.529 -15.687
    2    HA   ALA  63           HA       ALA  63   8.204 -15.507 -18.061
    3    HB1  ALA  63           HB1      ALA  63   9.079 -17.803 -18.555
    4    HB3  ALA  63           HB2      ALA  63  10.289 -17.566 -17.296
    5    HB2  ALA  63           HB3      ALA  63  10.294 -16.536 -18.727

  No H/Q in entry =           5
  In of MODEL   66
    1    H    GLY  64           H        GLY  64   8.945 -16.657 -14.875
    2    HA3  GLY  64           HA2      GLY  64   7.608 -17.588 -13.249
    3    HA2  GLY  64           HA3      GLY  64   6.234 -17.380 -14.326

  No H/Q in entry =           3
  In of MODEL   66
    1    H    GLU  65           H        GLU  65   5.499 -19.487 -13.569
    2    HA   GLU  65           HA       GLU  65   7.019 -21.834 -13.866
    3    HB2  GLU  65           HB2      GLU  65   4.029 -21.431 -13.820
    4    HB3  GLU  65           HB3      GLU  65   4.817 -23.008 -13.759
    5    HG2  GLU  65           HG2      GLU  65   4.555 -22.541 -11.493
    6    HG3  GLU  65           HG3      GLU  65   6.185 -21.940 -11.789

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLY  66           H        GLY  66   4.795 -20.244 -16.030
    2    HA3  GLY  66           HA2      GLY  66   5.315 -22.180 -18.173
    3    HA2  GLY  66           HA3      GLY  66   3.989 -21.036 -18.125

  No H/Q in entry =           3
  In of MODEL   66
    1    H    LYS  67           H        LYS  67   5.114 -21.093 -20.422
    2    HA   LYS  67           HA       LYS  67   7.488 -19.664 -20.848
    3    HB2  LYS  67           HB2      LYS  67   6.200 -19.362 -23.200
    4    HB3  LYS  67           HB3      LYS  67   6.993 -20.861 -22.701
    5    HG2  LYS  67           HG2      LYS  67   4.957 -21.819 -21.943
    6    HG3  LYS  67           HG3      LYS  67   4.128 -20.265 -21.958
    7    HD2  LYS  67           HD2      LYS  67   3.375 -21.520 -23.880
    8    HD3  LYS  67           HD3      LYS  67   4.424 -20.225 -24.463
    9    HE2  LYS  67           HE2      LYS  67   6.292 -21.743 -24.685
   10    HE3  LYS  67           HE3      LYS  67   5.395 -23.039 -23.893
   11    HZ1  LYS  67           HZ1      LYS  67   4.084 -21.883 -26.195
   12    HZ3  LYS  67           HZ2      LYS  67   4.271 -23.511 -25.751
   13    HZ2  LYS  67           HZ3      LYS  67   5.532 -22.693 -26.546

  No H/Q in entry =          13
  In of MODEL   66
    1    H    MET  68           H        MET  68   4.333 -18.530 -21.904
    2    HA   MET  68           HA       MET  68   5.054 -15.820 -22.164
    3    HB2  MET  68           HB2      MET  68   2.429 -17.280 -22.094
    4    HB3  MET  68           HB3      MET  68   2.510 -15.527 -22.273
    5    HG2  MET  68           HG2      MET  68   3.976 -17.483 -24.062
    6    HG3  MET  68           HG3      MET  68   2.426 -16.744 -24.464
    7    HE3  MET  68           HE1      MET  68   2.890 -13.230 -25.116
    8    HE2  MET  68           HE2      MET  68   2.851 -13.525 -23.380
    9    HE1  MET  68           HE3      MET  68   1.889 -14.533 -24.459

  No H/Q in entry =           9
  In of MODEL   66
    1    H    LYS  69           H        LYS  69   3.380 -17.504 -19.492
    2    HA   LYS  69           HA       LYS  69   2.507 -15.256 -18.098
    3    HB2  LYS  69           HB2      LYS  69   3.240 -18.016 -17.130
    4    HB3  LYS  69           HB3      LYS  69   2.488 -16.796 -16.099
    5    HG2  LYS  69           HG2      LYS  69   0.611 -16.596 -17.679
    6    HG3  LYS  69           HG3      LYS  69   1.359 -17.801 -18.727
    7    HD2  LYS  69           HD2      LYS  69   1.220 -19.463 -16.896
    8    HD3  LYS  69           HD3      LYS  69   0.424 -18.259 -15.879
    9    HE2  LYS  69           HE2      LYS  69  -0.626 -19.166 -18.575
   10    HE3  LYS  69           HE3      LYS  69  -1.182 -19.809 -17.031
   11    HZ3  LYS  69           HZ1      LYS  69  -1.946 -17.669 -16.382
   12    HZ2  LYS  69           HZ2      LYS  69  -2.569 -17.983 -17.930
   13    HZ1  LYS  69           HZ3      LYS  69  -1.250 -16.930 -17.739

  No H/Q in entry =          13
  In of MODEL   66
    1    H    VAL  70           H        VAL  70   3.306 -15.169 -15.538
    2    HA   VAL  70           HA       VAL  70   6.198 -14.529 -15.561
    3    HB   VAL  70           HB       VAL  70   5.649 -12.491 -14.225
    4   HG13  VAL  70          HG11      VAL  70   5.114 -11.151 -16.120
    5   HG12  VAL  70          HG12      VAL  70   4.183 -12.450 -16.867
    6   HG11  VAL  70          HG13      VAL  70   5.939 -12.562 -16.780
    7   HG23  VAL  70          HG21      VAL  70   3.260 -11.686 -14.317
    8   HG22  VAL  70          HG22      VAL  70   3.470 -13.143 -13.345
    9   HG21  VAL  70          HG23      VAL  70   2.799 -13.258 -14.972

  No H/Q in entry =           9
  In of MODEL   66
    1    H    SER  71           H        SER  71   7.132 -14.415 -13.407
    2    HA   SER  71           HA       SER  71   6.267 -16.537 -11.680
    3    HB2  SER  71           HB2      SER  71   8.663 -15.833 -12.010
    4    HB3  SER  71           HB3      SER  71   8.300 -14.371 -11.095
    5    HG   SER  71           HG       SER  71   8.995 -15.809  -9.605

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LEU  72           H        LEU  72   4.884 -16.423 -10.020
    2    HA   LEU  72           HA       LEU  72   3.334 -14.116  -9.550
    3    HB2  LEU  72           HB2      LEU  72   3.646 -16.675  -7.990
    4    HB3  LEU  72           HB3      LEU  72   2.477 -15.424  -7.577
    5    HG   LEU  72           HG       LEU  72   2.616 -16.730 -10.314
    6   HD11  LEU  72          HD11      LEU  72   0.964 -17.406  -7.869
    7   HD13  LEU  72          HD12      LEU  72   2.034 -18.475  -8.773
    8   HD12  LEU  72          HD13      LEU  72   0.523 -17.923  -9.496
    9   HD21  LEU  72          HD21      LEU  72   0.753 -14.802  -8.941
   10   HD23  LEU  72          HD22      LEU  72   0.116 -15.870 -10.180
   11   HD22  LEU  72          HD23      LEU  72   1.399 -14.731 -10.576

  No H/Q in entry =          11
  In of MODEL   66
    1    H    VAL  73           H        VAL  73   6.013 -15.552  -7.812
    2    HA   VAL  73           HA       VAL  73   5.975 -14.027  -5.474
    3    HB   VAL  73           HB       VAL  73   8.128 -14.866  -5.049
    4   HG13  VAL  73          HG11      VAL  73   7.881 -17.186  -5.480
    5   HG12  VAL  73          HG12      VAL  73   7.038 -16.895  -7.001
    6   HG11  VAL  73          HG13      VAL  73   6.234 -16.557  -5.468
    7   HG22  VAL  73          HG21      VAL  73   9.375 -14.085  -6.926
    8   HG21  VAL  73          HG22      VAL  73   8.378 -14.995  -8.059
    9   HG23  VAL  73          HG23      VAL  73   9.492 -15.844  -6.988

  No H/Q in entry =           9
  In of MODEL   66
    1    H    LEU  74           H        LEU  74   6.928 -13.120  -8.658
    2    HA   LEU  74           HA       LEU  74   8.874 -11.168  -8.180
    3    HB2  LEU  74           HB2      LEU  74   8.386 -11.918 -10.415
    4    HB3  LEU  74           HB3      LEU  74   6.726 -11.336 -10.294
    5    HG   LEU  74           HG       LEU  74   7.618  -9.010 -10.008
    6   HD11  LEU  74          HD11      LEU  74  10.209 -10.509 -10.380
    7   HD13  LEU  74          HD12      LEU  74   9.813  -9.277  -9.184
    8   HD12  LEU  74          HD13      LEU  74  10.070  -8.821 -10.867
    9   HD21  LEU  74          HD21      LEU  74   7.033 -10.263 -12.220
   10   HD23  LEU  74          HD22      LEU  74   8.759 -10.191 -12.483
   11   HD22  LEU  74          HD23      LEU  74   7.854  -8.706 -12.300

  No H/Q in entry =          11
  In of MODEL   66
    1    H    VAL  75           H        VAL  75   5.373 -10.790  -8.494
    2    HA   VAL  75           HA       VAL  75   5.277  -8.036  -7.896
    3    HB   VAL  75           HB       VAL  75   3.200 -10.190  -7.504
    4   HG11  VAL  75          HG11      VAL  75   3.002  -7.154  -7.293
    5   HG13  VAL  75          HG12      VAL  75   2.716  -8.314  -6.005
    6   HG12  VAL  75          HG13      VAL  75   1.618  -8.239  -7.374
    7   HG21  VAL  75          HG21      VAL  75   3.929  -9.750  -9.835
    8   HG23  VAL  75          HG22      VAL  75   3.600  -8.034  -9.607
    9   HG22  VAL  75          HG23      VAL  75   2.275  -9.197  -9.572

  No H/Q in entry =           9
  In of MODEL   66
    1    H    GLU  76           H        GLU  76   5.053 -10.922  -5.794
    2    HA   GLU  76           HA       GLU  76   4.605  -9.570  -3.363
    3    HB2  GLU  76           HB2      GLU  76   4.453 -12.051  -3.646
    4    HB3  GLU  76           HB3      GLU  76   6.197 -12.118  -3.825
    5    HG2  GLU  76           HG2      GLU  76   6.483 -11.234  -1.539
    6    HG3  GLU  76           HG3      GLU  76   4.743 -11.145  -1.334

  No H/Q in entry =           6
  In of MODEL   66
    1    H    ALA  77           H        ALA  77   7.650 -10.465  -4.961
    2    HA   ALA  77           HA       ALA  77   9.358  -9.425  -2.959
    3    HB3  ALA  77           HB1      ALA  77   9.898  -9.667  -5.928
    4    HB1  ALA  77           HB2      ALA  77  10.104 -10.966  -4.753
    5    HB2  ALA  77           HB3      ALA  77  11.109  -9.521  -4.654

  No H/Q in entry =           5
  In of MODEL   66
    1    H    GLN  78           H        GLN  78   7.933  -8.000  -5.854
    2    HA   GLN  78           HA       GLN  78   9.282  -5.518  -5.754
    3    HB2  GLN  78           HB2      GLN  78   7.960  -6.437  -7.698
    4    HB3  GLN  78           HB3      GLN  78   6.490  -6.046  -6.808
    5    HG2  GLN  78           HG2      GLN  78   7.169  -3.680  -6.722
    6    HG3  GLN  78           HG3      GLN  78   8.637  -4.066  -7.622
    7   HE21  GLN  78          HE21      GLN  78   6.776  -2.221  -8.715
    8   HE22  GLN  78          HE22      GLN  78   6.026  -2.932 -10.064

  No H/Q in entry =           8
  In of MODEL   66
    1    H    LEU  79           H        LEU  79   6.279  -6.667  -4.298
    2    HA   LEU  79           HA       LEU  79   5.291  -4.265  -3.270
    3    HB2  LEU  79           HB2      LEU  79   3.981  -6.319  -3.209
    4    HB3  LEU  79           HB3      LEU  79   5.138  -7.060  -2.108
    5    HG   LEU  79           HG       LEU  79   4.600  -5.425  -0.370
    6   HD13  LEU  79          HD11      LEU  79   4.121  -3.408  -1.408
    7   HD12  LEU  79          HD12      LEU  79   2.501  -3.938  -0.955
    8   HD11  LEU  79          HD13      LEU  79   3.065  -4.153  -2.610
    9   HD23  LEU  79          HD21      LEU  79   2.015  -5.922  -0.256
   10   HD22  LEU  79          HD22      LEU  79   3.158  -7.260  -0.163
   11   HD21  LEU  79          HD23      LEU  79   2.329  -6.919  -1.679

  No H/Q in entry =          11
  In of MODEL   66
    1    H    HIS  80           H        HIS  80   7.493  -6.602  -1.717
    2    HA   HIS  80           HA       HIS  80   7.801  -5.068   0.654
    3    HB2  HIS  80           HB2      HIS  80   9.131  -7.426  -0.566
    4    HB3  HIS  80           HB3      HIS  80  10.052  -6.532   0.645
    5    HD1  HIS  80           HD1      HIS  80   9.585  -7.177   2.991
    6    HD2  HIS  80           HD2      HIS  80   6.345  -8.023   0.506
    7    HE1  HIS  80           HE1      HIS  80   7.829  -8.288   4.452
    8    HE2  HIS  80           HE2      HIS  80   5.848  -8.808   2.946

  No H/Q in entry =           8
  In of MODEL   66
    1    H    LEU  81           H        LEU  81   9.779  -5.331  -2.278
    2    HA   LEU  81           HA       LEU  81  11.829  -3.591  -1.412
    3    HB2  LEU  81           HB2      LEU  81  10.883  -4.375  -4.170
    4    HB3  LEU  81           HB3      LEU  81  12.305  -3.368  -3.889
    5    HG   LEU  81           HG       LEU  81  11.927  -6.094  -2.621
    6   HD12  LEU  81          HD11      LEU  81  13.727  -6.712  -4.390
    7   HD11  LEU  81          HD12      LEU  81  13.152  -5.286  -5.252
    8   HD13  LEU  81          HD13      LEU  81  12.045  -6.612  -4.908
    9   HD23  LEU  81          HD21      LEU  81  14.555  -5.776  -2.631
   10   HD22  LEU  81          HD22      LEU  81  13.584  -5.021  -1.369
   11   HD21  LEU  81          HD23      LEU  81  14.149  -4.064  -2.738

  No H/Q in entry =          11
  In of MODEL   66
    1    H    MET  82           H        MET  82   8.888  -2.950  -3.320
    2    HA   MET  82           HA       MET  82   9.421  -0.222  -3.816
    3    HB2  MET  82           HB2      MET  82   6.864  -1.818  -3.673
    4    HB3  MET  82           HB3      MET  82   6.859  -0.093  -4.031
    5    HG2  MET  82           HG2      MET  82   8.447  -2.160  -5.588
    6    HG3  MET  82           HG3      MET  82   6.875  -1.536  -6.084
    7    HE3  MET  82           HE1      MET  82   7.310   1.923  -7.248
    8    HE2  MET  82           HE2      MET  82   6.951   1.690  -5.538
    9    HE1  MET  82           HE3      MET  82   6.276   0.585  -6.731

  No H/Q in entry =           9
  In of MODEL   66
    1    H    THR  83           H        THR  83   7.654  -1.831  -1.200
    2    HA   THR  83           HA       THR  83   6.815   0.512   0.143
    3    HB   THR  83           HB       THR  83   6.700  -1.069   2.156
    4    HG1  THR  83           HG1      THR  83   7.456  -3.018   1.912
    5   HG22  THR  83          HG21      THR  83   5.034  -2.631   0.698
    6   HG21  THR  83          HG22      THR  83   5.249  -1.298  -0.431
    7   HG23  THR  83          HG23      THR  83   4.624  -0.989   1.189

  No H/Q in entry =           7
  In of MODEL   66
    1    H    SER  84           H        SER  84   9.644  -1.586   0.630
    2    HA   SER  84           HA       SER  84  10.723  -0.163   2.813
    3    HB2  SER  84           HB2      SER  84  11.958  -1.998   0.770
    4    HB3  SER  84           HB3      SER  84  12.916  -1.249   2.046
    5    HG   SER  84           HG       SER  84  10.644  -2.940   2.320

  No H/Q in entry =           5
  In of MODEL   66
    1    H    MET  85           H        MET  85  11.444   0.110  -0.680
    2    HA   MET  85           HA       MET  85  13.444   2.075  -0.441
    3    HB2  MET  85           HB2      MET  85  13.032   0.802  -2.507
    4    HB3  MET  85           HB3      MET  85  11.500   1.650  -2.719
    5    HG2  MET  85           HG2      MET  85  12.699   3.803  -2.835
    6    HG3  MET  85           HG3      MET  85  14.230   2.964  -2.611
    7    HE3  MET  85           HE1      MET  85  15.691   2.842  -4.526
    8    HE2  MET  85           HE2      MET  85  15.318   1.773  -5.875
    9    HE1  MET  85           HE3      MET  85  15.190   1.171  -4.229

  No H/Q in entry =           9
  In of MODEL   66
    1    H    LEU  86           H        LEU  86   9.950   2.411  -0.916
    2    HA   LEU  86           HA       LEU  86   9.885   5.225  -1.087
    3    HB2  LEU  86           HB2      LEU  86   8.035   3.568  -1.652
    4    HB3  LEU  86           HB3      LEU  86   7.721   3.472   0.080
    5    HG   LEU  86           HG       LEU  86   7.560   6.033   0.038
    6   HD11  LEU  86          HD11      LEU  86   8.311   5.606  -2.672
    7   HD13  LEU  86          HD12      LEU  86   7.883   7.131  -1.902
    8   HD12  LEU  86          HD13      LEU  86   6.639   6.171  -2.699
    9   HD23  LEU  86          HD21      LEU  86   5.411   4.686  -1.609
   10   HD22  LEU  86          HD22      LEU  86   5.232   5.942  -0.387
   11   HD21  LEU  86          HD23      LEU  86   5.636   4.296   0.097

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ALA  87           H        ALA  87   9.444   3.037   1.655
    2    HA   ALA  87           HA       ALA  87   8.914   4.944   3.636
    3    HB1  ALA  87           HB1      ALA  87   9.719   2.124   3.532
    4    HB3  ALA  87           HB2      ALA  87   8.605   2.933   4.631
    5    HB2  ALA  87           HB3      ALA  87  10.336   2.962   4.959

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ARG  88           H        ARG  88  11.988   3.522   2.622
    2    HA   ARG  88           HA       ARG  88  13.615   4.893   4.444
    3    HB2  ARG  88           HB2      ARG  88  14.269   2.924   3.027
    4    HB3  ARG  88           HB3      ARG  88  14.409   4.022   1.657
    5    HG2  ARG  88           HG2      ARG  88  15.901   5.328   3.594
    6    HG3  ARG  88           HG3      ARG  88  16.225   3.637   3.964
    7    HD2  ARG  88           HD2      ARG  88  17.474   3.347   2.104
    8    HD3  ARG  88           HD3      ARG  88  16.328   4.222   1.085
    9    HE   ARG  88           HE       ARG  88  18.733   5.281   2.113
   10   HH21  ARG  88          HH11      ARG  88  19.077   7.500   1.923
   11   HH22  ARG  88          HH12      ARG  88  17.725   8.573   1.797
   12   HH11  ARG  88          HH21      ARG  88  15.391   6.037   1.869
   13   HH12  ARG  88          HH22      ARG  88  15.637   7.742   1.742

  No H/Q in entry =          13
  In of MODEL   66
    1    H    GLU  89           H        GLU  89  12.611   5.803   1.133
    2    HA   GLU  89           HA       GLU  89  14.157   8.163   0.970
    3    HB2  GLU  89           HB2      GLU  89  12.994   7.129  -0.970
    4    HB3  GLU  89           HB3      GLU  89  11.456   7.669  -0.296
    5    HG2  GLU  89           HG2      GLU  89  12.157  10.006  -0.457
    6    HG3  GLU  89           HG3      GLU  89  13.755   9.517  -1.010

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LEU  90           H        LEU  90  10.838   7.651   2.130
    2    HA   LEU  90           HA       LEU  90  10.330  10.382   2.720
    3    HB2  LEU  90           HB2      LEU  90   9.144   7.805   3.749
    4    HB3  LEU  90           HB3      LEU  90   8.518   9.399   4.184
    5    HG   LEU  90           HG       LEU  90   8.908   8.530   1.308
    6   HD12  LEU  90          HD11      LEU  90   6.375   8.202   1.393
    7   HD11  LEU  90          HD12      LEU  90   6.547   8.185   3.149
    8   HD13  LEU  90          HD13      LEU  90   7.355   6.958   2.172
    9   HD22  LEU  90          HD21      LEU  90   8.615  10.838   1.245
   10   HD21  LEU  90          HD22      LEU  90   7.642  10.865   2.715
   11   HD23  LEU  90          HD23      LEU  90   6.930  10.316   1.198

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  91           H        ILE  91  11.610   7.693   4.620
    2    HA   ILE  91           HA       ILE  91  11.775   9.049   7.092
    3    HB   ILE  91           HB       ILE  91  13.317   6.714   5.945
    4   HG12  ILE  91          HG12      ILE  91  11.323   6.874   8.224
    5   HG13  ILE  91          HG13      ILE  91  10.836   6.599   6.552
    6   HG22  ILE  91          HG21      ILE  91  13.812   6.491   8.580
    7   HG21  ILE  91          HG22      ILE  91  13.736   8.250   8.486
    8   HG23  ILE  91          HG23      ILE  91  14.905   7.365   7.507
    9   HD13  ILE  91          HD11      ILE  91  11.837   4.498   6.465
   10   HD12  ILE  91          HD12      ILE  91  11.260   4.550   8.131
   11   HD11  ILE  91          HD13      ILE  91  12.958   4.864   7.777

  No H/Q in entry =          11
  In of MODEL   66
    1    H    THR  92           H        THR  92  13.965   8.889   4.318
    2    HA   THR  92           HA       THR  92  16.142  10.277   5.462
    3    HB   THR  92           HB       THR  92  15.128  10.163   2.610
    4    HG1  THR  92           HG1      THR  92  15.963   8.264   3.000
    5   HG22  THR  92          HG21      THR  92  17.695  10.854   2.294
    6   HG21  THR  92          HG22      THR  92  17.402  11.669   3.830
    7   HG23  THR  92          HG23      THR  92  16.419  12.062   2.420

  No H/Q in entry =           7
  In of MODEL   66
    1    H    GLU  93           H        GLU  93  13.239  11.438   3.765
    2    HA   GLU  93           HA       GLU  93  13.835  14.198   3.884
    3    HB2  GLU  93           HB2      GLU  93  11.131  12.826   3.919
    4    HB3  GLU  93           HB3      GLU  93  11.416  14.527   3.551
    5    HG2  GLU  93           HG2      GLU  93  12.738  12.290   2.002
    6    HG3  GLU  93           HG3      GLU  93  11.187  12.975   1.532

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LEU  94           H        LEU  94  12.114  12.035   6.104
    2    HA   LEU  94           HA       LEU  94  11.323  13.974   7.995
    3    HB2  LEU  94           HB2      LEU  94  11.901  11.018   8.253
    4    HB3  LEU  94           HB3      LEU  94  11.343  11.989   9.612
    5    HG   LEU  94           HG       LEU  94   9.833  12.051   6.998
    6   HD11  LEU  94          HD11      LEU  94   9.935   9.822   8.993
    7   HD13  LEU  94          HD12      LEU  94   9.616   9.768   7.261
    8   HD12  LEU  94          HD13      LEU  94   8.348  10.281   8.374
    9   HD23  LEU  94          HD21      LEU  94   7.929  12.445   8.618
   10   HD22  LEU  94          HD22      LEU  94   9.169  13.699   8.648
   11   HD21  LEU  94          HD23      LEU  94   9.118  12.477   9.918

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  95           H        ILE  95  14.294  12.045   7.722
    2    HA   ILE  95           HA       ILE  95  15.486  12.958  10.127
    3    HB   ILE  95           HB       ILE  95  16.699  11.898   7.563
    4   HG12  ILE  95          HG12      ILE  95  16.430  10.687  10.329
    5   HG13  ILE  95          HG13      ILE  95  15.251  10.434   9.045
    6   HG21  ILE  95          HG21      ILE  95  17.981  12.695  10.196
    7   HG23  ILE  95          HG22      ILE  95  18.427  13.228   8.574
    8   HG22  ILE  95          HG23      ILE  95  18.738  11.566   9.073
    9   HD13  ILE  95          HD11      ILE  95  16.718   9.159   7.762
   10   HD12  ILE  95          HD12      ILE  95  17.207   8.704   9.392
   11   HD11  ILE  95          HD13      ILE  95  18.151   9.887   8.488

  No H/Q in entry =          11
  In of MODEL   66
    1    H    GLU  96           H        GLU  96  15.608  14.203   6.796
    2    HA   GLU  96           HA       GLU  96  17.460  16.279   7.262
    3    HB2  GLU  96           HB2      GLU  96  16.772  15.626   5.007
    4    HB3  GLU  96           HB3      GLU  96  15.133  16.182   5.326
    5    HG2  GLU  96           HG2      GLU  96  15.694  18.313   4.786
    6    HG3  GLU  96           HG3      GLU  96  17.005  18.309   5.955

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LEU  97           H        LEU  97  13.953  16.092   7.726
    2    HA   LEU  97           HA       LEU  97  13.544  18.824   8.382
    3    HB2  LEU  97           HB2      LEU  97  12.031  16.296   9.002
    4    HB3  LEU  97           HB3      LEU  97  11.525  17.841   9.684
    5    HG   LEU  97           HG       LEU  97  11.978  17.436   6.713
    6   HD12  LEU  97          HD11      LEU  97   9.454  17.309   6.620
    7   HD11  LEU  97          HD12      LEU  97   9.465  17.103   8.369
    8   HD13  LEU  97          HD13      LEU  97  10.235  15.899   7.335
    9   HD23  LEU  97          HD21      LEU  97  10.242  19.400   6.770
   10   HD22  LEU  97          HD22      LEU  97  11.927  19.758   7.147
   11   HD21  LEU  97          HD23      LEU  97  10.751  19.583   8.448

  No H/Q in entry =          11
  In of MODEL   66
    1    H    HIS  98           H        HIS  98  14.384  15.990  10.359
    2    HA   HIS  98           HA       HIS  98  14.252  17.242  12.881
    3    HB2  HIS  98           HB2      HIS  98  15.991  14.987  11.853
    4    HB3  HIS  98           HB3      HIS  98  16.007  15.519  13.536
    5    HD1  HIS  98           HD1      HIS  98  13.781  13.900  10.960
    6    HD2  HIS  98           HD2      HIS  98  13.715  14.805  15.029
    7    HE1  HIS  98           HE1      HIS  98  11.765  12.703  11.929
    8    HE2  HIS  98           HE2      HIS  98  11.705  13.246  14.403

  No H/Q in entry =           8
  In of MODEL   66
    1    H    GLU  99           H        GLU  99  16.781  17.134  10.420
    2    HA   GLU  99           HA       GLU  99  18.783  18.459  11.934
    3    HB2  GLU  99           HB2      GLU  99  19.240  17.179   9.855
    4    HB3  GLU  99           HB3      GLU  99  18.422  18.438   8.927
    5    HG2  GLU  99           HG2      GLU  99  20.039  20.104   9.708
    6    HG3  GLU  99           HG3      GLU  99  20.828  18.898  10.718

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LYS 100           H        LYS 100  16.237  19.631   9.747
    2    HA   LYS 100           HA       LYS 100  17.038  22.367   9.894
    3    HB2  LYS 100           HB2      LYS 100  14.397  21.083   9.161
    4    HB3  LYS 100           HB3      LYS 100  14.697  22.822   9.074
    5    HG2  LYS 100           HG2      LYS 100  16.654  22.377   7.586
    6    HG3  LYS 100           HG3      LYS 100  16.239  20.660   7.601
    7    HD2  LYS 100           HD2      LYS 100  14.034  21.175   6.625
    8    HD3  LYS 100           HD3      LYS 100  14.432  22.894   6.617
    9    HE2  LYS 100           HE2      LYS 100  16.376  22.417   5.136
   10    HE3  LYS 100           HE3      LYS 100  15.909  20.713   5.101
   11    HZ1  LYS 100           HZ1      LYS 100  14.077  22.911   4.293
   12    HZ3  LYS 100           HZ2      LYS 100  13.889  21.242   4.026
   13    HZ2  LYS 100           HZ3      LYS 100  15.092  22.106   3.196

  No H/Q in entry =          13
  In of MODEL   66
    1    H    LEU 101           H        LEU 101  14.959  20.316  11.872
    2    HA   LEU 101           HA       LEU 101  13.811  22.379  13.470
    3    HB2  LEU 101           HB2      LEU 101  14.254  19.427  13.838
    4    HB3  LEU 101           HB3      LEU 101  13.733  20.403  15.208
    5    HG   LEU 101           HG       LEU 101  12.288  20.503  12.554
    6   HD12  LEU 101          HD11      LEU 101  10.640  18.936  13.834
    7   HD11  LEU 101          HD12      LEU 101  12.044  18.518  14.813
    8   HD13  LEU 101          HD13      LEU 101  12.060  18.218  13.074
    9   HD21  LEU 101          HD21      LEU 101  11.661  21.286  15.416
   10   HD23  LEU 101          HD22      LEU 101  10.387  21.066  14.218
   11   HD22  LEU 101          HD23      LEU 101  11.621  22.301  13.972

  No H/Q in entry =          11
  In of MODEL   66
    1    H    LYS 102           H        LYS 102  16.953  21.769  12.999
    2    HA   LYS 102           HA       LYS 102  18.812  22.634  14.056
    3    HB2  LYS 102           HB2      LYS 102  17.011  24.147  15.214
    4    HB3  LYS 102           HB3      LYS 102  17.231  23.079  16.584
    5    HG2  LYS 102           HG2      LYS 102  19.114  25.092  15.404
    6    HG3  LYS 102           HG3      LYS 102  18.749  24.772  17.085
    7    HD2  LYS 102           HD2      LYS 102  20.396  22.864  15.375
    8    HD3  LYS 102           HD3      LYS 102  21.097  24.181  16.306
    9    HE2  LYS 102           HE2      LYS 102  20.705  21.629  17.269
   10    HE3  LYS 102           HE3      LYS 102  20.936  23.067  18.263
   11    HZ2  LYS 102           HZ1      LYS 102  18.972  21.783  18.896
   12    HZ1  LYS 102           HZ2      LYS 102  18.313  22.020  17.355
   13    HZ3  LYS 102           HZ3      LYS 102  18.555  23.346  18.384

  No H/Q in entry =          13
  In of MODEL   66
    1    H    ALA 103           H        ALA 103  16.763  21.022  16.493
    2    HA   ALA 103           HA       ALA 103  18.505  19.803  18.125
    3    HB2  ALA 103           HB1      ALA 103  16.918  17.797  18.128
    4    HB1  ALA 103           HB2      ALA 103  16.011  18.657  16.883
    5    HB3  ALA 103           HB3      ALA 103  16.206  19.371  18.483

  No H/Q in entry =           5
  In of MODEL   66
    1    H1   ALA   1           H3       ALA   1  -1.864  -6.871 -21.393
    2    H2   ALA   1           H2       ALA   1  -2.656  -8.307 -20.937
    3    H3   ALA   1           H1       ALA   1  -1.054  -8.357 -21.508
    4    HA   ALA   1           HA       ALA   1  -1.909  -8.818 -23.498
    5    HB1  ALA   1           HB1      ALA   1  -4.042  -9.534 -23.006
    6    HB2  ALA   1           HB2      ALA   1  -4.486  -8.019 -23.793
    7    HB3  ALA   1           HB3      ALA   1  -4.408  -8.107 -22.035

  No H/Q in entry =           7
  In of MODEL   66
    1    H    GLU   2           H        GLU   2  -2.757  -7.618 -25.474
    2    HA   GLU   2           HA       GLU   2  -1.363  -5.603 -26.358
    3    HB2  GLU   2           HB2      GLU   2  -4.374  -5.663 -26.645
    4    HB3  GLU   2           HB3      GLU   2  -3.262  -4.798 -27.703
    5    HG2  GLU   2           HG2      GLU   2  -2.774  -6.684 -28.870
    6    HG3  GLU   2           HG3      GLU   2  -2.463  -7.596 -27.399

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLU   3           H        GLU   3  -4.512  -4.344 -25.421
    2    HA   GLU   3           HA       GLU   3  -3.455  -1.792 -24.793
    3    HB2  GLU   3           HB2      GLU   3  -6.142  -3.104 -24.439
    4    HB3  GLU   3           HB3      GLU   3  -5.834  -1.492 -23.789
    5    HG2  GLU   3           HG2      GLU   3  -5.498  -0.557 -25.915
    6    HG3  GLU   3           HG3      GLU   3  -5.113  -2.110 -26.650

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LEU   4           H        LEU   4  -5.028  -4.157 -22.607
    2    HA   LEU   4           HA       LEU   4  -4.637  -2.940 -20.215
    3    HB2  LEU   4           HB2      LEU   4  -4.104  -5.880 -20.701
    4    HB3  LEU   4           HB3      LEU   4  -4.493  -5.139 -19.151
    5    HG   LEU   4           HG       LEU   4  -6.291  -5.199 -21.597
    6   HD13  LEU   4          HD11      LEU   4  -7.477  -6.919 -20.594
    7   HD12  LEU   4          HD12      LEU   4  -6.975  -6.467 -18.966
    8   HD11  LEU   4          HD13      LEU   4  -5.851  -7.308 -20.033
    9   HD23  LEU   4          HD21      LEU   4  -7.955  -4.393 -19.709
   10   HD22  LEU   4          HD22      LEU   4  -6.923  -3.220 -20.525
   11   HD21  LEU   4          HD23      LEU   4  -6.482  -3.818 -18.927

  No H/Q in entry =          11
  In of MODEL   66
    1    H    GLU   5           H        GLU   5  -2.160  -4.780 -21.978
    2    HA   GLU   5           HA       GLU   5  -0.155  -4.508 -19.960
    3    HB2  GLU   5           HB2      GLU   5  -0.107  -6.272 -21.715
    4    HB3  GLU   5           HB3      GLU   5   0.187  -5.026 -22.928
    5    HG2  GLU   5           HG2      GLU   5   2.267  -4.384 -21.791
    6    HG3  GLU   5           HG3      GLU   5   1.972  -5.590 -20.540

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLU   6           H        GLU   6  -0.818  -2.781 -22.991
    2    HA   GLU   6           HA       GLU   6   1.358  -0.954 -22.737
    3    HB2  GLU   6           HB2      GLU   6   0.220  -1.418 -24.891
    4    HB3  GLU   6           HB3      GLU   6  -1.236  -0.641 -24.269
    5    HG2  GLU   6           HG2      GLU   6  -0.027   1.468 -23.993
    6    HG3  GLU   6           HG3      GLU   6   1.467   0.705 -24.529

  No H/Q in entry =           6
  In of MODEL   66
    1    H    VAL   7           H        VAL   7  -1.970  -1.024 -21.660
    2    HA   VAL   7           HA       VAL   7  -2.178   1.686 -20.810
    3    HB   VAL   7           HB       VAL   7  -3.636  -0.833 -19.969
    4   HG11  VAL   7          HG11      VAL   7  -3.998   2.053 -19.140
    5   HG13  VAL   7          HG12      VAL   7  -3.891   0.624 -18.112
    6   HG12  VAL   7          HG13      VAL   7  -5.332   0.901 -19.088
    7   HG21  VAL   7          HG21      VAL   7  -3.815   0.254 -22.351
    8   HG23  VAL   7          HG22      VAL   7  -4.750   1.501 -21.525
    9   HG22  VAL   7          HG23      VAL   7  -5.298  -0.175 -21.500

  No H/Q in entry =           9
  In of MODEL   66
    1    H    VAL   8           H        VAL   8  -1.179  -1.308 -19.189
    2    HA   VAL   8           HA       VAL   8  -0.833  -0.240 -16.592
    3    HB   VAL   8           HB       VAL   8   0.475  -2.575 -18.001
    4   HG11  VAL   8          HG11      VAL   8   0.834  -1.486 -15.210
    5   HG13  VAL   8          HG12      VAL   8   2.069  -2.002 -16.358
    6   HG12  VAL   8          HG13      VAL   8   1.062  -3.201 -15.551
    7   HG22  VAL   8          HG21      VAL   8  -1.146  -3.912 -16.918
    8   HG21  VAL   8          HG22      VAL   8  -2.069  -2.457 -17.279
    9   HG23  VAL   8          HG23      VAL   8  -1.436  -2.714 -15.657

  No H/Q in entry =           9
  In of MODEL   66
    1    H    MET   9           H        MET   9   1.387  -0.534 -19.363
    2    HA   MET   9           HA       MET   9   3.688   0.499 -18.121
    3    HB2  MET   9           HB2      MET   9   2.707   0.500 -20.969
    4    HB3  MET   9           HB3      MET   9   4.202   1.322 -20.526
    5    HG2  MET   9           HG2      MET   9   4.851  -0.897 -19.368
    6    HG3  MET   9           HG3      MET   9   3.543  -1.614 -20.310
    7    HE3  MET   9           HE1      MET   9   4.500  -1.257 -23.927
    8    HE2  MET   9           HE2      MET   9   3.454  -0.174 -23.015
    9    HE1  MET   9           HE3      MET   9   3.408  -1.906 -22.697

  No H/Q in entry =           9
  In of MODEL   66
    1    H    GLY  10           H        GLY  10   0.991   2.115 -19.764
    2    HA3  GLY  10           HA2      GLY  10   1.964   4.765 -19.519
    3    HA2  GLY  10           HA3      GLY  10   0.271   4.310 -19.708

  No H/Q in entry =           3
  In of MODEL   66
    1    H    LEU  11           H        LEU  11  -0.109   2.774 -17.424
    2    HA   LEU  11           HA       LEU  11  -0.613   4.744 -15.451
    3    HB2  LEU  11           HB2      LEU  11  -0.553   1.728 -15.308
    4    HB3  LEU  11           HB3      LEU  11  -1.045   2.746 -13.956
    5    HG   LEU  11           HG       LEU  11  -2.312   2.875 -16.706
    6   HD13  LEU  11          HD11      LEU  11  -2.894   0.731 -15.954
    7   HD12  LEU  11          HD12      LEU  11  -4.236   1.724 -15.390
    8   HD11  LEU  11          HD13      LEU  11  -2.970   1.235 -14.265
    9   HD22  LEU  11          HD21      LEU  11  -2.886   4.889 -15.685
   10   HD21  LEU  11          HD22      LEU  11  -2.796   4.215 -14.058
   11   HD23  LEU  11          HD23      LEU  11  -4.183   3.858 -15.087

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  12           H        ILE  12   1.920   2.271 -15.731
    2    HA   ILE  12           HA       ILE  12   3.153   2.794 -13.237
    3    HB   ILE  12           HB       ILE  12   4.381   1.764 -15.816
    4   HG12  ILE  12          HG12      ILE  12   2.371   0.534 -14.667
    5   HG13  ILE  12          HG13      ILE  12   3.763  -0.405 -15.167
    6   HG23  ILE  12          HG21      ILE  12   6.187   2.418 -14.401
    7   HG22  ILE  12          HG22      ILE  12   6.016   0.679 -14.163
    8   HG21  ILE  12          HG23      ILE  12   5.381   1.800 -12.961
    9   HD11  ILE  12          HD11      ILE  12   3.336   0.688 -12.375
   10   HD13  ILE  12          HD12      ILE  12   4.597  -0.429 -12.892
   11   HD12  ILE  12          HD13      ILE  12   2.924  -0.944 -12.871

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  13           H        ILE  13   3.724   4.070 -16.495
    2    HA   ILE  13           HA       ILE  13   5.874   5.780 -15.786
    3    HB   ILE  13           HB       ILE  13   3.820   5.875 -18.010
    4   HG12  ILE  13          HG12      ILE  13   5.632   4.022 -17.778
    5   HG13  ILE  13          HG13      ILE  13   5.419   4.804 -19.340
    6   HG22  ILE  13          HG21      ILE  13   5.478   7.474 -19.111
    7   HG21  ILE  13          HG22      ILE  13   6.211   7.679 -17.524
    8   HG23  ILE  13          HG23      ILE  13   4.533   8.152 -17.783
    9   HD13  ILE  13          HD11      ILE  13   7.466   5.877 -19.227
   10   HD12  ILE  13          HD12      ILE  13   7.833   4.518 -18.172
   11   HD11  ILE  13          HD13      ILE  13   7.368   6.066 -17.477

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ASN  14           H        ASN  14   2.366   6.287 -16.014
    2    HA   ASN  14           HA       ASN  14   2.340   9.030 -15.365
    3    HB2  ASN  14           HB2      ASN  14   0.432   7.398 -16.182
    4    HB3  ASN  14           HB3      ASN  14   0.129   7.213 -14.459
    5   HD21  ASN  14          HD21      ASN  14  -1.902   8.382 -15.865
    6   HD22  ASN  14          HD22      ASN  14  -1.957  10.054 -15.590

  No H/Q in entry =           6
  In of MODEL   66
    1    H    SER  15           H        SER  15   2.058   6.146 -13.298
    2    HA   SER  15           HA       SER  15   1.781   7.506 -10.840
    3    HB2  SER  15           HB2      SER  15   2.332   5.415  -9.806
    4    HB3  SER  15           HB3      SER  15   1.490   5.004 -11.296
    5    HG   SER  15           HG       SER  15   3.228   3.868 -11.648

  No H/Q in entry =           5
  In of MODEL   66
    1    H    GLY  16           H        GLY  16   4.635   6.409 -12.635
    2    HA3  GLY  16           HA2      GLY  16   6.583   7.152 -10.722
    3    HA2  GLY  16           HA3      GLY  16   6.867   6.956 -12.449

  No H/Q in entry =           3
  In of MODEL   66
    1    H    GLN  17           H        GLN  17   5.171   8.922 -13.486
    2    HA   GLN  17           HA       GLN  17   6.758  11.259 -13.185
    3    HB2  GLN  17           HB2      GLN  17   3.994  10.842 -14.357
    4    HB3  GLN  17           HB3      GLN  17   4.857  12.379 -14.432
    5    HG2  GLN  17           HG2      GLN  17   5.922   9.751 -15.504
    6    HG3  GLN  17           HG3      GLN  17   5.176  11.008 -16.488
    7   HE21  GLN  17          HE21      GLN  17   8.154   9.867 -15.802
    8   HE22  GLN  17          HE22      GLN  17   9.053  11.308 -15.846

  No H/Q in entry =           8
  In of MODEL   66
    1    H    ALA  18           H        ALA  18   3.670  10.242 -11.807
    2    HA   ALA  18           HA       ALA  18   2.963  12.627 -10.523
    3    HB1  ALA  18           HB1      ALA  18   1.827  10.174 -10.744
    4    HB2  ALA  18           HB2      ALA  18   1.293  11.390  -9.586
    5    HB3  ALA  18           HB3      ALA  18   2.386  10.103  -9.073

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ARG  19           H        ARG  19   4.845   9.855  -9.276
    2    HA   ARG  19           HA       ARG  19   5.407  11.001  -6.755
    3    HB2  ARG  19           HB2      ARG  19   5.811   8.600  -7.296
    4    HB3  ARG  19           HB3      ARG  19   7.157   9.088  -8.330
    5    HG2  ARG  19           HG2      ARG  19   8.299  10.118  -6.415
    6    HG3  ARG  19           HG3      ARG  19   6.933   9.727  -5.371
    7    HD2  ARG  19           HD2      ARG  19   8.696   8.088  -5.039
    8    HD3  ARG  19           HD3      ARG  19   7.313   7.311  -5.813
    9    HE   ARG  19           HE       ARG  19   8.997   8.136  -7.875
   10   HH21  ARG  19          HH11      ARG  19  10.546   6.732  -8.748
   11   HH22  ARG  19          HH12      ARG  19  11.099   5.379  -7.824
   12   HH11  ARG  19          HH21      ARG  19   9.095   6.094  -5.106
   13   HH12  ARG  19          HH22      ARG  19  10.274   5.018  -5.761

  No H/Q in entry =          13
  In of MODEL   66
    1    H    SER  20           H        SER  20   7.192  11.041  -9.823
    2    HA   SER  20           HA       SER  20   9.447  12.450  -9.017
    3    HB2  SER  20           HB2      SER  20   9.455  11.584 -11.225
    4    HB3  SER  20           HB3      SER  20   7.951  12.403 -11.633
    5    HG   SER  20           HG       SER  20  10.555  13.373 -11.484

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LEU  21           H        LEU  21   6.337  13.728 -10.176
    2    HA   LEU  21           HA       LEU  21   7.013  16.472  -9.947
    3    HB2  LEU  21           HB2      LEU  21   4.345  15.048  -9.848
    4    HB3  LEU  21           HB3      LEU  21   4.511  16.802  -9.840
    5    HG   LEU  21           HG       LEU  21   5.696  15.032 -11.996
    6   HD13  LEU  21          HD11      LEU  21   3.777  15.648 -13.379
    7   HD12  LEU  21          HD12      LEU  21   3.103  16.603 -12.059
    8   HD11  LEU  21          HD13      LEU  21   3.212  14.850 -11.911
    9   HD23  LEU  21          HD21      LEU  21   5.427  17.364 -13.215
   10   HD22  LEU  21          HD22      LEU  21   6.809  17.112 -12.152
   11   HD21  LEU  21          HD23      LEU  21   5.416  18.014 -11.578

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ALA  22           H        ALA  22   5.523  14.174  -7.692
    2    HA   ALA  22           HA       ALA  22   4.943  15.973  -5.612
    3    HB3  ALA  22           HB1      ALA  22   4.179  13.582  -5.777
    4    HB2  ALA  22           HB2      ALA  22   4.785  14.047  -4.186
    5    HB1  ALA  22           HB3      ALA  22   5.796  13.093  -5.272

  No H/Q in entry =           5
  In of MODEL   66
    1    H    TYR  23           H        TYR  23   7.871  13.949  -6.090
    2    HA   TYR  23           HA       TYR  23   9.279  14.958  -3.848
    3    HB2  TYR  23           HB2      TYR  23  10.052  12.955  -5.023
    4    HB3  TYR  23           HB3      TYR  23  10.351  13.900  -6.482
    5    HD1  TYR  23           HD1      TYR  23  11.357  13.529  -2.907
    6    HD2  TYR  23           HD2      TYR  23  12.378  15.089  -6.777
    7    HE1  TYR  23           HE1      TYR  23  13.624  14.101  -2.078
    8    HE2  TYR  23           HE2      TYR  23  14.644  15.662  -5.949
    9    HH   TYR  23           HH       TYR  23  15.476  16.051  -2.996

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ALA  24           H        ALA  24   9.060  16.079  -7.208
    2    HA   ALA  24           HA       ALA  24  10.957  18.164  -6.973
    3    HB2  ALA  24           HB1      ALA  24  10.491  18.235  -9.177
    4    HB3  ALA  24           HB2      ALA  24   8.940  18.982  -8.798
    5    HB1  ALA  24           HB3      ALA  24   9.064  17.230  -8.936

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ALA  25           H        ALA  25   7.485  17.975  -6.316
    2    HA   ALA  25           HA       ALA  25   7.010  20.690  -5.730
    3    HB1  ALA  25           HB1      ALA  25   5.348  18.691  -5.921
    4    HB2  ALA  25           HB2      ALA  25   4.992  19.975  -4.764
    5    HB3  ALA  25           HB3      ALA  25   5.688  18.452  -4.207

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LEU  26           H        LEU  26   8.102  18.003  -3.703
    2    HA   LEU  26           HA       LEU  26   8.232  19.425  -1.261
    3    HB2  LEU  26           HB2      LEU  26   8.330  17.008  -1.266
    4    HB3  LEU  26           HB3      LEU  26   9.790  17.021  -2.253
    5    HG   LEU  26           HG       LEU  26  11.023  18.133  -0.421
    6   HD12  LEU  26          HD11      LEU  26   9.821  18.131   1.852
    7   HD11  LEU  26          HD12      LEU  26   8.324  17.995   0.932
    8   HD13  LEU  26          HD13      LEU  26   9.364  19.403   0.718
    9   HD21  LEU  26          HD21      LEU  26   9.502  15.660   0.458
   10   HD23  LEU  26          HD22      LEU  26  11.024  16.222   1.141
   11   HD22  LEU  26          HD23      LEU  26  10.961  15.669  -0.530

  No H/Q in entry =          11
  In of MODEL   66
    1    H    LYS  27           H        LYS  27  10.622  18.865  -3.814
    2    HA   LYS  27           HA       LYS  27  12.818  20.105  -2.605
    3    HB2  LYS  27           HB2      LYS  27  12.899  18.766  -4.701
    4    HB3  LYS  27           HB3      LYS  27  12.122  20.100  -5.553
    5    HG2  LYS  27           HG2      LYS  27  13.991  21.586  -4.989
    6    HG3  LYS  27           HG3      LYS  27  14.764  20.292  -4.066
    7    HD2  LYS  27           HD2      LYS  27  14.887  18.913  -6.127
    8    HD3  LYS  27           HD3      LYS  27  14.160  20.233  -7.042
    9    HE2  LYS  27           HE2      LYS  27  16.051  21.700  -6.444
   10    HE3  LYS  27           HE3      LYS  27  16.783  20.384  -5.520
   11    HZ3  LYS  27           HZ1      LYS  27  17.749  20.494  -7.717
   12    HZ2  LYS  27           HZ2      LYS  27  16.215  20.376  -8.441
   13    HZ1  LYS  27           HZ3      LYS  27  16.849  19.063  -7.569

  No H/Q in entry =          13
  In of MODEL   66
    1    H    GLN  28           H        GLN  28  10.172  21.489  -4.519
    2    HA   GLN  28           HA       GLN  28  11.124  24.144  -4.673
    3    HB2  GLN  28           HB2      GLN  28   8.297  23.061  -4.540
    4    HB3  GLN  28           HB3      GLN  28   8.696  24.740  -4.900
    5    HG2  GLN  28           HG2      GLN  28   9.698  22.355  -6.480
    6    HG3  GLN  28           HG3      GLN  28   8.344  23.377  -6.959
    7   HE21  GLN  28          HE21      GLN  28  11.478  22.930  -7.735
    8   HE22  GLN  28          HE22      GLN  28  11.939  24.524  -8.093

  No H/Q in entry =           8
  In of MODEL   66
    1    H    ALA  29           H        ALA  29   9.222  22.438  -2.222
    2    HA   ALA  29           HA       ALA  29   8.687  24.623  -0.526
    3    HB2  ALA  29           HB1      ALA  29   7.978  23.046   1.044
    4    HB1  ALA  29           HB2      ALA  29   9.197  21.867   0.561
    5    HB3  ALA  29           HB3      ALA  29   7.799  22.161  -0.471

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LYS  30           H        LYS  30  11.421  22.362  -0.634
    2    HA   LYS  30           HA       LYS  30  12.762  23.310   1.658
    3    HB2  LYS  30           HB2      LYS  30  13.834  22.036  -0.869
    4    HB3  LYS  30           HB3      LYS  30  14.831  22.392   0.543
    5    HG2  LYS  30           HG2      LYS  30  13.296  21.000   1.934
    6    HG3  LYS  30           HG3      LYS  30  12.396  20.582   0.473
    7    HD2  LYS  30           HD2      LYS  30  14.432  19.604  -0.514
    8    HD3  LYS  30           HD3      LYS  30  15.351  20.036   0.929
    9    HE2  LYS  30           HE2      LYS  30  13.865  18.596   2.294
   10    HE3  LYS  30           HE3      LYS  30  12.975  18.144   0.834
   11    HZ2  LYS  30           HZ1      LYS  30  14.779  16.567   1.569
   12    HZ1  LYS  30           HZ2      LYS  30  15.908  17.759   1.110
   13    HZ3  LYS  30           HZ3      LYS  30  14.862  17.077  -0.046

  No H/Q in entry =          13
  In of MODEL   66
    1    H    GLN  31           H        GLN  31  12.614  24.527  -1.632
    2    HA   GLN  31           HA       GLN  31  14.767  26.424  -1.227
    3    HB2  GLN  31           HB2      GLN  31  12.699  26.474  -3.429
    4    HB3  GLN  31           HB3      GLN  31  14.318  27.174  -3.445
    5    HG2  GLN  31           HG2      GLN  31  14.793  24.477  -2.885
    6    HG3  GLN  31           HG3      GLN  31  13.476  24.424  -4.049
    7   HE21  GLN  31          HE21      GLN  31  16.317  23.640  -4.487
    8   HE22  GLN  31          HE22      GLN  31  16.873  24.619  -5.756

  No H/Q in entry =           8
  In of MODEL   66
    1    H    GLY  32           H        GLY  32  11.705  26.230  -0.049
    2    HA3  GLY  32           HA2      GLY  32  10.559  27.790   1.243
    3    HA2  GLY  32           HA3      GLY  32  11.676  29.030   0.686

  No H/Q in entry =           3
  In of MODEL   66
    1    H    ASP  33           H        ASP  33  10.289  27.133  -1.799
    2    HA   ASP  33           HA       ASP  33   8.610  29.405  -2.627
    3    HB2  ASP  33           HB2      ASP  33   9.693  26.994  -4.091
    4    HB3  ASP  33           HB3      ASP  33   8.531  28.109  -4.804

  No H/Q in entry =           4
  In of MODEL   66
    1    H    PHE  34           H        PHE  34   6.940  28.919  -1.047
    2    HA   PHE  34           HA       PHE  34   5.567  26.443  -0.946
    3    HB2  PHE  34           HB2      PHE  34   4.607  29.225  -0.245
    4    HB3  PHE  34           HB3      PHE  34   3.766  27.731   0.170
    5    HD1  PHE  34           HD1      PHE  34   6.023  30.130   1.369
    6    HD2  PHE  34           HD2      PHE  34   5.353  25.888   1.306
    7    HE1  PHE  34           HE1      PHE  34   7.437  29.875   3.389
    8    HE2  PHE  34           HE2      PHE  34   6.769  25.636   3.325
    9    HZ   PHE  34           HZ       PHE  34   7.805  27.631   4.366

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ALA  35           H        ALA  35   5.108  29.313  -2.941
    2    HA   ALA  35           HA       ALA  35   2.547  28.697  -3.940
    3    HB1  ALA  35           HB1      ALA  35   3.573  30.099  -5.984
    4    HB3  ALA  35           HB2      ALA  35   4.803  30.459  -4.772
    5    HB2  ALA  35           HB3      ALA  35   3.115  30.863  -4.461

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ALA  36           H        ALA  36   5.762  28.037  -5.332
    2    HA   ALA  36           HA       ALA  36   4.752  26.614  -7.571
    3    HB3  ALA  36           HB1      ALA  36   6.904  26.746  -8.210
    4    HB2  ALA  36           HB2      ALA  36   7.403  25.714  -6.868
    5    HB1  ALA  36           HB3      ALA  36   7.295  27.460  -6.645

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ALA  37           H        ALA  37   5.746  25.609  -4.331
    2    HA   ALA  37           HA       ALA  37   5.690  22.823  -4.770
    3    HB2  ALA  37           HB1      ALA  37   5.451  24.604  -2.382
    4    HB1  ALA  37           HB2      ALA  37   6.584  23.290  -2.692
    5    HB3  ALA  37           HB3      ALA  37   4.929  22.930  -2.204

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LYS  38           H        LYS  38   3.164  25.020  -3.566
    2    HA   LYS  38           HA       LYS  38   1.073  23.200  -3.327
    3    HB2  LYS  38           HB2      LYS  38   1.420  25.956  -3.069
    4    HB3  LYS  38           HB3      LYS  38   0.207  25.811  -4.335
    5    HG2  LYS  38           HG2      LYS  38  -1.223  24.478  -2.882
    6    HG3  LYS  38           HG3      LYS  38   0.035  24.416  -1.640
    7    HD2  LYS  38           HD2      LYS  38  -0.153  26.750  -1.181
    8    HD3  LYS  38           HD3      LYS  38  -1.081  27.043  -2.652
    9    HE2  LYS  38           HE2      LYS  38  -2.563  27.065  -0.696
   10    HE3  LYS  38           HE3      LYS  38  -2.945  25.692  -1.740
   11    HZ3  LYS  38           HZ1      LYS  38  -2.199  24.217  -0.220
   12    HZ2  LYS  38           HZ2      LYS  38  -2.541  25.469   0.878
   13    HZ1  LYS  38           HZ3      LYS  38  -0.952  25.225   0.334

  No H/Q in entry =          13
  In of MODEL   66
    1    H    ALA  39           H        ALA  39   2.016  25.116  -6.179
    2    HA   ALA  39           HA       ALA  39  -0.076  24.250  -7.862
    3    HB2  ALA  39           HB1      ALA  39   2.647  24.910  -8.943
    4    HB1  ALA  39           HB2      ALA  39   1.685  26.165  -8.163
    5    HB3  ALA  39           HB3      ALA  39   1.059  25.332  -9.585

  No H/Q in entry =           5
  In of MODEL   66
    1    H    MET  40           H        MET  40   3.171  22.958  -7.323
    2    HA   MET  40           HA       MET  40   3.057  20.945  -9.322
    3    HB2  MET  40           HB2      MET  40   4.696  21.163  -6.790
    4    HB3  MET  40           HB3      MET  40   4.937  19.913  -8.012
    5    HG2  MET  40           HG2      MET  40   4.979  22.871  -8.666
    6    HG3  MET  40           HG3      MET  40   6.433  21.971  -8.236
    7    HE3  MET  40           HE1      MET  40   7.280  19.769 -11.063
    8    HE2  MET  40           HE2      MET  40   6.735  19.442  -9.421
    9    HE1  MET  40           HE3      MET  40   7.824  20.793  -9.727

  No H/Q in entry =           9
  In of MODEL   66
    1    H    MET  41           H        MET  41   2.180  20.971  -5.888
    2    HA   MET  41           HA       MET  41   1.658  18.204  -5.615
    3    HB2  MET  41           HB2      MET  41   0.334  20.552  -4.240
    4    HB3  MET  41           HB3      MET  41   0.188  18.872  -3.737
    5    HG2  MET  41           HG2      MET  41   2.898  19.103  -3.803
    6    HG3  MET  41           HG3      MET  41   2.457  20.759  -3.396
    7    HE2  MET  41           HE1      MET  41  -0.560  19.490  -1.642
    8    HE1  MET  41           HE2      MET  41   0.248  21.007  -2.023
    9    HE3  MET  41           HE3      MET  41   0.209  20.430  -0.356

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ASP  42           H        ASP  42  -0.399  20.926  -6.556
    2    HA   ASP  42           HA       ASP  42  -2.837  19.559  -6.671
    3    HB2  ASP  42           HB2      ASP  42  -2.140  22.132  -6.925
    4    HB3  ASP  42           HB3      ASP  42  -2.309  21.743  -8.634

  No H/Q in entry =           4
  In of MODEL   66
    1    H    GLN  43           H        GLN  43  -0.425  20.167  -9.197
    2    HA   GLN  43           HA       GLN  43  -1.831  18.852 -11.277
    3    HB2  GLN  43           HB2      GLN  43   1.130  19.376 -10.925
    4    HB3  GLN  43           HB3      GLN  43   0.402  18.739 -12.402
    5    HG2  GLN  43           HG2      GLN  43  -1.116  20.762 -12.419
    6    HG3  GLN  43           HG3      GLN  43  -0.151  21.415 -11.099
    7   HE21  GLN  43          HE21      GLN  43  -0.018  23.045 -13.180
    8   HE22  GLN  43          HE22      GLN  43   1.388  22.832 -14.104

  No H/Q in entry =           8
  In of MODEL   66
    1    H    SER  44           H        SER  44   0.550  17.710  -8.916
    2    HA   SER  44           HA       SER  44   0.882  15.108  -9.955
    3    HB2  SER  44           HB2      SER  44   1.796  16.541  -7.723
    4    HB3  SER  44           HB3      SER  44   0.946  15.152  -7.049
    5    HG   SER  44           HG       SER  44   3.054  14.541  -7.501

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ARG  45           H        ARG  45  -1.417  16.409  -7.587
    2    HA   ARG  45           HA       ARG  45  -2.788  14.041  -6.946
    3    HB2  ARG  45           HB2      ARG  45  -2.981  16.204  -5.744
    4    HB3  ARG  45           HB3      ARG  45  -3.854  16.873  -7.119
    5    HG2  ARG  45           HG2      ARG  45  -5.611  15.140  -6.823
    6    HG3  ARG  45           HG3      ARG  45  -4.749  14.526  -5.412
    7    HD2  ARG  45           HD2      ARG  45  -4.952  16.787  -4.344
    8    HD3  ARG  45           HD3      ARG  45  -5.956  17.309  -5.714
    9    HE   ARG  45           HE       ARG  45  -7.046  14.925  -4.671
   10   HH21  ARG  45          HH11      ARG  45  -8.868  14.989  -3.380
   11   HH22  ARG  45          HH12      ARG  45  -9.259  16.424  -2.501
   12   HH11  ARG  45          HH21      ARG  45  -6.501  18.170  -3.641
   13   HH12  ARG  45          HH22      ARG  45  -7.914  18.225  -2.647

  No H/Q in entry =          13
  In of MODEL   66
    1    H    MET  46           H        MET  46  -3.409  16.453  -9.481
    2    HA   MET  46           HA       MET  46  -5.755  15.276 -10.522
    3    HB2  MET  46           HB2      MET  46  -3.673  17.116 -11.712
    4    HB3  MET  46           HB3      MET  46  -5.063  16.558 -12.648
    5    HG2  MET  46           HG2      MET  46  -6.583  17.452 -10.921
    6    HG3  MET  46           HG3      MET  46  -5.200  18.018  -9.991
    7    HE1  MET  46           HE1      MET  46  -3.723  19.882 -10.494
    8    HE3  MET  46           HE2      MET  46  -5.243  20.557  -9.913
    9    HE2  MET  46           HE3      MET  46  -4.396  21.331 -11.252

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ALA  47           H        ALA  47  -2.333  14.813 -11.319
    2    HA   ALA  47           HA       ALA  47  -2.695  13.093 -13.532
    3    HB3  ALA  47           HB1      ALA  47  -0.518  13.990 -13.200
    4    HB2  ALA  47           HB2      ALA  47  -0.366  12.261 -12.875
    5    HB1  ALA  47           HB3      ALA  47  -0.449  13.407 -11.536

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LEU  48           H        LEU  48  -2.386  12.445 -10.064
    2    HA   LEU  48           HA       LEU  48  -2.470   9.606 -10.232
    3    HB2  LEU  48           HB2      LEU  48  -3.218  11.512  -8.003
    4    HB3  LEU  48           HB3      LEU  48  -3.115   9.761  -7.810
    5    HG   LEU  48           HG       LEU  48  -0.834  11.473  -8.825
    6   HD13  LEU  48          HD11      LEU  48  -1.096  12.234  -6.629
    7   HD12  LEU  48          HD12      LEU  48   0.075  10.930  -6.448
    8   HD11  LEU  48          HD13      LEU  48  -1.618  10.659  -6.033
    9   HD22  LEU  48          HD21      LEU  48  -0.333   9.293  -9.480
   10   HD21  LEU  48          HD22      LEU  48  -1.185   8.568  -8.118
   11   HD23  LEU  48          HD23      LEU  48   0.387   9.327  -7.872

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ASN  49           H        ASN  49  -4.939  12.086  -9.794
    2    HA   ASN  49           HA       ASN  49  -7.112  10.410  -9.238
    3    HB2  ASN  49           HB2      ASN  49  -7.159  12.839  -8.911
    4    HB3  ASN  49           HB3      ASN  49  -7.049  13.094 -10.649
    5   HD21  ASN  49          HD21      ASN  49  -9.127  14.201 -10.666
    6   HD22  ASN  49          HD22      ASN  49 -10.579  13.345 -10.484

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLU  50           H        GLU  50  -5.871  11.624 -12.334
    2    HA   GLU  50           HA       GLU  50  -7.838  10.367 -13.964
    3    HB2  GLU  50           HB2      GLU  50  -6.388  12.195 -14.787
    4    HB3  GLU  50           HB3      GLU  50  -4.988  11.129 -14.668
    5    HG2  GLU  50           HG2      GLU  50  -5.973   9.595 -16.300
    6    HG3  GLU  50           HG3      GLU  50  -7.438  10.568 -16.368

  No H/Q in entry =           6
  In of MODEL   66
    1    H    ALA  51           H        ALA  51  -4.650   9.383 -12.796
    2    HA   ALA  51           HA       ALA  51  -4.516   6.937 -14.225
    3    HB2  ALA  51           HB1      ALA  51  -2.522   6.653 -13.147
    4    HB1  ALA  51           HB2      ALA  51  -3.195   7.066 -11.571
    5    HB3  ALA  51           HB3      ALA  51  -2.757   8.343 -12.705

  No H/Q in entry =           5
  In of MODEL   66
    1    H    HIS  52           H        HIS  52  -5.657   7.751 -10.961
    2    HA   HIS  52           HA       HIS  52  -6.324   5.135 -10.132
    3    HB2  HIS  52           HB2      HIS  52  -6.176   7.153  -8.652
    4    HB3  HIS  52           HB3      HIS  52  -7.705   7.705  -9.336
    5    HD1  HIS  52           HD1      HIS  52  -9.557   5.482  -9.311
    6    HD2  HIS  52           HD2      HIS  52  -6.686   5.810  -6.308
    7    HE1  HIS  52           HE1      HIS  52 -10.398   4.100  -7.361
    8    HE2  HIS  52           HE2      HIS  52  -8.658   4.290  -5.522

  No H/Q in entry =           8
  In of MODEL   66
    1    H    LEU  53           H        LEU  53  -8.172   7.593 -11.891
    2    HA   LEU  53           HA       LEU  53 -10.673   6.291 -11.882
    3    HB2  LEU  53           HB2      LEU  53  -9.417   8.282 -13.761
    4    HB3  LEU  53           HB3      LEU  53 -11.019   7.615 -14.063
    5    HG   LEU  53           HG       LEU  53 -10.264   8.933 -11.434
    6   HD11  LEU  53          HD11      LEU  53 -11.368  10.101 -13.988
    7   HD13  LEU  53          HD12      LEU  53 -10.036  10.694 -12.993
    8   HD12  LEU  53          HD13      LEU  53 -11.697  10.843 -12.426
    9   HD22  LEU  53          HD21      LEU  53 -12.249   7.727 -11.060
   10   HD21  LEU  53          HD22      LEU  53 -12.815   7.965 -12.708
   11   HD23  LEU  53          HD23      LEU  53 -12.887   9.287 -11.559

  No H/Q in entry =          11
  In of MODEL   66
    1    H    VAL  54           H        VAL  54  -7.945   6.113 -14.149
    2    HA   VAL  54           HA       VAL  54  -9.181   4.345 -15.986
    3    HB   VAL  54           HB       VAL  54  -6.268   4.859 -15.332
    4   HG12  VAL  54          HG11      VAL  54  -6.042   3.784 -17.728
    5   HG11  VAL  54          HG12      VAL  54  -7.563   2.996 -17.312
    6   HG13  VAL  54          HG13      VAL  54  -6.136   2.743 -16.309
    7   HG22  VAL  54          HG21      VAL  54  -7.055   6.803 -16.361
    8   HG21  VAL  54          HG22      VAL  54  -8.255   5.940 -17.320
    9   HG23  VAL  54          HG23      VAL  54  -6.553   5.867 -17.769

  No H/Q in entry =           9
  In of MODEL   66
    1    H    GLN  55           H        GLN  55  -7.150   3.794 -13.110
    2    HA   GLN  55           HA       GLN  55  -7.053   0.979 -13.378
    3    HB2  GLN  55           HB2      GLN  55  -5.485   1.874 -11.872
    4    HB3  GLN  55           HB3      GLN  55  -6.696   2.833 -11.026
    5    HG2  GLN  55           HG2      GLN  55  -7.365   1.068  -9.708
    6    HG3  GLN  55           HG3      GLN  55  -7.150  -0.113 -10.993
    7   HE21  GLN  55          HE21      GLN  55  -5.516  -1.559 -10.521
    8   HE22  GLN  55          HE22      GLN  55  -4.124  -1.207  -9.622

  No H/Q in entry =           8
  In of MODEL   66
    1    H    THR  56           H        THR  56  -9.375   3.128 -11.731
    2    HA   THR  56           HA       THR  56 -10.939   1.234 -10.433
    3    HB   THR  56           HB       THR  56 -11.854   3.742 -11.872
    4    HG1  THR  56           HG1      THR  56 -10.312   3.455  -9.827
    5   HG21  THR  56          HG21      THR  56 -13.234   1.794 -10.059
    6   HG23  THR  56          HG22      THR  56 -13.849   2.602 -11.500
    7   HG22  THR  56          HG23      THR  56 -13.675   3.499  -9.990

  No H/Q in entry =           7
  In of MODEL   66
    1    H    LYS  57           H        LYS  57 -11.180   2.330 -13.812
    2    HA   LYS  57           HA       LYS  57 -13.338   0.638 -14.550
    3    HB2  LYS  57           HB2      LYS  57 -12.491   2.594 -15.871
    4    HB3  LYS  57           HB3      LYS  57 -11.043   1.671 -16.250
    5    HG2  LYS  57           HG2      LYS  57 -12.387  -0.016 -17.409
    6    HG3  LYS  57           HG3      LYS  57 -13.865   0.843 -16.989
    7    HD2  LYS  57           HD2      LYS  57 -13.076   2.808 -18.286
    8    HD3  LYS  57           HD3      LYS  57 -11.625   1.917 -18.739
    9    HE2  LYS  57           HE2      LYS  57 -14.453   0.992 -19.359
   10    HE3  LYS  57           HE3      LYS  57 -13.424   1.843 -20.509
   11    HZ1  LYS  57           HZ1      LYS  57 -12.477  -0.602 -19.164
   12    HZ3  LYS  57           HZ2      LYS  57 -11.954   0.086 -20.627
   13    HZ2  LYS  57           HZ3      LYS  57 -13.459  -0.699 -20.543

  No H/Q in entry =          13
  In of MODEL   66
    1    H    LEU  58           H        LEU  58  -9.832   0.218 -14.530
    2    HA   LEU  58           HA       LEU  58  -9.846  -2.294 -15.828
    3    HB2  LEU  58           HB2      LEU  58  -7.797  -1.003 -14.036
    4    HB3  LEU  58           HB3      LEU  58  -7.540  -2.520 -14.898
    5    HG   LEU  58           HG       LEU  58  -8.316   0.087 -16.244
    6   HD11  LEU  58          HD11      LEU  58  -5.659  -1.145 -15.585
    7   HD13  LEU  58          HD12      LEU  58  -6.159   0.545 -15.525
    8   HD12  LEU  58          HD13      LEU  58  -5.833  -0.220 -17.077
    9   HD22  LEU  58          HD21      LEU  58  -8.903  -1.471 -17.835
   10   HD21  LEU  58          HD22      LEU  58  -7.851  -2.718 -17.169
   11   HD23  LEU  58          HD23      LEU  58  -7.175  -1.439 -18.176

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  59           H        ILE  59 -10.637  -1.406 -12.566
    2    HA   ILE  59           HA       ILE  59 -10.267  -4.175 -11.631
    3    HB   ILE  59           HB       ILE  59  -9.813  -1.916 -10.228
    4   HG12  ILE  59          HG12      ILE  59 -11.183  -4.245  -8.874
    5   HG13  ILE  59          HG13      ILE  59  -9.563  -4.370  -9.510
    6   HG21  ILE  59          HG21      ILE  59 -12.346  -1.389 -10.458
    7   HG23  ILE  59          HG22      ILE  59 -11.625  -1.231  -8.874
    8   HG22  ILE  59          HG23      ILE  59 -12.579  -2.655  -9.277
    9   HD12  ILE  59          HD11      ILE  59 -10.521  -2.426  -7.424
   10   HD11  ILE  59          HD12      ILE  59  -8.915  -2.373  -8.141
   11   HD13  ILE  59          HD13      ILE  59  -9.404  -3.763  -7.170

  No H/Q in entry =          11
  In of MODEL   66
    1    H    GLU  60           H        GLU  60 -12.841  -1.865 -12.406
    2    HA   GLU  60           HA       GLU  60 -15.010  -3.393 -11.376
    3    HB2  GLU  60           HB2      GLU  60 -15.272  -1.034 -11.943
    4    HB3  GLU  60           HB3      GLU  60 -14.904  -1.369 -13.631
    5    HG2  GLU  60           HG2      GLU  60 -17.197  -2.770 -12.270
    6    HG3  GLU  60           HG3      GLU  60 -17.404  -1.163 -12.935

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLY  61           H        GLY  61 -13.368  -3.361 -14.508
    2    HA3  GLY  61           HA2      GLY  61 -15.083  -5.608 -15.389
    3    HA2  GLY  61           HA3      GLY  61 -14.252  -4.497 -16.471

  No H/Q in entry =           3
  In of MODEL   66
    1    H    ASP  62           H        ASP  62 -12.843  -5.950 -13.606
    2    HA   ASP  62           HA       ASP  62 -10.615  -6.939 -15.125
    3    HB2  ASP  62           HB2      ASP  62 -10.338  -5.992 -12.878
    4    HB3  ASP  62           HB3      ASP  62 -11.352  -7.263 -12.206

  No H/Q in entry =           4
  In of MODEL   66
    1    H    ALA  63           H        ALA  63 -10.725  -8.794 -16.309
    2    HA   ALA  63           HA       ALA  63 -12.124 -11.138 -15.114
    3    HB2  ALA  63           HB1      ALA  63 -12.581 -11.827 -17.498
    4    HB1  ALA  63           HB2      ALA  63 -11.959 -10.263 -18.020
    5    HB3  ALA  63           HB3      ALA  63 -13.414 -10.348 -17.025

  No H/Q in entry =           5
  In of MODEL   66
    1    H    GLY  64           H        GLY  64  -9.387  -9.816 -16.762
    2    HA3  GLY  64           HA2      GLY  64  -7.246 -10.603 -17.040
    3    HA2  GLY  64           HA3      GLY  64  -7.679 -11.993 -16.054

  No H/Q in entry =           3
  In of MODEL   66
    1    H    GLU  65           H        GLU  65  -6.415 -13.287 -17.560
    2    HA   GLU  65           HA       GLU  65  -6.987 -13.447 -20.308
    3    HB2  GLU  65           HB2      GLU  65  -5.789 -15.491 -18.439
    4    HB3  GLU  65           HB3      GLU  65  -5.840 -15.663 -20.194
    5    HG2  GLU  65           HG2      GLU  65  -3.747 -14.687 -19.891
    6    HG3  GLU  65           HG3      GLU  65  -4.757 -13.271 -20.178

  No H/Q in entry =           6
  In of MODEL   66
    1    H    GLY  66           H        GLY  66  -8.259 -15.220 -17.587
    2    HA3  GLY  66           HA2      GLY  66 -10.138 -16.704 -19.280
    3    HA2  GLY  66           HA3      GLY  66  -9.716 -17.098 -17.626

  No H/Q in entry =           3
  In of MODEL   66
    1    H    LYS  67           H        LYS  67 -12.242 -17.233 -18.035
    2    HA   LYS  67           HA       LYS  67 -13.785 -14.892 -17.986
    3    HB2  LYS  67           HB2      LYS  67 -15.430 -16.694 -16.835
    4    HB3  LYS  67           HB3      LYS  67 -15.097 -16.639 -18.571
    5    HG2  LYS  67           HG2      LYS  67 -13.458 -18.350 -18.427
    6    HG3  LYS  67           HG3      LYS  67 -13.340 -18.199 -16.675
    7    HD2  LYS  67           HD2      LYS  67 -14.602 -20.203 -17.165
    8    HD3  LYS  67           HD3      LYS  67 -15.725 -19.000 -16.525
    9    HE2  LYS  67           HE2      LYS  67 -16.488 -18.431 -18.752
   10    HE3  LYS  67           HE3      LYS  67 -15.246 -19.447 -19.484
   11    HZ1  LYS  67           HZ1      LYS  67 -16.935 -20.804 -17.578
   12    HZ3  LYS  67           HZ2      LYS  67 -16.429 -21.290 -19.125
   13    HZ2  LYS  67           HZ3      LYS  67 -17.755 -20.244 -18.953

  No H/Q in entry =          13
  In of MODEL   66
    1    H    MET  68           H        MET  68 -13.638 -17.153 -15.304
    2    HA   MET  68           HA       MET  68 -14.523 -15.354 -13.331
    3    HB2  MET  68           HB2      MET  68 -13.190 -18.045 -13.240
    4    HB3  MET  68           HB3      MET  68 -13.626 -17.177 -11.768
    5    HG2  MET  68           HG2      MET  68 -15.564 -17.812 -14.010
    6    HG3  MET  68           HG3      MET  68 -15.405 -18.763 -12.531
    7    HE3  MET  68           HE1      MET  68 -16.669 -16.844  -9.731
    8    HE2  MET  68           HE2      MET  68 -15.027 -16.363 -10.154
    9    HE1  MET  68           HE3      MET  68 -15.531 -18.038 -10.372

  No H/Q in entry =           9
  In of MODEL   66
    1    H    LYS  69           H        LYS  69 -11.194 -16.357 -14.175
    2    HA   LYS  69           HA       LYS  69  -9.899 -15.292 -11.954
    3    HB2  LYS  69           HB2      LYS  69  -8.943 -15.737 -14.779
    4    HB3  LYS  69           HB3      LYS  69  -7.868 -15.252 -13.466
    5    HG2  LYS  69           HG2      LYS  69  -8.543 -17.235 -12.167
    6    HG3  LYS  69           HG3      LYS  69  -9.639 -17.715 -13.461
    7    HD2  LYS  69           HD2      LYS  69  -7.709 -17.892 -15.009
    8    HD3  LYS  69           HD3      LYS  69  -6.625 -17.470 -13.682
    9    HE2  LYS  69           HE2      LYS  69  -8.506 -19.849 -13.658
   10    HE3  LYS  69           HE3      LYS  69  -6.793 -19.941 -14.060
   11    HZ3  LYS  69           HZ1      LYS  69  -6.219 -19.167 -11.895
   12    HZ2  LYS  69           HZ2      LYS  69  -7.308 -20.457 -11.711
   13    HZ1  LYS  69           HZ3      LYS  69  -7.840 -18.857 -11.504

  No H/Q in entry =          13
  In of MODEL   66
    1    H    VAL  70           H        VAL  70  -7.917 -13.589 -12.556
    2    HA   VAL  70           HA       VAL  70  -9.186 -11.077 -13.477
    3    HB   VAL  70           HB       VAL  70  -8.031  -9.931 -11.584
    4   HG13  VAL  70          HG11      VAL  70  -9.719 -10.461  -9.980
    5   HG12  VAL  70          HG12      VAL  70  -9.856 -12.118 -10.571
    6   HG11  VAL  70          HG13      VAL  70 -10.451 -10.780 -11.553
    7   HG23  VAL  70          HG21      VAL  70  -7.276 -11.393  -9.670
    8   HG22  VAL  70          HG22      VAL  70  -6.276 -11.552 -11.112
    9   HG21  VAL  70          HG23      VAL  70  -7.465 -12.794 -10.723

  No H/Q in entry =           9
  In of MODEL   66
    1    H    SER  71           H        SER  71  -7.620  -9.423 -14.053
    2    HA   SER  71           HA       SER  71  -5.426 -10.451 -15.598
    3    HB2  SER  71           HB2      SER  71  -6.786  -8.420 -16.216
    4    HB3  SER  71           HB3      SER  71  -6.025  -7.573 -14.872
    5    HG   SER  71           HG       SER  71  -4.797  -7.168 -16.664

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LEU  72           H        LEU  72  -3.391 -10.758 -14.966
    2    HA   LEU  72           HA       LEU  72  -2.644 -10.550 -12.261
    3    HB2  LEU  72           HB2      LEU  72  -1.013 -10.966 -14.762
    4    HB3  LEU  72           HB3      LEU  72  -0.336 -11.044 -13.139
    5    HG   LEU  72           HG       LEU  72  -2.691 -12.739 -14.031
    6   HD11  LEU  72          HD11      LEU  72   0.283 -13.309 -14.041
    7   HD13  LEU  72          HD12      LEU  72  -0.839 -13.418 -15.396
    8   HD12  LEU  72          HD13      LEU  72  -0.937 -14.583 -14.075
    9   HD21  LEU  72          HD21      LEU  72  -0.934 -12.605 -11.589
   10   HD23  LEU  72          HD22      LEU  72  -1.652 -14.142 -12.042
   11   HD22  LEU  72          HD23      LEU  72  -2.685 -12.763 -11.678

  No H/Q in entry =          11
  In of MODEL   66
    1    H    VAL  73           H        VAL  73  -1.961  -8.524 -15.043
    2    HA   VAL  73           HA       VAL  73  -0.034  -6.824 -13.953
    3    HB   VAL  73           HB       VAL  73  -0.406  -5.435 -15.814
    4   HG13  VAL  73          HG11      VAL  73  -0.377  -6.974 -17.621
    5   HG12  VAL  73          HG12      VAL  73  -1.445  -8.099 -16.785
    6   HG11  VAL  73          HG13      VAL  73   0.220  -7.895 -16.242
    7   HG22  VAL  73          HG21      VAL  73  -2.722  -4.891 -15.586
    8   HG21  VAL  73          HG22      VAL  73  -3.206  -6.576 -15.768
    9   HG23  VAL  73          HG23      VAL  73  -2.571  -5.688 -17.153

  No H/Q in entry =           9
  In of MODEL   66
    1    H    LEU  74           H        LEU  74  -3.425  -6.949 -13.362
    2    HA   LEU  74           HA       LEU  74  -4.043  -4.297 -12.735
    3    HB2  LEU  74           HB2      LEU  74  -5.764  -5.978 -12.900
    4    HB3  LEU  74           HB3      LEU  74  -5.064  -6.887 -11.562
    5    HG   LEU  74           HG       LEU  74  -5.491  -4.919 -10.069
    6   HD11  LEU  74          HD11      LEU  74  -6.662  -3.874 -12.643
    7   HD13  LEU  74          HD12      LEU  74  -5.592  -3.051 -11.509
    8   HD12  LEU  74          HD13      LEU  74  -7.284  -3.328 -11.085
    9   HD21  LEU  74          HD21      LEU  74  -7.083  -6.912 -10.616
   10   HD23  LEU  74          HD22      LEU  74  -8.024  -5.674 -11.418
   11   HD22  LEU  74          HD23      LEU  74  -7.700  -5.535  -9.708

  No H/Q in entry =          11
  In of MODEL   66
    1    H    VAL  75           H        VAL  75  -2.975  -6.887 -10.592
    2    HA   VAL  75           HA       VAL  75  -2.757  -5.343  -8.246
    3    HB   VAL  75           HB       VAL  75  -1.270  -7.835  -9.061
    4   HG11  VAL  75          HG11      VAL  75  -1.423  -6.358  -6.395
    5   HG13  VAL  75          HG12      VAL  75   0.020  -6.637  -7.359
    6   HG12  VAL  75          HG13      VAL  75  -0.792  -7.991  -6.592
    7   HG21  VAL  75          HG21      VAL  75  -3.738  -8.020  -8.830
    8   HG23  VAL  75          HG22      VAL  75  -3.632  -7.320  -7.215
    9   HG22  VAL  75          HG23      VAL  75  -2.908  -8.896  -7.544

  No H/Q in entry =           9
  In of MODEL   66
    1    H    GLU  76           H        GLU  76  -0.372  -6.090 -10.808
    2    HA   GLU  76           HA       GLU  76   1.822  -4.741  -9.668
    3    HB2  GLU  76           HB2      GLU  76   1.969  -6.220 -11.674
    4    HB3  GLU  76           HB3      GLU  76   1.104  -5.012 -12.609
    5    HG2  GLU  76           HG2      GLU  76   2.927  -3.394 -12.242
    6    HG3  GLU  76           HG3      GLU  76   3.809  -4.567 -11.283

  No H/Q in entry =           6
  In of MODEL   66
    1    H    ALA  77           H        ALA  77  -0.734  -3.539 -11.828
    2    HA   ALA  77           HA       ALA  77   0.248  -0.890 -12.005
    3    HB3  ALA  77           HB1      ALA  77  -2.627  -1.832 -12.198
    4    HB1  ALA  77           HB2      ALA  77  -1.467  -1.858 -13.526
    5    HB2  ALA  77           HB3      ALA  77  -1.974  -0.319 -12.829

  No H/Q in entry =           5
  In of MODEL   66
    1    H    GLN  78           H        GLN  78  -1.994  -2.458  -9.777
    2    HA   GLN  78           HA       GLN  78  -2.794  -0.146  -8.361
    3    HB2  GLN  78           HB2      GLN  78  -3.889  -2.417  -8.277
    4    HB3  GLN  78           HB3      GLN  78  -2.548  -2.963  -7.273
    5    HG2  GLN  78           HG2      GLN  78  -3.076  -1.219  -5.617
    6    HG3  GLN  78           HG3      GLN  78  -4.420  -0.672  -6.618
    7   HE21  GLN  78          HE21      GLN  78  -4.949  -1.591  -3.992
    8   HE22  GLN  78          HE22      GLN  78  -5.764  -3.077  -4.079

  No H/Q in entry =           8
  In of MODEL   66
    1    H    LEU  79           H        LEU  79  -0.105  -2.395  -7.944
    2    HA   LEU  79           HA       LEU  79   0.893  -1.503  -5.493
    3    HB2  LEU  79           HB2      LEU  79   1.758  -3.506  -6.575
    4    HB3  LEU  79           HB3      LEU  79   2.388  -2.548  -7.912
    5    HG   LEU  79           HG       LEU  79   3.955  -1.409  -6.420
    6   HD13  LEU  79          HD11      LEU  79   2.970  -1.173  -4.343
    7   HD12  LEU  79          HD12      LEU  79   4.056  -2.520  -4.013
    8   HD11  LEU  79          HD13      LEU  79   2.349  -2.824  -4.327
    9   HD23  LEU  79          HD21      LEU  79   5.181  -3.556  -5.535
   10   HD22  LEU  79          HD22      LEU  79   4.961  -3.352  -7.270
   11   HD21  LEU  79          HD23      LEU  79   3.894  -4.428  -6.371

  No H/Q in entry =          11
  In of MODEL   66
    1    H    HIS  80           H        HIS  80   1.728  -0.373  -8.771
    2    HA   HIS  80           HA       HIS  80   3.537   1.618  -7.860
    3    HB2  HIS  80           HB2      HIS  80   2.225   0.926 -10.432
    4    HB3  HIS  80           HB3      HIS  80   2.816   2.580 -10.262
    5    HD1  HIS  80           HD1      HIS  80   5.211   2.891 -10.806
    6    HD2  HIS  80           HD2      HIS  80   4.418  -1.026  -9.619
    7    HE1  HIS  80           HE1      HIS  80   7.404   1.623 -10.997
    8    HE2  HIS  80           HE2      HIS  80   6.932  -0.768 -10.277

  No H/Q in entry =           8
  In of MODEL   66
    1    H    LEU  81           H        LEU  81   0.123   1.768  -8.807
    2    HA   LEU  81           HA       LEU  81  -0.159   4.558  -8.465
    3    HB2  LEU  81           HB2      LEU  81  -2.164   2.304  -8.373
    4    HB3  LEU  81           HB3      LEU  81  -2.622   4.005  -8.272
    5    HG   LEU  81           HG       LEU  81  -0.946   2.869 -10.527
    6   HD12  LEU  81          HD11      LEU  81  -3.192   3.184 -11.804
    7   HD11  LEU  81          HD12      LEU  81  -3.932   3.107 -10.206
    8   HD13  LEU  81          HD13      LEU  81  -2.989   1.745 -10.806
    9   HD23  LEU  81          HD21      LEU  81  -2.062   5.012 -11.607
   10   HD22  LEU  81          HD22      LEU  81  -0.637   5.186 -10.587
   11   HD21  LEU  81          HD23      LEU  81  -2.237   5.525  -9.930

  No H/Q in entry =          11
  In of MODEL   66
    1    H    MET  82           H        MET  82  -0.786   1.861  -6.218
    2    HA   MET  82           HA       MET  82  -1.825   3.436  -4.116
    3    HB2  MET  82           HB2      MET  82  -0.440   0.756  -4.177
    4    HB3  MET  82           HB3      MET  82  -1.007   1.474  -2.671
    5    HG2  MET  82           HG2      MET  82  -2.761   0.980  -5.098
    6    HG3  MET  82           HG3      MET  82  -2.665  -0.098  -3.707
    7    HE3  MET  82           HE1      MET  82  -4.368   1.535  -0.870
    8    HE2  MET  82           HE2      MET  82  -2.641   1.821  -1.070
    9    HE1  MET  82           HE3      MET  82  -3.327   0.262  -1.523

  No H/Q in entry =           9
  In of MODEL   66
    1    H    THR  83           H        THR  83   1.474   2.368  -4.840
    2    HA   THR  83           HA       THR  83   2.708   3.471  -2.548
    3    HB   THR  83           HB       THR  83   4.789   3.430  -4.041
    4    HG1  THR  83           HG1      THR  83   4.533   2.909  -6.065
    5   HG22  THR  83          HG21      THR  83   4.354   0.771  -4.378
    6   HG21  THR  83          HG22      THR  83   3.074   1.141  -3.224
    7   HG23  THR  83          HG23      THR  83   4.755   1.491  -2.819

  No H/Q in entry =           7
  In of MODEL   66
    1    H    SER  84           H        SER  84   2.300   4.759  -5.840
    2    HA   SER  84           HA       SER  84   3.632   7.204  -5.390
    3    HB2  SER  84           HB2      SER  84   1.547   6.368  -7.392
    4    HB3  SER  84           HB3      SER  84   2.218   7.999  -7.368
    5    HG   SER  84           HG       SER  84   3.599   5.531  -7.680

  No H/Q in entry =           5
  In of MODEL   66
    1    H    MET  85           H        MET  85   0.144   6.431  -5.187
    2    HA   MET  85           HA       MET  85  -0.724   9.035  -4.570
    3    HB2  MET  85           HB2      MET  85  -2.246   7.224  -5.230
    4    HB3  MET  85           HB3      MET  85  -1.937   6.410  -3.697
    5    HG2  MET  85           HG2      MET  85  -2.817   8.365  -2.474
    6    HG3  MET  85           HG3      MET  85  -3.117   9.186  -4.005
    7    HE3  MET  85           HE1      MET  85  -5.436   9.442  -4.640
    8    HE2  MET  85           HE2      MET  85  -6.358   8.061  -5.228
    9    HE1  MET  85           HE3      MET  85  -4.735   8.357  -5.846

  No H/Q in entry =           9
  In of MODEL   66
    1    H    LEU  86           H        LEU  86   0.228   6.370  -2.444
    2    HA   LEU  86           HA       LEU  86  -0.288   7.662   0.008
    3    HB2  LEU  86           HB2      LEU  86   0.182   5.195  -0.399
    4    HB3  LEU  86           HB3      LEU  86   1.887   5.631  -0.509
    5    HG   LEU  86           HG       LEU  86   1.579   6.784   1.767
    6   HD11  LEU  86          HD11      LEU  86  -1.117   6.008   1.318
    7   HD13  LEU  86          HD12      LEU  86  -0.440   6.753   2.765
    8   HD12  LEU  86          HD13      LEU  86  -0.525   4.997   2.640
    9   HD23  LEU  86          HD21      LEU  86   1.163   3.789   1.882
   10   HD22  LEU  86          HD22      LEU  86   2.171   4.799   2.916
   11   HD21  LEU  86          HD23      LEU  86   2.658   4.482   1.252

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ALA  87           H        ALA  87   2.676   7.385  -1.911
    2    HA   ALA  87           HA       ALA  87   4.393   8.796  -0.197
    3    HB3  ALA  87           HB1      ALA  87   4.466   7.793  -2.909
    4    HB2  ALA  87           HB2      ALA  87   5.810   8.124  -1.820
    5    HB1  ALA  87           HB3      ALA  87   5.181   9.406  -2.853

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ARG  88           H        ARG  88   2.416   9.935  -2.895
    2    HA   ARG  88           HA       ARG  88   3.184  12.626  -2.776
    3    HB2  ARG  88           HB2      ARG  88   1.915  11.476  -4.625
    4    HB3  ARG  88           HB3      ARG  88   0.467  11.612  -3.628
    5    HG2  ARG  88           HG2      ARG  88   1.480  14.195  -3.545
    6    HG3  ARG  88           HG3      ARG  88   1.890  13.688  -5.181
    7    HD2  ARG  88           HD2      ARG  88  -0.258  13.764  -5.858
    8    HD3  ARG  88           HD3      ARG  88  -0.829  12.905  -4.427
    9    HE   ARG  88           HE       ARG  88  -1.030  15.683  -4.833
   10   HH21  ARG  88          HH11      ARG  88  -1.544  17.005  -3.086
   11   HH22  ARG  88          HH12      ARG  88  -1.231  16.463  -1.473
   12   HH11  ARG  88          HH21      ARG  88   0.014  13.415  -2.477
   13   HH12  ARG  88          HH22      ARG  88  -0.366  14.424  -1.129

  No H/Q in entry =          13
  In of MODEL   66
    1    H    GLU  89           H        GLU  89   0.500  10.939  -1.116
    2    HA   GLU  89           HA       GLU  89  -0.601  13.244   0.108
    3    HB2  GLU  89           HB2      GLU  89  -1.714  11.002   0.024
    4    HB3  GLU  89           HB3      GLU  89  -0.577  10.445   1.252
    5    HG2  GLU  89           HG2      GLU  89  -1.386  12.136   2.825
    6    HG3  GLU  89           HG3      GLU  89  -2.452  12.809   1.595

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LEU  90           H        LEU  90   1.867  10.953   1.250
    2    HA   LEU  90           HA       LEU  90   2.245  12.188   3.780
    3    HB2  LEU  90           HB2      LEU  90   4.005  10.424   2.079
    4    HB3  LEU  90           HB3      LEU  90   4.439  10.935   3.716
    5    HG   LEU  90           HG       LEU  90   1.800   9.587   3.075
    6   HD12  LEU  90          HD11      LEU  90   2.954   7.540   4.065
    7   HD11  LEU  90          HD12      LEU  90   4.472   8.399   3.811
    8   HD13  LEU  90          HD13      LEU  90   3.447   7.995   2.433
    9   HD22  LEU  90          HD21      LEU  90   1.555  10.502   5.203
   10   HD21  LEU  90          HD22      LEU  90   3.277  10.396   5.568
   11   HD23  LEU  90          HD23      LEU  90   2.273   8.947   5.621

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  91           H        ILE  91   3.817  12.585   0.639
    2    HA   ILE  91           HA       ILE  91   5.799  14.416   1.466
    3    HB   ILE  91           HB       ILE  91   4.462  13.934  -1.202
    4   HG12  ILE  91          HG12      ILE  91   7.304  13.447  -0.258
    5   HG13  ILE  91          HG13      ILE  91   6.026  12.247  -0.088
    6   HG22  ILE  91          HG21      ILE  91   6.676  15.287  -1.908
    7   HG21  ILE  91          HG22      ILE  91   6.380  16.081  -0.361
    8   HG23  ILE  91          HG23      ILE  91   5.145  16.113  -1.617
    9   HD13  ILE  91          HD11      ILE  91   5.831  11.932  -2.394
   10   HD12  ILE  91          HD12      ILE  91   7.567  12.177  -2.197
   11   HD11  ILE  91          HD13      ILE  91   6.549  13.500  -2.768

  No H/Q in entry =          11
  In of MODEL   66
    1    H    THR  92           H        THR  92   2.427  14.848   0.493
    2    HA   THR  92           HA       THR  92   2.397  17.672   0.444
    3    HB   THR  92           HB       THR  92   0.239  15.672   1.157
    4    HG1  THR  92           HG1      THR  92   0.523  15.502  -0.932
    5   HG22  THR  92          HG21      THR  92  -1.172  17.835   0.457
    6   HG21  THR  92          HG22      THR  92   0.227  18.659   1.143
    7   HG23  THR  92          HG23      THR  92  -0.704  17.533   2.130

  No H/Q in entry =           7
  In of MODEL   66
    1    H    GLU  93           H        GLU  93   1.877  15.361   3.094
    2    HA   GLU  93           HA       GLU  93   1.363  17.257   5.125
    3    HB2  GLU  93           HB2      GLU  93   2.681  14.532   5.337
    4    HB3  GLU  93           HB3      GLU  93   2.003  15.454   6.681
    5    HG2  GLU  93           HG2      GLU  93   0.367  14.683   4.255
    6    HG3  GLU  93           HG3      GLU  93   0.484  13.655   5.678

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LEU  94           H        LEU  94   4.360  15.782   3.940
    2    HA   LEU  94           HA       LEU  94   6.128  16.924   5.815
    3    HB2  LEU  94           HB2      LEU  94   6.502  15.968   2.977
    4    HB3  LEU  94           HB3      LEU  94   7.841  16.623   3.915
    5    HG   LEU  94           HG       LEU  94   6.114  14.421   5.059
    6   HD11  LEU  94          HD11      LEU  94   8.189  14.205   2.906
    7   HD13  LEU  94          HD12      LEU  94   6.746  13.229   3.178
    8   HD12  LEU  94          HD13      LEU  94   8.182  12.974   4.170
    9   HD23  LEU  94          HD21      LEU  94   8.316  13.882   6.188
   10   HD22  LEU  94          HD22      LEU  94   7.651  15.458   6.617
   11   HD21  LEU  94          HD23      LEU  94   8.979  15.343   5.461

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  95           H        ILE  95   4.956  18.106   2.681
    2    HA   ILE  95           HA       ILE  95   6.526  20.465   2.615
    3    HB   ILE  95           HB       ILE  95   3.870  19.784   1.333
    4   HG12  ILE  95          HG12      ILE  95   6.647  20.128   0.170
    5   HG13  ILE  95          HG13      ILE  95   6.004  18.573   0.685
    6   HG21  ILE  95          HG21      ILE  95   5.615  22.254   1.105
    7   HG23  ILE  95          HG22      ILE  95   3.893  22.183   1.478
    8   HG22  ILE  95          HG23      ILE  95   4.461  21.789  -0.145
    9   HD13  ILE  95          HD11      ILE  95   4.427  18.502  -1.029
   10   HD12  ILE  95          HD12      ILE  95   5.768  19.324  -1.827
   11   HD11  ILE  95          HD13      ILE  95   4.400  20.256  -1.217

  No H/Q in entry =          11
  In of MODEL   66
    1    H    GLU  96           H        GLU  96   3.290  19.806   3.940
    2    HA   GLU  96           HA       GLU  96   2.676  22.449   4.707
    3    HB2  GLU  96           HB2      GLU  96   1.003  20.665   4.728
    4    HB3  GLU  96           HB3      GLU  96   1.877  19.833   6.012
    5    HG2  GLU  96           HG2      GLU  96   0.872  21.110   7.596
    6    HG3  GLU  96           HG3      GLU  96   1.398  22.587   6.800

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LEU  97           H        LEU  97   4.536  19.894   6.304
    2    HA   LEU  97           HA       LEU  97   4.917  21.233   8.776
    3    HB2  LEU  97           HB2      LEU  97   6.441  19.070   7.339
    4    HB3  LEU  97           HB3      LEU  97   7.046  19.750   8.848
    5    HG   LEU  97           HG       LEU  97   4.234  18.656   8.560
    6   HD12  LEU  97          HD11      LEU  97   5.187  16.640   9.756
    7   HD11  LEU  97          HD12      LEU  97   6.794  17.273   9.399
    8   HD13  LEU  97          HD13      LEU  97   5.711  16.819   8.082
    9   HD23  LEU  97          HD21      LEU  97   4.712  18.352  11.119
   10   HD22  LEU  97          HD22      LEU  97   4.325  19.966  10.524
   11   HD21  LEU  97          HD23      LEU  97   6.000  19.526  10.851

  No H/Q in entry =          11
  In of MODEL   66
    1    H    HIS  98           H        HIS  98   6.758  21.261   5.733
    2    HA   HIS  98           HA       HIS  98   8.920  22.838   6.617
    3    HB2  HIS  98           HB2      HIS  98   7.600  22.593   3.903
    4    HB3  HIS  98           HB3      HIS  98   9.042  23.571   4.183
    5    HD1  HIS  98           HD1      HIS  98   7.832  20.000   4.201
    6    HD2  HIS  98           HD2      HIS  98  11.417  22.096   4.599
    7    HE1  HIS  98           HE1      HIS  98   9.687  18.271   4.119
    8    HE2  HIS  98           HE2      HIS  98  11.874  19.527   4.361

  No H/Q in entry =           8
  In of MODEL   66
    1    H    GLU  99           H        GLU  99   5.687  23.677   5.476
    2    HA   GLU  99           HA       GLU  99   6.065  26.492   5.426
    3    HB2  GLU  99           HB2      GLU  99   4.175  25.327   4.309
    4    HB3  GLU  99           HB3      GLU  99   3.495  24.960   5.893
    5    HG2  GLU  99           HG2      GLU  99   3.319  27.349   6.405
    6    HG3  GLU  99           HG3      GLU  99   4.080  27.755   4.870

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LYS 100           H        LYS 100   4.959  24.247   7.950
    2    HA   LYS 100           HA       LYS 100   4.391  26.294   9.857
    3    HB2  LYS 100           HB2      LYS 100   4.970  23.341  10.186
    4    HB3  LYS 100           HB3      LYS 100   4.536  24.409  11.527
    5    HG2  LYS 100           HG2      LYS 100   2.458  25.051  10.301
    6    HG3  LYS 100           HG3      LYS 100   2.873  23.887   9.040
    7    HD2  LYS 100           HD2      LYS 100   2.811  22.060  10.695
    8    HD3  LYS 100           HD3      LYS 100   2.413  23.218  11.967
    9    HE2  LYS 100           HE2      LYS 100   0.348  23.844  10.727
   10    HE3  LYS 100           HE3      LYS 100   0.736  22.629   9.502
   11    HZ1  LYS 100           HZ1      LYS 100   0.498  21.951  12.383
   12    HZ3  LYS 100           HZ2      LYS 100   0.470  20.902  11.044
   13    HZ2  LYS 100           HZ3      LYS 100  -0.843  21.941  11.341

  No H/Q in entry =          13
  In of MODEL   66
    1    H    LEU 101           H        LEU 101   7.306  24.501   8.988
    2    HA   LEU 101           HA       LEU 101   8.927  25.332  11.179
    3    HB2  LEU 101           HB2      LEU 101   9.494  24.356   8.391
    4    HB3  LEU 101           HB3      LEU 101  10.805  25.017   9.363
    5    HG   LEU 101           HG       LEU 101   8.983  22.857  10.436
    6   HD12  LEU 101          HD11      LEU 101  11.031  21.364   9.802
    7   HD11  LEU 101          HD12      LEU 101  11.386  22.632   8.630
    8   HD13  LEU 101          HD13      LEU 101   9.856  21.759   8.548
    9   HD21  LEU 101          HD21      LEU 101  11.715  23.962  11.141
   10   HD23  LEU 101          HD22      LEU 101  11.176  22.387  11.720
   11   HD22  LEU 101          HD23      LEU 101  10.289  23.842  12.172

  No H/Q in entry =          11
  In of MODEL   66
    1    H    LYS 102           H        LYS 102   7.323  27.205   9.061
    2    HA   LYS 102           HA       LYS 102   7.399  29.499   8.777
    3    HB2  LYS 102           HB2      LYS 102   8.984  29.374  10.860
    4    HB3  LYS 102           HB3      LYS 102  10.272  29.573   9.689
    5    HG2  LYS 102           HG2      LYS 102   8.176  31.523  10.578
    6    HG3  LYS 102           HG3      LYS 102   9.886  31.784  10.311
    7    HD2  LYS 102           HD2      LYS 102   7.913  31.370   8.029
    8    HD3  LYS 102           HD3      LYS 102   8.303  32.947   8.700
    9    HE2  LYS 102           HE2      LYS 102   9.655  31.770   6.608
   10    HE3  LYS 102           HE3      LYS 102  10.282  33.072   7.619
   11    HZ2  LYS 102           HZ1      LYS 102  11.800  31.167   7.421
   12    HZ1  LYS 102           HZ2      LYS 102  10.644  30.183   8.171
   13    HZ3  LYS 102           HZ3      LYS 102  11.346  31.466   9.028

  No H/Q in entry =          13
  In of MODEL   66
    1    H    ALA 103           H        ALA 103  10.649  28.160   8.176
    2    HA   ALA 103           HA       ALA 103  11.594  29.544   6.096
    3    HB2  ALA 103           HB1      ALA 103  12.469  27.333   5.151
    4    HB1  ALA 103           HB2      ALA 103  11.586  26.554   6.463
    5    HB3  ALA 103           HB3      ALA 103  12.880  27.696   6.828

  No H/Q in entry =           5
  In of MODEL   66
    1    H1   LYS   3           H1       LYS   3 -31.231   5.774 -19.916
    2    H2   LYS   3           H3       LYS   3 -30.236   5.477 -21.260
    3    H3   LYS   3           H2       LYS   3 -31.623   4.532 -21.004
    4    HA   LYS   3           HA       LYS   3 -30.613   3.169 -19.581
    5    HB2  LYS   3           HB2      LYS   3 -28.340   4.585 -20.924
    6    HB3  LYS   3           HB3      LYS   3 -28.008   3.395 -19.665
    7    HG2  LYS   3           HG2      LYS   3 -29.413   1.780 -20.999
    8    HG3  LYS   3           HG3      LYS   3 -29.374   2.964 -22.305
    9    HD2  LYS   3           HD2      LYS   3 -26.890   2.872 -22.245
   10    HD3  LYS   3           HD3      LYS   3 -27.002   1.588 -21.042
   11    HE2  LYS   3           HE2      LYS   3 -28.485   0.379 -22.749
   12    HE3  LYS   3           HE3      LYS   3 -27.872   1.547 -23.918
   13    HZ3  LYS   3           HZ1      LYS   3 -26.062   0.331 -24.166
   14    HZ2  LYS   3           HZ2      LYS   3 -26.685  -0.829 -23.093
   15    HZ1  LYS   3           HZ3      LYS   3 -25.708   0.430 -22.508

  No H/Q in entry =          15
  In of MODEL   66
    1    H    LYS   4           H        LYS   4 -30.671   3.053 -17.518
    2    HA   LYS   4           HA       LYS   4 -29.965   5.366 -15.894
    3    HB2  LYS   4           HB2      LYS   4 -31.146   2.672 -15.164
    4    HB3  LYS   4           HB3      LYS   4 -30.939   4.026 -14.055
    5    HG2  LYS   4           HG2      LYS   4 -32.739   3.921 -16.481
    6    HG3  LYS   4           HG3      LYS   4 -33.235   3.988 -14.791
    7    HD2  LYS   4           HD2      LYS   4 -32.557   6.219 -14.550
    8    HD3  LYS   4           HD3      LYS   4 -31.513   6.151 -15.969
    9    HE2  LYS   4           HE2      LYS   4 -33.447   7.504 -16.454
   10    HE3  LYS   4           HE3      LYS   4 -33.514   6.019 -17.404
   11    HZ3  LYS   4           HZ1      LYS   4 -35.087   5.114 -15.850
   12    HZ2  LYS   4           HZ2      LYS   4 -35.651   6.599 -16.455
   13    HZ1  LYS   4           HZ3      LYS   4 -34.998   6.512 -14.889

  No H/Q in entry =          13
  In of MODEL   66
    1    H    HIS   5           H        HIS   5 -28.501   5.482 -14.300
    2    HA   HIS   5           HA       HIS   5 -26.205   3.664 -14.602
    3    HB2  HIS   5           HB2      HIS   5 -26.482   6.432 -13.431
    4    HB3  HIS   5           HB3      HIS   5 -24.994   5.488 -13.398
    5    HD1  HIS   5           HD1      HIS   5 -23.527   6.677 -14.997
    6    HD2  HIS   5           HD2      HIS   5 -27.319   6.012 -16.554
    7    HE1  HIS   5           HE1      HIS   5 -23.355   7.227 -17.454
    8    HE2  HIS   5           HE2      HIS   5 -25.668   6.810 -18.373

  No H/Q in entry =           8
  In of MODEL   66
    1    H    ILE   6           H        ILE   6 -25.970   2.109 -13.265
    2    HA   ILE   6           HA       ILE   6 -26.955   2.406 -10.507
    3    HB   ILE   6           HB       ILE   6 -26.112  -0.075 -12.011
    4   HG12  ILE   6          HG12      ILE   6 -28.863   0.856 -11.179
    5   HG13  ILE   6          HG13      ILE   6 -28.217   1.001 -12.813
    6   HG23  ILE   6          HG21      ILE   6 -26.483  -1.306 -10.136
    7   HG22  ILE   6          HG22      ILE   6 -27.649  -0.158  -9.475
    8   HG21  ILE   6          HG23      ILE   6 -25.922   0.189  -9.384
    9   HD13  ILE   6          HD11      ILE   6 -28.662  -1.127 -13.289
   10   HD12  ILE   6          HD12      ILE   6 -29.682  -1.098 -11.849
   11   HD11  ILE   6          HD13      ILE   6 -28.025  -1.694 -11.745

  No H/Q in entry =          11
  In of MODEL   66
    1    H    TYR   7           H        TYR   7 -25.204   3.073  -9.223
    2    HA   TYR   7           HA       TYR   7 -22.485   2.122  -9.882
    3    HB2  TYR   7           HB2      TYR   7 -23.467   4.570  -8.435
    4    HB3  TYR   7           HB3      TYR   7 -21.779   4.063  -8.462
    5    HD1  TYR   7           HD1      TYR   7 -22.805   3.077 -11.544
    6    HD2  TYR   7           HD2      TYR   7 -22.160   6.681  -9.360
    7    HE1  TYR   7           HE1      TYR   7 -22.374   4.282 -13.649
    8    HE2  TYR   7           HE2      TYR   7 -21.771   7.891 -11.458
    9    HH   TYR   7           HH       TYR   7 -21.982   7.775 -13.689

  No H/Q in entry =           9
  In of MODEL   66
    1    H    LEU   8           H        LEU   8 -21.516   0.793  -8.534
    2    HA   LEU   8           HA       LEU   8 -22.652   0.326  -5.848
    3    HB2  LEU   8           HB2      LEU   8 -20.935  -1.351  -7.656
    4    HB3  LEU   8           HB3      LEU   8 -21.124  -1.712  -5.940
    5    HG   LEU   8           HG       LEU   8 -23.602  -1.903  -6.368
    6   HD13  LEU   8          HD11      LEU   8 -23.732  -0.715  -8.492
    7   HD12  LEU   8          HD12      LEU   8 -24.253  -2.384  -8.713
    8   HD11  LEU   8          HD13      LEU   8 -22.646  -1.884  -9.240
    9   HD23  LEU   8          HD21      LEU   8 -22.312  -3.959  -8.032
   10   HD22  LEU   8          HD22      LEU   8 -23.402  -4.115  -6.654
   11   HD21  LEU   8          HD23      LEU   8 -21.698  -3.750  -6.392

  No H/Q in entry =          11
  In of MODEL   66
    1    H    PHE   9           H        PHE   9 -21.382   0.742  -4.060
    2    HA   PHE   9           HA       PHE   9 -18.599   1.681  -4.578
    3    HB2  PHE   9           HB2      PHE   9 -20.581   2.769  -2.579
    4    HB3  PHE   9           HB3      PHE   9 -18.890   3.238  -2.678
    5    HD1  PHE   9           HD1      PHE   9 -18.059   4.597  -4.500
    6    HD2  PHE   9           HD2      PHE   9 -22.178   3.407  -4.353
    7    HE1  PHE   9           HE1      PHE   9 -18.594   6.223  -6.290
    8    HE2  PHE   9           HE2      PHE   9 -22.715   5.044  -6.138
    9    HZ   PHE   9           HZ       PHE   9 -20.920   6.448  -7.112

  No H/Q in entry =           9
  In of MODEL   66
    1    H    SER  10           H        SER  10 -17.012   0.765  -3.440
    2    HA   SER  10           HA       SER  10 -17.223  -0.096  -0.739
    3    HB2  SER  10           HB2      SER  10 -17.195  -2.433  -0.942
    4    HB3  SER  10           HB3      SER  10 -18.414  -1.937  -2.106
    5    HG   SER  10           HG       SER  10 -15.711  -2.631  -2.576

  No H/Q in entry =           5
  In of MODEL   66
    1    H    SER  11           H        SER  11 -15.204   0.033   0.100
    2    HA   SER  11           HA       SER  11 -13.023   0.882  -1.444
    3    HB2  SER  11           HB2      SER  11 -13.512   1.011   1.132
    4    HB3  SER  11           HB3      SER  11 -12.568  -0.479   1.168
    5    HG   SER  11           HG       SER  11 -10.916   0.659   0.055

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ALA  12           H        ALA  12 -14.199  -1.796  -2.242
    2    HA   ALA  12           HA       ALA  12 -11.623  -3.054  -2.755
    3    HB2  ALA  12           HB1      ALA  12 -12.517  -5.321  -2.108
    4    HB1  ALA  12           HB2      ALA  12 -13.854  -4.494  -1.311
    5    HB3  ALA  12           HB3      ALA  12 -12.202  -4.235  -0.753

  No H/Q in entry =           5
  In of MODEL   66
    1    H    GLY  13           H        GLY  13 -12.277  -2.123  -4.817
    2    HA3  GLY  13           HA2      GLY  13 -14.536  -2.736  -6.302
    3    HA2  GLY  13           HA3      GLY  13 -12.955  -2.377  -7.011

  No H/Q in entry =           3
  In of MODEL   66
    1    H    MET  14           H        MET  14 -11.546  -4.702  -6.064
    2    HA   MET  14           HA       MET  14 -12.101  -6.478  -8.140
    3    HB2  MET  14           HB2      MET  14  -9.960  -6.566  -6.959
    4    HB3  MET  14           HB3      MET  14 -10.750  -7.202  -5.517
    5    HG2  MET  14           HG2      MET  14 -11.449  -9.203  -6.797
    6    HG3  MET  14           HG3      MET  14 -10.658  -8.558  -8.236
    7    HE3  MET  14           HE1      MET  14  -7.053  -8.749  -7.787
    8    HE2  MET  14           HE2      MET  14  -7.786  -7.311  -7.081
    9    HE1  MET  14           HE3      MET  14  -8.474  -8.013  -8.542

  No H/Q in entry =           9
  In of MODEL   66
    1    H    SER  15           H        SER  15 -13.177  -6.817  -4.755
    2    HA   SER  15           HA       SER  15 -14.547  -9.287  -5.264
    3    HB2  SER  15           HB2      SER  15 -14.883  -7.324  -2.983
    4    HB3  SER  15           HB3      SER  15 -15.791  -8.827  -3.125
    5    HG   SER  15           HG       SER  15 -12.957  -8.744  -3.287

  No H/Q in entry =           5
  In of MODEL   66
    1    H    THR  16           H        THR  16 -15.651  -5.904  -5.086
    2    HA   THR  16           HA       THR  16 -18.432  -6.457  -5.637
    3    HB   THR  16           HB       THR  16 -16.901  -3.887  -6.172
    4    HG1  THR  16           HG1      THR  16 -18.292  -4.381  -3.795
    5   HG21  THR  16          HG21      THR  16 -19.318  -4.249  -6.982
    6   HG23  THR  16          HG22      THR  16 -19.009  -2.813  -5.988
    7   HG22  THR  16          HG23      THR  16 -19.755  -4.252  -5.278

  No H/Q in entry =           7
  In of MODEL   66
    1    H    SER  17           H        SER  17 -15.570  -5.913  -7.475
    2    HA   SER  17           HA       SER  17 -16.692  -5.212  -9.991
    3    HB2  SER  17           HB2      SER  17 -14.059  -6.515  -9.268
    4    HB3  SER  17           HB3      SER  17 -14.497  -6.085 -10.921
    5    HG   SER  17           HG       SER  17 -14.991  -3.954  -9.551

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LEU  18           H        LEU  18 -16.111  -8.333  -8.500
    2    HA   LEU  18           HA       LEU  18 -16.678  -9.868 -10.837
    3    HB2  LEU  18           HB2      LEU  18 -15.460 -10.800  -8.921
    4    HB3  LEU  18           HB3      LEU  18 -16.890 -10.595  -7.910
    5    HG   LEU  18           HG       LEU  18 -18.114 -12.205  -9.262
    6   HD11  LEU  18          HD11      LEU  18 -15.642 -12.037 -10.956
    7   HD13  LEU  18          HD12      LEU  18 -17.336 -12.000 -11.448
    8   HD12  LEU  18          HD13      LEU  18 -16.597 -13.518 -10.942
    9   HD21  LEU  18          HD21      LEU  18 -15.458 -13.000  -8.165
   10   HD23  LEU  18          HD22      LEU  18 -16.554 -14.195  -8.862
   11   HD22  LEU  18          HD23      LEU  18 -17.071 -13.225  -7.483

  No H/Q in entry =          11
  In of MODEL   66
    1    H    LEU  19           H        LEU  19 -18.665  -8.637  -8.150
    2    HA   LEU  19           HA       LEU  19 -21.117  -9.848  -8.977
    3    HB2  LEU  19           HB2      LEU  19 -20.844  -8.973  -6.733
    4    HB3  LEU  19           HB3      LEU  19 -20.602  -7.348  -7.371
    5    HG   LEU  19           HG       LEU  19 -22.925  -7.216  -8.031
    6   HD12  LEU  19          HD11      LEU  19 -24.374  -9.187  -7.028
    7   HD11  LEU  19          HD12      LEU  19 -22.895 -10.107  -7.299
    8   HD13  LEU  19          HD13      LEU  19 -23.688  -9.298  -8.649
    9   HD23  LEU  19          HD21      LEU  19 -23.941  -7.415  -5.740
   10   HD22  LEU  19          HD22      LEU  19 -22.457  -6.466  -5.838
   11   HD21  LEU  19          HD23      LEU  19 -22.411  -8.113  -5.209

  No H/Q in entry =          11
  In of MODEL   66
    1    H    VAL  20           H        VAL  20 -19.638  -6.686  -9.707
    2    HA   VAL  20           HA       VAL  20 -21.751  -5.679 -11.298
    3    HB   VAL  20           HB       VAL  20 -18.765  -5.071 -11.435
    4   HG11  VAL  20          HG11      VAL  20 -21.091  -3.743 -12.847
    5   HG13  VAL  20          HG12      VAL  20 -19.680  -4.497 -13.589
    6   HG12  VAL  20          HG13      VAL  20 -19.501  -3.001 -12.673
    7   HG22  VAL  20          HG21      VAL  20 -19.526  -4.284  -9.392
    8   HG21  VAL  20          HG22      VAL  20 -21.097  -3.822 -10.043
    9   HG23  VAL  20          HG23      VAL  20 -19.664  -2.874 -10.443

  No H/Q in entry =           9
  In of MODEL   66
    1    H    SER  21           H        SER  21 -18.975  -7.725 -12.287
    2    HA   SER  21           HA       SER  21 -19.749  -7.654 -15.042
    3    HB2  SER  21           HB2      SER  21 -18.299  -9.615 -15.346
    4    HB3  SER  21           HB3      SER  21 -17.482  -8.352 -14.425
    5    HG   SER  21           HG       SER  21 -18.727 -10.672 -13.400

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LYS  22           H        LYS  22 -20.812  -9.813 -12.446
    2    HA   LYS  22           HA       LYS  22 -22.333 -11.465 -14.254
    3    HB2  LYS  22           HB2      LYS  22 -21.572 -12.141 -11.932
    4    HB3  LYS  22           HB3      LYS  22 -22.849 -11.097 -11.308
    5    HG2  LYS  22           HG2      LYS  22 -23.720 -13.284 -11.267
    6    HG3  LYS  22           HG3      LYS  22 -24.475 -12.488 -12.647
    7    HD2  LYS  22           HD2      LYS  22 -23.070 -13.639 -14.189
    8    HD3  LYS  22           HD3      LYS  22 -22.038 -14.244 -12.892
    9    HE2  LYS  22           HE2      LYS  22 -23.434 -16.053 -13.619
   10    HE3  LYS  22           HE3      LYS  22 -24.000 -15.543 -12.029
   11    HZ2  LYS  22           HZ1      LYS  22 -25.609 -15.963 -14.074
   12    HZ1  LYS  22           HZ2      LYS  22 -25.293 -14.313 -14.325
   13    HZ3  LYS  22           HZ3      LYS  22 -25.952 -14.836 -12.849

  No H/Q in entry =          13
  In of MODEL   66
    1    H    MET  23           H        MET  23 -23.081  -8.523 -12.425
    2    HA   MET  23           HA       MET  23 -25.886  -8.623 -12.942
    3    HB2  MET  23           HB2      MET  23 -24.053  -6.299 -12.392
    4    HB3  MET  23           HB3      MET  23 -25.798  -6.140 -12.579
    5    HG2  MET  23           HG2      MET  23 -26.190  -7.421 -10.595
    6    HG3  MET  23           HG3      MET  23 -24.479  -7.822 -10.457
    7    HE2  MET  23           HE1      MET  23 -26.800  -4.167  -9.324
    8    HE1  MET  23           HE2      MET  23 -27.044  -5.155 -10.763
    9    HE3  MET  23           HE3      MET  23 -26.016  -3.724 -10.841

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ARG  24           H        ARG  24 -23.132  -7.204 -14.733
    2    HA   ARG  24           HA       ARG  24 -24.626  -5.937 -16.755
    3    HB2  ARG  24           HB2      ARG  24 -22.222  -5.465 -16.421
    4    HB3  ARG  24           HB3      ARG  24 -21.826  -7.100 -16.891
    5    HG2  ARG  24           HG2      ARG  24 -21.353  -5.888 -18.865
    6    HG3  ARG  24           HG3      ARG  24 -23.010  -6.475 -19.164
    7    HD2  ARG  24           HD2      ARG  24 -23.885  -4.338 -18.148
    8    HD3  ARG  24           HD3      ARG  24 -22.222  -3.777 -18.042
    9    HE   ARG  24           HE       ARG  24 -22.305  -4.211 -20.611
   10   HH21  ARG  24          HH11      ARG  24 -22.120  -2.199 -21.596
   11   HH22  ARG  24          HH12      ARG  24 -23.324  -0.991 -21.308
   12   HH11  ARG  24          HH21      ARG  24 -24.788  -2.908 -18.718
   13   HH12  ARG  24          HH22      ARG  24 -24.904  -1.423 -19.611

  No H/Q in entry =          13
  In of MODEL   66
    1    H    ALA  25           H        ALA  25 -23.492  -9.266 -16.433
    2    HA   ALA  25           HA       ALA  25 -24.106 -10.133 -19.062
    3    HB1  ALA  25           HB1      ALA  25 -23.405 -12.153 -18.339
    4    HB3  ALA  25           HB2      ALA  25 -24.469 -12.118 -16.932
    5    HB2  ALA  25           HB3      ALA  25 -22.916 -11.285 -16.883

  No H/Q in entry =           5
  In of MODEL   66
    1    H    GLN  26           H        GLN  26 -25.946 -10.141 -16.045
    2    HA   GLN  26           HA       GLN  26 -28.281 -11.364 -17.058
    3    HB2  GLN  26           HB2      GLN  26 -27.784  -9.587 -14.690
    4    HB3  GLN  26           HB3      GLN  26 -29.343 -10.320 -15.038
    5    HG2  GLN  26           HG2      GLN  26 -26.754 -11.761 -14.541
    6    HG3  GLN  26           HG3      GLN  26 -28.120 -11.650 -13.439
    7   HE21  GLN  26          HE21      GLN  26 -26.890 -13.825 -14.683
    8   HE22  GLN  26          HE22      GLN  26 -27.925 -14.885 -15.471

  No H/Q in entry =           8
  In of MODEL   66
    1    H    ALA  27           H        ALA  27 -27.359  -7.959 -16.703
    2    HA   ALA  27           HA       ALA  27 -29.849  -6.884 -17.511
    3    HB1  ALA  27           HB1      ALA  27 -28.049  -5.550 -16.403
    4    HB3  ALA  27           HB2      ALA  27 -28.635  -4.803 -17.890
    5    HB2  ALA  27           HB3      ALA  27 -27.097  -5.665 -17.885

  No H/Q in entry =           5
  In of MODEL   66
    1    H    GLU  28           H        GLU  28 -27.136  -8.120 -19.354
    2    HA   GLU  28           HA       GLU  28 -28.063  -7.112 -21.889
    3    HB2  GLU  28           HB2      GLU  28 -25.685  -7.780 -21.246
    4    HB3  GLU  28           HB3      GLU  28 -26.224  -9.448 -21.432
    5    HG2  GLU  28           HG2      GLU  28 -25.071  -8.691 -23.403
    6    HG3  GLU  28           HG3      GLU  28 -26.766  -9.023 -23.756

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LYS  29           H        LYS  29 -28.227 -10.199 -20.197
    2    HA   LYS  29           HA       LYS  29 -29.516 -11.696 -22.191
    3    HB2  LYS  29           HB2      LYS  29 -28.472 -12.654 -20.171
    4    HB3  LYS  29           HB3      LYS  29 -29.750 -11.940 -19.190
    5    HG2  LYS  29           HG2      LYS  29 -31.403 -13.329 -20.250
    6    HG3  LYS  29           HG3      LYS  29 -30.196 -13.973 -21.362
    7    HD2  LYS  29           HD2      LYS  29 -29.058 -15.116 -19.610
    8    HD3  LYS  29           HD3      LYS  29 -29.973 -14.265 -18.368
    9    HE2  LYS  29           HE2      LYS  29 -30.716 -16.619 -18.708
   10    HE3  LYS  29           HE3      LYS  29 -31.997 -15.434 -18.970
   11    HZ1  LYS  29           HZ1      LYS  29 -31.421 -15.594 -21.393
   12    HZ3  LYS  29           HZ2      LYS  29 -32.139 -16.975 -20.716
   13    HZ2  LYS  29           HZ3      LYS  29 -30.468 -16.944 -21.007

  No H/Q in entry =          13
  In of MODEL   66
    1    H    TYR  30           H        TYR  30 -30.926  -9.568 -19.717
    2    HA   TYR  30           HA       TYR  30 -33.582 -10.039 -20.964
    3    HB2  TYR  30           HB2      TYR  30 -32.944  -8.854 -18.254
    4    HB3  TYR  30           HB3      TYR  30 -34.558  -9.123 -18.911
    5    HD1  TYR  30           HD1      TYR  30 -35.460 -11.421 -19.104
    6    HD2  TYR  30           HD2      TYR  30 -31.635 -10.668 -17.391
    7    HE1  TYR  30           HE1      TYR  30 -35.366 -13.739 -18.281
    8    HE2  TYR  30           HE2      TYR  30 -31.542 -12.971 -16.572
    9    HH   TYR  30           HH       TYR  30 -33.169 -15.350 -17.646

  No H/Q in entry =           9
  In of MODEL   66
    1    H    GLU  31           H        GLU  31 -31.419  -8.050 -21.777
    2    HA   GLU  31           HA       GLU  31 -31.349  -5.902 -22.624
    3    HB2  GLU  31           HB2      GLU  31 -34.240  -6.633 -23.141
    4    HB3  GLU  31           HB3      GLU  31 -33.401  -5.270 -23.881
    5    HG2  GLU  31           HG2      GLU  31 -31.918  -6.715 -25.051
    6    HG3  GLU  31           HG3      GLU  31 -32.481  -8.121 -24.150

  No H/Q in entry =           6
  In of MODEL   66
    1    H    VAL  32           H        VAL  32 -31.560  -5.770 -19.893
    2    HA   VAL  32           HA       VAL  32 -33.434  -3.657 -19.266
    3    HB   VAL  32           HB       VAL  32 -31.044  -4.625 -17.664
    4   HG12  VAL  32          HG11      VAL  32 -32.593  -3.786 -15.784
    5   HG11  VAL  32          HG12      VAL  32 -33.423  -2.900 -17.062
    6   HG13  VAL  32          HG13      VAL  32 -31.720  -2.585 -16.737
    7   HG21  VAL  32          HG21      VAL  32 -32.803  -6.360 -18.341
    8   HG23  VAL  32          HG22      VAL  32 -33.852  -5.524 -17.194
    9   HG22  VAL  32          HG23      VAL  32 -32.334  -6.235 -16.645

  No H/Q in entry =           9
  In of MODEL   66
    1    HA   PRO  33           HA       PRO  33 -30.408  -0.734 -20.958
    2    HB2  PRO  33           HB2      PRO  33 -31.930   1.483 -20.865
    3    HB3  PRO  33           HB3      PRO  33 -32.388   0.166 -21.946
    4    HG2  PRO  33           HG2      PRO  33 -33.371   0.709 -19.144
    5    HG3  PRO  33           HG3      PRO  33 -34.328   0.480 -20.607
    6    HD2  PRO  33           HD2      PRO  33 -33.870  -1.572 -18.917
    7    HD3  PRO  33           HD3      PRO  33 -33.923  -1.833 -20.661

  No H/Q in entry =           7
  In of MODEL   66
    1    H    VAL  34           H        VAL  34 -29.150  -1.251 -18.998
    2    HA   VAL  34           HA       VAL  34 -28.885   1.193 -17.375
    3    HB   VAL  34           HB       VAL  34 -28.305  -0.246 -15.419
    4   HG12  VAL  34          HG11      VAL  34 -30.714  -1.127 -15.113
    5   HG11  VAL  34          HG12      VAL  34 -31.028  -0.386 -16.680
    6   HG13  VAL  34          HG13      VAL  34 -30.486   0.608 -15.327
    7   HG21  VAL  34          HG21      VAL  34 -28.472  -2.294 -17.407
    8   HG23  VAL  34          HG22      VAL  34 -29.533  -2.646 -16.041
    9   HG22  VAL  34          HG23      VAL  34 -27.817  -2.347 -15.769

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ILE  35           H        ILE  35 -26.916   1.647 -16.532
    2    HA   ILE  35           HA       ILE  35 -24.598   0.317 -17.770
    3    HB   ILE  35           HB       ILE  35 -25.017   3.213 -16.992
    4   HG12  ILE  35          HG12      ILE  35 -24.017   1.884 -19.518
    5   HG13  ILE  35          HG13      ILE  35 -25.652   2.499 -19.272
    6   HG21  ILE  35          HG21      ILE  35 -22.445   1.691 -17.274
    7   HG23  ILE  35          HG22      ILE  35 -22.911   2.881 -16.060
    8   HG22  ILE  35          HG23      ILE  35 -22.525   3.400 -17.700
    9   HD11  ILE  35          HD11      ILE  35 -24.264   4.708 -18.689
   10   HD13  ILE  35          HD12      ILE  35 -24.793   4.304 -20.322
   11   HD12  ILE  35          HD13      ILE  35 -23.141   3.949 -19.817

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ILE  36           H        ILE  36 -23.368  -0.683 -16.155
    2    HA   ILE  36           HA       ILE  36 -23.825  -0.040 -13.293
    3    HB   ILE  36           HB       ILE  36 -22.978  -2.749 -14.369
    4   HG12  ILE  36          HG12      ILE  36 -25.792  -1.952 -13.625
    5   HG13  ILE  36          HG13      ILE  36 -25.214  -1.946 -15.292
    6   HG23  ILE  36          HG21      ILE  36 -23.333  -3.558 -12.248
    7   HG22  ILE  36          HG22      ILE  36 -24.469  -2.276 -11.828
    8   HG21  ILE  36          HG23      ILE  36 -22.739  -1.936 -11.894
    9   HD13  ILE  36          HD11      ILE  36 -25.366  -4.163 -15.475
   10   HD12  ILE  36          HD12      ILE  36 -26.438  -4.032 -14.081
   11   HD11  ILE  36          HD13      ILE  36 -24.738  -4.440 -13.850

  No H/Q in entry =          11
  In of MODEL   66
    1    H    GLU  37           H        GLU  37 -22.052   0.611 -12.188
    2    HA   GLU  37           HA       GLU  37 -19.353  -0.180 -13.084
    3    HB2  GLU  37           HB2      GLU  37 -20.286   2.611 -12.439
    4    HB3  GLU  37           HB3      GLU  37 -18.589   2.138 -12.515
    5    HG2  GLU  37           HG2      GLU  37 -18.743   1.714 -14.853
    6    HG3  GLU  37           HG3      GLU  37 -20.490   1.952 -14.829

  No H/Q in entry =           6
  In of MODEL   66
    1    H    ALA  38           H        ALA  38 -17.872  -0.390 -11.393
    2    HA   ALA  38           HA       ALA  38 -18.916  -0.188  -8.630
    3    HB1  ALA  38           HB1      ALA  38 -17.184  -2.132 -10.028
    4    HB3  ALA  38           HB2      ALA  38 -18.237  -2.360  -8.631
    5    HB2  ALA  38           HB3      ALA  38 -16.630  -1.664  -8.419

  No H/Q in entry =           5
  In of MODEL   66
    1    H    PHE  39           H        PHE  39 -17.689   1.044  -7.163
    2    HA   PHE  39           HA       PHE  39 -15.169   2.254  -8.062
    3    HB2  PHE  39           HB2      PHE  39 -17.365   3.856  -6.756
    4    HB3  PHE  39           HB3      PHE  39 -15.820   4.450  -7.363
    5    HD1  PHE  39           HD1      PHE  39 -15.472   4.878  -9.683
    6    HD2  PHE  39           HD2      PHE  39 -19.159   3.259  -8.281
    7    HE1  PHE  39           HE1      PHE  39 -16.517   5.396 -11.869
    8    HE2  PHE  39           HE2      PHE  39 -20.214   3.763 -10.456
    9    HZ   PHE  39           HZ       PHE  39 -18.891   4.804 -12.267

  No H/Q in entry =           9
  In of MODEL   66
    1    HA   PRO  40           HA       PRO  40 -14.243   1.553  -3.765
    2    HB2  PRO  40           HB2      PRO  40 -12.490   3.580  -3.169
    3    HB3  PRO  40           HB3      PRO  40 -12.035   2.249  -4.232
    4    HG2  PRO  40           HG2      PRO  40 -13.091   4.970  -4.992
    5    HG3  PRO  40           HG3      PRO  40 -11.644   4.152  -5.582
    6    HD2  PRO  40           HD2      PRO  40 -13.858   4.007  -7.015
    7    HD3  PRO  40           HD3      PRO  40 -12.889   2.550  -6.798

  No H/Q in entry =           7
  In of MODEL   66
    1    H    GLU  41           H        GLU  41 -14.880   2.548  -1.647
    2    HA   GLU  41           HA       GLU  41 -17.138   4.233  -1.658
    3    HB2  GLU  41           HB2      GLU  41 -17.000   4.188   0.722
    4    HB3  GLU  41           HB3      GLU  41 -16.505   2.599   0.140
    5    HG2  GLU  41           HG2      GLU  41 -14.172   3.154   0.524
    6    HG3  GLU  41           HG3      GLU  41 -14.624   4.780   1.034

  No H/Q in entry =           6
  In of MODEL   66
    1    H    THR  42           H        THR  42 -13.814   5.177  -1.707
    2    HA   THR  42           HA       THR  42 -14.194   7.748  -0.523
    3    HB   THR  42           HB       THR  42 -12.036   8.328  -1.599
    4    HG1  THR  42           HG1      THR  42 -11.919   7.325  -3.484
    5   HG22  THR  42          HG21      THR  42 -10.682   6.511  -0.556
    6   HG21  THR  42          HG22      THR  42 -12.164   5.576  -0.343
    7   HG23  THR  42          HG23      THR  42 -11.959   7.107   0.504

  No H/Q in entry =           7
  In of MODEL   66
    1    H    LEU  43           H        LEU  43 -15.076   6.613  -3.616
    2    HA   LEU  43           HA       LEU  43 -15.349   9.372  -4.616
    3    HB2  LEU  43           HB2      LEU  43 -15.706   6.715  -5.991
    4    HB3  LEU  43           HB3      LEU  43 -15.886   8.291  -6.759
    5    HG   LEU  43           HG       LEU  43 -13.311   7.123  -5.729
    6   HD13  LEU  43          HD11      LEU  43 -12.724   6.750  -7.981
    7   HD12  LEU  43          HD12      LEU  43 -14.088   7.694  -8.576
    8   HD11  LEU  43          HD13      LEU  43 -14.364   6.123  -7.827
    9   HD23  LEU  43          HD21      LEU  43 -12.410   9.101  -7.100
   10   HD22  LEU  43          HD22      LEU  43 -13.120   9.456  -5.525
   11   HD21  LEU  43          HD23      LEU  43 -14.046   9.752  -6.996

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ALA  44           H        ALA  44 -17.287   7.550  -2.751
    2    HA   ALA  44           HA       ALA  44 -19.758   7.375  -4.081
    3    HB2  ALA  44           HB1      ALA  44 -19.618   6.282  -1.973
    4    HB3  ALA  44           HB2      ALA  44 -20.738   7.620  -1.720
    5    HB1  ALA  44           HB3      ALA  44 -19.070   7.748  -1.162

  No H/Q in entry =           5
  In of MODEL   66
    1    H    GLY  45           H        GLY  45 -18.368  10.204  -2.575
    2    HA3  GLY  45           HA2      GLY  45 -20.816  11.678  -2.961
    3    HA2  GLY  45           HA3      GLY  45 -19.280  12.322  -2.385

  No H/Q in entry =           3
  In of MODEL   66
    1    H    GLU  46           H        GLU  46 -17.731  11.374  -4.659
    2    HA   GLU  46           HA       GLU  46 -18.380  13.565  -6.455
    3    HB2  GLU  46           HB2      GLU  46 -16.050  13.055  -5.793
    4    HB3  GLU  46           HB3      GLU  46 -16.188  11.487  -6.588
    5    HG2  GLU  46           HG2      GLU  46 -16.484  12.592  -8.737
    6    HG3  GLU  46           HG3      GLU  46 -16.377  14.167  -7.950

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LYS  47           H        LYS  47 -18.229  10.042  -6.851
    2    HA   LYS  47           HA       LYS  47 -19.318  10.223  -9.533
    3    HB2  LYS  47           HB2      LYS  47 -17.679   8.431  -8.462
    4    HB3  LYS  47           HB3      LYS  47 -19.201   7.659  -8.016
    5    HG2  LYS  47           HG2      LYS  47 -18.710   6.654 -10.021
    6    HG3  LYS  47           HG3      LYS  47 -19.785   7.960 -10.518
    7    HD2  LYS  47           HD2      LYS  47 -17.694   9.352 -10.873
    8    HD3  LYS  47           HD3      LYS  47 -16.787   7.850 -10.702
    9    HE2  LYS  47           HE2      LYS  47 -18.093   6.886 -12.556
   10    HE3  LYS  47           HE3      LYS  47 -18.918   8.432 -12.751
   11    HZ1  LYS  47           HZ1      LYS  47 -16.536   9.346 -12.931
   12    HZ3  LYS  47           HZ2      LYS  47 -17.233   8.571 -14.272
   13    HZ2  LYS  47           HZ3      LYS  47 -16.116   7.741 -13.297

  No H/Q in entry =          13
  In of MODEL   66
    1    H    GLY  48           H        GLY  48 -20.647   9.490  -6.382
    2    HA3  GLY  48           HA2      GLY  48 -23.019   8.276  -7.119
    3    HA2  GLY  48           HA3      GLY  48 -22.807   9.287  -5.690

  No H/Q in entry =           3
  In of MODEL   66
    1    H    GLN  49           H        GLN  49 -22.239  11.697  -7.286
    2    HA   GLN  49           HA       GLN  49 -24.807  12.786  -7.452
    3    HB2  GLN  49           HB2      GLN  49 -22.266  13.656  -8.812
    4    HB3  GLN  49           HB3      GLN  49 -23.736  14.610  -8.744
    5    HG2  GLN  49           HG2      GLN  49 -23.587  14.662  -6.307
    6    HG3  GLN  49           HG3      GLN  49 -22.129  13.687  -6.373
    7   HE21  GLN  49          HE21      GLN  49 -22.036  15.931  -5.125
    8   HE22  GLN  49          HE22      GLN  49 -21.121  17.187  -5.782

  No H/Q in entry =           8
  In of MODEL   66
    1    H    ASN  50           H        ASN  50 -23.103  10.894  -9.812
    2    HA   ASN  50           HA       ASN  50 -24.985  11.727 -11.911
    3    HB2  ASN  50           HB2      ASN  50 -22.391  10.206 -12.117
    4    HB3  ASN  50           HB3      ASN  50 -23.440  10.608 -13.469
    5   HD21  ASN  50          HD21      ASN  50 -20.817  11.494 -11.858
    6   HD22  ASN  50          HD22      ASN  50 -20.595  13.128 -12.217

  No H/Q in entry =           6
  In of MODEL   66
    1    H    ALA  51           H        ALA  51 -24.960   9.395  -9.638
    2    HA   ALA  51           HA       ALA  51 -25.720   7.225 -11.444
    3    HB2  ALA  51           HB1      ALA  51 -25.132   5.899  -9.741
    4    HB3  ALA  51           HB2      ALA  51 -26.265   6.710  -8.662
    5    HB1  ALA  51           HB3      ALA  51 -24.631   7.342  -8.859

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ASP  52           H        ASP  52 -27.717   6.154 -11.301
    2    HA   ASP  52           HA       ASP  52 -29.915   7.978 -10.665
    3    HB2  ASP  52           HB2      ASP  52 -29.698   5.457 -12.306
    4    HB3  ASP  52           HB3      ASP  52 -31.250   6.182 -11.885

  No H/Q in entry =           4
  In of MODEL   66
    1    H    VAL  53           H        VAL  53 -28.297   5.113  -9.610
    2    HA   VAL  53           HA       VAL  53 -29.747   5.257  -7.101
    3    HB   VAL  53           HB       VAL  53 -31.129   3.591  -8.332
    4   HG11  VAL  53          HG11      VAL  53 -29.370   2.728  -9.838
    5   HG13  VAL  53          HG12      VAL  53 -30.197   1.436  -8.968
    6   HG12  VAL  53          HG13      VAL  53 -28.593   1.956  -8.457
    7   HG23  VAL  53          HG21      VAL  53 -30.300   1.639  -6.615
    8   HG22  VAL  53          HG22      VAL  53 -31.440   2.940  -6.267
    9   HG21  VAL  53          HG23      VAL  53 -29.735   3.129  -5.856

  No H/Q in entry =           9
  In of MODEL   66
    1    H    VAL  54           H        VAL  54 -28.438   4.852  -5.436
    2    HA   VAL  54           HA       VAL  54 -25.670   4.016  -6.027
    3    HB   VAL  54           HB       VAL  54 -26.761   5.811  -3.802
    4   HG11  VAL  54          HG11      VAL  54 -24.172   4.406  -4.067
    5   HG13  VAL  54          HG12      VAL  54 -24.935   5.096  -2.635
    6   HG12  VAL  54          HG13      VAL  54 -24.032   6.134  -3.739
    7   HG22  VAL  54          HG21      VAL  54 -25.910   7.618  -4.917
    8   HG21  VAL  54          HG22      VAL  54 -26.446   6.609  -6.261
    9   HG23  VAL  54          HG23      VAL  54 -24.741   6.652  -5.816

  No H/Q in entry =           9
  In of MODEL   66
    1    H    LEU  55           H        LEU  55 -25.067   2.106  -5.361
    2    HA   LEU  55           HA       LEU  55 -26.575   0.808  -3.177
    3    HB2  LEU  55           HB2      LEU  55 -25.002  -0.375  -5.453
    4    HB3  LEU  55           HB3      LEU  55 -25.761  -1.299  -4.157
    5    HG   LEU  55           HG       LEU  55 -27.200   0.255  -6.298
    6   HD13  LEU  55          HD11      LEU  55 -26.883  -1.609  -7.496
    7   HD12  LEU  55          HD12      LEU  55 -27.839  -2.477  -6.295
    8   HD11  LEU  55          HD13      LEU  55 -26.085  -2.399  -6.137
    9   HD23  LEU  55          HD21      LEU  55 -28.489  -1.679  -4.426
   10   HD22  LEU  55          HD22      LEU  55 -29.190  -0.312  -5.291
   11   HD21  LEU  55          HD23      LEU  55 -28.177  -0.033  -3.875

  No H/Q in entry =          11
  In of MODEL   66
    1    H    LEU  56           H        LEU  56 -25.426   0.242  -1.361
    2    HA   LEU  56           HA       LEU  56 -22.495   0.656  -1.404
    3    HB2  LEU  56           HB2      LEU  56 -24.305   0.459   0.990
    4    HB3  LEU  56           HB3      LEU  56 -22.599   0.900   0.982
    5    HG   LEU  56           HG       LEU  56 -24.905   2.553  -0.011
    6   HD11  LEU  56          HD11      LEU  56 -23.797   2.206   2.518
    7   HD13  LEU  56          HD12      LEU  56 -24.794   3.564   1.994
    8   HD12  LEU  56          HD13      LEU  56 -23.038   3.678   1.912
    9   HD23  LEU  56          HD21      LEU  56 -22.970   4.262  -0.215
   10   HD22  LEU  56          HD22      LEU  56 -23.341   3.148  -1.532
   11   HD21  LEU  56          HD23      LEU  56 -21.990   2.815  -0.450

  No H/Q in entry =          11
  In of MODEL   66
    1    H    GLY  57           H        GLY  57 -21.107  -0.960  -0.845
    2    HA3  GLY  57           HA2      GLY  57 -22.012  -3.654  -1.017
    3    HA2  GLY  57           HA3      GLY  57 -20.394  -3.144  -0.538

  No H/Q in entry =           3
  In of MODEL   66
    1    HA   PRO  58           HA       PRO  58 -23.211  -4.159   3.174
    2    HB2  PRO  58           HB2      PRO  58 -22.513  -6.752   3.812
    3    HB3  PRO  58           HB3      PRO  58 -23.896  -6.364   2.789
    4    HG2  PRO  58           HG2      PRO  58 -21.159  -7.237   2.023
    5    HG3  PRO  58           HG3      PRO  58 -22.718  -7.713   1.351
    6    HD2  PRO  58           HD2      PRO  58 -21.116  -5.900   0.115
    7    HD3  PRO  58           HD3      PRO  58 -22.875  -5.826   0.005

  No H/Q in entry =           7
  In of MODEL   66
    1    H    GLN  59           H        GLN  59 -19.835  -4.617   2.585
    2    HA   GLN  59           HA       GLN  59 -19.091  -4.600   5.349
    3    HB2  GLN  59           HB2      GLN  59 -17.336  -3.510   3.172
    4    HB3  GLN  59           HB3      GLN  59 -16.877  -4.331   4.650
    5    HG2  GLN  59           HG2      GLN  59 -16.490  -5.997   3.155
    6    HG3  GLN  59           HG3      GLN  59 -18.173  -6.338   3.522
    7   HE21  GLN  59          HE21      GLN  59 -18.574  -7.113   1.710
    8   HE22  GLN  59          HE22      GLN  59 -18.799  -6.613   0.139

  No H/Q in entry =           8
  In of MODEL   66
    1    H    ILE  60           H        ILE  60 -20.031  -2.080   3.109
    2    HA   ILE  60           HA       ILE  60 -19.199  -0.095   5.135
    3    HB   ILE  60           HB       ILE  60 -19.443   1.612   3.285
    4   HG12  ILE  60          HG12      ILE  60 -19.207  -0.647   1.340
    5   HG13  ILE  60          HG13      ILE  60 -20.801  -0.101   1.861
    6   HG21  ILE  60          HG21      ILE  60 -17.311   0.370   4.061
    7   HG23  ILE  60          HG22      ILE  60 -17.275   1.385   2.619
    8   HG22  ILE  60          HG23      ILE  60 -17.390  -0.368   2.461
    9   HD11  ILE  60          HD11      ILE  60 -19.863   2.271   1.195
   10   HD13  ILE  60          HD12      ILE  60 -20.497   1.182  -0.038
   11   HD12  ILE  60          HD13      ILE  60 -18.755   1.322   0.205

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ALA  61           H        ALA  61 -21.645  -1.694   5.213
    2    HA   ALA  61           HA       ALA  61 -23.878  -0.047   4.726
    3    HB1  ALA  61           HB1      ALA  61 -25.090  -1.529   6.064
    4    HB2  ALA  61           HB2      ALA  61 -23.695  -1.898   7.077
    5    HB3  ALA  61           HB3      ALA  61 -23.780  -2.524   5.430

  No H/Q in entry =           5
  In of MODEL   66
    1    H    TYR  62           H        TYR  62 -21.682  -0.115   7.534
    2    HA   TYR  62           HA       TYR  62 -23.254   1.552   9.180
    3    HB2  TYR  62           HB2      TYR  62 -21.250   1.968  10.442
    4    HB3  TYR  62           HB3      TYR  62 -21.237   0.281   9.931
    5    HD1  TYR  62           HD1      TYR  62 -19.611  -0.510   8.253
    6    HD2  TYR  62           HD2      TYR  62 -19.574   3.544   9.598
    7    HE1  TYR  62           HE1      TYR  62 -17.395  -0.193   7.222
    8    HE2  TYR  62           HE2      TYR  62 -17.343   3.857   8.569
    9    HH   TYR  62           HH       TYR  62 -15.708   1.153   6.974

  No H/Q in entry =           9
  In of MODEL   66
    1    H    MET  63           H        MET  63 -21.604   2.388   6.321
    2    HA   MET  63           HA       MET  63 -21.455   5.229   6.983
    3    HB2  MET  63           HB2      MET  63 -20.832   3.683   4.466
    4    HB3  MET  63           HB3      MET  63 -20.646   5.430   4.631
    5    HG2  MET  63           HG2      MET  63 -18.935   5.113   6.309
    6    HG3  MET  63           HG3      MET  63 -19.148   3.365   6.221
    7    HE2  MET  63           HE1      MET  63 -17.075   6.259   3.675
    8    HE1  MET  63           HE2      MET  63 -18.620   6.487   4.494
    9    HE3  MET  63           HE3      MET  63 -18.585   5.984   2.802

  No H/Q in entry =           9
  In of MODEL   66
    1    H    LEU  64           H        LEU  64 -24.006   3.351   6.029
    2    HA   LEU  64           HA       LEU  64 -25.215   4.739   3.931
    3    HB2  LEU  64           HB2      LEU  64 -26.076   2.639   4.870
    4    HB3  LEU  64           HB3      LEU  64 -26.543   3.496   6.338
    5    HG   LEU  64           HG       LEU  64 -28.240   4.728   5.090
    6   HD13  LEU  64          HD11      LEU  64 -27.950   4.945   2.856
    7   HD12  LEU  64          HD12      LEU  64 -28.587   3.305   2.726
    8   HD11  LEU  64          HD13      LEU  64 -26.845   3.574   2.788
    9   HD23  LEU  64          HD21      LEU  64 -28.742   1.904   4.372
   10   HD22  LEU  64          HD22      LEU  64 -29.738   3.044   5.276
   11   HD21  LEU  64          HD23      LEU  64 -28.363   2.266   6.055

  No H/Q in entry =          11
  In of MODEL   66
    1    HA   PRO  65           HA       PRO  65 -27.420   7.913   6.639
    2    HB2  PRO  65           HB2      PRO  65 -25.428   8.106   8.897
    3    HB3  PRO  65           HB3      PRO  65 -27.168   8.380   8.934
    4    HG2  PRO  65           HG2      PRO  65 -26.233   6.141   9.890
    5    HG3  PRO  65           HG3      PRO  65 -27.648   6.089   8.840
    6    HD2  PRO  65           HD2      PRO  65 -24.771   5.479   8.154
    7    HD3  PRO  65           HD3      PRO  65 -26.223   4.582   7.712

  No H/Q in entry =           7
  In of MODEL   66
    1    H    GLU  66           H        GLU  66 -23.864   7.874   6.725
    2    HA   GLU  66           HA       GLU  66 -23.576  10.668   6.289
    3    HB2  GLU  66           HB2      GLU  66 -21.752   8.362   5.670
    4    HB3  GLU  66           HB3      GLU  66 -21.308  10.053   5.445
    5    HG2  GLU  66           HG2      GLU  66 -21.530  10.449   7.808
    6    HG3  GLU  66           HG3      GLU  66 -22.050   8.783   8.057

  No H/Q in entry =           6
  In of MODEL   66
    1    H    ILE  67           H        ILE  67 -23.660   7.897   4.068
    2    HA   ILE  67           HA       ILE  67 -23.242   9.581   1.757
    3    HB   ILE  67           HB       ILE  67 -24.131   6.674   1.966
    4   HG12  ILE  67          HG12      ILE  67 -21.502   7.841   1.040
    5   HG13  ILE  67          HG13      ILE  67 -21.801   7.440   2.729
    6   HG21  ILE  67          HG21      ILE  67 -24.072   8.526  -0.280
    7   HG23  ILE  67          HG22      ILE  67 -24.692   6.877  -0.212
    8   HG22  ILE  67          HG23      ILE  67 -22.984   7.163  -0.538
    9   HD12  ILE  67          HD11      ILE  67 -21.367   5.644   0.402
   10   HD11  ILE  67          HD12      ILE  67 -22.384   5.082   1.728
   11   HD13  ILE  67          HD13      ILE  67 -20.714   5.556   2.038

  No H/Q in entry =          11
  In of MODEL   66
    1    H    GLN  68           H        GLN  68 -26.115   8.537   3.392
    2    HA   GLN  68           HA       GLN  68 -27.940   9.440   1.402
    3    HB2  GLN  68           HB2      GLN  68 -28.204   9.116   4.388
    4    HB3  GLN  68           HB3      GLN  68 -29.522   9.696   3.383
    5    HG2  GLN  68           HG2      GLN  68 -29.541   7.651   2.130
    6    HG3  GLN  68           HG3      GLN  68 -28.092   7.088   2.944
    7   HE21  GLN  68          HE21      GLN  68 -30.267   5.724   2.817
    8   HE22  GLN  68          HE22      GLN  68 -31.101   5.282   4.234

  No H/Q in entry =           8
  In of MODEL   66
    1    H    ARG  69           H        ARG  69 -26.346  11.141   4.126
    2    HA   ARG  69           HA       ARG  69 -27.713  13.616   3.688
    3    HB2  ARG  69           HB2      ARG  69 -25.373  12.708   5.294
    4    HB3  ARG  69           HB3      ARG  69 -25.453  14.423   4.916
    5    HG2  ARG  69           HG2      ARG  69 -27.773  14.473   5.880
    6    HG3  ARG  69           HG3      ARG  69 -27.563  12.790   6.373
    7    HD2  ARG  69           HD2      ARG  69 -25.877  15.157   7.266
    8    HD3  ARG  69           HD3      ARG  69 -27.008  14.261   8.266
    9    HE   ARG  69           HE       ARG  69 -24.392  13.323   7.336
   10   HH21  ARG  69          HH11      ARG  69 -23.585  11.574   8.554
   11   HH22  ARG  69          HH12      ARG  69 -24.617  10.769   9.689
   12   HH11  ARG  69          HH21      ARG  69 -27.354  12.790   9.030
   13   HH12  ARG  69          HH22      ARG  69 -26.750  11.455   9.956

  No H/Q in entry =          13
  In of MODEL   66
    1    H    LEU  70           H        LEU  70 -24.837  12.198   2.352
    2    HA   LEU  70           HA       LEU  70 -23.722  14.551   1.161
    3    HB2  LEU  70           HB2      LEU  70 -22.728  12.241   1.785
    4    HB3  LEU  70           HB3      LEU  70 -23.336  11.757   0.203
    5    HG   LEU  70           HG       LEU  70 -21.741  13.119  -0.892
    6   HD11  LEU  70          HD11      LEU  70 -20.928  13.994   1.888
    7   HD13  LEU  70          HD12      LEU  70 -21.621  15.014   0.627
    8   HD12  LEU  70          HD13      LEU  70 -20.008  14.332   0.420
    9   HD22  LEU  70          HD21      LEU  70 -20.307  11.406  -0.636
   10   HD21  LEU  70          HD22      LEU  70 -21.238  10.899   0.773
   11   HD23  LEU  70          HD23      LEU  70 -19.854  11.974   0.970

  No H/Q in entry =          11
  In of MODEL   66
    1    H    LEU  71           H        LEU  71 -25.870  11.995   0.068
    2    HA   LEU  71           HA       LEU  71 -26.388  13.455  -2.466
    3    HB2  LEU  71           HB2      LEU  71 -26.595  10.476  -1.988
    4    HB3  LEU  71           HB3      LEU  71 -26.720  11.319  -3.531
    5    HG   LEU  71           HG       LEU  71 -24.204  11.350  -1.862
    6   HD12  LEU  71          HD11      LEU  71 -24.250   9.695  -4.276
    7   HD11  LEU  71          HD12      LEU  71 -25.265   9.086  -2.970
    8   HD13  LEU  71          HD13      LEU  71 -23.546   9.368  -2.693
    9   HD22  LEU  71          HD21      LEU  71 -24.302  13.149  -3.377
   10   HD21  LEU  71          HD22      LEU  71 -24.795  12.092  -4.698
   11   HD23  LEU  71          HD23      LEU  71 -23.176  11.952  -4.015

  No H/Q in entry =          11
  In of MODEL   66
    1    HA   PRO  72           HA       PRO  72 -30.263  13.038   0.148
    2    HB2  PRO  72           HB2      PRO  72 -31.116  15.599   0.036
    3    HB3  PRO  72           HB3      PRO  72 -29.811  15.157   1.136
    4    HG2  PRO  72           HG2      PRO  72 -29.616  16.321  -1.630
    5    HG3  PRO  72           HG3      PRO  72 -28.852  16.888  -0.145
    6    HD2  PRO  72           HD2      PRO  72 -27.513  15.309  -1.889
    7    HD3  PRO  72           HD3      PRO  72 -27.263  15.160  -0.151

  No H/Q in entry =           7
  In of MODEL   66
    1    H    ASN  73           H        ASN  73 -29.628  13.957  -3.075
    2    HA   ASN  73           HA       ASN  73 -32.486  13.646  -3.712
    3    HB2  ASN  73           HB2      ASN  73 -32.013  14.729  -5.820
    4    HB3  ASN  73           HB3      ASN  73 -31.492  15.722  -4.468
    5   HD21  ASN  73          HD21      ASN  73 -30.688  15.736  -7.144
    6   HD22  ASN  73          HD22      ASN  73 -29.021  15.569  -7.330

  No H/Q in entry =           6
  In of MODEL   66
    1    H    LYS  74           H        LYS  74 -30.513  11.391  -3.256
    2    HA   LYS  74           HA       LYS  74 -31.077   9.969  -5.791
    3    HB2  LYS  74           HB2      LYS  74 -28.549   9.689  -4.159
    4    HB3  LYS  74           HB3      LYS  74 -28.931   8.861  -5.669
    5    HG2  LYS  74           HG2      LYS  74 -28.658  11.831  -5.499
    6    HG3  LYS  74           HG3      LYS  74 -27.286  10.762  -5.787
    7    HD2  LYS  74           HD2      LYS  74 -28.400   9.816  -7.724
    8    HD3  LYS  74           HD3      LYS  74 -29.818  10.821  -7.419
    9    HE2  LYS  74           HE2      LYS  74 -28.585  12.818  -7.879
   10    HE3  LYS  74           HE3      LYS  74 -27.067  11.923  -7.956
   11    HZ2  LYS  74           HZ1      LYS  74 -28.529  12.506 -10.093
   12    HZ1  LYS  74           HZ2      LYS  74 -29.190  10.990  -9.706
   13    HZ3  LYS  74           HZ3      LYS  74 -27.523  11.141  -9.999

  No H/Q in entry =          13
  In of MODEL   66
    1    HA   PRO  75           HA       PRO  75 -32.489   7.022  -2.791
    2    HB2  PRO  75           HB2      PRO  75 -32.802   4.787  -4.349
    3    HB3  PRO  75           HB3      PRO  75 -33.923   6.145  -4.437
    4    HG2  PRO  75           HG2      PRO  75 -31.582   5.521  -6.194
    5    HG3  PRO  75           HG3      PRO  75 -33.227   5.958  -6.651
    6    HD2  PRO  75           HD2      PRO  75 -31.280   7.817  -6.623
    7    HD3  PRO  75           HD3      PRO  75 -32.912   8.228  -6.095

  No H/Q in entry =           7
  In of MODEL   66
    1    H    VAL  76           H        VAL  76 -31.045   5.977  -1.402
    2    HA   VAL  76           HA       VAL  76 -28.580   4.746  -2.487
    3    HB   VAL  76           HB       VAL  76 -28.871   6.244   0.152
    4   HG11  VAL  76          HG11      VAL  76 -26.515   4.932  -1.218
    5   HG13  VAL  76          HG12      VAL  76 -27.218   4.502   0.344
    6   HG12  VAL  76          HG13      VAL  76 -26.366   6.034   0.153
    7   HG22  VAL  76          HG21      VAL  76 -28.193   8.132  -0.754
    8   HG21  VAL  76          HG22      VAL  76 -28.734   7.421  -2.276
    9   HG23  VAL  76          HG23      VAL  76 -27.034   7.332  -1.814

  No H/Q in entry =           9
  In of MODEL   66
    1    H    GLU  77           H        GLU  77 -28.373   2.599  -1.850
    2    HA   GLU  77           HA       GLU  77 -29.171   1.845   0.810
    3    HB2  GLU  77           HB2      GLU  77 -30.783   0.197   0.293
    4    HB3  GLU  77           HB3      GLU  77 -31.324   1.713  -0.427
    5    HG2  GLU  77           HG2      GLU  77 -30.710   0.929  -2.605
    6    HG3  GLU  77           HG3      GLU  77 -30.076  -0.563  -1.912

  No H/Q in entry =           6
  In of MODEL   66
    1    H    VAL  78           H        VAL  78 -28.854  -0.236   1.495
    2    HA   VAL  78           HA       VAL  78 -26.187  -1.026   0.624
    3    HB   VAL  78           HB       VAL  78 -27.906  -1.878   2.994
    4   HG11  VAL  78          HG11      VAL  78 -25.567  -3.127   1.891
    5   HG13  VAL  78          HG12      VAL  78 -26.481  -3.579   3.332
    6   HG12  VAL  78          HG13      VAL  78 -25.158  -2.420   3.454
    7   HG22  VAL  78          HG21      VAL  78 -26.446  -0.505   4.322
    8   HG21  VAL  78          HG22      VAL  78 -27.176   0.453   3.033
    9   HG23  VAL  78          HG23      VAL  78 -25.500  -0.082   2.895

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ILE  79           H        ILE  79 -25.653  -2.947  -0.257
    2    HA   ILE  79           HA       ILE  79 -27.715  -4.434  -1.595
    3    HB   ILE  79           HB       ILE  79 -24.727  -4.968  -1.357
    4   HG12  ILE  79          HG12      ILE  79 -26.352  -3.884  -3.664
    5   HG13  ILE  79          HG13      ILE  79 -25.478  -2.864  -2.520
    6   HG22  ILE  79          HG21      ILE  79 -25.825  -6.170  -3.666
    7   HG21  ILE  79          HG22      ILE  79 -26.816  -6.673  -2.296
    8   HG23  ILE  79          HG23      ILE  79 -25.075  -6.957  -2.277
    9   HD13  ILE  79          HD11      ILE  79 -24.059  -3.004  -4.332
   10   HD12  ILE  79          HD12      ILE  79 -24.403  -4.714  -4.594
   11   HD11  ILE  79          HD13      ILE  79 -23.422  -4.212  -3.216

  No H/Q in entry =          11
  In of MODEL   66
    1    H    ASP  80           H        ASP  80 -28.588  -6.347  -0.992
    2    HA   ASP  80           HA       ASP  80 -28.546  -7.216   1.665
    3    HB2  ASP  80           HB2      ASP  80 -30.296  -7.806   0.027
    4    HB3  ASP  80           HB3      ASP  80 -29.139  -8.828  -0.827

  No H/Q in entry =           4
  In of MODEL   66
    1    H    SER  81           H        SER  81 -27.018  -8.343   2.813
    2    HA   SER  81           HA       SER  81 -24.520  -9.047   1.638
    3    HB2  SER  81           HB2      SER  81 -23.978 -10.050   3.821
    4    HB3  SER  81           HB3      SER  81 -24.679  -8.443   4.015
    5    HG   SER  81           HG       SER  81 -25.540 -10.812   4.931

  No H/Q in entry =           5
  In of MODEL   66
    1    H    LEU  82           H        LEU  82 -27.239 -11.126   1.975
    2    HA   LEU  82           HA       LEU  82 -25.697 -13.505   1.488
    3    HB2  LEU  82           HB2      LEU  82 -28.629 -13.016   1.023
    4    HB3  LEU  82           HB3      LEU  82 -27.828 -14.574   1.219
    5    HG   LEU  82           HG       LEU  82 -28.165 -12.500   3.366
    6   HD13  LEU  82          HD11      LEU  82 -30.285 -13.559   2.768
    7   HD12  LEU  82          HD12      LEU  82 -29.720 -14.181   4.320
    8   HD11  LEU  82          HD13      LEU  82 -29.535 -15.153   2.860
    9   HD23  LEU  82          HD21      LEU  82 -27.373 -14.478   4.756
   10   HD22  LEU  82          HD22      LEU  82 -26.157 -13.718   3.729
   11   HD21  LEU  82          HD23      LEU  82 -26.904 -15.236   3.233

  No H/Q in entry =          11
  In of MODEL   66
    1    H    LEU  83           H        LEU  83 -27.641 -11.296  -0.464
    2    HA   LEU  83           HA       LEU  83 -27.437 -12.684  -2.918
    3    HB2  LEU  83           HB2      LEU  83 -27.839  -9.768  -2.305
    4    HB3  LEU  83           HB3      LEU  83 -27.867 -10.433  -3.939
    5    HG   LEU  83           HG       LEU  83 -29.910 -10.786  -1.765
    6   HD13  LEU  83          HD11      LEU  83 -30.656  -8.949  -2.853
    7   HD12  LEU  83          HD12      LEU  83 -31.118 -10.076  -4.127
    8   HD11  LEU  83          HD13      LEU  83 -29.581  -9.217  -4.224
    9   HD23  LEU  83          HD21      LEU  83 -30.044 -12.076  -4.475
   10   HD22  LEU  83          HD22      LEU  83 -31.019 -12.406  -3.044
   11   HD21  LEU  83          HD23      LEU  83 -29.333 -12.916  -3.097

  No H/Q in entry =          11
  In of MODEL   66
    1    H    TYR  84           H        TYR  84 -25.481 -10.286  -1.263
    2    HA   TYR  84           HA       TYR  84 -23.610  -9.831  -3.394
    3    HB2  TYR  84           HB2      TYR  84 -24.132  -8.321  -1.388
    4    HB3  TYR  84           HB3      TYR  84 -23.112  -9.411  -0.451
    5    HD1  TYR  84           HD1      TYR  84 -20.749  -9.909  -1.679
    6    HD2  TYR  84           HD2      TYR  84 -23.115  -6.388  -2.167
    7    HE1  TYR  84           HE1      TYR  84 -18.742  -8.680  -2.430
    8    HE2  TYR  84           HE2      TYR  84 -21.119  -5.150  -2.930
    9    HH   TYR  84           HH       TYR  84 -17.934  -6.476  -2.612

  No H/Q in entry =           9
  In of MODEL   66
    1    H    GLY  85           H        GLY  85 -23.387 -11.798  -0.423
    2    HA3  GLY  85           HA2      GLY  85 -20.810 -12.756  -0.885
    3    HA2  GLY  85           HA3      GLY  85 -22.047 -13.587   0.059

  No H/Q in entry =           3
  In of MODEL   66
    1    H    LYS  86           H        LYS  86 -23.888 -13.978  -2.004
    2    HA   LYS  86           HA       LYS  86 -22.839 -16.371  -3.230
    3    HB2  LYS  86           HB2      LYS  86 -25.108 -16.113  -2.252
    4    HB3  LYS  86           HB3      LYS  86 -25.487 -14.950  -3.521
    5    HG2  LYS  86           HG2      LYS  86 -25.332 -16.670  -5.185
    6    HG3  LYS  86           HG3      LYS  86 -24.858 -17.845  -3.957
    7    HD2  LYS  86           HD2      LYS  86 -26.969 -17.423  -2.756
    8    HD3  LYS  86           HD3      LYS  86 -27.446 -16.281  -4.012
    9    HE2  LYS  86           HE2      LYS  86 -26.855 -19.198  -4.488
   10    HE3  LYS  86           HE3      LYS  86 -28.469 -18.521  -4.286
   11    HZ1  LYS  86           HZ1      LYS  86 -26.543 -17.594  -6.347
   12    HZ3  LYS  86           HZ2      LYS  86 -28.185 -17.178  -6.212
   13    HZ2  LYS  86           HZ3      LYS  86 -27.744 -18.760  -6.637

  No H/Q in entry =          13
  In of MODEL   66
    1    H    VAL  87           H        VAL  87 -22.813 -13.167  -4.163
    2    HA   VAL  87           HA       VAL  87 -22.504 -12.019  -6.117
    3    HB   VAL  87           HB       VAL  87 -21.431 -14.567  -7.373
    4   HG11  VAL  87          HG11      VAL  87 -21.672 -12.254  -8.553
    5   HG13  VAL  87          HG12      VAL  87 -20.139 -13.116  -8.700
    6   HG12  VAL  87          HG13      VAL  87 -20.297 -11.782  -7.557
    7   HG22  VAL  87          HG21      VAL  87 -19.345 -14.336  -6.311
    8   HG21  VAL  87          HG22      VAL  87 -20.544 -14.258  -5.022
    9   HG23  VAL  87          HG23      VAL  87 -19.784 -12.780  -5.609

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ASP  88           H        ASP  88 -25.024 -12.648  -5.766
    2    HA   ASP  88           HA       ASP  88 -26.142 -13.890  -8.152
    3    HB2  ASP  88           HB2      ASP  88 -27.145 -14.103  -5.828
    4    HB3  ASP  88           HB3      ASP  88 -27.592 -12.403  -5.949

  No H/Q in entry =           4
  In of MODEL   66
    1    H    GLY  89           H        GLY  89 -25.429 -12.655  -9.806
    2    HA3  GLY  89           HA2      GLY  89 -25.601  -9.885 -10.042
    3    HA2  GLY  89           HA3      GLY  89 -25.576 -11.022 -11.389

  No H/Q in entry =           3
  In of MODEL   66
    1    H    LEU  90           H        LEU  90 -28.029 -12.362 -10.930
    2    HA   LEU  90           HA       LEU  90 -29.831 -10.435 -12.073
    3    HB2  LEU  90           HB2      LEU  90 -29.901 -12.838 -12.624
    4    HB3  LEU  90           HB3      LEU  90 -30.412 -13.182 -10.972
    5    HG   LEU  90           HG       LEU  90 -32.527 -12.064 -11.354
    6   HD13  LEU  90          HD11      LEU  90 -32.339 -10.342 -12.850
    7   HD12  LEU  90          HD12      LEU  90 -32.878 -11.592 -13.974
    8   HD11  LEU  90          HD13      LEU  90 -31.163 -11.201 -13.849
    9   HD23  LEU  90          HD21      LEU  90 -32.455 -13.724 -13.768
   10   HD22  LEU  90          HD22      LEU  90 -33.439 -13.869 -12.312
   11   HD21  LEU  90          HD23      LEU  90 -31.787 -14.485 -12.325

  No H/Q in entry =          11
  In of MODEL   66
    1    H    GLY  91           H        GLY  91 -29.675 -11.898  -8.870
    2    HA3  GLY  91           HA2      GLY  91 -32.014 -10.765  -7.850
    3    HA2  GLY  91           HA3      GLY  91 -30.626 -11.290  -6.898

  No H/Q in entry =           3
  In of MODEL   66
    1    H    VAL  92           H        VAL  92 -28.700  -9.479  -7.772
    2    HA   VAL  92           HA       VAL  92 -29.490  -7.157  -6.254
    3    HB   VAL  92           HB       VAL  92 -26.940  -7.653  -7.837
    4   HG12  VAL  92          HG11      VAL  92 -27.106  -5.738  -5.534
    5   HG11  VAL  92          HG12      VAL  92 -27.766  -5.212  -7.084
    6   HG13  VAL  92          HG13      VAL  92 -26.072  -5.683  -6.963
    7   HG22  VAL  92          HG21      VAL  92 -26.725  -9.221  -6.223
    8   HG21  VAL  92          HG22      VAL  92 -27.871  -8.425  -5.144
    9   HG23  VAL  92          HG23      VAL  92 -26.215  -7.829  -5.268

  No H/Q in entry =           9
  In of MODEL   66
    1    H    LEU  93           H        LEU  93 -29.075  -7.863  -9.665
    2    HA   LEU  93           HA       LEU  93 -29.413  -5.238 -10.628
    3    HB2  LEU  93           HB2      LEU  93 -28.771  -7.113 -12.064
    4    HB3  LEU  93           HB3      LEU  93 -30.365  -7.834 -11.836
    5    HG   LEU  93           HG       LEU  93 -31.369  -5.883 -12.988
    6   HD11  LEU  93          HD11      LEU  93 -29.515  -4.285 -12.499
    7   HD13  LEU  93          HD12      LEU  93 -29.951  -4.335 -14.208
    8   HD12  LEU  93          HD13      LEU  93 -28.502  -5.167 -13.643
    9   HD23  LEU  93          HD21      LEU  93 -30.326  -6.480 -15.265
   10   HD22  LEU  93          HD22      LEU  93 -31.174  -7.724 -14.346
   11   HD21  LEU  93          HD23      LEU  93 -29.408  -7.672 -14.344

  No H/Q in entry =          11
  In of MODEL   66
    1    H    LYS  94           H        LYS  94 -31.796  -7.767  -9.752
    2    HA   LYS  94           HA       LYS  94 -34.135  -6.328 -10.400
    3    HB2  LYS  94           HB2      LYS  94 -33.631  -8.490  -8.360
    4    HB3  LYS  94           HB3      LYS  94 -35.226  -7.794  -8.641
    5    HG2  LYS  94           HG2      LYS  94 -35.136  -8.598 -10.965
    6    HG3  LYS  94           HG3      LYS  94 -33.578  -9.349 -10.624
    7    HD2  LYS  94           HD2      LYS  94 -34.706 -10.657  -8.785
    8    HD3  LYS  94           HD3      LYS  94 -36.246 -10.013  -9.352
    9    HE2  LYS  94           HE2      LYS  94 -35.728 -10.971 -11.606
   10    HE3  LYS  94           HE3      LYS  94 -34.316 -11.749 -10.888
   11    HZ3  LYS  94           HZ1      LYS  94 -36.169 -13.269 -11.044
   12    HZ2  LYS  94           HZ2      LYS  94 -37.142 -12.228 -10.118
   13    HZ1  LYS  94           HZ3      LYS  94 -35.786 -12.971  -9.417

  No H/Q in entry =          13
  In of MODEL   66
    1    H    ALA  95           H        ALA  95 -32.319  -6.416  -7.346
    2    HA   ALA  95           HA       ALA  95 -34.167  -4.812  -5.891
    3    HB2  ALA  95           HB1      ALA  95 -31.797  -6.186  -5.332
    4    HB3  ALA  95           HB2      ALA  95 -32.776  -5.265  -4.191
    5    HB1  ALA  95           HB3      ALA  95 -31.424  -4.491  -5.020

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ALA  96           H        ALA  96 -31.518  -3.991  -7.992
    2    HA   ALA  96           HA       ALA  96 -31.417  -1.221  -7.253
    3    HB2  ALA  96           HB1      ALA  96 -30.050  -1.024  -9.362
    4    HB3  ALA  96           HB2      ALA  96 -30.357  -2.735  -9.660
    5    HB1  ALA  96           HB3      ALA  96 -29.444  -2.240  -8.236

  No H/Q in entry =           5
  In of MODEL   66
    1    H    VAL  97           H        VAL  97 -32.948  -2.964  -9.922
    2    HA   VAL  97           HA       VAL  97 -34.008  -0.677 -11.208
    3    HB   VAL  97           HB       VAL  97 -34.827  -3.600 -11.217
    4   HG11  VAL  97          HG11      VAL  97 -36.610  -1.594 -11.731
    5   HG13  VAL  97          HG12      VAL  97 -36.674  -3.195 -12.467
    6   HG12  VAL  97          HG13      VAL  97 -35.914  -1.859 -13.330
    7   HG21  VAL  97          HG21      VAL  97 -33.536  -1.801 -13.271
    8   HG23  VAL  97          HG22      VAL  97 -33.995  -3.483 -13.540
    9   HG22  VAL  97          HG23      VAL  97 -32.747  -3.086 -12.357

  No H/Q in entry =           9
  In of MODEL   66
    1    H    ALA  98           H        ALA  98 -35.204  -2.820  -8.648
    2    HA   ALA  98           HA       ALA  98 -37.760  -1.657  -8.317
    3    HB1  ALA  98           HB1      ALA  98 -36.758  -3.848  -7.255
    4    HB3  ALA  98           HB2      ALA  98 -37.937  -2.907  -6.337
    5    HB2  ALA  98           HB3      ALA  98 -36.216  -2.761  -5.976

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ALA  99           H        ALA  99 -34.682  -0.851  -6.672
    2    HA   ALA  99           HA       ALA  99 -35.806   1.157  -5.037
    3    HB1  ALA  99           HB1      ALA  99 -33.161   0.247  -5.768
    4    HB2  ALA  99           HB2      ALA  99 -33.710   1.018  -4.279
    5    HB3  ALA  99           HB3      ALA  99 -33.227   2.005  -5.657

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ILE 100           H        ILE 100 -34.758   1.243  -8.392
    2    HA   ILE 100           HA       ILE 100 -34.922   4.090  -8.645
    3    HB   ILE 100           HB       ILE 100 -35.024   1.910 -10.758
    4   HG12  ILE 100          HG12      ILE 100 -32.851   3.899 -10.106
    5   HG13  ILE 100          HG13      ILE 100 -32.898   2.261  -9.456
    6   HG21  ILE 100          HG21      ILE 100 -35.432   4.830 -10.924
    7   HG23  ILE 100          HG22      ILE 100 -35.941   3.551 -12.026
    8   HG22  ILE 100          HG23      ILE 100 -34.286   4.158 -12.084
    9   HD12  ILE 100          HD11      ILE 100 -32.354   3.182 -12.240
   10   HD11  ILE 100          HD12      ILE 100 -33.024   1.574 -11.968
   11   HD13  ILE 100          HD13      ILE 100 -31.477   2.017 -11.250

  No H/Q in entry =          11
  In of MODEL   66
    1    H    LYS 101           H        LYS 101 -37.228   1.484  -9.345
    2    HA   LYS 101           HA       LYS 101 -39.298   3.132 -10.369
    3    HB2  LYS 101           HB2      LYS 101 -39.199   0.371  -9.208
    4    HB3  LYS 101           HB3      LYS 101 -40.746   1.136  -9.566
    5    HG2  LYS 101           HG2      LYS 101 -40.266   1.242 -11.864
    6    HG3  LYS 101           HG3      LYS 101 -38.574   0.830 -11.601
    7    HD2  LYS 101           HD2      LYS 101 -39.832  -1.081 -12.468
    8    HD3  LYS 101           HD3      LYS 101 -39.209  -1.396 -10.848
    9    HE2  LYS 101           HE2      LYS 101 -41.278  -2.074 -10.338
   10    HE3  LYS 101           HE3      LYS 101 -41.725  -0.367 -10.361
   11    HZ3  LYS 101           HZ1      LYS 101 -42.613  -0.544 -12.479
   12    HZ2  LYS 101           HZ2      LYS 101 -43.083  -2.007 -11.756
   13    HZ1  LYS 101           HZ3      LYS 101 -41.774  -1.977 -12.837

  No H/Q in entry =          13
  In of MODEL   66
    1    H    LYS 102           H        LYS 102 -38.822   1.689  -7.142
    2    HA   LYS 102           HA       LYS 102 -41.065   2.909  -5.963
    3    HB2  LYS 102           HB2      LYS 102 -39.841   1.048  -4.924
    4    HB3  LYS 102           HB3      LYS 102 -38.445   2.098  -4.689
    5    HG2  LYS 102           HG2      LYS 102 -39.758   3.517  -3.211
    6    HG3  LYS 102           HG3      LYS 102 -41.157   2.470  -3.448
    7    HD2  LYS 102           HD2      LYS 102 -39.943   0.609  -2.398
    8    HD3  LYS 102           HD3      LYS 102 -38.545   1.658  -2.159
    9    HE2  LYS 102           HE2      LYS 102 -39.894   3.158  -0.770
   10    HE3  LYS 102           HE3      LYS 102 -41.310   2.141  -1.031
   11    HZ1  LYS 102           HZ1      LYS 102 -39.601   0.388  -0.004
   12    HZ3  LYS 102           HZ2      LYS 102 -40.709   1.290   0.913
   13    HZ2  LYS 102           HZ3      LYS 102 -39.096   1.804   0.785

  No H/Q in entry =          13
  In of MODEL   66
    1    H    ALA 103           H        ALA 103 -38.101   4.274  -6.984
    2    HA   ALA 103           HA       ALA 103 -38.315   6.609  -5.228
    3    HB2  ALA 103           HB1      ALA 103 -36.317   7.315  -6.806
    4    HB3  ALA 103           HB2      ALA 103 -36.290   5.592  -7.186
    5    HB1  ALA 103           HB3      ALA 103 -36.064   6.133  -5.523

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ALA 104           H        ALA 104 -38.933   5.844  -8.568
    2    HA   ALA 104           HA       ALA 104 -39.501   8.625  -9.222
    3    HB2  ALA 104           HB1      ALA 104 -39.543   7.934 -11.417
    4    HB1  ALA 104           HB2      ALA 104 -40.279   6.379 -11.024
    5    HB3  ALA 104           HB3      ALA 104 -38.556   6.636 -10.743

  No H/Q in entry =           5
  In of MODEL   66
    1    H    ALA 105           H        ALA 105 -41.125   6.549  -7.398
    2    HA   ALA 105           HA       ALA 105 -43.542   7.955  -7.393
    3    HB2  ALA 105           HB1      ALA 105 -44.287   7.077  -9.424
    4    HB3  ALA 105           HB2      ALA 105 -44.932   5.905  -8.277
    5    HB1  ALA 105           HB3      ALA 105 -43.462   5.538  -9.177

  No H/Q in entry =           5
  In of MODEL   67
    1    H1   ALA   1           H3       ALA   1 -12.437 -15.443  -2.182
    2    H2   ALA   1           H2       ALA   1 -11.514 -16.598  -3.026
    3    H3   ALA   1           H1       ALA   1 -12.651 -15.641  -3.855
    4    HA   ALA   1           HA       ALA   1 -14.068 -17.325  -3.605
    5    HB3  ALA   1           HB1      ALA   1 -12.691 -19.112  -3.148
    6    HB1  ALA   1           HB2      ALA   1 -13.437 -18.988  -1.555
    7    HB2  ALA   1           HB3      ALA   1 -11.854 -18.266  -1.845

  No H/Q in entry =           7
  In of MODEL   67
    1    H    GLU   2           H        GLU   2 -15.692 -18.157  -1.940
    2    HA   GLU   2           HA       GLU   2 -17.314 -16.416  -0.875
    3    HB2  GLU   2           HB2      GLU   2 -16.394 -18.850   0.669
    4    HB3  GLU   2           HB3      GLU   2 -17.907 -17.982   0.930
    5    HG2  GLU   2           HG2      GLU   2 -18.909 -19.059  -0.797
    6    HG3  GLU   2           HG3      GLU   2 -17.587 -18.676  -1.890

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLU   3           H        GLU   3 -15.403 -17.788   1.740
    2    HA   GLU   3           HA       GLU   3 -15.588 -15.430   3.295
    3    HB2  GLU   3           HB2      GLU   3 -14.031 -17.994   3.540
    4    HB3  GLU   3           HB3      GLU   3 -13.778 -16.676   4.684
    5    HG2  GLU   3           HG2      GLU   3 -15.968 -16.800   5.515
    6    HG3  GLU   3           HG3      GLU   3 -16.581 -17.595   4.070

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LEU   4           H        LEU   4 -12.659 -16.945   1.889
    2    HA   LEU   4           HA       LEU   4 -10.799 -15.063   2.475
    3    HB2  LEU   4           HB2      LEU   4 -11.060 -16.362  -0.247
    4    HB3  LEU   4           HB3      LEU   4  -9.595 -15.658   0.429
    5    HG   LEU   4           HG       LEU   4 -11.111 -18.035   1.554
    6   HD13  LEU   4          HD11      LEU   4  -9.500 -19.411   0.617
    7   HD12  LEU   4          HD12      LEU   4  -8.276 -18.143   0.582
    8   HD11  LEU   4          HD13      LEU   4  -9.571 -18.151  -0.614
    9   HD23  LEU   4          HD21      LEU   4  -8.854 -18.123   2.923
   10   HD22  LEU   4          HD22      LEU   4 -10.159 -17.067   3.458
   11   HD21  LEU   4          HD23      LEU   4  -8.794 -16.396   2.567

  No H/Q in entry =          11
  In of MODEL   67
    1    H    GLU   5           H        GLU   5 -13.145 -14.832  -0.187
    2    HA   GLU   5           HA       GLU   5 -12.118 -12.362  -1.197
    3    HB2  GLU   5           HB2      GLU   5 -13.502 -13.953  -2.534
    4    HB3  GLU   5           HB3      GLU   5 -14.890 -13.528  -1.533
    5    HG2  GLU   5           HG2      GLU   5 -14.998 -12.167  -3.518
    6    HG3  GLU   5           HG3      GLU   5 -14.517 -11.121  -2.183

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLU   6           H        GLU   6 -14.842 -13.205   0.911
    2    HA   GLU   6           HA       GLU   6 -15.712 -10.517   1.311
    3    HB2  GLU   6           HB2      GLU   6 -16.153 -13.054   2.900
    4    HB3  GLU   6           HB3      GLU   6 -16.923 -11.516   3.285
    5    HG2  GLU   6           HG2      GLU   6 -17.138 -12.915   0.605
    6    HG3  GLU   6           HG3      GLU   6 -18.361 -12.995   1.870

  No H/Q in entry =           6
  In of MODEL   67
    1    H    VAL   7           H        VAL   7 -13.422 -12.653   2.874
    2    HA   VAL   7           HA       VAL   7 -12.924 -11.080   5.196
    3    HB   VAL   7           HB       VAL   7 -11.253 -13.146   3.740
    4   HG11  VAL   7          HG11      VAL   7 -10.753 -11.615   6.299
    5   HG13  VAL   7          HG12      VAL   7  -9.663 -11.844   4.933
    6   HG12  VAL   7          HG13      VAL   7 -10.026 -13.195   6.007
    7   HG21  VAL   7          HG21      VAL   7 -13.504 -13.681   4.973
    8   HG23  VAL   7          HG22      VAL   7 -12.566 -13.416   6.443
    9   HG22  VAL   7          HG23      VAL   7 -12.094 -14.684   5.313

  No H/Q in entry =           9
  In of MODEL   67
    1    H    VAL   8           H        VAL   8 -11.432 -11.217   1.978
    2    HA   VAL   8           HA       VAL   8  -9.344  -9.369   2.457
    3    HB   VAL   8           HB       VAL   8 -10.829 -10.032  -0.097
    4   HG12  VAL   8          HG11      VAL   8  -8.541  -9.099  -1.028
    5   HG11  VAL   8          HG12      VAL   8  -8.509  -8.219   0.500
    6   HG13  VAL   8          HG13      VAL   8  -9.849  -7.986  -0.623
    7   HG22  VAL   8          HG21      VAL   8  -9.349 -11.781  -0.357
    8   HG21  VAL   8          HG22      VAL   8  -9.180 -11.649   1.390
    9   HG23  VAL   8          HG23      VAL   8  -8.003 -10.873   0.336

  No H/Q in entry =           9
  In of MODEL   67
    1    H    MET   9           H        MET   9 -12.691  -8.941   1.314
    2    HA   MET   9           HA       MET   9 -12.596  -6.166   0.874
    3    HB2  MET   9           HB2      MET   9 -14.877  -7.909   1.839
    4    HB3  MET   9           HB3      MET   9 -15.060  -6.224   1.348
    5    HG2  MET   9           HG2      MET   9 -14.235  -6.750  -0.891
    6    HG3  MET   9           HG3      MET   9 -13.935  -8.421  -0.412
    7    HE3  MET   9           HE1      MET   9 -17.201  -6.101   0.516
    8    HE2  MET   9           HE2      MET   9 -17.881  -6.256  -1.101
    9    HE1  MET   9           HE3      MET   9 -16.261  -5.596  -0.895

  No H/Q in entry =           9
  In of MODEL   67
    1    H    GLY  10           H        GLY  10 -13.266  -8.044   3.808
    2    HA3  GLY  10           HA2      GLY  10 -13.779  -5.851   5.526
    3    HA2  GLY  10           HA3      GLY  10 -13.231  -7.445   6.040

  No H/Q in entry =           3
  In of MODEL   67
    1    H    LEU  11           H        LEU  11 -10.794  -7.600   4.712
    2    HA   LEU  11           HA       LEU  11  -9.068  -6.183   6.458
    3    HB2  LEU  11           HB2      LEU  11  -8.552  -7.617   3.850
    4    HB3  LEU  11           HB3      LEU  11  -7.268  -6.926   4.841
    5    HG   LEU  11           HG       LEU  11  -9.288  -8.934   5.871
    6   HD13  LEU  11          HD11      LEU  11  -8.089 -10.187   4.302
    7   HD12  LEU  11          HD12      LEU  11  -7.149 -10.434   5.773
    8   HD11  LEU  11          HD13      LEU  11  -6.601  -9.278   4.560
    9   HD22  LEU  11          HD21      LEU  11  -8.413  -7.928   7.781
   10   HD21  LEU  11          HD22      LEU  11  -6.875  -7.545   7.010
   11   HD23  LEU  11          HD23      LEU  11  -7.217  -9.197   7.524

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  12           H        ILE  12  -9.981  -5.631   3.072
    2    HA   ILE  12           HA       ILE  12  -8.267  -3.421   2.633
    3    HB   ILE  12           HB       ILE  12 -10.939  -4.044   1.351
    4   HG12  ILE  12          HG12      ILE  12  -8.931  -5.746   1.291
    5   HG13  ILE  12          HG13      ILE  12  -9.819  -5.404  -0.180
    6   HG23  ILE  12          HG21      ILE  12 -10.402  -1.787   0.797
    7   HG22  ILE  12          HG22      ILE  12  -9.837  -2.726  -0.578
    8   HG21  ILE  12          HG23      ILE  12  -8.716  -2.166   0.629
    9   HD12  ILE  12          HD11      ILE  12  -7.314  -5.405  -0.432
   10   HD11  ILE  12          HD12      ILE  12  -7.261  -4.007   0.639
   11   HD13  ILE  12          HD13      ILE  12  -8.070  -3.896  -0.907

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  13           H        ILE  13 -11.625  -3.650   3.744
    2    HA   ILE  13           HA       ILE  13 -12.053  -0.857   4.011
    3    HB   ILE  13           HB       ILE  13 -13.277  -3.271   5.364
    4   HG12  ILE  13          HG12      ILE  13 -13.523  -2.674   2.838
    5   HG13  ILE  13          HG13      ILE  13 -14.941  -3.140   3.752
    6   HG23  ILE  13          HG21      ILE  13 -13.835  -1.697   6.961
    7   HG22  ILE  13          HG22      ILE  13 -15.159  -1.437   5.834
    8   HG21  ILE  13          HG23      ILE  13 -13.773  -0.351   5.827
    9   HD12  ILE  13          HD11      ILE  13 -15.250  -1.080   2.300
   10   HD11  ILE  13          HD12      ILE  13 -14.111  -0.279   3.364
   11   HD13  ILE  13          HD13      ILE  13 -15.631  -0.854   4.010

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ASN  14           H        ASN  14 -10.957  -3.356   6.284
    2    HA   ASN  14           HA       ASN  14 -10.727  -1.716   8.566
    3    HB2  ASN  14           HB2      ASN  14 -10.503  -4.326   8.247
    4    HB3  ASN  14           HB3      ASN  14  -8.791  -3.958   8.081
    5   HD21  ASN  14          HD21      ASN  14  -9.432  -5.471  10.263
    6   HD22  ASN  14          HD22      ASN  14  -9.387  -4.549  11.685

  No H/Q in entry =           6
  In of MODEL   67
    1    H    SER  15           H        SER  15  -8.346  -2.569   6.064
    2    HA   SER  15           HA       SER  15  -6.182  -1.096   7.122
    3    HB2  SER  15           HB2      SER  15  -5.178  -1.319   4.954
    4    HB3  SER  15           HB3      SER  15  -6.136  -2.775   5.196
    5    HG   SER  15           HG       SER  15  -7.680  -1.995   3.860

  No H/Q in entry =           5
  In of MODEL   67
    1    H    GLY  16           H        GLY  16  -8.786  -0.207   4.887
    2    HA3  GLY  16           HA2      GLY  16  -7.905   2.424   4.326
    3    HA2  GLY  16           HA3      GLY  16  -9.562   1.845   4.174

  No H/Q in entry =           3
  In of MODEL   67
    1    H    GLN  17           H        GLN  17 -10.099   1.130   6.827
    2    HA   GLN  17           HA       GLN  17 -10.776   3.643   7.967
    3    HB2  GLN  17           HB2      GLN  17 -12.045   1.606   8.478
    4    HB3  GLN  17           HB3      GLN  17 -10.635   0.918   9.283
    5    HG2  GLN  17           HG2      GLN  17 -10.662   2.703  10.946
    6    HG3  GLN  17           HG3      GLN  17 -11.991   3.501  10.107
    7   HE21  GLN  17          HE21      GLN  17 -12.274   2.683  12.825
    8   HE22  GLN  17          HE22      GLN  17 -13.399   1.413  12.891

  No H/Q in entry =           8
  In of MODEL   67
    1    H    ALA  18           H        ALA  18  -8.166   1.339   8.577
    2    HA   ALA  18           HA       ALA  18  -7.046   2.549  10.840
    3    HB2  ALA  18           HB1      ALA  18  -6.463   0.325   9.474
    4    HB3  ALA  18           HB2      ALA  18  -5.288   1.099  10.537
    5    HB1  ALA  18           HB3      ALA  18  -5.217   1.374   8.796

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ARG  19           H        ARG  19  -6.287   3.059   7.387
    2    HA   ARG  19           HA       ARG  19  -4.368   5.090   7.802
    3    HB2  ARG  19           HB2      ARG  19  -4.717   3.948   5.610
    4    HB3  ARG  19           HB3      ARG  19  -6.253   4.802   5.440
    5    HG2  ARG  19           HG2      ARG  19  -5.105   6.964   5.498
    6    HG3  ARG  19           HG3      ARG  19  -3.561   6.165   5.796
    7    HD2  ARG  19           HD2      ARG  19  -3.692   6.752   3.452
    8    HD3  ARG  19           HD3      ARG  19  -3.792   4.993   3.602
    9    HE   ARG  19           HE       ARG  19  -6.418   5.925   3.606
   10   HH21  ARG  19          HH11      ARG  19  -7.621   6.088   1.693
   11   HH22  ARG  19          HH12      ARG  19  -6.806   6.156   0.169
   12   HH11  ARG  19          HH21      ARG  19  -3.652   5.961   1.558
   13   HH12  ARG  19          HH22      ARG  19  -4.558   6.081   0.093

  No H/Q in entry =          13
  In of MODEL   67
    1    H    SER  20           H        SER  20  -7.868   5.234   7.219
    2    HA   SER  20           HA       SER  20  -8.202   7.992   7.167
    3    HB2  SER  20           HB2      SER  20 -10.017   6.405   6.679
    4    HB3  SER  20           HB3      SER  20 -10.057   5.930   8.376
    5    HG   SER  20           HG       SER  20 -10.236   8.646   7.753

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LEU  21           H        LEU  21  -8.207   5.815   9.975
    2    HA   LEU  21           HA       LEU  21  -8.621   7.819  11.938
    3    HB2  LEU  21           HB2      LEU  21  -7.288   5.108  12.099
    4    HB3  LEU  21           HB3      LEU  21  -7.587   6.129  13.501
    5    HG   LEU  21           HG       LEU  21  -9.768   5.246  11.589
    6   HD13  LEU  21          HD11      LEU  21  -8.935   3.239  12.587
    7   HD12  LEU  21          HD12      LEU  21 -10.373   3.679  13.508
    8   HD11  LEU  21          HD13      LEU  21  -8.768   4.011  14.164
    9   HD23  LEU  21          HD21      LEU  21 -11.092   5.747  13.826
   10   HD22  LEU  21          HD22      LEU  21 -10.646   7.088  12.776
   11   HD21  LEU  21          HD23      LEU  21  -9.693   6.745  14.212

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ALA  22           H        ALA  22  -5.687   6.419  10.520
    2    HA   ALA  22           HA       ALA  22  -3.789   7.721  12.130
    3    HB2  ALA  22           HB1      ALA  22  -3.396   5.860  10.440
    4    HB1  ALA  22           HB2      ALA  22  -2.190   7.147  10.467
    5    HB3  ALA  22           HB3      ALA  22  -3.414   7.110   9.197

  No H/Q in entry =           5
  In of MODEL   67
    1    H    TYR  23           H        TYR  23  -5.113   8.741   8.951
    2    HA   TYR  23           HA       TYR  23  -3.758  11.227   8.870
    3    HB2  TYR  23           HB2      TYR  23  -4.856  10.319   6.886
    4    HB3  TYR  23           HB3      TYR  23  -6.430  10.441   7.673
    5    HD1  TYR  23           HD1      TYR  23  -3.510  12.464   6.523
    6    HD2  TYR  23           HD2      TYR  23  -7.658  12.455   7.636
    7    HE1  TYR  23           HE1      TYR  23  -3.719  14.815   5.759
    8    HE2  TYR  23           HE2      TYR  23  -7.868  14.804   6.871
    9    HH   TYR  23           HH       TYR  23  -5.041  16.619   5.712

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ALA  24           H        ALA  24  -6.879  10.277  10.266
    2    HA   ALA  24           HA       ALA  24  -7.692  12.874  11.035
    3    HB1  ALA  24           HB1      ALA  24  -9.517  11.638  11.514
    4    HB2  ALA  24           HB2      ALA  24  -8.689  11.063  12.959
    5    HB3  ALA  24           HB3      ALA  24  -8.578  10.147  11.457

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ALA  25           H        ALA  25  -5.701  10.404  12.605
    2    HA   ALA  25           HA       ALA  25  -5.342  11.659  15.103
    3    HB2  ALA  25           HB1      ALA  25  -4.597   9.299  14.284
    4    HB3  ALA  25           HB2      ALA  25  -3.570  10.152  15.438
    5    HB1  ALA  25           HB3      ALA  25  -3.142  10.128  13.727

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LEU  26           H        LEU  26  -3.563  11.938  12.054
    2    HA   LEU  26           HA       LEU  26  -1.586  13.744  12.957
    3    HB2  LEU  26           HB2      LEU  26  -1.304  12.586  10.855
    4    HB3  LEU  26           HB3      LEU  26  -2.774  13.304  10.205
    5    HG   LEU  26           HG       LEU  26  -1.741  15.546  10.331
    6   HD12  LEU  26          HD11      LEU  26   0.799  15.547  10.734
    7   HD11  LEU  26          HD12      LEU  26   0.567  13.970  11.482
    8   HD13  LEU  26          HD13      LEU  26  -0.227  15.392  12.159
    9   HD21  LEU  26          HD21      LEU  26  -0.021  13.475   8.933
   10   HD23  LEU  26          HD22      LEU  26  -0.052  15.196   8.559
   11   HD22  LEU  26          HD23      LEU  26  -1.485  14.209   8.279

  No H/Q in entry =          11
  In of MODEL   67
    1    H    LYS  27           H        LYS  27  -4.771  14.249  11.494
    2    HA   LYS  27           HA       LYS  27  -4.695  17.037  11.289
    3    HB2  LYS  27           HB2      LYS  27  -6.455  15.572  10.315
    4    HB3  LYS  27           HB3      LYS  27  -7.106  15.324  11.935
    5    HG2  LYS  27           HG2      LYS  27  -7.515  17.734  12.168
    6    HG3  LYS  27           HG3      LYS  27  -6.812  18.022  10.573
    7    HD2  LYS  27           HD2      LYS  27  -8.561  16.600   9.548
    8    HD3  LYS  27           HD3      LYS  27  -9.270  16.329  11.141
    9    HE2  LYS  27           HE2      LYS  27  -9.691  18.744  11.381
   10    HE3  LYS  27           HE3      LYS  27  -8.954  19.036   9.803
   11    HZ3  LYS  27           HZ1      LYS  27 -11.334  18.930   9.572
   12    HZ2  LYS  27           HZ2      LYS  27 -11.391  17.416  10.345
   13    HZ1  LYS  27           HZ3      LYS  27 -10.652  17.570   8.820

  No H/Q in entry =          13
  In of MODEL   67
    1    H    GLN  28           H        GLN  28  -5.588  14.964  14.025
    2    HA   GLN  28           HA       GLN  28  -6.458  16.979  15.801
    3    HB2  GLN  28           HB2      GLN  28  -5.075  14.338  16.344
    4    HB3  GLN  28           HB3      GLN  28  -5.804  15.351  17.591
    5    HG2  GLN  28           HG2      GLN  28  -7.278  14.226  15.192
    6    HG3  GLN  28           HG3      GLN  28  -7.344  13.556  16.822
    7   HE21  GLN  28          HE21      GLN  28  -9.253  15.278  14.868
    8   HE22  GLN  28          HE22      GLN  28  -9.968  16.350  15.973

  No H/Q in entry =           8
  In of MODEL   67
    1    H    ALA  29           H        ALA  29  -3.254  15.652  15.099
    2    HA   ALA  29           HA       ALA  29  -1.794  17.041  17.068
    3    HB1  ALA  29           HB1      ALA  29   0.125  16.329  15.941
    4    HB3  ALA  29           HB2      ALA  29  -0.636  16.458  14.356
    5    HB2  ALA  29           HB3      ALA  29  -1.065  15.131  15.435

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LYS  30           H        LYS  30  -2.659  17.922  13.741
    2    HA   LYS  30           HA       LYS  30  -1.224  20.347  13.629
    3    HB2  LYS  30           HB2      LYS  30  -3.771  19.497  12.234
    4    HB3  LYS  30           HB3      LYS  30  -2.922  21.002  11.883
    5    HG2  LYS  30           HG2      LYS  30  -0.869  19.686  11.362
    6    HG3  LYS  30           HG3      LYS  30  -1.791  18.200  11.614
    7    HD2  LYS  30           HD2      LYS  30  -3.356  18.854   9.826
    8    HD3  LYS  30           HD3      LYS  30  -2.458  20.352   9.576
    9    HE2  LYS  30           HE2      LYS  30  -0.443  19.036   8.989
   10    HE3  LYS  30           HE3      LYS  30  -1.360  17.543   9.208
   11    HZ2  LYS  30           HZ1      LYS  30  -1.186  18.408   6.864
   12    HZ1  LYS  30           HZ2      LYS  30  -2.213  19.683   7.335
   13    HZ3  LYS  30           HZ3      LYS  30  -2.755  18.072   7.412

  No H/Q in entry =          13
  In of MODEL   67
    1    H    GLN  31           H        GLN  31  -4.327  19.533  15.058
    2    HA   GLN  31           HA       GLN  31  -5.055  22.299  15.509
    3    HB2  GLN  31           HB2      GLN  31  -6.257  19.869  16.842
    4    HB3  GLN  31           HB3      GLN  31  -6.999  21.450  16.597
    5    HG2  GLN  31           HG2      GLN  31  -6.311  20.660  14.005
    6    HG3  GLN  31           HG3      GLN  31  -6.850  19.163  14.758
    7   HE21  GLN  31          HE21      GLN  31  -8.252  20.750  12.660
    8   HE22  GLN  31          HE22      GLN  31  -9.758  21.161  13.325

  No H/Q in entry =           8
  In of MODEL   67
    1    H    GLY  32           H        GLY  32  -2.760  20.346  16.821
    2    HA3  GLY  32           HA2      GLY  32  -1.345  20.794  18.615
    3    HA2  GLY  32           HA3      GLY  32  -2.456  22.051  19.142

  No H/Q in entry =           3
  In of MODEL   67
    1    H    ASP  33           H        ASP  33  -3.919  19.029  18.493
    2    HA   ASP  33           HA       ASP  33  -4.321  18.581  21.375
    3    HB2  ASP  33           HB2      ASP  33  -5.752  17.583  18.907
    4    HB3  ASP  33           HB3      ASP  33  -6.097  16.980  20.526

  No H/Q in entry =           4
  In of MODEL   67
    1    H    PHE  34           H        PHE  34  -2.162  17.703  21.671
    2    HA   PHE  34           HA       PHE  34  -1.197  15.440  20.268
    3    HB2  PHE  34           HB2      PHE  34  -0.553  16.421  23.058
    4    HB3  PHE  34           HB3      PHE  34   0.355  15.185  22.188
    5    HD1  PHE  34           HD1      PHE  34   0.230  18.613  22.919
    6    HD2  PHE  34           HD2      PHE  34   1.010  15.895  19.684
    7    HE1  PHE  34           HE1      PHE  34   1.542  20.366  21.755
    8    HE2  PHE  34           HE2      PHE  34   2.316  17.651  18.525
    9    HZ   PHE  34           HZ       PHE  34   2.584  19.884  19.565

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ALA  35           H        ALA  35  -3.218  15.747  23.142
    2    HA   ALA  35           HA       ALA  35  -3.035  13.084  24.041
    3    HB3  ALA  35           HB1      ALA  35  -5.480  13.742  24.910
    4    HB1  ALA  35           HB2      ALA  35  -4.929  15.353  24.449
    5    HB2  ALA  35           HB3      ALA  35  -4.020  14.419  25.637

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ALA  36           H        ALA  36  -5.477  14.628  21.952
    2    HA   ALA  36           HA       ALA  36  -6.925  12.234  21.485
    3    HB1  ALA  36           HB1      ALA  36  -8.367  13.674  20.534
    4    HB3  ALA  36           HB2      ALA  36  -7.196  14.077  19.279
    5    HB2  ALA  36           HB3      ALA  36  -7.202  14.967  20.801

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ALA  37           H        ALA  37  -4.233  13.785  19.800
    2    HA   ALA  37           HA       ALA  37  -4.231  12.146  17.505
    3    HB3  ALA  37           HB1      ALA  37  -2.210  13.834  18.915
    4    HB2  ALA  37           HB2      ALA  37  -2.748  13.895  17.238
    5    HB1  ALA  37           HB3      ALA  37  -1.607  12.651  17.754

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LYS  38           H        LYS  38  -2.462  11.822  20.574
    2    HA   LYS  38           HA       LYS  38  -1.170   9.405  20.082
    3    HB2  LYS  38           HB2      LYS  38  -1.459  11.174  22.226
    4    HB3  LYS  38           HB3      LYS  38  -2.094   9.654  22.848
    5    HG2  LYS  38           HG2      LYS  38  -0.017   8.506  22.302
    6    HG3  LYS  38           HG3      LYS  38   0.605   9.942  21.483
    7    HD2  LYS  38           HD2      LYS  38   0.801  11.161  23.516
    8    HD3  LYS  38           HD3      LYS  38  -0.229  10.025  24.390
    9    HE2  LYS  38           HE2      LYS  38   2.126   9.680  24.997
   10    HE3  LYS  38           HE3      LYS  38   1.499   8.271  24.138
   11    HZ3  LYS  38           HZ1      LYS  38   2.796   8.671  22.350
   12    HZ2  LYS  38           HZ2      LYS  38   3.767   9.488  23.480
   13    HZ1  LYS  38           HZ3      LYS  38   2.693  10.360  22.493

  No H/Q in entry =          13
  In of MODEL   67
    1    H    ALA  39           H        ALA  39  -4.394   9.942  21.501
    2    HA   ALA  39           HA       ALA  39  -4.986   7.231  22.012
    3    HB3  ALA  39           HB1      ALA  39  -7.124   9.202  21.253
    4    HB2  ALA  39           HB2      ALA  39  -6.216   9.419  22.749
    5    HB1  ALA  39           HB3      ALA  39  -7.152   7.947  22.493

  No H/Q in entry =           5
  In of MODEL   67
    1    H    MET  40           H        MET  40  -5.561   9.248  19.165
    2    HA   MET  40           HA       MET  40  -7.068   7.332  17.715
    3    HB2  MET  40           HB2      MET  40  -5.434   9.706  16.799
    4    HB3  MET  40           HB3      MET  40  -6.477   8.759  15.735
    5    HG2  MET  40           HG2      MET  40  -7.483  10.024  18.297
    6    HG3  MET  40           HG3      MET  40  -7.538  10.857  16.746
    7    HE3  MET  40           HE1      MET  40 -10.152   9.267  14.697
    8    HE2  MET  40           HE2      MET  40  -8.399   9.362  14.540
    9    HE1  MET  40           HE3      MET  40  -9.296  10.740  15.176

  No H/Q in entry =           9
  In of MODEL   67
    1    H    MET  41           H        MET  41  -3.568   8.027  17.819
    2    HA   MET  41           HA       MET  41  -2.842   6.260  15.717
    3    HB2  MET  41           HB2      MET  41  -1.205   6.910  18.181
    4    HB3  MET  41           HB3      MET  41  -0.603   6.253  16.663
    5    HG2  MET  41           HG2      MET  41  -1.738   8.448  15.662
    6    HG3  MET  41           HG3      MET  41  -1.486   9.035  17.304
    7    HE2  MET  41           HE1      MET  41   1.408   6.902  17.654
    8    HE1  MET  41           HE2      MET  41   0.640   8.207  18.554
    9    HE3  MET  41           HE3      MET  41   2.263   8.430  17.903

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ASP  42           H        ASP  42  -3.215   5.796  19.206
    2    HA   ASP  42           HA       ASP  42  -2.209   3.190  19.364
    3    HB2  ASP  42           HB2      ASP  42  -3.052   4.963  21.188
    4    HB3  ASP  42           HB3      ASP  42  -4.492   3.954  21.125

  No H/Q in entry =           4
  In of MODEL   67
    1    H    GLN  43           H        GLN  43  -5.532   4.333  18.879
    2    HA   GLN  43           HA       GLN  43  -6.707   1.759  18.693
    3    HB2  GLN  43           HB2      GLN  43  -7.604   4.421  17.565
    4    HB3  GLN  43           HB3      GLN  43  -8.585   2.953  17.550
    5    HG2  GLN  43           HG2      GLN  43  -8.280   2.832  20.056
    6    HG3  GLN  43           HG3      GLN  43  -7.537   4.428  19.979
    7   HE21  GLN  43          HE21      GLN  43  -9.708   4.535  21.490
    8   HE22  GLN  43          HE22      GLN  43 -11.066   5.126  20.665

  No H/Q in entry =           8
  In of MODEL   67
    1    H    SER  44           H        SER  44  -5.353   3.954  16.272
    2    HA   SER  44           HA       SER  44  -6.083   2.476  13.988
    3    HB2  SER  44           HB2      SER  44  -4.796   4.845  14.423
    4    HB3  SER  44           HB3      SER  44  -3.457   3.832  13.887
    5    HG   SER  44           HG       SER  44  -4.566   4.815  12.128

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ARG  45           H        ARG  45  -3.196   2.331  16.054
    2    HA   ARG  45           HA       ARG  45  -1.746   0.358  14.667
    3    HB2  ARG  45           HB2      ARG  45  -0.879   1.771  16.530
    4    HB3  ARG  45           HB3      ARG  45  -1.875   0.854  17.656
    5    HG2  ARG  45           HG2      ARG  45  -0.671  -1.220  17.010
    6    HG3  ARG  45           HG3      ARG  45   0.350  -0.278  15.926
    7    HD2  ARG  45           HD2      ARG  45   1.111   1.096  17.876
    8    HD3  ARG  45           HD3      ARG  45   0.181   0.033  18.956
    9    HE   ARG  45           HE       ARG  45   1.853  -1.584  17.369
   10   HH21  ARG  45          HH11      ARG  45   3.748  -2.429  18.198
   11   HH22  ARG  45          HH12      ARG  45   4.536  -1.650  19.524
   12   HH11  ARG  45          HH21      ARG  45   2.197   0.881  19.754
   13   HH12  ARG  45          HH22      ARG  45   3.658   0.226  20.403

  No H/Q in entry =          13
  In of MODEL   67
    1    H    MET  46           H        MET  46  -4.135   0.069  17.279
    2    HA   MET  46           HA       MET  46  -3.999  -2.732  17.589
    3    HB2  MET  46           HB2      MET  46  -6.136  -0.696  18.200
    4    HB3  MET  46           HB3      MET  46  -6.371  -2.413  18.536
    5    HG2  MET  46           HG2      MET  46  -4.382  -2.445  19.952
    6    HG3  MET  46           HG3      MET  46  -4.037  -0.769  19.558
    7    HE3  MET  46           HE1      MET  46  -7.862  -2.309  20.807
    8    HE2  MET  46           HE2      MET  46  -6.970  -2.729  22.267
    9    HE1  MET  46           HE3      MET  46  -6.388  -3.279  20.698

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ALA  47           H        ALA  47  -6.005  -0.693  15.502
    2    HA   ALA  47           HA       ALA  47  -7.652  -2.725  14.446
    3    HB3  ALA  47           HB1      ALA  47  -8.307  -0.479  14.031
    4    HB1  ALA  47           HB2      ALA  47  -7.833  -1.120  12.457
    5    HB2  ALA  47           HB3      ALA  47  -6.735  -0.064  13.348

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LEU  48           H        LEU  48  -4.523  -1.456  13.379
    2    HA   LEU  48           HA       LEU  48  -4.273  -3.052  11.038
    3    HB2  LEU  48           HB2      LEU  48  -2.191  -1.798  12.835
    4    HB3  LEU  48           HB3      LEU  48  -1.839  -2.525  11.267
    5    HG   LEU  48           HG       LEU  48  -3.831  -0.282  11.664
    6   HD13  LEU  48          HD11      LEU  48  -1.696   0.568  12.319
    7   HD12  LEU  48          HD12      LEU  48  -1.971   1.123  10.668
    8   HD11  LEU  48          HD13      LEU  48  -0.890  -0.237  10.972
    9   HD22  LEU  48          HD21      LEU  48  -4.325  -1.262   9.591
   10   HD21  LEU  48          HD22      LEU  48  -2.650  -1.719   9.289
   11   HD23  LEU  48          HD23      LEU  48  -3.148  -0.034   9.130

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ASN  49           H        ASN  49  -3.217  -3.460  14.380
    2    HA   ASN  49           HA       ASN  49  -1.646  -5.744  14.044
    3    HB2  ASN  49           HB2      ASN  49  -1.650  -4.403  16.090
    4    HB3  ASN  49           HB3      ASN  49  -3.310  -4.875  16.425
    5   HD21  ASN  49          HD21      ASN  49  -1.285  -5.407  18.308
    6   HD22  ASN  49          HD22      ASN  49  -1.021  -7.081  18.384

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLU  50           H        GLU  50  -5.108  -5.421  14.731
    2    HA   GLU  50           HA       GLU  50  -5.658  -8.213  14.845
    3    HB2  GLU  50           HB2      GLU  50  -7.216  -6.504  15.727
    4    HB3  GLU  50           HB3      GLU  50  -7.510  -5.937  14.081
    5    HG2  GLU  50           HG2      GLU  50  -8.408  -8.121  13.449
    6    HG3  GLU  50           HG3      GLU  50  -8.028  -8.769  15.041

  No H/Q in entry =           6
  In of MODEL   67
    1    H    ALA  51           H        ALA  51  -5.704  -5.817  12.247
    2    HA   ALA  51           HA       ALA  51  -6.723  -7.532  10.231
    3    HB2  ALA  51           HB1      ALA  51  -6.484  -5.724   8.859
    4    HB1  ALA  51           HB2      ALA  51  -4.837  -5.398   9.400
    5    HB3  ALA  51           HB3      ALA  51  -6.209  -4.866  10.374

  No H/Q in entry =           5
  In of MODEL   67
    1    H    HIS  52           H        HIS  52  -3.416  -6.672  11.199
    2    HA   HIS  52           HA       HIS  52  -2.047  -8.183   9.245
    3    HB2  HIS  52           HB2      HIS  52  -0.995  -6.457  10.695
    4    HB3  HIS  52           HB3      HIS  52  -1.150  -7.553  12.067
    5    HD1  HIS  52           HD1      HIS  52   0.318  -9.727  12.037
    6    HD2  HIS  52           HD2      HIS  52   1.082  -7.105   8.887
    7    HE1  HIS  52           HE1      HIS  52   2.495 -10.483  10.987
    8    HE2  HIS  52           HE2      HIS  52   2.974  -8.895   9.066

  No H/Q in entry =           8
  In of MODEL   67
    1    H    LEU  53           H        LEU  53  -3.257  -9.039  12.464
    2    HA   LEU  53           HA       LEU  53  -2.097 -11.601  12.654
    3    HB2  LEU  53           HB2      LEU  53  -4.556 -10.379  13.879
    4    HB3  LEU  53           HB3      LEU  53  -4.126 -12.063  14.169
    5    HG   LEU  53           HG       LEU  53  -2.197  -9.767  14.644
    6   HD11  LEU  53          HD11      LEU  53  -4.013 -11.182  16.621
    7   HD13  LEU  53          HD12      LEU  53  -4.178  -9.510  16.088
    8   HD12  LEU  53          HD13      LEU  53  -2.776  -9.998  17.034
    9   HD22  LEU  53          HD21      LEU  53  -0.907 -11.730  14.602
   10   HD21  LEU  53          HD22      LEU  53  -2.219 -12.719  15.236
   11   HD23  LEU  53          HD23      LEU  53  -1.334 -11.649  16.307

  No H/Q in entry =          11
  In of MODEL   67
    1    H    VAL  54           H        VAL  54  -5.198 -10.526  11.305
    2    HA   VAL  54           HA       VAL  54  -6.155 -13.106  10.624
    3    HB   VAL  54           HB       VAL  54  -6.765 -10.365   9.490
    4   HG12  VAL  54          HG11      VAL  54  -8.891 -11.711   8.689
    5   HG11  VAL  54          HG12      VAL  54  -7.800 -13.094   8.757
    6   HG13  VAL  54          HG13      VAL  54  -7.424 -11.725   7.712
    7   HG22  VAL  54          HG21      VAL  54  -7.662 -10.387  11.646
    8   HG21  VAL  54          HG22      VAL  54  -7.943 -12.126  11.629
    9   HG23  VAL  54          HG23      VAL  54  -9.012 -11.053  10.726

  No H/Q in entry =           9
  In of MODEL   67
    1    H    GLN  55           H        GLN  55  -4.253 -10.686   8.825
    2    HA   GLN  55           HA       GLN  55  -4.157 -12.154   6.408
    3    HB2  GLN  55           HB2      GLN  55  -3.518  -9.899   6.213
    4    HB3  GLN  55           HB3      GLN  55  -2.403  -9.992   7.573
    5    HG2  GLN  55           HG2      GLN  55  -0.705 -10.866   6.290
    6    HG3  GLN  55           HG3      GLN  55  -1.798 -11.825   5.302
    7   HE21  GLN  55          HE21      GLN  55  -1.814 -11.136   3.180
    8   HE22  GLN  55          HE22      GLN  55  -1.593  -9.536   2.668

  No H/Q in entry =           8
  In of MODEL   67
    1    H    THR  56           H        THR  56  -2.038 -12.164   9.279
    2    HA   THR  56           HA       THR  56   0.011 -13.796   8.354
    3    HB   THR  56           HB       THR  56  -1.221 -14.031  11.108
    4    HG1  THR  56           HG1      THR  56   0.113 -11.972   9.850
    5   HG22  THR  56          HG21      THR  56   1.281 -14.321  11.645
    6   HG21  THR  56          HG22      THR  56   1.495 -14.568   9.912
    7   HG23  THR  56          HG23      THR  56   0.471 -15.664  10.840

  No H/Q in entry =           7
  In of MODEL   67
    1    H    LYS  57           H        LYS  57  -3.120 -14.781   9.732
    2    HA   LYS  57           HA       LYS  57  -2.720 -17.584   9.487
    3    HB2  LYS  57           HB2      LYS  57  -4.514 -16.464  10.840
    4    HB3  LYS  57           HB3      LYS  57  -5.306 -16.001   9.340
    5    HG2  LYS  57           HG2      LYS  57  -5.641 -18.332   8.736
    6    HG3  LYS  57           HG3      LYS  57  -4.729 -18.865  10.145
    7    HD2  LYS  57           HD2      LYS  57  -7.005 -19.087  10.787
    8    HD3  LYS  57           HD3      LYS  57  -6.476 -17.587  11.549
    9    HE2  LYS  57           HE2      LYS  57  -7.515 -16.257   9.809
   10    HE3  LYS  57           HE3      LYS  57  -7.883 -17.690   8.851
   11    HZ3  LYS  57           HZ1      LYS  57  -9.693 -18.095  10.046
   12    HZ2  LYS  57           HZ2      LYS  57  -9.526 -16.522  10.667
   13    HZ1  LYS  57           HZ3      LYS  57  -8.896 -17.847  11.524

  No H/Q in entry =          13
  In of MODEL   67
    1    H    LEU  58           H        LEU  58  -4.021 -15.122   7.315
    2    HA   LEU  58           HA       LEU  58  -4.862 -16.936   5.313
    3    HB2  LEU  58           HB2      LEU  58  -4.208 -13.998   5.173
    4    HB3  LEU  58           HB3      LEU  58  -4.892 -14.925   3.836
    5    HG   LEU  58           HG       LEU  58  -6.157 -14.722   6.589
    6   HD11  LEU  58          HD11      LEU  58  -6.441 -13.073   4.098
    7   HD13  LEU  58          HD12      LEU  58  -6.416 -12.564   5.786
    8   HD12  LEU  58          HD13      LEU  58  -7.854 -13.334   5.121
    9   HD22  LEU  58          HD21      LEU  58  -7.154 -16.616   5.726
   10   HD21  LEU  58          HD22      LEU  58  -6.815 -16.171   4.053
   11   HD23  LEU  58          HD23      LEU  58  -8.162 -15.423   4.909

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  59           H        ILE  59  -1.703 -15.776   6.160
    2    HA   ILE  59           HA       ILE  59  -0.629 -16.523   3.519
    3    HB   ILE  59           HB       ILE  59   0.180 -14.469   5.080
    4   HG12  ILE  59          HG12      ILE  59   2.248 -16.153   3.656
    5   HG13  ILE  59          HG13      ILE  59   1.059 -15.213   2.792
    6   HG21  ILE  59          HG21      ILE  59   0.904 -16.262   6.838
    7   HG23  ILE  59          HG22      ILE  59   2.015 -14.960   6.478
    8   HG22  ILE  59          HG23      ILE  59   2.251 -16.553   5.763
    9   HD13  ILE  59          HD11      ILE  59   3.107 -13.907   3.030
   10   HD12  ILE  59          HD12      ILE  59   3.061 -14.133   4.778
   11   HD11  ILE  59          HD13      ILE  59   1.820 -13.167   3.979

  No H/Q in entry =          11
  In of MODEL   67
    1    H    GLU  60           H        GLU  60  -0.643 -17.626   6.888
    2    HA   GLU  60           HA       GLU  60   1.354 -19.637   6.617
    3    HB2  GLU  60           HB2      GLU  60   0.678 -18.896   8.817
    4    HB3  GLU  60           HB3      GLU  60  -0.989 -19.387   8.519
    5    HG2  GLU  60           HG2      GLU  60   1.235 -21.408   8.321
    6    HG3  GLU  60           HG3      GLU  60   0.568 -20.976   9.895

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLY  61           H        GLY  61  -2.160 -19.678   6.146
    2    HA3  GLY  61           HA2      GLY  61  -1.962 -22.475   5.190
    3    HA2  GLY  61           HA3      GLY  61  -3.432 -21.715   5.788

  No H/Q in entry =           3
  In of MODEL   67
    1    H    ASP  62           H        ASP  62  -1.185 -20.178   3.573
    2    HA   ASP  62           HA       ASP  62  -3.209 -19.438   1.750
    3    HB2  ASP  62           HB2      ASP  62  -1.323 -18.685   0.345
    4    HB3  ASP  62           HB3      ASP  62  -1.139 -18.169   2.017

  No H/Q in entry =           4
  In of MODEL   67
    1    H    ALA  63           H        ALA  63  -1.034 -22.235   1.812
    2    HA   ALA  63           HA       ALA  63  -1.272 -23.105  -0.850
    3    HB2  ALA  63           HB1      ALA  63  -0.678 -25.294  -0.046
    4    HB1  ALA  63           HB2      ALA  63  -1.151 -24.862   1.597
    5    HB3  ALA  63           HB3      ALA  63   0.251 -24.092   0.853

  No H/Q in entry =           5
  In of MODEL   67
    1    H    GLY  64           H        GLY  64  -2.484 -25.741   0.499
    2    HA3  GLY  64           HA2      GLY  64  -4.593 -26.688   0.784
    3    HA2  GLY  64           HA3      GLY  64  -5.318 -25.113   0.505

  No H/Q in entry =           3
  In of MODEL   67
    1    H    GLU  65           H        GLU  65  -3.076 -25.820  -1.920
    2    HA   GLU  65           HA       GLU  65  -5.119 -27.104  -3.604
    3    HB2  GLU  65           HB2      GLU  65  -3.660 -24.544  -4.244
    4    HB3  GLU  65           HB3      GLU  65  -4.528 -25.500  -5.444
    5    HG2  GLU  65           HG2      GLU  65  -6.605 -25.268  -4.184
    6    HG3  GLU  65           HG3      GLU  65  -5.761 -24.405  -2.902

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLY  66           H        GLY  66  -4.420 -28.158  -5.410
    2    HA3  GLY  66           HA2      GLY  66  -2.385 -29.885  -5.371
    3    HA2  GLY  66           HA3      GLY  66  -2.995 -29.216  -6.872

  No H/Q in entry =           3
  In of MODEL   67
    1    H    LYS  67           H        LYS  67  -2.048 -26.981  -7.376
    2    HA   LYS  67           HA       LYS  67   0.814 -27.304  -7.491
    3    HB2  LYS  67           HB2      LYS  67  -0.984 -25.193  -8.686
    4    HB3  LYS  67           HB3      LYS  67   0.721 -25.445  -9.082
    5    HG2  LYS  67           HG2      LYS  67  -1.351 -27.641  -9.301
    6    HG3  LYS  67           HG3      LYS  67  -0.949 -26.578 -10.648
    7    HD2  LYS  67           HD2      LYS  67   1.504 -27.278 -10.208
    8    HD3  LYS  67           HD3      LYS  67   0.810 -28.595  -9.260
    9    HE2  LYS  67           HE2      LYS  67  -0.459 -29.379 -11.180
   10    HE3  LYS  67           HE3      LYS  67   0.065 -27.994 -12.137
   11    HZ1  LYS  67           HZ1      LYS  67   2.190 -29.563 -10.951
   12    HZ3  LYS  67           HZ2      LYS  67   2.068 -28.892 -12.506
   13    HZ2  LYS  67           HZ3      LYS  67   1.292 -30.360 -12.147

  No H/Q in entry =          13
  In of MODEL   67
    1    H    MET  68           H        MET  68   2.368 -25.773  -7.026
    2    HA   MET  68           HA       MET  68   2.466 -24.776  -4.473
    3    HB2  MET  68           HB2      MET  68   3.952 -23.912  -6.949
    4    HB3  MET  68           HB3      MET  68   4.368 -23.362  -5.326
    5    HG2  MET  68           HG2      MET  68   4.714 -25.672  -4.598
    6    HG3  MET  68           HG3      MET  68   4.217 -26.268  -6.183
    7    HE1  MET  68           HE1      MET  68   6.451 -24.277  -4.077
    8    HE3  MET  68           HE2      MET  68   6.676 -23.067  -5.338
    9    HE2  MET  68           HE3      MET  68   8.009 -24.133  -4.901

  No H/Q in entry =           9
  In of MODEL   67
    1    H    LYS  69           H        LYS  69   0.509 -23.487  -6.862
    2    HA   LYS  69           HA       LYS  69   0.795 -20.724  -6.470
    3    HB2  LYS  69           HB2      LYS  69  -0.366 -21.685  -8.391
    4    HB3  LYS  69           HB3      LYS  69  -1.696 -22.174  -7.335
    5    HG2  LYS  69           HG2      LYS  69  -2.091 -19.853  -6.692
    6    HG3  LYS  69           HG3      LYS  69  -0.711 -19.326  -7.655
    7    HD2  LYS  69           HD2      LYS  69  -1.820 -20.155  -9.699
    8    HD3  LYS  69           HD3      LYS  69  -3.204 -20.675  -8.734
    9    HE2  LYS  69           HE2      LYS  69  -3.679 -18.487  -9.722
   10    HE3  LYS  69           HE3      LYS  69  -3.520 -18.325  -7.974
   11    HZ2  LYS  69           HZ1      LYS  69  -2.128 -16.931  -9.878
   12    HZ1  LYS  69           HZ2      LYS  69  -1.008 -18.060  -9.282
   13    HZ3  LYS  69           HZ3      LYS  69  -1.786 -16.988  -8.218

  No H/Q in entry =          13
  In of MODEL   67
    1    H    VAL  70           H        VAL  70  -0.382 -19.158  -5.365
    2    HA   VAL  70           HA       VAL  70  -1.858 -20.119  -2.975
    3    HB   VAL  70           HB       VAL  70  -1.037 -18.051  -1.856
    4   HG12  VAL  70          HG11      VAL  70   1.169 -19.764  -3.038
    5   HG11  VAL  70          HG12      VAL  70   0.196 -20.187  -1.628
    6   HG13  VAL  70          HG13      VAL  70   1.284 -18.801  -1.565
    7   HG21  VAL  70          HG21      VAL  70   0.184 -17.620  -4.573
    8   HG23  VAL  70          HG22      VAL  70   1.060 -17.050  -3.155
    9   HG22  VAL  70          HG23      VAL  70  -0.560 -16.446  -3.486

  No H/Q in entry =           9
  In of MODEL   67
    1    H    SER  71           H        SER  71  -3.308 -18.362  -2.087
    2    HA   SER  71           HA       SER  71  -5.288 -17.638  -3.961
    3    HB2  SER  71           HB2      SER  71  -5.644 -17.887  -1.469
    4    HB3  SER  71           HB3      SER  71  -4.790 -16.364  -1.247
    5    HG   SER  71           HG       SER  71  -6.968 -16.584  -3.029

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LEU  72           H        LEU  72  -5.429 -15.999  -5.307
    2    HA   LEU  72           HA       LEU  72  -3.295 -14.220  -5.801
    3    HB2  LEU  72           HB2      LEU  72  -6.166 -14.223  -6.730
    4    HB3  LEU  72           HB3      LEU  72  -4.948 -13.094  -7.318
    5    HG   LEU  72           HG       LEU  72  -4.617 -16.110  -7.443
    6   HD13  LEU  72          HD11      LEU  72  -5.390 -16.061  -9.687
    7   HD12  LEU  72          HD12      LEU  72  -5.330 -14.300  -9.752
    8   HD11  LEU  72          HD13      LEU  72  -6.570 -15.103  -8.790
    9   HD21  LEU  72          HD21      LEU  72  -3.081 -13.733  -8.468
   10   HD23  LEU  72          HD22      LEU  72  -3.023 -15.236  -9.374
   11   HD22  LEU  72          HD23      LEU  72  -2.468 -15.196  -7.704

  No H/Q in entry =          11
  In of MODEL   67
    1    H    VAL  73           H        VAL  73  -6.374 -13.815  -4.155
    2    HA   VAL  73           HA       VAL  73  -6.375 -11.043  -3.805
    3    HB   VAL  73           HB       VAL  73  -8.085 -11.376  -2.205
    4   HG13  VAL  73          HG11      VAL  73  -9.546 -12.955  -3.340
    5   HG12  VAL  73          HG12      VAL  73  -8.163 -13.758  -4.079
    6   HG11  VAL  73          HG13      VAL  73  -8.579 -12.109  -4.548
    7   HG21  VAL  73          HG21      VAL  73  -6.676 -13.990  -1.774
    8   HG23  VAL  73          HG22      VAL  73  -8.403 -13.887  -1.432
    9   HG22  VAL  73          HG23      VAL  73  -7.272 -12.835  -0.582

  No H/Q in entry =           9
  In of MODEL   67
    1    H    LEU  74           H        LEU  74  -4.465 -13.440  -2.230
    2    HA   LEU  74           HA       LEU  74  -4.023 -12.305   0.290
    3    HB2  LEU  74           HB2      LEU  74  -3.277 -14.535  -0.214
    4    HB3  LEU  74           HB3      LEU  74  -2.219 -13.939  -1.492
    5    HG   LEU  74           HG       LEU  74  -0.885 -12.709   0.184
    6   HD12  LEU  74          HD11      LEU  74  -1.370 -13.400   2.626
    7   HD11  LEU  74          HD12      LEU  74  -2.969 -13.862   2.043
    8   HD13  LEU  74          HD13      LEU  74  -2.432 -12.188   1.910
    9   HD22  LEU  74          HD21      LEU  74   0.298 -14.574   0.817
   10   HD21  LEU  74          HD22      LEU  74  -0.742 -15.260  -0.410
   11   HD23  LEU  74          HD23      LEU  74  -1.151 -15.468   1.276

  No H/Q in entry =          11
  In of MODEL   67
    1    H    VAL  75           H        VAL  75  -2.143 -11.941  -2.678
    2    HA   VAL  75           HA       VAL  75  -0.310 -10.044  -1.677
    3    HB   VAL  75           HB       VAL  75  -1.288 -10.516  -4.495
    4   HG11  VAL  75          HG11      VAL  75   1.001  -8.811  -3.420
    5   HG13  VAL  75          HG12      VAL  75  -0.398  -8.245  -4.321
    6   HG12  VAL  75          HG13      VAL  75   0.804  -9.252  -5.113
    7   HG23  VAL  75          HG21      VAL  75   0.969 -11.618  -4.659
    8   HG22  VAL  75          HG22      VAL  75  -0.120 -12.424  -3.529
    9   HG21  VAL  75          HG23      VAL  75   1.165 -11.379  -2.923

  No H/Q in entry =           9
  In of MODEL   67
    1    H    GLU  76           H        GLU  76  -3.464  -9.649  -3.319
    2    HA   GLU  76           HA       GLU  76  -3.473  -6.835  -3.420
    3    HB2  GLU  76           HB2      GLU  76  -5.158  -8.300  -4.555
    4    HB3  GLU  76           HB3      GLU  76  -5.837  -8.697  -2.985
    5    HG2  GLU  76           HG2      GLU  76  -6.436  -6.340  -2.619
    6    HG3  GLU  76           HG3      GLU  76  -5.735  -5.892  -4.161

  No H/Q in entry =           6
  In of MODEL   67
    1    H    ALA  77           H        ALA  77  -4.604  -9.045  -0.874
    2    HA   ALA  77           HA       ALA  77  -5.520  -7.028   0.889
    3    HB3  ALA  77           HB1      ALA  77  -5.416  -8.763   2.622
    4    HB1  ALA  77           HB2      ALA  77  -4.452  -9.784   1.555
    5    HB2  ALA  77           HB3      ALA  77  -6.123  -9.405   1.140

  No H/Q in entry =           5
  In of MODEL   67
    1    H    GLN  78           H        GLN  78  -2.399  -8.626   0.508
    2    HA   GLN  78           HA       GLN  78  -1.111  -7.485   2.751
    3    HB2  GLN  78           HB2      GLN  78  -0.287  -9.439   1.392
    4    HB3  GLN  78           HB3      GLN  78   0.159  -8.301   0.123
    5    HG2  GLN  78           HG2      GLN  78   1.650  -7.130   1.689
    6    HG3  GLN  78           HG3      GLN  78   1.200  -8.254   2.969
    7   HE21  GLN  78          HE21      GLN  78   3.923  -8.037   2.116
    8   HE22  GLN  78          HE22      GLN  78   4.356  -9.482   1.336

  No H/Q in entry =           8
  In of MODEL   67
    1    H    LEU  79           H        LEU  79  -1.479  -6.419  -0.594
    2    HA   LEU  79           HA       LEU  79   0.242  -4.219  -0.590
    3    HB2  LEU  79           HB2      LEU  79  -0.809  -5.010  -2.638
    4    HB3  LEU  79           HB3      LEU  79  -2.402  -4.592  -2.021
    5    HG   LEU  79           HG       LEU  79  -1.820  -2.214  -1.999
    6   HD13  LEU  79          HD11      LEU  79   0.427  -2.007  -1.499
    7   HD12  LEU  79          HD12      LEU  79   0.471  -1.721  -3.238
    8   HD11  LEU  79          HD13      LEU  79   0.903  -3.305  -2.594
    9   HD23  LEU  79          HD21      LEU  79  -1.196  -2.026  -4.555
   10   HD22  LEU  79          HD22      LEU  79  -2.732  -2.749  -4.087
   11   HD21  LEU  79          HD23      LEU  79  -1.378  -3.780  -4.539

  No H/Q in entry =          11
  In of MODEL   67
    1    H    HIS  80           H        HIS  80  -3.222  -4.325   0.255
    2    HA   HIS  80           HA       HIS  80  -3.365  -1.566   0.919
    3    HB2  HIS  80           HB2      HIS  80  -5.104  -3.946   1.247
    4    HB3  HIS  80           HB3      HIS  80  -5.396  -2.601   2.353
    5    HD1  HIS  80           HD1      HIS  80  -6.991  -0.937   1.454
    6    HD2  HIS  80           HD2      HIS  80  -4.845  -2.786  -1.606
    7    HE1  HIS  80           HE1      HIS  80  -7.826   0.073  -0.721
    8    HE2  HIS  80           HE2      HIS  80  -6.525  -1.048  -2.595

  No H/Q in entry =           8
  In of MODEL   67
    1    H    LEU  81           H        LEU  81  -2.913  -4.468   2.910
    2    HA   LEU  81           HA       LEU  81  -2.865  -3.121   5.394
    3    HB2  LEU  81           HB2      LEU  81  -1.695  -5.757   4.508
    4    HB3  LEU  81           HB3      LEU  81  -1.650  -5.199   6.182
    5    HG   LEU  81           HG       LEU  81  -4.209  -5.409   4.568
    6   HD12  LEU  81          HD11      LEU  81  -4.538  -7.468   6.117
    7   HD11  LEU  81          HD12      LEU  81  -2.784  -7.427   6.294
    8   HD13  LEU  81          HD13      LEU  81  -3.505  -7.646   4.699
    9   HD23  LEU  81          HD21      LEU  81  -5.042  -5.597   7.073
   10   HD22  LEU  81          HD22      LEU  81  -4.694  -4.014   6.381
   11   HD21  LEU  81          HD23      LEU  81  -3.514  -4.794   7.435

  No H/Q in entry =          11
  In of MODEL   67
    1    H    MET  82           H        MET  82  -0.211  -4.070   3.209
    2    HA   MET  82           HA       MET  82   1.896  -3.211   4.881
    3    HB2  MET  82           HB2      MET  82   1.659  -3.550   1.890
    4    HB3  MET  82           HB3      MET  82   3.155  -3.004   2.645
    5    HG2  MET  82           HG2      MET  82   1.707  -5.569   3.378
    6    HG3  MET  82           HG3      MET  82   3.075  -5.483   2.270
    7    HE3  MET  82           HE1      MET  82   6.113  -4.799   4.237
    8    HE2  MET  82           HE2      MET  82   5.211  -3.416   3.623
    9    HE1  MET  82           HE3      MET  82   5.268  -4.907   2.688

  No H/Q in entry =           9
  In of MODEL   67
    1    H    THR  83           H        THR  83   0.089  -1.538   2.333
    2    HA   THR  83           HA       THR  83   1.544   0.885   2.411
    3    HB   THR  83           HB       THR  83  -0.622   1.847   1.437
    4    HG1  THR  83           HG1      THR  83  -2.295   0.579   1.339
    5   HG22  THR  83          HG21      THR  83  -0.394   0.025  -0.565
    6   HG21  THR  83          HG22      THR  83   1.106  -0.294   0.304
    7   HG23  THR  83          HG23      THR  83   0.770   1.325  -0.310

  No H/Q in entry =           7
  In of MODEL   67
    1    H    SER  84           H        SER  84  -1.471  -0.094   4.029
    2    HA   SER  84           HA       SER  84  -1.917   2.344   5.376
    3    HB2  SER  84           HB2      SER  84  -2.797  -0.478   5.946
    4    HB3  SER  84           HB3      SER  84  -3.260   0.872   6.981
    5    HG   SER  84           HG       SER  84  -3.740   0.565   4.192

  No H/Q in entry =           5
  In of MODEL   67
    1    H    MET  85           H        MET  85  -0.253  -0.617   6.497
    2    HA   MET  85           HA       MET  85   0.298   0.301   9.098
    3    HB2  MET  85           HB2      MET  85   0.544  -2.048   8.417
    4    HB3  MET  85           HB3      MET  85   1.932  -1.608   7.419
    5    HG2  MET  85           HG2      MET  85   3.137  -0.812   9.405
    6    HG3  MET  85           HG3      MET  85   1.739  -1.178  10.415
    7    HE2  MET  85           HE1      MET  85   4.769  -3.855   8.435
    8    HE1  MET  85           HE2      MET  85   4.192  -2.265   7.941
    9    HE3  MET  85           HE3      MET  85   3.327  -3.708   7.424

  No H/Q in entry =           9
  In of MODEL   67
    1    H    LEU  86           H        LEU  86   2.220   0.521   6.136
    2    HA   LEU  86           HA       LEU  86   4.464   1.792   7.278
    3    HB2  LEU  86           HB2      LEU  86   4.240   0.712   4.971
    4    HB3  LEU  86           HB3      LEU  86   3.456   2.208   4.462
    5    HG   LEU  86           HG       LEU  86   5.512   3.418   5.431
    6   HD11  LEU  86          HD11      LEU  86   6.174   0.794   6.228
    7   HD13  LEU  86          HD12      LEU  86   7.204   2.221   6.319
    8   HD12  LEU  86          HD13      LEU  86   7.286   1.170   4.907
    9   HD23  LEU  86          HD21      LEU  86   6.183   1.641   3.077
   10   HD22  LEU  86          HD22      LEU  86   6.609   3.331   3.336
   11   HD21  LEU  86          HD23      LEU  86   4.946   2.893   2.947

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ALA  87           H        ALA  87   1.566   3.087   5.709
    2    HA   ALA  87           HA       ALA  87   2.210   5.806   5.788
    3    HB1  ALA  87           HB1      ALA  87  -0.132   4.220   5.261
    4    HB3  ALA  87           HB2      ALA  87   0.206   5.875   4.758
    5    HB2  ALA  87           HB3      ALA  87  -0.585   5.569   6.306

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ARG  88           H        ARG  88   0.497   3.837   8.189
    2    HA   ARG  88           HA       ARG  88   0.033   5.896  10.037
    3    HB2  ARG  88           HB2      ARG  88  -0.947   3.561  10.111
    4    HB3  ARG  88           HB3      ARG  88   0.588   3.034  10.808
    5    HG2  ARG  88           HG2      ARG  88   0.158   5.117  12.430
    6    HG3  ARG  88           HG3      ARG  88  -1.516   4.822  11.983
    7    HD2  ARG  88           HD2      ARG  88  -1.650   2.976  13.231
    8    HD3  ARG  88           HD3      ARG  88  -0.074   2.365  12.692
    9    HE   ARG  88           HE       ARG  88  -0.571   3.639  15.148
   10   HH21  ARG  88          HH11      ARG  88   1.012   4.624  16.377
   11   HH22  ARG  88          HH12      ARG  88   2.535   5.022  15.663
   12   HH11  ARG  88          HH21      ARG  88   1.698   3.778  12.558
   13   HH12  ARG  88          HH22      ARG  88   2.931   4.527  13.513

  No H/Q in entry =          13
  In of MODEL   67
    1    H    GLU  89           H        GLU  89   2.788   3.627   9.800
    2    HA   GLU  89           HA       GLU  89   4.079   4.495  12.136
    3    HB2  GLU  89           HB2      GLU  89   4.694   2.464  10.790
    4    HB3  GLU  89           HB3      GLU  89   5.482   3.544   9.638
    5    HG2  GLU  89           HG2      GLU  89   6.992   4.365  11.373
    6    HG3  GLU  89           HG3      GLU  89   6.147   3.424  12.599

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LEU  90           H        LEU  90   4.397   5.645   8.806
    2    HA   LEU  90           HA       LEU  90   6.366   7.611   9.379
    3    HB2  LEU  90           HB2      LEU  90   4.342   7.313   7.163
    4    HB3  LEU  90           HB3      LEU  90   5.594   8.562   7.176
    5    HG   LEU  90           HG       LEU  90   6.219   5.615   7.509
    6   HD12  LEU  90          HD11      LEU  90   6.957   5.833   5.064
    7   HD11  LEU  90          HD12      LEU  90   5.967   7.292   5.021
    8   HD13  LEU  90          HD13      LEU  90   5.222   5.732   5.369
    9   HD22  LEU  90          HD21      LEU  90   8.139   6.732   8.179
   10   HD21  LEU  90          HD22      LEU  90   7.808   8.142   7.173
   11   HD23  LEU  90          HD23      LEU  90   8.438   6.665   6.443

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  91           H        ILE  91   2.827   7.688   9.250
    2    HA   ILE  91           HA       ILE  91   2.534  10.466   9.700
    3    HB   ILE  91           HB       ILE  91   0.706   8.122  10.255
    4   HG12  ILE  91          HG12      ILE  91   0.486  10.406   8.269
    5   HG13  ILE  91          HG13      ILE  91   1.318   8.897   7.894
    6   HG22  ILE  91          HG21      ILE  91  -0.991  10.209  10.326
    7   HG21  ILE  91          HG22      ILE  91   0.428  11.016  10.990
    8   HG23  ILE  91          HG23      ILE  91  -0.228   9.590  11.791
    9   HD13  ILE  91          HD11      ILE  91  -0.647   7.642   7.950
   10   HD12  ILE  91          HD12      ILE  91  -1.215   9.167   7.270
   11   HD11  ILE  91          HD13      ILE  91  -1.482   8.809   8.976

  No H/Q in entry =          11
  In of MODEL   67
    1    H    THR  92           H        THR  92   2.904   7.720  11.901
    2    HA   THR  92           HA       THR  92   2.497   9.103  14.326
    3    HB   THR  92           HB       THR  92   4.262   6.738  13.654
    4    HG1  THR  92           HG1      THR  92   2.281   6.013  13.565
    5   HG22  THR  92          HG21      THR  92   3.889   6.462  16.290
    6   HG21  THR  92          HG22      THR  92   3.853   8.222  16.215
    7   HG23  THR  92          HG23      THR  92   5.268   7.342  15.635

  No H/Q in entry =           7
  In of MODEL   67
    1    H    GLU  93           H        GLU  93   5.429   8.604  12.377
    2    HA   GLU  93           HA       GLU  93   7.215  10.003  14.063
    3    HB2  GLU  93           HB2      GLU  93   7.282   9.684  11.048
    4    HB3  GLU  93           HB3      GLU  93   8.637  10.194  12.055
    5    HG2  GLU  93           HG2      GLU  93   7.187   7.581  12.512
    6    HG3  GLU  93           HG3      GLU  93   8.567   7.709  11.429

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LEU  94           H        LEU  94   5.169  11.049  11.361
    2    HA   LEU  94           HA       LEU  94   6.016  13.739  11.253
    3    HB2  LEU  94           HB2      LEU  94   3.401  12.415  10.514
    4    HB3  LEU  94           HB3      LEU  94   3.685  14.138  10.270
    5    HG   LEU  94           HG       LEU  94   5.665  12.117   9.211
    6   HD11  LEU  94          HD11      LEU  94   2.927  12.710   8.163
    7   HD13  LEU  94          HD12      LEU  94   3.886  11.238   8.034
    8   HD12  LEU  94          HD13      LEU  94   4.237  12.612   6.986
    9   HD23  LEU  94          HD21      LEU  94   5.935  13.947   7.485
   10   HD22  LEU  94          HD22      LEU  94   6.366  14.435   9.124
   11   HD21  LEU  94          HD23      LEU  94   4.819  14.927   8.434

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  95           H        ILE  95   3.463  12.164  13.159
    2    HA   ILE  95           HA       ILE  95   2.464  14.531  14.357
    3    HB   ILE  95           HB       ILE  95   2.441  11.650  15.285
    4   HG12  ILE  95          HG12      ILE  95   0.242  13.457  14.245
    5   HG13  ILE  95          HG13      ILE  95   1.177  12.382  13.210
    6   HG21  ILE  95          HG21      ILE  95   1.203  14.143  16.491
    7   HG23  ILE  95          HG22      ILE  95   2.237  12.959  17.291
    8   HG22  ILE  95          HG23      ILE  95   0.593  12.523  16.825
    9   HD13  ILE  95          HD11      ILE  95   0.249  10.458  14.136
   10   HD12  ILE  95          HD12      ILE  95  -1.116  11.569  14.218
   11   HD11  ILE  95          HD13      ILE  95  -0.148  11.257  15.658

  No H/Q in entry =          11
  In of MODEL   67
    1    H    GLU  96           H        GLU  96   5.030  12.274  15.342
    2    HA   GLU  96           HA       GLU  96   5.616  13.467  17.830
    3    HB2  GLU  96           HB2      GLU  96   6.528  11.293  17.180
    4    HB3  GLU  96           HB3      GLU  96   7.466  12.051  15.894
    5    HG2  GLU  96           HG2      GLU  96   9.130  12.576  17.347
    6    HG3  GLU  96           HG3      GLU  96   8.001  13.407  18.407

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LEU  97           H        LEU  97   6.685  14.219  14.537
    2    HA   LEU  97           HA       LEU  97   8.604  16.188  15.237
    3    HB2  LEU  97           HB2      LEU  97   6.991  15.660  12.751
    4    HB3  LEU  97           HB3      LEU  97   8.032  17.076  12.866
    5    HG   LEU  97           HG       LEU  97   9.023  14.264  13.424
    6   HD12  LEU  97          HD11      LEU  97  10.011  14.441  11.101
    7   HD11  LEU  97          HD12      LEU  97   8.978  15.847  10.842
    8   HD13  LEU  97          HD13      LEU  97   8.258  14.266  11.142
    9   HD23  LEU  97          HD21      LEU  97  11.207  15.511  12.668
   10   HD22  LEU  97          HD22      LEU  97  10.600  15.791  14.300
   11   HD21  LEU  97          HD23      LEU  97  10.297  16.977  13.032

  No H/Q in entry =          11
  In of MODEL   67
    1    H    HIS  98           H        HIS  98   5.111  16.373  14.600
    2    HA   HIS  98           HA       HIS  98   4.853  19.177  14.734
    3    HB2  HIS  98           HB2      HIS  98   2.934  16.955  15.472
    4    HB3  HIS  98           HB3      HIS  98   2.492  18.662  15.528
    5    HD1  HIS  98           HD1      HIS  98   3.462  15.930  13.121
    6    HD2  HIS  98           HD2      HIS  98   2.142  19.882  13.002
    7    HE1  HIS  98           HE1      HIS  98   2.898  16.424  10.700
    8    HE2  HIS  98           HE2      HIS  98   2.097  18.825  10.606

  No H/Q in entry =           8
  In of MODEL   67
    1    H    GLU  99           H        GLU  99   4.963  16.690  17.235
    2    HA   GLU  99           HA       GLU  99   4.390  18.395  19.434
    3    HB2  GLU  99           HB2      GLU  99   4.267  15.914  19.534
    4    HB3  GLU  99           HB3      GLU  99   6.025  15.844  19.417
    5    HG2  GLU  99           HG2      GLU  99   6.243  17.136  21.489
    6    HG3  GLU  99           HG3      GLU  99   4.493  17.302  21.593

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LYS 100           H        LYS 100   7.423  17.419  17.855
    2    HA   LYS 100           HA       LYS 100   9.107  18.798  19.702
    3    HB2  LYS 100           HB2      LYS 100   9.578  17.863  16.861
    4    HB3  LYS 100           HB3      LYS 100  10.824  18.616  17.862
    5    HG2  LYS 100           HG2      LYS 100  10.431  16.873  19.607
    6    HG3  LYS 100           HG3      LYS 100   9.283  16.085  18.523
    7    HD2  LYS 100           HD2      LYS 100  11.064  15.775  16.847
    8    HD3  LYS 100           HD3      LYS 100  12.218  16.575  17.917
    9    HE2  LYS 100           HE2      LYS 100  11.805  14.827  19.639
   10    HE3  LYS 100           HE3      LYS 100  10.713  14.006  18.520
   11    HZ1  LYS 100           HZ1      LYS 100  13.539  14.634  17.849
   12    HZ3  LYS 100           HZ2      LYS 100  12.476  13.594  17.028
   13    HZ2  LYS 100           HZ3      LYS 100  13.066  13.168  18.563

  No H/Q in entry =          13
  In of MODEL   67
    1    H    LEU 101           H        LEU 101   7.412  19.746  16.754
    2    HA   LEU 101           HA       LEU 101   8.660  22.285  16.410
    3    HB2  LEU 101           HB2      LEU 101   6.043  21.088  15.538
    4    HB3  LEU 101           HB3      LEU 101   6.318  22.815  15.327
    5    HG   LEU 101           HG       LEU 101   8.320  20.768  14.353
    6   HD12  LEU 101          HD11      LEU 101   7.162  21.289  12.073
    7   HD11  LEU 101          HD12      LEU 101   5.774  21.740  13.061
    8   HD13  LEU 101          HD13      LEU 101   6.415  20.100  13.141
    9   HD21  LEU 101          HD21      LEU 101   7.731  23.689  13.798
   10   HD23  LEU 101          HD22      LEU 101   8.692  22.714  12.687
   11   HD22  LEU 101          HD23      LEU 101   9.246  22.965  14.342

  No H/Q in entry =          11
  In of MODEL   67
    1    H    LYS 102           H        LYS 102   7.120  21.172  19.034
    2    HA   LYS 102           HA       LYS 102   6.514  22.274  20.969
    3    HB2  LYS 102           HB2      LYS 102   7.819  24.244  19.836
    4    HB3  LYS 102           HB3      LYS 102   6.227  24.872  19.468
    5    HG2  LYS 102           HG2      LYS 102   7.614  24.599  22.113
    6    HG3  LYS 102           HG3      LYS 102   6.678  25.940  21.488
    7    HD2  LYS 102           HD2      LYS 102   5.400  23.323  22.375
    8    HD3  LYS 102           HD3      LYS 102   5.674  24.682  23.456
    9    HE2  LYS 102           HE2      LYS 102   3.382  24.311  21.979
   10    HE3  LYS 102           HE3      LYS 102   3.911  25.850  22.657
   11    HZ2  LYS 102           HZ1      LYS 102   3.370  25.963  20.280
   12    HZ1  LYS 102           HZ2      LYS 102   4.613  24.862  19.952
   13    HZ3  LYS 102           HZ3      LYS 102   4.982  26.388  20.591

  No H/Q in entry =          13
  In of MODEL   67
    1    H    ALA 103           H        ALA 103   4.884  23.838  18.208
    2    HA   ALA 103           HA       ALA 103   2.444  24.452  19.105
    3    HB1  ALA 103           HB1      ALA 103   1.521  23.621  16.869
    4    HB2  ALA 103           HB2      ALA 103   3.159  23.060  16.531
    5    HB3  ALA 103           HB3      ALA 103   2.851  24.777  16.797

  No H/Q in entry =           5
  In of MODEL   67
    1    H1   ALA   1           H3       ALA   1  10.256 -20.192  -6.171
    2    H2   ALA   1           H2       ALA   1   9.281 -20.385  -7.552
    3    H3   ALA   1           H1       ALA   1   8.840 -21.123  -6.086
    4    HA   ALA   1           HA       ALA   1   9.848 -22.948  -6.829
    5    HB1  ALA   1           HB1      ALA   1   9.937 -22.592  -9.105
    6    HB2  ALA   1           HB2      ALA   1  11.668 -22.468  -8.786
    7    HB3  ALA   1           HB3      ALA   1  10.691 -21.006  -8.933

  No H/Q in entry =           7
  In of MODEL   67
    1    H    GLU   2           H        GLU   2  12.117 -23.934  -6.898
    2    HA   GLU   2           HA       GLU   2  13.511 -23.872  -4.694
    3    HB2  GLU   2           HB2      GLU   2  14.855 -23.763  -7.400
    4    HB3  GLU   2           HB3      GLU   2  15.581 -24.384  -5.919
    5    HG2  GLU   2           HG2      GLU   2  14.532 -26.385  -6.152
    6    HG3  GLU   2           HG3      GLU   2  12.971 -25.616  -6.403

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLU   3           H        GLU   3  15.298 -22.037  -7.107
    2    HA   GLU   3           HA       GLU   3  16.488 -20.366  -5.155
    3    HB2  GLU   3           HB2      GLU   3  16.416 -20.365  -8.164
    4    HB3  GLU   3           HB3      GLU   3  17.187 -19.047  -7.282
    5    HG2  GLU   3           HG2      GLU   3  18.833 -20.447  -6.368
    6    HG3  GLU   3           HG3      GLU   3  17.863 -21.899  -6.582

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LEU   4           H        LEU   4  14.205 -19.485  -7.774
    2    HA   LEU   4           HA       LEU   4  13.783 -16.869  -7.162
    3    HB2  LEU   4           HB2      LEU   4  11.573 -18.809  -7.879
    4    HB3  LEU   4           HB3      LEU   4  11.524 -17.060  -8.078
    5    HG   LEU   4           HG       LEU   4  13.452 -18.955  -9.460
    6   HD13  LEU   4          HD11      LEU   4  12.142 -18.787 -11.363
    7   HD12  LEU   4          HD12      LEU   4  11.461 -17.231 -10.893
    8   HD11  LEU   4          HD13      LEU   4  10.888 -18.712 -10.128
    9   HD23  LEU   4          HD21      LEU   4  13.816 -16.716 -10.816
   10   HD22  LEU   4          HD22      LEU   4  14.680 -16.971  -9.301
   11   HD21  LEU   4          HD23      LEU   4  13.243 -15.952  -9.333

  No H/Q in entry =          11
  In of MODEL   67
    1    H    GLU   5           H        GLU   5  12.263 -19.628  -5.509
    2    HA   GLU   5           HA       GLU   5  10.620 -18.029  -3.798
    3    HB2  GLU   5           HB2      GLU   5  10.178 -20.414  -4.329
    4    HB3  GLU   5           HB3      GLU   5  11.588 -20.853  -3.362
    5    HG2  GLU   5           HG2      GLU   5   9.663 -21.053  -1.932
    6    HG3  GLU   5           HG3      GLU   5  10.541 -19.608  -1.433

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLU   6           H        GLU   6  13.744 -19.657  -3.372
    2    HA   GLU   6           HA       GLU   6  14.125 -18.804  -0.676
    3    HB2  GLU   6           HB2      GLU   6  16.061 -19.769  -2.793
    4    HB3  GLU   6           HB3      GLU   6  16.520 -19.439  -1.121
    5    HG2  GLU   6           HG2      GLU   6  14.350 -21.385  -1.954
    6    HG3  GLU   6           HG3      GLU   6  15.996 -21.848  -1.519

  No H/Q in entry =           6
  In of MODEL   67
    1    H    VAL   7           H        VAL   7  14.894 -17.492  -3.831
    2    HA   VAL   7           HA       VAL   7  16.617 -15.391  -2.978
    3    HB   VAL   7           HB       VAL   7  14.892 -15.730  -5.445
    4   HG11  VAL   7          HG11      VAL   7  16.823 -13.545  -4.645
    5   HG13  VAL   7          HG12      VAL   7  15.180 -13.378  -5.260
    6   HG12  VAL   7          HG13      VAL   7  16.475 -13.902  -6.337
    7   HG21  VAL   7          HG21      VAL   7  16.979 -17.218  -4.887
    8   HG23  VAL   7          HG22      VAL   7  17.904 -15.771  -5.291
    9   HG22  VAL   7          HG23      VAL   7  16.850 -16.506  -6.496

  No H/Q in entry =           9
  In of MODEL   67
    1    H    VAL   8           H        VAL   8  13.117 -15.608  -3.515
    2    HA   VAL   8           HA       VAL   8  12.495 -12.890  -3.042
    3    HB   VAL   8           HB       VAL   8  10.849 -15.394  -2.598
    4   HG12  VAL   8          HG11      VAL   8   8.969 -13.555  -2.842
    5   HG11  VAL   8          HG12      VAL   8  10.233 -12.473  -2.257
    6   HG13  VAL   8          HG13      VAL   8   9.724 -13.844  -1.275
    7   HG22  VAL   8          HG21      VAL   8  10.227 -15.226  -4.815
    8   HG21  VAL   8          HG22      VAL   8  11.735 -14.329  -4.969
    9   HG23  VAL   8          HG23      VAL   8  10.214 -13.464  -4.776

  No H/Q in entry =           9
  In of MODEL   67
    1    H    MET   9           H        MET   9  12.732 -15.697  -0.861
    2    HA   MET   9           HA       MET   9  11.949 -14.412   1.513
    3    HB2  MET   9           HB2      MET   9  13.944 -16.649   1.072
    4    HB3  MET   9           HB3      MET   9  13.366 -16.140   2.658
    5    HG2  MET   9           HG2      MET   9  11.063 -16.666   2.027
    6    HG3  MET   9           HG3      MET   9  11.587 -17.090   0.397
    7    HE3  MET   9           HE1      MET   9  13.418 -18.057   3.952
    8    HE2  MET   9           HE2      MET   9  12.217 -19.290   4.327
    9    HE1  MET   9           HE3      MET   9  11.704 -17.630   4.038

  No H/Q in entry =           9
  In of MODEL   67
    1    H    GLY  10           H        GLY  10  15.118 -14.684  -0.061
    2    HA3  GLY  10           HA2      GLY  10  16.608 -13.283   1.899
    3    HA2  GLY  10           HA3      GLY  10  17.059 -13.456   0.204

  No H/Q in entry =           3
  In of MODEL   67
    1    H    LEU  11           H        LEU  11  14.902 -12.205  -1.025
    2    HA   LEU  11           HA       LEU  11  15.627  -9.470  -0.868
    3    HB2  LEU  11           HB2      LEU  11  13.233 -10.847  -2.089
    4    HB3  LEU  11           HB3      LEU  11  13.537  -9.117  -2.251
    5    HG   LEU  11           HG       LEU  11  15.530 -11.254  -3.048
    6   HD13  LEU  11          HD11      LEU  11  13.771 -11.598  -4.559
    7   HD12  LEU  11          HD12      LEU  11  14.785 -10.431  -5.405
    8   HD11  LEU  11          HD13      LEU  11  13.324  -9.892  -4.579
    9   HD22  LEU  11          HD21      LEU  11  16.790  -9.308  -2.831
   10   HD21  LEU  11          HD22      LEU  11  15.428  -8.253  -3.203
   11   HD23  LEU  11          HD23      LEU  11  16.239  -9.134  -4.496

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  12           H        ILE  12  12.840 -11.256   0.416
    2    HA   ILE  12           HA       ILE  12  11.483  -9.013   1.482
    3    HB   ILE  12           HB       ILE  12  11.486 -11.893   2.438
    4   HG12  ILE  12          HG12      ILE  12  10.802 -11.264  -0.012
    5   HG13  ILE  12          HG13      ILE  12   9.762 -12.334   0.908
    6   HG23  ILE  12          HG21      ILE  12  10.515 -10.626   4.195
    7   HG22  ILE  12          HG22      ILE  12   9.133 -11.186   3.254
    8   HG21  ILE  12          HG23      ILE  12   9.712  -9.531   3.072
    9   HD12  ILE  12          HD11      ILE  12   8.553 -10.521  -0.338
   10   HD11  ILE  12          HD12      ILE  12   9.378  -9.339   0.675
   11   HD13  ILE  12          HD13      ILE  12   8.269 -10.487   1.393

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  13           H        ILE  13  13.854 -11.248   2.876
    2    HA   ILE  13           HA       ILE  13  13.919 -10.067   5.455
    3    HB   ILE  13           HB       ILE  13  15.941 -11.674   3.877
    4   HG12  ILE  13          HG12      ILE  13  13.657 -12.593   4.766
    5   HG13  ILE  13          HG13      ILE  13  15.121 -13.544   4.997
    6   HG23  ILE  13          HG21      ILE  13  17.400 -10.651   5.358
    7   HG22  ILE  13          HG22      ILE  13  16.884 -12.016   6.339
    8   HG21  ILE  13          HG23      ILE  13  16.169 -10.426   6.598
    9   HD12  ILE  13          HD11      ILE  13  13.621 -13.312   7.064
   10   HD11  ILE  13          HD12      ILE  13  14.083 -11.614   7.083
   11   HD13  ILE  13          HD13      ILE  13  15.308 -12.859   7.290

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ASN  14           H        ASN  14  15.863  -9.564   2.526
    2    HA   ASN  14           HA       ASN  14  17.637  -7.643   3.577
    3    HB2  ASN  14           HB2      ASN  14  17.587  -8.911   1.262
    4    HB3  ASN  14           HB3      ASN  14  16.708  -7.484   0.729
    5   HD21  ASN  14          HD21      ASN  14  19.138  -7.854  -0.469
    6   HD22  ASN  14          HD22      ASN  14  20.298  -6.784   0.151

  No H/Q in entry =           6
  In of MODEL   67
    1    H    SER  15           H        SER  15  14.522  -7.260   1.900
    2    HA   SER  15           HA       SER  15  14.444  -4.438   1.955
    3    HB2  SER  15           HB2      SER  15  12.104  -4.658   1.475
    4    HB3  SER  15           HB3      SER  15  12.882  -6.030   0.696
    5    HG   SER  15           HG       SER  15  12.187  -7.348   2.301

  No H/Q in entry =           5
  In of MODEL   67
    1    H    GLY  16           H        GLY  16  13.333  -6.883   4.267
    2    HA3  GLY  16           HA2      GLY  16  12.142  -5.119   6.129
    3    HA2  GLY  16           HA3      GLY  16  12.740  -6.734   6.489

  No H/Q in entry =           3
  In of MODEL   67
    1    H    GLN  17           H        GLN  17  15.452  -6.432   5.882
    2    HA   GLN  17           HA       GLN  17  16.435  -5.220   8.257
    3    HB2  GLN  17           HB2      GLN  17  17.661  -7.016   7.109
    4    HB3  GLN  17           HB3      GLN  17  17.918  -5.965   5.717
    5    HG2  GLN  17           HG2      GLN  17  19.226  -4.418   7.071
    6    HG3  GLN  17           HG3      GLN  17  18.889  -5.359   8.523
    7   HE21  GLN  17          HE21      GLN  17  21.577  -4.915   7.693
    8   HE22  GLN  17          HE22      GLN  17  22.235  -6.390   7.173

  No H/Q in entry =           8
  In of MODEL   67
    1    H    ALA  18           H        ALA  18  16.241  -4.143   4.897
    2    HA   ALA  18           HA       ALA  18  17.705  -1.767   5.115
    3    HB1  ALA  18           HB1      ALA  18  16.563  -2.971   3.054
    4    HB3  ALA  18           HB2      ALA  18  16.847  -1.230   3.035
    5    HB2  ALA  18           HB3      ALA  18  15.242  -1.858   3.414

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ARG  19           H        ARG  19  14.200  -2.315   5.529
    2    HA   ARG  19           HA       ARG  19  13.565   0.342   6.245
    3    HB2  ARG  19           HB2      ARG  19  11.862  -1.391   5.669
    4    HB3  ARG  19           HB3      ARG  19  12.203  -2.191   7.205
    5    HG2  ARG  19           HG2      ARG  19  11.521  -0.191   8.446
    6    HG3  ARG  19           HG3      ARG  19  11.273   0.686   6.938
    7    HD2  ARG  19           HD2      ARG  19   9.127  -0.086   7.769
    8    HD3  ARG  19           HD3      ARG  19   9.528  -0.971   6.292
    9    HE   ARG  19           HE       ARG  19  10.481  -2.522   8.394
   10   HH21  ARG  19          HH11      ARG  19   9.218  -4.148   9.340
   11   HH22  ARG  19          HH12      ARG  19   7.498  -4.101   9.178
   12   HH11  ARG  19          HH21      ARG  19   7.495  -1.198   7.312
   13   HH12  ARG  19          HH22      ARG  19   6.523  -2.431   8.026

  No H/Q in entry =          13
  In of MODEL   67
    1    H    SER  20           H        SER  20  14.402  -2.496   8.203
    2    HA   SER  20           HA       SER  20  14.143  -1.391  10.741
    3    HB2  SER  20           HB2      SER  20  14.620  -3.779  10.354
    4    HB3  SER  20           HB3      SER  20  16.239  -3.365   9.795
    5    HG   SER  20           HG       SER  20  15.396  -2.399  12.278

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LEU  21           H        LEU  21  16.976  -1.362   8.590
    2    HA   LEU  21           HA       LEU  21  18.676   0.107  10.319
    3    HB2  LEU  21           HB2      LEU  21  18.637  -0.163   7.306
    4    HB3  LEU  21           HB3      LEU  21  19.907   0.677   8.191
    5    HG   LEU  21           HG       LEU  21  19.128  -2.203   8.732
    6   HD13  LEU  21          HD11      LEU  21  19.959  -2.175   6.490
    7   HD12  LEU  21          HD12      LEU  21  21.314  -2.680   7.499
    8   HD11  LEU  21          HD13      LEU  21  21.231  -1.024   6.901
    9   HD23  LEU  21          HD21      LEU  21  21.626  -2.076   9.602
   10   HD22  LEU  21          HD22      LEU  21  20.332  -1.473  10.631
   11   HD21  LEU  21          HD23      LEU  21  21.310  -0.347   9.705

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ALA  22           H        ALA  22  16.410   1.098   7.773
    2    HA   ALA  22           HA       ALA  22  16.979   3.851   7.783
    3    HB3  ALA  22           HB1      ALA  22  15.555   2.623   6.112
    4    HB2  ALA  22           HB2      ALA  22  14.868   4.143   6.681
    5    HB1  ALA  22           HB3      ALA  22  14.263   2.611   7.313

  No H/Q in entry =           5
  In of MODEL   67
    1    H    TYR  23           H        TYR  23  14.471   2.064   9.631
    2    HA   TYR  23           HA       TYR  23  13.541   4.313  11.083
    3    HB2  TYR  23           HB2      TYR  23  12.283   2.212  11.069
    4    HB3  TYR  23           HB3      TYR  23  13.609   1.389  11.890
    5    HD1  TYR  23           HD1      TYR  23  11.146   4.169  12.260
    6    HD2  TYR  23           HD2      TYR  23  13.804   1.442  14.245
    7    HE1  TYR  23           HE1      TYR  23  10.233   4.876  14.456
    8    HE2  TYR  23           HE2      TYR  23  12.892   2.148  16.439
    9    HH   TYR  23           HH       TYR  23  10.495   4.759  16.678

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ALA  24           H        ALA  24  16.163   2.008  11.709
    2    HA   ALA  24           HA       ALA  24  16.857   2.997  14.269
    3    HB1  ALA  24           HB1      ALA  24  18.192   1.189  14.099
    4    HB3  ALA  24           HB2      ALA  24  19.225   2.098  12.994
    5    HB2  ALA  24           HB3      ALA  24  17.916   1.104  12.360

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ALA  25           H        ALA  25  17.809   3.913  10.985
    2    HA   ALA  25           HA       ALA  25  19.779   5.825  11.619
    3    HB1  ALA  25           HB1      ALA  25  19.041   4.884   9.308
    4    HB3  ALA  25           HB2      ALA  25  19.562   6.565   9.397
    5    HB2  ALA  25           HB3      ALA  25  17.843   6.178   9.337

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LEU  26           H        LEU  26  16.266   6.095  11.275
    2    HA   LEU  26           HA       LEU  26  16.077   8.879  11.725
    3    HB2  LEU  26           HB2      LEU  26  14.196   7.665  10.807
    4    HB3  LEU  26           HB3      LEU  26  14.100   6.640  12.233
    5    HG   LEU  26           HG       LEU  26  13.524   8.606  13.615
    6   HD12  LEU  26          HD11      LEU  26  12.882  10.713  12.291
    7   HD11  LEU  26          HD12      LEU  26  13.848  10.048  10.977
    8   HD13  LEU  26          HD13      LEU  26  14.605  10.425  12.526
    9   HD21  LEU  26          HD21      LEU  26  11.833   8.311  11.113
   10   HD23  LEU  26          HD22      LEU  26  11.288   9.016  12.632
   11   HD22  LEU  26          HD23      LEU  26  11.719   7.310  12.561

  No H/Q in entry =          11
  In of MODEL   67
    1    H    LYS  27           H        LYS  27  15.945   6.103  13.920
    2    HA   LYS  27           HA       LYS  27  15.381   7.478  16.290
    3    HB2  LYS  27           HB2      LYS  27  15.377   5.002  16.027
    4    HB3  LYS  27           HB3      LYS  27  17.141   5.033  15.975
    5    HG2  LYS  27           HG2      LYS  27  17.214   6.019  18.224
    6    HG3  LYS  27           HG3      LYS  27  15.448   6.060  18.278
    7    HD2  LYS  27           HD2      LYS  27  15.390   3.593  18.043
    8    HD3  LYS  27           HD3      LYS  27  17.155   3.561  18.023
    9    HE2  LYS  27           HE2      LYS  27  17.212   4.550  20.279
   10    HE3  LYS  27           HE3      LYS  27  15.447   4.613  20.302
   11    HZ3  LYS  27           HZ1      LYS  27  16.216   2.652  21.450
   12    HZ2  LYS  27           HZ2      LYS  27  17.119   2.160  20.095
   13    HZ1  LYS  27           HZ3      LYS  27  15.421   2.187  20.024

  No H/Q in entry =          13
  In of MODEL   67
    1    H    GLN  28           H        GLN  28  18.482   6.855  14.684
    2    HA   GLN  28           HA       GLN  28  20.189   7.918  16.665
    3    HB2  GLN  28           HB2      GLN  28  20.463   7.870  13.649
    4    HB3  GLN  28           HB3      GLN  28  21.761   8.320  14.755
    5    HG2  GLN  28           HG2      GLN  28  20.303   5.663  14.794
    6    HG3  GLN  28           HG3      GLN  28  21.889   5.930  14.074
    7   HE21  GLN  28          HE21      GLN  28  20.654   4.568  16.739
    8   HE22  GLN  28          HE22      GLN  28  21.825   4.996  17.890

  No H/Q in entry =           8
  In of MODEL   67
    1    H    ALA  29           H        ALA  29  18.444   9.422  13.980
    2    HA   ALA  29           HA       ALA  29  19.479  12.029  14.227
    3    HB2  ALA  29           HB1      ALA  29  17.782  12.688  12.763
    4    HB1  ALA  29           HB2      ALA  29  16.626  11.530  13.421
    5    HB3  ALA  29           HB3      ALA  29  17.944  10.970  12.391

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LYS  30           H        LYS  30  16.689  10.468  15.762
    2    HA   LYS  30           HA       LYS  30  15.712  12.736  17.123
    3    HB2  LYS  30           HB2      LYS  30  15.563   9.798  17.829
    4    HB3  LYS  30           HB3      LYS  30  14.719  11.060  18.726
    5    HG2  LYS  30           HG2      LYS  30  13.593  11.760  16.613
    6    HG3  LYS  30           HG3      LYS  30  14.375  10.413  15.783
    7    HD2  LYS  30           HD2      LYS  30  13.289   8.821  17.318
    8    HD3  LYS  30           HD3      LYS  30  12.517  10.158  18.171
    9    HE2  LYS  30           HE2      LYS  30  11.347  10.806  16.084
   10    HE3  LYS  30           HE3      LYS  30  12.099   9.441  15.250
   11    HZ2  LYS  30           HZ1      LYS  30   9.789   9.064  16.142
   12    HZ1  LYS  30           HZ2      LYS  30  10.465   9.109  17.706
   13    HZ3  LYS  30           HZ3      LYS  30  10.951   7.916  16.594

  No H/Q in entry =          13
  In of MODEL   67
    1    H    GLN  31           H        GLN  31  18.346  10.530  17.848
    2    HA   GLN  31           HA       GLN  31  18.700  11.541  20.540
    3    HB2  GLN  31           HB2      GLN  31  20.693   9.941  18.927
    4    HB3  GLN  31           HB3      GLN  31  20.569  10.068  20.682
    5    HG2  GLN  31           HG2      GLN  31  18.038   9.151  19.926
    6    HG3  GLN  31           HG3      GLN  31  19.123   8.291  18.841
    7   HE21  GLN  31          HE21      GLN  31  17.575   7.168  21.125
    8   HE22  GLN  31          HE22      GLN  31  18.726   6.491  22.171

  No H/Q in entry =           8
  In of MODEL   67
    1    H    GLY  32           H        GLY  32  19.224  12.849  17.571
    2    HA3  GLY  32           HA2      GLY  32  20.234  14.880  17.050
    3    HA2  GLY  32           HA3      GLY  32  21.000  14.875  18.635

  No H/Q in entry =           3
  In of MODEL   67
    1    H    ASP  33           H        ASP  33  21.372  11.976  16.857
    2    HA   ASP  33           HA       ASP  33  24.204  12.611  16.377
    3    HB2  ASP  33           HB2      ASP  33  22.659  10.017  16.502
    4    HB3  ASP  33           HB3      ASP  33  24.345  10.109  15.999

  No H/Q in entry =           4
  In of MODEL   67
    1    H    PHE  34           H        PHE  34  23.732  13.940  14.497
    2    HA   PHE  34           HA       PHE  34  22.358  12.974  12.217
    3    HB2  PHE  34           HB2      PHE  34  24.520  15.078  12.435
    4    HB3  PHE  34           HB3      PHE  34  23.524  14.800  11.009
    5    HD1  PHE  34           HD1      PHE  34  23.816  16.732  13.920
    6    HD2  PHE  34           HD2      PHE  34  20.898  14.656  11.549
    7    HE1  PHE  34           HE1      PHE  34  22.024  18.156  14.875
    8    HE2  PHE  34           HE2      PHE  34  19.110  16.079  12.507
    9    HZ   PHE  34           HZ       PHE  34  19.676  17.830  14.166

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ALA  35           H        ALA  35  25.735  12.739  13.209
    2    HA   ALA  35           HA       ALA  35  26.817  11.902  10.747
    3    HB3  ALA  35           HB1      ALA  35  28.489  10.710  12.459
    4    HB2  ALA  35           HB2      ALA  35  27.645  11.748  13.608
    5    HB1  ALA  35           HB3      ALA  35  28.485  12.459  12.231

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ALA  36           H        ALA  36  25.688   9.963  13.519
    2    HA   ALA  36           HA       ALA  36  26.132   7.468  12.242
    3    HB2  ALA  36           HB1      ALA  36  25.701   6.729  14.320
    4    HB3  ALA  36           HB2      ALA  36  24.019   7.246  14.178
    5    HB1  ALA  36           HB3      ALA  36  25.239   8.362  14.794

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ALA  37           H        ALA  37  23.340   9.632  12.389
    2    HA   ALA  37           HA       ALA  37  21.454   7.887  11.223
    3    HB3  ALA  37           HB1      ALA  37  21.721  10.847  11.512
    4    HB1  ALA  37           HB2      ALA  37  20.397   9.786  11.992
    5    HB2  ALA  37           HB3      ALA  37  20.584  10.254  10.301

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LYS  38           H        LYS  38  23.579  10.319   9.732
    2    HA   LYS  38           HA       LYS  38  22.921   9.899   7.058
    3    HB2  LYS  38           HB2      LYS  38  24.757  11.433   8.494
    4    HB3  LYS  38           HB3      LYS  38  25.773  10.430   7.464
    5    HG2  LYS  38           HG2      LYS  38  24.608  11.214   5.473
    6    HG3  LYS  38           HG3      LYS  38  23.430  12.085   6.459
    7    HD2  LYS  38           HD2      LYS  38  25.049  13.663   7.203
    8    HD3  LYS  38           HD3      LYS  38  26.393  12.659   6.661
    9    HE2  LYS  38           HE2      LYS  38  26.053  14.534   5.110
   10    HE3  LYS  38           HE3      LYS  38  25.694  13.000   4.308
   11    HZ3  LYS  38           HZ1      LYS  38  23.503  13.473   4.189
   12    HZ2  LYS  38           HZ2      LYS  38  24.046  15.081   4.273
   13    HZ1  LYS  38           HZ3      LYS  38  23.469  14.305   5.668

  No H/Q in entry =          13
  In of MODEL   67
    1    H    ALA  39           H        ALA  39  25.424   8.270   9.003
    2    HA   ALA  39           HA       ALA  39  26.463   6.667   6.929
    3    HB2  ALA  39           HB1      ALA  39  26.376   5.707   9.774
    4    HB1  ALA  39           HB2      ALA  39  27.344   7.120   9.352
    5    HB3  ALA  39           HB3      ALA  39  27.673   5.565   8.588

  No H/Q in entry =           5
  In of MODEL   67
    1    H    MET  40           H        MET  40  23.854   6.085   9.241
    2    HA   MET  40           HA       MET  40  23.374   3.385   8.510
    3    HB2  MET  40           HB2      MET  40  21.589   5.452   9.810
    4    HB3  MET  40           HB3      MET  40  21.161   3.748   9.638
    5    HG2  MET  40           HG2      MET  40  23.728   4.658  10.966
    6    HG3  MET  40           HG3      MET  40  22.235   4.401  11.867
    7    HE3  MET  40           HE1      MET  40  21.628   0.775  12.047
    8    HE2  MET  40           HE2      MET  40  20.771   2.088  11.243
    9    HE1  MET  40           HE3      MET  40  21.523   2.367  12.813

  No H/Q in entry =           9
  In of MODEL   67
    1    H    MET  41           H        MET  41  21.991   6.455   7.328
    2    HA   MET  41           HA       MET  41  20.012   5.283   5.666
    3    HB2  MET  41           HB2      MET  41  21.521   7.855   5.144
    4    HB3  MET  41           HB3      MET  41  19.984   7.379   4.434
    5    HG2  MET  41           HG2      MET  41  19.248   7.201   6.989
    6    HG3  MET  41           HG3      MET  41  20.572   8.343   7.204
    7    HE2  MET  41           HE1      MET  41  20.008   9.636   3.869
    8    HE1  MET  41           HE2      MET  41  20.977  10.064   5.276
    9    HE3  MET  41           HE3      MET  41  19.715  11.159   4.717

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ASP  42           H        ASP  42  23.392   6.165   5.096
    2    HA   ASP  42           HA       ASP  42  23.465   5.688   2.338
    3    HB2  ASP  42           HB2      ASP  42  25.236   6.666   4.098
    4    HB3  ASP  42           HB3      ASP  42  25.874   5.033   3.968

  No H/Q in entry =           4
  In of MODEL   67
    1    H    GLN  43           H        GLN  43  24.177   3.527   5.056
    2    HA   GLN  43           HA       GLN  43  24.807   1.261   3.472
    3    HB2  GLN  43           HB2      GLN  43  23.800   1.458   6.320
    4    HB3  GLN  43           HB3      GLN  43  24.358  -0.038   5.563
    5    HG2  GLN  43           HG2      GLN  43  26.533   1.146   5.041
    6    HG3  GLN  43           HG3      GLN  43  25.971   2.481   6.042
    7   HE21  GLN  43          HE21      GLN  43  28.197   1.482   7.068
    8   HE22  GLN  43          HE22      GLN  43  27.917   0.403   8.347

  No H/Q in entry =           8
  In of MODEL   67
    1    H    SER  44           H        SER  44  21.771   2.431   4.871
    2    HA   SER  44           HA       SER  44  20.173   0.206   4.208
    3    HB2  SER  44           HB2      SER  44  19.767   2.741   5.354
    4    HB3  SER  44           HB3      SER  44  18.725   2.709   3.934
    5    HG   SER  44           HG       SER  44  17.629   1.780   5.663

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ARG  45           H        ARG  45  20.941   3.161   2.398
    2    HA   ARG  45           HA       ARG  45  19.399   2.692   0.101
    3    HB2  ARG  45           HB2      ARG  45  20.571   4.815   0.678
    4    HB3  ARG  45           HB3      ARG  45  22.105   4.041   0.285
    5    HG2  ARG  45           HG2      ARG  45  21.305   3.644  -2.025
    6    HG3  ARG  45           HG3      ARG  45  19.784   4.440  -1.631
    7    HD2  ARG  45           HD2      ARG  45  21.062   6.522  -1.054
    8    HD3  ARG  45           HD3      ARG  45  22.546   5.730  -1.630
    9    HE   ARG  45           HE       ARG  45  20.603   5.514  -3.656
   10   HH21  ARG  45          HH11      ARG  45  20.603   6.883  -5.420
   11   HH22  ARG  45          HH12      ARG  45  21.379   8.424  -5.320
   12   HH11  ARG  45          HH21      ARG  45  22.371   7.993  -2.040
   13   HH12  ARG  45          HH22      ARG  45  22.379   9.052  -3.404

  No H/Q in entry =          13
  In of MODEL   67
    1    H    MET  46           H        MET  46  22.756   1.777   0.831
    2    HA   MET  46           HA       MET  46  23.334   0.575  -1.655
    3    HB2  MET  46           HB2      MET  46  24.453   0.244   1.128
    4    HB3  MET  46           HB3      MET  46  25.086  -0.669  -0.244
    5    HG2  MET  46           HG2      MET  46  25.570   1.413  -1.444
    6    HG3  MET  46           HG3      MET  46  24.866   2.355  -0.135
    7    HE3  MET  46           HE1      MET  46  27.727  -0.828   0.360
    8    HE2  MET  46           HE2      MET  46  28.739   0.233  -0.615
    9    HE1  MET  46           HE3      MET  46  27.149  -0.244  -1.206

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ALA  47           H        ALA  47  21.951  -0.739   1.329
    2    HA   ALA  47           HA       ALA  47  21.858  -3.451   0.529
    3    HB2  ALA  47           HB1      ALA  47  21.498  -2.984   2.835
    4    HB3  ALA  47           HB2      ALA  47  19.950  -3.568   2.225
    5    HB1  ALA  47           HB3      ALA  47  20.204  -1.840   2.481

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LEU  48           H        LEU  48  19.537  -0.794   0.183
    2    HA   LEU  48           HA       LEU  48  17.466  -2.302  -1.055
    3    HB2  LEU  48           HB2      LEU  48  18.158   0.643  -1.176
    4    HB3  LEU  48           HB3      LEU  48  16.674  -0.048  -1.833
    5    HG   LEU  48           HG       LEU  48  17.540  -0.359   1.050
    6   HD13  LEU  48          HD11      LEU  48  17.151   1.947   0.864
    7   HD12  LEU  48          HD12      LEU  48  15.588   1.320   1.383
    8   HD11  LEU  48          HD13      LEU  48  15.854   1.737  -0.310
    9   HD22  LEU  48          HD21      LEU  48  15.987  -2.054   0.680
   10   HD21  LEU  48          HD22      LEU  48  15.118  -1.140  -0.554
   11   HD23  LEU  48          HD23      LEU  48  14.921  -0.732   1.150

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ASN  49           H        ASN  49  20.172  -0.411  -2.303
    2    HA   ASN  49           HA       ASN  49  19.504  -0.488  -5.023
    3    HB2  ASN  49           HB2      ASN  49  21.210   1.004  -4.103
    4    HB3  ASN  49           HB3      ASN  49  22.225  -0.371  -3.690
    5   HD21  ASN  49          HD21      ASN  49  23.206   1.653  -5.387
    6   HD22  ASN  49          HD22      ASN  49  23.374   1.031  -6.956

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLU  50           H        GLU  50  21.470  -2.707  -3.070
    2    HA   GLU  50           HA       GLU  50  22.135  -4.474  -5.199
    3    HB2  GLU  50           HB2      GLU  50  23.346  -4.463  -3.040
    4    HB3  GLU  50           HB3      GLU  50  21.900  -5.070  -2.234
    5    HG2  GLU  50           HG2      GLU  50  21.954  -7.106  -3.591
    6    HG3  GLU  50           HG3      GLU  50  23.333  -6.493  -4.502

  No H/Q in entry =           6
  In of MODEL   67
    1    H    ALA  51           H        ALA  51  19.494  -4.371  -2.856
    2    HA   ALA  51           HA       ALA  51  18.290  -6.828  -3.603
    3    HB3  ALA  51           HB1      ALA  51  16.715  -6.300  -2.039
    4    HB1  ALA  51           HB2      ALA  51  16.520  -4.651  -2.638
    5    HB2  ALA  51           HB3      ALA  51  17.880  -5.055  -1.590

  No H/Q in entry =           5
  In of MODEL   67
    1    H    HIS  52           H        HIS  52  17.743  -3.474  -4.639
    2    HA   HIS  52           HA       HIS  52  15.612  -3.974  -6.425
    3    HB2  HIS  52           HB2      HIS  52  16.299  -1.717  -5.628
    4    HB3  HIS  52           HB3      HIS  52  17.743  -1.834  -6.635
    5    HD1  HIS  52           HD1      HIS  52  17.399  -1.807  -9.234
    6    HD2  HIS  52           HD2      HIS  52  13.906  -1.196  -7.045
    7    HE1  HIS  52           HE1      HIS  52  15.668  -0.948 -10.872
    8    HE2  HIS  52           HE2      HIS  52  13.533  -0.570  -9.552

  No H/Q in entry =           8
  In of MODEL   67
    1    H    LEU  53           H        LEU  53  19.127  -4.028  -6.879
    2    HA   LEU  53           HA       LEU  53  19.162  -4.347  -9.680
    3    HB2  LEU  53           HB2      LEU  53  21.098  -5.135  -7.517
    4    HB3  LEU  53           HB3      LEU  53  21.399  -5.523  -9.209
    5    HG   LEU  53           HG       LEU  53  20.787  -2.708  -8.248
    6   HD11  LEU  53          HD11      LEU  53  23.470  -4.027  -8.760
    7   HD13  LEU  53          HD12      LEU  53  22.858  -3.501  -7.192
    8   HD12  LEU  53          HD13      LEU  53  23.224  -2.313  -8.437
    9   HD22  LEU  53          HD21      LEU  53  20.456  -2.727 -10.579
   10   HD21  LEU  53          HD22      LEU  53  21.698  -3.947 -10.839
   11   HD23  LEU  53          HD23      LEU  53  22.158  -2.295 -10.476

  No H/Q in entry =          11
  In of MODEL   67
    1    H    VAL  54           H        VAL  54  19.035  -6.729  -7.050
    2    HA   VAL  54           HA       VAL  54  19.118  -9.027  -8.707
    3    HB   VAL  54           HB       VAL  54  17.986  -8.585  -5.933
    4   HG12  VAL  54          HG11      VAL  54  18.277 -11.206  -5.927
    5   HG11  VAL  54          HG12      VAL  54  18.083 -11.038  -7.672
    6   HG13  VAL  54          HG13      VAL  54  16.808 -10.489  -6.586
    7   HG22  VAL  54          HG21      VAL  54  20.306  -8.404  -5.725
    8   HG21  VAL  54          HG22      VAL  54  20.621  -9.502  -7.067
    9   HG23  VAL  54          HG23      VAL  54  20.092 -10.140  -5.510

  No H/Q in entry =           9
  In of MODEL   67
    1    H    GLN  55           H        GLN  55  16.422  -7.087  -7.410
    2    HA   GLN  55           HA       GLN  55  14.373  -8.727  -8.468
    3    HB2  GLN  55           HB2      GLN  55  13.655  -7.190  -6.839
    4    HB3  GLN  55           HB3      GLN  55  14.460  -5.833  -7.622
    5    HG2  GLN  55           HG2      GLN  55  12.731  -5.489  -9.102
    6    HG3  GLN  55           HG3      GLN  55  12.386  -7.205  -9.267
    7   HE21  GLN  55          HE21      GLN  55  10.378  -7.728  -8.448
    8   HE22  GLN  55          HE22      GLN  55   9.622  -6.962  -7.136

  No H/Q in entry =           8
  In of MODEL   67
    1    H    THR  56           H        THR  56  16.139  -5.951  -9.843
    2    HA   THR  56           HA       THR  56  14.691  -5.575 -12.183
    3    HB   THR  56           HB       THR  56  17.712  -5.525 -12.044
    4    HG1  THR  56           HG1      THR  56  15.783  -3.988 -10.820
    5   HG22  THR  56          HG21      THR  56  17.234  -3.537 -13.616
    6   HG21  THR  56          HG22      THR  56  15.611  -4.211 -13.760
    7   HG23  THR  56          HG23      THR  56  17.008  -5.160 -14.270

  No H/Q in entry =           7
  In of MODEL   67
    1    H    LYS  57           H        LYS  57  17.316  -7.904 -11.585
    2    HA   LYS  57           HA       LYS  57  17.285  -9.102 -14.161
    3    HB2  LYS  57           HB2      LYS  57  19.085  -9.376 -12.433
    4    HB3  LYS  57           HB3      LYS  57  17.975 -10.349 -11.479
    5    HG2  LYS  57           HG2      LYS  57  17.848 -12.022 -13.237
    6    HG3  LYS  57           HG3      LYS  57  18.835 -11.031 -14.305
    7    HD2  LYS  57           HD2      LYS  57  20.345 -12.623 -13.404
    8    HD3  LYS  57           HD3      LYS  57  20.643 -11.158 -12.470
    9    HE2  LYS  57           HE2      LYS  57  19.307 -11.978 -10.621
   10    HE3  LYS  57           HE3      LYS  57  18.757 -13.364 -11.560
   11    HZ3  LYS  57           HZ1      LYS  57  20.619 -14.474 -11.138
   12    HZ2  LYS  57           HZ2      LYS  57  20.899 -13.331  -9.913
   13    HZ1  LYS  57           HZ3      LYS  57  21.614 -13.135 -11.441

  No H/Q in entry =          13
  In of MODEL   67
    1    H    LEU  58           H        LEU  58  15.516  -9.743 -11.173
    2    HA   LEU  58           HA       LEU  58  14.260 -12.103 -12.096
    3    HB2  LEU  58           HB2      LEU  58  13.502 -10.185  -9.898
    4    HB3  LEU  58           HB3      LEU  58  12.675 -11.713 -10.206
    5    HG   LEU  58           HG       LEU  58  15.654 -11.470  -9.672
    6   HD11  LEU  58          HD11      LEU  58  13.290 -11.856  -7.863
    7   HD13  LEU  58          HD12      LEU  58  14.757 -10.910  -7.612
    8   HD12  LEU  58          HD13      LEU  58  14.809 -12.666  -7.474
    9   HD22  LEU  58          HD21      LEU  58  15.506 -13.532 -10.695
   10   HD21  LEU  58          HD22      LEU  58  13.792 -13.720 -10.323
   11   HD23  LEU  58          HD23      LEU  58  15.005 -14.034  -9.081

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  59           H        ILE  59  13.624  -8.760 -12.780
    2    HA   ILE  59           HA       ILE  59  10.895  -9.377 -13.701
    3    HB   ILE  59           HB       ILE  59  11.729  -7.104 -12.503
    4   HG12  ILE  59          HG12      ILE  59   9.825  -6.948 -14.849
    5   HG13  ILE  59          HG13      ILE  59   9.395  -7.726 -13.348
    6   HG21  ILE  59          HG21      ILE  59  13.275  -6.725 -14.562
    7   HG23  ILE  59          HG22      ILE  59  12.313  -5.374 -14.005
    8   HG22  ILE  59          HG23      ILE  59  11.809  -6.305 -15.412
    9   HD13  ILE  59          HD11      ILE  59   8.635  -5.403 -13.318
   10   HD12  ILE  59          HD12      ILE  59  10.277  -4.855 -13.647
   11   HD11  ILE  59          HD13      ILE  59   9.901  -5.640 -12.112

  No H/Q in entry =          11
  In of MODEL   67
    1    H    GLU  60           H        GLU  60  14.100  -8.566 -14.982
    2    HA   GLU  60           HA       GLU  60  13.308  -8.161 -17.685
    3    HB2  GLU  60           HB2      GLU  60  15.490  -7.429 -16.926
    4    HB3  GLU  60           HB3      GLU  60  15.936  -9.075 -16.488
    5    HG2  GLU  60           HG2      GLU  60  15.115  -8.456 -19.315
    6    HG3  GLU  60           HG3      GLU  60  16.757  -8.103 -18.780

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLY  61           H        GLY  61  14.262 -11.051 -15.872
    2    HA3  GLY  61           HA2      GLY  61  13.686 -12.696 -18.267
    3    HA2  GLY  61           HA3      GLY  61  14.721 -13.187 -16.930

  No H/Q in entry =           3
  In of MODEL   67
    1    H    ASP  62           H        ASP  62  11.621 -11.605 -16.545
    2    HA   ASP  62           HA       ASP  62  10.678 -13.501 -14.685
    3    HB2  ASP  62           HB2      ASP  62   8.553 -12.275 -14.859
    4    HB3  ASP  62           HB3      ASP  62   9.924 -11.183 -14.691

  No H/Q in entry =           4
  In of MODEL   67
    1    H    ALA  63           H        ALA  63  10.202 -13.253 -18.197
    2    HA   ALA  63           HA       ALA  63   8.004 -14.981 -18.514
    3    HB2  ALA  63           HB1      ALA  63   8.784 -15.298 -20.790
    4    HB1  ALA  63           HB2      ALA  63  10.403 -14.760 -20.350
    5    HB3  ALA  63           HB3      ALA  63   9.060 -13.618 -20.329

  No H/Q in entry =           5
  In of MODEL   67
    1    H    GLY  64           H        GLY  64   9.996 -16.671 -20.323
    2    HA3  GLY  64           HA2      GLY  64  11.243 -18.631 -20.116
    3    HA2  GLY  64           HA3      GLY  64  11.102 -18.512 -18.367

  No H/Q in entry =           3
  In of MODEL   67
    1    H    GLU  65           H        GLU  65   8.094 -18.122 -19.871
    2    HA   GLU  65           HA       GLU  65   7.508 -21.001 -19.732
    3    HB2  GLU  65           HB2      GLU  65   6.047 -18.842 -18.218
    4    HB3  GLU  65           HB3      GLU  65   5.411 -20.468 -18.462
    5    HG2  GLU  65           HG2      GLU  65   7.351 -21.437 -17.344
    6    HG3  GLU  65           HG3      GLU  65   8.083 -19.842 -17.174

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLY  66           H        GLY  66   5.749 -21.722 -20.822
    2    HA3  GLY  66           HA2      GLY  66   5.186 -21.005 -23.326
    3    HA2  GLY  66           HA3      GLY  66   3.980 -21.749 -22.295

  No H/Q in entry =           3
  In of MODEL   67
    1    H    LYS  67           H        LYS  67   2.837 -20.129 -20.820
    2    HA   LYS  67           HA       LYS  67   1.650 -18.138 -22.525
    3    HB2  LYS  67           HB2      LYS  67   0.995 -18.948 -19.690
    4    HB3  LYS  67           HB3      LYS  67  -0.006 -17.931 -20.735
    5    HG2  LYS  67           HG2      LYS  67   0.906 -20.702 -21.543
    6    HG3  LYS  67           HG3      LYS  67  -0.616 -20.413 -20.703
    7    HD2  LYS  67           HD2      LYS  67  -1.092 -18.699 -22.588
    8    HD3  LYS  67           HD3      LYS  67   0.205 -19.519 -23.460
    9    HE2  LYS  67           HE2      LYS  67  -0.951 -21.648 -23.293
   10    HE3  LYS  67           HE3      LYS  67  -2.196 -20.934 -22.269
   11    HZ1  LYS  67           HZ1      LYS  67  -1.774 -19.600 -24.801
   12    HZ3  LYS  67           HZ2      LYS  67  -3.221 -20.005 -24.010
   13    HZ2  LYS  67           HZ3      LYS  67  -2.391 -21.175 -24.923

  No H/Q in entry =          13
  In of MODEL   67
    1    H    MET  68           H        MET  68   1.283 -16.001 -22.074
    2    HA   MET  68           HA       MET  68   3.411 -14.388 -21.510
    3    HB2  MET  68           HB2      MET  68   0.460 -13.824 -21.253
    4    HB3  MET  68           HB3      MET  68   1.703 -12.575 -21.178
    5    HG2  MET  68           HG2      MET  68   2.495 -13.190 -23.413
    6    HG3  MET  68           HG3      MET  68   1.313 -14.497 -23.491
    7    HE1  MET  68           HE1      MET  68   2.128 -10.934 -23.181
    8    HE3  MET  68           HE2      MET  68   0.777 -10.671 -22.081
    9    HE2  MET  68           HE3      MET  68   0.723  -9.998 -23.708

  No H/Q in entry =           9
  In of MODEL   67
    1    H    LYS  69           H        LYS  69   1.868 -16.198 -19.126
    2    HA   LYS  69           HA       LYS  69   1.769 -14.390 -16.974
    3    HB2  LYS  69           HB2      LYS  69   0.589 -16.540 -16.999
    4    HB3  LYS  69           HB3      LYS  69   2.134 -17.385 -16.866
    5    HG2  LYS  69           HG2      LYS  69   2.593 -16.272 -14.731
    6    HG3  LYS  69           HG3      LYS  69   1.091 -15.358 -14.867
    7    HD2  LYS  69           HD2      LYS  69  -0.193 -17.468 -14.826
    8    HD3  LYS  69           HD3      LYS  69   1.312 -18.376 -14.668
    9    HE2  LYS  69           HE2      LYS  69   0.299 -18.061 -12.458
   10    HE3  LYS  69           HE3      LYS  69   1.806 -17.153 -12.565
   11    HZ2  LYS  69           HZ1      LYS  69  -0.653 -16.157 -11.887
   12    HZ1  LYS  69           HZ2      LYS  69  -0.412 -15.620 -13.479
   13    HZ3  LYS  69           HZ3      LYS  69   0.727 -15.252 -12.274

  No H/Q in entry =          13
  In of MODEL   67
    1    H    VAL  70           H        VAL  70   3.055 -14.077 -15.109
    2    HA   VAL  70           HA       VAL  70   5.932 -14.726 -15.451
    3    HB   VAL  70           HB       VAL  70   6.370 -12.614 -14.215
    4   HG12  VAL  70          HG11      VAL  70   4.629 -12.275 -16.676
    5   HG11  VAL  70          HG12      VAL  70   6.349 -12.664 -16.695
    6   HG13  VAL  70          HG13      VAL  70   5.804 -11.105 -16.075
    7   HG21  VAL  70          HG21      VAL  70   3.364 -12.571 -14.180
    8   HG23  VAL  70          HG22      VAL  70   4.226 -11.037 -14.292
    9   HG22  VAL  70          HG23      VAL  70   4.497 -12.101 -12.913

  No H/Q in entry =           9
  In of MODEL   67
    1    H    SER  71           H        SER  71   7.111 -14.610 -13.295
    2    HA   SER  71           HA       SER  71   6.115 -16.541 -11.497
    3    HB2  SER  71           HB2      SER  71   8.530 -15.944 -11.778
    4    HB3  SER  71           HB3      SER  71   8.211 -14.426 -10.941
    5    HG   SER  71           HG       SER  71   7.461 -16.911  -9.831

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LEU  72           H        LEU  72   4.724 -16.385  -9.867
    2    HA   LEU  72           HA       LEU  72   3.205 -14.053  -9.417
    3    HB2  LEU  72           HB2      LEU  72   3.472 -16.607  -7.837
    4    HB3  LEU  72           HB3      LEU  72   2.313 -15.338  -7.446
    5    HG   LEU  72           HG       LEU  72   2.464 -16.670 -10.171
    6   HD13  LEU  72          HD11      LEU  72   0.726 -18.137  -9.508
    7   HD12  LEU  72          HD12      LEU  72   0.393 -17.216  -8.044
    8   HD11  LEU  72          HD13      LEU  72   1.866 -18.178  -8.163
    9   HD21  LEU  72          HD21      LEU  72   0.629 -14.692  -8.840
   10   HD23  LEU  72          HD22      LEU  72  -0.036 -15.780 -10.047
   11   HD22  LEU  72          HD23      LEU  72   1.265 -14.675 -10.481

  No H/Q in entry =          11
  In of MODEL   67
    1    H    VAL  73           H        VAL  73   5.854 -15.519  -7.657
    2    HA   VAL  73           HA       VAL  73   5.825 -13.983  -5.327
    3    HB   VAL  73           HB       VAL  73   7.999 -14.819  -4.910
    4   HG13  VAL  73          HG11      VAL  73   7.750 -17.190  -5.420
    5   HG12  VAL  73          HG12      VAL  73   6.614 -16.822  -6.718
    6   HG11  VAL  73          HG13      VAL  73   6.168 -16.513  -5.041
    7   HG21  VAL  73          HG21      VAL  73   8.166 -14.862  -7.902
    8   HG23  VAL  73          HG22      VAL  73   9.138 -16.012  -6.986
    9   HG22  VAL  73          HG23      VAL  73   9.344 -14.280  -6.726

  No H/Q in entry =           9
  In of MODEL   67
    1    H    LEU  74           H        LEU  74   6.808 -13.105  -8.509
    2    HA   LEU  74           HA       LEU  74   8.779 -11.179  -8.029
    3    HB2  LEU  74           HB2      LEU  74   8.305 -11.922 -10.264
    4    HB3  LEU  74           HB3      LEU  74   6.645 -11.342 -10.155
    5    HG   LEU  74           HG       LEU  74   7.465  -9.021  -9.951
    6   HD12  LEU  74          HD11      LEU  74   9.969  -8.746 -10.553
    7   HD11  LEU  74          HD12      LEU  74  10.136 -10.427 -10.052
    8   HD13  LEU  74          HD13      LEU  74   9.582  -9.214  -8.899
    9   HD22  LEU  74          HD21      LEU  74   7.818  -8.793 -12.211
   10   HD21  LEU  74          HD22      LEU  74   7.197 -10.427 -12.147
   11   HD23  LEU  74          HD23      LEU  74   8.921 -10.164 -12.286

  No H/Q in entry =          11
  In of MODEL   67
    1    H    VAL  75           H        VAL  75   5.286 -10.753  -8.365
    2    HA   VAL  75           HA       VAL  75   5.226  -7.995  -7.780
    3    HB   VAL  75           HB       VAL  75   3.113 -10.112  -7.380
    4   HG11  VAL  75          HG11      VAL  75   2.959  -7.070  -7.226
    5   HG13  VAL  75          HG12      VAL  75   2.660  -8.198  -5.913
    6   HG12  VAL  75          HG13      VAL  75   1.562  -8.140  -7.282
    7   HG23  VAL  75          HG21      VAL  75   2.205  -9.023  -9.453
    8   HG22  VAL  75          HG22      VAL  75   3.770  -9.793  -9.708
    9   HG21  VAL  75          HG23      VAL  75   3.666  -8.041  -9.533

  No H/Q in entry =           9
  In of MODEL   67
    1    H    GLU  76           H        GLU  76   4.949 -10.866  -5.666
    2    HA   GLU  76           HA       GLU  76   4.507  -9.497  -3.244
    3    HB2  GLU  76           HB2      GLU  76   4.323 -11.978  -3.521
    4    HB3  GLU  76           HB3      GLU  76   6.068 -12.069  -3.680
    5    HG2  GLU  76           HG2      GLU  76   6.349 -11.193  -1.398
    6    HG3  GLU  76           HG3      GLU  76   4.611 -11.050  -1.210

  No H/Q in entry =           6
  In of MODEL   67
    1    H    ALA  77           H        ALA  77   7.548 -10.443  -4.821
    2    HA   ALA  77           HA       ALA  77   9.260  -9.418  -2.815
    3    HB2  ALA  77           HB1      ALA  77  11.013  -9.514  -4.531
    4    HB3  ALA  77           HB2      ALA  77   9.786  -9.721  -5.781
    5    HB1  ALA  77           HB3      ALA  77  10.024 -10.975  -4.564

  No H/Q in entry =           5
  In of MODEL   67
    1    H    GLN  78           H        GLN  78   7.871  -7.987  -5.723
    2    HA   GLN  78           HA       GLN  78   9.255  -5.524  -5.628
    3    HB2  GLN  78           HB2      GLN  78   7.938  -6.425  -7.578
    4    HB3  GLN  78           HB3      GLN  78   6.464  -6.027  -6.697
    5    HG2  GLN  78           HG2      GLN  78   7.150  -3.665  -6.609
    6    HG3  GLN  78           HG3      GLN  78   8.627  -4.057  -7.490
    7   HE21  GLN  78          HE21      GLN  78   6.712  -2.210  -8.565
    8   HE22  GLN  78          HE22      GLN  78   6.008  -2.916  -9.939

  No H/Q in entry =           8
  In of MODEL   67
    1    H    LEU  79           H        LEU  79   6.228  -6.622  -4.183
    2    HA   LEU  79           HA       LEU  79   5.269  -4.202  -3.172
    3    HB2  LEU  79           HB2      LEU  79   3.929  -6.236  -3.109
    4    HB3  LEU  79           HB3      LEU  79   5.069  -6.989  -1.997
    5    HG   LEU  79           HG       LEU  79   4.546  -5.338  -0.270
    6   HD13  LEU  79          HD11      LEU  79   4.101  -3.319  -1.321
    7   HD12  LEU  79          HD12      LEU  79   2.471  -3.823  -0.874
    8   HD11  LEU  79          HD13      LEU  79   3.042  -4.055  -2.525
    9   HD23  LEU  79          HD21      LEU  79   1.953  -5.797  -0.168
   10   HD22  LEU  79          HD22      LEU  79   3.076  -7.151  -0.063
   11   HD21  LEU  79          HD23      LEU  79   2.260  -6.805  -1.585

  No H/Q in entry =          11
  In of MODEL   67
    1    H    HIS  80           H        HIS  80   7.428  -6.563  -1.596
    2    HA   HIS  80           HA       HIS  80   7.746  -5.022   0.770
    3    HB2  HIS  80           HB2      HIS  80   9.049  -7.405  -0.432
    4    HB3  HIS  80           HB3      HIS  80   9.976  -6.518   0.780
    5    HD1  HIS  80           HD1      HIS  80   9.486  -7.145   3.126
    6    HD2  HIS  80           HD2      HIS  80   6.249  -7.957   0.628
    7    HE1  HIS  80           HE1      HIS  80   7.706  -8.224   4.583
    8    HE2  HIS  80           HE2      HIS  80   5.726  -8.722   3.068

  No H/Q in entry =           8
  In of MODEL   67
    1    H    LEU  81           H        LEU  81   9.736  -5.328  -2.150
    2    HA   LEU  81           HA       LEU  81  11.806  -3.613  -1.281
    3    HB2  LEU  81           HB2      LEU  81  10.864  -4.396  -4.040
    4    HB3  LEU  81           HB3      LEU  81  12.299  -3.409  -3.756
    5    HG   LEU  81           HG       LEU  81  11.875  -6.123  -2.478
    6   HD12  LEU  81          HD11      LEU  81  13.675  -6.775  -4.234
    7   HD11  LEU  81          HD12      LEU  81  13.125  -5.345  -5.105
    8   HD13  LEU  81          HD13      LEU  81  11.998  -6.654  -4.761
    9   HD23  LEU  81          HD21      LEU  81  14.507  -5.843  -2.474
   10   HD22  LEU  81          HD22      LEU  81  13.540  -5.068  -1.221
   11   HD21  LEU  81          HD23      LEU  81  14.126  -4.126  -2.592

  No H/Q in entry =          11
  In of MODEL   67
    1    H    MET  82           H        MET  82   8.885  -2.939  -3.208
    2    HA   MET  82           HA       MET  82   9.460  -0.221  -3.714
    3    HB2  MET  82           HB2      MET  82   6.880  -1.780  -3.577
    4    HB3  MET  82           HB3      MET  82   6.902  -0.056  -3.944
    5    HG2  MET  82           HG2      MET  82   8.468  -2.153  -5.483
    6    HG3  MET  82           HG3      MET  82   6.907  -1.510  -5.990
    7    HE3  MET  82           HE1      MET  82   7.399   1.937  -7.167
    8    HE2  MET  82           HE2      MET  82   7.028   1.718  -5.459
    9    HE1  MET  82           HE3      MET  82   6.343   0.617  -6.650

  No H/Q in entry =           9
  In of MODEL   67
    1    H    THR  83           H        THR  83   7.656  -1.792  -1.100
    2    HA   THR  83           HA       THR  83   6.843   0.569   0.227
    3    HB   THR  83           HB       THR  83   6.694  -1.001   2.247
    4    HG1  THR  83           HG1      THR  83   7.423  -2.962   2.016
    5   HG22  THR  83          HG21      THR  83   5.014  -2.545   0.787
    6   HG21  THR  83          HG22      THR  83   5.255  -1.221  -0.348
    7   HG23  THR  83          HG23      THR  83   4.625  -0.895   1.268

  No H/Q in entry =           7
  In of MODEL   67
    1    H    SER  84           H        SER  84   9.639  -1.567   0.739
    2    HA   SER  84           HA       SER  84  10.726  -0.150   2.922
    3    HB2  SER  84           HB2      SER  84  11.946  -2.012   0.895
    4    HB3  SER  84           HB3      SER  84  12.908  -1.271   2.172
    5    HG   SER  84           HG       SER  84  10.610  -2.928   2.442

  No H/Q in entry =           5
  In of MODEL   67
    1    H    MET  85           H        MET  85  11.470   0.097  -0.569
    2    HA   MET  85           HA       MET  85  13.497   2.033  -0.327
    3    HB2  MET  85           HB2      MET  85  13.070   0.752  -2.390
    4    HB3  MET  85           HB3      MET  85  11.560   1.636  -2.616
    5    HG2  MET  85           HG2      MET  85  12.799   3.755  -2.753
    6    HG3  MET  85           HG3      MET  85  14.312   2.900  -2.476
    7    HE2  MET  85           HE1      MET  85  11.614   3.114  -6.068
    8    HE1  MET  85           HE2      MET  85  11.206   3.239  -4.360
    9    HE3  MET  85           HE3      MET  85  11.252   1.658  -5.127

  No H/Q in entry =           9
  In of MODEL   67
    1    H    LEU  86           H        LEU  86  10.011   2.418  -0.824
    2    HA   LEU  86           HA       LEU  86   9.987   5.231  -1.009
    3    HB2  LEU  86           HB2      LEU  86   8.117   3.598  -1.576
    4    HB3  LEU  86           HB3      LEU  86   7.792   3.515   0.155
    5    HG   LEU  86           HG       LEU  86   7.669   6.078   0.101
    6   HD11  LEU  86          HD11      LEU  86   8.428   5.628  -2.604
    7   HD13  LEU  86          HD12      LEU  86   8.017   7.162  -1.843
    8   HD12  LEU  86          HD13      LEU  86   6.764   6.217  -2.643
    9   HD23  LEU  86          HD21      LEU  86   5.509   4.755  -1.553
   10   HD22  LEU  86          HD22      LEU  86   5.342   6.019  -0.337
   11   HD21  LEU  86          HD23      LEU  86   5.719   4.369   0.156

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ALA  87           H        ALA  87   9.499   3.063   1.742
    2    HA   ALA  87           HA       ALA  87   8.987   4.987   3.711
    3    HB1  ALA  87           HB1      ALA  87   9.752   2.155   3.625
    4    HB3  ALA  87           HB2      ALA  87   8.643   2.985   4.714
    5    HB2  ALA  87           HB3      ALA  87  10.373   2.991   5.051

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ARG  88           H        ARG  88  12.045   3.516   2.720
    2    HA   ARG  88           HA       ARG  88  13.682   4.872   4.545
    3    HB2  ARG  88           HB2      ARG  88  14.315   2.887   3.141
    4    HB3  ARG  88           HB3      ARG  88  14.479   3.976   1.766
    5    HG2  ARG  88           HG2      ARG  88  15.979   5.270   3.706
    6    HG3  ARG  88           HG3      ARG  88  16.276   3.577   4.085
    7    HD2  ARG  88           HD2      ARG  88  17.531   3.259   2.234
    8    HD3  ARG  88           HD3      ARG  88  16.403   4.146   1.204
    9    HE   ARG  88           HE       ARG  88  18.817   5.176   2.241
   10   HH21  ARG  88          HH11      ARG  88  19.195   7.389   2.043
   11   HH22  ARG  88          HH12      ARG  88  17.859   8.480   1.903
   12   HH11  ARG  88          HH21      ARG  88  15.489   5.978   1.975
   13   HH12  ARG  88          HH22      ARG  88  15.759   7.679   1.841

  No H/Q in entry =          13
  In of MODEL   67
    1    H    GLU  89           H        GLU  89  12.709   5.781   1.224
    2    HA   GLU  89           HA       GLU  89  14.290   8.117   1.059
    3    HB2  GLU  89           HB2      GLU  89  13.123   7.091  -0.883
    4    HB3  GLU  89           HB3      GLU  89  11.589   7.656  -0.220
    5    HG2  GLU  89           HG2      GLU  89  12.325   9.983  -0.387
    6    HG3  GLU  89           HG3      GLU  89  13.919   9.468  -0.930

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LEU  90           H        LEU  90  10.958   7.658   2.203
    2    HA   LEU  90           HA       LEU  90  10.486  10.400   2.777
    3    HB2  LEU  90           HB2      LEU  90   9.257   7.845   3.812
    4    HB3  LEU  90           HB3      LEU  90   8.652   9.450   4.235
    5    HG   LEU  90           HG       LEU  90   9.045   8.561   1.366
    6   HD12  LEU  90          HD11      LEU  90   6.507   8.270   1.439
    7   HD11  LEU  90          HD12      LEU  90   6.669   8.259   3.195
    8   HD13  LEU  90          HD13      LEU  90   7.465   7.017   2.228
    9   HD22  LEU  90          HD21      LEU  90   8.785  10.873   1.291
   10   HD21  LEU  90          HD22      LEU  90   7.805  10.922   2.755
   11   HD23  LEU  90          HD23      LEU  90   7.094  10.376   1.237

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  91           H        ILE  91  11.716   7.702   4.697
    2    HA   ILE  91           HA       ILE  91  11.887   9.067   7.163
    3    HB   ILE  91           HB       ILE  91  13.402   6.705   6.036
    4   HG12  ILE  91          HG12      ILE  91  11.397   6.904   8.303
    5   HG13  ILE  91          HG13      ILE  91  10.916   6.629   6.630
    6   HG22  ILE  91          HG21      ILE  91  13.879   6.487   8.675
    7   HG21  ILE  91          HG22      ILE  91  13.829   8.246   8.572
    8   HG23  ILE  91          HG23      ILE  91  14.990   7.340   7.604
    9   HD13  ILE  91          HD11      ILE  91  11.887   4.512   6.558
   10   HD12  ILE  91          HD12      ILE  91  11.302   4.581   8.220
   11   HD11  ILE  91          HD13      ILE  91  13.006   4.868   7.874

  No H/Q in entry =          11
  In of MODEL   67
    1    H    THR  92           H        THR  92  14.090   8.863   4.403
    2    HA   THR  92           HA       THR  92  16.281  10.224   5.552
    3    HB   THR  92           HB       THR  92  15.281  10.111   2.695
    4    HG1  THR  92           HG1      THR  92  16.086   8.202   3.099
    5   HG22  THR  92          HG21      THR  92  17.859  10.763   2.390
    6   HG21  THR  92          HG22      THR  92  17.570  11.590   3.920
    7   HG23  THR  92          HG23      THR  92  16.600  11.991   2.503

  No H/Q in entry =           7
  In of MODEL   67
    1    H    GLU  93           H        GLU  93  13.404  11.419   3.833
    2    HA   GLU  93           HA       GLU  93  14.039  14.171   3.942
    3    HB2  GLU  93           HB2      GLU  93  11.315  12.838   3.969
    4    HB3  GLU  93           HB3      GLU  93  11.627  14.533   3.594
    5    HG2  GLU  93           HG2      GLU  93  12.925  12.269   2.063
    6    HG3  GLU  93           HG3      GLU  93  11.387  12.974   1.582

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LEU  94           H        LEU  94  12.274  12.042   6.163
    2    HA   LEU  94           HA       LEU  94  11.502  14.002   8.040
    3    HB2  LEU  94           HB2      LEU  94  12.035  11.040   8.315
    4    HB3  LEU  94           HB3      LEU  94  11.484  12.025   9.667
    5    HG   LEU  94           HG       LEU  94   9.989  12.096   7.044
    6   HD11  LEU  94          HD11      LEU  94  10.048   9.876   9.051
    7   HD13  LEU  94          HD12      LEU  94   9.738   9.817   7.317
    8   HD12  LEU  94          HD13      LEU  94   8.472  10.354   8.420
    9   HD23  LEU  94          HD21      LEU  94   8.083  12.525   8.652
   10   HD22  LEU  94          HD22      LEU  94   9.340  13.761   8.683
   11   HD21  LEU  94          HD23      LEU  94   9.265  12.547   9.958

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  95           H        ILE  95  14.446  12.029   7.793
    2    HA   ILE  95           HA       ILE  95  15.637  12.936  10.201
    3    HB   ILE  95           HB       ILE  95  16.849  11.847   7.648
    4   HG12  ILE  95          HG12      ILE  95  16.548  10.653  10.418
    5   HG13  ILE  95          HG13      ILE  95  15.372  10.411   9.129
    6   HG21  ILE  95          HG21      ILE  95  18.128  12.637  10.284
    7   HG23  ILE  95          HG22      ILE  95  18.591  13.157   8.663
    8   HG22  ILE  95          HG23      ILE  95  18.875  11.493   9.171
    9   HD13  ILE  95          HD11      ILE  95  16.827   9.109   7.861
   10   HD12  ILE  95          HD12      ILE  95  17.301   8.655   9.495
   11   HD11  ILE  95          HD13      ILE  95  18.267   9.819   8.590

  No H/Q in entry =          11
  In of MODEL   67
    1    H    GLU  96           H        GLU  96  15.795  14.164   6.864
    2    HA   GLU  96           HA       GLU  96  17.675  16.215   7.331
    3    HB2  GLU  96           HB2      GLU  96  16.990  15.561   5.075
    4    HB3  GLU  96           HB3      GLU  96  15.357  16.142   5.382
    5    HG2  GLU  96           HG2      GLU  96  15.952  18.263   4.836
    6    HG3  GLU  96           HG3      GLU  96  17.256  18.245   6.012

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LEU  97           H        LEU  97  14.163  16.081   7.776
    2    HA   LEU  97           HA       LEU  97  13.790  18.821   8.417
    3    HB2  LEU  97           HB2      LEU  97  12.237  16.319   9.041
    4    HB3  LEU  97           HB3      LEU  97  11.750  17.874   9.713
    5    HG   LEU  97           HG       LEU  97  12.214  17.448   6.746
    6   HD12  LEU  97          HD11      LEU  97   9.688  17.357   6.639
    7   HD11  LEU  97          HD12      LEU  97   9.686  17.159   8.390
    8   HD13  LEU  97          HD13      LEU  97  10.445  15.939   7.365
    9   HD23  LEU  97          HD21      LEU  97  10.505  19.438   6.784
   10   HD22  LEU  97          HD22      LEU  97  12.193  19.772   7.169
   11   HD21  LEU  97          HD23      LEU  97  11.008  19.621   8.464

  No H/Q in entry =          11
  In of MODEL   67
    1    H    HIS  98           H        HIS  98  14.579  15.985  10.412
    2    HA   HIS  98           HA       HIS  98  14.451  17.250  12.927
    3    HB2  HIS  98           HB2      HIS  98  16.162  14.966  11.920
    4    HB3  HIS  98           HB3      HIS  98  16.176  15.506  13.601
    5    HD1  HIS  98           HD1      HIS  98  13.942  13.907  11.020
    6    HD2  HIS  98           HD2      HIS  98  13.867  14.832  15.084
    7    HE1  HIS  98           HE1      HIS  98  11.903  12.744  11.983
    8    HE2  HIS  98           HE2      HIS  98  11.838  13.299  14.454

  No H/Q in entry =           8
  In of MODEL   67
    1    H    GLU  99           H        GLU  99  16.991  17.095  10.481
    2    HA   GLU  99           HA       GLU  99  19.003  18.398  12.000
    3    HB2  GLU  99           HB2      GLU  99  19.454  17.102   9.930
    4    HB3  GLU  99           HB3      GLU  99  18.659  18.368   8.991
    5    HG2  GLU  99           HG2      GLU  99  20.295  20.014   9.773
    6    HG3  GLU  99           HG3      GLU  99  21.061  18.802  10.794

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LYS 100           H        LYS 100  16.487  19.596   9.794
    2    HA   LYS 100           HA       LYS 100  17.327  22.321   9.932
    3    HB2  LYS 100           HB2      LYS 100  14.671  21.072   9.190
    4    HB3  LYS 100           HB3      LYS 100  14.997  22.805   9.097
    5    HG2  LYS 100           HG2      LYS 100  16.955  22.326   7.621
    6    HG3  LYS 100           HG3      LYS 100  16.515  20.615   7.643
    7    HD2  LYS 100           HD2      LYS 100  14.324  21.157   6.652
    8    HD3  LYS 100           HD3      LYS 100  14.746  22.870   6.638
    9    HE2  LYS 100           HE2      LYS 100  16.691  22.358   5.170
   10    HE3  LYS 100           HE3      LYS 100  16.200  20.661   5.140
   11    HZ1  LYS 100           HZ1      LYS 100  14.405  22.880   4.312
   12    HZ3  LYS 100           HZ2      LYS 100  14.194  21.214   4.052
   13    HZ2  LYS 100           HZ3      LYS 100  15.414  22.056   3.224

  No H/Q in entry =          13
  In of MODEL   67
    1    H    LEU 101           H        LEU 101  15.207  20.309  11.908
    2    HA   LEU 101           HA       LEU 101  14.080  22.396  13.490
    3    HB2  LEU 101           HB2      LEU 101  14.479  19.441  13.874
    4    HB3  LEU 101           HB3      LEU 101  13.964  20.430  15.237
    5    HG   LEU 101           HG       LEU 101  12.535  20.538  12.574
    6   HD12  LEU 101          HD11      LEU 101  10.858  19.001  13.852
    7   HD11  LEU 101          HD12      LEU 101  12.251  18.568  14.841
    8   HD13  LEU 101          HD13      LEU 101  12.271  18.259  13.104
    9   HD21  LEU 101          HD21      LEU 101  11.904  21.344  15.429
   10   HD23  LEU 101          HD22      LEU 101  10.634  21.137  14.225
   11   HD22  LEU 101          HD23      LEU 101  11.887  22.352  13.980

  No H/Q in entry =          11
  In of MODEL   67
    1    H    LYS 102           H        LYS 102  17.216  21.739  13.039
    2    HA   LYS 102           HA       LYS 102  19.081  22.582  14.103
    3    HB2  LYS 102           HB2      LYS 102  17.296  24.126  15.243
    4    HB3  LYS 102           HB3      LYS 102  17.493  23.062  16.620
    5    HG2  LYS 102           HG2      LYS 102  19.411  25.042  15.440
    6    HG3  LYS 102           HG3      LYS 102  19.032  24.735  17.121
    7    HD2  LYS 102           HD2      LYS 102  20.661  22.795  15.429
    8    HD3  LYS 102           HD3      LYS 102  21.376  24.107  16.358
    9    HE2  LYS 102           HE2      LYS 102  20.942  21.566  17.330
   10    HE3  LYS 102           HE3      LYS 102  21.188  23.005  18.319
   11    HZ2  LYS 102           HZ1      LYS 102  19.202  21.752  18.948
   12    HZ1  LYS 102           HZ2      LYS 102  18.555  21.991  17.402
   13    HZ3  LYS 102           HZ3      LYS 102  18.811  23.318  18.425

  No H/Q in entry =          13
  In of MODEL   67
    1    H    ALA 103           H        ALA 103  16.996  21.011  16.535
    2    HA   ALA 103           HA       ALA 103  18.711  19.775  18.183
    3    HB2  ALA 103           HB1      ALA 103  17.096  17.792  18.187
    4    HB1  ALA 103           HB2      ALA 103  16.208  18.659  16.933
    5    HB3  ALA 103           HB3      ALA 103  16.405  19.378  18.530

  No H/Q in entry =           5
  In of MODEL   67
    1    H1   ALA   1           H3       ALA   1  -1.823  -6.792 -21.322
    2    H2   ALA   1           H2       ALA   1  -2.638  -8.213 -20.864
    3    H3   ALA   1           H1       ALA   1  -1.034  -8.290 -21.426
    4    HA   ALA   1           HA       ALA   1  -1.885  -8.747 -23.418
    5    HB1  ALA   1           HB1      ALA   1  -4.031  -9.430 -22.934
    6    HB2  ALA   1           HB2      ALA   1  -4.449  -7.913 -23.731
    7    HB3  ALA   1           HB3      ALA   1  -4.381  -7.993 -21.972

  No H/Q in entry =           7
  In of MODEL   67
    1    H    GLU   2           H        GLU   2  -2.704  -7.544 -25.405
    2    HA   GLU   2           HA       GLU   2  -1.277  -5.554 -26.290
    3    HB2  GLU   2           HB2      GLU   2  -4.286  -5.572 -26.594
    4    HB3  GLU   2           HB3      GLU   2  -3.156  -4.729 -27.649
    5    HG2  GLU   2           HG2      GLU   2  -2.689  -6.627 -28.805
    6    HG3  GLU   2           HG3      GLU   2  -2.400  -7.536 -27.328

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLU   3           H        GLU   3  -4.413  -4.245 -25.376
    2    HA   GLU   3           HA       GLU   3  -3.322  -1.706 -24.754
    3    HB2  GLU   3           HB2      GLU   3  -6.029  -2.977 -24.410
    4    HB3  GLU   3           HB3      GLU   3  -5.702  -1.367 -23.766
    5    HG2  GLU   3           HG2      GLU   3  -5.341  -0.447 -25.894
    6    HG3  GLU   3           HG3      GLU   3  -4.974  -2.009 -26.619

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LEU   4           H        LEU   4  -4.941  -4.038 -22.566
    2    HA   LEU   4           HA       LEU   4  -4.546  -2.814 -20.177
    3    HB2  LEU   4           HB2      LEU   4  -4.053  -5.764 -20.648
    4    HB3  LEU   4           HB3      LEU   4  -4.439  -5.011 -19.102
    5    HG   LEU   4           HG       LEU   4  -6.224  -5.057 -21.559
    6   HD13  LEU   4          HD11      LEU   4  -7.440  -6.754 -20.554
    7   HD12  LEU   4          HD12      LEU   4  -6.941  -6.302 -18.926
    8   HD11  LEU   4          HD13      LEU   4  -5.824  -7.164 -19.982
    9   HD23  LEU   4          HD21      LEU   4  -7.887  -4.217 -19.684
   10   HD22  LEU   4          HD22      LEU   4  -6.833  -3.064 -20.500
   11   HD21  LEU   4          HD23      LEU   4  -6.410  -3.660 -18.896

  No H/Q in entry =          11
  In of MODEL   67
    1    H    GLU   5           H        GLU   5  -2.086  -4.699 -21.918
    2    HA   GLU   5           HA       GLU   5  -0.089  -4.446 -19.891
    3    HB2  GLU   5           HB2      GLU   5  -0.075  -6.214 -21.657
    4    HB3  GLU   5           HB3      GLU   5   0.287  -4.969 -22.853
    5    HG2  GLU   5           HG2      GLU   5   2.379  -5.967 -22.208
    6    HG3  GLU   5           HG3      GLU   5   2.320  -4.365 -21.475

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLU   6           H        GLU   6  -0.709  -2.724 -22.933
    2    HA   GLU   6           HA       GLU   6   1.491  -0.928 -22.676
    3    HB2  GLU   6           HB2      GLU   6  -1.077  -0.781 -24.270
    4    HB3  GLU   6           HB3      GLU   6   0.217   0.412 -24.390
    5    HG2  GLU   6           HG2      GLU   6   0.572  -2.561 -24.866
    6    HG3  GLU   6           HG3      GLU   6   0.370  -1.363 -26.144

  No H/Q in entry =           6
  In of MODEL   67
    1    H    VAL   7           H        VAL   7  -1.843  -0.944 -21.617
    2    HA   VAL   7           HA       VAL   7  -2.017   1.772 -20.781
    3    HB   VAL   7           HB       VAL   7  -3.516  -0.721 -19.937
    4   HG11  VAL   7          HG11      VAL   7  -3.840   2.174 -19.123
    5   HG13  VAL   7          HG12      VAL   7  -3.760   0.748 -18.087
    6   HG12  VAL   7          HG13      VAL   7  -5.192   1.041 -19.073
    7   HG21  VAL   7          HG21      VAL   7  -3.666   0.356 -22.325
    8   HG23  VAL   7          HG22      VAL   7  -4.587   1.621 -21.509
    9   HG22  VAL   7          HG23      VAL   7  -5.160  -0.047 -21.479

  No H/Q in entry =           9
  In of MODEL   67
    1    H    VAL   8           H        VAL   8  -1.071  -1.228 -19.140
    2    HA   VAL   8           HA       VAL   8  -0.723  -0.153 -16.547
    3    HB   VAL   8           HB       VAL   8   0.644  -2.489 -17.905
    4   HG12  VAL   8          HG11      VAL   8   0.919  -3.112 -15.356
    5   HG11  VAL   8          HG12      VAL   8   0.805  -1.367 -15.123
    6   HG13  VAL   8          HG13      VAL   8   2.087  -2.040 -16.128
    7   HG22  VAL   8          HG21      VAL   8  -1.159  -3.770 -17.246
    8   HG21  VAL   8          HG22      VAL   8  -2.004  -2.225 -17.203
    9   HG23  VAL   8          HG23      VAL   8  -1.338  -2.903 -15.722

  No H/Q in entry =           9
  In of MODEL   67
    1    H    MET   9           H        MET   9   1.508  -0.492 -19.304
    2    HA   MET   9           HA       MET   9   3.817   0.514 -18.054
    3    HB2  MET   9           HB2      MET   9   2.896   0.727 -20.931
    4    HB3  MET   9           HB3      MET   9   4.504   1.185 -20.373
    5    HG2  MET   9           HG2      MET   9   4.917  -1.092 -19.585
    6    HG3  MET   9           HG3      MET   9   3.277  -1.567 -20.030
    7    HE3  MET   9           HE1      MET   9   5.904   0.762 -22.191
    8    HE2  MET   9           HE2      MET   9   6.873  -0.637 -22.645
    9    HE1  MET   9           HE3      MET   9   6.593  -0.281 -20.943

  No H/Q in entry =           9
  In of MODEL   67
    1    H    GLY  10           H        GLY  10   1.152   2.160 -19.720
    2    HA3  GLY  10           HA2      GLY  10   2.162   4.797 -19.481
    3    HA2  GLY  10           HA3      GLY  10   0.464   4.366 -19.678

  No H/Q in entry =           3
  In of MODEL   67
    1    H    LEU  11           H        LEU  11   0.049   2.847 -17.389
    2    HA   LEU  11           HA       LEU  11  -0.438   4.833 -15.428
    3    HB2  LEU  11           HB2      LEU  11  -0.422   1.817 -15.271
    4    HB3  LEU  11           HB3      LEU  11  -0.907   2.849 -13.926
    5    HG   LEU  11           HG       LEU  11  -2.156   2.983 -16.684
    6   HD13  LEU  11          HD11      LEU  11  -2.774   0.850 -15.925
    7   HD12  LEU  11          HD12      LEU  11  -4.104   1.866 -15.373
    8   HD11  LEU  11          HD13      LEU  11  -2.851   1.364 -14.239
    9   HD22  LEU  11          HD21      LEU  11  -2.707   5.009 -15.675
   10   HD21  LEU  11          HD22      LEU  11  -2.636   4.342 -14.044
   11   HD23  LEU  11          HD23      LEU  11  -4.022   4.000 -15.079

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  12           H        ILE  12   2.061   2.323 -15.682
    2    HA   ILE  12           HA       ILE  12   3.288   2.840 -13.184
    3    HB   ILE  12           HB       ILE  12   4.516   1.781 -15.751
    4   HG12  ILE  12          HG12      ILE  12   2.479   0.587 -14.602
    5   HG13  ILE  12          HG13      ILE  12   3.855  -0.373 -15.105
    6   HG23  ILE  12          HG21      ILE  12   6.335   2.388 -14.351
    7   HG22  ILE  12          HG22      ILE  12   6.105   0.666 -14.050
    8   HG21  ILE  12          HG23      ILE  12   5.501   1.851 -12.894
    9   HD12  ILE  12          HD11      ILE  12   3.001  -0.913 -12.813
   10   HD11  ILE  12          HD12      ILE  12   3.441   0.719 -12.312
   11   HD13  ILE  12          HD13      ILE  12   4.680  -0.405 -12.825

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  13           H        ILE  13   3.895   4.091 -16.445
    2    HA   ILE  13           HA       ILE  13   6.066   5.774 -15.732
    3    HB   ILE  13           HB       ILE  13   4.026   5.884 -17.967
    4   HG12  ILE  13          HG12      ILE  13   5.845   4.023 -17.695
    5   HG13  ILE  13          HG13      ILE  13   5.597   4.763 -19.272
    6   HG23  ILE  13          HG21      ILE  13   4.672   8.101 -18.012
    7   HG22  ILE  13          HG22      ILE  13   5.965   7.409 -18.985
    8   HG21  ILE  13          HG23      ILE  13   6.248   7.778 -17.285
    9   HD12  ILE  13          HD11      ILE  13   8.040   4.552 -18.552
   10   HD11  ILE  13          HD12      ILE  13   7.680   5.739 -17.304
   11   HD13  ILE  13          HD13      ILE  13   7.525   6.177 -19.001

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ASN  14           H        ASN  14   2.567   6.330 -15.981
    2    HA   ASN  14           HA       ASN  14   2.576   9.077 -15.346
    3    HB2  ASN  14           HB2      ASN  14   0.650   7.468 -16.166
    4    HB3  ASN  14           HB3      ASN  14   0.334   7.296 -14.443
    5   HD21  ASN  14          HD21      ASN  14  -1.672   8.487 -15.866
    6   HD22  ASN  14          HD22      ASN  14  -1.704  10.161 -15.599

  No H/Q in entry =           6
  In of MODEL   67
    1    H    SER  15           H        SER  15   2.241   6.206 -13.266
    2    HA   SER  15           HA       SER  15   1.971   7.583 -10.817
    3    HB2  SER  15           HB2      SER  15   2.499   5.487  -9.769
    4    HB3  SER  15           HB3      SER  15   1.640   5.085 -11.252
    5    HG   SER  15           HG       SER  15   3.534   4.543 -12.211

  No H/Q in entry =           5
  In of MODEL   67
    1    H    GLY  16           H        GLY  16   4.818   6.435 -12.590
    2    HA3  GLY  16           HA2      GLY  16   6.766   7.159 -10.670
    3    HA2  GLY  16           HA3      GLY  16   7.057   6.951 -12.395

  No H/Q in entry =           3
  In of MODEL   67
    1    H    GLN  17           H        GLN  17   5.396   8.937 -13.450
    2    HA   GLN  17           HA       GLN  17   7.014  11.252 -13.151
    3    HB2  GLN  17           HB2      GLN  17   5.702  10.828 -15.192
    4    HB3  GLN  17           HB3      GLN  17   4.206  11.000 -14.272
    5    HG2  GLN  17           HG2      GLN  17   4.740  13.321 -13.754
    6    HG3  GLN  17           HG3      GLN  17   6.304  13.168 -14.555
    7   HE21  GLN  17          HE21      GLN  17   4.393  15.113 -15.422
    8   HE22  GLN  17          HE22      GLN  17   3.841  14.668 -16.965

  No H/Q in entry =           8
  In of MODEL   67
    1    H    ALA  18           H        ALA  18   3.904  10.286 -11.786
    2    HA   ALA  18           HA       ALA  18   3.225  12.687 -10.517
    3    HB1  ALA  18           HB1      ALA  18   2.054  10.249 -10.732
    4    HB2  ALA  18           HB2      ALA  18   1.532  11.479  -9.583
    5    HB3  ALA  18           HB3      ALA  18   2.603  10.179  -9.058

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ARG  19           H        ARG  19   5.060   9.894  -9.246
    2    HA   ARG  19           HA       ARG  19   5.624  11.044  -6.728
    3    HB2  ARG  19           HB2      ARG  19   5.997   8.635  -7.256
    4    HB3  ARG  19           HB3      ARG  19   7.355   9.099  -8.284
    5    HG2  ARG  19           HG2      ARG  19   8.501  10.121  -6.368
    6    HG3  ARG  19           HG3      ARG  19   7.125   9.755  -5.329
    7    HD2  ARG  19           HD2      ARG  19   8.862   8.092  -4.980
    8    HD3  ARG  19           HD3      ARG  19   7.471   7.332  -5.758
    9    HE   ARG  19           HE       ARG  19   9.178   8.122  -7.814
   10   HH21  ARG  19          HH11      ARG  19  10.712   6.692  -8.672
   11   HH22  ARG  19          HH12      ARG  19  11.240   5.336  -7.739
   12   HH11  ARG  19          HH21      ARG  19   9.232   6.092  -5.035
   13   HH12  ARG  19          HH22      ARG  19  10.399   4.996  -5.678

  No H/Q in entry =          13
  In of MODEL   67
    1    H    SER  20           H        SER  20   7.426  11.044  -9.786
    2    HA   SER  20           HA       SER  20   9.697  12.424  -8.974
    3    HB2  SER  20           HB2      SER  20   9.452  11.438 -11.219
    4    HB3  SER  20           HB3      SER  20   8.254  12.661 -11.623
    5    HG   SER  20           HG       SER  20  10.731  13.489 -10.627

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LEU  21           H        LEU  21   6.612  13.741 -10.156
    2    HA   LEU  21           HA       LEU  21   7.326  16.476  -9.937
    3    HB2  LEU  21           HB2      LEU  21   4.637  15.092  -9.844
    4    HB3  LEU  21           HB3      LEU  21   4.829  16.843  -9.846
    5    HG   LEU  21           HG       LEU  21   5.994  15.038 -11.986
    6   HD13  LEU  21          HD11      LEU  21   3.616  14.788 -12.138
    7   HD12  LEU  21          HD12      LEU  21   4.070  15.966 -13.372
    8   HD11  LEU  21          HD13      LEU  21   3.351  16.509 -11.857
    9   HD23  LEU  21          HD21      LEU  21   5.782  17.369 -13.218
   10   HD22  LEU  21          HD22      LEU  21   7.152  17.094 -12.146
   11   HD21  LEU  21          HD23      LEU  21   5.774  18.028 -11.585

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ALA  22           H        ALA  22   5.791  14.211  -7.680
    2    HA   ALA  22           HA       ALA  22   5.226  16.028  -5.610
    3    HB3  ALA  22           HB1      ALA  22   4.428  13.647  -5.768
    4    HB2  ALA  22           HB2      ALA  22   5.032  14.111  -4.177
    5    HB1  ALA  22           HB3      ALA  22   6.035  13.137  -5.253

  No H/Q in entry =           5
  In of MODEL   67
    1    H    TYR  23           H        TYR  23   8.127  13.959  -6.063
    2    HA   TYR  23           HA       TYR  23   9.536  14.959  -3.818
    3    HB2  TYR  23           HB2      TYR  23  10.289  12.939  -4.978
    4    HB3  TYR  23           HB3      TYR  23  10.607  13.872  -6.441
    5    HD1  TYR  23           HD1      TYR  23  11.590  13.515  -2.858
    6    HD2  TYR  23           HD2      TYR  23  12.653  15.024  -6.738
    7    HE1  TYR  23           HE1      TYR  23  13.861  14.062  -2.024
    8    HE2  TYR  23           HE2      TYR  23  14.923  15.571  -5.903
    9    HH   TYR  23           HH       TYR  23  15.791  15.090  -2.488

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ALA  24           H        ALA  24   9.352  16.067  -7.184
    2    HA   ALA  24           HA       ALA  24  11.278  18.125  -6.949
    3    HB2  ALA  24           HB1      ALA  24  10.825  18.193  -9.155
    4    HB3  ALA  24           HB2      ALA  24   9.283  18.964  -8.788
    5    HB1  ALA  24           HB3      ALA  24   9.383  17.209  -8.918

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ALA  25           H        ALA  25   7.801  17.989  -6.310
    2    HA   ALA  25           HA       ALA  25   7.361  20.714  -5.739
    3    HB1  ALA  25           HB1      ALA  25   5.671  18.739  -5.931
    4    HB2  ALA  25           HB2      ALA  25   5.327  20.033  -4.781
    5    HB3  ALA  25           HB3      ALA  25   5.999  18.503  -4.213

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LEU  26           H        LEU  26   8.403  18.021  -3.694
    2    HA   LEU  26           HA       LEU  26   8.540  19.452  -1.258
    3    HB2  LEU  26           HB2      LEU  26   8.603  17.035  -1.251
    4    HB3  LEU  26           HB3      LEU  26  10.068  17.022  -2.230
    5    HG   LEU  26           HG       LEU  26  11.308  18.125  -0.397
    6   HD12  LEU  26          HD11      LEU  26  10.093  18.151   1.869
    7   HD11  LEU  26          HD12      LEU  26   8.599  18.032   0.943
    8   HD13  LEU  26          HD13      LEU  26   9.661  19.424   0.727
    9   HD21  LEU  26          HD21      LEU  26   9.746  15.678   0.486
   10   HD23  LEU  26          HD22      LEU  26  11.272  16.221   1.175
   11   HD22  LEU  26          HD23      LEU  26  11.211  15.662  -0.494

  No H/Q in entry =          11
  In of MODEL   67
    1    H    LYS  27           H        LYS  27  10.936  18.847  -3.795
    2    HA   LYS  27           HA       LYS  27  13.142  20.060  -2.579
    3    HB2  LYS  27           HB2      LYS  27  13.216  18.710  -4.669
    4    HB3  LYS  27           HB3      LYS  27  12.463  20.051  -5.531
    5    HG2  LYS  27           HG2      LYS  27  14.350  21.513  -4.964
    6    HG3  LYS  27           HG3      LYS  27  15.099  20.212  -4.031
    7    HD2  LYS  27           HD2      LYS  27  15.214  18.822  -6.084
    8    HD3  LYS  27           HD3      LYS  27  14.511  20.148  -7.010
    9    HE2  LYS  27           HE2      LYS  27  16.420  21.590  -6.408
   10    HE3  LYS  27           HE3      LYS  27  17.127  20.268  -5.474
   11    HZ3  LYS  27           HZ1      LYS  27  18.107  20.354  -7.665
   12    HZ2  LYS  27           HZ2      LYS  27  16.575  20.254  -8.398
   13    HZ1  LYS  27           HZ3      LYS  27  17.186  18.936  -7.516

  No H/Q in entry =          13
  In of MODEL   67
    1    H    GLN  28           H        GLN  28  10.527  21.473  -4.515
    2    HA   GLN  28           HA       GLN  28  11.519  24.113  -4.675
    3    HB2  GLN  28           HB2      GLN  28   8.672  23.081  -4.546
    4    HB3  GLN  28           HB3      GLN  28   9.106  24.746  -4.929
    5    HG2  GLN  28           HG2      GLN  28  10.056  22.314  -6.471
    6    HG3  GLN  28           HG3      GLN  28   8.737  23.371  -6.973
    7   HE21  GLN  28          HE21      GLN  28  11.819  22.819  -7.791
    8   HE22  GLN  28          HE22      GLN  28  12.349  24.394  -8.135

  No H/Q in entry =           8
  In of MODEL   67
    1    H    ALA  29           H        ALA  29   9.579  22.447  -2.228
    2    HA   ALA  29           HA       ALA  29   9.066  24.647  -0.545
    3    HB2  ALA  29           HB1      ALA  29   8.326  23.088   1.029
    4    HB1  ALA  29           HB2      ALA  29   9.530  21.889   0.558
    5    HB3  ALA  29           HB3      ALA  29   8.142  22.199  -0.483

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LYS  30           H        LYS  30  11.768  22.346  -0.627
    2    HA   LYS  30           HA       LYS  30  13.109  23.286   1.668
    3    HB2  LYS  30           HB2      LYS  30  14.177  21.985  -0.847
    4    HB3  LYS  30           HB3      LYS  30  15.171  22.333   0.569
    5    HG2  LYS  30           HG2      LYS  30  13.609  20.970   1.958
    6    HG3  LYS  30           HG3      LYS  30  12.711  20.558   0.493
    7    HD2  LYS  30           HD2      LYS  30  14.738  19.546  -0.478
    8    HD3  LYS  30           HD3      LYS  30  15.655  19.972   0.969
    9    HE2  LYS  30           HE2      LYS  30  14.141  18.560   2.332
   10    HE3  LYS  30           HE3      LYS  30  13.253  18.114   0.870
   11    HZ2  LYS  30           HZ1      LYS  30  15.030  16.515   1.622
   12    HZ1  LYS  30           HZ2      LYS  30  16.178  17.688   1.164
   13    HZ3  LYS  30           HZ3      LYS  30  15.128  17.016   0.005

  No H/Q in entry =          13
  In of MODEL   67
    1    H    GLN  31           H        GLN  31  12.997  24.490  -1.629
    2    HA   GLN  31           HA       GLN  31  15.175  26.357  -1.220
    3    HB2  GLN  31           HB2      GLN  31  13.120  26.427  -3.434
    4    HB3  GLN  31           HB3      GLN  31  14.749  27.103  -3.444
    5    HG2  GLN  31           HG2      GLN  31  15.182  24.402  -2.869
    6    HG3  GLN  31           HG3      GLN  31  13.871  24.363  -4.040
    7   HE21  GLN  31          HE21      GLN  31  16.702  23.535  -4.459
    8   HE22  GLN  31          HE22      GLN  31  17.279  24.501  -5.729

  No H/Q in entry =           8
  In of MODEL   67
    1    H    GLY  32           H        GLY  32  12.105  26.212  -0.058
    2    HA3  GLY  32           HA2      GLY  32  10.974  27.795   1.220
    3    HA2  GLY  32           HA3      GLY  32  12.111  29.017   0.663

  No H/Q in entry =           3
  In of MODEL   67
    1    H    ASP  33           H        ASP  33  10.711  27.127  -1.821
    2    HA   ASP  33           HA       ASP  33   9.069  29.419  -2.669
    3    HB2  ASP  33           HB2      ASP  33  10.126  26.986  -4.115
    4    HB3  ASP  33           HB3      ASP  33   8.984  28.115  -4.840

  No H/Q in entry =           4
  In of MODEL   67
    1    H    PHE  34           H        PHE  34   7.384  28.965  -1.096
    2    HA   PHE  34           HA       PHE  34   5.975  26.509  -0.991
    3    HB2  PHE  34           HB2      PHE  34   5.051  29.308  -0.308
    4    HB3  PHE  34           HB3      PHE  34   4.187  27.828   0.109
    5    HD1  PHE  34           HD1      PHE  34   6.472  30.201   1.310
    6    HD2  PHE  34           HD2      PHE  34   5.741  25.968   1.263
    7    HE1  PHE  34           HE1      PHE  34   7.870  29.935   3.339
    8    HE2  PHE  34           HE2      PHE  34   7.142  25.706   3.290
    9    HZ   PHE  34           HZ       PHE  34   8.200  27.691   4.328

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ALA  35           H        ALA  35   5.568  29.377  -3.001
    2    HA   ALA  35           HA       ALA  35   3.004  28.792  -4.012
    3    HB1  ALA  35           HB1      ALA  35   4.061  30.170  -6.056
    4    HB3  ALA  35           HB2      ALA  35   5.290  30.518  -4.840
    5    HB2  ALA  35           HB3      ALA  35   3.606  30.947  -4.540

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ALA  36           H        ALA  36   6.217  28.080  -5.383
    2    HA   ALA  36           HA       ALA  36   5.199  26.661  -7.620
    3    HB3  ALA  36           HB1      ALA  36   7.356  26.759  -8.248
    4    HB2  ALA  36           HB2      ALA  36   7.833  25.726  -6.899
    5    HB1  ALA  36           HB3      ALA  36   7.749  27.475  -6.685

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ALA  37           H        ALA  37   6.161  25.658  -4.370
    2    HA   ALA  37           HA       ALA  37   6.067  22.870  -4.797
    3    HB2  ALA  37           HB1      ALA  37   5.840  24.666  -2.418
    4    HB1  ALA  37           HB2      ALA  37   6.956  23.334  -2.716
    5    HB3  ALA  37           HB3      ALA  37   5.293  23.001  -2.235

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LYS  38           H        LYS  38   3.566  25.109  -3.617
    2    HA   LYS  38           HA       LYS  38   1.447  23.320  -3.381
    3    HB2  LYS  38           HB2      LYS  38   1.833  26.072  -3.134
    4    HB3  LYS  38           HB3      LYS  38   0.625  25.938  -4.407
    5    HG2  LYS  38           HG2      LYS  38  -0.832  24.633  -2.955
    6    HG3  LYS  38           HG3      LYS  38   0.418  24.559  -1.705
    7    HD2  LYS  38           HD2      LYS  38   0.262  26.898  -1.259
    8    HD3  LYS  38           HD3      LYS  38  -0.655  27.197  -2.736
    9    HE2  LYS  38           HE2      LYS  38  -2.147  27.250  -0.789
   10    HE3  LYS  38           HE3      LYS  38  -2.543  25.878  -1.828
   11    HZ3  LYS  38           HZ1      LYS  38  -1.826  24.399  -0.298
   12    HZ2  LYS  38           HZ2      LYS  38  -2.156  25.661   0.793
   13    HZ1  LYS  38           HZ3      LYS  38  -0.568  25.392   0.259

  No H/Q in entry =          13
  In of MODEL   67
    1    H    ALA  39           H        ALA  39   2.434  25.209  -6.237
    2    HA   ALA  39           HA       ALA  39   0.339  24.365  -7.928
    3    HB2  ALA  39           HB1      ALA  39   3.077  24.980  -8.997
    4    HB1  ALA  39           HB2      ALA  39   2.129  26.253  -8.227
    5    HB3  ALA  39           HB3      ALA  39   1.499  25.423  -9.650

  No H/Q in entry =           5
  In of MODEL   67
    1    H    MET  40           H        MET  40   3.564  23.029  -7.365
    2    HA   MET  40           HA       MET  40   3.432  21.008  -9.354
    3    HB2  MET  40           HB2      MET  40   5.060  21.215  -6.815
    4    HB3  MET  40           HB3      MET  40   5.289  19.955  -8.029
    5    HG2  MET  40           HG2      MET  40   5.378  22.910  -8.697
    6    HG3  MET  40           HG3      MET  40   6.816  21.991  -8.255
    7    HE3  MET  40           HE1      MET  40   7.647  19.764 -11.067
    8    HE2  MET  40           HE2      MET  40   7.089  19.452  -9.426
    9    HE1  MET  40           HE3      MET  40   8.198  20.786  -9.733

  No H/Q in entry =           9
  In of MODEL   67
    1    H    MET  41           H        MET  41   2.536  21.064  -5.925
    2    HA   MET  41           HA       MET  41   1.974  18.306  -5.643
    3    HB2  MET  41           HB2      MET  41   0.676  20.679  -4.286
    4    HB3  MET  41           HB3      MET  41   0.503  19.004  -3.776
    5    HG2  MET  41           HG2      MET  41   3.216  19.195  -3.828
    6    HG3  MET  41           HG3      MET  41   2.796  20.859  -3.431
    7    HE2  MET  41           HE1      MET  41  -0.248  19.642  -1.688
    8    HE1  MET  41           HE2      MET  41   0.584  21.146  -2.071
    9    HE3  MET  41           HE3      MET  41   0.527  20.577  -0.403

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ASP  42           H        ASP  42  -0.039  21.053  -6.607
    2    HA   ASP  42           HA       ASP  42  -2.495  19.720  -6.730
    3    HB2  ASP  42           HB2      ASP  42  -1.761  22.282  -6.992
    4    HB3  ASP  42           HB3      ASP  42  -1.926  21.887  -8.700

  No H/Q in entry =           4
  In of MODEL   67
    1    H    GLN  43           H        GLN  43  -0.062  20.281  -9.246
    2    HA   GLN  43           HA       GLN  43  -1.475  18.976 -11.326
    3    HB2  GLN  43           HB2      GLN  43   1.491  19.459 -10.961
    4    HB3  GLN  43           HB3      GLN  43   0.762  18.826 -12.439
    5    HG2  GLN  43           HG2      GLN  43  -0.727  20.870 -12.474
    6    HG3  GLN  43           HG3      GLN  43   0.241  21.517 -11.152
    7   HE21  GLN  43          HE21      GLN  43   0.409  23.134 -13.240
    8   HE22  GLN  43          HE22      GLN  43   1.816  22.896 -14.155

  No H/Q in entry =           8
  In of MODEL   67
    1    H    SER  44           H        SER  44   0.876  17.811  -8.948
    2    HA   SER  44           HA       SER  44   1.176  15.201  -9.973
    3    HB2  SER  44           HB2      SER  44   2.099  16.631  -7.742
    4    HB3  SER  44           HB3      SER  44   1.225  15.258  -7.066
    5    HG   SER  44           HG       SER  44   3.327  14.614  -7.503

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ARG  45           H        ARG  45  -1.116  16.546  -7.623
    2    HA   ARG  45           HA       ARG  45  -2.525  14.201  -6.979
    3    HB2  ARG  45           HB2      ARG  45  -2.693  16.372  -5.788
    4    HB3  ARG  45           HB3      ARG  45  -3.550  17.047  -7.171
    5    HG2  ARG  45           HG2      ARG  45  -5.333  15.341  -6.877
    6    HG3  ARG  45           HG3      ARG  45  -4.488  14.721  -5.458
    7    HD2  ARG  45           HD2      ARG  45  -4.664  16.990  -4.402
    8    HD3  ARG  45           HD3      ARG  45  -5.652  17.520  -5.780
    9    HE   ARG  45           HE       ARG  45  -6.782  15.157  -4.732
   10   HH21  ARG  45          HH11      ARG  45  -8.611  15.253  -3.451
   11   HH22  ARG  45          HH12      ARG  45  -8.986  16.697  -2.581
   12   HH11  ARG  45          HH21      ARG  45  -6.196  18.398  -3.713
   13   HH12  ARG  45          HH22      ARG  45  -7.613  18.479  -2.728

  No H/Q in entry =          13
  In of MODEL   67
    1    H    MET  46           H        MET  46  -3.097  16.610  -9.528
    2    HA   MET  46           HA       MET  46  -5.454  15.462 -10.577
    3    HB2  MET  46           HB2      MET  46  -3.341  17.270 -11.757
    4    HB3  MET  46           HB3      MET  46  -4.725  16.721 -12.707
    5    HG2  MET  46           HG2      MET  46  -6.270  17.673 -11.075
    6    HG3  MET  46           HG3      MET  46  -4.930  18.139 -10.033
    7    HE3  MET  46           HE1      MET  46  -5.220  18.930 -14.275
    8    HE2  MET  46           HE2      MET  46  -6.647  19.825 -13.759
    9    HE1  MET  46           HE3      MET  46  -6.468  18.131 -13.308

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ALA  47           H        ALA  47  -2.035  14.946 -11.352
    2    HA   ALA  47           HA       ALA  47  -2.410  13.220 -13.559
    3    HB3  ALA  47           HB1      ALA  47  -0.221  14.087 -13.220
    4    HB2  ALA  47           HB2      ALA  47  -0.097  12.358 -12.886
    5    HB1  ALA  47           HB3      ALA  47  -0.170  13.512 -11.553

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LEU  48           H        LEU  48  -2.129  12.584 -10.087
    2    HA   LEU  48           HA       LEU  48  -2.253   9.746 -10.242
    3    HB2  LEU  48           HB2      LEU  48  -2.986  11.673  -8.026
    4    HB3  LEU  48           HB3      LEU  48  -2.909   9.922  -7.824
    5    HG   LEU  48           HG       LEU  48  -0.598  11.596  -8.835
    6   HD13  LEU  48          HD11      LEU  48  -0.861  12.371  -6.644
    7   HD12  LEU  48          HD12      LEU  48   0.290  11.052  -6.450
    8   HD11  LEU  48          HD13      LEU  48  -1.409  10.807  -6.043
    9   HD22  LEU  48          HD21      LEU  48  -0.125   9.405  -9.477
   10   HD21  LEU  48          HD22      LEU  48  -0.995   8.700  -8.116
   11   HD23  LEU  48          HD23      LEU  48   0.587   9.437  -7.864

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ASN  49           H        ASN  49  -4.689  12.263  -9.830
    2    HA   ASN  49           HA       ASN  49  -6.888  10.622  -9.278
    3    HB2  ASN  49           HB2      ASN  49  -6.921  13.044  -8.954
    4    HB3  ASN  49           HB3      ASN  49  -6.763  13.303 -10.687
    5   HD21  ASN  49          HD21      ASN  49  -8.955  14.395  -9.307
    6   HD22  ASN  49          HD22      ASN  49 -10.369  13.581  -9.769

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLU  50           H        GLU  50  -5.613  11.803 -12.373
    2    HA   GLU  50           HA       GLU  50  -7.588  10.567 -14.007
    3    HB2  GLU  50           HB2      GLU  50  -6.108  12.370 -14.830
    4    HB3  GLU  50           HB3      GLU  50  -4.725  11.284 -14.699
    5    HG2  GLU  50           HG2      GLU  50  -5.722   9.757 -16.329
    6    HG3  GLU  50           HG3      GLU  50  -7.173  10.750 -16.410

  No H/Q in entry =           6
  In of MODEL   67
    1    H    ALA  51           H        ALA  51  -4.422   9.543 -12.817
    2    HA   ALA  51           HA       ALA  51  -4.315   7.087 -14.234
    3    HB2  ALA  51           HB1      ALA  51  -2.332   6.780 -13.144
    4    HB1  ALA  51           HB2      ALA  51  -3.007   7.210 -11.573
    5    HB3  ALA  51           HB3      ALA  51  -2.544   8.476 -12.711

  No H/Q in entry =           5
  In of MODEL   67
    1    H    HIS  52           H        HIS  52  -5.463   7.934 -10.979
    2    HA   HIS  52           HA       HIS  52  -6.171   5.332 -10.143
    3    HB2  HIS  52           HB2      HIS  52  -6.003   7.307  -8.643
    4    HB3  HIS  52           HB3      HIS  52  -7.473   7.953  -9.372
    5    HD1  HIS  52           HD1      HIS  52  -9.707   6.652  -8.918
    6    HD2  HIS  52           HD2      HIS  52  -6.415   5.181  -6.827
    7    HE1  HIS  52           HE1      HIS  52 -10.624   5.104  -7.137
    8    HE2  HIS  52           HE2      HIS  52  -8.629   4.198  -5.852

  No H/Q in entry =           8
  In of MODEL   67
    1    H    LEU  53           H        LEU  53  -7.974   7.807 -11.923
    2    HA   LEU  53           HA       LEU  53 -10.493   6.542 -11.922
    3    HB2  LEU  53           HB2      LEU  53  -9.198   8.505 -13.802
    4    HB3  LEU  53           HB3      LEU  53 -10.808   7.860 -14.112
    5    HG   LEU  53           HG       LEU  53 -10.045   9.187 -11.489
    6   HD11  LEU  53          HD11      LEU  53 -11.410  10.388 -13.918
    7   HD13  LEU  53          HD12      LEU  53  -9.796  10.798 -13.333
    8   HD12  LEU  53          HD13      LEU  53 -11.213  11.185 -12.362
    9   HD22  LEU  53          HD21      LEU  53 -12.037   8.003 -11.096
   10   HD21  LEU  53          HD22      LEU  53 -12.601   8.219 -12.749
   11   HD23  LEU  53          HD23      LEU  53 -12.667   9.558 -11.621

  No H/Q in entry =          11
  In of MODEL   67
    1    H    VAL  54           H        VAL  54  -7.756   6.313 -14.173
    2    HA   VAL  54           HA       VAL  54  -9.007   4.555 -16.009
    3    HB   VAL  54           HB       VAL  54  -6.091   5.030 -15.341
    4   HG12  VAL  54          HG11      VAL  54  -5.867   3.940 -17.730
    5   HG11  VAL  54          HG12      VAL  54  -7.402   3.176 -17.319
    6   HG13  VAL  54          HG13      VAL  54  -5.984   2.907 -16.307
    7   HG22  VAL  54          HG21      VAL  54  -6.844   6.980 -16.383
    8   HG21  VAL  54          HG22      VAL  54  -8.052   6.130 -17.345
    9   HG23  VAL  54          HG23      VAL  54  -6.348   6.030 -17.784

  No H/Q in entry =           9
  In of MODEL   67
    1    H    GLN  55           H        GLN  55  -7.000   3.989 -13.118
    2    HA   GLN  55           HA       GLN  55  -6.943   1.171 -13.373
    3    HB2  GLN  55           HB2      GLN  55  -5.370   2.051 -11.862
    4    HB3  GLN  55           HB3      GLN  55  -6.572   3.031 -11.027
    5    HG2  GLN  55           HG2      GLN  55  -7.273   1.282  -9.705
    6    HG3  GLN  55           HG3      GLN  55  -7.068   0.092 -10.983
    7   HE21  GLN  55          HE21      GLN  55  -5.458  -1.375 -10.496
    8   HE22  GLN  55          HE22      GLN  55  -4.065  -1.039  -9.591

  No H/Q in entry =           8
  In of MODEL   67
    1    H    THR  56           H        THR  56  -9.242   3.361 -11.749
    2    HA   THR  56           HA       THR  56 -10.841   1.496 -10.450
    3    HB   THR  56           HB       THR  56 -11.925   3.890 -11.954
    4    HG1  THR  56           HG1      THR  56 -10.211   3.693  -9.815
    5   HG22  THR  56          HG21      THR  56 -13.393   3.894  -9.828
    6   HG21  THR  56          HG22      THR  56 -12.805   2.249  -9.584
    7   HG23  THR  56          HG23      THR  56 -13.715   2.654 -11.040

  No H/Q in entry =           7
  In of MODEL   67
    1    H    LYS  57           H        LYS  57 -11.047   2.579 -13.836
    2    HA   LYS  57           HA       LYS  57 -13.225   0.915 -14.578
    3    HB2  LYS  57           HB2      LYS  57 -12.336   2.854 -15.902
    4    HB3  LYS  57           HB3      LYS  57 -10.907   1.902 -16.273
    5    HG2  LYS  57           HG2      LYS  57 -12.243   0.260 -17.464
    6    HG3  LYS  57           HG3      LYS  57 -13.731   1.073 -16.995
    7    HD2  LYS  57           HD2      LYS  57 -13.331   1.811 -19.213
    8    HD3  LYS  57           HD3      LYS  57 -12.769   3.145 -18.207
    9    HE2  LYS  57           HE2      LYS  57 -10.460   2.449 -18.449
   10    HE3  LYS  57           HE3      LYS  57 -10.933   0.956 -19.257
   11    HZ3  LYS  57           HZ1      LYS  57 -11.138   1.997 -21.189
   12    HZ2  LYS  57           HZ2      LYS  57 -10.306   3.295 -20.476
   13    HZ1  LYS  57           HZ3      LYS  57 -12.006   3.291 -20.518

  No H/Q in entry =          13
  In of MODEL   67
    1    H    LEU  58           H        LEU  58  -9.726   0.445 -14.537
    2    HA   LEU  58           HA       LEU  58  -9.768  -2.073 -15.823
    3    HB2  LEU  58           HB2      LEU  58  -7.711  -0.803 -14.026
    4    HB3  LEU  58           HB3      LEU  58  -7.472  -2.328 -14.879
    5    HG   LEU  58           HG       LEU  58  -8.202   0.283 -16.242
    6   HD11  LEU  58          HD11      LEU  58  -5.567  -0.983 -15.562
    7   HD13  LEU  58          HD12      LEU  58  -6.043   0.714 -15.513
    8   HD12  LEU  58          HD13      LEU  58  -5.719  -0.063 -17.060
    9   HD22  LEU  58          HD21      LEU  58  -8.803  -1.274 -17.829
   10   HD21  LEU  58          HD22      LEU  58  -7.773  -2.532 -17.150
   11   HD23  LEU  58          HD23      LEU  58  -7.072  -1.268 -18.160

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  59           H        ILE  59 -10.565  -1.158 -12.569
    2    HA   ILE  59           HA       ILE  59 -10.240  -3.928 -11.620
    3    HB   ILE  59           HB       ILE  59  -9.765  -1.665 -10.226
    4   HG12  ILE  59          HG12      ILE  59 -11.156  -3.994  -8.887
    5   HG13  ILE  59          HG13      ILE  59  -9.521  -4.102  -9.489
    6   HG21  ILE  59          HG21      ILE  59 -12.302  -1.129 -10.471
    7   HG23  ILE  59          HG22      ILE  59 -11.572  -0.945  -8.893
    8   HG22  ILE  59          HG23      ILE  59 -12.534  -2.374  -9.265
    9   HD13  ILE  59          HD11      ILE  59  -9.478  -3.505  -7.132
   10   HD12  ILE  59          HD12      ILE  59 -10.519  -2.123  -7.442
   11   HD11  ILE  59          HD13      ILE  59  -8.878  -2.155  -8.089

  No H/Q in entry =          11
  In of MODEL   67
    1    H    GLU  60           H        GLU  60 -12.776  -1.585 -12.420
    2    HA   GLU  60           HA       GLU  60 -14.973  -3.076 -11.395
    3    HB2  GLU  60           HB2      GLU  60 -15.232  -0.731 -11.958
    4    HB3  GLU  60           HB3      GLU  60 -14.800  -1.044 -13.636
    5    HG2  GLU  60           HG2      GLU  60 -17.139  -2.480 -12.404
    6    HG3  GLU  60           HG3      GLU  60 -17.331  -0.844 -13.001

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLY  61           H        GLY  61 -13.313  -3.083 -14.517
    2    HA3  GLY  61           HA2      GLY  61 -15.055  -5.310 -15.397
    3    HA2  GLY  61           HA3      GLY  61 -14.203  -4.216 -16.480

  No H/Q in entry =           3
  In of MODEL   67
    1    H    ASP  62           H        ASP  62 -12.833  -5.677 -13.600
    2    HA   ASP  62           HA       ASP  62 -10.518  -6.571 -14.953
    3    HB2  ASP  62           HB2      ASP  62 -10.012  -7.680 -12.791
    4    HB3  ASP  62           HB3      ASP  62 -10.505  -6.003 -12.586

  No H/Q in entry =           4
  In of MODEL   67
    1    H    ALA  63           H        ALA  63 -13.540  -8.262 -14.112
    2    HA   ALA  63           HA       ALA  63 -12.748 -10.931 -14.500
    3    HB3  ALA  63           HB1      ALA  63 -15.098 -11.386 -14.890
    4    HB1  ALA  63           HB2      ALA  63 -15.393  -9.713 -15.358
    5    HB2  ALA  63           HB3      ALA  63 -15.001 -10.105 -13.683

  No H/Q in entry =           5
  In of MODEL   67
    1    H    GLY  64           H        GLY  64 -14.985 -10.965 -16.735
    2    HA3  GLY  64           HA2      GLY  64 -15.084 -10.909 -19.061
    3    HA2  GLY  64           HA3      GLY  64 -13.462 -10.231 -19.095

  No H/Q in entry =           3
  In of MODEL   67
    1    H    GLU  65           H        GLU  65 -13.674 -12.943 -17.069
    2    HA   GLU  65           HA       GLU  65 -12.923 -14.784 -19.233
    3    HB2  GLU  65           HB2      GLU  65 -11.249 -14.176 -16.799
    4    HB3  GLU  65           HB3      GLU  65 -11.004 -15.590 -17.825
    5    HG2  GLU  65           HG2      GLU  65 -10.642 -14.160 -19.772
    6    HG3  GLU  65           HG3      GLU  65 -10.976 -12.723 -18.806

  No H/Q in entry =           6
  In of MODEL   67
    1    H    GLY  66           H        GLY  66 -13.153 -16.919 -18.852
    2    HA3  GLY  66           HA2      GLY  66 -15.288 -17.998 -17.687
    3    HA2  GLY  66           HA3      GLY  66 -13.779 -18.881 -17.821

  No H/Q in entry =           3
  In of MODEL   67
    1    H    LYS  67           H        LYS  67 -12.182 -18.336 -16.013
    2    HA   LYS  67           HA       LYS  67 -13.500 -18.945 -13.528
    3    HB2  LYS  67           HB2      LYS  67 -10.566 -18.693 -14.191
    4    HB3  LYS  67           HB3      LYS  67 -11.236 -19.373 -12.703
    5    HG2  LYS  67           HG2      LYS  67 -11.983 -20.397 -15.452
    6    HG3  LYS  67           HG3      LYS  67 -10.654 -21.073 -14.514
    7    HD2  LYS  67           HD2      LYS  67 -12.402 -21.337 -12.616
    8    HD3  LYS  67           HD3      LYS  67 -13.601 -21.112 -13.892
    9    HE2  LYS  67           HE2      LYS  67 -12.710 -23.000 -15.139
   10    HE3  LYS  67           HE3      LYS  67 -11.381 -23.174 -13.991
   11    HZ1  LYS  67           HZ1      LYS  67 -14.007 -23.200 -12.795
   12    HZ3  LYS  67           HZ2      LYS  67 -12.678 -24.221 -12.526
   13    HZ2  LYS  67           HZ3      LYS  67 -13.713 -24.499 -13.844

  No H/Q in entry =          13
  In of MODEL   67
    1    H    MET  68           H        MET  68 -13.206 -17.976 -11.558
    2    HA   MET  68           HA       MET  68 -13.749 -15.311 -11.308
    3    HB2  MET  68           HB2      MET  68 -12.408 -17.187  -9.368
    4    HB3  MET  68           HB3      MET  68 -12.977 -15.577  -8.928
    5    HG2  MET  68           HG2      MET  68 -15.254 -16.168  -9.616
    6    HG3  MET  68           HG3      MET  68 -14.700 -17.763 -10.131
    7    HE1  MET  68           HE1      MET  68 -15.171 -15.223  -7.537
    8    HE3  MET  68           HE2      MET  68 -13.683 -15.687  -6.716
    9    HE2  MET  68           HE3      MET  68 -15.240 -16.038  -5.967

  No H/Q in entry =           9
  In of MODEL   67
    1    H    LYS  69           H        LYS  69 -10.732 -16.439 -12.319
    2    HA   LYS  69           HA       LYS  69  -8.979 -14.720 -10.953
    3    HB2  LYS  69           HB2      LYS  69  -8.249 -16.716 -12.171
    4    HB3  LYS  69           HB3      LYS  69  -8.644 -15.930 -13.702
    5    HG2  LYS  69           HG2      LYS  69  -7.018 -14.150 -13.232
    6    HG3  LYS  69           HG3      LYS  69  -6.654 -14.875 -11.668
    7    HD2  LYS  69           HD2      LYS  69  -5.845 -16.915 -12.804
    8    HD3  LYS  69           HD3      LYS  69  -6.192 -16.177 -14.368
    9    HE2  LYS  69           HE2      LYS  69  -3.820 -15.891 -13.837
   10    HE3  LYS  69           HE3      LYS  69  -4.626 -14.325 -13.812
   11    HZ2  LYS  69           HZ1      LYS  69  -3.134 -15.416 -11.797
   12    HZ1  LYS  69           HZ2      LYS  69  -4.737 -15.616 -11.275
   13    HZ3  LYS  69           HZ3      LYS  69  -4.156 -14.069 -11.673

  No H/Q in entry =          13
  In of MODEL   67
    1    H    VAL  70           H        VAL  70  -7.810 -12.849 -11.555
    2    HA   VAL  70           HA       VAL  70  -9.184 -11.098 -13.518
    3    HB   VAL  70           HB       VAL  70  -8.507  -9.218 -12.047
    4   HG12  VAL  70          HG11      VAL  70 -10.084 -11.379 -10.617
    5   HG11  VAL  70          HG12      VAL  70 -10.743 -10.294 -11.843
    6   HG13  VAL  70          HG13      VAL  70 -10.178  -9.646 -10.303
    7   HG21  VAL  70          HG21      VAL  70  -7.302 -11.490 -10.486
    8   HG23  VAL  70          HG22      VAL  70  -7.919 -10.089  -9.612
    9   HG22  VAL  70          HG23      VAL  70  -6.637  -9.889 -10.805

  No H/Q in entry =           9
  In of MODEL   67
    1    H    SER  71           H        SER  71  -7.710  -9.278 -14.235
    2    HA   SER  71           HA       SER  71  -5.432 -10.288 -15.559
    3    HB2  SER  71           HB2      SER  71  -6.731  -8.251 -16.248
    4    HB3  SER  71           HB3      SER  71  -6.024  -7.397 -14.879
    5    HG   SER  71           HG       SER  71  -4.412  -8.776 -16.737

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LEU  72           H        LEU  72  -3.441 -10.625 -14.886
    2    HA   LEU  72           HA       LEU  72  -2.707 -10.415 -12.178
    3    HB2  LEU  72           HB2      LEU  72  -1.065 -10.863 -14.666
    4    HB3  LEU  72           HB3      LEU  72  -0.402 -10.948 -13.037
    5    HG   LEU  72           HG       LEU  72  -2.772 -12.610 -13.954
    6   HD13  LEU  72          HD11      LEU  72  -1.292 -14.408 -14.399
    7   HD12  LEU  72          HD12      LEU  72   0.058 -13.601 -13.602
    8   HD11  LEU  72          HD13      LEU  72  -0.525 -13.013 -15.160
    9   HD21  LEU  72          HD21      LEU  72  -1.053 -12.491 -11.483
   10   HD23  LEU  72          HD22      LEU  72  -1.786 -14.021 -11.941
   11   HD22  LEU  72          HD23      LEU  72  -2.804 -12.623 -11.600

  No H/Q in entry =          11
  In of MODEL   67
    1    H    VAL  73           H        VAL  73  -1.979  -8.412 -14.965
    2    HA   VAL  73           HA       VAL  73  -0.033  -6.734 -13.872
    3    HB   VAL  73           HB       VAL  73  -0.411  -5.320 -15.731
    4   HG13  VAL  73          HG11      VAL  73  -0.461  -6.898 -17.576
    5   HG12  VAL  73          HG12      VAL  73  -1.276  -8.100 -16.576
    6   HG11  VAL  73          HG13      VAL  73   0.390  -7.645 -16.224
    7   HG21  VAL  73          HG21      VAL  73  -3.195  -6.431 -15.563
    8   HG23  VAL  73          HG22      VAL  73  -2.595  -5.846 -17.114
    9   HG22  VAL  73          HG23      VAL  73  -2.674  -4.755 -15.730

  No H/Q in entry =           9
  In of MODEL   67
    1    H    LEU  74           H        LEU  74  -3.429  -6.808 -13.300
    2    HA   LEU  74           HA       LEU  74  -4.013  -4.144 -12.689
    3    HB2  LEU  74           HB2      LEU  74  -5.763  -5.787 -12.852
    4    HB3  LEU  74           HB3      LEU  74  -5.077  -6.720 -11.525
    5    HG   LEU  74           HG       LEU  74  -5.506  -4.836  -9.980
    6   HD12  LEU  74          HD11      LEU  74  -7.097  -3.043 -10.946
    7   HD11  LEU  74          HD12      LEU  74  -6.516  -3.564 -12.527
    8   HD13  LEU  74          HD13      LEU  74  -5.385  -2.900 -11.345
    9   HD22  LEU  74          HD21      LEU  74  -7.719  -5.383  -9.711
   10   HD21  LEU  74          HD22      LEU  74  -7.216  -6.645 -10.814
   11   HD23  LEU  74          HD23      LEU  74  -8.071  -5.252 -11.432

  No H/Q in entry =          11
  In of MODEL   67
    1    H    VAL  75           H        VAL  75  -2.994  -6.740 -10.528
    2    HA   VAL  75           HA       VAL  75  -2.766  -5.187  -8.187
    3    HB   VAL  75           HB       VAL  75  -1.304  -7.702  -8.980
    4   HG11  VAL  75          HG11      VAL  75  -1.483  -6.228  -6.314
    5   HG13  VAL  75          HG12      VAL  75  -0.028  -6.498  -7.262
    6   HG12  VAL  75          HG13      VAL  75  -0.847  -7.858  -6.512
    7   HG23  VAL  75          HG21      VAL  75  -2.964  -8.674  -7.353
    8   HG22  VAL  75          HG22      VAL  75  -3.716  -7.992  -8.796
    9   HG21  VAL  75          HG23      VAL  75  -3.748  -7.095  -7.277

  No H/Q in entry =           9
  In of MODEL   67
    1    H    GLU  76           H        GLU  76  -0.378  -5.981 -10.732
    2    HA   GLU  76           HA       GLU  76   1.829  -4.658  -9.587
    3    HB2  GLU  76           HB2      GLU  76   1.950  -6.151 -11.591
    4    HB3  GLU  76           HB3      GLU  76   1.130  -4.918 -12.534
    5    HG2  GLU  76           HG2      GLU  76   2.992  -3.354 -12.153
    6    HG3  GLU  76           HG3      GLU  76   3.827  -4.543 -11.171

  No H/Q in entry =           6
  In of MODEL   67
    1    H    ALA  77           H        ALA  77  -0.698  -3.430 -11.766
    2    HA   ALA  77           HA       ALA  77   0.324  -0.796 -11.951
    3    HB2  ALA  77           HB1      ALA  77  -1.921  -0.196 -12.750
    4    HB3  ALA  77           HB2      ALA  77  -2.548  -1.743 -12.177
    5    HB1  ALA  77           HB3      ALA  77  -1.378  -1.700 -13.495

  No H/Q in entry =           5
  In of MODEL   67
    1    H    GLN  78           H        GLN  78  -1.954  -2.321  -9.728
    2    HA   GLN  78           HA       GLN  78  -2.727   0.009  -8.327
    3    HB2  GLN  78           HB2      GLN  78  -3.864  -2.236  -8.234
    4    HB3  GLN  78           HB3      GLN  78  -2.530  -2.811  -7.236
    5    HG2  GLN  78           HG2      GLN  78  -3.017  -1.069  -5.572
    6    HG3  GLN  78           HG3      GLN  78  -4.350  -0.484  -6.566
    7   HE21  GLN  78          HE21      GLN  78  -4.841  -1.438  -3.920
    8   HE22  GLN  78          HE22      GLN  78  -5.715  -2.889  -4.025

  No H/Q in entry =           8
  In of MODEL   67
    1    H    LEU  79           H        LEU  79  -0.073  -2.277  -7.884
    2    HA   LEU  79           HA       LEU  79   0.923  -1.387  -5.432
    3    HB2  LEU  79           HB2      LEU  79   1.766  -3.408  -6.501
    4    HB3  LEU  79           HB3      LEU  79   2.417  -2.465  -7.838
    5    HG   LEU  79           HG       LEU  79   3.992  -1.342  -6.343
    6   HD13  LEU  79          HD11      LEU  79   2.999  -1.082  -4.272
    7   HD12  LEU  79          HD12      LEU  79   4.064  -2.443  -3.930
    8   HD11  LEU  79          HD13      LEU  79   2.354  -2.723  -4.253
    9   HD23  LEU  79          HD21      LEU  79   5.182  -3.502  -5.441
   10   HD22  LEU  79          HD22      LEU  79   4.974  -3.303  -7.178
   11   HD21  LEU  79          HD23      LEU  79   3.887  -4.359  -6.280

  No H/Q in entry =          11
  In of MODEL   67
    1    H    HIS  80           H        HIS  80   1.792  -0.286  -8.711
    2    HA   HIS  80           HA       HIS  80   3.625   1.684  -7.799
    3    HB2  HIS  80           HB2      HIS  80   2.318   0.999 -10.376
    4    HB3  HIS  80           HB3      HIS  80   2.931   2.645 -10.210
    5    HD1  HIS  80           HD1      HIS  80   5.334   2.919 -10.742
    6    HD2  HIS  80           HD2      HIS  80   4.477  -0.981  -9.541
    7    HE1  HIS  80           HE1      HIS  80   7.509   1.618 -10.915
    8    HE2  HIS  80           HE2      HIS  80   6.998  -0.762 -10.186

  No H/Q in entry =           8
  In of MODEL   67
    1    H    LEU  81           H        LEU  81   0.219   1.878  -8.766
    2    HA   LEU  81           HA       LEU  81  -0.025   4.674  -8.438
    3    HB2  LEU  81           HB2      LEU  81  -2.063   2.450  -8.347
    4    HB3  LEU  81           HB3      LEU  81  -2.497   4.157  -8.256
    5    HG   LEU  81           HG       LEU  81  -0.825   2.987 -10.497
    6   HD12  LEU  81          HD11      LEU  81  -3.059   3.327 -11.788
    7   HD11  LEU  81          HD12      LEU  81  -3.809   3.269 -10.193
    8   HD13  LEU  81          HD13      LEU  81  -2.882   1.891 -10.782
    9   HD23  LEU  81          HD21      LEU  81  -1.904   5.140 -11.593
   10   HD22  LEU  81          HD22      LEU  81  -0.482   5.298 -10.566
   11   HD21  LEU  81          HD23      LEU  81  -2.080   5.664  -9.920

  No H/Q in entry =          11
  In of MODEL   67
    1    H    MET  82           H        MET  82  -0.702   1.997  -6.183
    2    HA   MET  82           HA       MET  82  -1.731   3.597  -4.094
    3    HB2  MET  82           HB2      MET  82  -0.384   0.897  -4.134
    4    HB3  MET  82           HB3      MET  82  -0.949   1.630  -2.635
    5    HG2  MET  82           HG2      MET  82  -2.696   1.150  -5.069
    6    HG3  MET  82           HG3      MET  82  -2.623   0.077  -3.672
    7    HE3  MET  82           HE1      MET  82  -4.319   1.748  -0.853
    8    HE2  MET  82           HE2      MET  82  -2.587   2.008  -1.045
    9    HE1  MET  82           HE3      MET  82  -3.292   0.457  -1.494

  No H/Q in entry =           9
  In of MODEL   67
    1    H    THR  83           H        THR  83   1.557   2.478  -4.794
    2    HA   THR  83           HA       THR  83   2.794   3.574  -2.500
    3    HB   THR  83           HB       THR  83   4.882   3.496  -3.982
    4    HG1  THR  83           HG1      THR  83   4.630   2.969  -6.004
    5   HG22  THR  83          HG21      THR  83   4.411   0.842  -4.308
    6   HG21  THR  83          HG22      THR  83   3.130   1.235  -3.164
    7   HG23  THR  83          HG23      THR  83   4.814   1.563  -2.751

  No H/Q in entry =           7
  In of MODEL   67
    1    H    SER  84           H        SER  84   2.423   4.852  -5.801
    2    HA   SER  84           HA       SER  84   3.788   7.280  -5.355
    3    HB2  SER  84           HB2      SER  84   1.702   6.464  -7.365
    4    HB3  SER  84           HB3      SER  84   2.396   8.085  -7.344
    5    HG   SER  84           HG       SER  84   3.743   5.597  -7.637

  No H/Q in entry =           5
  In of MODEL   67
    1    H    MET  85           H        MET  85   0.287   6.557  -5.168
    2    HA   MET  85           HA       MET  85  -0.546   9.177  -4.567
    3    HB2  MET  85           HB2      MET  85  -2.089   7.383  -5.228
    4    HB3  MET  85           HB3      MET  85  -1.802   6.576  -3.688
    5    HG2  MET  85           HG2      MET  85  -2.682   8.524  -2.478
    6    HG3  MET  85           HG3      MET  85  -2.916   9.378  -4.001
    7    HE2  MET  85           HE1      MET  85  -5.162   5.964  -2.115
    8    HE1  MET  85           HE2      MET  85  -3.462   6.403  -1.957
    9    HE3  MET  85           HE3      MET  85  -3.973   5.345  -3.268

  No H/Q in entry =           9
  In of MODEL   67
    1    H    LEU  86           H        LEU  86   0.355   6.509  -2.424
    2    HA   LEU  86           HA       LEU  86  -0.155   7.820   0.019
    3    HB2  LEU  86           HB2      LEU  86   0.282   5.344  -0.374
    4    HB3  LEU  86           HB3      LEU  86   1.993   5.756  -0.476
    5    HG   LEU  86           HG       LEU  86   1.689   6.923   1.792
    6   HD11  LEU  86          HD11      LEU  86  -1.015   6.184   1.332
    7   HD13  LEU  86          HD12      LEU  86  -0.335   6.926   2.779
    8   HD12  LEU  86          HD13      LEU  86  -0.445   5.171   2.663
    9   HD23  LEU  86          HD21      LEU  86   1.229   3.935   1.920
   10   HD22  LEU  86          HD22      LEU  86   2.247   4.935   2.954
   11   HD21  LEU  86          HD23      LEU  86   2.737   4.603   1.294

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ALA  87           H        ALA  87   2.815   7.491  -1.882
    2    HA   ALA  87           HA       ALA  87   4.543   8.885  -0.166
    3    HB3  ALA  87           HB1      ALA  87   4.616   7.868  -2.872
    4    HB2  ALA  87           HB2      ALA  87   5.958   8.185  -1.777
    5    HB1  ALA  87           HB3      ALA  87   5.354   9.471  -2.820

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ARG  88           H        ARG  88   2.597  10.039  -2.880
    2    HA   ARG  88           HA       ARG  88   3.403  12.720  -2.769
    3    HB2  ARG  88           HB2      ARG  88   2.128  11.580  -4.620
    4    HB3  ARG  88           HB3      ARG  88   0.676  11.741  -3.631
    5    HG2  ARG  88           HG2      ARG  88   1.726  14.310  -3.555
    6    HG3  ARG  88           HG3      ARG  88   2.137  13.789  -5.186
    7    HD2  ARG  88           HD2      ARG  88  -0.006  13.893  -5.875
    8    HD3  ARG  88           HD3      ARG  88  -0.597  13.048  -4.444
    9    HE   ARG  88           HE       ARG  88  -0.755  15.828  -4.864
   10   HH21  ARG  88          HH11      ARG  88  -1.260  17.165  -3.126
   11   HH22  ARG  88          HH12      ARG  88  -0.963  16.626  -1.509
   12   HH11  ARG  88          HH21      ARG  88   0.244  13.556  -2.492
   13   HH12  ARG  88          HH22      ARG  88  -0.130  14.577  -1.150

  No H/Q in entry =          13
  In of MODEL   67
    1    H    GLU  89           H        GLU  89   0.686  11.080  -1.116
    2    HA   GLU  89           HA       GLU  89  -0.388  13.406   0.091
    3    HB2  GLU  89           HB2      GLU  89  -1.534  11.180   0.011
    4    HB3  GLU  89           HB3      GLU  89  -0.411  10.613   1.248
    5    HG2  GLU  89           HG2      GLU  89  -1.204  12.323   2.809
    6    HG3  GLU  89           HG3      GLU  89  -2.253  13.005   1.569

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LEU  90           H        LEU  90   2.040  11.085   1.257
    2    HA   LEU  90           HA       LEU  90   2.422  12.327   3.784
    3    HB2  LEU  90           HB2      LEU  90   4.165  10.529   2.101
    4    HB3  LEU  90           HB3      LEU  90   4.598  11.042   3.737
    5    HG   LEU  90           HG       LEU  90   1.944   9.729   3.089
    6   HD12  LEU  90          HD11      LEU  90   3.062   7.670   4.094
    7   HD11  LEU  90          HD12      LEU  90   4.594   8.507   3.845
    8   HD13  LEU  90          HD13      LEU  90   3.571   8.111   2.463
    9   HD22  LEU  90          HD21      LEU  90   1.700  10.658   5.211
   10   HD21  LEU  90          HD22      LEU  90   3.418  10.529   5.586
   11   HD23  LEU  90          HD23      LEU  90   2.393   9.095   5.640

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  91           H        ILE  91   4.017  12.687   0.650
    2    HA   ILE  91           HA       ILE  91   6.020  14.493   1.479
    3    HB   ILE  91           HB       ILE  91   4.691  14.017  -1.195
    4   HG12  ILE  91          HG12      ILE  91   7.521  13.494  -0.232
    5   HG13  ILE  91          HG13      ILE  91   6.225  12.313  -0.063
    6   HG22  ILE  91          HG21      ILE  91   6.928  15.334  -1.894
    7   HG21  ILE  91          HG22      ILE  91   6.636  16.140  -0.352
    8   HG23  ILE  91          HG23      ILE  91   5.408  16.184  -1.616
    9   HD13  ILE  91          HD11      ILE  91   6.037  11.990  -2.369
   10   HD12  ILE  91          HD12      ILE  91   7.775  12.210  -2.163
   11   HD11  ILE  91          HD13      ILE  91   6.780  13.546  -2.746

  No H/Q in entry =          11
  In of MODEL   67
    1    H    THR  92           H        THR  92   2.660  14.969   0.485
    2    HA   THR  92           HA       THR  92   2.671  17.792   0.423
    3    HB   THR  92           HB       THR  92   0.480  15.827   1.133
    4    HG1  THR  92           HG1      THR  92   0.774  15.642  -0.953
    5   HG22  THR  92          HG21      THR  92  -0.895  18.007   0.415
    6   HG21  THR  92          HG22      THR  92   0.512  18.814   1.105
    7   HG23  THR  92          HG23      THR  92  -0.440  17.706   2.092

  No H/Q in entry =           7
  In of MODEL   67
    1    H    GLU  93           H        GLU  93   2.104  15.501   3.081
    2    HA   GLU  93           HA       GLU  93   1.606  17.414   5.100
    3    HB2  GLU  93           HB2      GLU  93   2.883  14.672   5.333
    4    HB3  GLU  93           HB3      GLU  93   2.211  15.609   6.668
    5    HG2  GLU  93           HG2      GLU  93   0.578  14.851   4.237
    6    HG3  GLU  93           HG3      GLU  93   0.672  13.828   5.665

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LEU  94           H        LEU  94   4.587  15.891   3.939
    2    HA   LEU  94           HA       LEU  94   6.361  17.016   5.818
    3    HB2  LEU  94           HB2      LEU  94   6.738  16.041   2.986
    4    HB3  LEU  94           HB3      LEU  94   8.080  16.681   3.929
    5    HG   LEU  94           HG       LEU  94   6.316  14.510   5.074
    6   HD11  LEU  94          HD11      LEU  94   8.399  14.254   2.934
    7   HD13  LEU  94          HD12      LEU  94   6.941  13.300   3.202
    8   HD12  LEU  94          HD13      LEU  94   8.367  13.029   4.203
    9   HD23  LEU  94          HD21      LEU  94   8.503  13.945   6.217
   10   HD22  LEU  94          HD22      LEU  94   7.859  15.533   6.635
   11   HD21  LEU  94          HD23      LEU  94   9.191  15.393   5.487

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  95           H        ILE  95   5.224  18.200   2.672
    2    HA   ILE  95           HA       ILE  95   6.828  20.536   2.604
    3    HB   ILE  95           HB       ILE  95   4.169  19.887   1.310
    4   HG12  ILE  95          HG12      ILE  95   6.957  20.186   0.161
    5   HG13  ILE  95          HG13      ILE  95   6.289  18.642   0.680
    6   HG21  ILE  95          HG21      ILE  95   5.951  22.330   1.080
    7   HG23  ILE  95          HG22      ILE  95   4.227  22.286   1.444
    8   HG22  ILE  95          HG23      ILE  95   4.797  21.876  -0.174
    9   HD13  ILE  95          HD11      ILE  95   4.721  18.586  -1.042
   10   HD12  ILE  95          HD12      ILE  95   6.078  19.385  -1.837
   11   HD11  ILE  95          HD13      ILE  95   4.721  20.339  -1.239

  No H/Q in entry =          11
  In of MODEL   67
    1    H    GLU  96           H        GLU  96   3.576  19.929   3.913
    2    HA   GLU  96           HA       GLU  96   2.995  22.585   4.665
    3    HB2  GLU  96           HB2      GLU  96   1.297  20.825   4.685
    4    HB3  GLU  96           HB3      GLU  96   2.152  19.987   5.978
    5    HG2  GLU  96           HG2      GLU  96   1.156  21.286   7.550
    6    HG3  GLU  96           HG3      GLU  96   1.709  22.751   6.750

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LEU  97           H        LEU  97   4.810  20.011   6.284
    2    HA   LEU  97           HA       LEU  97   5.196  21.356   8.752
    3    HB2  LEU  97           HB2      LEU  97   6.697  19.165   7.334
    4    HB3  LEU  97           HB3      LEU  97   7.303  19.843   8.843
    5    HG   LEU  97           HG       LEU  97   4.477  18.788   8.545
    6   HD12  LEU  97          HD11      LEU  97   5.395  16.764   9.755
    7   HD11  LEU  97          HD12      LEU  97   7.013  17.372   9.404
    8   HD13  LEU  97          HD13      LEU  97   5.931  16.928   8.083
    9   HD23  LEU  97          HD21      LEU  97   4.937  18.490  11.107
   10   HD22  LEU  97          HD22      LEU  97   4.577  20.106  10.503
   11   HD21  LEU  97          HD23      LEU  97   6.244  19.643  10.841

  No H/Q in entry =          11
  In of MODEL   67
    1    H    HIS  98           H        HIS  98   7.054  21.343   5.719
    2    HA   HIS  98           HA       HIS  98   9.234  22.893   6.608
    3    HB2  HIS  98           HB2      HIS  98   7.925  22.654   3.887
    4    HB3  HIS  98           HB3      HIS  98   9.380  23.613   4.171
    5    HD1  HIS  98           HD1      HIS  98   8.119  20.060   4.199
    6    HD2  HIS  98           HD2      HIS  98  11.731  22.105   4.607
    7    HE1  HIS  98           HE1      HIS  98   9.948  18.304   4.136
    8    HE2  HIS  98           HE2      HIS  98  12.152  19.529   4.384

  No H/Q in entry =           8
  In of MODEL   67
    1    H    GLU  99           H        GLU  99   6.020  23.773   5.445
    2    HA   GLU  99           HA       GLU  99   6.439  26.582   5.383
    3    HB2  GLU  99           HB2      GLU  99   4.538  25.439   4.262
    4    HB3  GLU  99           HB3      GLU  99   3.844  25.089   5.844
    5    HG2  GLU  99           HG2      GLU  99   3.700  27.484   6.344
    6    HG3  GLU  99           HG3      GLU  99   4.475  27.871   4.811

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LYS 100           H        LYS 100   5.287  24.365   7.912
    2    HA   LYS 100           HA       LYS 100   4.738  26.429   9.807
    3    HB2  LYS 100           HB2      LYS 100   5.272  23.470  10.152
    4    HB3  LYS 100           HB3      LYS 100   4.846  24.550  11.486
    5    HG2  LYS 100           HG2      LYS 100   2.784  25.217  10.246
    6    HG3  LYS 100           HG3      LYS 100   3.189  24.041   8.992
    7    HD2  LYS 100           HD2      LYS 100   3.092  22.222  10.656
    8    HD3  LYS 100           HD3      LYS 100   2.704  23.392  11.920
    9    HE2  LYS 100           HE2      LYS 100   0.655  24.042  10.665
   10    HE3  LYS 100           HE3      LYS 100   1.032  22.816   9.449
   11    HZ1  LYS 100           HZ1      LYS 100   0.769  22.155  12.331
   12    HZ3  LYS 100           HZ2      LYS 100   0.732  21.100  10.997
   13    HZ2  LYS 100           HZ3      LYS 100  -0.566  22.159  11.282

  No H/Q in entry =          13
  In of MODEL   67
    1    H    LEU 101           H        LEU 101   7.632  24.591   8.962
    2    HA   LEU 101           HA       LEU 101   9.252  25.409  11.158
    3    HB2  LEU 101           HB2      LEU 101   9.820  24.411   8.378
    4    HB3  LEU 101           HB3      LEU 101  11.135  25.058   9.353
    5    HG   LEU 101           HG       LEU 101   9.277  22.930  10.427
    6   HD12  LEU 101          HD11      LEU 101  11.306  21.404   9.811
    7   HD11  LEU 101          HD12      LEU 101  11.686  22.661   8.636
    8   HD13  LEU 101          HD13      LEU 101  10.144  21.810   8.549
    9   HD21  LEU 101          HD21      LEU 101  12.020  23.998  11.142
   10   HD23  LEU 101          HD22      LEU 101  11.456  22.434  11.725
   11   HD22  LEU 101          HD23      LEU 101  10.587  23.904  12.166

  No H/Q in entry =          11
  In of MODEL   67
    1    H    LYS 102           H        LYS 102   7.687  27.294   9.022
    2    HA   LYS 102           HA       LYS 102   7.797  29.585   8.728
    3    HB2  LYS 102           HB2      LYS 102   9.369  29.448  10.820
    4    HB3  LYS 102           HB3      LYS 102  10.666  29.622   9.655
    5    HG2  LYS 102           HG2      LYS 102   8.594  31.607  10.524
    6    HG3  LYS 102           HG3      LYS 102  10.309  31.841  10.265
    7    HD2  LYS 102           HD2      LYS 102   8.342  31.446   7.974
    8    HD3  LYS 102           HD3      LYS 102   8.751  33.020   8.640
    9    HE2  LYS 102           HE2      LYS 102  10.098  31.813   6.561
   10    HE3  LYS 102           HE3      LYS 102  10.738  33.111   7.569
   11    HZ2  LYS 102           HZ1      LYS 102  12.229  31.184   7.389
   12    HZ1  LYS 102           HZ2      LYS 102  11.055  30.220   8.137
   13    HZ3  LYS 102           HZ3      LYS 102  11.771  31.497   8.992

  No H/Q in entry =          13
  In of MODEL   67
    1    H    ALA 103           H        ALA 103  11.031  28.197   8.151
    2    HA   ALA 103           HA       ALA 103  12.007  29.557   6.070
    3    HB2  ALA 103           HB1      ALA 103  12.855  27.330   5.140
    4    HB1  ALA 103           HB2      ALA 103  11.954  26.570   6.451
    5    HB3  ALA 103           HB3      ALA 103  13.262  27.695   6.817

  No H/Q in entry =           5
  In of MODEL   67
    1    H1   LYS   3           H1       LYS   3 -31.329   5.812 -19.933
    2    H2   LYS   3           H3       LYS   3 -30.315   5.571 -21.273
    3    H3   LYS   3           H2       LYS   3 -31.686   4.593 -21.059
    4    HA   LYS   3           HA       LYS   3 -30.664   3.212 -19.661
    5    HB2  LYS   3           HB2      LYS   3 -28.406   4.706 -20.941
    6    HB3  LYS   3           HB3      LYS   3 -28.064   3.489 -19.711
    7    HG2  LYS   3           HG2      LYS   3 -29.423   1.884 -21.104
    8    HG3  LYS   3           HG3      LYS   3 -29.394   3.104 -22.377
    9    HD2  LYS   3           HD2      LYS   3 -26.910   3.058 -22.293
   10    HD3  LYS   3           HD3      LYS   3 -27.008   1.739 -21.127
   11    HE2  LYS   3           HE2      LYS   3 -28.451   0.548 -22.881
   12    HE3  LYS   3           HE3      LYS   3 -27.848   1.760 -24.011
   13    HZ3  LYS   3           HZ1      LYS   3 -26.013   0.586 -24.273
   14    HZ2  LYS   3           HZ2      LYS   3 -26.625  -0.615 -23.239
   15    HZ1  LYS   3           HZ3      LYS   3 -25.678   0.646 -22.610

  No H/Q in entry =          15
  In of MODEL   67
    1    H    LYS   4           H        LYS   4 -30.741   3.038 -17.603
    2    HA   LYS   4           HA       LYS   4 -30.096   5.319 -15.910
    3    HB2  LYS   4           HB2      LYS   4 -31.233   2.585 -15.266
    4    HB3  LYS   4           HB3      LYS   4 -31.063   3.912 -14.118
    5    HG2  LYS   4           HG2      LYS   4 -32.836   3.837 -16.564
    6    HG3  LYS   4           HG3      LYS   4 -33.350   3.850 -14.879
    7    HD2  LYS   4           HD2      LYS   4 -32.718   6.086 -14.571
    8    HD3  LYS   4           HD3      LYS   4 -31.658   6.076 -15.980
    9    HE2  LYS   4           HE2      LYS   4 -33.613   7.404 -16.449
   10    HE3  LYS   4           HE3      LYS   4 -33.641   5.946 -17.439
   11    HZ3  LYS   4           HZ1      LYS   4 -35.213   4.969 -15.928
   12    HZ2  LYS   4           HZ2      LYS   4 -35.799   6.458 -16.498
   13    HZ1  LYS   4           HZ3      LYS   4 -35.160   6.342 -14.928

  No H/Q in entry =          13
  In of MODEL   67
    1    H    HIS   5           H        HIS   5 -28.651   5.419 -14.298
    2    HA   HIS   5           HA       HIS   5 -26.318   3.654 -14.624
    3    HB2  HIS   5           HB2      HIS   5 -26.659   6.383 -13.382
    4    HB3  HIS   5           HB3      HIS   5 -25.154   5.466 -13.358
    5    HD1  HIS   5           HD1      HIS   5 -23.694   6.726 -14.910
    6    HD2  HIS   5           HD2      HIS   5 -27.456   6.033 -16.525
    7    HE1  HIS   5           HE1      HIS   5 -23.509   7.347 -17.349
    8    HE2  HIS   5           HE2      HIS   5 -25.802   6.911 -18.303

  No H/Q in entry =           8
  In of MODEL   67
    1    H    ILE   6           H        ILE   6 -26.067   2.068 -13.326
    2    HA   ILE   6           HA       ILE   6 -27.085   2.271 -10.573
    3    HB   ILE   6           HB       ILE   6 -26.178  -0.152 -12.134
    4   HG12  ILE   6          HG12      ILE   6 -28.955   0.704 -11.307
    5   HG13  ILE   6          HG13      ILE   6 -28.296   0.906 -12.930
    6   HG23  ILE   6          HG21      ILE   6 -26.545  -1.440 -10.297
    7   HG22  ILE   6          HG22      ILE   6 -27.740  -0.333  -9.617
    8   HG21  ILE   6          HG23      ILE   6 -26.020   0.044  -9.499
    9   HD13  ILE   6          HD11      ILE   6 -28.695  -1.216 -13.467
   10   HD12  ILE   6          HD12      ILE   6 -29.730  -1.246 -12.039
   11   HD11  ILE   6          HD13      ILE   6 -28.063  -1.814 -11.933

  No H/Q in entry =          11
  In of MODEL   67
    1    H    TYR   7           H        TYR   7 -25.360   2.936  -9.253
    2    HA   TYR   7           HA       TYR   7 -22.617   2.055  -9.909
    3    HB2  TYR   7           HB2      TYR   7 -23.660   4.443  -8.406
    4    HB3  TYR   7           HB3      TYR   7 -21.963   3.969  -8.429
    5    HD1  TYR   7           HD1      TYR   7 -22.938   3.047 -11.546
    6    HD2  TYR   7           HD2      TYR   7 -22.386   6.603  -9.261
    7    HE1  TYR   7           HE1      TYR   7 -22.508   4.318 -13.614
    8    HE2  TYR   7           HE2      TYR   7 -21.997   7.877 -11.320
    9    HH   TYR   7           HH       TYR   7 -22.185   7.817 -13.556

  No H/Q in entry =           9
  In of MODEL   67
    1    H    LEU   8           H        LEU   8 -21.637   0.707  -8.586
    2    HA   LEU   8           HA       LEU   8 -22.791   0.146  -5.926
    3    HB2  LEU   8           HB2      LEU   8 -21.023  -1.448  -7.760
    4    HB3  LEU   8           HB3      LEU   8 -21.223  -1.859  -6.057
    5    HG   LEU   8           HG       LEU   8 -23.692  -2.085  -6.515
    6   HD13  LEU   8          HD11      LEU   8 -23.823  -0.842  -8.609
    7   HD12  LEU   8          HD12      LEU   8 -24.310  -2.515  -8.880
    8   HD11  LEU   8          HD13      LEU   8 -22.708  -1.971  -9.376
    9   HD23  LEU   8          HD21      LEU   8 -22.346  -4.070  -8.221
   10   HD22  LEU   8          HD22      LEU   8 -23.447  -4.284  -6.860
   11   HD21  LEU   8          HD23      LEU   8 -21.753  -3.894  -6.569

  No H/Q in entry =          11
  In of MODEL   67
    1    H    PHE   9           H        PHE   9 -21.566   0.561  -4.125
    2    HA   PHE   9           HA       PHE   9 -18.794   1.568  -4.569
    3    HB2  PHE   9           HB2      PHE   9 -20.872   2.575  -2.629
    4    HB3  PHE   9           HB3      PHE   9 -19.178   3.046  -2.597
    5    HD1  PHE   9           HD1      PHE   9 -18.222   4.446  -4.333
    6    HD2  PHE   9           HD2      PHE   9 -22.354   3.298  -4.458
    7    HE1  PHE   9           HE1      PHE   9 -18.639   6.135  -6.097
    8    HE2  PHE   9           HE2      PHE   9 -22.773   4.999  -6.216
    9    HZ   PHE   9           HZ       PHE   9 -20.913   6.412  -7.041

  No H/Q in entry =           9
  In of MODEL   67
    1    H    SER  10           H        SER  10 -17.218   0.626  -3.449
    2    HA   SER  10           HA       SER  10 -17.444  -0.275  -0.759
    3    HB2  SER  10           HB2      SER  10 -18.608  -2.162  -1.885
    4    HB3  SER  10           HB3      SER  10 -17.178  -2.413  -2.874
    5    HG   SER  10           HG       SER  10 -17.347  -3.728  -0.934

  No H/Q in entry =           5
  In of MODEL   67
    1    H    SER  11           H        SER  11 -15.443  -0.125   0.107
    2    HA   SER  11           HA       SER  11 -13.266   0.807  -1.384
    3    HB2  SER  11           HB2      SER  11 -13.784   0.839   1.191
    4    HB3  SER  11           HB3      SER  11 -12.803  -0.628   1.187
    5    HG   SER  11           HG       SER  11 -11.116   0.528   0.327

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ALA  12           H        ALA  12 -14.385  -1.923  -2.239
    2    HA   ALA  12           HA       ALA  12 -11.756  -3.073  -2.760
    3    HB2  ALA  12           HB1      ALA  12 -12.122  -4.465  -0.954
    4    HB3  ALA  12           HB2      ALA  12 -12.866  -5.407  -2.245
    5    HB1  ALA  12           HB3      ALA  12 -13.875  -4.451  -1.162

  No H/Q in entry =           5
  In of MODEL   67
    1    H    GLY  13           H        GLY  13 -12.411  -2.116  -4.810
    2    HA3  GLY  13           HA2      GLY  13 -14.613  -2.739  -6.355
    3    HA2  GLY  13           HA3      GLY  13 -13.019  -2.370  -7.027

  No H/Q in entry =           3
  In of MODEL   67
    1    H    MET  14           H        MET  14 -11.655  -4.726  -6.004
    2    HA   MET  14           HA       MET  14 -12.134  -6.469  -8.132
    3    HB2  MET  14           HB2      MET  14 -10.034  -6.572  -6.876
    4    HB3  MET  14           HB3      MET  14 -10.875  -7.231  -5.473
    5    HG2  MET  14           HG2      MET  14 -11.530  -9.210  -6.816
    6    HG3  MET  14           HG3      MET  14 -10.678  -8.542  -8.208
    7    HE3  MET  14           HE1      MET  14  -7.103  -8.785  -7.641
    8    HE2  MET  14           HE2      MET  14  -7.840  -7.340  -6.954
    9    HE1  MET  14           HE3      MET  14  -8.490  -8.029  -8.439

  No H/Q in entry =           9
  In of MODEL   67
    1    H    SER  15           H        SER  15 -13.281  -6.894  -4.773
    2    HA   SER  15           HA       SER  15 -14.644  -9.339  -5.359
    3    HB2  SER  15           HB2      SER  15 -14.140  -8.727  -3.016
    4    HB3  SER  15           HB3      SER  15 -15.266  -7.378  -3.135
    5    HG   SER  15           HG       SER  15 -15.789 -10.163  -3.191

  No H/Q in entry =           5
  In of MODEL   67
    1    H    THR  16           H        THR  16 -15.748  -5.960  -5.243
    2    HA   THR  16           HA       THR  16 -18.510  -6.537  -5.887
    3    HB   THR  16           HB       THR  16 -17.016  -3.931  -6.327
    4    HG1  THR  16           HG1      THR  16 -18.425  -4.368  -3.982
    5   HG21  THR  16          HG21      THR  16 -19.454  -4.392  -7.126
    6   HG23  THR  16          HG22      THR  16 -19.127  -2.907  -6.216
    7   HG22  THR  16          HG23      THR  16 -19.853  -4.307  -5.415

  No H/Q in entry =           7
  In of MODEL   67
    1    H    SER  17           H        SER  17 -15.573  -5.911  -7.645
    2    HA   SER  17           HA       SER  17 -16.683  -5.163 -10.152
    3    HB2  SER  17           HB2      SER  17 -14.034  -6.443  -9.445
    4    HB3  SER  17           HB3      SER  17 -14.465  -5.958 -11.085
    5    HG   SER  17           HG       SER  17 -13.450  -4.468  -9.167

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LEU  18           H        LEU  18 -16.057  -8.313  -8.740
    2    HA   LEU  18           HA       LEU  18 -16.572  -9.793 -11.124
    3    HB2  LEU  18           HB2      LEU  18 -15.356 -10.752  -9.218
    4    HB3  LEU  18           HB3      LEU  18 -16.802 -10.606  -8.222
    5    HG   LEU  18           HG       LEU  18 -17.976 -12.196  -9.649
    6   HD12  LEU  18          HD11      LEU  18 -16.393 -13.445 -11.318
    7   HD11  LEU  18          HD12      LEU  18 -15.462 -11.946 -11.268
    8   HD13  LEU  18          HD13      LEU  18 -17.141 -11.926 -11.808
    9   HD22  LEU  18          HD21      LEU  18 -16.913 -14.125  -8.901
   10   HD21  LEU  18          HD22      LEU  18 -16.464 -12.875  -7.739
   11   HD23  LEU  18          HD23      LEU  18 -15.314 -13.382  -8.976

  No H/Q in entry =          11
  In of MODEL   67
    1    H    LEU  19           H        LEU  19 -18.609  -8.675  -8.426
    2    HA   LEU  19           HA       LEU  19 -21.029  -9.907  -9.312
    3    HB2  LEU  19           HB2      LEU  19 -20.820  -9.103  -7.046
    4    HB3  LEU  19           HB3      LEU  19 -20.558  -7.457  -7.622
    5    HG   LEU  19           HG       LEU  19 -22.870  -7.305  -8.338
    6   HD12  LEU  19          HD11      LEU  19 -24.457  -9.124  -7.750
    7   HD11  LEU  19          HD12      LEU  19 -23.083 -10.138  -7.312
    8   HD13  LEU  19          HD13      LEU  19 -23.287  -9.606  -8.979
    9   HD22  LEU  19          HD21      LEU  19 -22.507  -6.562  -6.149
   10   HD21  LEU  19          HD22      LEU  19 -22.342  -8.203  -5.526
   11   HD23  LEU  19          HD23      LEU  19 -23.921  -7.609  -6.041

  No H/Q in entry =          11
  In of MODEL   67
    1    H    VAL  20           H        VAL  20 -19.604  -6.700  -9.940
    2    HA   VAL  20           HA       VAL  20 -21.718  -5.690 -11.526
    3    HB   VAL  20           HB       VAL  20 -18.744  -5.022 -11.605
    4   HG12  VAL  20          HG11      VAL  20 -19.569  -2.908 -12.777
    5   HG11  VAL  20          HG12      VAL  20 -21.072  -3.780 -13.077
    6   HG13  VAL  20          HG13      VAL  20 -19.556  -4.379 -13.751
    7   HG21  VAL  20          HG21      VAL  20 -21.129  -3.801 -10.263
    8   HG23  VAL  20          HG22      VAL  20 -19.655  -2.882 -10.560
    9   HG22  VAL  20          HG23      VAL  20 -19.604  -4.326  -9.549

  No H/Q in entry =           9
  In of MODEL   67
    1    H    SER  21           H        SER  21 -18.895  -7.655 -12.541
    2    HA   SER  21           HA       SER  21 -19.642  -7.524 -15.301
    3    HB2  SER  21           HB2      SER  21 -18.151  -9.447 -15.642
    4    HB3  SER  21           HB3      SER  21 -17.368  -8.196 -14.678
    5    HG   SER  21           HG       SER  21 -17.960  -9.420 -12.823

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LYS  22           H        LYS  22 -20.689  -9.772 -12.776
    2    HA   LYS  22           HA       LYS  22 -22.160 -11.403 -14.643
    3    HB2  LYS  22           HB2      LYS  22 -21.413 -12.139 -12.341
    4    HB3  LYS  22           HB3      LYS  22 -22.699 -11.123 -11.692
    5    HG2  LYS  22           HG2      LYS  22 -23.612 -13.268 -11.705
    6    HG3  LYS  22           HG3      LYS  22 -24.285 -12.503 -13.144
    7    HD2  LYS  22           HD2      LYS  22 -22.680 -13.645 -14.552
    8    HD3  LYS  22           HD3      LYS  22 -21.889 -14.338 -13.135
    9    HE2  LYS  22           HE2      LYS  22 -23.928 -15.597 -12.604
   10    HE3  LYS  22           HE3      LYS  22 -24.734 -14.893 -14.005
   11    HZ2  LYS  22           HZ1      LYS  22 -23.938 -17.139 -14.420
   12    HZ1  LYS  22           HZ2      LYS  22 -22.342 -16.642 -14.113
   13    HZ3  LYS  22           HZ3      LYS  22 -23.187 -16.011 -15.444

  No H/Q in entry =          13
  In of MODEL   67
    1    H    MET  23           H        MET  23 -22.982  -8.527 -12.745
    2    HA   MET  23           HA       MET  23 -25.779  -8.666 -13.294
    3    HB2  MET  23           HB2      MET  23 -23.997  -6.323 -12.661
    4    HB3  MET  23           HB3      MET  23 -25.744  -6.193 -12.863
    5    HG2  MET  23           HG2      MET  23 -26.132  -7.534 -10.918
    6    HG3  MET  23           HG3      MET  23 -24.414  -7.906 -10.773
    7    HE2  MET  23           HE1      MET  23 -26.816  -4.328  -9.566
    8    HE1  MET  23           HE2      MET  23 -27.026  -5.280 -11.034
    9    HE3  MET  23           HE3      MET  23 -26.025  -3.829 -11.063

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ARG  24           H        ARG  24 -23.035  -7.147 -15.016
    2    HA   ARG  24           HA       ARG  24 -24.533  -5.853 -17.018
    3    HB2  ARG  24           HB2      ARG  24 -21.690  -6.919 -17.026
    4    HB3  ARG  24           HB3      ARG  24 -22.366  -6.014 -18.358
    5    HG2  ARG  24           HG2      ARG  24 -22.680  -4.026 -16.885
    6    HG3  ARG  24           HG3      ARG  24 -21.995  -4.959 -15.528
    7    HD2  ARG  24           HD2      ARG  24 -20.581  -4.461 -18.190
    8    HD3  ARG  24           HD3      ARG  24 -20.313  -3.527 -16.725
    9    HE   ARG  24           HE       ARG  24 -19.727  -5.889 -15.781
   10   HH21  ARG  24          HH11      ARG  24 -17.533  -5.839 -15.290
   11   HH22  ARG  24          HH12      ARG  24 -16.380  -5.555 -16.547
   12   HH11  ARG  24          HH21      ARG  24 -18.931  -4.688 -18.844
   13   HH12  ARG  24          HH22      ARG  24 -17.217  -4.884 -18.648

  No H/Q in entry =          13
  In of MODEL   67
    1    H    ALA  25           H        ALA  25 -23.339  -9.168 -16.775
    2    HA   ALA  25           HA       ALA  25 -23.909  -9.974 -19.432
    3    HB1  ALA  25           HB1      ALA  25 -23.177 -11.999 -18.757
    4    HB3  ALA  25           HB2      ALA  25 -24.255 -12.024 -17.361
    5    HB2  ALA  25           HB3      ALA  25 -22.720 -11.163 -17.273

  No H/Q in entry =           5
  In of MODEL   67
    1    H    GLN  26           H        GLN  26 -25.778 -10.099 -16.437
    2    HA   GLN  26           HA       GLN  26 -28.079 -11.338 -17.507
    3    HB2  GLN  26           HB2      GLN  26 -27.641  -9.617 -15.086
    4    HB3  GLN  26           HB3      GLN  26 -29.182 -10.369 -15.471
    5    HG2  GLN  26           HG2      GLN  26 -26.571 -11.775 -14.985
    6    HG3  GLN  26           HG3      GLN  26 -27.950 -11.720 -13.895
    7   HE21  GLN  26          HE21      GLN  26 -26.666 -13.837 -15.185
    8   HE22  GLN  26          HE22      GLN  26 -27.672 -14.894 -16.013

  No H/Q in entry =           8
  In of MODEL   67
    1    H    ALA  27           H        ALA  27 -27.227  -7.927 -17.051
    2    HA   ALA  27           HA       ALA  27 -29.729  -6.878 -17.855
    3    HB1  ALA  27           HB1      ALA  27 -27.966  -5.541 -16.693
    4    HB3  ALA  27           HB2      ALA  27 -28.552  -4.765 -18.166
    5    HB2  ALA  27           HB3      ALA  27 -26.997  -5.598 -18.167

  No H/Q in entry =           5
  In of MODEL   67
    1    H    GLU  28           H        GLU  28 -26.974  -8.011 -19.702
    2    HA   GLU  28           HA       GLU  28 -27.894  -6.953 -22.219
    3    HB2  GLU  28           HB2      GLU  28 -25.511  -7.593 -21.569
    4    HB3  GLU  28           HB3      GLU  28 -26.015  -9.266 -21.805
    5    HG2  GLU  28           HG2      GLU  28 -24.858  -8.433 -23.744
    6    HG3  GLU  28           HG3      GLU  28 -26.542  -8.788 -24.123

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LYS  29           H        LYS  29 -28.016 -10.088 -20.613
    2    HA   LYS  29           HA       LYS  29 -29.256 -11.554 -22.660
    3    HB2  LYS  29           HB2      LYS  29 -28.215 -12.546 -20.656
    4    HB3  LYS  29           HB3      LYS  29 -29.516 -11.884 -19.670
    5    HG2  LYS  29           HG2      LYS  29 -31.130 -13.275 -20.784
    6    HG3  LYS  29           HG3      LYS  29 -29.901 -13.865 -21.900
    7    HD2  LYS  29           HD2      LYS  29 -28.759 -15.034 -20.168
    8    HD3  LYS  29           HD3      LYS  29 -29.702 -14.234 -18.914
    9    HE2  LYS  29           HE2      LYS  29 -30.397 -16.593 -19.324
   10    HE3  LYS  29           HE3      LYS  29 -31.697 -15.425 -19.568
   11    HZ1  LYS  29           HZ1      LYS  29 -31.094 -15.507 -21.988
   12    HZ3  LYS  29           HZ2      LYS  29 -31.793 -16.920 -21.357
   13    HZ2  LYS  29           HZ3      LYS  29 -30.120 -16.849 -21.628

  No H/Q in entry =          13
  In of MODEL   67
    1    H    TYR  30           H        TYR  30 -30.732  -9.521 -20.145
    2    HA   TYR  30           HA       TYR  30 -33.364 -10.009 -21.433
    3    HB2  TYR  30           HB2      TYR  30 -32.778  -8.885 -18.685
    4    HB3  TYR  30           HB3      TYR  30 -34.380  -9.167 -19.366
    5    HD1  TYR  30           HD1      TYR  30 -35.236 -11.476 -19.630
    6    HD2  TYR  30           HD2      TYR  30 -31.443 -10.696 -17.857
    7    HE1  TYR  30           HE1      TYR  30 -35.106 -13.814 -18.869
    8    HE2  TYR  30           HE2      TYR  30 -31.315 -13.020 -17.100
    9    HH   TYR  30           HH       TYR  30 -32.884 -15.398 -18.255

  No H/Q in entry =           9
  In of MODEL   67
    1    H    GLU  31           H        GLU  31 -31.232  -7.956 -22.169
    2    HA   GLU  31           HA       GLU  31 -31.195  -5.785 -22.956
    3    HB2  GLU  31           HB2      GLU  31 -34.066  -6.557 -23.524
    4    HB3  GLU  31           HB3      GLU  31 -33.245  -5.159 -24.218
    5    HG2  GLU  31           HG2      GLU  31 -31.723  -6.543 -25.410
    6    HG3  GLU  31           HG3      GLU  31 -32.269  -7.984 -24.553

  No H/Q in entry =           6
  In of MODEL   67
    1    H    VAL  32           H        VAL  32 -31.437  -5.733 -20.225
    2    HA   VAL  32           HA       VAL  32 -33.357  -3.674 -19.561
    3    HB   VAL  32           HB       VAL  32 -30.966  -4.638 -17.960
    4   HG12  VAL  32          HG11      VAL  32 -32.548  -3.881 -16.075
    5   HG11  VAL  32          HG12      VAL  32 -33.383  -2.976 -17.337
    6   HG13  VAL  32          HG13      VAL  32 -31.689  -2.638 -16.986
    7   HG21  VAL  32          HG21      VAL  32 -32.684  -6.387 -18.703
    8   HG23  VAL  32          HG22      VAL  32 -33.759  -5.603 -17.545
    9   HG22  VAL  32          HG23      VAL  32 -32.235  -6.300 -17.000

  No H/Q in entry =           9
  In of MODEL   67
    1    HA   PRO  33           HA       PRO  33 -30.370  -0.648 -21.141
    2    HB2  PRO  33           HB2      PRO  33 -31.935   1.535 -21.005
    3    HB3  PRO  33           HB3      PRO  33 -32.357   0.241 -22.126
    4    HG2  PRO  33           HG2      PRO  33 -33.379   0.688 -19.321
    5    HG3  PRO  33           HG3      PRO  33 -34.316   0.481 -20.800
    6    HD2  PRO  33           HD2      PRO  33 -33.835  -1.607 -19.161
    7    HD3  PRO  33           HD3      PRO  33 -33.866  -1.821 -20.912

  No H/Q in entry =           7
  In of MODEL   67
    1    H    VAL  34           H        VAL  34 -29.123  -1.195 -19.183
    2    HA   VAL  34           HA       VAL  34 -28.922   1.209 -17.492
    3    HB   VAL  34           HB       VAL  34 -28.334  -0.271 -15.569
    4   HG12  VAL  34          HG11      VAL  34 -30.729  -1.207 -15.313
    5   HG11  VAL  34          HG12      VAL  34 -31.041  -0.429 -16.863
    6   HG13  VAL  34          HG13      VAL  34 -30.532   0.539 -15.478
    7   HG21  VAL  34          HG21      VAL  34 -28.441  -2.267 -17.612
    8   HG23  VAL  34          HG22      VAL  34 -29.509  -2.676 -16.269
    9   HG22  VAL  34          HG23      VAL  34 -27.802  -2.352 -15.971

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ILE  35           H        ILE  35 -26.970   1.676 -16.615
    2    HA   ILE  35           HA       ILE  35 -24.615   0.425 -17.864
    3    HB   ILE  35           HB       ILE  35 -25.096   3.290 -17.013
    4   HG12  ILE  35          HG12      ILE  35 -24.045   2.050 -19.563
    5   HG13  ILE  35          HG13      ILE  35 -25.694   2.626 -19.318
    6   HG21  ILE  35          HG21      ILE  35 -22.494   1.826 -17.308
    7   HG23  ILE  35          HG22      ILE  35 -22.995   2.973 -16.067
    8   HG22  ILE  35          HG23      ILE  35 -22.602   3.544 -17.689
    9   HD11  ILE  35          HD11      ILE  35 -24.356   4.844 -18.660
   10   HD13  ILE  35          HD12      ILE  35 -24.859   4.476 -20.311
   11   HD12  ILE  35          HD13      ILE  35 -23.206   4.138 -19.796

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ILE  36           H        ILE  36 -23.383  -0.595 -16.264
    2    HA   ILE  36           HA       ILE  36 -23.880  -0.039 -13.390
    3    HB   ILE  36           HB       ILE  36 -22.970  -2.702 -14.530
    4   HG12  ILE  36          HG12      ILE  36 -25.807  -1.978 -13.795
    5   HG13  ILE  36          HG13      ILE  36 -25.212  -1.916 -15.454
    6   HG23  ILE  36          HG21      ILE  36 -23.331  -3.574 -12.435
    7   HG22  ILE  36          HG22      ILE  36 -24.496  -2.326 -11.993
    8   HG21  ILE  36          HG23      ILE  36 -22.773  -1.951 -12.032
    9   HD13  ILE  36          HD11      ILE  36 -25.319  -4.129 -15.699
   10   HD12  ILE  36          HD12      ILE  36 -26.408  -4.057 -14.314
   11   HD11  ILE  36          HD13      ILE  36 -24.703  -4.438 -14.076

  No H/Q in entry =          11
  In of MODEL   67
    1    H    GLU  37           H        GLU  37 -22.132   0.616 -12.249
    2    HA   GLU  37           HA       GLU  37 -19.409  -0.100 -13.138
    3    HB2  GLU  37           HB2      GLU  37 -20.369   2.657 -12.384
    4    HB3  GLU  37           HB3      GLU  37 -18.674   2.199 -12.543
    5    HG2  GLU  37           HG2      GLU  37 -20.695   2.184 -14.766
    6    HG3  GLU  37           HG3      GLU  37 -19.514   3.457 -14.463

  No H/Q in entry =           6
  In of MODEL   67
    1    H    ALA  38           H        ALA  38 -17.941  -0.329 -11.437
    2    HA   ALA  38           HA       ALA  38 -19.017  -0.222  -8.680
    3    HB1  ALA  38           HB1      ALA  38 -17.234  -2.093 -10.112
    4    HB3  ALA  38           HB2      ALA  38 -18.297  -2.378  -8.733
    5    HB2  ALA  38           HB3      ALA  38 -16.706  -1.659  -8.485

  No H/Q in entry =           5
  In of MODEL   67
    1    H    PHE  39           H        PHE  39 -17.829   0.995  -7.169
    2    HA   PHE  39           HA       PHE  39 -15.323   2.275  -8.007
    3    HB2  PHE  39           HB2      PHE  39 -17.616   3.774  -6.736
    4    HB3  PHE  39           HB3      PHE  39 -16.044   4.435  -7.179
    5    HD1  PHE  39           HD1      PHE  39 -15.457   4.798  -9.514
    6    HD2  PHE  39           HD2      PHE  39 -19.327   3.433  -8.354
    7    HE1  PHE  39           HE1      PHE  39 -16.332   5.420 -11.747
    8    HE2  PHE  39           HE2      PHE  39 -20.214   4.042 -10.577
    9    HZ   PHE  39           HZ       PHE  39 -18.717   5.008 -12.291

  No H/Q in entry =           9
  In of MODEL   67
    1    HA   PRO  40           HA       PRO  40 -14.428   1.474  -3.720
    2    HB2  PRO  40           HB2      PRO  40 -12.723   3.526  -3.055
    3    HB3  PRO  40           HB3      PRO  40 -12.229   2.223  -4.136
    4    HG2  PRO  40           HG2      PRO  40 -13.314   4.942  -4.856
    5    HG3  PRO  40           HG3      PRO  40 -11.858   4.148  -5.454
    6    HD2  PRO  40           HD2      PRO  40 -14.057   4.026  -6.896
    7    HD3  PRO  40           HD3      PRO  40 -13.066   2.580  -6.714

  No H/Q in entry =           7
  In of MODEL   67
    1    H    GLU  41           H        GLU  41 -15.105   2.400  -1.584
    2    HA   GLU  41           HA       GLU  41 -17.396   4.042  -1.573
    3    HB2  GLU  41           HB2      GLU  41 -17.375   3.823   0.753
    4    HB3  GLU  41           HB3      GLU  41 -16.597   2.345   0.185
    5    HG2  GLU  41           HG2      GLU  41 -15.205   2.902   1.905
    6    HG3  GLU  41           HG3      GLU  41 -14.398   3.722   0.567

  No H/Q in entry =           6
  In of MODEL   67
    1    H    THR  42           H        THR  42 -14.090   5.050  -1.561
    2    HA   THR  42           HA       THR  42 -14.531   7.578  -0.313
    3    HB   THR  42           HB       THR  42 -12.374   8.229  -1.351
    4    HG1  THR  42           HG1      THR  42 -11.734   5.839  -2.384
    5   HG22  THR  42          HG21      THR  42 -12.088   5.389  -0.405
    6   HG21  THR  42          HG22      THR  42 -12.621   6.655   0.703
    7   HG23  THR  42          HG23      THR  42 -11.045   6.773  -0.079

  No H/Q in entry =           7
  In of MODEL   67
    1    H    LEU  43           H        LEU  43 -15.360   6.512  -3.443
    2    HA   LEU  43           HA       LEU  43 -15.675   9.292  -4.372
    3    HB2  LEU  43           HB2      LEU  43 -15.959   6.664  -5.820
    4    HB3  LEU  43           HB3      LEU  43 -16.176   8.255  -6.548
    5    HG   LEU  43           HG       LEU  43 -13.574   7.153  -5.514
    6   HD12  LEU  43          HD11      LEU  43 -14.193   7.745  -8.376
    7   HD11  LEU  43          HD12      LEU  43 -14.703   6.209  -7.678
    8   HD13  LEU  43          HD13      LEU  43 -12.995   6.646  -7.691
    9   HD22  LEU  43          HD21      LEU  43 -13.505   9.508  -5.314
   10   HD21  LEU  43          HD22      LEU  43 -14.372   9.743  -6.833
   11   HD23  LEU  43          HD23      LEU  43 -12.711   9.153  -6.848

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ALA  44           H        ALA  44 -17.596   7.385  -2.578
    2    HA   ALA  44           HA       ALA  44 -20.050   7.198  -3.939
    3    HB3  ALA  44           HB1      ALA  44 -19.911   6.051  -1.859
    4    HB2  ALA  44           HB2      ALA  44 -21.059   7.361  -1.582
    5    HB1  ALA  44           HB3      ALA  44 -19.399   7.505  -1.003

  No H/Q in entry =           5
  In of MODEL   67
    1    H    GLY  45           H        GLY  45 -18.730  10.011  -2.341
    2    HA3  GLY  45           HA2      GLY  45 -21.202  11.449  -2.714
    3    HA2  GLY  45           HA3      GLY  45 -19.685  12.105  -2.104

  No H/Q in entry =           3
  In of MODEL   67
    1    H    GLU  46           H        GLU  46 -18.094  11.249  -4.386
    2    HA   GLU  46           HA       GLU  46 -18.767  13.475  -6.129
    3    HB2  GLU  46           HB2      GLU  46 -16.514  11.461  -6.135
    4    HB3  GLU  46           HB3      GLU  46 -16.667  12.774  -7.303
    5    HG2  GLU  46           HG2      GLU  46 -15.167  13.633  -5.786
    6    HG3  GLU  46           HG3      GLU  46 -16.699  14.303  -5.224

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LYS  47           H        LYS  47 -18.545   9.968  -6.619
    2    HA   LYS  47           HA       LYS  47 -19.609  10.202  -9.306
    3    HB2  LYS  47           HB2      LYS  47 -18.412   8.104  -7.641
    4    HB3  LYS  47           HB3      LYS  47 -19.750   7.542  -8.642
    5    HG2  LYS  47           HG2      LYS  47 -17.641   7.219  -9.774
    6    HG3  LYS  47           HG3      LYS  47 -18.621   8.414 -10.623
    7    HD2  LYS  47           HD2      LYS  47 -17.355  10.217  -9.662
    8    HD3  LYS  47           HD3      LYS  47 -16.463   9.096  -8.635
    9    HE2  LYS  47           HE2      LYS  47 -15.052   9.658 -10.463
   10    HE3  LYS  47           HE3      LYS  47 -15.609   8.006 -10.721
   11    HZ3  LYS  47           HZ1      LYS  47 -16.876   8.603 -12.468
   12    HZ2  LYS  47           HZ2      LYS  47 -15.704   9.823 -12.597
   13    HZ1  LYS  47           HZ3      LYS  47 -17.202  10.158 -11.869

  No H/Q in entry =          13
  In of MODEL   67
    1    H    GLY  48           H        GLY  48 -20.957   9.357  -6.191
    2    HA3  GLY  48           HA2      GLY  48 -23.296   8.120  -6.986
    3    HA2  GLY  48           HA3      GLY  48 -23.119   9.096  -5.528

  No H/Q in entry =           3
  In of MODEL   67
    1    H    GLN  49           H        GLN  49 -22.581  11.559  -7.051
    2    HA   GLN  49           HA       GLN  49 -25.168  12.602  -7.216
    3    HB2  GLN  49           HB2      GLN  49 -22.630  13.557  -8.524
    4    HB3  GLN  49           HB3      GLN  49 -24.118  14.481  -8.447
    5    HG2  GLN  49           HG2      GLN  49 -23.995  14.470  -6.008
    6    HG3  GLN  49           HG3      GLN  49 -22.518  13.524  -6.084
    7   HE21  GLN  49          HE21      GLN  49 -22.481  15.734  -4.774
    8   HE22  GLN  49          HE22      GLN  49 -21.584  17.025  -5.388

  No H/Q in entry =           8
  In of MODEL   67
    1    H    ASN  50           H        ASN  50 -23.404  10.808  -9.607
    2    HA   ASN  50           HA       ASN  50 -25.279  11.662 -11.703
    3    HB2  ASN  50           HB2      ASN  50 -22.655  10.197 -11.923
    4    HB3  ASN  50           HB3      ASN  50 -23.697  10.616 -13.274
    5   HD21  ASN  50          HD21      ASN  50 -21.109  11.506 -11.612
    6   HD22  ASN  50          HD22      ASN  50 -20.915  13.153 -11.925

  No H/Q in entry =           6
  In of MODEL   67
    1    H    ALA  51           H        ALA  51 -25.233   9.271  -9.495
    2    HA   ALA  51           HA       ALA  51 -25.932   7.136 -11.366
    3    HB2  ALA  51           HB1      ALA  51 -25.337   5.775  -9.693
    4    HB3  ALA  51           HB2      ALA  51 -26.496   6.535  -8.604
    5    HB1  ALA  51           HB3      ALA  51 -24.873   7.204  -8.767

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ASP  52           H        ASP  52 -27.910   6.025 -11.273
    2    HA   ASP  52           HA       ASP  52 -30.150   7.788 -10.611
    3    HB2  ASP  52           HB2      ASP  52 -29.867   5.317 -12.318
    4    HB3  ASP  52           HB3      ASP  52 -31.437   6.002 -11.894

  No H/Q in entry =           4
  In of MODEL   67
    1    H    VAL  53           H        VAL  53 -28.487   4.926  -9.617
    2    HA   VAL  53           HA       VAL  53 -29.966   4.976  -7.121
    3    HB   VAL  53           HB       VAL  53 -31.303   3.317  -8.411
    4   HG11  VAL  53          HG11      VAL  53 -29.512   2.528  -9.921
    5   HG13  VAL  53          HG12      VAL  53 -30.324   1.198  -9.095
    6   HG12  VAL  53          HG13      VAL  53 -28.735   1.734  -8.553
    7   HG23  VAL  53          HG21      VAL  53 -30.454   1.335  -6.738
    8   HG22  VAL  53          HG22      VAL  53 -31.622   2.604  -6.369
    9   HG21  VAL  53          HG23      VAL  53 -29.927   2.813  -5.933

  No H/Q in entry =           9
  In of MODEL   67
    1    H    VAL  54           H        VAL  54 -28.666   4.550  -5.454
    2    HA   VAL  54           HA       VAL  54 -25.876   3.781  -6.038
    3    HB   VAL  54           HB       VAL  54 -27.024   5.495  -3.776
    4   HG11  VAL  54          HG11      VAL  54 -24.406   4.148  -4.051
    5   HG13  VAL  54          HG12      VAL  54 -25.197   4.784  -2.611
    6   HG12  VAL  54          HG13      VAL  54 -24.304   5.868  -3.676
    7   HG22  VAL  54          HG21      VAL  54 -26.197   7.348  -4.834
    8   HG21  VAL  54          HG22      VAL  54 -26.699   6.366  -6.210
    9   HG23  VAL  54          HG23      VAL  54 -25.000   6.428  -5.746

  No H/Q in entry =           9
  In of MODEL   67
    1    H    LEU  55           H        LEU  55 -25.244   1.866  -5.417
    2    HA   LEU  55           HA       LEU  55 -26.749   0.482  -3.285
    3    HB2  LEU  55           HB2      LEU  55 -25.130  -0.609  -5.576
    4    HB3  LEU  55           HB3      LEU  55 -25.884  -1.583  -4.313
    5    HG   LEU  55           HG       LEU  55 -27.331   0.002  -6.426
    6   HD13  LEU  55          HD11      LEU  55 -26.967  -1.822  -7.670
    7   HD12  LEU  55          HD12      LEU  55 -27.918  -2.741  -6.504
    8   HD11  LEU  55          HD13      LEU  55 -26.167  -2.635  -6.325
    9   HD23  LEU  55          HD21      LEU  55 -28.602  -2.007  -4.621
   10   HD22  LEU  55          HD22      LEU  55 -29.321  -0.629  -5.457
   11   HD21  LEU  55          HD23      LEU  55 -28.328  -0.370  -4.023

  No H/Q in entry =          11
  In of MODEL   67
    1    H    LEU  56           H        LEU  56 -25.609  -0.112  -1.473
    2    HA   LEU  56           HA       LEU  56 -22.685   0.358  -1.473
    3    HB2  LEU  56           HB2      LEU  56 -24.516   0.063   0.895
    4    HB3  LEU  56           HB3      LEU  56 -22.818   0.536   0.916
    5    HG   LEU  56           HG       LEU  56 -25.146   2.170  -0.054
    6   HD11  LEU  56          HD11      LEU  56 -24.057   1.777   2.476
    7   HD13  LEU  56          HD12      LEU  56 -25.074   3.128   1.977
    8   HD12  LEU  56          HD13      LEU  56 -23.320   3.278   1.917
    9   HD23  LEU  56          HD21      LEU  56 -23.242   3.921  -0.193
   10   HD22  LEU  56          HD22      LEU  56 -23.577   2.836  -1.542
   11   HD21  LEU  56          HD23      LEU  56 -22.231   2.500  -0.455

  No H/Q in entry =          11
  In of MODEL   67
    1    H    GLY  57           H        GLY  57 -21.271  -1.246  -0.943
    2    HA3  GLY  57           HA2      GLY  57 -22.125  -3.950  -1.198
    3    HA2  GLY  57           HA3      GLY  57 -20.521  -3.424  -0.692

  No H/Q in entry =           3
  In of MODEL   67
    1    HA   PRO  58           HA       PRO  58 -23.356  -4.592   2.965
    2    HB2  PRO  58           HB2      PRO  58 -22.614  -7.189   3.541
    3    HB3  PRO  58           HB3      PRO  58 -23.993  -6.798   2.514
    4    HG2  PRO  58           HG2      PRO  58 -21.234  -7.598   1.754
    5    HG3  PRO  58           HG3      PRO  58 -22.776  -8.086   1.052
    6    HD2  PRO  58           HD2      PRO  58 -21.197  -6.209  -0.118
    7    HD3  PRO  58           HD3      PRO  58 -22.956  -6.166  -0.245

  No H/Q in entry =           7
  In of MODEL   67
    1    H    GLN  59           H        GLN  59 -19.966  -4.970   2.401
    2    HA   GLN  59           HA       GLN  59 -19.250  -5.014   5.171
    3    HB2  GLN  59           HB2      GLN  59 -17.804  -5.496   3.009
    4    HB3  GLN  59           HB3      GLN  59 -17.456  -3.783   3.130
    5    HG2  GLN  59           HG2      GLN  59 -15.743  -5.169   4.201
    6    HG3  GLN  59           HG3      GLN  59 -16.530  -4.091   5.342
    7   HE21  GLN  59          HE21      GLN  59 -16.370  -5.184   6.978
    8   HE22  GLN  59          HE22      GLN  59 -16.869  -6.631   7.628

  No H/Q in entry =           8
  In of MODEL   67
    1    H    ILE  60           H        ILE  60 -20.216  -2.452   2.990
    2    HA   ILE  60           HA       ILE  60 -19.441  -0.507   5.078
    3    HB   ILE  60           HB       ILE  60 -19.707   1.244   3.267
    4   HG12  ILE  60          HG12      ILE  60 -19.367  -0.943   1.262
    5   HG13  ILE  60          HG13      ILE  60 -20.991  -0.495   1.785
    6   HG22  ILE  60          HG21      ILE  60 -17.596  -0.840   2.814
    7   HG21  ILE  60          HG22      ILE  60 -17.541   0.457   4.008
    8   HG23  ILE  60          HG23      ILE  60 -17.535   0.842   2.287
    9   HD12  ILE  60          HD11      ILE  60 -19.015   1.066   0.179
   10   HD11  ILE  60          HD12      ILE  60 -20.142   1.943   1.212
   11   HD13  ILE  60          HD13      ILE  60 -20.754   0.878  -0.053

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ALA  61           H        ALA  61 -21.857  -2.154   5.087
    2    HA   ALA  61           HA       ALA  61 -24.117  -0.537   4.621
    3    HB1  ALA  61           HB1      ALA  61 -25.314  -2.077   5.905
    4    HB2  ALA  61           HB2      ALA  61 -23.921  -2.448   6.922
    5    HB3  ALA  61           HB3      ALA  61 -23.978  -3.030   5.259

  No H/Q in entry =           5
  In of MODEL   67
    1    H    TYR  62           H        TYR  62 -21.948  -0.639   7.448
    2    HA   TYR  62           HA       TYR  62 -23.568   0.952   9.122
    3    HB2  TYR  62           HB2      TYR  62 -21.549   1.416  10.385
    4    HB3  TYR  62           HB3      TYR  62 -21.573  -0.282   9.911
    5    HD1  TYR  62           HD1      TYR  62 -19.920  -1.173   8.351
    6    HD2  TYR  62           HD2      TYR  62 -19.890   2.968   9.405
    7    HE1  TYR  62           HE1      TYR  62 -17.698  -0.929   7.310
    8    HE2  TYR  62           HE2      TYR  62 -17.654   3.207   8.365
    9    HH   TYR  62           HH       TYR  62 -16.448   1.283   6.242

  No H/Q in entry =           9
  In of MODEL   67
    1    H    MET  63           H        MET  63 -21.907   1.896   6.305
    2    HA   MET  63           HA       MET  63 -21.819   4.720   7.044
    3    HB2  MET  63           HB2      MET  63 -21.146   3.262   4.488
    4    HB3  MET  63           HB3      MET  63 -20.982   5.005   4.716
    5    HG2  MET  63           HG2      MET  63 -19.293   4.636   6.416
    6    HG3  MET  63           HG3      MET  63 -19.471   2.892   6.229
    7    HE3  MET  63           HE1      MET  63 -19.176   5.809   3.263
    8    HE2  MET  63           HE2      MET  63 -17.433   5.864   3.534
    9    HE1  MET  63           HE3      MET  63 -18.543   6.151   4.875

  No H/Q in entry =           9
  In of MODEL   67
    1    H    LEU  64           H        LEU  64 -24.323   2.821   6.013
    2    HA   LEU  64           HA       LEU  64 -25.537   4.242   3.941
    3    HB2  LEU  64           HB2      LEU  64 -26.367   2.102   4.813
    4    HB3  LEU  64           HB3      LEU  64 -26.866   2.909   6.298
    5    HG   LEU  64           HG       LEU  64 -28.572   4.143   5.066
    6   HD13  LEU  64          HD11      LEU  64 -28.264   4.426   2.842
    7   HD12  LEU  64          HD12      LEU  64 -28.869   2.779   2.662
    8   HD11  LEU  64          HD13      LEU  64 -27.133   3.078   2.749
    9   HD23  LEU  64          HD21      LEU  64 -29.013   1.331   4.267
   10   HD22  LEU  64          HD22      LEU  64 -30.040   2.426   5.190
   11   HD21  LEU  64          HD23      LEU  64 -28.658   1.654   5.964

  No H/Q in entry =          11
  In of MODEL   67
    1    HA   PRO  65           HA       PRO  65 -27.830   7.300   6.709
    2    HB2  PRO  65           HB2      PRO  65 -25.865   7.469   8.994
    3    HB3  PRO  65           HB3      PRO  65 -27.611   7.709   9.019
    4    HG2  PRO  65           HG2      PRO  65 -26.642   5.461   9.924
    5    HG3  PRO  65           HG3      PRO  65 -28.046   5.413   8.859
    6    HD2  PRO  65           HD2      PRO  65 -25.151   4.877   8.187
    7    HD3  PRO  65           HD3      PRO  65 -26.581   3.963   7.705

  No H/Q in entry =           7
  In of MODEL   67
    1    H    GLU  66           H        GLU  66 -24.275   7.325   6.832
    2    HA   GLU  66           HA       GLU  66 -24.037  10.135   6.475
    3    HB2  GLU  66           HB2      GLU  66 -22.163   7.880   5.814
    4    HB3  GLU  66           HB3      GLU  66 -21.749   9.586   5.639
    5    HG2  GLU  66           HG2      GLU  66 -22.002   9.914   8.009
    6    HG3  GLU  66           HG3      GLU  66 -22.492   8.232   8.207

  No H/Q in entry =           6
  In of MODEL   67
    1    H    ILE  67           H        ILE  67 -24.044   7.425   4.179
    2    HA   ILE  67           HA       ILE  67 -23.635   9.179   1.919
    3    HB   ILE  67           HB       ILE  67 -24.471   6.250   2.041
    4   HG12  ILE  67          HG12      ILE  67 -21.855   7.492   1.175
    5   HG13  ILE  67          HG13      ILE  67 -22.164   7.040   2.850
    6   HG21  ILE  67          HG21      ILE  67 -24.425   8.164  -0.154
    7   HG23  ILE  67          HG22      ILE  67 -25.013   6.502  -0.138
    8   HG22  ILE  67          HG23      ILE  67 -23.307   6.829  -0.437
    9   HD12  ILE  67          HD11      ILE  67 -21.671   5.315   0.478
   10   HD11  ILE  67          HD12      ILE  67 -22.691   4.699   1.778
   11   HD13  ILE  67          HD13      ILE  67 -21.034   5.195   2.118

  No H/Q in entry =          11
  In of MODEL   67
    1    H    GLN  68           H        GLN  68 -26.503   8.037   3.495
    2    HA   GLN  68           HA       GLN  68 -28.325   8.959   1.510
    3    HB2  GLN  68           HB2      GLN  68 -28.614   8.548   4.484
    4    HB3  GLN  68           HB3      GLN  68 -29.932   9.130   3.481
    5    HG2  GLN  68           HG2      GLN  68 -29.900   7.121   2.174
    6    HG3  GLN  68           HG3      GLN  68 -28.449   6.562   2.987
    7   HE21  GLN  68          HE21      GLN  68 -30.596   5.161   2.800
    8   HE22  GLN  68          HE22      GLN  68 -31.435   4.665   4.195

  No H/Q in entry =           8
  In of MODEL   67
    1    H    ARG  69           H        ARG  69 -26.793  10.614   4.296
    2    HA   ARG  69           HA       ARG  69 -28.203  13.074   3.911
    3    HB2  ARG  69           HB2      ARG  69 -25.861  12.167   5.516
    4    HB3  ARG  69           HB3      ARG  69 -25.971  13.890   5.184
    5    HG2  ARG  69           HG2      ARG  69 -28.301  13.870   6.123
    6    HG3  ARG  69           HG3      ARG  69 -28.065  12.177   6.574
    7    HD2  ARG  69           HD2      ARG  69 -26.433  14.551   7.548
    8    HD3  ARG  69           HD3      ARG  69 -27.557  13.607   8.513
    9    HE   ARG  69           HE       ARG  69 -24.913  12.743   7.585
   10   HH21  ARG  69          HH11      ARG  69 -24.086  10.978   8.764
   11   HH22  ARG  69          HH12      ARG  69 -25.113  10.123   9.865
   12   HH11  ARG  69          HH21      ARG  69 -27.882  12.110   9.232
   13   HH12  ARG  69          HH22      ARG  69 -27.262  10.762  10.128

  No H/Q in entry =          13
  In of MODEL   67
    1    H    LEU  70           H        LEU  70 -25.286  11.748   2.568
    2    HA   LEU  70           HA       LEU  70 -24.204  14.153   1.454
    3    HB2  LEU  70           HB2      LEU  70 -23.172  11.846   2.025
    4    HB3  LEU  70           HB3      LEU  70 -23.755  11.394   0.424
    5    HG   LEU  70           HG       LEU  70 -22.175  12.815  -0.616
    6   HD11  LEU  70          HD11      LEU  70 -21.408  13.629   2.195
    7   HD13  LEU  70          HD12      LEU  70 -22.107  14.669   0.954
    8   HD12  LEU  70          HD13      LEU  70 -20.479  14.024   0.746
    9   HD22  LEU  70          HD21      LEU  70 -20.712  11.124  -0.392
   10   HD21  LEU  70          HD22      LEU  70 -21.646  10.560   0.993
   11   HD23  LEU  70          HD23      LEU  70 -20.286  11.655   1.234

  No H/Q in entry =          11
  In of MODEL   67
    1    H    LEU  71           H        LEU  71 -26.292  11.587   0.268
    2    HA   LEU  71           HA       LEU  71 -26.812  13.105  -2.231
    3    HB2  LEU  71           HB2      LEU  71 -26.967  10.111  -1.835
    4    HB3  LEU  71           HB3      LEU  71 -27.091  10.994  -3.356
    5    HG   LEU  71           HG       LEU  71 -24.594  11.026  -1.661
    6   HD12  LEU  71          HD11      LEU  71 -24.583   9.437  -4.119
    7   HD11  LEU  71          HD12      LEU  71 -25.600   8.774  -2.840
    8   HD13  LEU  71          HD13      LEU  71 -23.890   9.081  -2.538
    9   HD22  LEU  71          HD21      LEU  71 -24.710  12.864  -3.127
   10   HD21  LEU  71          HD22      LEU  71 -25.171  11.835  -4.482
   11   HD23  LEU  71          HD23      LEU  71 -23.556  11.706  -3.785

  No H/Q in entry =          11
  In of MODEL   67
    1    HA   PRO  72           HA       PRO  72 -30.704  12.544   0.330
    2    HB2  PRO  72           HB2      PRO  72 -31.606  15.091   0.277
    3    HB3  PRO  72           HB3      PRO  72 -30.304  14.644   1.380
    4    HG2  PRO  72           HG2      PRO  72 -30.102  15.887  -1.352
    5    HG3  PRO  72           HG3      PRO  72 -29.365  16.427   0.156
    6    HD2  PRO  72           HD2      PRO  72 -27.978  14.920  -1.616
    7    HD3  PRO  72           HD3      PRO  72 -27.743  14.730   0.120

  No H/Q in entry =           7
  In of MODEL   67
    1    H    ASN  73           H        ASN  73 -30.054  13.562  -2.861
    2    HA   ASN  73           HA       ASN  73 -32.900  13.215  -3.537
    3    HB2  ASN  73           HB2      ASN  73 -32.425  14.363  -5.610
    4    HB3  ASN  73           HB3      ASN  73 -31.938  15.329  -4.225
    5   HD21  ASN  73          HD21      ASN  73 -31.108  15.431  -6.891
    6   HD22  ASN  73          HD22      ASN  73 -29.435  15.301  -7.063

  No H/Q in entry =           6
  In of MODEL   67
    1    H    LYS  74           H        LYS  74 -30.888  10.987  -3.121
    2    HA   LYS  74           HA       LYS  74 -31.398   9.624  -5.699
    3    HB2  LYS  74           HB2      LYS  74 -28.883   9.346  -4.048
    4    HB3  LYS  74           HB3      LYS  74 -29.232   8.553  -5.584
    5    HG2  LYS  74           HG2      LYS  74 -29.019  11.523  -5.331
    6    HG3  LYS  74           HG3      LYS  74 -27.624  10.488  -5.633
    7    HD2  LYS  74           HD2      LYS  74 -28.700   9.573  -7.606
    8    HD3  LYS  74           HD3      LYS  74 -30.140  10.543  -7.289
    9    HE2  LYS  74           HE2      LYS  74 -28.940  12.575  -7.682
   10    HE3  LYS  74           HE3      LYS  74 -27.405  11.711  -7.768
   11    HZ2  LYS  74           HZ1      LYS  74 -28.856  12.325  -9.904
   12    HZ1  LYS  74           HZ2      LYS  74 -29.492  10.786  -9.564
   13    HZ3  LYS  74           HZ3      LYS  74 -27.825  10.977  -9.836

  No H/Q in entry =          13
  In of MODEL   67
    1    HA   PRO  75           HA       PRO  75 -32.785   6.570  -2.794
    2    HB2  PRO  75           HB2      PRO  75 -33.039   4.373  -4.416
    3    HB3  PRO  75           HB3      PRO  75 -34.184   5.711  -4.479
    4    HG2  PRO  75           HG2      PRO  75 -31.814   5.178  -6.227
    5    HG3  PRO  75           HG3      PRO  75 -33.463   5.598  -6.690
    6    HD2  PRO  75           HD2      PRO  75 -31.552   7.491  -6.591
    7    HD3  PRO  75           HD3      PRO  75 -33.197   7.857  -6.069

  No H/Q in entry =           7
  In of MODEL   67
    1    H    VAL  76           H        VAL  76 -31.335   5.515  -1.419
    2    HA   VAL  76           HA       VAL  76 -28.837   4.360  -2.511
    3    HB   VAL  76           HB       VAL  76 -29.183   5.780   0.165
    4   HG11  VAL  76          HG11      VAL  76 -26.788   4.551  -1.214
    5   HG13  VAL  76          HG12      VAL  76 -27.499   4.066   0.327
    6   HG12  VAL  76          HG13      VAL  76 -26.674   5.617   0.187
    7   HG22  VAL  76          HG21      VAL  76 -28.532   7.704  -0.682
    8   HG21  VAL  76          HG22      VAL  76 -29.044   7.026  -2.229
    9   HG23  VAL  76          HG23      VAL  76 -27.346   6.956  -1.752

  No H/Q in entry =           9
  In of MODEL   67
    1    H    GLU  77           H        GLU  77 -28.594   2.201  -1.929
    2    HA   GLU  77           HA       GLU  77 -29.405   1.360   0.701
    3    HB2  GLU  77           HB2      GLU  77 -30.980  -0.303   0.123
    4    HB3  GLU  77           HB3      GLU  77 -31.542   1.222  -0.563
    5    HG2  GLU  77           HG2      GLU  77 -30.892   0.508  -2.754
    6    HG3  GLU  77           HG3      GLU  77 -30.236  -0.989  -2.095

  No H/Q in entry =           6
  In of MODEL   67
    1    H    VAL  78           H        VAL  78 -29.055  -0.732   1.333
    2    HA   VAL  78           HA       VAL  78 -26.365  -1.449   0.469
    3    HB   VAL  78           HB       VAL  78 -28.091  -2.396   2.797
    4   HG11  VAL  78          HG11      VAL  78 -25.717  -3.570   1.686
    5   HG13  VAL  78          HG12      VAL  78 -26.637  -4.078   3.104
    6   HG12  VAL  78          HG13      VAL  78 -25.338  -2.898   3.271
    7   HG22  VAL  78          HG21      VAL  78 -26.673  -1.033   4.176
    8   HG21  VAL  78          HG22      VAL  78 -27.406  -0.054   2.905
    9   HG23  VAL  78          HG23      VAL  78 -25.719  -0.553   2.772

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ILE  79           H        ILE  79 -25.786  -3.333  -0.458
    2    HA   ILE  79           HA       ILE  79 -27.804  -4.821  -1.858
    3    HB   ILE  79           HB       ILE  79 -24.809  -5.306  -1.603
    4   HG12  ILE  79          HG12      ILE  79 -26.431  -4.191  -3.896
    5   HG13  ILE  79          HG13      ILE  79 -25.589  -3.186  -2.715
    6   HG22  ILE  79          HG21      ILE  79 -25.860  -6.465  -3.955
    7   HG21  ILE  79          HG22      ILE  79 -26.856  -7.023  -2.610
    8   HG23  ILE  79          HG23      ILE  79 -25.110  -7.275  -2.579
    9   HD13  ILE  79          HD11      ILE  79 -24.149  -3.249  -4.515
   10   HD12  ILE  79          HD12      ILE  79 -24.458  -4.958  -4.828
   11   HD11  ILE  79          HD13      ILE  79 -23.500  -4.476  -3.425

  No H/Q in entry =          11
  In of MODEL   67
    1    H    ASP  80           H        ASP  80 -28.646  -6.767  -1.316
    2    HA   ASP  80           HA       ASP  80 -28.615  -7.707   1.317
    3    HB2  ASP  80           HB2      ASP  80 -30.337  -8.285  -0.356
    4    HB3  ASP  80           HB3      ASP  80 -29.151  -9.261  -1.224

  No H/Q in entry =           4
  In of MODEL   67
    1    H    SER  81           H        SER  81 -27.078  -8.836   2.450
    2    HA   SER  81           HA       SER  81 -24.555  -9.461   1.284
    3    HB2  SER  81           HB2      SER  81 -24.015 -10.512   3.444
    4    HB3  SER  81           HB3      SER  81 -24.750  -8.925   3.673
    5    HG   SER  81           HG       SER  81 -26.763 -10.118   3.920

  No H/Q in entry =           5
  In of MODEL   67
    1    H    LEU  82           H        LEU  82 -27.236 -11.598   1.536
    2    HA   LEU  82           HA       LEU  82 -25.645 -13.934   1.001
    3    HB2  LEU  82           HB2      LEU  82 -28.586 -13.362   0.710
    4    HB3  LEU  82           HB3      LEU  82 -27.853 -14.950   0.492
    5    HG   LEU  82           HG       LEU  82 -27.856 -13.400   3.064
    6   HD13  LEU  82          HD11      LEU  82 -29.527 -15.055   3.780
    7   HD12  LEU  82          HD12      LEU  82 -29.516 -15.768   2.165
    8   HD11  LEU  82          HD13      LEU  82 -30.117 -14.126   2.401
    9   HD21  LEU  82          HD21      LEU  82 -26.833 -16.071   2.144
   10   HD23  LEU  82          HD22      LEU  82 -27.234 -15.787   3.837
   11   HD22  LEU  82          HD23      LEU  82 -25.988 -14.816   3.052

  No H/Q in entry =          11
  In of MODEL   67
    1    H    LEU  83           H        LEU  83 -27.611 -11.710  -0.911
    2    HA   LEU  83           HA       LEU  83 -27.354 -13.026  -3.400
    3    HB2  LEU  83           HB2      LEU  83 -27.819 -10.136  -2.714
    4    HB3  LEU  83           HB3      LEU  83 -27.817 -10.756  -4.364
    5    HG   LEU  83           HG       LEU  83 -29.875 -11.208  -2.223
    6   HD13  LEU  83          HD11      LEU  83 -30.645  -9.356  -3.269
    7   HD12  LEU  83          HD12      LEU  83 -31.073 -10.457  -4.578
    8   HD11  LEU  83          HD13      LEU  83 -29.552  -9.566  -4.635
    9   HD23  LEU  83          HD21      LEU  83 -29.957 -12.426  -4.968
   10   HD22  LEU  83          HD22      LEU  83 -30.941 -12.813  -3.557
   11   HD21  LEU  83          HD23      LEU  83 -29.244 -13.289  -3.606

  No H/Q in entry =          11
  In of MODEL   67
    1    H    TYR  84           H        TYR  84 -25.461 -10.638  -1.660
    2    HA   TYR  84           HA       TYR  84 -23.579 -10.089  -3.757
    3    HB2  TYR  84           HB2      TYR  84 -24.140  -8.633  -1.735
    4    HB3  TYR  84           HB3      TYR  84 -23.142  -9.738  -0.793
    5    HD1  TYR  84           HD1      TYR  84 -20.762  -9.624  -0.864
    6    HD2  TYR  84           HD2      TYR  84 -23.093  -7.256  -3.546
    7    HE1  TYR  84           HE1      TYR  84 -18.728  -8.380  -1.513
    8    HE2  TYR  84           HE2      TYR  84 -21.067  -6.011  -4.213
    9    HH   TYR  84           HH       TYR  84 -18.896  -5.601  -3.659

  No H/Q in entry =           9
  In of MODEL   67
    1    H    GLY  85           H        GLY  85 -23.348 -12.132  -0.838
    2    HA3  GLY  85           HA2      GLY  85 -20.749 -13.028  -1.299
    3    HA2  GLY  85           HA3      GLY  85 -21.979 -13.908  -0.391

  No H/Q in entry =           3
  In of MODEL   67
    1    H    LYS  86           H        LYS  86 -23.792 -14.278  -2.483
    2    HA   LYS  86           HA       LYS  86 -22.684 -16.616  -3.762
    3    HB2  LYS  86           HB2      LYS  86 -25.354 -15.220  -3.957
    4    HB3  LYS  86           HB3      LYS  86 -24.990 -16.812  -4.620
    5    HG2  LYS  86           HG2      LYS  86 -24.847 -16.189  -1.700
    6    HG3  LYS  86           HG3      LYS  86 -26.304 -16.776  -2.504
    7    HD2  LYS  86           HD2      LYS  86 -24.995 -18.693  -3.387
    8    HD3  LYS  86           HD3      LYS  86 -23.602 -18.129  -2.468
    9    HE2  LYS  86           HE2      LYS  86 -26.258 -18.863  -1.249
   10    HE3  LYS  86           HE3      LYS  86 -24.869 -19.945  -1.341
   11    HZ2  LYS  86           HZ1      LYS  86 -25.225 -17.506   0.258
   12    HZ1  LYS  86           HZ2      LYS  86 -23.659 -17.927  -0.250
   13    HZ3  LYS  86           HZ3      LYS  86 -24.557 -19.004   0.706

  No H/Q in entry =          13
  In of MODEL   67
    1    H    VAL  87           H        VAL  87 -22.711 -13.388  -4.608
    2    HA   VAL  87           HA       VAL  87 -22.404 -12.182  -6.527
    3    HB   VAL  87           HB       VAL  87 -21.296 -14.616  -7.935
    4   HG12  VAL  87          HG11      VAL  87 -19.971 -11.939  -7.748
    5   HG11  VAL  87          HG12      VAL  87 -21.426 -12.085  -8.735
    6   HG13  VAL  87          HG13      VAL  87 -20.011 -13.074  -9.095
    7   HG23  VAL  87          HG21      VAL  87 -19.130 -14.261  -6.792
    8   HG22  VAL  87          HG22      VAL  87 -20.389 -14.877  -5.725
    9   HG21  VAL  87          HG23      VAL  87 -19.939 -13.174  -5.665

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ASP  88           H        ASP  88 -24.914 -12.868  -6.219
    2    HA   ASP  88           HA       ASP  88 -25.984 -14.065  -8.650
    3    HB2  ASP  88           HB2      ASP  88 -27.007 -14.360  -6.343
    4    HB3  ASP  88           HB3      ASP  88 -27.485 -12.665  -6.424

  No H/Q in entry =           4
  In of MODEL   67
    1    H    GLY  89           H        GLY  89 -25.278 -12.773 -10.263
    2    HA3  GLY  89           HA2      GLY  89 -25.500 -10.000 -10.425
    3    HA2  GLY  89           HA3      GLY  89 -25.441 -11.100 -11.802

  No H/Q in entry =           3
  In of MODEL   67
    1    H    LEU  90           H        LEU  90 -27.871 -12.497 -11.407
    2    HA   LEU  90           HA       LEU  90 -29.698 -10.575 -12.516
    3    HB2  LEU  90           HB2      LEU  90 -29.716 -12.963 -13.132
    4    HB3  LEU  90           HB3      LEU  90 -30.237 -13.362 -11.495
    5    HG   LEU  90           HG       LEU  90 -32.369 -12.274 -11.870
    6   HD13  LEU  90          HD11      LEU  90 -32.199 -10.508 -13.317
    7   HD12  LEU  90          HD12      LEU  90 -32.703 -11.737 -14.479
    8   HD11  LEU  90          HD13      LEU  90 -30.997 -11.317 -14.327
    9   HD23  LEU  90          HD21      LEU  90 -32.241 -13.866 -14.328
   10   HD22  LEU  90          HD22      LEU  90 -33.238 -14.068 -12.886
   11   HD21  LEU  90          HD23      LEU  90 -31.573 -14.654 -12.897

  No H/Q in entry =          11
  In of MODEL   67
    1    H    GLY  91           H        GLY  91 -29.546 -12.120  -9.352
    2    HA3  GLY  91           HA2      GLY  91 -31.917 -11.062  -8.327
    3    HA2  GLY  91           HA3      GLY  91 -30.529 -11.585  -7.375

  No H/Q in entry =           3
  In of MODEL   67
    1    H    VAL  92           H        VAL  92 -28.629  -9.716  -8.179
    2    HA   VAL  92           HA       VAL  92 -29.479  -7.450  -6.607
    3    HB   VAL  92           HB       VAL  92 -26.905  -7.855  -8.175
    4   HG12  VAL  92          HG11      VAL  92 -27.131  -6.007  -5.824
    5   HG11  VAL  92          HG12      VAL  92 -27.784  -5.451  -7.367
    6   HG13  VAL  92          HG13      VAL  92 -26.083  -5.894  -7.238
    7   HG22  VAL  92          HG21      VAL  92 -26.676  -9.462  -6.604
    8   HG21  VAL  92          HG22      VAL  92 -27.848  -8.717  -5.515
    9   HG23  VAL  92          HG23      VAL  92 -26.203  -8.088  -5.605

  No H/Q in entry =           9
  In of MODEL   67
    1    H    LEU  93           H        LEU  93 -29.017  -8.055 -10.031
    2    HA   LEU  93           HA       LEU  93 -29.394  -5.412 -10.926
    3    HB2  LEU  93           HB2      LEU  93 -28.702  -7.235 -12.406
    4    HB3  LEU  93           HB3      LEU  93 -30.284  -7.991 -12.214
    5    HG   LEU  93           HG       LEU  93 -31.314  -6.029 -13.324
    6   HD11  LEU  93          HD11      LEU  93 -29.496  -4.410 -12.772
    7   HD13  LEU  93          HD12      LEU  93 -29.913  -4.423 -14.487
    8   HD12  LEU  93          HD13      LEU  93 -28.455  -5.242 -13.929
    9   HD23  LEU  93          HD21      LEU  93 -30.237  -6.545 -15.606
   10   HD22  LEU  93          HD22      LEU  93 -31.069  -7.828 -14.728
   11   HD21  LEU  93          HD23      LEU  93 -29.306  -7.744 -14.707

  No H/Q in entry =          11
  In of MODEL   67
    1    H    LYS  94           H        LYS  94 -31.737  -8.009 -10.145
    2    HA   LYS  94           HA       LYS  94 -34.097  -6.597 -10.779
    3    HB2  LYS  94           HB2      LYS  94 -33.572  -8.802  -8.793
    4    HB3  LYS  94           HB3      LYS  94 -35.178  -8.130  -9.071
    5    HG2  LYS  94           HG2      LYS  94 -35.049  -8.869 -11.415
    6    HG3  LYS  94           HG3      LYS  94 -33.480  -9.600 -11.078
    7    HD2  LYS  94           HD2      LYS  94 -34.600 -10.978  -9.287
    8    HD3  LYS  94           HD3      LYS  94 -36.147 -10.348  -9.853
    9    HE2  LYS  94           HE2      LYS  94 -35.588 -11.235 -12.126
   10    HE3  LYS  94           HE3      LYS  94 -34.169 -12.005 -11.416
   11    HZ3  LYS  94           HZ1      LYS  94 -35.991 -13.554 -11.632
   12    HZ2  LYS  94           HZ2      LYS  94 -36.994 -12.559 -10.688
   13    HZ1  LYS  94           HZ3      LYS  94 -35.630 -13.294  -9.993

  No H/Q in entry =          13
  In of MODEL   67
    1    H    ALA  95           H        ALA  95 -32.310  -6.733  -7.710
    2    HA   ALA  95           HA       ALA  95 -34.204  -5.206  -6.232
    3    HB2  ALA  95           HB1      ALA  95 -31.814  -6.549  -5.684
    4    HB3  ALA  95           HB2      ALA  95 -32.822  -5.677  -4.530
    5    HB1  ALA  95           HB3      ALA  95 -31.477  -4.856  -5.322

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ALA  96           H        ALA  96 -31.550  -4.278  -8.281
    2    HA   ALA  96           HA       ALA  96 -31.509  -1.527  -7.465
    3    HB2  ALA  96           HB1      ALA  96 -30.124  -1.248  -9.555
    4    HB3  ALA  96           HB2      ALA  96 -30.397  -2.954  -9.902
    5    HB1  ALA  96           HB3      ALA  96 -29.508  -2.481  -8.455

  No H/Q in entry =           5
  In of MODEL   67
    1    H    VAL  97           H        VAL  97 -32.978  -3.225 -10.197
    2    HA   VAL  97           HA       VAL  97 -34.070  -0.924 -11.432
    3    HB   VAL  97           HB       VAL  97 -34.832  -3.861 -11.529
    4   HG11  VAL  97          HG11      VAL  97 -36.649  -1.876 -12.008
    5   HG13  VAL  97          HG12      VAL  97 -36.673  -3.458 -12.788
    6   HG12  VAL  97          HG13      VAL  97 -35.931  -2.085 -13.606
    7   HG21  VAL  97          HG21      VAL  97 -33.556  -1.983 -13.520
    8   HG23  VAL  97          HG22      VAL  97 -33.979  -3.666 -13.839
    9   HG22  VAL  97          HG23      VAL  97 -32.752  -3.277 -12.632

  No H/Q in entry =           9
  In of MODEL   67
    1    H    ALA  98           H        ALA  98 -35.250  -3.159  -8.943
    2    HA   ALA  98           HA       ALA  98 -37.832  -2.054  -8.608
    3    HB1  ALA  98           HB1      ALA  98 -36.799  -4.253  -7.596
    4    HB3  ALA  98           HB2      ALA  98 -38.005  -3.360  -6.666
    5    HB2  ALA  98           HB3      ALA  98 -36.292  -3.192  -6.282

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ALA  99           H        ALA  99 -34.787  -1.236  -6.910
    2    HA   ALA  99           HA       ALA  99 -35.966   0.707  -5.234
    3    HB1  ALA  99           HB1      ALA  99 -33.296  -0.134  -5.960
    4    HB2  ALA  99           HB2      ALA  99 -33.876   0.585  -4.457
    5    HB3  ALA  99           HB3      ALA  99 -33.397   1.620  -5.803

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ILE 100           H        ILE 100 -34.885   0.904  -8.573
    2    HA   ILE 100           HA       ILE 100 -35.101   3.752  -8.751
    3    HB   ILE 100           HB       ILE 100 -35.140   1.629 -10.924
    4   HG12  ILE 100          HG12      ILE 100 -33.013   3.641 -10.195
    5   HG13  ILE 100          HG13      ILE 100 -33.034   1.984  -9.591
    6   HG21  ILE 100          HG21      ILE 100 -35.601   4.545 -11.014
    7   HG23  ILE 100          HG22      ILE 100 -36.076   3.287 -12.157
    8   HG22  ILE 100          HG23      ILE 100 -34.432   3.927 -12.181
    9   HD12  ILE 100          HD11      ILE 100 -32.480   2.992 -12.343
   10   HD11  ILE 100          HD12      ILE 100 -33.121   1.364 -12.121
   11   HD13  ILE 100          HD13      ILE 100 -31.590   1.817 -11.374

  No H/Q in entry =          11
  In of MODEL   67
    1    H    LYS 101           H        LYS 101 -37.349   1.124  -9.547
    2    HA   LYS 101           HA       LYS 101 -39.441   2.759 -10.546
    3    HB2  LYS 101           HB2      LYS 101 -39.301  -0.030  -9.461
    4    HB3  LYS 101           HB3      LYS 101 -40.859   0.716  -9.815
    5    HG2  LYS 101           HG2      LYS 101 -40.357   0.893 -12.103
    6    HG3  LYS 101           HG3      LYS 101 -38.659   0.506 -11.834
    7    HD2  LYS 101           HD2      LYS 101 -39.871  -1.404 -12.765
    8    HD3  LYS 101           HD3      LYS 101 -39.260  -1.751 -11.147
    9    HE2  LYS 101           HE2      LYS 101 -41.320  -2.482 -10.678
   10    HE3  LYS 101           HE3      LYS 101 -41.800  -0.784 -10.661
   11    HZ3  LYS 101           HZ1      LYS 101 -42.662  -0.920 -12.792
   12    HZ2  LYS 101           HZ2      LYS 101 -43.112  -2.410 -12.113
   13    HZ1  LYS 101           HZ3      LYS 101 -41.793  -2.327 -13.178

  No H/Q in entry =          13
  In of MODEL   67
    1    H    LYS 102           H        LYS 102 -38.970   1.238  -7.356
    2    HA   LYS 102           HA       LYS 102 -41.247   2.384  -6.168
    3    HB2  LYS 102           HB2      LYS 102 -39.998   0.518  -5.167
    4    HB3  LYS 102           HB3      LYS 102 -38.626   1.588  -4.889
    5    HG2  LYS 102           HG2      LYS 102 -39.980   2.941  -3.387
    6    HG3  LYS 102           HG3      LYS 102 -41.357   1.875  -3.667
    7    HD2  LYS 102           HD2      LYS 102 -40.118   0.009  -2.655
    8    HD3  LYS 102           HD3      LYS 102 -38.742   1.076  -2.374
    9    HE2  LYS 102           HE2      LYS 102 -40.135   2.513  -0.958
   10    HE3  LYS 102           HE3      LYS 102 -41.528   1.477  -1.261
   11    HZ1  LYS 102           HZ1      LYS 102 -39.797  -0.270  -0.264
   12    HZ3  LYS 102           HZ2      LYS 102 -40.931   0.585   0.666
   13    HZ2  LYS 102           HZ3      LYS 102 -39.326   1.134   0.568

  No H/Q in entry =          13
  In of MODEL   67
    1    H    ALA 103           H        ALA 103 -38.300   3.831  -7.120
    2    HA   ALA 103           HA       ALA 103 -38.577   6.113  -5.305
    3    HB2  ALA 103           HB1      ALA 103 -36.577   6.899  -6.842
    4    HB3  ALA 103           HB2      ALA 103 -36.512   5.189  -7.267
    5    HB1  ALA 103           HB3      ALA 103 -36.314   5.689  -5.587

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ALA 104           H        ALA 104 -39.145   5.428  -8.670
    2    HA   ALA 104           HA       ALA 104 -39.761   8.214  -9.255
    3    HB2  ALA 104           HB1      ALA 104 -39.766   7.582 -11.468
    4    HB1  ALA 104           HB2      ALA 104 -40.477   6.005 -11.125
    5    HB3  ALA 104           HB3      ALA 104 -38.762   6.286 -10.818

  No H/Q in entry =           5
  In of MODEL   67
    1    H    ALA 105           H        ALA 105 -41.363   6.059  -7.505
    2    HA   ALA 105           HA       ALA 105 -43.807   7.419  -7.488
    3    HB2  ALA 105           HB1      ALA 105 -44.513   6.582  -9.550
    4    HB3  ALA 105           HB2      ALA 105 -45.147   5.367  -8.441
    5    HB1  ALA 105           HB3      ALA 105 -43.661   5.053  -9.336

  No H/Q in entry =           5
  In of MODEL   68
    1    H1   ALA   1           H3       ALA   1 -12.062 -16.069  -2.356
    2    H2   ALA   1           H2       ALA   1 -11.107 -17.203  -3.191
    3    H3   ALA   1           H1       ALA   1 -12.262 -16.276  -4.029
    4    HA   ALA   1           HA       ALA   1 -13.640 -17.993  -3.781
    5    HB3  ALA   1           HB1      ALA   1 -12.222 -19.745  -3.311
    6    HB1  ALA   1           HB2      ALA   1 -12.979 -19.634  -1.722
    7    HB2  ALA   1           HB3      ALA   1 -11.413 -18.875  -2.007

  No H/Q in entry =           7
  In of MODEL   68
    1    H    GLU   2           H        GLU   2 -15.252 -18.860  -2.123
    2    HA   GLU   2           HA       GLU   2 -16.921 -17.155  -1.072
    3    HB2  GLU   2           HB2      GLU   2 -15.952 -19.561   0.484
    4    HB3  GLU   2           HB3      GLU   2 -17.486 -18.729   0.734
    5    HG2  GLU   2           HG2      GLU   2 -18.452 -19.835  -0.995
    6    HG3  GLU   2           HG3      GLU   2 -17.134 -19.423  -2.081

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLU   3           H        GLU   3 -14.992 -18.472   1.557
    2    HA   GLU   3           HA       GLU   3 -15.242 -16.114   3.104
    3    HB2  GLU   3           HB2      GLU   3 -13.625 -18.640   3.366
    4    HB3  GLU   3           HB3      GLU   3 -13.410 -17.312   4.507
    5    HG2  GLU   3           HG2      GLU   3 -15.601 -17.486   5.326
    6    HG3  GLU   3           HG3      GLU   3 -16.187 -18.300   3.881

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LEU   4           H        LEU   4 -12.270 -17.563   1.719
    2    HA   LEU   4           HA       LEU   4 -10.459 -15.634   2.308
    3    HB2  LEU   4           HB2      LEU   4 -10.673 -16.947  -0.410
    4    HB3  LEU   4           HB3      LEU   4  -9.230 -16.206   0.271
    5    HG   LEU   4           HG       LEU   4 -10.695 -18.616   1.395
    6   HD13  LEU   4          HD11      LEU   4  -9.046 -19.956   0.472
    7   HD12  LEU   4          HD12      LEU   4  -7.852 -18.658   0.439
    8   HD11  LEU   4          HD13      LEU   4  -9.140 -18.702  -0.763
    9   HD23  LEU   4          HD21      LEU   4  -8.443 -18.645   2.777
   10   HD22  LEU   4          HD22      LEU   4  -9.777 -17.619   3.301
   11   HD21  LEU   4          HD23      LEU   4  -8.423 -16.918   2.416

  No H/Q in entry =          11
  In of MODEL   68
    1    H    GLU   5           H        GLU   5 -12.796 -15.469  -0.367
    2    HA   GLU   5           HA       GLU   5 -11.823 -12.978  -1.379
    3    HB2  GLU   5           HB2      GLU   5 -13.144 -14.577  -2.741
    4    HB3  GLU   5           HB3      GLU   5 -14.549 -14.248  -1.726
    5    HG2  GLU   5           HG2      GLU   5 -14.475 -11.876  -2.362
    6    HG3  GLU   5           HG3      GLU   5 -13.045 -12.177  -3.351

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLU   6           H        GLU   6 -14.537 -13.879   0.717
    2    HA   GLU   6           HA       GLU   6 -15.474 -11.212   1.104
    3    HB2  GLU   6           HB2      GLU   6 -16.021 -13.886   2.252
    4    HB3  GLU   6           HB3      GLU   6 -16.349 -12.518   3.314
    5    HG2  GLU   6           HG2      GLU   6 -18.357 -13.000   2.036
    6    HG3  GLU   6           HG3      GLU   6 -17.683 -11.475   1.468

  No H/Q in entry =           6
  In of MODEL   68
    1    H    VAL   7           H        VAL   7 -13.142 -13.287   2.685
    2    HA   VAL   7           HA       VAL   7 -12.695 -11.695   5.005
    3    HB   VAL   7           HB       VAL   7 -10.966 -13.725   3.565
    4   HG11  VAL   7          HG11      VAL   7 -10.517 -12.174   6.122
    5   HG13  VAL   7          HG12      VAL   7  -9.414 -12.382   4.763
    6   HG12  VAL   7          HG13      VAL   7  -9.751 -13.737   5.839
    7   HG21  VAL   7          HG21      VAL   7 -13.210 -14.310   4.788
    8   HG23  VAL   7          HG22      VAL   7 -12.287 -14.018   6.262
    9   HG22  VAL   7          HG23      VAL   7 -11.778 -15.277   5.139

  No H/Q in entry =           9
  In of MODEL   68
    1    H    VAL   8           H        VAL   8 -11.182 -11.807   1.796
    2    HA   VAL   8           HA       VAL   8  -9.142  -9.907   2.280
    3    HB   VAL   8           HB       VAL   8 -10.578 -10.754  -0.236
    4   HG13  VAL   8          HG11      VAL   8  -9.951  -8.533  -0.754
    5   HG12  VAL   8          HG12      VAL   8  -8.603  -9.501  -1.353
    6   HG11  VAL   8          HG13      VAL   8  -8.459  -8.645   0.182
    7   HG23  VAL   8          HG21      VAL   8  -7.784 -11.254  -0.327
    8   HG22  VAL   8          HG22      VAL   8  -9.064 -12.442  -0.098
    9   HG21  VAL   8          HG23      VAL   8  -8.290 -11.706   1.302

  No H/Q in entry =           9
  In of MODEL   68
    1    H    MET   9           H        MET   9 -12.491  -9.563   1.118
    2    HA   MET   9           HA       MET   9 -12.462  -6.788   0.670
    3    HB2  MET   9           HB2      MET   9 -14.644  -8.700   1.488
    4    HB3  MET   9           HB3      MET   9 -14.958  -6.972   1.305
    5    HG2  MET   9           HG2      MET   9 -14.097  -7.068  -1.012
    6    HG3  MET   9           HG3      MET   9 -13.815  -8.799  -0.828
    7    HE1  MET   9           HE1      MET   9 -16.038  -5.968  -0.408
    8    HE3  MET   9           HE2      MET   9 -17.320  -6.781   0.485
    9    HE2  MET   9           HE3      MET   9 -17.562  -6.372  -1.210

  No H/Q in entry =           9
  In of MODEL   68
    1    H    GLY  10           H        GLY  10 -13.102  -8.673   3.606
    2    HA3  GLY  10           HA2      GLY  10 -13.677  -6.487   5.314
    3    HA2  GLY  10           HA3      GLY  10 -13.094  -8.066   5.836

  No H/Q in entry =           3
  In of MODEL   68
    1    H    LEU  11           H        LEU  11 -10.647  -8.166   4.522
    2    HA   LEU  11           HA       LEU  11  -8.964  -6.703   6.272
    3    HB2  LEU  11           HB2      LEU  11  -8.399  -8.133   3.672
    4    HB3  LEU  11           HB3      LEU  11  -7.138  -7.407   4.667
    5    HG   LEU  11           HG       LEU  11  -9.115  -9.460   5.693
    6   HD13  LEU  11          HD11      LEU  11  -7.878 -10.689   4.135
    7   HD12  LEU  11          HD12      LEU  11  -6.940 -10.909   5.611
    8   HD11  LEU  11          HD13      LEU  11  -6.414  -9.743   4.398
    9   HD22  LEU  11          HD21      LEU  11  -8.275  -8.427   7.605
   10   HD21  LEU  11          HD22      LEU  11  -6.742  -8.010   6.840
   11   HD23  LEU  11          HD23      LEU  11  -7.047  -9.668   7.358

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  12           H        ILE  12  -9.872  -6.184   2.880
    2    HA   ILE  12           HA       ILE  12  -8.209  -3.935   2.443
    3    HB   ILE  12           HB       ILE  12 -10.858  -4.627   1.149
    4   HG12  ILE  12          HG12      ILE  12  -8.816  -6.282   1.101
    5   HG13  ILE  12          HG13      ILE  12  -9.690  -5.955  -0.380
    6   HG22  ILE  12          HG21      ILE  12  -9.923  -3.262  -0.755
    7   HG21  ILE  12          HG22      ILE  12  -8.627  -2.741   0.314
    8   HG23  ILE  12          HG23      ILE  12 -10.283  -2.343   0.674
    9   HD12  ILE  12          HD11      ILE  12  -7.182  -5.903  -0.596
   10   HD11  ILE  12          HD12      ILE  12  -7.176  -4.504   0.475
   11   HD13  ILE  12          HD13      ILE  12  -7.965  -4.411  -1.082

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  13           H        ILE  13 -11.567  -4.240   3.536
    2    HA   ILE  13           HA       ILE  13 -12.063  -1.458   3.792
    3    HB   ILE  13           HB       ILE  13 -13.236  -3.886   5.168
    4   HG12  ILE  13          HG12      ILE  13 -13.462  -3.345   2.622
    5   HG13  ILE  13          HG13      ILE  13 -14.872  -3.851   3.527
    6   HG21  ILE  13          HG21      ILE  13 -13.897  -0.967   5.472
    7   HG23  ILE  13          HG22      ILE  13 -13.786  -2.203   6.718
    8   HG22  ILE  13          HG23      ILE  13 -15.173  -2.171   5.632
    9   HD13  ILE  13          HD11      ILE  13 -15.642  -1.563   3.749
   10   HD12  ILE  13          HD12      ILE  13 -15.279  -1.876   2.063
   11   HD11  ILE  13          HD13      ILE  13 -14.143  -0.964   3.031

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ASN  14           H        ASN  14 -10.920  -3.922   6.079
    2    HA   ASN  14           HA       ASN  14 -10.742  -2.271   8.357
    3    HB2  ASN  14           HB2      ASN  14 -10.454  -4.876   8.048
    4    HB3  ASN  14           HB3      ASN  14  -8.750  -4.466   7.889
    5   HD21  ASN  14          HD21      ASN  14  -9.366  -5.989  10.073
    6   HD22  ASN  14          HD22      ASN  14  -9.352  -5.061  11.492

  No H/Q in entry =           6
  In of MODEL   68
    1    H    SER  15           H        SER  15  -8.328  -3.073   5.870
    2    HA   SER  15           HA       SER  15  -6.206  -1.546   6.936
    3    HB2  SER  15           HB2      SER  15  -5.181  -1.760   4.781
    4    HB3  SER  15           HB3      SER  15  -6.120  -3.231   5.009
    5    HG   SER  15           HG       SER  15  -7.247  -2.685   3.341

  No H/Q in entry =           5
  In of MODEL   68
    1    H    GLY  16           H        GLY  16  -8.818  -0.727   4.683
    2    HA3  GLY  16           HA2      GLY  16  -7.998   1.923   4.119
    3    HA2  GLY  16           HA3      GLY  16  -9.640   1.304   3.959

  No H/Q in entry =           3
  In of MODEL   68
    1    H    GLN  17           H        GLN  17 -10.173   0.584   6.612
    2    HA   GLN  17           HA       GLN  17 -10.917   3.084   7.740
    3    HB2  GLN  17           HB2      GLN  17 -12.111   0.973   8.231
    4    HB3  GLN  17           HB3      GLN  17 -10.700   0.393   9.114
    5    HG2  GLN  17           HG2      GLN  17 -12.306   1.327  10.696
    6    HG3  GLN  17           HG3      GLN  17 -10.883   2.367  10.628
    7   HE21  GLN  17          HE21      GLN  17 -11.885   4.391  11.077
    8   HE22  GLN  17          HE22      GLN  17 -13.085   5.071  10.087

  No H/Q in entry =           8
  In of MODEL   68
    1    H    ALA  18           H        ALA  18  -8.256   0.845   8.372
    2    HA   ALA  18           HA       ALA  18  -7.177   2.089  10.637
    3    HB2  ALA  18           HB1      ALA  18  -6.534  -0.125   9.281
    4    HB3  ALA  18           HB2      ALA  18  -5.383   0.681  10.348
    5    HB1  ALA  18           HB3      ALA  18  -5.309   0.952   8.606

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ARG  19           H        ARG  19  -6.412   2.606   7.186
    2    HA   ARG  19           HA       ARG  19  -4.545   4.684   7.605
    3    HB2  ARG  19           HB2      ARG  19  -4.854   3.528   5.416
    4    HB3  ARG  19           HB3      ARG  19  -6.409   4.344   5.234
    5    HG2  ARG  19           HG2      ARG  19  -5.314   6.533   5.291
    6    HG3  ARG  19           HG3      ARG  19  -3.753   5.773   5.600
    7    HD2  ARG  19           HD2      ARG  19  -3.886   6.349   3.254
    8    HD3  ARG  19           HD3      ARG  19  -3.944   4.589   3.409
    9    HE   ARG  19           HE       ARG  19  -6.591   5.457   3.395
   10   HH21  ARG  19          HH11      ARG  19  -7.788   5.585   1.476
   11   HH22  ARG  19          HH12      ARG  19  -6.966   5.668  -0.044
   12   HH11  ARG  19          HH21      ARG  19  -3.816   5.553   1.362
   13   HH12  ARG  19          HH22      ARG  19  -4.716   5.647  -0.108

  No H/Q in entry =          13
  In of MODEL   68
    1    H    SER  20           H        SER  20  -8.044   4.742   7.003
    2    HA   SER  20           HA       SER  20  -8.445   7.492   6.940
    3    HB2  SER  20           HB2      SER  20 -10.140   5.576   6.585
    4    HB3  SER  20           HB3      SER  20 -10.361   5.635   8.332
    5    HG   SER  20           HG       SER  20 -10.389   8.055   6.966

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LEU  21           H        LEU  21  -8.412   5.324   9.756
    2    HA   LEU  21           HA       LEU  21  -8.886   7.322  11.710
    3    HB2  LEU  21           HB2      LEU  21  -7.493   4.643  11.883
    4    HB3  LEU  21           HB3      LEU  21  -7.814   5.662  13.283
    5    HG   LEU  21           HG       LEU  21  -9.968   4.708  11.370
    6   HD12  LEU  21          HD11      LEU  21  -9.196   3.602  14.088
    7   HD11  LEU  21          HD12      LEU  21  -8.880   2.812  12.543
    8   HD13  LEU  21          HD13      LEU  21 -10.541   3.053  13.086
    9   HD21  LEU  21          HD21      LEU  21  -9.929   6.276  13.942
   10   HD23  LEU  21          HD22      LEU  21 -11.318   5.249  13.602
   11   HD22  LEU  21          HD23      LEU  21 -10.902   6.551  12.499

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ALA  22           H        ALA  22  -5.911   5.989  10.311
    2    HA   ALA  22           HA       ALA  22  -4.054   7.342  11.928
    3    HB2  ALA  22           HB1      ALA  22  -3.606   5.486  10.246
    4    HB1  ALA  22           HB2      ALA  22  -2.432   6.801  10.275
    5    HB3  ALA  22           HB3      ALA  22  -3.648   6.731   8.999

  No H/Q in entry =           5
  In of MODEL   68
    1    H    TYR  23           H        TYR  23  -5.385   8.320   8.739
    2    HA   TYR  23           HA       TYR  23  -4.089  10.837   8.657
    3    HB2  TYR  23           HB2      TYR  23  -5.154   9.898   6.668
    4    HB3  TYR  23           HB3      TYR  23  -6.734   9.982   7.448
    5    HD1  TYR  23           HD1      TYR  23  -3.859  12.076   6.311
    6    HD2  TYR  23           HD2      TYR  23  -8.013  11.964   7.396
    7    HE1  TYR  23           HE1      TYR  23  -4.123  14.418   5.538
    8    HE2  TYR  23           HE2      TYR  23  -8.277  14.307   6.623
    9    HH   TYR  23           HH       TYR  23  -5.583  16.052   5.098

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ALA  24           H        ALA  24  -7.193   9.816  10.039
    2    HA   ALA  24           HA       ALA  24  -8.073  12.396  10.795
    3    HB1  ALA  24           HB1      ALA  24  -9.871  11.118  11.268
    4    HB2  ALA  24           HB2      ALA  24  -9.037  10.568  12.720
    5    HB3  ALA  24           HB3      ALA  24  -8.896   9.650  11.221

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ALA  25           H        ALA  25  -6.032   9.979  12.384
    2    HA   ALA  25           HA       ALA  25  -5.717  11.250  14.880
    3    HB2  ALA  25           HB1      ALA  25  -4.911   8.907  14.072
    4    HB3  ALA  25           HB2      ALA  25  -3.911   9.788  15.229
    5    HB1  ALA  25           HB3      ALA  25  -3.473   9.769  13.520

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LEU  26           H        LEU  26  -3.929  11.563  11.839
    2    HA   LEU  26           HA       LEU  26  -2.001  13.419  12.748
    3    HB2  LEU  26           HB2      LEU  26  -1.679  12.261  10.650
    4    HB3  LEU  26           HB3      LEU  26  -3.163  12.942   9.990
    5    HG   LEU  26           HG       LEU  26  -2.185  15.209  10.115
    6   HD12  LEU  26          HD11      LEU  26   0.352  15.272  10.531
    7   HD11  LEU  26          HD12      LEU  26   0.154  13.692  11.283
    8   HD13  LEU  26          HD13      LEU  26  -0.677  15.097  11.952
    9   HD21  LEU  26          HD21      LEU  26  -0.408  13.176   8.732
   10   HD23  LEU  26          HD22      LEU  26  -0.479  14.894   8.353
   11   HD22  LEU  26          HD23      LEU  26  -1.885  13.872   8.068

  No H/Q in entry =          11
  In of MODEL   68
    1    H    LYS  27           H        LYS  27  -5.189  13.842  11.265
    2    HA   LYS  27           HA       LYS  27  -5.179  16.631  11.052
    3    HB2  LYS  27           HB2      LYS  27  -6.898  15.120  10.073
    4    HB3  LYS  27           HB3      LYS  27  -7.552  14.862  11.690
    5    HG2  LYS  27           HG2      LYS  27  -8.020  17.262  11.913
    6    HG3  LYS  27           HG3      LYS  27  -7.315  17.562  10.321
    7    HD2  LYS  27           HD2      LYS  27  -9.024  16.095   9.291
    8    HD3  LYS  27           HD3      LYS  27  -9.734  15.812  10.882
    9    HE2  LYS  27           HE2      LYS  27 -10.216  18.217  11.112
   10    HE3  LYS  27           HE3      LYS  27  -9.477  18.522   9.536
   11    HZ3  LYS  27           HZ1      LYS  27 -11.852  18.358   9.293
   12    HZ2  LYS  27           HZ2      LYS  27 -11.877  16.845  10.071
   13    HZ1  LYS  27           HZ3      LYS  27 -11.133  17.012   8.549

  No H/Q in entry =          13
  In of MODEL   68
    1    H    GLN  28           H        GLN  28  -6.037  14.545  13.790
    2    HA   GLN  28           HA       GLN  28  -6.965  16.544  15.555
    3    HB2  GLN  28           HB2      GLN  28  -5.534  13.930  16.098
    4    HB3  GLN  28           HB3      GLN  28  -6.260  14.934  17.353
    5    HG2  GLN  28           HG2      GLN  28  -7.760  13.818  14.968
    6    HG3  GLN  28           HG3      GLN  28  -7.776  13.106  16.580
    7   HE21  GLN  28          HE21      GLN  28  -9.820  14.750  14.761
    8   HE22  GLN  28          HE22      GLN  28 -10.503  15.820  15.888

  No H/Q in entry =           8
  In of MODEL   68
    1    H    ALA  29           H        ALA  29  -3.726  15.293  14.874
    2    HA   ALA  29           HA       ALA  29  -2.310  16.722  16.846
    3    HB1  ALA  29           HB1      ALA  29  -0.369  16.054  15.732
    4    HB3  ALA  29           HB2      ALA  29  -1.124  16.159  14.142
    5    HB2  ALA  29           HB3      ALA  29  -1.527  14.826  15.223

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LYS  30           H        LYS  30  -3.178  17.572  13.512
    2    HA   LYS  30           HA       LYS  30  -1.802  20.031  13.400
    3    HB2  LYS  30           HB2      LYS  30  -4.320  19.115  11.994
    4    HB3  LYS  30           HB3      LYS  30  -3.506  20.639  11.643
    5    HG2  LYS  30           HG2      LYS  30  -1.419  19.371  11.137
    6    HG3  LYS  30           HG3      LYS  30  -2.305  17.865  11.389
    7    HD2  LYS  30           HD2      LYS  30  -3.877  18.475   9.590
    8    HD3  LYS  30           HD3      LYS  30  -3.013  19.994   9.340
    9    HE2  LYS  30           HE2      LYS  30  -0.964  18.724   8.768
   10    HE3  LYS  30           HE3      LYS  30  -1.846  17.211   8.987
   11    HZ2  LYS  30           HZ1      LYS  30  -1.680  18.072   6.641
   12    HZ1  LYS  30           HZ2      LYS  30  -2.740  19.324   7.102
   13    HZ3  LYS  30           HZ3      LYS  30  -3.244  17.700   7.182

  No H/Q in entry =          13
  In of MODEL   68
    1    H    GLN  31           H        GLN  31  -4.892  19.147  14.815
    2    HA   GLN  31           HA       GLN  31  -5.689  21.896  15.252
    3    HB2  GLN  31           HB2      GLN  31  -6.839  19.442  16.587
    4    HB3  GLN  31           HB3      GLN  31  -7.618  21.003  16.333
    5    HG2  GLN  31           HG2      GLN  31  -6.897  20.222  13.748
    6    HG3  GLN  31           HG3      GLN  31  -7.404  18.715  14.502
    7   HE21  GLN  31          HE21      GLN  31  -8.832  20.261  12.392
    8   HE22  GLN  31          HE22      GLN  31 -10.351  20.638  13.047

  No H/Q in entry =           8
  In of MODEL   68
    1    H    GLY  32           H        GLY  32  -3.355  20.003  16.583
    2    HA3  GLY  32           HA2      GLY  32  -1.961  20.490  18.383
    3    HA2  GLY  32           HA3      GLY  32  -3.105  21.722  18.901

  No H/Q in entry =           3
  In of MODEL   68
    1    H    ASP  33           H        ASP  33  -4.491  18.663  18.253
    2    HA   ASP  33           HA       ASP  33  -4.898  18.214  21.135
    3    HB2  ASP  33           HB2      ASP  33  -6.291  17.175  18.662
    4    HB3  ASP  33           HB3      ASP  33  -6.630  16.568  20.281

  No H/Q in entry =           4
  In of MODEL   68
    1    H    PHE  34           H        PHE  34  -2.719  17.390  21.445
    2    HA   PHE  34           HA       PHE  34  -1.693  15.146  20.055
    3    HB2  PHE  34           HB2      PHE  34  -1.088  16.151  22.845
    4    HB3  PHE  34           HB3      PHE  34  -0.145  14.935  21.984
    5    HD1  PHE  34           HD1      PHE  34  -0.357  18.361  22.703
    6    HD2  PHE  34           HD2      PHE  34   0.505  15.653  19.481
    7    HE1  PHE  34           HE1      PHE  34   0.918  20.142  21.541
    8    HE2  PHE  34           HE2      PHE  34   1.776  17.436  18.324
    9    HZ   PHE  34           HZ       PHE  34   1.984  19.678  19.358

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ALA  35           H        ALA  35  -3.737  15.413  22.916
    2    HA   ALA  35           HA       ALA  35  -3.494  12.758  23.825
    3    HB3  ALA  35           HB1      ALA  35  -5.959  13.360  24.679
    4    HB1  ALA  35           HB2      ALA  35  -5.444  14.982  24.216
    5    HB2  ALA  35           HB3      ALA  35  -4.520  14.074  25.411

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ALA  36           H        ALA  36  -5.961  14.237  21.718
    2    HA   ALA  36           HA       ALA  36  -7.348  11.807  21.251
    3    HB1  ALA  36           HB1      ALA  36  -8.820  13.209  20.288
    4    HB3  ALA  36           HB2      ALA  36  -7.652  13.636  19.037
    5    HB2  ALA  36           HB3      ALA  36  -7.687  14.531  20.557

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ALA  37           H        ALA  37  -4.686  13.417  19.576
    2    HA   ALA  37           HA       ALA  37  -4.632  11.772  17.286
    3    HB3  ALA  37           HB1      ALA  37  -2.659  13.513  18.701
    4    HB2  ALA  37           HB2      ALA  37  -3.190  13.555  17.021
    5    HB1  ALA  37           HB3      ALA  37  -2.022  12.340  17.548

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LYS  38           H        LYS  38  -2.872  11.500  20.366
    2    HA   LYS  38           HA       LYS  38  -1.519   9.113  19.888
    3    HB2  LYS  38           HB2      LYS  38  -1.863  10.882  22.025
    4    HB3  LYS  38           HB3      LYS  38  -2.464   9.348  22.649
    5    HG2  LYS  38           HG2      LYS  38  -0.357   8.249  22.118
    6    HG3  LYS  38           HG3      LYS  38   0.235   9.698  21.298
    7    HD2  LYS  38           HD2      LYS  38   0.389  10.927  23.327
    8    HD3  LYS  38           HD3      LYS  38  -0.617   9.769  24.199
    9    HE2  LYS  38           HE2      LYS  38   1.742   9.483  24.820
   10    HE3  LYS  38           HE3      LYS  38   1.154   8.056  23.963
   11    HZ3  LYS  38           HZ1      LYS  38   2.450   8.482  22.180
   12    HZ2  LYS  38           HZ2      LYS  38   3.396   9.326  23.313
   13    HZ1  LYS  38           HZ3      LYS  38   2.307  10.169  22.317

  No H/Q in entry =          13
  In of MODEL   68
    1    H    ALA  39           H        ALA  39  -4.763   9.577  21.288
    2    HA   ALA  39           HA       ALA  39  -5.293   6.854  21.804
    3    HB3  ALA  39           HB1      ALA  39  -7.473   8.770  21.028
    4    HB2  ALA  39           HB2      ALA  39  -6.578   9.014  22.528
    5    HB1  ALA  39           HB3      ALA  39  -7.478   7.518  22.271

  No H/Q in entry =           5
  In of MODEL   68
    1    H    MET  40           H        MET  40  -5.900   8.847  18.948
    2    HA   MET  40           HA       MET  40  -7.353   6.892  17.496
    3    HB2  MET  40           HB2      MET  40  -5.771   9.301  16.581
    4    HB3  MET  40           HB3      MET  40  -6.785   8.326  15.515
    5    HG2  MET  40           HG2      MET  40  -7.835   9.574  18.067
    6    HG3  MET  40           HG3      MET  40  -7.902  10.401  16.513
    7    HE3  MET  40           HE1      MET  40 -10.466   8.742  14.456
    8    HE2  MET  40           HE2      MET  40  -8.714   8.879  14.307
    9    HE1  MET  40           HE3      MET  40  -9.648  10.237  14.935

  No H/Q in entry =           9
  In of MODEL   68
    1    H    MET  41           H        MET  41  -3.871   7.671  17.617
    2    HA   MET  41           HA       MET  41  -3.091   5.916  15.524
    3    HB2  MET  41           HB2      MET  41  -1.483   6.613  17.995
    4    HB3  MET  41           HB3      MET  41  -0.858   5.965  16.482
    5    HG2  MET  41           HG2      MET  41  -2.040   8.129  15.468
    6    HG3  MET  41           HG3      MET  41  -1.811   8.727  17.110
    7    HE2  MET  41           HE1      MET  41   1.132   6.666  17.482
    8    HE1  MET  41           HE2      MET  41   0.327   7.954  18.374
    9    HE3  MET  41           HE3      MET  41   1.948   8.214  17.731

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ASP  42           H        ASP  42  -3.472   5.454  19.012
    2    HA   ASP  42           HA       ASP  42  -2.404   2.873  19.185
    3    HB2  ASP  42           HB2      ASP  42  -3.300   4.630  20.999
    4    HB3  ASP  42           HB3      ASP  42  -4.715   3.587  20.931

  No H/Q in entry =           4
  In of MODEL   68
    1    H    GLN  43           H        GLN  43  -5.751   3.934  18.678
    2    HA   GLN  43           HA       GLN  43  -6.863   1.332  18.494
    3    HB2  GLN  43           HB2      GLN  43  -7.818   3.968  17.353
    4    HB3  GLN  43           HB3      GLN  43  -8.762   2.477  17.337
    5    HG2  GLN  43           HG2      GLN  43  -8.469   2.370  19.845
    6    HG3  GLN  43           HG3      GLN  43  -7.764   3.984  19.767
    7   HE21  GLN  43          HE21      GLN  43  -9.945   4.044  21.266
    8   HE22  GLN  43          HE22      GLN  43 -11.312   4.599  20.432

  No H/Q in entry =           8
  In of MODEL   68
    1    H    SER  44           H        SER  44  -5.549   3.552  16.073
    2    HA   SER  44           HA       SER  44  -6.230   2.048  13.790
    3    HB2  SER  44           HB2      SER  44  -5.003   4.449  14.224
    4    HB3  SER  44           HB3      SER  44  -3.637   3.468  13.699
    5    HG   SER  44           HG       SER  44  -4.760   4.418  11.931

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ARG  45           H        ARG  45  -3.353   1.980  15.873
    2    HA   ARG  45           HA       ARG  45  -1.848   0.038  14.500
    3    HB2  ARG  45           HB2      ARG  45  -1.025   1.478  16.363
    4    HB3  ARG  45           HB3      ARG  45  -2.005   0.540  17.487
    5    HG2  ARG  45           HG2      ARG  45  -0.748  -1.506  16.854
    6    HG3  ARG  45           HG3      ARG  45   0.256  -0.543  15.772
    7    HD2  ARG  45           HD2      ARG  45   0.973   0.855  17.722
    8    HD3  ARG  45           HD3      ARG  45   0.063  -0.226  18.800
    9    HE   ARG  45           HE       ARG  45   1.783  -1.808  17.227
   10   HH21  ARG  45          HH11      ARG  45   3.692  -2.604  18.069
   11   HH22  ARG  45          HH12      ARG  45   4.455  -1.803  19.397
   12   HH11  ARG  45          HH21      ARG  45   2.054   0.672  19.606
   13   HH12  ARG  45          HH22      ARG  45   3.527   0.055  20.265

  No H/Q in entry =          13
  In of MODEL   68
    1    H    MET  46           H        MET  46  -4.243  -0.300  17.100
    2    HA   MET  46           HA       MET  46  -4.041  -3.096  17.419
    3    HB2  MET  46           HB2      MET  46  -6.230  -1.109  18.012
    4    HB3  MET  46           HB3      MET  46  -6.425  -2.831  18.353
    5    HG2  MET  46           HG2      MET  46  -4.441  -2.811  19.777
    6    HG3  MET  46           HG3      MET  46  -4.139  -1.127  19.383
    7    HE1  MET  46           HE1      MET  46  -6.285  -3.739  20.771
    8    HE3  MET  46           HE2      MET  46  -7.788  -2.895  20.412
    9    HE2  MET  46           HE3      MET  46  -7.241  -3.033  22.081

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ALA  47           H        ALA  47  -6.084  -1.112  15.314
    2    HA   ALA  47           HA       ALA  47  -7.677  -3.187  14.257
    3    HB3  ALA  47           HB1      ALA  47  -8.382  -0.959  13.831
    4    HB1  ALA  47           HB2      ALA  47  -7.885  -1.593  12.262
    5    HB2  ALA  47           HB3      ALA  47  -6.818  -0.508  13.155

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LEU  48           H        LEU  48  -4.573  -1.846  13.202
    2    HA   LEU  48           HA       LEU  48  -4.272  -3.443  10.868
    3    HB2  LEU  48           HB2      LEU  48  -2.230  -2.134  12.672
    4    HB3  LEU  48           HB3      LEU  48  -1.852  -2.857  11.109
    5    HG   LEU  48           HG       LEU  48  -3.900  -0.661  11.487
    6   HD13  LEU  48          HD11      LEU  48  -1.789   0.242  12.151
    7   HD12  LEU  48          HD12      LEU  48  -2.069   0.786  10.497
    8   HD11  LEU  48          HD13      LEU  48  -0.957  -0.547  10.811
    9   HD22  LEU  48          HD21      LEU  48  -4.359  -1.659   9.415
   10   HD21  LEU  48          HD22      LEU  48  -2.671  -2.077   9.123
   11   HD23  LEU  48          HD23      LEU  48  -3.209  -0.404   8.956

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ASN  49           H        ASN  49  -3.225  -3.815  14.216
    2    HA   ASN  49           HA       ASN  49  -1.597  -6.062  13.897
    3    HB2  ASN  49           HB2      ASN  49  -1.617  -4.739  15.940
    4    HB3  ASN  49           HB3      ASN  49  -3.286  -5.189  16.257
    5   HD21  ASN  49          HD21      ASN  49  -0.010  -6.587  15.947
    6   HD22  ASN  49          HD22      ASN  49  -0.308  -7.905  16.973

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLU  50           H        GLU  50  -5.069  -5.820  14.564
    2    HA   GLU  50           HA       GLU  50  -5.553  -8.624  14.684
    3    HB2  GLU  50           HB2      GLU  50  -7.156  -6.950  15.552
    4    HB3  GLU  50           HB3      GLU  50  -7.454  -6.395  13.903
    5    HG2  GLU  50           HG2      GLU  50  -8.296  -8.603  13.273
    6    HG3  GLU  50           HG3      GLU  50  -7.910  -9.236  14.869

  No H/Q in entry =           6
  In of MODEL   68
    1    H    ALA  51           H        ALA  51  -5.643  -6.238  12.078
    2    HA   ALA  51           HA       ALA  51  -6.609  -7.983  10.062
    3    HB2  ALA  51           HB1      ALA  51  -6.406  -6.174   8.686
    4    HB1  ALA  51           HB2      ALA  51  -4.770  -5.807   9.234
    5    HB3  ALA  51           HB3      ALA  51  -6.160  -5.305  10.200

  No H/Q in entry =           5
  In of MODEL   68
    1    H    HIS  52           H        HIS  52  -3.328  -7.040  11.045
    2    HA   HIS  52           HA       HIS  52  -1.913  -8.524   9.103
    3    HB2  HIS  52           HB2      HIS  52  -0.900  -6.773  10.540
    4    HB3  HIS  52           HB3      HIS  52  -1.055  -7.850  11.929
    5    HD1  HIS  52           HD1      HIS  52   0.463  -9.980  11.970
    6    HD2  HIS  52           HD2      HIS  52   1.195  -7.433   8.752
    7    HE1  HIS  52           HE1      HIS  52   2.662 -10.721  10.956
    8    HE2  HIS  52           HE2      HIS  52   3.122  -9.178   8.993

  No H/Q in entry =           8
  In of MODEL   68
    1    H    LEU  53           H        LEU  53  -3.120  -9.400  12.318
    2    HA   LEU  53           HA       LEU  53  -1.899 -11.932  12.524
    3    HB2  LEU  53           HB2      LEU  53  -4.402 -10.775  13.728
    4    HB3  LEU  53           HB3      LEU  53  -3.913 -12.440  14.034
    5    HG   LEU  53           HG       LEU  53  -2.044 -10.094  14.486
    6   HD11  LEU  53          HD11      LEU  53  -4.019 -11.404  16.370
    7   HD13  LEU  53          HD12      LEU  53  -3.906  -9.697  15.943
    8   HD12  LEU  53          HD13      LEU  53  -2.653 -10.444  16.928
    9   HD23  LEU  53          HD21      LEU  53  -1.145 -11.859  16.196
   10   HD22  LEU  53          HD22      LEU  53  -0.758 -12.070  14.492
   11   HD21  LEU  53          HD23      LEU  53  -2.030 -13.029  15.226

  No H/Q in entry =          11
  In of MODEL   68
    1    H    VAL  54           H        VAL  54  -5.018 -10.936  11.154
    2    HA   VAL  54           HA       VAL  54  -5.908 -13.541  10.476
    3    HB   VAL  54           HB       VAL  54  -6.578 -10.818   9.330
    4   HG12  VAL  54          HG11      VAL  54  -8.667 -12.218   8.522
    5   HG11  VAL  54          HG12      VAL  54  -7.543 -13.574   8.601
    6   HG13  VAL  54          HG13      VAL  54  -7.194 -12.200   7.554
    7   HG22  VAL  54          HG21      VAL  54  -7.486 -10.855  11.481
    8   HG21  VAL  54          HG22      VAL  54  -7.725 -12.601  11.468
    9   HG23  VAL  54          HG23      VAL  54  -8.815 -11.557  10.557

  No H/Q in entry =           9
  In of MODEL   68
    1    H    GLN  55           H        GLN  55  -4.056 -11.081   8.679
    2    HA   GLN  55           HA       GLN  55  -3.911 -12.554   6.268
    3    HB2  GLN  55           HB2      GLN  55  -3.326 -10.285   6.069
    4    HB3  GLN  55           HB3      GLN  55  -2.216 -10.347   7.436
    5    HG2  GLN  55           HG2      GLN  55  -0.490 -11.183   6.165
    6    HG3  GLN  55           HG3      GLN  55  -1.554 -12.171   5.174
    7   HE21  GLN  55          HE21      GLN  55  -1.575 -11.490   3.050
    8   HE22  GLN  55          HE22      GLN  55  -1.390  -9.886   2.533

  No H/Q in entry =           8
  In of MODEL   68
    1    H    THR  56           H        THR  56  -1.808 -12.504   9.151
    2    HA   THR  56           HA       THR  56   0.284 -14.089   8.242
    3    HB   THR  56           HB       THR  56  -0.956 -14.345  10.990
    4    HG1  THR  56           HG1      THR  56   0.686 -12.358   9.841
    5   HG23  THR  56          HG21      THR  56   1.191 -15.031  11.695
    6   HG22  THR  56          HG22      THR  56   1.959 -14.427  10.227
    7   HG21  THR  56          HG23      THR  56   0.953 -15.874  10.165

  No H/Q in entry =           7
  In of MODEL   68
    1    H    LYS  57           H        LYS  57  -2.829 -15.145   9.606
    2    HA   LYS  57           HA       LYS  57  -2.360 -17.938   9.372
    3    HB2  LYS  57           HB2      LYS  57  -4.188 -16.858  10.712
    4    HB3  LYS  57           HB3      LYS  57  -4.983 -16.418   9.207
    5    HG2  LYS  57           HG2      LYS  57  -5.215 -18.779   8.603
    6    HG3  LYS  57           HG3      LYS  57  -4.360 -19.257  10.068
    7    HD2  LYS  57           HD2      LYS  57  -6.146 -18.240  11.445
    8    HD3  LYS  57           HD3      LYS  57  -7.009 -17.775   9.979
    9    HE2  LYS  57           HE2      LYS  57  -7.208 -20.153   9.334
   10    HE3  LYS  57           HE3      LYS  57  -6.337 -20.636  10.787
   11    HZ2  LYS  57           HZ1      LYS  57  -9.066 -19.676  10.487
   12    HZ1  LYS  57           HZ2      LYS  57  -8.226 -19.137  11.862
   13    HZ3  LYS  57           HZ3      LYS  57  -8.420 -20.801  11.582

  No H/Q in entry =          13
  In of MODEL   68
    1    H    LEU  58           H        LEU  58  -3.708 -15.515   7.185
    2    HA   LEU  58           HA       LEU  58  -4.494 -17.355   5.185
    3    HB2  LEU  58           HB2      LEU  58  -3.910 -14.402   5.039
    4    HB3  LEU  58           HB3      LEU  58  -4.565 -15.350   3.702
    5    HG   LEU  58           HG       LEU  58  -5.849 -15.169   6.447
    6   HD11  LEU  58          HD11      LEU  58  -6.160 -13.534   3.948
    7   HD13  LEU  58          HD12      LEU  58  -6.155 -13.020   5.635
    8   HD12  LEU  58          HD13      LEU  58  -7.571 -13.827   4.965
    9   HD22  LEU  58          HD21      LEU  58  -6.796 -17.089   5.584
   10   HD21  LEU  58          HD22      LEU  58  -6.458 -16.641   3.912
   11   HD23  LEU  58          HD23      LEU  58  -7.828 -15.923   4.758

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  59           H        ILE  59  -1.369 -16.116   6.045
    2    HA   ILE  59           HA       ILE  59  -0.262 -16.846   3.413
    3    HB   ILE  59           HB       ILE  59   0.488 -14.767   4.974
    4   HG12  ILE  59          HG12      ILE  59   2.599 -16.404   3.555
    5   HG13  ILE  59          HG13      ILE  59   1.391 -15.488   2.690
    6   HG21  ILE  59          HG21      ILE  59   1.252 -16.550   6.732
    7   HG23  ILE  59          HG22      ILE  59   2.322 -15.211   6.384
    8   HG22  ILE  59          HG23      ILE  59   2.613 -16.793   5.663
    9   HD12  ILE  59          HD11      ILE  59   3.520 -14.223   3.021
   10   HD11  ILE  59          HD12      ILE  59   3.241 -14.300   4.759
   11   HD13  ILE  59          HD13      ILE  59   2.121 -13.415   3.724

  No H/Q in entry =          11
  In of MODEL   68
    1    H    GLU  60           H        GLU  60  -0.269 -17.938   6.785
    2    HA   GLU  60           HA       GLU  60   1.778 -19.901   6.531
    3    HB2  GLU  60           HB2      GLU  60   0.985 -19.098   8.714
    4    HB3  GLU  60           HB3      GLU  60  -0.598 -19.813   8.412
    5    HG2  GLU  60           HG2      GLU  60   0.444 -22.056   8.283
    6    HG3  GLU  60           HG3      GLU  60   2.021 -21.334   8.601

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLY  61           H        GLY  61  -1.732 -20.028   6.041
    2    HA3  GLY  61           HA2      GLY  61  -1.461 -22.823   5.095
    3    HA2  GLY  61           HA3      GLY  61  -2.952 -22.096   5.683

  No H/Q in entry =           3
  In of MODEL   68
    1    H    ASP  62           H        ASP  62  -0.732 -20.509   3.477
    2    HA   ASP  62           HA       ASP  62  -2.830 -20.005   1.589
    3    HB2  ASP  62           HB2      ASP  62  -1.036 -18.865   0.321
    4    HB3  ASP  62           HB3      ASP  62  -1.088 -18.354   2.005

  No H/Q in entry =           4
  In of MODEL   68
    1    H    ALA  63           H        ALA  63  -3.337 -22.357   1.151
    2    HA   ALA  63           HA       ALA  63  -1.504 -24.042  -0.239
    3    HB3  ALA  63           HB1      ALA  63  -3.692 -24.693   0.916
    4    HB1  ALA  63           HB2      ALA  63  -3.315 -25.474  -0.620
    5    HB2  ALA  63           HB3      ALA  63  -4.489 -24.159  -0.566

  No H/Q in entry =           5
  In of MODEL   68
    1    H    GLY  64           H        GLY  64  -3.909 -21.665  -1.250
    2    HA3  GLY  64           HA2      GLY  64  -4.018 -20.425  -3.207
    3    HA2  GLY  64           HA3      GLY  64  -2.613 -21.290  -3.804

  No H/Q in entry =           3
  In of MODEL   68
    1    H    GLU  65           H        GLU  65  -3.890 -21.232  -5.858
    2    HA   GLU  65           HA       GLU  65  -6.324 -22.641  -6.102
    3    HB2  GLU  65           HB2      GLU  65  -4.224 -21.934  -8.147
    4    HB3  GLU  65           HB3      GLU  65  -5.775 -22.671  -8.552
    5    HG2  GLU  65           HG2      GLU  65  -6.970 -20.795  -7.541
    6    HG3  GLU  65           HG3      GLU  65  -5.448 -20.072  -7.029

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLY  66           H        GLY  66  -3.007 -23.628  -6.478
    2    HA3  GLY  66           HA2      GLY  66  -3.819 -26.437  -6.846
    3    HA2  GLY  66           HA3      GLY  66  -2.329 -25.752  -7.465

  No H/Q in entry =           3
  In of MODEL   68
    1    H    LYS  67           H        LYS  67  -0.901 -27.062  -6.492
    2    HA   LYS  67           HA       LYS  67  -1.073 -27.843  -3.751
    3    HB2  LYS  67           HB2      LYS  67   1.395 -28.609  -4.408
    4    HB3  LYS  67           HB3      LYS  67  -0.043 -29.476  -4.960
    5    HG2  LYS  67           HG2      LYS  67  -0.029 -28.343  -7.072
    6    HG3  LYS  67           HG3      LYS  67   1.184 -27.190  -6.518
    7    HD2  LYS  67           HD2      LYS  67   2.832 -29.029  -6.330
    8    HD3  LYS  67           HD3      LYS  67   1.617 -30.163  -6.925
    9    HE2  LYS  67           HE2      LYS  67   1.438 -28.910  -9.027
   10    HE3  LYS  67           HE3      LYS  67   2.602 -27.725  -8.436
   11    HZ2  LYS  67           HZ1      LYS  67   3.336 -29.748  -9.915
   12    HZ1  LYS  67           HZ2      LYS  67   3.384 -30.542  -8.415
   13    HZ3  LYS  67           HZ3      LYS  67   4.330 -29.155  -8.676

  No H/Q in entry =          13
  In of MODEL   68
    1    H    MET  68           H        MET  68   1.929 -26.694  -5.038
    2    HA   MET  68           HA       MET  68   2.797 -25.468  -2.658
    3    HB2  MET  68           HB2      MET  68   3.781 -25.423  -5.498
    4    HB3  MET  68           HB3      MET  68   4.598 -24.525  -4.219
    5    HG2  MET  68           HG2      MET  68   4.888 -26.581  -2.921
    6    HG3  MET  68           HG3      MET  68   4.008 -27.499  -4.145
    7    HE2  MET  68           HE1      MET  68   8.163 -25.660  -4.292
    8    HE1  MET  68           HE2      MET  68   6.856 -25.405  -3.138
    9    HE3  MET  68           HE3      MET  68   6.825 -24.574  -4.691

  No H/Q in entry =           9
  In of MODEL   68
    1    H    LYS  69           H        LYS  69   1.416 -24.042  -5.611
    2    HA   LYS  69           HA       LYS  69   1.982 -21.393  -5.219
    3    HB2  LYS  69           HB2      LYS  69  -0.264 -22.788  -6.565
    4    HB3  LYS  69           HB3      LYS  69  -0.358 -21.035  -6.354
    5    HG2  LYS  69           HG2      LYS  69   0.747 -21.567  -8.481
    6    HG3  LYS  69           HG3      LYS  69   1.884 -20.800  -7.372
    7    HD2  LYS  69           HD2      LYS  69   2.849 -22.948  -6.786
    8    HD3  LYS  69           HD3      LYS  69   1.628 -23.796  -7.738
    9    HE2  LYS  69           HE2      LYS  69   3.657 -21.837  -8.854
   10    HE3  LYS  69           HE3      LYS  69   3.766 -23.592  -8.978
   11    HZ3  LYS  69           HZ1      LYS  69   2.783 -22.978 -10.959
   12    HZ2  LYS  69           HZ2      LYS  69   1.831 -21.766 -10.246
   13    HZ1  LYS  69           HZ3      LYS  69   1.443 -23.403 -10.010

  No H/Q in entry =          13
  In of MODEL   68
    1    H    VAL  70           H        VAL  70   0.202 -19.625  -4.881
    2    HA   VAL  70           HA       VAL  70  -1.219 -20.126  -2.329
    3    HB   VAL  70           HB       VAL  70  -0.559 -17.820  -1.637
    4   HG11  VAL  70          HG11      VAL  70   0.771 -20.004  -1.144
    5   HG13  VAL  70          HG12      VAL  70   1.551 -18.455  -0.820
    6   HG12  VAL  70          HG13      VAL  70   1.950 -19.355  -2.284
    7   HG22  VAL  70          HG21      VAL  70  -0.106 -16.682  -3.682
    8   HG21  VAL  70          HG22      VAL  70   0.969 -17.959  -4.245
    9   HG23  VAL  70          HG23      VAL  70   1.487 -16.886  -2.950

  No H/Q in entry =           9
  In of MODEL   68
    1    H    SER  71           H        SER  71  -2.911 -18.518  -1.910
    2    HA   SER  71           HA       SER  71  -4.680 -18.169  -4.095
    3    HB2  SER  71           HB2      SER  71  -5.422 -18.291  -1.711
    4    HB3  SER  71           HB3      SER  71  -4.669 -16.727  -1.417
    5    HG   SER  71           HG       SER  71  -6.803 -17.337  -3.189

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LEU  72           H        LEU  72  -5.025 -16.464  -5.441
    2    HA   LEU  72           HA       LEU  72  -2.933 -14.636  -5.929
    3    HB2  LEU  72           HB2      LEU  72  -5.797 -14.719  -6.875
    4    HB3  LEU  72           HB3      LEU  72  -4.610 -13.553  -7.455
    5    HG   LEU  72           HG       LEU  72  -4.174 -16.555  -7.575
    6   HD12  LEU  72          HD11      LEU  72  -4.753 -16.342  -9.980
    7   HD11  LEU  72          HD12      LEU  72  -5.210 -14.661  -9.705
    8   HD13  LEU  72          HD13      LEU  72  -6.124 -15.959  -8.938
    9   HD22  LEU  72          HD21      LEU  72  -2.069 -15.541  -7.830
   10   HD21  LEU  72          HD22      LEU  72  -2.724 -14.131  -8.646
   11   HD23  LEU  72          HD23      LEU  72  -2.618 -15.669  -9.498

  No H/Q in entry =          11
  In of MODEL   68
    1    H    VAL  73           H        VAL  73  -6.029 -14.300  -4.301
    2    HA   VAL  73           HA       VAL  73  -6.099 -11.529  -3.960
    3    HB   VAL  73           HB       VAL  73  -7.833 -11.889  -2.420
    4   HG12  VAL  73          HG11      VAL  73  -7.943 -14.465  -3.969
    5   HG11  VAL  73          HG12      VAL  73  -8.027 -12.919  -4.810
    6   HG13  VAL  73          HG13      VAL  73  -9.248 -13.335  -3.606
    7   HG22  VAL  73          HG21      VAL  73  -6.763 -13.246  -0.765
    8   HG21  VAL  73          HG22      VAL  73  -6.482 -14.549  -1.918
    9   HG23  VAL  73          HG23      VAL  73  -8.119 -14.200  -1.364

  No H/Q in entry =           9
  In of MODEL   68
    1    H    LEU  74           H        LEU  74  -4.141 -13.874  -2.368
    2    HA   LEU  74           HA       LEU  74  -3.740 -12.720   0.151
    3    HB2  LEU  74           HB2      LEU  74  -2.935 -14.932  -0.333
    4    HB3  LEU  74           HB3      LEU  74  -1.893 -14.320  -1.618
    5    HG   LEU  74           HG       LEU  74  -0.598 -13.035   0.057
    6   HD13  LEU  74          HD11      LEU  74  -2.140 -12.575   1.799
    7   HD12  LEU  74          HD12      LEU  74  -1.056 -13.779   2.499
    8   HD11  LEU  74          HD13      LEU  74  -2.647 -14.261   1.907
    9   HD21  LEU  74          HD21      LEU  74  -0.351 -15.590  -0.566
   10   HD23  LEU  74          HD22      LEU  74  -0.769 -15.786   1.122
   11   HD22  LEU  74          HD23      LEU  74   0.651 -14.863   0.689

  No H/Q in entry =          11
  In of MODEL   68
    1    H    VAL  75           H        VAL  75  -1.852 -12.321  -2.807
    2    HA   VAL  75           HA       VAL  75  -0.072 -10.377  -1.803
    3    HB   VAL  75           HB       VAL  75  -1.023 -10.887  -4.623
    4   HG11  VAL  75          HG11      VAL  75   1.219  -9.115  -3.554
    5   HG13  VAL  75          HG12      VAL  75  -0.199  -8.587  -4.447
    6   HG12  VAL  75          HG13      VAL  75   1.024  -9.561  -5.245
    7   HG21  VAL  75          HG21      VAL  75   1.477 -11.641  -3.064
    8   HG23  VAL  75          HG22      VAL  75   1.235 -11.951  -4.783
    9   HG22  VAL  75          HG23      VAL  75   0.207 -12.747  -3.591

  No H/Q in entry =           9
  In of MODEL   68
    1    H    GLU  76           H        GLU  76  -3.225 -10.063  -3.463
    2    HA   GLU  76           HA       GLU  76  -3.302  -7.250  -3.573
    3    HB2  GLU  76           HB2      GLU  76  -4.944  -8.747  -4.717
    4    HB3  GLU  76           HB3      GLU  76  -5.617  -9.176  -3.152
    5    HG2  GLU  76           HG2      GLU  76  -6.284  -6.840  -2.769
    6    HG3  GLU  76           HG3      GLU  76  -5.595  -6.360  -4.308

  No H/Q in entry =           6
  In of MODEL   68
    1    H    ALA  77           H        ALA  77  -4.393  -9.479  -1.026
    2    HA   ALA  77           HA       ALA  77  -5.367  -7.479   0.726
    3    HB2  ALA  77           HB1      ALA  77  -5.723 -10.025   0.837
    4    HB3  ALA  77           HB2      ALA  77  -5.494  -9.174   2.363
    5    HB1  ALA  77           HB3      ALA  77  -4.161 -10.083   1.653

  No H/Q in entry =           5
  In of MODEL   68
    1    H    GLN  78           H        GLN  78  -2.206  -9.003   0.367
    2    HA   GLN  78           HA       GLN  78  -0.959  -7.824   2.613
    3    HB2  GLN  78           HB2      GLN  78  -0.082  -9.762   1.262
    4    HB3  GLN  78           HB3      GLN  78   0.347  -8.615  -0.005
    5    HG2  GLN  78           HG2      GLN  78   1.795  -7.406   1.578
    6    HG3  GLN  78           HG3      GLN  78   1.369  -8.550   2.848
    7   HE21  GLN  78          HE21      GLN  78   3.311  -9.724   3.128
    8   HE22  GLN  78          HE22      GLN  78   4.120 -10.526   1.867

  No H/Q in entry =           8
  In of MODEL   68
    1    H    LEU  79           H        LEU  79  -1.334  -6.778  -0.738
    2    HA   LEU  79           HA       LEU  79   0.334  -4.537  -0.732
    3    HB2  LEU  79           HB2      LEU  79  -0.686  -5.359  -2.783
    4    HB3  LEU  79           HB3      LEU  79  -2.293  -4.978  -2.176
    5    HG   LEU  79           HG       LEU  79  -1.768  -2.587  -2.158
    6   HD13  LEU  79          HD11      LEU  79   0.470  -2.323  -1.647
    7   HD12  LEU  79          HD12      LEU  79   0.517  -2.042  -3.387
    8   HD11  LEU  79          HD13      LEU  79   0.984  -3.614  -2.735
    9   HD23  LEU  79          HD21      LEU  79  -1.135  -2.391  -4.711
   10   HD22  LEU  79          HD22      LEU  79  -2.655  -3.150  -4.250
   11   HD21  LEU  79          HD23      LEU  79  -1.275  -4.149  -4.691

  No H/Q in entry =          11
  In of MODEL   68
    1    H    HIS  80           H        HIS  80  -3.131  -4.724   0.095
    2    HA   HIS  80           HA       HIS  80  -3.344  -1.967   0.749
    3    HB2  HIS  80           HB2      HIS  80  -5.027  -4.387   1.076
    4    HB3  HIS  80           HB3      HIS  80  -5.358  -3.046   2.175
    5    HD1  HIS  80           HD1      HIS  80  -6.987  -1.424   1.262
    6    HD2  HIS  80           HD2      HIS  80  -4.781  -3.230  -1.779
    7    HE1  HIS  80           HE1      HIS  80  -7.835  -0.441  -0.920
    8    HE2  HIS  80           HE2      HIS  80  -6.496  -1.536  -2.784

  No H/Q in entry =           8
  In of MODEL   68
    1    H    LEU  81           H        LEU  81  -2.833  -4.851   2.752
    2    HA   LEU  81           HA       LEU  81  -2.831  -3.495   5.232
    3    HB2  LEU  81           HB2      LEU  81  -1.593  -6.106   4.361
    4    HB3  LEU  81           HB3      LEU  81  -1.571  -5.541   6.033
    5    HG   LEU  81           HG       LEU  81  -4.115  -5.817   4.406
    6   HD12  LEU  81          HD11      LEU  81  -4.403  -7.880   5.960
    7   HD11  LEU  81          HD12      LEU  81  -2.651  -7.796   6.146
    8   HD13  LEU  81          HD13      LEU  81  -3.358  -8.037   4.548
    9   HD23  LEU  81          HD21      LEU  81  -4.957  -6.018   6.907
   10   HD22  LEU  81          HD22      LEU  81  -4.644  -4.429   6.212
   11   HD21  LEU  81          HD23      LEU  81  -3.451  -5.177   7.275

  No H/Q in entry =          11
  In of MODEL   68
    1    H    MET  82           H        MET  82  -0.143  -4.387   3.064
    2    HA   MET  82           HA       MET  82   1.933  -3.472   4.744
    3    HB2  MET  82           HB2      MET  82   1.721  -3.826   1.753
    4    HB3  MET  82           HB3      MET  82   3.199  -3.242   2.515
    5    HG2  MET  82           HG2      MET  82   1.810  -5.839   3.248
    6    HG3  MET  82           HG3      MET  82   3.180  -5.723   2.148
    7    HE3  MET  82           HE1      MET  82   6.191  -4.960   4.129
    8    HE2  MET  82           HE2      MET  82   5.259  -3.601   3.506
    9    HE1  MET  82           HE3      MET  82   5.357  -5.093   2.575

  No H/Q in entry =           9
  In of MODEL   68
    1    H    THR  83           H        THR  83   0.100  -1.852   2.182
    2    HA   THR  83           HA       THR  83   1.496   0.606   2.260
    3    HB   THR  83           HB       THR  83  -0.687   1.513   1.271
    4    HG1  THR  83           HG1      THR  83  -2.329   0.205   1.169
    5   HG22  THR  83          HG21      THR  83  -0.405  -0.310  -0.723
    6   HG21  THR  83          HG22      THR  83   1.098  -0.589   0.154
    7   HG23  THR  83          HG23      THR  83   0.726   1.020  -0.466

  No H/Q in entry =           7
  In of MODEL   68
    1    H    SER  84           H        SER  84  -1.504  -0.440   3.865
    2    HA   SER  84           HA       SER  84  -2.015   1.991   5.201
    3    HB2  SER  84           HB2      SER  84  -2.830  -0.850   5.776
    4    HB3  SER  84           HB3      SER  84  -3.332   0.491   6.804
    5    HG   SER  84           HG       SER  84  -3.788   0.165   4.013

  No H/Q in entry =           5
  In of MODEL   68
    1    H    MET  85           H        MET  85  -0.286  -0.926   6.341
    2    HA   MET  85           HA       MET  85   0.228   0.013   8.942
    3    HB2  MET  85           HB2      MET  85   0.535  -2.331   8.276
    4    HB3  MET  85           HB3      MET  85   1.910  -1.864   7.275
    5    HG2  MET  85           HG2      MET  85   3.087  -1.013   9.266
    6    HG3  MET  85           HG3      MET  85   1.703  -1.442  10.272
    7    HE1  MET  85           HE1      MET  85   3.355  -2.458  11.716
    8    HE3  MET  85           HE2      MET  85   4.839  -2.729  10.805
    9    HE2  MET  85           HE3      MET  85   4.014  -4.090  11.558

  No H/Q in entry =           9
  In of MODEL   68
    1    H    LEU  86           H        LEU  86   2.160   0.271   5.989
    2    HA   LEU  86           HA       LEU  86   4.366   1.599   7.140
    3    HB2  LEU  86           HB2      LEU  86   4.181   0.507   4.835
    4    HB3  LEU  86           HB3      LEU  86   3.364   1.982   4.317
    5    HG   LEU  86           HG       LEU  86   5.385   3.244   5.293
    6   HD11  LEU  86          HD11      LEU  86   6.106   0.639   6.102
    7   HD13  LEU  86          HD12      LEU  86   7.101   2.091   6.194
    8   HD12  LEU  86          HD13      LEU  86   7.216   1.038   4.786
    9   HD23  LEU  86          HD21      LEU  86   6.112   1.477   2.949
   10   HD22  LEU  86          HD22      LEU  86   6.495   3.177   3.204
   11   HD21  LEU  86          HD23      LEU  86   4.845   2.698   2.808

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ALA  87           H        ALA  87   1.446   2.819   5.551
    2    HA   ALA  87           HA       ALA  87   2.024   5.553   5.625
    3    HB1  ALA  87           HB1      ALA  87  -0.275   3.909   5.090
    4    HB3  ALA  87           HB2      ALA  87   0.025   5.570   4.584
    5    HB2  ALA  87           HB3      ALA  87  -0.766   5.249   6.129

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ARG  88           H        ARG  88   0.347   3.550   8.023
    2    HA   ARG  88           HA       ARG  88  -0.177   5.603   9.862
    3    HB2  ARG  88           HB2      ARG  88  -1.101   3.245   9.937
    4    HB3  ARG  88           HB3      ARG  88   0.443   2.757  10.645
    5    HG2  ARG  88           HG2      ARG  88  -0.046   4.835  12.257
    6    HG3  ARG  88           HG3      ARG  88  -1.711   4.498  11.802
    7    HD2  ARG  88           HD2      ARG  88  -1.807   2.653  13.056
    8    HD3  ARG  88           HD3      ARG  88  -0.214   2.079  12.527
    9    HE   ARG  88           HE       ARG  88  -0.755   3.348  14.976
   10   HH21  ARG  88          HH11      ARG  88   0.797   4.374  16.211
   11   HH22  ARG  88          HH12      ARG  88   2.314   4.808  15.504
   12   HH11  ARG  88          HH21      ARG  88   1.524   3.534  12.398
   13   HH12  ARG  88          HH22      ARG  88   2.734   4.316  13.357

  No H/Q in entry =          13
  In of MODEL   68
    1    H    GLU  89           H        GLU  89   2.633   3.401   9.647
    2    HA   GLU  89           HA       GLU  89   3.890   4.306  11.987
    3    HB2  GLU  89           HB2      GLU  89   4.561   2.287  10.651
    4    HB3  GLU  89           HB3      GLU  89   5.329   3.382   9.500
    5    HG2  GLU  89           HG2      GLU  89   6.809   4.245  11.240
    6    HG3  GLU  89           HG3      GLU  89   5.981   3.288  12.464

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LEU  90           H        LEU  90   4.199   5.453   8.655
    2    HA   LEU  90           HA       LEU  90   6.116   7.469   9.232
    3    HB2  LEU  90           HB2      LEU  90   4.112   7.115   7.006
    4    HB3  LEU  90           HB3      LEU  90   5.334   8.394   7.022
    5    HG   LEU  90           HG       LEU  90   6.027   5.463   7.367
    6   HD12  LEU  90          HD11      LEU  90   6.774   5.692   4.926
    7   HD11  LEU  90          HD12      LEU  90   5.749   7.126   4.873
    8   HD13  LEU  90          HD13      LEU  90   5.039   5.550   5.222
    9   HD22  LEU  90          HD21      LEU  90   7.917   6.629   8.045
   10   HD21  LEU  90          HD22      LEU  90   7.557   8.027   7.032
   11   HD23  LEU  90          HD23      LEU  90   8.227   6.564   6.311

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  91           H        ILE  91   2.577   7.459   9.083
    2    HA   ILE  91           HA       ILE  91   2.215  10.231   9.523
    3    HB   ILE  91           HB       ILE  91   0.441   7.845  10.075
    4   HG12  ILE  91          HG12      ILE  91   0.177  10.117   8.081
    5   HG13  ILE  91          HG13      ILE  91   1.047   8.627   7.715
    6   HG22  ILE  91          HG21      ILE  91  -1.306   9.891  10.131
    7   HG21  ILE  91          HG22      ILE  91   0.090  10.734  10.800
    8   HG23  ILE  91          HG23      ILE  91  -0.537   9.296  11.602
    9   HD13  ILE  91          HD11      ILE  91  -0.888   7.326   7.765
   10   HD12  ILE  91          HD12      ILE  91  -1.488   8.834   7.077
   11   HD11  ILE  91          HD13      ILE  91  -1.756   8.475   8.783

  No H/Q in entry =          11
  In of MODEL   68
    1    H    THR  92           H        THR  92   2.639   7.502  11.735
    2    HA   THR  92           HA       THR  92   2.185   8.882  14.154
    3    HB   THR  92           HB       THR  92   4.011   6.558  13.498
    4    HG1  THR  92           HG1      THR  92   2.048   5.785  13.401
    5   HG22  THR  92          HG21      THR  92   3.630   6.281  16.133
    6   HG21  THR  92          HG22      THR  92   3.551   8.040  16.052
    7   HG23  THR  92          HG23      THR  92   4.991   7.193  15.483

  No H/Q in entry =           7
  In of MODEL   68
    1    H    GLU  93           H        GLU  93   5.139   8.447  12.222
    2    HA   GLU  93           HA       GLU  93   6.882   9.895  13.913
    3    HB2  GLU  93           HB2      GLU  93   6.973   9.569  10.899
    4    HB3  GLU  93           HB3      GLU  93   8.309  10.113  11.912
    5    HG2  GLU  93           HG2      GLU  93   6.921   7.468  12.370
    6    HG3  GLU  93           HG3      GLU  93   8.303   7.626  11.293

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LEU  94           H        LEU  94   4.826  10.882  11.196
    2    HA   LEU  94           HA       LEU  94   5.609  13.592  11.085
    3    HB2  LEU  94           HB2      LEU  94   3.030  12.203  10.336
    4    HB3  LEU  94           HB3      LEU  94   3.274  13.931  10.088
    5    HG   LEU  94           HG       LEU  94   5.308  11.956   9.046
    6   HD11  LEU  94          HD11      LEU  94   2.562  12.479   7.981
    7   HD13  LEU  94          HD12      LEU  94   3.557  11.030   7.862
    8   HD12  LEU  94          HD13      LEU  94   3.881  12.409   6.811
    9   HD23  LEU  94          HD21      LEU  94   5.543  13.787   7.315
   10   HD22  LEU  94          HD22      LEU  94   5.953  14.290   8.955
   11   HD21  LEU  94          HD23      LEU  94   4.399  14.742   8.255

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  95           H        ILE  95   3.084  11.962  12.982
    2    HA   ILE  95           HA       ILE  95   2.021  14.308  14.167
    3    HB   ILE  95           HB       ILE  95   2.063  11.430  15.104
    4   HG12  ILE  95          HG12      ILE  95  -0.173  13.180  14.046
    5   HG13  ILE  95          HG13      ILE  95   0.793  12.125  13.019
    6   HG21  ILE  95          HG21      ILE  95   0.759  13.896  16.295
    7   HG23  ILE  95          HG22      ILE  95   1.817  12.740  17.104
    8   HG22  ILE  95          HG23      ILE  95   0.186  12.263  16.631
    9   HD13  ILE  95          HD11      ILE  95  -0.093  10.182  13.946
   10   HD12  ILE  95          HD12      ILE  95  -1.485  11.260  14.017
   11   HD11  ILE  95          HD13      ILE  95  -0.518  10.976  15.464

  No H/Q in entry =          11
  In of MODEL   68
    1    H    GLU  96           H        GLU  96   4.635  12.116  15.173
    2    HA   GLU  96           HA       GLU  96   5.179  13.331  17.659
    3    HB2  GLU  96           HB2      GLU  96   6.146  11.177  17.022
    4    HB3  GLU  96           HB3      GLU  96   7.073  11.954  15.739
    5    HG2  GLU  96           HG2      GLU  96   8.716  12.524  17.199
    6    HG3  GLU  96           HG3      GLU  96   7.562  13.331  18.250

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LEU  97           H        LEU  97   6.247  14.098  14.371
    2    HA   LEU  97           HA       LEU  97   8.114  16.115  15.075
    3    HB2  LEU  97           HB2      LEU  97   6.529  15.540  12.581
    4    HB3  LEU  97           HB3      LEU  97   7.535  16.982  12.697
    5    HG   LEU  97           HG       LEU  97   8.590  14.197  13.270
    6   HD12  LEU  97          HD11      LEU  97   9.586  14.390  10.952
    7   HD11  LEU  97          HD12      LEU  97   8.521  15.769  10.682
    8   HD13  LEU  97          HD13      LEU  97   7.837  14.172  10.983
    9   HD23  LEU  97          HD21      LEU  97  10.747  15.493  12.522
   10   HD22  LEU  97          HD22      LEU  97  10.125  15.763  14.150
   11   HD21  LEU  97          HD23      LEU  97   9.800  16.938  12.876

  No H/Q in entry =          11
  In of MODEL   68
    1    H    HIS  98           H        HIS  98   4.622  16.214  14.418
    2    HA   HIS  98           HA       HIS  98   4.295  19.011  14.541
    3    HB2  HIS  98           HB2      HIS  98   2.427  16.746  15.276
    4    HB3  HIS  98           HB3      HIS  98   1.943  18.442  15.325
    5    HD1  HIS  98           HD1      HIS  98   2.992  15.726  12.932
    6    HD2  HIS  98           HD2      HIS  98   1.578  19.646  12.792
    7    HE1  HIS  98           HE1      HIS  98   2.429  16.199  10.505
    8    HE2  HIS  98           HE2      HIS  98   1.572  18.580  10.399

  No H/Q in entry =           8
  In of MODEL   68
    1    H    GLU  99           H        GLU  99   4.452  16.535  17.051
    2    HA   GLU  99           HA       GLU  99   3.826  18.233  19.241
    3    HB2  GLU  99           HB2      GLU  99   3.762  15.750  19.349
    4    HB3  GLU  99           HB3      GLU  99   5.522  15.722  19.242
    5    HG2  GLU  99           HG2      GLU  99   5.697  17.025  21.311
    6    HG3  GLU  99           HG3      GLU  99   3.943  17.149  21.405

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LYS 100           H        LYS 100   6.890  17.325  17.682
    2    HA   LYS 100           HA       LYS 100   8.530  18.750  19.533
    3    HB2  LYS 100           HB2      LYS 100   9.039  17.819  16.699
    4    HB3  LYS 100           HB3      LYS 100  10.261  18.605  17.704
    5    HG2  LYS 100           HG2      LYS 100   9.901  16.858  19.452
    6    HG3  LYS 100           HG3      LYS 100   8.778  16.038  18.364
    7    HD2  LYS 100           HD2      LYS 100  10.575  15.766  16.699
    8    HD3  LYS 100           HD3      LYS 100  11.703  16.598  17.772
    9    HE2  LYS 100           HE2      LYS 100  11.324  14.846  19.497
   10    HE3  LYS 100           HE3      LYS 100  10.257  13.995  18.375
   11    HZ1  LYS 100           HZ1      LYS 100  13.071  14.689  17.718
   12    HZ3  LYS 100           HZ2      LYS 100  12.038  13.620  16.894
   13    HZ2  LYS 100           HZ3      LYS 100  12.630  13.214  18.434

  No H/Q in entry =          13
  In of MODEL   68
    1    H    LEU 101           H        LEU 101   6.829  19.648  16.573
    2    HA   LEU 101           HA       LEU 101   8.018  22.215  16.228
    3    HB2  LEU 101           HB2      LEU 101   5.435  20.953  15.345
    4    HB3  LEU 101           HB3      LEU 101   5.669  22.685  15.131
    5    HG   LEU 101           HG       LEU 101   7.725  20.685  14.174
    6   HD12  LEU 101          HD11      LEU 101   6.568  21.170  11.887
    7   HD11  LEU 101          HD12      LEU 101   5.164  21.590  12.865
    8   HD13  LEU 101          HD13      LEU 101   5.844  19.966  12.954
    9   HD21  LEU 101          HD21      LEU 101   7.069  23.588  13.606
   10   HD23  LEU 101          HD22      LEU 101   8.059  22.633  12.504
   11   HD22  LEU 101          HD23      LEU 101   8.598  22.903  14.161

  No H/Q in entry =          11
  In of MODEL   68
    1    H    LYS 102           H        LYS 102   6.491  21.073  18.848
    2    HA   LYS 102           HA       LYS 102   5.847  22.167  20.775
    3    HB2  LYS 102           HB2      LYS 102   7.111  24.164  19.643
    4    HB3  LYS 102           HB3      LYS 102   5.506  24.752  19.264
    5    HG2  LYS 102           HG2      LYS 102   6.885  24.521  21.918
    6    HG3  LYS 102           HG3      LYS 102   5.920  25.838  21.283
    7    HD2  LYS 102           HD2      LYS 102   4.701  23.193  22.172
    8    HD3  LYS 102           HD3      LYS 102   4.936  24.561  23.250
    9    HE2  LYS 102           HE2      LYS 102   2.661  24.130  21.762
   10    HE3  LYS 102           HE3      LYS 102   3.149  25.684  22.438
   11    HZ2  LYS 102           HZ1      LYS 102   2.619  25.776  20.058
   12    HZ1  LYS 102           HZ2      LYS 102   3.890  24.705  19.739
   13    HZ3  LYS 102           HZ3      LYS 102   4.219  26.242  20.376

  No H/Q in entry =          13
  In of MODEL   68
    1    H    ALA 103           H        ALA 103   4.196  23.683  18.001
    2    HA   ALA 103           HA       ALA 103   1.736  24.240  18.883
    3    HB1  ALA 103           HB1      ALA 103   0.846  23.380  16.644
    4    HB2  ALA 103           HB2      ALA 103   2.498  22.857  16.316
    5    HB3  ALA 103           HB3      ALA 103   2.148  24.567  16.576

  No H/Q in entry =           5
  In of MODEL   68
    1    H1   ALA   1           H3       ALA   1  10.760 -20.281  -6.207
    2    H2   ALA   1           H2       ALA   1   9.798 -20.501  -7.592
    3    H3   ALA   1           H1       ALA   1   9.367 -21.245  -6.126
    4    HA   ALA   1           HA       ALA   1  10.423 -23.048  -6.858
    5    HB1  ALA   1           HB1      ALA   1  10.515 -22.697  -9.135
    6    HB2  ALA   1           HB2      ALA   1  12.241 -22.530  -8.807
    7    HB3  ALA   1           HB3      ALA   1  11.230 -21.093  -8.963

  No H/Q in entry =           7
  In of MODEL   68
    1    H    GLU   2           H        GLU   2  12.715 -23.979  -6.912
    2    HA   GLU   2           HA       GLU   2  14.095 -23.876  -4.700
    3    HB2  GLU   2           HB2      GLU   2  15.450 -23.744  -7.400
    4    HB3  GLU   2           HB3      GLU   2  16.184 -24.343  -5.912
    5    HG2  GLU   2           HG2      GLU   2  15.184 -26.369  -6.145
    6    HG3  GLU   2           HG3      GLU   2  13.607 -25.638  -6.407

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLU   3           H        GLU   3  15.850 -22.006  -7.109
    2    HA   GLU   3           HA       GLU   3  16.989 -20.301  -5.156
    3    HB2  GLU   3           HB2      GLU   3  16.933 -20.312  -8.166
    4    HB3  GLU   3           HB3      GLU   3  17.667 -18.973  -7.284
    5    HG2  GLU   3           HG2      GLU   3  19.342 -20.329  -6.356
    6    HG3  GLU   3           HG3      GLU   3  18.408 -21.805  -6.571

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LEU   4           H        LEU   4  14.700 -19.483  -7.790
    2    HA   LEU   4           HA       LEU   4  14.211 -16.876  -7.190
    3    HB2  LEU   4           HB2      LEU   4  12.053 -18.872  -7.912
    4    HB3  LEU   4           HB3      LEU   4  11.963 -17.125  -8.117
    5    HG   LEU   4           HG       LEU   4  13.943 -18.977  -9.483
    6   HD13  LEU   4          HD11      LEU   4  12.640 -18.846 -11.394
    7   HD12  LEU   4          HD12      LEU   4  11.919 -17.306 -10.932
    8   HD11  LEU   4          HD13      LEU   4  11.378 -18.798 -10.165
    9   HD23  LEU   4          HD21      LEU   4  14.261 -16.734 -10.844
   10   HD22  LEU   4          HD22      LEU   4  15.123 -16.963  -9.323
   11   HD21  LEU   4          HD23      LEU   4  13.661 -15.979  -9.366

  No H/Q in entry =          11
  In of MODEL   68
    1    H    GLU   5           H        GLU   5  12.750 -19.666  -5.536
    2    HA   GLU   5           HA       GLU   5  11.060 -18.102  -3.839
    3    HB2  GLU   5           HB2      GLU   5  10.652 -20.485  -4.350
    4    HB3  GLU   5           HB3      GLU   5  12.092 -20.906  -3.422
    5    HG2  GLU   5           HG2      GLU   5  11.124 -19.887  -1.413
    6    HG3  GLU   5           HG3      GLU   5   9.696 -19.409  -2.331

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLU   6           H        GLU   6  14.219 -19.653  -3.391
    2    HA   GLU   6           HA       GLU   6  14.565 -18.783  -0.696
    3    HB2  GLU   6           HB2      GLU   6  16.216 -20.089  -2.779
    4    HB3  GLU   6           HB3      GLU   6  17.102 -19.165  -1.566
    5    HG2  GLU   6           HG2      GLU   6  16.863 -21.442  -0.765
    6    HG3  GLU   6           HG3      GLU   6  15.834 -20.397   0.214

  No H/Q in entry =           6
  In of MODEL   68
    1    H    VAL   7           H        VAL   7  15.319 -17.462  -3.851
    2    HA   VAL   7           HA       VAL   7  16.986 -15.317  -2.995
    3    HB   VAL   7           HB       VAL   7  15.283 -15.706  -5.470
    4   HG11  VAL   7          HG11      VAL   7  17.157 -13.473  -4.667
    5   HG13  VAL   7          HG12      VAL   7  15.513 -13.347  -5.291
    6   HG12  VAL   7          HG13      VAL   7  16.827 -13.843  -6.359
    7   HG21  VAL   7          HG21      VAL   7  17.403 -17.141  -4.896
    8   HG23  VAL   7          HG22      VAL   7  18.295 -15.674  -5.300
    9   HG22  VAL   7          HG23      VAL   7  17.265 -16.438  -6.508

  No H/Q in entry =           9
  In of MODEL   68
    1    H    VAL   8           H        VAL   8  13.496 -15.621  -3.550
    2    HA   VAL   8           HA       VAL   8  12.806 -12.917  -3.089
    3    HB   VAL   8           HB       VAL   8  11.268 -15.498  -2.773
    4   HG13  VAL   8          HG11      VAL   8  10.204 -14.109  -1.185
    5   HG12  VAL   8          HG12      VAL   8   9.258 -13.856  -2.651
    6   HG11  VAL   8          HG13      VAL   8  10.453 -12.658  -2.155
    7   HG23  VAL   8          HG21      VAL   8  10.098 -13.731  -4.666
    8   HG22  VAL   8          HG22      VAL   8  11.009 -15.199  -5.009
    9   HG21  VAL   8          HG23      VAL   8  11.836 -13.646  -4.949

  No H/Q in entry =           9
  In of MODEL   68
    1    H    MET   9           H        MET   9  13.098 -15.711  -0.898
    2    HA   MET   9           HA       MET   9  12.271 -14.438   1.467
    3    HB2  MET   9           HB2      MET   9  14.193 -16.700   0.930
    4    HB3  MET   9           HB3      MET   9  13.902 -16.112   2.568
    5    HG2  MET   9           HG2      MET   9  11.488 -16.527   2.298
    6    HG3  MET   9           HG3      MET   9  11.768 -17.100   0.654
    7    HE1  MET   9           HE1      MET   9  12.643 -17.197   4.167
    8    HE3  MET   9           HE2      MET   9  14.116 -18.152   4.028
    9    HE2  MET   9           HE3      MET   9  12.650 -18.891   4.668

  No H/Q in entry =           9
  In of MODEL   68
    1    H    GLY  10           H        GLY  10  15.454 -14.638  -0.089
    2    HA3  GLY  10           HA2      GLY  10  16.900 -13.195   1.875
    3    HA2  GLY  10           HA3      GLY  10  17.364 -13.363   0.183

  No H/Q in entry =           3
  In of MODEL   68
    1    H    LEU  11           H        LEU  11  15.184 -12.168  -1.062
    2    HA   LEU  11           HA       LEU  11  15.842  -9.416  -0.909
    3    HB2  LEU  11           HB2      LEU  11  13.488 -10.854  -2.139
    4    HB3  LEU  11           HB3      LEU  11  13.752  -9.117  -2.305
    5    HG   LEU  11           HG       LEU  11  15.800 -11.209  -3.085
    6   HD13  LEU  11          HD11      LEU  11  14.058 -11.599  -4.603
    7   HD12  LEU  11          HD12      LEU  11  15.049 -10.411  -5.448
    8   HD11  LEU  11          HD13      LEU  11  13.570  -9.904  -4.632
    9   HD22  LEU  11          HD21      LEU  11  17.012  -9.232  -2.867
   10   HD21  LEU  11          HD22      LEU  11  15.626  -8.211  -3.250
   11   HD23  LEU  11          HD23      LEU  11  16.466  -9.076  -4.535

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  12           H        ILE  12  13.092 -11.265   0.365
    2    HA   ILE  12           HA       ILE  12  11.676  -9.051   1.416
    3    HB   ILE  12           HB       ILE  12  11.742 -11.928   2.382
    4   HG12  ILE  12          HG12      ILE  12  11.056 -11.319  -0.073
    5   HG13  ILE  12          HG13      ILE  12  10.041 -12.415   0.842
    6   HG22  ILE  12          HG21      ILE  12   9.448 -11.360   3.281
    7   HG21  ILE  12          HG22      ILE  12   9.789  -9.667   2.926
    8   HG23  ILE  12          HG23      ILE  12  10.772 -10.537   4.104
    9   HD12  ILE  12          HD11      ILE  12   8.793 -10.634  -0.415
   10   HD11  ILE  12          HD12      ILE  12   9.577  -9.433   0.609
   11   HD13  ILE  12          HD13      ILE  12   8.494 -10.613   1.314

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  13           H        ILE  13  14.092 -11.225   2.831
    2    HA   ILE  13           HA       ILE  13  14.114 -10.035   5.406
    3    HB   ILE  13           HB       ILE  13  16.196 -11.587   3.848
    4   HG12  ILE  13          HG12      ILE  13  13.922 -12.571   4.691
    5   HG13  ILE  13          HG13      ILE  13  15.405 -13.486   4.942
    6   HG21  ILE  13          HG21      ILE  13  16.313 -10.408   6.612
    7   HG23  ILE  13          HG22      ILE  13  17.571 -10.467   5.385
    8   HG22  ILE  13          HG23      ILE  13  17.146 -11.925   6.282
    9   HD13  ILE  13          HD11      ILE  13  15.540 -12.746   7.260
   10   HD12  ILE  13          HD12      ILE  13  13.916 -13.360   6.970
   11   HD11  ILE  13          HD13      ILE  13  14.203 -11.625   7.013

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ASN  14           H        ASN  14  16.062  -9.493   2.486
    2    HA   ASN  14           HA       ASN  14  17.783  -7.527   3.540
    3    HB2  ASN  14           HB2      ASN  14  17.776  -8.803   1.229
    4    HB3  ASN  14           HB3      ASN  14  16.867  -7.399   0.687
    5   HD21  ASN  14          HD21      ASN  14  19.311  -7.714  -0.497
    6   HD22  ASN  14          HD22      ASN  14  20.441  -6.615   0.126

  No H/Q in entry =           6
  In of MODEL   68
    1    H    SER  15           H        SER  15  14.669  -7.224   1.846
    2    HA   SER  15           HA       SER  15  14.522  -4.405   1.891
    3    HB2  SER  15           HB2      SER  15  12.194  -4.682   1.394
    4    HB3  SER  15           HB3      SER  15  13.007  -6.043   0.632
    5    HG   SER  15           HG       SER  15  11.893  -7.307   1.864

  No H/Q in entry =           5
  In of MODEL   68
    1    H    GLY  16           H        GLY  16  13.459  -6.869   4.204
    2    HA3  GLY  16           HA2      GLY  16  12.215  -5.128   6.054
    3    HA2  GLY  16           HA3      GLY  16  12.850  -6.727   6.423

  No H/Q in entry =           3
  In of MODEL   68
    1    H    GLN  17           H        GLN  17  15.557  -6.362   5.830
    2    HA   GLN  17           HA       GLN  17  16.497  -5.120   8.206
    3    HB2  GLN  17           HB2      GLN  17  17.746  -6.902   7.013
    4    HB3  GLN  17           HB3      GLN  17  18.049  -5.783   5.684
    5    HG2  GLN  17           HG2      GLN  17  19.990  -5.817   7.156
    6    HG3  GLN  17           HG3      GLN  17  19.195  -4.250   7.283
    7   HE21  GLN  17          HE21      GLN  17  19.701  -3.743   9.470
    8   HE22  GLN  17          HE22      GLN  17  19.207  -4.698  10.783

  No H/Q in entry =           8
  In of MODEL   68
    1    H    ALA  18           H        ALA  18  16.296  -4.058   4.841
    2    HA   ALA  18           HA       ALA  18  17.701  -1.646   5.059
    3    HB2  ALA  18           HB1      ALA  18  16.599  -2.884   2.996
    4    HB3  ALA  18           HB2      ALA  18  16.842  -1.137   2.974
    5    HB1  ALA  18           HB3      ALA  18  15.251  -1.802   3.345

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ARG  19           H        ARG  19  14.209  -2.278   5.457
    2    HA   ARG  19           HA       ARG  19  13.506   0.366   6.161
    3    HB2  ARG  19           HB2      ARG  19  11.848  -1.410   5.581
    4    HB3  ARG  19           HB3      ARG  19  12.199  -2.197   7.121
    5    HG2  ARG  19           HG2      ARG  19  11.462  -0.210   8.352
    6    HG3  ARG  19           HG3      ARG  19  11.202   0.657   6.840
    7    HD2  ARG  19           HD2      ARG  19   9.070  -0.164   7.662
    8    HD3  ARG  19           HD3      ARG  19   9.502  -1.044   6.190
    9    HE   ARG  19           HE       ARG  19  10.479  -2.565   8.302
   10   HH21  ARG  19          HH11      ARG  19   9.251  -4.218   9.247
   11   HH22  ARG  19          HH12      ARG  19   7.531  -4.214   9.075
   12   HH11  ARG  19          HH21      ARG  19   7.469  -1.317   7.200
   13   HH12  ARG  19          HH22      ARG  19   6.522  -2.571   7.912

  No H/Q in entry =          13
  In of MODEL   68
    1    H    SER  20           H        SER  20  14.400  -2.445   8.132
    2    HA   SER  20           HA       SER  20  14.101  -1.339  10.665
    3    HB2  SER  20           HB2      SER  20  14.767  -3.747   9.999
    4    HB3  SER  20           HB3      SER  20  16.419  -3.136   9.977
    5    HG   SER  20           HG       SER  20  14.831  -2.499  12.175

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LEU  21           H        LEU  21  16.944  -1.249   8.530
    2    HA   LEU  21           HA       LEU  21  18.598   0.266  10.263
    3    HB2  LEU  21           HB2      LEU  21  18.582  -0.018   7.250
    4    HB3  LEU  21           HB3      LEU  21  19.824   0.862   8.136
    5    HG   LEU  21           HG       LEU  21  19.122  -2.040   8.670
    6   HD12  LEU  21          HD11      LEU  21  21.405  -0.884   7.039
    7   HD11  LEU  21          HD12      LEU  21  20.010  -1.736   6.379
    8   HD13  LEU  21          HD13      LEU  21  21.158  -2.593   7.407
    9   HD21  LEU  21          HD21      LEU  21  21.196  -0.114   9.700
   10   HD23  LEU  21          HD22      LEU  21  21.602  -1.823   9.613
   11   HD22  LEU  21          HD23      LEU  21  20.251  -1.294  10.600

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ALA  22           H        ALA  22  16.323   1.195   7.702
    2    HA   ALA  22           HA       ALA  22  16.826   3.960   7.705
    3    HB3  ALA  22           HB1      ALA  22  15.440   2.693   6.031
    4    HB2  ALA  22           HB2      ALA  22  14.714   4.199   6.591
    5    HB1  ALA  22           HB3      ALA  22  14.143   2.654   7.224

  No H/Q in entry =           5
  In of MODEL   68
    1    H    TYR  23           H        TYR  23  14.351   2.119   9.546
    2    HA   TYR  23           HA       TYR  23  13.359   4.350  10.986
    3    HB2  TYR  23           HB2      TYR  23  12.152   2.218  10.971
    4    HB3  TYR  23           HB3      TYR  23  13.493   1.431  11.802
    5    HD1  TYR  23           HD1      TYR  23  10.949   4.138  12.148
    6    HD2  TYR  23           HD2      TYR  23  13.686   1.511  14.160
    7    HE1  TYR  23           HE1      TYR  23  10.005   4.831  14.336
    8    HE2  TYR  23           HE2      TYR  23  12.744   2.202  16.346
    9    HH   TYR  23           HH       TYR  23   9.959   4.398  16.534

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ALA  24           H        ALA  24  16.033   2.110  11.633
    2    HA   ALA  24           HA       ALA  24  16.688   3.124  14.193
    3    HB1  ALA  24           HB1      ALA  24  18.068   1.348  14.036
    4    HB3  ALA  24           HB2      ALA  24  19.084   2.278  12.934
    5    HB2  ALA  24           HB3      ALA  24  17.803   1.251  12.296

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ALA  25           H        ALA  25  17.636   4.052  10.911
    2    HA   ALA  25           HA       ALA  25  19.556   6.014  11.550
    3    HB1  ALA  25           HB1      ALA  25  18.853   5.047   9.238
    4    HB3  ALA  25           HB2      ALA  25  19.334   6.742   9.325
    5    HB2  ALA  25           HB3      ALA  25  17.624   6.313   9.257

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LEU  26           H        LEU  26  16.039   6.197  11.186
    2    HA   LEU  26           HA       LEU  26  15.781   8.978  11.626
    3    HB2  LEU  26           HB2      LEU  26  13.935   7.716  10.702
    4    HB3  LEU  26           HB3      LEU  26  13.856   6.693  12.131
    5    HG   LEU  26           HG       LEU  26  13.225   8.649  13.503
    6   HD12  LEU  26          HD11      LEU  26  12.539  10.736  12.169
    7   HD11  LEU  26          HD12      LEU  26  13.529  10.090  10.863
    8   HD13  LEU  26          HD13      LEU  26  14.268  10.490  12.414
    9   HD21  LEU  26          HD21      LEU  26  11.555   8.305  10.994
   10   HD23  LEU  26          HD22      LEU  26  10.985   9.002  12.507
   11   HD22  LEU  26          HD23      LEU  26  11.458   7.306  12.444

  No H/Q in entry =          11
  In of MODEL   68
    1    H    LYS  27           H        LYS  27  15.704   6.206  13.830
    2    HA   LYS  27           HA       LYS  27  15.094   7.574  16.192
    3    HB2  LYS  27           HB2      LYS  27  15.151   5.098  15.937
    4    HB3  LYS  27           HB3      LYS  27  16.914   5.171  15.895
    5    HG2  LYS  27           HG2      LYS  27  16.951   6.166  18.140
    6    HG3  LYS  27           HG3      LYS  27  15.184   6.164  18.185
    7    HD2  LYS  27           HD2      LYS  27  15.187   3.696  17.957
    8    HD3  LYS  27           HD3      LYS  27  16.952   3.706  17.947
    9    HE2  LYS  27           HE2      LYS  27  16.973   4.704  20.200
   10    HE3  LYS  27           HE3      LYS  27  15.207   4.724  20.213
   11    HZ3  LYS  27           HZ1      LYS  27  16.017   2.785  21.372
   12    HZ2  LYS  27           HZ2      LYS  27  16.939   2.312  20.024
   13    HZ1  LYS  27           HZ3      LYS  27  15.241   2.297  19.943

  No H/Q in entry =          13
  In of MODEL   68
    1    H    GLN  28           H        GLN  28  18.218   7.021  14.605
    2    HA   GLN  28           HA       GLN  28  19.888   8.131  16.592
    3    HB2  GLN  28           HB2      GLN  28  20.171   8.057  13.578
    4    HB3  GLN  28           HB3      GLN  28  21.450   8.582  14.672
    5    HG2  GLN  28           HG2      GLN  28  20.099   5.871  14.787
    6    HG3  GLN  28           HG3      GLN  28  21.659   6.179  14.027
    7   HE21  GLN  28          HE21      GLN  28  20.621   4.754  16.693
    8   HE22  GLN  28          HE22      GLN  28  21.758   5.289  17.834

  No H/Q in entry =           8
  In of MODEL   68
    1    H    ALA  29           H        ALA  29  18.122   9.584  13.893
    2    HA   ALA  29           HA       ALA  29  19.092  12.217  14.136
    3    HB2  ALA  29           HB1      ALA  29  17.388  12.830  12.661
    4    HB1  ALA  29           HB2      ALA  29  16.256  11.647  13.316
    5    HB3  ALA  29           HB3      ALA  29  17.593  11.115  12.296

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LYS  30           H        LYS  30  16.332  10.594  15.662
    2    HA   LYS  30           HA       LYS  30  15.293  12.842  17.010
    3    HB2  LYS  30           HB2      LYS  30  15.211   9.902  17.725
    4    HB3  LYS  30           HB3      LYS  30  14.332  11.147  18.613
    5    HG2  LYS  30           HG2      LYS  30  13.202  11.813  16.491
    6    HG3  LYS  30           HG3      LYS  30  14.021  10.482  15.670
    7    HD2  LYS  30           HD2      LYS  30  12.964   8.870  17.204
    8    HD3  LYS  30           HD3      LYS  30  12.155  10.190  18.049
    9    HE2  LYS  30           HE2      LYS  30  10.982  10.803  15.954
   10    HE3  LYS  30           HE3      LYS  30  11.771   9.454  15.128
   11    HZ2  LYS  30           HZ1      LYS  30   9.466   9.025  16.009
   12    HZ1  LYS  30           HZ2      LYS  30  10.132   9.090  17.576
   13    HZ3  LYS  30           HZ3      LYS  30  10.653   7.906  16.470

  No H/Q in entry =          13
  In of MODEL   68
    1    H    GLN  31           H        GLN  31  17.975  10.702  17.756
    2    HA   GLN  31           HA       GLN  31  18.291  11.730  20.447
    3    HB2  GLN  31           HB2      GLN  31  20.330  10.173  18.849
    4    HB3  GLN  31           HB3      GLN  31  20.194  10.303  20.603
    5    HG2  GLN  31           HG2      GLN  31  17.690   9.323  19.837
    6    HG3  GLN  31           HG3      GLN  31  18.801   8.485  18.760
    7   HE21  GLN  31          HE21      GLN  31  17.268   7.332  21.040
    8   HE22  GLN  31          HE22      GLN  31  18.430   6.687  22.094

  No H/Q in entry =           8
  In of MODEL   68
    1    H    GLY  32           H        GLY  32  18.799  13.041  17.476
    2    HA3  GLY  32           HA2      GLY  32  19.763  15.094  16.955
    3    HA2  GLY  32           HA3      GLY  32  20.519  15.112  18.543

  No H/Q in entry =           3
  In of MODEL   68
    1    H    ASP  33           H        ASP  33  20.971  12.217  16.777
    2    HA   ASP  33           HA       ASP  33  23.790  12.919  16.310
    3    HB2  ASP  33           HB2      ASP  33  22.308  10.289  16.435
    4    HB3  ASP  33           HB3      ASP  33  23.993  10.420  15.941

  No H/Q in entry =           4
  In of MODEL   68
    1    H    PHE  34           H        PHE  34  23.297  14.230  14.423
    2    HA   PHE  34           HA       PHE  34  21.959  13.224  12.139
    3    HB2  PHE  34           HB2      PHE  34  24.068  15.380  12.362
    4    HB3  PHE  34           HB3      PHE  34  23.087  15.075  10.931
    5    HD1  PHE  34           HD1      PHE  34  23.316  17.022  13.838
    6    HD2  PHE  34           HD2      PHE  34  20.462  14.868  11.458
    7    HE1  PHE  34           HE1      PHE  34  21.485  18.405  14.778
    8    HE2  PHE  34           HE2      PHE  34  18.635  16.251  12.402
    9    HZ   PHE  34           HZ       PHE  34  19.150  18.020  14.058

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ALA  35           H        ALA  35  25.334  13.075  13.150
    2    HA   ALA  35           HA       ALA  35  26.450  12.256  10.696
    3    HB3  ALA  35           HB1      ALA  35  28.141  11.110  12.421
    4    HB2  ALA  35           HB2      ALA  35  27.266  12.131  13.563
    5    HB1  ALA  35           HB3      ALA  35  28.096  12.858  12.188

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ALA  36           H        ALA  36  25.353  10.299  13.468
    2    HA   ALA  36           HA       ALA  36  25.864   7.811  12.202
    3    HB2  ALA  36           HB1      ALA  36  25.440   7.068  14.280
    4    HB3  ALA  36           HB2      ALA  36  23.747   7.545  14.128
    5    HB1  ALA  36           HB3      ALA  36  24.935   8.691  14.747

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ALA  37           H        ALA  37  23.020   9.908  12.327
    2    HA   ALA  37           HA       ALA  37  21.183   8.114  11.156
    3    HB3  ALA  37           HB1      ALA  37  21.377  11.080  11.438
    4    HB1  ALA  37           HB2      ALA  37  20.076   9.989  11.913
    5    HB2  ALA  37           HB3      ALA  37  20.261  10.457  10.222

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LYS  38           H        LYS  38  23.256  10.592   9.670
    2    HA   LYS  38           HA       LYS  38  22.623  10.148   6.993
    3    HB2  LYS  38           HB2      LYS  38  24.415  11.730   8.434
    4    HB3  LYS  38           HB3      LYS  38  25.459  10.748   7.412
    5    HG2  LYS  38           HG2      LYS  38  24.287  11.499   5.413
    6    HG3  LYS  38           HG3      LYS  38  23.083  12.343   6.390
    7    HD2  LYS  38           HD2      LYS  38  24.659  13.962   7.137
    8    HD3  LYS  38           HD3      LYS  38  26.031  12.990   6.606
    9    HE2  LYS  38           HE2      LYS  38  25.654  14.851   5.047
   10    HE3  LYS  38           HE3      LYS  38  25.337  13.307   4.248
   11    HZ3  LYS  38           HZ1      LYS  38  23.135  13.726   4.115
   12    HZ2  LYS  38           HZ2      LYS  38  23.639  15.347   4.197
   13    HZ1  LYS  38           HZ3      LYS  38  23.073  14.562   5.592

  No H/Q in entry =          13
  In of MODEL   68
    1    H    ALA  39           H        ALA  39  25.154   8.586   8.957
    2    HA   ALA  39           HA       ALA  39  26.243   7.002   6.894
    3    HB2  ALA  39           HB1      ALA  39  26.164   6.049   9.741
    4    HB1  ALA  39           HB2      ALA  39  27.100   7.483   9.320
    5    HB3  ALA  39           HB3      ALA  39  27.470   5.934   8.563

  No H/Q in entry =           5
  In of MODEL   68
    1    H    MET  40           H        MET  40  23.636   6.365   9.193
    2    HA   MET  40           HA       MET  40  23.225   3.652   8.469
    3    HB2  MET  40           HB2      MET  40  21.384   5.679   9.752
    4    HB3  MET  40           HB3      MET  40  20.998   3.964   9.584
    5    HG2  MET  40           HG2      MET  40  23.535   4.940  10.922
    6    HG3  MET  40           HG3      MET  40  22.044   4.650  11.816
    7    HE3  MET  40           HE1      MET  40  21.524   1.011  12.005
    8    HE2  MET  40           HE2      MET  40  20.640   2.300  11.192
    9    HE1  MET  40           HE3      MET  40  21.376   2.602  12.764

  No H/Q in entry =           9
  In of MODEL   68
    1    H    MET  41           H        MET  41  21.776   6.683   7.269
    2    HA   MET  41           HA       MET  41  19.834   5.459   5.601
    3    HB2  MET  41           HB2      MET  41  21.284   8.064   5.079
    4    HB3  MET  41           HB3      MET  41  19.763   7.550   4.361
    5    HG2  MET  41           HG2      MET  41  19.018   7.362   6.913
    6    HG3  MET  41           HG3      MET  41  20.312   8.536   7.131
    7    HE2  MET  41           HE1      MET  41  19.736   9.804   3.789
    8    HE1  MET  41           HE2      MET  41  20.686  10.261   5.200
    9    HE3  MET  41           HE3      MET  41  19.401  11.323   4.631

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ASP  42           H        ASP  42  23.195   6.420   5.046
    2    HA   ASP  42           HA       ASP  42  23.295   5.937   2.290
    3    HB2  ASP  42           HB2      ASP  42  25.032   6.963   4.056
    4    HB3  ASP  42           HB3      ASP  42  25.710   5.345   3.935

  No H/Q in entry =           4
  In of MODEL   68
    1    H    GLN  43           H        GLN  43  24.044   3.802   5.019
    2    HA   GLN  43           HA       GLN  43  24.737   1.547   3.445
    3    HB2  GLN  43           HB2      GLN  43  23.710   1.728   6.287
    4    HB3  GLN  43           HB3      GLN  43  24.308   0.243   5.538
    5    HG2  GLN  43           HG2      GLN  43  26.456   1.479   5.024
    6    HG3  GLN  43           HG3      GLN  43  25.857   2.802   6.018
    7   HE21  GLN  43          HE21      GLN  43  28.101   1.861   7.059
    8   HE22  GLN  43          HE22      GLN  43  27.840   0.780   8.339

  No H/Q in entry =           8
  In of MODEL   68
    1    H    SER  44           H        SER  44  21.666   2.648   4.824
    2    HA   SER  44           HA       SER  44  20.126   0.383   4.159
    3    HB2  SER  44           HB2      SER  44  19.652   2.910   5.295
    4    HB3  SER  44           HB3      SER  44  18.619   2.849   3.870
    5    HG   SER  44           HG       SER  44  17.536   1.899   5.596

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ARG  45           H        ARG  45  20.833   3.350   2.344
    2    HA   ARG  45           HA       ARG  45  19.315   2.836   0.040
    3    HB2  ARG  45           HB2      ARG  45  20.432   4.989   0.617
    4    HB3  ARG  45           HB3      ARG  45  21.986   4.251   0.235
    5    HG2  ARG  45           HG2      ARG  45  21.208   3.828  -2.078
    6    HG3  ARG  45           HG3      ARG  45  19.666   4.588  -1.695
    7    HD2  ARG  45           HD2      ARG  45  20.891   6.702  -1.118
    8    HD3  ARG  45           HD3      ARG  45  22.397   5.944  -1.683
    9    HE   ARG  45           HE       ARG  45  20.470   5.676  -3.719
   10   HH21  ARG  45          HH11      ARG  45  20.448   7.038  -5.487
   11   HH22  ARG  45          HH12      ARG  45  21.186   8.598  -5.389
   12   HH11  ARG  45          HH21      ARG  45  22.170   8.201  -2.101
   13   HH12  ARG  45          HH22      ARG  45  22.160   9.255  -3.469

  No H/Q in entry =          13
  In of MODEL   68
    1    H    MET  46           H        MET  46  22.689   2.005   0.792
    2    HA   MET  46           HA       MET  46  23.309   0.810  -1.687
    3    HB2  MET  46           HB2      MET  46  24.420   0.518   1.103
    4    HB3  MET  46           HB3      MET  46  25.082  -0.389  -0.260
    5    HG2  MET  46           HG2      MET  46  25.523   1.698  -1.470
    6    HG3  MET  46           HG3      MET  46  24.792   2.630  -0.170
    7    HE1  MET  46           HE1      MET  46  27.310   0.259  -1.351
    8    HE3  MET  46           HE2      MET  46  27.503  -0.538   0.207
    9    HE2  MET  46           HE3      MET  46  28.783   0.509  -0.404

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ALA  47           H        ALA  47  21.941  -0.528   1.293
    2    HA   ALA  47           HA       ALA  47  21.919  -3.244   0.501
    3    HB2  ALA  47           HB1      ALA  47  21.535  -2.779   2.804
    4    HB3  ALA  47           HB2      ALA  47  20.005  -3.402   2.188
    5    HB1  ALA  47           HB3      ALA  47  20.215  -1.667   2.439

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LEU  48           H        LEU  48  19.537  -0.645   0.135
    2    HA   LEU  48           HA       LEU  48  17.509  -2.206  -1.110
    3    HB2  LEU  48           HB2      LEU  48  18.130   0.755  -1.236
    4    HB3  LEU  48           HB3      LEU  48  16.667   0.025  -1.900
    5    HG   LEU  48           HG       LEU  48  17.525  -0.256   0.990
    6   HD13  LEU  48          HD11      LEU  48  17.081   2.040   0.794
    7   HD12  LEU  48          HD12      LEU  48  15.530   1.377   1.306
    8   HD11  LEU  48          HD13      LEU  48  15.796   1.795  -0.387
    9   HD22  LEU  48          HD21      LEU  48  16.015  -1.988   0.617
   10   HD21  LEU  48          HD22      LEU  48  15.131  -1.100  -0.625
   11   HD23  LEU  48          HD23      LEU  48  14.914  -0.691   1.077

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ASN  49           H        ASN  49  20.175  -0.254  -2.349
    2    HA   ASN  49           HA       ASN  49  19.524  -0.356  -5.073
    3    HB2  ASN  49           HB2      ASN  49  21.184   1.186  -4.176
    4    HB3  ASN  49           HB3      ASN  49  22.222  -0.154  -3.706
    5   HD21  ASN  49          HD21      ASN  49  20.750   1.358  -6.599
    6   HD22  ASN  49          HD22      ASN  49  21.993   0.899  -7.659

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLU  50           H        GLU  50  21.533  -2.521  -3.102
    2    HA   GLU  50           HA       GLU  50  22.252  -4.278  -5.221
    3    HB2  GLU  50           HB2      GLU  50  23.450  -4.231  -3.056
    4    HB3  GLU  50           HB3      GLU  50  22.015  -4.870  -2.256
    5    HG2  GLU  50           HG2      GLU  50  22.125  -6.908  -3.606
    6    HG3  GLU  50           HG3      GLU  50  23.494  -6.265  -4.511

  No H/Q in entry =           6
  In of MODEL   68
    1    H    ALA  51           H        ALA  51  19.596  -4.231  -2.893
    2    HA   ALA  51           HA       ALA  51  18.456  -6.719  -3.639
    3    HB3  ALA  51           HB1      ALA  51  16.859  -6.224  -2.085
    4    HB1  ALA  51           HB2      ALA  51  16.628  -4.582  -2.690
    5    HB2  ALA  51           HB3      ALA  51  17.992  -4.950  -1.634

  No H/Q in entry =           5
  In of MODEL   68
    1    H    HIS  52           H        HIS  52  17.834  -3.382  -4.688
    2    HA   HIS  52           HA       HIS  52  15.725  -3.939  -6.484
    3    HB2  HIS  52           HB2      HIS  52  16.336  -1.664  -5.700
    4    HB3  HIS  52           HB3      HIS  52  17.806  -1.748  -6.671
    5    HD1  HIS  52           HD1      HIS  52  17.536  -1.701  -9.270
    6    HD2  HIS  52           HD2      HIS  52  13.955  -1.245  -7.183
    7    HE1  HIS  52           HE1      HIS  52  15.821  -0.901 -10.954
    8    HE2  HIS  52           HE2      HIS  52  13.633  -0.618  -9.698

  No H/Q in entry =           8
  In of MODEL   68
    1    H    LEU  53           H        LEU  53  19.243  -3.909  -6.920
    2    HA   LEU  53           HA       LEU  53  19.301  -4.237  -9.718
    3    HB2  LEU  53           HB2      LEU  53  21.244  -4.972  -7.543
    4    HB3  LEU  53           HB3      LEU  53  21.563  -5.356  -9.233
    5    HG   LEU  53           HG       LEU  53  20.852  -2.553  -8.316
    6   HD11  LEU  53          HD11      LEU  53  23.556  -3.895  -8.559
    7   HD13  LEU  53          HD12      LEU  53  22.872  -3.101  -7.140
    8   HD12  LEU  53          HD13      LEU  53  23.348  -2.146  -8.540
    9   HD23  LEU  53          HD21      LEU  53  22.283  -2.092 -10.459
   10   HD22  LEU  53          HD22      LEU  53  20.621  -2.640 -10.659
   11   HD21  LEU  53          HD23      LEU  53  21.946  -3.772 -10.862

  No H/Q in entry =          11
  In of MODEL   68
    1    H    VAL  54           H        VAL  54  19.217  -6.613  -7.082
    2    HA   VAL  54           HA       VAL  54  19.364  -8.913  -8.731
    3    HB   VAL  54           HB       VAL  54  18.207  -8.490  -5.965
    4   HG12  VAL  54          HG11      VAL  54  18.561 -11.103  -5.949
    5   HG11  VAL  54          HG12      VAL  54  18.372 -10.945  -7.695
    6   HG13  VAL  54          HG13      VAL  54  17.079 -10.424  -6.617
    7   HG22  VAL  54          HG21      VAL  54  20.521  -8.252  -5.745
    8   HG21  VAL  54          HG22      VAL  54  20.869  -9.346  -7.081
    9   HG23  VAL  54          HG23      VAL  54  20.348  -9.992  -5.525

  No H/Q in entry =           9
  In of MODEL   68
    1    H    GLN  55           H        GLN  55  16.616  -7.035  -7.455
    2    HA   GLN  55           HA       GLN  55  14.613  -8.727  -8.519
    3    HB2  GLN  55           HB2      GLN  55  13.848  -7.202  -6.899
    4    HB3  GLN  55           HB3      GLN  55  14.625  -5.829  -7.682
    5    HG2  GLN  55           HG2      GLN  55  12.896  -5.531  -9.172
    6    HG3  GLN  55           HG3      GLN  55  12.594  -7.256  -9.333
    7   HE21  GLN  55          HE21      GLN  55  10.594  -7.824  -8.524
    8   HE22  GLN  55          HE22      GLN  55   9.813  -7.073  -7.218

  No H/Q in entry =           8
  In of MODEL   68
    1    H    THR  56           H        THR  56  16.319  -5.914  -9.893
    2    HA   THR  56           HA       THR  56  14.874  -5.579 -12.242
    3    HB   THR  56           HB       THR  56  17.893  -5.457 -12.092
    4    HG1  THR  56           HG1      THR  56  15.889  -3.697 -11.168
    5   HG23  THR  56          HG21      THR  56  17.732  -3.919 -13.878
    6   HG22  THR  56          HG22      THR  56  16.006  -3.669 -13.617
    7   HG21  THR  56          HG23      THR  56  16.583  -5.190 -14.299

  No H/Q in entry =           7
  In of MODEL   68
    1    H    LYS  57           H        LYS  57  17.551  -7.842 -11.622
    2    HA   LYS  57           HA       LYS  57  17.564  -9.049 -14.195
    3    HB2  LYS  57           HB2      LYS  57  19.361  -9.274 -12.457
    4    HB3  LYS  57           HB3      LYS  57  18.269 -10.269 -11.504
    5    HG2  LYS  57           HG2      LYS  57  18.167 -11.927 -13.308
    6    HG3  LYS  57           HG3      LYS  57  19.218 -10.931 -14.308
    7    HD2  LYS  57           HD2      LYS  57  21.016 -11.142 -12.612
    8    HD3  LYS  57           HD3      LYS  57  19.970 -12.179 -11.644
    9    HE2  LYS  57           HE2      LYS  57  19.863 -13.819 -13.483
   10    HE3  LYS  57           HE3      LYS  57  20.879 -12.786 -14.487
   11    HZ2  LYS  57           HZ1      LYS  57  21.595 -14.433 -12.196
   12    HZ1  LYS  57           HZ2      LYS  57  22.405 -12.949 -12.355
   13    HZ3  LYS  57           HZ3      LYS  57  22.470 -14.093 -13.608

  No H/Q in entry =          13
  In of MODEL   68
    1    H    LEU  58           H        LEU  58  15.794  -9.723 -11.214
    2    HA   LEU  58           HA       LEU  58  14.600 -12.116 -12.136
    3    HB2  LEU  58           HB2      LEU  58  13.784 -10.210  -9.949
    4    HB3  LEU  58           HB3      LEU  58  12.996 -11.759 -10.257
    5    HG   LEU  58           HG       LEU  58  15.966 -11.442  -9.707
    6   HD11  LEU  58          HD11      LEU  58  13.602 -11.879  -7.909
    7   HD13  LEU  58          HD12      LEU  58  15.044 -10.897  -7.653
    8   HD12  LEU  58          HD13      LEU  58  15.138 -12.651  -7.509
    9   HD22  LEU  58          HD21      LEU  58  15.873 -13.510 -10.724
   10   HD21  LEU  58          HD22      LEU  58  14.162 -13.738 -10.361
   11   HD23  LEU  58          HD23      LEU  58  15.375 -14.018  -9.111

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  59           H        ILE  59  13.888  -8.791 -12.834
    2    HA   ILE  59           HA       ILE  59  11.179  -9.477 -13.768
    3    HB   ILE  59           HB       ILE  59  11.954  -7.181 -12.573
    4   HG12  ILE  59          HG12      ILE  59  10.057  -7.069 -14.927
    5   HG13  ILE  59          HG13      ILE  59   9.639  -7.869 -13.434
    6   HG21  ILE  59          HG21      ILE  59  13.499  -6.769 -14.624
    7   HG23  ILE  59          HG22      ILE  59  12.497  -5.441 -14.083
    8   HG22  ILE  59          HG23      ILE  59  12.027  -6.393 -15.488
    9   HD12  ILE  59          HD11      ILE  59   8.854  -5.504 -13.505
   10   HD11  ILE  59          HD12      ILE  59  10.538  -4.992 -13.611
   11   HD13  ILE  59          HD13      ILE  59   9.958  -5.819 -12.165

  No H/Q in entry =          11
  In of MODEL   68
    1    H    GLU  60           H        GLU  60  14.371  -8.593 -15.034
    2    HA   GLU  60           HA       GLU  60  13.584  -8.215 -17.743
    3    HB2  GLU  60           HB2      GLU  60  15.759  -7.460 -16.872
    4    HB3  GLU  60           HB3      GLU  60  16.241  -9.133 -16.610
    5    HG2  GLU  60           HG2      GLU  60  16.023  -9.575 -19.035
    6    HG3  GLU  60           HG3      GLU  60  15.556  -7.895 -19.294

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLY  61           H        GLY  61  14.598 -11.075 -15.915
    2    HA3  GLY  61           HA2      GLY  61  14.075 -12.742 -18.308
    3    HA2  GLY  61           HA3      GLY  61  15.114 -13.204 -16.964

  No H/Q in entry =           3
  In of MODEL   68
    1    H    ASP  62           H        ASP  62  11.977 -11.693 -16.594
    2    HA   ASP  62           HA       ASP  62  11.077 -13.785 -14.857
    3    HB2  ASP  62           HB2      ASP  62   9.023 -12.424 -14.716
    4    HB3  ASP  62           HB3      ASP  62  10.475 -11.471 -14.427

  No H/Q in entry =           4
  In of MODEL   68
    1    H    ALA  63           H        ALA  63  11.241 -15.587 -16.501
    2    HA   ALA  63           HA       ALA  63   9.494 -15.717 -18.756
    3    HB1  ALA  63           HB1      ALA  63  11.532 -17.193 -18.219
    4    HB3  ALA  63           HB2      ALA  63  10.120 -17.999 -18.901
    5    HB2  ALA  63           HB3      ALA  63  10.446 -18.105 -17.171

  No H/Q in entry =           5
  In of MODEL   68
    1    H    GLY  64           H        GLY  64   9.191 -16.658 -15.378
    2    HA3  GLY  64           HA2      GLY  64   7.284 -16.922 -14.088
    3    HA2  GLY  64           HA3      GLY  64   6.309 -16.603 -15.516

  No H/Q in entry =           3
  In of MODEL   68
    1    H    GLU  65           H        GLU  65   4.995 -18.405 -14.560
    2    HA   GLU  65           HA       GLU  65   6.018 -21.032 -14.413
    3    HB2  GLU  65           HB2      GLU  65   3.199 -20.010 -14.722
    4    HB3  GLU  65           HB3      GLU  65   3.599 -21.709 -14.478
    5    HG2  GLU  65           HG2      GLU  65   4.709 -21.189 -12.371
    6    HG3  GLU  65           HG3      GLU  65   4.439 -19.465 -12.622

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLY  66           H        GLY  66   4.427 -19.286 -16.973
    2    HA3  GLY  66           HA2      GLY  66   4.898 -21.501 -18.859
    3    HA2  GLY  66           HA3      GLY  66   3.604 -20.331 -19.017

  No H/Q in entry =           3
  In of MODEL   68
    1    H    LYS  67           H        LYS  67   4.081 -19.540 -20.981
    2    HA   LYS  67           HA       LYS  67   6.717 -18.876 -21.835
    3    HB2  LYS  67           HB2      LYS  67   5.210 -17.715 -23.704
    4    HB3  LYS  67           HB3      LYS  67   5.441 -19.466 -23.626
    5    HG2  LYS  67           HG2      LYS  67   3.373 -19.776 -22.447
    6    HG3  LYS  67           HG3      LYS  67   3.195 -18.045 -22.177
    7    HD2  LYS  67           HD2      LYS  67   2.937 -17.691 -24.607
    8    HD3  LYS  67           HD3      LYS  67   3.099 -19.430 -24.871
    9    HE2  LYS  67           HE2      LYS  67   1.105 -19.850 -23.507
   10    HE3  LYS  67           HE3      LYS  67   0.954 -18.125 -23.168
   11    HZ2  LYS  67           HZ1      LYS  67  -0.375 -19.237 -25.107
   12    HZ1  LYS  67           HZ2      LYS  67   1.070 -18.992 -25.963
   13    HZ3  LYS  67           HZ3      LYS  67   0.254 -17.672 -25.271

  No H/Q in entry =          13
  In of MODEL   68
    1    H    MET  68           H        MET  68   4.164 -16.603 -22.332
    2    HA   MET  68           HA       MET  68   5.747 -14.309 -21.978
    3    HB2  MET  68           HB2      MET  68   2.783 -14.771 -22.174
    4    HB3  MET  68           HB3      MET  68   3.464 -13.155 -21.981
    5    HG2  MET  68           HG2      MET  68   4.799 -13.435 -24.005
    6    HG3  MET  68           HG3      MET  68   4.231 -15.095 -24.180
    7    HE2  MET  68           HE1      MET  68   2.081 -11.162 -24.861
    8    HE1  MET  68           HE2      MET  68   3.586 -11.496 -24.009
    9    HE3  MET  68           HE3      MET  68   2.045 -11.742 -23.190

  No H/Q in entry =           9
  In of MODEL   68
    1    H    LYS  69           H        LYS  69   3.437 -15.849 -19.721
    2    HA   LYS  69           HA       LYS  69   3.164 -13.868 -17.846
    3    HB2  LYS  69           HB2      LYS  69   3.096 -16.841 -17.711
    4    HB3  LYS  69           HB3      LYS  69   3.053 -15.932 -16.198
    5    HG2  LYS  69           HG2      LYS  69   0.769 -16.296 -17.013
    6    HG3  LYS  69           HG3      LYS  69   1.169 -14.579 -17.083
    7    HD2  LYS  69           HD2      LYS  69   1.622 -14.729 -19.464
    8    HD3  LYS  69           HD3      LYS  69   1.398 -16.479 -19.433
    9    HE2  LYS  69           HE2      LYS  69  -0.736 -14.442 -18.731
   10    HE3  LYS  69           HE3      LYS  69  -0.627 -15.305 -20.264
   11    HZ3  LYS  69           HZ1      LYS  69  -2.089 -16.585 -19.046
   12    HZ2  LYS  69           HZ2      LYS  69  -1.253 -16.360 -17.586
   13    HZ1  LYS  69           HZ3      LYS  69  -0.619 -17.386 -18.781

  No H/Q in entry =          13
  In of MODEL   68
    1    H    VAL  70           H        VAL  70   3.950 -14.108 -15.426
    2    HA   VAL  70           HA       VAL  70   6.904 -14.336 -15.373
    3    HB   VAL  70           HB       VAL  70   6.914 -12.352 -13.867
    4   HG11  VAL  70          HG11      VAL  70   7.125 -12.314 -16.465
    5   HG13  VAL  70          HG12      VAL  70   6.865 -10.785 -15.623
    6   HG12  VAL  70          HG13      VAL  70   5.518 -11.590 -16.426
    7   HG22  VAL  70          HG21      VAL  70   4.747 -12.252 -12.920
    8   HG21  VAL  70          HG22      VAL  70   3.963 -12.461 -14.484
    9   HG23  VAL  70          HG23      VAL  70   4.725 -10.923 -14.079

  No H/Q in entry =           9
  In of MODEL   68
    1    H    SER  71           H        SER  71   7.759 -14.599 -13.171
    2    HA   SER  71           HA       SER  71   6.488 -16.668 -11.716
    3    HB2  SER  71           HB2      SER  71   8.930 -16.285 -11.676
    4    HB3  SER  71           HB3      SER  71   8.672 -14.771 -10.812
    5    HG   SER  71           HG       SER  71   8.062 -17.412  -9.974

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LEU  72           H        LEU  72   5.159 -16.620  -9.945
    2    HA   LEU  72           HA       LEU  72   3.581 -14.324  -9.511
    3    HB2  LEU  72           HB2      LEU  72   3.900 -16.869  -7.929
    4    HB3  LEU  72           HB3      LEU  72   2.716 -15.625  -7.534
    5    HG   LEU  72           HG       LEU  72   2.891 -16.927 -10.271
    6   HD12  LEU  72          HD11      LEU  72   0.949 -18.285  -9.542
    7   HD11  LEU  72          HD12      LEU  72   1.106 -17.620  -7.917
    8   HD13  LEU  72          HD13      LEU  72   2.386 -18.637  -8.580
    9   HD22  LEU  72          HD21      LEU  72   1.626 -14.971 -10.533
   10   HD21  LEU  72          HD22      LEU  72   0.974 -15.039  -8.904
   11   HD23  LEU  72          HD23      LEU  72   0.376 -16.144 -10.137

  No H/Q in entry =          11
  In of MODEL   68
    1    H    VAL  73           H        VAL  73   6.255 -15.720  -7.732
    2    HA   VAL  73           HA       VAL  73   6.176 -14.178  -5.407
    3    HB   VAL  73           HB       VAL  73   8.330 -14.994  -4.949
    4   HG12  VAL  73          HG11      VAL  73   7.372 -17.079  -6.897
    5   HG11  VAL  73          HG12      VAL  73   6.419 -16.696  -5.465
    6   HG13  VAL  73          HG13      VAL  73   8.068 -17.297  -5.293
    7   HG22  VAL  73          HG21      VAL  73   9.577 -14.199  -6.829
    8   HG21  VAL  73          HG22      VAL  73   8.623 -15.162  -7.956
    9   HG23  VAL  73          HG23      VAL  73   9.743 -15.955  -6.851

  No H/Q in entry =           9
  In of MODEL   68
    1    H    LEU  74           H        LEU  74   7.155 -13.286  -8.586
    2    HA   LEU  74           HA       LEU  74   9.077 -11.312  -8.102
    3    HB2  LEU  74           HB2      LEU  74   8.634 -12.072 -10.337
    4    HB3  LEU  74           HB3      LEU  74   6.959 -11.534 -10.239
    5    HG   LEU  74           HG       LEU  74   7.734  -9.190 -10.021
    6   HD13  LEU  74          HD11      LEU  74   9.868  -9.367  -8.994
    7   HD12  LEU  74          HD12      LEU  74  10.219  -8.858 -10.644
    8   HD11  LEU  74          HD13      LEU  74  10.431 -10.545 -10.178
    9   HD21  LEU  74          HD21      LEU  74   7.437 -10.580 -12.235
   10   HD23  LEU  74          HD22      LEU  74   9.162 -10.319 -12.357
   11   HD22  LEU  74          HD23      LEU  74   8.085  -8.942 -12.288

  No H/Q in entry =          11
  In of MODEL   68
    1    H    VAL  75           H        VAL  75   5.577 -10.971  -8.458
    2    HA   VAL  75           HA       VAL  75   5.447  -8.213  -7.883
    3    HB   VAL  75           HB       VAL  75   3.385 -10.384  -7.495
    4   HG11  VAL  75          HG11      VAL  75   3.154  -7.347  -7.321
    5   HG13  VAL  75          HG12      VAL  75   2.872  -8.494  -6.020
    6   HG12  VAL  75          HG13      VAL  75   1.783  -8.449  -7.397
    7   HG21  VAL  75          HG21      VAL  75   3.854  -8.266  -9.623
    8   HG23  VAL  75          HG22      VAL  75   2.463  -9.348  -9.572
    9   HG22  VAL  75          HG23      VAL  75   4.081 -10.002  -9.824

  No H/Q in entry =           9
  In of MODEL   68
    1    H    GLU  76           H        GLU  76   5.227 -11.084  -5.761
    2    HA   GLU  76           HA       GLU  76   4.740  -9.718  -3.346
    3    HB2  GLU  76           HB2      GLU  76   4.628 -12.212  -3.638
    4    HB3  GLU  76           HB3      GLU  76   6.380 -12.246  -3.745
    5    HG2  GLU  76           HG2      GLU  76   6.557 -11.342  -1.458
    6    HG3  GLU  76           HG3      GLU  76   4.809 -11.280  -1.323

  No H/Q in entry =           6
  In of MODEL   68
    1    H    ALA  77           H        ALA  77   7.811 -10.596  -4.903
    2    HA   ALA  77           HA       ALA  77   9.486  -9.523  -2.891
    3    HB1  ALA  77           HB1      ALA  77  10.124 -11.071  -4.833
    4    HB2  ALA  77           HB2      ALA  77  11.264  -9.788  -4.429
    5    HB3  ALA  77           HB3      ALA  77  10.195  -9.612  -5.820

  No H/Q in entry =           5
  In of MODEL   68
    1    H    GLN  78           H        GLN  78   8.080  -8.135  -5.812
    2    HA   GLN  78           HA       GLN  78   9.403  -5.640  -5.717
    3    HB2  GLN  78           HB2      GLN  78   8.121  -6.576  -7.672
    4    HB3  GLN  78           HB3      GLN  78   6.632  -6.215  -6.800
    5    HG2  GLN  78           HG2      GLN  78   7.257  -3.835  -6.711
    6    HG3  GLN  78           HG3      GLN  78   8.746  -4.190  -7.587
    7   HE21  GLN  78          HE21      GLN  78   8.350  -3.235  -9.625
    8   HE22  GLN  78          HE22      GLN  78   7.007  -3.602 -10.596

  No H/Q in entry =           8
  In of MODEL   68
    1    H    LEU  79           H        LEU  79   6.396  -6.806  -4.285
    2    HA   LEU  79           HA       LEU  79   5.373  -4.406  -3.287
    3    HB2  LEU  79           HB2      LEU  79   4.082  -6.472  -3.224
    4    HB3  LEU  79           HB3      LEU  79   5.234  -7.194  -2.104
    5    HG   LEU  79           HG       LEU  79   4.661  -5.551  -0.385
    6   HD13  LEU  79          HD11      LEU  79   4.174  -3.546  -1.445
    7   HD12  LEU  79          HD12      LEU  79   2.554  -4.088  -1.005
    8   HD11  LEU  79          HD13      LEU  79   3.139  -4.311  -2.652
    9   HD23  LEU  79          HD21      LEU  79   2.080  -6.072  -0.296
   10   HD22  LEU  79          HD22      LEU  79   3.235  -7.398  -0.180
   11   HD21  LEU  79          HD23      LEU  79   2.419  -7.076  -1.707

  No H/Q in entry =          11
  In of MODEL   68
    1    H    HIS  80           H        HIS  80   7.580  -6.710  -1.691
    2    HA   HIS  80           HA       HIS  80   7.847  -5.154   0.671
    3    HB2  HIS  80           HB2      HIS  80   9.214  -7.508  -0.515
    4    HB3  HIS  80           HB3      HIS  80  10.113  -6.596   0.699
    5    HD1  HIS  80           HD1      HIS  80   9.626  -7.228   3.044
    6    HD2  HIS  80           HD2      HIS  80   6.422  -8.124   0.531
    7    HE1  HIS  80           HE1      HIS  80   7.864  -8.344   4.494
    8    HE2  HIS  80           HE2      HIS  80   5.905  -8.895   2.971

  No H/Q in entry =           8
  In of MODEL   68
    1    H    LEU  81           H        LEU  81   9.860  -5.421  -2.237
    2    HA   LEU  81           HA       LEU  81  11.884  -3.654  -1.363
    3    HB2  LEU  81           HB2      LEU  81  10.976  -4.468  -4.124
    4    HB3  LEU  81           HB3      LEU  81  12.385  -3.445  -3.835
    5    HG   LEU  81           HG       LEU  81  12.019  -6.165  -2.551
    6   HD12  LEU  81          HD11      LEU  81  13.845  -6.779  -4.295
    7   HD11  LEU  81          HD12      LEU  81  13.265  -5.365  -5.173
    8   HD13  LEU  81          HD13      LEU  81  12.167  -6.700  -4.831
    9   HD23  LEU  81          HD21      LEU  81  14.644  -5.822  -2.534
   10   HD22  LEU  81          HD22      LEU  81  13.652  -5.067  -1.288
   11   HD21  LEU  81          HD23      LEU  81  14.222  -4.114  -2.658

  No H/Q in entry =          11
  In of MODEL   68
    1    H    MET  82           H        MET  82   8.958  -3.057  -3.307
    2    HA   MET  82           HA       MET  82   9.470  -0.328  -3.819
    3    HB2  MET  82           HB2      MET  82   6.927  -1.948  -3.691
    4    HB3  MET  82           HB3      MET  82   6.909  -0.225  -4.063
    5    HG2  MET  82           HG2      MET  82   8.534  -2.288  -5.586
    6    HG3  MET  82           HG3      MET  82   6.961  -1.684  -6.104
    7    HE3  MET  82           HE1      MET  82   7.376   1.770  -7.290
    8    HE2  MET  82           HE2      MET  82   7.001   1.547  -5.583
    9    HE1  MET  82           HE3      MET  82   6.349   0.426  -6.774

  No H/Q in entry =           9
  In of MODEL   68
    1    H    THR  83           H        THR  83   7.690  -1.933  -1.210
    2    HA   THR  83           HA       THR  83   6.813   0.412   0.105
    3    HB   THR  83           HB       THR  83   6.691  -1.155   2.130
    4    HG1  THR  83           HG1      THR  83   7.468  -3.098   1.910
    5   HG22  THR  83          HG21      THR  83   5.056  -2.744   0.665
    6   HG21  THR  83          HG22      THR  83   5.271  -1.418  -0.472
    7   HG23  THR  83          HG23      THR  83   4.625  -1.102   1.139

  No H/Q in entry =           7
  In of MODEL   68
    1    H    SER  84           H        SER  84   9.657  -1.655   0.640
    2    HA   SER  84           HA       SER  84  10.698  -0.205   2.824
    3    HB2  SER  84           HB2      SER  84  11.973  -2.043   0.809
    4    HB3  SER  84           HB3      SER  84  12.910  -1.275   2.089
    5    HG   SER  84           HG       SER  84  10.651  -2.986   2.352

  No H/Q in entry =           5
  In of MODEL   68
    1    H    MET  85           H        MET  85  11.454   0.049  -0.664
    2    HA   MET  85           HA       MET  85  13.433   2.034  -0.418
    3    HB2  MET  85           HB2      MET  85  13.052   0.739  -2.478
    4    HB3  MET  85           HB3      MET  85  11.519   1.579  -2.714
    5    HG2  MET  85           HG2      MET  85  12.692   3.731  -2.860
    6    HG3  MET  85           HG3      MET  85  14.229   2.927  -2.562
    7    HE1  MET  85           HE1      MET  85  14.992   4.237  -4.471
    8    HE3  MET  85           HE2      MET  85  13.585   4.771  -5.387
    9    HE2  MET  85           HE3      MET  85  14.816   3.793  -6.176

  No H/Q in entry =           9
  In of MODEL   68
    1    H    LEU  86           H        LEU  86   9.941   2.333  -0.934
    2    HA   LEU  86           HA       LEU  86   9.851   5.145  -1.128
    3    HB2  LEU  86           HB2      LEU  86   8.023   3.465  -1.700
    4    HB3  LEU  86           HB3      LEU  86   7.691   3.380   0.030
    5    HG   LEU  86           HG       LEU  86   7.506   5.938  -0.034
    6   HD11  LEU  86          HD11      LEU  86   8.291   5.498  -2.733
    7   HD13  LEU  86          HD12      LEU  86   7.839   7.025  -1.980
    8   HD12  LEU  86          HD13      LEU  86   6.614   6.047  -2.783
    9   HD23  LEU  86          HD21      LEU  86   5.388   4.559  -1.695
   10   HD22  LEU  86          HD22      LEU  86   5.184   5.822  -0.484
   11   HD21  LEU  86          HD23      LEU  86   5.598   4.183   0.016

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ALA  87           H        ALA  87   9.400   2.974   1.626
    2    HA   ALA  87           HA       ALA  87   8.830   4.891   3.587
    3    HB1  ALA  87           HB1      ALA  87   9.664   2.078   3.514
    4    HB3  ALA  87           HB2      ALA  87   8.529   2.884   4.594
    5    HB2  ALA  87           HB3      ALA  87  10.257   2.933   4.941

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ARG  88           H        ARG  88  11.929   3.491   2.617
    2    HA   ARG  88           HA       ARG  88  13.522   4.892   4.446
    3    HB2  ARG  88           HB2      ARG  88  14.211   2.918   3.052
    4    HB3  ARG  88           HB3      ARG  88  14.356   4.007   1.675
    5    HG2  ARG  88           HG2      ARG  88  15.814   5.343   3.618
    6    HG3  ARG  88           HG3      ARG  88  16.149   3.658   4.005
    7    HD2  ARG  88           HD2      ARG  88  17.422   3.365   2.161
    8    HD3  ARG  88           HD3      ARG  88  16.279   4.222   1.123
    9    HE   ARG  88           HE       ARG  88  18.661   5.312   2.169
   10   HH21  ARG  88          HH11      ARG  88  18.987   7.533   1.966
   11   HH22  ARG  88          HH12      ARG  88  17.626   8.592   1.816
   12   HH11  ARG  88          HH21      ARG  88  15.316   6.033   1.883
   13   HH12  ARG  88          HH22      ARG  88  15.546   7.739   1.744

  No H/Q in entry =          13
  In of MODEL   68
    1    H    GLU  89           H        GLU  89  12.546   5.766   1.118
    2    HA   GLU  89           HA       GLU  89  14.071   8.140   0.954
    3    HB2  GLU  89           HB2      GLU  89  12.939   7.080  -0.991
    4    HB3  GLU  89           HB3      GLU  89  11.389   7.610  -0.338
    5    HG2  GLU  89           HG2      GLU  89  12.069   9.953  -0.510
    6    HG3  GLU  89           HG3      GLU  89  13.678   9.475  -1.042

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LEU  90           H        LEU  90  10.745   7.604   2.080
    2    HA   LEU  90           HA       LEU  90  10.204  10.335   2.643
    3    HB2  LEU  90           HB2      LEU  90   9.031   7.755   3.680
    4    HB3  LEU  90           HB3      LEU  90   8.385   9.346   4.095
    5    HG   LEU  90           HG       LEU  90   8.816   8.458   1.230
    6   HD12  LEU  90          HD11      LEU  90   6.285   8.106   1.291
    7   HD11  LEU  90          HD12      LEU  90   6.437   8.105   3.048
    8   HD13  LEU  90          HD13      LEU  90   7.268   6.879   2.089
    9   HD22  LEU  90          HD21      LEU  90   8.500  10.763   1.147
   10   HD21  LEU  90          HD22      LEU  90   7.512  10.792   2.605
   11   HD23  LEU  90          HD23      LEU  90   6.822  10.225   1.085

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  91           H        ILE  91  11.488   7.674   4.579
    2    HA   ILE  91           HA       ILE  91  11.613   9.050   7.041
    3    HB   ILE  91           HB       ILE  91  13.190   6.722   5.930
    4   HG12  ILE  91          HG12      ILE  91  11.169   6.880   8.186
    5   HG13  ILE  91          HG13      ILE  91  10.704   6.588   6.511
    6   HG22  ILE  91          HG21      ILE  91  13.658   6.524   8.572
    7   HG21  ILE  91          HG22      ILE  91  13.566   8.281   8.463
    8   HG23  ILE  91          HG23      ILE  91  14.754   7.400   7.504
    9   HD13  ILE  91          HD11      ILE  91  11.726   4.495   6.451
   10   HD12  ILE  91          HD12      ILE  91  11.130   4.555   8.110
   11   HD11  ILE  91          HD13      ILE  91  12.829   4.882   7.772

  No H/Q in entry =          11
  In of MODEL   68
    1    H    THR  92           H        THR  92  13.835   8.891   4.293
    2    HA   THR  92           HA       THR  92  15.986  10.308   5.450
    3    HB   THR  92           HB       THR  92  15.005  10.162   2.588
    4    HG1  THR  92           HG1      THR  92  15.853   8.275   3.002
    5   HG22  THR  92          HG21      THR  92  17.568  10.875   2.295
    6   HG21  THR  92          HG22      THR  92  17.251  11.700   3.821
    7   HG23  THR  92          HG23      THR  92  16.279  12.072   2.397

  No H/Q in entry =           7
  In of MODEL   68
    1    H    GLU  93           H        GLU  93  13.090  11.428   3.712
    2    HA   GLU  93           HA       GLU  93  13.659  14.194   3.816
    3    HB2  GLU  93           HB2      GLU  93  10.968  12.796   3.832
    4    HB3  GLU  93           HB3      GLU  93  11.240  14.497   3.454
    5    HG2  GLU  93           HG2      GLU  93  12.601  12.261   1.937
    6    HG3  GLU  93           HG3      GLU  93  11.049  12.927   1.445

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LEU  94           H        LEU  94  11.934  12.031   6.034
    2    HA   LEU  94           HA       LEU  94  11.104  13.978   7.901
    3    HB2  LEU  94           HB2      LEU  94  11.707  11.029   8.188
    4    HB3  LEU  94           HB3      LEU  94  11.124  12.005   9.533
    5    HG   LEU  94           HG       LEU  94   9.643  12.032   6.903
    6   HD11  LEU  94          HD11      LEU  94   9.744   9.820   8.916
    7   HD13  LEU  94          HD12      LEU  94   9.445   9.749   7.181
    8   HD12  LEU  94          HD13      LEU  94   8.161  10.258   8.276
    9   HD23  LEU  94          HD21      LEU  94   7.718  12.421   8.499
   10   HD22  LEU  94          HD22      LEU  94   8.945  13.686   8.532
   11   HD21  LEU  94          HD23      LEU  94   8.892  12.474   9.811

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  95           H        ILE  95  14.096  12.075   7.675
    2    HA   ILE  95           HA       ILE  95  15.252  13.018  10.087
    3    HB   ILE  95           HB       ILE  95  16.504  11.950   7.544
    4   HG12  ILE  95          HG12      ILE  95  16.216  10.758  10.317
    5   HG13  ILE  95          HG13      ILE  95  15.053  10.484   9.021
    6   HG21  ILE  95          HG21      ILE  95  17.748  12.780  10.185
    7   HG23  ILE  95          HG22      ILE  95  18.208  13.305   8.564
    8   HG22  ILE  95          HG23      ILE  95  18.529  11.651   9.079
    9   HD13  ILE  95          HD11      ILE  95  16.547   9.214   7.765
   10   HD12  ILE  95          HD12      ILE  95  17.022   8.776   9.404
   11   HD11  ILE  95          HD13      ILE  95  17.965   9.961   8.501

  No H/Q in entry =          11
  In of MODEL   68
    1    H    GLU  96           H        GLU  96  15.399  14.239   6.747
    2    HA   GLU  96           HA       GLU  96  17.225  16.337   7.217
    3    HB2  GLU  96           HB2      GLU  96  16.569  15.659   4.960
    4    HB3  GLU  96           HB3      GLU  96  14.921  16.202   5.256
    5    HG2  GLU  96           HG2      GLU  96  15.468  18.334   4.706
    6    HG3  GLU  96           HG3      GLU  96  16.765  18.352   5.890

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LEU  97           H        LEU  97  13.715  16.119   7.644
    2    HA   LEU  97           HA       LEU  97  13.273  18.851   8.274
    3    HB2  LEU  97           HB2      LEU  97  11.778  16.314   8.897
    4    HB3  LEU  97           HB3      LEU  97  11.250  17.859   9.561
    5    HG   LEU  97           HG       LEU  97  11.739  17.435   6.599
    6   HD12  LEU  97          HD11      LEU  97   9.217  17.283   6.479
    7   HD11  LEU  97          HD12      LEU  97   9.211  17.091   8.230
    8   HD13  LEU  97          HD13      LEU  97  10.004  15.887   7.214
    9   HD23  LEU  97          HD21      LEU  97   9.983  19.383   6.621
   10   HD22  LEU  97          HD22      LEU  97  11.661  19.760   7.014
   11   HD21  LEU  97          HD23      LEU  97  10.472  19.584   8.304

  No H/Q in entry =          11
  In of MODEL   68
    1    H    HIS  98           H        HIS  98  14.119  16.041  10.282
    2    HA   HIS  98           HA       HIS  98  13.947  17.311  12.793
    3    HB2  HIS  98           HB2      HIS  98  15.718  15.066  11.802
    4    HB3  HIS  98           HB3      HIS  98  15.710  15.611  13.481
    5    HD1  HIS  98           HD1      HIS  98  13.529  13.951  10.894
    6    HD2  HIS  98           HD2      HIS  98  13.409  14.886  14.954
    7    HE1  HIS  98           HE1      HIS  98  11.514  12.741  11.849
    8    HE2  HIS  98           HE2      HIS  98  11.421  13.303  14.318

  No H/Q in entry =           8
  In of MODEL   68
    1    H    GLU  99           H        GLU  99  16.503  17.209  10.361
    2    HA   GLU  99           HA       GLU  99  18.475  18.565  11.886
    3    HB2  GLU  99           HB2      GLU  99  18.968  17.274   9.823
    4    HB3  GLU  99           HB3      GLU  99  18.148  18.517   8.876
    5    HG2  GLU  99           HG2      GLU  99  19.740  20.205   9.661
    6    HG3  GLU  99           HG3      GLU  99  20.529  19.015  10.690

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LYS 100           H        LYS 100  15.943  19.696   9.663
    2    HA   LYS 100           HA       LYS 100  16.716  22.441   9.796
    3    HB2  LYS 100           HB2      LYS 100  14.095  21.125   9.045
    4    HB3  LYS 100           HB3      LYS 100  14.380  22.866   8.947
    5    HG2  LYS 100           HG2      LYS 100  16.357  22.429   7.484
    6    HG3  LYS 100           HG3      LYS 100  15.959  20.708   7.508
    7    HD2  LYS 100           HD2      LYS 100  13.760  21.194   6.504
    8    HD3  LYS 100           HD3      LYS 100  14.141  22.916   6.487
    9    HE2  LYS 100           HE2      LYS 100  16.106  22.447   5.031
   10    HE3  LYS 100           HE3      LYS 100  15.655  20.738   5.004
   11    HZ1  LYS 100           HZ1      LYS 100  13.812  22.912   4.159
   12    HZ3  LYS 100           HZ2      LYS 100  13.643  21.239   3.903
   13    HZ2  LYS 100           HZ3      LYS 100  14.847  22.109   3.080

  No H/Q in entry =          13
  In of MODEL   68
    1    H    LEU 101           H        LEU 101  14.635  20.384  11.768
    2    HA   LEU 101           HA       LEU 101  13.449  22.448  13.337
    3    HB2  LEU 101           HB2      LEU 101  13.917  19.504  13.733
    4    HB3  LEU 101           HB3      LEU 101  13.371  20.485  15.089
    5    HG   LEU 101           HG       LEU 101  11.955  20.551  12.419
    6   HD12  LEU 101          HD11      LEU 101  10.308  18.978  13.693
    7   HD11  LEU 101          HD12      LEU 101  11.705  18.581  14.690
    8   HD13  LEU 101          HD13      LEU 101  11.743  18.267  12.955
    9   HD21  LEU 101          HD21      LEU 101  11.288  21.349  15.267
   10   HD23  LEU 101          HD22      LEU 101  10.030  21.108  14.057
   11   HD22  LEU 101          HD23      LEU 101  11.255  22.353  13.815

  No H/Q in entry =          11
  In of MODEL   68
    1    H    LYS 102           H        LYS 102  16.602  21.866  12.905
    2    HA   LYS 102           HA       LYS 102  18.440  22.757  13.976
    3    HB2  LYS 102           HB2      LYS 102  16.612  24.261  15.102
    4    HB3  LYS 102           HB3      LYS 102  16.827  23.205  16.483
    5    HG2  LYS 102           HG2      LYS 102  18.704  25.228  15.307
    6    HG3  LYS 102           HG3      LYS 102  18.324  24.917  16.987
    7    HD2  LYS 102           HD2      LYS 102  20.008  23.012  15.310
    8    HD3  LYS 102           HD3      LYS 102  20.685  24.344  16.238
    9    HE2  LYS 102           HE2      LYS 102  20.308  21.795  17.217
   10    HE3  LYS 102           HE3      LYS 102  20.514  23.243  18.202
   11    HZ2  LYS 102           HZ1      LYS 102  18.555  21.945  18.824
   12    HZ1  LYS 102           HZ2      LYS 102  17.911  22.163  17.274
   13    HZ3  LYS 102           HZ3      LYS 102  18.129  23.499  18.294

  No H/Q in entry =          13
  In of MODEL   68
    1    H    ALA 103           H        ALA 103  16.380  21.144  16.402
    2    HA   ALA 103           HA       ALA 103  18.116  19.954  18.064
    3    HB2  ALA 103           HB1      ALA 103  16.549  17.933  18.065
    4    HB1  ALA 103           HB2      ALA 103  15.647  18.774  16.803
    5    HB3  ALA 103           HB3      ALA 103  15.818  19.503  18.399

  No H/Q in entry =           5
  In of MODEL   68
    1    H1   ALA   1           H3       ALA   1  -1.555  -7.222 -21.466
    2    H2   ALA   1           H2       ALA   1  -2.338  -8.662 -21.008
    3    H3   ALA   1           H1       ALA   1  -0.730  -8.701 -21.561
    4    HA   ALA   1           HA       ALA   1  -1.558  -9.185 -23.556
    5    HB1  ALA   1           HB1      ALA   1  -3.689  -9.918 -23.082
    6    HB2  ALA   1           HB2      ALA   1  -4.140  -8.414 -23.885
    7    HB3  ALA   1           HB3      ALA   1  -4.080  -8.488 -22.126

  No H/Q in entry =           7
  In of MODEL   68
    1    H    GLU   2           H        GLU   2  -2.395  -8.009 -25.551
    2    HA   GLU   2           HA       GLU   2  -1.012  -5.988 -26.435
    3    HB2  GLU   2           HB2      GLU   2  -4.018  -6.080 -26.755
    4    HB3  GLU   2           HB3      GLU   2  -2.903  -5.212 -27.807
    5    HG2  GLU   2           HG2      GLU   2  -2.384  -7.102 -28.954
    6    HG3  GLU   2           HG3      GLU   2  -2.081  -8.000 -27.473

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLU   3           H        GLU   3  -4.183  -4.752 -25.543
    2    HA   GLU   3           HA       GLU   3  -3.157  -2.185 -24.923
    3    HB2  GLU   3           HB2      GLU   3  -5.835  -3.520 -24.589
    4    HB3  GLU   3           HB3      GLU   3  -5.550  -1.900 -23.948
    5    HG2  GLU   3           HG2      GLU   3  -5.199  -0.979 -26.077
    6    HG3  GLU   3           HG3      GLU   3  -4.791  -2.533 -26.796

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LEU   4           H        LEU   4  -4.731  -4.549 -22.736
    2    HA   LEU   4           HA       LEU   4  -4.379  -3.309 -20.349
    3    HB2  LEU   4           HB2      LEU   4  -3.812  -6.247 -20.807
    4    HB3  LEU   4           HB3      LEU   4  -4.226  -5.498 -19.266
    5    HG   LEU   4           HG       LEU   4  -5.995  -5.595 -21.732
    6   HD13  LEU   4          HD11      LEU   4  -7.176  -7.318 -20.729
    7   HD12  LEU   4          HD12      LEU   4  -6.696  -6.849 -19.099
    8   HD11  LEU   4          HD13      LEU   4  -5.553  -7.687 -20.146
    9   HD23  LEU   4          HD21      LEU   4  -7.688  -4.790 -19.869
   10   HD22  LEU   4          HD22      LEU   4  -6.658  -3.614 -20.683
   11   HD21  LEU   4          HD23      LEU   4  -6.229  -4.195 -19.075

  No H/Q in entry =          11
  In of MODEL   68
    1    H    GLU   5           H        GLU   5  -1.865  -5.139 -22.071
    2    HA   GLU   5           HA       GLU   5   0.114  -4.831 -20.033
    3    HB2  GLU   5           HB2      GLU   5   0.195  -6.608 -21.777
    4    HB3  GLU   5           HB3      GLU   5   0.500  -5.366 -22.993
    5    HG2  GLU   5           HG2      GLU   5   2.556  -4.703 -21.826
    6    HG3  GLU   5           HG3      GLU   5   2.252  -5.909 -20.577

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLU   6           H        GLU   6  -0.531  -3.134 -23.085
    2    HA   GLU   6           HA       GLU   6   1.624  -1.285 -22.821
    3    HB2  GLU   6           HB2      GLU   6  -0.727  -1.634 -24.584
    4    HB3  GLU   6           HB3      GLU   6  -0.153   0.024 -24.403
    5    HG2  GLU   6           HG2      GLU   6   1.015  -0.989 -26.272
    6    HG3  GLU   6           HG3      GLU   6   2.159  -0.780 -24.948

  No H/Q in entry =           6
  In of MODEL   68
    1    H    VAL   7           H        VAL   7  -1.715  -1.378 -21.780
    2    HA   VAL   7           HA       VAL   7  -1.958   1.335 -20.954
    3    HB   VAL   7           HB       VAL   7  -3.401  -1.190 -20.109
    4   HG11  VAL   7          HG11      VAL   7  -3.800   1.698 -19.306
    5   HG13  VAL   7          HG12      VAL   7  -3.690   0.278 -18.266
    6   HG12  VAL   7          HG13      VAL   7  -5.124   0.533 -19.261
    7   HG21  VAL   7          HG21      VAL   7  -3.564  -0.124 -22.502
    8   HG23  VAL   7          HG22      VAL   7  -4.520   1.120 -21.696
    9   HG22  VAL   7          HG23      VAL   7  -5.053  -0.561 -21.663

  No H/Q in entry =           9
  In of MODEL   68
    1    H    VAL   8           H        VAL   8  -0.949  -1.636 -19.298
    2    HA   VAL   8           HA       VAL   8  -0.642  -0.544 -16.707
    3    HB   VAL   8           HB       VAL   8   0.701  -2.878 -18.083
    4   HG13  VAL   8          HG11      VAL   8   2.280  -2.289 -16.437
    5   HG12  VAL   8          HG12      VAL   8   1.266  -3.475 -15.616
    6   HG11  VAL   8          HG13      VAL   8   1.037  -1.755 -15.304
    7   HG22  VAL   8          HG21      VAL   8  -0.922  -4.219 -17.014
    8   HG21  VAL   8          HG22      VAL   8  -1.852  -2.767 -17.371
    9   HG23  VAL   8          HG23      VAL   8  -1.218  -3.026 -15.750

  No H/Q in entry =           9
  In of MODEL   68
    1    H    MET   9           H        MET   9   1.612  -0.838 -19.451
    2    HA   MET   9           HA       MET   9   3.889   0.227 -18.191
    3    HB2  MET   9           HB2      MET   9   2.944   0.242 -21.056
    4    HB3  MET   9           HB3      MET   9   4.456   1.013 -20.578
    5    HG2  MET   9           HG2      MET   9   5.248  -1.114 -19.619
    6    HG3  MET   9           HG3      MET   9   3.730  -1.890 -20.076
    7    HE1  MET   9           HE1      MET   9   6.551   0.185 -20.993
    8    HE3  MET   9           HE2      MET   9   5.971   0.717 -22.568
    9    HE2  MET   9           HE3      MET   9   7.250  -0.489 -22.468

  No H/Q in entry =           9
  In of MODEL   68
    1    H    GLY  10           H        GLY  10   1.195   1.803 -19.877
    2    HA3  GLY  10           HA2      GLY  10   2.139   4.465 -19.641
    3    HA2  GLY  10           HA3      GLY  10   0.453   3.992 -19.846

  No H/Q in entry =           3
  In of MODEL   68
    1    H    LEU  11           H        LEU  11   0.063   2.470 -17.554
    2    HA   LEU  11           HA       LEU  11  -0.483   4.450 -15.602
    3    HB2  LEU  11           HB2      LEU  11  -0.395   1.436 -15.435
    4    HB3  LEU  11           HB3      LEU  11  -0.912   2.460 -14.097
    5    HG   LEU  11           HG       LEU  11  -2.149   2.555 -16.861
    6   HD13  LEU  11          HD11      LEU  11  -2.719   0.411 -16.099
    7   HD12  LEU  11          HD12      LEU  11  -4.076   1.396 -15.557
    8   HD11  LEU  11          HD13      LEU  11  -2.818   0.928 -14.415
    9   HD22  LEU  11          HD21      LEU  11  -2.754   4.571 -15.862
   10   HD21  LEU  11          HD22      LEU  11  -2.676   3.911 -14.229
   11   HD23  LEU  11          HD23      LEU  11  -4.048   3.532 -15.270

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  12           H        ILE  12   2.077   2.000 -15.834
    2    HA   ILE  12           HA       ILE  12   3.278   2.555 -13.332
    3    HB   ILE  12           HB       ILE  12   4.543   1.516 -15.890
    4   HG12  ILE  12          HG12      ILE  12   2.532   0.276 -14.745
    5   HG13  ILE  12          HG13      ILE  12   3.934  -0.652 -15.234
    6   HG22  ILE  12          HG21      ILE  12   6.210   0.493 -14.279
    7   HG21  ILE  12          HG22      ILE  12   5.510   1.501 -13.013
    8   HG23  ILE  12          HG23      ILE  12   6.294   2.249 -14.403
    9   HD12  ILE  12          HD11      ILE  12   3.083  -1.200 -12.944
   10   HD11  ILE  12          HD12      ILE  12   3.476   0.446 -12.449
   11   HD13  ILE  12          HD13      ILE  12   4.749  -0.648 -12.948

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  13           H        ILE  13   3.872   3.810 -16.593
    2    HA   ILE  13           HA       ILE  13   5.998   5.547 -15.874
    3    HB   ILE  13           HB       ILE  13   3.966   5.614 -18.119
    4   HG12  ILE  13          HG12      ILE  13   5.800   3.772 -17.835
    5   HG13  ILE  13          HG13      ILE  13   5.556   4.508 -19.416
    6   HG21  ILE  13          HG21      ILE  13   6.245   7.479 -17.493
    7   HG23  ILE  13          HG22      ILE  13   4.624   7.871 -18.054
    8   HG22  ILE  13          HG23      ILE  13   5.797   7.177 -19.172
    9   HD13  ILE  13          HD11      ILE  13   7.484   5.958 -19.111
   10   HD12  ILE  13          HD12      ILE  13   7.975   4.315 -18.712
   11   HD11  ILE  13          HD13      ILE  13   7.631   5.466 -17.425

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ASN  14           H        ASN  14   2.488   6.018 -16.144
    2    HA   ASN  14           HA       ASN  14   2.427   8.766 -15.517
    3    HB2  ASN  14           HB2      ASN  14   0.545   7.109 -16.342
    4    HB3  ASN  14           HB3      ASN  14   0.225   6.934 -14.622
    5   HD21  ASN  14          HD21      ASN  14  -1.802   8.072 -16.059
    6   HD22  ASN  14          HD22      ASN  14  -1.876   9.746 -15.797

  No H/Q in entry =           6
  In of MODEL   68
    1    H    SER  15           H        SER  15   2.151   5.895 -13.430
    2    HA   SER  15           HA       SER  15   1.834   7.271 -10.987
    3    HB2  SER  15           HB2      SER  15   2.399   5.193  -9.930
    4    HB3  SER  15           HB3      SER  15   1.570   4.764 -11.422
    5    HG   SER  15           HG       SER  15   3.318   3.792 -12.015

  No H/Q in entry =           5
  In of MODEL   68
    1    H    GLY  16           H        GLY  16   4.718   6.188 -12.741
    2    HA3  GLY  16           HA2      GLY  16   6.637   6.965 -10.813
    3    HA2  GLY  16           HA3      GLY  16   6.942   6.758 -12.536

  No H/Q in entry =           3
  In of MODEL   68
    1    H    GLN  17           H        GLN  17   5.239   8.700 -13.606
    2    HA   GLN  17           HA       GLN  17   6.799  11.054 -13.306
    3    HB2  GLN  17           HB2      GLN  17   5.472  10.544 -15.344
    4    HB3  GLN  17           HB3      GLN  17   3.989  10.785 -14.418
    5    HG2  GLN  17           HG2      GLN  17   4.524  12.827 -15.648
    6    HG3  GLN  17           HG3      GLN  17   4.707  13.112 -13.918
    7   HE21  GLN  17          HE21      GLN  17   6.375  14.703 -13.990
    8   HE22  GLN  17          HE22      GLN  17   7.915  14.399 -14.636

  No H/Q in entry =           8
  In of MODEL   68
    1    H    ALA  18           H        ALA  18   3.706  10.018 -11.954
    2    HA   ALA  18           HA       ALA  18   2.963  12.406 -10.697
    3    HB1  ALA  18           HB1      ALA  18   1.852   9.940 -10.911
    4    HB2  ALA  18           HB2      ALA  18   1.294  11.159  -9.768
    5    HB3  ALA  18           HB3      ALA  18   2.394   9.888  -9.234

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ARG  19           H        ARG  19   4.857   9.662  -9.408
    2    HA   ARG  19           HA       ARG  19   5.380  10.833  -6.890
    3    HB2  ARG  19           HB2      ARG  19   5.813   8.432  -7.408
    4    HB3  ARG  19           HB3      ARG  19   7.166   8.925  -8.430
    5    HG2  ARG  19           HG2      ARG  19   8.276   9.980  -6.511
    6    HG3  ARG  19           HG3      ARG  19   6.903   9.585  -5.479
    7    HD2  ARG  19           HD2      ARG  19   8.678   7.965  -5.114
    8    HD3  ARG  19           HD3      ARG  19   7.311   7.169  -5.898
    9    HE   ARG  19           HE       ARG  19   9.009   7.994  -7.947
   10   HH21  ARG  19          HH11      ARG  19  10.582   6.599  -8.792
   11   HH22  ARG  19          HH12      ARG  19  11.138   5.259  -7.852
   12   HH11  ARG  19          HH21      ARG  19   9.097   5.975  -5.162
   13   HH12  ARG  19          HH22      ARG  19  10.294   4.905  -5.795

  No H/Q in entry =          13
  In of MODEL   68
    1    H    SER  20           H        SER  20   7.198  10.866  -9.938
    2    HA   SER  20           HA       SER  20   9.431  12.304  -9.119
    3    HB2  SER  20           HB2      SER  20   8.910  11.262 -11.426
    4    HB3  SER  20           HB3      SER  20   8.123  12.795 -11.783
    5    HG   SER  20           HG       SER  20  10.641  12.925 -10.626

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LEU  21           H        LEU  21   6.321  13.542 -10.321
    2    HA   LEU  21           HA       LEU  21   6.968  16.294 -10.107
    3    HB2  LEU  21           HB2      LEU  21   4.313  14.846 -10.023
    4    HB3  LEU  21           HB3      LEU  21   4.463  16.602 -10.032
    5    HG   LEU  21           HG       LEU  21   5.669  14.807 -12.159
    6   HD12  LEU  21          HD11      LEU  21   3.076  16.384 -12.216
    7   HD11  LEU  21          HD12      LEU  21   3.205  14.626 -12.142
    8   HD13  LEU  21          HD13      LEU  21   3.770  15.492 -13.571
    9   HD21  LEU  21          HD21      LEU  21   5.440  17.781 -11.738
   10   HD23  LEU  21          HD22      LEU  21   5.436  17.163 -13.387
   11   HD22  LEU  21          HD23      LEU  21   6.813  16.857 -12.341

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ALA  22           H        ALA  22   5.476  13.999  -7.851
    2    HA   ALA  22           HA       ALA  22   4.855  15.809  -5.790
    3    HB3  ALA  22           HB1      ALA  22   4.117  13.409  -5.945
    4    HB2  ALA  22           HB2      ALA  22   4.700  13.893  -4.352
    5    HB1  ALA  22           HB3      ALA  22   5.732  12.940  -5.419

  No H/Q in entry =           5
  In of MODEL   68
    1    H    TYR  23           H        TYR  23   7.808  13.810  -6.221
    2    HA   TYR  23           HA       TYR  23   9.181  14.850  -3.971
    3    HB2  TYR  23           HB2      TYR  23   9.988  12.846  -5.121
    4    HB3  TYR  23           HB3      TYR  23  10.292  13.781  -6.585
    5    HD1  TYR  23           HD1      TYR  23  11.250  13.490  -2.985
    6    HD2  TYR  23           HD2      TYR  23  12.324  14.949  -6.882
    7    HE1  TYR  23           HE1      TYR  23  13.502  14.094  -2.139
    8    HE2  TYR  23           HE2      TYR  23  14.575  15.552  -6.035
    9    HH   TYR  23           HH       TYR  23  15.567  14.752  -2.722

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ALA  24           H        ALA  24   8.988  15.943  -7.342
    2    HA   ALA  24           HA       ALA  24  10.863  18.047  -7.103
    3    HB2  ALA  24           HB1      ALA  24  10.421  18.097  -9.312
    4    HB3  ALA  24           HB2      ALA  24   8.858  18.832  -8.956
    5    HB1  ALA  24           HB3      ALA  24   9.001  17.080  -9.079

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ALA  25           H        ALA  25   7.386  17.830  -6.482
    2    HA   ALA  25           HA       ALA  25   6.878  20.545  -5.923
    3    HB1  ALA  25           HB1      ALA  25   5.238  18.529  -6.117
    4    HB2  ALA  25           HB2      ALA  25   4.856  19.817  -4.974
    5    HB3  ALA  25           HB3      ALA  25   5.561  18.306  -4.397

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LEU  26           H        LEU  26   7.974  17.884  -3.863
    2    HA   LEU  26           HA       LEU  26   8.063  19.326  -1.431
    3    HB2  LEU  26           HB2      LEU  26   8.184  16.910  -1.416
    4    HB3  LEU  26           HB3      LEU  26   9.654  16.930  -2.387
    5    HG   LEU  26           HG       LEU  26  10.856  18.068  -0.551
    6   HD12  LEU  26          HD11      LEU  26   9.629  18.072   1.709
    7   HD11  LEU  26          HD12      LEU  26   8.144  17.914   0.774
    8   HD13  LEU  26          HD13      LEU  26   9.173  19.330   0.560
    9   HD21  LEU  26          HD21      LEU  26   9.349  15.587   0.331
   10   HD23  LEU  26          HD22      LEU  26  10.859  16.169   1.027
   11   HD22  LEU  26          HD23      LEU  26  10.820  15.603  -0.641

  No H/Q in entry =          11
  In of MODEL   68
    1    H    LYS  27           H        LYS  27  10.486  18.770  -3.953
    2    HA   LYS  27           HA       LYS  27  12.656  20.040  -2.730
    3    HB2  LYS  27           HB2      LYS  27  12.773  18.686  -4.814
    4    HB3  LYS  27           HB3      LYS  27  11.993  20.006  -5.685
    5    HG2  LYS  27           HG2      LYS  27  13.842  21.515  -5.113
    6    HG3  LYS  27           HG3      LYS  27  14.616  20.235  -4.171
    7    HD2  LYS  27           HD2      LYS  27  14.776  18.841  -6.219
    8    HD3  LYS  27           HD3      LYS  27  14.046  20.147  -7.153
    9    HE2  LYS  27           HE2      LYS  27  15.916  21.637  -6.546
   10    HE3  LYS  27           HE3      LYS  27  16.650  20.335  -5.603
   11    HZ3  LYS  27           HZ1      LYS  27  17.639  20.438  -7.790
   12    HZ2  LYS  27           HZ2      LYS  27  16.115  20.299  -8.530
   13    HZ1  LYS  27           HZ3      LYS  27  16.752  18.999  -7.641

  No H/Q in entry =          13
  In of MODEL   68
    1    H    GLN  28           H        GLN  28  10.018  21.384  -4.684
    2    HA   GLN  28           HA       GLN  28  10.946  24.047  -4.848
    3    HB2  GLN  28           HB2      GLN  28   8.133  22.926  -4.746
    4    HB3  GLN  28           HB3      GLN  28   8.507  24.614  -5.094
    5    HG2  GLN  28           HG2      GLN  28   9.577  22.257  -6.673
    6    HG3  GLN  28           HG3      GLN  28   8.203  23.246  -7.162
    7   HE21  GLN  28          HE21      GLN  28  11.239  22.880  -8.089
    8   HE22  GLN  28          HE22      GLN  28  11.712  24.488  -8.359

  No H/Q in entry =           8
  In of MODEL   68
    1    H    ALA  29           H        ALA  29   9.034  22.342  -2.405
    2    HA   ALA  29           HA       ALA  29   8.459  24.534  -0.732
    3    HB2  ALA  29           HB1      ALA  29   7.748  22.963   0.842
    4    HB1  ALA  29           HB2      ALA  29   8.984  21.791   0.382
    5    HB3  ALA  29           HB3      ALA  29   7.594  22.064  -0.667

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LYS  30           H        LYS  30  11.216  22.299  -0.792
    2    HA   LYS  30           HA       LYS  30  12.522  23.278   1.507
    3    HB2  LYS  30           HB2      LYS  30  13.634  21.995  -0.998
    4    HB3  LYS  30           HB3      LYS  30  14.612  22.371   0.422
    5    HG2  LYS  30           HG2      LYS  30  13.075  20.975   1.807
    6    HG3  LYS  30           HG3      LYS  30  12.195  20.537   0.339
    7    HD2  LYS  30           HD2      LYS  30  14.252  19.572  -0.618
    8    HD3  LYS  30           HD3      LYS  30  15.151  20.024   0.832
    9    HE2  LYS  30           HE2      LYS  30  13.663  18.580   2.192
   10    HE3  LYS  30           HE3      LYS  30  12.795  18.108   0.726
   11    HZ2  LYS  30           HZ1      LYS  30  14.605  16.555   1.493
   12    HZ1  LYS  30           HZ2      LYS  30  15.728  17.754   1.037
   13    HZ3  LYS  30           HZ3      LYS  30  14.701  17.053  -0.125

  No H/Q in entry =          13
  In of MODEL   68
    1    H    GLN  31           H        GLN  31  12.399  24.468  -1.794
    2    HA   GLN  31           HA       GLN  31  14.528  26.388  -1.380
    3    HB2  GLN  31           HB2      GLN  31  12.485  26.402  -3.605
    4    HB3  GLN  31           HB3      GLN  31  14.097  27.117  -3.608
    5    HG2  GLN  31           HG2      GLN  31  14.591  24.429  -3.022
    6    HG3  GLN  31           HG3      GLN  31  13.288  24.355  -4.201
    7   HE21  GLN  31          HE21      GLN  31  16.141  23.594  -4.601
    8   HE22  GLN  31          HE22      GLN  31  16.702  24.570  -5.871

  No H/Q in entry =           8
  In of MODEL   68
    1    H    GLY  32           H        GLY  32  11.456  26.174  -0.234
    2    HA3  GLY  32           HA2      GLY  32  10.281  27.733   1.033
    3    HA2  GLY  32           HA3      GLY  32  11.391  28.979   0.478

  No H/Q in entry =           3
  In of MODEL   68
    1    H    ASP  33           H        ASP  33  10.051  27.049  -2.007
    2    HA   ASP  33           HA       ASP  33   8.359  29.298  -2.871
    3    HB2  ASP  33           HB2      ASP  33   9.481  26.887  -4.304
    4    HB3  ASP  33           HB3      ASP  33   8.317  27.985  -5.039

  No H/Q in entry =           4
  In of MODEL   68
    1    H    PHE  34           H        PHE  34   6.676  28.808  -1.306
    2    HA   PHE  34           HA       PHE  34   5.327  26.320  -1.201
    3    HB2  PHE  34           HB2      PHE  34   4.332  29.098  -0.532
    4    HB3  PHE  34           HB3      PHE  34   3.501  27.599  -0.115
    5    HD1  PHE  34           HD1      PHE  34   5.722  30.029   1.090
    6    HD2  PHE  34           HD2      PHE  34   5.093  25.780   1.054
    7    HE1  PHE  34           HE1      PHE  34   7.115  29.803   3.128
    8    HE2  PHE  34           HE2      PHE  34   6.489  25.558   3.089
    9    HZ   PHE  34           HZ       PHE  34   7.494  27.571   4.126

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ALA  35           H        ALA  35   4.862  29.170  -3.223
    2    HA   ALA  35           HA       ALA  35   2.318  28.521  -4.245
    3    HB3  ALA  35           HB1      ALA  35   3.353  29.918  -6.288
    4    HB2  ALA  35           HB2      ALA  35   4.566  30.299  -5.066
    5    HB1  ALA  35           HB3      ALA  35   2.871  30.688  -4.777

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ALA  36           H        ALA  36   5.555  27.882  -5.597
    2    HA   ALA  36           HA       ALA  36   4.584  26.432  -7.835
    3    HB3  ALA  36           HB1      ALA  36   6.741  26.580  -8.451
    4    HB2  ALA  36           HB2      ALA  36   7.235  25.563  -7.097
    5    HB1  ALA  36           HB3      ALA  36   7.108  27.310  -6.888

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ALA  37           H        ALA  37   5.551  25.462  -4.576
    2    HA   ALA  37           HA       ALA  37   5.527  22.672  -4.994
    3    HB2  ALA  37           HB1      ALA  37   5.244  24.469  -2.623
    4    HB1  ALA  37           HB2      ALA  37   6.393  23.164  -2.910
    5    HB3  ALA  37           HB3      ALA  37   4.736  22.792  -2.438

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LYS  38           H        LYS  38   2.967  24.853  -3.835
    2    HA   LYS  38           HA       LYS  38   0.890  23.015  -3.605
    3    HB2  LYS  38           HB2      LYS  38   1.208  25.776  -3.365
    4    HB3  LYS  38           HB3      LYS  38   0.010  25.609  -4.643
    5    HG2  LYS  38           HG2      LYS  38  -1.423  24.274  -3.196
    6    HG3  LYS  38           HG3      LYS  38  -0.178  24.234  -1.939
    7    HD2  LYS  38           HD2      LYS  38  -0.393  26.570  -1.501
    8    HD3  LYS  38           HD3      LYS  38  -1.308  26.842  -2.984
    9    HE2  LYS  38           HE2      LYS  38  -2.812  26.865  -1.045
   10    HE3  LYS  38           HE3      LYS  38  -3.169  25.480  -2.082
   11    HZ3  LYS  38           HZ1      LYS  38  -2.425  24.024  -0.543
   12    HZ2  LYS  38           HZ2      LYS  38  -2.792  25.281   0.542
   13    HZ1  LYS  38           HZ3      LYS  38  -1.194  25.048   0.017

  No H/Q in entry =          13
  In of MODEL   68
    1    H    ALA  39           H        ALA  39   1.846  24.918  -6.461
    2    HA   ALA  39           HA       ALA  39  -0.218  24.019  -8.161
    3    HB2  ALA  39           HB1      ALA  39   2.510  24.697  -9.217
    4    HB1  ALA  39           HB2      ALA  39   1.528  25.949  -8.457
    5    HB3  ALA  39           HB3      ALA  39   0.926  25.098  -9.880

  No H/Q in entry =           5
  In of MODEL   68
    1    H    MET  40           H        MET  40   3.035  22.762  -7.576
    2    HA   MET  40           HA       MET  40   2.963  20.733  -9.560
    3    HB2  MET  40           HB2      MET  40   4.571  20.987  -7.012
    4    HB3  MET  40           HB3      MET  40   4.838  19.729  -8.222
    5    HG2  MET  40           HG2      MET  40   4.859  22.683  -8.899
    6    HG3  MET  40           HG3      MET  40   6.316  21.801  -8.446
    7    HE3  MET  40           HE1      MET  40   7.216  19.585 -11.246
    8    HE2  MET  40           HE2      MET  40   6.656  19.265  -9.607
    9    HE1  MET  40           HE3      MET  40   7.735  20.625  -9.912

  No H/Q in entry =           9
  In of MODEL   68
    1    H    MET  41           H        MET  41   2.047  20.778  -6.136
    2    HA   MET  41           HA       MET  41   1.550  18.007  -5.847
    3    HB2  MET  41           HB2      MET  41   0.187  20.353  -4.506
    4    HB3  MET  41           HB3      MET  41   0.053  18.676  -3.991
    5    HG2  MET  41           HG2      MET  41   2.760  18.933  -4.029
    6    HG3  MET  41           HG3      MET  41   2.299  20.587  -3.640
    7    HE2  MET  41           HE1      MET  41  -0.725  19.302  -1.910
    8    HE1  MET  41           HE2      MET  41   0.072  20.824  -2.293
    9    HE3  MET  41           HE3      MET  41   0.020  20.260  -0.623

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ASP  42           H        ASP  42  -0.523  20.702  -6.832
    2    HA   ASP  42           HA       ASP  42  -2.946  19.310  -6.964
    3    HB2  ASP  42           HB2      ASP  42  -2.272  21.888  -7.230
    4    HB3  ASP  42           HB3      ASP  42  -2.418  21.485  -8.937

  No H/Q in entry =           4
  In of MODEL   68
    1    H    GLN  43           H        GLN  43  -0.513  19.922  -9.468
    2    HA   GLN  43           HA       GLN  43  -1.883  18.577 -11.552
    3    HB2  GLN  43           HB2      GLN  43   1.069  19.133 -11.172
    4    HB3  GLN  43           HB3      GLN  43   0.363  18.478 -12.652
    5    HG2  GLN  43           HG2      GLN  43  -1.174  20.485 -12.701
    6    HG3  GLN  43           HG3      GLN  43  -0.230  21.159 -11.376
    7   HE21  GLN  43          HE21      GLN  43  -0.089  22.773 -13.469
    8   HE22  GLN  43          HE22      GLN  43   1.328  22.566 -14.375

  No H/Q in entry =           8
  In of MODEL   68
    1    H    SER  44           H        SER  44   0.482  17.477  -9.157
    2    HA   SER  44           HA       SER  44   0.851  14.871 -10.172
    3    HB2  SER  44           HB2      SER  44   1.727  16.330  -7.941
    4    HB3  SER  44           HB3      SER  44   0.882  14.938  -7.265
    5    HG   SER  44           HG       SER  44   3.001  14.344  -7.689

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ARG  45           H        ARG  45  -1.486  16.168  -7.839
    2    HA   ARG  45           HA       ARG  45  -2.842  13.791  -7.195
    3    HB2  ARG  45           HB2      ARG  45  -3.069  15.961  -6.012
    4    HB3  ARG  45           HB3      ARG  45  -3.933  16.612  -7.401
    5    HG2  ARG  45           HG2      ARG  45  -5.676  14.864  -7.111
    6    HG3  ARG  45           HG3      ARG  45  -4.824  14.268  -5.686
    7    HD2  ARG  45           HD2      ARG  45  -5.061  16.536  -4.639
    8    HD3  ARG  45           HD3      ARG  45  -6.054  17.038  -6.023
    9    HE   ARG  45           HE       ARG  45  -7.133  14.651  -4.974
   10   HH21  ARG  45          HH11      ARG  45  -8.970  14.707  -3.704
   11   HH22  ARG  45          HH12      ARG  45  -9.384  16.145  -2.840
   12   HH11  ARG  45          HH21      ARG  45  -6.631  17.909  -3.963
   13   HH12  ARG  45          HH22      ARG  45  -8.054  17.958  -2.985

  No H/Q in entry =          13
  In of MODEL   68
    1    H    MET  46           H        MET  46  -3.457  16.178  -9.755
    2    HA   MET  46           HA       MET  46  -5.781  14.970 -10.812
    3    HB2  MET  46           HB2      MET  46  -3.704  16.819 -11.996
    4    HB3  MET  46           HB3      MET  46  -5.081  16.243 -12.940
    5    HG2  MET  46           HG2      MET  46  -6.633  17.166 -11.292
    6    HG3  MET  46           HG3      MET  46  -5.292  17.673 -10.273
    7    HE1  MET  46           HE1      MET  46  -7.065  17.759 -13.476
    8    HE3  MET  46           HE2      MET  46  -5.625  18.128 -14.418
    9    HE2  MET  46           HE3      MET  46  -6.852  19.370 -14.175

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ALA  47           H        ALA  47  -2.345  14.534 -11.568
    2    HA   ALA  47           HA       ALA  47  -2.667  12.793 -13.771
    3    HB3  ALA  47           HB1      ALA  47  -0.502  13.714 -13.423
    4    HB2  ALA  47           HB2      ALA  47  -0.337  11.989 -13.082
    5    HB1  ALA  47           HB3      ALA  47  -0.446  13.145 -11.754

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LEU  48           H        LEU  48  -2.389  12.175 -10.295
    2    HA   LEU  48           HA       LEU  48  -2.444   9.334 -10.442
    3    HB2  LEU  48           HB2      LEU  48  -3.235  11.250  -8.236
    4    HB3  LEU  48           HB3      LEU  48  -3.117   9.501  -8.029
    5    HG   LEU  48           HG       LEU  48  -0.842  11.228  -9.032
    6   HD13  LEU  48          HD11      LEU  48  -1.135  12.003  -6.845
    7   HD12  LEU  48          HD12      LEU  48   0.046  10.713  -6.641
    8   HD11  LEU  48          HD13      LEU  48  -1.649  10.428  -6.242
    9   HD22  LEU  48          HD21      LEU  48  -0.313   9.047  -9.664
   10   HD21  LEU  48          HD22      LEU  48  -1.173   8.325  -8.305
   11   HD23  LEU  48          HD23      LEU  48   0.389   9.101  -8.048

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ASN  49           H        ASN  49  -4.942  11.793 -10.051
    2    HA   ASN  49           HA       ASN  49  -7.105  10.101  -9.505
    3    HB2  ASN  49           HB2      ASN  49  -7.215  12.513  -9.182
    4    HB3  ASN  49           HB3      ASN  49  -7.021  12.787 -10.909
    5   HD21  ASN  49          HD21      ASN  49  -9.240  11.290  -8.536
    6   HD22  ASN  49          HD22      ASN  49 -10.635  11.503  -9.475

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLU  50           H        GLU  50  -5.841  11.303 -12.597
    2    HA   GLU  50           HA       GLU  50  -7.777  10.014 -14.239
    3    HB2  GLU  50           HB2      GLU  50  -6.336  11.850 -15.060
    4    HB3  GLU  50           HB3      GLU  50  -4.928  10.798 -14.917
    5    HG2  GLU  50           HG2      GLU  50  -5.879   9.242 -16.548
    6    HG3  GLU  50           HG3      GLU  50  -7.353  10.200 -16.640

  No H/Q in entry =           6
  In of MODEL   68
    1    H    ALA  51           H        ALA  51  -4.594   9.070 -13.028
    2    HA   ALA  51           HA       ALA  51  -4.420   6.614 -14.436
    3    HB2  ALA  51           HB1      ALA  51  -2.435   6.358 -13.334
    4    HB1  ALA  51           HB2      ALA  51  -3.130   6.777 -11.769
    5    HB3  ALA  51           HB3      ALA  51  -2.691   8.049 -12.908

  No H/Q in entry =           5
  In of MODEL   68
    1    H    HIS  52           H        HIS  52  -5.605   7.443 -11.191
    2    HA   HIS  52           HA       HIS  52  -6.255   4.827 -10.349
    3    HB2  HIS  52           HB2      HIS  52  -6.143   6.795  -8.846
    4    HB3  HIS  52           HB3      HIS  52  -7.609   7.428  -9.597
    5    HD1  HIS  52           HD1      HIS  52  -9.840   6.142  -9.143
    6    HD2  HIS  52           HD2      HIS  52  -6.558   4.628  -7.067
    7    HE1  HIS  52           HE1      HIS  52 -10.767   4.573  -7.383
    8    HE2  HIS  52           HE2      HIS  52  -8.777   3.642  -6.109

  No H/Q in entry =           8
  In of MODEL   68
    1    H    LEU  53           H        LEU  53  -8.108   7.253 -12.148
    2    HA   LEU  53           HA       LEU  53 -10.595   5.927 -12.156
    3    HB2  LEU  53           HB2      LEU  53  -9.339   7.912 -14.042
    4    HB3  LEU  53           HB3      LEU  53 -10.935   7.231 -14.347
    5    HG   LEU  53           HG       LEU  53 -10.220   8.556 -11.712
    6   HD11  LEU  53          HD11      LEU  53 -11.325   9.754 -14.261
    7   HD13  LEU  53          HD12      LEU  53  -9.916  10.280 -13.338
    8   HD12  LEU  53          HD13      LEU  53 -11.537  10.514 -12.688
    9   HD23  LEU  53          HD21      LEU  53 -12.809   8.954 -11.870
   10   HD22  LEU  53          HD22      LEU  53 -12.223   7.362 -11.404
   11   HD21  LEU  53          HD23      LEU  53 -12.779   7.644 -13.042

  No H/Q in entry =          11
  In of MODEL   68
    1    H    VAL  54           H        VAL  54  -7.841   5.758 -14.391
    2    HA   VAL  54           HA       VAL  54  -9.039   3.963 -16.228
    3    HB   VAL  54           HB       VAL  54  -6.139   4.511 -15.546
    4   HG12  VAL  54          HG11      VAL  54  -5.876   3.420 -17.931
    5   HG11  VAL  54          HG12      VAL  54  -7.394   2.620 -17.525
    6   HG13  VAL  54          HG13      VAL  54  -5.976   2.389 -16.505
    7   HG22  VAL  54          HG21      VAL  54  -6.934   6.440 -16.599
    8   HG21  VAL  54          HG22      VAL  54  -8.115   5.557 -17.564
    9   HG23  VAL  54          HG23      VAL  54  -6.407   5.497 -17.994

  No H/Q in entry =           9
  In of MODEL   68
    1    H    GLN  55           H        GLN  55  -7.035   3.455 -13.325
    2    HA   GLN  55           HA       GLN  55  -6.909   0.639 -13.570
    3    HB2  GLN  55           HB2      GLN  55  -5.366   1.561 -12.054
    4    HB3  GLN  55           HB3      GLN  55  -6.595   2.514 -11.229
    5    HG2  GLN  55           HG2      GLN  55  -7.262   0.754  -9.905
    6    HG3  GLN  55           HG3      GLN  55  -7.021  -0.435 -11.178
    7   HE21  GLN  55          HE21      GLN  55  -5.379  -1.862 -10.677
    8   HE22  GLN  55          HE22      GLN  55  -4.000  -1.489  -9.766

  No H/Q in entry =           8
  In of MODEL   68
    1    H    THR  56           H        THR  56  -9.269   2.777 -11.966
    2    HA   THR  56           HA       THR  56 -10.829   0.879 -10.670
    3    HB   THR  56           HB       THR  56 -11.960   3.243 -12.187
    4    HG1  THR  56           HG1      THR  56 -10.541   3.067  -9.756
    5   HG23  THR  56          HG21      THR  56 -13.724   3.168 -10.616
    6   HG22  THR  56          HG22      THR  56 -12.819   2.120  -9.523
    7   HG21  THR  56          HG23      THR  56 -13.449   1.479 -11.041

  No H/Q in entry =           7
  In of MODEL   68
    1    H    LYS  57           H        LYS  57 -11.043   1.946 -14.060
    2    HA   LYS  57           HA       LYS  57 -13.177   0.228 -14.809
    3    HB2  LYS  57           HB2      LYS  57 -12.324   2.185 -16.133
    4    HB3  LYS  57           HB3      LYS  57 -10.873   1.262 -16.496
    5    HG2  LYS  57           HG2      LYS  57 -12.211  -0.439 -17.648
    6    HG3  LYS  57           HG3      LYS  57 -13.689   0.429 -17.251
    7    HD2  LYS  57           HD2      LYS  57 -12.898   2.372 -18.565
    8    HD3  LYS  57           HD3      LYS  57 -11.429   1.493 -18.979
    9    HE2  LYS  57           HE2      LYS  57 -12.767  -0.241 -20.116
   10    HE3  LYS  57           HE3      LYS  57 -14.256   0.598 -19.684
   11    HZ2  LYS  57           HZ1      LYS  57 -12.267   1.260 -21.698
   12    HZ1  LYS  57           HZ2      LYS  57 -12.939   2.570 -20.847
   13    HZ3  LYS  57           HZ3      LYS  57 -13.946   1.502 -21.705

  No H/Q in entry =          13
  In of MODEL   68
    1    H    LEU  58           H        LEU  58  -9.667  -0.158 -14.747
    2    HA   LEU  58           HA       LEU  58  -9.642  -2.680 -16.025
    3    HB2  LEU  58           HB2      LEU  58  -7.626  -1.355 -14.221
    4    HB3  LEU  58           HB3      LEU  58  -7.345  -2.877 -15.068
    5    HG   LEU  58           HG       LEU  58  -8.131  -0.288 -16.444
    6   HD11  LEU  58          HD11      LEU  58  -5.469  -1.488 -15.745
    7   HD13  LEU  58          HD12      LEU  58  -5.986   0.197 -15.704
    8   HD12  LEU  58          HD13      LEU  58  -5.635  -0.577 -17.246
    9   HD22  LEU  58          HD21      LEU  58  -8.685  -1.864 -18.028
   10   HD21  LEU  58          HD22      LEU  58  -7.629  -3.095 -17.341
   11   HD23  LEU  58          HD23      LEU  58  -6.953  -1.817 -18.351

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  59           H        ILE  59 -10.478  -1.775 -12.779
    2    HA   ILE  59           HA       ILE  59 -10.092  -4.533 -11.819
    3    HB   ILE  59           HB       ILE  59  -9.679  -2.254 -10.430
    4   HG12  ILE  59          HG12      ILE  59 -11.022  -4.602  -9.078
    5   HG13  ILE  59          HG13      ILE  59  -9.390  -4.692  -9.690
    6   HG21  ILE  59          HG21      ILE  59 -12.235  -1.794 -10.692
    7   HG23  ILE  59          HG22      ILE  59 -11.510  -1.566  -9.117
    8   HG22  ILE  59          HG23      ILE  59 -12.429  -3.027  -9.468
    9   HD12  ILE  59          HD11      ILE  59  -9.483  -4.068  -7.285
   10   HD11  ILE  59          HD12      ILE  59 -10.346  -2.602  -7.735
   11   HD13  ILE  59          HD13      ILE  59  -8.683  -2.848  -8.272

  No H/Q in entry =          11
  In of MODEL   68
    1    H    GLU  60           H        GLU  60 -12.679  -2.254 -12.640
    2    HA   GLU  60           HA       GLU  60 -14.845  -3.795 -11.622
    3    HB2  GLU  60           HB2      GLU  60 -15.089  -1.429 -12.227
    4    HB3  GLU  60           HB3      GLU  60 -14.758  -1.810 -13.914
    5    HG2  GLU  60           HG2      GLU  60 -16.774  -3.263 -13.965
    6    HG3  GLU  60           HG3      GLU  60 -17.121  -2.815 -12.307

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLY  61           H        GLY  61 -13.169  -3.771 -14.735
    2    HA3  GLY  61           HA2      GLY  61 -14.851  -6.042 -15.617
    3    HA2  GLY  61           HA3      GLY  61 -14.020  -4.931 -16.699

  No H/Q in entry =           3
  In of MODEL   68
    1    H    ASP  62           H        ASP  62 -12.627  -6.345 -13.807
    2    HA   ASP  62           HA       ASP  62 -10.376  -7.333 -15.296
    3    HB2  ASP  62           HB2      ASP  62  -9.584  -8.057 -13.063
    4    HB3  ASP  62           HB3      ASP  62 -10.087  -6.370 -13.073

  No H/Q in entry =           4
  In of MODEL   68
    1    H    ALA  63           H        ALA  63 -11.652  -8.857 -16.714
    2    HA   ALA  63           HA       ALA  63 -12.938 -11.182 -15.665
    3    HB1  ALA  63           HB1      ALA  63 -13.055 -10.196 -18.048
    4    HB2  ALA  63           HB2      ALA  63 -12.948 -11.951 -17.929
    5    HB3  ALA  63           HB3      ALA  63 -11.514 -11.004 -18.333

  No H/Q in entry =           5
  In of MODEL   68
    1    H    GLY  64           H        GLY  64  -9.642 -10.430 -16.609
    2    HA3  GLY  64           HA2      GLY  64  -7.652 -11.418 -15.965
    3    HA2  GLY  64           HA3      GLY  64  -8.569 -12.596 -15.035

  No H/Q in entry =           3
  In of MODEL   68
    1    H    GLU  65           H        GLU  65  -6.923 -14.101 -15.958
    2    HA   GLU  65           HA       GLU  65  -6.819 -14.629 -18.732
    3    HB2  GLU  65           HB2      GLU  65  -6.084 -16.333 -16.355
    4    HB3  GLU  65           HB3      GLU  65  -5.771 -16.799 -18.027
    5    HG2  GLU  65           HG2      GLU  65  -4.422 -14.795 -18.373
    6    HG3  GLU  65           HG3      GLU  65  -4.791 -14.236 -16.741

  No H/Q in entry =           6
  In of MODEL   68
    1    H    GLY  66           H        GLY  66  -8.726 -15.988 -16.157
    2    HA3  GLY  66           HA2      GLY  66 -10.271 -17.611 -18.070
    3    HA2  GLY  66           HA3      GLY  66 -10.057 -18.016 -16.379

  No H/Q in entry =           3
  In of MODEL   68
    1    H    LYS  67           H        LYS  67 -12.123 -18.085 -15.739
    2    HA   LYS  67           HA       LYS  67 -14.090 -16.167 -16.511
    3    HB2  LYS  67           HB2      LYS  67 -15.320 -17.474 -14.541
    4    HB3  LYS  67           HB3      LYS  67 -15.076 -18.189 -16.140
    5    HG2  LYS  67           HG2      LYS  67 -13.106 -19.357 -15.413
    6    HG3  LYS  67           HG3      LYS  67 -13.071 -18.473 -13.889
    7    HD2  LYS  67           HD2      LYS  67 -15.207 -19.535 -13.230
    8    HD3  LYS  67           HD3      LYS  67 -15.213 -20.439 -14.746
    9    HE2  LYS  67           HE2      LYS  67 -13.098 -21.524 -14.142
   10    HE3  LYS  67           HE3      LYS  67 -13.023 -20.581 -12.652
   11    HZ2  LYS  67           HZ1      LYS  67 -14.030 -22.987 -12.696
   12    HZ1  LYS  67           HZ2      LYS  67 -15.434 -22.157 -13.167
   13    HZ3  LYS  67           HZ3      LYS  67 -14.677 -21.784 -11.692

  No H/Q in entry =          13
  In of MODEL   68
    1    H    MET  68           H        MET  68 -13.818 -17.081 -13.193
    2    HA   MET  68           HA       MET  68 -14.507 -14.565 -12.147
    3    HB2  MET  68           HB2      MET  68 -13.387 -17.077 -10.933
    4    HB3  MET  68           HB3      MET  68 -13.733 -15.647  -9.960
    5    HG2  MET  68           HG2      MET  68 -16.064 -15.670 -10.695
    6    HG3  MET  68           HG3      MET  68 -15.736 -17.034 -11.766
    7    HE2  MET  68           HE1      MET  68 -16.010 -16.874  -7.231
    8    HE1  MET  68           HE2      MET  68 -15.892 -15.561  -8.401
    9    HE3  MET  68           HE3      MET  68 -14.440 -16.438  -7.922

  No H/Q in entry =           9
  In of MODEL   68
    1    H    LYS  69           H        LYS  69 -11.286 -16.096 -12.445
    2    HA   LYS  69           HA       LYS  69  -9.805 -14.456 -10.826
    3    HB2  LYS  69           HB2      LYS  69  -9.193 -15.993 -13.302
    4    HB3  LYS  69           HB3      LYS  69  -7.955 -14.908 -12.667
    5    HG2  LYS  69           HG2      LYS  69  -7.679 -17.129 -11.677
    6    HG3  LYS  69           HG3      LYS  69  -8.192 -15.991 -10.435
    7    HD2  LYS  69           HD2      LYS  69 -10.490 -16.776 -10.595
    8    HD3  LYS  69           HD3      LYS  69 -10.068 -17.831 -11.946
    9    HE2  LYS  69           HE2      LYS  69  -8.908 -18.039  -9.150
   10    HE3  LYS  69           HE3      LYS  69 -10.173 -19.079  -9.801
   11    HZ3  LYS  69           HZ1      LYS  69  -8.233 -20.265 -10.166
   12    HZ2  LYS  69           HZ2      LYS  69  -7.343 -18.889 -10.610
   13    HZ1  LYS  69           HZ3      LYS  69  -8.511 -19.528 -11.668

  No H/Q in entry =          13
  In of MODEL   68
    1    H    VAL  70           H        VAL  70  -7.896 -12.995 -11.734
    2    HA   VAL  70           HA       VAL  70  -9.033 -10.879 -13.467
    3    HB   VAL  70           HB       VAL  70  -7.976  -9.220 -11.945
    4   HG11  VAL  70          HG11      VAL  70 -10.405 -10.148 -11.767
    5   HG13  VAL  70          HG12      VAL  70  -9.772  -9.203 -10.419
    6   HG12  VAL  70          HG13      VAL  70  -9.819 -10.962 -10.317
    7   HG22  VAL  70          HG21      VAL  70  -6.249 -10.389 -10.819
    8   HG21  VAL  70          HG22      VAL  70  -7.311 -11.738 -10.423
    9   HG23  VAL  70          HG23      VAL  70  -7.479 -10.206  -9.568

  No H/Q in entry =           9
  In of MODEL   68
    1    H    SER  71           H        SER  71  -7.369  -9.453 -14.366
    2    HA   SER  71           HA       SER  71  -5.234 -10.863 -15.582
    3    HB2  SER  71           HB2      SER  71  -6.269  -8.841 -16.573
    4    HB3  SER  71           HB3      SER  71  -5.609  -7.873 -15.257
    5    HG   SER  71           HG       SER  71  -4.198  -9.364 -17.218

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LEU  72           H        LEU  72  -3.115 -11.074 -15.026
    2    HA   LEU  72           HA       LEU  72  -2.401 -10.838 -12.315
    3    HB2  LEU  72           HB2      LEU  72  -0.740 -11.259 -14.795
    4    HB3  LEU  72           HB3      LEU  72  -0.078 -11.313 -13.165
    5    HG   LEU  72           HG       LEU  72  -2.409 -13.041 -14.054
    6   HD12  LEU  72          HD11      LEU  72  -0.749 -14.866 -14.243
    7   HD11  LEU  72          HD12      LEU  72   0.546 -13.713 -13.922
    8   HD13  LEU  72          HD13      LEU  72  -0.414 -13.574 -15.395
    9   HD22  LEU  72          HD21      LEU  72  -2.399 -13.029 -11.701
   10   HD21  LEU  72          HD22      LEU  72  -0.650 -12.902 -11.600
   11   HD23  LEU  72          HD23      LEU  72  -1.396 -14.427 -12.070

  No H/Q in entry =          11
  In of MODEL   68
    1    H    VAL  73           H        VAL  73  -1.706  -8.826 -15.104
    2    HA   VAL  73           HA       VAL  73   0.192  -7.099 -14.007
    3    HB   VAL  73           HB       VAL  73  -0.167  -5.734 -15.885
    4   HG12  VAL  73          HG11      VAL  73  -1.220  -8.352 -16.927
    5   HG11  VAL  73          HG12      VAL  73   0.402  -8.261 -16.243
    6   HG13  VAL  73          HG13      VAL  73  -0.021  -7.276 -17.642
    7   HG22  VAL  73          HG21      VAL  73  -2.487  -5.194 -15.682
    8   HG21  VAL  73          HG22      VAL  73  -2.964  -6.882 -15.853
    9   HG23  VAL  73          HG23      VAL  73  -2.319  -6.003 -17.239

  No H/Q in entry =           9
  In of MODEL   68
    1    H    LEU  74           H        LEU  74  -3.204  -7.253 -13.452
    2    HA   LEU  74           HA       LEU  74  -3.855  -4.602 -12.854
    3    HB2  LEU  74           HB2      LEU  74  -5.564  -6.288 -13.021
    4    HB3  LEU  74           HB3      LEU  74  -4.863  -7.199 -11.686
    5    HG   LEU  74           HG       LEU  74  -5.343  -5.313 -10.154
    6   HD13  LEU  74          HD11      LEU  74  -5.273  -3.392 -11.547
    7   HD12  LEU  74          HD12      LEU  74  -6.975  -3.569 -11.126
    8   HD11  LEU  74          HD13      LEU  74  -6.399  -4.094 -12.710
    9   HD21  LEU  74          HD21      LEU  74  -7.003  -7.200 -10.938
   10   HD23  LEU  74          HD22      LEU  74  -7.861  -5.834 -11.618
   11   HD22  LEU  74          HD23      LEU  74  -7.559  -5.892  -9.898

  No H/Q in entry =          11
  In of MODEL   68
    1    H    VAL  75           H        VAL  75  -2.786  -7.166 -10.678
    2    HA   VAL  75           HA       VAL  75  -2.608  -5.601  -8.342
    3    HB   VAL  75           HB       VAL  75  -1.086  -8.084  -9.120
    4   HG11  VAL  75          HG11      VAL  75  -1.288  -6.586  -6.470
    5   HG13  VAL  75          HG12      VAL  75   0.170  -6.865  -7.411
    6   HG12  VAL  75          HG13      VAL  75  -0.645  -8.216  -6.641
    7   HG21  VAL  75          HG21      VAL  75  -3.510  -7.544  -7.366
    8   HG23  VAL  75          HG22      VAL  75  -2.729  -9.115  -7.545
    9   HG22  VAL  75          HG23      VAL  75  -3.526  -8.364  -8.928

  No H/Q in entry =           9
  In of MODEL   68
    1    H    GLU  76           H        GLU  76  -0.188  -6.345 -10.872
    2    HA   GLU  76           HA       GLU  76   1.980  -4.966  -9.718
    3    HB2  GLU  76           HB2      GLU  76   2.157  -6.459 -11.713
    4    HB3  GLU  76           HB3      GLU  76   1.299  -5.260 -12.666
    5    HG2  GLU  76           HG2      GLU  76   3.107  -3.636 -12.308
    6    HG3  GLU  76           HG3      GLU  76   3.976  -4.775 -11.295

  No H/Q in entry =           6
  In of MODEL   68
    1    H    ALA  77           H        ALA  77  -0.563  -3.805 -11.915
    2    HA   ALA  77           HA       ALA  77   0.395  -1.148 -12.103
    3    HB1  ALA  77           HB1      ALA  77  -1.385  -2.317 -13.543
    4    HB2  ALA  77           HB2      ALA  77  -1.681  -0.631 -13.117
    5    HB3  ALA  77           HB3      ALA  77  -2.519  -1.918 -12.252

  No H/Q in entry =           5
  In of MODEL   68
    1    H    GLN  78           H        GLN  78  -1.857  -2.721  -9.887
    2    HA   GLN  78           HA       GLN  78  -2.694  -0.405  -8.498
    3    HB2  GLN  78           HB2      GLN  78  -3.771  -2.684  -8.407
    4    HB3  GLN  78           HB3      GLN  78  -2.433  -3.212  -7.389
    5    HG2  GLN  78           HG2      GLN  78  -2.988  -1.468  -5.746
    6    HG3  GLN  78           HG3      GLN  78  -4.327  -0.933  -6.761
    7   HE21  GLN  78          HE21      GLN  78  -6.158  -1.599  -5.568
    8   HE22  GLN  78          HE22      GLN  78  -6.418  -3.194  -5.047

  No H/Q in entry =           8
  In of MODEL   68
    1    H    LEU  79           H        LEU  79   0.012  -2.625  -8.034
    2    HA   LEU  79           HA       LEU  79   0.973  -1.704  -5.580
    3    HB2  LEU  79           HB2      LEU  79   1.870  -3.707  -6.637
    4    HB3  LEU  79           HB3      LEU  79   2.506  -2.754  -7.974
    5    HG   LEU  79           HG       LEU  79   4.045  -1.587  -6.473
    6   HD13  LEU  79          HD11      LEU  79   3.034  -1.345  -4.409
    7   HD12  LEU  79          HD12      LEU  79   4.130  -2.679  -4.057
    8   HD11  LEU  79          HD13      LEU  79   2.429  -3.002  -4.388
    9   HD23  LEU  79          HD21      LEU  79   5.282  -3.715  -5.558
   10   HD22  LEU  79          HD22      LEU  79   5.078  -3.527  -7.297
   11   HD21  LEU  79          HD23      LEU  79   4.013  -4.607  -6.401

  No H/Q in entry =          11
  In of MODEL   68
    1    H    HIS  80           H        HIS  80   1.833  -0.592  -8.857
    2    HA   HIS  80           HA       HIS  80   3.614   1.423  -7.941
    3    HB2  HIS  80           HB2      HIS  80   2.337   0.700 -10.523
    4    HB3  HIS  80           HB3      HIS  80   2.910   2.360 -10.359
    5    HD1  HIS  80           HD1      HIS  80   5.308   2.690 -10.879
    6    HD2  HIS  80           HD2      HIS  80   4.539  -1.225  -9.670
    7    HE1  HIS  80           HE1      HIS  80   7.515   1.442 -11.036
    8    HE2  HIS  80           HE2      HIS  80   7.057  -0.948 -10.302

  No H/Q in entry =           8
  In of MODEL   68
    1    H    LEU  81           H        LEU  81   0.209   1.533  -8.927
    2    HA   LEU  81           HA       LEU  81  -0.104   4.323  -8.610
    3    HB2  LEU  81           HB2      LEU  81  -2.088   2.050  -8.523
    4    HB3  LEU  81           HB3      LEU  81  -2.564   3.748  -8.440
    5    HG   LEU  81           HG       LEU  81  -0.852   2.611 -10.668
    6   HD12  LEU  81          HD11      LEU  81  -3.086   2.893 -11.972
    7   HD11  LEU  81          HD12      LEU  81  -3.843   2.822 -10.381
    8   HD13  LEU  81          HD13      LEU  81  -2.881   1.465 -10.960
    9   HD23  LEU  81          HD21      LEU  81  -1.977   4.734 -11.777
   10   HD22  LEU  81          HD22      LEU  81  -0.564   4.929 -10.742
   11   HD21  LEU  81          HD23      LEU  81  -2.175   5.258 -10.106

  No H/Q in entry =          11
  In of MODEL   68
    1    H    MET  82           H        MET  82  -0.730   1.638  -6.349
    2    HA   MET  82           HA       MET  82  -1.807   3.219  -4.271
    3    HB2  MET  82           HB2      MET  82  -0.396   0.551  -4.296
    4    HB3  MET  82           HB3      MET  82  -0.987   1.275  -2.802
    5    HG2  MET  82           HG2      MET  82  -2.708   0.746  -5.244
    6    HG3  MET  82           HG3      MET  82  -2.617  -0.320  -3.843
    7    HE3  MET  82           HE1      MET  82  -4.368   1.317  -1.039
    8    HE2  MET  82           HE2      MET  82  -2.642   1.619  -1.222
    9    HE1  MET  82           HE3      MET  82  -3.306   0.050  -1.670

  No H/Q in entry =           9
  In of MODEL   68
    1    H    THR  83           H        THR  83   1.510   2.177  -4.951
    2    HA   THR  83           HA       THR  83   2.708   3.309  -2.653
    3    HB   THR  83           HB       THR  83   4.805   3.277  -4.124
    4    HG1  THR  83           HG1      THR  83   4.577   2.738  -6.145
    5   HG22  THR  83          HG21      THR  83   4.400   0.611  -4.444
    6   HG21  THR  83          HG22      THR  83   3.103   0.978  -3.308
    7   HG23  THR  83          HG23      THR  83   4.777   1.347  -2.887

  No H/Q in entry =           7
  In of MODEL   68
    1    H    SER  84           H        SER  84   2.324   4.568  -5.960
    2    HA   SER  84           HA       SER  84   3.627   7.029  -5.514
    3    HB2  SER  84           HB2      SER  84   1.573   6.158  -7.533
    4    HB3  SER  84           HB3      SER  84   2.227   7.795  -7.514
    5    HG   SER  84           HG       SER  84   3.636   5.339  -7.792

  No H/Q in entry =           5
  In of MODEL   68
    1    H    MET  85           H        MET  85   0.144   6.224  -5.344
    2    HA   MET  85           HA       MET  85  -0.755   8.824  -4.756
    3    HB2  MET  85           HB2      MET  85  -2.256   7.000  -5.420
    4    HB3  MET  85           HB3      MET  85  -1.950   6.191  -3.883
    5    HG2  MET  85           HG2      MET  85  -2.870   8.124  -2.666
    6    HG3  MET  85           HG3      MET  85  -3.144   8.961  -4.193
    7    HE1  MET  85           HE1      MET  85  -5.348   9.389  -3.280
    8    HE3  MET  85           HE2      MET  85  -5.686   8.243  -1.985
    9    HE2  MET  85           HE3      MET  85  -6.745   8.310  -3.392

  No H/Q in entry =           9
  In of MODEL   68
    1    H    LEU  86           H        LEU  86   0.198   6.185  -2.599
    2    HA   LEU  86           HA       LEU  86  -0.357   7.491  -0.164
    3    HB2  LEU  86           HB2      LEU  86   0.142   5.025  -0.546
    4    HB3  LEU  86           HB3      LEU  86   1.843   5.478  -0.640
    5    HG   LEU  86           HG       LEU  86   1.499   6.644   1.622
    6   HD11  LEU  86          HD11      LEU  86  -1.184   5.839   1.150
    7   HD13  LEU  86          HD12      LEU  86  -0.530   6.602   2.598
    8   HD12  LEU  86          HD13      LEU  86  -0.597   4.844   2.487
    9   HD23  LEU  86          HD21      LEU  86   1.111   3.647   1.757
   10   HD22  LEU  86          HD22      LEU  86   2.098   4.674   2.794
   11   HD21  LEU  86          HD23      LEU  86   2.606   4.349   1.137

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ALA  87           H        ALA  87   2.631   7.228  -2.048
    2    HA   ALA  87           HA       ALA  87   4.315   8.668  -0.326
    3    HB3  ALA  87           HB1      ALA  87   4.428   7.645  -3.029
    4    HB2  ALA  87           HB2      ALA  87   5.756   7.998  -1.928
    5    HB1  ALA  87           HB3      ALA  87   5.126   9.266  -2.978

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ARG  88           H        ARG  88   2.357   9.767  -3.055
    2    HA   ARG  88           HA       ARG  88   3.097  12.467  -2.948
    3    HB2  ARG  88           HB2      ARG  88   1.860  11.291  -4.802
    4    HB3  ARG  88           HB3      ARG  88   0.400  11.420  -3.822
    5    HG2  ARG  88           HG2      ARG  88   1.387  14.013  -3.748
    6    HG3  ARG  88           HG3      ARG  88   1.820  13.497  -5.376
    7    HD2  ARG  88           HD2      ARG  88  -0.321  13.548  -6.077
    8    HD3  ARG  88           HD3      ARG  88  -0.900  12.693  -4.646
    9    HE   ARG  88           HE       ARG  88  -1.123  15.467  -5.076
   10   HH21  ARG  88          HH11      ARG  88  -1.669  16.797  -3.344
   11   HH22  ARG  88          HH12      ARG  88  -1.368  16.270  -1.724
   12   HH11  ARG  88          HH21      ARG  88  -0.083  13.227  -2.691
   13   HH12  ARG  88          HH22      ARG  88  -0.488  14.243  -1.354

  No H/Q in entry =          13
  In of MODEL   68
    1    H    GLU  89           H        GLU  89   0.412  10.767  -1.305
    2    HA   GLU  89           HA       GLU  89  -0.725  13.070  -0.111
    3    HB2  GLU  89           HB2      GLU  89  -1.816  10.817  -0.190
    4    HB3  GLU  89           HB3      GLU  89  -0.687  10.280   1.055
    5    HG2  GLU  89           HG2      GLU  89  -1.529  11.976   2.606
    6    HG3  GLU  89           HG3      GLU  89  -2.588  12.629   1.359

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LEU  90           H        LEU  90   1.752  10.812   1.076
    2    HA   LEU  90           HA       LEU  90   2.090  12.071   3.601
    3    HB2  LEU  90           HB2      LEU  90   3.886  10.310   1.933
    4    HB3  LEU  90           HB3      LEU  90   4.297  10.838   3.570
    5    HG   LEU  90           HG       LEU  90   1.679   9.460   2.911
    6   HD12  LEU  90          HD11      LEU  90   2.841   7.431   3.929
    7   HD11  LEU  90          HD12      LEU  90   4.354   8.304   3.686
    8   HD13  LEU  90          HD13      LEU  90   3.348   7.879   2.299
    9   HD22  LEU  90          HD21      LEU  90   1.401  10.389   5.029
   10   HD21  LEU  90          HD22      LEU  90   3.120  10.303   5.414
   11   HD23  LEU  90          HD23      LEU  90   2.130   8.844   5.467

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  91           H        ILE  91   3.693  12.459   0.474
    2    HA   ILE  91           HA       ILE  91   5.648  14.315   1.308
    3    HB   ILE  91           HB       ILE  91   4.345  13.799  -1.371
    4   HG12  ILE  91          HG12      ILE  91   7.182  13.347  -0.392
    5   HG13  ILE  91          HG13      ILE  91   5.913  12.136  -0.226
    6   HG22  ILE  91          HG21      ILE  91   6.554  15.168  -2.063
    7   HG21  ILE  91          HG22      ILE  91   6.233  15.971  -0.525
    8   HG23  ILE  91          HG23      ILE  91   5.012  15.981  -1.795
    9   HD13  ILE  91          HD11      ILE  91   5.746  11.802  -2.532
   10   HD12  ILE  91          HD12      ILE  91   7.478  12.065  -2.317
   11   HD11  ILE  91          HD13      ILE  91   6.454  13.374  -2.910

  No H/Q in entry =          11
  In of MODEL   68
    1    H    THR  92           H        THR  92   2.283  14.707   0.295
    2    HA   THR  92           HA       THR  92   2.226  17.530   0.223
    3    HB   THR  92           HB       THR  92   0.080  15.514   0.928
    4    HG1  THR  92           HG1      THR  92   0.389  15.331  -1.156
    5   HG22  THR  92          HG21      THR  92  -1.344  17.658   0.196
    6   HG21  THR  92          HG22      THR  92   0.039  18.501   0.891
    7   HG23  THR  92          HG23      THR  92  -0.892  17.374   1.876

  No H/Q in entry =           7
  In of MODEL   68
    1    H    GLU  93           H        GLU  93   1.700  15.234   2.885
    2    HA   GLU  93           HA       GLU  93   1.145  17.140   4.896
    3    HB2  GLU  93           HB2      GLU  93   2.487  14.431   5.144
    4    HB3  GLU  93           HB3      GLU  93   1.784  15.356   6.472
    5    HG2  GLU  93           HG2      GLU  93   0.183  14.551   4.035
    6    HG3  GLU  93           HG3      GLU  93   0.294  13.535   5.467

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LEU  94           H        LEU  94   4.168  15.686   3.755
    2    HA   LEU  94           HA       LEU  94   5.904  16.859   5.641
    3    HB2  LEU  94           HB2      LEU  94   6.320  15.885   2.814
    4    HB3  LEU  94           HB3      LEU  94   7.641  16.561   3.762
    5    HG   LEU  94           HG       LEU  94   5.923  14.351   4.904
    6   HD11  LEU  94          HD11      LEU  94   8.024  14.139   2.776
    7   HD13  LEU  94          HD12      LEU  94   6.588  13.151   3.040
    8   HD12  LEU  94          HD13      LEU  94   8.015  12.917   4.050
    9   HD23  LEU  94          HD21      LEU  94   8.117  13.842   6.061
   10   HD22  LEU  94          HD22      LEU  94   7.433  15.415   6.471
   11   HD21  LEU  94          HD23      LEU  94   8.774  15.304   5.330

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  95           H        ILE  95   4.756  18.006   2.485
    2    HA   ILE  95           HA       ILE  95   6.304  20.380   2.418
    3    HB   ILE  95           HB       ILE  95   3.668  19.663   1.112
    4   HG12  ILE  95          HG12      ILE  95   6.455  20.025  -0.023
    5   HG13  ILE  95          HG13      ILE  95   5.821  18.467   0.497
    6   HG21  ILE  95          HG21      ILE  95   5.392  22.148   0.884
    7   HG23  ILE  95          HG22      ILE  95   3.667  22.063   1.238
    8   HG22  ILE  95          HG23      ILE  95   4.257  21.662  -0.376
    9   HD13  ILE  95          HD11      ILE  95   4.265  18.368  -1.233
   10   HD12  ILE  95          HD12      ILE  95   5.606  19.197  -2.023
   11   HD11  ILE  95          HD13      ILE  95   4.223  20.120  -1.436

  No H/Q in entry =          11
  In of MODEL   68
    1    H    GLU  96           H        GLU  96   3.060  19.699   3.712
    2    HA   GLU  96           HA       GLU  96   2.411  22.342   4.452
    3    HB2  GLU  96           HB2      GLU  96   0.756  20.542   4.468
    4    HB3  GLU  96           HB3      GLU  96   1.624  19.729   5.768
    5    HG2  GLU  96           HG2      GLU  96   0.589  21.008   7.331
    6    HG3  GLU  96           HG3      GLU  96   1.110  22.484   6.529

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LEU  97           H        LEU  97   4.279  19.817   6.089
    2    HA   LEU  97           HA       LEU  97   4.619  21.179   8.555
    3    HB2  LEU  97           HB2      LEU  97   6.180  19.021   7.151
    4    HB3  LEU  97           HB3      LEU  97   6.761  19.718   8.661
    5    HG   LEU  97           HG       LEU  97   3.963  18.594   8.351
    6   HD12  LEU  97          HD11      LEU  97   4.922  16.596   9.573
    7   HD11  LEU  97          HD12      LEU  97   6.528  17.242   9.229
    8   HD13  LEU  97          HD13      LEU  97   5.464  16.768   7.904
    9   HD23  LEU  97          HD21      LEU  97   4.416  18.315  10.918
   10   HD22  LEU  97          HD22      LEU  97   4.020  19.920  10.306
   11   HD21  LEU  97          HD23      LEU  97   5.696  19.499  10.655

  No H/Q in entry =          11
  In of MODEL   68
    1    H    HIS  98           H        HIS  98   6.493  21.202   5.532
    2    HA   HIS  98           HA       HIS  98   8.630  22.807   6.427
    3    HB2  HIS  98           HB2      HIS  98   7.343  22.528   3.700
    4    HB3  HIS  98           HB3      HIS  98   8.772  23.522   3.989
    5    HD1  HIS  98           HD1      HIS  98   7.597  19.940   4.021
    6    HD2  HIS  98           HD2      HIS  98  11.156  22.073   4.442
    7    HE1  HIS  98           HE1      HIS  98   9.468  18.228   3.974
    8    HE2  HIS  98           HE2      HIS  98  11.640  19.507   4.230

  No H/Q in entry =           8
  In of MODEL   68
    1    H    GLU  99           H        GLU  99   5.402  23.605   5.244
    2    HA   GLU  99           HA       GLU  99   5.754  26.423   5.176
    3    HB2  GLU  99           HB2      GLU  99   3.887  25.231   4.047
    4    HB3  GLU  99           HB3      GLU  99   3.193  24.869   5.627
    5    HG2  GLU  99           HG2      GLU  99   2.989  27.261   6.118
    6    HG3  GLU  99           HG3      GLU  99   3.763  27.663   4.588

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LYS 100           H        LYS 100   4.642  24.187   7.705
    2    HA   LYS 100           HA       LYS 100   4.033  26.243   9.590
    3    HB2  LYS 100           HB2      LYS 100   4.636  23.299   9.948
    4    HB3  LYS 100           HB3      LYS 100   4.177  24.372  11.276
    5    HG2  LYS 100           HG2      LYS 100   2.107  24.985  10.023
    6    HG3  LYS 100           HG3      LYS 100   2.546  23.815   8.775
    7    HD2  LYS 100           HD2      LYS 100   2.484  22.001  10.444
    8    HD3  LYS 100           HD3      LYS 100   2.061  23.164  11.702
    9    HE2  LYS 100           HE2      LYS 100   0.004  23.761  10.434
   10    HE3  LYS 100           HE3      LYS 100   0.417  22.540   9.224
   11    HZ1  LYS 100           HZ1      LYS 100   0.154  21.882  12.107
   12    HZ3  LYS 100           HZ2      LYS 100   0.150  20.823  10.776
   13    HZ2  LYS 100           HZ3      LYS 100  -1.175  21.851  11.050

  No H/Q in entry =          13
  In of MODEL   68
    1    H    LEU 101           H        LEU 101   6.974  24.472   8.767
    2    HA   LEU 101           HA       LEU 101   8.562  25.336  10.969
    3    HB2  LEU 101           HB2      LEU 101   9.169  24.344   8.196
    4    HB3  LEU 101           HB3      LEU 101  10.464  25.025   9.176
    5    HG   LEU 101           HG       LEU 101   8.651  22.856  10.246
    6   HD12  LEU 101          HD11      LEU 101  10.719  21.378   9.646
    7   HD11  LEU 101          HD12      LEU 101  11.076  22.640   8.469
    8   HD13  LEU 101          HD13      LEU 101   9.556  21.752   8.377
    9   HD21  LEU 101          HD21      LEU 101  11.364  23.992  10.973
   10   HD23  LEU 101          HD22      LEU 101  10.834  22.417  11.558
   11   HD22  LEU 101          HD23      LEU 101   9.928  23.867  11.989

  No H/Q in entry =          11
  In of MODEL   68
    1    H    LYS 102           H        LYS 102   6.964  27.176   8.819
    2    HA   LYS 102           HA       LYS 102   7.021  29.469   8.518
    3    HB2  LYS 102           HB2      LYS 102   8.584  29.376  10.619
    4    HB3  LYS 102           HB3      LYS 102   9.883  29.578   9.460
    5    HG2  LYS 102           HG2      LYS 102   7.759  31.515  10.312
    6    HG3  LYS 102           HG3      LYS 102   9.469  31.789  10.061
    7    HD2  LYS 102           HD2      LYS 102   7.525  31.339   7.761
    8    HD3  LYS 102           HD3      LYS 102   7.892  32.925   8.423
    9    HE2  LYS 102           HE2      LYS 102   9.279  31.745   6.356
   10    HE3  LYS 102           HE3      LYS 102   9.882  33.061   7.363
   11    HZ2  LYS 102           HZ1      LYS 102  11.420  31.170   7.197
   12    HZ1  LYS 102           HZ2      LYS 102  10.266  30.180   7.942
   13    HZ3  LYS 102           HZ3      LYS 102  10.945  31.476   8.797

  No H/Q in entry =          13
  In of MODEL   68
    1    H    ALA 103           H        ALA 103  10.291  28.157   7.963
    2    HA   ALA 103           HA       ALA 103  11.245  29.534   5.883
    3    HB2  ALA 103           HB1      ALA 103  12.151  27.325   4.965
    4    HB1  ALA 103           HB2      ALA 103  11.261  26.547   6.273
    5    HB3  ALA 103           HB3      ALA 103  12.540  27.705   6.643

  No H/Q in entry =           5
  In of MODEL   68
    1    H1   LYS   3           H1       LYS   3 -31.075   6.695 -19.474
    2    H2   LYS   3           H3       LYS   3 -30.090   6.423 -20.830
    3    H3   LYS   3           H2       LYS   3 -31.501   5.505 -20.608
    4    HA   LYS   3           HA       LYS   3 -30.523   4.065 -19.238
    5    HB2  LYS   3           HB2      LYS   3 -28.217   5.471 -20.533
    6    HB3  LYS   3           HB3      LYS   3 -27.913   4.227 -19.321
    7    HG2  LYS   3           HG2      LYS   3 -29.361   2.699 -20.711
    8    HG3  LYS   3           HG3      LYS   3 -29.294   3.930 -21.971
    9    HD2  LYS   3           HD2      LYS   3 -26.813   3.773 -21.922
   10    HD3  LYS   3           HD3      LYS   3 -26.955   2.448 -20.768
   11    HE2  LYS   3           HE2      LYS   3 -28.473   1.341 -22.513
   12    HE3  LYS   3           HE3      LYS   3 -27.832   2.536 -23.639
   13    HZ3  LYS   3           HZ1      LYS   3 -26.054   1.284 -23.938
   14    HZ2  LYS   3           HZ2      LYS   3 -26.705   0.101 -22.908
   15    HZ1  LYS   3           HZ3      LYS   3 -25.695   1.313 -22.279

  No H/Q in entry =          15
  In of MODEL   68
    1    H    LYS   4           H        LYS   4 -30.580   3.873 -17.181
    2    HA   LYS   4           HA       LYS   4 -29.812   6.104 -15.474
    3    HB2  LYS   4           HB2      LYS   4 -31.061   3.417 -14.842
    4    HB3  LYS   4           HB3      LYS   4 -30.817   4.723 -13.682
    5    HG2  LYS   4           HG2      LYS   4 -32.623   4.754 -16.106
    6    HG3  LYS   4           HG3      LYS   4 -33.115   4.770 -14.413
    7    HD2  LYS   4           HD2      LYS   4 -32.379   6.973 -14.091
    8    HD3  LYS   4           HD3      LYS   4 -31.340   6.931 -15.515
    9    HE2  LYS   4           HE2      LYS   4 -33.240   8.350 -15.944
   10    HE3  LYS   4           HE3      LYS   4 -33.345   6.904 -16.949
   11    HZ3  LYS   4           HZ1      LYS   4 -34.939   5.982 -15.425
   12    HZ2  LYS   4           HZ2      LYS   4 -35.466   7.502 -15.973
   13    HZ1  LYS   4           HZ3      LYS   4 -34.813   7.340 -14.413

  No H/Q in entry =          13
  In of MODEL   68
    1    H    HIS   5           H        HIS   5 -28.342   6.123 -13.881
    2    HA   HIS   5           HA       HIS   5 -26.094   4.261 -14.256
    3    HB2  HIS   5           HB2      HIS   5 -26.298   6.989 -12.982
    4    HB3  HIS   5           HB3      HIS   5 -24.835   6.007 -12.988
    5    HD1  HIS   5           HD1      HIS   5 -23.341   7.217 -14.547
    6    HD2  HIS   5           HD2      HIS   5 -27.152   6.708 -16.117
    7    HE1  HIS   5           HE1      HIS   5 -23.161   7.855 -16.982
    8    HE2  HIS   5           HE2      HIS   5 -25.484   7.531 -17.909

  No H/Q in entry =           8
  In of MODEL   68
    1    H    ILE   6           H        ILE   6 -25.897   2.652 -12.979
    2    HA   ILE   6           HA       ILE   6 -26.869   2.870 -10.209
    3    HB   ILE   6           HB       ILE   6 -26.091   0.427 -11.807
    4   HG12  ILE   6          HG12      ILE   6 -28.817   1.396 -10.933
    5   HG13  ILE   6          HG13      ILE   6 -28.170   1.586 -12.563
    6   HG23  ILE   6          HG21      ILE   6 -26.491  -0.863  -9.978
    7   HG22  ILE   6          HG22      ILE   6 -27.625   0.288  -9.271
    8   HG21  ILE   6          HG23      ILE   6 -25.890   0.588  -9.173
    9   HD13  ILE   6          HD11      ILE   6 -28.671  -0.511 -13.116
   10   HD12  ILE   6          HD12      ILE   6 -29.687  -0.510 -11.674
   11   HD11  ILE   6          HD13      ILE   6 -28.046  -1.152 -11.596

  No H/Q in entry =          11
  In of MODEL   68
    1    H    TYR   7           H        TYR   7 -25.098   3.445  -8.906
    2    HA   TYR   7           HA       TYR   7 -22.407   2.451  -9.608
    3    HB2  TYR   7           HB2      TYR   7 -23.323   4.866  -8.068
    4    HB3  TYR   7           HB3      TYR   7 -21.648   4.319  -8.118
    5    HD1  TYR   7           HD1      TYR   7 -22.705   3.473 -11.232
    6    HD2  TYR   7           HD2      TYR   7 -21.964   6.976  -8.917
    7    HE1  TYR   7           HE1      TYR   7 -22.247   4.746 -13.292
    8    HE2  TYR   7           HE2      TYR   7 -21.549   8.254 -10.970
    9    HH   TYR   7           HH       TYR   7 -21.767   8.227 -13.204

  No H/Q in entry =           9
  In of MODEL   68
    1    H    LEU   8           H        LEU   8 -21.469   1.047  -8.312
    2    HA   LEU   8           HA       LEU   8 -22.612   0.510  -5.643
    3    HB2  LEU   8           HB2      LEU   8 -20.942  -1.143  -7.516
    4    HB3  LEU   8           HB3      LEU   8 -21.136  -1.562  -5.815
    5    HG   LEU   8           HG       LEU   8 -23.619  -1.674  -6.242
    6   HD13  LEU   8          HD11      LEU   8 -23.723  -0.404  -8.322
    7   HD12  LEU   8          HD12      LEU   8 -24.287  -2.051  -8.602
    8   HD11  LEU   8          HD13      LEU   8 -22.669  -1.573  -9.115
    9   HD23  LEU   8          HD21      LEU   8 -22.385  -3.699  -7.985
   10   HD22  LEU   8          HD22      LEU   8 -23.476  -3.878  -6.613
   11   HD21  LEU   8          HD23      LEU   8 -21.763  -3.565  -6.341

  No H/Q in entry =          11
  In of MODEL   68
    1    H    PHE   9           H        PHE   9 -21.334   0.835  -3.850
    2    HA   PHE   9           HA       PHE   9 -18.531   1.727  -4.342
    3    HB2  PHE   9           HB2      PHE   9 -20.488   2.779  -2.300
    4    HB3  PHE   9           HB3      PHE   9 -18.784   3.207  -2.373
    5    HD1  PHE   9           HD1      PHE   9 -17.905   4.606  -4.147
    6    HD2  PHE   9           HD2      PHE   9 -22.062   3.547  -4.037
    7    HE1  PHE   9           HE1      PHE   9 -18.387   6.318  -5.870
    8    HE2  PHE   9           HE2      PHE   9 -22.545   5.272  -5.755
    9    HZ   PHE   9           HZ       PHE   9 -20.706   6.653  -6.677

  No H/Q in entry =           9
  In of MODEL   68
    1    H    SER  10           H        SER  10 -16.979   0.692  -3.287
    2    HA   SER  10           HA       SER  10 -17.176  -0.257  -0.608
    3    HB2  SER  10           HB2      SER  10 -18.455  -2.058  -1.759
    4    HB3  SER  10           HB3      SER  10 -17.051  -2.357  -2.773
    5    HG   SER  10           HG       SER  10 -16.580  -3.673  -1.199

  No H/Q in entry =           5
  In of MODEL   68
    1    H    SER  11           H        SER  11 -15.160  -0.177   0.200
    2    HA   SER  11           HA       SER  11 -12.977   0.675  -1.321
    3    HB2  SER  11           HB2      SER  11 -11.787   0.675   0.653
    4    HB3  SER  11           HB3      SER  11 -13.446   0.712   1.252
    5    HG   SER  11           HG       SER  11 -13.191  -1.709   1.155

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ALA  12           H        ALA  12 -14.231  -2.019  -2.160
    2    HA   ALA  12           HA       ALA  12 -11.652  -3.237  -2.769
    3    HB3  ALA  12           HB1      ALA  12 -12.707  -5.544  -2.242
    4    HB1  ALA  12           HB2      ALA  12 -13.813  -4.634  -1.213
    5    HB2  ALA  12           HB3      ALA  12 -12.079  -4.581  -0.902

  No H/Q in entry =           5
  In of MODEL   68
    1    H    GLY  13           H        GLY  13 -12.341  -2.228  -4.784
    2    HA3  GLY  13           HA2      GLY  13 -14.607  -2.788  -6.274
    3    HA2  GLY  13           HA3      GLY  13 -13.032  -2.404  -6.982

  No H/Q in entry =           3
  In of MODEL   68
    1    H    MET  14           H        MET  14 -11.606  -4.739  -6.167
    2    HA   MET  14           HA       MET  14 -12.144  -6.457  -8.274
    3    HB2  MET  14           HB2      MET  14 -10.031  -6.603  -7.048
    4    HB3  MET  14           HB3      MET  14 -10.858  -7.278  -5.645
    5    HG2  MET  14           HG2      MET  14 -11.553  -9.226  -7.020
    6    HG3  MET  14           HG3      MET  14 -10.700  -8.544  -8.405
    7    HE3  MET  14           HE1      MET  14  -7.102  -8.803  -7.799
    8    HE2  MET  14           HE2      MET  14  -7.891  -7.367  -7.150
    9    HE1  MET  14           HE3      MET  14  -8.479  -8.084  -8.647

  No H/Q in entry =           9
  In of MODEL   68
    1    H    SER  15           H        SER  15 -13.290  -6.902  -4.925
    2    HA   SER  15           HA       SER  15 -14.693  -9.328  -5.595
    3    HB2  SER  15           HB2      SER  15 -15.038  -7.545  -3.169
    4    HB3  SER  15           HB3      SER  15 -15.849  -9.090  -3.412
    5    HG   SER  15           HG       SER  15 -13.859 -10.109  -3.439

  No H/Q in entry =           5
  In of MODEL   68
    1    H    THR  16           H        THR  16 -15.734  -5.933  -5.144
    2    HA   THR  16           HA       THR  16 -18.530  -6.398  -5.676
    3    HB   THR  16           HB       THR  16 -16.949  -3.843  -6.133
    4    HG1  THR  16           HG1      THR  16 -18.023  -3.621  -3.851
    5   HG22  THR  16          HG21      THR  16 -19.812  -4.236  -5.251
    6   HG21  THR  16          HG22      THR  16 -19.350  -4.039  -6.951
    7   HG23  THR  16          HG23      THR  16 -19.045  -2.745  -5.784

  No H/Q in entry =           7
  In of MODEL   68
    1    H    SER  17           H        SER  17 -15.694  -5.843  -7.521
    2    HA   SER  17           HA       SER  17 -16.803  -5.020 -10.006
    3    HB2  SER  17           HB2      SER  17 -14.203  -6.421  -9.344
    4    HB3  SER  17           HB3      SER  17 -14.634  -5.906 -10.975
    5    HG   SER  17           HG       SER  17 -13.621  -4.466  -8.954

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LEU  18           H        LEU  18 -16.298  -8.210  -8.633
    2    HA   LEU  18           HA       LEU  18 -16.908  -9.641 -11.025
    3    HB2  LEU  18           HB2      LEU  18 -15.712 -10.688  -9.167
    4    HB3  LEU  18           HB3      LEU  18 -17.113 -10.459  -8.122
    5    HG   LEU  18           HG       LEU  18 -18.426 -11.914  -9.682
    6   HD11  LEU  18          HD11      LEU  18 -15.699 -12.148 -10.941
    7   HD13  LEU  18          HD12      LEU  18 -17.242 -11.799 -11.720
    8   HD12  LEU  18          HD13      LEU  18 -16.906 -13.420 -11.114
    9   HD21  LEU  18          HD21      LEU  18 -17.367 -12.677  -7.574
   10   HD23  LEU  18          HD22      LEU  18 -15.998 -13.248  -8.531
   11   HD22  LEU  18          HD23      LEU  18 -17.599 -13.943  -8.782

  No H/Q in entry =          11
  In of MODEL   68
    1    H    LEU  19           H        LEU  19 -18.859  -8.461  -8.288
    2    HA   LEU  19           HA       LEU  19 -21.342  -9.576  -9.153
    3    HB2  LEU  19           HB2      LEU  19 -21.072  -8.807  -6.882
    4    HB3  LEU  19           HB3      LEU  19 -20.738  -7.169  -7.442
    5    HG   LEU  19           HG       LEU  19 -23.058  -6.922  -8.154
    6   HD11  LEU  19          HD11      LEU  19 -23.392  -9.712  -7.038
    7   HD13  LEU  19          HD12      LEU  19 -23.569  -9.235  -8.725
    8   HD12  LEU  19          HD13      LEU  19 -24.712  -8.647  -7.519
    9   HD22  LEU  19          HD21      LEU  19 -24.047  -6.844  -5.939
   10   HD21  LEU  19          HD22      LEU  19 -22.371  -6.296  -5.894
   11   HD23  LEU  19          HD23      LEU  19 -22.786  -7.912  -5.322

  No H/Q in entry =          11
  In of MODEL   68
    1    H    VAL  20           H        VAL  20 -19.785  -6.429  -9.768
    2    HA   VAL  20           HA       VAL  20 -21.873  -5.309 -11.314
    3    HB   VAL  20           HB       VAL  20 -18.874  -4.772 -11.417
    4   HG12  VAL  20          HG11      VAL  20 -19.513  -2.669 -12.626
    5   HG11  VAL  20          HG12      VAL  20 -21.141  -3.323 -12.807
    6   HG13  VAL  20          HG13      VAL  20 -19.776  -4.134 -13.572
    7   HG21  VAL  20          HG21      VAL  20 -21.194  -3.495 -10.029
    8   HG23  VAL  20          HG22      VAL  20 -19.728  -2.583 -10.379
    9   HG22  VAL  20          HG23      VAL  20 -19.647  -4.022  -9.364

  No H/Q in entry =           9
  In of MODEL   68
    1    H    SER  21           H        SER  21 -19.154  -7.387 -12.388
    2    HA   SER  21           HA       SER  21 -19.931  -7.193 -15.136
    3    HB2  SER  21           HB2      SER  21 -18.533  -9.181 -15.514
    4    HB3  SER  21           HB3      SER  21 -17.681  -7.971 -14.557
    5    HG   SER  21           HG       SER  21 -17.562  -9.320 -12.990

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LYS  22           H        LYS  22 -21.043  -9.420 -12.620
    2    HA   LYS  22           HA       LYS  22 -22.610 -10.964 -14.483
    3    HB2  LYS  22           HB2      LYS  22 -22.898 -10.678 -11.488
    4    HB3  LYS  22           HB3      LYS  22 -23.731 -11.866 -12.490
    5    HG2  LYS  22           HG2      LYS  22 -20.738 -11.717 -12.168
    6    HG3  LYS  22           HG3      LYS  22 -21.792 -12.778 -11.234
    7    HD2  LYS  22           HD2      LYS  22 -22.531 -13.850 -13.333
    8    HD3  LYS  22           HD3      LYS  22 -21.411 -12.822 -14.230
    9    HE2  LYS  22           HE2      LYS  22 -20.557 -14.738 -12.053
   10    HE3  LYS  22           HE3      LYS  22 -20.575 -15.152 -13.768
   11    HZ1  LYS  22           HZ1      LYS  22 -19.151 -12.727 -13.160
   12    HZ3  LYS  22           HZ2      LYS  22 -18.696 -14.048 -14.127
   13    HZ2  LYS  22           HZ3      LYS  22 -18.479 -14.113 -12.444

  No H/Q in entry =          13
  In of MODEL   68
    1    H    MET  23           H        MET  23 -23.278  -8.075 -12.544
    2    HA   MET  23           HA       MET  23 -26.085  -8.084 -13.056
    3    HB2  MET  23           HB2      MET  23 -24.193  -5.829 -12.425
    4    HB3  MET  23           HB3      MET  23 -25.934  -5.620 -12.601
    5    HG2  MET  23           HG2      MET  23 -26.356  -6.963 -10.666
    6    HG3  MET  23           HG3      MET  23 -24.655  -7.412 -10.547
    7    HE2  MET  23           HE1      MET  23 -26.880  -3.743  -9.273
    8    HE1  MET  23           HE2      MET  23 -27.151  -4.672 -10.747
    9    HE3  MET  23           HE3      MET  23 -26.087  -3.265 -10.774

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ARG  24           H        ARG  24 -23.300  -6.670 -14.802
    2    HA   ARG  24           HA       ARG  24 -24.765  -5.290 -16.770
    3    HB2  ARG  24           HB2      ARG  24 -21.973  -6.480 -16.828
    4    HB3  ARG  24           HB3      ARG  24 -22.625  -5.532 -18.141
    5    HG2  ARG  24           HG2      ARG  24 -22.783  -3.534 -16.703
    6    HG3  ARG  24           HG3      ARG  24 -22.243  -4.499 -15.304
    7    HD2  ARG  24           HD2      ARG  24 -20.300  -3.342 -16.205
    8    HD3  ARG  24           HD3      ARG  24 -20.169  -5.053 -16.593
    9    HE   ARG  24           HE       ARG  24 -21.292  -4.070 -18.817
   10   HH21  ARG  24          HH11      ARG  24 -19.872  -4.651 -20.459
   11   HH22  ARG  24          HH12      ARG  24 -18.219  -4.151 -20.379
   12   HH11  ARG  24          HH21      ARG  24 -18.603  -3.028 -17.045
   13   HH12  ARG  24          HH22      ARG  24 -17.481  -3.182 -18.359

  No H/Q in entry =          13
  In of MODEL   68
    1    H    ALA  25           H        ALA  25 -23.715  -8.657 -16.575
    2    HA   ALA  25           HA       ALA  25 -24.357  -9.408 -19.233
    3    HB1  ALA  25           HB1      ALA  25 -23.706 -11.472 -18.587
    4    HB3  ALA  25           HB2      ALA  25 -24.766 -11.463 -17.178
    5    HB2  ALA  25           HB3      ALA  25 -23.194 -10.672 -17.102

  No H/Q in entry =           5
  In of MODEL   68
    1    H    GLN  26           H        GLN  26 -26.190  -9.482 -16.215
    2    HA   GLN  26           HA       GLN  26 -28.558 -10.608 -17.265
    3    HB2  GLN  26           HB2      GLN  26 -28.011  -8.932 -14.834
    4    HB3  GLN  26           HB3      GLN  26 -29.589  -9.611 -15.204
    5    HG2  GLN  26           HG2      GLN  26 -27.038 -11.137 -14.769
    6    HG3  GLN  26           HG3      GLN  26 -28.398 -11.031 -13.658
    7   HE21  GLN  26          HE21      GLN  26 -27.226 -13.190 -14.987
    8   HE22  GLN  26          HE22      GLN  26 -28.289 -14.194 -15.812

  No H/Q in entry =           8
  In of MODEL   68
    1    H    ALA  27           H        ALA  27 -27.549  -7.242 -16.786
    2    HA   ALA  27           HA       ALA  27 -30.012  -6.075 -17.545
    3    HB1  ALA  27           HB1      ALA  27 -28.176  -4.830 -16.394
    4    HB3  ALA  27           HB2      ALA  27 -28.746  -4.013 -17.852
    5    HB2  ALA  27           HB3      ALA  27 -27.230  -4.913 -17.882

  No H/Q in entry =           5
  In of MODEL   68
    1    H    GLU  28           H        GLU  28 -27.335  -7.310 -19.441
    2    HA   GLU  28           HA       GLU  28 -28.240  -6.185 -21.935
    3    HB2  GLU  28           HB2      GLU  28 -25.879  -6.937 -21.325
    4    HB3  GLU  28           HB3      GLU  28 -26.460  -8.583 -21.569
    5    HG2  GLU  28           HG2      GLU  28 -25.292  -7.781 -23.515
    6    HG3  GLU  28           HG3      GLU  28 -26.996  -8.058 -23.876

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LYS  29           H        LYS  29 -28.480  -9.328 -20.359
    2    HA   LYS  29           HA       LYS  29 -29.810 -10.716 -22.403
    3    HB2  LYS  29           HB2      LYS  29 -28.788 -11.775 -20.423
    4    HB3  LYS  29           HB3      LYS  29 -30.045 -11.066 -19.413
    5    HG2  LYS  29           HG2      LYS  29 -31.735 -12.372 -20.519
    6    HG3  LYS  29           HG3      LYS  29 -30.547 -13.005 -21.658
    7    HD2  LYS  29           HD2      LYS  29 -29.435 -14.241 -19.953
    8    HD3  LYS  29           HD3      LYS  29 -30.326 -13.413 -18.678
    9    HE2  LYS  29           HE2      LYS  29 -31.130 -15.734 -19.102
   10    HE3  LYS  29           HE3      LYS  29 -32.380 -14.507 -19.317
   11    HZ1  LYS  29           HZ1      LYS  29 -31.813 -14.591 -21.747
   12    HZ3  LYS  29           HZ2      LYS  29 -32.565 -15.978 -21.118
   13    HZ2  LYS  29           HZ3      LYS  29 -30.894 -15.979 -21.413

  No H/Q in entry =          13
  In of MODEL   68
    1    H    TYR  30           H        TYR  30 -31.161  -8.647 -19.847
    2    HA   TYR  30           HA       TYR  30 -33.831  -9.004 -21.105
    3    HB2  TYR  30           HB2      TYR  30 -33.158  -7.937 -18.353
    4    HB3  TYR  30           HB3      TYR  30 -34.779  -8.140 -19.016
    5    HD1  TYR  30           HD1      TYR  30 -35.740 -10.405 -19.290
    6    HD2  TYR  30           HD2      TYR  30 -31.894  -9.814 -17.562
    7    HE1  TYR  30           HE1      TYR  30 -35.704 -12.755 -18.556
    8    HE2  TYR  30           HE2      TYR  30 -31.859 -12.148 -16.830
    9    HH   TYR  30           HH       TYR  30 -33.548 -14.443 -17.987

  No H/Q in entry =           9
  In of MODEL   68
    1    H    GLU  31           H        GLU  31 -31.619  -7.040 -21.849
    2    HA   GLU  31           HA       GLU  31 -31.496  -4.865 -22.614
    3    HB2  GLU  31           HB2      GLU  31 -34.405  -5.502 -23.150
    4    HB3  GLU  31           HB3      GLU  31 -33.533  -4.135 -23.842
    5    HG2  GLU  31           HG2      GLU  31 -32.090  -5.573 -25.068
    6    HG3  GLU  31           HG3      GLU  31 -32.687  -6.997 -24.219

  No H/Q in entry =           6
  In of MODEL   68
    1    H    VAL  32           H        VAL  32 -31.699  -4.830 -19.881
    2    HA   VAL  32           HA       VAL  32 -33.517  -2.695 -19.170
    3    HB   VAL  32           HB       VAL  32 -31.150  -3.782 -17.612
    4   HG12  VAL  32          HG11      VAL  32 -32.672  -2.975 -15.698
    5   HG11  VAL  32          HG12      VAL  32 -33.483  -2.020 -16.939
    6   HG13  VAL  32          HG13      VAL  32 -31.771  -1.762 -16.608
    7   HG21  VAL  32          HG21      VAL  32 -32.953  -5.445 -18.348
    8   HG23  VAL  32          HG22      VAL  32 -33.978  -4.626 -17.169
    9   HG22  VAL  32          HG23      VAL  32 -32.478  -5.396 -16.650

  No H/Q in entry =           9
  In of MODEL   68
    1    HA   PRO  33           HA       PRO  33 -30.419   0.211 -20.760
    2    HB2  PRO  33           HB2      PRO  33 -31.885   2.461 -20.580
    3    HB3  PRO  33           HB3      PRO  33 -32.377   1.198 -21.709
    4    HG2  PRO  33           HG2      PRO  33 -33.341   1.660 -18.885
    5    HG3  PRO  33           HG3      PRO  33 -34.307   1.511 -20.354
    6    HD2  PRO  33           HD2      PRO  33 -33.898  -0.614 -18.743
    7    HD3  PRO  33           HD3      PRO  33 -33.961  -0.808 -20.495

  No H/Q in entry =           7
  In of MODEL   68
    1    H    VAL  34           H        VAL  34 -29.172  -0.411 -18.824
    2    HA   VAL  34           HA       VAL  34 -28.842   1.964 -17.113
    3    HB   VAL  34           HB       VAL  34 -28.295   0.439 -15.213
    4   HG12  VAL  34          HG11      VAL  34 -30.726  -0.391 -14.933
    5   HG11  VAL  34          HG12      VAL  34 -31.023   0.415 -16.471
    6   HG13  VAL  34          HG13      VAL  34 -30.454   1.344 -15.084
    7   HG21  VAL  34          HG21      VAL  34 -28.518  -1.529 -17.274
    8   HG23  VAL  34          HG22      VAL  34 -29.585  -1.904 -15.921
    9   HG22  VAL  34          HG23      VAL  34 -27.862  -1.660 -15.643

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ILE  35           H        ILE  35 -26.860   2.336 -16.258
    2    HA   ILE  35           HA       ILE  35 -24.580   0.994 -17.552
    3    HB   ILE  35           HB       ILE  35 -24.923   3.869 -16.665
    4   HG12  ILE  35          HG12      ILE  35 -23.961   2.611 -19.242
    5   HG13  ILE  35          HG13      ILE  35 -25.579   3.257 -18.969
    6   HG21  ILE  35          HG21      ILE  35 -22.391   2.293 -17.010
    7   HG23  ILE  35          HG22      ILE  35 -22.825   3.449 -15.751
    8   HG22  ILE  35          HG23      ILE  35 -22.429   4.019 -17.373
    9   HD11  ILE  35          HD11      ILE  35 -24.136   5.406 -18.307
   10   HD13  ILE  35          HD12      ILE  35 -24.676   5.077 -19.953
   11   HD12  ILE  35          HD13      ILE  35 -23.034   4.662 -19.465

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ILE  36           H        ILE  36 -23.373  -0.095 -15.979
    2    HA   ILE  36           HA       ILE  36 -23.807   0.451 -13.093
    3    HB   ILE  36           HB       ILE  36 -23.032  -2.237 -14.272
    4   HG12  ILE  36          HG12      ILE  36 -25.823  -1.396 -13.491
    5   HG13  ILE  36          HG13      ILE  36 -25.248  -1.343 -15.157
    6   HG23  ILE  36          HG21      ILE  36 -23.403  -3.115 -12.182
    7   HG22  ILE  36          HG22      ILE  36 -24.505  -1.821 -11.711
    8   HG21  ILE  36          HG23      ILE  36 -22.768  -1.522 -11.769
    9   HD13  ILE  36          HD11      ILE  36 -25.457  -3.546 -15.422
   10   HD12  ILE  36          HD12      ILE  36 -26.523  -3.441 -14.023
   11   HD11  ILE  36          HD13      ILE  36 -24.833  -3.900 -13.812

  No H/Q in entry =          11
  In of MODEL   68
    1    H    GLU  37           H        GLU  37 -22.016   1.015 -11.970
    2    HA   GLU  37           HA       GLU  37 -19.340   0.191 -12.902
    3    HB2  GLU  37           HB2      GLU  37 -20.162   2.978 -12.101
    4    HB3  GLU  37           HB3      GLU  37 -18.493   2.445 -12.303
    5    HG2  GLU  37           HG2      GLU  37 -20.563   2.561 -14.478
    6    HG3  GLU  37           HG3      GLU  37 -19.305   3.763 -14.190

  No H/Q in entry =           6
  In of MODEL   68
    1    H    ALA  38           H        ALA  38 -17.861  -0.121 -11.225
    2    HA   ALA  38           HA       ALA  38 -18.895   0.004  -8.452
    3    HB1  ALA  38           HB1      ALA  38 -17.216  -1.929  -9.926
    4    HB3  ALA  38           HB2      ALA  38 -18.272  -2.182  -8.537
    5    HB2  ALA  38           HB3      ALA  38 -16.648  -1.537  -8.303

  No H/Q in entry =           5
  In of MODEL   68
    1    H    PHE  39           H        PHE  39 -17.635   1.149  -6.945
    2    HA   PHE  39           HA       PHE  39 -15.086   2.327  -7.804
    3    HB2  PHE  39           HB2      PHE  39 -17.403   3.864  -6.628
    4    HB3  PHE  39           HB3      PHE  39 -15.762   4.490  -6.771
    5    HD1  PHE  39           HD1      PHE  39 -14.754   4.672  -9.085
    6    HD2  PHE  39           HD2      PHE  39 -18.913   4.052  -8.377
    7    HE1  PHE  39           HE1      PHE  39 -15.252   5.496 -11.368
    8    HE2  PHE  39           HE2      PHE  39 -19.426   4.866 -10.652
    9    HZ   PHE  39           HZ       PHE  39 -17.600   5.561 -12.165

  No H/Q in entry =           9
  In of MODEL   68
    1    HA   PRO  40           HA       PRO  40 -14.170   1.443  -3.539
    2    HB2  PRO  40           HB2      PRO  40 -12.368   3.410  -2.876
    3    HB3  PRO  40           HB3      PRO  40 -11.946   2.098  -3.977
    4    HG2  PRO  40           HG2      PRO  40 -12.919   4.870  -4.655
    5    HG3  PRO  40           HG3      PRO  40 -11.507   4.018  -5.280
    6    HD2  PRO  40           HD2      PRO  40 -13.729   4.010  -6.693
    7    HD3  PRO  40           HD3      PRO  40 -12.801   2.519  -6.540

  No H/Q in entry =           7
  In of MODEL   68
    1    H    GLU  41           H        GLU  41 -14.778   2.375  -1.384
    2    HA   GLU  41           HA       GLU  41 -16.992   4.115  -1.325
    3    HB2  GLU  41           HB2      GLU  41 -16.979   3.834   0.981
    4    HB3  GLU  41           HB3      GLU  41 -16.197   2.362   0.406
    5    HG2  GLU  41           HG2      GLU  41 -14.829   4.783   1.576
    6    HG3  GLU  41           HG3      GLU  41 -15.063   3.224   2.368

  No H/Q in entry =           6
  In of MODEL   68
    1    H    THR  42           H        THR  42 -13.646   4.976  -1.347
    2    HA   THR  42           HA       THR  42 -13.957   7.510  -0.069
    3    HB   THR  42           HB       THR  42 -11.786   8.073  -1.112
    4    HG1  THR  42           HG1      THR  42 -11.759   5.516  -2.280
    5   HG23  THR  42          HG21      THR  42 -11.762   6.727   0.926
    6   HG22  THR  42          HG22      THR  42 -10.477   6.190  -0.158
    7   HG21  THR  42          HG23      THR  42 -11.964   5.253  -0.022

  No H/Q in entry =           7
  In of MODEL   68
    1    H    LEU  43           H        LEU  43 -14.874   6.513  -3.198
    2    HA   LEU  43           HA       LEU  43 -15.078   9.314  -4.095
    3    HB2  LEU  43           HB2      LEU  43 -15.513   6.723  -5.571
    4    HB3  LEU  43           HB3      LEU  43 -15.639   8.334  -6.275
    5    HG   LEU  43           HG       LEU  43 -13.100   7.067  -5.273
    6   HD12  LEU  43          HD11      LEU  43 -13.815   7.694  -8.120
    7   HD11  LEU  43          HD12      LEU  43 -14.217   6.139  -7.395
    8   HD13  LEU  43          HD13      LEU  43 -12.534   6.649  -7.506
    9   HD23  LEU  43          HD21      LEU  43 -12.138   9.029  -6.608
   10   HD22  LEU  43          HD22      LEU  43 -12.878   9.405  -5.050
   11   HD21  LEU  43          HD23      LEU  43 -13.760   9.717  -6.545

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ALA  44           H        ALA  44 -17.058   7.475  -2.295
    2    HA   ALA  44           HA       ALA  44 -19.535   7.411  -3.624
    3    HB3  ALA  44           HB1      ALA  44 -19.420   6.237  -1.557
    4    HB2  ALA  44           HB2      ALA  44 -20.504   7.593  -1.251
    5    HB1  ALA  44           HB3      ALA  44 -18.833   7.658  -0.693

  No H/Q in entry =           5
  In of MODEL   68
    1    H    GLY  45           H        GLY  45 -18.071  10.145  -2.016
    2    HA3  GLY  45           HA2      GLY  45 -20.482  11.695  -2.340
    3    HA2  GLY  45           HA3      GLY  45 -18.928  12.278  -1.745

  No H/Q in entry =           3
  In of MODEL   68
    1    H    GLU  46           H        GLU  46 -17.408  11.376  -4.057
    2    HA   GLU  46           HA       GLU  46 -18.004  13.648  -5.768
    3    HB2  GLU  46           HB2      GLU  46 -15.849  11.530  -5.866
    4    HB3  GLU  46           HB3      GLU  46 -15.949  12.907  -6.964
    5    HG2  GLU  46           HG2      GLU  46 -15.593  13.078  -3.979
    6    HG3  GLU  46           HG3      GLU  46 -14.304  13.236  -5.173

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LYS  47           H        LYS  47 -17.943  10.141  -6.295
    2    HA   LYS  47           HA       LYS  47 -19.033  10.449  -8.965
    3    HB2  LYS  47           HB2      LYS  47 -17.689   8.403  -7.499
    4    HB3  LYS  47           HB3      LYS  47 -19.247   7.770  -8.032
    5    HG2  LYS  47           HG2      LYS  47 -17.665   7.223  -9.697
    6    HG3  LYS  47           HG3      LYS  47 -18.654   8.534 -10.339
    7    HD2  LYS  47           HD2      LYS  47 -16.926  10.147  -9.696
    8    HD3  LYS  47           HD3      LYS  47 -15.935   8.832  -9.070
    9    HE2  LYS  47           HE2      LYS  47 -15.769   7.861 -11.279
   10    HE3  LYS  47           HE3      LYS  47 -16.848   9.094 -11.928
   11    HZ2  LYS  47           HZ1      LYS  47 -14.176   9.551 -10.736
   12    HZ1  LYS  47           HZ2      LYS  47 -15.223  10.771 -11.279
   13    HZ3  LYS  47           HZ3      LYS  47 -14.576   9.654 -12.383

  No H/Q in entry =          13
  In of MODEL   68
    1    H    GLY  48           H        GLY  48 -20.374   9.633  -5.841
    2    HA3  GLY  48           HA2      GLY  48 -22.778   8.507  -6.616
    3    HA2  GLY  48           HA3      GLY  48 -22.539   9.459  -5.150

  No H/Q in entry =           3
  In of MODEL   68
    1    H    GLN  49           H        GLN  49 -21.911  11.912  -6.657
    2    HA   GLN  49           HA       GLN  49 -24.452  13.071  -6.775
    3    HB2  GLN  49           HB2      GLN  49 -21.890  13.927  -8.108
    4    HB3  GLN  49           HB3      GLN  49 -23.337  14.914  -8.001
    5    HG2  GLN  49           HG2      GLN  49 -23.181  14.871  -5.564
    6    HG3  GLN  49           HG3      GLN  49 -21.749  13.863  -5.670
    7   HE21  GLN  49          HE21      GLN  49 -21.596  16.055  -4.340
    8   HE22  GLN  49          HE22      GLN  49 -20.651  17.311  -4.953

  No H/Q in entry =           8
  In of MODEL   68
    1    H    ASN  50           H        ASN  50 -22.800  11.225  -9.208
    2    HA   ASN  50           HA       ASN  50 -24.664  12.184 -11.270
    3    HB2  ASN  50           HB2      ASN  50 -22.110  10.607 -11.540
    4    HB3  ASN  50           HB3      ASN  50 -23.151  11.085 -12.873
    5   HD21  ASN  50          HD21      ASN  50 -20.503  11.843 -11.237
    6   HD22  ASN  50          HD22      ASN  50 -20.241  13.483 -11.536

  No H/Q in entry =           6
  In of MODEL   68
    1    H    ALA  51           H        ALA  51 -24.694   9.770  -9.086
    2    HA   ALA  51           HA       ALA  51 -25.512   7.688 -10.970
    3    HB2  ALA  51           HB1      ALA  51 -24.956   6.285  -9.318
    4    HB3  ALA  51           HB2      ALA  51 -26.065   7.083  -8.206
    5    HB1  ALA  51           HB3      ALA  51 -24.416   7.681  -8.386

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ASP  52           H        ASP  52 -27.536   6.664 -10.860
    2    HA   ASP  52           HA       ASP  52 -29.686   8.518 -10.151
    3    HB2  ASP  52           HB2      ASP  52 -29.537   6.054 -11.885
    4    HB3  ASP  52           HB3      ASP  52 -31.069   6.803 -11.434

  No H/Q in entry =           4
  In of MODEL   68
    1    H    VAL  53           H        VAL  53 -28.139   5.575  -9.208
    2    HA   VAL  53           HA       VAL  53 -29.581   5.663  -6.692
    3    HB   VAL  53           HB       VAL  53 -31.008   4.079  -7.980
    4   HG11  VAL  53          HG11      VAL  53 -29.274   3.229  -9.522
    5   HG13  VAL  53          HG12      VAL  53 -30.132   1.926  -8.698
    6   HG12  VAL  53          HG13      VAL  53 -28.514   2.386  -8.173
    7   HG23  VAL  53          HG21      VAL  53 -30.225   2.044  -6.339
    8   HG22  VAL  53          HG22      VAL  53 -31.331   3.359  -5.940
    9   HG21  VAL  53          HG23      VAL  53 -29.622   3.489  -5.526

  No H/Q in entry =           9
  In of MODEL   68
    1    H    VAL  54           H        VAL  54 -28.280   5.162  -5.046
    2    HA   VAL  54           HA       VAL  54 -25.535   4.278  -5.676
    3    HB   VAL  54           HB       VAL  54 -26.576   6.017  -3.382
    4   HG11  VAL  54          HG11      VAL  54 -24.023   4.557  -3.706
    5   HG13  VAL  54          HG12      VAL  54 -24.766   5.213  -2.248
    6   HG12  VAL  54          HG13      VAL  54 -23.839   6.268  -3.315
    7   HG22  VAL  54          HG21      VAL  54 -25.681   7.843  -4.432
    8   HG21  VAL  54          HG22      VAL  54 -26.244   6.899  -5.811
    9   HG23  VAL  54          HG23      VAL  54 -24.538   6.880  -5.370

  No H/Q in entry =           9
  In of MODEL   68
    1    H    LEU  55           H        LEU  55 -24.980   2.330  -5.083
    2    HA   LEU  55           HA       LEU  55 -26.516   0.991  -2.945
    3    HB2  LEU  55           HB2      LEU  55 -24.977  -0.145  -5.268
    4    HB3  LEU  55           HB3      LEU  55 -25.758  -1.099  -4.005
    5    HG   LEU  55           HG       LEU  55 -27.160   0.571  -6.082
    6   HD13  LEU  55          HD11      LEU  55 -26.894  -1.255  -7.350
    7   HD12  LEU  55          HD12      LEU  55 -27.869  -2.143  -6.179
    8   HD11  LEU  55          HD13      LEU  55 -26.114  -2.116  -6.024
    9   HD23  LEU  55          HD21      LEU  55 -28.496  -1.398  -4.280
   10   HD22  LEU  55          HD22      LEU  55 -29.162   0.019  -5.092
   11   HD21  LEU  55          HD23      LEU  55 -28.140   0.217  -3.670

  No H/Q in entry =          11
  In of MODEL   68
    1    H    LEU  56           H        LEU  56 -25.380   0.329  -1.154
    2    HA   LEU  56           HA       LEU  56 -22.438   0.669  -1.190
    3    HB2  LEU  56           HB2      LEU  56 -24.249   0.429   1.201
    4    HB3  LEU  56           HB3      LEU  56 -22.532   0.826   1.203
    5    HG   LEU  56           HG       LEU  56 -24.797   2.573   0.280
    6   HD11  LEU  56          HD11      LEU  56 -23.694   2.104   2.791
    7   HD13  LEU  56          HD12      LEU  56 -24.656   3.505   2.320
    8   HD12  LEU  56          HD13      LEU  56 -22.898   3.578   2.237
    9   HD23  LEU  56          HD21      LEU  56 -22.819   4.238   0.133
   10   HD22  LEU  56          HD22      LEU  56 -23.221   3.184  -1.223
   11   HD21  LEU  56          HD23      LEU  56 -21.876   2.778  -0.157

  No H/Q in entry =          11
  In of MODEL   68
    1    H    GLY  57           H        GLY  57 -21.091  -1.001  -0.696
    2    HA3  GLY  57           HA2      GLY  57 -22.064  -3.663  -0.966
    3    HA2  GLY  57           HA3      GLY  57 -20.433  -3.213  -0.472

  No H/Q in entry =           3
  In of MODEL   68
    1    HA   PRO  58           HA       PRO  58 -23.269  -4.294   3.207
    2    HB2  PRO  58           HB2      PRO  58 -22.636  -6.926   3.747
    3    HB3  PRO  58           HB3      PRO  58 -24.010  -6.465   2.742
    4    HG2  PRO  58           HG2      PRO  58 -21.299  -7.377   1.937
    5    HG3  PRO  58           HG3      PRO  58 -22.871  -7.789   1.252
    6    HD2  PRO  58           HD2      PRO  58 -21.225  -5.972   0.079
    7    HD3  PRO  58           HD3      PRO  58 -22.982  -5.849  -0.023

  No H/Q in entry =           7
  In of MODEL   68
    1    H    GLN  59           H        GLN  59 -19.907  -4.815   2.592
    2    HA   GLN  59           HA       GLN  59 -19.157  -4.920   5.352
    3    HB2  GLN  59           HB2      GLN  59 -17.704  -4.425   2.794
    4    HB3  GLN  59           HB3      GLN  59 -16.938  -3.941   4.292
    5    HG2  GLN  59           HG2      GLN  59 -16.204  -6.149   3.598
    6    HG3  GLN  59           HG3      GLN  59 -17.082  -6.231   5.117
    7   HE21  GLN  59          HE21      GLN  59 -17.779  -8.081   4.912
    8   HE22  GLN  59          HE22      GLN  59 -18.845  -8.960   3.984

  No H/Q in entry =           8
  In of MODEL   68
    1    H    ILE  60           H        ILE  60 -20.037  -2.295   3.210
    2    HA   ILE  60           HA       ILE  60 -19.150  -0.408   5.308
    3    HB   ILE  60           HB       ILE  60 -19.340   1.373   3.530
    4   HG12  ILE  60          HG12      ILE  60 -19.199  -0.797   1.481
    5   HG13  ILE  60          HG13      ILE  60 -20.771  -0.243   2.052
    6   HG22  ILE  60          HG21      ILE  60 -17.372  -0.660   2.620
    7   HG21  ILE  60          HG22      ILE  60 -17.246   0.046   4.230
    8   HG23  ILE  60          HG23      ILE  60 -17.191   1.084   2.805
    9   HD11  ILE  60          HD11      ILE  60 -19.849   2.134   1.481
   10   HD13  ILE  60          HD12      ILE  60 -20.428   1.095   0.180
   11   HD12  ILE  60          HD13      ILE  60 -18.698   1.250   0.481

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ALA  61           H        ALA  61 -21.636  -1.946   5.333
    2    HA   ALA  61           HA       ALA  61 -23.828  -0.227   4.914
    3    HB1  ALA  61           HB1      ALA  61 -25.075  -1.726   6.199
    4    HB2  ALA  61           HB2      ALA  61 -23.687  -2.169   7.193
    5    HB3  ALA  61           HB3      ALA  61 -23.791  -2.730   5.524

  No H/Q in entry =           5
  In of MODEL   68
    1    H    TYR  62           H        TYR  62 -21.628  -0.455   7.711
    2    HA   TYR  62           HA       TYR  62 -23.153   1.189   9.422
    3    HB2  TYR  62           HB2      TYR  62 -21.106   1.543  10.667
    4    HB3  TYR  62           HB3      TYR  62 -21.200  -0.145  10.163
    5    HD1  TYR  62           HD1      TYR  62 -19.621  -1.053   8.520
    6    HD2  TYR  62           HD2      TYR  62 -19.378   3.034   9.742
    7    HE1  TYR  62           HE1      TYR  62 -17.404  -0.873   7.458
    8    HE2  TYR  62           HE2      TYR  62 -17.146   3.209   8.682
    9    HH   TYR  62           HH       TYR  62 -15.630   2.181   7.488

  No H/Q in entry =           9
  In of MODEL   68
    1    H    MET  63           H        MET  63 -21.489   2.088   6.591
    2    HA   MET  63           HA       MET  63 -21.267   4.898   7.359
    3    HB2  MET  63           HB2      MET  63 -20.689   3.433   4.783
    4    HB3  MET  63           HB3      MET  63 -20.456   5.167   5.015
    5    HG2  MET  63           HG2      MET  63 -18.760   4.726   6.695
    6    HG3  MET  63           HG3      MET  63 -19.004   2.991   6.497
    7    HE2  MET  63           HE1      MET  63 -16.989   5.869   3.616
    8    HE1  MET  63           HE2      MET  63 -17.758   6.217   5.165
    9    HE3  MET  63           HE3      MET  63 -18.748   5.958   3.727

  No H/Q in entry =           9
  In of MODEL   68
    1    H    LEU  64           H        LEU  64 -23.866   3.122   6.343
    2    HA   LEU  64           HA       LEU  64 -25.043   4.618   4.301
    3    HB2  LEU  64           HB2      LEU  64 -25.956   2.507   5.162
    4    HB3  LEU  64           HB3      LEU  64 -26.398   3.320   6.664
    5    HG   LEU  64           HG       LEU  64 -28.065   4.641   5.467
    6   HD13  LEU  64          HD11      LEU  64 -27.774   4.934   3.241
    7   HD12  LEU  64          HD12      LEU  64 -28.453   3.317   3.053
    8   HD11  LEU  64          HD13      LEU  64 -26.705   3.538   3.120
    9   HD23  LEU  64          HD21      LEU  64 -28.640   1.860   4.646
   10   HD22  LEU  64          HD22      LEU  64 -29.606   2.989   5.594
   11   HD21  LEU  64          HD23      LEU  64 -28.249   2.148   6.341

  No H/Q in entry =          11
  In of MODEL   68
    1    HA   PRO  65           HA       PRO  65 -27.162   7.744   7.131
    2    HB2  PRO  65           HB2      PRO  65 -25.161   7.802   9.390
    3    HB3  PRO  65           HB3      PRO  65 -26.894   8.119   9.442
    4    HG2  PRO  65           HG2      PRO  65 -26.014   5.821  10.310
    5    HG3  PRO  65           HG3      PRO  65 -27.433   5.846   9.264
    6    HD2  PRO  65           HD2      PRO  65 -24.573   5.189   8.547
    7    HD3  PRO  65           HD3      PRO  65 -26.049   4.345   8.076

  No H/Q in entry =           7
  In of MODEL   68
    1    H    GLU  66           H        GLU  66 -23.608   7.611   7.206
    2    HA   GLU  66           HA       GLU  66 -23.250  10.412   6.874
    3    HB2  GLU  66           HB2      GLU  66 -21.486   8.083   6.164
    4    HB3  GLU  66           HB3      GLU  66 -21.000   9.771   6.001
    5    HG2  GLU  66           HG2      GLU  66 -21.207  10.084   8.377
    6    HG3  GLU  66           HG3      GLU  66 -21.768   8.422   8.565

  No H/Q in entry =           6
  In of MODEL   68
    1    H    ILE  67           H        ILE  67 -23.408   7.729   4.551
    2    HA   ILE  67           HA       ILE  67 -22.952   9.486   2.303
    3    HB   ILE  67           HB       ILE  67 -23.915   6.596   2.407
    4   HG12  ILE  67          HG12      ILE  67 -21.257   7.730   1.518
    5   HG13  ILE  67          HG13      ILE  67 -21.564   7.274   3.192
    6   HG21  ILE  67          HG21      ILE  67 -23.812   8.530   0.231
    7   HG23  ILE  67          HG22      ILE  67 -24.474   6.895   0.239
    8   HG22  ILE  67          HG23      ILE  67 -22.759   7.151  -0.081
    9   HD12  ILE  67          HD11      ILE  67 -21.180   5.555   0.797
   10   HD11  ILE  67          HD12      ILE  67 -22.209   4.971   2.104
   11   HD13  ILE  67          HD13      ILE  67 -20.527   5.390   2.427

  No H/Q in entry =          11
  In of MODEL   68
    1    H    GLN  68           H        GLN  68 -25.847   8.455   3.907
    2    HA   GLN  68           HA       GLN  68 -27.652   9.479   1.957
    3    HB2  GLN  68           HB2      GLN  68 -27.919   9.050   4.929
    4    HB3  GLN  68           HB3      GLN  68 -29.224   9.700   3.951
    5    HG2  GLN  68           HG2      GLN  68 -29.297   7.704   2.623
    6    HG3  GLN  68           HG3      GLN  68 -27.862   7.075   3.410
    7   HE21  GLN  68          HE21      GLN  68 -30.072   5.772   3.239
    8   HE22  GLN  68          HE22      GLN  68 -30.912   5.299   4.641

  No H/Q in entry =           8
  In of MODEL   68
    1    H    ARG  69           H        ARG  69 -26.010  11.035   4.737
    2    HA   ARG  69           HA       ARG  69 -27.315  13.558   4.395
    3    HB2  ARG  69           HB2      ARG  69 -24.995  12.532   5.961
    4    HB3  ARG  69           HB3      ARG  69 -25.032  14.262   5.647
    5    HG2  ARG  69           HG2      ARG  69 -27.349  14.335   6.618
    6    HG3  ARG  69           HG3      ARG  69 -27.181  12.629   7.048
    7    HD2  ARG  69           HD2      ARG  69 -25.433  14.917   8.024
    8    HD3  ARG  69           HD3      ARG  69 -26.586  14.014   8.994
    9    HE   ARG  69           HE       ARG  69 -23.995  13.044   8.021
   10   HH21  ARG  69          HH11      ARG  69 -23.231  11.232   9.171
   11   HH22  ARG  69          HH12      ARG  69 -24.281  10.411  10.278
   12   HH11  ARG  69          HH21      ARG  69 -26.967  12.524   9.703
   13   HH12  ARG  69          HH22      ARG  69 -26.395  11.141  10.576

  No H/Q in entry =          13
  In of MODEL   68
    1    H    LEU  70           H        LEU  70 -24.477  12.119   3.000
    2    HA   LEU  70           HA       LEU  70 -23.305  14.486   1.895
    3    HB2  LEU  70           HB2      LEU  70 -22.369  12.130   2.430
    4    HB3  LEU  70           HB3      LEU  70 -22.993  11.720   0.832
    5    HG   LEU  70           HG       LEU  70 -21.365  13.081  -0.216
    6   HD11  LEU  70          HD11      LEU  70 -20.525  13.831   2.593
    7   HD13  LEU  70          HD12      LEU  70 -21.193  14.914   1.371
    8   HD12  LEU  70          HD13      LEU  70 -19.600  14.199   1.135
    9   HD22  LEU  70          HD21      LEU  70 -19.975  11.324  -0.028
   10   HD21  LEU  70          HD22      LEU  70 -20.915  10.789   1.364
   11   HD23  LEU  70          HD23      LEU  70 -19.505  11.820   1.597

  No H/Q in entry =          11
  In of MODEL   68
    1    H    LEU  71           H        LEU  71 -25.520  12.028   0.713
    2    HA   LEU  71           HA       LEU  71 -26.005  13.593  -1.764
    3    HB2  LEU  71           HB2      LEU  71 -26.287  10.605  -1.396
    4    HB3  LEU  71           HB3      LEU  71 -26.392  11.508  -2.907
    5    HG   LEU  71           HG       LEU  71 -23.874  11.412  -1.244
    6   HD12  LEU  71          HD11      LEU  71 -23.968   9.850  -3.719
    7   HD11  LEU  71          HD12      LEU  71 -24.995   9.219  -2.433
    8   HD13  LEU  71          HD13      LEU  71 -23.269   9.447  -2.151
    9   HD22  LEU  71          HD21      LEU  71 -23.928  13.268  -2.690
   10   HD21  LEU  71          HD22      LEU  71 -24.453  12.275  -4.050
   11   HD23  LEU  71          HD23      LEU  71 -22.836  12.068  -3.375

  No H/Q in entry =          11
  In of MODEL   68
    1    HA   PRO  72           HA       PRO  72 -29.884  13.178   0.844
    2    HB2  PRO  72           HB2      PRO  72 -30.673  15.762   0.829
    3    HB3  PRO  72           HB3      PRO  72 -29.377  15.247   1.909
    4    HG2  PRO  72           HG2      PRO  72 -29.157  16.507  -0.812
    5    HG3  PRO  72           HG3      PRO  72 -28.376  16.999   0.691
    6    HD2  PRO  72           HD2      PRO  72 -27.081  15.452  -1.115
    7    HD3  PRO  72           HD3      PRO  72 -26.832  15.232   0.616

  No H/Q in entry =           7
  In of MODEL   68
    1    H    ASN  73           H        ASN  73 -29.233  14.199  -2.344
    2    HA   ASN  73           HA       ASN  73 -32.099  13.986  -2.985
    3    HB2  ASN  73           HB2      ASN  73 -31.601  15.134  -5.053
    4    HB3  ASN  73           HB3      ASN  73 -31.054  16.063  -3.666
    5   HD21  ASN  73          HD21      ASN  73 -30.254  16.156  -6.342
    6   HD22  ASN  73          HD22      ASN  73 -28.592  15.954  -6.538

  No H/Q in entry =           6
  In of MODEL   68
    1    H    LYS  74           H        LYS  74 -30.183  11.666  -2.619
    2    HA   LYS  74           HA       LYS  74 -30.787  10.355  -5.203
    3    HB2  LYS  74           HB2      LYS  74 -28.265   9.949  -3.590
    4    HB3  LYS  74           HB3      LYS  74 -28.670   9.188  -5.129
    5    HG2  LYS  74           HG2      LYS  74 -28.322  12.143  -4.848
    6    HG3  LYS  74           HG3      LYS  74 -26.978  11.051  -5.181
    7    HD2  LYS  74           HD2      LYS  74 -28.120  10.206  -7.148
    8    HD3  LYS  74           HD3      LYS  74 -29.510  11.234  -6.802
    9    HE2  LYS  74           HE2      LYS  74 -28.227  13.215  -7.191
   10    HE3  LYS  74           HE3      LYS  74 -26.732  12.285  -7.305
   11    HZ2  LYS  74           HZ1      LYS  74 -28.183  12.985  -9.415
   12    HZ1  LYS  74           HZ2      LYS  74 -28.882  11.472  -9.082
   13    HZ3  LYS  74           HZ3      LYS  74 -27.213  11.593  -9.374

  No H/Q in entry =          13
  In of MODEL   68
    1    HA   PRO  75           HA       PRO  75 -32.270   7.334  -2.311
    2    HB2  PRO  75           HB2      PRO  75 -32.641   5.168  -3.951
    3    HB3  PRO  75           HB3      PRO  75 -33.728   6.556  -3.985
    4    HG2  PRO  75           HG2      PRO  75 -31.407   5.938  -5.771
    5    HG3  PRO  75           HG3      PRO  75 -33.041   6.434  -6.207
    6    HD2  PRO  75           HD2      PRO  75 -31.047   8.241  -6.114
    7    HD3  PRO  75           HD3      PRO  75 -32.667   8.674  -5.566

  No H/Q in entry =           7
  In of MODEL   68
    1    H    VAL  76           H        VAL  76 -30.849   6.202  -0.966
    2    HA   VAL  76           HA       VAL  76 -28.420   4.950  -2.103
    3    HB   VAL  76           HB       VAL  76 -28.666   6.356   0.591
    4   HG11  VAL  76          HG11      VAL  76 -26.348   5.036  -0.833
    5   HG13  VAL  76          HG12      VAL  76 -27.058   4.566   0.712
    6   HG12  VAL  76          HG13      VAL  76 -26.168   6.081   0.577
    7   HG22  VAL  76          HG21      VAL  76 -27.943   8.258  -0.246
    8   HG21  VAL  76          HG22      VAL  76 -28.503   7.618  -1.791
    9   HG23  VAL  76          HG23      VAL  76 -26.806   7.469  -1.338

  No H/Q in entry =           9
  In of MODEL   68
    1    H    GLU  77           H        GLU  77 -28.265   2.775  -1.547
    2    HA   GLU  77           HA       GLU  77 -29.078   1.943   1.085
    3    HB2  GLU  77           HB2      GLU  77 -30.732   0.358   0.512
    4    HB3  GLU  77           HB3      GLU  77 -31.235   1.913  -0.150
    5    HG2  GLU  77           HG2      GLU  77 -30.647   1.195  -2.357
    6    HG3  GLU  77           HG3      GLU  77 -30.050  -0.337  -1.722

  No H/Q in entry =           6
  In of MODEL   68
    1    H    VAL  78           H        VAL  78 -28.812  -0.169   1.691
    2    HA   VAL  78           HA       VAL  78 -26.168  -0.994   0.784
    3    HB   VAL  78           HB       VAL  78 -27.905  -1.889   3.126
    4   HG11  VAL  78          HG11      VAL  78 -25.600  -3.155   1.970
    5   HG13  VAL  78          HG12      VAL  78 -26.523  -3.637   3.396
    6   HG12  VAL  78          HG13      VAL  78 -25.170  -2.518   3.557
    7   HG22  VAL  78          HG21      VAL  78 -26.408  -0.604   4.499
    8   HG21  VAL  78          HG22      VAL  78 -27.114   0.419   3.249
    9   HG23  VAL  78          HG23      VAL  78 -25.454  -0.153   3.086

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ILE  79           H        ILE  79 -25.686  -2.893  -0.170
    2    HA   ILE  79           HA       ILE  79 -27.787  -4.276  -1.556
    3    HB   ILE  79           HB       ILE  79 -24.813  -4.894  -1.347
    4   HG12  ILE  79          HG12      ILE  79 -26.414  -3.685  -3.607
    5   HG13  ILE  79          HG13      ILE  79 -25.512  -2.730  -2.428
    6   HG22  ILE  79          HG21      ILE  79 -25.945  -5.981  -3.696
    7   HG21  ILE  79          HG22      ILE  79 -26.947  -6.509  -2.343
    8   HG23  ILE  79          HG23      ILE  79 -25.213  -6.838  -2.338
    9   HD13  ILE  79          HD11      ILE  79 -24.101  -2.837  -4.248
   10   HD12  ILE  79          HD12      ILE  79 -24.489  -4.528  -4.573
   11   HD11  ILE  79          HD13      ILE  79 -23.492  -4.103  -3.179

  No H/Q in entry =          11
  In of MODEL   68
    1    H    ASP  80           H        ASP  80 -28.707  -6.187  -1.022
    2    HA   ASP  80           HA       ASP  80 -28.683  -7.156   1.600
    3    HB2  ASP  80           HB2      ASP  80 -30.450  -7.639  -0.054
    4    HB3  ASP  80           HB3      ASP  80 -29.321  -8.657  -0.948

  No H/Q in entry =           4
  In of MODEL   68
    1    H    SER  81           H        SER  81 -27.182  -8.364   2.701
    2    HA   SER  81           HA       SER  81 -24.705  -9.087   1.495
    3    HB2  SER  81           HB2      SER  81 -24.184 -10.183   3.636
    4    HB3  SER  81           HB3      SER  81 -24.845  -8.568   3.891
    5    HG   SER  81           HG       SER  81 -26.615  -9.387   4.702

  No H/Q in entry =           5
  In of MODEL   68
    1    H    LEU  82           H        LEU  82 -27.475 -11.106   1.761
    2    HA   LEU  82           HA       LEU  82 -25.995 -13.505   1.181
    3    HB2  LEU  82           HB2      LEU  82 -28.912 -12.798   0.939
    4    HB3  LEU  82           HB3      LEU  82 -28.254 -14.414   0.690
    5    HG   LEU  82           HG       LEU  82 -28.149 -12.901   3.281
    6   HD12  LEU  82          HD11      LEU  82 -29.868 -15.276   2.552
    7   HD11  LEU  82          HD12      LEU  82 -30.448 -13.611   2.461
    8   HD13  LEU  82          HD13      LEU  82 -29.950 -14.288   4.012
    9   HD22  LEU  82          HD21      LEU  82 -26.351 -14.399   3.235
   10   HD21  LEU  82          HD22      LEU  82 -27.255 -15.595   2.306
   11   HD23  LEU  82          HD23      LEU  82 -27.633 -15.334   4.008

  No H/Q in entry =          11
  In of MODEL   68
    1    H    LEU  83           H        LEU  83 -27.886 -11.175  -0.681
    2    HA   LEU  83           HA       LEU  83 -27.722 -12.475  -3.187
    3    HB2  LEU  83           HB2      LEU  83 -28.048  -9.575  -2.465
    4    HB3  LEU  83           HB3      LEU  83 -28.097 -10.177  -4.121
    5    HG   LEU  83           HG       LEU  83 -30.143 -10.560  -1.956
    6   HD13  LEU  83          HD11      LEU  83 -30.845  -8.664  -2.974
    7   HD12  LEU  83          HD12      LEU  83 -31.338  -9.731  -4.287
    8   HD11  LEU  83          HD13      LEU  83 -29.779  -8.908  -4.356
    9   HD23  LEU  83          HD21      LEU  83 -30.316 -11.744  -4.713
   10   HD22  LEU  83          HD22      LEU  83 -31.296 -12.101  -3.292
   11   HD21  LEU  83          HD23      LEU  83 -29.624 -12.652  -3.368

  No H/Q in entry =          11
  In of MODEL   68
    1    H    TYR  84           H        TYR  84 -25.702 -10.191  -1.449
    2    HA   TYR  84           HA       TYR  84 -23.824  -9.704  -3.566
    3    HB2  TYR  84           HB2      TYR  84 -24.298  -8.251  -1.514
    4    HB3  TYR  84           HB3      TYR  84 -23.323  -9.406  -0.607
    5    HD1  TYR  84           HD1      TYR  84 -20.944  -9.373  -0.718
    6    HD2  TYR  84           HD2      TYR  84 -23.236  -6.899  -3.338
    7    HE1  TYR  84           HE1      TYR  84 -18.878  -8.197  -1.395
    8    HE2  TYR  84           HE2      TYR  84 -21.178  -5.722  -4.032
    9    HH   TYR  84           HH       TYR  84 -18.774  -5.348  -2.754

  No H/Q in entry =           9
  In of MODEL   68
    1    H    GLY  85           H        GLY  85 -23.646 -11.786  -0.670
    2    HA3  GLY  85           HA2      GLY  85 -21.095 -12.792  -1.176
    3    HA2  GLY  85           HA3      GLY  85 -22.352 -13.625  -0.261

  No H/Q in entry =           3
  In of MODEL   68
    1    H    LYS  86           H        LYS  86 -24.206 -13.893  -2.331
    2    HA   LYS  86           HA       LYS  86 -23.221 -16.264  -3.649
    3    HB2  LYS  86           HB2      LYS  86 -25.500 -15.885  -2.634
    4    HB3  LYS  86           HB3      LYS  86 -25.833 -14.795  -3.979
    5    HG2  LYS  86           HG2      LYS  86 -26.764 -16.583  -4.896
    6    HG3  LYS  86           HG3      LYS  86 -25.106 -17.050  -5.275
    7    HD2  LYS  86           HD2      LYS  86 -26.573 -17.769  -2.732
    8    HD3  LYS  86           HD3      LYS  86 -26.358 -18.849  -4.108
    9    HE2  LYS  86           HE2      LYS  86 -24.242 -17.726  -2.290
   10    HE3  LYS  86           HE3      LYS  86 -24.671 -19.417  -2.545
   11    HZ1  LYS  86           HZ1      LYS  86 -23.589 -17.632  -4.659
   12    HZ3  LYS  86           HZ2      LYS  86 -23.864 -19.303  -4.779
   13    HZ2  LYS  86           HZ3      LYS  86 -22.647 -18.716  -3.752

  No H/Q in entry =          13
  In of MODEL   68
    1    H    VAL  87           H        VAL  87 -23.115 -13.029  -4.462
    2    HA   VAL  87           HA       VAL  87 -22.781 -11.817  -6.373
    3    HB   VAL  87           HB       VAL  87 -21.803 -14.277  -7.828
    4   HG13  VAL  87          HG11      VAL  87 -20.440 -12.775  -8.962
    5   HG12  VAL  87          HG12      VAL  87 -20.364 -11.657  -7.598
    6   HG11  VAL  87          HG13      VAL  87 -21.817 -11.740  -8.592
    7   HG21  VAL  87          HG21      VAL  87 -20.938 -14.538  -5.550
    8   HG23  VAL  87          HG22      VAL  87 -20.260 -12.914  -5.628
    9   HG22  VAL  87          HG23      VAL  87 -19.656 -14.174  -6.703

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ASP  88           H        ASP  88 -25.314 -12.395  -6.038
    2    HA   ASP  88           HA       ASP  88 -26.468 -13.518  -8.465
    3    HB2  ASP  88           HB2      ASP  88 -27.471 -13.792  -6.148
    4    HB3  ASP  88           HB3      ASP  88 -27.875 -12.077  -6.205

  No H/Q in entry =           4
  In of MODEL   68
    1    H    GLY  89           H        GLY  89 -25.726 -12.241 -10.075
    2    HA3  GLY  89           HA2      GLY  89 -25.829  -9.460 -10.206
    3    HA2  GLY  89           HA3      GLY  89 -25.836 -10.547 -11.594

  No H/Q in entry =           3
  In of MODEL   68
    1    H    LEU  90           H        LEU  90 -28.320 -11.839 -11.179
    2    HA   LEU  90           HA       LEU  90 -30.074  -9.827 -12.244
    3    HB2  LEU  90           HB2      LEU  90 -30.207 -12.205 -12.884
    4    HB3  LEU  90           HB3      LEU  90 -30.724 -12.597 -11.244
    5    HG   LEU  90           HG       LEU  90 -32.810 -11.412 -11.579
    6   HD13  LEU  90          HD11      LEU  90 -32.581  -9.640 -13.010
    7   HD12  LEU  90          HD12      LEU  90 -33.154 -10.833 -14.178
    8   HD11  LEU  90          HD13      LEU  90 -31.430 -10.491 -14.045
    9   HD23  LEU  90          HD21      LEU  90 -32.785 -12.982 -14.054
   10   HD22  LEU  90          HD22      LEU  90 -33.770 -13.155 -12.602
   11   HD21  LEU  90          HD23      LEU  90 -32.134 -13.814 -12.642

  No H/Q in entry =          11
  In of MODEL   68
    1    H    GLY  91           H        GLY  91 -29.950 -11.410  -9.099
    2    HA3  GLY  91           HA2      GLY  91 -32.257 -10.258  -8.031
    3    HA2  GLY  91           HA3      GLY  91 -30.881 -10.853  -7.102

  No H/Q in entry =           3
  In of MODEL   68
    1    H    VAL  92           H        VAL  92 -28.911  -9.061  -7.914
    2    HA   VAL  92           HA       VAL  92 -29.638  -6.777  -6.308
    3    HB   VAL  92           HB       VAL  92 -27.107  -7.279  -7.915
    4   HG12  VAL  92          HG11      VAL  92 -27.219  -5.447  -5.543
    5   HG11  VAL  92          HG12      VAL  92 -27.867  -4.847  -7.071
    6   HG13  VAL  92          HG13      VAL  92 -26.186  -5.365  -6.971
    7   HG22  VAL  92          HG21      VAL  92 -26.928  -8.910  -6.363
    8   HG21  VAL  92          HG22      VAL  92 -28.051  -8.126  -5.251
    9   HG23  VAL  92          HG23      VAL  92 -26.382  -7.569  -5.358

  No H/Q in entry =           9
  In of MODEL   68
    1    H    LEU  93           H        LEU  93 -29.249  -7.366  -9.744
    2    HA   LEU  93           HA       LEU  93 -29.521  -4.699 -10.608
    3    HB2  LEU  93           HB2      LEU  93 -28.931  -6.534 -12.115
    4    HB3  LEU  93           HB3      LEU  93 -30.541  -7.222 -11.909
    5    HG   LEU  93           HG       LEU  93 -31.498  -5.205 -12.984
    6   HD11  LEU  93          HD11      LEU  93 -29.602  -3.675 -12.442
    7   HD13  LEU  93          HD12      LEU  93 -30.043  -3.650 -14.151
    8   HD12  LEU  93          HD13      LEU  93 -28.614  -4.538 -13.620
    9   HD23  LEU  93          HD21      LEU  93 -30.474  -5.744 -15.286
   10   HD22  LEU  93          HD22      LEU  93 -31.352  -6.998 -14.411
   11   HD21  LEU  93          HD23      LEU  93 -29.586  -6.992 -14.412

  No H/Q in entry =          11
  In of MODEL   68
    1    H    LYS  94           H        LYS  94 -31.966  -7.199  -9.821
    2    HA   LYS  94           HA       LYS  94 -34.269  -5.676 -10.408
    3    HB2  LYS  94           HB2      LYS  94 -33.816  -7.924  -8.451
    4    HB3  LYS  94           HB3      LYS  94 -35.394  -7.178  -8.701
    5    HG2  LYS  94           HG2      LYS  94 -35.329  -7.897 -11.054
    6    HG3  LYS  94           HG3      LYS  94 -33.790  -8.699 -10.745
    7    HD2  LYS  94           HD2      LYS  94 -34.947 -10.046  -8.953
    8    HD3  LYS  94           HD3      LYS  94 -36.472  -9.343  -9.492
    9    HE2  LYS  94           HE2      LYS  94 -35.982 -10.229 -11.781
   10    HE3  LYS  94           HE3      LYS  94 -34.590 -11.069 -11.098
   11    HZ3  LYS  94           HZ1      LYS  94 -36.481 -12.533 -11.304
   12    HZ2  LYS  94           HZ2      LYS  94 -37.426 -11.504 -10.337
   13    HZ1  LYS  94           HZ3      LYS  94 -36.087 -12.306  -9.668

  No H/Q in entry =          13
  In of MODEL   68
    1    H    ALA  95           H        ALA  95 -32.450  -5.923  -7.364
    2    HA   ALA  95           HA       ALA  95 -34.255  -4.330  -5.846
    3    HB2  ALA  95           HB1      ALA  95 -31.919  -5.783  -5.344
    4    HB3  ALA  95           HB2      ALA  95 -32.872  -4.879  -4.168
    5    HB1  ALA  95           HB3      ALA  95 -31.503  -4.111  -4.971

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ALA  96           H        ALA  96 -31.590  -3.499  -7.922
    2    HA   ALA  96           HA       ALA  96 -31.416  -0.761  -7.080
    3    HB2  ALA  96           HB1      ALA  96 -30.047  -0.520  -9.184
    4    HB3  ALA  96           HB2      ALA  96 -30.400  -2.211  -9.546
    5    HB1  ALA  96           HB3      ALA  96 -29.472  -1.792  -8.106

  No H/Q in entry =           5
  In of MODEL   68
    1    H    VAL  97           H        VAL  97 -32.996  -2.364  -9.808
    2    HA   VAL  97           HA       VAL  97 -33.999  -0.004 -11.005
    3    HB   VAL  97           HB       VAL  97 -34.892  -2.902 -11.119
    4   HG11  VAL  97          HG11      VAL  97 -36.626  -0.834 -11.554
    5   HG13  VAL  97          HG12      VAL  97 -36.731  -2.405 -12.350
    6   HG12  VAL  97          HG13      VAL  97 -35.939  -1.057 -13.164
    7   HG21  VAL  97          HG21      VAL  97 -33.561  -1.063 -13.109
    8   HG23  VAL  97          HG22      VAL  97 -34.062  -2.721 -13.440
    9   HG22  VAL  97          HG23      VAL  97 -32.803  -2.400 -12.246

  No H/Q in entry =           9
  In of MODEL   68
    1    H    ALA  98           H        ALA  98 -35.245  -2.210  -8.523
    2    HA   ALA  98           HA       ALA  98 -37.771  -0.995  -8.141
    3    HB1  ALA  98           HB1      ALA  98 -36.822  -3.249  -7.165
    4    HB3  ALA  98           HB2      ALA  98 -37.975  -2.314  -6.210
    5    HB2  ALA  98           HB3      ALA  98 -36.251  -2.225  -5.848

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ALA  99           H        ALA  99 -34.670  -0.330  -6.477
    2    HA   ALA  99           HA       ALA  99 -35.739   1.644  -4.765
    3    HB1  ALA  99           HB1      ALA  99 -33.119   0.695  -5.536
    4    HB2  ALA  99           HB2      ALA  99 -33.646   1.423  -4.018
    5    HB3  ALA  99           HB3      ALA  99 -33.140   2.449  -5.359

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ILE 100           H        ILE 100 -34.695   1.828  -8.117
    2    HA   ILE 100           HA       ILE 100 -34.787   4.685  -8.263
    3    HB   ILE 100           HB       ILE 100 -34.949   2.590 -10.456
    4   HG12  ILE 100          HG12      ILE 100 -32.725   4.497  -9.736
    5   HG13  ILE 100          HG13      ILE 100 -32.812   2.837  -9.148
    6   HG21  ILE 100          HG21      ILE 100 -35.281   5.524 -10.511
    7   HG23  ILE 100          HG22      ILE 100 -35.826   4.300 -11.659
    8   HG22  ILE 100          HG23      ILE 100 -34.155   4.866 -11.700
    9   HD12  ILE 100          HD11      ILE 100 -32.250   3.848 -11.897
   10   HD11  ILE 100          HD12      ILE 100 -32.960   2.248 -11.683
   11   HD13  ILE 100          HD13      ILE 100 -31.401   2.625 -10.954

  No H/Q in entry =          11
  In of MODEL   68
    1    H    LYS 101           H        LYS 101 -37.160   2.167  -9.054
    2    HA   LYS 101           HA       LYS 101 -39.189   3.904 -10.009
    3    HB2  LYS 101           HB2      LYS 101 -39.159   1.100  -8.953
    4    HB3  LYS 101           HB3      LYS 101 -40.687   1.918  -9.278
    5    HG2  LYS 101           HG2      LYS 101 -40.208   2.097 -11.571
    6    HG3  LYS 101           HG3      LYS 101 -38.525   1.633 -11.329
    7    HD2  LYS 101           HD2      LYS 101 -39.833  -0.213 -12.262
    8    HD3  LYS 101           HD3      LYS 101 -39.218  -0.603 -10.657
    9    HE2  LYS 101           HE2      LYS 101 -41.301  -1.247 -10.167
   10    HE3  LYS 101           HE3      LYS 101 -41.705   0.470 -10.126
   11    HZ3  LYS 101           HZ1      LYS 101 -42.600   0.395 -12.247
   12    HZ2  LYS 101           HZ2      LYS 101 -43.106  -1.081 -11.576
   13    HZ1  LYS 101           HZ3      LYS 101 -41.799  -1.045 -12.660

  No H/Q in entry =          13
  In of MODEL   68
    1    H    LYS 102           H        LYS 102 -38.743   2.330  -6.841
    2    HA   LYS 102           HA       LYS 102 -40.953   3.563  -5.610
    3    HB2  LYS 102           HB2      LYS 102 -39.775   1.633  -4.645
    4    HB3  LYS 102           HB3      LYS 102 -38.352   2.638  -4.375
    5    HG2  LYS 102           HG2      LYS 102 -39.626   4.033  -2.841
    6    HG3  LYS 102           HG3      LYS 102 -41.051   3.033  -3.114
    7    HD2  LYS 102           HD2      LYS 102 -39.884   1.103  -2.137
    8    HD3  LYS 102           HD3      LYS 102 -38.458   2.106  -1.863
    9    HE2  LYS 102           HE2      LYS 102 -39.767   3.588  -0.415
   10    HE3  LYS 102           HE3      LYS 102 -41.209   2.617  -0.710
   11    HZ1  LYS 102           HZ1      LYS 102 -39.544   0.784   0.247
   12    HZ3  LYS 102           HZ2      LYS 102 -40.626   1.679   1.201
   13    HZ2  LYS 102           HZ3      LYS 102 -39.000   2.157   1.086

  No H/Q in entry =          13
  In of MODEL   68
    1    H    ALA 103           H        ALA 103 -37.957   4.888  -6.588
    2    HA   ALA 103           HA       ALA 103 -38.109   7.161  -4.746
    3    HB2  ALA 103           HB1      ALA 103 -36.095   7.875  -6.302
    4    HB3  ALA 103           HB2      ALA 103 -36.113   6.168  -6.746
    5    HB1  ALA 103           HB3      ALA 103 -35.870   6.640  -5.065

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ALA 104           H        ALA 104 -38.751   6.538  -8.110
    2    HA   ALA 104           HA       ALA 104 -39.250   9.354  -8.658
    3    HB2  ALA 104           HB1      ALA 104 -39.312   8.746 -10.877
    4    HB1  ALA 104           HB2      ALA 104 -40.088   7.199 -10.541
    5    HB3  ALA 104           HB3      ALA 104 -38.358   7.400 -10.255

  No H/Q in entry =           5
  In of MODEL   68
    1    H    ALA 105           H        ALA 105 -40.923   7.253  -6.909
    2    HA   ALA 105           HA       ALA 105 -43.304   8.721  -6.844
    3    HB2  ALA 105           HB1      ALA 105 -44.073   7.938  -8.904
    4    HB3  ALA 105           HB2      ALA 105 -44.747   6.740  -7.799
    5    HB1  ALA 105           HB3      ALA 105 -43.288   6.370  -8.718

  No H/Q in entry =           5
  In of MODEL   69
    1    H1   ALA   1           H3       ALA   1 -12.320 -15.616  -2.182
    2    H2   ALA   1           H2       ALA   1 -11.393 -16.757  -3.041
    3    H3   ALA   1           H1       ALA   1 -12.545 -15.804  -3.854
    4    HA   ALA   1           HA       ALA   1 -13.945 -17.502  -3.605
    5    HB3  ALA   1           HB1      ALA   1 -12.548 -19.280  -3.170
    6    HB1  ALA   1           HB2      ALA   1 -13.283 -19.174  -1.571
    7    HB2  ALA   1           HB3      ALA   1 -11.709 -18.436  -1.869

  No H/Q in entry =           7
  In of MODEL   69
    1    H    GLU   2           H        GLU   2 -15.548 -18.361  -1.934
    2    HA   GLU   2           HA       GLU   2 -17.178 -16.642  -0.844
    3    HB2  GLU   2           HB2      GLU   2 -16.225 -19.078   0.675
    4    HB3  GLU   2           HB3      GLU   2 -17.743 -18.225   0.954
    5    HG2  GLU   2           HG2      GLU   2 -18.748 -19.300  -0.773
    6    HG3  GLU   2           HG3      GLU   2 -17.439 -18.897  -1.873

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLU   3           H        GLU   3 -15.234 -18.014   1.746
    2    HA   GLU   3           HA       GLU   3 -15.429 -15.669   3.319
    3    HB2  GLU   3           HB2      GLU   3 -13.847 -18.221   3.535
    4    HB3  GLU   3           HB3      GLU   3 -13.597 -16.908   4.686
    5    HG2  GLU   3           HG2      GLU   3 -15.780 -17.058   5.532
    6    HG3  GLU   3           HG3      GLU   3 -16.396 -17.848   4.087

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LEU   4           H        LEU   4 -12.497 -17.148   1.881
    2    HA   LEU   4           HA       LEU   4 -10.649 -15.253   2.465
    3    HB2  LEU   4           HB2      LEU   4 -10.919 -16.536  -0.263
    4    HB3  LEU   4           HB3      LEU   4  -9.456 -15.823   0.407
    5    HG   LEU   4           HG       LEU   4 -10.943 -18.222   1.526
    6   HD13  LEU   4          HD11      LEU   4  -9.327 -19.577   0.568
    7   HD12  LEU   4          HD12      LEU   4  -8.114 -18.297   0.533
    8   HD11  LEU   4          HD13      LEU   4  -9.418 -18.309  -0.653
    9   HD23  LEU   4          HD21      LEU   4  -8.674 -18.299   2.878
   10   HD22  LEU   4          HD22      LEU   4  -9.985 -17.258   3.430
   11   HD21  LEU   4          HD23      LEU   4  -8.632 -16.569   2.533

  No H/Q in entry =          11
  In of MODEL   69
    1    H    GLU   5           H        GLU   5 -13.018 -15.025  -0.177
    2    HA   GLU   5           HA       GLU   5 -12.021 -12.540  -1.177
    3    HB2  GLU   5           HB2      GLU   5 -13.391 -14.117  -2.528
    4    HB3  GLU   5           HB3      GLU   5 -14.777 -13.749  -1.500
    5    HG2  GLU   5           HG2      GLU   5 -14.630 -11.375  -2.135
    6    HG3  GLU   5           HG3      GLU   5 -13.232 -11.729  -3.149

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLU   6           H        GLU   6 -14.721 -13.421   0.945
    2    HA   GLU   6           HA       GLU   6 -15.612 -10.744   1.371
    3    HB2  GLU   6           HB2      GLU   6 -17.033 -12.743   1.777
    4    HB3  GLU   6           HB3      GLU   6 -15.990 -13.181   3.130
    5    HG2  GLU   6           HG2      GLU   6 -16.509 -11.041   4.234
    6    HG3  GLU   6           HG3      GLU   6 -17.547 -10.591   2.882

  No H/Q in entry =           6
  In of MODEL   69
    1    H    VAL   7           H        VAL   7 -13.291 -12.869   2.901
    2    HA   VAL   7           HA       VAL   7 -12.790 -11.308   5.230
    3    HB   VAL   7           HB       VAL   7 -11.111 -13.349   3.748
    4   HG11  VAL   7          HG11      VAL   7 -10.605 -11.831   6.314
    5   HG13  VAL   7          HG12      VAL   7  -9.524 -12.042   4.938
    6   HG12  VAL   7          HG13      VAL   7  -9.867 -13.403   6.005
    7   HG21  VAL   7          HG21      VAL   7 -13.348 -13.913   4.994
    8   HG23  VAL   7          HG22      VAL   7 -12.401 -13.650   6.459
    9   HG22  VAL   7          HG23      VAL   7 -11.926 -14.905   5.316

  No H/Q in entry =           9
  In of MODEL   69
    1    H    VAL   8           H        VAL   8 -11.321 -11.410   2.000
    2    HA   VAL   8           HA       VAL   8  -9.246  -9.546   2.476
    3    HB   VAL   8           HB       VAL   8 -10.744 -10.214  -0.069
    4   HG13  VAL   8          HG11      VAL   8  -9.777  -8.045  -0.388
    5   HG12  VAL   8          HG12      VAL   8  -8.669  -9.190  -1.146
    6   HG11  VAL   8          HG13      VAL   8  -8.289  -8.515   0.438
    7   HG22  VAL   8          HG21      VAL   8  -9.231 -11.933  -0.356
    8   HG21  VAL   8          HG22      VAL   8  -9.056 -11.813   1.393
    9   HG23  VAL   8          HG23      VAL   8  -7.899 -11.006   0.339

  No H/Q in entry =           9
  In of MODEL   69
    1    H    MET   9           H        MET   9 -12.605  -9.140   1.361
    2    HA   MET   9           HA       MET   9 -12.539  -6.362   0.941
    3    HB2  MET   9           HB2      MET   9 -14.744  -8.240   1.781
    4    HB3  MET   9           HB3      MET   9 -15.027  -6.508   1.593
    5    HG2  MET   9           HG2      MET   9 -14.228  -6.616  -0.731
    6    HG3  MET   9           HG3      MET   9 -13.910  -8.341  -0.549
    7    HE3  MET   9           HE1      MET   9 -17.924  -6.156  -0.637
    8    HE2  MET   9           HE2      MET   9 -16.581  -5.759  -1.705
    9    HE1  MET   9           HE3      MET   9 -16.391  -5.590   0.038

  No H/Q in entry =           9
  In of MODEL   69
    1    H    GLY  10           H        GLY  10 -13.169  -8.266   3.866
    2    HA3  GLY  10           HA2      GLY  10 -13.689  -6.089   5.603
    3    HA2  GLY  10           HA3      GLY  10 -13.123  -7.682   6.102

  No H/Q in entry =           3
  In of MODEL   69
    1    H    LEU  11           H        LEU  11 -10.695  -7.806   4.755
    2    HA   LEU  11           HA       LEU  11  -8.968  -6.386   6.497
    3    HB2  LEU  11           HB2      LEU  11  -8.458  -7.798   3.875
    4    HB3  LEU  11           HB3      LEU  11  -7.174  -7.101   4.861
    5    HG   LEU  11           HG       LEU  11  -9.168  -9.135   5.893
    6   HD13  LEU  11          HD11      LEU  11  -7.970 -10.366   4.306
    7   HD12  LEU  11          HD12      LEU  11  -7.016 -10.615   5.768
    8   HD11  LEU  11          HD13      LEU  11  -6.488  -9.445   4.560
    9   HD22  LEU  11          HD21      LEU  11  -8.287  -8.134   7.804
   10   HD21  LEU  11          HD22      LEU  11  -6.759  -7.732   7.023
   11   HD23  LEU  11          HD23      LEU  11  -7.082  -9.390   7.528

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  12           H        ILE  12  -9.912  -5.819   3.122
    2    HA   ILE  12           HA       ILE  12  -8.220  -3.591   2.685
    3    HB   ILE  12           HB       ILE  12 -10.894  -4.243   1.421
    4   HG12  ILE  12          HG12      ILE  12  -8.859  -5.904   1.319
    5   HG13  ILE  12          HG13      ILE  12  -9.752  -5.551  -0.147
    6   HG23  ILE  12          HG21      ILE  12 -10.348  -1.938   0.950
    7   HG22  ILE  12          HG22      ILE  12  -9.931  -2.858  -0.489
    8   HG21  ILE  12          HG23      ILE  12  -8.693  -2.356   0.626
    9   HD13  ILE  12          HD11      ILE  12  -8.041  -4.004  -0.863
   10   HD12  ILE  12          HD12      ILE  12  -7.248  -5.505  -0.392
   11   HD11  ILE  12          HD13      ILE  12  -7.219  -4.126   0.681

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  13           H        ILE  13 -11.568  -3.857   3.820
    2    HA   ILE  13           HA       ILE  13 -12.019  -1.070   4.110
    3    HB   ILE  13           HB       ILE  13 -13.211  -3.497   5.471
    4   HG12  ILE  13          HG12      ILE  13 -13.482  -2.988   2.955
    5   HG13  ILE  13          HG13      ILE  13 -14.923  -3.350   3.882
    6   HG22  ILE  13          HG21      ILE  13 -15.111  -1.753   5.970
    7   HG21  ILE  13          HG22      ILE  13 -13.815  -0.570   5.856
    8   HG23  ILE  13          HG23      ILE  13 -13.729  -1.856   7.057
    9   HD11  ILE  13          HD11      ILE  13 -14.172  -0.485   3.793
   10   HD13  ILE  13          HD12      ILE  13 -15.745  -1.252   3.687
   11   HD12  ILE  13          HD13      ILE  13 -14.719  -1.196   2.271

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ASN  14           H        ASN  14 -10.883  -3.574   6.358
    2    HA   ASN  14           HA       ASN  14 -10.650  -1.948   8.649
    3    HB2  ASN  14           HB2      ASN  14 -10.406  -4.555   8.310
    4    HB3  ASN  14           HB3      ASN  14  -8.698  -4.169   8.133
    5   HD21  ASN  14          HD21      ASN  14  -9.309  -5.704  10.309
    6   HD22  ASN  14          HD22      ASN  14  -9.262  -4.791  11.738

  No H/Q in entry =           6
  In of MODEL   69
    1    H    SER  15           H        SER  15  -8.281  -2.762   6.123
    2    HA   SER  15           HA       SER  15  -6.123  -1.278   7.175
    3    HB2  SER  15           HB2      SER  15  -5.132  -1.479   4.999
    4    HB3  SER  15           HB3      SER  15  -6.078  -2.944   5.235
    5    HG   SER  15           HG       SER  15  -7.058  -2.376   3.477

  No H/Q in entry =           5
  In of MODEL   69
    1    H    GLY  16           H        GLY  16  -8.751  -0.397   4.965
    2    HA3  GLY  16           HA2      GLY  16  -7.898   2.246   4.416
    3    HA2  GLY  16           HA3      GLY  16  -9.551   1.653   4.272

  No H/Q in entry =           3
  In of MODEL   69
    1    H    GLN  17           H        GLN  17 -10.061   0.915   6.925
    2    HA   GLN  17           HA       GLN  17 -10.752   3.414   8.087
    3    HB2  GLN  17           HB2      GLN  17 -10.643   0.623   9.244
    4    HB3  GLN  17           HB3      GLN  17 -11.246   2.017  10.141
    5    HG2  GLN  17           HG2      GLN  17 -12.953   2.416   8.432
    6    HG3  GLN  17           HG3      GLN  17 -12.323   1.084   7.464
    7   HE21  GLN  17          HE21      GLN  17 -14.692   1.844   9.737
    8   HE22  GLN  17          HE22      GLN  17 -15.003   0.277  10.312

  No H/Q in entry =           8
  In of MODEL   69
    1    H    ALA  18           H        ALA  18  -8.117   1.129   8.662
    2    HA   ALA  18           HA       ALA  18  -6.990   2.333  10.924
    3    HB2  ALA  18           HB1      ALA  18  -6.398   0.124   9.538
    4    HB3  ALA  18           HB2      ALA  18  -5.222   0.902  10.598
    5    HB1  ALA  18           HB3      ALA  18  -5.166   1.189   8.858

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ARG  19           H        ARG  19  -6.262   2.874   7.469
    2    HA   ARG  19           HA       ARG  19  -4.359   4.919   7.884
    3    HB2  ARG  19           HB2      ARG  19  -4.714   3.790   5.687
    4    HB3  ARG  19           HB3      ARG  19  -6.258   4.631   5.534
    5    HG2  ARG  19           HG2      ARG  19  -5.129   6.802   5.599
    6    HG3  ARG  19           HG3      ARG  19  -3.577   6.016   5.880
    7    HD2  ARG  19           HD2      ARG  19  -3.731   6.618   3.541
    8    HD3  ARG  19           HD3      ARG  19  -3.814   4.857   3.679
    9    HE   ARG  19           HE       ARG  19  -6.448   5.765   3.709
   10   HH21  ARG  19          HH11      ARG  19  -7.667   5.930   1.807
   11   HH22  ARG  19          HH12      ARG  19  -6.864   6.016   0.277
   12   HH11  ARG  19          HH21      ARG  19  -3.698   5.840   1.641
   13   HH12  ARG  19          HH22      ARG  19  -4.616   5.962   0.183

  No H/Q in entry =          13
  In of MODEL   69
    1    H    SER  20           H        SER  20  -7.864   5.036   7.328
    2    HA   SER  20           HA       SER  20  -8.223   7.792   7.298
    3    HB2  SER  20           HB2      SER  20 -10.025   6.183   6.816
    4    HB3  SER  20           HB3      SER  20 -10.054   5.710   8.513
    5    HG   SER  20           HG       SER  20 -10.600   8.272   7.413

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LEU  21           H        LEU  21  -8.187   5.595  10.091
    2    HA   LEU  21           HA       LEU  21  -8.605   7.581  12.071
    3    HB2  LEU  21           HB2      LEU  21  -7.248   4.881  12.202
    4    HB3  LEU  21           HB3      LEU  21  -7.542   5.891  13.614
    5    HG   LEU  21           HG       LEU  21  -9.731   4.995  11.715
    6   HD11  LEU  21          HD11      LEU  21  -8.762   3.787  14.319
    7   HD13  LEU  21          HD12      LEU  21  -8.816   3.009  12.737
    8   HD12  LEU  21          HD13      LEU  21 -10.316   3.398  13.580
    9   HD21  LEU  21          HD21      LEU  21  -9.629   6.527  14.301
   10   HD23  LEU  21          HD22      LEU  21 -11.029   5.502  13.998
   11   HD22  LEU  21          HD23      LEU  21 -10.643   6.812  12.890

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ALA  22           H        ALA  22  -5.669   6.218  10.620
    2    HA   ALA  22           HA       ALA  22  -3.771   7.526  12.225
    3    HB2  ALA  22           HB1      ALA  22  -3.373   5.680  10.520
    4    HB1  ALA  22           HB2      ALA  22  -2.179   6.977  10.547
    5    HB3  ALA  22           HB3      ALA  22  -3.412   6.939   9.286

  No H/Q in entry =           5
  In of MODEL   69
    1    H    TYR  23           H        TYR  23  -5.128   8.556   9.064
    2    HA   TYR  23           HA       TYR  23  -3.796  11.054   8.990
    3    HB2  TYR  23           HB2      TYR  23  -4.899  10.152   7.007
    4    HB3  TYR  23           HB3      TYR  23  -6.468  10.250   7.807
    5    HD1  TYR  23           HD1      TYR  23  -3.587  12.304   6.624
    6    HD2  TYR  23           HD2      TYR  23  -7.710  12.262   7.823
    7    HE1  TYR  23           HE1      TYR  23  -3.826  14.658   5.879
    8    HE2  TYR  23           HE2      TYR  23  -7.951  14.615   7.078
    9    HH   TYR  23           HH       TYR  23  -5.570  16.193   5.184

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ALA  24           H        ALA  24  -6.897  10.066  10.402
    2    HA   ALA  24           HA       ALA  24  -7.727  12.651  11.196
    3    HB1  ALA  24           HB1      ALA  24  -9.538  11.396  11.680
    4    HB2  ALA  24           HB2      ALA  24  -8.694  10.818  13.115
    5    HB3  ALA  24           HB3      ALA  24  -8.586   9.914  11.605

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ALA  25           H        ALA  25  -5.703  10.188  12.734
    2    HA   ALA  25           HA       ALA  25  -5.336  11.429  15.238
    3    HB2  ALA  25           HB1      ALA  25  -4.576   9.082  14.396
    4    HB3  ALA  25           HB2      ALA  25  -3.548   9.936  15.549
    5    HB1  ALA  25           HB3      ALA  25  -3.133   9.928  13.834

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LEU  26           H        LEU  26  -3.583  11.745  12.177
    2    HA   LEU  26           HA       LEU  26  -1.615  13.563  13.078
    3    HB2  LEU  26           HB2      LEU  26  -1.338  12.421  10.965
    4    HB3  LEU  26           HB3      LEU  26  -2.820  13.131  10.332
    5    HG   LEU  26           HG       LEU  26  -1.806  15.382  10.466
    6   HD12  LEU  26          HD11      LEU  26   0.737  15.402  10.849
    7   HD11  LEU  26          HD12      LEU  26   0.524  13.818  11.588
    8   HD13  LEU  26          HD13      LEU  26  -0.276  15.228  12.281
    9   HD21  LEU  26          HD21      LEU  26  -0.078  13.336   9.040
   10   HD23  LEU  26          HD22      LEU  26  -0.128  15.059   8.678
   11   HD22  LEU  26          HD23      LEU  26  -1.553  14.061   8.403

  No H/Q in entry =          11
  In of MODEL   69
    1    H    LYS  27           H        LYS  27  -4.816  14.049  11.642
    2    HA   LYS  27           HA       LYS  27  -4.765  16.839  11.457
    3    HB2  LYS  27           HB2      LYS  27  -6.520  15.365  10.485
    4    HB3  LYS  27           HB3      LYS  27  -7.157  15.100  12.108
    5    HG2  LYS  27           HG2      LYS  27  -7.585  17.504  12.361
    6    HG3  LYS  27           HG3      LYS  27  -6.897  17.809  10.763
    7    HD2  LYS  27           HD2      LYS  27  -8.641  16.379   9.741
    8    HD3  LYS  27           HD3      LYS  27  -9.335  16.091  11.338
    9    HE2  LYS  27           HE2      LYS  27  -9.776  18.500  11.598
   10    HE3  LYS  27           HE3      LYS  27  -9.054  18.810  10.016
   11    HZ3  LYS  27           HZ1      LYS  27 -11.434  18.684   9.802
   12    HZ2  LYS  27           HZ2      LYS  27 -11.472  17.164  10.565
   13    HZ1  LYS  27           HZ3      LYS  27 -10.745  17.335   9.036

  No H/Q in entry =          13
  In of MODEL   69
    1    H    GLN  28           H        GLN  28  -5.619  14.739  14.184
    2    HA   GLN  28           HA       GLN  28  -6.494  16.734  15.981
    3    HB2  GLN  28           HB2      GLN  28  -5.087  14.099  16.490
    4    HB3  GLN  28           HB3      GLN  28  -5.806  15.098  17.755
    5    HG2  GLN  28           HG2      GLN  28  -7.304  13.986  15.365
    6    HG3  GLN  28           HG3      GLN  28  -7.344  13.299  16.988
    7   HE21  GLN  28          HE21      GLN  28  -9.257  15.075  15.057
    8   HE22  GLN  28          HE22      GLN  28  -9.977  16.112  16.190

  No H/Q in entry =           8
  In of MODEL   69
    1    H    ALA  29           H        ALA  29  -3.283  15.441  15.246
    2    HA   ALA  29           HA       ALA  29  -1.821  16.829  17.213
    3    HB1  ALA  29           HB1      ALA  29   0.096  16.143  16.067
    4    HB3  ALA  29           HB2      ALA  29  -0.678  16.275  14.488
    5    HB2  ALA  29           HB3      ALA  29  -1.087  14.937  15.561

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LYS  30           H        LYS  30  -2.719  17.725  13.899
    2    HA   LYS  30           HA       LYS  30  -1.307  20.163  13.793
    3    HB2  LYS  30           HB2      LYS  30  -3.856  19.301  12.411
    4    HB3  LYS  30           HB3      LYS  30  -3.024  20.816  12.064
    5    HG2  LYS  30           HG2      LYS  30  -0.963  19.521  11.519
    6    HG3  LYS  30           HG3      LYS  30  -1.869  18.026  11.768
    7    HD2  LYS  30           HD2      LYS  30  -3.454  18.678   9.996
    8    HD3  LYS  30           HD3      LYS  30  -2.571  20.186   9.749
    9    HE2  LYS  30           HE2      LYS  30  -0.549  18.891   9.138
   10    HE3  LYS  30           HE3      LYS  30  -1.452  17.389   9.354
   11    HZ2  LYS  30           HZ1      LYS  30  -1.303  18.271   7.014
   12    HZ1  LYS  30           HZ2      LYS  30  -2.337  19.534   7.502
   13    HZ3  LYS  30           HZ3      LYS  30  -2.865  17.918   7.572

  No H/Q in entry =          13
  In of MODEL   69
    1    H    GLN  31           H        GLN  31  -4.391  19.312  15.239
    2    HA   GLN  31           HA       GLN  31  -5.141  22.068  15.715
    3    HB2  GLN  31           HB2      GLN  31  -6.311  19.619  17.040
    4    HB3  GLN  31           HB3      GLN  31  -7.069  21.194  16.812
    5    HG2  GLN  31           HG2      GLN  31  -6.394  20.428  14.209
    6    HG3  GLN  31           HG3      GLN  31  -6.914  18.921  14.955
    7   HE21  GLN  31          HE21      GLN  31  -8.345  20.510  12.880
    8   HE22  GLN  31          HE22      GLN  31  -9.849  20.903  13.559

  No H/Q in entry =           8
  In of MODEL   69
    1    H    GLY  32           H        GLY  32  -2.819  20.127  16.996
    2    HA3  GLY  32           HA2      GLY  32  -1.394  20.575  18.782
    3    HA2  GLY  32           HA3      GLY  32  -2.512  21.819  19.327

  No H/Q in entry =           3
  In of MODEL   69
    1    H    ASP  33           H        ASP  33  -3.953  18.788  18.667
    2    HA   ASP  33           HA       ASP  33  -4.329  18.317  21.550
    3    HB2  ASP  33           HB2      ASP  33  -5.770  17.323  19.085
    4    HB3  ASP  33           HB3      ASP  33  -6.097  16.706  20.702

  No H/Q in entry =           4
  In of MODEL   69
    1    H    PHE  34           H        PHE  34  -2.160  17.457  21.823
    2    HA   PHE  34           HA       PHE  34  -1.186  15.211  20.398
    3    HB2  PHE  34           HB2      PHE  34  -0.529  16.179  23.189
    4    HB3  PHE  34           HB3      PHE  34   0.384  14.957  22.304
    5    HD1  PHE  34           HD1      PHE  34   0.233  18.379  23.059
    6    HD2  PHE  34           HD2      PHE  34   1.012  15.691  19.799
    7    HE1  PHE  34           HE1      PHE  34   1.520  20.152  21.898
    8    HE2  PHE  34           HE2      PHE  34   2.294  17.466  18.643
    9    HZ   PHE  34           HZ       PHE  34   2.551  19.694  19.697

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ALA  35           H        ALA  35  -3.188  15.481  23.288
    2    HA   ALA  35           HA       ALA  35  -2.974  12.813  24.167
    3    HB3  ALA  35           HB1      ALA  35  -5.418  13.443  25.059
    4    HB1  ALA  35           HB2      ALA  35  -4.885  15.062  24.605
    5    HB2  ALA  35           HB3      ALA  35  -3.959  14.128  25.780

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ALA  36           H        ALA  36  -5.445  14.350  22.107
    2    HA   ALA  36           HA       ALA  36  -6.875  11.946  21.635
    3    HB1  ALA  36           HB1      ALA  36  -8.338  13.379  20.705
    4    HB3  ALA  36           HB2      ALA  36  -7.180  13.802  19.443
    5    HB2  ALA  36           HB3      ALA  36  -7.182  14.682  20.972

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ALA  37           H        ALA  37  -4.211  13.533  19.940
    2    HA   ALA  37           HA       ALA  37  -4.211  11.910  17.634
    3    HB3  ALA  37           HB1      ALA  37  -2.194  13.606  19.041
    4    HB2  ALA  37           HB2      ALA  37  -2.746  13.673  17.368
    5    HB1  ALA  37           HB3      ALA  37  -1.590  12.436  17.867

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LYS  38           H        LYS  38  -2.416  11.580  20.688
    2    HA   LYS  38           HA       LYS  38  -1.106   9.178  20.169
    3    HB2  LYS  38           HB2      LYS  38  -1.395  10.930  22.328
    4    HB3  LYS  38           HB3      LYS  38  -2.012   9.400  22.944
    5    HG2  LYS  38           HG2      LYS  38   0.072   8.275  22.375
    6    HG3  LYS  38           HG3      LYS  38   0.675   9.722  21.561
    7    HD2  LYS  38           HD2      LYS  38   0.875  10.929  23.600
    8    HD3  LYS  38           HD3      LYS  38  -0.138   9.777  24.474
    9    HE2  LYS  38           HE2      LYS  38   2.224   9.450  25.061
   10    HE3  LYS  38           HE3      LYS  38   1.604   8.040  24.197
   11    HZ3  LYS  38           HZ1      LYS  38   2.883   8.464  22.402
   12    HZ2  LYS  38           HZ2      LYS  38   3.856   9.283  23.531
   13    HZ1  LYS  38           HZ3      LYS  38   2.767  10.152  22.558

  No H/Q in entry =          13
  In of MODEL   69
    1    H    ALA  39           H        ALA  39  -4.324   9.677  21.616
    2    HA   ALA  39           HA       ALA  39  -4.888   6.957  22.112
    3    HB3  ALA  39           HB1      ALA  39  -7.049   8.914  21.384
    4    HB2  ALA  39           HB2      ALA  39  -6.131   9.129  22.874
    5    HB1  ALA  39           HB3      ALA  39  -7.057   7.650  22.614

  No H/Q in entry =           5
  In of MODEL   69
    1    H    MET  40           H        MET  40  -5.502   8.988  19.284
    2    HA   MET  40           HA       MET  40  -7.004   7.069  17.833
    3    HB2  MET  40           HB2      MET  40  -5.397   9.464  16.920
    4    HB3  MET  40           HB3      MET  40  -6.440   8.515  15.858
    5    HG2  MET  40           HG2      MET  40  -7.437   9.753  18.436
    6    HG3  MET  40           HG3      MET  40  -7.512  10.596  16.891
    7    HE3  MET  40           HE1      MET  40 -10.127   8.997  14.851
    8    HE2  MET  40           HE2      MET  40  -8.376   9.109  14.681
    9    HE1  MET  40           HE3      MET  40  -9.281  10.474  15.334

  No H/Q in entry =           9
  In of MODEL   69
    1    H    MET  41           H        MET  41  -3.509   7.794  17.914
    2    HA   MET  41           HA       MET  41  -2.783   6.049  15.795
    3    HB2  MET  41           HB2      MET  41  -1.133   6.697  18.251
    4    HB3  MET  41           HB3      MET  41  -0.537   6.055  16.724
    5    HG2  MET  41           HG2      MET  41  -1.699   8.247  15.747
    6    HG3  MET  41           HG3      MET  41  -1.440   8.825  17.391
    7    HE2  MET  41           HE1      MET  41   1.476   6.716  17.704
    8    HE1  MET  41           HE2      MET  41   0.703   8.007  18.619
    9    HE3  MET  41           HE3      MET  41   2.318   8.249  17.957

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ASP  42           H        ASP  42  -3.125   5.558  19.283
    2    HA   ASP  42           HA       ASP  42  -2.095   2.960  19.416
    3    HB2  ASP  42           HB2      ASP  42  -2.940   4.712  21.259
    4    HB3  ASP  42           HB3      ASP  42  -4.371   3.691  21.199

  No H/Q in entry =           4
  In of MODEL   69
    1    H    GLN  43           H        GLN  43  -5.432   4.076  18.964
    2    HA   GLN  43           HA       GLN  43  -6.585   1.493  18.769
    3    HB2  GLN  43           HB2      GLN  43  -7.515   4.154  17.667
    4    HB3  GLN  43           HB3      GLN  43  -8.482   2.678  17.648
    5    HG2  GLN  43           HG2      GLN  43  -8.157   2.542  20.151
    6    HG3  GLN  43           HG3      GLN  43  -7.429   4.145  20.080
    7   HE21  GLN  43          HE21      GLN  43  -9.589   4.223  21.608
    8   HE22  GLN  43          HE22      GLN  43 -10.958   4.807  20.797

  No H/Q in entry =           8
  In of MODEL   69
    1    H    SER  44           H        SER  44  -5.269   3.717  16.353
    2    HA   SER  44           HA       SER  44  -6.003   2.247  14.065
    3    HB2  SER  44           HB2      SER  44  -4.734   4.625  14.506
    4    HB3  SER  44           HB3      SER  44  -3.390   3.628  13.953
    5    HG   SER  44           HG       SER  44  -4.522   4.613  12.210

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ARG  45           H        ARG  45  -3.100   2.115  16.108
    2    HA   ARG  45           HA       ARG  45  -1.643   0.164  14.696
    3    HB2  ARG  45           HB2      ARG  45  -0.774   1.572  16.562
    4    HB3  ARG  45           HB3      ARG  45  -1.754   0.638  17.690
    5    HG2  ARG  45           HG2      ARG  45  -0.536  -1.420  17.020
    6    HG3  ARG  45           HG3      ARG  45   0.469  -0.462  15.935
    7    HD2  ARG  45           HD2      ARG  45   1.232   0.906  17.889
    8    HD3  ARG  45           HD3      ARG  45   0.320  -0.173  18.968
    9    HE   ARG  45           HE       ARG  45   1.994  -1.764  17.357
   10   HH21  ARG  45          HH11      ARG  45   3.903  -2.597  18.166
   11   HH22  ARG  45          HH12      ARG  45   4.694  -1.821  19.492
   12   HH11  ARG  45          HH21      ARG  45   2.335   0.688  19.757
   13   HH12  ARG  45          HH22      ARG  45   3.806   0.042  20.390

  No H/Q in entry =          13
  In of MODEL   69
    1    H    MET  46           H        MET  46  -4.009  -0.164  17.324
    2    HA   MET  46           HA       MET  46  -3.846  -2.966  17.613
    3    HB2  MET  46           HB2      MET  46  -5.995  -0.952  18.256
    4    HB3  MET  46           HB3      MET  46  -6.214  -2.674  18.579
    5    HG2  MET  46           HG2      MET  46  -4.207  -2.701  19.975
    6    HG3  MET  46           HG3      MET  46  -3.891  -1.014  19.601
    7    HE3  MET  46           HE1      MET  46  -7.643  -2.669  20.794
    8    HE2  MET  46           HE2      MET  46  -6.832  -3.011  22.319
    9    HE1  MET  46           HE3      MET  46  -6.139  -3.598  20.809

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ALA  47           H        ALA  47  -5.885  -0.930  15.555
    2    HA   ALA  47           HA       ALA  47  -7.523  -2.970  14.498
    3    HB3  ALA  47           HB1      ALA  47  -8.200  -0.728  14.103
    4    HB1  ALA  47           HB2      ALA  47  -7.733  -1.354  12.522
    5    HB2  ALA  47           HB3      ALA  47  -6.638  -0.294  13.412

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LEU  48           H        LEU  48  -4.413  -1.666  13.416
    2    HA   LEU  48           HA       LEU  48  -4.166  -3.244  11.063
    3    HB2  LEU  48           HB2      LEU  48  -2.082  -1.983  12.853
    4    HB3  LEU  48           HB3      LEU  48  -1.736  -2.696  11.277
    5    HG   LEU  48           HG       LEU  48  -3.745  -0.473  11.704
    6   HD13  LEU  48          HD11      LEU  48  -1.612   0.390  12.349
    7   HD12  LEU  48          HD12      LEU  48  -1.905   0.955  10.704
    8   HD11  LEU  48          HD13      LEU  48  -0.809  -0.398  10.991
    9   HD22  LEU  48          HD21      LEU  48  -4.246  -1.444   9.629
   10   HD21  LEU  48          HD22      LEU  48  -2.568  -1.884   9.310
   11   HD23  LEU  48          HD23      LEU  48  -3.083  -0.202   9.167

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ASN  49           H        ASN  49  -3.082  -3.664  14.393
    2    HA   ASN  49           HA       ASN  49  -1.493  -5.932  14.030
    3    HB2  ASN  49           HB2      ASN  49  -1.500  -4.598  16.085
    4    HB3  ASN  49           HB3      ASN  49  -3.148  -5.104  16.431
    5   HD21  ASN  49          HD21      ASN  49  -2.485  -6.127  18.438
    6   HD22  ASN  49          HD22      ASN  49  -1.618  -7.585  18.437

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLU  50           H        GLU  50  -4.952  -5.645  14.746
    2    HA   GLU  50           HA       GLU  50  -5.476  -8.443  14.844
    3    HB2  GLU  50           HB2      GLU  50  -7.043  -6.753  15.749
    4    HB3  GLU  50           HB3      GLU  50  -7.354  -6.178  14.110
    5    HG2  GLU  50           HG2      GLU  50  -8.237  -8.366  13.469
    6    HG3  GLU  50           HG3      GLU  50  -7.840  -9.021  15.054

  No H/Q in entry =           6
  In of MODEL   69
    1    H    ALA  51           H        ALA  51  -5.564  -6.029  12.263
    2    HA   ALA  51           HA       ALA  51  -6.583  -7.740  10.243
    3    HB2  ALA  51           HB1      ALA  51  -6.370  -5.920   8.882
    4    HB1  ALA  51           HB2      ALA  51  -4.722  -5.583   9.413
    5    HB3  ALA  51           HB3      ALA  51  -6.091  -5.070  10.401

  No H/Q in entry =           5
  In of MODEL   69
    1    H    HIS  52           H        HIS  52  -3.276  -6.856  11.192
    2    HA   HIS  52           HA       HIS  52  -1.909  -8.342   9.217
    3    HB2  HIS  52           HB2      HIS  52  -0.932  -6.594  10.772
    4    HB3  HIS  52           HB3      HIS  52  -0.928  -7.829  12.030
    5    HD1  HIS  52           HD1      HIS  52   0.198 -10.247  10.945
    6    HD2  HIS  52           HD2      HIS  52   1.516  -6.557   9.521
    7    HE1  HIS  52           HE1      HIS  52   2.463 -10.655   9.888
    8    HE2  HIS  52           HE2      HIS  52   3.280  -8.415   9.014

  No H/Q in entry =           8
  In of MODEL   69
    1    H    LEU  53           H        LEU  53  -3.087  -9.231  12.439
    2    HA   LEU  53           HA       LEU  53  -1.902 -11.783  12.603
    3    HB2  LEU  53           HB2      LEU  53  -4.361 -10.590  13.856
    4    HB3  LEU  53           HB3      LEU  53  -3.918 -12.273  14.128
    5    HG   LEU  53           HG       LEU  53  -2.010  -9.961  14.615
    6   HD13  LEU  53          HD11      LEU  53  -3.899  -9.691  16.117
    7   HD12  LEU  53          HD12      LEU  53  -2.543 -10.347  17.034
    8   HD11  LEU  53          HD13      LEU  53  -3.860 -11.402  16.534
    9   HD22  LEU  53          HD21      LEU  53  -0.686 -11.898  14.525
   10   HD21  LEU  53          HD22      LEU  53  -1.975 -12.923  15.146
   11   HD23  LEU  53          HD23      LEU  53  -1.101 -11.862  16.236

  No H/Q in entry =          11
  In of MODEL   69
    1    H    VAL  54           H        VAL  54  -5.023 -10.727  11.285
    2    HA   VAL  54           HA       VAL  54  -5.961 -13.311  10.593
    3    HB   VAL  54           HB       VAL  54  -6.604 -10.567   9.483
    4   HG12  VAL  54          HG11      VAL  54  -8.725 -11.927   8.688
    5   HG11  VAL  54          HG12      VAL  54  -7.621 -13.300   8.739
    6   HG13  VAL  54          HG13      VAL  54  -7.265 -11.921   7.701
    7   HG22  VAL  54          HG21      VAL  54  -7.485 -10.612  11.645
    8   HG21  VAL  54          HG22      VAL  54  -7.751 -12.354  11.618
    9   HG23  VAL  54          HG23      VAL  54  -8.836 -11.284  10.731

  No H/Q in entry =           9
  In of MODEL   69
    1    H    GLN  55           H        GLN  55  -4.095 -10.861   8.796
    2    HA   GLN  55           HA       GLN  55  -4.004 -12.312   6.369
    3    HB2  GLN  55           HB2      GLN  55  -3.387 -10.050   6.185
    4    HB3  GLN  55           HB3      GLN  55  -2.261 -10.142   7.536
    5    HG2  GLN  55           HG2      GLN  55  -0.565 -10.992   6.234
    6    HG3  GLN  55           HG3      GLN  55  -1.657 -11.954   5.247
    7   HE21  GLN  55          HE21      GLN  55  -1.695 -11.251   3.130
    8   HE22  GLN  55          HE22      GLN  55  -1.492  -9.645   2.627

  No H/Q in entry =           8
  In of MODEL   69
    1    H    THR  56           H        THR  56  -1.864 -12.322   9.224
    2    HA   THR  56           HA       THR  56   0.192 -13.930   8.272
    3    HB   THR  56           HB       THR  56  -1.016 -14.195  11.033
    4    HG1  THR  56           HG1      THR  56   0.732 -12.254   9.940
    5   HG23  THR  56          HG21      THR  56   0.686 -15.808  10.762
    6   HG22  THR  56          HG22      THR  56   1.505 -14.451  11.535
    7   HG21  THR  56          HG23      THR  56   1.684 -14.718   9.801

  No H/Q in entry =           7
  In of MODEL   69
    1    H    LYS  57           H        LYS  57  -2.918 -14.952   9.667
    2    HA   LYS  57           HA       LYS  57  -2.495 -17.750   9.399
    3    HB2  LYS  57           HB2      LYS  57  -4.289 -16.659  10.775
    4    HB3  LYS  57           HB3      LYS  57  -5.094 -16.187   9.285
    5    HG2  LYS  57           HG2      LYS  57  -5.369 -18.538   8.655
    6    HG3  LYS  57           HG3      LYS  57  -4.512 -19.046  10.107
    7    HD2  LYS  57           HD2      LYS  57  -6.271 -18.010  11.506
    8    HD3  LYS  57           HD3      LYS  57  -7.138 -17.519  10.052
    9    HE2  LYS  57           HE2      LYS  57  -8.113 -19.594  10.920
   10    HE3  LYS  57           HE3      LYS  57  -7.314 -19.933   9.386
   11    HZ3  LYS  57           HZ1      LYS  57  -5.433 -20.802  10.529
   12    HZ2  LYS  57           HZ2      LYS  57  -6.819 -21.553  11.165
   13    HZ1  LYS  57           HZ3      LYS  57  -6.043 -20.317  12.037

  No H/Q in entry =          13
  In of MODEL   69
    1    H    LEU  58           H        LEU  58  -3.835 -15.285   7.254
    2    HA   LEU  58           HA       LEU  58  -4.675 -17.092   5.246
    3    HB2  LEU  58           HB2      LEU  58  -4.048 -14.148   5.121
    4    HB3  LEU  58           HB3      LEU  58  -4.734 -15.072   3.784
    5    HG   LEU  58           HG       LEU  58  -5.980 -14.899   6.547
    6   HD11  LEU  58          HD11      LEU  58  -6.298 -13.235   4.069
    7   HD13  LEU  58          HD12      LEU  58  -6.264 -12.738   5.761
    8   HD12  LEU  58          HD13      LEU  58  -7.700 -13.517   5.101
    9   HD22  LEU  58          HD21      LEU  58  -6.967 -16.796   5.678
   10   HD21  LEU  58          HD22      LEU  58  -6.644 -16.337   4.007
   11   HD23  LEU  58          HD23      LEU  58  -7.992 -15.606   4.878

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  59           H        ILE  59  -1.520 -15.910   6.077
    2    HA   ILE  59           HA       ILE  59  -0.459 -16.630   3.424
    3    HB   ILE  59           HB       ILE  59   0.343 -14.581   5.002
    4   HG12  ILE  59          HG12      ILE  59   2.396 -16.232   3.515
    5   HG13  ILE  59          HG13      ILE  59   1.197 -15.266   2.694
    6   HG23  ILE  59          HG21      ILE  59   2.223 -15.094   6.343
    7   HG22  ILE  59          HG22      ILE  59   2.415 -16.685   5.641
    8   HG21  ILE  59          HG23      ILE  59   1.085 -16.356   6.751
    9   HD12  ILE  59          HD11      ILE  59   3.330 -14.299   4.587
   10   HD11  ILE  59          HD12      ILE  59   1.990 -13.282   4.062
   11   HD13  ILE  59          HD13      ILE  59   3.152 -13.890   2.883

  No H/Q in entry =          11
  In of MODEL   69
    1    H    GLU  60           H        GLU  60  -0.438 -17.755   6.785
    2    HA   GLU  60           HA       GLU  60   1.574 -19.746   6.485
    3    HB2  GLU  60           HB2      GLU  60   1.022 -20.398   8.634
    4    HB3  GLU  60           HB3      GLU  60   0.366 -18.763   8.625
    5    HG2  GLU  60           HG2      GLU  60  -1.417 -20.037   9.481
    6    HG3  GLU  60           HG3      GLU  60  -1.821 -19.901   7.771

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLY  61           H        GLY  61  -1.942 -19.816   6.040
    2    HA3  GLY  61           HA2      GLY  61  -1.726 -22.604   5.063
    3    HA2  GLY  61           HA3      GLY  61  -3.199 -21.861   5.677

  No H/Q in entry =           3
  In of MODEL   69
    1    H    ASP  62           H        ASP  62  -0.983 -20.287   3.457
    2    HA   ASP  62           HA       ASP  62  -3.093 -19.706   1.613
    3    HB2  ASP  62           HB2      ASP  62  -1.260 -18.647   0.303
    4    HB3  ASP  62           HB3      ASP  62  -1.304 -18.112   1.980

  No H/Q in entry =           4
  In of MODEL   69
    1    H    ALA  63           H        ALA  63  -2.711 -22.574   1.893
    2    HA   ALA  63           HA       ALA  63  -1.231 -23.686  -0.268
    3    HB3  ALA  63           HB1      ALA  63  -2.535 -25.701   0.113
    4    HB2  ALA  63           HB2      ALA  63  -3.683 -24.793   1.097
    5    HB1  ALA  63           HB3      ALA  63  -2.024 -25.008   1.655

  No H/Q in entry =           5
  In of MODEL   69
    1    H    GLY  64           H        GLY  64  -4.535 -22.498   0.070
    2    HA3  GLY  64           HA2      GLY  64  -6.189 -22.039  -1.449
    3    HA2  GLY  64           HA3      GLY  64  -4.895 -21.783  -2.608

  No H/Q in entry =           3
  In of MODEL   69
    1    H    GLU  65           H        GLU  65  -5.556 -22.832  -4.422
    2    HA   GLU  65           HA       GLU  65  -7.169 -25.148  -4.405
    3    HB2  GLU  65           HB2      GLU  65  -5.448 -23.942  -6.568
    4    HB3  GLU  65           HB3      GLU  65  -6.533 -25.309  -6.829
    5    HG2  GLU  65           HG2      GLU  65  -8.447 -23.976  -6.102
    6    HG3  GLU  65           HG3      GLU  65  -7.389 -22.616  -5.735

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLY  66           H        GLY  66  -6.244 -26.906  -6.116
    2    HA3  GLY  66           HA2      GLY  66  -4.670 -28.681  -4.606
    3    HA2  GLY  66           HA3      GLY  66  -5.134 -28.884  -6.284

  No H/Q in entry =           3
  In of MODEL   69
    1    H    LYS  67           H        LYS  67  -3.833 -26.534  -7.251
    2    HA   LYS  67           HA       LYS  67  -1.218 -27.615  -7.655
    3    HB2  LYS  67           HB2      LYS  67  -2.591 -25.129  -8.661
    4    HB3  LYS  67           HB3      LYS  67  -0.962 -25.612  -9.152
    5    HG2  LYS  67           HG2      LYS  67  -1.795 -27.757  -9.964
    6    HG3  LYS  67           HG3      LYS  67  -3.415 -27.382  -9.380
    7    HD2  LYS  67           HD2      LYS  67  -3.486 -26.894 -11.699
    8    HD3  LYS  67           HD3      LYS  67  -3.296 -25.320 -10.924
    9    HE2  LYS  67           HE2      LYS  67  -0.938 -25.282 -11.389
   10    HE3  LYS  67           HE3      LYS  67  -0.953 -26.968 -11.906
   11    HZ3  LYS  67           HZ1      LYS  67  -1.079 -25.965 -13.916
   12    HZ2  LYS  67           HZ2      LYS  67  -1.854 -24.577 -13.318
   13    HZ1  LYS  67           HZ3      LYS  67  -2.738 -26.007 -13.569

  No H/Q in entry =          13
  In of MODEL   69
    1    H    MET  68           H        MET  68   0.763 -26.619  -7.404
    2    HA   MET  68           HA       MET  68   1.467 -25.787  -4.890
    3    HB2  MET  68           HB2      MET  68   2.843 -25.240  -7.520
    4    HB3  MET  68           HB3      MET  68   3.592 -25.016  -5.939
    5    HG2  MET  68           HG2      MET  68   2.412 -27.627  -6.932
    6    HG3  MET  68           HG3      MET  68   4.132 -27.235  -6.944
    7    HE2  MET  68           HE1      MET  68   4.709 -25.738  -4.082
    8    HE1  MET  68           HE2      MET  68   5.530 -26.805  -5.219
    9    HE3  MET  68           HE3      MET  68   5.380 -27.279  -3.529

  No H/Q in entry =           9
  In of MODEL   69
    1    H    LYS  69           H        LYS  69  -0.309 -23.897  -7.003
    2    HA   LYS  69           HA       LYS  69   0.850 -21.353  -6.557
    3    HB2  LYS  69           HB2      LYS  69  -1.983 -21.940  -7.377
    4    HB3  LYS  69           HB3      LYS  69  -1.111 -20.416  -7.583
    5    HG2  LYS  69           HG2      LYS  69  -0.171 -23.055  -8.737
    6    HG3  LYS  69           HG3      LYS  69  -1.129 -21.880  -9.641
    7    HD2  LYS  69           HD2      LYS  69   0.695 -20.174  -8.977
    8    HD3  LYS  69           HD3      LYS  69   1.672 -21.585  -8.564
    9    HE2  LYS  69           HE2      LYS  69   1.457 -22.459 -10.824
   10    HE3  LYS  69           HE3      LYS  69   0.343 -21.162 -11.255
   11    HZ2  LYS  69           HZ1      LYS  69   3.231 -20.975 -10.654
   12    HZ1  LYS  69           HZ2      LYS  69   2.219 -19.612 -10.603
   13    HZ3  LYS  69           HZ3      LYS  69   2.411 -20.477 -12.053

  No H/Q in entry =          13
  In of MODEL   69
    1    H    VAL  70           H        VAL  70  -0.647 -19.475  -5.744
    2    HA   VAL  70           HA       VAL  70  -1.745 -20.182  -3.082
    3    HB   VAL  70           HB       VAL  70  -0.741 -18.087  -2.213
    4   HG12  VAL  70          HG11      VAL  70   1.718 -18.864  -2.492
    5   HG11  VAL  70          HG12      VAL  70   1.037 -20.186  -3.442
    6   HG13  VAL  70          HG13      VAL  70   0.577 -19.986  -1.751
    7   HG21  VAL  70          HG21      VAL  70   0.563 -17.945  -4.964
    8   HG23  VAL  70          HG22      VAL  70   0.978 -16.917  -3.594
    9   HG22  VAL  70          HG23      VAL  70  -0.623 -16.809  -4.319

  No H/Q in entry =           9
  In of MODEL   69
    1    H    SER  71           H        SER  71  -3.157 -18.471  -2.214
    2    HA   SER  71           HA       SER  71  -5.203 -17.715  -4.012
    3    HB2  SER  71           HB2      SER  71  -5.460 -18.001  -1.505
    4    HB3  SER  71           HB3      SER  71  -4.612 -16.470  -1.305
    5    HG   SER  71           HG       SER  71  -6.874 -16.736  -2.981

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LEU  72           H        LEU  72  -5.331 -16.087  -5.363
    2    HA   LEU  72           HA       LEU  72  -3.217 -14.286  -5.860
    3    HB2  LEU  72           HB2      LEU  72  -6.094 -14.309  -6.768
    4    HB3  LEU  72           HB3      LEU  72  -4.891 -13.165  -7.356
    5    HG   LEU  72           HG       LEU  72  -4.542 -16.178  -7.508
    6   HD11  LEU  72          HD11      LEU  72  -6.480 -15.439  -8.859
    7   HD13  LEU  72          HD12      LEU  72  -5.139 -15.951  -9.886
    8   HD12  LEU  72          HD13      LEU  72  -5.462 -14.234  -9.648
    9   HD23  LEU  72          HD21      LEU  72  -2.962 -15.319  -9.423
   10   HD22  LEU  72          HD22      LEU  72  -2.388 -15.228  -7.766
   11   HD21  LEU  72          HD23      LEU  72  -3.025 -13.788  -8.556

  No H/Q in entry =          11
  In of MODEL   69
    1    H    VAL  73           H        VAL  73  -6.287 -13.920  -4.189
    2    HA   VAL  73           HA       VAL  73  -6.310 -11.151  -3.819
    3    HB   VAL  73           HB       VAL  73  -8.007 -11.509  -2.213
    4   HG12  VAL  73          HG11      VAL  73  -8.099 -13.909  -4.060
    5   HG11  VAL  73          HG12      VAL  73  -8.467 -12.265  -4.574
    6   HG13  VAL  73          HG13      VAL  73  -9.472 -13.052  -3.357
    7   HG21  VAL  73          HG21      VAL  73  -6.568 -14.110  -1.799
    8   HG23  VAL  73          HG22      VAL  73  -8.294 -14.023  -1.443
    9   HG22  VAL  73          HG23      VAL  73  -7.165 -12.964  -0.600

  No H/Q in entry =           9
  In of MODEL   69
    1    H    LEU  74           H        LEU  74  -4.367 -13.542  -2.276
    2    HA   LEU  74           HA       LEU  74  -3.916 -12.420   0.249
    3    HB2  LEU  74           HB2      LEU  74  -3.152 -14.639  -0.273
    4    HB3  LEU  74           HB3      LEU  74  -2.113 -14.028  -1.559
    5    HG   LEU  74           HG       LEU  74  -0.770 -12.797   0.109
    6   HD12  LEU  74          HD11      LEU  74  -1.228 -13.490   2.554
    7   HD11  LEU  74          HD12      LEU  74  -2.828 -13.969   1.986
    8   HD13  LEU  74          HD13      LEU  74  -2.309 -12.289   1.848
    9   HD22  LEU  74          HD21      LEU  74   0.430 -14.656   0.717
   10   HD21  LEU  74          HD22      LEU  74  -0.629 -15.352  -0.488
   11   HD23  LEU  74          HD23      LEU  74  -1.005 -15.554   1.207

  No H/Q in entry =          11
  In of MODEL   69
    1    H    VAL  75           H        VAL  75  -2.061 -12.019  -2.730
    2    HA   VAL  75           HA       VAL  75  -0.238 -10.112  -1.731
    3    HB   VAL  75           HB       VAL  75  -1.234 -10.564  -4.546
    4   HG13  VAL  75          HG11      VAL  75  -0.338  -8.274  -4.323
    5   HG12  VAL  75          HG12      VAL  75   0.823  -9.281  -5.177
    6   HG11  VAL  75          HG13      VAL  75   1.078  -8.896  -3.484
    7   HG21  VAL  75          HG21      VAL  75   0.017 -12.411  -3.302
    8   HG23  VAL  75          HG22      VAL  75   1.395 -11.314  -3.232
    9   HG22  VAL  75          HG23      VAL  75   0.783 -11.861  -4.794

  No H/Q in entry =           9
  In of MODEL   69
    1    H    GLU  76           H        GLU  76  -3.408  -9.734  -3.345
    2    HA   GLU  76           HA       GLU  76  -3.443  -6.919  -3.427
    3    HB2  GLU  76           HB2      GLU  76  -5.126  -8.337  -4.578
    4    HB3  GLU  76           HB3      GLU  76  -5.760  -8.846  -3.022
    5    HG2  GLU  76           HG2      GLU  76  -7.218  -7.119  -3.862
    6    HG3  GLU  76           HG3      GLU  76  -6.312  -6.420  -2.533

  No H/Q in entry =           6
  In of MODEL   69
    1    H    ALA  77           H        ALA  77  -4.535  -9.157  -0.888
    2    HA   ALA  77           HA       ALA  77  -5.455  -7.161   0.896
    3    HB1  ALA  77           HB1      ALA  77  -4.412  -9.951   1.437
    4    HB3  ALA  77           HB2      ALA  77  -6.095  -9.475   1.213
    5    HB2  ALA  77           HB3      ALA  77  -5.210  -8.935   2.637

  No H/Q in entry =           5
  In of MODEL   69
    1    H    GLN  78           H        GLN  78  -2.323  -8.728   0.481
    2    HA   GLN  78           HA       GLN  78  -1.028  -7.591   2.722
    3    HB2  GLN  78           HB2      GLN  78  -0.237  -9.529   1.258
    4    HB3  GLN  78           HB3      GLN  78   0.294  -8.313   0.100
    5    HG2  GLN  78           HG2      GLN  78   1.797  -7.337   1.714
    6    HG3  GLN  78           HG3      GLN  78   1.164  -8.363   2.998
    7   HE21  GLN  78          HE21      GLN  78   1.197 -10.891   2.088
    8   HE22  GLN  78          HE22      GLN  78   2.724 -11.347   1.505

  No H/Q in entry =           8
  In of MODEL   69
    1    H    LEU  79           H        LEU  79  -1.431  -6.505  -0.613
    2    HA   LEU  79           HA       LEU  79   0.271  -4.290  -0.607
    3    HB2  LEU  79           HB2      LEU  79  -0.788  -5.076  -2.653
    4    HB3  LEU  79           HB3      LEU  79  -2.381  -4.677  -2.021
    5    HG   LEU  79           HG       LEU  79  -1.820  -2.294  -1.987
    6   HD13  LEU  79          HD11      LEU  79   0.429  -2.070  -1.502
    7   HD12  LEU  79          HD12      LEU  79   0.457  -1.771  -3.239
    8   HD11  LEU  79          HD13      LEU  79   0.908  -3.357  -2.609
    9   HD23  LEU  79          HD21      LEU  79  -1.217  -2.083  -4.545
   10   HD22  LEU  79          HD22      LEU  79  -2.743  -2.823  -4.071
   11   HD21  LEU  79          HD23      LEU  79  -1.384  -3.839  -4.540

  No H/Q in entry =          11
  In of MODEL   69
    1    H    HIS  80           H        HIS  80  -3.186  -4.433   0.263
    2    HA   HIS  80           HA       HIS  80  -3.348  -1.680   0.947
    3    HB2  HIS  80           HB2      HIS  80  -5.063  -4.078   1.272
    4    HB3  HIS  80           HB3      HIS  80  -5.359  -2.743   2.389
    5    HD1  HIS  80           HD1      HIS  80  -6.976  -1.088   1.514
    6    HD2  HIS  80           HD2      HIS  80  -4.837  -2.896  -1.574
    7    HE1  HIS  80           HE1      HIS  80  -7.837  -0.070  -0.648
    8    HE2  HIS  80           HE2      HIS  80  -6.539  -1.166  -2.539

  No H/Q in entry =           8
  In of MODEL   69
    1    H    LEU  81           H        LEU  81  -2.856  -4.591   2.915
    2    HA   LEU  81           HA       LEU  81  -2.800  -3.261   5.407
    3    HB2  LEU  81           HB2      LEU  81  -1.614  -5.881   4.495
    4    HB3  LEU  81           HB3      LEU  81  -1.562  -5.333   6.172
    5    HG   LEU  81           HG       LEU  81  -4.130  -5.555   4.576
    6   HD12  LEU  81          HD11      LEU  81  -4.429  -7.628   6.114
    7   HD11  LEU  81          HD12      LEU  81  -2.674  -7.572   6.277
    8   HD13  LEU  81          HD13      LEU  81  -3.405  -7.787   4.686
    9   HD23  LEU  81          HD21      LEU  81  -4.942  -5.768   7.086
   10   HD22  LEU  81          HD22      LEU  81  -4.614  -4.177   6.403
   11   HD21  LEU  81          HD23      LEU  81  -3.419  -4.954   7.442

  No H/Q in entry =          11
  In of MODEL   69
    1    H    MET  82           H        MET  82  -0.155  -4.171   3.196
    2    HA   MET  82           HA       MET  82   1.957  -3.305   4.858
    3    HB2  MET  82           HB2      MET  82   1.700  -3.625   1.867
    4    HB3  MET  82           HB3      MET  82   3.197  -3.071   2.614
    5    HG2  MET  82           HG2      MET  82   1.778  -5.654   3.340
    6    HG3  MET  82           HG3      MET  82   3.136  -5.548   2.223
    7    HE3  MET  82           HE1      MET  82   6.183  -4.850   4.171
    8    HE2  MET  82           HE2      MET  82   5.264  -3.471   3.574
    9    HE1  MET  82           HE3      MET  82   5.327  -4.956   2.628

  No H/Q in entry =           9
  In of MODEL   69
    1    H    THR  83           H        THR  83   0.115  -1.631   2.336
    2    HA   THR  83           HA       THR  83   1.549   0.805   2.420
    3    HB   THR  83           HB       THR  83  -0.632   1.754   1.468
    4    HG1  THR  83           HG1      THR  83  -2.295   0.472   1.375
    5   HG22  THR  83          HG21      THR  83  -0.403  -0.052  -0.547
    6   HG21  THR  83          HG22      THR  83   1.106  -0.363   0.308
    7   HG23  THR  83          HG23      THR  83   0.751   1.257  -0.292

  No H/Q in entry =           7
  In of MODEL   69
    1    H    SER  84           H        SER  84  -1.444  -0.212   4.054
    2    HA   SER  84           HA       SER  84  -1.902   2.213   5.420
    3    HB2  SER  84           HB2      SER  84  -2.752  -0.621   5.978
    4    HB3  SER  84           HB3      SER  84  -3.220   0.717   7.026
    5    HG   SER  84           HG       SER  84  -3.718   0.425   4.238

  No H/Q in entry =           5
  In of MODEL   69
    1    H    MET  85           H        MET  85  -0.203  -0.741   6.508
    2    HA   MET  85           HA       MET  85   0.359   0.164   9.111
    3    HB2  MET  85           HB2      MET  85   0.622  -2.178   8.411
    4    HB3  MET  85           HB3      MET  85   1.997  -1.719   7.407
    5    HG2  MET  85           HG2      MET  85   3.197  -0.908   9.402
    6    HG3  MET  85           HG3      MET  85   1.816  -1.335  10.411
    7    HE1  MET  85           HE1      MET  85   4.968  -2.264   8.788
    8    HE3  MET  85           HE2      MET  85   4.034  -3.047   7.515
    9    HE2  MET  85           HE3      MET  85   5.009  -4.022   8.610

  No H/Q in entry =           9
  In of MODEL   69
    1    H    LEU  86           H        LEU  86   2.257   0.422   6.136
    2    HA   LEU  86           HA       LEU  86   4.498   1.705   7.271
    3    HB2  LEU  86           HB2      LEU  86   4.266   0.639   4.958
    4    HB3  LEU  86           HB3      LEU  86   3.465   2.131   4.466
    5    HG   LEU  86           HG       LEU  86   5.517   3.352   5.427
    6   HD11  LEU  86          HD11      LEU  86   6.209   0.730   6.201
    7   HD13  LEU  86          HD12      LEU  86   7.227   2.165   6.294
    8   HD12  LEU  86          HD13      LEU  86   7.308   1.125   4.874
    9   HD23  LEU  86          HD21      LEU  86   6.187   1.598   3.056
   10   HD22  LEU  86          HD22      LEU  86   6.599   3.290   3.323
   11   HD21  LEU  86          HD23      LEU  86   4.937   2.839   2.944

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ALA  87           H        ALA  87   1.576   2.985   5.733
    2    HA   ALA  87           HA       ALA  87   2.197   5.709   5.826
    3    HB1  ALA  87           HB1      ALA  87  -0.134   4.105   5.305
    4    HB3  ALA  87           HB2      ALA  87   0.185   5.766   4.811
    5    HB2  ALA  87           HB3      ALA  87  -0.591   5.442   6.363

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ARG  88           H        ARG  88   0.520   3.707   8.226
    2    HA   ARG  88           HA       ARG  88   0.052   5.750  10.092
    3    HB2  ARG  88           HB2      ARG  88  -0.907   3.405  10.156
    4    HB3  ARG  88           HB3      ARG  88   0.638   2.887  10.838
    5    HG2  ARG  88           HG2      ARG  88   0.202   4.955  12.477
    6    HG3  ARG  88           HG3      ARG  88  -1.473   4.648  12.041
    7    HD2  ARG  88           HD2      ARG  88  -1.581   2.792  13.278
    8    HD3  ARG  88           HD3      ARG  88  -0.004   2.200  12.722
    9    HE   ARG  88           HE       ARG  88  -0.493   3.452  15.191
   10   HH21  ARG  88          HH11      ARG  88   1.090   4.442  16.415
   11   HH22  ARG  88          HH12      ARG  88   2.604   4.860  15.692
   12   HH11  ARG  88          HH21      ARG  88   1.754   3.629  12.585
   13   HH12  ARG  88          HH22      ARG  88   2.988   4.383  13.536

  No H/Q in entry =          13
  In of MODEL   69
    1    H    GLU  89           H        GLU  89   2.825   3.507   9.818
    2    HA   GLU  89           HA       GLU  89   4.126   4.370  12.150
    3    HB2  GLU  89           HB2      GLU  89   4.749   2.355  10.785
    4    HB3  GLU  89           HB3      GLU  89   5.519   3.449   9.635
    5    HG2  GLU  89           HG2      GLU  89   7.034   4.272  11.364
    6    HG3  GLU  89           HG3      GLU  89   6.207   3.315  12.590

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LEU  90           H        LEU  90   4.409   5.546   8.826
    2    HA   LEU  90           HA       LEU  90   6.364   7.526   9.397
    3    HB2  LEU  90           HB2      LEU  90   4.326   7.225   7.195
    4    HB3  LEU  90           HB3      LEU  90   5.567   8.485   7.207
    5    HG   LEU  90           HG       LEU  90   6.220   5.541   7.514
    6   HD12  LEU  90          HD11      LEU  90   6.938   5.783   5.066
    7   HD11  LEU  90          HD12      LEU  90   5.935   7.233   5.040
    8   HD13  LEU  90          HD13      LEU  90   5.206   5.664   5.383
    9   HD22  LEU  90          HD21      LEU  90   8.136   6.671   8.178
   10   HD21  LEU  90          HD22      LEU  90   7.785   8.085   7.184
   11   HD23  LEU  90          HD23      LEU  90   8.422   6.619   6.440

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  91           H        ILE  91   2.823   7.572   9.295
    2    HA   ILE  91           HA       ILE  91   2.510  10.344   9.767
    3    HB   ILE  91           HB       ILE  91   0.707   7.980  10.319
    4   HG12  ILE  91          HG12      ILE  91   0.451  10.275   8.351
    5   HG13  ILE  91          HG13      ILE  91   1.294   8.776   7.959
    6   HG22  ILE  91          HG21      ILE  91  -1.008  10.051  10.418
    7   HG21  ILE  91          HG22      ILE  91   0.409  10.866  11.077
    8   HG23  ILE  91          HG23      ILE  91  -0.229   9.429  11.873
    9   HD13  ILE  91          HD11      ILE  91  -0.660   7.504   8.021
   10   HD12  ILE  91          HD12      ILE  91  -1.246   9.028   7.357
   11   HD11  ILE  91          HD13      ILE  91  -1.498   8.656   9.062

  No H/Q in entry =          11
  In of MODEL   69
    1    H    THR  92           H        THR  92   2.920   7.586  11.947
    2    HA   THR  92           HA       THR  92   2.519   8.949  14.384
    3    HB   THR  92           HB       THR  92   4.301   6.604  13.682
    4    HG1  THR  92           HG1      THR  92   2.325   5.863  13.602
    5   HG22  THR  92          HG21      THR  92   3.950   6.307  16.319
    6   HG21  THR  92          HG22      THR  92   3.897   8.067  16.256
    7   HG23  THR  92          HG23      THR  92   5.316   7.204  15.660

  No H/Q in entry =           7
  In of MODEL   69
    1    H    GLU  93           H        GLU  93   5.441   8.489  12.410
    2    HA   GLU  93           HA       GLU  93   7.227   9.893  14.092
    3    HB2  GLU  93           HB2      GLU  93   7.274   9.596  11.074
    4    HB3  GLU  93           HB3      GLU  93   8.632  10.110  12.074
    5    HG2  GLU  93           HG2      GLU  93   7.209   7.481  12.524
    6    HG3  GLU  93           HG3      GLU  93   8.580   7.630  11.431

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LEU  94           H        LEU  94   5.151  10.939  11.412
    2    HA   LEU  94           HA       LEU  94   5.974  13.638  11.317
    3    HB2  LEU  94           HB2      LEU  94   3.365  12.295  10.589
    4    HB3  LEU  94           HB3      LEU  94   3.632  14.022  10.354
    5    HG   LEU  94           HG       LEU  94   5.622  12.026   9.266
    6   HD11  LEU  94          HD11      LEU  94   2.870  12.602   8.243
    7   HD13  LEU  94          HD12      LEU  94   3.842  11.139   8.096
    8   HD12  LEU  94          HD13      LEU  94   4.173  12.524   7.055
    9   HD23  LEU  94          HD21      LEU  94   5.862  13.871   7.551
   10   HD22  LEU  94          HD22      LEU  94   6.301  14.351   9.190
   11   HD21  LEU  94          HD23      LEU  94   4.745  14.834   8.515

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  95           H        ILE  95   3.450  12.027  13.231
    2    HA   ILE  95           HA       ILE  95   2.438  14.376  14.453
    3    HB   ILE  95           HB       ILE  95   2.448  11.489  15.361
    4   HG12  ILE  95          HG12      ILE  95   0.226  13.283  14.350
    5   HG13  ILE  95          HG13      ILE  95   1.162  12.223  13.300
    6   HG21  ILE  95          HG21      ILE  95   1.197  13.963  16.593
    7   HG23  ILE  95          HG22      ILE  95   2.248  12.783  17.377
    8   HG22  ILE  95          HG23      ILE  95   0.604  12.335  16.921
    9   HD13  ILE  95          HD11      ILE  95   0.259  10.286  14.220
   10   HD12  ILE  95          HD12      ILE  95  -1.116  11.383  14.320
   11   HD11  ILE  95          HD13      ILE  95  -0.134  11.070  15.750

  No H/Q in entry =          11
  In of MODEL   69
    1    H    GLU  96           H        GLU  96   5.032  12.136  15.403
    2    HA   GLU  96           HA       GLU  96   5.626  13.316  17.894
    3    HB2  GLU  96           HB2      GLU  96   6.552  11.155  17.222
    4    HB3  GLU  96           HB3      GLU  96   7.474  11.931  15.935
    5    HG2  GLU  96           HG2      GLU  96   9.144  12.461  17.379
    6    HG3  GLU  96           HG3      GLU  96   8.016  13.275  18.453

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LEU  97           H        LEU  97   6.663  14.101  14.599
    2    HA   LEU  97           HA       LEU  97   8.569  16.082  15.298
    3    HB2  LEU  97           HB2      LEU  97   6.943  15.557  12.820
    4    HB3  LEU  97           HB3      LEU  97   7.972  16.981  12.937
    5    HG   LEU  97           HG       LEU  97   8.992  14.175  13.468
    6   HD12  LEU  97          HD11      LEU  97   9.961  14.377  11.140
    7   HD11  LEU  97          HD12      LEU  97   8.914  15.775  10.897
    8   HD13  LEU  97          HD13      LEU  97   8.210  14.185  11.192
    9   HD23  LEU  97          HD21      LEU  97  11.159  15.446  12.705
   10   HD22  LEU  97          HD22      LEU  97  10.562  15.710  14.343
   11   HD21  LEU  97          HD23      LEU  97  10.239  16.902  13.086

  No H/Q in entry =          11
  In of MODEL   69
    1    H    HIS  98           H        HIS  98   5.071  16.240  14.689
    2    HA   HIS  98           HA       HIS  98   4.788  19.041  14.844
    3    HB2  HIS  98           HB2      HIS  98   2.896  16.796  15.581
    4    HB3  HIS  98           HB3      HIS  98   2.439  18.499  15.652
    5    HD1  HIS  98           HD1      HIS  98   3.415  15.792  13.219
    6    HD2  HIS  98           HD2      HIS  98   2.058  19.734  13.137
    7    HE1  HIS  98           HE1      HIS  98   2.828  16.298  10.805
    8    HE2  HIS  98           HE2      HIS  98   2.005  18.692  10.734

  No H/Q in entry =           8
  In of MODEL   69
    1    H    GLU  99           H        GLU  99   4.940  16.537  17.327
    2    HA   GLU  99           HA       GLU  99   4.369  18.222  19.542
    3    HB2  GLU  99           HB2      GLU  99   4.268  15.740  19.626
    4    HB3  GLU  99           HB3      GLU  99   6.026  15.687  19.495
    5    HG2  GLU  99           HG2      GLU  99   6.248  16.966  21.574
    6    HG3  GLU  99           HG3      GLU  99   4.497  17.115  21.693

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LYS 100           H        LYS 100   7.397  17.285  17.933
    2    HA   LYS 100           HA       LYS 100   9.083  18.666  19.777
    3    HB2  LYS 100           HB2      LYS 100   9.541  17.755  16.927
    4    HB3  LYS 100           HB3      LYS 100  10.788  18.512  17.923
    5    HG2  LYS 100           HG2      LYS 100  10.424  16.754  19.659
    6    HG3  LYS 100           HG3      LYS 100   9.274  15.962  18.578
    7    HD2  LYS 100           HD2      LYS 100  11.045  15.680  16.886
    8    HD3  LYS 100           HD3      LYS 100  12.200  16.483  17.953
    9    HE2  LYS 100           HE2      LYS 100  11.816  14.720  19.666
   10    HE3  LYS 100           HE3      LYS 100  10.723  13.897  18.549
   11    HZ1  LYS 100           HZ1      LYS 100  13.538  14.555  17.862
   12    HZ3  LYS 100           HZ2      LYS 100  12.478  13.510  17.041
   13    HZ2  LYS 100           HZ3      LYS 100  13.084  13.079  18.570

  No H/Q in entry =          13
  In of MODEL   69
    1    H    LEU 101           H        LEU 101   7.357  19.619  16.848
    2    HA   LEU 101           HA       LEU 101   8.581  22.171  16.513
    3    HB2  LEU 101           HB2      LEU 101   5.968  20.957  15.652
    4    HB3  LEU 101           HB3      LEU 101   6.225  22.687  15.451
    5    HG   LEU 101           HG       LEU 101   8.238  20.666  14.448
    6   HD12  LEU 101          HD11      LEU 101   7.059  21.191  12.181
    7   HD11  LEU 101          HD12      LEU 101   5.674  21.623  13.182
    8   HD13  LEU 101          HD13      LEU 101   6.331  19.988  13.245
    9   HD21  LEU 101          HD21      LEU 101   7.619  23.585  13.917
   10   HD23  LEU 101          HD22      LEU 101   8.580  22.626  12.793
   11   HD22  LEU 101          HD23      LEU 101   9.145  22.871  14.445

  No H/Q in entry =          11
  In of MODEL   69
    1    H    LYS 102           H        LYS 102   7.071  21.026  19.141
    2    HA   LYS 102           HA       LYS 102   6.469  22.110  21.087
    3    HB2  LYS 102           HB2      LYS 102   7.748  24.100  19.958
    4    HB3  LYS 102           HB3      LYS 102   6.148  24.715  19.606
    5    HG2  LYS 102           HG2      LYS 102   7.557  24.436  22.239
    6    HG3  LYS 102           HG3      LYS 102   6.604  25.774  21.630
    7    HD2  LYS 102           HD2      LYS 102   5.357  23.139  22.509
    8    HD3  LYS 102           HD3      LYS 102   5.627  24.493  23.597
    9    HE2  LYS 102           HE2      LYS 102   3.327  24.111  22.135
   10    HE3  LYS 102           HE3      LYS 102   3.847  25.650  22.820
   11    HZ2  LYS 102           HZ1      LYS 102   3.287  25.775  20.448
   12    HZ1  LYS 102           HZ2      LYS 102   4.538  24.688  20.103
   13    HZ3  LYS 102           HZ3      LYS 102   4.898  26.213  20.750

  No H/Q in entry =          13
  In of MODEL   69
    1    H    ALA 103           H        ALA 103   4.805  23.678  18.350
    2    HA   ALA 103           HA       ALA 103   2.365  24.263  19.270
    3    HB1  ALA 103           HB1      ALA 103   1.434  23.440  17.034
    4    HB2  ALA 103           HB2      ALA 103   3.074  22.896  16.680
    5    HB3  ALA 103           HB3      ALA 103   2.752  24.608  16.961

  No H/Q in entry =           5
  In of MODEL   69
    1    H1   ALA   1           H3       ALA   1  10.384 -20.134  -6.374
    2    H2   ALA   1           H2       ALA   1   9.400 -20.326  -7.748
    3    H3   ALA   1           H1       ALA   1   8.977 -21.078  -6.284
    4    HA   ALA   1           HA       ALA   1   9.996 -22.889  -7.048
    5    HB1  ALA   1           HB1      ALA   1  10.064 -22.517  -9.322
    6    HB2  ALA   1           HB2      ALA   1  11.796 -22.379  -9.015
    7    HB3  ALA   1           HB3      ALA   1  10.806 -20.925  -9.144

  No H/Q in entry =           7
  In of MODEL   69
    1    H    GLU   2           H        GLU   2  12.272 -23.853  -7.141
    2    HA   GLU   2           HA       GLU   2  13.683 -23.794  -4.947
    3    HB2  GLU   2           HB2      GLU   2  15.005 -23.655  -7.662
    4    HB3  GLU   2           HB3      GLU   2  15.748 -24.280  -6.191
    5    HG2  GLU   2           HG2      GLU   2  14.715 -26.288  -6.430
    6    HG3  GLU   2           HG3      GLU   2  13.146 -25.531  -6.664

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLU   3           H        GLU   3  15.435 -21.926  -7.360
    2    HA   GLU   3           HA       GLU   3  16.625 -20.259  -5.406
    3    HB2  GLU   3           HB2      GLU   3  16.530 -20.238  -8.415
    4    HB3  GLU   3           HB3      GLU   3  17.296 -18.919  -7.529
    5    HG2  GLU   3           HG2      GLU   3  18.961 -20.310  -6.637
    6    HG3  GLU   3           HG3      GLU   3  18.002 -21.769  -6.854

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LEU   4           H        LEU   4  14.314 -19.380  -8.001
    2    HA   LEU   4           HA       LEU   4  13.873 -16.772  -7.368
    3    HB2  LEU   4           HB2      LEU   4  11.676 -18.728  -8.082
    4    HB3  LEU   4           HB3      LEU   4  11.610 -16.977  -8.269
    5    HG   LEU   4           HG       LEU   4  13.543 -18.845  -9.678
    6   HD13  LEU   4          HD11      LEU   4  12.218 -18.676 -11.570
    7   HD12  LEU   4          HD12      LEU   4  11.526 -17.129 -11.084
    8   HD11  LEU   4          HD13      LEU   4  10.973 -18.621 -10.325
    9   HD23  LEU   4          HD21      LEU   4  13.877 -16.594 -11.021
   10   HD22  LEU   4          HD22      LEU   4  14.755 -16.851  -9.514
   11   HD21  LEU   4          HD23      LEU   4  13.309 -15.845  -9.528

  No H/Q in entry =          11
  In of MODEL   69
    1    H    GLU   5           H        GLU   5  12.391 -19.556  -5.723
    2    HA   GLU   5           HA       GLU   5  10.747 -17.984  -3.989
    3    HB2  GLU   5           HB2      GLU   5  10.290 -20.351  -4.513
    4    HB3  GLU   5           HB3      GLU   5  11.742 -20.809  -3.621
    5    HG2  GLU   5           HG2      GLU   5  10.829 -19.784  -1.581
    6    HG3  GLU   5           HG3      GLU   5   9.384 -19.298  -2.467

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLU   6           H        GLU   6  13.888 -19.587  -3.597
    2    HA   GLU   6           HA       GLU   6  14.282 -18.749  -0.899
    3    HB2  GLU   6           HB2      GLU   6  15.482 -20.665  -1.919
    4    HB3  GLU   6           HB3      GLU   6  16.339 -19.543  -2.977
    5    HG2  GLU   6           HG2      GLU   6  17.286 -18.401  -1.010
    6    HG3  GLU   6           HG3      GLU   6  16.422 -19.508   0.055

  No H/Q in entry =           6
  In of MODEL   69
    1    H    VAL   7           H        VAL   7  15.015 -17.408  -4.050
    2    HA   VAL   7           HA       VAL   7  16.726 -15.298  -3.195
    3    HB   VAL   7           HB       VAL   7  14.985 -15.635  -5.652
    4   HG11  VAL   7          HG11      VAL   7  16.903 -13.439  -4.852
    5   HG13  VAL   7          HG12      VAL   7  15.253 -13.282  -5.452
    6   HG12  VAL   7          HG13      VAL   7  16.545 -13.787  -6.543
    7   HG21  VAL   7          HG21      VAL   7  17.090 -17.108  -5.120
    8   HG23  VAL   7          HG22      VAL   7  17.999 -15.651  -5.521
    9   HG22  VAL   7          HG23      VAL   7  16.942 -16.387  -6.723

  No H/Q in entry =           9
  In of MODEL   69
    1    H    VAL   8           H        VAL   8  13.224 -15.542  -3.708
    2    HA   VAL   8           HA       VAL   8  12.582 -12.833  -3.211
    3    HB   VAL   8           HB       VAL   8  10.963 -15.356  -2.775
    4   HG13  VAL   8          HG11      VAL   8  10.010 -13.656  -1.369
    5   HG12  VAL   8          HG12      VAL   8   9.013 -13.719  -2.823
    6   HG11  VAL   8          HG13      VAL   8  10.196 -12.428  -2.622
    7   HG23  VAL   8          HG21      VAL   8  10.288 -13.415  -4.931
    8   HG22  VAL   8          HG22      VAL   8  10.318 -15.175  -4.973
    9   HG21  VAL   8          HG23      VAL   8  11.815 -14.267  -5.152

  No H/Q in entry =           9
  In of MODEL   69
    1    H    MET   9           H        MET   9  12.860 -15.654  -1.052
    2    HA   MET   9           HA       MET   9  12.084 -14.391   1.337
    3    HB2  MET   9           HB2      MET   9  13.975 -16.671   0.762
    4    HB3  MET   9           HB3      MET   9  13.687 -16.101   2.406
    5    HG2  MET   9           HG2      MET   9  11.274 -16.496   2.138
    6    HG3  MET   9           HG3      MET   9  11.541 -17.035   0.479
    7    HE3  MET   9           HE1      MET   9  12.777 -19.047   4.387
    8    HE2  MET   9           HE2      MET   9  11.202 -18.297   4.152
    9    HE1  MET   9           HE3      MET   9  12.662 -17.320   4.032

  No H/Q in entry =           9
  In of MODEL   69
    1    H    GLY  10           H        GLY  10  15.243 -14.624  -0.263
    2    HA3  GLY  10           HA2      GLY  10  16.735 -13.223   1.696
    3    HA2  GLY  10           HA3      GLY  10  17.175 -13.381  -0.004

  No H/Q in entry =           3
  In of MODEL   69
    1    H    LEU  11           H        LEU  11  14.997 -12.141  -1.208
    2    HA   LEU  11           HA       LEU  11  15.699  -9.401  -1.037
    3    HB2  LEU  11           HB2      LEU  11  13.308 -10.791  -2.249
    4    HB3  LEU  11           HB3      LEU  11  13.595  -9.057  -2.402
    5    HG   LEU  11           HG       LEU  11  15.601 -11.171  -3.229
    6   HD13  LEU  11          HD11      LEU  11  13.834 -11.520  -4.728
    7   HD12  LEU  11          HD12      LEU  11  14.832 -10.338  -5.574
    8   HD11  LEU  11          HD13      LEU  11  13.372  -9.817  -4.734
    9   HD22  LEU  11          HD21      LEU  11  16.846  -9.215  -3.008
   10   HD21  LEU  11          HD22      LEU  11  15.471  -8.169  -3.362
   11   HD23  LEU  11          HD23      LEU  11  16.281  -9.034  -4.667

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  12           H        ILE  12  12.938 -11.220   0.256
    2    HA   ILE  12           HA       ILE  12  11.569  -8.997   1.347
    3    HB   ILE  12           HB       ILE  12  11.605 -11.884   2.279
    4   HG12  ILE  12          HG12      ILE  12  10.890 -11.233  -0.157
    5   HG13  ILE  12          HG13      ILE  12   9.873 -12.326   0.761
    6   HG23  ILE  12          HG21      ILE  12  10.674 -10.532   4.042
    7   HG22  ILE  12          HG22      ILE  12   9.313 -11.272   3.200
    8   HG21  ILE  12          HG23      ILE  12   9.727  -9.586   2.894
    9   HD13  ILE  12          HD11      ILE  12   8.364 -10.504   1.304
   10   HD12  ILE  12          HD12      ILE  12   8.616 -10.530  -0.440
   11   HD11  ILE  12          HD13      ILE  12   9.442  -9.344   0.546

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  13           H        ILE  13  13.970 -11.220   2.708
    2    HA   ILE  13           HA       ILE  13  14.044 -10.057   5.295
    3    HB   ILE  13           HB       ILE  13  16.077 -11.628   3.692
    4   HG12  ILE  13          HG12      ILE  13  13.838 -12.629   4.505
    5   HG13  ILE  13          HG13      ILE  13  15.313 -13.519   4.864
    6   HG22  ILE  13          HG21      ILE  13  17.058 -12.005   6.099
    7   HG21  ILE  13          HG22      ILE  13  16.269 -10.478   6.473
    8   HG23  ILE  13          HG23      ILE  13  17.499 -10.547   5.211
    9   HD11  ILE  13          HD11      ILE  13  14.525 -11.539   6.930
   10   HD13  ILE  13          HD12      ILE  13  15.116 -13.188   7.108
   11   HD12  ILE  13          HD13      ILE  13  13.423 -12.899   6.730

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ASN  14           H        ASN  14  15.962  -9.516   2.354
    2    HA   ASN  14           HA       ASN  14  17.727  -7.586   3.405
    3    HB2  ASN  14           HB2      ASN  14  17.670  -8.839   1.082
    4    HB3  ASN  14           HB3      ASN  14  16.775  -7.415   0.565
    5   HD21  ASN  14          HD21      ASN  14  19.199  -7.755  -0.654
    6   HD22  ASN  14          HD22      ASN  14  20.353  -6.680  -0.035

  No H/Q in entry =           6
  In of MODEL   69
    1    H    SER  15           H        SER  15  14.595  -7.219   1.755
    2    HA   SER  15           HA       SER  15  14.492  -4.399   1.830
    3    HB2  SER  15           HB2      SER  15  12.151  -4.637   1.367
    4    HB3  SER  15           HB3      SER  15  12.936  -5.995   0.572
    5    HG   SER  15           HG       SER  15  11.633  -7.164   1.723

  No H/Q in entry =           5
  In of MODEL   69
    1    H    GLY  16           H        GLY  16  13.422  -6.870   4.132
    2    HA3  GLY  16           HA2      GLY  16  12.229  -5.129   6.016
    3    HA2  GLY  16           HA3      GLY  16  12.844  -6.741   6.360

  No H/Q in entry =           3
  In of MODEL   69
    1    H    GLN  17           H        GLN  17  15.548  -6.411   5.735
    2    HA   GLN  17           HA       GLN  17  16.538  -5.207   8.111
    3    HB2  GLN  17           HB2      GLN  17  17.921  -6.049   5.550
    4    HB3  GLN  17           HB3      GLN  17  18.789  -5.455   6.967
    5    HG2  GLN  17           HG2      GLN  17  17.852  -7.258   8.332
    6    HG3  GLN  17           HG3      GLN  17  16.907  -7.832   6.959
    7   HE21  GLN  17          HE21      GLN  17  19.813  -8.329   8.602
    8   HE22  GLN  17          HE22      GLN  17  20.669  -9.118   7.367

  No H/Q in entry =           8
  In of MODEL   69
    1    H    ALA  18           H        ALA  18  16.309  -4.108   4.760
    2    HA   ALA  18           HA       ALA  18  17.753  -1.720   4.983
    3    HB2  ALA  18           HB1      ALA  18  16.606  -2.920   2.922
    4    HB3  ALA  18           HB2      ALA  18  16.875  -1.177   2.914
    5    HB1  ALA  18           HB3      ALA  18  15.279  -1.822   3.300

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ARG  19           H        ARG  19  14.257  -2.303   5.420
    2    HA   ARG  19           HA       ARG  19  13.604   0.344   6.159
    3    HB2  ARG  19           HB2      ARG  19  11.912  -1.401   5.584
    4    HB3  ARG  19           HB3      ARG  19  12.271  -2.209   7.112
    5    HG2  ARG  19           HG2      ARG  19  11.581  -0.223   8.372
    6    HG3  ARG  19           HG3      ARG  19  11.314   0.662   6.872
    7    HD2  ARG  19           HD2      ARG  19   9.181  -0.135   7.714
    8    HD3  ARG  19           HD3      ARG  19   9.580  -1.006   6.227
    9    HE   ARG  19           HE       ARG  19  10.561  -2.563   8.311
   10   HH21  ARG  19          HH11      ARG  19   9.321  -4.206   9.256
   11   HH22  ARG  19          HH12      ARG  19   7.599  -4.174   9.107
   12   HH11  ARG  19          HH21      ARG  19   7.556  -1.258   7.261
   13   HH12  ARG  19          HH22      ARG  19   6.600  -2.505   7.973

  No H/Q in entry =          13
  In of MODEL   69
    1    H    SER  20           H        SER  20  14.481  -2.500   8.091
    2    HA   SER  20           HA       SER  20  14.232  -1.415  10.638
    3    HB2  SER  20           HB2      SER  20  14.727  -3.796  10.228
    4    HB3  SER  20           HB3      SER  20  16.339  -3.362   9.665
    5    HG   SER  20           HG       SER  20  15.238  -2.916  12.247

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LEU  21           H        LEU  21  17.048  -1.346   8.467
    2    HA   LEU  21           HA       LEU  21  18.747   0.126  10.193
    3    HB2  LEU  21           HB2      LEU  21  18.687  -0.129   7.178
    4    HB3  LEU  21           HB3      LEU  21  19.954   0.725   8.056
    5    HG   LEU  21           HG       LEU  21  19.216  -2.169   8.583
    6   HD11  LEU  21          HD11      LEU  21  21.340  -0.964   6.791
    7   HD13  LEU  21          HD12      LEU  21  20.043  -2.061   6.325
    8   HD12  LEU  21          HD13      LEU  21  21.366  -2.642   7.333
    9   HD21  LEU  21          HD21      LEU  21  21.348  -0.282   9.570
   10   HD23  LEU  21          HD22      LEU  21  21.720  -1.999   9.470
   11   HD22  LEU  21          HD23      LEU  21  20.402  -1.449  10.490

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ALA  22           H        ALA  22  16.453   1.115   7.671
    2    HA   ALA  22           HA       ALA  22  16.998   3.872   7.695
    3    HB3  ALA  22           HB1      ALA  22  15.572   2.643   6.027
    4    HB2  ALA  22           HB2      ALA  22  14.876   4.153   6.612
    5    HB1  ALA  22           HB3      ALA  22  14.290   2.611   7.237

  No H/Q in entry =           5
  In of MODEL   69
    1    H    TYR  23           H        TYR  23  14.520   2.050   9.550
    2    HA   TYR  23           HA       TYR  23  13.581   4.281  11.025
    3    HB2  TYR  23           HB2      TYR  23  12.340   2.170  11.007
    4    HB3  TYR  23           HB3      TYR  23  13.680   1.351  11.809
    5    HD1  TYR  23           HD1      TYR  23  11.165   4.073  12.221
    6    HD2  TYR  23           HD2      TYR  23  13.930   1.422  14.165
    7    HE1  TYR  23           HE1      TYR  23  10.266   4.754  14.432
    8    HE2  TYR  23           HE2      TYR  23  13.031   2.103  16.373
    9    HH   TYR  23           HH       TYR  23  10.135   3.904  16.702

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ALA  24           H        ALA  24  16.228   1.995  11.615
    2    HA   ALA  24           HA       ALA  24  16.933   2.973  14.176
    3    HB1  ALA  24           HB1      ALA  24  18.282   1.178  13.984
    4    HB3  ALA  24           HB2      ALA  24  19.299   2.103  12.878
    5    HB2  ALA  24           HB3      ALA  24  17.994   1.102  12.246

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ALA  25           H        ALA  25  17.851   3.920  10.891
    2    HA   ALA  25           HA       ALA  25  19.810   5.845  11.524
    3    HB1  ALA  25           HB1      ALA  25  19.062   4.913   9.212
    4    HB3  ALA  25           HB2      ALA  25  19.569   6.599   9.309
    5    HB2  ALA  25           HB3      ALA  25  17.853   6.196   9.259

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LEU  26           H        LEU  26  16.291   6.086  11.208
    2    HA   LEU  26           HA       LEU  26  16.081   8.865  11.679
    3    HB2  LEU  26           HB2      LEU  26  14.204   7.641  10.766
    4    HB3  LEU  26           HB3      LEU  26  14.128   6.605  12.187
    5    HG   LEU  26           HG       LEU  26  13.545   8.556  13.586
    6   HD12  LEU  26          HD11      LEU  26  12.874  10.666  12.282
    7   HD11  LEU  26          HD12      LEU  26  13.836  10.018  10.956
    8   HD13  LEU  26          HD13      LEU  26  14.601  10.392  12.501
    9   HD21  LEU  26          HD21      LEU  26  11.837   8.263  11.095
   10   HD23  LEU  26          HD22      LEU  26  11.298   8.953  12.623
   11   HD22  LEU  26          HD23      LEU  26  11.744   7.251  12.537

  No H/Q in entry =          11
  In of MODEL   69
    1    H    LYS  27           H        LYS  27  15.991   6.073  13.856
    2    HA   LYS  27           HA       LYS  27  15.432   7.426  16.240
    3    HB2  LYS  27           HB2      LYS  27  15.449   4.952  15.959
    4    HB3  LYS  27           HB3      LYS  27  17.211   4.999  15.894
    5    HG2  LYS  27           HG2      LYS  27  17.293   5.971  18.149
    6    HG3  LYS  27           HG3      LYS  27  15.526   5.995  18.217
    7    HD2  LYS  27           HD2      LYS  27  15.489   3.530  17.965
    8    HD3  LYS  27           HD3      LYS  27  17.254   3.513  17.932
    9    HE2  LYS  27           HE2      LYS  27  17.319   4.488  20.194
   10    HE3  LYS  27           HE3      LYS  27  15.554   4.534  20.230
   11    HZ3  LYS  27           HZ1      LYS  27  16.349   2.572  21.359
   12    HZ2  LYS  27           HZ2      LYS  27  17.247   2.098  19.994
   13    HZ1  LYS  27           HZ3      LYS  27  15.548   2.110  19.936

  No H/Q in entry =          13
  In of MODEL   69
    1    H    GLN  28           H        GLN  28  18.526   6.842  14.606
    2    HA   GLN  28           HA       GLN  28  20.239   7.907  16.582
    3    HB2  GLN  28           HB2      GLN  28  20.490   7.882  13.563
    4    HB3  GLN  28           HB3      GLN  28  21.793   8.336  14.662
    5    HG2  GLN  28           HG2      GLN  28  20.357   5.667  14.700
    6    HG3  GLN  28           HG3      GLN  28  21.933   5.950  13.961
    7   HE21  GLN  28          HE21      GLN  28  20.704   4.603  16.658
    8   HE22  GLN  28          HE22      GLN  28  21.903   5.017  17.786

  No H/Q in entry =           8
  In of MODEL   69
    1    H    ALA  29           H        ALA  29  18.460   9.414  13.920
    2    HA   ALA  29           HA       ALA  29  19.474  12.028  14.177
    3    HB2  ALA  29           HB1      ALA  29  17.760  12.681  12.731
    4    HB1  ALA  29           HB2      ALA  29  16.619  11.509  13.389
    5    HB3  ALA  29           HB3      ALA  29  17.934  10.967  12.346

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LYS  30           H        LYS  30  16.709  10.432  15.723
    2    HA   LYS  30           HA       LYS  30  15.722  12.682  17.106
    3    HB2  LYS  30           HB2      LYS  30  15.605   9.737  17.793
    4    HB3  LYS  30           HB3      LYS  30  14.757  10.986  18.705
    5    HG2  LYS  30           HG2      LYS  30  13.609  11.690  16.605
    6    HG3  LYS  30           HG3      LYS  30  14.397  10.355  15.760
    7    HD2  LYS  30           HD2      LYS  30  13.336   8.744  17.292
    8    HD3  LYS  30           HD3      LYS  30  12.558  10.068  18.161
    9    HE2  LYS  30           HE2      LYS  30  11.368  10.719  16.087
   10    HE3  LYS  30           HE3      LYS  30  12.125   9.367  15.238
   11    HZ2  LYS  30           HZ1      LYS  30   9.826   8.963  16.144
   12    HZ1  LYS  30           HZ2      LYS  30  10.513   9.003  17.703
   13    HZ3  LYS  30           HZ3      LYS  30  11.001   7.823  16.579

  No H/Q in entry =          13
  In of MODEL   69
    1    H    GLN  31           H        GLN  31  18.381  10.494  17.796
    2    HA   GLN  31           HA       GLN  31  18.747  11.490  20.493
    3    HB2  GLN  31           HB2      GLN  31  20.742   9.919  18.853
    4    HB3  GLN  31           HB3      GLN  31  20.630  10.033  20.610
    5    HG2  GLN  31           HG2      GLN  31  18.102   9.098  19.867
    6    HG3  GLN  31           HG3      GLN  31  19.186   8.255  18.768
    7   HE21  GLN  31          HE21      GLN  31  17.666   7.103  21.056
    8   HE22  GLN  31          HE22      GLN  31  18.831   6.429  22.088

  No H/Q in entry =           8
  In of MODEL   69
    1    H    GLY  32           H        GLY  32  19.236  12.823  17.528
    2    HA3  GLY  32           HA2      GLY  32  20.225  14.866  17.015
    3    HA2  GLY  32           HA3      GLY  32  21.002  14.857  18.593

  No H/Q in entry =           3
  In of MODEL   69
    1    H    ASP  33           H        ASP  33  21.387  11.974  16.793
    2    HA   ASP  33           HA       ASP  33  24.210  12.638  16.295
    3    HB2  ASP  33           HB2      ASP  33  22.689  10.029  16.414
    4    HB3  ASP  33           HB3      ASP  33  24.370  10.140  15.899

  No H/Q in entry =           4
  In of MODEL   69
    1    H    PHE  34           H        PHE  34  23.712  13.975  14.429
    2    HA   PHE  34           HA       PHE  34  22.329  13.012  12.152
    3    HB2  PHE  34           HB2      PHE  34  24.474  15.134  12.369
    4    HB3  PHE  34           HB3      PHE  34  23.469  14.858  10.948
    5    HD1  PHE  34           HD1      PHE  34  23.766  16.772  13.870
    6    HD2  PHE  34           HD2      PHE  34  20.848  14.686  11.507
    7    HE1  PHE  34           HE1      PHE  34  21.969  18.173  14.848
    8    HE2  PHE  34           HE2      PHE  34  19.055  16.087  12.489
    9    HZ   PHE  34           HZ       PHE  34  19.619  17.831  14.155

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ALA  35           H        ALA  35  25.715  12.802  13.117
    2    HA   ALA  35           HA       ALA  35  26.785  11.991  10.641
    3    HB3  ALA  35           HB1      ALA  35  28.482  10.802  12.332
    4    HB2  ALA  35           HB2      ALA  35  27.637  11.825  13.495
    5    HB1  ALA  35           HB3      ALA  35  28.460  12.553  12.116

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ALA  36           H        ALA  36  25.695  10.023  13.408
    2    HA   ALA  36           HA       ALA  36  26.152   7.541  12.111
    3    HB2  ALA  36           HB1      ALA  36  25.743   6.784  14.187
    4    HB3  ALA  36           HB2      ALA  36  24.056   7.287  14.061
    5    HB1  ALA  36           HB3      ALA  36  25.270   8.409  14.676

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ALA  37           H        ALA  37  23.342   9.679  12.293
    2    HA   ALA  37           HA       ALA  37  21.463   7.924  11.130
    3    HB3  ALA  37           HB1      ALA  37  21.705  10.884  11.437
    4    HB1  ALA  37           HB2      ALA  37  20.395   9.808  11.920
    5    HB2  ALA  37           HB3      ALA  37  20.564  10.290  10.231

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LYS  38           H        LYS  38  23.554  10.386   9.640
    2    HA   LYS  38           HA       LYS  38  22.879   9.978   6.968
    3    HB2  LYS  38           HB2      LYS  38  24.713  11.519   8.400
    4    HB3  LYS  38           HB3      LYS  38  25.730  10.532   7.356
    5    HG2  LYS  38           HG2      LYS  38  24.543  11.319   5.379
    6    HG3  LYS  38           HG3      LYS  38  23.364  12.172   6.380
    7    HD2  LYS  38           HD2      LYS  38  24.975  13.760   7.123
    8    HD3  LYS  38           HD3      LYS  38  26.324  12.772   6.564
    9    HE2  LYS  38           HE2      LYS  38  25.955  14.654   5.029
   10    HE3  LYS  38           HE3      LYS  38  25.605  13.123   4.219
   11    HZ3  LYS  38           HZ1      LYS  38  23.408  13.577   4.119
   12    HZ2  LYS  38           HZ2      LYS  38  23.938  15.189   4.210
   13    HZ1  LYS  38           HZ3      LYS  38  23.378  14.399   5.605

  No H/Q in entry =          13
  In of MODEL   69
    1    H    ALA  39           H        ALA  39  25.412   8.359   8.883
    2    HA   ALA  39           HA       ALA  39  26.449   6.779   6.790
    3    HB2  ALA  39           HB1      ALA  39  26.393   5.798   9.629
    4    HB1  ALA  39           HB2      ALA  39  27.345   7.223   9.209
    5    HB3  ALA  39           HB3      ALA  39  27.682   5.676   8.432

  No H/Q in entry =           5
  In of MODEL   69
    1    H    MET  40           H        MET  40  23.863   6.158   9.117
    2    HA   MET  40           HA       MET  40  23.402   3.459   8.371
    3    HB2  MET  40           HB2      MET  40  21.609   5.501   9.699
    4    HB3  MET  40           HB3      MET  40  21.194   3.794   9.519
    5    HG2  MET  40           HG2      MET  40  23.763   4.718  10.833
    6    HG3  MET  40           HG3      MET  40  22.279   4.442  11.744
    7    HE3  MET  40           HE1      MET  40  21.706   0.809  11.903
    8    HE2  MET  40           HE2      MET  40  20.832   2.120  11.115
    9    HE1  MET  40           HE3      MET  40  21.593   2.395  12.680

  No H/Q in entry =           9
  In of MODEL   69
    1    H    MET  41           H        MET  41  21.983   6.524   7.221
    2    HA   MET  41           HA       MET  41  20.001   5.346   5.566
    3    HB2  MET  41           HB2      MET  41  21.484   7.935   5.051
    4    HB3  MET  41           HB3      MET  41  19.945   7.450   4.348
    5    HG2  MET  41           HG2      MET  41  19.231   7.248   6.908
    6    HG3  MET  41           HG3      MET  41  20.546   8.400   7.120
    7    HE2  MET  41           HE1      MET  41  19.945   9.711   3.799
    8    HE1  MET  41           HE2      MET  41  20.921  10.138   5.201
    9    HE3  MET  41           HE3      MET  41  19.645  11.225   4.660

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ASP  42           H        ASP  42  23.369   6.262   4.977
    2    HA   ASP  42           HA       ASP  42  23.425   5.805   2.215
    3    HB2  ASP  42           HB2      ASP  42  25.201   6.787   3.968
    4    HB3  ASP  42           HB3      ASP  42  25.852   5.160   3.822

  No H/Q in entry =           4
  In of MODEL   69
    1    H    GLN  43           H        GLN  43  24.177   3.631   4.913
    2    HA   GLN  43           HA       GLN  43  24.815   1.382   3.308
    3    HB2  GLN  43           HB2      GLN  43  23.829   1.550   6.165
    4    HB3  GLN  43           HB3      GLN  43  24.394   0.065   5.393
    5    HG2  GLN  43           HG2      GLN  43  26.554   1.272   4.863
    6    HG3  GLN  43           HG3      GLN  43  25.988   2.595   5.878
    7   HE21  GLN  43          HE21      GLN  43  28.231   1.609   6.880
    8   HE22  GLN  43          HE22      GLN  43  27.970   0.519   8.153

  No H/Q in entry =           8
  In of MODEL   69
    1    H    SER  44           H        SER  44  21.780   2.516   4.738
    2    HA   SER  44           HA       SER  44  20.197   0.281   4.071
    3    HB2  SER  44           HB2      SER  44  19.777   2.804   5.238
    4    HB3  SER  44           HB3      SER  44  18.724   2.773   3.826
    5    HG   SER  44           HG       SER  44  17.650   1.822   5.557

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ARG  45           H        ARG  45  20.925   3.255   2.276
    2    HA   ARG  45           HA       ARG  45  19.370   2.788  -0.012
    3    HB2  ARG  45           HB2      ARG  45  20.527   4.917   0.571
    4    HB3  ARG  45           HB3      ARG  45  22.064   4.160   0.161
    5    HG2  ARG  45           HG2      ARG  45  21.251   3.772  -2.146
    6    HG3  ARG  45           HG3      ARG  45  19.726   4.551  -1.735
    7    HD2  ARG  45           HD2      ARG  45  20.990   6.641  -1.153
    8    HD3  ARG  45           HD3      ARG  45  22.476   5.866  -1.746
    9    HE   ARG  45           HE       ARG  45  20.520   5.647  -3.759
   10   HH21  ARG  45          HH11      ARG  45  20.494   7.027  -5.513
   11   HH22  ARG  45          HH12      ARG  45  21.258   8.574  -5.409
   12   HH11  ARG  45          HH21      ARG  45  22.278   8.130  -2.138
   13   HH12  ARG  45          HH22      ARG  45  22.267   9.198  -3.495

  No H/Q in entry =          13
  In of MODEL   69
    1    H    MET  46           H        MET  46  22.740   1.898   0.687
    2    HA   MET  46           HA       MET  46  23.310   0.719  -1.812
    3    HB2  MET  46           HB2      MET  46  24.452   0.372   0.960
    4    HB3  MET  46           HB3      MET  46  25.087  -0.516  -0.429
    5    HG2  MET  46           HG2      MET  46  25.536   1.588  -1.604
    6    HG3  MET  46           HG3      MET  46  24.831   2.503  -0.279
    7    HE3  MET  46           HE1      MET  46  27.672  -0.667   0.107
    8    HE2  MET  46           HE2      MET  46  28.756   0.423  -0.753
    9    HE1  MET  46           HE3      MET  46  27.192   0.011  -1.454

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ALA  47           H        ALA  47  21.961  -0.628   1.173
    2    HA   ALA  47           HA       ALA  47  21.887  -3.336   0.354
    3    HB2  ALA  47           HB1      ALA  47  21.540  -2.888   2.666
    4    HB3  ALA  47           HB2      ALA  47  19.993  -3.481   2.064
    5    HB1  ALA  47           HB3      ALA  47  20.233  -1.753   2.330

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LEU  48           H        LEU  48  19.540  -0.698   0.045
    2    HA   LEU  48           HA       LEU  48  17.473  -2.215  -1.188
    3    HB2  LEU  48           HB2      LEU  48  18.137   0.737  -1.294
    4    HB3  LEU  48           HB3      LEU  48  16.655   0.036  -1.945
    5    HG   LEU  48           HG       LEU  48  17.545  -0.286   0.930
    6   HD13  LEU  48          HD11      LEU  48  17.135   2.017   0.762
    7   HD12  LEU  48          HD12      LEU  48  15.580   1.373   1.289
    8   HD11  LEU  48          HD13      LEU  48  15.831   1.804  -0.403
    9   HD22  LEU  48          HD21      LEU  48  16.005  -1.992   0.560
   10   HD21  LEU  48          HD22      LEU  48  15.118  -1.078  -0.661
   11   HD23  LEU  48          HD23      LEU  48  14.930  -0.683   1.047

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ASN  49           H        ASN  49  20.152  -0.291  -2.443
    2    HA   ASN  49           HA       ASN  49  19.464  -0.356  -5.159
    3    HB2  ASN  49           HB2      ASN  49  21.165   1.144  -4.234
    4    HB3  ASN  49           HB3      ASN  49  22.198  -0.229  -3.852
    5   HD21  ASN  49          HD21      ASN  49  23.894   0.548  -5.270
    6   HD22  ASN  49          HD22      ASN  49  23.736   0.486  -6.959

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLU  50           H        GLU  50  21.465  -2.570  -3.236
    2    HA   GLU  50           HA       GLU  50  22.129  -4.317  -5.382
    3    HB2  GLU  50           HB2      GLU  50  23.357  -4.310  -3.232
    4    HB3  GLU  50           HB3      GLU  50  21.922  -4.936  -2.420
    5    HG2  GLU  50           HG2      GLU  50  21.984  -6.961  -3.792
    6    HG3  GLU  50           HG3      GLU  50  23.350  -6.329  -4.708

  No H/Q in entry =           6
  In of MODEL   69
    1    H    ALA  51           H        ALA  51  19.506  -4.253  -3.019
    2    HA   ALA  51           HA       ALA  51  18.318  -6.716  -3.774
    3    HB3  ALA  51           HB1      ALA  51  16.749  -6.213  -2.194
    4    HB1  ALA  51           HB2      ALA  51  16.535  -4.562  -2.780
    5    HB2  ALA  51           HB3      ALA  51  17.907  -4.960  -1.745

  No H/Q in entry =           5
  In of MODEL   69
    1    H    HIS  52           H        HIS  52  17.733  -3.360  -4.782
    2    HA   HIS  52           HA       HIS  52  15.593  -3.867  -6.555
    3    HB2  HIS  52           HB2      HIS  52  16.378  -1.611  -5.705
    4    HB3  HIS  52           HB3      HIS  52  17.685  -1.712  -6.886
    5    HD1  HIS  52           HD1      HIS  52  16.569  -2.517  -9.422
    6    HD2  HIS  52           HD2      HIS  52  14.271  -0.226  -6.804
    7    HE1  HIS  52           HE1      HIS  52  14.764  -1.424 -10.822
    8    HE2  HIS  52           HE2      HIS  52  13.355  -0.023  -9.240

  No H/Q in entry =           8
  In of MODEL   69
    1    H    LEU  53           H        LEU  53  19.105  -3.886  -7.037
    2    HA   LEU  53           HA       LEU  53  19.121  -4.186  -9.839
    3    HB2  LEU  53           HB2      LEU  53  21.081  -4.964  -7.695
    4    HB3  LEU  53           HB3      LEU  53  21.372  -5.350  -9.389
    5    HG   LEU  53           HG       LEU  53  20.749  -2.540  -8.417
    6   HD13  LEU  53          HD11      LEU  53  22.830  -3.221  -7.378
    7   HD12  LEU  53          HD12      LEU  53  23.214  -2.160  -8.734
    8   HD11  LEU  53          HD13      LEU  53  23.412  -3.901  -8.896
    9   HD22  LEU  53          HD21      LEU  53  20.388  -2.545 -10.741
   10   HD21  LEU  53          HD22      LEU  53  21.619  -3.770 -11.025
   11   HD23  LEU  53          HD23      LEU  53  22.093  -2.121 -10.665

  No H/Q in entry =          11
  In of MODEL   69
    1    H    VAL  54           H        VAL  54  19.035  -6.587  -7.225
    2    HA   VAL  54           HA       VAL  54  19.126  -8.873  -8.899
    3    HB   VAL  54           HB       VAL  54  18.012  -8.459  -6.113
    4   HG12  VAL  54          HG11      VAL  54  18.326 -11.078  -6.128
    5   HG11  VAL  54          HG12      VAL  54  18.117 -10.900  -7.870
    6   HG13  VAL  54          HG13      VAL  54  16.846 -10.370  -6.770
    7   HG22  VAL  54          HG21      VAL  54  20.331  -8.259  -5.922
    8   HG21  VAL  54          HG22      VAL  54  20.646  -9.345  -7.273
    9   HG23  VAL  54          HG23      VAL  54  20.135  -9.998  -5.717

  No H/Q in entry =           9
  In of MODEL   69
    1    H    GLN  55           H        GLN  55  16.423  -6.966  -7.568
    2    HA   GLN  55           HA       GLN  55  14.381  -8.617  -8.622
    3    HB2  GLN  55           HB2      GLN  55  13.661  -7.097  -6.977
    4    HB3  GLN  55           HB3      GLN  55  14.449  -5.727  -7.757
    5    HG2  GLN  55           HG2      GLN  55  12.705  -5.389  -9.221
    6    HG3  GLN  55           HG3      GLN  55  12.374  -7.107  -9.395
    7   HE21  GLN  55          HE21      GLN  55  10.377  -7.653  -8.565
    8   HE22  GLN  55          HE22      GLN  55   9.624  -6.903  -7.243

  No H/Q in entry =           8
  In of MODEL   69
    1    H    THR  56           H        THR  56  16.112  -5.816  -9.991
    2    HA   THR  56           HA       THR  56  14.642  -5.436 -12.317
    3    HB   THR  56           HB       THR  56  17.664  -5.360 -12.204
    4    HG1  THR  56           HG1      THR  56  15.728  -3.481 -11.343
    5   HG23  THR  56          HG21      THR  56  16.933  -4.979 -14.421
    6   HG22  THR  56          HG22      THR  56  17.157  -3.364 -13.751
    7   HG21  THR  56          HG23      THR  56  15.535  -4.045 -13.886

  No H/Q in entry =           7
  In of MODEL   69
    1    H    LYS  57           H        LYS  57  17.292  -7.746 -11.755
    2    HA   LYS  57           HA       LYS  57  17.253  -8.927 -14.339
    3    HB2  LYS  57           HB2      LYS  57  19.068  -9.195 -12.623
    4    HB3  LYS  57           HB3      LYS  57  17.973 -10.189 -11.672
    5    HG2  LYS  57           HG2      LYS  57  17.831 -11.821 -13.496
    6    HG3  LYS  57           HG3      LYS  57  18.880 -10.824 -14.496
    7    HD2  LYS  57           HD2      LYS  57  20.703 -11.082 -12.845
    8    HD3  LYS  57           HD3      LYS  57  19.659 -12.099 -11.853
    9    HE2  LYS  57           HE2      LYS  57  21.112 -13.524 -13.211
   10    HE3  LYS  57           HE3      LYS  57  19.453 -13.699 -13.781
   11    HZ3  LYS  57           HZ1      LYS  57  19.888 -12.214 -15.571
   12    HZ2  LYS  57           HZ2      LYS  57  21.107 -13.397 -15.570
   13    HZ1  LYS  57           HZ3      LYS  57  21.431 -11.839 -14.975

  No H/Q in entry =          13
  In of MODEL   69
    1    H    LEU  58           H        LEU  58  15.512  -9.604 -11.343
    2    HA   LEU  58           HA       LEU  58  14.270 -11.969 -12.272
    3    HB2  LEU  58           HB2      LEU  58  13.512 -10.072 -10.056
    4    HB3  LEU  58           HB3      LEU  58  12.696 -11.606 -10.368
    5    HG   LEU  58           HG       LEU  58  15.678 -11.340  -9.854
    6   HD11  LEU  58          HD11      LEU  58  13.331 -11.759  -8.031
    7   HD13  LEU  58          HD12      LEU  58  14.791 -10.802  -7.784
    8   HD12  LEU  58          HD13      LEU  58  14.860 -12.559  -7.659
    9   HD22  LEU  58          HD21      LEU  58  15.539 -13.396 -10.891
   10   HD21  LEU  58          HD22      LEU  58  13.830 -13.602 -10.507
   11   HD23  LEU  58          HD23      LEU  58  15.055 -13.913  -9.277

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  59           H        ILE  59  13.599  -8.626 -12.928
    2    HA   ILE  59           HA       ILE  59  10.869  -9.262 -13.833
    3    HB   ILE  59           HB       ILE  59  11.700  -6.988 -12.628
    4   HG12  ILE  59          HG12      ILE  59   9.755  -6.852 -14.944
    5   HG13  ILE  59          HG13      ILE  59   9.359  -7.625 -13.430
    6   HG23  ILE  59          HG21      ILE  59  12.250  -5.258 -14.140
    7   HG22  ILE  59          HG22      ILE  59  11.735  -6.177 -15.536
    8   HG21  ILE  59          HG23      ILE  59  13.228  -6.594 -14.700
    9   HD12  ILE  59          HD11      ILE  59  10.096  -4.736 -13.862
   10   HD11  ILE  59          HD12      ILE  59  10.010  -5.469 -12.262
   11   HD13  ILE  59          HD13      ILE  59   8.561  -5.369 -13.264

  No H/Q in entry =          11
  In of MODEL   69
    1    H    GLU  60           H        GLU  60  14.057  -8.413 -15.132
    2    HA   GLU  60           HA       GLU  60  13.241  -7.997 -17.827
    3    HB2  GLU  60           HB2      GLU  60  15.499  -7.871 -18.315
    4    HB3  GLU  60           HB3      GLU  60  15.538  -7.558 -16.582
    5    HG2  GLU  60           HG2      GLU  60  17.188  -9.214 -16.845
    6    HG3  GLU  60           HG3      GLU  60  15.775 -10.148 -16.360

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLY  61           H        GLY  61  14.235 -10.890 -16.041
    2    HA3  GLY  61           HA2      GLY  61  13.655 -12.524 -18.442
    3    HA2  GLY  61           HA3      GLY  61  14.704 -13.015 -17.117

  No H/Q in entry =           3
  In of MODEL   69
    1    H    ASP  62           H        ASP  62  11.595 -11.461 -16.693
    2    HA   ASP  62           HA       ASP  62  10.689 -13.539 -14.947
    3    HB2  ASP  62           HB2      ASP  62   8.625 -12.161 -14.839
    4    HB3  ASP  62           HB3      ASP  62  10.090 -11.244 -14.498

  No H/Q in entry =           4
  In of MODEL   69
    1    H    ALA  63           H        ALA  63  11.173 -14.567 -17.628
    2    HA   ALA  63           HA       ALA  63   8.773 -14.896 -19.119
    3    HB1  ALA  63           HB1      ALA  63   9.929 -16.757 -20.197
    4    HB3  ALA  63           HB2      ALA  63  11.127 -16.791 -18.906
    5    HB2  ALA  63           HB3      ALA  63  11.043 -15.406 -19.994

  No H/Q in entry =           5
  In of MODEL   69
    1    H    GLY  64           H        GLY  64  10.242 -16.722 -16.485
    2    HA3  GLY  64           HA2      GLY  64   9.434 -18.337 -15.076
    3    HA2  GLY  64           HA3      GLY  64   7.834 -17.699 -15.427

  No H/Q in entry =           3
  In of MODEL   69
    1    H    GLU  65           H        GLU  65   6.612 -19.489 -15.795
    2    HA   GLU  65           HA       GLU  65   7.592 -21.857 -16.974
    3    HB2  GLU  65           HB2      GLU  65   4.777 -20.850 -16.590
    4    HB3  GLU  65           HB3      GLU  65   5.166 -22.462 -17.191
    5    HG2  GLU  65           HG2      GLU  65   6.419 -22.958 -15.155
    6    HG3  GLU  65           HG3      GLU  65   6.143 -21.323 -14.557

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLY  66           H        GLY  66   5.916 -22.739 -18.779
    2    HA3  GLY  66           HA2      GLY  66   6.874 -21.797 -21.244
    3    HA2  GLY  66           HA3      GLY  66   5.561 -22.935 -21.018

  No H/Q in entry =           3
  In of MODEL   69
    1    H    LYS  67           H        LYS  67   3.842 -21.189 -19.578
    2    HA   LYS  67           HA       LYS  67   2.584 -19.883 -21.782
    3    HB2  LYS  67           HB2      LYS  67   1.884 -20.118 -18.861
    4    HB3  LYS  67           HB3      LYS  67   0.856 -19.305 -20.047
    5    HG2  LYS  67           HG2      LYS  67   0.724 -21.331 -21.393
    6    HG3  LYS  67           HG3      LYS  67   1.859 -22.153 -20.325
    7    HD2  LYS  67           HD2      LYS  67  -0.270 -22.923 -19.629
    8    HD3  LYS  67           HD3      LYS  67   0.150 -21.677 -18.451
    9    HE2  LYS  67           HE2      LYS  67  -1.232 -20.049 -19.552
   10    HE3  LYS  67           HE3      LYS  67  -1.480 -21.112 -20.937
   11    HZ3  LYS  67           HZ1      LYS  67  -3.369 -21.566 -19.814
   12    HZ2  LYS  67           HZ2      LYS  67  -2.710 -21.180 -18.298
   13    HZ1  LYS  67           HZ3      LYS  67  -2.367 -22.680 -19.019

  No H/Q in entry =          13
  In of MODEL   69
    1    H    MET  68           H        MET  68   1.897 -17.779 -21.965
    2    HA   MET  68           HA       MET  68   3.765 -15.785 -21.838
    3    HB2  MET  68           HB2      MET  68   0.756 -15.555 -21.812
    4    HB3  MET  68           HB3      MET  68   1.855 -14.217 -22.148
    5    HG2  MET  68           HG2      MET  68   1.781 -16.818 -23.704
    6    HG3  MET  68           HG3      MET  68   1.032 -15.309 -24.230
    7    HE2  MET  68           HE1      MET  68   3.182 -12.954 -23.510
    8    HE1  MET  68           HE2      MET  68   1.981 -13.320 -24.745
    9    HE3  MET  68           HE3      MET  68   3.643 -12.973 -25.218

  No H/Q in entry =           9
  In of MODEL   69
    1    H    LYS  69           H        LYS  69   2.322 -17.051 -19.077
    2    HA   LYS  69           HA       LYS  69   1.912 -14.681 -17.568
    3    HB2  LYS  69           HB2      LYS  69   2.379 -17.488 -16.551
    4    HB3  LYS  69           HB3      LYS  69   1.642 -16.154 -15.659
    5    HG2  LYS  69           HG2      LYS  69   0.566 -17.218 -18.283
    6    HG3  LYS  69           HG3      LYS  69  -0.028 -17.728 -16.702
    7    HD2  LYS  69           HD2      LYS  69  -0.383 -15.209 -16.241
    8    HD3  LYS  69           HD3      LYS  69  -0.215 -15.006 -17.986
    9    HE2  LYS  69           HE2      LYS  69  -2.063 -16.526 -18.396
   10    HE3  LYS  69           HE3      LYS  69  -2.172 -16.915 -16.679
   11    HZ2  LYS  69           HZ1      LYS  69  -2.798 -14.349 -18.010
   12    HZ1  LYS  69           HZ2      LYS  69  -2.561 -14.465 -16.333
   13    HZ3  LYS  69           HZ3      LYS  69  -3.826 -15.321 -17.076

  No H/Q in entry =          13
  In of MODEL   69
    1    H    VAL  70           H        VAL  70   3.014 -14.598 -15.224
    2    HA   VAL  70           HA       VAL  70   5.958 -14.675 -15.555
    3    HB   VAL  70           HB       VAL  70   6.063 -12.511 -14.354
    4   HG12  VAL  70          HG11      VAL  70   4.931 -11.148 -16.254
    5   HG11  VAL  70          HG12      VAL  70   4.524 -12.722 -16.938
    6   HG13  VAL  70          HG13      VAL  70   6.212 -12.273 -16.700
    7   HG21  VAL  70          HG21      VAL  70   3.031 -12.596 -14.635
    8   HG23  VAL  70          HG22      VAL  70   3.957 -11.190 -14.109
    9   HG22  VAL  70          HG23      VAL  70   3.933 -12.649 -13.118

  No H/Q in entry =           9
  In of MODEL   69
    1    H    SER  71           H        SER  71   7.093 -14.544 -13.446
    2    HA   SER  71           HA       SER  71   6.197 -16.496 -11.604
    3    HB2  SER  71           HB2      SER  71   8.589 -15.810 -11.963
    4    HB3  SER  71           HB3      SER  71   8.236 -14.314 -11.102
    5    HG   SER  71           HG       SER  71   7.634 -16.856 -10.019

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LEU  72           H        LEU  72   4.790 -16.351 -10.002
    2    HA   LEU  72           HA       LEU  72   3.254 -14.036  -9.524
    3    HB2  LEU  72           HB2      LEU  72   3.555 -16.603  -7.972
    4    HB3  LEU  72           HB3      LEU  72   2.396 -15.344  -7.549
    5    HG   LEU  72           HG       LEU  72   2.515 -16.634 -10.296
    6   HD11  LEU  72          HD11      LEU  72   1.978 -18.322  -8.575
    7   HD13  LEU  72          HD12      LEU  72   0.562 -17.957  -9.561
    8   HD12  LEU  72          HD13      LEU  72   0.709 -17.273  -7.942
    9   HD23  LEU  72          HD21      LEU  72   0.028 -15.793 -10.149
   10   HD22  LEU  72          HD22      LEU  72   1.284 -14.628 -10.532
   11   HD21  LEU  72          HD23      LEU  72   0.643 -14.726  -8.894

  No H/Q in entry =          11
  In of MODEL   69
    1    H    VAL  73           H        VAL  73   5.929 -15.491  -7.794
    2    HA   VAL  73           HA       VAL  73   5.904 -13.971  -5.453
    3    HB   VAL  73           HB       VAL  73   8.084 -14.794  -5.056
    4   HG12  VAL  73          HG11      VAL  73   6.765 -16.812  -6.890
    5   HG11  VAL  73          HG12      VAL  73   6.236 -16.493  -5.238
    6   HG13  VAL  73          HG13      VAL  73   7.844 -17.150  -5.539
    7   HG21  VAL  73          HG21      VAL  73   8.238 -14.816  -8.051
    8   HG23  VAL  73          HG22      VAL  73   9.238 -15.947  -7.140
    9   HG22  VAL  73          HG23      VAL  73   9.408 -14.211  -6.879

  No H/Q in entry =           9
  In of MODEL   69
    1    H    LEU  74           H        LEU  74   6.855 -13.062  -8.637
    2    HA   LEU  74           HA       LEU  74   8.812 -11.122  -8.158
    3    HB2  LEU  74           HB2      LEU  74   8.324 -11.857 -10.395
    4    HB3  LEU  74           HB3      LEU  74   6.663 -11.284 -10.269
    5    HG   LEU  74           HG       LEU  74   7.473  -8.962 -10.060
    6   HD12  LEU  74          HD11      LEU  74   9.974  -8.673 -10.673
    7   HD11  LEU  74          HD12      LEU  74  10.150 -10.354 -10.172
    8   HD13  LEU  74          HD13      LEU  74   9.593  -9.144  -9.017
    9   HD22  LEU  74          HD21      LEU  74   7.768  -8.729 -12.315
   10   HD21  LEU  74          HD22      LEU  74   7.236 -10.394 -12.264
   11   HD23  LEU  74          HD23      LEU  74   8.943 -10.039 -12.406

  No H/Q in entry =          11
  In of MODEL   69
    1    H    VAL  75           H        VAL  75   5.314 -10.724  -8.464
    2    HA   VAL  75           HA       VAL  75   5.233  -7.971  -7.861
    3    HB   VAL  75           HB       VAL  75   3.142 -10.110  -7.456
    4   HG13  VAL  75          HG11      VAL  75   2.669  -8.205  -5.969
    5   HG12  VAL  75          HG12      VAL  75   1.581  -8.140  -7.348
    6   HG11  VAL  75          HG13      VAL  75   2.976  -7.075  -7.284
    7   HG21  VAL  75          HG21      VAL  75   4.005  -9.566  -9.795
    8   HG23  VAL  75          HG22      VAL  75   3.378  -7.936  -9.557
    9   HG22  VAL  75          HG23      VAL  75   2.276  -9.314  -9.559

  No H/Q in entry =           9
  In of MODEL   69
    1    H    GLU  76           H        GLU  76   4.998 -10.860  -5.764
    2    HA   GLU  76           HA       GLU  76   4.562  -9.511  -3.329
    3    HB2  GLU  76           HB2      GLU  76   4.377 -11.975  -3.574
    4    HB3  GLU  76           HB3      GLU  76   6.108 -12.079  -3.838
    5    HG2  GLU  76           HG2      GLU  76   5.687 -12.672  -1.536
    6    HG3  GLU  76           HG3      GLU  76   6.454 -11.094  -1.530

  No H/Q in entry =           6
  In of MODEL   69
    1    H    ALA  77           H        ALA  77   7.599 -10.419  -4.936
    2    HA   ALA  77           HA       ALA  77   9.317  -9.392  -2.935
    3    HB3  ALA  77           HB1      ALA  77   9.761  -9.773  -5.905
    4    HB1  ALA  77           HB2      ALA  77  10.168 -10.909  -4.619
    5    HB2  ALA  77           HB3      ALA  77  11.035  -9.379  -4.750

  No H/Q in entry =           5
  In of MODEL   69
    1    H    GLN  78           H        GLN  78   7.894  -7.954  -5.824
    2    HA   GLN  78           HA       GLN  78   9.256  -5.480  -5.722
    3    HB2  GLN  78           HB2      GLN  78   7.870  -6.446  -7.640
    4    HB3  GLN  78           HB3      GLN  78   6.445  -5.909  -6.753
    5    HG2  GLN  78           HG2      GLN  78   7.180  -3.611  -6.835
    6    HG3  GLN  78           HG3      GLN  78   8.731  -4.081  -7.530
    7   HE21  GLN  78          HE21      GLN  78   8.241  -5.660  -9.629
    8   HE22  GLN  78          HE22      GLN  78   7.143  -4.969 -10.725

  No H/Q in entry =           8
  In of MODEL   69
    1    H    LEU  79           H        LEU  79   6.250  -6.615  -4.262
    2    HA   LEU  79           HA       LEU  79   5.278  -4.210  -3.227
    3    HB2  LEU  79           HB2      LEU  79   3.956  -6.257  -3.167
    4    HB3  LEU  79           HB3      LEU  79   5.112  -7.007  -2.070
    5    HG   LEU  79           HG       LEU  79   4.586  -5.373  -0.327
    6   HD13  LEU  79          HD11      LEU  79   4.116  -3.350  -1.361
    7   HD12  LEU  79          HD12      LEU  79   2.494  -3.872  -0.905
    8   HD11  LEU  79          HD13      LEU  79   3.054  -4.087  -2.562
    9   HD23  LEU  79          HD21      LEU  79   1.999  -5.856  -0.209
   10   HD22  LEU  79          HD22      LEU  79   3.134  -7.200  -0.122
   11   HD21  LEU  79          HD23      LEU  79   2.304  -6.851  -1.635

  No H/Q in entry =          11
  In of MODEL   69
    1    H    HIS  80           H        HIS  80   7.470  -6.562  -1.683
    2    HA   HIS  80           HA       HIS  80   7.791  -5.035   0.691
    3    HB2  HIS  80           HB2      HIS  80   9.106  -7.397  -0.537
    4    HB3  HIS  80           HB3      HIS  80  10.034  -6.511   0.674
    5    HD1  HIS  80           HD1      HIS  80   9.568  -7.159   3.019
    6    HD2  HIS  80           HD2      HIS  80   6.319  -7.982   0.540
    7    HE1  HIS  80           HE1      HIS  80   7.809  -8.263   4.482
    8    HE2  HIS  80           HE2      HIS  80   5.822  -8.769   2.979

  No H/Q in entry =           8
  In of MODEL   69
    1    H    LEU  81           H        LEU  81   9.762  -5.302  -2.246
    2    HA   LEU  81           HA       LEU  81  11.823  -3.575  -1.381
    3    HB2  LEU  81           HB2      LEU  81  10.867  -4.348  -4.138
    4    HB3  LEU  81           HB3      LEU  81  12.295  -3.349  -3.858
    5    HG   LEU  81           HG       LEU  81  11.905  -6.076  -2.596
    6   HD12  LEU  81          HD11      LEU  81  13.698  -6.700  -4.370
    7   HD11  LEU  81          HD12      LEU  81  13.129  -5.269  -5.227
    8   HD13  LEU  81          HD13      LEU  81  12.015  -6.590  -4.883
    9   HD23  LEU  81          HD21      LEU  81  14.535  -5.773  -2.610
   10   HD22  LEU  81          HD22      LEU  81  13.570  -5.015  -1.344
   11   HD21  LEU  81          HD23      LEU  81  14.138  -4.058  -2.712

  No H/Q in entry =          11
  In of MODEL   69
    1    H    MET  82           H        MET  82   8.882  -2.914  -3.281
    2    HA   MET  82           HA       MET  82   9.429  -0.188  -3.772
    3    HB2  MET  82           HB2      MET  82   6.863  -1.771  -3.627
    4    HB3  MET  82           HB3      MET  82   6.867  -0.044  -3.982
    5    HG2  MET  82           HG2      MET  82   8.440  -2.117  -5.547
    6    HG3  MET  82           HG3      MET  82   6.870  -1.484  -6.038
    7    HE3  MET  82           HE1      MET  82   7.322   1.976  -7.195
    8    HE2  MET  82           HE2      MET  82   6.966   1.741  -5.486
    9    HE1  MET  82           HE3      MET  82   6.282   0.642  -6.679

  No H/Q in entry =           9
  In of MODEL   69
    1    H    THR  83           H        THR  83   7.659  -1.793  -1.156
    2    HA   THR  83           HA       THR  83   6.834   0.552   0.193
    3    HB   THR  83           HB       THR  83   6.715  -1.034   2.204
    4    HG1  THR  83           HG1      THR  83   7.459  -2.986   1.954
    5   HG22  THR  83          HG21      THR  83   5.037  -2.583   0.745
    6   HG21  THR  83          HG22      THR  83   5.258  -1.249  -0.381
    7   HG23  THR  83          HG23      THR  83   4.637  -0.940   1.241

  No H/Q in entry =           7
  In of MODEL   69
    1    H    SER  84           H        SER  84   9.653  -1.563   0.670
    2    HA   SER  84           HA       SER  84  10.744  -0.151   2.854
    3    HB2  SER  84           HB2      SER  84  11.965  -1.988   0.805
    4    HB3  SER  84           HB3      SER  84  12.930  -1.247   2.080
    5    HG   SER  84           HG       SER  84  10.649  -2.926   2.355

  No H/Q in entry =           5
  In of MODEL   69
    1    H    MET  85           H        MET  85  11.459   0.126  -0.640
    2    HA   MET  85           HA       MET  85  13.471   2.079  -0.401
    3    HB2  MET  85           HB2      MET  85  13.041   0.810  -2.469
    4    HB3  MET  85           HB3      MET  85  11.520   1.678  -2.676
    5    HG2  MET  85           HG2      MET  85  12.740   3.814  -2.798
    6    HG3  MET  85           HG3      MET  85  14.263   2.963  -2.560
    7    HE1  MET  85           HE1      MET  85  11.664   4.245  -4.801
    8    HE3  MET  85           HE2      MET  85  10.976   2.625  -4.864
    9    HE2  MET  85           HE3      MET  85  11.711   3.312  -6.305

  No H/Q in entry =           9
  In of MODEL   69
    1    H    LEU  86           H        LEU  86   9.978   2.436  -0.868
    2    HA   LEU  86           HA       LEU  86   9.927   5.250  -1.033
    3    HB2  LEU  86           HB2      LEU  86   8.068   3.604  -1.598
    4    HB3  LEU  86           HB3      LEU  86   7.757   3.506   0.135
    5    HG   LEU  86           HG       LEU  86   7.610   6.068   0.099
    6   HD11  LEU  86          HD11      LEU  86   8.353   5.644  -2.614
    7   HD13  LEU  86          HD12      LEU  86   7.934   7.169  -1.840
    8   HD12  LEU  86          HD13      LEU  86   6.683   6.218  -2.636
    9   HD23  LEU  86          HD21      LEU  86   5.450   4.737  -1.547
   10   HD22  LEU  86          HD22      LEU  86   5.281   5.991  -0.321
   11   HD21  LEU  86          HD23      LEU  86   5.676   4.342   0.158

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ALA  87           H        ALA  87   9.480   3.059   1.705
    2    HA   ALA  87           HA       ALA  87   8.965   4.964   3.692
    3    HB1  ALA  87           HB1      ALA  87   9.755   2.140   3.580
    4    HB3  ALA  87           HB2      ALA  87   8.647   2.953   4.683
    5    HB2  ALA  87           HB3      ALA  87  10.379   2.972   5.008

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ARG  88           H        ARG  88  12.029   3.528   2.668
    2    HA   ARG  88           HA       ARG  88  13.667   4.886   4.490
    3    HB2  ARG  88           HB2      ARG  88  14.308   2.916   3.067
    4    HB3  ARG  88           HB3      ARG  88  14.451   4.016   1.699
    5    HG2  ARG  88           HG2      ARG  88  15.954   5.310   3.636
    6    HG3  ARG  88           HG3      ARG  88  16.269   3.617   4.001
    7    HD2  ARG  88           HD2      ARG  88  17.513   3.324   2.139
    8    HD3  ARG  88           HD3      ARG  88  16.369   4.208   1.124
    9    HE   ARG  88           HE       ARG  88  18.782   5.251   2.149
   10   HH21  ARG  88          HH11      ARG  88  19.138   7.469   1.963
   11   HH22  ARG  88          HH12      ARG  88  17.792   8.550   1.842
   12   HH11  ARG  88          HH21      ARG  88  15.444   6.026   1.914
   13   HH12  ARG  88          HH22      ARG  88  15.699   7.730   1.789

  No H/Q in entry =          13
  In of MODEL   69
    1    H    GLU  89           H        GLU  89  12.661   5.809   1.183
    2    HA   GLU  89           HA       GLU  89  14.220   8.160   1.022
    3    HB2  GLU  89           HB2      GLU  89  13.047   7.137  -0.918
    4    HB3  GLU  89           HB3      GLU  89  11.513   7.684  -0.240
    5    HG2  GLU  89           HG2      GLU  89  12.227  10.018  -0.397
    6    HG3  GLU  89           HG3      GLU  89  13.822   9.521  -0.955

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LEU  90           H        LEU  90  10.901   7.664   2.187
    2    HA   LEU  90           HA       LEU  90  10.408  10.397   2.784
    3    HB2  LEU  90           HB2      LEU  90   9.211   7.824   3.810
    4    HB3  LEU  90           HB3      LEU  90   8.594   9.421   4.250
    5    HG   LEU  90           HG       LEU  90   8.974   8.555   1.371
    6   HD12  LEU  90          HD11      LEU  90   6.439   8.241   1.461
    7   HD11  LEU  90          HD12      LEU  90   6.614   8.219   3.216
    8   HD13  LEU  90          HD13      LEU  90   7.414   6.990   2.235
    9   HD22  LEU  90          HD21      LEU  90   8.693  10.865   1.314
   10   HD21  LEU  90          HD22      LEU  90   7.724  10.895   2.786
   11   HD23  LEU  90          HD23      LEU  90   7.005  10.353   1.270

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  91           H        ILE  91  11.678   7.697   4.676
    2    HA   ILE  91           HA       ILE  91  11.855   9.047   7.150
    3    HB   ILE  91           HB       ILE  91  13.382   6.706   5.995
    4   HG12  ILE  91          HG12      ILE  91  11.393   6.872   8.279
    5   HG13  ILE  91          HG13      ILE  91  10.902   6.603   6.608
    6   HG22  ILE  91          HG21      ILE  91  13.882   6.474   8.629
    7   HG21  ILE  91          HG22      ILE  91  13.815   8.234   8.539
    8   HG23  ILE  91          HG23      ILE  91  14.977   7.345   7.555
    9   HD13  ILE  91          HD11      ILE  91  11.891   4.496   6.514
   10   HD12  ILE  91          HD12      ILE  91  11.318   4.548   8.180
   11   HD11  ILE  91          HD13      ILE  91  13.017   4.853   7.824

  No H/Q in entry =          11
  In of MODEL   69
    1    H    THR  92           H        THR  92  14.039   8.881   4.372
    2    HA   THR  92           HA       THR  92  16.226  10.254   5.514
    3    HB   THR  92           HB       THR  92  15.205  10.152   2.664
    4    HG1  THR  92           HG1      THR  92  16.031   8.248   3.048
    5   HG22  THR  92          HG21      THR  92  17.776  10.829   2.344
    6   HG21  THR  92          HG22      THR  92  17.490  11.643   3.882
    7   HG23  THR  92          HG23      THR  92  16.506  12.044   2.475

  No H/Q in entry =           7
  In of MODEL   69
    1    H    GLU  93           H        GLU  93  13.325  11.435   3.826
    2    HA   GLU  93           HA       GLU  93  13.937  14.191   3.949
    3    HB2  GLU  93           HB2      GLU  93  11.225  12.834   3.987
    4    HB3  GLU  93           HB3      GLU  93  11.519  14.534   3.622
    5    HG2  GLU  93           HG2      GLU  93  12.825  12.293   2.065
    6    HG3  GLU  93           HG3      GLU  93  11.277  12.988   1.600

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LEU  94           H        LEU  94  12.208  12.032   6.168
    2    HA   LEU  94           HA       LEU  94  11.432  13.972   8.065
    3    HB2  LEU  94           HB2      LEU  94  11.994  11.012   8.315
    4    HB3  LEU  94           HB3      LEU  94  11.444  11.983   9.677
    5    HG   LEU  94           HG       LEU  94   9.930  12.059   7.067
    6   HD11  LEU  94          HD11      LEU  94  10.023   9.826   9.057
    7   HD13  LEU  94          HD12      LEU  94   9.701   9.776   7.326
    8   HD12  LEU  94          HD13      LEU  94   8.438  10.294   8.442
    9   HD23  LEU  94          HD21      LEU  94   8.031  12.460   8.692
   10   HD22  LEU  94          HD22      LEU  94   9.278  13.707   8.721
   11   HD21  LEU  94          HD23      LEU  94   9.223  12.483   9.989

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  95           H        ILE  95  14.392  12.027   7.781
    2    HA   ILE  95           HA       ILE  95  15.594  12.928  10.186
    3    HB   ILE  95           HB       ILE  95  16.796  11.867   7.617
    4   HG12  ILE  95          HG12      ILE  95  16.526  10.652  10.381
    5   HG13  ILE  95          HG13      ILE  95  15.342  10.408   9.099
    6   HG21  ILE  95          HG21      ILE  95  18.087  12.651  10.249
    7   HG23  ILE  95          HG22      ILE  95  18.533  13.186   8.627
    8   HG22  ILE  95          HG23      ILE  95  18.836  11.521   9.123
    9   HD13  ILE  95          HD11      ILE  95  16.800   9.128   7.811
   10   HD12  ILE  95          HD12      ILE  95  17.290   8.667   9.438
   11   HD11  ILE  95          HD13      ILE  95  18.239   9.846   8.535

  No H/Q in entry =          11
  In of MODEL   69
    1    H    GLU  96           H        GLU  96  15.715  14.180   6.858
    2    HA   GLU  96           HA       GLU  96  17.580  16.245   7.324
    3    HB2  GLU  96           HB2      GLU  96  16.884  15.600   5.069
    4    HB3  GLU  96           HB3      GLU  96  15.248  16.165   5.393
    5    HG2  GLU  96           HG2      GLU  96  15.820  18.294   4.856
    6    HG3  GLU  96           HG3      GLU  96  17.133  18.280   6.022

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LEU  97           H        LEU  97  14.073  16.076   7.795
    2    HA   LEU  97           HA       LEU  97  13.680  18.809   8.457
    3    HB2  LEU  97           HB2      LEU  97  12.155  16.288   9.075
    4    HB3  LEU  97           HB3      LEU  97  11.659  17.834   9.762
    5    HG   LEU  97           HG       LEU  97  12.104  17.433   6.789
    6   HD12  LEU  97          HD11      LEU  97   9.578  17.320   6.701
    7   HD11  LEU  97          HD12      LEU  97   9.592  17.110   8.450
    8   HD13  LEU  97          HD13      LEU  97  10.353  15.904   7.411
    9   HD23  LEU  97          HD21      LEU  97  10.378  19.407   6.854
   10   HD22  LEU  97          HD22      LEU  97  12.066  19.754   7.228
   11   HD21  LEU  97          HD23      LEU  97  10.892  19.583   8.531

  No H/Q in entry =          11
  In of MODEL   69
    1    H    HIS  98           H        HIS  98  14.509  15.966  10.427
    2    HA   HIS  98           HA       HIS  98  14.389  17.213  12.952
    3    HB2  HIS  98           HB2      HIS  98  16.113  14.951  11.916
    4    HB3  HIS  98           HB3      HIS  98  16.135  15.480  13.600
    5    HD1  HIS  98           HD1      HIS  98  13.895  13.879  11.025
    6    HD2  HIS  98           HD2      HIS  98  13.843  14.775  15.096
    7    HE1  HIS  98           HE1      HIS  98  11.875  12.690  11.995
    8    HE2  HIS  98           HE2      HIS  98  11.823  13.228  14.470

  No H/Q in entry =           8
  In of MODEL   69
    1    H    GLU  99           H        GLU  99  16.912  17.097  10.485
    2    HA   GLU  99           HA       GLU  99  18.924  18.408  11.998
    3    HB2  GLU  99           HB2      GLU  99  19.371  17.130   9.915
    4    HB3  GLU  99           HB3      GLU  99  18.557  18.395   8.992
    5    HG2  GLU  99           HG2      GLU  99  20.185  20.051   9.773
    6    HG3  GLU  99           HG3      GLU  99  20.969  18.838  10.779

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LYS 100           H        LYS 100  16.381  19.598   9.819
    2    HA   LYS 100           HA       LYS 100  17.197  22.330   9.969
    3    HB2  LYS 100           HB2      LYS 100  14.547  21.062   9.240
    4    HB3  LYS 100           HB3      LYS 100  14.856  22.799   9.156
    5    HG2  LYS 100           HG2      LYS 100  16.808  22.347   7.662
    6    HG3  LYS 100           HG3      LYS 100  16.384  20.632   7.675
    7    HD2  LYS 100           HD2      LYS 100  14.180  21.161   6.705
    8    HD3  LYS 100           HD3      LYS 100  14.587  22.878   6.699
    9    HE2  LYS 100           HE2      LYS 100  16.525  22.394   5.213
   10    HE3  LYS 100           HE3      LYS 100  16.048  20.692   5.175
   11    HZ1  LYS 100           HZ1      LYS 100  14.227  22.901   4.376
   12    HZ3  LYS 100           HZ2      LYS 100  14.029  21.235   4.106
   13    HZ2  LYS 100           HZ3      LYS 100  15.235  22.094   3.275

  No H/Q in entry =          13
  In of MODEL   69
    1    H    LEU 101           H        LEU 101  15.111  20.285  11.948
    2    HA   LEU 101           HA       LEU 101  13.977  22.351  13.553
    3    HB2  LEU 101           HB2      LEU 101  14.405  19.397  13.914
    4    HB3  LEU 101           HB3      LEU 101  13.892  20.372  15.287
    5    HG   LEU 101           HG       LEU 101  12.442  20.486  12.636
    6   HD12  LEU 101          HD11      LEU 101  10.788  18.925  13.916
    7   HD11  LEU 101          HD12      LEU 101  12.192  18.497  14.891
    8   HD13  LEU 101          HD13      LEU 101  12.202  18.201  13.152
    9   HD21  LEU 101          HD21      LEU 101  11.825  21.266  15.501
   10   HD23  LEU 101          HD22      LEU 101  10.548  21.056  14.305
   11   HD22  LEU 101          HD23      LEU 101  11.788  22.284  14.059

  No H/Q in entry =          11
  In of MODEL   69
    1    H    LYS 102           H        LYS 102  17.115  21.726  13.074
    2    HA   LYS 102           HA       LYS 102  18.980  22.578  14.129
    3    HB2  LYS 102           HB2      LYS 102  17.190  24.098  15.293
    4    HB3  LYS 102           HB3      LYS 102  17.407  23.026  16.661
    5    HG2  LYS 102           HG2      LYS 102  19.299  25.031  15.481
    6    HG3  LYS 102           HG3      LYS 102  18.936  24.709  17.163
    7    HD2  LYS 102           HD2      LYS 102  20.569  22.796  15.445
    8    HD3  LYS 102           HD3      LYS 102  21.279  24.108  16.377
    9    HE2  LYS 102           HE2      LYS 102  20.875  21.556  17.335
   10    HE3  LYS 102           HE3      LYS 102  21.116  22.990  18.333
   11    HZ2  LYS 102           HZ1      LYS 102  19.146  21.716  18.967
   12    HZ1  LYS 102           HZ2      LYS 102  18.485  21.960  17.428
   13    HZ3  LYS 102           HZ3      LYS 102  18.736  23.282  18.458

  No H/Q in entry =          13
  In of MODEL   69
    1    H    ALA 103           H        ALA 103  16.928  20.972  16.567
    2    HA   ALA 103           HA       ALA 103  18.667  19.739  18.193
    3    HB2  ALA 103           HB1      ALA 103  17.069  17.743  18.195
    4    HB1  ALA 103           HB2      ALA 103  16.164  18.610  16.953
    5    HB3  ALA 103           HB3      ALA 103  16.366  19.320  18.554

  No H/Q in entry =           5
  In of MODEL   69
    1    H1   ALA   1           H3       ALA   1  -1.929  -6.738 -21.340
    2    H2   ALA   1           H2       ALA   1  -2.728  -8.171 -20.886
    3    H3   ALA   1           H1       ALA   1  -1.127  -8.229 -21.460
    4    HA   ALA   1           HA       ALA   1  -1.989  -8.680 -23.449
    5    HB1  ALA   1           HB1      ALA   1  -4.125  -9.385 -22.954
    6    HB2  ALA   1           HB2      ALA   1  -4.563  -7.867 -23.737
    7    HB3  ALA   1           HB3      ALA   1  -4.481  -7.959 -21.980

  No H/Q in entry =           7
  In of MODEL   69
    1    H    GLU   2           H        GLU   2  -2.834  -7.471 -25.421
    2    HA   GLU   2           HA       GLU   2  -1.432  -5.462 -26.303
    3    HB2  GLU   2           HB2      GLU   2  -4.443  -5.505 -26.585
    4    HB3  GLU   2           HB3      GLU   2  -3.329  -4.644 -27.643
    5    HG2  GLU   2           HG2      GLU   2  -2.853  -6.530 -28.815
    6    HG3  GLU   2           HG3      GLU   2  -2.545  -7.447 -27.347

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLU   3           H        GLU   3  -4.572  -4.188 -25.357
    2    HA   GLU   3           HA       GLU   3  -3.499  -1.643 -24.726
    3    HB2  GLU   3           HB2      GLU   3  -6.192  -2.941 -24.369
    4    HB3  GLU   3           HB3      GLU   3  -5.875  -1.332 -23.717
    5    HG2  GLU   3           HG2      GLU   3  -5.537  -0.394 -25.841
    6    HG3  GLU   3           HG3      GLU   3  -5.163  -1.948 -26.580

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LEU   4           H        LEU   4  -5.080  -4.004 -22.542
    2    HA   LEU   4           HA       LEU   4  -4.678  -2.794 -20.148
    3    HB2  LEU   4           HB2      LEU   4  -4.162  -5.736 -20.642
    4    HB3  LEU   4           HB3      LEU   4  -4.544  -4.997 -19.089
    5    HG   LEU   4           HG       LEU   4  -6.347  -5.042 -21.532
    6   HD13  LEU   4          HD11      LEU   4  -7.540  -6.757 -20.530
    7   HD12  LEU   4          HD12      LEU   4  -7.033  -6.311 -18.902
    8   HD11  LEU   4          HD13      LEU   4  -5.916  -7.156 -19.972
    9   HD23  LEU   4          HD21      LEU   4  -8.003  -4.230 -19.639
   10   HD22  LEU   4          HD22      LEU   4  -6.966  -3.062 -20.454
   11   HD21  LEU   4          HD23      LEU   4  -6.525  -3.665 -18.858

  No H/Q in entry =          11
  In of MODEL   69
    1    H    GLU   5           H        GLU   5  -2.215  -4.644 -21.920
    2    HA   GLU   5           HA       GLU   5  -0.205  -4.387 -19.906
    3    HB2  GLU   5           HB2      GLU   5  -0.165  -6.149 -21.659
    4    HB3  GLU   5           HB3      GLU   5   0.123  -4.905 -22.875
    5    HG2  GLU   5           HG2      GLU   5   2.209  -4.261 -21.746
    6    HG3  GLU   5           HG3      GLU   5   1.922  -5.477 -20.501

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLU   6           H        GLU   6  -0.864  -2.650 -22.932
    2    HA   GLU   6           HA       GLU   6   1.323  -0.836 -22.679
    3    HB2  GLU   6           HB2      GLU   6   0.204  -1.271 -24.835
    4    HB3  GLU   6           HB3      GLU   6  -1.274  -0.537 -24.211
    5    HG2  GLU   6           HG2      GLU   6  -0.100   1.595 -23.891
    6    HG3  GLU   6           HG3      GLU   6   1.400   0.870 -24.465

  No H/Q in entry =           6
  In of MODEL   69
    1    H    VAL   7           H        VAL   7  -2.003  -0.890 -21.594
    2    HA   VAL   7           HA       VAL   7  -2.195   1.819 -20.738
    3    HB   VAL   7           HB       VAL   7  -3.665  -0.693 -19.900
    4   HG11  VAL   7          HG11      VAL   7  -4.009   2.193 -19.063
    5   HG13  VAL   7          HG12      VAL   7  -3.908   0.761 -18.038
    6   HG12  VAL   7          HG13      VAL   7  -5.350   1.047 -19.012
    7   HG21  VAL   7          HG21      VAL   7  -3.843   0.399 -22.279
    8   HG23  VAL   7          HG22      VAL   7  -4.770   1.650 -21.448
    9   HG22  VAL   7          HG23      VAL   7  -5.327  -0.024 -21.426

  No H/Q in entry =           9
  In of MODEL   69
    1    H    VAL   8           H        VAL   8  -1.210  -1.184 -19.126
    2    HA   VAL   8           HA       VAL   8  -0.852  -0.123 -16.527
    3    HB   VAL   8           HB       VAL   8   0.513  -2.442 -17.917
    4   HG13  VAL   8          HG11      VAL   8   1.956  -1.776 -16.128
    5   HG12  VAL   8          HG12      VAL   8   1.012  -3.132 -15.511
    6   HG11  VAL   8          HG13      VAL   8   0.594  -1.484 -15.046
    7   HG21  VAL   8          HG21      VAL   8  -2.130  -2.206 -17.165
    8   HG23  VAL   8          HG22      VAL   8  -1.415  -2.863 -15.696
    9   HG22  VAL   8          HG23      VAL   8  -1.263  -3.741 -17.214

  No H/Q in entry =           9
  In of MODEL   69
    1    H    MET   9           H        MET   9   1.361  -0.423 -19.304
    2    HA   MET   9           HA       MET   9   3.670   0.595 -18.064
    3    HB2  MET   9           HB2      MET   9   2.689   0.663 -20.917
    4    HB3  MET   9           HB3      MET   9   4.225   1.390 -20.446
    5    HG2  MET   9           HG2      MET   9   4.987  -0.763 -19.538
    6    HG3  MET   9           HG3      MET   9   3.439  -1.499 -19.958
    7    HE3  MET   9           HE1      MET   9   6.746   0.007 -22.724
    8    HE2  MET   9           HE2      MET   9   7.064  -0.881 -21.236
    9    HE1  MET   9           HE3      MET   9   6.239   0.673 -21.168

  No H/Q in entry =           9
  In of MODEL   69
    1    H    GLY  10           H        GLY  10   0.979   2.229 -19.698
    2    HA3  GLY  10           HA2      GLY  10   1.966   4.873 -19.449
    3    HA2  GLY  10           HA3      GLY  10   0.271   4.427 -19.636

  No H/Q in entry =           3
  In of MODEL   69
    1    H    LEU  11           H        LEU  11  -0.113   2.889 -17.355
    2    HA   LEU  11           HA       LEU  11  -0.603   4.857 -15.376
    3    HB2  LEU  11           HB2      LEU  11  -0.558   1.840 -15.240
    4    HB3  LEU  11           HB3      LEU  11  -1.042   2.859 -13.885
    5    HG   LEU  11           HG       LEU  11  -2.314   3.001 -16.632
    6   HD13  LEU  11          HD11      LEU  11  -2.907   0.858 -15.883
    7   HD12  LEU  11          HD12      LEU  11  -4.242   1.857 -15.314
    8   HD11  LEU  11          HD13      LEU  11  -2.976   1.359 -14.193
    9   HD22  LEU  11          HD21      LEU  11  -2.875   5.015 -15.605
   10   HD21  LEU  11          HD22      LEU  11  -2.786   4.337 -13.979
   11   HD23  LEU  11          HD23      LEU  11  -4.177   3.990 -15.006

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  12           H        ILE  12   1.916   2.371 -15.666
    2    HA   ILE  12           HA       ILE  12   3.157   2.882 -13.174
    3    HB   ILE  12           HB       ILE  12   4.372   1.849 -15.759
    4   HG12  ILE  12          HG12      ILE  12   2.360   0.631 -14.589
    5   HG13  ILE  12          HG13      ILE  12   3.737  -0.313 -15.118
    6   HG23  ILE  12          HG21      ILE  12   6.158   2.542 -14.294
    7   HG22  ILE  12          HG22      ILE  12   6.045   0.787 -14.176
    8   HG21  ILE  12          HG23      ILE  12   5.377   1.801 -12.899
    9   HD13  ILE  12          HD11      ILE  12   4.607  -0.362 -12.856
   10   HD12  ILE  12          HD12      ILE  12   2.921  -0.873 -12.818
   11   HD11  ILE  12          HD13      ILE  12   3.359   0.745 -12.315

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  13           H        ILE  13   3.728   4.162 -16.431
    2    HA   ILE  13           HA       ILE  13   5.890   5.859 -15.722
    3    HB   ILE  13           HB       ILE  13   3.830   5.977 -17.940
    4   HG12  ILE  13          HG12      ILE  13   5.585   4.090 -17.745
    5   HG13  ILE  13          HG13      ILE  13   5.439   4.919 -19.290
    6   HG22  ILE  13          HG21      ILE  13   5.695   7.507 -18.995
    7   HG21  ILE  13          HG22      ILE  13   6.127   7.827 -17.319
    8   HG23  ILE  13          HG23      ILE  13   4.508   8.216 -17.898
    9   HD11  ILE  13          HD11      ILE  13   7.378   6.150 -17.411
   10   HD13  ILE  13          HD12      ILE  13   7.518   5.832 -19.137
   11   HD12  ILE  13          HD13      ILE  13   7.805   4.536 -17.981

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ASN  14           H        ASN  14   2.384   6.385 -15.942
    2    HA   ASN  14           HA       ASN  14   2.374   9.127 -15.287
    3    HB2  ASN  14           HB2      ASN  14   0.456   7.507 -16.104
    4    HB3  ASN  14           HB3      ASN  14   0.155   7.320 -14.380
    5   HD21  ASN  14          HD21      ASN  14  -1.873   8.503 -15.780
    6   HD22  ASN  14          HD22      ASN  14  -1.917  10.175 -15.501

  No H/Q in entry =           6
  In of MODEL   69
    1    H    SER  15           H        SER  15   2.080   6.240 -13.225
    2    HA   SER  15           HA       SER  15   1.817   7.597 -10.764
    3    HB2  SER  15           HB2      SER  15   2.355   5.500  -9.735
    4    HB3  SER  15           HB3      SER  15   1.513   5.096 -11.227
    5    HG   SER  15           HG       SER  15   3.237   4.008 -11.691

  No H/Q in entry =           5
  In of MODEL   69
    1    H    GLY  16           H        GLY  16   4.660   6.487 -12.567
    2    HA3  GLY  16           HA2      GLY  16   6.616   7.216 -10.657
    3    HA2  GLY  16           HA3      GLY  16   6.895   7.022 -12.385

  No H/Q in entry =           3
  In of MODEL   69
    1    H    GLN  17           H        GLN  17   5.209   9.000 -13.414
    2    HA   GLN  17           HA       GLN  17   6.808  11.327 -13.111
    3    HB2  GLN  17           HB2      GLN  17   4.042  10.922 -14.282
    4    HB3  GLN  17           HB3      GLN  17   4.905  12.460 -14.348
    5    HG2  GLN  17           HG2      GLN  17   6.745  11.419 -15.570
    6    HG3  GLN  17           HG3      GLN  17   5.972   9.840 -15.435
    7   HE21  GLN  17          HE21      GLN  17   6.328  12.463 -17.521
    8   HE22  GLN  17          HE22      GLN  17   4.960  12.200 -18.492

  No H/Q in entry =           8
  In of MODEL   69
    1    H    ALA  18           H        ALA  18   3.718  10.324 -11.729
    2    HA   ALA  18           HA       ALA  18   3.027  12.710 -10.439
    3    HB1  ALA  18           HB1      ALA  18   1.876  10.263 -10.662
    4    HB2  ALA  18           HB2      ALA  18   1.352  11.480  -9.500
    5    HB3  ALA  18           HB3      ALA  18   2.439  10.186  -8.993

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ARG  19           H        ARG  19   4.896   9.925  -9.201
    2    HA   ARG  19           HA       ARG  19   5.469  11.063  -6.679
    3    HB2  ARG  19           HB2      ARG  19   5.859   8.661  -7.227
    4    HB3  ARG  19           HB3      ARG  19   7.206   9.143  -8.262
    5    HG2  ARG  19           HG2      ARG  19   8.357  10.163  -6.347
    6    HG3  ARG  19           HG3      ARG  19   6.992   9.778  -5.301
    7    HD2  ARG  19           HD2      ARG  19   8.747   8.128  -4.976
    8    HD3  ARG  19           HD3      ARG  19   7.357   7.361  -5.749
    9    HE   ARG  19           HE       ARG  19   9.041   8.181  -7.812
   10   HH21  ARG  19          HH11      ARG  19  10.581   6.770  -8.692
   11   HH22  ARG  19          HH12      ARG  19  11.128   5.412  -7.772
   12   HH11  ARG  19          HH21      ARG  19   9.134   6.132  -5.048
   13   HH12  ARG  19          HH22      ARG  19  10.306   5.051  -5.708

  No H/Q in entry =          13
  In of MODEL   69
    1    H    SER  20           H        SER  20   7.248  11.100  -9.751
    2    HA   SER  20           HA       SER  20   9.513  12.495  -8.947
    3    HB2  SER  20           HB2      SER  20   9.258  11.521 -11.197
    4    HB3  SER  20           HB3      SER  20   8.047  12.740 -11.583
    5    HG   SER  20           HG       SER  20  10.771  13.170 -10.899

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LEU  21           H        LEU  21   6.407  13.792 -10.096
    2    HA   LEU  21           HA       LEU  21   7.098  16.531  -9.863
    3    HB2  LEU  21           HB2      LEU  21   4.422  15.124  -9.758
    4    HB3  LEU  21           HB3      LEU  21   4.600  16.877  -9.753
    5    HG   LEU  21           HG       LEU  21   5.761  15.090 -11.911
    6   HD11  LEU  21          HD11      LEU  21   3.124  16.582 -11.791
    7   HD13  LEU  21          HD12      LEU  21   3.362  14.846 -12.001
    8   HD12  LEU  21          HD13      LEU  21   3.828  15.962 -13.285
    9   HD21  LEU  21          HD21      LEU  21   5.565  18.057 -11.451
   10   HD23  LEU  21          HD22      LEU  21   5.505  17.468 -13.109
   11   HD22  LEU  21          HD23      LEU  21   6.909  17.131 -12.110

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ALA  22           H        ALA  22   5.601  14.237  -7.610
    2    HA   ALA  22           HA       ALA  22   5.035  16.035  -5.524
    3    HB3  ALA  22           HB1      ALA  22   4.258  13.649  -5.693
    4    HB2  ALA  22           HB2      ALA  22   4.869  14.107  -4.103
    5    HB1  ALA  22           HB3      ALA  22   5.873  13.149  -5.193

  No H/Q in entry =           5
  In of MODEL   69
    1    H    TYR  23           H        TYR  23   7.951  13.996  -6.013
    2    HA   TYR  23           HA       TYR  23   9.369  14.992  -3.772
    3    HB2  TYR  23           HB2      TYR  23  10.129  12.988  -4.953
    4    HB3  TYR  23           HB3      TYR  23  10.430  13.934  -6.410
    5    HD1  TYR  23           HD1      TYR  23  11.442  13.552  -2.838
    6    HD2  TYR  23           HD2      TYR  23  12.463  15.111  -6.709
    7    HE1  TYR  23           HE1      TYR  23  13.714  14.112  -2.015
    8    HE2  TYR  23           HE2      TYR  23  14.733  15.672  -5.885
    9    HH   TYR  23           HH       TYR  23  15.951  14.498  -2.916

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ALA  24           H        ALA  24   9.149  16.122  -7.128
    2    HA   ALA  24           HA       ALA  24  11.058  18.196  -6.893
    3    HB2  ALA  24           HB1      ALA  24  10.588  18.274  -9.096
    4    HB3  ALA  24           HB2      ALA  24   9.041  19.029  -8.712
    5    HB1  ALA  24           HB3      ALA  24   9.156  17.276  -8.855

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ALA  25           H        ALA  25   7.587  18.024  -6.229
    2    HA   ALA  25           HA       ALA  25   7.127  20.741  -5.637
    3    HB1  ALA  25           HB1      ALA  25   5.454  18.752  -5.829
    4    HB2  ALA  25           HB2      ALA  25   5.107  20.035  -4.668
    5    HB3  ALA  25           HB3      ALA  25   5.797  18.507  -4.116

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LEU  26           H        LEU  26   8.209  18.044  -3.617
    2    HA   LEU  26           HA       LEU  26   8.352  19.459  -1.173
    3    HB2  LEU  26           HB2      LEU  26   8.436  17.042  -1.184
    4    HB3  LEU  26           HB3      LEU  26   9.894  17.050  -2.173
    5    HG   LEU  26           HG       LEU  26  11.137  18.151  -0.342
    6   HD12  LEU  26          HD11      LEU  26   9.940  18.150   1.933
    7   HD11  LEU  26          HD12      LEU  26   8.440  18.024   1.017
    8   HD13  LEU  26          HD13      LEU  26   9.488  19.427   0.803
    9   HD21  LEU  26          HD21      LEU  26   9.604  15.684   0.535
   10   HD23  LEU  26          HD22      LEU  26  11.131  16.236   1.217
   11   HD22  LEU  26          HD23      LEU  26  11.062  15.687  -0.456

  No H/Q in entry =          11
  In of MODEL   69
    1    H    LYS  27           H        LYS  27  10.734  18.892  -3.732
    2    HA   LYS  27           HA       LYS  27  12.938  20.117  -2.525
    3    HB2  LYS  27           HB2      LYS  27  13.008  18.782  -4.624
    4    HB3  LYS  27           HB3      LYS  27  12.237  20.123  -5.471
    5    HG2  LYS  27           HG2      LYS  27  14.115  21.597  -4.909
    6    HG3  LYS  27           HG3      LYS  27  14.882  20.297  -3.990
    7    HD2  LYS  27           HD2      LYS  27  14.994  18.921  -6.054
    8    HD3  LYS  27           HD3      LYS  27  14.272  20.248  -6.965
    9    HE2  LYS  27           HE2      LYS  27  16.173  21.703  -6.368
   10    HE3  LYS  27           HE3      LYS  27  16.899  20.381  -5.448
   11    HZ3  LYS  27           HZ1      LYS  27  17.861  20.490  -7.646
   12    HZ2  LYS  27           HZ2      LYS  27  16.325  20.382  -8.368
   13    HZ1  LYS  27           HZ3      LYS  27  16.954  19.064  -7.499

  No H/Q in entry =          13
  In of MODEL   69
    1    H    GLN  28           H        GLN  28  10.296  21.520  -4.431
    2    HA   GLN  28           HA       GLN  28  11.262  24.170  -4.581
    3    HB2  GLN  28           HB2      GLN  28   8.429  23.105  -4.442
    4    HB3  GLN  28           HB3      GLN  28   8.839  24.781  -4.805
    5    HG2  GLN  28           HG2      GLN  28   9.811  22.383  -6.386
    6    HG3  GLN  28           HG3      GLN  28   8.474  23.427  -6.864
    7   HE21  GLN  28          HE21      GLN  28  11.601  22.930  -7.639
    8   HE22  GLN  28          HE22      GLN  28  12.087  24.518  -7.997

  No H/Q in entry =           8
  In of MODEL   69
    1    H    ALA  29           H        ALA  29   9.356  22.469  -2.130
    2    HA   ALA  29           HA       ALA  29   8.836  24.653  -0.428
    3    HB2  ALA  29           HB1      ALA  29   8.122  23.077   1.140
    4    HB1  ALA  29           HB2      ALA  29   9.334  21.892   0.652
    5    HB3  ALA  29           HB3      ALA  29   7.935  22.196  -0.376

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LYS  30           H        LYS  30  11.558  22.377  -0.546
    2    HA   LYS  30           HA       LYS  30  12.909  23.313   1.745
    3    HB2  LYS  30           HB2      LYS  30  13.968  22.039  -0.787
    4    HB3  LYS  30           HB3      LYS  30  14.970  22.387   0.624
    5    HG2  LYS  30           HG2      LYS  30  13.431  21.000   2.015
    6    HG3  LYS  30           HG3      LYS  30  12.525  20.590   0.554
    7    HD2  LYS  30           HD2      LYS  30  14.554  19.603  -0.439
    8    HD3  LYS  30           HD3      LYS  30  15.478  20.027   1.004
    9    HE2  LYS  30           HE2      LYS  30  13.987  18.592   2.369
   10    HE3  LYS  30           HE3      LYS  30  13.092  18.148   0.909
   11    HZ2  LYS  30           HZ1      LYS  30  14.889  16.560   1.637
   12    HZ1  LYS  30           HZ2      LYS  30  16.024  17.747   1.179
   13    HZ3  LYS  30           HZ3      LYS  30  14.971  17.073   0.023

  No H/Q in entry =          13
  In of MODEL   69
    1    H    GLN  31           H        GLN  31  12.761  24.538  -1.542
    2    HA   GLN  31           HA       GLN  31  14.925  26.422  -1.137
    3    HB2  GLN  31           HB2      GLN  31  12.853  26.489  -3.335
    4    HB3  GLN  31           HB3      GLN  31  14.475  27.180  -3.353
    5    HG2  GLN  31           HG2      GLN  31  14.936  24.479  -2.800
    6    HG3  GLN  31           HG3      GLN  31  13.617  24.436  -3.962
    7   HE21  GLN  31          HE21      GLN  31  16.453  23.637  -4.407
    8   HE22  GLN  31          HE22      GLN  31  17.011  24.616  -5.675

  No H/Q in entry =           8
  In of MODEL   69
    1    H    GLY  32           H        GLY  32  11.865  26.242   0.047
    2    HA3  GLY  32           HA2      GLY  32  10.730  27.806   1.344
    3    HA2  GLY  32           HA3      GLY  32  11.852  29.042   0.787

  No H/Q in entry =           3
  In of MODEL   69
    1    H    ASP  33           H        ASP  33  10.449  27.157  -1.699
    2    HA   ASP  33           HA       ASP  33   8.781  29.440  -2.519
    3    HB2  ASP  33           HB2      ASP  33   9.848  27.026  -3.990
    4    HB3  ASP  33           HB3      ASP  33   8.691  28.150  -4.698

  No H/Q in entry =           4
  In of MODEL   69
    1    H    PHE  34           H        PHE  34   7.112  28.960  -0.936
    2    HA   PHE  34           HA       PHE  34   5.726  26.491  -0.838
    3    HB2  PHE  34           HB2      PHE  34   4.782  29.277  -0.128
    4    HB3  PHE  34           HB3      PHE  34   3.934  27.786   0.285
    5    HD1  PHE  34           HD1      PHE  34   6.207  30.171   1.484
    6    HD2  PHE  34           HD2      PHE  34   5.514  25.932   1.414
    7    HE1  PHE  34           HE1      PHE  34   7.623  29.903   3.501
    8    HE2  PHE  34           HE2      PHE  34   6.932  25.669   3.429
    9    HZ   PHE  34           HZ       PHE  34   7.981  27.656   4.472

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ALA  35           H        ALA  35   5.278  29.368  -2.825
    2    HA   ALA  35           HA       ALA  35   2.712  28.768  -3.821
    3    HB1  ALA  35           HB1      ALA  35   3.741  30.169  -5.863
    4    HB3  ALA  35           HB2      ALA  35   4.976  30.520  -4.653
    5    HB2  ALA  35           HB3      ALA  35   3.290  30.932  -4.338

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ALA  36           H        ALA  36   5.920  28.093  -5.221
    2    HA   ALA  36           HA       ALA  36   4.898  26.681  -7.460
    3    HB3  ALA  36           HB1      ALA  36   7.049  26.803  -8.103
    4    HB2  ALA  36           HB2      ALA  36   7.545  25.764  -6.765
    5    HB1  ALA  36           HB3      ALA  36   7.448  27.511  -6.538

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ALA  37           H        ALA  37   5.894  25.664  -4.224
    2    HA   ALA  37           HA       ALA  37   5.821  22.879  -4.669
    3    HB2  ALA  37           HB1      ALA  37   5.596  24.656  -2.277
    4    HB1  ALA  37           HB2      ALA  37   6.722  23.337  -2.592
    5    HB3  ALA  37           HB3      ALA  37   5.066  22.985  -2.102

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LYS  38           H        LYS  38   3.310  25.086  -3.455
    2    HA   LYS  38           HA       LYS  38   1.209  23.278  -3.216
    3    HB2  LYS  38           HB2      LYS  38   1.571  26.031  -2.953
    4    HB3  LYS  38           HB3      LYS  38   0.355  25.895  -4.217
    5    HG2  LYS  38           HG2      LYS  38  -1.079  24.567  -2.764
    6    HG3  LYS  38           HG3      LYS  38   0.181  24.496  -1.524
    7    HD2  LYS  38           HD2      LYS  38   0.007  26.830  -1.060
    8    HD3  LYS  38           HD3      LYS  38  -0.923  27.131  -2.529
    9    HE2  LYS  38           HE2      LYS  38  -2.401  27.157  -0.569
   10    HE3  LYS  38           HE3      LYS  38  -2.792  25.788  -1.615
   11    HZ3  LYS  38           HZ1      LYS  38  -2.051  24.306  -0.101
   12    HZ2  LYS  38           HZ2      LYS  38  -2.384  25.558   1.001
   13    HZ1  LYS  38           HZ3      LYS  38  -0.797  25.306   0.453

  No H/Q in entry =          13
  In of MODEL   69
    1    H    ALA  39           H        ALA  39   2.157  25.195  -6.066
    2    HA   ALA  39           HA       ALA  39   0.056  24.344  -7.747
    3    HB2  ALA  39           HB1      ALA  39   2.781  24.991  -8.832
    4    HB1  ALA  39           HB2      ALA  39   1.828  26.250  -8.047
    5    HB3  ALA  39           HB3      ALA  39   1.194  25.423  -9.470

  No H/Q in entry =           5
  In of MODEL   69
    1    H    MET  40           H        MET  40   3.298  23.033  -7.217
    2    HA   MET  40           HA       MET  40   3.169  21.025  -9.220
    3    HB2  MET  40           HB2      MET  40   4.814  21.229  -6.691
    4    HB3  MET  40           HB3      MET  40   5.045  19.979  -7.916
    5    HG2  MET  40           HG2      MET  40   5.102  22.939  -8.564
    6    HG3  MET  40           HG3      MET  40   6.552  22.030  -8.139
    7    HE3  MET  40           HE1      MET  40   7.381  19.830 -10.973
    8    HE2  MET  40           HE2      MET  40   6.838  19.502  -9.330
    9    HE1  MET  40           HE3      MET  40   7.934  20.848  -9.635

  No H/Q in entry =           9
  In of MODEL   69
    1    H    MET  41           H        MET  41   2.299  21.049  -5.784
    2    HA   MET  41           HA       MET  41   1.763  18.284  -5.516
    3    HB2  MET  41           HB2      MET  41   0.454  20.636  -4.133
    4    HB3  MET  41           HB3      MET  41   0.300  18.956  -3.634
    5    HG2  MET  41           HG2      MET  41   3.011  19.172  -3.705
    6    HG3  MET  41           HG3      MET  41   2.579  20.829  -3.293
    7    HE2  MET  41           HE1      MET  41  -0.441  19.573  -1.536
    8    HE1  MET  41           HE2      MET  41   0.375  21.087  -1.915
    9    HE3  MET  41           HE3      MET  41   0.336  20.506  -0.250

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ASP  42           H        ASP  42  -0.281  21.019  -6.447
    2    HA   ASP  42           HA       ASP  42  -2.727  19.665  -6.560
    3    HB2  ASP  42           HB2      ASP  42  -2.018  22.235  -6.810
    4    HB3  ASP  42           HB3      ASP  42  -2.192  21.851  -8.519

  No H/Q in entry =           4
  In of MODEL   69
    1    H    GLN  43           H        GLN  43  -0.318  20.266  -9.090
    2    HA   GLN  43           HA       GLN  43  -1.735  18.962 -11.169
    3    HB2  GLN  43           HB2      GLN  43   1.229  19.469 -10.822
    4    HB3  GLN  43           HB3      GLN  43   0.495  18.840 -12.299
    5    HG2  GLN  43           HG2      GLN  43  -1.012  20.871 -12.309
    6    HG3  GLN  43           HG3      GLN  43  -0.041  21.517 -10.989
    7   HE21  GLN  43          HE21      GLN  43   0.097  23.149 -13.068
    8   HE22  GLN  43          HE22      GLN  43   1.500  22.931 -13.995

  No H/Q in entry =           8
  In of MODEL   69
    1    H    SER  44           H        SER  44   0.644  17.802  -8.816
    2    HA   SER  44           HA       SER  44   0.960  15.201  -9.861
    3    HB2  SER  44           HB2      SER  44   1.887  16.625  -7.628
    4    HB3  SER  44           HB3      SER  44   1.030  15.239  -6.955
    5    HG   SER  44           HG       SER  44   3.134  14.617  -7.412

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ARG  45           H        ARG  45  -1.327  16.510  -7.485
    2    HA   ARG  45           HA       ARG  45  -2.709  14.148  -6.847
    3    HB2  ARG  45           HB2      ARG  45  -2.888  16.309  -5.639
    4    HB3  ARG  45           HB3      ARG  45  -3.761  16.986  -7.011
    5    HG2  ARG  45           HG2      ARG  45  -5.526  15.262  -6.716
    6    HG3  ARG  45           HG3      ARG  45  -4.665  14.640  -5.307
    7    HD2  ARG  45           HD2      ARG  45  -4.853  16.900  -4.235
    8    HD3  ARG  45           HD3      ARG  45  -5.857  17.430  -5.601
    9    HE   ARG  45           HE       ARG  45  -6.958  15.050  -4.561
   10   HH21  ARG  45          HH11      ARG  45  -8.777  15.121  -3.266
   11   HH22  ARG  45          HH12      ARG  45  -9.158  16.556  -2.384
   12   HH11  ARG  45          HH21      ARG  45  -6.393  18.289  -3.525
   13   HH12  ARG  45          HH22      ARG  45  -7.803  18.350  -2.528

  No H/Q in entry =          13
  In of MODEL   69
    1    H    MET  46           H        MET  46  -3.322  16.569  -9.375
    2    HA   MET  46           HA       MET  46  -5.677  15.407 -10.414
    3    HB2  MET  46           HB2      MET  46  -3.589  17.240 -11.600
    4    HB3  MET  46           HB3      MET  46  -4.979  16.688 -12.539
    5    HG2  MET  46           HG2      MET  46  -6.511  17.615 -10.879
    6    HG3  MET  46           HG3      MET  46  -5.160  18.091  -9.856
    7    HE3  MET  46           HE1      MET  46  -5.517  18.775 -14.055
    8    HE2  MET  46           HE2      MET  46  -6.864  19.821 -13.618
    9    HE1  MET  46           HE3      MET  46  -6.846  18.144 -13.073

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ALA  47           H        ALA  47  -2.259  14.927 -11.219
    2    HA   ALA  47           HA       ALA  47  -2.635  13.214 -13.435
    3    HB3  ALA  47           HB1      ALA  47  -0.452  14.098 -13.106
    4    HB2  ALA  47           HB2      ALA  47  -0.309  12.367 -12.784
    5    HB1  ALA  47           HB3      ALA  47  -0.383  13.511 -11.443

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LEU  48           H        LEU  48  -2.322  12.556  -9.969
    2    HA   LEU  48           HA       LEU  48  -2.422   9.718 -10.143
    3    HB2  LEU  48           HB2      LEU  48  -3.155  11.623  -7.908
    4    HB3  LEU  48           HB3      LEU  48  -3.061   9.871  -7.719
    5    HG   LEU  48           HG       LEU  48  -0.773  11.574  -8.736
    6   HD13  LEU  48          HD11      LEU  48  -1.026  12.331  -6.537
    7   HD12  LEU  48          HD12      LEU  48   0.138  11.021  -6.361
    8   HD11  LEU  48          HD13      LEU  48  -1.556  10.758  -5.943
    9   HD22  LEU  48          HD21      LEU  48  -0.285   9.391  -9.396
   10   HD21  LEU  48          HD22      LEU  48  -1.139   8.669  -8.033
   11   HD23  LEU  48          HD23      LEU  48   0.438   9.418  -7.789

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ASN  49           H        ASN  49  -4.877  12.211  -9.695
    2    HA   ASN  49           HA       ASN  49  -7.058  10.546  -9.137
    3    HB2  ASN  49           HB2      ASN  49  -7.079  12.981  -8.811
    4    HB3  ASN  49           HB3      ASN  49  -6.994  13.228 -10.551
    5   HD21  ASN  49          HD21      ASN  49  -9.061  14.314 -10.618
    6   HD22  ASN  49          HD22      ASN  49 -10.516  13.476 -10.381

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLU  50           H        GLU  50  -5.816  11.759 -12.234
    2    HA   GLU  50           HA       GLU  50  -7.793  10.517 -13.862
    3    HB2  GLU  50           HB2      GLU  50  -6.335  12.339 -14.684
    4    HB3  GLU  50           HB3      GLU  50  -4.941  11.264 -14.570
    5    HG2  GLU  50           HG2      GLU  50  -5.938   9.739 -16.203
    6    HG3  GLU  50           HG3      GLU  50  -7.398  10.720 -16.266

  No H/Q in entry =           6
  In of MODEL   69
    1    H    ALA  51           H        ALA  51  -4.609   9.513 -12.703
    2    HA   ALA  51           HA       ALA  51  -4.491   7.068 -14.137
    3    HB2  ALA  51           HB1      ALA  51  -2.497   6.771 -13.064
    4    HB1  ALA  51           HB2      ALA  51  -3.164   7.185 -11.486
    5    HB3  ALA  51           HB3      ALA  51  -2.721   8.462 -12.618

  No H/Q in entry =           5
  In of MODEL   69
    1    H    HIS  52           H        HIS  52  -5.621   7.882 -10.869
    2    HA   HIS  52           HA       HIS  52  -6.300   5.268 -10.044
    3    HB2  HIS  52           HB2      HIS  52  -6.144   7.348  -8.602
    4    HB3  HIS  52           HB3      HIS  52  -7.729   7.800  -9.228
    5    HD1  HIS  52           HD1      HIS  52  -9.441   5.469  -9.103
    6    HD2  HIS  52           HD2      HIS  52  -6.479   6.012  -6.221
    7    HE1  HIS  52           HE1      HIS  52 -10.120   4.068  -7.104
    8    HE2  HIS  52           HE2      HIS  52  -8.323   4.389  -5.339

  No H/Q in entry =           8
  In of MODEL   69
    1    H    LEU  53           H        LEU  53  -8.138   7.740 -11.794
    2    HA   LEU  53           HA       LEU  53 -10.646   6.452 -11.783
    3    HB2  LEU  53           HB2      LEU  53  -9.382   8.442 -13.657
    4    HB3  LEU  53           HB3      LEU  53 -10.987   7.781 -13.962
    5    HG   LEU  53           HG       LEU  53 -10.219   9.103 -11.338
    6   HD13  LEU  53          HD11      LEU  53 -10.011  10.770 -13.093
    7   HD12  LEU  53          HD12      LEU  53 -11.516  11.060 -12.218
    8   HD11  LEU  53          HD13      LEU  53 -11.547  10.277 -13.795
    9   HD22  LEU  53          HD21      LEU  53 -12.190   7.891 -10.925
   10   HD21  LEU  53          HD22      LEU  53 -12.771   8.096 -12.573
   11   HD23  LEU  53          HD23      LEU  53 -12.851   9.436 -11.445

  No H/Q in entry =          11
  In of MODEL   69
    1    H    VAL  54           H        VAL  54  -7.924   6.263 -14.056
    2    HA   VAL  54           HA       VAL  54  -9.173   4.506 -15.894
    3    HB   VAL  54           HB       VAL  54  -6.256   5.003 -15.245
    4   HG12  VAL  54          HG11      VAL  54  -6.041   3.932 -17.644
    5   HG11  VAL  54          HG12      VAL  54  -7.566   3.151 -17.226
    6   HG13  VAL  54          HG13      VAL  54  -6.138   2.888 -16.226
    7   HG22  VAL  54          HG21      VAL  54  -7.035   6.954 -16.269
    8   HG21  VAL  54          HG22      VAL  54  -8.242   6.099 -17.227
    9   HG23  VAL  54          HG23      VAL  54  -6.541   6.018 -17.679

  No H/Q in entry =           9
  In of MODEL   69
    1    H    GLN  55           H        GLN  55  -7.140   3.938 -13.023
    2    HA   GLN  55           HA       GLN  55  -7.059   1.123 -13.298
    3    HB2  GLN  55           HB2      GLN  55  -5.483   2.006 -11.793
    4    HB3  GLN  55           HB3      GLN  55  -6.687   2.970 -10.942
    5    HG2  GLN  55           HG2      GLN  55  -7.362   1.206  -9.626
    6    HG3  GLN  55           HG3      GLN  55  -7.156   0.027 -10.915
    7   HE21  GLN  55          HE21      GLN  55  -5.530  -1.429 -10.449
    8   HE22  GLN  55          HE22      GLN  55  -4.133  -1.087  -9.553

  No H/Q in entry =           8
  In of MODEL   69
    1    H    THR  56           H        THR  56  -9.365   3.281 -11.641
    2    HA   THR  56           HA       THR  56 -10.937   1.393 -10.344
    3    HB   THR  56           HB       THR  56 -12.038   3.797 -11.821
    4    HG1  THR  56           HG1      THR  56 -10.733   3.577  -9.318
    5   HG23  THR  56          HG21      THR  56 -13.824   2.527 -10.938
    6   HG22  THR  56          HG22      THR  56 -13.528   3.761  -9.714
    7   HG21  THR  56          HG23      THR  56 -12.925   2.121  -9.477

  No H/Q in entry =           7
  In of MODEL   69
    1    H    LYS  57           H        LYS  57 -11.179   2.497 -13.720
    2    HA   LYS  57           HA       LYS  57 -13.348   0.819 -14.457
    3    HB2  LYS  57           HB2      LYS  57 -12.483   2.776 -15.773
    4    HB3  LYS  57           HB3      LYS  57 -11.051   1.835 -16.165
    5    HG2  LYS  57           HG2      LYS  57 -12.436   0.163 -17.311
    6    HG3  LYS  57           HG3      LYS  57 -13.891   1.061 -16.892
    7    HD2  LYS  57           HD2      LYS  57 -13.070   2.996 -18.202
    8    HD3  LYS  57           HD3      LYS  57 -11.627   2.085 -18.639
    9    HE2  LYS  57           HE2      LYS  57 -13.263   1.947 -20.461
   10    HE3  LYS  57           HE3      LYS  57 -13.085   0.355 -19.725
   11    HZ3  LYS  57           HZ1      LYS  57 -15.072   0.691 -18.475
   12    HZ2  LYS  57           HZ2      LYS  57 -15.411   1.018 -20.108
   13    HZ1  LYS  57           HZ3      LYS  57 -15.209   2.296 -19.006

  No H/Q in entry =          13
  In of MODEL   69
    1    H    LEU  58           H        LEU  58  -9.844   0.380 -14.446
    2    HA   LEU  58           HA       LEU  58  -9.874  -2.130 -15.749
    3    HB2  LEU  58           HB2      LEU  58  -7.815  -0.853 -13.958
    4    HB3  LEU  58           HB3      LEU  58  -7.568  -2.370 -14.824
    5    HG   LEU  58           HG       LEU  58  -8.332   0.244 -16.163
    6   HD11  LEU  58          HD11      LEU  58  -5.681  -1.003 -15.512
    7   HD13  LEU  58          HD12      LEU  58  -6.171   0.689 -15.447
    8   HD12  LEU  58          HD13      LEU  58  -5.852  -0.074 -17.002
    9   HD22  LEU  58          HD21      LEU  58  -8.931  -1.308 -17.756
   10   HD21  LEU  58          HD22      LEU  58  -7.885  -2.562 -17.094
   11   HD23  LEU  58          HD23      LEU  58  -7.203  -1.284 -18.101

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  59           H        ILE  59 -10.654  -1.244 -12.483
    2    HA   ILE  59           HA       ILE  59 -10.297  -4.017 -11.555
    3    HB   ILE  59           HB       ILE  59  -9.832  -1.760 -10.149
    4   HG12  ILE  59          HG12      ILE  59 -11.192  -4.106  -8.812
    5   HG13  ILE  59          HG13      ILE  59  -9.564  -4.203  -9.433
    6   HG23  ILE  59          HG21      ILE  59 -11.648  -1.089  -8.795
    7   HG22  ILE  59          HG22      ILE  59 -12.599  -2.498  -9.199
    8   HG21  ILE  59          HG23      ILE  59 -12.361  -1.217 -10.385
    9   HD12  ILE  59          HD11      ILE  59 -10.588  -2.355  -7.298
   10   HD11  ILE  59          HD12      ILE  59  -9.012  -2.149  -8.051
   11   HD13  ILE  59          HD13      ILE  59  -9.362  -3.606  -7.121

  No H/Q in entry =          11
  In of MODEL   69
    1    H    GLU  60           H        GLU  60 -12.860  -1.692 -12.320
    2    HA   GLU  60           HA       GLU  60 -15.036  -3.210 -11.289
    3    HB2  GLU  60           HB2      GLU  60 -16.379  -1.601 -12.251
    4    HB3  GLU  60           HB3      GLU  60 -14.853  -0.724 -12.234
    5    HG2  GLU  60           HG2      GLU  60 -15.614  -0.431 -14.444
    6    HG3  GLU  60           HG3      GLU  60 -14.484  -1.761 -14.587

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLY  61           H        GLY  61 -13.400  -3.180 -14.424
    2    HA3  GLY  61           HA2      GLY  61 -15.128  -5.416 -15.306
    3    HA2  GLY  61           HA3      GLY  61 -14.294  -4.307 -16.387

  No H/Q in entry =           3
  In of MODEL   69
    1    H    ASP  62           H        ASP  62 -12.887  -5.773 -13.528
    2    HA   ASP  62           HA       ASP  62 -10.660  -6.762 -15.045
    3    HB2  ASP  62           HB2      ASP  62  -9.900  -7.580 -12.814
    4    HB3  ASP  62           HB3      ASP  62 -10.314  -5.869 -12.819

  No H/Q in entry =           4
  In of MODEL   69
    1    H    ALA  63           H        ALA  63 -13.152  -8.009 -15.884
    2    HA   ALA  63           HA       ALA  63 -13.495 -10.623 -14.806
    3    HB1  ALA  63           HB1      ALA  63 -14.693 -11.082 -16.902
    4    HB2  ALA  63           HB2      ALA  63 -13.982  -9.650 -17.645
    5    HB3  ALA  63           HB3      ALA  63 -15.128  -9.478 -16.313

  No H/Q in entry =           5
  In of MODEL   69
    1    H    GLY  64           H        GLY  64 -11.442  -9.297 -17.328
    2    HA3  GLY  64           HA2      GLY  64  -9.649 -10.132 -18.485
    3    HA2  GLY  64           HA3      GLY  64  -9.388 -11.182 -17.098

  No H/Q in entry =           3
  In of MODEL   69
    1    H    GLU  65           H        GLU  65  -8.999 -13.149 -17.991
    2    HA   GLU  65           HA       GLU  65 -10.155 -14.075 -20.383
    3    HB2  GLU  65           HB2      GLU  65  -8.827 -15.568 -18.124
    4    HB3  GLU  65           HB3      GLU  65  -9.311 -16.320 -19.645
    5    HG2  GLU  65           HG2      GLU  65  -7.892 -14.772 -20.899
    6    HG3  GLU  65           HG3      GLU  65  -7.449 -13.940 -19.408

  No H/Q in entry =           6
  In of MODEL   69
    1    H    GLY  66           H        GLY  66 -11.012 -16.536 -20.092
    2    HA3  GLY  66           HA2      GLY  66 -13.758 -16.324 -19.528
    3    HA2  GLY  66           HA3      GLY  66 -12.886 -17.805 -19.874

  No H/Q in entry =           3
  In of MODEL   69
    1    H    LYS  67           H        LYS  67 -11.113 -17.674 -17.654
    2    HA   LYS  67           HA       LYS  67 -12.773 -18.890 -15.677
    3    HB2  LYS  67           HB2      LYS  67  -9.815 -18.342 -15.821
    4    HB3  LYS  67           HB3      LYS  67 -10.581 -19.207 -14.482
    5    HG2  LYS  67           HG2      LYS  67 -11.492 -20.869 -16.019
    6    HG3  LYS  67           HG3      LYS  67 -10.861 -19.978 -17.402
    7    HD2  LYS  67           HD2      LYS  67  -9.281 -21.707 -17.049
    8    HD3  LYS  67           HD3      LYS  67  -8.544 -20.285 -16.305
    9    HE2  LYS  67           HE2      LYS  67  -9.232 -20.981 -14.103
   10    HE3  LYS  67           HE3      LYS  67 -10.231 -22.276 -14.766
   11    HZ3  LYS  67           HZ1      LYS  67  -8.386 -23.465 -14.286
   12    HZ2  LYS  67           HZ2      LYS  67  -7.337 -22.138 -14.440
   13    HZ1  LYS  67           HZ3      LYS  67  -7.914 -22.932 -15.825

  No H/Q in entry =          13
  In of MODEL   69
    1    H    MET  68           H        MET  68 -12.957 -18.441 -13.516
    2    HA   MET  68           HA       MET  68 -13.850 -15.972 -12.761
    3    HB2  MET  68           HB2      MET  68 -12.640 -18.138 -11.041
    4    HB3  MET  68           HB3      MET  68 -13.569 -16.773 -10.421
    5    HG2  MET  68           HG2      MET  68 -14.597 -18.773 -12.456
    6    HG3  MET  68           HG3      MET  68 -14.969 -18.811 -10.731
    7    HE2  MET  68           HE1      MET  68 -15.485 -15.682  -9.891
    8    HE1  MET  68           HE2      MET  68 -16.061 -17.289  -9.452
    9    HE3  MET  68           HE3      MET  68 -17.215 -16.052  -9.945

  No H/Q in entry =           9
  In of MODEL   69
    1    H    LYS  69           H        LYS  69 -10.594 -16.571 -13.386
    2    HA   LYS  69           HA       LYS  69  -9.388 -15.068 -11.304
    3    HB2  LYS  69           HB2      LYS  69  -8.279 -15.703 -14.045
    4    HB3  LYS  69           HB3      LYS  69  -7.348 -15.231 -12.621
    5    HG2  LYS  69           HG2      LYS  69  -9.147 -17.668 -12.730
    6    HG3  LYS  69           HG3      LYS  69  -7.409 -17.719 -13.015
    7    HD2  LYS  69           HD2      LYS  69  -7.189 -16.555 -10.719
    8    HD3  LYS  69           HD3      LYS  69  -8.866 -17.041 -10.464
    9    HE2  LYS  69           HE2      LYS  69  -8.295 -19.380 -10.796
   10    HE3  LYS  69           HE3      LYS  69  -6.641 -18.952 -11.229
   11    HZ2  LYS  69           HZ1      LYS  69  -7.961 -18.712  -8.593
   12    HZ1  LYS  69           HZ2      LYS  69  -6.521 -17.889  -8.958
   13    HZ3  LYS  69           HZ3      LYS  69  -6.565 -19.589  -8.992

  No H/Q in entry =          13
  In of MODEL   69
    1    H    VAL  70           H        VAL  70  -7.716 -13.233 -12.018
    2    HA   VAL  70           HA       VAL  70  -9.173 -11.147 -13.534
    3    HB   VAL  70           HB       VAL  70  -8.417  -9.513 -11.839
    4   HG12  VAL  70          HG11      VAL  70  -9.888 -10.464  -9.934
    5   HG11  VAL  70          HG12      VAL  70 -10.105 -11.865 -10.984
    6   HG13  VAL  70          HG13      VAL  70 -10.641 -10.272 -11.517
    7   HG21  VAL  70          HG21      VAL  70  -7.464 -11.990 -10.349
    8   HG23  VAL  70          HG22      VAL  70  -7.522 -10.363  -9.676
    9   HG22  VAL  70          HG23      VAL  70  -6.430 -10.726 -11.010

  No H/Q in entry =           9
  In of MODEL   69
    1    H    SER  71           H        SER  71  -7.734  -9.364 -14.207
    2    HA   SER  71           HA       SER  71  -5.447 -10.275 -15.597
    3    HB2  SER  71           HB2      SER  71  -6.820  -8.247 -16.190
    4    HB3  SER  71           HB3      SER  71  -6.090  -7.423 -14.815
    5    HG   SER  71           HG       SER  71  -4.549  -8.702 -16.812

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LEU  72           H        LEU  72  -3.464 -10.631 -14.919
    2    HA   LEU  72           HA       LEU  72  -2.711 -10.432 -12.215
    3    HB2  LEU  72           HB2      LEU  72  -1.087 -10.851 -14.720
    4    HB3  LEU  72           HB3      LEU  72  -0.407 -10.937 -13.097
    5    HG   LEU  72           HG       LEU  72  -2.771 -12.617 -13.992
    6   HD11  LEU  72          HD11      LEU  72  -0.752 -13.147 -15.330
    7   HD13  LEU  72          HD12      LEU  72  -1.163 -14.461 -14.230
    8   HD12  LEU  72          HD13      LEU  72   0.164 -13.367 -13.838
    9   HD23  LEU  72          HD21      LEU  72  -1.774 -14.038 -12.030
   10   HD22  LEU  72          HD22      LEU  72  -2.752 -12.637 -11.623
   11   HD21  LEU  72          HD23      LEU  72  -0.995 -12.532 -11.553

  No H/Q in entry =          11
  In of MODEL   69
    1    H    VAL  73           H        VAL  73  -2.022  -8.404 -14.993
    2    HA   VAL  73           HA       VAL  73  -0.083  -6.716 -13.904
    3    HB   VAL  73           HB       VAL  73  -0.479  -5.299 -15.752
    4   HG12  VAL  73          HG11      VAL  73  -1.362  -8.067 -16.616
    5   HG11  VAL  73          HG12      VAL  73   0.309  -7.628 -16.266
    6   HG13  VAL  73          HG13      VAL  73  -0.542  -6.861 -17.605
    7   HG21  VAL  73          HG21      VAL  73  -3.263  -6.403 -15.555
    8   HG23  VAL  73          HG22      VAL  73  -2.681  -5.821 -17.113
    9   HG22  VAL  73          HG23      VAL  73  -2.738  -4.729 -15.729

  No H/Q in entry =           9
  In of MODEL   69
    1    H    LEU  74           H        LEU  74  -3.474  -6.825 -13.306
    2    HA   LEU  74           HA       LEU  74  -4.076  -4.170 -12.673
    3    HB2  LEU  74           HB2      LEU  74  -5.814  -5.825 -12.834
    4    HB3  LEU  74           HB3      LEU  74  -5.109  -6.764 -11.521
    5    HG   LEU  74           HG       LEU  74  -5.546  -4.906  -9.952
    6   HD12  LEU  74          HD11      LEU  74  -7.125  -3.093 -10.870
    7   HD11  LEU  74          HD12      LEU  74  -6.590  -3.602 -12.471
    8   HD13  LEU  74          HD13      LEU  74  -5.423  -2.958 -11.314
    9   HD22  LEU  74          HD21      LEU  74  -7.756  -5.462  -9.683
   10   HD21  LEU  74          HD22      LEU  74  -7.255  -6.705 -10.810
   11   HD23  LEU  74          HD23      LEU  74  -8.115  -5.304 -11.401

  No H/Q in entry =          11
  In of MODEL   69
    1    H    VAL  75           H        VAL  75  -3.018  -6.772 -10.537
    2    HA   VAL  75           HA       VAL  75  -2.786  -5.233  -8.188
    3    HB   VAL  75           HB       VAL  75  -1.308  -7.729  -9.009
    4   HG13  VAL  75          HG11      VAL  75  -0.023  -6.516  -7.285
    5   HG12  VAL  75          HG12      VAL  75  -0.831  -7.893  -6.549
    6   HG11  VAL  75          HG13      VAL  75  -1.487  -6.279  -6.337
    7   HG21  VAL  75          HG21      VAL  75  -3.843  -7.757  -8.747
    8   HG23  VAL  75          HG22      VAL  75  -3.596  -7.311  -7.059
    9   HG22  VAL  75          HG23      VAL  75  -2.974  -8.847  -7.665

  No H/Q in entry =           9
  In of MODEL   69
    1    H    GLU  76           H        GLU  76  -0.410  -5.988 -10.756
    2    HA   GLU  76           HA       GLU  76   1.793  -4.653  -9.618
    3    HB2  GLU  76           HB2      GLU  76   1.966  -6.120 -11.612
    4    HB3  GLU  76           HB3      GLU  76   1.050  -4.951 -12.551
    5    HG2  GLU  76           HG2      GLU  76   3.386  -4.627 -13.068
    6    HG3  GLU  76           HG3      GLU  76   2.882  -3.256 -12.099

  No H/Q in entry =           6
  In of MODEL   69
    1    H    ALA  77           H        ALA  77  -0.761  -3.433 -11.770
    2    HA   ALA  77           HA       ALA  77   0.235  -0.789 -11.944
    3    HB3  ALA  77           HB1      ALA  77  -2.598  -1.836 -12.197
    4    HB1  ALA  77           HB2      ALA  77  -1.440  -1.614 -13.509
    5    HB2  ALA  77           HB3      ALA  77  -2.081  -0.211 -12.653

  No H/Q in entry =           5
  In of MODEL   69
    1    H    GLN  78           H        GLN  78  -2.011  -2.349  -9.715
    2    HA   GLN  78           HA       GLN  78  -2.795  -0.036  -8.292
    3    HB2  GLN  78           HB2      GLN  78  -3.845  -2.368  -8.236
    4    HB3  GLN  78           HB3      GLN  78  -2.551  -2.816  -7.129
    5    HG2  GLN  78           HG2      GLN  78  -3.242  -1.134  -5.542
    6    HG3  GLN  78           HG3      GLN  78  -4.422  -0.480  -6.677
    7   HE21  GLN  78          HE21      GLN  78  -5.907  -2.513  -7.573
    8   HE22  GLN  78          HE22      GLN  78  -6.560  -3.450  -6.316

  No H/Q in entry =           8
  In of MODEL   69
    1    H    LEU  79           H        LEU  79  -0.117  -2.301  -7.885
    2    HA   LEU  79           HA       LEU  79   0.890  -1.419  -5.435
    3    HB2  LEU  79           HB2      LEU  79   1.742  -3.424  -6.523
    4    HB3  LEU  79           HB3      LEU  79   2.375  -2.467  -7.859
    5    HG   LEU  79           HG       LEU  79   3.951  -1.340  -6.368
    6   HD13  LEU  79          HD11      LEU  79   2.971  -1.103  -4.288
    7   HD12  LEU  79          HD12      LEU  79   4.051  -2.457  -3.963
    8   HD11  LEU  79          HD13      LEU  79   2.341  -2.750  -4.275
    9   HD23  LEU  79          HD21      LEU  79   5.167  -3.495  -5.490
   10   HD22  LEU  79          HD22      LEU  79   4.944  -3.286  -7.224
   11   HD21  LEU  79          HD23      LEU  79   3.874  -4.359  -6.325

  No H/Q in entry =          11
  In of MODEL   69
    1    H    HIS  80           H        HIS  80   1.724  -0.287  -8.712
    2    HA   HIS  80           HA       HIS  80   3.546   1.692  -7.800
    3    HB2  HIS  80           HB2      HIS  80   2.225   1.014 -10.371
    4    HB3  HIS  80           HB3      HIS  80   2.825   2.664 -10.199
    5    HD1  HIS  80           HD1      HIS  80   5.221   2.963 -10.747
    6    HD2  HIS  80           HD2      HIS  80   4.409  -0.953  -9.567
    7    HE1  HIS  80           HE1      HIS  80   7.407   1.683 -10.945
    8    HE2  HIS  80           HE2      HIS  80   6.923  -0.707 -10.229

  No H/Q in entry =           8
  In of MODEL   69
    1    H    LEU  81           H        LEU  81   0.131   1.863  -8.740
    2    HA   LEU  81           HA       LEU  81  -0.136   4.654  -8.391
    3    HB2  LEU  81           HB2      LEU  81  -2.152   2.411  -8.300
    4    HB3  LEU  81           HB3      LEU  81  -2.601   4.114  -8.194
    5    HG   LEU  81           HG       LEU  81  -0.936   2.974 -10.455
    6   HD12  LEU  81          HD11      LEU  81  -3.182   3.303 -11.727
    7   HD11  LEU  81          HD12      LEU  81  -3.920   3.227 -10.127
    8   HD13  LEU  81          HD13      LEU  81  -2.985   1.862 -10.732
    9   HD23  LEU  81          HD21      LEU  81  -2.042   5.125 -11.529
   10   HD22  LEU  81          HD22      LEU  81  -0.614   5.289 -10.511
   11   HD21  LEU  81          HD23      LEU  81  -2.211   5.636  -9.850

  No H/Q in entry =          11
  In of MODEL   69
    1    H    MET  82           H        MET  82  -0.772   1.956  -6.149
    2    HA   MET  82           HA       MET  82  -1.798   3.532  -4.041
    3    HB2  MET  82           HB2      MET  82  -0.428   0.844  -4.111
    4    HB3  MET  82           HB3      MET  82  -0.988   1.562  -2.603
    5    HG2  MET  82           HG2      MET  82  -2.750   1.083  -5.026
    6    HG3  MET  82           HG3      MET  82  -2.656   0.001  -3.638
    7    HE3  MET  82           HE1      MET  82  -4.345   1.637  -0.794
    8    HE2  MET  82           HE2      MET  82  -2.617   1.915  -0.997
    9    HE1  MET  82           HE3      MET  82  -3.312   0.360  -1.452

  No H/Q in entry =           9
  In of MODEL   69
    1    H    THR  83           H        THR  83   1.493   2.447  -4.775
    2    HA   THR  83           HA       THR  83   2.738   3.538  -2.482
    3    HB   THR  83           HB       THR  83   4.816   3.489  -3.980
    4    HG1  THR  83           HG1      THR  83   4.553   2.974  -6.004
    5   HG22  THR  83          HG21      THR  83   4.366   0.833  -4.321
    6   HG21  THR  83          HG22      THR  83   3.090   1.208  -3.165
    7   HG23  THR  83          HG23      THR  83   4.774   1.548  -2.762

  No H/Q in entry =           7
  In of MODEL   69
    1    H    SER  84           H        SER  84   2.331   4.836  -5.771
    2    HA   SER  84           HA       SER  84   3.677   7.273  -5.318
    3    HB2  SER  84           HB2      SER  84   1.583   6.452  -7.318
    4    HB3  SER  84           HB3      SER  84   2.263   8.079  -7.292
    5    HG   SER  84           HG       SER  84   3.630   5.605  -7.612

  No H/Q in entry =           5
  In of MODEL   69
    1    H    MET  85           H        MET  85   0.185   6.518  -5.110
    2    HA   MET  85           HA       MET  85  -0.667   9.126  -4.485
    3    HB2  MET  85           HB2      MET  85  -2.198   7.320  -5.147
    4    HB3  MET  85           HB3      MET  85  -1.895   6.508  -3.612
    5    HG2  MET  85           HG2      MET  85  -2.767   8.466  -2.393
    6    HG3  MET  85           HG3      MET  85  -3.054   9.292  -3.923
    7    HE1  MET  85           HE1      MET  85  -4.201   7.040  -1.271
    8    HE3  MET  85           HE2      MET  85  -3.776   5.673  -2.298
    9    HE2  MET  85           HE3      MET  85  -5.467   5.997  -1.931

  No H/Q in entry =           9
  In of MODEL   69
    1    H    LEU  86           H        LEU  86   0.274   6.451  -2.367
    2    HA   LEU  86           HA       LEU  86  -0.230   7.741   0.088
    3    HB2  LEU  86           HB2      LEU  86   0.227   5.271  -0.325
    4    HB3  LEU  86           HB3      LEU  86   1.933   5.699  -0.437
    5    HG   LEU  86           HG       LEU  86   1.636   6.848   1.841
    6   HD11  LEU  86          HD11      LEU  86  -1.065   6.088   1.397
    7   HD13  LEU  86          HD12      LEU  86  -0.381   6.826   2.844
    8   HD12  LEU  86          HD13      LEU  86  -0.476   5.071   2.716
    9   HD23  LEU  86          HD21      LEU  86   1.204   3.855   1.952
   10   HD22  LEU  86          HD22      LEU  86   2.220   4.858   2.986
   11   HD21  LEU  86          HD23      LEU  86   2.701   4.541   1.319

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ALA  87           H        ALA  87   2.729   7.452  -1.837
    2    HA   ALA  87           HA       ALA  87   4.457   8.849  -0.124
    3    HB3  ALA  87           HB1      ALA  87   4.519   7.851  -2.838
    4    HB2  ALA  87           HB2      ALA  87   5.867   8.173  -1.751
    5    HB1  ALA  87           HB3      ALA  87   5.243   9.460  -2.780

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ARG  88           H        ARG  88   2.481  10.004  -2.815
    2    HA   ARG  88           HA       ARG  88   3.263  12.691  -2.692
    3    HB2  ARG  88           HB2      ARG  88   1.985  11.553  -4.541
    4    HB3  ARG  88           HB3      ARG  88   0.539  11.694  -3.540
    5    HG2  ARG  88           HG2      ARG  88   1.566  14.271  -3.454
    6    HG3  ARG  88           HG3      ARG  88   1.970  13.765  -5.093
    7    HD2  ARG  88           HD2      ARG  88  -0.179  13.855  -5.765
    8    HD3  ARG  88           HD3      ARG  88  -0.751  12.995  -4.335
    9    HE   ARG  88           HE       ARG  88  -0.938  15.776  -4.734
   10   HH21  ARG  88          HH11      ARG  88  -1.441  17.097  -2.983
   11   HH22  ARG  88          HH12      ARG  88  -1.127  16.549  -1.372
   12   HH11  ARG  88          HH21      ARG  88   0.099  13.497  -2.385
   13   HH12  ARG  88          HH22      ARG  88  -0.273  14.505  -1.033

  No H/Q in entry =          13
  In of MODEL   69
    1    H    GLU  89           H        GLU  89   0.574  11.015  -1.030
    2    HA   GLU  89           HA       GLU  89  -0.512  13.323   0.201
    3    HB2  GLU  89           HB2      GLU  89  -1.638  11.088   0.115
    4    HB3  GLU  89           HB3      GLU  89  -0.501  10.522   1.339
    5    HG2  GLU  89           HG2      GLU  89  -1.297  12.214   2.918
    6    HG3  GLU  89           HG3      GLU  89  -2.362  12.896   1.691

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LEU  90           H        LEU  90   1.945  11.016   1.333
    2    HA   LEU  90           HA       LEU  90   2.336  12.245   3.865
    3    HB2  LEU  90           HB2      LEU  90   4.082  10.474   2.157
    4    HB3  LEU  90           HB3      LEU  90   4.523  10.980   3.793
    5    HG   LEU  90           HG       LEU  90   1.876   9.647   3.156
    6   HD12  LEU  90          HD11      LEU  90   3.020   7.592   4.138
    7   HD11  LEU  90          HD12      LEU  90   4.543   8.443   3.883
    8   HD13  LEU  90          HD13      LEU  90   3.512   8.048   2.506
    9   HD22  LEU  90          HD21      LEU  90   1.640  10.559   5.286
   10   HD21  LEU  90          HD22      LEU  90   3.361  10.443   5.647
   11   HD23  LEU  90          HD23      LEU  90   2.350   9.000   5.699

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  91           H        ILE  91   3.903  12.640   0.722
    2    HA   ILE  91           HA       ILE  91   5.897  14.458   1.549
    3    HB   ILE  91           HB       ILE  91   4.552  13.989  -1.118
    4   HG12  ILE  91          HG12      ILE  91   7.394  13.484  -0.181
    5   HG13  ILE  91          HG13      ILE  91   6.109  12.291  -0.010
    6   HG22  ILE  91          HG21      ILE  91   6.772  15.331  -1.825
    7   HG21  ILE  91          HG22      ILE  91   6.484  16.124  -0.276
    8   HG23  ILE  91          HG23      ILE  91   5.246  16.165  -1.530
    9   HD13  ILE  91          HD11      ILE  91   5.907  11.982  -2.317
   10   HD12  ILE  91          HD12      ILE  91   7.645  12.217  -2.123
   11   HD11  ILE  91          HD13      ILE  91   6.633  13.547  -2.689

  No H/Q in entry =          11
  In of MODEL   69
    1    H    THR  92           H        THR  92   2.525  14.911   0.583
    2    HA   THR  92           HA       THR  92   2.511  17.735   0.540
    3    HB   THR  92           HB       THR  92   0.343  15.745   1.253
    4    HG1  THR  92           HG1      THR  92   0.622  15.578  -0.836
    5   HG22  THR  92          HG21      THR  92  -1.057  17.917   0.561
    6   HG21  THR  92          HG22      THR  92   0.347  18.732   1.246
    7   HG23  THR  92          HG23      THR  92  -0.587  17.609   2.232

  No H/Q in entry =           7
  In of MODEL   69
    1    H    GLU  93           H        GLU  93   1.984  15.421   3.186
    2    HA   GLU  93           HA       GLU  93   1.484  17.315   5.222
    3    HB2  GLU  93           HB2      GLU  93   2.788  14.583   5.426
    4    HB3  GLU  93           HB3      GLU  93   2.117  15.505   6.773
    5    HG2  GLU  93           HG2      GLU  93   0.473  14.749   4.349
    6    HG3  GLU  93           HG3      GLU  93   0.587  13.717   5.770

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LEU  94           H        LEU  94   4.470  15.826   4.028
    2    HA   LEU  94           HA       LEU  94   6.248  16.955   5.902
    3    HB2  LEU  94           HB2      LEU  94   6.612  16.002   3.061
    4    HB3  LEU  94           HB3      LEU  94   7.956  16.649   3.998
    5    HG   LEU  94           HG       LEU  94   6.220  14.454   5.141
    6   HD11  LEU  94          HD11      LEU  94   8.289  14.231   2.983
    7   HD13  LEU  94          HD12      LEU  94   6.841  13.262   3.256
    8   HD12  LEU  94          HD13      LEU  94   8.278  12.997   4.245
    9   HD23  LEU  94          HD21      LEU  94   8.420  13.900   6.264
   10   HD22  LEU  94          HD22      LEU  94   7.766  15.479   6.697
   11   HD21  LEU  94          HD23      LEU  94   9.090  15.359   5.538

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  95           H        ILE  95   5.077  18.150   2.773
    2    HA   ILE  95           HA       ILE  95   6.659  20.501   2.709
    3    HB   ILE  95           HB       ILE  95   3.997  19.837   1.431
    4   HG12  ILE  95          HG12      ILE  95   6.773  20.168   0.263
    5   HG13  ILE  95          HG13      ILE  95   6.123  18.615   0.776
    6   HG21  ILE  95          HG21      ILE  95   5.755  22.298   1.205
    7   HG23  ILE  95          HG22      ILE  95   4.034  22.235   1.581
    8   HG22  ILE  95          HG23      ILE  95   4.596  21.842  -0.044
    9   HD13  ILE  95          HD11      ILE  95   4.542  18.557  -0.935
   10   HD12  ILE  95          HD12      ILE  95   5.886  19.373  -1.734
   11   HD11  ILE  95          HD13      ILE  95   4.525  20.311  -1.120

  No H/Q in entry =          11
  In of MODEL   69
    1    H    GLU  96           H        GLU  96   3.423  19.856   4.039
    2    HA   GLU  96           HA       GLU  96   2.824  22.501   4.813
    3    HB2  GLU  96           HB2      GLU  96   1.142  20.726   4.834
    4    HB3  GLU  96           HB3      GLU  96   2.015  19.887   6.114
    5    HG2  GLU  96           HG2      GLU  96   1.019  21.165   7.703
    6    HG3  GLU  96           HG3      GLU  96   1.552  22.641   6.909

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LEU  97           H        LEU  97   4.674  19.932   6.401
    2    HA   LEU  97           HA       LEU  97   5.067  21.264   8.875
    3    HB2  LEU  97           HB2      LEU  97   6.577  19.096   7.430
    4    HB3  LEU  97           HB3      LEU  97   7.188  19.769   8.939
    5    HG   LEU  97           HG       LEU  97   4.370  18.691   8.655
    6   HD12  LEU  97          HD11      LEU  97   5.314  16.667   9.844
    7   HD11  LEU  97          HD12      LEU  97   6.924  17.292   9.485
    8   HD13  LEU  97          HD13      LEU  97   5.836  16.847   8.169
    9   HD23  LEU  97          HD21      LEU  97   4.851  18.379  11.212
   10   HD22  LEU  97          HD22      LEU  97   4.472  19.996  10.622
   11   HD21  LEU  97          HD23      LEU  97   6.145  19.546  10.944

  No H/Q in entry =          11
  In of MODEL   69
    1    H    HIS  98           H        HIS  98   6.902  21.289   5.828
    2    HA   HIS  98           HA       HIS  98   9.074  22.852   6.711
    3    HB2  HIS  98           HB2      HIS  98   7.747  22.620   3.999
    4    HB3  HIS  98           HB3      HIS  98   9.196  23.589   4.278
    5    HD1  HIS  98           HD1      HIS  98   7.966  20.025   4.291
    6    HD2  HIS  98           HD2      HIS  98  11.563  22.100   4.686
    7    HE1  HIS  98           HE1      HIS  98   9.811  18.286   4.202
    8    HE2  HIS  98           HE2      HIS  98  12.005  19.529   4.442

  No H/Q in entry =           8
  In of MODEL   69
    1    H    GLU  99           H        GLU  99   5.844  23.711   5.579
    2    HA   GLU  99           HA       GLU  99   6.237  26.524   5.533
    3    HB2  GLU  99           HB2      GLU  99   4.339  25.372   4.418
    4    HB3  GLU  99           HB3      GLU  99   3.659  25.004   6.003
    5    HG2  GLU  99           HG2      GLU  99   3.498  27.394   6.520
    6    HG3  GLU  99           HG3      GLU  99   4.258  27.799   4.984

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LYS 100           H        LYS 100   5.124  24.279   8.055
    2    HA   LYS 100           HA       LYS 100   4.572  26.325   9.968
    3    HB2  LYS 100           HB2      LYS 100   5.135  23.369  10.289
    4    HB3  LYS 100           HB3      LYS 100   4.709  24.436  11.633
    5    HG2  LYS 100           HG2      LYS 100   2.632  25.092  10.413
    6    HG3  LYS 100           HG3      LYS 100   3.038  23.929   9.149
    7    HD2  LYS 100           HD2      LYS 100   2.970  22.098  10.800
    8    HD3  LYS 100           HD3      LYS 100   2.581  23.255  12.075
    9    HE2  LYS 100           HE2      LYS 100   0.517  23.896  10.840
   10    HE3  LYS 100           HE3      LYS 100   0.896  22.681   9.613
   11    HZ1  LYS 100           HZ1      LYS 100   0.660  21.999  12.492
   12    HZ3  LYS 100           HZ2      LYS 100   0.623  20.953  11.151
   13    HZ2  LYS 100           HZ3      LYS 100  -0.683  21.998  11.453

  No H/Q in entry =          13
  In of MODEL   69
    1    H    LEU 101           H        LEU 101   7.475  24.519   9.088
    2    HA   LEU 101           HA       LEU 101   9.104  25.336  11.278
    3    HB2  LEU 101           HB2      LEU 101   9.660  24.363   8.487
    4    HB3  LEU 101           HB3      LEU 101  10.977  25.015   9.457
    5    HG   LEU 101           HG       LEU 101   9.146  22.863  10.529
    6   HD12  LEU 101          HD11      LEU 101  11.184  21.359   9.888
    7   HD11  LEU 101          HD12      LEU 101  11.544  22.628   8.719
    8   HD13  LEU 101          HD13      LEU 101  10.009  21.764   8.638
    9   HD21  LEU 101          HD21      LEU 101  11.885  23.950  11.231
   10   HD23  LEU 101          HD22      LEU 101  11.339  22.378  11.808
   11   HD22  LEU 101          HD23      LEU 101  10.461  23.836  12.265

  No H/Q in entry =          11
  In of MODEL   69
    1    H    LYS 102           H        LYS 102   7.507  27.222   9.167
    2    HA   LYS 102           HA       LYS 102   7.594  29.516   8.889
    3    HB2  LYS 102           HB2      LYS 102   9.183  29.379  10.967
    4    HB3  LYS 102           HB3      LYS 102  10.470  29.572   9.794
    5    HG2  LYS 102           HG2      LYS 102   8.386  31.533  10.692
    6    HG3  LYS 102           HG3      LYS 102  10.097  31.784  10.422
    7    HD2  LYS 102           HD2      LYS 102   8.117  31.386   8.143
    8    HD3  LYS 102           HD3      LYS 102   8.517  32.960   8.816
    9    HE2  LYS 102           HE2      LYS 102   9.858  31.780   6.720
   10    HE3  LYS 102           HE3      LYS 102  10.494  33.076   7.731
   11    HZ2  LYS 102           HZ1      LYS 102  12.001  31.164   7.527
   12    HZ1  LYS 102           HZ2      LYS 102  10.842  30.184   8.277
   13    HZ3  LYS 102           HZ3      LYS 102  11.552  31.461   9.135

  No H/Q in entry =          13
  In of MODEL   69
    1    H    ALA 103           H        ALA 103  10.836  28.161   8.277
    2    HA   ALA 103           HA       ALA 103  11.784  29.544   6.199
    3    HB2  ALA 103           HB1      ALA 103  12.644  27.330   5.247
    4    HB1  ALA 103           HB2      ALA 103  11.760  26.554   6.559
    5    HB3  ALA 103           HB3      ALA 103  13.061  27.688   6.923

  No H/Q in entry =           5
  In of MODEL   69
    1    H1   LYS   3           H1       LYS   3 -31.225   5.347 -20.220
    2    H2   LYS   3           H3       LYS   3 -30.214   5.034 -21.547
    3    H3   LYS   3           H2       LYS   3 -31.590   4.076 -21.285
    4    HA   LYS   3           HA       LYS   3 -30.577   2.758 -19.822
    5    HB2  LYS   3           HB2      LYS   3 -28.309   4.174 -21.173
    6    HB3  LYS   3           HB3      LYS   3 -27.975   3.016 -19.885
    7    HG2  LYS   3           HG2      LYS   3 -29.344   1.354 -21.198
    8    HG3  LYS   3           HG3      LYS   3 -29.308   2.511 -22.528
    9    HD2  LYS   3           HD2      LYS   3 -26.824   2.454 -22.442
   10    HD3  LYS   3           HD3      LYS   3 -26.930   1.194 -21.213
   11    HE2  LYS   3           HE2      LYS   3 -28.380  -0.072 -22.907
   12    HE3  LYS   3           HE3      LYS   3 -27.770   1.079 -24.095
   13    HZ3  LYS   3           HZ1      LYS   3 -25.942  -0.118 -24.299
   14    HZ2  LYS   3           HZ2      LYS   3 -26.561  -1.263 -23.207
   15    HZ1  LYS   3           HZ3      LYS   3 -25.607   0.022 -22.639

  No H/Q in entry =          15
  In of MODEL   69
    1    H    LYS   4           H        LYS   4 -30.655   2.686 -17.758
    2    HA   LYS   4           HA       LYS   4 -29.996   5.042 -16.178
    3    HB2  LYS   4           HB2      LYS   4 -31.150   2.350 -15.401
    4    HB3  LYS   4           HB3      LYS   4 -30.972   3.731 -14.319
    5    HG2  LYS   4           HG2      LYS   4 -32.745   3.548 -16.760
    6    HG3  LYS   4           HG3      LYS   4 -33.259   3.646 -15.077
    7    HD2  LYS   4           HD2      LYS   4 -32.613   5.890 -14.879
    8    HD3  LYS   4           HD3      LYS   4 -31.552   5.805 -16.285
    9    HE2  LYS   4           HE2      LYS   4 -33.500   7.121 -16.820
   10    HE3  LYS   4           HE3      LYS   4 -33.537   5.616 -17.737
   11    HZ3  LYS   4           HZ1      LYS   4 -35.114   4.724 -16.180
   12    HZ2  LYS   4           HZ2      LYS   4 -35.691   6.186 -16.822
   13    HZ1  LYS   4           HZ3      LYS   4 -35.055   6.142 -15.249

  No H/Q in entry =          13
  In of MODEL   69
    1    H    HIS   5           H        HIS   5 -28.551   5.212 -14.572
    2    HA   HIS   5           HA       HIS   5 -26.228   3.419 -14.810
    3    HB2  HIS   5           HB2      HIS   5 -26.552   6.209 -13.703
    4    HB3  HIS   5           HB3      HIS   5 -25.054   5.285 -13.635
    5    HD1  HIS   5           HD1      HIS   5 -23.586   6.458 -15.245
    6    HD2  HIS   5           HD2      HIS   5 -27.353   5.710 -16.826
    7    HE1  HIS   5           HE1      HIS   5 -23.396   6.958 -17.712
    8    HE2  HIS   5           HE2      HIS   5 -25.693   6.490 -18.644

  No H/Q in entry =           8
  In of MODEL   69
    1    H    ILE   6           H        ILE   6 -25.986   1.898 -13.438
    2    HA   ILE   6           HA       ILE   6 -27.003   2.240 -10.698
    3    HB   ILE   6           HB       ILE   6 -26.112  -0.261 -12.138
    4   HG12  ILE   6          HG12      ILE   6 -28.883   0.651 -11.354
    5   HG13  ILE   6          HG13      ILE   6 -28.223   0.769 -12.986
    6   HG23  ILE   6          HG21      ILE   6 -26.486  -1.456 -10.241
    7   HG22  ILE   6          HG22      ILE   6 -27.674  -0.309  -9.616
    8   HG21  ILE   6          HG23      ILE   6 -25.952   0.062  -9.516
    9   HD13  ILE   6          HD11      ILE   6 -28.635  -1.374 -13.418
   10   HD12  ILE   6          HD12      ILE   6 -29.670  -1.328 -11.991
   11   HD11  ILE   6          HD13      ILE   6 -28.007  -1.900 -11.856

  No H/Q in entry =          11
  In of MODEL   69
    1    H    TYR   7           H        TYR   7 -25.274   2.959  -9.411
    2    HA   TYR   7           HA       TYR   7 -22.537   2.031 -10.022
    3    HB2  TYR   7           HB2      TYR   7 -23.565   4.495  -8.639
    4    HB3  TYR   7           HB3      TYR   7 -21.871   4.011  -8.638
    5    HD1  TYR   7           HD1      TYR   7 -22.851   2.944 -11.706
    6    HD2  TYR   7           HD2      TYR   7 -22.277   6.602  -9.597
    7    HE1  TYR   7           HE1      TYR   7 -22.414   4.109 -13.833
    8    HE2  TYR   7           HE2      TYR   7 -21.883   7.773 -11.716
    9    HH   TYR   7           HH       TYR   7 -22.070   7.605 -13.946

  No H/Q in entry =           9
  In of MODEL   69
    1    H    LEU   8           H        LEU   8 -21.565   0.743  -8.636
    2    HA   LEU   8           HA       LEU   8 -22.722   0.319  -5.951
    3    HB2  LEU   8           HB2      LEU   8 -20.964  -1.374  -7.705
    4    HB3  LEU   8           HB3      LEU   8 -21.166  -1.700  -5.984
    5    HG   LEU   8           HG       LEU   8 -23.637  -1.933  -6.431
    6   HD13  LEU   8          HD11      LEU   8 -23.761  -0.792  -8.584
    7   HD12  LEU   8          HD12      LEU   8 -24.257  -2.473  -8.773
    8   HD11  LEU   8          HD13      LEU   8 -22.652  -1.963  -9.294
    9   HD23  LEU   8          HD21      LEU   8 -22.303  -4.007  -8.037
   10   HD22  LEU   8          HD22      LEU   8 -23.405  -4.147  -6.669
   11   HD21  LEU   8          HD23      LEU   8 -21.709  -3.754  -6.396

  No H/Q in entry =          11
  In of MODEL   69
    1    H    PHE   9           H        PHE   9 -21.476   0.799  -4.156
    2    HA   PHE   9           HA       PHE   9 -18.700   1.761  -4.665
    3    HB2  PHE   9           HB2      PHE   9 -20.769   2.870  -2.775
    4    HB3  PHE   9           HB3      PHE   9 -19.065   3.296  -2.713
    5    HD1  PHE   9           HD1      PHE   9 -18.014   4.573  -4.510
    6    HD2  PHE   9           HD2      PHE   9 -22.199   3.632  -4.612
    7    HE1  PHE   9           HE1      PHE   9 -18.342   6.222  -6.328
    8    HE2  PHE   9           HE2      PHE   9 -22.528   5.294  -6.425
    9    HZ   PHE   9           HZ       PHE   9 -20.596   6.585  -7.289

  No H/Q in entry =           9
  In of MODEL   69
    1    H    SER  10           H        SER  10 -17.102   0.866  -3.495
    2    HA   SER  10           HA       SER  10 -17.347   0.056  -0.779
    3    HB2  SER  10           HB2      SER  10 -17.287  -2.288  -0.945
    4    HB3  SER  10           HB3      SER  10 -18.513  -1.816  -2.111
    5    HG   SER  10           HG       SER  10 -16.028  -1.778  -3.178

  No H/Q in entry =           5
  In of MODEL   69
    1    H    SER  11           H        SER  11 -15.342   0.152   0.100
    2    HA   SER  11           HA       SER  11 -13.133   0.993  -1.429
    3    HB2  SER  11           HB2      SER  11 -12.008   1.170   0.575
    4    HB3  SER  11           HB3      SER  11 -13.686   1.215   1.120
    5    HG   SER  11           HG       SER  11 -12.078  -1.125   0.936

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ALA  12           H        ALA  12 -14.284  -1.695  -2.182
    2    HA   ALA  12           HA       ALA  12 -11.707  -2.987  -2.591
    3    HB2  ALA  12           HB1      ALA  12 -12.748  -5.239  -1.929
    4    HB1  ALA  12           HB2      ALA  12 -13.959  -4.290  -1.069
    5    HB3  ALA  12           HB3      ALA  12 -12.259  -4.159  -0.621

  No H/Q in entry =           5
  In of MODEL   69
    1    H    GLY  13           H        GLY  13 -12.468  -1.988  -4.672
    2    HA3  GLY  13           HA2      GLY  13 -14.659  -2.765  -6.167
    3    HA2  GLY  13           HA3      GLY  13 -13.098  -2.322  -6.872

  No H/Q in entry =           3
  In of MODEL   69
    1    H    MET  14           H        MET  14 -11.639  -4.599  -5.727
    2    HA   MET  14           HA       MET  14 -11.959  -6.417  -7.823
    3    HB2  MET  14           HB2      MET  14  -9.914  -6.415  -6.484
    4    HB3  MET  14           HB3      MET  14 -10.790  -7.047  -5.091
    5    HG2  MET  14           HG2      MET  14 -11.326  -9.097  -6.375
    6    HG3  MET  14           HG3      MET  14 -10.448  -8.454  -7.764
    7    HE3  MET  14           HE1      MET  14  -6.955  -8.545  -7.186
    8    HE2  MET  14           HE2      MET  14  -7.569  -7.159  -6.287
    9    HE1  MET  14           HE3      MET  14  -8.345  -7.634  -7.795

  No H/Q in entry =           9
  In of MODEL   69
    1    H    SER  15           H        SER  15 -13.273  -6.745  -4.531
    2    HA   SER  15           HA       SER  15 -14.573  -9.246  -5.168
    3    HB2  SER  15           HB2      SER  15 -14.954  -7.383  -2.813
    4    HB3  SER  15           HB3      SER  15 -15.891  -8.857  -3.047
    5    HG   SER  15           HG       SER  15 -14.228  -9.672  -1.999

  No H/Q in entry =           5
  In of MODEL   69
    1    H    THR  16           H        THR  16 -15.658  -5.854  -4.971
    2    HA   THR  16           HA       THR  16 -18.435  -6.379  -5.554
    3    HB   THR  16           HB       THR  16 -16.861  -3.841  -6.116
    4    HG1  THR  16           HG1      THR  16 -16.712  -3.576  -4.065
    5   HG21  THR  16          HG21      THR  16 -19.214  -4.078  -7.002
    6   HG23  THR  16          HG22      THR  16 -18.994  -2.740  -5.861
    7   HG22  THR  16          HG23      THR  16 -19.752  -4.251  -5.336

  No H/Q in entry =           7
  In of MODEL   69
    1    H    SER  17           H        SER  17 -15.542  -5.858  -7.371
    2    HA   SER  17           HA       SER  17 -16.647  -5.228  -9.912
    3    HB2  SER  17           HB2      SER  17 -14.005  -6.470  -9.126
    4    HB3  SER  17           HB3      SER  17 -14.430  -6.101 -10.797
    5    HG   SER  17           HG       SER  17 -14.626  -4.143  -8.788

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LEU  18           H        LEU  18 -16.040  -8.308  -8.347
    2    HA   LEU  18           HA       LEU  18 -16.563  -9.900 -10.656
    3    HB2  LEU  18           HB2      LEU  18 -15.353 -10.782  -8.718
    4    HB3  LEU  18           HB3      LEU  18 -16.785 -10.559  -7.715
    5    HG   LEU  18           HG       LEU  18 -18.001 -12.169  -9.166
    6   HD13  LEU  18          HD11      LEU  18 -16.929 -12.138 -11.240
    7   HD12  LEU  18          HD12      LEU  18 -16.344 -13.647 -10.540
    8   HD11  LEU  18          HD13      LEU  18 -15.322 -12.211 -10.519
    9   HD22  LEU  18          HD21      LEU  18 -17.096 -14.083  -8.164
   10   HD21  LEU  18          HD22      LEU  18 -16.776 -12.750  -7.053
   11   HD23  LEU  18          HD23      LEU  18 -15.483 -13.372  -8.079

  No H/Q in entry =          11
  In of MODEL   69
    1    H    LEU  19           H        LEU  19 -18.594  -8.638  -8.017
    2    HA   LEU  19           HA       LEU  19 -21.021  -9.898  -8.842
    3    HB2  LEU  19           HB2      LEU  19 -20.793  -8.977  -6.616
    4    HB3  LEU  19           HB3      LEU  19 -20.548  -7.363  -7.281
    5    HG   LEU  19           HG       LEU  19 -22.909  -7.435  -8.112
    6   HD12  LEU  19          HD11      LEU  19 -23.063  -9.866  -6.321
    7   HD11  LEU  19          HD12      LEU  19 -23.183  -9.888  -8.079
    8   HD13  LEU  19          HD13      LEU  19 -24.420  -9.076  -7.123
    9   HD22  LEU  19          HD21      LEU  19 -23.840  -6.869  -5.966
   10   HD21  LEU  19          HD22      LEU  19 -22.180  -6.283  -6.060
   11   HD23  LEU  19          HD23      LEU  19 -22.549  -7.740  -5.138

  No H/Q in entry =          11
  In of MODEL   69
    1    H    VAL  20           H        VAL  20 -19.577  -6.734  -9.626
    2    HA   VAL  20           HA       VAL  20 -21.686  -5.790 -11.259
    3    HB   VAL  20           HB       VAL  20 -18.707  -5.143 -11.360
    4   HG11  VAL  20          HG11      VAL  20 -21.016  -3.990 -12.928
    5   HG13  VAL  20          HG12      VAL  20 -19.481  -4.603 -13.540
    6   HG12  VAL  20          HG13      VAL  20 -19.529  -3.085 -12.646
    7   HG23  VAL  20          HG21      VAL  20 -19.651  -2.932 -10.459
    8   HG22  VAL  20          HG22      VAL  20 -19.543  -4.308  -9.362
    9   HG21  VAL  20          HG23      VAL  20 -21.095  -3.873 -10.080

  No H/Q in entry =           9
  In of MODEL   69
    1    H    SER  21           H        SER  21 -18.874  -7.819 -12.176
    2    HA   SER  21           HA       SER  21 -19.620  -7.818 -14.940
    3    HB2  SER  21           HB2      SER  21 -18.143  -9.769 -15.183
    4    HB3  SER  21           HB3      SER  21 -17.350  -8.472 -14.290
    5    HG   SER  21           HG       SER  21 -18.092 -10.987 -13.490

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LYS  22           H        LYS  22 -20.680  -9.934 -12.308
    2    HA   LYS  22           HA       LYS  22 -22.161 -11.646 -14.094
    3    HB2  LYS  22           HB2      LYS  22 -21.408 -12.225 -11.726
    4    HB3  LYS  22           HB3      LYS  22 -22.755 -11.230 -11.173
    5    HG2  LYS  22           HG2      LYS  22 -23.609 -13.387 -11.101
    6    HG3  LYS  22           HG3      LYS  22 -24.220 -12.756 -12.629
    7    HD2  LYS  22           HD2      LYS  22 -22.356 -13.892 -13.803
    8    HD3  LYS  22           HD3      LYS  22 -21.849 -14.588 -12.263
    9    HE2  LYS  22           HE2      LYS  22 -24.539 -15.039 -13.573
   10    HE3  LYS  22           HE3      LYS  22 -23.183 -16.164 -13.634
   11    HZ3  LYS  22           HZ1      LYS  22 -23.316 -16.432 -11.261
   12    HZ2  LYS  22           HZ2      LYS  22 -24.823 -16.776 -11.965
   13    HZ1  LYS  22           HZ3      LYS  22 -24.579 -15.299 -11.163

  No H/Q in entry =          13
  In of MODEL   69
    1    H    MET  23           H        MET  23 -22.966  -8.675 -12.339
    2    HA   MET  23           HA       MET  23 -25.764  -8.824 -12.881
    3    HB2  MET  23           HB2      MET  23 -23.968  -6.464 -12.363
    4    HB3  MET  23           HB3      MET  23 -25.714  -6.333 -12.570
    5    HG2  MET  23           HG2      MET  23 -26.110  -7.575 -10.563
    6    HG3  MET  23           HG3      MET  23 -24.394  -7.950 -10.400
    7    HE2  MET  23           HE1      MET  23 -26.775  -4.303  -9.370
    8    HE1  MET  23           HE2      MET  23 -26.990  -5.325 -10.789
    9    HE3  MET  23           HE3      MET  23 -25.981  -3.883 -10.888

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ARG  24           H        ARG  24 -23.011  -7.407 -14.674
    2    HA   ARG  24           HA       ARG  24 -24.501  -6.204 -16.738
    3    HB2  ARG  24           HB2      ARG  24 -21.664  -7.284 -16.689
    4    HB3  ARG  24           HB3      ARG  24 -22.333  -6.447 -18.068
    5    HG2  ARG  24           HG2      ARG  24 -22.328  -5.091 -15.359
    6    HG3  ARG  24           HG3      ARG  24 -20.877  -5.079 -16.395
    7    HD2  ARG  24           HD2      ARG  24 -23.680  -4.143 -17.165
    8    HD3  ARG  24           HD3      ARG  24 -22.276  -3.125 -16.875
    9    HE   ARG  24           HE       ARG  24 -22.718  -4.585 -19.282
   10   HH21  ARG  24          HH11      ARG  24 -20.868  -5.025 -20.481
   11   HH22  ARG  24          HH12      ARG  24 -19.467  -4.029 -20.291
   12   HH11  ARG  24          HH21      ARG  24 -20.863  -2.411 -17.469
   13   HH12  ARG  24          HH22      ARG  24 -19.477  -2.479 -18.513

  No H/Q in entry =          13
  In of MODEL   69
    1    H    ALA  25           H        ALA  25 -23.326  -9.509 -16.332
    2    HA   ALA  25           HA       ALA  25 -23.902 -10.441 -18.948
    3    HB1  ALA  25           HB1      ALA  25 -23.182 -12.436 -18.174
    4    HB3  ALA  25           HB2      ALA  25 -24.260 -12.386 -16.779
    5    HB2  ALA  25           HB3      ALA  25 -22.720 -11.530 -16.732

  No H/Q in entry =           5
  In of MODEL   69
    1    H    GLN  26           H        GLN  26 -25.773 -10.408 -15.951
    2    HA   GLN  26           HA       GLN  26 -28.081 -11.685 -16.960
    3    HB2  GLN  26           HB2      GLN  26 -27.632  -9.849 -14.626
    4    HB3  GLN  26           HB3      GLN  26 -29.177 -10.610 -14.974
    5    HG2  GLN  26           HG2      GLN  26 -26.575 -12.007 -14.419
    6    HG3  GLN  26           HG3      GLN  26 -27.954 -11.890 -13.333
    7   HE21  GLN  26          HE21      GLN  26 -26.682 -14.075 -14.518
    8   HE22  GLN  26          HE22      GLN  26 -27.695 -15.166 -15.294

  No H/Q in entry =           8
  In of MODEL   69
    1    H    ALA  27           H        ALA  27 -27.208  -8.260 -16.670
    2    HA   ALA  27           HA       ALA  27 -29.703  -7.237 -17.526
    3    HB1  ALA  27           HB1      ALA  27 -27.932  -5.855 -16.429
    4    HB3  ALA  27           HB2      ALA  27 -28.512  -5.148 -17.938
    5    HB2  ALA  27           HB3      ALA  27 -26.962  -5.989 -17.898

  No H/Q in entry =           5
  In of MODEL   69
    1    H    GLU  28           H        GLU  28 -26.954  -8.475 -19.314
    2    HA   GLU  28           HA       GLU  28 -27.869  -7.535 -21.879
    3    HB2  GLU  28           HB2      GLU  28 -25.489  -8.158 -21.199
    4    HB3  GLU  28           HB3      GLU  28 -26.003  -9.836 -21.353
    5    HG2  GLU  28           HG2      GLU  28 -24.841  -9.107 -23.330
    6    HG3  GLU  28           HG3      GLU  28 -26.528  -9.469 -23.691

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LYS  29           H        LYS  29 -28.009 -10.587 -20.123
    2    HA   LYS  29           HA       LYS  29 -29.258 -12.144 -22.096
    3    HB2  LYS  29           HB2      LYS  29 -28.223 -13.044 -20.046
    4    HB3  LYS  29           HB3      LYS  29 -29.521 -12.326 -19.094
    5    HG2  LYS  29           HG2      LYS  29 -31.143 -13.760 -20.139
    6    HG3  LYS  29           HG3      LYS  29 -29.917 -14.412 -21.224
    7    HD2  LYS  29           HD2      LYS  29 -28.782 -15.502 -19.438
    8    HD3  LYS  29           HD3      LYS  29 -29.721 -14.635 -18.223
    9    HE2  LYS  29           HE2      LYS  29 -30.430 -17.007 -18.519
   10    HE3  LYS  29           HE3      LYS  29 -31.723 -15.845 -18.820
   11    HZ1  LYS  29           HZ1      LYS  29 -31.120 -16.048 -21.233
   12    HZ3  LYS  29           HZ2      LYS  29 -31.827 -17.425 -20.533
   13    HZ2  LYS  29           HZ3      LYS  29 -30.153 -17.378 -20.808

  No H/Q in entry =          13
  In of MODEL   69
    1    H    TYR  30           H        TYR  30 -30.722  -9.982 -19.683
    2    HA   TYR  30           HA       TYR  30 -33.358 -10.516 -20.948
    3    HB2  TYR  30           HB2      TYR  30 -32.765  -9.263 -18.257
    4    HB3  TYR  30           HB3      TYR  30 -34.367  -9.569 -18.925
    5    HD1  TYR  30           HD1      TYR  30 -35.237 -11.882 -19.075
    6    HD2  TYR  30           HD2      TYR  30 -31.440 -11.040 -17.342
    7    HE1  TYR  30           HE1      TYR  30 -35.122 -14.180 -18.201
    8    HE2  TYR  30           HE2      TYR  30 -31.326 -13.325 -16.471
    9    HH   TYR  30           HH       TYR  30 -32.910 -15.747 -17.510

  No H/Q in entry =           9
  In of MODEL   69
    1    H    GLU  31           H        GLU  31 -31.214  -8.515 -21.781
    2    HA   GLU  31           HA       GLU  31 -31.163  -6.385 -22.673
    3    HB2  GLU  31           HB2      GLU  31 -34.037  -7.166 -23.204
    4    HB3  GLU  31           HB3      GLU  31 -33.209  -5.809 -23.965
    5    HG2  GLU  31           HG2      GLU  31 -31.696  -7.259 -25.089
    6    HG3  GLU  31           HG3      GLU  31 -32.249  -8.653 -24.162

  No H/Q in entry =           6
  In of MODEL   69
    1    H    VAL  32           H        VAL  32 -31.404  -6.198 -19.949
    2    HA   VAL  32           HA       VAL  32 -33.311  -4.097 -19.387
    3    HB   VAL  32           HB       VAL  32 -30.926  -4.997 -17.740
    4   HG12  VAL  32          HG11      VAL  32 -32.504  -4.139 -15.895
    5   HG11  VAL  32          HG12      VAL  32 -33.334  -3.292 -17.199
    6   HG13  VAL  32          HG13      VAL  32 -31.637  -2.947 -16.865
    7   HG21  VAL  32          HG21      VAL  32 -32.654  -6.770 -18.397
    8   HG23  VAL  32          HG22      VAL  32 -33.726  -5.924 -17.279
    9   HG22  VAL  32          HG23      VAL  32 -32.204  -6.602 -16.700

  No H/Q in entry =           9
  In of MODEL   69
    1    HA   PRO  33           HA       PRO  33 -30.306  -1.171 -21.111
    2    HB2  PRO  33           HB2      PRO  33 -31.859   1.027 -21.082
    3    HB3  PRO  33           HB3      PRO  33 -32.288  -0.319 -22.139
    4    HG2  PRO  33           HG2      PRO  33 -33.307   0.271 -19.359
    5    HG3  PRO  33           HG3      PRO  33 -34.246  -0.003 -20.827
    6    HD2  PRO  33           HD2      PRO  33 -33.777  -2.012 -19.088
    7    HD3  PRO  33           HD3      PRO  33 -33.809  -2.310 -20.826

  No H/Q in entry =           7
  In of MODEL   69
    1    H    VAL  34           H        VAL  34 -29.062  -1.629 -19.128
    2    HA   VAL  34           HA       VAL  34 -28.847   0.853 -17.557
    3    HB   VAL  34           HB       VAL  34 -28.268  -0.535 -15.564
    4   HG12  VAL  34          HG11      VAL  34 -30.668  -1.441 -15.263
    5   HG11  VAL  34          HG12      VAL  34 -30.975  -0.738 -16.849
    6   HG13  VAL  34          HG13      VAL  34 -30.460   0.291 -15.513
    7   HG21  VAL  34          HG21      VAL  34 -28.387  -2.627 -17.507
    8   HG23  VAL  34          HG22      VAL  34 -29.458  -2.964 -16.146
    9   HG22  VAL  34          HG23      VAL  34 -27.749  -2.637 -15.863

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ILE  35           H        ILE  35 -26.891   1.352 -16.703
    2    HA   ILE  35           HA       ILE  35 -24.544   0.026 -17.889
    3    HB   ILE  35           HB       ILE  35 -25.009   2.932 -17.179
    4   HG12  ILE  35          HG12      ILE  35 -23.965   1.562 -19.665
    5   HG13  ILE  35          HG13      ILE  35 -25.611   2.161 -19.449
    6   HG21  ILE  35          HG21      ILE  35 -22.415   1.440 -17.401
    7   HG23  ILE  35          HG22      ILE  35 -22.909   2.649 -16.218
    8   HG22  ILE  35          HG23      ILE  35 -22.513   3.137 -17.865
    9   HD11  ILE  35          HD11      ILE  35 -24.259   4.400 -18.899
   10   HD13  ILE  35          HD12      ILE  35 -24.765   3.954 -20.529
   11   HD12  ILE  35          HD13      ILE  35 -23.114   3.632 -19.999

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ILE  36           H        ILE  36 -23.318  -0.922 -16.241
    2    HA   ILE  36           HA       ILE  36 -23.812  -0.223 -13.398
    3    HB   ILE  36           HB       ILE  36 -22.919  -2.944 -14.406
    4   HG12  ILE  36          HG12      ILE  36 -25.751  -2.168 -13.709
    5   HG13  ILE  36          HG13      ILE  36 -25.156  -2.191 -15.369
    6   HG23  ILE  36          HG21      ILE  36 -23.285  -3.711 -12.272
    7   HG22  ILE  36          HG22      ILE  36 -24.442  -2.435 -11.891
    8   HG21  ILE  36          HG23      ILE  36 -22.718  -2.073 -11.948
    9   HD13  ILE  36          HD11      ILE  36 -25.277  -4.412 -15.505
   10   HD12  ILE  36          HD12      ILE  36 -26.365  -4.266 -14.125
   11   HD11  ILE  36          HD13      ILE  36 -24.662  -4.646 -13.869

  No H/Q in entry =          11
  In of MODEL   69
    1    H    GLU  37           H        GLU  37 -22.060   0.475 -12.289
    2    HA   GLU  37           HA       GLU  37 -19.342  -0.299 -13.141
    3    HB2  GLU  37           HB2      GLU  37 -20.292   2.496 -12.531
    4    HB3  GLU  37           HB3      GLU  37 -18.597   2.025 -12.651
    5    HG2  GLU  37           HG2      GLU  37 -20.601   1.909 -14.887
    6    HG3  GLU  37           HG3      GLU  37 -19.409   3.185 -14.641

  No H/Q in entry =           6
  In of MODEL   69
    1    H    ALA  38           H        ALA  38 -17.875  -0.453 -11.431
    2    HA   ALA  38           HA       ALA  38 -18.950  -0.205  -8.683
    3    HB1  ALA  38           HB1      ALA  38 -17.179  -2.155 -10.020
    4    HB3  ALA  38           HB2      ALA  38 -18.244  -2.366  -8.631
    5    HB2  ALA  38           HB3      ALA  38 -16.648  -1.646  -8.418

  No H/Q in entry =           5
  In of MODEL   69
    1    H    PHE  39           H        PHE  39 -17.755   1.075  -7.232
    2    HA   PHE  39           HA       PHE  39 -15.242   2.298  -8.131
    3    HB2  PHE  39           HB2      PHE  39 -17.474   3.899  -6.885
    4    HB3  PHE  39           HB3      PHE  39 -15.930   4.502  -7.484
    5    HD1  PHE  39           HD1      PHE  39 -15.552   4.868  -9.812
    6    HD2  PHE  39           HD2      PHE  39 -19.246   3.263  -8.414
    7    HE1  PHE  39           HE1      PHE  39 -16.574   5.327 -12.023
    8    HE2  PHE  39           HE2      PHE  39 -20.278   3.708 -10.613
    9    HZ   PHE  39           HZ       PHE  39 -18.941   4.712 -12.434

  No H/Q in entry =           9
  In of MODEL   69
    1    HA   PRO  40           HA       PRO  40 -14.351   1.703  -3.811
    2    HB2  PRO  40           HB2      PRO  40 -12.632   3.767  -3.242
    3    HB3  PRO  40           HB3      PRO  40 -12.148   2.419  -4.270
    4    HG2  PRO  40           HG2      PRO  40 -13.230   5.107  -5.103
    5    HG3  PRO  40           HG3      PRO  40 -11.768   4.294  -5.659
    6    HD2  PRO  40           HD2      PRO  40 -13.965   4.092  -7.109
    7    HD3  PRO  40           HD3      PRO  40 -12.981   2.653  -6.852

  No H/Q in entry =           7
  In of MODEL   69
    1    H    GLU  41           H        GLU  41 -15.023   2.736  -1.722
    2    HA   GLU  41           HA       GLU  41 -17.303   4.389  -1.792
    3    HB2  GLU  41           HB2      GLU  41 -17.309   4.247   0.528
    4    HB3  GLU  41           HB3      GLU  41 -16.468   2.773   0.049
    5    HG2  GLU  41           HG2      GLU  41 -15.179   5.309   1.058
    6    HG3  GLU  41           HG3      GLU  41 -15.410   3.822   1.979

  No H/Q in entry =           6
  In of MODEL   69
    1    H    THR  42           H        THR  42 -13.992   5.377  -1.827
    2    HA   THR  42           HA       THR  42 -14.417   7.967  -0.704
    3    HB   THR  42           HB       THR  42 -12.261   8.550  -1.833
    4    HG1  THR  42           HG1      THR  42 -12.002   7.407  -3.599
    5   HG21  THR  42          HG21      THR  42 -12.432   7.306   0.386
    6   HG23  THR  42          HG22      THR  42 -10.904   7.133  -0.479
    7   HG22  THR  42          HG23      THR  42 -12.094   5.833  -0.525

  No H/Q in entry =           7
  In of MODEL   69
    1    H    LEU  43           H        LEU  43 -15.252   6.753  -3.780
    2    HA   LEU  43           HA       LEU  43 -15.551   9.486  -4.844
    3    HB2  LEU  43           HB2      LEU  43 -15.847   6.791  -6.159
    4    HB3  LEU  43           HB3      LEU  43 -16.062   8.344  -6.966
    5    HG   LEU  43           HG       LEU  43 -13.463   7.276  -5.889
    6   HD11  LEU  43          HD11      LEU  43 -14.604   6.266  -8.019
    7   HD13  LEU  43          HD12      LEU  43 -12.892   6.685  -8.045
    8   HD12  LEU  43          HD13      LEU  43 -14.074   7.772  -8.770
    9   HD21  LEU  43          HD21      LEU  43 -14.240   9.822  -7.307
   10   HD23  LEU  43          HD22      LEU  43 -12.582   9.220  -7.281
   11   HD22  LEU  43          HD23      LEU  43 -13.390   9.641  -5.773

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ALA  44           H        ALA  44 -17.484   7.680  -2.959
    2    HA   ALA  44           HA       ALA  44 -19.938   7.442  -4.310
    3    HB2  ALA  44           HB1      ALA  44 -19.806   6.397  -2.176
    4    HB3  ALA  44           HB2      ALA  44 -20.946   7.727  -1.964
    5    HB1  ALA  44           HB3      ALA  44 -19.286   7.889  -1.392

  No H/Q in entry =           5
  In of MODEL   69
    1    H    GLY  45           H        GLY  45 -18.602  10.321  -2.851
    2    HA3  GLY  45           HA2      GLY  45 -21.066  11.755  -3.294
    3    HA2  GLY  45           HA3      GLY  45 -19.543  12.432  -2.717

  No H/Q in entry =           3
  In of MODEL   69
    1    H    GLU  46           H        GLU  46 -17.959  11.455  -4.953
    2    HA   GLU  46           HA       GLU  46 -18.618  13.598  -6.803
    3    HB2  GLU  46           HB2      GLU  46 -16.384  11.560  -6.764
    4    HB3  GLU  46           HB3      GLU  46 -16.520  12.881  -7.926
    5    HG2  GLU  46           HG2      GLU  46 -16.205  13.199  -4.949
    6    HG3  GLU  46           HG3      GLU  46 -14.912  13.356  -6.136

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LYS  47           H        LYS  47 -18.416  10.070  -7.121
    2    HA   LYS  47           HA       LYS  47 -19.480  10.178  -9.817
    3    HB2  LYS  47           HB2      LYS  47 -18.848   7.878  -7.963
    4    HB3  LYS  47           HB3      LYS  47 -19.455   7.685  -9.609
    5    HG2  LYS  47           HG2      LYS  47 -16.869   9.021  -8.857
    6    HG3  LYS  47           HG3      LYS  47 -17.031   7.370  -9.451
    7    HD2  LYS  47           HD2      LYS  47 -17.738   9.910 -10.908
    8    HD3  LYS  47           HD3      LYS  47 -16.437   8.785 -11.294
    9    HE2  LYS  47           HE2      LYS  47 -18.014   8.104 -12.799
   10    HE3  LYS  47           HE3      LYS  47 -18.423   7.064 -11.436
   11    HZ2  LYS  47           HZ1      LYS  47 -20.191   8.564 -12.682
   12    HZ1  LYS  47           HZ2      LYS  47 -19.683   9.680 -11.508
   13    HZ3  LYS  47           HZ3      LYS  47 -20.315   8.176 -11.033

  No H/Q in entry =          13
  In of MODEL   69
    1    H    GLY  48           H        GLY  48 -20.832   9.495  -6.664
    2    HA3  GLY  48           HA2      GLY  48 -23.180   8.234  -7.399
    3    HA2  GLY  48           HA3      GLY  48 -22.997   9.279  -5.990

  No H/Q in entry =           3
  In of MODEL   69
    1    H    GLN  49           H        GLN  49 -22.444  11.662  -7.632
    2    HA   GLN  49           HA       GLN  49 -25.023  12.711  -7.848
    3    HB2  GLN  49           HB2      GLN  49 -22.480  13.586  -9.200
    4    HB3  GLN  49           HB3      GLN  49 -23.963  14.521  -9.168
    5    HG2  GLN  49           HG2      GLN  49 -23.840  14.628  -6.731
    6    HG3  GLN  49           HG3      GLN  49 -22.369  13.672  -6.761
    7   HE21  GLN  49          HE21      GLN  49 -22.319  15.943  -5.562
    8   HE22  GLN  49          HE22      GLN  49 -21.413  17.197  -6.237

  No H/Q in entry =           8
  In of MODEL   69
    1    H    ASN  50           H        ASN  50 -23.270  10.792 -10.148
    2    HA   ASN  50           HA       ASN  50 -25.141  11.555 -12.284
    3    HB2  ASN  50           HB2      ASN  50 -22.526  10.065 -12.431
    4    HB3  ASN  50           HB3      ASN  50 -23.565  10.423 -13.802
    5   HD21  ASN  50          HD21      ASN  50 -20.972  11.378 -12.184
    6   HD22  ASN  50          HD22      ASN  50 -20.767  13.007 -12.577

  No H/Q in entry =           6
  In of MODEL   69
    1    H    ALA  51           H        ALA  51 -25.109   9.274  -9.961
    2    HA   ALA  51           HA       ALA  51 -25.822   7.054 -11.727
    3    HB2  ALA  51           HB1      ALA  51 -25.234   5.773  -9.989
    4    HB3  ALA  51           HB2      ALA  51 -26.390   6.592  -8.939
    5    HB1  ALA  51           HB3      ALA  51 -24.761   7.242  -9.134

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ASP  52           H        ASP  52 -27.806   5.960 -11.580
    2    HA   ASP  52           HA       ASP  52 -30.035   7.768 -11.006
    3    HB2  ASP  52           HB2      ASP  52 -29.767   5.215 -12.589
    4    HB3  ASP  52           HB3      ASP  52 -31.333   5.928 -12.200

  No H/Q in entry =           4
  In of MODEL   69
    1    H    VAL  53           H        VAL  53 -28.389   4.948  -9.873
    2    HA   VAL  53           HA       VAL  53 -29.868   5.127  -7.383
    3    HB   VAL  53           HB       VAL  53 -31.216   3.417  -8.591
    4   HG11  VAL  53          HG11      VAL  53 -29.429   2.544 -10.060
    5   HG13  VAL  53          HG12      VAL  53 -30.248   1.262  -9.170
    6   HG12  VAL  53          HG13      VAL  53 -28.656   1.813  -8.654
    7   HG23  VAL  53          HG21      VAL  53 -30.378   1.513  -6.824
    8   HG22  VAL  53          HG22      VAL  53 -31.539   2.806  -6.515
    9   HG21  VAL  53          HG23      VAL  53 -29.841   3.026  -6.091

  No H/Q in entry =           9
  In of MODEL   69
    1    H    VAL  54           H        VAL  54 -28.571   4.775  -5.696
    2    HA   VAL  54           HA       VAL  54 -25.785   3.964  -6.242
    3    HB   VAL  54           HB       VAL  54 -26.924   5.792  -4.066
    4   HG11  VAL  54          HG11      VAL  54 -24.313   4.417  -4.275
    5   HG13  VAL  54          HG12      VAL  54 -25.100   5.127  -2.867
    6   HG12  VAL  54          HG13      VAL  54 -24.200   6.153  -3.983
    7   HG22  VAL  54          HG21      VAL  54 -26.084   7.587  -5.212
    8   HG21  VAL  54          HG22      VAL  54 -26.593   6.542  -6.539
    9   HG23  VAL  54          HG23      VAL  54 -24.893   6.615  -6.078

  No H/Q in entry =           9
  In of MODEL   69
    1    H    LEU  55           H        LEU  55 -25.165   2.076  -5.528
    2    HA   LEU  55           HA       LEU  55 -26.678   0.807  -3.331
    3    HB2  LEU  55           HB2      LEU  55 -25.066  -0.404  -5.565
    4    HB3  LEU  55           HB3      LEU  55 -25.827  -1.310  -4.256
    5    HG   LEU  55           HG       LEU  55 -27.264   0.178  -6.445
    6   HD13  LEU  55          HD11      LEU  55 -26.910  -1.708  -7.599
    7   HD12  LEU  55          HD12      LEU  55 -27.867  -2.562  -6.389
    8   HD11  LEU  55          HD13      LEU  55 -26.116  -2.457  -6.216
    9   HD23  LEU  55          HD21      LEU  55 -28.546  -1.732  -4.545
   10   HD22  LEU  55          HD22      LEU  55 -29.256  -0.392  -5.447
   11   HD21  LEU  55          HD23      LEU  55 -28.262  -0.071  -4.026

  No H/Q in entry =          11
  In of MODEL   69
    1    H    LEU  56           H        LEU  56 -25.541   0.296  -1.491
    2    HA   LEU  56           HA       LEU  56 -22.615   0.748  -1.513
    3    HB2  LEU  56           HB2      LEU  56 -24.448   0.579   0.865
    4    HB3  LEU  56           HB3      LEU  56 -22.747   1.042   0.865
    5    HG   LEU  56           HG       LEU  56 -25.064   2.642  -0.187
    6   HD11  LEU  56          HD11      LEU  56 -23.979   2.365   2.361
    7   HD13  LEU  56          HD12      LEU  56 -24.987   3.697   1.796
    8   HD12  LEU  56          HD13      LEU  56 -23.232   3.833   1.730
    9   HD23  LEU  56          HD21      LEU  56 -23.150   4.371  -0.409
   10   HD22  LEU  56          HD22      LEU  56 -23.492   3.225  -1.704
   11   HD21  LEU  56          HD23      LEU  56 -22.148   2.934  -0.602

  No H/Q in entry =          11
  In of MODEL   69
    1    H    GLY  57           H        GLY  57 -21.211  -0.837  -0.907
    2    HA3  GLY  57           HA2      GLY  57 -22.078  -3.546  -1.028
    3    HA2  GLY  57           HA3      GLY  57 -20.473  -3.003  -0.541

  No H/Q in entry =           3
  In of MODEL   69
    1    HA   PRO  58           HA       PRO  58 -23.316  -3.976   3.160
    2    HB2  PRO  58           HB2      PRO  58 -22.590  -6.546   3.862
    3    HB3  PRO  58           HB3      PRO  58 -23.968  -6.198   2.817
    4    HG2  PRO  58           HG2      PRO  58 -21.212  -7.050   2.098
    5    HG3  PRO  58           HG3      PRO  58 -22.757  -7.562   1.420
    6    HD2  PRO  58           HD2      PRO  58 -21.166  -5.755   0.160
    7    HD3  PRO  58           HD3      PRO  58 -22.926  -5.707   0.031

  No H/Q in entry =           7
  In of MODEL   69
    1    H    GLN  59           H        GLN  59 -19.928  -4.402   2.616
    2    HA   GLN  59           HA       GLN  59 -19.213  -4.315   5.385
    3    HB2  GLN  59           HB2      GLN  59 -17.474  -3.280   3.162
    4    HB3  GLN  59           HB3      GLN  59 -16.988  -3.977   4.694
    5    HG2  GLN  59           HG2      GLN  59 -16.514  -5.617   3.096
    6    HG3  GLN  59           HG3      GLN  59 -18.006  -6.150   3.853
    7   HE21  GLN  59          HE21      GLN  59 -18.803  -7.098   2.311
    8   HE22  GLN  59          HE22      GLN  59 -19.398  -6.816   0.784

  No H/Q in entry =           8
  In of MODEL   69
    1    H    ILE  60           H        ILE  60 -20.163  -1.856   3.082
    2    HA   ILE  60           HA       ILE  60 -19.377   0.183   5.073
    3    HB   ILE  60           HB       ILE  60 -19.631   1.845   3.179
    4   HG12  ILE  60          HG12      ILE  60 -19.319  -0.450   1.290
    5   HG13  ILE  60          HG13      ILE  60 -20.933   0.063   1.780
    6   HG22  ILE  60          HG21      ILE  60 -17.534  -0.240   2.694
    7   HG21  ILE  60          HG22      ILE  60 -17.476   0.950   3.993
    8   HG23  ILE  60          HG23      ILE  60 -17.458   1.480   2.312
    9   HD11  ILE  60          HD11      ILE  60 -20.041   2.447   1.077
   10   HD13  ILE  60          HD12      ILE  60 -20.646   1.320  -0.136
   11   HD12  ILE  60          HD13      ILE  60 -18.911   1.499   0.111

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ALA  61           H        ALA  61 -21.803  -1.446   5.161
    2    HA   ALA  61           HA       ALA  61 -24.053   0.160   4.616
    3    HB1  ALA  61           HB1      ALA  61 -25.260  -1.309   5.974
    4    HB2  ALA  61           HB2      ALA  61 -23.869  -1.638   7.007
    5    HB3  ALA  61           HB3      ALA  61 -23.929  -2.301   5.374

  No H/Q in entry =           5
  In of MODEL   69
    1    H    TYR  62           H        TYR  62 -21.884   0.182   7.446
    2    HA   TYR  62           HA       TYR  62 -23.494   1.863   9.039
    3    HB2  TYR  62           HB2      TYR  62 -21.448   2.402  10.257
    4    HB3  TYR  62           HB3      TYR  62 -21.530   0.673   9.920
    5    HD1  TYR  62           HD1      TYR  62 -19.943  -0.382   8.376
    6    HD2  TYR  62           HD2      TYR  62 -19.725   3.805   9.195
    7    HE1  TYR  62           HE1      TYR  62 -17.724  -0.294   7.306
    8    HE2  TYR  62           HE2      TYR  62 -17.491   3.889   8.128
    9    HH   TYR  62           HH       TYR  62 -15.943   0.937   6.968

  No H/Q in entry =           9
  In of MODEL   69
    1    H    MET  63           H        MET  63 -21.828   2.658   6.179
    2    HA   MET  63           HA       MET  63 -21.722   5.514   6.782
    3    HB2  MET  63           HB2      MET  63 -21.046   3.916   4.311
    4    HB3  MET  63           HB3      MET  63 -20.899   5.671   4.427
    5    HG2  MET  63           HG2      MET  63 -19.222   5.407   6.181
    6    HG3  MET  63           HG3      MET  63 -19.356   3.655   6.037
    7    HE3  MET  63           HE1      MET  63 -16.233   5.022   5.173
    8    HE2  MET  63           HE2      MET  63 -16.236   3.496   4.287
    9    HE1  MET  63           HE3      MET  63 -17.058   3.612   5.843

  No H/Q in entry =           9
  In of MODEL   69
    1    H    LEU  64           H        LEU  64 -24.238   3.582   5.844
    2    HA   LEU  64           HA       LEU  64 -25.444   4.908   3.704
    3    HB2  LEU  64           HB2      LEU  64 -26.287   2.818   4.679
    4    HB3  LEU  64           HB3      LEU  64 -26.780   3.701   6.123
    5    HG   LEU  64           HG       LEU  64 -28.480   4.882   4.831
    6   HD13  LEU  64          HD11      LEU  64 -28.170   5.055   2.596
    7   HD12  LEU  64          HD12      LEU  64 -28.784   3.404   2.496
    8   HD11  LEU  64          HD13      LEU  64 -27.046   3.697   2.569
    9   HD23  LEU  64          HD21      LEU  64 -28.937   2.038   4.170
   10   HD22  LEU  64          HD22      LEU  64 -29.958   3.183   5.039
   11   HD21  LEU  64          HD23      LEU  64 -28.580   2.440   5.849

  No H/Q in entry =          11
  In of MODEL   69
    1    HA   PRO  65           HA       PRO  65 -27.718   8.112   6.319
    2    HB2  PRO  65           HB2      PRO  65 -25.752   8.380   8.593
    3    HB3  PRO  65           HB3      PRO  65 -27.497   8.631   8.606
    4    HG2  PRO  65           HG2      PRO  65 -26.541   6.425   9.620
    5    HG3  PRO  65           HG3      PRO  65 -27.945   6.333   8.557
    6    HD2  PRO  65           HD2      PRO  65 -25.053   5.746   7.913
    7    HD3  PRO  65           HD3      PRO  65 -26.489   4.820   7.476

  No H/Q in entry =           7
  In of MODEL   69
    1    H    GLU  66           H        GLU  66 -24.162   8.121   6.441
    2    HA   GLU  66           HA       GLU  66 -23.908  10.909   5.948
    3    HB2  GLU  66           HB2      GLU  66 -22.047   8.614   5.398
    4    HB3  GLU  66           HB3      GLU  66 -21.622  10.306   5.140
    5    HG2  GLU  66           HG2      GLU  66 -21.873  10.750   7.491
    6    HG3  GLU  66           HG3      GLU  66 -22.374   9.083   7.771

  No H/Q in entry =           6
  In of MODEL   69
    1    H    ILE  67           H        ILE  67 -23.931   8.090   3.786
    2    HA   ILE  67           HA       ILE  67 -23.512   9.729   1.444
    3    HB   ILE  67           HB       ILE  67 -24.365   6.814   1.708
    4   HG12  ILE  67          HG12      ILE  67 -21.742   7.997   0.782
    5   HG13  ILE  67          HG13      ILE  67 -22.054   7.629   2.478
    6   HG21  ILE  67          HG21      ILE  67 -24.307   8.618  -0.577
    7   HG23  ILE  67          HG22      ILE  67 -24.906   6.963  -0.480
    8   HG22  ILE  67          HG23      ILE  67 -23.198   7.266  -0.795
    9   HD12  ILE  67          HD11      ILE  67 -21.572   5.787   0.194
   10   HD11  ILE  67          HD12      ILE  67 -22.595   5.242   1.522
   11   HD13  ILE  67          HD13      ILE  67 -20.934   5.745   1.838

  No H/Q in entry =          11
  In of MODEL   69
    1    H    GLN  68           H        GLN  68 -26.387   8.682   3.073
    2    HA   GLN  68           HA       GLN  68 -28.203   9.518   1.045
    3    HB2  GLN  68           HB2      GLN  68 -28.494   9.254   4.034
    4    HB3  GLN  68           HB3      GLN  68 -29.809   9.794   3.004
    5    HG2  GLN  68           HG2      GLN  68 -29.788   7.724   1.797
    6    HG3  GLN  68           HG3      GLN  68 -28.341   7.197   2.636
    7   HE21  GLN  68          HE21      GLN  68 -30.497   5.801   2.517
    8   HE22  GLN  68          HE22      GLN  68 -31.338   5.379   3.936

  No H/Q in entry =           8
  In of MODEL   69
    1    H    ARG  69           H        ARG  69 -26.661  11.297   3.747
    2    HA   ARG  69           HA       ARG  69 -28.056  13.745   3.241
    3    HB2  ARG  69           HB2      ARG  69 -25.720  12.903   4.891
    4    HB3  ARG  69           HB3      ARG  69 -25.818  14.608   4.475
    5    HG2  ARG  69           HG2      ARG  69 -28.149  14.648   5.414
    6    HG3  ARG  69           HG3      ARG  69 -27.923  12.978   5.946
    7    HD2  ARG  69           HD2      ARG  69 -26.277  15.387   6.803
    8    HD3  ARG  69           HD3      ARG  69 -27.407  14.497   7.812
    9    HE   ARG  69           HE       ARG  69 -24.769  13.574   6.929
   10   HH21  ARG  69          HH11      ARG  69 -23.952  11.862   8.192
   11   HH22  ARG  69          HH12      ARG  69 -24.984  11.068   9.333
   12   HH11  ARG  69          HH21      ARG  69 -27.741  13.038   8.604
   13   HH12  ARG  69          HH22      ARG  69 -27.129  11.732   9.564

  No H/Q in entry =          13
  In of MODEL   69
    1    H    LEU  70           H        LEU  70 -25.147  12.336   1.966
    2    HA   LEU  70           HA       LEU  70 -24.051  14.678   0.736
    3    HB2  LEU  70           HB2      LEU  70 -23.032  12.395   1.420
    4    HB3  LEU  70           HB3      LEU  70 -23.619  11.870  -0.157
    5    HG   LEU  70           HG       LEU  70 -22.030  13.228  -1.266
    6   HD11  LEU  70          HD11      LEU  70 -21.257  14.174   1.503
    7   HD13  LEU  70          HD12      LEU  70 -21.950  15.156   0.213
    8   HD12  LEU  70          HD13      LEU  70 -20.326  14.491   0.037
    9   HD22  LEU  70          HD21      LEU  70 -20.577  11.540  -0.959
   10   HD21  LEU  70          HD22      LEU  70 -21.515  11.051   0.452
   11   HD23  LEU  70          HD23      LEU  70 -20.147  12.149   0.640

  No H/Q in entry =          11
  In of MODEL   69
    1    H    LEU  71           H        LEU  71 -26.155  12.070  -0.323
    2    HA   LEU  71           HA       LEU  71 -26.665  13.467  -2.895
    3    HB2  LEU  71           HB2      LEU  71 -26.837  10.496  -2.353
    4    HB3  LEU  71           HB3      LEU  71 -26.957  11.304  -3.915
    5    HG   LEU  71           HG       LEU  71 -24.459  11.405  -2.222
    6   HD12  LEU  71          HD11      LEU  71 -24.459   9.698  -4.600
    7   HD11  LEU  71          HD12      LEU  71 -25.479   9.104  -3.291
    8   HD13  LEU  71          HD13      LEU  71 -23.767   9.415  -3.003
    9   HD22  LEU  71          HD21      LEU  71 -24.565  13.170  -3.776
   10   HD21  LEU  71          HD22      LEU  71 -25.032  12.079  -5.080
   11   HD23  LEU  71          HD23      LEU  71 -23.418  11.974  -4.376

  No H/Q in entry =          11
  In of MODEL   69
    1    HA   PRO  72           HA       PRO  72 -30.560  13.055  -0.310
    2    HB2  PRO  72           HB2      PRO  72 -31.446  15.602  -0.487
    3    HB3  PRO  72           HB3      PRO  72 -30.146  15.202   0.636
    4    HG2  PRO  72           HG2      PRO  72 -29.938  16.308  -2.153
    5    HG3  PRO  72           HG3      PRO  72 -29.198  16.917  -0.673
    6    HD2  PRO  72           HD2      PRO  72 -27.819  15.318  -2.369
    7    HD3  PRO  72           HD3      PRO  72 -27.586  15.211  -0.625

  No H/Q in entry =           7
  In of MODEL   69
    1    H    ASN  73           H        ASN  73 -29.905  13.913  -3.546
    2    HA   ASN  73           HA       ASN  73 -32.752  13.550  -4.205
    3    HB2  ASN  73           HB2      ASN  73 -32.270  14.593  -6.331
    4    HB3  ASN  73           HB3      ASN  73 -31.777  15.622  -4.996
    5   HD21  ASN  73          HD21      ASN  73 -30.946  15.589  -7.663
    6   HD22  ASN  73          HD22      ASN  73 -29.274  15.440  -7.828

  No H/Q in entry =           6
  In of MODEL   69
    1    H    LYS  74           H        LYS  74 -30.753  11.332  -3.680
    2    HA   LYS  74           HA       LYS  74 -31.272   9.849  -6.189
    3    HB2  LYS  74           HB2      LYS  74 -28.759   9.637  -4.526
    4    HB3  LYS  74           HB3      LYS  74 -29.114   8.771  -6.021
    5    HG2  LYS  74           HG2      LYS  74 -28.882  11.749  -5.914
    6    HG3  LYS  74           HG3      LYS  74 -27.493  10.692  -6.165
    7    HD2  LYS  74           HD2      LYS  74 -28.575   9.689  -8.091
    8    HD3  LYS  74           HD3      LYS  74 -30.008  10.681  -7.822
    9    HE2  LYS  74           HE2      LYS  74 -28.796  12.684  -8.314
   10    HE3  LYS  74           HE3      LYS  74 -27.266  11.808  -8.356
   11    HZ2  LYS  74           HZ1      LYS  74 -28.713  12.326 -10.520
   12    HZ1  LYS  74           HZ2      LYS  74 -29.358  10.809 -10.105
   13    HZ3  LYS  74           HZ3      LYS  74 -27.691  10.976 -10.386

  No H/Q in entry =          13
  In of MODEL   69
    1    HA   PRO  75           HA       PRO  75 -32.677   6.949  -3.139
    2    HB2  PRO  75           HB2      PRO  75 -32.945   4.677  -4.652
    3    HB3  PRO  75           HB3      PRO  75 -34.083   6.017  -4.781
    4    HG2  PRO  75           HG2      PRO  75 -31.716   5.385  -6.500
    5    HG3  PRO  75           HG3      PRO  75 -33.362   5.791  -6.983
    6    HD2  PRO  75           HD2      PRO  75 -31.439   7.676  -6.976
    7    HD3  PRO  75           HD3      PRO  75 -33.082   8.077  -6.473

  No H/Q in entry =           7
  In of MODEL   69
    1    H    VAL  76           H        VAL  76 -31.233   5.953  -1.714
    2    HA   VAL  76           HA       VAL  76 -28.743   4.732  -2.747
    3    HB   VAL  76           HB       VAL  76 -29.080   6.283  -0.144
    4   HG11  VAL  76          HG11      VAL  76 -26.693   4.973  -1.461
    5   HG13  VAL  76          HG12      VAL  76 -27.407   4.567   0.102
    6   HG12  VAL  76          HG13      VAL  76 -26.573   6.106  -0.114
    7   HG22  VAL  76          HG21      VAL  76 -28.417   8.159  -1.084
    8   HG21  VAL  76          HG22      VAL  76 -28.933   7.408  -2.595
    9   HG23  VAL  76          HG23      VAL  76 -27.236   7.352  -2.116

  No H/Q in entry =           9
  In of MODEL   69
    1    H    GLU  77           H        GLU  77 -28.514   2.602  -2.061
    2    HA   GLU  77           HA       GLU  77 -29.329   1.894   0.607
    3    HB2  GLU  77           HB2      GLU  77 -30.913   0.215   0.109
    4    HB3  GLU  77           HB3      GLU  77 -31.467   1.709  -0.649
    5    HG2  GLU  77           HG2      GLU  77 -30.820   0.884  -2.803
    6    HG3  GLU  77           HG3      GLU  77 -30.174  -0.582  -2.072

  No H/Q in entry =           6
  In of MODEL   69
    1    H    VAL  78           H        VAL  78 -28.991  -0.166   1.340
    2    HA   VAL  78           HA       VAL  78 -26.306  -0.940   0.513
    3    HB   VAL  78           HB       VAL  78 -28.038  -1.762   2.883
    4   HG11  VAL  78          HG11      VAL  78 -25.671  -3.005   1.832
    5   HG13  VAL  78          HG12      VAL  78 -26.595  -3.436   3.273
    6   HG12  VAL  78          HG13      VAL  78 -25.288  -2.258   3.383
    7   HG22  VAL  78          HG21      VAL  78 -26.611  -0.342   4.195
    8   HG21  VAL  78          HG22      VAL  78 -27.338   0.578   2.879
    9   HG23  VAL  78          HG23      VAL  78 -25.654   0.063   2.770

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ILE  79           H        ILE  79 -25.737  -2.871  -0.321
    2    HA   ILE  79           HA       ILE  79 -27.766  -4.413  -1.647
    3    HB   ILE  79           HB       ILE  79 -24.774  -4.903  -1.367
    4   HG12  ILE  79          HG12      ILE  79 -26.389  -3.892  -3.713
    5   HG13  ILE  79          HG13      ILE  79 -25.540  -2.835  -2.582
    6   HG22  ILE  79          HG21      ILE  79 -25.832  -6.170  -3.660
    7   HG21  ILE  79          HG22      ILE  79 -26.830  -6.656  -2.290
    8   HG23  ILE  79          HG23      ILE  79 -25.086  -6.916  -2.247
    9   HD13  ILE  79          HD11      ILE  79 -24.101  -2.995  -4.377
   10   HD12  ILE  79          HD12      ILE  79 -24.420  -4.715  -4.605
   11   HD11  ILE  79          HD13      ILE  79 -23.460  -4.171  -3.229

  No H/Q in entry =          11
  In of MODEL   69
    1    H    ASP  80           H        ASP  80 -28.619  -6.325  -1.010
    2    HA   ASP  80           HA       ASP  80 -28.594  -7.136   1.665
    3    HB2  ASP  80           HB2      ASP  80 -30.319  -7.785   0.022
    4    HB3  ASP  80           HB3      ASP  80 -29.139  -8.809  -0.797

  No H/Q in entry =           4
  In of MODEL   69
    1    H    SER  81           H        SER  81 -27.063  -8.217   2.853
    2    HA   SER  81           HA       SER  81 -24.545  -8.913   1.718
    3    HB2  SER  81           HB2      SER  81 -24.013  -9.864   3.929
    4    HB3  SER  81           HB3      SER  81 -24.732  -8.261   4.078
    5    HG   SER  81           HG       SER  81 -26.668  -9.214   4.620

  No H/Q in entry =           5
  In of MODEL   69
    1    H    LEU  82           H        LEU  82 -27.238 -11.021   2.073
    2    HA   LEU  82           HA       LEU  82 -25.661 -13.389   1.654
    3    HB2  LEU  82           HB2      LEU  82 -28.598 -12.806   1.349
    4    HB3  LEU  82           HB3      LEU  82 -27.883 -14.407   1.181
    5    HG   LEU  82           HG       LEU  82 -27.839 -12.773   3.700
    6   HD12  LEU  82          HD11      LEU  82 -29.492 -14.518   4.455
    7   HD11  LEU  82          HD12      LEU  82 -29.618 -15.036   2.772
    8   HD13  LEU  82          HD13      LEU  82 -30.115 -13.407   3.233
    9   HD21  LEU  82          HD21      LEU  82 -26.884 -15.494   2.855
   10   HD23  LEU  82          HD22      LEU  82 -27.267 -15.151   4.541
   11   HD22  LEU  82          HD23      LEU  82 -26.005 -14.232   3.721

  No H/Q in entry =          11
  In of MODEL   69
    1    H    LEU  83           H        LEU  83 -27.614 -11.249  -0.365
    2    HA   LEU  83           HA       LEU  83 -27.366 -12.687  -2.786
    3    HB2  LEU  83           HB2      LEU  83 -27.813  -9.764  -2.242
    4    HB3  LEU  83           HB3      LEU  83 -27.816 -10.463  -3.860
    5    HG   LEU  83           HG       LEU  83 -29.875 -10.798  -1.700
    6   HD13  LEU  83          HD11      LEU  83 -30.634  -8.995  -2.836
    7   HD12  LEU  83          HD12      LEU  83 -31.068 -10.155  -4.089
    8   HD11  LEU  83          HD13      LEU  83 -29.542  -9.278  -4.190
    9   HD23  LEU  83          HD21      LEU  83 -29.964 -12.148  -4.382
   10   HD22  LEU  83          HD22      LEU  83 -30.950 -12.459  -2.955
   11   HD21  LEU  83          HD23      LEU  83 -29.257 -12.948  -2.980

  No H/Q in entry =          11
  In of MODEL   69
    1    H    TYR  84           H        TYR  84 -25.458 -10.227  -1.165
    2    HA   TYR  84           HA       TYR  84 -23.572  -9.793  -3.286
    3    HB2  TYR  84           HB2      TYR  84 -24.109  -8.218  -1.366
    4    HB3  TYR  84           HB3      TYR  84 -23.170  -9.296  -0.335
    5    HD1  TYR  84           HD1      TYR  84 -20.735  -9.495  -0.624
    6    HD2  TYR  84           HD2      TYR  84 -23.024  -6.735  -2.941
    7    HE1  TYR  84           HE1      TYR  84 -18.651  -8.346  -1.291
    8    HE2  TYR  84           HE2      TYR  84 -20.950  -5.583  -3.625
    9    HH   TYR  84           HH       TYR  84 -17.764  -6.781  -2.532

  No H/Q in entry =           9
  In of MODEL   69
    1    H    GLY  85           H        GLY  85 -23.353 -11.693  -0.270
    2    HA3  GLY  85           HA2      GLY  85 -20.761 -12.626  -0.687
    3    HA2  GLY  85           HA3      GLY  85 -21.996 -13.452   0.263

  No H/Q in entry =           3
  In of MODEL   69
    1    H    LYS  86           H        LYS  86 -23.811 -13.913  -1.809
    2    HA   LYS  86           HA       LYS  86 -22.717 -16.318  -2.972
    3    HB2  LYS  86           HB2      LYS  86 -25.374 -14.900  -3.144
    4    HB3  LYS  86           HB3      LYS  86 -25.046 -16.469  -3.875
    5    HG2  LYS  86           HG2      LYS  86 -24.759 -17.458  -1.715
    6    HG3  LYS  86           HG3      LYS  86 -24.963 -15.886  -0.940
    7    HD2  LYS  86           HD2      LYS  86 -27.102 -16.878  -0.844
    8    HD3  LYS  86           HD3      LYS  86 -27.190 -15.747  -2.193
    9    HE2  LYS  86           HE2      LYS  86 -27.052 -17.467  -3.786
   10    HE3  LYS  86           HE3      LYS  86 -26.481 -18.636  -2.596
   11    HZ2  LYS  86           HZ1      LYS  86 -29.188 -17.417  -2.729
   12    HZ1  LYS  86           HZ2      LYS  86 -28.648 -18.419  -1.467
   13    HZ3  LYS  86           HZ3      LYS  86 -28.786 -19.038  -3.041

  No H/Q in entry =          13
  In of MODEL   69
    1    H    VAL  87           H        VAL  87 -22.724 -13.135  -3.974
    2    HA   VAL  87           HA       VAL  87 -22.410 -12.026  -5.950
    3    HB   VAL  87           HB       VAL  87 -21.298 -14.572  -7.167
    4   HG13  VAL  87          HG11      VAL  87 -20.040 -13.132  -8.502
    5   HG12  VAL  87          HG12      VAL  87 -20.099 -11.823  -7.321
    6   HG11  VAL  87          HG13      VAL  87 -21.521 -12.199  -8.293
    7   HG22  VAL  87          HG21      VAL  87 -19.164 -14.184  -6.109
    8   HG21  VAL  87          HG22      VAL  87 -20.402 -14.427  -4.878
    9   HG23  VAL  87          HG23      VAL  87 -19.816 -12.803  -5.231

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ASP  88           H        ASP  88 -24.924 -12.680  -5.610
    2    HA   ASP  88           HA       ASP  88 -26.001 -13.989  -7.980
    3    HB2  ASP  88           HB2      ASP  88 -27.025 -14.165  -5.661
    4    HB3  ASP  88           HB3      ASP  88 -27.493 -12.472  -5.825

  No H/Q in entry =           4
  In of MODEL   69
    1    H    GLY  89           H        GLY  89 -25.287 -12.780  -9.653
    2    HA3  GLY  89           HA2      GLY  89 -25.494 -10.018  -9.951
    3    HA2  GLY  89           HA3      GLY  89 -25.440 -11.184 -11.272

  No H/Q in entry =           3
  In of MODEL   69
    1    H    LEU  90           H        LEU  90 -27.878 -12.546 -10.809
    2    HA   LEU  90           HA       LEU  90 -29.694 -10.669 -12.011
    3    HB2  LEU  90           HB2      LEU  90 -29.727 -13.084 -12.511
    4    HB3  LEU  90           HB3      LEU  90 -30.251 -13.399 -10.857
    5    HG   LEU  90           HG       LEU  90 -32.376 -12.318 -11.284
    6   HD13  LEU  90          HD11      LEU  90 -32.194 -10.626 -12.816
    7   HD12  LEU  90          HD12      LEU  90 -32.707 -11.907 -13.918
    8   HD11  LEU  90          HD13      LEU  90 -30.998 -11.490 -13.785
    9   HD23  LEU  90          HD21      LEU  90 -32.258 -14.029 -13.662
   10   HD22  LEU  90          HD22      LEU  90 -33.254 -14.155 -12.212
   11   HD21  LEU  90          HD23      LEU  90 -31.594 -14.750 -12.195

  No H/Q in entry =          11
  In of MODEL   69
    1    H    GLY  91           H        GLY  91 -29.552 -12.059  -8.776
    2    HA3  GLY  91           HA2      GLY  91 -31.916 -10.937  -7.805
    3    HA2  GLY  91           HA3      GLY  91 -30.531 -11.422  -6.827

  No H/Q in entry =           3
  In of MODEL   69
    1    H    VAL  92           H        VAL  92 -28.620  -9.605  -7.721
    2    HA   VAL  92           HA       VAL  92 -29.456  -7.261  -6.262
    3    HB   VAL  92           HB       VAL  92 -26.885  -7.757  -7.808
    4   HG12  VAL  92          HG11      VAL  92 -27.099  -5.795  -5.550
    5   HG11  VAL  92          HG12      VAL  92 -27.750  -5.312  -7.118
    6   HG13  VAL  92          HG13      VAL  92 -26.050  -5.758  -6.969
    7   HG22  VAL  92          HG21      VAL  92 -26.665  -9.287  -6.159
    8   HG21  VAL  92          HG22      VAL  92 -27.833  -8.482  -5.109
    9   HG23  VAL  92          HG23      VAL  92 -26.184  -7.868  -5.230

  No H/Q in entry =           9
  In of MODEL   69
    1    H    LEU  93           H        LEU  93 -28.998  -8.035  -9.652
    2    HA   LEU  93           HA       LEU  93 -29.359  -5.436 -10.677
    3    HB2  LEU  93           HB2      LEU  93 -28.678  -7.333 -12.065
    4    HB3  LEU  93           HB3      LEU  93 -30.265  -8.070 -11.838
    5    HG   LEU  93           HG       LEU  93 -31.283  -6.158 -13.042
    6   HD11  LEU  93          HD11      LEU  93 -29.455  -4.525 -12.569
    7   HD13  LEU  93          HD12      LEU  93 -29.872  -4.619 -14.281
    8   HD12  LEU  93          HD13      LEU  93 -28.419  -5.418 -13.683
    9   HD23  LEU  93          HD21      LEU  93 -30.208  -6.792 -15.295
   10   HD22  LEU  93          HD22      LEU  93 -31.049  -8.025 -14.356
   11   HD21  LEU  93          HD23      LEU  93 -29.285  -7.950 -14.338

  No H/Q in entry =          11
  In of MODEL   69
    1    H    LYS  94           H        LYS  94 -31.717  -7.978  -9.769
    2    HA   LYS  94           HA       LYS  94 -34.069  -6.584 -10.473
    3    HB2  LYS  94           HB2      LYS  94 -33.558  -8.693  -8.381
    4    HB3  LYS  94           HB3      LYS  94 -35.158  -8.026  -8.692
    5    HG2  LYS  94           HG2      LYS  94 -35.034  -8.879 -10.997
    6    HG3  LYS  94           HG3      LYS  94 -33.470  -9.602 -10.624
    7    HD2  LYS  94           HD2      LYS  94 -34.600 -10.884  -8.769
    8    HD3  LYS  94           HD3      LYS  94 -36.142 -10.274  -9.365
    9    HE2  LYS  94           HE2      LYS  94 -35.588 -11.273 -11.592
   10    HE3  LYS  94           HE3      LYS  94 -34.174 -12.016 -10.845
   11    HZ3  LYS  94           HZ1      LYS  94 -36.006 -13.564 -10.986
   12    HZ2  LYS  94           HZ2      LYS  94 -37.002 -12.516 -10.092
   13    HZ1  LYS  94           HZ3      LYS  94 -35.643 -13.226  -9.361

  No H/Q in entry =          13
  In of MODEL   69
    1    H    ALA  95           H        ALA  95 -32.283  -6.581  -7.399
    2    HA   ALA  95           HA       ALA  95 -34.168  -4.971  -5.998
    3    HB2  ALA  95           HB1      ALA  95 -31.786  -6.302  -5.385
    4    HB3  ALA  95           HB2      ALA  95 -32.788  -5.368  -4.276
    5    HB1  ALA  95           HB3      ALA  95 -31.438  -4.595  -5.106

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ALA  96           H        ALA  96 -31.509  -4.161  -8.091
    2    HA   ALA  96           HA       ALA  96 -31.451  -1.374  -7.410
    3    HB2  ALA  96           HB1      ALA  96 -30.064  -1.205  -9.509
    4    HB3  ALA  96           HB2      ALA  96 -30.347  -2.926  -9.774
    5    HB1  ALA  96           HB3      ALA  96 -29.455  -2.388  -8.350

  No H/Q in entry =           5
  In of MODEL   69
    1    H    VAL  97           H        VAL  97 -32.931  -3.195 -10.056
    2    HA   VAL  97           HA       VAL  97 -34.007  -0.950 -11.402
    3    HB   VAL  97           HB       VAL  97 -34.788  -3.884 -11.355
    4   HG11  VAL  97          HG11      VAL  97 -36.593  -1.913 -11.931
    5   HG13  VAL  97          HG12      VAL  97 -36.627  -3.531 -12.632
    6   HG12  VAL  97          HG13      VAL  97 -35.875  -2.204 -13.516
    7   HG21  VAL  97          HG21      VAL  97 -33.500  -2.114 -13.434
    8   HG23  VAL  97          HG22      VAL  97 -33.933  -3.807 -13.672
    9   HG22  VAL  97          HG23      VAL  97 -32.703  -3.367 -12.485

  No H/Q in entry =           9
  In of MODEL   69
    1    H    ALA  98           H        ALA  98 -35.202  -3.054  -8.807
    2    HA   ALA  98           HA       ALA  98 -37.777  -1.919  -8.528
    3    HB1  ALA  98           HB1      ALA  98 -36.756  -4.072  -7.408
    4    HB3  ALA  98           HB2      ALA  98 -37.957  -3.127  -6.523
    5    HB2  ALA  98           HB3      ALA  98 -36.242  -2.950  -6.148

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ALA  99           H        ALA  99 -34.727  -1.037  -6.870
    2    HA   ALA  99           HA       ALA  99 -35.894   0.992  -5.291
    3    HB1  ALA  99           HB1      ALA  99 -33.229   0.101  -5.975
    4    HB2  ALA  99           HB2      ALA  99 -33.804   0.897  -4.509
    5    HB3  ALA  99           HB3      ALA  99 -33.319   1.862  -5.903

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ILE 100           H        ILE 100 -34.812   1.019  -8.636
    2    HA   ILE 100           HA       ILE 100 -35.011   3.857  -8.953
    3    HB   ILE 100           HB       ILE 100 -35.062   1.631 -11.019
    4   HG12  ILE 100          HG12      ILE 100 -32.923   3.663 -10.388
    5   HG13  ILE 100          HG13      ILE 100 -32.954   2.038  -9.703
    6   HG21  ILE 100          HG21      ILE 100 -35.506   4.542 -11.252
    7   HG23  ILE 100          HG22      ILE 100 -35.987   3.233 -12.332
    8   HG22  ILE 100          HG23      ILE 100 -34.340   3.860 -12.386
    9   HD12  ILE 100          HD11      ILE 100 -32.394   2.907 -12.501
   10   HD11  ILE 100          HD12      ILE 100 -33.045   1.296 -12.201
   11   HD13  ILE 100          HD13      ILE 100 -31.512   1.775 -11.477

  No H/Q in entry =          11
  In of MODEL   69
    1    H    LYS 101           H        LYS 101 -37.275   1.207  -9.619
    2    HA   LYS 101           HA       LYS 101 -39.356   2.805 -10.699
    3    HB2  LYS 101           HB2      LYS 101 -39.232   0.070  -9.478
    4    HB3  LYS 101           HB3      LYS 101 -40.786   0.808  -9.868
    5    HG2  LYS 101           HG2      LYS 101 -40.284   0.870 -12.162
    6    HG3  LYS 101           HG3      LYS 101 -38.588   0.487 -11.874
    7    HD2  LYS 101           HD2      LYS 101 -39.812  -1.459 -12.711
    8    HD3  LYS 101           HD3      LYS 101 -39.203  -1.731 -11.078
    9    HE2  LYS 101           HE2      LYS 101 -41.267  -2.426 -10.575
   10    HE3  LYS 101           HE3      LYS 101 -41.737  -0.726 -10.640
   11    HZ3  LYS 101           HZ1      LYS 101 -42.600  -0.961 -12.762
   12    HZ2  LYS 101           HZ2      LYS 101 -43.059  -2.413 -12.011
   13    HZ1  LYS 101           HZ3      LYS 101 -41.739  -2.390 -13.080

  No H/Q in entry =          13
  In of MODEL   69
    1    H    LYS 102           H        LYS 102 -38.893   1.438  -7.437
    2    HA   LYS 102           HA       LYS 102 -41.166   2.654  -6.307
    3    HB2  LYS 102           HB2      LYS 102 -39.928   0.831  -5.215
    4    HB3  LYS 102           HB3      LYS 102 -38.548   1.906  -4.990
    5    HG2  LYS 102           HG2      LYS 102 -39.894   3.338  -3.556
    6    HG3  LYS 102           HG3      LYS 102 -41.277   2.269  -3.784
    7    HD2  LYS 102           HD2      LYS 102 -40.050   0.447  -2.682
    8    HD3  LYS 102           HD3      LYS 102 -38.668   1.518  -2.452
    9    HE2  LYS 102           HE2      LYS 102 -40.051   3.031  -1.110
   10    HE3  LYS 102           HE3      LYS 102 -41.451   1.989  -1.362
   11    HZ1  LYS 102           HZ1      LYS 102 -39.730   0.282  -0.281
   12    HZ3  LYS 102           HZ2      LYS 102 -40.859   1.188   0.607
   13    HZ2  LYS 102           HZ3      LYS 102 -39.251   1.721   0.482

  No H/Q in entry =          13
  In of MODEL   69
    1    H    ALA 103           H        ALA 103 -38.209   4.035  -7.328
    2    HA   ALA 103           HA       ALA 103 -38.472   6.405  -5.626
    3    HB2  ALA 103           HB1      ALA 103 -36.466   7.103  -7.199
    4    HB3  ALA 103           HB2      ALA 103 -36.413   5.373  -7.541
    5    HB1  ALA 103           HB3      ALA 103 -36.212   5.954  -5.888

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ALA 104           H        ALA 104 -39.044   5.560  -8.954
    2    HA   ALA 104           HA       ALA 104 -39.643   8.318  -9.675
    3    HB2  ALA 104           HB1      ALA 104 -39.652   7.578 -11.854
    4    HB1  ALA 104           HB2      ALA 104 -40.372   6.023 -11.434
    5    HB3  ALA 104           HB3      ALA 104 -38.655   6.310 -11.142

  No H/Q in entry =           5
  In of MODEL   69
    1    H    ALA 105           H        ALA 105 -41.258   6.261  -7.822
    2    HA   ALA 105           HA       ALA 105 -43.693   7.635  -7.872
    3    HB2  ALA 105           HB1      ALA 105 -44.405   6.703  -9.891
    4    HB3  ALA 105           HB2      ALA 105 -45.047   5.547  -8.724
    5    HB1  ALA 105           HB3      ALA 105 -43.563   5.180  -9.603

  No H/Q in entry =           5
  In of MODEL   70
    1    H1   ALA   1           H3       ALA   1 -12.425 -15.458  -2.367
    2    H2   ALA   1           H2       ALA   1 -11.498 -16.611  -3.208
    3    H3   ALA   1           H1       ALA   1 -12.629 -15.652  -4.041
    4    HA   ALA   1           HA       ALA   1 -14.049 -17.335  -3.803
    5    HB3  ALA   1           HB1      ALA   1 -12.676 -19.124  -3.342
    6    HB1  ALA   1           HB2      ALA   1 -13.431 -19.003  -1.753
    7    HB2  ALA   1           HB3      ALA   1 -11.846 -18.282  -2.033

  No H/Q in entry =           7
  In of MODEL   70
    1    H    GLU   2           H        GLU   2 -15.684 -18.169  -2.150
    2    HA   GLU   2           HA       GLU   2 -17.310 -16.429  -1.091
    3    HB2  GLU   2           HB2      GLU   2 -16.402 -18.867   0.453
    4    HB3  GLU   2           HB3      GLU   2 -17.915 -17.997   0.707
    5    HG2  GLU   2           HG2      GLU   2 -18.908 -19.070  -1.028
    6    HG3  GLU   2           HG3      GLU   2 -17.580 -18.686  -2.112

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLU   3           H        GLU   3 -15.416 -17.807   1.532
    2    HA   GLU   3           HA       GLU   3 -15.608 -15.452   3.091
    3    HB2  GLU   3           HB2      GLU   3 -14.056 -18.019   3.341
    4    HB3  GLU   3           HB3      GLU   3 -13.808 -16.703   4.488
    5    HG2  GLU   3           HG2      GLU   3 -16.003 -16.827   5.306
    6    HG3  GLU   3           HG3      GLU   3 -16.608 -17.618   3.856

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LEU   4           H        LEU   4 -12.672 -16.968   1.700
    2    HA   LEU   4           HA       LEU   4 -10.814 -15.088   2.300
    3    HB2  LEU   4           HB2      LEU   4 -11.060 -16.381  -0.425
    4    HB3  LEU   4           HB3      LEU   4  -9.599 -15.680   0.261
    5    HG   LEU   4           HG       LEU   4 -11.124 -18.058   1.371
    6   HD13  LEU   4          HD11      LEU   4  -9.509 -19.434   0.442
    7   HD12  LEU   4          HD12      LEU   4  -8.283 -18.167   0.417
    8   HD11  LEU   4          HD13      LEU   4  -9.571 -18.172  -0.787
    9   HD23  LEU   4          HD21      LEU   4  -8.875 -18.151   2.754
   10   HD22  LEU   4          HD22      LEU   4 -10.182 -17.095   3.283
   11   HD21  LEU   4          HD23      LEU   4  -8.811 -16.423   2.402

  No H/Q in entry =          11
  In of MODEL   70
    1    H    GLU   5           H        GLU   5 -13.144 -14.850  -0.375
    2    HA   GLU   5           HA       GLU   5 -12.109 -12.379  -1.374
    3    HB2  GLU   5           HB2      GLU   5 -13.492 -13.976  -2.714
    4    HB3  GLU   5           HB3      GLU   5 -14.885 -13.528  -1.729
    5    HG2  GLU   5           HG2      GLU   5 -14.969 -12.175  -3.714
    6    HG3  GLU   5           HG3      GLU   5 -14.465 -11.126  -2.389

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLU   6           H        GLU   6 -14.846 -13.223   0.716
    2    HA   GLU   6           HA       GLU   6 -15.716 -10.535   1.117
    3    HB2  GLU   6           HB2      GLU   6 -17.140 -12.554   1.513
    4    HB3  GLU   6           HB3      GLU   6 -16.141 -12.935   2.916
    5    HG2  GLU   6           HG2      GLU   6 -18.017 -11.729   3.767
    6    HG3  GLU   6           HG3      GLU   6 -16.675 -10.588   3.765

  No H/Q in entry =           6
  In of MODEL   70
    1    H    VAL   7           H        VAL   7 -13.437 -12.676   2.689
    2    HA   VAL   7           HA       VAL   7 -12.952 -11.109   5.017
    3    HB   VAL   7           HB       VAL   7 -11.274 -13.173   3.567
    4   HG11  VAL   7          HG11      VAL   7 -10.788 -11.648   6.132
    5   HG13  VAL   7          HG12      VAL   7  -9.690 -11.876   4.772
    6   HG12  VAL   7          HG13      VAL   7 -10.061 -13.228   5.841
    7   HG21  VAL   7          HG21      VAL   7 -13.533 -13.709   4.785
    8   HG23  VAL   7          HG22      VAL   7 -12.603 -13.448   6.262
    9   HG22  VAL   7          HG23      VAL   7 -12.126 -14.713   5.132

  No H/Q in entry =           9
  In of MODEL   70
    1    H    VAL   8           H        VAL   8 -11.440 -11.241   1.808
    2    HA   VAL   8           HA       VAL   8  -9.354  -9.395   2.303
    3    HB   VAL   8           HB       VAL   8 -10.823 -10.069  -0.256
    4   HG11  VAL   8          HG11      VAL   8  -8.449  -8.294   0.309
    5   HG13  VAL   8          HG12      VAL   8  -9.865  -7.953  -0.686
    6   HG12  VAL   8          HG13      VAL   8  -8.641  -9.086  -1.256
    7   HG23  VAL   8          HG21      VAL   8  -7.987 -10.864   0.175
    8   HG22  VAL   8          HG22      VAL   8  -9.320 -11.789  -0.511
    9   HG21  VAL   8          HG23      VAL   8  -9.145 -11.668   1.237

  No H/Q in entry =           9
  In of MODEL   70
    1    H    MET   9           H        MET   9 -12.693  -8.962   1.141
    2    HA   MET   9           HA       MET   9 -12.594  -6.186   0.707
    3    HB2  MET   9           HB2      MET   9 -14.815  -8.063   1.492
    4    HB3  MET   9           HB3      MET   9 -15.098  -6.324   1.365
    5    HG2  MET   9           HG2      MET   9 -13.988  -6.515  -0.965
    6    HG3  MET   9           HG3      MET   9 -14.260  -8.250  -0.799
    7    HE2  MET   9           HE1      MET   9 -16.821  -8.584   0.801
    8    HE1  MET   9           HE2      MET   9 -16.449  -9.428  -0.699
    9    HE3  MET   9           HE3      MET   9 -18.026  -8.674  -0.490

  No H/Q in entry =           9
  In of MODEL   70
    1    H    GLY  10           H        GLY  10 -13.283  -8.070   3.633
    2    HA3  GLY  10           HA2      GLY  10 -13.804  -5.879   5.353
    3    HA2  GLY  10           HA3      GLY  10 -13.261  -7.475   5.866

  No H/Q in entry =           3
  In of MODEL   70
    1    H    LEU  11           H        LEU  11 -10.816  -7.630   4.553
    2    HA   LEU  11           HA       LEU  11  -9.099  -6.218   6.312
    3    HB2  LEU  11           HB2      LEU  11  -8.568  -7.648   3.704
    4    HB3  LEU  11           HB3      LEU  11  -7.290  -6.960   4.704
    5    HG   LEU  11           HG       LEU  11  -9.318  -8.968   5.718
    6   HD13  LEU  11          HD11      LEU  11  -8.111 -10.219   4.154
    7   HD12  LEU  11          HD12      LEU  11  -7.180 -10.470   5.630
    8   HD11  LEU  11          HD13      LEU  11  -6.624  -9.311   4.423
    9   HD22  LEU  11          HD21      LEU  11  -8.454  -7.966   7.636
   10   HD21  LEU  11          HD22      LEU  11  -6.910  -7.584   6.874
   11   HD23  LEU  11          HD23      LEU  11  -7.257  -9.236   7.383

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  12           H        ILE  12  -9.991  -5.659   2.922
    2    HA   ILE  12           HA       ILE  12  -8.272  -3.450   2.497
    3    HB   ILE  12           HB       ILE  12 -10.934  -4.083   1.199
    4   HG12  ILE  12          HG12      ILE  12  -8.916  -5.764   1.130
    5   HG13  ILE  12          HG13      ILE  12  -9.781  -5.405  -0.350
    6   HG23  ILE  12          HG21      ILE  12 -10.318  -1.768   0.763
    7   HG22  ILE  12          HG22      ILE  12  -9.989  -2.700  -0.692
    8   HG21  ILE  12          HG23      ILE  12  -8.695  -2.249   0.379
    9   HD12  ILE  12          HD11      ILE  12  -7.274  -5.386  -0.563
   10   HD11  ILE  12          HD12      ILE  12  -7.245  -4.008   0.535
   11   HD13  ILE  12          HD13      ILE  12  -8.030  -3.871  -1.020

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  13           H        ILE  13 -11.637  -3.677   3.588
    2    HA   ILE  13           HA       ILE  13 -12.064  -0.885   3.858
    3    HB   ILE  13           HB       ILE  13 -13.298  -3.300   5.197
    4   HG12  ILE  13          HG12      ILE  13 -13.531  -2.697   2.673
    5   HG13  ILE  13          HG13      ILE  13 -14.957  -3.159   3.578
    6   HG23  ILE  13          HG21      ILE  13 -13.814  -1.692   6.795
    7   HG22  ILE  13          HG22      ILE  13 -15.182  -1.512   5.705
    8   HG21  ILE  13          HG23      ILE  13 -13.840  -0.373   5.629
    9   HD12  ILE  13          HD11      ILE  13 -15.266  -1.102   2.135
   10   HD11  ILE  13          HD12      ILE  13 -14.107  -0.303   3.181
   11   HD13  ILE  13          HD13      ILE  13 -15.625  -0.862   3.849

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ASN  14           H        ASN  14 -10.984  -3.389   6.133
    2    HA   ASN  14           HA       ASN  14 -10.766  -1.754   8.419
    3    HB2  ASN  14           HB2      ASN  14 -10.543  -4.364   8.096
    4    HB3  ASN  14           HB3      ASN  14  -8.829  -3.996   7.941
    5   HD21  ASN  14          HD21      ASN  14  -9.485  -5.514  10.116
    6   HD22  ASN  14          HD22      ASN  14  -9.448  -4.594  11.540

  No H/Q in entry =           6
  In of MODEL   70
    1    H    SER  15           H        SER  15  -8.371  -2.604   5.929
    2    HA   SER  15           HA       SER  15  -6.212  -1.135   7.004
    3    HB2  SER  15           HB2      SER  15  -5.193  -1.359   4.844
    4    HB3  SER  15           HB3      SER  15  -6.162  -2.811   5.071
    5    HG   SER  15           HG       SER  15  -7.045  -2.225   3.260

  No H/Q in entry =           5
  In of MODEL   70
    1    H    GLY  16           H        GLY  16  -8.802  -0.239   4.754
    2    HA3  GLY  16           HA2      GLY  16  -7.915   2.392   4.204
    3    HA2  GLY  16           HA3      GLY  16  -9.572   1.815   4.041

  No H/Q in entry =           3
  In of MODEL   70
    1    H    GLN  17           H        GLN  17 -10.125   1.095   6.690
    2    HA   GLN  17           HA       GLN  17 -10.807   3.607   7.830
    3    HB2  GLN  17           HB2      GLN  17 -10.734   0.825   9.016
    4    HB3  GLN  17           HB3      GLN  17 -11.354   2.233   9.878
    5    HG2  GLN  17           HG2      GLN  17 -12.369   1.303   7.176
    6    HG3  GLN  17           HG3      GLN  17 -13.146   0.927   8.714
    7   HE21  GLN  17          HE21      GLN  17 -13.578   2.929   6.191
    8   HE22  GLN  17          HE22      GLN  17 -14.171   4.310   6.983

  No H/Q in entry =           8
  In of MODEL   70
    1    H    ALA  18           H        ALA  18  -8.202   1.299   8.452
    2    HA   ALA  18           HA       ALA  18  -7.094   2.503  10.724
    3    HB2  ALA  18           HB1      ALA  18  -6.506   0.281   9.356
    4    HB3  ALA  18           HB2      ALA  18  -5.336   1.052  10.428
    5    HB1  ALA  18           HB3      ALA  18  -5.254   1.330   8.688

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ARG  19           H        ARG  19  -6.314   3.019   7.276
    2    HA   ARG  19           HA       ARG  19  -4.396   5.047   7.707
    3    HB2  ARG  19           HB2      ARG  19  -4.733   3.910   5.511
    4    HB3  ARG  19           HB3      ARG  19  -6.267   4.766   5.333
    5    HG2  ARG  19           HG2      ARG  19  -5.117   6.927   5.402
    6    HG3  ARG  19           HG3      ARG  19  -3.576   6.126   5.708
    7    HD2  ARG  19           HD2      ARG  19  -3.693   6.718   3.365
    8    HD3  ARG  19           HD3      ARG  19  -3.795   4.959   3.510
    9    HE   ARG  19           HE       ARG  19  -6.420   5.893   3.500
   10   HH21  ARG  19          HH11      ARG  19  -7.611   6.061   1.581
   11   HH22  ARG  19          HH12      ARG  19  -6.787   6.131   0.062
   12   HH11  ARG  19          HH21      ARG  19  -3.642   5.930   1.469
   13   HH12  ARG  19          HH22      ARG  19  -4.538   6.054  -0.001

  No H/Q in entry =          13
  In of MODEL   70
    1    H    SER  20           H        SER  20  -7.893   5.196   7.103
    2    HA   SER  20           HA       SER  20  -8.224   7.955   7.054
    3    HB2  SER  20           HB2      SER  20 -10.035   6.360   6.556
    4    HB3  SER  20           HB3      SER  20 -10.091   5.899   8.255
    5    HG   SER  20           HG       SER  20 -10.524   8.500   7.194

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LEU  21           H        LEU  21  -8.247   5.772   9.859
    2    HA   LEU  21           HA       LEU  21  -8.672   7.772  11.823
    3    HB2  LEU  21           HB2      LEU  21  -7.346   5.058  11.984
    4    HB3  LEU  21           HB3      LEU  21  -7.645   6.078  13.388
    5    HG   LEU  21           HG       LEU  21  -9.824   5.205  11.467
    6   HD12  LEU  21          HD11      LEU  21 -10.407   3.711  13.533
    7   HD11  LEU  21          HD12      LEU  21  -8.704   3.914  13.944
    8   HD13  LEU  21          HD13      LEU  21  -9.159   3.168  12.411
    9   HD22  LEU  21          HD21      LEU  21 -10.689   7.043  12.636
   10   HD21  LEU  21          HD22      LEU  21  -9.758   6.702  14.092
   11   HD23  LEU  21          HD23      LEU  21 -11.162   5.721  13.700

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ALA  22           H        ALA  22  -5.730   6.372  10.419
    2    HA   ALA  22           HA       ALA  22  -3.841   7.669  12.043
    3    HB2  ALA  22           HB1      ALA  22  -3.439   5.812  10.353
    4    HB1  ALA  22           HB2      ALA  22  -2.232   7.097  10.389
    5    HB3  ALA  22           HB3      ALA  22  -3.449   7.064   9.112

  No H/Q in entry =           5
  In of MODEL   70
    1    H    TYR  23           H        TYR  23  -5.145   8.698   8.859
    2    HA   TYR  23           HA       TYR  23  -3.787  11.182   8.791
    3    HB2  TYR  23           HB2      TYR  23  -4.872  10.281   6.797
    4    HB3  TYR  23           HB3      TYR  23  -6.451  10.399   7.576
    5    HD1  TYR  23           HD1      TYR  23  -3.528  12.428   6.446
    6    HD2  TYR  23           HD2      TYR  23  -7.680  12.412   7.543
    7    HE1  TYR  23           HE1      TYR  23  -3.736  14.780   5.687
    8    HE2  TYR  23           HE2      TYR  23  -7.890  14.764   6.783
    9    HH   TYR  23           HH       TYR  23  -5.176  16.439   5.225

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ALA  24           H        ALA  24  -6.917  10.232  10.166
    2    HA   ALA  24           HA       ALA  24  -7.732  12.829  10.936
    3    HB1  ALA  24           HB1      ALA  24  -9.562  11.593  11.401
    4    HB2  ALA  24           HB2      ALA  24  -8.743  11.015  12.850
    5    HB3  ALA  24           HB3      ALA  24  -8.623  10.102  11.347

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ALA  25           H        ALA  25  -5.753  10.353  12.513
    2    HA   ALA  25           HA       ALA  25  -5.408  11.603  15.015
    3    HB2  ALA  25           HB1      ALA  25  -4.660   9.244  14.195
    4    HB3  ALA  25           HB2      ALA  25  -3.639  10.093  15.358
    5    HB1  ALA  25           HB3      ALA  25  -3.201  10.073  13.649

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LEU  26           H        LEU  26  -3.611  11.886  11.977
    2    HA   LEU  26           HA       LEU  26  -1.637  13.689  12.896
    3    HB2  LEU  26           HB2      LEU  26  -1.343  12.534  10.793
    4    HB3  LEU  26           HB3      LEU  26  -2.809  13.255  10.136
    5    HG   LEU  26           HG       LEU  26  -1.775  15.497  10.273
    6   HD12  LEU  26          HD11      LEU  26   0.763  15.494  10.690
    7   HD11  LEU  26          HD12      LEU  26   0.525  13.915  11.434
    8   HD13  LEU  26          HD13      LEU  26  -0.271  15.337  12.110
    9   HD21  LEU  26          HD21      LEU  26  -0.048  13.427   8.880
   10   HD23  LEU  26          HD22      LEU  26  -0.075  15.148   8.510
   11   HD22  LEU  26          HD23      LEU  26  -1.507  14.163   8.220

  No H/Q in entry =          11
  In of MODEL   70
    1    H    LYS  27           H        LYS  27  -4.813  14.200  11.415
    2    HA   LYS  27           HA       LYS  27  -4.732  16.988  11.216
    3    HB2  LYS  27           HB2      LYS  27  -6.488  15.526  10.228
    4    HB3  LYS  27           HB3      LYS  27  -7.149  15.276  11.844
    5    HG2  LYS  27           HG2      LYS  27  -7.557  17.686  12.079
    6    HG3  LYS  27           HG3      LYS  27  -6.844  17.976  10.489
    7    HD2  LYS  27           HD2      LYS  27  -8.588  16.558   9.450
    8    HD3  LYS  27           HD3      LYS  27  -9.307  16.284  11.039
    9    HE2  LYS  27           HE2      LYS  27  -9.728  18.700  11.282
   10    HE3  LYS  27           HE3      LYS  27  -8.981  18.994   9.708
   11    HZ3  LYS  27           HZ1      LYS  27 -11.359  18.891   9.463
   12    HZ2  LYS  27           HZ2      LYS  27 -11.422  17.375  10.233
   13    HZ1  LYS  27           HZ3      LYS  27 -10.674  17.532   8.712

  No H/Q in entry =          13
  In of MODEL   70
    1    H    GLN  28           H        GLN  28  -5.644  14.910  13.942
    2    HA   GLN  28           HA       GLN  28  -6.523  16.922  15.717
    3    HB2  GLN  28           HB2      GLN  28  -5.413  14.160  16.024
    4    HB3  GLN  28           HB3      GLN  28  -5.522  15.186  17.456
    5    HG2  GLN  28           HG2      GLN  28  -7.561  13.725  16.966
    6    HG3  GLN  28           HG3      GLN  28  -7.879  15.441  17.215
    7   HE21  GLN  28          HE21      GLN  28  -8.210  16.779  15.213
    8   HE22  GLN  28          HE22      GLN  28  -8.788  16.030  13.805

  No H/Q in entry =           8
  In of MODEL   70
    1    H    ALA  29           H        ALA  29  -3.316  15.594  15.032
    2    HA   ALA  29           HA       ALA  29  -1.866  16.977  17.012
    3    HB1  ALA  29           HB1      ALA  29   0.059  16.266  15.896
    4    HB3  ALA  29           HB2      ALA  29  -0.692  16.398  14.306
    5    HB2  ALA  29           HB3      ALA  29  -1.129  15.070  15.380

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LYS  30           H        LYS  30  -2.711  17.866  13.682
    2    HA   LYS  30           HA       LYS  30  -1.273  20.290  13.583
    3    HB2  LYS  30           HB2      LYS  30  -3.812  19.445  12.171
    4    HB3  LYS  30           HB3      LYS  30  -2.960  20.950  11.829
    5    HG2  LYS  30           HG2      LYS  30  -0.905  19.633  11.317
    6    HG3  LYS  30           HG3      LYS  30  -1.829  18.148  11.561
    7    HD2  LYS  30           HD2      LYS  30  -3.383  18.807   9.765
    8    HD3  LYS  30           HD3      LYS  30  -2.482  20.304   9.523
    9    HE2  LYS  30           HE2      LYS  30  -0.465  18.987   8.945
   10    HE3  LYS  30           HE3      LYS  30  -1.385  17.495   9.156
   11    HZ2  LYS  30           HZ1      LYS  30  -1.196  18.364   6.815
   12    HZ1  LYS  30           HZ2      LYS  30  -2.224  19.640   7.282
   13    HZ3  LYS  30           HZ3      LYS  30  -2.769  18.029   7.352

  No H/Q in entry =          13
  In of MODEL   70
    1    H    GLN  31           H        GLN  31  -4.385  19.476  14.992
    2    HA   GLN  31           HA       GLN  31  -5.113  22.242  15.444
    3    HB2  GLN  31           HB2      GLN  31  -6.325  19.811  16.765
    4    HB3  GLN  31           HB3      GLN  31  -7.065  21.392  16.519
    5    HG2  GLN  31           HG2      GLN  31  -6.362  20.607  13.930
    6    HG3  GLN  31           HG3      GLN  31  -6.907  19.109  14.676
    7   HE21  GLN  31          HE21      GLN  31  -8.294  20.702  12.573
    8   HE22  GLN  31          HE22      GLN  31  -9.803  21.113  13.230

  No H/Q in entry =           8
  In of MODEL   70
    1    H    GLY  32           H        GLY  32  -2.828  20.284  16.766
    2    HA3  GLY  32           HA2      GLY  32  -1.423  20.727  18.569
    3    HA2  GLY  32           HA3      GLY  32  -2.536  21.984  19.092

  No H/Q in entry =           3
  In of MODEL   70
    1    H    ASP  33           H        ASP  33  -3.998  18.965  18.428
    2    HA   ASP  33           HA       ASP  33  -4.418  18.511  21.307
    3    HB2  ASP  33           HB2      ASP  33  -5.835  17.520  18.828
    4    HB3  ASP  33           HB3      ASP  33  -6.190  16.913  20.444

  No H/Q in entry =           4
  In of MODEL   70
    1    H    PHE  34           H        PHE  34  -2.261  17.631  21.614
    2    HA   PHE  34           HA       PHE  34  -1.290  15.369  20.213
    3    HB2  PHE  34           HB2      PHE  34  -0.662  16.344  23.008
    4    HB3  PHE  34           HB3      PHE  34   0.250  15.109  22.141
    5    HD1  PHE  34           HD1      PHE  34   0.124  18.536  22.878
    6    HD2  PHE  34           HD2      PHE  34   0.920  15.824  19.642
    7    HE1  PHE  34           HE1      PHE  34   1.444  20.290  21.726
    8    HE2  PHE  34           HE2      PHE  34   2.236  17.581  18.495
    9    HZ   PHE  34           HZ       PHE  34   2.500  19.811  19.542

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ALA  35           H        ALA  35  -3.328  15.672  23.074
    2    HA   ALA  35           HA       ALA  35  -3.153  13.007  23.969
    3    HB3  ALA  35           HB1      ALA  35  -5.603  13.666  24.825
    4    HB1  ALA  35           HB2      ALA  35  -5.047  15.277  24.371
    5    HB2  ALA  35           HB3      ALA  35  -4.147  14.340  25.562

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ALA  36           H        ALA  36  -5.581  14.559  21.869
    2    HA   ALA  36           HA       ALA  36  -7.028  12.167  21.388
    3    HB1  ALA  36           HB1      ALA  36  -8.464  13.610  20.432
    4    HB3  ALA  36           HB2      ALA  36  -7.285  14.015  19.184
    5    HB2  ALA  36           HB3      ALA  36  -7.298  14.902  20.709

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ALA  37           H        ALA  37  -4.325  13.718  19.723
    2    HA   ALA  37           HA       ALA  37  -4.311  12.084  17.425
    3    HB3  ALA  37           HB1      ALA  37  -2.296  13.768  18.850
    4    HB2  ALA  37           HB2      ALA  37  -2.825  13.832  17.170
    5    HB1  ALA  37           HB3      ALA  37  -1.688  12.586  17.691

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LYS  38           H        LYS  38  -2.561  11.752  20.504
    2    HA   LYS  38           HA       LYS  38  -1.267   9.335  20.014
    3    HB2  LYS  38           HB2      LYS  38  -1.568  11.100  22.161
    4    HB3  LYS  38           HB3      LYS  38  -2.208   9.579  22.776
    5    HG2  LYS  38           HG2      LYS  38  -0.129   8.430  22.240
    6    HG3  LYS  38           HG3      LYS  38   0.500   9.868  21.428
    7    HD2  LYS  38           HD2      LYS  38   0.684  11.082  23.464
    8    HD3  LYS  38           HD3      LYS  38  -0.352   9.945  24.329
    9    HE2  LYS  38           HE2      LYS  38   1.999   9.597  24.950
   10    HE3  LYS  38           HE3      LYS  38   1.376   8.190  24.084
   11    HZ3  LYS  38           HZ1      LYS  38   2.683   8.592  22.305
   12    HZ2  LYS  38           HZ2      LYS  38   3.649   9.406  23.443
   13    HZ1  LYS  38           HZ3      LYS  38   2.582  10.282  22.451

  No H/Q in entry =          13
  In of MODEL   70
    1    H    ALA  39           H        ALA  39  -4.500   9.873  21.415
    2    HA   ALA  39           HA       ALA  39  -5.098   7.161  21.917
    3    HB3  ALA  39           HB1      ALA  39  -7.229   9.135  21.149
    4    HB2  ALA  39           HB2      ALA  39  -6.329   9.349  22.651
    5    HB1  ALA  39           HB3      ALA  39  -7.266   7.877  22.386

  No H/Q in entry =           5
  In of MODEL   70
    1    H    MET  40           H        MET  40  -5.653   9.184  19.071
    2    HA   MET  40           HA       MET  40  -7.154   7.273  17.608
    3    HB2  MET  40           HB2      MET  40  -5.511   9.647  16.706
    4    HB3  MET  40           HB3      MET  40  -6.549   8.702  15.635
    5    HG2  MET  40           HG2      MET  40  -7.569   9.963  18.193
    6    HG3  MET  40           HG3      MET  40  -7.614  10.800  16.643
    7    HE3  MET  40           HE1      MET  40 -10.217   9.217  14.576
    8    HE2  MET  40           HE2      MET  40  -8.463   9.310  14.429
    9    HE1  MET  40           HE3      MET  40  -9.363  10.687  15.063

  No H/Q in entry =           9
  In of MODEL   70
    1    H    MET  41           H        MET  41  -3.653   7.964  17.734
    2    HA   MET  41           HA       MET  41  -2.917   6.201  15.633
    3    HB2  MET  41           HB2      MET  41  -1.293   6.844  18.108
    4    HB3  MET  41           HB3      MET  41  -0.683   6.189  16.592
    5    HG2  MET  41           HG2      MET  41  -1.810   8.388  15.589
    6    HG3  MET  41           HG3      MET  41  -1.568   8.971  17.234
    7    HE2  MET  41           HE1      MET  41   1.322   6.835  17.596
    8    HE1  MET  41           HE2      MET  41   0.550   8.138  18.495
    9    HE3  MET  41           HE3      MET  41   2.177   8.360  17.854

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ASP  42           H        ASP  42  -3.311   5.730  19.118
    2    HA   ASP  42           HA       ASP  42  -2.309   3.123  19.278
    3    HB2  ASP  42           HB2      ASP  42  -3.161   4.892  21.100
    4    HB3  ASP  42           HB3      ASP  42  -4.601   3.885  21.026

  No H/Q in entry =           4
  In of MODEL   70
    1    H    GLN  43           H        GLN  43  -5.627   4.270  18.775
    2    HA   GLN  43           HA       GLN  43  -6.804   1.697  18.577
    3    HB2  GLN  43           HB2      GLN  43  -7.692   4.362  17.449
    4    HB3  GLN  43           HB3      GLN  43  -8.673   2.895  17.425
    5    HG2  GLN  43           HG2      GLN  43  -8.384   2.769  19.933
    6    HG3  GLN  43           HG3      GLN  43  -7.639   4.364  19.863
    7   HE21  GLN  43          HE21      GLN  43  -9.818   4.471  21.362
    8   HE22  GLN  43          HE22      GLN  43 -11.171   5.064  20.529

  No H/Q in entry =           8
  In of MODEL   70
    1    H    SER  44           H        SER  44  -5.433   3.896  16.168
    2    HA   SER  44           HA       SER  44  -6.151   2.422  13.877
    3    HB2  SER  44           HB2      SER  44  -4.864   4.790  14.324
    4    HB3  SER  44           HB3      SER  44  -3.523   3.777  13.795
    5    HG   SER  44           HG       SER  44  -4.621   4.764  12.031

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ARG  45           H        ARG  45  -3.277   2.271  15.960
    2    HA   ARG  45           HA       ARG  45  -1.820   0.299  14.578
    3    HB2  ARG  45           HB2      ARG  45  -0.962   1.708  16.449
    4    HB3  ARG  45           HB3      ARG  45  -1.967   0.789  17.567
    5    HG2  ARG  45           HG2      ARG  45  -0.761  -1.285  16.924
    6    HG3  ARG  45           HG3      ARG  45   0.268  -0.341  15.848
    7    HD2  ARG  45           HD2      ARG  45   1.018   1.028  17.806
    8    HD3  ARG  45           HD3      ARG  45   0.081  -0.036  18.877
    9    HE   ARG  45           HE       ARG  45   1.761  -1.652  17.297
   10   HH21  ARG  45          HH11      ARG  45   3.650  -2.500  18.136
   11   HH22  ARG  45          HH12      ARG  45   4.431  -1.725  19.468
   12   HH11  ARG  45          HH21      ARG  45   2.093   0.809  19.690
   13   HH12  ARG  45          HH22      ARG  45   3.550   0.151  20.346

  No H/Q in entry =          13
  In of MODEL   70
    1    H    MET  46           H        MET  46  -4.225   0.008  17.175
    2    HA   MET  46           HA       MET  46  -4.093  -2.794  17.480
    3    HB2  MET  46           HB2      MET  46  -6.232  -0.756  18.083
    4    HB3  MET  46           HB3      MET  46  -6.471  -2.475  18.413
    5    HG2  MET  46           HG2      MET  46  -4.486  -2.512  19.838
    6    HG3  MET  46           HG3      MET  46  -4.144  -0.831  19.454
    7    HE3  MET  46           HE1      MET  46  -7.931  -2.436  20.623
    8    HE2  MET  46           HE2      MET  46  -7.132  -2.777  22.154
    9    HE1  MET  46           HE3      MET  46  -6.437  -3.379  20.652

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ALA  47           H        ALA  47  -6.084  -0.749  15.385
    2    HA   ALA  47           HA       ALA  47  -7.728  -2.777  14.315
    3    HB3  ALA  47           HB1      ALA  47  -8.377  -0.530  13.900
    4    HB1  ALA  47           HB2      ALA  47  -7.895  -1.169  12.329
    5    HB2  ALA  47           HB3      ALA  47  -6.802  -0.116  13.228

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LEU  48           H        LEU  48  -4.591  -1.510  13.269
    2    HA   LEU  48           HA       LEU  48  -4.328  -3.101  10.927
    3    HB2  LEU  48           HB2      LEU  48  -2.256  -1.853  12.739
    4    HB3  LEU  48           HB3      LEU  48  -1.895  -2.577  11.172
    5    HG   LEU  48           HG       LEU  48  -3.888  -0.332  11.561
    6   HD13  LEU  48          HD11      LEU  48  -1.755   0.514  12.230
    7   HD12  LEU  48          HD12      LEU  48  -2.020   1.073  10.579
    8   HD11  LEU  48          HD13      LEU  48  -0.942  -0.289  10.887
    9   HD22  LEU  48          HD21      LEU  48  -4.370  -1.308   9.484
   10   HD21  LEU  48          HD22      LEU  48  -2.693  -1.766   9.190
   11   HD23  LEU  48          HD23      LEU  48  -3.189  -0.080   9.032

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ASN  49           H        ASN  49  -3.293  -3.516  14.274
    2    HA   ASN  49           HA       ASN  49  -1.722  -5.802  13.943
    3    HB2  ASN  49           HB2      ASN  49  -1.712  -4.489  15.994
    4    HB3  ASN  49           HB3      ASN  49  -3.391  -4.902  16.308
    5   HD21  ASN  49          HD21      ASN  49  -0.162  -6.405  15.943
    6   HD22  ASN  49          HD22      ASN  49  -0.484  -7.708  16.980

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLU  50           H        GLU  50  -5.187  -5.477  14.610
    2    HA   GLU  50           HA       GLU  50  -5.741  -8.268  14.715
    3    HB2  GLU  50           HB2      GLU  50  -7.303  -6.559  15.591
    4    HB3  GLU  50           HB3      GLU  50  -7.586  -5.989  13.944
    5    HG2  GLU  50           HG2      GLU  50  -8.482  -8.171  13.303
    6    HG3  GLU  50           HG3      GLU  50  -8.113  -8.822  14.896

  No H/Q in entry =           6
  In of MODEL   70
    1    H    ALA  51           H        ALA  51  -5.770  -5.867  12.122
    2    HA   ALA  51           HA       ALA  51  -6.778  -7.577  10.096
    3    HB2  ALA  51           HB1      ALA  51  -6.529  -5.767   8.730
    4    HB1  ALA  51           HB2      ALA  51  -4.885  -5.443   9.281
    5    HB3  ALA  51           HB3      ALA  51  -6.262  -4.912  10.248

  No H/Q in entry =           5
  In of MODEL   70
    1    H    HIS  52           H        HIS  52  -3.475  -6.722  11.086
    2    HA   HIS  52           HA       HIS  52  -2.097  -8.230   9.137
    3    HB2  HIS  52           HB2      HIS  52  -1.047  -6.511  10.590
    4    HB3  HIS  52           HB3      HIS  52  -1.220  -7.600  11.966
    5    HD1  HIS  52           HD1      HIS  52   0.272  -9.740  12.001
    6    HD2  HIS  52           HD2      HIS  52   1.010  -7.218   8.765
    7    HE1  HIS  52           HE1      HIS  52   2.446 -10.521  10.965
    8    HE2  HIS  52           HE2      HIS  52   2.910  -8.994   8.991

  No H/Q in entry =           8
  In of MODEL   70
    1    H    LEU  53           H        LEU  53  -3.327  -9.092  12.346
    2    HA   LEU  53           HA       LEU  53  -2.170 -11.655  12.539
    3    HB2  LEU  53           HB2      LEU  53  -4.640 -10.439  13.750
    4    HB3  LEU  53           HB3      LEU  53  -4.204 -12.120  14.043
    5    HG   LEU  53           HG       LEU  53  -2.280  -9.821  14.525
    6   HD12  LEU  53          HD11      LEU  53  -2.874 -10.236  16.966
    7   HD11  LEU  53          HD12      LEU  53  -4.267 -11.144  16.382
    8   HD13  LEU  53          HD13      LEU  53  -4.116  -9.430  16.015
    9   HD22  LEU  53          HD21      LEU  53  -1.000 -11.794  14.500
   10   HD21  LEU  53          HD22      LEU  53  -2.316 -12.769  15.144
   11   HD23  LEU  53          HD23      LEU  53  -1.430 -11.690  16.205

  No H/Q in entry =          11
  In of MODEL   70
    1    H    VAL  54           H        VAL  54  -5.262 -10.574  11.173
    2    HA   VAL  54           HA       VAL  54  -6.217 -13.152  10.481
    3    HB   VAL  54           HB       VAL  54  -6.818 -10.408   9.349
    4   HG12  VAL  54          HG11      VAL  54  -8.941 -11.750   8.533
    5   HG11  VAL  54          HG12      VAL  54  -7.851 -13.134   8.605
    6   HG13  VAL  54          HG13      VAL  54  -7.468 -11.764   7.565
    7   HG22  VAL  54          HG21      VAL  54  -7.728 -10.434  11.499
    8   HG21  VAL  54          HG22      VAL  54  -8.011 -12.173  11.478
    9   HG23  VAL  54          HG23      VAL  54  -9.073 -11.097  10.571

  No H/Q in entry =           9
  In of MODEL   70
    1    H    GLN  55           H        GLN  55  -4.303 -10.730   8.698
    2    HA   GLN  55           HA       GLN  55  -4.193 -12.194   6.279
    3    HB2  GLN  55           HB2      GLN  55  -3.551  -9.939   6.093
    4    HB3  GLN  55           HB3      GLN  55  -2.444 -10.036   7.460
    5    HG2  GLN  55           HG2      GLN  55  -0.739 -10.909   6.185
    6    HG3  GLN  55           HG3      GLN  55  -1.827 -11.865   5.188
    7   HE21  GLN  55          HE21      GLN  55  -1.829 -11.172   3.068
    8   HE22  GLN  55          HE22      GLN  55  -1.604  -9.570   2.560

  No H/Q in entry =           8
  In of MODEL   70
    1    H    THR  56           H        THR  56  -2.092 -12.211   9.163
    2    HA   THR  56           HA       THR  56  -0.039 -13.844   8.247
    3    HB   THR  56           HB       THR  56  -1.290 -14.075  10.993
    4    HG1  THR  56           HG1      THR  56   0.013 -12.013   9.740
    5   HG23  THR  56          HG21      THR  56   0.906 -14.737  11.697
    6   HG22  THR  56          HG22      THR  56   1.599 -14.312  10.131
    7   HG21  THR  56          HG23      THR  56   0.517 -15.698  10.272

  No H/Q in entry =           7
  In of MODEL   70
    1    H    LYS  57           H        LYS  57  -3.178 -14.829   9.604
    2    HA   LYS  57           HA       LYS  57  -2.780 -17.631   9.356
    3    HB2  LYS  57           HB2      LYS  57  -4.581 -16.515  10.701
    4    HB3  LYS  57           HB3      LYS  57  -5.362 -16.045   9.198
    5    HG2  LYS  57           HG2      LYS  57  -5.659 -18.393   8.579
    6    HG3  LYS  57           HG3      LYS  57  -4.814 -18.905  10.037
    7    HD2  LYS  57           HD2      LYS  57  -6.570 -17.845  11.424
    8    HD3  LYS  57           HD3      LYS  57  -7.427 -17.359   9.962
    9    HE2  LYS  57           HE2      LYS  57  -8.505 -19.370  10.599
   10    HE3  LYS  57           HE3      LYS  57  -7.382 -19.895   9.345
   11    HZ3  LYS  57           HZ1      LYS  57  -6.065 -20.944  10.830
   12    HZ2  LYS  57           HZ2      LYS  57  -7.523 -21.058  11.694
   13    HZ1  LYS  57           HZ3      LYS  57  -6.394 -19.851  12.087

  No H/Q in entry =          13
  In of MODEL   70
    1    H    LEU  58           H        LEU  58  -4.066 -15.164   7.181
    2    HA   LEU  58           HA       LEU  58  -4.896 -16.973   5.171
    3    HB2  LEU  58           HB2      LEU  58  -4.238 -14.035   5.040
    4    HB3  LEU  58           HB3      LEU  58  -4.916 -14.959   3.698
    5    HG   LEU  58           HG       LEU  58  -6.197 -14.760   6.444
    6   HD11  LEU  58          HD11      LEU  58  -6.464 -13.106   3.953
    7   HD13  LEU  58          HD12      LEU  58  -6.448 -12.600   5.643
    8   HD12  LEU  58          HD13      LEU  58  -7.884 -13.368   4.968
    9   HD22  LEU  58          HD21      LEU  58  -7.191 -16.652   5.570
   10   HD21  LEU  58          HD22      LEU  58  -6.841 -16.204   3.901
   11   HD23  LEU  58          HD23      LEU  58  -8.193 -15.455   4.750

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  59           H        ILE  59  -1.741 -15.817   6.039
    2    HA   ILE  59           HA       ILE  59  -0.652 -16.561   3.403
    3    HB   ILE  59           HB       ILE  59   0.149 -14.511   4.980
    4   HG12  ILE  59          HG12      ILE  59   2.221 -16.183   3.547
    5   HG13  ILE  59          HG13      ILE  59   1.031 -15.241   2.687
    6   HG22  ILE  59          HG21      ILE  59   2.192 -16.609   5.671
    7   HG21  ILE  59          HG22      ILE  59   0.852 -16.289   6.749
    8   HG23  ILE  59          HG23      ILE  59   2.003 -15.013   6.358
    9   HD11  ILE  59          HD11      ILE  59   2.848 -14.066   4.784
   10   HD13  ILE  59          HD12      ILE  59   1.812 -13.185   3.664
   11   HD12  ILE  59          HD13      ILE  59   3.226 -14.050   3.062

  No H/Q in entry =          11
  In of MODEL   70
    1    H    GLU  60           H        GLU  60  -0.688 -17.670   6.770
    2    HA   GLU  60           HA       GLU  60   1.309 -19.682   6.507
    3    HB2  GLU  60           HB2      GLU  60   0.667 -18.992   8.710
    4    HB3  GLU  60           HB3      GLU  60  -1.027 -19.370   8.401
    5    HG2  GLU  60           HG2      GLU  60  -0.051 -21.156   9.744
    6    HG3  GLU  60           HG3      GLU  60  -0.389 -21.777   8.130

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLY  61           H        GLY  61  -2.202 -19.719   6.014
    2    HA3  GLY  61           HA2      GLY  61  -2.000 -22.515   5.054
    3    HA2  GLY  61           HA3      GLY  61  -3.474 -21.754   5.645

  No H/Q in entry =           3
  In of MODEL   70
    1    H    ASP  62           H        ASP  62  -1.215 -20.206   3.450
    2    HA   ASP  62           HA       ASP  62  -3.309 -19.702   1.541
    3    HB2  ASP  62           HB2      ASP  62  -1.462 -18.556   0.296
    4    HB3  ASP  62           HB3      ASP  62  -1.666 -17.988   1.950

  No H/Q in entry =           4
  In of MODEL   70
    1    H    ALA  63           H        ALA  63  -1.483 -22.436   2.037
    2    HA   ALA  63           HA       ALA  63  -0.602 -23.157  -0.560
    3    HB1  ALA  63           HB1      ALA  63  -1.602 -25.059   1.550
    4    HB2  ALA  63           HB2      ALA  63  -0.008 -24.306   1.594
    5    HB3  ALA  63           HB3      ALA  63  -0.436 -25.384   0.265

  No H/Q in entry =           5
  In of MODEL   70
    1    H    GLY  64           H        GLY  64  -3.681 -23.529   1.130
    2    HA3  GLY  64           HA2      GLY  64  -5.761 -24.220   0.445
    3    HA2  GLY  64           HA3      GLY  64  -5.365 -23.391  -1.051

  No H/Q in entry =           3
  In of MODEL   70
    1    H    GLU  65           H        GLU  65  -5.379 -24.616  -2.857
    2    HA   GLU  65           HA       GLU  65  -6.055 -27.320  -2.818
    3    HB2  GLU  65           HB2      GLU  65  -4.758 -25.703  -5.011
    4    HB3  GLU  65           HB3      GLU  65  -5.437 -27.316  -5.229
    5    HG2  GLU  65           HG2      GLU  65  -6.983 -24.931  -4.177
    6    HG3  GLU  65           HG3      GLU  65  -7.046 -25.507  -5.841

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLY  66           H        GLY  66  -4.630 -28.757  -4.444
    2    HA3  GLY  66           HA2      GLY  66  -2.547 -29.851  -2.898
    3    HA2  GLY  66           HA3      GLY  66  -2.956 -30.294  -4.544

  No H/Q in entry =           3
  In of MODEL   70
    1    H    LYS  67           H        LYS  67  -2.495 -27.719  -5.684
    2    HA   LYS  67           HA       LYS  67   0.316 -27.942  -6.142
    3    HB2  LYS  67           HB2      LYS  67  -1.792 -26.068  -7.204
    4    HB3  LYS  67           HB3      LYS  67  -0.109 -26.058  -7.746
    5    HG2  LYS  67           HG2      LYS  67  -0.279 -28.440  -8.355
    6    HG3  LYS  67           HG3      LYS  67  -1.954 -28.466  -7.807
    7    HD2  LYS  67           HD2      LYS  67  -2.544 -26.788  -9.516
    8    HD3  LYS  67           HD3      LYS  67  -0.867 -26.762 -10.066
    9    HE2  LYS  67           HE2      LYS  67  -1.001 -29.165 -10.611
   10    HE3  LYS  67           HE3      LYS  67  -2.675 -29.198 -10.059
   11    HZ2  LYS  67           HZ1      LYS  67  -2.044 -28.817 -12.575
   12    HZ1  LYS  67           HZ2      LYS  67  -1.954 -27.200 -12.063
   13    HZ3  LYS  67           HZ3      LYS  67  -3.397 -28.076 -11.872

  No H/Q in entry =          13
  In of MODEL   70
    1    H    MET  68           H        MET  68   1.775 -26.130  -6.241
    2    HA   MET  68           HA       MET  68   2.238 -24.985  -3.723
    3    HB2  MET  68           HB2      MET  68   3.406 -24.402  -6.441
    4    HB3  MET  68           HB3      MET  68   4.024 -23.707  -4.941
    5    HG2  MET  68           HG2      MET  68   4.404 -25.970  -4.041
    6    HG3  MET  68           HG3      MET  68   3.781 -26.672  -5.535
    7    HE2  MET  68           HE1      MET  68   6.328 -27.941  -6.556
    8    HE1  MET  68           HE2      MET  68   5.838 -27.858  -4.865
    9    HE3  MET  68           HE3      MET  68   7.485 -27.430  -5.320

  No H/Q in entry =           9
  In of MODEL   70
    1    H    LYS  69           H        LYS  69   0.848 -23.540  -6.658
    2    HA   LYS  69           HA       LYS  69   0.940 -20.899  -6.206
    3    HB2  LYS  69           HB2      LYS  69  -0.187 -21.915  -8.124
    4    HB3  LYS  69           HB3      LYS  69  -1.572 -22.297  -7.095
    5    HG2  LYS  69           HG2      LYS  69  -1.901 -19.935  -6.589
    6    HG3  LYS  69           HG3      LYS  69  -0.460 -19.509  -7.511
    7    HD2  LYS  69           HD2      LYS  69  -1.511 -20.397  -9.562
    8    HD3  LYS  69           HD3      LYS  69  -2.959 -20.806  -8.637
    9    HE2  LYS  69           HE2      LYS  69  -3.270 -18.436  -8.050
   10    HE3  LYS  69           HE3      LYS  69  -1.808 -18.016  -8.941
   11    HZ1  LYS  69           HZ1      LYS  69  -2.995 -19.202 -10.877
   12    HZ3  LYS  69           HZ2      LYS  69  -3.460 -17.619 -10.470
   13    HZ2  LYS  69           HZ3      LYS  69  -4.405 -18.940  -9.972

  No H/Q in entry =          13
  In of MODEL   70
    1    H    VAL  70           H        VAL  70  -0.270 -19.242  -5.251
    2    HA   VAL  70           HA       VAL  70  -1.809 -20.041  -2.841
    3    HB   VAL  70           HB       VAL  70  -1.011 -17.907  -1.843
    4   HG13  VAL  70          HG11      VAL  70   1.078 -18.748  -1.202
    5   HG12  VAL  70          HG12      VAL  70   1.423 -19.380  -2.813
    6   HG11  VAL  70          HG13      VAL  70   0.253 -20.198  -1.778
    7   HG21  VAL  70          HG21      VAL  70   0.377 -17.678  -4.523
    8   HG23  VAL  70          HG22      VAL  70   1.043 -16.887  -3.096
    9   HG22  VAL  70          HG23      VAL  70  -0.567 -16.458  -3.665

  No H/Q in entry =           9
  In of MODEL   70
    1    H    SER  71           H        SER  71  -3.338 -18.322  -2.123
    2    HA   SER  71           HA       SER  71  -5.223 -17.678  -4.123
    3    HB2  SER  71           HB2      SER  71  -5.744 -17.885  -1.671
    4    HB3  SER  71           HB3      SER  71  -4.894 -16.368  -1.399
    5    HG   SER  71           HG       SER  71  -7.363 -16.864  -2.547

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LEU  72           H        LEU  72  -5.398 -16.014  -5.451
    2    HA   LEU  72           HA       LEU  72  -3.260 -14.236  -5.928
    3    HB2  LEU  72           HB2      LEU  72  -6.125 -14.239  -6.876
    4    HB3  LEU  72           HB3      LEU  72  -4.906 -13.105  -7.451
    5    HG   LEU  72           HG       LEU  72  -4.563 -16.119  -7.584
    6   HD11  LEU  72          HD11      LEU  72  -6.510 -15.285  -8.942
    7   HD13  LEU  72          HD12      LEU  72  -5.215 -15.979  -9.917
    8   HD12  LEU  72          HD13      LEU  72  -5.392 -14.228  -9.804
    9   HD23  LEU  72          HD21      LEU  72  -2.968 -15.286  -9.487
   10   HD22  LEU  72          HD22      LEU  72  -2.410 -15.151  -7.828
   11   HD21  LEU  72          HD23      LEU  72  -3.049 -13.736  -8.658

  No H/Q in entry =          11
  In of MODEL   70
    1    H    VAL  73           H        VAL  73  -6.349 -13.831  -4.300
    2    HA   VAL  73           HA       VAL  73  -6.349 -11.060  -3.945
    3    HB   VAL  73           HB       VAL  73  -8.073 -11.393  -2.365
    4   HG13  VAL  73          HG11      VAL  73  -9.555 -12.775  -3.576
    5   HG12  VAL  73          HG12      VAL  73  -8.267 -13.873  -4.068
    6   HG11  VAL  73          HG13      VAL  73  -8.374 -12.264  -4.783
    7   HG21  VAL  73          HG21      VAL  73  -6.671 -14.010  -1.912
    8   HG23  VAL  73          HG22      VAL  73  -8.396 -13.889  -1.566
    9   HG22  VAL  73          HG23      VAL  73  -7.253 -12.840  -0.728

  No H/Q in entry =           9
  In of MODEL   70
    1    H    LEU  74           H        LEU  74  -4.451 -13.462  -2.363
    2    HA   LEU  74           HA       LEU  74  -4.023 -12.333   0.162
    3    HB2  LEU  74           HB2      LEU  74  -3.275 -14.563  -0.340
    4    HB3  LEU  74           HB3      LEU  74  -2.211 -13.966  -1.613
    5    HG   LEU  74           HG       LEU  74  -0.880 -12.742   0.068
    6   HD12  LEU  74          HD11      LEU  74  -1.383 -13.433   2.510
    7   HD11  LEU  74          HD12      LEU  74  -2.985 -13.873   1.915
    8   HD13  LEU  74          HD13      LEU  74  -2.425 -12.206   1.787
    9   HD23  LEU  74          HD21      LEU  74  -1.140 -15.476   1.197
   10   HD22  LEU  74          HD22      LEU  74   0.279 -14.595   0.673
   11   HD21  LEU  74          HD23      LEU  74  -0.766 -15.335  -0.519

  No H/Q in entry =          11
  In of MODEL   70
    1    H    VAL  75           H        VAL  75  -2.124 -11.965  -2.794
    2    HA   VAL  75           HA       VAL  75  -0.296 -10.072  -1.779
    3    HB   VAL  75           HB       VAL  75  -1.258 -10.528  -4.605
    4   HG11  VAL  75          HG11      VAL  75   1.046  -8.856  -3.508
    5   HG13  VAL  75          HG12      VAL  75  -0.347  -8.263  -4.402
    6   HG12  VAL  75          HG13      VAL  75   0.842  -9.276  -5.205
    7   HG21  VAL  75          HG21      VAL  75   1.191 -11.406  -3.034
    8   HG23  VAL  75          HG22      VAL  75   0.972 -11.664  -4.765
    9   HG22  VAL  75          HG23      VAL  75  -0.109 -12.449  -3.612

  No H/Q in entry =           9
  In of MODEL   70
    1    H    GLU  76           H        GLU  76  -3.440  -9.670  -3.438
    2    HA   GLU  76           HA       GLU  76  -3.446  -6.855  -3.534
    3    HB2  GLU  76           HB2      GLU  76  -5.124  -8.303  -4.687
    4    HB3  GLU  76           HB3      GLU  76  -5.808  -8.727  -3.125
    5    HG2  GLU  76           HG2      GLU  76  -6.434  -6.389  -2.726
    6    HG3  GLU  76           HG3      GLU  76  -5.709  -5.898  -4.244

  No H/Q in entry =           6
  In of MODEL   70
    1    H    ALA  77           H        ALA  77  -4.594  -9.069  -0.999
    2    HA   ALA  77           HA       ALA  77  -5.519  -7.055   0.763
    3    HB1  ALA  77           HB1      ALA  77  -4.559  -9.878   1.258
    4    HB3  ALA  77           HB2      ALA  77  -6.223  -9.309   1.146
    5    HB2  ALA  77           HB3      ALA  77  -5.227  -8.851   2.526

  No H/Q in entry =           5
  In of MODEL   70
    1    H    GLN  78           H        GLN  78  -2.397  -8.656   0.397
    2    HA   GLN  78           HA       GLN  78  -1.121  -7.520   2.650
    3    HB2  GLN  78           HB2      GLN  78  -0.292  -9.473   1.290
    4    HB3  GLN  78           HB3      GLN  78   0.165  -8.331   0.029
    5    HG2  GLN  78           HG2      GLN  78   1.646  -7.167   1.611
    6    HG3  GLN  78           HG3      GLN  78   1.187  -8.297   2.882
    7   HE21  GLN  78          HE21      GLN  78   3.917  -8.072   2.038
    8   HE22  GLN  78          HE22      GLN  78   4.353  -9.516   1.258

  No H/Q in entry =           8
  In of MODEL   70
    1    H    LEU  79           H        LEU  79  -1.468  -6.447  -0.695
    2    HA   LEU  79           HA       LEU  79   0.255  -4.249  -0.676
    3    HB2  LEU  79           HB2      LEU  79  -0.784  -5.035  -2.732
    4    HB3  LEU  79           HB3      LEU  79  -2.381  -4.617  -2.124
    5    HG   LEU  79           HG       LEU  79  -1.796  -2.239  -2.094
    6   HD13  LEU  79          HD11      LEU  79   0.448  -2.035  -1.579
    7   HD12  LEU  79          HD12      LEU  79   0.503  -1.745  -3.318
    8   HD11  LEU  79          HD13      LEU  79   0.930  -3.332  -2.674
    9   HD23  LEU  79          HD21      LEU  79  -1.157  -2.047  -4.645
   10   HD22  LEU  79          HD22      LEU  79  -2.696  -2.769  -4.188
   11   HD21  LEU  79          HD23      LEU  79  -1.341  -3.801  -4.634

  No H/Q in entry =          11
  In of MODEL   70
    1    H    HIS  80           H        HIS  80  -3.214  -4.353   0.148
    2    HA   HIS  80           HA       HIS  80  -3.358  -1.595   0.816
    3    HB2  HIS  80           HB2      HIS  80  -5.101  -3.975   1.130
    4    HB3  HIS  80           HB3      HIS  80  -5.399  -2.631   2.236
    5    HD1  HIS  80           HD1      HIS  80  -6.987  -0.965   1.331
    6    HD2  HIS  80           HD2      HIS  80  -4.825  -2.809  -1.719
    7    HE1  HIS  80           HE1      HIS  80  -7.808   0.051  -0.847
    8    HE2  HIS  80           HE2      HIS  80  -6.496  -1.068  -2.715

  No H/Q in entry =           8
  In of MODEL   70
    1    H    LEU  81           H        LEU  81  -2.921  -4.502   2.804
    2    HA   LEU  81           HA       LEU  81  -2.886  -3.160   5.291
    3    HB2  LEU  81           HB2      LEU  81  -1.714  -5.796   4.407
    4    HB3  LEU  81           HB3      LEU  81  -1.679  -5.241   6.082
    5    HG   LEU  81           HG       LEU  81  -4.228  -5.445   4.452
    6   HD12  LEU  81          HD11      LEU  81  -4.568  -7.507   5.996
    7   HD11  LEU  81          HD12      LEU  81  -2.815  -7.468   6.183
    8   HD13  LEU  81          HD13      LEU  81  -3.527  -7.683   4.583
    9   HD23  LEU  81          HD21      LEU  81  -5.076  -5.637   6.953
   10   HD22  LEU  81          HD22      LEU  81  -4.722  -4.053   6.266
   11   HD21  LEU  81          HD23      LEU  81  -3.550  -4.836   7.325

  No H/Q in entry =          11
  In of MODEL   70
    1    H    MET  82           H        MET  82  -0.220  -4.107   3.120
    2    HA   MET  82           HA       MET  82   1.877  -3.254   4.806
    3    HB2  MET  82           HB2      MET  82   1.658  -3.586   1.813
    4    HB3  MET  82           HB3      MET  82   3.150  -3.043   2.578
    5    HG2  MET  82           HG2      MET  82   1.696  -5.608   3.297
    6    HG3  MET  82           HG3      MET  82   3.069  -5.522   2.198
    7    HE3  MET  82           HE1      MET  82   6.097  -4.844   4.185
    8    HE2  MET  82           HE2      MET  82   5.199  -3.459   3.568
    9    HE1  MET  82           HE3      MET  82   5.261  -4.949   2.630

  No H/Q in entry =           9
  In of MODEL   70
    1    H    THR  83           H        THR  83   0.087  -1.574   2.252
    2    HA   THR  83           HA       THR  83   1.544   0.848   2.343
    3    HB   THR  83           HB       THR  83  -0.615   1.814   1.358
    4    HG1  THR  83           HG1      THR  83  -2.289   0.548   1.248
    5   HG22  THR  83          HG21      THR  83  -0.377  -0.005  -0.646
    6   HG21  THR  83          HG22      THR  83   1.117  -0.326   0.231
    7   HG23  THR  83          HG23      THR  83   0.786   1.294  -0.382

  No H/Q in entry =           7
  In of MODEL   70
    1    H    SER  84           H        SER  84  -1.482  -0.132   3.941
    2    HA   SER  84           HA       SER  84  -1.933   2.305   5.290
    3    HB2  SER  84           HB2      SER  84  -2.819  -0.518   5.849
    4    HB3  SER  84           HB3      SER  84  -3.288   0.830   6.884
    5    HG   SER  84           HG       SER  84  -3.751   0.529   4.091

  No H/Q in entry =           5
  In of MODEL   70
    1    H    MET  85           H        MET  85  -0.279  -0.661   6.415
    2    HA   MET  85           HA       MET  85   0.257   0.252   9.021
    3    HB2  MET  85           HB2      MET  85   0.506  -2.096   8.336
    4    HB3  MET  85           HB3      MET  85   1.900  -1.655   7.348
    5    HG2  MET  85           HG2      MET  85   3.081  -0.849   9.355
    6    HG3  MET  85           HG3      MET  85   1.680  -1.253  10.347
    7    HE1  MET  85           HE1      MET  85   0.618  -3.426  10.503
    8    HE3  MET  85           HE2      MET  85   1.828  -3.498  11.782
    9    HE2  MET  85           HE3      MET  85   1.556  -4.902  10.756

  No H/Q in entry =           9
  In of MODEL   70
    1    H    LEU  86           H        LEU  86   2.197   0.476   6.071
    2    HA   LEU  86           HA       LEU  86   4.436   1.742   7.229
    3    HB2  LEU  86           HB2      LEU  86   4.224   0.667   4.919
    4    HB3  LEU  86           HB3      LEU  86   3.445   2.165   4.408
    5    HG   LEU  86           HG       LEU  86   5.496   3.371   5.391
    6   HD11  LEU  86          HD11      LEU  86   6.151   0.745   6.187
    7   HD13  LEU  86          HD12      LEU  86   7.182   2.170   6.287
    8   HD12  LEU  86          HD13      LEU  86   7.272   1.123   4.874
    9   HD23  LEU  86          HD21      LEU  86   6.180   1.598   3.038
   10   HD22  LEU  86          HD22      LEU  86   6.606   3.287   3.303
   11   HD21  LEU  86          HD23      LEU  86   4.944   2.851   2.903

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ALA  87           H        ALA  87   1.548   3.044   5.646
    2    HA   ALA  87           HA       ALA  87   2.194   5.762   5.734
    3    HB1  ALA  87           HB1      ALA  87  -0.146   4.179   5.190
    4    HB3  ALA  87           HB2      ALA  87   0.197   5.834   4.692
    5    HB2  ALA  87           HB3      ALA  87  -0.603   5.526   6.235

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ARG  88           H        ARG  88   0.466   3.789   8.121
    2    HA   ARG  88           HA       ARG  88  -0.008   5.845   9.970
    3    HB2  ARG  88           HB2      ARG  88  -0.991   3.511  10.033
    4    HB3  ARG  88           HB3      ARG  88   0.540   2.980  10.739
    5    HG2  ARG  88           HG2      ARG  88   0.103   5.061  12.361
    6    HG3  ARG  88           HG3      ARG  88  -1.570   4.769  11.904
    7    HD2  ARG  88           HD2      ARG  88  -1.713   2.920  13.148
    8    HD3  ARG  88           HD3      ARG  88  -0.134   2.309  12.617
    9    HE   ARG  88           HE       ARG  88  -0.645   3.578  15.072
   10   HH21  ARG  88          HH11      ARG  88   0.932   4.559  16.313
   11   HH22  ARG  88          HH12      ARG  88   2.459   4.958  15.609
   12   HH11  ARG  88          HH21      ARG  88   1.639   3.720  12.496
   13   HH12  ARG  88          HH22      ARG  88   2.868   4.466  13.460

  No H/Q in entry =          13
  In of MODEL   70
    1    H    GLU  89           H        GLU  89   2.746   3.574   9.745
    2    HA   GLU  89           HA       GLU  89   4.024   4.436  12.090
    3    HB2  GLU  89           HB2      GLU  89   4.645   2.407  10.744
    4    HB3  GLU  89           HB3      GLU  89   5.441   3.488   9.599
    5    HG2  GLU  89           HG2      GLU  89   6.941   4.304  11.345
    6    HG3  GLU  89           HG3      GLU  89   6.088   3.362  12.563

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LEU  90           H        LEU  90   4.363   5.592   8.764
    2    HA   LEU  90           HA       LEU  90   6.330   7.555   9.353
    3    HB2  LEU  90           HB2      LEU  90   4.319   7.264   7.124
    4    HB3  LEU  90           HB3      LEU  90   5.573   8.512   7.148
    5    HG   LEU  90           HG       LEU  90   6.192   5.563   7.478
    6   HD12  LEU  90          HD11      LEU  90   6.946   5.786   5.039
    7   HD11  LEU  90          HD12      LEU  90   5.957   7.245   4.992
    8   HD13  LEU  90          HD13      LEU  90   5.209   5.685   5.333
    9   HD22  LEU  90          HD21      LEU  90   8.110   6.677   8.162
   10   HD21  LEU  90          HD22      LEU  90   7.786   8.089   7.157
   11   HD23  LEU  90          HD23      LEU  90   8.420   6.613   6.428

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  91           H        ILE  91   2.792   7.636   9.203
    2    HA   ILE  91           HA       ILE  91   2.500  10.413   9.657
    3    HB   ILE  91           HB       ILE  91   0.666   8.070  10.196
    4   HG12  ILE  91          HG12      ILE  91   0.460  10.358   8.214
    5   HG13  ILE  91          HG13      ILE  91   1.293   8.849   7.840
    6   HG22  ILE  91          HG21      ILE  91  -1.029  10.159  10.261
    7   HG21  ILE  91          HG22      ILE  91   0.387  10.963  10.936
    8   HG23  ILE  91          HG23      ILE  91  -0.276   9.536  11.730
    9   HD13  ILE  91          HD11      ILE  91  -0.674   7.596   7.882
   10   HD12  ILE  91          HD12      ILE  91  -1.236   9.122   7.202
   11   HD11  ILE  91          HD13      ILE  91  -1.514   8.761   8.906

  No H/Q in entry =          11
  In of MODEL   70
    1    H    THR  92           H        THR  92   2.853   7.662  11.855
    2    HA   THR  92           HA       THR  92   2.433   9.040  14.280
    3    HB   THR  92           HB       THR  92   4.200   6.675  13.614
    4    HG1  THR  92           HG1      THR  92   2.219   5.953  13.511
    5   HG22  THR  92          HG21      THR  92   3.811   6.394  16.247
    6   HG21  THR  92          HG22      THR  92   3.777   8.155  16.175
    7   HG23  THR  92          HG23      THR  92   5.195   7.275  15.602

  No H/Q in entry =           7
  In of MODEL   70
    1    H    GLU  93           H        GLU  93   5.377   8.543  12.348
    2    HA   GLU  93           HA       GLU  93   7.154   9.937  14.048
    3    HB2  GLU  93           HB2      GLU  93   7.239   9.624  11.032
    4    HB3  GLU  93           HB3      GLU  93   8.588  10.130  12.048
    5    HG2  GLU  93           HG2      GLU  93   7.133   7.518  12.492
    6    HG3  GLU  93           HG3      GLU  93   8.519   7.647  11.417

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LEU  94           H        LEU  94   5.125  10.990  11.335
    2    HA   LEU  94           HA       LEU  94   5.976  13.680  11.238
    3    HB2  LEU  94           HB2      LEU  94   3.363  12.359  10.481
    4    HB3  LEU  94           HB3      LEU  94   3.651  14.082  10.241
    5    HG   LEU  94           HG       LEU  94   5.635  12.062   9.190
    6   HD11  LEU  94          HD11      LEU  94   2.904  12.660   8.127
    7   HD13  LEU  94          HD12      LEU  94   3.862  11.187   8.000
    8   HD12  LEU  94          HD13      LEU  94   4.221  12.563   6.957
    9   HD23  LEU  94          HD21      LEU  94   5.917  13.896   7.470
   10   HD22  LEU  94          HD22      LEU  94   6.339  14.380   9.113
   11   HD21  LEU  94          HD23      LEU  94   4.796  14.874   8.413

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  95           H        ILE  95   3.410  12.103  13.125
    2    HA   ILE  95           HA       ILE  95   2.405  14.469  14.322
    3    HB   ILE  95           HB       ILE  95   2.374  11.586  15.244
    4   HG12  ILE  95          HG12      ILE  95   0.184  13.397  14.195
    5   HG13  ILE  95          HG13      ILE  95   1.123  12.323  13.162
    6   HG21  ILE  95          HG21      ILE  95   1.131  14.078  16.447
    7   HG23  ILE  95          HG22      ILE  95   2.160  12.892  17.251
    8   HG22  ILE  95          HG23      ILE  95   0.518  12.458  16.774
    9   HD13  ILE  95          HD11      ILE  95   0.188  10.399  14.079
   10   HD12  ILE  95          HD12      ILE  95  -1.176  11.510  14.155
   11   HD11  ILE  95          HD13      ILE  95  -0.217  11.195  15.600

  No H/Q in entry =          11
  In of MODEL   70
    1    H    GLU  96           H        GLU  96   4.963  12.207  15.318
    2    HA   GLU  96           HA       GLU  96   5.535  13.395  17.811
    3    HB2  GLU  96           HB2      GLU  96   6.449  11.221  17.162
    4    HB3  GLU  96           HB3      GLU  96   7.396  11.981  15.884
    5    HG2  GLU  96           HG2      GLU  96   9.051  12.502  17.348
    6    HG3  GLU  96           HG3      GLU  96   7.917  13.332  18.403

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LEU  97           H        LEU  97   6.625  14.152  14.527
    2    HA   LEU  97           HA       LEU  97   8.541  16.118  15.242
    3    HB2  LEU  97           HB2      LEU  97   6.943  15.597  12.745
    4    HB3  LEU  97           HB3      LEU  97   7.985  17.012  12.869
    5    HG   LEU  97           HG       LEU  97   8.970  14.198  13.427
    6   HD12  LEU  97          HD11      LEU  97   9.971  14.378  11.111
    7   HD11  LEU  97          HD12      LEU  97   8.942  15.785  10.848
    8   HD13  LEU  97          HD13      LEU  97   8.218  14.204  11.141
    9   HD23  LEU  97          HD21      LEU  97  11.159  15.444  12.688
   10   HD22  LEU  97          HD22      LEU  97  10.543  15.721  14.316
   11   HD21  LEU  97          HD23      LEU  97  10.248  16.910  13.049

  No H/Q in entry =          11
  In of MODEL   70
    1    H    HIS  98           H        HIS  98   5.053  16.308  14.585
    2    HA   HIS  98           HA       HIS  98   4.796  19.112  14.722
    3    HB2  HIS  98           HB2      HIS  98   2.871  16.890  15.444
    4    HB3  HIS  98           HB3      HIS  98   2.430  18.597  15.501
    5    HD1  HIS  98           HD1      HIS  98   3.413  15.869  13.095
    6    HD2  HIS  98           HD2      HIS  98   2.097  19.823  12.975
    7    HE1  HIS  98           HE1      HIS  98   2.863  16.369  10.671
    8    HE2  HIS  98           HE2      HIS  98   2.065  18.770  10.577

  No H/Q in entry =           8
  In of MODEL   70
    1    H    GLU  99           H        GLU  99   4.889  16.619  17.219
    2    HA   GLU  99           HA       GLU  99   4.305  18.321  19.418
    3    HB2  GLU  99           HB2      GLU  99   4.178  15.840  19.513
    4    HB3  GLU  99           HB3      GLU  99   5.937  15.769  19.406
    5    HG2  GLU  99           HG2      GLU  99   6.144  17.056  21.482
    6    HG3  GLU  99           HG3      GLU  99   4.393  17.223  21.576

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LYS 100           H        LYS 100   7.346  17.345  17.855
    2    HA   LYS 100           HA       LYS 100   9.020  18.719  19.715
    3    HB2  LYS 100           HB2      LYS 100   9.507  17.789  16.876
    4    HB3  LYS 100           HB3      LYS 100  10.748  18.539  17.886
    5    HG2  LYS 100           HG2      LYS 100  10.343  16.793  19.625
    6    HG3  LYS 100           HG3      LYS 100   9.200  16.008  18.532
    7    HD2  LYS 100           HD2      LYS 100  10.991  15.699  16.866
    8    HD3  LYS 100           HD3      LYS 100  12.139  16.496  17.944
    9    HE2  LYS 100           HE2      LYS 100  11.715  14.746  19.660
   10    HE3  LYS 100           HE3      LYS 100  10.628  13.927  18.533
   11    HZ1  LYS 100           HZ1      LYS 100  13.459  14.555  17.881
   12    HZ3  LYS 100           HZ2      LYS 100  12.400  13.516  17.050
   13    HZ2  LYS 100           HZ3      LYS 100  12.981  13.087  18.589

  No H/Q in entry =          13
  In of MODEL   70
    1    H    LEU 101           H        LEU 101   7.343  19.674  16.759
    2    HA   LEU 101           HA       LEU 101   8.597  22.213  16.427
    3    HB2  LEU 101           HB2      LEU 101   5.984  21.020  15.537
    4    HB3  LEU 101           HB3      LEU 101   6.261  22.747  15.332
    5    HG   LEU 101           HG       LEU 101   8.267  20.701  14.366
    6   HD12  LEU 101          HD11      LEU 101   7.124  21.226  12.080
    7   HD11  LEU 101          HD12      LEU 101   5.730  21.677  13.060
    8   HD13  LEU 101          HD13      LEU 101   6.369  20.036  13.140
    9   HD21  LEU 101          HD21      LEU 101   7.684  23.623  13.812
   10   HD23  LEU 101          HD22      LEU 101   8.651  22.649  12.706
   11   HD22  LEU 101          HD23      LEU 101   9.195  22.897  14.364

  No H/Q in entry =          11
  In of MODEL   70
    1    H    LYS 102           H        LYS 102   7.040  21.096  19.040
    2    HA   LYS 102           HA       LYS 102   6.423  22.195  20.973
    3    HB2  LYS 102           HB2      LYS 102   7.737  24.166  19.852
    4    HB3  LYS 102           HB3      LYS 102   6.148  24.796  19.476
    5    HG2  LYS 102           HG2      LYS 102   7.519  24.516  22.129
    6    HG3  LYS 102           HG3      LYS 102   6.587  25.860  21.500
    7    HD2  LYS 102           HD2      LYS 102   5.302  23.242  22.375
    8    HD3  LYS 102           HD3      LYS 102   5.571  24.598  23.460
    9    HE2  LYS 102           HE2      LYS 102   3.287  24.232  21.969
   10    HE3  LYS 102           HE3      LYS 102   3.813  25.769  22.653
   11    HZ2  LYS 102           HZ1      LYS 102   3.286  25.888  20.273
   12    HZ1  LYS 102           HZ2      LYS 102   4.531  24.787  19.950
   13    HZ3  LYS 102           HZ3      LYS 102   4.897  26.311  20.595

  No H/Q in entry =          13
  In of MODEL   70
    1    H    ALA 103           H        ALA 103   4.812  23.766  18.206
    2    HA   ALA 103           HA       ALA 103   2.366  24.380  19.090
    3    HB1  ALA 103           HB1      ALA 103   1.456  23.555  16.846
    4    HB2  ALA 103           HB2      ALA 103   3.095  22.993  16.517
    5    HB3  ALA 103           HB3      ALA 103   2.787  24.709  16.785

  No H/Q in entry =           5
  In of MODEL   70
    1    H1   ALA   1           H3       ALA   1  10.287 -20.220  -6.229
    2    H2   ALA   1           H2       ALA   1   9.321 -20.409  -7.616
    3    H3   ALA   1           H1       ALA   1   8.870 -21.150  -6.154
    4    HA   ALA   1           HA       ALA   1   9.881 -22.975  -6.895
    5    HB1  ALA   1           HB1      ALA   1   9.984 -22.615  -9.170
    6    HB2  ALA   1           HB2      ALA   1  11.713 -22.493  -8.840
    7    HB3  ALA   1           HB3      ALA   1  10.738 -21.029  -8.990

  No H/Q in entry =           7
  In of MODEL   70
    1    H    GLU   2           H        GLU   2  12.149 -23.962  -6.953
    2    HA   GLU   2           HA       GLU   2  13.530 -23.906  -4.740
    3    HB2  GLU   2           HB2      GLU   2  14.890 -23.793  -7.438
    4    HB3  GLU   2           HB3      GLU   2  15.607 -24.418  -5.953
    5    HG2  GLU   2           HG2      GLU   2  14.557 -26.418  -6.197
    6    HG3  GLU   2           HG3      GLU   2  12.999 -25.646  -6.456

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLU   3           H        GLU   3  15.333 -22.068  -7.138
    2    HA   GLU   3           HA       GLU   3  16.513 -20.402  -5.176
    3    HB2  GLU   3           HB2      GLU   3  16.459 -20.396  -8.186
    4    HB3  GLU   3           HB3      GLU   3  17.226 -19.080  -7.297
    5    HG2  GLU   3           HG2      GLU   3  18.865 -20.483  -6.375
    6    HG3  GLU   3           HG3      GLU   3  17.895 -21.934  -6.598

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LEU   4           H        LEU   4  14.246 -19.514  -7.807
    2    HA   LEU   4           HA       LEU   4  13.823 -16.898  -7.192
    3    HB2  LEU   4           HB2      LEU   4  11.616 -18.836  -7.926
    4    HB3  LEU   4           HB3      LEU   4  11.570 -17.085  -8.122
    5    HG   LEU   4           HG       LEU   4  13.504 -18.979  -9.497
    6   HD13  LEU   4          HD11      LEU   4  12.206 -18.806 -11.407
    7   HD12  LEU   4          HD12      LEU   4  11.523 -17.251 -10.938
    8   HD11  LEU   4          HD13      LEU   4  10.945 -18.733 -10.179
    9   HD23  LEU   4          HD21      LEU   4  13.878 -16.738 -10.845
   10   HD22  LEU   4          HD22      LEU   4  14.733 -16.997  -9.326
   11   HD21  LEU   4          HD23      LEU   4  13.297 -15.977  -9.364

  No H/Q in entry =          11
  In of MODEL   70
    1    H    GLU   5           H        GLU   5  12.291 -19.659  -5.554
    2    HA   GLU   5           HA       GLU   5  10.640 -18.062  -3.850
    3    HB2  GLU   5           HB2      GLU   5  10.211 -20.453  -4.395
    4    HB3  GLU   5           HB3      GLU   5  11.601 -20.885  -3.398
    5    HG2  GLU   5           HG2      GLU   5   9.647 -21.082  -2.008
    6    HG3  GLU   5           HG3      GLU   5  10.515 -19.636  -1.495

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLU   6           H        GLU   6  13.759 -19.694  -3.408
    2    HA   GLU   6           HA       GLU   6  14.125 -18.847  -0.708
    3    HB2  GLU   6           HB2      GLU   6  15.312 -20.782  -1.760
    4    HB3  GLU   6           HB3      GLU   6  16.238 -19.633  -2.730
    5    HG2  GLU   6           HG2      GLU   6  17.600 -20.124  -0.831
    6    HG3  GLU   6           HG3      GLU   6  16.915 -18.528  -0.532

  No H/Q in entry =           6
  In of MODEL   70
    1    H    VAL   7           H        VAL   7  14.913 -17.529  -3.856
    2    HA   VAL   7           HA       VAL   7  16.633 -15.432  -2.988
    3    HB   VAL   7           HB       VAL   7  14.923 -15.764  -5.466
    4   HG11  VAL   7          HG11      VAL   7  16.852 -13.583  -4.651
    5   HG13  VAL   7          HG12      VAL   7  15.212 -13.413  -5.275
    6   HG12  VAL   7          HG13      VAL   7  16.513 -13.936  -6.345
    7   HG21  VAL   7          HG21      VAL   7  17.006 -17.256  -4.899
    8   HG23  VAL   7          HG22      VAL   7  17.934 -15.809  -5.295
    9   HG22  VAL   7          HG23      VAL   7  16.887 -16.540  -6.507

  No H/Q in entry =           9
  In of MODEL   70
    1    H    VAL   8           H        VAL   8  13.137 -15.644  -3.547
    2    HA   VAL   8           HA       VAL   8  12.515 -12.926  -3.072
    3    HB   VAL   8           HB       VAL   8  10.865 -15.432  -2.647
    4   HG11  VAL   8          HG11      VAL   8  10.185 -12.498  -2.417
    5   HG13  VAL   8          HG12      VAL   8   9.829 -13.798  -1.280
    6   HG12  VAL   8          HG13      VAL   8   8.952 -13.697  -2.805
    7   HG23  VAL   8          HG21      VAL   8  10.225 -13.499  -4.817
    8   HG22  VAL   8          HG22      VAL   8  10.263 -15.259  -4.856
    9   HG21  VAL   8          HG23      VAL   8  11.759 -14.345  -5.016

  No H/Q in entry =           9
  In of MODEL   70
    1    H    MET   9           H        MET   9  12.736 -15.739  -0.895
    2    HA   MET   9           HA       MET   9  11.940 -14.457   1.476
    3    HB2  MET   9           HB2      MET   9  13.784 -16.774   0.915
    4    HB3  MET   9           HB3      MET   9  13.551 -16.177   2.558
    5    HG2  MET   9           HG2      MET   9  11.017 -16.373   2.054
    6    HG3  MET   9           HG3      MET   9  11.512 -17.381   0.692
    7    HE2  MET   9           HE1      MET   9  14.005 -18.908   1.563
    8    HE1  MET   9           HE2      MET   9  12.584 -19.578   0.767
    9    HE3  MET   9           HE3      MET   9  13.256 -20.386   2.181

  No H/Q in entry =           9
  In of MODEL   70
    1    H    GLY  10           H        GLY  10  15.118 -14.729  -0.079
    2    HA3  GLY  10           HA2      GLY  10  16.597 -13.334   1.893
    3    HA2  GLY  10           HA3      GLY  10  17.059 -13.504   0.200

  No H/Q in entry =           3
  In of MODEL   70
    1    H    LEU  11           H        LEU  11  14.910 -12.248  -1.039
    2    HA   LEU  11           HA       LEU  11  15.636  -9.514  -0.872
    3    HB2  LEU  11           HB2      LEU  11  13.248 -10.887  -2.110
    4    HB3  LEU  11           HB3      LEU  11  13.555  -9.156  -2.267
    5    HG   LEU  11           HG       LEU  11  15.551 -11.294  -3.057
    6   HD13  LEU  11          HD11      LEU  11  13.801 -11.633  -4.578
    7   HD12  LEU  11          HD12      LEU  11  14.821 -10.466  -5.417
    8   HD11  LEU  11          HD13      LEU  11  13.356  -9.926  -4.598
    9   HD22  LEU  11          HD21      LEU  11  16.811  -9.350  -2.828
   10   HD21  LEU  11          HD22      LEU  11  15.452  -8.292  -3.206
   11   HD23  LEU  11          HD23      LEU  11  16.271  -9.171  -4.496

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  12           H        ILE  12  12.840 -11.300   0.391
    2    HA   ILE  12           HA       ILE  12  11.479  -9.058   1.453
    3    HB   ILE  12           HB       ILE  12  11.473 -11.941   2.402
    4   HG12  ILE  12          HG12      ILE  12  10.801 -11.299  -0.049
    5   HG13  ILE  12          HG13      ILE  12   9.757 -12.374   0.861
    6   HG23  ILE  12          HG21      ILE  12  10.542 -10.520   4.133
    7   HG22  ILE  12          HG22      ILE  12   9.202 -11.326   3.319
    8   HG21  ILE  12          HG23      ILE  12   9.571  -9.642   2.952
    9   HD12  ILE  12          HD11      ILE  12   8.557 -10.551  -0.384
   10   HD11  ILE  12          HD12      ILE  12   9.372  -9.378   0.648
   11   HD13  ILE  12          HD13      ILE  12   8.259 -10.535   1.346

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  13           H        ILE  13  13.839 -11.298   2.858
    2    HA   ILE  13           HA       ILE  13  13.890 -10.123   5.439
    3    HB   ILE  13           HB       ILE  13  15.928 -11.723   3.873
    4   HG12  ILE  13          HG12      ILE  13  13.632 -12.649   4.726
    5   HG13  ILE  13          HG13      ILE  13  15.092 -13.602   4.967
    6   HG23  ILE  13          HG21      ILE  13  17.350 -10.675   5.385
    7   HG22  ILE  13          HG22      ILE  13  16.866 -12.086   6.316
    8   HG21  ILE  13          HG23      ILE  13  16.107 -10.525   6.627
    9   HD12  ILE  13          HD11      ILE  13  13.593 -13.411   7.022
   10   HD11  ILE  13          HD12      ILE  13  13.995 -11.697   7.050
   11   HD13  ILE  13          HD13      ILE  13  15.260 -12.898   7.269

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ASN  14           H        ASN  14  15.852  -9.615   2.523
    2    HA   ASN  14           HA       ASN  14  17.622  -7.698   3.588
    3    HB2  ASN  14           HB2      ASN  14  17.584  -8.961   1.271
    4    HB3  ASN  14           HB3      ASN  14  16.710  -7.532   0.735
    5   HD21  ASN  14          HD21      ASN  14  19.147  -7.902  -0.450
    6   HD22  ASN  14          HD22      ASN  14  20.304  -6.835   0.180

  No H/Q in entry =           6
  In of MODEL   70
    1    H    SER  15           H        SER  15  14.517  -7.308   1.894
    2    HA   SER  15           HA       SER  15  14.441  -4.487   1.954
    3    HB2  SER  15           HB2      SER  15  12.105  -4.704   1.459
    4    HB3  SER  15           HB3      SER  15  12.886  -6.075   0.683
    5    HG   SER  15           HG       SER  15  11.522  -7.200   1.812

  No H/Q in entry =           5
  In of MODEL   70
    1    H    GLY  16           H        GLY  16  13.315  -6.935   4.253
    2    HA3  GLY  16           HA2      GLY  16  12.114  -5.174   6.112
    3    HA2  GLY  16           HA3      GLY  16  12.708  -6.790   6.473

  No H/Q in entry =           3
  In of MODEL   70
    1    H    GLN  17           H        GLN  17  15.424  -6.490   5.883
    2    HA   GLN  17           HA       GLN  17  16.394  -5.284   8.266
    3    HB2  GLN  17           HB2      GLN  17  17.807  -6.146   5.728
    4    HB3  GLN  17           HB3      GLN  17  18.657  -5.564   7.160
    5    HG2  GLN  17           HG2      GLN  17  16.731  -7.903   7.146
    6    HG3  GLN  17           HG3      GLN  17  18.485  -8.057   7.079
    7   HE21  GLN  17          HE21      GLN  17  16.090  -8.410   9.249
    8   HE22  GLN  17          HE22      GLN  17  16.855  -7.848  10.656

  No H/Q in entry =           8
  In of MODEL   70
    1    H    ALA  18           H        ALA  18  16.221  -4.200   4.907
    2    HA   ALA  18           HA       ALA  18  17.686  -1.825   5.138
    3    HB1  ALA  18           HB1      ALA  18  16.555  -3.024   3.068
    4    HB3  ALA  18           HB2      ALA  18  16.841  -1.284   3.055
    5    HB2  ALA  18           HB3      ALA  18  15.233  -1.910   3.422

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ARG  19           H        ARG  19  14.179  -2.371   5.531
    2    HA   ARG  19           HA       ARG  19  13.542   0.286   6.248
    3    HB2  ARG  19           HB2      ARG  19  11.840  -1.445   5.658
    4    HB3  ARG  19           HB3      ARG  19  12.171  -2.249   7.194
    5    HG2  ARG  19           HG2      ARG  19  11.483  -0.250   8.436
    6    HG3  ARG  19           HG3      ARG  19  11.245   0.631   6.928
    7    HD2  ARG  19           HD2      ARG  19   9.094  -0.141   7.745
    8    HD3  ARG  19           HD3      ARG  19   9.503  -1.024   6.268
    9    HE   ARG  19           HE       ARG  19  10.441  -2.580   8.372
   10   HH21  ARG  19          HH11      ARG  19   9.172  -4.206   9.308
   11   HH22  ARG  19          HH12      ARG  19   7.453  -4.158   9.135
   12   HH11  ARG  19          HH21      ARG  19   7.464  -1.250   7.276
   13   HH12  ARG  19          HH22      ARG  19   6.486  -2.485   7.981

  No H/Q in entry =          13
  In of MODEL   70
    1    H    SER  20           H        SER  20  14.364  -2.557   8.205
    2    HA   SER  20           HA       SER  20  14.091  -1.457  10.743
    3    HB2  SER  20           HB2      SER  20  14.572  -3.847  10.343
    4    HB3  SER  20           HB3      SER  20  16.198  -3.426   9.815
    5    HG   SER  20           HG       SER  20  15.056  -2.912  12.367

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LEU  21           H        LEU  21  16.937  -1.427   8.610
    2    HA   LEU  21           HA       LEU  21  18.627   0.037  10.352
    3    HB2  LEU  21           HB2      LEU  21  18.606  -0.231   7.338
    4    HB3  LEU  21           HB3      LEU  21  19.869   0.612   8.229
    5    HG   LEU  21           HG       LEU  21  19.094  -2.271   8.757
    6   HD12  LEU  21          HD11      LEU  21  21.412  -2.614   7.588
    7   HD11  LEU  21          HD12      LEU  21  21.084  -1.039   6.865
    8   HD13  LEU  21          HD13      LEU  21  19.975  -2.382   6.591
    9   HD22  LEU  21          HD21      LEU  21  20.244  -1.549  10.671
   10   HD21  LEU  21          HD22      LEU  21  21.253  -0.419   9.778
   11   HD23  LEU  21          HD23      LEU  21  21.576  -2.142   9.684

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ALA  22           H        ALA  22  16.378   1.036   7.795
    2    HA   ALA  22           HA       ALA  22  16.950   3.788   7.813
    3    HB3  ALA  22           HB1      ALA  22  15.534   2.564   6.131
    4    HB2  ALA  22           HB2      ALA  22  14.845   4.085   6.699
    5    HB1  ALA  22           HB3      ALA  22  14.235   2.552   7.324

  No H/Q in entry =           5
  In of MODEL   70
    1    H    TYR  23           H        TYR  23  14.429   2.000   9.643
    2    HA   TYR  23           HA       TYR  23  13.492   4.247  11.094
    3    HB2  TYR  23           HB2      TYR  23  12.229   2.150  11.070
    4    HB3  TYR  23           HB3      TYR  23  13.551   1.320  11.890
    5    HD1  TYR  23           HD1      TYR  23  11.094   4.104  12.269
    6    HD2  TYR  23           HD2      TYR  23  13.742   1.361  14.246
    7    HE1  TYR  23           HE1      TYR  23  10.177   4.802  14.466
    8    HE2  TYR  23           HE2      TYR  23  12.825   2.058  16.441
    9    HH   TYR  23           HH       TYR  23  10.123   4.356  16.659

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ALA  24           H        ALA  24  16.108   1.938  11.731
    2    HA   ALA  24           HA       ALA  24  16.788   2.922  14.297
    3    HB1  ALA  24           HB1      ALA  24  18.122   1.112  14.131
    4    HB3  ALA  24           HB2      ALA  24  19.162   2.022  13.035
    5    HB2  ALA  24           HB3      ALA  24  17.856   1.031  12.390

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ALA  25           H        ALA  25  17.760   3.843  11.020
    2    HA   ALA  25           HA       ALA  25  19.729   5.752  11.670
    3    HB1  ALA  25           HB1      ALA  25  19.003   4.816   9.353
    4    HB3  ALA  25           HB2      ALA  25  19.526   6.497   9.449
    5    HB2  ALA  25           HB3      ALA  25  17.806   6.111   9.377

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LEU  26           H        LEU  26  16.217   6.026  11.305
    2    HA   LEU  26           HA       LEU  26  16.028   8.809  11.760
    3    HB2  LEU  26           HB2      LEU  26  14.152   7.599  10.828
    4    HB3  LEU  26           HB3      LEU  26  14.046   6.571  12.252
    5    HG   LEU  26           HG       LEU  26  13.464   8.534  13.634
    6   HD12  LEU  26          HD11      LEU  26  12.832  10.645  12.311
    7   HD11  LEU  26          HD12      LEU  26  13.806   9.981  11.001
    8   HD13  LEU  26          HD13      LEU  26  14.553  10.355  12.555
    9   HD21  LEU  26          HD21      LEU  26  11.788   8.246  11.122
   10   HD23  LEU  26          HD22      LEU  26  11.234   8.949  12.639
   11   HD22  LEU  26          HD23      LEU  26  11.664   7.242  12.567

  No H/Q in entry =          11
  In of MODEL   70
    1    H    LYS  27           H        LYS  27  15.881   6.029  13.949
    2    HA   LYS  27           HA       LYS  27  15.304   7.399  16.318
    3    HB2  LYS  27           HB2      LYS  27  15.299   4.924  16.050
    4    HB3  LYS  27           HB3      LYS  27  17.063   4.953  16.009
    5    HG2  LYS  27           HG2      LYS  27  17.124   5.935  18.260
    6    HG3  LYS  27           HG3      LYS  27  15.357   5.977  18.303
    7    HD2  LYS  27           HD2      LYS  27  15.299   3.511  18.063
    8    HD3  LYS  27           HD3      LYS  27  17.064   3.477  18.054
    9    HE2  LYS  27           HE2      LYS  27  17.108   4.462  20.312
   10    HE3  LYS  27           HE3      LYS  27  15.343   4.526  20.324
   11    HZ3  LYS  27           HZ1      LYS  27  16.103   2.562  21.473
   12    HZ2  LYS  27           HZ2      LYS  27  17.014   2.072  20.123
   13    HZ1  LYS  27           HZ3      LYS  27  15.317   2.101  20.041

  No H/Q in entry =          13
  In of MODEL   70
    1    H    GLN  28           H        GLN  28  18.414   6.777  14.729
    2    HA   GLN  28           HA       GLN  28  20.110   7.834  16.723
    3    HB2  GLN  28           HB2      GLN  28  20.307   7.436  13.763
    4    HB3  GLN  28           HB3      GLN  28  21.519   8.438  14.561
    5    HG2  GLN  28           HG2      GLN  28  22.062   5.944  14.378
    6    HG3  GLN  28           HG3      GLN  28  22.207   6.657  15.982
    7   HE21  GLN  28          HE21      GLN  28  20.334   6.283  17.501
    8   HE22  GLN  28          HE22      GLN  28  19.379   4.894  17.296

  No H/Q in entry =           8
  In of MODEL   70
    1    H    ALA  29           H        ALA  29  18.383   9.345  14.031
    2    HA   ALA  29           HA       ALA  29  19.419  11.951  14.289
    3    HB2  ALA  29           HB1      ALA  29  17.731  12.614  12.816
    4    HB1  ALA  29           HB2      ALA  29  16.570  11.456  13.464
    5    HB3  ALA  29           HB3      ALA  29  17.893  10.896  12.442

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LYS  30           H        LYS  30  16.617  10.390  15.804
    2    HA   LYS  30           HA       LYS  30  15.635  12.656  17.163
    3    HB2  LYS  30           HB2      LYS  30  15.479   9.716  17.863
    4    HB3  LYS  30           HB3      LYS  30  14.630  10.978  18.757
    5    HG2  LYS  30           HG2      LYS  30  13.518  11.683  16.639
    6    HG3  LYS  30           HG3      LYS  30  14.304  10.336  15.811
    7    HD2  LYS  30           HD2      LYS  30  13.207   8.743  17.336
    8    HD3  LYS  30           HD3      LYS  30  12.431  10.079  18.188
    9    HE2  LYS  30           HE2      LYS  30  11.275  10.732  16.095
   10    HE3  LYS  30           HE3      LYS  30  12.030   9.367  15.263
   11    HZ2  LYS  30           HZ1      LYS  30   9.715   8.991  16.139
   12    HZ1  LYS  30           HZ2      LYS  30  10.381   9.032  17.707
   13    HZ3  LYS  30           HZ3      LYS  30  10.873   7.841  16.596

  No H/Q in entry =          13
  In of MODEL   70
    1    H    GLN  31           H        GLN  31  18.262  10.445  17.900
    2    HA   GLN  31           HA       GLN  31  18.601  11.451  20.596
    3    HB2  GLN  31           HB2      GLN  31  20.602   9.852  18.992
    4    HB3  GLN  31           HB3      GLN  31  20.468   9.976  20.746
    5    HG2  GLN  31           HG2      GLN  31  17.941   9.063  19.973
    6    HG3  GLN  31           HG3      GLN  31  19.031   8.204  18.893
    7   HE21  GLN  31          HE21      GLN  31  17.469   7.078  21.166
    8   HE22  GLN  31          HE22      GLN  31  18.613   6.398  22.217

  No H/Q in entry =           8
  In of MODEL   70
    1    H    GLY  32           H        GLY  32  19.144  12.765  17.632
    2    HA3  GLY  32           HA2      GLY  32  20.160  14.795  17.122
    3    HA2  GLY  32           HA3      GLY  32  20.915  14.786  18.711

  No H/Q in entry =           3
  In of MODEL   70
    1    H    ASP  33           H        ASP  33  21.295  11.891  16.930
    2    HA   ASP  33           HA       ASP  33  24.131  12.524  16.468
    3    HB2  ASP  33           HB2      ASP  33  22.583   9.931  16.579
    4    HB3  ASP  33           HB3      ASP  33  24.272  10.022  16.086

  No H/Q in entry =           4
  In of MODEL   70
    1    H    PHE  34           H        PHE  34  23.672  13.857  14.588
    2    HA   PHE  34           HA       PHE  34  22.311  12.897  12.298
    3    HB2  PHE  34           HB2      PHE  34  24.473  14.998  12.534
    4    HB3  PHE  34           HB3      PHE  34  23.485  14.725  11.100
    5    HD1  PHE  34           HD1      PHE  34  23.762  16.650  14.017
    6    HD2  PHE  34           HD2      PHE  34  20.856  14.582  11.625
    7    HE1  PHE  34           HE1      PHE  34  21.966  18.074  14.964
    8    HE2  PHE  34           HE2      PHE  34  19.063  16.005  12.575
    9    HZ   PHE  34           HZ       PHE  34  19.622  17.751  14.240

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ALA  35           H        ALA  35  25.681  12.657  13.309
    2    HA   ALA  35           HA       ALA  35  26.777  11.824  10.852
    3    HB3  ALA  35           HB1      ALA  35  28.438  10.627  12.572
    4    HB2  ALA  35           HB2      ALA  35  27.588  11.663  13.718
    5    HB1  ALA  35           HB3      ALA  35  28.437  12.376  12.348

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ALA  36           H        ALA  36  25.629   9.880  13.614
    2    HA   ALA  36           HA       ALA  36  26.079   7.388  12.335
    3    HB2  ALA  36           HB1      ALA  36  25.635   6.644  14.409
    4    HB3  ALA  36           HB2      ALA  36  23.955   7.164  14.258
    5    HB1  ALA  36           HB3      ALA  36  25.171   8.277  14.883

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ALA  37           H        ALA  37  23.288   9.554  12.469
    2    HA   ALA  37           HA       ALA  37  21.408   7.813  11.288
    3    HB3  ALA  37           HB1      ALA  37  21.675  10.772  11.585
    4    HB1  ALA  37           HB2      ALA  37  20.348   9.711  12.055
    5    HB2  ALA  37           HB3      ALA  37  20.545  10.183  10.366

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LYS  38           H        LYS  38  23.543  10.246   9.815
    2    HA   LYS  38           HA       LYS  38  22.901   9.831   7.137
    3    HB2  LYS  38           HB2      LYS  38  24.731  11.361   8.586
    4    HB3  LYS  38           HB3      LYS  38  25.751  10.359   7.560
    5    HG2  LYS  38           HG2      LYS  38  24.599  11.148   5.564
    6    HG3  LYS  38           HG3      LYS  38  23.416  12.018   6.545
    7    HD2  LYS  38           HD2      LYS  38  25.032  13.593   7.301
    8    HD3  LYS  38           HD3      LYS  38  26.379  12.589   6.766
    9    HE2  LYS  38           HE2      LYS  38  26.049  14.468   5.217
   10    HE3  LYS  38           HE3      LYS  38  25.694  12.936   4.410
   11    HZ3  LYS  38           HZ1      LYS  38  23.504  13.411   4.278
   12    HZ2  LYS  38           HZ2      LYS  38  24.048  15.018   4.368
   13    HZ1  LYS  38           HZ3      LYS  38  23.462  14.240   5.759

  No H/Q in entry =          13
  In of MODEL   70
    1    H    ALA  39           H        ALA  39  25.391   8.197   9.093
    2    HA   ALA  39           HA       ALA  39  26.441   6.597   7.022
    3    HB2  ALA  39           HB1      ALA  39  26.336   5.631   9.864
    4    HB1  ALA  39           HB2      ALA  39  27.308   7.044   9.451
    5    HB3  ALA  39           HB3      ALA  39  27.640   5.490   8.686

  No H/Q in entry =           5
  In of MODEL   70
    1    H    MET  40           H        MET  40  23.817   6.013   9.317
    2    HA   MET  40           HA       MET  40  23.339   3.315   8.578
    3    HB2  MET  40           HB2      MET  40  21.549   5.380   9.871
    4    HB3  MET  40           HB3      MET  40  21.120   3.677   9.694
    5    HG2  MET  40           HG2      MET  40  23.680   4.582  11.039
    6    HG3  MET  40           HG3      MET  40  22.181   4.325  11.930
    7    HE3  MET  40           HE1      MET  40  21.570   0.699  12.099
    8    HE2  MET  40           HE2      MET  40  20.719   2.014  11.293
    9    HE1  MET  40           HE3      MET  40  21.462   2.290  12.867

  No H/Q in entry =           9
  In of MODEL   70
    1    H    MET  41           H        MET  41  21.967   6.388   7.394
    2    HA   MET  41           HA       MET  41  19.996   5.221   5.718
    3    HB2  MET  41           HB2      MET  41  21.511   7.793   5.210
    4    HB3  MET  41           HB3      MET  41  19.978   7.320   4.489
    5    HG2  MET  41           HG2      MET  41  19.227   7.137   7.040
    6    HG3  MET  41           HG3      MET  41  20.550   8.278   7.265
    7    HE2  MET  41           HE1      MET  41  20.008   9.578   3.929
    8    HE1  MET  41           HE2      MET  41  20.968  10.003   5.343
    9    HE3  MET  41           HE3      MET  41  19.710  11.099   4.779

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ASP  42           H        ASP  42  23.381   6.101   5.170
    2    HA   ASP  42           HA       ASP  42  23.469   5.630   2.411
    3    HB2  ASP  42           HB2      ASP  42  25.231   6.603   4.184
    4    HB3  ASP  42           HB3      ASP  42  25.868   4.969   4.055

  No H/Q in entry =           4
  In of MODEL   70
    1    H    GLN  43           H        GLN  43  24.163   3.462   5.130
    2    HA   GLN  43           HA       GLN  43  24.800   1.199   3.544
    3    HB2  GLN  43           HB2      GLN  43  23.777   1.391   6.387
    4    HB3  GLN  43           HB3      GLN  43  24.338  -0.104   5.630
    5    HG2  GLN  43           HG2      GLN  43  26.517   1.080   5.123
    6    HG3  GLN  43           HG3      GLN  43  25.950   2.413   6.124
    7   HE21  GLN  43          HE21      GLN  43  28.170   1.410   7.161
    8   HE22  GLN  43          HE22      GLN  43  27.880   0.329   8.436

  No H/Q in entry =           8
  In of MODEL   70
    1    H    SER  44           H        SER  44  21.757   2.369   4.928
    2    HA   SER  44           HA       SER  44  20.161   0.147   4.250
    3    HB2  SER  44           HB2      SER  44  19.751   2.680   5.399
    4    HB3  SER  44           HB3      SER  44  18.717   2.652   3.973
    5    HG   SER  44           HG       SER  44  17.610   1.720   5.693

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ARG  45           H        ARG  45  20.943   3.105   2.451
    2    HA   ARG  45           HA       ARG  45  19.415   2.642   0.144
    3    HB2  ARG  45           HB2      ARG  45  20.585   4.763   0.732
    4    HB3  ARG  45           HB3      ARG  45  22.120   3.988   0.347
    5    HG2  ARG  45           HG2      ARG  45  21.334   3.597  -1.969
    6    HG3  ARG  45           HG3      ARG  45  19.811   4.393  -1.582
    7    HD2  ARG  45           HD2      ARG  45  21.088   6.473  -0.994
    8    HD3  ARG  45           HD3      ARG  45  22.575   5.681  -1.562
    9    HE   ARG  45           HE       ARG  45  20.643   5.471  -3.600
   10   HH21  ARG  45          HH11      ARG  45  20.656   6.843  -5.361
   11   HH22  ARG  45          HH12      ARG  45  21.433   8.383  -5.254
   12   HH11  ARG  45          HH21      ARG  45  22.405   7.944  -1.968
   13   HH12  ARG  45          HH22      ARG  45  22.422   9.006  -3.330

  No H/Q in entry =          13
  In of MODEL   70
    1    H    MET  46           H        MET  46  22.766   1.722   0.892
    2    HA   MET  46           HA       MET  46  23.358   0.525  -1.593
    3    HB2  MET  46           HB2      MET  46  24.459   0.189   1.197
    4    HB3  MET  46           HB3      MET  46  25.101  -0.724  -0.173
    5    HG2  MET  46           HG2      MET  46  25.587   1.363  -1.368
    6    HG3  MET  46           HG3      MET  46  24.886   2.300  -0.056
    7    HE3  MET  46           HE1      MET  46  27.673  -0.911   0.362
    8    HE2  MET  46           HE2      MET  46  28.786   0.160  -0.484
    9    HE1  MET  46           HE3      MET  46  27.224  -0.226  -1.206

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ALA  47           H        ALA  47  21.955  -0.793   1.380
    2    HA   ALA  47           HA       ALA  47  21.865  -3.504   0.574
    3    HB2  ALA  47           HB1      ALA  47  21.492  -3.042   2.879
    4    HB3  ALA  47           HB2      ALA  47  19.947  -3.623   2.258
    5    HB1  ALA  47           HB3      ALA  47  20.200  -1.895   2.519

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LEU  48           H        LEU  48  19.549  -0.844   0.220
    2    HA   LEU  48           HA       LEU  48  17.483  -2.348  -1.034
    3    HB2  LEU  48           HB2      LEU  48  18.179   0.597  -1.145
    4    HB3  LEU  48           HB3      LEU  48  16.698  -0.092  -1.813
    5    HG   LEU  48           HG       LEU  48  17.547  -0.409   1.076
    6   HD13  LEU  48          HD11      LEU  48  17.161   1.898   0.892
    7   HD12  LEU  48          HD12      LEU  48  15.594   1.271   1.400
    8   HD11  LEU  48          HD13      LEU  48  15.871   1.692  -0.291
    9   HD22  LEU  48          HD21      LEU  48  15.994  -2.101   0.693
   10   HD21  LEU  48          HD22      LEU  48  15.133  -1.185  -0.544
   11   HD23  LEU  48          HD23      LEU  48  14.927  -0.779   1.159

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ASN  49           H        ASN  49  20.199  -0.456  -2.262
    2    HA   ASN  49           HA       ASN  49  19.547  -0.528  -4.986
    3    HB2  ASN  49           HB2      ASN  49  21.243   0.968  -4.084
    4    HB3  ASN  49           HB3      ASN  49  22.247  -0.398  -3.615
    5   HD21  ASN  49          HD21      ASN  49  20.843   1.193  -6.495
    6   HD22  ASN  49          HD22      ASN  49  22.066   0.691  -7.558

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLU  50           H        GLU  50  21.499  -2.752  -3.026
    2    HA   GLU  50           HA       GLU  50  22.175  -4.516  -5.154
    3    HB2  GLU  50           HB2      GLU  50  23.374  -4.510  -2.988
    4    HB3  GLU  50           HB3      GLU  50  21.922  -5.118  -2.192
    5    HG2  GLU  50           HG2      GLU  50  21.982  -7.151  -3.553
    6    HG3  GLU  50           HG3      GLU  50  23.367  -6.537  -4.454

  No H/Q in entry =           6
  In of MODEL   70
    1    H    ALA  51           H        ALA  51  19.521  -4.415  -2.827
    2    HA   ALA  51           HA       ALA  51  18.319  -6.870  -3.586
    3    HB3  ALA  51           HB1      ALA  51  16.734  -6.343  -2.030
    4    HB1  ALA  51           HB2      ALA  51  16.545  -4.693  -2.627
    5    HB2  ALA  51           HB3      ALA  51  17.898  -5.099  -1.572

  No H/Q in entry =           5
  In of MODEL   70
    1    H    HIS  52           H        HIS  52  17.781  -3.513  -4.618
    2    HA   HIS  52           HA       HIS  52  15.660  -4.007  -6.418
    3    HB2  HIS  52           HB2      HIS  52  16.336  -1.752  -5.618
    4    HB3  HIS  52           HB3      HIS  52  17.796  -1.869  -6.600
    5    HD1  HIS  52           HD1      HIS  52  17.512  -1.782  -9.193
    6    HD2  HIS  52           HD2      HIS  52  13.949  -1.281  -7.085
    7    HE1  HIS  52           HE1      HIS  52  15.804  -0.934 -10.861
    8    HE2  HIS  52           HE2      HIS  52  13.627  -0.624  -9.590

  No H/Q in entry =           8
  In of MODEL   70
    1    H    LEU  53           H        LEU  53  19.178  -4.063  -6.852
    2    HA   LEU  53           HA       LEU  53  19.229  -4.377  -9.652
    3    HB2  LEU  53           HB2      LEU  53  21.152  -5.169  -7.479
    4    HB3  LEU  53           HB3      LEU  53  21.462  -5.557  -9.170
    5    HG   LEU  53           HG       LEU  53  20.838  -2.740  -8.224
    6   HD12  LEU  53          HD11      LEU  53  23.336  -2.399  -8.501
    7   HD11  LEU  53          HD12      LEU  53  23.494  -4.154  -8.561
    8   HD13  LEU  53          HD13      LEU  53  22.875  -3.375  -7.110
    9   HD22  LEU  53          HD21      LEU  53  20.559  -2.757 -10.558
   10   HD21  LEU  53          HD22      LEU  53  21.788  -3.996 -10.791
   11   HD23  LEU  53          HD23      LEU  53  22.265  -2.348 -10.427

  No H/Q in entry =          11
  In of MODEL   70
    1    H    VAL  54           H        VAL  54  19.084  -6.764  -7.028
    2    HA   VAL  54           HA       VAL  54  19.175  -9.059  -8.689
    3    HB   VAL  54           HB       VAL  54  18.027  -8.621  -5.921
    4   HG12  VAL  54          HG11      VAL  54  18.315 -11.243  -5.919
    5   HG11  VAL  54          HG12      VAL  54  18.132 -11.071  -7.664
    6   HG13  VAL  54          HG13      VAL  54  16.851 -10.523  -6.585
    7   HG22  VAL  54          HG21      VAL  54  20.346  -8.443  -5.699
    8   HG21  VAL  54          HG22      VAL  54  20.667  -9.538  -7.041
    9   HG23  VAL  54          HG23      VAL  54  20.129 -10.179  -5.489

  No H/Q in entry =           9
  In of MODEL   70
    1    H    GLN  55           H        GLN  55  16.473  -7.119  -7.404
    2    HA   GLN  55           HA       GLN  55  14.429  -8.755  -8.479
    3    HB2  GLN  55           HB2      GLN  55  13.703  -7.220  -6.851
    4    HB3  GLN  55           HB3      GLN  55  14.514  -5.862  -7.626
    5    HG2  GLN  55           HG2      GLN  55  12.793  -5.513  -9.115
    6    HG3  GLN  55           HG3      GLN  55  12.448  -7.229  -9.286
    7   HE21  GLN  55          HE21      GLN  55  10.434  -7.752  -8.481
    8   HE22  GLN  55          HE22      GLN  55   9.671  -6.988  -7.172

  No H/Q in entry =           8
  In of MODEL   70
    1    H    THR  56           H        THR  56  16.206  -5.978  -9.837
    2    HA   THR  56           HA       THR  56  14.772  -5.595 -12.185
    3    HB   THR  56           HB       THR  56  17.792  -5.546 -12.015
    4    HG1  THR  56           HG1      THR  56  15.881  -4.064 -10.757
    5   HG23  THR  56          HG21      THR  56  17.639  -3.908 -13.767
    6   HG22  THR  56          HG22      THR  56  15.885  -3.823 -13.610
    7   HG21  THR  56          HG23      THR  56  16.642  -5.280 -14.255

  No H/Q in entry =           7
  In of MODEL   70
    1    H    LYS  57           H        LYS  57  17.391  -7.928 -11.576
    2    HA   LYS  57           HA       LYS  57  17.375  -9.121 -14.154
    3    HB2  LYS  57           HB2      LYS  57  19.162  -9.397 -12.406
    4    HB3  LYS  57           HB3      LYS  57  18.044 -10.382 -11.474
    5    HG2  LYS  57           HG2      LYS  57  17.921 -12.016 -13.296
    6    HG3  LYS  57           HG3      LYS  57  18.989 -11.025 -14.283
    7    HD2  LYS  57           HD2      LYS  57  20.789 -11.294 -12.614
    8    HD3  LYS  57           HD3      LYS  57  19.727 -12.295 -11.626
    9    HE2  LYS  57           HE2      LYS  57  21.005 -13.869 -12.855
   10    HE3  LYS  57           HE3      LYS  57  19.486 -13.788 -13.745
   11    HZ3  LYS  57           HZ1      LYS  57  20.443 -12.738 -15.473
   12    HZ2  LYS  57           HZ2      LYS  57  21.841 -13.507 -14.896
   13    HZ1  LYS  57           HZ3      LYS  57  21.544 -11.881 -14.510

  No H/Q in entry =          13
  In of MODEL   70
    1    H    LEU  58           H        LEU  58  15.587  -9.766 -11.178
    2    HA   LEU  58           HA       LEU  58  14.334 -12.124 -12.113
    3    HB2  LEU  58           HB2      LEU  58  13.565 -10.209  -9.917
    4    HB3  LEU  58           HB3      LEU  58  12.739 -11.736 -10.233
    5    HG   LEU  58           HG       LEU  58  15.715 -11.497  -9.680
    6   HD11  LEU  58          HD11      LEU  58  13.340 -11.884  -7.886
    7   HD13  LEU  58          HD12      LEU  58  14.806 -10.940  -7.624
    8   HD12  LEU  58          HD13      LEU  58  14.855 -12.696  -7.489
    9   HD22  LEU  58          HD21      LEU  58  15.570 -13.556 -10.708
   10   HD21  LEU  58          HD22      LEU  58  13.854 -13.744 -10.347
   11   HD23  LEU  58          HD23      LEU  58  15.059 -14.061  -9.098

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  59           H        ILE  59  13.706  -8.778 -12.794
    2    HA   ILE  59           HA       ILE  59  10.981  -9.391 -13.733
    3    HB   ILE  59           HB       ILE  59  11.821  -7.119 -12.529
    4   HG12  ILE  59          HG12      ILE  59   9.907  -6.964 -14.867
    5   HG13  ILE  59          HG13      ILE  59   9.484  -7.745 -13.365
    6   HG22  ILE  59          HG21      ILE  59  11.904  -6.314 -15.424
    7   HG21  ILE  59          HG22      ILE  59  13.375  -6.742 -14.583
    8   HG23  ILE  59          HG23      ILE  59  12.397  -5.388 -14.028
    9   HD11  ILE  59          HD11      ILE  59  10.506  -4.914 -13.506
   10   HD13  ILE  59          HD12      ILE  59   9.788  -5.715 -12.110
   11   HD12  ILE  59          HD13      ILE  59   8.789  -5.319 -13.509

  No H/Q in entry =          11
  In of MODEL   70
    1    H    GLU  60           H        GLU  60  14.195  -8.580 -14.993
    2    HA   GLU  60           HA       GLU  60  13.419  -8.169 -17.701
    3    HB2  GLU  60           HB2      GLU  60  15.589  -7.424 -17.001
    4    HB3  GLU  60           HB3      GLU  60  16.029  -9.034 -16.437
    5    HG2  GLU  60           HG2      GLU  60  17.091  -8.631 -18.597
    6    HG3  GLU  60           HG3      GLU  60  15.846  -9.863 -18.790

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLY  61           H        GLY  61  14.361 -11.063 -15.887
    2    HA3  GLY  61           HA2      GLY  61  13.797 -12.703 -18.289
    3    HA2  GLY  61           HA3      GLY  61  14.824 -13.198 -16.947

  No H/Q in entry =           3
  In of MODEL   70
    1    H    ASP  62           H        ASP  62  11.726 -11.611 -16.566
    2    HA   ASP  62           HA       ASP  62  10.767 -13.731 -14.881
    3    HB2  ASP  62           HB2      ASP  62   8.748 -12.276 -14.710
    4    HB3  ASP  62           HB3      ASP  62  10.249 -11.457 -14.288

  No H/Q in entry =           4
  In of MODEL   70
    1    H    ALA  63           H        ALA  63  10.839 -13.500 -18.209
    2    HA   ALA  63           HA       ALA  63   8.233 -14.271 -19.016
    3    HB1  ALA  63           HB1      ALA  63  10.819 -15.150 -20.318
    4    HB3  ALA  63           HB2      ALA  63  10.146 -13.532 -20.511
    5    HB2  ALA  63           HB3      ALA  63   9.246 -14.935 -21.085

  No H/Q in entry =           5
  In of MODEL   70
    1    H    GLY  64           H        GLY  64  11.038 -16.121 -17.946
    2    HA3  GLY  64           HA2      GLY  64  11.335 -18.331 -17.409
    3    HA2  GLY  64           HA3      GLY  64   9.704 -18.226 -16.759

  No H/Q in entry =           3
  In of MODEL   70
    1    H    GLU  65           H        GLU  65   8.269 -19.621 -17.604
    2    HA   GLU  65           HA       GLU  65   8.906 -21.437 -19.610
    3    HB2  GLU  65           HB2      GLU  65   6.189 -20.541 -18.652
    4    HB3  GLU  65           HB3      GLU  65   6.474 -21.949 -19.675
    5    HG2  GLU  65           HG2      GLU  65   7.740 -21.522 -16.955
    6    HG3  GLU  65           HG3      GLU  65   6.323 -22.529 -17.247

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLY  66           H        GLY  66   7.068 -21.720 -21.404
    2    HA3  GLY  66           HA2      GLY  66   7.769 -20.021 -23.535
    3    HA2  GLY  66           HA3      GLY  66   6.499 -21.228 -23.551

  No H/Q in entry =           3
  In of MODEL   70
    1    H    LYS  67           H        LYS  67   4.915 -20.104 -21.485
    2    HA   LYS  67           HA       LYS  67   3.413 -18.238 -23.027
    3    HB2  LYS  67           HB2      LYS  67   3.051 -19.354 -20.250
    4    HB3  LYS  67           HB3      LYS  67   1.881 -18.288 -21.040
    5    HG2  LYS  67           HG2      LYS  67   1.725 -19.859 -22.938
    6    HG3  LYS  67           HG3      LYS  67   2.886 -20.926 -22.153
    7    HD2  LYS  67           HD2      LYS  67   1.338 -21.236 -20.263
    8    HD3  LYS  67           HD3      LYS  67   0.175 -20.156 -21.037
    9    HE2  LYS  67           HE2      LYS  67   0.037 -21.673 -22.973
   10    HE3  LYS  67           HE3      LYS  67   1.211 -22.750 -22.219
   11    HZ2  LYS  67           HZ1      LYS  67  -1.384 -23.084 -21.951
   12    HZ1  LYS  67           HZ2      LYS  67  -1.133 -22.030 -20.644
   13    HZ3  LYS  67           HZ3      LYS  67  -0.288 -23.502 -20.725

  No H/Q in entry =          13
  In of MODEL   70
    1    H    MET  68           H        MET  68   2.522 -16.262 -22.234
    2    HA   MET  68           HA       MET  68   4.453 -14.304 -21.715
    3    HB2  MET  68           HB2      MET  68   1.443 -14.241 -21.548
    4    HB3  MET  68           HB3      MET  68   2.460 -12.808 -21.404
    5    HG2  MET  68           HG2      MET  68   3.434 -13.275 -23.624
    6    HG3  MET  68           HG3      MET  68   2.403 -14.699 -23.773
    7    HE2  MET  68           HE1      MET  68   0.632 -13.772 -26.042
    8    HE1  MET  68           HE2      MET  68   2.356 -13.440 -25.890
    9    HE3  MET  68           HE3      MET  68   1.249 -12.134 -26.306

  No H/Q in entry =           9
  In of MODEL   70
    1    H    LYS  69           H        LYS  69   2.158 -15.845 -19.451
    2    HA   LYS  69           HA       LYS  69   2.190 -14.226 -17.301
    3    HB2  LYS  69           HB2      LYS  69   1.016 -16.378 -17.403
    4    HB3  LYS  69           HB3      LYS  69   2.547 -17.221 -17.153
    5    HG2  LYS  69           HG2      LYS  69   2.848 -16.116 -14.994
    6    HG3  LYS  69           HG3      LYS  69   1.376 -15.177 -15.245
    7    HD2  LYS  69           HD2      LYS  69   0.058 -17.268 -15.298
    8    HD3  LYS  69           HD3      LYS  69   1.532 -18.197 -15.017
    9    HE2  LYS  69           HE2      LYS  69   1.873 -17.038 -12.876
   10    HE3  LYS  69           HE3      LYS  69   0.426 -16.073 -13.157
   11    HZ1  LYS  69           HZ1      LYS  69  -0.708 -18.353 -13.398
   12    HZ3  LYS  69           HZ2      LYS  69  -0.349 -17.776 -11.842
   13    HZ2  LYS  69           HZ3      LYS  69   0.644 -18.949 -12.568

  No H/Q in entry =          13
  In of MODEL   70
    1    H    VAL  70           H        VAL  70   3.327 -13.966 -15.313
    2    HA   VAL  70           HA       VAL  70   6.232 -14.550 -15.480
    3    HB   VAL  70           HB       VAL  70   6.547 -12.472 -14.160
    4   HG13  VAL  70          HG11      VAL  70   6.406 -11.048 -16.014
    5   HG12  VAL  70          HG12      VAL  70   4.876 -11.743 -16.550
    6   HG11  VAL  70          HG13      VAL  70   6.377 -12.639 -16.775
    7   HG21  VAL  70          HG21      VAL  70   3.533 -12.412 -14.387
    8   HG23  VAL  70          HG22      VAL  70   4.447 -10.914 -14.210
    9   HG22  VAL  70          HG23      VAL  70   4.532 -12.152 -12.957

  No H/Q in entry =           9
  In of MODEL   70
    1    H    SER  71           H        SER  71   7.284 -14.581 -13.296
    2    HA   SER  71           HA       SER  71   6.152 -16.540 -11.609
    3    HB2  SER  71           HB2      SER  71   8.589 -16.050 -11.757
    4    HB3  SER  71           HB3      SER  71   8.307 -14.520 -10.933
    5    HG   SER  71           HG       SER  71   8.311 -17.112  -9.967

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LEU  72           H        LEU  72   4.781 -16.401  -9.951
    2    HA   LEU  72           HA       LEU  72   3.261 -14.068  -9.505
    3    HB2  LEU  72           HB2      LEU  72   3.516 -16.631  -7.940
    4    HB3  LEU  72           HB3      LEU  72   2.366 -15.359  -7.533
    5    HG   LEU  72           HG       LEU  72   2.500 -16.646 -10.279
    6   HD11  LEU  72          HD11      LEU  72   1.946 -18.277  -8.432
    7   HD13  LEU  72          HD12      LEU  72   0.652 -18.055  -9.608
    8   HD12  LEU  72          HD13      LEU  72   0.559 -17.263  -8.036
    9   HD23  LEU  72          HD21      LEU  72   0.023 -15.796 -10.167
   10   HD22  LEU  72          HD22      LEU  72   1.286 -14.622 -10.500
   11   HD21  LEU  72          HD23      LEU  72   0.611 -14.751  -8.878

  No H/Q in entry =          11
  In of MODEL   70
    1    H    VAL  73           H        VAL  73   5.899 -15.541  -7.732
    2    HA   VAL  73           HA       VAL  73   5.857 -14.009  -5.399
    3    HB   VAL  73           HB       VAL  73   8.025 -14.850  -4.969
    4   HG13  VAL  73          HG11      VAL  73   7.684 -17.164  -5.259
    5   HG12  VAL  73          HG12      VAL  73   6.894 -16.943  -6.819
    6   HG11  VAL  73          HG13      VAL  73   6.054 -16.499  -5.333
    7   HG21  VAL  73          HG21      VAL  73   8.214 -14.895  -7.963
    8   HG23  VAL  73          HG22      VAL  73   9.191 -16.028  -7.031
    9   HG22  VAL  73          HG23      VAL  73   9.377 -14.292  -6.781

  No H/Q in entry =           9
  In of MODEL   70
    1    H    LEU  74           H        LEU  74   6.860 -13.125  -8.574
    2    HA   LEU  74           HA       LEU  74   8.830 -11.202  -8.078
    3    HB2  LEU  74           HB2      LEU  74   8.368 -11.941 -10.317
    4    HB3  LEU  74           HB3      LEU  74   6.708 -11.358 -10.217
    5    HG   LEU  74           HG       LEU  74   7.530  -9.040 -10.007
    6   HD12  LEU  74          HD11      LEU  74  10.035  -8.758 -10.576
    7   HD11  LEU  74          HD12      LEU  74  10.203 -10.445 -10.093
    8   HD13  LEU  74          HD13      LEU  74   9.637  -9.247  -8.930
    9   HD23  LEU  74          HD21      LEU  74   9.025 -10.135 -12.328
   10   HD22  LEU  74          HD22      LEU  74   7.868  -8.826 -12.240
   11   HD21  LEU  74          HD23      LEU  74   7.299 -10.480 -12.228

  No H/Q in entry =          11
  In of MODEL   70
    1    H    VAL  75           H        VAL  75   5.340 -10.772  -8.434
    2    HA   VAL  75           HA       VAL  75   5.279  -8.015  -7.844
    3    HB   VAL  75           HB       VAL  75   3.162 -10.131  -7.461
    4   HG11  VAL  75          HG11      VAL  75   3.011  -7.089  -7.301
    5   HG13  VAL  75          HG12      VAL  75   2.699  -8.221  -5.993
    6   HG12  VAL  75          HG13      VAL  75   1.611  -8.155  -7.371
    7   HG21  VAL  75          HG21      VAL  75   3.684  -8.033  -9.595
    8   HG23  VAL  75          HG22      VAL  75   2.272  -9.086  -9.543
    9   HG22  VAL  75          HG23      VAL  75   3.876  -9.775  -9.788

  No H/Q in entry =           9
  In of MODEL   70
    1    H    GLU  76           H        GLU  76   4.986 -10.890  -5.737
    2    HA   GLU  76           HA       GLU  76   4.531  -9.526  -3.315
    3    HB2  GLU  76           HB2      GLU  76   4.345 -12.005  -3.598
    4    HB3  GLU  76           HB3      GLU  76   6.092 -12.098  -3.749
    5    HG2  GLU  76           HG2      GLU  76   6.368 -11.239  -1.465
    6    HG3  GLU  76           HG3      GLU  76   4.631 -11.073  -1.283

  No H/Q in entry =           6
  In of MODEL   70
    1    H    ALA  77           H        ALA  77   7.581 -10.471  -4.876
    2    HA   ALA  77           HA       ALA  77   9.281  -9.452  -2.857
    3    HB3  ALA  77           HB1      ALA  77   9.718  -9.930  -5.808
    4    HB1  ALA  77           HB2      ALA  77  10.205 -10.962  -4.464
    5    HB2  ALA  77           HB3      ALA  77  11.001  -9.409  -4.716

  No H/Q in entry =           5
  In of MODEL   70
    1    H    GLN  78           H        GLN  78   7.912  -8.014  -5.771
    2    HA   GLN  78           HA       GLN  78   9.297  -5.553  -5.663
    3    HB2  GLN  78           HB2      GLN  78   7.993  -6.446  -7.625
    4    HB3  GLN  78           HB3      GLN  78   6.513  -6.054  -6.750
    5    HG2  GLN  78           HG2      GLN  78   7.196  -3.691  -6.647
    6    HG3  GLN  78           HG3      GLN  78   8.675  -4.077  -7.524
    7   HE21  GLN  78          HE21      GLN  78   6.798  -2.226  -8.619
    8   HE22  GLN  78          HE22      GLN  78   6.085  -2.928  -9.990

  No H/Q in entry =           8
  In of MODEL   70
    1    H    LEU  79           H        LEU  79   6.261  -6.651  -4.238
    2    HA   LEU  79           HA       LEU  79   5.298  -4.231  -3.228
    3    HB2  LEU  79           HB2      LEU  79   3.955  -6.265  -3.177
    4    HB3  LEU  79           HB3      LEU  79   5.088  -7.021  -2.060
    5    HG   LEU  79           HG       LEU  79   4.556  -5.373  -0.333
    6   HD13  LEU  79          HD11      LEU  79   4.120  -3.351  -1.382
    7   HD12  LEU  79          HD12      LEU  79   2.486  -3.855  -0.946
    8   HD11  LEU  79          HD13      LEU  79   3.067  -4.084  -2.594
    9   HD23  LEU  79          HD21      LEU  79   1.963  -5.830  -0.247
   10   HD22  LEU  79          HD22      LEU  79   3.083  -7.185  -0.138
   11   HD21  LEU  79          HD23      LEU  79   2.277  -6.835  -1.664

  No H/Q in entry =          11
  In of MODEL   70
    1    H    HIS  80           H        HIS  80   7.445  -6.598  -1.644
    2    HA   HIS  80           HA       HIS  80   7.750  -5.062   0.727
    3    HB2  HIS  80           HB2      HIS  80   9.058  -7.443  -0.471
    4    HB3  HIS  80           HB3      HIS  80   9.978  -6.560   0.748
    5    HD1  HIS  80           HD1      HIS  80   9.474  -7.192   3.089
    6    HD2  HIS  80           HD2      HIS  80   6.251  -7.995   0.570
    7    HE1  HIS  80           HE1      HIS  80   7.684  -8.271   4.533
    8    HE2  HIS  80           HE2      HIS  80   5.713  -8.765   3.006

  No H/Q in entry =           8
  In of MODEL   70
    1    H    LEU  81           H        LEU  81   9.758  -5.364  -2.181
    2    HA   LEU  81           HA       LEU  81  11.824  -3.652  -1.297
    3    HB2  LEU  81           HB2      LEU  81  10.898  -4.429  -4.063
    4    HB3  LEU  81           HB3      LEU  81  12.331  -3.444  -3.768
    5    HG   LEU  81           HG       LEU  81  11.897  -6.160  -2.498
    6   HD12  LEU  81          HD11      LEU  81  13.708  -6.811  -4.245
    7   HD11  LEU  81          HD12      LEU  81  13.164  -5.378  -5.116
    8   HD13  LEU  81          HD13      LEU  81  12.033  -6.687  -4.782
    9   HD23  LEU  81          HD21      LEU  81  14.530  -5.883  -2.478
   10   HD22  LEU  81          HD22      LEU  81  13.556  -5.110  -1.229
   11   HD21  LEU  81          HD23      LEU  81  14.151  -4.165  -2.594

  No H/Q in entry =          11
  In of MODEL   70
    1    H    MET  82           H        MET  82   8.915  -2.972  -3.239
    2    HA   MET  82           HA       MET  82   9.496  -0.254  -3.737
    3    HB2  MET  82           HB2      MET  82   6.913  -1.810  -3.619
    4    HB3  MET  82           HB3      MET  82   6.939  -0.086  -3.981
    5    HG2  MET  82           HG2      MET  82   8.512  -2.181  -5.515
    6    HG3  MET  82           HG3      MET  82   6.955  -1.535  -6.030
    7    HE3  MET  82           HE1      MET  82   7.457   1.914  -7.198
    8    HE2  MET  82           HE2      MET  82   7.076   1.692  -5.492
    9    HE1  MET  82           HE3      MET  82   6.397   0.593  -6.689

  No H/Q in entry =           9
  In of MODEL   70
    1    H    THR  83           H        THR  83   7.675  -1.828  -1.137
    2    HA   THR  83           HA       THR  83   6.856   0.531   0.190
    3    HB   THR  83           HB       THR  83   6.693  -1.043   2.206
    4    HG1  THR  83           HG1      THR  83   7.422  -3.004   1.976
    5   HG22  THR  83          HG21      THR  83   5.020  -2.582   0.733
    6   HG21  THR  83          HG22      THR  83   5.269  -1.256  -0.398
    7   HG23  THR  83          HG23      THR  83   4.630  -0.933   1.214

  No H/Q in entry =           7
  In of MODEL   70
    1    H    SER  84           H        SER  84   9.646  -1.609   0.715
    2    HA   SER  84           HA       SER  84  10.722  -0.197   2.907
    3    HB2  SER  84           HB2      SER  84  11.952  -2.056   0.883
    4    HB3  SER  84           HB3      SER  84  12.907  -1.318   2.168
    5    HG   SER  84           HG       SER  84  10.606  -2.974   2.420

  No H/Q in entry =           5
  In of MODEL   70
    1    H    MET  85           H        MET  85  11.487   0.056  -0.579
    2    HA   MET  85           HA       MET  85  13.515   1.990  -0.321
    3    HB2  MET  85           HB2      MET  85  13.104   0.717  -2.389
    4    HB3  MET  85           HB3      MET  85  11.591   1.594  -2.621
    5    HG2  MET  85           HG2      MET  85  12.825   3.720  -2.738
    6    HG3  MET  85           HG3      MET  85  14.340   2.862  -2.474
    7    HE1  MET  85           HE1      MET  85  15.162   0.978  -3.828
    8    HE3  MET  85           HE2      MET  85  15.872   2.406  -4.576
    9    HE2  MET  85           HE3      MET  85  15.237   1.118  -5.591

  No H/Q in entry =           9
  In of MODEL   70
    1    H    LEU  86           H        LEU  86  10.032   2.379  -0.838
    2    HA   LEU  86           HA       LEU  86  10.012   5.193  -1.017
    3    HB2  LEU  86           HB2      LEU  86   8.143   3.563  -1.599
    4    HB3  LEU  86           HB3      LEU  86   7.808   3.476   0.130
    5    HG   LEU  86           HG       LEU  86   7.687   6.039   0.080
    6   HD11  LEU  86          HD11      LEU  86   8.463   5.594  -2.621
    7   HD13  LEU  86          HD12      LEU  86   8.049   7.127  -1.860
    8   HD12  LEU  86          HD13      LEU  86   6.799   6.185  -2.669
    9   HD23  LEU  86          HD21      LEU  86   5.537   4.722  -1.589
   10   HD22  LEU  86          HD22      LEU  86   5.363   5.983  -0.372
   11   HD21  LEU  86          HD23      LEU  86   5.736   4.332   0.120

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ALA  87           H        ALA  87   9.505   3.019   1.726
    2    HA   ALA  87           HA       ALA  87   8.983   4.940   3.696
    3    HB1  ALA  87           HB1      ALA  87   9.746   2.107   3.608
    4    HB3  ALA  87           HB2      ALA  87   8.631   2.936   4.692
    5    HB2  ALA  87           HB3      ALA  87  10.359   2.940   5.040

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ARG  88           H        ARG  88  12.045   3.468   2.720
    2    HA   ARG  88           HA       ARG  88  13.672   4.819   4.558
    3    HB2  ARG  88           HB2      ARG  88  14.313   2.836   3.154
    4    HB3  ARG  88           HB3      ARG  88  14.485   3.928   1.782
    5    HG2  ARG  88           HG2      ARG  88  15.975   5.216   3.733
    6    HG3  ARG  88           HG3      ARG  88  16.268   3.522   4.111
    7    HD2  ARG  88           HD2      ARG  88  17.534   3.207   2.267
    8    HD3  ARG  88           HD3      ARG  88  16.413   4.097   1.232
    9    HE   ARG  88           HE       ARG  88  18.822   5.122   2.285
   10   HH21  ARG  88          HH11      ARG  88  19.203   7.335   2.094
   11   HH22  ARG  88          HH12      ARG  88  17.869   8.428   1.949
   12   HH11  ARG  88          HH21      ARG  88  15.496   5.928   2.001
   13   HH12  ARG  88          HH22      ARG  88  15.769   7.629   1.872

  No H/Q in entry =          13
  In of MODEL   70
    1    H    GLU  89           H        GLU  89  12.720   5.735   1.233
    2    HA   GLU  89           HA       GLU  89  14.305   8.070   1.082
    3    HB2  GLU  89           HB2      GLU  89  13.148   7.050  -0.869
    4    HB3  GLU  89           HB3      GLU  89  11.611   7.614  -0.214
    5    HG2  GLU  89           HG2      GLU  89  12.350   9.941  -0.372
    6    HG3  GLU  89           HG3      GLU  89  13.947   9.425  -0.906

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LEU  90           H        LEU  90  10.966   7.613   2.205
    2    HA   LEU  90           HA       LEU  90  10.492  10.353   2.782
    3    HB2  LEU  90           HB2      LEU  90   9.255   7.798   3.804
    4    HB3  LEU  90           HB3      LEU  90   8.649   9.402   4.227
    5    HG   LEU  90           HG       LEU  90   9.059   8.519   1.358
    6   HD12  LEU  90          HD11      LEU  90   6.520   8.230   1.415
    7   HD11  LEU  90          HD12      LEU  90   6.671   8.216   3.172
    8   HD13  LEU  90          HD13      LEU  90   7.472   6.974   2.208
    9   HD22  LEU  90          HD21      LEU  90   8.802  10.831   1.286
   10   HD21  LEU  90          HD22      LEU  90   7.813  10.878   2.745
   11   HD23  LEU  90          HD23      LEU  90   7.110  10.335   1.221

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  91           H        ILE  91  11.709   7.650   4.704
    2    HA   ILE  91           HA       ILE  91  11.867   9.010   7.174
    3    HB   ILE  91           HB       ILE  91  13.385   6.649   6.050
    4   HG12  ILE  91          HG12      ILE  91  11.368   6.846   8.306
    5   HG13  ILE  91          HG13      ILE  91  10.896   6.574   6.630
    6   HG22  ILE  91          HG21      ILE  91  13.847   6.425   8.692
    7   HG21  ILE  91          HG22      ILE  91  13.799   8.185   8.592
    8   HG23  ILE  91          HG23      ILE  91  14.965   7.280   7.629
    9   HD13  ILE  91          HD11      ILE  91  11.865   4.457   6.559
   10   HD12  ILE  91          HD12      ILE  91  11.270   4.523   8.218
   11   HD11  ILE  91          HD13      ILE  91  12.977   4.809   7.883

  No H/Q in entry =          11
  In of MODEL   70
    1    H    THR  92           H        THR  92  14.086   8.809   4.426
    2    HA   THR  92           HA       THR  92  16.270  10.167   5.591
    3    HB   THR  92           HB       THR  92  15.288  10.060   2.728
    4    HG1  THR  92           HG1      THR  92  16.089   8.150   3.133
    5   HG22  THR  92          HG21      THR  92  17.869  10.710   2.440
    6   HG21  THR  92          HG22      THR  92  17.571  11.534   3.970
    7   HG23  THR  92          HG23      THR  92  16.610  11.939   2.548

  No H/Q in entry =           7
  In of MODEL   70
    1    H    GLU  93           H        GLU  93  13.405  11.367   3.858
    2    HA   GLU  93           HA       GLU  93  14.043  14.118   3.976
    3    HB2  GLU  93           HB2      GLU  93  11.317  12.788   3.984
    4    HB3  GLU  93           HB3      GLU  93  11.633  14.483   3.614
    5    HG2  GLU  93           HG2      GLU  93  12.938  12.222   2.086
    6    HG3  GLU  93           HG3      GLU  93  11.403  12.929   1.597

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LEU  94           H        LEU  94  12.262  11.987   6.182
    2    HA   LEU  94           HA       LEU  94  11.480  13.944   8.058
    3    HB2  LEU  94           HB2      LEU  94  12.009  10.980   8.330
    4    HB3  LEU  94           HB3      LEU  94  11.451  11.963   9.681
    5    HG   LEU  94           HG       LEU  94   9.972  12.041   7.050
    6   HD11  LEU  94          HD11      LEU  94  10.017   9.817   9.052
    7   HD13  LEU  94          HD12      LEU  94   9.717   9.762   7.316
    8   HD12  LEU  94          HD13      LEU  94   8.445  10.298   8.413
    9   HD23  LEU  94          HD21      LEU  94   8.056  12.469   8.647
   10   HD22  LEU  94          HD22      LEU  94   9.315  13.704   8.687
   11   HD21  LEU  94          HD23      LEU  94   9.231  12.487   9.960

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  95           H        ILE  95  14.424  11.969   7.825
    2    HA   ILE  95           HA       ILE  95  15.602  12.870  10.241
    3    HB   ILE  95           HB       ILE  95  16.828  11.784   7.694
    4   HG12  ILE  95          HG12      ILE  95  16.509  10.585  10.460
    5   HG13  ILE  95          HG13      ILE  95  15.340  10.346   9.163
    6   HG21  ILE  95          HG21      ILE  95  18.092  12.568  10.339
    7   HG23  ILE  95          HG22      ILE  95  18.565  13.091   8.721
    8   HG22  ILE  95          HG23      ILE  95  18.844  11.426   9.228
    9   HD13  ILE  95          HD11      ILE  95  16.802   9.046   7.901
   10   HD12  ILE  95          HD12      ILE  95  17.265   8.588   9.537
   11   HD11  ILE  95          HD13      ILE  95  18.238   9.754   8.641

  No H/Q in entry =          11
  In of MODEL   70
    1    H    GLU  96           H        GLU  96  15.781  14.104   6.909
    2    HA   GLU  96           HA       GLU  96  17.660  16.153   7.391
    3    HB2  GLU  96           HB2      GLU  96  16.988  15.503   5.130
    4    HB3  GLU  96           HB3      GLU  96  15.354  16.086   5.428
    5    HG2  GLU  96           HG2      GLU  96  15.954  18.207   4.889
    6    HG3  GLU  96           HG3      GLU  96  17.251  18.185   6.073

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LEU  97           H        LEU  97  14.145  16.021   7.814
    2    HA   LEU  97           HA       LEU  97  13.771  18.760   8.458
    3    HB2  LEU  97           HB2      LEU  97  12.212  16.258   9.068
    4    HB3  LEU  97           HB3      LEU  97  11.723  17.812   9.740
    5    HG   LEU  97           HG       LEU  97  12.203  17.392   6.775
    6   HD12  LEU  97          HD11      LEU  97   9.678  17.304   6.653
    7   HD11  LEU  97          HD12      LEU  97   9.666  17.102   8.403
    8   HD13  LEU  97          HD13      LEU  97  10.429  15.884   7.381
    9   HD23  LEU  97          HD21      LEU  97  10.497  19.383   6.807
   10   HD22  LEU  97          HD22      LEU  97  12.183  19.715   7.203
   11   HD21  LEU  97          HD23      LEU  97  10.989  19.562   8.491

  No H/Q in entry =          11
  In of MODEL   70
    1    H    HIS  98           H        HIS  98  14.545  15.919  10.452
    2    HA   HIS  98           HA       HIS  98  14.403  17.180  12.969
    3    HB2  HIS  98           HB2      HIS  98  16.119  14.896  11.968
    4    HB3  HIS  98           HB3      HIS  98  16.123  15.433  13.650
    5    HD1  HIS  98           HD1      HIS  98  13.902  13.841  11.052
    6    HD2  HIS  98           HD2      HIS  98  13.804  14.758  15.118
    7    HE1  HIS  98           HE1      HIS  98  11.857  12.677  12.001
    8    HE2  HIS  98           HE2      HIS  98  11.777  13.228  14.472

  No H/Q in entry =           8
  In of MODEL   70
    1    H    GLU  99           H        GLU  99  16.958  17.027  10.538
    2    HA   GLU  99           HA       GLU  99  18.962  18.325  12.072
    3    HB2  GLU  99           HB2      GLU  99  19.424  17.032  10.002
    4    HB3  GLU  99           HB3      GLU  99  18.636  18.301   9.061
    5    HG2  GLU  99           HG2      GLU  99  20.269  19.944   9.856
    6    HG3  GLU  99           HG3      GLU  99  21.027  18.729  10.879

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LYS 100           H        LYS 100  16.461  19.530   9.853
    2    HA   LYS 100           HA       LYS 100  17.302  22.254  10.001
    3    HB2  LYS 100           HB2      LYS 100  14.650  21.008   9.241
    4    HB3  LYS 100           HB3      LYS 100  14.977  22.742   9.153
    5    HG2  LYS 100           HG2      LYS 100  16.944  22.263   7.689
    6    HG3  LYS 100           HG3      LYS 100  16.503  20.553   7.704
    7    HD2  LYS 100           HD2      LYS 100  14.318  21.099   6.702
    8    HD3  LYS 100           HD3      LYS 100  14.742  22.811   6.693
    9    HE2  LYS 100           HE2      LYS 100  16.695  22.301   5.236
   10    HE3  LYS 100           HE3      LYS 100  16.202  20.604   5.200
   11    HZ1  LYS 100           HZ1      LYS 100  14.414  22.827   4.365
   12    HZ3  LYS 100           HZ2      LYS 100  14.203  21.161   4.101
   13    HZ2  LYS 100           HZ3      LYS 100  15.429  22.004   3.282

  No H/Q in entry =          13
  In of MODEL   70
    1    H    LEU 101           H        LEU 101  15.169  20.240  11.961
    2    HA   LEU 101           HA       LEU 101  14.034  22.325  13.540
    3    HB2  LEU 101           HB2      LEU 101  14.427  19.368  13.921
    4    HB3  LEU 101           HB3      LEU 101  13.906  20.355  15.283
    5    HG   LEU 101           HG       LEU 101  12.493  20.470  12.612
    6   HD12  LEU 101          HD11      LEU 101  10.807  18.932  13.876
    7   HD11  LEU 101          HD12      LEU 101  12.193  18.495  14.873
    8   HD13  LEU 101          HD13      LEU 101  12.224  18.190  13.135
    9   HD21  LEU 101          HD21      LEU 101  11.845  21.270  15.464
   10   HD23  LEU 101          HD22      LEU 101  10.582  21.067  14.252
   11   HD22  LEU 101          HD23      LEU 101  11.838  22.282  14.017

  No H/Q in entry =          11
  In of MODEL   70
    1    H    LYS 102           H        LYS 102  17.172  21.666  13.107
    2    HA   LYS 102           HA       LYS 102  19.031  22.505  14.183
    3    HB2  LYS 102           HB2      LYS 102  17.241  24.048  15.316
    4    HB3  LYS 102           HB3      LYS 102  17.428  22.980  16.692
    5    HG2  LYS 102           HG2      LYS 102  19.356  24.961  15.528
    6    HG3  LYS 102           HG3      LYS 102  18.967  24.651  17.206
    7    HD2  LYS 102           HD2      LYS 102  20.604  22.714  15.520
    8    HD3  LYS 102           HD3      LYS 102  21.314  24.023  16.455
    9    HE2  LYS 102           HE2      LYS 102  20.872  21.480  17.420
   10    HE3  LYS 102           HE3      LYS 102  21.113  22.917  18.413
   11    HZ2  LYS 102           HZ1      LYS 102  19.123  21.665  19.027
   12    HZ1  LYS 102           HZ2      LYS 102  18.485  21.908  17.478
   13    HZ3  LYS 102           HZ3      LYS 102  18.736  23.232  18.506

  No H/Q in entry =          13
  In of MODEL   70
    1    H    ALA 103           H        ALA 103  16.930  20.931  16.600
    2    HA   ALA 103           HA       ALA 103  18.634  19.689  18.256
    3    HB2  ALA 103           HB1      ALA 103  17.017  17.709  18.246
    4    HB1  ALA 103           HB2      ALA 103  16.137  18.578  16.988
    5    HB3  ALA 103           HB3      ALA 103  16.325  19.294  18.588

  No H/Q in entry =           5
  In of MODEL   70
    1    H1   ALA   1           H3       ALA   1  -1.688  -6.778 -21.425
    2    H2   ALA   1           H2       ALA   1  -2.507  -8.200 -20.975
    3    H3   ALA   1           H1       ALA   1  -0.900  -8.276 -21.528
    4    HA   ALA   1           HA       ALA   1  -1.738  -8.729 -23.526
    5    HB1  ALA   1           HB1      ALA   1  -3.888  -9.411 -23.056
    6    HB2  ALA   1           HB2      ALA   1  -4.300  -7.892 -23.852
    7    HB3  ALA   1           HB3      ALA   1  -4.243  -7.976 -22.093

  No H/Q in entry =           7
  In of MODEL   70
    1    H    GLU   2           H        GLU   2  -2.545  -7.522 -25.515
    2    HA   GLU   2           HA       GLU   2  -1.111  -5.531 -26.387
    3    HB2  GLU   2           HB2      GLU   2  -4.118  -5.546 -26.709
    4    HB3  GLU   2           HB3      GLU   2  -2.981  -4.701 -27.756
    5    HG2  GLU   2           HG2      GLU   2  -2.509  -6.597 -28.913
    6    HG3  GLU   2           HG3      GLU   2  -2.229  -7.510 -27.436

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLU   3           H        GLU   3  -4.250  -4.221 -25.490
    2    HA   GLU   3           HA       GLU   3  -3.161  -1.684 -24.856
    3    HB2  GLU   3           HB2      GLU   3  -5.872  -2.953 -24.530
    4    HB3  GLU   3           HB3      GLU   3  -5.547  -1.344 -23.881
    5    HG2  GLU   3           HG2      GLU   3  -5.172  -0.420 -26.005
    6    HG3  GLU   3           HG3      GLU   3  -4.802  -1.981 -26.732

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LEU   4           H        LEU   4  -4.795  -4.019 -22.683
    2    HA   LEU   4           HA       LEU   4  -4.413  -2.800 -20.289
    3    HB2  LEU   4           HB2      LEU   4  -3.920  -5.750 -20.762
    4    HB3  LEU   4           HB3      LEU   4  -4.316  -4.999 -19.218
    5    HG   LEU   4           HG       LEU   4  -6.086  -5.038 -21.685
    6   HD13  LEU   4          HD11      LEU   4  -7.310  -6.737 -20.691
    7   HD12  LEU   4          HD12      LEU   4  -6.820  -6.288 -19.059
    8   HD11  LEU   4          HD13      LEU   4  -5.697  -7.149 -20.110
    9   HD23  LEU   4          HD21      LEU   4  -7.759  -4.201 -19.818
   10   HD22  LEU   4          HD22      LEU   4  -6.699  -3.047 -20.626
   11   HD21  LEU   4          HD23      LEU   4  -6.286  -3.647 -19.020

  No H/Q in entry =          11
  In of MODEL   70
    1    H    GLU   5           H        GLU   5  -1.945  -4.684 -22.019
    2    HA   GLU   5           HA       GLU   5   0.040  -4.437 -19.979
    3    HB2  GLU   5           HB2      GLU   5   0.052  -6.198 -21.761
    4    HB3  GLU   5           HB3      GLU   5   0.448  -4.945 -22.939
    5    HG2  GLU   5           HG2      GLU   5   2.517  -5.976 -22.264
    6    HG3  GLU   5           HG3      GLU   5   2.465  -4.377 -21.526

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLU   6           H        GLU   6  -0.561  -2.708 -23.022
    2    HA   GLU   6           HA       GLU   6   1.640  -0.915 -22.748
    3    HB2  GLU   6           HB2      GLU   6   0.470  -1.396 -24.905
    4    HB3  GLU   6           HB3      GLU   6  -0.928  -0.510 -24.297
    5    HG2  GLU   6           HG2      GLU   6   0.317   1.061 -25.593
    6    HG3  GLU   6           HG3      GLU   6   0.658   1.454 -23.910

  No H/Q in entry =           6
  In of MODEL   70
    1    H    VAL   7           H        VAL   7  -1.701  -0.930 -21.708
    2    HA   VAL   7           HA       VAL   7  -1.876   1.785 -20.868
    3    HB   VAL   7           HB       VAL   7  -3.383  -0.709 -20.038
    4   HG11  VAL   7          HG11      VAL   7  -3.710   2.185 -19.220
    5   HG13  VAL   7          HG12      VAL   7  -3.636   0.757 -18.187
    6   HG12  VAL   7          HG13      VAL   7  -5.062   1.053 -19.181
    7   HG21  VAL   7          HG21      VAL   7  -3.518   0.374 -22.425
    8   HG23  VAL   7          HG22      VAL   7  -4.443   1.638 -21.612
    9   HG22  VAL   7          HG23      VAL   7  -5.017  -0.030 -21.589

  No H/Q in entry =           9
  In of MODEL   70
    1    H    VAL   8           H        VAL   8  -0.943  -1.220 -19.228
    2    HA   VAL   8           HA       VAL   8  -0.610  -0.149 -16.630
    3    HB   VAL   8           HB       VAL   8   0.748  -2.490 -17.990
    4   HG11  VAL   8          HG11      VAL   8   0.852  -1.455 -15.154
    5   HG13  VAL   8          HG12      VAL   8   2.194  -1.908 -16.205
    6   HG12  VAL   8          HG13      VAL   8   1.148  -3.153 -15.524
    7   HG23  VAL   8          HG21      VAL   8  -1.219  -2.886 -15.788
    8   HG22  VAL   8          HG22      VAL   8  -1.041  -3.761 -17.306
    9   HG21  VAL   8          HG23      VAL   8  -1.899  -2.224 -17.274

  No H/Q in entry =           9
  In of MODEL   70
    1    H    MET   9           H        MET   9   1.637  -0.485 -19.375
    2    HA   MET   9           HA       MET   9   3.939   0.516 -18.108
    3    HB2  MET   9           HB2      MET   9   2.992   0.541 -20.970
    4    HB3  MET   9           HB3      MET   9   4.507   1.315 -20.503
    5    HG2  MET   9           HG2      MET   9   5.051  -0.937 -19.334
    6    HG3  MET   9           HG3      MET   9   3.755  -1.599 -20.330
    7    HE2  MET   9           HE1      MET   9   3.784  -0.123 -22.987
    8    HE1  MET   9           HE2      MET   9   3.711  -1.866 -22.747
    9    HE3  MET   9           HE3      MET   9   4.845  -1.190 -23.914

  No H/Q in entry =           9
  In of MODEL   70
    1    H    GLY  10           H        GLY  10   1.286   2.168 -19.787
    2    HA3  GLY  10           HA2      GLY  10   2.297   4.803 -19.537
    3    HA2  GLY  10           HA3      GLY  10   0.600   4.374 -19.745

  No H/Q in entry =           3
  In of MODEL   70
    1    H    LEU  11           H        LEU  11   0.170   2.851 -17.462
    2    HA   LEU  11           HA       LEU  11  -0.327   4.834 -15.499
    3    HB2  LEU  11           HB2      LEU  11  -0.314   1.817 -15.348
    4    HB3  LEU  11           HB3      LEU  11  -0.806   2.847 -14.005
    5    HG   LEU  11           HG       LEU  11  -2.039   2.988 -16.769
    6   HD13  LEU  11          HD11      LEU  11  -2.663   0.854 -16.018
    7   HD12  LEU  11          HD12      LEU  11  -3.996   1.870 -15.473
    8   HD11  LEU  11          HD13      LEU  11  -2.750   1.365 -14.332
    9   HD22  LEU  11          HD21      LEU  11  -2.594   5.013 -15.760
   10   HD21  LEU  11          HD22      LEU  11  -2.533   4.342 -14.130
   11   HD23  LEU  11          HD23      LEU  11  -3.914   4.003 -15.174

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  12           H        ILE  12   2.171   2.321 -15.743
    2    HA   ILE  12           HA       ILE  12   3.383   2.832 -13.238
    3    HB   ILE  12           HB       ILE  12   4.620   1.774 -15.802
    4   HG12  ILE  12          HG12      ILE  12   2.585   0.577 -14.658
    5   HG13  ILE  12          HG13      ILE  12   3.967  -0.383 -15.145
    6   HG23  ILE  12          HG21      ILE  12   6.380   2.481 -14.292
    7   HG22  ILE  12          HG22      ILE  12   6.282   0.722 -14.223
    8   HG21  ILE  12          HG23      ILE  12   5.590   1.696 -12.927
    9   HD12  ILE  12          HD11      ILE  12   3.092  -0.904 -12.853
   10   HD11  ILE  12          HD12      ILE  12   3.535   0.729 -12.362
   11   HD13  ILE  12          HD13      ILE  12   4.773  -0.403 -12.859

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  13           H        ILE  13   4.011   4.090 -16.492
    2    HA   ILE  13           HA       ILE  13   6.179   5.769 -15.762
    3    HB   ILE  13           HB       ILE  13   4.153   5.887 -18.010
    4   HG12  ILE  13          HG12      ILE  13   5.968   4.022 -17.728
    5   HG13  ILE  13          HG13      ILE  13   5.727   4.762 -19.306
    6   HG23  ILE  13          HG21      ILE  13   4.819   8.117 -17.971
    7   HG22  ILE  13          HG22      ILE  13   6.032   7.425 -19.042
    8   HG21  ILE  13          HG23      ILE  13   6.430   7.743 -17.355
    9   HD12  ILE  13          HD11      ILE  13   8.164   4.556 -18.605
   10   HD11  ILE  13          HD12      ILE  13   7.812   5.711 -17.325
   11   HD13  ILE  13          HD13      ILE  13   7.649   6.193 -19.009

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ASN  14           H        ASN  14   2.682   6.329 -16.032
    2    HA   ASN  14           HA       ASN  14   2.691   9.074 -15.391
    3    HB2  ASN  14           HB2      ASN  14   0.768   7.469 -16.225
    4    HB3  ASN  14           HB3      ASN  14   0.442   7.294 -14.506
    5   HD21  ASN  14          HD21      ASN  14  -1.555   8.490 -15.938
    6   HD22  ASN  14          HD22      ASN  14  -1.587  10.163 -15.667

  No H/Q in entry =           6
  In of MODEL   70
    1    H    SER  15           H        SER  15   2.341   6.200 -13.319
    2    HA   SER  15           HA       SER  15   2.057   7.571 -10.869
    3    HB2  SER  15           HB2      SER  15   2.568   5.474  -9.822
    4    HB3  SER  15           HB3      SER  15   1.730   5.073 -11.318
    5    HG   SER  15           HG       SER  15   3.448   3.928 -11.698

  No H/Q in entry =           5
  In of MODEL   70
    1    H    GLY  16           H        GLY  16   4.914   6.425 -12.627
    2    HA3  GLY  16           HA2      GLY  16   6.851   7.143 -10.694
    3    HA2  GLY  16           HA3      GLY  16   7.151   6.938 -12.418

  No H/Q in entry =           3
  In of MODEL   70
    1    H    GLN  17           H        GLN  17   5.499   8.928 -13.478
    2    HA   GLN  17           HA       GLN  17   7.117  11.240 -13.165
    3    HB2  GLN  17           HB2      GLN  17   4.360  10.866 -14.366
    4    HB3  GLN  17           HB3      GLN  17   5.251  12.386 -14.439
    5    HG2  GLN  17           HG2      GLN  17   6.306   9.741 -15.474
    6    HG3  GLN  17           HG3      GLN  17   5.554  10.975 -16.483
    7   HE21  GLN  17          HE21      GLN  17   8.538   9.864 -15.781
    8   HE22  GLN  17          HE22      GLN  17   9.428  11.308 -15.847

  No H/Q in entry =           8
  In of MODEL   70
    1    H    ALA  18           H        ALA  18   3.998  10.275 -11.820
    2    HA   ALA  18           HA       ALA  18   3.314  12.674 -10.551
    3    HB1  ALA  18           HB1      ALA  18   2.142  10.238 -10.778
    4    HB2  ALA  18           HB2      ALA  18   1.614  11.465  -9.630
    5    HB3  ALA  18           HB3      ALA  18   2.681  10.164  -9.101

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ARG  19           H        ARG  19   5.138   9.877  -9.275
    2    HA   ARG  19           HA       ARG  19   5.689  11.022  -6.751
    3    HB2  ARG  19           HB2      ARG  19   6.062   8.613  -7.281
    4    HB3  ARG  19           HB3      ARG  19   7.427   9.077  -8.301
    5    HG2  ARG  19           HG2      ARG  19   8.563  10.095  -6.376
    6    HG3  ARG  19           HG3      ARG  19   7.179   9.728  -5.346
    7    HD2  ARG  19           HD2      ARG  19   8.913   8.063  -4.989
    8    HD3  ARG  19           HD3      ARG  19   7.526   7.306  -5.777
    9    HE   ARG  19           HE       ARG  19   9.246   8.098  -7.822
   10   HH21  ARG  19          HH11      ARG  19  10.784   6.669  -8.673
   11   HH22  ARG  19          HH12      ARG  19  11.305   5.310  -7.739
   12   HH11  ARG  19          HH21      ARG  19   9.282   6.063  -5.047
   13   HH12  ARG  19          HH22      ARG  19  10.452   4.967  -5.685

  No H/Q in entry =          13
  In of MODEL   70
    1    H    SER  20           H        SER  20   7.509  11.025  -9.798
    2    HA   SER  20           HA       SER  20   9.776  12.402  -8.970
    3    HB2  SER  20           HB2      SER  20   9.536  11.418 -11.220
    4    HB3  SER  20           HB3      SER  20   8.351  12.655 -11.628
    5    HG   SER  20           HG       SER  20  11.054  13.083 -10.861

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LEU  21           H        LEU  21   6.700  13.724 -10.168
    2    HA   LEU  21           HA       LEU  21   7.415  16.458  -9.938
    3    HB2  LEU  21           HB2      LEU  21   4.724  15.078  -9.863
    4    HB3  LEU  21           HB3      LEU  21   4.920  16.828  -9.864
    5    HG   LEU  21           HG       LEU  21   6.096  15.023 -11.997
    6   HD12  LEU  21          HD11      LEU  21   4.143  16.117 -13.351
    7   HD11  LEU  21          HD12      LEU  21   3.408  16.356 -11.766
    8   HD13  LEU  21          HD13      LEU  21   3.794  14.728 -12.321
    9   HD22  LEU  21          HD21      LEU  21   7.253  17.056 -12.154
   10   HD21  LEU  21          HD22      LEU  21   5.882  18.011 -11.599
   11   HD23  LEU  21          HD23      LEU  21   5.896  17.365 -13.233

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ALA  22           H        ALA  22   5.864  14.190  -7.695
    2    HA   ALA  22           HA       ALA  22   5.288  16.003  -5.626
    3    HB3  ALA  22           HB1      ALA  22   4.490  13.624  -5.793
    4    HB2  ALA  22           HB2      ALA  22   5.084  14.084  -4.197
    5    HB1  ALA  22           HB3      ALA  22   6.093  13.111  -5.269

  No H/Q in entry =           5
  In of MODEL   70
    1    H    TYR  23           H        TYR  23   8.190  13.933  -6.065
    2    HA   TYR  23           HA       TYR  23   9.587  14.927  -3.810
    3    HB2  TYR  23           HB2      TYR  23  10.345  12.910  -4.967
    4    HB3  TYR  23           HB3      TYR  23  10.670  13.842  -6.428
    5    HD1  TYR  23           HD1      TYR  23  11.628  13.514  -2.833
    6    HD2  TYR  23           HD2      TYR  23  12.729  14.963  -6.724
    7    HE1  TYR  23           HE1      TYR  23  13.896  14.059  -1.989
    8    HE2  TYR  23           HE2      TYR  23  14.995  15.510  -5.879
    9    HH   TYR  23           HH       TYR  23  15.976  14.669  -2.574

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ALA  24           H        ALA  24   9.424  16.041  -7.174
    2    HA   ALA  24           HA       ALA  24  11.351  18.097  -6.923
    3    HB2  ALA  24           HB1      ALA  24  10.911  18.170  -9.132
    4    HB3  ALA  24           HB2      ALA  24   9.367  18.942  -8.773
    5    HB1  ALA  24           HB3      ALA  24   9.466  17.187  -8.906

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ALA  25           H        ALA  25   7.869  17.964  -6.306
    2    HA   ALA  25           HA       ALA  25   7.429  20.688  -5.733
    3    HB1  ALA  25           HB1      ALA  25   5.739  18.714  -5.938
    4    HB2  ALA  25           HB2      ALA  25   5.389  20.006  -4.788
    5    HB3  ALA  25           HB3      ALA  25   6.056  18.475  -4.219

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LEU  26           H        LEU  26   8.456  17.990  -3.686
    2    HA   LEU  26           HA       LEU  26   8.580  19.416  -1.247
    3    HB2  LEU  26           HB2      LEU  26   8.641  16.998  -1.244
    4    HB3  LEU  26           HB3      LEU  26  10.112  16.986  -2.214
    5    HG   LEU  26           HG       LEU  26  11.341  18.084  -0.371
    6   HD12  LEU  26          HD11      LEU  26  10.113  18.106   1.888
    7   HD11  LEU  26          HD12      LEU  26   8.624  17.991   0.951
    8   HD13  LEU  26          HD13      LEU  26   9.689  19.382   0.745
    9   HD21  LEU  26          HD21      LEU  26   9.772  15.637   0.497
   10   HD23  LEU  26          HD22      LEU  26  11.294  16.177   1.196
   11   HD22  LEU  26          HD23      LEU  26  11.243  15.621  -0.475

  No H/Q in entry =          11
  In of MODEL   70
    1    H    LYS  27           H        LYS  27  10.990  18.813  -3.770
    2    HA   LYS  27           HA       LYS  27  13.190  20.022  -2.539
    3    HB2  LYS  27           HB2      LYS  27  13.275  18.676  -4.631
    4    HB3  LYS  27           HB3      LYS  27  12.529  20.020  -5.495
    5    HG2  LYS  27           HG2      LYS  27  14.414  21.479  -4.914
    6    HG3  LYS  27           HG3      LYS  27  15.156  20.175  -3.978
    7    HD2  LYS  27           HD2      LYS  27  15.282  18.788  -6.034
    8    HD3  LYS  27           HD3      LYS  27  14.585  20.117  -6.961
    9    HE2  LYS  27           HE2      LYS  27  16.492  21.557  -6.345
   10    HE3  LYS  27           HE3      LYS  27  17.193  20.232  -5.409
   11    HZ3  LYS  27           HZ1      LYS  27  18.186  20.321  -7.595
   12    HZ2  LYS  27           HZ2      LYS  27  16.658  20.224  -8.337
   13    HZ1  LYS  27           HZ3      LYS  27  17.263  18.904  -7.454

  No H/Q in entry =          13
  In of MODEL   70
    1    H    GLN  28           H        GLN  28  10.588  21.441  -4.488
    2    HA   GLN  28           HA       GLN  28  11.583  24.081  -4.637
    3    HB2  GLN  28           HB2      GLN  28   8.869  22.824  -4.789
    4    HB3  GLN  28           HB3      GLN  28   8.979  24.576  -4.619
    5    HG2  GLN  28           HG2      GLN  28   8.927  23.670  -7.015
    6    HG3  GLN  28           HG3      GLN  28  10.229  24.796  -6.633
    7   HE21  GLN  28          HE21      GLN  28  12.405  23.805  -6.159
    8   HE22  GLN  28          HE22      GLN  28  12.788  22.299  -6.843

  No H/Q in entry =           8
  In of MODEL   70
    1    H    ALA  29           H        ALA  29   9.627  22.411  -2.204
    2    HA   ALA  29           HA       ALA  29   9.106  24.608  -0.519
    3    HB2  ALA  29           HB1      ALA  29   8.355  23.047   1.046
    4    HB1  ALA  29           HB2      ALA  29   9.561  21.848   0.580
    5    HB3  ALA  29           HB3      ALA  29   8.180  22.161  -0.468

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LYS  30           H        LYS  30  11.806  22.305  -0.590
    2    HA   LYS  30           HA       LYS  30  13.135  23.239   1.715
    3    HB2  LYS  30           HB2      LYS  30  14.216  21.942  -0.797
    4    HB3  LYS  30           HB3      LYS  30  15.202  22.287   0.626
    5    HG2  LYS  30           HG2      LYS  30  13.630  20.922   2.003
    6    HG3  LYS  30           HG3      LYS  30  12.741  20.514   0.532
    7    HD2  LYS  30           HD2      LYS  30  14.773  19.502  -0.429
    8    HD3  LYS  30           HD3      LYS  30  15.682  19.924   1.024
    9    HE2  LYS  30           HE2      LYS  30  14.158  18.511   2.376
   10    HE3  LYS  30           HE3      LYS  30  13.279  18.068   0.906
   11    HZ2  LYS  30           HZ1      LYS  30  15.049  16.466   1.666
   12    HZ1  LYS  30           HZ2      LYS  30  16.202  17.639   1.217
   13    HZ3  LYS  30           HZ3      LYS  30  15.158  16.970   0.051

  No H/Q in entry =          13
  In of MODEL   70
    1    H    GLN  31           H        GLN  31  13.044  24.449  -1.580
    2    HA   GLN  31           HA       GLN  31  15.221  26.314  -1.155
    3    HB2  GLN  31           HB2      GLN  31  13.180  26.390  -3.381
    4    HB3  GLN  31           HB3      GLN  31  14.809  27.065  -3.380
    5    HG2  GLN  31           HG2      GLN  31  15.236  24.362  -2.808
    6    HG3  GLN  31           HG3      GLN  31  13.932  24.327  -3.987
    7   HE21  GLN  31          HE21      GLN  31  16.765  23.497  -4.390
    8   HE22  GLN  31          HE22      GLN  31  17.350  24.465  -5.655

  No H/Q in entry =           8
  In of MODEL   70
    1    H    GLY  32           H        GLY  32  12.143  26.170  -0.012
    2    HA3  GLY  32           HA2      GLY  32  11.007  27.751   1.263
    3    HA2  GLY  32           HA3      GLY  32  12.149  28.973   0.715

  No H/Q in entry =           3
  In of MODEL   70
    1    H    ASP  33           H        ASP  33  10.761  27.090  -1.781
    2    HA   ASP  33           HA       ASP  33   9.127  29.385  -2.634
    3    HB2  ASP  33           HB2      ASP  33  10.190  26.954  -4.079
    4    HB3  ASP  33           HB3      ASP  33   9.053  28.085  -4.808

  No H/Q in entry =           4
  In of MODEL   70
    1    H    PHE  34           H        PHE  34   7.431  28.929  -1.072
    2    HA   PHE  34           HA       PHE  34   6.020  26.475  -0.980
    3    HB2  PHE  34           HB2      PHE  34   5.095  29.273  -0.298
    4    HB3  PHE  34           HB3      PHE  34   4.226  27.793   0.111
    5    HD1  PHE  34           HD1      PHE  34   6.506  30.161   1.330
    6    HD2  PHE  34           HD2      PHE  34   5.772  25.929   1.271
    7    HE1  PHE  34           HE1      PHE  34   7.893  29.890   3.367
    8    HE2  PHE  34           HE2      PHE  34   7.160  25.662   3.306
    9    HZ   PHE  34           HZ       PHE  34   8.215  27.643   4.354

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ALA  35           H        ALA  35   5.628  29.347  -2.988
    2    HA   ALA  35           HA       ALA  35   3.069  28.767  -4.015
    3    HB1  ALA  35           HB1      ALA  35   4.140  30.148  -6.050
    4    HB3  ALA  35           HB2      ALA  35   5.362  30.492  -4.825
    5    HB2  ALA  35           HB3      ALA  35   3.676  30.922  -4.535

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ALA  36           H        ALA  36   6.290  28.054  -5.368
    2    HA   ALA  36           HA       ALA  36   5.284  26.640  -7.614
    3    HB3  ALA  36           HB1      ALA  36   7.445  26.738  -8.229
    4    HB2  ALA  36           HB2      ALA  36   7.912  25.701  -6.879
    5    HB1  ALA  36           HB3      ALA  36   7.829  27.450  -6.662

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ALA  37           H        ALA  37   6.225  25.629  -4.360
    2    HA   ALA  37           HA       ALA  37   6.131  22.843  -4.793
    3    HB2  ALA  37           HB1      ALA  37   5.892  24.634  -2.413
    4    HB1  ALA  37           HB2      ALA  37   7.008  23.302  -2.706
    5    HB3  ALA  37           HB3      ALA  37   5.342  22.969  -2.236

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LYS  38           H        LYS  38   3.626  25.082  -3.624
    2    HA   LYS  38           HA       LYS  38   1.504  23.295  -3.405
    3    HB2  LYS  38           HB2      LYS  38   1.890  26.046  -3.150
    4    HB3  LYS  38           HB3      LYS  38   0.690  25.916  -4.429
    5    HG2  LYS  38           HG2      LYS  38  -0.777  24.609  -2.989
    6    HG3  LYS  38           HG3      LYS  38   0.465  24.531  -1.733
    7    HD2  LYS  38           HD2      LYS  38   0.309  26.870  -1.282
    8    HD3  LYS  38           HD3      LYS  38  -0.598  27.172  -2.765
    9    HE2  LYS  38           HE2      LYS  38  -2.103  27.223  -0.826
   10    HE3  LYS  38           HE3      LYS  38  -2.493  25.853  -1.870
   11    HZ3  LYS  38           HZ1      LYS  38  -1.787  24.371  -0.339
   12    HZ2  LYS  38           HZ2      LYS  38  -2.123  25.631   0.752
   13    HZ1  LYS  38           HZ3      LYS  38  -0.531  25.361   0.228

  No H/Q in entry =          13
  In of MODEL   70
    1    H    ALA  39           H        ALA  39   2.509  25.188  -6.250
    2    HA   ALA  39           HA       ALA  39   0.423  24.350  -7.956
    3    HB2  ALA  39           HB1      ALA  39   3.168  24.965  -9.007
    4    HB1  ALA  39           HB2      ALA  39   2.217  26.237  -8.240
    5    HB3  ALA  39           HB3      ALA  39   1.595  25.410  -9.668

  No H/Q in entry =           5
  In of MODEL   70
    1    H    MET  40           H        MET  40   3.644  23.009  -7.376
    2    HA   MET  40           HA       MET  40   3.522  20.993  -9.370
    3    HB2  MET  40           HB2      MET  40   5.135  21.193  -6.820
    4    HB3  MET  40           HB3      MET  40   5.370  19.936  -8.036
    5    HG2  MET  40           HG2      MET  40   5.466  22.892  -8.698
    6    HG3  MET  40           HG3      MET  40   6.900  21.970  -8.249
    7    HE3  MET  40           HE1      MET  40   7.746  19.748 -11.060
    8    HE2  MET  40           HE2      MET  40   7.178  19.433  -9.423
    9    HE1  MET  40           HE3      MET  40   8.290  20.767  -9.720

  No H/Q in entry =           9
  In of MODEL   70
    1    H    MET  41           H        MET  41   2.606  21.042  -5.947
    2    HA   MET  41           HA       MET  41   2.039  18.284  -5.673
    3    HB2  MET  41           HB2      MET  41   0.735  20.656  -4.319
    4    HB3  MET  41           HB3      MET  41   0.558  18.980  -3.814
    5    HG2  MET  41           HG2      MET  41   3.271  19.169  -3.849
    6    HG3  MET  41           HG3      MET  41   2.851  20.832  -3.451
    7    HE2  MET  41           HE1      MET  41  -0.205  19.615  -1.729
    8    HE1  MET  41           HE2      MET  41   0.630  21.119  -2.104
    9    HE3  MET  41           HE3      MET  41   0.563  20.546  -0.437

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ASP  42           H        ASP  42   0.035  21.035  -6.644
    2    HA   ASP  42           HA       ASP  42  -2.422  19.705  -6.784
    3    HB2  ASP  42           HB2      ASP  42  -1.684  22.267  -7.037
    4    HB3  ASP  42           HB3      ASP  42  -1.839  21.876  -8.746

  No H/Q in entry =           4
  In of MODEL   70
    1    H    GLN  43           H        GLN  43   0.027  20.269  -9.284
    2    HA   GLN  43           HA       GLN  43  -1.375  18.970 -11.376
    3    HB2  GLN  43           HB2      GLN  43   1.589  19.449 -10.992
    4    HB3  GLN  43           HB3      GLN  43   0.869  18.820 -12.475
    5    HG2  GLN  43           HG2      GLN  43  -0.618  20.865 -12.515
    6    HG3  GLN  43           HG3      GLN  43   0.342  21.508 -11.186
    7   HE21  GLN  43          HE21      GLN  43   0.524  23.129 -13.269
    8   HE22  GLN  43          HE22      GLN  43   1.937  22.892 -14.176

  No H/Q in entry =           8
  In of MODEL   70
    1    H    SER  44           H        SER  44   0.960  17.798  -8.985
    2    HA   SER  44           HA       SER  44   1.264  15.189 -10.014
    3    HB2  SER  44           HB2      SER  44   2.175  16.614  -7.775
    4    HB3  SER  44           HB3      SER  44   1.296  15.240  -7.106
    5    HG   SER  44           HG       SER  44   3.399  14.595  -7.533

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ARG  45           H        ARG  45  -1.041  16.532  -7.675
    2    HA   ARG  45           HA       ARG  45  -2.456  14.187  -7.044
    3    HB2  ARG  45           HB2      ARG  45  -2.629  16.355  -5.850
    4    HB3  ARG  45           HB3      ARG  45  -3.476  17.034  -7.236
    5    HG2  ARG  45           HG2      ARG  45  -5.263  15.329  -6.957
    6    HG3  ARG  45           HG3      ARG  45  -4.427  14.705  -5.534
    7    HD2  ARG  45           HD2      ARG  45  -4.607  16.973  -4.475
    8    HD3  ARG  45           HD3      ARG  45  -5.587  17.506  -5.857
    9    HE   ARG  45           HE       ARG  45  -6.726  15.142  -4.821
   10   HH21  ARG  45          HH11      ARG  45  -8.561  15.237  -3.551
   11   HH22  ARG  45          HH12      ARG  45  -8.940  16.680  -2.681
   12   HH11  ARG  45          HH21      ARG  45  -6.143  18.381  -3.792
   13   HH12  ARG  45          HH22      ARG  45  -7.565  18.461  -2.815

  No H/Q in entry =          13
  In of MODEL   70
    1    H    MET  46           H        MET  46  -3.010  16.601  -9.592
    2    HA   MET  46           HA       MET  46  -5.362  15.457 -10.657
    3    HB2  MET  46           HB2      MET  46  -3.240  17.264 -11.824
    4    HB3  MET  46           HB3      MET  46  -4.623  16.721 -12.779
    5    HG2  MET  46           HG2      MET  46  -6.167  17.671 -11.142
    6    HG3  MET  46           HG3      MET  46  -4.824  18.140 -10.105
    7    HE3  MET  46           HE1      MET  46  -5.130  18.806 -14.312
    8    HE2  MET  46           HE2      MET  46  -6.469  19.868 -13.893
    9    HE1  MET  46           HE3      MET  46  -6.475  18.195 -13.339

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ALA  47           H        ALA  47  -1.939  14.940 -11.413
    2    HA   ALA  47           HA       ALA  47  -2.302  13.219 -13.626
    3    HB3  ALA  47           HB1      ALA  47  -0.115  14.083 -13.272
    4    HB2  ALA  47           HB2      ALA  47   0.006  12.353 -12.940
    5    HB1  ALA  47           HB3      ALA  47  -0.074  13.504 -11.605

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LEU  48           H        LEU  48  -2.042  12.576 -10.153
    2    HA   LEU  48           HA       LEU  48  -2.168   9.738 -10.315
    3    HB2  LEU  48           HB2      LEU  48  -2.912  11.661  -8.099
    4    HB3  LEU  48           HB3      LEU  48  -2.839   9.909  -7.901
    5    HG   LEU  48           HG       LEU  48  -0.520  11.584  -8.894
    6   HD13  LEU  48          HD11      LEU  48  -0.795  12.354  -6.703
    7   HD12  LEU  48          HD12      LEU  48   0.353  11.034  -6.505
    8   HD11  LEU  48          HD13      LEU  48  -1.348  10.790  -6.109
    9   HD22  LEU  48          HD21      LEU  48  -0.045   9.394  -9.538
   10   HD21  LEU  48          HD22      LEU  48  -0.924   8.686  -8.183
   11   HD23  LEU  48          HD23      LEU  48   0.657   9.422  -7.921

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ASN  49           H        ASN  49  -4.604  12.257  -9.912
    2    HA   ASN  49           HA       ASN  49  -6.809  10.616  -9.376
    3    HB2  ASN  49           HB2      ASN  49  -6.861  13.028  -9.040
    4    HB3  ASN  49           HB3      ASN  49  -6.655  13.307 -10.764
    5   HD21  ASN  49          HD21      ASN  49  -8.918  11.841  -8.411
    6   HD22  ASN  49          HD22      ASN  49 -10.305  12.100  -9.353

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLU  50           H        GLU  50  -5.513  11.802 -12.461
    2    HA   GLU  50           HA       GLU  50  -7.480  10.571 -14.110
    3    HB2  GLU  50           HB2      GLU  50  -5.993  12.375 -14.921
    4    HB3  GLU  50           HB3      GLU  50  -4.612  11.287 -14.783
    5    HG2  GLU  50           HG2      GLU  50  -5.601   9.764 -16.422
    6    HG3  GLU  50           HG3      GLU  50  -7.051  10.759 -16.510

  No H/Q in entry =           6
  In of MODEL   70
    1    H    ALA  51           H        ALA  51  -4.322   9.542 -12.903
    2    HA   ALA  51           HA       ALA  51  -4.209   7.089 -14.324
    3    HB2  ALA  51           HB1      ALA  51  -2.232   6.778 -13.223
    4    HB1  ALA  51           HB2      ALA  51  -2.917   7.206 -11.655
    5    HB3  ALA  51           HB3      ALA  51  -2.446   8.473 -12.788

  No H/Q in entry =           5
  In of MODEL   70
    1    H    HIS  52           H        HIS  52  -5.375   7.930 -11.075
    2    HA   HIS  52           HA       HIS  52  -6.091   5.327 -10.248
    3    HB2  HIS  52           HB2      HIS  52  -5.931   7.291  -8.738
    4    HB3  HIS  52           HB3      HIS  52  -7.387   7.952  -9.481
    5    HD1  HIS  52           HD1      HIS  52  -9.641   6.730  -9.004
    6    HD2  HIS  52           HD2      HIS  52  -6.377   5.102  -6.986
    7    HE1  HIS  52           HE1      HIS  52 -10.589   5.167  -7.252
    8    HE2  HIS  52           HE2      HIS  52  -8.611   4.166  -6.012

  No H/Q in entry =           8
  In of MODEL   70
    1    H    LEU  53           H        LEU  53  -7.881   7.808 -12.034
    2    HA   LEU  53           HA       LEU  53 -10.401   6.545 -12.051
    3    HB2  LEU  53           HB2      LEU  53  -9.093   8.512 -13.918
    4    HB3  LEU  53           HB3      LEU  53 -10.701   7.868 -14.240
    5    HG   LEU  53           HG       LEU  53  -9.962   9.178 -11.603
    6   HD12  LEU  53          HD11      LEU  53 -11.264  11.146 -12.556
    7   HD11  LEU  53          HD12      LEU  53 -11.116  10.372 -14.134
    8   HD13  LEU  53          HD13      LEU  53  -9.675  10.886 -13.264
    9   HD22  LEU  53          HD21      LEU  53 -11.972   8.000 -11.259
   10   HD21  LEU  53          HD22      LEU  53 -12.511   8.254 -12.916
   11   HD23  LEU  53          HD23      LEU  53 -12.576   9.573 -11.762

  No H/Q in entry =          11
  In of MODEL   70
    1    H    VAL  54           H        VAL  54  -7.651   6.319 -14.285
    2    HA   VAL  54           HA       VAL  54  -8.893   4.565 -16.132
    3    HB   VAL  54           HB       VAL  54  -5.980   5.036 -15.446
    4   HG12  VAL  54          HG11      VAL  54  -5.743   3.951 -17.836
    5   HG11  VAL  54          HG12      VAL  54  -7.281   3.188 -17.435
    6   HG13  VAL  54          HG13      VAL  54  -5.870   2.915 -16.415
    7   HG22  VAL  54          HG21      VAL  54  -6.725   6.989 -16.489
    8   HG21  VAL  54          HG22      VAL  54  -7.928   6.141 -17.460
    9   HG23  VAL  54          HG23      VAL  54  -6.222   6.041 -17.888

  No H/Q in entry =           9
  In of MODEL   70
    1    H    GLN  55           H        GLN  55  -6.904   3.991 -13.231
    2    HA   GLN  55           HA       GLN  55  -6.847   1.174 -13.491
    3    HB2  GLN  55           HB2      GLN  55  -5.283   2.049 -11.969
    4    HB3  GLN  55           HB3      GLN  55  -6.489   3.028 -11.139
    5    HG2  GLN  55           HG2      GLN  55  -7.200   1.278  -9.825
    6    HG3  GLN  55           HG3      GLN  55  -6.988   0.090 -11.104
    7   HE21  GLN  55          HE21      GLN  55  -5.383  -1.380 -10.610
    8   HE22  GLN  55          HE22      GLN  55  -3.995  -1.046  -9.696

  No H/Q in entry =           8
  In of MODEL   70
    1    H    THR  56           H        THR  56  -9.154   3.362 -11.876
    2    HA   THR  56           HA       THR  56 -10.763   1.497 -10.591
    3    HB   THR  56           HB       THR  56 -11.823   3.902 -12.095
    4    HG1  THR  56           HG1      THR  56 -10.136   3.684  -9.945
    5   HG23  THR  56          HG21      THR  56 -13.564   3.889 -10.450
    6   HG22  THR  56          HG22      THR  56 -12.727   2.674  -9.483
    7   HG21  THR  56          HG23      THR  56 -13.422   2.236 -11.044

  No H/Q in entry =           7
  In of MODEL   70
    1    H    LYS  57           H        LYS  57 -10.947   2.586 -13.976
    2    HA   LYS  57           HA       LYS  57 -13.123   0.926 -14.734
    3    HB2  LYS  57           HB2      LYS  57 -12.221   2.868 -16.048
    4    HB3  LYS  57           HB3      LYS  57 -10.794   1.911 -16.415
    5    HG2  LYS  57           HG2      LYS  57 -12.175   0.251 -17.576
    6    HG3  LYS  57           HG3      LYS  57 -13.630   1.155 -17.175
    7    HD2  LYS  57           HD2      LYS  57 -12.786   3.084 -18.481
    8    HD3  LYS  57           HD3      LYS  57 -11.342   2.166 -18.899
    9    HE2  LYS  57           HE2      LYS  57 -12.771   1.870 -20.771
   10    HE3  LYS  57           HE3      LYS  57 -12.983   0.383 -19.847
   11    HZ3  LYS  57           HZ1      LYS  57 -15.065   0.945 -19.236
   12    HZ2  LYS  57           HZ2      LYS  57 -15.006   1.844 -20.678
   13    HZ1  LYS  57           HZ3      LYS  57 -14.740   2.609 -19.183

  No H/Q in entry =          13
  In of MODEL   70
    1    H    LEU  58           H        LEU  58  -9.624   0.452 -14.673
    2    HA   LEU  58           HA       LEU  58  -9.661  -2.063 -15.965
    3    HB2  LEU  58           HB2      LEU  58  -7.614  -0.798 -14.152
    4    HB3  LEU  58           HB3      LEU  58  -7.371  -2.322 -15.008
    5    HG   LEU  58           HG       LEU  58  -8.091   0.293 -16.370
    6   HD11  LEU  58          HD11      LEU  58  -5.461  -0.977 -15.676
    7   HD13  LEU  58          HD12      LEU  58  -5.935   0.720 -15.626
    8   HD12  LEU  58          HD13      LEU  58  -5.603  -0.054 -17.173
    9   HD22  LEU  58          HD21      LEU  58  -8.683  -1.260 -17.963
   10   HD21  LEU  58          HD22      LEU  58  -7.659  -2.521 -17.281
   11   HD23  LEU  58          HD23      LEU  58  -6.951  -1.255 -18.284

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  59           H        ILE  59 -10.476  -1.154 -12.714
    2    HA   ILE  59           HA       ILE  59 -10.160  -3.926 -11.768
    3    HB   ILE  59           HB       ILE  59  -9.693  -1.663 -10.368
    4   HG12  ILE  59          HG12      ILE  59 -11.086  -3.995  -9.038
    5   HG13  ILE  59          HG13      ILE  59  -9.450  -4.105  -9.637
    6   HG22  ILE  59          HG21      ILE  59 -12.464  -2.361  -9.436
    7   HG21  ILE  59          HG22      ILE  59 -12.222  -1.112 -10.636
    8   HG23  ILE  59          HG23      ILE  59 -11.506  -0.956  -9.033
    9   HD11  ILE  59          HD11      ILE  59 -10.354  -1.970  -7.724
   10   HD13  ILE  59          HD12      ILE  59  -8.698  -2.340  -8.185
   11   HD12  ILE  59          HD13      ILE  59  -9.615  -3.479  -7.199

  No H/Q in entry =          11
  In of MODEL   70
    1    H    GLU  60           H        GLU  60 -12.689  -1.579 -12.578
    2    HA   GLU  60           HA       GLU  60 -14.893  -3.070 -11.570
    3    HB2  GLU  60           HB2      GLU  60 -15.281  -0.782 -12.084
    4    HB3  GLU  60           HB3      GLU  60 -14.620  -0.953 -13.707
    5    HG2  GLU  60           HG2      GLU  60 -17.068  -0.850 -13.812
    6    HG3  GLU  60           HG3      GLU  60 -16.519  -2.441 -14.297

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLY  61           H        GLY  61 -13.215  -3.072 -14.682
    2    HA3  GLY  61           HA2      GLY  61 -14.953  -5.295 -15.577
    3    HA2  GLY  61           HA3      GLY  61 -14.094  -4.200 -16.653

  No H/Q in entry =           3
  In of MODEL   70
    1    H    ASP  62           H        ASP  62 -12.738  -5.662 -13.768
    2    HA   ASP  62           HA       ASP  62 -10.534  -6.731 -15.287
    3    HB2  ASP  62           HB2      ASP  62  -9.763  -7.475 -13.015
    4    HB3  ASP  62           HB3      ASP  62 -10.084  -5.748 -13.133

  No H/Q in entry =           4
  In of MODEL   70
    1    H    ALA  63           H        ALA  63 -13.609  -7.937 -14.768
    2    HA   ALA  63           HA       ALA  63 -13.200 -10.651 -14.057
    3    HB1  ALA  63           HB1      ALA  63 -15.275  -9.598 -16.009
    4    HB2  ALA  63           HB2      ALA  63 -15.419  -9.403 -14.263
    5    HB3  ALA  63           HB3      ALA  63 -15.407 -11.018 -14.973

  No H/Q in entry =           5
  In of MODEL   70
    1    H    GLY  64           H        GLY  64 -13.120  -8.965 -17.149
    2    HA3  GLY  64           HA2      GLY  64 -12.473  -9.597 -19.258
    3    HA2  GLY  64           HA3      GLY  64 -11.233 -10.527 -18.425

  No H/Q in entry =           3
  In of MODEL   70
    1    H    GLU  65           H        GLU  65 -11.243 -12.661 -18.799
    2    HA   GLU  65           HA       GLU  65 -13.072 -13.914 -20.472
    3    HB2  GLU  65           HB2      GLU  65 -11.241 -15.142 -18.410
    4    HB3  GLU  65           HB3      GLU  65 -12.089 -16.049 -19.662
    5    HG2  GLU  65           HG2      GLU  65 -10.178 -13.757 -20.197
    6    HG3  GLU  65           HG3      GLU  65  -9.753 -15.463 -20.315

  No H/Q in entry =           6
  In of MODEL   70
    1    H    GLY  66           H        GLY  66 -13.934 -16.185 -19.603
    2    HA3  GLY  66           HA2      GLY  66 -16.370 -15.667 -18.294
    3    HA2  GLY  66           HA3      GLY  66 -15.723 -17.249 -18.685

  No H/Q in entry =           3
  In of MODEL   70
    1    H    LYS  67           H        LYS  67 -13.366 -17.067 -17.124
    2    HA   LYS  67           HA       LYS  67 -14.410 -17.916 -14.614
    3    HB2  LYS  67           HB2      LYS  67 -11.602 -17.612 -15.665
    4    HB3  LYS  67           HB3      LYS  67 -11.984 -18.289 -14.076
    5    HG2  LYS  67           HG2      LYS  67 -13.430 -19.983 -15.132
    6    HG3  LYS  67           HG3      LYS  67 -13.070 -19.307 -16.720
    7    HD2  LYS  67           HD2      LYS  67 -10.686 -19.854 -16.421
    8    HD3  LYS  67           HD3      LYS  67 -11.038 -20.520 -14.825
    9    HE2  LYS  67           HE2      LYS  67 -12.557 -22.179 -15.850
   10    HE3  LYS  67           HE3      LYS  67 -12.196 -21.519 -17.446
   11    HZ2  LYS  67           HZ1      LYS  67 -10.879 -23.556 -16.456
   12    HZ1  LYS  67           HZ2      LYS  67  -9.941 -22.317 -15.771
   13    HZ3  LYS  67           HZ3      LYS  67 -10.129 -22.412 -17.456

  No H/Q in entry =          13
  In of MODEL   70
    1    H    MET  68           H        MET  68 -13.600 -17.291 -12.547
    2    HA   MET  68           HA       MET  68 -14.160 -14.629 -11.895
    3    HB2  MET  68           HB2      MET  68 -12.811 -16.829 -10.338
    4    HB3  MET  68           HB3      MET  68 -13.272 -15.279  -9.636
    5    HG2  MET  68           HG2      MET  68 -15.614 -15.672 -10.291
    6    HG3  MET  68           HG3      MET  68 -15.158 -17.218 -11.008
    7    HE2  MET  68           HE1      MET  68 -16.637 -19.057  -9.119
    8    HE1  MET  68           HE2      MET  68 -17.226 -17.494  -9.679
    9    HE3  MET  68           HE3      MET  68 -17.318 -17.900  -7.966

  No H/Q in entry =           9
  In of MODEL   70
    1    H    LYS  69           H        LYS  69 -10.980 -16.214 -12.285
    2    HA   LYS  69           HA       LYS  69  -9.270 -14.491 -11.122
    3    HB2  LYS  69           HB2      LYS  69  -8.599 -16.506 -12.353
    4    HB3  LYS  69           HB3      LYS  69  -8.869 -15.662 -13.879
    5    HG2  LYS  69           HG2      LYS  69  -7.167 -13.999 -13.298
    6    HG3  LYS  69           HG3      LYS  69  -6.937 -14.755 -11.722
    7    HD2  LYS  69           HD2      LYS  69  -6.188 -16.835 -12.834
    8    HD3  LYS  69           HD3      LYS  69  -6.389 -16.057 -14.405
    9    HE2  LYS  69           HE2      LYS  69  -4.729 -14.348 -13.788
   10    HE3  LYS  69           HE3      LYS  69  -4.540 -15.092 -12.203
   11    HZ1  LYS  69           HZ1      LYS  69  -4.016 -17.196 -13.570
   12    HZ3  LYS  69           HZ2      LYS  69  -2.818 -16.004 -13.400
   13    HZ2  LYS  69           HZ3      LYS  69  -3.715 -16.112 -14.839

  No H/Q in entry =          13
  In of MODEL   70
    1    H    VAL  70           H        VAL  70  -7.935 -12.700 -11.688
    2    HA   VAL  70           HA       VAL  70  -9.169 -10.820 -13.627
    3    HB   VAL  70           HB       VAL  70  -8.363  -9.022 -12.122
    4   HG13  VAL  70          HG11      VAL  70 -10.190  -9.181 -10.662
    5   HG12  VAL  70          HG12      VAL  70  -9.984 -10.919 -10.444
    6   HG11  VAL  70          HG13      VAL  70 -10.654 -10.293 -11.950
    7   HG21  VAL  70          HG21      VAL  70  -7.435 -11.403 -10.496
    8   HG23  VAL  70          HG22      VAL  70  -7.770  -9.849  -9.734
    9   HG22  VAL  70          HG23      VAL  70  -6.513  -9.974 -10.962

  No H/Q in entry =           9
  In of MODEL   70
    1    H    SER  71           H        SER  71  -7.604  -9.152 -14.398
    2    HA   SER  71           HA       SER  71  -5.361 -10.313 -15.660
    3    HB2  SER  71           HB2      SER  71  -6.538  -8.266 -16.471
    4    HB3  SER  71           HB3      SER  71  -5.875  -7.380 -15.101
    5    HG   SER  71           HG       SER  71  -4.656  -8.294 -17.414

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LEU  72           H        LEU  72  -3.348 -10.623 -15.007
    2    HA   LEU  72           HA       LEU  72  -2.630 -10.419 -12.294
    3    HB2  LEU  72           HB2      LEU  72  -0.978 -10.869 -14.775
    4    HB3  LEU  72           HB3      LEU  72  -0.318 -10.948 -13.145
    5    HG   LEU  72           HG       LEU  72  -2.691 -12.611 -14.048
    6   HD11  LEU  72          HD11      LEU  72  -0.611 -13.120 -15.355
    7   HD13  LEU  72          HD12      LEU  72  -1.137 -14.461 -14.337
    8   HD12  LEU  72          HD13      LEU  72   0.215 -13.448 -13.832
    9   HD23  LEU  72          HD21      LEU  72  -1.723 -14.034 -12.075
   10   HD22  LEU  72          HD22      LEU  72  -2.675 -12.612 -11.674
   11   HD21  LEU  72          HD23      LEU  72  -0.917 -12.542 -11.604

  No H/Q in entry =          11
  In of MODEL   70
    1    H    VAL  73           H        VAL  73  -1.883  -8.411 -15.072
    2    HA   VAL  73           HA       VAL  73   0.058  -6.737 -13.965
    3    HB   VAL  73           HB       VAL  73  -0.307  -5.319 -15.823
    4   HG13  VAL  73          HG11      VAL  73  -0.150  -6.854 -17.612
    5   HG12  VAL  73          HG12      VAL  73  -1.254  -7.995 -16.845
    6   HG11  VAL  73          HG13      VAL  73   0.378  -7.784 -16.211
    7   HG21  VAL  73          HG21      VAL  73  -3.094  -6.412 -15.655
    8   HG23  VAL  73          HG22      VAL  73  -2.491  -5.864 -17.217
    9   HG22  VAL  73          HG23      VAL  73  -2.561  -4.743 -15.857

  No H/Q in entry =           9
  In of MODEL   70
    1    H    LEU  74           H        LEU  74  -3.342  -6.809 -13.413
    2    HA   LEU  74           HA       LEU  74  -3.926  -4.146 -12.800
    3    HB2  LEU  74           HB2      LEU  74  -5.677  -5.786 -12.977
    4    HB3  LEU  74           HB3      LEU  74  -5.000  -6.723 -11.648
    5    HG   LEU  74           HG       LEU  74  -5.444  -4.856 -10.096
    6   HD12  LEU  74          HD11      LEU  74  -7.001  -3.034 -11.067
    7   HD11  LEU  74          HD12      LEU  74  -6.401  -3.544 -12.644
    8   HD13  LEU  74          HD13      LEU  74  -5.282  -2.906 -11.437
    9   HD23  LEU  74          HD21      LEU  74  -8.001  -5.202 -11.570
   10   HD22  LEU  74          HD22      LEU  74  -7.636  -5.393  -9.870
   11   HD21  LEU  74          HD23      LEU  74  -7.183  -6.650 -10.994

  No H/Q in entry =          11
  In of MODEL   70
    1    H    VAL  75           H        VAL  75  -2.923  -6.747 -10.638
    2    HA   VAL  75           HA       VAL  75  -2.708  -5.199  -8.293
    3    HB   VAL  75           HB       VAL  75  -1.241  -7.712  -9.081
    4   HG11  VAL  75          HG11      VAL  75  -1.438  -6.240  -6.415
    5   HG13  VAL  75          HG12      VAL  75   0.023  -6.517  -7.352
    6   HG12  VAL  75          HG13      VAL  75  -0.808  -7.874  -6.608
    7   HG21  VAL  75          HG21      VAL  75  -3.677  -7.121  -7.362
    8   HG23  VAL  75          HG22      VAL  75  -2.918  -8.707  -7.503
    9   HG22  VAL  75          HG23      VAL  75  -3.677  -7.963  -8.912

  No H/Q in entry =           9
  In of MODEL   70
    1    H    GLU  76           H        GLU  76  -0.305  -5.990 -10.826
    2    HA   GLU  76           HA       GLU  76   1.896  -4.672  -9.664
    3    HB2  GLU  76           HB2      GLU  76   2.014  -6.163 -11.676
    4    HB3  GLU  76           HB3      GLU  76   1.221  -4.911 -12.619
    5    HG2  GLU  76           HG2      GLU  76   3.101  -3.374 -12.189
    6    HG3  GLU  76           HG3      GLU  76   3.912  -4.595 -11.227

  No H/Q in entry =           6
  In of MODEL   70
    1    H    ALA  77           H        ALA  77  -0.616  -3.436 -11.856
    2    HA   ALA  77           HA       ALA  77   0.408  -0.803 -12.029
    3    HB3  ALA  77           HB1      ALA  77  -2.395  -1.895 -12.363
    4    HB1  ALA  77           HB2      ALA  77  -1.228  -1.533 -13.634
    5    HB2  ALA  77           HB3      ALA  77  -1.954  -0.222 -12.705

  No H/Q in entry =           5
  In of MODEL   70
    1    H    GLN  78           H        GLN  78  -1.884  -2.331  -9.823
    2    HA   GLN  78           HA       GLN  78  -2.663  -0.002  -8.422
    3    HB2  GLN  78           HB2      GLN  78  -3.800  -2.251  -8.342
    4    HB3  GLN  78           HB3      GLN  78  -2.474  -2.823  -7.332
    5    HG2  GLN  78           HG2      GLN  78  -2.979  -1.083  -5.671
    6    HG3  GLN  78           HG3      GLN  78  -4.299  -0.494  -6.680
    7   HE21  GLN  78          HE21      GLN  78  -4.814  -1.455  -4.037
    8   HE22  GLN  78          HE22      GLN  78  -5.694  -2.902  -4.154

  No H/Q in entry =           8
  In of MODEL   70
    1    H    LEU  79           H        LEU  79  -0.014  -2.292  -7.968
    2    HA   LEU  79           HA       LEU  79   0.968  -1.408  -5.509
    3    HB2  LEU  79           HB2      LEU  79   1.815  -3.427  -6.576
    4    HB3  LEU  79           HB3      LEU  79   2.476  -2.483  -7.908
    5    HG   LEU  79           HG       LEU  79   4.042  -1.364  -6.400
    6   HD13  LEU  79          HD11      LEU  79   3.037  -1.107  -4.335
    7   HD12  LEU  79          HD12      LEU  79   4.099  -2.470  -3.990
    8   HD11  LEU  79          HD13      LEU  79   2.390  -2.748  -4.323
    9   HD23  LEU  79          HD21      LEU  79   5.225  -3.527  -5.496
   10   HD22  LEU  79          HD22      LEU  79   5.028  -3.324  -7.234
   11   HD21  LEU  79          HD23      LEU  79   3.935  -4.381  -6.344

  No H/Q in entry =          11
  In of MODEL   70
    1    H    HIS  80           H        HIS  80   1.858  -0.301  -8.779
    2    HA   HIS  80           HA       HIS  80   3.688   1.665  -7.853
    3    HB2  HIS  80           HB2      HIS  80   2.395   0.987 -10.439
    4    HB3  HIS  80           HB3      HIS  80   3.009   2.632 -10.266
    5    HD1  HIS  80           HD1      HIS  80   5.415   2.904 -10.783
    6    HD2  HIS  80           HD2      HIS  80   4.547  -0.997  -9.595
    7    HE1  HIS  80           HE1      HIS  80   7.590   1.602 -10.945
    8    HE2  HIS  80           HE2      HIS  80   7.072  -0.779 -10.225

  No H/Q in entry =           8
  In of MODEL   70
    1    H    LEU  81           H        LEU  81   0.288   1.865  -8.839
    2    HA   LEU  81           HA       LEU  81   0.044   4.660  -8.508
    3    HB2  LEU  81           HB2      LEU  81  -1.996   2.438  -8.434
    4    HB3  LEU  81           HB3      LEU  81  -2.429   4.146  -8.342
    5    HG   LEU  81           HG       LEU  81  -0.745   2.978 -10.575
    6   HD12  LEU  81          HD11      LEU  81  -2.971   3.323 -11.878
    7   HD11  LEU  81          HD12      LEU  81  -3.730   3.263 -10.288
    8   HD13  LEU  81          HD13      LEU  81  -2.802   1.885 -10.874
    9   HD23  LEU  81          HD21      LEU  81  -1.816   5.135 -11.673
   10   HD22  LEU  81          HD22      LEU  81  -0.399   5.289 -10.637
   11   HD21  LEU  81          HD23      LEU  81  -2.001   5.655 -10.000

  No H/Q in entry =          11
  In of MODEL   70
    1    H    MET  82           H        MET  82  -0.650   1.980  -6.262
    2    HA   MET  82           HA       MET  82  -1.689   3.576  -4.176
    3    HB2  MET  82           HB2      MET  82  -0.344   0.874  -4.214
    4    HB3  MET  82           HB3      MET  82  -0.918   1.605  -2.717
    5    HG2  MET  82           HG2      MET  82  -2.651   1.132  -5.162
    6    HG3  MET  82           HG3      MET  82  -2.587   0.056  -3.767
    7    HE3  MET  82           HE1      MET  82  -4.298   1.723  -0.955
    8    HE2  MET  82           HE2      MET  82  -2.565   1.982  -1.136
    9    HE1  MET  82           HE3      MET  82  -3.268   0.432  -1.592

  No H/Q in entry =           9
  In of MODEL   70
    1    H    THR  83           H        THR  83   1.601   2.455  -4.859
    2    HA   THR  83           HA       THR  83   2.826   3.545  -2.555
    3    HB   THR  83           HB       THR  83   4.923   3.468  -4.025
    4    HG1  THR  83           HG1      THR  83   4.682   2.945  -6.050
    5   HG22  THR  83          HG21      THR  83   4.452   0.815  -4.359
    6   HG21  THR  83          HG22      THR  83   3.164   1.208  -3.222
    7   HG23  THR  83          HG23      THR  83   4.846   1.533  -2.798

  No H/Q in entry =           7
  In of MODEL   70
    1    H    SER  84           H        SER  84   2.476   4.830  -5.856
    2    HA   SER  84           HA       SER  84   3.840   7.256  -5.396
    3    HB2  SER  84           HB2      SER  84   1.766   6.447  -7.420
    4    HB3  SER  84           HB3      SER  84   2.461   8.067  -7.393
    5    HG   SER  84           HG       SER  84   3.808   5.577  -7.683

  No H/Q in entry =           5
  In of MODEL   70
    1    H    MET  85           H        MET  85   0.338   6.537  -5.232
    2    HA   MET  85           HA       MET  85  -0.496   9.156  -4.631
    3    HB2  MET  85           HB2      MET  85  -2.037   7.364  -5.305
    4    HB3  MET  85           HB3      MET  85  -1.760   6.554  -3.763
    5    HG2  MET  85           HG2      MET  85  -2.637   8.514  -2.559
    6    HG3  MET  85           HG3      MET  85  -2.879   9.353  -4.090
    7    HE1  MET  85           HE1      MET  85  -4.178   8.533  -5.975
    8    HE3  MET  85           HE2      MET  85  -5.369   9.441  -5.047
    9    HE2  MET  85           HE3      MET  85  -5.813   7.893  -5.761

  No H/Q in entry =           9
  In of MODEL   70
    1    H    LEU  86           H        LEU  86   0.390   6.482  -2.487
    2    HA   LEU  86           HA       LEU  86  -0.134   7.789  -0.045
    3    HB2  LEU  86           HB2      LEU  86   0.303   5.313  -0.440
    4    HB3  LEU  86           HB3      LEU  86   2.015   5.724  -0.532
    5    HG   LEU  86           HG       LEU  86   1.699   6.887   1.737
    6   HD11  LEU  86          HD11      LEU  86  -1.003   6.152   1.260
    7   HD13  LEU  86          HD12      LEU  86  -0.331   6.890   2.712
    8   HD12  LEU  86          HD13      LEU  86  -0.442   5.135   2.591
    9   HD23  LEU  86          HD21      LEU  86   1.235   3.899   1.856
   10   HD22  LEU  86          HD22      LEU  86   2.247   4.896   2.899
   11   HD21  LEU  86          HD23      LEU  86   2.748   4.567   1.241

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ALA  87           H        ALA  87   2.847   7.461  -1.929
    2    HA   ALA  87           HA       ALA  87   4.566   8.850  -0.200
    3    HB3  ALA  87           HB1      ALA  87   4.654   7.838  -2.908
    4    HB2  ALA  87           HB2      ALA  87   5.990   8.152  -1.804
    5    HB1  ALA  87           HB3      ALA  87   5.394   9.441  -2.848

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ARG  88           H        ARG  88   2.638  10.012  -2.923
    2    HA   ARG  88           HA       ARG  88   3.445  12.692  -2.802
    3    HB2  ARG  88           HB2      ARG  88   2.180  11.556  -4.663
    4    HB3  ARG  88           HB3      ARG  88   0.723  11.717  -3.682
    5    HG2  ARG  88           HG2      ARG  88   1.775  14.284  -3.595
    6    HG3  ARG  88           HG3      ARG  88   2.195  13.766  -5.225
    7    HD2  ARG  88           HD2      ARG  88   0.057  13.874  -5.926
    8    HD3  ARG  88           HD3      ARG  88  -0.544  13.027  -4.500
    9    HE   ARG  88           HE       ARG  88  -0.697  15.807  -4.916
   10   HH21  ARG  88          HH11      ARG  88  -1.211  17.142  -3.178
   11   HH22  ARG  88          HH12      ARG  88  -0.924  16.599  -1.560
   12   HH11  ARG  88          HH21      ARG  88   0.285  13.530  -2.542
   13   HH12  ARG  88          HH22      ARG  88  -0.095  14.548  -1.200

  No H/Q in entry =          13
  In of MODEL   70
    1    H    GLU  89           H        GLU  89   0.717  11.050  -1.169
    2    HA   GLU  89           HA       GLU  89  -0.362  13.375   0.037
    3    HB2  GLU  89           HB2      GLU  89  -1.509  11.151  -0.054
    4    HB3  GLU  89           HB3      GLU  89  -0.395  10.580   1.188
    5    HG2  GLU  89           HG2      GLU  89  -1.195  12.287   2.748
    6    HG3  GLU  89           HG3      GLU  89  -2.236  12.973   1.503

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LEU  90           H        LEU  90   2.056  11.049   1.213
    2    HA   LEU  90           HA       LEU  90   2.424  12.286   3.744
    3    HB2  LEU  90           HB2      LEU  90   4.177  10.490   2.068
    4    HB3  LEU  90           HB3      LEU  90   4.600  10.999   3.708
    5    HG   LEU  90           HG       LEU  90   1.948   9.690   3.041
    6   HD12  LEU  90          HD11      LEU  90   3.059   7.628   4.049
    7   HD11  LEU  90          HD12      LEU  90   4.593   8.463   3.811
    8   HD13  LEU  90          HD13      LEU  90   3.578   8.071   2.422
    9   HD22  LEU  90          HD21      LEU  90   1.693  10.615   5.163
   10   HD21  LEU  90          HD22      LEU  90   3.408  10.484   5.548
   11   HD23  LEU  90          HD23      LEU  90   2.382   9.050   5.593

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  91           H        ILE  91   4.038  12.650   0.621
    2    HA   ILE  91           HA       ILE  91   6.039  14.453   1.465
    3    HB   ILE  91           HB       ILE  91   4.725  13.984  -1.217
    4   HG12  ILE  91          HG12      ILE  91   7.549  13.456  -0.239
    5   HG13  ILE  91          HG13      ILE  91   6.250  12.276  -0.080
    6   HG22  ILE  91          HG21      ILE  91   6.968  15.300  -1.900
    7   HG21  ILE  91          HG22      ILE  91   6.667  16.104  -0.359
    8   HG23  ILE  91          HG23      ILE  91   5.447  16.151  -1.630
    9   HD13  ILE  91          HD11      ILE  91   6.077  11.958  -2.388
   10   HD12  ILE  91          HD12      ILE  91   7.814  12.176  -2.171
   11   HD11  ILE  91          HD13      ILE  91   6.823  13.514  -2.757

  No H/Q in entry =          11
  In of MODEL   70
    1    H    THR  92           H        THR  92   2.685  14.934   0.452
    2    HA   THR  92           HA       THR  92   2.699  17.758   0.395
    3    HB   THR  92           HB       THR  92   0.502  15.793   1.089
    4    HG1  THR  92           HG1      THR  92   0.808  15.613  -0.996
    5   HG22  THR  92          HG21      THR  92  -0.866  17.976   0.367
    6   HG21  THR  92          HG22      THR  92   0.537  18.780   1.067
    7   HG23  THR  92          HG23      THR  92  -0.422  17.671   2.046

  No H/Q in entry =           7
  In of MODEL   70
    1    H    GLU  93           H        GLU  93   2.114  15.462   3.046
    2    HA   GLU  93           HA       GLU  93   1.606  17.371   5.065
    3    HB2  GLU  93           HB2      GLU  93   2.879  14.627   5.300
    4    HB3  GLU  93           HB3      GLU  93   2.199  15.563   6.633
    5    HG2  GLU  93           HG2      GLU  93   0.580  14.811   4.191
    6    HG3  GLU  93           HG3      GLU  93   0.665  13.785   5.618

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LEU  94           H        LEU  94   4.593  15.847   3.919
    2    HA   LEU  94           HA       LEU  94   6.356  16.967   5.811
    3    HB2  LEU  94           HB2      LEU  94   6.749  15.998   2.980
    4    HB3  LEU  94           HB3      LEU  94   8.086  16.635   3.932
    5    HG   LEU  94           HG       LEU  94   6.313  14.463   5.062
    6   HD11  LEU  94          HD11      LEU  94   8.408  14.209   2.934
    7   HD13  LEU  94          HD12      LEU  94   6.948  13.256   3.192
    8   HD12  LEU  94          HD13      LEU  94   8.368  12.981   4.201
    9   HD23  LEU  94          HD21      LEU  94   8.493  13.893   6.217
   10   HD22  LEU  94          HD22      LEU  94   7.848  15.481   6.634
   11   HD21  LEU  94          HD23      LEU  94   9.187  15.342   5.494

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  95           H        ILE  95   5.239  18.159   2.661
    2    HA   ILE  95           HA       ILE  95   6.846  20.493   2.607
    3    HB   ILE  95           HB       ILE  95   4.194  19.850   1.296
    4   HG12  ILE  95          HG12      ILE  95   6.989  20.148   0.164
    5   HG13  ILE  95          HG13      ILE  95   6.317  18.604   0.676
    6   HG21  ILE  95          HG21      ILE  95   5.980  22.292   1.082
    7   HG23  ILE  95          HG22      ILE  95   4.253  22.248   1.435
    8   HG22  ILE  95          HG23      ILE  95   4.833  21.841  -0.180
    9   HD13  ILE  95          HD11      ILE  95   4.759  18.552  -1.056
   10   HD12  ILE  95          HD12      ILE  95   6.121  19.352  -1.840
   11   HD11  ILE  95          HD13      ILE  95   4.761  20.306  -1.249

  No H/Q in entry =          11
  In of MODEL   70
    1    H    GLU  96           H        GLU  96   3.585  19.887   3.896
    2    HA   GLU  96           HA       GLU  96   3.002  22.542   4.649
    3    HB2  GLU  96           HB2      GLU  96   1.302  20.783   4.656
    4    HB3  GLU  96           HB3      GLU  96   2.149  19.942   5.952
    5    HG2  GLU  96           HG2      GLU  96   1.145  21.238   7.521
    6    HG3  GLU  96           HG3      GLU  96   1.703  22.705   6.727

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LEU  97           H        LEU  97   4.805  19.962   6.274
    2    HA   LEU  97           HA       LEU  97   5.178  21.303   8.747
    3    HB2  LEU  97           HB2      LEU  97   6.685  19.113   7.333
    4    HB3  LEU  97           HB3      LEU  97   7.283  19.787   8.847
    5    HG   LEU  97           HG       LEU  97   4.458  18.736   8.530
    6   HD12  LEU  97          HD11      LEU  97   5.366  16.708   9.742
    7   HD11  LEU  97          HD12      LEU  97   6.987  17.316   9.402
    8   HD13  LEU  97          HD13      LEU  97   5.912  16.875   8.073
    9   HD23  LEU  97          HD21      LEU  97   4.902  18.432  11.095
   10   HD22  LEU  97          HD22      LEU  97   4.547  20.050  10.492
   11   HD21  LEU  97          HD23      LEU  97   6.211  19.584  10.839

  No H/Q in entry =          11
  In of MODEL   70
    1    H    HIS  98           H        HIS  98   7.054  21.294   5.725
    2    HA   HIS  98           HA       HIS  98   9.229  22.840   6.630
    3    HB2  HIS  98           HB2      HIS  98   7.937  22.608   3.902
    4    HB3  HIS  98           HB3      HIS  98   9.391  23.564   4.196
    5    HD1  HIS  98           HD1      HIS  98   8.126  20.012   4.209
    6    HD2  HIS  98           HD2      HIS  98  11.738  22.054   4.643
    7    HE1  HIS  98           HE1      HIS  98   9.955  18.255   4.153
    8    HE2  HIS  98           HE2      HIS  98  12.158  19.477   4.417

  No H/Q in entry =           8
  In of MODEL   70
    1    H    GLU  99           H        GLU  99   6.024  23.725   5.450
    2    HA   GLU  99           HA       GLU  99   6.445  26.534   5.396
    3    HB2  GLU  99           HB2      GLU  99   4.551  25.395   4.261
    4    HB3  GLU  99           HB3      GLU  99   3.847  25.043   5.838
    5    HG2  GLU  99           HG2      GLU  99   3.702  27.436   6.342
    6    HG3  GLU  99           HG3      GLU  99   4.487  27.826   4.815

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LYS 100           H        LYS 100   5.276  24.313   7.913
    2    HA   LYS 100           HA       LYS 100   4.718  26.374   9.809
    3    HB2  LYS 100           HB2      LYS 100   5.247  23.414  10.152
    4    HB3  LYS 100           HB3      LYS 100   4.814  24.491  11.485
    5    HG2  LYS 100           HG2      LYS 100   2.761  25.162  10.234
    6    HG3  LYS 100           HG3      LYS 100   3.172  23.989   8.981
    7    HD2  LYS 100           HD2      LYS 100   3.063  22.167  10.640
    8    HD3  LYS 100           HD3      LYS 100   2.669  23.334  11.904
    9    HE2  LYS 100           HE2      LYS 100   0.628  23.989  10.638
   10    HE3  LYS 100           HE3      LYS 100   1.011  22.765   9.421
   11    HZ1  LYS 100           HZ1      LYS 100   0.730  22.099  12.301
   12    HZ3  LYS 100           HZ2      LYS 100   0.700  21.047  10.965
   13    HZ2  LYS 100           HZ3      LYS 100  -0.599  22.106  11.244

  No H/Q in entry =          13
  In of MODEL   70
    1    H    LEU 101           H        LEU 101   7.615  24.534   8.978
    2    HA   LEU 101           HA       LEU 101   9.222  25.346  11.185
    3    HB2  LEU 101           HB2      LEU 101   9.806  24.354   8.407
    4    HB3  LEU 101           HB3      LEU 101  11.117  24.997   9.392
    5    HG   LEU 101           HG       LEU 101   9.249  22.869  10.449
    6   HD12  LEU 101          HD11      LEU 101  11.281  21.342   9.843
    7   HD11  LEU 101          HD12      LEU 101  11.669  22.601   8.672
    8   HD13  LEU 101          HD13      LEU 101  10.127  21.752   8.575
    9   HD21  LEU 101          HD21      LEU 101  11.989  23.933  11.183
   10   HD23  LEU 101          HD22      LEU 101  11.420  22.369  11.760
   11   HD22  LEU 101          HD23      LEU 101  10.550  23.838  12.198

  No H/Q in entry =          11
  In of MODEL   70
    1    H    LYS 102           H        LYS 102   7.673  27.237   9.044
    2    HA   LYS 102           HA       LYS 102   7.787  29.529   8.756
    3    HB2  LYS 102           HB2      LYS 102   9.346  29.386  10.856
    4    HB3  LYS 102           HB3      LYS 102  10.650  29.562   9.700
    5    HG2  LYS 102           HG2      LYS 102   8.574  31.547  10.560
    6    HG3  LYS 102           HG3      LYS 102  10.291  31.780  10.312
    7    HD2  LYS 102           HD2      LYS 102   8.338  31.391   8.008
    8    HD3  LYS 102           HD3      LYS 102   8.745  32.963   8.679
    9    HE2  LYS 102           HE2      LYS 102  10.102  31.760   6.607
   10    HE3  LYS 102           HE3      LYS 102  10.738  33.055   7.621
   11    HZ2  LYS 102           HZ1      LYS 102  12.228  31.126   7.446
   12    HZ1  LYS 102           HZ2      LYS 102  11.049  30.162   8.185
   13    HZ3  LYS 102           HZ3      LYS 102  11.760  31.436   9.047

  No H/Q in entry =          13
  In of MODEL   70
    1    H    ALA 103           H        ALA 103  11.023  28.139   8.195
    2    HA   ALA 103           HA       ALA 103  12.013  29.503   6.123
    3    HB2  ALA 103           HB1      ALA 103  12.864  27.276   5.193
    4    HB1  ALA 103           HB2      ALA 103  11.954  26.514   6.497
    5    HB3  ALA 103           HB3      ALA 103  13.261  27.637   6.874

  No H/Q in entry =           5
  In of MODEL   70
    1    H1   LYS   3           H1       LYS   3 -31.641   5.495 -19.870
    2    H2   LYS   3           H3       LYS   3 -30.637   5.245 -21.217
    3    H3   LYS   3           H2       LYS   3 -31.986   4.246 -20.968
    4    HA   LYS   3           HA       LYS   3 -30.925   2.912 -19.554
    5    HB2  LYS   3           HB2      LYS   3 -28.707   4.422 -20.888
    6    HB3  LYS   3           HB3      LYS   3 -28.331   3.237 -19.637
    7    HG2  LYS   3           HG2      LYS   3 -29.674   1.579 -20.984
    8    HG3  LYS   3           HG3      LYS   3 -29.680   2.774 -22.281
    9    HD2  LYS   3           HD2      LYS   3 -27.195   2.775 -22.222
   10    HD3  LYS   3           HD3      LYS   3 -27.257   1.479 -21.030
   11    HE2  LYS   3           HE2      LYS   3 -28.695   0.226 -22.744
   12    HE3  LYS   3           HE3      LYS   3 -28.127   1.427 -23.904
   13    HZ3  LYS   3           HZ1      LYS   3 -26.273   0.281 -24.163
   14    HZ2  LYS   3           HZ2      LYS   3 -26.851  -0.910 -23.098
   15    HZ1  LYS   3           HZ3      LYS   3 -25.922   0.381 -22.504

  No H/Q in entry =          15
  In of MODEL   70
    1    H    LYS   4           H        LYS   4 -30.978   2.779 -17.493
    2    HA   LYS   4           HA       LYS   4 -30.358   5.105 -15.852
    3    HB2  LYS   4           HB2      LYS   4 -31.437   2.363 -15.142
    4    HB3  LYS   4           HB3      LYS   4 -31.280   3.716 -14.022
    5    HG2  LYS   4           HG2      LYS   4 -33.077   3.559 -16.448
    6    HG3  LYS   4           HG3      LYS   4 -33.573   3.596 -14.758
    7    HD2  LYS   4           HD2      LYS   4 -32.979   5.849 -14.501
    8    HD3  LYS   4           HD3      LYS   4 -31.934   5.831 -15.921
    9    HE2  LYS   4           HE2      LYS   4 -33.919   7.114 -16.396
   10    HE3  LYS   4           HE3      LYS   4 -33.930   5.634 -17.356
   11    HZ3  LYS   4           HZ1      LYS   4 -35.467   4.659 -15.808
   12    HZ2  LYS   4           HZ2      LYS   4 -36.087   6.125 -16.402
   13    HZ1  LYS   4           HZ3      LYS   4 -35.431   6.052 -14.837

  No H/Q in entry =          13
  In of MODEL   70
    1    H    HIS   5           H        HIS   5 -28.899   5.263 -14.258
    2    HA   HIS   5           HA       HIS   5 -26.536   3.536 -14.573
    3    HB2  HIS   5           HB2      HIS   5 -26.916   6.283 -13.382
    4    HB3  HIS   5           HB3      HIS   5 -25.393   5.395 -13.357
    5    HD1  HIS   5           HD1      HIS   5 -23.973   6.650 -14.948
    6    HD2  HIS   5           HD2      HIS   5 -27.739   5.855 -16.509
    7    HE1  HIS   5           HE1      HIS   5 -23.825   7.225 -17.401
    8    HE2  HIS   5           HE2      HIS   5 -26.120   6.727 -18.321

  No H/Q in entry =           8
  In of MODEL   70
    1    H    ILE   6           H        ILE   6 -26.242   1.982 -13.248
    2    HA   ILE   6           HA       ILE   6 -27.236   2.220 -10.488
    3    HB   ILE   6           HB       ILE   6 -26.300  -0.216 -12.010
    4   HG12  ILE   6          HG12      ILE   6 -29.084   0.605 -11.171
    5   HG13  ILE   6          HG13      ILE   6 -28.444   0.786 -12.804
    6   HG23  ILE   6          HG21      ILE   6 -26.624  -1.474 -10.145
    7   HG22  ILE   6          HG22      ILE   6 -27.832  -0.375  -9.474
    8   HG21  ILE   6          HG23      ILE   6 -26.119   0.036  -9.382
    9   HD13  ILE   6          HD11      ILE   6 -28.810  -1.353 -13.295
   10   HD12  ILE   6          HD12      ILE   6 -29.830  -1.373 -11.855
   11   HD11  ILE   6          HD13      ILE   6 -28.152  -1.908 -11.756

  No H/Q in entry =          11
  In of MODEL   70
    1    H    TYR   7           H        TYR   7 -25.510   2.943  -9.200
    2    HA   TYR   7           HA       TYR   7 -22.758   2.101  -9.867
    3    HB2  TYR   7           HB2      TYR   7 -23.830   4.499  -8.401
    4    HB3  TYR   7           HB3      TYR   7 -22.124   4.057  -8.433
    5    HD1  TYR   7           HD1      TYR   7 -23.115   3.055 -11.521
    6    HD2  TYR   7           HD2      TYR   7 -22.605   6.664  -9.312
    7    HE1  TYR   7           HE1      TYR   7 -22.729   4.291 -13.617
    8    HE2  TYR   7           HE2      TYR   7 -22.263   7.904 -11.400
    9    HH   TYR   7           HH       TYR   7 -22.472   7.796 -13.632

  No H/Q in entry =           9
  In of MODEL   70
    1    H    LEU   8           H        LEU   8 -21.740   0.799  -8.529
    2    HA   LEU   8           HA       LEU   8 -22.855   0.269  -5.845
    3    HB2  LEU   8           HB2      LEU   8 -21.077  -1.328  -7.666
    4    HB3  LEU   8           HB3      LEU   8 -21.251  -1.709  -5.953
    5    HG   LEU   8           HG       LEU   8 -23.720  -1.990  -6.381
    6   HD13  LEU   8          HD11      LEU   8 -23.897  -0.791  -8.498
    7   HD12  LEU   8          HD12      LEU   8 -24.354  -2.478  -8.730
    8   HD11  LEU   8          HD13      LEU   8 -22.768  -1.914  -9.254
    9   HD23  LEU   8          HD21      LEU   8 -22.355  -3.983  -8.061
   10   HD22  LEU   8          HD22      LEU   8 -23.437  -4.190  -6.685
   11   HD21  LEU   8          HD23      LEU   8 -21.748  -3.762  -6.420

  No H/Q in entry =          11
  In of MODEL   70
    1    H    PHE   9           H        PHE   9 -21.606   0.727  -4.057
    2    HA   PHE   9           HA       PHE   9 -18.860   1.775  -4.561
    3    HB2  PHE   9           HB2      PHE   9 -20.925   2.786  -2.609
    4    HB3  PHE   9           HB3      PHE   9 -19.236   3.274  -2.598
    5    HD1  PHE   9           HD1      PHE   9 -18.305   4.649  -4.372
    6    HD2  PHE   9           HD2      PHE   9 -22.434   3.483  -4.422
    7    HE1  PHE   9           HE1      PHE   9 -18.754   6.310  -6.153
    8    HE2  PHE   9           HE2      PHE   9 -22.885   5.157  -6.198
    9    HZ   PHE   9           HZ       PHE   9 -21.041   6.565  -7.069

  No H/Q in entry =           9
  In of MODEL   70
    1    H    SER  10           H        SER  10 -17.235   0.926  -3.405
    2    HA   SER  10           HA       SER  10 -17.435   0.044  -0.716
    3    HB2  SER  10           HB2      SER  10 -17.152  -2.332  -1.003
    4    HB3  SER  10           HB3      SER  10 -18.597  -1.843  -1.873
    5    HG   SER  10           HG       SER  10 -16.711  -3.205  -2.864

  No H/Q in entry =           5
  In of MODEL   70
    1    H    SER  11           H        SER  11 -15.425   0.191   0.135
    2    HA   SER  11           HA       SER  11 -13.265   1.129  -1.383
    3    HB2  SER  11           HB2      SER  11 -12.113   1.252   0.606
    4    HB3  SER  11           HB3      SER  11 -13.780   1.208   1.184
    5    HG   SER  11           HG       SER  11 -13.228  -1.257   0.986

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ALA  12           H        ALA  12 -14.355  -1.586  -2.233
    2    HA   ALA  12           HA       ALA  12 -11.732  -2.740  -2.746
    3    HB1  ALA  12           HB1      ALA  12 -13.878  -4.201  -1.215
    4    HB2  ALA  12           HB2      ALA  12 -12.177  -3.998  -0.798
    5    HB3  ALA  12           HB3      ALA  12 -12.635  -5.058  -2.130

  No H/Q in entry =           5
  In of MODEL   70
    1    H    GLY  13           H        GLY  13 -12.550  -1.747  -4.782
    2    HA3  GLY  13           HA2      GLY  13 -14.747  -2.547  -6.260
    3    HA2  GLY  13           HA3      GLY  13 -13.210  -2.043  -6.978

  No H/Q in entry =           3
  In of MODEL   70
    1    H    MET  14           H        MET  14 -11.658  -4.270  -5.940
    2    HA   MET  14           HA       MET  14 -11.925  -6.072  -8.049
    3    HB2  MET  14           HB2      MET  14  -9.900  -5.946  -6.591
    4    HB3  MET  14           HB3      MET  14 -10.772  -6.834  -5.343
    5    HG2  MET  14           HG2      MET  14  -9.622  -8.542  -6.462
    6    HG3  MET  14           HG3      MET  14 -11.185  -8.577  -7.279
    7    HE1  MET  14           HE1      MET  14  -7.588  -8.608  -7.592
    8    HE3  MET  14           HE2      MET  14  -7.641  -6.867  -7.326
    9    HE2  MET  14           HE3      MET  14  -7.097  -7.496  -8.879

  No H/Q in entry =           9
  In of MODEL   70
    1    H    SER  15           H        SER  15 -13.183  -6.529  -4.747
    2    HA   SER  15           HA       SER  15 -14.395  -9.060  -5.423
    3    HB2  SER  15           HB2      SER  15 -14.765  -7.269  -3.016
    4    HB3  SER  15           HB3      SER  15 -15.717  -8.729  -3.270
    5    HG   SER  15           HG       SER  15 -12.868  -8.577  -3.212

  No H/Q in entry =           5
  In of MODEL   70
    1    H    THR  16           H        THR  16 -15.618  -5.723  -5.132
    2    HA   THR  16           HA       THR  16 -18.380  -6.361  -5.682
    3    HB   THR  16           HB       THR  16 -16.937  -3.737  -6.195
    4    HG1  THR  16           HG1      THR  16 -18.312  -4.105  -3.834
    5   HG22  THR  16          HG21      THR  16 -19.794  -4.323  -5.389
    6   HG21  THR  16          HG22      THR  16 -19.282  -4.025  -7.059
    7   HG23  THR  16          HG23      THR  16 -19.118  -2.761  -5.832

  No H/Q in entry =           7
  In of MODEL   70
    1    H    SER  17           H        SER  17 -15.543  -5.686  -7.521
    2    HA   SER  17           HA       SER  17 -16.692  -5.009 -10.031
    3    HB2  SER  17           HB2      SER  17 -14.011  -6.203  -9.304
    4    HB3  SER  17           HB3      SER  17 -14.463  -5.810 -10.964
    5    HG   SER  17           HG       SER  17 -14.981  -3.760  -9.278

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LEU  18           H        LEU  18 -15.993  -8.118  -8.563
    2    HA   LEU  18           HA       LEU  18 -16.503  -9.655 -10.912
    3    HB2  LEU  18           HB2      LEU  18 -15.250 -10.559  -9.008
    4    HB3  LEU  18           HB3      LEU  18 -16.682 -10.408  -7.990
    5    HG   LEU  18           HG       LEU  18 -17.858 -12.044  -9.365
    6   HD13  LEU  18          HD11      LEU  18 -17.050 -11.813 -11.540
    7   HD12  LEU  18          HD12      LEU  18 -16.289 -13.317 -11.021
    8   HD11  LEU  18          HD13      LEU  18 -15.366 -11.816 -11.018
    9   HD23  LEU  18          HD21      LEU  18 -16.497 -14.005  -8.807
   10   HD22  LEU  18          HD22      LEU  18 -16.618 -12.845  -7.482
   11   HD21  LEU  18          HD23      LEU  18 -15.142 -12.933  -8.445

  No H/Q in entry =          11
  In of MODEL   70
    1    H    LEU  19           H        LEU  19 -18.534  -8.520  -8.215
    2    HA   LEU  19           HA       LEU  19 -20.939  -9.816  -9.050
    3    HB2  LEU  19           HB2      LEU  19 -20.702  -8.950  -6.801
    4    HB3  LEU  19           HB3      LEU  19 -20.515  -7.312  -7.424
    5    HG   LEU  19           HG       LEU  19 -22.887  -7.442  -8.231
    6   HD11  LEU  19          HD11      LEU  19 -23.071  -9.909  -8.235
    7   HD13  LEU  19          HD12      LEU  19 -24.331  -9.149  -7.263
    8   HD12  LEU  19          HD13      LEU  19 -22.946  -9.901  -6.475
    9   HD23  LEU  19          HD21      LEU  19 -23.817  -7.087  -5.970
   10   HD22  LEU  19          HD22      LEU  19 -22.299  -6.232  -6.241
   11   HD21  LEU  19          HD23      LEU  19 -22.318  -7.716  -5.287

  No H/Q in entry =          11
  In of MODEL   70
    1    H    VAL  20           H        VAL  20 -19.581  -6.596  -9.757
    2    HA   VAL  20           HA       VAL  20 -21.730  -5.657 -11.340
    3    HB   VAL  20           HB       VAL  20 -18.774  -4.937 -11.581
    4   HG12  VAL  20          HG11      VAL  20 -20.491  -2.795 -12.332
    5   HG11  VAL  20          HG12      VAL  20 -20.999  -4.223 -13.233
    6   HG13  VAL  20          HG13      VAL  20 -19.332  -3.661 -13.339
    7   HG22  VAL  20          HG21      VAL  20 -19.276  -4.228  -9.472
    8   HG21  VAL  20          HG22      VAL  20 -20.982  -3.987  -9.838
    9   HG23  VAL  20          HG23      VAL  20 -19.787  -2.818 -10.400

  No H/Q in entry =           9
  In of MODEL   70
    1    H    SER  21           H        SER  21 -18.881  -7.589 -12.345
    2    HA   SER  21           HA       SER  21 -19.659  -7.527 -15.100
    3    HB2  SER  21           HB2      SER  21 -18.133  -9.422 -15.421
    4    HB3  SER  21           HB3      SER  21 -17.365  -8.145 -14.480
    5    HG   SER  21           HG       SER  21 -17.713  -9.327 -12.634

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LYS  22           H        LYS  22 -20.638  -9.743 -12.519
    2    HA   LYS  22           HA       LYS  22 -22.096 -11.438 -14.338
    3    HB2  LYS  22           HB2      LYS  22 -22.343 -11.081 -11.350
    4    HB3  LYS  22           HB3      LYS  22 -23.203 -12.301 -12.289
    5    HG2  LYS  22           HG2      LYS  22 -20.204 -12.153 -12.257
    6    HG3  LYS  22           HG3      LYS  22 -21.109 -13.032 -11.026
    7    HD2  LYS  22           HD2      LYS  22 -21.844 -13.641 -13.816
    8    HD3  LYS  22           HD3      LYS  22 -20.219 -14.132 -13.334
    9    HE2  LYS  22           HE2      LYS  22 -21.149 -15.397 -11.451
   10    HE3  LYS  22           HE3      LYS  22 -22.776 -14.884 -11.897
   11    HZ1  LYS  22           HZ1      LYS  22 -21.134 -16.322 -13.857
   12    HZ3  LYS  22           HZ2      LYS  22 -22.824 -16.274 -13.689
   13    HZ2  LYS  22           HZ3      LYS  22 -21.889 -17.193 -12.609

  No H/Q in entry =          13
  In of MODEL   70
    1    H    MET  23           H        MET  23 -22.954  -8.541 -12.489
    2    HA   MET  23           HA       MET  23 -25.752  -8.743 -13.006
    3    HB2  MET  23           HB2      MET  23 -24.009  -6.355 -12.438
    4    HB3  MET  23           HB3      MET  23 -25.759  -6.261 -12.623
    5    HG2  MET  23           HG2      MET  23 -26.102  -7.569 -10.649
    6    HG3  MET  23           HG3      MET  23 -24.376  -7.907 -10.514
    7    HE2  MET  23           HE1      MET  23 -26.832  -4.351  -9.354
    8    HE1  MET  23           HE2      MET  23 -27.040  -5.337 -10.800
    9    HE3  MET  23           HE3      MET  23 -26.067  -3.867 -10.868

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ARG  24           H        ARG  24 -23.055  -7.207 -14.786
    2    HA   ARG  24           HA       ARG  24 -24.598  -5.982 -16.798
    3    HB2  ARG  24           HB2      ARG  24 -22.173  -5.485 -16.402
    4    HB3  ARG  24           HB3      ARG  24 -21.772  -7.064 -17.033
    5    HG2  ARG  24           HG2      ARG  24 -22.602  -6.444 -19.275
    6    HG3  ARG  24           HG3      ARG  24 -23.125  -4.862 -18.639
    7    HD2  ARG  24           HD2      ARG  24 -20.265  -5.935 -18.554
    8    HD3  ARG  24           HD3      ARG  24 -20.879  -4.787 -19.737
    9    HE   ARG  24           HE       ARG  24 -21.407  -3.460 -17.523
   10   HH21  ARG  24          HH11      ARG  24 -20.169  -1.587 -17.641
   11   HH22  ARG  24          HH12      ARG  24 -18.448  -1.704 -17.753
   12   HH11  ARG  24          HH21      ARG  24 -18.609  -5.197 -18.299
   13   HH12  ARG  24          HH22      ARG  24 -17.533  -3.845 -18.131

  No H/Q in entry =          13
  In of MODEL   70
    1    H    ALA  25           H        ALA  25 -23.339  -9.269 -16.501
    2    HA   ALA  25           HA       ALA  25 -23.921 -10.138 -19.137
    3    HB1  ALA  25           HB1      ALA  25 -23.144 -12.136 -18.429
    4    HB3  ALA  25           HB2      ALA  25 -24.208 -12.152 -17.021
    5    HB2  ALA  25           HB3      ALA  25 -22.688 -11.261 -16.967

  No H/Q in entry =           5
  In of MODEL   70
    1    H    GLN  26           H        GLN  26 -25.757 -10.238 -16.120
    2    HA   GLN  26           HA       GLN  26 -28.045 -11.542 -17.141
    3    HB2  GLN  26           HB2      GLN  26 -27.614  -9.763 -14.760
    4    HB3  GLN  26           HB3      GLN  26 -29.145 -10.552 -15.113
    5    HG2  GLN  26           HG2      GLN  26 -26.503 -11.899 -14.627
    6    HG3  GLN  26           HG3      GLN  26 -27.872 -11.848 -13.523
    7   HE21  GLN  26          HE21      GLN  26 -26.561 -13.966 -14.784
    8   HE22  GLN  26          HE22      GLN  26 -27.556 -15.058 -15.581

  No H/Q in entry =           8
  In of MODEL   70
    1    H    ALA  27           H        ALA  27 -27.252  -8.107 -16.760
    2    HA   ALA  27           HA       ALA  27 -29.782  -7.120 -17.560
    3    HB1  ALA  27           HB1      ALA  27 -28.032  -5.727 -16.442
    4    HB3  ALA  27           HB2      ALA  27 -28.647  -4.992 -17.924
    5    HB2  ALA  27           HB3      ALA  27 -27.078  -5.796 -17.924

  No H/Q in entry =           5
  In of MODEL   70
    1    H    GLU  28           H        GLU  28 -27.024  -8.239 -19.412
    2    HA   GLU  28           HA       GLU  28 -27.991  -7.248 -21.940
    3    HB2  GLU  28           HB2      GLU  28 -25.589  -7.831 -21.303
    4    HB3  GLU  28           HB3      GLU  28 -26.064  -9.517 -21.500
    5    HG2  GLU  28           HG2      GLU  28 -24.942  -8.702 -23.467
    6    HG3  GLU  28           HG3      GLU  28 -26.623  -9.095 -23.821

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LYS  29           H        LYS  29 -28.038 -10.352 -20.271
    2    HA   LYS  29           HA       LYS  29 -29.271 -11.881 -22.276
    3    HB2  LYS  29           HB2      LYS  29 -28.190 -12.815 -20.263
    4    HB3  LYS  29           HB3      LYS  29 -29.494 -12.156 -19.276
    5    HG2  LYS  29           HG2      LYS  29 -31.093 -13.599 -20.346
    6    HG3  LYS  29           HG3      LYS  29 -29.864 -14.189 -21.463
    7    HD2  LYS  29           HD2      LYS  29 -28.682 -15.302 -19.720
    8    HD3  LYS  29           HD3      LYS  29 -29.628 -14.494 -18.472
    9    HE2  LYS  29           HE2      LYS  29 -30.282 -16.872 -18.828
   10    HE3  LYS  29           HE3      LYS  29 -31.606 -15.734 -19.082
   11    HZ1  LYS  29           HZ1      LYS  29 -31.026 -15.854 -21.506
   12    HZ3  LYS  29           HZ2      LYS  29 -31.692 -17.267 -20.839
   13    HZ2  LYS  29           HZ3      LYS  29 -30.023 -17.171 -21.130

  No H/Q in entry =          13
  In of MODEL   70
    1    H    TYR  30           H        TYR  30 -30.758  -9.826 -19.785
    2    HA   TYR  30           HA       TYR  30 -33.394 -10.389 -21.035
    3    HB2  TYR  30           HB2      TYR  30 -32.801  -9.200 -18.316
    4    HB3  TYR  30           HB3      TYR  30 -34.404  -9.526 -18.975
    5    HD1  TYR  30           HD1      TYR  30 -35.219 -11.854 -19.184
    6    HD2  TYR  30           HD2      TYR  30 -31.424 -10.969 -17.467
    7    HE1  TYR  30           HE1      TYR  30 -35.037 -14.173 -18.379
    8    HE2  TYR  30           HE2      TYR  30 -31.244 -13.274 -16.665
    9    HH   TYR  30           HH       TYR  30 -32.780 -15.704 -17.757

  No H/Q in entry =           9
  In of MODEL   70
    1    H    GLU  31           H        GLU  31 -31.309  -8.313 -21.834
    2    HA   GLU  31           HA       GLU  31 -31.320  -6.157 -22.665
    3    HB2  GLU  31           HB2      GLU  31 -34.182  -6.993 -23.187
    4    HB3  GLU  31           HB3      GLU  31 -33.395  -5.595 -23.917
    5    HG2  GLU  31           HG2      GLU  31 -31.859  -6.974 -25.097
    6    HG3  GLU  31           HG3      GLU  31 -32.369  -8.407 -24.207

  No H/Q in entry =           6
  In of MODEL   70
    1    H    VAL  32           H        VAL  32 -31.535  -6.054 -19.933
    2    HA   VAL  32           HA       VAL  32 -33.486  -4.018 -19.289
    3    HB   VAL  32           HB       VAL  32 -31.062  -4.906 -17.695
    4   HG12  VAL  32          HG11      VAL  32 -32.639  -4.141 -15.809
    5   HG11  VAL  32          HG12      VAL  32 -33.503  -3.277 -17.079
    6   HG13  VAL  32          HG13      VAL  32 -31.812  -2.901 -16.754
    7   HG21  VAL  32          HG21      VAL  32 -32.753  -6.701 -18.385
    8   HG23  VAL  32          HG22      VAL  32 -33.832  -5.914 -17.232
    9   HG22  VAL  32          HG23      VAL  32 -32.289  -6.572 -16.688

  No H/Q in entry =           9
  In of MODEL   70
    1    HA   PRO  33           HA       PRO  33 -30.574  -0.971 -20.961
    2    HB2  PRO  33           HB2      PRO  33 -32.178   1.187 -20.851
    3    HB3  PRO  33           HB3      PRO  33 -32.587  -0.137 -21.942
    4    HG2  PRO  33           HG2      PRO  33 -33.588   0.346 -19.136
    5    HG3  PRO  33           HG3      PRO  33 -34.536   0.092 -20.600
    6    HD2  PRO  33           HD2      PRO  33 -34.000  -1.954 -18.925
    7    HD3  PRO  33           HD3      PRO  33 -34.044  -2.203 -20.672

  No H/Q in entry =           7
  In of MODEL   70
    1    H    VAL  34           H        VAL  34 -29.296  -1.455 -19.005
    2    HA   VAL  34           HA       VAL  34 -29.123   0.986 -17.364
    3    HB   VAL  34           HB       VAL  34 -28.488  -0.444 -15.420
    4   HG12  VAL  34          HG11      VAL  34 -30.863  -1.418 -15.119
    5   HG11  VAL  34          HG12      VAL  34 -31.205  -0.678 -16.680
    6   HG13  VAL  34          HG13      VAL  34 -30.699   0.326 -15.321
    7   HG21  VAL  34          HG21      VAL  34 -28.578  -2.483 -17.422
    8   HG23  VAL  34          HG22      VAL  34 -29.624  -2.884 -16.059
    9   HG22  VAL  34          HG23      VAL  34 -27.921  -2.523 -15.785

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ILE  35           H        ILE  35 -27.171   1.507 -16.518
    2    HA   ILE  35           HA       ILE  35 -24.806   0.275 -17.767
    3    HB   ILE  35           HB       ILE  35 -25.333   3.147 -16.968
    4   HG12  ILE  35          HG12      ILE  35 -24.285   1.876 -19.504
    5   HG13  ILE  35          HG13      ILE  35 -25.942   2.427 -19.253
    6   HG21  ILE  35          HG21      ILE  35 -22.706   1.725 -17.261
    7   HG23  ILE  35          HG22      ILE  35 -23.216   2.888 -16.038
    8   HG22  ILE  35          HG23      ILE  35 -22.851   3.433 -17.675
    9   HD11  ILE  35          HD11      ILE  35 -24.639   4.682 -18.652
   10   HD13  ILE  35          HD12      ILE  35 -25.152   4.271 -20.290
   11   HD12  ILE  35          HD13      ILE  35 -23.488   3.975 -19.787

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ILE  36           H        ILE  36 -23.539  -0.689 -16.160
    2    HA   ILE  36           HA       ILE  36 -24.017  -0.085 -13.293
    3    HB   ILE  36           HB       ILE  36 -23.069  -2.753 -14.389
    4   HG12  ILE  36          HG12      ILE  36 -25.912  -2.067 -13.639
    5   HG13  ILE  36          HG13      ILE  36 -25.334  -2.027 -15.305
    6   HG23  ILE  36          HG21      ILE  36 -23.392  -3.590 -12.275
    7   HG22  ILE  36          HG22      ILE  36 -24.575  -2.355 -11.844
    8   HG21  ILE  36          HG23      ILE  36 -22.860  -1.949 -11.909
    9   HD13  ILE  36          HD11      ILE  36 -25.403  -4.247 -15.505
   10   HD12  ILE  36          HD12      ILE  36 -26.479  -4.167 -14.110
   11   HD11  ILE  36          HD13      ILE  36 -24.764  -4.512 -13.883

  No H/Q in entry =          11
  In of MODEL   70
    1    H    GLU  37           H        GLU  37 -22.270   0.624 -12.184
    2    HA   GLU  37           HA       GLU  37 -19.543  -0.057 -13.087
    3    HB2  GLU  37           HB2      GLU  37 -20.567   2.692 -12.402
    4    HB3  GLU  37           HB3      GLU  37 -18.858   2.275 -12.518
    5    HG2  GLU  37           HG2      GLU  37 -19.132   1.778 -14.880
    6    HG3  GLU  37           HG3      GLU  37 -20.846   2.173 -14.768

  No H/Q in entry =           6
  In of MODEL   70
    1    H    ALA  38           H        ALA  38 -18.054  -0.226 -11.398
    2    HA   ALA  38           HA       ALA  38 -19.103  -0.084  -8.631
    3    HB1  ALA  38           HB1      ALA  38 -17.300  -1.950 -10.045
    4    HB3  ALA  38           HB2      ALA  38 -18.344  -2.227  -8.650
    5    HB2  ALA  38           HB3      ALA  38 -16.764  -1.474  -8.433

  No H/Q in entry =           5
  In of MODEL   70
    1    H    PHE  39           H        PHE  39 -17.923   1.184  -7.157
    2    HA   PHE  39           HA       PHE  39 -15.451   2.494  -8.048
    3    HB2  PHE  39           HB2      PHE  39 -17.771   3.968  -6.797
    4    HB3  PHE  39           HB3      PHE  39 -16.208   4.656  -7.234
    5    HD1  PHE  39           HD1      PHE  39 -15.603   4.975  -9.579
    6    HD2  PHE  39           HD2      PHE  39 -19.470   3.603  -8.416
    7    HE1  PHE  39           HE1      PHE  39 -16.471   5.554 -11.826
    8    HE2  PHE  39           HE2      PHE  39 -20.349   4.170 -10.652
    9    HZ   PHE  39           HZ       PHE  39 -18.850   5.116 -12.374

  No H/Q in entry =           9
  In of MODEL   70
    1    HA   PRO  40           HA       PRO  40 -14.496   1.797  -3.755
    2    HB2  PRO  40           HB2      PRO  40 -12.825   3.893  -3.149
    3    HB3  PRO  40           HB3      PRO  40 -12.316   2.578  -4.209
    4    HG2  PRO  40           HG2      PRO  40 -13.459   5.261  -4.972
    5    HG3  PRO  40           HG3      PRO  40 -11.995   4.481  -5.570
    6    HD2  PRO  40           HD2      PRO  40 -14.206   4.291  -6.985
    7    HD3  PRO  40           HD3      PRO  40 -13.187   2.867  -6.786

  No H/Q in entry =           7
  In of MODEL   70
    1    H    GLU  41           H        GLU  41 -15.170   2.752  -1.631
    2    HA   GLU  41           HA       GLU  41 -17.490   4.350  -1.629
    3    HB2  GLU  41           HB2      GLU  41 -17.321   4.321   0.764
    4    HB3  GLU  41           HB3      GLU  41 -16.835   2.738   0.159
    5    HG2  GLU  41           HG2      GLU  41 -14.500   3.277   0.520
    6    HG3  GLU  41           HG3      GLU  41 -14.933   4.908   1.034

  No H/Q in entry =           6
  In of MODEL   70
    1    H    THR  42           H        THR  42 -14.205   5.419  -1.670
    2    HA   THR  42           HA       THR  42 -14.679   7.965  -0.468
    3    HB   THR  42           HB       THR  42 -12.547   8.634  -1.553
    4    HG1  THR  42           HG1      THR  42 -12.931   6.130  -2.821
    5   HG23  THR  42          HG21      THR  42 -11.123   7.027  -0.411
    6   HG22  THR  42          HG22      THR  42 -12.431   5.844  -0.385
    7   HG21  THR  42          HG23      THR  42 -12.561   7.320   0.569

  No H/Q in entry =           7
  In of MODEL   70
    1    H    LEU  43           H        LEU  43 -15.520   6.820  -3.569
    2    HA   LEU  43           HA       LEU  43 -15.897   9.575  -4.549
    3    HB2  LEU  43           HB2      LEU  43 -16.124   6.908  -5.932
    4    HB3  LEU  43           HB3      LEU  43 -16.419   8.468  -6.696
    5    HG   LEU  43           HG       LEU  43 -13.754   7.510  -5.681
    6   HD11  LEU  43          HD11      LEU  43 -14.846   6.408  -7.766
    7   HD13  LEU  43          HD12      LEU  43 -13.182   6.985  -7.868
    8   HD12  LEU  43          HD13      LEU  43 -14.492   7.949  -8.548
    9   HD22  LEU  43          HD21      LEU  43 -13.767   9.866  -5.571
   10   HD21  LEU  43          HD22      LEU  43 -14.698  10.015  -7.062
   11   HD23  LEU  43          HD23      LEU  43 -13.015   9.494  -7.122

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ALA  44           H        ALA  44 -17.764   7.667  -2.697
    2    HA   ALA  44           HA       ALA  44 -20.227   7.408  -4.028
    3    HB2  ALA  44           HB1      ALA  44 -20.045   6.306  -1.928
    4    HB3  ALA  44           HB2      ALA  44 -21.215   7.600  -1.663
    5    HB1  ALA  44           HB3      ALA  44 -19.553   7.787  -1.106

  No H/Q in entry =           5
  In of MODEL   70
    1    H    GLY  45           H        GLY  45 -18.944  10.277  -2.500
    2    HA3  GLY  45           HA2      GLY  45 -21.446  11.661  -2.876
    3    HA2  GLY  45           HA3      GLY  45 -19.935  12.358  -2.295

  No H/Q in entry =           3
  In of MODEL   70
    1    H    GLU  46           H        GLU  46 -18.353  11.487  -4.577
    2    HA   GLU  46           HA       GLU  46 -19.085  13.664  -6.356
    3    HB2  GLU  46           HB2      GLU  46 -16.798  11.688  -6.367
    4    HB3  GLU  46           HB3      GLU  46 -16.983  13.000  -7.532
    5    HG2  GLU  46           HG2      GLU  46 -15.474  13.865  -6.020
    6    HG3  GLU  46           HG3      GLU  46 -17.008  14.534  -5.464

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LYS  47           H        LYS  47 -18.801  10.153  -6.778
    2    HA   LYS  47           HA       LYS  47 -19.898  10.312  -9.458
    3    HB2  LYS  47           HB2      LYS  47 -19.250   7.945  -7.694
    4    HB3  LYS  47           HB3      LYS  47 -19.772   7.841  -9.375
    5    HG2  LYS  47           HG2      LYS  47 -17.319   9.360  -8.584
    6    HG3  LYS  47           HG3      LYS  47 -17.282   7.622  -8.880
    7    HD2  LYS  47           HD2      LYS  47 -18.235   7.996 -11.114
    8    HD3  LYS  47           HD3      LYS  47 -18.221   9.733 -10.816
    9    HE2  LYS  47           HE2      LYS  47 -16.294   9.143 -12.125
   10    HE3  LYS  47           HE3      LYS  47 -15.769   9.616 -10.510
   11    HZ1  LYS  47           HZ1      LYS  47 -16.253   6.903 -10.411
   12    HZ3  LYS  47           HZ2      LYS  47 -14.747   7.687 -10.372
   13    HZ2  LYS  47           HZ3      LYS  47 -15.395   7.165 -11.853

  No H/Q in entry =          13
  In of MODEL   70
    1    H    GLY  48           H        GLY  48 -21.197   9.506  -6.312
    2    HA3  GLY  48           HA2      GLY  48 -23.522   8.209  -7.058
    3    HA2  GLY  48           HA3      GLY  48 -23.348   9.217  -5.622

  No H/Q in entry =           3
  In of MODEL   70
    1    H    GLN  49           H        GLN  49 -22.872  11.658  -7.199
    2    HA   GLN  49           HA       GLN  49 -25.479  12.650  -7.357
    3    HB2  GLN  49           HB2      GLN  49 -22.973  13.626  -8.711
    4    HB3  GLN  49           HB3      GLN  49 -24.478  14.523  -8.636
    5    HG2  GLN  49           HG2      GLN  49 -24.329  14.563  -6.197
    6    HG3  GLN  49           HG3      GLN  49 -22.836  13.645  -6.271
    7   HE21  GLN  49          HE21      GLN  49 -22.827  15.881  -5.006
    8   HE22  GLN  49          HE22      GLN  49 -21.960  17.176  -5.655

  No H/Q in entry =           8
  In of MODEL   70
    1    H    ASN  50           H        ASN  50 -23.706  10.842  -9.730
    2    HA   ASN  50           HA       ASN  50 -25.619  11.619 -11.823
    3    HB2  ASN  50           HB2      ASN  50 -22.970  10.199 -12.042
    4    HB3  ASN  50           HB3      ASN  50 -24.033  10.571 -13.390
    5   HD21  ASN  50          HD21      ASN  50 -21.446  11.543 -11.772
    6   HD22  ASN  50          HD22      ASN  50 -21.285  13.186 -12.120

  No H/Q in entry =           6
  In of MODEL   70
    1    H    ALA  51           H        ALA  51 -25.505   9.274  -9.569
    2    HA   ALA  51           HA       ALA  51 -26.184   7.088 -11.390
    3    HB2  ALA  51           HB1      ALA  51 -25.545   5.774  -9.697
    4    HB3  ALA  51           HB2      ALA  51 -26.708   6.534  -8.610
    5    HB1  ALA  51           HB3      ALA  51 -25.098   7.228  -8.804

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ASP  52           H        ASP  52 -28.139   5.943 -11.254
    2    HA   ASP  52           HA       ASP  52 -30.404   7.678 -10.603
    3    HB2  ASP  52           HB2      ASP  52 -30.092   5.179 -12.263
    4    HB3  ASP  52           HB3      ASP  52 -31.671   5.842 -11.837

  No H/Q in entry =           4
  In of MODEL   70
    1    H    VAL  53           H        VAL  53 -28.677   4.868  -9.570
    2    HA   VAL  53           HA       VAL  53 -30.132   4.939  -7.061
    3    HB   VAL  53           HB       VAL  53 -31.451   3.231  -8.303
    4   HG11  VAL  53          HG11      VAL  53 -29.661   2.446  -9.815
    5   HG13  VAL  53          HG12      VAL  53 -30.438   1.117  -8.955
    6   HG12  VAL  53          HG13      VAL  53 -28.854   1.694  -8.440
    7   HG23  VAL  53          HG21      VAL  53 -30.547   1.299  -6.601
    8   HG22  VAL  53          HG22      VAL  53 -31.735   2.553  -6.243
    9   HG21  VAL  53          HG23      VAL  53 -30.039   2.803  -5.830

  No H/Q in entry =           9
  In of MODEL   70
    1    H    VAL  54           H        VAL  54 -28.808   4.571  -5.399
    2    HA   VAL  54           HA       VAL  54 -26.009   3.844  -5.997
    3    HB   VAL  54           HB       VAL  54 -27.167   5.580  -3.757
    4   HG11  VAL  54          HG11      VAL  54 -24.526   4.276  -4.034
    5   HG13  VAL  54          HG12      VAL  54 -25.314   4.926  -2.597
    6   HG12  VAL  54          HG13      VAL  54 -24.452   6.006  -3.694
    7   HG22  VAL  54          HG21      VAL  54 -26.385   7.427  -4.861
    8   HG21  VAL  54          HG22      VAL  54 -26.883   6.409  -6.211
    9   HG23  VAL  54          HG23      VAL  54 -25.180   6.512  -5.767

  No H/Q in entry =           9
  In of MODEL   70
    1    H    LEU  55           H        LEU  55 -25.335   1.953  -5.344
    2    HA   LEU  55           HA       LEU  55 -26.791   0.584  -3.171
    3    HB2  LEU  55           HB2      LEU  55 -25.176  -0.522  -5.455
    4    HB3  LEU  55           HB3      LEU  55 -25.899  -1.484  -4.166
    5    HG   LEU  55           HG       LEU  55 -27.397   0.030  -6.295
    6   HD13  LEU  55          HD11      LEU  55 -27.010  -1.812  -7.507
    7   HD12  LEU  55          HD12      LEU  55 -27.933  -2.724  -6.312
    8   HD11  LEU  55          HD13      LEU  55 -26.183  -2.581  -6.155
    9   HD23  LEU  55          HD21      LEU  55 -28.611  -1.965  -4.437
   10   HD22  LEU  55          HD22      LEU  55 -29.363  -0.617  -5.292
   11   HD21  LEU  55          HD23      LEU  55 -28.362  -0.312  -3.874

  No H/Q in entry =          11
  In of MODEL   70
    1    H    LEU  56           H        LEU  56 -25.622   0.048  -1.358
    2    HA   LEU  56           HA       LEU  56 -22.707   0.572  -1.399
    3    HB2  LEU  56           HB2      LEU  56 -24.508   0.291   0.994
    4    HB3  LEU  56           HB3      LEU  56 -22.819   0.795   0.987
    5    HG   LEU  56           HG       LEU  56 -25.187   2.367   0.009
    6   HD11  LEU  56          HD11      LEU  56 -24.066   2.043   2.535
    7   HD13  LEU  56          HD12      LEU  56 -25.113   3.365   2.020
    8   HD12  LEU  56          HD13      LEU  56 -23.363   3.547   1.938
    9   HD23  LEU  56          HD21      LEU  56 -23.318   4.149  -0.184
   10   HD22  LEU  56          HD22      LEU  56 -23.647   3.031  -1.508
   11   HD21  LEU  56          HD23      LEU  56 -22.283   2.742  -0.428

  No H/Q in entry =          11
  In of MODEL   70
    1    H    GLY  57           H        GLY  57 -21.259  -0.995  -0.855
    2    HA3  GLY  57           HA2      GLY  57 -22.061  -3.719  -1.043
    3    HA2  GLY  57           HA3      GLY  57 -20.465  -3.151  -0.560

  No H/Q in entry =           3
  In of MODEL   70
    1    HA   PRO  58           HA       PRO  58 -23.239  -4.300   3.143
    2    HB2  PRO  58           HB2      PRO  58 -22.444  -6.869   3.761
    3    HB3  PRO  58           HB3      PRO  58 -23.841  -6.527   2.741
    4    HG2  PRO  58           HG2      PRO  58 -21.074  -7.289   1.969
    5    HG3  PRO  58           HG3      PRO  58 -22.615  -7.820   1.293
    6    HD2  PRO  58           HD2      PRO  58 -21.082  -5.938   0.070
    7    HD3  PRO  58           HD3      PRO  58 -22.843  -5.930  -0.039

  No H/Q in entry =           7
  In of MODEL   70
    1    H    GLN  59           H        GLN  59 -19.849  -4.627   2.550
    2    HA   GLN  59           HA       GLN  59 -19.104  -4.601   5.314
    3    HB2  GLN  59           HB2      GLN  59 -17.730  -4.828   2.905
    4    HB3  GLN  59           HB3      GLN  59 -17.201  -3.288   3.551
    5    HG2  GLN  59           HG2      GLN  59 -15.735  -5.158   4.186
    6    HG3  GLN  59           HG3      GLN  59 -16.438  -4.346   5.576
    7   HE21  GLN  59          HE21      GLN  59 -16.760  -5.746   6.880
    8   HE22  GLN  59          HE22      GLN  59 -17.430  -7.257   7.069

  No H/Q in entry =           8
  In of MODEL   70
    1    H    ILE  60           H        ILE  60 -20.140  -2.101   3.092
    2    HA   ILE  60           HA       ILE  60 -19.381  -0.101   5.134
    3    HB   ILE  60           HB       ILE  60 -19.678   1.611   3.303
    4   HG12  ILE  60          HG12      ILE  60 -19.393  -0.608   1.322
    5   HG13  ILE  60          HG13      ILE  60 -21.000  -0.133   1.872
    6   HG23  ILE  60          HG21      ILE  60 -17.528   1.227   2.299
    7   HG22  ILE  60          HG22      ILE  60 -17.578  -0.468   2.784
    8   HG21  ILE  60          HG23      ILE  60 -17.494   0.798   4.009
    9   HD13  ILE  60          HD11      ILE  60 -20.733   1.168  -0.039
   10   HD12  ILE  60          HD12      ILE  60 -19.015   1.429   0.256
   11   HD11  ILE  60          HD13      ILE  60 -20.215   2.278   1.229

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ALA  61           H        ALA  61 -21.766  -1.792   5.200
    2    HA   ALA  61           HA       ALA  61 -24.060  -0.227   4.726
    3    HB1  ALA  61           HB1      ALA  61 -25.215  -1.764   6.054
    4    HB2  ALA  61           HB2      ALA  61 -23.805  -2.088   7.062
    5    HB3  ALA  61           HB3      ALA  61 -23.868  -2.705   5.411

  No H/Q in entry =           5
  In of MODEL   70
    1    H    TYR  62           H        TYR  62 -21.861  -0.234   7.532
    2    HA   TYR  62           HA       TYR  62 -23.493   1.361   9.191
    3    HB2  TYR  62           HB2      TYR  62 -21.491   1.862  10.442
    4    HB3  TYR  62           HB3      TYR  62 -21.447   0.169   9.955
    5    HD1  TYR  62           HD1      TYR  62 -19.799  -0.622   8.310
    6    HD2  TYR  62           HD2      TYR  62 -19.867   3.470   9.536
    7    HE1  TYR  62           HE1      TYR  62 -17.594  -0.276   7.262
    8    HE2  TYR  62           HE2      TYR  62 -17.648   3.811   8.491
    9    HH   TYR  62           HH       TYR  62 -16.419   2.080   6.285

  No H/Q in entry =           9
  In of MODEL   70
    1    H    MET  63           H        MET  63 -21.878   2.279   6.337
    2    HA   MET  63           HA       MET  63 -21.836   5.118   7.021
    3    HB2  MET  63           HB2      MET  63 -21.153   3.613   4.496
    4    HB3  MET  63           HB3      MET  63 -21.041   5.365   4.667
    5    HG2  MET  63           HG2      MET  63 -19.316   5.116   6.340
    6    HG3  MET  63           HG3      MET  63 -19.457   3.361   6.252
    7    HE1  MET  63           HE1      MET  63 -19.075   6.501   4.514
    8    HE3  MET  63           HE2      MET  63 -19.004   5.998   2.826
    9    HE2  MET  63           HE3      MET  63 -17.514   6.344   3.706

  No H/Q in entry =           9
  In of MODEL   70
    1    H    LEU  64           H        LEU  64 -24.315   3.152   6.055
    2    HA   LEU  64           HA       LEU  64 -25.577   4.510   3.966
    3    HB2  LEU  64           HB2      LEU  64 -26.358   2.372   4.890
    4    HB3  LEU  64           HB3      LEU  64 -26.856   3.201   6.364
    5    HG   LEU  64           HG       LEU  64 -28.598   4.377   5.125
    6   HD13  LEU  64          HD11      LEU  64 -28.318   4.622   2.893
    7   HD12  LEU  64          HD12      LEU  64 -28.892   2.960   2.752
    8   HD11  LEU  64          HD13      LEU  64 -27.162   3.293   2.814
    9   HD23  LEU  64          HD21      LEU  64 -28.994   1.542   4.387
   10   HD22  LEU  64          HD22      LEU  64 -30.032   2.635   5.299
   11   HD21  LEU  64          HD23      LEU  64 -28.628   1.905   6.074

  No H/Q in entry =          11
  In of MODEL   70
    1    HA   PRO  65           HA       PRO  65 -27.899   7.579   6.698
    2    HB2  PRO  65           HB2      PRO  65 -25.914   7.830   8.958
    3    HB3  PRO  65           HB3      PRO  65 -27.663   8.038   8.997
    4    HG2  PRO  65           HG2      PRO  65 -26.643   5.829   9.936
    5    HG3  PRO  65           HG3      PRO  65 -28.057   5.731   8.887
    6    HD2  PRO  65           HD2      PRO  65 -25.159   5.236   8.195
    7    HD3  PRO  65           HD3      PRO  65 -26.577   4.288   7.746

  No H/Q in entry =           7
  In of MODEL   70
    1    H    GLU  66           H        GLU  66 -24.344   7.673   6.783
    2    HA   GLU  66           HA       GLU  66 -24.162  10.480   6.368
    3    HB2  GLU  66           HB2      GLU  66 -22.252   8.247   5.732
    4    HB3  GLU  66           HB3      GLU  66 -21.872   9.957   5.519
    5    HG2  GLU  66           HG2      GLU  66 -22.107  10.326   7.884
    6    HG3  GLU  66           HG3      GLU  66 -22.563   8.639   8.120

  No H/Q in entry =           6
  In of MODEL   70
    1    H    ILE  67           H        ILE  67 -24.142   7.724   4.126
    2    HA   ILE  67           HA       ILE  67 -23.789   9.440   1.828
    3    HB   ILE  67           HB       ILE  67 -24.567   6.499   2.016
    4   HG12  ILE  67          HG12      ILE  67 -21.985   7.772   1.098
    5   HG13  ILE  67          HG13      ILE  67 -22.268   7.347   2.784
    6   HG21  ILE  67          HG21      ILE  67 -24.580   8.369  -0.216
    7   HG23  ILE  67          HG22      ILE  67 -25.137   6.697  -0.161
    8   HG22  ILE  67          HG23      ILE  67 -23.441   7.050  -0.485
    9   HD12  ILE  67          HD11      ILE  67 -21.768   5.585   0.443
   10   HD11  ILE  67          HD12      ILE  67 -22.763   4.977   1.765
   11   HD13  ILE  67          HD13      ILE  67 -21.110   5.510   2.077

  No H/Q in entry =          11
  In of MODEL   70
    1    H    GLN  68           H        GLN  68 -26.619   8.276   3.456
    2    HA   GLN  68           HA       GLN  68 -28.477   9.124   1.473
    3    HB2  GLN  68           HB2      GLN  68 -28.729   8.768   4.457
    4    HB3  GLN  68           HB3      GLN  68 -30.068   9.306   3.457
    5    HG2  GLN  68           HG2      GLN  68 -30.010   7.271   2.189
    6    HG3  GLN  68           HG3      GLN  68 -28.541   6.757   2.998
    7   HE21  GLN  68          HE21      GLN  68 -30.664   5.312   2.861
    8   HE22  GLN  68          HE22      GLN  68 -31.478   4.828   4.276

  No H/Q in entry =           8
  In of MODEL   70
    1    H    ARG  69           H        ARG  69 -26.949  10.864   4.209
    2    HA   ARG  69           HA       ARG  69 -28.408  13.288   3.789
    3    HB2  ARG  69           HB2      ARG  69 -26.034  12.458   5.389
    4    HB3  ARG  69           HB3      ARG  69 -26.179  14.172   5.023
    5    HG2  ARG  69           HG2      ARG  69 -28.498  14.127   5.987
    6    HG3  ARG  69           HG3      ARG  69 -28.226  12.449   6.468
    7    HD2  ARG  69           HD2      ARG  69 -26.629  14.871   7.379
    8    HD3  ARG  69           HD3      ARG  69 -27.725  13.925   8.373
    9    HE   ARG  69           HE       ARG  69 -25.077  13.093   7.435
   10   HH21  ARG  69          HH11      ARG  69 -24.203  11.367   8.639
   11   HH22  ARG  69          HH12      ARG  69 -25.203  10.515   9.768
   12   HH11  ARG  69          HH21      ARG  69 -28.015  12.437   9.126
   13   HH12  ARG  69          HH22      ARG  69 -27.360  11.118  10.041

  No H/Q in entry =          13
  In of MODEL   70
    1    H    LEU  70           H        LEU  70 -25.481  11.990   2.443
    2    HA   LEU  70           HA       LEU  70 -24.456  14.392   1.270
    3    HB2  LEU  70           HB2      LEU  70 -23.375  12.117   1.876
    4    HB3  LEU  70           HB3      LEU  70 -23.967  11.622   0.291
    5    HG   LEU  70           HG       LEU  70 -22.423  13.051  -0.796
    6   HD11  LEU  70          HD11      LEU  70 -21.643  13.935   1.991
    7   HD13  LEU  70          HD12      LEU  70 -22.374  14.937   0.738
    8   HD12  LEU  70          HD13      LEU  70 -20.737  14.318   0.525
    9   HD22  LEU  70          HD21      LEU  70 -20.927  11.391  -0.553
   10   HD21  LEU  70          HD22      LEU  70 -21.836  10.839   0.854
   11   HD23  LEU  70          HD23      LEU  70 -20.494  11.964   1.058

  No H/Q in entry =          11
  In of MODEL   70
    1    H    LEU  71           H        LEU  71 -26.507  11.765   0.158
    2    HA   LEU  71           HA       LEU  71 -27.082  13.223  -2.366
    3    HB2  LEU  71           HB2      LEU  71 -27.176  10.234  -1.909
    4    HB3  LEU  71           HB3      LEU  71 -27.332  11.084  -3.446
    5    HG   LEU  71           HG       LEU  71 -24.819  11.197  -1.778
    6   HD12  LEU  71          HD11      LEU  71 -24.804   9.560  -4.204
    7   HD11  LEU  71          HD12      LEU  71 -25.794   8.904  -2.902
    8   HD13  LEU  71          HD13      LEU  71 -24.088   9.248  -2.623
    9   HD22  LEU  71          HD21      LEU  71 -24.986  13.003  -3.279
   10   HD21  LEU  71          HD22      LEU  71 -25.439  11.938  -4.608
   11   HD23  LEU  71          HD23      LEU  71 -23.816  11.854  -3.925

  No H/Q in entry =          11
  In of MODEL   70
    1    HA   PRO  72           HA       PRO  72 -30.936  12.640   0.247
    2    HB2  PRO  72           HB2      PRO  72 -31.885  15.168   0.153
    3    HB3  PRO  72           HB3      PRO  72 -30.563  14.769   1.251
    4    HG2  PRO  72           HG2      PRO  72 -30.414  15.959  -1.508
    5    HG3  PRO  72           HG3      PRO  72 -29.672  16.544  -0.018
    6    HD2  PRO  72           HD2      PRO  72 -28.274  15.028  -1.775
    7    HD3  PRO  72           HD3      PRO  72 -28.018  14.876  -0.037

  No H/Q in entry =           7
  In of MODEL   70
    1    H    ASN  73           H        ASN  73 -30.338  13.606  -2.970
    2    HA   ASN  73           HA       ASN  73 -33.183  13.194  -3.608
    3    HB2  ASN  73           HB2      ASN  73 -32.751  14.308  -5.709
    4    HB3  ASN  73           HB3      ASN  73 -32.268  15.311  -4.350
    5   HD21  ASN  73          HD21      ASN  73 -31.467  15.375  -7.025
    6   HD22  ASN  73          HD22      ASN  73 -29.794  15.272  -7.212

  No H/Q in entry =           6
  In of MODEL   70
    1    H    LYS  74           H        LYS  74 -31.125  11.010  -3.170
    2    HA   LYS  74           HA       LYS  74 -31.637   9.588  -5.714
    3    HB2  LYS  74           HB2      LYS  74 -29.099   9.391  -4.086
    4    HB3  LYS  74           HB3      LYS  74 -29.451   8.560  -5.602
    5    HG2  LYS  74           HG2      LYS  74 -29.290  11.538  -5.410
    6    HG3  LYS  74           HG3      LYS  74 -27.878  10.523  -5.707
    7    HD2  LYS  74           HD2      LYS  74 -28.958   9.550  -7.650
    8    HD3  LYS  74           HD3      LYS  74 -30.412  10.499  -7.336
    9    HE2  LYS  74           HE2      LYS  74 -29.255  12.544  -7.783
   10    HE3  LYS  74           HE3      LYS  74 -27.704  11.708  -7.867
   11    HZ2  LYS  74           HZ1      LYS  74 -29.188  12.251  -9.999
   12    HZ1  LYS  74           HZ2      LYS  74 -29.792  10.708  -9.622
   13    HZ3  LYS  74           HZ3      LYS  74 -28.132  10.925  -9.915

  No H/Q in entry =          13
  In of MODEL   70
    1    HA   PRO  75           HA       PRO  75 -32.935   6.567  -2.736
    2    HB2  PRO  75           HB2      PRO  75 -33.165   4.334  -4.311
    3    HB3  PRO  75           HB3      PRO  75 -34.336   5.649  -4.388
    4    HG2  PRO  75           HG2      PRO  75 -31.975   5.126  -6.150
    5    HG3  PRO  75           HG3      PRO  75 -33.636   5.505  -6.604
    6    HD2  PRO  75           HD2      PRO  75 -31.759   7.435  -6.563
    7    HD3  PRO  75           HD3      PRO  75 -33.406   7.781  -6.031

  No H/Q in entry =           7
  In of MODEL   70
    1    H    VAL  76           H        VAL  76 -31.451   5.568  -1.356
    2    HA   VAL  76           HA       VAL  76 -28.944   4.439  -2.451
    3    HB   VAL  76           HB       VAL  76 -29.289   5.904   0.200
    4   HG11  VAL  76          HG11      VAL  76 -26.886   4.693  -1.179
    5   HG13  VAL  76          HG12      VAL  76 -27.571   4.225   0.378
    6   HG12  VAL  76          HG13      VAL  76 -26.778   5.789   0.198
    7   HG22  VAL  76          HG21      VAL  76 -28.684   7.823  -0.692
    8   HG21  VAL  76          HG22      VAL  76 -29.198   7.104  -2.219
    9   HG23  VAL  76          HG23      VAL  76 -27.495   7.076  -1.759

  No H/Q in entry =           9
  In of MODEL   70
    1    H    GLU  77           H        GLU  77 -28.655   2.295  -1.829
    2    HA   GLU  77           HA       GLU  77 -29.423   1.492   0.825
    3    HB2  GLU  77           HB2      GLU  77 -30.971  -0.212   0.297
    4    HB3  GLU  77           HB3      GLU  77 -31.569   1.289  -0.413
    5    HG2  GLU  77           HG2      GLU  77 -30.928   0.544  -2.595
    6    HG3  GLU  77           HG3      GLU  77 -30.238  -0.928  -1.914

  No H/Q in entry =           6
  In of MODEL   70
    1    H    VAL  78           H        VAL  78 -29.027  -0.580   1.494
    2    HA   VAL  78           HA       VAL  78 -26.333  -1.264   0.618
    3    HB   VAL  78           HB       VAL  78 -28.017  -2.196   2.982
    4   HG11  VAL  78          HG11      VAL  78 -25.634  -3.348   1.868
    5   HG13  VAL  78          HG12      VAL  78 -26.529  -3.845   3.306
    6   HG12  VAL  78          HG13      VAL  78 -25.251  -2.638   3.436
    7   HG22  VAL  78          HG21      VAL  78 -26.610  -0.780   4.319
    8   HG21  VAL  78          HG22      VAL  78 -27.375   0.160   3.037
    9   HG23  VAL  78          HG23      VAL  78 -25.680  -0.310   2.895

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ILE  79           H        ILE  79 -25.728  -3.156  -0.279
    2    HA   ILE  79           HA       ILE  79 -27.732  -4.709  -1.627
    3    HB   ILE  79           HB       ILE  79 -24.726  -5.132  -1.394
    4   HG12  ILE  79          HG12      ILE  79 -26.393  -4.094  -3.691
    5   HG13  ILE  79          HG13      ILE  79 -25.557  -3.050  -2.540
    6   HG22  ILE  79          HG21      ILE  79 -25.779  -6.358  -3.712
    7   HG21  ILE  79          HG22      ILE  79 -26.750  -6.907  -2.344
    8   HG23  ILE  79          HG23      ILE  79 -25.001  -7.125  -2.328
    9   HD13  ILE  79          HD11      ILE  79 -24.134  -3.122  -4.354
   10   HD12  ILE  79          HD12      ILE  79 -24.414  -4.841  -4.629
   11   HD11  ILE  79          HD13      ILE  79 -23.452  -4.314  -3.246

  No H/Q in entry =          11
  In of MODEL   70
    1    H    ASP  80           H        ASP  80 -28.532  -6.658  -1.038
    2    HA   ASP  80           HA       ASP  80 -28.457  -7.545   1.613
    3    HB2  ASP  80           HB2      ASP  80 -30.184  -8.188  -0.030
    4    HB3  ASP  80           HB3      ASP  80 -28.989  -9.159  -0.891

  No H/Q in entry =           4
  In of MODEL   70
    1    H    SER  81           H        SER  81 -26.887  -8.622   2.752
    2    HA   SER  81           HA       SER  81 -24.364  -9.223   1.572
    3    HB2  SER  81           HB2      SER  81 -23.781 -10.217   3.745
    4    HB3  SER  81           HB3      SER  81 -24.548  -8.643   3.953
    5    HG   SER  81           HG       SER  81 -25.902 -11.110   4.113

  No H/Q in entry =           5
  In of MODEL   70
    1    H    LEU  82           H        LEU  82 -27.002 -11.404   1.894
    2    HA   LEU  82           HA       LEU  82 -25.372 -13.721   1.388
    3    HB2  LEU  82           HB2      LEU  82 -28.327 -13.209   1.117
    4    HB3  LEU  82           HB3      LEU  82 -27.566 -14.787   0.924
    5    HG   LEU  82           HG       LEU  82 -27.578 -13.185   3.463
    6   HD13  LEU  82          HD11      LEU  82 -29.218 -14.825   4.234
    7   HD12  LEU  82          HD12      LEU  82 -29.173 -15.632   2.664
    8   HD11  LEU  82          HD13      LEU  82 -29.825 -13.998   2.798
    9   HD21  LEU  82          HD21      LEU  82 -26.494 -15.846   2.586
   10   HD23  LEU  82          HD22      LEU  82 -26.893 -15.544   4.277
   11   HD22  LEU  82          HD23      LEU  82 -25.678 -14.555   3.469

  No H/Q in entry =          11
  In of MODEL   70
    1    H    LEU  83           H        LEU  83 -27.399 -11.572  -0.546
    2    HA   LEU  83           HA       LEU  83 -27.145 -12.934  -3.010
    3    HB2  LEU  83           HB2      LEU  83 -27.656 -10.039  -2.377
    4    HB3  LEU  83           HB3      LEU  83 -27.660 -10.692  -4.015
    5    HG   LEU  83           HG       LEU  83 -29.686 -11.138  -1.843
    6   HD13  LEU  83          HD11      LEU  83 -30.502  -9.322  -2.918
    7   HD12  LEU  83          HD12      LEU  83 -30.923 -10.457  -4.199
    8   HD11  LEU  83          HD13      LEU  83 -29.418  -9.539  -4.291
    9   HD23  LEU  83          HD21      LEU  83 -29.774 -12.412  -4.563
   10   HD22  LEU  83          HD22      LEU  83 -30.735 -12.790  -3.134
   11   HD21  LEU  83          HD23      LEU  83 -29.030 -13.234  -3.191

  No H/Q in entry =          11
  In of MODEL   70
    1    H    TYR  84           H        TYR  84 -25.279 -10.475  -1.340
    2    HA   TYR  84           HA       TYR  84 -23.428  -9.934  -3.466
    3    HB2  TYR  84           HB2      TYR  84 -24.013  -8.471  -1.432
    4    HB3  TYR  84           HB3      TYR  84 -22.924  -9.520  -0.525
    5    HD1  TYR  84           HD1      TYR  84 -20.564  -9.890  -1.826
    6    HD2  TYR  84           HD2      TYR  84 -23.103  -6.473  -2.176
    7    HE1  TYR  84           HE1      TYR  84 -18.635  -8.550  -2.594
    8    HE2  TYR  84           HE2      TYR  84 -21.186  -5.125  -2.955
    9    HH   TYR  84           HH       TYR  84 -17.921  -6.570  -3.169

  No H/Q in entry =           9
  In of MODEL   70
    1    H    GLY  85           H        GLY  85 -23.129 -11.913  -0.509
    2    HA3  GLY  85           HA2      GLY  85 -20.519 -12.770  -0.981
    3    HA2  GLY  85           HA3      GLY  85 -21.723 -13.653  -0.043

  No H/Q in entry =           3
  In of MODEL   70
    1    H    LYS  86           H        LYS  86 -23.550 -14.099  -2.108
    2    HA   LYS  86           HA       LYS  86 -22.411 -16.442  -3.352
    3    HB2  LYS  86           HB2      LYS  86 -25.104 -15.086  -3.455
    4    HB3  LYS  86           HB3      LYS  86 -24.745 -16.626  -4.233
    5    HG2  LYS  86           HG2      LYS  86 -24.406 -17.662  -2.101
    6    HG3  LYS  86           HG3      LYS  86 -24.648 -16.119  -1.285
    7    HD2  LYS  86           HD2      LYS  86 -26.758 -17.173  -1.197
    8    HD3  LYS  86           HD3      LYS  86 -26.890 -16.012  -2.516
    9    HE2  LYS  86           HE2      LYS  86 -26.716 -17.688  -4.152
   10    HE3  LYS  86           HE3      LYS  86 -26.102 -18.868  -2.996
   11    HZ3  LYS  86           HZ1      LYS  86 -28.419 -19.290  -3.476
   12    HZ2  LYS  86           HZ2      LYS  86 -28.838 -17.706  -3.026
   13    HZ1  LYS  86           HZ3      LYS  86 -28.254 -18.793  -1.860

  No H/Q in entry =          13
  In of MODEL   70
    1    H    VAL  87           H        VAL  87 -22.507 -13.233  -4.261
    2    HA   VAL  87           HA       VAL  87 -22.242 -12.059  -6.206
    3    HB   VAL  87           HB       VAL  87 -21.079 -14.550  -7.492
    4   HG13  VAL  87          HG11      VAL  87 -19.862 -13.045  -8.811
    5   HG12  VAL  87          HG12      VAL  87 -20.001 -11.745  -7.627
    6   HG11  VAL  87          HG13      VAL  87 -21.394 -12.197  -8.607
    7   HG23  VAL  87          HG21      VAL  87 -18.870 -13.684  -6.482
    8   HG22  VAL  87          HG22      VAL  87 -19.935 -14.667  -5.480
    9   HG21  VAL  87          HG23      VAL  87 -19.904 -12.917  -5.278

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ASP  88           H        ASP  88 -24.736 -12.785  -5.859
    2    HA   ASP  88           HA       ASP  88 -25.808 -14.051  -8.254
    3    HB2  ASP  88           HB2      ASP  88 -26.801 -14.319  -5.931
    4    HB3  ASP  88           HB3      ASP  88 -27.312 -12.634  -6.040

  No H/Q in entry =           4
  In of MODEL   70
    1    H    GLY  89           H        GLY  89 -25.143 -12.778  -9.900
    2    HA3  GLY  89           HA2      GLY  89 -25.420 -10.014 -10.114
    3    HA2  GLY  89           HA3      GLY  89 -25.353 -11.140 -11.469

  No H/Q in entry =           3
  In of MODEL   70
    1    H    LEU  90           H        LEU  90 -27.753 -12.574 -11.020
    2    HA   LEU  90           HA       LEU  90 -29.627 -10.708 -12.148
    3    HB2  LEU  90           HB2      LEU  90 -29.606 -13.108 -12.716
    4    HB3  LEU  90           HB3      LEU  90 -30.103 -13.484 -11.066
    5    HG   LEU  90           HG       LEU  90 -32.259 -12.443 -11.441
    6   HD13  LEU  90          HD11      LEU  90 -32.137 -10.704 -12.924
    7   HD12  LEU  90          HD12      LEU  90 -32.629 -11.965 -14.056
    8   HD11  LEU  90          HD13      LEU  90 -30.931 -11.510 -13.930
    9   HD23  LEU  90          HD21      LEU  90 -32.126 -14.082 -13.867
   10   HD22  LEU  90          HD22      LEU  90 -33.103 -14.273 -12.412
   11   HD21  LEU  90          HD23      LEU  90 -31.428 -14.828 -12.429

  No H/Q in entry =          11
  In of MODEL   70
    1    H    GLY  91           H        GLY  91 -29.414 -12.186  -8.956
    2    HA3  GLY  91           HA2      GLY  91 -31.793 -11.152  -7.927
    3    HA2  GLY  91           HA3      GLY  91 -30.386 -11.631  -6.979

  No H/Q in entry =           3
  In of MODEL   70
    1    H    VAL  92           H        VAL  92 -28.530  -9.742  -7.840
    2    HA   VAL  92           HA       VAL  92 -29.406  -7.463  -6.305
    3    HB   VAL  92           HB       VAL  92 -26.841  -7.850  -7.892
    4   HG12  VAL  92          HG11      VAL  92 -27.077  -5.960  -5.576
    5   HG11  VAL  92          HG12      VAL  92 -27.757  -5.448  -7.122
    6   HG13  VAL  92          HG13      VAL  92 -26.046  -5.856  -7.004
    7   HG22  VAL  92          HG21      VAL  92 -26.565  -9.422  -6.292
    8   HG21  VAL  92          HG22      VAL  92 -27.740  -8.676  -5.205
    9   HG23  VAL  92          HG23      VAL  92 -26.108  -8.019  -5.325

  No H/Q in entry =           9
  In of MODEL   70
    1    H    LEU  93           H        LEU  93 -28.967  -8.127  -9.721
    2    HA   LEU  93           HA       LEU  93 -29.404  -5.510 -10.665
    3    HB2  LEU  93           HB2      LEU  93 -28.694  -7.348 -12.116
    4    HB3  LEU  93           HB3      LEU  93 -30.259  -8.130 -11.892
    5    HG   LEU  93           HG       LEU  93 -31.336  -6.210 -13.029
    6   HD11  LEU  93          HD11      LEU  93 -29.543  -4.548 -12.529
    7   HD13  LEU  93          HD12      LEU  93 -29.977  -4.602 -14.238
    8   HD12  LEU  93          HD13      LEU  93 -28.498  -5.382 -13.680
    9   HD23  LEU  93          HD21      LEU  93 -30.272  -6.752 -15.311
   10   HD22  LEU  93          HD22      LEU  93 -31.072  -8.033 -14.400
   11   HD21  LEU  93          HD23      LEU  93 -29.310  -7.915 -14.399

  No H/Q in entry =          11
  In of MODEL   70
    1    H    LYS  94           H        LYS  94 -31.689  -8.134  -9.807
    2    HA   LYS  94           HA       LYS  94 -34.081  -6.779 -10.444
    3    HB2  LYS  94           HB2      LYS  94 -33.496  -8.934  -8.420
    4    HB3  LYS  94           HB3      LYS  94 -35.116  -8.297  -8.696
    5    HG2  LYS  94           HG2      LYS  94 -34.996  -9.081 -11.025
    6    HG3  LYS  94           HG3      LYS  94 -33.411  -9.774 -10.690
    7    HD2  LYS  94           HD2      LYS  94 -34.488 -11.137  -8.860
    8    HD3  LYS  94           HD3      LYS  94 -36.051 -10.548  -9.422
    9    HE2  LYS  94           HE2      LYS  94 -35.499 -11.470 -11.683
   10    HE3  LYS  94           HE3      LYS  94 -34.059 -12.199 -10.973
   11    HZ3  LYS  94           HZ1      LYS  94 -35.853 -13.786 -11.138
   12    HZ2  LYS  94           HZ2      LYS  94 -36.865 -12.790 -10.205
   13    HZ1  LYS  94           HZ3      LYS  94 -35.481 -13.486  -9.510

  No H/Q in entry =          13
  In of MODEL   70
    1    H    ALA  95           H        ALA  95 -32.262  -6.820  -7.392
    2    HA   ALA  95           HA       ALA  95 -34.169  -5.299  -5.924
    3    HB2  ALA  95           HB1      ALA  95 -31.747  -6.586  -5.375
    4    HB3  ALA  95           HB2      ALA  95 -32.760  -5.711  -4.229
    5    HB1  ALA  95           HB3      ALA  95 -31.439  -4.880  -5.051

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ALA  96           H        ALA  96 -31.554  -4.363  -8.020
    2    HA   ALA  96           HA       ALA  96 -31.555  -1.597  -7.259
    3    HB2  ALA  96           HB1      ALA  96 -30.198  -1.333  -9.368
    4    HB3  ALA  96           HB2      ALA  96 -30.441  -3.051  -9.679
    5    HB1  ALA  96           HB3      ALA  96 -29.547  -2.533  -8.251

  No H/Q in entry =           5
  In of MODEL   70
    1    H    VAL  97           H        VAL  97 -33.022  -3.376  -9.940
    2    HA   VAL  97           HA       VAL  97 -34.167  -1.121 -11.209
    3    HB   VAL  97           HB       VAL  97 -34.876  -4.073 -11.240
    4   HG11  VAL  97          HG11      VAL  97 -36.734  -2.131 -11.739
    5   HG13  VAL  97          HG12      VAL  97 -36.738  -3.729 -12.487
    6   HG12  VAL  97          HG13      VAL  97 -36.029  -2.359 -13.339
    7   HG21  VAL  97          HG21      VAL  97 -33.656  -2.212 -13.281
    8   HG23  VAL  97          HG22      VAL  97 -34.050  -3.908 -13.563
    9   HG22  VAL  97          HG23      VAL  97 -32.818  -3.473 -12.377

  No H/Q in entry =           9
  In of MODEL   70
    1    H    ALA  98           H        ALA  98 -35.280  -3.327  -8.665
    2    HA   ALA  98           HA       ALA  98 -37.879  -2.264  -8.325
    3    HB1  ALA  98           HB1      ALA  98 -36.794  -4.423  -7.279
    4    HB3  ALA  98           HB2      ALA  98 -38.007  -3.534  -6.355
    5    HB2  ALA  98           HB3      ALA  98 -36.294  -3.326  -5.992

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ALA  99           H        ALA  99 -34.832  -1.355  -6.675
    2    HA   ALA  99           HA       ALA  99 -36.031   0.598  -5.025
    3    HB1  ALA  99           HB1      ALA  99 -33.353  -0.206  -5.763
    4    HB2  ALA  99           HB2      ALA  99 -33.931   0.532  -4.269
    5    HB3  ALA  99           HB3      ALA  99 -33.485   1.548  -5.640

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ILE 100           H        ILE 100 -34.988   0.748  -8.379
    2    HA   ILE 100           HA       ILE 100 -35.259   3.589  -8.610
    3    HB   ILE 100           HB       ILE 100 -35.280   1.422 -10.740
    4   HG12  ILE 100          HG12      ILE 100 -33.184   3.487 -10.074
    5   HG13  ILE 100          HG13      ILE 100 -33.168   1.843  -9.437
    6   HG21  ILE 100          HG21      ILE 100 -35.798   4.326 -10.884
    7   HG23  ILE 100          HG22      ILE 100 -36.260   3.037 -11.996
    8   HG22  ILE 100          HG23      ILE 100 -34.629   3.706 -12.050
    9   HD12  ILE 100          HD11      ILE 100 -32.661   2.805 -12.214
   10   HD11  ILE 100          HD12      ILE 100 -33.269   1.170 -11.953
   11   HD13  ILE 100          HD13      ILE 100 -31.741   1.667 -11.232

  No H/Q in entry =          11
  In of MODEL   70
    1    H    LYS 101           H        LYS 101 -37.466   0.903  -9.330
    2    HA   LYS 101           HA       LYS 101 -39.597   2.479 -10.340
    3    HB2  LYS 101           HB2      LYS 101 -39.394  -0.285  -9.202
    4    HB3  LYS 101           HB3      LYS 101 -40.969   0.425  -9.553
    5    HG2  LYS 101           HG2      LYS 101 -40.495   0.565 -11.849
    6    HG3  LYS 101           HG3      LYS 101 -38.787   0.216 -11.590
    7    HD2  LYS 101           HD2      LYS 101 -39.973  -1.735 -12.471
    8    HD3  LYS 101           HD3      LYS 101 -39.339  -2.038 -10.853
    9    HE2  LYS 101           HE2      LYS 101 -41.379  -2.797 -10.348
   10    HE3  LYS 101           HE3      LYS 101 -41.890  -1.109 -10.359
   11    HZ3  LYS 101           HZ1      LYS 101 -42.772  -1.303 -12.478
   12    HZ2  LYS 101           HZ2      LYS 101 -43.187  -2.788 -11.765
   13    HZ1  LYS 101           HZ3      LYS 101 -41.880  -2.701 -12.846

  No H/Q in entry =          13
  In of MODEL   70
    1    H    LYS 102           H        LYS 102 -39.065   1.031  -7.125
    2    HA   LYS 102           HA       LYS 102 -41.352   2.158  -5.936
    3    HB2  LYS 102           HB2      LYS 102 -40.059   0.336  -4.911
    4    HB3  LYS 102           HB3      LYS 102 -38.703   1.437  -4.669
    5    HG2  LYS 102           HG2      LYS 102 -40.067   2.794  -3.181
    6    HG3  LYS 102           HG3      LYS 102 -41.426   1.696  -3.425
    7    HD2  LYS 102           HD2      LYS 102 -40.143  -0.125  -2.389
    8    HD3  LYS 102           HD3      LYS 102 -38.784   0.973  -2.143
    9    HE2  LYS 102           HE2      LYS 102 -40.189   2.412  -0.743
   10    HE3  LYS 102           HE3      LYS 102 -41.566   1.344  -1.010
   11    HZ1  LYS 102           HZ1      LYS 102 -39.791  -0.351   0.004
   12    HZ3  LYS 102           HZ2      LYS 102 -40.932   0.502   0.928
   13    HZ2  LYS 102           HZ3      LYS 102 -39.339   1.078   0.802

  No H/Q in entry =          13
  In of MODEL   70
    1    H    ALA 103           H        ALA 103 -38.443   3.640  -6.948
    2    HA   ALA 103           HA       ALA 103 -38.744   5.953  -5.175
    3    HB2  ALA 103           HB1      ALA 103 -36.774   6.745  -6.749
    4    HB3  ALA 103           HB2      ALA 103 -36.682   5.028  -7.141
    5    HB1  ALA 103           HB3      ALA 103 -36.475   5.565  -5.474

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ALA 104           H        ALA 104 -39.333   5.190  -8.520
    2    HA   ALA 104           HA       ALA 104 -40.007   7.952  -9.154
    3    HB2  ALA 104           HB1      ALA 104 -40.023   7.275 -11.353
    4    HB1  ALA 104           HB2      ALA 104 -40.700   5.693 -10.971
    5    HB3  ALA 104           HB3      ALA 104 -38.988   6.012 -10.689

  No H/Q in entry =           5
  In of MODEL   70
    1    H    ALA 105           H        ALA 105 -41.550   5.803  -7.345
    2    HA   ALA 105           HA       ALA 105 -44.019   7.117  -7.329
    3    HB2  ALA 105           HB1      ALA 105 -44.730   6.227  -9.366
    4    HB3  ALA 105           HB2      ALA 105 -45.331   5.022  -8.226
    5    HB1  ALA 105           HB3      ALA 105 -43.848   4.719  -9.130

  No H/Q in entry =           5
  In of MODEL   71
    1    H1   ALA   1           H3       ALA   1 -12.029 -16.097  -2.391
    2    H2   ALA   1           H2       ALA   1 -11.068 -17.227  -3.227
    3    H3   ALA   1           H1       ALA   1 -12.225 -16.302  -4.065
    4    HA   ALA   1           HA       ALA   1 -13.598 -18.023  -3.822
    5    HB3  ALA   1           HB1      ALA   1 -12.176 -19.772  -3.353
    6    HB1  ALA   1           HB2      ALA   1 -12.936 -19.667  -1.766
    7    HB2  ALA   1           HB3      ALA   1 -11.372 -18.903  -2.046

  No H/Q in entry =           7
  In of MODEL   71
    1    H    GLU   2           H        GLU   2 -15.211 -18.898  -2.168
    2    HA   GLU   2           HA       GLU   2 -16.886 -17.200  -1.117
    3    HB2  GLU   2           HB2      GLU   2 -15.913 -19.606   0.436
    4    HB3  GLU   2           HB3      GLU   2 -17.450 -18.779   0.685
    5    HG2  GLU   2           HG2      GLU   2 -18.410 -19.885  -1.048
    6    HG3  GLU   2           HG3      GLU   2 -17.092 -19.467  -2.131

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLU   3           H        GLU   3 -14.958 -18.516   1.513
    2    HA   GLU   3           HA       GLU   3 -15.218 -16.162   3.063
    3    HB2  GLU   3           HB2      GLU   3 -13.594 -18.684   3.324
    4    HB3  GLU   3           HB3      GLU   3 -13.385 -17.358   4.467
    5    HG2  GLU   3           HG2      GLU   3 -15.577 -17.540   5.282
    6    HG3  GLU   3           HG3      GLU   3 -16.157 -18.353   3.835

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LEU   4           H        LEU   4 -12.238 -17.600   1.681
    2    HA   LEU   4           HA       LEU   4 -10.434 -15.667   2.277
    3    HB2  LEU   4           HB2      LEU   4 -10.641 -16.976  -0.444
    4    HB3  LEU   4           HB3      LEU   4  -9.201 -16.232   0.241
    5    HG   LEU   4           HG       LEU   4 -10.660 -18.648   1.358
    6   HD13  LEU   4          HD11      LEU   4  -9.006 -19.981   0.435
    7   HD12  LEU   4          HD12      LEU   4  -7.816 -18.680   0.407
    8   HD11  LEU   4          HD13      LEU   4  -9.102 -18.725  -0.798
    9   HD23  LEU   4          HD21      LEU   4  -8.411 -18.673   2.743
   10   HD22  LEU   4          HD22      LEU   4  -9.748 -17.653   3.267
   11   HD21  LEU   4          HD23      LEU   4  -8.395 -16.946   2.385

  No H/Q in entry =          11
  In of MODEL   71
    1    H    GLU   5           H        GLU   5 -12.767 -15.503  -0.402
    2    HA   GLU   5           HA       GLU   5 -11.800 -13.008  -1.407
    3    HB2  GLU   5           HB2      GLU   5 -13.120 -14.620  -2.766
    4    HB3  GLU   5           HB3      GLU   5 -14.528 -14.271  -1.761
    5    HG2  GLU   5           HG2      GLU   5 -14.432 -11.905  -2.414
    6    HG3  GLU   5           HG3      GLU   5 -12.997 -12.222  -3.390

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLU   6           H        GLU   6 -14.515 -13.921   0.682
    2    HA   GLU   6           HA       GLU   6 -15.460 -11.257   1.073
    3    HB2  GLU   6           HB2      GLU   6 -15.843 -13.802   2.663
    4    HB3  GLU   6           HB3      GLU   6 -16.659 -12.285   3.037
    5    HG2  GLU   6           HG2      GLU   6 -17.690 -12.254   0.820
    6    HG3  GLU   6           HG3      GLU   6 -16.821 -13.721   0.373

  No H/Q in entry =           6
  In of MODEL   71
    1    H    VAL   7           H        VAL   7 -13.125 -13.328   2.654
    2    HA   VAL   7           HA       VAL   7 -12.686 -11.740   4.978
    3    HB   VAL   7           HB       VAL   7 -10.949 -13.762   3.537
    4   HG11  VAL   7          HG11      VAL   7 -10.509 -12.215   6.098
    5   HG13  VAL   7          HG12      VAL   7  -9.403 -12.416   4.740
    6   HG12  VAL   7          HG13      VAL   7  -9.738 -13.775   5.813
    7   HG21  VAL   7          HG21      VAL   7 -13.194 -14.356   4.754
    8   HG23  VAL   7          HG22      VAL   7 -12.273 -14.064   6.231
    9   HG22  VAL   7          HG23      VAL   7 -11.760 -15.320   5.106

  No H/Q in entry =           9
  In of MODEL   71
    1    H    VAL   8           H        VAL   8 -11.167 -11.841   1.771
    2    HA   VAL   8           HA       VAL   8  -9.134  -9.936   2.262
    3    HB   VAL   8           HB       VAL   8 -10.566 -10.775  -0.261
    4   HG11  VAL   8          HG11      VAL   8  -8.484  -8.644   0.191
    5   HG13  VAL   8          HG12      VAL   8  -9.928  -8.584  -0.821
    6   HG12  VAL   8          HG13      VAL   8  -8.532  -9.534  -1.332
    7   HG21  VAL   8          HG21      VAL   8  -8.295 -11.748   1.283
    8   HG23  VAL   8          HG22      VAL   8  -7.771 -11.273  -0.329
    9   HG22  VAL   8          HG23      VAL   8  -9.045 -12.473  -0.140

  No H/Q in entry =           9
  In of MODEL   71
    1    H    MET   9           H        MET   9 -12.482  -9.600   1.095
    2    HA   MET   9           HA       MET   9 -12.460  -6.824   0.652
    3    HB2  MET   9           HB2      MET   9 -14.617  -8.779   1.407
    4    HB3  MET   9           HB3      MET   9 -14.965  -7.050   1.344
    5    HG2  MET   9           HG2      MET   9 -13.893  -7.097  -0.997
    6    HG3  MET   9           HG3      MET   9 -14.040  -8.852  -0.893
    7    HE3  MET   9           HE1      MET   9 -17.590  -9.742  -1.062
    8    HE2  MET   9           HE2      MET   9 -16.813  -9.543   0.506
    9    HE1  MET   9           HE3      MET   9 -15.886 -10.171  -0.856

  No H/Q in entry =           9
  In of MODEL   71
    1    H    GLY  10           H        GLY  10 -13.100  -8.716   3.584
    2    HA3  GLY  10           HA2      GLY  10 -13.684  -6.535   5.295
    3    HA2  GLY  10           HA3      GLY  10 -13.097  -8.114   5.815

  No H/Q in entry =           3
  In of MODEL   71
    1    H    LEU  11           H        LEU  11 -10.647  -8.204   4.505
    2    HA   LEU  11           HA       LEU  11  -8.972  -6.740   6.261
    3    HB2  LEU  11           HB2      LEU  11  -8.399  -8.162   3.659
    4    HB3  LEU  11           HB3      LEU  11  -7.142  -7.435   4.657
    5    HG   LEU  11           HG       LEU  11  -9.114  -9.496   5.676
    6   HD13  LEU  11          HD11      LEU  11  -7.870 -10.718   4.118
    7   HD12  LEU  11          HD12      LEU  11  -6.934 -10.938   5.595
    8   HD11  LEU  11          HD13      LEU  11  -6.410  -9.768   4.385
    9   HD22  LEU  11          HD21      LEU  11  -8.280  -8.465   7.591
   10   HD21  LEU  11          HD22      LEU  11  -6.748  -8.041   6.830
   11   HD23  LEU  11          HD23      LEU  11  -7.049  -9.701   7.344

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  12           H        ILE  12  -9.876  -6.217   2.868
    2    HA   ILE  12           HA       ILE  12  -8.219  -3.962   2.438
    3    HB   ILE  12           HB       ILE  12 -10.858  -4.680   1.139
    4   HG12  ILE  12          HG12      ILE  12  -8.797  -6.298   1.070
    5   HG13  ILE  12          HG13      ILE  12  -9.655  -5.953  -0.417
    6   HG22  ILE  12          HG21      ILE  12 -10.005  -3.265  -0.740
    7   HG21  ILE  12          HG22      ILE  12  -8.660  -2.765   0.277
    8   HG23  ILE  12          HG23      ILE  12 -10.295  -2.364   0.717
    9   HD11  ILE  12          HD11      ILE  12  -7.165  -4.493   0.503
   10   HD13  ILE  12          HD12      ILE  12  -7.954  -4.362  -1.066
   11   HD12  ILE  12          HD13      ILE  12  -7.154  -5.847  -0.611

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  13           H        ILE  13 -11.577  -4.279   3.525
    2    HA   ILE  13           HA       ILE  13 -12.082  -1.499   3.786
    3    HB   ILE  13           HB       ILE  13 -13.251  -3.937   5.148
    4   HG12  ILE  13          HG12      ILE  13 -13.484  -3.401   2.613
    5   HG13  ILE  13          HG13      ILE  13 -14.907  -3.869   3.518
    6   HG21  ILE  13          HG21      ILE  13 -13.787  -1.036   5.589
    7   HG23  ILE  13          HG22      ILE  13 -13.929  -2.378   6.716
    8   HG22  ILE  13          HG23      ILE  13 -15.188  -2.101   5.516
    9   HD12  ILE  13          HD11      ILE  13 -14.928  -1.714   1.945
   10   HD11  ILE  13          HD12      ILE  13 -14.246  -0.981   3.384
   11   HD13  ILE  13          HD13      ILE  13 -15.814  -1.751   3.474

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ASN  14           H        ASN  14 -10.935  -3.964   6.070
    2    HA   ASN  14           HA       ASN  14 -10.766  -2.316   8.351
    3    HB2  ASN  14           HB2      ASN  14 -10.470  -4.920   8.038
    4    HB3  ASN  14           HB3      ASN  14  -8.767  -4.505   7.883
    5   HD21  ASN  14          HD21      ASN  14  -9.383  -6.034  10.062
    6   HD22  ASN  14          HD22      ASN  14  -9.373  -5.109  11.484

  No H/Q in entry =           6
  In of MODEL   71
    1    H    SER  15           H        SER  15  -8.346  -3.107   5.867
    2    HA   SER  15           HA       SER  15  -6.230  -1.576   6.939
    3    HB2  SER  15           HB2      SER  15  -5.199  -1.784   4.786
    4    HB3  SER  15           HB3      SER  15  -6.136  -3.257   5.008
    5    HG   SER  15           HG       SER  15  -6.529  -1.125   3.285

  No H/Q in entry =           5
  In of MODEL   71
    1    H    GLY  16           H        GLY  16  -8.841  -0.760   4.684
    2    HA3  GLY  16           HA2      GLY  16  -8.027   1.894   4.126
    3    HA2  GLY  16           HA3      GLY  16  -9.667   1.270   3.962

  No H/Q in entry =           3
  In of MODEL   71
    1    H    GLN  17           H        GLN  17 -10.203   0.544   6.613
    2    HA   GLN  17           HA       GLN  17 -10.956   3.039   7.744
    3    HB2  GLN  17           HB2      GLN  17 -10.820   0.255   8.915
    4    HB3  GLN  17           HB3      GLN  17 -11.446   1.644   9.806
    5    HG2  GLN  17           HG2      GLN  17 -13.114   2.031   8.026
    6    HG3  GLN  17           HG3      GLN  17 -12.496   0.635   7.146
    7   HE21  GLN  17          HE21      GLN  17 -13.050  -1.489   7.933
    8   HE22  GLN  17          HE22      GLN  17 -14.172  -1.724   9.185

  No H/Q in entry =           8
  In of MODEL   71
    1    H    ALA  18           H        ALA  18  -8.289   0.806   8.376
    2    HA   ALA  18           HA       ALA  18  -7.218   2.049  10.646
    3    HB2  ALA  18           HB1      ALA  18  -6.566  -0.160   9.286
    4    HB3  ALA  18           HB2      ALA  18  -5.419   0.646  10.357
    5    HB1  ALA  18           HB3      ALA  18  -5.343   0.921   8.616

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ARG  19           H        ARG  19  -6.448   2.575   7.197
    2    HA   ARG  19           HA       ARG  19  -4.588   4.658   7.623
    3    HB2  ARG  19           HB2      ARG  19  -4.890   3.504   5.431
    4    HB3  ARG  19           HB3      ARG  19  -6.447   4.316   5.248
    5    HG2  ARG  19           HG2      ARG  19  -5.358   6.508   5.312
    6    HG3  ARG  19           HG3      ARG  19  -3.796   5.752   5.622
    7    HD2  ARG  19           HD2      ARG  19  -3.926   6.333   3.277
    8    HD3  ARG  19           HD3      ARG  19  -3.980   4.572   3.428
    9    HE   ARG  19           HE       ARG  19  -6.629   5.433   3.411
   10   HH21  ARG  19          HH11      ARG  19  -7.823   5.561   1.490
   11   HH22  ARG  19          HH12      ARG  19  -6.999   5.649  -0.028
   12   HH11  ARG  19          HH21      ARG  19  -3.851   5.540   1.383
   13   HH12  ARG  19          HH22      ARG  19  -4.749   5.635  -0.088

  No H/Q in entry =          13
  In of MODEL   71
    1    H    SER  20           H        SER  20  -8.087   4.707   7.015
    2    HA   SER  20           HA       SER  20  -8.495   7.455   6.957
    3    HB2  SER  20           HB2      SER  20 -10.345   6.077   6.421
    4    HB3  SER  20           HB3      SER  20 -10.224   5.193   7.939
    5    HG   SER  20           HG       SER  20 -10.626   7.355   8.916

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LEU  21           H        LEU  21  -8.461   5.282   9.768
    2    HA   LEU  21           HA       LEU  21  -8.943   7.275  11.726
    3    HB2  LEU  21           HB2      LEU  21  -7.546   4.598  11.894
    4    HB3  LEU  21           HB3      LEU  21  -7.865   5.615  13.295
    5    HG   LEU  21           HG       LEU  21 -10.026   4.673  11.386
    6   HD12  LEU  21          HD11      LEU  21  -9.200   3.530  14.071
    7   HD11  LEU  21          HD12      LEU  21  -8.965   2.751  12.507
    8   HD13  LEU  21          HD13      LEU  21 -10.597   3.017  13.123
    9   HD21  LEU  21          HD21      LEU  21  -9.975   6.207  13.978
   10   HD23  LEU  21          HD22      LEU  21 -11.367   5.188  13.627
   11   HD22  LEU  21          HD23      LEU  21 -10.950   6.506  12.541

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ALA  22           H        ALA  22  -5.962   5.954  10.330
    2    HA   ALA  22           HA       ALA  22  -4.112   7.308  11.952
    3    HB2  ALA  22           HB1      ALA  22  -3.656   5.457  10.268
    4    HB1  ALA  22           HB2      ALA  22  -2.485   6.776  10.301
    5    HB3  ALA  22           HB3      ALA  22  -3.699   6.705   9.023

  No H/Q in entry =           5
  In of MODEL   71
    1    H    TYR  23           H        TYR  23  -5.440   8.289   8.763
    2    HA   TYR  23           HA       TYR  23  -4.152  10.810   8.687
    3    HB2  TYR  23           HB2      TYR  23  -5.210   9.872   6.696
    4    HB3  TYR  23           HB3      TYR  23  -6.792   9.950   7.472
    5    HD1  TYR  23           HD1      TYR  23  -3.925  12.046   6.325
    6    HD2  TYR  23           HD2      TYR  23  -8.071  11.935   7.441
    7    HE1  TYR  23           HE1      TYR  23  -4.194  14.389   5.557
    8    HE2  TYR  23           HE2      TYR  23  -8.340  14.278   6.672
    9    HH   TYR  23           HH       TYR  23  -5.658  16.023   5.127

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ALA  24           H        ALA  24  -7.255   9.778  10.062
    2    HA   ALA  24           HA       ALA  24  -8.144  12.353  10.822
    3    HB1  ALA  24           HB1      ALA  24  -9.939  11.069  11.290
    4    HB2  ALA  24           HB2      ALA  24  -9.106  10.518  12.741
    5    HB3  ALA  24           HB3      ALA  24  -8.959   9.604  11.241

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ALA  25           H        ALA  25  -6.099   9.939  12.410
    2    HA   ALA  25           HA       ALA  25  -5.792  11.206  14.909
    3    HB2  ALA  25           HB1      ALA  25  -4.978   8.867  14.098
    4    HB3  ALA  25           HB2      ALA  25  -3.982   9.748  15.258
    5    HB1  ALA  25           HB3      ALA  25  -3.541   9.734  13.550

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LEU  26           H        LEU  26  -3.999  11.530  11.872
    2    HA   LEU  26           HA       LEU  26  -2.078  13.390  12.787
    3    HB2  LEU  26           HB2      LEU  26  -1.749  12.237  10.688
    4    HB3  LEU  26           HB3      LEU  26  -3.234  12.915  10.027
    5    HG   LEU  26           HG       LEU  26  -2.263  15.184  10.158
    6   HD12  LEU  26          HD11      LEU  26   0.274  15.254  10.578
    7   HD11  LEU  26          HD12      LEU  26   0.079  13.672  11.327
    8   HD13  LEU  26          HD13      LEU  26  -0.758  15.073  11.997
    9   HD21  LEU  26          HD21      LEU  26  -0.477  13.159   8.774
   10   HD23  LEU  26          HD22      LEU  26  -0.552  14.878   8.398
   11   HD22  LEU  26          HD23      LEU  26  -1.955  13.852   8.109

  No H/Q in entry =          11
  In of MODEL   71
    1    H    LYS  27           H        LYS  27  -5.265  13.807  11.300
    2    HA   LYS  27           HA       LYS  27  -5.262  16.595  11.092
    3    HB2  LYS  27           HB2      LYS  27  -6.975  15.082  10.107
    4    HB3  LYS  27           HB3      LYS  27  -7.631  14.819  11.723
    5    HG2  LYS  27           HG2      LYS  27  -8.106  17.217  11.949
    6    HG3  LYS  27           HG3      LYS  27  -7.400  17.522  10.359
    7    HD2  LYS  27           HD2      LYS  27  -9.102  16.052   9.323
    8    HD3  LYS  27           HD3      LYS  27  -9.815  15.764  10.913
    9    HE2  LYS  27           HE2      LYS  27 -10.304  18.167  11.146
   10    HE3  LYS  27           HE3      LYS  27  -9.563  18.478   9.572
   11    HZ3  LYS  27           HZ1      LYS  27 -11.937  18.307   9.325
   12    HZ2  LYS  27           HZ2      LYS  27 -11.959  16.793  10.100
   13    HZ1  LYS  27           HZ3      LYS  27 -11.213  16.965   8.579

  No H/Q in entry =          13
  In of MODEL   71
    1    H    GLN  28           H        GLN  28  -6.119  14.502  13.824
    2    HA   GLN  28           HA       GLN  28  -7.056  16.495  15.592
    3    HB2  GLN  28           HB2      GLN  28  -5.607  13.892  16.146
    4    HB3  GLN  28           HB3      GLN  28  -6.369  14.886  17.388
    5    HG2  GLN  28           HG2      GLN  28  -7.807  13.740  14.978
    6    HG3  GLN  28           HG3      GLN  28  -7.849  13.042  16.597
    7   HE21  GLN  28          HE21      GLN  28  -9.765  14.805  14.644
    8   HE22  GLN  28          HE22      GLN  28 -10.530  15.808  15.779

  No H/Q in entry =           8
  In of MODEL   71
    1    H    ALA  29           H        ALA  29  -3.812  15.255  14.914
    2    HA   ALA  29           HA       ALA  29  -2.404  16.684  16.892
    3    HB1  ALA  29           HB1      ALA  29  -0.458  16.024  15.780
    4    HB3  ALA  29           HB2      ALA  29  -1.211  16.130  14.188
    5    HB2  ALA  29           HB3      ALA  29  -1.612  14.793  15.266

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LYS  30           H        LYS  30  -3.269  17.538  13.557
    2    HA   LYS  30           HA       LYS  30  -1.899  20.001  13.452
    3    HB2  LYS  30           HB2      LYS  30  -4.412  19.081  12.040
    4    HB3  LYS  30           HB3      LYS  30  -3.602  20.608  11.694
    5    HG2  LYS  30           HG2      LYS  30  -1.510  19.347  11.189
    6    HG3  LYS  30           HG3      LYS  30  -2.393  17.837  11.437
    7    HD2  LYS  30           HD2      LYS  30  -3.963  18.447   9.636
    8    HD3  LYS  30           HD3      LYS  30  -3.103  19.968   9.391
    9    HE2  LYS  30           HE2      LYS  30  -1.049  18.706   8.820
   10    HE3  LYS  30           HE3      LYS  30  -1.928  17.189   9.034
   11    HZ2  LYS  30           HZ1      LYS  30  -1.760  18.056   6.690
   12    HZ1  LYS  30           HZ2      LYS  30  -2.824  19.303   7.152
   13    HZ3  LYS  30           HZ3      LYS  30  -3.323  17.678   7.227

  No H/Q in entry =          13
  In of MODEL   71
    1    H    GLN  31           H        GLN  31  -4.989  19.105  14.860
    2    HA   GLN  31           HA       GLN  31  -5.795  21.851  15.302
    3    HB2  GLN  31           HB2      GLN  31  -6.940  19.391  16.629
    4    HB3  GLN  31           HB3      GLN  31  -7.723  20.951  16.377
    5    HG2  GLN  31           HG2      GLN  31  -6.995  20.176  13.792
    6    HG3  GLN  31           HG3      GLN  31  -7.499  18.667  14.542
    7   HE21  GLN  31          HE21      GLN  31  -8.928  20.213  12.433
    8   HE22  GLN  31          HE22      GLN  31 -10.449  20.584  13.086

  No H/Q in entry =           8
  In of MODEL   71
    1    H    GLY  32           H        GLY  32  -3.457  19.962  16.633
    2    HA3  GLY  32           HA2      GLY  32  -2.068  20.450  18.437
    3    HA2  GLY  32           HA3      GLY  32  -3.216  21.678  18.954

  No H/Q in entry =           3
  In of MODEL   71
    1    H    ASP  33           H        ASP  33  -4.593  18.616  18.298
    2    HA   ASP  33           HA       ASP  33  -5.003  18.161  21.179
    3    HB2  ASP  33           HB2      ASP  33  -6.389  17.122  18.701
    4    HB3  ASP  33           HB3      ASP  33  -6.729  16.511  20.318

  No H/Q in entry =           4
  In of MODEL   71
    1    H    PHE  34           H        PHE  34  -2.823  17.342  21.491
    2    HA   PHE  34           HA       PHE  34  -1.787  15.104  20.098
    3    HB2  PHE  34           HB2      PHE  34  -1.190  16.105  22.891
    4    HB3  PHE  34           HB3      PHE  34  -0.242  14.893  22.029
    5    HD1  PHE  34           HD1      PHE  34  -0.465  18.318  22.754
    6    HD2  PHE  34           HD2      PHE  34   0.410  15.618  19.529
    7    HE1  PHE  34           HE1      PHE  34   0.807  20.104  21.598
    8    HE2  PHE  34           HE2      PHE  34   1.678  17.407  18.377
    9    HZ   PHE  34           HZ       PHE  34   1.878  19.648  19.417

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ALA  35           H        ALA  35  -3.837  15.359  22.957
    2    HA   ALA  35           HA       ALA  35  -3.588  12.703  23.861
    3    HB3  ALA  35           HB1      ALA  35  -6.057  13.296  24.711
    4    HB1  ALA  35           HB2      ALA  35  -5.546  14.921  24.252
    5    HB2  ALA  35           HB3      ALA  35  -4.621  14.013  25.448

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ALA  36           H        ALA  36  -6.055  14.179  21.752
    2    HA   ALA  36           HA       ALA  36  -7.435  11.746  21.278
    3    HB1  ALA  36           HB1      ALA  36  -8.909  13.145  20.315
    4    HB3  ALA  36           HB2      ALA  36  -7.740  13.579  19.067
    5    HB2  ALA  36           HB3      ALA  36  -7.781  14.470  20.589

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ALA  37           H        ALA  37  -4.774  13.367  19.610
    2    HA   ALA  37           HA       ALA  37  -4.712  11.726  17.318
    3    HB3  ALA  37           HB1      ALA  37  -2.746  13.470  18.740
    4    HB2  ALA  37           HB2      ALA  37  -3.274  13.514  17.059
    5    HB1  ALA  37           HB3      ALA  37  -2.104  12.302  17.585

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LYS  38           H        LYS  38  -2.957  11.453  20.400
    2    HA   LYS  38           HA       LYS  38  -1.596   9.071  19.920
    3    HB2  LYS  38           HB2      LYS  38  -1.948  10.835  22.060
    4    HB3  LYS  38           HB3      LYS  38  -2.547   9.298  22.679
    5    HG2  LYS  38           HG2      LYS  38  -0.435   8.206  22.150
    6    HG3  LYS  38           HG3      LYS  38   0.154   9.658  21.334
    7    HD2  LYS  38           HD2      LYS  38   0.302  10.884  23.366
    8    HD3  LYS  38           HD3      LYS  38  -0.703   9.722  24.234
    9    HE2  LYS  38           HE2      LYS  38   1.656   9.441  24.859
   10    HE3  LYS  38           HE3      LYS  38   1.073   8.014  23.997
   11    HZ3  LYS  38           HZ1      LYS  38   2.371   8.447  22.217
   12    HZ2  LYS  38           HZ2      LYS  38   3.312   9.292  23.354
   13    HZ1  LYS  38           HZ3      LYS  38   2.223  10.134  22.358

  No H/Q in entry =          13
  In of MODEL   71
    1    H    ALA  39           H        ALA  39  -4.844   9.524  21.315
    2    HA   ALA  39           HA       ALA  39  -5.366   6.798  21.825
    3    HB3  ALA  39           HB1      ALA  39  -7.551   8.709  21.049
    4    HB2  ALA  39           HB2      ALA  39  -6.659   8.953  22.551
    5    HB1  ALA  39           HB3      ALA  39  -7.554   7.455  22.290

  No H/Q in entry =           5
  In of MODEL   71
    1    H    MET  40           H        MET  40  -5.974   8.795  18.972
    2    HA   MET  40           HA       MET  40  -7.419   6.838  17.514
    3    HB2  MET  40           HB2      MET  40  -5.842   9.254  16.606
    4    HB3  MET  40           HB3      MET  40  -6.852   8.277  15.537
    5    HG2  MET  40           HG2      MET  40  -7.910   9.518  18.089
    6    HG3  MET  40           HG3      MET  40  -7.976  10.348  16.537
    7    HE3  MET  40           HE1      MET  40 -10.532   8.685  14.472
    8    HE2  MET  40           HE2      MET  40  -8.781   8.828  14.326
    9    HE1  MET  40           HE3      MET  40  -9.720  10.181  14.955

  No H/Q in entry =           9
  In of MODEL   71
    1    H    MET  41           H        MET  41  -3.940   7.627  17.642
    2    HA   MET  41           HA       MET  41  -3.151   5.878  15.548
    3    HB2  MET  41           HB2      MET  41  -1.550   6.575  18.022
    4    HB3  MET  41           HB3      MET  41  -0.920   5.932  16.509
    5    HG2  MET  41           HG2      MET  41  -2.106   8.095  15.497
    6    HG3  MET  41           HG3      MET  41  -1.882   8.690  17.141
    7    HE2  MET  41           HE1      MET  41   1.066   6.637  17.514
    8    HE1  MET  41           HE2      MET  41   0.256   7.921  18.407
    9    HE3  MET  41           HE3      MET  41   1.877   8.187  17.767

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ASP  42           H        ASP  42  -3.536   5.408  19.034
    2    HA   ASP  42           HA       ASP  42  -2.462   2.830  19.203
    3    HB2  ASP  42           HB2      ASP  42  -3.366   4.581  21.019
    4    HB3  ASP  42           HB3      ASP  42  -4.777   3.534  20.946

  No H/Q in entry =           4
  In of MODEL   71
    1    H    GLN  43           H        GLN  43  -5.811   3.883  18.693
    2    HA   GLN  43           HA       GLN  43  -6.915   1.278  18.502
    3    HB2  GLN  43           HB2      GLN  43  -7.875   3.913  17.364
    4    HB3  GLN  43           HB3      GLN  43  -8.816   2.419  17.344
    5    HG2  GLN  43           HG2      GLN  43  -8.526   2.309  19.852
    6    HG3  GLN  43           HG3      GLN  43  -7.826   3.925  19.779
    7   HE21  GLN  43          HE21      GLN  43 -10.009   3.975  21.274
    8   HE22  GLN  43          HE22      GLN  43 -11.377   4.528  20.438

  No H/Q in entry =           8
  In of MODEL   71
    1    H    SER  44           H        SER  44  -5.603   3.506  16.088
    2    HA   SER  44           HA       SER  44  -6.276   2.005  13.801
    3    HB2  SER  44           HB2      SER  44  -5.057   4.409  14.241
    4    HB3  SER  44           HB3      SER  44  -3.687   3.432  13.716
    5    HG   SER  44           HG       SER  44  -4.810   4.383  11.949

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ARG  45           H        ARG  45  -3.402   1.941  15.888
    2    HA   ARG  45           HA       ARG  45  -1.889   0.006  14.514
    3    HB2  ARG  45           HB2      ARG  45  -1.073   1.445  16.381
    4    HB3  ARG  45           HB3      ARG  45  -2.053   0.502  17.501
    5    HG2  ARG  45           HG2      ARG  45  -0.789  -1.540  16.866
    6    HG3  ARG  45           HG3      ARG  45   0.214  -0.572  15.788
    7    HD2  ARG  45           HD2      ARG  45   0.923   0.825  17.742
    8    HD3  ARG  45           HD3      ARG  45   0.015  -0.261  18.816
    9    HE   ARG  45           HE       ARG  45   1.742  -1.835  17.243
   10   HH21  ARG  45          HH11      ARG  45   3.652  -2.627  18.087
   11   HH22  ARG  45          HH12      ARG  45   4.410  -1.826  19.418
   12   HH11  ARG  45          HH21      ARG  45   2.002   0.641  19.628
   13   HH12  ARG  45          HH22      ARG  45   3.475   0.027  20.288

  No H/Q in entry =          13
  In of MODEL   71
    1    H    MET  46           H        MET  46  -4.288  -0.344  17.109
    2    HA   MET  46           HA       MET  46  -4.079  -3.140  17.423
    3    HB2  MET  46           HB2      MET  46  -6.262  -1.153  18.025
    4    HB3  MET  46           HB3      MET  46  -6.475  -2.876  18.342
    5    HG2  MET  46           HG2      MET  46  -4.683  -2.925  19.893
    6    HG3  MET  46           HG3      MET  46  -4.056  -1.378  19.349
    7    HE2  MET  46           HE1      MET  46  -8.247  -1.670  21.208
    8    HE1  MET  46           HE2      MET  46  -7.408  -2.957  20.348
    9    HE3  MET  46           HE3      MET  46  -7.925  -1.517  19.476

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ALA  47           H        ALA  47  -6.124  -1.158  15.319
    2    HA   ALA  47           HA       ALA  47  -7.708  -3.235  14.254
    3    HB3  ALA  47           HB1      ALA  47  -8.420  -1.009  13.831
    4    HB1  ALA  47           HB2      ALA  47  -7.918  -1.639  12.262
    5    HB2  ALA  47           HB3      ALA  47  -6.856  -0.552  13.159

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LEU  48           H        LEU  48  -4.606  -1.884  13.208
    2    HA   LEU  48           HA       LEU  48  -4.297  -3.475  10.871
    3    HB2  LEU  48           HB2      LEU  48  -2.263  -2.163  12.681
    4    HB3  LEU  48           HB3      LEU  48  -1.880  -2.882  11.117
    5    HG   LEU  48           HG       LEU  48  -3.935  -0.693  11.496
    6   HD13  LEU  48          HD11      LEU  48  -1.827   0.214  12.165
    7   HD12  LEU  48          HD12      LEU  48  -2.106   0.761  10.511
    8   HD11  LEU  48          HD13      LEU  48  -0.990  -0.570  10.826
    9   HD22  LEU  48          HD21      LEU  48  -4.387  -1.689   9.422
   10   HD21  LEU  48          HD22      LEU  48  -2.698  -2.101   9.132
   11   HD23  LEU  48          HD23      LEU  48  -3.240  -0.429   8.967

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ASN  49           H        ASN  49  -3.254  -3.850  14.221
    2    HA   ASN  49           HA       ASN  49  -1.620  -6.092  13.899
    3    HB2  ASN  49           HB2      ASN  49  -1.671  -4.752  15.944
    4    HB3  ASN  49           HB3      ASN  49  -3.322  -5.259  16.265
    5   HD21  ASN  49          HD21      ASN  49  -1.326  -5.748  18.178
    6   HD22  ASN  49          HD22      ASN  49  -1.021  -7.415  18.256

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLU  50           H        GLU  50  -5.094  -5.862  14.561
    2    HA   GLU  50           HA       GLU  50  -5.569  -8.667  14.675
    3    HB2  GLU  50           HB2      GLU  50  -7.180  -6.999  15.543
    4    HB3  GLU  50           HB3      GLU  50  -7.476  -6.442  13.894
    5    HG2  GLU  50           HG2      GLU  50  -8.311  -8.651  13.259
    6    HG3  GLU  50           HG3      GLU  50  -7.925  -9.286  14.855

  No H/Q in entry =           6
  In of MODEL   71
    1    H    ALA  51           H        ALA  51  -5.662  -6.276  12.073
    2    HA   ALA  51           HA       ALA  51  -6.620  -8.020  10.053
    3    HB2  ALA  51           HB1      ALA  51  -6.419  -6.208   8.680
    4    HB1  ALA  51           HB2      ALA  51  -4.786  -5.837   9.232
    5    HB3  ALA  51           HB3      ALA  51  -6.178  -5.341  10.196

  No H/Q in entry =           5
  In of MODEL   71
    1    H    HIS  52           H        HIS  52  -3.343  -7.070  11.043
    2    HA   HIS  52           HA       HIS  52  -1.921  -8.546   9.101
    3    HB2  HIS  52           HB2      HIS  52  -0.899  -6.802  10.522
    4    HB3  HIS  52           HB3      HIS  52  -1.084  -7.851  11.928
    5    HD1  HIS  52           HD1      HIS  52   0.242 -10.200  11.793
    6    HD2  HIS  52           HD2      HIS  52   1.386  -7.309   9.015
    7    HE1  HIS  52           HE1      HIS  52   2.493 -10.927  10.888
    8    HE2  HIS  52           HE2      HIS  52   3.204  -9.176   9.192

  No H/Q in entry =           8
  In of MODEL   71
    1    H    LEU  53           H        LEU  53  -3.130  -9.431  12.312
    2    HA   LEU  53           HA       LEU  53  -1.903 -11.960  12.514
    3    HB2  LEU  53           HB2      LEU  53  -4.410 -10.812  13.717
    4    HB3  LEU  53           HB3      LEU  53  -3.920 -12.477  14.019
    5    HG   LEU  53           HG       LEU  53  -2.058 -10.127  14.483
    6   HD13  LEU  53          HD11      LEU  53  -3.921  -9.745  15.946
    7   HD12  LEU  53          HD12      LEU  53  -2.658 -10.493  16.922
    8   HD11  LEU  53          HD13      LEU  53  -4.024 -11.453  16.362
    9   HD21  LEU  53          HD21      LEU  53  -2.057 -13.056  15.232
   10   HD23  LEU  53          HD22      LEU  53  -1.144 -11.886  16.179
   11   HD22  LEU  53          HD23      LEU  53  -0.763 -12.128  14.484

  No H/Q in entry =          11
  In of MODEL   71
    1    H    VAL  54           H        VAL  54  -5.022 -10.971  11.141
    2    HA   VAL  54           HA       VAL  54  -5.904 -13.577  10.457
    3    HB   VAL  54           HB       VAL  54  -6.579 -10.854   9.315
    4   HG12  VAL  54          HG11      VAL  54  -8.663 -12.258   8.500
    5   HG11  VAL  54          HG12      VAL  54  -7.535 -13.611   8.579
    6   HG13  VAL  54          HG13      VAL  54  -7.189 -12.234   7.535
    7   HG22  VAL  54          HG21      VAL  54  -7.491 -10.898  11.464
    8   HG21  VAL  54          HG22      VAL  54  -7.725 -12.644  11.448
    9   HG23  VAL  54          HG23      VAL  54  -8.816 -11.601  10.536

  No H/Q in entry =           9
  In of MODEL   71
    1    H    GLN  55           H        GLN  55  -4.055 -11.108   8.668
    2    HA   GLN  55           HA       GLN  55  -3.902 -12.576   6.254
    3    HB2  GLN  55           HB2      GLN  55  -3.323 -10.305   6.061
    4    HB3  GLN  55           HB3      GLN  55  -2.215 -10.366   7.429
    5    HG2  GLN  55           HG2      GLN  55  -0.485 -11.195   6.159
    6    HG3  GLN  55           HG3      GLN  55  -1.545 -12.184   5.165
    7   HE21  GLN  55          HE21      GLN  55  -1.564 -11.499   3.042
    8   HE22  GLN  55          HE22      GLN  55  -1.382  -9.893   2.529

  No H/Q in entry =           8
  In of MODEL   71
    1    H    THR  56           H        THR  56  -1.804 -12.525   9.140
    2    HA   THR  56           HA       THR  56   0.294 -14.102   8.232
    3    HB   THR  56           HB       THR  56  -0.952 -14.363  10.977
    4    HG1  THR  56           HG1      THR  56   0.304 -12.269   9.721
    5   HG22  THR  56          HG21      THR  56   1.977 -14.392  10.333
    6   HG21  THR  56          HG22      THR  56   1.016 -15.846  10.057
    7   HG23  THR  56          HG23      THR  56   1.123 -15.152  11.675

  No H/Q in entry =           7
  In of MODEL   71
    1    H    LYS  57           H        LYS  57  -2.818 -15.170   9.589
    2    HA   LYS  57           HA       LYS  57  -2.341 -17.962   9.350
    3    HB2  LYS  57           HB2      LYS  57  -4.176 -16.883  10.687
    4    HB3  LYS  57           HB3      LYS  57  -4.970 -16.453   9.179
    5    HG2  LYS  57           HG2      LYS  57  -5.176 -18.823   8.583
    6    HG3  LYS  57           HG3      LYS  57  -4.339 -19.284  10.064
    7    HD2  LYS  57           HD2      LYS  57  -6.149 -18.259  11.404
    8    HD3  LYS  57           HD3      LYS  57  -6.996 -17.818   9.922
    9    HE2  LYS  57           HE2      LYS  57  -7.180 -20.201   9.305
   10    HE3  LYS  57           HE3      LYS  57  -6.308 -20.666  10.764
   11    HZ3  LYS  57           HZ1      LYS  57  -8.052 -20.040  12.110
   12    HZ2  LYS  57           HZ2      LYS  57  -8.861 -20.697  10.767
   13    HZ1  LYS  57           HZ3      LYS  57  -8.737 -19.012  10.945

  No H/Q in entry =          13
  In of MODEL   71
    1    H    LEU  58           H        LEU  58  -3.693 -15.538   7.166
    2    HA   LEU  58           HA       LEU  58  -4.470 -17.376   5.161
    3    HB2  LEU  58           HB2      LEU  58  -3.894 -14.422   5.021
    4    HB3  LEU  58           HB3      LEU  58  -4.544 -15.368   3.681
    5    HG   LEU  58           HG       LEU  58  -5.833 -15.197   6.425
    6   HD11  LEU  58          HD11      LEU  58  -6.144 -13.558   3.929
    7   HD13  LEU  58          HD12      LEU  58  -6.144 -13.047   5.616
    8   HD12  LEU  58          HD13      LEU  58  -7.556 -13.857   4.942
    9   HD22  LEU  58          HD21      LEU  58  -6.773 -17.118   5.556
   10   HD21  LEU  58          HD22      LEU  58  -6.433 -16.666   3.886
   11   HD23  LEU  58          HD23      LEU  58  -7.807 -15.953   4.731

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  59           H        ILE  59  -1.350 -16.130   6.029
    2    HA   ILE  59           HA       ILE  59  -0.236 -16.852   3.397
    3    HB   ILE  59           HB       ILE  59   0.505 -14.774   4.962
    4   HG12  ILE  59          HG12      ILE  59   2.619 -16.409   3.543
    5   HG13  ILE  59          HG13      ILE  59   1.418 -15.482   2.680
    6   HG21  ILE  59          HG21      ILE  59   1.268 -16.552   6.722
    7   HG23  ILE  59          HG22      ILE  59   2.338 -15.214   6.375
    8   HG22  ILE  59          HG23      ILE  59   2.631 -16.797   5.657
    9   HD13  ILE  59          HD11      ILE  59   2.137 -13.430   3.836
   10   HD12  ILE  59          HD12      ILE  59   3.478 -14.168   2.963
   11   HD11  ILE  59          HD13      ILE  59   3.350 -14.360   4.712

  No H/Q in entry =          11
  In of MODEL   71
    1    H    GLU  60           H        GLU  60  -0.246 -17.950   6.767
    2    HA   GLU  60           HA       GLU  60   1.807 -19.907   6.513
    3    HB2  GLU  60           HB2      GLU  60   1.006 -19.110   8.696
    4    HB3  GLU  60           HB3      GLU  60  -0.572 -19.832   8.389
    5    HG2  GLU  60           HG2      GLU  60   0.475 -22.068   8.265
    6    HG3  GLU  60           HG3      GLU  60   2.052 -21.344   8.573

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLY  61           H        GLY  61  -1.701 -20.043   6.016
    2    HA3  GLY  61           HA2      GLY  61  -1.420 -22.835   5.065
    3    HA2  GLY  61           HA3      GLY  61  -2.915 -22.114   5.653

  No H/Q in entry =           3
  In of MODEL   71
    1    H    ASP  62           H        ASP  62  -0.696 -20.515   3.454
    2    HA   ASP  62           HA       ASP  62  -2.735 -19.874   1.597
    3    HB2  ASP  62           HB2      ASP  62  -0.846 -19.042   0.217
    4    HB3  ASP  62           HB3      ASP  62  -0.773 -18.469   1.880

  No H/Q in entry =           4
  In of MODEL   71
    1    H    ALA  63           H        ALA  63  -0.324 -22.490   1.648
    2    HA   ALA  63           HA       ALA  63  -1.368 -23.467  -0.951
    3    HB1  ALA  63           HB1      ALA  63   1.120 -24.333   0.516
    4    HB3  ALA  63           HB2      ALA  63   1.081 -23.123  -0.766
    5    HB2  ALA  63           HB3      ALA  63   0.637 -24.795  -1.117

  No H/Q in entry =           5
  In of MODEL   71
    1    H    GLY  64           H        GLY  64  -0.996 -26.066  -0.880
    2    HA3  GLY  64           HA2      GLY  64  -1.379 -28.084   0.355
    3    HA2  GLY  64           HA3      GLY  64  -2.208 -27.138   1.581

  No H/Q in entry =           3
  In of MODEL   71
    1    H    GLU  65           H        GLU  65  -3.650 -25.688  -0.719
    2    HA   GLU  65           HA       GLU  65  -5.979 -27.293  -0.641
    3    HB2  GLU  65           HB2      GLU  65  -5.286 -24.924  -2.378
    4    HB3  GLU  65           HB3      GLU  65  -6.888 -25.655  -2.279
    5    HG2  GLU  65           HG2      GLU  65  -5.366 -24.604   0.119
    6    HG3  GLU  65           HG3      GLU  65  -6.582 -23.674  -0.755

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLY  66           H        GLY  66  -3.530 -26.812  -3.065
    2    HA3  GLY  66           HA2      GLY  66  -4.029 -29.307  -4.348
    3    HA2  GLY  66           HA3      GLY  66  -4.585 -27.963  -5.326

  No H/Q in entry =           3
  In of MODEL   71
    1    H    LYS  67           H        LYS  67  -3.087 -26.508  -6.177
    2    HA   LYS  67           HA       LYS  67  -0.556 -27.711  -6.831
    3    HB2  LYS  67           HB2      LYS  67  -1.928 -25.184  -7.732
    4    HB3  LYS  67           HB3      LYS  67  -0.360 -25.721  -8.350
    5    HG2  LYS  67           HG2      LYS  67  -1.359 -27.877  -9.020
    6    HG3  LYS  67           HG3      LYS  67  -2.925 -27.344  -8.412
    7    HD2  LYS  67           HD2      LYS  67  -2.974 -25.526 -10.052
    8    HD3  LYS  67           HD3      LYS  67  -1.371 -25.985 -10.633
    9    HE2  LYS  67           HE2      LYS  67  -3.084 -26.930 -12.110
   10    HE3  LYS  67           HE3      LYS  67  -2.252 -28.224 -11.248
   11    HZ1  LYS  67           HZ1      LYS  67  -4.601 -27.120  -9.944
   12    HZ3  LYS  67           HZ2      LYS  67  -4.073 -28.730 -10.056
   13    HZ2  LYS  67           HZ3      LYS  67  -4.892 -28.009 -11.358

  No H/Q in entry =          13
  In of MODEL   71
    1    H    MET  68           H        MET  68   1.466 -26.791  -6.716
    2    HA   MET  68           HA       MET  68   2.364 -25.951  -4.263
    3    HB2  MET  68           HB2      MET  68   3.585 -25.510  -6.987
    4    HB3  MET  68           HB3      MET  68   4.445 -25.285  -5.464
    5    HG2  MET  68           HG2      MET  68   3.099 -27.865  -6.313
    6    HG3  MET  68           HG3      MET  68   4.829 -27.544  -6.456
    7    HE1  MET  68           HE1      MET  68   6.348 -27.080  -4.837
    8    HE3  MET  68           HE2      MET  68   6.308 -27.522  -3.131
    9    HE2  MET  68           HE3      MET  68   5.623 -25.984  -3.653

  No H/Q in entry =           9
  In of MODEL   71
    1    H    LYS  69           H        LYS  69   0.576 -24.018  -6.354
    2    HA   LYS  69           HA       LYS  69   1.870 -21.520  -5.772
    3    HB2  LYS  69           HB2      LYS  69  -0.704 -22.152  -7.182
    4    HB3  LYS  69           HB3      LYS  69  -0.099 -20.509  -6.944
    5    HG2  LYS  69           HG2      LYS  69   2.008 -21.109  -8.065
    6    HG3  LYS  69           HG3      LYS  69   1.419 -22.754  -8.301
    7    HD2  LYS  69           HD2      LYS  69  -0.411 -21.934  -9.699
    8    HD3  LYS  69           HD3      LYS  69   0.090 -20.266  -9.411
    9    HE2  LYS  69           HE2      LYS  69   0.953 -21.029 -11.577
   10    HE3  LYS  69           HE3      LYS  69   2.288 -20.768 -10.454
   11    HZ3  LYS  69           HZ1      LYS  69   2.441 -23.082 -10.041
   12    HZ2  LYS  69           HZ2      LYS  69   2.400 -22.884 -11.728
   13    HZ1  LYS  69           HZ3      LYS  69   1.013 -23.408 -10.897

  No H/Q in entry =          13
  In of MODEL   71
    1    H    VAL  70           H        VAL  70   0.071 -19.638  -5.300
    2    HA   VAL  70           HA       VAL  70  -1.259 -20.336  -2.744
    3    HB   VAL  70           HB       VAL  70  -0.508 -18.136  -1.862
    4   HG11  VAL  70          HG11      VAL  70   0.793 -20.307  -1.550
    5   HG13  VAL  70          HG12      VAL  70   1.719 -18.823  -1.325
    6   HG12  VAL  70          HG13      VAL  70   1.869 -19.739  -2.826
    7   HG23  VAL  70          HG21      VAL  70   1.581 -17.230  -3.274
    8   HG22  VAL  70          HG22      VAL  70  -0.062 -16.702  -3.633
    9   HG21  VAL  70          HG23      VAL  70   0.688 -17.960  -4.611

  No H/Q in entry =           9
  In of MODEL   71
    1    H    SER  71           H        SER  71  -2.853 -18.674  -2.099
    2    HA   SER  71           HA       SER  71  -4.741 -18.131  -4.133
    3    HB2  SER  71           HB2      SER  71  -5.270 -18.331  -1.673
    4    HB3  SER  71           HB3      SER  71  -4.504 -16.765  -1.429
    5    HG   SER  71           HG       SER  71  -6.588 -17.197  -3.299

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LEU  72           H        LEU  72  -4.985 -16.467  -5.465
    2    HA   LEU  72           HA       LEU  72  -2.897 -14.632  -5.945
    3    HB2  LEU  72           HB2      LEU  72  -5.759 -14.720  -6.897
    4    HB3  LEU  72           HB3      LEU  72  -4.574 -13.551  -7.472
    5    HG   LEU  72           HG       LEU  72  -4.144 -16.554  -7.599
    6   HD11  LEU  72          HD11      LEU  72  -5.383 -14.621  -9.555
    7   HD13  LEU  72          HD12      LEU  72  -5.967 -16.208  -9.053
    8   HD12  LEU  72          HD13      LEU  72  -4.565 -16.081 -10.115
    9   HD21  LEU  72          HD21      LEU  72  -2.681 -14.126  -8.612
   10   HD23  LEU  72          HD22      LEU  72  -2.566 -15.623  -9.520
   11   HD22  LEU  72          HD23      LEU  72  -2.024 -15.568  -7.845

  No H/Q in entry =          11
  In of MODEL   71
    1    H    VAL  73           H        VAL  73  -5.998 -14.308  -4.322
    2    HA   VAL  73           HA       VAL  73  -6.076 -11.537  -3.976
    3    HB   VAL  73           HB       VAL  73  -7.815 -11.904  -2.447
    4   HG12  VAL  73          HG11      VAL  73  -7.825 -14.457  -4.062
    5   HG11  VAL  73          HG12      VAL  73  -8.082 -12.879  -4.804
    6   HG13  VAL  73          HG13      VAL  73  -9.204 -13.469  -3.578
    7   HG22  VAL  73          HG21      VAL  73  -6.746 -13.243  -0.779
    8   HG21  VAL  73          HG22      VAL  73  -6.447 -14.552  -1.924
    9   HG23  VAL  73          HG23      VAL  73  -8.091 -14.213  -1.381

  No H/Q in entry =           9
  In of MODEL   71
    1    H    LEU  74           H        LEU  74  -4.113 -13.880  -2.385
    2    HA   LEU  74           HA       LEU  74  -3.720 -12.730   0.137
    3    HB2  LEU  74           HB2      LEU  74  -2.909 -14.939  -0.352
    4    HB3  LEU  74           HB3      LEU  74  -1.865 -14.321  -1.631
    5    HG   LEU  74           HG       LEU  74  -0.567 -13.048   0.041
    6   HD13  LEU  74          HD11      LEU  74  -2.123 -12.556   1.765
    7   HD12  LEU  74          HD12      LEU  74  -1.043 -13.748   2.488
    8   HD11  LEU  74          HD13      LEU  74  -2.631 -14.240   1.897
    9   HD21  LEU  74          HD21      LEU  74  -0.339 -15.612  -0.552
   10   HD23  LEU  74          HD22      LEU  74  -0.772 -15.786   1.134
   11   HD22  LEU  74          HD23      LEU  74   0.660 -14.881   0.702

  No H/Q in entry =          11
  In of MODEL   71
    1    H    VAL  75           H        VAL  75  -1.829 -12.319  -2.817
    2    HA   VAL  75           HA       VAL  75  -0.056 -10.372  -1.806
    3    HB   VAL  75           HB       VAL  75  -1.000 -10.874  -4.630
    4   HG11  VAL  75          HG11      VAL  75   1.246  -9.115  -3.549
    5   HG13  VAL  75          HG12      VAL  75  -0.171  -8.575  -4.439
    6   HG12  VAL  75          HG13      VAL  75   1.049  -9.550  -5.243
    7   HG23  VAL  75          HG21      VAL  75   1.245 -11.950  -4.795
    8   HG22  VAL  75          HG22      VAL  75   0.219 -12.739  -3.598
    9   HG21  VAL  75          HG23      VAL  75   1.499 -11.641  -3.076

  No H/Q in entry =           9
  In of MODEL   71
    1    H    GLU  76           H        GLU  76  -3.207 -10.065  -3.471
    2    HA   GLU  76           HA       GLU  76  -3.292  -7.251  -3.576
    3    HB2  GLU  76           HB2      GLU  76  -4.931  -8.709  -4.740
    4    HB3  GLU  76           HB3      GLU  76  -5.580  -9.216  -3.188
    5    HG2  GLU  76           HG2      GLU  76  -7.051  -7.519  -4.078
    6    HG3  GLU  76           HG3      GLU  76  -6.191  -6.802  -2.730

  No H/Q in entry =           6
  In of MODEL   71
    1    H    ALA  77           H        ALA  77  -4.381  -9.488  -1.035
    2    HA   ALA  77           HA       ALA  77  -5.364  -7.495   0.719
    3    HB2  ALA  77           HB1      ALA  77  -5.852  -9.934   0.920
    4    HB3  ALA  77           HB2      ALA  77  -5.304  -9.210   2.431
    5    HB1  ALA  77           HB3      ALA  77  -4.195 -10.187   1.470

  No H/Q in entry =           5
  In of MODEL   71
    1    H    GLN  78           H        GLN  78  -2.198  -9.008   0.362
    2    HA   GLN  78           HA       GLN  78  -0.957  -7.831   2.613
    3    HB2  GLN  78           HB2      GLN  78  -0.070  -9.763   1.265
    4    HB3  GLN  78           HB3      GLN  78   0.352  -8.616  -0.005
    5    HG2  GLN  78           HG2      GLN  78   1.797  -7.398   1.571
    6    HG3  GLN  78           HG3      GLN  78   1.378  -8.540   2.846
    7   HE21  GLN  78          HE21      GLN  78   4.096  -8.234   2.003
    8   HE22  GLN  78          HE22      GLN  78   4.577  -9.663   1.222

  No H/Q in entry =           8
  In of MODEL   71
    1    H    LEU  79           H        LEU  79  -1.330  -6.779  -0.736
    2    HA   LEU  79           HA       LEU  79   0.332  -4.533  -0.723
    3    HB2  LEU  79           HB2      LEU  79  -0.682  -5.354  -2.778
    4    HB3  LEU  79           HB3      LEU  79  -2.291  -4.979  -2.172
    5    HG   LEU  79           HG       LEU  79  -1.773  -2.586  -2.149
    6   HD13  LEU  79          HD11      LEU  79   0.463  -2.318  -1.633
    7   HD12  LEU  79          HD12      LEU  79   0.513  -2.032  -3.373
    8   HD11  LEU  79          HD13      LEU  79   0.983  -3.604  -2.723
    9   HD23  LEU  79          HD21      LEU  79  -1.137  -2.384  -4.701
   10   HD22  LEU  79          HD22      LEU  79  -2.656  -3.148  -4.243
   11   HD21  LEU  79          HD23      LEU  79  -1.271  -4.143  -4.684

  No H/Q in entry =          11
  In of MODEL   71
    1    H    HIS  80           H        HIS  80  -3.134  -4.731   0.097
    2    HA   HIS  80           HA       HIS  80  -3.356  -1.976   0.756
    3    HB2  HIS  80           HB2      HIS  80  -5.033  -4.402   1.076
    4    HB3  HIS  80           HB3      HIS  80  -5.369  -3.064   2.177
    5    HD1  HIS  80           HD1      HIS  80  -7.002  -1.445   1.264
    6    HD2  HIS  80           HD2      HIS  80  -4.785  -3.239  -1.777
    7    HE1  HIS  80           HE1      HIS  80  -7.848  -0.461  -0.918
    8    HE2  HIS  80           HE2      HIS  80  -6.503  -1.548  -2.781

  No H/Q in entry =           8
  In of MODEL   71
    1    H    LEU  81           H        LEU  81  -2.841  -4.863   2.755
    2    HA   LEU  81           HA       LEU  81  -2.846  -3.512   5.237
    3    HB2  LEU  81           HB2      LEU  81  -1.600  -6.117   4.363
    4    HB3  LEU  81           HB3      LEU  81  -1.582  -5.556   6.036
    5    HG   LEU  81           HG       LEU  81  -4.122  -5.836   4.404
    6   HD12  LEU  81          HD11      LEU  81  -4.407  -7.903   5.954
    7   HD11  LEU  81          HD12      LEU  81  -2.656  -7.814   6.143
    8   HD13  LEU  81          HD13      LEU  81  -3.359  -8.054   4.543
    9   HD23  LEU  81          HD21      LEU  81  -4.968  -6.044   6.904
   10   HD22  LEU  81          HD22      LEU  81  -4.658  -4.453   6.213
   11   HD21  LEU  81          HD23      LEU  81  -3.465  -5.200   7.276

  No H/Q in entry =          11
  In of MODEL   71
    1    H    MET  82           H        MET  82  -0.153  -4.392   3.072
    2    HA   MET  82           HA       MET  82   1.918  -3.475   4.758
    3    HB2  MET  82           HB2      MET  82   1.712  -3.823   1.766
    4    HB3  MET  82           HB3      MET  82   3.187  -3.236   2.531
    5    HG2  MET  82           HG2      MET  82   1.804  -5.838   3.257
    6    HG3  MET  82           HG3      MET  82   3.177  -5.717   2.159
    7    HE3  MET  82           HE1      MET  82   6.181  -4.949   4.147
    8    HE2  MET  82           HE2      MET  82   5.246  -3.591   3.525
    9    HE1  MET  82           HE3      MET  82   5.351  -5.082   2.592

  No H/Q in entry =           9
  In of MODEL   71
    1    H    THR  83           H        THR  83   0.085  -1.854   2.196
    2    HA   THR  83           HA       THR  83   1.473   0.608   2.281
    3    HB   THR  83           HB       THR  83  -0.710   1.510   1.290
    4    HG1  THR  83           HG1      THR  83  -2.348   0.197   1.182
    5   HG22  THR  83          HG21      THR  83  -0.419  -0.308  -0.708
    6   HG21  THR  83          HG22      THR  83   1.083  -0.585   0.172
    7   HG23  THR  83          HG23      THR  83   0.707   1.024  -0.446

  No H/Q in entry =           7
  In of MODEL   71
    1    H    SER  84           H        SER  84  -1.525  -0.451   3.879
    2    HA   SER  84           HA       SER  84  -2.047   1.977   5.218
    3    HB2  SER  84           HB2      SER  84  -2.854  -0.868   5.786
    4    HB3  SER  84           HB3      SER  84  -3.361   0.470   6.816
    5    HG   SER  84           HG       SER  84  -3.812   0.147   4.024

  No H/Q in entry =           5
  In of MODEL   71
    1    H    MET  85           H        MET  85  -0.311  -0.937   6.355
    2    HA   MET  85           HA       MET  85   0.196  -0.002   8.959
    3    HB2  MET  85           HB2      MET  85   0.511  -2.343   8.293
    4    HB3  MET  85           HB3      MET  85   1.883  -1.872   7.291
    5    HG2  MET  85           HG2      MET  85   3.060  -1.019   9.279
    6    HG3  MET  85           HG3      MET  85   1.680  -1.453  10.288
    7    HE2  MET  85           HE1      MET  85   4.135  -2.594  11.445
    8    HE1  MET  85           HE2      MET  85   4.973  -2.277   9.927
    9    HE3  MET  85           HE3      MET  85   4.981  -3.900  10.608

  No H/Q in entry =           9
  In of MODEL   71
    1    H    LEU  86           H        LEU  86   2.133   0.267   6.011
    2    HA   LEU  86           HA       LEU  86   4.333   1.599   7.167
    3    HB2  LEU  86           HB2      LEU  86   4.155   0.511   4.860
    4    HB3  LEU  86           HB3      LEU  86   3.334   1.984   4.344
    5    HG   LEU  86           HG       LEU  86   5.350   3.250   5.325
    6   HD11  LEU  86          HD11      LEU  86   6.077   0.646   6.130
    7   HD13  LEU  86          HD12      LEU  86   7.068   2.100   6.227
    8   HD12  LEU  86          HD13      LEU  86   7.188   1.051   4.817
    9   HD23  LEU  86          HD21      LEU  86   6.086   1.490   2.979
   10   HD22  LEU  86          HD22      LEU  86   6.464   3.191   3.238
   11   HD21  LEU  86          HD23      LEU  86   4.816   2.707   2.838

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ALA  87           H        ALA  87   1.412   2.814   5.576
    2    HA   ALA  87           HA       ALA  87   1.982   5.549   5.656
    3    HB1  ALA  87           HB1      ALA  87  -0.312   3.900   5.114
    4    HB3  ALA  87           HB2      ALA  87  -0.015   5.562   4.612
    5    HB2  ALA  87           HB3      ALA  87  -0.808   5.237   6.154

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ARG  88           H        ARG  88   0.306   3.537   8.047
    2    HA   ARG  88           HA       ARG  88  -0.226   5.585   9.889
    3    HB2  ARG  88           HB2      ARG  88  -1.144   3.224   9.958
    4    HB3  ARG  88           HB3      ARG  88   0.400   2.739  10.668
    5    HG2  ARG  88           HG2      ARG  88  -0.097   4.812  12.283
    6    HG3  ARG  88           HG3      ARG  88  -1.760   4.472  11.825
    7    HD2  ARG  88           HD2      ARG  88  -1.853   2.624  13.075
    8    HD3  ARG  88           HD3      ARG  88  -0.258   2.055  12.547
    9    HE   ARG  88           HE       ARG  88  -0.807   3.318  14.998
   10   HH21  ARG  88          HH11      ARG  88   0.740   4.347  16.237
   11   HH22  ARG  88          HH12      ARG  88   2.257   4.786  15.534
   12   HH11  ARG  88          HH21      ARG  88   1.476   3.515  12.424
   13   HH12  ARG  88          HH22      ARG  88   2.682   4.299  13.387

  No H/Q in entry =          13
  In of MODEL   71
    1    H    GLU  89           H        GLU  89   2.590   3.391   9.675
    2    HA   GLU  89           HA       GLU  89   3.840   4.296  12.019
    3    HB2  GLU  89           HB2      GLU  89   4.519   2.281  10.680
    4    HB3  GLU  89           HB3      GLU  89   5.287   3.380   9.532
    5    HG2  GLU  89           HG2      GLU  89   6.761   4.244  11.277
    6    HG3  GLU  89           HG3      GLU  89   5.933   3.282  12.497

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LEU  90           H        LEU  90   4.152   5.450   8.689
    2    HA   LEU  90           HA       LEU  90   6.062   7.470   9.274
    3    HB2  LEU  90           HB2      LEU  90   4.063   7.115   7.044
    4    HB3  LEU  90           HB3      LEU  90   5.281   8.397   7.064
    5    HG   LEU  90           HG       LEU  90   5.982   5.468   7.405
    6   HD12  LEU  90          HD11      LEU  90   6.732   5.704   4.966
    7   HD11  LEU  90          HD12      LEU  90   5.703   7.134   4.913
    8   HD13  LEU  90          HD13      LEU  90   4.998   5.555   5.258
    9   HD22  LEU  90          HD21      LEU  90   7.867   6.637   8.088
   10   HD21  LEU  90          HD22      LEU  90   7.506   8.036   7.078
   11   HD23  LEU  90          HD23      LEU  90   8.180   6.577   6.355

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  91           H        ILE  91   2.523   7.450   9.119
    2    HA   ILE  91           HA       ILE  91   2.153  10.220   9.564
    3    HB   ILE  91           HB       ILE  91   0.385   7.828  10.108
    4   HG12  ILE  91          HG12      ILE  91   0.117  10.103   8.118
    5   HG13  ILE  91          HG13      ILE  91   0.992   8.617   7.751
    6   HG22  ILE  91          HG21      ILE  91  -1.368   9.869  10.165
    7   HG21  ILE  91          HG22      ILE  91   0.024  10.715  10.838
    8   HG23  ILE  91          HG23      ILE  91  -0.600   9.273  11.636
    9   HD13  ILE  91          HD11      ILE  91  -0.939   7.310   7.795
   10   HD12  ILE  91          HD12      ILE  91  -1.542   8.818   7.109
   11   HD11  ILE  91          HD13      ILE  91  -1.812   8.454   8.814

  No H/Q in entry =          11
  In of MODEL   71
    1    H    THR  92           H        THR  92   2.580   7.488  11.771
    2    HA   THR  92           HA       THR  92   2.119   8.862  14.192
    3    HB   THR  92           HB       THR  92   3.952   6.544  13.535
    4    HG1  THR  92           HG1      THR  92   1.992   5.767  13.432
    5   HG22  THR  92          HG21      THR  92   3.567   6.262  16.168
    6   HG21  THR  92          HG22      THR  92   3.484   8.020  16.091
    7   HG23  THR  92          HG23      THR  92   4.927   7.178  15.523

  No H/Q in entry =           7
  In of MODEL   71
    1    H    GLU  93           H        GLU  93   5.078   8.440  12.264
    2    HA   GLU  93           HA       GLU  93   6.813   9.889  13.961
    3    HB2  GLU  93           HB2      GLU  93   6.910   9.569  10.947
    4    HB3  GLU  93           HB3      GLU  93   8.243  10.115  11.962
    5    HG2  GLU  93           HG2      GLU  93   6.861   7.465  12.413
    6    HG3  GLU  93           HG3      GLU  93   8.245   7.629  11.339

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LEU  94           H        LEU  94   4.759  10.876  11.242
    2    HA   LEU  94           HA       LEU  94   5.534  13.588  11.137
    3    HB2  LEU  94           HB2      LEU  94   2.960  12.193  10.382
    4    HB3  LEU  94           HB3      LEU  94   3.200  13.922  10.137
    5    HG   LEU  94           HG       LEU  94   5.241  11.955   9.095
    6   HD11  LEU  94          HD11      LEU  94   2.496  12.472   8.026
    7   HD13  LEU  94          HD12      LEU  94   3.495  11.026   7.906
    8   HD12  LEU  94          HD13      LEU  94   3.817  12.408   6.859
    9   HD23  LEU  94          HD21      LEU  94   5.474  13.789   7.369
   10   HD22  LEU  94          HD22      LEU  94   5.880  14.291   9.010
   11   HD21  LEU  94          HD23      LEU  94   4.325  14.740   8.308

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  95           H        ILE  95   3.011  11.947  13.027
    2    HA   ILE  95           HA       ILE  95   1.939  14.287  14.215
    3    HB   ILE  95           HB       ILE  95   1.987  11.408  15.146
    4   HG12  ILE  95          HG12      ILE  95  -0.252  13.153  14.088
    5   HG13  ILE  95          HG13      ILE  95   0.719  12.103  13.061
    6   HG21  ILE  95          HG21      ILE  95   0.674  13.868  16.340
    7   HG23  ILE  95          HG22      ILE  95   1.734  12.714  17.149
    8   HG22  ILE  95          HG23      ILE  95   0.105  12.232  16.672
    9   HD13  ILE  95          HD11      ILE  95  -0.163  10.156  13.983
   10   HD12  ILE  95          HD12      ILE  95  -1.558  11.229  14.054
   11   HD11  ILE  95          HD13      ILE  95  -0.592  10.946  15.501

  No H/Q in entry =          11
  In of MODEL   71
    1    H    GLU  96           H        GLU  96   4.558  12.101  15.221
    2    HA   GLU  96           HA       GLU  96   5.094  13.312  17.711
    3    HB2  GLU  96           HB2      GLU  96   6.069  11.163  17.071
    4    HB3  GLU  96           HB3      GLU  96   6.995  11.945  15.791
    5    HG2  GLU  96           HG2      GLU  96   8.634  12.516  17.255
    6    HG3  GLU  96           HG3      GLU  96   7.475  13.318  18.306

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LEU  97           H        LEU  97   6.165  14.090  14.426
    2    HA   LEU  97           HA       LEU  97   8.026  16.110  15.137
    3    HB2  LEU  97           HB2      LEU  97   6.446  15.536  12.639
    4    HB3  LEU  97           HB3      LEU  97   7.448  16.980  12.760
    5    HG   LEU  97           HG       LEU  97   8.510  14.197  13.329
    6   HD12  LEU  97          HD11      LEU  97   9.509  14.398  11.013
    7   HD11  LEU  97          HD12      LEU  97   8.441  15.774  10.744
    8   HD13  LEU  97          HD13      LEU  97   7.761  14.175  11.041
    9   HD23  LEU  97          HD21      LEU  97  10.665  15.501  12.587
   10   HD22  LEU  97          HD22      LEU  97  10.039  15.766  14.214
   11   HD21  LEU  97          HD23      LEU  97   9.713  16.942  12.943

  No H/Q in entry =          11
  In of MODEL   71
    1    H    HIS  98           H        HIS  98   4.534  16.201  14.475
    2    HA   HIS  98           HA       HIS  98   4.199  18.996  14.602
    3    HB2  HIS  98           HB2      HIS  98   2.336  16.724  15.330
    4    HB3  HIS  98           HB3      HIS  98   1.848  18.419  15.380
    5    HD1  HIS  98           HD1      HIS  98   2.909  15.711  12.984
    6    HD2  HIS  98           HD2      HIS  98   1.483  19.626  12.850
    7    HE1  HIS  98           HE1      HIS  98   2.348  16.187  10.558
    8    HE2  HIS  98           HE2      HIS  98   1.484  18.565  10.455

  No H/Q in entry =           8
  In of MODEL   71
    1    H    GLU  99           H        GLU  99   4.359  16.516  17.108
    2    HA   GLU  99           HA       GLU  99   3.724  18.208  19.300
    3    HB2  GLU  99           HB2      GLU  99   3.667  15.725  19.403
    4    HB3  GLU  99           HB3      GLU  99   5.427  15.702  19.299
    5    HG2  GLU  99           HG2      GLU  99   5.595  17.001  21.370
    6    HG3  GLU  99           HG3      GLU  99   3.841  17.120  21.462

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LYS 100           H        LYS 100   6.793  17.312  17.744
    2    HA   LYS 100           HA       LYS 100   8.426  18.738  19.601
    3    HB2  LYS 100           HB2      LYS 100   8.943  17.813  16.765
    4    HB3  LYS 100           HB3      LYS 100  10.160  18.601  17.774
    5    HG2  LYS 100           HG2      LYS 100   9.803  16.850  19.519
    6    HG3  LYS 100           HG3      LYS 100   8.683  16.029  18.427
    7    HD2  LYS 100           HD2      LYS 100  10.484  15.765  16.764
    8    HD3  LYS 100           HD3      LYS 100  11.609  16.598  17.841
    9    HE2  LYS 100           HE2      LYS 100  11.231  14.842  19.562
   10    HE3  LYS 100           HE3      LYS 100  10.169  13.990  18.437
   11    HZ1  LYS 100           HZ1      LYS 100  12.982  14.693  17.786
   12    HZ3  LYS 100           HZ2      LYS 100  11.954  13.623  16.958
   13    HZ2  LYS 100           HZ3      LYS 100  12.544  13.215  18.499

  No H/Q in entry =          13
  In of MODEL   71
    1    H    LEU 101           H        LEU 101   6.727  19.636  16.640
    2    HA   LEU 101           HA       LEU 101   7.909  22.208  16.301
    3    HB2  LEU 101           HB2      LEU 101   5.332  20.940  15.412
    4    HB3  LEU 101           HB3      LEU 101   5.561  22.673  15.201
    5    HG   LEU 101           HG       LEU 101   7.625  20.680  14.244
    6   HD12  LEU 101          HD11      LEU 101   6.470  21.167  11.956
    7   HD11  LEU 101          HD12      LEU 101   5.063  21.581  12.932
    8   HD13  LEU 101          HD13      LEU 101   5.748  19.959  13.019
    9   HD21  LEU 101          HD21      LEU 101   6.961  23.583  13.681
   10   HD23  LEU 101          HD22      LEU 101   7.956  22.633  12.578
   11   HD22  LEU 101          HD23      LEU 101   8.491  22.901  14.237

  No H/Q in entry =          11
  In of MODEL   71
    1    H    LYS 102           H        LYS 102   6.381  21.057  18.916
    2    HA   LYS 102           HA       LYS 102   5.731  22.145  20.845
    3    HB2  LYS 102           HB2      LYS 102   6.991  24.148  19.719
    4    HB3  LYS 102           HB3      LYS 102   5.386  24.732  19.338
    5    HG2  LYS 102           HG2      LYS 102   6.760  24.499  21.994
    6    HG3  LYS 102           HG3      LYS 102   5.793  25.814  21.360
    7    HD2  LYS 102           HD2      LYS 102   4.580  23.165  22.242
    8    HD3  LYS 102           HD3      LYS 102   4.809  24.531  23.323
    9    HE2  LYS 102           HE2      LYS 102   2.538  24.097  21.830
   10    HE3  LYS 102           HE3      LYS 102   3.020  25.650  22.510
   11    HZ2  LYS 102           HZ1      LYS 102   2.494  25.746  20.129
   12    HZ1  LYS 102           HZ2      LYS 102   3.769  24.679  19.811
   13    HZ3  LYS 102           HZ3      LYS 102   4.092  26.215  20.451

  No H/Q in entry =          13
  In of MODEL   71
    1    H    ALA 103           H        ALA 103   4.080  23.661  18.071
    2    HA   ALA 103           HA       ALA 103   1.617  24.209  18.949
    3    HB1  ALA 103           HB1      ALA 103   0.734  23.352  16.707
    4    HB2  ALA 103           HB2      ALA 103   2.388  22.834  16.382
    5    HB3  ALA 103           HB3      ALA 103   2.032  24.543  16.644

  No H/Q in entry =           5
  In of MODEL   71
    1    H1   ALA   1           H3       ALA   1  10.812 -20.236  -6.210
    2    H2   ALA   1           H2       ALA   1   9.853 -20.457  -7.598
    3    H3   ALA   1           H1       ALA   1   9.422 -21.205  -6.134
    4    HA   ALA   1           HA       ALA   1  10.484 -23.003  -6.868
    5    HB1  ALA   1           HB1      ALA   1  10.580 -22.648  -9.144
    6    HB2  ALA   1           HB2      ALA   1  12.305 -22.477  -8.812
    7    HB3  ALA   1           HB3      ALA   1  11.290 -21.042  -8.968

  No H/Q in entry =           7
  In of MODEL   71
    1    H    GLU   2           H        GLU   2  12.779 -23.927  -6.919
    2    HA   GLU   2           HA       GLU   2  14.155 -23.825  -4.705
    3    HB2  GLU   2           HB2      GLU   2  15.515 -23.684  -7.402
    4    HB3  GLU   2           HB3      GLU   2  16.247 -24.283  -5.915
    5    HG2  GLU   2           HG2      GLU   2  15.254 -26.312  -6.153
    6    HG3  GLU   2           HG3      GLU   2  13.675 -25.585  -6.416

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLU   3           H        GLU   3  15.909 -21.945  -7.107
    2    HA   GLU   3           HA       GLU   3  17.039 -20.241  -5.149
    3    HB2  GLU   3           HB2      GLU   3  16.989 -20.246  -8.159
    4    HB3  GLU   3           HB3      GLU   3  17.718 -18.906  -7.274
    5    HG2  GLU   3           HG2      GLU   3  19.394 -20.260  -6.345
    6    HG3  GLU   3           HG3      GLU   3  18.465 -21.738  -6.565

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LEU   4           H        LEU   4  14.753 -19.425  -7.786
    2    HA   LEU   4           HA       LEU   4  14.255 -16.820  -7.181
    3    HB2  LEU   4           HB2      LEU   4  12.104 -18.821  -7.910
    4    HB3  LEU   4           HB3      LEU   4  12.010 -17.073  -8.113
    5    HG   LEU   4           HG       LEU   4  13.997 -18.917  -9.479
    6   HD13  LEU   4          HD11      LEU   4  12.697 -18.787 -11.391
    7   HD12  LEU   4          HD12      LEU   4  11.971 -17.249 -10.928
    8   HD11  LEU   4          HD13      LEU   4  11.433 -18.744 -10.165
    9   HD23  LEU   4          HD21      LEU   4  14.311 -16.671 -10.834
   10   HD22  LEU   4          HD22      LEU   4  15.171 -16.900  -9.313
   11   HD21  LEU   4          HD23      LEU   4  13.707 -15.921  -9.356

  No H/Q in entry =          11
  In of MODEL   71
    1    H    GLU   5           H        GLU   5  12.799 -19.617  -5.535
    2    HA   GLU   5           HA       GLU   5  11.102 -18.061  -3.838
    3    HB2  GLU   5           HB2      GLU   5  10.706 -20.446  -4.357
    4    HB3  GLU   5           HB3      GLU   5  12.141 -20.863  -3.419
    5    HG2  GLU   5           HG2      GLU   5  11.152 -19.832  -1.419
    6    HG3  GLU   5           HG3      GLU   5   9.722 -19.384  -2.350

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLU   6           H        GLU   6  14.265 -19.604  -3.387
    2    HA   GLU   6           HA       GLU   6  14.603 -18.738  -0.690
    3    HB2  GLU   6           HB2      GLU   6  16.580 -19.653  -2.791
    4    HB3  GLU   6           HB3      GLU   6  17.017 -19.310  -1.116
    5    HG2  GLU   6           HG2      GLU   6  15.450 -21.013  -0.327
    6    HG3  GLU   6           HG3      GLU   6  14.923 -21.325  -1.981

  No H/Q in entry =           6
  In of MODEL   71
    1    H    VAL   7           H        VAL   7  15.359 -17.409  -3.841
    2    HA   VAL   7           HA       VAL   7  17.018 -15.262  -2.978
    3    HB   VAL   7           HB       VAL   7  15.321 -15.650  -5.457
    4   HG11  VAL   7          HG11      VAL   7  17.187 -13.413  -4.647
    5   HG13  VAL   7          HG12      VAL   7  15.544 -13.291  -5.273
    6   HG12  VAL   7          HG13      VAL   7  16.861 -13.781  -6.340
    7   HG21  VAL   7          HG21      VAL   7  17.444 -17.081  -4.882
    8   HG23  VAL   7          HG22      VAL   7  18.332 -15.610  -5.282
    9   HG22  VAL   7          HG23      VAL   7  17.307 -16.374  -6.493

  No H/Q in entry =           9
  In of MODEL   71
    1    H    VAL   8           H        VAL   8  13.530 -15.574  -3.540
    2    HA   VAL   8           HA       VAL   8  12.832 -12.873  -3.075
    3    HB   VAL   8           HB       VAL   8  11.300 -15.458  -2.766
    4   HG11  VAL   8          HG11      VAL   8  10.509 -12.632  -2.091
    5   HG13  VAL   8          HG12      VAL   8  10.181 -14.119  -1.199
    6   HG12  VAL   8          HG13      VAL   8   9.299 -13.769  -2.684
    7   HG21  VAL   8          HG21      VAL   8  11.872 -13.613  -4.944
    8   HG23  VAL   8          HG22      VAL   8  10.137 -13.679  -4.647
    9   HG22  VAL   8          HG23      VAL   8  11.023 -15.157  -5.007

  No H/Q in entry =           9
  In of MODEL   71
    1    H    MET   9           H        MET   9  13.128 -15.671  -0.889
    2    HA   MET   9           HA       MET   9  12.294 -14.404   1.477
    3    HB2  MET   9           HB2      MET   9  14.186 -16.678   0.914
    4    HB3  MET   9           HB3      MET   9  13.971 -16.074   2.558
    5    HG2  MET   9           HG2      MET   9  11.439 -16.331   2.123
    6    HG3  MET   9           HG3      MET   9  11.910 -17.312   0.736
    7    HE3  MET   9           HE1      MET   9  13.394 -20.440   1.980
    8    HE2  MET   9           HE2      MET   9  14.397 -19.062   1.533
    9    HE1  MET   9           HE3      MET   9  12.900 -19.372   0.659

  No H/Q in entry =           9
  In of MODEL   71
    1    H    GLY  10           H        GLY  10  15.480 -14.592  -0.073
    2    HA3  GLY  10           HA2      GLY  10  16.918 -13.149   1.896
    3    HA2  GLY  10           HA3      GLY  10  17.386 -13.312   0.204

  No H/Q in entry =           3
  In of MODEL   71
    1    H    LEU  11           H        LEU  11  15.204 -12.121  -1.042
    2    HA   LEU  11           HA       LEU  11  15.854  -9.367  -0.883
    3    HB2  LEU  11           HB2      LEU  11  13.507 -10.810  -2.119
    4    HB3  LEU  11           HB3      LEU  11  13.765  -9.072  -2.282
    5    HG   LEU  11           HG       LEU  11  15.821 -11.156  -3.062
    6   HD13  LEU  11          HD11      LEU  11  14.083 -11.549  -4.584
    7   HD12  LEU  11          HD12      LEU  11  15.072 -10.356  -5.425
    8   HD11  LEU  11          HD13      LEU  11  13.590  -9.855  -4.611
    9   HD22  LEU  11          HD21      LEU  11  17.026  -9.176  -2.838
   10   HD21  LEU  11          HD22      LEU  11  15.639  -8.158  -3.222
   11   HD23  LEU  11          HD23      LEU  11  16.483  -9.019  -4.507

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  12           H        ILE  12  13.107 -11.227   0.383
    2    HA   ILE  12           HA       ILE  12  11.683  -9.019   1.436
    3    HB   ILE  12           HB       ILE  12  11.756 -11.898   2.393
    4   HG12  ILE  12          HG12      ILE  12  11.070 -11.289  -0.058
    5   HG13  ILE  12          HG13      ILE  12  10.049 -12.381   0.856
    6   HG22  ILE  12          HG21      ILE  12   9.472 -11.349   3.308
    7   HG21  ILE  12          HG22      ILE  12   9.784  -9.653   2.939
    8   HG23  ILE  12          HG23      ILE  12  10.787 -10.498   4.117
    9   HD11  ILE  12          HD11      ILE  12   9.600  -9.395   0.606
   10   HD13  ILE  12          HD12      ILE  12   8.513 -10.567   1.349
   11   HD12  ILE  12          HD13      ILE  12   8.794 -10.606  -0.377

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  13           H        ILE  13  14.103 -11.188   2.850
    2    HA   ILE  13           HA       ILE  13  14.117 -10.003   5.428
    3    HB   ILE  13           HB       ILE  13  16.200 -11.551   3.868
    4   HG12  ILE  13          HG12      ILE  13  13.948 -12.561   4.692
    5   HG13  ILE  13          HG13      ILE  13  15.437 -13.448   5.009
    6   HG21  ILE  13          HG21      ILE  13  16.377 -10.231   6.535
    7   HG23  ILE  13          HG22      ILE  13  17.652 -10.578   5.374
    8   HG22  ILE  13          HG23      ILE  13  17.038 -11.861   6.416
    9   HD12  ILE  13          HD11      ILE  13  13.626 -12.960   6.950
   10   HD11  ILE  13          HD12      ILE  13  14.569 -11.479   7.073
   11   HD13  ILE  13          HD13      ILE  13  15.356 -13.039   7.278

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ASN  14           H        ASN  14  16.068  -9.451   2.512
    2    HA   ASN  14           HA       ASN  14  17.782  -7.482   3.573
    3    HB2  ASN  14           HB2      ASN  14  17.783  -8.753   1.260
    4    HB3  ASN  14           HB3      ASN  14  16.870  -7.351   0.718
    5   HD21  ASN  14          HD21      ASN  14  19.318  -7.656  -0.462
    6   HD22  ASN  14          HD22      ASN  14  20.443  -6.555   0.165

  No H/Q in entry =           6
  In of MODEL   71
    1    H    SER  15           H        SER  15  14.670  -7.184   1.874
    2    HA   SER  15           HA       SER  15  14.515  -4.366   1.924
    3    HB2  SER  15           HB2      SER  15  12.188  -4.648   1.425
    4    HB3  SER  15           HB3      SER  15  13.007  -6.005   0.658
    5    HG   SER  15           HG       SER  15  11.301  -5.940   2.842

  No H/Q in entry =           5
  In of MODEL   71
    1    H    GLY  16           H        GLY  16  13.455  -6.837   4.231
    2    HA3  GLY  16           HA2      GLY  16  12.203  -5.104   6.082
    3    HA2  GLY  16           HA3      GLY  16  12.842  -6.702   6.449

  No H/Q in entry =           3
  In of MODEL   71
    1    H    GLN  17           H        GLN  17  15.549  -6.328   5.861
    2    HA   GLN  17           HA       GLN  17  16.481  -5.087   8.241
    3    HB2  GLN  17           HB2      GLN  17  17.909  -5.939   5.709
    4    HB3  GLN  17           HB3      GLN  17  18.754  -5.294   7.118
    5    HG2  GLN  17           HG2      GLN  17  17.792  -7.087   8.516
    6    HG3  GLN  17           HG3      GLN  17  16.954  -7.735   7.108
    7   HE21  GLN  17          HE21      GLN  17  18.218  -8.896   5.519
    8   HE22  GLN  17          HE22      GLN  17  19.837  -9.320   5.793

  No H/Q in entry =           8
  In of MODEL   71
    1    H    ALA  18           H        ALA  18  16.283  -4.019   4.878
    2    HA   ALA  18           HA       ALA  18  17.680  -1.604   5.103
    3    HB2  ALA  18           HB1      ALA  18  16.586  -2.841   3.036
    4    HB3  ALA  18           HB2      ALA  18  16.823  -1.093   3.017
    5    HB1  ALA  18           HB3      ALA  18  15.233  -1.764   3.385

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ARG  19           H        ARG  19  14.189  -2.246   5.494
    2    HA   ARG  19           HA       ARG  19  13.478   0.394   6.202
    3    HB2  ARG  19           HB2      ARG  19  11.826  -1.385   5.615
    4    HB3  ARG  19           HB3      ARG  19  12.177  -2.175   7.155
    5    HG2  ARG  19           HG2      ARG  19  11.432  -0.192   8.388
    6    HG3  ARG  19           HG3      ARG  19  11.171   0.677   6.877
    7    HD2  ARG  19           HD2      ARG  19   9.041  -0.152   7.694
    8    HD3  ARG  19           HD3      ARG  19   9.477  -1.028   6.221
    9    HE   ARG  19           HE       ARG  19  10.456  -2.550   8.332
   10   HH21  ARG  19          HH11      ARG  19   9.231  -4.208   9.271
   11   HH22  ARG  19          HH12      ARG  19   7.511  -4.208   9.097
   12   HH11  ARG  19          HH21      ARG  19   7.444  -1.308   7.227
   13   HH12  ARG  19          HH22      ARG  19   6.500  -2.567   7.935

  No H/Q in entry =          13
  In of MODEL   71
    1    H    SER  20           H        SER  20  14.376  -2.418   8.169
    2    HA   SER  20           HA       SER  20  14.070  -1.318  10.703
    3    HB2  SER  20           HB2      SER  20  14.573  -3.633  10.596
    4    HB3  SER  20           HB3      SER  20  16.017  -3.354   9.624
    5    HG   SER  20           HG       SER  20  16.726  -2.093  11.559

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LEU  21           H        LEU  21  16.916  -1.215   8.573
    2    HA   LEU  21           HA       LEU  21  18.563   0.301  10.312
    3    HB2  LEU  21           HB2      LEU  21  18.552   0.018   7.300
    4    HB3  LEU  21           HB3      LEU  21  19.789   0.907   8.186
    5    HG   LEU  21           HG       LEU  21  19.103  -1.997   8.735
    6   HD12  LEU  21          HD11      LEU  21  21.351  -0.833   7.060
    7   HD11  LEU  21          HD12      LEU  21  19.965  -1.727   6.438
    8   HD13  LEU  21          HD13      LEU  21  21.146  -2.539   7.463
    9   HD21  LEU  21          HD21      LEU  21  21.180  -0.054   9.730
   10   HD23  LEU  21          HD22      LEU  21  21.593  -1.763   9.650
   11   HD22  LEU  21          HD23      LEU  21  20.248  -1.233  10.648

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ALA  22           H        ALA  22  16.290   1.228   7.749
    2    HA   ALA  22           HA       ALA  22  16.784   3.995   7.759
    3    HB3  ALA  22           HB1      ALA  22  15.406   2.727   6.080
    4    HB2  ALA  22           HB2      ALA  22  14.674   4.229   6.641
    5    HB1  ALA  22           HB3      ALA  22  14.106   2.682   7.271

  No H/Q in entry =           5
  In of MODEL   71
    1    H    TYR  23           H        TYR  23  14.312   2.143   9.591
    2    HA   TYR  23           HA       TYR  23  13.311   4.368  11.034
    3    HB2  TYR  23           HB2      TYR  23  12.110   2.234  11.013
    4    HB3  TYR  23           HB3      TYR  23  13.452   1.448  11.845
    5    HD1  TYR  23           HD1      TYR  23  10.904   4.153  12.192
    6    HD2  TYR  23           HD2      TYR  23  13.636   1.518  14.203
    7    HE1  TYR  23           HE1      TYR  23   9.956   4.838  14.381
    8    HE2  TYR  23           HE2      TYR  23  12.688   2.203  16.389
    9    HH   TYR  23           HH       TYR  23   9.892   4.377  16.580

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ALA  24           H        ALA  24  15.990   2.135  11.682
    2    HA   ALA  24           HA       ALA  24  16.638   3.146  14.245
    3    HB1  ALA  24           HB1      ALA  24  18.023   1.374  14.087
    4    HB3  ALA  24           HB2      ALA  24  19.039   2.309  12.989
    5    HB2  ALA  24           HB3      ALA  24  17.762   1.279  12.346

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ALA  25           H        ALA  25  17.589   4.083  10.966
    2    HA   ALA  25           HA       ALA  25  19.503   6.049  11.613
    3    HB1  ALA  25           HB1      ALA  25  18.806   5.085   9.298
    4    HB3  ALA  25           HB2      ALA  25  19.282   6.780   9.388
    5    HB2  ALA  25           HB3      ALA  25  17.574   6.347   9.316

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LEU  26           H        LEU  26  15.986   6.223  11.243
    2    HA   LEU  26           HA       LEU  26  15.718   9.002  11.687
    3    HB2  LEU  26           HB2      LEU  26  13.878   7.737  10.758
    4    HB3  LEU  26           HB3      LEU  26  13.799   6.711  12.185
    5    HG   LEU  26           HG       LEU  26  13.160   8.662  13.560
    6   HD12  LEU  26          HD11      LEU  26  12.471  10.750  12.228
    7   HD11  LEU  26          HD12      LEU  26  13.465  10.109  10.922
    8   HD13  LEU  26          HD13      LEU  26  14.200  10.508  12.476
    9   HD21  LEU  26          HD21      LEU  26  11.496   8.318  11.046
   10   HD23  LEU  26          HD22      LEU  26  10.921   9.011  12.560
   11   HD22  LEU  26          HD23      LEU  26  11.399   7.316  12.495

  No H/Q in entry =          11
  In of MODEL   71
    1    H    LYS  27           H        LYS  27  15.646   6.226  13.886
    2    HA   LYS  27           HA       LYS  27  15.027   7.587  16.250
    3    HB2  LYS  27           HB2      LYS  27  15.093   5.112  15.990
    4    HB3  LYS  27           HB3      LYS  27  16.855   5.190  15.951
    5    HG2  LYS  27           HG2      LYS  27  16.885   6.181  18.198
    6    HG3  LYS  27           HG3      LYS  27  15.118   6.174  18.240
    7    HD2  LYS  27           HD2      LYS  27  15.129   3.706  18.008
    8    HD3  LYS  27           HD3      LYS  27  16.894   3.721  18.000
    9    HE2  LYS  27           HE2      LYS  27  16.908   4.715  20.255
   10    HE3  LYS  27           HE3      LYS  27  15.142   4.730  20.265
   11    HZ3  LYS  27           HZ1      LYS  27  15.955   2.791  21.422
   12    HZ2  LYS  27           HZ2      LYS  27  16.882   2.323  20.074
   13    HZ1  LYS  27           HZ3      LYS  27  15.184   2.304  19.990

  No H/Q in entry =          13
  In of MODEL   71
    1    H    GLN  28           H        GLN  28  18.156   7.046  14.666
    2    HA   GLN  28           HA       GLN  28  19.820   8.158  16.659
    3    HB2  GLN  28           HB2      GLN  28  20.115   8.111  13.644
    4    HB3  GLN  28           HB3      GLN  28  21.393   8.601  14.758
    5    HG2  GLN  28           HG2      GLN  28  20.009   5.904  14.800
    6    HG3  GLN  28           HG3      GLN  28  21.589   6.212  14.080
    7   HE21  GLN  28          HE21      GLN  28  20.365   4.849  16.764
    8   HE22  GLN  28          HE22      GLN  28  21.531   5.304  17.908

  No H/Q in entry =           8
  In of MODEL   71
    1    H    ALA  29           H        ALA  29  18.054   9.611  13.959
    2    HA   ALA  29           HA       ALA  29  19.016  12.245  14.210
    3    HB2  ALA  29           HB1      ALA  29  17.313  12.856  12.733
    4    HB1  ALA  29           HB2      ALA  29  16.183  11.669  13.384
    5    HB3  ALA  29           HB3      ALA  29  17.523  11.143  12.365

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LYS  30           H        LYS  30  16.258  10.612  15.727
    2    HA   LYS  30           HA       LYS  30  15.211  12.854  17.078
    3    HB2  LYS  30           HB2      LYS  30  15.136   9.913  17.787
    4    HB3  LYS  30           HB3      LYS  30  14.252  11.154  18.676
    5    HG2  LYS  30           HG2      LYS  30  13.123  11.821  16.554
    6    HG3  LYS  30           HG3      LYS  30  13.947  10.493  15.731
    7    HD2  LYS  30           HD2      LYS  30  12.892   8.875  17.260
    8    HD3  LYS  30           HD3      LYS  30  12.079  10.192  18.107
    9    HE2  LYS  30           HE2      LYS  30  10.907  10.805  16.010
   10    HE3  LYS  30           HE3      LYS  30  11.701   9.460  15.184
   11    HZ2  LYS  30           HZ1      LYS  30   9.396   9.022  16.059
   12    HZ1  LYS  30           HZ2      LYS  30  10.060   9.087  17.628
   13    HZ3  LYS  30           HZ3      LYS  30  10.586   7.906  16.521

  No H/Q in entry =          13
  In of MODEL   71
    1    H    GLN  31           H        GLN  31  17.898  10.720  17.825
    2    HA   GLN  31           HA       GLN  31  18.206  11.744  20.518
    3    HB2  GLN  31           HB2      GLN  31  20.252  10.196  18.921
    4    HB3  GLN  31           HB3      GLN  31  20.112  10.322  20.675
    5    HG2  GLN  31           HG2      GLN  31  17.613   9.336  19.902
    6    HG3  GLN  31           HG3      GLN  31  18.728   8.504  18.826
    7   HE21  GLN  31          HE21      GLN  31  17.194   7.342  21.101
    8   HE22  GLN  31          HE22      GLN  31  18.356   6.698  22.155

  No H/Q in entry =           8
  In of MODEL   71
    1    H    GLY  32           H        GLY  32  18.715  13.062  17.550
    2    HA3  GLY  32           HA2      GLY  32  19.674  15.119  17.035
    3    HA2  GLY  32           HA3      GLY  32  20.428  15.136  18.624

  No H/Q in entry =           3
  In of MODEL   71
    1    H    ASP  33           H        ASP  33  20.891  12.246  16.854
    2    HA   ASP  33           HA       ASP  33  23.708  12.957  16.393
    3    HB2  ASP  33           HB2      ASP  33  22.233  10.322  16.510
    4    HB3  ASP  33           HB3      ASP  33  23.919  10.459  16.019

  No H/Q in entry =           4
  In of MODEL   71
    1    H    PHE  34           H        PHE  34  23.214  14.270  14.508
    2    HA   PHE  34           HA       PHE  34  21.883  13.265  12.219
    3    HB2  PHE  34           HB2      PHE  34  23.986  15.427  12.450
    4    HB3  PHE  34           HB3      PHE  34  23.008  15.121  11.017
    5    HD1  PHE  34           HD1      PHE  34  23.227  17.063  13.927
    6    HD2  PHE  34           HD2      PHE  34  20.383  14.906  11.539
    7    HE1  PHE  34           HE1      PHE  34  21.390  18.439  14.868
    8    HE2  PHE  34           HE2      PHE  34  18.550  16.282  12.482
    9    HZ   PHE  34           HZ       PHE  34  19.057  18.049  14.142

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ALA  35           H        ALA  35  25.258  13.123  13.235
    2    HA   ALA  35           HA       ALA  35  26.379  12.312  10.782
    3    HB3  ALA  35           HB1      ALA  35  28.071  11.168  12.508
    4    HB2  ALA  35           HB2      ALA  35  27.191  12.184  13.650
    5    HB1  ALA  35           HB3      ALA  35  28.022  12.916  12.278

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ALA  36           H        ALA  36  25.283  10.347  13.549
    2    HA   ALA  36           HA       ALA  36  25.804   7.863  12.279
    3    HB2  ALA  36           HB1      ALA  36  25.378   7.115  14.355
    4    HB3  ALA  36           HB2      ALA  36  23.684   7.587  14.200
    5    HB1  ALA  36           HB3      ALA  36  24.868   8.736  14.823

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ALA  37           H        ALA  37  22.953   9.951  12.402
    2    HA   ALA  37           HA       ALA  37  21.124   8.154  11.225
    3    HB3  ALA  37           HB1      ALA  37  21.308  11.121  11.513
    4    HB1  ALA  37           HB2      ALA  37  20.010  10.025  11.984
    5    HB2  ALA  37           HB3      ALA  37  20.197  10.496  10.294

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LYS  38           H        LYS  38  23.193  10.642   9.747
    2    HA   LYS  38           HA       LYS  38  22.565  10.200   7.069
    3    HB2  LYS  38           HB2      LYS  38  24.350  11.785   8.515
    4    HB3  LYS  38           HB3      LYS  38  25.399  10.808   7.494
    5    HG2  LYS  38           HG2      LYS  38  24.228  11.559   5.494
    6    HG3  LYS  38           HG3      LYS  38  23.020  12.398   6.470
    7    HD2  LYS  38           HD2      LYS  38  24.590  14.021   7.223
    8    HD3  LYS  38           HD3      LYS  38  25.965  13.053   6.693
    9    HE2  LYS  38           HE2      LYS  38  25.586  14.916   5.137
   10    HE3  LYS  38           HE3      LYS  38  25.274  13.372   4.335
   11    HZ3  LYS  38           HZ1      LYS  38  23.072  13.786   4.199
   12    HZ2  LYS  38           HZ2      LYS  38  23.571  15.408   4.284
   13    HZ1  LYS  38           HZ3      LYS  38  23.005  14.619   5.677

  No H/Q in entry =          13
  In of MODEL   71
    1    H    ALA  39           H        ALA  39  25.098   8.642   9.034
    2    HA   ALA  39           HA       ALA  39  26.194   7.065   6.969
    3    HB2  ALA  39           HB1      ALA  39  26.113   6.106   9.815
    4    HB1  ALA  39           HB2      ALA  39  27.046   7.544   9.398
    5    HB3  ALA  39           HB3      ALA  39  27.422   5.998   8.638

  No H/Q in entry =           5
  In of MODEL   71
    1    H    MET  40           H        MET  40  23.585   6.416   9.263
    2    HA   MET  40           HA       MET  40  23.184   3.703   8.533
    3    HB2  MET  40           HB2      MET  40  21.334   5.722   9.817
    4    HB3  MET  40           HB3      MET  40  20.953   4.007   9.644
    5    HG2  MET  40           HG2      MET  40  23.486   4.988  10.989
    6    HG3  MET  40           HG3      MET  40  21.994   4.692  11.880
    7    HE3  MET  40           HE1      MET  40  21.483   1.051  12.061
    8    HE2  MET  40           HE2      MET  40  20.597   2.339  11.249
    9    HE1  MET  40           HE3      MET  40  21.330   2.640  12.823

  No H/Q in entry =           9
  In of MODEL   71
    1    H    MET  41           H        MET  41  21.728   6.733   7.336
    2    HA   MET  41           HA       MET  41  19.792   5.506   5.662
    3    HB2  MET  41           HB2      MET  41  21.235   8.117   5.148
    4    HB3  MET  41           HB3      MET  41  19.717   7.599   4.427
    5    HG2  MET  41           HG2      MET  41  18.968   7.404   6.977
    6    HG3  MET  41           HG3      MET  41  20.259   8.582   7.199
    7    HE2  MET  41           HE1      MET  41  19.684   9.855   3.859
    8    HE1  MET  41           HE2      MET  41  20.631  10.311   5.272
    9    HE3  MET  41           HE3      MET  41  19.344  11.371   4.703

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ASP  42           H        ASP  42  23.152   6.478   5.115
    2    HA   ASP  42           HA       ASP  42  23.257   6.001   2.358
    3    HB2  ASP  42           HB2      ASP  42  24.989   7.028   4.130
    4    HB3  ASP  42           HB3      ASP  42  25.671   5.412   4.007

  No H/Q in entry =           4
  In of MODEL   71
    1    H    GLN  43           H        GLN  43  24.008   3.862   5.085
    2    HA   GLN  43           HA       GLN  43  24.710   1.612   3.507
    3    HB2  GLN  43           HB2      GLN  43  23.678   1.785   6.349
    4    HB3  GLN  43           HB3      GLN  43  24.281   0.304   5.597
    5    HG2  GLN  43           HG2      GLN  43  26.427   1.546   5.089
    6    HG3  GLN  43           HG3      GLN  43  25.822   2.866   6.085
    7   HE21  GLN  43          HE21      GLN  43  28.067   1.929   7.128
    8   HE22  GLN  43          HE22      GLN  43  27.806   0.845   8.406

  No H/Q in entry =           8
  In of MODEL   71
    1    H    SER  44           H        SER  44  21.634   2.702   4.884
    2    HA   SER  44           HA       SER  44  20.101   0.434   4.212
    3    HB2  SER  44           HB2      SER  44  19.618   2.958   5.352
    4    HB3  SER  44           HB3      SER  44  18.588   2.897   3.925
    5    HG   SER  44           HG       SER  44  17.505   1.940   5.647

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ARG  45           H        ARG  45  20.802   3.406   2.403
    2    HA   ARG  45           HA       ARG  45  19.290   2.893   0.096
    3    HB2  ARG  45           HB2      ARG  45  20.400   5.047   0.679
    4    HB3  ARG  45           HB3      ARG  45  21.957   4.315   0.298
    5    HG2  ARG  45           HG2      ARG  45  21.184   3.894  -2.017
    6    HG3  ARG  45           HG3      ARG  45  19.640   4.649  -1.635
    7    HD2  ARG  45           HD2      ARG  45  20.857   6.765  -1.052
    8    HD3  ARG  45           HD3      ARG  45  22.366   6.013  -1.616
    9    HE   ARG  45           HE       ARG  45  20.444   5.743  -3.656
   10   HH21  ARG  45          HH11      ARG  45  20.420   7.108  -5.422
   11   HH22  ARG  45          HH12      ARG  45  21.154   8.670  -5.319
   12   HH11  ARG  45          HH21      ARG  45  22.133   8.270  -2.030
   13   HH12  ARG  45          HH22      ARG  45  22.123   9.327  -3.396

  No H/Q in entry =          13
  In of MODEL   71
    1    H    MET  46           H        MET  46  22.665   2.070   0.852
    2    HA   MET  46           HA       MET  46  23.293   0.881  -1.629
    3    HB2  MET  46           HB2      MET  46  24.400   0.593   1.163
    4    HB3  MET  46           HB3      MET  46  25.065  -0.318  -0.197
    5    HG2  MET  46           HG2      MET  46  25.700   1.662  -1.351
    6    HG3  MET  46           HG3      MET  46  24.693   2.677  -0.327
    7    HE2  MET  46           HE1      MET  46  28.166   0.280   1.482
    8    HE1  MET  46           HE2      MET  46  27.269  -0.145   0.027
    9    HE3  MET  46           HE3      MET  46  26.461  -0.179   1.593

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ALA  47           H        ALA  47  21.924  -0.466   1.347
    2    HA   ALA  47           HA       ALA  47  21.911  -3.181   0.550
    3    HB2  ALA  47           HB1      ALA  47  21.521  -2.721   2.853
    4    HB3  ALA  47           HB2      ALA  47  19.994  -3.347   2.232
    5    HB1  ALA  47           HB3      ALA  47  20.199  -1.613   2.488

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LEU  48           H        LEU  48  19.522  -0.588   0.184
    2    HA   LEU  48           HA       LEU  48  17.500  -2.153  -1.067
    3    HB2  LEU  48           HB2      LEU  48  18.114   0.810  -1.187
    4    HB3  LEU  48           HB3      LEU  48  16.654   0.078  -1.854
    5    HG   LEU  48           HG       LEU  48  17.507  -0.206   1.036
    6   HD13  LEU  48          HD11      LEU  48  17.058   2.088   0.844
    7   HD12  LEU  48          HD12      LEU  48  15.508   1.420   1.353
    8   HD11  LEU  48          HD13      LEU  48  15.775   1.843  -0.339
    9   HD22  LEU  48          HD21      LEU  48  16.003  -1.942   0.657
   10   HD21  LEU  48          HD22      LEU  48  15.118  -1.054  -0.584
   11   HD23  LEU  48          HD23      LEU  48  14.898  -0.649   1.118

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ASN  49           H        ASN  49  20.163  -0.190  -2.298
    2    HA   ASN  49           HA       ASN  49  19.517  -0.289  -5.023
    3    HB2  ASN  49           HB2      ASN  49  21.174   1.252  -4.101
    4    HB3  ASN  49           HB3      ASN  49  22.221  -0.093  -3.665
    5   HD21  ASN  49          HD21      ASN  49  23.190   1.927  -5.356
    6   HD22  ASN  49          HD22      ASN  49  23.385   1.306  -6.922

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLU  50           H        GLU  50  21.529  -2.452  -3.053
    2    HA   GLU  50           HA       GLU  50  22.256  -4.203  -5.174
    3    HB2  GLU  50           HB2      GLU  50  23.451  -4.156  -3.007
    4    HB3  GLU  50           HB3      GLU  50  22.016  -4.802  -2.211
    5    HG2  GLU  50           HG2      GLU  50  22.135  -6.836  -3.565
    6    HG3  GLU  50           HG3      GLU  50  23.503  -6.187  -4.466

  No H/Q in entry =           6
  In of MODEL   71
    1    H    ALA  51           H        ALA  51  19.597  -4.168  -2.851
    2    HA   ALA  51           HA       ALA  51  18.465  -6.658  -3.603
    3    HB3  ALA  51           HB1      ALA  51  16.864  -6.170  -2.051
    4    HB1  ALA  51           HB2      ALA  51  16.630  -4.528  -2.654
    5    HB2  ALA  51           HB3      ALA  51  17.993  -4.893  -1.595

  No H/Q in entry =           5
  In of MODEL   71
    1    H    HIS  52           H        HIS  52  17.835  -3.321  -4.647
    2    HA   HIS  52           HA       HIS  52  15.731  -3.880  -6.448
    3    HB2  HIS  52           HB2      HIS  52  16.307  -1.605  -5.673
    4    HB3  HIS  52           HB3      HIS  52  17.807  -1.681  -6.597
    5    HD1  HIS  52           HD1      HIS  52  17.497  -1.999  -9.266
    6    HD2  HIS  52           HD2      HIS  52  14.092  -0.829  -7.166
    7    HE1  HIS  52           HE1      HIS  52  15.866  -1.110 -10.987
    8    HE2  HIS  52           HE2      HIS  52  13.785  -0.392  -9.722

  No H/Q in entry =           8
  In of MODEL   71
    1    H    LEU  53           H        LEU  53  19.249  -3.839  -6.877
    2    HA   LEU  53           HA       LEU  53  19.313  -4.161  -9.676
    3    HB2  LEU  53           HB2      LEU  53  21.255  -4.897  -7.500
    4    HB3  LEU  53           HB3      LEU  53  21.577  -5.272  -9.190
    5    HG   LEU  53           HG       LEU  53  20.861  -2.476  -8.256
    6   HD13  LEU  53          HD11      LEU  53  22.894  -3.038  -7.098
    7   HD12  LEU  53          HD12      LEU  53  23.350  -2.055  -8.489
    8   HD11  LEU  53          HD13      LEU  53  23.568  -3.801  -8.535
    9   HD21  LEU  53          HD21      LEU  53  21.987  -3.678 -10.795
   10   HD23  LEU  53          HD22      LEU  53  22.262  -1.985 -10.397
   11   HD22  LEU  53          HD23      LEU  53  20.628  -2.575 -10.630

  No H/Q in entry =          11
  In of MODEL   71
    1    H    VAL  54           H        VAL  54  19.231  -6.542  -7.044
    2    HA   VAL  54           HA       VAL  54  19.388  -8.839  -8.698
    3    HB   VAL  54           HB       VAL  54  18.225  -8.424  -5.933
    4   HG12  VAL  54          HG11      VAL  54  18.586 -11.037  -5.921
    5   HG11  VAL  54          HG12      VAL  54  18.400 -10.876  -7.667
    6   HG13  VAL  54          HG13      VAL  54  17.103 -10.361  -6.591
    7   HG22  VAL  54          HG21      VAL  54  20.538  -8.181  -5.708
    8   HG21  VAL  54          HG22      VAL  54  20.891  -9.271  -7.046
    9   HG23  VAL  54          HG23      VAL  54  20.369  -9.922  -5.493

  No H/Q in entry =           9
  In of MODEL   71
    1    H    GLN  55           H        GLN  55  16.632  -6.972  -7.423
    2    HA   GLN  55           HA       GLN  55  14.636  -8.667  -8.494
    3    HB2  GLN  55           HB2      GLN  55  13.864  -7.148  -6.872
    4    HB3  GLN  55           HB3      GLN  55  14.638  -5.770  -7.651
    5    HG2  GLN  55           HG2      GLN  55  12.911  -5.475  -9.143
    6    HG3  GLN  55           HG3      GLN  55  12.614  -7.200  -9.309
    7   HE21  GLN  55          HE21      GLN  55  10.614  -7.776  -8.504
    8   HE22  GLN  55          HE22      GLN  55   9.829  -7.029  -7.198

  No H/Q in entry =           8
  In of MODEL   71
    1    H    THR  56           H        THR  56  16.336  -5.846  -9.859
    2    HA   THR  56           HA       THR  56  14.895  -5.512 -12.210
    3    HB   THR  56           HB       THR  56  17.912  -5.378 -12.042
    4    HG1  THR  56           HG1      THR  56  15.952  -3.932 -10.800
    5   HG22  THR  56          HG21      THR  56  16.137  -3.508 -13.568
    6   HG21  THR  56          HG22      THR  56  16.482  -5.101 -14.241
    7   HG23  THR  56          HG23      THR  56  17.805  -3.985 -13.895

  No H/Q in entry =           7
  In of MODEL   71
    1    H    LYS  57           H        LYS  57  17.577  -7.768 -11.590
    2    HA   LYS  57           HA       LYS  57  17.598  -8.970 -14.165
    3    HB2  LYS  57           HB2      LYS  57  19.390  -9.191 -12.418
    4    HB3  LYS  57           HB3      LYS  57  18.299 -10.199 -11.477
    5    HG2  LYS  57           HG2      LYS  57  18.216 -11.848 -13.288
    6    HG3  LYS  57           HG3      LYS  57  19.259 -10.838 -14.283
    7    HD2  LYS  57           HD2      LYS  57  21.059 -11.044 -12.592
    8    HD3  LYS  57           HD3      LYS  57  20.022 -12.089 -11.624
    9    HE2  LYS  57           HE2      LYS  57  19.912 -13.714 -13.489
   10    HE3  LYS  57           HE3      LYS  57  20.956 -12.681 -14.462
   11    HZ3  LYS  57           HZ1      LYS  57  22.762 -13.096 -13.130
   12    HZ2  LYS  57           HZ2      LYS  57  21.977 -14.601 -13.113
   13    HZ1  LYS  57           HZ3      LYS  57  21.826 -13.547 -11.790

  No H/Q in entry =          13
  In of MODEL   71
    1    H    LEU  58           H        LEU  58  15.824  -9.655 -11.189
    2    HA   LEU  58           HA       LEU  58  14.639 -12.050 -12.117
    3    HB2  LEU  58           HB2      LEU  58  13.814 -10.149  -9.928
    4    HB3  LEU  58           HB3      LEU  58  13.031 -11.700 -10.240
    5    HG   LEU  58           HG       LEU  58  15.999 -11.376  -9.684
    6   HD11  LEU  58          HD11      LEU  58  13.633 -11.823  -7.892
    7   HD13  LEU  58          HD12      LEU  58  15.072 -10.838  -7.631
    8   HD12  LEU  58          HD13      LEU  58  15.170 -12.592  -7.491
    9   HD22  LEU  58          HD21      LEU  58  15.913 -13.442 -10.706
   10   HD21  LEU  58          HD22      LEU  58  14.202 -13.676 -10.346
   11   HD23  LEU  58          HD23      LEU  58  15.414 -13.955  -9.095

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  59           H        ILE  59  13.918  -8.725 -12.810
    2    HA   ILE  59           HA       ILE  59  11.214  -9.417 -13.750
    3    HB   ILE  59           HB       ILE  59  11.977  -7.121 -12.550
    4   HG12  ILE  59          HG12      ILE  59  10.086  -7.025 -14.911
    5   HG13  ILE  59          HG13      ILE  59   9.667  -7.803 -13.406
    6   HG21  ILE  59          HG21      ILE  59  13.529  -6.704 -14.598
    7   HG23  ILE  59          HG22      ILE  59  12.528  -5.378 -14.048
    8   HG22  ILE  59          HG23      ILE  59  12.057  -6.322 -15.458
    9   HD13  ILE  59          HD11      ILE  59  10.075  -5.710 -12.177
   10   HD12  ILE  59          HD12      ILE  59   8.858  -5.477 -13.432
   11   HD11  ILE  59          HD13      ILE  59  10.510  -4.916 -13.693

  No H/Q in entry =          11
  In of MODEL   71
    1    H    GLU  60           H        GLU  60  14.405  -8.521 -15.009
    2    HA   GLU  60           HA       GLU  60  13.621  -8.141 -17.719
    3    HB2  GLU  60           HB2      GLU  60  15.793  -7.381 -16.841
    4    HB3  GLU  60           HB3      GLU  60  16.279  -9.054 -16.584
    5    HG2  GLU  60           HG2      GLU  60  16.074  -9.491 -19.007
    6    HG3  GLU  60           HG3      GLU  60  15.589  -7.817 -19.266

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLY  61           H        GLY  61  14.641 -11.001 -15.894
    2    HA3  GLY  61           HA2      GLY  61  14.126 -12.664 -18.291
    3    HA2  GLY  61           HA3      GLY  61  15.164 -13.126 -16.947

  No H/Q in entry =           3
  In of MODEL   71
    1    H    ASP  62           H        ASP  62  12.022 -11.625 -16.580
    2    HA   ASP  62           HA       ASP  62  11.113 -13.587 -14.757
    3    HB2  ASP  62           HB2      ASP  62   8.963 -12.379 -14.914
    4    HB3  ASP  62           HB3      ASP  62  10.326 -11.293 -14.660

  No H/Q in entry =           4
  In of MODEL   71
    1    H    ALA  63           H        ALA  63  10.568 -13.187 -18.255
    2    HA   ALA  63           HA       ALA  63   8.854 -15.615 -18.230
    3    HB2  ALA  63           HB1      ALA  63   9.227 -13.566 -20.431
    4    HB3  ALA  63           HB2      ALA  63   7.897 -13.562 -19.274
    5    HB1  ALA  63           HB3      ALA  63   8.065 -14.892 -20.420

  No H/Q in entry =           5
  In of MODEL   71
    1    H    GLY  64           H        GLY  64   9.124 -16.663 -20.600
    2    HA3  GLY  64           HA2      GLY  64  10.679 -17.435 -22.258
    3    HA2  GLY  64           HA3      GLY  64  11.992 -17.026 -21.162

  No H/Q in entry =           3
  In of MODEL   71
    1    H    GLU  65           H        GLU  65  10.301 -18.311 -18.928
    2    HA   GLU  65           HA       GLU  65  11.585 -20.830 -19.017
    3    HB2  GLU  65           HB2      GLU  65   9.376 -19.804 -17.238
    4    HB3  GLU  65           HB3      GLU  65  10.209 -21.339 -16.997
    5    HG2  GLU  65           HG2      GLU  65  11.582 -18.641 -17.133
    6    HG3  GLU  65           HG3      GLU  65  11.194 -19.491 -15.638

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLY  66           H        GLY  66   8.333 -19.821 -19.719
    2    HA3  GLY  66           HA2      GLY  66   7.779 -22.045 -21.401
    3    HA2  GLY  66           HA3      GLY  66   6.930 -22.186 -19.875

  No H/Q in entry =           3
  In of MODEL   71
    1    H    LYS  67           H        LYS  67   5.304 -20.711 -19.363
    2    HA   LYS  67           HA       LYS  67   3.854 -19.744 -21.649
    3    HB2  LYS  67           HB2      LYS  67   3.220 -19.845 -18.705
    4    HB3  LYS  67           HB3      LYS  67   2.099 -19.233 -19.928
    5    HG2  LYS  67           HG2      LYS  67   2.256 -21.375 -21.147
    6    HG3  LYS  67           HG3      LYS  67   3.366 -21.991 -19.926
    7    HD2  LYS  67           HD2      LYS  67   1.630 -21.791 -18.209
    8    HD3  LYS  67           HD3      LYS  67   0.514 -21.111 -19.397
    9    HE2  LYS  67           HE2      LYS  67   0.060 -23.501 -19.122
   10    HE3  LYS  67           HE3      LYS  67   0.703 -23.199 -20.735
   11    HZ1  LYS  67           HZ1      LYS  67   2.651 -23.774 -18.654
   12    HZ3  LYS  67           HZ2      LYS  67   2.616 -24.266 -20.277
   13    HZ2  LYS  67           HZ3      LYS  67   1.660 -25.067 -19.124

  No H/Q in entry =          13
  In of MODEL   71
    1    H    MET  68           H        MET  68   2.999 -17.737 -21.988
    2    HA   MET  68           HA       MET  68   4.661 -15.568 -21.995
    3    HB2  MET  68           HB2      MET  68   1.645 -15.639 -21.986
    4    HB3  MET  68           HB3      MET  68   2.602 -14.216 -22.396
    5    HG2  MET  68           HG2      MET  68   2.815 -16.895 -23.798
    6    HG3  MET  68           HG3      MET  68   1.916 -15.507 -24.413
    7    HE1  MET  68           HE1      MET  68   2.651 -13.442 -24.967
    8    HE3  MET  68           HE2      MET  68   4.257 -12.955 -25.502
    9    HE2  MET  68           HE3      MET  68   3.853 -12.899 -23.787

  No H/Q in entry =           9
  In of MODEL   71
    1    H    LYS  69           H        LYS  69   3.243 -16.765 -19.163
    2    HA   LYS  69           HA       LYS  69   2.832 -14.233 -17.858
    3    HB2  LYS  69           HB2      LYS  69   2.744 -17.079 -16.868
    4    HB3  LYS  69           HB3      LYS  69   2.446 -15.686 -15.825
    5    HG2  LYS  69           HG2      LYS  69   0.647 -14.929 -17.328
    6    HG3  LYS  69           HG3      LYS  69   0.945 -16.311 -18.384
    7    HD2  LYS  69           HD2      LYS  69   0.329 -17.855 -16.596
    8    HD3  LYS  69           HD3      LYS  69   0.126 -16.510 -15.471
    9    HE2  LYS  69           HE2      LYS  69  -2.059 -17.198 -16.348
   10    HE3  LYS  69           HE3      LYS  69  -1.656 -15.585 -16.932
   11    HZ3  LYS  69           HZ1      LYS  69  -0.988 -16.475 -19.016
   12    HZ2  LYS  69           HZ2      LYS  69  -2.523 -17.109 -18.663
   13    HZ1  LYS  69           HZ3      LYS  69  -1.137 -18.071 -18.464

  No H/Q in entry =          13
  In of MODEL   71
    1    H    VAL  70           H        VAL  70   3.724 -14.419 -15.311
    2    HA   VAL  70           HA       VAL  70   6.675 -14.625 -15.472
    3    HB   VAL  70           HB       VAL  70   6.815 -12.543 -14.131
    4   HG11  VAL  70          HG11      VAL  70   6.846 -12.615 -16.694
    5   HG13  VAL  70          HG12      VAL  70   6.478 -11.053 -15.964
    6   HG12  VAL  70          HG13      VAL  70   5.178 -12.044 -16.625
    7   HG23  VAL  70          HG21      VAL  70   4.537 -11.157 -14.321
    8   HG22  VAL  70          HG22      VAL  70   4.822 -12.254 -12.971
    9   HG21  VAL  70          HG23      VAL  70   3.824 -12.771 -14.331

  No H/Q in entry =           9
  In of MODEL   71
    1    H    SER  71           H        SER  71   7.676 -14.674 -13.290
    2    HA   SER  71           HA       SER  71   6.570 -16.681 -11.634
    3    HB2  SER  71           HB2      SER  71   9.004 -16.113 -11.777
    4    HB3  SER  71           HB3      SER  71   8.670 -14.628 -10.889
    5    HG   SER  71           HG       SER  71   7.904 -17.192  -9.958

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LEU  72           H        LEU  72   5.207 -16.584  -9.951
    2    HA   LEU  72           HA       LEU  72   3.622 -14.294  -9.515
    3    HB2  LEU  72           HB2      LEU  72   3.946 -16.844  -7.941
    4    HB3  LEU  72           HB3      LEU  72   2.762 -15.603  -7.540
    5    HG   LEU  72           HG       LEU  72   2.934 -16.909 -10.276
    6   HD11  LEU  72          HD11      LEU  72   1.408 -17.659  -7.788
    7   HD13  LEU  72          HD12      LEU  72   2.318 -18.701  -8.879
    8   HD12  LEU  72          HD13      LEU  72   0.765 -18.037  -9.386
    9   HD21  LEU  72          HD21      LEU  72   1.047 -14.997  -8.917
   10   HD23  LEU  72          HD22      LEU  72   0.419 -16.080 -10.149
   11   HD22  LEU  72          HD23      LEU  72   1.692 -14.932 -10.552

  No H/Q in entry =          11
  In of MODEL   71
    1    H    VAL  73           H        VAL  73   6.297 -15.686  -7.735
    2    HA   VAL  73           HA       VAL  73   6.210 -14.148  -5.406
    3    HB   VAL  73           HB       VAL  73   8.367 -14.958  -4.949
    4   HG12  VAL  73          HG11      VAL  73   7.292 -17.000  -6.901
    5   HG11  VAL  73          HG12      VAL  73   6.518 -16.682  -5.348
    6   HG13  VAL  73          HG13      VAL  73   8.174 -17.287  -5.401
    7   HG22  VAL  73          HG21      VAL  73   9.627 -14.172  -6.814
    8   HG21  VAL  73          HG22      VAL  73   8.657 -15.101  -7.955
    9   HG23  VAL  73          HG23      VAL  73   9.768 -15.930  -6.865

  No H/Q in entry =           9
  In of MODEL   71
    1    H    LEU  74           H        LEU  74   7.191 -13.247  -8.583
    2    HA   LEU  74           HA       LEU  74   9.106 -11.269  -8.092
    3    HB2  LEU  74           HB2      LEU  74   8.668 -12.028 -10.329
    4    HB3  LEU  74           HB3      LEU  74   6.992 -11.489 -10.232
    5    HG   LEU  74           HG       LEU  74   7.760  -9.148 -10.017
    6   HD13  LEU  74          HD11      LEU  74   9.883  -9.312  -8.969
    7   HD12  LEU  74          HD12      LEU  74  10.252  -8.810 -10.617
    8   HD11  LEU  74          HD13      LEU  74  10.463 -10.495 -10.140
    9   HD21  LEU  74          HD21      LEU  74   7.527 -10.583 -12.236
   10   HD23  LEU  74          HD22      LEU  74   9.235 -10.222 -12.338
   11   HD22  LEU  74          HD23      LEU  74   8.079  -8.910 -12.276

  No H/Q in entry =          11
  In of MODEL   71
    1    H    VAL  75           H        VAL  75   5.606 -10.937  -8.452
    2    HA   VAL  75           HA       VAL  75   5.468  -8.181  -7.872
    3    HB   VAL  75           HB       VAL  75   3.409 -10.355  -7.483
    4   HG11  VAL  75          HG11      VAL  75   3.165  -7.317  -7.346
    5   HG13  VAL  75          HG12      VAL  75   2.902  -8.443  -6.023
    6   HG12  VAL  75          HG13      VAL  75   1.803  -8.430  -7.393
    7   HG23  VAL  75          HG21      VAL  75   2.495  -9.353  -9.571
    8   HG22  VAL  75          HG22      VAL  75   4.122  -9.985  -9.809
    9   HG21  VAL  75          HG23      VAL  75   3.868  -8.249  -9.628

  No H/Q in entry =           9
  In of MODEL   71
    1    H    GLU  76           H        GLU  76   5.252 -11.057  -5.756
    2    HA   GLU  76           HA       GLU  76   4.757  -9.697  -3.339
    3    HB2  GLU  76           HB2      GLU  76   4.618 -12.166  -3.565
    4    HB3  GLU  76           HB3      GLU  76   6.355 -12.241  -3.804
    5    HG2  GLU  76           HG2      GLU  76   5.918 -12.822  -1.505
    6    HG3  GLU  76           HG3      GLU  76   6.646 -11.227  -1.499

  No H/Q in entry =           6
  In of MODEL   71
    1    H    ALA  77           H        ALA  77   7.833 -10.562  -4.893
    2    HA   ALA  77           HA       ALA  77   9.502  -9.489  -2.876
    3    HB1  ALA  77           HB1      ALA  77  10.249 -11.037  -4.696
    4    HB2  ALA  77           HB2      ALA  77  11.280  -9.618  -4.508
    5    HB3  ALA  77           HB3      ALA  77  10.118  -9.693  -5.832

  No H/Q in entry =           5
  In of MODEL   71
    1    H    GLN  78           H        GLN  78   8.096  -8.099  -5.796
    2    HA   GLN  78           HA       GLN  78   9.412  -5.600  -5.695
    3    HB2  GLN  78           HB2      GLN  78   8.137  -6.535  -7.655
    4    HB3  GLN  78           HB3      GLN  78   6.645  -6.184  -6.783
    5    HG2  GLN  78           HG2      GLN  78   7.255  -3.802  -6.688
    6    HG3  GLN  78           HG3      GLN  78   8.751  -4.145  -7.557
    7   HE21  GLN  78          HE21      GLN  78   6.793  -2.358  -8.650
    8   HE22  GLN  78          HE22      GLN  78   6.123  -3.085 -10.031

  No H/Q in entry =           8
  In of MODEL   71
    1    H    LEU  79           H        LEU  79   6.406  -6.778  -4.270
    2    HA   LEU  79           HA       LEU  79   5.375  -4.383  -3.269
    3    HB2  LEU  79           HB2      LEU  79   4.090  -6.453  -3.212
    4    HB3  LEU  79           HB3      LEU  79   5.242  -7.173  -2.092
    5    HG   LEU  79           HG       LEU  79   4.661  -5.535  -0.371
    6   HD13  LEU  79          HD11      LEU  79   4.170  -3.530  -1.427
    7   HD12  LEU  79          HD12      LEU  79   2.551  -4.078  -0.992
    8   HD11  LEU  79          HD13      LEU  79   3.140  -4.296  -2.638
    9   HD23  LEU  79          HD21      LEU  79   2.082  -6.064  -0.287
   10   HD22  LEU  79          HD22      LEU  79   3.240  -7.387  -0.172
   11   HD21  LEU  79          HD23      LEU  79   2.426  -7.065  -1.700

  No H/Q in entry =          11
  In of MODEL   71
    1    H    HIS  80           H        HIS  80   7.586  -6.684  -1.674
    2    HA   HIS  80           HA       HIS  80   7.845  -5.132   0.692
    3    HB2  HIS  80           HB2      HIS  80   9.220  -7.480  -0.497
    4    HB3  HIS  80           HB3      HIS  80  10.114  -6.567   0.720
    5    HD1  HIS  80           HD1      HIS  80   9.625  -7.205   3.063
    6    HD2  HIS  80           HD2      HIS  80   6.428  -8.106   0.543
    7    HE1  HIS  80           HE1      HIS  80   7.864  -8.329   4.509
    8    HE2  HIS  80           HE2      HIS  80   5.909  -8.882   2.981

  No H/Q in entry =           8
  In of MODEL   71
    1    H    LEU  81           H        LEU  81   9.863  -5.387  -2.213
    2    HA   LEU  81           HA       LEU  81  11.880  -3.616  -1.332
    3    HB2  LEU  81           HB2      LEU  81  10.979  -4.428  -4.096
    4    HB3  LEU  81           HB3      LEU  81  12.384  -3.401  -3.804
    5    HG   LEU  81           HG       LEU  81  12.025  -6.125  -2.525
    6   HD12  LEU  81          HD11      LEU  81  13.855  -6.730  -4.267
    7   HD11  LEU  81          HD12      LEU  81  13.273  -5.316  -5.144
    8   HD13  LEU  81          HD13      LEU  81  12.178  -6.655  -4.807
    9   HD23  LEU  81          HD21      LEU  81  14.648  -5.774  -2.503
   10   HD22  LEU  81          HD22      LEU  81  13.652  -5.024  -1.258
   11   HD21  LEU  81          HD23      LEU  81  14.222  -4.067  -2.625

  No H/Q in entry =          11
  In of MODEL   71
    1    H    MET  82           H        MET  82   8.956  -3.023  -3.280
    2    HA   MET  82           HA       MET  82   9.461  -0.292  -3.786
    3    HB2  MET  82           HB2      MET  82   6.922  -1.919  -3.666
    4    HB3  MET  82           HB3      MET  82   6.900  -0.196  -4.034
    5    HG2  MET  82           HG2      MET  82   8.534  -2.251  -5.559
    6    HG3  MET  82           HG3      MET  82   6.960  -1.651  -6.078
    7    HE3  MET  82           HE1      MET  82   7.367   1.807  -7.257
    8    HE2  MET  82           HE2      MET  82   6.989   1.580  -5.551
    9    HE1  MET  82           HE3      MET  82   6.343   0.459  -6.745

  No H/Q in entry =           9
  In of MODEL   71
    1    H    THR  83           H        THR  83   7.681  -1.907  -1.183
    2    HA   THR  83           HA       THR  83   6.795   0.433   0.135
    3    HB   THR  83           HB       THR  83   6.674  -1.139   2.156
    4    HG1  THR  83           HG1      THR  83   7.457  -3.079   1.933
    5   HG22  THR  83          HG21      THR  83   5.046  -2.729   0.686
    6   HG21  THR  83          HG22      THR  83   5.260  -1.401  -0.449
    7   HG23  THR  83          HG23      THR  83   4.609  -1.090   1.162

  No H/Q in entry =           7
  In of MODEL   71
    1    H    SER  84           H        SER  84   9.644  -1.627   0.670
    2    HA   SER  84           HA       SER  84  10.677  -0.178   2.859
    3    HB2  SER  84           HB2      SER  84  11.961  -2.009   0.843
    4    HB3  SER  84           HB3      SER  84  12.893  -1.241   2.126
    5    HG   SER  84           HG       SER  84  10.639  -2.959   2.381

  No H/Q in entry =           5
  In of MODEL   71
    1    H    MET  85           H        MET  85  11.439   0.084  -0.627
    2    HA   MET  85           HA       MET  85  13.411   2.075  -0.374
    3    HB2  MET  85           HB2      MET  85  13.047   0.789  -2.439
    4    HB3  MET  85           HB3      MET  85  11.502   1.606  -2.673
    5    HG2  MET  85           HG2      MET  85  12.658   3.780  -2.793
    6    HG3  MET  85           HG3      MET  85  14.204   2.976  -2.538
    7    HE2  MET  85           HE1      MET  85  14.392   4.684  -4.908
    8    HE1  MET  85           HE2      MET  85  12.637   4.819  -4.951
    9    HE3  MET  85           HE3      MET  85  13.501   4.268  -6.380

  No H/Q in entry =           9
  In of MODEL   71
    1    H    LEU  86           H        LEU  86   9.919   2.365  -0.896
    2    HA   LEU  86           HA       LEU  86   9.821   5.176  -1.084
    3    HB2  LEU  86           HB2      LEU  86   8.000   3.493  -1.663
    4    HB3  LEU  86           HB3      LEU  86   7.665   3.403   0.066
    5    HG   LEU  86           HG       LEU  86   7.473   5.961   0.007
    6   HD11  LEU  86          HD11      LEU  86   8.263   5.529  -2.691
    7   HD13  LEU  86          HD12      LEU  86   7.806   7.052  -1.935
    8   HD12  LEU  86          HD13      LEU  86   6.584   6.073  -2.743
    9   HD23  LEU  86          HD21      LEU  86   5.362   4.579  -1.660
   10   HD22  LEU  86          HD22      LEU  86   5.152   5.839  -0.447
   11   HD21  LEU  86          HD23      LEU  86   5.569   4.201   0.051

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ALA  87           H        ALA  87   9.372   2.999   1.665
    2    HA   ALA  87           HA       ALA  87   8.793   4.910   3.628
    3    HB1  ALA  87           HB1      ALA  87   9.635   2.100   3.551
    4    HB3  ALA  87           HB2      ALA  87   8.497   2.901   4.631
    5    HB2  ALA  87           HB3      ALA  87  10.224   2.954   4.981

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ARG  88           H        ARG  88  11.897   3.521   2.661
    2    HA   ARG  88           HA       ARG  88  13.484   4.923   4.496
    3    HB2  ARG  88           HB2      ARG  88  14.181   2.955   3.099
    4    HB3  ARG  88           HB3      ARG  88  14.325   4.046   1.724
    5    HG2  ARG  88           HG2      ARG  88  15.775   5.382   3.673
    6    HG3  ARG  88           HG3      ARG  88  16.115   3.698   4.057
    7    HD2  ARG  88           HD2      ARG  88  17.392   3.412   2.215
    8    HD3  ARG  88           HD3      ARG  88  16.248   4.268   1.176
    9    HE   ARG  88           HE       ARG  88  18.626   5.363   2.229
   10   HH21  ARG  88          HH11      ARG  88  18.945   7.585   2.030
   11   HH22  ARG  88          HH12      ARG  88  17.582   8.640   1.880
   12   HH11  ARG  88          HH21      ARG  88  15.279   6.075   1.938
   13   HH12  ARG  88          HH22      ARG  88  15.504   7.782   1.803

  No H/Q in entry =          13
  In of MODEL   71
    1    H    GLU  89           H        GLU  89  12.511   5.801   1.167
    2    HA   GLU  89           HA       GLU  89  14.029   8.180   1.011
    3    HB2  GLU  89           HB2      GLU  89  12.904   7.121  -0.939
    4    HB3  GLU  89           HB3      GLU  89  11.351   7.644  -0.287
    5    HG2  GLU  89           HG2      GLU  89  12.025   9.990  -0.453
    6    HG3  GLU  89           HG3      GLU  89  13.636   9.517  -0.983

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LEU  90           H        LEU  90  10.703   7.632   2.131
    2    HA   LEU  90           HA       LEU  90  10.153  10.361   2.698
    3    HB2  LEU  90           HB2      LEU  90   8.986   7.775   3.727
    4    HB3  LEU  90           HB3      LEU  90   8.335   9.364   4.144
    5    HG   LEU  90           HG       LEU  90   8.773   8.482   1.279
    6   HD12  LEU  90          HD11      LEU  90   6.243   8.123   1.334
    7   HD11  LEU  90          HD12      LEU  90   6.392   8.119   3.091
    8   HD13  LEU  90          HD13      LEU  90   7.228   6.897   2.132
    9   HD22  LEU  90          HD21      LEU  90   8.451  10.787   1.199
   10   HD21  LEU  90          HD22      LEU  90   7.460  10.810   2.656
   11   HD23  LEU  90          HD23      LEU  90   6.774  10.243   1.134

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  91           H        ILE  91  11.442   7.699   4.630
    2    HA   ILE  91           HA       ILE  91  11.558   9.071   7.096
    3    HB   ILE  91           HB       ILE  91  13.144   6.750   5.982
    4   HG12  ILE  91          HG12      ILE  91  11.119   6.897   8.235
    5   HG13  ILE  91          HG13      ILE  91  10.657   6.607   6.559
    6   HG22  ILE  91          HG21      ILE  91  13.608   6.548   8.625
    7   HG21  ILE  91          HG22      ILE  91  13.511   8.305   8.520
    8   HG23  ILE  91          HG23      ILE  91  14.703   7.429   7.561
    9   HD13  ILE  91          HD11      ILE  91  11.685   4.517   6.497
   10   HD12  ILE  91          HD12      ILE  91  11.086   4.572   8.154
   11   HD11  ILE  91          HD13      ILE  91  12.785   4.905   7.821

  No H/Q in entry =          11
  In of MODEL   71
    1    H    THR  92           H        THR  92  13.785   8.923   4.351
    2    HA   THR  92           HA       THR  92  15.930  10.345   5.514
    3    HB   THR  92           HB       THR  92  14.954  10.202   2.651
    4    HG1  THR  92           HG1      THR  92  15.808   8.316   3.063
    5   HG22  THR  92          HG21      THR  92  17.517  10.923   2.363
    6   HG21  THR  92          HG22      THR  92  17.194  11.743   3.890
    7   HG23  THR  92          HG23      THR  92  16.223  12.116   2.466

  No H/Q in entry =           7
  In of MODEL   71
    1    H    GLU  93           H        GLU  93  13.034  11.459   3.774
    2    HA   GLU  93           HA       GLU  93  13.595  14.227   3.883
    3    HB2  GLU  93           HB2      GLU  93  10.908  12.822   3.892
    4    HB3  GLU  93           HB3      GLU  93  11.176  14.524   3.518
    5    HG2  GLU  93           HG2      GLU  93  12.546  12.295   1.999
    6    HG3  GLU  93           HG3      GLU  93  10.993  12.957   1.506

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LEU  94           H        LEU  94  11.872  12.055   6.094
    2    HA   LEU  94           HA       LEU  94  11.033  13.995   7.964
    3    HB2  LEU  94           HB2      LEU  94  11.645  11.048   8.246
    4    HB3  LEU  94           HB3      LEU  94  11.057  12.020   9.593
    5    HG   LEU  94           HG       LEU  94   9.580  12.048   6.959
    6   HD11  LEU  94          HD11      LEU  94   9.684   9.832   8.969
    7   HD13  LEU  94          HD12      LEU  94   9.388   9.763   7.233
    8   HD12  LEU  94          HD13      LEU  94   8.100  10.267   8.326
    9   HD23  LEU  94          HD21      LEU  94   7.651  12.427   8.553
   10   HD22  LEU  94          HD22      LEU  94   8.875  13.697   8.591
   11   HD21  LEU  94          HD23      LEU  94   8.823  12.482   9.868

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  95           H        ILE  95  14.031  12.102   7.740
    2    HA   ILE  95           HA       ILE  95  15.181  13.044  10.155
    3    HB   ILE  95           HB       ILE  95  16.440  11.984   7.613
    4   HG12  ILE  95          HG12      ILE  95  16.151  10.786  10.382
    5   HG13  ILE  95          HG13      ILE  95  14.991  10.511   9.084
    6   HG21  ILE  95          HG21      ILE  95  17.678  12.812  10.257
    7   HG23  ILE  95          HG22      ILE  95  18.138  13.342   8.638
    8   HG22  ILE  95          HG23      ILE  95  18.463  11.687   9.151
    9   HD13  ILE  95          HD11      ILE  95  16.490   9.247   7.828
   10   HD12  ILE  95          HD12      ILE  95  16.964   8.808   9.467
   11   HD11  ILE  95          HD13      ILE  95  17.905   9.997   8.568

  No H/Q in entry =          11
  In of MODEL   71
    1    H    GLU  96           H        GLU  96  15.329  14.272   6.818
    2    HA   GLU  96           HA       GLU  96  17.149  16.374   7.295
    3    HB2  GLU  96           HB2      GLU  96  16.499  15.698   5.036
    4    HB3  GLU  96           HB3      GLU  96  14.849  16.236   5.330
    5    HG2  GLU  96           HG2      GLU  96  15.390  18.371   4.785
    6    HG3  GLU  96           HG3      GLU  96  16.686  18.389   5.971

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LEU  97           H        LEU  97  13.639  16.145   7.716
    2    HA   LEU  97           HA       LEU  97  13.188  18.875   8.350
    3    HB2  LEU  97           HB2      LEU  97  11.699  16.332   8.966
    4    HB3  LEU  97           HB3      LEU  97  11.165  17.874   9.632
    5    HG   LEU  97           HG       LEU  97  11.661  17.457   6.670
    6   HD12  LEU  97          HD11      LEU  97   9.140  17.299   6.545
    7   HD11  LEU  97          HD12      LEU  97   9.131  17.103   8.296
    8   HD13  LEU  97          HD13      LEU  97   9.929  15.902   7.278
    9   HD23  LEU  97          HD21      LEU  97   9.900  19.400   6.693
   10   HD22  LEU  97          HD22      LEU  97  11.575  19.781   7.089
   11   HD21  LEU  97          HD23      LEU  97  10.385  19.599   8.376

  No H/Q in entry =          11
  In of MODEL   71
    1    H    HIS  98           H        HIS  98  14.038  16.063  10.354
    2    HA   HIS  98           HA       HIS  98  13.859  17.328  12.867
    3    HB2  HIS  98           HB2      HIS  98  15.638  15.089  11.875
    4    HB3  HIS  98           HB3      HIS  98  15.626  15.631  13.555
    5    HD1  HIS  98           HD1      HIS  98  13.453  13.970  10.961
    6    HD2  HIS  98           HD2      HIS  98  13.324  14.897  15.023
    7    HE1  HIS  98           HE1      HIS  98  11.440  12.753  11.911
    8    HE2  HIS  98           HE2      HIS  98  11.342  13.309  14.380

  No H/Q in entry =           8
  In of MODEL   71
    1    H    GLU  99           H        GLU  99  16.420  17.238  10.439
    2    HA   GLU  99           HA       GLU  99  18.385  18.596  11.971
    3    HB2  GLU  99           HB2      GLU  99  18.885  17.310   9.906
    4    HB3  GLU  99           HB3      GLU  99  18.063  18.553   8.960
    5    HG2  GLU  99           HG2      GLU  99  19.649  20.245   9.751
    6    HG3  GLU  99           HG3      GLU  99  20.439  19.054  10.779

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LYS 100           H        LYS 100  15.853  19.724   9.745
    2    HA   LYS 100           HA       LYS 100  16.618  22.471   9.885
    3    HB2  LYS 100           HB2      LYS 100  14.003  21.149   9.127
    4    HB3  LYS 100           HB3      LYS 100  14.282  22.891   9.033
    5    HG2  LYS 100           HG2      LYS 100  16.263  22.462   7.572
    6    HG3  LYS 100           HG3      LYS 100  15.870  20.741   7.593
    7    HD2  LYS 100           HD2      LYS 100  13.671  21.222   6.586
    8    HD3  LYS 100           HD3      LYS 100  14.048  22.946   6.573
    9    HE2  LYS 100           HE2      LYS 100  16.016  22.485   5.119
   10    HE3  LYS 100           HE3      LYS 100  15.571  20.775   5.088
   11    HZ1  LYS 100           HZ1      LYS 100  13.723  22.944   4.244
   12    HZ3  LYS 100           HZ2      LYS 100  13.558  21.272   3.985
   13    HZ2  LYS 100           HZ3      LYS 100  14.761  22.147   3.165

  No H/Q in entry =          13
  In of MODEL   71
    1    H    LEU 101           H        LEU 101  14.540  20.405  11.849
    2    HA   LEU 101           HA       LEU 101  13.345  22.462  13.420
    3    HB2  LEU 101           HB2      LEU 101  13.820  19.519  13.812
    4    HB3  LEU 101           HB3      LEU 101  13.270  20.496  15.169
    5    HG   LEU 101           HG       LEU 101  11.858  20.562  12.496
    6   HD12  LEU 101          HD11      LEU 101  10.213  18.982  13.764
    7   HD11  LEU 101          HD12      LEU 101  11.610  18.587  14.763
    8   HD13  LEU 101          HD13      LEU 101  11.651  18.277  13.027
    9   HD21  LEU 101          HD21      LEU 101  11.184  21.353  15.345
   10   HD23  LEU 101          HD22      LEU 101   9.929  21.111  14.132
   11   HD22  LEU 101          HD23      LEU 101  11.150  22.359  13.895

  No H/Q in entry =          11
  In of MODEL   71
    1    H    LYS 102           H        LYS 102  16.501  21.890  12.993
    2    HA   LYS 102           HA       LYS 102  18.334  22.784  14.068
    3    HB2  LYS 102           HB2      LYS 102  16.500  24.280  15.194
    4    HB3  LYS 102           HB3      LYS 102  16.716  23.223  16.574
    5    HG2  LYS 102           HG2      LYS 102  18.589  25.253  15.405
    6    HG3  LYS 102           HG3      LYS 102  18.206  24.938  17.084
    7    HD2  LYS 102           HD2      LYS 102  19.899  23.041  15.406
    8    HD3  LYS 102           HD3      LYS 102  20.571  24.373  16.338
    9    HE2  LYS 102           HE2      LYS 102  20.199  21.822  17.311
   10    HE3  LYS 102           HE3      LYS 102  20.399  23.268  18.300
   11    HZ2  LYS 102           HZ1      LYS 102  18.443  21.963  18.915
   12    HZ1  LYS 102           HZ2      LYS 102  17.801  22.183  17.364
   13    HZ3  LYS 102           HZ3      LYS 102  18.013  23.517  18.388

  No H/Q in entry =          13
  In of MODEL   71
    1    H    ALA 103           H        ALA 103  16.275  21.160  16.488
    2    HA   ALA 103           HA       ALA 103  18.011  19.972  18.150
    3    HB2  ALA 103           HB1      ALA 103  16.450  17.947  18.145
    4    HB1  ALA 103           HB2      ALA 103  15.548  18.788  16.883
    5    HB3  ALA 103           HB3      ALA 103  15.714  19.514  18.481

  No H/Q in entry =           5
  In of MODEL   71
    1    H1   ALA   1           H3       ALA   1  -1.514  -7.184 -21.465
    2    H2   ALA   1           H2       ALA   1  -2.294  -8.627 -21.011
    3    H3   ALA   1           H1       ALA   1  -0.684  -8.660 -21.562
    4    HA   ALA   1           HA       ALA   1  -1.508  -9.143 -23.560
    5    HB1  ALA   1           HB1      ALA   1  -3.638  -9.883 -23.090
    6    HB2  ALA   1           HB2      ALA   1  -4.091  -8.379 -23.892
    7    HB3  ALA   1           HB3      ALA   1  -4.034  -8.455 -22.133

  No H/Q in entry =           7
  In of MODEL   71
    1    H    GLU   2           H        GLU   2  -2.345  -7.965 -25.553
    2    HA   GLU   2           HA       GLU   2  -0.966  -5.938 -26.431
    3    HB2  GLU   2           HB2      GLU   2  -3.971  -6.038 -26.757
    4    HB3  GLU   2           HB3      GLU   2  -2.857  -5.165 -27.805
    5    HG2  GLU   2           HG2      GLU   2  -2.330  -7.051 -28.955
    6    HG3  GLU   2           HG3      GLU   2  -2.027  -7.951 -27.475

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLU   3           H        GLU   3  -4.142  -4.713 -25.542
    2    HA   GLU   3           HA       GLU   3  -3.125  -2.145 -24.916
    3    HB2  GLU   3           HB2      GLU   3  -5.799  -3.488 -24.588
    4    HB3  GLU   3           HB3      GLU   3  -5.521  -1.868 -23.944
    5    HG2  GLU   3           HG2      GLU   3  -5.168  -0.942 -26.071
    6    HG3  GLU   3           HG3      GLU   3  -4.755  -2.494 -26.792

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LEU   4           H        LEU   4  -4.696  -4.517 -22.736
    2    HA   LEU   4           HA       LEU   4  -4.351  -3.281 -20.346
    3    HB2  LEU   4           HB2      LEU   4  -3.775  -6.217 -20.809
    4    HB3  LEU   4           HB3      LEU   4  -4.193  -5.472 -19.267
    5    HG   LEU   4           HG       LEU   4  -5.958  -5.569 -21.736
    6   HD13  LEU   4          HD11      LEU   4  -7.136  -7.298 -20.738
    7   HD12  LEU   4          HD12      LEU   4  -6.660  -6.830 -19.107
    8   HD11  LEU   4          HD13      LEU   4  -5.513  -7.663 -20.154
    9   HD23  LEU   4          HD21      LEU   4  -7.657  -4.773 -19.874
   10   HD22  LEU   4          HD22      LEU   4  -6.629  -3.592 -20.684
   11   HD21  LEU   4          HD23      LEU   4  -6.201  -4.175 -19.076

  No H/Q in entry =          11
  In of MODEL   71
    1    H    GLU   5           H        GLU   5  -1.829  -5.100 -22.067
    2    HA   GLU   5           HA       GLU   5   0.146  -4.791 -20.025
    3    HB2  GLU   5           HB2      GLU   5   0.235  -6.564 -21.774
    4    HB3  GLU   5           HB3      GLU   5   0.538  -5.319 -22.985
    5    HG2  GLU   5           HG2      GLU   5   2.593  -4.654 -21.818
    6    HG3  GLU   5           HG3      GLU   5   2.287  -5.857 -20.565

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLU   6           H        GLU   6  -0.499  -3.090 -23.075
    2    HA   GLU   6           HA       GLU   6   1.651  -1.235 -22.804
    3    HB2  GLU   6           HB2      GLU   6  -0.908  -1.165 -24.418
    4    HB3  GLU   6           HB3      GLU   6   0.346   0.070 -24.527
    5    HG2  GLU   6           HG2      GLU   6   1.986  -1.598 -25.217
    6    HG3  GLU   6           HG3      GLU   6   0.803  -2.887 -25.007

  No H/Q in entry =           6
  In of MODEL   71
    1    H    VAL   7           H        VAL   7  -1.690  -1.340 -21.768
    2    HA   VAL   7           HA       VAL   7  -1.942   1.372 -20.937
    3    HB   VAL   7           HB       VAL   7  -3.380  -1.160 -20.101
    4   HG11  VAL   7          HG11      VAL   7  -3.788   1.726 -19.293
    5   HG13  VAL   7          HG12      VAL   7  -3.676   0.304 -18.255
    6   HG12  VAL   7          HG13      VAL   7  -5.109   0.557 -19.251
    7   HG21  VAL   7          HG21      VAL   7  -3.542  -0.090 -22.491
    8   HG23  VAL   7          HG22      VAL   7  -4.503   1.150 -21.684
    9   HG22  VAL   7          HG23      VAL   7  -5.031  -0.533 -21.656

  No H/Q in entry =           9
  In of MODEL   71
    1    H    VAL   8           H        VAL   8  -0.928  -1.600 -19.286
    2    HA   VAL   8           HA       VAL   8  -0.628  -0.512 -16.692
    3    HB   VAL   8           HB       VAL   8   0.727  -2.839 -18.071
    4   HG11  VAL   8          HG11      VAL   8   1.087  -1.675 -15.321
    5   HG13  VAL   8          HG12      VAL   8   2.303  -2.318 -16.424
    6   HG12  VAL   8          HG13      VAL   8   1.233  -3.416 -15.555
    7   HG23  VAL   8          HG21      VAL   8  -1.212  -2.987 -15.749
    8   HG22  VAL   8          HG22      VAL   8  -0.880  -4.185 -16.996
    9   HG21  VAL   8          HG23      VAL   8  -1.834  -2.758 -17.382

  No H/Q in entry =           9
  In of MODEL   71
    1    H    MET   9           H        MET   9   1.631  -0.794 -19.432
    2    HA   MET   9           HA       MET   9   3.903   0.275 -18.167
    3    HB2  MET   9           HB2      MET   9   2.956   0.229 -21.024
    4    HB3  MET   9           HB3      MET   9   4.424   1.099 -20.578
    5    HG2  MET   9           HG2      MET   9   5.140  -1.077 -19.395
    6    HG3  MET   9           HG3      MET   9   3.845  -1.852 -20.310
    7    HE3  MET   9           HE1      MET   9   4.786  -1.867 -23.862
    8    HE2  MET   9           HE2      MET   9   3.772  -0.590 -23.197
    9    HE1  MET   9           HE3      MET   9   3.652  -2.225 -22.554

  No H/Q in entry =           9
  In of MODEL   71
    1    H    GLY  10           H        GLY  10   1.207   1.847 -19.854
    2    HA3  GLY  10           HA2      GLY  10   2.143   4.510 -19.612
    3    HA2  GLY  10           HA3      GLY  10   0.459   4.033 -19.820

  No H/Q in entry =           3
  In of MODEL   71
    1    H    LEU  11           H        LEU  11   0.069   2.506 -17.532
    2    HA   LEU  11           HA       LEU  11  -0.485   4.480 -15.577
    3    HB2  LEU  11           HB2      LEU  11  -0.389   1.466 -15.416
    4    HB3  LEU  11           HB3      LEU  11  -0.911   2.486 -14.076
    5    HG   LEU  11           HG       LEU  11  -2.144   2.583 -16.843
    6   HD13  LEU  11          HD11      LEU  11  -2.709   0.436 -16.085
    7   HD12  LEU  11          HD12      LEU  11  -4.070   1.415 -15.545
    8   HD11  LEU  11          HD13      LEU  11  -2.812   0.949 -14.401
    9   HD22  LEU  11          HD21      LEU  11  -2.757   4.595 -15.841
   10   HD21  LEU  11          HD22      LEU  11  -2.679   3.932 -14.209
   11   HD23  LEU  11          HD23      LEU  11  -4.048   3.551 -15.253

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  12           H        ILE  12   2.082   2.038 -15.810
    2    HA   ILE  12           HA       ILE  12   3.276   2.591 -13.304
    3    HB   ILE  12           HB       ILE  12   4.546   1.559 -15.862
    4   HG12  ILE  12          HG12      ILE  12   2.542   0.311 -14.720
    5   HG13  ILE  12          HG13      ILE  12   3.951  -0.613 -15.202
    6   HG22  ILE  12          HG21      ILE  12   6.241   0.567 -14.295
    7   HG21  ILE  12          HG22      ILE  12   5.515   1.496 -12.984
    8   HG23  ILE  12          HG23      ILE  12   6.274   2.328 -14.340
    9   HD11  ILE  12          HD11      ILE  12   3.479   0.491 -12.421
   10   HD13  ILE  12          HD12      ILE  12   4.771  -0.599 -12.918
   11   HD12  ILE  12          HD13      ILE  12   3.111  -1.152 -12.911

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  13           H        ILE  13   3.873   3.855 -16.562
    2    HA   ILE  13           HA       ILE  13   5.993   5.596 -15.836
    3    HB   ILE  13           HB       ILE  13   3.967   5.649 -18.086
    4   HG12  ILE  13          HG12      ILE  13   5.804   3.826 -17.820
    5   HG13  ILE  13          HG13      ILE  13   5.599   4.595 -19.389
    6   HG21  ILE  13          HG21      ILE  13   6.061   7.627 -17.334
    7   HG23  ILE  13          HG22      ILE  13   4.556   7.872 -18.213
    8   HG22  ILE  13          HG23      ILE  13   5.960   7.208 -19.046
    9   HD12  ILE  13          HD11      ILE  13   8.020   4.365 -18.195
   10   HD11  ILE  13          HD12      ILE  13   7.501   5.902 -17.511
   11   HD13  ILE  13          HD13      ILE  13   7.605   5.709 -19.257

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ASN  14           H        ASN  14   2.482   6.057 -16.111
    2    HA   ASN  14           HA       ASN  14   2.412   8.804 -15.479
    3    HB2  ASN  14           HB2      ASN  14   0.536   7.143 -16.311
    4    HB3  ASN  14           HB3      ASN  14   0.213   6.964 -14.591
    5   HD21  ASN  14          HD21      ASN  14  -1.814   8.099 -16.029
    6   HD22  ASN  14          HD22      ASN  14  -1.893   9.772 -15.765

  No H/Q in entry =           6
  In of MODEL   71
    1    H    SER  15           H        SER  15   2.140   5.928 -13.398
    2    HA   SER  15           HA       SER  15   1.815   7.299 -10.953
    3    HB2  SER  15           HB2      SER  15   2.383   5.221  -9.899
    4    HB3  SER  15           HB3      SER  15   1.560   4.791 -11.394
    5    HG   SER  15           HG       SER  15   4.212   4.498 -10.661

  No H/Q in entry =           5
  In of MODEL   71
    1    H    GLY  16           H        GLY  16   4.705   6.227 -12.704
    2    HA3  GLY  16           HA2      GLY  16   6.619   7.006 -10.771
    3    HA2  GLY  16           HA3      GLY  16   6.927   6.803 -12.494

  No H/Q in entry =           3
  In of MODEL   71
    1    H    GLN  17           H        GLN  17   5.221   8.743 -13.563
    2    HA   GLN  17           HA       GLN  17   6.774  11.100 -13.256
    3    HB2  GLN  17           HB2      GLN  17   4.040  10.624 -14.471
    4    HB3  GLN  17           HB3      GLN  17   4.855  12.187 -14.523
    5    HG2  GLN  17           HG2      GLN  17   6.776  11.156 -15.673
    6    HG3  GLN  17           HG3      GLN  17   5.968   9.590 -15.620
    7   HE21  GLN  17          HE21      GLN  17   4.210   9.214 -17.110
    8   HE22  GLN  17          HE22      GLN  17   3.830  10.310 -18.350

  No H/Q in entry =           8
  In of MODEL   71
    1    H    ALA  18           H        ALA  18   3.681  10.053 -11.911
    2    HA   ALA  18           HA       ALA  18   2.929  12.436 -10.651
    3    HB1  ALA  18           HB1      ALA  18   1.826   9.967 -10.871
    4    HB2  ALA  18           HB2      ALA  18   1.262  11.183  -9.728
    5    HB3  ALA  18           HB3      ALA  18   2.365   9.913  -9.193

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ARG  19           H        ARG  19   4.829   9.695  -9.363
    2    HA   ARG  19           HA       ARG  19   5.344  10.863  -6.842
    3    HB2  ARG  19           HB2      ARG  19   5.785   8.464  -7.364
    4    HB3  ARG  19           HB3      ARG  19   7.138   8.963  -8.384
    5    HG2  ARG  19           HG2      ARG  19   8.242  10.018  -6.461
    6    HG3  ARG  19           HG3      ARG  19   6.869   9.617  -5.431
    7    HD2  ARG  19           HD2      ARG  19   8.648   8.001  -5.067
    8    HD3  ARG  19           HD3      ARG  19   7.284   7.203  -5.854
    9    HE   ARG  19           HE       ARG  19   8.983   8.037  -7.899
   10   HH21  ARG  19          HH11      ARG  19  10.561   6.648  -8.744
   11   HH22  ARG  19          HH12      ARG  19  11.119   5.307  -7.805
   12   HH11  ARG  19          HH21      ARG  19   9.072   6.012  -5.117
   13   HH12  ARG  19          HH22      ARG  19  10.273   4.947  -5.751

  No H/Q in entry =          13
  In of MODEL   71
    1    H    SER  20           H        SER  20   7.167  10.908  -9.888
    2    HA   SER  20           HA       SER  20   9.394  12.350  -9.062
    3    HB2  SER  20           HB2      SER  20   9.439  11.470 -11.264
    4    HB3  SER  20           HB3      SER  20   7.933  12.271 -11.696
    5    HG   SER  20           HG       SER  20   9.173  14.275 -11.227

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LEU  21           H        LEU  21   6.284  13.581 -10.267
    2    HA   LEU  21           HA       LEU  21   6.922  16.335 -10.046
    3    HB2  LEU  21           HB2      LEU  21   4.271  14.878  -9.972
    4    HB3  LEU  21           HB3      LEU  21   4.415  16.635  -9.973
    5    HG   LEU  21           HG       LEU  21   5.640  14.858 -12.104
    6   HD12  LEU  21          HD11      LEU  21   3.027  16.403 -12.160
    7   HD11  LEU  21          HD12      LEU  21   3.178  14.647 -12.094
    8   HD13  LEU  21          HD13      LEU  21   3.734  15.525 -13.517
    9   HD21  LEU  21          HD21      LEU  21   5.373  17.827 -11.674
   10   HD23  LEU  21          HD22      LEU  21   5.380  17.215 -13.325
   11   HD22  LEU  21          HD23      LEU  21   6.759  16.923 -12.278

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ALA  22           H        ALA  22   5.432  14.031  -7.797
    2    HA   ALA  22           HA       ALA  22   4.803  15.835  -5.735
    3    HB3  ALA  22           HB1      ALA  22   4.072  13.434  -5.895
    4    HB2  ALA  22           HB2      ALA  22   4.651  13.916  -4.300
    5    HB1  ALA  22           HB3      ALA  22   5.688  12.968  -5.367

  No H/Q in entry =           5
  In of MODEL   71
    1    H    TYR  23           H        TYR  23   7.763  13.845  -6.164
    2    HA   TYR  23           HA       TYR  23   9.128  14.885  -3.910
    3    HB2  TYR  23           HB2      TYR  23   9.942  12.885  -5.063
    4    HB3  TYR  23           HB3      TYR  23  10.248  13.825  -6.523
    5    HD1  TYR  23           HD1      TYR  23  11.211  13.491  -2.933
    6    HD2  TYR  23           HD2      TYR  23  12.264  15.033  -6.802
    7    HE1  TYR  23           HE1      TYR  23  13.460  14.098  -2.080
    8    HE2  TYR  23           HE2      TYR  23  14.512  15.641  -5.948
    9    HH   TYR  23           HH       TYR  23  15.504  14.815  -2.635

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ALA  24           H        ALA  24   8.938  15.984  -7.279
    2    HA   ALA  24           HA       ALA  24  10.807  18.094  -7.032
    3    HB2  ALA  24           HB1      ALA  24  10.368  18.146  -9.242
    4    HB3  ALA  24           HB2      ALA  24   8.802  18.876  -8.887
    5    HB1  ALA  24           HB3      ALA  24   8.951  17.125  -9.014

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ALA  25           H        ALA  25   7.329  17.865  -6.418
    2    HA   ALA  25           HA       ALA  25   6.812  20.577  -5.855
    3    HB1  ALA  25           HB1      ALA  25   5.178  18.557  -6.055
    4    HB2  ALA  25           HB2      ALA  25   4.791  19.842  -4.910
    5    HB3  ALA  25           HB3      ALA  25   5.500  18.332  -4.335

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LEU  26           H        LEU  26   7.912  17.916  -3.798
    2    HA   LEU  26           HA       LEU  26   7.993  19.353  -1.363
    3    HB2  LEU  26           HB2      LEU  26   8.121  16.938  -1.353
    4    HB3  LEU  26           HB3      LEU  26   9.593  16.964  -2.321
    5    HG   LEU  26           HG       LEU  26  10.789  18.102  -0.480
    6   HD12  LEU  26          HD11      LEU  26   9.558  18.097   1.777
    7   HD11  LEU  26          HD12      LEU  26   8.074  17.937   0.840
    8   HD13  LEU  26          HD13      LEU  26   9.100  19.357   0.630
    9   HD21  LEU  26          HD21      LEU  26   9.288  15.615   0.395
   10   HD23  LEU  26          HD22      LEU  26  10.794  16.199   1.094
   11   HD22  LEU  26          HD23      LEU  26  10.759  15.637  -0.575

  No H/Q in entry =          11
  In of MODEL   71
    1    H    LYS  27           H        LYS  27  10.422  18.809  -3.882
    2    HA   LYS  27           HA       LYS  27  12.586  20.083  -2.652
    3    HB2  LYS  27           HB2      LYS  27  12.711  18.733  -4.739
    4    HB3  LYS  27           HB3      LYS  27  11.929  20.053  -5.609
    5    HG2  LYS  27           HG2      LYS  27  13.772  21.566  -5.030
    6    HG3  LYS  27           HG3      LYS  27  14.549  20.286  -4.090
    7    HD2  LYS  27           HD2      LYS  27  14.716  18.897  -6.141
    8    HD3  LYS  27           HD3      LYS  27  13.984  20.203  -7.073
    9    HE2  LYS  27           HE2      LYS  27  15.849  21.697  -6.460
   10    HE3  LYS  27           HE3      LYS  27  16.585  20.395  -5.518
   11    HZ3  LYS  27           HZ1      LYS  27  17.577  20.505  -7.703
   12    HZ2  LYS  27           HZ2      LYS  27  16.054  20.363  -8.446
   13    HZ1  LYS  27           HZ3      LYS  27  16.694  19.063  -7.558

  No H/Q in entry =          13
  In of MODEL   71
    1    H    GLN  28           H        GLN  28   9.948  21.423  -4.609
    2    HA   GLN  28           HA       GLN  28  10.869  24.089  -4.765
    3    HB2  GLN  28           HB2      GLN  28   8.051  22.980  -4.655
    4    HB3  GLN  28           HB3      GLN  28   8.442  24.656  -5.037
    5    HG2  GLN  28           HG2      GLN  28   9.483  22.254  -6.568
    6    HG3  GLN  28           HG3      GLN  28   8.124  23.255  -7.077
    7   HE21  GLN  28          HE21      GLN  28  11.266  22.828  -7.820
    8   HE22  GLN  28          HE22      GLN  28  11.717  24.421  -8.194

  No H/Q in entry =           8
  In of MODEL   71
    1    H    ALA  29           H        ALA  29   8.958  22.373  -2.329
    2    HA   ALA  29           HA       ALA  29   8.373  24.560  -0.653
    3    HB2  ALA  29           HB1      ALA  29   7.664  22.984   0.917
    4    HB1  ALA  29           HB2      ALA  29   8.904  21.817   0.457
    5    HB3  ALA  29           HB3      ALA  29   7.515  22.088  -0.595

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LYS  30           H        LYS  30  11.137  22.334  -0.713
    2    HA   LYS  30           HA       LYS  30  12.436  23.312   1.591
    3    HB2  LYS  30           HB2      LYS  30  13.556  22.037  -0.915
    4    HB3  LYS  30           HB3      LYS  30  14.530  22.414   0.508
    5    HG2  LYS  30           HG2      LYS  30  12.995  21.010   1.887
    6    HG3  LYS  30           HG3      LYS  30  12.119  20.573   0.417
    7    HD2  LYS  30           HD2      LYS  30  14.180  19.615  -0.539
    8    HD3  LYS  30           HD3      LYS  30  15.075  20.067   0.914
    9    HE2  LYS  30           HE2      LYS  30  13.589  18.616   2.269
   10    HE3  LYS  30           HE3      LYS  30  12.725  18.145   0.800
   11    HZ2  LYS  30           HZ1      LYS  30  14.538  16.595   1.567
   12    HZ1  LYS  30           HZ2      LYS  30  15.658  17.798   1.116
   13    HZ3  LYS  30           HZ3      LYS  30  14.635  17.096  -0.050

  No H/Q in entry =          13
  In of MODEL   71
    1    H    GLN  31           H        GLN  31  12.315  24.508  -1.709
    2    HA   GLN  31           HA       GLN  31  14.438  26.434  -1.287
    3    HB2  GLN  31           HB2      GLN  31  12.399  26.446  -3.515
    4    HB3  GLN  31           HB3      GLN  31  14.008  27.166  -3.515
    5    HG2  GLN  31           HG2      GLN  31  14.510  24.478  -2.933
    6    HG3  GLN  31           HG3      GLN  31  13.209  24.402  -4.114
    7   HE21  GLN  31          HE21      GLN  31  16.065  23.651  -4.511
    8   HE22  GLN  31          HE22      GLN  31  16.625  24.630  -5.778

  No H/Q in entry =           8
  In of MODEL   71
    1    H    GLY  32           H        GLY  32  11.365  26.208  -0.147
    2    HA3  GLY  32           HA2      GLY  32  10.183  27.761   1.121
    3    HA2  GLY  32           HA3      GLY  32  11.291  29.012   0.571

  No H/Q in entry =           3
  In of MODEL   71
    1    H    ASP  33           H        ASP  33   9.960  27.083  -1.920
    2    HA   ASP  33           HA       ASP  33   8.263  29.329  -2.783
    3    HB2  ASP  33           HB2      ASP  33   9.395  26.924  -4.219
    4    HB3  ASP  33           HB3      ASP  33   8.228  28.020  -4.954

  No H/Q in entry =           4
  In of MODEL   71
    1    H    PHE  34           H        PHE  34   6.579  28.831  -1.222
    2    HA   PHE  34           HA       PHE  34   5.237  26.339  -1.124
    3    HB2  PHE  34           HB2      PHE  34   4.233  29.112  -0.451
    4    HB3  PHE  34           HB3      PHE  34   3.406  27.610  -0.038
    5    HD1  PHE  34           HD1      PHE  34   5.617  30.044   1.175
    6    HD2  PHE  34           HD2      PHE  34   5.001  25.794   1.129
    7    HE1  PHE  34           HE1      PHE  34   7.008  29.819   3.215
    8    HE2  PHE  34           HE2      PHE  34   6.393  25.572   3.167
    9    HZ   PHE  34           HZ       PHE  34   7.391  27.586   4.209

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ALA  35           H        ALA  35   4.767  29.192  -3.141
    2    HA   ALA  35           HA       ALA  35   2.227  28.537  -4.169
    3    HB3  ALA  35           HB1      ALA  35   3.261  29.941  -6.208
    4    HB2  ALA  35           HB2      ALA  35   4.471  30.323  -4.983
    5    HB1  ALA  35           HB3      ALA  35   2.774  30.707  -4.696

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ALA  36           H        ALA  36   5.468  27.910  -5.517
    2    HA   ALA  36           HA       ALA  36   4.504  26.461  -7.759
    3    HB3  ALA  36           HB1      ALA  36   6.662  26.617  -8.371
    4    HB2  ALA  36           HB2      ALA  36   7.157  25.598  -7.018
    5    HB1  ALA  36           HB3      ALA  36   7.024  27.345  -6.806

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ALA  37           H        ALA  37   5.469  25.488  -4.500
    2    HA   ALA  37           HA       ALA  37   5.454  22.698  -4.924
    3    HB2  ALA  37           HB1      ALA  37   5.161  24.490  -2.550
    4    HB1  ALA  37           HB2      ALA  37   6.315  23.189  -2.837
    5    HB3  ALA  37           HB3      ALA  37   4.658  22.811  -2.369

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LYS  38           H        LYS  38   2.885  24.870  -3.765
    2    HA   LYS  38           HA       LYS  38   0.814  23.026  -3.542
    3    HB2  LYS  38           HB2      LYS  38   1.123  25.787  -3.296
    4    HB3  LYS  38           HB3      LYS  38  -0.072  25.619  -4.577
    5    HG2  LYS  38           HG2      LYS  38  -1.504  24.277  -3.134
    6    HG3  LYS  38           HG3      LYS  38  -0.261  24.238  -1.876
    7    HD2  LYS  38           HD2      LYS  38  -0.483  26.573  -1.433
    8    HD3  LYS  38           HD3      LYS  38  -1.397  26.845  -2.918
    9    HE2  LYS  38           HE2      LYS  38  -2.904  26.860  -0.981
   10    HE3  LYS  38           HE3      LYS  38  -3.255  25.476  -2.021
   11    HZ3  LYS  38           HZ1      LYS  38  -2.510  24.020  -0.484
   12    HZ2  LYS  38           HZ2      LYS  38  -2.882  25.273   0.603
   13    HZ1  LYS  38           HZ3      LYS  38  -1.283  25.046   0.081

  No H/Q in entry =          13
  In of MODEL   71
    1    H    ALA  39           H        ALA  39   1.769  24.937  -6.393
    2    HA   ALA  39           HA       ALA  39  -0.290  24.035  -8.098
    3    HB2  ALA  39           HB1      ALA  39   2.438  24.723  -9.148
    4    HB1  ALA  39           HB2      ALA  39   1.451  25.971  -8.387
    5    HB3  ALA  39           HB3      ALA  39   0.854  25.121  -9.813

  No H/Q in entry =           5
  In of MODEL   71
    1    H    MET  40           H        MET  40   2.966  22.787  -7.510
    2    HA   MET  40           HA       MET  40   2.903  20.761  -9.498
    3    HB2  MET  40           HB2      MET  40   4.507  21.015  -6.947
    4    HB3  MET  40           HB3      MET  40   4.779  19.760  -8.158
    5    HG2  MET  40           HG2      MET  40   4.792  22.716  -8.829
    6    HG3  MET  40           HG3      MET  40   6.251  21.836  -8.376
    7    HE3  MET  40           HE1      MET  40   7.162  19.629 -11.178
    8    HE2  MET  40           HE2      MET  40   6.601  19.304  -9.541
    9    HE1  MET  40           HE3      MET  40   7.676  20.668  -9.842

  No H/Q in entry =           9
  In of MODEL   71
    1    H    MET  41           H        MET  41   1.982  20.796  -6.075
    2    HA   MET  41           HA       MET  41   1.491  18.024  -5.793
    3    HB2  MET  41           HB2      MET  41   0.120  20.364  -4.449
    4    HB3  MET  41           HB3      MET  41  -0.011  18.685  -3.938
    5    HG2  MET  41           HG2      MET  41   2.696  18.950  -3.971
    6    HG3  MET  41           HG3      MET  41   2.229  20.602  -3.579
    7    HE2  MET  41           HE1      MET  41  -0.794  19.305  -1.857
    8    HE1  MET  41           HE2      MET  41   0.000  20.830  -2.236
    9    HE3  MET  41           HE3      MET  41  -0.053  20.262  -0.567

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ASP  42           H        ASP  42  -0.587  20.715  -6.776
    2    HA   ASP  42           HA       ASP  42  -3.006  19.316  -6.914
    3    HB2  ASP  42           HB2      ASP  42  -2.339  21.897  -7.175
    4    HB3  ASP  42           HB3      ASP  42  -2.481  21.496  -8.883

  No H/Q in entry =           4
  In of MODEL   71
    1    H    GLN  43           H        GLN  43  -0.571  19.940  -9.413
    2    HA   GLN  43           HA       GLN  43  -1.933  18.595 -11.502
    3    HB2  GLN  43           HB2      GLN  43   1.016  19.159 -11.116
    4    HB3  GLN  43           HB3      GLN  43   0.315  18.505 -12.599
    5    HG2  GLN  43           HG2      GLN  43  -1.228  20.508 -12.647
    6    HG3  GLN  43           HG3      GLN  43  -0.288  21.181 -11.319
    7   HE21  GLN  43          HE21      GLN  43  -0.148  22.800 -13.408
    8   HE22  GLN  43          HE22      GLN  43   1.272  22.599 -14.312

  No H/Q in entry =           8
  In of MODEL   71
    1    H    SER  44           H        SER  44   0.431  17.497  -9.105
    2    HA   SER  44           HA       SER  44   0.809  14.894 -10.125
    3    HB2  SER  44           HB2      SER  44   1.677  16.351  -7.889
    4    HB3  SER  44           HB3      SER  44   0.835  14.956  -7.217
    5    HG   SER  44           HG       SER  44   2.957  14.369  -7.639

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ARG  45           H        ARG  45  -1.536  16.180  -7.793
    2    HA   ARG  45           HA       ARG  45  -2.885  13.798  -7.156
    3    HB2  ARG  45           HB2      ARG  45  -3.121  15.965  -5.969
    4    HB3  ARG  45           HB3      ARG  45  -3.985  16.616  -7.359
    5    HG2  ARG  45           HG2      ARG  45  -5.723  14.862  -7.075
    6    HG3  ARG  45           HG3      ARG  45  -4.872  14.267  -5.650
    7    HD2  ARG  45           HD2      ARG  45  -5.117  16.532  -4.598
    8    HD3  ARG  45           HD3      ARG  45  -6.110  17.033  -5.984
    9    HE   ARG  45           HE       ARG  45  -7.183  14.642  -4.941
   10   HH21  ARG  45          HH11      ARG  45  -9.022  14.690  -3.674
   11   HH22  ARG  45          HH12      ARG  45  -9.442  16.125  -2.808
   12   HH11  ARG  45          HH21      ARG  45  -6.692  17.899  -3.922
   13   HH12  ARG  45          HH22      ARG  45  -8.117  17.942  -2.947

  No H/Q in entry =          13
  In of MODEL   71
    1    H    MET  46           H        MET  46  -3.504  16.188  -9.713
    2    HA   MET  46           HA       MET  46  -5.822  14.975 -10.776
    3    HB2  MET  46           HB2      MET  46  -3.737  16.780 -12.033
    4    HB3  MET  46           HB3      MET  46  -5.209  16.276 -12.869
    5    HG2  MET  46           HG2      MET  46  -6.365  17.112 -10.635
    6    HG3  MET  46           HG3      MET  46  -4.898  18.073 -10.489
    7    HE3  MET  46           HE1      MET  46  -4.804  19.647 -14.106
    8    HE2  MET  46           HE2      MET  46  -4.942  17.897 -14.238
    9    HE1  MET  46           HE3      MET  46  -3.894  18.601 -13.007

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ALA  47           H        ALA  47  -2.384  14.551 -11.527
    2    HA   ALA  47           HA       ALA  47  -2.696  12.814 -13.734
    3    HB3  ALA  47           HB1      ALA  47  -0.534  13.740 -13.380
    4    HB2  ALA  47           HB2      ALA  47  -0.365  12.015 -13.043
    5    HB1  ALA  47           HB3      ALA  47  -0.480  13.168 -11.712

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LEU  48           H        LEU  48  -2.423  12.189 -10.259
    2    HA   LEU  48           HA       LEU  48  -2.470   9.348 -10.411
    3    HB2  LEU  48           HB2      LEU  48  -3.270  11.257  -8.203
    4    HB3  LEU  48           HB3      LEU  48  -3.147   9.509  -7.999
    5    HG   LEU  48           HG       LEU  48  -0.875  11.245  -8.995
    6   HD13  LEU  48          HD11      LEU  48  -1.175  12.014  -6.806
    7   HD12  LEU  48          HD12      LEU  48   0.010  10.727  -6.603
    8   HD11  LEU  48          HD13      LEU  48  -1.685  10.437  -6.208
    9   HD22  LEU  48          HD21      LEU  48  -0.339   9.066  -9.630
   10   HD21  LEU  48          HD22      LEU  48  -1.199   8.339  -8.274
   11   HD23  LEU  48          HD23      LEU  48   0.360   9.119  -8.013

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ASN  49           H        ASN  49  -4.975  11.800 -10.020
    2    HA   ASN  49           HA       ASN  49  -7.134  10.100  -9.481
    3    HB2  ASN  49           HB2      ASN  49  -7.239  12.519  -9.159
    4    HB3  ASN  49           HB3      ASN  49  -7.066  12.784 -10.890
    5   HD21  ASN  49          HD21      ASN  49  -9.304  13.816  -9.537
    6   HD22  ASN  49          HD22      ASN  49 -10.689  12.966 -10.018

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLU  50           H        GLU  50  -5.868  11.312 -12.568
    2    HA   GLU  50           HA       GLU  50  -7.798  10.021 -14.216
    3    HB2  GLU  50           HB2      GLU  50  -6.361  11.862 -15.031
    4    HB3  GLU  50           HB3      GLU  50  -4.950  10.814 -14.887
    5    HG2  GLU  50           HG2      GLU  50  -5.894   9.259 -16.523
    6    HG3  GLU  50           HG3      GLU  50  -7.371  10.212 -16.615

  No H/Q in entry =           6
  In of MODEL   71
    1    H    ALA  51           H        ALA  51  -4.614   9.084 -13.001
    2    HA   ALA  51           HA       ALA  51  -4.430   6.631 -14.414
    3    HB2  ALA  51           HB1      ALA  51  -2.447   6.378 -13.309
    4    HB1  ALA  51           HB2      ALA  51  -3.146   6.792 -11.744
    5    HB3  ALA  51           HB3      ALA  51  -2.709   8.068 -12.880

  No H/Q in entry =           5
  In of MODEL   71
    1    H    HIS  52           H        HIS  52  -5.624   7.449 -11.169
    2    HA   HIS  52           HA       HIS  52  -6.268   4.830 -10.334
    3    HB2  HIS  52           HB2      HIS  52  -6.166   6.767  -8.809
    4    HB3  HIS  52           HB3      HIS  52  -7.601   7.442  -9.580
    5    HD1  HIS  52           HD1      HIS  52  -9.819   5.895  -9.423
    6    HD2  HIS  52           HD2      HIS  52  -6.719   4.907  -6.818
    7    HE1  HIS  52           HE1      HIS  52 -10.832   4.418  -7.632
    8    HE2  HIS  52           HE2      HIS  52  -8.954   3.807  -6.035

  No H/Q in entry =           8
  In of MODEL   71
    1    H    LEU  53           H        LEU  53  -8.124   7.254 -12.131
    2    HA   LEU  53           HA       LEU  53 -10.608   5.921 -12.146
    3    HB2  LEU  53           HB2      LEU  53  -9.353   7.917 -14.020
    4    HB3  LEU  53           HB3      LEU  53 -10.943   7.228 -14.339
    5    HG   LEU  53           HG       LEU  53 -10.249   8.553 -11.698
    6   HD13  LEU  53          HD11      LEU  53  -9.958  10.260 -13.372
    7   HD12  LEU  53          HD12      LEU  53 -11.544  10.513 -12.644
    8   HD11  LEU  53          HD13      LEU  53 -11.410   9.750 -14.225
    9   HD21  LEU  53          HD21      LEU  53 -12.788   7.637 -13.054
   10   HD23  LEU  53          HD22      LEU  53 -12.835   8.929 -11.860
   11   HD22  LEU  53          HD23      LEU  53 -12.268   7.335 -11.401

  No H/Q in entry =          11
  In of MODEL   71
    1    H    VAL  54           H        VAL  54  -7.850   5.764 -14.377
    2    HA   VAL  54           HA       VAL  54  -9.039   3.970 -16.219
    3    HB   VAL  54           HB       VAL  54  -6.142   4.525 -15.531
    4   HG12  VAL  54          HG11      VAL  54  -5.872   3.439 -17.917
    5   HG11  VAL  54          HG12      VAL  54  -7.388   2.634 -17.516
    6   HG13  VAL  54          HG13      VAL  54  -5.971   2.405 -16.493
    7   HG22  VAL  54          HG21      VAL  54  -6.940   6.453 -16.582
    8   HG21  VAL  54          HG22      VAL  54  -8.117   5.569 -17.551
    9   HG23  VAL  54          HG23      VAL  54  -6.409   5.515 -17.977

  No H/Q in entry =           9
  In of MODEL   71
    1    H    GLN  55           H        GLN  55  -7.039   3.462 -13.314
    2    HA   GLN  55           HA       GLN  55  -6.904   0.646 -13.564
    3    HB2  GLN  55           HB2      GLN  55  -5.366   1.570 -12.043
    4    HB3  GLN  55           HB3      GLN  55  -6.600   2.518 -11.218
    5    HG2  GLN  55           HG2      GLN  55  -7.263   0.753  -9.899
    6    HG3  GLN  55           HG3      GLN  55  -7.017  -0.433 -11.174
    7   HE21  GLN  55          HE21      GLN  55  -5.372  -1.855 -10.673
    8   HE22  GLN  55          HE22      GLN  55  -3.995  -1.480  -9.758

  No H/Q in entry =           8
  In of MODEL   71
    1    H    THR  56           H        THR  56  -9.273   2.775 -11.960
    2    HA   THR  56           HA       THR  56 -10.830   0.870 -10.670
    3    HB   THR  56           HB       THR  56 -11.959   3.237 -12.183
    4    HG1  THR  56           HG1      THR  56 -10.231   3.094 -10.079
    5   HG22  THR  56          HG21      THR  56 -12.860   2.229  -9.507
    6   HG21  THR  56          HG22      THR  56 -13.384   1.391 -10.968
    7   HG23  THR  56          HG23      THR  56 -13.778   3.095 -10.739

  No H/Q in entry =           7
  In of MODEL   71
    1    H    LYS  57           H        LYS  57 -11.041   1.942 -14.059
    2    HA   LYS  57           HA       LYS  57 -13.168   0.220 -14.814
    3    HB2  LYS  57           HB2      LYS  57 -12.319   2.182 -16.133
    4    HB3  LYS  57           HB3      LYS  57 -10.865   1.264 -16.495
    5    HG2  LYS  57           HG2      LYS  57 -12.194  -0.438 -17.654
    6    HG3  LYS  57           HG3      LYS  57 -13.677   0.422 -17.255
    7    HD2  LYS  57           HD2      LYS  57 -12.888   2.377 -18.561
    8    HD3  LYS  57           HD3      LYS  57 -11.421   1.496 -18.984
    9    HE2  LYS  57           HE2      LYS  57 -12.769  -0.233 -20.120
   10    HE3  LYS  57           HE3      LYS  57 -14.253   0.612 -19.683
   11    HZ3  LYS  57           HZ1      LYS  57 -13.796   2.339 -21.109
   12    HZ2  LYS  57           HZ2      LYS  57 -13.213   1.004 -21.985
   13    HZ1  LYS  57           HZ3      LYS  57 -12.131   2.021 -21.157

  No H/Q in entry =          13
  In of MODEL   71
    1    H    LEU  58           H        LEU  58  -9.658  -0.156 -14.747
    2    HA   LEU  58           HA       LEU  58  -9.623  -2.676 -16.030
    3    HB2  LEU  58           HB2      LEU  58  -7.614  -1.348 -14.220
    4    HB3  LEU  58           HB3      LEU  58  -7.327  -2.867 -15.070
    5    HG   LEU  58           HG       LEU  58  -8.118  -0.278 -16.441
    6   HD11  LEU  58          HD11      LEU  58  -5.455  -1.472 -15.740
    7   HD13  LEU  58          HD12      LEU  58  -5.976   0.211 -15.697
    8   HD12  LEU  58          HD13      LEU  58  -5.621  -0.558 -17.240
    9   HD22  LEU  58          HD21      LEU  58  -8.665  -1.853 -18.030
   10   HD21  LEU  58          HD22      LEU  58  -7.607  -3.082 -17.343
   11   HD23  LEU  58          HD23      LEU  58  -6.933  -1.800 -18.349

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  59           H        ILE  59 -10.467  -1.779 -12.783
    2    HA   ILE  59           HA       ILE  59 -10.075  -4.538 -11.828
    3    HB   ILE  59           HB       ILE  59  -9.664  -2.268 -10.432
    4   HG12  ILE  59          HG12      ILE  59 -11.027  -4.619  -9.102
    5   HG13  ILE  59          HG13      ILE  59  -9.383  -4.698  -9.684
    6   HG21  ILE  59          HG21      ILE  59 -12.229  -1.813 -10.714
    7   HG23  ILE  59          HG22      ILE  59 -11.494  -1.549  -9.149
    8   HG22  ILE  59          HG23      ILE  59 -12.413  -3.019  -9.462
    9   HD11  ILE  59          HD11      ILE  59  -8.775  -2.771  -8.284
   10   HD13  ILE  59          HD12      ILE  59  -9.407  -4.091  -7.308
   11   HD12  ILE  59          HD13      ILE  59 -10.426  -2.698  -7.678

  No H/Q in entry =          11
  In of MODEL   71
    1    H    GLU  60           H        GLU  60 -12.667  -2.265 -12.649
    2    HA   GLU  60           HA       GLU  60 -14.830  -3.813 -11.638
    3    HB2  GLU  60           HB2      GLU  60 -15.077  -1.446 -12.241
    4    HB3  GLU  60           HB3      GLU  60 -14.750  -1.827 -13.929
    5    HG2  GLU  60           HG2      GLU  60 -16.762  -3.294 -13.960
    6    HG3  GLU  60           HG3      GLU  60 -17.110  -2.817 -12.311

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLY  61           H        GLY  61 -13.149  -3.779 -14.748
    2    HA3  GLY  61           HA2      GLY  61 -14.823  -6.053 -15.638
    3    HA2  GLY  61           HA3      GLY  61 -13.993  -4.938 -16.716

  No H/Q in entry =           3
  In of MODEL   71
    1    H    ASP  62           H        ASP  62 -12.600  -6.353 -13.824
    2    HA   ASP  62           HA       ASP  62 -10.278  -7.231 -15.195
    3    HB2  ASP  62           HB2      ASP  62  -9.715  -8.257 -13.001
    4    HB3  ASP  62           HB3      ASP  62 -10.214  -6.575 -12.856

  No H/Q in entry =           4
  In of MODEL   71
    1    H    ALA  63           H        ALA  63 -13.239  -8.951 -14.191
    2    HA   ALA  63           HA       ALA  63 -12.154 -11.453 -15.378
    3    HB2  ALA  63           HB1      ALA  63 -14.613 -11.086 -13.630
    4    HB3  ALA  63           HB2      ALA  63 -13.020 -11.493 -12.994
    5    HB1  ALA  63           HB3      ALA  63 -13.851 -12.611 -14.077

  No H/Q in entry =           5
  In of MODEL   71
    1    H    GLY  64           H        GLY  64 -14.210 -12.812 -16.150
    2    HA3  GLY  64           HA2      GLY  64 -16.255 -12.774 -17.415
    3    HA2  GLY  64           HA3      GLY  64 -15.885 -11.121 -17.889

  No H/Q in entry =           3
  In of MODEL   71
    1    H    GLU  65           H        GLU  65 -12.986 -12.070 -18.291
    2    HA   GLU  65           HA       GLU  65 -13.198 -12.472 -21.084
    3    HB2  GLU  65           HB2      GLU  65 -10.847 -12.785 -19.218
    4    HB3  GLU  65           HB3      GLU  65 -10.734 -12.865 -20.977
    5    HG2  GLU  65           HG2      GLU  65 -11.873 -10.513 -19.442
    6    HG3  GLU  65           HG3      GLU  65 -10.229 -10.591 -20.072

  No H/Q in entry =           6
  In of MODEL   71
    1    H    GLY  66           H        GLY  66 -12.604 -14.641 -18.429
    2    HA3  GLY  66           HA2      GLY  66 -13.540 -16.935 -19.830
    3    HA2  GLY  66           HA3      GLY  66 -11.798 -16.972 -19.644

  No H/Q in entry =           3
  In of MODEL   71
    1    H    LYS  67           H        LYS  67 -10.897 -17.190 -17.594
    2    HA   LYS  67           HA       LYS  67 -12.498 -18.737 -15.776
    3    HB2  LYS  67           HB2      LYS  67  -9.581 -17.983 -15.812
    4    HB3  LYS  67           HB3      LYS  67 -10.310 -19.025 -14.583
    5    HG2  LYS  67           HG2      LYS  67 -11.124 -20.547 -16.349
    6    HG3  LYS  67           HG3      LYS  67 -10.397 -19.512 -17.577
    7    HD2  LYS  67           HD2      LYS  67  -8.166 -19.944 -16.651
    8    HD3  LYS  67           HD3      LYS  67  -8.876 -20.936 -15.374
    9    HE2  LYS  67           HE2      LYS  67  -8.053 -22.377 -17.184
   10    HE3  LYS  67           HE3      LYS  67  -9.814 -22.457 -17.100
   11    HZ1  LYS  67           HZ1      LYS  67  -8.706 -20.395 -18.820
   12    HZ3  LYS  67           HZ2      LYS  67 -10.049 -21.406 -19.057
   13    HZ2  LYS  67           HZ3      LYS  67  -8.480 -21.991 -19.344

  No H/Q in entry =          13
  In of MODEL   71
    1    H    MET  68           H        MET  68 -12.744 -18.470 -13.594
    2    HA   MET  68           HA       MET  68 -13.785 -16.118 -12.667
    3    HB2  MET  68           HB2      MET  68 -12.508 -18.365 -11.110
    4    HB3  MET  68           HB3      MET  68 -13.499 -17.096 -10.390
    5    HG2  MET  68           HG2      MET  68 -14.419 -18.952 -12.604
    6    HG3  MET  68           HG3      MET  68 -14.814 -19.150 -10.895
    7    HE1  MET  68           HE1      MET  68 -15.949 -17.761  -9.507
    8    HE3  MET  68           HE2      MET  68 -17.161 -16.546  -9.913
    9    HE2  MET  68           HE3      MET  68 -15.460 -16.090  -9.825

  No H/Q in entry =           9
  In of MODEL   71
    1    H    LYS  69           H        LYS  69 -10.469 -16.555 -13.205
    2    HA   LYS  69           HA       LYS  69  -9.535 -14.959 -11.002
    3    HB2  LYS  69           HB2      LYS  69  -8.167 -16.099 -13.434
    4    HB3  LYS  69           HB3      LYS  69  -7.319 -15.131 -12.227
    5    HG2  LYS  69           HG2      LYS  69  -8.021 -16.704 -10.461
    6    HG3  LYS  69           HG3      LYS  69  -8.888 -17.665 -11.656
    7    HD2  LYS  69           HD2      LYS  69  -6.795 -18.152 -12.828
    8    HD3  LYS  69           HD3      LYS  69  -5.904 -17.130 -11.699
    9    HE2  LYS  69           HE2      LYS  69  -5.680 -19.471 -11.027
   10    HE3  LYS  69           HE3      LYS  69  -6.641 -18.604  -9.831
   11    HZ3  LYS  69           HZ1      LYS  69  -8.630 -19.492 -10.728
   12    HZ2  LYS  69           HZ2      LYS  69  -7.560 -20.794 -10.528
   13    HZ1  LYS  69           HZ3      LYS  69  -7.826 -20.139 -12.074

  No H/Q in entry =          13
  In of MODEL   71
    1    H    VAL  70           H        VAL  70  -7.580 -13.323 -11.919
    2    HA   VAL  70           HA       VAL  70  -8.914 -11.309 -13.632
    3    HB   VAL  70           HB       VAL  70  -8.077  -9.563 -12.079
    4   HG11  VAL  70          HG11      VAL  70 -10.391 -10.685 -11.939
    5   HG13  VAL  70          HG12      VAL  70  -9.849  -9.800 -10.511
    6   HG12  VAL  70          HG13      VAL  70  -9.749 -11.560 -10.550
    7   HG23  VAL  70          HG21      VAL  70  -7.575 -10.657  -9.680
    8   HG22  VAL  70          HG22      VAL  70  -6.290 -10.394 -10.858
    9   HG21  VAL  70          HG23      VAL  70  -7.010 -11.993 -10.682

  No H/Q in entry =           9
  In of MODEL   71
    1    H    SER  71           H        SER  71  -7.364  -9.663 -14.420
    2    HA   SER  71           HA       SER  71  -5.106 -10.817 -15.675
    3    HB2  SER  71           HB2      SER  71  -6.330  -8.794 -16.504
    4    HB3  SER  71           HB3      SER  71  -5.646  -7.880 -15.163
    5    HG   SER  71           HG       SER  71  -4.096  -9.351 -17.028

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LEU  72           H        LEU  72  -3.074 -11.053 -15.036
    2    HA   LEU  72           HA       LEU  72  -2.365 -10.820 -12.323
    3    HB2  LEU  72           HB2      LEU  72  -0.695 -11.227 -14.799
    4    HB3  LEU  72           HB3      LEU  72  -0.041 -11.291 -13.166
    5    HG   LEU  72           HG       LEU  72  -2.362 -13.016 -14.088
    6   HD11  LEU  72          HD11      LEU  72   0.618 -13.462 -14.166
    7   HD13  LEU  72          HD12      LEU  72  -0.580 -13.788 -15.417
    8   HD12  LEU  72          HD13      LEU  72  -0.493 -14.822 -13.991
    9   HD21  LEU  72          HD21      LEU  72  -0.635 -12.866 -11.623
   10   HD23  LEU  72          HD22      LEU  72  -1.351 -14.404 -12.080
   11   HD22  LEU  72          HD23      LEU  72  -2.384 -13.021 -11.731

  No H/Q in entry =          11
  In of MODEL   71
    1    H    VAL  73           H        VAL  73  -1.672  -8.801 -15.107
    2    HA   VAL  73           HA       VAL  73   0.220  -7.070 -14.003
    3    HB   VAL  73           HB       VAL  73  -0.138  -5.703 -15.879
    4   HG12  VAL  73          HG11      VAL  73  -1.148  -8.389 -16.829
    5   HG11  VAL  73          HG12      VAL  73   0.516  -8.148 -16.299
    6   HG13  VAL  73          HG13      VAL  73  -0.106  -7.253 -17.683
    7   HG22  VAL  73          HG21      VAL  73  -2.460  -5.168 -15.679
    8   HG21  VAL  73          HG22      VAL  73  -2.935  -6.856 -15.853
    9   HG23  VAL  73          HG23      VAL  73  -2.290  -5.974 -17.238

  No H/Q in entry =           9
  In of MODEL   71
    1    H    LEU  74           H        LEU  74  -3.177  -7.235 -13.455
    2    HA   LEU  74           HA       LEU  74  -3.836  -4.587 -12.852
    3    HB2  LEU  74           HB2      LEU  74  -5.541  -6.275 -13.025
    4    HB3  LEU  74           HB3      LEU  74  -4.839  -7.189 -11.693
    5    HG   LEU  74           HG       LEU  74  -5.333  -5.325 -10.149
    6   HD13  LEU  74          HD11      LEU  74  -5.230  -3.387 -11.514
    7   HD12  LEU  74          HD12      LEU  74  -6.939  -3.553 -11.117
    8   HD11  LEU  74          HD13      LEU  74  -6.347  -4.062 -12.699
    9   HD21  LEU  74          HD21      LEU  74  -7.010  -7.184 -11.014
   10   HD23  LEU  74          HD22      LEU  74  -7.851  -5.775 -11.624
   11   HD22  LEU  74          HD23      LEU  74  -7.539  -5.917  -9.912

  No H/Q in entry =          11
  In of MODEL   71
    1    H    VAL  75           H        VAL  75  -2.763  -7.152 -10.680
    2    HA   VAL  75           HA       VAL  75  -2.595  -5.591  -8.340
    3    HB   VAL  75           HB       VAL  75  -1.062  -8.067  -9.120
    4   HG11  VAL  75          HG11      VAL  75  -1.278  -6.573  -6.468
    5   HG13  VAL  75          HG12      VAL  75   0.184  -6.851  -7.402
    6   HG12  VAL  75          HG13      VAL  75  -0.633  -8.203  -6.637
    7   HG23  VAL  75          HG21      VAL  75  -2.703  -9.111  -7.559
    8   HG22  VAL  75          HG22      VAL  75  -3.499  -8.357  -8.940
    9   HG21  VAL  75          HG23      VAL  75  -3.497  -7.547  -7.373

  No H/Q in entry =           9
  In of MODEL   71
    1    H    GLU  76           H        GLU  76  -0.167  -6.323 -10.867
    2    HA   GLU  76           HA       GLU  76   1.995  -4.940  -9.707
    3    HB2  GLU  76           HB2      GLU  76   2.221  -6.419 -11.687
    4    HB3  GLU  76           HB3      GLU  76   1.302  -5.272 -12.649
    5    HG2  GLU  76           HG2      GLU  76   3.639  -4.914 -13.132
    6    HG3  GLU  76           HG3      GLU  76   3.097  -3.545 -12.181

  No H/Q in entry =           6
  In of MODEL   71
    1    H    ALA  77           H        ALA  77  -0.548  -3.782 -11.907
    2    HA   ALA  77           HA       ALA  77   0.403  -1.122 -12.087
    3    HB1  ALA  77           HB1      ALA  77  -1.288  -2.137 -13.618
    4    HB2  ALA  77           HB2      ALA  77  -1.802  -0.584 -12.958
    5    HB3  ALA  77           HB3      ALA  77  -2.463  -2.082 -12.303

  No H/Q in entry =           5
  In of MODEL   71
    1    H    GLN  78           H        GLN  78  -1.849  -2.705  -9.879
    2    HA   GLN  78           HA       GLN  78  -2.695  -0.395  -8.487
    3    HB2  GLN  78           HB2      GLN  78  -3.772  -2.669  -8.398
    4    HB3  GLN  78           HB3      GLN  78  -2.429  -3.209  -7.393
    5    HG2  GLN  78           HG2      GLN  78  -2.973  -1.476  -5.732
    6    HG3  GLN  78           HG3      GLN  78  -4.317  -0.931  -6.734
    7   HE21  GLN  78          HE21      GLN  78  -4.784  -1.901  -4.086
    8   HE22  GLN  78          HE22      GLN  78  -5.621  -3.374  -4.194

  No H/Q in entry =           8
  In of MODEL   71
    1    H    LEU  79           H        LEU  79   0.017  -2.608  -8.022
    2    HA   LEU  79           HA       LEU  79   0.971  -1.690  -5.564
    3    HB2  LEU  79           HB2      LEU  79   1.876  -3.688  -6.623
    4    HB3  LEU  79           HB3      LEU  79   2.511  -2.730  -7.958
    5    HG   LEU  79           HG       LEU  79   4.044  -1.562  -6.452
    6   HD13  LEU  79          HD11      LEU  79   3.029  -1.327  -4.389
    7   HD12  LEU  79          HD12      LEU  79   4.128  -2.658  -4.038
    8   HD11  LEU  79          HD13      LEU  79   2.428  -2.985  -4.372
    9   HD23  LEU  79          HD21      LEU  79   5.285  -3.688  -5.539
   10   HD22  LEU  79          HD22      LEU  79   5.084  -3.497  -7.278
   11   HD21  LEU  79          HD23      LEU  79   4.020  -4.582  -6.386

  No H/Q in entry =          11
  In of MODEL   71
    1    H    HIS  80           H        HIS  80   1.834  -0.568  -8.837
    2    HA   HIS  80           HA       HIS  80   3.606   1.450  -7.915
    3    HB2  HIS  80           HB2      HIS  80   2.337   0.728 -10.500
    4    HB3  HIS  80           HB3      HIS  80   2.904   2.390 -10.332
    5    HD1  HIS  80           HD1      HIS  80   5.302   2.728 -10.848
    6    HD2  HIS  80           HD2      HIS  80   4.542  -1.192  -9.648
    7    HE1  HIS  80           HE1      HIS  80   7.513   1.486 -11.003
    8    HE2  HIS  80           HE2      HIS  80   7.061  -0.906 -10.275

  No H/Q in entry =           8
  In of MODEL   71
    1    H    LEU  81           H        LEU  81   0.203   1.552  -8.906
    2    HA   LEU  81           HA       LEU  81  -0.119   4.341  -8.585
    3    HB2  LEU  81           HB2      LEU  81  -2.096   2.062  -8.506
    4    HB3  LEU  81           HB3      LEU  81  -2.577   3.758  -8.420
    5    HG   LEU  81           HG       LEU  81  -0.858   2.630 -10.647
    6   HD12  LEU  81          HD11      LEU  81  -3.091   2.909 -11.954
    7   HD11  LEU  81          HD12      LEU  81  -3.850   2.832 -10.365
    8   HD13  LEU  81          HD13      LEU  81  -2.883   1.479 -10.945
    9   HD23  LEU  81          HD21      LEU  81  -1.987   4.753 -11.754
   10   HD22  LEU  81          HD22      LEU  81  -0.577   4.950 -10.717
   11   HD21  LEU  81          HD23      LEU  81  -2.189   5.273 -10.083

  No H/Q in entry =          11
  In of MODEL   71
    1    H    MET  82           H        MET  82  -0.740   1.649  -6.330
    2    HA   MET  82           HA       MET  82  -1.826   3.223  -4.251
    3    HB2  MET  82           HB2      MET  82  -0.406   0.560  -4.278
    4    HB3  MET  82           HB3      MET  82  -1.002   1.279  -2.784
    5    HG2  MET  82           HG2      MET  82  -2.718   0.749  -5.230
    6    HG3  MET  82           HG3      MET  82  -2.626  -0.319  -3.831
    7    HE3  MET  82           HE1      MET  82  -4.386   1.308  -1.027
    8    HE2  MET  82           HE2      MET  82  -2.661   1.615  -1.206
    9    HE1  MET  82           HE3      MET  82  -3.320   0.045  -1.658

  No H/Q in entry =           9
  In of MODEL   71
    1    H    THR  83           H        THR  83   1.495   2.192  -4.927
    2    HA   THR  83           HA       THR  83   2.686   3.324  -2.625
    3    HB   THR  83           HB       THR  83   4.786   3.300  -4.092
    4    HG1  THR  83           HG1      THR  83   4.563   2.764  -6.115
    5   HG22  THR  83          HG21      THR  83   4.390   0.634  -4.418
    6   HG21  THR  83          HG22      THR  83   3.090   0.994  -3.283
    7   HG23  THR  83          HG23      THR  83   4.762   1.368  -2.859

  No H/Q in entry =           7
  In of MODEL   71
    1    H    SER  84           H        SER  84   2.304   4.587  -5.930
    2    HA   SER  84           HA       SER  84   3.600   7.052  -5.477
    3    HB2  SER  84           HB2      SER  84   1.551   6.178  -7.501
    4    HB3  SER  84           HB3      SER  84   2.201   7.817  -7.478
    5    HG   SER  84           HG       SER  84   3.617   5.365  -7.758

  No H/Q in entry =           5
  In of MODEL   71
    1    H    MET  85           H        MET  85   0.119   6.236  -5.315
    2    HA   MET  85           HA       MET  85  -0.789   8.832  -4.724
    3    HB2  MET  85           HB2      MET  85  -2.286   7.011  -5.393
    4    HB3  MET  85           HB3      MET  85  -1.976   6.192  -3.863
    5    HG2  MET  85           HG2      MET  85  -2.896   8.121  -2.633
    6    HG3  MET  85           HG3      MET  85  -3.185   8.957  -4.158
    7    HE2  MET  85           HE1      MET  85  -5.664   8.960  -2.589
    8    HE1  MET  85           HE2      MET  85  -4.980   7.729  -1.530
    9    HE3  MET  85           HE3      MET  85  -6.537   7.449  -2.304

  No H/Q in entry =           9
  In of MODEL   71
    1    H    LEU  86           H        LEU  86   0.169   6.192  -2.570
    2    HA   LEU  86           HA       LEU  86  -0.395   7.492  -0.133
    3    HB2  LEU  86           HB2      LEU  86   0.112   5.028  -0.519
    4    HB3  LEU  86           HB3      LEU  86   1.812   5.485  -0.610
    5    HG   LEU  86           HG       LEU  86   1.460   6.647   1.654
    6   HD11  LEU  86          HD11      LEU  86  -1.219   5.835   1.176
    7   HD13  LEU  86          HD12      LEU  86  -0.570   6.597   2.627
    8   HD12  LEU  86          HD13      LEU  86  -0.632   4.839   2.512
    9   HD23  LEU  86          HD21      LEU  86   1.081   3.648   1.783
   10   HD22  LEU  86          HD22      LEU  86   2.063   4.676   2.824
   11   HD21  LEU  86          HD23      LEU  86   2.575   4.356   1.167

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ALA  87           H        ALA  87   2.597   7.241  -2.012
    2    HA   ALA  87           HA       ALA  87   4.274   8.683  -0.285
    3    HB3  ALA  87           HB1      ALA  87   4.394   7.665  -2.990
    4    HB2  ALA  87           HB2      ALA  87   5.720   8.019  -1.885
    5    HB1  ALA  87           HB3      ALA  87   5.088   9.287  -2.935

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ARG  88           H        ARG  88   2.318   9.781  -3.015
    2    HA   ARG  88           HA       ARG  88   3.050  12.483  -2.902
    3    HB2  ARG  88           HB2      ARG  88   1.820  11.306  -4.760
    4    HB3  ARG  88           HB3      ARG  88   0.357  11.429  -3.782
    5    HG2  ARG  88           HG2      ARG  88   1.336  14.025  -3.702
    6    HG3  ARG  88           HG3      ARG  88   1.774  13.514  -5.330
    7    HD2  ARG  88           HD2      ARG  88  -0.366  13.560  -6.034
    8    HD3  ARG  88           HD3      ARG  88  -0.945  12.701  -4.606
    9    HE   ARG  88           HE       ARG  88  -1.175  15.475  -5.031
   10   HH21  ARG  88          HH11      ARG  88  -1.728  16.800  -3.298
   11   HH22  ARG  88          HH12      ARG  88  -1.429  16.271  -1.678
   12   HH11  ARG  88          HH21      ARG  88  -0.133  13.233  -2.648
   13   HH12  ARG  88          HH22      ARG  88  -0.543  14.245  -1.310

  No H/Q in entry =          13
  In of MODEL   71
    1    H    GLU  89           H        GLU  89   0.367  10.772  -1.266
    2    HA   GLU  89           HA       GLU  89  -0.779  13.069  -0.070
    3    HB2  GLU  89           HB2      GLU  89  -1.863  10.813  -0.155
    4    HB3  GLU  89           HB3      GLU  89  -0.735  10.278   1.091
    5    HG2  GLU  89           HG2      GLU  89  -1.584  11.967   2.644
    6    HG3  GLU  89           HG3      GLU  89  -2.643  12.620   1.396

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LEU  90           H        LEU  90   1.703  10.816   1.117
    2    HA   LEU  90           HA       LEU  90   2.033  12.071   3.645
    3    HB2  LEU  90           HB2      LEU  90   3.836  10.319   1.976
    4    HB3  LEU  90           HB3      LEU  90   4.243  10.845   3.615
    5    HG   LEU  90           HG       LEU  90   1.630   9.460   2.949
    6   HD12  LEU  90          HD11      LEU  90   2.796   7.433   3.966
    7   HD11  LEU  90          HD12      LEU  90   4.307   8.310   3.726
    8   HD13  LEU  90          HD13      LEU  90   3.305   7.885   2.337
    9   HD22  LEU  90          HD21      LEU  90   1.346  10.384   5.068
   10   HD21  LEU  90          HD22      LEU  90   3.064  10.302   5.456
   11   HD23  LEU  90          HD23      LEU  90   2.078   8.841   5.504

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  91           H        ILE  91   3.640  12.470   0.522
    2    HA   ILE  91           HA       ILE  91   5.588  14.330   1.363
    3    HB   ILE  91           HB       ILE  91   4.291  13.816  -1.320
    4   HG12  ILE  91          HG12      ILE  91   7.128  13.370  -0.337
    5   HG13  ILE  91          HG13      ILE  91   5.862  12.155  -0.175
    6   HG22  ILE  91          HG21      ILE  91   6.497  15.192  -2.005
    7   HG21  ILE  91          HG22      ILE  91   6.172  15.992  -0.466
    8   HG23  ILE  91          HG23      ILE  91   4.952  16.000  -1.739
    9   HD13  ILE  91          HD11      ILE  91   5.700  11.824  -2.482
   10   HD12  ILE  91          HD12      ILE  91   7.430  12.092  -2.264
   11   HD11  ILE  91          HD13      ILE  91   6.404  13.399  -2.856

  No H/Q in entry =          11
  In of MODEL   71
    1    H    THR  92           H        THR  92   2.224  14.714   0.344
    2    HA   THR  92           HA       THR  92   2.159  17.537   0.278
    3    HB   THR  92           HB       THR  92   0.017  15.514   0.975
    4    HG1  THR  92           HG1      THR  92   0.330  15.335  -1.109
    5   HG22  THR  92          HG21      THR  92  -1.411  17.655   0.244
    6   HG21  THR  92          HG22      THR  92  -0.032  18.501   0.944
    7   HG23  THR  92          HG23      THR  92  -0.961  17.369   1.925

  No H/Q in entry =           7
  In of MODEL   71
    1    H    GLU  93           H        GLU  93   1.634  15.235   2.935
    2    HA   GLU  93           HA       GLU  93   1.071  17.135   4.948
    3    HB2  GLU  93           HB2      GLU  93   2.420  14.429   5.193
    4    HB3  GLU  93           HB3      GLU  93   1.713  15.350   6.522
    5    HG2  GLU  93           HG2      GLU  93   0.118  14.545   4.080
    6    HG3  GLU  93           HG3      GLU  93   0.229  13.526   5.511

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LEU  94           H        LEU  94   4.100  15.692   3.810
    2    HA   LEU  94           HA       LEU  94   5.830  16.867   5.700
    3    HB2  LEU  94           HB2      LEU  94   6.253  15.899   2.873
    4    HB3  LEU  94           HB3      LEU  94   7.570  16.576   3.825
    5    HG   LEU  94           HG       LEU  94   5.857  14.360   4.959
    6   HD11  LEU  94          HD11      LEU  94   7.962  14.158   2.834
    7   HD13  LEU  94          HD12      LEU  94   6.528  13.165   3.094
    8   HD12  LEU  94          HD13      LEU  94   7.954  12.933   4.105
    9   HD23  LEU  94          HD21      LEU  94   8.050  13.855   6.119
   10   HD22  LEU  94          HD22      LEU  94   7.361  15.425   6.530
   11   HD21  LEU  94          HD23      LEU  94   8.705  15.320   5.392

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  95           H        ILE  95   4.684  18.016   2.545
    2    HA   ILE  95           HA       ILE  95   6.224  20.394   2.485
    3    HB   ILE  95           HB       ILE  95   3.594  19.672   1.173
    4   HG12  ILE  95          HG12      ILE  95   6.381  20.045   0.044
    5   HG13  ILE  95          HG13      ILE  95   5.751  18.484   0.560
    6   HG21  ILE  95          HG21      ILE  95   5.310  22.163   0.953
    7   HG23  ILE  95          HG22      ILE  95   3.585  22.072   1.304
    8   HG22  ILE  95          HG23      ILE  95   4.178  21.676  -0.309
    9   HD13  ILE  95          HD11      ILE  95   4.197  18.384  -1.174
   10   HD12  ILE  95          HD12      ILE  95   5.537  19.218  -1.959
   11   HD11  ILE  95          HD13      ILE  95   4.151  20.136  -1.373

  No H/Q in entry =          11
  In of MODEL   71
    1    H    GLU  96           H        GLU  96   2.981  19.702   3.772
    2    HA   GLU  96           HA       GLU  96   2.323  22.342   4.516
    3    HB2  GLU  96           HB2      GLU  96   0.672  20.536   4.526
    4    HB3  GLU  96           HB3      GLU  96   1.541  19.723   5.826
    5    HG2  GLU  96           HG2      GLU  96   0.499  20.996   7.390
    6    HG3  GLU  96           HG3      GLU  96   1.017  22.475   6.591

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LEU  97           H        LEU  97   4.195  19.819   6.152
    2    HA   LEU  97           HA       LEU  97   4.527  21.177   8.621
    3    HB2  LEU  97           HB2      LEU  97   6.097  19.026   7.215
    4    HB3  LEU  97           HB3      LEU  97   6.673  19.722   8.728
    5    HG   LEU  97           HG       LEU  97   3.879  18.590   8.411
    6   HD12  LEU  97          HD11      LEU  97   4.842  16.593   9.631
    7   HD11  LEU  97          HD12      LEU  97   6.446  17.244   9.290
    8   HD13  LEU  97          HD13      LEU  97   5.386  16.770   7.962
    9   HD23  LEU  97          HD21      LEU  97   4.328  18.307  10.978
   10   HD22  LEU  97          HD22      LEU  97   3.929  19.913  10.368
   11   HD21  LEU  97          HD23      LEU  97   5.605  19.496  10.719

  No H/Q in entry =          11
  In of MODEL   71
    1    H    HIS  98           H        HIS  98   6.406  21.211   5.601
    2    HA   HIS  98           HA       HIS  98   8.537  22.820   6.503
    3    HB2  HIS  98           HB2      HIS  98   7.255  22.543   3.774
    4    HB3  HIS  98           HB3      HIS  98   8.681  23.541   4.066
    5    HD1  HIS  98           HD1      HIS  98   7.516  19.955   4.090
    6    HD2  HIS  98           HD2      HIS  98  11.069  22.098   4.521
    7    HE1  HIS  98           HE1      HIS  98   9.393  18.249   4.042
    8    HE2  HIS  98           HE2      HIS  98  11.560  19.533   4.305

  No H/Q in entry =           8
  In of MODEL   71
    1    H    GLU  99           H        GLU  99   5.309  23.612   5.316
    2    HA   GLU  99           HA       GLU  99   5.652  26.431   5.253
    3    HB2  GLU  99           HB2      GLU  99   3.791  25.236   4.120
    4    HB3  GLU  99           HB3      GLU  99   3.095  24.869   5.698
    5    HG2  GLU  99           HG2      GLU  99   2.883  27.259   6.193
    6    HG3  GLU  99           HG3      GLU  99   3.659  27.666   4.665

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LYS 100           H        LYS 100   4.542  24.187   7.777
    2    HA   LYS 100           HA       LYS 100   3.924  26.237   9.665
    3    HB2  LYS 100           HB2      LYS 100   4.536  23.294  10.018
    4    HB3  LYS 100           HB3      LYS 100   4.071  24.364  11.347
    5    HG2  LYS 100           HG2      LYS 100   2.001  24.973  10.091
    6    HG3  LYS 100           HG3      LYS 100   2.446  23.807   8.842
    7    HD2  LYS 100           HD2      LYS 100   2.386  21.989  10.507
    8    HD3  LYS 100           HD3      LYS 100   1.958  23.149  11.767
    9    HE2  LYS 100           HE2      LYS 100  -0.099  23.742  10.497
   10    HE3  LYS 100           HE3      LYS 100   0.320  22.525   9.285
   11    HZ1  LYS 100           HZ1      LYS 100   0.054  21.861  12.166
   12    HZ3  LYS 100           HZ2      LYS 100   0.055  20.804  10.834
   13    HZ2  LYS 100           HZ3      LYS 100  -1.274  21.827  11.107

  No H/Q in entry =          13
  In of MODEL   71
    1    H    LEU 101           H        LEU 101   6.872  24.476   8.843
    2    HA   LEU 101           HA       LEU 101   8.454  25.340  11.050
    3    HB2  LEU 101           HB2      LEU 101   9.069  24.355   8.275
    4    HB3  LEU 101           HB3      LEU 101  10.360  25.039   9.259
    5    HG   LEU 101           HG       LEU 101   8.551  22.862  10.322
    6   HD12  LEU 101          HD11      LEU 101  10.625  21.391   9.723
    7   HD11  LEU 101          HD12      LEU 101  10.980  22.656   8.549
    8   HD13  LEU 101          HD13      LEU 101   9.462  21.765   8.452
    9   HD21  LEU 101          HD21      LEU 101  11.259  24.005  11.055
   10   HD23  LEU 101          HD22      LEU 101  10.733  22.427  11.637
   11   HD22  LEU 101          HD23      LEU 101   9.822  23.873  12.069

  No H/Q in entry =          11
  In of MODEL   71
    1    H    LYS 102           H        LYS 102   6.855  27.180   8.900
    2    HA   LYS 102           HA       LYS 102   6.905  29.473   8.604
    3    HB2  LYS 102           HB2      LYS 102   8.465  29.381  10.707
    4    HB3  LYS 102           HB3      LYS 102   9.765  29.589   9.551
    5    HG2  LYS 102           HG2      LYS 102   7.634  31.518  10.403
    6    HG3  LYS 102           HG3      LYS 102   9.344  31.798  10.156
    7    HD2  LYS 102           HD2      LYS 102   7.405  31.347   7.851
    8    HD3  LYS 102           HD3      LYS 102   7.767  32.932   8.518
    9    HE2  LYS 102           HE2      LYS 102   9.160  31.760   6.451
   10    HE3  LYS 102           HE3      LYS 102   9.758  33.076   7.461
   11    HZ2  LYS 102           HZ1      LYS 102  11.302  31.190   7.294
   12    HZ1  LYS 102           HZ2      LYS 102  10.149  30.195   8.035
   13    HZ3  LYS 102           HZ3      LYS 102  10.823  31.492   8.894

  No H/Q in entry =          13
  In of MODEL   71
    1    H    ALA 103           H        ALA 103  10.179  28.172   8.052
    2    HA   ALA 103           HA       ALA 103  11.133  29.556   5.976
    3    HB2  ALA 103           HB1      ALA 103  12.047  27.351   5.055
    4    HB1  ALA 103           HB2      ALA 103  11.158  26.569   6.360
    5    HB3  ALA 103           HB3      ALA 103  12.432  27.729   6.735

  No H/Q in entry =           5
  In of MODEL   71
    1    H1   LYS   3           H1       LYS   3 -31.019   6.474 -19.605
    2    H2   LYS   3           H3       LYS   3 -30.042   6.162 -20.960
    3    H3   LYS   3           H2       LYS   3 -31.453   5.252 -20.702
    4    HA   LYS   3           HA       LYS   3 -30.471   3.850 -19.299
    5    HB2  LYS   3           HB2      LYS   3 -28.169   5.214 -20.647
    6    HB3  LYS   3           HB3      LYS   3 -27.862   4.004 -19.401
    7    HG2  LYS   3           HG2      LYS   3 -29.320   2.441 -20.739
    8    HG3  LYS   3           HG3      LYS   3 -29.258   3.636 -22.034
    9    HD2  LYS   3           HD2      LYS   3 -26.777   3.475 -21.995
   10    HD3  LYS   3           HD3      LYS   3 -26.915   2.183 -20.803
   11    HE2  LYS   3           HE2      LYS   3 -28.444   1.031 -22.509
   12    HE3  LYS   3           HE3      LYS   3 -27.807   2.192 -23.672
   13    HZ3  LYS   3           HZ1      LYS   3 -26.034   0.929 -23.945
   14    HZ2  LYS   3           HZ2      LYS   3 -26.682  -0.224 -22.878
   15    HZ1  LYS   3           HZ3      LYS   3 -25.665   1.004 -22.289

  No H/Q in entry =          15
  In of MODEL   71
    1    H    LYS   4           H        LYS   4 -30.516   3.715 -17.237
    2    HA   LYS   4           HA       LYS   4 -29.733   5.993 -15.598
    3    HB2  LYS   4           HB2      LYS   4 -30.984   3.326 -14.884
    4    HB3  LYS   4           HB3      LYS   4 -30.731   4.664 -13.763
    5    HG2  LYS   4           HG2      LYS   4 -32.552   4.630 -16.176
    6    HG3  LYS   4           HG3      LYS   4 -33.033   4.696 -14.482
    7    HD2  LYS   4           HD2      LYS   4 -32.292   6.904 -14.225
    8    HD3  LYS   4           HD3      LYS   4 -31.260   6.821 -15.653
    9    HE2  LYS   4           HE2      LYS   4 -33.160   8.232 -16.111
   10    HE3  LYS   4           HE3      LYS   4 -33.274   6.758 -17.074
   11    HZ3  LYS   4           HZ1      LYS   4 -34.861   5.883 -15.517
   12    HZ2  LYS   4           HZ2      LYS   4 -35.388   7.387 -16.103
   13    HZ1  LYS   4           HZ3      LYS   4 -34.726   7.268 -14.543

  No H/Q in entry =          13
  In of MODEL   71
    1    H    HIS   5           H        HIS   5 -28.256   6.053 -14.013
    2    HA   HIS   5           HA       HIS   5 -26.013   4.176 -14.350
    3    HB2  HIS   5           HB2      HIS   5 -26.205   6.939 -13.152
    4    HB3  HIS   5           HB3      HIS   5 -24.743   5.954 -13.138
    5    HD1  HIS   5           HD1      HIS   5 -23.256   7.117 -14.739
    6    HD2  HIS   5           HD2      HIS   5 -27.077   6.571 -16.273
    7    HE1  HIS   5           HE1      HIS   5 -23.088   7.685 -17.193
    8    HE2  HIS   5           HE2      HIS   5 -25.418   7.341 -18.096

  No H/Q in entry =           8
  In of MODEL   71
    1    H    ILE   6           H        ILE   6 -25.811   2.603 -13.029
    2    HA   ILE   6           HA       ILE   6 -26.768   2.900 -10.261
    3    HB   ILE   6           HB       ILE   6 -26.004   0.412 -11.794
    4   HG12  ILE   6          HG12      ILE   6 -28.722   1.411 -10.933
    5   HG13  ILE   6          HG13      ILE   6 -28.084   1.553 -12.570
    6   HG23  ILE   6          HG21      ILE   6 -26.396  -0.826  -9.928
    7   HG22  ILE   6          HG22      ILE   6 -27.524   0.348  -9.247
    8   HG21  ILE   6          HG23      ILE   6 -25.788   0.646  -9.167
    9   HD13  ILE   6          HD11      ILE   6 -28.593  -0.557 -13.062
   10   HD12  ILE   6          HD12      ILE   6 -29.600  -0.513 -11.615
   11   HD11  ILE   6          HD13      ILE   6 -27.959  -1.157 -11.528

  No H/Q in entry =          11
  In of MODEL   71
    1    H    TYR   7           H        TYR   7 -24.988   3.508  -8.985
    2    HA   TYR   7           HA       TYR   7 -22.302   2.488  -9.674
    3    HB2  TYR   7           HB2      TYR   7 -23.205   4.948  -8.197
    4    HB3  TYR   7           HB3      TYR   7 -21.533   4.396  -8.242
    5    HD1  TYR   7           HD1      TYR   7 -22.608   3.466 -11.324
    6    HD2  TYR   7           HD2      TYR   7 -21.848   7.030  -9.113
    7    HE1  TYR   7           HE1      TYR   7 -22.159   4.679 -13.421
    8    HE2  TYR   7           HE2      TYR   7 -21.441   8.249 -11.202
    9    HH   TYR   7           HH       TYR   7 -21.672   8.160 -13.433

  No H/Q in entry =           9
  In of MODEL   71
    1    H    LEU   8           H        LEU   8 -21.361   1.120  -8.345
    2    HA   LEU   8           HA       LEU   8 -22.489   0.659  -5.655
    3    HB2  LEU   8           HB2      LEU   8 -20.833  -1.048  -7.491
    4    HB3  LEU   8           HB3      LEU   8 -21.019  -1.419  -5.777
    5    HG   LEU   8           HG       LEU   8 -23.504  -1.537  -6.187
    6   HD13  LEU   8          HD11      LEU   8 -23.618  -0.326  -8.301
    7   HD12  LEU   8          HD12      LEU   8 -24.186  -1.979  -8.532
    8   HD11  LEU   8          HD13      LEU   8 -22.570  -1.518  -9.067
    9   HD23  LEU   8          HD21      LEU   8 -22.284  -3.613  -7.879
   10   HD22  LEU   8          HD22      LEU   8 -23.368  -3.751  -6.496
   11   HD21  LEU   8          HD23      LEU   8 -21.653  -3.436  -6.243

  No H/Q in entry =          11
  In of MODEL   71
    1    H    PHE   9           H        PHE   9 -21.211   1.048  -3.878
    2    HA   PHE   9           HA       PHE   9 -18.405   1.915  -4.400
    3    HB2  PHE   9           HB2      PHE   9 -20.407   3.045  -2.450
    4    HB3  PHE   9           HB3      PHE   9 -18.688   3.414  -2.407
    5    HD1  PHE   9           HD1      PHE   9 -17.629   4.709  -4.183
    6    HD2  PHE   9           HD2      PHE   9 -21.841   3.891  -4.248
    7    HE1  PHE   9           HE1      PHE   9 -17.934   6.413  -5.954
    8    HE2  PHE   9           HE2      PHE   9 -22.146   5.607  -6.014
    9    HZ   PHE   9           HZ       PHE   9 -20.190   6.864  -6.873

  No H/Q in entry =           9
  In of MODEL   71
    1    H    SER  10           H        SER  10 -16.838   0.931  -3.294
    2    HA   SER  10           HA       SER  10 -17.052   0.067  -0.593
    3    HB2  SER  10           HB2      SER  10 -18.327  -1.779  -1.624
    4    HB3  SER  10           HB3      SER  10 -16.979  -2.091  -2.705
    5    HG   SER  10           HG       SER  10 -16.119  -3.201  -1.174

  No H/Q in entry =           5
  In of MODEL   71
    1    H    SER  11           H        SER  11 -15.033   0.127   0.225
    2    HA   SER  11           HA       SER  11 -12.834   0.918  -1.322
    3    HB2  SER  11           HB2      SER  11 -11.614   0.906   0.659
    4    HB3  SER  11           HB3      SER  11 -13.276   1.118   1.217
    5    HG   SER  11           HG       SER  11 -11.713  -0.671   2.076

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ALA  12           H        ALA  12 -14.114  -1.772  -2.082
    2    HA   ALA  12           HA       ALA  12 -11.562  -3.056  -2.648
    3    HB1  ALA  12           HB1      ALA  12 -13.777  -4.711  -1.433
    4    HB3  ALA  12           HB2      ALA  12 -12.435  -4.066  -0.489
    5    HB2  ALA  12           HB3      ALA  12 -12.121  -5.209  -1.795

  No H/Q in entry =           5
  In of MODEL   71
    1    H    GLY  13           H        GLY  13 -12.444  -1.994  -4.652
    2    HA3  GLY  13           HA2      GLY  13 -14.691  -2.759  -6.078
    3    HA2  GLY  13           HA3      GLY  13 -13.170  -2.260  -6.830

  No H/Q in entry =           3
  In of MODEL   71
    1    H    MET  14           H        MET  14 -11.667  -4.544  -5.749
    2    HA   MET  14           HA       MET  14 -11.841  -6.300  -7.884
    3    HB2  MET  14           HB2      MET  14  -9.931  -6.335  -6.326
    4    HB3  MET  14           HB3      MET  14 -10.937  -7.097  -5.094
    5    HG2  MET  14           HG2      MET  14  -9.641  -8.818  -6.223
    6    HG3  MET  14           HG3      MET  14 -11.328  -9.001  -6.707
    7    HE2  MET  14           HE1      MET  14  -7.728  -8.433  -9.254
    8    HE1  MET  14           HE2      MET  14  -8.050  -9.387  -7.809
    9    HE3  MET  14           HE3      MET  14  -7.790  -7.651  -7.667

  No H/Q in entry =           9
  In of MODEL   71
    1    H    SER  15           H        SER  15 -13.231  -6.942  -4.682
    2    HA   SER  15           HA       SER  15 -14.614  -9.299  -5.620
    3    HB2  SER  15           HB2      SER  15 -14.202  -9.432  -3.312
    4    HB3  SER  15           HB3      SER  15 -14.711  -7.769  -3.034
    5    HG   SER  15           HG       SER  15 -16.763  -8.367  -3.053

  No H/Q in entry =           5
  In of MODEL   71
    1    H    THR  16           H        THR  16 -15.576  -5.919  -5.025
    2    HA   THR  16           HA       THR  16 -18.395  -6.271  -5.498
    3    HB   THR  16           HB       THR  16 -16.726  -3.788  -6.031
    4    HG1  THR  16           HG1      THR  16 -18.007  -3.960  -3.629
    5   HG21  THR  16          HG21      THR  16 -19.263  -4.082  -6.663
    6   HG23  THR  16          HG22      THR  16 -18.726  -2.597  -5.856
    7   HG22  THR  16          HG23      THR  16 -19.512  -3.885  -4.932

  No H/Q in entry =           7
  In of MODEL   71
    1    H    SER  17           H        SER  17 -15.595  -5.757  -7.393
    2    HA   SER  17           HA       SER  17 -16.716  -5.003  -9.893
    3    HB2  SER  17           HB2      SER  17 -14.114  -6.378  -9.197
    4    HB3  SER  17           HB3      SER  17 -14.552  -5.935 -10.847
    5    HG   SER  17           HG       SER  17 -14.625  -4.043  -8.765

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LEU  18           H        LEU  18 -16.210  -8.153  -8.435
    2    HA   LEU  18           HA       LEU  18 -16.837  -9.649 -10.783
    3    HB2  LEU  18           HB2      LEU  18 -15.631 -10.622  -8.871
    4    HB3  LEU  18           HB3      LEU  18 -17.062 -10.406  -7.864
    5    HG   LEU  18           HG       LEU  18 -18.310 -11.943  -9.332
    6   HD11  LEU  18          HD11      LEU  18 -15.704 -11.901 -10.814
    7   HD13  LEU  18          HD12      LEU  18 -17.350 -11.821 -11.445
    8   HD12  LEU  18          HD13      LEU  18 -16.706 -13.351 -10.851
    9   HD23  LEU  18          HD21      LEU  18 -15.735 -13.093  -8.298
   10   HD22  LEU  18          HD22      LEU  18 -17.238 -13.968  -8.597
   11   HD21  LEU  18          HD23      LEU  18 -17.168 -12.741  -7.331

  No H/Q in entry =          11
  In of MODEL   71
    1    H    LEU  19           H        LEU  19 -18.769  -8.389  -8.069
    2    HA   LEU  19           HA       LEU  19 -21.260  -9.523  -8.888
    3    HB2  LEU  19           HB2      LEU  19 -20.929  -8.669  -6.637
    4    HB3  LEU  19           HB3      LEU  19 -20.678  -7.044  -7.273
    5    HG   LEU  19           HG       LEU  19 -23.005  -6.871  -7.885
    6   HD12  LEU  19          HD11      LEU  19 -24.451  -8.862  -6.877
    7   HD11  LEU  19          HD12      LEU  19 -22.991  -9.779  -7.247
    8   HD13  LEU  19          HD13      LEU  19 -23.835  -8.911  -8.529
    9   HD23  LEU  19          HD21      LEU  19 -23.998  -7.062  -5.603
   10   HD22  LEU  19          HD22      LEU  19 -22.464  -6.194  -5.670
   11   HD21  LEU  19          HD23      LEU  19 -22.511  -7.857  -5.086

  No H/Q in entry =          11
  In of MODEL   71
    1    H    VAL  20           H        VAL  20 -19.700  -6.397  -9.600
    2    HA   VAL  20           HA       VAL  20 -21.795  -5.317 -11.165
    3    HB   VAL  20           HB       VAL  20 -18.794  -4.790 -11.305
    4   HG11  VAL  20          HG11      VAL  20 -21.076  -3.394 -12.723
    5   HG13  VAL  20          HG12      VAL  20 -19.691  -4.196 -13.464
    6   HG12  VAL  20          HG13      VAL  20 -19.462  -2.706 -12.551
    7   HG21  VAL  20          HG21      VAL  20 -21.102  -3.433  -9.958
    8   HG23  VAL  20          HG22      VAL  20 -19.592  -2.588 -10.295
    9   HG22  VAL  20          HG23      VAL  20 -19.591  -4.011  -9.253

  No H/Q in entry =           9
  In of MODEL   71
    1    H    SER  21           H        SER  21 -19.085  -7.430 -12.195
    2    HA   SER  21           HA       SER  21 -19.878  -7.311 -14.943
    3    HB2  SER  21           HB2      SER  21 -18.485  -9.311 -15.274
    4    HB3  SER  21           HB3      SER  21 -17.627  -8.078 -14.354
    5    HG   SER  21           HG       SER  21 -18.143  -9.224 -12.471

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LYS  22           H        LYS  22 -20.979  -9.464 -12.359
    2    HA   LYS  22           HA       LYS  22 -22.560 -11.057 -14.169
    3    HB2  LYS  22           HB2      LYS  22 -22.801 -10.688 -11.180
    4    HB3  LYS  22           HB3      LYS  22 -23.686 -11.879 -12.132
    5    HG2  LYS  22           HG2      LYS  22 -20.683 -11.800 -11.894
    6    HG3  LYS  22           HG3      LYS  22 -21.735 -12.799 -10.892
    7    HD2  LYS  22           HD2      LYS  22 -22.570 -13.919 -12.931
    8    HD3  LYS  22           HD3      LYS  22 -21.445 -12.958 -13.893
    9    HE2  LYS  22           HE2      LYS  22 -20.171 -14.837 -13.648
   10    HE3  LYS  22           HE3      LYS  22 -19.686 -13.992 -12.178
   11    HZ3  LYS  22           HZ1      LYS  22 -20.142 -16.144 -11.500
   12    HZ2  LYS  22           HZ2      LYS  22 -21.533 -16.275 -12.466
   13    HZ1  LYS  22           HZ3      LYS  22 -21.552 -15.293 -11.081

  No H/Q in entry =          13
  In of MODEL   71
    1    H    MET  23           H        MET  23 -23.212  -8.113 -12.310
    2    HA   MET  23           HA       MET  23 -26.022  -8.131 -12.805
    3    HB2  MET  23           HB2      MET  23 -24.122  -5.863 -12.248
    4    HB3  MET  23           HB3      MET  23 -25.863  -5.655 -12.420
    5    HG2  MET  23           HG2      MET  23 -26.277  -6.942 -10.444
    6    HG3  MET  23           HG3      MET  23 -24.576  -7.392 -10.323
    7    HE2  MET  23           HE1      MET  23 -26.786  -3.685  -9.139
    8    HE1  MET  23           HE2      MET  23 -27.067  -4.652 -10.585
    9    HE3  MET  23           HE3      MET  23 -26.001  -3.249 -10.659

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ARG  24           H        ARG  24 -23.243  -6.772 -14.605
    2    HA   ARG  24           HA       ARG  24 -24.717  -5.444 -16.603
    3    HB2  ARG  24           HB2      ARG  24 -22.211  -5.210 -16.153
    4    HB3  ARG  24           HB3      ARG  24 -22.001  -6.730 -16.988
    5    HG2  ARG  24           HG2      ARG  24 -22.942  -5.727 -19.080
    6    HG3  ARG  24           HG3      ARG  24 -23.111  -4.177 -18.215
    7    HD2  ARG  24           HD2      ARG  24 -20.506  -5.738 -18.555
    8    HD3  ARG  24           HD3      ARG  24 -20.982  -4.336 -19.504
    9    HE   ARG  24           HE       ARG  24 -21.074  -3.284 -17.090
   10   HH21  ARG  24          HH11      ARG  24 -19.517  -1.662 -17.086
   11   HH22  ARG  24          HH12      ARG  24 -17.862  -2.063 -17.394
   12   HH11  ARG  24          HH21      ARG  24 -18.724  -5.351 -18.380
   13   HH12  ARG  24          HH22      ARG  24 -17.403  -4.250 -18.148

  No H/Q in entry =          13
  In of MODEL   71
    1    H    ALA  25           H        ALA  25 -23.674  -8.807 -16.320
    2    HA   ALA  25           HA       ALA  25 -24.331  -9.631 -18.952
    3    HB1  ALA  25           HB1      ALA  25 -23.681 -11.677 -18.252
    4    HB3  ALA  25           HB2      ALA  25 -24.732 -11.627 -16.838
    5    HB2  ALA  25           HB3      ALA  25 -23.158 -10.837 -16.793

  No H/Q in entry =           5
  In of MODEL   71
    1    H    GLN  26           H        GLN  26 -26.148  -9.616 -15.921
    2    HA   GLN  26           HA       GLN  26 -28.523 -10.766 -16.927
    3    HB2  GLN  26           HB2      GLN  26 -27.960  -9.024 -14.546
    4    HB3  GLN  26           HB3      GLN  26 -29.541  -9.711 -14.890
    5    HG2  GLN  26           HG2      GLN  26 -26.989 -11.229 -14.426
    6    HG3  GLN  26           HG3      GLN  26 -28.344 -11.090 -13.311
    7   HE21  GLN  26          HE21      GLN  26 -27.183 -13.286 -14.585
    8   HE22  GLN  26          HE22      GLN  26 -28.253 -14.311 -15.375

  No H/Q in entry =           8
  In of MODEL   71
    1    H    ALA  27           H        ALA  27 -27.505  -7.391 -16.548
    2    HA   ALA  27           HA       ALA  27 -29.970  -6.240 -17.326
    3    HB1  ALA  27           HB1      ALA  27 -28.125  -4.967 -16.221
    4    HB3  ALA  27           HB2      ALA  27 -28.702  -4.190 -17.697
    5    HB2  ALA  27           HB3      ALA  27 -27.188  -5.094 -17.710

  No H/Q in entry =           5
  In of MODEL   71
    1    H    GLU  28           H        GLU  28 -27.306  -7.533 -19.201
    2    HA   GLU  28           HA       GLU  28 -28.224  -6.476 -21.720
    3    HB2  GLU  28           HB2      GLU  28 -25.861  -7.215 -21.103
    4    HB3  GLU  28           HB3      GLU  28 -26.446  -8.866 -21.299
    5    HG2  GLU  28           HG2      GLU  28 -25.289  -8.123 -23.272
    6    HG3  GLU  28           HG3      GLU  28 -26.994  -8.405 -23.615

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LYS  29           H        LYS  29 -28.460  -9.574 -20.056
    2    HA   LYS  29           HA       LYS  29 -29.806 -11.016 -22.053
    3    HB2  LYS  29           HB2      LYS  29 -28.774 -12.021 -20.051
    4    HB3  LYS  29           HB3      LYS  29 -30.025 -11.281 -19.052
    5    HG2  LYS  29           HG2      LYS  29 -31.722 -12.614 -20.112
    6    HG3  LYS  29           HG3      LYS  29 -30.543 -13.281 -21.239
    7    HD2  LYS  29           HD2      LYS  29 -29.424 -14.472 -19.507
    8    HD3  LYS  29           HD3      LYS  29 -30.305 -13.606 -18.251
    9    HE2  LYS  29           HE2      LYS  29 -31.115 -15.937 -18.605
   10    HE3  LYS  29           HE3      LYS  29 -32.365 -14.714 -18.848
   11    HZ1  LYS  29           HZ1      LYS  29 -31.812 -14.866 -21.276
   12    HZ3  LYS  29           HZ2      LYS  29 -32.563 -16.234 -20.606
   13    HZ2  LYS  29           HZ3      LYS  29 -30.894 -16.246 -20.909

  No H/Q in entry =          13
  In of MODEL   71
    1    H    TYR  30           H        TYR  30 -31.137  -8.872 -19.549
    2    HA   TYR  30           HA       TYR  30 -33.815  -9.259 -20.780
    3    HB2  TYR  30           HB2      TYR  30 -33.124  -8.117 -18.064
    4    HB3  TYR  30           HB3      TYR  30 -34.750  -8.335 -18.711
    5    HD1  TYR  30           HD1      TYR  30 -35.717 -10.605 -18.917
    6    HD2  TYR  30           HD2      TYR  30 -31.860  -9.974 -17.227
    7    HE1  TYR  30           HE1      TYR  30 -35.681 -12.933 -18.116
    8    HE2  TYR  30           HE2      TYR  30 -31.824 -12.287 -16.431
    9    HH   TYR  30           HH       TYR  30 -33.525 -14.609 -17.514

  No H/Q in entry =           9
  In of MODEL   71
    1    H    GLU  31           H        GLU  31 -31.604  -7.322 -21.591
    2    HA   GLU  31           HA       GLU  31 -31.481  -5.169 -22.418
    3    HB2  GLU  31           HB2      GLU  31 -34.394  -5.814 -22.920
    4    HB3  GLU  31           HB3      GLU  31 -33.523  -4.469 -23.655
    5    HG2  GLU  31           HG2      GLU  31 -32.089  -5.944 -24.849
    6    HG3  GLU  31           HG3      GLU  31 -32.685  -7.342 -23.955

  No H/Q in entry =           6
  In of MODEL   71
    1    H    VAL  32           H        VAL  32 -31.668  -5.058 -19.686
    2    HA   VAL  32           HA       VAL  32 -33.478  -2.899 -19.024
    3    HB   VAL  32           HB       VAL  32 -31.103  -3.947 -17.450
    4   HG12  VAL  32          HG11      VAL  32 -32.613  -3.084 -15.550
    5   HG11  VAL  32          HG12      VAL  32 -33.429  -2.162 -16.814
    6   HG13  VAL  32          HG13      VAL  32 -31.714  -1.899 -16.500
    7   HG21  VAL  32          HG21      VAL  32 -32.915  -5.627 -18.129
    8   HG23  VAL  32          HG22      VAL  32 -33.930  -4.773 -16.967
    9   HG22  VAL  32          HG23      VAL  32 -32.429  -5.531 -16.436

  No H/Q in entry =           9
  In of MODEL   71
    1    HA   PRO  33           HA       PRO  33 -30.384  -0.045 -20.713
    2    HB2  PRO  33           HB2      PRO  33 -31.843   2.212 -20.588
    3    HB3  PRO  33           HB3      PRO  33 -32.345   0.919 -21.678
    4    HG2  PRO  33           HG2      PRO  33 -33.292   1.462 -18.863
    5    HG3  PRO  33           HG3      PRO  33 -34.266   1.273 -20.322
    6    HD2  PRO  33           HD2      PRO  33 -33.852  -0.807 -18.654
    7    HD3  PRO  33           HD3      PRO  33 -33.926  -1.049 -20.399

  No H/Q in entry =           7
  In of MODEL   71
    1    H    VAL  34           H        VAL  34 -29.126  -0.616 -18.768
    2    HA   VAL  34           HA       VAL  34 -28.782   1.805 -17.125
    3    HB   VAL  34           HB       VAL  34 -28.227   0.334 -15.187
    4   HG12  VAL  34          HG11      VAL  34 -30.658  -0.484 -14.870
    5   HG11  VAL  34          HG12      VAL  34 -30.962   0.281 -16.428
    6   HG13  VAL  34          HG13      VAL  34 -30.383   1.246 -15.071
    7   HG21  VAL  34          HG21      VAL  34 -28.466  -1.691 -17.191
    8   HG23  VAL  34          HG22      VAL  34 -29.525  -2.026 -15.821
    9   HG22  VAL  34          HG23      VAL  34 -27.800  -1.778 -15.560

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ILE  35           H        ILE  35 -26.794   2.197 -16.293
    2    HA   ILE  35           HA       ILE  35 -24.523   0.815 -17.561
    3    HB   ILE  35           HB       ILE  35 -24.857   3.714 -16.753
    4   HG12  ILE  35          HG12      ILE  35 -23.912   2.382 -19.299
    5   HG13  ILE  35          HG13      ILE  35 -25.528   3.039 -19.034
    6   HG21  ILE  35          HG21      ILE  35 -22.330   2.124 -17.069
    7   HG23  ILE  35          HG22      ILE  35 -22.754   3.315 -15.840
    8   HG22  ILE  35          HG23      ILE  35 -22.365   3.838 -17.478
    9   HD11  ILE  35          HD11      ILE  35 -24.076   5.203 -18.442
   10   HD13  ILE  35          HD12      ILE  35 -24.627   4.830 -20.076
   11   HD12  ILE  35          HD13      ILE  35 -22.981   4.424 -19.585

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ILE  36           H        ILE  36 -23.310  -0.233 -15.964
    2    HA   ILE  36           HA       ILE  36 -23.727   0.396 -13.094
    3    HB   ILE  36           HB       ILE  36 -22.964  -2.327 -14.201
    4   HG12  ILE  36          HG12      ILE  36 -25.750  -1.458 -13.428
    5   HG13  ILE  36          HG13      ILE  36 -25.183  -1.452 -15.098
    6   HG23  ILE  36          HG21      ILE  36 -23.325  -3.144 -12.085
    7   HG22  ILE  36          HG22      ILE  36 -24.422  -1.836 -11.644
    8   HG21  ILE  36          HG23      ILE  36 -22.684  -1.542 -11.721
    9   HD13  ILE  36          HD11      ILE  36 -25.398  -3.662 -15.301
   10   HD12  ILE  36          HD12      ILE  36 -26.456  -3.515 -13.898
   11   HD11  ILE  36          HD13      ILE  36 -24.766  -3.972 -13.684

  No H/Q in entry =          11
  In of MODEL   71
    1    H    GLU  37           H        GLU  37 -21.928   0.986 -11.996
    2    HA   GLU  37           HA       GLU  37 -19.260   0.130 -12.921
    3    HB2  GLU  37           HB2      GLU  37 -20.096   2.941 -12.224
    4    HB3  GLU  37           HB3      GLU  37 -18.418   2.412 -12.355
    5    HG2  GLU  37           HG2      GLU  37 -18.700   1.979 -14.706
    6    HG3  GLU  37           HG3      GLU  37 -20.412   2.390 -14.602

  No H/Q in entry =           6
  In of MODEL   71
    1    H    ALA  38           H        ALA  38 -17.772  -0.137 -11.243
    2    HA   ALA  38           HA       ALA  38 -18.789   0.067  -8.469
    3    HB1  ALA  38           HB1      ALA  38 -17.123  -1.910  -9.898
    4    HB3  ALA  38           HB2      ALA  38 -18.172  -2.121  -8.496
    5    HB2  ALA  38           HB3      ALA  38 -16.545  -1.473  -8.290

  No H/Q in entry =           5
  In of MODEL   71
    1    H    PHE  39           H        PHE  39 -17.518   1.253  -7.001
    2    HA   PHE  39           HA       PHE  39 -14.972   2.401  -7.909
    3    HB2  PHE  39           HB2      PHE  39 -17.350   3.939  -6.887
    4    HB3  PHE  39           HB3      PHE  39 -15.708   4.574  -6.804
    5    HD1  PHE  39           HD1      PHE  39 -14.396   4.544  -9.067
    6    HD2  PHE  39           HD2      PHE  39 -18.644   4.434  -8.708
    7    HE1  PHE  39           HE1      PHE  39 -14.602   5.419 -11.376
    8    HE2  PHE  39           HE2      PHE  39 -18.866   5.300 -11.010
    9    HZ   PHE  39           HZ       PHE  39 -16.850   5.767 -12.363

  No H/Q in entry =           9
  In of MODEL   71
    1    HA   PRO  40           HA       PRO  40 -14.033   1.633  -3.624
    2    HB2  PRO  40           HB2      PRO  40 -12.223   3.613  -3.027
    3    HB3  PRO  40           HB3      PRO  40 -11.811   2.271  -4.096
    4    HG2  PRO  40           HG2      PRO  40 -12.784   5.026  -4.841
    5    HG3  PRO  40           HG3      PRO  40 -11.376   4.158  -5.451
    6    HD2  PRO  40           HD2      PRO  40 -13.605   4.109  -6.853
    7    HD3  PRO  40           HD3      PRO  40 -12.679   2.622  -6.662

  No H/Q in entry =           7
  In of MODEL   71
    1    H    GLU  41           H        GLU  41 -14.628   2.626  -1.494
    2    HA   GLU  41           HA       GLU  41 -16.838   4.373  -1.472
    3    HB2  GLU  41           HB2      GLU  41 -16.697   4.289   0.900
    4    HB3  GLU  41           HB3      GLU  41 -16.217   2.699   0.305
    5    HG2  GLU  41           HG2      GLU  41 -13.852   3.319   0.641
    6    HG3  GLU  41           HG3      GLU  41 -14.373   4.866   1.305

  No H/Q in entry =           6
  In of MODEL   71
    1    H    THR  42           H        THR  42 -13.489   5.225  -1.537
    2    HA   THR  42           HA       THR  42 -13.788   7.794  -0.328
    3    HB   THR  42           HB       THR  42 -11.625   8.325  -1.428
    4    HG1  THR  42           HG1      THR  42 -12.300   5.963  -2.791
    5   HG21  THR  42          HG21      THR  42 -11.858   5.606  -0.122
    6   HG23  THR  42          HG22      THR  42 -11.512   7.144   0.671
    7   HG22  THR  42          HG23      THR  42 -10.324   6.425  -0.414

  No H/Q in entry =           7
  In of MODEL   71
    1    H    LEU  43           H        LEU  43 -14.725   6.713  -3.424
    2    HA   LEU  43           HA       LEU  43 -14.928   9.488  -4.398
    3    HB2  LEU  43           HB2      LEU  43 -15.357   6.850  -5.789
    4    HB3  LEU  43           HB3      LEU  43 -15.522   8.434  -6.544
    5    HG   LEU  43           HG       LEU  43 -12.946   7.249  -5.537
    6   HD11  LEU  43          HD11      LEU  43 -14.168   6.307  -7.658
    7   HD13  LEU  43          HD12      LEU  43 -12.439   6.649  -7.703
    8   HD12  LEU  43          HD13      LEU  43 -13.581   7.794  -8.401
    9   HD23  LEU  43          HD21      LEU  43 -12.112   9.201  -7.055
   10   HD22  LEU  43          HD22      LEU  43 -12.652   9.551  -5.412
   11   HD21  LEU  43          HD23      LEU  43 -13.721   9.867  -6.777

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ALA  44           H        ALA  44 -16.902   7.703  -2.534
    2    HA   ALA  44           HA       ALA  44 -19.387   7.608  -3.847
    3    HB2  ALA  44           HB1      ALA  44 -19.262   6.493  -1.749
    4    HB3  ALA  44           HB2      ALA  44 -20.343   7.859  -1.475
    5    HB1  ALA  44           HB3      ALA  44 -18.668   7.936  -0.929

  No H/Q in entry =           5
  In of MODEL   71
    1    H    GLY  45           H        GLY  45 -17.908  10.383  -2.324
    2    HA3  GLY  45           HA2      GLY  45 -20.318  11.929  -2.679
    3    HA2  GLY  45           HA3      GLY  45 -18.760  12.525  -2.109

  No H/Q in entry =           3
  In of MODEL   71
    1    H    GLU  46           H        GLU  46 -17.255  11.555  -4.403
    2    HA   GLU  46           HA       GLU  46 -17.856  13.780  -6.174
    3    HB2  GLU  46           HB2      GLU  46 -15.540  13.276  -5.586
    4    HB3  GLU  46           HB3      GLU  46 -15.710  11.653  -6.253
    5    HG2  GLU  46           HG2      GLU  46 -14.504  12.965  -7.822
    6    HG3  GLU  46           HG3      GLU  46 -16.116  12.683  -8.480

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LYS  47           H        LYS  47 -17.806  10.259  -6.603
    2    HA   LYS  47           HA       LYS  47 -18.909  10.494  -9.274
    3    HB2  LYS  47           HB2      LYS  47 -18.393   8.091  -7.516
    4    HB3  LYS  47           HB3      LYS  47 -18.951   8.015  -9.187
    5    HG2  LYS  47           HG2      LYS  47 -16.384   9.352  -8.420
    6    HG3  LYS  47           HG3      LYS  47 -16.483   7.626  -8.768
    7    HD2  LYS  47           HD2      LYS  47 -17.436   8.134 -10.970
    8    HD3  LYS  47           HD3      LYS  47 -17.305   9.857 -10.623
    9    HE2  LYS  47           HE2      LYS  47 -14.885   9.645 -10.437
   10    HE3  LYS  47           HE3      LYS  47 -15.005   7.914 -10.748
   11    HZ2  LYS  47           HZ1      LYS  47 -14.444   9.396 -12.690
   12    HZ1  LYS  47           HZ2      LYS  47 -16.056   9.925 -12.637
   13    HZ3  LYS  47           HZ3      LYS  47 -15.707   8.286 -12.922

  No H/Q in entry =          13
  In of MODEL   71
    1    H    GLY  48           H        GLY  48 -20.234   9.769  -6.120
    2    HA3  GLY  48           HA2      GLY  48 -22.645   8.628  -6.850
    3    HA2  GLY  48           HA3      GLY  48 -22.395   9.620  -5.414

  No H/Q in entry =           3
  In of MODEL   71
    1    H    GLN  49           H        GLN  49 -21.772  12.028  -6.992
    2    HA   GLN  49           HA       GLN  49 -24.310  13.187  -7.128
    3    HB2  GLN  49           HB2      GLN  49 -21.755  14.001  -8.500
    4    HB3  GLN  49           HB3      GLN  49 -23.198  14.994  -8.412
    5    HG2  GLN  49           HG2      GLN  49 -23.030  15.019  -5.976
    6    HG3  GLN  49           HG3      GLN  49 -21.599  14.005  -6.061
    7   HE21  GLN  49          HE21      GLN  49 -21.435  16.233  -4.793
    8   HE22  GLN  49          HE22      GLN  49 -20.491  17.471  -5.447

  No H/Q in entry =           8
  In of MODEL   71
    1    H    ASN  50           H        ASN  50 -22.676  11.272  -9.518
    2    HA   ASN  50           HA       ASN  50 -24.550  12.176 -11.595
    3    HB2  ASN  50           HB2      ASN  50 -22.001  10.587 -11.835
    4    HB3  ASN  50           HB3      ASN  50 -23.048  11.030 -13.175
    5   HD21  ASN  50          HD21      ASN  50 -20.390  11.828 -11.576
    6   HD22  ASN  50          HD22      ASN  50 -20.126  13.458 -11.922

  No H/Q in entry =           6
  In of MODEL   71
    1    H    ALA  51           H        ALA  51 -24.572   9.824  -9.344
    2    HA   ALA  51           HA       ALA  51 -25.406   7.692 -11.164
    3    HB2  ALA  51           HB1      ALA  51 -24.842   6.335  -9.478
    4    HB3  ALA  51           HB2      ALA  51 -25.944   7.166  -8.382
    5    HB1  ALA  51           HB3      ALA  51 -24.295   7.756  -8.586

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ASP  52           H        ASP  52 -27.431   6.677 -11.015
    2    HA   ASP  52           HA       ASP  52 -29.573   8.554 -10.345
    3    HB2  ASP  52           HB2      ASP  52 -29.438   6.043 -12.011
    4    HB3  ASP  52           HB3      ASP  52 -30.966   6.807 -11.572

  No H/Q in entry =           4
  In of MODEL   71
    1    H    VAL  53           H        VAL  53 -28.026   5.636  -9.328
    2    HA   VAL  53           HA       VAL  53 -29.454   5.796  -6.808
    3    HB   VAL  53           HB       VAL  53 -30.891   4.180  -8.043
    4   HG11  VAL  53          HG11      VAL  53 -29.167   3.283  -9.571
    5   HG13  VAL  53          HG12      VAL  53 -30.023   2.007  -8.706
    6   HG12  VAL  53          HG13      VAL  53 -28.402   2.477  -8.202
    7   HG23  VAL  53          HG21      VAL  53 -30.103   2.191  -6.350
    8   HG22  VAL  53          HG22      VAL  53 -31.204   3.518  -5.982
    9   HG21  VAL  53          HG23      VAL  53 -29.492   3.656  -5.582

  No H/Q in entry =           9
  In of MODEL   71
    1    H    VAL  54           H        VAL  54 -28.144   5.340  -5.157
    2    HA   VAL  54           HA       VAL  54 -25.405   4.433  -5.777
    3    HB   VAL  54           HB       VAL  54 -26.429   6.236  -3.527
    4   HG11  VAL  54          HG11      VAL  54 -23.882   4.764  -3.824
    5   HG13  VAL  54          HG12      VAL  54 -24.615   5.461  -2.381
    6   HG12  VAL  54          HG13      VAL  54 -23.692   6.483  -3.482
    7   HG22  VAL  54          HG21      VAL  54 -25.537   8.030  -4.632
    8   HG21  VAL  54          HG22      VAL  54 -26.110   7.049  -5.981
    9   HG23  VAL  54          HG23      VAL  54 -24.401   7.040  -5.550

  No H/Q in entry =           9
  In of MODEL   71
    1    H    LEU  55           H        LEU  55 -24.850   2.500  -5.133
    2    HA   LEU  55           HA       LEU  55 -26.377   1.225  -2.949
    3    HB2  LEU  55           HB2      LEU  55 -24.853   0.021  -5.248
    4    HB3  LEU  55           HB3      LEU  55 -25.629  -0.895  -3.955
    5    HG   LEU  55           HG       LEU  55 -27.040   0.718  -6.069
    6   HD13  LEU  55          HD11      LEU  55 -26.785  -1.143  -7.287
    7   HD12  LEU  55          HD12      LEU  55 -27.755  -1.996  -6.086
    8   HD11  LEU  55          HD13      LEU  55 -25.998  -1.967  -5.943
    9   HD23  LEU  55          HD21      LEU  55 -28.369  -1.197  -4.206
   10   HD22  LEU  55          HD22      LEU  55 -29.038   0.198  -5.053
   11   HD21  LEU  55          HD23      LEU  55 -28.007   0.434  -3.643

  No H/Q in entry =          11
  In of MODEL   71
    1    H    LEU  56           H        LEU  56 -25.232   0.610  -1.147
    2    HA   LEU  56           HA       LEU  56 -22.289   0.943  -1.209
    3    HB2  LEU  56           HB2      LEU  56 -24.087   0.774   1.197
    4    HB3  LEU  56           HB3      LEU  56 -22.369   1.168   1.179
    5    HG   LEU  56           HG       LEU  56 -24.635   2.893   0.220
    6   HD11  LEU  56          HD11      LEU  56 -23.520   2.492   2.737
    7   HD13  LEU  56          HD12      LEU  56 -24.483   3.881   2.232
    8   HD12  LEU  56          HD13      LEU  56 -22.724   3.949   2.138
    9   HD23  LEU  56          HD21      LEU  56 -22.656   4.550   0.016
   10   HD22  LEU  56          HD22      LEU  56 -23.067   3.459  -1.308
   11   HD21  LEU  56          HD23      LEU  56 -21.717   3.079  -0.238

  No H/Q in entry =          11
  In of MODEL   71
    1    H    GLY  57           H        GLY  57 -20.942  -0.716  -0.676
    2    HA3  GLY  57           HA2      GLY  57 -21.922  -3.382  -0.865
    3    HA2  GLY  57           HA3      GLY  57 -20.289  -2.921  -0.393

  No H/Q in entry =           3
  In of MODEL   71
    1    HA   PRO  58           HA       PRO  58 -23.105  -3.892   3.329
    2    HB2  PRO  58           HB2      PRO  58 -22.474  -6.509   3.940
    3    HB3  PRO  58           HB3      PRO  58 -23.853  -6.074   2.930
    4    HG2  PRO  58           HG2      PRO  58 -21.149  -7.015   2.136
    5    HG3  PRO  58           HG3      PRO  58 -22.724  -7.442   1.471
    6    HD2  PRO  58           HD2      PRO  58 -21.082  -5.662   0.239
    7    HD3  PRO  58           HD3      PRO  58 -22.839  -5.539   0.143

  No H/Q in entry =           7
  In of MODEL   71
    1    H    GLN  59           H        GLN  59 -19.747  -4.438   2.712
    2    HA   GLN  59           HA       GLN  59 -18.982  -4.467   5.469
    3    HB2  GLN  59           HB2      GLN  59 -17.252  -3.448   3.228
    4    HB3  GLN  59           HB3      GLN  59 -16.754  -4.172   4.743
    5    HG2  GLN  59           HG2      GLN  59 -16.396  -5.933   3.355
    6    HG3  GLN  59           HG3      GLN  59 -18.072  -6.250   3.771
    7   HE21  GLN  59          HE21      GLN  59 -18.660  -7.052   2.062
    8   HE22  GLN  59          HE22      GLN  59 -18.880  -6.668   0.458

  No H/Q in entry =           8
  In of MODEL   71
    1    H    ILE  60           H        ILE  60 -19.869  -1.900   3.260
    2    HA   ILE  60           HA       ILE  60 -18.967   0.042   5.298
    3    HB   ILE  60           HB       ILE  60 -18.684   1.698   3.657
    4   HG12  ILE  60          HG12      ILE  60 -20.228  -0.020   1.713
    5   HG13  ILE  60          HG13      ILE  60 -20.850   1.410   2.536
    6   HG21  ILE  60          HG21      ILE  60 -17.874  -0.941   2.508
    7   HG23  ILE  60          HG22      ILE  60 -16.904   0.201   3.436
    8   HG22  ILE  60          HG23      ILE  60 -17.408   0.603   1.796
    9   HD12  ILE  60          HD11      ILE  60 -20.022   1.663   0.100
   10   HD11  ILE  60          HD12      ILE  60 -18.403   1.577   0.795
   11   HD13  ILE  60          HD13      ILE  60 -19.504   2.866   1.280

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ALA  61           H        ALA  61 -21.456  -1.490   5.379
    2    HA   ALA  61           HA       ALA  61 -23.647   0.221   4.925
    3    HB1  ALA  61           HB1      ALA  61 -24.889  -1.238   6.259
    4    HB2  ALA  61           HB2      ALA  61 -23.497  -1.656   7.257
    5    HB3  ALA  61           HB3      ALA  61 -23.612  -2.263   5.605

  No H/Q in entry =           5
  In of MODEL   71
    1    H    TYR  62           H        TYR  62 -21.431   0.067   7.715
    2    HA   TYR  62           HA       TYR  62 -22.943   1.762   9.388
    3    HB2  TYR  62           HB2      TYR  62 -20.887   2.147  10.611
    4    HB3  TYR  62           HB3      TYR  62 -20.989   0.446  10.156
    5    HD1  TYR  62           HD1      TYR  62 -19.461  -0.489   8.451
    6    HD2  TYR  62           HD2      TYR  62 -19.123   3.579   9.712
    7    HE1  TYR  62           HE1      TYR  62 -17.249  -0.343   7.372
    8    HE2  TYR  62           HE2      TYR  62 -16.896   3.719   8.634
    9    HH   TYR  62           HH       TYR  62 -15.566   2.687   7.107

  No H/Q in entry =           9
  In of MODEL   71
    1    H    MET  63           H        MET  63 -21.294   2.578   6.524
    2    HA   MET  63           HA       MET  63 -21.061   5.408   7.211
    3    HB2  MET  63           HB2      MET  63 -20.499   3.869   4.675
    4    HB3  MET  63           HB3      MET  63 -20.264   5.608   4.855
    5    HG2  MET  63           HG2      MET  63 -18.556   5.220   6.529
    6    HG3  MET  63           HG3      MET  63 -18.809   3.480   6.402
    7    HE2  MET  63           HE1      MET  63 -16.806   6.229   3.383
    8    HE1  MET  63           HE2      MET  63 -17.523   6.640   4.941
    9    HE3  MET  63           HE3      MET  63 -18.560   6.348   3.544

  No H/Q in entry =           9
  In of MODEL   71
    1    H    LEU  64           H        LEU  64 -23.670   3.609   6.260
    2    HA   LEU  64           HA       LEU  64 -24.855   5.050   4.183
    3    HB2  LEU  64           HB2      LEU  64 -25.767   2.966   5.110
    4    HB3  LEU  64           HB3      LEU  64 -26.199   3.822   6.589
    5    HG   LEU  64           HG       LEU  64 -27.871   5.112   5.365
    6   HD13  LEU  64          HD11      LEU  64 -27.591   5.342   3.131
    7   HD12  LEU  64          HD12      LEU  64 -28.275   3.721   2.992
    8   HD11  LEU  64          HD13      LEU  64 -26.526   3.940   3.042
    9   HD23  LEU  64          HD21      LEU  64 -28.455   2.310   4.625
   10   HD22  LEU  64          HD22      LEU  64 -29.414   3.468   5.547
   11   HD21  LEU  64          HD23      LEU  64 -28.054   2.645   6.311

  No H/Q in entry =          11
  In of MODEL   71
    1    HA   PRO  65           HA       PRO  65 -26.952   8.259   6.937
    2    HB2  PRO  65           HB2      PRO  65 -24.938   8.375   9.183
    3    HB3  PRO  65           HB3      PRO  65 -26.670   8.697   9.235
    4    HG2  PRO  65           HG2      PRO  65 -25.789   6.424  10.163
    5    HG3  PRO  65           HG3      PRO  65 -27.214   6.421   9.124
    6    HD2  PRO  65           HD2      PRO  65 -24.360   5.739   8.409
    7    HD3  PRO  65           HD3      PRO  65 -25.839   4.886   7.971

  No H/Q in entry =           7
  In of MODEL   71
    1    H    GLU  66           H        GLU  66 -23.397   8.120   6.995
    2    HA   GLU  66           HA       GLU  66 -23.036  10.910   6.583
    3    HB2  GLU  66           HB2      GLU  66 -21.281   8.559   5.929
    4    HB3  GLU  66           HB3      GLU  66 -20.792  10.240   5.716
    5    HG2  GLU  66           HG2      GLU  66 -20.984  10.620   8.084
    6    HG3  GLU  66           HG3      GLU  66 -21.548   8.966   8.321

  No H/Q in entry =           6
  In of MODEL   71
    1    H    ILE  67           H        ILE  67 -23.212   8.163   4.338
    2    HA   ILE  67           HA       ILE  67 -22.766   9.856   2.039
    3    HB   ILE  67           HB       ILE  67 -23.734   6.972   2.229
    4   HG12  ILE  67          HG12      ILE  67 -21.080   8.075   1.292
    5   HG13  ILE  67          HG13      ILE  67 -21.378   7.667   2.981
    6   HG21  ILE  67          HG21      ILE  67 -23.640   8.844  -0.001
    7   HG23  ILE  67          HG22      ILE  67 -24.304   7.212   0.056
    8   HG22  ILE  67          HG23      ILE  67 -22.591   7.454  -0.280
    9   HD12  ILE  67          HD11      ILE  67 -21.010   5.881   0.633
   10   HD11  ILE  67          HD12      ILE  67 -22.033   5.335   1.962
   11   HD13  ILE  67          HD13      ILE  67 -20.348   5.760   2.263

  No H/Q in entry =          11
  In of MODEL   71
    1    H    GLN  68           H        GLN  68 -25.653   8.876   3.687
    2    HA   GLN  68           HA       GLN  68 -27.467   9.848   1.719
    3    HB2  GLN  68           HB2      GLN  68 -27.718   9.503   4.703
    4    HB3  GLN  68           HB3      GLN  68 -29.027  10.130   3.715
    5    HG2  GLN  68           HG2      GLN  68 -29.113   8.098   2.443
    6    HG3  GLN  68           HG3      GLN  68 -27.675   7.487   3.240
    7   HE21  GLN  68          HE21      GLN  68 -29.887   6.184   3.118
    8   HE22  GLN  68          HE22      GLN  68 -30.722   5.753   4.537

  No H/Q in entry =           8
  In of MODEL   71
    1    H    ARG  69           H        ARG  69 -25.808  11.479   4.446
    2    HA   ARG  69           HA       ARG  69 -27.109  13.995   4.040
    3    HB2  ARG  69           HB2      ARG  69 -24.782  13.008   5.620
    4    HB3  ARG  69           HB3      ARG  69 -24.817  14.728   5.259
    5    HG2  ARG  69           HG2      ARG  69 -27.128  14.833   6.240
    6    HG3  ARG  69           HG3      ARG  69 -26.962  13.140   6.717
    7    HD2  ARG  69           HD2      ARG  69 -25.204  15.451   7.618
    8    HD3  ARG  69           HD3      ARG  69 -26.352  14.576   8.620
    9    HE   ARG  69           HE       ARG  69 -23.770  13.575   7.660
   10   HH21  ARG  69          HH11      ARG  69 -23.003  11.794   8.856
   11   HH22  ARG  69          HH12      ARG  69 -24.047  11.006   9.991
   12   HH11  ARG  69          HH21      ARG  69 -26.732  13.109   9.372
   13   HH12  ARG  69          HH22      ARG  69 -26.159  11.749  10.281

  No H/Q in entry =          13
  In of MODEL   71
    1    H    LEU  70           H        LEU  70 -24.282  12.510   2.670
    2    HA   LEU  70           HA       LEU  70 -23.112  14.843   1.492
    3    HB2  LEU  70           HB2      LEU  70 -22.177  12.501   2.087
    4    HB3  LEU  70           HB3      LEU  70 -22.812  12.049   0.506
    5    HG   LEU  70           HG       LEU  70 -21.186  13.375  -0.589
    6   HD11  LEU  70          HD11      LEU  70 -20.329  14.202   2.193
    7   HD13  LEU  70          HD12      LEU  70 -21.003  15.252   0.946
    8   HD12  LEU  70          HD13      LEU  70 -19.410  14.528   0.720
    9   HD22  LEU  70          HD21      LEU  70 -19.800  11.622  -0.360
   10   HD21  LEU  70          HD22      LEU  70 -20.732  11.127   1.052
   11   HD23  LEU  70          HD23      LEU  70 -19.318  12.161   1.248

  No H/Q in entry =          11
  In of MODEL   71
    1    H    LEU  71           H        LEU  71 -25.338  12.358   0.392
    2    HA   LEU  71           HA       LEU  71 -25.835  13.854  -2.124
    3    HB2  LEU  71           HB2      LEU  71 -26.120  10.878  -1.672
    4    HB3  LEU  71           HB3      LEU  71 -26.232  11.738  -3.206
    5    HG   LEU  71           HG       LEU  71 -23.705  11.684  -1.557
    6   HD12  LEU  71          HD11      LEU  71 -23.815  10.054  -3.985
    7   HD11  LEU  71          HD12      LEU  71 -24.836   9.461  -2.677
    8   HD13  LEU  71          HD13      LEU  71 -23.108   9.693  -2.410
    9   HD22  LEU  71          HD21      LEU  71 -23.764  13.500  -3.054
   10   HD21  LEU  71          HD22      LEU  71 -24.297  12.469  -4.381
   11   HD23  LEU  71          HD23      LEU  71 -22.678  12.278  -3.711

  No H/Q in entry =          11
  In of MODEL   71
    1    HA   PRO  72           HA       PRO  72 -29.699  13.520   0.516
    2    HB2  PRO  72           HB2      PRO  72 -30.483  16.105   0.433
    3    HB3  PRO  72           HB3      PRO  72 -29.182  15.617   1.519
    4    HG2  PRO  72           HG2      PRO  72 -28.975  16.800  -1.237
    5    HG3  PRO  72           HG3      PRO  72 -28.185  17.332   0.247
    6    HD2  PRO  72           HD2      PRO  72 -26.902  15.733  -1.522
    7    HD3  PRO  72           HD3      PRO  72 -26.644  15.561   0.213

  No H/Q in entry =           7
  In of MODEL   71
    1    H    ASN  73           H        ASN  73 -29.064  14.451  -2.703
    2    HA   ASN  73           HA       ASN  73 -31.935  14.226  -3.322
    3    HB2  ASN  73           HB2      ASN  73 -31.446  15.314  -5.423
    4    HB3  ASN  73           HB3      ASN  73 -30.888  16.280  -4.066
    5   HD21  ASN  73          HD21      ASN  73 -30.104  16.297  -6.748
    6   HD22  ASN  73          HD22      ASN  73 -28.443  16.085  -6.947

  No H/Q in entry =           6
  In of MODEL   71
    1    H    LYS  74           H        LYS  74 -30.020  11.913  -2.901
    2    HA   LYS  74           HA       LYS  74 -30.642  10.531  -5.444
    3    HB2  LYS  74           HB2      LYS  74 -28.111  10.165  -3.834
    4    HB3  LYS  74           HB3      LYS  74 -28.527   9.362  -5.349
    5    HG2  LYS  74           HG2      LYS  74 -28.171  12.323  -5.154
    6    HG3  LYS  74           HG3      LYS  74 -26.831  11.219  -5.463
    7    HD2  LYS  74           HD2      LYS  74 -27.986  10.321  -7.399
    8    HD3  LYS  74           HD3      LYS  74 -29.372  11.362  -7.074
    9    HE2  LYS  74           HE2      LYS  74 -28.088  13.329  -7.526
   10    HE3  LYS  74           HE3      LYS  74 -26.596  12.393  -7.623
   11    HZ2  LYS  74           HZ1      LYS  74 -28.057  13.036  -9.743
   12    HZ1  LYS  74           HZ2      LYS  74 -28.757  11.535  -9.363
   13    HZ3  LYS  74           HZ3      LYS  74 -27.089  11.644  -9.669

  No H/Q in entry =          13
  In of MODEL   71
    1    HA   PRO  75           HA       PRO  75 -32.114   7.596  -2.461
    2    HB2  PRO  75           HB2      PRO  75 -32.499   5.385  -4.036
    3    HB3  PRO  75           HB3      PRO  75 -33.584   6.774  -4.103
    4    HG2  PRO  75           HG2      PRO  75 -31.274   6.101  -5.885
    5    HG3  PRO  75           HG3      PRO  75 -32.911   6.589  -6.325
    6    HD2  PRO  75           HD2      PRO  75 -30.911   8.392  -6.294
    7    HD3  PRO  75           HD3      PRO  75 -32.527   8.844  -5.750

  No H/Q in entry =           7
  In of MODEL   71
    1    H    VAL  76           H        VAL  76 -30.688   6.499  -1.093
    2    HA   VAL  76           HA       VAL  76 -28.267   5.210  -2.209
    3    HB   VAL  76           HB       VAL  76 -28.497   6.691   0.447
    4   HG11  VAL  76          HG11      VAL  76 -26.188   5.327  -0.952
    5   HG13  VAL  76          HG12      VAL  76 -26.892   4.902   0.610
    6   HG12  VAL  76          HG13      VAL  76 -25.998   6.411   0.427
    7   HG22  VAL  76          HG21      VAL  76 -27.774   8.568  -0.447
    8   HG21  VAL  76          HG22      VAL  76 -28.344   7.886  -1.970
    9   HG23  VAL  76          HG23      VAL  76 -26.644   7.746  -1.523

  No H/Q in entry =           9
  In of MODEL   71
    1    H    GLU  77           H        GLU  77 -28.115   3.052  -1.592
    2    HA   GLU  77           HA       GLU  77 -28.914   2.296   1.067
    3    HB2  GLU  77           HB2      GLU  77 -30.574   0.698   0.548
    4    HB3  GLU  77           HB3      GLU  77 -31.079   2.236  -0.154
    5    HG2  GLU  77           HG2      GLU  77 -30.503   1.454  -2.343
    6    HG3  GLU  77           HG3      GLU  77 -29.905  -0.060  -1.670

  No H/Q in entry =           6
  In of MODEL   71
    1    H    VAL  78           H        VAL  78 -28.649   0.201   1.730
    2    HA   VAL  78           HA       VAL  78 -26.012  -0.656   0.833
    3    HB   VAL  78           HB       VAL  78 -27.736  -1.481   3.208
    4   HG11  VAL  78          HG11      VAL  78 -25.441  -2.784   2.075
    5   HG13  VAL  78          HG12      VAL  78 -26.356  -3.223   3.519
    6   HG12  VAL  78          HG13      VAL  78 -25.001  -2.103   3.640
    7   HG22  VAL  78          HG21      VAL  78 -26.230  -0.162   4.536
    8   HG21  VAL  78          HG22      VAL  78 -26.941   0.828   3.261
    9   HG23  VAL  78          HG23      VAL  78 -25.282   0.248   3.107

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ILE  79           H        ILE  79 -25.539  -2.581  -0.071
    2    HA   ILE  79           HA       ILE  79 -27.650  -3.998  -1.405
    3    HB   ILE  79           HB       ILE  79 -24.676  -4.616  -1.197
    4   HG12  ILE  79          HG12      ILE  79 -26.288  -3.467  -3.481
    5   HG13  ILE  79          HG13      ILE  79 -25.378  -2.483  -2.333
    6   HG22  ILE  79          HG21      ILE  79 -25.824  -5.767  -3.507
    7   HG21  ILE  79          HG22      ILE  79 -26.819  -6.254  -2.135
    8   HG23  ILE  79          HG23      ILE  79 -25.087  -6.587  -2.131
    9   HD13  ILE  79          HD11      ILE  79 -23.976  -2.644  -4.158
   10   HD12  ILE  79          HD12      ILE  79 -24.369  -4.341  -4.433
   11   HD11  ILE  79          HD13      ILE  79 -23.365  -3.880  -3.058

  No H/Q in entry =          11
  In of MODEL   71
    1    H    ASP  80           H        ASP  80 -28.571  -5.893  -0.814
    2    HA   ASP  80           HA       ASP  80 -28.533  -6.787   1.834
    3    HB2  ASP  80           HB2      ASP  80 -30.312  -7.312   0.205
    4    HB3  ASP  80           HB3      ASP  80 -29.190  -8.358  -0.668

  No H/Q in entry =           4
  In of MODEL   71
    1    H    SER  81           H        SER  81 -27.029  -7.967   2.961
    2    HA   SER  81           HA       SER  81 -24.560  -8.728   1.761
    3    HB2  SER  81           HB2      SER  81 -24.031  -9.769   3.930
    4    HB3  SER  81           HB3      SER  81 -24.681  -8.143   4.141
    5    HG   SER  81           HG       SER  81 -26.770  -9.495   4.257

  No H/Q in entry =           5
  In of MODEL   71
    1    H    LEU  82           H        LEU  82 -27.333 -10.734   2.099
    2    HA   LEU  82           HA       LEU  82 -25.862 -13.150   1.579
    3    HB2  LEU  82           HB2      LEU  82 -28.778 -12.442   1.338
    4    HB3  LEU  82           HB3      LEU  82 -28.127 -14.066   1.122
    5    HG   LEU  82           HG       LEU  82 -27.992 -12.493   3.676
    6   HD13  LEU  82          HD11      LEU  82 -30.297 -13.055   3.185
    7   HD12  LEU  82          HD12      LEU  82 -29.701 -14.162   4.425
    8   HD11  LEU  82          HD13      LEU  82 -29.841 -14.703   2.752
    9   HD23  LEU  82          HD21      LEU  82 -27.489 -14.911   4.457
   10   HD22  LEU  82          HD22      LEU  82 -26.208 -14.010   3.647
   11   HD21  LEU  82          HD23      LEU  82 -27.132 -15.220   2.758

  No H/Q in entry =          11
  In of MODEL   71
    1    H    LEU  83           H        LEU  83 -27.758 -10.870  -0.338
    2    HA   LEU  83           HA       LEU  83 -27.611 -12.241  -2.807
    3    HB2  LEU  83           HB2      LEU  83 -27.928  -9.321  -2.165
    4    HB3  LEU  83           HB3      LEU  83 -27.986  -9.968  -3.804
    5    HG   LEU  83           HG       LEU  83 -30.021 -10.286  -1.618
    6   HD13  LEU  83          HD11      LEU  83 -30.725  -8.418  -2.683
    7   HD12  LEU  83          HD12      LEU  83 -31.227  -9.520  -3.963
    8   HD11  LEU  83          HD13      LEU  83 -29.667  -8.703  -4.064
    9   HD23  LEU  83          HD21      LEU  83 -30.212 -11.546  -4.338
   10   HD22  LEU  83          HD22      LEU  83 -31.185 -11.862  -2.903
   11   HD21  LEU  83          HD23      LEU  83 -29.514 -12.418  -2.973

  No H/Q in entry =          11
  In of MODEL   71
    1    H    TYR  84           H        TYR  84 -25.576  -9.913  -1.146
    2    HA   TYR  84           HA       TYR  84 -23.710  -9.489  -3.286
    3    HB2  TYR  84           HB2      TYR  84 -24.177  -7.988  -1.257
    4    HB3  TYR  84           HB3      TYR  84 -23.173  -9.112  -0.344
    5    HD1  TYR  84           HD1      TYR  84 -20.813  -8.988  -0.427
    6    HD2  TYR  84           HD2      TYR  84 -23.147  -6.738  -3.206
    7    HE1  TYR  84           HE1      TYR  84 -18.771  -7.810  -1.170
    8    HE2  TYR  84           HE2      TYR  84 -21.113  -5.560  -3.965
    9    HH   TYR  84           HH       TYR  84 -18.903  -5.356  -3.722

  No H/Q in entry =           9
  In of MODEL   71
    1    H    GLY  85           H        GLY  85 -23.519 -11.489  -0.334
    2    HA3  GLY  85           HA2      GLY  85 -20.974 -12.514  -0.826
    3    HA2  GLY  85           HA3      GLY  85 -22.226 -13.319   0.120

  No H/Q in entry =           3
  In of MODEL   71
    1    H    LYS  86           H        LYS  86 -24.093 -13.640  -1.931
    2    HA   LYS  86           HA       LYS  86 -23.120 -16.050  -3.188
    3    HB2  LYS  86           HB2      LYS  86 -25.406 -15.567  -2.164
    4    HB3  LYS  86           HB3      LYS  86 -25.731 -14.615  -3.612
    5    HG2  LYS  86           HG2      LYS  86 -24.847 -17.289  -4.232
    6    HG3  LYS  86           HG3      LYS  86 -26.306 -17.259  -3.239
    7    HD2  LYS  86           HD2      LYS  86 -27.359 -15.695  -4.776
    8    HD3  LYS  86           HD3      LYS  86 -25.885 -15.615  -5.739
    9    HE2  LYS  86           HE2      LYS  86 -27.505 -18.116  -5.284
   10    HE3  LYS  86           HE3      LYS  86 -27.606 -17.098  -6.720
   11    HZ1  LYS  86           HZ1      LYS  86 -24.940 -17.522  -6.438
   12    HZ3  LYS  86           HZ2      LYS  86 -25.962 -18.362  -7.504
   13    HZ2  LYS  86           HZ3      LYS  86 -25.602 -19.019  -5.981

  No H/Q in entry =          13
  In of MODEL   71
    1    H    VAL  87           H        VAL  87 -23.012 -12.840  -4.092
    2    HA   VAL  87           HA       VAL  87 -22.686 -11.682  -6.037
    3    HB   VAL  87           HB       VAL  87 -21.698 -14.238  -7.341
    4   HG11  VAL  87          HG11      VAL  87 -21.850 -11.940  -8.508
    5   HG13  VAL  87          HG12      VAL  87 -20.302 -12.783  -8.592
    6   HG12  VAL  87          HG13      VAL  87 -20.525 -11.458  -7.451
    7   HG22  VAL  87          HG21      VAL  87 -20.697 -14.277  -5.147
    8   HG21  VAL  87          HG22      VAL  87 -20.208 -12.592  -5.308
    9   HG23  VAL  87          HG23      VAL  87 -19.484 -13.821  -6.343

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ASP  88           H        ASP  88 -25.218 -12.244  -5.673
    2    HA   ASP  88           HA       ASP  88 -26.388 -13.433  -8.061
    3    HB2  ASP  88           HB2      ASP  88 -27.380 -13.640  -5.731
    4    HB3  ASP  88           HB3      ASP  88 -27.781 -11.927  -5.833

  No H/Q in entry =           4
  In of MODEL   71
    1    H    GLY  89           H        GLY  89 -25.654 -12.203  -9.709
    2    HA3  GLY  89           HA2      GLY  89 -25.751  -9.426  -9.918
    3    HA2  GLY  89           HA3      GLY  89 -25.768 -10.551 -11.276

  No H/Q in entry =           3
  In of MODEL   71
    1    H    LEU  90           H        LEU  90 -28.253 -11.827 -10.810
    2    HA   LEU  90           HA       LEU  90 -30.009  -9.841 -11.922
    3    HB2  LEU  90           HB2      LEU  90 -30.151 -12.236 -12.493
    4    HB3  LEU  90           HB3      LEU  90 -30.659 -12.581 -10.841
    5    HG   LEU  90           HG       LEU  90 -32.745 -11.401 -11.197
    6   HD13  LEU  90          HD11      LEU  90 -32.519  -9.671 -12.679
    7   HD12  LEU  90          HD12      LEU  90 -33.103 -10.895 -13.809
    8   HD11  LEU  90          HD13      LEU  90 -31.377 -10.553 -13.695
    9   HD23  LEU  90          HD21      LEU  90 -32.738 -13.040 -13.627
   10   HD22  LEU  90          HD22      LEU  90 -33.713 -13.171 -12.164
   11   HD21  LEU  90          HD23      LEU  90 -32.079 -13.833 -12.196

  No H/Q in entry =          11
  In of MODEL   71
    1    H    GLY  91           H        GLY  91 -29.870 -11.336  -8.733
    2    HA3  GLY  91           HA2      GLY  91 -32.170 -10.150  -7.686
    3    HA2  GLY  91           HA3      GLY  91 -30.789 -10.722  -6.749

  No H/Q in entry =           3
  In of MODEL   71
    1    H    VAL  92           H        VAL  92 -28.820  -8.957  -7.621
    2    HA   VAL  92           HA       VAL  92 -29.534  -6.628  -6.076
    3    HB   VAL  92           HB       VAL  92 -27.011  -7.179  -7.682
    4   HG12  VAL  92          HG11      VAL  92 -27.107  -5.282  -5.362
    5   HG11  VAL  92          HG12      VAL  92 -27.764  -4.723  -6.903
    6   HG13  VAL  92          HG13      VAL  92 -26.082  -5.242  -6.797
    7   HG22  VAL  92          HG21      VAL  92 -26.828  -8.767  -6.086
    8   HG21  VAL  92          HG22      VAL  92 -27.943  -7.949  -4.990
    9   HG23  VAL  92          HG23      VAL  92 -26.273  -7.400  -5.122

  No H/Q in entry =           9
  In of MODEL   71
    1    H    LEU  93           H        LEU  93 -29.166  -7.312  -9.496
    2    HA   LEU  93           HA       LEU  93 -29.437  -4.671 -10.433
    3    HB2  LEU  93           HB2      LEU  93 -28.858  -6.549 -11.891
    4    HB3  LEU  93           HB3      LEU  93 -30.470  -7.228 -11.658
    5    HG   LEU  93           HG       LEU  93 -31.428  -5.238 -12.783
    6   HD11  LEU  93          HD11      LEU  93 -29.527  -3.698 -12.295
    7   HD13  LEU  93          HD12      LEU  93 -29.977  -3.720 -14.001
    8   HD12  LEU  93          HD13      LEU  93 -28.548  -4.596 -13.454
    9   HD23  LEU  93          HD21      LEU  93 -30.419  -5.845 -15.074
   10   HD22  LEU  93          HD22      LEU  93 -31.293  -7.072 -14.159
   11   HD21  LEU  93          HD23      LEU  93 -29.529  -7.070 -14.170

  No H/Q in entry =          11
  In of MODEL   71
    1    H    LYS  94           H        LYS  94 -31.882  -7.142  -9.561
    2    HA   LYS  94           HA       LYS  94 -34.186  -5.632 -10.179
    3    HB2  LYS  94           HB2      LYS  94 -33.727  -7.825  -8.162
    4    HB3  LYS  94           HB3      LYS  94 -35.304  -7.083  -8.425
    5    HG2  LYS  94           HG2      LYS  94 -35.253  -7.868 -10.756
    6    HG3  LYS  94           HG3      LYS  94 -33.714  -8.665 -10.434
    7    HD2  LYS  94           HD2      LYS  94 -34.863  -9.958  -8.598
    8    HD3  LYS  94           HD3      LYS  94 -36.390  -9.267  -9.147
    9    HE2  LYS  94           HE2      LYS  94 -35.915 -10.218 -11.414
   10    HE3  LYS  94           HE3      LYS  94 -34.521 -11.041 -10.715
   11    HZ3  LYS  94           HZ1      LYS  94 -36.416 -12.508 -10.870
   12    HZ2  LYS  94           HZ2      LYS  94 -37.354 -11.449  -9.926
   13    HZ1  LYS  94           HZ3      LYS  94 -36.013 -12.235  -9.242

  No H/Q in entry =          13
  In of MODEL   71
    1    H    ALA  95           H        ALA  95 -32.350  -5.798  -7.140
    2    HA   ALA  95           HA       ALA  95 -34.143  -4.158  -5.655
    3    HB2  ALA  95           HB1      ALA  95 -31.807  -5.602  -5.127
    4    HB3  ALA  95           HB2      ALA  95 -32.751  -4.665  -3.971
    5    HB1  ALA  95           HB3      ALA  95 -31.385  -3.921  -4.803

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ALA  96           H        ALA  96 -31.488  -3.391  -7.770
    2    HA   ALA  96           HA       ALA  96 -31.304  -0.631  -7.006
    3    HB2  ALA  96           HB1      ALA  96 -29.947  -0.454  -9.123
    4    HB3  ALA  96           HB2      ALA  96 -30.304  -2.151  -9.436
    5    HB1  ALA  96           HB3      ALA  96 -29.367  -1.695  -8.013

  No H/Q in entry =           5
  In of MODEL   71
    1    H    VAL  97           H        VAL  97 -32.902  -2.307  -9.679
    2    HA   VAL  97           HA       VAL  97 -33.908   0.021 -10.936
    3    HB   VAL  97           HB       VAL  97 -34.807  -2.878 -10.965
    4   HG11  VAL  97          HG11      VAL  97 -36.539  -0.819 -11.447
    5   HG13  VAL  97          HG12      VAL  97 -36.652  -2.411 -12.198
    6   HG12  VAL  97          HG13      VAL  97 -35.862  -1.088 -13.053
    7   HG21  VAL  97          HG21      VAL  97 -33.483  -1.097 -13.012
    8   HG23  VAL  97          HG22      VAL  97 -33.990  -2.763 -13.294
    9   HG22  VAL  97          HG23      VAL  97 -32.723  -2.411 -12.116

  No H/Q in entry =           9
  In of MODEL   71
    1    H    ALA  98           H        ALA  98 -35.144  -2.112  -8.386
    2    HA   ALA  98           HA       ALA  98 -37.665  -0.882  -8.024
    3    HB1  ALA  98           HB1      ALA  98 -36.716  -3.109  -6.990
    4    HB3  ALA  98           HB2      ALA  98 -37.860  -2.146  -6.055
    5    HB2  ALA  98           HB3      ALA  98 -36.135  -2.051  -5.706

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ALA  99           H        ALA  99 -34.553  -0.177  -6.397
    2    HA   ALA  99           HA       ALA  99 -35.609   1.846  -4.735
    3    HB1  ALA  99           HB1      ALA  99 -32.995   0.870  -5.494
    4    HB2  ALA  99           HB2      ALA  99 -33.512   1.642  -3.995
    5    HB3  ALA  99           HB3      ALA  99 -33.011   2.628  -5.367

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ILE 100           H        ILE 100 -34.583   1.934  -8.096
    2    HA   ILE 100           HA       ILE 100 -34.671   4.786  -8.322
    3    HB   ILE 100           HB       ILE 100 -34.849   2.631 -10.455
    4   HG12  ILE 100          HG12      ILE 100 -32.616   4.553  -9.801
    5   HG13  ILE 100          HG13      ILE 100 -32.704   2.909  -9.166
    6   HG21  ILE 100          HG21      ILE 100 -35.176   5.562 -10.590
    7   HG23  ILE 100          HG22      ILE 100 -35.729   4.308 -11.700
    8   HG22  ILE 100          HG23      ILE 100 -34.058   4.869 -11.765
    9   HD12  ILE 100          HD11      ILE 100 -32.156   3.842 -11.945
   10   HD11  ILE 100          HD12      ILE 100 -32.867   2.250 -11.683
   11   HD13  ILE 100          HD13      ILE 100 -31.303   2.644 -10.972

  No H/Q in entry =          11
  In of MODEL   71
    1    H    LYS 101           H        LYS 101 -37.052   2.252  -9.028
    2    HA   LYS 101           HA       LYS 101 -39.084   3.966 -10.021
    3    HB2  LYS 101           HB2      LYS 101 -39.053   1.193  -8.887
    4    HB3  LYS 101           HB3      LYS 101 -40.582   2.004  -9.226
    5    HG2  LYS 101           HG2      LYS 101 -40.116   2.118 -11.526
    6    HG3  LYS 101           HG3      LYS 101 -38.433   1.657 -11.280
    7    HD2  LYS 101           HD2      LYS 101 -39.750  -0.210 -12.154
    8    HD3  LYS 101           HD3      LYS 101 -39.124  -0.557 -10.542
    9    HE2  LYS 101           HE2      LYS 101 -41.207  -1.183 -10.022
   10    HE3  LYS 101           HE3      LYS 101 -41.607   0.535 -10.026
   11    HZ3  LYS 101           HZ1      LYS 101 -42.515   0.403 -12.139
   12    HZ2  LYS 101           HZ2      LYS 101 -43.020  -1.053 -11.425
   13    HZ1  LYS 101           HZ3      LYS 101 -41.719  -1.050 -12.516

  No H/Q in entry =          13
  In of MODEL   71
    1    H    LYS 102           H        LYS 102 -38.624   2.480  -6.811
    2    HA   LYS 102           HA       LYS 102 -40.823   3.751  -5.604
    3    HB2  LYS 102           HB2      LYS 102 -39.644   1.848  -4.591
    4    HB3  LYS 102           HB3      LYS 102 -38.218   2.857  -4.358
    5    HG2  LYS 102           HG2      LYS 102 -39.479   4.296  -2.857
    6    HG3  LYS 102           HG3      LYS 102 -40.909   3.292  -3.092
    7    HD2  LYS 102           HD2      LYS 102 -39.739   1.389  -2.069
    8    HD3  LYS 102           HD3      LYS 102 -38.311   2.395  -1.831
    9    HE2  LYS 102           HE2      LYS 102 -39.608   3.919  -0.419
   10    HE3  LYS 102           HE3      LYS 102 -41.054   2.944  -0.677
   11    HZ1  LYS 102           HZ1      LYS 102 -39.386   1.136   0.320
   12    HZ3  LYS 102           HZ2      LYS 102 -40.462   2.059   1.255
   13    HZ2  LYS 102           HZ3      LYS 102 -38.835   2.530   1.118

  No H/Q in entry =          13
  In of MODEL   71
    1    H    ALA 103           H        ALA 103 -37.831   5.044  -6.635
    2    HA   ALA 103           HA       ALA 103 -37.967   7.367  -4.857
    3    HB2  ALA 103           HB1      ALA 103 -35.962   8.032  -6.444
    4    HB3  ALA 103           HB2      ALA 103 -35.985   6.314  -6.839
    5    HB1  ALA 103           HB3      ALA 103 -35.732   6.832  -5.173

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ALA 104           H        ALA 104 -38.630   6.651  -8.198
    2    HA   ALA 104           HA       ALA 104 -39.127   9.452  -8.823
    3    HB2  ALA 104           HB1      ALA 104 -39.203   8.782 -11.023
    4    HB1  ALA 104           HB2      ALA 104 -39.980   7.245 -10.638
    5    HB3  ALA 104           HB3      ALA 104 -38.248   7.453 -10.369

  No H/Q in entry =           5
  In of MODEL   71
    1    H    ALA 105           H        ALA 105 -40.794   7.405  -7.006
    2    HA   ALA 105           HA       ALA 105 -43.171   8.877  -6.969
    3    HB2  ALA 105           HB1      ALA 105 -43.954   8.039  -9.002
    4    HB3  ALA 105           HB2      ALA 105 -44.623   6.874  -7.860
    5    HB1  ALA 105           HB3      ALA 105 -43.171   6.476  -8.776

  No H/Q in entry =           5
  In of MODEL   72
    1    H1   ALA   1           H3       ALA   1 -12.208 -15.751  -2.390
    2    H2   ALA   1           H2       ALA   1 -11.264 -16.896  -3.224
    3    H3   ALA   1           H1       ALA   1 -12.406 -15.953  -4.063
    4    HA   ALA   1           HA       ALA   1 -13.805 -17.653  -3.822
    5    HB3  ALA   1           HB1      ALA   1 -12.411 -19.423  -3.350
    6    HB1  ALA   1           HB2      ALA   1 -13.171 -19.305  -1.763
    7    HB2  ALA   1           HB3      ALA   1 -11.594 -18.566  -2.043

  No H/Q in entry =           7
  In of MODEL   72
    1    H    GLU   2           H        GLU   2 -15.433 -18.502  -2.169
    2    HA   GLU   2           HA       GLU   2 -17.083 -16.777  -1.120
    3    HB2  GLU   2           HB2      GLU   2 -16.148 -19.198   0.436
    4    HB3  GLU   2           HB3      GLU   2 -17.673 -18.347   0.683
    5    HG2  GLU   2           HG2      GLU   2 -18.648 -19.439  -1.050
    6    HG3  GLU   2           HG3      GLU   2 -17.322 -19.042  -2.133

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLU   3           H        GLU   3 -15.178 -18.122   1.513
    2    HA   GLU   3           HA       GLU   3 -15.402 -15.764   3.062
    3    HB2  GLU   3           HB2      GLU   3 -13.818 -18.310   3.325
    4    HB3  GLU   3           HB3      GLU   3 -13.589 -16.987   4.468
    5    HG2  GLU   3           HG2      GLU   3 -15.785 -17.135   5.281
    6    HG3  GLU   3           HG3      GLU   3 -16.377 -17.939   3.833

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LEU   4           H        LEU   4 -12.445 -17.248   1.683
    2    HA   LEU   4           HA       LEU   4 -10.611 -15.343   2.280
    3    HB2  LEU   4           HB2      LEU   4 -10.835 -16.649  -0.441
    4    HB3  LEU   4           HB3      LEU   4  -9.385 -15.927   0.245
    5    HG   LEU   4           HG       LEU   4 -10.882 -18.320   1.362
    6   HD13  LEU   4          HD11      LEU   4  -9.248 -19.679   0.441
    7   HD12  LEU   4          HD12      LEU   4  -8.038 -18.397   0.413
    8   HD11  LEU   4          HD13      LEU   4  -9.323 -18.423  -0.793
    9   HD23  LEU   4          HD21      LEU   4  -8.635 -18.380   2.749
   10   HD22  LEU   4          HD22      LEU   4  -9.957 -17.338   3.272
   11   HD21  LEU   4          HD23      LEU   4  -8.592 -16.653   2.390

  No H/Q in entry =          11
  In of MODEL   72
    1    H    GLU   5           H        GLU   5 -12.939 -15.144  -0.401
    2    HA   GLU   5           HA       GLU   5 -11.932 -12.664  -1.407
    3    HB2  GLU   5           HB2      GLU   5 -13.271 -14.248  -2.773
    4    HB3  GLU   5           HB3      GLU   5 -14.674 -13.896  -1.763
    5    HG2  GLU   5           HG2      GLU   5 -14.569 -11.530  -2.403
    6    HG3  GLU   5           HG3      GLU   5 -13.133 -11.845  -3.376

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLU   6           H        GLU   6 -14.663 -13.534   0.680
    2    HA   GLU   6           HA       GLU   6 -15.568 -10.856   1.068
    3    HB2  GLU   6           HB2      GLU   6 -15.991 -13.395   2.657
    4    HB3  GLU   6           HB3      GLU   6 -16.782 -11.866   3.035
    5    HG2  GLU   6           HG2      GLU   6 -17.823 -11.815   0.829
    6    HG3  GLU   6           HG3      GLU   6 -16.967 -13.282   0.362

  No H/Q in entry =           6
  In of MODEL   72
    1    H    VAL   7           H        VAL   7 -13.266 -12.962   2.653
    2    HA   VAL   7           HA       VAL   7 -12.805 -11.380   4.976
    3    HB   VAL   7           HB       VAL   7 -11.098 -13.429   3.538
    4   HG11  VAL   7          HG11      VAL   7 -10.636 -11.888   6.098
    5   HG13  VAL   7          HG12      VAL   7  -9.532 -12.107   4.742
    6   HG12  VAL   7          HG13      VAL   7  -9.889 -13.460   5.815
    7   HG21  VAL   7          HG21      VAL   7 -13.352 -13.988   4.754
    8   HG23  VAL   7          HG22      VAL   7 -12.429 -13.710   6.231
    9   HG22  VAL   7          HG23      VAL   7 -11.934 -14.974   5.107

  No H/Q in entry =           9
  In of MODEL   72
    1    H    VAL   8           H        VAL   8 -11.285 -11.506   1.771
    2    HA   VAL   8           HA       VAL   8  -9.222  -9.632   2.263
    3    HB   VAL   8           HB       VAL   8 -10.679 -10.322  -0.300
    4   HG13  VAL   8          HG11      VAL   8  -9.727  -8.245  -0.797
    5   HG12  VAL   8          HG12      VAL   8  -8.424  -9.349  -1.240
    6   HG11  VAL   8          HG13      VAL   8  -8.369  -8.494   0.301
    7   HG21  VAL   8          HG21      VAL   8  -8.983 -11.898   1.217
    8   HG23  VAL   8          HG22      VAL   8  -7.852 -11.109   0.122
    9   HG22  VAL   8          HG23      VAL   8  -9.182 -12.060  -0.530

  No H/Q in entry =           9
  In of MODEL   72
    1    H    MET   9           H        MET   9 -12.564  -9.245   1.092
    2    HA   MET   9           HA       MET   9 -12.499  -6.470   0.649
    3    HB2  MET   9           HB2      MET   9 -14.713  -8.346   1.472
    4    HB3  MET   9           HB3      MET   9 -14.996  -6.617   1.262
    5    HG2  MET   9           HG2      MET   9 -14.142  -6.753  -1.048
    6    HG3  MET   9           HG3      MET   9 -13.856  -8.481  -0.840
    7    HE1  MET   9           HE1      MET   9 -16.117  -5.651  -0.455
    8    HE3  MET   9           HE2      MET   9 -17.774  -6.211  -0.665
    9    HE2  MET   9           HE3      MET   9 -16.762  -5.929  -2.079

  No H/Q in entry =           9
  In of MODEL   72
    1    H    GLY  10           H        GLY  10 -13.170  -8.351   3.581
    2    HA3  GLY  10           HA2      GLY  10 -13.723  -6.160   5.290
    3    HA2  GLY  10           HA3      GLY  10 -13.160  -7.748   5.811

  No H/Q in entry =           3
  In of MODEL   72
    1    H    LEU  11           H        LEU  11 -10.711  -7.877   4.504
    2    HA   LEU  11           HA       LEU  11  -9.015  -6.437   6.260
    3    HB2  LEU  11           HB2      LEU  11  -8.461  -7.870   3.660
    4    HB3  LEU  11           HB3      LEU  11  -7.194  -7.162   4.659
    5    HG   LEU  11           HG       LEU  11  -9.199  -9.191   5.677
    6   HD13  LEU  11          HD11      LEU  11  -7.973 -10.433   4.120
    7   HD12  LEU  11          HD12      LEU  11  -7.042 -10.667   5.599
    8   HD11  LEU  11          HD13      LEU  11  -6.498  -9.506   4.389
    9   HD22  LEU  11          HD21      LEU  11  -8.351  -8.172   7.593
   10   HD21  LEU  11          HD22      LEU  11  -6.812  -7.773   6.833
   11   HD23  LEU  11          HD23      LEU  11  -7.139  -9.427   7.347

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  12           H        ILE  12  -9.908  -5.902   2.866
    2    HA   ILE  12           HA       ILE  12  -8.215  -3.673   2.437
    3    HB   ILE  12           HB       ILE  12 -10.867  -4.344   1.136
    4   HG12  ILE  12          HG12      ILE  12  -8.839  -6.006   1.075
    5   HG13  ILE  12          HG13      ILE  12  -9.689  -5.649  -0.414
    6   HG22  ILE  12          HG21      ILE  12  -9.972  -2.955  -0.748
    7   HG21  ILE  12          HG22      ILE  12  -8.626  -2.476   0.278
    8   HG23  ILE  12          HG23      ILE  12 -10.258  -2.045   0.703
    9   HD13  ILE  12          HD11      ILE  12  -7.953  -4.107  -1.080
   10   HD12  ILE  12          HD12      ILE  12  -7.181  -5.614  -0.593
   11   HD11  ILE  12          HD13      ILE  12  -7.173  -4.238   0.486

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  13           H        ILE  13 -11.579  -3.938   3.521
    2    HA   ILE  13           HA       ILE  13 -12.042  -1.150   3.780
    3    HB   ILE  13           HB       ILE  13 -13.249  -3.573   5.133
    4   HG12  ILE  13          HG12      ILE  13 -13.480  -3.011   2.604
    5   HG13  ILE  13          HG13      ILE  13 -14.908  -3.464   3.508
    6   HG22  ILE  13          HG21      ILE  13 -15.157  -1.805   5.588
    7   HG21  ILE  13          HG22      ILE  13 -13.835  -0.648   5.533
    8   HG23  ILE  13          HG23      ILE  13 -13.813  -1.953   6.716
    9   HD13  ILE  13          HD11      ILE  13 -15.588  -1.148   3.737
   10   HD12  ILE  13          HD12      ILE  13 -15.236  -1.469   2.050
   11   HD11  ILE  13          HD13      ILE  13 -14.066  -0.606   3.021

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ASN  14           H        ASN  14 -10.935  -3.632   6.067
    2    HA   ASN  14           HA       ASN  14 -10.743  -1.986   8.347
    3    HB2  ASN  14           HB2      ASN  14 -10.486  -4.594   8.035
    4    HB3  ASN  14           HB3      ASN  14  -8.777  -4.205   7.882
    5   HD21  ASN  14          HD21      ASN  14  -9.419  -5.723  10.061
    6   HD22  ASN  14          HD22      ASN  14  -9.396  -4.798  11.482

  No H/Q in entry =           6
  In of MODEL   72
    1    H    SER  15           H        SER  15  -8.332  -2.815   5.866
    2    HA   SER  15           HA       SER  15  -6.194  -1.316   6.939
    3    HB2  SER  15           HB2      SER  15  -5.170  -1.532   4.780
    4    HB3  SER  15           HB3      SER  15  -6.114  -2.998   5.015
    5    HG   SER  15           HG       SER  15  -6.400  -1.012   3.180

  No H/Q in entry =           5
  In of MODEL   72
    1    H    GLY  16           H        GLY  16  -8.790  -0.461   4.681
    2    HA3  GLY  16           HA2      GLY  16  -7.935   2.180   4.122
    3    HA2  GLY  16           HA3      GLY  16  -9.584   1.581   3.958

  No H/Q in entry =           3
  In of MODEL   72
    1    H    GLN  17           H        GLN  17 -10.134   0.865   6.608
    2    HA   GLN  17           HA       GLN  17 -10.849   3.372   7.738
    3    HB2  GLN  17           HB2      GLN  17 -12.066   1.267   8.219
    4    HB3  GLN  17           HB3      GLN  17 -10.666   0.680   9.116
    5    HG2  GLN  17           HG2      GLN  17 -12.279   1.634  10.680
    6    HG3  GLN  17           HG3      GLN  17 -10.849   2.663  10.620
    7   HE21  GLN  17          HE21      GLN  17 -14.280   2.529   9.961
    8   HE22  GLN  17          HE22      GLN  17 -14.433   4.131   9.418

  No H/Q in entry =           8
  In of MODEL   72
    1    H    ALA  18           H        ALA  18  -8.217   1.099   8.373
    2    HA   ALA  18           HA       ALA  18  -7.130   2.325  10.643
    3    HB2  ALA  18           HB1      ALA  18  -6.510   0.106   9.285
    4    HB3  ALA  18           HB2      ALA  18  -5.353   0.895  10.357
    5    HB1  ALA  18           HB3      ALA  18  -5.271   1.168   8.615

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ARG  19           H        ARG  19  -6.349   2.838   7.195
    2    HA   ARG  19           HA       ARG  19  -4.457   4.892   7.622
    3    HB2  ARG  19           HB2      ARG  19  -4.775   3.742   5.430
    4    HB3  ARG  19           HB3      ARG  19  -6.319   4.578   5.245
    5    HG2  ARG  19           HG2      ARG  19  -5.196   6.753   5.309
    6    HG3  ARG  19           HG3      ARG  19  -3.646   5.973   5.621
    7    HD2  ARG  19           HD2      ARG  19  -3.765   6.554   3.275
    8    HD3  ARG  19           HD3      ARG  19  -3.846   4.795   3.427
    9    HE   ARG  19           HE       ARG  19  -6.482   5.696   3.408
   10   HH21  ARG  19          HH11      ARG  19  -7.672   5.842   1.485
   11   HH22  ARG  19          HH12      ARG  19  -6.845   5.917  -0.032
   12   HH11  ARG  19          HH21      ARG  19  -3.701   5.760   1.382
   13   HH12  ARG  19          HH22      ARG  19  -4.595   5.867  -0.090

  No H/Q in entry =          13
  In of MODEL   72
    1    H    SER  20           H        SER  20  -7.954   4.995   7.010
    2    HA   SER  20           HA       SER  20  -8.319   7.749   6.950
    3    HB2  SER  20           HB2      SER  20 -10.109   6.131   6.454
    4    HB3  SER  20           HB3      SER  20 -10.163   5.674   8.154
    5    HG   SER  20           HG       SER  20 -10.616   8.271   7.094

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LEU  21           H        LEU  21  -8.322   5.577   9.763
    2    HA   LEU  21           HA       LEU  21  -8.775   7.579  11.719
    3    HB2  LEU  21           HB2      LEU  21  -7.410   4.885  11.896
    4    HB3  LEU  21           HB3      LEU  21  -7.736   5.905  13.294
    5    HG   LEU  21           HG       LEU  21  -9.884   4.982  11.361
    6   HD11  LEU  21          HD11      LEU  21  -8.916   3.788  13.968
    7   HD13  LEU  21          HD12      LEU  21  -9.024   2.999  12.394
    8   HD12  LEU  21          HD13      LEU  21 -10.495   3.420  13.273
    9   HD22  LEU  21          HD21      LEU  21 -10.810   6.804  12.498
   10   HD21  LEU  21          HD22      LEU  21  -9.863   6.526  13.955
   11   HD23  LEU  21          HD23      LEU  21 -11.241   5.496  13.595

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ALA  22           H        ALA  22  -5.813   6.210  10.326
    2    HA   ALA  22           HA       ALA  22  -3.944   7.537  11.949
    3    HB2  ALA  22           HB1      ALA  22  -3.515   5.678  10.267
    4    HB1  ALA  22           HB2      ALA  22  -2.324   6.979  10.301
    5    HB3  ALA  22           HB3      ALA  22  -3.538   6.926   9.021

  No H/Q in entry =           5
  In of MODEL   72
    1    H    TYR  23           H        TYR  23  -5.254   8.537   8.759
    2    HA   TYR  23           HA       TYR  23  -3.927  11.038   8.683
    3    HB2  TYR  23           HB2      TYR  23  -4.996  10.114   6.691
    4    HB3  TYR  23           HB3      TYR  23  -6.578  10.218   7.466
    5    HD1  TYR  23           HD1      TYR  23  -3.688  12.261   6.292
    6    HD2  TYR  23           HD2      TYR  23  -7.820  12.231   7.463
    7    HE1  TYR  23           HE1      TYR  23  -3.921  14.606   5.523
    8    HE2  TYR  23           HE2      TYR  23  -8.053  14.578   6.693
    9    HH   TYR  23           HH       TYR  23  -5.428  16.226   5.004

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ALA  24           H        ALA  24  -7.047  10.054  10.056
    2    HA   ALA  24           HA       ALA  24  -7.896  12.643  10.814
    3    HB1  ALA  24           HB1      ALA  24  -9.712  11.387  11.280
    4    HB2  ALA  24           HB2      ALA  24  -8.889  10.824  12.733
    5    HB3  ALA  24           HB3      ALA  24  -8.755   9.907  11.233

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ALA  25           H        ALA  25  -5.890  10.199  12.404
    2    HA   ALA  25           HA       ALA  25  -5.566  11.462  14.903
    3    HB2  ALA  25           HB1      ALA  25  -4.787   9.110  14.094
    4    HB3  ALA  25           HB2      ALA  25  -3.780   9.976  15.255
    5    HB1  ALA  25           HB3      ALA  25  -3.337   9.954  13.547

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LEU  26           H        LEU  26  -3.766  11.756  11.868
    2    HA   LEU  26           HA       LEU  26  -1.817  13.587  12.784
    3    HB2  LEU  26           HB2      LEU  26  -1.504  12.428  10.685
    4    HB3  LEU  26           HB3      LEU  26  -2.978  13.128  10.023
    5    HG   LEU  26           HG       LEU  26  -1.972  15.383  10.153
    6   HD12  LEU  26          HD11      LEU  26   0.565  15.413  10.576
    7   HD11  LEU  26          HD12      LEU  26   0.345  13.835  11.326
    8   HD13  LEU  26          HD13      LEU  26  -0.470  15.249  11.994
    9   HD21  LEU  26          HD21      LEU  26  -0.217  13.329   8.772
   10   HD23  LEU  26          HD22      LEU  26  -0.265  15.049   8.395
   11   HD22  LEU  26          HD23      LEU  26  -1.683  14.045   8.106

  No H/Q in entry =          11
  In of MODEL   72
    1    H    LYS  27           H        LYS  27  -4.996  14.052  11.293
    2    HA   LYS  27           HA       LYS  27  -4.950  16.840  11.085
    3    HB2  LYS  27           HB2      LYS  27  -6.685  15.353  10.099
    4    HB3  LYS  27           HB3      LYS  27  -7.347  15.101  11.713
    5    HG2  LYS  27           HG2      LYS  27  -7.785  17.506  11.939
    6    HG3  LYS  27           HG3      LYS  27  -7.072  17.800  10.349
    7    HD2  LYS  27           HD2      LYS  27  -8.796  16.356   9.312
    8    HD3  LYS  27           HD3      LYS  27  -9.515  16.079  10.901
    9    HE2  LYS  27           HE2      LYS  27  -9.967  18.490  11.133
   10    HE3  LYS  27           HE3      LYS  27  -9.220  18.788   9.560
   11    HZ3  LYS  27           HZ1      LYS  27 -11.596  18.654   9.310
   12    HZ2  LYS  27           HZ2      LYS  27 -11.642  17.141  10.085
   13    HZ1  LYS  27           HZ3      LYS  27 -10.892  17.301   8.566

  No H/Q in entry =          13
  In of MODEL   72
    1    H    GLN  28           H        GLN  28  -5.841  14.762  13.817
    2    HA   GLN  28           HA       GLN  28  -6.749  16.770  15.582
    3    HB2  GLN  28           HB2      GLN  28  -5.358  14.133  16.118
    4    HB3  GLN  28           HB3      GLN  28  -6.060  15.147  17.380
    5    HG2  GLN  28           HG2      GLN  28  -8.261  14.986  16.317
    6    HG3  GLN  28           HG3      GLN  28  -7.577  14.028  15.005
    7   HE21  GLN  28          HE21      GLN  28  -9.678  13.077  16.795
    8   HE22  GLN  28          HE22      GLN  28  -9.040  11.763  17.659

  No H/Q in entry =           8
  In of MODEL   72
    1    H    ALA  29           H        ALA  29  -3.524  15.479  14.908
    2    HA   ALA  29           HA       ALA  29  -2.096  16.888  16.886
    3    HB1  ALA  29           HB1      ALA  29  -0.160  16.197  15.777
    4    HB3  ALA  29           HB2      ALA  29  -0.909  16.313  14.184
    5    HB2  ALA  29           HB3      ALA  29  -1.332  14.984  15.263

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LYS  30           H        LYS  30  -2.944  17.753  13.551
    2    HA   LYS  30           HA       LYS  30  -1.537  20.194  13.446
    3    HB2  LYS  30           HB2      LYS  30  -4.062  19.313  12.032
    4    HB3  LYS  30           HB3      LYS  30  -3.228  20.827  11.685
    5    HG2  LYS  30           HG2      LYS  30  -1.156  19.533  11.183
    6    HG3  LYS  30           HG3      LYS  30  -2.062  18.038  11.431
    7    HD2  LYS  30           HD2      LYS  30  -3.621  18.671   9.629
    8    HD3  LYS  30           HD3      LYS  30  -2.737  20.178   9.383
    9    HE2  LYS  30           HE2      LYS  30  -0.703  18.884   8.815
   10    HE3  LYS  30           HE3      LYS  30  -1.605  17.382   9.029
   11    HZ2  LYS  30           HZ1      LYS  30  -1.421  18.244   6.685
   12    HZ1  LYS  30           HZ2      LYS  30  -2.467  19.508   7.145
   13    HZ3  LYS  30           HZ3      LYS  30  -2.991  17.891   7.221

  No H/Q in entry =          13
  In of MODEL   72
    1    H    GLN  31           H        GLN  31  -4.641  19.347  14.851
    2    HA   GLN  31           HA       GLN  31  -5.405  22.106  15.291
    3    HB2  GLN  31           HB2      GLN  31  -6.590  19.665  16.619
    4    HB3  GLN  31           HB3      GLN  31  -7.348  21.236  16.365
    5    HG2  GLN  31           HG2      GLN  31  -6.630  20.449  13.780
    6    HG3  GLN  31           HG3      GLN  31  -7.158  18.947  14.531
    7   HE21  GLN  31          HE21      GLN  31  -8.561  20.515  12.420
    8   HE22  GLN  31          HE22      GLN  31 -10.076  20.909  13.071

  No H/Q in entry =           8
  In of MODEL   72
    1    H    GLY  32           H        GLY  32  -3.098  20.182  16.625
    2    HA3  GLY  32           HA2      GLY  32  -1.703  20.649  18.430
    3    HA2  GLY  32           HA3      GLY  32  -2.833  21.894  18.946

  No H/Q in entry =           3
  In of MODEL   72
    1    H    ASP  33           H        ASP  33  -4.256  18.854  18.290
    2    HA   ASP  33           HA       ASP  33  -4.676  18.406  21.170
    3    HB2  ASP  33           HB2      ASP  33  -6.075  17.388  18.692
    4    HB3  ASP  33           HB3      ASP  33  -6.426  16.783  20.309

  No H/Q in entry =           4
  In of MODEL   72
    1    H    PHE  34           H        PHE  34  -2.509  17.554  21.485
    2    HA   PHE  34           HA       PHE  34  -1.507  15.300  20.094
    3    HB2  PHE  34           HB2      PHE  34  -0.897  16.293  22.887
    4    HB3  PHE  34           HB3      PHE  34   0.033  15.066  22.027
    5    HD1  PHE  34           HD1      PHE  34  -0.138  18.494  22.750
    6    HD2  PHE  34           HD2      PHE  34   0.699  15.779  19.527
    7    HE1  PHE  34           HE1      PHE  34   1.163  20.260  21.594
    8    HE2  PHE  34           HE2      PHE  34   1.995  17.549  18.376
    9    HZ   PHE  34           HZ       PHE  34   2.229  19.786  19.414

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ALA  35           H        ALA  35  -3.555  15.588  22.951
    2    HA   ALA  35           HA       ALA  35  -3.348  12.929  23.856
    3    HB3  ALA  35           HB1      ALA  35  -5.808  13.560  24.704
    4    HB1  ALA  35           HB2      ALA  35  -5.271  15.177  24.245
    5    HB2  ALA  35           HB3      ALA  35  -4.362  14.256  25.442

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ALA  36           H        ALA  36  -5.790  14.442  21.744
    2    HA   ALA  36           HA       ALA  36  -7.207  12.030  21.270
    3    HB1  ALA  36           HB1      ALA  36  -8.658  13.451  20.306
    4    HB3  ALA  36           HB2      ALA  36  -7.482  13.866  19.059
    5    HB2  ALA  36           HB3      ALA  36  -7.510  14.759  20.580

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ALA  37           H        ALA  37  -4.520  13.609  19.604
    2    HA   ALA  37           HA       ALA  37  -4.480  11.966  17.313
    3    HB3  ALA  37           HB1      ALA  37  -2.490  13.680  18.736
    4    HB2  ALA  37           HB2      ALA  37  -3.015  13.731  17.054
    5    HB1  ALA  37           HB3      ALA  37  -1.865  12.502  17.582

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LYS  38           H        LYS  38  -2.733  11.668  20.397
    2    HA   LYS  38           HA       LYS  38  -1.408   9.265  19.919
    3    HB2  LYS  38           HB2      LYS  38  -1.736  11.035  22.058
    4    HB3  LYS  38           HB3      LYS  38  -2.358   9.508  22.678
    5    HG2  LYS  38           HG2      LYS  38  -0.264   8.383  22.151
    6    HG3  LYS  38           HG3      LYS  38   0.349   9.825  21.334
    7    HD2  LYS  38           HD2      LYS  38   0.514  11.050  23.366
    8    HD3  LYS  38           HD3      LYS  38  -0.509   9.904  24.234
    9    HE2  LYS  38           HE2      LYS  38   1.844   9.587  24.861
   10    HE3  LYS  38           HE3      LYS  38   1.240   8.169  23.999
   11    HZ3  LYS  38           HZ1      LYS  38   2.547   8.581  22.221
   12    HZ2  LYS  38           HZ2      LYS  38   3.499   9.411  23.357
   13    HZ1  LYS  38           HZ3      LYS  38   2.424  10.269  22.360

  No H/Q in entry =          13
  In of MODEL   72
    1    H    ALA  39           H        ALA  39  -4.650   9.768  21.311
    2    HA   ALA  39           HA       ALA  39  -5.215   7.051  21.822
    3    HB3  ALA  39           HB1      ALA  39  -7.369   8.995  21.043
    4    HB2  ALA  39           HB2      ALA  39  -6.476   9.226  22.546
    5    HB1  ALA  39           HB3      ALA  39  -7.393   7.742  22.284

  No H/Q in entry =           5
  In of MODEL   72
    1    H    MET  40           H        MET  40  -5.790   9.056  18.967
    2    HA   MET  40           HA       MET  40  -7.263   7.121  17.509
    3    HB2  MET  40           HB2      MET  40  -5.649   9.511  16.601
    4    HB3  MET  40           HB3      MET  40  -6.672   8.550  15.531
    5    HG2  MET  40           HG2      MET  40  -7.713   9.808  18.082
    6    HG3  MET  40           HG3      MET  40  -7.765  10.638  16.529
    7    HE3  MET  40           HE1      MET  40 -10.344   9.014  14.462
    8    HE2  MET  40           HE2      MET  40  -8.591   9.130  14.319
    9    HE1  MET  40           HE3      MET  40  -9.509  10.498  14.946

  No H/Q in entry =           9
  In of MODEL   72
    1    H    MET  41           H        MET  41  -3.772   7.855  17.639
    2    HA   MET  41           HA       MET  41  -3.009   6.094  15.547
    3    HB2  MET  41           HB2      MET  41  -1.399   6.767  18.022
    4    HB3  MET  41           HB3      MET  41  -0.778   6.114  16.511
    5    HG2  MET  41           HG2      MET  41  -1.930   8.294  15.496
    6    HG3  MET  41           HG3      MET  41  -1.698   8.887  17.140
    7    HE2  MET  41           HE1      MET  41   1.218   6.788  17.516
    8    HE1  MET  41           HE2      MET  41   0.427   8.085  18.408
    9    HE3  MET  41           HE3      MET  41   2.053   8.326  17.770

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ASP  42           H        ASP  42  -3.404   5.632  19.033
    2    HA   ASP  42           HA       ASP  42  -2.370   3.038  19.204
    3    HB2  ASP  42           HB2      ASP  42  -3.249   4.803  21.019
    4    HB3  ASP  42           HB3      ASP  42  -4.676   3.778  20.945

  No H/Q in entry =           4
  In of MODEL   72
    1    H    GLN  43           H        GLN  43  -5.702   4.141  18.690
    2    HA   GLN  43           HA       GLN  43  -6.846   1.554  18.500
    3    HB2  GLN  43           HB2      GLN  43  -7.764   4.203  17.360
    4    HB3  GLN  43           HB3      GLN  43  -8.728   2.724  17.339
    5    HG2  GLN  43           HG2      GLN  43  -8.442   2.610  19.848
    6    HG3  GLN  43           HG3      GLN  43  -7.717   4.215  19.774
    7   HE21  GLN  43          HE21      GLN  43  -9.901   4.300  21.268
    8   HE22  GLN  43          HE22      GLN  43 -11.259   4.873  20.430

  No H/Q in entry =           8
  In of MODEL   72
    1    H    SER  44           H        SER  44  -5.497   3.760  16.086
    2    HA   SER  44           HA       SER  44  -6.192   2.269  13.799
    3    HB2  SER  44           HB2      SER  44  -4.936   4.654  14.239
    4    HB3  SER  44           HB3      SER  44  -3.581   3.656  13.716
    5    HG   SER  44           HG       SER  44  -4.687   4.623  11.947

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ARG  45           H        ARG  45  -3.321   2.161  15.888
    2    HA   ARG  45           HA       ARG  45  -1.837   0.203  14.517
    3    HB2  ARG  45           HB2      ARG  45  -1.000   1.629  16.384
    4    HB3  ARG  45           HB3      ARG  45  -1.996   0.702  17.504
    5    HG2  ARG  45           HG2      ARG  45  -0.763  -1.359  16.871
    6    HG3  ARG  45           HG3      ARG  45   0.257  -0.407  15.794
    7    HD2  ARG  45           HD2      ARG  45   0.985   0.979  17.747
    8    HD3  ARG  45           HD3      ARG  45   0.059  -0.092  18.821
    9    HE   ARG  45           HE       ARG  45   1.763  -1.693  17.251
   10   HH21  ARG  45          HH11      ARG  45   3.660  -2.514  18.097
   11   HH22  ARG  45          HH12      ARG  45   4.429  -1.724  19.428
   12   HH11  ARG  45          HH21      ARG  45   2.059   0.780  19.634
   13   HH12  ARG  45          HH22      ARG  45   3.522   0.143  20.296

  No H/Q in entry =          13
  In of MODEL   72
    1    H    MET  46           H        MET  46  -4.243  -0.109  17.110
    2    HA   MET  46           HA       MET  46  -4.077  -2.908  17.426
    3    HB2  MET  46           HB2      MET  46  -6.249  -0.900  18.012
    4    HB3  MET  46           HB3      MET  46  -6.454  -2.619  18.359
    5    HG2  MET  46           HG2      MET  46  -4.473  -2.605  19.785
    6    HG3  MET  46           HG3      MET  46  -4.159  -0.923  19.383
    7    HE1  MET  46           HE1      MET  46  -6.293  -3.521  20.918
    8    HE3  MET  46           HE2      MET  46  -7.737  -2.721  20.308
    9    HE2  MET  46           HE3      MET  46  -7.408  -2.727  22.038

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ALA  47           H        ALA  47  -6.089  -0.896  15.319
    2    HA   ALA  47           HA       ALA  47  -7.705  -2.948  14.253
    3    HB3  ALA  47           HB1      ALA  47  -8.382  -0.711  13.829
    4    HB1  ALA  47           HB2      ALA  47  -7.888  -1.350  12.261
    5    HB2  ALA  47           HB3      ALA  47  -6.810  -0.280  13.158

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LEU  48           H        LEU  48  -4.581  -1.646  13.209
    2    HA   LEU  48           HA       LEU  48  -4.294  -3.243  10.873
    3    HB2  LEU  48           HB2      LEU  48  -2.242  -1.962  12.685
    4    HB3  LEU  48           HB3      LEU  48  -1.869  -2.687  11.122
    5    HG   LEU  48           HG       LEU  48  -3.890  -0.466  11.498
    6   HD13  LEU  48          HD11      LEU  48  -1.769   0.409  12.168
    7   HD12  LEU  48          HD12      LEU  48  -2.038   0.958  10.514
    8   HD11  LEU  48          HD13      LEU  48  -0.943  -0.389  10.830
    9   HD22  LEU  48          HD21      LEU  48  -4.356  -1.456   9.423
   10   HD21  LEU  48          HD22      LEU  48  -2.672  -1.894   9.135
   11   HD23  LEU  48          HD23      LEU  48  -3.188  -0.215   8.969

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ASN  49           H        ASN  49  -3.261  -3.632  14.224
    2    HA   ASN  49           HA       ASN  49  -1.661  -5.899  13.906
    3    HB2  ASN  49           HB2      ASN  49  -1.706  -4.546  15.949
    4    HB3  ASN  49           HB3      ASN  49  -3.356  -5.056  16.273
    5   HD21  ASN  49          HD21      ASN  49  -2.899  -6.176  18.233
    6   HD22  ASN  49          HD22      ASN  49  -1.945  -7.578  18.287

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLU  50           H        GLU  50  -5.132  -5.615  14.564
    2    HA   GLU  50           HA       GLU  50  -5.651  -8.413  14.679
    3    HB2  GLU  50           HB2      GLU  50  -7.236  -6.720  15.545
    4    HB3  GLU  50           HB3      GLU  50  -7.522  -6.159  13.895
    5    HG2  GLU  50           HG2      GLU  50  -8.390  -8.355  13.260
    6    HG3  GLU  50           HG3      GLU  50  -8.016  -8.995  14.857

  No H/Q in entry =           6
  In of MODEL   72
    1    H    ALA  51           H        ALA  51  -5.704  -6.021  12.076
    2    HA   ALA  51           HA       ALA  51  -6.686  -7.752  10.055
    3    HB2  ALA  51           HB1      ALA  51  -6.457  -5.944   8.682
    4    HB1  ALA  51           HB2      ALA  51  -4.818  -5.598   9.235
    5    HB3  ALA  51           HB3      ALA  51  -6.204  -5.080  10.198

  No H/Q in entry =           5
  In of MODEL   72
    1    H    HIS  52           H        HIS  52  -3.397  -6.852  11.048
    2    HA   HIS  52           HA       HIS  52  -1.995  -8.350   9.108
    3    HB2  HIS  52           HB2      HIS  52  -0.981  -6.607  10.573
    4    HB3  HIS  52           HB3      HIS  52  -1.122  -7.716  11.936
    5    HD1  HIS  52           HD1      HIS  52   0.402  -9.841  11.918
    6    HD2  HIS  52           HD2      HIS  52   1.090  -7.229   8.742
    7    HE1  HIS  52           HE1      HIS  52   2.590 -10.557  10.862
    8    HE2  HIS  52           HE2      HIS  52   3.023  -8.976   8.924

  No H/Q in entry =           8
  In of MODEL   72
    1    H    LEU  53           H        LEU  53  -3.221  -9.215  12.318
    2    HA   LEU  53           HA       LEU  53  -2.033 -11.763  12.523
    3    HB2  LEU  53           HB2      LEU  53  -4.519 -10.571  13.725
    4    HB3  LEU  53           HB3      LEU  53  -4.066 -12.247  14.023
    5    HG   LEU  53           HG       LEU  53  -2.170  -9.923  14.505
    6   HD12  LEU  53          HD11      LEU  53  -2.762 -10.350  16.946
    7   HD11  LEU  53          HD12      LEU  53  -4.145 -11.271  16.358
    8   HD13  LEU  53          HD13      LEU  53  -4.010  -9.555  15.993
    9   HD22  LEU  53          HD21      LEU  53  -0.874 -11.892  14.471
   10   HD21  LEU  53          HD22      LEU  53  -2.173 -12.870  15.143
   11   HD23  LEU  53          HD23      LEU  53  -1.283 -11.770  16.178

  No H/Q in entry =          11
  In of MODEL   72
    1    H    VAL  54           H        VAL  54  -5.135 -10.726  11.147
    2    HA   VAL  54           HA       VAL  54  -6.057 -13.319  10.463
    3    HB   VAL  54           HB       VAL  54  -6.689 -10.586   9.319
    4   HG12  VAL  54          HG11      VAL  54  -8.793 -11.958   8.503
    5   HG11  VAL  54          HG12      VAL  54  -7.687 -13.328   8.583
    6   HG13  VAL  54          HG13      VAL  54  -7.318 -11.957   7.539
    7   HG22  VAL  54          HG21      VAL  54  -7.604 -10.615  11.467
    8   HG21  VAL  54          HG22      VAL  54  -7.865 -12.357  11.452
    9   HG23  VAL  54          HG23      VAL  54  -8.938 -11.298  10.538

  No H/Q in entry =           9
  In of MODEL   72
    1    H    GLN  55           H        GLN  55  -4.169 -10.879   8.674
    2    HA   GLN  55           HA       GLN  55  -4.036 -12.351   6.261
    3    HB2  GLN  55           HB2      GLN  55  -3.422 -10.089   6.068
    4    HB3  GLN  55           HB3      GLN  55  -2.316 -10.167   7.437
    5    HG2  GLN  55           HG2      GLN  55  -0.598 -11.023   6.169
    6    HG3  GLN  55           HG3      GLN  55  -1.672 -11.996   5.174
    7   HE21  GLN  55          HE21      GLN  55  -1.678 -11.312   3.051
    8   HE22  GLN  55          HE22      GLN  55  -1.471  -9.709   2.537

  No H/Q in entry =           8
  In of MODEL   72
    1    H    THR  56           H        THR  56  -1.940 -12.331   9.150
    2    HA   THR  56           HA       THR  56   0.135 -13.941   8.244
    3    HB   THR  56           HB       THR  56  -1.118 -14.180  10.988
    4    HG1  THR  56           HG1      THR  56  -0.505 -11.987   9.999
    5   HG21  THR  56          HG21      THR  56   1.678 -14.587   9.899
    6   HG23  THR  56          HG22      THR  56   0.616 -15.815  10.587
    7   HG22  THR  56          HG23      THR  56   1.289 -14.552  11.618

  No H/Q in entry =           7
  In of MODEL   72
    1    H    LYS  57           H        LYS  57  -2.995 -14.960   9.599
    2    HA   LYS  57           HA       LYS  57  -2.561 -17.758   9.362
    3    HB2  LYS  57           HB2      LYS  57  -4.380 -16.650  10.696
    4    HB3  LYS  57           HB3      LYS  57  -5.166 -16.211   9.188
    5    HG2  LYS  57           HG2      LYS  57  -5.418 -18.574   8.594
    6    HG3  LYS  57           HG3      LYS  57  -4.573 -19.052  10.065
    7    HD2  LYS  57           HD2      LYS  57  -6.357 -17.996  11.425
    8    HD3  LYS  57           HD3      LYS  57  -7.214 -17.554   9.949
    9    HE2  LYS  57           HE2      LYS  57  -7.439 -19.932   9.344
   10    HE3  LYS  57           HE3      LYS  57  -6.541 -20.406  10.785
   11    HZ3  LYS  57           HZ1      LYS  57  -8.501 -20.466  11.792
   12    HZ2  LYS  57           HZ2      LYS  57  -9.286 -19.669  10.512
   13    HZ1  LYS  57           HZ3      LYS  57  -8.506 -18.770  11.725

  No H/Q in entry =          13
  In of MODEL   72
    1    H    LEU  58           H        LEU  58  -3.873 -15.316   7.174
    2    HA   LEU  58           HA       LEU  58  -4.676 -17.142   5.170
    3    HB2  LEU  58           HB2      LEU  58  -4.055 -14.197   5.029
    4    HB3  LEU  58           HB3      LEU  58  -4.718 -15.134   3.689
    5    HG   LEU  58           HG       LEU  58  -6.007 -14.941   6.431
    6   HD11  LEU  58          HD11      LEU  58  -6.290 -13.300   3.934
    7   HD13  LEU  58          HD12      LEU  58  -6.284 -12.788   5.622
    8   HD12  LEU  58          HD13      LEU  58  -7.708 -13.576   4.947
    9   HD22  LEU  58          HD21      LEU  58  -6.976 -16.848   5.563
   10   HD21  LEU  58          HD22      LEU  58  -6.628 -16.403   3.893
   11   HD23  LEU  58          HD23      LEU  58  -7.991 -15.668   4.736

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  59           H        ILE  59  -1.538 -15.944   6.040
    2    HA   ILE  59           HA       ILE  59  -0.434 -16.684   3.409
    3    HB   ILE  59           HB       ILE  59   0.338 -14.618   4.974
    4   HG12  ILE  59          HG12      ILE  59   2.411 -16.296   3.544
    5   HG13  ILE  59          HG13      ILE  59   1.241 -15.317   2.697
    6   HG21  ILE  59          HG21      ILE  59   1.071 -16.403   6.737
    7   HG23  ILE  59          HG22      ILE  59   2.166 -15.086   6.386
    8   HG22  ILE  59          HG23      ILE  59   2.429 -16.676   5.672
    9   HD13  ILE  59          HD11      ILE  59   3.188 -13.954   2.910
   10   HD12  ILE  59          HD12      ILE  59   3.370 -14.379   4.610
   11   HD11  ILE  59          HD13      ILE  59   2.037 -13.344   4.097

  No H/Q in entry =          11
  In of MODEL   72
    1    H    GLU  60           H        GLU  60  -0.463 -17.781   6.780
    2    HA   GLU  60           HA       GLU  60   1.559 -19.769   6.529
    3    HB2  GLU  60           HB2      GLU  60   0.778 -18.966   8.712
    4    HB3  GLU  60           HB3      GLU  60  -0.819 -19.643   8.404
    5    HG2  GLU  60           HG2      GLU  60   0.170 -21.908   8.273
    6    HG3  GLU  60           HG3      GLU  60   1.764 -21.226   8.591

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLY  61           H        GLY  61  -1.950 -19.852   6.029
    2    HA3  GLY  61           HA2      GLY  61  -1.712 -22.648   5.080
    3    HA2  GLY  61           HA3      GLY  61  -3.196 -21.903   5.665

  No H/Q in entry =           3
  In of MODEL   72
    1    H    ASP  62           H        ASP  62  -0.950 -20.340   3.467
    2    HA   ASP  62           HA       ASP  62  -3.041 -19.827   1.569
    3    HB2  ASP  62           HB2      ASP  62  -1.235 -18.680   0.317
    4    HB3  ASP  62           HB3      ASP  62  -1.315 -18.167   1.999

  No H/Q in entry =           4
  In of MODEL   72
    1    H    ALA  63           H        ALA  63  -3.732 -21.262   0.069
    2    HA   ALA  63           HA       ALA  63  -1.712 -23.007  -1.234
    3    HB3  ALA  63           HB1      ALA  63  -3.506 -24.743  -1.395
    4    HB2  ALA  63           HB2      ALA  63  -4.472 -23.762  -0.294
    5    HB1  ALA  63           HB3      ALA  63  -2.934 -24.437   0.247

  No H/Q in entry =           5
  In of MODEL   72
    1    H    GLY  64           H        GLY  64  -4.831 -21.361  -1.395
    2    HA3  GLY  64           HA2      GLY  64  -6.056 -20.516  -3.138
    3    HA2  GLY  64           HA3      GLY  64  -4.534 -20.381  -4.001

  No H/Q in entry =           3
  In of MODEL   72
    1    H    GLU  65           H        GLU  65  -4.819 -21.239  -5.989
    2    HA   GLU  65           HA       GLU  65  -6.778 -23.095  -6.682
    3    HB2  GLU  65           HB2      GLU  65  -4.160 -22.434  -8.027
    4    HB3  GLU  65           HB3      GLU  65  -5.398 -23.464  -8.747
    5    HG2  GLU  65           HG2      GLU  65  -7.034 -21.649  -8.608
    6    HG3  GLU  65           HG3      GLU  65  -5.850 -20.618  -7.811

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLY  66           H        GLY  66  -5.724 -25.048  -8.135
    2    HA3  GLY  66           HA2      GLY  66  -5.342 -27.177  -6.343
    3    HA2  GLY  66           HA3      GLY  66  -5.142 -27.246  -8.084

  No H/Q in entry =           3
  In of MODEL   72
    1    H    LYS  67           H        LYS  67  -3.041 -25.328  -8.240
    2    HA   LYS  67           HA       LYS  67  -0.825 -27.061  -7.715
    3    HB2  LYS  67           HB2      LYS  67  -1.014 -24.308  -8.930
    4    HB3  LYS  67           HB3      LYS  67   0.479 -25.252  -8.842
    5    HG2  LYS  67           HG2      LYS  67  -0.607 -27.100 -10.061
    6    HG3  LYS  67           HG3      LYS  67  -2.102 -26.172 -10.147
    7    HD2  LYS  67           HD2      LYS  67  -0.953 -24.433 -11.466
    8    HD3  LYS  67           HD3      LYS  67   0.548 -25.359 -11.376
    9    HE2  LYS  67           HE2      LYS  67  -0.537 -27.246 -12.534
   10    HE3  LYS  67           HE3      LYS  67  -2.044 -26.334 -12.616
   11    HZ3  LYS  67           HZ1      LYS  67  -1.258 -25.644 -14.571
   12    HZ2  LYS  67           HZ2      LYS  67   0.338 -26.103 -14.220
   13    HZ1  LYS  67           HZ3      LYS  67  -0.262 -24.612 -13.668

  No H/Q in entry =          13
  In of MODEL   72
    1    H    MET  68           H        MET  68   1.095 -26.579  -6.663
    2    HA   MET  68           HA       MET  68   1.001 -25.998  -4.012
    3    HB2  MET  68           HB2      MET  68   3.342 -25.474  -5.849
    4    HB3  MET  68           HB3      MET  68   3.426 -25.718  -4.104
    5    HG2  MET  68           HG2      MET  68   2.037 -27.927  -4.780
    6    HG3  MET  68           HG3      MET  68   2.948 -27.697  -6.274
    7    HE3  MET  68           HE1      MET  68   6.535 -27.305  -5.077
    8    HE2  MET  68           HE2      MET  68   5.594 -26.099  -4.202
    9    HE1  MET  68           HE3      MET  68   5.213 -26.452  -5.886

  No H/Q in entry =           9
  In of MODEL   72
    1    H    LYS  69           H        LYS  69   0.491 -23.666  -6.375
    2    HA   LYS  69           HA       LYS  69   1.804 -21.427  -5.324
    3    HB2  LYS  69           HB2      LYS  69  -0.478 -21.791  -7.188
    4    HB3  LYS  69           HB3      LYS  69  -0.141 -20.177  -6.552
    5    HG2  LYS  69           HG2      LYS  69   1.109 -20.548  -8.637
    6    HG3  LYS  69           HG3      LYS  69   2.210 -20.383  -7.271
    7    HD2  LYS  69           HD2      LYS  69   2.502 -22.784  -7.137
    8    HD3  LYS  69           HD3      LYS  69   1.261 -23.043  -8.366
    9    HE2  LYS  69           HE2      LYS  69   3.403 -23.215  -9.466
   10    HE3  LYS  69           HE3      LYS  69   2.677 -21.687  -9.959
   11    HZ2  LYS  69           HZ1      LYS  69   5.073 -22.160  -8.483
   12    HZ1  LYS  69           HZ2      LYS  69   4.036 -21.085  -7.673
   13    HZ3  LYS  69           HZ3      LYS  69   4.545 -20.746  -9.258

  No H/Q in entry =          13
  In of MODEL   72
    1    H    VAL  70           H        VAL  70   0.050 -19.375  -5.009
    2    HA   VAL  70           HA       VAL  70  -1.436 -20.033  -2.526
    3    HB   VAL  70           HB       VAL  70  -0.755 -17.776  -1.699
    4   HG12  VAL  70          HG11      VAL  70   1.577 -19.561  -2.455
    5   HG11  VAL  70          HG12      VAL  70   0.507 -19.827  -1.077
    6   HG13  VAL  70          HG13      VAL  70   1.542 -18.400  -1.127
    7   HG23  VAL  70          HG21      VAL  70   1.405 -16.923  -3.018
    8   HG22  VAL  70          HG22      VAL  70  -0.211 -16.435  -3.520
    9   HG21  VAL  70          HG23      VAL  70   0.617 -17.734  -4.372

  No H/Q in entry =           9
  In of MODEL   72
    1    H    SER  71           H        SER  71  -3.083 -18.387  -1.996
    2    HA   SER  71           HA       SER  71  -4.890 -17.921  -4.120
    3    HB2  SER  71           HB2      SER  71  -5.576 -18.071  -1.723
    4    HB3  SER  71           HB3      SER  71  -4.758 -16.544  -1.411
    5    HG   SER  71           HG       SER  71  -6.879 -16.972  -3.256

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LEU  72           H        LEU  72  -5.168 -16.230  -5.457
    2    HA   LEU  72           HA       LEU  72  -3.051 -14.428  -5.936
    3    HB2  LEU  72           HB2      LEU  72  -5.913 -14.474  -6.890
    4    HB3  LEU  72           HB3      LEU  72  -4.712 -13.321  -7.464
    5    HG   LEU  72           HG       LEU  72  -4.300 -16.326  -7.585
    6   HD12  LEU  72          HD11      LEU  72  -5.306 -14.442  -9.741
    7   HD11  LEU  72          HD12      LEU  72  -6.262 -15.688  -8.937
    8   HD13  LEU  72          HD13      LEU  72  -4.908 -16.145  -9.970
    9   HD22  LEU  72          HD21      LEU  72  -2.192 -15.311  -7.847
   10   HD21  LEU  72          HD22      LEU  72  -2.848 -13.911  -8.680
   11   HD23  LEU  72          HD23      LEU  72  -2.745 -15.460  -9.512

  No H/Q in entry =          11
  In of MODEL   72
    1    H    VAL  73           H        VAL  73  -6.148 -14.055  -4.316
    2    HA   VAL  73           HA       VAL  73  -6.184 -11.284  -3.971
    3    HB   VAL  73           HB       VAL  73  -7.897 -11.637  -2.372
    4   HG11  VAL  73          HG11      VAL  73  -8.201 -12.469  -4.805
    5   HG13  VAL  73          HG12      VAL  73  -9.379 -12.996  -3.604
    6   HG12  VAL  73          HG13      VAL  73  -8.092 -14.089  -4.116
    7   HG23  VAL  73          HG21      VAL  73  -8.194 -14.177  -1.648
    8   HG22  VAL  73          HG22      VAL  73  -7.113 -13.106  -0.757
    9   HG21  VAL  73          HG23      VAL  73  -6.456 -14.230  -1.947

  No H/Q in entry =           9
  In of MODEL   72
    1    H    LEU  74           H        LEU  74  -4.259 -13.655  -2.377
    2    HA   LEU  74           HA       LEU  74  -3.851 -12.511   0.145
    3    HB2  LEU  74           HB2      LEU  74  -3.074 -14.733  -0.350
    4    HB3  LEU  74           HB3      LEU  74  -2.013 -14.126  -1.620
    5    HG   LEU  74           HG       LEU  74  -0.712 -12.876   0.072
    6   HD13  LEU  74          HD11      LEU  74  -2.267 -12.380   1.791
    7   HD12  LEU  74          HD12      LEU  74  -1.214 -13.600   2.508
    8   HD11  LEU  74          HD13      LEU  74  -2.805 -14.055   1.900
    9   HD23  LEU  74          HD21      LEU  74  -0.922 -15.624   1.179
   10   HD22  LEU  74          HD22      LEU  74   0.481 -14.709   0.674
   11   HD21  LEU  74          HD23      LEU  74  -0.538 -15.458  -0.533

  No H/Q in entry =          11
  In of MODEL   72
    1    H    VAL  75           H        VAL  75  -1.950 -12.131  -2.808
    2    HA   VAL  75           HA       VAL  75  -0.148 -10.211  -1.797
    3    HB   VAL  75           HB       VAL  75  -1.098 -10.702  -4.621
    4   HG13  VAL  75          HG11      VAL  75  -0.237  -8.403  -4.439
    5   HG12  VAL  75          HG12      VAL  75   0.970  -9.407  -5.228
    6   HG11  VAL  75          HG13      VAL  75   1.162  -8.975  -3.537
    7   HG23  VAL  75          HG21      VAL  75   1.443 -11.454  -3.130
    8   HG22  VAL  75          HG22      VAL  75   1.066 -11.865  -4.804
    9   HG21  VAL  75          HG23      VAL  75   0.117 -12.563  -3.488

  No H/Q in entry =           9
  In of MODEL   72
    1    H    GLU  76           H        GLU  76  -3.293  -9.855  -3.464
    2    HA   GLU  76           HA       GLU  76  -3.334  -7.041  -3.571
    3    HB2  GLU  76           HB2      GLU  76  -4.992  -8.519  -4.720
    4    HB3  GLU  76           HB3      GLU  76  -5.675  -8.937  -3.156
    5    HG2  GLU  76           HG2      GLU  76  -6.302  -6.583  -2.779
    6    HG3  GLU  76           HG3      GLU  76  -5.615  -6.128  -4.327

  No H/Q in entry =           6
  In of MODEL   72
    1    H    ALA  77           H        ALA  77  -4.460  -9.260  -1.030
    2    HA   ALA  77           HA       ALA  77  -5.414  -7.251   0.723
    3    HB1  ALA  77           HB1      ALA  77  -4.273  -9.936   1.522
    4    HB2  ALA  77           HB2      ALA  77  -5.907  -9.713   0.896
    5    HB3  ALA  77           HB3      ALA  77  -5.435  -8.957   2.418

  No H/Q in entry =           5
  In of MODEL   72
    1    H    GLN  78           H        GLN  78  -2.271  -8.813   0.369
    2    HA   GLN  78           HA       GLN  78  -1.015  -7.653   2.621
    3    HB2  GLN  78           HB2      GLN  78  -0.160  -9.600   1.267
    4    HB3  GLN  78           HB3      GLN  78   0.289  -8.456   0.006
    5    HG2  GLN  78           HG2      GLN  78   1.743  -7.268   1.604
    6    HG3  GLN  78           HG3      GLN  78   1.303  -8.419   2.862
    7   HE21  GLN  78          HE21      GLN  78   4.028  -8.149   2.049
    8   HE22  GLN  78          HE22      GLN  78   4.492  -9.572   1.244

  No H/Q in entry =           8
  In of MODEL   72
    1    H    LEU  79           H        LEU  79  -1.368  -6.597  -0.729
    2    HA   LEU  79           HA       LEU  79   0.328  -4.378  -0.716
    3    HB2  LEU  79           HB2      LEU  79  -0.697  -5.184  -2.771
    4    HB3  LEU  79           HB3      LEU  79  -2.300  -4.784  -2.167
    5    HG   LEU  79           HG       LEU  79  -1.745  -2.399  -2.145
    6   HD13  LEU  79          HD11      LEU  79   0.495  -2.165  -1.627
    7   HD12  LEU  79          HD12      LEU  79   0.550  -1.881  -3.366
    8   HD11  LEU  79          HD13      LEU  79   0.995  -3.460  -2.716
    9   HD23  LEU  79          HD21      LEU  79  -1.103  -2.209  -4.696
   10   HD22  LEU  79          HD22      LEU  79  -2.634  -2.948  -4.239
   11   HD21  LEU  79          HD23      LEU  79  -1.265  -3.965  -4.678

  No H/Q in entry =          11
  In of MODEL   72
    1    H    HIS  80           H        HIS  80  -3.141  -4.522   0.102
    2    HA   HIS  80           HA       HIS  80  -3.321  -1.764   0.759
    3    HB2  HIS  80           HB2      HIS  80  -5.035  -4.163   1.078
    4    HB3  HIS  80           HB3      HIS  80  -5.352  -2.820   2.179
    5    HD1  HIS  80           HD1      HIS  80  -6.959  -1.176   1.264
    6    HD2  HIS  80           HD2      HIS  80  -4.767  -3.006  -1.775
    7    HE1  HIS  80           HE1      HIS  80  -7.788  -0.180  -0.920
    8    HE2  HIS  80           HE2      HIS  80  -6.458  -1.289  -2.781

  No H/Q in entry =           8
  In of MODEL   72
    1    H    LEU  81           H        LEU  81  -2.852  -4.657   2.759
    2    HA   LEU  81           HA       LEU  81  -2.839  -3.305   5.241
    3    HB2  LEU  81           HB2      LEU  81  -1.632  -5.929   4.370
    4    HB3  LEU  81           HB3      LEU  81  -1.608  -5.367   6.042
    5    HG   LEU  81           HG       LEU  81  -4.150  -5.610   4.408
    6   HD12  LEU  81          HD11      LEU  81  -4.468  -7.670   5.959
    7   HD11  LEU  81          HD12      LEU  81  -2.716  -7.609   6.149
    8   HD13  LEU  81          HD13      LEU  81  -3.422  -7.838   4.549
    9   HD23  LEU  81          HD21      LEU  81  -5.001  -5.803   6.907
   10   HD22  LEU  81          HD22      LEU  81  -4.666  -4.217   6.215
   11   HD21  LEU  81          HD23      LEU  81  -3.486  -4.982   7.280

  No H/Q in entry =          11
  In of MODEL   72
    1    H    MET  82           H        MET  82  -0.158  -4.227   3.079
    2    HA   MET  82           HA       MET  82   1.926  -3.341   4.766
    3    HB2  MET  82           HB2      MET  82   1.717  -3.688   1.774
    4    HB3  MET  82           HB3      MET  82   3.200  -3.124   2.541
    5    HG2  MET  82           HG2      MET  82   1.777  -5.704   3.266
    6    HG3  MET  82           HG3      MET  82   3.152  -5.604   2.170
    7    HE3  MET  82           HE1      MET  82   6.166  -4.881   4.160
    8    HE2  MET  82           HE2      MET  82   5.253  -3.510   3.536
    9    HE1  MET  82           HE3      MET  82   5.335  -5.002   2.604

  No H/Q in entry =           9
  In of MODEL   72
    1    H    THR  83           H        THR  83   0.120  -1.694   2.202
    2    HA   THR  83           HA       THR  83   1.546   0.746   2.287
    3    HB   THR  83           HB       THR  83  -0.622   1.682   1.293
    4    HG1  THR  83           HG1      THR  83  -2.280   0.394   1.185
    5   HG22  THR  83          HG21      THR  83  -0.357  -0.142  -0.703
    6   HG21  THR  83          HG22      THR  83   1.139  -0.441   0.178
    7   HG23  THR  83          HG23      THR  83   0.789   1.173  -0.441

  No H/Q in entry =           7
  In of MODEL   72
    1    H    SER  84           H        SER  84  -1.470  -0.265   3.882
    2    HA   SER  84           HA       SER  84  -1.955   2.171   5.221
    3    HB2  SER  84           HB2      SER  84  -2.806  -0.661   5.789
    4    HB3  SER  84           HB3      SER  84  -3.294   0.685   6.818
    5    HG   SER  84           HG       SER  84  -3.748   0.368   4.025

  No H/Q in entry =           5
  In of MODEL   72
    1    H    MET  85           H        MET  85  -0.266  -0.769   6.361
    2    HA   MET  85           HA       MET  85   0.253   0.160   8.964
    3    HB2  MET  85           HB2      MET  85   0.532  -2.187   8.293
    4    HB3  MET  85           HB3      MET  85   1.918  -1.735   7.300
    5    HG2  MET  85           HG2      MET  85   3.101  -0.911   9.294
    6    HG3  MET  85           HG3      MET  85   1.706  -1.307  10.296
    7    HE3  MET  85           HE1      MET  85   4.423  -4.103   7.966
    8    HE2  MET  85           HE2      MET  85   5.177  -2.936   9.050
    9    HE1  MET  85           HE3      MET  85   4.116  -2.375   7.761

  No H/Q in entry =           9
  In of MODEL   72
    1    H    LEU  86           H        LEU  86   2.197   0.397   6.017
    2    HA   LEU  86           HA       LEU  86   4.416   1.696   7.176
    3    HB2  LEU  86           HB2      LEU  86   4.223   0.609   4.869
    4    HB3  LEU  86           HB3      LEU  86   3.426   2.095   4.351
    5    HG   LEU  86           HG       LEU  86   5.460   3.330   5.334
    6   HD11  LEU  86          HD11      LEU  86   6.146   0.716   6.141
    7   HD13  LEU  86          HD12      LEU  86   7.159   2.154   6.238
    8   HD12  LEU  86          HD13      LEU  86   7.265   1.102   4.829
    9   HD23  LEU  86          HD21      LEU  86   6.171   1.557   2.989
   10   HD22  LEU  86          HD22      LEU  86   6.575   3.252   3.248
   11   HD21  LEU  86          HD23      LEU  86   4.920   2.794   2.846

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ALA  87           H        ALA  87   1.516   2.955   5.581
    2    HA   ALA  87           HA       ALA  87   2.128   5.681   5.660
    3    HB1  ALA  87           HB1      ALA  87  -0.191   4.067   5.117
    4    HB3  ALA  87           HB2      ALA  87   0.132   5.724   4.614
    5    HB2  ALA  87           HB3      ALA  87  -0.667   5.412   6.156

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ARG  88           H        ARG  88   0.419   3.696   8.051
    2    HA   ARG  88           HA       ARG  88  -0.084   5.753   9.891
    3    HB2  ARG  88           HB2      ARG  88  -1.038   3.407   9.961
    4    HB3  ARG  88           HB3      ARG  88   0.498   2.898  10.672
    5    HG2  ARG  88           HG2      ARG  88   0.031   4.979  12.286
    6    HG3  ARG  88           HG3      ARG  88  -1.636   4.664  11.826
    7    HD2  ARG  88           HD2      ARG  88  -1.759   2.819  13.077
    8    HD3  ARG  88           HD3      ARG  88  -0.172   2.225  12.551
    9    HE   ARG  88           HE       ARG  88  -0.703   3.498  15.001
   10   HH21  ARG  88          HH11      ARG  88   0.858   4.503  16.241
   11   HH22  ARG  88          HH12      ARG  88   2.382   4.918  15.539
   12   HH11  ARG  88          HH21      ARG  88   1.584   3.659  12.429
   13   HH12  ARG  88          HH22      ARG  88   2.801   4.424  13.393

  No H/Q in entry =          13
  In of MODEL   72
    1    H    GLU  89           H        GLU  89   2.699   3.516   9.680
    2    HA   GLU  89           HA       GLU  89   3.960   4.402  12.025
    3    HB2  GLU  89           HB2      GLU  89   4.610   2.376  10.688
    4    HB3  GLU  89           HB3      GLU  89   5.395   3.463   9.541
    5    HG2  GLU  89           HG2      GLU  89   6.881   4.304  11.286
    6    HG3  GLU  89           HG3      GLU  89   6.037   3.356  12.506

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LEU  90           H        LEU  90   4.293   5.550   8.695
    2    HA   LEU  90           HA       LEU  90   6.234   7.540   9.281
    3    HB2  LEU  90           HB2      LEU  90   4.231   7.215   7.049
    4    HB3  LEU  90           HB3      LEU  90   5.469   8.478   7.070
    5    HG   LEU  90           HG       LEU  90   6.125   5.539   7.413
    6   HD12  LEU  90          HD11      LEU  90   6.881   5.762   4.975
    7   HD11  LEU  90          HD12      LEU  90   5.874   7.208   4.920
    8   HD13  LEU  90          HD13      LEU  90   5.144   5.640   5.265
    9   HD22  LEU  90          HD21      LEU  90   8.027   6.679   8.097
   10   HD21  LEU  90          HD22      LEU  90   7.688   8.083   7.086
   11   HD23  LEU  90          HD23      LEU  90   8.341   6.613   6.364

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  91           H        ILE  91   2.695   7.575   9.123
    2    HA   ILE  91           HA       ILE  91   2.367  10.351   9.566
    3    HB   ILE  91           HB       ILE  91   0.562   7.987  10.110
    4   HG12  ILE  91          HG12      ILE  91   0.331  10.264   8.119
    5   HG13  ILE  91          HG13      ILE  91   1.184   8.764   7.752
    6   HG22  ILE  91          HG21      ILE  91  -1.159  10.054  10.164
    7   HG21  ILE  91          HG22      ILE  91   0.245  10.879  10.838
    8   HG23  ILE  91          HG23      ILE  91  -0.402   9.447  11.636
    9   HD13  ILE  91          HD11      ILE  91  -0.767   7.488   7.795
   10   HD12  ILE  91          HD12      ILE  91  -1.347   9.004   7.108
   11   HD11  ILE  91          HD13      ILE  91  -1.624   8.646   8.813

  No H/Q in entry =          11
  In of MODEL   72
    1    H    THR  92           H        THR  92   2.750   7.613  11.775
    2    HA   THR  92           HA       THR  92   2.308   8.995  14.194
    3    HB   THR  92           HB       THR  92   4.106   6.649  13.540
    4    HG1  THR  92           HG1      THR  92   2.134   5.902  13.436
    5   HG22  THR  92          HG21      THR  92   3.714   6.374  16.174
    6   HG21  THR  92          HG22      THR  92   3.658   8.133  16.095
    7   HG23  THR  92          HG23      THR  92   5.089   7.269  15.529

  No H/Q in entry =           7
  In of MODEL   72
    1    H    GLU  93           H        GLU  93   5.262   8.527  12.270
    2    HA   GLU  93           HA       GLU  93   7.018   9.950  13.968
    3    HB2  GLU  93           HB2      GLU  93   7.113   9.627  10.954
    4    HB3  GLU  93           HB3      GLU  93   8.453  10.153  11.970
    5    HG2  GLU  93           HG2      GLU  93   7.030   7.524  12.421
    6    HG3  GLU  93           HG3      GLU  93   8.417   7.667  11.348

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LEU  94           H        LEU  94   4.981  10.967  11.247
    2    HA   LEU  94           HA       LEU  94   5.799  13.667  11.141
    3    HB2  LEU  94           HB2      LEU  94   3.204  12.311  10.384
    4    HB3  LEU  94           HB3      LEU  94   3.471  14.036  10.138
    5    HG   LEU  94           HG       LEU  94   5.482  12.037   9.099
    6   HD11  LEU  94          HD11      LEU  94   2.746  12.596   8.027
    7   HD13  LEU  94          HD12      LEU  94   3.723  11.135   7.909
    8   HD12  LEU  94          HD13      LEU  94   4.067  12.511   6.861
    9   HD23  LEU  94          HD21      LEU  94   5.745  13.867   7.372
   10   HD22  LEU  94          HD22      LEU  94   6.157  14.363   9.014
   11   HD21  LEU  94          HD23      LEU  94   4.610  14.835   8.310

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  95           H        ILE  95   3.249  12.066  13.029
    2    HA   ILE  95           HA       ILE  95   2.212  14.423  14.215
    3    HB   ILE  95           HB       ILE  95   2.215  11.544  15.148
    4   HG12  ILE  95          HG12      ILE  95   0.004  13.323  14.087
    5   HG13  ILE  95          HG13      ILE  95   0.960  12.257  13.061
    6   HG21  ILE  95          HG21      ILE  95   0.939  14.024  16.339
    7   HG23  ILE  95          HG22      ILE  95   1.980  12.854  17.149
    8   HG22  ILE  95          HG23      ILE  95   0.344  12.398  16.671
    9   HD13  ILE  95          HD11      ILE  95   0.047  10.325  13.983
   10   HD12  ILE  95          HD12      ILE  95  -1.332  11.419  14.052
   11   HD11  ILE  95          HD13      ILE  95  -0.372  11.122  15.500

  No H/Q in entry =          11
  In of MODEL   72
    1    H    GLU  96           H        GLU  96   4.796  12.197  15.224
    2    HA   GLU  96           HA       GLU  96   5.348  13.401  17.714
    3    HB2  GLU  96           HB2      GLU  96   6.290  11.237  17.076
    4    HB3  GLU  96           HB3      GLU  96   7.230  12.003  15.797
    5    HG2  GLU  96           HG2      GLU  96   8.876  12.550  17.262
    6    HG3  GLU  96           HG3      GLU  96   7.729  13.370  18.312

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LEU  97           H        LEU  97   6.435  14.160  14.430
    2    HA   LEU  97           HA       LEU  97   8.325  16.152  15.142
    3    HB2  LEU  97           HB2      LEU  97   6.739  15.601  12.643
    4    HB3  LEU  97           HB3      LEU  97   7.763  17.030  12.764
    5    HG   LEU  97           HG       LEU  97   8.781  14.230  13.335
    6   HD12  LEU  97          HD11      LEU  97   9.786  14.415  11.020
    7   HD11  LEU  97          HD12      LEU  97   8.739  15.808  10.749
    8   HD13  LEU  97          HD13      LEU  97   8.034  14.219  11.047
    9   HD23  LEU  97          HD21      LEU  97  10.957  15.501  12.595
   10   HD22  LEU  97          HD22      LEU  97  10.333  15.777  14.221
   11   HD21  LEU  97          HD23      LEU  97  10.027  16.957  12.949

  No H/Q in entry =          11
  In of MODEL   72
    1    H    HIS  98           H        HIS  98   4.836  16.296  14.476
    2    HA   HIS  98           HA       HIS  98   4.544  19.097  14.602
    3    HB2  HIS  98           HB2      HIS  98   2.646  16.854  15.329
    4    HB3  HIS  98           HB3      HIS  98   2.183  18.556  15.378
    5    HD1  HIS  98           HD1      HIS  98   3.204  15.831  12.984
    6    HD2  HIS  98           HD2      HIS  98   1.840  19.768  12.847
    7    HE1  HIS  98           HE1      HIS  98   2.654  16.314  10.557
    8    HE2  HIS  98           HE2      HIS  98   1.826  18.706  10.452

  No H/Q in entry =           8
  In of MODEL   72
    1    H    GLU  99           H        GLU  99   4.663  16.615  17.109
    2    HA   GLU  99           HA       GLU  99   4.053  18.318  19.300
    3    HB2  GLU  99           HB2      GLU  99   3.957  15.836  19.404
    4    HB3  GLU  99           HB3      GLU  99   5.717  15.786  19.301
    5    HG2  GLU  99           HG2      GLU  99   5.903  17.084  21.372
    6    HG3  GLU  99           HG3      GLU  99   4.150  17.230  21.462

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LYS 100           H        LYS 100   7.109  17.374  17.747
    2    HA   LYS 100           HA       LYS 100   8.762  18.776  19.605
    3    HB2  LYS 100           HB2      LYS 100   9.267  17.842  16.770
    4    HB3  LYS 100           HB3      LYS 100  10.495  18.611  17.780
    5    HG2  LYS 100           HG2      LYS 100  10.109  16.866  19.525
    6    HG3  LYS 100           HG3      LYS 100   8.978  16.063  18.432
    7    HD2  LYS 100           HD2      LYS 100  10.777  15.770  16.772
    8    HD3  LYS 100           HD3      LYS 100  11.913  16.586  17.849
    9    HE2  LYS 100           HE2      LYS 100  11.506  14.836  19.571
   10    HE3  LYS 100           HE3      LYS 100  10.432  14.000  18.445
   11    HZ1  LYS 100           HZ1      LYS 100  13.257  14.660  17.796
   12    HZ3  LYS 100           HZ2      LYS 100  12.212  13.606  16.968
   13    HZ2  LYS 100           HZ3      LYS 100  12.795  13.189  18.509

  No H/Q in entry =          13
  In of MODEL   72
    1    H    LEU 101           H        LEU 101   7.080  19.699  16.642
    2    HA   LEU 101           HA       LEU 101   8.302  22.251  16.303
    3    HB2  LEU 101           HB2      LEU 101   5.706  21.023  15.412
    4    HB3  LEU 101           HB3      LEU 101   5.962  22.752  15.201
    5    HG   LEU 101           HG       LEU 101   7.995  20.728  14.247
    6   HD12  LEU 101          HD11      LEU 101   6.851  21.230  11.957
    7   HD11  LEU 101          HD12      LEU 101   5.449  21.667  12.932
    8   HD13  LEU 101          HD13      LEU 101   6.109  20.035  13.020
    9   HD21  LEU 101          HD21      LEU 101   7.378  23.640  13.681
   10   HD23  LEU 101          HD22      LEU 101   8.359  22.674  12.580
   11   HD22  LEU 101          HD23      LEU 101   8.896  22.935  14.239

  No H/Q in entry =          11
  In of MODEL   72
    1    H    LYS 102           H        LYS 102   6.754  21.125  18.917
    2    HA   LYS 102           HA       LYS 102   6.119  22.224  20.845
    3    HB2  LYS 102           HB2      LYS 102   7.411  24.207  19.719
    4    HB3  LYS 102           HB3      LYS 102   5.815  24.816  19.336
    5    HG2  LYS 102           HG2      LYS 102   7.183  24.563  21.993
    6    HG3  LYS 102           HG3      LYS 102   6.236  25.893  21.358
    7    HD2  LYS 102           HD2      LYS 102   4.982  23.263  22.240
    8    HD3  LYS 102           HD3      LYS 102   5.231  24.626  23.320
    9    HE2  LYS 102           HE2      LYS 102   2.955  24.226  21.826
   10    HE3  LYS 102           HE3      LYS 102   3.461  25.772  22.505
   11    HZ2  LYS 102           HZ1      LYS 102   2.938  25.875  20.124
   12    HZ1  LYS 102           HZ2      LYS 102   4.197  24.788  19.807
   13    HZ3  LYS 102           HZ3      LYS 102   4.543  26.319  20.447

  No H/Q in entry =          13
  In of MODEL   72
    1    H    ALA 103           H        ALA 103   4.494  23.764  18.068
    2    HA   ALA 103           HA       ALA 103   2.039  24.351  18.944
    3    HB1  ALA 103           HB1      ALA 103   1.144  23.506  16.702
    4    HB2  ALA 103           HB2      ALA 103   2.791  22.963  16.378
    5    HB3  ALA 103           HB3      ALA 103   2.461  24.677  16.639

  No H/Q in entry =           5
  In of MODEL   72
    1    H1   ALA   1           H3       ALA   1  10.570 -20.244  -6.186
    2    H2   ALA   1           H2       ALA   1   9.609 -20.450  -7.574
    3    H3   ALA   1           H1       ALA   1   9.165 -21.191  -6.110
    4    HA   ALA   1           HA       ALA   1  10.200 -23.006  -6.842
    5    HB1  ALA   1           HB1      ALA   1  10.303 -22.653  -9.118
    6    HB2  ALA   1           HB2      ALA   1  12.030 -22.508  -8.785
    7    HB3  ALA   1           HB3      ALA   1  11.038 -21.057  -8.942

  No H/Q in entry =           7
  In of MODEL   72
    1    H    GLU   2           H        GLU   2  12.480 -23.965  -6.891
    2    HA   GLU   2           HA       GLU   2  13.856 -23.883  -4.676
    3    HB2  GLU   2           HB2      GLU   2  15.220 -23.764  -7.371
    4    HB3  GLU   2           HB3      GLU   2  15.941 -24.374  -5.883
    5    HG2  GLU   2           HG2      GLU   2  14.918 -26.387  -6.121
    6    HG3  GLU   2           HG3      GLU   2  13.350 -25.636  -6.386

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLU   3           H        GLU   3  15.641 -22.032  -7.077
    2    HA   GLU   3           HA       GLU   3  16.796 -20.344  -5.119
    3    HB2  GLU   3           HB2      GLU   3  16.748 -20.349  -8.129
    4    HB3  GLU   3           HB3      GLU   3  17.496 -19.021  -7.243
    5    HG2  GLU   3           HG2      GLU   3  19.151 -20.399  -6.313
    6    HG3  GLU   3           HG3      GLU   3  18.199 -21.863  -6.532

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LEU   4           H        LEU   4  14.524 -19.494  -7.758
    2    HA   LEU   4           HA       LEU   4  14.066 -16.881  -7.154
    3    HB2  LEU   4           HB2      LEU   4  11.885 -18.849  -7.885
    4    HB3  LEU   4           HB3      LEU   4  11.818 -17.100  -8.088
    5    HG   LEU   4           HG       LEU   4  13.778 -18.975  -9.452
    6   HD13  LEU   4          HD11      LEU   4  12.482 -18.826 -11.365
    7   HD12  LEU   4          HD12      LEU   4  11.779 -17.277 -10.904
    8   HD11  LEU   4          HD13      LEU   4  11.218 -18.763 -10.140
    9   HD23  LEU   4          HD21      LEU   4  14.128 -16.735 -10.808
   10   HD22  LEU   4          HD22      LEU   4  14.982 -16.977  -9.286
   11   HD21  LEU   4          HD23      LEU   4  13.534 -15.975  -9.331

  No H/Q in entry =          11
  In of MODEL   72
    1    H    GLU   5           H        GLU   5  12.566 -19.655  -5.509
    2    HA   GLU   5           HA       GLU   5  10.891 -18.072  -3.814
    3    HB2  GLU   5           HB2      GLU   5  10.455 -20.449  -4.329
    4    HB3  GLU   5           HB3      GLU   5  11.887 -20.890  -3.397
    5    HG2  GLU   5           HG2      GLU   5  10.928 -19.881  -1.387
    6    HG3  GLU   5           HG3      GLU   5   9.519 -19.349  -2.305

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLU   6           H        GLU   6  14.029 -19.664  -3.359
    2    HA   GLU   6           HA       GLU   6  14.379 -18.802  -0.662
    3    HB2  GLU   6           HB2      GLU   6  16.336 -19.756  -2.764
    4    HB3  GLU   6           HB3      GLU   6  16.788 -19.404  -1.095
    5    HG2  GLU   6           HG2      GLU   6  15.211 -21.080  -0.277
    6    HG3  GLU   6           HG3      GLU   6  14.653 -21.391  -1.921

  No H/Q in entry =           6
  In of MODEL   72
    1    H    VAL   7           H        VAL   7  15.157 -17.486  -3.814
    2    HA   VAL   7           HA       VAL   7  16.849 -15.364  -2.950
    3    HB   VAL   7           HB       VAL   7  15.148 -15.727  -5.431
    4   HG11  VAL   7          HG11      VAL   7  17.048 -13.519  -4.619
    5   HG13  VAL   7          HG12      VAL   7  15.408 -13.372  -5.247
    6   HG12  VAL   7          HG13      VAL   7  16.718 -13.882  -6.313
    7   HG21  VAL   7          HG21      VAL   7  17.249 -17.190  -4.853
    8   HG23  VAL   7          HG22      VAL   7  18.160 -15.733  -5.253
    9   HG22  VAL   7          HG23      VAL   7  17.124 -16.482  -6.465

  No H/Q in entry =           9
  In of MODEL   72
    1    H    VAL   8           H        VAL   8  13.357 -15.622  -3.515
    2    HA   VAL   8           HA       VAL   8  12.700 -12.910  -3.052
    3    HB   VAL   8           HB       VAL   8  11.077 -15.431  -2.612
    4   HG13  VAL   8          HG11      VAL   8   9.958 -13.849  -1.295
    5   HG12  VAL   8          HG12      VAL   8   9.168 -13.647  -2.859
    6   HG11  VAL   8          HG13      VAL   8  10.410 -12.508  -2.346
    7   HG21  VAL   8          HG21      VAL   8  11.972 -14.349  -4.992
    8   HG23  VAL   8          HG22      VAL   8  10.420 -13.538  -4.799
    9   HG22  VAL   8          HG23      VAL   8  10.493 -15.297  -4.836

  No H/Q in entry =           9
  In of MODEL   72
    1    H    MET   9           H        MET   9  12.952 -15.711  -0.864
    2    HA   MET   9           HA       MET   9  12.134 -14.431   1.500
    3    HB2  MET   9           HB2      MET   9  14.039 -16.711   0.973
    4    HB3  MET   9           HB3      MET   9  13.728 -16.127   2.609
    5    HG2  MET   9           HG2      MET   9  11.319 -16.527   2.309
    6    HG3  MET   9           HG3      MET   9  11.611 -17.085   0.661
    7    HE1  MET   9           HE1      MET   9  12.503 -17.225   4.180
    8    HE3  MET   9           HE2      MET   9  13.098 -18.839   4.559
    9    HE2  MET   9           HE3      MET   9  11.363 -18.551   4.452

  No H/Q in entry =           9
  In of MODEL   72
    1    H    GLY  10           H        GLY  10  15.319 -14.669  -0.047
    2    HA3  GLY  10           HA2      GLY  10  16.777 -13.248   1.923
    3    HA2  GLY  10           HA3      GLY  10  17.244 -13.419   0.231

  No H/Q in entry =           3
  In of MODEL   72
    1    H    LEU  11           H        LEU  11  15.082 -12.195  -1.017
    2    HA   LEU  11           HA       LEU  11  15.774  -9.451  -0.859
    3    HB2  LEU  11           HB2      LEU  11  13.406 -10.858  -2.097
    4    HB3  LEU  11           HB3      LEU  11  13.691  -9.124  -2.260
    5    HG   LEU  11           HG       LEU  11  15.715 -11.240  -3.037
    6   HD13  LEU  11          HD11      LEU  11  13.973 -11.607  -4.561
    7   HD12  LEU  11          HD12      LEU  11  14.981 -10.430  -5.401
    8   HD11  LEU  11          HD13      LEU  11  13.506  -9.906  -4.588
    9   HD22  LEU  11          HD21      LEU  11  16.951  -9.279  -2.813
   10   HD21  LEU  11          HD22      LEU  11  15.580  -8.240  -3.198
   11   HD23  LEU  11          HD23      LEU  11  16.412  -9.114  -4.483

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  12           H        ILE  12  12.998 -11.267   0.406
    2    HA   ILE  12           HA       ILE  12  11.606  -9.037   1.456
    3    HB   ILE  12           HB       ILE  12  11.634 -11.917   2.416
    4   HG12  ILE  12          HG12      ILE  12  10.961 -11.294  -0.039
    5   HG13  ILE  12          HG13      ILE  12   9.928 -12.377   0.873
    6   HG22  ILE  12          HG21      ILE  12   9.365 -11.337   3.334
    7   HG21  ILE  12          HG22      ILE  12   9.686  -9.647   2.948
    8   HG23  ILE  12          HG23      ILE  12  10.686 -10.487   4.133
    9   HD13  ILE  12          HD11      ILE  12   8.403 -10.559   1.362
   10   HD12  ILE  12          HD12      ILE  12   8.698 -10.589  -0.375
   11   HD11  ILE  12          HD13      ILE  12   9.496  -9.398   0.629

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  13           H        ILE  13  13.991 -11.243   2.874
    2    HA   ILE  13           HA       ILE  13  14.022 -10.057   5.451
    3    HB   ILE  13           HB       ILE  13  16.084 -11.636   3.895
    4   HG12  ILE  13          HG12      ILE  13  13.798 -12.590   4.743
    5   HG13  ILE  13          HG13      ILE  13  15.269 -13.523   4.994
    6   HG22  ILE  13          HG21      ILE  13  17.014 -11.988   6.333
    7   HG21  ILE  13          HG22      ILE  13  16.235 -10.445   6.657
    8   HG23  ILE  13          HG23      ILE  13  17.488 -10.556   5.421
    9   HD13  ILE  13          HD11      ILE  13  15.417 -12.770   7.310
   10   HD12  ILE  13          HD12      ILE  13  13.790 -13.379   7.025
   11   HD11  ILE  13          HD13      ILE  13  14.085 -11.644   7.061

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ASN  14           H        ASN  14  15.984  -9.536   2.537
    2    HA   ASN  14           HA       ASN  14  17.727  -7.593   3.598
    3    HB2  ASN  14           HB2      ASN  14  17.710  -8.866   1.286
    4    HB3  ASN  14           HB3      ASN  14  16.820  -7.449   0.743
    5   HD21  ASN  14          HD21      ASN  14  19.263  -7.793  -0.435
    6   HD22  ASN  14          HD22      ASN  14  20.405  -6.709   0.192

  No H/Q in entry =           6
  In of MODEL   72
    1    H    SER  15           H        SER  15  14.621  -7.249   1.896
    2    HA   SER  15           HA       SER  15  14.510  -4.428   1.945
    3    HB2  SER  15           HB2      SER  15  12.179  -4.676   1.444
    4    HB3  SER  15           HB3      SER  15  12.978  -6.042   0.677
    5    HG   SER  15           HG       SER  15  11.152  -5.995   2.689

  No H/Q in entry =           5
  In of MODEL   72
    1    H    GLY  16           H        GLY  16  13.409  -6.882   4.252
    2    HA3  GLY  16           HA2      GLY  16  12.183  -5.128   6.101
    3    HA2  GLY  16           HA3      GLY  16  12.797  -6.736   6.469

  No H/Q in entry =           3
  In of MODEL   72
    1    H    GLN  17           H        GLN  17  15.510  -6.404   5.884
    2    HA   GLN  17           HA       GLN  17  16.459  -5.177   8.264
    3    HB2  GLN  17           HB2      GLN  17  17.684  -6.975   7.063
    4    HB3  GLN  17           HB3      GLN  17  18.015  -5.848   5.747
    5    HG2  GLN  17           HG2      GLN  17  19.943  -5.928   7.237
    6    HG3  GLN  17           HG3      GLN  17  19.174  -4.349   7.365
    7   HE21  GLN  17          HE21      GLN  17  19.981  -7.261   9.121
    8   HE22  GLN  17          HE22      GLN  17  19.324  -6.778  10.609

  No H/Q in entry =           8
  In of MODEL   72
    1    H    ALA  18           H        ALA  18  16.280  -4.108   4.901
    2    HA   ALA  18           HA       ALA  18  17.714  -1.714   5.126
    3    HB1  ALA  18           HB1      ALA  18  16.603  -2.935   3.058
    4    HB3  ALA  18           HB2      ALA  18  16.867  -1.191   3.039
    5    HB2  ALA  18           HB3      ALA  18  15.267  -1.837   3.405

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ARG  19           H        ARG  19  14.213  -2.302   5.513
    2    HA   ARG  19           HA       ARG  19  13.542   0.349   6.219
    3    HB2  ARG  19           HB2      ARG  19  11.864  -1.405   5.632
    4    HB3  ARG  19           HB3      ARG  19  12.201  -2.198   7.172
    5    HG2  ARG  19           HG2      ARG  19  11.486  -0.204   8.404
    6    HG3  ARG  19           HG3      ARG  19  11.240   0.668   6.892
    7    HD2  ARG  19           HD2      ARG  19   9.096  -0.128   7.708
    8    HD3  ARG  19           HD3      ARG  19   9.520  -1.011   6.235
    9    HE   ARG  19           HE       ARG  19  10.473  -2.547   8.348
   10   HH21  ARG  19          HH11      ARG  19   9.222  -4.185   9.287
   11   HH22  ARG  19          HH12      ARG  19   7.503  -4.159   9.111
   12   HH11  ARG  19          HH21      ARG  19   7.482  -1.259   7.240
   13   HH12  ARG  19          HH22      ARG  19   6.518  -2.503   7.947

  No H/Q in entry =          13
  In of MODEL   72
    1    H    SER  20           H        SER  20  14.395  -2.475   8.189
    2    HA   SER  20           HA       SER  20  14.103  -1.369  10.722
    3    HB2  SER  20           HB2      SER  20  14.615  -3.754  10.331
    4    HB3  SER  20           HB3      SER  20  16.238  -3.316   9.806
    5    HG   SER  20           HG       SER  20  15.087  -2.788  12.351

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LEU  21           H        LEU  21  16.953  -1.312   8.595
    2    HA   LEU  21           HA       LEU  21  18.621   0.180  10.335
    3    HB2  LEU  21           HB2      LEU  21  18.610  -0.103   7.322
    4    HB3  LEU  21           HB3      LEU  21  19.860   0.764   8.211
    5    HG   LEU  21           HG       LEU  21  19.125  -2.128   8.754
    6   HD11  LEU  21          HD11      LEU  21  21.244  -0.916   6.963
    7   HD13  LEU  21          HD12      LEU  21  19.990  -2.074   6.520
    8   HD12  LEU  21          HD13      LEU  21  21.327  -2.577   7.554
    9   HD22  LEU  21          HD21      LEU  21  20.269  -1.417  10.662
   10   HD21  LEU  21          HD22      LEU  21  21.226  -0.226   9.788
   11   HD23  LEU  21          HD23      LEU  21  21.625  -1.932   9.662

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ALA  22           H        ALA  22  16.365   1.141   7.769
    2    HA   ALA  22           HA       ALA  22  16.903   3.899   7.777
    3    HB3  ALA  22           HB1      ALA  22  15.506   2.652   6.098
    4    HB2  ALA  22           HB2      ALA  22  14.797   4.166   6.658
    5    HB1  ALA  22           HB3      ALA  22  14.205   2.628   7.288

  No H/Q in entry =           5
  In of MODEL   72
    1    H    TYR  23           H        TYR  23  14.401   2.087   9.609
    2    HA   TYR  23           HA       TYR  23  13.432   4.328  11.049
    3    HB2  TYR  23           HB2      TYR  23  12.198   2.213  11.030
    4    HB3  TYR  23           HB3      TYR  23  13.526   1.405  11.860
    5    HD1  TYR  23           HD1      TYR  23  10.994   4.120  12.208
    6    HD2  TYR  23           HD2      TYR  23  13.743   1.501  14.219
    7    HE1  TYR  23           HE1      TYR  23  10.060   4.818  14.398
    8    HE2  TYR  23           HE2      TYR  23  12.807   2.198  16.407
    9    HH   TYR  23           HH       TYR  23   9.981   4.312  16.608

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ALA  24           H        ALA  24  16.076   2.054  11.701
    2    HA   ALA  24           HA       ALA  24  16.737   3.056  14.264
    3    HB1  ALA  24           HB1      ALA  24  18.095   1.263  14.108
    4    HB3  ALA  24           HB2      ALA  24  19.126   2.182  13.010
    5    HB2  ALA  24           HB3      ALA  24  17.833   1.171  12.367

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ALA  25           H        ALA  25  17.705   3.977  10.986
    2    HA   ALA  25           HA       ALA  25  19.649   5.913  11.633
    3    HB1  ALA  25           HB1      ALA  25  18.940   4.959   9.318
    4    HB3  ALA  25           HB2      ALA  25  19.441   6.647   9.408
    5    HB2  ALA  25           HB3      ALA  25  17.727   6.240   9.334

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LEU  26           H        LEU  26  16.135   6.141  11.259
    2    HA   LEU  26           HA       LEU  26  15.910   8.924  11.703
    3    HB2  LEU  26           HB2      LEU  26  14.051   7.687  10.772
    4    HB3  LEU  26           HB3      LEU  26  13.955   6.663  12.199
    5    HG   LEU  26           HG       LEU  26  13.346   8.624  13.573
    6   HD12  LEU  26          HD11      LEU  26  12.690  10.722  12.240
    7   HD11  LEU  26          HD12      LEU  26  13.675  10.065  10.935
    8   HD13  LEU  26          HD13      LEU  26  14.414  10.454  12.489
    9   HD21  LEU  26          HD21      LEU  26  11.678   8.306  11.058
   10   HD23  LEU  26          HD22      LEU  26  11.113   9.008  12.571
   11   HD22  LEU  26          HD23      LEU  26  11.564   7.306  12.507

  No H/Q in entry =          11
  In of MODEL   72
    1    H    LYS  27           H        LYS  27  15.793   6.151  13.902
    2    HA   LYS  27           HA       LYS  27  15.193   7.523  16.265
    3    HB2  LYS  27           HB2      LYS  27  15.221   5.047  16.006
    4    HB3  LYS  27           HB3      LYS  27  16.984   5.098  15.969
    5    HG2  LYS  27           HG2      LYS  27  17.027   6.089  18.216
    6    HG3  LYS  27           HG3      LYS  27  15.260   6.109  18.256
    7    HD2  LYS  27           HD2      LYS  27  15.234   3.641  18.025
    8    HD3  LYS  27           HD3      LYS  27  16.999   3.629  18.019
    9    HE2  LYS  27           HE2      LYS  27  17.026   4.624  20.274
   10    HE3  LYS  27           HE3      LYS  27  15.260   4.666  20.282
   11    HZ3  LYS  27           HZ1      LYS  27  16.042   2.715  21.440
   12    HZ2  LYS  27           HZ2      LYS  27  16.962   2.232  20.094
   13    HZ1  LYS  27           HZ3      LYS  27  15.265   2.239  20.009

  No H/Q in entry =          13
  In of MODEL   72
    1    H    GLN  28           H        GLN  28  18.315   6.933  14.685
    2    HA   GLN  28           HA       GLN  28  19.993   8.019  16.678
    3    HB2  GLN  28           HB2      GLN  28  20.285   7.952  13.664
    4    HB3  GLN  28           HB3      GLN  28  21.569   8.448  14.768
    5    HG2  GLN  28           HG2      GLN  28  21.501   6.258  15.870
    6    HG3  GLN  28           HG3      GLN  28  20.179   5.755  14.818
    7   HE21  GLN  28          HE21      GLN  28  22.774   4.419  14.929
    8   HE22  GLN  28          HE22      GLN  28  23.492   4.602  13.403

  No H/Q in entry =           8
  In of MODEL   72
    1    H    ALA  29           H        ALA  29  18.253   9.498  13.977
    2    HA   ALA  29           HA       ALA  29  19.256  12.118  14.227
    3    HB2  ALA  29           HB1      ALA  29  17.563  12.754  12.748
    4    HB1  ALA  29           HB2      ALA  29  16.415  11.584  13.398
    5    HB3  ALA  29           HB3      ALA  29  17.747  11.037  12.381

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LYS  30           H        LYS  30  16.471  10.527  15.742
    2    HA   LYS  30           HA       LYS  30  15.457  12.786  17.091
    3    HB2  LYS  30           HB2      LYS  30  15.336   9.847  17.801
    4    HB3  LYS  30           HB3      LYS  30  14.470  11.102  18.689
    5    HG2  LYS  30           HG2      LYS  30  13.354  11.785  16.565
    6    HG3  LYS  30           HG3      LYS  30  14.158  10.445  15.744
    7    HD2  LYS  30           HD2      LYS  30  13.078   8.844  17.273
    8    HD3  LYS  30           HD3      LYS  30  12.283  10.173  18.118
    9    HE2  LYS  30           HE2      LYS  30  11.124  10.804  16.020
   10    HE3  LYS  30           HE3      LYS  30  11.898   9.446  15.195
   11    HZ2  LYS  30           HZ1      LYS  30   9.585   9.044  16.069
   12    HZ1  LYS  30           HZ2      LYS  30  10.248   9.099  17.638
   13    HZ3  LYS  30           HZ3      LYS  30  10.757   7.910  16.532

  No H/Q in entry =          13
  In of MODEL   72
    1    H    GLN  31           H        GLN  31  18.110  10.612  17.841
    2    HA   GLN  31           HA       GLN  31  18.431  11.632  20.535
    3    HB2  GLN  31           HB2      GLN  31  20.455  10.052  18.940
    4    HB3  GLN  31           HB3      GLN  31  20.316  10.181  20.694
    5    HG2  GLN  31           HG2      GLN  31  17.802   9.233  19.919
    6    HG3  GLN  31           HG3      GLN  31  18.905   8.383  18.844
    7   HE21  GLN  31          HE21      GLN  31  17.352   7.247  21.118
    8   HE22  GLN  31          HE22      GLN  31  18.503   6.585  22.174

  No H/Q in entry =           8
  In of MODEL   72
    1    H    GLY  32           H        GLY  32  18.964  12.941  17.567
    2    HA3  GLY  32           HA2      GLY  32  19.955  14.982  17.051
    3    HA2  GLY  32           HA3      GLY  32  20.707  14.989  18.641

  No H/Q in entry =           3
  In of MODEL   72
    1    H    ASP  33           H        ASP  33  21.127  12.091  16.872
    2    HA   ASP  33           HA       ASP  33  23.956  12.758  16.414
    3    HB2  ASP  33           HB2      ASP  33  22.440  10.146  16.531
    4    HB3  ASP  33           HB3      ASP  33  24.129  10.257  16.042

  No H/Q in entry =           4
  In of MODEL   72
    1    H    PHE  34           H        PHE  34  23.484  14.078  14.528
    2    HA   PHE  34           HA       PHE  34  22.140  13.092  12.239
    3    HB2  PHE  34           HB2      PHE  34  24.276  15.221  12.470
    4    HB3  PHE  34           HB3      PHE  34  23.294  14.930  11.036
    5    HD1  PHE  34           HD1      PHE  34  23.541  16.870  13.946
    6    HD2  PHE  34           HD2      PHE  34  20.665  14.756  11.556
    7    HE1  PHE  34           HE1      PHE  34  21.724  18.274  14.884
    8    HE2  PHE  34           HE2      PHE  34  18.853  16.160  12.497
    9    HZ   PHE  34           HZ       PHE  34  19.386  17.920  14.156

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ALA  35           H        ALA  35  25.511  12.898  13.258
    2    HA   ALA  35           HA       ALA  35  26.622  12.069  10.806
    3    HB3  ALA  35           HB1      ALA  35  28.294  10.900  12.534
    4    HB2  ALA  35           HB2      ALA  35  27.429  11.930  13.674
    5    HB1  ALA  35           HB3      ALA  35  28.272  12.648  12.303

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ALA  36           H        ALA  36  25.493  10.122  13.573
    2    HA   ALA  36           HA       ALA  36  25.976   7.630  12.304
    3    HB2  ALA  36           HB1      ALA  36  25.537   6.890  14.380
    4    HB3  ALA  36           HB2      ALA  36  23.851   7.388  14.224
    5    HB1  ALA  36           HB3      ALA  36  25.052   8.518  14.847

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ALA  37           H        ALA  37  23.158   9.762  12.424
    2    HA   ALA  37           HA       ALA  37  21.303   7.993  11.246
    3    HB3  ALA  37           HB1      ALA  37  21.533  10.956  11.532
    4    HB1  ALA  37           HB2      ALA  37  20.217   9.881  12.003
    5    HB2  ALA  37           HB3      ALA  37  20.413  10.349  10.313

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LYS  38           H        LYS  38  23.411  10.447   9.769
    2    HA   LYS  38           HA       LYS  38  22.779  10.014   7.090
    3    HB2  LYS  38           HB2      LYS  38  24.587  11.572   8.537
    4    HB3  LYS  38           HB3      LYS  38  25.622  10.579   7.517
    5    HG2  LYS  38           HG2      LYS  38  24.465  11.347   5.516
    6    HG3  LYS  38           HG3      LYS  38  23.268  12.205   6.491
    7    HD2  LYS  38           HD2      LYS  38  24.863  13.803   7.245
    8    HD3  LYS  38           HD3      LYS  38  26.223  12.814   6.716
    9    HE2  LYS  38           HE2      LYS  38  25.874  14.682   5.159
   10    HE3  LYS  38           HE3      LYS  38  25.539  13.143   4.357
   11    HZ3  LYS  38           HZ1      LYS  38  23.344  13.590   4.219
   12    HZ2  LYS  38           HZ2      LYS  38  23.868  15.205   4.304
   13    HZ1  LYS  38           HZ3      LYS  38  23.288  14.425   5.696

  No H/Q in entry =          13
  In of MODEL   72
    1    H    ALA  39           H        ALA  39  25.285   8.418   9.058
    2    HA   ALA  39           HA       ALA  39  26.360   6.824   6.996
    3    HB2  ALA  39           HB1      ALA  39  26.261   5.867   9.841
    4    HB1  ALA  39           HB2      ALA  39  27.216   7.291   9.425
    5    HB3  ALA  39           HB3      ALA  39  27.569   5.738   8.666

  No H/Q in entry =           5
  In of MODEL   72
    1    H    MET  40           H        MET  40  23.739   6.216   9.287
    2    HA   MET  40           HA       MET  40  23.296   3.509   8.558
    3    HB2  MET  40           HB2      MET  40  21.477   5.557   9.839
    4    HB3  MET  40           HB3      MET  40  21.070   3.848   9.667
    5    HG2  MET  40           HG2      MET  40  23.615   4.791  11.014
    6    HG3  MET  40           HG3      MET  40  22.118   4.518  11.903
    7    HE3  MET  40           HE1      MET  40  21.552   0.885  12.085
    8    HE2  MET  40           HE2      MET  40  20.686   2.187  11.272
    9    HE1  MET  40           HE3      MET  40  21.422   2.477  12.847

  No H/Q in entry =           9
  In of MODEL   72
    1    H    MET  41           H        MET  41  21.888   6.561   7.359
    2    HA   MET  41           HA       MET  41  19.935   5.363   5.683
    3    HB2  MET  41           HB2      MET  41  21.419   7.951   5.169
    4    HB3  MET  41           HB3      MET  41  19.893   7.456   4.446
    5    HG2  MET  41           HG2      MET  41  19.139   7.274   6.996
    6    HG3  MET  41           HG3      MET  41  20.448   8.432   7.219
    7    HE2  MET  41           HE1      MET  41  19.896   9.712   3.878
    8    HE1  MET  41           HE2      MET  41  20.849  10.154   5.291
    9    HE3  MET  41           HE3      MET  41  19.578  11.233   4.721

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ASP  42           H        ASP  42  23.310   6.283   5.139
    2    HA   ASP  42           HA       ASP  42  23.410   5.803   2.382
    3    HB2  ASP  42           HB2      ASP  42  25.156   6.804   4.155
    4    HB3  ASP  42           HB3      ASP  42  25.813   5.178   4.033

  No H/Q in entry =           4
  In of MODEL   72
    1    H    GLN  43           H        GLN  43  24.125   3.654   5.110
    2    HA   GLN  43           HA       GLN  43  24.794   1.392   3.535
    3    HB2  GLN  43           HB2      GLN  43  23.762   1.583   6.375
    4    HB3  GLN  43           HB3      GLN  43  24.343   0.092   5.625
    5    HG2  GLN  43           HG2      GLN  43  26.509   1.301   5.118
    6    HG3  GLN  43           HG3      GLN  43  25.923   2.631   6.113
    7   HE21  GLN  43          HE21      GLN  43  28.153   1.659   7.158
    8   HE22  GLN  43          HE22      GLN  43  27.874   0.580   8.436

  No H/Q in entry =           8
  In of MODEL   72
    1    H    SER  44           H        SER  44  21.734   2.530   4.908
    2    HA   SER  44           HA       SER  44  20.167   0.286   4.235
    3    HB2  SER  44           HB2      SER  44  19.722   2.817   5.374
    4    HB3  SER  44           HB3      SER  44  18.692   2.771   3.946
    5    HG   SER  44           HG       SER  44  17.593   1.832   5.667

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ARG  45           H        ARG  45  20.916   3.246   2.426
    2    HA   ARG  45           HA       ARG  45  19.398   2.755   0.118
    3    HB2  ARG  45           HB2      ARG  45  20.541   4.892   0.701
    4    HB3  ARG  45           HB3      ARG  45  22.086   4.136   0.321
    5    HG2  ARG  45           HG2      ARG  45  21.310   3.726  -1.994
    6    HG3  ARG  45           HG3      ARG  45  19.776   4.505  -1.614
    7    HD2  ARG  45           HD2      ARG  45  21.026   6.602  -1.031
    8    HD3  ARG  45           HD3      ARG  45  22.524   5.827  -1.593
    9    HE   ARG  45           HE       ARG  45  20.599   5.585  -3.635
   10   HH21  ARG  45          HH11      ARG  45  20.598   6.950  -5.401
   11   HH22  ARG  45          HH12      ARG  45  21.356   8.500  -5.298
   12   HH11  ARG  45          HH21      ARG  45  22.326   8.086  -2.008
   13   HH12  ARG  45          HH22      ARG  45  22.333   9.143  -3.374

  No H/Q in entry =          13
  In of MODEL   72
    1    H    MET  46           H        MET  46  22.759   1.880   0.877
    2    HA   MET  46           HA       MET  46  23.371   0.681  -1.602
    3    HB2  MET  46           HB2      MET  46  24.470   0.363   1.191
    4    HB3  MET  46           HB3      MET  46  25.128  -0.538  -0.178
    5    HG2  MET  46           HG2      MET  46  25.583   1.559  -1.371
    6    HG3  MET  46           HG3      MET  46  24.870   2.483  -0.055
    7    HE1  MET  46           HE1      MET  46  27.464   0.166  -1.308
    8    HE3  MET  46           HE2      MET  46  27.409  -0.739   0.200
    9    HE2  MET  46           HE3      MET  46  28.832   0.223  -0.189

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ALA  47           H        ALA  47  21.979  -0.643   1.373
    2    HA   ALA  47           HA       ALA  47  21.924  -3.358   0.577
    3    HB2  ALA  47           HB1      ALA  47  21.540  -2.891   2.879
    4    HB3  ALA  47           HB2      ALA  47  20.004  -3.494   2.258
    5    HB1  ALA  47           HB3      ALA  47  20.235  -1.763   2.512

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LEU  48           H        LEU  48  19.576  -0.729   0.207
    2    HA   LEU  48           HA       LEU  48  17.532  -2.263  -1.045
    3    HB2  LEU  48           HB2      LEU  48  18.191   0.690  -1.165
    4    HB3  LEU  48           HB3      LEU  48  16.720  -0.020  -1.834
    5    HG   LEU  48           HG       LEU  48  17.567  -0.315   1.058
    6   HD13  LEU  48          HD11      LEU  48  17.153   1.986   0.864
    7   HD12  LEU  48          HD12      LEU  48  15.592   1.342   1.371
    8   HD11  LEU  48          HD13      LEU  48  15.868   1.759  -0.320
    9   HD22  LEU  48          HD21      LEU  48  16.036  -2.028   0.678
   10   HD21  LEU  48          HD22      LEU  48  15.166  -1.127  -0.565
   11   HD23  LEU  48          HD23      LEU  48  14.951  -0.718   1.137

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ASN  49           H        ASN  49  20.226  -0.342  -2.274
    2    HA   ASN  49           HA       ASN  49  19.581  -0.432  -4.999
    3    HB2  ASN  49           HB2      ASN  49  21.265   1.078  -4.053
    4    HB3  ASN  49           HB3      ASN  49  22.296  -0.291  -3.657
    5   HD21  ASN  49          HD21      ASN  49  24.033   0.264  -5.057
    6   HD22  ASN  49          HD22      ASN  49  23.883   0.287  -6.746

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLU  50           H        GLU  50  21.557  -2.625  -3.027
    2    HA   GLU  50           HA       GLU  50  22.259  -4.388  -5.146
    3    HB2  GLU  50           HB2      GLU  50  23.453  -4.359  -2.978
    4    HB3  GLU  50           HB3      GLU  50  22.007  -4.982  -2.183
    5    HG2  GLU  50           HG2      GLU  50  22.096  -7.019  -3.536
    6    HG3  GLU  50           HG3      GLU  50  23.474  -6.391  -4.436

  No H/Q in entry =           6
  In of MODEL   72
    1    H    ALA  51           H        ALA  51  19.598  -4.311  -2.826
    2    HA   ALA  51           HA       ALA  51  18.429  -6.784  -3.578
    3    HB3  ALA  51           HB1      ALA  51  16.835  -6.270  -2.027
    4    HB1  ALA  51           HB2      ALA  51  16.626  -4.625  -2.631
    5    HB2  ALA  51           HB3      ALA  51  17.982  -5.011  -1.571

  No H/Q in entry =           5
  In of MODEL   72
    1    H    HIS  52           H        HIS  52  17.851  -3.438  -4.624
    2    HA   HIS  52           HA       HIS  52  15.741  -3.966  -6.426
    3    HB2  HIS  52           HB2      HIS  52  16.405  -1.700  -5.624
    4    HB3  HIS  52           HB3      HIS  52  17.848  -1.803  -6.634
    5    HD1  HIS  52           HD1      HIS  52  17.508  -1.743  -9.225
    6    HD2  HIS  52           HD2      HIS  52  13.992  -1.244  -7.042
    7    HE1  HIS  52           HE1      HIS  52  15.760  -0.916 -10.861
    8    HE2  HIS  52           HE2      HIS  52  13.611  -0.606  -9.545

  No H/Q in entry =           8
  In of MODEL   72
    1    H    LEU  53           H        LEU  53  19.260  -3.979  -6.852
    2    HA   LEU  53           HA       LEU  53  19.321  -4.303  -9.651
    3    HB2  LEU  53           HB2      LEU  53  21.249  -5.061  -7.471
    4    HB3  LEU  53           HB3      LEU  53  21.568  -5.455  -9.158
    5    HG   LEU  53           HG       LEU  53  20.909  -2.641  -8.231
    6   HD12  LEU  53          HD11      LEU  53  23.413  -2.284  -8.532
    7   HD11  LEU  53          HD12      LEU  53  23.574  -4.040  -8.531
    8   HD13  LEU  53          HD13      LEU  53  22.948  -3.213  -7.110
    9   HD22  LEU  53          HD21      LEU  53  20.628  -2.689 -10.569
   10   HD21  LEU  53          HD22      LEU  53  21.891  -3.896 -10.788
   11   HD23  LEU  53          HD23      LEU  53  22.323  -2.233 -10.433

  No H/Q in entry =          11
  In of MODEL   72
    1    H    VAL  54           H        VAL  54  19.200  -6.682  -7.018
    2    HA   VAL  54           HA       VAL  54  19.323  -8.982  -8.671
    3    HB   VAL  54           HB       VAL  54  18.164  -8.547  -5.907
    4   HG12  VAL  54          HG11      VAL  54  18.485 -11.166  -5.893
    5   HG11  VAL  54          HG12      VAL  54  18.303 -11.002  -7.640
    6   HG13  VAL  54          HG13      VAL  54  17.013 -10.467  -6.565
    7   HG22  VAL  54          HG21      VAL  54  20.480  -8.339  -5.680
    8   HG21  VAL  54          HG22      VAL  54  20.818  -9.436  -7.017
    9   HG23  VAL  54          HG23      VAL  54  20.284 -10.077  -5.464

  No H/Q in entry =           9
  In of MODEL   72
    1    H    GLN  55           H        GLN  55  16.595  -7.071  -7.399
    2    HA   GLN  55           HA       GLN  55  14.574  -8.736  -8.471
    3    HB2  GLN  55           HB2      GLN  55  13.824  -7.204  -6.850
    4    HB3  GLN  55           HB3      GLN  55  14.620  -5.839  -7.629
    5    HG2  GLN  55           HG2      GLN  55  12.899  -5.518  -9.123
    6    HG3  GLN  55           HG3      GLN  55  12.576  -7.238  -9.288
    7   HE21  GLN  55          HE21      GLN  55  10.567  -7.783  -8.485
    8   HE22  GLN  55          HE22      GLN  55   9.791  -7.023  -7.181

  No H/Q in entry =           8
  In of MODEL   72
    1    H    THR  56           H        THR  56  16.319  -5.942  -9.836
    2    HA   THR  56           HA       THR  56  14.885  -5.587 -12.188
    3    HB   THR  56           HB       THR  56  17.904  -5.502 -12.025
    4    HG1  THR  56           HG1      THR  56  16.448  -4.336 -10.379
    5   HG21  THR  56          HG21      THR  56  15.837  -4.061 -13.703
    6   HG23  THR  56          HG22      THR  56  17.057  -5.201 -14.267
    7   HG22  THR  56          HG23      THR  56  17.545  -3.621 -13.653

  No H/Q in entry =           7
  In of MODEL   72
    1    H    LYS  57           H        LYS  57  17.532  -7.884 -11.565
    2    HA   LYS  57           HA       LYS  57  17.536  -9.087 -14.139
    3    HB2  LYS  57           HB2      LYS  57  19.321  -9.334 -12.386
    4    HB3  LYS  57           HB3      LYS  57  18.214 -10.331 -11.453
    5    HG2  LYS  57           HG2      LYS  57  18.125 -11.980 -13.253
    6    HG3  LYS  57           HG3      LYS  57  19.156 -10.973 -14.263
    7    HD2  LYS  57           HD2      LYS  57  20.985 -11.186 -12.618
    8    HD3  LYS  57           HD3      LYS  57  19.960 -12.201 -11.605
    9    HE2  LYS  57           HE2      LYS  57  19.803 -13.874 -13.406
   10    HE3  LYS  57           HE3      LYS  57  20.790 -12.863 -14.460
   11    HZ3  LYS  57           HZ1      LYS  57  22.526 -13.901 -13.598
   12    HZ2  LYS  57           HZ2      LYS  57  21.595 -14.632 -12.381
   13    HZ1  LYS  57           HZ3      LYS  57  22.231 -13.075 -12.147

  No H/Q in entry =          13
  In of MODEL   72
    1    H    LEU  58           H        LEU  58  15.750  -9.743 -11.164
    2    HA   LEU  58           HA       LEU  58  14.529 -12.120 -12.093
    3    HB2  LEU  58           HB2      LEU  58  13.731 -10.206  -9.905
    4    HB3  LEU  58           HB3      LEU  58  12.924 -11.745 -10.217
    5    HG   LEU  58           HG       LEU  58  15.896 -11.466  -9.659
    6   HD11  LEU  58          HD11      LEU  58  13.522 -11.876  -7.868
    7   HD13  LEU  58          HD12      LEU  58  14.975 -10.913  -7.607
    8   HD12  LEU  58          HD13      LEU  58  15.047 -12.668  -7.466
    9   HD22  LEU  58          HD21      LEU  58  15.779 -13.531 -10.679
   10   HD21  LEU  58          HD22      LEU  58  14.065 -13.739 -10.321
   11   HD23  LEU  58          HD23      LEU  58  15.271 -14.036  -9.069

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  59           H        ILE  59  13.860  -8.785 -12.788
    2    HA   ILE  59           HA       ILE  59  11.145  -9.436 -13.730
    3    HB   ILE  59           HB       ILE  59  11.945  -7.151 -12.530
    4   HG12  ILE  59          HG12      ILE  59  10.048  -7.054 -14.889
    5   HG13  ILE  59          HG13      ILE  59   9.624  -7.784 -13.362
    6   HG21  ILE  59          HG21      ILE  59  13.496  -6.766 -14.593
    7   HG23  ILE  59          HG22      ILE  59  12.533  -5.421 -14.024
    8   HG22  ILE  59          HG23      ILE  59  12.025  -6.344 -15.436
    9   HD13  ILE  59          HD11      ILE  59   8.825  -5.540 -13.244
   10   HD12  ILE  59          HD12      ILE  59  10.346  -4.906 -13.871
   11   HD11  ILE  59          HD13      ILE  59  10.280  -5.594 -12.247

  No H/Q in entry =          11
  In of MODEL   72
    1    H    GLU  60           H        GLU  60  14.352  -8.589 -14.986
    2    HA   GLU  60           HA       GLU  60  13.576  -8.198 -17.697
    3    HB2  GLU  60           HB2      GLU  60  15.756  -7.468 -16.829
    4    HB3  GLU  60           HB3      GLU  60  16.218  -9.145 -16.549
    5    HG2  GLU  60           HG2      GLU  60  16.021  -9.608 -18.966
    6    HG3  GLU  60           HG3      GLU  60  15.551  -7.934 -19.251

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLY  61           H        GLY  61  14.550 -11.074 -15.871
    2    HA3  GLY  61           HA2      GLY  61  14.012 -12.730 -18.267
    3    HA2  GLY  61           HA3      GLY  61  15.041 -13.207 -16.921

  No H/Q in entry =           3
  In of MODEL   72
    1    H    ASP  62           H        ASP  62  11.922 -11.657 -16.559
    2    HA   ASP  62           HA       ASP  62  10.995 -13.750 -14.830
    3    HB2  ASP  62           HB2      ASP  62   8.968 -12.352 -14.664
    4    HB3  ASP  62           HB3      ASP  62  10.439 -11.429 -14.371

  No H/Q in entry =           4
  In of MODEL   72
    1    H    ALA  63           H        ALA  63  10.151 -15.650 -15.538
    2    HA   ALA  63           HA       ALA  63   8.389 -15.590 -17.936
    3    HB1  ALA  63           HB1      ALA  63   9.235 -17.919 -18.406
    4    HB3  ALA  63           HB2      ALA  63  10.469 -17.655 -17.176
    5    HB2  ALA  63           HB3      ALA  63  10.441 -16.650 -18.625

  No H/Q in entry =           5
  In of MODEL   72
    1    H    GLY  64           H        GLY  64   9.262 -17.170 -14.906
    2    HA3  GLY  64           HA2      GLY  64   8.049 -18.361 -13.370
    3    HA2  GLY  64           HA3      GLY  64   6.638 -17.505 -13.977

  No H/Q in entry =           3
  In of MODEL   72
    1    H    GLU  65           H        GLU  65   5.090 -19.005 -14.324
    2    HA   GLU  65           HA       GLU  65   5.523 -21.707 -14.827
    3    HB2  GLU  65           HB2      GLU  65   3.147 -19.967 -15.472
    4    HB3  GLU  65           HB3      GLU  65   3.147 -21.721 -15.644
    5    HG2  GLU  65           HG2      GLU  65   3.681 -21.991 -13.277
    6    HG3  GLU  65           HG3      GLU  65   3.790 -20.243 -13.078

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLY  66           H        GLY  66   4.093 -22.553 -16.867
    2    HA3  GLY  66           HA2      GLY  66   5.840 -22.576 -19.062
    3    HA2  GLY  66           HA3      GLY  66   4.206 -23.208 -19.043

  No H/Q in entry =           3
  In of MODEL   72
    1    H    LYS  67           H        LYS  67   2.907 -20.733 -18.495
    2    HA   LYS  67           HA       LYS  67   2.706 -19.737 -21.166
    3    HB2  LYS  67           HB2      LYS  67   1.310 -18.995 -18.600
    4    HB3  LYS  67           HB3      LYS  67   0.909 -18.299 -20.174
    5    HG2  LYS  67           HG2      LYS  67   0.512 -20.562 -21.078
    6    HG3  LYS  67           HG3      LYS  67   0.905 -21.260 -19.510
    7    HD2  LYS  67           HD2      LYS  67  -0.992 -20.041 -18.496
    8    HD3  LYS  67           HD3      LYS  67  -1.397 -19.372 -20.080
    9    HE2  LYS  67           HE2      LYS  67  -1.725 -21.650 -20.966
   10    HE3  LYS  67           HE3      LYS  67  -1.318 -22.325 -19.389
   11    HZ3  LYS  67           HZ1      LYS  67  -3.501 -22.198 -19.020
   12    HZ2  LYS  67           HZ2      LYS  67  -3.764 -21.104 -20.292
   13    HZ1  LYS  67           HZ3      LYS  67  -3.236 -20.541 -18.777

  No H/Q in entry =          13
  In of MODEL   72
    1    H    MET  68           H        MET  68   2.775 -17.607 -21.860
    2    HA   MET  68           HA       MET  68   5.110 -16.246 -21.614
    3    HB2  MET  68           HB2      MET  68   2.371 -15.155 -22.256
    4    HB3  MET  68           HB3      MET  68   3.876 -14.275 -22.526
    5    HG2  MET  68           HG2      MET  68   4.636 -15.839 -24.134
    6    HG3  MET  68           HG3      MET  68   3.453 -17.048 -23.637
    7    HE2  MET  68           HE1      MET  68   2.225 -13.001 -25.407
    8    HE1  MET  68           HE2      MET  68   3.710 -13.366 -24.533
    9    HE3  MET  68           HE3      MET  68   2.170 -13.378 -23.679

  No H/Q in entry =           9
  In of MODEL   72
    1    H    LYS  69           H        LYS  69   2.940 -16.442 -19.054
    2    HA   LYS  69           HA       LYS  69   3.023 -13.818 -18.023
    3    HB2  LYS  69           HB2      LYS  69   2.301 -16.496 -16.931
    4    HB3  LYS  69           HB3      LYS  69   2.504 -15.150 -15.806
    5    HG2  LYS  69           HG2      LYS  69   0.171 -15.269 -16.566
    6    HG3  LYS  69           HG3      LYS  69   0.933 -13.793 -17.156
    7    HD2  LYS  69           HD2      LYS  69   1.270 -14.768 -19.345
    8    HD3  LYS  69           HD3      LYS  69   0.710 -16.342 -18.778
    9    HE2  LYS  69           HE2      LYS  69  -1.130 -15.292 -19.943
   10    HE3  LYS  69           HE3      LYS  69  -1.501 -15.268 -18.220
   11    HZ2  LYS  69           HZ1      LYS  69  -1.117 -13.087 -20.008
   12    HZ1  LYS  69           HZ2      LYS  69  -0.080 -12.972 -18.667
   13    HZ3  LYS  69           HZ3      LYS  69  -1.760 -13.089 -18.439

  No H/Q in entry =          13
  In of MODEL   72
    1    H    VAL  70           H        VAL  70   3.732 -13.985 -15.346
    2    HA   VAL  70           HA       VAL  70   6.671 -14.387 -15.405
    3    HB   VAL  70           HB       VAL  70   6.825 -12.372 -13.938
    4   HG12  VAL  70          HG11      VAL  70   5.463 -11.871 -16.601
    5   HG11  VAL  70          HG12      VAL  70   7.174 -12.250 -16.403
    6   HG13  VAL  70          HG13      VAL  70   6.521 -10.749 -15.748
    7   HG23  VAL  70          HG21      VAL  70   4.639 -10.867 -14.243
    8   HG22  VAL  70          HG22      VAL  70   4.764 -12.025 -12.920
    9   HG21  VAL  70          HG23      VAL  70   3.852 -12.441 -14.370

  No H/Q in entry =           9
  In of MODEL   72
    1    H    SER  71           H        SER  71   7.604 -14.579 -13.207
    2    HA   SER  71           HA       SER  71   6.369 -16.596 -11.663
    3    HB2  SER  71           HB2      SER  71   8.811 -16.190 -11.680
    4    HB3  SER  71           HB3      SER  71   8.554 -14.661 -10.845
    5    HG   SER  71           HG       SER  71   7.858 -17.260  -9.927

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LEU  72           H        LEU  72   5.025 -16.507  -9.934
    2    HA   LEU  72           HA       LEU  72   3.475 -14.192  -9.500
    3    HB2  LEU  72           HB2      LEU  72   3.758 -16.749  -7.929
    4    HB3  LEU  72           HB3      LEU  72   2.596 -15.488  -7.522
    5    HG   LEU  72           HG       LEU  72   2.738 -16.772 -10.269
    6   HD12  LEU  72          HD11      LEU  72   0.913 -17.446  -7.941
    7   HD11  LEU  72          HD12      LEU  72   2.214 -18.469  -8.544
    8   HD13  LEU  72          HD13      LEU  72   0.816 -18.132  -9.563
    9   HD22  LEU  72          HD21      LEU  72   1.508 -14.787 -10.501
   10   HD21  LEU  72          HD22      LEU  72   0.848 -14.874  -8.876
   11   HD23  LEU  72          HD23      LEU  72   0.241 -15.951 -10.130

  No H/Q in entry =          11
  In of MODEL   72
    1    H    VAL  73           H        VAL  73   6.127 -15.625  -7.716
    2    HA   VAL  73           HA       VAL  73   6.061 -14.085  -5.389
    3    HB   VAL  73           HB       VAL  73   8.249 -14.889  -4.958
    4   HG11  VAL  73          HG11      VAL  73   6.305 -16.567  -5.256
    5   HG13  VAL  73          HG12      VAL  73   7.945 -17.217  -5.239
    6   HG12  VAL  73          HG13      VAL  73   7.093 -17.005  -6.770
    7   HG23  VAL  73          HG21      VAL  73   9.405 -16.091  -7.016
    8   HG22  VAL  73          HG22      VAL  73   9.589 -14.354  -6.780
    9   HG21  VAL  73          HG23      VAL  73   8.421 -14.965  -7.951

  No H/Q in entry =           9
  In of MODEL   72
    1    H    LEU  74           H        LEU  74   7.060 -13.201  -8.565
    2    HA   LEU  74           HA       LEU  74   9.005 -11.251  -8.073
    3    HB2  LEU  74           HB2      LEU  74   8.555 -12.007 -10.310
    4    HB3  LEU  74           HB3      LEU  74   6.889 -11.438 -10.215
    5    HG   LEU  74           HG       LEU  74   7.691  -9.112 -10.010
    6   HD13  LEU  74          HD11      LEU  74   9.798  -9.301  -8.935
    7   HD12  LEU  74          HD12      LEU  74  10.195  -8.811 -10.581
    8   HD11  LEU  74          HD13      LEU  74  10.376 -10.496 -10.096
    9   HD23  LEU  74          HD21      LEU  74   9.185 -10.223 -12.329
   10   HD22  LEU  74          HD22      LEU  74   8.046  -8.898 -12.246
   11   HD21  LEU  74          HD23      LEU  74   7.456 -10.544 -12.227

  No H/Q in entry =          11
  In of MODEL   72
    1    H    VAL  75           H        VAL  75   5.510 -10.866  -8.437
    2    HA   VAL  75           HA       VAL  75   5.414  -8.108  -7.858
    3    HB   VAL  75           HB       VAL  75   3.323 -10.251  -7.475
    4   HG13  VAL  75          HG11      VAL  75   2.824  -8.343  -5.998
    5   HG12  VAL  75          HG12      VAL  75   1.752  -8.293  -7.389
    6   HG11  VAL  75          HG13      VAL  75   3.139  -7.217  -7.315
    7   HG23  VAL  75          HG21      VAL  75   3.729  -8.113  -9.594
    8   HG22  VAL  75          HG22      VAL  75   2.438  -9.312  -9.570
    9   HG21  VAL  75          HG23      VAL  75   4.112  -9.821  -9.804

  No H/Q in entry =           9
  In of MODEL   72
    1    H    GLU  76           H        GLU  76   5.152 -10.979  -5.741
    2    HA   GLU  76           HA       GLU  76   4.675  -9.611  -3.325
    3    HB2  GLU  76           HB2      GLU  76   4.520 -12.093  -3.597
    4    HB3  GLU  76           HB3      GLU  76   6.268 -12.166  -3.747
    5    HG2  GLU  76           HG2      GLU  76   6.516 -11.262  -1.462
    6    HG3  GLU  76           HG3      GLU  76   4.773 -11.177  -1.286

  No H/Q in entry =           6
  In of MODEL   72
    1    H    ALA  77           H        ALA  77   7.739 -10.524  -4.876
    2    HA   ALA  77           HA       ALA  77   9.423  -9.476  -2.857
    3    HB3  ALA  77           HB1      ALA  77  10.071  -9.649  -5.806
    4    HB1  ALA  77           HB2      ALA  77  10.113 -11.035  -4.717
    5    HB2  ALA  77           HB3      ALA  77  11.203  -9.675  -4.453

  No H/Q in entry =           5
  In of MODEL   72
    1    H    GLN  78           H        GLN  78   8.042  -8.066  -5.780
    2    HA   GLN  78           HA       GLN  78   9.396  -5.588  -5.678
    3    HB2  GLN  78           HB2      GLN  78   8.105  -6.507  -7.637
    4    HB3  GLN  78           HB3      GLN  78   6.620  -6.125  -6.768
    5    HG2  GLN  78           HG2      GLN  78   7.270  -3.755  -6.683
    6    HG3  GLN  78           HG3      GLN  78   8.766  -4.127  -7.540
    7   HE21  GLN  78          HE21      GLN  78   6.892  -2.306  -8.675
    8   HE22  GLN  78          HE22      GLN  78   6.197  -3.026 -10.047

  No H/Q in entry =           8
  In of MODEL   72
    1    H    LEU  79           H        LEU  79   6.370  -6.718  -4.256
    2    HA   LEU  79           HA       LEU  79   5.375  -4.307  -3.257
    3    HB2  LEU  79           HB2      LEU  79   4.058  -6.357  -3.200
    4    HB3  LEU  79           HB3      LEU  79   5.198  -7.094  -2.079
    5    HG   LEU  79           HG       LEU  79   4.641  -5.447  -0.359
    6   HD13  LEU  79          HD11      LEU  79   4.182  -3.434  -1.417
    7   HD12  LEU  79          HD12      LEU  79   2.555  -3.957  -0.982
    8   HD11  LEU  79          HD13      LEU  79   3.141  -4.185  -2.628
    9   HD23  LEU  79          HD21      LEU  79   2.054  -5.935  -0.277
   10   HD22  LEU  79          HD22      LEU  79   3.191  -7.276  -0.160
   11   HD21  LEU  79          HD23      LEU  79   2.384  -6.942  -1.689

  No H/Q in entry =          11
  In of MODEL   72
    1    H    HIS  80           H        HIS  80   7.549  -6.640  -1.659
    2    HA   HIS  80           HA       HIS  80   7.829  -5.092   0.707
    3    HB2  HIS  80           HB2      HIS  80   9.169  -7.461  -0.480
    4    HB3  HIS  80           HB3      HIS  80  10.076  -6.562   0.738
    5    HD1  HIS  80           HD1      HIS  80   9.575  -7.190   3.081
    6    HD2  HIS  80           HD2      HIS  80   6.367  -8.044   0.558
    7    HE1  HIS  80           HE1      HIS  80   7.796  -8.287   4.525
    8    HE2  HIS  80           HE2      HIS  80   5.834  -8.811   2.995

  No H/Q in entry =           8
  In of MODEL   72
    1    H    LEU  81           H        LEU  81   9.847  -5.379  -2.197
    2    HA   LEU  81           HA       LEU  81  11.890  -3.639  -1.314
    3    HB2  LEU  81           HB2      LEU  81  10.979  -4.438  -4.079
    4    HB3  LEU  81           HB3      LEU  81  12.400  -3.433  -3.786
    5    HG   LEU  81           HG       LEU  81  11.997  -6.150  -2.506
    6   HD12  LEU  81          HD11      LEU  81  13.819  -6.785  -4.246
    7   HD11  LEU  81          HD12      LEU  81  13.260  -5.362  -5.124
    8   HD13  LEU  81          HD13      LEU  81  12.144  -6.684  -4.787
    9   HD23  LEU  81          HD21      LEU  81  14.626  -5.840  -2.481
   10   HD22  LEU  81          HD22      LEU  81  13.640  -5.074  -1.238
   11   HD21  LEU  81          HD23      LEU  81  14.226  -4.127  -2.605

  No H/Q in entry =          11
  In of MODEL   72
    1    H    MET  82           H        MET  82   8.977  -3.003  -3.266
    2    HA   MET  82           HA       MET  82   9.524  -0.279  -3.772
    3    HB2  MET  82           HB2      MET  82   6.961  -1.867  -3.654
    4    HB3  MET  82           HB3      MET  82   6.966  -0.144  -4.023
    5    HG2  MET  82           HG2      MET  82   8.569  -2.225  -5.545
    6    HG3  MET  82           HG3      MET  82   7.005  -1.601  -6.066
    7    HE3  MET  82           HE1      MET  82   7.466   1.850  -7.246
    8    HE2  MET  82           HE2      MET  82   7.084   1.629  -5.540
    9    HE1  MET  82           HE3      MET  82   6.421   0.518  -6.735

  No H/Q in entry =           9
  In of MODEL   72
    1    H    THR  83           H        THR  83   7.717  -1.866  -1.170
    2    HA   THR  83           HA       THR  83   6.866   0.488   0.146
    3    HB   THR  83           HB       THR  83   6.719  -1.080   2.168
    4    HG1  THR  83           HG1      THR  83   7.473  -3.033   1.947
    5   HG22  THR  83          HG21      THR  83   5.069  -2.646   0.697
    6   HG21  THR  83          HG22      THR  83   5.304  -1.322  -0.438
    7   HG23  THR  83          HG23      THR  83   4.657  -1.000   1.171

  No H/Q in entry =           7
  In of MODEL   72
    1    H    SER  84           H        SER  84   9.682  -1.615   0.685
    2    HA   SER  84           HA       SER  84  10.736  -0.181   2.874
    3    HB2  SER  84           HB2      SER  84  11.993  -2.033   0.860
    4    HB3  SER  84           HB3      SER  84  12.936  -1.278   2.143
    5    HG   SER  84           HG       SER  84  10.656  -2.961   2.398

  No H/Q in entry =           5
  In of MODEL   72
    1    H    MET  85           H        MET  85  11.505   0.068  -0.611
    2    HA   MET  85           HA       MET  85  13.508   2.028  -0.357
    3    HB2  MET  85           HB2      MET  85  13.111   0.738  -2.421
    4    HB3  MET  85           HB3      MET  85  11.594   1.605  -2.661
    5    HG2  MET  85           HG2      MET  85  12.814   3.738  -2.786
    6    HG3  MET  85           HG3      MET  85  14.334   2.894  -2.505
    7    HE3  MET  85           HE1      MET  85  11.500   2.526  -6.042
    8    HE2  MET  85           HE2      MET  85  11.995   4.143  -5.549
    9    HE1  MET  85           HE3      MET  85  11.200   3.086  -4.390

  No H/Q in entry =           9
  In of MODEL   72
    1    H    LEU  86           H        LEU  86  10.021   2.371  -0.883
    2    HA   LEU  86           HA       LEU  86   9.967   5.184  -1.073
    3    HB2  LEU  86           HB2      LEU  86   8.120   3.528  -1.652
    4    HB3  LEU  86           HB3      LEU  86   7.782   3.444   0.077
    5    HG   LEU  86           HG       LEU  86   7.629   6.005   0.016
    6   HD11  LEU  86          HD11      LEU  86   8.416   5.560  -2.681
    7   HD13  LEU  86          HD12      LEU  86   7.981   7.090  -1.927
    8   HD12  LEU  86          HD13      LEU  86   6.746   6.129  -2.734
    9   HD23  LEU  86          HD21      LEU  86   5.499   4.655  -1.652
   10   HD22  LEU  86          HD22      LEU  86   5.307   5.919  -0.440
   11   HD21  LEU  86          HD23      LEU  86   5.699   4.275   0.059

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ALA  87           H        ALA  87   9.482   3.015   1.678
    2    HA   ALA  87           HA       ALA  87   8.931   4.936   3.639
    3    HB1  ALA  87           HB1      ALA  87   9.729   2.113   3.564
    4    HB3  ALA  87           HB2      ALA  87   8.602   2.932   4.643
    5    HB2  ALA  87           HB3      ALA  87  10.329   2.959   4.994

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ARG  88           H        ARG  88  12.014   3.499   2.676
    2    HA   ARG  88           HA       ARG  88  13.620   4.877   4.511
    3    HB2  ARG  88           HB2      ARG  88  14.287   2.897   3.116
    4    HB3  ARG  88           HB3      ARG  88  14.450   3.986   1.741
    5    HG2  ARG  88           HG2      ARG  88  15.919   5.300   3.690
    6    HG3  ARG  88           HG3      ARG  88  16.232   3.611   4.075
    7    HD2  ARG  88           HD2      ARG  88  17.506   3.305   2.234
    8    HD3  ARG  88           HD3      ARG  88  16.376   4.177   1.194
    9    HE   ARG  88           HE       ARG  88  18.770   5.236   2.248
   10   HH21  ARG  88          HH11      ARG  88  19.124   7.453   2.049
   11   HH22  ARG  88          HH12      ARG  88  17.777   8.529   1.897
   12   HH11  ARG  88          HH21      ARG  88  15.435   5.999   1.954
   13   HH12  ARG  88          HH22      ARG  88  15.687   7.703   1.819

  No H/Q in entry =          13
  In of MODEL   72
    1    H    GLU  89           H        GLU  89  12.663   5.768   1.181
    2    HA   GLU  89           HA       GLU  89  14.219   8.123   1.025
    3    HB2  GLU  89           HB2      GLU  89  13.079   7.080  -0.925
    4    HB3  GLU  89           HB3      GLU  89  11.534   7.628  -0.275
    5    HG2  GLU  89           HG2      GLU  89  12.244   9.963  -0.441
    6    HG3  GLU  89           HG3      GLU  89  13.848   9.466  -0.970

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LEU  90           H        LEU  90  10.883   7.628   2.142
    2    HA   LEU  90           HA       LEU  90  10.375  10.364   2.707
    3    HB2  LEU  90           HB2      LEU  90   9.167   7.798   3.737
    4    HB3  LEU  90           HB3      LEU  90   8.540   9.396   4.153
    5    HG   LEU  90           HG       LEU  90   8.967   8.507   1.288
    6   HD12  LEU  90          HD11      LEU  90   6.432   8.187   1.341
    7   HD11  LEU  90          HD12      LEU  90   6.580   8.181   3.098
    8   HD13  LEU  90          HD13      LEU  90   7.398   6.946   2.141
    9   HD22  LEU  90          HD21      LEU  90   8.681  10.816   1.207
   10   HD21  LEU  90          HD22      LEU  90   7.689  10.855   2.663
   11   HD23  LEU  90          HD23      LEU  90   6.996  10.298   1.140

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  91           H        ILE  91  11.621   7.684   4.642
    2    HA   ILE  91           HA       ILE  91  11.756   9.056   7.107
    3    HB   ILE  91           HB       ILE  91  13.307   6.709   5.996
    4   HG12  ILE  91          HG12      ILE  91  11.282   6.889   8.247
    5   HG13  ILE  91          HG13      ILE  91  10.817   6.605   6.571
    6   HG22  ILE  91          HG21      ILE  91  13.765   6.501   8.640
    7   HG21  ILE  91          HG22      ILE  91  13.696   8.260   8.533
    8   HG23  ILE  91          HG23      ILE  91  14.875   7.365   7.576
    9   HD13  ILE  91          HD11      ILE  91  11.813   4.500   6.510
   10   HD12  ILE  91          HD12      ILE  91  11.213   4.565   8.168
   11   HD11  ILE  91          HD13      ILE  91  12.917   4.871   7.835

  No H/Q in entry =          11
  In of MODEL   72
    1    H    THR  92           H        THR  92  13.983   8.872   4.365
    2    HA   THR  92           HA       THR  92  16.148  10.261   5.529
    3    HB   THR  92           HB       THR  92  15.173  10.131   2.665
    4    HG1  THR  92           HG1      THR  92  15.997   8.232   3.078
    5   HG22  THR  92          HG21      THR  92  17.747  10.812   2.379
    6   HG21  THR  92          HG22      THR  92  17.435  11.639   3.905
    7   HG23  THR  92          HG23      THR  92  16.472  12.025   2.480

  No H/Q in entry =           7
  In of MODEL   72
    1    H    GLU  93           H        GLU  93  13.272  11.419   3.785
    2    HA   GLU  93           HA       GLU  93  13.875  14.178   3.894
    3    HB2  GLU  93           HB2      GLU  93  11.166  12.814   3.902
    4    HB3  GLU  93           HB3      GLU  93  11.461  14.512   3.526
    5    HG2  GLU  93           HG2      GLU  93  12.798  12.261   2.010
    6    HG3  GLU  93           HG3      GLU  93  11.256  12.947   1.515

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LEU  94           H        LEU  94  12.117  12.034   6.105
    2    HA   LEU  94           HA       LEU  94  11.306  13.988   7.972
    3    HB2  LEU  94           HB2      LEU  94  11.872  11.032   8.257
    4    HB3  LEU  94           HB3      LEU  94  11.298  12.013   9.602
    5    HG   LEU  94           HG       LEU  94   9.824  12.062   6.968
    6   HD11  LEU  94          HD11      LEU  94   9.892   9.846   8.978
    7   HD13  LEU  94          HD12      LEU  94   9.597   9.781   7.242
    8   HD12  LEU  94          HD13      LEU  94   8.316  10.305   8.334
    9   HD23  LEU  94          HD21      LEU  94   7.900  12.472   8.559
   10   HD22  LEU  94          HD22      LEU  94   9.143  13.722   8.597
   11   HD21  LEU  94          HD23      LEU  94   9.071  12.509   9.875

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  95           H        ILE  95  14.275  12.048   7.752
    2    HA   ILE  95           HA       ILE  95  15.436  12.973  10.168
    3    HB   ILE  95           HB       ILE  95  16.681  11.893   7.627
    4   HG12  ILE  95          HG12      ILE  95  16.371  10.701  10.397
    5   HG13  ILE  95          HG13      ILE  95  15.209  10.443   9.098
    6   HG21  ILE  95          HG21      ILE  95  17.929  12.703  10.272
    7   HG23  ILE  95          HG22      ILE  95  18.400  13.225   8.653
    8   HG22  ILE  95          HG23      ILE  95  18.699  11.566   9.167
    9   HD13  ILE  95          HD11      ILE  95  16.689   9.156   7.844
   10   HD12  ILE  95          HD12      ILE  95  17.155   8.710   9.483
   11   HD11  ILE  95          HD13      ILE  95  18.115   9.884   8.585

  No H/Q in entry =          11
  In of MODEL   72
    1    H    GLU  96           H        GLU  96  15.607  14.197   6.831
    2    HA   GLU  96           HA       GLU  96  17.459  16.271   7.309
    3    HB2  GLU  96           HB2      GLU  96  16.801  15.604   5.049
    4    HB3  GLU  96           HB3      GLU  96  15.158  16.167   5.341
    5    HG2  GLU  96           HG2      GLU  96  15.733  18.293   4.796
    6    HG3  GLU  96           HG3      GLU  96  17.028  18.293   5.983

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LEU  97           H        LEU  97  13.945  16.096   7.726
    2    HA   LEU  97           HA       LEU  97  13.536  18.833   8.358
    3    HB2  LEU  97           HB2      LEU  97  12.007  16.314   8.974
    4    HB3  LEU  97           HB3      LEU  97  11.497  17.865   9.639
    5    HG   LEU  97           HG       LEU  97  11.989  17.439   6.677
    6   HD12  LEU  97          HD11      LEU  97   9.466  17.319   6.550
    7   HD11  LEU  97          HD12      LEU  97   9.452  17.124   8.301
    8   HD13  LEU  97          HD13      LEU  97  10.233  15.911   7.285
    9   HD23  LEU  97          HD21      LEU  97  10.257  19.409   6.698
   10   HD22  LEU  97          HD22      LEU  97  11.938  19.764   7.096
   11   HD21  LEU  97          HD23      LEU  97  10.744  19.601   8.382

  No H/Q in entry =          11
  In of MODEL   72
    1    H    HIS  98           H        HIS  98  14.341  16.010  10.365
    2    HA   HIS  98           HA       HIS  98  14.178  17.278  12.877
    3    HB2  HIS  98           HB2      HIS  98  15.924  15.012  11.888
    4    HB3  HIS  98           HB3      HIS  98  15.918  15.555  13.567
    5    HD1  HIS  98           HD1      HIS  98  13.723  13.926  10.972
    6    HD2  HIS  98           HD2      HIS  98  13.604  14.857  15.033
    7    HE1  HIS  98           HE1      HIS  98  11.690  12.741  11.920
    8    HE2  HIS  98           HE2      HIS  98  11.598  13.300  14.389

  No H/Q in entry =           8
  In of MODEL   72
    1    H    GLU  99           H        GLU  99  16.740  17.148  10.451
    2    HA   GLU  99           HA       GLU  99  18.725  18.477  11.984
    3    HB2  GLU  99           HB2      GLU  99  19.207  17.182   9.920
    4    HB3  GLU  99           HB3      GLU  99  18.404  18.437   8.973
    5    HG2  GLU  99           HG2      GLU  99  20.016  20.104   9.765
    6    HG3  GLU  99           HG3      GLU  99  20.787  18.902  10.794

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LYS 100           H        LYS 100  16.213  19.642   9.756
    2    HA   LYS 100           HA       LYS 100  17.019  22.377   9.895
    3    HB2  LYS 100           HB2      LYS 100  14.385  21.095   9.135
    4    HB3  LYS 100           HB3      LYS 100  14.691  22.832   9.040
    5    HG2  LYS 100           HG2      LYS 100  16.666  22.372   7.582
    6    HG3  LYS 100           HG3      LYS 100  16.247  20.657   7.603
    7    HD2  LYS 100           HD2      LYS 100  14.057  21.172   6.594
    8    HD3  LYS 100           HD3      LYS 100  14.460  22.889   6.580
    9    HE2  LYS 100           HE2      LYS 100  16.422  22.398   5.128
   10    HE3  LYS 100           HE3      LYS 100  15.950  20.695   5.098
   11    HZ1  LYS 100           HZ1      LYS 100  14.137  22.892   4.251
   12    HZ3  LYS 100           HZ2      LYS 100  13.947  21.223   3.992
   13    HZ2  LYS 100           HZ3      LYS 100  15.164  22.078   3.173

  No H/Q in entry =          13
  In of MODEL   72
    1    H    LEU 101           H        LEU 101  14.908  20.344  11.858
    2    HA   LEU 101           HA       LEU 101  13.744  22.420  13.427
    3    HB2  LEU 101           HB2      LEU 101  14.173  19.470  13.820
    4    HB3  LEU 101           HB3      LEU 101  13.636  20.456  15.177
    5    HG   LEU 101           HG       LEU 101  12.228  20.543  12.502
    6   HD12  LEU 101          HD11      LEU 101  10.558  18.989  13.770
    7   HD11  LEU 101          HD12      LEU 101  11.947  18.573  14.770
    8   HD13  LEU 101          HD13      LEU 101  11.986  18.262  13.034
    9   HD21  LEU 101          HD21      LEU 101  11.564  21.346  15.350
   10   HD23  LEU 101          HD22      LEU 101  10.306  21.122  14.136
   11   HD22  LEU 101          HD23      LEU 101  11.547  22.352  13.899

  No H/Q in entry =          11
  In of MODEL   72
    1    H    LYS 102           H        LYS 102  16.890  21.799  13.003
    2    HA   LYS 102           HA       LYS 102  18.736  22.665  14.080
    3    HB2  LYS 102           HB2      LYS 102  16.925  24.190  15.203
    4    HB3  LYS 102           HB3      LYS 102  17.123  23.131  16.583
    5    HG2  LYS 102           HG2      LYS 102  19.028  25.131  15.415
    6    HG3  LYS 102           HG3      LYS 102  18.639  24.822  17.094
    7    HD2  LYS 102           HD2      LYS 102  20.304  22.899  15.419
    8    HD3  LYS 102           HD3      LYS 102  20.995  24.220  16.350
    9    HE2  LYS 102           HE2      LYS 102  20.583  21.676  17.324
   10    HE3  LYS 102           HE3      LYS 102  20.804  23.119  18.313
   11    HZ2  LYS 102           HZ1      LYS 102  18.828  21.845  18.927
   12    HZ1  LYS 102           HZ2      LYS 102  18.191  22.074  17.375
   13    HZ3  LYS 102           HZ3      LYS 102  18.423  23.405  18.399

  No H/Q in entry =          13
  In of MODEL   72
    1    H    ALA 103           H        ALA 103  16.650  21.075  16.499
    2    HA   ALA 103           HA       ALA 103  18.366  19.861  18.162
    3    HB2  ALA 103           HB1      ALA 103  16.774  17.860  18.156
    4    HB1  ALA 103           HB2      ALA 103  15.886  18.714  16.894
    5    HB3  ALA 103           HB3      ALA 103  16.062  19.438  18.491

  No H/Q in entry =           5
  In of MODEL   72
    1    H1   ALA   1           H3       ALA   1  -1.539  -7.010 -21.458
    2    H2   ALA   1           H2       ALA   1  -2.341  -8.441 -21.004
    3    H3   ALA   1           H1       ALA   1  -0.732  -8.499 -21.554
    4    HA   ALA   1           HA       ALA   1  -1.561  -8.970 -23.552
    5    HB1  ALA   1           HB1      ALA   1  -3.703  -9.677 -23.084
    6    HB2  ALA   1           HB2      ALA   1  -4.132  -8.166 -23.887
    7    HB3  ALA   1           HB3      ALA   1  -4.078  -8.242 -22.128

  No H/Q in entry =           7
  In of MODEL   72
    1    H    GLU   2           H        GLU   2  -2.378  -7.780 -25.547
    2    HA   GLU   2           HA       GLU   2  -0.967  -5.775 -26.424
    3    HB2  GLU   2           HB2      GLU   2  -3.973  -5.829 -26.753
    4    HB3  GLU   2           HB3      GLU   2  -2.845  -4.974 -27.800
    5    HG2  GLU   2           HG2      GLU   2  -2.346  -6.869 -28.949
    6    HG3  GLU   2           HG3      GLU   2  -2.058  -7.772 -27.468

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLU   3           H        GLU   3  -4.125  -4.501 -25.539
    2    HA   GLU   3           HA       GLU   3  -3.069  -1.948 -24.913
    3    HB2  GLU   3           HB2      GLU   3  -5.764  -3.250 -24.587
    4    HB3  GLU   3           HB3      GLU   3  -5.461  -1.635 -23.944
    5    HG2  GLU   3           HG2      GLU   3  -5.092  -0.714 -26.070
    6    HG3  GLU   3           HG3      GLU   3  -4.702  -2.273 -26.790

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LEU   4           H        LEU   4  -4.678  -4.295 -22.733
    2    HA   LEU   4           HA       LEU   4  -4.317  -3.063 -20.344
    3    HB2  LEU   4           HB2      LEU   4  -3.786  -6.008 -20.804
    4    HB3  LEU   4           HB3      LEU   4  -4.194  -5.256 -19.264
    5    HG   LEU   4           HG       LEU   4  -5.958  -5.327 -21.734
    6   HD13  LEU   4          HD11      LEU   4  -7.163  -7.037 -20.737
    7   HD12  LEU   4          HD12      LEU   4  -6.682  -6.575 -19.105
    8   HD11  LEU   4          HD13      LEU   4  -5.546  -7.426 -20.150
    9   HD23  LEU   4          HD21      LEU   4  -7.645  -4.503 -19.874
   10   HD22  LEU   4          HD22      LEU   4  -6.598  -3.339 -20.684
   11   HD21  LEU   4          HD23      LEU   4  -6.181  -3.928 -19.075

  No H/Q in entry =          11
  In of MODEL   72
    1    H    GLU   5           H        GLU   5  -1.821  -4.922 -22.061
    2    HA   GLU   5           HA       GLU   5   0.156  -4.642 -20.018
    3    HB2  GLU   5           HB2      GLU   5   0.224  -6.418 -21.760
    4    HB3  GLU   5           HB3      GLU   5   0.538  -5.180 -22.977
    5    HG2  GLU   5           HG2      GLU   5   2.603  -4.536 -21.817
    6    HG3  GLU   5           HG3      GLU   5   2.288  -5.733 -20.562

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLU   6           H        GLU   6  -0.459  -2.933 -23.069
    2    HA   GLU   6           HA       GLU   6   1.718  -1.111 -22.797
    3    HB2  GLU   6           HB2      GLU   6  -0.835  -1.014 -24.417
    4    HB3  GLU   6           HB3      GLU   6   0.426   0.215 -24.517
    5    HG2  GLU   6           HG2      GLU   6   2.058  -1.458 -25.208
    6    HG3  GLU   6           HG3      GLU   6   0.871  -2.742 -25.003

  No H/Q in entry =           6
  In of MODEL   72
    1    H    VAL   7           H        VAL   7  -1.624  -1.164 -21.764
    2    HA   VAL   7           HA       VAL   7  -1.836   1.551 -20.935
    3    HB   VAL   7           HB       VAL   7  -3.313  -0.957 -20.098
    4   HG11  VAL   7          HG11      VAL   7  -3.677   1.935 -19.292
    5   HG13  VAL   7          HG12      VAL   7  -3.589   0.512 -18.253
    6   HG12  VAL   7          HG13      VAL   7  -5.016   0.786 -19.251
    7   HG21  VAL   7          HG21      VAL   7  -3.456   0.114 -22.489
    8   HG23  VAL   7          HG22      VAL   7  -4.399   1.369 -21.684
    9   HG22  VAL   7          HG23      VAL   7  -4.952  -0.305 -21.655

  No H/Q in entry =           9
  In of MODEL   72
    1    H    VAL   8           H        VAL   8  -0.869  -1.435 -19.281
    2    HA   VAL   8           HA       VAL   8  -0.555  -0.350 -16.687
    3    HB   VAL   8           HB       VAL   8   0.837  -2.678 -18.035
    4   HG13  VAL   8          HG11      VAL   8   2.284  -2.174 -16.267
    5   HG12  VAL   8          HG12      VAL   8   1.159  -3.298 -15.504
    6   HG11  VAL   8          HG13      VAL   8   0.983  -1.563 -15.245
    7   HG21  VAL   8          HG21      VAL   8  -1.818  -2.438 -17.316
    8   HG23  VAL   8          HG22      VAL   8  -1.118  -3.095 -15.841
    9   HG22  VAL   8          HG23      VAL   8  -0.950  -3.971 -17.357

  No H/Q in entry =           9
  In of MODEL   72
    1    H    MET   9           H        MET   9   1.703  -0.669 -19.425
    2    HA   MET   9           HA       MET   9   3.989   0.366 -18.158
    3    HB2  MET   9           HB2      MET   9   3.053   0.406 -21.027
    4    HB3  MET   9           HB3      MET   9   4.580   1.142 -20.539
    5    HG2  MET   9           HG2      MET   9   5.324  -1.005 -19.589
    6    HG3  MET   9           HG3      MET   9   3.791  -1.746 -20.052
    7    HE1  MET   9           HE1      MET   9   6.637   0.300 -20.973
    8    HE3  MET   9           HE2      MET   9   6.951   0.114 -22.697
    9    HE2  MET   9           HE3      MET   9   7.531  -1.105 -21.565

  No H/Q in entry =           9
  In of MODEL   72
    1    H    GLY  10           H        GLY  10   1.320   1.978 -19.849
    2    HA3  GLY  10           HA2      GLY  10   2.297   4.627 -19.607
    3    HA2  GLY  10           HA3      GLY  10   0.605   4.176 -19.816

  No H/Q in entry =           3
  In of MODEL   72
    1    H    LEU  11           H        LEU  11   0.190   2.656 -17.528
    2    HA   LEU  11           HA       LEU  11  -0.336   4.640 -15.575
    3    HB2  LEU  11           HB2      LEU  11  -0.286   1.624 -15.412
    4    HB3  LEU  11           HB3      LEU  11  -0.794   2.653 -14.073
    5    HG   LEU  11           HG       LEU  11  -2.023   2.768 -16.841
    6   HD13  LEU  11          HD11      LEU  11  -2.621   0.630 -16.083
    7   HD12  LEU  11          HD12      LEU  11  -3.968   1.631 -15.544
    8   HD11  LEU  11          HD13      LEU  11  -2.718   1.146 -14.399
    9   HD22  LEU  11          HD21      LEU  11  -2.605   4.790 -15.841
   10   HD21  LEU  11          HD22      LEU  11  -2.539   4.126 -14.208
   11   HD23  LEU  11          HD23      LEU  11  -3.913   3.766 -15.254

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  12           H        ILE  12   2.193   2.158 -15.804
    2    HA   ILE  12           HA       ILE  12   3.394   2.694 -13.298
    3    HB   ILE  12           HB       ILE  12   4.646   1.639 -15.855
    4   HG12  ILE  12          HG12      ILE  12   2.628   0.422 -14.705
    5   HG13  ILE  12          HG13      ILE  12   4.024  -0.523 -15.185
    6   HG22  ILE  12          HG21      ILE  12   6.321   0.617 -14.271
    7   HG21  ILE  12          HG22      ILE  12   5.622   1.593 -12.980
    8   HG23  ILE  12          HG23      ILE  12   6.398   2.375 -14.356
    9   HD13  ILE  12          HD11      ILE  12   4.848  -0.504 -12.900
   10   HD12  ILE  12          HD12      ILE  12   3.174  -1.057 -12.899
   11   HD11  ILE  12          HD13      ILE  12   3.555   0.579 -12.412

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  13           H        ILE  13   4.013   3.947 -16.555
    2    HA   ILE  13           HA       ILE  13   6.159   5.655 -15.828
    3    HB   ILE  13           HB       ILE  13   4.136   5.739 -18.080
    4   HG12  ILE  13          HG12      ILE  13   5.969   3.896 -17.791
    5   HG13  ILE  13          HG13      ILE  13   5.731   4.635 -19.371
    6   HG22  ILE  13          HG21      ILE  13   6.022   7.278 -19.106
    7   HG21  ILE  13          HG22      ILE  13   6.380   7.634 -17.421
    8   HG23  ILE  13          HG23      ILE  13   4.779   7.983 -18.070
    9   HD13  ILE  13          HD11      ILE  13   7.651   6.106 -19.032
   10   HD12  ILE  13          HD12      ILE  13   8.144   4.451 -18.688
   11   HD11  ILE  13          HD13      ILE  13   7.808   5.558 -17.363

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ASN  14           H        ASN  14   2.656   6.171 -16.107
    2    HA   ASN  14           HA       ASN  14   2.628   8.918 -15.476
    3    HB2  ASN  14           HB2      ASN  14   0.727   7.286 -16.309
    4    HB3  ASN  14           HB3      ASN  14   0.400   7.113 -14.589
    5   HD21  ASN  14          HD21      ASN  14  -1.608   8.279 -16.030
    6   HD22  ASN  14          HD22      ASN  14  -1.662   9.953 -15.766

  No H/Q in entry =           6
  In of MODEL   72
    1    H    SER  15           H        SER  15   2.310   6.048 -13.394
    2    HA   SER  15           HA       SER  15   2.004   7.425 -10.950
    3    HB2  SER  15           HB2      SER  15   2.540   5.339  -9.894
    4    HB3  SER  15           HB3      SER  15   1.709   4.921 -11.388
    5    HG   SER  15           HG       SER  15   4.253   4.399 -10.614

  No H/Q in entry =           5
  In of MODEL   72
    1    H    GLY  16           H        GLY  16   4.878   6.308 -12.698
    2    HA3  GLY  16           HA2      GLY  16   6.802   7.058 -10.763
    3    HA2  GLY  16           HA3      GLY  16   7.109   6.850 -12.486

  No H/Q in entry =           3
  In of MODEL   72
    1    H    GLN  17           H        GLN  17   5.434   8.815 -13.558
    2    HA   GLN  17           HA       GLN  17   7.022  11.148 -13.250
    3    HB2  GLN  17           HB2      GLN  17   5.690  10.654 -15.291
    4    HB3  GLN  17           HB3      GLN  17   4.211  10.921 -14.368
    5    HG2  GLN  17           HG2      GLN  17   4.766  12.956 -15.587
    6    HG3  GLN  17           HG3      GLN  17   4.986  13.236 -13.861
    7   HE21  GLN  17          HE21      GLN  17   6.628  13.106 -16.944
    8   HE22  GLN  17          HE22      GLN  17   8.174  13.485 -16.354

  No H/Q in entry =           8
  In of MODEL   72
    1    H    ALA  18           H        ALA  18   3.913  10.149 -11.908
    2    HA   ALA  18           HA       ALA  18   3.196  12.544 -10.649
    3    HB1  ALA  18           HB1      ALA  18   2.055  10.093 -10.869
    4    HB2  ALA  18           HB2      ALA  18   1.509  11.318  -9.727
    5    HB3  ALA  18           HB3      ALA  18   2.592  10.032  -9.191

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ARG  19           H        ARG  19   5.053   9.775  -9.359
    2    HA   ARG  19           HA       ARG  19   5.583  10.936  -6.838
    3    HB2  ARG  19           HB2      ARG  19   5.988   8.530  -7.358
    4    HB3  ARG  19           HB3      ARG  19   7.349   9.008  -8.376
    5    HG2  ARG  19           HG2      ARG  19   8.468  10.047  -6.453
    6    HG3  ARG  19           HG3      ARG  19   7.087   9.667  -5.424
    7    HD2  ARG  19           HD2      ARG  19   8.841   8.025  -5.058
    8    HD3  ARG  19           HD3      ARG  19   7.465   7.247  -5.846
    9    HE   ARG  19           HE       ARG  19   9.179   8.054  -7.890
   10   HH21  ARG  19          HH11      ARG  19  10.736   6.640  -8.733
   11   HH22  ARG  19          HH12      ARG  19  11.273   5.291  -7.792
   12   HH11  ARG  19          HH21      ARG  19   9.234   6.029  -5.107
   13   HH12  ARG  19          HH22      ARG  19  10.419   4.945  -5.738

  No H/Q in entry =          13
  In of MODEL   72
    1    H    SER  20           H        SER  20   7.410  10.951  -9.881
    2    HA   SER  20           HA       SER  20   9.658  12.359  -9.054
    3    HB2  SER  20           HB2      SER  20   9.435  11.364 -11.300
    4    HB3  SER  20           HB3      SER  20   8.236  12.584 -11.716
    5    HG   SER  20           HG       SER  20  10.935  13.040 -10.954

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LEU  21           H        LEU  21   6.568  13.638 -10.263
    2    HA   LEU  21           HA       LEU  21   7.248  16.381 -10.043
    3    HB2  LEU  21           HB2      LEU  21   4.573  14.971  -9.963
    4    HB3  LEU  21           HB3      LEU  21   4.750  16.724  -9.979
    5    HG   LEU  21           HG       LEU  21   5.940  14.907 -12.095
    6   HD11  LEU  21          HD11      LEU  21   3.296  16.381 -12.005
    7   HD13  LEU  21          HD12      LEU  21   3.560  14.655 -12.253
    8   HD12  LEU  21          HD13      LEU  21   4.026  15.805 -13.504
    9   HD22  LEU  21          HD21      LEU  21   7.097  16.924 -12.306
   10   HD21  LEU  21          HD22      LEU  21   5.758  17.891 -11.694
   11   HD23  LEU  21          HD23      LEU  21   5.707  17.264 -13.333

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ALA  22           H        ALA  22   5.721  14.102  -7.794
    2    HA   ALA  22           HA       ALA  22   5.118  15.917  -5.733
    3    HB3  ALA  22           HB1      ALA  22   4.350  13.527  -5.893
    4    HB2  ALA  22           HB2      ALA  22   4.935  14.000  -4.297
    5    HB1  ALA  22           HB3      ALA  22   5.958  13.036  -5.363

  No H/Q in entry =           5
  In of MODEL   72
    1    H    TYR  23           H        TYR  23   8.047  13.881  -6.158
    2    HA   TYR  23           HA       TYR  23   9.426  14.901  -3.904
    3    HB2  TYR  23           HB2      TYR  23  10.210  12.888  -5.055
    4    HB3  TYR  23           HB3      TYR  23  10.532  13.823  -6.515
    5    HD1  TYR  23           HD1      TYR  23  11.493  13.461  -2.929
    6    HD2  TYR  23           HD2      TYR  23  12.560  15.016  -6.789
    7    HE1  TYR  23           HE1      TYR  23  13.750  14.032  -2.075
    8    HE2  TYR  23           HE2      TYR  23  14.817  15.589  -5.934
    9    HH   TYR  23           HH       TYR  23  15.850  14.634  -2.692

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ALA  24           H        ALA  24   9.257  16.001  -7.273
    2    HA   ALA  24           HA       ALA  24  11.157  18.081  -7.026
    3    HB2  ALA  24           HB1      ALA  24  10.721  18.140  -9.236
    4    HB3  ALA  24           HB2      ALA  24   9.167  18.894  -8.883
    5    HB1  ALA  24           HB3      ALA  24   9.288  17.140  -9.009

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ALA  25           H        ALA  25   7.676  17.907  -6.415
    2    HA   ALA  25           HA       ALA  25   7.200  20.627  -5.853
    3    HB1  ALA  25           HB1      ALA  25   5.535  18.632  -6.054
    4    HB2  ALA  25           HB2      ALA  25   5.167  19.924  -4.910
    5    HB3  ALA  25           HB3      ALA  25   5.852  18.403  -4.334

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LEU  26           H        LEU  26   8.257  17.950  -3.794
    2    HA   LEU  26           HA       LEU  26   8.358  19.387  -1.360
    3    HB2  LEU  26           HB2      LEU  26   8.449  16.970  -1.348
    4    HB3  LEU  26           HB3      LEU  26   9.922  16.973  -2.315
    5    HG   LEU  26           HG       LEU  26  11.133  18.093  -0.474
    6   HD12  LEU  26          HD11      LEU  26   9.900  18.108   1.782
    7   HD11  LEU  26          HD12      LEU  26   8.415  17.971   0.844
    8   HD13  LEU  26          HD13      LEU  26   9.463  19.375   0.635
    9   HD21  LEU  26          HD21      LEU  26   9.593  15.630   0.401
   10   HD23  LEU  26          HD22      LEU  26  11.107  16.192   1.101
   11   HD22  LEU  26          HD23      LEU  26  11.066  15.629  -0.568

  No H/Q in entry =          11
  In of MODEL   72
    1    H    LYS  27           H        LYS  27  10.781  18.804  -3.876
    2    HA   LYS  27           HA       LYS  27  12.963  20.045  -2.645
    3    HB2  LYS  27           HB2      LYS  27  13.069  18.693  -4.731
    4    HB3  LYS  27           HB3      LYS  27  12.308  20.024  -5.602
    5    HG2  LYS  27           HG2      LYS  27  14.174  21.508  -5.023
    6    HG3  LYS  27           HG3      LYS  27  14.930  20.217  -4.081
    7    HD2  LYS  27           HD2      LYS  27  15.077  18.825  -6.131
    8    HD3  LYS  27           HD3      LYS  27  14.366  20.141  -7.065
    9    HE2  LYS  27           HE2      LYS  27  16.254  21.607  -6.450
   10    HE3  LYS  27           HE3      LYS  27  16.968  20.294  -5.507
   11    HZ3  LYS  27           HZ1      LYS  27  17.965  20.387  -7.691
   12    HZ2  LYS  27           HZ2      LYS  27  16.440  20.269  -8.436
   13    HZ1  LYS  27           HZ3      LYS  27  17.059  18.960  -7.547

  No H/Q in entry =          13
  In of MODEL   72
    1    H    GLN  28           H        GLN  28  10.348  21.425  -4.605
    2    HA   GLN  28           HA       GLN  28  11.310  24.076  -4.762
    3    HB2  GLN  28           HB2      GLN  28   8.480  22.997  -4.665
    4    HB3  GLN  28           HB3      GLN  28   8.882  24.677  -5.020
    5    HG2  GLN  28           HG2      GLN  28  10.225  23.961  -6.951
    6    HG3  GLN  28           HG3      GLN  28   9.868  22.274  -6.588
    7   HE21  GLN  28          HE21      GLN  28   9.124  23.621  -9.079
    8   HE22  GLN  28          HE22      GLN  28   7.428  23.621  -9.153

  No H/Q in entry =           8
  In of MODEL   72
    1    H    ALA  29           H        ALA  29   9.370  22.391  -2.326
    2    HA   ALA  29           HA       ALA  29   8.817  24.588  -0.652
    3    HB2  ALA  29           HB1      ALA  29   8.083  23.024   0.918
    4    HB1  ALA  29           HB2      ALA  29   9.305  21.838   0.460
    5    HB3  ALA  29           HB3      ALA  29   7.922  22.130  -0.593

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LYS  30           H        LYS  30  11.546  22.319  -0.708
    2    HA   LYS  30           HA       LYS  30  12.858  23.278   1.596
    3    HB2  LYS  30           HB2      LYS  30  13.961  21.985  -0.908
    4    HB3  LYS  30           HB3      LYS  30  14.940  22.347   0.516
    5    HG2  LYS  30           HG2      LYS  30  13.382  20.968   1.894
    6    HG3  LYS  30           HG3      LYS  30  12.501  20.544   0.423
    7    HD2  LYS  30           HD2      LYS  30  14.547  19.554  -0.530
    8    HD3  LYS  30           HD3      LYS  30  15.448  19.993   0.924
    9    HE2  LYS  30           HE2      LYS  30  13.939  18.565   2.277
   10    HE3  LYS  30           HE3      LYS  30  13.068  18.107   0.808
   11    HZ2  LYS  30           HZ1      LYS  30  14.857  16.529   1.578
   12    HZ1  LYS  30           HZ2      LYS  30  15.996  17.715   1.127
   13    HZ3  LYS  30           HZ3      LYS  30  14.963  17.029  -0.039

  No H/Q in entry =          13
  In of MODEL   72
    1    H    GLN  31           H        GLN  31  12.759  24.474  -1.704
    2    HA   GLN  31           HA       GLN  31  14.912  26.368  -1.281
    3    HB2  GLN  31           HB2      GLN  31  12.875  26.410  -3.511
    4    HB3  GLN  31           HB3      GLN  31  14.495  27.105  -3.510
    5    HG2  GLN  31           HG2      GLN  31  14.954  24.410  -2.926
    6    HG3  GLN  31           HG3      GLN  31  13.654  24.354  -4.108
    7   HE21  GLN  31          HE21      GLN  31  16.498  23.558  -4.502
    8   HE22  GLN  31          HE22      GLN  31  17.074  24.528  -5.770

  No H/Q in entry =           8
  In of MODEL   72
    1    H    GLY  32           H        GLY  32  11.834  26.190  -0.144
    2    HA3  GLY  32           HA2      GLY  32  10.675  27.762   1.122
    3    HA2  GLY  32           HA3      GLY  32  11.802  28.995   0.572

  No H/Q in entry =           3
  In of MODEL   72
    1    H    ASP  33           H        ASP  33  10.444  27.085  -1.919
    2    HA   ASP  33           HA       ASP  33   8.783  29.357  -2.785
    3    HB2  ASP  33           HB2      ASP  33   9.879  26.933  -4.218
    4    HB3  ASP  33           HB3      ASP  33   8.730  28.048  -4.954

  No H/Q in entry =           4
  In of MODEL   72
    1    H    PHE  34           H        PHE  34   7.090  28.886  -1.224
    2    HA   PHE  34           HA       PHE  34   5.709  26.414  -1.126
    3    HB2  PHE  34           HB2      PHE  34   4.748  29.204  -0.456
    4    HB3  PHE  34           HB3      PHE  34   3.897  27.714  -0.043
    5    HD1  PHE  34           HD1      PHE  34   6.145  30.115   1.171
    6    HD2  PHE  34           HD2      PHE  34   5.463  25.874   1.126
    7    HE1  PHE  34           HE1      PHE  34   7.530  29.869   3.212
    8    HE2  PHE  34           HE2      PHE  34   6.850  25.632   3.165
    9    HZ   PHE  34           HZ       PHE  34   7.878  27.631   4.208

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ALA  35           H        ALA  35   5.285  29.273  -3.145
    2    HA   ALA  35           HA       ALA  35   2.737  28.657  -4.176
    3    HB3  ALA  35           HB1      ALA  35   3.795  30.044  -6.214
    4    HB2  ALA  35           HB2      ALA  35   5.009  30.408  -4.988
    5    HB1  ALA  35           HB3      ALA  35   3.318  30.818  -4.703

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ALA  36           H        ALA  36   5.969  27.980  -5.520
    2    HA   ALA  36           HA       ALA  36   4.985  26.545  -7.762
    3    HB3  ALA  36           HB1      ALA  36   7.146  26.667  -8.373
    4    HB2  ALA  36           HB2      ALA  36   7.623  25.642  -7.018
    5    HB1  ALA  36           HB3      ALA  36   7.518  27.390  -6.808

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ALA  37           H        ALA  37   5.932  25.559  -4.503
    2    HA   ALA  37           HA       ALA  37   5.874  22.769  -4.925
    3    HB2  ALA  37           HB1      ALA  37   5.607  24.566  -2.552
    4    HB1  ALA  37           HB2      ALA  37   6.741  23.248  -2.838
    5    HB3  ALA  37           HB3      ALA  37   5.078  22.896  -2.370

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LYS  38           H        LYS  38   3.338  24.981  -3.769
    2    HA   LYS  38           HA       LYS  38   1.238  23.169  -3.548
    3    HB2  LYS  38           HB2      LYS  38   1.590  25.926  -3.302
    4    HB3  LYS  38           HB3      LYS  38   0.394  25.776  -4.584
    5    HG2  LYS  38           HG2      LYS  38  -1.060  24.456  -3.142
    6    HG3  LYS  38           HG3      LYS  38   0.181  24.399  -1.882
    7    HD2  LYS  38           HD2      LYS  38  -0.006  26.737  -1.441
    8    HD3  LYS  38           HD3      LYS  38  -0.914  27.022  -2.927
    9    HE2  LYS  38           HE2      LYS  38  -2.422  27.061  -0.991
   10    HE3  LYS  38           HE3      LYS  38  -2.794  25.683  -2.031
   11    HZ3  LYS  38           HZ1      LYS  38  -2.073  24.215  -0.493
   12    HZ2  LYS  38           HZ2      LYS  38  -2.426  25.475   0.593
   13    HZ1  LYS  38           HZ3      LYS  38  -0.830  25.223   0.072

  No H/Q in entry =          13
  In of MODEL   72
    1    H    ALA  39           H        ALA  39   2.226  25.064  -6.398
    2    HA   ALA  39           HA       ALA  39   0.154  24.193  -8.105
    3    HB2  ALA  39           HB1      ALA  39   2.894  24.838  -9.153
    4    HB1  ALA  39           HB2      ALA  39   1.925  26.101  -8.393
    5    HB3  ALA  39           HB3      ALA  39   1.316  25.261  -9.819

  No H/Q in entry =           5
  In of MODEL   72
    1    H    MET  40           H        MET  40   3.391  22.895  -7.513
    2    HA   MET  40           HA       MET  40   3.298  20.870  -9.500
    3    HB2  MET  40           HB2      MET  40   4.903  21.100  -6.948
    4    HB3  MET  40           HB3      MET  40   5.156  19.840  -8.158
    5    HG2  MET  40           HG2      MET  40   5.216  22.795  -8.831
    6    HG3  MET  40           HG3      MET  40   6.661  21.893  -8.375
    7    HE3  MET  40           HE1      MET  40   7.541  19.671 -11.176
    8    HE2  MET  40           HE2      MET  40   6.973  19.356  -9.539
    9    HE1  MET  40           HE3      MET  40   8.069  20.702  -9.839

  No H/Q in entry =           9
  In of MODEL   72
    1    H    MET  41           H        MET  41   2.374  20.921  -6.079
    2    HA   MET  41           HA       MET  41   1.840  18.157  -5.795
    3    HB2  MET  41           HB2      MET  41   0.504  20.518  -4.454
    4    HB3  MET  41           HB3      MET  41   0.347  18.841  -3.942
    5    HG2  MET  41           HG2      MET  41   3.058  19.064  -3.972
    6    HG3  MET  41           HG3      MET  41   2.616  20.723  -3.582
    7    HE2  MET  41           HE1      MET  41  -0.428  19.475  -1.862
    8    HE1  MET  41           HE2      MET  41   0.389  20.987  -2.241
    9    HE3  MET  41           HE3      MET  41   0.326  20.420  -0.571

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ASP  42           H        ASP  42  -0.195  20.879  -6.781
    2    HA   ASP  42           HA       ASP  42  -2.636  19.517  -6.921
    3    HB2  ASP  42           HB2      ASP  42  -1.929  22.087  -7.182
    4    HB3  ASP  42           HB3      ASP  42  -2.075  21.688  -8.890

  No H/Q in entry =           4
  In of MODEL   72
    1    H    GLN  43           H        GLN  43  -0.188  20.102  -9.418
    2    HA   GLN  43           HA       GLN  43  -1.569  18.777 -11.508
    3    HB2  GLN  43           HB2      GLN  43   1.388  19.295 -11.119
    4    HB3  GLN  43           HB3      GLN  43   0.678  18.652 -12.602
    5    HG2  GLN  43           HG2      GLN  43  -0.834  20.678 -12.653
    6    HG3  GLN  43           HG3      GLN  43   0.115  21.338 -11.324
    7   HE21  GLN  43          HE21      GLN  43   0.282  22.953 -13.414
    8   HE22  GLN  43          HE22      GLN  43   1.699  22.730 -14.317

  No H/Q in entry =           8
  In of MODEL   72
    1    H    SER  44           H        SER  44   0.775  17.644  -9.108
    2    HA   SER  44           HA       SER  44   1.114  15.035 -10.126
    3    HB2  SER  44           HB2      SER  44   2.002  16.480  -7.891
    4    HB3  SER  44           HB3      SER  44   1.139  15.098  -7.219
    5    HG   SER  44           HG       SER  44   3.251  14.478  -7.638

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ARG  45           H        ARG  45  -1.213  16.358  -7.798
    2    HA   ARG  45           HA       ARG  45  -2.600  13.998  -7.160
    3    HB2  ARG  45           HB2      ARG  45  -2.803  16.169  -5.975
    4    HB3  ARG  45           HB3      ARG  45  -3.655  16.832  -7.366
    5    HG2  ARG  45           HG2      ARG  45  -5.421  15.106  -7.083
    6    HG3  ARG  45           HG3      ARG  45  -4.580  14.498  -5.656
    7    HD2  ARG  45           HD2      ARG  45  -4.791  16.767  -4.606
    8    HD3  ARG  45           HD3      ARG  45  -5.775  17.283  -5.993
    9    HE   ARG  45           HE       ARG  45  -6.886  14.908  -4.950
   10   HH21  ARG  45          HH11      ARG  45  -8.725  14.986  -3.684
   11   HH22  ARG  45          HH12      ARG  45  -9.124  16.427  -2.820
   12   HH11  ARG  45          HH21      ARG  45  -6.345  18.158  -3.932
   13   HH12  ARG  45          HH22      ARG  45  -7.771  18.224  -2.959

  No H/Q in entry =          13
  In of MODEL   72
    1    H    MET  46           H        MET  46  -3.179  16.396  -9.719
    2    HA   MET  46           HA       MET  46  -5.514  15.218 -10.784
    3    HB2  MET  46           HB2      MET  46  -3.412  17.047 -11.954
    4    HB3  MET  46           HB3      MET  46  -4.785  16.483 -12.909
    5    HG2  MET  46           HG2      MET  46  -6.345  17.419 -11.276
    6    HG3  MET  46           HG3      MET  46  -5.009  17.912 -10.243
    7    HE1  MET  46           HE1      MET  46  -6.882  18.150 -13.417
    8    HE3  MET  46           HE2      MET  46  -5.380  18.257 -14.329
    9    HE2  MET  46           HE3      MET  46  -6.429  19.668 -14.205

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ALA  47           H        ALA  47  -2.083  14.741 -11.531
    2    HA   ALA  47           HA       ALA  47  -2.420  13.007 -13.738
    3    HB3  ALA  47           HB1      ALA  47  -0.244  13.900 -13.382
    4    HB2  ALA  47           HB2      ALA  47  -0.102  12.173 -13.044
    5    HB1  ALA  47           HB3      ALA  47  -0.200  13.328 -11.714

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LEU  48           H        LEU  48  -2.159  12.381 -10.262
    2    HA   LEU  48           HA       LEU  48  -2.250   9.540 -10.413
    3    HB2  LEU  48           HB2      LEU  48  -3.022  11.463  -8.207
    4    HB3  LEU  48           HB3      LEU  48  -2.927   9.713  -8.001
    5    HG   LEU  48           HG       LEU  48  -0.627  11.413  -8.996
    6   HD13  LEU  48          HD11      LEU  48  -0.917  12.188  -6.808
    7   HD12  LEU  48          HD12      LEU  48   0.247  10.882  -6.603
    8   HD11  LEU  48          HD13      LEU  48  -1.452  10.619  -6.210
    9   HD22  LEU  48          HD21      LEU  48  -0.124   9.226  -9.630
   10   HD21  LEU  48          HD22      LEU  48  -0.997   8.513  -8.275
   11   HD23  LEU  48          HD23      LEU  48   0.574   9.269  -8.012

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ASN  49           H        ASN  49  -4.717  12.030 -10.025
    2    HA   ASN  49           HA       ASN  49  -6.902  10.365  -9.488
    3    HB2  ASN  49           HB2      ASN  49  -6.949  12.795  -9.176
    4    HB3  ASN  49           HB3      ASN  49  -6.810  13.040 -10.913
    5   HD21  ASN  49          HD21      ASN  49  -8.859  14.052 -11.200
    6   HD22  ASN  49          HD22      ASN  49 -10.326  13.242 -10.944

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLU  50           H        GLU  50  -5.616  11.555 -12.574
    2    HA   GLU  50           HA       GLU  50  -7.563  10.293 -14.223
    3    HB2  GLU  50           HB2      GLU  50  -6.097  12.112 -15.037
    4    HB3  GLU  50           HB3      GLU  50  -4.703  11.042 -14.892
    5    HG2  GLU  50           HG2      GLU  50  -5.669   9.501 -16.528
    6    HG3  GLU  50           HG3      GLU  50  -7.131  10.477 -16.622

  No H/Q in entry =           6
  In of MODEL   72
    1    H    ALA  51           H        ALA  51  -4.395   9.308 -13.005
    2    HA   ALA  51           HA       ALA  51  -4.248   6.851 -14.416
    3    HB2  ALA  51           HB1      ALA  51  -2.271   6.569 -13.310
    4    HB1  ALA  51           HB2      ALA  51  -2.964   6.994 -11.745
    5    HB3  ALA  51           HB3      ALA  51  -2.506   8.263 -12.881

  No H/Q in entry =           5
  In of MODEL   72
    1    H    HIS  52           H        HIS  52  -5.432   7.690 -11.173
    2    HA   HIS  52           HA       HIS  52  -6.117   5.081 -10.337
    3    HB2  HIS  52           HB2      HIS  52  -5.984   7.073  -8.846
    4    HB3  HIS  52           HB3      HIS  52  -7.467   7.682  -9.581
    5    HD1  HIS  52           HD1      HIS  52  -9.675   6.376  -9.087
    6    HD2  HIS  52           HD2      HIS  52  -6.346   4.902  -7.059
    7    HE1  HIS  52           HE1      HIS  52 -10.558   4.804  -7.309
    8    HE2  HIS  52           HE2      HIS  52  -8.540   3.896  -6.063

  No H/Q in entry =           8
  In of MODEL   72
    1    H    LEU  53           H        LEU  53  -7.934   7.533 -12.137
    2    HA   LEU  53           HA       LEU  53 -10.438   6.239 -12.154
    3    HB2  LEU  53           HB2      LEU  53  -9.150   8.216 -14.025
    4    HB3  LEU  53           HB3      LEU  53 -10.748   7.548 -14.350
    5    HG   LEU  53           HG       LEU  53 -10.036   8.880 -11.716
    6   HD12  LEU  53          HD11      LEU  53 -11.366  10.822 -12.681
    7   HD11  LEU  53          HD12      LEU  53 -11.198  10.045 -14.256
    8   HD13  LEU  53          HD13      LEU  53  -9.768  10.586 -13.380
    9   HD22  LEU  53          HD21      LEU  53 -12.029   7.679 -11.367
   10   HD21  LEU  53          HD22      LEU  53 -12.565   7.908 -13.028
   11   HD23  LEU  53          HD23      LEU  53 -12.656   9.236 -11.889

  No H/Q in entry =          11
  In of MODEL   72
    1    H    VAL  54           H        VAL  54  -7.681   6.038 -14.382
    2    HA   VAL  54           HA       VAL  54  -8.896   4.262 -16.225
    3    HB   VAL  54           HB       VAL  54  -5.991   4.772 -15.534
    4   HG12  VAL  54          HG11      VAL  54  -5.736   3.681 -17.919
    5   HG11  VAL  54          HG12      VAL  54  -7.265   2.900 -17.519
    6   HG13  VAL  54          HG13      VAL  54  -5.853   2.649 -16.495
    7   HG22  VAL  54          HG21      VAL  54  -6.759   6.712 -16.586
    8   HG21  VAL  54          HG22      VAL  54  -7.948   5.845 -17.556
    9   HG23  VAL  54          HG23      VAL  54  -6.240   5.765 -17.981

  No H/Q in entry =           9
  In of MODEL   72
    1    H    GLN  55           H        GLN  55  -6.907   3.724 -13.317
    2    HA   GLN  55           HA       GLN  55  -6.815   0.906 -13.566
    3    HB2  GLN  55           HB2      GLN  55  -5.264   1.807 -12.044
    4    HB3  GLN  55           HB3      GLN  55  -6.484   2.775 -11.221
    5    HG2  GLN  55           HG2      GLN  55  -7.176   1.021  -9.901
    6    HG3  GLN  55           HG3      GLN  55  -6.947  -0.169 -11.175
    7   HE21  GLN  55          HE21      GLN  55  -5.324  -1.617 -10.672
    8   HE22  GLN  55          HE22      GLN  55  -3.943  -1.263  -9.756

  No H/Q in entry =           8
  In of MODEL   72
    1    H    THR  56           H        THR  56  -9.152   3.072 -11.965
    2    HA   THR  56           HA       THR  56 -10.740   1.192 -10.676
    3    HB   THR  56           HB       THR  56 -11.826   3.578 -12.191
    4    HG1  THR  56           HG1      THR  56  -9.924   3.782 -10.622
    5   HG21  THR  56          HG21      THR  56 -12.717   2.075  -9.719
    6   HG23  THR  56          HG22      THR  56 -13.547   2.136 -11.275
    7   HG22  THR  56          HG23      THR  56 -13.438   3.584 -10.274

  No H/Q in entry =           7
  In of MODEL   72
    1    H    LYS  57           H        LYS  57 -10.931   2.266 -14.065
    2    HA   LYS  57           HA       LYS  57 -13.084   0.576 -14.821
    3    HB2  LYS  57           HB2      LYS  57 -12.189   2.529 -16.136
    4    HB3  LYS  57           HB3      LYS  57 -10.764   1.570 -16.510
    5    HG2  LYS  57           HG2      LYS  57 -12.138  -0.083 -17.673
    6    HG3  LYS  57           HG3      LYS  57 -13.602   0.794 -17.242
    7    HD2  LYS  57           HD2      LYS  57 -12.817   2.747 -18.543
    8    HD3  LYS  57           HD3      LYS  57 -11.359   1.863 -18.989
    9    HE2  LYS  57           HE2      LYS  57 -12.730   0.148 -20.122
   10    HE3  LYS  57           HE3      LYS  57 -14.202   1.009 -19.672
   11    HZ3  LYS  57           HZ1      LYS  57 -13.954   2.096 -21.571
   12    HZ2  LYS  57           HZ2      LYS  57 -12.369   1.530 -21.798
   13    HZ1  LYS  57           HZ3      LYS  57 -12.653   2.911 -20.851

  No H/Q in entry =          13
  In of MODEL   72
    1    H    LEU  58           H        LEU  58  -9.580   0.146 -14.751
    2    HA   LEU  58           HA       LEU  58  -9.583  -2.374 -16.033
    3    HB2  LEU  58           HB2      LEU  58  -7.555  -1.077 -14.221
    4    HB3  LEU  58           HB3      LEU  58  -7.291  -2.601 -15.070
    5    HG   LEU  58           HG       LEU  58  -8.040  -0.001 -16.444
    6   HD11  LEU  58          HD11      LEU  58  -5.396  -1.235 -15.740
    7   HD13  LEU  58          HD12      LEU  58  -5.892   0.456 -15.697
    8   HD12  LEU  58          HD13      LEU  58  -5.547  -0.319 -17.240
    9   HD22  LEU  58          HD21      LEU  58  -8.610  -1.567 -18.032
   10   HD21  LEU  58          HD22      LEU  58  -7.571  -2.813 -17.343
   11   HD23  LEU  58          HD23      LEU  58  -6.877  -1.542 -18.350

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  59           H        ILE  59 -10.416  -1.463 -12.787
    2    HA   ILE  59           HA       ILE  59 -10.067  -4.227 -11.830
    3    HB   ILE  59           HB       ILE  59  -9.628  -1.957 -10.437
    4   HG12  ILE  59          HG12      ILE  59 -10.999  -4.316  -9.126
    5   HG13  ILE  59          HG13      ILE  59  -9.345  -4.373  -9.680
    6   HG21  ILE  59          HG21      ILE  59 -12.170  -1.452 -10.705
    7   HG23  ILE  59          HG22      ILE  59 -11.454  -1.250  -9.122
    8   HG22  ILE  59          HG23      ILE  59 -12.397  -2.692  -9.494
    9   HD13  ILE  59          HD11      ILE  59  -9.227  -3.771  -7.386
   10   HD12  ILE  59          HD12      ILE  59 -10.505  -2.576  -7.564
   11   HD11  ILE  59          HD13      ILE  59  -8.920  -2.287  -8.282

  No H/Q in entry =          11
  In of MODEL   72
    1    H    GLU  60           H        GLU  60 -12.623  -1.915 -12.655
    2    HA   GLU  60           HA       GLU  60 -14.811  -3.430 -11.645
    3    HB2  GLU  60           HB2      GLU  60 -15.027  -1.061 -12.246
    4    HB3  GLU  60           HB3      GLU  60 -14.692  -1.442 -13.933
    5    HG2  GLU  60           HG2      GLU  60 -16.724  -2.875 -13.991
    6    HG3  GLU  60           HG3      GLU  60 -17.075  -2.416 -12.338

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLY  61           H        GLY  61 -13.126  -3.423 -14.754
    2    HA3  GLY  61           HA2      GLY  61 -14.835  -5.671 -15.644
    3    HA2  GLY  61           HA3      GLY  61 -13.986  -4.569 -16.722

  No H/Q in entry =           3
  In of MODEL   72
    1    H    ASP  62           H        ASP  62 -12.620  -6.006 -13.828
    2    HA   ASP  62           HA       ASP  62 -10.382  -7.024 -15.319
    3    HB2  ASP  62           HB2      ASP  62  -9.599  -7.752 -13.078
    4    HB3  ASP  62           HB3      ASP  62 -10.058  -6.053 -13.112

  No H/Q in entry =           4
  In of MODEL   72
    1    H    ALA  63           H        ALA  63 -10.416  -8.927 -16.420
    2    HA   ALA  63           HA       ALA  63 -11.866 -11.230 -15.210
    3    HB2  ALA  63           HB1      ALA  63 -12.272 -11.962 -17.609
    4    HB1  ALA  63           HB2      ALA  63 -11.703 -10.373 -18.118
    5    HB3  ALA  63           HB3      ALA  63 -13.157 -10.514 -17.129

  No H/Q in entry =           5
  In of MODEL   72
    1    H    GLY  64           H        GLY  64  -9.261 -10.086 -17.278
    2    HA3  GLY  64           HA2      GLY  64  -7.211 -10.949 -17.827
    3    HA2  GLY  64           HA3      GLY  64  -7.299 -11.839 -16.313

  No H/Q in entry =           3
  In of MODEL   72
    1    H    GLU  65           H        GLU  65  -6.798 -13.911 -16.746
    2    HA   GLU  65           HA       GLU  65  -7.040 -15.162 -19.223
    3    HB2  GLU  65           HB2      GLU  65  -6.897 -16.341 -16.451
    4    HB3  GLU  65           HB3      GLU  65  -6.810 -17.305 -17.926
    5    HG2  GLU  65           HG2      GLU  65  -4.848 -16.068 -18.670
    6    HG3  GLU  65           HG3      GLU  65  -4.963 -14.992 -17.278

  No H/Q in entry =           6
  In of MODEL   72
    1    H    GLY  66           H        GLY  66  -8.181 -17.533 -18.966
    2    HA3  GLY  66           HA2      GLY  66 -10.870 -17.152 -19.676
    3    HA2  GLY  66           HA3      GLY  66 -10.096 -18.693 -19.361

  No H/Q in entry =           3
  In of MODEL   72
    1    H    LYS  67           H        LYS  67  -9.420 -18.181 -16.648
    2    HA   LYS  67           HA       LYS  67 -11.886 -18.938 -15.421
    3    HB2  LYS  67           HB2      LYS  67  -9.107 -18.522 -14.328
    4    HB3  LYS  67           HB3      LYS  67 -10.462 -19.135 -13.371
    5    HG2  LYS  67           HG2      LYS  67 -10.786 -20.967 -14.996
    6    HG3  LYS  67           HG3      LYS  67  -9.430 -20.363 -15.947
    7    HD2  LYS  67           HD2      LYS  67  -7.912 -20.750 -14.043
    8    HD3  LYS  67           HD3      LYS  67  -9.269 -21.349 -13.085
    9    HE2  LYS  67           HE2      LYS  67  -9.647 -23.149 -14.732
   10    HE3  LYS  67           HE3      LYS  67  -8.294 -22.552 -15.694
   11    HZ3  LYS  67           HZ1      LYS  67  -7.085 -23.956 -14.476
   12    HZ2  LYS  67           HZ2      LYS  67  -8.284 -24.125 -13.285
   13    HZ1  LYS  67           HZ3      LYS  67  -7.213 -22.808 -13.235

  No H/Q in entry =          13
  In of MODEL   72
    1    H    MET  68           H        MET  68 -12.827 -18.089 -13.568
    2    HA   MET  68           HA       MET  68 -13.755 -15.536 -13.664
    3    HB2  MET  68           HB2      MET  68 -13.377 -17.310 -11.255
    4    HB3  MET  68           HB3      MET  68 -14.341 -15.833 -11.248
    5    HG2  MET  68           HG2      MET  68 -15.897 -16.710 -12.807
    6    HG3  MET  68           HG3      MET  68 -14.810 -18.017 -13.279
    7    HE2  MET  68           HE1      MET  68 -16.464 -17.622  -9.019
    8    HE1  MET  68           HE2      MET  68 -16.236 -16.321 -10.186
    9    HE3  MET  68           HE3      MET  68 -14.832 -17.132  -9.494

  No H/Q in entry =           9
  In of MODEL   72
    1    H    LYS  69           H        LYS  69 -10.532 -16.195 -12.955
    2    HA   LYS  69           HA       LYS  69 -10.009 -14.348 -10.893
    3    HB2  LYS  69           HB2      LYS  69  -8.354 -15.802 -12.901
    4    HB3  LYS  69           HB3      LYS  69  -7.606 -14.493 -11.983
    5    HG2  LYS  69           HG2      LYS  69  -7.315 -16.624 -10.797
    6    HG3  LYS  69           HG3      LYS  69  -8.370 -15.556  -9.873
    7    HD2  LYS  69           HD2      LYS  69 -10.342 -16.728 -10.658
    8    HD3  LYS  69           HD3      LYS  69  -9.372 -17.709 -11.756
    9    HE2  LYS  69           HE2      LYS  69  -9.822 -19.041  -9.789
   10    HE3  LYS  69           HE3      LYS  69  -8.121 -18.581  -9.749
   11    HZ2  LYS  69           HZ1      LYS  69 -10.218 -17.923  -7.930
   12    HZ1  LYS  69           HZ2      LYS  69  -9.420 -16.533  -8.492
   13    HZ3  LYS  69           HZ3      LYS  69  -8.539 -17.777  -7.738

  No H/Q in entry =          13
  In of MODEL   72
    1    H    VAL  70           H        VAL  70  -7.863 -12.784 -11.677
    2    HA   VAL  70           HA       VAL  70  -9.053 -10.796 -13.529
    3    HB   VAL  70           HB       VAL  70  -8.076  -9.053 -12.039
    4   HG12  VAL  70          HG11      VAL  70  -9.987 -10.944 -10.635
    5   HG11  VAL  70          HG12      VAL  70 -10.461  -9.781 -11.874
    6   HG13  VAL  70          HG13      VAL  70  -9.819  -9.215 -10.332
    7   HG23  VAL  70          HG21      VAL  70  -7.655 -10.049  -9.606
    8   HG22  VAL  70          HG22      VAL  70  -6.359 -10.029 -10.800
    9   HG21  VAL  70          HG23      VAL  70  -7.264 -11.513 -10.508

  No H/Q in entry =           9
  In of MODEL   72
    1    H    SER  71           H        SER  71  -7.424  -9.281 -14.399
    2    HA   SER  71           HA       SER  71  -5.247 -10.603 -15.622
    3    HB2  SER  71           HB2      SER  71  -6.309  -8.581 -16.571
    4    HB3  SER  71           HB3      SER  71  -5.694  -7.633 -15.219
    5    HG   SER  71           HG       SER  71  -4.193  -9.061 -17.163

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LEU  72           H        LEU  72  -3.165 -10.851 -15.029
    2    HA   LEU  72           HA       LEU  72  -2.455 -10.628 -12.315
    3    HB2  LEU  72           HB2      LEU  72  -0.795 -11.068 -14.793
    4    HB3  LEU  72           HB3      LEU  72  -0.134 -11.129 -13.162
    5    HG   LEU  72           HG       LEU  72  -2.488 -12.828 -14.047
    6   HD11  LEU  72          HD11      LEU  72   0.458 -13.546 -13.925
    7   HD13  LEU  72          HD12      LEU  72  -0.500 -13.381 -15.396
    8   HD12  LEU  72          HD13      LEU  72  -0.860 -14.674 -14.252
    9   HD22  LEU  72          HD21      LEU  72  -2.469 -12.824 -11.695
   10   HD21  LEU  72          HD22      LEU  72  -0.718 -12.710 -11.599
   11   HD23  LEU  72          HD23      LEU  72  -1.476 -14.229 -12.070

  No H/Q in entry =          11
  In of MODEL   72
    1    H    VAL  73           H        VAL  73  -1.728  -8.621 -15.100
    2    HA   VAL  73           HA       VAL  73   0.190  -6.919 -13.995
    3    HB   VAL  73           HB       VAL  73  -0.204  -5.502 -15.856
    4   HG11  VAL  73          HG11      VAL  73   0.564  -7.940 -16.235
    5   HG13  VAL  73          HG12      VAL  73   0.000  -7.040 -17.642
    6   HG12  VAL  73          HG13      VAL  73  -1.060  -8.214 -16.864
    7   HG23  VAL  73          HG21      VAL  73  -2.362  -6.123 -17.264
    8   HG22  VAL  73          HG22      VAL  73  -2.468  -4.991 -15.916
    9   HG21  VAL  73          HG23      VAL  73  -2.960  -6.671 -15.697

  No H/Q in entry =           9
  In of MODEL   72
    1    H    LEU  74           H        LEU  74  -3.210  -7.032 -13.449
    2    HA   LEU  74           HA       LEU  74  -3.829  -4.373 -12.848
    3    HB2  LEU  74           HB2      LEU  74  -5.557  -6.040 -13.024
    4    HB3  LEU  74           HB3      LEU  74  -4.873  -6.957 -11.684
    5    HG   LEU  74           HG       LEU  74  -5.342  -5.073 -10.154
    6   HD13  LEU  74          HD11      LEU  74  -5.224  -3.142 -11.520
    7   HD12  LEU  74          HD12      LEU  74  -6.940  -3.300 -11.147
    8   HD11  LEU  74          HD13      LEU  74  -6.328  -3.820 -12.718
    9   HD23  LEU  74          HD21      LEU  74  -7.890  -5.510 -11.626
   10   HD22  LEU  74          HD22      LEU  74  -7.530  -5.639  -9.918
   11   HD21  LEU  74          HD23      LEU  74  -7.040  -6.919 -11.000

  No H/Q in entry =          11
  In of MODEL   72
    1    H    VAL  75           H        VAL  75  -2.798  -6.953 -10.674
    2    HA   VAL  75           HA       VAL  75  -2.607  -5.394  -8.335
    3    HB   VAL  75           HB       VAL  75  -1.113  -7.895  -9.113
    4   HG13  VAL  75          HG11      VAL  75   0.149  -6.658  -7.386
    5   HG12  VAL  75          HG12      VAL  75  -0.660  -8.035  -6.650
    6   HG11  VAL  75          HG13      VAL  75  -1.327  -6.423  -6.455
    7   HG23  VAL  75          HG21      VAL  75  -3.492  -7.375  -7.293
    8   HG22  VAL  75          HG22      VAL  75  -2.777  -8.950  -7.633
    9   HG21  VAL  75          HG23      VAL  75  -3.598  -8.058  -8.915

  No H/Q in entry =           9
  In of MODEL   72
    1    H    GLU  76           H        GLU  76  -0.189  -6.164 -10.859
    2    HA   GLU  76           HA       GLU  76   1.993  -4.814  -9.698
    3    HB2  GLU  76           HB2      GLU  76   2.171  -6.304 -11.688
    4    HB3  GLU  76           HB3      GLU  76   1.310  -5.110 -12.647
    5    HG2  GLU  76           HG2      GLU  76   3.121  -3.481 -12.280
    6    HG3  GLU  76           HG3      GLU  76   3.997  -4.635 -11.294

  No H/Q in entry =           6
  In of MODEL   72
    1    H    ALA  77           H        ALA  77  -0.530  -3.619 -11.901
    2    HA   ALA  77           HA       ALA  77   0.462  -0.974 -12.082
    3    HB3  ALA  77           HB1      ALA  77  -2.435  -1.834 -12.277
    4    HB1  ALA  77           HB2      ALA  77  -1.269  -2.016 -13.588
    5    HB2  ALA  77           HB3      ALA  77  -1.691  -0.407 -13.003

  No H/Q in entry =           5
  In of MODEL   72
    1    H    GLN  78           H        GLN  78  -1.815  -2.521  -9.874
    2    HA   GLN  78           HA       GLN  78  -2.627  -0.198  -8.484
    3    HB2  GLN  78           HB2      GLN  78  -3.734  -2.460  -8.397
    4    HB3  GLN  78           HB3      GLN  78  -2.405  -3.011  -7.382
    5    HG2  GLN  78           HG2      GLN  78  -2.936  -1.267  -5.732
    6    HG3  GLN  78           HG3      GLN  78  -4.265  -0.706  -6.745
    7   HE21  GLN  78          HE21      GLN  78  -4.751  -1.667  -4.090
    8   HE22  GLN  78          HE22      GLN  78  -5.614  -3.126  -4.202

  No H/Q in entry =           8
  In of MODEL   72
    1    H    LEU  79           H        LEU  79   0.050  -2.452  -8.015
    2    HA   LEU  79           HA       LEU  79   1.016  -1.547  -5.557
    3    HB2  LEU  79           HB2      LEU  79   1.890  -3.559  -6.615
    4    HB3  LEU  79           HB3      LEU  79   2.541  -2.612  -7.949
    5    HG   LEU  79           HG       LEU  79   4.091  -1.467  -6.443
    6   HD13  LEU  79          HD11      LEU  79   3.078  -1.215  -4.381
    7   HD12  LEU  79          HD12      LEU  79   4.156  -2.563  -4.028
    8   HD11  LEU  79          HD13      LEU  79   2.452  -2.864  -4.363
    9   HD23  LEU  79          HD21      LEU  79   5.299  -3.612  -5.528
   10   HD22  LEU  79          HD22      LEU  79   5.102  -3.419  -7.267
   11   HD21  LEU  79          HD23      LEU  79   4.021  -4.486  -6.375

  No H/Q in entry =          11
  In of MODEL   72
    1    H    HIS  80           H        HIS  80   1.899  -0.441  -8.831
    2    HA   HIS  80           HA       HIS  80   3.701   1.551  -7.908
    3    HB2  HIS  80           HB2      HIS  80   2.423   0.847 -10.494
    4    HB3  HIS  80           HB3      HIS  80   3.016   2.500 -10.326
    5    HD1  HIS  80           HD1      HIS  80   5.419   2.800 -10.839
    6    HD2  HIS  80           HD2      HIS  80   4.598  -1.107  -9.638
    7    HE1  HIS  80           HE1      HIS  80   7.611   1.525 -10.992
    8    HE2  HIS  80           HE2      HIS  80   7.122  -0.860 -10.263

  No H/Q in entry =           8
  In of MODEL   72
    1    H    LEU  81           H        LEU  81   0.301   1.704  -8.902
    2    HA   LEU  81           HA       LEU  81   0.022   4.498  -8.582
    3    HB2  LEU  81           HB2      LEU  81  -1.990   2.250  -8.504
    4    HB3  LEU  81           HB3      LEU  81  -2.445   3.953  -8.419
    5    HG   LEU  81           HG       LEU  81  -0.741   2.798 -10.644
    6   HD12  LEU  81          HD11      LEU  81  -2.968   3.110 -11.954
    7   HD11  LEU  81          HD12      LEU  81  -3.731   3.046 -10.365
    8   HD13  LEU  81          HD13      LEU  81  -2.784   1.678 -10.944
    9   HD23  LEU  81          HD21      LEU  81  -1.837   4.937 -11.753
   10   HD22  LEU  81          HD22      LEU  81  -0.425   5.113 -10.715
   11   HD21  LEU  81          HD23      LEU  81  -2.032   5.462 -10.082

  No H/Q in entry =          11
  In of MODEL   72
    1    H    MET  82           H        MET  82  -0.643   1.817  -6.327
    2    HA   MET  82           HA       MET  82  -1.706   3.409  -4.249
    3    HB2  MET  82           HB2      MET  82  -0.328   0.724  -4.274
    4    HB3  MET  82           HB3      MET  82  -0.914   1.453  -2.781
    5    HG2  MET  82           HG2      MET  82  -2.636   0.949  -5.228
    6    HG3  MET  82           HG3      MET  82  -2.562  -0.120  -3.829
    7    HE3  MET  82           HE1      MET  82  -4.299   1.536  -1.026
    8    HE2  MET  82           HE2      MET  82  -2.568   1.816  -1.205
    9    HE1  MET  82           HE3      MET  82  -3.252   0.256  -1.657

  No H/Q in entry =           9
  In of MODEL   72
    1    H    THR  83           H        THR  83   1.599   2.327  -4.921
    2    HA   THR  83           HA       THR  83   2.805   3.441  -2.619
    3    HB   THR  83           HB       THR  83   4.906   3.384  -4.084
    4    HG1  THR  83           HG1      THR  83   4.676   2.851  -6.107
    5   HG22  THR  83          HG21      THR  83   4.469   0.724  -4.409
    6   HG21  THR  83          HG22      THR  83   3.174   1.105  -3.276
    7   HG23  THR  83          HG23      THR  83   4.850   1.453  -2.850

  No H/Q in entry =           7
  In of MODEL   72
    1    H    SER  84           H        SER  84   2.446   4.709  -5.925
    2    HA   SER  84           HA       SER  84   3.779   7.153  -5.472
    3    HB2  SER  84           HB2      SER  84   1.719   6.310  -7.498
    4    HB3  SER  84           HB3      SER  84   2.394   7.939  -7.475
    5    HG   SER  84           HG       SER  84   3.773   5.465  -7.752

  No H/Q in entry =           5
  In of MODEL   72
    1    H    MET  85           H        MET  85   0.286   6.391  -5.313
    2    HA   MET  85           HA       MET  85  -0.582   9.001  -4.724
    3    HB2  MET  85           HB2      MET  85  -2.097   7.185  -5.393
    4    HB3  MET  85           HB3      MET  85  -1.817   6.389  -3.845
    5    HG2  MET  85           HG2      MET  85  -2.722   8.345  -2.658
    6    HG3  MET  85           HG3      MET  85  -2.968   9.172  -4.195
    7    HE3  MET  85           HE1      MET  85  -4.969   5.387  -2.659
    8    HE2  MET  85           HE2      MET  85  -4.939   6.795  -1.602
    9    HE1  MET  85           HE3      MET  85  -3.427   6.125  -2.208

  No H/Q in entry =           9
  In of MODEL   72
    1    H    LEU  86           H        LEU  86   0.332   6.347  -2.568
    2    HA   LEU  86           HA       LEU  86  -0.213   7.657  -0.132
    3    HB2  LEU  86           HB2      LEU  86   0.256   5.185  -0.516
    4    HB3  LEU  86           HB3      LEU  86   1.963   5.617  -0.606
    5    HG   LEU  86           HG       LEU  86   1.627   6.784   1.658
    6   HD11  LEU  86          HD11      LEU  86  -1.064   6.014   1.178
    7   HD13  LEU  86          HD12      LEU  86  -0.405   6.766   2.628
    8   HD12  LEU  86          HD13      LEU  86  -0.494   5.010   2.514
    9   HD23  LEU  86          HD21      LEU  86   1.201   3.792   1.787
   10   HD22  LEU  86          HD22      LEU  86   2.198   4.805   2.828
   11   HD21  LEU  86          HD23      LEU  86   2.706   4.476   1.172

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ALA  87           H        ALA  87   2.776   7.359  -2.008
    2    HA   ALA  87           HA       ALA  87   4.474   8.776  -0.280
    3    HB3  ALA  87           HB1      ALA  87   4.580   7.755  -2.984
    4    HB2  ALA  87           HB2      ALA  87   5.910   8.089  -1.879
    5    HB1  ALA  87           HB3      ALA  87   5.299   9.366  -2.929

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ARG  88           H        ARG  88   2.537   9.903  -3.012
    2    HA   ARG  88           HA       ARG  88   3.311  12.593  -2.900
    3    HB2  ARG  88           HB2      ARG  88   2.064  11.435  -4.759
    4    HB3  ARG  88           HB3      ARG  88   0.603  11.581  -3.782
    5    HG2  ARG  88           HG2      ARG  88   1.622  14.162  -3.702
    6    HG3  ARG  88           HG3      ARG  88   2.053  13.643  -5.330
    7    HD2  ARG  88           HD2      ARG  88  -0.086  13.721  -6.036
    8    HD3  ARG  88           HD3      ARG  88  -0.678  12.872  -4.608
    9    HE   ARG  88           HE       ARG  88  -0.866  15.649  -5.034
   10   HH21  ARG  88          HH11      ARG  88  -1.400  16.983  -3.302
   11   HH22  ARG  88          HH12      ARG  88  -1.110  16.451  -1.682
   12   HH11  ARG  88          HH21      ARG  88   0.140  13.393  -2.650
   13   HH12  ARG  88          HH22      ARG  88  -0.256  14.412  -1.313

  No H/Q in entry =          13
  In of MODEL   72
    1    H    GLU  89           H        GLU  89   0.600  10.924  -1.266
    2    HA   GLU  89           HA       GLU  89  -0.511  13.240  -0.072
    3    HB2  GLU  89           HB2      GLU  89  -1.630  11.001  -0.157
    4    HB3  GLU  89           HB3      GLU  89  -0.511  10.449   1.090
    5    HG2  GLU  89           HG2      GLU  89  -1.336  12.152   2.641
    6    HG3  GLU  89           HG3      GLU  89  -2.383  12.820   1.392

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LEU  90           H        LEU  90   1.934  10.949   1.118
    2    HA   LEU  90           HA       LEU  90   2.281  12.200   3.646
    3    HB2  LEU  90           HB2      LEU  90   4.059  10.420   1.980
    4    HB3  LEU  90           HB3      LEU  90   4.472  10.940   3.619
    5    HG   LEU  90           HG       LEU  90   1.839   9.596   2.951
    6   HD12  LEU  90          HD11      LEU  90   2.973   7.551   3.970
    7   HD11  LEU  90          HD12      LEU  90   4.497   8.405   3.731
    8   HD13  LEU  90          HD13      LEU  90   3.490   7.995   2.342
    9   HD22  LEU  90          HD21      LEU  90   1.567  10.525   5.070
   10   HD21  LEU  90          HD22      LEU  90   3.283  10.417   5.459
   11   HD23  LEU  90          HD23      LEU  90   2.275   8.971   5.507

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  91           H        ILE  91   3.897  12.572   0.524
    2    HA   ILE  91           HA       ILE  91   5.873  14.403   1.366
    3    HB   ILE  91           HB       ILE  91   4.571  13.907  -1.318
    4   HG12  ILE  91          HG12      ILE  91   7.399  13.418  -0.331
    5   HG13  ILE  91          HG13      ILE  91   6.115  12.223  -0.171
    6   HG22  ILE  91          HG21      ILE  91   6.799  15.249  -2.001
    7   HG21  ILE  91          HG22      ILE  91   6.484  16.054  -0.463
    8   HG23  ILE  91          HG23      ILE  91   5.266  16.081  -1.737
    9   HD13  ILE  91          HD11      ILE  91   5.950  11.894  -2.478
   10   HD12  ILE  91          HD12      ILE  91   7.684  12.135  -2.258
   11   HD11  ILE  91          HD13      ILE  91   6.678  13.458  -2.852

  No H/Q in entry =          11
  In of MODEL   72
    1    H    THR  92           H        THR  92   2.516  14.838   0.344
    2    HA   THR  92           HA       THR  92   2.495  17.662   0.276
    3    HB   THR  92           HB       THR  92   0.321  15.673   0.972
    4    HG1  THR  92           HG1      THR  92   0.633  15.488  -1.111
    5   HG22  THR  92          HG21      THR  92  -1.073  17.835   0.240
    6   HG21  THR  92          HG22      THR  92   0.318  18.660   0.940
    7   HG23  THR  92          HG23      THR  92  -0.629  17.542   1.921

  No H/Q in entry =           7
  In of MODEL   72
    1    H    GLU  93           H        GLU  93   1.932  15.369   2.934
    2    HA   GLU  93           HA       GLU  93   1.396  17.279   4.945
    3    HB2  GLU  93           HB2      GLU  93   2.703  14.553   5.194
    4    HB3  GLU  93           HB3      GLU  93   2.009  15.485   6.521
    5    HG2  GLU  93           HG2      GLU  93   0.405  14.704   4.079
    6    HG3  GLU  93           HG3      GLU  93   0.499  13.684   5.510

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LEU  94           H        LEU  94   4.404  15.789   3.811
    2    HA   LEU  94           HA       LEU  94   6.150  16.938   5.703
    3    HB2  LEU  94           HB2      LEU  94   6.560  15.962   2.876
    4    HB3  LEU  94           HB3      LEU  94   7.888  16.620   3.829
    5    HG   LEU  94           HG       LEU  94   6.139  14.430   4.963
    6   HD11  LEU  94          HD11      LEU  94   8.242  14.195   2.840
    7   HD13  LEU  94          HD12      LEU  94   6.793  13.224   3.099
    8   HD12  LEU  94          HD13      LEU  94   8.215  12.971   4.112
    9   HD23  LEU  94          HD21      LEU  94   8.323  13.892   6.125
   10   HD22  LEU  94          HD22      LEU  94   7.658  15.473   6.535
   11   HD21  LEU  94          HD23      LEU  94   9.001  15.347   5.398

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  95           H        ILE  95   5.025  18.103   2.546
    2    HA   ILE  95           HA       ILE  95   6.602  20.457   2.486
    3    HB   ILE  95           HB       ILE  95   3.961  19.776   1.172
    4   HG12  ILE  95          HG12      ILE  95   6.755  20.104   0.045
    5   HG13  ILE  95          HG13      ILE  95   6.101  18.554   0.561
    6   HG21  ILE  95          HG21      ILE  95   5.717  22.239   0.952
    7   HG23  ILE  95          HG22      ILE  95   3.990  22.175   1.302
    8   HG22  ILE  95          HG23      ILE  95   4.578  21.769  -0.311
    9   HD13  ILE  95          HD11      ILE  95   4.547  18.476  -1.174
   10   HD12  ILE  95          HD12      ILE  95   5.901  19.290  -1.959
   11   HD11  ILE  95          HD13      ILE  95   4.528  20.229  -1.374

  No H/Q in entry =          11
  In of MODEL   72
    1    H    GLU  96           H        GLU  96   3.347  19.815   3.770
    2    HA   GLU  96           HA       GLU  96   2.729  22.466   4.512
    3    HB2  GLU  96           HB2      GLU  96   1.051  20.686   4.522
    4    HB3  GLU  96           HB3      GLU  96   1.906  19.860   5.823
    5    HG2  GLU  96           HG2      GLU  96   0.882  21.150   7.385
    6    HG3  GLU  96           HG3      GLU  96   1.424  22.620   6.586

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LEU  97           H        LEU  97   4.560  19.915   6.151
    2    HA   LEU  97           HA       LEU  97   4.911  21.269   8.620
    3    HB2  LEU  97           HB2      LEU  97   6.449  19.093   7.217
    4    HB3  LEU  97           HB3      LEU  97   7.034  19.781   8.730
    5    HG   LEU  97           HG       LEU  97   4.223  18.693   8.411
    6   HD12  LEU  97          HD11      LEU  97   5.154  16.681   9.632
    7   HD11  LEU  97          HD12      LEU  97   6.768  17.308   9.293
    8   HD13  LEU  97          HD13      LEU  97   5.702  16.849   7.964
    9   HD23  LEU  97          HD21      LEU  97   4.666  18.404  10.978
   10   HD22  LEU  97          HD22      LEU  97   4.292  20.015  10.367
   11   HD21  LEU  97          HD23      LEU  97   5.961  19.572  10.720

  No H/Q in entry =          11
  In of MODEL   72
    1    H    HIS  98           H        HIS  98   6.793  21.273   5.601
    2    HA   HIS  98           HA       HIS  98   8.948  22.849   6.505
    3    HB2  HIS  98           HB2      HIS  98   7.664  22.590   3.775
    4    HB3  HIS  98           HB3      HIS  98   9.106  23.566   4.068
    5    HD1  HIS  98           HD1      HIS  98   7.885  19.999   4.092
    6    HD2  HIS  98           HD2      HIS  98  11.470  22.087   4.526
    7    HE1  HIS  98           HE1      HIS  98   9.735  18.264   4.047
    8    HE2  HIS  98           HE2      HIS  98  11.922  19.515   4.311

  No H/Q in entry =           8
  In of MODEL   72
    1    H    GLU  99           H        GLU  99   5.733  23.690   5.315
    2    HA   GLU  99           HA       GLU  99   6.120  26.503   5.251
    3    HB2  GLU  99           HB2      GLU  99   4.242  25.337   4.116
    4    HB3  GLU  99           HB3      GLU  99   3.539  24.981   5.694
    5    HG2  GLU  99           HG2      GLU  99   3.364  27.375   6.188
    6    HG3  GLU  99           HG3      GLU  99   4.147  27.769   4.660

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LYS 100           H        LYS 100   4.974  24.278   7.774
    2    HA   LYS 100           HA       LYS 100   4.386  26.338   9.661
    3    HB2  LYS 100           HB2      LYS 100   4.951  23.386  10.016
    4    HB3  LYS 100           HB3      LYS 100   4.502  24.464  11.344
    5    HG2  LYS 100           HG2      LYS 100   2.443  25.104  10.086
    6    HG3  LYS 100           HG3      LYS 100   2.871  23.931   8.838
    7    HD2  LYS 100           HD2      LYS 100   2.782  22.115  10.504
    8    HD3  LYS 100           HD3      LYS 100   2.370  23.282  11.763
    9    HE2  LYS 100           HE2      LYS 100   0.324  23.906  10.491
   10    HE3  LYS 100           HE3      LYS 100   0.725  22.682   9.279
   11    HZ1  LYS 100           HZ1      LYS 100   0.446  22.023  12.161
   12    HZ3  LYS 100           HZ2      LYS 100   0.432  20.966  10.829
   13    HZ2  LYS 100           HZ3      LYS 100  -0.881  22.010  11.101

  No H/Q in entry =          13
  In of MODEL   72
    1    H    LEU 101           H        LEU 101   7.307  24.532   8.843
    2    HA   LEU 101           HA       LEU 101   8.900  25.372  11.050
    3    HB2  LEU 101           HB2      LEU 101   9.502  24.377   8.277
    4    HB3  LEU 101           HB3      LEU 101  10.802  25.041   9.262
    5    HG   LEU 101           HG       LEU 101   8.959  22.893  10.324
    6   HD12  LEU 101          HD11      LEU 101  11.011  21.390   9.728
    7   HD11  LEU 101          HD12      LEU 101  11.386  22.649   8.553
    8   HD13  LEU 101          HD13      LEU 101   9.855  21.780   8.455
    9   HD21  LEU 101          HD21      LEU 101  11.684  23.994  11.059
   10   HD23  LEU 101          HD22      LEU 101  11.133  22.425  11.641
   11   HD22  LEU 101          HD23      LEU 101  10.244  23.885  12.072

  No H/Q in entry =          11
  In of MODEL   72
    1    H    LYS 102           H        LYS 102   7.331  27.236   8.899
    2    HA   LYS 102           HA       LYS 102   7.417  29.528   8.601
    3    HB2  LYS 102           HB2      LYS 102   8.973  29.413  10.706
    4    HB3  LYS 102           HB3      LYS 102  10.278  29.600   9.551
    5    HG2  LYS 102           HG2      LYS 102   8.175  31.562  10.400
    6    HG3  LYS 102           HG3      LYS 102   9.890  31.815  10.155
    7    HD2  LYS 102           HD2      LYS 102   7.946  31.393   7.848
    8    HD3  LYS 102           HD3      LYS 102   8.332  32.973   8.514
    9    HE2  LYS 102           HE2      LYS 102   9.709  31.779   6.449
   10    HE3  LYS 102           HE3      LYS 102  10.326  33.086   7.459
   11    HZ2  LYS 102           HZ1      LYS 102  11.841  31.175   7.295
   12    HZ1  LYS 102           HZ2      LYS 102  10.672  30.199   8.035
   13    HZ3  LYS 102           HZ3      LYS 102  11.366  31.486   8.894

  No H/Q in entry =          13
  In of MODEL   72
    1    H    ALA 103           H        ALA 103  10.671  28.176   8.053
    2    HA   ALA 103           HA       ALA 103  11.648  29.544   5.977
    3    HB2  ALA 103           HB1      ALA 103  12.529  27.324   5.059
    4    HB1  ALA 103           HB2      ALA 103  11.626  26.557   6.363
    5    HB3  ALA 103           HB3      ALA 103  12.918  27.697   6.738

  No H/Q in entry =           5
  In of MODEL   72
    1    H1   LYS   3           H1       LYS   3 -31.588   6.243 -19.480
    2    H2   LYS   3           H3       LYS   3 -30.603   6.009 -20.843
    3    H3   LYS   3           H2       LYS   3 -31.976   5.038 -20.611
    4    HA   LYS   3           HA       LYS   3 -30.936   3.636 -19.248
    5    HB2  LYS   3           HB2      LYS   3 -28.692   5.129 -20.558
    6    HB3  LYS   3           HB3      LYS   3 -28.335   3.897 -19.347
    7    HG2  LYS   3           HG2      LYS   3 -29.731   2.316 -20.729
    8    HG3  LYS   3           HG3      LYS   3 -29.720   3.548 -21.989
    9    HD2  LYS   3           HD2      LYS   3 -27.234   3.485 -21.956
   10    HD3  LYS   3           HD3      LYS   3 -27.319   2.155 -20.800
   11    HE2  LYS   3           HE2      LYS   3 -28.803   0.992 -22.537
   12    HE3  LYS   3           HE3      LYS   3 -28.215   2.210 -23.667
   13    HZ3  LYS   3           HZ1      LYS   3 -26.393   1.028 -23.977
   14    HZ2  LYS   3           HZ2      LYS   3 -26.992  -0.179 -22.943
   15    HZ1  LYS   3           HZ3      LYS   3 -26.025   1.070 -22.321

  No H/Q in entry =          15
  In of MODEL   72
    1    H    LYS   4           H        LYS   4 -30.972   3.441 -17.191
    2    HA   LYS   4           HA       LYS   4 -30.279   5.701 -15.488
    3    HB2  LYS   4           HB2      LYS   4 -31.421   2.968 -14.849
    4    HB3  LYS   4           HB3      LYS   4 -31.219   4.282 -13.691
    5    HG2  LYS   4           HG2      LYS   4 -33.041   4.243 -16.103
    6    HG3  LYS   4           HG3      LYS   4 -33.522   4.241 -14.407
    7    HD2  LYS   4           HD2      LYS   4 -32.870   6.470 -14.090
    8    HD3  LYS   4           HD3      LYS   4 -31.837   6.468 -15.519
    9    HE2  LYS   4           HE2      LYS   4 -33.793   7.814 -15.937
   10    HE3  LYS   4           HE3      LYS   4 -33.850   6.365 -16.941
   11    HZ3  LYS   4           HZ1      LYS   4 -35.397   5.383 -15.408
   12    HZ2  LYS   4           HZ2      LYS   4 -35.985   6.882 -15.952
   13    HZ1  LYS   4           HZ3      LYS   4 -35.317   6.745 -14.396

  No H/Q in entry =          13
  In of MODEL   72
    1    H    HIS   5           H        HIS   5 -28.802   5.775 -13.904
    2    HA   HIS   5           HA       HIS   5 -26.487   4.000 -14.294
    3    HB2  HIS   5           HB2      HIS   5 -26.787   6.719 -13.018
    4    HB3  HIS   5           HB3      HIS   5 -25.287   5.793 -13.033
    5    HD1  HIS   5           HD1      HIS   5 -23.850   7.059 -14.601
    6    HD2  HIS   5           HD2      HIS   5 -27.649   6.404 -16.148
    7    HE1  HIS   5           HE1      HIS   5 -23.709   7.703 -17.037
    8    HE2  HIS   5           HE2      HIS   5 -26.024   7.291 -17.949

  No H/Q in entry =           8
  In of MODEL   72
    1    H    ILE   6           H        ILE   6 -26.220   2.400 -13.018
    2    HA   ILE   6           HA       ILE   6 -27.184   2.581 -10.242
    3    HB   ILE   6           HB       ILE   6 -26.323   0.168 -11.845
    4   HG12  ILE   6          HG12      ILE   6 -29.077   1.032 -10.955
    5   HG13  ILE   6          HG13      ILE   6 -28.449   1.246 -12.589
    6   HG23  ILE   6          HG21      ILE   6 -26.662  -1.136 -10.015
    7   HG22  ILE   6          HG22      ILE   6 -27.835  -0.029  -9.300
    8   HG21  ILE   6          HG23      ILE   6 -26.112   0.337  -9.213
    9   HD13  ILE   6          HD11      ILE   6 -28.873  -0.867 -13.138
   10   HD12  ILE   6          HD12      ILE   6 -29.879  -0.905 -11.691
   11   HD11  ILE   6          HD13      ILE   6 -28.214  -1.484 -11.623

  No H/Q in entry =          11
  In of MODEL   72
    1    H    TYR   7           H        TYR   7 -25.429   3.221  -8.950
    2    HA   TYR   7           HA       TYR   7 -22.705   2.331  -9.669
    3    HB2  TYR   7           HB2      TYR   7 -23.703   4.710  -8.122
    4    HB3  TYR   7           HB3      TYR   7 -22.008   4.226  -8.184
    5    HD1  TYR   7           HD1      TYR   7 -23.052   3.342 -11.291
    6    HD2  TYR   7           HD2      TYR   7 -22.430   6.870  -8.980
    7    HE1  TYR   7           HE1      TYR   7 -22.654   4.630 -13.352
    8    HE2  TYR   7           HE2      TYR   7 -22.076   8.163 -11.034
    9    HH   TYR   7           HH       TYR   7 -22.307   8.127 -13.266

  No H/Q in entry =           9
  In of MODEL   72
    1    H    LEU   8           H        LEU   8 -21.706   0.963  -8.380
    2    HA   LEU   8           HA       LEU   8 -22.811   0.382  -5.703
    3    HB2  LEU   8           HB2      LEU   8 -21.091  -1.204  -7.588
    4    HB3  LEU   8           HB3      LEU   8 -21.259  -1.631  -5.886
    5    HG   LEU   8           HG       LEU   8 -23.738  -1.837  -6.298
    6   HD13  LEU   8          HD11      LEU   8 -23.903  -0.572  -8.376
    7   HD12  LEU   8          HD12      LEU   8 -24.406  -2.239  -8.653
    8   HD11  LEU   8          HD13      LEU   8 -22.810  -1.700  -9.176
    9   HD23  LEU   8          HD21      LEU   8 -22.438  -3.814  -8.049
   10   HD22  LEU   8          HD22      LEU   8 -23.514  -4.034  -6.668
   11   HD21  LEU   8          HD23      LEU   8 -21.812  -3.657  -6.408

  No H/Q in entry =          11
  In of MODEL   72
    1    H    PHE   9           H        PHE   9 -21.546   0.776  -3.918
    2    HA   PHE   9           HA       PHE   9 -18.775   1.765  -4.405
    3    HB2  PHE   9           HB2      PHE   9 -20.809   2.757  -2.413
    4    HB3  PHE   9           HB3      PHE   9 -19.111   3.212  -2.398
    5    HD1  PHE   9           HD1      PHE   9 -18.163   4.615  -4.145
    6    HD2  PHE   9           HD2      PHE   9 -22.317   3.541  -4.186
    7    HE1  PHE   9           HE1      PHE   9 -18.591   6.336  -5.875
    8    HE2  PHE   9           HE2      PHE   9 -22.747   5.274  -5.911
    9    HZ   PHE   9           HZ       PHE   9 -20.881   6.667  -6.761

  No H/Q in entry =           9
  In of MODEL   72
    1    H    SER  10           H        SER  10 -17.163   0.832  -3.301
    2    HA   SER  10           HA       SER  10 -17.360  -0.115  -0.628
    3    HB2  SER  10           HB2      SER  10 -18.547  -1.982  -1.756
    4    HB3  SER  10           HB3      SER  10 -17.139  -2.224  -2.777
    5    HG   SER  10           HG       SER  10 -17.392  -3.508  -0.740

  No H/Q in entry =           5
  In of MODEL   72
    1    H    SER  11           H        SER  11 -15.333   0.022   0.212
    2    HA   SER  11           HA       SER  11 -13.179   0.948  -1.318
    3    HB2  SER  11           HB2      SER  11 -12.651  -0.479   1.239
    4    HB3  SER  11           HB3      SER  11 -12.018   1.059   0.645
    5    HG   SER  11           HG       SER  11 -14.740   0.631   1.329

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ALA  12           H        ALA  12 -14.322  -1.729  -2.188
    2    HA   ALA  12           HA       ALA  12 -11.733  -2.928  -2.771
    3    HB3  ALA  12           HB1      ALA  12 -12.799  -5.248  -2.234
    4    HB1  ALA  12           HB2      ALA  12 -13.856  -4.321  -1.170
    5    HB2  ALA  12           HB3      ALA  12 -12.112  -4.289  -0.922

  No H/Q in entry =           5
  In of MODEL   72
    1    H    GLY  13           H        GLY  13 -12.479  -1.908  -4.783
    2    HA3  GLY  13           HA2      GLY  13 -14.741  -2.550  -6.245
    3    HA2  GLY  13           HA3      GLY  13 -13.190  -2.109  -6.974

  No H/Q in entry =           3
  In of MODEL   72
    1    H    MET  14           H        MET  14 -11.666  -4.393  -6.181
    2    HA   MET  14           HA       MET  14 -12.174  -6.111  -8.297
    3    HB2  MET  14           HB2      MET  14 -10.039  -6.203  -7.115
    4    HB3  MET  14           HB3      MET  14 -10.818  -6.895  -5.694
    5    HG2  MET  14           HG2      MET  14 -11.472  -8.875  -7.030
    6    HG3  MET  14           HG3      MET  14 -10.696  -8.172  -8.450
    7    HE2  MET  14           HE1      MET  14  -7.867  -6.916  -7.365
    8    HE1  MET  14           HE2      MET  14  -8.515  -7.681  -8.813
    9    HE3  MET  14           HE3      MET  14  -7.086  -8.355  -8.036

  No H/Q in entry =           9
  In of MODEL   72
    1    H    SER  15           H        SER  15 -13.236  -6.650  -4.930
    2    HA   SER  15           HA       SER  15 -14.568  -9.108  -5.580
    3    HB2  SER  15           HB2      SER  15 -14.982  -7.297  -3.186
    4    HB3  SER  15           HB3      SER  15 -15.768  -8.857  -3.411
    5    HG   SER  15           HG       SER  15 -13.908  -9.868  -3.103

  No H/Q in entry =           5
  In of MODEL   72
    1    H    THR  16           H        THR  16 -15.725  -5.746  -5.236
    2    HA   THR  16           HA       THR  16 -18.499  -6.342  -5.777
    3    HB   THR  16           HB       THR  16 -17.031  -3.721  -6.234
    4    HG1  THR  16           HG1      THR  16 -17.410  -5.103  -3.968
    5   HG23  THR  16          HG21      THR  16 -19.164  -2.712  -5.980
    6   HG22  THR  16          HG22      THR  16 -19.879  -4.199  -5.334
    7   HG21  THR  16          HG23      THR  16 -19.434  -4.087  -7.043

  No H/Q in entry =           7
  In of MODEL   72
    1    H    SER  17           H        SER  17 -15.668  -5.702  -7.626
    2    HA   SER  17           HA       SER  17 -16.823  -4.922 -10.103
    3    HB2  SER  17           HB2      SER  17 -14.176  -6.277  -9.523
    4    HB3  SER  17           HB3      SER  17 -14.641  -5.640 -11.101
    5    HG   SER  17           HG       SER  17 -13.565  -4.350  -9.051

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LEU  18           H        LEU  18 -16.189  -8.089  -8.735
    2    HA   LEU  18           HA       LEU  18 -16.759  -9.542 -11.124
    3    HB2  LEU  18           HB2      LEU  18 -15.512 -10.524  -9.248
    4    HB3  LEU  18           HB3      LEU  18 -16.942 -10.385  -8.226
    5    HG   LEU  18           HG       LEU  18 -18.145 -11.907  -9.787
    6   HD11  LEU  18          HD11      LEU  18 -15.469 -11.815 -11.135
    7   HD13  LEU  18          HD12      LEU  18 -17.081 -11.762 -11.848
    8   HD12  LEU  18          HD13      LEU  18 -16.440 -13.282 -11.228
    9   HD23  LEU  18          HD21      LEU  18 -15.609 -12.982  -8.586
   10   HD22  LEU  18          HD22      LEU  18 -17.031 -13.928  -9.034
   11   HD21  LEU  18          HD23      LEU  18 -17.141 -12.726  -7.748

  No H/Q in entry =          11
  In of MODEL   72
    1    H    LEU  19           H        LEU  19 -18.736  -8.438  -8.375
    2    HA   LEU  19           HA       LEU  19 -21.181  -9.646  -9.224
    3    HB2  LEU  19           HB2      LEU  19 -20.898  -8.854  -6.952
    4    HB3  LEU  19           HB3      LEU  19 -20.681  -7.203  -7.531
    5    HG   LEU  19           HG       LEU  19 -23.011  -7.073  -8.162
    6   HD13  LEU  19          HD11      LEU  19 -23.759  -9.137  -8.858
    7   HD12  LEU  19          HD12      LEU  19 -24.425  -9.101  -7.227
    8   HD11  LEU  19          HD13      LEU  19 -22.939  -9.990  -7.551
    9   HD21  LEU  19          HD21      LEU  19 -22.527  -8.116  -5.381
   10   HD23  LEU  19          HD22      LEU  19 -24.005  -7.304  -5.898
   11   HD22  LEU  19          HD23      LEU  19 -22.468  -6.439  -5.924

  No H/Q in entry =          11
  In of MODEL   72
    1    H    VAL  20           H        VAL  20 -19.748  -6.443  -9.849
    2    HA   VAL  20           HA       VAL  20 -21.887  -5.402 -11.382
    3    HB   VAL  20           HB       VAL  20 -18.911  -4.752 -11.499
    4   HG11  VAL  20          HG11      VAL  20 -21.244  -3.500 -12.952
    5   HG13  VAL  20          HG12      VAL  20 -19.732  -4.096 -13.635
    6   HG12  VAL  20          HG13      VAL  20 -19.740  -2.628 -12.657
    7   HG22  VAL  20          HG21      VAL  20 -19.809  -4.090  -9.424
    8   HG21  VAL  20          HG22      VAL  20 -21.275  -3.463 -10.174
    9   HG23  VAL  20          HG23      VAL  20 -19.738  -2.631 -10.413

  No H/Q in entry =           9
  In of MODEL   72
    1    H    SER  21           H        SER  21 -19.096  -7.375 -12.472
    2    HA   SER  21           HA       SER  21 -19.898  -7.211 -15.216
    3    HB2  SER  21           HB2      SER  21 -18.425  -9.138 -15.605
    4    HB3  SER  21           HB3      SER  21 -17.616  -7.904 -14.643
    5    HG   SER  21           HG       SER  21 -18.992  -9.966 -13.363

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LYS  22           H        LYS  22 -20.909  -9.478 -12.692
    2    HA   LYS  22           HA       LYS  22 -22.426 -11.082 -14.547
    3    HB2  LYS  22           HB2      LYS  22 -22.776 -10.811 -11.559
    4    HB3  LYS  22           HB3      LYS  22 -23.462 -12.072 -12.580
    5    HG2  LYS  22           HG2      LYS  22 -20.513 -11.644 -12.111
    6    HG3  LYS  22           HG3      LYS  22 -21.512 -12.833 -11.274
    7    HD2  LYS  22           HD2      LYS  22 -22.001 -13.927 -13.419
    8    HD3  LYS  22           HD3      LYS  22 -20.987 -12.743 -14.247
    9    HE2  LYS  22           HE2      LYS  22 -19.028 -13.532 -12.999
   10    HE3  LYS  22           HE3      LYS  22 -20.035 -14.698 -12.140
   11    HZ2  LYS  22           HZ1      LYS  22 -19.103 -14.734 -14.920
   12    HZ1  LYS  22           HZ2      LYS  22 -20.566 -15.506 -14.530
   13    HZ3  LYS  22           HZ3      LYS  22 -19.125 -15.982 -13.768

  No H/Q in entry =          13
  In of MODEL   72
    1    H    MET  23           H        MET  23 -23.192  -8.220 -12.604
    2    HA   MET  23           HA       MET  23 -26.001  -8.336 -13.099
    3    HB2  MET  23           HB2      MET  23 -24.192  -6.011 -12.478
    4    HB3  MET  23           HB3      MET  23 -25.941  -5.867 -12.643
    5    HG2  MET  23           HG2      MET  23 -26.299  -7.225 -10.705
    6    HG3  MET  23           HG3      MET  23 -24.582  -7.610 -10.598
    7    HE2  MET  23           HE1      MET  23 -26.936  -4.030  -9.308
    8    HE1  MET  23           HE2      MET  23 -27.181  -4.967 -10.781
    9    HE3  MET  23           HE3      MET  23 -26.171  -3.520 -10.814

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ARG  24           H        ARG  24 -23.282  -6.816 -14.860
    2    HA   ARG  24           HA       ARG  24 -24.810  -5.493 -16.818
    3    HB2  ARG  24           HB2      ARG  24 -22.373  -5.065 -16.436
    4    HB3  ARG  24           HB3      ARG  24 -22.015  -6.636 -17.107
    5    HG2  ARG  24           HG2      ARG  24 -22.916  -5.924 -19.323
    6    HG3  ARG  24           HG3      ARG  24 -23.272  -4.321 -18.627
    7    HD2  ARG  24           HD2      ARG  24 -20.828  -4.173 -17.947
    8    HD3  ARG  24           HD3      ARG  24 -20.564  -5.647 -18.869
    9    HE   ARG  24           HE       ARG  24 -20.635  -4.580 -20.829
   10   HH21  ARG  24          HH11      ARG  24 -19.522  -2.775 -21.576
   11   HH22  ARG  24          HH12      ARG  24 -19.965  -1.201 -21.012
   12   HH11  ARG  24          HH21      ARG  24 -22.086  -2.565 -18.528
   13   HH12  ARG  24          HH22      ARG  24 -21.491  -1.087 -19.217

  No H/Q in entry =          13
  In of MODEL   72
    1    H    ALA  25           H        ALA  25 -23.633  -8.818 -16.632
    2    HA   ALA  25           HA       ALA  25 -24.261  -9.593 -19.286
    3    HB1  ALA  25           HB1      ALA  25 -23.528 -11.630 -18.645
    4    HB3  ALA  25           HB2      ALA  25 -24.579 -11.662 -17.229
    5    HB2  ALA  25           HB3      ALA  25 -23.037 -10.811 -17.162

  No H/Q in entry =           5
  In of MODEL   72
    1    H    GLN  26           H        GLN  26 -26.072  -9.737 -16.256
    2    HA   GLN  26           HA       GLN  26 -28.401 -10.951 -17.292
    3    HB2  GLN  26           HB2      GLN  26 -27.904  -9.257 -14.864
    4    HB3  GLN  26           HB3      GLN  26 -29.457  -9.996 -15.225
    5    HG2  GLN  26           HG2      GLN  26 -26.846 -11.422 -14.806
    6    HG3  GLN  26           HG3      GLN  26 -28.203 -11.370 -13.687
    7   HE21  GLN  26          HE21      GLN  26 -26.957 -13.482 -15.023
    8   HE22  GLN  26          HE22      GLN  26 -27.987 -14.524 -15.842

  No H/Q in entry =           8
  In of MODEL   72
    1    H    ALA  27           H        ALA  27 -27.518  -7.550 -16.818
    2    HA   ALA  27           HA       ALA  27 -30.028  -6.477 -17.562
    3    HB1  ALA  27           HB1      ALA  27 -28.234  -5.163 -16.422
    4    HB3  ALA  27           HB2      ALA  27 -28.844  -4.368 -17.875
    5    HB2  ALA  27           HB3      ALA  27 -27.295  -5.211 -17.915

  No H/Q in entry =           5
  In of MODEL   72
    1    H    GLU  28           H        GLU  28 -27.318  -7.609 -19.475
    2    HA   GLU  28           HA       GLU  28 -28.281  -6.519 -21.962
    3    HB2  GLU  28           HB2      GLU  28 -25.889  -7.181 -21.366
    4    HB3  GLU  28           HB3      GLU  28 -26.409  -8.848 -21.609
    5    HG2  GLU  28           HG2      GLU  28 -25.284  -8.002 -23.562
    6    HG3  GLU  28           HG3      GLU  28 -26.979  -8.343 -23.911

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LYS  29           H        LYS  29 -28.391  -9.669 -20.386
    2    HA   LYS  29           HA       LYS  29 -29.681 -11.107 -22.423
    3    HB2  LYS  29           HB2      LYS  29 -28.606 -12.126 -20.450
    4    HB3  LYS  29           HB3      LYS  29 -29.884 -11.465 -19.431
    5    HG2  LYS  29           HG2      LYS  29 -31.528 -12.836 -20.527
    6    HG3  LYS  29           HG3      LYS  29 -30.324 -13.422 -21.673
    7    HD2  LYS  29           HD2      LYS  29 -29.156 -14.615 -19.976
    8    HD3  LYS  29           HD3      LYS  29 -30.070 -13.822 -18.695
    9    HE2  LYS  29           HE2      LYS  29 -30.788 -16.172 -19.115
   10    HE3  LYS  29           HE3      LYS  29 -32.085 -14.994 -19.322
   11    HZ1  LYS  29           HZ1      LYS  29 -31.530 -15.055 -21.754
   12    HZ3  LYS  29           HZ2      LYS  29 -32.224 -16.471 -21.123
   13    HZ2  LYS  29           HZ3      LYS  29 -30.557 -16.407 -21.428

  No H/Q in entry =          13
  In of MODEL   72
    1    H    TYR  30           H        TYR  30 -31.093  -9.091 -19.857
    2    HA   TYR  30           HA       TYR  30 -33.754  -9.549 -21.099
    3    HB2  TYR  30           HB2      TYR  30 -33.106  -8.457 -18.352
    4    HB3  TYR  30           HB3      TYR  30 -34.723  -8.723 -19.004
    5    HD1  TYR  30           HD1      TYR  30 -35.598 -11.022 -19.274
    6    HD2  TYR  30           HD2      TYR  30 -31.766 -10.285 -17.569
    7    HE1  TYR  30           HE1      TYR  30 -35.468 -13.369 -18.539
    8    HE2  TYR  30           HE2      TYR  30 -31.638 -12.617 -16.838
    9    HH   TYR  30           HH       TYR  30 -33.246 -14.974 -17.985

  No H/Q in entry =           9
  In of MODEL   72
    1    H    GLU  31           H        GLU  31 -31.624  -7.502 -21.856
    2    HA   GLU  31           HA       GLU  31 -31.589  -5.324 -22.622
    3    HB2  GLU  31           HB2      GLU  31 -34.474  -6.072 -23.140
    4    HB3  GLU  31           HB3      GLU  31 -33.659  -4.672 -23.836
    5    HG2  GLU  31           HG2      GLU  31 -32.170  -6.054 -25.072
    6    HG3  GLU  31           HG3      GLU  31 -32.707  -7.500 -24.220

  No H/Q in entry =           6
  In of MODEL   72
    1    H    VAL  32           H        VAL  32 -31.776  -5.298 -19.887
    2    HA   VAL  32           HA       VAL  32 -33.669  -3.234 -19.164
    3    HB   VAL  32           HB       VAL  32 -31.253  -4.229 -17.620
    4   HG12  VAL  32          HG11      VAL  32 -32.793  -3.481 -15.697
    5   HG11  VAL  32          HG12      VAL  32 -33.648  -2.558 -16.933
    6   HG13  VAL  32          HG13      VAL  32 -31.944  -2.235 -16.612
    7   HG21  VAL  32          HG21      VAL  32 -32.996  -5.960 -18.347
    8   HG23  VAL  32          HG22      VAL  32 -34.043  -5.181 -17.160
    9   HG22  VAL  32          HG23      VAL  32 -32.512  -5.893 -16.651

  No H/Q in entry =           9
  In of MODEL   72
    1    HA   PRO  33           HA       PRO  33 -30.695  -0.211 -20.772
    2    HB2  PRO  33           HB2      PRO  33 -32.244   1.981 -20.583
    3    HB3  PRO  33           HB3      PRO  33 -32.695   0.701 -21.708
    4    HG2  PRO  33           HG2      PRO  33 -33.659   1.125 -18.879
    5    HG3  PRO  33           HG3      PRO  33 -34.626   0.939 -20.342
    6    HD2  PRO  33           HD2      PRO  33 -34.126  -1.169 -18.734
    7    HD3  PRO  33           HD3      PRO  33 -34.193  -1.365 -20.485

  No H/Q in entry =           7
  In of MODEL   72
    1    H    VAL  34           H        VAL  34 -29.413  -0.786 -18.844
    2    HA   VAL  34           HA       VAL  34 -29.163   1.600 -17.134
    3    HB   VAL  34           HB       VAL  34 -28.547   0.097 -15.238
    4   HG12  VAL  34          HG11      VAL  34 -30.942  -0.825 -14.944
    5   HG11  VAL  34          HG12      VAL  34 -31.279  -0.029 -16.480
    6   HG13  VAL  34          HG13      VAL  34 -30.737   0.920 -15.095
    7   HG21  VAL  34          HG21      VAL  34 -28.707  -1.878 -17.299
    8   HG23  VAL  34          HG22      VAL  34 -29.751  -2.294 -15.939
    9   HG22  VAL  34          HG23      VAL  34 -28.036  -1.984 -15.671

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ILE  35           H        ILE  35 -27.190   2.048 -16.291
    2    HA   ILE  35           HA       ILE  35 -24.868   0.793 -17.599
    3    HB   ILE  35           HB       ILE  35 -25.316   3.653 -16.710
    4   HG12  ILE  35          HG12      ILE  35 -24.323   2.432 -19.293
    5   HG13  ILE  35          HG13      ILE  35 -25.963   3.017 -19.009
    6   HG21  ILE  35          HG21      ILE  35 -22.729   2.175 -17.071
    7   HG23  ILE  35          HG22      ILE  35 -23.198   3.313 -15.809
    8   HG22  ILE  35          HG23      ILE  35 -22.833   3.898 -17.433
    9   HD11  ILE  35          HD11      ILE  35 -24.598   5.219 -18.356
   10   HD13  ILE  35          HD12      ILE  35 -25.136   4.871 -20.000
   11   HD12  ILE  35          HD13      ILE  35 -23.476   4.518 -19.521

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ILE  36           H        ILE  36 -23.613  -0.250 -16.034
    2    HA   ILE  36           HA       ILE  36 -24.049   0.279 -13.146
    3    HB   ILE  36           HB       ILE  36 -23.179  -2.377 -14.331
    4   HG12  ILE  36          HG12      ILE  36 -25.996  -1.643 -13.532
    5   HG13  ILE  36          HG13      ILE  36 -25.434  -1.568 -15.202
    6   HG23  ILE  36          HG21      ILE  36 -23.504  -3.268 -12.239
    7   HG22  ILE  36          HG22      ILE  36 -24.652  -2.018 -11.760
    8   HG21  ILE  36          HG23      ILE  36 -22.928  -1.652 -11.829
    9   HD13  ILE  36          HD11      ILE  36 -25.560  -3.778 -15.466
   10   HD12  ILE  36          HD12      ILE  36 -26.621  -3.713 -14.060
   11   HD11  ILE  36          HD13      ILE  36 -24.914  -4.108 -13.860

  No H/Q in entry =          11
  In of MODEL   72
    1    H    GLU  37           H        GLU  37 -22.274   0.912 -12.033
    2    HA   GLU  37           HA       GLU  37 -19.574   0.189 -12.983
    3    HB2  GLU  37           HB2      GLU  37 -20.515   2.943 -12.199
    4    HB3  GLU  37           HB3      GLU  37 -18.821   2.483 -12.362
    5    HG2  GLU  37           HG2      GLU  37 -19.117   2.106 -14.723
    6    HG3  GLU  37           HG3      GLU  37 -20.838   2.461 -14.587

  No H/Q in entry =           6
  In of MODEL   72
    1    H    ALA  38           H        ALA  38 -18.075  -0.066 -11.314
    2    HA   ALA  38           HA       ALA  38 -19.095   0.019  -8.534
    3    HB1  ALA  38           HB1      ALA  38 -17.353  -1.848 -10.020
    4    HB3  ALA  38           HB2      ALA  38 -18.390  -2.141  -8.625
    5    HB2  ALA  38           HB3      ALA  38 -16.790  -1.435  -8.401

  No H/Q in entry =           5
  In of MODEL   72
    1    H    PHE  39           H        PHE  39 -17.870   1.213  -7.035
    2    HA   PHE  39           HA       PHE  39 -15.373   2.486  -7.910
    3    HB2  PHE  39           HB2      PHE  39 -17.800   3.905  -6.823
    4    HB3  PHE  39           HB3      PHE  39 -16.181   4.602  -6.764
    5    HD1  PHE  39           HD1      PHE  39 -14.925   4.727  -9.031
    6    HD2  PHE  39           HD2      PHE  39 -19.150   4.321  -8.630
    7    HE1  PHE  39           HE1      PHE  39 -15.218   5.639 -11.317
    8    HE2  PHE  39           HE2      PHE  39 -19.459   5.221 -10.908
    9    HZ   PHE  39           HZ       PHE  39 -17.497   5.854 -12.271

  No H/Q in entry =           9
  In of MODEL   72
    1    HA   PRO  40           HA       PRO  40 -14.397   1.637  -3.650
    2    HB2  PRO  40           HB2      PRO  40 -12.669   3.670  -2.999
    3    HB3  PRO  40           HB3      PRO  40 -12.203   2.377  -4.103
    4    HG2  PRO  40           HG2      PRO  40 -13.284   5.109  -4.772
    5    HG3  PRO  40           HG3      PRO  40 -11.846   4.311  -5.408
    6    HD2  PRO  40           HD2      PRO  40 -14.074   4.220  -6.806
    7    HD3  PRO  40           HD3      PRO  40 -13.090   2.764  -6.661

  No H/Q in entry =           7
  In of MODEL   72
    1    H    GLU  41           H        GLU  41 -15.028   2.545  -1.492
    2    HA   GLU  41           HA       GLU  41 -17.306   4.200  -1.419
    3    HB2  GLU  41           HB2      GLU  41 -17.237   3.963   0.907
    4    HB3  GLU  41           HB3      GLU  41 -16.491   2.482   0.306
    5    HG2  GLU  41           HG2      GLU  41 -15.077   3.024   2.025
    6    HG3  GLU  41           HG3      GLU  41 -14.263   3.786   0.659

  No H/Q in entry =           6
  In of MODEL   72
    1    H    THR  42           H        THR  42 -13.996   5.187  -1.462
    2    HA   THR  42           HA       THR  42 -14.395   7.706  -0.180
    3    HB   THR  42           HB       THR  42 -12.256   8.354  -1.262
    4    HG1  THR  42           HG1      THR  42 -12.934   6.833  -3.133
    5   HG23  THR  42          HG21      THR  42 -10.909   6.888  -0.021
    6   HG22  THR  42          HG22      THR  42 -11.968   5.510  -0.329
    7   HG21  THR  42          HG23      THR  42 -12.471   6.774   0.791

  No H/Q in entry =           7
  In of MODEL   72
    1    H    LEU  43           H        LEU  43 -15.293   6.676  -3.304
    2    HA   LEU  43           HA       LEU  43 -15.609   9.467  -4.199
    3    HB2  LEU  43           HB2      LEU  43 -15.939   6.857  -5.667
    4    HB3  LEU  43           HB3      LEU  43 -16.158   8.456  -6.375
    5    HG   LEU  43           HG       LEU  43 -13.544   7.328  -5.400
    6   HD11  LEU  43          HD11      LEU  43 -14.741   6.426  -7.561
    7   HD13  LEU  43          HD12      LEU  43 -13.020   6.804  -7.578
    8   HD12  LEU  43          HD13      LEU  43 -14.180   7.950  -8.247
    9   HD22  LEU  43          HD21      LEU  43 -13.379   9.653  -5.191
   10   HD21  LEU  43          HD22      LEU  43 -14.384   9.947  -6.612
   11   HD23  LEU  43          HD23      LEU  43 -12.739   9.344  -6.806

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ALA  44           H        ALA  44 -17.506   7.553  -2.386
    2    HA   ALA  44           HA       ALA  44 -19.987   7.396  -3.700
    3    HB2  ALA  44           HB1      ALA  44 -19.814   6.228  -1.635
    4    HB3  ALA  44           HB2      ALA  44 -20.948   7.541  -1.322
    5    HB1  ALA  44           HB3      ALA  44 -19.277   7.670  -0.775

  No H/Q in entry =           5
  In of MODEL   72
    1    H    GLY  45           H        GLY  45 -18.618  10.184  -2.101
    2    HA3  GLY  45           HA2      GLY  45 -21.088  11.641  -2.410
    3    HA2  GLY  45           HA3      GLY  45 -19.554  12.283  -1.823

  No H/Q in entry =           3
  In of MODEL   72
    1    H    GLU  46           H        GLU  46 -18.015  11.440  -4.145
    2    HA   GLU  46           HA       GLU  46 -18.708  13.688  -5.852
    3    HB2  GLU  46           HB2      GLU  46 -16.479  11.649  -5.995
    4    HB3  GLU  46           HB3      GLU  46 -16.632  13.054  -7.050
    5    HG2  GLU  46           HG2      GLU  46 -16.333  13.213  -4.061
    6    HG3  GLU  46           HG3      GLU  46 -14.989  13.314  -5.198

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LYS  47           H        LYS  47 -18.517  10.185  -6.381
    2    HA   LYS  47           HA       LYS  47 -19.634  10.452  -9.045
    3    HB2  LYS  47           HB2      LYS  47 -18.411   8.334  -7.427
    4    HB3  LYS  47           HB3      LYS  47 -19.778   7.786  -8.397
    5    HG2  LYS  47           HG2      LYS  47 -17.736   7.447  -9.610
    6    HG3  LYS  47           HG3      LYS  47 -18.685   8.707 -10.397
    7    HD2  LYS  47           HD2      LYS  47 -17.337  10.418  -9.273
    8    HD3  LYS  47           HD3      LYS  47 -16.377   9.151  -8.510
    9    HE2  LYS  47           HE2      LYS  47 -16.648   9.520 -11.485
   10    HE3  LYS  47           HE3      LYS  47 -15.313  10.148 -10.520
   11    HZ1  LYS  47           HZ1      LYS  47 -15.858   7.362 -10.089
   12    HZ3  LYS  47           HZ2      LYS  47 -14.383   8.153 -10.375
   13    HZ2  LYS  47           HZ3      LYS  47 -15.384   7.724 -11.680

  No H/Q in entry =          13
  In of MODEL   72
    1    H    GLY  48           H        GLY  48 -20.924   9.585  -5.911
    2    HA3  GLY  48           HA2      GLY  48 -23.287   8.368  -6.672
    3    HA2  GLY  48           HA3      GLY  48 -23.075   9.328  -5.208

  No H/Q in entry =           3
  In of MODEL   72
    1    H    GLN  49           H        GLN  49 -22.551  11.804  -6.718
    2    HA   GLN  49           HA       GLN  49 -25.134  12.864  -6.821
    3    HB2  GLN  49           HB2      GLN  49 -22.616  13.818  -8.169
    4    HB3  GLN  49           HB3      GLN  49 -24.098  14.749  -8.053
    5    HG2  GLN  49           HG2      GLN  49 -23.926  14.712  -5.617
    6    HG3  GLN  49           HG3      GLN  49 -22.457  13.759  -5.733
    7   HE21  GLN  49          HE21      GLN  49 -22.380  15.955  -4.402
    8   HE22  GLN  49          HE22      GLN  49 -21.487  17.247  -5.020

  No H/Q in entry =           8
  In of MODEL   72
    1    H    ASN  50           H        ASN  50 -23.429  11.084  -9.265
    2    HA   ASN  50           HA       ASN  50 -25.341  11.972 -11.313
    3    HB2  ASN  50           HB2      ASN  50 -22.731  10.492 -11.600
    4    HB3  ASN  50           HB3      ASN  50 -23.796  10.932 -12.927
    5   HD21  ASN  50          HD21      ASN  50 -21.170  11.789 -11.307
    6   HD22  ASN  50          HD22      ASN  50 -20.972  13.437 -11.606

  No H/Q in entry =           6
  In of MODEL   72
    1    H    ALA  51           H        ALA  51 -25.266   9.558  -9.131
    2    HA   ALA  51           HA       ALA  51 -26.016   7.445 -11.009
    3    HB2  ALA  51           HB1      ALA  51 -25.395   6.065  -9.362
    4    HB3  ALA  51           HB2      ALA  51 -26.529   6.821  -8.243
    5    HB1  ALA  51           HB3      ALA  51 -24.904   7.481  -8.432

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ASP  52           H        ASP  52 -27.998   6.347 -10.888
    2    HA   ASP  52           HA       ASP  52 -30.212   8.117 -10.165
    3    HB2  ASP  52           HB2      ASP  52 -29.980   5.661 -11.901
    4    HB3  ASP  52           HB3      ASP  52 -31.536   6.351 -11.440

  No H/Q in entry =           4
  In of MODEL   72
    1    H    VAL  53           H        VAL  53 -28.549   5.235  -9.233
    2    HA   VAL  53           HA       VAL  53 -29.978   5.267  -6.707
    3    HB   VAL  53           HB       VAL  53 -31.351   3.631  -7.987
    4   HG11  VAL  53          HG11      VAL  53 -29.595   2.846  -9.540
    5   HG13  VAL  53          HG12      VAL  53 -30.398   1.513  -8.711
    6   HG12  VAL  53          HG13      VAL  53 -28.795   2.034  -8.196
    7   HG23  VAL  53          HG21      VAL  53 -30.482   1.626  -6.352
    8   HG22  VAL  53          HG22      VAL  53 -31.634   2.898  -5.946
    9   HG21  VAL  53          HG23      VAL  53 -29.929   3.094  -5.542

  No H/Q in entry =           9
  In of MODEL   72
    1    H    VAL  54           H        VAL  54 -28.648   4.816  -5.070
    2    HA   VAL  54           HA       VAL  54 -25.875   4.038  -5.718
    3    HB   VAL  54           HB       VAL  54 -26.968   5.735  -3.416
    4   HG11  VAL  54          HG11      VAL  54 -24.364   4.374  -3.757
    5   HG13  VAL  54          HG12      VAL  54 -25.123   5.000  -2.294
    6   HG12  VAL  54          HG13      VAL  54 -24.243   6.090  -3.366
    7   HG22  VAL  54          HG21      VAL  54 -26.150   7.594  -4.472
    8   HG21  VAL  54          HG22      VAL  54 -26.686   6.629  -5.847
    9   HG23  VAL  54          HG23      VAL  54 -24.977   6.676  -5.416

  No H/Q in entry =           9
  In of MODEL   72
    1    H    LEU  55           H        LEU  55 -25.243   2.112  -5.128
    2    HA   LEU  55           HA       LEU  55 -26.715   0.716  -2.981
    3    HB2  LEU  55           HB2      LEU  55 -25.148  -0.362  -5.314
    4    HB3  LEU  55           HB3      LEU  55 -25.883  -1.344  -4.047
    5    HG   LEU  55           HG       LEU  55 -27.362   0.270  -6.114
    6   HD13  LEU  55          HD11      LEU  55 -27.033  -1.543  -7.384
    7   HD12  LEU  55          HD12      LEU  55 -27.968  -2.467  -6.208
    8   HD11  LEU  55          HD13      LEU  55 -26.213  -2.373  -6.064
    9   HD23  LEU  55          HD21      LEU  55 -28.609  -1.748  -4.306
   10   HD22  LEU  55          HD22      LEU  55 -29.335  -0.357  -5.112
   11   HD21  LEU  55          HD23      LEU  55 -28.313  -0.119  -3.696

  No H/Q in entry =          11
  In of MODEL   72
    1    H    LEU  56           H        LEU  56 -25.542   0.096  -1.198
    2    HA   LEU  56           HA       LEU  56 -22.616   0.548  -1.251
    3    HB2  LEU  56           HB2      LEU  56 -24.402   0.241   1.150
    4    HB3  LEU  56           HB3      LEU  56 -22.701   0.702   1.142
    5    HG   LEU  56           HG       LEU  56 -25.036   2.362   0.234
    6   HD11  LEU  56          HD11      LEU  56 -23.901   1.935   2.738
    7   HD13  LEU  56          HD12      LEU  56 -24.919   3.298   2.272
    8   HD12  LEU  56          HD13      LEU  56 -23.165   3.438   2.180
    9   HD23  LEU  56          HD21      LEU  56 -23.125   4.101   0.076
   10   HD22  LEU  56          HD22      LEU  56 -23.494   3.033  -1.279
   11   HD21  LEU  56          HD23      LEU  56 -22.129   2.677  -0.222

  No H/Q in entry =          11
  In of MODEL   72
    1    H    GLY  57           H        GLY  57 -21.203  -1.069  -0.767
    2    HA3  GLY  57           HA2      GLY  57 -22.077  -3.767  -1.030
    3    HA2  GLY  57           HA3      GLY  57 -20.461  -3.254  -0.547

  No H/Q in entry =           3
  In of MODEL   72
    1    HA   PRO  58           HA       PRO  58 -23.231  -4.442   3.149
    2    HB2  PRO  58           HB2      PRO  58 -22.495  -7.048   3.683
    3    HB3  PRO  58           HB3      PRO  58 -23.891  -6.641   2.688
    4    HG2  PRO  58           HG2      PRO  58 -21.153  -7.449   1.866
    5    HG3  PRO  58           HG3      PRO  58 -22.712  -7.920   1.190
    6    HD2  PRO  58           HD2      PRO  58 -21.143  -6.042   0.008
    7    HD3  PRO  58           HD3      PRO  58 -22.904  -5.986  -0.084

  No H/Q in entry =           7
  In of MODEL   72
    1    H    GLN  59           H        GLN  59 -19.854  -4.836   2.514
    2    HA   GLN  59           HA       GLN  59 -19.085  -4.913   5.269
    3    HB2  GLN  59           HB2      GLN  59 -17.733  -5.150   2.872
    4    HB3  GLN  59           HB3      GLN  59 -17.189  -3.599   3.477
    5    HG2  GLN  59           HG2      GLN  59 -15.719  -5.464   4.122
    6    HG3  GLN  59           HG3      GLN  59 -16.389  -4.616   5.506
    7   HE21  GLN  59          HE21      GLN  59 -16.371  -6.147   6.773
    8   HE22  GLN  59          HE22      GLN  59 -17.110  -7.616   7.026

  No H/Q in entry =           8
  In of MODEL   72
    1    H    ILE  60           H        ILE  60 -20.077  -2.322   3.133
    2    HA   ILE  60           HA       ILE  60 -19.250  -0.403   5.226
    3    HB   ILE  60           HB       ILE  60 -19.524   1.369   3.447
    4   HG12  ILE  60          HG12      ILE  60 -19.288  -0.789   1.396
    5   HG13  ILE  60          HG13      ILE  60 -20.886  -0.322   1.978
    6   HG21  ILE  60          HG21      ILE  60 -17.367   0.220   4.148
    7   HG23  ILE  60          HG22      ILE  60 -17.371   1.132   2.639
    8   HG22  ILE  60          HG23      ILE  60 -17.474  -0.628   2.606
    9   HD12  ILE  60          HD11      ILE  60 -18.908   1.275   0.388
   10   HD11  ILE  60          HD12      ILE  60 -20.080   2.105   1.410
   11   HD13  ILE  60          HD13      ILE  60 -20.635   1.045   0.114

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ALA  61           H        ALA  61 -21.675  -2.035   5.264
    2    HA   ALA  61           HA       ALA  61 -23.934  -0.401   4.860
    3    HB1  ALA  61           HB1      ALA  61 -25.115  -1.946   6.152
    4    HB2  ALA  61           HB2      ALA  61 -23.705  -2.336   7.138
    5    HB3  ALA  61           HB3      ALA  61 -23.798  -2.900   5.470

  No H/Q in entry =           5
  In of MODEL   72
    1    H    TYR  62           H        TYR  62 -21.710  -0.545   7.644
    2    HA   TYR  62           HA       TYR  62 -23.286   1.039   9.365
    3    HB2  TYR  62           HB2      TYR  62 -21.260   1.452  10.611
    4    HB3  TYR  62           HB3      TYR  62 -21.263  -0.226  10.072
    5    HD1  TYR  62           HD1      TYR  62 -19.639  -1.014   8.410
    6    HD2  TYR  62           HD2      TYR  62 -19.618   3.055   9.717
    7    HE1  TYR  62           HE1      TYR  62 -17.436  -0.690   7.353
    8    HE2  TYR  62           HE2      TYR  62 -17.399   3.373   8.661
    9    HH   TYR  62           HH       TYR  62 -16.087   1.057   6.516

  No H/Q in entry =           9
  In of MODEL   72
    1    H    MET  63           H        MET  63 -21.674   2.002   6.524
    2    HA   MET  63           HA       MET  63 -21.554   4.818   7.291
    3    HB2  MET  63           HB2      MET  63 -20.934   3.374   4.714
    4    HB3  MET  63           HB3      MET  63 -20.771   5.117   4.940
    5    HG2  MET  63           HG2      MET  63 -19.047   4.751   6.608
    6    HG3  MET  63           HG3      MET  63 -19.224   3.006   6.422
    7    HE2  MET  63           HE1      MET  63 -17.335   5.946   3.516
    8    HE1  MET  63           HE2      MET  63 -18.100   6.269   5.072
    9    HE3  MET  63           HE3      MET  63 -19.096   5.974   3.645

  No H/Q in entry =           9
  In of MODEL   72
    1    H    LEU  64           H        LEU  64 -24.090   2.944   6.291
    2    HA   LEU  64           HA       LEU  64 -25.336   4.395   4.256
    3    HB2  LEU  64           HB2      LEU  64 -26.163   2.251   5.123
    4    HB3  LEU  64           HB3      LEU  64 -26.626   3.046   6.627
    5    HG   LEU  64           HG       LEU  64 -28.349   4.303   5.441
    6   HD13  LEU  64          HD11      LEU  64 -28.083   4.606   3.214
    7   HD12  LEU  64          HD12      LEU  64 -28.701   2.964   3.029
    8   HD11  LEU  64          HD13      LEU  64 -26.962   3.253   3.085
    9   HD23  LEU  64          HD21      LEU  64 -28.823   1.501   4.622
   10   HD22  LEU  64          HD22      LEU  64 -29.825   2.594   5.577
   11   HD21  LEU  64          HD23      LEU  64 -28.433   1.805   6.315

  No H/Q in entry =          11
  In of MODEL   72
    1    HA   PRO  65           HA       PRO  65 -27.554   7.438   7.101
    2    HB2  PRO  65           HB2      PRO  65 -25.544   7.572   9.348
    3    HB3  PRO  65           HB3      PRO  65 -27.287   7.822   9.410
    4    HG2  PRO  65           HG2      PRO  65 -26.315   5.559  10.273
    5    HG3  PRO  65           HG3      PRO  65 -27.740   5.531   9.234
    6    HD2  PRO  65           HD2      PRO  65 -24.862   4.983   8.500
    7    HD3  PRO  65           HD3      PRO  65 -26.307   4.084   8.038

  No H/Q in entry =           7
  In of MODEL   72
    1    H    GLU  66           H        GLU  66 -23.997   7.439   7.154
    2    HA   GLU  66           HA       GLU  66 -23.748  10.252   6.821
    3    HB2  GLU  66           HB2      GLU  66 -21.901   7.993   6.099
    4    HB3  GLU  66           HB3      GLU  66 -21.481   9.697   5.934
    5    HG2  GLU  66           HG2      GLU  66 -21.685  10.003   8.311
    6    HG3  GLU  66           HG3      GLU  66 -22.182   8.321   8.501

  No H/Q in entry =           6
  In of MODEL   72
    1    H    ILE  67           H        ILE  67 -23.819   7.565   4.497
    2    HA   ILE  67           HA       ILE  67 -23.443   9.339   2.248
    3    HB   ILE  67           HB       ILE  67 -24.295   6.415   2.356
    4   HG12  ILE  67          HG12      ILE  67 -21.688   7.649   1.451
    5   HG13  ILE  67          HG13      ILE  67 -21.967   7.182   3.127
    6   HG21  ILE  67          HG21      ILE  67 -24.280   8.351   0.181
    7   HG23  ILE  67          HG22      ILE  67 -24.879   6.693   0.192
    8   HG22  ILE  67          HG23      ILE  67 -23.177   7.012  -0.138
    9   HD12  ILE  67          HD11      ILE  67 -21.533   5.479   0.729
   10   HD11  ILE  67          HD12      ILE  67 -22.531   4.856   2.042
   11   HD13  ILE  67          HD13      ILE  67 -20.864   5.339   2.355

  No H/Q in entry =          11
  In of MODEL   72
    1    H    GLN  68           H        GLN  68 -26.287   8.198   3.869
    2    HA   GLN  68           HA       GLN  68 -28.142   9.152   1.930
    3    HB2  GLN  68           HB2      GLN  68 -28.374   8.713   4.904
    4    HB3  GLN  68           HB3      GLN  68 -29.709   9.314   3.933
    5    HG2  GLN  68           HG2      GLN  68 -29.714   7.317   2.605
    6    HG3  GLN  68           HG3      GLN  68 -28.252   6.742   3.384
    7   HE21  GLN  68          HE21      GLN  68 -30.410   5.356   3.226
    8   HE22  GLN  68          HE22      GLN  68 -31.225   4.852   4.633

  No H/Q in entry =           8
  In of MODEL   72
    1    H    ARG  69           H        ARG  69 -26.544  10.770   4.701
    2    HA   ARG  69           HA       ARG  69 -27.945  13.242   4.368
    3    HB2  ARG  69           HB2      ARG  69 -25.579  12.305   5.918
    4    HB3  ARG  69           HB3      ARG  69 -25.684  14.032   5.606
    5    HG2  ARG  69           HG2      ARG  69 -27.995  14.017   6.591
    6    HG3  ARG  69           HG3      ARG  69 -27.760  12.318   7.019
    7    HD2  ARG  69           HD2      ARG  69 -26.095  14.672   7.985
    8    HD3  ARG  69           HD3      ARG  69 -27.205  13.725   8.962
    9    HE   ARG  69           HE       ARG  69 -24.587  12.854   7.973
   10   HH21  ARG  69          HH11      ARG  69 -23.747  11.072   9.118
   11   HH22  ARG  69          HH12      ARG  69 -24.757  10.212  10.231
   12   HH11  ARG  69          HH21      ARG  69 -27.526  12.222   9.672
   13   HH12  ARG  69          HH22      ARG  69 -26.897  10.861  10.542

  No H/Q in entry =          13
  In of MODEL   72
    1    H    LEU  70           H        LEU  70 -25.064  11.912   2.954
    2    HA   LEU  70           HA       LEU  70 -23.990  14.321   1.843
    3    HB2  LEU  70           HB2      LEU  70 -22.961  12.003   2.371
    4    HB3  LEU  70           HB3      LEU  70 -23.580  11.571   0.778
    5    HG   LEU  70           HG       LEU  70 -22.010  12.992  -0.280
    6   HD11  LEU  70          HD11      LEU  70 -21.182  13.773   2.523
    7   HD13  LEU  70          HD12      LEU  70 -21.900  14.830   1.307
    8   HD12  LEU  70          HD13      LEU  70 -20.280  14.177   1.061
    9   HD22  LEU  70          HD21      LEU  70 -20.554  11.289  -0.101
   10   HD21  LEU  70          HD22      LEU  70 -21.465  10.718   1.297
   11   HD23  LEU  70          HD23      LEU  70 -20.092  11.803   1.521

  No H/Q in entry =          11
  In of MODEL   72
    1    H    LEU  71           H        LEU  71 -26.117  11.781   0.674
    2    HA   LEU  71           HA       LEU  71 -26.677  13.327  -1.799
    3    HB2  LEU  71           HB2      LEU  71 -26.843  10.330  -1.431
    4    HB3  LEU  71           HB3      LEU  71 -26.992  11.229  -2.940
    5    HG   LEU  71           HG       LEU  71 -24.461  11.229  -1.294
    6   HD12  LEU  71          HD11      LEU  71 -24.510   9.665  -3.768
    7   HD11  LEU  71          HD12      LEU  71 -25.504   8.996  -2.476
    8   HD13  LEU  71          HD13      LEU  71 -23.786   9.289  -2.205
    9   HD22  LEU  71          HD21      LEU  71 -24.594  13.082  -2.739
   10   HD21  LEU  71          HD22      LEU  71 -25.089  12.070  -4.095
   11   HD23  LEU  71          HD23      LEU  71 -23.462  11.925  -3.431

  No H/Q in entry =          11
  In of MODEL   72
    1    HA   PRO  72           HA       PRO  72 -30.521  12.765   0.833
    2    HB2  PRO  72           HB2      PRO  72 -31.406  15.317   0.824
    3    HB3  PRO  72           HB3      PRO  72 -30.086  14.852   1.895
    4    HG2  PRO  72           HG2      PRO  72 -29.930  16.120  -0.827
    5    HG3  PRO  72           HG3      PRO  72 -29.161  16.640   0.671
    6    HD2  PRO  72           HD2      PRO  72 -27.817  15.144  -1.143
    7    HD3  PRO  72           HD3      PRO  72 -27.550  14.934   0.586

  No H/Q in entry =           7
  In of MODEL   72
    1    H    ASN  73           H        ASN  73 -29.928  13.810  -2.359
    2    HA   ASN  73           HA       ASN  73 -32.788  13.488  -2.983
    3    HB2  ASN  73           HB2      ASN  73 -32.348  14.655  -5.053
    4    HB3  ASN  73           HB3      ASN  73 -31.826  15.604  -3.669
    5   HD21  ASN  73          HD21      ASN  73 -31.048  15.727  -6.349
    6   HD22  ASN  73          HD22      ASN  73 -29.380  15.589  -6.556

  No H/Q in entry =           6
  In of MODEL   72
    1    H    LYS  74           H        LYS  74 -30.783  11.243  -2.629
    2    HA   LYS  74           HA       LYS  74 -31.352   9.910  -5.210
    3    HB2  LYS  74           HB2      LYS  74 -28.807   9.601  -3.613
    4    HB3  LYS  74           HB3      LYS  74 -29.192   8.824  -5.149
    5    HG2  LYS  74           HG2      LYS  74 -28.954  11.790  -4.870
    6    HG3  LYS  74           HG3      LYS  74 -27.573  10.750  -5.211
    7    HD2  LYS  74           HD2      LYS  74 -28.693   9.862  -7.171
    8    HD3  LYS  74           HD3      LYS  74 -30.119  10.838  -6.816
    9    HE2  LYS  74           HE2      LYS  74 -28.915  12.867  -7.212
   10    HE3  LYS  74           HE3      LYS  74 -27.387  11.993  -7.337
   11    HZ2  LYS  74           HZ1      LYS  74 -28.877  12.638  -9.437
   12    HZ1  LYS  74           HZ2      LYS  74 -29.515  11.099  -9.100
   13    HZ3  LYS  74           HZ3      LYS  74 -27.853  11.283  -9.403

  No H/Q in entry =          13
  In of MODEL   72
    1    HA   PRO  75           HA       PRO  75 -32.700   6.835  -2.310
    2    HB2  PRO  75           HB2      PRO  75 -33.001   4.656  -3.948
    3    HB3  PRO  75           HB3      PRO  75 -34.139   6.002  -3.975
    4    HG2  PRO  75           HG2      PRO  75 -31.807   5.473  -5.774
    5    HG3  PRO  75           HG3      PRO  75 -33.462   5.907  -6.201
    6    HD2  PRO  75           HD2      PRO  75 -31.537   7.788  -6.120
    7    HD3  PRO  75           HD3      PRO  75 -33.169   8.158  -5.562

  No H/Q in entry =           7
  In of MODEL   72
    1    H    VAL  76           H        VAL  76 -31.230   5.757  -0.973
    2    HA   VAL  76           HA       VAL  76 -28.762   4.599  -2.127
    3    HB   VAL  76           HB       VAL  76 -29.046   5.993   0.570
    4   HG11  VAL  76          HG11      VAL  76 -26.687   4.763  -0.869
    5   HG13  VAL  76          HG12      VAL  76 -27.369   4.267   0.681
    6   HG12  VAL  76          HG13      VAL  76 -26.538   5.815   0.540
    7   HG22  VAL  76          HG21      VAL  76 -28.400   7.922  -0.271
    8   HG21  VAL  76          HG22      VAL  76 -28.946   7.262  -1.814
    9   HG23  VAL  76          HG23      VAL  76 -27.241   7.177  -1.371

  No H/Q in entry =           9
  In of MODEL   72
    1    H    GLU  77           H        GLU  77 -28.522   2.432  -1.572
    2    HA   GLU  77           HA       GLU  77 -29.286   1.569   1.065
    3    HB2  GLU  77           HB2      GLU  77 -30.881  -0.078   0.501
    4    HB3  GLU  77           HB3      GLU  77 -31.448   1.457  -0.158
    5    HG2  GLU  77           HG2      GLU  77 -30.845   0.762  -2.368
    6    HG3  GLU  77           HG3      GLU  77 -30.187  -0.746  -1.737

  No H/Q in entry =           6
  In of MODEL   72
    1    H    VAL  78           H        VAL  78 -28.936  -0.532   1.669
    2    HA   VAL  78           HA       VAL  78 -26.268  -1.255   0.745
    3    HB   VAL  78           HB       VAL  78 -27.955  -2.216   3.097
    4   HG11  VAL  78          HG11      VAL  78 -25.610  -3.394   1.927
    5   HG13  VAL  78          HG12      VAL  78 -26.506  -3.910   3.358
    6   HG12  VAL  78          HG13      VAL  78 -25.196  -2.740   3.511
    7   HG22  VAL  78          HG21      VAL  78 -26.499  -0.875   4.462
    8   HG21  VAL  78          HG22      VAL  78 -27.252   0.120   3.216
    9   HG23  VAL  78          HG23      VAL  78 -25.572  -0.387   3.043

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ILE  79           H        ILE  79 -25.719  -3.135  -0.212
    2    HA   ILE  79           HA       ILE  79 -27.775  -4.596  -1.586
    3    HB   ILE  79           HB       ILE  79 -24.778  -5.100  -1.395
    4   HG12  ILE  79          HG12      ILE  79 -26.439  -3.952  -3.645
    5   HG13  ILE  79          HG13      ILE  79 -25.566  -2.965  -2.472
    6   HG22  ILE  79          HG21      ILE  79 -25.883  -6.230  -3.738
    7   HG21  ILE  79          HG22      ILE  79 -26.855  -6.796  -2.379
    8   HG23  ILE  79          HG23      ILE  79 -25.111  -7.058  -2.386
    9   HD13  ILE  79          HD11      ILE  79 -24.163  -3.019  -4.300
   10   HD12  ILE  79          HD12      ILE  79 -24.489  -4.722  -4.623
   11   HD11  ILE  79          HD13      ILE  79 -23.500  -4.260  -3.236

  No H/Q in entry =          11
  In of MODEL   72
    1    H    ASP  80           H        ASP  80 -28.618  -6.542  -1.048
    2    HA   ASP  80           HA       ASP  80 -28.541  -7.509   1.574
    3    HB2  ASP  80           HB2      ASP  80 -30.300  -8.059  -0.070
    4    HB3  ASP  80           HB3      ASP  80 -29.137  -9.033  -0.970

  No H/Q in entry =           4
  In of MODEL   72
    1    H    SER  81           H        SER  81 -26.989  -8.658   2.666
    2    HA   SER  81           HA       SER  81 -24.493  -9.286   1.443
    3    HB2  SER  81           HB2      SER  81 -23.920 -10.365   3.582
    4    HB3  SER  81           HB3      SER  81 -24.633  -8.774   3.841
    5    HG   SER  81           HG       SER  81 -25.369 -10.829   5.040

  No H/Q in entry =           5
  In of MODEL   72
    1    H    LEU  82           H        LEU  82 -27.183 -11.410   1.726
    2    HA   LEU  82           HA       LEU  82 -25.617 -13.750   1.137
    3    HB2  LEU  82           HB2      LEU  82 -28.559 -13.280   0.718
    4    HB3  LEU  82           HB3      LEU  82 -27.738 -14.834   0.846
    5    HG   LEU  82           HG       LEU  82 -28.079 -12.849   3.074
    6   HD11  LEU  82          HD11      LEU  82 -29.530 -15.354   2.250
    7   HD13  LEU  82          HD12      LEU  82 -30.201 -13.792   2.724
    8   HD12  LEU  82          HD13      LEU  82 -29.483 -14.849   3.940
    9   HD21  LEU  82          HD21      LEU  82 -26.780 -15.558   2.820
   10   HD23  LEU  82          HD22      LEU  82 -27.251 -14.874   4.375
   11   HD22  LEU  82          HD23      LEU  82 -26.052 -14.050   3.379

  No H/Q in entry =          11
  In of MODEL   72
    1    H    LEU  83           H        LEU  83 -27.606 -11.494  -0.713
    2    HA   LEU  83           HA       LEU  83 -27.408 -12.787  -3.219
    3    HB2  LEU  83           HB2      LEU  83 -27.840  -9.902  -2.495
    4    HB3  LEU  83           HB3      LEU  83 -27.876 -10.505  -4.152
    5    HG   LEU  83           HG       LEU  83 -29.893 -10.966  -1.975
    6   HD13  LEU  83          HD11      LEU  83 -30.672  -9.098  -2.987
    7   HD12  LEU  83          HD12      LEU  83 -31.132 -10.182  -4.298
    8   HD11  LEU  83          HD13      LEU  83 -29.606  -9.301  -4.376
    9   HD23  LEU  83          HD21      LEU  83 -30.037 -12.155  -4.729
   10   HD22  LEU  83          HD22      LEU  83 -30.995 -12.550  -3.303
   11   HD21  LEU  83          HD23      LEU  83 -29.303 -13.036  -3.390

  No H/Q in entry =          11
  In of MODEL   72
    1    H    TYR  84           H        TYR  84 -25.466 -10.428  -1.494
    2    HA   TYR  84           HA       TYR  84 -23.621  -9.869  -3.622
    3    HB2  TYR  84           HB2      TYR  84 -24.143  -8.443  -1.555
    4    HB3  TYR  84           HB3      TYR  84 -23.100  -9.555  -0.670
    5    HD1  TYR  84           HD1      TYR  84 -20.737  -9.374  -0.779
    6    HD2  TYR  84           HD2      TYR  84 -23.165  -7.072  -3.432
    7    HE1  TYR  84           HE1      TYR  84 -18.738  -8.100  -1.483
    8    HE2  TYR  84           HE2      TYR  84 -21.176  -5.799  -4.153
    9    HH   TYR  84           HH       TYR  84 -18.621  -5.413  -2.649

  No H/Q in entry =           9
  In of MODEL   72
    1    H    GLY  85           H        GLY  85 -23.346 -11.943  -0.729
    2    HA3  GLY  85           HA2      GLY  85 -20.762 -12.851  -1.251
    3    HA2  GLY  85           HA3      GLY  85 -21.980 -13.732  -0.327

  No H/Q in entry =           3
  In of MODEL   72
    1    H    LYS  86           H        LYS  86 -23.835 -14.069  -2.386
    2    HA   LYS  86           HA       LYS  86 -22.768 -16.402  -3.711
    3    HB2  LYS  86           HB2      LYS  86 -25.024 -16.239  -2.711
    4    HB3  LYS  86           HB3      LYS  86 -25.435 -14.998  -3.894
    5    HG2  LYS  86           HG2      LYS  86 -25.283 -16.606  -5.673
    6    HG3  LYS  86           HG3      LYS  86 -24.794 -17.853  -4.525
    7    HD2  LYS  86           HD2      LYS  86 -26.893 -17.528  -3.284
    8    HD3  LYS  86           HD3      LYS  86 -27.384 -16.298  -4.447
    9    HE2  LYS  86           HE2      LYS  86 -26.859 -19.202  -5.062
   10    HE3  LYS  86           HE3      LYS  86 -28.443 -18.438  -4.942
   11    HZ2  LYS  86           HZ1      LYS  86 -27.642 -18.625  -7.246
   12    HZ1  LYS  86           HZ2      LYS  86 -26.318 -17.632  -6.859
   13    HZ3  LYS  86           HZ3      LYS  86 -27.897 -17.011  -6.781

  No H/Q in entry =          13
  In of MODEL   72
    1    H    VAL  87           H        VAL  87 -22.791 -13.166  -4.523
    2    HA   VAL  87           HA       VAL  87 -22.515 -11.941  -6.436
    3    HB   VAL  87           HB       VAL  87 -21.421 -14.429  -7.791
    4   HG11  VAL  87          HG11      VAL  87 -21.696 -12.146  -8.949
    5   HG13  VAL  87          HG12      VAL  87 -20.099 -12.890  -9.032
    6   HG12  VAL  87          HG13      VAL  87 -20.406 -11.585  -7.887
    7   HG21  VAL  87          HG21      VAL  87 -19.984 -12.720  -5.768
    8   HG23  VAL  87          HG22      VAL  87 -19.227 -13.925  -6.806
    9   HG22  VAL  87          HG23      VAL  87 -20.408 -14.422  -5.595

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ASP  88           H        ASP  88 -25.022 -12.615  -6.085
    2    HA   ASP  88           HA       ASP  88 -26.148 -13.781  -8.506
    3    HB2  ASP  88           HB2      ASP  88 -27.126 -14.093  -6.183
    4    HB3  ASP  88           HB3      ASP  88 -27.595 -12.394  -6.237

  No H/Q in entry =           4
  In of MODEL   72
    1    H    GLY  89           H        GLY  89 -25.466 -12.476 -10.120
    2    HA3  GLY  89           HA2      GLY  89 -25.674  -9.701 -10.249
    3    HA2  GLY  89           HA3      GLY  89 -25.648 -10.788 -11.638

  No H/Q in entry =           3
  In of MODEL   72
    1    H    LEU  90           H        LEU  90 -28.079 -12.174 -11.208
    2    HA   LEU  90           HA       LEU  90 -29.915 -10.229 -12.262
    3    HB2  LEU  90           HB2      LEU  90 -29.961 -12.610 -12.902
    4    HB3  LEU  90           HB3      LEU  90 -30.453 -13.023 -11.259
    5    HG   LEU  90           HG       LEU  90 -32.585 -11.917 -11.581
    6   HD13  LEU  90          HD11      LEU  90 -32.431 -10.138 -13.013
    7   HD12  LEU  90          HD12      LEU  90 -32.966 -11.352 -14.177
    8   HD11  LEU  90          HD13      LEU  90 -31.255 -10.945 -14.054
    9   HD23  LEU  90          HD21      LEU  90 -32.515 -13.486 -14.056
   10   HD22  LEU  90          HD22      LEU  90 -33.483 -13.696 -12.598
   11   HD21  LEU  90          HD23      LEU  90 -31.824 -14.292 -12.648

  No H/Q in entry =          11
  In of MODEL   72
    1    H    GLY  91           H        GLY  91 -29.712 -11.807  -9.118
    2    HA3  GLY  91           HA2      GLY  91 -32.054 -10.743  -8.036
    3    HA2  GLY  91           HA3      GLY  91 -30.652 -11.286  -7.115

  No H/Q in entry =           3
  In of MODEL   72
    1    H    VAL  92           H        VAL  92 -28.756  -9.420  -7.938
    2    HA   VAL  92           HA       VAL  92 -29.560  -7.166  -6.327
    3    HB   VAL  92           HB       VAL  92 -27.020  -7.570  -7.951
    4   HG12  VAL  92          HG11      VAL  92 -27.187  -5.745  -5.577
    5   HG11  VAL  92          HG12      VAL  92 -27.868  -5.170  -7.101
    6   HG13  VAL  92          HG13      VAL  92 -26.167  -5.623  -7.011
    7   HG22  VAL  92          HG21      VAL  92 -26.770  -9.194  -6.400
    8   HG21  VAL  92          HG22      VAL  92 -27.915  -8.453  -5.281
    9   HG23  VAL  92          HG23      VAL  92 -26.269  -7.833  -5.397

  No H/Q in entry =           9
  In of MODEL   72
    1    H    LEU  93           H        LEU  93 -29.169  -7.738  -9.766
    2    HA   LEU  93           HA       LEU  93 -29.547  -5.084 -10.628
    3    HB2  LEU  93           HB2      LEU  93 -28.897  -6.895 -12.139
    4    HB3  LEU  93           HB3      LEU  93 -30.479  -7.645 -11.924
    5    HG   LEU  93           HG       LEU  93 -31.518  -5.665 -12.992
    6   HD11  LEU  93          HD11      LEU  93 -29.680  -4.063 -12.460
    7   HD13  LEU  93          HD12      LEU  93 -30.130  -4.055 -14.167
    8   HD12  LEU  93          HD13      LEU  93 -28.667  -4.889 -13.646
    9   HD23  LEU  93          HD21      LEU  93 -30.489  -6.164 -15.300
   10   HD22  LEU  93          HD22      LEU  93 -31.312  -7.452 -14.419
   11   HD21  LEU  93          HD23      LEU  93 -29.549  -7.378 -14.432

  No H/Q in entry =          11
  In of MODEL   72
    1    H    LYS  94           H        LYS  94 -31.891  -7.675  -9.826
    2    HA   LYS  94           HA       LYS  94 -34.254  -6.242 -10.399
    3    HB2  LYS  94           HB2      LYS  94 -33.704  -8.470  -8.446
    4    HB3  LYS  94           HB3      LYS  94 -35.310  -7.785  -8.686
    5    HG2  LYS  94           HG2      LYS  94 -35.232  -8.501 -11.038
    6    HG3  LYS  94           HG3      LYS  94 -33.662  -9.245 -10.740
    7    HD2  LYS  94           HD2      LYS  94 -34.756 -10.634  -8.941
    8    HD3  LYS  94           HD3      LYS  94 -36.309  -9.989  -9.470
    9    HE2  LYS  94           HE2      LYS  94 -35.801 -10.857 -11.763
   10    HE3  LYS  94           HE3      LYS  94 -34.373 -11.642 -11.088
   11    HZ3  LYS  94           HZ1      LYS  94 -36.209 -13.179 -11.283
   12    HZ2  LYS  94           HZ2      LYS  94 -37.187 -12.186 -10.310
   13    HZ1  LYS  94           HZ3      LYS  94 -35.814 -12.937  -9.650

  No H/Q in entry =          13
  In of MODEL   72
    1    H    ALA  95           H        ALA  95 -32.408  -6.420  -7.366
    2    HA   ALA  95           HA       ALA  95 -34.262  -4.896  -5.835
    3    HB2  ALA  95           HB1      ALA  95 -31.870  -6.259  -5.349
    4    HB3  ALA  95           HB2      ALA  95 -32.850  -5.394  -4.167
    5    HB1  ALA  95           HB3      ALA  95 -31.515  -4.573  -4.978

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ALA  96           H        ALA  96 -31.644  -3.964  -7.928
    2    HA   ALA  96           HA       ALA  96 -31.569  -1.221  -7.087
    3    HB2  ALA  96           HB1      ALA  96 -30.224  -0.929  -9.199
    4    HB3  ALA  96           HB2      ALA  96 -30.514  -2.631  -9.559
    5    HB1  ALA  96           HB3      ALA  96 -29.593  -2.178  -8.125

  No H/Q in entry =           5
  In of MODEL   72
    1    H    VAL  97           H        VAL  97 -33.104  -2.883  -9.805
    2    HA   VAL  97           HA       VAL  97 -34.203  -0.562 -10.995
    3    HB   VAL  97           HB       VAL  97 -34.986  -3.493 -11.106
    4   HG11  VAL  97          HG11      VAL  97 -36.800  -1.492 -11.528
    5   HG13  VAL  97          HG12      VAL  97 -36.850  -3.066 -12.324
    6   HG12  VAL  97          HG13      VAL  97 -36.115  -1.689 -13.142
    7   HG21  VAL  97          HG21      VAL  97 -33.738  -1.604 -13.103
    8   HG23  VAL  97          HG22      VAL  97 -34.178  -3.280 -13.431
    9   HG22  VAL  97          HG23      VAL  97 -32.924  -2.912 -12.245

  No H/Q in entry =           9
  In of MODEL   72
    1    H    ALA  98           H        ALA  98 -35.349  -2.815  -8.506
    2    HA   ALA  98           HA       ALA  98 -37.916  -1.698  -8.109
    3    HB1  ALA  98           HB1      ALA  98 -36.877  -3.914  -7.139
    4    HB3  ALA  98           HB2      ALA  98 -38.059  -3.023  -6.177
    5    HB2  ALA  98           HB3      ALA  98 -36.338  -2.869  -5.825

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ALA  99           H        ALA  99 -34.833  -0.915  -6.464
    2    HA   ALA  99           HA       ALA  99 -35.967   1.016  -4.744
    3    HB1  ALA  99           HB1      ALA  99 -33.316   0.167  -5.532
    4    HB2  ALA  99           HB2      ALA  99 -33.862   0.875  -4.011
    5    HB3  ALA  99           HB3      ALA  99 -33.404   1.920  -5.355

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ILE 100           H        ILE 100 -34.951   1.241  -8.103
    2    HA   ILE 100           HA       ILE 100 -35.152   4.093  -8.247
    3    HB   ILE 100           HB       ILE 100 -35.247   1.993 -10.440
    4   HG12  ILE 100          HG12      ILE 100 -33.094   3.983  -9.733
    5   HG13  ILE 100          HG13      ILE 100 -33.113   2.320  -9.145
    6   HG21  ILE 100          HG21      ILE 100 -35.692   4.912 -10.492
    7   HG23  ILE 100          HG22      ILE 100 -36.197   3.668 -11.637
    8   HG22  ILE 100          HG23      ILE 100 -34.550   4.297 -11.687
    9   HD12  ILE 100          HD11      ILE 100 -32.608   3.353 -11.897
   10   HD11  ILE 100          HD12      ILE 100 -33.255   1.727 -11.679
   11   HD13  ILE 100          HD13      ILE 100 -31.706   2.163 -10.959

  No H/Q in entry =          11
  In of MODEL   72
    1    H    LYS 101           H        LYS 101 -37.433   1.486  -9.024
    2    HA   LYS 101           HA       LYS 101 -39.532   3.145  -9.967
    3    HB2  LYS 101           HB2      LYS 101 -39.389   0.343  -8.912
    4    HB3  LYS 101           HB3      LYS 101 -40.948   1.102  -9.227
    5    HG2  LYS 101           HG2      LYS 101 -40.491   1.300 -11.523
    6    HG3  LYS 101           HG3      LYS 101 -38.791   0.900 -11.291
    7    HD2  LYS 101           HD2      LYS 101 -40.033  -0.993 -12.217
    8    HD3  LYS 101           HD3      LYS 101 -39.393  -1.360 -10.616
    9    HE2  LYS 101           HE2      LYS 101 -41.447  -2.084 -10.113
   10    HE3  LYS 101           HE3      LYS 101 -41.915  -0.383 -10.069
   11    HZ3  LYS 101           HZ1      LYS 101 -42.821  -0.492 -12.184
   12    HZ2  LYS 101           HZ2      LYS 101 -43.267  -1.986 -11.512
   13    HZ1  LYS 101           HZ3      LYS 101 -41.968  -1.901 -12.603

  No H/Q in entry =          13
  In of MODEL   72
    1    H    LYS 102           H        LYS 102 -39.008   1.588  -6.801
    2    HA   LYS 102           HA       LYS 102 -41.255   2.735  -5.556
    3    HB2  LYS 102           HB2      LYS 102 -39.998   0.852  -4.600
    4    HB3  LYS 102           HB3      LYS 102 -38.613   1.911  -4.338
    5    HG2  LYS 102           HG2      LYS 102 -39.929   3.256  -2.796
    6    HG3  LYS 102           HG3      LYS 102 -41.317   2.202  -3.059
    7    HD2  LYS 102           HD2      LYS 102 -40.071   0.319  -2.091
    8    HD3  LYS 102           HD3      LYS 102 -38.683   1.375  -1.826
    9    HE2  LYS 102           HE2      LYS 102 -40.038   2.805  -0.370
   10    HE3  LYS 102           HE3      LYS 102 -41.444   1.781  -0.655
   11    HZ1  LYS 102           HZ1      LYS 102 -39.704   0.013   0.290
   12    HZ3  LYS 102           HZ2      LYS 102 -40.814   0.866   1.251
   13    HZ2  LYS 102           HZ3      LYS 102 -39.208   1.405   1.127

  No H/Q in entry =          13
  In of MODEL   72
    1    H    ALA 103           H        ALA 103 -38.317   4.175  -6.553
    2    HA   ALA 103           HA       ALA 103 -38.545   6.439  -4.709
    3    HB2  ALA 103           HB1      ALA 103 -36.569   7.229  -6.278
    4    HB3  ALA 103           HB2      ALA 103 -36.524   5.523  -6.721
    5    HB1  ALA 103           HB3      ALA 103 -36.289   6.004  -5.042

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ALA 104           H        ALA 104 -39.183   5.792  -8.069
    2    HA   ALA 104           HA       ALA 104 -39.792   8.588  -8.613
    3    HB2  ALA 104           HB1      ALA 104 -39.845   7.978 -10.832
    4    HB1  ALA 104           HB2      ALA 104 -40.559   6.402 -10.491
    5    HB3  ALA 104           HB3      ALA 104 -38.836   6.670 -10.216

  No H/Q in entry =           5
  In of MODEL   72
    1    H    ALA 105           H        ALA 105 -41.373   6.425  -6.855
    2    HA   ALA 105           HA       ALA 105 -43.807   7.800  -6.775
    3    HB2  ALA 105           HB1      ALA 105 -44.560   6.989  -8.831
    4    HB3  ALA 105           HB2      ALA 105 -45.180   5.766  -7.722
    5    HB1  ALA 105           HB3      ALA 105 -43.714   5.452  -8.649

  No H/Q in entry =           5
  In of MODEL   73
    1    H1   ALA   1           H3       ALA   1 -12.093 -16.028  -2.221
    2    H2   ALA   1           H2       ALA   1 -11.144 -17.158  -3.069
    3    H3   ALA   1           H1       ALA   1 -12.308 -16.230  -3.893
    4    HA   ALA   1           HA       ALA   1 -13.682 -17.948  -3.639
    5    HB3  ALA   1           HB1      ALA   1 -12.259 -19.701  -3.188
    6    HB1  ALA   1           HB2      ALA   1 -13.002 -19.596  -1.592
    7    HB2  ALA   1           HB3      ALA   1 -11.439 -18.835  -1.888

  No H/Q in entry =           7
  In of MODEL   73
    1    H    GLU   2           H        GLU   2 -15.279 -18.822  -1.970
    2    HA   GLU   2           HA       GLU   2 -16.940 -17.122  -0.898
    3    HB2  GLU   2           HB2      GLU   2 -15.955 -19.534   0.641
    4    HB3  GLU   2           HB3      GLU   2 -17.488 -18.703   0.907
    5    HG2  GLU   2           HG2      GLU   2 -18.468 -19.804  -0.817
    6    HG3  GLU   2           HG3      GLU   2 -17.160 -19.387  -1.914

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLU   3           H        GLU   3 -14.986 -18.447   1.709
    2    HA   GLU   3           HA       GLU   3 -15.225 -16.095   3.266
    3    HB2  GLU   3           HB2      GLU   3 -13.604 -18.621   3.505
    4    HB3  GLU   3           HB3      GLU   3 -13.380 -17.297   4.649
    5    HG2  GLU   3           HG2      GLU   3 -15.564 -17.476   5.486
    6    HG3  GLU   3           HG3      GLU   3 -16.161 -18.285   4.044

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LEU   4           H        LEU   4 -12.263 -17.537   1.850
    2    HA   LEU   4           HA       LEU   4 -10.449 -15.609   2.430
    3    HB2  LEU   4           HB2      LEU   4 -10.687 -16.912  -0.291
    4    HB3  LEU   4           HB3      LEU   4  -9.238 -16.172   0.380
    5    HG   LEU   4           HG       LEU   4 -10.691 -18.587   1.509
    6   HD13  LEU   4          HD11      LEU   4  -9.049 -19.923   0.566
    7   HD12  LEU   4          HD12      LEU   4  -7.857 -18.624   0.528
    8   HD11  LEU   4          HD13      LEU   4  -9.155 -18.664  -0.664
    9   HD23  LEU   4          HD21      LEU   4  -8.427 -18.620   2.870
   10   HD22  LEU   4          HD22      LEU   4  -9.757 -17.597   3.410
   11   HD21  LEU   4          HD23      LEU   4  -8.411 -16.892   2.515

  No H/Q in entry =          11
  In of MODEL   73
    1    H    GLU   5           H        GLU   5 -12.810 -15.435  -0.223
    2    HA   GLU   5           HA       GLU   5 -11.848 -12.940  -1.235
    3    HB2  GLU   5           HB2      GLU   5 -13.188 -14.550  -2.580
    4    HB3  GLU   5           HB3      GLU   5 -14.583 -14.193  -1.562
    5    HG2  GLU   5           HG2      GLU   5 -14.480 -11.828  -2.218
    6    HG3  GLU   5           HG3      GLU   5 -13.058 -12.155  -3.208

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLU   6           H        GLU   6 -14.543 -13.851   0.882
    2    HA   GLU   6           HA       GLU   6 -15.478 -11.186   1.286
    3    HB2  GLU   6           HB2      GLU   6 -16.871 -13.202   1.699
    4    HB3  GLU   6           HB3      GLU   6 -15.825 -13.622   3.056
    5    HG2  GLU   6           HG2      GLU   6 -17.734 -12.451   3.952
    6    HG3  GLU   6           HG3      GLU   6 -16.353 -11.362   4.049

  No H/Q in entry =           6
  In of MODEL   73
    1    H    VAL   7           H        VAL   7 -13.130 -13.265   2.840
    2    HA   VAL   7           HA       VAL   7 -12.664 -11.681   5.161
    3    HB   VAL   7           HB       VAL   7 -10.947 -13.705   3.699
    4   HG11  VAL   7          HG11      VAL   7 -10.476 -12.163   6.257
    5   HG13  VAL   7          HG12      VAL   7  -9.385 -12.365   4.887
    6   HG12  VAL   7          HG13      VAL   7  -9.712 -13.724   5.962
    7   HG21  VAL   7          HG21      VAL   7 -13.179 -14.296   4.939
    8   HG23  VAL   7          HG22      VAL   7 -12.243 -14.009   6.406
    9   HG22  VAL   7          HG23      VAL   7 -11.744 -15.263   5.274

  No H/Q in entry =           9
  In of MODEL   73
    1    H    VAL   8           H        VAL   8 -11.179 -11.780   1.938
    2    HA   VAL   8           HA       VAL   8  -9.137  -9.880   2.411
    3    HB   VAL   8           HB       VAL   8 -10.613 -10.591  -0.135
    4   HG11  VAL   8          HG11      VAL   8  -8.326  -8.719   0.434
    5   HG13  VAL   8          HG12      VAL   8  -9.708  -8.491  -0.638
    6   HG12  VAL   8          HG13      VAL   8  -8.398  -9.574  -1.108
    7   HG21  VAL   8          HG21      VAL   8  -8.867 -12.135   1.357
    8   HG23  VAL   8          HG22      VAL   8  -7.764 -11.320   0.252
    9   HG22  VAL   8          HG23      VAL   8  -9.082 -12.297  -0.387

  No H/Q in entry =           9
  In of MODEL   73
    1    H    MET   9           H        MET   9 -12.497  -9.535   1.280
    2    HA   MET   9           HA       MET   9 -12.473  -6.758   0.842
    3    HB2  MET   9           HB2      MET   9 -14.653  -8.664   1.689
    4    HB3  MET   9           HB3      MET   9 -14.960  -6.938   1.479
    5    HG2  MET   9           HG2      MET   9 -14.107  -7.076  -0.840
    6    HG3  MET   9           HG3      MET   9 -13.839  -8.807  -0.629
    7    HE1  MET   9           HE1      MET   9 -16.017  -5.941  -0.287
    8    HE3  MET   9           HE2      MET   9 -17.692  -6.485  -0.314
    9    HE2  MET   9           HE3      MET   9 -16.829  -6.242  -1.829

  No H/Q in entry =           9
  In of MODEL   73
    1    H    GLY  10           H        GLY  10 -13.086  -8.655   3.777
    2    HA3  GLY  10           HA2      GLY  10 -13.648  -6.475   5.498
    3    HA2  GLY  10           HA3      GLY  10 -13.058  -8.056   6.008

  No H/Q in entry =           3
  In of MODEL   73
    1    H    LEU  11           H        LEU  11 -10.623  -8.149   4.673
    2    HA   LEU  11           HA       LEU  11  -8.926  -6.691   6.413
    3    HB2  LEU  11           HB2      LEU  11  -8.383  -8.111   3.803
    4    HB3  LEU  11           HB3      LEU  11  -7.114  -7.388   4.790
    5    HG   LEU  11           HG       LEU  11  -9.080  -9.446   5.825
    6   HD13  LEU  11          HD11      LEU  11  -7.855 -10.669   4.252
    7   HD12  LEU  11          HD12      LEU  11  -6.904 -10.893   5.719
    8   HD11  LEU  11          HD13      LEU  11  -6.390  -9.722   4.506
    9   HD22  LEU  11          HD21      LEU  11  -8.224  -8.420   7.734
   10   HD21  LEU  11          HD22      LEU  11  -6.698  -7.999   6.957
   11   HD23  LEU  11          HD23      LEU  11  -6.997  -9.658   7.471

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  12           H        ILE  12  -9.865  -6.160   3.031
    2    HA   ILE  12           HA       ILE  12  -8.207  -3.908   2.587
    3    HB   ILE  12           HB       ILE  12 -10.863  -4.615   1.315
    4   HG12  ILE  12          HG12      ILE  12  -8.809  -6.243   1.226
    5   HG13  ILE  12          HG13      ILE  12  -9.684  -5.897  -0.251
    6   HG22  ILE  12          HG21      ILE  12  -9.900  -3.233  -0.599
    7   HG21  ILE  12          HG22      ILE  12  -8.691  -2.645   0.535
    8   HG23  ILE  12          HG23      ILE  12 -10.382  -2.340   0.811
    9   HD13  ILE  12          HD11      ILE  12  -7.983  -4.299  -0.916
   10   HD12  ILE  12          HD12      ILE  12  -7.193  -5.817  -0.491
   11   HD11  ILE  12          HD13      ILE  12  -7.166  -4.472   0.627

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  13           H        ILE  13 -11.555  -4.221   3.709
    2    HA   ILE  13           HA       ILE  13 -12.051  -1.440   3.980
    3    HB   ILE  13           HB       ILE  13 -13.210  -3.877   5.353
    4   HG12  ILE  13          HG12      ILE  13 -13.465  -3.333   2.817
    5   HG13  ILE  13          HG13      ILE  13 -14.876  -3.814   3.736
    6   HG21  ILE  13          HG21      ILE  13 -13.795  -0.965   5.746
    7   HG23  ILE  13          HG22      ILE  13 -13.812  -2.267   6.927
    8   HG22  ILE  13          HG23      ILE  13 -15.144  -2.096   5.789
    9   HD13  ILE  13          HD11      ILE  13 -15.625  -1.527   3.943
   10   HD12  ILE  13          HD12      ILE  13 -15.237  -1.825   2.259
   11   HD11  ILE  13          HD13      ILE  13 -14.108  -0.935   3.256

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ASN  14           H        ASN  14 -10.885  -3.911   6.248
    2    HA   ASN  14           HA       ASN  14 -10.689  -2.268   8.530
    3    HB2  ASN  14           HB2      ASN  14 -10.401  -4.872   8.209
    4    HB3  ASN  14           HB3      ASN  14  -8.699  -4.460   8.037
    5   HD21  ASN  14          HD21      ASN  14  -9.295  -5.991  10.220
    6   HD22  ASN  14          HD22      ASN  14  -9.269  -5.068  11.643

  No H/Q in entry =           6
  In of MODEL   73
    1    H    SER  15           H        SER  15  -8.296  -3.059   6.019
    2    HA   SER  15           HA       SER  15  -6.166  -1.534   7.071
    3    HB2  SER  15           HB2      SER  15  -5.161  -1.738   4.905
    4    HB3  SER  15           HB3      SER  15  -6.092  -3.211   5.139
    5    HG   SER  15           HG       SER  15  -6.828  -2.578   3.238

  No H/Q in entry =           5
  In of MODEL   73
    1    H    GLY  16           H        GLY  16  -8.799  -0.709   4.845
    2    HA3  GLY  16           HA2      GLY  16  -7.985   1.944   4.283
    3    HA2  GLY  16           HA3      GLY  16  -9.628   1.324   4.136

  No H/Q in entry =           3
  In of MODEL   73
    1    H    GLN  17           H        GLN  17 -10.138   0.594   6.791
    2    HA   GLN  17           HA       GLN  17 -10.874   3.089   7.934
    3    HB2  GLN  17           HB2      GLN  17 -12.072   0.990   8.434
    4    HB3  GLN  17           HB3      GLN  17 -10.647   0.384   9.280
    5    HG2  GLN  17           HG2      GLN  17 -10.781   2.288  10.855
    6    HG3  GLN  17           HG3      GLN  17 -12.221   2.869  10.019
    7   HE21  GLN  17          HE21      GLN  17 -14.122   2.231  11.028
    8   HE22  GLN  17          HE22      GLN  17 -14.317   0.804  11.927

  No H/Q in entry =           8
  In of MODEL   73
    1    H    ALA  18           H        ALA  18  -8.205   0.850   8.534
    2    HA   ALA  18           HA       ALA  18  -7.107   2.086  10.794
    3    HB2  ALA  18           HB1      ALA  18  -6.474  -0.122   9.424
    4    HB3  ALA  18           HB2      ALA  18  -5.315   0.681  10.484
    5    HB1  ALA  18           HB3      ALA  18  -5.256   0.958   8.743

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ARG  19           H        ARG  19  -6.373   2.617   7.339
    2    HA   ARG  19           HA       ARG  19  -4.504   4.695   7.749
    3    HB2  ARG  19           HB2      ARG  19  -4.831   3.546   5.558
    4    HB3  ARG  19           HB3      ARG  19  -6.389   4.361   5.392
    5    HG2  ARG  19           HG2      ARG  19  -5.295   6.551   5.448
    6    HG3  ARG  19           HG3      ARG  19  -3.731   5.791   5.741
    7    HD2  ARG  19           HD2      ARG  19  -3.884   6.376   3.398
    8    HD3  ARG  19           HD3      ARG  19  -3.940   4.615   3.547
    9    HE   ARG  19           HE       ARG  19  -6.588   5.481   3.560
   10   HH21  ARG  19          HH11      ARG  19  -7.801   5.615   1.651
   11   HH22  ARG  19          HH12      ARG  19  -6.993   5.704   0.125
   12   HH11  ARG  19          HH21      ARG  19  -3.831   5.586   1.503
   13   HH12  ARG  19          HH22      ARG  19  -4.744   5.685   0.041

  No H/Q in entry =          13
  In of MODEL   73
    1    H    SER  20           H        SER  20  -8.008   4.752   7.177
    2    HA   SER  20           HA       SER  20  -8.411   7.501   7.128
    3    HB2  SER  20           HB2      SER  20 -10.184   5.857   6.649
    4    HB3  SER  20           HB3      SER  20 -10.214   5.402   8.351
    5    HG   SER  20           HG       SER  20 -10.525   8.085   7.545

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LEU  21           H        LEU  21  -8.352   5.323   9.935
    2    HA   LEU  21           HA       LEU  21  -8.810   7.315  11.901
    3    HB2  LEU  21           HB2      LEU  21  -7.410   4.638  12.055
    4    HB3  LEU  21           HB3      LEU  21  -7.729   5.651  13.459
    5    HG   LEU  21           HG       LEU  21  -9.893   4.709  11.553
    6   HD11  LEU  21          HD11      LEU  21  -8.778   3.485  14.075
    7   HD13  LEU  21          HD12      LEU  21  -9.102   2.708  12.525
    8   HD12  LEU  21          HD13      LEU  21 -10.442   3.183  13.571
    9   HD21  LEU  21          HD21      LEU  21  -9.836   6.224  14.157
   10   HD23  LEU  21          HD22      LEU  21 -11.228   5.207  13.800
   11   HD22  LEU  21          HD23      LEU  21 -10.815   6.534  12.726

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ALA  22           H        ALA  22  -5.846   5.989  10.471
    2    HA   ALA  22           HA       ALA  22  -3.976   7.337  12.076
    3    HB2  ALA  22           HB1      ALA  22  -3.542   5.488  10.384
    4    HB1  ALA  22           HB2      ALA  22  -2.368   6.804  10.408
    5    HB3  ALA  22           HB3      ALA  22  -3.596   6.737   9.142

  No H/Q in entry =           5
  In of MODEL   73
    1    H    TYR  23           H        TYR  23  -5.336   8.326   8.903
    2    HA   TYR  23           HA       TYR  23  -4.043  10.844   8.818
    3    HB2  TYR  23           HB2      TYR  23  -5.124   9.912   6.836
    4    HB3  TYR  23           HB3      TYR  23  -6.698   9.991   7.630
    5    HD1  TYR  23           HD1      TYR  23  -3.842  12.086   6.454
    6    HD2  TYR  23           HD2      TYR  23  -7.974  11.979   7.620
    7    HE1  TYR  23           HE1      TYR  23  -4.117  14.431   5.693
    8    HE2  TYR  23           HE2      TYR  23  -8.250  14.324   6.859
    9    HH   TYR  23           HH       TYR  23  -6.723  16.338   6.529

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ALA  24           H        ALA  24  -7.135   9.816  10.224
    2    HA   ALA  24           HA       ALA  24  -8.009  12.392  10.998
    3    HB1  ALA  24           HB1      ALA  24  -9.802  11.111  11.482
    4    HB2  ALA  24           HB2      ALA  24  -8.955  10.556  12.924
    5    HB3  ALA  24           HB3      ALA  24  -8.826   9.644  11.421

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ALA  25           H        ALA  25  -5.953   9.971  12.560
    2    HA   ALA  25           HA       ALA  25  -5.617  11.233  15.057
    3    HB2  ALA  25           HB1      ALA  25  -4.816   8.894  14.233
    4    HB3  ALA  25           HB2      ALA  25  -3.807   9.771  15.385
    5    HB1  ALA  25           HB3      ALA  25  -3.384   9.759  13.672

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LEU  26           H        LEU  26  -3.856  11.558  12.002
    2    HA   LEU  26           HA       LEU  26  -1.921  13.413  12.900
    3    HB2  LEU  26           HB2      LEU  26  -1.617  12.263  10.796
    4    HB3  LEU  26           HB3      LEU  26  -3.107  12.945  10.151
    5    HG   LEU  26           HG       LEU  26  -2.130  15.212  10.276
    6   HD12  LEU  26          HD11      LEU  26   0.411  15.276  10.669
    7   HD11  LEU  26          HD12      LEU  26   0.221  13.693  11.418
    8   HD13  LEU  26          HD13      LEU  26  -0.606  15.095  12.098
    9   HD21  LEU  26          HD21      LEU  26  -0.363  13.185   8.870
   10   HD23  LEU  26          HD22      LEU  26  -0.438  14.905   8.497
   11   HD22  LEU  26          HD23      LEU  26  -1.847  13.883   8.222

  No H/Q in entry =          11
  In of MODEL   73
    1    H    LYS  27           H        LYS  27  -5.122  13.839  11.447
    2    HA   LYS  27           HA       LYS  27  -5.116  16.628  11.244
    3    HB2  LYS  27           HB2      LYS  27  -6.842  15.120  10.275
    4    HB3  LYS  27           HB3      LYS  27  -7.482  14.855  11.897
    5    HG2  LYS  27           HG2      LYS  27  -7.950  17.254  12.132
    6    HG3  LYS  27           HG3      LYS  27  -7.259  17.560  10.536
    7    HD2  LYS  27           HD2      LYS  27  -8.976  16.096   9.515
    8    HD3  LYS  27           HD3      LYS  27  -9.672  15.806  11.111
    9    HE2  LYS  27           HE2      LYS  27 -10.153  18.210  11.354
   10    HE3  LYS  27           HE3      LYS  27  -9.429  18.522   9.773
   11    HZ3  LYS  27           HZ1      LYS  27 -11.806  18.357   9.550
   12    HZ2  LYS  27           HZ2      LYS  27 -11.822  16.841  10.323
   13    HZ1  LYS  27           HZ3      LYS  27 -11.092  17.014   8.795

  No H/Q in entry =          13
  In of MODEL   73
    1    H    GLN  28           H        GLN  28  -5.948  14.532  13.982
    2    HA   GLN  28           HA       GLN  28  -6.862  16.523  15.762
    3    HB2  GLN  28           HB2      GLN  28  -5.409  13.920  16.301
    4    HB3  GLN  28           HB3      GLN  28  -6.167  14.911  17.549
    5    HG2  GLN  28           HG2      GLN  28  -7.611  13.755  15.147
    6    HG3  GLN  28           HG3      GLN  28  -7.652  13.069  16.771
    7   HE21  GLN  28          HE21      GLN  28  -9.559  14.834  14.800
    8   HE22  GLN  28          HE22      GLN  28 -10.327  15.840  15.931

  No H/Q in entry =           8
  In of MODEL   73
    1    H    ALA  29           H        ALA  29  -3.628  15.277  15.049
    2    HA   ALA  29           HA       ALA  29  -2.197  16.701  17.013
    3    HB1  ALA  29           HB1      ALA  29  -0.264  16.038  15.880
    4    HB3  ALA  29           HB2      ALA  29  -1.034  16.148  14.297
    5    HB2  ALA  29           HB3      ALA  29  -1.426  14.811  15.377

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LYS  30           H        LYS  30  -3.095  17.562  13.690
    2    HA   LYS  30           HA       LYS  30  -1.721  20.022  13.574
    3    HB2  LYS  30           HB2      LYS  30  -4.250  19.110  12.187
    4    HB3  LYS  30           HB3      LYS  30  -3.441  20.636  11.835
    5    HG2  LYS  30           HG2      LYS  30  -1.357  19.371  11.306
    6    HG3  LYS  30           HG3      LYS  30  -2.241  17.863  11.560
    7    HD2  LYS  30           HD2      LYS  30  -3.828  18.479   9.778
    8    HD3  LYS  30           HD3      LYS  30  -2.968  19.999   9.525
    9    HE2  LYS  30           HE2      LYS  30  -0.923  18.733   8.931
   10    HE3  LYS  30           HE3      LYS  30  -1.802  17.218   9.152
   11    HZ2  LYS  30           HZ1      LYS  30  -1.657  18.088   6.808
   12    HZ1  LYS  30           HZ2      LYS  30  -2.714  19.337   7.283
   13    HZ3  LYS  30           HZ3      LYS  30  -3.216  17.713   7.361

  No H/Q in entry =          13
  In of MODEL   73
    1    H    GLN  31           H        GLN  31  -4.798  19.131  15.013
    2    HA   GLN  31           HA       GLN  31  -5.593  21.877  15.468
    3    HB2  GLN  31           HB2      GLN  31  -6.730  19.418  16.804
    4    HB3  GLN  31           HB3      GLN  31  -7.512  20.979  16.562
    5    HG2  GLN  31           HG2      GLN  31  -6.813  20.208  13.968
    6    HG3  GLN  31           HG3      GLN  31  -7.312  18.698  14.721
    7   HE21  GLN  31          HE21      GLN  31  -8.760  20.251  12.629
    8   HE22  GLN  31          HE22      GLN  31 -10.273  20.624  13.299

  No H/Q in entry =           8
  In of MODEL   73
    1    H    GLY  32           H        GLY  32  -3.246  19.982  16.771
    2    HA3  GLY  32           HA2      GLY  32  -1.836  20.463  18.561
    3    HA2  GLY  32           HA3      GLY  32  -2.976  21.693  19.093

  No H/Q in entry =           3
  In of MODEL   73
    1    H    ASP  33           H        ASP  33  -4.366  18.635  18.446
    2    HA   ASP  33           HA       ASP  33  -4.747  18.176  21.330
    3    HB2  ASP  33           HB2      ASP  33  -6.162  17.144  18.865
    4    HB3  ASP  33           HB3      ASP  33  -6.486  16.531  20.485

  No H/Q in entry =           4
  In of MODEL   73
    1    H    PHE  34           H        PHE  34  -2.566  17.352  21.618
    2    HA   PHE  34           HA       PHE  34  -1.550  15.114  20.211
    3    HB2  PHE  34           HB2      PHE  34  -0.921  16.109  22.999
    4    HB3  PHE  34           HB3      PHE  34   0.015  14.896  22.125
    5    HD1  PHE  34           HD1      PHE  34  -0.193  18.320  22.858
    6    HD2  PHE  34           HD2      PHE  34   0.643  15.624  19.619
    7    HE1  PHE  34           HE1      PHE  34   1.071  20.106  21.691
    8    HE2  PHE  34           HE2      PHE  34   1.902  17.413  18.457
    9    HZ   PHE  34           HZ       PHE  34   2.118  19.651  19.498

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ALA  35           H        ALA  35  -3.568  15.369  23.091
    2    HA   ALA  35           HA       ALA  35  -3.316  12.711  23.988
    3    HB3  ALA  35           HB1      ALA  35  -5.774  13.307  24.866
    4    HB1  ALA  35           HB2      ALA  35  -5.264  14.932  24.404
    5    HB2  ALA  35           HB3      ALA  35  -4.329  14.020  25.588

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ALA  36           H        ALA  36  -5.802  14.195  21.908
    2    HA   ALA  36           HA       ALA  36  -7.192  11.766  21.444
    3    HB1  ALA  36           HB1      ALA  36  -8.673  13.170  20.499
    4    HB3  ALA  36           HB2      ALA  36  -7.517  13.603  19.240
    5    HB2  ALA  36           HB3      ALA  36  -7.539  14.492  20.763

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ALA  37           H        ALA  37  -4.545  13.384  19.751
    2    HA   ALA  37           HA       ALA  37  -4.510  11.747  17.455
    3    HB3  ALA  37           HB1      ALA  37  -2.527  13.484  18.860
    4    HB2  ALA  37           HB2      ALA  37  -3.072  13.532  17.184
    5    HB1  ALA  37           HB3      ALA  37  -1.899  12.317  17.696

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LYS  38           H        LYS  38  -2.723  11.465  20.519
    2    HA   LYS  38           HA       LYS  38  -1.373   9.081  20.020
    3    HB2  LYS  38           HB2      LYS  38  -1.699  10.842  22.167
    4    HB3  LYS  38           HB3      LYS  38  -2.294   9.306  22.790
    5    HG2  LYS  38           HG2      LYS  38  -0.191   8.210  22.237
    6    HG3  LYS  38           HG3      LYS  38   0.393   9.662  21.416
    7    HD2  LYS  38           HD2      LYS  38   0.564  10.884  23.449
    8    HD3  LYS  38           HD3      LYS  38  -0.433   9.723  24.326
    9    HE2  LYS  38           HE2      LYS  38   1.931   9.436  24.925
   10    HE3  LYS  38           HE3      LYS  38   1.337   8.012  24.067
   11    HZ3  LYS  38           HZ1      LYS  38   2.617   8.445  22.275
   12    HZ2  LYS  38           HZ2      LYS  38   3.572   9.286  23.403
   13    HZ1  LYS  38           HZ3      LYS  38   2.473  10.131  22.420

  No H/Q in entry =          13
  In of MODEL   73
    1    H    ALA  39           H        ALA  39  -4.605   9.538  21.450
    2    HA   ALA  39           HA       ALA  39  -5.128   6.812  21.962
    3    HB3  ALA  39           HB1      ALA  39  -7.317   8.730  21.211
    4    HB2  ALA  39           HB2      ALA  39  -6.409   8.969  22.704
    5    HB1  ALA  39           HB3      ALA  39  -7.309   7.474  22.450

  No H/Q in entry =           5
  In of MODEL   73
    1    H    MET  40           H        MET  40  -5.762   8.816  19.118
    2    HA   MET  40           HA       MET  40  -7.226   6.864  17.672
    3    HB2  MET  40           HB2      MET  40  -5.654   9.278  16.752
    4    HB3  MET  40           HB3      MET  40  -6.677   8.306  15.691
    5    HG2  MET  40           HG2      MET  40  -7.705   9.544  18.257
    6    HG3  MET  40           HG3      MET  40  -7.786  10.377  16.706
    7    HE3  MET  40           HE1      MET  40 -10.367   8.723  14.666
    8    HE2  MET  40           HE2      MET  40  -8.617   8.862  14.502
    9    HE1  MET  40           HE3      MET  40  -9.546  10.217  15.143

  No H/Q in entry =           9
  In of MODEL   73
    1    H    MET  41           H        MET  41  -3.744   7.645  17.764
    2    HA   MET  41           HA       MET  41  -2.981   5.899  15.659
    3    HB2  MET  41           HB2      MET  41  -1.352   6.588  18.118
    4    HB3  MET  41           HB3      MET  41  -0.739   5.946  16.597
    5    HG2  MET  41           HG2      MET  41  -1.932   8.113  15.602
    6    HG3  MET  41           HG3      MET  41  -1.689   8.706  17.244
    7    HE2  MET  41           HE1      MET  41   1.258   6.645  17.582
    8    HE1  MET  41           HE2      MET  41   0.461   7.929  18.486
    9    HE3  MET  41           HE3      MET  41   2.075   8.193  17.829

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ASP  42           H        ASP  42  -3.330   5.423  19.149
    2    HA   ASP  42           HA       ASP  42  -2.260   2.843  19.302
    3    HB2  ASP  42           HB2      ASP  42  -3.141   4.593  21.130
    4    HB3  ASP  42           HB3      ASP  42  -4.555   3.549  21.071

  No H/Q in entry =           4
  In of MODEL   73
    1    H    GLN  43           H        GLN  43  -5.612   3.904  18.829
    2    HA   GLN  43           HA       GLN  43  -6.723   1.301  18.646
    3    HB2  GLN  43           HB2      GLN  43  -7.690   3.940  17.522
    4    HB3  GLN  43           HB3      GLN  43  -8.634   2.449  17.509
    5    HG2  GLN  43           HG2      GLN  43  -8.318   2.333  20.014
    6    HG3  GLN  43           HG3      GLN  43  -7.615   3.948  19.936
    7   HE21  GLN  43          HE21      GLN  43  -9.782   4.000  21.454
    8   HE22  GLN  43          HE22      GLN  43 -11.157   4.558  20.634

  No H/Q in entry =           8
  In of MODEL   73
    1    H    SER  44           H        SER  44  -5.432   3.531  16.221
    2    HA   SER  44           HA       SER  44  -6.132   2.035  13.939
    3    HB2  SER  44           HB2      SER  44  -4.904   4.436  14.370
    4    HB3  SER  44           HB3      SER  44  -3.541   3.457  13.830
    5    HG   SER  44           HG       SER  44  -4.681   4.413  12.075

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ARG  45           H        ARG  45  -3.237   1.962  15.995
    2    HA   ARG  45           HA       ARG  45  -1.742   0.026  14.602
    3    HB2  ARG  45           HB2      ARG  45  -0.904   1.459  16.463
    4    HB3  ARG  45           HB3      ARG  45  -1.874   0.517  17.592
    5    HG2  ARG  45           HG2      ARG  45  -0.621  -1.526  16.941
    6    HG3  ARG  45           HG3      ARG  45   0.373  -0.559  15.854
    7    HD2  ARG  45           HD2      ARG  45   1.106   0.833  17.802
    8    HD3  ARG  45           HD3      ARG  45   0.207  -0.253  18.884
    9    HE   ARG  45           HE       ARG  45   1.913  -1.828  17.290
   10   HH21  ARG  45          HH11      ARG  45   3.831  -2.625  18.113
   11   HH22  ARG  45          HH12      ARG  45   4.605  -1.828  19.437
   12   HH11  ARG  45          HH21      ARG  45   2.204   0.644  19.676
   13   HH12  ARG  45          HH22      ARG  45   3.683   0.026  20.320

  No H/Q in entry =          13
  In of MODEL   73
    1    H    MET  46           H        MET  46  -4.114  -0.324  17.222
    2    HA   MET  46           HA       MET  46  -3.908  -3.120  17.529
    3    HB2  MET  46           HB2      MET  46  -6.092  -1.138  18.150
    4    HB3  MET  46           HB3      MET  46  -6.285  -2.860  18.484
    5    HG2  MET  46           HG2      MET  46  -4.296  -2.849  19.896
    6    HG3  MET  46           HG3      MET  46  -3.984  -1.166  19.499
    7    HE1  MET  46           HE1      MET  46  -6.177  -3.750  20.817
    8    HE3  MET  46           HE2      MET  46  -7.686  -2.865  20.623
    9    HE2  MET  46           HE3      MET  46  -7.007  -3.091  22.232

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ALA  47           H        ALA  47  -5.970  -1.131  15.450
    2    HA   ALA  47           HA       ALA  47  -7.571  -3.203  14.399
    3    HB3  ALA  47           HB1      ALA  47  -8.282  -0.974  13.987
    4    HB1  ALA  47           HB2      ALA  47  -7.798  -1.602  12.412
    5    HB2  ALA  47           HB3      ALA  47  -6.724  -0.520  13.299

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LEU  48           H        LEU  48  -4.477  -1.856  13.322
    2    HA   LEU  48           HA       LEU  48  -4.196  -3.444  10.979
    3    HB2  LEU  48           HB2      LEU  48  -2.140  -2.140  12.770
    4    HB3  LEU  48           HB3      LEU  48  -1.775  -2.857  11.201
    5    HG   LEU  48           HG       LEU  48  -3.821  -0.664  11.605
    6   HD13  LEU  48          HD11      LEU  48  -1.705   0.238  12.254
    7   HD12  LEU  48          HD12      LEU  48  -1.999   0.787  10.604
    8   HD11  LEU  48          HD13      LEU  48  -0.883  -0.546  10.904
    9   HD22  LEU  48          HD21      LEU  48  -4.297  -1.655   9.534
   10   HD21  LEU  48          HD22      LEU  48  -2.612  -2.070   9.225
   11   HD23  LEU  48          HD23      LEU  48  -3.152  -0.398   9.070

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ASN  49           H        ASN  49  -3.119  -3.827  14.317
    2    HA   ASN  49           HA       ASN  49  -1.493  -6.072  13.975
    3    HB2  ASN  49           HB2      ASN  49  -1.497  -4.755  16.023
    4    HB3  ASN  49           HB3      ASN  49  -3.162  -5.211  16.354
    5   HD21  ASN  49          HD21      ASN  49   0.099  -6.637  15.955
    6   HD22  ASN  49          HD22      ASN  49  -0.178  -7.942  17.004

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLU  50           H        GLU  50  -4.959  -5.835  14.674
    2    HA   GLU  50           HA       GLU  50  -5.439  -8.640  14.788
    3    HB2  GLU  50           HB2      GLU  50  -7.037  -6.970  15.676
    4    HB3  GLU  50           HB3      GLU  50  -7.349  -6.410  14.031
    5    HG2  GLU  50           HG2      GLU  50  -8.195  -8.616  13.401
    6    HG3  GLU  50           HG3      GLU  50  -7.794  -9.254  14.992

  No H/Q in entry =           6
  In of MODEL   73
    1    H    ALA  51           H        ALA  51  -5.554  -6.244  12.192
    2    HA   ALA  51           HA       ALA  51  -6.537  -7.983  10.178
    3    HB2  ALA  51           HB1      ALA  51  -6.347  -6.169   8.806
    4    HB1  ALA  51           HB2      ALA  51  -4.707  -5.802   9.342
    5    HB3  ALA  51           HB3      ALA  51  -6.088  -5.305  10.321

  No H/Q in entry =           5
  In of MODEL   73
    1    H    HIS  52           H        HIS  52  -3.248  -7.041  11.135
    2    HA   HIS  52           HA       HIS  52  -1.849  -8.517   9.176
    3    HB2  HIS  52           HB2      HIS  52  -0.790  -6.786  10.567
    4    HB3  HIS  52           HB3      HIS  52  -0.996  -7.802  11.993
    5    HD1  HIS  52           HD1      HIS  52   0.311 -10.155  11.937
    6    HD2  HIS  52           HD2      HIS  52   1.475  -7.378   9.053
    7    HE1  HIS  52           HE1      HIS  52   2.549 -10.940  11.049
    8    HE2  HIS  52           HE2      HIS  52   3.272  -9.258   9.289

  No H/Q in entry =           8
  In of MODEL   73
    1    H    LEU  53           H        LEU  53  -3.027  -9.405  12.398
    2    HA   LEU  53           HA       LEU  53  -1.802 -11.937  12.583
    3    HB2  LEU  53           HB2      LEU  53  -4.296 -10.789  13.814
    4    HB3  LEU  53           HB3      LEU  53  -3.802 -12.453  14.110
    5    HG   LEU  53           HG       LEU  53  -1.947 -10.093  14.560
    6   HD12  LEU  53          HD11      LEU  53  -2.508 -10.488  17.006
    7   HD11  LEU  53          HD12      LEU  53  -3.868 -11.465  16.453
    8   HD13  LEU  53          HD13      LEU  53  -3.795  -9.752  16.056
    9   HD22  LEU  53          HD21      LEU  53  -0.616 -12.035  14.534
   10   HD21  LEU  53          HD22      LEU  53  -1.895 -13.034  15.216
   11   HD23  LEU  53          HD23      LEU  53  -1.020 -11.914  16.243

  No H/Q in entry =          11
  In of MODEL   73
    1    H    VAL  54           H        VAL  54  -4.934 -10.939  11.245
    2    HA   VAL  54           HA       VAL  54  -5.828 -13.542  10.566
    3    HB   VAL  54           HB       VAL  54  -6.510 -10.816   9.435
    4   HG12  VAL  54          HG11      VAL  54  -8.605 -12.214   8.640
    5   HG11  VAL  54          HG12      VAL  54  -7.480 -13.569   8.704
    6   HG13  VAL  54          HG13      VAL  54  -7.141 -12.191   7.659
    7   HG22  VAL  54          HG21      VAL  54  -7.399 -10.861  11.594
    8   HG21  VAL  54          HG22      VAL  54  -7.637 -12.607  11.577
    9   HG23  VAL  54          HG23      VAL  54  -8.735 -11.560  10.679

  No H/Q in entry =           9
  In of MODEL   73
    1    H    GLN  55           H        GLN  55  -3.993 -11.074   8.761
    2    HA   GLN  55           HA       GLN  55  -3.868 -12.538   6.343
    3    HB2  GLN  55           HB2      GLN  55  -3.287 -10.268   6.148
    4    HB3  GLN  55           HB3      GLN  55  -2.165 -10.334   7.504
    5    HG2  GLN  55           HG2      GLN  55  -0.450 -11.164   6.215
    6    HG3  GLN  55           HG3      GLN  55  -1.522 -12.150   5.230
    7   HE21  GLN  55          HE21      GLN  55  -1.562 -11.461   3.108
    8   HE22  GLN  55          HE22      GLN  55  -1.383  -9.855   2.596

  No H/Q in entry =           8
  In of MODEL   73
    1    H    THR  56           H        THR  56  -1.741 -12.496   9.208
    2    HA   THR  56           HA       THR  56   0.345 -14.077   8.275
    3    HB   THR  56           HB       THR  56  -0.931 -14.115  11.024
    4    HG1  THR  56           HG1      THR  56   0.677 -12.387   9.670
    5   HG23  THR  56          HG21      THR  56   0.406 -16.048  10.961
    6   HG22  THR  56          HG22      THR  56   1.496 -14.825  11.614
    7   HG21  THR  56          HG23      THR  56   1.608 -15.292   9.916

  No H/Q in entry =           7
  In of MODEL   73
    1    H    LYS  57           H        LYS  57  -2.755 -15.140   9.662
    2    HA   LYS  57           HA       LYS  57  -2.287 -17.932   9.414
    3    HB2  LYS  57           HB2      LYS  57  -4.104 -16.859  10.774
    4    HB3  LYS  57           HB3      LYS  57  -4.911 -16.413   9.278
    5    HG2  LYS  57           HG2      LYS  57  -5.136 -18.778   8.664
    6    HG3  LYS  57           HG3      LYS  57  -4.286 -19.254  10.133
    7    HD2  LYS  57           HD2      LYS  57  -6.079 -18.225  11.499
    8    HD3  LYS  57           HD3      LYS  57  -6.939 -17.776  10.026
    9    HE2  LYS  57           HE2      LYS  57  -7.119 -20.164   9.401
   10    HE3  LYS  57           HE3      LYS  57  -6.260 -20.626  10.868
   11    HZ2  LYS  57           HZ1      LYS  57  -8.948 -20.329  10.622
   12    HZ1  LYS  57           HZ2      LYS  57  -8.473 -18.884  11.379
   13    HZ3  LYS  57           HZ3      LYS  57  -8.083 -20.381  12.082

  No H/Q in entry =          13
  In of MODEL   73
    1    H    LEU  58           H        LEU  58  -3.656 -15.502   7.248
    2    HA   LEU  58           HA       LEU  58  -4.458 -17.335   5.248
    3    HB2  LEU  58           HB2      LEU  58  -3.878 -14.382   5.107
    4    HB3  LEU  58           HB3      LEU  58  -4.543 -15.325   3.773
    5    HG   LEU  58           HG       LEU  58  -5.804 -15.155   6.530
    6   HD11  LEU  58          HD11      LEU  58  -6.137 -13.512   4.040
    7   HD13  LEU  58          HD12      LEU  58  -6.118 -13.003   5.729
    8   HD12  LEU  58          HD13      LEU  58  -7.539 -13.809   5.068
    9   HD22  LEU  58          HD21      LEU  58  -6.756 -17.073   5.669
   10   HD21  LEU  58          HD22      LEU  58  -6.434 -16.619   3.995
   11   HD23  LEU  58          HD23      LEU  58  -7.796 -15.904   4.856

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  59           H        ILE  59  -1.326 -16.097   6.085
    2    HA   ILE  59           HA       ILE  59  -0.242 -16.817   3.440
    3    HB   ILE  59           HB       ILE  59   0.521 -14.741   4.991
    4   HG12  ILE  59          HG12      ILE  59   2.628 -16.388   3.580
    5   HG13  ILE  59          HG13      ILE  59   1.423 -15.473   2.710
    6   HG21  ILE  59          HG21      ILE  59   1.281 -16.514   6.758
    7   HG23  ILE  59          HG22      ILE  59   2.354 -15.179   6.402
    8   HG22  ILE  59          HG23      ILE  59   2.641 -16.767   5.690
    9   HD11  ILE  59          HD11      ILE  59   3.309 -14.303   4.755
   10   HD13  ILE  59          HD12      ILE  59   2.148 -13.400   3.783
   11   HD12  ILE  59          HD13      ILE  59   3.527 -14.185   3.010

  No H/Q in entry =          11
  In of MODEL   73
    1    H    GLU  60           H        GLU  60  -0.218 -17.921   6.809
    2    HA   GLU  60           HA       GLU  60   1.827 -19.882   6.530
    3    HB2  GLU  60           HB2      GLU  60   1.112 -19.135   8.730
    4    HB3  GLU  60           HB3      GLU  60  -0.521 -19.727   8.436
    5    HG2  GLU  60           HG2      GLU  60   1.834 -21.600   8.261
    6    HG3  GLU  60           HG3      GLU  60   1.108 -21.217   9.822

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLY  61           H        GLY  61  -1.686 -20.010   6.070
    2    HA3  GLY  61           HA2      GLY  61  -1.421 -22.801   5.112
    3    HA2  GLY  61           HA3      GLY  61  -2.909 -22.077   5.716

  No H/Q in entry =           3
  In of MODEL   73
    1    H    ASP  62           H        ASP  62  -0.708 -20.480   3.495
    2    HA   ASP  62           HA       ASP  62  -2.816 -19.944   1.637
    3    HB2  ASP  62           HB2      ASP  62  -1.009 -18.857   0.332
    4    HB3  ASP  62           HB3      ASP  62  -1.029 -18.336   2.013

  No H/Q in entry =           4
  In of MODEL   73
    1    H    ALA  63           H        ALA  63  -3.300 -22.376   1.331
    2    HA   ALA  63           HA       ALA  63  -1.524 -23.993  -0.225
    3    HB1  ALA  63           HB1      ALA  63  -3.545 -25.374  -0.643
    4    HB3  ALA  63           HB2      ALA  63  -4.508 -24.147   0.177
    5    HB2  ALA  63           HB3      ALA  63  -3.273 -25.036   1.068

  No H/Q in entry =           5
  In of MODEL   73
    1    H    GLY  64           H        GLY  64  -4.186 -21.795  -0.977
    2    HA3  GLY  64           HA2      GLY  64  -4.724 -20.674  -2.915
    3    HA2  GLY  64           HA3      GLY  64  -3.212 -21.239  -3.606

  No H/Q in entry =           3
  In of MODEL   73
    1    H    GLU  65           H        GLU  65  -5.176 -21.152  -5.368
    2    HA   GLU  65           HA       GLU  65  -6.934 -23.354  -5.433
    3    HB2  GLU  65           HB2      GLU  65  -5.854 -21.608  -7.643
    4    HB3  GLU  65           HB3      GLU  65  -7.100 -22.834  -7.887
    5    HG2  GLU  65           HG2      GLU  65  -8.530 -21.738  -6.216
    6    HG3  GLU  65           HG3      GLU  65  -7.284 -20.527  -5.930

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLY  66           H        GLY  66  -3.712 -22.919  -6.672
    2    HA3  GLY  66           HA2      GLY  66  -3.583 -25.505  -7.969
    3    HA2  GLY  66           HA3      GLY  66  -2.315 -24.297  -7.904

  No H/Q in entry =           3
  In of MODEL   73
    1    H    LYS  67           H        LYS  67  -1.763 -26.951  -7.605
    2    HA   LYS  67           HA       LYS  67  -1.748 -27.953  -4.992
    3    HB2  LYS  67           HB2      LYS  67  -0.239 -28.567  -7.495
    4    HB3  LYS  67           HB3      LYS  67   0.226 -29.351  -5.979
    5    HG2  LYS  67           HG2      LYS  67  -1.662 -30.407  -7.527
    6    HG3  LYS  67           HG3      LYS  67  -1.792 -30.467  -5.770
    7    HD2  LYS  67           HD2      LYS  67  -3.354 -28.693  -5.711
    8    HD3  LYS  67           HD3      LYS  67  -2.956 -28.177  -7.352
    9    HE2  LYS  67           HE2      LYS  67  -4.293 -29.756  -8.316
   10    HE3  LYS  67           HE3      LYS  67  -3.897 -30.972  -7.103
   11    HZ1  LYS  67           HZ1      LYS  67  -5.477 -28.678  -6.235
   12    HZ3  LYS  67           HZ2      LYS  67  -5.557 -30.302  -5.744
   13    HZ2  LYS  67           HZ3      LYS  67  -6.254 -29.821  -7.216

  No H/Q in entry =          13
  In of MODEL   73
    1    H    MET  68           H        MET  68   0.758 -26.214  -6.738
    2    HA   MET  68           HA       MET  68   2.378 -25.960  -4.293
    3    HB2  MET  68           HB2      MET  68   3.104 -25.658  -7.208
    4    HB3  MET  68           HB3      MET  68   4.217 -25.398  -5.865
    5    HG2  MET  68           HG2      MET  68   2.714 -27.979  -6.389
    6    HG3  MET  68           HG3      MET  68   4.402 -27.695  -6.814
    7    HE3  MET  68           HE1      MET  68   6.393 -27.576  -3.783
    8    HE2  MET  68           HE2      MET  68   5.612 -26.039  -4.153
    9    HE1  MET  68           HE3      MET  68   6.128 -27.096  -5.465

  No H/Q in entry =           9
  In of MODEL   73
    1    H    LYS  69           H        LYS  69   0.201 -24.141  -6.058
    2    HA   LYS  69           HA       LYS  69   1.612 -21.619  -5.759
    3    HB2  LYS  69           HB2      LYS  69  -1.003 -22.303  -7.061
    4    HB3  LYS  69           HB3      LYS  69  -0.412 -20.646  -6.885
    5    HG2  LYS  69           HG2      LYS  69   1.662 -21.243  -8.059
    6    HG3  LYS  69           HG3      LYS  69   1.102 -22.907  -8.221
    7    HD2  LYS  69           HD2      LYS  69  -0.827 -22.127  -9.551
    8    HD3  LYS  69           HD3      LYS  69  -0.255 -20.465  -9.398
    9    HE2  LYS  69           HE2      LYS  69   1.385 -22.703 -10.614
   10    HE3  LYS  69           HE3      LYS  69   0.414 -21.574 -11.558
   11    HZ2  LYS  69           HZ1      LYS  69   2.741 -20.964  -9.832
   12    HZ1  LYS  69           HZ2      LYS  69   1.687 -19.765 -10.410
   13    HZ3  LYS  69           HZ3      LYS  69   2.587 -20.706 -11.502

  No H/Q in entry =          13
  In of MODEL   73
    1    H    VAL  70           H        VAL  70  -0.090 -19.691  -5.262
    2    HA   VAL  70           HA       VAL  70  -1.367 -20.290  -2.654
    3    HB   VAL  70           HB       VAL  70  -0.541 -18.100  -1.844
    4   HG11  VAL  70          HG11      VAL  70   0.768 -20.138  -1.386
    5   HG13  VAL  70          HG12      VAL  70   1.829 -18.744  -1.594
    6   HG12  VAL  70          HG13      VAL  70   1.647 -19.916  -2.899
    7   HG23  VAL  70          HG21      VAL  70   1.291 -16.977  -3.206
    8   HG22  VAL  70          HG22      VAL  70  -0.316 -16.874  -3.921
    9   HG21  VAL  70          HG23      VAL  70   0.851 -18.033  -4.550

  No H/Q in entry =           9
  In of MODEL   73
    1    H    SER  71           H        SER  71  -2.928 -18.607  -2.015
    2    HA   SER  71           HA       SER  71  -4.844 -18.072  -4.034
    3    HB2  SER  71           HB2      SER  71  -5.361 -18.270  -1.576
    4    HB3  SER  71           HB3      SER  71  -4.568 -16.718  -1.326
    5    HG   SER  71           HG       SER  71  -6.916 -17.318  -2.781

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LEU  72           H        LEU  72  -5.084 -16.407  -5.370
    2    HA   LEU  72           HA       LEU  72  -2.997 -14.576  -5.869
    3    HB2  LEU  72           HB2      LEU  72  -5.868 -14.660  -6.791
    4    HB3  LEU  72           HB3      LEU  72  -4.690 -13.487  -7.375
    5    HG   LEU  72           HG       LEU  72  -4.248 -16.488  -7.514
    6   HD13  LEU  72          HD11      LEU  72  -6.214 -15.869  -8.862
    7   HD12  LEU  72          HD12      LEU  72  -4.852 -16.274  -9.907
    8   HD11  LEU  72          HD13      LEU  72  -5.285 -14.586  -9.638
    9   HD22  LEU  72          HD21      LEU  72  -2.146 -15.471  -7.780
   10   HD21  LEU  72          HD22      LEU  72  -2.808 -14.055  -8.580
   11   HD23  LEU  72          HD23      LEU  72  -2.708 -15.587  -9.444

  No H/Q in entry =          11
  In of MODEL   73
    1    H    VAL  73           H        VAL  73  -6.079 -14.248  -4.213
    2    HA   VAL  73           HA       VAL  73  -6.148 -11.477  -3.861
    3    HB   VAL  73           HB       VAL  73  -7.843 -11.855  -2.254
    4   HG12  VAL  73          HG11      VAL  73  -7.884 -14.242  -4.120
    5   HG11  VAL  73          HG12      VAL  73  -8.308 -12.601  -4.605
    6   HG13  VAL  73          HG13      VAL  73  -9.278 -13.441  -3.394
    7   HG23  VAL  73          HG21      VAL  73  -8.100 -14.374  -1.486
    8   HG22  VAL  73          HG22      VAL  73  -6.989 -13.297  -0.640
    9   HG21  VAL  73          HG23      VAL  73  -6.372 -14.437  -1.835

  No H/Q in entry =           9
  In of MODEL   73
    1    H    LEU  74           H        LEU  74  -4.174 -13.827  -2.295
    2    HA   LEU  74           HA       LEU  74  -3.752 -12.682   0.225
    3    HB2  LEU  74           HB2      LEU  74  -2.951 -14.893  -0.283
    4    HB3  LEU  74           HB3      LEU  74  -1.914 -14.270  -1.564
    5    HG   LEU  74           HG       LEU  74  -0.608 -13.004   0.113
    6   HD11  LEU  74          HD11      LEU  74  -2.663 -14.218   1.964
    7   HD13  LEU  74          HD12      LEU  74  -2.146 -12.534   1.856
    8   HD12  LEU  74          HD13      LEU  74  -1.071 -13.744   2.555
    9   HD23  LEU  74          HD21      LEU  74  -0.771 -15.759   1.213
   10   HD22  LEU  74          HD22      LEU  74   0.616 -14.822   0.701
   11   HD21  LEU  74          HD23      LEU  74  -0.403 -15.580  -0.501

  No H/Q in entry =          11
  In of MODEL   73
    1    H    VAL  75           H        VAL  75  -1.891 -12.270  -2.749
    2    HA   VAL  75           HA       VAL  75  -0.103 -10.329  -1.753
    3    HB   VAL  75           HB       VAL  75  -1.078 -10.824  -4.568
    4   HG12  VAL  75          HG11      VAL  75   0.971  -9.495  -5.204
    5   HG11  VAL  75          HG12      VAL  75   1.173  -9.079  -3.508
    6   HG13  VAL  75          HG13      VAL  75  -0.246  -8.524  -4.382
    7   HG23  VAL  75          HG21      VAL  75   1.525 -11.524  -3.165
    8   HG22  VAL  75          HG22      VAL  75   1.042 -12.009  -4.791
    9   HG21  VAL  75          HG23      VAL  75   0.189 -12.656  -3.388

  No H/Q in entry =           9
  In of MODEL   73
    1    H    GLU  76           H        GLU  76  -3.271 -10.012  -3.384
    2    HA   GLU  76           HA       GLU  76  -3.351  -7.198  -3.484
    3    HB2  GLU  76           HB2      GLU  76  -5.002  -8.698  -4.617
    4    HB3  GLU  76           HB3      GLU  76  -5.662  -9.125  -3.047
    5    HG2  GLU  76           HG2      GLU  76  -6.319  -6.783  -2.659
    6    HG3  GLU  76           HG3      GLU  76  -5.648  -6.312  -4.209

  No H/Q in entry =           6
  In of MODEL   73
    1    H    ALA  77           H        ALA  77  -4.417  -9.437  -0.935
    2    HA   ALA  77           HA       ALA  77  -5.378  -7.445   0.833
    3    HB2  ALA  77           HB1      ALA  77  -5.909  -9.846   1.073
    4    HB3  ALA  77           HB2      ALA  77  -5.242  -9.174   2.560
    5    HB1  ALA  77           HB3      ALA  77  -4.231 -10.166   1.511

  No H/Q in entry =           5
  In of MODEL   73
    1    H    GLN  78           H        GLN  78  -2.219  -8.964   0.440
    2    HA   GLN  78           HA       GLN  78  -0.952  -7.793   2.679
    3    HB2  GLN  78           HB2      GLN  78  -0.085  -9.725   1.316
    4    HB3  GLN  78           HB3      GLN  78   0.329  -8.575   0.048
    5    HG2  GLN  78           HG2      GLN  78   1.791  -7.367   1.619
    6    HG3  GLN  78           HG3      GLN  78   1.381  -8.515   2.889
    7   HE21  GLN  78          HE21      GLN  78   4.092  -8.203   2.011
    8   HE22  GLN  78          HE22      GLN  78   4.563  -9.631   1.222

  No H/Q in entry =           8
  In of MODEL   73
    1    H    LEU  79           H        LEU  79  -1.358  -6.734  -0.664
    2    HA   LEU  79           HA       LEU  79   0.308  -4.493  -0.665
    3    HB2  LEU  79           HB2      LEU  79  -0.729  -5.308  -2.710
    4    HB3  LEU  79           HB3      LEU  79  -2.331  -4.930  -2.087
    5    HG   LEU  79           HG       LEU  79  -1.807  -2.539  -2.065
    6   HD13  LEU  79          HD11      LEU  79   0.435  -2.276  -1.572
    7   HD12  LEU  79          HD12      LEU  79   0.466  -1.987  -3.312
    8   HD11  LEU  79          HD13      LEU  79   0.940  -3.561  -2.670
    9   HD23  LEU  79          HD21      LEU  79  -1.197  -2.334  -4.623
   10   HD22  LEU  79          HD22      LEU  79  -2.713  -3.095  -4.151
   11   HD21  LEU  79          HD23      LEU  79  -1.336  -4.092  -4.608

  No H/Q in entry =          11
  In of MODEL   73
    1    H    HIS  80           H        HIS  80  -3.149  -4.685   0.192
    2    HA   HIS  80           HA       HIS  80  -3.358  -1.930   0.858
    3    HB2  HIS  80           HB2      HIS  80  -5.036  -4.353   1.191
    4    HB3  HIS  80           HB3      HIS  80  -5.359  -3.016   2.298
    5    HD1  HIS  80           HD1      HIS  80  -6.998  -1.393   1.405
    6    HD2  HIS  80           HD2      HIS  80  -4.817  -3.186  -1.662
    7    HE1  HIS  80           HE1      HIS  80  -7.865  -0.402  -0.766
    8    HE2  HIS  80           HE2      HIS  80  -6.542  -1.490  -2.645

  No H/Q in entry =           8
  In of MODEL   73
    1    H    LEU  81           H        LEU  81  -2.828  -4.821   2.846
    2    HA   LEU  81           HA       LEU  81  -2.805  -3.475   5.330
    3    HB2  LEU  81           HB2      LEU  81  -1.573  -6.081   4.439
    4    HB3  LEU  81           HB3      LEU  81  -1.537  -5.522   6.113
    5    HG   LEU  81           HG       LEU  81  -4.094  -5.795   4.507
    6   HD12  LEU  81          HD11      LEU  81  -4.367  -7.863   6.057
    7   HD11  LEU  81          HD12      LEU  81  -2.614  -7.778   6.227
    8   HD13  LEU  81          HD13      LEU  81  -3.335  -8.014   4.635
    9   HD23  LEU  81          HD21      LEU  81  -4.914  -6.005   7.016
   10   HD22  LEU  81          HD22      LEU  81  -4.608  -4.414   6.323
   11   HD21  LEU  81          HD23      LEU  81  -3.406  -5.165   7.373

  No H/Q in entry =          11
  In of MODEL   73
    1    H    MET  82           H        MET  82  -0.136  -4.356   3.136
    2    HA   MET  82           HA       MET  82   1.955  -3.446   4.801
    3    HB2  MET  82           HB2      MET  82   1.716  -3.789   1.811
    4    HB3  MET  82           HB3      MET  82   3.200  -3.207   2.561
    5    HG2  MET  82           HG2      MET  82   1.820  -5.807   3.298
    6    HG3  MET  82           HG3      MET  82   3.181  -5.687   2.185
    7    HE3  MET  82           HE1      MET  82   6.208  -4.928   4.143
    8    HE2  MET  82           HE2      MET  82   5.269  -3.568   3.533
    9    HE1  MET  82           HE3      MET  82   5.361  -5.057   2.596

  No H/Q in entry =           9
  In of MODEL   73
    1    H    THR  83           H        THR  83   0.098  -1.818   2.261
    2    HA   THR  83           HA       THR  83   1.492   0.641   2.336
    3    HB   THR  83           HB       THR  83  -0.699   1.550   1.369
    4    HG1  THR  83           HG1      THR  83  -2.341   0.240   1.276
    5   HG22  THR  83          HG21      THR  83  -0.433  -0.266  -0.634
    6   HG21  THR  83          HG22      THR  83   1.077  -0.547   0.229
    7   HG23  THR  83          HG23      THR  83   0.699   1.063  -0.382

  No H/Q in entry =           7
  In of MODEL   73
    1    H    SER  84           H        SER  84  -1.492  -0.414   3.963
    2    HA   SER  84           HA       SER  84  -1.993   2.012   5.313
    3    HB2  SER  84           HB2      SER  84  -2.801  -0.831   5.884
    4    HB3  SER  84           HB3      SER  84  -3.294   0.506   6.922
    5    HG   SER  84           HG       SER  84  -3.776   0.189   4.134

  No H/Q in entry =           5
  In of MODEL   73
    1    H    MET  85           H        MET  85  -0.252  -0.907   6.426
    2    HA   MET  85           HA       MET  85   0.284   0.023   9.026
    3    HB2  MET  85           HB2      MET  85   0.587  -2.319   8.347
    4    HB3  MET  85           HB3      MET  85   1.955  -1.846   7.339
    5    HG2  MET  85           HG2      MET  85   3.149  -1.010   9.320
    6    HG3  MET  85           HG3      MET  85   1.771  -1.428  10.338
    7    HE3  MET  85           HE1      MET  85   3.408  -3.802   7.300
    8    HE2  MET  85           HE2      MET  85   4.841  -4.052   8.296
    9    HE1  MET  85           HE3      MET  85   4.321  -2.415   7.907

  No H/Q in entry =           9
  In of MODEL   73
    1    H    LEU  86           H        LEU  86   2.190   0.292   6.058
    2    HA   LEU  86           HA       LEU  86   4.405   1.618   7.193
    3    HB2  LEU  86           HB2      LEU  86   4.201   0.534   4.887
    4    HB3  LEU  86           HB3      LEU  86   3.378   2.010   4.381
    5    HG   LEU  86           HG       LEU  86   5.406   3.270   5.343
    6   HD11  LEU  86          HD11      LEU  86   6.136   0.664   6.137
    7   HD13  LEU  86          HD12      LEU  86   7.131   2.115   6.225
    8   HD12  LEU  86          HD13      LEU  86   7.235   1.068   4.813
    9   HD23  LEU  86          HD21      LEU  86   6.114   1.512   2.987
   10   HD22  LEU  86          HD22      LEU  86   6.498   3.212   3.245
   11   HD21  LEU  86          HD23      LEU  86   4.845   2.733   2.861

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ALA  87           H        ALA  87   1.471   2.842   5.635
    2    HA   ALA  87           HA       ALA  87   2.047   5.575   5.713
    3    HB1  ALA  87           HB1      ALA  87  -0.256   3.932   5.193
    4    HB3  ALA  87           HB2      ALA  87   0.039   5.595   4.690
    5    HB2  ALA  87           HB3      ALA  87  -0.739   5.268   6.241

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ARG  88           H        ARG  88   0.392   3.563   8.119
    2    HA   ARG  88           HA       ARG  88  -0.117   5.609   9.970
    3    HB2  ARG  88           HB2      ARG  88  -1.038   3.250  10.045
    4    HB3  ARG  88           HB3      ARG  88   0.512   2.761  10.737
    5    HG2  ARG  88           HG2      ARG  88   0.036   4.832  12.361
    6    HG3  ARG  88           HG3      ARG  88  -1.632   4.496  11.920
    7    HD2  ARG  88           HD2      ARG  88  -1.716   2.646  13.168
    8    HD3  ARG  88           HD3      ARG  88  -0.127   2.075  12.622
    9    HE   ARG  88           HE       ARG  88  -0.648   3.335  15.081
   10   HH21  ARG  88          HH11      ARG  88   0.914   4.358  16.305
   11   HH22  ARG  88          HH12      ARG  88   2.424   4.795  15.587
   12   HH11  ARG  88          HH21      ARG  88   1.608   3.532  12.484
   13   HH12  ARG  88          HH22      ARG  88   2.826   4.311  13.435

  No H/Q in entry =          13
  In of MODEL   73
    1    H    GLU  89           H        GLU  89   2.693   3.409   9.722
    2    HA   GLU  89           HA       GLU  89   3.969   4.308  12.054
    3    HB2  GLU  89           HB2      GLU  89   4.630   2.294  10.705
    4    HB3  GLU  89           HB3      GLU  89   5.388   3.393   9.551
    5    HG2  GLU  89           HG2      GLU  89   6.882   4.251  11.281
    6    HG3  GLU  89           HG3      GLU  89   6.065   3.289  12.509

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LEU  90           H        LEU  90   4.248   5.467   8.724
    2    HA   LEU  90           HA       LEU  90   6.169   7.481   9.291
    3    HB2  LEU  90           HB2      LEU  90   4.146   7.135   7.082
    4    HB3  LEU  90           HB3      LEU  90   5.367   8.414   7.092
    5    HG   LEU  90           HG       LEU  90   6.065   5.483   7.420
    6   HD12  LEU  90          HD11      LEU  90   6.790   5.721   4.974
    7   HD11  LEU  90          HD12      LEU  90   5.764   7.154   4.934
    8   HD13  LEU  90          HD13      LEU  90   5.059   5.576   5.284
    9   HD22  LEU  90          HD21      LEU  90   7.960   6.647   8.085
   10   HD21  LEU  90          HD22      LEU  90   7.590   8.049   7.081
   11   HD23  LEU  90          HD23      LEU  90   8.255   6.589   6.348

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  91           H        ILE  91   2.629   7.470   9.174
    2    HA   ILE  91           HA       ILE  91   2.269  10.240   9.627
    3    HB   ILE  91           HB       ILE  91   0.501   7.851  10.186
    4   HG12  ILE  91          HG12      ILE  91   0.218  10.129   8.203
    5   HG13  ILE  91          HG13      ILE  91   1.086   8.642   7.824
    6   HG22  ILE  91          HG21      ILE  91  -1.246   9.895  10.265
    7   HG21  ILE  91          HG22      ILE  91   0.154  10.737  10.925
    8   HG23  ILE  91          HG23      ILE  91  -0.464   9.295  11.727
    9   HD13  ILE  91          HD11      ILE  91  -0.847   7.339   7.886
   10   HD12  ILE  91          HD12      ILE  91  -1.455   8.849   7.209
   11   HD11  ILE  91          HD13      ILE  91  -1.708   8.483   8.916

  No H/Q in entry =          11
  In of MODEL   73
    1    H    THR  92           H        THR  92   2.714   7.503  11.825
    2    HA   THR  92           HA       THR  92   2.281   8.873  14.253
    3    HB   THR  92           HB       THR  92   4.102   6.553  13.573
    4    HG1  THR  92           HG1      THR  92   2.139   5.780  13.490
    5   HG22  THR  92          HG21      THR  92   3.744   6.267  16.210
    6   HG21  THR  92          HG22      THR  92   3.664   8.026  16.136
    7   HG23  THR  92          HG23      THR  92   5.099   7.182  15.551

  No H/Q in entry =           7
  In of MODEL   73
    1    H    GLU  93           H        GLU  93   5.218   8.449  12.293
    2    HA   GLU  93           HA       GLU  93   6.974   9.891  13.974
    3    HB2  GLU  93           HB2      GLU  93   7.039   9.576  10.959
    4    HB3  GLU  93           HB3      GLU  93   8.384  10.118  11.961
    5    HG2  GLU  93           HG2      GLU  93   7.001   7.470  12.422
    6    HG3  GLU  93           HG3      GLU  93   8.374   7.633  11.334

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LEU  94           H        LEU  94   4.894  10.887  11.279
    2    HA   LEU  94           HA       LEU  94   5.674  13.598  11.171
    3    HB2  LEU  94           HB2      LEU  94   3.089  12.209  10.440
    4    HB3  LEU  94           HB3      LEU  94   3.330  13.939  10.195
    5    HG   LEU  94           HG       LEU  94   5.356  11.968   9.129
    6   HD11  LEU  94          HD11      LEU  94   2.600  12.494   8.090
    7   HD13  LEU  94          HD12      LEU  94   3.595  11.046   7.957
    8   HD12  LEU  94          HD13      LEU  94   3.909  12.429   6.908
    9   HD23  LEU  94          HD21      LEU  94   5.574  13.806   7.403
   10   HD22  LEU  94          HD22      LEU  94   5.999  14.303   9.041
   11   HD21  LEU  94          HD23      LEU  94   4.438  14.757   8.356

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  95           H        ILE  95   3.167  11.959  13.084
    2    HA   ILE  95           HA       ILE  95   2.113  14.299  14.287
    3    HB   ILE  95           HB       ILE  95   2.165  11.418  15.213
    4   HG12  ILE  95          HG12      ILE  95  -0.081  13.170  14.182
    5   HG13  ILE  95          HG13      ILE  95   0.876  12.119  13.142
    6   HG21  ILE  95          HG21      ILE  95   0.869  13.879  16.424
    7   HG23  ILE  95          HG22      ILE  95   1.935  12.721  17.220
    8   HG22  ILE  95          HG23      ILE  95   0.301  12.244  16.760
    9   HD13  ILE  95          HD11      ILE  95   0.000  10.173  14.070
   10   HD12  ILE  95          HD12      ILE  95  -1.392  11.249  14.157
   11   HD11  ILE  95          HD13      ILE  95  -0.412  10.961  15.594

  No H/Q in entry =          11
  In of MODEL   73
    1    H    GLU  96           H        GLU  96   4.737  12.106  15.262
    2    HA   GLU  96           HA       GLU  96   5.302  13.312  17.748
    3    HB2  GLU  96           HB2      GLU  96   6.265  11.162  17.094
    4    HB3  GLU  96           HB3      GLU  96   7.180  11.944  15.806
    5    HG2  GLU  96           HG2      GLU  96   8.835  12.509  17.254
    6    HG3  GLU  96           HG3      GLU  96   7.690  13.312  18.318

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LEU  97           H        LEU  97   6.341  14.092  14.453
    2    HA   LEU  97           HA       LEU  97   8.212  16.108  15.148
    3    HB2  LEU  97           HB2      LEU  97   6.605  15.541  12.666
    4    HB3  LEU  97           HB3      LEU  97   7.611  16.983  12.779
    5    HG   LEU  97           HG       LEU  97   8.674  14.197  13.331
    6   HD12  LEU  97          HD11      LEU  97   9.649  14.399  11.006
    7   HD11  LEU  97          HD12      LEU  97   8.581  15.779  10.750
    8   HD13  LEU  97          HD13      LEU  97   7.901  14.180  11.052
    9   HD23  LEU  97          HD21      LEU  97  10.823  15.497  12.570
   10   HD22  LEU  97          HD22      LEU  97  10.215  15.761  14.204
   11   HD21  LEU  97          HD23      LEU  97   9.878  16.940  12.937

  No H/Q in entry =          11
  In of MODEL   73
    1    H    HIS  98           H        HIS  98   4.714  16.207  14.522
    2    HA   HIS  98           HA       HIS  98   4.387  19.003  14.658
    3    HB2  HIS  98           HB2      HIS  98   2.527  16.734  15.402
    4    HB3  HIS  98           HB3      HIS  98   2.042  18.429  15.460
    5    HD1  HIS  98           HD1      HIS  98   3.072  15.723  13.049
    6    HD2  HIS  98           HD2      HIS  98   1.654  19.642  12.935
    7    HE1  HIS  98           HE1      HIS  98   2.487  16.204  10.629
    8    HE2  HIS  98           HE2      HIS  98   1.627  18.585  10.539

  No H/Q in entry =           8
  In of MODEL   73
    1    H    GLU  99           H        GLU  99   4.567  16.518  17.158
    2    HA   GLU  99           HA       GLU  99   3.960  18.207  19.360
    3    HB2  GLU  99           HB2      GLU  99   3.898  15.724  19.459
    4    HB3  GLU  99           HB3      GLU  99   5.657  15.698  19.336
    5    HG2  GLU  99           HG2      GLU  99   5.850  16.994  21.408
    6    HG3  GLU  99           HG3      GLU  99   4.097  17.116  21.518

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LYS 100           H        LYS 100   7.010  17.308  17.770
    2    HA   LYS 100           HA       LYS 100   8.665  18.727  19.612
    3    HB2  LYS 100           HB2      LYS 100   9.150  17.806  16.769
    4    HB3  LYS 100           HB3      LYS 100  10.380  18.590  17.767
    5    HG2  LYS 100           HG2      LYS 100  10.037  16.836  19.512
    6    HG3  LYS 100           HG3      LYS 100   8.905  16.020  18.431
    7    HD2  LYS 100           HD2      LYS 100  10.688  15.755  16.749
    8    HD3  LYS 100           HD3      LYS 100  11.825  16.584  17.815
    9    HE2  LYS 100           HE2      LYS 100  11.462  14.825  19.537
   10    HE3  LYS 100           HE3      LYS 100  10.386  13.977  18.421
   11    HZ1  LYS 100           HZ1      LYS 100  13.194  14.676  17.742
   12    HZ3  LYS 100           HZ2      LYS 100  12.154  13.610  16.923
   13    HZ2  LYS 100           HZ3      LYS 100  12.760  13.198  18.457

  No H/Q in entry =          13
  In of MODEL   73
    1    H    LEU 101           H        LEU 101   6.937  19.634  16.670
    2    HA   LEU 101           HA       LEU 101   8.121  22.204  16.324
    3    HB2  LEU 101           HB2      LEU 101   5.532  20.943  15.459
    4    HB3  LEU 101           HB3      LEU 101   5.763  22.676  15.249
    5    HG   LEU 101           HG       LEU 101   7.812  20.681  14.267
    6   HD12  LEU 101          HD11      LEU 101   6.634  21.173  11.992
    7   HD11  LEU 101          HD12      LEU 101   5.238  21.589  12.984
    8   HD13  LEU 101          HD13      LEU 101   5.921  19.965  13.061
    9   HD21  LEU 101          HD21      LEU 101   7.149  23.586  13.715
   10   HD23  LEU 101          HD22      LEU 101   8.130  22.635  12.601
   11   HD22  LEU 101          HD23      LEU 101   8.683  22.900  14.254

  No H/Q in entry =          11
  In of MODEL   73
    1    H    LYS 102           H        LYS 102   6.618  21.051  18.953
    2    HA   LYS 102           HA       LYS 102   5.991  22.138  20.890
    3    HB2  LYS 102           HB2      LYS 102   7.243  24.140  19.754
    4    HB3  LYS 102           HB3      LYS 102   5.635  24.728  19.391
    5    HG2  LYS 102           HG2      LYS 102   7.037  24.488  22.032
    6    HG3  LYS 102           HG3      LYS 102   6.066  25.806  21.410
    7    HD2  LYS 102           HD2      LYS 102   4.857  23.158  22.301
    8    HD3  LYS 102           HD3      LYS 102   5.100  24.522  23.381
    9    HE2  LYS 102           HE2      LYS 102   2.813  24.095  21.912
   10    HE3  LYS 102           HE3      LYS 102   3.305  25.646  22.589
   11    HZ2  LYS 102           HZ1      LYS 102   2.754  25.747  20.214
   12    HZ1  LYS 102           HZ2      LYS 102   4.024  24.678  19.880
   13    HZ3  LYS 102           HZ3      LYS 102   4.356  26.212  20.520

  No H/Q in entry =          13
  In of MODEL   73
    1    H    ALA 103           H        ALA 103   4.314  23.662  18.136
    2    HA   ALA 103           HA       ALA 103   1.862  24.214  19.041
    3    HB1  ALA 103           HB1      ALA 103   0.953  23.362  16.807
    4    HB2  ALA 103           HB2      ALA 103   2.603  22.842  16.463
    5    HB3  ALA 103           HB3      ALA 103   2.253  24.550  16.732

  No H/Q in entry =           5
  In of MODEL   73
    1    H1   ALA   1           H3       ALA   1  10.697 -20.208  -6.288
    2    H2   ALA   1           H2       ALA   1   9.723 -20.424  -7.666
    3    H3   ALA   1           H1       ALA   1   9.306 -21.174  -6.199
    4    HA   ALA   1           HA       ALA   1  10.356 -22.974  -6.947
    5    HB1  ALA   1           HB1      ALA   1  10.429 -22.614  -9.223
    6    HB2  ALA   1           HB2      ALA   1  12.157 -22.447  -8.909
    7    HB3  ALA   1           HB3      ALA   1  11.144 -21.010  -9.052

  No H/Q in entry =           7
  In of MODEL   73
    1    H    GLU   2           H        GLU   2  12.648 -23.902  -7.024
    2    HA   GLU   2           HA       GLU   2  14.048 -23.807  -4.824
    3    HB2  GLU   2           HB2      GLU   2  15.380 -23.663  -7.535
    4    HB3  GLU   2           HB3      GLU   2  16.126 -24.267  -6.056
    5    HG2  GLU   2           HG2      GLU   2  15.126 -26.293  -6.288
    6    HG3  GLU   2           HG3      GLU   2  13.546 -25.563  -6.533

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLU   3           H        GLU   3  15.781 -21.926  -7.242
    2    HA   GLU   3           HA       GLU   3  16.935 -20.228  -5.293
    3    HB2  GLU   3           HB2      GLU   3  16.853 -20.227  -8.302
    4    HB3  GLU   3           HB3      GLU   3  17.594 -18.891  -7.422
    5    HG2  GLU   3           HG2      GLU   3  19.277 -20.249  -6.514
    6    HG3  GLU   3           HG3      GLU   3  18.343 -21.725  -6.726

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LEU   4           H        LEU   4  14.622 -19.402  -7.904
    2    HA   LEU   4           HA       LEU   4  14.137 -16.798  -7.289
    3    HB2  LEU   4           HB2      LEU   4  11.974 -18.793  -7.999
    4    HB3  LEU   4           HB3      LEU   4  11.881 -17.044  -8.198
    5    HG   LEU   4           HG       LEU   4  13.851 -18.890  -9.588
    6   HD13  LEU   4          HD11      LEU   4  12.531 -18.754 -11.486
    7   HD12  LEU   4          HD12      LEU   4  11.813 -17.215 -11.013
    8   HD11  LEU   4          HD13      LEU   4  11.280 -18.711 -10.246
    9   HD23  LEU   4          HD21      LEU   4  14.154 -16.642 -10.943
   10   HD22  LEU   4          HD22      LEU   4  15.030 -16.876  -9.431
   11   HD21  LEU   4          HD23      LEU   4  13.568 -15.893  -9.457

  No H/Q in entry =          11
  In of MODEL   73
    1    H    GLU   5           H        GLU   5  12.693 -19.594  -5.633
    2    HA   GLU   5           HA       GLU   5  11.016 -18.038  -3.916
    3    HB2  GLU   5           HB2      GLU   5  10.610 -20.422  -4.434
    4    HB3  GLU   5           HB3      GLU   5  12.054 -20.842  -3.511
    5    HG2  GLU   5           HG2      GLU   5  11.090 -19.823  -1.498
    6    HG3  GLU   5           HG3      GLU   5   9.657 -19.354  -2.412

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLU   6           H        GLU   6  14.181 -19.588  -3.500
    2    HA   GLU   6           HA       GLU   6  14.549 -18.728  -0.806
    3    HB2  GLU   6           HB2      GLU   6  15.781 -20.632  -1.826
    4    HB3  GLU   6           HB3      GLU   6  16.639 -19.488  -2.862
    5    HG2  GLU   6           HG2      GLU   6  18.051 -19.941  -0.960
    6    HG3  GLU   6           HG3      GLU   6  17.415 -18.307  -0.771

  No H/Q in entry =           6
  In of MODEL   73
    1    H    VAL   7           H        VAL   7  15.274 -17.395  -3.962
    2    HA   VAL   7           HA       VAL   7  16.947 -15.252  -3.113
    3    HB   VAL   7           HB       VAL   7  15.223 -15.633  -5.575
    4   HG11  VAL   7          HG11      VAL   7  17.102 -13.401  -4.781
    5   HG13  VAL   7          HG12      VAL   7  15.453 -13.275  -5.389
    6   HG12  VAL   7          HG13      VAL   7  16.758 -13.765  -6.471
    7   HG21  VAL   7          HG21      VAL   7  17.349 -17.069  -5.025
    8   HG23  VAL   7          HG22      VAL   7  18.237 -15.599  -5.431
    9   HG22  VAL   7          HG23      VAL   7  17.197 -16.359  -6.633

  No H/Q in entry =           9
  In of MODEL   73
    1    H    VAL   8           H        VAL   8  13.453 -15.556  -3.639
    2    HA   VAL   8           HA       VAL   8  12.765 -12.854  -3.162
    3    HB   VAL   8           HB       VAL   8  11.186 -15.403  -2.723
    4   HG11  VAL   8          HG11      VAL   8  10.472 -12.495  -2.402
    5   HG13  VAL   8          HG12      VAL   8  10.063 -13.859  -1.360
    6   HG12  VAL   8          HG13      VAL   8   9.244 -13.655  -2.907
    7   HG23  VAL   8          HG21      VAL   8  10.479 -13.475  -4.881
    8   HG22  VAL   8          HG22      VAL   8  10.547 -15.234  -4.923
    9   HG21  VAL   8          HG23      VAL   8  12.025 -14.294  -5.099

  No H/Q in entry =           9
  In of MODEL   73
    1    H    MET   9           H        MET   9  13.079 -15.656  -0.984
    2    HA   MET   9           HA       MET   9  12.272 -14.392   1.393
    3    HB2  MET   9           HB2      MET   9  14.205 -16.643   0.842
    4    HB3  MET   9           HB3      MET   9  13.894 -16.070   2.482
    5    HG2  MET   9           HG2      MET   9  11.478 -16.490   2.168
    6    HG3  MET   9           HG3      MET   9  11.800 -17.080   0.536
    7    HE1  MET   9           HE1      MET   9  12.613 -17.117   4.059
    8    HE3  MET   9           HE2      MET   9  13.328 -18.672   4.471
    9    HE2  MET   9           HE3      MET   9  11.577 -18.513   4.379

  No H/Q in entry =           9
  In of MODEL   73
    1    H    GLY  10           H        GLY  10  15.441 -14.584  -0.191
    2    HA3  GLY  10           HA2      GLY  10  16.903 -13.148   1.765
    3    HA2  GLY  10           HA3      GLY  10  17.353 -13.309   0.068

  No H/Q in entry =           3
  In of MODEL   73
    1    H    LEU  11           H        LEU  11  15.161 -12.111  -1.153
    2    HA   LEU  11           HA       LEU  11  15.818  -9.359  -0.996
    3    HB2  LEU  11           HB2      LEU  11  13.454 -10.794  -2.210
    4    HB3  LEU  11           HB3      LEU  11  13.715  -9.057  -2.373
    5    HG   LEU  11           HG       LEU  11  15.758 -11.144  -3.178
    6   HD13  LEU  11          HD11      LEU  11  14.003 -11.530  -4.682
    7   HD12  LEU  11          HD12      LEU  11  14.985 -10.338  -5.532
    8   HD11  LEU  11          HD13      LEU  11  13.514  -9.836  -4.701
    9   HD22  LEU  11          HD21      LEU  11  16.970  -9.167  -2.963
   10   HD21  LEU  11          HD22      LEU  11  15.581  -8.146  -3.330
   11   HD23  LEU  11          HD23      LEU  11  16.410  -9.005  -4.626

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  12           H        ILE  12  13.080 -11.214   0.296
    2    HA   ILE  12           HA       ILE  12  11.672  -9.006   1.367
    3    HB   ILE  12           HB       ILE  12  11.749 -11.888   2.316
    4   HG12  ILE  12          HG12      ILE  12  11.032 -11.263  -0.125
    5   HG13  ILE  12          HG13      ILE  12  10.026 -12.362   0.797
    6   HG22  ILE  12          HG21      ILE  12   9.416 -11.274   3.186
    7   HG21  ILE  12          HG22      ILE  12   9.878  -9.589   2.950
    8   HG23  ILE  12          HG23      ILE  12  10.781 -10.601   4.076
    9   HD13  ILE  12          HD11      ILE  12   8.488 -10.561   1.317
   10   HD12  ILE  12          HD12      ILE  12   8.757 -10.583  -0.426
   11   HD11  ILE  12          HD13      ILE  12   9.558  -9.387   0.569

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  13           H        ILE  13  14.102 -11.183   2.752
    2    HA   ILE  13           HA       ILE  13  14.146 -10.002   5.332
    3    HB   ILE  13           HB       ILE  13  16.212 -11.549   3.748
    4   HG12  ILE  13          HG12      ILE  13  13.947 -12.535   4.619
    5   HG13  ILE  13          HG13      ILE  13  15.434 -13.449   4.849
    6   HG21  ILE  13          HG21      ILE  13  16.381 -10.314   6.474
    7   HG23  ILE  13          HG22      ILE  13  17.638 -10.495   5.257
    8   HG22  ILE  13          HG23      ILE  13  17.139 -11.885   6.222
    9   HD13  ILE  13          HD11      ILE  13  15.602 -12.700   7.166
   10   HD12  ILE  13          HD12      ILE  13  13.983 -13.336   6.899
   11   HD11  ILE  13          HD13      ILE  13  14.246 -11.599   6.937

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ASN  14           H        ASN  14  16.068  -9.448   2.396
    2    HA   ASN  14           HA       ASN  14  17.797  -7.485   3.442
    3    HB2  ASN  14           HB2      ASN  14  17.770  -8.752   1.127
    4    HB3  ASN  14           HB3      ASN  14  16.855  -7.347   0.598
    5   HD21  ASN  14          HD21      ASN  14  19.289  -7.656  -0.609
    6   HD22  ASN  14          HD22      ASN  14  20.424  -6.558   0.008

  No H/Q in entry =           6
  In of MODEL   73
    1    H    SER  15           H        SER  15  14.668  -7.178   1.777
    2    HA   SER  15           HA       SER  15  14.519  -4.359   1.833
    3    HB2  SER  15           HB2      SER  15  12.185  -4.637   1.360
    4    HB3  SER  15           HB3      SER  15  12.994  -5.990   0.580
    5    HG   SER  15           HG       SER  15  11.511  -7.032   1.701

  No H/Q in entry =           5
  In of MODEL   73
    1    H    GLY  16           H        GLY  16  13.478  -6.832   4.147
    2    HA3  GLY  16           HA2      GLY  16  12.249  -5.099   6.014
    3    HA2  GLY  16           HA3      GLY  16  12.889  -6.699   6.372

  No H/Q in entry =           3
  In of MODEL   73
    1    H    GLN  17           H        GLN  17  15.590  -6.330   5.756
    2    HA   GLN  17           HA       GLN  17  16.550  -5.095   8.128
    3    HB2  GLN  17           HB2      GLN  17  17.803  -6.867   6.948
    4    HB3  GLN  17           HB3      GLN  17  18.061  -5.775   5.586
    5    HG2  GLN  17           HG2      GLN  17  19.262  -4.209   7.076
    6    HG3  GLN  17           HG3      GLN  17  19.030  -5.322   8.423
    7   HE21  GLN  17          HE21      GLN  17  20.811  -6.645   8.776
    8   HE22  GLN  17          HE22      GLN  17  21.901  -7.152   7.579

  No H/Q in entry =           8
  In of MODEL   73
    1    H    ALA  18           H        ALA  18  16.319  -4.022   4.769
    2    HA   ALA  18           HA       ALA  18  17.723  -1.609   4.984
    3    HB2  ALA  18           HB1      ALA  18  16.605  -2.840   2.926
    4    HB3  ALA  18           HB2      ALA  18  16.845  -1.094   2.908
    5    HB1  ALA  18           HB3      ALA  18  15.258  -1.761   3.291

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ARG  19           H        ARG  19  14.235  -2.245   5.410
    2    HA   ARG  19           HA       ARG  19  13.537   0.395   6.130
    3    HB2  ARG  19           HB2      ARG  19  11.875  -1.379   5.558
    4    HB3  ARG  19           HB3      ARG  19  12.241  -2.172   7.092
    5    HG2  ARG  19           HG2      ARG  19  11.513  -0.190   8.337
    6    HG3  ARG  19           HG3      ARG  19  11.238   0.682   6.830
    7    HD2  ARG  19           HD2      ARG  19   9.115  -0.144   7.668
    8    HD3  ARG  19           HD3      ARG  19   9.534  -1.018   6.189
    9    HE   ARG  19           HE       ARG  19  10.531  -2.546   8.286
   10   HH21  ARG  19          HH11      ARG  19   9.313  -4.203   9.236
   11   HH22  ARG  19          HH12      ARG  19   7.591  -4.199   9.079
   12   HH11  ARG  19          HH21      ARG  19   7.510  -1.296   7.216
   13   HH12  ARG  19          HH22      ARG  19   6.571  -2.554   7.931

  No H/Q in entry =          13
  In of MODEL   73
    1    H    SER  20           H        SER  20  14.450  -2.422   8.083
    2    HA   SER  20           HA       SER  20  14.173  -1.325  10.622
    3    HB2  SER  20           HB2      SER  20  14.710  -3.701  10.222
    4    HB3  SER  20           HB3      SER  20  16.320  -3.242   9.675
    5    HG   SER  20           HG       SER  20  15.322  -2.450  12.195

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LEU  21           H        LEU  21  16.997  -1.225   8.462
    2    HA   LEU  21           HA       LEU  21  18.665   0.285  10.186
    3    HB2  LEU  21           HB2      LEU  21  18.621   0.007   7.173
    4    HB3  LEU  21           HB3      LEU  21  19.869   0.891   8.048
    5    HG   LEU  21           HG       LEU  21  19.185  -2.012   8.595
    6   HD11  LEU  21          HD11      LEU  21  21.192  -0.743   6.731
    7   HD13  LEU  21          HD12      LEU  21  20.037  -2.030   6.388
    8   HD12  LEU  21          HD13      LEU  21  21.446  -2.357   7.395
    9   HD21  LEU  21          HD21      LEU  21  21.262  -0.072   9.591
   10   HD23  LEU  21          HD22      LEU  21  21.686  -1.777   9.491
   11   HD22  LEU  21          HD23      LEU  21  20.345  -1.267  10.504

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ALA  22           H        ALA  22  16.367   1.221   7.648
    2    HA   ALA  22           HA       ALA  22  16.867   3.987   7.657
    3    HB3  ALA  22           HB1      ALA  22  15.468   2.725   5.991
    4    HB2  ALA  22           HB2      ALA  22  14.745   4.228   6.563
    5    HB1  ALA  22           HB3      ALA  22  14.182   2.680   7.196

  No H/Q in entry =           5
  In of MODEL   73
    1    H    TYR  23           H        TYR  23  14.411   2.137   9.513
    2    HA   TYR  23           HA       TYR  23  13.429   4.362  10.970
    3    HB2  TYR  23           HB2      TYR  23  12.222   2.231  10.960
    4    HB3  TYR  23           HB3      TYR  23  13.572   1.439  11.773
    5    HD1  TYR  23           HD1      TYR  23  11.030   4.143  12.159
    6    HD2  TYR  23           HD2      TYR  23  13.793   1.508  14.127
    7    HE1  TYR  23           HE1      TYR  23  10.111   4.824  14.361
    8    HE2  TYR  23           HE2      TYR  23  12.874   2.189  16.328
    9    HH   TYR  23           HH       TYR  23  11.651   4.241  17.253

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ALA  24           H        ALA  24  16.110   2.122  11.586
    2    HA   ALA  24           HA       ALA  24  16.788   3.127  14.143
    3    HB1  ALA  24           HB1      ALA  24  18.167   1.353  13.968
    4    HB3  ALA  24           HB2      ALA  24  19.173   2.287  12.861
    5    HB2  ALA  24           HB3      ALA  24  17.887   1.261  12.230

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ALA  25           H        ALA  25  17.706   4.068  10.857
    2    HA   ALA  25           HA       ALA  25  19.630   6.028  11.486
    3    HB1  ALA  25           HB1      ALA  25  18.908   5.070   9.177
    4    HB3  ALA  25           HB2      ALA  25  19.388   6.764   9.265
    5    HB2  ALA  25           HB3      ALA  25  17.678   6.334   9.210

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LEU  26           H        LEU  26  16.110   6.211  11.153
    2    HA   LEU  26           HA       LEU  26  15.853   8.990  11.606
    3    HB2  LEU  26           HB2      LEU  26  14.000   7.730  10.693
    4    HB3  LEU  26           HB3      LEU  26  13.935   6.701  12.119
    5    HG   LEU  26           HG       LEU  26  13.314   8.651  13.504
    6   HD12  LEU  26          HD11      LEU  26  12.616  10.743  12.184
    7   HD11  LEU  26          HD12      LEU  26  13.594  10.102  10.866
    8   HD13  LEU  26          HD13      LEU  26  14.346  10.497  12.412
    9   HD21  LEU  26          HD21      LEU  26  11.623   8.316  11.008
   10   HD23  LEU  26          HD22      LEU  26  11.066   9.007  12.529
   11   HD22  LEU  26          HD23      LEU  26  11.539   7.311  12.455

  No H/Q in entry =          11
  In of MODEL   73
    1    H    LYS  27           H        LYS  27  15.798   6.210  13.800
    2    HA   LYS  27           HA       LYS  27  15.208   7.569  16.173
    3    HB2  LYS  27           HB2      LYS  27  15.265   5.094  15.908
    4    HB3  LYS  27           HB3      LYS  27  17.027   5.168  15.850
    5    HG2  LYS  27           HG2      LYS  27  17.083   6.155  18.099
    6    HG3  LYS  27           HG3      LYS  27  15.316   6.152  18.159
    7    HD2  LYS  27           HD2      LYS  27  15.320   3.684  17.923
    8    HD3  LYS  27           HD3      LYS  27  17.084   3.696  17.897
    9    HE2  LYS  27           HE2      LYS  27  17.124   4.686  20.153
   10    HE3  LYS  27           HE3      LYS  27  15.358   4.704  20.182
   11    HZ3  LYS  27           HZ1      LYS  27  16.180   2.762  21.327
   12    HZ2  LYS  27           HZ2      LYS  27  17.091   2.294  19.968
   13    HZ1  LYS  27           HZ3      LYS  27  15.392   2.278  19.903

  No H/Q in entry =          13
  In of MODEL   73
    1    H    GLN  28           H        GLN  28  18.318   7.024  14.556
    2    HA   GLN  28           HA       GLN  28  20.005   8.128  16.532
    3    HB2  GLN  28           HB2      GLN  28  20.270   8.089  13.515
    4    HB3  GLN  28           HB3      GLN  28  21.560   8.569  14.617
    5    HG2  GLN  28           HG2      GLN  28  20.167   5.877  14.656
    6    HG3  GLN  28           HG3      GLN  28  21.745   6.184  13.934
    7   HE21  GLN  28          HE21      GLN  28  20.505   4.829  16.623
    8   HE22  GLN  28          HE22      GLN  28  21.685   5.266  17.762

  No H/Q in entry =           8
  In of MODEL   73
    1    H    ALA  29           H        ALA  29  18.214   9.590  13.854
    2    HA   ALA  29           HA       ALA  29  19.185  12.222  14.098
    3    HB2  ALA  29           HB1      ALA  29  17.467  12.839  12.641
    4    HB1  ALA  29           HB2      ALA  29  16.342  11.652  13.301
    5    HB3  ALA  29           HB3      ALA  29  17.670  11.125  12.267

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LYS  30           H        LYS  30  16.439  10.591  15.642
    2    HA   LYS  30           HA       LYS  30  15.411  12.833  17.007
    3    HB2  LYS  30           HB2      LYS  30  15.337   9.891  17.712
    4    HB3  LYS  30           HB3      LYS  30  14.465  11.132  18.613
    5    HG2  LYS  30           HG2      LYS  30  13.315  11.805  16.504
    6    HG3  LYS  30           HG3      LYS  30  14.128  10.478  15.670
    7    HD2  LYS  30           HD2      LYS  30  13.086   8.859  17.208
    8    HD3  LYS  30           HD3      LYS  30  12.284  10.176  18.065
    9    HE2  LYS  30           HE2      LYS  30  11.092  10.795  15.982
   10    HE3  LYS  30           HE3      LYS  30  11.875   9.450  15.145
   11    HZ2  LYS  30           HZ1      LYS  30   9.578   9.016  16.044
   12    HZ1  LYS  30           HZ2      LYS  30  10.258   9.076  17.605
   13    HZ3  LYS  30           HZ3      LYS  30  10.770   7.896  16.491

  No H/Q in entry =          13
  In of MODEL   73
    1    H    GLN  31           H        GLN  31  18.101  10.693  17.723
    2    HA   GLN  31           HA       GLN  31  18.439  11.711  20.414
    3    HB2  GLN  31           HB2      GLN  31  20.466  10.162  18.793
    4    HB3  GLN  31           HB3      GLN  31  20.345  10.285  20.548
    5    HG2  GLN  31           HG2      GLN  31  17.835   9.306  19.800
    6    HG3  GLN  31           HG3      GLN  31  18.937   8.473  18.711
    7   HE21  GLN  31          HE21      GLN  31  17.425   7.311  21.000
    8   HE22  GLN  31          HE22      GLN  31  18.596   6.663  22.041

  No H/Q in entry =           8
  In of MODEL   73
    1    H    GLY  32           H        GLY  32  18.920  13.034  17.443
    2    HA3  GLY  32           HA2      GLY  32  19.878  15.089  16.921
    3    HA2  GLY  32           HA3      GLY  32  20.648  15.102  18.503

  No H/Q in entry =           3
  In of MODEL   73
    1    H    ASP  33           H        ASP  33  21.087  12.214  16.722
    2    HA   ASP  33           HA       ASP  33  23.901  12.920  16.233
    3    HB2  ASP  33           HB2      ASP  33  22.421  10.288  16.362
    4    HB3  ASP  33           HB3      ASP  33  24.102  10.422  15.853

  No H/Q in entry =           4
  In of MODEL   73
    1    H    PHE  34           H        PHE  34  23.390  14.237  14.356
    2    HA   PHE  34           HA       PHE  34  22.033  13.238  12.080
    3    HB2  PHE  34           HB2      PHE  34  24.142  15.396  12.292
    4    HB3  PHE  34           HB3      PHE  34  23.149  15.094  10.868
    5    HD1  PHE  34           HD1      PHE  34  23.402  17.031  13.780
    6    HD2  PHE  34           HD2      PHE  34  20.528  14.884  11.418
    7    HE1  PHE  34           HE1      PHE  34  21.579  18.409  14.742
    8    HE2  PHE  34           HE2      PHE  34  18.709  16.262  12.383
    9    HZ   PHE  34           HZ       PHE  34  19.237  18.025  14.040

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ALA  35           H        ALA  35  25.417  13.088  13.060
    2    HA   ALA  35           HA       ALA  35  26.511  12.279  10.594
    3    HB3  ALA  35           HB1      ALA  35  28.219  11.128  12.300
    4    HB2  ALA  35           HB2      ALA  35  27.353  12.144  13.452
    5    HB1  ALA  35           HB3      ALA  35  28.171  12.877  12.073

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ALA  36           H        ALA  36  25.440  10.311  13.368
    2    HA   ALA  36           HA       ALA  36  25.942   7.829  12.089
    3    HB2  ALA  36           HB1      ALA  36  25.537   7.078  14.168
    4    HB3  ALA  36           HB2      ALA  36  23.842   7.553  14.032
    5    HB1  ALA  36           HB3      ALA  36  25.035   8.699  14.644

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ALA  37           H        ALA  37  23.098   9.922  12.246
    2    HA   ALA  37           HA       ALA  37  21.252   8.131  11.085
    3    HB3  ALA  37           HB1      ALA  37  21.446  11.097  11.376
    4    HB1  ALA  37           HB2      ALA  37  20.151  10.003  11.859
    5    HB2  ALA  37           HB3      ALA  37  20.320  10.477  10.168

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LYS  38           H        LYS  38  23.310  10.617   9.589
    2    HA   LYS  38           HA       LYS  38  22.654  10.181   6.917
    3    HB2  LYS  38           HB2      LYS  38  24.457  11.760   8.347
    4    HB3  LYS  38           HB3      LYS  38  25.493  10.783   7.313
    5    HG2  LYS  38           HG2      LYS  38  24.303  11.539   5.327
    6    HG3  LYS  38           HG3      LYS  38  23.106  12.379   6.318
    7    HD2  LYS  38           HD2      LYS  38  24.688  13.997   7.057
    8    HD3  LYS  38           HD3      LYS  38  26.056  13.027   6.510
    9    HE2  LYS  38           HE2      LYS  38  25.663  14.894   4.961
   10    HE3  LYS  38           HE3      LYS  38  25.341  13.352   4.160
   11    HZ3  LYS  38           HZ1      LYS  38  23.138  13.770   4.048
   12    HZ2  LYS  38           HZ2      LYS  38  23.641  15.392   4.131
   13    HZ1  LYS  38           HZ3      LYS  38  23.088  14.601   5.528

  No H/Q in entry =          13
  In of MODEL   73
    1    H    ALA  39           H        ALA  39  25.203   8.614   8.853
    2    HA   ALA  39           HA       ALA  39  26.275   7.039   6.774
    3    HB2  ALA  39           HB1      ALA  39  26.222   6.075   9.619
    4    HB1  ALA  39           HB2      ALA  39  27.153   7.512   9.195
    5    HB3  ALA  39           HB3      ALA  39  27.518   5.966   8.428

  No H/Q in entry =           5
  In of MODEL   73
    1    H    MET  40           H        MET  40  23.689   6.391   9.094
    2    HA   MET  40           HA       MET  40  23.274   3.680   8.363
    3    HB2  MET  40           HB2      MET  40  21.443   5.701   9.671
    4    HB3  MET  40           HB3      MET  40  21.056   3.987   9.499
    5    HG2  MET  40           HG2      MET  40  23.605   4.960  10.819
    6    HG3  MET  40           HG3      MET  40  22.121   4.666  11.725
    7    HE3  MET  40           HE1      MET  40  21.605   1.026  11.905
    8    HE2  MET  40           HE2      MET  40  20.713   2.317  11.105
    9    HE1  MET  40           HE3      MET  40  21.463   2.614  12.671

  No H/Q in entry =           9
  In of MODEL   73
    1    H    MET  41           H        MET  41  21.812   6.715   7.188
    2    HA   MET  41           HA       MET  41  19.856   5.495   5.532
    3    HB2  MET  41           HB2      MET  41  21.299   8.104   5.007
    4    HB3  MET  41           HB3      MET  41  19.772   7.591   4.301
    5    HG2  MET  41           HG2      MET  41  19.050   7.393   6.858
    6    HG3  MET  41           HG3      MET  41  20.345   8.567   7.069
    7    HE2  MET  41           HE1      MET  41  19.738   9.847   3.737
    8    HE1  MET  41           HE2      MET  41  20.701  10.299   5.141
    9    HE3  MET  41           HE3      MET  41  19.410  11.362   4.587

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ASP  42           H        ASP  42  23.212   6.461   4.951
    2    HA   ASP  42           HA       ASP  42  23.287   5.988   2.193
    3    HB2  ASP  42           HB2      ASP  42  25.039   7.009   3.947
    4    HB3  ASP  42           HB3      ASP  42  25.717   5.392   3.814

  No H/Q in entry =           4
  In of MODEL   73
    1    H    GLN  43           H        GLN  43  24.062   3.844   4.907
    2    HA   GLN  43           HA       GLN  43  24.742   1.595   3.319
    3    HB2  GLN  43           HB2      GLN  43  23.741   1.765   6.171
    4    HB3  GLN  43           HB3      GLN  43  24.333   0.284   5.411
    5    HG2  GLN  43           HG2      GLN  43  26.476   1.522   4.882
    6    HG3  GLN  43           HG3      GLN  43  25.884   2.842   5.887
    7   HE21  GLN  43          HE21      GLN  43  28.138   1.898   6.905
    8   HE22  GLN  43          HE22      GLN  43  27.889   0.812   8.183

  No H/Q in entry =           8
  In of MODEL   73
    1    H    SER  44           H        SER  44  21.683   2.688   4.729
    2    HA   SER  44           HA       SER  44  20.139   0.425   4.070
    3    HB2  SER  44           HB2      SER  44  19.673   2.948   5.219
    4    HB3  SER  44           HB3      SER  44  18.628   2.891   3.803
    5    HG   SER  44           HG       SER  44  17.561   1.934   5.535

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ARG  45           H        ARG  45  20.827   3.399   2.259
    2    HA   ARG  45           HA       ARG  45  19.290   2.893  -0.033
    3    HB2  ARG  45           HB2      ARG  45  20.410   5.044   0.542
    4    HB3  ARG  45           HB3      ARG  45  21.961   4.309   0.143
    5    HG2  ARG  45           HG2      ARG  45  21.164   3.893  -2.164
    6    HG3  ARG  45           HG3      ARG  45  19.625   4.651  -1.765
    7    HD2  ARG  45           HD2      ARG  45  20.853   6.764  -1.191
    8    HD3  ARG  45           HD3      ARG  45  22.354   6.009  -1.772
    9    HE   ARG  45           HE       ARG  45  20.410   5.746  -3.792
   10   HH21  ARG  45          HH11      ARG  45  20.371   7.115  -5.555
   11   HH22  ARG  45          HH12      ARG  45  21.109   8.675  -5.457
   12   HH11  ARG  45          HH21      ARG  45  22.122   8.267  -2.180
   13   HH12  ARG  45          HH22      ARG  45  22.099   9.326  -3.543

  No H/Q in entry =          13
  In of MODEL   73
    1    H    MET  46           H        MET  46  22.671   2.061   0.686
    2    HA   MET  46           HA       MET  46  23.270   0.875  -1.803
    3    HB2  MET  46           HB2      MET  46  24.405   0.560   0.976
    4    HB3  MET  46           HB3      MET  46  25.063  -0.320  -0.408
    5    HG2  MET  46           HG2      MET  46  25.483   1.786  -1.586
    6    HG3  MET  46           HG3      MET  46  24.749   2.695  -0.270
    7    HE1  MET  46           HE1      MET  46  27.229   0.309  -1.457
    8    HE3  MET  46           HE2      MET  46  27.542  -0.446   0.102
    9    HE2  MET  46           HE3      MET  46  28.744   0.633  -0.604

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ALA  47           H        ALA  47  21.930  -0.474   1.185
    2    HA   ALA  47           HA       ALA  47  21.902  -3.188   0.383
    3    HB2  ALA  47           HB1      ALA  47  21.538  -2.731   2.691
    4    HB3  ALA  47           HB2      ALA  47  20.004  -3.353   2.085
    5    HB1  ALA  47           HB3      ALA  47  20.214  -1.619   2.341

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LEU  48           H        LEU  48  19.515  -0.589   0.047
    2    HA   LEU  48           HA       LEU  48  17.477  -2.147  -1.185
    3    HB2  LEU  48           HB2      LEU  48  18.096   0.815  -1.307
    4    HB3  LEU  48           HB3      LEU  48  16.627   0.086  -1.960
    5    HG   LEU  48           HG       LEU  48  17.510  -0.204   0.921
    6   HD13  LEU  48          HD11      LEU  48  17.064   2.091   0.737
    7   HD12  LEU  48          HD12      LEU  48  15.518   1.426   1.261
    8   HD11  LEU  48          HD13      LEU  48  15.768   1.850  -0.433
    9   HD22  LEU  48          HD21      LEU  48  15.998  -1.937   0.555
   10   HD21  LEU  48          HD22      LEU  48  15.103  -1.045  -0.676
   11   HD23  LEU  48          HD23      LEU  48  14.901  -0.642   1.029

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ASN  49           H        ASN  49  20.131  -0.188  -2.441
    2    HA   ASN  49           HA       ASN  49  19.456  -0.281  -5.159
    3    HB2  ASN  49           HB2      ASN  49  21.122   1.260  -4.276
    4    HB3  ASN  49           HB3      ASN  49  22.165  -0.080  -3.812
    5   HD21  ASN  49          HD21      ASN  49  20.669   1.429  -6.697
    6   HD22  ASN  49          HD22      ASN  49  21.906   0.974  -7.764

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLU  50           H        GLU  50  21.484  -2.451  -3.214
    2    HA   GLU  50           HA       GLU  50  22.185  -4.200  -5.346
    3    HB2  GLU  50           HB2      GLU  50  23.403  -4.160  -3.191
    4    HB3  GLU  50           HB3      GLU  50  21.975  -4.804  -2.381
    5    HG2  GLU  50           HG2      GLU  50  22.075  -6.837  -3.740
    6    HG3  GLU  50           HG3      GLU  50  23.435  -6.189  -4.654

  No H/Q in entry =           6
  In of MODEL   73
    1    H    ALA  51           H        ALA  51  19.551  -4.164  -2.995
    2    HA   ALA  51           HA       ALA  51  18.406  -6.650  -3.739
    3    HB3  ALA  51           HB1      ALA  51  16.822  -6.162  -2.169
    4    HB1  ALA  51           HB2      ALA  51  16.585  -4.518  -2.767
    5    HB2  ALA  51           HB3      ALA  51  17.958  -4.888  -1.724

  No H/Q in entry =           5
  In of MODEL   73
    1    H    HIS  52           H        HIS  52  17.772  -3.310  -4.771
    2    HA   HIS  52           HA       HIS  52  15.647  -3.862  -6.550
    3    HB2  HIS  52           HB2      HIS  52  16.213  -1.590  -5.790
    4    HB3  HIS  52           HB3      HIS  52  17.728  -1.666  -6.689
    5    HD1  HIS  52           HD1      HIS  52  17.477  -1.942  -9.359
    6    HD2  HIS  52           HD2      HIS  52  14.008  -0.848  -7.324
    7    HE1  HIS  52           HE1      HIS  52  15.870  -1.060 -11.107
    8    HE2  HIS  52           HE2      HIS  52  13.750  -0.387  -9.882

  No H/Q in entry =           8
  In of MODEL   73
    1    H    LEU  53           H        LEU  53  19.161  -3.828  -7.016
    2    HA   LEU  53           HA       LEU  53  19.195  -4.145  -9.817
    3    HB2  LEU  53           HB2      LEU  53  21.159  -4.894  -7.664
    4    HB3  LEU  53           HB3      LEU  53  21.463  -5.259  -9.361
    5    HG   LEU  53           HG       LEU  53  20.770  -2.468  -8.386
    6   HD12  LEU  53          HD11      LEU  53  23.251  -2.051  -8.673
    7   HD11  LEU  53          HD12      LEU  53  23.464  -3.799  -8.763
    8   HD13  LEU  53          HD13      LEU  53  22.833  -3.062  -7.294
    9   HD22  LEU  53          HD21      LEU  53  20.466  -2.500 -10.725
   10   HD21  LEU  53          HD22      LEU  53  21.759  -3.669 -10.969
   11   HD23  LEU  53          HD23      LEU  53  22.148  -2.001 -10.594

  No H/Q in entry =          11
  In of MODEL   73
    1    H    VAL  54           H        VAL  54  19.136  -6.531  -7.188
    2    HA   VAL  54           HA       VAL  54  19.270  -8.825  -8.847
    3    HB   VAL  54           HB       VAL  54  18.138  -8.412  -6.069
    4   HG12  VAL  54          HG11      VAL  54  18.493 -11.026  -6.066
    5   HG11  VAL  54          HG12      VAL  54  18.289 -10.862  -7.809
    6   HG13  VAL  54          HG13      VAL  54  17.005 -10.345  -6.719
    7   HG22  VAL  54          HG21      VAL  54  20.453  -8.174  -5.869
    8   HG21  VAL  54          HG22      VAL  54  20.790  -9.263  -7.212
    9   HG23  VAL  54          HG23      VAL  54  20.283  -9.915  -5.654

  No H/Q in entry =           9
  In of MODEL   73
    1    H    GLN  55           H        GLN  55  16.532  -6.954  -7.540
    2    HA   GLN  55           HA       GLN  55  14.521  -8.643  -8.592
    3    HB2  GLN  55           HB2      GLN  55  13.770  -7.125  -6.960
    4    HB3  GLN  55           HB3      GLN  55  14.539  -5.748  -7.745
    5    HG2  GLN  55           HG2      GLN  55  12.796  -5.446  -9.218
    6    HG3  GLN  55           HG3      GLN  55  12.494  -7.171  -9.383
    7   HE21  GLN  55          HE21      GLN  55  10.502  -7.744  -8.558
    8   HE22  GLN  55          HE22      GLN  55   9.731  -6.997  -7.243

  No H/Q in entry =           8
  In of MODEL   73
    1    H    THR  56           H        THR  56  16.212  -5.824  -9.971
    2    HA   THR  56           HA       THR  56  14.747  -5.482 -12.306
    3    HB   THR  56           HB       THR  56  17.750  -5.287 -11.952
    4    HG1  THR  56           HG1      THR  56  15.631  -3.788 -11.173
    5   HG23  THR  56          HG21      THR  56  17.422  -5.321 -14.280
    6   HG22  THR  56          HG22      THR  56  17.393  -3.602 -13.891
    7   HG21  THR  56          HG23      THR  56  15.881  -4.469 -14.165

  No H/Q in entry =           7
  In of MODEL   73
    1    H    LYS  57           H        LYS  57  17.431  -7.745 -11.718
    2    HA   LYS  57           HA       LYS  57  17.422  -8.943 -14.295
    3    HB2  LYS  57           HB2      LYS  57  19.233  -9.171 -12.568
    4    HB3  LYS  57           HB3      LYS  57  18.150 -10.178 -11.617
    5    HG2  LYS  57           HG2      LYS  57  18.044 -11.822 -13.432
    6    HG3  LYS  57           HG3      LYS  57  19.080 -10.814 -14.433
    7    HD2  LYS  57           HD2      LYS  57  20.898 -11.033 -12.768
    8    HD3  LYS  57           HD3      LYS  57  19.866 -12.064 -11.780
    9    HE2  LYS  57           HE2      LYS  57  19.717 -13.700 -13.632
   10    HE3  LYS  57           HE3      LYS  57  20.757 -12.680 -14.626
   11    HZ2  LYS  57           HZ1      LYS  57  21.598 -14.630 -12.946
   12    HZ1  LYS  57           HZ2      LYS  57  21.860 -13.219 -12.038
   13    HZ3  LYS  57           HZ3      LYS  57  22.563 -13.386 -13.575

  No H/Q in entry =          13
  In of MODEL   73
    1    H    LEU  58           H        LEU  58  15.679  -9.629 -11.301
    2    HA   LEU  58           HA       LEU  58  14.479 -12.020 -12.221
    3    HB2  LEU  58           HB2      LEU  58  13.681 -10.121 -10.020
    4    HB3  LEU  58           HB3      LEU  58  12.891 -11.670 -10.327
    5    HG   LEU  58           HG       LEU  58  15.866 -11.353  -9.802
    6   HD11  LEU  58          HD11      LEU  58  13.518 -11.799  -7.985
    7   HD13  LEU  58          HD12      LEU  58  14.961 -10.816  -7.738
    8   HD12  LEU  58          HD13      LEU  58  15.058 -12.571  -7.602
    9   HD22  LEU  58          HD21      LEU  58  15.765 -13.417 -10.826
   10   HD21  LEU  58          HD22      LEU  58  14.057 -13.648 -10.448
   11   HD23  LEU  58          HD23      LEU  58  15.282 -13.932  -9.210

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  59           H        ILE  59  13.758  -8.692 -12.901
    2    HA   ILE  59           HA       ILE  59  11.042  -9.377 -13.814
    3    HB   ILE  59           HB       ILE  59  11.825  -7.085 -12.618
    4   HG12  ILE  59          HG12      ILE  59   9.906  -6.976 -14.955
    5   HG13  ILE  59          HG13      ILE  59   9.504  -7.764 -13.451
    6   HG21  ILE  59          HG21      ILE  59  13.352  -6.666 -14.682
    7   HG23  ILE  59          HG22      ILE  59  12.358  -5.340 -14.122
    8   HG22  ILE  59          HG23      ILE  59  11.872  -6.283 -15.527
    9   HD11  ILE  59          HD11      ILE  59  10.400  -4.892 -13.671
   10   HD13  ILE  59          HD12      ILE  59   9.851  -5.700 -12.204
   11   HD12  ILE  59          HD13      ILE  59   8.717  -5.399 -13.523

  No H/Q in entry =          11
  In of MODEL   73
    1    H    GLU  60           H        GLU  60  14.222  -8.486 -15.105
    2    HA   GLU  60           HA       GLU  60  13.411  -8.099 -17.806
    3    HB2  GLU  60           HB2      GLU  60  15.580  -7.318 -17.032
    4    HB3  GLU  60           HB3      GLU  60  16.068  -8.963 -16.633
    5    HG2  GLU  60           HG2      GLU  60  15.218  -8.275 -19.439
    6    HG3  GLU  60           HG3      GLU  60  16.863  -7.947 -18.900

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLY  61           H        GLY  61  14.443 -10.965 -15.997
    2    HA3  GLY  61           HA2      GLY  61  13.900 -12.623 -18.391
    3    HA2  GLY  61           HA3      GLY  61  14.951 -13.089 -17.058

  No H/Q in entry =           3
  In of MODEL   73
    1    H    ASP  62           H        ASP  62  11.815 -11.583 -16.660
    2    HA   ASP  62           HA       ASP  62  10.939 -13.658 -14.896
    3    HB2  ASP  62           HB2      ASP  62   8.870 -12.316 -14.770
    4    HB3  ASP  62           HB3      ASP  62  10.315 -11.345 -14.501

  No H/Q in entry =           4
  In of MODEL   73
    1    H    ALA  63           H        ALA  63  11.196 -15.420 -16.648
    2    HA   ALA  63           HA       ALA  63   9.292 -15.588 -18.785
    3    HB3  ALA  63           HB1      ALA  63   9.956 -17.999 -18.823
    4    HB2  ALA  63           HB2      ALA  63  10.904 -17.723 -17.364
    5    HB1  ALA  63           HB3      ALA  63  11.334 -16.899 -18.863

  No H/Q in entry =           5
  In of MODEL   73
    1    H    GLY  64           H        GLY  64   9.389 -16.750 -15.460
    2    HA3  GLY  64           HA2      GLY  64   7.704 -17.392 -14.028
    3    HA2  GLY  64           HA3      GLY  64   6.542 -16.855 -15.233

  No H/Q in entry =           3
  In of MODEL   73
    1    H    GLU  65           H        GLU  65   5.739 -19.019 -13.976
    2    HA   GLU  65           HA       GLU  65   6.744 -21.488 -14.895
    3    HB2  GLU  65           HB2      GLU  65   4.051 -20.724 -13.780
    4    HB3  GLU  65           HB3      GLU  65   4.511 -22.384 -14.149
    5    HG2  GLU  65           HG2      GLU  65   6.421 -22.222 -12.624
    6    HG3  GLU  65           HG3      GLU  65   6.029 -20.538 -12.283

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLY  66           H        GLY  66   4.182 -19.440 -16.078
    2    HA3  GLY  66           HA2      GLY  66   3.427 -21.194 -18.249
    3    HA2  GLY  66           HA3      GLY  66   2.759 -19.614 -17.893

  No H/Q in entry =           3
  In of MODEL   73
    1    H    LYS  67           H        LYS  67   3.269 -20.422 -20.458
    2    HA   LYS  67           HA       LYS  67   5.786 -19.763 -21.494
    3    HB2  LYS  67           HB2      LYS  67   3.168 -19.600 -22.981
    4    HB3  LYS  67           HB3      LYS  67   4.772 -19.950 -23.638
    5    HG2  LYS  67           HG2      LYS  67   3.076 -21.672 -21.828
    6    HG3  LYS  67           HG3      LYS  67   3.756 -22.083 -23.400
    7    HD2  LYS  67           HD2      LYS  67   6.057 -21.812 -22.327
    8    HD3  LYS  67           HD3      LYS  67   5.219 -21.769 -20.773
    9    HE2  LYS  67           HE2      LYS  67   4.117 -23.955 -21.406
   10    HE3  LYS  67           HE3      LYS  67   5.192 -24.017 -22.803
   11    HZ1  LYS  67           HZ1      LYS  67   6.311 -23.608 -20.114
   12    HZ3  LYS  67           HZ2      LYS  67   7.039 -24.285 -21.490
   13    HZ2  LYS  67           HZ3      LYS  67   5.882 -25.170 -20.615

  No H/Q in entry =          13
  In of MODEL   73
    1    H    MET  68           H        MET  68   2.877 -17.826 -21.222
    2    HA   MET  68           HA       MET  68   4.303 -15.410 -22.105
    3    HB2  MET  68           HB2      MET  68   1.355 -16.028 -21.900
    4    HB3  MET  68           HB3      MET  68   2.022 -14.475 -22.401
    5    HG2  MET  68           HG2      MET  68   2.562 -17.126 -23.768
    6    HG3  MET  68           HG3      MET  68   1.454 -15.885 -24.355
    7    HE3  MET  68           HE1      MET  68   3.352 -13.075 -25.615
    8    HE2  MET  68           HE2      MET  68   3.104 -13.016 -23.871
    9    HE1  MET  68           HE3      MET  68   1.873 -13.737 -24.905

  No H/Q in entry =           9
  In of MODEL   73
    1    H    LYS  69           H        LYS  69   3.390 -16.842 -19.199
    2    HA   LYS  69           HA       LYS  69   2.692 -14.341 -17.879
    3    HB2  LYS  69           HB2      LYS  69   2.702 -17.206 -16.947
    4    HB3  LYS  69           HB3      LYS  69   2.367 -15.850 -15.867
    5    HG2  LYS  69           HG2      LYS  69   0.539 -15.110 -17.340
    6    HG3  LYS  69           HG3      LYS  69   0.875 -16.449 -18.438
    7    HD2  LYS  69           HD2      LYS  69   0.366 -18.055 -16.632
    8    HD3  LYS  69           HD3      LYS  69   0.011 -16.711 -15.543
    9    HE2  LYS  69           HE2      LYS  69  -1.419 -17.173 -18.175
   10    HE3  LYS  69           HE3      LYS  69  -2.036 -17.710 -16.613
   11    HZ2  LYS  69           HZ1      LYS  69  -1.551 -14.934 -17.517
   12    HZ1  LYS  69           HZ2      LYS  69  -1.796 -15.333 -15.885
   13    HZ3  LYS  69           HZ3      LYS  69  -3.018 -15.629 -17.028

  No H/Q in entry =          13
  In of MODEL   73
    1    H    VAL  70           H        VAL  70   3.569 -14.451 -15.355
    2    HA   VAL  70           HA       VAL  70   6.527 -14.576 -15.477
    3    HB   VAL  70           HB       VAL  70   6.601 -12.482 -14.170
    4   HG13  VAL  70          HG11      VAL  70   6.766 -12.374 -16.622
    5   HG12  VAL  70          HG12      VAL  70   5.905 -10.964 -16.004
    6   HG11  VAL  70          HG13      VAL  70   5.009 -12.288 -16.746
    7   HG23  VAL  70          HG21      VAL  70   4.465 -11.125 -14.026
    8   HG22  VAL  70          HG22      VAL  70   4.458 -12.581 -13.033
    9   HG21  VAL  70          HG23      VAL  70   3.584 -12.555 -14.564

  No H/Q in entry =           9
  In of MODEL   73
    1    H    SER  71           H        SER  71   7.518 -14.635 -13.310
    2    HA   SER  71           HA       SER  71   6.423 -16.639 -11.642
    3    HB2  SER  71           HB2      SER  71   8.854 -16.084 -11.794
    4    HB3  SER  71           HB3      SER  71   8.531 -14.583 -10.930
    5    HG   SER  71           HG       SER  71   8.223 -17.256 -10.048

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LEU  72           H        LEU  72   5.060 -16.538  -9.964
    2    HA   LEU  72           HA       LEU  72   3.485 -14.245  -9.507
    3    HB2  LEU  72           HB2      LEU  72   3.820 -16.798  -7.940
    4    HB3  LEU  72           HB3      LEU  72   2.641 -15.555  -7.526
    5    HG   LEU  72           HG       LEU  72   2.786 -16.846 -10.270
    6   HD13  LEU  72          HD11      LEU  72   2.285 -18.556  -8.569
    7   HD12  LEU  72          HD12      LEU  72   0.849 -18.202  -9.528
    8   HD11  LEU  72          HD13      LEU  72   1.012 -17.532  -7.906
    9   HD22  LEU  72          HD21      LEU  72   1.536 -14.868 -10.496
   10   HD21  LEU  72          HD22      LEU  72   0.870 -14.972  -8.874
   11   HD23  LEU  72          HD23      LEU  72   0.284 -16.052 -10.136

  No H/Q in entry =          11
  In of MODEL   73
    1    H    VAL  73           H        VAL  73   6.176 -15.646  -7.757
    2    HA   VAL  73           HA       VAL  73   6.116 -14.112  -5.425
    3    HB   VAL  73           HB       VAL  73   8.311 -14.894  -5.017
    4   HG12  VAL  73          HG11      VAL  73   7.011 -16.946  -6.827
    5   HG11  VAL  73          HG12      VAL  73   6.496 -16.624  -5.171
    6   HG13  VAL  73          HG13      VAL  73   8.110 -17.261  -5.488
    7   HG23  VAL  73          HG21      VAL  73   9.482 -16.054  -7.086
    8   HG22  VAL  73          HG22      VAL  73   9.631 -14.314  -6.843
    9   HG21  VAL  73          HG23      VAL  73   8.471 -14.944  -8.011

  No H/Q in entry =           9
  In of MODEL   73
    1    H    LEU  74           H        LEU  74   7.066 -13.208  -8.611
    2    HA   LEU  74           HA       LEU  74   8.991 -11.234  -8.136
    3    HB2  LEU  74           HB2      LEU  74   8.523 -11.992 -10.370
    4    HB3  LEU  74           HB3      LEU  74   6.852 -11.443 -10.255
    5    HG   LEU  74           HG       LEU  74   7.630  -9.107 -10.054
    6   HD11  LEU  74          HD11      LEU  74  10.325 -10.464 -10.162
    7   HD13  LEU  74          HD12      LEU  74   9.752  -9.259  -9.008
    8   HD12  LEU  74          HD13      LEU  74  10.128  -8.785 -10.665
    9   HD23  LEU  74          HD21      LEU  74   9.109 -10.199 -12.392
   10   HD22  LEU  74          HD22      LEU  74   7.960  -8.884 -12.294
   11   HD21  LEU  74          HD23      LEU  74   7.383 -10.535 -12.270

  No H/Q in entry =          11
  In of MODEL   73
    1    H    VAL  75           H        VAL  75   5.487 -10.894  -8.460
    2    HA   VAL  75           HA       VAL  75   5.361  -8.139  -7.873
    3    HB   VAL  75           HB       VAL  75   3.303 -10.310  -7.469
    4   HG12  VAL  75          HG11      VAL  75   1.695  -8.379  -7.345
    5   HG11  VAL  75          HG12      VAL  75   3.067  -7.283  -7.319
    6   HG13  VAL  75          HG13      VAL  75   2.818  -8.404  -5.990
    7   HG23  VAL  75          HG21      VAL  75   3.589  -8.148  -9.582
    8   HG22  VAL  75          HG22      VAL  75   2.401  -9.449  -9.562
    9   HG21  VAL  75          HG23      VAL  75   4.108  -9.817  -9.809

  No H/Q in entry =           9
  In of MODEL   73
    1    H    GLU  76           H        GLU  76   5.162 -11.018  -5.760
    2    HA   GLU  76           HA       GLU  76   4.695  -9.661  -3.336
    3    HB2  GLU  76           HB2      GLU  76   4.567 -12.143  -3.605
    4    HB3  GLU  76           HB3      GLU  76   6.312 -12.196  -3.788
    5    HG2  GLU  76           HG2      GLU  76   6.604 -11.317  -1.508
    6    HG3  GLU  76           HG3      GLU  76   4.866 -11.209  -1.297

  No H/Q in entry =           6
  In of MODEL   73
    1    H    ALA  77           H        ALA  77   7.752 -10.530  -4.923
    2    HA   ALA  77           HA       ALA  77   9.445  -9.464  -2.922
    3    HB1  ALA  77           HB1      ALA  77  10.232 -11.002  -4.685
    4    HB2  ALA  77           HB2      ALA  77  11.195  -9.526  -4.635
    5    HB3  ALA  77           HB3      ALA  77   9.976  -9.740  -5.891

  No H/Q in entry =           5
  In of MODEL   73
    1    H    GLN  78           H        GLN  78   8.012  -8.066  -5.825
    2    HA   GLN  78           HA       GLN  78   9.334  -5.570  -5.733
    3    HB2  GLN  78           HB2      GLN  78   8.034  -6.502  -7.681
    4    HB3  GLN  78           HB3      GLN  78   6.554  -6.142  -6.794
    5    HG2  GLN  78           HG2      GLN  78   7.175  -3.764  -6.706
    6    HG3  GLN  78           HG3      GLN  78   8.661  -4.115  -7.587
    7   HE21  GLN  78          HE21      GLN  78   6.727  -2.317  -8.678
    8   HE22  GLN  78          HE22      GLN  78   6.031  -3.042 -10.046

  No H/Q in entry =           8
  In of MODEL   73
    1    H    LEU  79           H        LEU  79   6.340  -6.744  -4.279
    2    HA   LEU  79           HA       LEU  79   5.325  -4.349  -3.263
    3    HB2  LEU  79           HB2      LEU  79   4.036  -6.416  -3.196
    4    HB3  LEU  79           HB3      LEU  79   5.198  -7.141  -2.090
    5    HG   LEU  79           HG       LEU  79   4.639  -5.504  -0.359
    6   HD13  LEU  79          HD11      LEU  79   4.141  -3.496  -1.408
    7   HD12  LEU  79          HD12      LEU  79   2.526  -4.041  -0.956
    8   HD11  LEU  79          HD13      LEU  79   3.096  -4.257  -2.608
    9   HD23  LEU  79          HD21      LEU  79   2.060  -6.028  -0.249
   10   HD22  LEU  79          HD22      LEU  79   3.216  -7.353  -0.148
   11   HD21  LEU  79          HD23      LEU  79   2.387  -7.027  -1.667

  No H/Q in entry =          11
  In of MODEL   73
    1    H    HIS  80           H        HIS  80   7.547  -6.656  -1.696
    2    HA   HIS  80           HA       HIS  80   7.834  -5.109   0.670
    3    HB2  HIS  80           HB2      HIS  80   9.192  -7.458  -0.537
    4    HB3  HIS  80           HB3      HIS  80  10.101  -6.549   0.672
    5    HD1  HIS  80           HD1      HIS  80   9.635  -7.190   3.019
    6    HD2  HIS  80           HD2      HIS  80   6.410  -8.080   0.531
    7    HE1  HIS  80           HE1      HIS  80   7.887  -8.313   4.481
    8    HE2  HIS  80           HE2      HIS  80   5.915  -8.860   2.973

  No H/Q in entry =           8
  In of MODEL   73
    1    H    LEU  81           H        LEU  81   9.822  -5.364  -2.257
    2    HA   LEU  81           HA       LEU  81  11.852  -3.598  -1.394
    3    HB2  LEU  81           HB2      LEU  81  10.920  -4.403  -4.150
    4    HB3  LEU  81           HB3      LEU  81  12.330  -3.380  -3.870
    5    HG   LEU  81           HG       LEU  81  11.978  -6.105  -2.592
    6   HD12  LEU  81          HD11      LEU  81  13.789  -6.712  -4.355
    7   HD11  LEU  81          HD12      LEU  81  13.200  -5.295  -5.223
    8   HD13  LEU  81          HD13      LEU  81  12.107  -6.632  -4.876
    9   HD23  LEU  81          HD21      LEU  81  14.603  -5.760  -2.597
   10   HD22  LEU  81          HD22      LEU  81  13.621  -5.010  -1.340
   11   HD21  LEU  81          HD23      LEU  81  14.179  -4.052  -2.712

  No H/Q in entry =          11
  In of MODEL   73
    1    H    MET  82           H        MET  82   8.908  -2.996  -3.310
    2    HA   MET  82           HA       MET  82   9.414  -0.265  -3.816
    3    HB2  MET  82           HB2      MET  82   6.873  -1.887  -3.672
    4    HB3  MET  82           HB3      MET  82   6.851  -0.163  -4.037
    5    HG2  MET  82           HG2      MET  82   8.463  -2.220  -5.583
    6    HG3  MET  82           HG3      MET  82   6.886  -1.615  -6.085
    7    HE3  MET  82           HE1      MET  82   7.288   1.844  -7.262
    8    HE2  MET  82           HE2      MET  82   6.928   1.614  -5.552
    9    HE1  MET  82           HE3      MET  82   6.266   0.497  -6.741

  No H/Q in entry =           9
  In of MODEL   73
    1    H    THR  83           H        THR  83   7.658  -1.881  -1.198
    2    HA   THR  83           HA       THR  83   6.790   0.458   0.133
    3    HB   THR  83           HB       THR  83   6.688  -1.116   2.153
    4    HG1  THR  83           HG1      THR  83   7.464  -3.058   1.919
    5   HG22  THR  83          HG21      THR  83   5.041  -2.701   0.698
    6   HG21  THR  83          HG22      THR  83   5.245  -1.371  -0.437
    7   HG23  THR  83          HG23      THR  83   4.613  -1.062   1.181

  No H/Q in entry =           7
  In of MODEL   73
    1    H    SER  84           H        SER  84   9.640  -1.608   0.635
    2    HA   SER  84           HA       SER  84  10.700  -0.165   2.815
    3    HB2  SER  84           HB2      SER  84  11.959  -1.996   0.783
    4    HB3  SER  84           HB3      SER  84  12.906  -1.231   2.057
    5    HG   SER  84           HG       SER  84  10.651  -2.945   2.334

  No H/Q in entry =           5
  In of MODEL   73
    1    H    MET  85           H        MET  85  11.425   0.102  -0.678
    2    HA   MET  85           HA       MET  85  13.405   2.088  -0.442
    3    HB2  MET  85           HB2      MET  85  13.002   0.798  -2.504
    4    HB3  MET  85           HB3      MET  85  11.470   1.643  -2.724
    5    HG2  MET  85           HG2      MET  85  12.655   3.794  -2.860
    6    HG3  MET  85           HG3      MET  85  14.191   2.974  -2.597
    7    HE3  MET  85           HE1      MET  85  11.121   1.685  -5.154
    8    HE2  MET  85           HE2      MET  85  11.461   3.062  -6.198
    9    HE1  MET  85           HE3      MET  85  11.092   3.329  -4.500

  No H/Q in entry =           9
  In of MODEL   73
    1    H    LEU  86           H        LEU  86   9.908   2.386  -0.927
    2    HA   LEU  86           HA       LEU  86   9.814   5.198  -1.110
    3    HB2  LEU  86           HB2      LEU  86   7.983   3.519  -1.672
    4    HB3  LEU  86           HB3      LEU  86   7.666   3.427   0.061
    5    HG   LEU  86           HG       LEU  86   7.479   5.986   0.008
    6   HD11  LEU  86          HD11      LEU  86   8.240   5.556  -2.699
    7   HD13  LEU  86          HD12      LEU  86   7.794   7.080  -1.936
    8   HD12  LEU  86          HD13      LEU  86   6.562   6.104  -2.732
    9   HD23  LEU  86          HD21      LEU  86   5.347   4.610  -1.639
   10   HD22  LEU  86          HD22      LEU  86   5.153   5.869  -0.422
   11   HD21  LEU  86          HD23      LEU  86   5.572   4.229   0.069

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ALA  87           H        ALA  87   9.389   3.017   1.641
    2    HA   ALA  87           HA       ALA  87   8.835   4.926   3.613
    3    HB1  ALA  87           HB1      ALA  87   9.670   2.114   3.523
    4    HB3  ALA  87           HB2      ALA  87   8.545   2.916   4.616
    5    HB2  ALA  87           HB3      ALA  87  10.275   2.965   4.947

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ARG  88           H        ARG  88  11.926   3.532   2.611
    2    HA   ARG  88           HA       ARG  88  13.535   4.927   4.431
    3    HB2  ARG  88           HB2      ARG  88  14.213   2.960   3.024
    4    HB3  ARG  88           HB3      ARG  88  14.344   4.053   1.650
    5    HG2  ARG  88           HG2      ARG  88  15.818   5.383   3.585
    6    HG3  ARG  88           HG3      ARG  88  16.158   3.697   3.962
    7    HD2  ARG  88           HD2      ARG  88  17.415   3.412   2.107
    8    HD3  ARG  88           HD3      ARG  88  16.262   4.272   1.081
    9    HE   ARG  88           HE       ARG  88  18.653   5.360   2.111
   10   HH21  ARG  88          HH11      ARG  88  18.975   7.582   1.912
   11   HH22  ARG  88          HH12      ARG  88  17.612   8.640   1.778
   12   HH11  ARG  88          HH21      ARG  88  15.305   6.079   1.856
   13   HH12  ARG  88          HH22      ARG  88  15.533   7.787   1.722

  No H/Q in entry =          13
  In of MODEL   73
    1    H    GLU  89           H        GLU  89  12.528   5.813   1.115
    2    HA   GLU  89           HA       GLU  89  14.050   8.189   0.946
    3    HB2  GLU  89           HB2      GLU  89  12.902   7.135  -0.993
    4    HB3  GLU  89           HB3      GLU  89  11.357   7.661  -0.324
    5    HG2  GLU  89           HG2      GLU  89  12.034  10.006  -0.493
    6    HG3  GLU  89           HG3      GLU  89  13.639   9.531  -1.041

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LEU  90           H        LEU  90  10.735   7.647   2.100
    2    HA   LEU  90           HA       LEU  90  10.196  10.375   2.677
    3    HB2  LEU  90           HB2      LEU  90   9.035   7.790   3.715
    4    HB3  LEU  90           HB3      LEU  90   8.391   9.379   4.141
    5    HG   LEU  90           HG       LEU  90   8.798   8.502   1.270
    6   HD12  LEU  90          HD11      LEU  90   6.268   8.148   1.351
    7   HD11  LEU  90          HD12      LEU  90   6.435   8.140   3.107
    8   HD13  LEU  90          HD13      LEU  90   7.259   6.918   2.137
    9   HD22  LEU  90          HD21      LEU  90   8.480  10.807   1.197
   10   HD21  LEU  90          HD22      LEU  90   7.504  10.830   2.665
   11   HD23  LEU  90          HD23      LEU  90   6.801  10.267   1.149

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  91           H        ILE  91  11.500   7.708   4.592
    2    HA   ILE  91           HA       ILE  91  11.645   9.075   7.058
    3    HB   ILE  91           HB       ILE  91  13.214   6.752   5.924
    4   HG12  ILE  91          HG12      ILE  91  11.213   6.900   8.199
    5   HG13  ILE  91          HG13      ILE  91  10.733   6.614   6.527
    6   HG22  ILE  91          HG21      ILE  91  13.706   6.545   8.562
    7   HG21  ILE  91          HG22      ILE  91  13.612   8.302   8.460
    8   HG23  ILE  91          HG23      ILE  91  14.792   7.426   7.487
    9   HD13  ILE  91          HD11      ILE  91  11.756   4.522   6.450
   10   HD12  ILE  91          HD12      ILE  91  11.175   4.575   8.114
   11   HD11  ILE  91          HD13      ILE  91  12.871   4.905   7.763

  No H/Q in entry =          11
  In of MODEL   73
    1    H    THR  92           H        THR  92  13.843   8.927   4.290
    2    HA   THR  92           HA       THR  92  16.003  10.342   5.433
    3    HB   THR  92           HB       THR  92  14.997  10.206   2.580
    4    HG1  THR  92           HG1      THR  92  15.851   8.318   2.979
    5   HG22  THR  92          HG21      THR  92  17.557  10.922   2.266
    6   HG21  THR  92          HG22      THR  92  17.252  11.741   3.798
    7   HG23  THR  92          HG23      THR  92  16.268  12.118   2.384

  No H/Q in entry =           7
  In of MODEL   73
    1    H    GLU  93           H        GLU  93  13.092  11.466   3.725
    2    HA   GLU  93           HA       GLU  93  13.659  14.232   3.833
    3    HB2  GLU  93           HB2      GLU  93  10.969  12.832   3.868
    4    HB3  GLU  93           HB3      GLU  93  11.237  14.535   3.494
    5    HG2  GLU  93           HG2      GLU  93  12.586  12.305   1.957
    6    HG3  GLU  93           HG3      GLU  93  11.029  12.972   1.481

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LEU  94           H        LEU  94  11.955  12.060   6.058
    2    HA   LEU  94           HA       LEU  94  11.140  13.999   7.940
    3    HB2  LEU  94           HB2      LEU  94  11.748  11.050   8.211
    4    HB3  LEU  94           HB3      LEU  94  11.177  12.021   9.565
    5    HG   LEU  94           HG       LEU  94   9.672  12.056   6.948
    6   HD11  LEU  94          HD11      LEU  94   9.793   9.837   8.952
    7   HD13  LEU  94          HD12      LEU  94   9.479   9.772   7.220
    8   HD12  LEU  94          HD13      LEU  94   8.203  10.276   8.327
    9   HD23  LEU  94          HD21      LEU  94   7.761  12.437   8.562
   10   HD22  LEU  94          HD22      LEU  94   8.987  13.704   8.589
   11   HD21  LEU  94          HD23      LEU  94   8.947  12.487   9.864

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  95           H        ILE  95  14.131  12.100   7.681
    2    HA   ILE  95           HA       ILE  95  15.308  13.035  10.086
    3    HB   ILE  95           HB       ILE  95  16.538  11.977   7.529
    4   HG12  ILE  95          HG12      ILE  95  16.276  10.775  10.299
    5   HG13  ILE  95          HG13      ILE  95  15.102  10.504   9.013
    6   HG21  ILE  95          HG21      ILE  95  17.805  12.798  10.161
    7   HG23  ILE  95          HG22      ILE  95  18.250  13.330   8.538
    8   HG22  ILE  95          HG23      ILE  95  18.577  11.673   9.044
    9   HD13  ILE  95          HD11      ILE  95  16.585   9.240   7.739
   10   HD12  ILE  95          HD12      ILE  95  17.075   8.797   9.372
   11   HD11  ILE  95          HD13      ILE  95  18.009   9.985   8.465

  No H/Q in entry =          11
  In of MODEL   73
    1    H    GLU  96           H        GLU  96  15.424  14.268   6.750
    2    HA   GLU  96           HA       GLU  96  17.254  16.365   7.211
    3    HB2  GLU  96           HB2      GLU  96  16.578  15.695   4.957
    4    HB3  GLU  96           HB3      GLU  96  14.932  16.236   5.270
    5    HG2  GLU  96           HG2      GLU  96  15.472  18.370   4.723
    6    HG3  GLU  96           HG3      GLU  96  16.780  18.385   5.895

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LEU  97           H        LEU  97  13.748  16.143   7.668
    2    HA   LEU  97           HA       LEU  97  13.309  18.873   8.312
    3    HB2  LEU  97           HB2      LEU  97  11.821  16.332   8.939
    4    HB3  LEU  97           HB3      LEU  97  11.298  17.875   9.613
    5    HG   LEU  97           HG       LEU  97  11.762  17.462   6.645
    6   HD12  LEU  97          HD11      LEU  97   9.239  17.308   6.547
    7   HD11  LEU  97          HD12      LEU  97   9.248  17.110   8.297
    8   HD13  LEU  97          HD13      LEU  97  10.033  15.910   7.269
    9   HD23  LEU  97          HD21      LEU  97  10.004  19.408   6.690
   10   HD22  LEU  97          HD22      LEU  97  11.685  19.785   7.069
   11   HD21  LEU  97          HD23      LEU  97  10.508  19.603   8.369

  No H/Q in entry =          11
  In of MODEL   73
    1    H    HIS  98           H        HIS  98  14.174  16.056  10.302
    2    HA   HIS  98           HA       HIS  98  14.024  17.317  12.819
    3    HB2  HIS  98           HB2      HIS  98  15.788  15.077  11.804
    4    HB3  HIS  98           HB3      HIS  98  15.794  15.616  13.485
    5    HD1  HIS  98           HD1      HIS  98  13.591  13.963  10.911
    6    HD2  HIS  98           HD2      HIS  98  13.507  14.884  14.976
    7    HE1  HIS  98           HE1      HIS  98  11.586  12.749  11.880
    8    HE2  HIS  98           HE2      HIS  98  11.515  13.301  14.352

  No H/Q in entry =           8
  In of MODEL   73
    1    H    GLU  99           H        GLU  99  16.559  17.226  10.364
    2    HA   GLU  99           HA       GLU  99  18.543  18.578  11.877
    3    HB2  GLU  99           HB2      GLU  99  19.019  17.294   9.804
    4    HB3  GLU  99           HB3      GLU  99  18.189  18.540   8.869
    5    HG2  GLU  99           HG2      GLU  99  19.787  20.227   9.647
    6    HG3  GLU  99           HG3      GLU  99  20.586  19.033  10.664

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LYS 100           H        LYS 100  15.991  19.714   9.680
    2    HA   LYS 100           HA       LYS 100  16.762  22.459   9.816
    3    HB2  LYS 100           HB2      LYS 100  14.136  21.144   9.083
    4    HB3  LYS 100           HB3      LYS 100  14.418  22.886   8.990
    5    HG2  LYS 100           HG2      LYS 100  16.383  22.455   7.508
    6    HG3  LYS 100           HG3      LYS 100  15.986  20.735   7.529
    7    HD2  LYS 100           HD2      LYS 100  13.779  21.222   6.546
    8    HD3  LYS 100           HD3      LYS 100  14.158  22.945   6.532
    9    HE2  LYS 100           HE2      LYS 100  16.110  22.483   5.057
   10    HE3  LYS 100           HE3      LYS 100  15.661  20.774   5.028
   11    HZ1  LYS 100           HZ1      LYS 100  13.809  22.949   4.207
   12    HZ3  LYS 100           HZ2      LYS 100  13.638  21.277   3.947
   13    HZ2  LYS 100           HZ3      LYS 100  14.834  22.150   3.115

  No H/Q in entry =          13
  In of MODEL   73
    1    H    LEU 101           H        LEU 101  14.701  20.394  11.799
    2    HA   LEU 101           HA       LEU 101  13.527  22.452  13.386
    3    HB2  LEU 101           HB2      LEU 101  14.000  19.507  13.767
    4    HB3  LEU 101           HB3      LEU 101  13.466  20.482  15.132
    5    HG   LEU 101           HG       LEU 101  12.026  20.556  12.474
    6   HD12  LEU 101          HD11      LEU 101  10.392  18.977  13.757
    7   HD11  LEU 101          HD12      LEU 101  11.798  18.578  14.741
    8   HD13  LEU 101          HD13      LEU 101  11.820  18.271  13.003
    9   HD21  LEU 101          HD21      LEU 101  11.384  21.344  15.331
   10   HD23  LEU 101          HD22      LEU 101  10.116  21.106  14.131
   11   HD22  LEU 101          HD23      LEU 101  11.337  22.353  13.883

  No H/Q in entry =          11
  In of MODEL   73
    1    H    LYS 102           H        LYS 102  16.677  21.873  12.924
    2    HA   LYS 102           HA       LYS 102  18.523  22.762  13.982
    3    HB2  LYS 102           HB2      LYS 102  16.704  24.260  15.129
    4    HB3  LYS 102           HB3      LYS 102  16.932  23.200  16.505
    5    HG2  LYS 102           HG2      LYS 102  18.797  25.228  15.320
    6    HG3  LYS 102           HG3      LYS 102  18.432  24.911  17.002
    7    HD2  LYS 102           HD2      LYS 102  20.103  23.013  15.303
    8    HD3  LYS 102           HD3      LYS 102  20.787  24.342  16.230
    9    HE2  LYS 102           HE2      LYS 102  20.420  21.790  17.203
   10    HE3  LYS 102           HE3      LYS 102  20.634  23.234  18.192
   11    HZ2  LYS 102           HZ1      LYS 102  18.682  21.932  18.826
   12    HZ1  LYS 102           HZ2      LYS 102  18.023  22.156  17.282
   13    HZ3  LYS 102           HZ3      LYS 102  18.250  23.488  18.306

  No H/Q in entry =          13
  In of MODEL   73
    1    H    ALA 103           H        ALA 103  16.486  21.138  16.421
    2    HA   ALA 103           HA       ALA 103  18.237  19.944  18.062
    3    HB2  ALA 103           HB1      ALA 103  16.672  17.922  18.070
    4    HB1  ALA 103           HB2      ALA 103  15.758  18.767  16.819
    5    HB3  ALA 103           HB3      ALA 103  15.943  19.490  18.416

  No H/Q in entry =           5
  In of MODEL   73
    1    H1   ALA   1           H3       ALA   1  -1.761  -7.104 -21.391
    2    H2   ALA   1           H2       ALA   1  -2.540  -8.546 -20.931
    3    H3   ALA   1           H1       ALA   1  -0.936  -8.582 -21.498
    4    HA   ALA   1           HA       ALA   1  -1.781  -9.060 -23.488
    5    HB1  ALA   1           HB1      ALA   1  -3.908  -9.796 -22.998
    6    HB2  ALA   1           HB2      ALA   1  -4.366  -8.290 -23.792
    7    HB3  ALA   1           HB3      ALA   1  -4.291  -8.369 -22.034

  No H/Q in entry =           7
  In of MODEL   73
    1    H    GLU   2           H        GLU   2  -2.637  -7.877 -25.471
    2    HA   GLU   2           HA       GLU   2  -1.263  -5.851 -26.360
    3    HB2  GLU   2           HB2      GLU   2  -4.272  -5.944 -26.654
    4    HB3  GLU   2           HB3      GLU   2  -3.167  -5.072 -27.712
    5    HG2  GLU   2           HG2      GLU   2  -2.656  -6.958 -28.871
    6    HG3  GLU   2           HG3      GLU   2  -2.340  -7.860 -27.395

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLU   3           H        GLU   3  -4.427  -4.621 -25.435
    2    HA   GLU   3           HA       GLU   3  -3.398  -2.056 -24.815
    3    HB2  GLU   3           HB2      GLU   3  -6.072  -3.394 -24.462
    4    HB3  GLU   3           HB3      GLU   3  -5.783  -1.776 -23.818
    5    HG2  GLU   3           HG2      GLU   3  -5.451  -0.847 -25.947
    6    HG3  GLU   3           HG3      GLU   3  -5.048  -2.399 -26.675

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LEU   4           H        LEU   4  -4.951  -4.429 -22.623
    2    HA   LEU   4           HA       LEU   4  -4.578  -3.197 -20.235
    3    HB2  LEU   4           HB2      LEU   4  -4.014  -6.133 -20.708
    4    HB3  LEU   4           HB3      LEU   4  -4.414  -5.390 -19.162
    5    HG   LEU   4           HG       LEU   4  -6.205  -5.480 -21.612
    6   HD13  LEU   4          HD11      LEU   4  -7.375  -7.207 -20.605
    7   HD12  LEU   4          HD12      LEU   4  -6.882  -6.743 -18.977
    8   HD11  LEU   4          HD13      LEU   4  -5.747  -7.577 -20.038
    9   HD23  LEU   4          HD21      LEU   4  -7.882  -4.683 -19.731
   10   HD22  LEU   4          HD22      LEU   4  -6.860  -3.503 -20.550
   11   HD21  LEU   4          HD23      LEU   4  -6.416  -4.089 -18.947

  No H/Q in entry =          11
  In of MODEL   73
    1    H    GLU   5           H        GLU   5  -2.078  -5.019 -21.985
    2    HA   GLU   5           HA       GLU   5  -0.081  -4.717 -19.964
    3    HB2  GLU   5           HB2      GLU   5  -0.014  -6.487 -21.715
    4    HB3  GLU   5           HB3      GLU   5   0.279  -5.241 -22.929
    5    HG2  GLU   5           HG2      GLU   5   2.345  -4.580 -21.774
    6    HG3  GLU   5           HG3      GLU   5   2.052  -5.795 -20.530

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLU   6           H        GLU   6  -0.755  -3.010 -23.004
    2    HA   GLU   6           HA       GLU   6   1.401  -1.159 -22.753
    3    HB2  GLU   6           HB2      GLU   6   0.260  -1.652 -24.905
    4    HB3  GLU   6           HB3      GLU   6  -1.193  -0.865 -24.288
    5    HG2  GLU   6           HG2      GLU   6   0.001   0.761 -25.607
    6    HG3  GLU   6           HG3      GLU   6   0.198   1.209 -23.914

  No H/Q in entry =           6
  In of MODEL   73
    1    H    VAL   7           H        VAL   7  -1.928  -1.259 -21.682
    2    HA   VAL   7           HA       VAL   7  -2.166   1.451 -20.844
    3    HB   VAL   7           HB       VAL   7  -3.600  -1.079 -19.996
    4   HG11  VAL   7          HG11      VAL   7  -3.994   1.807 -19.179
    5   HG13  VAL   7          HG12      VAL   7  -3.874   0.383 -18.145
    6   HG12  VAL   7          HG13      VAL   7  -5.316   0.640 -19.126
    7   HG21  VAL   7          HG21      VAL   7  -3.785  -0.004 -22.383
    8   HG23  VAL   7          HG22      VAL   7  -4.735   1.237 -21.564
    9   HG22  VAL   7          HG23      VAL   7  -5.266  -0.445 -21.533

  No H/Q in entry =           9
  In of MODEL   73
    1    H    VAL   8           H        VAL   8  -1.140  -1.525 -19.208
    2    HA   VAL   8           HA       VAL   8  -0.811  -0.443 -16.615
    3    HB   VAL   8           HB       VAL   8   0.594  -2.749 -17.986
    4   HG11  VAL   8          HG11      VAL   8   0.766  -1.632 -15.199
    5   HG13  VAL   8          HG12      VAL   8   2.059  -2.235 -16.236
    6   HG12  VAL   8          HG13      VAL   8   0.954  -3.366 -15.457
    7   HG22  VAL   8          HG21      VAL   8  -1.164  -4.070 -17.280
    8   HG21  VAL   8          HG22      VAL   8  -2.044  -2.544 -17.241
    9   HG23  VAL   8          HG23      VAL   8  -1.340  -3.190 -15.763

  No H/Q in entry =           9
  In of MODEL   73
    1    H    MET   9           H        MET   9   1.419  -0.725 -19.380
    2    HA   MET   9           HA       MET   9   3.706   0.337 -18.137
    3    HB2  MET   9           HB2      MET   9   2.737   0.378 -20.996
    4    HB3  MET   9           HB3      MET   9   4.263   1.122 -20.519
    5    HG2  MET   9           HG2      MET   9   5.016  -1.032 -19.571
    6    HG3  MET   9           HG3      MET   9   3.493  -1.776 -20.063
    7    HE1  MET   9           HE1      MET   9   6.340   0.285 -20.895
    8    HE3  MET   9           HE2      MET   9   6.628   0.202 -22.631
    9    HE2  MET   9           HE3      MET   9   7.254  -1.064 -21.579

  No H/Q in entry =           9
  In of MODEL   73
    1    H    GLY  10           H        GLY  10   0.996   1.918 -19.793
    2    HA3  GLY  10           HA2      GLY  10   1.940   4.579 -19.556
    3    HA2  GLY  10           HA3      GLY  10   0.252   4.106 -19.747

  No H/Q in entry =           3
  In of MODEL   73
    1    H    LEU  11           H        LEU  11  -0.117   2.575 -17.458
    2    HA   LEU  11           HA       LEU  11  -0.646   4.548 -15.494
    3    HB2  LEU  11           HB2      LEU  11  -0.554   1.533 -15.339
    4    HB3  LEU  11           HB3      LEU  11  -1.060   2.552 -13.992
    5    HG   LEU  11           HG       LEU  11  -2.322   2.656 -16.745
    6   HD13  LEU  11          HD11      LEU  11  -2.884   0.509 -15.986
    7   HD12  LEU  11          HD12      LEU  11  -4.237   1.490 -15.429
    8   HD11  LEU  11          HD13      LEU  11  -2.968   1.019 -14.299
    9   HD22  LEU  11          HD21      LEU  11  -2.920   4.668 -15.734
   10   HD21  LEU  11          HD22      LEU  11  -2.827   4.002 -14.104
   11   HD23  LEU  11          HD23      LEU  11  -4.208   3.626 -15.134

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  12           H        ILE  12   1.913   2.101 -15.758
    2    HA   ILE  12           HA       ILE  12   3.135   2.647 -13.264
    3    HB   ILE  12           HB       ILE  12   4.372   1.614 -15.838
    4   HG12  ILE  12          HG12      ILE  12   2.384   0.367 -14.674
    5   HG13  ILE  12          HG13      ILE  12   3.788  -0.557 -15.165
    6   HG22  ILE  12          HG21      ILE  12   6.029   0.565 -14.186
    7   HG21  ILE  12          HG22      ILE  12   5.387   1.685 -12.984
    8   HG23  ILE  12          HG23      ILE  12   6.173   2.304 -14.435
    9   HD13  ILE  12          HD11      ILE  12   4.626  -0.545 -12.890
   10   HD12  ILE  12          HD12      ILE  12   2.952  -1.095 -12.867
   11   HD11  ILE  12          HD13      ILE  12   3.344   0.541 -12.387

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  13           H        ILE  13   3.700   3.915 -16.526
    2    HA   ILE  13           HA       ILE  13   5.831   5.650 -15.819
    3    HB   ILE  13           HB       ILE  13   3.781   5.715 -18.048
    4   HG12  ILE  13          HG12      ILE  13   5.638   3.892 -17.783
    5   HG13  ILE  13          HG13      ILE  13   5.371   4.629 -19.359
    6   HG21  ILE  13          HG21      ILE  13   5.973   7.641 -17.370
    7   HG23  ILE  13          HG22      ILE  13   4.394   7.958 -18.077
    8   HG22  ILE  13          HG23      ILE  13   5.681   7.280 -19.073
    9   HD13  ILE  13          HD11      ILE  13   7.284   6.105 -19.062
   10   HD12  ILE  13          HD12      ILE  13   7.797   4.464 -18.686
   11   HD11  ILE  13          HD13      ILE  13   7.456   5.597 -17.383

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ASN  14           H        ASN  14   2.318   6.120 -16.057
    2    HA   ASN  14           HA       ASN  14   2.261   8.865 -15.419
    3    HB2  ASN  14           HB2      ASN  14   0.373   7.210 -16.234
    4    HB3  ASN  14           HB3      ASN  14   0.068   7.029 -14.511
    5   HD21  ASN  14          HD21      ASN  14  -1.972   8.170 -15.926
    6   HD22  ASN  14          HD22      ASN  14  -2.045   9.843 -15.658

  No H/Q in entry =           6
  In of MODEL   73
    1    H    SER  15           H        SER  15   2.005   5.986 -13.341
    2    HA   SER  15           HA       SER  15   1.709   7.354 -10.890
    3    HB2  SER  15           HB2      SER  15   2.283   5.272  -9.845
    4    HB3  SER  15           HB3      SER  15   1.444   4.848 -11.333
    5    HG   SER  15           HG       SER  15   3.220   3.673 -11.517

  No H/Q in entry =           5
  In of MODEL   73
    1    H    GLY  16           H        GLY  16   4.578   6.279 -12.673
    2    HA3  GLY  16           HA2      GLY  16   6.514   7.050 -10.759
    3    HA2  GLY  16           HA3      GLY  16   6.804   6.850 -12.485

  No H/Q in entry =           3
  In of MODEL   73
    1    H    GLN  17           H        GLN  17   5.090   8.795 -13.533
    2    HA   GLN  17           HA       GLN  17   6.651  11.149 -13.239
    3    HB2  GLN  17           HB2      GLN  17   5.323  10.667 -15.270
    4    HB3  GLN  17           HB3      GLN  17   3.838  10.857 -14.338
    5    HG2  GLN  17           HG2      GLN  17   4.469  13.189 -13.814
    6    HG3  GLN  17           HG3      GLN  17   5.935  13.001 -14.773
    7   HE21  GLN  17          HE21      GLN  17   5.714  13.787 -16.866
    8   HE22  GLN  17          HE22      GLN  17   4.259  13.833 -17.740

  No H/Q in entry =           8
  In of MODEL   73
    1    H    ALA  18           H        ALA  18   3.571  10.105 -11.863
    2    HA   ALA  18           HA       ALA  18   2.836  12.488 -10.591
    3    HB1  ALA  18           HB1      ALA  18   1.726  10.022 -10.804
    4    HB2  ALA  18           HB2      ALA  18   1.177  11.237  -9.652
    5    HB3  ALA  18           HB3      ALA  18   2.282   9.964  -9.132

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ARG  19           H        ARG  19   4.745   9.741  -9.328
    2    HA   ARG  19           HA       ARG  19   5.289  10.903  -6.811
    3    HB2  ARG  19           HB2      ARG  19   5.719   8.504  -7.341
    4    HB3  ARG  19           HB3      ARG  19   7.062   9.002  -8.374
    5    HG2  ARG  19           HG2      ARG  19   8.189  10.052  -6.461
    6    HG3  ARG  19           HG3      ARG  19   6.825   9.652  -5.418
    7    HD2  ARG  19           HD2      ARG  19   8.605   8.032  -5.075
    8    HD3  ARG  19           HD3      ARG  19   7.231   7.238  -5.849
    9    HE   ARG  19           HE       ARG  19   8.910   8.072  -7.911
   10   HH21  ARG  19          HH11      ARG  19  10.476   6.680  -8.775
   11   HH22  ARG  19          HH12      ARG  19  11.041   5.337  -7.844
   12   HH11  ARG  19          HH21      ARG  19   9.024   6.042  -5.133
   13   HH12  ARG  19          HH22      ARG  19  10.216   4.975  -5.781

  No H/Q in entry =          13
  In of MODEL   73
    1    H    SER  20           H        SER  20   7.080  10.949  -9.875
    2    HA   SER  20           HA       SER  20   9.318  12.385  -9.070
    3    HB2  SER  20           HB2      SER  20   9.085  11.393 -11.315
    4    HB3  SER  20           HB3      SER  20   7.862  12.593 -11.714
    5    HG   SER  20           HG       SER  20  10.411  13.349 -10.777

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LEU  21           H        LEU  21   6.198  13.626 -10.241
    2    HA   LEU  21           HA       LEU  21   6.844  16.377 -10.022
    3    HB2  LEU  21           HB2      LEU  21   4.191  14.927  -9.920
    4    HB3  LEU  21           HB3      LEU  21   4.340  16.683  -9.924
    5    HG   LEU  21           HG       LEU  21   5.534  14.901 -12.068
    6   HD11  LEU  21          HD11      LEU  21   2.847  16.267 -11.867
    7   HD13  LEU  21          HD12      LEU  21   3.197  14.590 -12.291
    8   HD12  LEU  21          HD13      LEU  21   3.574  15.884 -13.428
    9   HD21  LEU  21          HD21      LEU  21   5.279  17.873 -11.642
   10   HD23  LEU  21          HD22      LEU  21   5.282  17.252 -13.290
   11   HD22  LEU  21          HD23      LEU  21   6.662  16.964 -12.243

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ALA  22           H        ALA  22   5.373  14.073  -7.761
    2    HA   ALA  22           HA       ALA  22   4.770  15.875  -5.689
    3    HB3  ALA  22           HB1      ALA  22   4.031  13.476  -5.846
    4    HB2  ALA  22           HB2      ALA  22   4.628  13.953  -4.256
    5    HB1  ALA  22           HB3      ALA  22   5.652  13.005  -5.336

  No H/Q in entry =           5
  In of MODEL   73
    1    H    TYR  23           H        TYR  23   7.720  13.879  -6.152
    2    HA   TYR  23           HA       TYR  23   9.112  14.913  -3.912
    3    HB2  TYR  23           HB2      TYR  23   9.911  12.913  -5.075
    4    HB3  TYR  23           HB3      TYR  23  10.199  13.853  -6.538
    5    HD1  TYR  23           HD1      TYR  23  11.206  13.524  -2.959
    6    HD2  TYR  23           HD2      TYR  23  12.215  15.054  -6.844
    7    HE1  TYR  23           HE1      TYR  23  13.466  14.128  -2.134
    8    HE2  TYR  23           HE2      TYR  23  14.474  15.658  -6.018
    9    HH   TYR  23           HH       TYR  23  15.515  16.200  -3.741

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ALA  24           H        ALA  24   8.889  16.017  -7.276
    2    HA   ALA  24           HA       ALA  24  10.764  18.123  -7.046
    3    HB2  ALA  24           HB1      ALA  24  10.302  18.180  -9.251
    4    HB3  ALA  24           HB2      ALA  24   8.742  18.913  -8.878
    5    HB1  ALA  24           HB3      ALA  24   8.885  17.161  -9.010

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ALA  25           H        ALA  25   7.293  17.900  -6.396
    2    HA   ALA  25           HA       ALA  25   6.788  20.613  -5.822
    3    HB1  ALA  25           HB1      ALA  25   5.147  18.596  -6.009
    4    HB2  ALA  25           HB2      ALA  25   4.775  19.881  -4.858
    5    HB3  ALA  25           HB3      ALA  25   5.486  18.368  -4.293

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LEU  26           H        LEU  26   7.904  17.946  -3.781
    2    HA   LEU  26           HA       LEU  26   8.013  19.378  -1.346
    3    HB2  LEU  26           HB2      LEU  26   8.136  16.963  -1.341
    4    HB3  LEU  26           HB3      LEU  26   9.598  16.988  -2.324
    5    HG   LEU  26           HG       LEU  26  10.815  18.120  -0.494
    6   HD12  LEU  26          HD11      LEU  26   9.608  18.114   1.776
    7   HD11  LEU  26          HD12      LEU  26   8.114  17.959   0.854
    8   HD13  LEU  26          HD13      LEU  26   9.141  19.377   0.636
    9   HD21  LEU  26          HD21      LEU  26   9.318  15.635   0.392
   10   HD23  LEU  26          HD22      LEU  26  10.833  16.215   1.076
   11   HD22  LEU  26          HD23      LEU  26  10.780  15.655  -0.593

  No H/Q in entry =          11
  In of MODEL   73
    1    H    LYS  27           H        LYS  27  10.415  18.834  -3.891
    2    HA   LYS  27           HA       LYS  27  12.594  20.101  -2.682
    3    HB2  LYS  27           HB2      LYS  27  12.694  18.755  -4.772
    4    HB3  LYS  27           HB3      LYS  27  11.905  20.077  -5.631
    5    HG2  LYS  27           HG2      LYS  27  13.757  21.585  -5.070
    6    HG3  LYS  27           HG3      LYS  27  14.541  20.303  -4.140
    7    HD2  LYS  27           HD2      LYS  27  14.684  18.917  -6.194
    8    HD3  LYS  27           HD3      LYS  27  13.945  20.226  -7.117
    9    HE2  LYS  27           HE2      LYS  27  15.819  21.715  -6.521
   10    HE3  LYS  27           HE3      LYS  27  16.563  20.410  -5.589
   11    HZ3  LYS  27           HZ1      LYS  27  17.532  20.521  -7.784
   12    HZ2  LYS  27           HZ2      LYS  27  16.001  20.384  -8.512
   13    HZ1  LYS  27           HZ3      LYS  27  16.648  19.081  -7.632

  No H/Q in entry =          13
  In of MODEL   73
    1    H    GLN  28           H        GLN  28   9.938  21.450  -4.608
    2    HA   GLN  28           HA       GLN  28  10.863  24.114  -4.770
    3    HB2  GLN  28           HB2      GLN  28   8.046  23.006  -4.636
    4    HB3  GLN  28           HB3      GLN  28   8.432  24.685  -5.010
    5    HG2  GLN  28           HG2      GLN  28   9.437  22.286  -6.569
    6    HG3  GLN  28           HG3      GLN  28   8.097  23.321  -7.062
    7   HE21  GLN  28          HE21      GLN  28  11.217  22.834  -7.838
    8   HE22  GLN  28          HE22      GLN  28  11.705  24.422  -8.191

  No H/Q in entry =           8
  In of MODEL   73
    1    H    ALA  29           H        ALA  29   8.974  22.399  -2.317
    2    HA   ALA  29           HA       ALA  29   8.411  24.584  -0.631
    3    HB2  ALA  29           HB1      ALA  29   7.716  23.007   0.944
    4    HB1  ALA  29           HB2      ALA  29   8.948  21.838   0.469
    5    HB3  ALA  29           HB3      ALA  29   7.549  22.114  -0.568

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LYS  30           H        LYS  30  11.169  22.352  -0.723
    2    HA   LYS  30           HA       LYS  30  12.495  23.323   1.568
    3    HB2  LYS  30           HB2      LYS  30  13.586  22.050  -0.952
    4    HB3  LYS  30           HB3      LYS  30  14.576  22.423   0.461
    5    HG2  LYS  30           HG2      LYS  30  13.053  21.020   1.855
    6    HG3  LYS  30           HG3      LYS  30  12.160  20.587   0.393
    7    HD2  LYS  30           HD2      LYS  30  14.209  19.626  -0.586
    8    HD3  LYS  30           HD3      LYS  30  15.120  20.074   0.858
    9    HE2  LYS  30           HE2      LYS  30  13.646  18.624   2.226
   10    HE3  LYS  30           HE3      LYS  30  12.765  18.157   0.766
   11    HZ2  LYS  30           HZ1      LYS  30  14.583  16.602   1.511
   12    HZ1  LYS  30           HZ2      LYS  30  15.701  17.803   1.050
   13    HZ3  LYS  30           HZ3      LYS  30  14.664  17.106  -0.106

  No H/Q in entry =          13
  In of MODEL   73
    1    H    GLN  31           H        GLN  31  12.342  24.525  -1.728
    2    HA   GLN  31           HA       GLN  31  14.474  26.446  -1.326
    3    HB2  GLN  31           HB2      GLN  31  12.411  26.466  -3.532
    4    HB3  GLN  31           HB3      GLN  31  14.022  27.182  -3.547
    5    HG2  GLN  31           HG2      GLN  31  14.524  24.493  -2.975
    6    HG3  GLN  31           HG3      GLN  31  13.210  24.421  -4.143
    7   HE21  GLN  31          HE21      GLN  31  16.060  23.665  -4.571
    8   HE22  GLN  31          HE22      GLN  31  16.609  24.645  -5.843

  No H/Q in entry =           8
  In of MODEL   73
    1    H    GLY  32           H        GLY  32  11.412  26.225  -0.153
    2    HA3  GLY  32           HA2      GLY  32  10.247  27.778   1.130
    3    HA2  GLY  32           HA3      GLY  32  11.351  29.028   0.569

  No H/Q in entry =           3
  In of MODEL   73
    1    H    ASP  33           H        ASP  33   9.990  27.105  -1.911
    2    HA   ASP  33           HA       ASP  33   8.289  29.356  -2.752
    3    HB2  ASP  33           HB2      ASP  33   9.401  26.951  -4.203
    4    HB3  ASP  33           HB3      ASP  33   8.229  28.051  -4.924

  No H/Q in entry =           4
  In of MODEL   73
    1    H    PHE  34           H        PHE  34   6.620  28.859  -1.173
    2    HA   PHE  34           HA       PHE  34   5.274  26.370  -1.065
    3    HB2  PHE  34           HB2      PHE  34   4.283  29.144  -0.378
    4    HB3  PHE  34           HB3      PHE  34   3.457  27.643   0.041
    5    HD1  PHE  34           HD1      PHE  34   5.686  30.071   1.236
    6    HD2  PHE  34           HD2      PHE  34   5.061  25.821   1.189
    7    HE1  PHE  34           HE1      PHE  34   7.098  29.839   3.260
    8    HE2  PHE  34           HE2      PHE  34   6.474  25.594   3.211
    9    HZ   PHE  34           HZ       PHE  34   7.487  27.603   4.246

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ALA  35           H        ALA  35   4.789  29.227  -3.073
    2    HA   ALA  35           HA       ALA  35   2.237  28.579  -4.076
    3    HB3  ALA  35           HB1      ALA  35   3.253  29.984  -6.123
    4    HB2  ALA  35           HB2      ALA  35   4.476  30.362  -4.910
    5    HB1  ALA  35           HB3      ALA  35   2.783  30.749  -4.604

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ALA  36           H        ALA  36   5.462  27.948  -5.458
    2    HA   ALA  36           HA       ALA  36   4.472  26.505  -7.692
    3    HB3  ALA  36           HB1      ALA  36   6.624  26.657  -8.327
    4    HB2  ALA  36           HB2      ALA  36   7.130  25.635  -6.981
    5    HB1  ALA  36           HB3      ALA  36   7.004  27.382  -6.765

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ALA  37           H        ALA  37   5.469  25.524  -4.446
    2    HA   ALA  37           HA       ALA  37   5.443  22.735  -4.874
    3    HB2  ALA  37           HB1      ALA  37   5.180  24.524  -2.494
    4    HB1  ALA  37           HB2      ALA  37   6.328  23.221  -2.796
    5    HB3  ALA  37           HB3      ALA  37   4.675  22.845  -2.310

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LYS  38           H        LYS  38   2.892  24.911  -3.684
    2    HA   LYS  38           HA       LYS  38   0.819  23.070  -3.443
    3    HB2  LYS  38           HB2      LYS  38   1.137  25.831  -3.195
    4    HB3  LYS  38           HB3      LYS  38  -0.072  25.667  -4.464
    5    HG2  LYS  38           HG2      LYS  38  -1.491  24.326  -3.008
    6    HG3  LYS  38           HG3      LYS  38  -0.236  24.282  -1.763
    7    HD2  LYS  38           HD2      LYS  38  -0.448  26.616  -1.314
    8    HD3  LYS  38           HD3      LYS  38  -1.377  26.893  -2.789
    9    HE2  LYS  38           HE2      LYS  38  -2.864  26.908  -0.836
   10    HE3  LYS  38           HE3      LYS  38  -3.229  25.527  -1.875
   11    HZ3  LYS  38           HZ1      LYS  38  -2.470  24.066  -0.348
   12    HZ2  LYS  38           HZ2      LYS  38  -2.828  25.319   0.745
   13    HZ1  LYS  38           HZ3      LYS  38  -1.235  25.089   0.205

  No H/Q in entry =          13
  In of MODEL   73
    1    H    ALA  39           H        ALA  39   1.748  24.984  -6.300
    2    HA   ALA  39           HA       ALA  39  -0.331  24.089  -7.985
    3    HB2  ALA  39           HB1      ALA  39   2.388  24.773  -9.063
    4    HB1  ALA  39           HB2      ALA  39   1.411  26.022  -8.289
    5    HB3  ALA  39           HB3      ALA  39   0.797  25.176  -9.710

  No H/Q in entry =           5
  In of MODEL   73
    1    H    MET  40           H        MET  40   2.929  22.833  -7.434
    2    HA   MET  40           HA       MET  40   2.841  20.811  -9.424
    3    HB2  MET  40           HB2      MET  40   4.471  21.057  -6.889
    4    HB3  MET  40           HB3      MET  40   4.728  19.804  -8.106
    5    HG2  MET  40           HG2      MET  40   4.741  22.761  -8.772
    6    HG3  MET  40           HG3      MET  40   6.202  21.877  -8.335
    7    HE3  MET  40           HE1      MET  40   7.079  19.673 -11.151
    8    HE2  MET  40           HE2      MET  40   6.534  19.347  -9.509
    9    HE1  MET  40           HE3      MET  40   7.609  20.708  -9.818

  No H/Q in entry =           9
  In of MODEL   73
    1    H    MET  41           H        MET  41   1.955  20.843  -5.992
    2    HA   MET  41           HA       MET  41   1.462  18.071  -5.709
    3    HB2  MET  41           HB2      MET  41   0.110  20.411  -4.347
    4    HB3  MET  41           HB3      MET  41  -0.019  18.731  -3.837
    5    HG2  MET  41           HG2      MET  41   2.688  18.991  -3.898
    6    HG3  MET  41           HG3      MET  41   2.229  20.643  -3.499
    7    HE2  MET  41           HE1      MET  41  -0.779  19.350  -1.747
    8    HE1  MET  41           HE2      MET  41   0.014  20.874  -2.131
    9    HE3  MET  41           HE3      MET  41  -0.023  20.303  -0.463

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ASP  42           H        ASP  42  -0.621  20.768  -6.665
    2    HA   ASP  42           HA       ASP  42  -3.044  19.374  -6.781
    3    HB2  ASP  42           HB2      ASP  42  -2.375  21.954  -7.044
    4    HB3  ASP  42           HB3      ASP  42  -2.535  21.556  -8.751

  No H/Q in entry =           4
  In of MODEL   73
    1    H    GLN  43           H        GLN  43  -0.634  19.998  -9.304
    2    HA   GLN  43           HA       GLN  43  -2.021  18.659 -11.381
    3    HB2  GLN  43           HB2      GLN  43   0.933  19.215 -11.025
    4    HB3  GLN  43           HB3      GLN  43   0.215  18.565 -12.501
    5    HG2  GLN  43           HG2      GLN  43  -1.324  20.572 -12.529
    6    HG3  GLN  43           HG3      GLN  43  -0.369  21.241 -11.210
    7   HE21  GLN  43          HE21      GLN  43  -0.248  22.863 -13.298
    8   HE22  GLN  43          HE22      GLN  43   1.162  22.661 -14.217

  No H/Q in entry =           8
  In of MODEL   73
    1    H    SER  44           H        SER  44   0.366  17.552  -9.010
    2    HA   SER  44           HA       SER  44   0.728  14.949 -10.038
    3    HB2  SER  44           HB2      SER  44   1.622  16.401  -7.810
    4    HB3  SER  44           HB3      SER  44   0.785  15.006  -7.131
    5    HG   SER  44           HG       SER  44   2.900  14.415  -7.576

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ARG  45           H        ARG  45  -1.590  16.236  -7.680
    2    HA   ARG  45           HA       ARG  45  -2.938  13.857  -7.033
    3    HB2  ARG  45           HB2      ARG  45  -3.156  16.022  -5.840
    4    HB3  ARG  45           HB3      ARG  45  -4.033  16.677  -7.219
    5    HG2  ARG  45           HG2      ARG  45  -5.772  14.926  -6.920
    6    HG3  ARG  45           HG3      ARG  45  -4.907  14.327  -5.505
    7    HD2  ARG  45           HD2      ARG  45  -5.136  16.591  -4.447
    8    HD3  ARG  45           HD3      ARG  45  -6.142  17.096  -5.821
    9    HE   ARG  45           HE       ARG  45  -7.210  14.705  -4.771
   10   HH21  ARG  45          HH11      ARG  45  -9.036  14.755  -3.484
   11   HH22  ARG  45          HH12      ARG  45  -9.443  16.189  -2.612
   12   HH11  ARG  45          HH21      ARG  45  -6.701  17.959  -3.752
   13   HH12  ARG  45          HH22      ARG  45  -8.116  18.004  -2.762

  No H/Q in entry =          13
  In of MODEL   73
    1    H    MET  46           H        MET  46  -3.578  16.252  -9.579
    2    HA   MET  46           HA       MET  46  -5.909  15.046 -10.620
    3    HB2  MET  46           HB2      MET  46  -3.845  16.904 -11.810
    4    HB3  MET  46           HB3      MET  46  -5.223  16.325 -12.751
    5    HG2  MET  46           HG2      MET  46  -6.776  17.242 -11.106
    6    HG3  MET  46           HG3      MET  46  -5.440  17.737 -10.075
    7    HE1  MET  46           HE1      MET  46  -7.158  17.813 -13.285
    8    HE3  MET  46           HE2      MET  46  -5.770  18.312 -14.247
    9    HE2  MET  46           HE3      MET  46  -7.060  19.465 -13.910

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ALA  47           H        ALA  47  -2.481  14.616 -11.407
    2    HA   ALA  47           HA       ALA  47  -2.820  12.883 -13.614
    3    HB3  ALA  47           HB1      ALA  47  -0.653  13.804 -13.281
    4    HB2  ALA  47           HB2      ALA  47  -0.484  12.078 -12.949
    5    HB1  ALA  47           HB3      ALA  47  -0.582  13.229 -11.615

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LEU  48           H        LEU  48  -2.511  12.252 -10.143
    2    HA   LEU  48           HA       LEU  48  -2.566   9.411 -10.300
    3    HB2  LEU  48           HB2      LEU  48  -3.339  11.318  -8.080
    4    HB3  LEU  48           HB3      LEU  48  -3.218   9.569  -7.880
    5    HG   LEU  48           HG       LEU  48  -0.952  11.302  -8.897
    6   HD13  LEU  48          HD11      LEU  48  -1.227  12.068  -6.704
    7   HD12  LEU  48          HD12      LEU  48  -0.043  10.778  -6.515
    8   HD11  LEU  48          HD13      LEU  48  -1.734  10.491  -6.103
    9   HD22  LEU  48          HD21      LEU  48  -0.427   9.124  -9.542
   10   HD21  LEU  48          HD22      LEU  48  -1.275   8.396  -8.178
   11   HD23  LEU  48          HD23      LEU  48   0.289   9.172  -7.931

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ASN  49           H        ASN  49  -5.062  11.867  -9.878
    2    HA   ASN  49           HA       ASN  49  -7.218  10.171  -9.319
    3    HB2  ASN  49           HB2      ASN  49  -7.329  12.581  -8.986
    4    HB3  ASN  49           HB3      ASN  49  -7.147  12.862 -10.713
    5   HD21  ASN  49          HD21      ASN  49  -9.343  11.296  -8.354
    6   HD22  ASN  49          HD22      ASN  49 -10.748  11.537  -9.274

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLU  50           H        GLU  50  -5.983  11.385 -12.418
    2    HA   GLU  50           HA       GLU  50  -7.932  10.101 -14.046
    3    HB2  GLU  50           HB2      GLU  50  -6.500  11.941 -14.873
    4    HB3  GLU  50           HB3      GLU  50  -5.090  10.889 -14.747
    5    HG2  GLU  50           HG2      GLU  50  -6.054   9.339 -16.375
    6    HG3  GLU  50           HG3      GLU  50  -7.530  10.296 -16.450

  No H/Q in entry =           6
  In of MODEL   73
    1    H    ALA  51           H        ALA  51  -4.738   9.156 -12.867
    2    HA   ALA  51           HA       ALA  51  -4.574   6.704 -14.286
    3    HB2  ALA  51           HB1      ALA  51  -2.580   6.446 -13.203
    4    HB1  ALA  51           HB2      ALA  51  -3.261   6.859 -11.629
    5    HB3  ALA  51           HB3      ALA  51  -2.833   8.135 -12.768

  No H/Q in entry =           5
  In of MODEL   73
    1    H    HIS  52           H        HIS  52  -5.732   7.520 -11.027
    2    HA   HIS  52           HA       HIS  52  -6.372   4.901 -10.190
    3    HB2  HIS  52           HB2      HIS  52  -6.253   6.810  -8.648
    4    HB3  HIS  52           HB3      HIS  52  -7.665   7.527  -9.420
    5    HD1  HIS  52           HD1      HIS  52  -9.934   6.081  -9.256
    6    HD2  HIS  52           HD2      HIS  52  -6.855   4.910  -6.701
    7    HE1  HIS  52           HE1      HIS  52 -10.991   4.606  -7.489
    8    HE2  HIS  52           HE2      HIS  52  -9.126   3.884  -5.923

  No H/Q in entry =           8
  In of MODEL   73
    1    H    LEU  53           H        LEU  53  -8.242   7.332 -11.963
    2    HA   LEU  53           HA       LEU  53 -10.729   6.004 -11.954
    3    HB2  LEU  53           HB2      LEU  53  -9.492   7.993 -13.848
    4    HB3  LEU  53           HB3      LEU  53 -11.093   7.317 -14.133
    5    HG   LEU  53           HG       LEU  53 -10.332   8.647 -11.514
    6   HD12  LEU  53          HD11      LEU  53 -11.648  10.605 -12.437
    7   HD11  LEU  53          HD12      LEU  53 -11.556   9.828 -14.019
    8   HD13  LEU  53          HD13      LEU  53 -10.085  10.346 -13.201
    9   HD22  LEU  53          HD21      LEU  53 -12.322   7.445 -11.142
   10   HD21  LEU  53          HD22      LEU  53 -12.886   7.691 -12.791
   11   HD23  LEU  53          HD23      LEU  53 -12.952   9.011 -11.639

  No H/Q in entry =          11
  In of MODEL   73
    1    H    VAL  54           H        VAL  54  -7.995   5.845 -14.214
    2    HA   VAL  54           HA       VAL  54  -9.208   4.057 -16.047
    3    HB   VAL  54           HB       VAL  54  -6.302   4.604 -15.388
    4   HG12  VAL  54          HG11      VAL  54  -6.059   3.522 -17.779
    5   HG11  VAL  54          HG12      VAL  54  -7.573   2.720 -17.363
    6   HG13  VAL  54          HG13      VAL  54  -6.146   2.485 -16.356
    7   HG22  VAL  54          HG21      VAL  54  -7.107   6.536 -16.427
    8   HG21  VAL  54          HG22      VAL  54  -8.296   5.656 -17.385
    9   HG23  VAL  54          HG23      VAL  54  -6.592   5.599 -17.830

  No H/Q in entry =           9
  In of MODEL   73
    1    H    GLN  55           H        GLN  55  -7.178   3.539 -13.163
    2    HA   GLN  55           HA       GLN  55  -7.051   0.724 -13.420
    3    HB2  GLN  55           HB2      GLN  55  -5.496   1.642 -11.914
    4    HB3  GLN  55           HB3      GLN  55  -6.718   2.591 -11.074
    5    HG2  GLN  55           HG2      GLN  55  -7.372   0.825  -9.751
    6    HG3  GLN  55           HG3      GLN  55  -7.141  -0.359 -11.031
    7   HE21  GLN  55          HE21      GLN  55  -5.494  -1.786 -10.549
    8   HE22  GLN  55          HE22      GLN  55  -4.107  -1.415  -9.649

  No H/Q in entry =           8
  In of MODEL   73
    1    H    THR  56           H        THR  56  -9.398   2.855 -11.787
    2    HA   THR  56           HA       THR  56 -10.946   0.951 -10.484
    3    HB   THR  56           HB       THR  56 -11.887   3.441 -11.938
    4    HG1  THR  56           HG1      THR  56 -10.546   2.961  -9.627
    5   HG23  THR  56          HG21      THR  56 -13.845   2.201 -11.556
    6   HG22  THR  56          HG22      THR  56 -13.733   3.223 -10.122
    7   HG21  THR  56          HG23      THR  56 -13.237   1.532 -10.042

  No H/Q in entry =           7
  In of MODEL   73
    1    H    LYS  57           H        LYS  57 -11.190   2.029 -13.869
    2    HA   LYS  57           HA       LYS  57 -13.329   0.313 -14.604
    3    HB2  LYS  57           HB2      LYS  57 -12.488   2.276 -15.929
    4    HB3  LYS  57           HB3      LYS  57 -11.042   1.353 -16.309
    5    HG2  LYS  57           HG2      LYS  57 -12.398  -0.345 -17.450
    6    HG3  LYS  57           HG3      LYS  57 -13.867   0.533 -17.042
    7    HD2  LYS  57           HD2      LYS  57 -13.069   2.472 -18.361
    8    HD3  LYS  57           HD3      LYS  57 -11.612   1.579 -18.788
    9    HE2  LYS  57           HE2      LYS  57 -12.987  -0.147 -19.904
   10    HE3  LYS  57           HE3      LYS  57 -14.456   0.726 -19.475
   11    HZ2  LYS  57           HZ1      LYS  57 -13.014   1.069 -21.743
   12    HZ1  LYS  57           HZ2      LYS  57 -12.513   2.377 -20.781
   13    HZ3  LYS  57           HZ3      LYS  57 -14.162   2.156 -21.130

  No H/Q in entry =          13
  In of MODEL   73
    1    H    LEU  58           H        LEU  58  -9.819  -0.071 -14.575
    2    HA   LEU  58           HA       LEU  58  -9.803  -2.588 -15.863
    3    HB2  LEU  58           HB2      LEU  58  -7.772  -1.268 -14.071
    4    HB3  LEU  58           HB3      LEU  58  -7.498  -2.786 -14.927
    5    HG   LEU  58           HG       LEU  58  -8.298  -0.193 -16.286
    6   HD11  LEU  58          HD11      LEU  58  -5.629  -1.394 -15.615
    7   HD13  LEU  58          HD12      LEU  58  -6.147   0.290 -15.563
    8   HD12  LEU  58          HD13      LEU  58  -5.809  -0.477 -17.111
    9   HD22  LEU  58          HD21      LEU  58  -8.865  -1.764 -17.871
   10   HD21  LEU  58          HD22      LEU  58  -7.802  -2.997 -17.197
   11   HD23  LEU  58          HD23      LEU  58  -7.136  -1.715 -18.208

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  59           H        ILE  59 -10.611  -1.695 -12.606
    2    HA   ILE  59           HA       ILE  59 -10.215  -4.456 -11.659
    3    HB   ILE  59           HB       ILE  59  -9.790  -2.183 -10.265
    4   HG12  ILE  59          HG12      ILE  59 -11.119  -4.549  -8.928
    5   HG13  ILE  59          HG13      ILE  59  -9.481  -4.610  -9.527
    6   HG21  ILE  59          HG21      ILE  59 -12.341  -1.709 -10.502
    7   HG23  ILE  59          HG22      ILE  59 -11.611  -1.507  -8.927
    8   HG22  ILE  59          HG23      ILE  59 -12.539  -2.958  -9.296
    9   HD11  ILE  59          HD11      ILE  59 -10.490  -2.565  -7.565
   10   HD13  ILE  59          HD12      ILE  59  -8.825  -2.750  -8.098
   11   HD12  ILE  59          HD13      ILE  59  -9.580  -4.004  -7.114

  No H/Q in entry =          11
  In of MODEL   73
    1    H    GLU  60           H        GLU  60 -12.811  -2.177 -12.449
    2    HA   GLU  60           HA       GLU  60 -14.966  -3.723 -11.418
    3    HB2  GLU  60           HB2      GLU  60 -15.258  -1.372 -11.992
    4    HB3  GLU  60           HB3      GLU  60 -14.873  -1.704 -13.678
    5    HG2  GLU  60           HG2      GLU  60 -17.155  -3.137 -12.337
    6    HG3  GLU  60           HG3      GLU  60 -17.380  -1.528 -12.992

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLY  61           H        GLY  61 -13.318  -3.686 -14.546
    2    HA3  GLY  61           HA2      GLY  61 -15.006  -5.955 -15.421
    3    HA2  GLY  61           HA3      GLY  61 -14.185  -4.840 -16.506

  No H/Q in entry =           3
  In of MODEL   73
    1    H    ASP  62           H        ASP  62 -12.771  -6.270 -13.632
    2    HA   ASP  62           HA       ASP  62 -10.514  -7.216 -15.131
    3    HB2  ASP  62           HB2      ASP  62  -9.731  -7.988 -12.905
    4    HB3  ASP  62           HB3      ASP  62 -10.229  -6.299 -12.894

  No H/Q in entry =           4
  In of MODEL   73
    1    H    ALA  63           H        ALA  63 -11.960  -8.681 -16.551
    2    HA   ALA  63           HA       ALA  63 -13.061 -11.099 -15.479
    3    HB3  ALA  63           HB1      ALA  63 -12.994 -11.849 -17.872
    4    HB2  ALA  63           HB2      ALA  63 -12.070 -10.401 -18.268
    5    HB1  ALA  63           HB3      ALA  63 -13.728 -10.257 -17.682

  No H/Q in entry =           5
  In of MODEL   73
    1    H    GLY  64           H        GLY  64  -9.944 -10.207 -16.850
    2    HA3  GLY  64           HA2      GLY  64  -7.862 -11.164 -16.647
    3    HA2  GLY  64           HA3      GLY  64  -8.537 -12.265 -15.452

  No H/Q in entry =           3
  In of MODEL   73
    1    H    GLU  65           H        GLU  65  -6.768 -13.446 -16.991
    2    HA   GLU  65           HA       GLU  65  -7.647 -14.370 -19.504
    3    HB2  GLU  65           HB2      GLU  65  -5.654 -15.514 -17.551
    4    HB3  GLU  65           HB3      GLU  65  -5.928 -16.177 -19.163
    5    HG2  GLU  65           HG2      GLU  65  -5.365 -14.013 -20.173
    6    HG3  GLU  65           HG3      GLU  65  -5.130 -13.314 -18.572

  No H/Q in entry =           6
  In of MODEL   73
    1    H    GLY  66           H        GLY  66  -7.979 -15.698 -16.298
    2    HA3  GLY  66           HA2      GLY  66  -9.360 -18.091 -17.151
    3    HA2  GLY  66           HA3      GLY  66  -8.995 -17.618 -15.503

  No H/Q in entry =           3
  In of MODEL   73
    1    H    LYS  67           H        LYS  67 -11.400 -18.742 -16.215
    2    HA   LYS  67           HA       LYS  67 -13.460 -16.967 -16.867
    3    HB2  LYS  67           HB2      LYS  67 -13.748 -19.452 -15.185
    4    HB3  LYS  67           HB3      LYS  67 -14.946 -18.723 -16.261
    5    HG2  LYS  67           HG2      LYS  67 -12.377 -20.124 -16.999
    6    HG3  LYS  67           HG3      LYS  67 -14.013 -20.477 -17.551
    7    HD2  LYS  67           HD2      LYS  67 -13.997 -18.166 -18.641
    8    HD3  LYS  67           HD3      LYS  67 -12.262 -18.138 -18.320
    9    HE2  LYS  67           HE2      LYS  67 -12.087 -20.354 -19.522
   10    HE3  LYS  67           HE3      LYS  67 -13.777 -20.160 -19.993
   11    HZ1  LYS  67           HZ1      LYS  67 -11.870 -17.986 -20.515
   12    HZ3  LYS  67           HZ2      LYS  67 -13.296 -18.391 -21.344
   13    HZ2  LYS  67           HZ3      LYS  67 -11.895 -19.329 -21.548

  No H/Q in entry =          13
  In of MODEL   73
    1    H    MET  68           H        MET  68 -12.308 -18.014 -13.725
    2    HA   MET  68           HA       MET  68 -14.042 -16.072 -12.353
    3    HB2  MET  68           HB2      MET  68 -12.547 -18.486 -11.327
    4    HB3  MET  68           HB3      MET  68 -13.518 -17.403 -10.329
    5    HG2  MET  68           HG2      MET  68 -14.554 -18.958 -12.719
    6    HG3  MET  68           HG3      MET  68 -14.802 -19.409 -11.030
    7    HE3  MET  68           HE1      MET  68 -17.126 -17.041  -9.509
    8    HE2  MET  68           HE2      MET  68 -15.443 -16.518  -9.520
    9    HE1  MET  68           HE3      MET  68 -15.824 -18.232  -9.366

  No H/Q in entry =           9
  In of MODEL   73
    1    H    LYS  69           H        LYS  69 -10.833 -16.268 -13.372
    2    HA   LYS  69           HA       LYS  69  -9.738 -14.924 -11.035
    3    HB2  LYS  69           HB2      LYS  69  -8.489 -16.013 -13.551
    4    HB3  LYS  69           HB3      LYS  69  -7.568 -15.094 -12.359
    5    HG2  LYS  69           HG2      LYS  69  -8.226 -16.691 -10.601
    6    HG3  LYS  69           HG3      LYS  69  -9.172 -17.602 -11.777
    7    HD2  LYS  69           HD2      LYS  69  -7.117 -18.050 -13.077
    8    HD3  LYS  69           HD3      LYS  69  -6.174 -17.165 -11.877
    9    HE2  LYS  69           HE2      LYS  69  -7.888 -19.581 -11.233
   10    HE3  LYS  69           HE3      LYS  69  -6.153 -19.657 -11.534
   11    HZ2  LYS  69           HZ1      LYS  69  -7.551 -18.229  -9.347
   12    HZ1  LYS  69           HZ2      LYS  69  -5.916 -17.968  -9.720
   13    HZ3  LYS  69           HZ3      LYS  69  -6.440 -19.503  -9.212

  No H/Q in entry =          13
  In of MODEL   73
    1    H    VAL  70           H        VAL  70  -7.796 -13.276 -11.866
    2    HA   VAL  70           HA       VAL  70  -9.094 -11.171 -13.495
    3    HB   VAL  70           HB       VAL  70  -8.242  -9.503 -11.889
    4   HG11  VAL  70          HG11      VAL  70 -10.540 -10.384 -11.651
    5   HG13  VAL  70          HG12      VAL  70  -9.846  -9.999 -10.076
    6   HG12  VAL  70          HG13      VAL  70  -9.934 -11.675 -10.614
    7   HG23  VAL  70          HG21      VAL  70  -7.443 -10.359  -9.638
    8   HG22  VAL  70          HG22      VAL  70  -6.332 -10.680 -10.969
    9   HG21  VAL  70          HG23      VAL  70  -7.358 -11.971 -10.347

  No H/Q in entry =           9
  In of MODEL   73
    1    H    SER  71           H        SER  71  -7.540  -9.566 -14.295
    2    HA   SER  71           HA       SER  71  -5.302 -10.732 -15.576
    3    HB2  SER  71           HB2      SER  71  -6.514  -8.709 -16.404
    4    HB3  SER  71           HB3      SER  71  -5.839  -7.795 -15.056
    5    HG   SER  71           HG       SER  71  -4.513  -9.017 -17.236

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LEU  72           H        LEU  72  -3.262 -10.981 -14.952
    2    HA   LEU  72           HA       LEU  72  -2.524 -10.754 -12.246
    3    HB2  LEU  72           HB2      LEU  72  -0.889 -11.169 -14.743
    4    HB3  LEU  72           HB3      LEU  72  -0.206 -11.220 -13.122
    5    HG   LEU  72           HG       LEU  72  -2.543 -12.954 -13.985
    6   HD13  LEU  72          HD11      LEU  72  -0.564 -13.497 -15.344
    7   HD12  LEU  72          HD12      LEU  72  -0.872 -14.777 -14.170
    8   HD11  LEU  72          HD13      LEU  72   0.419 -13.609 -13.882
    9   HD22  LEU  72          HD21      LEU  72  -2.520 -12.956 -11.637
   10   HD21  LEU  72          HD22      LEU  72  -0.774 -12.792 -11.542
   11   HD23  LEU  72          HD23      LEU  72  -1.490 -14.333 -12.007

  No H/Q in entry =          11
  In of MODEL   73
    1    H    VAL  73           H        VAL  73  -1.856  -8.732 -15.034
    2    HA   VAL  73           HA       VAL  73   0.051  -7.007 -13.947
    3    HB   VAL  73           HB       VAL  73  -0.376  -5.594 -15.802
    4   HG12  VAL  73          HG11      VAL  73  -1.148  -8.398 -16.657
    5   HG11  VAL  73          HG12      VAL  73   0.502  -7.896 -16.292
    6   HG13  VAL  73          HG13      VAL  73  -0.362  -7.168 -17.645
    7   HG23  VAL  73          HG21      VAL  73  -2.541  -6.193 -17.185
    8   HG22  VAL  73          HG22      VAL  73  -2.658  -5.111 -15.798
    9   HG21  VAL  73          HG23      VAL  73  -3.119  -6.806 -15.637

  No H/Q in entry =           9
  In of MODEL   73
    1    H    LEU  74           H        LEU  74  -3.340  -7.166 -13.363
    2    HA   LEU  74           HA       LEU  74  -3.987  -4.517 -12.749
    3    HB2  LEU  74           HB2      LEU  74  -5.694  -6.209 -12.908
    4    HB3  LEU  74           HB3      LEU  74  -4.983  -7.116 -11.577
    5    HG   LEU  74           HG       LEU  74  -5.463  -5.239 -10.041
    6   HD11  LEU  74          HD11      LEU  74  -6.496  -4.002 -12.594
    7   HD13  LEU  74          HD12      LEU  74  -5.385  -3.307 -11.415
    8   HD12  LEU  74          HD13      LEU  74  -7.094  -3.486 -11.017
    9   HD23  LEU  74          HD21      LEU  74  -8.022  -5.705 -11.482
   10   HD22  LEU  74          HD22      LEU  74  -7.635  -5.842  -9.780
   11   HD21  LEU  74          HD23      LEU  74  -7.145  -7.108 -10.879

  No H/Q in entry =          11
  In of MODEL   73
    1    H    VAL  75           H        VAL  75  -2.897  -7.088 -10.593
    2    HA   VAL  75           HA       VAL  75  -2.700  -5.531  -8.252
    3    HB   VAL  75           HB       VAL  75  -1.180  -8.009  -9.052
    4   HG12  VAL  75          HG11      VAL  75  -0.703  -8.151  -6.578
    5   HG11  VAL  75          HG12      VAL  75  -1.381  -6.539  -6.398
    6   HG13  VAL  75          HG13      VAL  75   0.080  -6.772  -7.343
    7   HG23  VAL  75          HG21      VAL  75  -3.509  -7.572  -7.151
    8   HG22  VAL  75          HG22      VAL  75  -2.822  -9.121  -7.637
    9   HG21  VAL  75          HG23      VAL  75  -3.694  -8.135  -8.812

  No H/Q in entry =           9
  In of MODEL   73
    1    H    GLU  76           H        GLU  76  -0.301  -6.264 -10.806
    2    HA   GLU  76           HA       GLU  76   1.876  -4.887  -9.666
    3    HB2  GLU  76           HB2      GLU  76   2.033  -6.375 -11.669
    4    HB3  GLU  76           HB3      GLU  76   1.171  -5.168 -12.611
    5    HG2  GLU  76           HG2      GLU  76   2.987  -3.548 -12.240
    6    HG3  GLU  76           HG3      GLU  76   3.864  -4.711 -11.265

  No H/Q in entry =           6
  In of MODEL   73
    1    H    ALA  77           H        ALA  77  -0.688  -3.721 -11.837
    2    HA   ALA  77           HA       ALA  77   0.267  -1.063 -12.023
    3    HB1  ALA  77           HB1      ALA  77  -1.424  -2.029 -13.555
    4    HB2  ALA  77           HB2      ALA  77  -1.979  -0.519 -12.834
    5    HB3  ALA  77           HB3      ALA  77  -2.589  -2.058 -12.230

  No H/Q in entry =           5
  In of MODEL   73
    1    H    GLN  78           H        GLN  78  -1.965  -2.645  -9.794
    2    HA   GLN  78           HA       GLN  78  -2.791  -0.335  -8.389
    3    HB2  GLN  78           HB2      GLN  78  -3.869  -2.611  -8.294
    4    HB3  GLN  78           HB3      GLN  78  -2.519  -3.149  -7.298
    5    HG2  GLN  78           HG2      GLN  78  -3.051  -1.420  -5.633
    6    HG3  GLN  78           HG3      GLN  78  -4.397  -0.867  -6.628
    7   HE21  GLN  78          HE21      GLN  78  -4.835  -1.851  -3.970
    8   HE22  GLN  78          HE22      GLN  78  -5.687  -3.315  -4.080

  No H/Q in entry =           8
  In of MODEL   73
    1    H    LEU  79           H        LEU  79  -0.080  -2.555  -7.956
    2    HA   LEU  79           HA       LEU  79   0.903  -1.642  -5.507
    3    HB2  LEU  79           HB2      LEU  79   1.792  -3.640  -6.579
    4    HB3  LEU  79           HB3      LEU  79   2.415  -2.681  -7.919
    5    HG   LEU  79           HG       LEU  79   3.966  -1.519  -6.428
    6   HD13  LEU  79          HD11      LEU  79   2.974  -1.285  -4.354
    7   HD12  LEU  79          HD12      LEU  79   4.073  -2.620  -4.016
    8   HD11  LEU  79          HD13      LEU  79   2.370  -2.943  -4.333
    9   HD23  LEU  79          HD21      LEU  79   5.213  -3.650  -5.531
   10   HD22  LEU  79          HD22      LEU  79   4.994  -3.455  -7.268
   11   HD21  LEU  79          HD23      LEU  79   3.937  -4.539  -6.366

  No H/Q in entry =          11
  In of MODEL   73
    1    H    HIS  80           H        HIS  80   1.733  -0.517  -8.788
    2    HA   HIS  80           HA       HIS  80   3.520   1.496  -7.881
    3    HB2  HIS  80           HB2      HIS  80   2.221   0.781 -10.454
    4    HB3  HIS  80           HB3      HIS  80   2.794   2.441 -10.289
    5    HD1  HIS  80           HD1      HIS  80   5.187   2.775 -10.829
    6    HD2  HIS  80           HD2      HIS  80   4.432  -1.145  -9.628
    7    HE1  HIS  80           HE1      HIS  80   7.393   1.529 -11.010
    8    HE2  HIS  80           HE2      HIS  80   6.944  -0.864 -10.281

  No H/Q in entry =           8
  In of MODEL   73
    1    H    LEU  81           H        LEU  81   0.107   1.607  -8.836
    2    HA   LEU  81           HA       LEU  81  -0.206   4.395  -8.506
    3    HB2  LEU  81           HB2      LEU  81  -2.187   2.121  -8.410
    4    HB3  LEU  81           HB3      LEU  81  -2.664   3.818  -8.316
    5    HG   LEU  81           HG       LEU  81  -0.971   2.690 -10.563
    6   HD12  LEU  81          HD11      LEU  81  -3.216   2.976 -11.847
    7   HD11  LEU  81          HD12      LEU  81  -3.960   2.898 -10.250
    8   HD13  LEU  81          HD13      LEU  81  -3.001   1.544 -10.842
    9   HD23  LEU  81          HD21      LEU  81  -2.107   4.817 -11.655
   10   HD22  LEU  81          HD22      LEU  81  -0.685   5.009 -10.632
   11   HD21  LEU  81          HD23      LEU  81  -2.290   5.335  -9.981

  No H/Q in entry =          11
  In of MODEL   73
    1    H    MET  82           H        MET  82  -0.809   1.702  -6.250
    2    HA   MET  82           HA       MET  82  -1.870   3.274  -4.157
    3    HB2  MET  82           HB2      MET  82  -0.456   0.608  -4.203
    4    HB3  MET  82           HB3      MET  82  -1.035   1.326  -2.702
    5    HG2  MET  82           HG2      MET  82  -2.778   0.804  -5.130
    6    HG3  MET  82           HG3      MET  82  -2.673  -0.267  -3.735
    7    HE3  MET  82           HE1      MET  82  -4.400   1.359  -0.909
    8    HE2  MET  82           HE2      MET  82  -2.676   1.663  -1.106
    9    HE1  MET  82           HE3      MET  82  -3.344   0.095  -1.554

  No H/Q in entry =           9
  In of MODEL   73
    1    H    THR  83           H        THR  83   1.442   2.238  -4.869
    2    HA   THR  83           HA       THR  83   2.659   3.363  -2.578
    3    HB   THR  83           HB       THR  83   4.744   3.337  -4.067
    4    HG1  THR  83           HG1      THR  83   4.498   2.805  -6.089
    5   HG22  THR  83          HG21      THR  83   4.338   0.672  -4.394
    6   HG21  THR  83          HG22      THR  83   3.051   1.033  -3.244
    7   HG23  THR  83          HG23      THR  83   4.728   1.403  -2.837

  No H/Q in entry =           7
  In of MODEL   73
    1    H    SER  84           H        SER  84   2.245   4.633  -5.877
    2    HA   SER  84           HA       SER  84   3.551   7.094  -5.434
    3    HB2  SER  84           HB2      SER  84   1.479   6.228  -7.437
    4    HB3  SER  84           HB3      SER  84   2.133   7.865  -7.418
    5    HG   SER  84           HG       SER  84   3.540   5.411  -7.717

  No H/Q in entry =           5
  In of MODEL   73
    1    H    MET  85           H        MET  85   0.070   6.284  -5.236
    2    HA   MET  85           HA       MET  85  -0.826   8.882  -4.631
    3    HB2  MET  85           HB2      MET  85  -2.327   7.052  -5.287
    4    HB3  MET  85           HB3      MET  85  -2.014   6.249  -3.750
    5    HG2  MET  85           HG2      MET  85  -2.931   8.182  -2.534
    6    HG3  MET  85           HG3      MET  85  -3.207   9.020  -4.061
    7    HE3  MET  85           HE1      MET  85  -4.055   4.987  -3.277
    8    HE2  MET  85           HE2      MET  85  -5.346   5.497  -2.191
    9    HE1  MET  85           HE3      MET  85  -3.706   6.085  -1.935

  No H/Q in entry =           9
  In of MODEL   73
    1    H    LEU  86           H        LEU  86   0.148   6.236  -2.492
    2    HA   LEU  86           HA       LEU  86  -0.386   7.533  -0.047
    3    HB2  LEU  86           HB2      LEU  86   0.111   5.069  -0.442
    4    HB3  LEU  86           HB3      LEU  86   1.811   5.523  -0.550
    5    HG   LEU  86           HG       LEU  86   1.486   6.681   1.720
    6   HD11  LEU  86          HD11      LEU  86  -1.201   5.876   1.269
    7   HD13  LEU  86          HD12      LEU  86  -0.535   6.633   2.713
    8   HD12  LEU  86          HD13      LEU  86  -0.601   4.876   2.596
    9   HD23  LEU  86          HD21      LEU  86   1.101   3.683   1.847
   10   HD22  LEU  86          HD22      LEU  86   2.096   4.707   2.879
   11   HD21  LEU  86          HD23      LEU  86   2.590   4.388   1.217

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ALA  87           H        ALA  87   2.585   7.279  -1.958
    2    HA   ALA  87           HA       ALA  87   4.283   8.714  -0.246
    3    HB3  ALA  87           HB1      ALA  87   4.372   7.701  -2.954
    4    HB2  ALA  87           HB2      ALA  87   5.710   8.051  -1.863
    5    HB1  ALA  87           HB3      ALA  87   5.070   9.322  -2.903

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ARG  88           H        ARG  88   2.300   9.822  -2.953
    2    HA   ARG  88           HA       ARG  88   3.039  12.521  -2.843
    3    HB2  ARG  88           HB2      ARG  88   1.787  11.351  -4.691
    4    HB3  ARG  88           HB3      ARG  88   0.335  11.475  -3.697
    5    HG2  ARG  88           HG2      ARG  88   1.321  14.069  -3.623
    6    HG3  ARG  88           HG3      ARG  88   1.740  13.559  -5.256
    7    HD2  ARG  88           HD2      ARG  88  -0.408  13.611  -5.938
    8    HD3  ARG  88           HD3      ARG  88  -0.972  12.751  -4.505
    9    HE   ARG  88           HE       ARG  88  -1.202  15.526  -4.923
   10   HH21  ARG  88          HH11      ARG  88  -1.733  16.849  -3.182
   11   HH22  ARG  88          HH12      ARG  88  -1.418  16.317  -1.566
   12   HH11  ARG  88          HH21      ARG  88  -0.139  13.278  -2.555
   13   HH12  ARG  88          HH22      ARG  88  -0.533  14.289  -1.211

  No H/Q in entry =          13
  In of MODEL   73
    1    H    GLU  89           H        GLU  89   0.370  10.813  -1.182
    2    HA   GLU  89           HA       GLU  89  -0.758  13.111   0.030
    3    HB2  GLU  89           HB2      GLU  89  -1.848  10.858  -0.048
    4    HB3  GLU  89           HB3      GLU  89  -0.708  10.318   1.185
    5    HG2  GLU  89           HG2      GLU  89  -1.537  12.006   2.750
    6    HG3  GLU  89           HG3      GLU  89  -2.607  12.663   1.514

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LEU  90           H        LEU  90   1.731  10.851   1.186
    2    HA   LEU  90           HA       LEU  90   2.090  12.101   3.712
    3    HB2  LEU  90           HB2      LEU  90   3.873  10.348   2.023
    4    HB3  LEU  90           HB3      LEU  90   4.298  10.870   3.658
    5    HG   LEU  90           HG       LEU  90   1.675   9.492   3.017
    6   HD12  LEU  90          HD11      LEU  90   2.848   7.461   4.018
    7   HD11  LEU  90          HD12      LEU  90   4.357   8.335   3.764
    8   HD13  LEU  90          HD13      LEU  90   3.340   7.915   2.385
    9   HD22  LEU  90          HD21      LEU  90   1.415  10.413   5.141
   10   HD21  LEU  90          HD22      LEU  90   3.137  10.327   5.510
   11   HD23  LEU  90          HD23      LEU  90   2.149   8.868   5.566

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  91           H        ILE  91   3.665  12.501   0.573
    2    HA   ILE  91           HA       ILE  91   5.626  14.356   1.397
    3    HB   ILE  91           HB       ILE  91   4.300  13.849  -1.273
    4   HG12  ILE  91          HG12      ILE  91   7.146  13.396  -0.320
    5   HG13  ILE  91          HG13      ILE  91   5.880  12.183  -0.147
    6   HG22  ILE  91          HG21      ILE  91   6.502  15.222  -1.979
    7   HG21  ILE  91          HG22      ILE  91   6.194  16.020  -0.435
    8   HG23  ILE  91          HG23      ILE  91   4.961  16.033  -1.695
    9   HD13  ILE  91          HD11      ILE  91   5.692  11.857  -2.453
   10   HD12  ILE  91          HD12      ILE  91   7.425  12.120  -2.253
   11   HD11  ILE  91          HD13      ILE  91   6.395  13.431  -2.832

  No H/Q in entry =          11
  In of MODEL   73
    1    H    THR  92           H        THR  92   2.252  14.749   0.415
    2    HA   THR  92           HA       THR  92   2.193  17.572   0.354
    3    HB   THR  92           HB       THR  92   0.054  15.552   1.070
    4    HG1  THR  92           HG1      THR  92   0.344  15.376  -1.017
    5   HG22  THR  92          HG21      THR  92  -1.378  17.698   0.358
    6   HG21  THR  92          HG22      THR  92   0.010  18.539   1.044
    7   HG23  THR  92          HG23      THR  92  -0.910  17.407   2.033

  No H/Q in entry =           7
  In of MODEL   73
    1    H    GLU  93           H        GLU  93   1.691  15.266   3.012
    2    HA   GLU  93           HA       GLU  93   1.153  17.165   5.034
    3    HB2  GLU  93           HB2      GLU  93   2.499  14.455   5.261
    4    HB3  GLU  93           HB3      GLU  93   1.807  15.375   6.599
    5    HG2  GLU  93           HG2      GLU  93   0.186  14.578   4.173
    6    HG3  GLU  93           HG3      GLU  93   0.310  13.557   5.600

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LEU  94           H        LEU  94   4.167  15.717   3.862
    2    HA   LEU  94           HA       LEU  94   5.919  16.885   5.736
    3    HB2  LEU  94           HB2      LEU  94   6.310  15.921   2.903
    4    HB3  LEU  94           HB3      LEU  94   7.639  16.594   3.842
    5    HG   LEU  94           HG       LEU  94   5.933  14.379   4.991
    6   HD11  LEU  94          HD11      LEU  94   8.015  14.176   2.843
    7   HD13  LEU  94          HD12      LEU  94   6.582  13.186   3.116
    8   HD12  LEU  94          HD13      LEU  94   8.018  12.950   4.112
    9   HD23  LEU  94          HD21      LEU  94   8.137  13.868   6.127
   10   HD22  LEU  94          HD22      LEU  94   7.456  15.439   6.547
   11   HD21  LEU  94          HD23      LEU  94   8.787  15.333   5.395

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  95           H        ILE  95   4.742  18.042   2.595
    2    HA   ILE  95           HA       ILE  95   6.287  20.417   2.523
    3    HB   ILE  95           HB       ILE  95   3.641  19.703   1.237
    4   HG12  ILE  95          HG12      ILE  95   6.417  20.071   0.079
    5   HG13  ILE  95          HG13      ILE  95   5.789  18.511   0.599
    6   HG21  ILE  95          HG21      ILE  95   5.361  22.190   1.003
    7   HG23  ILE  95          HG22      ILE  95   3.639  22.103   1.372
    8   HG22  ILE  95          HG23      ILE  95   4.214  21.708  -0.248
    9   HD13  ILE  95          HD11      ILE  95   4.217  18.417  -1.118
   10   HD12  ILE  95          HD12      ILE  95   5.551  19.250  -1.916
   11   HD11  ILE  95          HD13      ILE  95   4.172  20.169  -1.314

  No H/Q in entry =          11
  In of MODEL   73
    1    H    GLU  96           H        GLU  96   3.056  19.729   3.843
    2    HA   GLU  96           HA       GLU  96   2.411  22.369   4.598
    3    HB2  GLU  96           HB2      GLU  96   0.757  20.568   4.623
    4    HB3  GLU  96           HB3      GLU  96   1.638  19.750   5.912
    5    HG2  GLU  96           HG2      GLU  96   0.615  21.023   7.489
    6    HG3  GLU  96           HG3      GLU  96   1.128  22.502   6.687

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LEU  97           H        LEU  97   4.295  19.840   6.210
    2    HA   LEU  97           HA       LEU  97   4.656  21.193   8.677
    3    HB2  LEU  97           HB2      LEU  97   6.206  19.041   7.252
    4    HB3  LEU  97           HB3      LEU  97   6.800  19.733   8.759
    5    HG   LEU  97           HG       LEU  97   4.000  18.608   8.470
    6   HD12  LEU  97          HD11      LEU  97   4.972  16.607   9.676
    7   HD11  LEU  97          HD12      LEU  97   6.573  17.255   9.320
    8   HD13  LEU  97          HD13      LEU  97   5.499  16.785   8.002
    9   HD23  LEU  97          HD21      LEU  97   4.476  18.320  11.031
   10   HD22  LEU  97          HD22      LEU  97   4.074  19.927  10.429
   11   HD21  LEU  97          HD23      LEU  97   5.753  19.506  10.761

  No H/Q in entry =          11
  In of MODEL   73
    1    H    HIS  98           H        HIS  98   6.503  21.228   5.638
    2    HA   HIS  98           HA       HIS  98   8.647  22.832   6.520
    3    HB2  HIS  98           HB2      HIS  98   7.336  22.561   3.804
    4    HB3  HIS  98           HB3      HIS  98   8.767  23.556   4.083
    5    HD1  HIS  98           HD1      HIS  98   7.595  19.972   4.113
    6    HD2  HIS  98           HD2      HIS  98  11.156  22.107   4.510
    7    HE1  HIS  98           HE1      HIS  98   9.467  18.262   4.043
    8    HE2  HIS  98           HE2      HIS  98  11.640  19.542   4.285

  No H/Q in entry =           8
  In of MODEL   73
    1    H    GLU  99           H        GLU  99   5.408  23.632   5.369
    2    HA   GLU  99           HA       GLU  99   5.757  26.450   5.307
    3    HB2  GLU  99           HB2      GLU  99   3.882  25.261   4.191
    4    HB3  GLU  99           HB3      GLU  99   3.202  24.893   5.776
    5    HG2  GLU  99           HG2      GLU  99   3.000  27.283   6.277
    6    HG3  GLU  99           HG3      GLU  99   3.760  27.690   4.742

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LYS 100           H        LYS 100   4.669  24.204   7.838
    2    HA   LYS 100           HA       LYS 100   4.075  26.253   9.736
    3    HB2  LYS 100           HB2      LYS 100   4.684  23.308  10.078
    4    HB3  LYS 100           HB3      LYS 100   4.236  24.376  11.413
    5    HG2  LYS 100           HG2      LYS 100   2.154  24.992  10.181
    6    HG3  LYS 100           HG3      LYS 100   2.583  23.827   8.925
    7    HD2  LYS 100           HD2      LYS 100   2.537  22.006  10.588
    8    HD3  LYS 100           HD3      LYS 100   2.125  23.165  11.854
    9    HE2  LYS 100           HE2      LYS 100   0.056  23.765  10.606
   10    HE3  LYS 100           HE3      LYS 100   0.459  22.548   9.388
   11    HZ1  LYS 100           HZ1      LYS 100   0.222  21.880  12.271
   12    HZ3  LYS 100           HZ2      LYS 100   0.207  20.825  10.937
   13    HZ2  LYS 100           HZ3      LYS 100  -1.117  21.851  11.226

  No H/Q in entry =          13
  In of MODEL   73
    1    H    LEU 101           H        LEU 101   7.011  24.487   8.880
    2    HA   LEU 101           HA       LEU 101   8.617  25.344  11.072
    3    HB2  LEU 101           HB2      LEU 101   9.201  24.363   8.289
    4    HB3  LEU 101           HB3      LEU 101  10.503  25.041   9.261
    5    HG   LEU 101           HG       LEU 101   8.701  22.867  10.339
    6   HD12  LEU 101          HD11      LEU 101  10.766  21.393   9.715
    7   HD11  LEU 101          HD12      LEU 101  11.111  22.659   8.540
    8   HD13  LEU 101          HD13      LEU 101   9.590  21.771   8.458
    9   HD21  LEU 101          HD21      LEU 101  11.420  24.003  11.046
   10   HD23  LEU 101          HD22      LEU 101  10.897  22.425  11.630
   11   HD22  LEU 101          HD23      LEU 101   9.993  23.872  12.074

  No H/Q in entry =          11
  In of MODEL   73
    1    H    LYS 102           H        LYS 102   6.999  27.191   8.942
    2    HA   LYS 102           HA       LYS 102   7.052  29.484   8.649
    3    HB2  LYS 102           HB2      LYS 102   8.633  29.385  10.736
    4    HB3  LYS 102           HB3      LYS 102   9.922  29.592   9.567
    5    HG2  LYS 102           HG2      LYS 102   7.803  31.525  10.444
    6    HG3  LYS 102           HG3      LYS 102   9.511  31.802  10.179
    7    HD2  LYS 102           HD2      LYS 102   7.547  31.358   7.894
    8    HD3  LYS 102           HD3      LYS 102   7.920  32.942   8.560
    9    HE2  LYS 102           HE2      LYS 102   9.288  31.770   6.476
   10    HE3  LYS 102           HE3      LYS 102   9.900  33.083   7.482
   11    HZ2  LYS 102           HZ1      LYS 102  11.437  31.194   7.296
   12    HZ1  LYS 102           HZ2      LYS 102  10.291  30.200   8.047
   13    HZ3  LYS 102           HZ3      LYS 102  10.977  31.494   8.901

  No H/Q in entry =          13
  In of MODEL   73
    1    H    ALA 103           H        ALA 103  10.317  28.177   8.061
    2    HA   ALA 103           HA       ALA 103  11.252  29.563   5.977
    3    HB2  ALA 103           HB1      ALA 103  12.152  27.357   5.043
    4    HB1  ALA 103           HB2      ALA 103  11.274  26.575   6.356
    5    HB3  ALA 103           HB3      ALA 103  12.555  27.731   6.719

  No H/Q in entry =           5
  In of MODEL   73
    1    H1   LYS   3           H1       LYS   3 -30.798   6.393 -19.810
    2    H2   LYS   3           H3       LYS   3 -29.805   6.078 -21.151
    3    H3   LYS   3           H2       LYS   3 -31.227   5.181 -20.919
    4    HA   LYS   3           HA       LYS   3 -30.276   3.764 -19.506
    5    HB2  LYS   3           HB2      LYS   3 -27.944   5.114 -20.815
    6    HB3  LYS   3           HB3      LYS   3 -27.664   3.897 -19.570
    7    HG2  LYS   3           HG2      LYS   3 -29.116   2.351 -20.936
    8    HG3  LYS   3           HG3      LYS   3 -29.025   3.550 -22.225
    9    HD2  LYS   3           HD2      LYS   3 -26.547   3.370 -22.150
   10    HD3  LYS   3           HD3      LYS   3 -26.713   2.073 -20.966
   11    HE2  LYS   3           HE2      LYS   3 -28.226   0.942 -22.699
   12    HE3  LYS   3           HE3      LYS   3 -27.563   2.103 -23.847
   13    HZ3  LYS   3           HZ1      LYS   3 -25.797   0.826 -24.100
   14    HZ2  LYS   3           HZ2      LYS   3 -26.469  -0.325 -23.048
   15    HZ1  LYS   3           HZ3      LYS   3 -25.451   0.890 -22.439

  No H/Q in entry =          15
  In of MODEL   73
    1    H    LYS   4           H        LYS   4 -30.354   3.621 -17.446
    2    HA   LYS   4           HA       LYS   4 -29.577   5.884 -15.786
    3    HB2  LYS   4           HB2      LYS   4 -30.859   3.226 -15.101
    4    HB3  LYS   4           HB3      LYS   4 -30.611   4.556 -13.972
    5    HG2  LYS   4           HG2      LYS   4 -32.397   4.547 -16.411
    6    HG3  LYS   4           HG3      LYS   4 -32.902   4.610 -14.723
    7    HD2  LYS   4           HD2      LYS   4 -32.146   6.811 -14.447
    8    HD3  LYS   4           HD3      LYS   4 -31.094   6.725 -15.860
    9    HE2  LYS   4           HE2      LYS   4 -32.976   8.153 -16.340
   10    HE3  LYS   4           HE3      LYS   4 -33.088   6.685 -17.310
   11    HZ3  LYS   4           HZ1      LYS   4 -34.704   5.816 -15.780
   12    HZ2  LYS   4           HZ2      LYS   4 -35.211   7.327 -16.368
   13    HZ1  LYS   4           HZ3      LYS   4 -34.573   7.197 -14.799

  No H/Q in entry =          13
  In of MODEL   73
    1    H    HIS   5           H        HIS   5 -28.121   5.926 -14.180
    2    HA   HIS   5           HA       HIS   5 -25.889   4.031 -14.491
    3    HB2  HIS   5           HB2      HIS   5 -26.076   6.791 -13.285
    4    HB3  HIS   5           HB3      HIS   5 -24.622   5.794 -13.254
    5    HD1  HIS   5           HD1      HIS   5 -23.103   6.951 -14.828
    6    HD2  HIS   5           HD2      HIS   5 -26.905   6.445 -16.420
    7    HE1  HIS   5           HE1      HIS   5 -22.894   7.529 -17.275
    8    HE2  HIS   5           HE2      HIS   5 -25.213   7.208 -18.215

  No H/Q in entry =           8
  In of MODEL   73
    1    H    ILE   6           H        ILE   6 -25.720   2.451 -13.175
    2    HA   ILE   6           HA       ILE   6 -26.714   2.745 -10.419
    3    HB   ILE   6           HB       ILE   6 -25.949   0.256 -11.952
    4   HG12  ILE   6          HG12      ILE   6 -28.671   1.275 -11.127
    5   HG13  ILE   6          HG13      ILE   6 -28.008   1.419 -12.754
    6   HG23  ILE   6          HG21      ILE   6 -26.377  -0.986 -10.098
    7   HG22  ILE   6          HG22      ILE   6 -27.506   0.194  -9.428
    8   HG21  ILE   6          HG23      ILE   6 -25.768   0.478  -9.321
    9   HD13  ILE   6          HD11      ILE   6 -28.526  -0.685 -13.262
   10   HD12  ILE   6          HD12      ILE   6 -29.554  -0.639 -11.830
   11   HD11  ILE   6          HD13      ILE   6 -27.921  -1.296 -11.722

  No H/Q in entry =          11
  In of MODEL   73
    1    H    TYR   7           H        TYR   7 -24.949   3.332  -9.115
    2    HA   TYR   7           HA       TYR   7 -22.261   2.293  -9.769
    3    HB2  TYR   7           HB2      TYR   7 -23.165   4.755  -8.295
    4    HB3  TYR   7           HB3      TYR   7 -21.496   4.188  -8.318
    5    HD1  TYR   7           HD1      TYR   7 -22.535   3.281 -11.419
    6    HD2  TYR   7           HD2      TYR   7 -21.778   6.828  -9.181
    7    HE1  TYR   7           HE1      TYR   7 -22.045   4.498 -13.504
    8    HE2  TYR   7           HE2      TYR   7 -21.330   8.054 -11.259
    9    HH   TYR   7           HH       TYR   7 -21.530   7.976 -13.494

  No H/Q in entry =           9
  In of MODEL   73
    1    H    LEU   8           H        LEU   8 -21.351   0.911  -8.433
    2    HA   LEU   8           HA       LEU   8 -22.522   0.449  -5.761
    3    HB2  LEU   8           HB2      LEU   8 -20.853  -1.264  -7.581
    4    HB3  LEU   8           HB3      LEU   8 -21.067  -1.642  -5.871
    5    HG   LEU   8           HG       LEU   8 -23.547  -1.738  -6.318
    6   HD13  LEU   8          HD11      LEU   8 -23.619  -0.516  -8.428
    7   HD12  LEU   8          HD12      LEU   8 -24.198  -2.162  -8.675
    8   HD11  LEU   8          HD13      LEU   8 -22.570  -1.714  -9.184
    9   HD23  LEU   8          HD21      LEU   8 -22.319  -3.816  -8.002
   10   HD22  LEU   8          HD22      LEU   8 -23.424  -3.951  -6.635
   11   HD21  LEU   8          HD23      LEU   8 -21.710  -3.650  -6.356

  No H/Q in entry =          11
  In of MODEL   73
    1    H    PHE   9           H        PHE   9 -21.262   0.828  -3.966
    2    HA   PHE   9           HA       PHE   9 -18.444   1.676  -4.450
    3    HB2  PHE   9           HB2      PHE   9 -20.459   2.797  -2.510
    4    HB3  PHE   9           HB3      PHE   9 -18.739   3.152  -2.443
    5    HD1  PHE   9           HD1      PHE   9 -17.644   4.442  -4.209
    6    HD2  PHE   9           HD2      PHE   9 -21.868   3.691  -4.298
    7    HE1  PHE   9           HE1      PHE   9 -17.915   6.169  -5.964
    8    HE2  PHE   9           HE2      PHE   9 -22.139   5.429  -6.048
    9    HZ   PHE   9           HZ       PHE   9 -20.161   6.664  -6.888

  No H/Q in entry =           9
  In of MODEL   73
    1    H    SER  10           H        SER  10 -16.899   0.637  -3.369
    2    HA   SER  10           HA       SER  10 -17.150  -0.254  -0.672
    3    HB2  SER  10           HB2      SER  10 -18.402  -2.087  -1.734
    4    HB3  SER  10           HB3      SER  10 -17.056  -2.365  -2.828
    5    HG   SER  10           HG       SER  10 -17.062  -3.753  -0.987

  No H/Q in entry =           5
  In of MODEL   73
    1    H    SER  11           H        SER  11 -15.146  -0.124   0.169
    2    HA   SER  11           HA       SER  11 -12.937   0.678  -1.336
    3    HB2  SER  11           HB2      SER  11 -11.743   0.661   0.660
    4    HB3  SER  11           HB3      SER  11 -13.413   0.848   1.199
    5    HG   SER  11           HG       SER  11 -12.230  -0.806   2.327

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ALA  12           H        ALA  12 -14.186  -2.035  -2.111
    2    HA   ALA  12           HA       ALA  12 -11.612  -3.282  -2.665
    3    HB3  ALA  12           HB1      ALA  12 -12.244  -4.427  -0.619
    4    HB2  ALA  12           HB2      ALA  12 -12.398  -5.535  -1.980
    5    HB1  ALA  12           HB3      ALA  12 -13.838  -4.794  -1.281

  No H/Q in entry =           5
  In of MODEL   73
    1    H    GLY  13           H        GLY  13 -12.316  -2.323  -4.702
    2    HA3  GLY  13           HA2      GLY  13 -14.583  -2.919  -6.169
    3    HA2  GLY  13           HA3      GLY  13 -13.008  -2.564  -6.894

  No H/Q in entry =           3
  In of MODEL   73
    1    H    MET  14           H        MET  14 -11.618  -4.921  -5.956
    2    HA   MET  14           HA       MET  14 -12.139  -6.650  -8.060
    3    HB2  MET  14           HB2      MET  14 -10.053  -6.824  -6.801
    4    HB3  MET  14           HB3      MET  14 -10.914  -7.453  -5.398
    5    HG2  MET  14           HG2      MET  14 -11.614  -9.424  -6.719
    6    HG3  MET  14           HG3      MET  14 -10.771  -8.781  -8.129
    7    HE1  MET  14           HE1      MET  14  -8.562  -8.393  -8.438
    8    HE3  MET  14           HE2      MET  14  -7.178  -9.093  -7.602
    9    HE2  MET  14           HE3      MET  14  -7.922  -7.623  -6.978

  No H/Q in entry =           9
  In of MODEL   73
    1    H    SER  15           H        SER  15 -13.316  -7.107  -4.713
    2    HA   SER  15           HA       SER  15 -14.760  -9.492  -5.411
    3    HB2  SER  15           HB2      SER  15 -14.245  -9.251  -3.079
    4    HB3  SER  15           HB3      SER  15 -15.017  -7.668  -3.014
    5    HG   SER  15           HG       SER  15 -16.447  -9.989  -3.792

  No H/Q in entry =           5
  In of MODEL   73
    1    H    THR  16           H        THR  16 -15.734  -6.075  -5.040
    2    HA   THR  16           HA       THR  16 -18.531  -6.492  -5.602
    3    HB   THR  16           HB       THR  16 -16.891  -3.982  -6.091
    4    HG1  THR  16           HG1      THR  16 -16.501  -4.231  -4.033
    5   HG21  THR  16          HG21      THR  16 -19.270  -4.123  -6.938
    6   HG23  THR  16          HG22      THR  16 -18.981  -2.829  -5.762
    7   HG22  THR  16          HG23      THR  16 -19.777  -4.329  -5.266

  No H/Q in entry =           7
  In of MODEL   73
    1    H    SER  17           H        SER  17 -15.656  -6.017  -7.427
    2    HA   SER  17           HA       SER  17 -16.733  -5.242  -9.940
    3    HB2  SER  17           HB2      SER  17 -14.154  -6.650  -9.220
    4    HB3  SER  17           HB3      SER  17 -14.565  -6.178 -10.868
    5    HG   SER  17           HG       SER  17 -13.320  -4.703  -9.259

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LEU  18           H        LEU  18 -16.275  -8.403  -8.489
    2    HA   LEU  18           HA       LEU  18 -16.879  -9.884 -10.851
    3    HB2  LEU  18           HB2      LEU  18 -15.710 -10.863  -8.913
    4    HB3  LEU  18           HB3      LEU  18 -17.168 -10.661  -7.944
    5    HG   LEU  18           HG       LEU  18 -18.373 -12.200  -9.420
    6   HD13  LEU  18          HD11      LEU  18 -17.419 -11.998 -11.540
    7   HD12  LEU  18          HD12      LEU  18 -16.779 -13.548 -10.994
    8   HD11  LEU  18          HD13      LEU  18 -15.774 -12.101 -10.917
    9   HD23  LEU  18          HD21      LEU  18 -15.795 -13.466  -8.571
   10   HD22  LEU  18          HD22      LEU  18 -17.407 -14.180  -8.629
   11   HD21  LEU  18          HD23      LEU  18 -17.034 -12.941  -7.431

  No H/Q in entry =          11
  In of MODEL   73
    1    H    LEU  19           H        LEU  19 -18.841  -8.620  -8.161
    2    HA   LEU  19           HA       LEU  19 -21.329  -9.729  -9.021
    3    HB2  LEU  19           HB2      LEU  19 -21.036  -8.894  -6.763
    4    HB3  LEU  19           HB3      LEU  19 -20.740  -7.270  -7.380
    5    HG   LEU  19           HG       LEU  19 -23.055  -7.060  -8.053
    6   HD11  LEU  19          HD11      LEU  19 -23.101  -9.959  -7.381
    7   HD13  LEU  19          HD12      LEU  19 -23.915  -9.091  -8.682
    8   HD12  LEU  19          HD13      LEU  19 -24.549  -9.012  -7.039
    9   HD22  LEU  19          HD21      LEU  19 -22.484  -6.393  -5.818
   10   HD21  LEU  19          HD22      LEU  19 -22.678  -8.046  -5.233
   11   HD23  LEU  19          HD23      LEU  19 -24.081  -7.142  -5.805

  No H/Q in entry =          11
  In of MODEL   73
    1    H    VAL  20           H        VAL  20 -19.733  -6.614  -9.697
    2    HA   VAL  20           HA       VAL  20 -21.796  -5.509 -11.288
    3    HB   VAL  20           HB       VAL  20 -18.790  -5.007 -11.418
    4   HG12  VAL  20          HG11      VAL  20 -19.407  -2.913 -12.625
    5   HG11  VAL  20          HG12      VAL  20 -21.065  -3.503 -12.736
    6   HG13  VAL  20          HG13      VAL  20 -19.764  -4.369 -13.553
    7   HG21  VAL  20          HG21      VAL  20 -21.060  -3.740  -9.952
    8   HG23  VAL  20          HG22      VAL  20 -19.631  -2.799 -10.371
    9   HG22  VAL  20          HG23      VAL  20 -19.475  -4.231  -9.354

  No H/Q in entry =           9
  In of MODEL   73
    1    H    SER  21           H        SER  21 -19.089  -7.640 -12.287
    2    HA   SER  21           HA       SER  21 -19.839  -7.504 -15.046
    3    HB2  SER  21           HB2      SER  21 -18.458  -9.511 -15.366
    4    HB3  SER  21           HB3      SER  21 -17.604  -8.291 -14.424
    5    HG   SER  21           HG       SER  21 -18.053  -9.442 -12.576

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LYS  22           H        LYS  22 -20.997  -9.658 -12.488
    2    HA   LYS  22           HA       LYS  22 -22.563 -11.230 -14.328
    3    HB2  LYS  22           HB2      LYS  22 -21.854 -11.991 -12.031
    4    HB3  LYS  22           HB3      LYS  22 -23.054 -10.880 -11.373
    5    HG2  LYS  22           HG2      LYS  22 -24.161 -12.912 -11.345
    6    HG3  LYS  22           HG3      LYS  22 -24.733 -12.175 -12.842
    7    HD2  LYS  22           HD2      LYS  22 -23.182 -13.509 -14.138
    8    HD3  LYS  22           HD3      LYS  22 -22.487 -14.183 -12.663
    9    HE2  LYS  22           HE2      LYS  22 -25.360 -14.552 -13.535
   10    HE3  LYS  22           HE3      LYS  22 -24.073 -15.727 -13.804
   11    HZ1  LYS  22           HZ1      LYS  22 -24.077 -15.086 -11.098
   12    HZ3  LYS  22           HZ2      LYS  22 -24.499 -16.561 -11.828
   13    HZ2  LYS  22           HZ3      LYS  22 -25.690 -15.385 -11.541

  No H/Q in entry =          13
  In of MODEL   73
    1    H    MET  23           H        MET  23 -23.218  -8.289 -12.464
    2    HA   MET  23           HA       MET  23 -26.021  -8.281 -13.002
    3    HB2  MET  23           HB2      MET  23 -24.111  -6.031 -12.407
    4    HB3  MET  23           HB3      MET  23 -25.848  -5.808 -12.603
    5    HG2  MET  23           HG2      MET  23 -26.301  -7.101 -10.640
    6    HG3  MET  23           HG3      MET  23 -24.605  -7.564 -10.495
    7    HE2  MET  23           HE1      MET  23 -26.803  -3.845  -9.327
    8    HE1  MET  23           HE2      MET  23 -27.071  -4.804 -10.782
    9    HE3  MET  23           HE3      MET  23 -25.992  -3.409 -10.833

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ARG  24           H        ARG  24 -23.205  -6.937 -14.754
    2    HA   ARG  24           HA       ARG  24 -24.640  -5.589 -16.768
    3    HB2  ARG  24           HB2      ARG  24 -22.208  -5.236 -16.386
    4    HB3  ARG  24           HB3      ARG  24 -21.888  -6.861 -16.938
    5    HG2  ARG  24           HG2      ARG  24 -21.367  -5.580 -18.854
    6    HG3  ARG  24           HG3      ARG  24 -23.053  -6.067 -19.170
    7    HD2  ARG  24           HD2      ARG  24 -23.850  -3.952 -18.126
    8    HD3  ARG  24           HD3      ARG  24 -22.175  -3.487 -17.852
    9    HE   ARG  24           HE       ARG  24 -21.960  -2.719 -19.913
   10   HH21  ARG  24          HH11      ARG  24 -23.235  -1.546 -21.345
   11   HH22  ARG  24          HH12      ARG  24 -24.584  -2.308 -22.113
   12   HH11  ARG  24          HH21      ARG  24 -24.313  -5.149 -20.019
   13   HH12  ARG  24          HH22      ARG  24 -25.207  -4.443 -21.328

  No H/Q in entry =          13
  In of MODEL   73
    1    H    ALA  25           H        ALA  25 -23.628  -8.961 -16.484
    2    HA   ALA  25           HA       ALA  25 -24.253  -9.769 -19.129
    3    HB1  ALA  25           HB1      ALA  25 -23.630 -11.823 -18.429
    4    HB3  ALA  25           HB2      ALA  25 -24.701 -11.770 -17.030
    5    HB2  ALA  25           HB3      ALA  25 -23.121 -10.993 -16.958

  No H/Q in entry =           5
  In of MODEL   73
    1    H    GLN  26           H        GLN  26 -26.113  -9.753 -16.126
    2    HA   GLN  26           HA       GLN  26 -28.483 -10.877 -17.171
    3    HB2  GLN  26           HB2      GLN  26 -27.941  -9.151 -14.775
    4    HB3  GLN  26           HB3      GLN  26 -29.523  -9.823 -15.144
    5    HG2  GLN  26           HG2      GLN  26 -26.990 -11.363 -14.649
    6    HG3  GLN  26           HG3      GLN  26 -28.359 -11.219 -13.554
    7   HE21  GLN  26          HE21      GLN  26 -27.198 -13.419 -14.821
    8   HE22  GLN  26          HE22      GLN  26 -28.265 -14.431 -15.631

  No H/Q in entry =           8
  In of MODEL   73
    1    H    ALA  27           H        ALA  27 -27.443  -7.513 -16.763
    2    HA   ALA  27           HA       ALA  27 -29.887  -6.339 -17.571
    3    HB1  ALA  27           HB1      ALA  27 -28.049  -5.084 -16.433
    4    HB3  ALA  27           HB2      ALA  27 -28.597  -4.297 -17.914
    5    HB2  ALA  27           HB3      ALA  27 -27.090  -5.214 -17.910

  No H/Q in entry =           5
  In of MODEL   73
    1    H    GLU  28           H        GLU  28 -27.207  -7.645 -19.413
    2    HA   GLU  28           HA       GLU  28 -28.078  -6.570 -21.940
    3    HB2  GLU  28           HB2      GLU  28 -25.730  -7.332 -21.292
    4    HB3  GLU  28           HB3      GLU  28 -26.328  -8.976 -21.503
    5    HG2  GLU  28           HG2      GLU  28 -25.134  -8.234 -23.457
    6    HG3  GLU  28           HG3      GLU  28 -26.838  -8.501 -23.825

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LYS  29           H        LYS  29 -28.365  -9.673 -20.293
    2    HA   LYS  29           HA       LYS  29 -29.693 -11.095 -22.317
    3    HB2  LYS  29           HB2      LYS  29 -28.699 -12.117 -20.303
    4    HB3  LYS  29           HB3      LYS  29 -29.958 -11.371 -19.320
    5    HG2  LYS  29           HG2      LYS  29 -31.650 -12.686 -20.410
    6    HG3  LYS  29           HG3      LYS  29 -30.460 -13.357 -21.523
    7    HD2  LYS  29           HD2      LYS  29 -29.376 -14.565 -19.781
    8    HD3  LYS  29           HD3      LYS  29 -30.269 -13.697 -18.533
    9    HE2  LYS  29           HE2      LYS  29 -31.094 -16.020 -18.910
   10    HE3  LYS  29           HE3      LYS  29 -32.329 -14.786 -19.165
   11    HZ1  LYS  29           HZ1      LYS  29 -31.742 -14.932 -21.586
   12    HZ3  LYS  29           HZ2      LYS  29 -32.514 -16.296 -20.933
   13    HZ2  LYS  29           HZ3      LYS  29 -30.841 -16.321 -21.212

  No H/Q in entry =          13
  In of MODEL   73
    1    H    TYR  30           H        TYR  30 -31.043  -8.951 -19.822
    2    HA   TYR  30           HA       TYR  30 -33.705  -9.311 -21.095
    3    HB2  TYR  30           HB2      TYR  30 -33.045  -8.185 -18.363
    4    HB3  TYR  30           HB3      TYR  30 -34.664  -8.388 -19.035
    5    HD1  TYR  30           HD1      TYR  30 -35.645 -10.649 -19.265
    6    HD2  TYR  30           HD2      TYR  30 -31.808 -10.056 -17.516
    7    HE1  TYR  30           HE1      TYR  30 -35.641 -12.981 -18.475
    8    HE2  TYR  30           HE2      TYR  30 -31.804 -12.374 -16.730
    9    HH   TYR  30           HH       TYR  30 -33.507 -14.677 -17.848

  No H/Q in entry =           9
  In of MODEL   73
    1    H    GLU  31           H        GLU  31 -31.467  -7.388 -21.864
    2    HA   GLU  31           HA       GLU  31 -31.314  -5.232 -22.681
    3    HB2  GLU  31           HB2      GLU  31 -34.225  -5.853 -23.227
    4    HB3  GLU  31           HB3      GLU  31 -33.332  -4.511 -23.943
    5    HG2  GLU  31           HG2      GLU  31 -31.893  -5.993 -25.122
    6    HG3  GLU  31           HG3      GLU  31 -32.513  -7.390 -24.245

  No H/Q in entry =           6
  In of MODEL   73
    1    H    VAL  32           H        VAL  32 -31.540  -5.132 -19.950
    2    HA   VAL  32           HA       VAL  32 -33.342  -2.962 -19.306
    3    HB   VAL  32           HB       VAL  32 -31.000  -4.036 -17.701
    4   HG12  VAL  32          HG11      VAL  32 -32.530  -3.168 -15.820
    5   HG11  VAL  32          HG12      VAL  32 -33.321  -2.235 -17.092
    6   HG13  VAL  32          HG13      VAL  32 -31.608  -1.986 -16.751
    7   HG21  VAL  32          HG21      VAL  32 -32.814  -5.697 -18.414
    8   HG23  VAL  32          HG22      VAL  32 -33.841  -4.840 -17.264
    9   HG22  VAL  32          HG23      VAL  32 -32.354  -5.613 -16.714

  No H/Q in entry =           9
  In of MODEL   73
    1    HA   PRO  33           HA       PRO  33 -30.201  -0.126 -20.937
    2    HB2  PRO  33           HB2      PRO  33 -31.644   2.142 -20.823
    3    HB3  PRO  33           HB3      PRO  33 -32.140   0.859 -21.927
    4    HG2  PRO  33           HG2      PRO  33 -33.123   1.397 -19.123
    5    HG3  PRO  33           HG3      PRO  33 -34.077   1.222 -20.596
    6    HD2  PRO  33           HD2      PRO  33 -33.705  -0.868 -18.932
    7    HD3  PRO  33           HD3      PRO  33 -33.755  -1.102 -20.679

  No H/Q in entry =           7
  In of MODEL   73
    1    H    VAL  34           H        VAL  34 -28.977  -0.715 -18.975
    2    HA   VAL  34           HA       VAL  34 -28.636   1.696 -17.317
    3    HB   VAL  34           HB       VAL  34 -28.122   0.212 -15.377
    4   HG12  VAL  34          HG11      VAL  34 -30.564  -0.587 -15.100
    5   HG11  VAL  34          HG12      VAL  34 -30.839   0.186 -16.659
    6   HG13  VAL  34          HG13      VAL  34 -30.272   1.141 -15.289
    7   HG21  VAL  34          HG21      VAL  34 -28.348  -1.802 -17.394
    8   HG23  VAL  34          HG22      VAL  34 -29.430  -2.134 -16.041
    9   HG22  VAL  34          HG23      VAL  34 -27.707  -1.901 -15.754

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ILE  35           H        ILE  35 -26.657   2.068 -16.453
    2    HA   ILE  35           HA       ILE  35 -24.381   0.673 -17.695
    3    HB   ILE  35           HB       ILE  35 -24.701   3.571 -16.880
    4   HG12  ILE  35          HG12      ILE  35 -23.730   2.241 -19.418
    5   HG13  ILE  35          HG13      ILE  35 -25.344   2.911 -19.174
    6   HG21  ILE  35          HG21      ILE  35 -22.183   1.961 -17.166
    7   HG23  ILE  35          HG22      ILE  35 -22.615   3.150 -15.938
    8   HG22  ILE  35          HG23      ILE  35 -22.199   3.678 -17.569
    9   HD11  ILE  35          HD11      ILE  35 -23.884   5.060 -18.550
   10   HD13  ILE  35          HD12      ILE  35 -24.414   4.698 -20.194
   11   HD12  ILE  35          HD13      ILE  35 -22.780   4.278 -19.681

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ILE  36           H        ILE  36 -23.200  -0.392 -16.086
    2    HA   ILE  36           HA       ILE  36 -23.653   0.227 -13.219
    3    HB   ILE  36           HB       ILE  36 -22.895  -2.496 -14.327
    4   HG12  ILE  36          HG12      ILE  36 -25.685  -1.608 -13.591
    5   HG13  ILE  36          HG13      ILE  36 -25.094  -1.601 -15.253
    6   HG23  ILE  36          HG21      ILE  36 -23.294  -3.320 -12.219
    7   HG22  ILE  36          HG22      ILE  36 -24.387  -2.004 -11.789
    8   HG21  ILE  36          HG23      ILE  36 -22.646  -1.725 -11.840
    9   HD13  ILE  36          HD11      ILE  36 -25.324  -3.808 -15.468
   10   HD12  ILE  36          HD12      ILE  36 -26.401  -3.658 -14.080
   11   HD11  ILE  36          HD13      ILE  36 -24.719  -4.130 -13.843

  No H/Q in entry =          11
  In of MODEL   73
    1    H    GLU  37           H        GLU  37 -21.865   0.798 -12.093
    2    HA   GLU  37           HA       GLU  37 -19.190  -0.076 -12.982
    3    HB2  GLU  37           HB2      GLU  37 -20.013   2.738 -12.285
    4    HB3  GLU  37           HB3      GLU  37 -18.339   2.196 -12.394
    5    HG2  GLU  37           HG2      GLU  37 -20.308   2.229 -14.664
    6    HG3  GLU  37           HG3      GLU  37 -19.076   3.453 -14.359

  No H/Q in entry =           6
  In of MODEL   73
    1    H    ALA  38           H        ALA  38 -17.730  -0.362 -11.283
    2    HA   ALA  38           HA       ALA  38 -18.785  -0.162  -8.524
    3    HB1  ALA  38           HB1      ALA  38 -17.114  -2.147  -9.937
    4    HB3  ALA  38           HB2      ALA  38 -18.186  -2.355  -8.552
    5    HB2  ALA  38           HB3      ALA  38 -16.557  -1.721  -8.319

  No H/Q in entry =           5
  In of MODEL   73
    1    H    PHE  39           H        PHE  39 -17.527   1.007  -7.033
    2    HA   PHE  39           HA       PHE  39 -14.958   2.137  -7.898
    3    HB2  PHE  39           HB2      PHE  39 -17.071   3.815  -6.556
    4    HB3  PHE  39           HB3      PHE  39 -15.528   4.347  -7.219
    5    HD1  PHE  39           HD1      PHE  39 -15.291   4.914  -9.488
    6    HD2  PHE  39           HD2      PHE  39 -18.895   3.124  -8.077
    7    HE1  PHE  39           HE1      PHE  39 -16.394   5.467 -11.637
    8    HE2  PHE  39           HE2      PHE  39 -20.007   3.663 -10.214
    9    HZ   PHE  39           HZ       PHE  39 -18.755   4.807 -12.013

  No H/Q in entry =           9
  In of MODEL   73
    1    HA   PRO  40           HA       PRO  40 -14.088   1.344  -3.604
    2    HB2  PRO  40           HB2      PRO  40 -12.273   3.309  -2.973
    3    HB3  PRO  40           HB3      PRO  40 -11.854   1.966  -4.037
    4    HG2  PRO  40           HG2      PRO  40 -12.791   4.731  -4.792
    5    HG3  PRO  40           HG3      PRO  40 -11.384   3.848  -5.385
    6    HD2  PRO  40           HD2      PRO  40 -13.593   3.834  -6.812
    7    HD3  PRO  40           HD3      PRO  40 -12.685   2.335  -6.621

  No H/Q in entry =           7
  In of MODEL   73
    1    H    GLU  41           H        GLU  41 -14.706   2.333  -1.478
    2    HA   GLU  41           HA       GLU  41 -16.902   4.098  -1.480
    3    HB2  GLU  41           HB2      GLU  41 -16.645   4.120   0.953
    4    HB3  GLU  41           HB3      GLU  41 -16.510   2.483   0.311
    5    HG2  GLU  41           HG2      GLU  41 -14.831   2.517   1.883
    6    HG3  GLU  41           HG3      GLU  41 -13.956   2.924   0.407

  No H/Q in entry =           6
  In of MODEL   73
    1    H    THR  42           H        THR  42 -13.547   4.923  -1.493
    2    HA   THR  42           HA       THR  42 -13.843   7.489  -0.277
    3    HB   THR  42           HB       THR  42 -11.660   8.006  -1.360
    4    HG1  THR  42           HG1      THR  42 -10.800   5.940  -2.412
    5   HG21  THR  42          HG21      THR  42 -11.889   5.282  -0.059
    6   HG23  THR  42          HG22      THR  42 -11.635   6.823   0.762
    7   HG22  THR  42          HG23      THR  42 -10.376   6.161  -0.277

  No H/Q in entry =           7
  In of MODEL   73
    1    H    LEU  43           H        LEU  43 -14.742   6.428  -3.390
    2    HA   LEU  43           HA       LEU  43 -14.909   9.209  -4.354
    3    HB2  LEU  43           HB2      LEU  43 -15.332   6.578  -5.761
    4    HB3  LEU  43           HB3      LEU  43 -15.485   8.166  -6.514
    5    HG   LEU  43           HG       LEU  43 -12.931   6.944  -5.495
    6   HD11  LEU  43          HD11      LEU  43 -14.041   6.002  -7.614
    7   HD13  LEU  43          HD12      LEU  43 -12.362   6.528  -7.728
    8   HD12  LEU  43          HD13      LEU  43 -13.651   7.560  -8.344
    9   HD23  LEU  43          HD21      LEU  43 -11.961   8.902  -6.794
   10   HD22  LEU  43          HD22      LEU  43 -12.768   9.303  -5.277
   11   HD21  LEU  43          HD23      LEU  43 -13.590   9.577  -6.812

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ALA  44           H        ALA  44 -16.924   7.433  -2.528
    2    HA   ALA  44           HA       ALA  44 -19.389   7.364  -3.878
    3    HB3  ALA  44           HB1      ALA  44 -19.305   6.239  -1.783
    4    HB2  ALA  44           HB2      ALA  44 -20.378   7.613  -1.518
    5    HB1  ALA  44           HB3      ALA  44 -18.711   7.673  -0.948

  No H/Q in entry =           5
  In of MODEL   73
    1    H    GLY  45           H        GLY  45 -17.911  10.121  -2.322
    2    HA3  GLY  45           HA2      GLY  45 -20.302  11.687  -2.705
    3    HA2  GLY  45           HA3      GLY  45 -18.748  12.268  -2.109

  No H/Q in entry =           3
  In of MODEL   73
    1    H    GLU  46           H        GLU  46 -17.217  11.296  -4.386
    2    HA   GLU  46           HA       GLU  46 -17.775  13.533  -6.155
    3    HB2  GLU  46           HB2      GLU  46 -15.469  12.926  -5.481
    4    HB3  GLU  46           HB3      GLU  46 -15.658  11.380  -6.308
    5    HG2  GLU  46           HG2      GLU  46 -15.880  12.520  -8.437
    6    HG3  GLU  46           HG3      GLU  46 -15.760  14.084  -7.630

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LYS  47           H        LYS  47 -17.747  10.013  -6.599
    2    HA   LYS  47           HA       LYS  47 -18.809  10.270  -9.285
    3    HB2  LYS  47           HB2      LYS  47 -18.329   7.858  -7.527
    4    HB3  LYS  47           HB3      LYS  47 -18.878   7.788  -9.203
    5    HG2  LYS  47           HG2      LYS  47 -16.304   9.100  -8.414
    6    HG3  LYS  47           HG3      LYS  47 -16.417   7.379  -8.774
    7    HD2  LYS  47           HD2      LYS  47 -17.348   7.907 -10.979
    8    HD3  LYS  47           HD3      LYS  47 -17.212   9.626 -10.620
    9    HE2  LYS  47           HE2      LYS  47 -14.791   9.395 -10.409
   10    HE3  LYS  47           HE3      LYS  47 -14.923   7.671 -10.751
   11    HZ3  LYS  47           HZ1      LYS  47 -14.556   8.358 -12.831
   12    HZ2  LYS  47           HZ2      LYS  47 -15.104   9.939 -12.541
   13    HZ1  LYS  47           HZ3      LYS  47 -16.222   8.691 -12.826

  No H/Q in entry =          13
  In of MODEL   73
    1    H    GLY  48           H        GLY  48 -20.187   9.542  -6.154
    2    HA3  GLY  48           HA2      GLY  48 -22.595   8.423  -6.924
    3    HA2  GLY  48           HA3      GLY  48 -22.358   9.407  -5.480

  No H/Q in entry =           3
  In of MODEL   73
    1    H    GLN  49           H        GLN  49 -21.692  11.817  -7.038
    2    HA   GLN  49           HA       GLN  49 -24.218  12.998  -7.206
    3    HB2  GLN  49           HB2      GLN  49 -21.638  13.796  -8.537
    4    HB3  GLN  49           HB3      GLN  49 -23.074  14.800  -8.465
    5    HG2  GLN  49           HG2      GLN  49 -22.940  14.814  -6.027
    6    HG3  GLN  49           HG3      GLN  49 -21.517  13.788  -6.097
    7   HE21  GLN  49          HE21      GLN  49 -21.353  16.010  -4.817
    8   HE22  GLN  49          HE22      GLN  49 -20.389  17.242  -5.451

  No H/Q in entry =           8
  In of MODEL   73
    1    H    ASN  50           H        ASN  50 -22.566  11.079  -9.580
    2    HA   ASN  50           HA       ASN  50 -24.401  12.008 -11.680
    3    HB2  ASN  50           HB2      ASN  50 -21.862  10.398 -11.890
    4    HB3  ASN  50           HB3      ASN  50 -22.886  10.856 -13.244
    5   HD21  ASN  50          HD21      ASN  50 -20.245  11.625 -11.603
    6   HD22  ASN  50          HD22      ASN  50 -19.963  13.255 -11.938

  No H/Q in entry =           6
  In of MODEL   73
    1    H    ALA  51           H        ALA  51 -24.476   9.647  -9.440
    2    HA   ALA  51           HA       ALA  51 -25.300   7.529 -11.282
    3    HB2  ALA  51           HB1      ALA  51 -24.772   6.160  -9.593
    4    HB3  ALA  51           HB2      ALA  51 -25.884   6.996  -8.510
    5    HB1  ALA  51           HB3      ALA  51 -24.227   7.572  -8.688

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ASP  52           H        ASP  52 -27.335   6.529 -11.167
    2    HA   ASP  52           HA       ASP  52 -29.471   8.422 -10.519
    3    HB2  ASP  52           HB2      ASP  52 -29.333   5.917 -12.194
    4    HB3  ASP  52           HB3      ASP  52 -30.861   6.691 -11.775

  No H/Q in entry =           4
  In of MODEL   73
    1    H    VAL  53           H        VAL  53 -27.964   5.486  -9.495
    2    HA   VAL  53           HA       VAL  53 -29.427   5.648  -6.994
    3    HB   VAL  53           HB       VAL  53 -30.859   4.050  -8.257
    4   HG11  VAL  53          HG11      VAL  53 -29.121   3.144  -9.763
    5   HG13  VAL  53          HG12      VAL  53 -30.000   1.872  -8.916
    6   HG12  VAL  53          HG13      VAL  53 -28.381   2.326  -8.387
    7   HG23  VAL  53          HG21      VAL  53 -30.112   2.046  -6.562
    8   HG22  VAL  53          HG22      VAL  53 -31.208   3.381  -6.203
    9   HG21  VAL  53          HG23      VAL  53 -29.501   3.503  -5.777

  No H/Q in entry =           9
  In of MODEL   73
    1    H    VAL  54           H        VAL  54 -28.146   5.174  -5.326
    2    HA   VAL  54           HA       VAL  54 -25.404   4.246  -5.910
    3    HB   VAL  54           HB       VAL  54 -26.447   6.048  -3.667
    4   HG11  VAL  54          HG11      VAL  54 -23.907   4.556  -3.934
    5   HG13  VAL  54          HG12      VAL  54 -24.656   5.254  -2.498
    6   HG12  VAL  54          HG13      VAL  54 -23.708   6.273  -3.581
    7   HG22  VAL  54          HG21      VAL  54 -25.523   7.840  -4.751
    8   HG21  VAL  54          HG22      VAL  54 -26.085   6.870  -6.113
    9   HG23  VAL  54          HG23      VAL  54 -24.383   6.844  -5.656

  No H/Q in entry =           9
  In of MODEL   73
    1    H    LEU  55           H        LEU  55 -24.876   2.306  -5.266
    2    HA   LEU  55           HA       LEU  55 -26.444   1.035  -3.110
    3    HB2  LEU  55           HB2      LEU  55 -24.897  -0.172  -5.392
    4    HB3  LEU  55           HB3      LEU  55 -25.699  -1.087  -4.114
    5    HG   LEU  55           HG       LEU  55 -27.066   0.547  -6.243
    6   HD13  LEU  55          HD11      LEU  55 -26.807  -1.311  -7.464
    7   HD12  LEU  55          HD12      LEU  55 -27.802  -2.160  -6.282
    8   HD11  LEU  55          HD13      LEU  55 -26.048  -2.147  -6.112
    9   HD23  LEU  55          HD21      LEU  55 -28.437  -1.365  -4.407
   10   HD22  LEU  55          HD22      LEU  55 -29.082   0.039  -5.258
   11   HD21  LEU  55          HD23      LEU  55 -28.070   0.261  -3.831

  No H/Q in entry =          11
  In of MODEL   73
    1    H    LEU  56           H        LEU  56 -25.330   0.403  -1.295
    2    HA   LEU  56           HA       LEU  56 -22.385   0.712  -1.311
    3    HB2  LEU  56           HB2      LEU  56 -24.219   0.549   1.067
    4    HB3  LEU  56           HB3      LEU  56 -22.498   0.927   1.075
    5    HG   LEU  56           HG       LEU  56 -24.736   2.674   0.091
    6   HD11  LEU  56          HD11      LEU  56 -23.660   2.254   2.623
    7   HD13  LEU  56          HD12      LEU  56 -24.604   3.654   2.110
    8   HD12  LEU  56          HD13      LEU  56 -22.844   3.706   2.042
    9   HD23  LEU  56          HD21      LEU  56 -22.740   4.316  -0.076
   10   HD22  LEU  56          HD22      LEU  56 -23.141   3.234  -1.411
   11   HD21  LEU  56          HD23      LEU  56 -21.810   2.838  -0.324

  No H/Q in entry =          11
  In of MODEL   73
    1    H    GLY  57           H        GLY  57 -21.060  -0.960  -0.769
    2    HA3  GLY  57           HA2      GLY  57 -22.058  -3.617  -0.979
    3    HA2  GLY  57           HA3      GLY  57 -20.428  -3.172  -0.481

  No H/Q in entry =           3
  In of MODEL   73
    1    HA   PRO  58           HA       PRO  58 -23.306  -4.136   3.193
    2    HB2  PRO  58           HB2      PRO  58 -22.706  -6.761   3.800
    3    HB3  PRO  58           HB3      PRO  58 -24.067  -6.310   2.773
    4    HG2  PRO  58           HG2      PRO  58 -21.358  -7.270   2.014
    5    HG3  PRO  58           HG3      PRO  58 -22.928  -7.680   1.325
    6    HD2  PRO  58           HD2      PRO  58 -21.252  -5.910   0.123
    7    HD3  PRO  58           HD3      PRO  58 -23.008  -5.770   0.004

  No H/Q in entry =           7
  In of MODEL   73
    1    H    GLN  59           H        GLN  59 -19.945  -4.707   2.621
    2    HA   GLN  59           HA       GLN  59 -19.220  -4.754   5.389
    3    HB2  GLN  59           HB2      GLN  59 -17.579  -3.937   2.987
    4    HB3  GLN  59           HB3      GLN  59 -16.951  -4.186   4.604
    5    HG2  GLN  59           HG2      GLN  59 -16.489  -6.102   3.199
    6    HG3  GLN  59           HG3      GLN  59 -17.596  -6.545   4.488
    7   HE21  GLN  59          HE21      GLN  59 -18.550  -8.003   3.539
    8   HE22  GLN  59          HE22      GLN  59 -19.578  -8.250   2.255

  No H/Q in entry =           8
  In of MODEL   73
    1    H    ILE  60           H        ILE  60 -20.054  -2.171   3.179
    2    HA   ILE  60           HA       ILE  60 -19.165  -0.245   5.238
    3    HB   ILE  60           HB       ILE  60 -19.343   1.494   3.405
    4   HG12  ILE  60          HG12      ILE  60 -19.155  -0.756   1.443
    5   HG13  ILE  60          HG13      ILE  60 -20.736  -0.158   1.946
    6   HG22  ILE  60          HG21      ILE  60 -17.347  -0.640   2.762
    7   HG21  ILE  60          HG22      ILE  60 -17.239   0.384   4.194
    8   HG23  ILE  60          HG23      ILE  60 -17.185   1.107   2.586
    9   HD12  ILE  60          HD11      ILE  60 -18.634   1.178   0.301
   10   HD11  ILE  60          HD12      ILE  60 -19.665   2.185   1.317
   11   HD13  ILE  60          HD13      ILE  60 -20.383   1.150   0.082

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ALA  61           H        ALA  61 -21.667  -1.757   5.277
    2    HA   ALA  61           HA       ALA  61 -23.838  -0.024   4.799
    3    HB1  ALA  61           HB1      ALA  61 -25.112  -1.480   6.107
    4    HB2  ALA  61           HB2      ALA  61 -23.737  -1.913   7.124
    5    HB3  ALA  61           HB3      ALA  61 -23.833  -2.514   5.468

  No H/Q in entry =           5
  In of MODEL   73
    1    H    TYR  62           H        TYR  62 -21.665  -0.209   7.620
    2    HA   TYR  62           HA       TYR  62 -23.188   1.490   9.277
    3    HB2  TYR  62           HB2      TYR  62 -21.154   1.845  10.538
    4    HB3  TYR  62           HB3      TYR  62 -21.249   0.151  10.060
    5    HD1  TYR  62           HD1      TYR  62 -19.675  -0.777   8.406
    6    HD2  TYR  62           HD2      TYR  62 -19.389   3.302   9.651
    7    HE1  TYR  62           HE1      TYR  62 -17.446  -0.621   7.367
    8    HE2  TYR  62           HE2      TYR  62 -17.146   3.452   8.612
    9    HH   TYR  62           HH       TYR  62 -15.984   1.050   6.500

  No H/Q in entry =           9
  In of MODEL   73
    1    H    MET  63           H        MET  63 -21.489   2.305   6.441
    2    HA   MET  63           HA       MET  63 -21.243   5.129   7.144
    3    HB2  MET  63           HB2      MET  63 -20.657   3.596   4.612
    4    HB3  MET  63           HB3      MET  63 -20.412   5.333   4.800
    5    HG2  MET  63           HG2      MET  63 -18.729   4.931   6.494
    6    HG3  MET  63           HG3      MET  63 -18.994   3.194   6.365
    7    HE2  MET  63           HE1      MET  63 -16.823   6.083   3.888
    8    HE1  MET  63           HE2      MET  63 -18.364   6.337   4.708
    9    HE3  MET  63           HE3      MET  63 -18.337   5.865   3.008

  No H/Q in entry =           9
  In of MODEL   73
    1    H    LEU  64           H        LEU  64 -23.852   3.357   6.148
    2    HA   LEU  64           HA       LEU  64 -24.996   4.816   4.060
    3    HB2  LEU  64           HB2      LEU  64 -25.939   2.737   4.964
    4    HB3  LEU  64           HB3      LEU  64 -26.386   3.589   6.441
    5    HG   LEU  64           HG       LEU  64 -28.027   4.898   5.198
    6   HD13  LEU  64          HD11      LEU  64 -27.714   5.136   2.969
    7   HD12  LEU  64          HD12      LEU  64 -28.409   3.521   2.813
    8   HD11  LEU  64          HD13      LEU  64 -26.658   3.726   2.890
    9   HD23  LEU  64          HD21      LEU  64 -28.625   2.104   4.437
   10   HD22  LEU  64          HD22      LEU  64 -29.587   3.267   5.350
   11   HD21  LEU  64          HD23      LEU  64 -28.245   2.429   6.129

  No H/Q in entry =          11
  In of MODEL   73
    1    HA   PRO  65           HA       PRO  65 -27.106   8.031   6.797
    2    HB2  PRO  65           HB2      PRO  65 -25.124   8.122   9.073
    3    HB3  PRO  65           HB3      PRO  65 -26.855   8.456   9.100
    4    HG2  PRO  65           HG2      PRO  65 -26.006   6.172  10.031
    5    HG3  PRO  65           HG3      PRO  65 -27.415   6.186   8.972
    6    HD2  PRO  65           HD2      PRO  65 -24.556   5.483   8.296
    7    HD3  PRO  65           HD3      PRO  65 -26.036   4.644   7.832

  No H/Q in entry =           7
  In of MODEL   73
    1    H    GLU  66           H        GLU  66 -23.555   7.863   6.907
    2    HA   GLU  66           HA       GLU  66 -23.165  10.651   6.511
    3    HB2  GLU  66           HB2      GLU  66 -21.419   8.288   5.873
    4    HB3  GLU  66           HB3      GLU  66 -20.913   9.966   5.675
    5    HG2  GLU  66           HG2      GLU  66 -21.137  10.337   8.040
    6    HG3  GLU  66           HG3      GLU  66 -21.718   8.687   8.263

  No H/Q in entry =           6
  In of MODEL   73
    1    H    ILE  67           H        ILE  67 -23.330   7.915   4.252
    2    HA   ILE  67           HA       ILE  67 -22.835   9.615   1.967
    3    HB   ILE  67           HB       ILE  67 -23.830   6.738   2.130
    4   HG12  ILE  67          HG12      ILE  67 -21.154   7.824   1.238
    5   HG13  ILE  67          HG13      ILE  67 -21.480   7.410   2.920
    6   HG21  ILE  67          HG21      ILE  67 -23.689   8.618  -0.089
    7   HG23  ILE  67          HG22      ILE  67 -24.367   6.991  -0.049
    8   HG22  ILE  67          HG23      ILE  67 -22.647   7.221  -0.360
    9   HD12  ILE  67          HD11      ILE  67 -21.093   5.630   0.570
   10   HD11  ILE  67          HD12      ILE  67 -22.139   5.089   1.881
   11   HD13  ILE  67          HD13      ILE  67 -20.455   5.497   2.209

  No H/Q in entry =          11
  In of MODEL   73
    1    H    GLN  68           H        GLN  68 -25.755   8.652   3.569
    2    HA   GLN  68           HA       GLN  68 -27.532   9.647   1.579
    3    HB2  GLN  68           HB2      GLN  68 -27.831   9.291   4.558
    4    HB3  GLN  68           HB3      GLN  68 -29.119   9.932   3.553
    5    HG2  GLN  68           HG2      GLN  68 -29.202   7.907   2.271
    6    HG3  GLN  68           HG3      GLN  68 -27.781   7.280   3.087
    7   HE21  GLN  68          HE21      GLN  68 -30.002   5.997   2.927
    8   HE22  GLN  68          HE22      GLN  68 -30.860   5.565   4.331

  No H/Q in entry =           8
  In of MODEL   73
    1    H    ARG  69           H        ARG  69 -25.899  11.252   4.336
    2    HA   ARG  69           HA       ARG  69 -27.174  13.781   3.923
    3    HB2  ARG  69           HB2      ARG  69 -24.879  12.766   5.533
    4    HB3  ARG  69           HB3      ARG  69 -24.895  14.490   5.179
    5    HG2  ARG  69           HG2      ARG  69 -27.219  14.609   6.127
    6    HG3  ARG  69           HG3      ARG  69 -27.073  12.912   6.599
    7    HD2  ARG  69           HD2      ARG  69 -25.310  15.205   7.536
    8    HD3  ARG  69           HD3      ARG  69 -26.480  14.336   8.517
    9    HE   ARG  69           HE       ARG  69 -23.891  13.317   7.590
   10   HH21  ARG  69          HH11      ARG  69 -23.157  11.524   8.789
   11   HH22  ARG  69          HH12      ARG  69 -24.225  10.741   9.905
   12   HH11  ARG  69          HH21      ARG  69 -26.882  12.869   9.256
   13   HH12  ARG  69          HH22      ARG  69 -26.334  11.501  10.168

  No H/Q in entry =          13
  In of MODEL   73
    1    H    LEU  70           H        LEU  70 -24.340  12.278   2.589
    2    HA   LEU  70           HA       LEU  70 -23.133  14.606   1.438
    3    HB2  LEU  70           HB2      LEU  70 -22.226  12.254   2.037
    4    HB3  LEU  70           HB3      LEU  70 -22.841  11.814   0.443
    5    HG   LEU  70           HG       LEU  70 -21.190  13.132  -0.622
    6   HD11  LEU  70          HD11      LEU  70 -20.366  13.939   2.177
    7   HD13  LEU  70          HD12      LEU  70 -21.013  15.000   0.925
    8   HD12  LEU  70          HD13      LEU  70 -19.423  14.264   0.719
    9   HD22  LEU  70          HD21      LEU  70 -19.820  11.366  -0.381
   10   HD21  LEU  70          HD22      LEU  70 -20.778  10.872   1.016
   11   HD23  LEU  70          HD23      LEU  70 -19.358  11.895   1.237

  No H/Q in entry =          11
  In of MODEL   73
    1    H    LEU  71           H        LEU  71 -25.363  12.144   0.295
    2    HA   LEU  71           HA       LEU  71 -25.810  13.655  -2.223
    3    HB2  LEU  71           HB2      LEU  71 -26.128  10.679  -1.787
    4    HB3  LEU  71           HB3      LEU  71 -26.210  11.548  -3.319
    5    HG   LEU  71           HG       LEU  71 -23.708  11.466  -1.634
    6   HD12  LEU  71          HD11      LEU  71 -23.795   9.846  -4.070
    7   HD11  LEU  71          HD12      LEU  71 -24.841   9.257  -2.779
    8   HD13  LEU  71          HD13      LEU  71 -23.115   9.473  -2.487
    9   HD22  LEU  71          HD21      LEU  71 -23.730  13.288  -3.122
   10   HD21  LEU  71          HD22      LEU  71 -24.251  12.267  -4.462
   11   HD23  LEU  71          HD23      LEU  71 -22.644  12.060  -3.770

  No H/Q in entry =          11
  In of MODEL   73
    1    HA   PRO  72           HA       PRO  72 -29.717  13.342   0.359
    2    HB2  PRO  72           HB2      PRO  72 -30.477  15.933   0.277
    3    HB3  PRO  72           HB3      PRO  72 -29.197  15.430   1.380
    4    HG2  PRO  72           HG2      PRO  72 -28.939  16.624  -1.368
    5    HG3  PRO  72           HG3      PRO  72 -28.167  17.143   0.130
    6    HD2  PRO  72           HD2      PRO  72 -26.872  15.540  -1.627
    7    HD3  PRO  72           HD3      PRO  72 -26.641  15.359   0.110

  No H/Q in entry =           7
  In of MODEL   73
    1    H    ASN  73           H        ASN  73 -29.026  14.282  -2.847
    2    HA   ASN  73           HA       ASN  73 -31.889  14.083  -3.507
    3    HB2  ASN  73           HB2      ASN  73 -31.362  15.175  -5.596
    4    HB3  ASN  73           HB3      ASN  73 -30.816  16.132  -4.227
    5   HD21  ASN  73          HD21      ASN  73 -29.992  16.153  -6.896
    6   HD22  ASN  73          HD22      ASN  73 -28.330  15.929  -7.073

  No H/Q in entry =           6
  In of MODEL   73
    1    H    LYS  74           H        LYS  74 -30.000  11.752  -3.069
    2    HA   LYS  74           HA       LYS  74 -30.596  10.387  -5.627
    3    HB2  LYS  74           HB2      LYS  74 -28.092   9.993  -3.982
    4    HB3  LYS  74           HB3      LYS  74 -28.493   9.199  -5.506
    5    HG2  LYS  74           HG2      LYS  74 -28.115  12.157  -5.293
    6    HG3  LYS  74           HG3      LYS  74 -26.780  11.042  -5.586
    7    HD2  LYS  74           HD2      LYS  74 -27.913  10.163  -7.544
    8    HD3  LYS  74           HD3      LYS  74 -29.296  11.214  -7.235
    9    HE2  LYS  74           HE2      LYS  74 -27.989  13.172  -7.659
   10    HE3  LYS  74           HE3      LYS  74 -26.503  12.225  -7.738
   11    HZ2  LYS  74           HZ1      LYS  74 -27.928  12.889  -9.876
   12    HZ1  LYS  74           HZ2      LYS  74 -28.646  11.393  -9.514
   13    HZ3  LYS  74           HZ3      LYS  74 -26.973  11.488  -9.794

  No H/Q in entry =          13
  In of MODEL   73
    1    HA   PRO  75           HA       PRO  75 -32.136   7.451  -2.678
    2    HB2  PRO  75           HB2      PRO  75 -32.517   5.251  -4.269
    3    HB3  PRO  75           HB3      PRO  75 -33.587   6.648  -4.345
    4    HG2  PRO  75           HG2      PRO  75 -31.258   5.965  -6.095
    5    HG3  PRO  75           HG3      PRO  75 -32.883   6.467  -6.558
    6    HD2  PRO  75           HD2      PRO  75 -30.870   8.254  -6.490
    7    HD3  PRO  75           HD3      PRO  75 -32.490   8.717  -5.967

  No H/Q in entry =           7
  In of MODEL   73
    1    H    VAL  76           H        VAL  76 -30.738   6.336  -1.293
    2    HA   VAL  76           HA       VAL  76 -28.313   5.033  -2.380
    3    HB   VAL  76           HB       VAL  76 -28.569   6.503   0.279
    4   HG11  VAL  76          HG11      VAL  76 -26.252   5.127  -1.093
    5   HG13  VAL  76          HG12      VAL  76 -26.981   4.700   0.457
    6   HG12  VAL  76          HG13      VAL  76 -26.073   6.203   0.293
    7   HG22  VAL  76          HG21      VAL  76 -27.817   8.378  -0.596
    8   HG21  VAL  76          HG22      VAL  76 -28.372   7.708  -2.132
    9   HG23  VAL  76          HG23      VAL  76 -26.680   7.552  -1.661

  No H/Q in entry =           9
  In of MODEL   73
    1    H    GLU  77           H        GLU  77 -28.187   2.870  -1.770
    2    HA   GLU  77           HA       GLU  77 -29.031   2.109   0.873
    3    HB2  GLU  77           HB2      GLU  77 -30.697   0.528   0.322
    4    HB3  GLU  77           HB3      GLU  77 -31.177   2.072  -0.381
    5    HG2  GLU  77           HG2      GLU  77 -30.577   1.295  -2.564
    6    HG3  GLU  77           HG3      GLU  77 -30.002  -0.227  -1.889

  No H/Q in entry =           6
  In of MODEL   73
    1    H    VAL  78           H        VAL  78 -28.793   0.009   1.531
    2    HA   VAL  78           HA       VAL  78 -26.150  -0.865   0.667
    3    HB   VAL  78           HB       VAL  78 -27.915  -1.686   3.014
    4   HG11  VAL  78          HG11      VAL  78 -25.614  -3.003   1.909
    5   HG13  VAL  78          HG12      VAL  78 -26.555  -3.441   3.337
    6   HG12  VAL  78          HG13      VAL  78 -25.192  -2.333   3.483
    7   HG22  VAL  78          HG21      VAL  78 -26.418  -0.385   4.370
    8   HG21  VAL  78          HG22      VAL  78 -27.102   0.616   3.089
    9   HG23  VAL  78          HG23      VAL  78 -25.446   0.024   2.955

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ILE  79           H        ILE  79 -25.679  -2.790  -0.237
    2    HA   ILE  79           HA       ILE  79 -27.783  -4.183  -1.609
    3    HB   ILE  79           HB       ILE  79 -24.817  -4.828  -1.359
    4   HG12  ILE  79          HG12      ILE  79 -26.385  -3.656  -3.661
    5   HG13  ILE  79          HG13      ILE  79 -25.484  -2.683  -2.496
    6   HG22  ILE  79          HG21      ILE  79 -25.940  -5.959  -3.692
    7   HG21  ILE  79          HG22      ILE  79 -26.959  -6.444  -2.335
    8   HG23  ILE  79          HG23      ILE  79 -25.230  -6.790  -2.308
    9   HD13  ILE  79          HD11      ILE  79 -24.057  -2.848  -4.301
   10   HD12  ILE  79          HD12      ILE  79 -24.461  -4.541  -4.589
   11   HD11  ILE  79          HD13      ILE  79 -23.472  -4.095  -3.198

  No H/Q in entry =          11
  In of MODEL   73
    1    H    ASP  80           H        ASP  80 -28.727  -6.073  -1.039
    2    HA   ASP  80           HA       ASP  80 -28.736  -6.979   1.606
    3    HB2  ASP  80           HB2      ASP  80 -30.494  -7.484  -0.053
    4    HB3  ASP  80           HB3      ASP  80 -29.368  -8.534  -0.912

  No H/Q in entry =           4
  In of MODEL   73
    1    H    SER  81           H        SER  81 -27.258  -8.176   2.749
    2    HA   SER  81           HA       SER  81 -24.778  -8.953   1.581
    3    HB2  SER  81           HB2      SER  81 -24.286 -10.002   3.752
    4    HB3  SER  81           HB3      SER  81 -24.934  -8.376   3.964
    5    HG   SER  81           HG       SER  81 -26.019 -10.832   4.603

  No H/Q in entry =           5
  In of MODEL   73
    1    H    LEU  82           H        LEU  82 -27.572 -10.937   1.871
    2    HA   LEU  82           HA       LEU  82 -26.113 -13.364   1.361
    3    HB2  LEU  82           HB2      LEU  82 -29.020 -12.631   1.079
    4    HB3  LEU  82           HB3      LEU  82 -28.378 -14.259   0.869
    5    HG   LEU  82           HG       LEU  82 -28.293 -12.688   3.426
    6   HD12  LEU  82          HD11      LEU  82 -30.014 -14.309   4.158
    7   HD11  LEU  82          HD12      LEU  82 -30.062 -14.975   2.525
    8   HD13  LEU  82          HD13      LEU  82 -30.582 -13.315   2.817
    9   HD21  LEU  82          HD21      LEU  82 -27.365 -15.396   2.521
   10   HD23  LEU  82          HD22      LEU  82 -27.774 -15.105   4.211
   11   HD22  LEU  82          HD23      LEU  82 -26.488 -14.174   3.443

  No H/Q in entry =          11
  In of MODEL   73
    1    H    LEU  83           H        LEU  83 -27.962 -11.059  -0.573
    2    HA   LEU  83           HA       LEU  83 -27.790 -12.420  -3.045
    3    HB2  LEU  83           HB2      LEU  83 -28.092  -9.500  -2.395
    4    HB3  LEU  83           HB3      LEU  83 -28.132 -10.141  -4.038
    5    HG   LEU  83           HG       LEU  83 -30.202 -10.451  -1.882
    6   HD13  LEU  83          HD11      LEU  83 -30.874  -8.573  -2.951
    7   HD12  LEU  83          HD12      LEU  83 -31.367  -9.666  -4.243
    8   HD11  LEU  83          HD13      LEU  83 -29.799  -8.861  -4.318
    9   HD23  LEU  83          HD21      LEU  83 -30.362 -11.699  -4.611
   10   HD22  LEU  83          HD22      LEU  83 -31.360 -12.012  -3.192
   11   HD21  LEU  83          HD23      LEU  83 -29.692 -12.582  -3.241

  No H/Q in entry =          11
  In of MODEL   73
    1    H    TYR  84           H        TYR  84 -25.761 -10.116  -1.345
    2    HA   TYR  84           HA       TYR  84 -23.860  -9.699  -3.455
    3    HB2  TYR  84           HB2      TYR  84 -24.339  -8.196  -1.438
    4    HB3  TYR  84           HB3      TYR  84 -23.377  -9.337  -0.501
    5    HD1  TYR  84           HD1      TYR  84 -21.005  -9.287  -0.562
    6    HD2  TYR  84           HD2      TYR  84 -23.249  -6.929  -3.325
    7    HE1  TYR  84           HE1      TYR  84 -18.927  -8.142  -1.253
    8    HE2  TYR  84           HE2      TYR  84 -21.178  -5.783  -4.034
    9    HH   TYR  84           HH       TYR  84 -18.417  -6.691  -3.842

  No H/Q in entry =           9
  In of MODEL   73
    1    H    GLY  85           H        GLY  85 -23.729 -11.714  -0.510
    2    HA3  GLY  85           HA2      GLY  85 -21.185 -12.758  -0.969
    3    HA2  GLY  85           HA3      GLY  85 -22.458 -13.556  -0.046

  No H/Q in entry =           3
  In of MODEL   73
    1    H    LYS  86           H        LYS  86 -24.297 -13.853  -2.125
    2    HA   LYS  86           HA       LYS  86 -23.325 -16.266  -3.378
    3    HB2  LYS  86           HB2      LYS  86 -25.659 -15.586  -2.391
    4    HB3  LYS  86           HB3      LYS  86 -25.911 -14.898  -3.993
    5    HG2  LYS  86           HG2      LYS  86 -25.722 -17.040  -5.005
    6    HG3  LYS  86           HG3      LYS  86 -25.272 -17.773  -3.465
    7    HD2  LYS  86           HD2      LYS  86 -27.626 -18.152  -3.804
    8    HD3  LYS  86           HD3      LYS  86 -27.442 -16.956  -2.522
    9    HE2  LYS  86           HE2      LYS  86 -28.146 -15.208  -3.882
   10    HE3  LYS  86           HE3      LYS  86 -27.793 -16.092  -5.365
   11    HZ1  LYS  86           HZ1      LYS  86 -29.870 -16.968  -3.439
   12    HZ3  LYS  86           HZ2      LYS  86 -29.642 -17.490  -5.040
   13    HZ2  LYS  86           HZ3      LYS  86 -30.208 -15.920  -4.733

  No H/Q in entry =          13
  In of MODEL   73
    1    H    VAL  87           H        VAL  87 -23.178 -13.051  -4.266
    2    HA   VAL  87           HA       VAL  87 -22.815 -11.888  -6.202
    3    HB   VAL  87           HB       VAL  87 -21.659 -14.578  -7.057
    4   HG11  VAL  87          HG11      VAL  87 -22.079 -12.056  -8.550
    5   HG13  VAL  87          HG12      VAL  87 -21.848 -13.698  -9.156
    6   HG12  VAL  87          HG13      VAL  87 -20.456 -12.735  -8.663
    7   HG21  VAL  87          HG21      VAL  87 -20.475 -12.072  -5.917
    8   HG23  VAL  87          HG22      VAL  87 -19.505 -13.232  -6.822
    9   HG22  VAL  87          HG23      VAL  87 -20.319 -13.731  -5.341

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ASP  88           H        ASP  88 -25.356 -12.432  -5.876
    2    HA   ASP  88           HA       ASP  88 -26.501 -13.600  -8.286
    3    HB2  ASP  88           HB2      ASP  88 -27.528 -13.809  -5.972
    4    HB3  ASP  88           HB3      ASP  88 -27.913 -12.092  -6.073

  No H/Q in entry =           4
  In of MODEL   73
    1    H    GLY  89           H        GLY  89 -25.733 -12.369  -9.919
    2    HA3  GLY  89           HA2      GLY  89 -25.804  -9.591 -10.117
    3    HA2  GLY  89           HA3      GLY  89 -25.810 -10.711 -11.479

  No H/Q in entry =           3
  In of MODEL   73
    1    H    LEU  90           H        LEU  90 -28.311 -11.968 -11.056
    2    HA   LEU  90           HA       LEU  90 -30.036  -9.962 -12.184
    3    HB2  LEU  90           HB2      LEU  90 -30.188 -12.353 -12.768
    4    HB3  LEU  90           HB3      LEU  90 -30.723 -12.701 -11.125
    5    HG   LEU  90           HG       LEU  90 -32.793 -11.503 -11.506
    6   HD13  LEU  90          HD11      LEU  90 -32.533  -9.769 -12.977
    7   HD12  LEU  90          HD12      LEU  90 -33.109 -10.983 -14.121
    8   HD11  LEU  90          HD13      LEU  90 -31.382 -10.655 -13.980
    9   HD23  LEU  90          HD21      LEU  90 -32.763 -13.131 -13.943
   10   HD22  LEU  90          HD22      LEU  90 -33.762 -13.260 -12.495
   11   HD21  LEU  90          HD23      LEU  90 -32.134 -13.936 -12.505

  No H/Q in entry =          11
  In of MODEL   73
    1    H    GLY  91           H        GLY  91 -29.955 -11.472  -9.001
    2    HA3  GLY  91           HA2      GLY  91 -32.259 -10.272  -7.982
    3    HA2  GLY  91           HA3      GLY  91 -30.898 -10.859  -7.027

  No H/Q in entry =           3
  In of MODEL   73
    1    H    VAL  92           H        VAL  92 -28.902  -9.106  -7.862
    2    HA   VAL  92           HA       VAL  92 -29.619  -6.778  -6.317
    3    HB   VAL  92           HB       VAL  92 -27.078  -7.343  -7.890
    4   HG12  VAL  92          HG11      VAL  92 -27.192  -5.455  -5.562
    5   HG11  VAL  92          HG12      VAL  92 -27.821  -4.885  -7.110
    6   HG13  VAL  92          HG13      VAL  92 -26.146  -5.418  -6.982
    7   HG22  VAL  92          HG21      VAL  92 -26.931  -8.940  -6.298
    8   HG21  VAL  92          HG22      VAL  92 -28.055  -8.117  -5.215
    9   HG23  VAL  92          HG23      VAL  92 -26.379  -7.580  -5.319

  No H/Q in entry =           9
  In of MODEL   73
    1    H    LEU  93           H        LEU  93 -29.206  -7.451  -9.735
    2    HA   LEU  93           HA       LEU  93 -29.441  -4.804 -10.664
    3    HB2  LEU  93           HB2      LEU  93 -28.858  -6.680 -12.122
    4    HB3  LEU  93           HB3      LEU  93 -30.478  -7.347 -11.915
    5    HG   LEU  93           HG       LEU  93 -31.403  -5.344 -13.046
    6   HD11  LEU  93          HD11      LEU  93 -29.497  -3.822 -12.523
    7   HD13  LEU  93          HD12      LEU  93 -29.922  -3.833 -14.235
    8   HD12  LEU  93          HD13      LEU  93 -28.508  -4.723 -13.671
    9   HD23  LEU  93          HD21      LEU  93 -30.365  -5.948 -15.325
   10   HD22  LEU  93          HD22      LEU  93 -31.263  -7.174 -14.427
   11   HD21  LEU  93          HD23      LEU  93 -29.499  -7.185 -14.414

  No H/Q in entry =          11
  In of MODEL   73
    1    H    LYS  94           H        LYS  94 -31.920  -7.258  -9.840
    2    HA   LYS  94           HA       LYS  94 -34.202  -5.727 -10.483
    3    HB2  LYS  94           HB2      LYS  94 -33.790  -7.932  -8.470
    4    HB3  LYS  94           HB3      LYS  94 -35.358  -7.176  -8.752
    5    HG2  LYS  94           HG2      LYS  94 -35.279  -7.951 -11.087
    6    HG3  LYS  94           HG3      LYS  94 -33.751  -8.762 -10.745
    7    HD2  LYS  94           HD2      LYS  94 -34.939 -10.054  -8.932
    8    HD3  LYS  94           HD3      LYS  94 -36.451  -9.347  -9.500
    9    HE2  LYS  94           HE2      LYS  94 -35.951 -10.293 -11.764
   10    HE3  LYS  94           HE3      LYS  94 -34.573 -11.131 -11.048
   11    HZ3  LYS  94           HZ1      LYS  94 -36.479 -12.580 -11.238
   12    HZ2  LYS  94           HZ2      LYS  94 -37.421 -11.518 -10.303
   13    HZ1  LYS  94           HZ3      LYS  94 -36.097 -12.318  -9.604

  No H/Q in entry =          13
  In of MODEL   73
    1    H    ALA  95           H        ALA  95 -32.412  -5.920  -7.419
    2    HA   ALA  95           HA       ALA  95 -34.213  -4.272  -5.954
    3    HB2  ALA  95           HB1      ALA  95 -31.897  -5.738  -5.398
    4    HB3  ALA  95           HB2      ALA  95 -32.851  -4.797  -4.252
    5    HB1  ALA  95           HB3      ALA  95 -31.467  -4.062  -5.060

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ALA  96           H        ALA  96 -31.521  -3.518  -8.026
    2    HA   ALA  96           HA       ALA  96 -31.326  -0.763  -7.247
    3    HB2  ALA  96           HB1      ALA  96 -29.937  -0.587  -9.344
    4    HB3  ALA  96           HB2      ALA  96 -30.304  -2.282  -9.669
    5    HB1  ALA  96           HB3      ALA  96 -29.384  -1.838  -8.231

  No H/Q in entry =           5
  In of MODEL   73
    1    H    VAL  97           H        VAL  97 -32.898  -2.414  -9.950
    2    HA   VAL  97           HA       VAL  97 -33.866  -0.073 -11.212
    3    HB   VAL  97           HB       VAL  97 -34.790  -2.964 -11.266
    4   HG11  VAL  97          HG11      VAL  97 -36.498  -0.888 -11.764
    5   HG13  VAL  97          HG12      VAL  97 -36.612  -2.477 -12.525
    6   HG12  VAL  97          HG13      VAL  97 -35.799  -1.157 -13.363
    7   HG21  VAL  97          HG21      VAL  97 -33.421  -1.186 -13.286
    8   HG23  VAL  97          HG22      VAL  97 -33.937  -2.846 -13.582
    9   HG22  VAL  97          HG23      VAL  97 -32.685  -2.510 -12.386

  No H/Q in entry =           9
  In of MODEL   73
    1    H    ALA  98           H        ALA  98 -35.157  -2.206  -8.690
    2    HA   ALA  98           HA       ALA  98 -37.674  -0.958  -8.359
    3    HB1  ALA  98           HB1      ALA  98 -36.758  -3.197  -7.321
    4    HB3  ALA  98           HB2      ALA  98 -37.908  -2.228  -6.400
    5    HB2  ALA  98           HB3      ALA  98 -36.186  -2.148  -6.024

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ALA  99           H        ALA  99 -34.580  -0.286  -6.683
    2    HA   ALA  99           HA       ALA  99 -35.643   1.739  -5.027
    3    HB1  ALA  99           HB1      ALA  99 -33.026   0.745  -5.754
    4    HB2  ALA  99           HB2      ALA  99 -33.559   1.514  -4.258
    5    HB3  ALA  99           HB3      ALA  99 -33.031   2.503  -5.619

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ILE 100           H        ILE 100 -34.568   1.834  -8.373
    2    HA   ILE 100           HA       ILE 100 -34.629   4.687  -8.588
    3    HB   ILE 100           HB       ILE 100 -34.793   2.542 -10.732
    4   HG12  ILE 100          HG12      ILE 100 -32.555   4.444 -10.038
    5   HG13  ILE 100          HG13      ILE 100 -32.666   2.798  -9.412
    6   HG21  ILE 100          HG21      ILE 100 -35.095   5.478 -10.860
    7   HG23  ILE 100          HG22      ILE 100 -35.642   4.233 -11.983
    8   HG22  ILE 100          HG23      ILE 100 -33.965   4.780 -12.023
    9   HD12  ILE 100          HD11      ILE 100 -32.069   3.738 -12.179
   10   HD11  ILE 100          HD12      ILE 100 -32.798   2.150 -11.933
   11   HD13  ILE 100          HD13      ILE 100 -31.241   2.529 -11.199

  No H/Q in entry =          11
  In of MODEL   73
    1    H    LYS 101           H        LYS 101 -37.021   2.176  -9.341
    2    HA   LYS 101           HA       LYS 101 -39.024   3.911 -10.355
    3    HB2  LYS 101           HB2      LYS 101 -39.032   1.132  -9.233
    4    HB3  LYS 101           HB3      LYS 101 -40.549   1.958  -9.591
    5    HG2  LYS 101           HG2      LYS 101 -40.049   2.078 -11.882
    6    HG3  LYS 101           HG3      LYS 101 -38.373   1.602 -11.614
    7    HD2  LYS 101           HD2      LYS 101 -39.693  -0.250 -12.516
    8    HD3  LYS 101           HD3      LYS 101 -39.093  -0.609 -10.896
    9    HE2  LYS 101           HE2      LYS 101 -41.188  -1.220 -10.410
   10    HE3  LYS 101           HE3      LYS 101 -41.574   0.502 -10.413
   11    HZ3  LYS 101           HZ1      LYS 101 -42.452   0.386 -12.539
   12    HZ2  LYS 101           HZ2      LYS 101 -42.980  -1.069 -11.839
   13    HZ1  LYS 101           HZ3      LYS 101 -41.663  -1.072 -12.911

  No H/Q in entry =          13
  In of MODEL   73
    1    H    LYS 102           H        LYS 102 -38.622   2.407  -7.145
    2    HA   LYS 102           HA       LYS 102 -40.829   3.692  -5.965
    3    HB2  LYS 102           HB2      LYS 102 -39.680   1.773  -4.943
    4    HB3  LYS 102           HB3      LYS 102 -38.249   2.771  -4.685
    5    HG2  LYS 102           HG2      LYS 102 -39.521   4.214  -3.196
    6    HG3  LYS 102           HG3      LYS 102 -40.955   3.222  -3.457
    7    HD2  LYS 102           HD2      LYS 102 -39.816   1.304  -2.426
    8    HD3  LYS 102           HD3      LYS 102 -38.383   2.299  -2.162
    9    HE2  LYS 102           HE2      LYS 102 -39.688   3.827  -0.761
   10    HE3  LYS 102           HE3      LYS 102 -41.137   2.865  -1.046
   11    HZ1  LYS 102           HZ1      LYS 102 -39.500   1.039  -0.032
   12    HZ3  LYS 102           HZ2      LYS 102 -40.582   1.967   0.891
   13    HZ2  LYS 102           HZ3      LYS 102 -38.950   2.425   0.780

  No H/Q in entry =          13
  In of MODEL   73
    1    H    ALA 103           H        ALA 103 -37.811   4.963  -6.947
    2    HA   ALA 103           HA       ALA 103 -37.955   7.280  -5.161
    3    HB2  ALA 103           HB1      ALA 103 -35.920   7.936  -6.716
    4    HB3  ALA 103           HB2      ALA 103 -35.953   6.219  -7.118
    5    HB1  ALA 103           HB3      ALA 103 -35.719   6.728  -5.446

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ALA 104           H        ALA 104 -38.574   6.583  -8.514
    2    HA   ALA 104           HA       ALA 104 -39.039   9.392  -9.134
    3    HB2  ALA 104           HB1      ALA 104 -39.089   8.732 -11.338
    4    HB1  ALA 104           HB2      ALA 104 -39.883   7.201 -10.971
    5    HB3  ALA 104           HB3      ALA 104 -38.154   7.392 -10.676

  No H/Q in entry =           5
  In of MODEL   73
    1    H    ALA 105           H        ALA 105 -40.749   7.350  -7.350
    2    HA   ALA 105           HA       ALA 105 -43.114   8.843  -7.341
    3    HB2  ALA 105           HB1      ALA 105 -43.875   8.020  -9.390
    4    HB3  ALA 105           HB2      ALA 105 -44.570   6.856  -8.262
    5    HB1  ALA 105           HB3      ALA 105 -43.108   6.449  -9.159

  No H/Q in entry =           5
  In of MODEL   74
    1    H1   ALA   1           H3       ALA   1 -12.435 -15.548  -2.186
    2    H2   ALA   1           H2       ALA   1 -11.513 -16.696  -3.040
    3    H3   ALA   1           H1       ALA   1 -12.657 -15.739  -3.858
    4    HA   ALA   1           HA       ALA   1 -14.069 -17.427  -3.608
    5    HB3  ALA   1           HB1      ALA   1 -12.684 -19.213  -3.166
    6    HB1  ALA   1           HB2      ALA   1 -13.422 -19.098  -1.568
    7    HB2  ALA   1           HB3      ALA   1 -11.842 -18.371  -1.865

  No H/Q in entry =           7
  In of MODEL   74
    1    H    GLU   2           H        GLU   2 -15.681 -18.271  -1.938
    2    HA   GLU   2           HA       GLU   2 -17.302 -16.539  -0.856
    3    HB2  GLU   2           HB2      GLU   2 -16.367 -18.977   0.672
    4    HB3  GLU   2           HB3      GLU   2 -17.881 -18.114   0.945
    5    HG2  GLU   2           HG2      GLU   2 -18.890 -19.186  -0.781
    6    HG3  GLU   2           HG3      GLU   2 -17.575 -18.795  -1.879

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLU   3           H        GLU   3 -15.373 -17.917   1.742
    2    HA   GLU   3           HA       GLU   3 -15.555 -15.566   3.308
    3    HB2  GLU   3           HB2      GLU   3 -13.991 -18.128   3.534
    4    HB3  GLU   3           HB3      GLU   3 -13.734 -16.814   4.682
    5    HG2  GLU   3           HG2      GLU   3 -15.920 -16.948   5.524
    6    HG3  GLU   3           HG3      GLU   3 -16.538 -17.738   4.080

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LEU   4           H        LEU   4 -12.630 -17.068   1.880
    2    HA   LEU   4           HA       LEU   4 -10.771 -15.184   2.463
    3    HB2  LEU   4           HB2      LEU   4 -11.044 -16.471  -0.262
    4    HB3  LEU   4           HB3      LEU   4  -9.578 -15.766   0.408
    5    HG   LEU   4           HG       LEU   4 -11.082 -18.153   1.531
    6   HD13  LEU   4          HD11      LEU   4  -9.473 -19.521   0.580
    7   HD12  LEU   4          HD12      LEU   4  -8.251 -18.249   0.543
    8   HD11  LEU   4          HD13      LEU   4  -9.553 -18.256  -0.645
    9   HD23  LEU   4          HD21      LEU   4  -8.816 -18.241   2.888
   10   HD22  LEU   4          HD22      LEU   4 -10.122 -17.191   3.434
   11   HD21  LEU   4          HD23      LEU   4  -8.762 -16.512   2.539

  No H/Q in entry =          11
  In of MODEL   74
    1    H    GLU   5           H        GLU   5 -13.133 -14.947  -0.184
    2    HA   GLU   5           HA       GLU   5 -12.118 -12.471  -1.189
    3    HB2  GLU   5           HB2      GLU   5 -13.490 -14.033  -2.546
    4    HB3  GLU   5           HB3      GLU   5 -14.875 -13.676  -1.515
    5    HG2  GLU   5           HG2      GLU   5 -14.755 -11.304  -2.140
    6    HG3  GLU   5           HG3      GLU   5 -13.339 -11.630  -3.140

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLU   6           H        GLU   6 -14.828 -13.329   0.931
    2    HA   GLU   6           HA       GLU   6 -15.703 -10.645   1.347
    3    HB2  GLU   6           HB2      GLU   6 -17.141 -12.628   1.756
    4    HB3  GLU   6           HB3      GLU   6 -16.101 -13.080   3.106
    5    HG2  GLU   6           HG2      GLU   6 -16.609 -10.965   4.236
    6    HG3  GLU   6           HG3      GLU   6 -17.604 -10.458   2.874

  No H/Q in entry =           6
  In of MODEL   74
    1    H    VAL   7           H        VAL   7 -13.398 -12.782   2.888
    2    HA   VAL   7           HA       VAL   7 -12.892 -11.218   5.214
    3    HB   VAL   7           HB       VAL   7 -11.224 -13.274   3.740
    4   HG11  VAL   7          HG11      VAL   7 -10.713 -11.752   6.303
    5   HG13  VAL   7          HG12      VAL   7  -9.630 -11.973   4.930
    6   HG12  VAL   7          HG13      VAL   7  -9.984 -13.330   6.000
    7   HG21  VAL   7          HG21      VAL   7 -13.466 -13.820   4.983
    8   HG23  VAL   7          HG22      VAL   7 -12.520 -13.559   6.449
    9   HG22  VAL   7          HG23      VAL   7 -12.052 -14.820   5.311

  No H/Q in entry =           9
  In of MODEL   74
    1    H    VAL   8           H        VAL   8 -11.417 -11.338   1.987
    2    HA   VAL   8           HA       VAL   8  -9.331  -9.486   2.463
    3    HB   VAL   8           HB       VAL   8 -10.813 -10.284  -0.044
    4   HG12  VAL   8          HG11      VAL   8  -8.876  -9.060  -1.203
    5   HG11  VAL   8          HG12      VAL   8  -8.603  -8.253   0.342
    6   HG13  VAL   8          HG13      VAL   8 -10.138  -8.046  -0.499
    7   HG22  VAL   8          HG21      VAL   8  -9.321 -12.006   0.051
    8   HG21  VAL   8          HG22      VAL   8  -8.546 -11.296   1.464
    9   HG23  VAL   8          HG23      VAL   8  -8.019 -10.833  -0.151

  No H/Q in entry =           9
  In of MODEL   74
    1    H    MET   9           H        MET   9 -12.685  -9.061   1.340
    2    HA   MET   9           HA       MET   9 -12.600  -6.284   0.912
    3    HB2  MET   9           HB2      MET   9 -14.820  -8.145   1.754
    4    HB3  MET   9           HB3      MET   9 -15.090  -6.413   1.559
    5    HG2  MET   9           HG2      MET   9 -14.271  -6.541  -0.763
    6    HG3  MET   9           HG3      MET   9 -13.994  -8.271  -0.570
    7    HE2  MET   9           HE1      MET   9 -16.625  -5.643  -1.766
    8    HE1  MET   9           HE2      MET   9 -16.391  -5.456  -0.030
    9    HE3  MET   9           HE3      MET   9 -17.951  -5.991  -0.648

  No H/Q in entry =           9
  In of MODEL   74
    1    H    GLY  10           H        GLY  10 -13.249  -8.177   3.842
    2    HA3  GLY  10           HA2      GLY  10 -13.758  -5.993   5.572
    3    HA2  GLY  10           HA3      GLY  10 -13.203  -7.588   6.076

  No H/Q in entry =           3
  In of MODEL   74
    1    H    LEU  11           H        LEU  11 -10.773  -7.731   4.734
    2    HA   LEU  11           HA       LEU  11  -9.041  -6.318   6.476
    3    HB2  LEU  11           HB2      LEU  11  -8.535  -7.739   3.859
    4    HB3  LEU  11           HB3      LEU  11  -7.248  -7.049   4.846
    5    HG   LEU  11           HG       LEU  11  -9.257  -9.066   5.878
    6   HD13  LEU  11          HD11      LEU  11  -8.064 -10.310   4.298
    7   HD12  LEU  11          HD12      LEU  11  -7.115 -10.561   5.762
    8   HD11  LEU  11          HD13      LEU  11  -6.577  -9.397   4.552
    9   HD22  LEU  11          HD21      LEU  11  -8.374  -8.066   7.788
   10   HD21  LEU  11          HD22      LEU  11  -6.841  -7.676   7.010
   11   HD23  LEU  11          HD23      LEU  11  -7.176  -9.331   7.519

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  12           H        ILE  12  -9.974  -5.753   3.098
    2    HA   ILE  12           HA       ILE  12  -8.268  -3.537   2.659
    3    HB   ILE  12           HB       ILE  12 -10.942  -4.177   1.390
    4   HG12  ILE  12          HG12      ILE  12  -8.926  -5.853   1.293
    5   HG13  ILE  12          HG13      ILE  12  -9.800  -5.485  -0.179
    6   HG23  ILE  12          HG21      ILE  12 -10.345  -1.861   0.949
    7   HG22  ILE  12          HG22      ILE  12 -10.017  -2.788  -0.509
    8   HG21  ILE  12          HG23      ILE  12  -8.719  -2.328   0.554
    9   HD12  ILE  12          HD11      ILE  12  -7.295  -5.464  -0.411
   10   HD11  ILE  12          HD12      ILE  12  -7.258  -4.094   0.697
   11   HD13  ILE  12          HD13      ILE  12  -8.054  -3.946  -0.853

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  13           H        ILE  13 -11.619  -3.778   3.788
    2    HA   ILE  13           HA       ILE  13 -12.052  -0.988   4.069
    3    HB   ILE  13           HB       ILE  13 -13.263  -3.405   5.433
    4   HG12  ILE  13          HG12      ILE  13 -13.518  -2.859   2.907
    5   HG13  ILE  13          HG13      ILE  13 -14.946  -3.277   3.829
    6   HG23  ILE  13          HG21      ILE  13 -13.753  -1.756   7.011
    7   HG22  ILE  13          HG22      ILE  13 -15.153  -1.650   5.952
    8   HG21  ILE  13          HG23      ILE  13 -13.850  -0.474   5.808
    9   HD12  ILE  13          HD11      ILE  13 -14.911  -1.121   2.257
   10   HD11  ILE  13          HD12      ILE  13 -14.187  -0.414   3.688
   11   HD13  ILE  13          HD13      ILE  13 -15.780  -1.128   3.796

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ASN  14           H        ASN  14 -10.937  -3.494   6.326
    2    HA   ASN  14           HA       ASN  14 -10.699  -1.864   8.613
    3    HB2  ASN  14           HB2      ASN  14 -10.470  -4.472   8.282
    4    HB3  ASN  14           HB3      ASN  14  -8.760  -4.098   8.107
    5   HD21  ASN  14          HD21      ASN  14  -9.385  -5.623  10.286
    6   HD22  ASN  14          HD22      ASN  14  -9.335  -4.707  11.712

  No H/Q in entry =           6
  In of MODEL   74
    1    H    SER  15           H        SER  15  -8.330  -2.699   6.094
    2    HA   SER  15           HA       SER  15  -6.164  -1.226   7.147
    3    HB2  SER  15           HB2      SER  15  -5.166  -1.448   4.981
    4    HB3  SER  15           HB3      SER  15  -6.137  -2.898   5.206
    5    HG   SER  15           HG       SER  15  -6.712  -0.591   3.683

  No H/Q in entry =           5
  In of MODEL   74
    1    H    GLY  16           H        GLY  16  -8.782  -0.334   4.930
    2    HA3  GLY  16           HA2      GLY  16  -7.911   2.302   4.376
    3    HA2  GLY  16           HA3      GLY  16  -9.568   1.720   4.230

  No H/Q in entry =           3
  In of MODEL   74
    1    H    GLN  17           H        GLN  17 -10.088   0.992   6.883
    2    HA   GLN  17           HA       GLN  17 -10.765   3.498   8.038
    3    HB2  GLN  17           HB2      GLN  17 -11.986   1.387   8.517
    4    HB3  GLN  17           HB3      GLN  17 -10.583   0.804   9.412
    5    HG2  GLN  17           HG2      GLN  17 -12.196   1.766  10.975
    6    HG3  GLN  17           HG3      GLN  17 -10.759   2.785  10.913
    7   HE21  GLN  17          HE21      GLN  17 -14.191   2.665  10.224
    8   HE22  GLN  17          HE22      GLN  17 -14.332   4.271   9.690

  No H/Q in entry =           8
  In of MODEL   74
    1    H    ALA  18           H        ALA  18  -8.145   1.197   8.624
    2    HA   ALA  18           HA       ALA  18  -7.016   2.400  10.886
    3    HB2  ALA  18           HB1      ALA  18  -6.435   0.184   9.506
    4    HB3  ALA  18           HB2      ALA  18  -5.256   0.956  10.567
    5    HB1  ALA  18           HB3      ALA  18  -5.195   1.239   8.826

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ARG  19           H        ARG  19  -6.277   2.927   7.430
    2    HA   ARG  19           HA       ARG  19  -4.362   4.961   7.844
    3    HB2  ARG  19           HB2      ARG  19  -4.719   3.828   5.649
    4    HB3  ARG  19           HB3      ARG  19  -6.258   4.679   5.491
    5    HG2  ARG  19           HG2      ARG  19  -5.115   6.844   5.553
    6    HG3  ARG  19           HG3      ARG  19  -3.568   6.048   5.838
    7    HD2  ARG  19           HD2      ARG  19  -3.714   6.645   3.498
    8    HD3  ARG  19           HD3      ARG  19  -3.808   4.885   3.640
    9    HE   ARG  19           HE       ARG  19  -6.436   5.810   3.663
   10   HH21  ARG  19          HH11      ARG  19  -7.650   5.978   1.758
   11   HH22  ARG  19          HH12      ARG  19  -6.844   6.055   0.230
   12   HH11  ARG  19          HH21      ARG  19  -3.682   5.861   1.600
   13   HH12  ARG  19          HH22      ARG  19  -4.596   5.986   0.140

  No H/Q in entry =          13
  In of MODEL   74
    1    H    SER  20           H        SER  20  -7.865   5.099   7.281
    2    HA   SER  20           HA       SER  20  -8.206   7.857   7.243
    3    HB2  SER  20           HB2      SER  20 -10.099   6.536   6.723
    4    HB3  SER  20           HB3      SER  20  -9.976   5.628   8.228
    5    HG   SER  20           HG       SER  20 -10.602   8.384   7.934

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LEU  21           H        LEU  21  -8.190   5.668  10.042
    2    HA   LEU  21           HA       LEU  21  -8.599   7.661  12.016
    3    HB2  LEU  21           HB2      LEU  21  -7.261   4.951  12.155
    4    HB3  LEU  21           HB3      LEU  21  -7.548   5.967  13.564
    5    HG   LEU  21           HG       LEU  21  -9.742   5.080  11.667
    6   HD13  LEU  21          HD11      LEU  21  -8.829   3.097  12.707
    7   HD12  LEU  21          HD12      LEU  21 -10.341   3.491  13.528
    8   HD11  LEU  21          HD13      LEU  21  -8.796   3.885  14.286
    9   HD21  LEU  21          HD21      LEU  21  -9.641   6.599  14.266
   10   HD23  LEU  21          HD22      LEU  21 -11.058   5.615  13.917
   11   HD22  LEU  21          HD23      LEU  21 -10.616   6.928  12.837

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ALA  22           H        ALA  22  -5.669   6.275  10.575
    2    HA   ALA  22           HA       ALA  22  -3.765   7.575  12.180
    3    HB2  ALA  22           HB1      ALA  22  -3.377   5.723  10.480
    4    HB1  ALA  22           HB2      ALA  22  -2.173   7.012  10.506
    5    HB3  ALA  22           HB3      ALA  22  -3.405   6.978   9.243

  No H/Q in entry =           5
  In of MODEL   74
    1    H    TYR  23           H        TYR  23  -5.109   8.606   9.014
    2    HA   TYR  23           HA       TYR  23  -3.761  11.095   8.935
    3    HB2  TYR  23           HB2      TYR  23  -4.866  10.195   6.952
    4    HB3  TYR  23           HB3      TYR  23  -6.436  10.306   7.750
    5    HD1  TYR  23           HD1      TYR  23  -3.543  12.336   6.557
    6    HD2  TYR  23           HD2      TYR  23  -7.663  12.327   7.768
    7    HE1  TYR  23           HE1      TYR  23  -3.767  14.689   5.806
    8    HE2  TYR  23           HE2      TYR  23  -7.888  14.680   7.017
    9    HH   TYR  23           HH       TYR  23  -5.106  16.446   5.651

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ALA  24           H        ALA  24  -6.871  10.131  10.344
    2    HA   ALA  24           HA       ALA  24  -7.686  12.723  11.130
    3    HB1  ALA  24           HB1      ALA  24  -9.506  11.481  11.613
    4    HB2  ALA  24           HB2      ALA  24  -8.669  10.901  13.051
    5    HB3  ALA  24           HB3      ALA  24  -8.564   9.992  11.544

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ALA  25           H        ALA  25  -5.681  10.251  12.678
    2    HA   ALA  25           HA       ALA  25  -5.312  11.496  15.179
    3    HB2  ALA  25           HB1      ALA  25  -4.565   9.142  14.345
    4    HB3  ALA  25           HB2      ALA  25  -3.534   9.992  15.498
    5    HB1  ALA  25           HB3      ALA  25  -3.115   9.977  13.784

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LEU  26           H        LEU  26  -3.550  11.792  12.122
    2    HA   LEU  26           HA       LEU  26  -1.573  13.600  13.022
    3    HB2  LEU  26           HB2      LEU  26  -1.299  12.451  10.913
    4    HB3  LEU  26           HB3      LEU  26  -2.775  13.169  10.274
    5    HG   LEU  26           HG       LEU  26  -1.747  15.413  10.405
    6   HD12  LEU  26          HD11      LEU  26   0.796  15.418  10.793
    7   HD11  LEU  26          HD12      LEU  26   0.572  13.837  11.536
    8   HD13  LEU  26          HD13      LEU  26  -0.222  15.255  12.224
    9   HD21  LEU  26          HD21      LEU  26  -0.029  13.353   8.988
   10   HD23  LEU  26          HD22      LEU  26  -0.067  15.075   8.621
   11   HD22  LEU  26          HD23      LEU  26  -1.498  14.086   8.345

  No H/Q in entry =          11
  In of MODEL   74
    1    H    LYS  27           H        LYS  27  -4.767  14.103  11.578
    2    HA   LYS  27           HA       LYS  27  -4.698  16.892  11.386
    3    HB2  LYS  27           HB2      LYS  27  -6.460  15.427  10.415
    4    HB3  LYS  27           HB3      LYS  27  -7.102  15.170  12.037
    5    HG2  LYS  27           HG2      LYS  27  -7.516  17.578  12.283
    6    HG3  LYS  27           HG3      LYS  27  -6.822  17.875  10.685
    7    HD2  LYS  27           HD2      LYS  27  -8.573  16.453   9.663
    8    HD3  LYS  27           HD3      LYS  27  -9.272  16.173  11.260
    9    HE2  LYS  27           HE2      LYS  27  -9.699  18.586  11.513
   10    HE3  LYS  27           HE3      LYS  27  -8.971  18.887   9.931
   11    HZ3  LYS  27           HZ1      LYS  27 -11.351  18.777   9.713
   12    HZ2  LYS  27           HZ2      LYS  27 -11.400  17.259  10.480
   13    HZ1  LYS  27           HZ3      LYS  27 -10.670  17.421   8.951

  No H/Q in entry =          13
  In of MODEL   74
    1    H    GLN  28           H        GLN  28  -5.571  14.805  14.117
    2    HA   GLN  28           HA       GLN  28  -6.437  16.810  15.907
    3    HB2  GLN  28           HB2      GLN  28  -5.046  14.168  16.427
    4    HB3  GLN  28           HB3      GLN  28  -5.764  15.174  17.686
    5    HG2  GLN  28           HG2      GLN  28  -7.262  14.067  15.295
    6    HG3  GLN  28           HG3      GLN  28  -7.309  13.380  16.917
    7   HE21  GLN  28          HE21      GLN  28  -9.208  15.166  14.981
    8   HE22  GLN  28          HE22      GLN  28  -9.926  16.206  16.113

  No H/Q in entry =           8
  In of MODEL   74
    1    H    ALA  29           H        ALA  29  -3.233  15.494  15.181
    2    HA   ALA  29           HA       ALA  29  -1.766  16.878  17.148
    3    HB1  ALA  29           HB1      ALA  29   0.149  16.176  16.008
    4    HB3  ALA  29           HB2      ALA  29  -0.621  16.310  14.427
    5    HB2  ALA  29           HB3      ALA  29  -1.041  14.977  15.503

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LYS  30           H        LYS  30  -2.651  17.771  13.830
    2    HA   LYS  30           HA       LYS  30  -1.223  20.200  13.720
    3    HB2  LYS  30           HB2      LYS  30  -3.775  19.350  12.336
    4    HB3  LYS  30           HB3      LYS  30  -2.933  20.859  11.987
    5    HG2  LYS  30           HG2      LYS  30  -0.879  19.550  11.449
    6    HG3  LYS  30           HG3      LYS  30  -1.796  18.061  11.700
    7    HD2  LYS  30           HD2      LYS  30  -3.373  18.719   9.923
    8    HD3  LYS  30           HD3      LYS  30  -2.479  20.221   9.674
    9    HE2  LYS  30           HE2      LYS  30  -0.464  18.912   9.071
   10    HE3  LYS  30           HE3      LYS  30  -1.377  17.416   9.288
   11    HZ2  LYS  30           HZ1      LYS  30  -1.218  18.291   6.947
   12    HZ1  LYS  30           HZ2      LYS  30  -2.245  19.562   7.429
   13    HZ3  LYS  30           HZ3      LYS  30  -2.783  17.949   7.502

  No H/Q in entry =          13
  In of MODEL   74
    1    H    GLN  31           H        GLN  31  -4.316  19.373  15.163
    2    HA   GLN  31           HA       GLN  31  -5.049  22.135  15.630
    3    HB2  GLN  31           HB2      GLN  31  -6.237  19.696  16.959
    4    HB3  GLN  31           HB3      GLN  31  -6.985  21.276  16.725
    5    HG2  GLN  31           HG2      GLN  31  -6.309  20.499  14.126
    6    HG3  GLN  31           HG3      GLN  31  -6.840  18.997  14.875
    7   HE21  GLN  31          HE21      GLN  31  -8.257  20.590  12.792
    8   HE22  GLN  31          HE22      GLN  31  -9.760  20.995  13.467

  No H/Q in entry =           8
  In of MODEL   74
    1    H    GLY  32           H        GLY  32  -2.742  20.182  16.921
    2    HA3  GLY  32           HA2      GLY  32  -1.318  20.625  18.709
    3    HA2  GLY  32           HA3      GLY  32  -2.429  21.878  19.248

  No H/Q in entry =           3
  In of MODEL   74
    1    H    ASP  33           H        ASP  33  -3.888  18.855  18.593
    2    HA   ASP  33           HA       ASP  33  -4.273  18.393  21.476
    3    HB2  ASP  33           HB2      ASP  33  -5.715  17.402  19.011
    4    HB3  ASP  33           HB3      ASP  33  -6.050  16.791  20.629

  No H/Q in entry =           4
  In of MODEL   74
    1    H    PHE  34           H        PHE  34  -2.110  17.519  21.756
    2    HA   PHE  34           HA       PHE  34  -1.147  15.264  20.338
    3    HB2  PHE  34           HB2      PHE  34  -0.491  16.235  23.129
    4    HB3  PHE  34           HB3      PHE  34   0.416  15.005  22.248
    5    HD1  PHE  34           HD1      PHE  34   0.287  18.430  22.994
    6    HD2  PHE  34           HD2      PHE  34   1.055  15.728  19.743
    7    HE1  PHE  34           HE1      PHE  34   1.588  20.191  21.831
    8    HE2  PHE  34           HE2      PHE  34   2.351  17.492  18.585
    9    HZ   PHE  34           HZ       PHE  34   2.619  19.721  19.634

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ALA  35           H        ALA  35  -3.153  15.554  23.224
    2    HA   ALA  35           HA       ALA  35  -2.959  12.887  24.110
    3    HB3  ALA  35           HB1      ALA  35  -5.401  13.535  24.996
    4    HB1  ALA  35           HB2      ALA  35  -4.856  15.150  24.539
    5    HB2  ALA  35           HB3      ALA  35  -3.938  14.213  25.717

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ALA  36           H        ALA  36  -5.415  14.435  22.041
    2    HA   ALA  36           HA       ALA  36  -6.860  12.039  21.572
    3    HB1  ALA  36           HB1      ALA  36  -8.312  13.479  20.636
    4    HB3  ALA  36           HB2      ALA  36  -7.149  13.891  19.375
    5    HB2  ALA  36           HB3      ALA  36  -7.148  14.775  20.902

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ALA  37           H        ALA  37  -4.182  13.604  19.879
    2    HA   ALA  37           HA       ALA  37  -4.188  11.975  17.577
    3    HB3  ALA  37           HB1      ALA  37  -2.163  13.662  18.983
    4    HB2  ALA  37           HB2      ALA  37  -2.711  13.729  17.309
    5    HB1  ALA  37           HB3      ALA  37  -1.565  12.485  17.814

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LYS  38           H        LYS  38  -2.402  11.642  20.635
    2    HA   LYS  38           HA       LYS  38  -1.106   9.230  20.125
    3    HB2  LYS  38           HB2      LYS  38  -1.388  10.990  22.279
    4    HB3  LYS  38           HB3      LYS  38  -2.016   9.465  22.897
    5    HG2  LYS  38           HG2      LYS  38   0.061   8.325  22.335
    6    HG3  LYS  38           HG3      LYS  38   0.676   9.766  21.519
    7    HD2  LYS  38           HD2      LYS  38   0.879  10.977  23.556
    8    HD3  LYS  38           HD3      LYS  38  -0.143   9.834  24.430
    9    HE2  LYS  38           HE2      LYS  38   2.216   9.492  25.023
   10    HE3  LYS  38           HE3      LYS  38   1.588   8.085  24.161
   11    HZ3  LYS  38           HZ1      LYS  38   2.874   8.496  22.368
   12    HZ2  LYS  38           HZ2      LYS  38   3.849   9.311  23.496
   13    HZ1  LYS  38           HZ3      LYS  38   2.768  10.185  22.519

  No H/Q in entry =          13
  In of MODEL   74
    1    H    ALA  39           H        ALA  39  -4.324   9.754  21.564
    2    HA   ALA  39           HA       ALA  39  -4.906   7.039  22.066
    3    HB3  ALA  39           HB1      ALA  39  -7.053   9.007  21.328
    4    HB2  ALA  39           HB2      ALA  39  -6.137   9.221  22.820
    5    HB1  ALA  39           HB3      ALA  39  -7.072   7.747  22.562

  No H/Q in entry =           5
  In of MODEL   74
    1    H    MET  40           H        MET  40  -5.502   9.066  19.232
    2    HA   MET  40           HA       MET  40  -7.013   7.154  17.782
    3    HB2  MET  40           HB2      MET  40  -5.389   9.536  16.867
    4    HB3  MET  40           HB3      MET  40  -6.436   8.590  15.805
    5    HG2  MET  40           HG2      MET  40  -7.430   9.841  18.378
    6    HG3  MET  40           HG3      MET  40  -7.496  10.681  16.830
    7    HE3  MET  40           HE1      MET  40 -10.117   9.094  14.789
    8    HE2  MET  40           HE2      MET  40  -8.365   9.194  14.623
    9    HE1  MET  40           HE3      MET  40  -9.262  10.567  15.270

  No H/Q in entry =           9
  In of MODEL   74
    1    H    MET  41           H        MET  41  -3.513   7.856  17.869
    2    HA   MET  41           HA       MET  41  -2.795   6.101  15.755
    3    HB2  MET  41           HB2      MET  41  -1.145   6.744  18.213
    4    HB3  MET  41           HB3      MET  41  -0.550   6.095  16.689
    5    HG2  MET  41           HG2      MET  41  -1.696   8.292  15.704
    6    HG3  MET  41           HG3      MET  41  -1.437   8.872  17.347
    7    HE2  MET  41           HE1      MET  41   1.464   6.745  17.671
    8    HE1  MET  41           HE2      MET  41   0.698   8.043  18.582
    9    HE3  MET  41           HE3      MET  41   2.317   8.273  17.923

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ASP  42           H        ASP  42  -3.147   5.621  19.244
    2    HA   ASP  42           HA       ASP  42  -2.134   3.017  19.385
    3    HB2  ASP  42           HB2      ASP  42  -2.972   4.779  21.222
    4    HB3  ASP  42           HB3      ASP  42  -4.409   3.767  21.162

  No H/Q in entry =           4
  In of MODEL   74
    1    H    GLN  43           H        GLN  43  -5.462   4.153  18.924
    2    HA   GLN  43           HA       GLN  43  -6.632   1.577  18.733
    3    HB2  GLN  43           HB2      GLN  43  -7.542   4.242  17.622
    4    HB3  GLN  43           HB3      GLN  43  -8.519   2.771  17.606
    5    HG2  GLN  43           HG2      GLN  43  -8.200   2.640  20.110
    6    HG3  GLN  43           HG3      GLN  43  -7.461   4.238  20.035
    7   HE21  GLN  43          HE21      GLN  43  -9.624   4.334  21.559
    8   HE22  GLN  43          HE22      GLN  43 -10.988   4.924  20.744

  No H/Q in entry =           8
  In of MODEL   74
    1    H    SER  44           H        SER  44  -5.296   3.786  16.314
    2    HA   SER  44           HA       SER  44  -6.035   2.316  14.028
    3    HB2  SER  44           HB2      SER  44  -4.752   4.686  14.466
    4    HB3  SER  44           HB3      SER  44  -3.413   3.679  13.918
    5    HG   SER  44           HG       SER  44  -4.535   4.667  12.170

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ARG  45           H        ARG  45  -3.137   2.169  16.077
    2    HA   ARG  45           HA       ARG  45  -1.690   0.206  14.674
    3    HB2  ARG  45           HB2      ARG  45  -0.816   1.613  16.538
    4    HB3  ARG  45           HB3      ARG  45  -1.804   0.688  17.666
    5    HG2  ARG  45           HG2      ARG  45  -0.598  -1.380  17.004
    6    HG3  ARG  45           HG3      ARG  45   0.415  -0.430  15.918
    7    HD2  ARG  45           HD2      ARG  45   1.183   0.937  17.870
    8    HD3  ARG  45           HD3      ARG  45   0.262  -0.133  18.950
    9    HE   ARG  45           HE       ARG  45   1.929  -1.739  17.347
   10   HH21  ARG  45          HH11      ARG  45   3.830  -2.582  18.162
   11   HH22  ARG  45          HH12      ARG  45   4.624  -1.808  19.487
   12   HH11  ARG  45          HH21      ARG  45   2.280   0.717  19.741
   13   HH12  ARG  45          HH22      ARG  45   3.746   0.063  20.379

  No H/Q in entry =          13
  In of MODEL   74
    1    H    MET  46           H        MET  46  -4.063  -0.100  17.298
    2    HA   MET  46           HA       MET  46  -3.919  -2.902  17.594
    3    HB2  MET  46           HB2      MET  46  -6.057  -0.873  18.227
    4    HB3  MET  46           HB3      MET  46  -6.287  -2.592  18.554
    5    HG2  MET  46           HG2      MET  46  -4.279  -2.627  19.951
    6    HG3  MET  46           HG3      MET  46  -3.960  -0.940  19.579
    7    HE1  MET  46           HE1      MET  46  -6.247  -3.501  20.719
    8    HE3  MET  46           HE2      MET  46  -7.738  -2.568  20.790
    9    HE2  MET  46           HE3      MET  46  -6.886  -2.965  22.278

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ALA  47           H        ALA  47  -5.941  -0.859  15.527
    2    HA   ALA  47           HA       ALA  47  -7.590  -2.890  14.471
    3    HB3  ALA  47           HB1      ALA  47  -8.252  -0.645  14.070
    4    HB1  ALA  47           HB2      ALA  47  -7.785  -1.278  12.491
    5    HB2  ALA  47           HB3      ALA  47  -6.685  -0.223  13.380

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LEU  48           H        LEU  48  -4.469  -1.609  13.393
    2    HA   LEU  48           HA       LEU  48  -4.228  -3.195  11.043
    3    HB2  LEU  48           HB2      LEU  48  -2.140  -1.943  12.835
    4    HB3  LEU  48           HB3      LEU  48  -1.794  -2.663  11.262
    5    HG   LEU  48           HG       LEU  48  -3.790  -0.426  11.679
    6   HD13  LEU  48          HD11      LEU  48  -1.653   0.426  12.326
    7   HD12  LEU  48          HD12      LEU  48  -1.939   0.988  10.679
    8   HD11  LEU  48          HD13      LEU  48  -0.852  -0.371  10.971
    9   HD22  LEU  48          HD21      LEU  48  -4.293  -1.398   9.605
   10   HD21  LEU  48          HD22      LEU  48  -2.618  -1.850   9.291
   11   HD23  LEU  48          HD23      LEU  48  -3.121  -0.165   9.143

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ASN  49           H        ASN  49  -3.153  -3.614  14.377
    2    HA   ASN  49           HA       ASN  49  -1.578  -5.893  14.023
    3    HB2  ASN  49           HB2      ASN  49  -1.546  -4.588  16.076
    4    HB3  ASN  49           HB3      ASN  49  -3.222  -5.001  16.408
    5   HD21  ASN  49          HD21      ASN  49  -0.011  -6.533  15.969
    6   HD22  ASN  49          HD22      ASN  49  -0.319  -7.827  17.024

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLU  50           H        GLU  50  -5.037  -5.582  14.731
    2    HA   GLU  50           HA       GLU  50  -5.579  -8.376  14.835
    3    HB2  GLU  50           HB2      GLU  50  -7.137  -6.674  15.733
    4    HB3  GLU  50           HB3      GLU  50  -7.441  -6.100  14.091
    5    HG2  GLU  50           HG2      GLU  50  -8.337  -8.284  13.455
    6    HG3  GLU  50           HG3      GLU  50  -7.947  -8.938  15.042

  No H/Q in entry =           6
  In of MODEL   74
    1    H    ALA  51           H        ALA  51  -5.646  -5.968  12.248
    2    HA   ALA  51           HA       ALA  51  -6.672  -7.677  10.231
    3    HB2  ALA  51           HB1      ALA  51  -6.445  -5.862   8.865
    4    HB1  ALA  51           HB2      ALA  51  -4.796  -5.535   9.398
    5    HB3  ALA  51           HB3      ALA  51  -6.163  -5.010  10.383

  No H/Q in entry =           5
  In of MODEL   74
    1    H    HIS  52           H        HIS  52  -3.361  -6.813  11.184
    2    HA   HIS  52           HA       HIS  52  -2.000  -8.312   9.216
    3    HB2  HIS  52           HB2      HIS  52  -0.909  -6.605  10.624
    4    HB3  HIS  52           HB3      HIS  52  -1.116  -7.642  12.034
    5    HD1  HIS  52           HD1      HIS  52   0.144 -10.024  11.910
    6    HD2  HIS  52           HD2      HIS  52   1.342  -7.194   9.092
    7    HE1  HIS  52           HE1      HIS  52   2.364 -10.824  10.989
    8    HE2  HIS  52           HE2      HIS  52   3.107  -9.110   9.271

  No H/Q in entry =           8
  In of MODEL   74
    1    H    LEU  53           H        LEU  53  -3.190  -9.185  12.437
    2    HA   LEU  53           HA       LEU  53  -2.022 -11.745  12.610
    3    HB2  LEU  53           HB2      LEU  53  -4.483 -10.541  13.852
    4    HB3  LEU  53           HB3      LEU  53  -4.034 -12.220  14.137
    5    HG   LEU  53           HG       LEU  53  -2.102  -9.926  14.590
    6   HD11  LEU  53          HD11      LEU  53  -4.143 -11.170  16.439
    7   HD13  LEU  53          HD12      LEU  53  -3.873  -9.460  16.101
    8   HD12  LEU  53          HD13      LEU  53  -2.702 -10.365  17.053
    9   HD23  LEU  53          HD21      LEU  53  -1.231 -11.732  16.275
   10   HD22  LEU  53          HD22      LEU  53  -0.861 -11.928  14.565
   11   HD21  LEU  53          HD23      LEU  53  -2.150 -12.868  15.293

  No H/Q in entry =          11
  In of MODEL   74
    1    H    VAL  54           H        VAL  54  -5.133 -10.672  11.283
    2    HA   VAL  54           HA       VAL  54  -6.087 -13.251  10.596
    3    HB   VAL  54           HB       VAL  54  -6.710 -10.506   9.477
    4   HG12  VAL  54          HG11      VAL  54  -8.838 -11.854   8.682
    5   HG11  VAL  54          HG12      VAL  54  -7.743 -13.235   8.738
    6   HG13  VAL  54          HG13      VAL  54  -7.376 -11.861   7.697
    7   HG22  VAL  54          HG21      VAL  54  -7.596 -10.540  11.638
    8   HG21  VAL  54          HG22      VAL  54  -7.873 -12.280  11.615
    9   HG23  VAL  54          HG23      VAL  54  -8.949 -11.206  10.723

  No H/Q in entry =           9
  In of MODEL   74
    1    H    GLN  55           H        GLN  55  -4.202 -10.818   8.797
    2    HA   GLN  55           HA       GLN  55  -4.115 -12.275   6.373
    3    HB2  GLN  55           HB2      GLN  55  -3.483 -10.019   6.185
    4    HB3  GLN  55           HB3      GLN  55  -2.360 -10.114   7.538
    5    HG2  GLN  55           HG2      GLN  55  -0.667 -10.978   6.242
    6    HG3  GLN  55           HG3      GLN  55  -1.763 -11.936   5.255
    7   HE21  GLN  55          HE21      GLN  55  -1.792 -11.238   3.137
    8   HE22  GLN  55          HE22      GLN  55  -1.578  -9.634   2.630

  No H/Q in entry =           8
  In of MODEL   74
    1    H    THR  56           H        THR  56  -1.980 -12.293   9.232
    2    HA   THR  56           HA       THR  56   0.067 -13.916   8.289
    3    HB   THR  56           HB       THR  56  -1.152 -14.155  11.048
    4    HG1  THR  56           HG1      THR  56   0.064 -12.072   9.786
    5   HG22  THR  56          HG21      THR  56   1.320 -14.499  11.601
    6   HG21  THR  56          HG22      THR  56   1.576 -14.675   9.864
    7   HG23  THR  56          HG23      THR  56   0.531 -15.807  10.721

  No H/Q in entry =           7
  In of MODEL   74
    1    H    LYS  57           H        LYS  57  -3.053 -14.915   9.680
    2    HA   LYS  57           HA       LYS  57  -2.648 -17.716   9.420
    3    HB2  LYS  57           HB2      LYS  57  -4.437 -16.605  10.787
    4    HB3  LYS  57           HB3      LYS  57  -5.238 -16.140   9.294
    5    HG2  LYS  57           HG2      LYS  57  -5.501 -18.505   8.678
    6    HG3  LYS  57           HG3      LYS  57  -4.678 -18.991  10.158
    7    HD2  LYS  57           HD2      LYS  57  -6.461 -17.926  11.501
    8    HD3  LYS  57           HD3      LYS  57  -7.293 -17.451  10.020
    9    HE2  LYS  57           HE2      LYS  57  -7.524 -19.835   9.386
   10    HE3  LYS  57           HE3      LYS  57  -6.700 -20.319  10.866
   11    HZ3  LYS  57           HZ1      LYS  57  -8.524 -19.989  12.072
   12    HZ2  LYS  57           HZ2      LYS  57  -9.364 -19.991  10.595
   13    HZ1  LYS  57           HZ3      LYS  57  -8.896 -18.520  11.306

  No H/Q in entry =          13
  In of MODEL   74
    1    H    LEU  58           H        LEU  58  -3.967 -15.248   7.266
    2    HA   LEU  58           HA       LEU  58  -4.814 -17.054   5.261
    3    HB2  LEU  58           HB2      LEU  58  -4.168 -14.114   5.130
    4    HB3  LEU  58           HB3      LEU  58  -4.858 -15.037   3.793
    5    HG   LEU  58           HG       LEU  58  -6.108 -14.849   6.554
    6   HD11  LEU  58          HD11      LEU  58  -6.410 -13.190   4.071
    7   HD13  LEU  58          HD12      LEU  58  -6.376 -12.688   5.762
    8   HD12  LEU  58          HD13      LEU  58  -7.816 -13.460   5.101
    9   HD22  LEU  58          HD21      LEU  58  -7.105 -16.742   5.688
   10   HD21  LEU  58          HD22      LEU  58  -6.776 -16.289   4.015
   11   HD23  LEU  58          HD23      LEU  58  -8.121 -15.548   4.882

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  59           H        ILE  59  -1.654 -15.890   6.095
    2    HA   ILE  59           HA       ILE  59  -0.592 -16.623   3.446
    3    HB   ILE  59           HB       ILE  59   0.220 -14.573   5.010
    4   HG12  ILE  59          HG12      ILE  59   2.276 -16.254   3.562
    5   HG13  ILE  59          HG13      ILE  59   1.090 -15.294   2.717
    6   HG22  ILE  59          HG21      ILE  59   2.290 -16.641   5.690
    7   HG21  ILE  59          HG22      ILE  59   0.939 -16.373   6.768
    8   HG23  ILE  59          HG23      ILE  59   2.058 -15.061   6.399
    9   HD11  ILE  59          HD11      ILE  59   3.025 -14.206   4.760
   10   HD13  ILE  59          HD12      ILE  59   1.880 -13.258   3.813
   11   HD12  ILE  59          HD13      ILE  59   3.228 -14.067   3.015

  No H/Q in entry =          11
  In of MODEL   74
    1    H    GLU  60           H        GLU  60  -0.585 -17.741   6.810
    2    HA   GLU  60           HA       GLU  60   1.415 -19.746   6.519
    3    HB2  GLU  60           HB2      GLU  60   0.855 -20.388   8.668
    4    HB3  GLU  60           HB3      GLU  60   0.209 -18.749   8.654
    5    HG2  GLU  60           HG2      GLU  60  -1.580 -20.019   9.514
    6    HG3  GLU  60           HG3      GLU  60  -1.987 -19.867   7.806

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLY  61           H        GLY  61  -2.101 -19.793   6.067
    2    HA3  GLY  61           HA2      GLY  61  -1.901 -22.586   5.097
    3    HA2  GLY  61           HA3      GLY  61  -3.370 -21.832   5.707

  No H/Q in entry =           3
  In of MODEL   74
    1    H    ASP  62           H        ASP  62  -1.140 -20.277   3.488
    2    HA   ASP  62           HA       ASP  62  -3.187 -19.568   1.665
    3    HB2  ASP  62           HB2      ASP  62  -1.310 -18.759   0.271
    4    HB3  ASP  62           HB3      ASP  62  -1.167 -18.231   1.945

  No H/Q in entry =           4
  In of MODEL   74
    1    H    ALA  63           H        ALA  63  -0.869 -22.262   1.680
    2    HA   ALA  63           HA       ALA  63  -1.396 -23.091  -1.027
    3    HB2  ALA  63           HB1      ALA  63  -0.337 -25.255  -0.207
    4    HB1  ALA  63           HB2      ALA  63  -0.109 -24.431   1.336
    5    HB3  ALA  63           HB3      ALA  63   0.664 -23.803  -0.121

  No H/Q in entry =           5
  In of MODEL   74
    1    H    GLY  64           H        GLY  64  -1.645 -25.756   0.972
    2    HA3  GLY  64           HA2      GLY  64  -3.347 -27.178   1.587
    3    HA2  GLY  64           HA3      GLY  64  -4.453 -25.817   1.496

  No H/Q in entry =           3
  In of MODEL   74
    1    H    GLU  65           H        GLU  65  -4.626 -25.088  -1.039
    2    HA   GLU  65           HA       GLU  65  -6.055 -27.215  -2.246
    3    HB2  GLU  65           HB2      GLU  65  -5.196 -24.530  -3.315
    4    HB3  GLU  65           HB3      GLU  65  -6.236 -25.649  -4.197
    5    HG2  GLU  65           HG2      GLU  65  -7.886 -25.601  -2.409
    6    HG3  GLU  65           HG3      GLU  65  -6.828 -24.600  -1.417

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLY  66           H        GLY  66  -2.906 -25.856  -2.818
    2    HA3  GLY  66           HA2      GLY  66  -2.057 -28.211  -4.290
    3    HA2  GLY  66           HA3      GLY  66  -1.980 -26.694  -5.163

  No H/Q in entry =           3
  In of MODEL   74
    1    H    LYS  67           H        LYS  67   0.259 -27.006  -5.391
    2    HA   LYS  67           HA       LYS  67   1.936 -27.031  -3.021
    3    HB2  LYS  67           HB2      LYS  67   3.731 -27.012  -4.962
    4    HB3  LYS  67           HB3      LYS  67   2.817 -28.473  -4.568
    5    HG2  LYS  67           HG2      LYS  67   1.213 -28.024  -6.322
    6    HG3  LYS  67           HG3      LYS  67   1.928 -26.445  -6.637
    7    HD2  LYS  67           HD2      LYS  67   4.010 -27.518  -7.384
    8    HD3  LYS  67           HD3      LYS  67   3.322 -29.107  -7.039
    9    HE2  LYS  67           HE2      LYS  67   2.947 -28.816  -9.359
   10    HE3  LYS  67           HE3      LYS  67   1.400 -28.409  -8.619
   11    HZ2  LYS  67           HZ1      LYS  67   3.241 -26.737 -10.059
   12    HZ1  LYS  67           HZ2      LYS  67   2.725 -26.056  -8.591
   13    HZ3  LYS  67           HZ3      LYS  67   1.585 -26.521  -9.762

  No H/Q in entry =          13
  In of MODEL   74
    1    H    MET  68           H        MET  68   3.099 -25.423  -5.792
    2    HA   MET  68           HA       MET  68   4.095 -23.185  -4.407
    3    HB2  MET  68           HB2      MET  68   3.783 -23.870  -7.314
    4    HB3  MET  68           HB3      MET  68   4.452 -22.321  -6.801
    5    HG2  MET  68           HG2      MET  68   5.494 -25.003  -5.851
    6    HG3  MET  68           HG3      MET  68   6.191 -24.101  -7.198
    7    HE3  MET  68           HE1      MET  68   7.801 -24.700  -3.891
    8    HE2  MET  68           HE2      MET  68   8.892 -23.671  -4.817
    9    HE1  MET  68           HE3      MET  68   7.956 -24.917  -5.640

  No H/Q in entry =           9
  In of MODEL   74
    1    H    LYS  69           H        LYS  69   1.184 -23.541  -6.417
    2    HA   LYS  69           HA       LYS  69   0.560 -20.824  -6.636
    3    HB2  LYS  69           HB2      LYS  69  -1.322 -23.170  -6.708
    4    HB3  LYS  69           HB3      LYS  69  -1.694 -21.532  -7.257
    5    HG2  LYS  69           HG2      LYS  69   0.756 -22.935  -8.289
    6    HG3  LYS  69           HG3      LYS  69  -0.821 -23.287  -8.997
    7    HD2  LYS  69           HD2      LYS  69  -1.151 -20.871  -9.434
    8    HD3  LYS  69           HD3      LYS  69   0.452 -20.545  -8.770
    9    HE2  LYS  69           HE2      LYS  69   1.466 -21.991 -10.494
   10    HE3  LYS  69           HE3      LYS  69  -0.134 -22.317 -11.160
   11    HZ2  LYS  69           HZ1      LYS  69   1.086 -20.540 -12.334
   12    HZ1  LYS  69           HZ2      LYS  69   1.049 -19.608 -10.914
   13    HZ3  LYS  69           HZ3      LYS  69  -0.399 -20.023 -11.700

  No H/Q in entry =          13
  In of MODEL   74
    1    H    VAL  70           H        VAL  70  -0.630 -19.359  -5.537
    2    HA   VAL  70           HA       VAL  70  -1.849 -20.165  -2.960
    3    HB   VAL  70           HB       VAL  70  -0.966 -18.065  -1.967
    4   HG13  VAL  70          HG11      VAL  70   0.282 -20.133  -1.620
    5   HG12  VAL  70          HG12      VAL  70   1.415 -18.798  -1.832
    6   HG11  VAL  70          HG13      VAL  70   1.116 -19.919  -3.160
    7   HG22  VAL  70          HG21      VAL  70  -0.530 -16.516  -3.649
    8   HG21  VAL  70          HG22      VAL  70   0.089 -17.742  -4.752
    9   HG23  VAL  70          HG23      VAL  70   1.100 -17.158  -3.434

  No H/Q in entry =           9
  In of MODEL   74
    1    H    SER  71           H        SER  71  -3.307 -18.431  -2.128
    2    HA   SER  71           HA       SER  71  -5.288 -17.721  -4.012
    3    HB2  SER  71           HB2      SER  71  -5.620 -17.969  -1.504
    4    HB3  SER  71           HB3      SER  71  -4.819 -16.414  -1.313
    5    HG   SER  71           HG       SER  71  -6.865 -16.554  -3.187

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LEU  72           H        LEU  72  -5.442 -16.072  -5.352
    2    HA   LEU  72           HA       LEU  72  -3.316 -14.286  -5.849
    3    HB2  LEU  72           HB2      LEU  72  -6.191 -14.294  -6.763
    4    HB3  LEU  72           HB3      LEU  72  -4.982 -13.157  -7.352
    5    HG   LEU  72           HG       LEU  72  -4.635 -16.170  -7.492
    6   HD13  LEU  72          HD11      LEU  72  -5.354 -16.064  -9.786
    7   HD12  LEU  72          HD12      LEU  72  -5.450 -14.304  -9.733
    8   HD11  LEU  72          HD13      LEU  72  -6.603 -15.276  -8.820
    9   HD22  LEU  72          HD21      LEU  72  -2.499 -15.220  -7.749
   10   HD21  LEU  72          HD22      LEU  72  -3.112 -13.787  -8.556
   11   HD23  LEU  72          HD23      LEU  72  -3.059 -15.323  -9.415

  No H/Q in entry =          11
  In of MODEL   74
    1    H    VAL  73           H        VAL  73  -6.387 -13.896  -4.185
    2    HA   VAL  73           HA       VAL  73  -6.392 -11.126  -3.823
    3    HB   VAL  73           HB       VAL  73  -8.118 -11.459  -2.268
    4   HG12  VAL  73          HG11      VAL  73  -8.303 -14.028  -3.823
    5   HG11  VAL  73          HG12      VAL  73  -8.350 -12.479  -4.663
    6   HG13  VAL  73          HG13      VAL  73  -9.575 -12.862  -3.452
    7   HG23  VAL  73          HG21      VAL  73  -8.435 -13.800  -1.250
    8   HG22  VAL  73          HG22      VAL  73  -7.097 -12.840  -0.619
    9   HG21  VAL  73          HG23      VAL  73  -6.786 -14.131  -1.780

  No H/Q in entry =           9
  In of MODEL   74
    1    H    LEU  74           H        LEU  74  -4.468 -13.525  -2.269
    2    HA   LEU  74           HA       LEU  74  -4.015 -12.399   0.253
    3    HB2  LEU  74           HB2      LEU  74  -3.266 -14.626  -0.266
    4    HB3  LEU  74           HB3      LEU  74  -2.216 -14.021  -1.546
    5    HG   LEU  74           HG       LEU  74  -0.879 -12.794   0.133
    6   HD12  LEU  74          HD11      LEU  74  -1.355 -13.523   2.574
    7   HD11  LEU  74          HD12      LEU  74  -2.961 -13.957   1.985
    8   HD13  LEU  74          HD13      LEU  74  -2.403 -12.288   1.876
    9   HD23  LEU  74          HD21      LEU  74  -1.120 -15.553   1.217
   10   HD22  LEU  74          HD22      LEU  74   0.296 -14.646   0.736
   11   HD21  LEU  74          HD23      LEU  74  -0.723 -15.364  -0.490

  No H/Q in entry =          11
  In of MODEL   74
    1    H    VAL  75           H        VAL  75  -2.152 -12.018  -2.723
    2    HA   VAL  75           HA       VAL  75  -0.319 -10.121  -1.724
    3    HB   VAL  75           HB       VAL  75  -1.311 -10.587  -4.537
    4   HG12  VAL  75          HG11      VAL  75   0.752  -9.292  -5.182
    5   HG11  VAL  75          HG12      VAL  75   0.984  -8.895  -3.485
    6   HG13  VAL  75          HG13      VAL  75  -0.432  -8.300  -4.338
    7   HG23  VAL  75          HG21      VAL  75   1.309 -11.321  -3.189
    8   HG22  VAL  75          HG22      VAL  75   0.742 -11.847  -4.774
    9   HG21  VAL  75          HG23      VAL  75  -0.059 -12.429  -3.314

  No H/Q in entry =           9
  In of MODEL   74
    1    H    GLU  76           H        GLU  76  -3.482  -9.727  -3.346
    2    HA   GLU  76           HA       GLU  76  -3.499  -6.911  -3.435
    3    HB2  GLU  76           HB2      GLU  76  -5.188  -8.327  -4.585
    4    HB3  GLU  76           HB3      GLU  76  -5.832  -8.819  -3.026
    5    HG2  GLU  76           HG2      GLU  76  -7.273  -7.086  -3.877
    6    HG3  GLU  76           HG3      GLU  76  -6.358  -6.379  -2.560

  No H/Q in entry =           6
  In of MODEL   74
    1    H    ALA  77           H        ALA  77  -4.610  -9.136  -0.893
    2    HA   ALA  77           HA       ALA  77  -5.522  -7.129   0.885
    3    HB1  ALA  77           HB1      ALA  77  -4.544  -9.949   1.366
    4    HB3  ALA  77           HB2      ALA  77  -6.213  -9.389   1.266
    5    HB2  ALA  77           HB3      ALA  77  -5.209  -8.926   2.639

  No H/Q in entry =           5
  In of MODEL   74
    1    H    GLN  78           H        GLN  78  -2.399  -8.717   0.479
    2    HA   GLN  78           HA       GLN  78  -1.102  -7.583   2.720
    3    HB2  GLN  78           HB2      GLN  78  -0.283  -9.529   1.342
    4    HB3  GLN  78           HB3      GLN  78   0.160  -8.380   0.084
    5    HG2  GLN  78           HG2      GLN  78   1.647  -7.218   1.665
    6    HG3  GLN  78           HG3      GLN  78   1.210  -8.369   2.926
    7   HE21  GLN  78          HE21      GLN  78   3.928  -8.117   2.063
    8   HE22  GLN  78          HE22      GLN  78   4.367  -9.545   1.256

  No H/Q in entry =           8
  In of MODEL   74
    1    H    LEU  79           H        LEU  79  -1.491  -6.503  -0.618
    2    HA   LEU  79           HA       LEU  79   0.225  -4.299  -0.614
    3    HB2  LEU  79           HB2      LEU  79  -0.835  -5.084  -2.660
    4    HB3  LEU  79           HB3      LEU  79  -2.426  -4.673  -2.032
    5    HG   LEU  79           HG       LEU  79  -1.849  -2.293  -2.003
    6   HD13  LEU  79          HD11      LEU  79   0.400  -2.082  -1.514
    7   HD12  LEU  79          HD12      LEU  79   0.434  -1.788  -3.253
    8   HD11  LEU  79          HD13      LEU  79   0.873  -3.375  -2.618
    9   HD23  LEU  79          HD21      LEU  79  -1.240  -2.092  -4.561
   10   HD22  LEU  79          HD22      LEU  79  -2.771  -2.821  -4.088
   11   HD21  LEU  79          HD23      LEU  79  -1.418  -3.847  -4.552

  No H/Q in entry =          11
  In of MODEL   74
    1    H    HIS  80           H        HIS  80  -3.234  -4.417   0.249
    2    HA   HIS  80           HA       HIS  80  -3.379  -1.661   0.926
    3    HB2  HIS  80           HB2      HIS  80  -5.111  -4.048   1.254
    4    HB3  HIS  80           HB3      HIS  80  -5.400  -2.708   2.367
    5    HD1  HIS  80           HD1      HIS  80  -7.005  -1.045   1.484
    6    HD2  HIS  80           HD2      HIS  80  -4.871  -2.875  -1.595
    7    HE1  HIS  80           HE1      HIS  80  -7.854  -0.027  -0.682
    8    HE2  HIS  80           HE2      HIS  80  -6.560  -1.137  -2.568

  No H/Q in entry =           8
  In of MODEL   74
    1    H    LEU  81           H        LEU  81  -2.910  -4.571   2.902
    2    HA   LEU  81           HA       LEU  81  -2.851  -3.235   5.391
    3    HB2  LEU  81           HB2      LEU  81  -1.680  -5.865   4.488
    4    HB3  LEU  81           HB3      LEU  81  -1.627  -5.313   6.163
    5    HG   LEU  81           HG       LEU  81  -4.194  -5.522   4.563
    6   HD12  LEU  81          HD11      LEU  81  -4.509  -7.590   6.105
    7   HD11  LEU  81          HD12      LEU  81  -2.754  -7.545   6.272
    8   HD13  LEU  81          HD13      LEU  81  -3.484  -7.758   4.680
    9   HD23  LEU  81          HD21      LEU  81  -5.012  -5.724   7.072
   10   HD22  LEU  81          HD22      LEU  81  -4.672  -4.137   6.385
   11   HD21  LEU  81          HD23      LEU  81  -3.485  -4.919   7.429

  No H/Q in entry =          11
  In of MODEL   74
    1    H    MET  82           H        MET  82  -0.207  -4.168   3.187
    2    HA   MET  82           HA       MET  82   1.907  -3.311   4.851
    3    HB2  MET  82           HB2      MET  82   1.654  -3.637   1.861
    4    HB3  MET  82           HB3      MET  82   3.153  -3.091   2.610
    5    HG2  MET  82           HG2      MET  82   1.716  -5.663   3.339
    6    HG3  MET  82           HG3      MET  82   3.077  -5.569   2.224
    7    HE3  MET  82           HE1      MET  82   6.125  -4.885   4.177
    8    HE2  MET  82           HE2      MET  82   5.215  -3.502   3.575
    9    HE1  MET  82           HE3      MET  82   5.271  -4.989   2.633

  No H/Q in entry =           9
  In of MODEL   74
    1    H    THR  83           H        THR  83   0.082  -1.632   2.322
    2    HA   THR  83           HA       THR  83   1.531   0.795   2.402
    3    HB   THR  83           HB       THR  83  -0.642   1.756   1.444
    4    HG1  THR  83           HG1      THR  83  -2.313   0.484   1.350
    5   HG22  THR  83          HG21      THR  83  -0.421  -0.057  -0.567
    6   HG21  THR  83          HG22      THR  83   1.084  -0.375   0.292
    7   HG23  THR  83          HG23      THR  83   0.741   1.245  -0.312

  No H/Q in entry =           7
  In of MODEL   74
    1    H    SER  84           H        SER  84  -1.473  -0.199   4.033
    2    HA   SER  84           HA       SER  84  -1.917   2.233   5.392
    3    HB2  SER  84           HB2      SER  84  -2.786  -0.594   5.955
    4    HB3  SER  84           HB3      SER  84  -3.248   0.750   6.999
    5    HG   SER  84           HG       SER  84  -3.742   0.454   4.210

  No H/Q in entry =           5
  In of MODEL   74
    1    H    MET  85           H        MET  85  -0.239  -0.729   6.491
    2    HA   MET  85           HA       MET  85   0.323   0.179   9.093
    3    HB2  MET  85           HB2      MET  85   0.572  -2.167   8.399
    4    HB3  MET  85           HB3      MET  85   1.954  -1.719   7.397
    5    HG2  MET  85           HG2      MET  85   3.149  -0.905   9.397
    6    HG3  MET  85           HG3      MET  85   1.764  -1.334  10.401
    7    HE1  MET  85           HE1      MET  85   4.985  -2.319   8.868
    8    HE3  MET  85           HE2      MET  85   4.010  -2.927   7.532
    9    HE2  MET  85           HE3      MET  85   4.914  -4.054   8.538

  No H/Q in entry =           9
  In of MODEL   74
    1    H    LEU  86           H        LEU  86   2.229   0.417   6.121
    2    HA   LEU  86           HA       LEU  86   4.476   1.688   7.257
    3    HB2  LEU  86           HB2      LEU  86   4.242   0.618   4.946
    4    HB3  LEU  86           HB3      LEU  86   3.451   2.114   4.449
    5    HG   LEU  86           HG       LEU  86   5.509   3.325   5.411
    6   HD11  LEU  86          HD11      LEU  86   6.182   0.699   6.193
    7   HD13  LEU  86          HD12      LEU  86   7.210   2.128   6.284
    8   HD12  LEU  86          HD13      LEU  86   7.286   1.084   4.868
    9   HD23  LEU  86          HD21      LEU  86   6.172   1.560   3.046
   10   HD22  LEU  86          HD22      LEU  86   6.595   3.250   3.310
   11   HD21  LEU  86          HD23      LEU  86   4.931   2.809   2.928

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ALA  87           H        ALA  87   1.565   2.983   5.710
    2    HA   ALA  87           HA       ALA  87   2.203   5.703   5.797
    3    HB1  ALA  87           HB1      ALA  87  -0.137   4.114   5.276
    4    HB3  ALA  87           HB2      ALA  87   0.194   5.771   4.779
    5    HB2  ALA  87           HB3      ALA  87  -0.587   5.456   6.330

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ARG  88           H        ARG  88   0.509   3.719   8.199
    2    HA   ARG  88           HA       ARG  88   0.050   5.769  10.059
    3    HB2  ARG  88           HB2      ARG  88  -0.924   3.431  10.127
    4    HB3  ARG  88           HB3      ARG  88   0.616   2.904  10.814
    5    HG2  ARG  88           HG2      ARG  88   0.191   4.980  12.447
    6    HG3  ARG  88           HG3      ARG  88  -1.486   4.682  12.008
    7    HD2  ARG  88           HD2      ARG  88  -1.608   2.830  13.249
    8    HD3  ARG  88           HD3      ARG  88  -0.034   2.226  12.698
    9    HE   ARG  88           HE       ARG  88  -0.520   3.488  15.162
   10   HH21  ARG  88          HH11      ARG  88   1.067   4.471  16.387
   11   HH22  ARG  88          HH12      ARG  88   2.585   4.877  15.667
   12   HH11  ARG  88          HH21      ARG  88   1.734   3.644  12.561
   13   HH12  ARG  88          HH22      ARG  88   2.970   4.392  13.512

  No H/Q in entry =          13
  In of MODEL   74
    1    H    GLU  89           H        GLU  89   2.809   3.508   9.796
    2    HA   GLU  89           HA       GLU  89   4.111   4.368  12.129
    3    HB2  GLU  89           HB2      GLU  89   4.723   2.345  10.770
    4    HB3  GLU  89           HB3      GLU  89   5.503   3.432   9.619
    5    HG2  GLU  89           HG2      GLU  89   7.020   4.249  11.349
    6    HG3  GLU  89           HG3      GLU  89   6.184   3.301  12.575

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LEU  90           H        LEU  90   4.408   5.534   8.802
    2    HA   LEU  90           HA       LEU  90   6.375   7.503   9.373
    3    HB2  LEU  90           HB2      LEU  90   4.339   7.210   7.167
    4    HB3  LEU  90           HB3      LEU  90   5.589   8.462   7.179
    5    HG   LEU  90           HG       LEU  90   6.222   5.514   7.494
    6   HD12  LEU  90          HD11      LEU  90   6.947   5.745   5.047
    7   HD11  LEU  90          HD12      LEU  90   5.952   7.201   5.015
    8   HD13  LEU  90          HD13      LEU  90   5.213   5.638   5.361
    9   HD22  LEU  90          HD21      LEU  90   8.144   6.633   8.159
   10   HD21  LEU  90          HD22      LEU  90   7.804   8.047   7.161
   11   HD23  LEU  90          HD23      LEU  90   8.433   6.575   6.422

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  91           H        ILE  91   2.835   7.571   9.263
    2    HA   ILE  91           HA       ILE  91   2.538  10.347   9.728
    3    HB   ILE  91           HB       ILE  91   0.719   7.995  10.282
    4   HG12  ILE  91          HG12      ILE  91   0.482  10.287   8.308
    5   HG13  ILE  91          HG13      ILE  91   1.316   8.782   7.921
    6   HG22  ILE  91          HG21      ILE  91  -0.983  10.078  10.372
    7   HG21  ILE  91          HG22      ILE  91   0.438  10.886  11.032
    8   HG23  ILE  91          HG23      ILE  91  -0.211   9.455  11.830
    9   HD13  ILE  91          HD11      ILE  91  -0.646   7.523   7.983
   10   HD12  ILE  91          HD12      ILE  91  -1.221   9.048   7.313
   11   HD11  ILE  91          HD13      ILE  91  -1.479   8.682   9.019

  No H/Q in entry =          11
  In of MODEL   74
    1    H    THR  92           H        THR  92   2.926   7.592  11.915
    2    HA   THR  92           HA       THR  92   2.529   8.963  14.348
    3    HB   THR  92           HB       THR  92   4.297   6.605  13.655
    4    HG1  THR  92           HG1      THR  92   2.317   5.876  13.574
    5   HG22  THR  92          HG21      THR  92   3.939   6.317  16.292
    6   HG21  THR  92          HG22      THR  92   3.898   8.077  16.225
    7   HG23  THR  92          HG23      THR  92   5.312   7.203  15.634

  No H/Q in entry =           7
  In of MODEL   74
    1    H    GLU  93           H        GLU  93   5.452   8.480  12.381
    2    HA   GLU  93           HA       GLU  93   7.244   9.876  14.063
    3    HB2  GLU  93           HB2      GLU  93   7.295   9.571  11.046
    4    HB3  GLU  93           HB3      GLU  93   8.654  10.079  12.047
    5    HG2  GLU  93           HG2      GLU  93   7.213   7.460  12.502
    6    HG3  GLU  93           HG3      GLU  93   8.587   7.597  11.411

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LEU  94           H        LEU  94   5.180  10.928  11.376
    2    HA   LEU  94           HA       LEU  94   6.020  13.621  11.276
    3    HB2  LEU  94           HB2      LEU  94   3.404  12.294  10.546
    4    HB3  LEU  94           HB3      LEU  94   3.683  14.018  10.307
    5    HG   LEU  94           HG       LEU  94   5.662  12.007   9.229
    6   HD11  LEU  94          HD11      LEU  94   2.916  12.598   8.198
    7   HD13  LEU  94          HD12      LEU  94   3.879  11.129   8.057
    8   HD12  LEU  94          HD13      LEU  94   4.221  12.508   7.013
    9   HD23  LEU  94          HD21      LEU  94   5.918  13.846   7.509
   10   HD22  LEU  94          HD22      LEU  94   6.357  14.328   9.148
   11   HD21  LEU  94          HD23      LEU  94   4.805  14.818   8.468

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  95           H        ILE  95   3.482  12.032  13.189
    2    HA   ILE  95           HA       ILE  95   2.483  14.391  14.403
    3    HB   ILE  95           HB       ILE  95   2.472  11.506  15.318
    4   HG12  ILE  95          HG12      ILE  95   0.264  13.311  14.299
    5   HG13  ILE  95          HG13      ILE  95   1.196  12.243  13.253
    6   HG21  ILE  95          HG21      ILE  95   1.235  13.991  16.542
    7   HG23  ILE  95          HG22      ILE  95   2.277  12.806  17.331
    8   HG22  ILE  95          HG23      ILE  95   0.631  12.367  16.872
    9   HD13  ILE  95          HD11      ILE  95   0.278  10.314  14.176
   10   HD12  ILE  95          HD12      ILE  95  -1.090  11.420  14.270
   11   HD11  ILE  95          HD13      ILE  95  -0.113  11.105  15.704

  No H/Q in entry =          11
  In of MODEL   74
    1    H    GLU  96           H        GLU  96   5.060  12.136  15.364
    2    HA   GLU  96           HA       GLU  96   5.657  13.319  17.853
    3    HB2  GLU  96           HB2      GLU  96   6.571  11.151  17.189
    4    HB3  GLU  96           HB3      GLU  96   7.500  11.916  15.901
    5    HG2  GLU  96           HG2      GLU  96   9.171  12.440  17.348
    6    HG3  GLU  96           HG3      GLU  96   8.045  13.263  18.418

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LEU  97           H        LEU  97   6.706  14.089  14.558
    2    HA   LEU  97           HA       LEU  97   8.624  16.059  15.257
    3    HB2  LEU  97           HB2      LEU  97   6.999  15.538  12.777
    4    HB3  LEU  97           HB3      LEU  97   8.037  16.956  12.892
    5    HG   LEU  97           HG       LEU  97   9.038  14.145  13.432
    6   HD12  LEU  97          HD11      LEU  97  10.012  14.334  11.105
    7   HD11  LEU  97          HD12      LEU  97   8.975  15.738  10.857
    8   HD13  LEU  97          HD13      LEU  97   8.260  14.154  11.154
    9   HD23  LEU  97          HD21      LEU  97  11.214  15.400  12.670
   10   HD22  LEU  97          HD22      LEU  97  10.616  15.671  14.307
   11   HD21  LEU  97          HD23      LEU  97  10.303  16.862  13.046

  No H/Q in entry =          11
  In of MODEL   74
    1    H    HIS  98           H        HIS  98   5.127  16.239  14.640
    2    HA   HIS  98           HA       HIS  98   4.863  19.041  14.787
    3    HB2  HIS  98           HB2      HIS  98   2.954  16.811  15.526
    4    HB3  HIS  98           HB3      HIS  98   2.508  18.516  15.592
    5    HD1  HIS  98           HD1      HIS  98   3.471  15.797  13.168
    6    HD2  HIS  98           HD2      HIS  98   2.141  19.747  13.073
    7    HE1  HIS  98           HE1      HIS  98   2.892  16.301  10.751
    8    HE2  HIS  98           HE2      HIS  98   2.085  18.700  10.672

  No H/Q in entry =           8
  In of MODEL   74
    1    H    GLU  99           H        GLU  99   4.993  16.543  17.277
    2    HA   GLU  99           HA       GLU  99   4.428  18.237  19.486
    3    HB2  GLU  99           HB2      GLU  99   4.311  15.756  19.576
    4    HB3  GLU  99           HB3      GLU  99   6.069  15.691  19.449
    5    HG2  GLU  99           HG2      GLU  99   6.295  16.974  21.525
    6    HG3  GLU  99           HG3      GLU  99   4.545  17.135  21.640

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LYS 100           H        LYS 100   7.454  17.276  17.886
    2    HA   LYS 100           HA       LYS 100   9.145  18.651  19.729
    3    HB2  LYS 100           HB2      LYS 100   9.603  17.730  16.883
    4    HB3  LYS 100           HB3      LYS 100  10.852  18.482  17.880
    5    HG2  LYS 100           HG2      LYS 100  10.474  16.730  19.619
    6    HG3  LYS 100           HG3      LYS 100   9.321  15.943  18.538
    7    HD2  LYS 100           HD2      LYS 100  11.094  15.645  16.851
    8    HD3  LYS 100           HD3      LYS 100  12.251  16.444  17.917
    9    HE2  LYS 100           HE2      LYS 100  11.853  14.687  19.634
   10    HE3  LYS 100           HE3      LYS 100  10.756  13.868  18.517
   11    HZ1  LYS 100           HZ1      LYS 100  13.577  14.507  17.834
   12    HZ3  LYS 100           HZ2      LYS 100  12.512  13.467  17.014
   13    HZ2  LYS 100           HZ3      LYS 100  13.112  13.036  18.545

  No H/Q in entry =          13
  In of MODEL   74
    1    H    LEU 101           H        LEU 101   7.431  19.607  16.795
    2    HA   LEU 101           HA       LEU 101   8.672  22.151  16.456
    3    HB2  LEU 101           HB2      LEU 101   6.053  20.951  15.592
    4    HB3  LEU 101           HB3      LEU 101   6.322  22.680  15.388
    5    HG   LEU 101           HG       LEU 101   8.323  20.643  14.394
    6   HD12  LEU 101          HD11      LEU 101   7.152  21.170  12.123
    7   HD11  LEU 101          HD12      LEU 101   5.768  21.613  13.120
    8   HD13  LEU 101          HD13      LEU 101   6.414  19.975  13.189
    9   HD21  LEU 101          HD21      LEU 101   7.724  23.564  13.855
   10   HD23  LEU 101          HD22      LEU 101   8.682  22.596  12.734
   11   HD22  LEU 101          HD23      LEU 101   9.244  22.842  14.387

  No H/Q in entry =          11
  In of MODEL   74
    1    H    LYS 102           H        LYS 102   7.149  21.023  19.084
    2    HA   LYS 102           HA       LYS 102   6.550  22.115  21.026
    3    HB2  LYS 102           HB2      LYS 102   7.845  24.094  19.895
    4    HB3  LYS 102           HB3      LYS 102   6.249  24.719  19.538
    5    HG2  LYS 102           HG2      LYS 102   7.651  24.437  22.174
    6    HG3  LYS 102           HG3      LYS 102   6.708  25.779  21.560
    7    HD2  LYS 102           HD2      LYS 102   5.442  23.155  22.443
    8    HD3  LYS 102           HD3      LYS 102   5.718  24.509  23.528
    9    HE2  LYS 102           HE2      LYS 102   3.419  24.139  22.063
   10    HE3  LYS 102           HE3      LYS 102   3.948  25.676  22.745
   11    HZ2  LYS 102           HZ1      LYS 102   3.393  25.799  20.371
   12    HZ1  LYS 102           HZ2      LYS 102   4.638  24.703  20.031
   13    HZ3  LYS 102           HZ3      LYS 102   5.006  26.227  20.675

  No H/Q in entry =          13
  In of MODEL   74
    1    H    ALA 103           H        ALA 103   4.902  23.687  18.282
    2    HA   ALA 103           HA       ALA 103   2.464  24.290  19.195
    3    HB1  ALA 103           HB1      ALA 103   1.532  23.467  16.959
    4    HB2  ALA 103           HB2      ALA 103   3.169  22.912  16.610
    5    HB3  ALA 103           HB3      ALA 103   2.858  24.627  16.886

  No H/Q in entry =           5
  In of MODEL   74
    1    H1   ALA   1           H3       ALA   1  10.248 -20.222  -6.321
    2    H2   ALA   1           H2       ALA   1   9.266 -20.411  -7.697
    3    H3   ALA   1           H1       ALA   1   8.835 -21.157  -6.231
    4    HA   ALA   1           HA       ALA   1   9.843 -22.977  -6.988
    5    HB1  ALA   1           HB1      ALA   1   9.919 -22.610  -9.264
    6    HB2  ALA   1           HB2      ALA   1  11.651 -22.483  -8.953
    7    HB3  ALA   1           HB3      ALA   1  10.670 -21.023  -9.088

  No H/Q in entry =           7
  In of MODEL   74
    1    H    GLU   2           H        GLU   2  12.114 -23.956  -7.074
    2    HA   GLU   2           HA       GLU   2  13.520 -23.900  -4.878
    3    HB2  GLU   2           HB2      GLU   2  14.849 -23.776  -7.591
    4    HB3  GLU   2           HB3      GLU   2  15.585 -24.402  -6.116
    5    HG2  GLU   2           HG2      GLU   2  14.539 -26.405  -6.353
    6    HG3  GLU   2           HG3      GLU   2  12.975 -25.638  -6.592

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLU   3           H        GLU   3  15.289 -22.050  -7.292
    2    HA   GLU   3           HA       GLU   3  16.486 -20.385  -5.339
    3    HB2  GLU   3           HB2      GLU   3  16.397 -20.371  -8.349
    4    HB3  GLU   3           HB3      GLU   3  17.170 -19.055  -7.465
    5    HG2  GLU   3           HG2      GLU   3  18.824 -20.454  -6.566
    6    HG3  GLU   3           HG3      GLU   3  17.856 -21.908  -6.781

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LEU   4           H        LEU   4  14.186 -19.498  -7.942
    2    HA   LEU   4           HA       LEU   4  13.761 -16.886  -7.316
    3    HB2  LEU   4           HB2      LEU   4  11.552 -18.829  -8.029
    4    HB3  LEU   4           HB3      LEU   4  11.498 -17.078  -8.221
    5    HG   LEU   4           HG       LEU   4  13.422 -18.962  -9.622
    6   HD13  LEU   4          HD11      LEU   4  12.102 -18.789 -11.517
    7   HD12  LEU   4          HD12      LEU   4  11.419 -17.237 -11.037
    8   HD11  LEU   4          HD13      LEU   4  10.855 -18.723 -10.274
    9   HD23  LEU   4          HD21      LEU   4  13.773 -16.717 -10.970
   10   HD22  LEU   4          HD22      LEU   4  14.647 -16.976  -9.461
   11   HD21  LEU   4          HD23      LEU   4  13.207 -15.961  -9.480

  No H/Q in entry =          11
  In of MODEL   74
    1    H    GLU   5           H        GLU   5  12.258 -19.656  -5.668
    2    HA   GLU   5           HA       GLU   5  10.620 -18.069  -3.941
    3    HB2  GLU   5           HB2      GLU   5  10.155 -20.438  -4.464
    4    HB3  GLU   5           HB3      GLU   5  11.596 -20.898  -3.554
    5    HG2  GLU   5           HG2      GLU   5  10.668 -19.860  -1.530
    6    HG3  GLU   5           HG3      GLU   5   9.236 -19.366  -2.432

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLU   6           H        GLU   6  13.750 -19.691  -3.538
    2    HA   GLU   6           HA       GLU   6  14.144 -18.849  -0.841
    3    HB2  GLU   6           HB2      GLU   6  15.333 -20.776  -1.862
    4    HB3  GLU   6           HB3      GLU   6  16.205 -19.656  -2.909
    5    HG2  GLU   6           HG2      GLU   6  17.171 -18.540  -0.954
    6    HG3  GLU   6           HG3      GLU   6  16.258 -19.597   0.122

  No H/Q in entry =           6
  In of MODEL   74
    1    H    VAL   7           H        VAL   7  14.892 -17.521  -3.995
    2    HA   VAL   7           HA       VAL   7  16.614 -15.419  -3.141
    3    HB   VAL   7           HB       VAL   7  14.877 -15.752  -5.601
    4   HG11  VAL   7          HG11      VAL   7  16.807 -13.566  -4.802
    5   HG13  VAL   7          HG12      VAL   7  15.160 -13.400  -5.407
    6   HG12  VAL   7          HG13      VAL   7  16.450 -13.915  -6.493
    7   HG21  VAL   7          HG21      VAL   7  16.971 -17.237  -5.061
    8   HG23  VAL   7          HG22      VAL   7  17.890 -15.786  -5.464
    9   HG22  VAL   7          HG23      VAL   7  16.831 -16.518  -6.666

  No H/Q in entry =           9
  In of MODEL   74
    1    H    VAL   8           H        VAL   8  13.113 -15.643  -3.660
    2    HA   VAL   8           HA       VAL   8  12.486 -12.928  -3.172
    3    HB   VAL   8           HB       VAL   8  10.874 -15.461  -2.797
    4   HG12  VAL   8          HG11      VAL   8   8.918 -13.794  -2.748
    5   HG11  VAL   8          HG12      VAL   8  10.124 -12.559  -2.384
    6   HG13  VAL   8          HG13      VAL   8   9.890 -13.915  -1.281
    7   HG21  VAL   8          HG21      VAL   8  11.633 -14.476  -5.141
    8   HG23  VAL   8          HG22      VAL   8  10.375 -13.286  -4.829
    9   HG22  VAL   8          HG23      VAL   8   9.963 -14.994  -4.926

  No H/Q in entry =           9
  In of MODEL   74
    1    H    MET   9           H        MET   9  12.742 -15.745  -1.005
    2    HA   MET   9           HA       MET   9  11.969 -14.472   1.379
    3    HB2  MET   9           HB2      MET   9  13.847 -16.765   0.813
    4    HB3  MET   9           HB3      MET   9  13.559 -16.190   2.456
    5    HG2  MET   9           HG2      MET   9  11.140 -16.563   2.173
    6    HG3  MET   9           HG3      MET   9  11.418 -17.124   0.523
    7    HE2  MET   9           HE1      MET   9  11.041 -18.359   4.215
    8    HE1  MET   9           HE2      MET   9  12.488 -17.363   4.085
    9    HE3  MET   9           HE3      MET   9  12.637 -19.077   4.467

  No H/Q in entry =           9
  In of MODEL   74
    1    H    GLY  10           H        GLY  10  15.130 -14.729  -0.213
    2    HA3  GLY  10           HA2      GLY  10  16.627 -13.333   1.745
    3    HA2  GLY  10           HA3      GLY  10  17.070 -13.497   0.046

  No H/Q in entry =           3
  In of MODEL   74
    1    H    LEU  11           H        LEU  11  14.902 -12.246  -1.165
    2    HA   LEU  11           HA       LEU  11  15.621  -9.510  -1.000
    3    HB2  LEU  11           HB2      LEU  11  13.224 -10.888  -2.214
    4    HB3  LEU  11           HB3      LEU  11  13.523  -9.156  -2.370
    5    HG   LEU  11           HG       LEU  11  15.517 -11.285  -3.188
    6   HD13  LEU  11          HD11      LEU  11  13.750 -11.626  -4.690
    7   HD12  LEU  11          HD12      LEU  11  14.757 -10.454  -5.537
    8   HD11  LEU  11          HD13      LEU  11  13.299  -9.921  -4.701
    9   HD22  LEU  11          HD21      LEU  11  16.773  -9.337  -2.969
   10   HD21  LEU  11          HD22      LEU  11  15.406  -8.283  -3.329
   11   HD23  LEU  11          HD23      LEU  11  16.213  -9.156  -4.630

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  12           H        ILE  12  12.846 -11.309   0.292
    2    HA   ILE  12           HA       ILE  12  11.489  -9.073   1.374
    3    HB   ILE  12           HB       ILE  12  11.504 -11.959   2.314
    4   HG12  ILE  12          HG12      ILE  12  10.797 -11.305  -0.126
    5   HG13  ILE  12          HG13      ILE  12   9.775 -12.394   0.791
    6   HG23  ILE  12          HG21      ILE  12  10.584 -10.580   4.069
    7   HG22  ILE  12          HG22      ILE  12   9.225 -11.339   3.241
    8   HG21  ILE  12          HG23      ILE  12   9.629  -9.654   2.913
    9   HD12  ILE  12          HD11      ILE  12   8.531 -10.587  -0.416
   10   HD11  ILE  12          HD12      ILE  12   9.367  -9.401   0.584
   11   HD13  ILE  12          HD13      ILE  12   8.279 -10.558   1.321

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  13           H        ILE  13  13.873 -11.309   2.746
    2    HA   ILE  13           HA       ILE  13  13.950 -10.140   5.330
    3    HB   ILE  13           HB       ILE  13  15.976 -11.728   3.736
    4   HG12  ILE  13          HG12      ILE  13  13.710 -12.689   4.576
    5   HG13  ILE  13          HG13      ILE  13  15.179 -13.613   4.873
    6   HG23  ILE  13          HG21      ILE  13  17.397 -10.654   5.245
    7   HG22  ILE  13          HG22      ILE  13  16.961 -12.098   6.148
    8   HG21  ILE  13          HG23      ILE  13  16.171 -10.562   6.507
    9   HD12  ILE  13          HD11      ILE  13  13.405 -13.105   6.836
   10   HD11  ILE  13          HD12      ILE  13  14.369 -11.638   6.955
   11   HD13  ILE  13          HD13      ILE  13  15.137 -13.209   7.145

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ASN  14           H        ASN  14  15.877  -9.618   2.392
    2    HA   ASN  14           HA       ASN  14  17.652  -7.698   3.441
    3    HB2  ASN  14           HB2      ASN  14  17.592  -8.955   1.122
    4    HB3  ASN  14           HB3      ASN  14  16.707  -7.528   0.599
    5   HD21  ASN  14          HD21      ASN  14  19.131  -7.887  -0.614
    6   HD22  ASN  14          HD22      ASN  14  20.291  -6.817   0.005

  No H/Q in entry =           6
  In of MODEL   74
    1    H    SER  15           H        SER  15  14.526  -7.315   1.784
    2    HA   SER  15           HA       SER  15  14.441  -4.494   1.851
    3    HB2  SER  15           HB2      SER  15  12.104  -4.716   1.375
    4    HB3  SER  15           HB3      SER  15  12.877  -6.092   0.598
    5    HG   SER  15           HG       SER  15  11.418  -5.997   3.014

  No H/Q in entry =           5
  In of MODEL   74
    1    H    GLY  16           H        GLY  16  13.350  -6.952   4.158
    2    HA3  GLY  16           HA2      GLY  16  12.165  -5.198   6.035
    3    HA2  GLY  16           HA3      GLY  16  12.769  -6.813   6.385

  No H/Q in entry =           3
  In of MODEL   74
    1    H    GLN  17           H        GLN  17  15.476  -6.503   5.764
    2    HA   GLN  17           HA       GLN  17  16.469  -5.299   8.139
    3    HB2  GLN  17           HB2      GLN  17  17.659  -7.101   6.902
    4    HB3  GLN  17           HB3      GLN  17  17.989  -5.960   5.598
    5    HG2  GLN  17           HG2      GLN  17  19.929  -6.088   7.075
    6    HG3  GLN  17           HG3      GLN  17  19.184  -4.498   7.220
    7   HE21  GLN  17          HE21      GLN  17  19.922  -7.459   8.942
    8   HE22  GLN  17          HE22      GLN  17  19.297  -6.967  10.440

  No H/Q in entry =           8
  In of MODEL   74
    1    H    ALA  18           H        ALA  18  16.254  -4.207   4.785
    2    HA   ALA  18           HA       ALA  18  17.713  -1.828   5.005
    3    HB2  ALA  18           HB1      ALA  18  16.563  -3.026   2.945
    4    HB3  ALA  18           HB2      ALA  18  16.842  -1.285   2.933
    5    HB1  ALA  18           HB3      ALA  18  15.241  -1.918   3.317

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ARG  19           H        ARG  19  14.213  -2.387   5.437
    2    HA   ARG  19           HA       ARG  19  13.575   0.266   6.168
    3    HB2  ARG  19           HB2      ARG  19  11.873  -1.469   5.593
    4    HB3  ARG  19           HB3      ARG  19  12.224  -2.276   7.123
    5    HG2  ARG  19           HG2      ARG  19  11.544  -0.283   8.377
    6    HG3  ARG  19           HG3      ARG  19  11.285   0.601   6.874
    7    HD2  ARG  19           HD2      ARG  19   9.146  -0.180   7.714
    8    HD3  ARG  19           HD3      ARG  19   9.542  -1.058   6.231
    9    HE   ARG  19           HE       ARG  19  10.509  -2.616   8.320
   10   HH21  ARG  19          HH11      ARG  19   9.256  -4.249   9.267
   11   HH22  ARG  19          HH12      ARG  19   7.535  -4.206   9.114
   12   HH11  ARG  19          HH21      ARG  19   7.515  -1.294   7.261
   13   HH12  ARG  19          HH22      ARG  19   6.549  -2.534   7.974

  No H/Q in entry =          13
  In of MODEL   74
    1    H    SER  20           H        SER  20  14.429  -2.579   8.108
    2    HA   SER  20           HA       SER  20  14.182  -1.486  10.652
    3    HB2  SER  20           HB2      SER  20  14.627  -3.813  10.521
    4    HB3  SER  20           HB3      SER  20  16.068  -3.561   9.539
    5    HG   SER  20           HG       SER  20  15.687  -2.799  12.251

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LEU  21           H        LEU  21  17.003  -1.441   8.486
    2    HA   LEU  21           HA       LEU  21  18.708   0.025  10.212
    3    HB2  LEU  21           HB2      LEU  21  18.653  -0.239   7.199
    4    HB3  LEU  21           HB3      LEU  21  19.923   0.612   8.075
    5    HG   LEU  21           HG       LEU  21  19.169  -2.277   8.610
    6   HD13  LEU  21          HD11      LEU  21  20.004  -2.166   6.349
    7   HD12  LEU  21          HD12      LEU  21  21.313  -2.769   7.363
    8   HD11  LEU  21          HD13      LEU  21  21.315  -1.089   6.831
    9   HD21  LEU  21          HD21      LEU  21  21.298  -0.394   9.605
   10   HD23  LEU  21          HD22      LEU  21  21.677  -2.109   9.497
   11   HD22  LEU  21          HD23      LEU  21  20.354  -1.568  10.517

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ALA  22           H        ALA  22  16.426   1.022   7.683
    2    HA   ALA  22           HA       ALA  22  16.989   3.776   7.701
    3    HB3  ALA  22           HB1      ALA  22  15.558   2.551   6.033
    4    HB2  ALA  22           HB2      ALA  22  14.870   4.068   6.613
    5    HB1  ALA  22           HB3      ALA  22  14.273   2.532   7.241

  No H/Q in entry =           5
  In of MODEL   74
    1    H    TYR  23           H        TYR  23  14.495   1.975   9.556
    2    HA   TYR  23           HA       TYR  23  13.567   4.215  11.023
    3    HB2  TYR  23           HB2      TYR  23  12.311   2.114  11.009
    4    HB3  TYR  23           HB3      TYR  23  13.646   1.286  11.812
    5    HD1  TYR  23           HD1      TYR  23  11.165   4.041  12.223
    6    HD2  TYR  23           HD2      TYR  23  13.882   1.342  14.167
    7    HE1  TYR  23           HE1      TYR  23  10.271   4.731  14.434
    8    HE2  TYR  23           HE2      TYR  23  12.988   2.030  16.375
    9    HH   TYR  23           HH       TYR  23  10.421   4.496  16.630

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ALA  24           H        ALA  24  16.199   1.914  11.624
    2    HA   ALA  24           HA       ALA  24  16.904   2.894  14.184
    3    HB1  ALA  24           HB1      ALA  24  18.243   1.089  13.999
    4    HB3  ALA  24           HB2      ALA  24  19.267   2.005  12.893
    5    HB2  ALA  24           HB3      ALA  24  17.957   1.011  12.261

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ALA  25           H        ALA  25  17.835   3.826  10.899
    2    HA   ALA  25           HA       ALA  25  19.805   5.740  11.531
    3    HB1  ALA  25           HB1      ALA  25  19.056   4.807   9.220
    4    HB3  ALA  25           HB2      ALA  25  19.574   6.490   9.314
    5    HB2  ALA  25           HB3      ALA  25  17.855   6.099   9.261

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LEU  26           H        LEU  26  16.289   6.003  11.207
    2    HA   LEU  26           HA       LEU  26  16.095   8.785  11.671
    3    HB2  LEU  26           HB2      LEU  26  14.213   7.570  10.757
    4    HB3  LEU  26           HB3      LEU  26  14.127   6.538  12.180
    5    HG   LEU  26           HG       LEU  26  13.554   8.496  13.573
    6   HD12  LEU  26          HD11      LEU  26  12.899  10.608  12.263
    7   HD11  LEU  26          HD12      LEU  26  13.860   9.951  10.941
    8   HD13  LEU  26          HD13      LEU  26  14.624  10.323  12.486
    9   HD21  LEU  26          HD21      LEU  26  11.849   8.208  11.080
   10   HD23  LEU  26          HD22      LEU  26  11.311   8.906  12.605
   11   HD22  LEU  26          HD23      LEU  26  11.746   7.201  12.524

  No H/Q in entry =          11
  In of MODEL   74
    1    H    LYS  27           H        LYS  27  15.983   5.999  13.855
    2    HA   LYS  27           HA       LYS  27  15.428   7.362  16.234
    3    HB2  LYS  27           HB2      LYS  27  15.429   4.887  15.960
    4    HB3  LYS  27           HB3      LYS  27  17.192   4.922  15.898
    5    HG2  LYS  27           HG2      LYS  27  17.275   5.899  18.151
    6    HG3  LYS  27           HG3      LYS  27  15.509   5.935  18.215
    7    HD2  LYS  27           HD2      LYS  27  15.457   3.469  17.969
    8    HD3  LYS  27           HD3      LYS  27  17.221   3.441  17.939
    9    HE2  LYS  27           HE2      LYS  27  17.289   4.421  20.199
   10    HE3  LYS  27           HE3      LYS  27  15.523   4.479  20.232
   11    HZ3  LYS  27           HZ1      LYS  27  16.304   2.515  21.367
   12    HZ2  LYS  27           HZ2      LYS  27  17.201   2.032  20.005
   13    HZ1  LYS  27           HZ3      LYS  27  15.502   2.054  19.943

  No H/Q in entry =          13
  In of MODEL   74
    1    H    GLN  28           H        GLN  28  18.522   6.753  14.607
    2    HA   GLN  28           HA       GLN  28  20.237   7.812  16.584
    3    HB2  GLN  28           HB2      GLN  28  20.496   7.780  13.566
    4    HB3  GLN  28           HB3      GLN  28  21.799   8.225  14.668
    5    HG2  GLN  28           HG2      GLN  28  20.341   5.568  14.708
    6    HG3  GLN  28           HG3      GLN  28  21.918   5.836  13.967
    7   HE21  GLN  28          HE21      GLN  28  20.696   4.487  16.657
    8   HE22  GLN  28          HE22      GLN  28  21.892   4.900  17.788

  No H/Q in entry =           8
  In of MODEL   74
    1    H    ALA  29           H        ALA  29  18.474   9.323  13.916
    2    HA   ALA  29           HA       ALA  29  19.504  11.932  14.168
    3    HB2  ALA  29           HB1      ALA  29  17.797  12.593  12.716
    4    HB1  ALA  29           HB2      ALA  29  16.647  11.430  13.375
    5    HB3  ALA  29           HB3      ALA  29  17.961  10.877  12.336

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LYS  30           H        LYS  30  16.726  10.358  15.712
    2    HA   LYS  30           HA       LYS  30  15.751  12.617  17.088
    3    HB2  LYS  30           HB2      LYS  30  15.613   9.675  17.782
    4    HB3  LYS  30           HB3      LYS  30  14.771  10.932  18.689
    5    HG2  LYS  30           HG2      LYS  30  13.632  11.638  16.585
    6    HG3  LYS  30           HG3      LYS  30  14.413  10.296  15.745
    7    HD2  LYS  30           HD2      LYS  30  13.338   8.695  17.278
    8    HD3  LYS  30           HD3      LYS  30  12.568  10.026  18.142
    9    HE2  LYS  30           HE2      LYS  30  11.385  10.680  16.064
   10    HE3  LYS  30           HE3      LYS  30  12.136   9.321  15.220
   11    HZ2  LYS  30           HZ1      LYS  30   9.832   8.935  16.123
   12    HZ1  LYS  30           HZ2      LYS  30  10.516   8.974  17.683
   13    HZ3  LYS  30           HZ3      LYS  30  10.999   7.787  16.563

  No H/Q in entry =          13
  In of MODEL   74
    1    H    GLN  31           H        GLN  31  18.394  10.414  17.789
    2    HA   GLN  31           HA       GLN  31  18.761  11.415  20.483
    3    HB2  GLN  31           HB2      GLN  31  20.749   9.826  18.852
    4    HB3  GLN  31           HB3      GLN  31  20.634   9.946  20.608
    5    HG2  GLN  31           HG2      GLN  31  18.102   9.026  19.862
    6    HG3  GLN  31           HG3      GLN  31  19.182   8.173  18.767
    7   HE21  GLN  31          HE21      GLN  31  17.650   7.036  21.055
    8   HE22  GLN  31          HE22      GLN  31  18.809   6.358  22.091

  No H/Q in entry =           8
  In of MODEL   74
    1    H    GLY  32           H        GLY  32  19.265  12.737  17.516
    2    HA3  GLY  32           HA2      GLY  32  20.267  14.773  17.000
    3    HA2  GLY  32           HA3      GLY  32  21.041  14.763  18.580

  No H/Q in entry =           3
  In of MODEL   74
    1    H    ASP  33           H        ASP  33  21.411  11.872  16.787
    2    HA   ASP  33           HA       ASP  33  24.239  12.516  16.294
    3    HB2  ASP  33           HB2      ASP  33  22.701   9.918  16.417
    4    HB3  ASP  33           HB3      ASP  33  24.384  10.016  15.905

  No H/Q in entry =           4
  In of MODEL   74
    1    H    PHE  34           H        PHE  34  23.754  13.852  14.423
    2    HA   PHE  34           HA       PHE  34  22.369  12.893  12.146
    3    HB2  PHE  34           HB2      PHE  34  24.527  15.001  12.362
    4    HB3  PHE  34           HB3      PHE  34  23.524  14.728  10.939
    5    HD1  PHE  34           HD1      PHE  34  23.827  16.648  13.858
    6    HD2  PHE  34           HD2      PHE  34  20.901  14.574  11.494
    7    HE1  PHE  34           HE1      PHE  34  22.037  18.062  14.829
    8    HE2  PHE  34           HE2      PHE  34  19.115  15.989  12.468
    9    HZ   PHE  34           HZ       PHE  34  19.686  17.733  14.131

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ALA  35           H        ALA  35  25.752  12.663  13.118
    2    HA   ALA  35           HA       ALA  35  26.822  11.839  10.647
    3    HB3  ALA  35           HB1      ALA  35  28.507  10.644  12.344
    4    HB2  ALA  35           HB2      ALA  35  27.667  11.674  13.503
    5    HB1  ALA  35           HB3      ALA  35  28.498  12.393  12.124

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ALA  36           H        ALA  36  25.713   9.885  13.416
    2    HA   ALA  36           HA       ALA  36  26.157   7.397  12.126
    3    HB2  ALA  36           HB1      ALA  36  25.739   6.647  14.204
    4    HB3  ALA  36           HB2      ALA  36  24.055   7.161  14.073
    5    HB1  ALA  36           HB3      ALA  36  25.275   8.277  14.687

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ALA  37           H        ALA  37  23.360   9.553  12.298
    2    HA   ALA  37           HA       ALA  37  21.473   7.808  11.135
    3    HB3  ALA  37           HB1      ALA  37  21.733  10.767  11.436
    4    HB1  ALA  37           HB2      ALA  37  20.415   9.701  11.918
    5    HB2  ALA  37           HB3      ALA  37  20.591  10.177  10.228

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LYS  38           H        LYS  38  23.582  10.252   9.643
    2    HA   LYS  38           HA       LYS  38  22.911   9.842   6.971
    3    HB2  LYS  38           HB2      LYS  38  24.752  11.374   8.403
    4    HB3  LYS  38           HB3      LYS  38  25.763  10.378   7.363
    5    HG2  LYS  38           HG2      LYS  38  24.586  11.168   5.382
    6    HG3  LYS  38           HG3      LYS  38  23.411  12.032   6.379
    7    HD2  LYS  38           HD2      LYS  38  25.030  13.611   7.120
    8    HD3  LYS  38           HD3      LYS  38  26.374  12.613   6.567
    9    HE2  LYS  38           HE2      LYS  38  26.021  14.493   5.026
   10    HE3  LYS  38           HE3      LYS  38  25.662  12.962   4.220
   11    HZ3  LYS  38           HZ1      LYS  38  23.468  13.430   4.114
   12    HZ2  LYS  38           HZ2      LYS  38  24.008  15.039   4.202
   13    HZ1  LYS  38           HZ3      LYS  38  23.441  14.256   5.597

  No H/Q in entry =          13
  In of MODEL   74
    1    H    ALA  39           H        ALA  39  25.429   8.211   8.895
    2    HA   ALA  39           HA       ALA  39  26.460   6.620   6.808
    3    HB2  ALA  39           HB1      ALA  39  26.392   5.647   9.649
    4    HB1  ALA  39           HB2      ALA  39  27.354   7.064   9.228
    5    HB3  ALA  39           HB3      ALA  39  27.682   5.513   8.455

  No H/Q in entry =           5
  In of MODEL   74
    1    H    MET  40           H        MET  40  23.865   6.021   9.131
    2    HA   MET  40           HA       MET  40  23.388   3.323   8.392
    3    HB2  MET  40           HB2      MET  40  21.605   5.380   9.711
    4    HB3  MET  40           HB3      MET  40  21.180   3.675   9.534
    5    HG2  MET  40           HG2      MET  40  23.753   4.586  10.851
    6    HG3  MET  40           HG3      MET  40  22.265   4.322  11.759
    7    HE3  MET  40           HE1      MET  40  21.668   0.693  11.927
    8    HE2  MET  40           HE2      MET  40  20.804   2.007  11.134
    9    HE1  MET  40           HE3      MET  40  21.564   2.282  12.700

  No H/Q in entry =           9
  In of MODEL   74
    1    H    MET  41           H        MET  41  21.991   6.395   7.231
    2    HA   MET  41           HA       MET  41  20.006   5.225   5.575
    3    HB2  MET  41           HB2      MET  41  21.506   7.803   5.056
    4    HB3  MET  41           HB3      MET  41  19.966   7.326   4.352
    5    HG2  MET  41           HG2      MET  41  19.245   7.135   6.910
    6    HG3  MET  41           HG3      MET  41  20.567   8.279   7.122
    7    HE2  MET  41           HE1      MET  41  19.981   9.585   3.797
    8    HE1  MET  41           HE2      MET  41  20.957  10.010   5.200
    9    HE3  MET  41           HE3      MET  41  19.689  11.104   4.653

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ASP  42           H        ASP  42  23.381   6.118   4.990
    2    HA   ASP  42           HA       ASP  42  23.439   5.654   2.230
    3    HB2  ASP  42           HB2      ASP  42  25.218   6.628   3.984
    4    HB3  ASP  42           HB3      ASP  42  25.859   4.997   3.843

  No H/Q in entry =           4
  In of MODEL   74
    1    H    GLN  43           H        GLN  43  24.172   3.482   4.934
    2    HA   GLN  43           HA       GLN  43  24.798   1.224   3.336
    3    HB2  GLN  43           HB2      GLN  43  23.807   1.406   6.191
    4    HB3  GLN  43           HB3      GLN  43  24.364  -0.085   5.424
    5    HG2  GLN  43           HG2      GLN  43  26.533   1.108   4.895
    6    HG3  GLN  43           HG3      GLN  43  25.973   2.436   5.906
    7   HE21  GLN  43          HE21      GLN  43  28.208   1.438   6.915
    8   HE22  GLN  43          HE22      GLN  43  27.937   0.353   8.190

  No H/Q in entry =           8
  In of MODEL   74
    1    H    SER  44           H        SER  44  21.768   2.381   4.758
    2    HA   SER  44           HA       SER  44  20.171   0.155   4.093
    3    HB2  SER  44           HB2      SER  44  19.765   2.683   5.253
    4    HB3  SER  44           HB3      SER  44  18.716   2.656   3.839
    5    HG   SER  44           HG       SER  44  17.631   1.716   5.569

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ARG  45           H        ARG  45  20.923   3.120   2.292
    2    HA   ARG  45           HA       ARG  45  19.369   2.657   0.001
    3    HB2  ARG  45           HB2      ARG  45  20.539   4.780   0.582
    4    HB3  ARG  45           HB3      ARG  45  22.072   4.012   0.177
    5    HG2  ARG  45           HG2      ARG  45  21.260   3.623  -2.131
    6    HG3  ARG  45           HG3      ARG  45  19.739   4.414  -1.725
    7    HD2  ARG  45           HD2      ARG  45  21.016   6.496  -1.146
    8    HD3  ARG  45           HD3      ARG  45  22.499   5.710  -1.733
    9    HE   ARG  45           HE       ARG  45  20.545   5.499  -3.750
   10   HH21  ARG  45          HH11      ARG  45  20.532   6.875  -5.508
   11   HH22  ARG  45          HH12      ARG  45  21.305   8.417  -5.405
   12   HH11  ARG  45          HH21      ARG  45  22.316   7.974  -2.132
   13   HH12  ARG  45          HH22      ARG  45  22.314   9.039  -3.491

  No H/Q in entry =          13
  In of MODEL   74
    1    H    MET  46           H        MET  46  22.732   1.747   0.709
    2    HA   MET  46           HA       MET  46  23.299   0.558  -1.785
    3    HB2  MET  46           HB2      MET  46  24.434   0.217   0.990
    4    HB3  MET  46           HB3      MET  46  25.063  -0.687  -0.391
    5    HG2  MET  46           HG2      MET  46  25.515   1.414  -1.583
    6    HG3  MET  46           HG3      MET  46  24.842   2.335  -0.245
    7    HE1  MET  46           HE1      MET  46  27.122  -0.210  -1.439
    8    HE3  MET  46           HE2      MET  46  27.659  -0.873   0.100
    9    HE2  MET  46           HE3      MET  46  28.722   0.200  -0.808

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ALA  47           H        ALA  47  21.936  -0.773   1.201
    2    HA   ALA  47           HA       ALA  47  21.845  -3.482   0.389
    3    HB2  ALA  47           HB1      ALA  47  21.497  -3.026   2.699
    4    HB3  ALA  47           HB2      ALA  47  19.947  -3.611   2.095
    5    HB1  ALA  47           HB3      ALA  47  20.198  -1.883   2.357

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LEU  48           H        LEU  48  19.516  -0.829   0.068
    2    HA   LEU  48           HA       LEU  48  17.442  -2.337  -1.166
    3    HB2  LEU  48           HB2      LEU  48  18.126   0.611  -1.277
    4    HB3  LEU  48           HB3      LEU  48  16.640  -0.082  -1.930
    5    HG   LEU  48           HG       LEU  48  17.523  -0.403   0.948
    6   HD13  LEU  48          HD11      LEU  48  17.127   1.903   0.774
    7   HD12  LEU  48          HD12      LEU  48  15.568   1.270   1.299
    8   HD11  LEU  48          HD13      LEU  48  15.824   1.695  -0.394
    9   HD22  LEU  48          HD21      LEU  48  15.972  -2.100   0.579
   10   HD21  LEU  48          HD22      LEU  48  15.093  -1.183  -0.646
   11   HD23  LEU  48          HD23      LEU  48  14.905  -0.783   1.061

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ASN  49           H        ASN  49  20.136  -0.433  -2.420
    2    HA   ASN  49           HA       ASN  49  19.453  -0.500  -5.137
    3    HB2  ASN  49           HB2      ASN  49  21.153   1.000  -4.259
    4    HB3  ASN  49           HB3      ASN  49  22.166  -0.360  -3.790
    5   HD21  ASN  49          HD21      ASN  49  20.716   1.186  -6.677
    6   HD22  ASN  49          HD22      ASN  49  21.943   0.699  -7.742

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLU  50           H        GLU  50  21.436  -2.723  -3.205
    2    HA   GLU  50           HA       GLU  50  22.093  -4.479  -5.345
    3    HB2  GLU  50           HB2      GLU  50  23.316  -4.474  -3.192
    4    HB3  GLU  50           HB3      GLU  50  21.876  -5.089  -2.382
    5    HG2  GLU  50           HG2      GLU  50  21.928  -7.118  -3.748
    6    HG3  GLU  50           HG3      GLU  50  23.300  -6.498  -4.663

  No H/Q in entry =           6
  In of MODEL   74
    1    H    ALA  51           H        ALA  51  19.465  -4.392  -2.987
    2    HA   ALA  51           HA       ALA  51  18.263  -6.850  -3.738
    3    HB3  ALA  51           HB1      ALA  51  16.695  -6.332  -2.163
    4    HB1  ALA  51           HB2      ALA  51  16.493  -4.681  -2.754
    5    HB2  ALA  51           HB3      ALA  51  17.860  -5.086  -1.715

  No H/Q in entry =           5
  In of MODEL   74
    1    H    HIS  52           H        HIS  52  17.702  -3.493  -4.756
    2    HA   HIS  52           HA       HIS  52  15.562  -3.990  -6.532
    3    HB2  HIS  52           HB2      HIS  52  16.198  -1.734  -5.756
    4    HB3  HIS  52           HB3      HIS  52  17.690  -1.841  -6.688
    5    HD1  HIS  52           HD1      HIS  52  17.367  -2.120  -9.355
    6    HD2  HIS  52           HD2      HIS  52  13.986  -0.912  -7.236
    7    HE1  HIS  52           HE1      HIS  52  15.745  -1.187 -11.063
    8    HE2  HIS  52           HE2      HIS  52  13.680  -0.445  -9.787

  No H/Q in entry =           8
  In of MODEL   74
    1    H    LEU  53           H        LEU  53  19.075  -4.033  -7.007
    2    HA   LEU  53           HA       LEU  53  19.095  -4.340  -9.808
    3    HB2  LEU  53           HB2      LEU  53  21.046  -5.137  -7.662
    4    HB3  LEU  53           HB3      LEU  53  21.337  -5.509  -9.359
    5    HG   LEU  53           HG       LEU  53  20.695  -2.700  -8.407
    6   HD11  LEU  53          HD11      LEU  53  23.343  -4.142  -8.617
    7   HD13  LEU  53          HD12      LEU  53  22.707  -3.216  -7.258
    8   HD12  LEU  53          HD13      LEU  53  23.228  -2.387  -8.721
    9   HD23  LEU  53          HD21      LEU  53  22.123  -2.257 -10.560
   10   HD22  LEU  53          HD22      LEU  53  20.444  -2.753 -10.747
   11   HD21  LEU  53          HD23      LEU  53  21.732  -3.920 -10.975

  No H/Q in entry =          11
  In of MODEL   74
    1    H    VAL  54           H        VAL  54  18.988  -6.733  -7.189
    2    HA   VAL  54           HA       VAL  54  19.068  -9.024  -8.856
    3    HB   VAL  54           HB       VAL  54  17.951  -8.597  -6.074
    4   HG12  VAL  54          HG11      VAL  54  18.247 -11.218  -6.081
    5   HG11  VAL  54          HG12      VAL  54  18.044 -11.042  -7.824
    6   HG13  VAL  54          HG13      VAL  54  16.773 -10.501  -6.729
    7   HG22  VAL  54          HG21      VAL  54  20.271  -8.411  -5.878
    8   HG21  VAL  54          HG22      VAL  54  20.581  -9.502  -7.226
    9   HG23  VAL  54          HG23      VAL  54  20.063 -10.148  -5.670

  No H/Q in entry =           9
  In of MODEL   74
    1    H    GLN  55           H        GLN  55  16.375  -7.097  -7.536
    2    HA   GLN  55           HA       GLN  55  14.324  -8.737  -8.590
    3    HB2  GLN  55           HB2      GLN  55  13.611  -7.209  -6.950
    4    HB3  GLN  55           HB3      GLN  55  14.408  -5.846  -7.732
    5    HG2  GLN  55           HG2      GLN  55  12.670  -5.500  -9.200
    6    HG3  GLN  55           HG3      GLN  55  12.329  -7.217  -9.371
    7   HE21  GLN  55          HE21      GLN  55  10.326  -7.748  -8.544
    8   HE22  GLN  55          HE22      GLN  55   9.575  -6.989  -7.224

  No H/Q in entry =           8
  In of MODEL   74
    1    H    THR  56           H        THR  56  16.075  -5.951  -9.962
    2    HA   THR  56           HA       THR  56  14.613  -5.568 -12.292
    3    HB   THR  56           HB       THR  56  17.635  -5.510 -12.166
    4    HG1  THR  56           HG1      THR  56  15.758  -4.067 -10.835
    5   HG22  THR  56          HG21      THR  56  17.197  -3.558 -13.754
    6   HG21  THR  56          HG22      THR  56  15.536  -4.141 -13.851
    7   HG23  THR  56          HG23      THR  56  16.863  -5.168 -14.393

  No H/Q in entry =           7
  In of MODEL   74
    1    H    LYS  57           H        LYS  57  17.247  -7.893 -11.719
    2    HA   LYS  57           HA       LYS  57  17.205  -9.080 -14.300
    3    HB2  LYS  57           HB2      LYS  57  19.016  -9.357 -12.583
    4    HB3  LYS  57           HB3      LYS  57  17.913 -10.336 -11.628
    5    HG2  LYS  57           HG2      LYS  57  17.750 -11.969 -13.460
    6    HG3  LYS  57           HG3      LYS  57  18.837 -10.991 -14.442
    7    HD2  LYS  57           HD2      LYS  57  20.621 -11.284 -12.748
    8    HD3  LYS  57           HD3      LYS  57  19.539 -12.290 -11.787
    9    HE2  LYS  57           HE2      LYS  57  19.381 -13.918 -13.626
   10    HE3  LYS  57           HE3      LYS  57  20.417 -12.911 -14.637
   11    HZ3  LYS  57           HZ1      LYS  57  22.231 -13.637 -13.609
   12    HZ2  LYS  57           HZ2      LYS  57  21.258 -14.872 -12.971
   13    HZ1  LYS  57           HZ3      LYS  57  21.551 -13.467 -12.065

  No H/Q in entry =          13
  In of MODEL   74
    1    H    LEU  58           H        LEU  58  15.454  -9.738 -11.305
    2    HA   LEU  58           HA       LEU  58  14.199 -12.098 -12.231
    3    HB2  LEU  58           HB2      LEU  58  13.448 -10.191 -10.022
    4    HB3  LEU  58           HB3      LEU  58  12.624 -11.720 -10.332
    5    HG   LEU  58           HG       LEU  58  15.605 -11.471  -9.813
    6   HD11  LEU  58          HD11      LEU  58  13.252 -11.871  -7.993
    7   HD13  LEU  58          HD12      LEU  58  14.718 -10.922  -7.745
    8   HD12  LEU  58          HD13      LEU  58  14.775 -12.679  -7.615
    9   HD22  LEU  58          HD21      LEU  58  15.456 -13.529 -10.844
   10   HD21  LEU  58          HD22      LEU  58  13.745 -13.724 -10.463
   11   HD23  LEU  58          HD23      LEU  58  14.965 -14.039  -9.229

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  59           H        ILE  59  13.551  -8.752 -12.897
    2    HA   ILE  59           HA       ILE  59  10.818  -9.373 -13.806
    3    HB   ILE  59           HB       ILE  59  11.661  -7.101 -12.605
    4   HG12  ILE  59          HG12      ILE  59   9.723  -6.963 -14.926
    5   HG13  ILE  59          HG13      ILE  59   9.318  -7.722 -13.408
    6   HG22  ILE  59          HG21      ILE  59  11.712  -6.281 -15.496
    7   HG21  ILE  59          HG22      ILE  59  13.194  -6.719 -14.678
    8   HG23  ILE  59          HG23      ILE  59  12.227  -5.366 -14.100
    9   HD11  ILE  59          HD11      ILE  59  10.271  -4.872 -13.684
   10   HD13  ILE  59          HD12      ILE  59   9.741  -5.647 -12.193
   11   HD12  ILE  59          HD13      ILE  59   8.584  -5.346 -13.489

  No H/Q in entry =          11
  In of MODEL   74
    1    H    GLU  60           H        GLU  60  14.014  -8.548 -15.101
    2    HA   GLU  60           HA       GLU  60  13.206  -8.133 -17.799
    3    HB2  GLU  60           HB2      GLU  60  15.468  -8.031 -18.285
    4    HB3  GLU  60           HB3      GLU  60  15.502  -7.701 -16.555
    5    HG2  GLU  60           HG2      GLU  60  17.143  -9.368 -16.795
    6    HG3  GLU  60           HG3      GLU  60  15.722 -10.290 -16.307

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLY  61           H        GLY  61  14.178 -11.028 -16.003
    2    HA3  GLY  61           HA2      GLY  61  13.592 -12.664 -18.402
    3    HA2  GLY  61           HA3      GLY  61  14.636 -13.159 -17.073

  No H/Q in entry =           3
  In of MODEL   74
    1    H    ASP  62           H        ASP  62  11.535 -11.585 -16.660
    2    HA   ASP  62           HA       ASP  62  10.605 -13.526 -14.828
    3    HB2  ASP  62           HB2      ASP  62   8.483 -12.271 -14.951
    4    HB3  ASP  62           HB3      ASP  62   9.872 -11.210 -14.732

  No H/Q in entry =           4
  In of MODEL   74
    1    H    ALA  63           H        ALA  63  10.027 -13.117 -18.319
    2    HA   ALA  63           HA       ALA  63   7.902 -15.064 -18.464
    3    HB1  ALA  63           HB1      ALA  63   8.476 -14.979 -20.952
    4    HB3  ALA  63           HB2      ALA  63   9.695 -13.779 -20.529
    5    HB2  ALA  63           HB3      ALA  63   7.990 -13.452 -20.217

  No H/Q in entry =           5
  In of MODEL   74
    1    H    GLY  64           H        GLY  64  10.108 -15.744 -20.859
    2    HA3  GLY  64           HA2      GLY  64  11.540 -17.489 -21.312
    3    HA2  GLY  64           HA3      GLY  64  11.738 -17.715 -19.580

  No H/Q in entry =           3
  In of MODEL   74
    1    H    GLU  65           H        GLU  65   9.433 -18.506 -18.588
    2    HA   GLU  65           HA       GLU  65   9.147 -21.145 -19.559
    3    HB2  GLU  65           HB2      GLU  65   7.497 -19.557 -17.599
    4    HB3  GLU  65           HB3      GLU  65   7.237 -21.268 -17.934
    5    HG2  GLU  65           HG2      GLU  65   9.520 -21.789 -17.246
    6    HG3  GLU  65           HG3      GLU  65   9.863 -20.078 -16.997

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLY  66           H        GLY  66   7.201 -18.285 -19.937
    2    HA3  GLY  66           HA2      GLY  66   5.843 -19.406 -22.245
    3    HA2  GLY  66           HA3      GLY  66   4.816 -18.954 -20.900

  No H/Q in entry =           3
  In of MODEL   74
    1    H    LYS  67           H        LYS  67   3.759 -17.481 -22.271
    2    HA   LYS  67           HA       LYS  67   5.246 -15.246 -23.369
    3    HB2  LYS  67           HB2      LYS  67   2.773 -14.641 -24.068
    4    HB3  LYS  67           HB3      LYS  67   3.671 -15.922 -24.891
    5    HG2  LYS  67           HG2      LYS  67   2.641 -17.623 -23.512
    6    HG3  LYS  67           HG3      LYS  67   1.878 -16.404 -22.496
    7    HD2  LYS  67           HD2      LYS  67   0.517 -15.647 -24.393
    8    HD3  LYS  67           HD3      LYS  67   1.300 -16.833 -25.440
    9    HE2  LYS  67           HE2      LYS  67  -0.707 -17.897 -24.773
   10    HE3  LYS  67           HE3      LYS  67   0.523 -18.591 -23.718
   11    HZ2  LYS  67           HZ1      LYS  67  -1.723 -16.932 -23.059
   12    HZ1  LYS  67           HZ2      LYS  67  -0.270 -16.373 -22.381
   13    HZ3  LYS  67           HZ3      LYS  67  -0.804 -17.956 -22.067

  No H/Q in entry =          13
  In of MODEL   74
    1    H    MET  68           H        MET  68   2.065 -14.664 -22.315
    2    HA   MET  68           HA       MET  68   2.634 -12.236 -21.019
    3    HB2  MET  68           HB2      MET  68   0.208 -13.999 -21.169
    4    HB3  MET  68           HB3      MET  68   0.207 -12.514 -20.219
    5    HG2  MET  68           HG2      MET  68   0.992 -12.640 -23.141
    6    HG3  MET  68           HG3      MET  68  -0.623 -12.209 -22.575
    7    HE3  MET  68           HE1      MET  68   1.834  -9.917 -24.214
    8    HE2  MET  68           HE2      MET  68   0.415  -8.961 -23.799
    9    HE1  MET  68           HE3      MET  68   0.219 -10.631 -24.324

  No H/Q in entry =           9
  In of MODEL   74
    1    H    LYS  69           H        LYS  69   2.028 -15.470 -19.626
    2    HA   LYS  69           HA       LYS  69   1.716 -14.641 -16.965
    3    HB2  LYS  69           HB2      LYS  69   2.680 -17.297 -18.035
    4    HB3  LYS  69           HB3      LYS  69   2.127 -17.003 -16.384
    5    HG2  LYS  69           HG2      LYS  69   0.391 -16.218 -18.710
    6    HG3  LYS  69           HG3      LYS  69   0.413 -17.890 -18.152
    7    HD2  LYS  69           HD2      LYS  69  -0.153 -17.111 -15.863
    8    HD3  LYS  69           HD3      LYS  69  -0.241 -15.455 -16.468
    9    HE2  LYS  69           HE2      LYS  69  -2.020 -16.130 -18.047
   10    HE3  LYS  69           HE3      LYS  69  -1.942 -17.777 -17.422
   11    HZ2  LYS  69           HZ1      LYS  69  -3.723 -16.378 -16.434
   12    HZ1  LYS  69           HZ2      LYS  69  -2.516 -15.407 -15.736
   13    HZ3  LYS  69           HZ3      LYS  69  -2.656 -17.042 -15.297

  No H/Q in entry =          13
  In of MODEL   74
    1    H    VAL  70           H        VAL  70   3.013 -14.386 -15.190
    2    HA   VAL  70           HA       VAL  70   5.938 -14.688 -15.539
    3    HB   VAL  70           HB       VAL  70   6.232 -12.569 -14.289
    4   HG13  VAL  70          HG11      VAL  70   6.298 -12.504 -16.729
    5   HG12  VAL  70          HG12      VAL  70   5.482 -11.058 -16.134
    6   HG11  VAL  70          HG13      VAL  70   4.540 -12.392 -16.800
    7   HG22  VAL  70          HG21      VAL  70   4.344 -12.143 -13.000
    8   HG21  VAL  70          HG22      VAL  70   3.246 -12.737 -14.244
    9   HG23  VAL  70          HG23      VAL  70   3.959 -11.132 -14.394

  No H/Q in entry =           9
  In of MODEL   74
    1    H    SER  71           H        SER  71   7.068 -14.615 -13.390
    2    HA   SER  71           HA       SER  71   6.063 -16.567 -11.608
    3    HB2  SER  71           HB2      SER  71   8.486 -15.936 -11.907
    4    HB3  SER  71           HB3      SER  71   8.155 -14.467 -10.992
    5    HG   SER  71           HG       SER  71   7.238 -16.831  -9.880

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LEU  72           H        LEU  72   4.686 -16.413  -9.969
    2    HA   LEU  72           HA       LEU  72   3.163 -14.087  -9.500
    3    HB2  LEU  72           HB2      LEU  72   3.445 -16.649  -7.936
    4    HB3  LEU  72           HB3      LEU  72   2.288 -15.383  -7.528
    5    HG   LEU  72           HG       LEU  72   2.418 -16.689 -10.266
    6   HD13  LEU  72          HD11      LEU  72   0.589 -18.103  -9.584
    7   HD12  LEU  72          HD12      LEU  72   0.466 -17.283  -8.028
    8   HD11  LEU  72          HD13      LEU  72   1.869 -18.289  -8.383
    9   HD22  LEU  72          HD21      LEU  72   1.217 -14.691 -10.527
   10   HD21  LEU  72          HD22      LEU  72   0.555 -14.745  -8.902
   11   HD23  LEU  72          HD23      LEU  72  -0.068 -15.830 -10.141

  No H/Q in entry =          11
  In of MODEL   74
    1    H    VAL  73           H        VAL  73   5.826 -15.554  -7.762
    2    HA   VAL  73           HA       VAL  73   5.806 -14.028  -5.425
    3    HB   VAL  73           HB       VAL  73   7.951 -14.891  -5.000
    4   HG12  VAL  73          HG11      VAL  73   6.925 -16.949  -6.940
    5   HG11  VAL  73          HG12      VAL  73   5.990 -16.545  -5.500
    6   HG13  VAL  73          HG13      VAL  73   7.626 -17.184  -5.341
    7   HG23  VAL  73          HG21      VAL  73   9.307 -15.884  -6.928
    8   HG22  VAL  73          HG22      VAL  73   9.195 -14.125  -6.891
    9   HG21  VAL  73          HG23      VAL  73   8.194 -15.049  -8.012

  No H/Q in entry =           9
  In of MODEL   74
    1    H    LEU  74           H        LEU  74   6.769 -13.133  -8.608
    2    HA   LEU  74           HA       LEU  74   8.738 -11.205  -8.131
    3    HB2  LEU  74           HB2      LEU  74   8.242 -11.949 -10.366
    4    HB3  LEU  74           HB3      LEU  74   6.590 -11.349 -10.246
    5    HG   LEU  74           HG       LEU  74   7.438  -9.040 -10.042
    6   HD12  LEU  74          HD11      LEU  74   9.943  -8.791 -10.648
    7   HD11  LEU  74          HD12      LEU  74  10.092 -10.475 -10.148
    8   HD13  LEU  74          HD13      LEU  74   9.553  -9.257  -8.994
    9   HD23  LEU  74          HD21      LEU  74   8.896 -10.139 -12.381
   10   HD22  LEU  74          HD22      LEU  74   7.744  -8.828 -12.279
   11   HD21  LEU  74          HD23      LEU  74   7.172 -10.480 -12.263

  No H/Q in entry =          11
  In of MODEL   74
    1    H    VAL  75           H        VAL  75   5.243 -10.786  -8.445
    2    HA   VAL  75           HA       VAL  75   5.179  -8.031  -7.848
    3    HB   VAL  75           HB       VAL  75   3.074 -10.155  -7.445
    4   HG12  VAL  75          HG11      VAL  75   1.515  -8.172  -7.336
    5   HG11  VAL  75          HG12      VAL  75   2.925  -7.125  -7.272
    6   HG13  VAL  75          HG13      VAL  75   2.614  -8.256  -5.964
    7   HG23  VAL  75          HG21      VAL  75   3.355  -7.988  -9.549
    8   HG22  VAL  75          HG22      VAL  75   2.203  -9.321  -9.543
    9   HG21  VAL  75          HG23      VAL  75   3.921  -9.641  -9.785

  No H/Q in entry =           9
  In of MODEL   74
    1    H    GLU  76           H        GLU  76   4.920 -10.912  -5.746
    2    HA   GLU  76           HA       GLU  76   4.489  -9.554  -3.315
    3    HB2  GLU  76           HB2      GLU  76   4.291 -12.021  -3.561
    4    HB3  GLU  76           HB3      GLU  76   6.025 -12.132  -3.808
    5    HG2  GLU  76           HG2      GLU  76   5.599 -12.716  -1.511
    6    HG3  GLU  76           HG3      GLU  76   6.340 -11.125  -1.496

  No H/Q in entry =           6
  In of MODEL   74
    1    H    ALA  77           H        ALA  77   7.523 -10.486  -4.913
    2    HA   ALA  77           HA       ALA  77   9.243  -9.465  -2.911
    3    HB3  ALA  77           HB1      ALA  77   9.652  -9.927  -5.870
    4    HB1  ALA  77           HB2      ALA  77  10.147 -10.971  -4.538
    5    HB2  ALA  77           HB3      ALA  77  10.945  -9.417  -4.783

  No H/Q in entry =           5
  In of MODEL   74
    1    H    GLN  78           H        GLN  78   7.835  -8.025  -5.806
    2    HA   GLN  78           HA       GLN  78   9.213  -5.560  -5.708
    3    HB2  GLN  78           HB2      GLN  78   7.888  -6.455  -7.655
    4    HB3  GLN  78           HB3      GLN  78   6.418  -6.065  -6.763
    5    HG2  GLN  78           HG2      GLN  78   7.087  -3.703  -6.674
    6    HG3  GLN  78           HG3      GLN  78   8.571  -4.080  -7.547
    7   HE21  GLN  78          HE21      GLN  78   6.696  -2.239  -8.651
    8   HE22  GLN  78          HE22      GLN  78   5.985  -2.945 -10.022

  No H/Q in entry =           8
  In of MODEL   74
    1    H    LEU  79           H        LEU  79   6.197  -6.672  -4.251
    2    HA   LEU  79           HA       LEU  79   5.238  -4.258  -3.224
    3    HB2  LEU  79           HB2      LEU  79   3.903  -6.296  -3.162
    4    HB3  LEU  79           HB3      LEU  79   5.052  -7.051  -2.060
    5    HG   LEU  79           HG       LEU  79   4.533  -5.409  -0.323
    6   HD13  LEU  79          HD11      LEU  79   4.078  -3.386  -1.362
    7   HD12  LEU  79          HD12      LEU  79   2.452  -3.896  -0.909
    8   HD11  LEU  79          HD13      LEU  79   3.014  -4.119  -2.564
    9   HD23  LEU  79          HD21      LEU  79   1.943  -5.875  -0.209
   10   HD22  LEU  79          HD22      LEU  79   3.069  -7.226  -0.116
   11   HD21  LEU  79          HD23      LEU  79   2.245  -6.876  -1.632

  No H/Q in entry =          11
  In of MODEL   74
    1    H    HIS  80           H        HIS  80   7.412  -6.621  -1.670
    2    HA   HIS  80           HA       HIS  80   7.739  -5.089   0.701
    3    HB2  HIS  80           HB2      HIS  80   9.041  -7.463  -0.518
    4    HB3  HIS  80           HB3      HIS  80   9.972  -6.580   0.692
    5    HD1  HIS  80           HD1      HIS  80   9.497  -7.218   3.038
    6    HD2  HIS  80           HD2      HIS  80   6.248  -8.027   0.554
    7    HE1  HIS  80           HE1      HIS  80   7.728  -8.308   4.500
    8    HE2  HIS  80           HE2      HIS  80   5.741  -8.805   2.994

  No H/Q in entry =           8
  In of MODEL   74
    1    H    LEU  81           H        LEU  81   9.713  -5.377  -2.231
    2    HA   LEU  81           HA       LEU  81  11.784  -3.661  -1.367
    3    HB2  LEU  81           HB2      LEU  81  10.829  -4.434  -4.123
    4    HB3  LEU  81           HB3      LEU  81  12.262  -3.444  -3.843
    5    HG   LEU  81           HG       LEU  81  11.852  -6.165  -2.575
    6   HD12  LEU  81          HD11      LEU  81  13.645  -6.806  -4.343
    7   HD11  LEU  81          HD12      LEU  81  13.086  -5.373  -5.205
    8   HD13  LEU  81          HD13      LEU  81  11.964  -6.686  -4.861
    9   HD23  LEU  81          HD21      LEU  81  14.484  -5.879  -2.584
   10   HD22  LEU  81          HD22      LEU  81  13.522  -5.112  -1.323
   11   HD21  LEU  81          HD23      LEU  81  14.098  -4.162  -2.692

  No H/Q in entry =          11
  In of MODEL   74
    1    H    MET  82           H        MET  82   8.851  -2.986  -3.274
    2    HA   MET  82           HA       MET  82   9.416  -0.265  -3.771
    3    HB2  MET  82           HB2      MET  82   6.840  -1.830  -3.627
    4    HB3  MET  82           HB3      MET  82   6.856  -0.105  -3.986
    5    HG2  MET  82           HG2      MET  82   8.419  -2.191  -5.543
    6    HG3  MET  82           HG3      MET  82   6.854  -1.549  -6.039
    7    HE3  MET  82           HE1      MET  82   7.330   1.904  -7.204
    8    HE2  MET  82           HE2      MET  82   6.969   1.677  -5.494
    9    HE1  MET  82           HE3      MET  82   6.280   0.578  -6.686

  No H/Q in entry =           9
  In of MODEL   74
    1    H    THR  83           H        THR  83   7.630  -1.851  -1.155
    2    HA   THR  83           HA       THR  83   6.819   0.502   0.187
    3    HB   THR  83           HB       THR  83   6.685  -1.077   2.201
    4    HG1  THR  83           HG1      THR  83   7.417  -3.035   1.958
    5   HG22  THR  83          HG21      THR  83   5.000  -2.619   0.744
    6   HG21  THR  83          HG22      THR  83   5.232  -1.290  -0.386
    7   HG23  THR  83          HG23      THR  83   4.610  -0.972   1.234

  No H/Q in entry =           7
  In of MODEL   74
    1    H    SER  84           H        SER  84   9.623  -1.630   0.675
    2    HA   SER  84           HA       SER  84  10.719  -0.219   2.858
    3    HB2  SER  84           HB2      SER  84  11.932  -2.069   0.816
    4    HB3  SER  84           HB3      SER  84  12.899  -1.331   2.091
    5    HG   SER  84           HG       SER  84  10.607  -2.995   2.366

  No H/Q in entry =           5
  In of MODEL   74
    1    H    MET  85           H        MET  85  11.443   0.045  -0.636
    2    HA   MET  85           HA       MET  85  13.466   1.985  -0.397
    3    HB2  MET  85           HB2      MET  85  13.032   0.713  -2.463
    4    HB3  MET  85           HB3      MET  85  11.518   1.591  -2.677
    5    HG2  MET  85           HG2      MET  85  12.756   3.720  -2.794
    6    HG3  MET  85           HG3      MET  85  14.272   2.853  -2.562
    7    HE1  MET  85           HE1      MET  85  11.722   4.201  -4.870
    8    HE3  MET  85           HE2      MET  85  10.975   2.609  -4.783
    9    HE2  MET  85           HE3      MET  85  11.679   3.156  -6.298

  No H/Q in entry =           9
  In of MODEL   74
    1    H    LEU  86           H        LEU  86   9.976   2.363  -0.873
    2    HA   LEU  86           HA       LEU  86   9.945   5.178  -1.045
    3    HB2  LEU  86           HB2      LEU  86   8.075   3.542  -1.609
    4    HB3  LEU  86           HB3      LEU  86   7.760   3.451   0.124
    5    HG   LEU  86           HG       LEU  86   7.630   6.013   0.081
    6   HD11  LEU  86          HD11      LEU  86   8.376   5.577  -2.630
    7   HD13  LEU  86          HD12      LEU  86   7.965   7.107  -1.860
    8   HD12  LEU  86          HD13      LEU  86   6.710   6.162  -2.657
    9   HD23  LEU  86          HD21      LEU  86   5.465   4.692  -1.566
   10   HD22  LEU  86          HD22      LEU  86   5.301   5.950  -0.344
   11   HD21  LEU  86          HD23      LEU  86   5.685   4.300   0.140

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ALA  87           H        ALA  87   9.477   2.996   1.698
    2    HA   ALA  87           HA       ALA  87   8.971   4.910   3.679
    3    HB1  ALA  87           HB1      ALA  87   9.742   2.080   3.576
    4    HB3  ALA  87           HB2      ALA  87   8.637   2.903   4.675
    5    HB2  ALA  87           HB3      ALA  87  10.369   2.912   5.003

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ARG  88           H        ARG  88  12.027   3.451   2.665
    2    HA   ARG  88           HA       ARG  88  13.670   4.803   4.487
    3    HB2  ARG  88           HB2      ARG  88  14.301   2.826   3.070
    4    HB3  ARG  88           HB3      ARG  88  14.454   3.921   1.700
    5    HG2  ARG  88           HG2      ARG  88  15.962   5.211   3.636
    6    HG3  ARG  88           HG3      ARG  88  16.265   3.516   4.007
    7    HD2  ARG  88           HD2      ARG  88  17.511   3.210   2.147
    8    HD3  ARG  88           HD3      ARG  88  16.375   4.099   1.128
    9    HE   ARG  88           HE       ARG  88  18.792   5.130   2.156
   10   HH21  ARG  88          HH11      ARG  88  19.163   7.345   1.965
   11   HH22  ARG  88          HH12      ARG  88  17.824   8.433   1.838
   12   HH11  ARG  88          HH21      ARG  88  15.460   5.925   1.912
   13   HH12  ARG  88          HH22      ARG  88  15.726   7.627   1.783

  No H/Q in entry =          13
  In of MODEL   74
    1    H    GLU  89           H        GLU  89  12.677   5.724   1.175
    2    HA   GLU  89           HA       GLU  89  14.251   8.065   1.012
    3    HB2  GLU  89           HB2      GLU  89  13.076   7.045  -0.928
    4    HB3  GLU  89           HB3      GLU  89  11.544   7.603  -0.254
    5    HG2  GLU  89           HG2      GLU  89  12.273   9.932  -0.416
    6    HG3  GLU  89           HG3      GLU  89  13.866   9.423  -0.969

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LEU  90           H        LEU  90  10.927   7.593   2.172
    2    HA   LEU  90           HA       LEU  90  10.451  10.330   2.761
    3    HB2  LEU  90           HB2      LEU  90   9.235   7.768   3.791
    4    HB3  LEU  90           HB3      LEU  90   8.628   9.370   4.225
    5    HG   LEU  90           HG       LEU  90   9.008   8.494   1.349
    6   HD12  LEU  90          HD11      LEU  90   6.471   8.197   1.435
    7   HD11  LEU  90          HD12      LEU  90   6.642   8.179   3.190
    8   HD13  LEU  90          HD13      LEU  90   7.436   6.942   2.214
    9   HD22  LEU  90          HD21      LEU  90   8.741  10.806   1.286
   10   HD21  LEU  90          HD22      LEU  90   7.769  10.846   2.756
   11   HD23  LEU  90          HD23      LEU  90   7.051  10.305   1.239

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  91           H        ILE  91  11.699   7.627   4.662
    2    HA   ILE  91           HA       ILE  91  11.880   8.982   7.133
    3    HB   ILE  91           HB       ILE  91  13.394   6.629   5.987
    4   HG12  ILE  91          HG12      ILE  91  11.402   6.813   8.266
    5   HG13  ILE  91          HG13      ILE  91  10.912   6.544   6.594
    6   HG22  ILE  91          HG21      ILE  91  13.887   6.400   8.622
    7   HG21  ILE  91          HG22      ILE  91  13.832   8.160   8.528
    8   HG23  ILE  91          HG23      ILE  91  14.990   7.261   7.549
    9   HD13  ILE  91          HD11      ILE  91  11.888   4.430   6.508
   10   HD12  ILE  91          HD12      ILE  91  11.311   4.490   8.173
   11   HD11  ILE  91          HD13      ILE  91  13.014   4.783   7.820

  No H/Q in entry =          11
  In of MODEL   74
    1    H    THR  92           H        THR  92  14.068   8.795   4.359
    2    HA   THR  92           HA       THR  92  16.262  10.158   5.502
    3    HB   THR  92           HB       THR  92  15.247  10.054   2.651
    4    HG1  THR  92           HG1      THR  92  16.059   8.146   3.042
    5   HG22  THR  92          HG21      THR  92  17.822  10.714   2.335
    6   HG21  THR  92          HG22      THR  92  17.539  11.534   3.870
    7   HG23  THR  92          HG23      THR  92  16.560  11.938   2.460

  No H/Q in entry =           7
  In of MODEL   74
    1    H    GLU  93           H        GLU  93  13.372  11.352   3.805
    2    HA   GLU  93           HA       GLU  93  14.002  14.105   3.923
    3    HB2  GLU  93           HB2      GLU  93  11.281  12.765   3.959
    4    HB3  GLU  93           HB3      GLU  93  11.586  14.463   3.590
    5    HG2  GLU  93           HG2      GLU  93  12.882  12.209   2.042
    6    HG3  GLU  93           HG3      GLU  93  11.339  12.913   1.572

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LEU  94           H        LEU  94  12.254  11.963   6.144
    2    HA   LEU  94           HA       LEU  94  11.487  13.912   8.034
    3    HB2  LEU  94           HB2      LEU  94  12.030  10.950   8.293
    4    HB3  LEU  94           HB3      LEU  94  11.483  11.928   9.652
    5    HG   LEU  94           HG       LEU  94   9.974  12.007   7.038
    6   HD11  LEU  94          HD11      LEU  94  10.049   9.778   9.034
    7   HD13  LEU  94          HD12      LEU  94   9.730   9.726   7.302
    8   HD12  LEU  94          HD13      LEU  94   8.469  10.255   8.414
    9   HD23  LEU  94          HD21      LEU  94   8.076  12.424   8.658
   10   HD22  LEU  94          HD22      LEU  94   9.330  13.663   8.687
   11   HD21  LEU  94          HD23      LEU  94   9.265  12.443   9.958

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  95           H        ILE  95  14.435  11.948   7.762
    2    HA   ILE  95           HA       ILE  95  15.637  12.847  10.167
    3    HB   ILE  95           HB       ILE  95  16.838  11.772   7.603
    4   HG12  ILE  95          HG12      ILE  95  16.555  10.565  10.370
    5   HG13  ILE  95          HG13      ILE  95  15.372  10.326   9.085
    6   HG21  ILE  95          HG21      ILE  95  18.129  12.554  10.235
    7   HG23  ILE  95          HG22      ILE  95  18.582  13.082   8.613
    8   HG22  ILE  95          HG23      ILE  95  18.873  11.417   9.113
    9   HD13  ILE  95          HD11      ILE  95  16.824   9.033   7.803
   10   HD12  ILE  95          HD12      ILE  95  17.307   8.573   9.433
   11   HD11  ILE  95          HD13      ILE  95  18.266   9.744   8.528

  No H/Q in entry =          11
  In of MODEL   74
    1    H    GLU  96           H        GLU  96  15.774  14.090   6.835
    2    HA   GLU  96           HA       GLU  96  17.651  16.144   7.300
    3    HB2  GLU  96           HB2      GLU  96  16.956  15.498   5.046
    4    HB3  GLU  96           HB3      GLU  96  15.323  16.074   5.364
    5    HG2  GLU  96           HG2      GLU  96  15.909  18.198   4.824
    6    HG3  GLU  96           HG3      GLU  96  17.220  18.178   5.993

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LEU  97           H        LEU  97  14.142  15.999   7.764
    2    HA   LEU  97           HA       LEU  97  13.766  18.735   8.419
    3    HB2  LEU  97           HB2      LEU  97  12.223  16.226   9.040
    4    HB3  LEU  97           HB3      LEU  97  11.735  17.777   9.722
    5    HG   LEU  97           HG       LEU  97  12.184  17.365   6.751
    6   HD12  LEU  97          HD11      LEU  97   9.658  17.269   6.658
    7   HD11  LEU  97          HD12      LEU  97   9.666  17.063   8.407
    8   HD13  LEU  97          HD13      LEU  97  10.422  15.850   7.373
    9   HD23  LEU  97          HD21      LEU  97  10.470  19.351   6.807
   10   HD22  LEU  97          HD22      LEU  97  12.160  19.688   7.184
   11   HD21  LEU  97          HD23      LEU  97  10.982  19.528   8.485

  No H/Q in entry =          11
  In of MODEL   74
    1    H    HIS  98           H        HIS  98  14.572  15.892  10.397
    2    HA   HIS  98           HA       HIS  98  14.455  17.146  12.919
    3    HB2  HIS  98           HB2      HIS  98  16.167  14.871  11.892
    4    HB3  HIS  98           HB3      HIS  98  16.189  15.404  13.575
    5    HD1  HIS  98           HD1      HIS  98  13.944  13.811  11.000
    6    HD2  HIS  98           HD2      HIS  98  13.889  14.718  15.068
    7    HE1  HIS  98           HE1      HIS  98  11.914  12.638  11.969
    8    HE2  HIS  98           HE2      HIS  98  11.860  13.182  14.442

  No H/Q in entry =           8
  In of MODEL   74
    1    H    GLU  99           H        GLU  99  16.982  17.008  10.458
    2    HA   GLU  99           HA       GLU  99  19.000  18.310  11.971
    3    HB2  GLU  99           HB2      GLU  99  19.442  17.023   9.893
    4    HB3  GLU  99           HB3      GLU  99  18.638  18.291   8.965
    5    HG2  GLU  99           HG2      GLU  99  20.275  19.939   9.745
    6    HG3  GLU  99           HG3      GLU  99  21.050  18.724  10.756

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LYS 100           H        LYS 100  16.468  19.511   9.785
    2    HA   LYS 100           HA       LYS 100  17.302  22.238   9.930
    3    HB2  LYS 100           HB2      LYS 100  14.645  20.985   9.197
    4    HB3  LYS 100           HB3      LYS 100  14.966  22.720   9.110
    5    HG2  LYS 100           HG2      LYS 100  16.917  22.251   7.622
    6    HG3  LYS 100           HG3      LYS 100  16.482  20.539   7.638
    7    HD2  LYS 100           HD2      LYS 100  14.284  21.080   6.662
    8    HD3  LYS 100           HD3      LYS 100  14.702  22.794   6.653
    9    HE2  LYS 100           HE2      LYS 100  16.640  22.294   5.172
   10    HE3  LYS 100           HE3      LYS 100  16.153  20.595   5.137
   11    HZ1  LYS 100           HZ1      LYS 100  14.348  22.814   4.329
   12    HZ3  LYS 100           HZ2      LYS 100  14.139  21.148   4.063
   13    HZ2  LYS 100           HZ3      LYS 100  15.353  21.997   3.232

  No H/Q in entry =          13
  In of MODEL   74
    1    H    LEU 101           H        LEU 101  15.199  20.212  11.909
    2    HA   LEU 101           HA       LEU 101  14.075  22.289  13.506
    3    HB2  LEU 101           HB2      LEU 101  14.483  19.333  13.876
    4    HB3  LEU 101           HB3      LEU 101  13.973  20.315  15.245
    5    HG   LEU 101           HG       LEU 101  12.530  20.431  12.591
    6   HD12  LEU 101          HD11      LEU 101  10.863  18.884  13.871
    7   HD11  LEU 101          HD12      LEU 101  12.262  18.450  14.851
    8   HD13  LEU 101          HD13      LEU 101  12.274  18.149  13.112
    9   HD21  LEU 101          HD21      LEU 101  11.912  21.222  15.453
   10   HD23  LEU 101          HD22      LEU 101  10.636  21.017  14.254
   11   HD22  LEU 101          HD23      LEU 101  11.884  22.237  14.008

  No H/Q in entry =          11
  In of MODEL   74
    1    H    LYS 102           H        LYS 102  17.210  21.642  13.036
    2    HA   LYS 102           HA       LYS 102  19.078  22.485  14.092
    3    HB2  LYS 102           HB2      LYS 102  17.296  24.019  15.249
    4    HB3  LYS 102           HB3      LYS 102  17.503  22.949  16.620
    5    HG2  LYS 102           HG2      LYS 102  19.410  24.939  15.439
    6    HG3  LYS 102           HG3      LYS 102  19.041  24.624  17.120
    7    HD2  LYS 102           HD2      LYS 102  20.666  22.696  15.411
    8    HD3  LYS 102           HD3      LYS 102  21.382  24.006  16.341
    9    HE2  LYS 102           HE2      LYS 102  20.960  21.459  17.305
   10    HE3  LYS 102           HE3      LYS 102  21.208  22.894  18.299
   11    HZ2  LYS 102           HZ1      LYS 102  19.229  21.634  18.933
   12    HZ1  LYS 102           HZ2      LYS 102  18.572  21.878  17.391
   13    HZ3  LYS 102           HZ3      LYS 102  18.830  23.201  18.419

  No H/Q in entry =          13
  In of MODEL   74
    1    H    ALA 103           H        ALA 103  17.011  20.898  16.530
    2    HA   ALA 103           HA       ALA 103  18.738  19.659  18.162
    3    HB2  ALA 103           HB1      ALA 103  17.128  17.672  18.166
    4    HB1  ALA 103           HB2      ALA 103  16.231  18.542  16.921
    5    HB3  ALA 103           HB3      ALA 103  16.435  19.254  18.520

  No H/Q in entry =           5
  In of MODEL   74
    1    H1   ALA   1           H3       ALA   1  -1.948  -6.786 -21.345
    2    H2   ALA   1           H2       ALA   1  -2.757  -8.212 -20.889
    3    H3   ALA   1           H1       ALA   1  -1.156  -8.281 -21.461
    4    HA   ALA   1           HA       ALA   1  -2.016  -8.732 -23.450
    5    HB1  ALA   1           HB1      ALA   1  -4.158  -9.423 -22.957
    6    HB2  ALA   1           HB2      ALA   1  -4.584  -7.903 -23.745
    7    HB3  ALA   1           HB3      ALA   1  -4.507  -7.991 -21.987

  No H/Q in entry =           7
  In of MODEL   74
    1    H    GLU   2           H        GLU   2  -2.850  -7.523 -25.427
    2    HA   GLU   2           HA       GLU   2  -1.432  -5.525 -26.311
    3    HB2  GLU   2           HB2      GLU   2  -4.443  -5.550 -26.598
    4    HB3  GLU   2           HB3      GLU   2  -3.321  -4.698 -27.656
    5    HG2  GLU   2           HG2      GLU   2  -2.856  -6.590 -28.823
    6    HG3  GLU   2           HG3      GLU   2  -2.556  -7.506 -27.352

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLU   3           H        GLU   3  -4.566  -4.228 -25.374
    2    HA   GLU   3           HA       GLU   3  -3.478  -1.689 -24.747
    3    HB2  GLU   3           HB2      GLU   3  -6.181  -2.968 -24.393
    4    HB3  GLU   3           HB3      GLU   3  -5.854  -1.360 -23.744
    5    HG2  GLU   3           HG2      GLU   3  -5.506  -0.430 -25.870
    6    HG3  GLU   3           HG3      GLU   3  -5.140  -1.987 -26.604

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LEU   4           H        LEU   4  -5.079  -4.034 -22.560
    2    HA   LEU   4           HA       LEU   4  -4.674  -2.821 -20.169
    3    HB2  LEU   4           HB2      LEU   4  -4.176  -5.767 -20.654
    4    HB3  LEU   4           HB3      LEU   4  -4.556  -5.021 -19.104
    5    HG   LEU   4           HG       LEU   4  -6.354  -5.061 -21.550
    6   HD13  LEU   4          HD11      LEU   4  -7.561  -6.766 -20.547
    7   HD12  LEU   4          HD12      LEU   4  -7.054  -6.319 -18.919
    8   HD11  LEU   4          HD13      LEU   4  -5.940  -7.174 -19.985
    9   HD23  LEU   4          HD21      LEU   4  -8.009  -4.234 -19.663
   10   HD22  LEU   4          HD22      LEU   4  -6.963  -3.074 -20.479
   11   HD21  LEU   4          HD23      LEU   4  -6.529  -3.676 -18.880

  No H/Q in entry =          11
  In of MODEL   74
    1    H    GLU   5           H        GLU   5  -2.219  -4.691 -21.931
    2    HA   GLU   5           HA       GLU   5  -0.211  -4.442 -19.913
    3    HB2  GLU   5           HB2      GLU   5  -0.181  -6.208 -21.665
    4    HB3  GLU   5           HB3      GLU   5   0.122  -4.967 -22.881
    5    HG2  GLU   5           HG2      GLU   5   2.210  -4.343 -21.755
    6    HG3  GLU   5           HG3      GLU   5   1.907  -5.540 -20.497

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLU   6           H        GLU   6  -0.853  -2.709 -22.945
    2    HA   GLU   6           HA       GLU   6   1.344  -0.908 -22.692
    3    HB2  GLU   6           HB2      GLU   6   0.197  -1.361 -24.845
    4    HB3  GLU   6           HB3      GLU   6  -1.246  -0.561 -24.223
    5    HG2  GLU   6           HG2      GLU   6  -0.002   1.530 -23.949
    6    HG3  GLU   6           HG3      GLU   6   1.477   0.742 -24.491

  No H/Q in entry =           6
  In of MODEL   74
    1    H    VAL   7           H        VAL   7  -1.984  -0.937 -21.614
    2    HA   VAL   7           HA       VAL   7  -2.160   1.775 -20.766
    3    HB   VAL   7           HB       VAL   7  -3.648  -0.726 -19.924
    4   HG11  VAL   7          HG11      VAL   7  -3.975   2.165 -19.096
    5   HG13  VAL   7          HG12      VAL   7  -3.885   0.735 -18.067
    6   HG12  VAL   7          HG13      VAL   7  -5.323   1.028 -19.044
    7   HG21  VAL   7          HG21      VAL   7  -3.814   0.362 -22.307
    8   HG23  VAL   7          HG22      VAL   7  -4.734   1.620 -21.481
    9   HG22  VAL   7          HG23      VAL   7  -5.302  -0.049 -21.455

  No H/Q in entry =           9
  In of MODEL   74
    1    H    VAL   8           H        VAL   8  -1.197  -1.230 -19.144
    2    HA   VAL   8           HA       VAL   8  -0.838  -0.165 -16.547
    3    HB   VAL   8           HB       VAL   8   0.398  -2.527 -17.969
    4   HG12  VAL   8          HG11      VAL   8   1.135  -3.167 -15.597
    5   HG11  VAL   8          HG12      VAL   8   0.862  -1.478 -15.169
    6   HG13  VAL   8          HG13      VAL   8   2.066  -1.894 -16.388
    7   HG22  VAL   8          HG21      VAL   8  -1.571  -3.494 -17.335
    8   HG21  VAL   8          HG22      VAL   8  -2.048  -2.028 -16.483
    9   HG23  VAL   8          HG23      VAL   8  -1.096  -3.254 -15.654

  No H/Q in entry =           9
  In of MODEL   74
    1    H    MET   9           H        MET   9   1.379  -0.486 -19.318
    2    HA   MET   9           HA       MET   9   3.692   0.519 -18.076
    3    HB2  MET   9           HB2      MET   9   2.716   0.576 -20.931
    4    HB3  MET   9           HB3      MET   9   4.249   1.311 -20.465
    5    HG2  MET   9           HG2      MET   9   5.004  -0.841 -19.526
    6    HG3  MET   9           HG3      MET   9   3.466  -1.579 -19.978
    7    HE2  MET   9           HE1      MET   9   7.124  -1.012 -21.209
    8    HE1  MET   9           HE2      MET   9   6.321   0.549 -21.082
    9    HE3  MET   9           HE3      MET   9   6.826  -0.048 -22.660

  No H/Q in entry =           9
  In of MODEL   74
    1    H    GLY  10           H        GLY  10   1.014   2.167 -19.720
    2    HA3  GLY  10           HA2      GLY  10   2.018   4.805 -19.476
    3    HA2  GLY  10           HA3      GLY  10   0.320   4.370 -19.665

  No H/Q in entry =           3
  In of MODEL   74
    1    H    LEU  11           H        LEU  11  -0.078   2.840 -17.381
    2    HA   LEU  11           HA       LEU  11  -0.559   4.816 -15.408
    3    HB2  LEU  11           HB2      LEU  11  -0.534   1.800 -15.264
    4    HB3  LEU  11           HB3      LEU  11  -1.014   2.824 -13.913
    5    HG   LEU  11           HG       LEU  11  -2.280   2.968 -16.662
    6   HD13  LEU  11          HD11      LEU  11  -2.888   0.830 -15.910
    7   HD12  LEU  11          HD12      LEU  11  -4.217   1.840 -15.346
    8   HD11  LEU  11          HD13      LEU  11  -2.957   1.336 -14.221
    9   HD22  LEU  11          HD21      LEU  11  -2.830   4.988 -15.642
   10   HD21  LEU  11          HD22      LEU  11  -2.748   4.314 -14.014
   11   HD23  LEU  11          HD23      LEU  11  -4.139   3.973 -15.043

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  12           H        ILE  12   1.944   2.313 -15.687
    2    HA   ILE  12           HA       ILE  12   3.184   2.823 -13.194
    3    HB   ILE  12           HB       ILE  12   4.399   1.776 -15.773
    4   HG12  ILE  12          HG12      ILE  12   2.374   0.572 -14.617
    5   HG13  ILE  12          HG13      ILE  12   3.752  -0.383 -15.125
    6   HG23  ILE  12          HG21      ILE  12   6.175   2.473 -14.283
    7   HG22  ILE  12          HG22      ILE  12   6.070   0.715 -14.203
    8   HG21  ILE  12          HG23      ILE  12   5.391   1.700 -12.907
    9   HD12  ILE  12          HD11      ILE  12   2.893  -0.912 -12.824
   10   HD11  ILE  12          HD12      ILE  12   3.365   0.713 -12.330
   11   HD13  ILE  12          HD13      ILE  12   4.580  -0.433 -12.853

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  13           H        ILE  13   3.770   4.090 -16.452
    2    HA   ILE  13           HA       ILE  13   5.940   5.775 -15.744
    3    HB   ILE  13           HB       ILE  13   3.886   5.901 -17.966
    4   HG12  ILE  13          HG12      ILE  13   5.659   4.012 -17.738
    5   HG13  ILE  13          HG13      ILE  13   5.464   4.800 -19.299
    6   HG23  ILE  13          HG21      ILE  13   4.564   8.124 -17.945
    7   HG22  ILE  13          HG22      ILE  13   5.776   7.427 -19.014
    8   HG21  ILE  13          HG23      ILE  13   6.174   7.748 -17.327
    9   HD12  ILE  13          HD11      ILE  13   7.888   4.474 -18.131
   10   HD11  ILE  13          HD12      ILE  13   7.434   6.026 -17.438
   11   HD13  ILE  13          HD13      ILE  13   7.511   5.835 -19.185

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ASN  14           H        ASN  14   2.439   6.323 -15.972
    2    HA   ASN  14           HA       ASN  14   2.445   9.067 -15.324
    3    HB2  ASN  14           HB2      ASN  14   0.518   7.457 -16.140
    4    HB3  ASN  14           HB3      ASN  14   0.213   7.277 -14.417
    5   HD21  ASN  14          HD21      ASN  14  -1.804   8.469 -15.823
    6   HD22  ASN  14          HD22      ASN  14  -1.839  10.142 -15.549

  No H/Q in entry =           6
  In of MODEL   74
    1    H    SER  15           H        SER  15   2.129   6.187 -13.255
    2    HA   SER  15           HA       SER  15   1.869   7.552 -10.798
    3    HB2  SER  15           HB2      SER  15   2.398   5.454  -9.763
    4    HB3  SER  15           HB3      SER  15   1.547   5.052 -11.251
    5    HG   SER  15           HG       SER  15   4.323   4.982 -10.723

  No H/Q in entry =           5
  In of MODEL   74
    1    H    GLY  16           H        GLY  16   4.709   6.420 -12.593
    2    HA3  GLY  16           HA2      GLY  16   6.665   7.140 -10.680
    3    HA2  GLY  16           HA3      GLY  16   6.947   6.940 -12.407

  No H/Q in entry =           3
  In of MODEL   74
    1    H    GLN  17           H        GLN  17   5.275   8.926 -13.444
    2    HA   GLN  17           HA       GLN  17   6.889  11.244 -13.145
    3    HB2  GLN  17           HB2      GLN  17   5.515  10.762 -15.168
    4    HB3  GLN  17           HB3      GLN  17   4.058  11.064 -14.219
    5    HG2  GLN  17           HG2      GLN  17   4.646  13.082 -15.459
    6    HG3  GLN  17           HG3      GLN  17   4.883  13.361 -13.734
    7   HE21  GLN  17          HE21      GLN  17   6.513  13.143 -16.828
    8   HE22  GLN  17          HE22      GLN  17   8.066  13.512 -16.248

  No H/Q in entry =           8
  In of MODEL   74
    1    H    ALA  18           H        ALA  18   3.789  10.264 -11.766
    2    HA   ALA  18           HA       ALA  18   3.111  12.658 -10.483
    3    HB1  ALA  18           HB1      ALA  18   1.945  10.218 -10.703
    4    HB2  ALA  18           HB2      ALA  18   1.426  11.441  -9.545
    5    HB3  ALA  18           HB3      ALA  18   2.504  10.142  -9.032

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ARG  19           H        ARG  19   4.960   9.864  -9.235
    2    HA   ARG  19           HA       ARG  19   5.536  11.005  -6.714
    3    HB2  ARG  19           HB2      ARG  19   5.911   8.598  -7.255
    4    HB3  ARG  19           HB3      ARG  19   7.263   9.070  -8.289
    5    HG2  ARG  19           HG2      ARG  19   8.417  10.087  -6.374
    6    HG3  ARG  19           HG3      ARG  19   7.047   9.713  -5.330
    7    HD2  ARG  19           HD2      ARG  19   8.790   8.053  -4.997
    8    HD3  ARG  19           HD3      ARG  19   7.397   7.293  -5.771
    9    HE   ARG  19           HE       ARG  19   9.091   8.096  -7.833
   10   HH21  ARG  19          HH11      ARG  19  10.623   6.674  -8.706
   11   HH22  ARG  19          HH12      ARG  19  11.160   5.315  -7.781
   12   HH11  ARG  19          HH21      ARG  19   9.165   6.054  -5.064
   13   HH12  ARG  19          HH22      ARG  19  10.332   4.964  -5.718

  No H/Q in entry =          13
  In of MODEL   74
    1    H    SER  20           H        SER  20   7.321  11.022  -9.782
    2    HA   SER  20           HA       SER  20   9.593  12.405  -8.977
    3    HB2  SER  20           HB2      SER  20   9.592  11.538 -11.185
    4    HB3  SER  20           HB3      SER  20   8.096  12.372 -11.593
    5    HG   SER  20           HG       SER  20  10.609  13.563 -11.008

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LEU  21           H        LEU  21   6.498  13.719 -10.136
    2    HA   LEU  21           HA       LEU  21   7.206  16.454  -9.909
    3    HB2  LEU  21           HB2      LEU  21   4.520  15.067  -9.802
    4    HB3  LEU  21           HB3      LEU  21   4.712  16.818  -9.808
    5    HG   LEU  21           HG       LEU  21   5.854  15.004 -11.953
    6   HD13  LEU  21          HD11      LEU  21   3.452  14.795 -12.047
    7   HD12  LEU  21          HD12      LEU  21   3.938  15.901 -13.335
    8   HD11  LEU  21          HD13      LEU  21   3.241  16.535 -11.844
    9   HD21  LEU  21          HD21      LEU  21   5.693  17.978 -11.519
   10   HD23  LEU  21          HD22      LEU  21   5.648  17.371 -13.171
   11   HD22  LEU  21          HD23      LEU  21   7.036  17.030 -12.150

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ALA  22           H        ALA  22   5.689  14.175  -7.653
    2    HA   ALA  22           HA       ALA  22   5.131  15.982  -5.573
    3    HB3  ALA  22           HB1      ALA  22   4.339  13.600  -5.737
    4    HB2  ALA  22           HB2      ALA  22   4.950  14.059  -4.147
    5    HB1  ALA  22           HB3      ALA  22   5.949  13.092  -5.233

  No H/Q in entry =           5
  In of MODEL   74
    1    H    TYR  23           H        TYR  23   8.035  13.923  -6.051
    2    HA   TYR  23           HA       TYR  23   9.454  14.916  -3.809
    3    HB2  TYR  23           HB2      TYR  23  10.206  12.904  -4.982
    4    HB3  TYR  23           HB3      TYR  23  10.512  13.843  -6.442
    5    HD1  TYR  23           HD1      TYR  23  11.517  13.481  -2.865
    6    HD2  TYR  23           HD2      TYR  23  12.556  14.995  -6.749
    7    HE1  TYR  23           HE1      TYR  23  13.791  14.031  -2.043
    8    HE2  TYR  23           HE2      TYR  23  14.829  15.547  -5.926
    9    HH   TYR  23           HH       TYR  23  15.758  14.922  -2.537

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ALA  24           H        ALA  24   9.248  16.038  -7.169
    2    HA   ALA  24           HA       ALA  24  11.171  18.101  -6.935
    3    HB2  ALA  24           HB1      ALA  24  10.705  18.176  -9.139
    4    HB3  ALA  24           HB2      ALA  24   9.163  18.943  -8.760
    5    HB1  ALA  24           HB3      ALA  24   9.267  17.189  -8.898

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ALA  25           H        ALA  25   7.697  17.953  -6.278
    2    HA   ALA  25           HA       ALA  25   7.254  20.674  -5.693
    3    HB1  ALA  25           HB1      ALA  25   5.568  18.695  -5.884
    4    HB2  ALA  25           HB2      ALA  25   5.227  19.983  -4.727
    5    HB3  ALA  25           HB3      ALA  25   5.906  18.453  -4.169

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LEU  26           H        LEU  26   8.314  17.975  -3.665
    2    HA   LEU  26           HA       LEU  26   8.461  19.396  -1.224
    3    HB2  LEU  26           HB2      LEU  26   8.530  16.978  -1.228
    4    HB3  LEU  26           HB3      LEU  26   9.990  16.974  -2.215
    5    HG   LEU  26           HG       LEU  26  11.236  18.072  -0.384
    6   HD12  LEU  26          HD11      LEU  26  10.034  18.084   1.889
    7   HD11  LEU  26          HD12      LEU  26   8.536  17.966   0.970
    8   HD13  LEU  26          HD13      LEU  26   9.593  19.361   0.755
    9   HD21  LEU  26          HD21      LEU  26   9.686  15.617   0.497
   10   HD23  LEU  26          HD22      LEU  26  11.215  16.161   1.180
   11   HD22  LEU  26          HD23      LEU  26  11.145  15.609  -0.492

  No H/Q in entry =          11
  In of MODEL   74
    1    H    LYS  27           H        LYS  27  10.844  18.807  -3.776
    2    HA   LYS  27           HA       LYS  27  13.054  20.021  -2.568
    3    HB2  LYS  27           HB2      LYS  27  13.119  18.680  -4.663
    4    HB3  LYS  27           HB3      LYS  27  12.359  20.023  -5.516
    5    HG2  LYS  27           HG2      LYS  27  14.245  21.488  -4.953
    6    HG3  LYS  27           HG3      LYS  27  15.002  20.184  -4.029
    7    HD2  LYS  27           HD2      LYS  27  15.109  18.803  -6.090
    8    HD3  LYS  27           HD3      LYS  27  14.398  20.132  -7.005
    9    HE2  LYS  27           HE2      LYS  27  16.307  21.576  -6.408
   10    HE3  LYS  27           HE3      LYS  27  17.022  20.251  -5.483
   11    HZ3  LYS  27           HZ1      LYS  27  17.990  20.349  -7.680
   12    HZ2  LYS  27           HZ2      LYS  27  16.454  20.249  -8.404
   13    HZ1  LYS  27           HZ3      LYS  27  17.073  18.929  -7.531

  No H/Q in entry =          13
  In of MODEL   74
    1    H    GLN  28           H        GLN  28  10.425  21.436  -4.483
    2    HA   GLN  28           HA       GLN  28  11.409  24.079  -4.637
    3    HB2  GLN  28           HB2      GLN  28   8.567  23.036  -4.499
    4    HB3  GLN  28           HB3      GLN  28   8.992  24.706  -4.871
    5    HG2  GLN  28           HG2      GLN  28   9.941  22.289  -6.437
    6    HG3  GLN  28           HG3      GLN  28   8.619  23.347  -6.924
    7   HE21  GLN  28          HE21      GLN  28  11.701  22.806  -7.753
    8   HE22  GLN  28          HE22      GLN  28  12.227  24.384  -8.090

  No H/Q in entry =           8
  In of MODEL   74
    1    H    ALA  29           H        ALA  29   9.487  22.397  -2.186
    2    HA   ALA  29           HA       ALA  29   8.977  24.588  -0.490
    3    HB2  ALA  29           HB1      ALA  29   8.250  23.021   1.080
    4    HB1  ALA  29           HB2      ALA  29   9.455  21.827   0.598
    5    HB3  ALA  29           HB3      ALA  29   8.060  22.138  -0.434

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LYS  30           H        LYS  30  11.685  22.295  -0.598
    2    HA   LYS  30           HA       LYS  30  13.037  23.228   1.694
    3    HB2  LYS  30           HB2      LYS  30  14.093  21.941  -0.833
    4    HB3  LYS  30           HB3      LYS  30  15.095  22.285   0.580
    5    HG2  LYS  30           HG2      LYS  30  13.543  20.912   1.971
    6    HG3  LYS  30           HG3      LYS  30  12.638  20.504   0.509
    7    HD2  LYS  30           HD2      LYS  30  14.663  19.502  -0.477
    8    HD3  LYS  30           HD3      LYS  30  15.587  19.924   0.966
    9    HE2  LYS  30           HE2      LYS  30  14.083  18.502   2.332
   10    HE3  LYS  30           HE3      LYS  30  13.189  18.060   0.872
   11    HZ2  LYS  30           HZ1      LYS  30  14.973  16.462   1.607
   12    HZ1  LYS  30           HZ2      LYS  30  16.117  17.640   1.148
   13    HZ3  LYS  30           HZ3      LYS  30  15.062  16.970  -0.008

  No H/Q in entry =          13
  In of MODEL   74
    1    H    GLN  31           H        GLN  31  12.903  24.446  -1.597
    2    HA   GLN  31           HA       GLN  31  15.078  26.317  -1.192
    3    HB2  GLN  31           HB2      GLN  31  13.012  26.391  -3.394
    4    HB3  GLN  31           HB3      GLN  31  14.638  27.071  -3.410
    5    HG2  GLN  31           HG2      GLN  31  15.081  24.369  -2.849
    6    HG3  GLN  31           HG3      GLN  31  13.764  24.332  -4.014
    7   HE21  GLN  31          HE21      GLN  31  16.595  23.513  -4.452
    8   HE22  GLN  31          HE22      GLN  31  17.163  24.486  -5.721

  No H/Q in entry =           8
  In of MODEL   74
    1    H    GLY  32           H        GLY  32  12.015  26.159  -0.014
    2    HA3  GLY  32           HA2      GLY  32  10.888  27.734   1.278
    3    HA2  GLY  32           HA3      GLY  32  12.019  28.961   0.720

  No H/Q in entry =           3
  In of MODEL   74
    1    H    ASP  33           H        ASP  33  10.609  27.079  -1.764
    2    HA   ASP  33           HA       ASP  33   8.957  29.370  -2.593
    3    HB2  ASP  33           HB2      ASP  33  10.012  26.946  -4.056
    4    HB3  ASP  33           HB3      ASP  33   8.863  28.075  -4.770

  No H/Q in entry =           4
  In of MODEL   74
    1    H    PHE  34           H        PHE  34   7.282  28.905  -1.013
    2    HA   PHE  34           HA       PHE  34   5.880  26.445  -0.911
    3    HB2  PHE  34           HB2      PHE  34   4.953  29.239  -0.211
    4    HB3  PHE  34           HB3      PHE  34   4.094  27.755   0.204
    5    HD1  PHE  34           HD1      PHE  34   6.380  30.128   1.403
    6    HD2  PHE  34           HD2      PHE  34   5.659  25.893   1.341
    7    HE1  PHE  34           HE1      PHE  34   7.791  29.856   3.423
    8    HE2  PHE  34           HE2      PHE  34   7.072  25.626   3.360
    9    HZ   PHE  34           HZ       PHE  34   8.132  27.609   4.400

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ALA  35           H        ALA  35   5.455  29.320  -2.907
    2    HA   ALA  35           HA       ALA  35   2.886  28.734  -3.906
    3    HB1  ALA  35           HB1      ALA  35   3.929  30.124  -5.950
    4    HB3  ALA  35           HB2      ALA  35   5.164  30.469  -4.739
    5    HB2  ALA  35           HB3      ALA  35   3.480  30.893  -4.428

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ALA  36           H        ALA  36   6.093  28.035  -5.298
    2    HA   ALA  36           HA       ALA  36   5.067  26.624  -7.536
    3    HB3  ALA  36           HB1      ALA  36   7.220  26.730  -8.175
    4    HB2  ALA  36           HB2      ALA  36   7.707  25.692  -6.833
    5    HB1  ALA  36           HB3      ALA  36   7.620  27.440  -6.611

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ALA  37           H        ALA  37   6.049  25.609  -4.295
    2    HA   ALA  37           HA       ALA  37   5.960  22.823  -4.734
    3    HB2  ALA  37           HB1      ALA  37   5.741  24.607  -2.346
    4    HB1  ALA  37           HB2      ALA  37   6.859  23.280  -2.656
    5    HB3  ALA  37           HB3      ALA  37   5.200  22.940  -2.168

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LYS  38           H        LYS  38   3.460  25.050  -3.530
    2    HA   LYS  38           HA       LYS  38   1.347  23.255  -3.291
    3    HB2  LYS  38           HB2      LYS  38   1.727  26.007  -3.034
    4    HB3  LYS  38           HB3      LYS  38   0.512  25.876  -4.300
    5    HG2  LYS  38           HG2      LYS  38  -0.934  24.561  -2.846
    6    HG3  LYS  38           HG3      LYS  38   0.323  24.484  -1.604
    7    HD2  LYS  38           HD2      LYS  38   0.164  26.821  -1.146
    8    HD3  LYS  38           HD3      LYS  38  -0.761  27.124  -2.617
    9    HE2  LYS  38           HE2      LYS  38  -2.243  27.164  -0.661
   10    HE3  LYS  38           HE3      LYS  38  -2.641  25.796  -1.704
   11    HZ3  LYS  38           HZ1      LYS  38  -1.912  24.313  -0.185
   12    HZ2  LYS  38           HZ2      LYS  38  -2.240  25.569   0.913
   13    HZ1  LYS  38           HZ3      LYS  38  -0.653  25.305   0.369

  No H/Q in entry =          13
  In of MODEL   74
    1    H    ALA  39           H        ALA  39   2.313  25.159  -6.143
    2    HA   ALA  39           HA       ALA  39   0.211  24.317  -7.826
    3    HB2  ALA  39           HB1      ALA  39   2.941  24.944  -8.908
    4    HB1  ALA  39           HB2      ALA  39   1.995  26.211  -8.128
    5    HB3  ALA  39           HB3      ALA  39   1.359  25.385  -9.550

  No H/Q in entry =           5
  In of MODEL   74
    1    H    MET  40           H        MET  40   3.443  22.987  -7.287
    2    HA   MET  40           HA       MET  40   3.304  20.975  -9.285
    3    HB2  MET  40           HB2      MET  40   4.946  21.174  -6.753
    4    HB3  MET  40           HB3      MET  40   5.172  19.920  -7.975
    5    HG2  MET  40           HG2      MET  40   5.249  22.878  -8.630
    6    HG3  MET  40           HG3      MET  40   6.692  21.961  -8.200
    7    HE3  MET  40           HE1      MET  40   7.513  19.748 -11.026
    8    HE2  MET  40           HE2      MET  40   6.964  19.428  -9.383
    9    HE1  MET  40           HE3      MET  40   8.069  20.766  -9.690

  No H/Q in entry =           9
  In of MODEL   74
    1    H    MET  41           H        MET  41   2.427  21.013  -5.851
    2    HA   MET  41           HA       MET  41   1.873  18.252  -5.577
    3    HB2  MET  41           HB2      MET  41   0.577  20.616  -4.203
    4    HB3  MET  41           HB3      MET  41   0.411  18.938  -3.699
    5    HG2  MET  41           HG2      MET  41   3.123  19.137  -3.766
    6    HG3  MET  41           HG3      MET  41   2.702  20.798  -3.359
    7    HE2  MET  41           HE1      MET  41  -0.330  19.566  -1.605
    8    HE1  MET  41           HE2      MET  41   0.496  21.073  -1.986
    9    HE3  MET  41           HE3      MET  41   0.450  20.497  -0.319

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ASP  42           H        ASP  42  -0.151  20.998  -6.519
    2    HA   ASP  42           HA       ASP  42  -2.605  19.660  -6.634
    3    HB2  ASP  42           HB2      ASP  42  -1.879  22.225  -6.889
    4    HB3  ASP  42           HB3      ASP  42  -2.052  21.837  -8.597

  No H/Q in entry =           4
  In of MODEL   74
    1    H    GLN  43           H        GLN  43  -0.187  20.238  -9.160
    2    HA   GLN  43           HA       GLN  43  -1.608  18.939 -11.239
    3    HB2  GLN  43           HB2      GLN  43   1.358  19.428 -10.887
    4    HB3  GLN  43           HB3      GLN  43   0.623  18.800 -12.364
    5    HG2  GLN  43           HG2      GLN  43  -0.871  20.840 -12.382
    6    HG3  GLN  43           HG3      GLN  43   0.102  21.483 -11.062
    7   HE21  GLN  43          HE21      GLN  43   0.254  23.109 -13.144
    8   HE22  GLN  43          HE22      GLN  43   1.657  22.879 -14.068

  No H/Q in entry =           8
  In of MODEL   74
    1    H    SER  44           H        SER  44   0.758  17.769  -8.878
    2    HA   SER  44           HA       SER  44   1.059  15.164  -9.916
    3    HB2  SER  44           HB2      SER  44   1.991  16.587  -7.685
    4    HB3  SER  44           HB3      SER  44   1.124  15.208  -7.009
    5    HG   SER  44           HG       SER  44   3.225  14.572  -7.461

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ARG  45           H        ARG  45  -1.223  16.493  -7.548
    2    HA   ARG  45           HA       ARG  45  -2.623  14.142  -6.907
    3    HB2  ARG  45           HB2      ARG  45  -2.790  16.307  -5.705
    4    HB3  ARG  45           HB3      ARG  45  -3.655  16.986  -7.080
    5    HG2  ARG  45           HG2      ARG  45  -5.433  15.274  -6.784
    6    HG3  ARG  45           HG3      ARG  45  -4.578  14.650  -5.372
    7    HD2  ARG  45           HD2      ARG  45  -4.754  16.915  -4.306
    8    HD3  ARG  45           HD3      ARG  45  -5.752  17.448  -5.675
    9    HE   ARG  45           HE       ARG  45  -6.870  15.077  -4.632
   10   HH21  ARG  45          HH11      ARG  45  -8.691  15.163  -3.341
   11   HH22  ARG  45          HH12      ARG  45  -9.065  16.603  -2.462
   12   HH11  ARG  45          HH21      ARG  45  -6.286  18.315  -3.602
   13   HH12  ARG  45          HH22      ARG  45  -7.698  18.388  -2.609

  No H/Q in entry =          13
  In of MODEL   74
    1    H    MET  46           H        MET  46  -3.215  16.560  -9.442
    2    HA   MET  46           HA       MET  46  -5.575  15.411 -10.483
    3    HB2  MET  46           HB2      MET  46  -3.472  17.227 -11.670
    4    HB3  MET  46           HB3      MET  46  -4.864  16.682 -12.610
    5    HG2  MET  46           HG2      MET  46  -6.392  17.618 -10.946
    6    HG3  MET  46           HG3      MET  46  -5.036  18.101  -9.935
    7    HE1  MET  46           HE1      MET  46  -6.713  18.115 -13.147
    8    HE3  MET  46           HE2      MET  46  -5.414  18.762 -14.142
    9    HE2  MET  46           HE3      MET  46  -6.769  19.796 -13.694

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ALA  47           H        ALA  47  -2.159  14.907 -11.279
    2    HA   ALA  47           HA       ALA  47  -2.542  13.190 -13.492
    3    HB3  ALA  47           HB1      ALA  47  -0.353  14.062 -13.161
    4    HB2  ALA  47           HB2      ALA  47  -0.222  12.331 -12.835
    5    HB1  ALA  47           HB3      ALA  47  -0.291  13.479 -11.496

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LEU  48           H        LEU  48  -2.239  12.540 -10.024
    2    HA   LEU  48           HA       LEU  48  -2.358   9.702 -10.191
    3    HB2  LEU  48           HB2      LEU  48  -3.083  11.617  -7.962
    4    HB3  LEU  48           HB3      LEU  48  -3.001   9.865  -7.769
    5    HG   LEU  48           HG       LEU  48  -0.699  11.550  -8.785
    6   HD13  LEU  48          HD11      LEU  48  -0.952  12.315  -6.589
    7   HD12  LEU  48          HD12      LEU  48   0.203  10.997  -6.407
    8   HD11  LEU  48          HD13      LEU  48  -1.493  10.747  -5.992
    9   HD22  LEU  48          HD21      LEU  48  -0.225   9.363  -9.439
   10   HD21  LEU  48          HD22      LEU  48  -1.085   8.650  -8.076
   11   HD23  LEU  48          HD23      LEU  48   0.496   9.390  -7.830

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ASN  49           H        ASN  49  -4.797  12.211  -9.754
    2    HA   ASN  49           HA       ASN  49  -6.990  10.562  -9.197
    3    HB2  ASN  49           HB2      ASN  49  -7.050  12.971  -8.853
    4    HB3  ASN  49           HB3      ASN  49  -6.857  13.258 -10.577
    5   HD21  ASN  49          HD21      ASN  49  -9.096  11.732  -8.232
    6   HD22  ASN  49          HD22      ASN  49 -10.492  12.009  -9.153

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLU  50           H        GLU  50  -5.734  11.760 -12.294
    2    HA   GLU  50           HA       GLU  50  -7.716  10.526 -13.923
    3    HB2  GLU  50           HB2      GLU  50  -6.245  12.336 -14.746
    4    HB3  GLU  50           HB3      GLU  50  -4.858  11.253 -14.627
    5    HG2  GLU  50           HG2      GLU  50  -5.861   9.731 -16.258
    6    HG3  GLU  50           HG3      GLU  50  -7.314  10.721 -16.327

  No H/Q in entry =           6
  In of MODEL   74
    1    H    ALA  51           H        ALA  51  -4.540   9.504 -12.755
    2    HA   ALA  51           HA       ALA  51  -4.435   7.056 -14.183
    3    HB2  ALA  51           HB1      ALA  51  -2.445   6.748 -13.105
    4    HB1  ALA  51           HB2      ALA  51  -3.113   7.170 -11.529
    5    HB3  ALA  51           HB3      ALA  51  -2.659   8.442 -12.663

  No H/Q in entry =           5
  In of MODEL   74
    1    H    HIS  52           H        HIS  52  -5.567   7.885 -10.919
    2    HA   HIS  52           HA       HIS  52  -6.264   5.277 -10.089
    3    HB2  HIS  52           HB2      HIS  52  -6.096   7.194  -8.551
    4    HB3  HIS  52           HB3      HIS  52  -7.514   7.921  -9.306
    5    HD1  HIS  52           HD1      HIS  52  -9.786   6.474  -9.123
    6    HD2  HIS  52           HD2      HIS  52  -6.689   5.311  -6.587
    7    HE1  HIS  52           HE1      HIS  52 -10.832   5.010  -7.341
    8    HE2  HIS  52           HE2      HIS  52  -8.956   4.292  -5.786

  No H/Q in entry =           8
  In of MODEL   74
    1    H    LEU  53           H        LEU  53  -8.083   7.756 -11.849
    2    HA   LEU  53           HA       LEU  53 -10.599   6.485 -11.840
    3    HB2  LEU  53           HB2      LEU  53  -9.320   8.460 -13.719
    4    HB3  LEU  53           HB3      LEU  53 -10.929   7.811 -14.021
    5    HG   LEU  53           HG       LEU  53 -10.167   9.109 -11.385
    6   HD11  LEU  53          HD11      LEU  53 -11.258  10.320 -13.930
    7   HD13  LEU  53          HD12      LEU  53  -9.879  10.856 -12.968
    8   HD12  LEU  53          HD13      LEU  53 -11.519  11.068 -12.360
    9   HD23  LEU  53          HD21      LEU  53 -12.747   9.528 -11.483
   10   HD22  LEU  53          HD22      LEU  53 -12.175   7.919 -11.062
   11   HD21  LEU  53          HD23      LEU  53 -12.760   8.241 -12.682

  No H/Q in entry =          11
  In of MODEL   74
    1    H    VAL  54           H        VAL  54  -7.874   6.273 -14.106
    2    HA   VAL  54           HA       VAL  54  -9.130   4.519 -15.943
    3    HB   VAL  54           HB       VAL  54  -6.212   4.999 -15.289
    4   HG12  VAL  54          HG11      VAL  54  -5.999   3.920 -17.684
    5   HG11  VAL  54          HG12      VAL  54  -7.529   3.151 -17.268
    6   HG13  VAL  54          HG13      VAL  54  -6.105   2.881 -16.265
    7   HG22  VAL  54          HG21      VAL  54  -6.976   6.952 -16.319
    8   HG21  VAL  54          HG22      VAL  54  -8.186   6.102 -17.277
    9   HG23  VAL  54          HG23      VAL  54  -6.485   6.009 -17.726

  No H/Q in entry =           9
  In of MODEL   74
    1    H    GLN  55           H        GLN  55  -7.106   3.945 -13.066
    2    HA   GLN  55           HA       GLN  55  -7.043   1.129 -13.333
    3    HB2  GLN  55           HB2      GLN  55  -5.464   2.006 -11.827
    4    HB3  GLN  55           HB3      GLN  55  -6.664   2.980 -10.982
    5    HG2  GLN  55           HG2      GLN  55  -7.354   1.223  -9.663
    6    HG3  GLN  55           HG3      GLN  55  -7.153   0.039 -10.948
    7   HE21  GLN  55          HE21      GLN  55  -5.537  -1.426 -10.476
    8   HE22  GLN  55          HE22      GLN  55  -4.140  -1.090  -9.577

  No H/Q in entry =           8
  In of MODEL   74
    1    H    THR  56           H        THR  56  -9.339   3.306 -11.687
    2    HA   THR  56           HA       THR  56 -10.926   1.432 -10.388
    3    HB   THR  56           HB       THR  56 -12.016   3.834 -11.874
    4    HG1  THR  56           HG1      THR  56 -10.245   3.649  -9.822
    5   HG22  THR  56          HG21      THR  56 -13.521   3.831  -9.806
    6   HG21  THR  56          HG22      THR  56 -12.891   2.216  -9.478
    7   HG23  THR  56          HG23      THR  56 -13.786   2.530 -10.966

  No H/Q in entry =           7
  In of MODEL   74
    1    H    LYS  57           H        LYS  57 -11.153   2.528 -13.768
    2    HA   LYS  57           HA       LYS  57 -13.332   0.863 -14.505
    3    HB2  LYS  57           HB2      LYS  57 -12.459   2.809 -15.827
    4    HB3  LYS  57           HB3      LYS  57 -11.024   1.866 -16.206
    5    HG2  LYS  57           HG2      LYS  57 -12.399   0.193 -17.358
    6    HG3  LYS  57           HG3      LYS  57 -13.860   1.085 -16.946
    7    HD2  LYS  57           HD2      LYS  57 -13.036   3.024 -18.253
    8    HD3  LYS  57           HD3      LYS  57 -11.592   2.112 -18.689
    9    HE2  LYS  57           HE2      LYS  57 -13.010   0.402 -19.795
   10    HE3  LYS  57           HE3      LYS  57 -14.454   1.326 -19.384
   11    HZ3  LYS  57           HZ1      LYS  57 -14.095   2.740 -21.041
   12    HZ2  LYS  57           HZ2      LYS  57 -12.988   1.600 -21.644
   13    HZ1  LYS  57           HZ3      LYS  57 -12.442   2.898 -20.690

  No H/Q in entry =          13
  In of MODEL   74
    1    H    LEU  58           H        LEU  58  -9.831   0.401 -14.485
    2    HA   LEU  58           HA       LEU  58  -9.874  -2.112 -15.782
    3    HB2  LEU  58           HB2      LEU  58  -7.811  -0.844 -13.991
    4    HB3  LEU  58           HB3      LEU  58  -7.572  -2.365 -14.852
    5    HG   LEU  58           HG       LEU  58  -8.316   0.251 -16.200
    6   HD11  LEU  58          HD11      LEU  58  -5.674  -1.012 -15.540
    7   HD13  LEU  58          HD12      LEU  58  -6.154   0.683 -15.480
    8   HD12  LEU  58          HD13      LEU  58  -5.837  -0.086 -17.032
    9   HD22  LEU  58          HD21      LEU  58  -8.922  -1.301 -17.790
   10   HD21  LEU  58          HD22      LEU  58  -7.885  -2.560 -17.123
   11   HD23  LEU  58          HD23      LEU  58  -7.193  -1.289 -18.131

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  59           H        ILE  59 -10.655  -1.213 -12.520
    2    HA   ILE  59           HA       ILE  59 -10.318  -3.986 -11.585
    3    HB   ILE  59           HB       ILE  59  -9.845  -1.723 -10.185
    4   HG12  ILE  59          HG12      ILE  59 -11.200  -4.085  -8.864
    5   HG13  ILE  59          HG13      ILE  59  -9.558  -4.149  -9.454
    6   HG22  ILE  59          HG21      ILE  59 -12.602  -2.440  -9.225
    7   HG21  ILE  59          HG22      ILE  59 -12.377  -1.181 -10.417
    8   HG23  ILE  59          HG23      ILE  59 -11.646  -1.036  -8.821
    9   HD11  ILE  59          HD11      ILE  59 -10.579  -2.130  -7.468
   10   HD13  ILE  59          HD12      ILE  59  -8.913  -2.286  -8.009
   11   HD12  ILE  59          HD13      ILE  59  -9.651  -3.565  -7.043

  No H/Q in entry =          11
  In of MODEL   74
    1    H    GLU  60           H        GLU  60 -12.864  -1.646 -12.360
    2    HA   GLU  60           HA       GLU  60 -15.052  -3.147 -11.330
    3    HB2  GLU  60           HB2      GLU  60 -16.384  -1.533 -12.301
    4    HB3  GLU  60           HB3      GLU  60 -14.852  -0.665 -12.280
    5    HG2  GLU  60           HG2      GLU  60 -15.595  -0.369 -14.493
    6    HG3  GLU  60           HG3      GLU  60 -14.483  -1.716 -14.631

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLY  61           H        GLY  61 -13.410  -3.136 -14.461
    2    HA3  GLY  61           HA2      GLY  61 -15.150  -5.363 -15.341
    3    HA2  GLY  61           HA3      GLY  61 -14.307  -4.262 -16.424

  No H/Q in entry =           3
  In of MODEL   74
    1    H    ASP  62           H        ASP  62 -12.918  -5.733 -13.558
    2    HA   ASP  62           HA       ASP  62 -10.624  -6.638 -14.960
    3    HB2  ASP  62           HB2      ASP  62 -10.055  -7.691 -12.783
    4    HB3  ASP  62           HB3      ASP  62 -10.527  -6.004 -12.615

  No H/Q in entry =           4
  In of MODEL   74
    1    H    ALA  63           H        ALA  63 -13.604  -8.315 -13.946
    2    HA   ALA  63           HA       ALA  63 -12.654 -10.970 -14.560
    3    HB1  ALA  63           HB1      ALA  63 -15.162 -11.477 -14.514
    4    HB3  ALA  63           HB2      ALA  63 -15.411  -9.764 -14.177
    5    HB2  ALA  63           HB3      ALA  63 -14.507 -10.766 -13.039

  No H/Q in entry =           5
  In of MODEL   74
    1    H    GLY  64           H        GLY  64 -15.627 -10.549 -15.982
    2    HA3  GLY  64           HA2      GLY  64 -16.415 -10.494 -18.142
    3    HA2  GLY  64           HA3      GLY  64 -14.895  -9.757 -18.629

  No H/Q in entry =           3
  In of MODEL   74
    1    H    GLU  65           H        GLU  65 -12.979 -11.515 -18.240
    2    HA   GLU  65           HA       GLU  65 -13.406 -13.443 -20.262
    3    HB2  GLU  65           HB2      GLU  65 -11.171 -13.125 -18.263
    4    HB3  GLU  65           HB3      GLU  65 -11.153 -14.305 -19.574
    5    HG2  GLU  65           HG2      GLU  65 -11.367 -12.528 -21.231
    6    HG3  GLU  65           HG3      GLU  65 -11.505 -11.320 -19.955

  No H/Q in entry =           6
  In of MODEL   74
    1    H    GLY  66           H        GLY  66 -13.349 -13.658 -16.790
    2    HA3  GLY  66           HA2      GLY  66 -14.760 -16.193 -16.830
    3    HA2  GLY  66           HA3      GLY  66 -13.184 -16.213 -16.065

  No H/Q in entry =           3
  In of MODEL   74
    1    H    LYS  67           H        LYS  67 -14.197 -16.849 -14.132
    2    HA   LYS  67           HA       LYS  67 -16.059 -15.038 -12.843
    3    HB2  LYS  67           HB2      LYS  67 -15.771 -16.919 -11.009
    4    HB3  LYS  67           HB3      LYS  67 -16.733 -17.196 -12.467
    5    HG2  LYS  67           HG2      LYS  67 -14.868 -18.273 -13.573
    6    HG3  LYS  67           HG3      LYS  67 -13.781 -17.849 -12.252
    7    HD2  LYS  67           HD2      LYS  67 -15.056 -19.288 -10.719
    8    HD3  LYS  67           HD3      LYS  67 -16.178 -19.693 -12.022
    9    HE2  LYS  67           HE2      LYS  67 -14.641 -21.497 -12.014
   10    HE3  LYS  67           HE3      LYS  67 -14.086 -20.462 -13.330
   11    HZ2  LYS  67           HZ1      LYS  67 -12.811 -21.092 -10.829
   12    HZ1  LYS  67           HZ2      LYS  67 -12.815 -19.432 -11.186
   13    HZ3  LYS  67           HZ3      LYS  67 -12.135 -20.537 -12.281

  No H/Q in entry =          13
  In of MODEL   74
    1    H    MET  68           H        MET  68 -13.892 -16.765 -10.867
    2    HA   MET  68           HA       MET  68 -13.246 -14.592  -9.203
    3    HB2  MET  68           HB2      MET  68 -12.190 -17.391  -9.475
    4    HB3  MET  68           HB3      MET  68 -11.524 -16.265  -8.293
    5    HG2  MET  68           HG2      MET  68 -14.474 -16.914  -8.514
    6    HG3  MET  68           HG3      MET  68 -13.374 -17.715  -7.389
    7    HE3  MET  68           HE1      MET  68 -16.135 -15.364  -6.499
    8    HE2  MET  68           HE2      MET  68 -15.320 -15.791  -4.996
    9    HE1  MET  68           HE3      MET  68 -15.495 -16.998  -6.269

  No H/Q in entry =           9
  In of MODEL   74
    1    H    LYS  69           H        LYS  69 -11.343 -16.101 -11.823
    2    HA   LYS  69           HA       LYS  69  -8.907 -14.843 -11.226
    3    HB2  LYS  69           HB2      LYS  69  -9.929 -15.868 -13.880
    4    HB3  LYS  69           HB3      LYS  69  -8.245 -15.484 -13.520
    5    HG2  LYS  69           HG2      LYS  69  -9.776 -17.367 -11.740
    6    HG3  LYS  69           HG3      LYS  69  -9.061 -17.955 -13.240
    7    HD2  LYS  69           HD2      LYS  69  -6.853 -17.088 -12.505
    8    HD3  LYS  69           HD3      LYS  69  -7.580 -16.575 -10.981
    9    HE2  LYS  69           HE2      LYS  69  -8.226 -18.909 -10.502
   10    HE3  LYS  69           HE3      LYS  69  -7.498 -19.423 -12.022
   11    HZ2  LYS  69           HZ1      LYS  69  -6.055 -19.706 -10.037
   12    HZ1  LYS  69           HZ2      LYS  69  -6.008 -18.016  -9.878
   13    HZ3  LYS  69           HZ3      LYS  69  -5.363 -18.761 -11.264

  No H/Q in entry =          13
  In of MODEL   74
    1    H    VAL  70           H        VAL  70  -7.853 -13.005 -11.812
    2    HA   VAL  70           HA       VAL  70  -9.277 -11.043 -13.515
    3    HB   VAL  70           HB       VAL  70  -8.527  -9.275 -11.956
    4   HG13  VAL  70          HG11      VAL  70 -10.780 -10.172 -11.703
    5   HG12  VAL  70          HG12      VAL  70 -10.106  -9.864 -10.103
    6   HG11  VAL  70          HG13      VAL  70 -10.170 -11.510 -10.731
    7   HG22  VAL  70          HG21      VAL  70  -6.660 -10.010 -10.775
    8   HG21  VAL  70          HG22      VAL  70  -7.297 -11.645 -10.604
    9   HG23  VAL  70          HG23      VAL  70  -7.907 -10.350  -9.576

  No H/Q in entry =           9
  In of MODEL   74
    1    H    SER  71           H        SER  71  -7.780  -9.286 -14.237
    2    HA   SER  71           HA       SER  71  -5.517 -10.320 -15.576
    3    HB2  SER  71           HB2      SER  71  -6.830  -8.263 -16.236
    4    HB3  SER  71           HB3      SER  71  -6.049  -7.419 -14.902
    5    HG   SER  71           HG       SER  71  -4.388  -8.854 -16.593

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LEU  72           H        LEU  72  -3.521 -10.652 -14.917
    2    HA   LEU  72           HA       LEU  72  -2.772 -10.452 -12.213
    3    HB2  LEU  72           HB2      LEU  72  -1.144 -10.886 -14.712
    4    HB3  LEU  72           HB3      LEU  72  -0.471 -10.975 -13.088
    5    HG   LEU  72           HG       LEU  72  -2.842 -12.639 -13.994
    6   HD13  LEU  72          HD11      LEU  72  -1.320 -14.464 -14.361
    7   HD12  LEU  72          HD12      LEU  72   0.036 -13.535 -13.724
    8   HD11  LEU  72          HD13      LEU  72  -0.690 -13.086 -15.267
    9   HD22  LEU  72          HD21      LEU  72  -2.855 -12.656 -11.645
   10   HD21  LEU  72          HD22      LEU  72  -1.106 -12.546 -11.523
   11   HD23  LEU  72          HD23      LEU  72  -1.862 -14.060 -12.012

  No H/Q in entry =          11
  In of MODEL   74
    1    H    VAL  73           H        VAL  73  -2.064  -8.434 -14.995
    2    HA   VAL  73           HA       VAL  73  -0.117  -6.757 -13.906
    3    HB   VAL  73           HB       VAL  73  -0.470  -5.366 -15.768
    4   HG12  VAL  73          HG11      VAL  73  -1.577  -7.959 -16.821
    5   HG11  VAL  73          HG12      VAL  73   0.053  -7.900 -16.150
    6   HG13  VAL  73          HG13      VAL  73  -0.366  -6.896 -17.538
    7   HG23  VAL  73          HG21      VAL  73  -2.645  -5.602 -17.105
    8   HG22  VAL  73          HG22      VAL  73  -2.774  -4.783 -15.550
    9   HG21  VAL  73          HG23      VAL  73  -3.290  -6.462 -15.707

  No H/Q in entry =           9
  In of MODEL   74
    1    H    LEU  74           H        LEU  74  -3.509  -6.842 -13.315
    2    HA   LEU  74           HA       LEU  74  -4.096  -4.182 -12.689
    3    HB2  LEU  74           HB2      LEU  74  -5.840  -5.834 -12.851
    4    HB3  LEU  74           HB3      LEU  74  -5.147  -6.762 -11.525
    5    HG   LEU  74           HG       LEU  74  -5.584  -4.886  -9.978
    6   HD12  LEU  74          HD11      LEU  74  -7.169  -3.087 -10.944
    7   HD11  LEU  74          HD12      LEU  74  -6.581  -3.602 -12.523
    8   HD13  LEU  74          HD13      LEU  74  -5.455  -2.945 -11.333
    9   HD23  LEU  74          HD21      LEU  74  -8.155  -5.267 -11.419
   10   HD22  LEU  74          HD22      LEU  74  -7.768  -5.440  -9.721
   11   HD21  LEU  74          HD23      LEU  74  -7.317  -6.703 -10.840

  No H/Q in entry =          11
  In of MODEL   74
    1    H    VAL  75           H        VAL  75  -3.059  -6.784 -10.545
    2    HA   VAL  75           HA       VAL  75  -2.822  -5.242  -8.199
    3    HB   VAL  75           HB       VAL  75  -1.362  -7.751  -9.013
    4   HG12  VAL  75          HG11      VAL  75  -0.875  -7.912  -6.543
    5   HG11  VAL  75          HG12      VAL  75  -1.517  -6.288  -6.352
    6   HG13  VAL  75          HG13      VAL  75  -0.066  -6.547  -7.305
    7   HG23  VAL  75          HG21      VAL  75  -3.647  -7.295  -7.067
    8   HG22  VAL  75          HG22      VAL  75  -3.029  -8.844  -7.641
    9   HG21  VAL  75          HG23      VAL  75  -3.894  -7.776  -8.747

  No H/Q in entry =           9
  In of MODEL   74
    1    H    GLU  76           H        GLU  76  -0.446  -6.018 -10.761
    2    HA   GLU  76           HA       GLU  76   1.764  -4.695  -9.621
    3    HB2  GLU  76           HB2      GLU  76   1.926  -6.168 -11.613
    4    HB3  GLU  76           HB3      GLU  76   1.027  -4.991 -12.556
    5    HG2  GLU  76           HG2      GLU  76   3.360  -4.683 -13.069
    6    HG3  GLU  76           HG3      GLU  76   2.877  -3.314 -12.085

  No H/Q in entry =           6
  In of MODEL   74
    1    H    ALA  77           H        ALA  77  -0.778  -3.463 -11.782
    2    HA   ALA  77           HA       ALA  77   0.236  -0.826 -11.960
    3    HB3  ALA  77           HB1      ALA  77  -2.562  -1.938 -12.272
    4    HB1  ALA  77           HB2      ALA  77  -1.413  -1.544 -13.550
    5    HB2  ALA  77           HB3      ALA  77  -2.147  -0.254 -12.597

  No H/Q in entry =           5
  In of MODEL   74
    1    H    GLN  78           H        GLN  78  -2.025  -2.367  -9.731
    2    HA   GLN  78           HA       GLN  78  -2.797  -0.044  -8.316
    3    HB2  GLN  78           HB2      GLN  78  -3.927  -2.295  -8.227
    4    HB3  GLN  78           HB3      GLN  78  -2.586  -2.868  -7.238
    5    HG2  GLN  78           HG2      GLN  78  -3.072  -1.132  -5.565
    6    HG3  GLN  78           HG3      GLN  78  -4.412  -0.549  -6.552
    7   HE21  GLN  78          HE21      GLN  78  -4.902  -1.504  -3.912
    8   HE22  GLN  78          HE22      GLN  78  -5.764  -2.963  -4.015

  No H/Q in entry =           8
  In of MODEL   74
    1    H    LEU  79           H        LEU  79  -0.135  -2.326  -7.898
    2    HA   LEU  79           HA       LEU  79   0.873  -1.444  -5.448
    3    HB2  LEU  79           HB2      LEU  79   1.715  -3.458  -6.530
    4    HB3  LEU  79           HB3      LEU  79   2.356  -2.508  -7.866
    5    HG   LEU  79           HG       LEU  79   3.936  -1.387  -6.375
    6   HD13  LEU  79          HD11      LEU  79   2.954  -1.139  -4.297
    7   HD12  LEU  79          HD12      LEU  79   4.024  -2.499  -3.968
    8   HD11  LEU  79          HD13      LEU  79   2.313  -2.782  -4.282
    9   HD23  LEU  79          HD21      LEU  79   5.137  -3.548  -5.489
   10   HD22  LEU  79          HD22      LEU  79   4.918  -3.342  -7.224
   11   HD21  LEU  79          HD23      LEU  79   3.840  -4.405  -6.325

  No H/Q in entry =          11
  In of MODEL   74
    1    H    HIS  80           H        HIS  80   1.721  -0.326  -8.726
    2    HA   HIS  80           HA       HIS  80   3.554   1.644  -7.816
    3    HB2  HIS  80           HB2      HIS  80   2.234   0.967 -10.388
    4    HB3  HIS  80           HB3      HIS  80   2.844   2.614 -10.219
    5    HD1  HIS  80           HD1      HIS  80   5.243   2.896 -10.763
    6    HD2  HIS  80           HD2      HIS  80   4.403  -1.011  -9.574
    7    HE1  HIS  80           HE1      HIS  80   7.421   1.601 -10.953
    8    HE2  HIS  80           HE2      HIS  80   6.920  -0.783 -10.232

  No H/Q in entry =           8
  In of MODEL   74
    1    H    LEU  81           H        LEU  81   0.143   1.834  -8.763
    2    HA   LEU  81           HA       LEU  81  -0.107   4.628  -8.422
    3    HB2  LEU  81           HB2      LEU  81  -2.139   2.398  -8.329
    4    HB3  LEU  81           HB3      LEU  81  -2.577   4.104  -8.228
    5    HG   LEU  81           HG       LEU  81  -0.914   2.948 -10.483
    6   HD12  LEU  81          HD11      LEU  81  -3.156   3.288 -11.760
    7   HD11  LEU  81          HD12      LEU  81  -3.897   3.221 -10.162
    8   HD13  LEU  81          HD13      LEU  81  -2.970   1.848 -10.762
    9   HD23  LEU  81          HD21      LEU  81  -2.005   5.103 -11.564
   10   HD22  LEU  81          HD22      LEU  81  -0.577   5.260 -10.544
   11   HD21  LEU  81          HD23      LEU  81  -2.173   5.619  -9.888

  No H/Q in entry =          11
  In of MODEL   74
    1    H    MET  82           H        MET  82  -0.765   1.939  -6.174
    2    HA   MET  82           HA       MET  82  -1.786   3.527  -4.073
    3    HB2  MET  82           HB2      MET  82  -0.433   0.831  -4.132
    4    HB3  MET  82           HB3      MET  82  -0.992   1.556  -2.627
    5    HG2  MET  82           HG2      MET  82  -2.751   1.082  -5.053
    6    HG3  MET  82           HG3      MET  82  -2.668   0.003  -3.662
    7    HE3  MET  82           HE1      MET  82  -4.351   1.657  -0.826
    8    HE2  MET  82           HE2      MET  82  -2.621   1.923  -1.026
    9    HE1  MET  82           HE3      MET  82  -3.325   0.372  -1.478

  No H/Q in entry =           9
  In of MODEL   74
    1    H    THR  83           H        THR  83   1.500   2.420  -4.796
    2    HA   THR  83           HA       THR  83   2.747   3.508  -2.504
    3    HB   THR  83           HB       THR  83   4.828   3.442  -3.998
    4    HG1  THR  83           HG1      THR  83   4.565   2.923  -6.021
    5   HG22  THR  83          HG21      THR  83   4.361   0.788  -4.333
    6   HG21  THR  83          HG22      THR  83   3.085   1.174  -3.180
    7   HG23  THR  83          HG23      THR  83   4.771   1.504  -2.775

  No H/Q in entry =           7
  In of MODEL   74
    1    H    SER  84           H        SER  84   2.355   4.800  -5.797
    2    HA   SER  84           HA       SER  84   3.716   7.229  -5.348
    3    HB2  SER  84           HB2      SER  84   1.621   6.418  -7.350
    4    HB3  SER  84           HB3      SER  84   2.311   8.040  -7.326
    5    HG   SER  84           HG       SER  84   3.663   5.556  -7.637

  No H/Q in entry =           5
  In of MODEL   74
    1    H    MET  85           H        MET  85   0.218   6.498  -5.145
    2    HA   MET  85           HA       MET  85  -0.618   9.112  -4.528
    3    HB2  MET  85           HB2      MET  85  -2.160   7.317  -5.188
    4    HB3  MET  85           HB3      MET  85  -1.863   6.504  -3.652
    5    HG2  MET  85           HG2      MET  85  -2.720   8.479  -2.439
    6    HG3  MET  85           HG3      MET  85  -3.012   9.291  -3.976
    7    HE1  MET  85           HE1      MET  85  -4.234   7.073  -1.283
    8    HE3  MET  85           HE2      MET  85  -3.670   5.740  -2.287
    9    HE2  MET  85           HE3      MET  85  -5.394   5.945  -1.997

  No H/Q in entry =           9
  In of MODEL   74
    1    H    LEU  86           H        LEU  86   0.302   6.437  -2.401
    2    HA   LEU  86           HA       LEU  86  -0.198   7.736   0.050
    3    HB2  LEU  86           HB2      LEU  86   0.243   5.263  -0.356
    4    HB3  LEU  86           HB3      LEU  86   1.952   5.679  -0.466
    5    HG   LEU  86           HG       LEU  86   1.658   6.836   1.809
    6   HD11  LEU  86          HD11      LEU  86  -1.047   6.093   1.361
    7   HD13  LEU  86          HD12      LEU  86  -0.361   6.830   2.807
    8   HD12  LEU  86          HD13      LEU  86  -0.467   5.075   2.683
    9   HD23  LEU  86          HD21      LEU  86   1.206   3.847   1.926
   10   HD22  LEU  86          HD22      LEU  86   2.227   4.845   2.959
   11   HD21  LEU  86          HD23      LEU  86   2.709   4.521   1.295

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ALA  87           H        ALA  87   2.762   7.423  -1.869
    2    HA   ALA  87           HA       ALA  87   4.496   8.814  -0.156
    3    HB3  ALA  87           HB1      ALA  87   4.557   7.809  -2.867
    4    HB2  ALA  87           HB2      ALA  87   5.904   8.124  -1.778
    5    HB1  ALA  87           HB3      ALA  87   5.291   9.413  -2.812

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ARG  88           H        ARG  88   2.532   9.975  -2.854
    2    HA   ARG  88           HA       ARG  88   3.332  12.657  -2.736
    3    HB2  ARG  88           HB2      ARG  88   2.050  11.522  -4.585
    4    HB3  ARG  88           HB3      ARG  88   0.603  11.675  -3.587
    5    HG2  ARG  88           HG2      ARG  88   1.647  14.246  -3.506
    6    HG3  ARG  88           HG3      ARG  88   2.051  13.733  -5.142
    7    HD2  ARG  88           HD2      ARG  88  -0.096  13.835  -5.818
    8    HD3  ARG  88           HD3      ARG  88  -0.677  12.983  -4.387
    9    HE   ARG  88           HE       ARG  88  -0.845  15.764  -4.794
   10   HH21  ARG  88          HH11      ARG  88  -1.343  17.092  -3.047
   11   HH22  ARG  88          HH12      ARG  88  -1.036  16.547  -1.434
   12   HH11  ARG  88          HH21      ARG  88   0.172  13.484  -2.438
   13   HH12  ARG  88          HH22      ARG  88  -0.196  14.498  -1.089

  No H/Q in entry =          13
  In of MODEL   74
    1    H    GLU  89           H        GLU  89   0.629  11.003  -1.075
    2    HA   GLU  89           HA       GLU  89  -0.445  13.321   0.148
    3    HB2  GLU  89           HB2      GLU  89  -1.585  11.093   0.065
    4    HB3  GLU  89           HB3      GLU  89  -0.455  10.523   1.293
    5    HG2  GLU  89           HG2      GLU  89  -1.243  12.224   2.866
    6    HG3  GLU  89           HG3      GLU  89  -2.301  12.909   1.635

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LEU  90           H        LEU  90   1.995  11.001   1.290
    2    HA   LEU  90           HA       LEU  90   2.388  12.233   3.821
    3    HB2  LEU  90           HB2      LEU  90   4.127  10.447   2.120
    4    HB3  LEU  90           HB3      LEU  90   4.567  10.954   3.756
    5    HG   LEU  90           HG       LEU  90   1.913   9.637   3.117
    6   HD12  LEU  90          HD11      LEU  90   3.042   7.576   4.107
    7   HD11  LEU  90          HD12      LEU  90   4.570   8.418   3.853
    8   HD13  LEU  90          HD13      LEU  90   3.541   8.025   2.475
    9   HD22  LEU  90          HD21      LEU  90   1.678  10.556   5.244
   10   HD21  LEU  90          HD22      LEU  90   3.399  10.430   5.609
   11   HD23  LEU  90          HD23      LEU  90   2.378   8.993   5.662

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  91           H        ILE  91   3.965  12.610   0.679
    2    HA   ILE  91           HA       ILE  91   5.968  14.418   1.506
    3    HB   ILE  91           HB       ILE  91   4.626  13.951  -1.163
    4   HG12  ILE  91          HG12      ILE  91   7.462  13.430  -0.219
    5   HG13  ILE  91          HG13      ILE  91   6.170  12.246  -0.048
    6   HG22  ILE  91          HG21      ILE  91   6.856  15.276  -1.869
    7   HG21  ILE  91          HG22      ILE  91   6.569  16.075  -0.322
    8   HG23  ILE  91          HG23      ILE  91   5.335  16.121  -1.579
    9   HD13  ILE  91          HD11      ILE  91   5.970  11.932  -2.354
   10   HD12  ILE  91          HD12      ILE  91   7.709  12.156  -2.157
   11   HD11  ILE  91          HD13      ILE  91   6.707  13.492  -2.728

  No H/Q in entry =          11
  In of MODEL   74
    1    H    THR  92           H        THR  92   2.602  14.890   0.532
    2    HA   THR  92           HA       THR  92   2.605  17.713   0.482
    3    HB   THR  92           HB       THR  92   0.423  15.740   1.196
    4    HG1  THR  92           HG1      THR  92   0.706  15.565  -0.893
    5   HG22  THR  92          HG21      THR  92  -0.961  17.919   0.495
    6   HG21  THR  92          HG22      THR  92   0.447  18.727   1.181
    7   HG23  THR  92          HG23      THR  92  -0.497  17.612   2.168

  No H/Q in entry =           7
  In of MODEL   74
    1    H    GLU  93           H        GLU  93   2.058  15.410   3.133
    2    HA   GLU  93           HA       GLU  93   1.567  17.312   5.163
    3    HB2  GLU  93           HB2      GLU  93   2.853  14.572   5.377
    4    HB3  GLU  93           HB3      GLU  93   2.185  15.502   6.720
    5    HG2  GLU  93           HG2      GLU  93   0.540  14.751   4.294
    6    HG3  GLU  93           HG3      GLU  93   0.645  13.722   5.718

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LEU  94           H        LEU  94   4.546  15.801   3.979
    2    HA   LEU  94           HA       LEU  94   6.327  16.923   5.853
    3    HB2  LEU  94           HB2      LEU  94   6.690  15.961   3.015
    4    HB3  LEU  94           HB3      LEU  94   8.036  16.601   3.954
    5    HG   LEU  94           HG       LEU  94   6.284  14.420   5.098
    6   HD11  LEU  94          HD11      LEU  94   8.356  14.179   2.946
    7   HD13  LEU  94          HD12      LEU  94   6.902  13.220   3.218
    8   HD12  LEU  94          HD13      LEU  94   8.334  12.948   4.210
    9   HD23  LEU  94          HD21      LEU  94   8.479  13.856   6.227
   10   HD22  LEU  94          HD22      LEU  94   7.833  15.440   6.656
   11   HD21  LEU  94          HD23      LEU  94   9.159  15.309   5.500

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  95           H        ILE  95   5.170  18.118   2.719
    2    HA   ILE  95           HA       ILE  95   6.767  20.458   2.652
    3    HB   ILE  95           HB       ILE  95   4.103  19.808   1.370
    4   HG12  ILE  95          HG12      ILE  95   6.884  20.119   0.207
    5   HG13  ILE  95          HG13      ILE  95   6.223  18.571   0.723
    6   HG21  ILE  95          HG21      ILE  95   5.878  22.257   1.142
    7   HG23  ILE  95          HG22      ILE  95   4.155  22.207   1.514
    8   HG22  ILE  95          HG23      ILE  95   4.718  21.806  -0.109
    9   HD13  ILE  95          HD11      ILE  95   4.645  18.519  -0.991
   10   HD12  ILE  95          HD12      ILE  95   5.996  19.325  -1.789
   11   HD11  ILE  95          HD13      ILE  95   4.639  20.272  -1.180

  No H/Q in entry =          11
  In of MODEL   74
    1    H    GLU  96           H        GLU  96   3.524  19.838   3.977
    2    HA   GLU  96           HA       GLU  96   2.941  22.489   4.743
    3    HB2  GLU  96           HB2      GLU  96   1.247  20.724   4.765
    4    HB3  GLU  96           HB3      GLU  96   2.112  19.883   6.049
    5    HG2  GLU  96           HG2      GLU  96   1.121  21.172   7.633
    6    HG3  GLU  96           HG3      GLU  96   1.665  22.642   6.836

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LEU  97           H        LEU  97   4.771  19.912   6.342
    2    HA   LEU  97           HA       LEU  97   5.168  21.247   8.813
    3    HB2  LEU  97           HB2      LEU  97   6.666  19.066   7.376
    4    HB3  LEU  97           HB3      LEU  97   7.279  19.739   8.885
    5    HG   LEU  97           HG       LEU  97   4.454  18.678   8.598
    6   HD12  LEU  97          HD11      LEU  97   5.383  16.651   9.795
    7   HD11  LEU  97          HD12      LEU  97   6.998  17.265   9.437
    8   HD13  LEU  97          HD13      LEU  97   5.910  16.824   8.120
    9   HD23  LEU  97          HD21      LEU  97   4.929  18.370  11.157
   10   HD22  LEU  97          HD22      LEU  97   4.561  19.988  10.562
   11   HD21  LEU  97          HD23      LEU  97   6.231  19.528  10.889

  No H/Q in entry =          11
  In of MODEL   74
    1    H    HIS  98           H        HIS  98   7.009  21.253   5.770
    2    HA   HIS  98           HA       HIS  98   9.189  22.804   6.653
    3    HB2  HIS  98           HB2      HIS  98   7.867  22.574   3.939
    4    HB3  HIS  98           HB3      HIS  98   9.321  23.534   4.219
    5    HD1  HIS  98           HD1      HIS  98   8.068  19.978   4.238
    6    HD2  HIS  98           HD2      HIS  98  11.677  22.031   4.635
    7    HE1  HIS  98           HE1      HIS  98   9.902  18.227   4.157
    8    HE2  HIS  98           HE2      HIS  98  12.104  19.457   4.399

  No H/Q in entry =           8
  In of MODEL   74
    1    H    GLU  99           H        GLU  99   5.967  23.681   5.512
    2    HA   GLU  99           HA       GLU  99   6.378  26.491   5.460
    3    HB2  GLU  99           HB2      GLU  99   4.475  25.348   4.344
    4    HB3  GLU  99           HB3      GLU  99   3.790  24.989   5.929
    5    HG2  GLU  99           HG2      GLU  99   3.643  27.381   6.440
    6    HG3  GLU  99           HG3      GLU  99   4.409  27.778   4.905

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LYS 100           H        LYS 100   5.246  24.260   7.985
    2    HA   LYS 100           HA       LYS 100   4.703  26.314   9.892
    3    HB2  LYS 100           HB2      LYS 100   5.246  23.355  10.222
    4    HB3  LYS 100           HB3      LYS 100   4.825  24.428  11.562
    5    HG2  LYS 100           HG2      LYS 100   2.754  25.095  10.337
    6    HG3  LYS 100           HG3      LYS 100   3.155  23.926   9.076
    7    HD2  LYS 100           HD2      LYS 100   3.072  22.100  10.732
    8    HD3  LYS 100           HD3      LYS 100   2.688  23.263  12.003
    9    HE2  LYS 100           HE2      LYS 100   0.631  23.913  10.763
   10    HE3  LYS 100           HE3      LYS 100   1.004  22.693   9.539
   11    HZ1  LYS 100           HZ1      LYS 100   0.758  22.019  12.420
   12    HZ3  LYS 100           HZ2      LYS 100   0.717  20.970  11.081
   13    HZ2  LYS 100           HZ3      LYS 100  -0.583  22.024  11.378

  No H/Q in entry =          13
  In of MODEL   74
    1    H    LEU 101           H        LEU 101   7.596  24.487   9.023
    2    HA   LEU 101           HA       LEU 101   9.226  25.299  11.214
    3    HB2  LEU 101           HB2      LEU 101   9.781  24.315   8.427
    4    HB3  LEU 101           HB3      LEU 101  11.101  24.961   9.398
    5    HG   LEU 101           HG       LEU 101   9.253  22.824  10.472
    6   HD12  LEU 101          HD11      LEU 101  11.283  21.306   9.838
    7   HD11  LEU 101          HD12      LEU 101  11.654  22.569   8.667
    8   HD13  LEU 101          HD13      LEU 101  10.113  21.715   8.585
    9   HD21  LEU 101          HD21      LEU 101  11.998  23.896  11.177
   10   HD23  LEU 101          HD22      LEU 101  11.441  22.328  11.756
   11   HD22  LEU 101          HD23      LEU 101  10.571  23.793  12.208

  No H/Q in entry =          11
  In of MODEL   74
    1    H    LYS 102           H        LYS 102   7.645  27.190   9.095
    2    HA   LYS 102           HA       LYS 102   7.748  29.483   8.811
    3    HB2  LYS 102           HB2      LYS 102   9.331  29.340  10.894
    4    HB3  LYS 102           HB3      LYS 102  10.622  29.523   9.722
    5    HG2  LYS 102           HG2      LYS 102   8.549  31.499  10.611
    6    HG3  LYS 102           HG3      LYS 102  10.262  31.738  10.344
    7    HD2  LYS 102           HD2      LYS 102   8.284  31.348   8.062
    8    HD3  LYS 102           HD3      LYS 102   8.693  32.920   8.732
    9    HE2  LYS 102           HE2      LYS 102  10.031  31.726   6.641
   10    HE3  LYS 102           HE3      LYS 102  10.674  33.021   7.651
   11    HZ2  LYS 102           HZ1      LYS 102  12.168  31.099   7.454
   12    HZ1  LYS 102           HZ2      LYS 102  11.001  30.128   8.204
   13    HZ3  LYS 102           HZ3      LYS 102  11.718  31.403   9.061

  No H/Q in entry =          13
  In of MODEL   74
    1    H    ALA 103           H        ALA 103  10.982  28.105   8.210
    2    HA   ALA 103           HA       ALA 103  11.943  29.477   6.130
    3    HB2  ALA 103           HB1      ALA 103  12.791  27.256   5.185
    4    HB1  ALA 103           HB2      ALA 103  11.899  26.488   6.497
    5    HB3  ALA 103           HB3      ALA 103  13.207  27.614   6.862

  No H/Q in entry =           5
  In of MODEL   74
    1    H1   LYS   3           H1       LYS   3 -31.120   5.394 -20.280
    2    H2   LYS   3           H3       LYS   3 -30.086   5.108 -21.596
    3    H3   LYS   3           H2       LYS   3 -31.458   4.134 -21.367
    4    HA   LYS   3           HA       LYS   3 -30.454   2.807 -19.906
    5    HB2  LYS   3           HB2      LYS   3 -28.179   4.260 -21.205
    6    HB3  LYS   3           HB3      LYS   3 -27.853   3.089 -19.927
    7    HG2  LYS   3           HG2      LYS   3 -29.188   1.432 -21.281
    8    HG3  LYS   3           HG3      LYS   3 -29.143   2.605 -22.596
    9    HD2  LYS   3           HD2      LYS   3 -26.660   2.569 -22.475
   10    HD3  LYS   3           HD3      LYS   3 -26.773   1.293 -21.264
   11    HE2  LYS   3           HE2      LYS   3 -28.187   0.036 -22.994
   12    HE3  LYS   3           HE3      LYS   3 -27.571   1.208 -24.158
   13    HZ3  LYS   3           HZ1      LYS   3 -25.730   0.030 -24.351
   14    HZ2  LYS   3           HZ2      LYS   3 -26.353  -1.135 -23.284
   15    HZ1  LYS   3           HZ3      LYS   3 -25.419   0.151 -22.687

  No H/Q in entry =          15
  In of MODEL   74
    1    H    LYS   4           H        LYS   4 -30.560   2.707 -17.843
    2    HA   LYS   4           HA       LYS   4 -29.944   5.049 -16.225
    3    HB2  LYS   4           HB2      LYS   4 -31.085   2.337 -15.499
    4    HB3  LYS   4           HB3      LYS   4 -30.934   3.705 -14.397
    5    HG2  LYS   4           HG2      LYS   4 -32.671   3.538 -16.865
    6    HG3  LYS   4           HG3      LYS   4 -33.211   3.609 -15.189
    7    HD2  LYS   4           HD2      LYS   4 -32.588   5.856 -14.952
    8    HD3  LYS   4           HD3      LYS   4 -31.507   5.799 -16.345
    9    HE2  LYS   4           HE2      LYS   4 -33.458   7.104 -16.890
   10    HE3  LYS   4           HE3      LYS   4 -33.468   5.610 -17.828
   11    HZ3  LYS   4           HZ1      LYS   4 -35.059   4.685 -16.304
   12    HZ2  LYS   4           HZ2      LYS   4 -35.641   6.151 -16.936
   13    HZ1  LYS   4           HZ3      LYS   4 -35.026   6.092 -15.354

  No H/Q in entry =          13
  In of MODEL   74
    1    H    HIS   5           H        HIS   5 -28.524   5.211 -14.596
    2    HA   HIS   5           HA       HIS   5 -26.182   3.442 -14.825
    3    HB2  HIS   5           HB2      HIS   5 -26.548   6.213 -13.687
    4    HB3  HIS   5           HB3      HIS   5 -25.041   5.303 -13.608
    5    HD1  HIS   5           HD1      HIS   5 -23.561   6.510 -15.183
    6    HD2  HIS   5           HD2      HIS   5 -27.298   5.748 -16.826
    7    HE1  HIS   5           HE1      HIS   5 -23.341   7.042 -17.640
    8    HE2  HIS   5           HE2      HIS   5 -25.620   6.566 -18.610

  No H/Q in entry =           8
  In of MODEL   74
    1    H    ILE   6           H        ILE   6 -25.946   1.905 -13.467
    2    HA   ILE   6           HA       ILE   6 -27.006   2.204 -10.738
    3    HB   ILE   6           HB       ILE   6 -26.071  -0.271 -12.198
    4   HG12  ILE   6          HG12      ILE   6 -28.861   0.606 -11.442
    5   HG13  ILE   6          HG13      ILE   6 -28.178   0.751 -13.062
    6   HG23  ILE   6          HG21      ILE   6 -26.461  -1.493 -10.321
    7   HG22  ILE   6          HG22      ILE   6 -27.668  -0.366  -9.699
    8   HG21  ILE   6          HG23      ILE   6 -25.951   0.020  -9.570
    9   HD13  ILE   6          HD11      ILE   6 -28.566  -1.390 -13.528
   10   HD12  ILE   6          HD12      ILE   6 -29.620  -1.371 -12.114
   11   HD11  ILE   6          HD13      ILE   6 -27.954  -1.930 -11.964

  No H/Q in entry =          11
  In of MODEL   74
    1    H    TYR   7           H        TYR   7 -25.301   2.921  -9.418
    2    HA   TYR   7           HA       TYR   7 -22.547   2.025 -10.002
    3    HB2  TYR   7           HB2      TYR   7 -23.617   4.463  -8.602
    4    HB3  TYR   7           HB3      TYR   7 -21.918   3.993  -8.582
    5    HD1  TYR   7           HD1      TYR   7 -22.846   2.957 -11.679
    6    HD2  TYR   7           HD2      TYR   7 -22.335   6.593  -9.514
    7    HE1  TYR   7           HE1      TYR   7 -22.389   4.153 -13.784
    8    HE2  TYR   7           HE2      TYR   7 -21.920   7.793 -11.613
    9    HH   TYR   7           HH       TYR   7 -22.074   7.654 -13.847

  No H/Q in entry =           9
  In of MODEL   74
    1    H    LEU   8           H        LEU   8 -21.583   0.728  -8.618
    2    HA   LEU   8           HA       LEU   8 -22.775   0.260  -5.955
    3    HB2  LEU   8           HB2      LEU   8 -20.977  -1.394  -7.705
    4    HB3  LEU   8           HB3      LEU   8 -21.200  -1.745  -5.991
    5    HG   LEU   8           HG       LEU   8 -23.662  -1.994  -6.477
    6   HD13  LEU   8          HD11      LEU   8 -23.766  -0.828  -8.617
    7   HD12  LEU   8          HD12      LEU   8 -24.244  -2.510  -8.834
    8   HD11  LEU   8          HD13      LEU   8 -22.636  -1.979  -9.326
    9   HD23  LEU   8          HD21      LEU   8 -22.286  -4.035  -8.090
   10   HD22  LEU   8          HD22      LEU   8 -23.406  -4.203  -6.739
   11   HD21  LEU   8          HD23      LEU   8 -21.718  -3.798  -6.438

  No H/Q in entry =          11
  In of MODEL   74
    1    H    PHE   9           H        PHE   9 -21.571   0.730  -4.149
    2    HA   PHE   9           HA       PHE   9 -18.798   1.732  -4.588
    3    HB2  PHE   9           HB2      PHE   9 -20.920   2.789  -2.727
    4    HB3  PHE   9           HB3      PHE   9 -19.224   3.240  -2.628
    5    HD1  PHE   9           HD1      PHE   9 -18.160   4.558  -4.385
    6    HD2  PHE   9           HD2      PHE   9 -22.326   3.547  -4.585
    7    HE1  PHE   9           HE1      PHE   9 -18.479   6.224  -6.190
    8    HE2  PHE   9           HE2      PHE   9 -22.646   5.225  -6.384
    9    HZ   PHE   9           HZ       PHE   9 -20.720   6.558  -7.193

  No H/Q in entry =           9
  In of MODEL   74
    1    H    SER  10           H        SER  10 -17.216   0.874  -3.388
    2    HA   SER  10           HA       SER  10 -17.489   0.012  -0.695
    3    HB2  SER  10           HB2      SER  10 -17.358  -2.336  -0.904
    4    HB3  SER  10           HB3      SER  10 -18.616  -1.859  -2.032
    5    HG   SER  10           HG       SER  10 -15.919  -2.517  -2.560

  No H/Q in entry =           5
  In of MODEL   74
    1    H    SER  11           H        SER  11 -15.501   0.173   0.204
    2    HA   SER  11           HA       SER  11 -13.289   1.051  -1.286
    3    HB2  SER  11           HB2      SER  11 -13.858   1.220   1.267
    4    HB3  SER  11           HB3      SER  11 -12.905  -0.263   1.364
    5    HG   SER  11           HG       SER  11 -11.635   1.437  -0.227

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ALA  12           H        ALA  12 -14.390  -1.653  -2.092
    2    HA   ALA  12           HA       ALA  12 -11.786  -2.875  -2.511
    3    HB3  ALA  12           HB1      ALA  12 -12.314  -4.041  -0.513
    4    HB2  ALA  12           HB2      ALA  12 -12.696  -5.154  -1.827
    5    HB1  ALA  12           HB3      ALA  12 -13.992  -4.282  -1.008

  No H/Q in entry =           5
  In of MODEL   74
    1    H    GLY  13           H        GLY  13 -12.655  -1.862  -4.557
    2    HA3  GLY  13           HA2      GLY  13 -14.812  -2.747  -6.045
    3    HA2  GLY  13           HA3      GLY  13 -13.292  -2.187  -6.756

  No H/Q in entry =           3
  In of MODEL   74
    1    H    MET  14           H        MET  14 -11.766  -4.437  -5.518
    2    HA   MET  14           HA       MET  14 -11.839  -6.222  -7.671
    3    HB2  MET  14           HB2      MET  14  -9.908  -6.130  -6.148
    4    HB3  MET  14           HB3      MET  14 -10.859  -6.887  -4.872
    5    HG2  MET  14           HG2      MET  14  -9.498  -8.585  -5.972
    6    HG3  MET  14           HG3      MET  14 -11.188  -8.870  -6.389
    7    HE1  MET  14           HE1      MET  14  -7.909  -9.103  -7.613
    8    HE3  MET  14           HE2      MET  14  -7.780  -7.351  -7.488
    9    HE2  MET  14           HE3      MET  14  -7.692  -8.121  -9.070

  No H/Q in entry =           9
  In of MODEL   74
    1    H    SER  15           H        SER  15 -13.295  -6.714  -4.471
    2    HA   SER  15           HA       SER  15 -14.504  -9.222  -5.268
    3    HB2  SER  15           HB2      SER  15 -14.912  -7.515  -2.808
    4    HB3  SER  15           HB3      SER  15 -15.889  -8.941  -3.147
    5    HG   SER  15           HG       SER  15 -13.155  -8.725  -2.536

  No H/Q in entry =           5
  In of MODEL   74
    1    H    THR  16           H        THR  16 -15.641  -5.868  -4.962
    2    HA   THR  16           HA       THR  16 -18.412  -6.388  -5.564
    3    HB   THR  16           HB       THR  16 -16.838  -3.844  -6.099
    4    HG1  THR  16           HG1      THR  16 -16.465  -4.228  -4.005
    5   HG23  THR  16          HG21      THR  16 -18.941  -2.748  -5.941
    6   HG22  THR  16          HG22      THR  16 -19.726  -4.185  -5.262
    7   HG21  THR  16          HG23      THR  16 -19.227  -4.154  -6.959

  No H/Q in entry =           7
  In of MODEL   74
    1    H    SER  17           H        SER  17 -15.520  -5.835  -7.351
    2    HA   SER  17           HA       SER  17 -16.594  -5.182  -9.899
    3    HB2  SER  17           HB2      SER  17 -13.949  -6.378  -9.063
    4    HB3  SER  17           HB3      SER  17 -14.348  -6.065 -10.752
    5    HG   SER  17           HG       SER  17 -13.193  -4.359  -9.605

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LEU  18           H        LEU  18 -15.981  -8.276  -8.365
    2    HA   LEU  18           HA       LEU  18 -16.457  -9.843 -10.702
    3    HB2  LEU  18           HB2      LEU  18 -15.266 -10.728  -8.745
    4    HB3  LEU  18           HB3      LEU  18 -16.728 -10.551  -7.776
    5    HG   LEU  18           HG       LEU  18 -17.877 -12.195  -9.161
    6   HD12  LEU  18          HD11      LEU  18 -16.289 -13.496 -10.770
    7   HD11  LEU  18          HD12      LEU  18 -15.333 -12.015 -10.747
    8   HD13  LEU  18          HD13      LEU  18 -17.001 -11.979 -11.316
    9   HD23  LEU  18          HD21      LEU  18 -15.201 -13.279  -8.349
   10   HD22  LEU  18          HD22      LEU  18 -16.753 -14.119  -8.395
   11   HD21  LEU  18          HD23      LEU  18 -16.474 -12.846  -7.206

  No H/Q in entry =          11
  In of MODEL   74
    1    H    LEU  19           H        LEU  19 -18.537  -8.633  -8.076
    2    HA   LEU  19           HA       LEU  19 -20.940  -9.904  -8.952
    3    HB2  LEU  19           HB2      LEU  19 -20.768  -9.019  -6.713
    4    HB3  LEU  19           HB3      LEU  19 -20.497  -7.394  -7.342
    5    HG   LEU  19           HG       LEU  19 -22.806  -7.298  -8.126
    6   HD11  LEU  19          HD11      LEU  19 -23.018 -10.050  -6.894
    7   HD13  LEU  19          HD12      LEU  19 -23.209  -9.644  -8.598
    8   HD12  LEU  19          HD13      LEU  19 -24.390  -9.075  -7.419
    9   HD22  LEU  19          HD21      LEU  19 -23.772  -6.921  -6.030
   10   HD21  LEU  19          HD22      LEU  19 -22.041  -6.698  -5.773
   11   HD23  LEU  19          HD23      LEU  19 -22.823  -8.195  -5.265

  No H/Q in entry =          11
  In of MODEL   74
    1    H    VAL  20           H        VAL  20 -19.514  -6.718  -9.675
    2    HA   VAL  20           HA       VAL  20 -21.607  -5.770 -11.326
    3    HB   VAL  20           HB       VAL  20 -18.633  -5.099 -11.402
    4   HG12  VAL  20          HG11      VAL  20 -19.562  -2.984 -12.592
    5   HG11  VAL  20          HG12      VAL  20 -20.953  -3.999 -12.972
    6   HG13  VAL  20          HG13      VAL  20 -19.349  -4.453 -13.543
    7   HG21  VAL  20          HG21      VAL  20 -21.019  -3.889 -10.065
    8   HG23  VAL  20          HG22      VAL  20 -19.596  -2.920 -10.437
    9   HG22  VAL  20          HG23      VAL  20 -19.454  -4.322  -9.377

  No H/Q in entry =           9
  In of MODEL   74
    1    H    SER  21           H        SER  21 -18.765  -7.764 -12.227
    2    HA   SER  21           HA       SER  21 -19.472  -7.733 -15.002
    3    HB2  SER  21           HB2      SER  21 -17.976  -9.675 -15.245
    4    HB3  SER  21           HB3      SER  21 -17.206  -8.376 -14.336
    5    HG   SER  21           HG       SER  21 -17.239  -9.544 -12.583

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LYS  22           H        LYS  22 -20.549  -9.893 -12.413
    2    HA   LYS  22           HA       LYS  22 -21.990 -11.595 -14.242
    3    HB2  LYS  22           HB2      LYS  22 -21.253 -12.083 -11.789
    4    HB3  LYS  22           HB3      LYS  22 -22.755 -11.262 -11.365
    5    HG2  LYS  22           HG2      LYS  22 -24.053 -12.983 -12.044
    6    HG3  LYS  22           HG3      LYS  22 -22.977 -13.415 -13.372
    7    HD2  LYS  22           HD2      LYS  22 -21.423 -14.443 -11.768
    8    HD3  LYS  22           HD3      LYS  22 -22.522 -14.031 -10.450
    9    HE2  LYS  22           HE2      LYS  22 -23.106 -15.906 -12.753
   10    HE3  LYS  22           HE3      LYS  22 -22.797 -16.370 -11.080
   11    HZ3  LYS  22           HZ1      LYS  22 -24.861 -15.796 -10.440
   12    HZ2  LYS  22           HZ2      LYS  22 -25.218 -16.124 -12.067
   13    HZ1  LYS  22           HZ3      LYS  22 -24.996 -14.522 -11.554

  No H/Q in entry =          13
  In of MODEL   74
    1    H    MET  23           H        MET  23 -22.846  -8.654 -12.460
    2    HA   MET  23           HA       MET  23 -25.635  -8.821 -13.044
    3    HB2  MET  23           HB2      MET  23 -23.867  -6.451 -12.470
    4    HB3  MET  23           HB3      MET  23 -25.611  -6.333 -12.702
    5    HG2  MET  23           HG2      MET  23 -26.024  -7.604 -10.716
    6    HG3  MET  23           HG3      MET  23 -24.308  -7.966 -10.532
    7    HE2  MET  23           HE1      MET  23 -26.736  -4.353  -9.490
    8    HE1  MET  23           HE2      MET  23 -26.922  -5.359 -10.926
    9    HE3  MET  23           HE3      MET  23 -25.924  -3.906 -10.992

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ARG  24           H        ARG  24 -22.868  -7.357 -14.780
    2    HA   ARG  24           HA       ARG  24 -24.341  -6.139 -16.849
    3    HB2  ARG  24           HB2      ARG  24 -21.920  -5.672 -16.401
    4    HB3  ARG  24           HB3      ARG  24 -21.527  -7.269 -16.992
    5    HG2  ARG  24           HG2      ARG  24 -22.322  -6.670 -19.267
    6    HG3  ARG  24           HG3      ARG  24 -22.779  -5.055 -18.663
    7    HD2  ARG  24           HD2      ARG  24 -20.579  -4.839 -19.650
    8    HD3  ARG  24           HD3      ARG  24 -20.394  -4.782 -17.902
    9    HE   ARG  24           HE       ARG  24 -19.947  -7.368 -18.399
   10   HH21  ARG  24          HH11      ARG  24 -17.882  -7.746 -17.597
   11   HH22  ARG  24          HH12      ARG  24 -16.548  -6.822 -18.193
   12   HH11  ARG  24          HH21      ARG  24 -18.710  -4.601 -19.904
   13   HH12  ARG  24          HH22      ARG  24 -17.048  -4.969 -19.566

  No H/Q in entry =          13
  In of MODEL   74
    1    H    ALA  25           H        ALA  25 -23.142  -9.441 -16.469
    2    HA   ALA  25           HA       ALA  25 -23.672 -10.343 -19.104
    3    HB1  ALA  25           HB1      ALA  25 -22.946 -12.341 -18.345
    4    HB3  ALA  25           HB2      ALA  25 -24.044 -12.319 -16.965
    5    HB2  ALA  25           HB3      ALA  25 -22.512 -11.451 -16.886

  No H/Q in entry =           5
  In of MODEL   74
    1    H    GLN  26           H        GLN  26 -25.585 -10.366 -16.134
    2    HA   GLN  26           HA       GLN  26 -27.867 -11.649 -17.192
    3    HB2  GLN  26           HB2      GLN  26 -27.469  -9.840 -14.829
    4    HB3  GLN  26           HB3      GLN  26 -29.002 -10.610 -15.209
    5    HG2  GLN  26           HG2      GLN  26 -26.395 -11.990 -14.634
    6    HG3  GLN  26           HG3      GLN  26 -27.790 -11.899 -13.567
    7   HE21  GLN  26          HE21      GLN  26 -26.481 -14.058 -14.760
    8   HE22  GLN  26          HE22      GLN  26 -27.474 -15.147 -15.565

  No H/Q in entry =           8
  In of MODEL   74
    1    H    ALA  27           H        ALA  27 -27.029  -8.221 -16.845
    2    HA   ALA  27           HA       ALA  27 -29.522  -7.208 -17.723
    3    HB1  ALA  27           HB1      ALA  27 -27.778  -5.825 -16.585
    4    HB3  ALA  27           HB2      ALA  27 -28.344  -5.106 -18.094
    5    HB2  ALA  27           HB3      ALA  27 -26.788  -5.932 -18.041

  No H/Q in entry =           5
  In of MODEL   74
    1    H    GLU  28           H        GLU  28 -26.737  -8.400 -19.489
    2    HA   GLU  28           HA       GLU  28 -27.623  -7.436 -22.055
    3    HB2  GLU  28           HB2      GLU  28 -25.247  -8.045 -21.348
    4    HB3  GLU  28           HB3      GLU  28 -25.745  -9.727 -21.531
    5    HG2  GLU  28           HG2      GLU  28 -24.561  -8.961 -23.481
    6    HG3  GLU  28           HG3      GLU  28 -26.239  -9.333 -23.872

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LYS  29           H        LYS  29 -27.761 -10.510 -20.339
    2    HA   LYS  29           HA       LYS  29 -28.968 -12.054 -22.350
    3    HB2  LYS  29           HB2      LYS  29 -27.954 -12.970 -20.297
    4    HB3  LYS  29           HB3      LYS  29 -29.270 -12.275 -19.353
    5    HG2  LYS  29           HG2      LYS  29 -30.865 -13.710 -20.441
    6    HG3  LYS  29           HG3      LYS  29 -29.618 -14.338 -21.517
    7    HD2  LYS  29           HD2      LYS  29 -28.499 -15.440 -19.727
    8    HD3  LYS  29           HD3      LYS  29 -29.463 -14.598 -18.516
    9    HE2  LYS  29           HE2      LYS  29 -30.146 -16.971 -18.851
   10    HE3  LYS  29           HE3      LYS  29 -31.445 -15.817 -19.157
   11    HZ1  LYS  29           HZ1      LYS  29 -30.806 -15.985 -21.563
   12    HZ3  LYS  29           HZ2      LYS  29 -31.510 -17.376 -20.891
   13    HZ2  LYS  29           HZ3      LYS  29 -29.834 -17.311 -21.141

  No H/Q in entry =          13
  In of MODEL   74
    1    H    TYR  30           H        TYR  30 -30.484  -9.935 -19.930
    2    HA   TYR  30           HA       TYR  30 -33.098 -10.476 -21.239
    3    HB2  TYR  30           HB2      TYR  30 -32.554  -9.253 -18.524
    4    HB3  TYR  30           HB3      TYR  30 -34.144  -9.564 -19.219
    5    HD1  TYR  30           HD1      TYR  30 -34.991 -11.882 -19.412
    6    HD2  TYR  30           HD2      TYR  30 -31.227 -11.029 -17.613
    7    HE1  TYR  30           HE1      TYR  30 -34.867 -14.191 -18.565
    8    HE2  TYR  30           HE2      TYR  30 -31.104 -13.324 -16.771
    9    HH   TYR  30           HH       TYR  30 -32.651 -15.747 -17.863

  No H/Q in entry =           9
  In of MODEL   74
    1    H    GLU  31           H        GLU  31 -30.959  -8.446 -22.017
    2    HA   GLU  31           HA       GLU  31 -30.916  -6.304 -22.881
    3    HB2  GLU  31           HB2      GLU  31 -33.776  -7.104 -23.462
    4    HB3  GLU  31           HB3      GLU  31 -32.948  -5.729 -24.195
    5    HG2  GLU  31           HG2      GLU  31 -31.406  -7.152 -25.314
    6    HG3  GLU  31           HG3      GLU  31 -31.961  -8.562 -24.413

  No H/Q in entry =           6
  In of MODEL   74
    1    H    VAL  32           H        VAL  32 -31.198  -6.154 -20.158
    2    HA   VAL  32           HA       VAL  32 -33.131  -4.078 -19.597
    3    HB   VAL  32           HB       VAL  32 -30.762  -4.978 -17.927
    4   HG12  VAL  32          HG11      VAL  32 -32.373  -4.158 -16.094
    5   HG11  VAL  32          HG12      VAL  32 -33.192  -3.301 -17.400
    6   HG13  VAL  32          HG13      VAL  32 -31.503  -2.946 -17.036
    7   HG21  VAL  32          HG21      VAL  32 -32.465  -6.758 -18.631
    8   HG23  VAL  32          HG22      VAL  32 -33.559  -5.935 -17.519
    9   HG22  VAL  32          HG23      VAL  32 -32.040  -6.607 -16.925

  No H/Q in entry =           9
  In of MODEL   74
    1    HA   PRO  33           HA       PRO  33 -30.129  -1.103 -21.241
    2    HB2  PRO  33           HB2      PRO  33 -31.701   1.080 -21.205
    3    HB3  PRO  33           HB3      PRO  33 -32.103  -0.255 -22.286
    4    HG2  PRO  33           HG2      PRO  33 -33.166   0.290 -19.514
    5    HG3  PRO  33           HG3      PRO  33 -34.081   0.027 -20.998
    6    HD2  PRO  33           HD2      PRO  33 -33.621  -2.000 -19.278
    7    HD3  PRO  33           HD3      PRO  33 -33.625  -2.277 -21.021

  No H/Q in entry =           7
  In of MODEL   74
    1    H    VAL  34           H        VAL  34 -28.909  -1.575 -19.246
    2    HA   VAL  34           HA       VAL  34 -28.738   0.888 -17.640
    3    HB   VAL  34           HB       VAL  34 -28.175  -0.520 -15.657
    4   HG12  VAL  34          HG11      VAL  34 -30.572  -1.452 -15.402
    5   HG11  VAL  34          HG12      VAL  34 -30.862  -0.731 -16.983
    6   HG13  VAL  34          HG13      VAL  34 -30.376   0.286 -15.627
    7   HG21  VAL  34          HG21      VAL  34 -28.248  -2.589 -17.628
    8   HG23  VAL  34          HG22      VAL  34 -29.334  -2.952 -16.286
    9   HG22  VAL  34          HG23      VAL  34 -27.632  -2.613 -15.976

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ILE  35           H        ILE  35 -26.800   1.393 -16.752
    2    HA   ILE  35           HA       ILE  35 -24.424   0.104 -17.922
    3    HB   ILE  35           HB       ILE  35 -24.926   2.997 -17.181
    4   HG12  ILE  35          HG12      ILE  35 -23.834   1.668 -19.669
    5   HG13  ILE  35          HG13      ILE  35 -25.488   2.248 -19.469
    6   HG21  ILE  35          HG21      ILE  35 -22.315   1.530 -17.385
    7   HG23  ILE  35          HG22      ILE  35 -22.837   2.719 -16.194
    8   HG22  ILE  35          HG23      ILE  35 -22.422   3.232 -17.829
    9   HD11  ILE  35          HD11      ILE  35 -24.164   4.492 -18.872
   10   HD13  ILE  35          HD12      ILE  35 -24.643   4.063 -20.515
   11   HD12  ILE  35          HD13      ILE  35 -22.997   3.749 -19.965

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ILE  36           H        ILE  36 -23.214  -0.855 -16.268
    2    HA   ILE  36           HA       ILE  36 -23.754  -0.197 -13.424
    3    HB   ILE  36           HB       ILE  36 -22.822  -2.896 -14.453
    4   HG12  ILE  36          HG12      ILE  36 -25.671  -2.155 -13.787
    5   HG13  ILE  36          HG13      ILE  36 -25.051  -2.151 -15.438
    6   HG23  ILE  36          HG21      ILE  36 -23.211  -3.694 -12.335
    7   HG22  ILE  36          HG22      ILE  36 -24.385  -2.434 -11.953
    8   HG21  ILE  36          HG23      ILE  36 -22.663  -2.056 -11.982
    9   HD13  ILE  36          HD11      ILE  36 -25.151  -4.371 -15.605
   10   HD12  ILE  36          HD12      ILE  36 -26.260  -4.252 -14.239
   11   HD11  ILE  36          HD13      ILE  36 -24.557  -4.621 -13.963

  No H/Q in entry =          11
  In of MODEL   74
    1    H    GLU  37           H        GLU  37 -22.023   0.503 -12.282
    2    HA   GLU  37           HA       GLU  37 -19.287  -0.236 -13.104
    3    HB2  GLU  37           HB2      GLU  37 -20.274   2.542 -12.476
    4    HB3  GLU  37           HB3      GLU  37 -18.571   2.089 -12.570
    5    HG2  GLU  37           HG2      GLU  37 -20.534   1.981 -14.843
    6    HG3  GLU  37           HG3      GLU  37 -19.358   3.264 -14.561

  No H/Q in entry =           6
  In of MODEL   74
    1    H    ALA  38           H        ALA  38 -17.844  -0.399 -11.375
    2    HA   ALA  38           HA       ALA  38 -18.960  -0.196  -8.639
    3    HB1  ALA  38           HB1      ALA  38 -17.152  -2.113  -9.976
    4    HB3  ALA  38           HB2      ALA  38 -18.234  -2.351  -8.605
    5    HB2  ALA  38           HB3      ALA  38 -16.649  -1.619  -8.360

  No H/Q in entry =           5
  In of MODEL   74
    1    H    PHE  39           H        PHE  39 -17.797   1.076  -7.156
    2    HA   PHE  39           HA       PHE  39 -15.282   2.334  -8.003
    3    HB2  PHE  39           HB2      PHE  39 -17.561   3.889  -6.784
    4    HB3  PHE  39           HB3      PHE  39 -16.005   4.521  -7.316
    5    HD1  PHE  39           HD1      PHE  39 -15.537   4.897  -9.638
    6    HD2  PHE  39           HD2      PHE  39 -19.287   3.312  -8.371
    7    HE1  PHE  39           HE1      PHE  39 -16.487   5.393 -11.873
    8    HE2  PHE  39           HE2      PHE  39 -20.248   3.795 -10.594
    9    HZ   PHE  39           HZ       PHE  39 -18.847   4.807 -12.360

  No H/Q in entry =           9
  In of MODEL   74
    1    HA   PRO  40           HA       PRO  40 -14.447   1.690  -3.677
    2    HB2  PRO  40           HB2      PRO  40 -12.757   3.767  -3.062
    3    HB3  PRO  40           HB3      PRO  40 -12.245   2.430  -4.090
    4    HG2  PRO  40           HG2      PRO  40 -13.328   5.119  -4.918
    5    HG3  PRO  40           HG3      PRO  40 -11.860   4.310  -5.467
    6    HD2  PRO  40           HD2      PRO  40 -14.036   4.126  -6.938
    7    HD3  PRO  40           HD3      PRO  40 -13.045   2.691  -6.689

  No H/Q in entry =           7
  In of MODEL   74
    1    H    GLU  41           H        GLU  41 -15.159   2.690  -1.586
    2    HA   GLU  41           HA       GLU  41 -17.452   4.324  -1.668
    3    HB2  GLU  41           HB2      GLU  41 -17.362   4.314   0.720
    4    HB3  GLU  41           HB3      GLU  41 -16.844   2.724   0.160
    5    HG2  GLU  41           HG2      GLU  41 -14.523   3.296   0.587
    6    HG3  GLU  41           HG3      GLU  41 -14.994   4.926   1.068

  No H/Q in entry =           6
  In of MODEL   74
    1    H    THR  42           H        THR  42 -14.150   5.342  -1.644
    2    HA   THR  42           HA       THR  42 -14.614   7.913  -0.494
    3    HB   THR  42           HB       THR  42 -12.444   8.531  -1.524
    4    HG1  THR  42           HG1      THR  42 -11.791   6.102  -2.460
    5   HG21  THR  42          HG21      THR  42 -12.637   7.128   0.597
    6   HG23  THR  42          HG22      THR  42 -11.096   7.027  -0.259
    7   HG22  THR  42          HG23      THR  42 -12.277   5.728  -0.414

  No H/Q in entry =           7
  In of MODEL   74
    1    H    LEU  43           H        LEU  43 -15.395   6.732  -3.597
    2    HA   LEU  43           HA       LEU  43 -15.703   9.475  -4.630
    3    HB2  LEU  43           HB2      LEU  43 -15.771   6.758  -5.911
    4    HB3  LEU  43           HB3      LEU  43 -16.313   8.212  -6.748
    5    HG   LEU  43           HG       LEU  43 -13.501   7.706  -5.807
    6   HD12  LEU  43          HD11      LEU  43 -13.244   7.758  -8.420
    7   HD11  LEU  43          HD12      LEU  43 -14.927   7.237  -8.385
    8   HD13  LEU  43          HD13      LEU  43 -13.688   6.264  -7.595
    9   HD21  LEU  43          HD21      LEU  43 -14.895   9.974  -7.187
   10   HD23  LEU  43          HD22      LEU  43 -13.189   9.660  -7.510
   11   HD22  LEU  43          HD23      LEU  43 -13.724  10.017  -5.869

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ALA  44           H        ALA  44 -17.646   7.628  -2.795
    2    HA   ALA  44           HA       ALA  44 -20.078   7.386  -4.185
    3    HB2  ALA  44           HB1      ALA  44 -19.968   6.315  -2.062
    4    HB3  ALA  44           HB2      ALA  44 -21.123   7.631  -1.850
    5    HB1  ALA  44           HB3      ALA  44 -19.473   7.801  -1.252

  No H/Q in entry =           5
  In of MODEL   74
    1    H    GLY  45           H        GLY  45 -18.789  10.258  -2.670
    2    HA3  GLY  45           HA2      GLY  45 -21.259  11.674  -3.130
    3    HA2  GLY  45           HA3      GLY  45 -19.751  12.358  -2.523

  No H/Q in entry =           3
  In of MODEL   74
    1    H    GLU  46           H        GLU  46 -18.127  11.424  -4.749
    2    HA   GLU  46           HA       GLU  46 -18.779  13.584  -6.580
    3    HB2  GLU  46           HB2      GLU  46 -16.525  11.570  -6.515
    4    HB3  GLU  46           HB3      GLU  46 -16.659  12.880  -7.689
    5    HG2  GLU  46           HG2      GLU  46 -16.400  13.231  -4.709
    6    HG3  GLU  46           HG3      GLU  46 -15.082  13.379  -5.872

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LYS  47           H        LYS  47 -18.540  10.062  -6.940
    2    HA   LYS  47           HA       LYS  47 -19.567  10.196  -9.649
    3    HB2  LYS  47           HB2      LYS  47 -18.435   8.139  -7.870
    4    HB3  LYS  47           HB3      LYS  47 -19.708   7.567  -8.949
    5    HG2  LYS  47           HG2      LYS  47 -17.513   7.236  -9.923
    6    HG3  LYS  47           HG3      LYS  47 -18.458   8.389 -10.865
    7    HD2  LYS  47           HD2      LYS  47 -17.305  10.239  -9.743
    8    HD3  LYS  47           HD3      LYS  47 -16.349   9.079  -8.823
    9    HE2  LYS  47           HE2      LYS  47 -15.363   8.230 -10.865
   10    HE3  LYS  47           HE3      LYS  47 -16.376   9.305 -11.827
   11    HZ1  LYS  47           HZ1      LYS  47 -15.274  11.092 -10.295
   12    HZ3  LYS  47           HZ2      LYS  47 -14.495  10.530 -11.694
   13    HZ2  LYS  47           HZ3      LYS  47 -14.049   9.921 -10.172

  No H/Q in entry =          13
  In of MODEL   74
    1    H    GLY  48           H        GLY  48 -20.958   9.461  -6.525
    2    HA3  GLY  48           HA2      GLY  48 -23.283   8.188  -7.309
    3    HA2  GLY  48           HA3      GLY  48 -23.130   9.216  -5.885

  No H/Q in entry =           3
  In of MODEL   74
    1    H    GLN  49           H        GLN  49 -22.575  11.625  -7.488
    2    HA   GLN  49           HA       GLN  49 -25.161  12.654  -7.728
    3    HB2  GLN  49           HB2      GLN  49 -22.606  13.569  -9.032
    4    HB3  GLN  49           HB3      GLN  49 -24.099  14.490  -9.010
    5    HG2  GLN  49           HG2      GLN  49 -24.010  14.568  -6.570
    6    HG3  GLN  49           HG3      GLN  49 -22.531  13.624  -6.592
    7   HE21  GLN  49          HE21      GLN  49 -22.517  15.880  -5.362
    8   HE22  GLN  49          HE22      GLN  49 -21.615  17.151  -6.008

  No H/Q in entry =           8
  In of MODEL   74
    1    H    ASN  50           H        ASN  50 -23.357  10.781 -10.027
    2    HA   ASN  50           HA       ASN  50 -25.205  11.553 -12.180
    3    HB2  ASN  50           HB2      ASN  50 -22.574  10.089 -12.307
    4    HB3  ASN  50           HB3      ASN  50 -23.597  10.455 -13.689
    5   HD21  ASN  50          HD21      ASN  50 -21.035  11.413 -12.022
    6   HD22  ASN  50          HD22      ASN  50 -20.841  13.048 -12.391

  No H/Q in entry =           6
  In of MODEL   74
    1    H    ALA  51           H        ALA  51 -25.185   9.244  -9.886
    2    HA   ALA  51           HA       ALA  51 -25.852   7.040 -11.689
    3    HB2  ALA  51           HB1      ALA  51 -25.278   5.743  -9.959
    4    HB3  ALA  51           HB2      ALA  51 -26.455   6.538  -8.916
    5    HB1  ALA  51           HB3      ALA  51 -24.831   7.204  -9.079

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ASP  52           H        ASP  52 -27.829   5.928 -11.585
    2    HA   ASP  52           HA       ASP  52 -30.081   7.708 -11.019
    3    HB2  ASP  52           HB2      ASP  52 -29.769   5.177 -12.631
    4    HB3  ASP  52           HB3      ASP  52 -31.346   5.872 -12.257

  No H/Q in entry =           4
  In of MODEL   74
    1    H    VAL  53           H        VAL  53 -28.427   4.888  -9.899
    2    HA   VAL  53           HA       VAL  53 -29.943   5.023  -7.428
    3    HB   VAL  53           HB       VAL  53 -31.256   3.315  -8.677
    4   HG11  VAL  53          HG11      VAL  53 -29.442   2.478 -10.131
    5   HG13  VAL  53          HG12      VAL  53 -30.262   1.176  -9.270
    6   HG12  VAL  53          HG13      VAL  53 -28.683   1.736  -8.724
    7   HG23  VAL  53          HG21      VAL  53 -30.427   1.397  -6.922
    8   HG22  VAL  53          HG22      VAL  53 -31.604   2.675  -6.615
    9   HG21  VAL  53          HG23      VAL  53 -29.915   2.905  -6.163

  No H/Q in entry =           9
  In of MODEL   74
    1    H    VAL  54           H        VAL  54 -28.666   4.661  -5.728
    2    HA   VAL  54           HA       VAL  54 -25.866   3.880  -6.243
    3    HB   VAL  54           HB       VAL  54 -27.051   5.670  -4.062
    4   HG11  VAL  54          HG11      VAL  54 -24.427   4.321  -4.250
    5   HG13  VAL  54          HG12      VAL  54 -25.239   5.007  -2.844
    6   HG12  VAL  54          HG13      VAL  54 -24.333   6.055  -3.935
    7   HG22  VAL  54          HG21      VAL  54 -26.212   7.486  -5.173
    8   HG21  VAL  54          HG22      VAL  54 -26.693   6.454  -6.520
    9   HG23  VAL  54          HG23      VAL  54 -25.001   6.538  -6.034

  No H/Q in entry =           9
  In of MODEL   74
    1    H    LEU  55           H        LEU  55 -25.239   1.989  -5.545
    2    HA   LEU  55           HA       LEU  55 -26.772   0.679  -3.387
    3    HB2  LEU  55           HB2      LEU  55 -25.117  -0.488  -5.612
    4    HB3  LEU  55           HB3      LEU  55 -25.888  -1.419  -4.327
    5    HG   LEU  55           HG       LEU  55 -27.307   0.085  -6.517
    6   HD13  LEU  55          HD11      LEU  55 -26.920  -1.782  -7.689
    7   HD12  LEU  55          HD12      LEU  55 -27.886  -2.661  -6.504
    8   HD11  LEU  55          HD13      LEU  55 -26.138  -2.543  -6.304
    9   HD23  LEU  55          HD21      LEU  55 -28.599  -1.861  -4.659
   10   HD22  LEU  55          HD22      LEU  55 -29.308  -0.516  -5.554
   11   HD21  LEU  55          HD23      LEU  55 -28.337  -0.203  -4.116

  No H/Q in entry =          11
  In of MODEL   74
    1    H    LEU  56           H        LEU  56 -25.657   0.154  -1.537
    2    HA   LEU  56           HA       LEU  56 -22.734   0.632  -1.512
    3    HB2  LEU  56           HB2      LEU  56 -24.599   0.417   0.839
    4    HB3  LEU  56           HB3      LEU  56 -22.902   0.895   0.867
    5    HG   LEU  56           HG       LEU  56 -25.219   2.487  -0.196
    6   HD11  LEU  56          HD11      LEU  56 -24.167   2.188   2.362
    7   HD13  LEU  56          HD12      LEU  56 -25.180   3.517   1.800
    8   HD12  LEU  56          HD13      LEU  56 -23.424   3.671   1.761
    9   HD23  LEU  56          HD21      LEU  56 -23.317   4.236  -0.369
   10   HD22  LEU  56          HD22      LEU  56 -23.631   3.103  -1.684
   11   HD21  LEU  56          HD23      LEU  56 -22.300   2.811  -0.566

  No H/Q in entry =          11
  In of MODEL   74
    1    H    GLY  57           H        GLY  57 -21.325  -0.948  -0.906
    2    HA3  GLY  57           HA2      GLY  57 -22.165  -3.663  -1.074
    3    HA2  GLY  57           HA3      GLY  57 -20.572  -3.112  -0.557

  No H/Q in entry =           3
  In of MODEL   74
    1    HA   PRO  58           HA       PRO  58 -23.458  -4.157   3.091
    2    HB2  PRO  58           HB2      PRO  58 -22.719  -6.729   3.770
    3    HB3  PRO  58           HB3      PRO  58 -24.084  -6.380   2.710
    4    HG2  PRO  58           HG2      PRO  58 -21.312  -7.199   2.020
    5    HG3  PRO  58           HG3      PRO  58 -22.843  -7.716   1.314
    6    HD2  PRO  58           HD2      PRO  58 -21.251  -5.878   0.099
    7    HD3  PRO  58           HD3      PRO  58 -23.007  -5.844  -0.054

  No H/Q in entry =           7
  In of MODEL   74
    1    H    GLN  59           H        GLN  59 -20.060  -4.546   2.590
    2    HA   GLN  59           HA       GLN  59 -19.384  -4.488   5.370
    3    HB2  GLN  59           HB2      GLN  59 -17.763  -3.667   2.956
    4    HB3  GLN  59           HB3      GLN  59 -17.137  -3.771   4.590
    5    HG2  GLN  59           HG2      GLN  59 -16.462  -5.765   3.623
    6    HG3  GLN  59           HG3      GLN  59 -17.909  -6.223   4.506
    7   HE21  GLN  59          HE21      GLN  59 -17.804  -7.837   3.044
    8   HE22  GLN  59          HE22      GLN  59 -18.515  -8.074   1.560

  No H/Q in entry =           8
  In of MODEL   74
    1    H    ILE  60           H        ILE  60 -20.324  -2.008   3.084
    2    HA   ILE  60           HA       ILE  60 -19.585   0.012   5.112
    3    HB   ILE  60           HB       ILE  60 -19.815   1.697   3.244
    4   HG12  ILE  60          HG12      ILE  60 -19.495  -0.565   1.317
    5   HG13  ILE  60          HG13      ILE  60 -21.112  -0.056   1.805
    6   HG23  ILE  60          HG21      ILE  60 -17.641   1.246   2.287
    7   HG22  ILE  60          HG22      ILE  60 -17.721  -0.417   2.868
    8   HG21  ILE  60          HG23      ILE  60 -17.659   0.918   4.019
    9   HD13  ILE  60          HD11      ILE  60 -20.777   1.208  -0.114
   10   HD12  ILE  60          HD12      ILE  60 -19.058   1.434   0.211
   11   HD11  ILE  60          HD13      ILE  60 -20.258   2.332   1.141

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ALA  61           H        ALA  61 -21.996  -1.640   5.145
    2    HA   ALA  61           HA       ALA  61 -24.253  -0.047   4.589
    3    HB1  ALA  61           HB1      ALA  61 -25.465  -1.544   5.910
    4    HB2  ALA  61           HB2      ALA  61 -24.087  -1.874   6.959
    5    HB3  ALA  61           HB3      ALA  61 -24.118  -2.516   5.317

  No H/Q in entry =           5
  In of MODEL   74
    1    H    TYR  62           H        TYR  62 -22.125  -0.042   7.450
    2    HA   TYR  62           HA       TYR  62 -23.774   1.604   9.040
    3    HB2  TYR  62           HB2      TYR  62 -21.793   2.097  10.332
    4    HB3  TYR  62           HB3      TYR  62 -21.769   0.394   9.877
    5    HD1  TYR  62           HD1      TYR  62 -20.087  -0.464   8.308
    6    HD2  TYR  62           HD2      TYR  62 -20.126   3.662   9.419
    7    HE1  TYR  62           HE1      TYR  62 -17.852  -0.178   7.309
    8    HE2  TYR  62           HE2      TYR  62 -17.876   3.943   8.422
    9    HH   TYR  62           HH       TYR  62 -16.424   1.411   6.532

  No H/Q in entry =           9
  In of MODEL   74
    1    H    MET  63           H        MET  63 -22.072   2.451   6.215
    2    HA   MET  63           HA       MET  63 -22.002   5.300   6.854
    3    HB2  MET  63           HB2      MET  63 -21.283   3.745   4.369
    4    HB3  MET  63           HB3      MET  63 -21.141   5.498   4.521
    5    HG2  MET  63           HG2      MET  63 -19.465   5.236   6.244
    6    HG3  MET  63           HG3      MET  63 -19.636   3.483   6.167
    7    HE3  MET  63           HE1      MET  63 -19.070   6.071   2.733
    8    HE2  MET  63           HE2      MET  63 -17.583   6.402   3.622
    9    HE1  MET  63           HE3      MET  63 -19.146   6.598   4.416

  No H/Q in entry =           9
  In of MODEL   74
    1    H    LEU  64           H        LEU  64 -24.487   3.357   5.856
    2    HA   LEU  64           HA       LEU  64 -25.674   4.701   3.716
    3    HB2  LEU  64           HB2      LEU  64 -26.512   2.590   4.653
    4    HB3  LEU  64           HB3      LEU  64 -27.033   3.449   6.101
    5    HG   LEU  64           HG       LEU  64 -28.725   4.633   4.800
    6   HD13  LEU  64          HD11      LEU  64 -28.385   4.836   2.572
    7   HD12  LEU  64          HD12      LEU  64 -28.983   3.182   2.442
    8   HD11  LEU  64          HD13      LEU  64 -27.249   3.489   2.544
    9   HD23  LEU  64          HD21      LEU  64 -29.147   1.793   4.096
   10   HD22  LEU  64          HD22      LEU  64 -30.191   2.918   4.965
   11   HD21  LEU  64          HD23      LEU  64 -28.818   2.178   5.785

  No H/Q in entry =          11
  In of MODEL   74
    1    HA   PRO  65           HA       PRO  65 -28.014   7.849   6.339
    2    HB2  PRO  65           HB2      PRO  65 -26.084   8.105   8.645
    3    HB3  PRO  65           HB3      PRO  65 -27.829   8.341   8.636
    4    HG2  PRO  65           HG2      PRO  65 -26.868   6.131   9.635
    5    HG3  PRO  65           HG3      PRO  65 -28.257   6.040   8.552
    6    HD2  PRO  65           HD2      PRO  65 -25.351   5.488   7.942
    7    HD3  PRO  65           HD3      PRO  65 -26.772   4.555   7.472

  No H/Q in entry =           7
  In of MODEL   74
    1    H    GLU  66           H        GLU  66 -24.461   7.888   6.513
    2    HA   GLU  66           HA       GLU  66 -24.224  10.685   6.059
    3    HB2  GLU  66           HB2      GLU  66 -22.335   8.413   5.505
    4    HB3  GLU  66           HB3      GLU  66 -21.923  10.112   5.276
    5    HG2  GLU  66           HG2      GLU  66 -22.212  10.524   7.629
    6    HG3  GLU  66           HG3      GLU  66 -22.701   8.849   7.880

  No H/Q in entry =           6
  In of MODEL   74
    1    H    ILE  67           H        ILE  67 -24.193   7.893   3.862
    2    HA   ILE  67           HA       ILE  67 -23.754   9.566   1.546
    3    HB   ILE  67           HB       ILE  67 -24.584   6.641   1.761
    4   HG12  ILE  67          HG12      ILE  67 -21.959   7.859   0.888
    5   HG13  ILE  67          HG13      ILE  67 -22.291   7.466   2.574
    6   HG21  ILE  67          HG21      ILE  67 -24.511   8.475  -0.501
    7   HG23  ILE  67          HG22      ILE  67 -25.096   6.813  -0.433
    8   HG22  ILE  67          HG23      ILE  67 -23.387   7.135  -0.719
    9   HD12  ILE  67          HD11      ILE  67 -21.761   5.659   0.274
   10   HD11  ILE  67          HD12      ILE  67 -22.798   5.087   1.580
   11   HD13  ILE  67          HD13      ILE  67 -21.147   5.600   1.926

  No H/Q in entry =          11
  In of MODEL   74
    1    H    GLN  68           H        GLN  68 -26.643   8.473   3.120
    2    HA   GLN  68           HA       GLN  68 -28.437   9.318   1.077
    3    HB2  GLN  68           HB2      GLN  68 -28.768   9.014   4.059
    4    HB3  GLN  68           HB3      GLN  68 -30.073   9.556   3.017
    5    HG2  GLN  68           HG2      GLN  68 -30.017   7.500   1.783
    6    HG3  GLN  68           HG3      GLN  68 -28.577   6.976   2.637
    7   HE21  GLN  68          HE21      GLN  68 -30.718   5.563   2.469
    8   HE22  GLN  68          HE22      GLN  68 -31.576   5.115   3.870

  No H/Q in entry =           8
  In of MODEL   74
    1    H    ARG  69           H        ARG  69 -26.950  11.077   3.823
    2    HA   ARG  69           HA       ARG  69 -28.359  13.518   3.329
    3    HB2  ARG  69           HB2      ARG  69 -26.040  12.676   5.000
    4    HB3  ARG  69           HB3      ARG  69 -26.148  14.386   4.605
    5    HG2  ARG  69           HG2      ARG  69 -28.491  14.392   5.511
    6    HG3  ARG  69           HG3      ARG  69 -28.258  12.718   6.025
    7    HD2  ARG  69           HD2      ARG  69 -26.646  15.130   6.937
    8    HD3  ARG  69           HD3      ARG  69 -27.782  14.217   7.918
    9    HE   ARG  69           HE       ARG  69 -25.123  13.329   7.061
   10   HH21  ARG  69          HH11      ARG  69 -24.309  11.609   8.314
   11   HH22  ARG  69          HH12      ARG  69 -25.350  10.792   9.430
   12   HH11  ARG  69          HH21      ARG  69 -28.114  12.746   8.686
   13   HH12  ARG  69          HH22      ARG  69 -27.504  11.433   9.639

  No H/Q in entry =          13
  In of MODEL   74
    1    H    LEU  70           H        LEU  70 -25.420  12.152   2.078
    2    HA   LEU  70           HA       LEU  70 -24.328  14.519   0.894
    3    HB2  LEU  70           HB2      LEU  70 -23.298  12.237   1.563
    4    HB3  LEU  70           HB3      LEU  70 -23.858  11.726  -0.030
    5    HG   LEU  70           HG       LEU  70 -22.266  13.113  -1.098
    6   HD11  LEU  70          HD11      LEU  70 -21.541  14.030   1.694
    7   HD13  LEU  70          HD12      LEU  70 -22.224  15.022   0.406
    8   HD12  LEU  70          HD13      LEU  70 -20.592  14.374   0.245
    9   HD22  LEU  70          HD21      LEU  70 -20.802  11.435  -0.791
   10   HD21  LEU  70          HD22      LEU  70 -21.756  10.919   0.600
   11   HD23  LEU  70          HD23      LEU  70 -20.401  12.026   0.821

  No H/Q in entry =          11
  In of MODEL   74
    1    H    LEU  71           H        LEU  71 -26.392  11.907  -0.229
    2    HA   LEU  71           HA       LEU  71 -26.879  13.332  -2.789
    3    HB2  LEU  71           HB2      LEU  71 -27.033  10.353  -2.288
    4    HB3  LEU  71           HB3      LEU  71 -27.137  11.180  -3.842
    5    HG   LEU  71           HG       LEU  71 -24.664  11.280  -2.112
    6   HD12  LEU  71          HD11      LEU  71 -24.615   9.605  -4.511
    7   HD11  LEU  71          HD12      LEU  71 -25.649   8.985  -3.224
    8   HD13  LEU  71          HD13      LEU  71 -23.943   9.307  -2.908
    9   HD22  LEU  71          HD21      LEU  71 -24.764  13.064  -3.645
   10   HD21  LEU  71          HD22      LEU  71 -25.202  11.985  -4.968
   11   HD23  LEU  71          HD23      LEU  71 -23.598  11.887  -4.244

  No H/Q in entry =          11
  In of MODEL   74
    1    HA   PRO  72           HA       PRO  72 -30.807  12.852  -0.266
    2    HB2  PRO  72           HB2      PRO  72 -31.713  15.392  -0.423
    3    HB3  PRO  72           HB3      PRO  72 -30.427  14.989   0.713
    4    HG2  PRO  72           HG2      PRO  72 -30.187  16.134  -2.058
    5    HG3  PRO  72           HG3      PRO  72 -29.474  16.730  -0.560
    6    HD2  PRO  72           HD2      PRO  72 -28.057  15.165  -2.257
    7    HD3  PRO  72           HD3      PRO  72 -27.847  15.038  -0.512

  No H/Q in entry =           7
  In of MODEL   74
    1    H    ASN  73           H        ASN  73 -30.113  13.756  -3.481
    2    HA   ASN  73           HA       ASN  73 -32.947  13.378  -4.185
    3    HB2  ASN  73           HB2      ASN  73 -32.446  14.451  -6.291
    4    HB3  ASN  73           HB3      ASN  73 -31.980  15.469  -4.936
    5   HD21  ASN  73          HD21      ASN  73 -31.111  15.476  -7.591
    6   HD22  ASN  73          HD22      ASN  73 -29.436  15.345  -7.734

  No H/Q in entry =           6
  In of MODEL   74
    1    H    LYS  74           H        LYS  74 -30.937  11.171  -3.661
    2    HA   LYS  74           HA       LYS  74 -31.406   9.715  -6.194
    3    HB2  LYS  74           HB2      LYS  74 -28.915   9.505  -4.499
    4    HB3  LYS  74           HB3      LYS  74 -29.240   8.655  -6.010
    5    HG2  LYS  74           HG2      LYS  74 -29.037  11.633  -5.861
    6    HG3  LYS  74           HG3      LYS  74 -27.635  10.591  -6.106
    7    HD2  LYS  74           HD2      LYS  74 -28.680   9.603  -8.060
    8    HD3  LYS  74           HD3      LYS  74 -30.127  10.580  -7.800
    9    HE2  LYS  74           HE2      LYS  74 -28.926  12.600  -8.248
   10    HE3  LYS  74           HE3      LYS  74 -27.388  11.738  -8.279
   11    HZ2  LYS  74           HZ1      LYS  74 -28.809  12.270 -10.457
   12    HZ1  LYS  74           HZ2      LYS  74 -29.445  10.744 -10.071
   13    HZ3  LYS  74           HZ3      LYS  74 -27.777  10.929 -10.325

  No H/Q in entry =          13
  In of MODEL   74
    1    HA   PRO  75           HA       PRO  75 -32.828   6.763  -3.203
    2    HB2  PRO  75           HB2      PRO  75 -33.053   4.509  -4.748
    3    HB3  PRO  75           HB3      PRO  75 -34.201   5.841  -4.876
    4    HG2  PRO  75           HG2      PRO  75 -31.804   5.252  -6.569
    5    HG3  PRO  75           HG3      PRO  75 -33.447   5.650  -7.071
    6    HD2  PRO  75           HD2      PRO  75 -31.542   7.552  -7.012
    7    HD3  PRO  75           HD3      PRO  75 -33.195   7.931  -6.527

  No H/Q in entry =           7
  In of MODEL   74
    1    H    VAL  76           H        VAL  76 -31.395   5.763  -1.769
    2    HA   VAL  76           HA       VAL  76 -28.879   4.577  -2.783
    3    HB   VAL  76           HB       VAL  76 -29.268   6.091  -0.165
    4   HG11  VAL  76          HG11      VAL  76 -26.851   4.820  -1.464
    5   HG13  VAL  76          HG12      VAL  76 -27.582   4.388   0.083
    6   HG12  VAL  76          HG13      VAL  76 -26.759   5.937  -0.101
    7   HG22  VAL  76          HG21      VAL  76 -28.608   7.986  -1.072
    8   HG21  VAL  76          HG22      VAL  76 -29.096   7.249  -2.599
    9   HG23  VAL  76          HG23      VAL  76 -27.406   7.202  -2.096

  No H/Q in entry =           9
  In of MODEL   74
    1    H    GLU  77           H        GLU  77 -28.640   2.440  -2.120
    2    HA   GLU  77           HA       GLU  77 -29.488   1.692   0.526
    3    HB2  GLU  77           HB2      GLU  77 -31.050   0.005  -0.014
    4    HB3  GLU  77           HB3      GLU  77 -31.606   1.503  -0.763
    5    HG2  GLU  77           HG2      GLU  77 -30.922   0.713  -2.917
    6    HG3  GLU  77           HG3      GLU  77 -30.273  -0.758  -2.195

  No H/Q in entry =           6
  In of MODEL   74
    1    H    VAL  78           H        VAL  78 -29.142  -0.375   1.238
    2    HA   VAL  78           HA       VAL  78 -26.438  -1.114   0.440
    3    HB   VAL  78           HB       VAL  78 -28.196  -1.982   2.775
    4   HG11  VAL  78          HG11      VAL  78 -25.804  -3.190   1.741
    5   HG13  VAL  78          HG12      VAL  78 -26.743  -3.648   3.163
    6   HG12  VAL  78          HG13      VAL  78 -25.449  -2.460   3.307
    7   HG22  VAL  78          HG21      VAL  78 -26.800  -0.566   4.125
    8   HG21  VAL  78          HG22      VAL  78 -27.518   0.365   2.809
    9   HG23  VAL  78          HG23      VAL  78 -25.828  -0.135   2.718

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ILE  79           H        ILE  79 -25.840  -3.030  -0.410
    2    HA   ILE  79           HA       ILE  79 -27.835  -4.572  -1.784
    3    HB   ILE  79           HB       ILE  79 -24.842  -5.039  -1.469
    4   HG12  ILE  79          HG12      ILE  79 -26.434  -4.012  -3.824
    5   HG13  ILE  79          HG13      ILE  79 -25.611  -2.963  -2.669
    6   HG22  ILE  79          HG21      ILE  79 -25.857  -6.286  -3.792
    7   HG21  ILE  79          HG22      ILE  79 -26.870  -6.798  -2.442
    8   HG23  ILE  79          HG23      ILE  79 -25.126  -7.043  -2.377
    9   HD13  ILE  79          HD11      ILE  79 -24.145  -3.086  -4.444
   10   HD12  ILE  79          HD12      ILE  79 -24.445  -4.806  -4.698
   11   HD11  ILE  79          HD13      ILE  79 -23.510  -4.271  -3.301

  No H/Q in entry =          11
  In of MODEL   74
    1    H    ASP  80           H        ASP  80 -28.680  -6.500  -1.185
    2    HA   ASP  80           HA       ASP  80 -28.686  -7.345   1.480
    3    HB2  ASP  80           HB2      ASP  80 -30.382  -7.987  -0.196
    4    HB3  ASP  80           HB3      ASP  80 -29.182  -8.990  -1.011

  No H/Q in entry =           4
  In of MODEL   74
    1    H    SER  81           H        SER  81 -27.162  -8.427   2.675
    2    HA   SER  81           HA       SER  81 -24.621  -9.086   1.569
    3    HB2  SER  81           HB2      SER  81 -24.113 -10.061   3.774
    4    HB3  SER  81           HB3      SER  81 -24.848  -8.467   3.934
    5    HG   SER  81           HG       SER  81 -25.636 -10.730   4.992

  No H/Q in entry =           5
  In of MODEL   74
    1    H    LEU  82           H        LEU  82 -27.301 -11.222   1.858
    2    HA   LEU  82           HA       LEU  82 -25.696 -13.571   1.431
    3    HB2  LEU  82           HB2      LEU  82 -28.626 -13.152   0.887
    4    HB3  LEU  82           HB3      LEU  82 -27.796 -14.689   1.122
    5    HG   LEU  82           HG       LEU  82 -28.249 -12.599   3.232
    6   HD13  LEU  82          HD11      LEU  82 -29.808 -14.245   4.162
    7   HD12  LEU  82          HD12      LEU  82 -29.481 -15.332   2.812
    8   HD11  LEU  82          HD13      LEU  82 -30.297 -13.795   2.527
    9   HD21  LEU  82          HD21      LEU  82 -26.888 -15.290   3.173
   10   HD23  LEU  82          HD22      LEU  82 -27.422 -14.525   4.670
   11   HD22  LEU  82          HD23      LEU  82 -26.206 -13.738   3.664

  No H/Q in entry =          11
  In of MODEL   74
    1    H    LEU  83           H        LEU  83 -27.640 -11.422  -0.588
    2    HA   LEU  83           HA       LEU  83 -27.345 -12.826  -3.023
    3    HB2  LEU  83           HB2      LEU  83 -27.825  -9.915  -2.449
    4    HB3  LEU  83           HB3      LEU  83 -27.799 -10.594  -4.075
    5    HG   LEU  83           HG       LEU  83 -29.886 -10.974  -1.949
    6   HD13  LEU  83          HD11      LEU  83 -30.646  -9.163  -3.073
    7   HD12  LEU  83          HD12      LEU  83 -31.051 -10.312  -4.347
    8   HD11  LEU  83          HD13      LEU  83 -29.531  -9.419  -4.414
    9   HD23  LEU  83          HD21      LEU  83 -29.925 -12.290  -4.649
   10   HD22  LEU  83          HD22      LEU  83 -30.928 -12.629  -3.240
   11   HD21  LEU  83          HD23      LEU  83 -29.230 -13.102  -3.247

  No H/Q in entry =          11
  In of MODEL   74
    1    H    TYR  84           H        TYR  84 -25.483 -10.372  -1.344
    2    HA   TYR  84           HA       TYR  84 -23.570  -9.893  -3.432
    3    HB2  TYR  84           HB2      TYR  84 -24.143  -8.342  -1.509
    4    HB3  TYR  84           HB3      TYR  84 -23.227  -9.428  -0.468
    5    HD1  TYR  84           HD1      TYR  84 -20.784  -9.627  -0.712
    6    HD2  TYR  84           HD2      TYR  84 -23.027  -6.834  -3.034
    7    HE1  TYR  84           HE1      TYR  84 -18.687  -8.467  -1.319
    8    HE2  TYR  84           HE2      TYR  84 -20.940  -5.670  -3.658
    9    HH   TYR  84           HH       TYR  84 -18.097  -6.831  -3.578

  No H/Q in entry =           9
  In of MODEL   74
    1    H    GLY  85           H        GLY  85 -23.378 -11.830  -0.437
    2    HA3  GLY  85           HA2      GLY  85 -20.771 -12.734  -0.829
    3    HA2  GLY  85           HA3      GLY  85 -22.012 -13.584   0.092

  No H/Q in entry =           3
  In of MODEL   74
    1    H    LYS  86           H        LYS  86 -23.793 -14.033  -2.010
    2    HA   LYS  86           HA       LYS  86 -22.660 -16.414  -3.189
    3    HB2  LYS  86           HB2      LYS  86 -24.949 -16.235  -2.278
    4    HB3  LYS  86           HB3      LYS  86 -25.331 -15.044  -3.520
    5    HG2  LYS  86           HG2      LYS  86 -25.081 -16.729  -5.229
    6    HG3  LYS  86           HG3      LYS  86 -24.666 -17.924  -3.999
    7    HD2  LYS  86           HD2      LYS  86 -26.827 -17.517  -2.888
    8    HD3  LYS  86           HD3      LYS  86 -27.242 -16.346  -4.139
    9    HE2  LYS  86           HE2      LYS  86 -27.136 -18.104  -5.830
   10    HE3  LYS  86           HE3      LYS  86 -26.695 -19.277  -4.589
   11    HZ1  LYS  86           HZ1      LYS  86 -28.915 -18.130  -3.562
   12    HZ3  LYS  86           HZ2      LYS  86 -28.885 -19.601  -4.414
   13    HZ2  LYS  86           HZ3      LYS  86 -29.273 -18.159  -5.223

  No H/Q in entry =          13
  In of MODEL   74
    1    H    VAL  87           H        VAL  87 -22.683 -13.218  -4.150
    2    HA   VAL  87           HA       VAL  87 -22.350 -12.081  -6.107
    3    HB   VAL  87           HB       VAL  87 -21.192 -14.614  -7.315
    4   HG13  VAL  87          HG11      VAL  87 -19.895 -13.144  -8.616
    5   HG12  VAL  87          HG12      VAL  87 -20.114 -11.806  -7.488
    6   HG11  VAL  87          HG13      VAL  87 -21.449 -12.318  -8.520
    7   HG23  VAL  87          HG21      VAL  87 -19.791 -12.803  -5.357
    8   HG22  VAL  87          HG22      VAL  87 -19.057 -14.126  -6.260
    9   HG21  VAL  87          HG23      VAL  87 -20.291 -14.465  -5.049

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ASP  88           H        ASP  88 -24.863 -12.763  -5.812
    2    HA   ASP  88           HA       ASP  88 -25.894 -14.050  -8.213
    3    HB2  ASP  88           HB2      ASP  88 -26.950 -14.265  -5.912
    4    HB3  ASP  88           HB3      ASP  88 -27.431 -12.574  -6.061

  No H/Q in entry =           4
  In of MODEL   74
    1    H    GLY  89           H        GLY  89 -25.168 -12.814  -9.861
    2    HA3  GLY  89           HA2      GLY  89 -25.395 -10.050 -10.126
    3    HA2  GLY  89           HA3      GLY  89 -25.312 -11.198 -11.460

  No H/Q in entry =           3
  In of MODEL   74
    1    H    LEU  90           H        LEU  90 -27.744 -12.587 -11.051
    2    HA   LEU  90           HA       LEU  90 -29.560 -10.711 -12.255
    3    HB2  LEU  90           HB2      LEU  90 -29.564 -13.120 -12.785
    4    HB3  LEU  90           HB3      LEU  90 -30.108 -13.461 -11.142
    5    HG   LEU  90           HG       LEU  90 -32.237 -12.393 -11.587
    6   HD13  LEU  90          HD11      LEU  90 -32.049 -10.680 -13.094
    7   HD12  LEU  90          HD12      LEU  90 -32.533 -11.952 -14.219
    8   HD11  LEU  90          HD13      LEU  90 -30.832 -11.522 -14.057
    9   HD23  LEU  90          HD21      LEU  90 -32.069 -14.072 -13.984
   10   HD22  LEU  90          HD22      LEU  90 -33.085 -14.225 -12.551
   11   HD21  LEU  90          HD23      LEU  90 -31.420 -14.806 -12.517

  No H/Q in entry =          11
  In of MODEL   74
    1    H    GLY  91           H        GLY  91 -29.451 -12.141  -9.035
    2    HA3  GLY  91           HA2      GLY  91 -31.839 -11.053  -8.084
    3    HA2  GLY  91           HA3      GLY  91 -30.464 -11.538  -7.093

  No H/Q in entry =           3
  In of MODEL   74
    1    H    VAL  92           H        VAL  92 -28.557  -9.693  -7.936
    2    HA   VAL  92           HA       VAL  92 -29.434  -7.376  -6.460
    3    HB   VAL  92           HB       VAL  92 -26.837  -7.829  -7.975
    4   HG12  VAL  92          HG11      VAL  92 -27.101  -5.898  -5.695
    5   HG11  VAL  92          HG12      VAL  92 -27.733  -5.400  -7.266
    6   HG13  VAL  92          HG13      VAL  92 -26.033  -5.833  -7.098
    7   HG22  VAL  92          HG21      VAL  92 -26.627  -9.377  -6.343
    8   HG21  VAL  92          HG22      VAL  92 -27.816  -8.597  -5.299
    9   HG23  VAL  92          HG23      VAL  92 -26.172  -7.967  -5.388

  No H/Q in entry =           9
  In of MODEL   74
    1    H    LEU  93           H        LEU  93 -28.921  -8.102  -9.853
    2    HA   LEU  93           HA       LEU  93 -29.291  -5.494 -10.849
    3    HB2  LEU  93           HB2      LEU  93 -28.573  -7.366 -12.251
    4    HB3  LEU  93           HB3      LEU  93 -30.156  -8.120 -12.056
    5    HG   LEU  93           HG       LEU  93 -31.174  -6.202 -13.249
    6   HD11  LEU  93          HD11      LEU  93 -29.369  -4.560 -12.730
    7   HD13  LEU  93          HD12      LEU  93 -29.760  -4.635 -14.449
    8   HD12  LEU  93          HD13      LEU  93 -28.309  -5.428 -13.841
    9   HD23  LEU  93          HD21      LEU  93 -30.063  -6.797 -15.495
   10   HD22  LEU  93          HD22      LEU  93 -30.904  -8.050 -14.585
   11   HD21  LEU  93          HD23      LEU  93 -29.142  -7.960 -14.541

  No H/Q in entry =          11
  In of MODEL   74
    1    H    LYS  94           H        LYS  94 -31.639  -8.068 -10.008
    2    HA   LYS  94           HA       LYS  94 -33.993  -6.686 -10.727
    3    HB2  LYS  94           HB2      LYS  94 -33.492  -8.817  -8.655
    4    HB3  LYS  94           HB3      LYS  94 -35.095  -8.159  -8.981
    5    HG2  LYS  94           HG2      LYS  94 -34.930  -8.982 -11.295
    6    HG3  LYS  94           HG3      LYS  94 -33.365  -9.695 -10.909
    7    HD2  LYS  94           HD2      LYS  94 -34.509 -11.012  -9.085
    8    HD3  LYS  94           HD3      LYS  94 -36.048 -10.407  -9.696
    9    HE2  LYS  94           HE2      LYS  94 -35.454 -11.373 -11.927
   10    HE3  LYS  94           HE3      LYS  94 -34.044 -12.113 -11.169
   11    HZ3  LYS  94           HZ1      LYS  94 -35.859 -13.674 -11.355
   12    HZ2  LYS  94           HZ2      LYS  94 -36.877 -12.648 -10.463
   13    HZ1  LYS  94           HZ3      LYS  94 -35.522 -13.355  -9.722

  No H/Q in entry =          13
  In of MODEL   74
    1    H    ALA  95           H        ALA  95 -32.251  -6.706  -7.628
    2    HA   ALA  95           HA       ALA  95 -34.170  -5.131  -6.233
    3    HB2  ALA  95           HB1      ALA  95 -31.784  -6.448  -5.603
    4    HB3  ALA  95           HB2      ALA  95 -32.811  -5.538  -4.497
    5    HB1  ALA  95           HB3      ALA  95 -31.457  -4.743  -5.298

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ALA  96           H        ALA  96 -31.488  -4.271  -8.278
    2    HA   ALA  96           HA       ALA  96 -31.465  -1.492  -7.561
    3    HB2  ALA  96           HB1      ALA  96 -30.051  -1.284  -9.637
    4    HB3  ALA  96           HB2      ALA  96 -30.314  -3.003  -9.928
    5    HB1  ALA  96           HB3      ALA  96 -29.448  -2.476  -8.486

  No H/Q in entry =           5
  In of MODEL   74
    1    H    VAL  97           H        VAL  97 -32.892  -3.292 -10.250
    2    HA   VAL  97           HA       VAL  97 -33.968  -1.040 -11.583
    3    HB   VAL  97           HB       VAL  97 -34.724  -3.981 -11.585
    4   HG11  VAL  97          HG11      VAL  97 -36.538  -2.019 -12.161
    5   HG13  VAL  97          HG12      VAL  97 -36.547  -3.628 -12.884
    6   HG12  VAL  97          HG13      VAL  97 -35.796  -2.282 -13.740
    7   HG21  VAL  97          HG21      VAL  97 -33.422  -2.172 -13.623
    8   HG23  VAL  97          HG22      VAL  97 -33.837  -3.866 -13.888
    9   HG22  VAL  97          HG23      VAL  97 -32.628  -3.431 -12.679

  No H/Q in entry =           9
  In of MODEL   74
    1    H    ALA  98           H        ALA  98 -35.181  -3.187  -9.033
    2    HA   ALA  98           HA       ALA  98 -37.770  -2.078  -8.775
    3    HB1  ALA  98           HB1      ALA  98 -36.746  -4.236  -7.669
    4    HB3  ALA  98           HB2      ALA  98 -37.968  -3.315  -6.790
    5    HB2  ALA  98           HB3      ALA  98 -36.260  -3.127  -6.388

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ALA  99           H        ALA  99 -34.752  -1.190  -7.064
    2    HA   ALA  99           HA       ALA  99 -35.959   0.808  -5.475
    3    HB1  ALA  99           HB1      ALA  99 -33.277  -0.051  -6.133
    4    HB2  ALA  99           HB2      ALA  99 -33.880   0.720  -4.665
    5    HB3  ALA  99           HB3      ALA  99 -33.384   1.707  -6.040

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ILE 100           H        ILE 100 -34.831   0.887  -8.804
    2    HA   ILE 100           HA       ILE 100 -35.051   3.727  -9.087
    3    HB   ILE 100           HB       ILE 100 -35.052   1.527 -11.182
    4   HG12  ILE 100          HG12      ILE 100 -32.941   3.569 -10.495
    5   HG13  ILE 100          HG13      ILE 100 -32.967   1.936  -9.832
    6   HG21  ILE 100          HG21      ILE 100 -35.520   4.436 -11.385
    7   HG23  ILE 100          HG22      ILE 100 -35.974   3.137 -12.488
    8   HG22  ILE 100          HG23      ILE 100 -34.332   3.779 -12.511
    9   HD12  ILE 100          HD11      ILE 100 -32.376   2.846 -12.610
   10   HD11  ILE 100          HD12      ILE 100 -33.017   1.224 -12.340
   11   HD13  ILE 100          HD13      ILE 100 -31.497   1.709 -11.588

  No H/Q in entry =          11
  In of MODEL   74
    1    H    LYS 101           H        LYS 101 -37.281   1.065  -9.820
    2    HA   LYS 101           HA       LYS 101 -39.361   2.658 -10.909
    3    HB2  LYS 101           HB2      LYS 101 -39.230  -0.091  -9.722
    4    HB3  LYS 101           HB3      LYS 101 -40.784   0.638 -10.124
    5    HG2  LYS 101           HG2      LYS 101 -40.250   0.734 -12.410
    6    HG3  LYS 101           HG3      LYS 101 -38.555   0.363 -12.103
    7    HD2  LYS 101           HD2      LYS 101 -39.750  -1.584 -12.981
    8    HD3  LYS 101           HD3      LYS 101 -39.162  -1.871 -11.344
    9    HE2  LYS 101           HE2      LYS 101 -41.226  -2.590 -10.879
   10    HE3  LYS 101           HE3      LYS 101 -41.710  -0.894 -10.929
   11    HZ3  LYS 101           HZ1      LYS 101 -42.541  -1.108 -13.066
   12    HZ2  LYS 101           HZ2      LYS 101 -42.998  -2.575 -12.341
   13    HZ1  LYS 101           HZ3      LYS 101 -41.663  -2.527 -13.390

  No H/Q in entry =          13
  In of MODEL   74
    1    H    LYS 102           H        LYS 102 -38.932   1.254  -7.659
    2    HA   LYS 102           HA       LYS 102 -41.231   2.435  -6.546
    3    HB2  LYS 102           HB2      LYS 102 -39.992   0.610  -5.460
    4    HB3  LYS 102           HB3      LYS 102 -38.626   1.694  -5.201
    5    HG2  LYS 102           HG2      LYS 102 -40.005   3.095  -3.769
    6    HG3  LYS 102           HG3      LYS 102 -41.375   2.016  -4.030
    7    HD2  LYS 102           HD2      LYS 102 -40.148   0.191  -2.934
    8    HD3  LYS 102           HD3      LYS 102 -38.778   1.272  -2.671
    9    HE2  LYS 102           HE2      LYS 102 -40.194   2.755  -1.329
   10    HE3  LYS 102           HE3      LYS 102 -41.581   1.705  -1.615
   11    HZ1  LYS 102           HZ1      LYS 102 -39.860  -0.001  -0.530
   12    HZ3  LYS 102           HZ2      LYS 102 -41.010   0.884   0.352
   13    HZ2  LYS 102           HZ3      LYS 102 -39.405   1.433   0.257

  No H/Q in entry =          13
  In of MODEL   74
    1    H    ALA 103           H        ALA 103 -38.273   3.855  -7.507
    2    HA   ALA 103           HA       ALA 103 -38.582   6.201  -5.778
    3    HB2  ALA 103           HB1      ALA 103 -36.560   6.937  -7.314
    4    HB3  ALA 103           HB2      ALA 103 -36.487   5.213  -7.677
    5    HB1  ALA 103           HB3      ALA 103 -36.313   5.773  -6.013

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ALA 104           H        ALA 104 -39.099   5.394  -9.125
    2    HA   ALA 104           HA       ALA 104 -39.712   8.155  -9.819
    3    HB2  ALA 104           HB1      ALA 104 -39.684   7.443 -12.007
    4    HB1  ALA 104           HB2      ALA 104 -40.396   5.877 -11.618
    5    HB3  ALA 104           HB3      ALA 104 -38.686   6.175 -11.298

  No H/Q in entry =           5
  In of MODEL   74
    1    H    ALA 105           H        ALA 105 -41.335   6.059  -8.017
    2    HA   ALA 105           HA       ALA 105 -43.782   7.412  -8.084
    3    HB2  ALA 105           HB1      ALA 105 -44.456   6.500 -10.125
    4    HB3  ALA 105           HB2      ALA 105 -45.104   5.324  -8.981
    5    HB1  ALA 105           HB3      ALA 105 -43.604   4.983  -9.843

  No H/Q in entry =           5
  In of MODEL   75
    1    H1   ALA   1           H3       ALA   1 -11.926 -16.306  -2.418
    2    H2   ALA   1           H2       ALA   1 -10.958 -17.428  -3.253
    3    H3   ALA   1           H1       ALA   1 -12.122 -16.513  -4.091
    4    HA   ALA   1           HA       ALA   1 -13.481 -18.245  -3.847
    5    HB3  ALA   1           HB1      ALA   1 -12.045 -19.982  -3.378
    6    HB1  ALA   1           HB2      ALA   1 -12.805 -19.882  -1.790
    7    HB2  ALA   1           HB3      ALA   1 -11.247 -19.106  -2.071

  No H/Q in entry =           7
  In of MODEL   75
    1    H    GLU   2           H        GLU   2 -15.086 -19.131  -2.192
    2    HA   GLU   2           HA       GLU   2 -16.775 -17.446  -1.141
    3    HB2  GLU   2           HB2      GLU   2 -15.781 -19.844   0.413
    4    HB3  GLU   2           HB3      GLU   2 -17.325 -19.029   0.662
    5    HG2  GLU   2           HG2      GLU   2 -18.277 -20.143  -1.069
    6    HG3  GLU   2           HG3      GLU   2 -16.962 -19.716  -2.154

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLU   3           H        GLU   3 -14.835 -18.746   1.489
    2    HA   GLU   3           HA       GLU   3 -15.113 -16.393   3.038
    3    HB2  GLU   3           HB2      GLU   3 -13.469 -18.901   3.299
    4    HB3  GLU   3           HB3      GLU   3 -13.269 -17.573   4.442
    5    HG2  GLU   3           HG2      GLU   3 -15.460 -17.772   5.258
    6    HG3  GLU   3           HG3      GLU   3 -16.034 -18.590   3.811

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LEU   4           H        LEU   4 -12.122 -17.807   1.655
    2    HA   LEU   4           HA       LEU   4 -10.334 -15.860   2.249
    3    HB2  LEU   4           HB2      LEU   4 -10.531 -17.172  -0.471
    4    HB3  LEU   4           HB3      LEU   4  -9.096 -16.416   0.213
    5    HG   LEU   4           HG       LEU   4 -10.536 -18.843   1.332
    6   HD13  LEU   4          HD11      LEU   4  -8.872 -20.164   0.409
    7   HD12  LEU   4          HD12      LEU   4  -7.692 -18.853   0.380
    8   HD11  LEU   4          HD13      LEU   4  -8.978 -18.909  -0.824
    9   HD23  LEU   4          HD21      LEU   4  -8.286 -18.850   2.717
   10   HD22  LEU   4          HD22      LEU   4  -9.631 -17.839   3.241
   11   HD21  LEU   4          HD23      LEU   4  -8.284 -17.122   2.357

  No H/Q in entry =          11
  In of MODEL   75
    1    H    GLU   5           H        GLU   5 -12.669 -15.716  -0.428
    2    HA   GLU   5           HA       GLU   5 -11.722 -13.214  -1.436
    3    HB2  GLU   5           HB2      GLU   5 -13.036 -14.848  -2.785
    4    HB3  GLU   5           HB3      GLU   5 -14.445 -14.485  -1.788
    5    HG2  GLU   5           HG2      GLU   5 -14.602 -13.123  -3.769
    6    HG3  GLU   5           HG3      GLU   5 -14.171 -12.061  -2.428

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLU   6           H        GLU   6 -14.429 -14.147   0.655
    2    HA   GLU   6           HA       GLU   6 -15.395 -11.491   1.044
    3    HB2  GLU   6           HB2      GLU   6 -16.780 -13.508   1.448
    4    HB3  GLU   6           HB3      GLU   6 -15.736 -13.934   2.804
    5    HG2  GLU   6           HG2      GLU   6 -16.306 -11.824   3.926
    6    HG3  GLU   6           HG3      GLU   6 -17.323 -11.361   2.564

  No H/Q in entry =           6
  In of MODEL   75
    1    H    VAL   7           H        VAL   7 -13.042 -13.542   2.626
    2    HA   VAL   7           HA       VAL   7 -12.616 -11.949   4.949
    3    HB   VAL   7           HB       VAL   7 -10.863 -13.958   3.508
    4   HG11  VAL   7          HG11      VAL   7 -10.434 -12.406   6.068
    5   HG13  VAL   7          HG12      VAL   7  -9.327 -12.600   4.709
    6   HG12  VAL   7          HG13      VAL   7  -9.651 -13.960   5.783
    7   HG21  VAL   7          HG21      VAL   7 -13.102 -14.570   4.727
    8   HG23  VAL   7          HG22      VAL   7 -12.184 -14.269   6.203
    9   HG22  VAL   7          HG23      VAL   7 -11.660 -15.521   5.078

  No H/Q in entry =           9
  In of MODEL   75
    1    H    VAL   8           H        VAL   8 -11.097 -12.040   1.741
    2    HA   VAL   8           HA       VAL   8  -9.079 -10.118   2.230
    3    HB   VAL   8           HB       VAL   8 -10.503 -10.980  -0.288
    4   HG12  VAL   8          HG11      VAL   8  -8.497  -9.705  -1.371
    5   HG11  VAL   8          HG12      VAL   8  -8.457  -8.811   0.150
    6   HG13  VAL   8          HG13      VAL   8  -9.908  -8.780  -0.853
    7   HG22  VAL   8          HG21      VAL   8  -8.958 -12.653  -0.154
    8   HG21  VAL   8          HG22      VAL   8  -8.213 -11.898   1.251
    9   HG23  VAL   8          HG23      VAL   8  -7.696 -11.439  -0.369

  No H/Q in entry =           9
  In of MODEL   75
    1    H    MET   9           H        MET   9 -12.431  -9.810   1.064
    2    HA   MET   9           HA       MET   9 -12.430  -7.034   0.620
    3    HB2  MET   9           HB2      MET   9 -14.568  -9.010   1.370
    4    HB3  MET   9           HB3      MET   9 -14.935  -7.284   1.319
    5    HG2  MET   9           HG2      MET   9 -13.864  -7.306  -1.024
    6    HG3  MET   9           HG3      MET   9 -13.998  -9.061  -0.933
    7    HE2  MET   9           HE1      MET   9 -16.742  -9.760   0.506
    8    HE1  MET   9           HE2      MET   9 -15.861 -10.395  -0.881
    9    HE3  MET   9           HE3      MET   9 -17.560  -9.966  -1.050

  No H/Q in entry =           9
  In of MODEL   75
    1    H    GLY  10           H        GLY  10 -13.054  -8.930   3.553
    2    HA3  GLY  10           HA2      GLY  10 -13.655  -6.752   5.263
    3    HA2  GLY  10           HA3      GLY  10 -13.055  -8.326   5.783

  No H/Q in entry =           3
  In of MODEL   75
    1    H    LEU  11           H        LEU  11 -10.605  -8.398   4.472
    2    HA   LEU  11           HA       LEU  11  -8.941  -6.919   6.227
    3    HB2  LEU  11           HB2      LEU  11  -8.358  -8.338   3.625
    4    HB3  LEU  11           HB3      LEU  11  -7.106  -7.601   4.623
    5    HG   LEU  11           HG       LEU  11  -9.061  -9.676   5.644
    6   HD13  LEU  11          HD11      LEU  11  -7.809 -10.890   4.086
    7   HD12  LEU  11          HD12      LEU  11  -6.870 -11.101   5.563
    8   HD11  LEU  11          HD13      LEU  11  -6.355  -9.928   4.352
    9   HD22  LEU  11          HD21      LEU  11  -8.235  -8.637   7.558
   10   HD21  LEU  11          HD22      LEU  11  -6.706  -8.202   6.796
   11   HD23  LEU  11          HD23      LEU  11  -6.993  -9.864   7.311

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  12           H        ILE  12  -9.851  -6.405   2.834
    2    HA   ILE  12           HA       ILE  12  -8.211  -4.137   2.402
    3    HB   ILE  12           HB       ILE  12 -10.846  -4.876   1.105
    4   HG12  ILE  12          HG12      ILE  12  -8.767  -6.475   1.040
    5   HG13  ILE  12          HG13      ILE  12  -9.639  -6.149  -0.445
    6   HG21  ILE  12          HG21      ILE  12  -8.659  -2.951   0.247
    7   HG23  ILE  12          HG22      ILE  12 -10.315  -2.531   0.663
    8   HG22  ILE  12          HG23      ILE  12  -9.975  -3.474  -0.758
    9   HD11  ILE  12          HD11      ILE  12  -7.148  -4.675   0.456
   10   HD13  ILE  12          HD12      ILE  12  -7.960  -4.526  -1.101
   11   HD12  ILE  12          HD13      ILE  12  -7.149  -6.015  -0.675

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  13           H        ILE  13 -11.567  -4.481   3.491
    2    HA   ILE  13           HA       ILE  13 -12.094  -1.704   3.750
    3    HB   ILE  13           HB       ILE  13 -13.242  -4.140   5.135
    4   HG12  ILE  13          HG12      ILE  13 -13.458  -3.648   2.585
    5   HG13  ILE  13          HG13      ILE  13 -14.875  -4.140   3.487
    6   HG21  ILE  13          HG21      ILE  13 -13.963  -1.227   5.383
    7   HG23  ILE  13          HG22      ILE  13 -13.812  -2.430   6.657
    8   HG22  ILE  13          HG23      ILE  13 -15.205  -2.461   5.579
    9   HD13  ILE  13          HD11      ILE  13 -15.842  -2.033   3.400
   10   HD12  ILE  13          HD12      ILE  13 -14.949  -2.046   1.892
   11   HD11  ILE  13          HD13      ILE  13 -14.276  -1.225   3.283

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ASN  14           H        ASN  14 -10.927  -4.159   6.035
    2    HA   ASN  14           HA       ASN  14 -10.770  -2.508   8.315
    3    HB2  ASN  14           HB2      ASN  14 -10.453  -5.110   8.003
    4    HB3  ASN  14           HB3      ASN  14  -8.753  -4.682   7.847
    5   HD21  ASN  14          HD21      ASN  14  -9.356  -6.213  10.028
    6   HD22  ASN  14          HD22      ASN  14  -9.353  -5.288  11.449

  No H/Q in entry =           6
  In of MODEL   75
    1    H    SER  15           H        SER  15  -8.344  -3.281   5.830
    2    HA   SER  15           HA       SER  15  -6.240  -1.732   6.901
    3    HB2  SER  15           HB2      SER  15  -5.211  -1.929   4.744
    4    HB3  SER  15           HB3      SER  15  -6.129  -3.413   4.974
    5    HG   SER  15           HG       SER  15  -7.385  -2.863   3.388

  No H/Q in entry =           5
  In of MODEL   75
    1    H    GLY  16           H        GLY  16  -8.858  -0.939   4.646
    2    HA3  GLY  16           HA2      GLY  16  -8.066   1.721   4.086
    3    HA2  GLY  16           HA3      GLY  16  -9.701   1.084   3.924

  No H/Q in entry =           3
  In of MODEL   75
    1    H    GLN  17           H        GLN  17 -10.230   0.355   6.575
    2    HA   GLN  17           HA       GLN  17 -11.003   2.845   7.705
    3    HB2  GLN  17           HB2      GLN  17 -12.172   0.715   8.190
    4    HB3  GLN  17           HB3      GLN  17 -10.756   0.157   9.081
    5    HG2  GLN  17           HG2      GLN  17 -10.973   2.093  10.614
    6    HG3  GLN  17           HG3      GLN  17 -12.414   2.609   9.739
    7   HE21  GLN  17          HE21      GLN  17 -14.099   2.165  11.199
    8   HE22  GLN  17          HE22      GLN  17 -14.356   0.650  11.921

  No H/Q in entry =           8
  In of MODEL   75
    1    H    ALA  18           H        ALA  18  -8.317   0.634   8.338
    2    HA   ALA  18           HA       ALA  18  -7.255   1.886  10.606
    3    HB2  ALA  18           HB1      ALA  18  -6.586  -0.318   9.247
    4    HB3  ALA  18           HB2      ALA  18  -5.446   0.498  10.317
    5    HB1  ALA  18           HB3      ALA  18  -5.373   0.772   8.576

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ARG  19           H        ARG  19  -6.492   2.417   7.156
    2    HA   ARG  19           HA       ARG  19  -4.648   4.514   7.581
    3    HB2  ARG  19           HB2      ARG  19  -4.941   3.357   5.389
    4    HB3  ARG  19           HB3      ARG  19  -6.505   4.157   5.206
    5    HG2  ARG  19           HG2      ARG  19  -5.434   6.357   5.268
    6    HG3  ARG  19           HG3      ARG  19  -3.865   5.614   5.578
    7    HD2  ARG  19           HD2      ARG  19  -4.001   6.192   3.232
    8    HD3  ARG  19           HD3      ARG  19  -4.040   4.431   3.385
    9    HE   ARG  19           HE       ARG  19  -6.697   5.271   3.369
   10   HH21  ARG  19          HH11      ARG  19  -7.892   5.388   1.448
   11   HH22  ARG  19          HH12      ARG  19  -7.070   5.482  -0.070
   12   HH11  ARG  19          HH21      ARG  19  -3.920   5.399   1.340
   13   HH12  ARG  19          HH22      ARG  19  -4.820   5.485  -0.132

  No H/Q in entry =          13
  In of MODEL   75
    1    H    SER  20           H        SER  20  -8.147   4.535   6.974
    2    HA   SER  20           HA       SER  20  -8.577   7.280   6.914
    3    HB2  SER  20           HB2      SER  20 -10.415   5.885   6.379
    4    HB3  SER  20           HB3      SER  20 -10.289   5.005   7.901
    5    HG   SER  20           HG       SER  20 -10.959   7.750   7.587

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LEU  21           H        LEU  21  -8.524   5.109   9.727
    2    HA   LEU  21           HA       LEU  21  -9.022   7.100  11.683
    3    HB2  LEU  21           HB2      LEU  21  -7.595   4.438  11.859
    4    HB3  LEU  21           HB3      LEU  21  -7.941   5.450  13.256
    5    HG   LEU  21           HG       LEU  21 -10.074   4.484  11.330
    6   HD11  LEU  21          HD11      LEU  21  -8.908   2.606  12.513
    7   HD13  LEU  21          HD12      LEU  21 -10.608   2.761  12.956
    8   HD12  LEU  21          HD13      LEU  21  -9.354   3.351  14.049
    9   HD23  LEU  21          HD21      LEU  21 -11.438   4.950  13.548
   10   HD22  LEU  21          HD22      LEU  21 -11.022   6.304  12.502
   11   HD21  LEU  21          HD23      LEU  21 -10.076   5.992  13.949

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ALA  22           H        ALA  22  -6.031   5.801  10.287
    2    HA   ALA  22           HA       ALA  22  -4.191   7.171  11.907
    3    HB2  ALA  22           HB1      ALA  22  -3.721   5.323  10.224
    4    HB1  ALA  22           HB2      ALA  22  -2.561   6.651  10.256
    5    HB3  ALA  22           HB3      ALA  22  -3.774   6.569   8.978

  No H/Q in entry =           5
  In of MODEL   75
    1    H    TYR  23           H        TYR  23  -5.528   8.140   8.718
    2    HA   TYR  23           HA       TYR  23  -4.260  10.671   8.641
    3    HB2  TYR  23           HB2      TYR  23  -5.311   9.724   6.650
    4    HB3  TYR  23           HB3      TYR  23  -6.893   9.788   7.427
    5    HD1  TYR  23           HD1      TYR  23  -4.040  11.923   6.312
    6    HD2  TYR  23           HD2      TYR  23  -8.199  11.749   7.364
    7    HE1  TYR  23           HE1      TYR  23  -4.331  14.263   5.544
    8    HE2  TYR  23           HE2      TYR  23  -8.492  14.089   6.595
    9    HH   TYR  23           HH       TYR  23  -5.750  15.937   5.256

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ALA  24           H        ALA  24  -7.355   9.614  10.017
    2    HA   ALA  24           HA       ALA  24  -8.263  12.183  10.776
    3    HB1  ALA  24           HB1      ALA  24 -10.048  10.885  11.245
    4    HB2  ALA  24           HB2      ALA  24  -9.210  10.342  12.697
    5    HB3  ALA  24           HB3      ALA  24  -9.057   9.428  11.197

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ALA  25           H        ALA  25  -6.199   9.787  12.364
    2    HA   ALA  25           HA       ALA  25  -5.901  11.058  14.862
    3    HB2  ALA  25           HB1      ALA  25  -5.068   8.724  14.052
    4    HB3  ALA  25           HB2      ALA  25  -4.079   9.614  15.212
    5    HB1  ALA  25           HB3      ALA  25  -3.639   9.603  13.504

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LEU  26           H        LEU  26  -4.112  11.393  11.825
    2    HA   LEU  26           HA       LEU  26  -2.205  13.269  12.738
    3    HB2  LEU  26           HB2      LEU  26  -1.868  12.118  10.639
    4    HB3  LEU  26           HB3      LEU  26  -3.359  12.783   9.978
    5    HG   LEU  26           HG       LEU  26  -2.406  15.061  10.107
    6   HD12  LEU  26          HD11      LEU  26   0.130  15.151  10.526
    7   HD11  LEU  26          HD12      LEU  26  -0.052  13.568  11.277
    8   HD13  LEU  26          HD13      LEU  26  -0.899  14.963  11.946
    9   HD21  LEU  26          HD21      LEU  26  -0.605  13.049   8.724
   10   HD23  LEU  26          HD22      LEU  26  -0.693  14.767   8.347
   11   HD22  LEU  26          HD23      LEU  26  -2.088  13.730   8.059

  No H/Q in entry =          11
  In of MODEL   75
    1    H    LYS  27           H        LYS  27  -5.396  13.660  11.252
    2    HA   LYS  27           HA       LYS  27  -5.416  16.449  11.043
    3    HB2  LYS  27           HB2      LYS  27  -7.117  14.921  10.059
    4    HB3  LYS  27           HB3      LYS  27  -7.770  14.653  11.675
    5    HG2  LYS  27           HG2      LYS  27  -8.265  17.048  11.900
    6    HG3  LYS  27           HG3      LYS  27  -7.561  17.358  10.310
    7    HD2  LYS  27           HD2      LYS  27  -9.252  15.873   9.275
    8    HD3  LYS  27           HD3      LYS  27  -9.962  15.581  10.865
    9    HE2  LYS  27           HE2      LYS  27 -10.470  17.980  11.098
   10    HE3  LYS  27           HE3      LYS  27  -9.732  18.295   9.523
   11    HZ3  LYS  27           HZ1      LYS  27 -12.105  18.106   9.277
   12    HZ2  LYS  27           HZ2      LYS  27 -12.114  16.592  10.052
   13    HZ1  LYS  27           HZ3      LYS  27 -11.371  16.769   8.532

  No H/Q in entry =          13
  In of MODEL   75
    1    H    GLN  28           H        GLN  28  -6.254  14.350  13.776
    2    HA   GLN  28           HA       GLN  28  -7.206  16.336  15.542
    3    HB2  GLN  28           HB2      GLN  28  -5.736  13.747  16.099
    4    HB3  GLN  28           HB3      GLN  28  -6.508  14.735  17.340
    5    HG2  GLN  28           HG2      GLN  28  -7.932  13.571  14.930
    6    HG3  GLN  28           HG3      GLN  28  -7.972  12.877  16.551
    7   HE21  GLN  28          HE21      GLN  28  -9.878  14.649  14.578
    8   HE22  GLN  28          HE22      GLN  28 -10.662  15.636  15.715

  No H/Q in entry =           8
  In of MODEL   75
    1    H    ALA  29           H        ALA  29  -3.953  15.122  14.865
    2    HA   ALA  29           HA       ALA  29  -2.556  16.564  16.840
    3    HB1  ALA  29           HB1      ALA  29  -0.606  15.918  15.728
    4    HB3  ALA  29           HB2      ALA  29  -1.360  16.017  14.137
    5    HB2  ALA  29           HB3      ALA  29  -1.750  14.678  15.216

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LYS  30           H        LYS  30  -3.429  17.408  13.506
    2    HA   LYS  30           HA       LYS  30  -2.079  19.882  13.399
    3    HB2  LYS  30           HB2      LYS  30  -4.585  18.941  11.988
    4    HB3  LYS  30           HB3      LYS  30  -3.787  20.474  11.640
    5    HG2  LYS  30           HG2      LYS  30  -1.686  19.230  11.136
    6    HG3  LYS  30           HG3      LYS  30  -2.556  17.713  11.385
    7    HD2  LYS  30           HD2      LYS  30  -4.132  18.309   9.585
    8    HD3  LYS  30           HD3      LYS  30  -3.284  19.837   9.338
    9    HE2  LYS  30           HE2      LYS  30  -1.221  18.591   8.767
   10    HE3  LYS  30           HE3      LYS  30  -2.087  17.068   8.983
   11    HZ2  LYS  30           HZ1      LYS  30  -1.927  17.934   6.638
   12    HZ1  LYS  30           HZ2      LYS  30  -3.001  19.173   7.099
   13    HZ3  LYS  30           HZ3      LYS  30  -3.487  17.545   7.176

  No H/Q in entry =          13
  In of MODEL   75
    1    H    GLN  31           H        GLN  31  -5.161  18.963  14.809
    2    HA   GLN  31           HA       GLN  31  -5.989  21.702  15.249
    3    HB2  GLN  31           HB2      GLN  31  -7.114  19.234  16.579
    4    HB3  GLN  31           HB3      GLN  31  -7.909  20.787  16.326
    5    HG2  GLN  31           HG2      GLN  31  -7.176  20.017  13.740
    6    HG3  GLN  31           HG3      GLN  31  -7.668  18.504  14.492
    7   HE21  GLN  31          HE21      GLN  31  -9.110  20.037  12.382
    8   HE22  GLN  31          HE22      GLN  31 -10.633  20.397  13.036

  No H/Q in entry =           8
  In of MODEL   75
    1    H    GLY  32           H        GLY  32  -3.636  19.833  16.580
    2    HA3  GLY  32           HA2      GLY  32  -2.249  20.333  18.383
    3    HA2  GLY  32           HA3      GLY  32  -3.407  21.552  18.900

  No H/Q in entry =           3
  In of MODEL   75
    1    H    ASP  33           H        ASP  33  -4.759  18.479  18.247
    2    HA   ASP  33           HA       ASP  33  -5.165  18.022  21.128
    3    HB2  ASP  33           HB2      ASP  33  -6.543  16.971  18.651
    4    HB3  ASP  33           HB3      ASP  33  -6.878  16.358  20.269

  No H/Q in entry =           4
  In of MODEL   75
    1    H    PHE  34           H        PHE  34  -2.978  17.221  21.439
    2    HA   PHE  34           HA       PHE  34  -1.925  14.990  20.048
    3    HB2  PHE  34           HB2      PHE  34  -1.335  15.998  22.840
    4    HB3  PHE  34           HB3      PHE  34  -0.378  14.793  21.978
    5    HD1  PHE  34           HD1      PHE  34  -0.628  18.216  22.701
    6    HD2  PHE  34           HD2      PHE  34   0.268  15.521  19.477
    7    HE1  PHE  34           HE1      PHE  34   0.630  20.012  21.543
    8    HE2  PHE  34           HE2      PHE  34   1.520  17.320  18.324
    9    HZ   PHE  34           HZ       PHE  34   1.703  19.563  19.362

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ALA  35           H        ALA  35  -3.976  15.231  22.907
    2    HA   ALA  35           HA       ALA  35  -3.706  12.578  23.812
    3    HB3  ALA  35           HB1      ALA  35  -6.178  13.152  24.664
    4    HB1  ALA  35           HB2      ALA  35  -5.680  14.780  24.203
    5    HB2  ALA  35           HB3      ALA  35  -4.748  13.880  25.399

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ALA  36           H        ALA  36  -6.185  14.032  21.704
    2    HA   ALA  36           HA       ALA  36  -7.546  11.588  21.232
    3    HB1  ALA  36           HB1      ALA  36  -9.031  12.975  20.269
    4    HB3  ALA  36           HB2      ALA  36  -7.866  13.417  19.020
    5    HB2  ALA  36           HB3      ALA  36  -7.913  14.309  20.541

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ALA  37           H        ALA  37  -4.899  13.230  19.562
    2    HA   ALA  37           HA       ALA  37  -4.824  11.588  17.271
    3    HB3  ALA  37           HB1      ALA  37  -2.872  13.348  18.691
    4    HB2  ALA  37           HB2      ALA  37  -3.401  13.387  17.010
    5    HB1  ALA  37           HB3      ALA  37  -2.221  12.184  17.537

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LYS  38           H        LYS  38  -3.065  11.331  20.352
    2    HA   LYS  38           HA       LYS  38  -1.686   8.960  19.873
    3    HB2  LYS  38           HB2      LYS  38  -2.051  10.722  22.012
    4    HB3  LYS  38           HB3      LYS  38  -2.637   9.181  22.633
    5    HG2  LYS  38           HG2      LYS  38  -0.517   8.105  22.103
    6    HG3  LYS  38           HG3      LYS  38   0.060   9.561  21.286
    7    HD2  LYS  38           HD2      LYS  38   0.199  10.790  23.317
    8    HD3  LYS  38           HD3      LYS  38  -0.796   9.620  24.186
    9    HE2  LYS  38           HE2      LYS  38   1.565   9.359  24.810
   10    HE3  LYS  38           HE3      LYS  38   0.994   7.926  23.950
   11    HZ3  LYS  38           HZ1      LYS  38   2.287   8.368  22.169
   12    HZ2  LYS  38           HZ2      LYS  38   3.222   9.221  23.305
   13    HZ1  LYS  38           HZ3      LYS  38   2.125  10.054  22.309

  No H/Q in entry =          13
  In of MODEL   75
    1    H    ALA  39           H        ALA  39  -4.937   9.387  21.269
    2    HA   ALA  39           HA       ALA  39  -5.437   6.657  21.782
    3    HB3  ALA  39           HB1      ALA  39  -7.637   8.550  21.005
    4    HB2  ALA  39           HB2      ALA  39  -6.747   8.802  22.507
    5    HB1  ALA  39           HB3      ALA  39  -7.630   7.297  22.247

  No H/Q in entry =           5
  In of MODEL   75
    1    H    MET  40           H        MET  40  -6.062   8.648  18.927
    2    HA   MET  40           HA       MET  40  -7.492   6.678  17.471
    3    HB2  MET  40           HB2      MET  40  -5.935   9.106  16.561
    4    HB3  MET  40           HB3      MET  40  -6.938   8.121  15.492
    5    HG2  MET  40           HG2      MET  40  -8.004   9.354  18.045
    6    HG3  MET  40           HG3      MET  40  -8.078  10.183  16.492
    7    HE3  MET  40           HE1      MET  40 -10.621   8.499  14.429
    8    HE2  MET  40           HE2      MET  40  -8.871   8.655  14.283
    9    HE1  MET  40           HE3      MET  40  -9.820  10.001  14.911

  No H/Q in entry =           9
  In of MODEL   75
    1    H    MET  41           H        MET  41  -4.019   7.495  17.597
    2    HA   MET  41           HA       MET  41  -3.217   5.751  15.503
    3    HB2  MET  41           HB2      MET  41  -1.621   6.462  17.977
    4    HB3  MET  41           HB3      MET  41  -0.986   5.824  16.464
    5    HG2  MET  41           HG2      MET  41  -2.190   7.976  15.451
    6    HG3  MET  41           HG3      MET  41  -1.970   8.574  17.094
    7    HE2  MET  41           HE1      MET  41   0.994   6.545  17.467
    8    HE1  MET  41           HE2      MET  41   0.175   7.823  18.360
    9    HE3  MET  41           HE3      MET  41   1.793   8.101  17.719

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ASP  42           H        ASP  42  -3.597   5.280  18.990
    2    HA   ASP  42           HA       ASP  42  -2.502   2.711  19.160
    3    HB2  ASP  42           HB2      ASP  42  -3.419   4.456  20.976
    4    HB3  ASP  42           HB3      ASP  42  -4.822   3.398  20.904

  No H/Q in entry =           4
  In of MODEL   75
    1    H    GLN  43           H        GLN  43  -5.860   3.737  18.651
    2    HA   GLN  43           HA       GLN  43  -6.943   1.123  18.462
    3    HB2  GLN  43           HB2      GLN  43  -7.925   3.749  17.323
    4    HB3  GLN  43           HB3      GLN  43  -8.853   2.248  17.304
    5    HG2  GLN  43           HG2      GLN  43  -8.562   2.142  19.813
    6    HG3  GLN  43           HG3      GLN  43  -7.874   3.763  19.737
    7   HE21  GLN  43          HE21      GLN  43 -10.058   3.797  21.234
    8   HE22  GLN  43          HE22      GLN  43 -11.430   4.338  20.398

  No H/Q in entry =           8
  In of MODEL   75
    1    H    SER  44           H        SER  44  -5.650   3.360  16.046
    2    HA   SER  44           HA       SER  44  -6.312   1.852  13.760
    3    HB2  SER  44           HB2      SER  44  -5.112   4.266  14.199
    4    HB3  SER  44           HB3      SER  44  -3.734   3.300  13.674
    5    HG   SER  44           HG       SER  44  -4.866   4.240  11.906

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ARG  45           H        ARG  45  -3.436   1.813  15.846
    2    HA   ARG  45           HA       ARG  45  -1.909  -0.111  14.473
    3    HB2  ARG  45           HB2      ARG  45  -1.104   1.335  16.338
    4    HB3  ARG  45           HB3      ARG  45  -2.076   0.385  17.460
    5    HG2  ARG  45           HG2      ARG  45  -0.795  -1.647  16.826
    6    HG3  ARG  45           HG3      ARG  45   0.200  -0.671  15.746
    7    HD2  ARG  45           HD2      ARG  45   0.899   0.732  17.699
    8    HD3  ARG  45           HD3      ARG  45  -0.001  -0.361  18.774
    9    HE   ARG  45           HE       ARG  45   1.738  -1.922  17.202
   10   HH21  ARG  45          HH11      ARG  45   3.655  -2.698  18.045
   11   HH22  ARG  45          HH12      ARG  45   4.407  -1.890  19.375
   12   HH11  ARG  45          HH21      ARG  45   1.979   0.559  19.585
   13   HH12  ARG  45          HH22      ARG  45   3.458  -0.044  20.245

  No H/Q in entry =          13
  In of MODEL   75
    1    H    MET  46           H        MET  46  -4.303  -0.479  17.069
    2    HA   MET  46           HA       MET  46  -4.072  -3.273  17.385
    3    HB2  MET  46           HB2      MET  46  -6.284  -1.312  17.978
    4    HB3  MET  46           HB3      MET  46  -6.460  -3.035  18.316
    5    HG2  MET  46           HG2      MET  46  -4.465  -2.990  19.734
    6    HG3  MET  46           HG3      MET  46  -4.204  -1.295  19.355
    7    HE3  MET  46           HE1      MET  46  -7.821  -3.153  20.393
    8    HE2  MET  46           HE2      MET  46  -7.231  -3.305  22.043
    9    HE1  MET  46           HE3      MET  46  -6.289  -3.976  20.715

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ALA  47           H        ALA  47  -6.133  -1.309  15.280
    2    HA   ALA  47           HA       ALA  47  -7.702  -3.399  14.217
    3    HB3  ALA  47           HB1      ALA  47  -8.431  -1.178  13.794
    4    HB1  ALA  47           HB2      ALA  47  -7.925  -1.805  12.225
    5    HB2  ALA  47           HB3      ALA  47  -6.871  -0.710  13.121

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LEU  48           H        LEU  48  -4.611  -2.023  13.169
    2    HA   LEU  48           HA       LEU  48  -4.290  -3.614  10.833
    3    HB2  LEU  48           HB2      LEU  48  -2.266  -2.285  12.642
    4    HB3  LEU  48           HB3      LEU  48  -1.878  -3.002  11.078
    5    HG   LEU  48           HG       LEU  48  -3.950  -0.828  11.456
    6   HD13  LEU  48          HD11      LEU  48  -1.850   0.096  12.124
    7   HD12  LEU  48          HD12      LEU  48  -2.133   0.639  10.470
    8   HD11  LEU  48          HD13      LEU  48  -1.007  -0.682  10.784
    9   HD22  LEU  48          HD21      LEU  48  -4.395  -1.829   9.383
   10   HD21  LEU  48          HD22      LEU  48  -2.703  -2.228   9.092
   11   HD23  LEU  48          HD23      LEU  48  -3.258  -0.561   8.927

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ASN  49           H        ASN  49  -3.243  -3.978  14.182
    2    HA   ASN  49           HA       ASN  49  -1.591  -6.207  13.862
    3    HB2  ASN  49           HB2      ASN  49  -1.636  -4.881  15.906
    4    HB3  ASN  49           HB3      ASN  49  -3.295  -5.366  16.224
    5   HD21  ASN  49          HD21      ASN  49  -0.016  -6.756  15.823
    6   HD22  ASN  49          HD22      ASN  49  -0.275  -8.058  16.879

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLU  50           H        GLU  50  -5.067  -6.004  14.525
    2    HA   GLU  50           HA       GLU  50  -5.520  -8.814  14.641
    3    HB2  GLU  50           HB2      GLU  50  -7.143  -7.158  15.509
    4    HB3  GLU  50           HB3      GLU  50  -7.444  -6.604  13.860
    5    HG2  GLU  50           HG2      GLU  50  -8.262  -8.820  13.226
    6    HG3  GLU  50           HG3      GLU  50  -7.870  -9.451  14.822

  No H/Q in entry =           6
  In of MODEL   75
    1    H    ALA  51           H        ALA  51  -5.632  -6.425  12.038
    2    HA   ALA  51           HA       ALA  51  -6.577  -8.178  10.018
    3    HB2  ALA  51           HB1      ALA  51  -6.392  -6.365   8.645
    4    HB1  ALA  51           HB2      ALA  51  -4.761  -5.981   9.196
    5    HB3  ALA  51           HB3      ALA  51  -6.157  -5.496  10.160

  No H/Q in entry =           5
  In of MODEL   75
    1    H    HIS  52           H        HIS  52  -3.308  -7.201  11.007
    2    HA   HIS  52           HA       HIS  52  -1.874  -8.666   9.065
    3    HB2  HIS  52           HB2      HIS  52  -0.866  -6.913  10.485
    4    HB3  HIS  52           HB3      HIS  52  -1.041  -7.964  11.891
    5    HD1  HIS  52           HD1      HIS  52   0.318 -10.286  11.777
    6    HD2  HIS  52           HD2      HIS  52   1.407  -7.418   8.954
    7    HE1  HIS  52           HE1      HIS  52   2.571 -10.998  10.864
    8    HE2  HIS  52           HE2      HIS  52   3.249  -9.260   9.141

  No H/Q in entry =           8
  In of MODEL   75
    1    H    LEU  53           H        LEU  53  -3.075  -9.559  12.277
    2    HA   LEU  53           HA       LEU  53  -1.827 -12.079  12.480
    3    HB2  LEU  53           HB2      LEU  53  -4.352 -10.962  13.679
    4    HB3  LEU  53           HB3      LEU  53  -3.826 -12.613  13.994
    5    HG   LEU  53           HG       LEU  53  -2.026 -10.211  14.443
    6   HD12  LEU  53          HD11      LEU  53  -2.609 -10.693  16.908
    7   HD11  LEU  53          HD12      LEU  53  -4.004 -11.567  16.276
    8   HD13  LEU  53          HD13      LEU  53  -3.821  -9.847  15.951
    9   HD22  LEU  53          HD21      LEU  53  -0.663 -12.137  14.435
   10   HD21  LEU  53          HD22      LEU  53  -1.923 -13.144  15.140
   11   HD23  LEU  53          HD23      LEU  53  -1.064 -11.989  16.143

  No H/Q in entry =          11
  In of MODEL   75
    1    H    VAL  54           H        VAL  54  -4.955 -11.115  11.108
    2    HA   VAL  54           HA       VAL  54  -5.816 -13.728  10.426
    3    HB   VAL  54           HB       VAL  54  -6.514 -11.012   9.283
    4   HG12  VAL  54          HG11      VAL  54  -8.587 -12.433   8.470
    5   HG11  VAL  54          HG12      VAL  54  -7.449 -13.776   8.548
    6   HG13  VAL  54          HG13      VAL  54  -7.113 -12.397   7.503
    7   HG22  VAL  54          HG21      VAL  54  -7.425 -11.061  11.432
    8   HG21  VAL  54          HG22      VAL  54  -7.645 -12.809  11.417
    9   HG23  VAL  54          HG23      VAL  54  -8.744 -11.776  10.505

  No H/Q in entry =           9
  In of MODEL   75
    1    H    GLN  55           H        GLN  55  -3.989 -11.246   8.635
    2    HA   GLN  55           HA       GLN  55  -3.824 -12.714   6.221
    3    HB2  GLN  55           HB2      GLN  55  -3.264 -10.439   6.027
    4    HB3  GLN  55           HB3      GLN  55  -2.155 -10.490   7.395
    5    HG2  GLN  55           HG2      GLN  55  -0.419 -11.306   6.125
    6    HG3  GLN  55           HG3      GLN  55  -1.471 -12.304   5.131
    7   HE21  GLN  55          HE21      GLN  55  -1.496 -11.620   3.007
    8   HE22  GLN  55          HE22      GLN  55  -1.328 -10.014   2.493

  No H/Q in entry =           8
  In of MODEL   75
    1    H    THR  56           H        THR  56  -1.726 -12.645   9.107
    2    HA   THR  56           HA       THR  56   0.385 -14.206   8.199
    3    HB   THR  56           HB       THR  56  -0.921 -14.241  10.934
    4    HG1  THR  56           HG1      THR  56   1.390 -12.895  10.005
    5   HG21  THR  56          HG21      THR  56   1.780 -15.241   9.991
    6   HG23  THR  56          HG22      THR  56   0.466 -16.220  10.643
    7   HG22  THR  56          HG23      THR  56   1.313 -15.073  11.683

  No H/Q in entry =           7
  In of MODEL   75
    1    H    LYS  57           H        LYS  57  -2.718 -15.297   9.558
    2    HA   LYS  57           HA       LYS  57  -2.219 -18.085   9.321
    3    HB2  LYS  57           HB2      LYS  57  -4.061 -17.031  10.661
    4    HB3  LYS  57           HB3      LYS  57  -4.856 -16.591   9.157
    5    HG2  LYS  57           HG2      LYS  57  -5.042 -18.963   8.540
    6    HG3  LYS  57           HG3      LYS  57  -4.222 -19.424  10.029
    7    HD2  LYS  57           HD2      LYS  57  -6.050 -18.420  11.353
    8    HD3  LYS  57           HD3      LYS  57  -6.876 -17.956   9.866
    9    HE2  LYS  57           HE2      LYS  57  -7.041 -20.339   9.212
   10    HE3  LYS  57           HE3      LYS  57  -6.219 -20.814  10.697
   11    HZ2  LYS  57           HZ1      LYS  57  -8.907 -19.662  10.354
   12    HZ1  LYS  57           HZ2      LYS  57  -8.081 -19.474  11.827
   13    HZ3  LYS  57           HZ3      LYS  57  -8.429 -21.030  11.239

  No H/Q in entry =          13
  In of MODEL   75
    1    H    LEU  58           H        LEU  58  -3.591 -15.674   7.135
    2    HA   LEU  58           HA       LEU  58  -4.354 -17.519   5.132
    3    HB2  LEU  58           HB2      LEU  58  -3.803 -14.560   4.990
    4    HB3  LEU  58           HB3      LEU  58  -4.445 -15.513   3.651
    5    HG   LEU  58           HG       LEU  58  -5.735 -15.350   6.395
    6   HD11  LEU  58          HD11      LEU  58  -6.060 -13.716   3.898
    7   HD13  LEU  58          HD12      LEU  58  -6.063 -13.204   5.585
    8   HD12  LEU  58          HD13      LEU  58  -7.469 -14.025   4.912
    9   HD22  LEU  58          HD21      LEU  58  -6.659 -17.279   5.528
   10   HD21  LEU  58          HD22      LEU  58  -6.324 -16.826   3.857
   11   HD23  LEU  58          HD23      LEU  58  -7.703 -16.123   4.702

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  59           H        ILE  59  -1.244 -16.248   5.997
    2    HA   ILE  59           HA       ILE  59  -0.126 -16.962   3.365
    3    HB   ILE  59           HB       ILE  59   0.600 -14.877   4.925
    4   HG12  ILE  59          HG12      ILE  59   2.735 -16.496   3.523
    5   HG13  ILE  59          HG13      ILE  59   1.524 -15.596   2.647
    6   HG22  ILE  59          HG21      ILE  59   2.719 -16.882   5.650
    7   HG21  ILE  59          HG22      ILE  59   1.351 -16.629   6.710
    8   HG23  ILE  59          HG23      ILE  59   2.443 -15.297   6.334
    9   HD11  ILE  59          HD11      ILE  59   2.206 -13.527   3.835
   10   HD13  ILE  59          HD12      ILE  59   3.527 -14.223   2.899
   11   HD12  ILE  59          HD13      ILE  59   3.470 -14.445   4.649

  No H/Q in entry =          11
  In of MODEL   75
    1    H    GLU  60           H        GLU  60  -0.125 -18.059   6.736
    2    HA   GLU  60           HA       GLU  60   1.943 -19.999   6.483
    3    HB2  GLU  60           HB2      GLU  60   1.126 -19.199   8.664
    4    HB3  GLU  60           HB3      GLU  60  -0.436 -19.954   8.359
    5    HG2  GLU  60           HG2      GLU  60   0.653 -22.169   8.243
    6    HG3  GLU  60           HG3      GLU  60   2.217 -21.414   8.545

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLY  61           H        GLY  61  -1.564 -20.164   5.988
    2    HA3  GLY  61           HA2      GLY  61  -1.261 -22.954   5.038
    3    HA2  GLY  61           HA3      GLY  61  -2.762 -22.244   5.626

  No H/Q in entry =           3
  In of MODEL   75
    1    H    ASP  62           H        ASP  62  -0.554 -20.632   3.423
    2    HA   ASP  62           HA       ASP  62  -2.545 -19.893   1.598
    3    HB2  ASP  62           HB2      ASP  62  -0.618 -19.315   0.121
    4    HB3  ASP  62           HB3      ASP  62  -0.458 -18.685   1.757

  No H/Q in entry =           4
  In of MODEL   75
    1    H    ALA  63           H        ALA  63  -1.283 -22.990   2.046
    2    HA   ALA  63           HA       ALA  63  -1.305 -23.856  -0.726
    3    HB2  ALA  63           HB1      ALA  63  -1.258 -26.158   0.403
    4    HB1  ALA  63           HB2      ALA  63  -1.068 -25.267   1.912
    5    HB3  ALA  63           HB3      ALA  63   0.139 -25.104   0.636

  No H/Q in entry =           5
  In of MODEL   75
    1    H    GLY  64           H        GLY  64  -2.772 -25.751  -1.294
    2    HA3  GLY  64           HA2      GLY  64  -4.986 -26.790  -0.604
    3    HA2  GLY  64           HA3      GLY  64  -5.524 -25.129  -0.417

  No H/Q in entry =           3
  In of MODEL   75
    1    H    GLU  65           H        GLU  65  -4.850 -23.800  -2.590
    2    HA   GLU  65           HA       GLU  65  -6.559 -24.835  -4.584
    3    HB2  GLU  65           HB2      GLU  65  -4.567 -22.571  -4.656
    4    HB3  GLU  65           HB3      GLU  65  -5.682 -22.937  -5.972
    5    HG2  GLU  65           HG2      GLU  65  -7.596 -22.625  -4.499
    6    HG3  GLU  65           HG3      GLU  65  -6.530 -22.385  -3.116

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLY  66           H        GLY  66  -3.099 -24.814  -4.254
    2    HA3  GLY  66           HA2      GLY  66  -2.728 -27.025  -6.017
    3    HA2  GLY  66           HA3      GLY  66  -2.162 -25.527  -6.730

  No H/Q in entry =           3
  In of MODEL   75
    1    H    LYS  67           H        LYS  67  -0.507 -27.685  -6.283
    2    HA   LYS  67           HA       LYS  67   0.898 -28.157  -4.099
    3    HB2  LYS  67           HB2      LYS  67   2.047 -27.520  -6.813
    4    HB3  LYS  67           HB3      LYS  67   2.959 -28.293  -5.508
    5    HG2  LYS  67           HG2      LYS  67   1.237 -30.075  -5.379
    6    HG3  LYS  67           HG3      LYS  67   0.374 -29.323  -6.718
    7    HD2  LYS  67           HD2      LYS  67   3.252 -30.230  -6.931
    8    HD3  LYS  67           HD3      LYS  67   1.886 -31.265  -7.353
    9    HE2  LYS  67           HE2      LYS  67   1.095 -29.359  -8.867
   10    HE3  LYS  67           HE3      LYS  67   2.686 -28.641  -8.622
   11    HZ1  LYS  67           HZ1      LYS  67   3.077 -31.320  -9.243
   12    HZ3  LYS  67           HZ2      LYS  67   3.458 -29.965 -10.194
   13    HZ2  LYS  67           HZ3      LYS  67   1.948 -30.726 -10.360

  No H/Q in entry =          13
  In of MODEL   75
    1    H    MET  68           H        MET  68   3.102 -26.294  -5.781
    2    HA   MET  68           HA       MET  68   3.986 -24.820  -3.546
    3    HB2  MET  68           HB2      MET  68   4.581 -24.359  -6.471
    4    HB3  MET  68           HB3      MET  68   5.538 -23.786  -5.104
    5    HG2  MET  68           HG2      MET  68   4.987 -26.693  -5.772
    6    HG3  MET  68           HG3      MET  68   6.509 -25.846  -6.059
    7    HE1  MET  68           HE1      MET  68   7.865 -24.791  -4.539
    8    HE3  MET  68           HE2      MET  68   8.120 -25.207  -2.845
    9    HE2  MET  68           HE3      MET  68   6.891 -24.020  -3.280

  No H/Q in entry =           9
  In of MODEL   75
    1    H    LYS  69           H        LYS  69   1.912 -23.887  -6.266
    2    HA   LYS  69           HA       LYS  69   1.988 -21.136  -5.983
    3    HB2  LYS  69           HB2      LYS  69  -0.057 -22.996  -7.085
    4    HB3  LYS  69           HB3      LYS  69  -0.430 -21.276  -6.934
    5    HG2  LYS  69           HG2      LYS  69   1.302 -20.634  -8.371
    6    HG3  LYS  69           HG3      LYS  69   2.182 -22.145  -8.142
    7    HD2  LYS  69           HD2      LYS  69   0.813 -21.714 -10.365
    8    HD3  LYS  69           HD3      LYS  69   0.828 -23.316  -9.623
    9    HE2  LYS  69           HE2      LYS  69  -1.310 -23.014  -8.653
   10    HE3  LYS  69           HE3      LYS  69  -1.260 -21.267  -8.883
   11    HZ2  LYS  69           HZ1      LYS  69  -2.129 -23.302 -10.680
   12    HZ1  LYS  69           HZ2      LYS  69  -0.949 -22.308 -11.391
   13    HZ3  LYS  69           HZ3      LYS  69  -2.369 -21.625 -10.755

  No H/Q in entry =          13
  In of MODEL   75
    1    H    VAL  70           H        VAL  70   0.367 -19.596  -5.252
    2    HA   VAL  70           HA       VAL  70  -1.036 -20.432  -2.777
    3    HB   VAL  70           HB       VAL  70  -0.422 -18.197  -1.833
    4   HG13  VAL  70          HG11      VAL  70   1.607 -18.952  -1.009
    5   HG12  VAL  70          HG12      VAL  70   2.157 -19.512  -2.589
    6   HG11  VAL  70          HG13      VAL  70   0.968 -20.451  -1.686
    7   HG22  VAL  70          HG21      VAL  70   0.018 -16.846  -3.752
    8   HG21  VAL  70          HG22      VAL  70   1.126 -18.037  -4.431
    9   HG23  VAL  70          HG23      VAL  70   1.607 -17.092  -3.024

  No H/Q in entry =           9
  In of MODEL   75
    1    H    SER  71           H        SER  71  -2.690 -18.797  -2.126
    2    HA   SER  71           HA       SER  71  -4.565 -18.311  -4.186
    3    HB2  SER  71           HB2      SER  71  -5.172 -18.530  -1.770
    4    HB3  SER  71           HB3      SER  71  -4.380 -16.989  -1.453
    5    HG   SER  71           HG       SER  71  -6.830 -17.515  -2.517

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LEU  72           H        LEU  72  -4.882 -16.621  -5.494
    2    HA   LEU  72           HA       LEU  72  -2.808 -14.770  -5.977
    3    HB2  LEU  72           HB2      LEU  72  -5.670 -14.875  -6.926
    4    HB3  LEU  72           HB3      LEU  72  -4.490 -13.705  -7.507
    5    HG   LEU  72           HG       LEU  72  -4.042 -16.705  -7.622
    6   HD11  LEU  72          HD11      LEU  72  -6.018 -15.972  -8.982
    7   HD13  LEU  72          HD12      LEU  72  -4.692 -16.593  -9.964
    8   HD12  LEU  72          HD13      LEU  72  -4.960 -14.854  -9.842
    9   HD23  LEU  72          HD21      LEU  72  -2.481 -15.833  -9.532
   10   HD22  LEU  72          HD22      LEU  72  -1.927 -15.660  -7.876
   11   HD21  LEU  72          HD23      LEU  72  -2.619 -14.277  -8.720

  No H/Q in entry =          11
  In of MODEL   75
    1    H    VAL  73           H        VAL  73  -5.911 -14.469  -4.353
    2    HA   VAL  73           HA       VAL  73  -6.011 -11.699  -4.008
    3    HB   VAL  73           HB       VAL  73  -7.745 -12.079  -2.474
    4   HG12  VAL  73          HG11      VAL  73  -7.810 -14.659  -4.024
    5   HG11  VAL  73          HG12      VAL  73  -7.927 -13.111  -4.860
    6   HG13  VAL  73          HG13      VAL  73  -9.137 -13.556  -3.655
    7   HG22  VAL  73          HG21      VAL  73  -6.680 -13.414  -0.807
    8   HG21  VAL  73          HG22      VAL  73  -6.347 -14.710  -1.956
    9   HG23  VAL  73          HG23      VAL  73  -8.001 -14.405  -1.425

  No H/Q in entry =           9
  In of MODEL   75
    1    H    LEU  74           H        LEU  74  -4.029 -14.025  -2.416
    2    HA   LEU  74           HA       LEU  74  -3.644 -12.871   0.105
    3    HB2  LEU  74           HB2      LEU  74  -2.815 -15.072  -0.380
    4    HB3  LEU  74           HB3      LEU  74  -1.780 -14.449  -1.664
    5    HG   LEU  74           HG       LEU  74  -0.484 -13.165   0.000
    6   HD13  LEU  74          HD11      LEU  74  -2.052 -12.676   1.718
    7   HD12  LEU  74          HD12      LEU  74  -0.947 -13.841   2.449
    8   HD11  LEU  74          HD13      LEU  74  -2.528 -14.367   1.872
    9   HD21  LEU  74          HD21      LEU  74  -0.254 -15.737  -0.577
   10   HD23  LEU  74          HD22      LEU  74  -0.666 -15.892   1.117
   11   HD22  LEU  74          HD23      LEU  74   0.757 -14.987   0.656

  No H/Q in entry =          11
  In of MODEL   75
    1    H    VAL  75           H        VAL  75  -1.757 -12.446  -2.851
    2    HA   VAL  75           HA       VAL  75   0.001 -10.485  -1.842
    3    HB   VAL  75           HB       VAL  75  -0.942 -10.984  -4.667
    4   HG13  VAL  75          HG11      VAL  75  -0.106  -8.675  -4.463
    5   HG12  VAL  75          HG12      VAL  75   1.104  -9.660  -5.271
    6   HG11  VAL  75          HG13      VAL  75   1.304  -9.245  -3.577
    7   HG21  VAL  75          HG21      VAL  75   0.327 -12.797  -3.410
    8   HG23  VAL  75          HG22      VAL  75   1.676 -11.667  -3.292
    9   HG22  VAL  75          HG23      VAL  75   1.124 -12.221  -4.875

  No H/Q in entry =           9
  In of MODEL   75
    1    H    GLU  76           H        GLU  76  -3.154 -10.203  -3.505
    2    HA   GLU  76           HA       GLU  76  -3.261  -7.391  -3.612
    3    HB2  GLU  76           HB2      GLU  76  -4.886  -8.895  -4.763
    4    HB3  GLU  76           HB3      GLU  76  -5.550  -9.349  -3.202
    5    HG2  GLU  76           HG2      GLU  76  -6.256  -7.031  -2.796
    6    HG3  GLU  76           HG3      GLU  76  -5.571  -6.521  -4.326

  No H/Q in entry =           6
  In of MODEL   75
    1    H    ALA  77           H        ALA  77  -4.331  -9.635  -1.069
    2    HA   ALA  77           HA       ALA  77  -5.329  -7.648   0.684
    3    HB2  ALA  77           HB1      ALA  77  -5.766 -10.118   0.861
    4    HB3  ALA  77           HB2      ALA  77  -5.302  -9.356   2.381
    5    HB1  ALA  77           HB3      ALA  77  -4.126 -10.309   1.478

  No H/Q in entry =           5
  In of MODEL   75
    1    H    GLN  78           H        GLN  78  -2.151  -9.137   0.327
    2    HA   GLN  78           HA       GLN  78  -0.919  -7.948   2.576
    3    HB2  GLN  78           HB2      GLN  78  -0.023  -9.874   1.219
    4    HB3  GLN  78           HB3      GLN  78   0.402  -8.716  -0.039
    5    HG2  GLN  78           HG2      GLN  78   1.828  -7.501   1.562
    6    HG3  GLN  78           HG3      GLN  78   1.412  -8.665   2.818
    7   HE21  GLN  78          HE21      GLN  78   1.495 -10.440   0.005
    8   HE22  GLN  78          HE22      GLN  78   3.112 -10.956   0.054

  No H/Q in entry =           8
  In of MODEL   75
    1    H    LEU  79           H        LEU  79  -1.302  -6.901  -0.773
    2    HA   LEU  79           HA       LEU  79   0.342  -4.642  -0.762
    3    HB2  LEU  79           HB2      LEU  79  -0.667  -5.473  -2.816
    4    HB3  LEU  79           HB3      LEU  79  -2.278  -5.110  -2.210
    5    HG   LEU  79           HG       LEU  79  -1.779  -2.713  -2.189
    6   HD13  LEU  79          HD11      LEU  79   0.455  -2.426  -1.674
    7   HD12  LEU  79          HD12      LEU  79   0.501  -2.141  -3.414
    8   HD11  LEU  79          HD13      LEU  79   0.984  -3.709  -2.763
    9   HD23  LEU  79          HD21      LEU  79  -1.145  -2.507  -4.741
   10   HD22  LEU  79          HD22      LEU  79  -2.658  -3.283  -4.282
   11   HD21  LEU  79          HD23      LEU  79  -1.266  -4.267  -4.723

  No H/Q in entry =          11
  In of MODEL   75
    1    H    HIS  80           H        HIS  80  -3.122  -4.867   0.060
    2    HA   HIS  80           HA       HIS  80  -3.366  -2.114   0.717
    3    HB2  HIS  80           HB2      HIS  80  -5.023  -4.553   1.039
    4    HB3  HIS  80           HB3      HIS  80  -5.369  -3.217   2.140
    5    HD1  HIS  80           HD1      HIS  80  -7.016  -1.612   1.226
    6    HD2  HIS  80           HD2      HIS  80  -4.786  -3.390  -1.815
    7    HE1  HIS  80           HE1      HIS  80  -7.871  -0.635  -0.956
    8    HE2  HIS  80           HE2      HIS  80  -6.518  -1.713  -2.819

  No H/Q in entry =           8
  In of MODEL   75
    1    H    LEU  81           H        LEU  81  -2.827  -4.995   2.717
    2    HA   LEU  81           HA       LEU  81  -2.842  -3.643   5.198
    3    HB2  LEU  81           HB2      LEU  81  -1.575  -6.238   4.326
    4    HB3  LEU  81           HB3      LEU  81  -1.561  -5.676   5.998
    5    HG   LEU  81           HG       LEU  81  -4.100  -5.978   4.368
    6   HD12  LEU  81          HD11      LEU  81  -4.367  -8.045   5.919
    7   HD11  LEU  81          HD12      LEU  81  -2.617  -7.942   6.107
    8   HD13  LEU  81          HD13      LEU  81  -3.319  -8.189   4.508
    9   HD23  LEU  81          HD21      LEU  81  -4.942  -6.191   6.868
   10   HD22  LEU  81          HD22      LEU  81  -4.645  -4.598   6.175
   11   HD21  LEU  81          HD23      LEU  81  -3.446  -5.334   7.239

  No H/Q in entry =          11
  In of MODEL   75
    1    H    MET  82           H        MET  82  -0.142  -4.502   3.033
    2    HA   MET  82           HA       MET  82   1.922  -3.567   4.717
    3    HB2  MET  82           HB2      MET  82   1.717  -3.919   1.726
    4    HB3  MET  82           HB3      MET  82   3.188  -3.320   2.490
    5    HG2  MET  82           HG2      MET  82   1.826  -5.933   3.218
    6    HG3  MET  82           HG3      MET  82   3.197  -5.801   2.119
    7    HE3  MET  82           HE1      MET  82   6.197  -5.008   4.105
    8    HE2  MET  82           HE2      MET  82   5.250  -3.658   3.483
    9    HE1  MET  82           HE3      MET  82   5.367  -5.148   2.551

  No H/Q in entry =           9
  In of MODEL   75
    1    H    THR  83           H        THR  83   0.075  -1.963   2.155
    2    HA   THR  83           HA       THR  83   1.444   0.509   2.238
    3    HB   THR  83           HB       THR  83  -0.747   1.394   1.247
    4    HG1  THR  83           HG1      THR  83  -2.375   0.068   1.141
    5   HG22  THR  83          HG21      THR  83  -0.443  -0.423  -0.749
    6   HG21  THR  83          HG22      THR  83   1.062  -0.687   0.130
    7   HG23  THR  83          HG23      THR  83   0.673   0.918  -0.489

  No H/Q in entry =           7
  In of MODEL   75
    1    H    SER  84           H        SER  84  -1.546  -0.572   3.838
    2    HA   SER  84           HA       SER  84  -2.086   1.852   5.176
    3    HB2  SER  84           HB2      SER  84  -2.870  -0.998   5.746
    4    HB3  SER  84           HB3      SER  84  -3.388   0.336   6.775
    5    HG   SER  84           HG       SER  84  -3.838   0.008   3.983

  No H/Q in entry =           5
  In of MODEL   75
    1    H    MET  85           H        MET  85  -0.327  -1.047   6.314
    2    HA   MET  85           HA       MET  85   0.174  -0.106   8.917
    3    HB2  MET  85           HB2      MET  85   0.507  -2.445   8.250
    4    HB3  MET  85           HB3      MET  85   1.878  -1.962   7.249
    5    HG2  MET  85           HG2      MET  85   3.053  -1.112   9.234
    6    HG3  MET  85           HG3      MET  85   1.670  -1.531  10.245
    7    HE1  MET  85           HE1      MET  85   4.340  -2.543   7.908
    8    HE3  MET  85           HE2      MET  85   3.325  -3.804   7.211
    9    HE2  MET  85           HE3      MET  85   4.705  -4.245   8.211

  No H/Q in entry =           9
  In of MODEL   75
    1    H    LEU  86           H        LEU  86   2.107   0.176   5.968
    2    HA   LEU  86           HA       LEU  86   4.297   1.527   7.123
    3    HB2  LEU  86           HB2      LEU  86   4.127   0.436   4.816
    4    HB3  LEU  86           HB3      LEU  86   3.295   1.902   4.299
    5    HG   LEU  86           HG       LEU  86   5.300   3.185   5.279
    6   HD11  LEU  86          HD11      LEU  86   6.048   0.588   6.086
    7   HD13  LEU  86          HD12      LEU  86   7.027   2.050   6.181
    8   HD12  LEU  86          HD13      LEU  86   7.156   1.000   4.772
    9   HD23  LEU  86          HD21      LEU  86   6.049   1.429   2.933
   10   HD22  LEU  86          HD22      LEU  86   6.414   3.133   3.192
   11   HD21  LEU  86          HD23      LEU  86   4.770   2.636   2.792

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ALA  87           H        ALA  87   1.366   2.717   5.532
    2    HA   ALA  87           HA       ALA  87   1.914   5.457   5.610
    3    HB1  ALA  87           HB1      ALA  87  -0.367   3.789   5.070
    4    HB3  ALA  87           HB2      ALA  87  -0.083   5.454   4.566
    5    HB2  ALA  87           HB3      ALA  87  -0.873   5.123   6.110

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ARG  88           H        ARG  88   0.256   3.433   8.003
    2    HA   ARG  88           HA       ARG  88  -0.293   5.478   9.844
    3    HB2  ARG  88           HB2      ARG  88  -1.191   3.110   9.915
    4    HB3  ARG  88           HB3      ARG  88   0.357   2.638  10.624
    5    HG2  ARG  88           HG2      ARG  88  -0.157   4.708  12.238
    6    HG3  ARG  88           HG3      ARG  88  -1.817   4.354  11.781
    7    HD2  ARG  88           HD2      ARG  88  -1.894   2.506  13.032
    8    HD3  ARG  88           HD3      ARG  88  -0.295   1.950  12.504
    9    HE   ARG  88           HE       ARG  88  -0.853   3.210  14.955
   10   HH21  ARG  88          HH11      ARG  88   0.687   4.251  16.192
   11   HH22  ARG  88          HH12      ARG  88   2.199   4.702  15.488
   12   HH11  ARG  88          HH21      ARG  88   1.427   3.424  12.380
   13   HH12  ARG  88          HH22      ARG  88   2.627   4.217  13.342

  No H/Q in entry =          13
  In of MODEL   75
    1    H    GLU  89           H        GLU  89   2.541   3.306   9.629
    2    HA   GLU  89           HA       GLU  89   3.785   4.223  11.972
    3    HB2  GLU  89           HB2      GLU  89   4.480   2.212  10.635
    4    HB3  GLU  89           HB3      GLU  89   5.238   3.317   9.486
    5    HG2  GLU  89           HG2      GLU  89   6.706   4.193  11.229
    6    HG3  GLU  89           HG3      GLU  89   5.886   3.226  12.451

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LEU  90           H        LEU  90   4.086   5.377   8.642
    2    HA   LEU  90           HA       LEU  90   5.980   7.412   9.224
    3    HB2  LEU  90           HB2      LEU  90   3.983   7.040   6.996
    4    HB3  LEU  90           HB3      LEU  90   5.191   8.332   7.015
    5    HG   LEU  90           HG       LEU  90   5.916   5.409   7.357
    6   HD12  LEU  90          HD11      LEU  90   6.663   5.649   4.918
    7   HD11  LEU  90          HD12      LEU  90   5.622   7.071   4.864
    8   HD13  LEU  90          HD13      LEU  90   4.930   5.487   5.211
    9   HD22  LEU  90          HD21      LEU  90   7.791   6.593   8.039
   10   HD21  LEU  90          HD22      LEU  90   7.418   7.989   7.027
   11   HD23  LEU  90          HD23      LEU  90   8.104   6.535   6.305

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  91           H        ILE  91   2.442   7.365   9.071
    2    HA   ILE  91           HA       ILE  91   2.049  10.132   9.515
    3    HB   ILE  91           HB       ILE  91   0.300   7.726  10.061
    4   HG12  ILE  91          HG12      ILE  91   0.014   9.998   8.070
    5   HG13  ILE  91          HG13      ILE  91   0.901   8.518   7.703
    6   HG22  ILE  91          HG21      ILE  91  -1.469   9.753  10.117
    7   HG21  ILE  91          HG22      ILE  91  -0.083  10.610  10.789
    8   HG23  ILE  91          HG23      ILE  91  -0.695   9.164  11.589
    9   HD13  ILE  91          HD11      ILE  91  -1.020   7.196   7.748
   10   HD12  ILE  91          HD12      ILE  91  -1.635   8.698   7.062
   11   HD11  ILE  91          HD13      ILE  91  -1.902   8.334   8.767

  No H/Q in entry =          11
  In of MODEL   75
    1    H    THR  92           H        THR  92   2.500   7.404  11.724
    2    HA   THR  92           HA       THR  92   2.028   8.776  14.143
    3    HB   THR  92           HB       THR  92   3.880   6.473  13.487
    4    HG1  THR  92           HG1      THR  92   1.925   5.679  13.386
    5   HG22  THR  92          HG21      THR  92   3.498   6.189  16.121
    6   HG21  THR  92          HG22      THR  92   3.401   7.946  16.043
    7   HG23  THR  92          HG23      THR  92   4.850   7.116  15.474

  No H/Q in entry =           7
  In of MODEL   75
    1    H    GLU  93           H        GLU  93   4.989   8.377  12.215
    2    HA   GLU  93           HA       GLU  93   6.714   9.841  13.910
    3    HB2  GLU  93           HB2      GLU  93   6.812   9.519  10.896
    4    HB3  GLU  93           HB3      GLU  93   8.141  10.077  11.911
    5    HG2  GLU  93           HG2      GLU  93   6.781   7.416  12.364
    6    HG3  GLU  93           HG3      GLU  93   8.163   7.591  11.289

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LEU  94           H        LEU  94   4.650  10.809  11.192
    2    HA   LEU  94           HA       LEU  94   5.404  13.528  11.085
    3    HB2  LEU  94           HB2      LEU  94   2.841  12.111  10.331
    4    HB3  LEU  94           HB3      LEU  94   3.067  13.843  10.085
    5    HG   LEU  94           HG       LEU  94   5.124  11.891   9.044
    6   HD11  LEU  94          HD11      LEU  94   2.373  12.385   7.975
    7   HD13  LEU  94          HD12      LEU  94   3.384  10.948   7.856
    8   HD12  LEU  94          HD13      LEU  94   3.695  12.331   6.808
    9   HD23  LEU  94          HD21      LEU  94   5.341  13.726   7.316
   10   HD22  LEU  94          HD22      LEU  94   5.744  14.232   8.957
   11   HD21  LEU  94          HD23      LEU  94   4.185  14.668   8.255

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  95           H        ILE  95   2.895  11.867  12.977
    2    HA   ILE  95           HA       ILE  95   1.805  14.200  14.163
    3    HB   ILE  95           HB       ILE  95   1.877  11.322  15.097
    4   HG12  ILE  95          HG12      ILE  95  -0.377  13.048  14.038
    5   HG13  ILE  95          HG13      ILE  95   0.602  12.005  13.011
    6   HG21  ILE  95          HG21      ILE  95   0.544  13.772  16.289
    7   HG23  ILE  95          HG22      ILE  95   1.614  12.626  17.098
    8   HG22  ILE  95          HG23      ILE  95  -0.011  12.132  16.622
    9   HD13  ILE  95          HD11      ILE  95  -0.264  10.052  13.935
   10   HD12  ILE  95          HD12      ILE  95  -1.668  11.114  14.005
   11   HD11  ILE  95          HD13      ILE  95  -0.699  10.839  15.453

  No H/Q in entry =          11
  In of MODEL   75
    1    H    GLU  96           H        GLU  96   4.442  12.036  15.170
    2    HA   GLU  96           HA       GLU  96   4.969  13.253  17.659
    3    HB2  GLU  96           HB2      GLU  96   5.961  11.111  17.019
    4    HB3  GLU  96           HB3      GLU  96   6.880  11.899  15.738
    5    HG2  GLU  96           HG2      GLU  96   8.515  12.485  17.202
    6    HG3  GLU  96           HG3      GLU  96   7.351  13.278  18.253

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LEU  97           H        LEU  97   6.033  14.036  14.372
    2    HA   LEU  97           HA       LEU  97   7.877  16.072  15.081
    3    HB2  LEU  97           HB2      LEU  97   6.301  15.484  12.585
    4    HB3  LEU  97           HB3      LEU  97   7.291  16.936  12.704
    5    HG   LEU  97           HG       LEU  97   8.376  14.161  13.274
    6   HD12  LEU  97          HD11      LEU  97   9.372  14.369  10.958
    7   HD11  LEU  97          HD12      LEU  97   8.293  15.737  10.689
    8   HD13  LEU  97          HD13      LEU  97   7.626  14.132  10.987
    9   HD23  LEU  97          HD21      LEU  97  10.520  15.482  12.531
   10   HD22  LEU  97          HD22      LEU  97   9.893  15.744  14.158
   11   HD21  LEU  97          HD23      LEU  97   9.557  16.916  12.886

  No H/Q in entry =          11
  In of MODEL   75
    1    H    HIS  98           H        HIS  98   4.385  16.134  14.421
    2    HA   HIS  98           HA       HIS  98   4.027  18.927  14.547
    3    HB2  HIS  98           HB2      HIS  98   2.183  16.641  15.276
    4    HB3  HIS  98           HB3      HIS  98   1.681  18.331  15.326
    5    HD1  HIS  98           HD1      HIS  98   2.763  15.631  12.931
    6    HD2  HIS  98           HD2      HIS  98   1.306  19.534  12.795
    7    HE1  HIS  98           HE1      HIS  98   2.197  16.101  10.505
    8    HE2  HIS  98           HE2      HIS  98   1.314  18.472  10.401

  No H/Q in entry =           8
  In of MODEL   75
    1    H    GLU  99           H        GLU  99   4.208  16.450  17.054
    2    HA   GLU  99           HA       GLU  99   3.561  18.138  19.245
    3    HB2  GLU  99           HB2      GLU  99   3.523  15.654  19.350
    4    HB3  GLU  99           HB3      GLU  99   5.284  15.646  19.245
    5    HG2  GLU  99           HG2      GLU  99   5.442  16.948  21.315
    6    HG3  GLU  99           HG3      GLU  99   3.687  17.052  21.407

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LYS 100           H        LYS 100   6.636  17.266  17.689
    2    HA   LYS 100           HA       LYS 100   8.258  18.706  19.544
    3    HB2  LYS 100           HB2      LYS 100   8.781  17.783  16.709
    4    HB3  LYS 100           HB3      LYS 100   9.993  18.581  17.716
    5    HG2  LYS 100           HG2      LYS 100   9.650  16.829  19.462
    6    HG3  LYS 100           HG3      LYS 100   8.537  15.998  18.371
    7    HD2  LYS 100           HD2      LYS 100  10.339  15.748  16.708
    8    HD3  LYS 100           HD3      LYS 100  11.457  16.590  17.784
    9    HE2  LYS 100           HE2      LYS 100  11.094  14.832  19.507
   10    HE3  LYS 100           HE3      LYS 100  10.039  13.971  18.382
   11    HZ1  LYS 100           HZ1      LYS 100  12.846  14.697  17.729
   12    HZ3  LYS 100           HZ2      LYS 100  11.826  13.618  16.903
   13    HZ2  LYS 100           HZ3      LYS 100  12.420  13.215  18.443

  No H/Q in entry =          13
  In of MODEL   75
    1    H    LEU 101           H        LEU 101   6.551  19.589  16.583
    2    HA   LEU 101           HA       LEU 101   7.713  22.169  16.242
    3    HB2  LEU 101           HB2      LEU 101   5.145  20.880  15.355
    4    HB3  LEU 101           HB3      LEU 101   5.360  22.615  15.143
    5    HG   LEU 101           HG       LEU 101   7.439  20.638  14.186
    6   HD12  LEU 101          HD11      LEU 101   6.280  21.114  11.898
    7   HD11  LEU 101          HD12      LEU 101   4.870  21.518  12.875
    8   HD13  LEU 101          HD13      LEU 101   5.568  19.901  12.962
    9   HD21  LEU 101          HD21      LEU 101   6.752  23.536  13.621
   10   HD23  LEU 101          HD22      LEU 101   7.755  22.593  12.519
   11   HD22  LEU 101          HD23      LEU 101   8.288  22.866  14.177

  No H/Q in entry =          11
  In of MODEL   75
    1    H    LYS 102           H        LYS 102   6.195  21.008  18.859
    2    HA   LYS 102           HA       LYS 102   5.537  22.091  20.787
    3    HB2  LYS 102           HB2      LYS 102   6.781  24.104  19.659
    4    HB3  LYS 102           HB3      LYS 102   5.170  24.675  19.279
    5    HG2  LYS 102           HG2      LYS 102   6.548  24.455  21.934
    6    HG3  LYS 102           HG3      LYS 102   5.569  25.762  21.299
    7    HD2  LYS 102           HD2      LYS 102   4.378  23.103  22.184
    8    HD3  LYS 102           HD3      LYS 102   4.597  24.472  23.263
    9    HE2  LYS 102           HE2      LYS 102   2.329  24.019  21.772
   10    HE3  LYS 102           HE3      LYS 102   2.799  25.576  22.451
   11    HZ2  LYS 102           HZ1      LYS 102   2.270  25.667  20.070
   12    HZ1  LYS 102           HZ2      LYS 102   3.554  24.610  19.752
   13    HZ3  LYS 102           HZ3      LYS 102   3.865  26.149  20.391

  No H/Q in entry =          13
  In of MODEL   75
    1    H    ALA 103           H        ALA 103   3.873  23.593  18.012
    2    HA   ALA 103           HA       ALA 103   1.406  24.122  18.892
    3    HB1  ALA 103           HB1      ALA 103   0.528  23.256  16.650
    4    HB2  ALA 103           HB2      ALA 103   2.187  22.752  16.325
    5    HB3  ALA 103           HB3      ALA 103   1.817  24.457  16.586

  No H/Q in entry =           5
  In of MODEL   75
    1    H1   ALA   1           H3       ALA   1  10.945 -20.264  -6.245
    2    H2   ALA   1           H2       ALA   1   9.988 -20.493  -7.631
    3    H3   ALA   1           H1       ALA   1   9.563 -21.244  -6.167
    4    HA   ALA   1           HA       ALA   1  10.639 -23.034  -6.900
    5    HB1  ALA   1           HB1      ALA   1  10.731 -22.679  -9.176
    6    HB2  ALA   1           HB2      ALA   1  12.454 -22.494  -8.845
    7    HB3  ALA   1           HB3      ALA   1  11.428 -21.067  -9.002

  No H/Q in entry =           7
  In of MODEL   75
    1    H    GLU   2           H        GLU   2  12.941 -23.940  -6.952
    2    HA   GLU   2           HA       GLU   2  14.317 -23.826  -4.738
    3    HB2  GLU   2           HB2      GLU   2  15.675 -23.675  -7.436
    4    HB3  GLU   2           HB3      GLU   2  16.412 -24.267  -5.948
    5    HG2  GLU   2           HG2      GLU   2  15.436 -26.304  -6.185
    6    HG3  GLU   2           HG3      GLU   2  13.850 -25.590  -6.448

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLU   3           H        GLU   3  16.055 -21.933  -7.143
    2    HA   GLU   3           HA       GLU   3  17.173 -20.219  -5.186
    3    HB2  GLU   3           HB2      GLU   3  17.121 -20.226  -8.196
    4    HB3  GLU   3           HB3      GLU   3  17.840 -18.880  -7.312
    5    HG2  GLU   3           HG2      GLU   3  19.527 -20.219  -6.383
    6    HG3  GLU   3           HG3      GLU   3  18.610 -21.705  -6.601

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LEU   4           H        LEU   4  14.878 -19.422  -7.822
    2    HA   LEU   4           HA       LEU   4  14.361 -16.821  -7.218
    3    HB2  LEU   4           HB2      LEU   4  12.225 -18.839  -7.946
    4    HB3  LEU   4           HB3      LEU   4  12.116 -17.093  -8.149
    5    HG   LEU   4           HG       LEU   4  14.118 -18.921  -9.515
    6   HD13  LEU   4          HD11      LEU   4  12.816 -18.803 -11.427
    7   HD12  LEU   4          HD12      LEU   4  12.078 -17.271 -10.965
    8   HD11  LEU   4          HD13      LEU   4  11.553 -18.770 -10.200
    9   HD23  LEU   4          HD21      LEU   4  14.413 -16.674 -10.872
   10   HD22  LEU   4          HD22      LEU   4  15.276 -16.896  -9.351
   11   HD21  LEU   4          HD23      LEU   4  13.804 -15.928  -9.394

  No H/Q in entry =          11
  In of MODEL   75
    1    H    GLU   5           H        GLU   5  12.928 -19.629  -5.571
    2    HA   GLU   5           HA       GLU   5  11.218 -18.086  -3.874
    3    HB2  GLU   5           HB2      GLU   5  10.852 -20.480  -4.396
    4    HB3  GLU   5           HB3      GLU   5  12.280 -20.876  -3.440
    5    HG2  GLU   5           HG2      GLU   5  10.368 -21.144  -2.001
    6    HG3  GLU   5           HG3      GLU   5  11.208 -19.677  -1.497

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLU   6           H        GLU   6  14.394 -19.603  -3.423
    2    HA   GLU   6           HA       GLU   6  14.726 -18.733  -0.727
    3    HB2  GLU   6           HB2      GLU   6  15.992 -20.625  -1.705
    4    HB3  GLU   6           HB3      GLU   6  16.829 -19.495  -2.770
    5    HG2  GLU   6           HG2      GLU   6  17.736 -18.306  -0.820
    6    HG3  GLU   6           HG3      GLU   6  16.877 -19.402   0.260

  No H/Q in entry =           6
  In of MODEL   75
    1    H    VAL   7           H        VAL   7  15.470 -17.400  -3.879
    2    HA   VAL   7           HA       VAL   7  17.113 -15.238  -3.018
    3    HB   VAL   7           HB       VAL   7  15.418 -15.642  -5.496
    4   HG11  VAL   7          HG11      VAL   7  17.266 -13.389  -4.688
    5   HG13  VAL   7          HG12      VAL   7  15.622 -13.281  -5.314
    6   HG12  VAL   7          HG13      VAL   7  16.942 -13.760  -6.381
    7   HG21  VAL   7          HG21      VAL   7  17.552 -17.055  -4.921
    8   HG23  VAL   7          HG22      VAL   7  18.429 -15.577  -5.322
    9   HG22  VAL   7          HG23      VAL   7  17.409 -16.351  -6.533

  No H/Q in entry =           9
  In of MODEL   75
    1    H    VAL   8           H        VAL   8  13.627 -15.578  -3.578
    2    HA   VAL   8           HA       VAL   8  12.907 -12.883  -3.115
    3    HB   VAL   8           HB       VAL   8  11.397 -15.480  -2.803
    4   HG12  VAL   8          HG11      VAL   8   9.381 -13.803  -2.724
    5   HG11  VAL   8          HG12      VAL   8  10.585 -12.661  -2.121
    6   HG13  VAL   8          HG13      VAL   8  10.266 -14.154  -1.239
    7   HG22  VAL   8          HG21      VAL   8  11.137 -15.179  -5.050
    8   HG21  VAL   8          HG22      VAL   8  11.948 -13.618  -4.969
    9   HG23  VAL   8          HG23      VAL   8  10.213 -13.721  -4.694

  No H/Q in entry =           9
  In of MODEL   75
    1    H    MET   9           H        MET   9  13.227 -15.677  -0.927
    2    HA   MET   9           HA       MET   9  12.383 -14.415   1.439
    3    HB2  MET   9           HB2      MET   9  14.291 -16.674   0.876
    4    HB3  MET   9           HB3      MET   9  14.075 -16.071   2.519
    5    HG2  MET   9           HG2      MET   9  11.544 -16.347   2.089
    6    HG3  MET   9           HG3      MET   9  12.021 -17.328   0.702
    7    HE2  MET   9           HE1      MET   9  14.527 -19.046   1.501
    8    HE1  MET   9           HE2      MET   9  13.031 -19.382   0.634
    9    HE3  MET   9           HE3      MET   9  13.536 -20.440   1.949

  No H/Q in entry =           9
  In of MODEL   75
    1    H    GLY  10           H        GLY  10  15.570 -14.579  -0.113
    2    HA3  GLY  10           HA2      GLY  10  16.997 -13.124   1.855
    3    HA2  GLY  10           HA3      GLY  10  17.466 -13.284   0.163

  No H/Q in entry =           3
  In of MODEL   75
    1    H    LEU  11           H        LEU  11  15.275 -12.111  -1.083
    2    HA   LEU  11           HA       LEU  11  15.902  -9.352  -0.926
    3    HB2  LEU  11           HB2      LEU  11  13.566 -10.814  -2.160
    4    HB3  LEU  11           HB3      LEU  11  13.810  -9.074  -2.324
    5    HG   LEU  11           HG       LEU  11  15.882 -11.142  -3.104
    6   HD13  LEU  11          HD11      LEU  11  14.147 -11.550  -4.625
    7   HD12  LEU  11          HD12      LEU  11  15.126 -10.350  -5.467
    8   HD11  LEU  11          HD13      LEU  11  13.641  -9.860  -4.652
    9   HD22  LEU  11          HD21      LEU  11  17.072  -9.153  -2.882
   10   HD21  LEU  11          HD22      LEU  11  15.676  -8.146  -3.265
   11   HD23  LEU  11          HD23      LEU  11  16.527  -9.001  -4.551

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  12           H        ILE  12  13.171 -11.232   0.342
    2    HA   ILE  12           HA       ILE  12  11.729  -9.036   1.394
    3    HB   ILE  12           HB       ILE  12  11.826 -11.914   2.351
    4   HG12  ILE  12          HG12      ILE  12  11.127 -11.300  -0.099
    5   HG13  ILE  12          HG13      ILE  12  10.126 -12.411   0.813
    6   HG21  ILE  12          HG21      ILE  12   9.849  -9.679   2.907
    7   HG23  ILE  12          HG22      ILE  12  10.844 -10.534   4.085
    8   HG22  ILE  12          HG23      ILE  12   9.534 -11.377   3.259
    9   HD11  ILE  12          HD11      ILE  12   9.631  -9.431   0.592
   10   HD13  ILE  12          HD12      ILE  12   8.561 -10.630   1.316
   11   HD12  ILE  12          HD13      ILE  12   8.848 -10.640  -0.410

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  13           H        ILE  13  14.167 -11.185   2.809
    2    HA   ILE  13           HA       ILE  13  14.173  -9.998   5.386
    3    HB   ILE  13           HB       ILE  13  16.282 -11.518   3.831
    4   HG12  ILE  13          HG12      ILE  13  14.022 -12.551   4.624
    5   HG13  ILE  13          HG13      ILE  13  15.515 -13.435   4.923
    6   HG21  ILE  13          HG21      ILE  13  16.343 -10.406   6.634
    7   HG23  ILE  13          HG22      ILE  13  17.601 -10.350   5.405
    8   HG22  ILE  13          HG23      ILE  13  17.248 -11.865   6.236
    9   HD13  ILE  13          HD11      ILE  13  15.436 -13.054   7.216
   10   HD12  ILE  13          HD12      ILE  13  13.714 -13.030   6.855
   11   HD11  ILE  13          HD13      ILE  13  14.596 -11.518   7.024

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ASN  14           H        ASN  14  16.119  -9.432   2.469
    2    HA   ASN  14           HA       ASN  14  17.817  -7.448   3.528
    3    HB2  ASN  14           HB2      ASN  14  17.827  -8.721   1.216
    4    HB3  ASN  14           HB3      ASN  14  16.903  -7.326   0.674
    5   HD21  ASN  14          HD21      ASN  14  19.352  -7.613  -0.508
    6   HD22  ASN  14          HD22      ASN  14  20.469  -6.502   0.118

  No H/Q in entry =           6
  In of MODEL   75
    1    H    SER  15           H        SER  15  14.702  -7.177   1.830
    2    HA   SER  15           HA       SER  15  14.525  -4.360   1.879
    3    HB2  SER  15           HB2      SER  15  12.196  -4.662   1.386
    4    HB3  SER  15           HB3      SER  15  13.029  -6.004   0.612
    5    HG   SER  15           HG       SER  15  12.069  -7.339   1.917

  No H/Q in entry =           5
  In of MODEL   75
    1    H    GLY  16           H        GLY  16  13.485  -6.838   4.187
    2    HA3  GLY  16           HA2      GLY  16  12.220  -5.113   6.038
    3    HA2  GLY  16           HA3      GLY  16  12.872  -6.706   6.406

  No H/Q in entry =           3
  In of MODEL   75
    1    H    GLN  17           H        GLN  17  15.576  -6.311   5.816
    2    HA   GLN  17           HA       GLN  17  16.499  -5.061   8.195
    3    HB2  GLN  17           HB2      GLN  17  17.764  -6.831   6.990
    4    HB3  GLN  17           HB3      GLN  17  18.068  -5.693   5.676
    5    HG2  GLN  17           HG2      GLN  17  19.209  -4.179   7.276
    6    HG3  GLN  17           HG3      GLN  17  18.950  -5.360   8.558
    7   HE21  GLN  17          HE21      GLN  17  21.058  -6.148   8.930
    8   HE22  GLN  17          HE22      GLN  17  22.046  -6.814   7.721

  No H/Q in entry =           8
  In of MODEL   75
    1    H    ALA  18           H        ALA  18  16.291  -3.997   4.832
    2    HA   ALA  18           HA       ALA  18  17.669  -1.570   5.055
    3    HB2  ALA  18           HB1      ALA  18  16.584  -2.817   2.989
    4    HB3  ALA  18           HB2      ALA  18  16.807  -1.068   2.969
    5    HB1  ALA  18           HB3      ALA  18  15.223  -1.751   3.338

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ARG  19           H        ARG  19  14.183  -2.241   5.447
    2    HA   ARG  19           HA       ARG  19  13.451   0.394   6.154
    3    HB2  ARG  19           HB2      ARG  19  11.813  -1.398   5.569
    4    HB3  ARG  19           HB3      ARG  19  12.171  -2.184   7.109
    5    HG2  ARG  19           HG2      ARG  19  11.411  -0.207   8.342
    6    HG3  ARG  19           HG3      ARG  19  11.143   0.659   6.830
    7    HD2  ARG  19           HD2      ARG  19   9.019  -0.186   7.649
    8    HD3  ARG  19           HD3      ARG  19   9.462  -1.059   6.176
    9    HE   ARG  19           HE       ARG  19  10.454  -2.573   8.287
   10   HH21  ARG  19          HH11      ARG  19   9.242  -4.239   9.228
   11   HH22  ARG  19          HH12      ARG  19   7.523  -4.254   9.054
   12   HH11  ARG  19          HH21      ARG  19   7.431  -1.355   7.183
   13   HH12  ARG  19          HH22      ARG  19   6.497  -2.621   7.892

  No H/Q in entry =          13
  In of MODEL   75
    1    H    SER  20           H        SER  20  14.373  -2.409   8.122
    2    HA   SER  20           HA       SER  20  14.058  -1.310  10.656
    3    HB2  SER  20           HB2      SER  20  14.580  -3.623  10.542
    4    HB3  SER  20           HB3      SER  20  16.028  -3.327   9.581
    5    HG   SER  20           HG       SER  20  15.597  -2.492  12.264

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LEU  21           H        LEU  21  16.903  -1.186   8.525
    2    HA   LEU  21           HA       LEU  21  18.538   0.345  10.262
    3    HB2  LEU  21           HB2      LEU  21  18.530   0.069   7.248
    4    HB3  LEU  21           HB3      LEU  21  19.764   0.954   8.142
    5    HG   LEU  21           HG       LEU  21  19.081  -1.951   8.680
    6   HD11  LEU  21          HD11      LEU  21  19.948  -1.588   6.361
    7   HD13  LEU  21          HD12      LEU  21  21.050  -2.531   7.363
    8   HD12  LEU  21          HD13      LEU  21  21.382  -0.828   7.053
    9   HD23  LEU  21          HD21      LEU  21  21.574  -1.725   9.561
   10   HD22  LEU  21          HD22      LEU  21  20.246  -1.199  10.589
   11   HD21  LEU  21          HD23      LEU  21  21.173  -0.015   9.681

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ALA  22           H        ALA  22  16.257   1.252   7.699
    2    HA   ALA  22           HA       ALA  22  16.729   4.023   7.707
    3    HB3  ALA  22           HB1      ALA  22  15.360   2.743   6.029
    4    HB2  ALA  22           HB2      ALA  22  14.616   4.240   6.591
    5    HB1  ALA  22           HB3      ALA  22  14.062   2.688   7.221

  No H/Q in entry =           5
  In of MODEL   75
    1    H    TYR  23           H        TYR  23  14.273   2.152   9.542
    2    HA   TYR  23           HA       TYR  23  13.254   4.370  10.983
    3    HB2  TYR  23           HB2      TYR  23  12.068   2.229  10.966
    4    HB3  TYR  23           HB3      TYR  23  13.418   1.450  11.793
    5    HD1  TYR  23           HD1      TYR  23  10.873   4.159  12.155
    6    HD2  TYR  23           HD2      TYR  23  13.591   1.496  14.147
    7    HE1  TYR  23           HE1      TYR  23   9.928   4.834  14.348
    8    HE2  TYR  23           HE2      TYR  23  12.647   2.169  16.338
    9    HH   TYR  23           HH       TYR  23   9.968   4.518  16.540

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ALA  24           H        ALA  24  15.952   2.159  11.632
    2    HA   ALA  24           HA       ALA  24  16.593   3.177  14.194
    3    HB1  ALA  24           HB1      ALA  24  17.992   1.416  14.036
    4    HB3  ALA  24           HB2      ALA  24  18.999   2.358  12.937
    5    HB2  ALA  24           HB3      ALA  24  17.730   1.318  12.296

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ALA  25           H        ALA  25  17.534   4.119  10.914
    2    HA   ALA  25           HA       ALA  25  19.433   6.100  11.559
    3    HB1  ALA  25           HB1      ALA  25  18.743   5.130   9.244
    4    HB3  ALA  25           HB2      ALA  25  19.205   6.829   9.334
    5    HB2  ALA  25           HB3      ALA  25  17.500   6.382   9.263

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LEU  26           H        LEU  26  15.914   6.247  11.190
    2    HA   LEU  26           HA       LEU  26  15.625   9.024  11.633
    3    HB2  LEU  26           HB2      LEU  26  13.794   7.743  10.705
    4    HB3  LEU  26           HB3      LEU  26  13.724   6.717  12.133
    5    HG   LEU  26           HG       LEU  26  13.070   8.664  13.507
    6   HD12  LEU  26          HD11      LEU  26  12.364  10.745  12.174
    7   HD11  LEU  26          HD12      LEU  26  13.362  10.112  10.868
    8   HD13  LEU  26          HD13      LEU  26  14.095  10.518  12.421
    9   HD21  LEU  26          HD21      LEU  26  11.408   8.306  10.994
   10   HD23  LEU  26          HD22      LEU  26  10.828   8.994  12.508
   11   HD22  LEU  26          HD23      LEU  26  11.319   7.304  12.443

  No H/Q in entry =          11
  In of MODEL   75
    1    H    LYS  27           H        LYS  27  15.576   6.248  13.833
    2    HA   LYS  27           HA       LYS  27  14.947   7.606  16.197
    3    HB2  LYS  27           HB2      LYS  27  15.032   5.132  15.938
    4    HB3  LYS  27           HB3      LYS  27  16.794   5.224  15.898
    5    HG2  LYS  27           HG2      LYS  27  16.817   6.216  18.145
    6    HG3  LYS  27           HG3      LYS  27  15.050   6.195  18.187
    7    HD2  LYS  27           HD2      LYS  27  15.081   3.727  17.957
    8    HD3  LYS  27           HD3      LYS  27  16.846   3.756  17.949
    9    HE2  LYS  27           HE2      LYS  27  16.853   4.751  20.203
   10    HE3  LYS  27           HE3      LYS  27  15.086   4.752  20.214
   11    HZ3  LYS  27           HZ1      LYS  27  15.916   2.821  21.371
   12    HZ2  LYS  27           HZ2      LYS  27  16.845   2.359  20.023
   13    HZ1  LYS  27           HZ3      LYS  27  15.148   2.326  19.941

  No H/Q in entry =          13
  In of MODEL   75
    1    H    GLN  28           H        GLN  28  18.079   7.089  14.612
    2    HA   GLN  28           HA       GLN  28  19.735   8.215  16.603
    3    HB2  GLN  28           HB2      GLN  28  20.028   8.165  13.589
    4    HB3  GLN  28           HB3      GLN  28  21.302   8.673  14.698
    5    HG2  GLN  28           HG2      GLN  28  19.949   5.961  14.750
    6    HG3  GLN  28           HG3      GLN  28  21.525   6.284  14.031
    7   HE21  GLN  28          HE21      GLN  28  20.292   4.938  16.729
    8   HE22  GLN  28          HE22      GLN  28  21.461   5.399  17.868

  No H/Q in entry =           8
  In of MODEL   75
    1    H    ALA  29           H        ALA  29  17.957   9.652  13.904
    2    HA   ALA  29           HA       ALA  29  18.898  12.295  14.152
    3    HB2  ALA  29           HB1      ALA  29  17.189  12.891  12.676
    4    HB1  ALA  29           HB2      ALA  29  16.069  11.695  13.328
    5    HB3  ALA  29           HB3      ALA  29  17.413  11.179  12.308

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LYS  30           H        LYS  30  16.153  10.640  15.672
    2    HA   LYS  30           HA       LYS  30  15.089  12.875  17.021
    3    HB2  LYS  30           HB2      LYS  30  15.038   9.934  17.732
    4    HB3  LYS  30           HB3      LYS  30  14.144  11.168  18.621
    5    HG2  LYS  30           HG2      LYS  30  13.009  11.824  16.499
    6    HG3  LYS  30           HG3      LYS  30  13.843  10.503  15.677
    7    HD2  LYS  30           HD2      LYS  30  12.803   8.878  17.207
    8    HD3  LYS  30           HD3      LYS  30  11.979  10.188  18.053
    9    HE2  LYS  30           HE2      LYS  30  10.802  10.791  15.957
   10    HE3  LYS  30           HE3      LYS  30  11.606   9.451  15.131
   11    HZ2  LYS  30           HZ1      LYS  30   9.305   8.996  16.008
   12    HZ1  LYS  30           HZ2      LYS  30   9.968   9.067  17.576
   13    HZ3  LYS  30           HZ3      LYS  30  10.503   7.890  16.469

  No H/Q in entry =          13
  In of MODEL   75
    1    H    GLN  31           H        GLN  31  17.793  10.763  17.769
    2    HA   GLN  31           HA       GLN  31  18.094  11.791  20.461
    3    HB2  GLN  31           HB2      GLN  31  20.152  10.258  18.864
    4    HB3  GLN  31           HB3      GLN  31  20.012  10.384  20.618
    5    HG2  GLN  31           HG2      GLN  31  17.520   9.378  19.847
    6    HG3  GLN  31           HG3      GLN  31  18.641   8.554  18.771
    7   HE21  GLN  31          HE21      GLN  31  17.118   7.382  21.047
    8   HE22  GLN  31          HE22      GLN  31  18.286   6.747  22.101

  No H/Q in entry =           8
  In of MODEL   75
    1    H    GLY  32           H        GLY  32  18.591  13.111  17.492
    2    HA3  GLY  32           HA2      GLY  32  19.534  15.175  16.975
    3    HA2  GLY  32           HA3      GLY  32  20.288  15.200  18.564

  No H/Q in entry =           3
  In of MODEL   75
    1    H    ASP  33           H        ASP  33  20.774  12.312  16.795
    2    HA   ASP  33           HA       ASP  33  23.585  13.045  16.333
    3    HB2  ASP  33           HB2      ASP  33  22.131  10.398  16.452
    4    HB3  ASP  33           HB3      ASP  33  23.816  10.549  15.960

  No H/Q in entry =           4
  In of MODEL   75
    1    H    PHE  34           H        PHE  34  23.080  14.353  14.447
    2    HA   PHE  34           HA       PHE  34  21.756  13.336  12.160
    3    HB2  PHE  34           HB2      PHE  34  23.842  15.515  12.389
    4    HB3  PHE  34           HB3      PHE  34  22.865  15.200  10.956
    5    HD1  PHE  34           HD1      PHE  34  23.070  17.146  13.865
    6    HD2  PHE  34           HD2      PHE  34  20.242  14.965  11.479
    7    HE1  PHE  34           HE1      PHE  34  21.223  18.508  14.805
    8    HE2  PHE  34           HE2      PHE  34  18.399  16.326  12.422
    9    HZ   PHE  34           HZ       PHE  34  18.893  18.098  14.081

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ALA  35           H        ALA  35  25.132  13.222  13.174
    2    HA   ALA  35           HA       ALA  35  26.259  12.418  10.721
    3    HB3  ALA  35           HB1      ALA  35  27.961  11.289  12.447
    4    HB2  ALA  35           HB2      ALA  35  27.073  12.298  13.589
    5    HB1  ALA  35           HB3      ALA  35  27.897  13.036  12.216

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ALA  36           H        ALA  36  25.180  10.446  13.490
    2    HA   ALA  36           HA       ALA  36  25.720   7.966  12.221
    3    HB2  ALA  36           HB1      ALA  36  25.301   7.215  14.298
    4    HB3  ALA  36           HB2      ALA  36  23.603   7.674  14.143
    5    HB1  ALA  36           HB3      ALA  36  24.778   8.832  14.765

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ALA  37           H        ALA  37  22.852  10.031  12.344
    2    HA   ALA  37           HA       ALA  37  21.037   8.219  11.169
    3    HB3  ALA  37           HB1      ALA  37  21.198  11.187  11.455
    4    HB1  ALA  37           HB2      ALA  37  19.909  10.081  11.927
    5    HB2  ALA  37           HB3      ALA  37  20.091  10.553  10.237

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LYS  38           H        LYS  38  23.085  10.722   9.688
    2    HA   LYS  38           HA       LYS  38  22.460  10.273   7.011
    3    HB2  LYS  38           HB2      LYS  38  24.233  11.874   8.455
    4    HB3  LYS  38           HB3      LYS  38  25.289  10.905   7.434
    5    HG2  LYS  38           HG2      LYS  38  24.112  11.645   5.434
    6    HG3  LYS  38           HG3      LYS  38  22.897  12.475   6.411
    7    HD2  LYS  38           HD2      LYS  38  24.455  14.110   7.162
    8    HD3  LYS  38           HD3      LYS  38  25.837  13.153   6.631
    9    HE2  LYS  38           HE2      LYS  38  25.442  15.012   5.075
   10    HE3  LYS  38           HE3      LYS  38  25.143  13.466   4.274
   11    HZ3  LYS  38           HZ1      LYS  38  22.937  13.861   4.138
   12    HZ2  LYS  38           HZ2      LYS  38  23.423  15.487   4.223
   13    HZ1  LYS  38           HZ3      LYS  38  22.864  14.694   5.616

  No H/Q in entry =          13
  In of MODEL   75
    1    H    ALA  39           H        ALA  39  25.006   8.737   8.976
    2    HA   ALA  39           HA       ALA  39  26.114   7.168   6.912
    3    HB2  ALA  39           HB1      ALA  39  26.042   6.210   9.758
    4    HB1  ALA  39           HB2      ALA  39  26.963   7.655   9.340
    5    HB3  ALA  39           HB3      ALA  39  27.351   6.111   8.581

  No H/Q in entry =           5
  In of MODEL   75
    1    H    MET  40           H        MET  40  23.511   6.499   9.207
    2    HA   MET  40           HA       MET  40  23.131   3.783   8.478
    3    HB2  MET  40           HB2      MET  40  21.266   5.788   9.762
    4    HB3  MET  40           HB3      MET  40  20.899   4.069   9.591
    5    HG2  MET  40           HG2      MET  40  23.424   5.071  10.934
    6    HG3  MET  40           HG3      MET  40  21.934   4.764  11.825
    7    HE3  MET  40           HE1      MET  40  21.454   1.119  12.009
    8    HE2  MET  40           HE2      MET  40  20.557   2.400  11.197
    9    HE1  MET  40           HE3      MET  40  21.288   2.708  12.770

  No H/Q in entry =           9
  In of MODEL   75
    1    H    MET  41           H        MET  41  21.650   6.800   7.281
    2    HA   MET  41           HA       MET  41  19.724   5.556   5.609
    3    HB2  MET  41           HB2      MET  41  21.146   8.179   5.092
    4    HB3  MET  41           HB3      MET  41  19.631   7.648   4.371
    5    HG2  MET  41           HG2      MET  41  18.885   7.449   6.922
    6    HG3  MET  41           HG3      MET  41  20.167   8.637   7.143
    7    HE2  MET  41           HE1      MET  41  19.581   9.903   3.803
    8    HE1  MET  41           HE2      MET  41  20.524  10.368   5.215
    9    HE3  MET  41           HE3      MET  41  19.228  11.417   4.646

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ASP  42           H        ASP  42  23.075   6.555   5.059
    2    HA   ASP  42           HA       ASP  42  23.183   6.077   2.303
    3    HB2  ASP  42           HB2      ASP  42  24.908   7.119   4.073
    4    HB3  ASP  42           HB3      ASP  42  25.603   5.509   3.950

  No H/Q in entry =           4
  In of MODEL   75
    1    H    GLN  43           H        GLN  43  23.952   3.946   5.030
    2    HA   GLN  43           HA       GLN  43  24.672   1.701   3.454
    3    HB2  GLN  43           HB2      GLN  43  23.640   1.867   6.295
    4    HB3  GLN  43           HB3      GLN  43  24.254   0.390   5.545
    5    HG2  GLN  43           HG2      GLN  43  26.390   1.650   5.035
    6    HG3  GLN  43           HG3      GLN  43  25.775   2.965   6.030
    7   HE21  GLN  43          HE21      GLN  43  28.028   2.047   7.073
    8   HE22  GLN  43          HE22      GLN  43  27.776   0.961   8.351

  No H/Q in entry =           8
  In of MODEL   75
    1    H    SER  44           H        SER  44  21.588   2.767   4.831
    2    HA   SER  44           HA       SER  44  20.073   0.486   4.161
    3    HB2  SER  44           HB2      SER  44  19.570   3.007   5.300
    4    HB3  SER  44           HB3      SER  44  18.540   2.936   3.873
    5    HG   SER  44           HG       SER  44  17.465   1.972   5.596

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ARG  45           H        ARG  45  20.750   3.463   2.350
    2    HA   ARG  45           HA       ARG  45  19.240   2.936   0.044
    3    HB2  ARG  45           HB2      ARG  45  20.333   5.100   0.625
    4    HB3  ARG  45           HB3      ARG  45  21.896   4.380   0.244
    5    HG2  ARG  45           HG2      ARG  45  21.126   3.951  -2.071
    6    HG3  ARG  45           HG3      ARG  45  19.575   4.694  -1.689
    7    HD2  ARG  45           HD2      ARG  45  20.776   6.820  -1.107
    8    HD3  ARG  45           HD3      ARG  45  22.291   6.080  -1.672
    9    HE   ARG  45           HE       ARG  45  20.370   5.793  -3.710
   10   HH21  ARG  45          HH11      ARG  45  20.335   7.157  -5.477
   11   HH22  ARG  45          HH12      ARG  45  21.056   8.724  -5.375
   12   HH11  ARG  45          HH21      ARG  45  22.040   8.334  -2.087
   13   HH12  ARG  45          HH22      ARG  45  22.020   9.390  -3.453

  No H/Q in entry =          13
  In of MODEL   75
    1    H    MET  46           H        MET  46  22.622   2.140   0.799
    2    HA   MET  46           HA       MET  46  23.259   0.955  -1.681
    3    HB2  MET  46           HB2      MET  46  24.368   0.662   1.110
    4    HB3  MET  46           HB3      MET  46  25.047  -0.221  -0.261
    5    HG2  MET  46           HG2      MET  46  25.448   1.890  -1.451
    6    HG3  MET  46           HG3      MET  46  24.715   2.793  -0.131
    7    HE3  MET  46           HE1      MET  46  27.459  -0.353   0.200
    8    HE2  MET  46           HE2      MET  46  28.722   0.712  -0.410
    9    HE1  MET  46           HE3      MET  46  27.258   0.458  -1.359

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ALA  47           H        ALA  47  21.902  -0.401   1.296
    2    HA   ALA  47           HA       ALA  47  21.910  -3.117   0.500
    3    HB2  ALA  47           HB1      ALA  47  21.518  -2.658   2.803
    4    HB3  ALA  47           HB2      ALA  47  19.996  -3.297   2.184
    5    HB1  ALA  47           HB3      ALA  47  20.187  -1.561   2.438

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LEU  48           H        LEU  48  19.500  -0.543   0.134
    2    HA   LEU  48           HA       LEU  48  17.491  -2.125  -1.115
    3    HB2  LEU  48           HB2      LEU  48  18.080   0.843  -1.237
    4    HB3  LEU  48           HB3      LEU  48  16.626   0.099  -1.903
    5    HG   LEU  48           HG       LEU  48  17.483  -0.176   0.987
    6   HD13  LEU  48          HD11      LEU  48  17.015   2.114   0.793
    7   HD12  LEU  48          HD12      LEU  48  15.470   1.434   1.303
    8   HD11  LEU  48          HD13      LEU  48  15.734   1.857  -0.389
    9   HD22  LEU  48          HD21      LEU  48  15.992  -1.925   0.610
   10   HD21  LEU  48          HD22      LEU  48  15.100  -1.045  -0.632
   11   HD23  LEU  48          HD23      LEU  48  14.877  -0.640   1.070

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ASN  49           H        ASN  49  20.137  -0.142  -2.349
    2    HA   ASN  49           HA       ASN  49  19.491  -0.247  -5.073
    3    HB2  ASN  49           HB2      ASN  49  21.133   1.311  -4.169
    4    HB3  ASN  49           HB3      ASN  49  22.186  -0.018  -3.704
    5   HD21  ASN  49          HD21      ASN  49  20.672   1.449  -6.603
    6   HD22  ASN  49          HD22      ASN  49  21.930   1.024  -7.659

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLU  50           H        GLU  50  21.520  -2.393  -3.103
    2    HA   GLU  50           HA       GLU  50  22.261  -4.139  -5.223
    3    HB2  GLU  50           HB2      GLU  50  23.457  -4.082  -3.056
    4    HB3  GLU  50           HB3      GLU  50  22.027  -4.738  -2.259
    5    HG2  GLU  50           HG2      GLU  50  22.161  -6.773  -3.612
    6    HG3  GLU  50           HG3      GLU  50  23.524  -6.113  -4.514

  No H/Q in entry =           6
  In of MODEL   75
    1    H    ALA  51           H        ALA  51  19.602  -4.124  -2.899
    2    HA   ALA  51           HA       ALA  51  18.490  -6.624  -3.649
    3    HB3  ALA  51           HB1      ALA  51  16.886  -6.147  -2.096
    4    HB1  ALA  51           HB2      ALA  51  16.638  -4.508  -2.700
    5    HB2  ALA  51           HB3      ALA  51  18.005  -4.862  -1.642

  No H/Q in entry =           5
  In of MODEL   75
    1    H    HIS  52           H        HIS  52  17.833  -3.292  -4.695
    2    HA   HIS  52           HA       HIS  52  15.733  -3.870  -6.494
    3    HB2  HIS  52           HB2      HIS  52  16.292  -1.589  -5.720
    4    HB3  HIS  52           HB3      HIS  52  17.791  -1.655  -6.645
    5    HD1  HIS  52           HD1      HIS  52  17.497  -1.940  -9.310
    6    HD2  HIS  52           HD2      HIS  52  14.055  -0.866  -7.217
    7    HE1  HIS  52           HE1      HIS  52  15.851  -1.075 -11.031
    8    HE2  HIS  52           HE2      HIS  52  13.749  -0.415  -9.771

  No H/Q in entry =           8
  In of MODEL   75
    1    H    LEU  53           H        LEU  53  19.251  -3.801  -6.925
    2    HA   LEU  53           HA       LEU  53  19.316  -4.124  -9.724
    3    HB2  LEU  53           HB2      LEU  53  21.266  -4.855  -7.552
    4    HB3  LEU  53           HB3      LEU  53  21.590  -5.208  -9.247
    5    HG   LEU  53           HG       LEU  53  20.854  -2.430  -8.272
    6   HD12  LEU  53          HD11      LEU  53  23.383  -2.044  -8.626
    7   HD11  LEU  53          HD12      LEU  53  23.534  -3.796  -8.503
    8   HD13  LEU  53          HD13      LEU  53  22.892  -2.871  -7.151
    9   HD22  LEU  53          HD21      LEU  53  20.586  -2.455 -10.614
   10   HD21  LEU  53          HD22      LEU  53  21.893  -3.613 -10.842
   11   HD23  LEU  53          HD23      LEU  53  22.261  -1.941 -10.457

  No H/Q in entry =          11
  In of MODEL   75
    1    H    VAL  54           H        VAL  54  19.254  -6.504  -7.091
    2    HA   VAL  54           HA       VAL  54  19.428  -8.801  -8.743
    3    HB   VAL  54           HB       VAL  54  18.264  -8.393  -5.977
    4   HG12  VAL  54          HG11      VAL  54  18.645 -11.003  -5.964
    5   HG11  VAL  54          HG12      VAL  54  18.458 -10.845  -7.710
    6   HG13  VAL  54          HG13      VAL  54  17.157 -10.339  -6.634
    7   HG22  VAL  54          HG21      VAL  54  20.574  -8.131  -5.754
    8   HG21  VAL  54          HG22      VAL  54  20.936  -9.220  -7.092
    9   HG23  VAL  54          HG23      VAL  54  20.420  -9.873  -5.537

  No H/Q in entry =           9
  In of MODEL   75
    1    H    GLN  55           H        GLN  55  16.658  -6.954  -7.467
    2    HA   GLN  55           HA       GLN  55  14.675  -8.666  -8.536
    3    HB2  GLN  55           HB2      GLN  55  13.892  -7.152  -6.915
    4    HB3  GLN  55           HB3      GLN  55  14.655  -5.769  -7.696
    5    HG2  GLN  55           HG2      GLN  55  12.924  -5.488  -9.187
    6    HG3  GLN  55           HG3      GLN  55  12.641  -7.216  -9.351
    7   HE21  GLN  55          HE21      GLN  55  10.647  -7.807  -8.545
    8   HE22  GLN  55          HE22      GLN  55   9.856  -7.066  -7.240

  No H/Q in entry =           8
  In of MODEL   75
    1    H    THR  56           H        THR  56  16.352  -5.833  -9.905
    2    HA   THR  56           HA       THR  56  14.907  -5.511 -12.255
    3    HB   THR  56           HB       THR  56  17.902  -5.282 -11.863
    4    HG1  THR  56           HG1      THR  56  15.897  -3.287 -11.900
    5   HG21  THR  56          HG21      THR  56  16.085  -4.263 -14.061
    6   HG23  THR  56          HG22      THR  56  17.388  -5.439 -14.231
    7   HG22  THR  56          HG23      THR  56  17.762  -3.760 -13.839

  No H/Q in entry =           7
  In of MODEL   75
    1    H    LYS  57           H        LYS  57  17.608  -7.746 -11.635
    2    HA   LYS  57           HA       LYS  57  17.637  -8.949 -14.209
    3    HB2  LYS  57           HB2      LYS  57  19.436  -9.159 -12.474
    4    HB3  LYS  57           HB3      LYS  57  18.353 -10.160 -11.517
    5    HG2  LYS  57           HG2      LYS  57  18.259 -11.820 -13.326
    6    HG3  LYS  57           HG3      LYS  57  19.315 -10.821 -14.317
    7    HD2  LYS  57           HD2      LYS  57  21.101 -11.029 -12.612
    8    HD3  LYS  57           HD3      LYS  57  20.050 -12.063 -11.645
    9    HE2  LYS  57           HE2      LYS  57  19.940 -13.693 -13.509
   10    HE3  LYS  57           HE3      LYS  57  21.012 -12.674 -14.470
   11    HZ2  LYS  57           HZ1      LYS  57  21.615 -14.211 -12.034
   12    HZ1  LYS  57           HZ2      LYS  57  22.558 -12.862 -12.449
   13    HZ3  LYS  57           HZ3      LYS  57  22.443 -14.179 -13.513

  No H/Q in entry =          13
  In of MODEL   75
    1    H    LEU  58           H        LEU  58  15.871  -9.646 -11.231
    2    HA   LEU  58           HA       LEU  58  14.704 -12.051 -12.158
    3    HB2  LEU  58           HB2      LEU  58  13.865 -10.156  -9.969
    4    HB3  LEU  58           HB3      LEU  58  13.094 -11.713 -10.280
    5    HG   LEU  58           HG       LEU  58  16.060 -11.365  -9.726
    6   HD11  LEU  58          HD11      LEU  58  13.698 -11.830  -7.932
    7   HD13  LEU  58          HD12      LEU  58  15.129 -10.833  -7.673
    8   HD12  LEU  58          HD13      LEU  58  15.242 -12.586  -7.532
    9   HD22  LEU  58          HD21      LEU  58  15.990 -13.432 -10.746
   10   HD21  LEU  58          HD22      LEU  58  14.281 -13.680 -10.385
   11   HD23  LEU  58          HD23      LEU  58  15.496 -13.949  -9.134

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  59           H        ILE  59  13.956  -8.732 -12.853
    2    HA   ILE  59           HA       ILE  59  11.257  -9.447 -13.791
    3    HB   ILE  59           HB       ILE  59  12.000  -7.145 -12.591
    4   HG12  ILE  59          HG12      ILE  59  10.116  -7.050 -14.955
    5   HG13  ILE  59          HG13      ILE  59   9.698  -7.851 -13.463
    6   HG22  ILE  59          HG21      ILE  59  12.086  -6.328 -15.481
    7   HG21  ILE  59          HG22      ILE  59  13.565  -6.728 -14.637
    8   HG23  ILE  59          HG23      ILE  59  12.553  -5.401 -14.077
    9   HD11  ILE  59          HD11      ILE  59  10.155  -5.744 -12.220
   10   HD13  ILE  59          HD12      ILE  59   8.849  -5.570 -13.392
   11   HD12  ILE  59          HD13      ILE  59  10.456  -4.944 -13.763

  No H/Q in entry =          11
  In of MODEL   75
    1    H    GLU  60           H        GLU  60  14.441  -8.526 -15.052
    2    HA   GLU  60           HA       GLU  60  13.653  -8.154 -17.762
    3    HB2  GLU  60           HB2      GLU  60  15.820  -7.381 -16.870
    4    HB3  GLU  60           HB3      GLU  60  16.321  -9.055 -16.639
    5    HG2  GLU  60           HG2      GLU  60  16.124  -9.462 -19.062
    6    HG3  GLU  60           HG3      GLU  60  15.597  -7.798 -19.304

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLY  61           H        GLY  61  14.696 -11.005 -15.936
    2    HA3  GLY  61           HA2      GLY  61  14.193 -12.674 -18.331
    3    HA2  GLY  61           HA3      GLY  61  15.236 -13.126 -16.987

  No H/Q in entry =           3
  In of MODEL   75
    1    H    ASP  62           H        ASP  62  12.080 -11.652 -16.625
    2    HA   ASP  62           HA       ASP  62  11.176 -13.508 -14.735
    3    HB2  ASP  62           HB2      ASP  62   8.949 -12.466 -15.139
    4    HB3  ASP  62           HB3      ASP  62  10.233 -11.295 -14.855

  No H/Q in entry =           4
  In of MODEL   75
    1    H    ALA  63           H        ALA  63  11.553 -14.049 -18.044
    2    HA   ALA  63           HA       ALA  63   9.228 -15.758 -18.442
    3    HB1  ALA  63           HB1      ALA  63  10.571 -16.408 -20.541
    4    HB2  ALA  63           HB2      ALA  63  11.702 -15.146 -20.055
    5    HB3  ALA  63           HB3      ALA  63  10.026 -14.734 -20.419

  No H/Q in entry =           5
  In of MODEL   75
    1    H    GLY  64           H        GLY  64   9.606 -18.047 -19.162
    2    HA3  GLY  64           HA2      GLY  64  11.348 -19.901 -18.966
    3    HA2  GLY  64           HA3      GLY  64  11.484 -19.356 -17.300

  No H/Q in entry =           3
  In of MODEL   75
    1    H    GLU  65           H        GLU  65   9.050 -19.094 -16.327
    2    HA   GLU  65           HA       GLU  65   8.140 -21.746 -16.036
    3    HB2  GLU  65           HB2      GLU  65   6.878 -19.122 -15.252
    4    HB3  GLU  65           HB3      GLU  65   6.224 -20.696 -14.802
    5    HG2  GLU  65           HG2      GLU  65   8.306 -21.275 -13.662
    6    HG3  GLU  65           HG3      GLU  65   9.034 -19.752 -14.168

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLY  66           H        GLY  66   6.977 -19.088 -17.950
    2    HA3  GLY  66           HA2      GLY  66   5.629 -20.768 -19.815
    3    HA2  GLY  66           HA3      GLY  66   4.496 -19.895 -18.804

  No H/Q in entry =           3
  In of MODEL   75
    1    H    LYS  67           H        LYS  67   4.540 -19.615 -21.535
    2    HA   LYS  67           HA       LYS  67   5.960 -17.877 -22.916
    3    HB2  LYS  67           HB2      LYS  67   2.952 -17.904 -22.712
    4    HB3  LYS  67           HB3      LYS  67   3.849 -17.067 -23.985
    5    HG2  LYS  67           HG2      LYS  67   4.984 -19.201 -24.559
    6    HG3  LYS  67           HG3      LYS  67   4.024 -20.025 -23.334
    7    HD2  LYS  67           HD2      LYS  67   2.784 -18.490 -25.627
    8    HD3  LYS  67           HD3      LYS  67   3.139 -20.217 -25.707
    9    HE2  LYS  67           HE2      LYS  67   1.805 -20.441 -23.531
   10    HE3  LYS  67           HE3      LYS  67   1.244 -18.796 -23.828
   11    HZ1  LYS  67           HZ1      LYS  67   0.957 -20.186 -26.209
   12    HZ3  LYS  67           HZ2      LYS  67  -0.272 -19.633 -25.178
   13    HZ2  LYS  67           HZ3      LYS  67   0.353 -21.202 -24.994

  No H/Q in entry =          13
  In of MODEL   75
    1    H    MET  68           H        MET  68   3.232 -16.038 -22.373
    2    HA   MET  68           HA       MET  68   4.605 -13.633 -21.872
    3    HB2  MET  68           HB2      MET  68   1.676 -14.255 -21.480
    4    HB3  MET  68           HB3      MET  68   2.390 -12.653 -21.661
    5    HG2  MET  68           HG2      MET  68   2.478 -14.866 -23.730
    6    HG3  MET  68           HG3      MET  68   1.457 -13.431 -23.802
    7    HE1  MET  68           HE1      MET  68   2.071 -11.237 -23.816
    8    HE3  MET  68           HE2      MET  68   3.525 -10.529 -24.514
    9    HE2  MET  68           HE3      MET  68   3.501 -10.968 -22.809

  No H/Q in entry =           9
  In of MODEL   75
    1    H    LYS  69           H        LYS  69   2.873 -15.794 -19.619
    2    HA   LYS  69           HA       LYS  69   2.690 -14.106 -17.432
    3    HB2  LYS  69           HB2      LYS  69   3.079 -17.102 -17.476
    4    HB3  LYS  69           HB3      LYS  69   2.559 -16.174 -16.067
    5    HG2  LYS  69           HG2      LYS  69   0.694 -15.235 -17.532
    6    HG3  LYS  69           HG3      LYS  69   1.129 -16.468 -18.716
    7    HD2  LYS  69           HD2      LYS  69   0.008 -16.836 -15.943
    8    HD3  LYS  69           HD3      LYS  69  -0.583 -17.497 -17.469
    9    HE2  LYS  69           HE2      LYS  69   1.615 -18.786 -17.610
   10    HE3  LYS  69           HE3      LYS  69   1.896 -18.309 -15.937
   11    HZ2  LYS  69           HZ1      LYS  69   0.549 -20.501 -16.681
   12    HZ1  LYS  69           HZ2      LYS  69  -0.725 -19.401 -16.456
   13    HZ3  LYS  69           HZ3      LYS  69   0.356 -19.726 -15.187

  No H/Q in entry =          13
  In of MODEL   75
    1    H    VAL  70           H        VAL  70   3.790 -14.248 -15.282
    2    HA   VAL  70           HA       VAL  70   6.721 -14.615 -15.519
    3    HB   VAL  70           HB       VAL  70   6.962 -12.588 -14.074
    4   HG13  VAL  70          HG11      VAL  70   6.953 -11.134 -15.893
    5   HG12  VAL  70          HG12      VAL  70   5.419 -11.753 -16.506
    6   HG11  VAL  70          HG13      VAL  70   6.896 -12.691 -16.717
    7   HG22  VAL  70          HG21      VAL  70   4.858 -12.367 -12.985
    8   HG21  VAL  70          HG22      VAL  70   3.972 -12.518 -14.501
    9   HG23  VAL  70          HG23      VAL  70   4.867 -11.040 -14.147

  No H/Q in entry =           9
  In of MODEL   75
    1    H    SER  71           H        SER  71   7.755 -14.692 -13.319
    2    HA   SER  71           HA       SER  71   6.644 -16.729 -11.706
    3    HB2  SER  71           HB2      SER  71   9.073 -16.201 -11.818
    4    HB3  SER  71           HB3      SER  71   8.763 -14.695 -10.957
    5    HG   SER  71           HG       SER  71   8.961 -17.240 -10.021

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LEU  72           H        LEU  72   5.309 -16.660  -9.985
    2    HA   LEU  72           HA       LEU  72   3.706 -14.381  -9.550
    3    HB2  LEU  72           HB2      LEU  72   4.051 -16.923  -7.967
    4    HB3  LEU  72           HB3      LEU  72   2.850 -15.694  -7.580
    5    HG   LEU  72           HG       LEU  72   3.054 -17.000 -10.312
    6   HD11  LEU  72          HD11      LEU  72   2.556 -18.660  -8.503
    7   HD13  LEU  72          HD12      LEU  72   1.217 -18.445  -9.628
    8   HD12  LEU  72          HD13      LEU  72   1.164 -17.680  -8.041
    9   HD23  LEU  72          HD21      LEU  72   0.551 -16.248 -10.238
   10   HD22  LEU  72          HD22      LEU  72   1.765 -15.020 -10.549
   11   HD21  LEU  72          HD23      LEU  72   1.069 -15.180  -8.939

  No H/Q in entry =          11
  In of MODEL   75
    1    H    VAL  73           H        VAL  73   6.393 -15.751  -7.770
    2    HA   VAL  73           HA       VAL  73   6.295 -14.213  -5.442
    3    HB   VAL  73           HB       VAL  73   8.460 -15.004  -4.985
    4   HG12  VAL  73          HG11      VAL  73   7.501 -17.093  -6.931
    5   HG11  VAL  73          HG12      VAL  73   6.573 -16.727  -5.476
    6   HG13  VAL  73          HG13      VAL  73   8.231 -17.314  -5.342
    7   HG22  VAL  73          HG21      VAL  73   9.707 -14.207  -6.856
    8   HG21  VAL  73          HG22      VAL  73   8.748 -15.155  -7.992
    9   HG23  VAL  73          HG23      VAL  73   9.871 -15.963  -6.897

  No H/Q in entry =           9
  In of MODEL   75
    1    H    LEU  74           H        LEU  74   7.268 -13.306  -8.620
    2    HA   LEU  74           HA       LEU  74   9.167 -11.312  -8.130
    3    HB2  LEU  74           HB2      LEU  74   8.733 -12.076 -10.367
    4    HB3  LEU  74           HB3      LEU  74   7.053 -11.550 -10.270
    5    HG   LEU  74           HG       LEU  74   7.794  -9.205 -10.071
    6   HD13  LEU  74          HD11      LEU  74   9.904  -9.351  -8.983
    7   HD12  LEU  74          HD12      LEU  74  10.284  -8.826 -10.622
    8   HD11  LEU  74          HD13      LEU  74  10.519 -10.511 -10.160
    9   HD21  LEU  74          HD21      LEU  74   7.609 -10.649 -12.284
   10   HD23  LEU  74          HD22      LEU  74   9.316 -10.280 -12.362
   11   HD22  LEU  74          HD23      LEU  74   8.154  -8.973 -12.327

  No H/Q in entry =          11
  In of MODEL   75
    1    H    VAL  75           H        VAL  75   5.664 -11.008  -8.490
    2    HA   VAL  75           HA       VAL  75   5.504  -8.253  -7.911
    3    HB   VAL  75           HB       VAL  75   3.464 -10.444  -7.524
    4   HG13  VAL  75          HG11      VAL  75   2.925  -8.545  -6.049
    5   HG12  VAL  75          HG12      VAL  75   1.848  -8.523  -7.437
    6   HG11  VAL  75          HG13      VAL  75   3.209  -7.416  -7.368
    7   HG21  VAL  75          HG21      VAL  75   4.322  -9.910  -9.852
    8   HG23  VAL  75          HG22      VAL  75   3.703  -8.274  -9.631
    9   HG22  VAL  75          HG23      VAL  75   2.593  -9.646  -9.637

  No H/Q in entry =           9
  In of MODEL   75
    1    H    GLU  76           H        GLU  76   5.312 -11.129  -5.794
    2    HA   GLU  76           HA       GLU  76   4.807  -9.772  -3.377
    3    HB2  GLU  76           HB2      GLU  76   4.705 -12.254  -3.638
    4    HB3  GLU  76           HB3      GLU  76   6.451 -12.293  -3.810
    5    HG2  GLU  76           HG2      GLU  76   6.720 -11.400  -1.532
    6    HG3  GLU  76           HG3      GLU  76   4.979 -11.317  -1.330

  No H/Q in entry =           6
  In of MODEL   75
    1    H    ALA  77           H        ALA  77   7.889 -10.614  -4.932
    2    HA   ALA  77           HA       ALA  77   9.551  -9.526  -2.916
    3    HB1  ALA  77           HB1      ALA  77  10.305 -11.068  -4.739
    4    HB2  ALA  77           HB2      ALA  77  11.330  -9.646  -4.545
    5    HB3  ALA  77           HB3      ALA  77  10.170  -9.722  -5.871

  No H/Q in entry =           5
  In of MODEL   75
    1    H    GLN  78           H        GLN  78   8.133  -8.149  -5.837
    2    HA   GLN  78           HA       GLN  78   9.429  -5.640  -5.737
    3    HB2  GLN  78           HB2      GLN  78   8.152  -6.596  -7.692
    4    HB3  GLN  78           HB3      GLN  78   6.663  -6.234  -6.822
    5    HG2  GLN  78           HG2      GLN  78   7.286  -3.852  -6.740
    6    HG3  GLN  78           HG3      GLN  78   8.772  -4.209  -7.619
    7   HE21  GLN  78          HE21      GLN  78   6.542  -6.327  -8.870
    8   HE22  GLN  78          HE22      GLN  78   5.976  -5.397 -10.172

  No H/Q in entry =           8
  In of MODEL   75
    1    H    LEU  79           H        LEU  79   6.432  -6.841  -4.310
    2    HA   LEU  79           HA       LEU  79   5.383  -4.453  -3.311
    3    HB2  LEU  79           HB2      LEU  79   4.114  -6.533  -3.252
    4    HB3  LEU  79           HB3      LEU  79   5.272  -7.244  -2.132
    5    HG   LEU  79           HG       LEU  79   4.679  -5.609  -0.411
    6   HD13  LEU  79          HD11      LEU  79   4.172  -3.609  -1.469
    7   HD12  LEU  79          HD12      LEU  79   2.557  -4.169  -1.032
    8   HD11  LEU  79          HD13      LEU  79   3.147  -4.383  -2.678
    9   HD23  LEU  79          HD21      LEU  79   2.104  -6.159  -0.326
   10   HD22  LEU  79          HD22      LEU  79   3.273  -7.472  -0.210
   11   HD21  LEU  79          HD23      LEU  79   2.456  -7.157  -1.738

  No H/Q in entry =          11
  In of MODEL   75
    1    H    HIS  80           H        HIS  80   7.612  -6.735  -1.715
    2    HA   HIS  80           HA       HIS  80   7.860  -5.180   0.650
    3    HB2  HIS  80           HB2      HIS  80   9.253  -7.517  -0.538
    4    HB3  HIS  80           HB3      HIS  80  10.140  -6.597   0.678
    5    HD1  HIS  80           HD1      HIS  80   9.657  -7.237   3.022
    6    HD2  HIS  80           HD2      HIS  80   6.467  -8.165   0.503
    7    HE1  HIS  80           HE1      HIS  80   7.906  -8.374   4.469
    8    HE2  HIS  80           HE2      HIS  80   5.955  -8.944   2.942

  No H/Q in entry =           8
  In of MODEL   75
    1    H    LEU  81           H        LEU  81   9.879  -5.420  -2.256
    2    HA   LEU  81           HA       LEU  81  11.882  -3.633  -1.377
    3    HB2  LEU  81           HB2      LEU  81  10.987  -4.453  -4.140
    4    HB3  LEU  81           HB3      LEU  81  12.384  -3.416  -3.849
    5    HG   LEU  81           HG       LEU  81  12.046  -6.141  -2.568
    6   HD12  LEU  81          HD11      LEU  81  13.881  -6.733  -4.311
    7   HD11  LEU  81          HD12      LEU  81  13.287  -5.324  -5.188
    8   HD13  LEU  81          HD13      LEU  81  12.203  -6.671  -4.850
    9   HD23  LEU  81          HD21      LEU  81  14.667  -5.769  -2.548
   10   HD22  LEU  81          HD22      LEU  81  13.665  -5.026  -1.302
   11   HD21  LEU  81          HD23      LEU  81  14.227  -4.066  -2.671

  No H/Q in entry =          11
  In of MODEL   75
    1    H    MET  82           H        MET  82   8.952  -3.065  -3.324
    2    HA   MET  82           HA       MET  82   9.435  -0.330  -3.832
    3    HB2  MET  82           HB2      MET  82   6.910  -1.977  -3.710
    4    HB3  MET  82           HB3      MET  82   6.874  -0.254  -4.079
    5    HG2  MET  82           HG2      MET  82   8.523  -2.298  -5.603
    6    HG3  MET  82           HG3      MET  82   6.945  -1.710  -6.122
    7    HE3  MET  82           HE1      MET  82   7.323   1.750  -7.303
    8    HE2  MET  82           HE2      MET  82   6.948   1.521  -5.597
    9    HE1  MET  82           HE3      MET  82   6.311   0.394  -6.790

  No H/Q in entry =           9
  In of MODEL   75
    1    H    THR  83           H        THR  83   7.670  -1.958  -1.227
    2    HA   THR  83           HA       THR  83   6.765   0.376   0.090
    3    HB   THR  83           HB       THR  83   6.658  -1.195   2.112
    4    HG1  THR  83           HG1      THR  83   7.456  -3.130   1.890
    5   HG22  THR  83          HG21      THR  83   5.043  -2.800   0.643
    6   HG21  THR  83          HG22      THR  83   5.245  -1.470  -0.492
    7   HG23  THR  83          HG23      THR  83   4.593  -1.164   1.118

  No H/Q in entry =           7
  In of MODEL   75
    1    H    SER  84           H        SER  84   9.631  -1.661   0.625
    2    HA   SER  84           HA       SER  84  10.653  -0.202   2.812
    3    HB2  SER  84           HB2      SER  84  11.951  -2.024   0.797
    4    HB3  SER  84           HB3      SER  84  12.878  -1.248   2.079
    5    HG   SER  84           HG       SER  84  10.638  -2.984   2.337

  No H/Q in entry =           5
  In of MODEL   75
    1    H    MET  85           H        MET  85  11.412   0.064  -0.674
    2    HA   MET  85           HA       MET  85  13.368   2.071  -0.423
    3    HB2  MET  85           HB2      MET  85  13.014   0.781  -2.487
    4    HB3  MET  85           HB3      MET  85  11.462   1.586  -2.720
    5    HG2  MET  85           HG2      MET  85  12.586   3.763  -2.866
    6    HG3  MET  85           HG3      MET  85  14.141   2.995  -2.567
    7    HE1  MET  85           HE1      MET  85  11.094   3.338  -4.610
    8    HE3  MET  85           HE2      MET  85  11.120   1.634  -5.056
    9    HE2  MET  85           HE3      MET  85  11.495   2.855  -6.265

  No H/Q in entry =           9
  In of MODEL   75
    1    H    LEU  86           H        LEU  86   9.874   2.332  -0.943
    2    HA   LEU  86           HA       LEU  86   9.753   5.143  -1.134
    3    HB2  LEU  86           HB2      LEU  86   7.945   3.444  -1.710
    4    HB3  LEU  86           HB3      LEU  86   7.612   3.353   0.019
    5    HG   LEU  86           HG       LEU  86   7.399   5.910  -0.042
    6   HD11  LEU  86          HD11      LEU  86   8.192   5.482  -2.740
    7   HD13  LEU  86          HD12      LEU  86   7.722   7.002  -1.985
    8   HD12  LEU  86          HD13      LEU  86   6.509   6.012  -2.791
    9   HD23  LEU  86          HD21      LEU  86   5.298   4.509  -1.707
   10   HD22  LEU  86          HD22      LEU  86   5.079   5.768  -0.495
   11   HD21  LEU  86          HD23      LEU  86   5.510   4.134   0.004

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ALA  87           H        ALA  87   9.323   2.964   1.617
    2    HA   ALA  87           HA       ALA  87   8.730   4.872   3.579
    3    HB1  ALA  87           HB1      ALA  87   9.594   2.068   3.504
    4    HB3  ALA  87           HB2      ALA  87   8.449   2.861   4.584
    5    HB2  ALA  87           HB3      ALA  87  10.176   2.928   4.933

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ARG  88           H        ARG  88  11.844   3.507   2.612
    2    HA   ARG  88           HA       ARG  88  13.420   4.922   4.445
    3    HB2  ARG  88           HB2      ARG  88  14.132   2.959   3.049
    4    HB3  ARG  88           HB3      ARG  88  14.267   4.050   1.674
    5    HG2  ARG  88           HG2      ARG  88  15.708   5.399   3.621
    6    HG3  ARG  88           HG3      ARG  88  16.061   3.718   4.005
    7    HD2  ARG  88           HD2      ARG  88  17.339   3.441   2.163
    8    HD3  ARG  88           HD3      ARG  88  16.188   4.287   1.124
    9    HE   ARG  88           HE       ARG  88  18.557   5.402   2.175
   10   HH21  ARG  88          HH11      ARG  88  18.859   7.626   1.975
   11   HH22  ARG  88          HH12      ARG  88  17.487   8.670   1.825
   12   HH11  ARG  88          HH21      ARG  88  15.205   6.087   1.885
   13   HH12  ARG  88          HH22      ARG  88  15.417   7.796   1.750

  No H/Q in entry =          13
  In of MODEL   75
    1    H    GLU  89           H        GLU  89  12.439   5.791   1.117
    2    HA   GLU  89           HA       GLU  89  13.938   8.181   0.957
    3    HB2  GLU  89           HB2      GLU  89  12.821   7.112  -0.990
    4    HB3  GLU  89           HB3      GLU  89  11.263   7.623  -0.339
    5    HG2  GLU  89           HG2      GLU  89  11.919   9.974  -0.506
    6    HG3  GLU  89           HG3      GLU  89  13.534   9.514  -1.037

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LEU  90           H        LEU  90  10.617   7.608   2.079
    2    HA   LEU  90           HA       LEU  90  10.045  10.332   2.645
    3    HB2  LEU  90           HB2      LEU  90   8.899   7.738   3.677
    4    HB3  LEU  90           HB3      LEU  90   8.235   9.321   4.093
    5    HG   LEU  90           HG       LEU  90   8.679   8.442   1.228
    6   HD12  LEU  90          HD11      LEU  90   6.152   8.062   1.284
    7   HD11  LEU  90          HD12      LEU  90   6.303   8.060   3.042
    8   HD13  LEU  90          HD13      LEU  90   7.148   6.844   2.083
    9   HD22  LEU  90          HD21      LEU  90   8.339  10.743   1.147
   10   HD21  LEU  90          HD22      LEU  90   7.348  10.760   2.604
   11   HD23  LEU  90          HD23      LEU  90   6.666  10.187   1.082

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  91           H        ILE  91  11.356   7.682   4.579
    2    HA   ILE  91           HA       ILE  91  11.462   9.057   7.043
    3    HB   ILE  91           HB       ILE  91  13.066   6.747   5.931
    4   HG12  ILE  91          HG12      ILE  91  11.041   6.880   8.184
    5   HG13  ILE  91          HG13      ILE  91  10.581   6.585   6.508
    6   HG22  ILE  91          HG21      ILE  91  13.533   6.550   8.573
    7   HG21  ILE  91          HG22      ILE  91  13.422   8.307   8.467
    8   HG23  ILE  91          HG23      ILE  91  14.621   7.440   7.508
    9   HD13  ILE  91          HD11      ILE  91  11.626   4.503   6.447
   10   HD12  ILE  91          HD12      ILE  91  11.027   4.555   8.105
   11   HD11  ILE  91          HD13      ILE  91  12.723   4.901   7.770

  No H/Q in entry =          11
  In of MODEL   75
    1    H    THR  92           H        THR  92  13.690   8.925   4.298
    2    HA   THR  92           HA       THR  92  15.823  10.364   5.459
    3    HB   THR  92           HB       THR  92  14.848  10.211   2.596
    4    HG1  THR  92           HG1      THR  92  15.716   8.333   3.009
    5   HG22  THR  92          HG21      THR  92  17.404  10.953   2.307
    6   HG21  THR  92          HG22      THR  92  17.075  11.772   3.833
    7   HG23  THR  92          HG23      THR  92  16.101  12.135   2.409

  No H/Q in entry =           7
  In of MODEL   75
    1    H    GLU  93           H        GLU  93  12.918  11.454   3.719
    2    HA   GLU  93           HA       GLU  93  13.457  14.227   3.827
    3    HB2  GLU  93           HB2      GLU  93  10.781  12.800   3.838
    4    HB3  GLU  93           HB3      GLU  93  11.035  14.504   3.462
    5    HG2  GLU  93           HG2      GLU  93  12.422  12.285   1.944
    6    HG3  GLU  93           HG3      GLU  93  10.863  12.935   1.451

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LEU  94           H        LEU  94  11.752  12.042   6.040
    2    HA   LEU  94           HA       LEU  94  10.899  13.977   7.908
    3    HB2  LEU  94           HB2      LEU  94  11.534  11.035   8.192
    4    HB3  LEU  94           HB3      LEU  94  10.939  12.003   9.538
    5    HG   LEU  94           HG       LEU  94   9.461  12.017   6.906
    6   HD11  LEU  94          HD11      LEU  94   9.583   9.804   8.917
    7   HD13  LEU  94          HD12      LEU  94   9.287   9.731   7.181
    8   HD12  LEU  94          HD13      LEU  94   7.996  10.225   8.275
    9   HD23  LEU  94          HD21      LEU  94   7.529  12.382   8.500
   10   HD22  LEU  94          HD22      LEU  94   8.743  13.661   8.536
   11   HD21  LEU  94          HD23      LEU  94   8.701  12.447   9.814

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  95           H        ILE  95  13.911  12.108   7.684
    2    HA   ILE  95           HA       ILE  95  15.054  13.060  10.098
    3    HB   ILE  95           HB       ILE  95  16.321  12.009   7.556
    4   HG12  ILE  95          HG12      ILE  95  16.043  10.810  10.327
    5   HG13  ILE  95          HG13      ILE  95  14.884  10.525   9.029
    6   HG21  ILE  95          HG21      ILE  95  17.553  12.849  10.199
    7   HG23  ILE  95          HG22      ILE  95  18.009  13.381   8.580
    8   HG22  ILE  95          HG23      ILE  95  18.347  11.729   9.093
    9   HD13  ILE  95          HD11      ILE  95  16.393   9.273   7.774
   10   HD12  ILE  95          HD12      ILE  95  16.871   8.838   9.412
   11   HD11  ILE  95          HD13      ILE  95  17.802  10.034   8.512

  No H/Q in entry =          11
  In of MODEL   75
    1    H    GLU  96           H        GLU  96  15.192  14.287   6.761
    2    HA   GLU  96           HA       GLU  96  16.995  16.403   7.236
    3    HB2  GLU  96           HB2      GLU  96  16.349  15.722   4.977
    4    HB3  GLU  96           HB3      GLU  96  14.695  16.246   5.272
    5    HG2  GLU  96           HG2      GLU  96  15.219  18.385   4.725
    6    HG3  GLU  96           HG3      GLU  96  16.515  18.415   5.910

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LEU  97           H        LEU  97  13.487  16.147   7.658
    2    HA   LEU  97           HA       LEU  97  13.014  18.874   8.291
    3    HB2  LEU  97           HB2      LEU  97  11.546  16.319   8.909
    4    HB3  LEU  97           HB3      LEU  97  11.000  17.858   9.574
    5    HG   LEU  97           HG       LEU  97  11.498  17.443   6.612
    6   HD12  LEU  97          HD11      LEU  97   8.978  17.264   6.488
    7   HD11  LEU  97          HD12      LEU  97   8.972  17.069   8.239
    8   HD13  LEU  97          HD13      LEU  97   9.779  15.875   7.222
    9   HD23  LEU  97          HD21      LEU  97   9.721  19.372   6.635
   10   HD22  LEU  97          HD22      LEU  97  11.394  19.766   7.030
   11   HD21  LEU  97          HD23      LEU  97  10.206  19.575   8.318

  No H/Q in entry =          11
  In of MODEL   75
    1    H    HIS  98           H        HIS  98  13.888  16.070  10.296
    2    HA   HIS  98           HA       HIS  98  13.699  17.335  12.808
    3    HB2  HIS  98           HB2      HIS  98  15.496  15.110  11.817
    4    HB3  HIS  98           HB3      HIS  98  15.480  15.653  13.497
    5    HD1  HIS  98           HD1      HIS  98  13.320  13.972  10.904
    6    HD2  HIS  98           HD2      HIS  98  13.185  14.901  14.966
    7    HE1  HIS  98           HE1      HIS  98  11.317  12.740  11.856
    8    HE2  HIS  98           HE2      HIS  98  11.215  13.297  14.325

  No H/Q in entry =           8
  In of MODEL   75
    1    H    GLU  99           H        GLU  99  16.260  17.264  10.380
    2    HA   GLU  99           HA       GLU  99  18.215  18.639  11.909
    3    HB2  GLU  99           HB2      GLU  99  18.725  17.356   9.845
    4    HB3  GLU  99           HB3      GLU  99  17.892  18.592   8.899
    5    HG2  GLU  99           HG2      GLU  99  19.465  20.296   9.688
    6    HG3  GLU  99           HG3      GLU  99  20.265  19.112  10.716

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LYS 100           H        LYS 100  15.673  19.745   9.684
    2    HA   LYS 100           HA       LYS 100  16.416  22.498   9.822
    3    HB2  LYS 100           HB2      LYS 100  13.811  21.155   9.065
    4    HB3  LYS 100           HB3      LYS 100  14.076  22.899   8.971
    5    HG2  LYS 100           HG2      LYS 100  16.060  22.485   7.510
    6    HG3  LYS 100           HG3      LYS 100  15.681  20.760   7.531
    7    HD2  LYS 100           HD2      LYS 100  13.478  21.224   6.525
    8    HD3  LYS 100           HD3      LYS 100  13.841  22.950   6.510
    9    HE2  LYS 100           HE2      LYS 100  15.812  22.504   5.056
   10    HE3  LYS 100           HE3      LYS 100  15.380  20.791   5.027
   11    HZ1  LYS 100           HZ1      LYS 100  13.515  22.945   4.182
   12    HZ3  LYS 100           HZ2      LYS 100  13.364  21.271   3.924
   13    HZ2  LYS 100           HZ3      LYS 100  14.559  22.155   3.103

  No H/Q in entry =          13
  In of MODEL   75
    1    H    LEU 101           H        LEU 101  14.355  20.416  11.789
    2    HA   LEU 101           HA       LEU 101  13.145  22.465  13.359
    3    HB2  LEU 101           HB2      LEU 101  13.644  19.526  13.752
    4    HB3  LEU 101           HB3      LEU 101  13.086  20.499  15.109
    5    HG   LEU 101           HG       LEU 101  11.672  20.553  12.436
    6   HD12  LEU 101          HD11      LEU 101  10.041  18.960  13.706
    7   HD11  LEU 101          HD12      LEU 101  11.441  18.577  14.705
    8   HD13  LEU 101          HD13      LEU 101  11.485  18.267  12.969
    9   HD21  LEU 101          HD21      LEU 101  10.994  21.340  15.285
   10   HD23  LEU 101          HD22      LEU 101   9.740  21.087  14.073
   11   HD22  LEU 101          HD23      LEU 101  10.951  22.345  13.834

  No H/Q in entry =          11
  In of MODEL   75
    1    H    LYS 102           H        LYS 102  16.305  21.918  12.930
    2    HA   LYS 102           HA       LYS 102  18.132  22.827  14.004
    3    HB2  LYS 102           HB2      LYS 102  16.286  24.310  15.130
    4    HB3  LYS 102           HB3      LYS 102  16.511  23.255  16.510
    5    HG2  LYS 102           HG2      LYS 102  18.367  25.299  15.339
    6    HG3  LYS 102           HG3      LYS 102  17.988  24.982  17.018
    7    HD2  LYS 102           HD2      LYS 102  19.695  23.098  15.341
    8    HD3  LYS 102           HD3      LYS 102  20.357  24.435  16.272
    9    HE2  LYS 102           HE2      LYS 102  20.006  21.882  17.247
   10    HE3  LYS 102           HE3      LYS 102  20.194  23.330  18.234
   11    HZ2  LYS 102           HZ1      LYS 102  18.249  22.010  18.852
   12    HZ1  LYS 102           HZ2      LYS 102  17.604  22.224  17.301
   13    HZ3  LYS 102           HZ3      LYS 102  17.807  23.560  18.324

  No H/Q in entry =          13
  In of MODEL   75
    1    H    ALA 103           H        ALA 103  16.086  21.188  16.426
    2    HA   ALA 103           HA       ALA 103  17.833  20.016  18.088
    3    HB2  ALA 103           HB1      ALA 103  16.288  17.978  18.084
    4    HB1  ALA 103           HB2      ALA 103  15.378  18.811  16.823
    5    HB3  ALA 103           HB3      ALA 103  15.539  19.539  18.420

  No H/Q in entry =           5
  In of MODEL   75
    1    H1   ALA   1           H3       ALA   1  -1.491  -7.320 -21.502
    2    H2   ALA   1           H2       ALA   1  -2.260  -8.769 -21.047
    3    H3   ALA   1           H1       ALA   1  -0.650  -8.790 -21.598
    4    HA   ALA   1           HA       ALA   1  -1.470  -9.280 -23.595
    5    HB1  ALA   1           HB1      ALA   1  -3.594 -10.037 -23.124
    6    HB2  ALA   1           HB2      ALA   1  -4.060  -8.537 -23.927
    7    HB3  ALA   1           HB3      ALA   1  -4.002  -8.612 -22.168

  No H/Q in entry =           7
  In of MODEL   75
    1    H    GLU   2           H        GLU   2  -2.318  -8.111 -25.589
    2    HA   GLU   2           HA       GLU   2  -0.955  -6.073 -26.469
    3    HB2  GLU   2           HB2      GLU   2  -3.960  -6.197 -26.793
    4    HB3  GLU   2           HB3      GLU   2  -2.853  -5.316 -27.842
    5    HG2  GLU   2           HG2      GLU   2  -2.312  -7.199 -28.991
    6    HG3  GLU   2           HG3      GLU   2  -2.001  -8.095 -27.511

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLU   3           H        GLU   3  -4.141  -4.874 -25.579
    2    HA   GLU   3           HA       GLU   3  -3.144  -2.297 -24.955
    3    HB2  GLU   3           HB2      GLU   3  -5.808  -3.661 -24.626
    4    HB3  GLU   3           HB3      GLU   3  -5.541  -2.039 -23.983
    5    HG2  GLU   3           HG2      GLU   3  -5.198  -1.111 -26.110
    6    HG3  GLU   3           HG3      GLU   3  -4.772  -2.660 -26.830

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LEU   4           H        LEU   4  -4.695  -4.680 -22.773
    2    HA   LEU   4           HA       LEU   4  -4.359  -3.439 -20.384
    3    HB2  LEU   4           HB2      LEU   4  -3.760  -6.371 -20.845
    4    HB3  LEU   4           HB3      LEU   4  -4.184  -5.629 -19.304
    5    HG   LEU   4           HG       LEU   4  -5.949  -5.741 -21.772
    6   HD13  LEU   4          HD11      LEU   4  -7.112  -7.479 -20.773
    7   HD12  LEU   4          HD12      LEU   4  -6.640  -7.006 -19.141
    8   HD11  LEU   4          HD13      LEU   4  -5.486  -7.830 -20.188
    9   HD23  LEU   4          HD21      LEU   4  -7.653  -4.957 -19.910
   10   HD22  LEU   4          HD22      LEU   4  -6.634  -3.769 -20.721
   11   HD21  LEU   4          HD23      LEU   4  -6.201  -4.347 -19.113

  No H/Q in entry =          11
  In of MODEL   75
    1    H    GLU   5           H        GLU   5  -1.823  -5.239 -22.105
    2    HA   GLU   5           HA       GLU   5   0.150  -4.913 -20.064
    3    HB2  GLU   5           HB2      GLU   5   0.252  -6.686 -21.811
    4    HB3  GLU   5           HB3      GLU   5   0.545  -5.440 -23.024
    5    HG2  GLU   5           HG2      GLU   5   2.688  -6.331 -22.384
    6    HG3  GLU   5           HG3      GLU   5   2.559  -4.724 -21.671

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLU   6           H        GLU   6  -0.510  -3.219 -23.114
    2    HA   GLU   6           HA       GLU   6   1.625  -1.347 -22.846
    3    HB2  GLU   6           HB2      GLU   6   0.532  -1.842 -25.011
    4    HB3  GLU   6           HB3      GLU   6  -0.956  -1.109 -24.413
    5    HG2  GLU   6           HG2      GLU   6   0.210   1.035 -24.105
    6    HG3  GLU   6           HG3      GLU   6   1.712   0.309 -24.672

  No H/Q in entry =           6
  In of MODEL   75
    1    H    VAL   7           H        VAL   7  -1.714  -1.478 -21.809
    2    HA   VAL   7           HA       VAL   7  -1.988   1.232 -20.979
    3    HB   VAL   7           HB       VAL   7  -3.405  -1.311 -20.140
    4   HG11  VAL   7          HG11      VAL   7  -3.836   1.572 -19.334
    5   HG13  VAL   7          HG12      VAL   7  -3.712   0.152 -18.295
    6   HG12  VAL   7          HG13      VAL   7  -5.147   0.393 -19.291
    7   HG21  VAL   7          HG21      VAL   7  -3.576  -0.243 -22.531
    8   HG23  VAL   7          HG22      VAL   7  -4.547   0.990 -21.725
    9   HG22  VAL   7          HG23      VAL   7  -5.061  -0.698 -21.695

  No H/Q in entry =           9
  In of MODEL   75
    1    H    VAL   8           H        VAL   8  -0.949  -1.731 -19.327
    2    HA   VAL   8           HA       VAL   8  -0.657  -0.639 -16.733
    3    HB   VAL   8           HB       VAL   8   0.723  -2.953 -18.108
    4   HG12  VAL   8          HG11      VAL   8   1.225  -3.534 -15.599
    5   HG11  VAL   8          HG12      VAL   8   1.046  -1.797 -15.348
    6   HG13  VAL   8          HG13      VAL   8   2.281  -2.407 -16.449
    7   HG21  VAL   8          HG21      VAL   8  -1.850  -2.880 -17.419
    8   HG23  VAL   8          HG22      VAL   8  -1.209  -3.135 -15.799
    9   HG22  VAL   8          HG23      VAL   8  -0.894  -4.318 -17.063

  No H/Q in entry =           9
  In of MODEL   75
    1    H    MET   9           H        MET   9   1.604  -0.904 -19.474
    2    HA   MET   9           HA       MET   9   3.867   0.183 -18.211
    3    HB2  MET   9           HB2      MET   9   2.920   0.132 -21.068
    4    HB3  MET   9           HB3      MET   9   4.383   1.009 -20.621
    5    HG2  MET   9           HG2      MET   9   5.105  -1.168 -19.436
    6    HG3  MET   9           HG3      MET   9   3.819  -1.945 -20.363
    7    HE2  MET   9           HE1      MET   9   3.754  -0.682 -23.243
    8    HE1  MET   9           HE2      MET   9   3.649  -2.322 -22.608
    9    HE3  MET   9           HE3      MET   9   4.784  -1.957 -23.905

  No H/Q in entry =           9
  In of MODEL   75
    1    H    GLY  10           H        GLY  10   1.158   1.733 -19.898
    2    HA3  GLY  10           HA2      GLY  10   2.073   4.404 -19.657
    3    HA2  GLY  10           HA3      GLY  10   0.393   3.913 -19.865

  No H/Q in entry =           3
  In of MODEL   75
    1    H    LEU  11           H        LEU  11   0.016   2.384 -17.576
    2    HA   LEU  11           HA       LEU  11  -0.553   4.355 -15.622
    3    HB2  LEU  11           HB2      LEU  11  -0.433   1.342 -15.459
    4    HB3  LEU  11           HB3      LEU  11  -0.963   2.359 -14.119
    5    HG   LEU  11           HG       LEU  11  -2.198   2.444 -16.885
    6   HD13  LEU  11          HD11      LEU  11  -2.745   0.293 -16.127
    7   HD12  LEU  11          HD12      LEU  11  -4.114   1.262 -15.586
    8   HD11  LEU  11          HD13      LEU  11  -2.852   0.806 -14.442
    9   HD22  LEU  11          HD21      LEU  11  -2.826   4.452 -15.884
   10   HD21  LEU  11          HD22      LEU  11  -2.742   3.791 -14.252
   11   HD23  LEU  11          HD23      LEU  11  -4.109   3.398 -15.296

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  12           H        ILE  12   2.033   1.934 -15.854
    2    HA   ILE  12           HA       ILE  12   3.224   2.498 -13.349
    3    HB   ILE  12           HB       ILE  12   4.505   1.477 -15.906
    4   HG12  ILE  12          HG12      ILE  12   2.506   0.213 -14.772
    5   HG13  ILE  12          HG13      ILE  12   3.921  -0.700 -15.253
    6   HG21  ILE  12          HG21      ILE  12   5.463   1.432 -13.026
    7   HG23  ILE  12          HG22      ILE  12   6.234   2.244 -14.387
    8   HG22  ILE  12          HG23      ILE  12   6.191   0.483 -14.320
    9   HD11  ILE  12          HD11      ILE  12   3.447   0.398 -12.471
   10   HD13  ILE  12          HD12      ILE  12   4.733  -0.699 -12.971
   11   HD12  ILE  12          HD13      ILE  12   3.069  -1.243 -12.962

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  13           H        ILE  13   3.809   3.764 -16.608
    2    HA   ILE  13           HA       ILE  13   5.915   5.523 -15.884
    3    HB   ILE  13           HB       ILE  13   3.886   5.571 -18.131
    4   HG12  ILE  13          HG12      ILE  13   5.721   3.741 -17.863
    5   HG13  ILE  13          HG13      ILE  13   5.503   4.502 -19.434
    6   HG21  ILE  13          HG21      ILE  13   6.169   7.445 -17.525
    7   HG23  ILE  13          HG22      ILE  13   4.530   7.842 -18.027
    8   HG22  ILE  13          HG23      ILE  13   5.664   7.163 -19.192
    9   HD13  ILE  13          HD11      ILE  13   7.517   5.661 -19.299
   10   HD12  ILE  13          HD12      ILE  13   7.918   4.258 -18.314
   11   HD11  ILE  13          HD13      ILE  13   7.441   5.765 -17.541

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ASN  14           H        ASN  14   2.401   5.956 -16.158
    2    HA   ASN  14           HA       ASN  14   2.309   8.702 -15.527
    3    HB2  ASN  14           HB2      ASN  14   0.446   7.026 -16.357
    4    HB3  ASN  14           HB3      ASN  14   0.125   6.846 -14.637
    5   HD21  ASN  14          HD21      ASN  14  -1.912   7.963 -16.075
    6   HD22  ASN  14          HD22      ASN  14  -2.004   9.636 -15.812

  No H/Q in entry =           6
  In of MODEL   75
    1    H    SER  15           H        SER  15   2.061   5.825 -13.445
    2    HA   SER  15           HA       SER  15   1.726   7.195 -11.000
    3    HB2  SER  15           HB2      SER  15   2.314   5.122  -9.945
    4    HB3  SER  15           HB3      SER  15   1.489   4.686 -11.437
    5    HG   SER  15           HG       SER  15   3.274   3.863 -12.171

  No H/Q in entry =           5
  In of MODEL   75
    1    H    GLY  16           H        GLY  16   4.624   6.146 -12.752
    2    HA3  GLY  16           HA2      GLY  16   6.532   6.941 -10.820
    3    HA2  GLY  16           HA3      GLY  16   6.842   6.740 -12.543

  No H/Q in entry =           3
  In of MODEL   75
    1    H    GLN  17           H        GLN  17   5.119   8.664 -13.613
    2    HA   GLN  17           HA       GLN  17   6.653  11.035 -13.308
    3    HB2  GLN  17           HB2      GLN  17   5.333  10.512 -15.348
    4    HB3  GLN  17           HB3      GLN  17   3.848  10.738 -14.424
    5    HG2  GLN  17           HG2      GLN  17   4.515  13.070 -13.931
    6    HG3  GLN  17           HG3      GLN  17   5.976  12.844 -14.893
    7   HE21  GLN  17          HE21      GLN  17   5.575  14.105 -16.747
    8   HE22  GLN  17          HE22      GLN  17   4.196  13.944 -17.722

  No H/Q in entry =           8
  In of MODEL   75
    1    H    ALA  18           H        ALA  18   3.570   9.963 -11.961
    2    HA   ALA  18           HA       ALA  18   2.799  12.341 -10.702
    3    HB1  ALA  18           HB1      ALA  18   1.716   9.864 -10.920
    4    HB2  ALA  18           HB2      ALA  18   1.143  11.076  -9.777
    5    HB3  ALA  18           HB3      ALA  18   2.256   9.815  -9.242

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ARG  19           H        ARG  19   4.722   9.617  -9.414
    2    HA   ARG  19           HA       ARG  19   5.228  10.790  -6.893
    3    HB2  ARG  19           HB2      ARG  19   5.688   8.394  -7.414
    4    HB3  ARG  19           HB3      ARG  19   7.037   8.903  -8.434
    5    HG2  ARG  19           HG2      ARG  19   8.133   9.968  -6.512
    6    HG3  ARG  19           HG3      ARG  19   6.763   9.557  -5.482
    7    HD2  ARG  19           HD2      ARG  19   8.555   7.956  -5.118
    8    HD3  ARG  19           HD3      ARG  19   7.197   7.146  -5.904
    9    HE   ARG  19           HE       ARG  19   8.890   7.992  -7.950
   10   HH21  ARG  19          HH11      ARG  19  10.478   6.615  -8.795
   11   HH22  ARG  19          HH12      ARG  19  11.047   5.280  -7.855
   12   HH11  ARG  19          HH21      ARG  19   8.996   5.970  -5.167
   13   HH12  ARG  19          HH22      ARG  19  10.205   4.914  -5.800

  No H/Q in entry =          13
  In of MODEL   75
    1    H    SER  20           H        SER  20   7.050  10.847  -9.939
    2    HA   SER  20           HA       SER  20   9.266  12.308  -9.115
    3    HB2  SER  20           HB2      SER  20   9.319  11.427 -11.317
    4    HB3  SER  20           HB3      SER  20   7.804  12.213 -11.749
    5    HG   SER  20           HG       SER  20  10.256  13.502 -11.116

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LEU  21           H        LEU  21   6.145  13.513 -10.320
    2    HA   LEU  21           HA       LEU  21   6.761  16.272 -10.101
    3    HB2  LEU  21           HB2      LEU  21   4.119  14.801 -10.016
    4    HB3  LEU  21           HB3      LEU  21   4.256  16.556 -10.036
    5    HG   LEU  21           HG       LEU  21   5.484  14.763 -12.151
    6   HD11  LEU  21          HD11      LEU  21   2.978  14.606 -12.052
    7   HD13  LEU  21          HD12      LEU  21   3.583  15.301 -13.557
    8   HD12  LEU  21          HD13      LEU  21   2.905  16.349 -12.313
    9   HD23  LEU  21          HD21      LEU  21   5.212  17.084 -13.401
   10   HD22  LEU  21          HD22      LEU  21   6.593  16.840 -12.338
   11   HD21  LEU  21          HD23      LEU  21   5.201  17.748 -11.770

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ALA  22           H        ALA  22   5.291  13.958  -7.850
    2    HA   ALA  22           HA       ALA  22   4.648  15.759  -5.788
    3    HB3  ALA  22           HB1      ALA  22   3.936  13.351  -5.947
    4    HB2  ALA  22           HB2      ALA  22   4.512  13.839  -4.353
    5    HB1  ALA  22           HB3      ALA  22   5.556  12.898  -5.420

  No H/Q in entry =           5
  In of MODEL   75
    1    H    TYR  23           H        TYR  23   7.623  13.792  -6.217
    2    HA   TYR  23           HA       TYR  23   8.982  14.844  -3.965
    3    HB2  TYR  23           HB2      TYR  23   9.812  12.850  -5.116
    4    HB3  TYR  23           HB3      TYR  23  10.106  13.790  -6.578
    5    HD1  TYR  23           HD1      TYR  23  11.058  13.533  -2.973
    6    HD2  TYR  23           HD2      TYR  23  12.134  14.956  -6.881
    7    HE1  TYR  23           HE1      TYR  23  13.303  14.161  -2.127
    8    HE2  TYR  23           HE2      TYR  23  14.379  15.585  -6.033
    9    HH   TYR  23           HH       TYR  23  15.282  15.015  -2.628

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ALA  24           H        ALA  24   8.781  15.939  -7.334
    2    HA   ALA  24           HA       ALA  24  10.633  18.064  -7.090
    3    HB2  ALA  24           HB1      ALA  24  10.193  18.111  -9.300
    4    HB3  ALA  24           HB2      ALA  24   8.622  18.829  -8.945
    5    HB1  ALA  24           HB3      ALA  24   8.784  17.079  -9.070

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ALA  25           H        ALA  25   7.158  17.808  -6.474
    2    HA   ALA  25           HA       ALA  25   6.619  20.516  -5.912
    3    HB1  ALA  25           HB1      ALA  25   5.001  18.482  -6.111
    4    HB2  ALA  25           HB2      ALA  25   4.604  19.766  -4.966
    5    HB3  ALA  25           HB3      ALA  25   5.325  18.261  -4.391

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LEU  26           H        LEU  26   7.741  17.865  -3.854
    2    HA   LEU  26           HA       LEU  26   7.812  19.304  -1.420
    3    HB2  LEU  26           HB2      LEU  26   7.959  16.890  -1.409
    4    HB3  LEU  26           HB3      LEU  26   9.430  16.927  -2.377
    5    HG   LEU  26           HG       LEU  26  10.618  18.076  -0.538
    6   HD12  LEU  26          HD11      LEU  26   9.388  18.063   1.720
    7   HD11  LEU  26          HD12      LEU  26   7.905  17.890   0.783
    8   HD13  LEU  26          HD13      LEU  26   8.919  19.318   0.572
    9   HD21  LEU  26          HD21      LEU  26   9.137  15.577   0.339
   10   HD23  LEU  26          HD22      LEU  26  10.638  16.175   1.037
   11   HD22  LEU  26          HD23      LEU  26  10.608  15.611  -0.632

  No H/Q in entry =          11
  In of MODEL   75
    1    H    LYS  27           H        LYS  27  10.244  18.778  -3.940
    2    HA   LYS  27           HA       LYS  27  12.398  20.070  -2.712
    3    HB2  LYS  27           HB2      LYS  27  12.533  18.720  -4.798
    4    HB3  LYS  27           HB3      LYS  27  11.740  20.033  -5.668
    5    HG2  LYS  27           HG2      LYS  27  13.571  21.561  -5.092
    6    HG3  LYS  27           HG3      LYS  27  14.358  20.288  -4.150
    7    HD2  LYS  27           HD2      LYS  27  14.536  18.899  -6.201
    8    HD3  LYS  27           HD3      LYS  27  13.793  20.198  -7.134
    9    HE2  LYS  27           HE2      LYS  27  15.646  21.708  -6.522
   10    HE3  LYS  27           HE3      LYS  27  16.393  20.412  -5.580
   11    HZ3  LYS  27           HZ1      LYS  27  17.384  20.529  -7.765
   12    HZ2  LYS  27           HZ2      LYS  27  15.861  20.374  -8.508
   13    HZ1  LYS  27           HZ3      LYS  27  16.512  19.080  -7.619

  No H/Q in entry =          13
  In of MODEL   75
    1    H    GLN  28           H        GLN  28   9.749  21.388  -4.668
    2    HA   GLN  28           HA       GLN  28  10.648  24.061  -4.827
    3    HB2  GLN  28           HB2      GLN  28   7.841  22.925  -4.718
    4    HB3  GLN  28           HB3      GLN  28   8.214  24.607  -5.093
    5    HG2  GLN  28           HG2      GLN  28   9.266  22.217  -6.634
    6    HG3  GLN  28           HG3      GLN  28   7.912  23.225  -7.143
    7   HE21  GLN  28          HE21      GLN  28  11.074  22.794  -7.845
    8   HE22  GLN  28          HE22      GLN  28  11.525  24.387  -8.221

  No H/Q in entry =           8
  In of MODEL   75
    1    H    ALA  29           H        ALA  29   8.751  22.332  -2.389
    2    HA   ALA  29           HA       ALA  29   8.150  24.515  -0.714
    3    HB2  ALA  29           HB1      ALA  29   7.454  22.934   0.858
    4    HB1  ALA  29           HB2      ALA  29   8.703  21.777   0.398
    5    HB3  ALA  29           HB3      ALA  29   7.312  22.036  -0.654

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LYS  30           H        LYS  30  10.931  22.310  -0.773
    2    HA   LYS  30           HA       LYS  30  12.224  23.300   1.529
    3    HB2  LYS  30           HB2      LYS  30  13.353  22.033  -0.976
    4    HB3  LYS  30           HB3      LYS  30  14.325  22.418   0.446
    5    HG2  LYS  30           HG2      LYS  30  12.802  21.004   1.827
    6    HG3  LYS  30           HG3      LYS  30  11.929  20.558   0.357
    7    HD2  LYS  30           HD2      LYS  30  13.997  19.616  -0.599
    8    HD3  LYS  30           HD3      LYS  30  14.889  20.076   0.853
    9    HE2  LYS  30           HE2      LYS  30  13.415  18.614   2.209
   10    HE3  LYS  30           HE3      LYS  30  12.554  18.135   0.741
   11    HZ2  LYS  30           HZ1      LYS  30  14.380  16.600   1.509
   12    HZ1  LYS  30           HZ2      LYS  30  15.490  17.812   1.056
   13    HZ3  LYS  30           HZ3      LYS  30  14.472  17.102  -0.109

  No H/Q in entry =          13
  In of MODEL   75
    1    H    GLN  31           H        GLN  31  12.092  24.494  -1.771
    2    HA   GLN  31           HA       GLN  31  14.200  26.437  -1.351
    3    HB2  GLN  31           HB2      GLN  31  12.160  26.431  -3.579
    4    HB3  GLN  31           HB3      GLN  31  13.763  27.163  -3.579
    5    HG2  GLN  31           HG2      GLN  31  14.287  24.480  -2.996
    6    HG3  GLN  31           HG3      GLN  31  12.986  24.393  -4.177
    7   HE21  GLN  31          HE21      GLN  31  15.847  23.665  -4.575
    8   HE22  GLN  31          HE22      GLN  31  16.399  24.647  -5.843

  No H/Q in entry =           8
  In of MODEL   75
    1    H    GLY  32           H        GLY  32  11.129  26.187  -0.210
    2    HA3  GLY  32           HA2      GLY  32   9.935  27.731   1.058
    3    HA2  GLY  32           HA3      GLY  32  11.033  28.991   0.506

  No H/Q in entry =           3
  In of MODEL   75
    1    H    ASP  33           H        ASP  33   9.716  27.049  -1.983
    2    HA   ASP  33           HA       ASP  33   8.001  29.281  -2.847
    3    HB2  ASP  33           HB2      ASP  33   9.152  26.884  -4.281
    4    HB3  ASP  33           HB3      ASP  33   7.976  27.971  -5.016

  No H/Q in entry =           4
  In of MODEL   75
    1    H    PHE  34           H        PHE  34   6.322  28.771  -1.284
    2    HA   PHE  34           HA       PHE  34   4.999  26.268  -1.184
    3    HB2  PHE  34           HB2      PHE  34   3.974  29.034  -0.513
    4    HB3  PHE  34           HB3      PHE  34   3.159  27.525  -0.099
    5    HD1  PHE  34           HD1      PHE  34   5.351  29.978   1.112
    6    HD2  PHE  34           HD2      PHE  34   4.769  25.722   1.069
    7    HE1  PHE  34           HE1      PHE  34   6.744  29.765   3.151
    8    HE2  PHE  34           HE2      PHE  34   6.164  25.513   3.106
    9    HZ   PHE  34           HZ       PHE  34   7.146  27.535   4.147

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ALA  35           H        ALA  35   4.506  29.116  -3.203
    2    HA   ALA  35           HA       ALA  35   1.971  28.440  -4.230
    3    HB3  ALA  35           HB1      ALA  35   2.993  29.851  -6.270
    4    HB2  ALA  35           HB2      ALA  35   4.201  30.243  -5.045
    5    HB1  ALA  35           HB3      ALA  35   2.501  30.614  -4.758

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ALA  36           H        ALA  36   5.216  27.838  -5.578
    2    HA   ALA  36           HA       ALA  36   4.264  26.381  -7.819
    3    HB3  ALA  36           HB1      ALA  36   6.420  26.553  -8.432
    4    HB2  ALA  36           HB2      ALA  36   6.923  25.539  -7.079
    5    HB1  ALA  36           HB3      ALA  36   6.777  27.285  -6.868

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ALA  37           H        ALA  37   5.238  25.417  -4.561
    2    HA   ALA  37           HA       ALA  37   5.244  22.627  -4.982
    3    HB2  ALA  37           HB1      ALA  37   4.939  24.418  -2.609
    4    HB1  ALA  37           HB2      ALA  37   6.102  23.126  -2.896
    5    HB3  ALA  37           HB3      ALA  37   4.449  22.735  -2.427

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LYS  38           H        LYS  38   2.659  24.779  -3.824
    2    HA   LYS  38           HA       LYS  38   0.602  22.918  -3.599
    3    HB2  LYS  38           HB2      LYS  38   0.890  25.682  -3.355
    4    HB3  LYS  38           HB3      LYS  38  -0.304  25.504  -4.635
    5    HG2  LYS  38           HG2      LYS  38  -1.725  24.151  -3.190
    6    HG3  LYS  38           HG3      LYS  38  -0.481  24.123  -1.932
    7    HD2  LYS  38           HD2      LYS  38  -0.722  26.456  -1.491
    8    HD3  LYS  38           HD3      LYS  38  -1.638  26.720  -2.976
    9    HE2  LYS  38           HE2      LYS  38  -3.145  26.724  -1.038
   10    HE3  LYS  38           HE3      LYS  38  -3.485  25.337  -2.077
   11    HZ3  LYS  38           HZ1      LYS  38  -2.728  23.887  -0.539
   12    HZ2  LYS  38           HZ2      LYS  38  -3.109  25.139   0.546
   13    HZ1  LYS  38           HZ3      LYS  38  -1.509  24.924   0.024

  No H/Q in entry =          13
  In of MODEL   75
    1    H    ALA  39           H        ALA  39   1.541  24.835  -6.451
    2    HA   ALA  39           HA       ALA  39  -0.511  23.916  -8.155
    3    HB2  ALA  39           HB1      ALA  39   2.211  24.625  -9.206
    4    HB1  ALA  39           HB2      ALA  39   1.214  25.865  -8.446
    5    HB3  ALA  39           HB3      ALA  39   0.623  25.010  -9.871

  No H/Q in entry =           5
  In of MODEL   75
    1    H    MET  40           H        MET  40   2.755  22.694  -7.567
    2    HA   MET  40           HA       MET  40   2.707  20.667  -9.554
    3    HB2  MET  40           HB2      MET  40   4.310  20.935  -7.004
    4    HB3  MET  40           HB3      MET  40   4.591  19.682  -8.214
    5    HG2  MET  40           HG2      MET  40   4.581  22.637  -8.887
    6    HG3  MET  40           HG3      MET  40   6.047  21.769  -8.434
    7    HE3  MET  40           HE1      MET  40   6.975  19.567 -11.236
    8    HE2  MET  40           HE2      MET  40   6.416  19.239  -9.598
    9    HE1  MET  40           HE3      MET  40   7.480  20.611  -9.900

  No H/Q in entry =           9
  In of MODEL   75
    1    H    MET  41           H        MET  41   1.787  20.697  -6.131
    2    HA   MET  41           HA       MET  41   1.319  17.921  -5.847
    3    HB2  MET  41           HB2      MET  41  -0.071  20.250  -4.504
    4    HB3  MET  41           HB3      MET  41  -0.188  18.570  -3.992
    5    HG2  MET  41           HG2      MET  41   2.517  18.857  -4.026
    6    HG3  MET  41           HG3      MET  41   2.037  20.505  -3.635
    7    HE2  MET  41           HE1      MET  41  -0.975  19.186  -1.910
    8    HE1  MET  41           HE2      MET  41  -0.193  20.717  -2.290
    9    HE3  MET  41           HE3      MET  41  -0.241  20.149  -0.621

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ASP  42           H        ASP  42  -0.782  20.594  -6.831
    2    HA   ASP  42           HA       ASP  42  -3.189  19.176  -6.967
    3    HB2  ASP  42           HB2      ASP  42  -2.543  21.762  -7.229
    4    HB3  ASP  42           HB3      ASP  42  -2.682  21.359  -8.937

  No H/Q in entry =           4
  In of MODEL   75
    1    H    GLN  43           H        GLN  43  -0.760  19.818  -9.467
    2    HA   GLN  43           HA       GLN  43  -2.112  18.461 -11.555
    3    HB2  GLN  43           HB2      GLN  43   0.832  19.048 -11.170
    4    HB3  GLN  43           HB3      GLN  43   0.136  18.387 -12.652
    5    HG2  GLN  43           HG2      GLN  43  -1.423  20.378 -12.701
    6    HG3  GLN  43           HG3      GLN  43  -0.488  21.060 -11.374
    7   HE21  GLN  43          HE21      GLN  43  -0.362  22.678 -13.464
    8   HE22  GLN  43          HE22      GLN  43   1.059  22.489 -14.369

  No H/Q in entry =           8
  In of MODEL   75
    1    H    SER  44           H        SER  44   0.261  17.383  -9.158
    2    HA   SER  44           HA       SER  44   0.660  14.782 -10.176
    3    HB2  SER  44           HB2      SER  44   1.517  16.248  -7.942
    4    HB3  SER  44           HB3      SER  44   0.687  14.846  -7.269
    5    HG   SER  44           HG       SER  44   2.813  14.276  -7.691

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ARG  45           H        ARG  45  -1.694  16.051  -7.845
    2    HA   ARG  45           HA       ARG  45  -3.024  13.659  -7.205
    3    HB2  ARG  45           HB2      ARG  45  -3.277  15.825  -6.020
    4    HB3  ARG  45           HB3      ARG  45  -4.146  16.468  -7.409
    5    HG2  ARG  45           HG2      ARG  45  -5.871  14.700  -7.124
    6    HG3  ARG  45           HG3      ARG  45  -5.014  14.113  -5.698
    7    HD2  ARG  45           HD2      ARG  45  -5.277  16.376  -4.648
    8    HD3  ARG  45           HD3      ARG  45  -6.274  16.869  -6.034
    9    HE   ARG  45           HE       ARG  45  -7.328  14.469  -4.989
   10   HH21  ARG  45          HH11      ARG  45  -9.167  14.504  -3.721
   11   HH22  ARG  45          HH12      ARG  45  -9.598  15.936  -2.856
   12   HH11  ARG  45          HH21      ARG  45  -6.862  17.731  -3.973
   13   HH12  ARG  45          HH22      ARG  45  -8.288  17.763  -2.997

  No H/Q in entry =          13
  In of MODEL   75
    1    H    MET  46           H        MET  46  -3.663  16.042  -9.763
    2    HA   MET  46           HA       MET  46  -5.972  14.810 -10.825
    3    HB2  MET  46           HB2      MET  46  -3.914  16.686 -11.999
    4    HB3  MET  46           HB3      MET  46  -5.277  16.092 -12.952
    5    HG2  MET  46           HG2      MET  46  -6.853  16.989 -11.310
    6    HG3  MET  46           HG3      MET  46  -5.524  17.520 -10.287
    7    HE3  MET  46           HE1      MET  46  -5.882  18.007 -14.450
    8    HE2  MET  46           HE2      MET  46  -7.154  19.188 -14.153
    9    HE1  MET  46           HE3      MET  46  -7.295  17.564 -13.483

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ALA  47           H        ALA  47  -2.531  14.413 -11.577
    2    HA   ALA  47           HA       ALA  47  -2.830  12.672 -13.783
    3    HB3  ALA  47           HB1      ALA  47  -0.676  13.616 -13.430
    4    HB2  ALA  47           HB2      ALA  47  -0.493  11.892 -13.092
    5    HB1  ALA  47           HB3      ALA  47  -0.616  13.045 -11.762

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LEU  48           H        LEU  48  -2.551  12.052 -10.307
    2    HA   LEU  48           HA       LEU  48  -2.575   9.210 -10.458
    3    HB2  LEU  48           HB2      LEU  48  -3.389  11.115  -8.251
    4    HB3  LEU  48           HB3      LEU  48  -3.253   9.367  -8.045
    5    HG   LEU  48           HG       LEU  48  -0.995  11.120  -9.044
    6   HD13  LEU  48          HD11      LEU  48  -1.299  11.889  -6.855
    7   HD12  LEU  48          HD12      LEU  48  -0.105  10.611  -6.652
    8   HD11  LEU  48          HD13      LEU  48  -1.796  10.308  -6.256
    9   HD22  LEU  48          HD21      LEU  48  -0.441   8.946  -9.678
   10   HD21  LEU  48          HD22      LEU  48  -1.295   8.213  -8.321
   11   HD23  LEU  48          HD23      LEU  48   0.258   9.006  -8.061

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ASN  49           H        ASN  49  -5.099  11.642 -10.067
    2    HA   ASN  49           HA       ASN  49  -7.244   9.926  -9.526
    3    HB2  ASN  49           HB2      ASN  49  -7.382  12.335  -9.200
    4    HB3  ASN  49           HB3      ASN  49  -7.186  12.614 -10.925
    5   HD21  ASN  49          HD21      ASN  49  -9.389  11.027  -8.587
    6   HD22  ASN  49          HD22      ASN  49 -10.788  11.257  -9.518

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLU  50           H        GLU  50  -5.990  11.145 -12.615
    2    HA   GLU  50           HA       GLU  50  -7.910   9.838 -14.260
    3    HB2  GLU  50           HB2      GLU  50  -6.488  11.690 -15.077
    4    HB3  GLU  50           HB3      GLU  50  -5.068  10.653 -14.934
    5    HG2  GLU  50           HG2      GLU  50  -6.001   9.090 -16.568
    6    HG3  GLU  50           HG3      GLU  50  -7.485  10.032 -16.661

  No H/Q in entry =           6
  In of MODEL   75
    1    H    ALA  51           H        ALA  51  -4.718   8.927 -13.047
    2    HA   ALA  51           HA       ALA  51  -4.515   6.475 -14.458
    3    HB2  ALA  51           HB1      ALA  51  -2.530   6.239 -13.354
    4    HB1  ALA  51           HB2      ALA  51  -3.231   6.648 -11.789
    5    HB3  ALA  51           HB3      ALA  51  -2.805   7.927 -12.926

  No H/Q in entry =           5
  In of MODEL   75
    1    H    HIS  52           H        HIS  52  -5.714   7.286 -11.213
    2    HA   HIS  52           HA       HIS  52  -6.336   4.662 -10.376
    3    HB2  HIS  52           HB2      HIS  52  -6.249   6.601  -8.853
    4    HB3  HIS  52           HB3      HIS  52  -7.691   7.263  -9.624
    5    HD1  HIS  52           HD1      HIS  52  -9.902   5.723  -9.445
    6    HD2  HIS  52           HD2      HIS  52  -6.777   4.713  -6.878
    7    HE1  HIS  52           HE1      HIS  52 -10.897   4.231  -7.656
    8    HE2  HIS  52           HE2      HIS  52  -9.005   3.607  -6.083

  No H/Q in entry =           8
  In of MODEL   75
    1    H    LEU  53           H        LEU  53  -8.213   7.070 -12.174
    2    HA   LEU  53           HA       LEU  53 -10.686   5.718 -12.187
    3    HB2  LEU  53           HB2      LEU  53  -9.453   7.706 -14.088
    4    HB3  LEU  53           HB3      LEU  53 -11.054   7.024 -14.361
    5    HG   LEU  53           HG       LEU  53 -10.281   8.377 -11.756
    6   HD12  LEU  53          HD11      LEU  53 -11.716  10.280 -12.752
    7   HD11  LEU  53          HD12      LEU  53 -11.410   9.516 -14.313
    8   HD13  LEU  53          HD13      LEU  53 -10.067  10.119 -13.345
    9   HD22  LEU  53          HD21      LEU  53 -12.264   7.167 -11.363
   10   HD21  LEU  53          HD22      LEU  53 -12.842   7.404 -13.008
   11   HD23  LEU  53          HD23      LEU  53 -12.903   8.728 -11.861

  No H/Q in entry =          11
  In of MODEL   75
    1    H    VAL  54           H        VAL  54  -7.928   5.581 -14.419
    2    HA   VAL  54           HA       VAL  54  -9.104   3.776 -16.260
    3    HB   VAL  54           HB       VAL  54  -6.210   4.354 -15.573
    4   HG12  VAL  54          HG11      VAL  54  -5.933   3.269 -17.959
    5   HG11  VAL  54          HG12      VAL  54  -7.443   2.453 -17.556
    6   HG13  VAL  54          HG13      VAL  54  -6.023   2.235 -16.534
    7   HG22  VAL  54          HG21      VAL  54  -7.025   6.276 -16.625
    8   HG21  VAL  54          HG22      VAL  54  -8.195   5.382 -17.592
    9   HG23  VAL  54          HG23      VAL  54  -6.486   5.341 -18.020

  No H/Q in entry =           9
  In of MODEL   75
    1    H    GLN  55           H        GLN  55  -7.098   3.286 -13.355
    2    HA   GLN  55           HA       GLN  55  -6.940   0.471 -13.603
    3    HB2  GLN  55           HB2      GLN  55  -5.410   1.408 -12.084
    4    HB3  GLN  55           HB3      GLN  55  -6.650   2.347 -11.259
    5    HG2  GLN  55           HG2      GLN  55  -7.299   0.578  -9.938
    6    HG3  GLN  55           HG3      GLN  55  -7.044  -0.607 -11.213
    7   HE21  GLN  55          HE21      GLN  55  -5.387  -2.016 -10.711
    8   HE22  GLN  55          HE22      GLN  55  -4.013  -1.629  -9.798

  No H/Q in entry =           8
  In of MODEL   75
    1    H    THR  56           H        THR  56  -9.325   2.582 -11.999
    2    HA   THR  56           HA       THR  56 -10.867   0.665 -10.708
    3    HB   THR  56           HB       THR  56 -11.807   3.149 -12.173
    4    HG1  THR  56           HG1      THR  56 -11.278   2.677  -9.428
    5   HG21  THR  56          HG21      THR  56 -13.183   1.403 -10.115
    6   HG23  THR  56          HG22      THR  56 -13.681   1.642 -11.790
    7   HG22  THR  56          HG23      THR  56 -13.771   2.979 -10.642

  No H/Q in entry =           7
  In of MODEL   75
    1    H    LYS  57           H        LYS  57 -11.088   1.734 -14.097
    2    HA   LYS  57           HA       LYS  57 -13.202  -0.006 -14.850
    3    HB2  LYS  57           HB2      LYS  57 -12.370   1.962 -16.171
    4    HB3  LYS  57           HB3      LYS  57 -10.908   1.055 -16.533
    5    HG2  LYS  57           HG2      LYS  57 -12.237  -0.665 -17.678
    6    HG3  LYS  57           HG3      LYS  57 -13.716   0.209 -17.300
    7    HD2  LYS  57           HD2      LYS  57 -12.909   2.141 -18.621
    8    HD3  LYS  57           HD3      LYS  57 -11.438   1.255 -19.016
    9    HE2  LYS  57           HE2      LYS  57 -12.798  -0.500 -20.126
   10    HE3  LYS  57           HE3      LYS  57 -14.269   0.401 -19.756
   11    HZ2  LYS  57           HZ1      LYS  57 -12.095   1.089 -21.617
   12    HZ1  LYS  57           HZ2      LYS  57 -13.070   2.314 -20.954
   13    HZ3  LYS  57           HZ3      LYS  57 -13.771   1.075 -21.884

  No H/Q in entry =          13
  In of MODEL   75
    1    H    LEU  58           H        LEU  58  -9.688  -0.354 -14.785
    2    HA   LEU  58           HA       LEU  58  -9.634  -2.874 -16.066
    3    HB2  LEU  58           HB2      LEU  58  -7.635  -1.529 -14.258
    4    HB3  LEU  58           HB3      LEU  58  -7.336  -3.046 -15.107
    5    HG   LEU  58           HG       LEU  58  -8.148  -0.465 -16.479
    6   HD11  LEU  58          HD11      LEU  58  -5.475  -1.637 -15.779
    7   HD13  LEU  58          HD12      LEU  58  -6.010   0.042 -15.736
    8   HD12  LEU  58          HD13      LEU  58  -5.649  -0.725 -17.279
    9   HD22  LEU  58          HD21      LEU  58  -8.684  -2.044 -18.067
   10   HD21  LEU  58          HD22      LEU  58  -7.615  -3.265 -17.379
   11   HD23  LEU  58          HD23      LEU  58  -6.952  -1.978 -18.387

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  59           H        ILE  59 -10.484  -1.981 -12.820
    2    HA   ILE  59           HA       ILE  59 -10.069  -4.737 -11.863
    3    HB   ILE  59           HB       ILE  59  -9.674  -2.465 -10.467
    4   HG12  ILE  59          HG12      ILE  59 -11.027  -4.816  -9.130
    5   HG13  ILE  59          HG13      ILE  59  -9.386  -4.898  -9.721
    6   HG22  ILE  59          HG21      ILE  59 -12.415  -3.211  -9.503
    7   HG21  ILE  59          HG22      ILE  59 -12.241  -2.015 -10.768
    8   HG23  ILE  59          HG23      ILE  59 -11.506  -1.752  -9.188
    9   HD11  ILE  59          HD11      ILE  59  -8.811  -2.913  -8.344
   10   HD13  ILE  59          HD12      ILE  59  -9.331  -4.283  -7.372
   11   HD12  ILE  59          HD13      ILE  59 -10.440  -2.945  -7.676

  No H/Q in entry =          11
  In of MODEL   75
    1    H    GLU  60           H        GLU  60 -12.680  -2.485 -12.684
    2    HA   GLU  60           HA       GLU  60 -14.830  -4.050 -11.671
    3    HB2  GLU  60           HB2      GLU  60 -15.076  -1.677 -12.286
    4    HB3  GLU  60           HB3      GLU  60 -14.782  -2.079 -13.975
    5    HG2  GLU  60           HG2      GLU  60 -16.796  -3.508 -13.991
    6    HG3  GLU  60           HG3      GLU  60 -17.095  -3.106 -12.312

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLY  61           H        GLY  61 -13.150  -4.004 -14.782
    2    HA3  GLY  61           HA2      GLY  61 -14.807  -6.292 -15.669
    3    HA2  GLY  61           HA3      GLY  61 -13.986  -5.171 -16.749

  No H/Q in entry =           3
  In of MODEL   75
    1    H    ASP  62           H        ASP  62 -12.588  -6.582 -13.857
    2    HA   ASP  62           HA       ASP  62 -10.208  -7.347 -15.134
    3    HB2  ASP  62           HB2      ASP  62  -9.798  -8.600 -13.004
    4    HB3  ASP  62           HB3      ASP  62 -10.279  -6.926 -12.757

  No H/Q in entry =           4
  In of MODEL   75
    1    H    ALA  63           H        ALA  63 -13.233  -8.836 -15.419
    2    HA   ALA  63           HA       ALA  63 -12.319 -11.598 -15.599
    3    HB1  ALA  63           HB1      ALA  63 -14.676 -11.847 -16.645
    4    HB3  ALA  63           HB2      ALA  63 -14.902 -10.150 -16.226
    5    HB2  ALA  63           HB3      ALA  63 -14.598 -11.339 -14.958

  No H/Q in entry =           5
  In of MODEL   75
    1    H    GLY  64           H        GLY  64 -12.768 -12.822 -17.631
    2    HA3  GLY  64           HA2      GLY  64 -13.057 -12.438 -20.135
    3    HA2  GLY  64           HA3      GLY  64 -11.709 -11.325 -19.940

  No H/Q in entry =           3
  In of MODEL   75
    1    H    GLU  65           H        GLU  65  -9.861 -12.515 -18.510
    2    HA   GLU  65           HA       GLU  65  -8.776 -14.452 -20.240
    3    HB2  GLU  65           HB2      GLU  65  -7.996 -13.637 -17.444
    4    HB3  GLU  65           HB3      GLU  65  -7.055 -14.754 -18.433
    5    HG2  GLU  65           HG2      GLU  65  -6.804 -13.051 -20.172
    6    HG3  GLU  65           HG3      GLU  65  -7.808 -11.934 -19.248

  No H/Q in entry =           6
  In of MODEL   75
    1    H    GLY  66           H        GLY  66 -10.430 -14.740 -17.192
    2    HA3  GLY  66           HA2      GLY  66 -11.256 -17.426 -17.671
    3    HA2  GLY  66           HA3      GLY  66 -10.013 -17.346 -16.438

  No H/Q in entry =           3
  In of MODEL   75
    1    H    LYS  67           H        LYS  67 -12.524 -18.364 -15.951
    2    HA   LYS  67           HA       LYS  67 -14.629 -17.021 -15.112
    3    HB2  LYS  67           HB2      LYS  67 -13.176 -19.135 -13.529
    4    HB3  LYS  67           HB3      LYS  67 -14.828 -18.604 -13.190
    5    HG2  LYS  67           HG2      LYS  67 -15.464 -19.153 -15.530
    6    HG3  LYS  67           HG3      LYS  67 -13.830 -19.748 -15.817
    7    HD2  LYS  67           HD2      LYS  67 -15.615 -20.847 -13.633
    8    HD3  LYS  67           HD3      LYS  67 -15.552 -21.532 -15.258
    9    HE2  LYS  67           HE2      LYS  67 -13.013 -21.675 -14.944
   10    HE3  LYS  67           HE3      LYS  67 -13.310 -21.339 -13.237
   11    HZ1  LYS  67           HZ1      LYS  67 -15.092 -23.327 -14.015
   12    HZ3  LYS  67           HZ2      LYS  67 -13.768 -23.470 -12.961
   13    HZ2  LYS  67           HZ3      LYS  67 -13.573 -23.776 -14.620

  No H/Q in entry =          13
  In of MODEL   75
    1    H    MET  68           H        MET  68 -13.284 -17.806 -12.165
    2    HA   MET  68           HA       MET  68 -13.802 -15.320 -10.950
    3    HB2  MET  68           HB2      MET  68 -12.118 -17.608  -9.926
    4    HB3  MET  68           HB3      MET  68 -12.842 -16.326  -8.956
    5    HG2  MET  68           HG2      MET  68 -14.362 -18.339 -10.638
    6    HG3  MET  68           HG3      MET  68 -14.232 -18.354  -8.879
    7    HE1  MET  68           HE1      MET  68 -14.870 -16.749  -7.385
    8    HE3  MET  68           HE2      MET  68 -16.212 -15.616  -7.522
    9    HE2  MET  68           HE3      MET  68 -14.602 -15.131  -8.050

  No H/Q in entry =           9
  In of MODEL   75
    1    H    LYS  69           H        LYS  69 -10.710 -16.729 -12.054
    2    HA   LYS  69           HA       LYS  69  -8.965 -15.002 -10.778
    3    HB2  LYS  69           HB2      LYS  69  -8.677 -16.327 -13.478
    4    HB3  LYS  69           HB3      LYS  69  -7.349 -15.601 -12.570
    5    HG2  LYS  69           HG2      LYS  69  -8.023 -17.113 -10.626
    6    HG3  LYS  69           HG3      LYS  69  -9.068 -17.958 -11.766
    7    HD2  LYS  69           HD2      LYS  69  -6.061 -17.766 -11.760
    8    HD3  LYS  69           HD3      LYS  69  -7.075 -19.209 -11.835
    9    HE2  LYS  69           HE2      LYS  69  -7.913 -18.350 -14.084
   10    HE3  LYS  69           HE3      LYS  69  -6.615 -17.159 -14.013
   11    HZ2  LYS  69           HZ1      LYS  69  -6.364 -19.628 -15.033
   12    HZ1  LYS  69           HZ2      LYS  69  -5.793 -19.868 -13.452
   13    HZ3  LYS  69           HZ3      LYS  69  -5.073 -18.697 -14.452

  No H/Q in entry =          13
  In of MODEL   75
    1    H    VAL  70           H        VAL  70  -7.495 -13.334 -11.688
    2    HA   VAL  70           HA       VAL  70  -8.864 -11.488 -13.561
    3    HB   VAL  70           HB       VAL  70  -8.002  -9.628 -12.132
    4   HG13  VAL  70          HG11      VAL  70  -9.870  -9.673 -10.739
    5   HG12  VAL  70          HG12      VAL  70  -9.680 -11.389 -10.378
    6   HG11  VAL  70          HG13      VAL  70 -10.321 -10.882 -11.941
    7   HG22  VAL  70          HG21      VAL  70  -6.194 -10.581 -10.913
    8   HG21  VAL  70          HG22      VAL  70  -7.157 -11.972 -10.424
    9   HG23  VAL  70          HG23      VAL  70  -7.459 -10.394  -9.700

  No H/Q in entry =           9
  In of MODEL   75
    1    H    SER  71           H        SER  71  -7.324  -9.828 -14.415
    2    HA   SER  71           HA       SER  71  -5.087 -11.013 -15.667
    3    HB2  SER  71           HB2      SER  71  -6.287  -9.024 -16.558
    4    HB3  SER  71           HB3      SER  71  -5.655  -8.070 -15.218
    5    HG   SER  71           HG       SER  71  -4.449  -8.881 -17.525

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LEU  72           H        LEU  72  -3.018 -11.198 -15.070
    2    HA   LEU  72           HA       LEU  72  -2.310 -10.957 -12.357
    3    HB2  LEU  72           HB2      LEU  72  -0.641 -11.357 -14.836
    4    HB3  LEU  72           HB3      LEU  72   0.020 -11.406 -13.205
    5    HG   LEU  72           HG       LEU  72  -2.293 -13.156 -14.098
    6   HD11  LEU  72          HD11      LEU  72  -0.190 -13.585 -15.408
    7   HD13  LEU  72          HD12      LEU  72  -0.683 -14.947 -14.404
    8   HD12  LEU  72          HD13      LEU  72   0.638 -13.900 -13.882
    9   HD23  LEU  72          HD21      LEU  72  -1.269 -14.538 -12.126
   10   HD22  LEU  72          HD22      LEU  72  -2.269 -13.151 -11.725
   11   HD21  LEU  72          HD23      LEU  72  -0.513 -13.017 -11.661

  No H/Q in entry =          11
  In of MODEL   75
    1    H    VAL  73           H        VAL  73  -1.634  -8.934 -15.143
    2    HA   VAL  73           HA       VAL  73   0.245  -7.188 -14.041
    3    HB   VAL  73           HB       VAL  73  -0.127  -5.823 -15.917
    4   HG12  VAL  73          HG11      VAL  73  -1.145  -8.461 -16.954
    5   HG11  VAL  73          HG12      VAL  73   0.481  -8.334 -16.284
    6   HG13  VAL  73          HG13      VAL  73   0.025  -7.362 -17.683
    7   HG22  VAL  73          HG21      VAL  73  -2.453  -5.309 -15.720
    8   HG21  VAL  73          HG22      VAL  73  -2.913  -7.002 -15.888
    9   HG23  VAL  73          HG23      VAL  73  -2.276  -6.120 -17.276

  No H/Q in entry =           9
  In of MODEL   75
    1    H    LEU  74           H        LEU  74  -3.150  -7.380 -13.491
    2    HA   LEU  74           HA       LEU  74  -3.831  -4.737 -12.889
    3    HB2  LEU  74           HB2      LEU  74  -5.522  -6.439 -13.061
    4    HB3  LEU  74           HB3      LEU  74  -4.812  -7.346 -11.729
    5    HG   LEU  74           HG       LEU  74  -5.321  -5.487 -10.185
    6   HD13  LEU  74          HD11      LEU  74  -5.229  -3.549 -11.557
    7   HD12  LEU  74          HD12      LEU  74  -6.934  -3.724 -11.147
    8   HD11  LEU  74          HD13      LEU  74  -6.353  -4.231 -12.733
    9   HD21  LEU  74          HD21      LEU  74  -6.985  -7.357 -11.052
   10   HD23  LEU  74          HD22      LEU  74  -7.837  -5.953 -11.659
   11   HD22  LEU  74          HD23      LEU  74  -7.522  -6.095  -9.947

  No H/Q in entry =          11
  In of MODEL   75
    1    H    VAL  75           H        VAL  75  -2.736  -7.291 -10.716
    2    HA   VAL  75           HA       VAL  75  -2.579  -5.728  -8.377
    3    HB   VAL  75           HB       VAL  75  -1.027  -8.192  -9.156
    4   HG13  VAL  75          HG11      VAL  75   0.211  -6.941  -7.431
    5   HG12  VAL  75          HG12      VAL  75  -0.583  -8.320  -6.686
    6   HG11  VAL  75          HG13      VAL  75  -1.268  -6.714  -6.505
    7   HG21  VAL  75          HG21      VAL  75  -3.557  -8.296  -8.929
    8   HG23  VAL  75          HG22      VAL  75  -3.356  -7.803  -7.247
    9   HG22  VAL  75          HG23      VAL  75  -2.678  -9.334  -7.804

  No H/Q in entry =           9
  In of MODEL   75
    1    H    GLU  76           H        GLU  76  -0.147  -6.442 -10.905
    2    HA   GLU  76           HA       GLU  76   2.004  -5.041  -9.747
    3    HB2  GLU  76           HB2      GLU  76   2.209  -6.528 -11.739
    4    HB3  GLU  76           HB3      GLU  76   1.326  -5.348 -12.695
    5    HG2  GLU  76           HG2      GLU  76   3.105  -3.685 -12.324
    6    HG3  GLU  76           HG3      GLU  76   4.003  -4.826 -11.340

  No H/Q in entry =           6
  In of MODEL   75
    1    H    ALA  77           H        ALA  77  -0.549  -3.905 -11.946
    2    HA   ALA  77           HA       ALA  77   0.381  -1.238 -12.129
    3    HB1  ALA  77           HB1      ALA  77  -1.321  -2.308 -13.640
    4    HB2  ALA  77           HB2      ALA  77  -1.798  -0.720 -13.035
    5    HB3  ALA  77           HB3      ALA  77  -2.491  -2.178 -12.326

  No H/Q in entry =           5
  In of MODEL   75
    1    H    GLN  78           H        GLN  78  -1.857  -2.838  -9.918
    2    HA   GLN  78           HA       GLN  78  -2.721  -0.533  -8.527
    3    HB2  GLN  78           HB2      GLN  78  -3.775  -2.822  -8.438
    4    HB3  GLN  78           HB3      GLN  78  -2.432  -3.341  -7.425
    5    HG2  GLN  78           HG2      GLN  78  -3.002  -1.606  -5.776
    6    HG3  GLN  78           HG3      GLN  78  -4.347  -1.081  -6.787
    7   HE21  GLN  78          HE21      GLN  78  -4.190  -4.375  -7.223
    8   HE22  GLN  78          HE22      GLN  78  -5.277  -4.864  -6.014

  No H/Q in entry =           8
  In of MODEL   75
    1    H    LEU  79           H        LEU  79   0.008  -2.724  -8.062
    2    HA   LEU  79           HA       LEU  79   0.956  -1.796  -5.605
    3    HB2  LEU  79           HB2      LEU  79   1.876  -3.788  -6.664
    4    HB3  LEU  79           HB3      LEU  79   2.503  -2.826  -7.999
    5    HG   LEU  79           HG       LEU  79   4.028  -1.645  -6.495
    6   HD13  LEU  79          HD11      LEU  79   3.012  -1.416  -4.432
    7   HD12  LEU  79          HD12      LEU  79   4.121  -2.739  -4.080
    8   HD11  LEU  79          HD13      LEU  79   2.425  -3.080  -4.413
    9   HD23  LEU  79          HD21      LEU  79   5.287  -3.761  -5.581
   10   HD22  LEU  79          HD22      LEU  79   5.083  -3.572  -7.320
   11   HD21  LEU  79          HD23      LEU  79   4.028  -4.664  -6.427

  No H/Q in entry =          11
  In of MODEL   75
    1    H    HIS  80           H        HIS  80   1.809  -0.670  -8.880
    2    HA   HIS  80           HA       HIS  80   3.566   1.363  -7.960
    3    HB2  HIS  80           HB2      HIS  80   2.300   0.629 -10.544
    4    HB3  HIS  80           HB3      HIS  80   2.855   2.295 -10.377
    5    HD1  HIS  80           HD1      HIS  80   5.250   2.652 -10.894
    6    HD2  HIS  80           HD2      HIS  80   4.522  -1.273  -9.691
    7    HE1  HIS  80           HE1      HIS  80   7.470   1.428 -11.049
    8    HE2  HIS  80           HE2      HIS  80   7.038  -0.967 -10.319

  No H/Q in entry =           8
  In of MODEL   75
    1    H    LEU  81           H        LEU  81   0.161   1.437  -8.949
    2    HA   LEU  81           HA       LEU  81  -0.183   4.223  -8.629
    3    HB2  LEU  81           HB2      LEU  81  -2.142   1.929  -8.548
    4    HB3  LEU  81           HB3      LEU  81  -2.636   3.621  -8.463
    5    HG   LEU  81           HG       LEU  81  -0.909   2.505 -10.690
    6   HD12  LEU  81          HD11      LEU  81  -3.145   2.765 -11.997
    7   HD11  LEU  81          HD12      LEU  81  -3.903   2.684 -10.407
    8   HD13  LEU  81          HD13      LEU  81  -2.925   1.338 -10.987
    9   HD23  LEU  81          HD21      LEU  81  -2.056   4.618 -11.798
   10   HD22  LEU  81          HD22      LEU  81  -0.647   4.827 -10.761
   11   HD21  LEU  81          HD23      LEU  81  -2.261   5.138 -10.127

  No H/Q in entry =          11
  In of MODEL   75
    1    H    MET  82           H        MET  82  -0.782   1.528  -6.373
    2    HA   MET  82           HA       MET  82  -1.879   3.094  -4.294
    3    HB2  MET  82           HB2      MET  82  -0.438   0.443  -4.320
    4    HB3  MET  82           HB3      MET  82  -1.039   1.158  -2.827
    5    HG2  MET  82           HG2      MET  82  -2.752   0.613  -5.271
    6    HG3  MET  82           HG3      MET  82  -2.651  -0.454  -3.872
    7    HE3  MET  82           HE1      MET  82  -4.423   1.161  -1.067
    8    HE2  MET  82           HE2      MET  82  -2.700   1.482  -1.248
    9    HE1  MET  82           HE3      MET  82  -3.347  -0.094  -1.699

  No H/Q in entry =           9
  In of MODEL   75
    1    H    THR  83           H        THR  83   1.450   2.090  -4.971
    2    HA   THR  83           HA       THR  83   2.632   3.232  -2.671
    3    HB   THR  83           HB       THR  83   4.732   3.225  -4.138
    4    HG1  THR  83           HG1      THR  83   4.512   2.686  -6.161
    5   HG22  THR  83          HG21      THR  83   4.357   0.555  -4.462
    6   HG21  THR  83          HG22      THR  83   3.054   0.906  -3.327
    7   HG23  THR  83          HG23      THR  83   4.723   1.293  -2.904

  No H/Q in entry =           7
  In of MODEL   75
    1    H    SER  84           H        SER  84   2.239   4.491  -5.976
    2    HA   SER  84           HA       SER  84   3.515   6.966  -5.525
    3    HB2  SER  84           HB2      SER  84   1.473   6.074  -7.548
    4    HB3  SER  84           HB3      SER  84   2.110   7.719  -7.526
    5    HG   SER  84           HG       SER  84   3.545   5.278  -7.805

  No H/Q in entry =           5
  In of MODEL   75
    1    H    MET  85           H        MET  85   0.041   6.122  -5.361
    2    HA   MET  85           HA       MET  85  -0.887   8.712  -4.771
    3    HB2  MET  85           HB2      MET  85  -2.362   6.862  -5.438
    4    HB3  MET  85           HB3      MET  85  -2.059   6.069  -3.892
    5    HG2  MET  85           HG2      MET  85  -3.015   7.988  -2.695
    6    HG3  MET  85           HG3      MET  85  -3.265   8.831  -4.222
    7    HE1  MET  85           HE1      MET  85  -3.873   5.911  -2.060
    8    HE3  MET  85           HE2      MET  85  -4.023   4.827  -3.440
    9    HE2  MET  85           HE3      MET  85  -5.449   5.238  -2.493

  No H/Q in entry =           9
  In of MODEL   75
    1    H    LEU  86           H        LEU  86   0.092   6.080  -2.616
    2    HA   LEU  86           HA       LEU  86  -0.480   7.377  -0.179
    3    HB2  LEU  86           HB2      LEU  86   0.046   4.917  -0.564
    4    HB3  LEU  86           HB3      LEU  86   1.742   5.388  -0.656
    5    HG   LEU  86           HG       LEU  86   1.382   6.548   1.608
    6   HD11  LEU  86          HD11      LEU  86  -1.291   5.714   1.131
    7   HD13  LEU  86          HD12      LEU  86  -0.648   6.482   2.581
    8   HD12  LEU  86          HD13      LEU  86  -0.695   4.724   2.467
    9   HD23  LEU  86          HD21      LEU  86   1.026   3.546   1.738
   10   HD22  LEU  86          HD22      LEU  86   2.001   4.583   2.778
   11   HD21  LEU  86          HD23      LEU  86   2.514   4.265   1.121

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ALA  87           H        ALA  87   2.512   7.149  -2.060
    2    HA   ALA  87           HA       ALA  87   4.179   8.605  -0.334
    3    HB3  ALA  87           HB1      ALA  87   4.306   7.587  -3.038
    4    HB2  ALA  87           HB2      ALA  87   5.629   7.952  -1.935
    5    HB1  ALA  87           HB3      ALA  87   4.987   9.215  -2.984

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ARG  88           H        ARG  88   2.212   9.686  -3.064
    2    HA   ARG  88           HA       ARG  88   2.923  12.394  -2.953
    3    HB2  ARG  88           HB2      ARG  88   1.701  11.206  -4.810
    4    HB3  ARG  88           HB3      ARG  88   0.238  11.318  -3.831
    5    HG2  ARG  88           HG2      ARG  88   1.197  13.922  -3.753
    6    HG3  ARG  88           HG3      ARG  88   1.637  13.413  -5.381
    7    HD2  ARG  88           HD2      ARG  88  -0.503  13.441  -6.084
    8    HD3  ARG  88           HD3      ARG  88  -1.074  12.579  -4.655
    9    HE   ARG  88           HE       ARG  88  -1.327  15.350  -5.082
   10   HH21  ARG  88          HH11      ARG  88  -1.889  16.672  -3.349
   11   HH22  ARG  88          HH12      ARG  88  -1.585  16.147  -1.729
   12   HH11  ARG  88          HH21      ARG  88  -0.265  13.119  -2.698
   13   HH12  ARG  88          HH22      ARG  88  -0.683  14.129  -1.361

  No H/Q in entry =          13
  In of MODEL   75
    1    H    GLU  89           H        GLU  89   0.254  10.662  -1.315
    2    HA   GLU  89           HA       GLU  89  -0.909  12.951  -0.120
    3    HB2  GLU  89           HB2      GLU  89  -1.975  10.687  -0.203
    4    HB3  GLU  89           HB3      GLU  89  -0.842  10.161   1.043
    5    HG2  GLU  89           HG2      GLU  89  -1.705  11.845   2.595
    6    HG3  GLU  89           HG3      GLU  89  -2.769  12.488   1.347

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LEU  90           H        LEU  90   1.591  10.719   1.067
    2    HA   LEU  90           HA       LEU  90   1.912  11.978   3.594
    3    HB2  LEU  90           HB2      LEU  90   3.729  10.239   1.926
    4    HB3  LEU  90           HB3      LEU  90   4.132  10.770   3.565
    5    HG   LEU  90           HG       LEU  90   1.530   9.364   2.901
    6   HD12  LEU  90          HD11      LEU  90   2.713   7.347   3.918
    7   HD11  LEU  90          HD12      LEU  90   4.216   8.236   3.677
    8   HD13  LEU  90          HD13      LEU  90   3.217   7.802   2.289
    9   HD22  LEU  90          HD21      LEU  90   1.239  10.287   5.019
   10   HD21  LEU  90          HD22      LEU  90   2.958  10.219   5.406
   11   HD23  LEU  90          HD23      LEU  90   1.984   8.750   5.456

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  91           H        ILE  91   3.514  12.387   0.470
    2    HA   ILE  91           HA       ILE  91   5.448  14.264   1.309
    3    HB   ILE  91           HB       ILE  91   4.154  13.737  -1.372
    4   HG12  ILE  91          HG12      ILE  91   6.994  13.315  -0.390
    5   HG13  ILE  91          HG13      ILE  91   5.739  12.090  -0.227
    6   HG22  ILE  91          HG21      ILE  91   6.349  15.131  -2.059
    7   HG21  ILE  91          HG22      ILE  91   6.018  15.929  -0.521
    8   HG23  ILE  91          HG23      ILE  91   4.798  15.927  -1.793
    9   HD13  ILE  91          HD11      ILE  91   5.579  11.757  -2.534
   10   HD12  ILE  91          HD12      ILE  91   7.307  12.038  -2.317
   11   HD11  ILE  91          HD13      ILE  91   6.269  13.337  -2.909

  No H/Q in entry =          11
  In of MODEL   75
    1    H    THR  92           H        THR  92   2.080  14.620   0.292
    2    HA   THR  92           HA       THR  92   1.993  17.442   0.224
    3    HB   THR  92           HB       THR  92  -0.133  15.403   0.923
    4    HG1  THR  92           HG1      THR  92   0.181  15.225  -1.160
    5   HG22  THR  92          HG21      THR  92  -1.578  17.532   0.192
    6   HG21  THR  92          HG22      THR  92  -0.206  18.389   0.890
    7   HG23  THR  92          HG23      THR  92  -1.125  17.250   1.872

  No H/Q in entry =           7
  In of MODEL   75
    1    H    GLU  93           H        GLU  93   1.488  15.138   2.883
    2    HA   GLU  93           HA       GLU  93   0.910  17.035   4.895
    3    HB2  GLU  93           HB2      GLU  93   2.281  14.340   5.141
    4    HB3  GLU  93           HB3      GLU  93   1.567  15.256   6.470
    5    HG2  GLU  93           HG2      GLU  93  -0.022  14.437   4.029
    6    HG3  GLU  93           HG3      GLU  93   0.098  13.420   5.461

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LEU  94           H        LEU  94   3.950  15.615   3.756
    2    HA   LEU  94           HA       LEU  94   5.671  16.805   5.645
    3    HB2  LEU  94           HB2      LEU  94   6.101  15.839   2.818
    4    HB3  LEU  94           HB3      LEU  94   7.413  16.528   3.769
    5    HG   LEU  94           HG       LEU  94   5.718  14.298   4.906
    6   HD11  LEU  94          HD11      LEU  94   7.823  14.111   2.780
    7   HD13  LEU  94          HD12      LEU  94   6.398  13.107   3.041
    8   HD12  LEU  94          HD13      LEU  94   7.826  12.888   4.052
    9   HD23  LEU  94          HD21      LEU  94   7.916  13.812   6.065
   10   HD22  LEU  94          HD22      LEU  94   7.214  15.376   6.476
   11   HD21  LEU  94          HD23      LEU  94   8.558  15.282   5.337

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  95           H        ILE  95   4.515  17.943   2.490
    2    HA   ILE  95           HA       ILE  95   6.036  20.334   2.428
    3    HB   ILE  95           HB       ILE  95   3.411  19.590   1.117
    4   HG12  ILE  95          HG12      ILE  95   6.194  19.984  -0.013
    5   HG13  ILE  95          HG13      ILE  95   5.577  18.419   0.504
    6   HG21  ILE  95          HG21      ILE  95   5.107  22.094   0.895
    7   HG23  ILE  95          HG22      ILE  95   3.383  21.990   1.247
    8   HG22  ILE  95          HG23      ILE  95   3.979  21.598  -0.367
    9   HD13  ILE  95          HD11      ILE  95   4.024  18.305  -1.229
   10   HD12  ILE  95          HD12      ILE  95   5.357  19.150  -2.016
   11   HD11  ILE  95          HD13      ILE  95   3.963  20.056  -1.429

  No H/Q in entry =          11
  In of MODEL   75
    1    H    GLU  96           H        GLU  96   2.799  19.616   3.716
    2    HA   GLU  96           HA       GLU  96   2.120  22.251   4.459
    3    HB2  GLU  96           HB2      GLU  96   0.484  20.433   4.471
    4    HB3  GLU  96           HB3      GLU  96   1.360  19.627   5.771
    5    HG2  GLU  96           HG2      GLU  96   0.308  20.893   7.335
    6    HG3  GLU  96           HG3      GLU  96   0.814  22.376   6.535

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LEU  97           H        LEU  97   4.013  19.745   6.096
    2    HA   LEU  97           HA       LEU  97   4.335  21.107   8.564
    3    HB2  LEU  97           HB2      LEU  97   5.922  18.967   7.159
    4    HB3  LEU  97           HB3      LEU  97   6.493  19.668   8.671
    5    HG   LEU  97           HG       LEU  97   3.708  18.515   8.356
    6   HD12  LEU  97          HD11      LEU  97   4.687  16.526   9.577
    7   HD11  LEU  97          HD12      LEU  97   6.286  17.190   9.235
    8   HD13  LEU  97          HD13      LEU  97   5.229  16.706   7.908
    9   HD23  LEU  97          HD21      LEU  97   4.160  18.237  10.922
   10   HD22  LEU  97          HD22      LEU  97   3.748  19.839  10.312
   11   HD21  LEU  97          HD23      LEU  97   5.428  19.435  10.663

  No H/Q in entry =          11
  In of MODEL   75
    1    H    HIS  98           H        HIS  98   6.213  21.154   5.543
    2    HA   HIS  98           HA       HIS  98   8.331  22.781   6.443
    3    HB2  HIS  98           HB2      HIS  98   7.050  22.491   3.715
    4    HB3  HIS  98           HB3      HIS  98   8.469  23.501   4.006
    5    HD1  HIS  98           HD1      HIS  98   7.332  19.906   4.032
    6    HD2  HIS  98           HD2      HIS  98  10.868  22.077   4.460
    7    HE1  HIS  98           HE1      HIS  98   9.222  18.215   3.985
    8    HE2  HIS  98           HE2      HIS  98  11.380  19.517   4.246

  No H/Q in entry =           8
  In of MODEL   75
    1    H    GLU  99           H        GLU  99   5.096  23.546   5.257
    2    HA   GLU  99           HA       GLU  99   5.417  26.367   5.193
    3    HB2  GLU  99           HB2      GLU  99   3.565  25.157   4.060
    4    HB3  GLU  99           HB3      GLU  99   2.873  24.785   5.639
    5    HG2  GLU  99           HG2      GLU  99   2.642  27.174   6.133
    6    HG3  GLU  99           HG3      GLU  99   3.414  27.586   4.605

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LYS 100           H        LYS 100   4.326  24.116   7.718
    2    HA   LYS 100           HA       LYS 100   3.693  26.163   9.605
    3    HB2  LYS 100           HB2      LYS 100   4.328  23.225   9.960
    4    HB3  LYS 100           HB3      LYS 100   3.855  24.291  11.288
    5    HG2  LYS 100           HG2      LYS 100   1.780  24.883  10.033
    6    HG3  LYS 100           HG3      LYS 100   2.234  23.720   8.785
    7    HD2  LYS 100           HD2      LYS 100   2.189  21.902  10.451
    8    HD3  LYS 100           HD3      LYS 100   1.752  23.060  11.710
    9    HE2  LYS 100           HE2      LYS 100  -0.310  23.636  10.440
   10    HE3  LYS 100           HE3      LYS 100   0.118  22.421   9.229
   11    HZ1  LYS 100           HZ1      LYS 100  -0.142  21.757  12.111
   12    HZ3  LYS 100           HZ2      LYS 100  -0.132  20.699  10.779
   13    HZ2  LYS 100           HZ3      LYS 100  -1.469  21.712  11.052

  No H/Q in entry =          13
  In of MODEL   75
    1    H    LEU 101           H        LEU 101   6.654  24.425   8.783
    2    HA   LEU 101           HA       LEU 101   8.230  25.303  10.988
    3    HB2  LEU 101           HB2      LEU 101   8.851  24.321   8.214
    4    HB3  LEU 101           HB3      LEU 101  10.137  25.015   9.197
    5    HG   LEU 101           HG       LEU 101   8.347  22.825  10.262
    6   HD12  LEU 101          HD11      LEU 101  10.432  21.370   9.663
    7   HD11  LEU 101          HD12      LEU 101  10.776  22.638   8.488
    8   HD13  LEU 101          HD13      LEU 101   9.266  21.734   8.392
    9   HD21  LEU 101          HD21      LEU 101  11.046  23.990  10.994
   10   HD23  LEU 101          HD22      LEU 101  10.533  22.408  11.576
   11   HD22  LEU 101          HD23      LEU 101   9.610  23.847  12.008

  No H/Q in entry =          11
  In of MODEL   75
    1    H    LYS 102           H        LYS 102   6.615  27.129   8.839
    2    HA   LYS 102           HA       LYS 102   6.647  29.422   8.541
    3    HB2  LYS 102           HB2      LYS 102   8.208  29.343  10.643
    4    HB3  LYS 102           HB3      LYS 102   9.507  29.561   9.487
    5    HG2  LYS 102           HG2      LYS 102   7.360  31.473  10.338
    6    HG3  LYS 102           HG3      LYS 102   9.068  31.767  10.090
    7    HD2  LYS 102           HD2      LYS 102   7.131  31.299   7.787
    8    HD3  LYS 102           HD3      LYS 102   7.481  32.888   8.452
    9    HE2  LYS 102           HE2      LYS 102   8.883  31.725   6.385
   10    HE3  LYS 102           HE3      LYS 102   9.470  33.047   7.394
   11    HZ2  LYS 102           HZ1      LYS 102  11.029  31.172   7.228
   12    HZ1  LYS 102           HZ2      LYS 102   9.885  30.169   7.970
   13    HZ3  LYS 102           HZ3      LYS 102  10.549  31.472   8.828

  No H/Q in entry =          13
  In of MODEL   75
    1    H    ALA 103           H        ALA 103   9.931  28.146   7.988
    2    HA   ALA 103           HA       ALA 103  10.873  29.537   5.911
    3    HB2  ALA 103           HB1      ALA 103  11.805  27.338   4.991
    4    HB1  ALA 103           HB2      ALA 103  10.922  26.550   6.297
    5    HB3  ALA 103           HB3      ALA 103  12.187  27.720   6.670

  No H/Q in entry =           5
  In of MODEL   75
    1    H1   LYS   3           H1       LYS   3 -30.836   6.748 -19.512
    2    H2   LYS   3           H3       LYS   3 -29.872   6.416 -20.870
    3    H3   LYS   3           H2       LYS   3 -31.302   5.539 -20.608
    4    HA   LYS   3           HA       LYS   3 -30.346   4.112 -19.210
    5    HB2  LYS   3           HB2      LYS   3 -28.019   5.427 -20.565
    6    HB3  LYS   3           HB3      LYS   3 -27.734   4.208 -19.321
    7    HG2  LYS   3           HG2      LYS   3 -29.231   2.680 -20.656
    8    HG3  LYS   3           HG3      LYS   3 -29.148   3.876 -21.950
    9    HD2  LYS   3           HD2      LYS   3 -26.671   3.659 -21.920
   10    HD3  LYS   3           HD3      LYS   3 -26.834   2.369 -20.730
   11    HE2  LYS   3           HE2      LYS   3 -28.394   1.253 -22.432
   12    HE3  LYS   3           HE3      LYS   3 -27.735   2.402 -23.594
   13    HZ3  LYS   3           HZ1      LYS   3 -25.991   1.100 -23.877
   14    HZ2  LYS   3           HZ2      LYS   3 -26.660  -0.039 -22.809
   15    HZ1  LYS   3           HZ3      LYS   3 -25.615   1.164 -22.222

  No H/Q in entry =          15
  In of MODEL   75
    1    H    LYS   4           H        LYS   4 -30.387   3.976 -17.148
    2    HA   LYS   4           HA       LYS   4 -29.548   6.233 -15.508
    3    HB2  LYS   4           HB2      LYS   4 -30.855   3.594 -14.793
    4    HB3  LYS   4           HB3      LYS   4 -30.569   4.923 -13.672
    5    HG2  LYS   4           HG2      LYS   4 -32.398   4.933 -16.078
    6    HG3  LYS   4           HG3      LYS   4 -32.871   5.007 -14.382
    7    HD2  LYS   4           HD2      LYS   4 -32.080   7.199 -14.127
    8    HD3  LYS   4           HD3      LYS   4 -31.056   7.094 -15.558
    9    HE2  LYS   4           HE2      LYS   4 -32.925   8.548 -16.007
   10    HE3  LYS   4           HE3      LYS   4 -33.077   7.078 -16.971
   11    HZ3  LYS   4           HZ1      LYS   4 -34.676   6.237 -15.409
   12    HZ2  LYS   4           HZ2      LYS   4 -35.172   7.753 -15.992
   13    HZ1  LYS   4           HZ3      LYS   4 -34.507   7.617 -14.435

  No H/Q in entry =          13
  In of MODEL   75
    1    H    HIS   5           H        HIS   5 -28.064   6.258 -13.930
    2    HA   HIS   5           HA       HIS   5 -25.865   4.331 -14.276
    3    HB2  HIS   5           HB2      HIS   5 -25.990   7.097 -13.074
    4    HB3  HIS   5           HB3      HIS   5 -24.552   6.080 -13.067
    5    HD1  HIS   5           HD1      HIS   5 -23.044   7.211 -14.671
    6    HD2  HIS   5           HD2      HIS   5 -26.881   6.753 -16.192
    7    HE1  HIS   5           HE1      HIS   5 -22.872   7.780 -17.125
    8    HE2  HIS   5           HE2      HIS   5 -25.212   7.489 -18.021

  No H/Q in entry =           8
  In of MODEL   75
    1    H    ILE   6           H        ILE   6 -25.693   2.753 -12.958
    2    HA   ILE   6           HA       ILE   6 -26.633   3.068 -10.187
    3    HB   ILE   6           HB       ILE   6 -25.930   0.565 -11.726
    4   HG12  ILE   6          HG12      ILE   6 -28.623   1.622 -10.853
    5   HG13  ILE   6          HG13      ILE   6 -27.987   1.753 -12.493
    6   HG23  ILE   6          HG21      ILE   6 -26.342  -0.667  -9.860
    7   HG22  ILE   6          HG22      ILE   6 -27.443   0.531  -9.174
    8   HG21  ILE   6          HG23      ILE   6 -25.699   0.789  -9.099
    9   HD13  ILE   6          HD11      ILE   6 -28.543  -0.345 -12.985
   10   HD12  ILE   6          HD12      ILE   6 -29.545  -0.281 -11.535
   11   HD11  ILE   6          HD13      ILE   6 -27.919  -0.961 -11.455

  No H/Q in entry =          11
  In of MODEL   75
    1    H    TYR   7           H        TYR   7 -24.837   3.633  -8.916
    2    HA   TYR   7           HA       TYR   7 -22.176   2.556  -9.616
    3    HB2  TYR   7           HB2      TYR   7 -23.018   5.032  -8.133
    4    HB3  TYR   7           HB3      TYR   7 -21.359   4.444  -8.184
    5    HD1  TYR   7           HD1      TYR   7 -22.465   3.542 -11.263
    6    HD2  TYR   7           HD2      TYR   7 -21.618   7.085  -9.050
    7    HE1  TYR   7           HE1      TYR   7 -21.997   4.748 -13.360
    8    HE2  TYR   7           HE2      TYR   7 -21.192   8.298 -11.139
    9    HH   TYR   7           HH       TYR   7 -21.432   8.217 -13.370

  No H/Q in entry =           9
  In of MODEL   75
    1    H    LEU   8           H        LEU   8 -21.260   1.164  -8.293
    2    HA   LEU   8           HA       LEU   8 -22.389   0.725  -5.599
    3    HB2  LEU   8           HB2      LEU   8 -20.778  -1.016  -7.443
    4    HB3  LEU   8           HB3      LEU   8 -20.966  -1.386  -5.730
    5    HG   LEU   8           HG       LEU   8 -23.454  -1.448  -6.131
    6   HD13  LEU   8          HD11      LEU   8 -23.549  -0.232  -8.242
    7   HD12  LEU   8          HD12      LEU   8 -24.154  -1.871  -8.474
    8   HD11  LEU   8          HD13      LEU   8 -22.530  -1.446  -9.013
    9   HD23  LEU   8          HD21      LEU   8 -22.286  -3.547  -7.830
   10   HD22  LEU   8          HD22      LEU   8 -23.369  -3.664  -6.443
   11   HD21  LEU   8          HD23      LEU   8 -21.646  -3.387  -6.196

  No H/Q in entry =          11
  In of MODEL   75
    1    H    PHE   9           H        PHE   9 -21.086   1.086  -3.824
    2    HA   PHE   9           HA       PHE   9 -18.269   1.895  -4.376
    3    HB2  PHE   9           HB2      PHE   9 -20.225   3.055  -2.398
    4    HB3  PHE   9           HB3      PHE   9 -18.500   3.387  -2.370
    5    HD1  PHE   9           HD1      PHE   9 -17.426   4.654  -4.163
    6    HD2  PHE   9           HD2      PHE   9 -21.660   3.957  -4.163
    7    HE1  PHE   9           HE1      PHE   9 -17.710   6.374  -5.921
    8    HE2  PHE   9           HE2      PHE   9 -21.944   5.690  -5.917
    9    HZ   PHE   9           HZ       PHE   9 -19.967   6.894  -6.802

  No H/Q in entry =           9
  In of MODEL   75
    1    H    SER  10           H        SER  10 -16.714   0.845  -3.313
    2    HA   SER  10           HA       SER  10 -16.913  -0.049  -0.614
    3    HB2  SER  10           HB2      SER  10 -18.237  -1.841  -1.719
    4    HB3  SER  10           HB3      SER  10 -16.859  -2.182  -2.751
    5    HG   SER  10           HG       SER  10 -15.661  -2.560  -0.805

  No H/Q in entry =           5
  In of MODEL   75
    1    H    SER  11           H        SER  11 -14.885   0.034   0.173
    2    HA   SER  11           HA       SER  11 -12.695   0.766  -1.413
    3    HB2  SER  11           HB2      SER  11 -11.474   0.817   0.552
    4    HB3  SER  11           HB3      SER  11 -13.127   0.987   1.144
    5    HG   SER  11           HG       SER  11 -13.137  -1.195   1.636

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ALA  12           H        ALA  12 -14.030  -1.949  -2.065
    2    HA   ALA  12           HA       ALA  12 -11.492  -3.269  -2.636
    3    HB3  ALA  12           HB1      ALA  12 -12.526  -4.186  -0.436
    4    HB2  ALA  12           HB2      ALA  12 -11.968  -5.333  -1.654
    5    HB1  ALA  12           HB3      ALA  12 -13.688  -4.977  -1.505

  No H/Q in entry =           5
  In of MODEL   75
    1    H    GLY  13           H        GLY  13 -12.324  -2.245  -4.648
    2    HA3  GLY  13           HA2      GLY  13 -14.591  -2.988  -6.072
    3    HA2  GLY  13           HA3      GLY  13 -13.064  -2.501  -6.821

  No H/Q in entry =           3
  In of MODEL   75
    1    H    MET  14           H        MET  14 -11.575  -4.780  -5.732
    2    HA   MET  14           HA       MET  14 -11.732  -6.546  -7.852
    3    HB2  MET  14           HB2      MET  14  -9.838  -6.617  -6.307
    4    HB3  MET  14           HB3      MET  14 -10.859  -7.291  -5.038
    5    HG2  MET  14           HG2      MET  14  -9.621  -9.100  -6.093
    6    HG3  MET  14           HG3      MET  14 -11.316  -9.255  -6.557
    7    HE1  MET  14           HE1      MET  14  -7.795  -8.838  -7.422
    8    HE3  MET  14           HE2      MET  14  -8.115  -7.136  -7.749
    9    HE2  MET  14           HE3      MET  14  -7.682  -8.213  -9.074

  No H/Q in entry =           9
  In of MODEL   75
    1    H    SER  15           H        SER  15 -13.371  -6.970  -4.733
    2    HA   SER  15           HA       SER  15 -14.690  -9.383  -5.735
    3    HB2  SER  15           HB2      SER  15 -14.667  -8.035  -3.056
    4    HB3  SER  15           HB3      SER  15 -15.989  -9.123  -3.468
    5    HG   SER  15           HG       SER  15 -13.376  -9.956  -4.035

  No H/Q in entry =           5
  In of MODEL   75
    1    H    THR  16           H        THR  16 -15.579  -5.998  -5.021
    2    HA   THR  16           HA       THR  16 -18.411  -6.288  -5.441
    3    HB   THR  16           HB       THR  16 -16.704  -3.841  -6.010
    4    HG1  THR  16           HG1      THR  16 -17.919  -3.952  -3.583
    5   HG21  THR  16          HG21      THR  16 -19.576  -4.191  -5.111
    6   HG23  THR  16          HG22      THR  16 -19.060  -3.727  -6.742
    7   HG22  THR  16          HG23      THR  16 -18.761  -2.653  -5.367

  No H/Q in entry =           7
  In of MODEL   75
    1    H    SER  17           H        SER  17 -15.645  -5.841  -7.370
    2    HA   SER  17           HA       SER  17 -16.758  -5.057  -9.865
    3    HB2  SER  17           HB2      SER  17 -14.184  -6.489  -9.179
    4    HB3  SER  17           HB3      SER  17 -14.618  -6.039 -10.828
    5    HG   SER  17           HG       SER  17 -13.658  -4.252 -10.285

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LEU  18           H        LEU  18 -16.316  -8.221  -8.414
    2    HA   LEU  18           HA       LEU  18 -16.985  -9.699 -10.761
    3    HB2  LEU  18           HB2      LEU  18 -15.794 -10.703  -8.859
    4    HB3  LEU  18           HB3      LEU  18 -17.213 -10.453  -7.843
    5    HG   LEU  18           HG       LEU  18 -18.504 -11.942  -9.360
    6   HD11  LEU  18          HD11      LEU  18 -15.832 -12.043 -10.717
    7   HD13  LEU  18          HD12      LEU  18 -17.439 -11.898 -11.429
    8   HD12  LEU  18          HD13      LEU  18 -16.898 -13.445 -10.778
    9   HD22  LEU  18          HD21      LEU  18 -17.646 -13.960  -8.473
   10   HD21  LEU  18          HD22      LEU  18 -17.385 -12.691  -7.275
   11   HD23  LEU  18          HD23      LEU  18 -16.040 -13.257  -8.267

  No H/Q in entry =          11
  In of MODEL   75
    1    H    LEU  19           H        LEU  19 -18.879  -8.400  -8.039
    2    HA   LEU  19           HA       LEU  19 -21.398  -9.478  -8.851
    3    HB2  LEU  19           HB2      LEU  19 -21.032  -8.630  -6.598
    4    HB3  LEU  19           HB3      LEU  19 -20.761  -7.011  -7.238
    5    HG   LEU  19           HG       LEU  19 -23.085  -6.790  -7.822
    6   HD13  LEU  19          HD11      LEU  19 -23.932  -8.817  -8.503
    7   HD12  LEU  19          HD12      LEU  19 -24.573  -8.759  -6.862
    8   HD11  LEU  19          HD13      LEU  19 -23.129  -9.707  -7.210
    9   HD22  LEU  19          HD21      LEU  19 -22.521  -6.162  -5.596
   10   HD21  LEU  19          HD22      LEU  19 -22.605  -7.834  -5.041
   11   HD23  LEU  19          HD23      LEU  19 -24.073  -6.995  -5.542

  No H/Q in entry =          11
  In of MODEL   75
    1    H    VAL  20           H        VAL  20 -19.771  -6.387  -9.564
    2    HA   VAL  20           HA       VAL  20 -21.847  -5.257 -11.120
    3    HB   VAL  20           HB       VAL  20 -18.837  -4.798 -11.285
    4   HG12  VAL  20          HG11      VAL  20 -19.651  -2.600 -12.412
    5   HG11  VAL  20          HG12      VAL  20 -21.117  -3.512 -12.769
    6   HG13  VAL  20          HG13      VAL  20 -19.563  -4.063 -13.392
    7   HG22  VAL  20          HG21      VAL  20 -19.549  -4.003  -9.222
    8   HG21  VAL  20          HG22      VAL  20 -21.090  -3.436  -9.864
    9   HG23  VAL  20          HG23      VAL  20 -19.602  -2.574 -10.256

  No H/Q in entry =           9
  In of MODEL   75
    1    H    SER  21           H        SER  21 -19.189  -7.428 -12.163
    2    HA   SER  21           HA       SER  21 -19.988  -7.288 -14.908
    3    HB2  SER  21           HB2      SER  21 -18.642  -9.319 -15.245
    4    HB3  SER  21           HB3      SER  21 -17.753  -8.105 -14.329
    5    HG   SER  21           HG       SER  21 -17.618 -10.262 -13.496

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LYS  22           H        LYS  22 -21.128  -9.419 -12.323
    2    HA   LYS  22           HA       LYS  22 -22.749 -10.975 -14.129
    3    HB2  LYS  22           HB2      LYS  22 -22.007 -11.734 -11.840
    4    HB3  LYS  22           HB3      LYS  22 -23.188 -10.610 -11.170
    5    HG2  LYS  22           HG2      LYS  22 -24.289 -12.654 -11.119
    6    HG3  LYS  22           HG3      LYS  22 -24.912 -11.887 -12.580
    7    HD2  LYS  22           HD2      LYS  22 -23.373 -13.198 -13.946
    8    HD3  LYS  22           HD3      LYS  22 -22.697 -13.940 -12.493
    9    HE2  LYS  22           HE2      LYS  22 -25.594 -14.183 -13.327
   10    HE3  LYS  22           HE3      LYS  22 -24.354 -15.373 -13.719
   11    HZ2  LYS  22           HZ1      LYS  22 -25.898 -15.196 -11.416
   12    HZ1  LYS  22           HZ2      LYS  22 -24.295 -14.863 -10.961
   13    HZ3  LYS  22           HZ3      LYS  22 -24.666 -16.311 -11.767

  No H/Q in entry =          13
  In of MODEL   75
    1    H    MET  23           H        MET  23 -23.329  -8.019 -12.263
    2    HA   MET  23           HA       MET  23 -26.142  -7.974 -12.749
    3    HB2  MET  23           HB2      MET  23 -24.190  -5.750 -12.196
    4    HB3  MET  23           HB3      MET  23 -25.927  -5.503 -12.361
    5    HG2  MET  23           HG2      MET  23 -26.361  -6.784 -10.386
    6    HG3  MET  23           HG3      MET  23 -24.670  -7.271 -10.271
    7    HE2  MET  23           HE1      MET  23 -26.793  -3.517  -9.075
    8    HE1  MET  23           HE2      MET  23 -27.102  -4.476 -10.521
    9    HE3  MET  23           HE3      MET  23 -26.004  -3.097 -10.596

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ARG  24           H        ARG  24 -23.340  -6.674 -14.556
    2    HA   ARG  24           HA       ARG  24 -24.791  -5.311 -16.547
    3    HB2  ARG  24           HB2      ARG  24 -22.365  -4.958 -16.241
    4    HB3  ARG  24           HB3      ARG  24 -22.052  -6.609 -16.720
    5    HG2  ARG  24           HG2      ARG  24 -21.545  -5.444 -18.705
    6    HG3  ARG  24           HG3      ARG  24 -23.249  -5.897 -18.975
    7    HD2  ARG  24           HD2      ARG  24 -23.138  -3.549 -19.449
    8    HD3  ARG  24           HD3      ARG  24 -23.854  -3.696 -17.849
    9    HE   ARG  24           HE       ARG  24 -21.252  -3.342 -17.282
   10   HH21  ARG  24          HH11      ARG  24 -21.225  -1.543 -15.934
   11   HH22  ARG  24          HH12      ARG  24 -21.921  -0.056 -16.476
   12   HH11  ARG  24          HH21      ARG  24 -23.361  -1.629 -19.301
   13   HH12  ARG  24          HH22      ARG  24 -23.173  -0.114 -18.473

  No H/Q in entry =          13
  In of MODEL   75
    1    H    ALA  25           H        ALA  25 -23.821  -8.697 -16.273
    2    HA   ALA  25           HA       ALA  25 -24.506  -9.502 -18.904
    3    HB1  ALA  25           HB1      ALA  25 -23.899 -11.563 -18.209
    4    HB3  ALA  25           HB2      ALA  25 -24.944 -11.492 -16.791
    5    HB2  ALA  25           HB3      ALA  25 -23.352 -10.737 -16.750

  No H/Q in entry =           5
  In of MODEL   75
    1    H    GLN  26           H        GLN  26 -26.310  -9.452 -15.868
    2    HA   GLN  26           HA       GLN  26 -28.715 -10.546 -16.866
    3    HB2  GLN  26           HB2      GLN  26 -28.105  -8.822 -14.485
    4    HB3  GLN  26           HB3      GLN  26 -29.702  -9.472 -14.824
    5    HG2  GLN  26           HG2      GLN  26 -27.183 -11.046 -14.370
    6    HG3  GLN  26           HG3      GLN  26 -28.529 -10.880 -13.251
    7   HE21  GLN  26          HE21      GLN  26 -27.423 -13.100 -14.532
    8   HE22  GLN  26          HE22      GLN  26 -28.519 -14.099 -15.320

  No H/Q in entry =           8
  In of MODEL   75
    1    H    ALA  27           H        ALA  27 -27.621  -7.195 -16.486
    2    HA   ALA  27           HA       ALA  27 -30.063  -5.989 -17.254
    3    HB1  ALA  27           HB1      ALA  27 -28.185  -4.759 -16.153
    4    HB3  ALA  27           HB2      ALA  27 -28.750  -3.967 -17.625
    5    HB2  ALA  27           HB3      ALA  27 -27.256  -4.905 -17.646

  No H/Q in entry =           5
  In of MODEL   75
    1    H    GLU  28           H        GLU  28 -27.434  -7.338 -19.141
    2    HA   GLU  28           HA       GLU  28 -28.337  -6.257 -21.654
    3    HB2  GLU  28           HB2      GLU  28 -25.988  -7.051 -21.046
    4    HB3  GLU  28           HB3      GLU  28 -26.612  -8.688 -21.242
    5    HG2  GLU  28           HG2      GLU  28 -25.444  -7.966 -23.219
    6    HG3  GLU  28           HG3      GLU  28 -27.158  -8.211 -23.556

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LYS  29           H        LYS  29 -28.636  -9.352 -19.993
    2    HA   LYS  29           HA       LYS  29 -30.021 -10.761 -21.987
    3    HB2  LYS  29           HB2      LYS  29 -29.004 -11.791 -19.990
    4    HB3  LYS  29           HB3      LYS  29 -30.234 -11.025 -18.987
    5    HG2  LYS  29           HG2      LYS  29 -31.965 -12.319 -20.042
    6    HG3  LYS  29           HG3      LYS  29 -30.805 -13.010 -21.174
    7    HD2  LYS  29           HD2      LYS  29 -29.706 -14.227 -19.448
    8    HD3  LYS  29           HD3      LYS  29 -30.564 -13.344 -18.187
    9    HE2  LYS  29           HE2      LYS  29 -31.427 -15.656 -18.543
   10    HE3  LYS  29           HE3      LYS  29 -32.650 -14.405 -18.779
   11    HZ1  LYS  29           HZ1      LYS  29 -32.109 -14.567 -21.209
   12    HZ3  LYS  29           HZ2      LYS  29 -32.888 -15.918 -20.539
   13    HZ2  LYS  29           HZ3      LYS  29 -31.221 -15.967 -20.848

  No H/Q in entry =          13
  In of MODEL   75
    1    H    TYR  30           H        TYR  30 -31.296  -8.592 -19.475
    2    HA   TYR  30           HA       TYR  30 -33.984  -8.916 -20.698
    3    HB2  TYR  30           HB2      TYR  30 -33.260  -7.794 -17.983
    4    HB3  TYR  30           HB3      TYR  30 -34.892  -7.976 -18.625
    5    HD1  TYR  30           HD1      TYR  30 -35.909 -10.224 -18.830
    6    HD2  TYR  30           HD2      TYR  30 -32.034  -9.680 -17.154
    7    HE1  TYR  30           HE1      TYR  30 -35.923 -12.553 -18.033
    8    HE2  TYR  30           HE2      TYR  30 -32.048 -11.995 -16.360
    9    HH   TYR  30           HH       TYR  30 -33.802 -14.277 -17.440

  No H/Q in entry =           9
  In of MODEL   75
    1    H    GLU  31           H        GLU  31 -31.734  -7.028 -21.515
    2    HA   GLU  31           HA       GLU  31 -31.566  -4.877 -22.339
    3    HB2  GLU  31           HB2      GLU  31 -34.495  -5.458 -22.832
    4    HB3  GLU  31           HB3      GLU  31 -33.597  -4.130 -23.567
    5    HG2  GLU  31           HG2      GLU  31 -32.201  -5.635 -24.768
    6    HG3  GLU  31           HG3      GLU  31 -32.824  -7.021 -23.875

  No H/Q in entry =           6
  In of MODEL   75
    1    H    VAL  32           H        VAL  32 -31.742  -4.766 -19.605
    2    HA   VAL  32           HA       VAL  32 -33.501  -2.569 -18.935
    3    HB   VAL  32           HB       VAL  32 -31.145  -3.671 -17.370
    4   HG12  VAL  32          HG11      VAL  32 -32.628  -2.778 -15.465
    5   HG11  VAL  32          HG12      VAL  32 -33.428  -1.837 -16.723
    6   HG13  VAL  32          HG13      VAL  32 -31.707  -1.612 -16.415
    7   HG21  VAL  32          HG21      VAL  32 -32.994  -5.310 -18.045
    8   HG23  VAL  32          HG22      VAL  32 -33.988  -4.435 -16.879
    9   HG22  VAL  32          HG23      VAL  32 -32.502  -5.227 -16.354

  No H/Q in entry =           9
  In of MODEL   75
    1    HA   PRO  33           HA       PRO  33 -30.350   0.218 -20.630
    2    HB2  PRO  33           HB2      PRO  33 -31.759   2.507 -20.497
    3    HB3  PRO  33           HB3      PRO  33 -32.293   1.227 -21.587
    4    HG2  PRO  33           HG2      PRO  33 -33.218   1.787 -18.768
    5    HG3  PRO  33           HG3      PRO  33 -34.201   1.622 -20.223
    6    HD2  PRO  33           HD2      PRO  33 -33.827  -0.469 -18.560
    7    HD3  PRO  33           HD3      PRO  33 -33.913  -0.707 -20.306

  No H/Q in entry =           7
  In of MODEL   75
    1    H    VAL  34           H        VAL  34 -29.099  -0.382 -18.690
    2    HA   VAL  34           HA       VAL  34 -28.695   2.027 -17.045
    3    HB   VAL  34           HB       VAL  34 -28.167   0.541 -15.111
    4   HG12  VAL  34          HG11      VAL  34 -30.614  -0.223 -14.787
    5   HG11  VAL  34          HG12      VAL  34 -30.906   0.550 -16.342
    6   HG13  VAL  34          HG13      VAL  34 -30.301   1.501 -14.986
    7   HG21  VAL  34          HG21      VAL  34 -28.456  -1.475 -17.117
    8   HG23  VAL  34          HG22      VAL  34 -29.519  -1.789 -15.744
    9   HG22  VAL  34          HG23      VAL  34 -27.788  -1.578 -15.488

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ILE  35           H        ILE  35 -26.695   2.374 -16.219
    2    HA   ILE  35           HA       ILE  35 -24.461   0.943 -17.498
    3    HB   ILE  35           HB       ILE  35 -24.726   3.848 -16.685
    4   HG12  ILE  35          HG12      ILE  35 -23.821   2.499 -19.236
    5   HG13  ILE  35          HG13      ILE  35 -25.420   3.191 -18.965
    6   HG21  ILE  35          HG21      ILE  35 -22.237   2.203 -17.011
    7   HG23  ILE  35          HG22      ILE  35 -22.630   3.401 -15.780
    8   HG22  ILE  35          HG23      ILE  35 -22.236   3.919 -17.418
    9   HD11  ILE  35          HD11      ILE  35 -23.919   5.322 -18.374
   10   HD13  ILE  35          HD12      ILE  35 -24.484   4.963 -20.006
   11   HD12  ILE  35          HD13      ILE  35 -22.847   4.520 -19.522

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ILE  36           H        ILE  36 -23.266  -0.134 -15.907
    2    HA   ILE  36           HA       ILE  36 -23.658   0.499 -13.033
    3    HB   ILE  36           HB       ILE  36 -22.959  -2.237 -14.148
    4   HG12  ILE  36          HG12      ILE  36 -25.723  -1.308 -13.364
    5   HG13  ILE  36          HG13      ILE  36 -25.163  -1.313 -15.036
    6   HG23  ILE  36          HG21      ILE  36 -23.332  -3.050 -12.031
    7   HG22  ILE  36          HG22      ILE  36 -24.398  -1.718 -11.585
    8   HG21  ILE  36          HG23      ILE  36 -22.655  -1.463 -11.668
    9   HD13  ILE  36          HD11      ILE  36 -25.427  -3.517 -15.240
   10   HD12  ILE  36          HD12      ILE  36 -26.476  -3.349 -13.834
   11   HD11  ILE  36          HD13      ILE  36 -24.797  -3.843 -13.627

  No H/Q in entry =          11
  In of MODEL   75
    1    H    GLU  37           H        GLU  37 -21.843   1.049 -11.942
    2    HA   GLU  37           HA       GLU  37 -19.197   0.136 -12.877
    3    HB2  GLU  37           HB2      GLU  37 -19.967   2.962 -12.171
    4    HB3  GLU  37           HB3      GLU  37 -18.303   2.396 -12.313
    5    HG2  GLU  37           HG2      GLU  37 -18.602   1.982 -14.662
    6    HG3  GLU  37           HG3      GLU  37 -20.308   2.416 -14.550

  No H/Q in entry =           6
  In of MODEL   75
    1    H    ALA  38           H        ALA  38 -17.710  -0.168 -11.205
    2    HA   ALA  38           HA       ALA  38 -18.713   0.055  -8.427
    3    HB1  ALA  38           HB1      ALA  38 -17.095  -1.957  -9.865
    4    HB3  ALA  38           HB2      ALA  38 -18.145  -2.146  -8.460
    5    HB2  ALA  38           HB3      ALA  38 -16.502  -1.535  -8.258

  No H/Q in entry =           5
  In of MODEL   75
    1    H    PHE  39           H        PHE  39 -17.411   1.210  -6.963
    2    HA   PHE  39           HA       PHE  39 -14.842   2.302  -7.877
    3    HB2  PHE  39           HB2      PHE  39 -17.199   3.884  -6.878
    4    HB3  PHE  39           HB3      PHE  39 -15.547   4.485  -6.736
    5    HD1  PHE  39           HD1      PHE  39 -14.168   4.534  -8.928
    6    HD2  PHE  39           HD2      PHE  39 -18.425   4.355  -8.760
    7    HE1  PHE  39           HE1      PHE  39 -14.285   5.445 -11.230
    8    HE2  PHE  39           HE2      PHE  39 -18.558   5.257 -11.054
    9    HZ   PHE  39           HZ       PHE  39 -16.493   5.777 -12.309

  No H/Q in entry =           9
  In of MODEL   75
    1    HA   PRO  40           HA       PRO  40 -13.907   1.508  -3.598
    2    HB2  PRO  40           HB2      PRO  40 -12.051   3.445  -3.004
    3    HB3  PRO  40           HB3      PRO  40 -11.672   2.098  -4.077
    4    HG2  PRO  40           HG2      PRO  40 -12.587   4.875  -4.811
    5    HG3  PRO  40           HG3      PRO  40 -11.201   3.977  -5.429
    6    HD2  PRO  40           HD2      PRO  40 -13.435   3.977  -6.826
    7    HD3  PRO  40           HD3      PRO  40 -12.540   2.471  -6.637

  No H/Q in entry =           7
  In of MODEL   75
    1    H    GLU  41           H        GLU  41 -14.471   2.511  -1.464
    2    HA   GLU  41           HA       GLU  41 -16.642   4.306  -1.431
    3    HB2  GLU  41           HB2      GLU  41 -16.495   4.216   0.941
    4    HB3  GLU  41           HB3      GLU  41 -16.053   2.617   0.342
    5    HG2  GLU  41           HG2      GLU  41 -13.682   3.150   0.687
    6    HG3  GLU  41           HG3      GLU  41 -14.137   4.737   1.306

  No H/Q in entry =           6
  In of MODEL   75
    1    H    THR  42           H        THR  42 -13.277   5.085  -1.507
    2    HA   THR  42           HA       THR  42 -13.514   7.657  -0.293
    3    HB   THR  42           HB       THR  42 -11.344   8.141  -1.406
    4    HG1  THR  42           HG1      THR  42 -11.172   7.121  -3.251
    5   HG21  THR  42          HG21      THR  42 -11.671   6.626   0.699
    6   HG23  THR  42          HG22      THR  42 -10.094   6.668  -0.093
    7   HG22  THR  42          HG23      THR  42 -11.191   5.321  -0.387

  No H/Q in entry =           7
  In of MODEL   75
    1    H    LEU  43           H        LEU  43 -14.485   6.602  -3.387
    2    HA   LEU  43           HA       LEU  43 -14.631   9.382  -4.355
    3    HB2  LEU  43           HB2      LEU  43 -14.931   6.704  -5.682
    4    HB3  LEU  43           HB3      LEU  43 -15.409   8.204  -6.473
    5    HG   LEU  43           HG       LEU  43 -12.594   7.606  -5.610
    6   HD13  LEU  43          HD11      LEU  43 -12.707   6.077  -7.281
    7   HD12  LEU  43          HD12      LEU  43 -12.527   7.508  -8.295
    8   HD11  LEU  43          HD13      LEU  43 -14.127   6.826  -8.013
    9   HD22  LEU  43          HD21      LEU  43 -12.910   9.938  -5.842
   10   HD21  LEU  43          HD22      LEU  43 -13.923   9.740  -7.273
   11   HD23  LEU  43          HD23      LEU  43 -12.192   9.417  -7.365

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ALA  44           H        ALA  44 -16.636   7.638  -2.488
    2    HA   ALA  44           HA       ALA  44 -19.127   7.601  -3.791
    3    HB2  ALA  44           HB1      ALA  44 -19.020   6.479  -1.696
    4    HB3  ALA  44           HB2      ALA  44 -20.069   7.868  -1.416
    5    HB1  ALA  44           HB3      ALA  44 -18.391   7.909  -0.876

  No H/Q in entry =           5
  In of MODEL   75
    1    H    GLY  45           H        GLY  45 -17.582  10.340  -2.271
    2    HA3  GLY  45           HA2      GLY  45 -19.958  11.939  -2.614
    3    HA2  GLY  45           HA3      GLY  45 -18.385  12.500  -2.049

  No H/Q in entry =           3
  In of MODEL   75
    1    H    GLU  46           H        GLU  46 -16.910  11.500  -4.351
    2    HA   GLU  46           HA       GLU  46 -17.468  13.741  -6.115
    3    HB2  GLU  46           HB2      GLU  46 -15.365  11.569  -6.171
    4    HB3  GLU  46           HB3      GLU  46 -15.444  12.911  -7.313
    5    HG2  GLU  46           HG2      GLU  46 -15.058  13.179  -4.339
    6    HG3  GLU  46           HG3      GLU  46 -13.773  13.255  -5.545

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LYS  47           H        LYS  47 -17.497  10.219  -6.550
    2    HA   LYS  47           HA       LYS  47 -18.605  10.484  -9.218
    3    HB2  LYS  47           HB2      LYS  47 -18.132   8.068  -7.463
    4    HB3  LYS  47           HB3      LYS  47 -18.704   8.005  -9.130
    5    HG2  LYS  47           HG2      LYS  47 -16.117   9.326  -8.427
    6    HG3  LYS  47           HG3      LYS  47 -16.223   7.583  -8.672
    7    HD2  LYS  47           HD2      LYS  47 -17.144   7.933 -10.897
    8    HD3  LYS  47           HD3      LYS  47 -17.101   9.678 -10.654
    9    HE2  LYS  47           HE2      LYS  47 -15.163   8.355 -11.910
   10    HE3  LYS  47           HE3      LYS  47 -14.859   9.804 -10.954
   11    HZ1  LYS  47           HZ1      LYS  47 -14.511   8.234  -9.035
   12    HZ3  LYS  47           HZ2      LYS  47 -13.310   8.242 -10.236
   13    HZ2  LYS  47           HZ3      LYS  47 -14.451   6.984 -10.182

  No H/Q in entry =          13
  In of MODEL   75
    1    H    GLY  48           H        GLY  48 -19.934   9.783  -6.060
    2    HA3  GLY  48           HA2      GLY  48 -22.372   8.696  -6.783
    3    HA2  GLY  48           HA3      GLY  48 -22.095   9.681  -5.345

  No H/Q in entry =           3
  In of MODEL   75
    1    H    GLN  49           H        GLN  49 -21.425  12.077  -6.922
    2    HA   GLN  49           HA       GLN  49 -23.937  13.293  -7.049
    3    HB2  GLN  49           HB2      GLN  49 -21.370  14.051  -8.428
    4    HB3  GLN  49           HB3      GLN  49 -22.790  15.076  -8.333
    5    HG2  GLN  49           HG2      GLN  49 -22.611  15.093  -5.898
    6    HG3  GLN  49           HG3      GLN  49 -21.205  14.048  -5.990
    7   HE21  GLN  49          HE21      GLN  49 -20.987  16.270  -4.720
    8   HE22  GLN  49          HE22      GLN  49 -20.018  17.487  -5.374

  No H/Q in entry =           8
  In of MODEL   75
    1    H    ASN  50           H        ASN  50 -22.354  11.345  -9.446
    2    HA   ASN  50           HA       ASN  50 -24.215  12.294 -11.515
    3    HB2  ASN  50           HB2      ASN  50 -21.703  10.648 -11.767
    4    HB3  ASN  50           HB3      ASN  50 -22.744  11.117 -13.103
    5   HD21  ASN  50          HD21      ASN  50 -20.063  11.853 -11.512
    6   HD22  ASN  50          HD22      ASN  50 -19.765  13.477 -11.857

  No H/Q in entry =           6
  In of MODEL   75
    1    H    ALA  51           H        ALA  51 -24.281   9.939  -9.268
    2    HA   ALA  51           HA       ALA  51 -25.168   7.829 -11.087
    3    HB2  ALA  51           HB1      ALA  51 -24.630   6.457  -9.405
    4    HB3  ALA  51           HB2      ALA  51 -25.709   7.311  -8.304
    5    HB1  ALA  51           HB3      ALA  51 -24.047   7.863  -8.514

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ASP  52           H        ASP  52 -27.215   6.858 -10.933
    2    HA   ASP  52           HA       ASP  52 -29.312   8.782 -10.252
    3    HB2  ASP  52           HB2      ASP  52 -29.239   6.270 -11.923
    4    HB3  ASP  52           HB3      ASP  52 -30.748   7.068 -11.478

  No H/Q in entry =           4
  In of MODEL   75
    1    H    VAL  53           H        VAL  53 -27.827   5.828  -9.247
    2    HA   VAL  53           HA       VAL  53 -29.242   6.017  -6.720
    3    HB   VAL  53           HB       VAL  53 -30.719   4.436  -7.953
    4   HG11  VAL  53          HG11      VAL  53 -29.021   3.502  -9.487
    5   HG13  VAL  53          HG12      VAL  53 -29.902   2.244  -8.621
    6   HG12  VAL  53          HG13      VAL  53 -28.268   2.678  -8.123
    7   HG23  VAL  53          HG21      VAL  53 -29.970   2.426  -6.265
    8   HG22  VAL  53          HG22      VAL  53 -31.039   3.777  -5.891
    9   HG21  VAL  53          HG23      VAL  53 -29.324   3.876  -5.496

  No H/Q in entry =           9
  In of MODEL   75
    1    H    VAL  54           H        VAL  54 -27.937   5.529  -5.074
    2    HA   VAL  54           HA       VAL  54 -25.220   4.562  -5.706
    3    HB   VAL  54           HB       VAL  54 -26.197   6.384  -3.450
    4   HG11  VAL  54          HG11      VAL  54 -23.683   4.856  -3.758
    5   HG13  VAL  54          HG12      VAL  54 -24.396   5.568  -2.311
    6   HG12  VAL  54          HG13      VAL  54 -23.454   6.571  -3.414
    7   HG22  VAL  54          HG21      VAL  54 -25.269   8.160  -4.556
    8   HG21  VAL  54          HG22      VAL  54 -25.868   7.194  -5.903
    9   HG23  VAL  54          HG23      VAL  54 -24.159   7.146  -5.477

  No H/Q in entry =           9
  In of MODEL   75
    1    H    LEU  55           H        LEU  55 -24.707   2.617  -5.066
    2    HA   LEU  55           HA       LEU  55 -26.254   1.373  -2.879
    3    HB2  LEU  55           HB2      LEU  55 -24.766   0.138  -5.185
    4    HB3  LEU  55           HB3      LEU  55 -25.556  -0.762  -3.890
    5    HG   LEU  55           HG       LEU  55 -26.939   0.885  -5.997
    6   HD13  LEU  55          HD11      LEU  55 -26.729  -0.979  -7.218
    7   HD12  LEU  55          HD12      LEU  55 -27.714  -1.811  -6.016
    8   HD11  LEU  55          HD13      LEU  55 -25.957  -1.823  -5.878
    9   HD23  LEU  55          HD21      LEU  55 -28.303  -1.002  -4.132
   10   HD22  LEU  55          HD22      LEU  55 -28.944   0.408  -4.975
   11   HD21  LEU  55          HD23      LEU  55 -27.904   0.620  -3.567

  No H/Q in entry =          11
  In of MODEL   75
    1    H    LEU  56           H        LEU  56 -25.115   0.730  -1.082
    2    HA   LEU  56           HA       LEU  56 -22.168   0.997  -1.153
    3    HB2  LEU  56           HB2      LEU  56 -23.961   0.866   1.259
    4    HB3  LEU  56           HB3      LEU  56 -22.234   1.221   1.235
    5    HG   LEU  56           HG       LEU  56 -24.465   2.997   0.287
    6   HD11  LEU  56          HD11      LEU  56 -23.349   2.568   2.799
    7   HD13  LEU  56          HD12      LEU  56 -24.283   3.979   2.300
    8   HD12  LEU  56          HD13      LEU  56 -22.523   4.007   2.199
    9   HD23  LEU  56          HD21      LEU  56 -22.450   4.610   0.078
   10   HD22  LEU  56          HD22      LEU  56 -22.890   3.529  -1.246
   11   HD21  LEU  56          HD23      LEU  56 -21.544   3.119  -0.182

  No H/Q in entry =          11
  In of MODEL   75
    1    H    GLY  57           H        GLY  57 -20.855  -0.691  -0.628
    2    HA3  GLY  57           HA2      GLY  57 -21.898  -3.334  -0.816
    3    HA2  GLY  57           HA3      GLY  57 -20.251  -2.911  -0.353

  No H/Q in entry =           3
  In of MODEL   75
    1    HA   PRO  58           HA       PRO  58 -23.075  -3.826   3.381
    2    HB2  PRO  58           HB2      PRO  58 -22.500  -6.457   3.985
    3    HB3  PRO  58           HB3      PRO  58 -23.872  -5.989   2.982
    4    HG2  PRO  58           HG2      PRO  58 -21.192  -6.989   2.176
    5    HG3  PRO  58           HG3      PRO  58 -22.780  -7.380   1.516
    6    HD2  PRO  58           HD2      PRO  58 -21.102  -5.635   0.281
    7    HD3  PRO  58           HD3      PRO  58 -22.856  -5.472   0.191

  No H/Q in entry =           7
  In of MODEL   75
    1    H    GLN  59           H        GLN  59 -19.731  -4.445   2.750
    2    HA   GLN  59           HA       GLN  59 -18.958  -4.494   5.505
    3    HB2  GLN  59           HB2      GLN  59 -17.347  -3.705   3.073
    4    HB3  GLN  59           HB3      GLN  59 -16.696  -3.965   4.678
    5    HG2  GLN  59           HG2      GLN  59 -16.611  -5.830   2.821
    6    HG3  GLN  59           HG3      GLN  59 -16.835  -6.231   4.515
    7   HE21  GLN  59          HE21      GLN  59 -17.922  -6.644   1.657
    8   HE22  GLN  59          HE22      GLN  59 -19.437  -7.329   1.632

  No H/Q in entry =           8
  In of MODEL   75
    1    H    ILE  60           H        ILE  60 -19.795  -1.906   3.302
    2    HA   ILE  60           HA       ILE  60 -18.843   0.013   5.340
    3    HB   ILE  60           HB       ILE  60 -18.527   1.664   3.701
    4   HG12  ILE  60          HG12      ILE  60 -20.200  -0.011   1.831
    5   HG13  ILE  60          HG13      ILE  60 -20.659   1.523   2.568
    6   HG22  ILE  60          HG21      ILE  60 -17.184   0.647   1.937
    7   HG21  ILE  60          HG22      ILE  60 -17.832  -0.934   2.374
    8   HG23  ILE  60          HG23      ILE  60 -16.844  -0.037   3.527
    9   HD11  ILE  60          HD11      ILE  60 -18.299   1.253   0.703
   10   HD13  ILE  60          HD12      ILE  60 -19.094   2.733   1.239
   11   HD12  ILE  60          HD13      ILE  60 -19.926   1.634   0.139

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ALA  61           H        ALA  61 -21.365  -1.463   5.429
    2    HA   ALA  61           HA       ALA  61 -23.519   0.298   4.985
    3    HB1  ALA  61           HB1      ALA  61 -24.789  -1.136   6.320
    4    HB2  ALA  61           HB2      ALA  61 -23.402  -1.587   7.313
    5    HB3  ALA  61           HB3      ALA  61 -23.537  -2.189   5.661

  No H/Q in entry =           5
  In of MODEL   75
    1    H    TYR  62           H        TYR  62 -21.298   0.090   7.766
    2    HA   TYR  62           HA       TYR  62 -22.767   1.815   9.447
    3    HB2  TYR  62           HB2      TYR  62 -20.698   2.151  10.663
    4    HB3  TYR  62           HB3      TYR  62 -20.837   0.455  10.204
    5    HD1  TYR  62           HD1      TYR  62 -19.381  -0.469   8.393
    6    HD2  TYR  62           HD2      TYR  62 -18.860   3.509   9.863
    7    HE1  TYR  62           HE1      TYR  62 -17.170  -0.363   7.308
    8    HE2  TYR  62           HE2      TYR  62 -16.635   3.610   8.778
    9    HH   TYR  62           HH       TYR  62 -15.357   2.602   7.193

  No H/Q in entry =           9
  In of MODEL   75
    1    H    MET  63           H        MET  63 -21.109   2.598   6.578
    2    HA   MET  63           HA       MET  63 -20.810   5.421   7.268
    3    HB2  MET  63           HB2      MET  63 -20.288   3.868   4.733
    4    HB3  MET  63           HB3      MET  63 -20.023   5.605   4.904
    5    HG2  MET  63           HG2      MET  63 -18.311   5.201   6.563
    6    HG3  MET  63           HG3      MET  63 -18.600   3.465   6.464
    7    HE1  MET  63           HE1      MET  63 -17.961   6.575   4.754
    8    HE3  MET  63           HE2      MET  63 -17.934   6.091   3.059
    9    HE2  MET  63           HE3      MET  63 -16.420   6.289   3.943

  No H/Q in entry =           9
  In of MODEL   75
    1    H    LEU  64           H        LEU  64 -23.462   3.682   6.324
    2    HA   LEU  64           HA       LEU  64 -24.623   5.152   4.254
    3    HB2  LEU  64           HB2      LEU  64 -25.578   3.088   5.180
    4    HB3  LEU  64           HB3      LEU  64 -25.985   3.950   6.662
    5    HG   LEU  64           HG       LEU  64 -27.632   5.280   5.447
    6   HD13  LEU  64          HD11      LEU  64 -27.355   5.507   3.212
    7   HD12  LEU  64          HD12      LEU  64 -28.075   3.902   3.073
    8   HD11  LEU  64          HD13      LEU  64 -26.321   4.082   3.117
    9   HD23  LEU  64          HD21      LEU  64 -28.282   2.493   4.705
   10   HD22  LEU  64          HD22      LEU  64 -29.211   3.670   5.632
   11   HD21  LEU  64          HD23      LEU  64 -27.867   2.816   6.388

  No H/Q in entry =          11
  In of MODEL   75
    1    HA   PRO  65           HA       PRO  65 -26.638   8.403   7.019
    2    HB2  PRO  65           HB2      PRO  65 -24.614   8.472   9.258
    3    HB3  PRO  65           HB3      PRO  65 -26.338   8.831   9.317
    4    HG2  PRO  65           HG2      PRO  65 -25.505   6.538  10.238
    5    HG3  PRO  65           HG3      PRO  65 -26.933   6.568   9.204
    6    HD2  PRO  65           HD2      PRO  65 -24.097   5.823   8.479
    7    HD3  PRO  65           HD3      PRO  65 -25.597   5.005   8.044

  No H/Q in entry =           7
  In of MODEL   75
    1    H    GLU  66           H        GLU  66 -23.087   8.185   7.064
    2    HA   GLU  66           HA       GLU  66 -22.666  10.967   6.655
    3    HB2  GLU  66           HB2      GLU  66 -20.965   8.579   5.991
    4    HB3  GLU  66           HB3      GLU  66 -20.440  10.248   5.779
    5    HG2  GLU  66           HG2      GLU  66 -20.616  10.629   8.148
    6    HG3  GLU  66           HG3      GLU  66 -21.215   8.988   8.385

  No H/Q in entry =           6
  In of MODEL   75
    1    H    ILE  67           H        ILE  67 -22.911   8.228   4.406
    2    HA   ILE  67           HA       ILE  67 -22.434   9.914   2.108
    3    HB   ILE  67           HB       ILE  67 -23.465   7.051   2.298
    4   HG12  ILE  67          HG12      ILE  67 -20.791   8.097   1.354
    5   HG13  ILE  67          HG13      ILE  67 -21.092   7.693   3.042
    6   HG21  ILE  67          HG21      ILE  67 -23.339   8.924   0.071
    7   HG23  ILE  67          HG22      ILE  67 -24.039   7.307   0.128
    8   HG22  ILE  67          HG23      ILE  67 -22.322   7.512  -0.215
    9   HD12  ILE  67          HD11      ILE  67 -20.774   5.903   0.691
   10   HD11  ILE  67          HD12      ILE  67 -21.803   5.379   2.023
   11   HD13  ILE  67          HD13      ILE  67 -20.108   5.765   2.318

  No H/Q in entry =          11
  In of MODEL   75
    1    H    GLN  68           H        GLN  68 -25.337   8.996   3.765
    2    HA   GLN  68           HA       GLN  68 -27.136  10.011   1.806
    3    HB2  GLN  68           HB2      GLN  68 -27.385   9.667   4.790
    4    HB3  GLN  68           HB3      GLN  68 -28.683  10.324   3.807
    5    HG2  GLN  68           HG2      GLN  68 -28.817   8.297   2.533
    6    HG3  GLN  68           HG3      GLN  68 -27.390   7.652   3.324
    7   HE21  GLN  68          HE21      GLN  68 -29.632   6.400   3.208
    8   HE22  GLN  68          HE22      GLN  68 -30.471   5.984   4.629

  No H/Q in entry =           8
  In of MODEL   75
    1    H    ARG  69           H        ARG  69 -25.431  11.600   4.528
    2    HA   ARG  69           HA       ARG  69 -26.677  14.146   4.132
    3    HB2  ARG  69           HB2      ARG  69 -24.368  13.104   5.701
    4    HB3  ARG  69           HB3      ARG  69 -24.367  14.825   5.342
    5    HG2  ARG  69           HG2      ARG  69 -26.671  14.981   6.332
    6    HG3  ARG  69           HG3      ARG  69 -26.540  13.283   6.806
    7    HD2  ARG  69           HD2      ARG  69 -24.728  15.553   7.704
    8    HD3  ARG  69           HD3      ARG  69 -25.892  14.704   8.708
    9    HE   ARG  69           HE       ARG  69 -23.336  13.646   7.739
   10   HH21  ARG  69          HH11      ARG  69 -22.605  11.846   8.929
   11   HH22  ARG  69          HH12      ARG  69 -23.663  11.081  10.066
   12   HH11  ARG  69          HH21      ARG  69 -26.302  13.244   9.460
   13   HH12  ARG  69          HH22      ARG  69 -25.756  11.870  10.366

  No H/Q in entry =          13
  In of MODEL   75
    1    H    LEU  70           H        LEU  70 -23.890  12.601   2.749
    2    HA   LEU  70           HA       LEU  70 -22.672  14.908   1.570
    3    HB2  LEU  70           HB2      LEU  70 -21.787  12.545   2.159
    4    HB3  LEU  70           HB3      LEU  70 -22.437  12.109   0.579
    5    HG   LEU  70           HG       LEU  70 -20.787  13.402  -0.520
    6   HD11  LEU  70          HD11      LEU  70 -19.901  14.205   2.260
    7   HD13  LEU  70          HD12      LEU  70 -20.556  15.271   1.017
    8   HD12  LEU  70          HD13      LEU  70 -18.981  14.512   0.785
    9   HD22  LEU  70          HD21      LEU  70 -19.438  11.617  -0.299
   10   HD21  LEU  70          HD22      LEU  70 -20.377  11.141   1.116
   11   HD23  LEU  70          HD23      LEU  70 -18.939  12.144   1.308

  No H/Q in entry =          11
  In of MODEL   75
    1    H    LEU  71           H        LEU  71 -24.956  12.474   0.475
    2    HA   LEU  71           HA       LEU  71 -25.428  13.985  -2.039
    3    HB2  LEU  71           HB2      LEU  71 -25.779  11.015  -1.589
    4    HB3  LEU  71           HB3      LEU  71 -25.877  11.880  -3.121
    5    HG   LEU  71           HG       LEU  71 -23.346  11.768  -1.481
    6   HD12  LEU  71          HD11      LEU  71 -23.500  10.143  -3.912
    7   HD11  LEU  71          HD12      LEU  71 -24.530   9.572  -2.601
    8   HD13  LEU  71          HD13      LEU  71 -22.796   9.765  -2.339
    9   HD22  LEU  71          HD21      LEU  71 -23.369  13.586  -2.975
   10   HD21  LEU  71          HD22      LEU  71 -23.930  12.570  -4.302
   11   HD23  LEU  71          HD23      LEU  71 -22.313  12.342  -3.638

  No H/Q in entry =          11
  In of MODEL   75
    1    HA   PRO  72           HA       PRO  72 -29.290  13.733   0.615
    2    HB2  PRO  72           HB2      PRO  72 -30.016  16.335   0.539
    3    HB3  PRO  72           HB3      PRO  72 -28.723  15.817   1.620
    4    HG2  PRO  72           HG2      PRO  72 -28.499  17.000  -1.136
    5    HG3  PRO  72           HG3      PRO  72 -27.693  17.511   0.346
    6    HD2  PRO  72           HD2      PRO  72 -26.452  15.886  -1.429
    7    HD3  PRO  72           HD3      PRO  72 -26.192  15.707   0.304

  No H/Q in entry =           7
  In of MODEL   75
    1    H    ASN  73           H        ASN  73 -28.645  14.655  -2.605
    2    HA   ASN  73           HA       ASN  73 -31.523  14.494  -3.213
    3    HB2  ASN  73           HB2      ASN  73 -31.018  15.575  -5.315
    4    HB3  ASN  73           HB3      ASN  73 -30.434  16.527  -3.959
    5   HD21  ASN  73          HD21      ASN  73 -29.660  16.529  -6.643
    6   HD22  ASN  73          HD22      ASN  73 -28.004  16.282  -6.849

  No H/Q in entry =           6
  In of MODEL   75
    1    H    LYS  74           H        LYS  74 -29.659  12.139  -2.804
    2    HA   LYS  74           HA       LYS  74 -30.320  10.775  -5.346
    3    HB2  LYS  74           HB2      LYS  74 -27.793  10.351  -3.745
    4    HB3  LYS  74           HB3      LYS  74 -28.231   9.559  -5.260
    5    HG2  LYS  74           HG2      LYS  74 -27.809  12.511  -5.062
    6    HG3  LYS  74           HG3      LYS  74 -26.495  11.378  -5.377
    7    HD2  LYS  74           HD2      LYS  74 -27.676  10.509  -7.310
    8    HD3  LYS  74           HD3      LYS  74 -29.038  11.580  -6.979
    9    HE2  LYS  74           HE2      LYS  74 -27.712  13.519  -7.433
   10    HE3  LYS  74           HE3      LYS  74 -26.241  12.550  -7.536
   11    HZ2  LYS  74           HZ1      LYS  74 -27.696  13.229  -9.650
   12    HZ1  LYS  74           HZ2      LYS  74 -28.427  11.744  -9.271
   13    HZ3  LYS  74           HZ3      LYS  74 -26.758  11.814  -9.581

  No H/Q in entry =          13
  In of MODEL   75
    1    HA   PRO  75           HA       PRO  75 -31.846   7.868  -2.361
    2    HB2  PRO  75           HB2      PRO  75 -32.286   5.670  -3.938
    3    HB3  PRO  75           HB3      PRO  75 -33.340   7.082  -4.000
    4    HG2  PRO  75           HG2      PRO  75 -31.052   6.361  -5.790
    5    HG3  PRO  75           HG3      PRO  75 -32.678   6.885  -6.224
    6    HD2  PRO  75           HD2      PRO  75 -30.639   8.644  -6.198
    7    HD3  PRO  75           HD3      PRO  75 -32.244   9.130  -5.647

  No H/Q in entry =           7
  In of MODEL   75
    1    H    VAL  76           H        VAL  76 -30.440   6.738  -0.999
    2    HA   VAL  76           HA       VAL  76 -28.052   5.398  -2.126
    3    HB   VAL  76           HB       VAL  76 -28.240   6.879   0.533
    4   HG11  VAL  76          HG11      VAL  76 -25.967   5.466  -0.877
    5   HG13  VAL  76          HG12      VAL  76 -26.674   5.055   0.687
    6   HG12  VAL  76          HG13      VAL  76 -25.749   6.545   0.503
    7   HG22  VAL  76          HG21      VAL  76 -27.478   8.741  -0.361
    8   HG21  VAL  76          HG22      VAL  76 -28.070   8.075  -1.884
    9   HG23  VAL  76          HG23      VAL  76 -26.372   7.895  -1.443

  No H/Q in entry =           9
  In of MODEL   75
    1    H    GLU  77           H        GLU  77 -27.946   3.236  -1.513
    2    HA   GLU  77           HA       GLU  77 -28.752   2.493   1.148
    3    HB2  GLU  77           HB2      GLU  77 -30.450   0.933   0.633
    4    HB3  GLU  77           HB3      GLU  77 -30.922   2.483  -0.066
    5    HG2  GLU  77           HG2      GLU  77 -30.372   1.693  -2.258
    6    HG3  GLU  77           HG3      GLU  77 -29.806   0.165  -1.589

  No H/Q in entry =           6
  In of MODEL   75
    1    H    VAL  78           H        VAL  78 -28.531   0.392   1.807
    2    HA   VAL  78           HA       VAL  78 -25.918  -0.521   0.899
    3    HB   VAL  78           HB       VAL  78 -27.651  -1.312   3.279
    4   HG11  VAL  78          HG11      VAL  78 -25.390  -2.664   2.137
    5   HG13  VAL  78          HG12      VAL  78 -26.309  -3.085   3.583
    6   HG12  VAL  78          HG13      VAL  78 -24.929  -1.995   3.701
    7   HG22  VAL  78          HG21      VAL  78 -26.111  -0.027   4.604
    8   HG21  VAL  78          HG22      VAL  78 -26.804   0.979   3.333
    9   HG23  VAL  78          HG23      VAL  78 -25.159   0.364   3.171

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ILE  79           H        ILE  79 -25.490  -2.455  -0.008
    2    HA   ILE  79           HA       ILE  79 -27.637  -3.823  -1.338
    3    HB   ILE  79           HB       ILE  79 -24.677  -4.508  -1.140
    4   HG12  ILE  79          HG12      ILE  79 -26.271  -3.320  -3.417
    5   HG13  ILE  79          HG13      ILE  79 -25.335  -2.356  -2.272
    6   HG22  ILE  79          HG21      ILE  79 -25.859  -5.629  -3.449
    7   HG21  ILE  79          HG22      ILE  79 -26.859  -6.096  -2.073
    8   HG23  ILE  79          HG23      ILE  79 -25.134  -6.467  -2.077
    9   HD13  ILE  79          HD11      ILE  79 -23.944  -2.547  -4.102
   10   HD12  ILE  79          HD12      ILE  79 -24.376  -4.234  -4.377
   11   HD11  ILE  79          HD13      ILE  79 -23.356  -3.798  -3.005

  No H/Q in entry =          11
  In of MODEL   75
    1    H    ASP  80           H        ASP  80 -28.597  -5.697  -0.746
    2    HA   ASP  80           HA       ASP  80 -28.571  -6.597   1.901
    3    HB2  ASP  80           HB2      ASP  80 -30.367  -7.080   0.277
    4    HB3  ASP  80           HB3      ASP  80 -29.271  -8.148  -0.601

  No H/Q in entry =           4
  In of MODEL   75
    1    H    SER  81           H        SER  81 -27.089  -7.811   3.020
    2    HA   SER  81           HA       SER  81 -24.642  -8.626   1.810
    3    HB2  SER  81           HB2      SER  81 -24.129  -9.680   3.977
    4    HB3  SER  81           HB3      SER  81 -24.741  -8.042   4.192
    5    HG   SER  81           HG       SER  81 -26.508 -10.198   4.241

  No H/Q in entry =           5
  In of MODEL   75
    1    H    LEU  82           H        LEU  82 -27.458 -10.569   2.156
    2    HA   LEU  82           HA       LEU  82 -26.042 -13.017   1.627
    3    HB2  LEU  82           HB2      LEU  82 -28.943 -12.247   1.392
    4    HB3  LEU  82           HB3      LEU  82 -28.326 -13.885   1.181
    5    HG   LEU  82           HG       LEU  82 -28.161 -12.304   3.729
    6   HD12  LEU  82          HD11      LEU  82 -29.988 -14.588   2.947
    7   HD11  LEU  82          HD12      LEU  82 -30.483 -12.900   3.082
    8   HD13  LEU  82          HD13      LEU  82 -29.941 -13.777   4.513
    9   HD23  LEU  82          HD21      LEU  82 -27.681 -14.708   4.533
   10   HD22  LEU  82          HD22      LEU  82 -26.396 -13.852   3.681
   11   HD21  LEU  82          HD23      LEU  82 -27.362 -15.060   2.834

  No H/Q in entry =          11
  In of MODEL   75
    1    H    LEU  83           H        LEU  83 -27.894 -10.693  -0.280
    2    HA   LEU  83           HA       LEU  83 -27.786 -12.062  -2.751
    3    HB2  LEU  83           HB2      LEU  83 -28.035  -9.137  -2.103
    4    HB3  LEU  83           HB3      LEU  83 -28.114  -9.781  -3.743
    5    HG   LEU  83           HG       LEU  83 -30.149 -10.056  -1.550
    6   HD13  LEU  83          HD11      LEU  83 -30.813  -8.172  -2.611
    7   HD12  LEU  83          HD12      LEU  83 -31.345  -9.261  -3.891
    8   HD11  LEU  83          HD13      LEU  83 -29.768  -8.478  -3.997
    9   HD23  LEU  83          HD21      LEU  83 -30.376 -11.308  -4.272
   10   HD22  LEU  83          HD22      LEU  83 -31.351 -11.604  -2.834
   11   HD21  LEU  83          HD23      LEU  83 -29.693 -12.197  -2.910

  No H/Q in entry =          11
  In of MODEL   75
    1    H    TYR  84           H        TYR  84 -25.694  -9.783  -1.093
    2    HA   TYR  84           HA       TYR  84 -23.826  -9.398  -3.240
    3    HB2  TYR  84           HB2      TYR  84 -24.249  -7.884  -1.215
    4    HB3  TYR  84           HB3      TYR  84 -23.280  -9.035  -0.297
    5    HD1  TYR  84           HD1      TYR  84 -20.916  -8.984  -0.379
    6    HD2  TYR  84           HD2      TYR  84 -23.180  -6.660  -3.156
    7    HE1  TYR  84           HE1      TYR  84 -18.839  -7.863  -1.117
    8    HE2  TYR  84           HE2      TYR  84 -21.112  -5.540  -3.910
    9    HH   TYR  84           HH       TYR  84 -18.714  -5.101  -2.650

  No H/Q in entry =           9
  In of MODEL   75
    1    H    GLY  85           H        GLY  85 -23.670 -11.406  -0.291
    2    HA3  GLY  85           HA2      GLY  85 -21.150 -12.486  -0.794
    3    HA2  GLY  85           HA3      GLY  85 -22.416 -13.264   0.155

  No H/Q in entry =           3
  In of MODEL   75
    1    H    LYS  86           H        LYS  86 -24.297 -13.541  -1.890
    2    HA   LYS  86           HA       LYS  86 -23.382 -15.970  -3.154
    3    HB2  LYS  86           HB2      LYS  86 -25.600 -15.771  -2.200
    4    HB3  LYS  86           HB3      LYS  86 -25.948 -14.385  -3.231
    5    HG2  LYS  86           HG2      LYS  86 -27.107 -16.346  -3.995
    6    HG3  LYS  86           HG3      LYS  86 -25.901 -15.838  -5.179
    7    HD2  LYS  86           HD2      LYS  86 -24.370 -17.521  -4.475
    8    HD3  LYS  86           HD3      LYS  86 -25.325 -17.882  -3.038
    9    HE2  LYS  86           HE2      LYS  86 -27.109 -18.781  -4.412
   10    HE3  LYS  86           HE3      LYS  86 -26.231 -18.344  -5.877
   11    HZ3  LYS  86           HZ1      LYS  86 -24.488 -19.855  -5.312
   12    HZ2  LYS  86           HZ2      LYS  86 -25.959 -20.700  -5.210
   13    HZ1  LYS  86           HZ3      LYS  86 -25.178 -20.182  -3.794

  No H/Q in entry =          13
  In of MODEL   75
    1    H    VAL  87           H        VAL  87 -23.206 -12.761  -4.053
    2    HA   VAL  87           HA       VAL  87 -22.861 -11.609  -5.998
    3    HB   VAL  87           HB       VAL  87 -21.941 -14.171  -7.330
    4   HG11  VAL  87          HG11      VAL  87 -22.016 -11.776  -8.383
    5   HG13  VAL  87          HG12      VAL  87 -20.565 -12.756  -8.599
    6   HG12  VAL  87          HG13      VAL  87 -20.596 -11.480  -7.382
    7   HG22  VAL  87          HG21      VAL  87 -20.945 -14.304  -5.145
    8   HG21  VAL  87          HG22      VAL  87 -20.421 -12.625  -5.241
    9   HG23  VAL  87          HG23      VAL  87 -19.714 -13.832  -6.313

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ASP  88           H        ASP  88 -25.405 -12.115  -5.625
    2    HA   ASP  88           HA       ASP  88 -26.609 -13.274  -8.011
    3    HB2  ASP  88           HB2      ASP  88 -27.597 -13.463  -5.678
    4    HB3  ASP  88           HB3      ASP  88 -27.959 -11.739  -5.777

  No H/Q in entry =           4
  In of MODEL   75
    1    H    GLY  89           H        GLY  89 -25.853 -12.057  -9.661
    2    HA3  GLY  89           HA2      GLY  89 -25.889  -9.280  -9.865
    3    HA2  GLY  89           HA3      GLY  89 -25.936 -10.402 -11.224

  No H/Q in entry =           3
  In of MODEL   75
    1    H    LEU  90           H        LEU  90 -28.447 -11.623 -10.752
    2    HA   LEU  90           HA       LEU  90 -30.163  -9.597 -11.854
    3    HB2  LEU  90           HB2      LEU  90 -30.359 -11.987 -12.428
    4    HB3  LEU  90           HB3      LEU  90 -30.869 -12.323 -10.774
    5    HG   LEU  90           HG       LEU  90 -32.929 -11.097 -11.122
    6   HD13  LEU  90          HD11      LEU  90 -32.671  -9.370 -12.601
    7   HD12  LEU  90          HD12      LEU  90 -33.284 -10.579 -13.732
    8   HD11  LEU  90          HD13      LEU  90 -31.552 -10.275 -13.624
    9   HD23  LEU  90          HD21      LEU  90 -32.967 -12.732 -13.554
   10   HD22  LEU  90          HD22      LEU  90 -33.941 -12.843 -12.088
   11   HD21  LEU  90          HD23      LEU  90 -32.321 -13.541 -12.126

  No H/Q in entry =          11
  In of MODEL   75
    1    H    GLY  91           H        GLY  91 -30.046 -11.099  -8.669
    2    HA3  GLY  91           HA2      GLY  91 -32.314  -9.864  -7.610
    3    HA2  GLY  91           HA3      GLY  91 -30.944 -10.467  -6.680

  No H/Q in entry =           3
  In of MODEL   75
    1    H    VAL  92           H        VAL  92 -28.940  -8.745  -7.557
    2    HA   VAL  92           HA       VAL  92 -29.596  -6.403  -6.005
    3    HB   VAL  92           HB       VAL  92 -27.092  -7.008  -7.622
    4   HG12  VAL  92          HG11      VAL  92 -27.137  -5.113  -5.298
    5   HG11  VAL  92          HG12      VAL  92 -27.786  -4.538  -6.835
    6   HG13  VAL  92          HG13      VAL  92 -26.116  -5.094  -6.737
    7   HG22  VAL  92          HG21      VAL  92 -26.938  -8.602  -6.028
    8   HG21  VAL  92          HG22      VAL  92 -28.031  -7.762  -4.927
    9   HG23  VAL  92          HG23      VAL  92 -26.349  -7.249  -5.064

  No H/Q in entry =           9
  In of MODEL   75
    1    H    LEU  93           H        LEU  93 -29.254  -7.091  -9.427
    2    HA   LEU  93           HA       LEU  93 -29.470  -4.443 -10.360
    3    HB2  LEU  93           HB2      LEU  93 -28.939  -6.331 -11.823
    4    HB3  LEU  93           HB3      LEU  93 -30.563  -6.975 -11.585
    5    HG   LEU  93           HG       LEU  93 -31.481  -4.963 -12.704
    6   HD11  LEU  93          HD11      LEU  93 -29.545  -3.465 -12.220
    7   HD13  LEU  93          HD12      LEU  93 -30.001  -3.475 -13.924
    8   HD12  LEU  93          HD13      LEU  93 -28.591  -4.384 -13.384
    9   HD23  LEU  93          HD21      LEU  93 -30.494  -5.587 -14.999
   10   HD22  LEU  93          HD22      LEU  93 -31.392  -6.796 -14.083
   11   HD21  LEU  93          HD23      LEU  93 -29.628  -6.833 -14.101

  No H/Q in entry =          11
  In of MODEL   75
    1    H    LYS  94           H        LYS  94 -31.967  -6.860  -9.484
    2    HA   LYS  94           HA       LYS  94 -34.238  -5.299 -10.091
    3    HB2  LYS  94           HB2      LYS  94 -33.821  -7.504  -8.078
    4    HB3  LYS  94           HB3      LYS  94 -35.382  -6.726  -8.334
    5    HG2  LYS  94           HG2      LYS  94 -35.358  -7.509 -10.667
    6    HG3  LYS  94           HG3      LYS  94 -33.835  -8.341 -10.351
    7    HD2  LYS  94           HD2      LYS  94 -35.007  -9.611  -8.514
    8    HD3  LYS  94           HD3      LYS  94 -36.519  -8.884  -9.056
    9    HE2  LYS  94           HE2      LYS  94 -36.074  -9.843 -11.326
   10    HE3  LYS  94           HE3      LYS  94 -34.695 -10.698 -10.633
   11    HZ3  LYS  94           HZ1      LYS  94 -36.624 -12.121 -10.783
   12    HZ2  LYS  94           HZ2      LYS  94 -37.534 -11.044  -9.835
   13    HZ1  LYS  94           HZ3      LYS  94 -36.209 -11.861  -9.157

  No H/Q in entry =          13
  In of MODEL   75
    1    H    ALA  95           H        ALA  95 -32.396  -5.509  -7.058
    2    HA   ALA  95           HA       ALA  95 -34.146  -3.832  -5.565
    3    HB2  ALA  95           HB1      ALA  95 -31.841  -5.329  -5.047
    4    HB3  ALA  95           HB2      ALA  95 -32.760  -4.372  -3.887
    5    HB1  ALA  95           HB3      ALA  95 -31.381  -3.658  -4.721

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ALA  96           H        ALA  96 -31.483  -3.122  -7.688
    2    HA   ALA  96           HA       ALA  96 -31.235  -0.368  -6.921
    3    HB2  ALA  96           HB1      ALA  96 -29.883  -0.216  -9.042
    4    HB3  ALA  96           HB2      ALA  96 -30.278  -1.906  -9.356
    5    HB1  ALA  96           HB3      ALA  96 -29.326  -1.473  -7.937

  No H/Q in entry =           5
  In of MODEL   75
    1    H    VAL  97           H        VAL  97 -32.879  -2.004  -9.590
    2    HA   VAL  97           HA       VAL  97 -33.838   0.348 -10.841
    3    HB   VAL  97           HB       VAL  97 -34.802  -2.530 -10.870
    4   HG11  VAL  97          HG11      VAL  97 -36.489  -0.432 -11.343
    5   HG13  VAL  97          HG12      VAL  97 -36.639  -2.020 -12.096
    6   HG12  VAL  97          HG13      VAL  97 -35.823  -0.714 -12.953
    7   HG21  VAL  97          HG21      VAL  97 -33.445  -0.776 -12.920
    8   HG23  VAL  97          HG22      VAL  97 -33.990  -2.430 -13.202
    9   HG22  VAL  97          HG23      VAL  97 -32.711  -2.108 -12.028

  No H/Q in entry =           9
  In of MODEL   75
    1    H    ALA  98           H        ALA  98 -35.111  -1.761  -8.289
    2    HA   ALA  98           HA       ALA  98 -37.603  -0.476  -7.917
    3    HB1  ALA  98           HB1      ALA  98 -36.700  -2.725  -6.889
    4    HB3  ALA  98           HB2      ALA  98 -37.821  -1.738  -5.949
    5    HB2  ALA  98           HB3      ALA  98 -36.091  -1.681  -5.605

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ALA  99           H        ALA  99 -34.471   0.157  -6.299
    2    HA   ALA  99           HA       ALA  99 -35.476   2.201  -4.630
    3    HB1  ALA  99           HB1      ALA  99 -32.887   1.169  -5.400
    4    HB2  ALA  99           HB2      ALA  99 -33.382   1.949  -3.898
    5    HB3  ALA  99           HB3      ALA  99 -32.864   2.927  -5.270

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ILE 100           H        ILE 100 -34.461   2.271  -7.996
    2    HA   ILE 100           HA       ILE 100 -34.485   5.126  -8.217
    3    HB   ILE 100           HB       ILE 100 -34.719   2.977 -10.352
    4   HG12  ILE 100          HG12      ILE 100 -32.443   4.848  -9.704
    5   HG13  ILE 100          HG13      ILE 100 -32.564   3.206  -9.070
    6   HG21  ILE 100          HG21      ILE 100 -34.982   5.915 -10.483
    7   HG23  ILE 100          HG22      ILE 100 -35.566   4.675 -11.592
    8   HG22  ILE 100          HG23      ILE 100 -33.884   5.199 -11.663
    9   HD12  ILE 100          HD11      ILE 100 -32.005   4.131 -11.851
   10   HD11  ILE 100          HD12      ILE 100 -32.751   2.554 -11.588
   11   HD13  ILE 100          HD13      ILE 100 -31.176   2.913 -10.882

  No H/Q in entry =          11
  In of MODEL   75
    1    H    LYS 101           H        LYS 101 -36.926   2.645  -8.918
    2    HA   LYS 101           HA       LYS 101 -38.922   4.406  -9.901
    3    HB2  LYS 101           HB2      LYS 101 -38.949   1.630  -8.772
    4    HB3  LYS 101           HB3      LYS 101 -40.459   2.477  -9.104
    5    HG2  LYS 101           HG2      LYS 101 -40.000   2.583 -11.406
    6    HG3  LYS 101           HG3      LYS 101 -38.327   2.085 -11.166
    7    HD2  LYS 101           HD2      LYS 101 -39.688   0.249 -12.038
    8    HD3  LYS 101           HD3      LYS 101 -39.065  -0.115 -10.429
    9    HE2  LYS 101           HE2      LYS 101 -41.159  -0.695  -9.903
   10    HE3  LYS 101           HE3      LYS 101 -41.520   1.032  -9.904
   11    HZ3  LYS 101           HZ1      LYS 101 -42.439   0.923 -12.012
   12    HZ2  LYS 101           HZ2      LYS 101 -42.973  -0.522 -11.300
   13    HZ1  LYS 101           HZ3      LYS 101 -41.676  -0.546 -12.395

  No H/Q in entry =          13
  In of MODEL   75
    1    H    LYS 102           H        LYS 102 -38.483   2.905  -6.696
    2    HA   LYS 102           HA       LYS 102 -40.650   4.223  -5.479
    3    HB2  LYS 102           HB2      LYS 102 -39.510   2.291  -4.473
    4    HB3  LYS 102           HB3      LYS 102 -38.061   3.269  -4.244
    5    HG2  LYS 102           HG2      LYS 102 -39.284   4.735  -2.736
    6    HG3  LYS 102           HG3      LYS 102 -40.737   3.762  -2.968
    7    HD2  LYS 102           HD2      LYS 102 -39.606   1.831  -1.952
    8    HD3  LYS 102           HD3      LYS 102 -38.155   2.806  -1.717
    9    HE2  LYS 102           HE2      LYS 102 -39.412   4.356  -0.298
   10    HE3  LYS 102           HE3      LYS 102 -40.880   3.414  -0.552
   11    HZ1  LYS 102           HZ1      LYS 102 -39.251   1.568   0.437
   12    HZ3  LYS 102           HZ2      LYS 102 -40.301   2.513   1.376
   13    HZ2  LYS 102           HZ3      LYS 102 -38.665   2.947   1.234

  No H/Q in entry =          13
  In of MODEL   75
    1    H    ALA 103           H        ALA 103 -37.633   5.450  -6.519
    2    HA   ALA 103           HA       ALA 103 -37.712   7.773  -4.736
    3    HB2  ALA 103           HB1      ALA 103 -35.698   8.396  -6.330
    4    HB3  ALA 103           HB2      ALA 103 -35.760   6.679  -6.727
    5    HB1  ALA 103           HB3      ALA 103 -35.490   7.190  -5.061

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ALA 104           H        ALA 104 -38.401   7.077  -8.076
    2    HA   ALA 104           HA       ALA 104 -38.838   9.889  -8.695
    3    HB2  ALA 104           HB1      ALA 104 -38.938   9.225 -10.897
    4    HB1  ALA 104           HB2      ALA 104 -39.746   7.705 -10.512
    5    HB3  ALA 104           HB3      ALA 104 -38.009   7.874 -10.248

  No H/Q in entry =           5
  In of MODEL   75
    1    H    ALA 105           H        ALA 105 -40.544   7.877  -6.875
    2    HA   ALA 105           HA       ALA 105 -42.888   9.402  -6.828
    3    HB2  ALA 105           HB1      ALA 105 -43.697   8.585  -8.860
    4    HB3  ALA 105           HB2      ALA 105 -44.388   7.434  -7.717
    5    HB1  ALA 105           HB3      ALA 105 -42.948   7.004  -8.639

  No H/Q in entry =           5
  In of MODEL   76
    1    H1   ALA   1           H3       ALA   1 -12.364 -15.627  -2.095
    2    H2   ALA   1           H2       ALA   1 -11.442 -16.764  -2.962
    3    H3   ALA   1           H1       ALA   1 -12.601 -15.812  -3.766
    4    HA   ALA   1           HA       ALA   1 -13.997 -17.511  -3.510
    5    HB3  ALA   1           HB1      ALA   1 -12.596 -19.289  -3.089
    6    HB1  ALA   1           HB2      ALA   1 -13.320 -19.186  -1.484
    7    HB2  ALA   1           HB3      ALA   1 -11.749 -18.447  -1.791

  No H/Q in entry =           7
  In of MODEL   76
    1    H    GLU   2           H        GLU   2 -15.589 -18.375  -1.830
    2    HA   GLU   2           HA       GLU   2 -17.212 -16.659  -0.726
    3    HB2  GLU   2           HB2      GLU   2 -16.247 -19.097   0.782
    4    HB3  GLU   2           HB3      GLU   2 -17.764 -18.246   1.073
    5    HG2  GLU   2           HG2      GLU   2 -18.780 -19.318  -0.649
    6    HG3  GLU   2           HG3      GLU   2 -17.478 -18.912  -1.757

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLU   3           H        GLU   3 -15.250 -18.035   1.848
    2    HA   GLU   3           HA       GLU   3 -15.436 -15.692   3.427
    3    HB2  GLU   3           HB2      GLU   3 -13.851 -18.243   3.627
    4    HB3  GLU   3           HB3      GLU   3 -13.594 -16.932   4.779
    5    HG2  GLU   3           HG2      GLU   3 -15.771 -17.086   5.640
    6    HG3  GLU   3           HG3      GLU   3 -16.396 -17.874   4.197

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LEU   4           H        LEU   4 -12.512 -17.166   1.966
    2    HA   LEU   4           HA       LEU   4 -10.663 -15.271   2.542
    3    HB2  LEU   4           HB2      LEU   4 -10.950 -16.548  -0.187
    4    HB3  LEU   4           HB3      LEU   4  -9.483 -15.836   0.474
    5    HG   LEU   4           HG       LEU   4 -10.960 -18.238   1.599
    6   HD13  LEU   4          HD11      LEU   4  -9.349 -19.590   0.627
    7   HD12  LEU   4          HD12      LEU   4  -8.137 -18.309   0.586
    8   HD11  LEU   4          HD13      LEU   4  -9.450 -18.320  -0.591
    9   HD23  LEU   4          HD21      LEU   4  -8.682 -18.316   2.935
   10   HD22  LEU   4          HD22      LEU   4  -9.990 -17.277   3.497
   11   HD21  LEU   4          HD23      LEU   4  -8.644 -16.585   2.593

  No H/Q in entry =          11
  In of MODEL   76
    1    H    GLU   5           H        GLU   5 -13.050 -15.040  -0.084
    2    HA   GLU   5           HA       GLU   5 -12.061 -12.551  -1.087
    3    HB2  GLU   5           HB2      GLU   5 -13.436 -14.124  -2.434
    4    HB3  GLU   5           HB3      GLU   5 -14.816 -13.768  -1.393
    5    HG2  GLU   5           HG2      GLU   5 -14.704 -11.397  -2.021
    6    HG3  GLU   5           HG3      GLU   5 -13.293 -11.720  -3.029

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLU   6           H        GLU   6 -14.746 -13.439   1.053
    2    HA   GLU   6           HA       GLU   6 -15.637 -10.764   1.489
    3    HB2  GLU   6           HB2      GLU   6 -17.021 -12.814   1.900
    4    HB3  GLU   6           HB3      GLU   6 -15.999 -13.169   3.292
    5    HG2  GLU   6           HG2      GLU   6 -17.816 -11.991   4.226
    6    HG3  GLU   6           HG3      GLU   6 -16.562 -10.764   4.065

  No H/Q in entry =           6
  In of MODEL   76
    1    H    VAL   7           H        VAL   7 -13.303 -12.890   3.000
    2    HA   VAL   7           HA       VAL   7 -12.787 -11.333   5.328
    3    HB   VAL   7           HB       VAL   7 -11.118 -13.370   3.831
    4   HG11  VAL   7          HG11      VAL   7 -10.595 -11.856   6.396
    5   HG13  VAL   7          HG12      VAL   7  -9.523 -12.063   5.012
    6   HG12  VAL   7          HG13      VAL   7  -9.858 -13.427   6.079
    7   HG21  VAL   7          HG21      VAL   7 -13.345 -13.938   5.091
    8   HG23  VAL   7          HG22      VAL   7 -12.388 -13.676   6.550
    9   HG22  VAL   7          HG23      VAL   7 -11.920 -14.929   5.402

  No H/Q in entry =           9
  In of MODEL   76
    1    H    VAL   8           H        VAL   8 -11.340 -11.428   2.088
    2    HA   VAL   8           HA       VAL   8  -9.264  -9.563   2.554
    3    HB   VAL   8           HB       VAL   8 -10.763 -10.359   0.057
    4   HG11  VAL   8          HG11      VAL   8  -8.585  -8.300   0.447
    5   HG13  VAL   8          HG12      VAL   8 -10.107  -8.130  -0.428
    6   HG12  VAL   8          HG13      VAL   8  -8.812  -9.124  -1.096
    7   HG21  VAL   8          HG21      VAL   8  -8.466 -11.367   1.539
    8   HG23  VAL   8          HG22      VAL   8  -7.978 -10.887  -0.085
    9   HG22  VAL   8          HG23      VAL   8  -9.260 -12.074   0.131

  No H/Q in entry =           9
  In of MODEL   76
    1    H    MET   9           H        MET   9 -12.631  -9.158   1.462
    2    HA   MET   9           HA       MET   9 -12.570  -6.378   1.046
    3    HB2  MET   9           HB2      MET   9 -14.748  -8.295   1.844
    4    HB3  MET   9           HB3      MET   9 -15.061  -6.559   1.775
    5    HG2  MET   9           HG2      MET   9 -14.057  -6.628  -0.583
    6    HG3  MET   9           HG3      MET   9 -14.190  -8.384  -0.470
    7    HE3  MET   9           HE1      MET   9 -17.700  -9.320  -0.641
    8    HE2  MET   9           HE2      MET   9 -16.974  -9.105   0.948
    9    HE1  MET   9           HE3      MET   9 -15.994  -9.709  -0.385

  No H/Q in entry =           9
  In of MODEL   76
    1    H    GLY  10           H        GLY  10 -13.179  -8.289   3.973
    2    HA3  GLY  10           HA2      GLY  10 -13.689  -6.115   5.717
    3    HA2  GLY  10           HA3      GLY  10 -13.118  -7.709   6.209

  No H/Q in entry =           3
  In of MODEL   76
    1    H    LEU  11           H        LEU  11 -10.699  -7.828   4.845
    2    HA   LEU  11           HA       LEU  11  -8.961  -6.410   6.578
    3    HB2  LEU  11           HB2      LEU  11  -8.468  -7.816   3.951
    4    HB3  LEU  11           HB3      LEU  11  -7.178  -7.121   4.929
    5    HG   LEU  11           HG       LEU  11  -9.163  -9.158   5.970
    6   HD13  LEU  11          HD11      LEU  11  -7.975 -10.385   4.373
    7   HD12  LEU  11          HD12      LEU  11  -7.011 -10.636   5.828
    8   HD11  LEU  11          HD13      LEU  11  -6.492  -9.463   4.618
    9   HD22  LEU  11          HD21      LEU  11  -8.270  -8.160   7.877
   10   HD21  LEU  11          HD22      LEU  11  -6.747  -7.755   7.087
   11   HD23  LEU  11          HD23      LEU  11  -7.066  -9.414   7.591

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  12           H        ILE  12  -9.929  -5.837   3.211
    2    HA   ILE  12           HA       ILE  12  -8.242  -3.607   2.767
    3    HB   ILE  12           HB       ILE  12 -10.922  -4.261   1.519
    4   HG12  ILE  12          HG12      ILE  12  -8.892  -5.920   1.396
    5   HG13  ILE  12          HG13      ILE  12  -9.785  -5.555  -0.066
    6   HG23  ILE  12          HG21      ILE  12 -10.362  -1.944   1.071
    7   HG22  ILE  12          HG22      ILE  12 -10.008  -2.861  -0.387
    8   HG21  ILE  12          HG23      ILE  12  -8.726  -2.382   0.688
    9   HD12  ILE  12          HD11      ILE  12  -7.285  -5.512  -0.327
   10   HD11  ILE  12          HD12      ILE  12  -7.245  -4.149   0.791
   11   HD13  ILE  12          HD13      ILE  12  -8.060  -3.995  -0.747

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  13           H        ILE  13 -11.581  -3.878   3.924
    2    HA   ILE  13           HA       ILE  13 -12.033  -1.092   4.222
    3    HB   ILE  13           HB       ILE  13 -13.213  -3.523   5.588
    4   HG12  ILE  13          HG12      ILE  13 -13.502  -3.016   3.075
    5   HG13  ILE  13          HG13      ILE  13 -14.936  -3.374   4.012
    6   HG22  ILE  13          HG21      ILE  13 -15.067  -1.966   6.296
    7   HG21  ILE  13          HG22      ILE  13 -14.050  -0.609   5.829
    8   HG23  ILE  13          HG23      ILE  13 -13.542  -1.682   7.130
    9   HD11  ILE  13          HD11      ILE  13 -14.185  -0.511   3.917
   10   HD13  ILE  13          HD12      ILE  13 -15.759  -1.278   3.813
   11   HD12  ILE  13          HD13      ILE  13 -14.736  -1.221   2.395

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ASN  14           H        ASN  14 -10.880  -3.600   6.457
    2    HA   ASN  14           HA       ASN  14 -10.633  -1.978   8.750
    3    HB2  ASN  14           HB2      ASN  14 -10.388  -4.583   8.405
    4    HB3  ASN  14           HB3      ASN  14  -8.682  -4.196   8.217
    5   HD21  ASN  14          HD21      ASN  14  -9.277  -5.735  10.394
    6   HD22  ASN  14          HD22      ASN  14  -9.221  -4.825  11.824

  No H/Q in entry =           6
  In of MODEL   76
    1    H    SER  15           H        SER  15  -8.280  -2.785   6.206
    2    HA   SER  15           HA       SER  15  -6.116  -1.300   7.246
    3    HB2  SER  15           HB2      SER  15  -5.137  -1.502   5.068
    4    HB3  SER  15           HB3      SER  15  -6.091  -2.963   5.299
    5    HG   SER  15           HG       SER  15  -7.329  -2.368   3.721

  No H/Q in entry =           5
  In of MODEL   76
    1    H    GLY  16           H        GLY  16  -8.760  -0.418   5.056
    2    HA3  GLY  16           HA2      GLY  16  -7.913   2.227   4.507
    3    HA2  GLY  16           HA3      GLY  16  -9.566   1.633   4.373

  No H/Q in entry =           3
  In of MODEL   76
    1    H    GLN  17           H        GLN  17 -10.058   0.890   7.027
    2    HA   GLN  17           HA       GLN  17 -10.743   3.386   8.199
    3    HB2  GLN  17           HB2      GLN  17 -11.968   1.302   8.697
    4    HB3  GLN  17           HB3      GLN  17 -10.544   0.666   9.520
    5    HG2  GLN  17           HG2      GLN  17 -10.632   2.506  11.140
    6    HG3  GLN  17           HG3      GLN  17 -12.018   3.199  10.299
    7   HE21  GLN  17          HE21      GLN  17 -12.228   2.436  13.036
    8   HE22  GLN  17          HE22      GLN  17 -13.266   1.097  13.145

  No H/Q in entry =           8
  In of MODEL   76
    1    H    ALA  18           H        ALA  18  -8.102   1.102   8.751
    2    HA   ALA  18           HA       ALA  18  -6.961   2.303  11.009
    3    HB2  ALA  18           HB1      ALA  18  -6.376   0.097   9.614
    4    HB3  ALA  18           HB2      ALA  18  -5.193   0.873  10.668
    5    HB1  ALA  18           HB3      ALA  18  -5.150   1.164   8.928

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ARG  19           H        ARG  19  -6.257   2.851   7.549
    2    HA   ARG  19           HA       ARG  19  -4.352   4.897   7.955
    3    HB2  ARG  19           HB2      ARG  19  -4.721   3.771   5.759
    4    HB3  ARG  19           HB3      ARG  19  -6.268   4.611   5.617
    5    HG2  ARG  19           HG2      ARG  19  -5.140   6.783   5.679
    6    HG3  ARG  19           HG3      ARG  19  -3.585   5.998   5.947
    7    HD2  ARG  19           HD2      ARG  19  -3.755   6.604   3.611
    8    HD3  ARG  19           HD3      ARG  19  -3.836   4.843   3.746
    9    HE   ARG  19           HE       ARG  19  -6.470   5.749   3.796
   10   HH21  ARG  19          HH11      ARG  19  -7.702   5.917   1.903
   11   HH22  ARG  19          HH12      ARG  19  -6.910   6.006   0.368
   12   HH11  ARG  19          HH21      ARG  19  -3.735   5.829   1.709
   13   HH12  ARG  19          HH22      ARG  19  -4.662   5.954   0.258

  No H/Q in entry =          13
  In of MODEL   76
    1    H    SER  20           H        SER  20  -7.862   5.012   7.424
    2    HA   SER  20           HA       SER  20  -8.223   7.767   7.401
    3    HB2  SER  20           HB2      SER  20  -9.951   5.879   7.058
    4    HB3  SER  20           HB3      SER  20 -10.139   5.923   8.810
    5    HG   SER  20           HG       SER  20 -10.547   8.199   8.566

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LEU  21           H        LEU  21  -8.166   5.565  10.190
    2    HA   LEU  21           HA       LEU  21  -8.572   7.547  12.176
    3    HB2  LEU  21           HB2      LEU  21  -7.212   4.848  12.292
    4    HB3  LEU  21           HB3      LEU  21  -7.497   5.855  13.709
    5    HG   LEU  21           HG       LEU  21  -9.703   4.974  11.823
    6   HD12  LEU  21          HD11      LEU  21  -8.896   3.760  14.482
    7   HD11  LEU  21          HD12      LEU  21  -8.595   3.028  12.906
    8   HD13  LEU  21          HD13      LEU  21 -10.251   3.255  13.471
    9   HD22  LEU  21          HD21      LEU  21 -10.590   6.769  13.029
   10   HD21  LEU  21          HD22      LEU  21  -9.593   6.458  14.448
   11   HD23  LEU  21          HD23      LEU  21 -10.984   5.439  14.114

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ALA  22           H        ALA  22  -5.645   6.189  10.703
    2    HA   ALA  22           HA       ALA  22  -3.737   7.495  12.297
    3    HB2  ALA  22           HB1      ALA  22  -3.350   5.654  10.586
    4    HB1  ALA  22           HB2      ALA  22  -2.156   6.952  10.607
    5    HB3  ALA  22           HB3      ALA  22  -3.398   6.914   9.354

  No H/Q in entry =           5
  In of MODEL   76
    1    H    TYR  23           H        TYR  23  -5.116   8.531   9.147
    2    HA   TYR  23           HA       TYR  23  -3.787  11.030   9.069
    3    HB2  TYR  23           HB2      TYR  23  -4.904  10.129   7.092
    4    HB3  TYR  23           HB3      TYR  23  -6.467  10.229   7.904
    5    HD1  TYR  23           HD1      TYR  23  -3.591  12.280   6.703
    6    HD2  TYR  23           HD2      TYR  23  -7.707  12.241   7.929
    7    HE1  TYR  23           HE1      TYR  23  -3.833  14.634   5.961
    8    HE2  TYR  23           HE2      TYR  23  -7.950  14.595   7.187
    9    HH   TYR  23           HH       TYR  23  -5.194  16.371   5.778

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ALA  24           H        ALA  24  -6.877  10.037  10.500
    2    HA   ALA  24           HA       ALA  24  -7.704  12.620  11.305
    3    HB1  ALA  24           HB1      ALA  24  -9.511  11.362  11.798
    4    HB2  ALA  24           HB2      ALA  24  -8.657  10.782  13.226
    5    HB3  ALA  24           HB3      ALA  24  -8.558   9.881  11.715

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ALA  25           H        ALA  25  -5.668  10.155  12.824
    2    HA   ALA  25           HA       ALA  25  -5.285  11.392  15.327
    3    HB2  ALA  25           HB1      ALA  25  -4.529   9.047  14.476
    4    HB3  ALA  25           HB2      ALA  25  -3.494   9.900  15.623
    5    HB1  ALA  25           HB3      ALA  25  -3.090   9.895  13.906

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LEU  26           H        LEU  26  -3.553  11.715  12.256
    2    HA   LEU  26           HA       LEU  26  -1.581  13.533  13.147
    3    HB2  LEU  26           HB2      LEU  26  -1.317  12.396  11.030
    4    HB3  LEU  26           HB3      LEU  26  -2.804  13.105  10.408
    5    HG   LEU  26           HG       LEU  26  -1.791  15.356  10.539
    6   HD12  LEU  26          HD11      LEU  26   0.755  15.378  10.905
    7   HD11  LEU  26          HD12      LEU  26   0.549  13.792  11.643
    8   HD13  LEU  26          HD13      LEU  26  -0.249  15.201  12.344
    9   HD21  LEU  26          HD21      LEU  26  -0.071  13.315   9.098
   10   HD23  LEU  26          HD22      LEU  26  -0.124  15.038   8.740
   11   HD22  LEU  26          HD23      LEU  26  -1.551  14.040   8.472

  No H/Q in entry =          11
  In of MODEL   76
    1    H    LYS  27           H        LYS  27  -4.791  14.019  11.733
    2    HA   LYS  27           HA       LYS  27  -4.744  16.809  11.553
    3    HB2  LYS  27           HB2      LYS  27  -6.504  15.335  10.591
    4    HB3  LYS  27           HB3      LYS  27  -7.130  15.067  12.217
    5    HG2  LYS  27           HG2      LYS  27  -7.559  17.471  12.477
    6    HG3  LYS  27           HG3      LYS  27  -6.881  17.779  10.875
    7    HD2  LYS  27           HD2      LYS  27  -8.631  16.349   9.863
    8    HD3  LYS  27           HD3      LYS  27  -9.314  16.057  11.464
    9    HE2  LYS  27           HE2      LYS  27  -9.756  18.466  11.732
   10    HE3  LYS  27           HE3      LYS  27  -9.044  18.779  10.145
   11    HZ3  LYS  27           HZ1      LYS  27 -11.426  18.652   9.948
   12    HZ2  LYS  27           HZ2      LYS  27 -11.457  17.131  10.708
   13    HZ1  LYS  27           HZ3      LYS  27 -10.741  17.305   9.174

  No H/Q in entry =          13
  In of MODEL   76
    1    H    GLN  28           H        GLN  28  -5.578  14.703  14.282
    2    HA   GLN  28           HA       GLN  28  -6.442  16.694  16.089
    3    HB2  GLN  28           HB2      GLN  28  -5.032  14.058  16.581
    4    HB3  GLN  28           HB3      GLN  28  -5.737  15.055  17.854
    5    HG2  GLN  28           HG2      GLN  28  -7.279  13.995  15.471
    6    HG3  GLN  28           HG3      GLN  28  -7.267  13.236  17.062
    7   HE21  GLN  28          HE21      GLN  28  -7.317  15.648  18.655
    8   HE22  GLN  28          HE22      GLN  28  -8.827  16.388  18.423

  No H/Q in entry =           8
  In of MODEL   76
    1    H    ALA  29           H        ALA  29  -3.236  15.405  15.329
    2    HA   ALA  29           HA       ALA  29  -1.761  16.791  17.289
    3    HB1  ALA  29           HB1      ALA  29   0.148  16.109  16.129
    4    HB3  ALA  29           HB2      ALA  29  -0.636  16.243  14.555
    5    HB2  ALA  29           HB3      ALA  29  -1.037  14.903  15.629

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LYS  30           H        LYS  30  -2.683  17.692  13.983
    2    HA   LYS  30           HA       LYS  30  -1.273  20.132  13.872
    3    HB2  LYS  30           HB2      LYS  30  -3.831  19.270  12.506
    4    HB3  LYS  30           HB3      LYS  30  -3.003  20.786  12.156
    5    HG2  LYS  30           HG2      LYS  30  -0.944  19.495  11.594
    6    HG3  LYS  30           HG3      LYS  30  -1.848  17.998  11.846
    7    HD2  LYS  30           HD2      LYS  30  -3.445  18.652  10.087
    8    HD3  LYS  30           HD3      LYS  30  -2.565  20.161   9.837
    9    HE2  LYS  30           HE2      LYS  30  -0.546  18.870   9.210
   10    HE3  LYS  30           HE3      LYS  30  -1.446  17.366   9.429
   11    HZ2  LYS  30           HZ1      LYS  30  -1.313  18.253   7.090
   12    HZ1  LYS  30           HZ2      LYS  30  -2.346  19.514   7.587
   13    HZ3  LYS  30           HZ3      LYS  30  -2.871  17.897   7.657

  No H/Q in entry =          13
  In of MODEL   76
    1    H    GLN  31           H        GLN  31  -4.347  19.276  15.338
    2    HA   GLN  31           HA       GLN  31  -5.096  22.031  15.823
    3    HB2  GLN  31           HB2      GLN  31  -6.254  19.578  17.152
    4    HB3  GLN  31           HB3      GLN  31  -7.015  21.152  16.932
    5    HG2  GLN  31           HG2      GLN  31  -6.357  20.392  14.323
    6    HG3  GLN  31           HG3      GLN  31  -6.871  18.883  15.070
    7   HE21  GLN  31          HE21      GLN  31  -8.318  20.475  13.007
    8   HE22  GLN  31          HE22      GLN  31  -9.817  20.865  13.697

  No H/Q in entry =           8
  In of MODEL   76
    1    H    GLY  32           H        GLY  32  -2.763  20.089  17.085
    2    HA3  GLY  32           HA2      GLY  32  -1.326  20.535  18.862
    3    HA2  GLY  32           HA3      GLY  32  -2.442  21.777  19.417

  No H/Q in entry =           3
  In of MODEL   76
    1    H    ASP  33           H        ASP  33  -3.885  18.746  18.761
    2    HA   ASP  33           HA       ASP  33  -4.241  18.269  21.646
    3    HB2  ASP  33           HB2      ASP  33  -5.698  17.278  19.189
    4    HB3  ASP  33           HB3      ASP  33  -6.013  16.657  20.807

  No H/Q in entry =           4
  In of MODEL   76
    1    H    PHE  34           H        PHE  34  -2.069  17.410  21.902
    2    HA   PHE  34           HA       PHE  34  -1.103  15.168  20.466
    3    HB2  PHE  34           HB2      PHE  34  -0.428  16.131  23.255
    4    HB3  PHE  34           HB3      PHE  34   0.480  14.911  22.361
    5    HD1  PHE  34           HD1      PHE  34   0.332  18.332  23.124
    6    HD2  PHE  34           HD2      PHE  34   1.091  15.650  19.854
    7    HE1  PHE  34           HE1      PHE  34   1.609  20.108  21.957
    8    HE2  PHE  34           HE2      PHE  34   2.364  17.429  18.693
    9    HZ   PHE  34           HZ       PHE  34   2.625  19.655  19.749

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ALA  35           H        ALA  35  -3.085  15.430  23.371
    2    HA   ALA  35           HA       ALA  35  -2.863  12.761  24.244
    3    HB3  ALA  35           HB1      ALA  35  -5.302  13.388  25.153
    4    HB1  ALA  35           HB2      ALA  35  -4.773  15.008  24.699
    5    HB2  ALA  35           HB3      ALA  35  -3.838  14.073  25.865

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ALA  36           H        ALA  36  -5.349  14.300  22.203
    2    HA   ALA  36           HA       ALA  36  -6.781  11.896  21.736
    3    HB1  ALA  36           HB1      ALA  36  -8.251  13.329  20.819
    4    HB3  ALA  36           HB2      ALA  36  -7.102  13.755  19.550
    5    HB2  ALA  36           HB3      ALA  36  -7.094  14.632  21.081

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ALA  37           H        ALA  37  -4.129  13.488  20.027
    2    HA   ALA  37           HA       ALA  37  -4.144  11.869  17.717
    3    HB3  ALA  37           HB1      ALA  37  -2.119  13.565  19.113
    4    HB2  ALA  37           HB2      ALA  37  -2.682  13.634  17.444
    5    HB1  ALA  37           HB3      ALA  37  -1.522  12.397  17.934

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LYS  38           H        LYS  38  -2.328  11.535  20.758
    2    HA   LYS  38           HA       LYS  38  -1.019   9.136  20.226
    3    HB2  LYS  38           HB2      LYS  38  -1.295  10.883  22.390
    4    HB3  LYS  38           HB3      LYS  38  -1.906   9.351  23.007
    5    HG2  LYS  38           HG2      LYS  38   0.174   8.229  22.422
    6    HG3  LYS  38           HG3      LYS  38   0.770   9.678  21.607
    7    HD2  LYS  38           HD2      LYS  38   0.983  10.881  23.647
    8    HD3  LYS  38           HD3      LYS  38  -0.022   9.727  24.525
    9    HE2  LYS  38           HE2      LYS  38   2.344   9.400  25.096
   10    HE3  LYS  38           HE3      LYS  38   1.719   7.992  24.233
   11    HZ3  LYS  38           HZ1      LYS  38   2.985   8.421  22.430
   12    HZ2  LYS  38           HZ2      LYS  38   3.965   9.238  23.554
   13    HZ1  LYS  38           HZ3      LYS  38   2.869  10.108  22.590

  No H/Q in entry =          13
  In of MODEL   76
    1    H    ALA  39           H        ALA  39  -4.228   9.629  21.695
    2    HA   ALA  39           HA       ALA  39  -4.786   6.908  22.191
    3    HB3  ALA  39           HB1      ALA  39  -6.954   8.864  21.480
    4    HB2  ALA  39           HB2      ALA  39  -6.026   9.077  22.965
    5    HB1  ALA  39           HB3      ALA  39  -6.952   7.598  22.709

  No H/Q in entry =           5
  In of MODEL   76
    1    H    MET  40           H        MET  40  -5.421   8.943  19.371
    2    HA   MET  40           HA       MET  40  -6.931   7.026  17.926
    3    HB2  MET  40           HB2      MET  40  -5.333   9.424  17.007
    4    HB3  MET  40           HB3      MET  40  -6.382   8.475  15.950
    5    HG2  MET  40           HG2      MET  40  -7.363   9.708  18.537
    6    HG3  MET  40           HG3      MET  40  -7.448  10.554  16.994
    7    HE3  MET  40           HE1      MET  40 -10.076   8.957  14.969
    8    HE2  MET  40           HE2      MET  40  -8.327   9.071  14.788
    9    HE1  MET  40           HE3      MET  40  -9.228  10.433  15.449

  No H/Q in entry =           9
  In of MODEL   76
    1    H    MET  41           H        MET  41  -3.436   7.754  17.985
    2    HA   MET  41           HA       MET  41  -2.724   6.013  15.857
    3    HB2  MET  41           HB2      MET  41  -1.057   6.658  18.303
    4    HB3  MET  41           HB3      MET  41  -0.471   6.019  16.771
    5    HG2  MET  41           HG2      MET  41  -1.642   8.212  15.806
    6    HG3  MET  41           HG3      MET  41  -1.372   8.787  17.450
    7    HE2  MET  41           HE1      MET  41   1.547   6.680  17.739
    8    HE1  MET  41           HE2      MET  41   0.779   7.969  18.662
    9    HE3  MET  41           HE3      MET  41   2.391   8.213  17.989

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ASP  42           H        ASP  42  -3.042   5.515  19.347
    2    HA   ASP  42           HA       ASP  42  -2.009   2.918  19.468
    3    HB2  ASP  42           HB2      ASP  42  -2.843   4.666  21.320
    4    HB3  ASP  42           HB3      ASP  42  -4.273   3.644  21.267

  No H/Q in entry =           4
  In of MODEL   76
    1    H    GLN  43           H        GLN  43  -5.349   4.032  19.040
    2    HA   GLN  43           HA       GLN  43  -6.501   1.448  18.849
    3    HB2  GLN  43           HB2      GLN  43  -7.441   4.111  17.758
    4    HB3  GLN  43           HB3      GLN  43  -8.407   2.634  17.743
    5    HG2  GLN  43           HG2      GLN  43  -8.065   2.493  20.244
    6    HG3  GLN  43           HG3      GLN  43  -7.339   4.097  20.170
    7   HE21  GLN  43          HE21      GLN  43  -9.488   4.170  21.713
    8   HE22  GLN  43          HE22      GLN  43 -10.864   4.755  20.912

  No H/Q in entry =           8
  In of MODEL   76
    1    H    SER  44           H        SER  44  -5.204   3.678  16.428
    2    HA   SER  44           HA       SER  44  -5.952   2.212  14.142
    3    HB2  SER  44           HB2      SER  44  -4.682   4.590  14.579
    4    HB3  SER  44           HB3      SER  44  -3.341   3.595  14.015
    5    HG   SER  44           HG       SER  44  -4.485   4.582  12.281

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ARG  45           H        ARG  45  -3.035   2.078  16.165
    2    HA   ARG  45           HA       ARG  45  -1.586   0.131  14.740
    3    HB2  ARG  45           HB2      ARG  45  -0.705   1.537  16.602
    4    HB3  ARG  45           HB3      ARG  45  -1.677   0.600  17.735
    5    HG2  ARG  45           HG2      ARG  45  -0.462  -1.457  17.053
    6    HG3  ARG  45           HG3      ARG  45   0.534  -0.495  15.963
    7    HD2  ARG  45           HD2      ARG  45   1.309   0.869  17.914
    8    HD3  ARG  45           HD3      ARG  45   0.406  -0.212  18.997
    9    HE   ARG  45           HE       ARG  45   2.071  -1.799  17.372
   10   HH21  ARG  45          HH11      ARG  45   3.985  -2.632  18.166
   11   HH22  ARG  45          HH12      ARG  45   4.785  -1.857  19.488
   12   HH11  ARG  45          HH21      ARG  45   2.425   0.649  19.774
   13   HH12  ARG  45          HH22      ARG  45   3.902   0.003  20.396

  No H/Q in entry =          13
  In of MODEL   76
    1    H    MET  46           H        MET  46  -3.934  -0.204  17.383
    2    HA   MET  46           HA       MET  46  -3.766  -3.006  17.666
    3    HB2  MET  46           HB2      MET  46  -5.913  -0.996  18.327
    4    HB3  MET  46           HB3      MET  46  -6.128  -2.718  18.649
    5    HG2  MET  46           HG2      MET  46  -4.108  -2.744  20.028
    6    HG3  MET  46           HG3      MET  46  -3.804  -1.053  19.659
    7    HE1  MET  46           HE1      MET  46  -5.931  -3.683  21.109
    8    HE3  MET  46           HE2      MET  46  -7.404  -2.836  20.648
    9    HE2  MET  46           HE3      MET  46  -6.956  -2.946  22.346

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ALA  47           H        ALA  47  -5.821  -0.969  15.626
    2    HA   ALA  47           HA       ALA  47  -7.464  -3.007  14.576
    3    HB3  ALA  47           HB1      ALA  47  -8.146  -0.765  14.190
    4    HB1  ALA  47           HB2      ALA  47  -7.689  -1.388  12.604
    5    HB2  ALA  47           HB3      ALA  47  -6.589  -0.329  13.488

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LEU  48           H        LEU  48  -4.363  -1.699  13.475
    2    HA   LEU  48           HA       LEU  48  -4.131  -3.272  11.117
    3    HB2  LEU  48           HB2      LEU  48  -2.036  -2.013  12.895
    4    HB3  LEU  48           HB3      LEU  48  -1.700  -2.723  11.316
    5    HG   LEU  48           HG       LEU  48  -3.708  -0.503  11.761
    6   HD13  LEU  48          HD11      LEU  48  -1.571   0.362  12.393
    7   HD12  LEU  48          HD12      LEU  48  -1.876   0.929  10.751
    8   HD11  LEU  48          HD13      LEU  48  -0.777  -0.423  11.028
    9   HD22  LEU  48          HD21      LEU  48  -4.222  -1.470   9.687
   10   HD21  LEU  48          HD22      LEU  48  -2.547  -1.908   9.356
   11   HD23  LEU  48          HD23      LEU  48  -3.063  -0.226   9.220

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ASN  49           H        ASN  49  -3.024  -3.698  14.439
    2    HA   ASN  49           HA       ASN  49  -1.436  -5.964  14.061
    3    HB2  ASN  49           HB2      ASN  49  -1.401  -4.661  16.119
    4    HB3  ASN  49           HB3      ASN  49  -3.066  -5.103  16.466
    5   HD21  ASN  49          HD21      ASN  49   0.251  -6.214  16.555
    6   HD22  ASN  49          HD22      ASN  49  -0.059  -7.671  17.366

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLU  50           H        GLU  50  -4.890  -5.681  14.801
    2    HA   GLU  50           HA       GLU  50  -5.411  -8.479  14.897
    3    HB2  GLU  50           HB2      GLU  50  -6.973  -6.793  15.817
    4    HB3  GLU  50           HB3      GLU  50  -7.296  -6.214  14.180
    5    HG2  GLU  50           HG2      GLU  50  -8.182  -8.402  13.542
    6    HG3  GLU  50           HG3      GLU  50  -7.773  -9.060  15.123

  No H/Q in entry =           6
  In of MODEL   76
    1    H    ALA  51           H        ALA  51  -5.518  -6.061  12.322
    2    HA   ALA  51           HA       ALA  51  -6.550  -7.768  10.306
    3    HB2  ALA  51           HB1      ALA  51  -6.348  -5.946   8.946
    4    HB1  ALA  51           HB2      ALA  51  -4.696  -5.609   9.466
    5    HB3  ALA  51           HB3      ALA  51  -6.059  -5.099  10.465

  No H/Q in entry =           5
  In of MODEL   76
    1    H    HIS  52           H        HIS  52  -3.237  -6.884  11.234
    2    HA   HIS  52           HA       HIS  52  -1.882  -8.364   9.247
    3    HB2  HIS  52           HB2      HIS  52  -0.771  -6.666  10.626
    4    HB3  HIS  52           HB3      HIS  52  -0.995  -7.671  12.058
    5    HD1  HIS  52           HD1      HIS  52   0.200 -10.114  11.924
    6    HD2  HIS  52           HD2      HIS  52   1.533  -7.257   9.195
    7    HE1  HIS  52           HE1      HIS  52   2.432 -10.939  11.054
    8    HE2  HIS  52           HE2      HIS  52   3.256  -9.207   9.390

  No H/Q in entry =           8
  In of MODEL   76
    1    H    LEU  53           H        LEU  53  -3.037  -9.261  12.475
    2    HA   LEU  53           HA       LEU  53  -1.849 -11.813  12.626
    3    HB2  LEU  53           HB2      LEU  53  -4.300 -10.622  13.899
    4    HB3  LEU  53           HB3      LEU  53  -3.857 -12.306  14.163
    5    HG   LEU  53           HG       LEU  53  -1.923 -10.014  14.632
    6   HD13  LEU  53          HD11      LEU  53  -2.495 -10.111  16.978
    7   HD12  LEU  53          HD12      LEU  53  -3.592 -11.463  16.703
    8   HD11  LEU  53          HD13      LEU  53  -3.986  -9.867  16.076
    9   HD22  LEU  53          HD21      LEU  53  -0.654 -11.998  14.554
   10   HD21  LEU  53          HD22      LEU  53  -1.955 -12.967  15.236
   11   HD23  LEU  53          HD23      LEU  53  -1.033 -11.893  16.270

  No H/Q in entry =          11
  In of MODEL   76
    1    H    VAL  54           H        VAL  54  -4.980 -10.756  11.331
    2    HA   VAL  54           HA       VAL  54  -5.921 -13.340  10.641
    3    HB   VAL  54           HB       VAL  54  -6.574 -10.595   9.540
    4   HG12  VAL  54          HG11      VAL  54  -8.699 -11.955   8.757
    5   HG11  VAL  54          HG12      VAL  54  -7.593 -13.327   8.798
    6   HG13  VAL  54          HG13      VAL  54  -7.246 -11.946   7.760
    7   HG22  VAL  54          HG21      VAL  54  -7.440 -10.644  11.708
    8   HG21  VAL  54          HG22      VAL  54  -7.705 -12.386  11.680
    9   HG23  VAL  54          HG23      VAL  54  -8.797 -11.316  10.802

  No H/Q in entry =           9
  In of MODEL   76
    1    H    GLN  55           H        GLN  55  -4.069 -10.885   8.836
    2    HA   GLN  55           HA       GLN  55  -3.993 -12.331   6.405
    3    HB2  GLN  55           HB2      GLN  55  -3.380 -10.069   6.221
    4    HB3  GLN  55           HB3      GLN  55  -2.244 -10.162   7.564
    5    HG2  GLN  55           HG2      GLN  55  -0.556 -11.008   6.249
    6    HG3  GLN  55           HG3      GLN  55  -1.654 -11.969   5.268
    7   HE21  GLN  55          HE21      GLN  55  -1.707 -11.262   3.153
    8   HE22  GLN  55          HE22      GLN  55  -1.509  -9.655   2.652

  No H/Q in entry =           8
  In of MODEL   76
    1    H    THR  56           H        THR  56  -1.834 -12.345   9.246
    2    HA   THR  56           HA       THR  56   0.217 -13.949   8.277
    3    HB   THR  56           HB       THR  56  -0.974 -14.216  11.046
    4    HG1  THR  56           HG1      THR  56   0.882 -12.324  10.036
    5   HG21  THR  56          HG21      THR  56   1.747 -14.698   9.825
    6   HG23  THR  56          HG22      THR  56   0.730 -15.840  10.705
    7   HG22  THR  56          HG23      THR  56   1.517 -14.516  11.563

  No H/Q in entry =           7
  In of MODEL   76
    1    H    LYS  57           H        LYS  57  -2.883 -14.977   9.691
    2    HA   LYS  57           HA       LYS  57  -2.460 -17.774   9.415
    3    HB2  LYS  57           HB2      LYS  57  -4.245 -16.682  10.803
    4    HB3  LYS  57           HB3      LYS  57  -5.063 -16.216   9.318
    5    HG2  LYS  57           HG2      LYS  57  -5.321 -18.577   8.694
    6    HG3  LYS  57           HG3      LYS  57  -4.472 -19.069  10.158
    7    HD2  LYS  57           HD2      LYS  57  -6.243 -18.021  11.534
    8    HD3  LYS  57           HD3      LYS  57  -7.102 -17.551  10.068
    9    HE2  LYS  57           HE2      LYS  57  -8.068 -19.624  10.965
   10    HE3  LYS  57           HE3      LYS  57  -7.274 -19.971   9.431
   11    HZ3  LYS  57           HZ1      LYS  57  -5.476 -20.953  10.497
   12    HZ2  LYS  57           HZ2      LYS  57  -6.815 -21.510  11.382
   13    HZ1  LYS  57           HZ3      LYS  57  -5.848 -20.257  12.000

  No H/Q in entry =          13
  In of MODEL   76
    1    H    LEU  58           H        LEU  58  -3.816 -15.306   7.283
    2    HA   LEU  58           HA       LEU  58  -4.668 -17.110   5.278
    3    HB2  LEU  58           HB2      LEU  58  -4.044 -14.165   5.154
    4    HB3  LEU  58           HB3      LEU  58  -4.739 -15.087   3.820
    5    HG   LEU  58           HG       LEU  58  -5.966 -14.920   6.592
    6   HD11  LEU  58          HD11      LEU  58  -6.302 -13.252   4.120
    7   HD13  LEU  58          HD12      LEU  58  -6.257 -12.758   5.812
    8   HD12  LEU  58          HD13      LEU  58  -7.697 -13.537   5.161
    9   HD22  LEU  58          HD21      LEU  58  -6.957 -16.817   5.726
   10   HD21  LEU  58          HD22      LEU  58  -6.646 -16.354   4.053
   11   HD23  LEU  58          HD23      LEU  58  -7.988 -15.626   4.935

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  59           H        ILE  59  -1.509 -15.926   6.090
    2    HA   ILE  59           HA       ILE  59  -0.465 -16.640   3.428
    3    HB   ILE  59           HB       ILE  59   0.346 -14.591   4.994
    4   HG12  ILE  59          HG12      ILE  59   2.396 -16.255   3.515
    5   HG13  ILE  59          HG13      ILE  59   1.201 -15.287   2.691
    6   HG21  ILE  59          HG21      ILE  59   1.108 -16.378   6.733
    7   HG23  ILE  59          HG22      ILE  59   2.214 -15.077   6.353
    8   HG22  ILE  59          HG23      ILE  59   2.436 -16.671   5.634
    9   HD12  ILE  59          HD11      ILE  59   3.363 -14.084   2.999
   10   HD11  ILE  59          HD12      ILE  59   3.131 -14.200   4.741
   11   HD13  ILE  59          HD13      ILE  59   2.007 -13.257   3.762

  No H/Q in entry =          11
  In of MODEL   76
    1    H    GLU  60           H        GLU  60  -0.420 -17.772   6.786
    2    HA   GLU  60           HA       GLU  60   1.592 -19.761   6.469
    3    HB2  GLU  60           HB2      GLU  60   1.077 -20.388   8.626
    4    HB3  GLU  60           HB3      GLU  60   0.360 -18.779   8.614
    5    HG2  GLU  60           HG2      GLU  60  -1.821 -19.866   7.902
    6    HG3  GLU  60           HG3      GLU  60  -1.060 -21.424   8.220

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLY  61           H        GLY  61  -1.928 -19.833   6.048
    2    HA3  GLY  61           HA2      GLY  61  -1.716 -22.619   5.064
    3    HA2  GLY  61           HA3      GLY  61  -3.185 -21.878   5.690

  No H/Q in entry =           3
  In of MODEL   76
    1    H    ASP  62           H        ASP  62  -0.987 -20.297   3.458
    2    HA   ASP  62           HA       ASP  62  -3.034 -19.561   1.664
    3    HB2  ASP  62           HB2      ASP  62  -1.183 -18.783   0.242
    4    HB3  ASP  62           HB3      ASP  62  -0.943 -18.305   1.919

  No H/Q in entry =           4
  In of MODEL   76
    1    H    ALA  63           H        ALA  63  -4.010 -20.650   0.033
    2    HA   ALA  63           HA       ALA  63  -2.568 -22.614  -1.554
    3    HB2  ALA  63           HB1      ALA  63  -4.920 -23.516   0.108
    4    HB1  ALA  63           HB2      ALA  63  -3.237 -23.965   0.385
    5    HB3  ALA  63           HB3      ALA  63  -4.055 -24.481  -1.091

  No H/Q in entry =           5
  In of MODEL   76
    1    H    GLY  64           H        GLY  64  -5.728 -23.495  -1.574
    2    HA3  GLY  64           HA2      GLY  64  -7.646 -22.695  -2.696
    3    HA2  GLY  64           HA3      GLY  64  -6.692 -21.373  -3.348

  No H/Q in entry =           3
  In of MODEL   76
    1    H    GLU  65           H        GLU  65  -4.692 -23.805  -3.934
    2    HA   GLU  65           HA       GLU  65  -6.094 -24.809  -6.312
    3    HB2  GLU  65           HB2      GLU  65  -3.423 -23.402  -6.354
    4    HB3  GLU  65           HB3      GLU  65  -4.095 -24.311  -7.709
    5    HG2  GLU  65           HG2      GLU  65  -5.465 -21.967  -6.359
    6    HG3  GLU  65           HG3      GLU  65  -4.573 -21.871  -7.877

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLY  66           H        GLY  66  -4.997 -26.506  -7.423
    2    HA3  GLY  66           HA2      GLY  66  -4.244 -28.649  -5.786
    3    HA2  GLY  66           HA3      GLY  66  -4.106 -28.593  -7.532

  No H/Q in entry =           3
  In of MODEL   76
    1    H    LYS  67           H        LYS  67  -2.273 -26.493  -7.756
    2    HA   LYS  67           HA       LYS  67   0.166 -27.909  -7.068
    3    HB2  LYS  67           HB2      LYS  67  -0.424 -25.595  -8.904
    4    HB3  LYS  67           HB3      LYS  67   1.200 -26.240  -8.637
    5    HG2  LYS  67           HG2      LYS  67   0.441 -28.479  -9.326
    6    HG3  LYS  67           HG3      LYS  67  -1.189 -27.858  -9.576
    7    HD2  LYS  67           HD2      LYS  67  -0.341 -26.333 -11.323
    8    HD3  LYS  67           HD3      LYS  67   1.289 -26.964 -11.077
    9    HE2  LYS  67           HE2      LYS  67   0.508 -29.227 -11.685
   10    HE3  LYS  67           HE3      LYS  67  -1.118 -28.595 -11.939
   11    HZ3  LYS  67           HZ1      LYS  67  -0.564 -27.876 -13.945
   12    HZ2  LYS  67           HZ2      LYS  67   0.900 -28.724 -13.791
   13    HZ1  LYS  67           HZ3      LYS  67   0.817 -27.081 -13.367

  No H/Q in entry =          13
  In of MODEL   76
    1    H    MET  68           H        MET  68   2.046 -26.018  -7.084
    2    HA   MET  68           HA       MET  68   2.226 -25.214  -4.397
    3    HB2  MET  68           HB2      MET  68   3.818 -24.457  -6.843
    4    HB3  MET  68           HB3      MET  68   4.260 -23.973  -5.205
    5    HG2  MET  68           HG2      MET  68   4.326 -26.345  -4.523
    6    HG3  MET  68           HG3      MET  68   3.900 -26.828  -6.166
    7    HE2  MET  68           HE1      MET  68   7.491 -27.965  -6.308
    8    HE1  MET  68           HE2      MET  68   5.776 -28.318  -6.525
    9    HE3  MET  68           HE3      MET  68   6.424 -28.085  -4.902

  No H/Q in entry =           9
  In of MODEL   76
    1    H    LYS  69           H        LYS  69   0.391 -23.755  -6.769
    2    HA   LYS  69           HA       LYS  69   0.921 -21.030  -6.409
    3    HB2  LYS  69           HB2      LYS  69  -1.577 -22.423  -7.322
    4    HB3  LYS  69           HB3      LYS  69  -1.377 -20.667  -7.330
    5    HG2  LYS  69           HG2      LYS  69   0.572 -20.839  -8.767
    6    HG3  LYS  69           HG3      LYS  69   0.529 -22.600  -8.674
    7    HD2  LYS  69           HD2      LYS  69  -0.514 -22.124 -10.736
    8    HD3  LYS  69           HD3      LYS  69  -1.867 -22.388  -9.633
    9    HE2  LYS  69           HE2      LYS  69  -2.193 -20.016  -9.346
   10    HE3  LYS  69           HE3      LYS  69  -0.701 -19.655 -10.214
   11    HZ3  LYS  69           HZ1      LYS  69  -1.730 -19.828 -12.158
   12    HZ2  LYS  69           HZ2      LYS  69  -3.197 -19.820 -11.300
   13    HZ1  LYS  69           HZ3      LYS  69  -2.474 -21.294 -11.740

  No H/Q in entry =          13
  In of MODEL   76
    1    H    VAL  70           H        VAL  70  -0.450 -19.344  -5.493
    2    HA   VAL  70           HA       VAL  70  -1.751 -20.151  -2.952
    3    HB   VAL  70           HB       VAL  70  -0.864 -18.063  -1.964
    4   HG13  VAL  70          HG11      VAL  70   0.432 -20.094  -1.641
    5   HG12  VAL  70          HG12      VAL  70   1.545 -18.752  -1.911
    6   HG11  VAL  70          HG13      VAL  70   1.206 -19.891  -3.213
    7   HG21  VAL  70          HG21      VAL  70   0.615 -17.782  -4.613
    8   HG23  VAL  70          HG22      VAL  70   0.866 -16.769  -3.192
    9   HG22  VAL  70          HG23      VAL  70  -0.678 -16.726  -4.039

  No H/Q in entry =           9
  In of MODEL   76
    1    H    SER  71           H        SER  71  -3.230 -18.446  -2.129
    2    HA   SER  71           HA       SER  71  -5.211 -17.746  -4.016
    3    HB2  SER  71           HB2      SER  71  -5.577 -18.013  -1.526
    4    HB3  SER  71           HB3      SER  71  -4.753 -16.475  -1.294
    5    HG   SER  71           HG       SER  71  -6.465 -15.940  -3.114

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LEU  72           H        LEU  72  -5.397 -16.086  -5.324
    2    HA   LEU  72           HA       LEU  72  -3.288 -14.282  -5.833
    3    HB2  LEU  72           HB2      LEU  72  -6.170 -14.318  -6.723
    4    HB3  LEU  72           HB3      LEU  72  -4.984 -13.155  -7.309
    5    HG   LEU  72           HG       LEU  72  -4.575 -16.158  -7.481
    6   HD11  LEU  72          HD11      LEU  72  -5.865 -14.206  -9.385
    7   HD13  LEU  72          HD12      LEU  72  -6.448 -15.790  -8.870
    8   HD12  LEU  72          HD13      LEU  72  -5.078 -15.671  -9.975
    9   HD23  LEU  72          HD21      LEU  72  -3.057 -15.267  -9.421
   10   HD22  LEU  72          HD22      LEU  72  -2.456 -15.134  -7.777
   11   HD21  LEU  72          HD23      LEU  72  -3.155 -13.727  -8.574

  No H/Q in entry =          11
  In of MODEL   76
    1    H    VAL  73           H        VAL  73  -6.347 -13.921  -4.139
    2    HA   VAL  73           HA       VAL  73  -6.369 -11.153  -3.765
    3    HB   VAL  73           HB       VAL  73  -8.080 -11.506  -2.199
    4   HG12  VAL  73          HG11      VAL  73  -8.192 -14.047  -3.825
    5   HG11  VAL  73          HG12      VAL  73  -8.396 -12.463  -4.570
    6   HG13  VAL  73          HG13      VAL  73  -9.526 -13.006  -3.330
    7   HG22  VAL  73          HG21      VAL  73  -6.995 -12.888  -0.574
    8   HG21  VAL  73          HG22      VAL  73  -6.754 -14.188  -1.742
    9   HG23  VAL  73          HG23      VAL  73  -8.375 -13.820  -1.153

  No H/Q in entry =           9
  In of MODEL   76
    1    H    LEU  74           H        LEU  74  -4.414 -13.545  -2.239
    2    HA   LEU  74           HA       LEU  74  -3.947 -12.427   0.284
    3    HB2  LEU  74           HB2      LEU  74  -3.181 -14.642  -0.231
    4    HB3  LEU  74           HB3      LEU  74  -2.168 -14.038  -1.541
    5    HG   LEU  74           HG       LEU  74  -0.793 -12.797   0.092
    6   HD12  LEU  74          HD11      LEU  74  -1.198 -13.464   2.548
    7   HD11  LEU  74          HD12      LEU  74  -2.807 -13.965   2.021
    8   HD13  LEU  74          HD13      LEU  74  -2.308 -12.282   1.854
    9   HD22  LEU  74          HD21      LEU  74   0.417 -14.654   0.706
   10   HD21  LEU  74          HD22      LEU  74  -0.648 -15.348  -0.497
   11   HD23  LEU  74          HD23      LEU  74  -1.016 -15.554   1.199

  No H/Q in entry =          11
  In of MODEL   76
    1    H    VAL  75           H        VAL  75  -2.112 -12.019  -2.706
    2    HA   VAL  75           HA       VAL  75  -0.285 -10.113  -1.716
    3    HB   VAL  75           HB       VAL  75  -1.298 -10.567  -4.524
    4   HG12  VAL  75          HG11      VAL  75   0.765  -9.268  -5.170
    5   HG11  VAL  75          HG12      VAL  75   0.997  -8.876  -3.474
    6   HG13  VAL  75          HG13      VAL  75  -0.422  -8.283  -4.322
    7   HG21  VAL  75          HG21      VAL  75   0.010 -12.372  -3.205
    8   HG23  VAL  75          HG22      VAL  75   1.384 -11.271  -3.315
    9   HG22  VAL  75          HG23      VAL  75   0.648 -11.912  -4.784

  No H/Q in entry =           9
  In of MODEL   76
    1    H    GLU  76           H        GLU  76  -3.465  -9.735  -3.308
    2    HA   GLU  76           HA       GLU  76  -3.503  -6.920  -3.384
    3    HB2  GLU  76           HB2      GLU  76  -5.194  -8.325  -4.530
    4    HB3  GLU  76           HB3      GLU  76  -5.811  -8.858  -2.975
    5    HG2  GLU  76           HG2      GLU  76  -7.287  -7.128  -3.778
    6    HG3  GLU  76           HG3      GLU  76  -6.373  -6.441  -2.450

  No H/Q in entry =           6
  In of MODEL   76
    1    H    ALA  77           H        ALA  77  -4.576  -9.163  -0.842
    2    HA   ALA  77           HA       ALA  77  -5.486  -7.171   0.952
    3    HB1  ALA  77           HB1      ALA  77  -4.297  -9.790   1.845
    4    HB2  ALA  77           HB2      ALA  77  -5.860  -9.724   1.031
    5    HB3  ALA  77           HB3      ALA  77  -5.628  -8.881   2.562

  No H/Q in entry =           5
  In of MODEL   76
    1    H    GLN  78           H        GLN  78  -2.356  -8.735   0.512
    2    HA   GLN  78           HA       GLN  78  -1.047  -7.601   2.747
    3    HB2  GLN  78           HB2      GLN  78  -0.222  -9.535   1.363
    4    HB3  GLN  78           HB3      GLN  78   0.191  -8.385   0.094
    5    HG2  GLN  78           HG2      GLN  78   1.690  -7.203   1.648
    6    HG3  GLN  78           HG3      GLN  78   1.283  -8.351   2.920
    7   HE21  GLN  78          HE21      GLN  78   3.985  -8.084   2.026
    8   HE22  GLN  78          HE22      GLN  78   4.425  -9.509   1.215

  No H/Q in entry =           8
  In of MODEL   76
    1    H    LEU  79           H        LEU  79  -1.473  -6.509  -0.583
    2    HA   LEU  79           HA       LEU  79   0.227  -4.293  -0.585
    3    HB2  LEU  79           HB2      LEU  79  -0.845  -5.076  -2.624
    4    HB3  LEU  79           HB3      LEU  79  -2.434  -4.679  -1.981
    5    HG   LEU  79           HG       LEU  79  -1.874  -2.296  -1.946
    6   HD13  LEU  79          HD11      LEU  79   0.377  -2.071  -1.476
    7   HD12  LEU  79          HD12      LEU  79   0.394  -1.769  -3.213
    8   HD11  LEU  79          HD13      LEU  79   0.850  -3.355  -2.589
    9   HD23  LEU  79          HD21      LEU  79  -1.290  -2.079  -4.509
   10   HD22  LEU  79          HD22      LEU  79  -2.811  -2.821  -4.025
   11   HD21  LEU  79          HD23      LEU  79  -1.454  -3.835  -4.506

  No H/Q in entry =          11
  In of MODEL   76
    1    H    HIS  80           H        HIS  80  -3.224  -4.440   0.309
    2    HA   HIS  80           HA       HIS  80  -3.383  -1.688   0.999
    3    HB2  HIS  80           HB2      HIS  80  -5.094  -4.088   1.332
    4    HB3  HIS  80           HB3      HIS  80  -5.384  -2.756   2.453
    5    HD1  HIS  80           HD1      HIS  80  -7.008  -1.100   1.592
    6    HD2  HIS  80           HD2      HIS  80  -4.888  -2.901  -1.514
    7    HE1  HIS  80           HE1      HIS  80  -7.884  -0.079  -0.562
    8    HE2  HIS  80           HE2      HIS  80  -6.599  -1.171  -2.464

  No H/Q in entry =           8
  In of MODEL   76
    1    H    LEU  81           H        LEU  81  -2.875  -4.603   2.958
    2    HA   LEU  81           HA       LEU  81  -2.804  -3.277   5.453
    3    HB2  LEU  81           HB2      LEU  81  -1.621  -5.894   4.527
    4    HB3  LEU  81           HB3      LEU  81  -1.558  -5.350   6.205
    5    HG   LEU  81           HG       LEU  81  -4.137  -5.571   4.626
    6   HD12  LEU  81          HD11      LEU  81  -4.424  -7.647   6.162
    7   HD11  LEU  81          HD12      LEU  81  -2.668  -7.590   6.313
    8   HD13  LEU  81          HD13      LEU  81  -3.410  -7.802   4.727
    9   HD23  LEU  81          HD21      LEU  81  -4.932  -5.789   7.141
   10   HD22  LEU  81          HD22      LEU  81  -4.610  -4.197   6.458
   11   HD21  LEU  81          HD23      LEU  81  -3.408  -4.975   7.488

  No H/Q in entry =          11
  In of MODEL   76
    1    H    MET  82           H        MET  82  -0.173  -4.181   3.221
    2    HA   MET  82           HA       MET  82   1.950  -3.316   4.871
    3    HB2  MET  82           HB2      MET  82   1.673  -3.631   1.881
    4    HB3  MET  82           HB3      MET  82   3.174  -3.077   2.619
    5    HG2  MET  82           HG2      MET  82   1.762  -5.663   3.350
    6    HG3  MET  82           HG3      MET  82   3.112  -5.554   2.223
    7    HE3  MET  82           HE1      MET  82   6.172  -4.857   4.152
    8    HE2  MET  82           HE2      MET  82   5.248  -3.477   3.564
    9    HE1  MET  82           HE3      MET  82   5.306  -4.960   2.615

  No H/Q in entry =           9
  In of MODEL   76
    1    H    THR  83           H        THR  83   0.090  -1.639   2.365
    2    HA   THR  83           HA       THR  83   1.522   0.797   2.443
    3    HB   THR  83           HB       THR  83  -0.666   1.747   1.508
    4    HG1  THR  83           HG1      THR  83  -2.329   0.464   1.424
    5   HG22  THR  83          HG21      THR  83  -0.450  -0.056  -0.512
    6   HG21  THR  83          HG22      THR  83   1.065  -0.367   0.332
    7   HG23  THR  83          HG23      THR  83   0.704   1.254  -0.263

  No H/Q in entry =           7
  In of MODEL   76
    1    H    SER  84           H        SER  84  -1.460  -0.225   4.096
    2    HA   SER  84           HA       SER  84  -1.910   2.197   5.470
    3    HB2  SER  84           HB2      SER  84  -2.754  -0.639   6.027
    4    HB3  SER  84           HB3      SER  84  -3.215   0.697   7.081
    5    HG   SER  84           HG       SER  84  -3.732   0.410   4.296

  No H/Q in entry =           5
  In of MODEL   76
    1    H    MET  85           H        MET  85  -0.201  -0.757   6.540
    2    HA   MET  85           HA       MET  85   0.378   0.143   9.141
    3    HB2  MET  85           HB2      MET  85   0.638  -2.198   8.429
    4    HB3  MET  85           HB3      MET  85   2.012  -1.733   7.425
    5    HG2  MET  85           HG2      MET  85   3.221  -0.940   9.415
    6    HG3  MET  85           HG3      MET  85   1.837  -1.346  10.429
    7    HE3  MET  85           HE1      MET  85   3.453  -3.851   7.398
    8    HE2  MET  85           HE2      MET  85   4.913  -3.892   8.382
    9    HE1  MET  85           HE3      MET  85   4.234  -2.344   7.888

  No H/Q in entry =           9
  In of MODEL   76
    1    H    LEU  86           H        LEU  86   2.255   0.408   6.154
    2    HA   LEU  86           HA       LEU  86   4.503   1.691   7.276
    3    HB2  LEU  86           HB2      LEU  86   4.256   0.629   4.963
    4    HB3  LEU  86           HB3      LEU  86   3.450   2.122   4.478
    5    HG   LEU  86           HG       LEU  86   5.508   3.343   5.428
    6   HD11  LEU  86          HD11      LEU  86   6.207   0.719   6.192
    7   HD13  LEU  86          HD12      LEU  86   7.225   2.155   6.281
    8   HD12  LEU  86          HD13      LEU  86   7.297   1.118   4.859
    9   HD23  LEU  86          HD21      LEU  86   6.163   1.594   3.049
   10   HD22  LEU  86          HD22      LEU  86   6.576   3.285   3.317
   11   HD21  LEU  86          HD23      LEU  86   4.912   2.834   2.948

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ALA  87           H        ALA  87   1.570   2.971   5.760
    2    HA   ALA  87           HA       ALA  87   2.188   5.695   5.854
    3    HB1  ALA  87           HB1      ALA  87  -0.145   4.091   5.346
    4    HB3  ALA  87           HB2      ALA  87   0.170   5.753   4.853
    5    HB2  ALA  87           HB3      ALA  87  -0.595   5.426   6.410

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ARG  88           H        ARG  88   0.530   3.688   8.261
    2    HA   ARG  88           HA       ARG  88   0.073   5.727  10.134
    3    HB2  ARG  88           HB2      ARG  88  -0.884   3.382  10.201
    4    HB3  ARG  88           HB3      ARG  88   0.667   2.863  10.872
    5    HG2  ARG  88           HG2      ARG  88   0.240   4.928  12.517
    6    HG3  ARG  88           HG3      ARG  88  -1.438   4.621  12.092
    7    HD2  ARG  88           HD2      ARG  88  -1.536   2.762  13.326
    8    HD3  ARG  88           HD3      ARG  88   0.038   2.172  12.758
    9    HE   ARG  88           HE       ARG  88  -0.436   3.419  15.233
   10   HH21  ARG  88          HH11      ARG  88   1.155   4.409  16.448
   11   HH22  ARG  88          HH12      ARG  88   2.663   4.829  15.716
   12   HH11  ARG  88          HH21      ARG  88   1.794   3.603  12.612
   13   HH12  ARG  88          HH22      ARG  88   3.033   4.356  13.556

  No H/Q in entry =          13
  In of MODEL   76
    1    H    GLU  89           H        GLU  89   2.846   3.487   9.837
    2    HA   GLU  89           HA       GLU  89   4.161   4.347  12.162
    3    HB2  GLU  89           HB2      GLU  89   4.777   2.335  10.790
    4    HB3  GLU  89           HB3      GLU  89   5.538   3.432   9.636
    5    HG2  GLU  89           HG2      GLU  89   7.065   4.253  11.357
    6    HG3  GLU  89           HG3      GLU  89   6.247   3.293  12.586

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LEU  90           H        LEU  90   4.421   5.529   8.838
    2    HA   LEU  90           HA       LEU  90   6.378   7.510   9.400
    3    HB2  LEU  90           HB2      LEU  90   4.325   7.212   7.211
    4    HB3  LEU  90           HB3      LEU  90   5.566   8.473   7.218
    5    HG   LEU  90           HG       LEU  90   6.223   5.528   7.515
    6   HD12  LEU  90          HD11      LEU  90   6.925   5.776   5.062
    7   HD11  LEU  90          HD12      LEU  90   5.920   7.224   5.046
    8   HD13  LEU  90          HD13      LEU  90   5.195   5.654   5.391
    9   HD22  LEU  90          HD21      LEU  90   8.143   6.658   8.168
   10   HD21  LEU  90          HD22      LEU  90   7.783   8.074   7.179
   11   HD23  LEU  90          HD23      LEU  90   8.417   6.610   6.427

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  91           H        ILE  91   2.837   7.553   9.323
    2    HA   ILE  91           HA       ILE  91   2.524  10.324   9.802
    3    HB   ILE  91           HB       ILE  91   0.727   7.957  10.362
    4   HG12  ILE  91          HG12      ILE  91   0.456  10.256   8.400
    5   HG13  ILE  91          HG13      ILE  91   1.298   8.759   7.999
    6   HG22  ILE  91          HG21      ILE  91  -0.989  10.027  10.476
    7   HG21  ILE  91          HG22      ILE  91   0.432  10.842  11.127
    8   HG23  ILE  91          HG23      ILE  91  -0.199   9.403  11.925
    9   HD13  ILE  91          HD11      ILE  91  -0.655   7.485   8.072
   10   HD12  ILE  91          HD12      ILE  91  -1.246   9.009   7.414
   11   HD11  ILE  91          HD13      ILE  91  -1.486   8.633   9.121

  No H/Q in entry =          11
  In of MODEL   76
    1    H    THR  92           H        THR  92   2.952   7.562  11.973
    2    HA   THR  92           HA       THR  92   2.566   8.920  14.416
    3    HB   THR  92           HB       THR  92   4.345   6.578  13.697
    4    HG1  THR  92           HG1      THR  92   2.369   5.835  13.630
    5   HG22  THR  92          HG21      THR  92   4.012   6.276  16.336
    6   HG21  THR  92          HG22      THR  92   3.958   8.036  16.277
    7   HG23  THR  92          HG23      THR  92   5.374   7.175  15.669

  No H/Q in entry =           7
  In of MODEL   76
    1    H    GLU  93           H        GLU  93   5.475   8.467  12.421
    2    HA   GLU  93           HA       GLU  93   7.272   9.869  14.093
    3    HB2  GLU  93           HB2      GLU  93   7.298   9.577  11.075
    4    HB3  GLU  93           HB3      GLU  93   8.662  10.091  12.066
    5    HG2  GLU  93           HG2      GLU  93   7.245   7.460  12.522
    6    HG3  GLU  93           HG3      GLU  93   8.608   7.612  11.420

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LEU  94           H        LEU  94   5.177  10.918  11.430
    2    HA   LEU  94           HA       LEU  94   5.996  13.617  11.334
    3    HB2  LEU  94           HB2      LEU  94   3.383  12.274  10.621
    4    HB3  LEU  94           HB3      LEU  94   3.647  14.002  10.388
    5    HG   LEU  94           HG       LEU  94   5.631  12.010   9.283
    6   HD11  LEU  94          HD11      LEU  94   2.873  12.585   8.279
    7   HD13  LEU  94          HD12      LEU  94   3.844  11.124   8.123
    8   HD12  LEU  94          HD13      LEU  94   4.167  12.510   7.083
    9   HD23  LEU  94          HD21      LEU  94   5.859  13.858   7.569
   10   HD22  LEU  94          HD22      LEU  94   6.309  14.335   9.207
   11   HD21  LEU  94          HD23      LEU  94   4.747  14.818   8.542

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  95           H        ILE  95   3.487  12.001  13.263
    2    HA   ILE  95           HA       ILE  95   2.481  14.347  14.496
    3    HB   ILE  95           HB       ILE  95   2.500  11.458  15.398
    4   HG12  ILE  95          HG12      ILE  95   0.269  13.252  14.406
    5   HG13  ILE  95          HG13      ILE  95   1.199  12.195  13.347
    6   HG21  ILE  95          HG21      ILE  95   1.255  13.928  16.643
    7   HG23  ILE  95          HG22      ILE  95   2.312  12.748  17.418
    8   HG22  ILE  95          HG23      ILE  95   0.666  12.299  16.972
    9   HD13  ILE  95          HD11      ILE  95   0.304  10.255  14.269
   10   HD12  ILE  95          HD12      ILE  95  -1.071  11.351  14.381
   11   HD11  ILE  95          HD13      ILE  95  -0.079  11.037  15.804

  No H/Q in entry =          11
  In of MODEL   76
    1    H    GLU  96           H        GLU  96   5.083  12.107  15.423
    2    HA   GLU  96           HA       GLU  96   5.693  13.284  17.913
    3    HB2  GLU  96           HB2      GLU  96   6.617  11.125  17.231
    4    HB3  GLU  96           HB3      GLU  96   7.529  11.903  15.938
    5    HG2  GLU  96           HG2      GLU  96   9.209  12.432  17.372
    6    HG3  GLU  96           HG3      GLU  96   8.087  13.243  18.456

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LEU  97           H        LEU  97   6.707  14.075  14.612
    2    HA   LEU  97           HA       LEU  97   8.617  16.057  15.302
    3    HB2  LEU  97           HB2      LEU  97   6.974  15.534  12.835
    4    HB3  LEU  97           HB3      LEU  97   8.003  16.960  12.947
    5    HG   LEU  97           HG       LEU  97   9.029  14.153  13.466
    6   HD12  LEU  97          HD11      LEU  97   9.981  14.360  11.131
    7   HD11  LEU  97          HD12      LEU  97   8.931  15.758  10.899
    8   HD13  LEU  97          HD13      LEU  97   8.230  14.167  11.195
    9   HD23  LEU  97          HD21      LEU  97  11.189  15.428  12.690
   10   HD22  LEU  97          HD22      LEU  97  10.603  15.688  14.333
   11   HD21  LEU  97          HD23      LEU  97  10.270  16.882  13.080

  No H/Q in entry =          11
  In of MODEL   76
    1    H    HIS  98           H        HIS  98   5.114  16.213  14.717
    2    HA   HIS  98           HA       HIS  98   4.830  19.013  14.879
    3    HB2  HIS  98           HB2      HIS  98   2.944  16.766  15.625
    4    HB3  HIS  98           HB3      HIS  98   2.486  18.468  15.703
    5    HD1  HIS  98           HD1      HIS  98   3.448  15.766  13.258
    6    HD2  HIS  98           HD2      HIS  98   2.088  19.707  13.192
    7    HE1  HIS  98           HE1      HIS  98   2.844  16.276  10.849
    8    HE2  HIS  98           HE2      HIS  98   2.019  18.670  10.788

  No H/Q in entry =           8
  In of MODEL   76
    1    H    GLU  99           H        GLU  99   5.001  16.505  17.356
    2    HA   GLU  99           HA       GLU  99   4.443  18.185  19.578
    3    HB2  GLU  99           HB2      GLU  99   4.345  15.703  19.658
    4    HB3  GLU  99           HB3      GLU  99   6.102  15.651  19.516
    5    HG2  GLU  99           HG2      GLU  99   6.337  16.927  21.595
    6    HG3  GLU  99           HG3      GLU  99   4.587  17.074  21.726

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LYS 100           H        LYS 100   7.462  17.253  17.947
    2    HA   LYS 100           HA       LYS 100   9.159  18.632  19.782
    3    HB2  LYS 100           HB2      LYS 100   9.598  17.727  16.927
    4    HB3  LYS 100           HB3      LYS 100  10.851  18.484  17.917
    5    HG2  LYS 100           HG2      LYS 100  10.500  16.722  19.652
    6    HG3  LYS 100           HG3      LYS 100   9.344  15.931  18.577
    7    HD2  LYS 100           HD2      LYS 100  11.104  15.654  16.873
    8    HD3  LYS 100           HD3      LYS 100  12.265  16.456  17.933
    9    HE2  LYS 100           HE2      LYS 100  11.894  14.689  19.645
   10    HE3  LYS 100           HE3      LYS 100  10.794  13.867  18.534
   11    HZ1  LYS 100           HZ1      LYS 100  13.604  14.529  17.829
   12    HZ3  LYS 100           HZ2      LYS 100  12.540  13.485  17.014
   13    HZ2  LYS 100           HZ3      LYS 100  13.156  13.051  18.537

  No H/Q in entry =          13
  In of MODEL   76
    1    H    LEU 101           H        LEU 101   7.412  19.589  16.867
    2    HA   LEU 101           HA       LEU 101   8.631  22.143  16.528
    3    HB2  LEU 101           HB2      LEU 101   6.013  20.928  15.683
    4    HB3  LEU 101           HB3      LEU 101   6.268  22.660  15.484
    5    HG   LEU 101           HG       LEU 101   8.276  20.642  14.463
    6   HD12  LEU 101          HD11      LEU 101   7.081  21.170  12.205
    7   HD11  LEU 101          HD12      LEU 101   5.702  21.599  13.216
    8   HD13  LEU 101          HD13      LEU 101   6.361  19.965  13.272
    9   HD21  LEU 101          HD21      LEU 101   7.651  23.561  13.942
   10   HD23  LEU 101          HD22      LEU 101   8.605  22.605  12.809
   11   HD22  LEU 101          HD23      LEU 101   9.180  22.848  14.458

  No H/Q in entry =          11
  In of MODEL   76
    1    H    LYS 102           H        LYS 102   7.140  20.992  19.164
    2    HA   LYS 102           HA       LYS 102   6.551  22.072  21.117
    3    HB2  LYS 102           HB2      LYS 102   7.821  24.065  19.983
    4    HB3  LYS 102           HB3      LYS 102   6.218  24.680  19.643
    5    HG2  LYS 102           HG2      LYS 102   7.645  24.397  22.266
    6    HG3  LYS 102           HG3      LYS 102   6.687  25.735  21.666
    7    HD2  LYS 102           HD2      LYS 102   5.448  23.098  22.548
    8    HD3  LYS 102           HD3      LYS 102   5.724  24.449  23.637
    9    HE2  LYS 102           HE2      LYS 102   3.414  24.068  22.190
   10    HE3  LYS 102           HE3      LYS 102   3.938  25.606  22.874
   11    HZ2  LYS 102           HZ1      LYS 102   3.361  25.735  20.506
   12    HZ1  LYS 102           HZ2      LYS 102   4.611  24.650  20.150
   13    HZ3  LYS 102           HZ3      LYS 102   4.974  26.174  20.798

  No H/Q in entry =          13
  In of MODEL   76
    1    H    ALA 103           H        ALA 103   4.867  23.644  18.394
    2    HA   ALA 103           HA       ALA 103   2.433  24.225  19.331
    3    HB1  ALA 103           HB1      ALA 103   1.487  23.405  17.101
    4    HB2  ALA 103           HB2      ALA 103   3.125  22.863  16.734
    5    HB3  ALA 103           HB3      ALA 103   2.804  24.575  17.021

  No H/Q in entry =           5
  In of MODEL   76
    1    H1   ALA   1           H3       ALA   1  10.314 -20.117  -6.450
    2    H2   ALA   1           H2       ALA   1   9.321 -20.307  -7.818
    3    H3   ALA   1           H1       ALA   1   8.909 -21.062  -6.352
    4    HA   ALA   1           HA       ALA   1   9.924 -22.871  -7.126
    5    HB1  ALA   1           HB1      ALA   1   9.976 -22.494  -9.401
    6    HB2  ALA   1           HB2      ALA   1  11.710 -22.356  -9.105
    7    HB3  ALA   1           HB3      ALA   1  10.717 -20.902  -9.224

  No H/Q in entry =           7
  In of MODEL   76
    1    H    GLU   2           H        GLU   2  12.200 -23.833  -7.237
    2    HA   GLU   2           HA       GLU   2  13.626 -23.777  -5.052
    3    HB2  GLU   2           HB2      GLU   2  14.929 -23.632  -7.777
    4    HB3  GLU   2           HB3      GLU   2  15.683 -24.259  -6.311
    5    HG2  GLU   2           HG2      GLU   2  14.650 -26.268  -6.547
    6    HG3  GLU   2           HG3      GLU   2  13.078 -25.511  -6.769

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLU   3           H        GLU   3  15.360 -21.903  -7.474
    2    HA   GLU   3           HA       GLU   3  16.561 -20.238  -5.524
    3    HB2  GLU   3           HB2      GLU   3  16.446 -20.212  -8.533
    4    HB3  GLU   3           HB3      GLU   3  17.217 -18.894  -7.650
    5    HG2  GLU   3           HG2      GLU   3  18.889 -20.285  -6.772
    6    HG3  GLU   3           HG3      GLU   3  17.930 -21.745  -6.985

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LEU   4           H        LEU   4  14.232 -19.357  -8.103
    2    HA   LEU   4           HA       LEU   4  13.794 -16.750  -7.462
    3    HB2  LEU   4           HB2      LEU   4  11.593 -18.706  -8.164
    4    HB3  LEU   4           HB3      LEU   4  11.524 -16.956  -8.347
    5    HG   LEU   4           HG       LEU   4  13.450 -18.819  -9.774
    6   HD13  LEU   4          HD11      LEU   4  12.111 -18.648 -11.656
    7   HD12  LEU   4          HD12      LEU   4  11.422 -17.103 -11.163
    8   HD11  LEU   4          HD13      LEU   4  10.875 -18.596 -10.402
    9   HD23  LEU   4          HD21      LEU   4  13.773 -16.565 -11.114
   10   HD22  LEU   4          HD22      LEU   4  14.661 -16.825  -9.614
   11   HD21  LEU   4          HD23      LEU   4  13.214 -15.820  -9.616

  No H/Q in entry =          11
  In of MODEL   76
    1    H    GLU   5           H        GLU   5  12.325 -19.538  -5.812
    2    HA   GLU   5           HA       GLU   5  10.692 -17.971  -4.064
    3    HB2  GLU   5           HB2      GLU   5  10.232 -20.337  -4.589
    4    HB3  GLU   5           HB3      GLU   5  11.691 -20.796  -3.708
    5    HG2  GLU   5           HG2      GLU   5  10.797 -19.809  -1.655
    6    HG3  GLU   5           HG3      GLU   5   9.361 -19.266  -2.522

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLU   6           H        GLU   6  13.837 -19.572  -3.696
    2    HA   GLU   6           HA       GLU   6  14.248 -18.739  -0.999
    3    HB2  GLU   6           HB2      GLU   6  15.432 -20.653  -2.114
    4    HB3  GLU   6           HB3      GLU   6  16.345 -19.471  -3.056
    5    HG2  GLU   6           HG2      GLU   6  17.745 -19.932  -1.210
    6    HG3  GLU   6           HG3      GLU   6  16.957 -18.415  -0.780

  No H/Q in entry =           6
  In of MODEL   76
    1    H    VAL   7           H        VAL   7  14.958 -17.392  -4.153
    2    HA   VAL   7           HA       VAL   7  16.673 -15.281  -3.306
    3    HB   VAL   7           HB       VAL   7  14.916 -15.616  -5.751
    4   HG11  VAL   7          HG11      VAL   7  16.838 -13.419  -4.960
    5   HG13  VAL   7          HG12      VAL   7  15.184 -13.263  -5.549
    6   HG12  VAL   7          HG13      VAL   7  16.469 -13.764  -6.649
    7   HG21  VAL   7          HG21      VAL   7  17.026 -17.088  -5.236
    8   HG23  VAL   7          HG22      VAL   7  17.931 -15.629  -5.641
    9   HG22  VAL   7          HG23      VAL   7  16.867 -16.363  -6.837

  No H/Q in entry =           9
  In of MODEL   76
    1    H    VAL   8           H        VAL   8  13.169 -15.528  -3.794
    2    HA   VAL   8           HA       VAL   8  12.527 -12.820  -3.288
    3    HB   VAL   8           HB       VAL   8  10.937 -15.367  -2.908
    4   HG11  VAL   8          HG11      VAL   8  10.190 -12.474  -2.457
    5   HG13  VAL   8          HG12      VAL   8   9.925 -13.852  -1.389
    6   HG12  VAL   8          HG13      VAL   8   8.975 -13.684  -2.863
    7   HG23  VAL   8          HG21      VAL   8  10.379 -13.200  -4.940
    8   HG22  VAL   8          HG22      VAL   8  10.027 -14.922  -5.027
    9   HG21  VAL   8          HG23      VAL   8  11.677 -14.352  -5.252

  No H/Q in entry =           9
  In of MODEL   76
    1    H    MET   9           H        MET   9  12.823 -15.645  -1.136
    2    HA   MET   9           HA       MET   9  12.061 -14.388   1.260
    3    HB2  MET   9           HB2      MET   9  13.899 -16.689   0.633
    4    HB3  MET   9           HB3      MET   9  13.733 -16.096   2.287
    5    HG2  MET   9           HG2      MET   9  11.191 -16.306   1.917
    6    HG3  MET   9           HG3      MET   9  11.605 -17.274   0.501
    7    HE3  MET   9           HE1      MET   9  13.033 -20.455   1.641
    8    HE2  MET   9           HE2      MET   9  14.079 -19.103   1.213
    9    HE1  MET   9           HE3      MET   9  12.557 -19.334   0.358

  No H/Q in entry =           9
  In of MODEL   76
    1    H    GLY  10           H        GLY  10  15.210 -14.615  -0.362
    2    HA3  GLY  10           HA2      GLY  10  16.714 -13.216   1.590
    3    HA2  GLY  10           HA3      GLY  10  17.143 -13.370  -0.114

  No H/Q in entry =           3
  In of MODEL   76
    1    H    LEU  11           H        LEU  11  14.956 -12.130  -1.300
    2    HA   LEU  11           HA       LEU  11  15.656  -9.389  -1.129
    3    HB2  LEU  11           HB2      LEU  11  13.258 -10.779  -2.328
    4    HB3  LEU  11           HB3      LEU  11  13.543  -9.044  -2.479
    5    HG   LEU  11           HG       LEU  11  15.545 -11.155  -3.324
    6   HD13  LEU  11          HD11      LEU  11  13.768 -11.503  -4.812
    7   HD12  LEU  11          HD12      LEU  11  14.759 -10.319  -5.662
    8   HD11  LEU  11          HD13      LEU  11  13.304  -9.801  -4.811
    9   HD22  LEU  11          HD21      LEU  11  16.789  -9.199  -3.107
   10   HD21  LEU  11          HD22      LEU  11  15.412  -8.153  -3.450
   11   HD23  LEU  11          HD23      LEU  11  16.213  -9.015  -4.762

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  12           H        ILE  12  12.906 -11.214   0.179
    2    HA   ILE  12           HA       ILE  12  11.543  -8.993   1.283
    3    HB   ILE  12           HB       ILE  12  11.587 -11.883   2.209
    4   HG12  ILE  12          HG12      ILE  12  10.854 -11.232  -0.220
    5   HG13  ILE  12          HG13      ILE  12   9.839 -12.320   0.705
    6   HG23  ILE  12          HG21      ILE  12  10.671 -10.525   3.980
    7   HG22  ILE  12          HG22      ILE  12   9.307 -11.279   3.156
    8   HG21  ILE  12          HG23      ILE  12   9.705  -9.591   2.840
    9   HD12  ILE  12          HD11      ILE  12   8.583 -10.516  -0.491
   10   HD11  ILE  12          HD12      ILE  12   9.430  -9.327   0.496
   11   HD13  ILE  12          HD13      ILE  12   8.349 -10.481   1.248

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  13           H        ILE  13  13.955 -11.217   2.624
    2    HA   ILE  13           HA       ILE  13  14.045 -10.059   5.212
    3    HB   ILE  13           HB       ILE  13  16.070 -11.624   3.593
    4   HG12  ILE  13          HG12      ILE  13  13.838 -12.633   4.412
    5   HG13  ILE  13          HG13      ILE  13  15.317 -13.519   4.769
    6   HG22  ILE  13          HG21      ILE  13  17.244 -11.983   5.798
    7   HG21  ILE  13          HG22      ILE  13  16.237 -10.718   6.489
    8   HG23  ILE  13          HG23      ILE  13  17.361 -10.333   5.187
    9   HD11  ILE  13          HD11      ILE  13  14.536 -11.542   6.838
   10   HD13  ILE  13          HD12      ILE  13  15.116 -13.195   7.013
   11   HD12  ILE  13          HD13      ILE  13  13.424 -12.894   6.637

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ASN  14           H        ASN  14  15.942  -9.510   2.260
    2    HA   ASN  14           HA       ASN  14  17.713  -7.581   3.302
    3    HB2  ASN  14           HB2      ASN  14  17.641  -8.829   0.978
    4    HB3  ASN  14           HB3      ASN  14  16.741  -7.406   0.469
    5   HD21  ASN  14          HD21      ASN  14  19.157  -7.742  -0.767
    6   HD22  ASN  14          HD22      ASN  14  20.315  -6.666  -0.154

  No H/Q in entry =           6
  In of MODEL   76
    1    H    SER  15           H        SER  15  14.570  -7.214   1.674
    2    HA   SER  15           HA       SER  15  14.465  -4.394   1.755
    3    HB2  SER  15           HB2      SER  15  12.126  -4.632   1.299
    4    HB3  SER  15           HB3      SER  15  12.902  -5.998   0.509
    5    HG   SER  15           HG       SER  15  11.858  -7.281   1.790

  No H/Q in entry =           5
  In of MODEL   76
    1    H    GLY  16           H        GLY  16  13.412  -6.870   4.060
    2    HA3  GLY  16           HA2      GLY  16  12.231  -5.134   5.955
    3    HA2  GLY  16           HA3      GLY  16  12.850  -6.746   6.292

  No H/Q in entry =           3
  In of MODEL   76
    1    H    GLN  17           H        GLN  17  15.549  -6.413   5.649
    2    HA   GLN  17           HA       GLN  17  16.554  -5.212   8.020
    3    HB2  GLN  17           HB2      GLN  17  17.767  -6.992   6.811
    4    HB3  GLN  17           HB3      GLN  17  18.026  -5.893   5.456
    5    HG2  GLN  17           HG2      GLN  17  19.308  -4.380   6.892
    6    HG3  GLN  17           HG3      GLN  17  19.003  -5.414   8.286
    7   HE21  GLN  17          HE21      GLN  17  21.675  -4.889   7.492
    8   HE22  GLN  17          HE22      GLN  17  22.350  -6.312   6.862

  No H/Q in entry =           8
  In of MODEL   76
    1    H    ALA  18           H        ALA  18  16.302  -4.107   4.673
    2    HA   ALA  18           HA       ALA  18  17.745  -1.718   4.891
    3    HB2  ALA  18           HB1      ALA  18  16.585  -2.915   2.836
    4    HB3  ALA  18           HB2      ALA  18  16.852  -1.172   2.829
    5    HB1  ALA  18           HB3      ALA  18  15.259  -1.819   3.225

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ARG  19           H        ARG  19  14.253  -2.305   5.351
    2    HA   ARG  19           HA       ARG  19  13.602   0.340   6.100
    3    HB2  ARG  19           HB2      ARG  19  11.908  -1.405   5.532
    4    HB3  ARG  19           HB3      ARG  19  12.278  -2.216   7.056
    5    HG2  ARG  19           HG2      ARG  19  11.595  -0.233   8.325
    6    HG3  ARG  19           HG3      ARG  19  11.316   0.655   6.828
    7    HD2  ARG  19           HD2      ARG  19   9.190  -0.145   7.683
    8    HD3  ARG  19           HD3      ARG  19   9.579  -1.013   6.192
    9    HE   ARG  19           HE       ARG  19  10.577  -2.573   8.266
   10   HH21  ARG  19          HH11      ARG  19   9.344  -4.219   9.216
   11   HH22  ARG  19          HH12      ARG  19   7.621  -4.189   9.079
   12   HH11  ARG  19          HH21      ARG  19   7.563  -1.269   7.240
   13   HH12  ARG  19          HH22      ARG  19   6.613  -2.519   7.956

  No H/Q in entry =          13
  In of MODEL   76
    1    H    SER  20           H        SER  20  14.494  -2.507   8.020
    2    HA   SER  20           HA       SER  20  14.262  -1.427  10.571
    3    HB2  SER  20           HB2      SER  20  14.883  -3.836   9.858
    4    HB3  SER  20           HB3      SER  20  16.542  -3.246   9.821
    5    HG   SER  20           HG       SER  20  16.187  -2.527  12.004

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LEU  21           H        LEU  21  17.063  -1.352   8.380
    2    HA   LEU  21           HA       LEU  21  18.773   0.119  10.098
    3    HB2  LEU  21           HB2      LEU  21  18.693  -0.127   7.083
    4    HB3  LEU  21           HB3      LEU  21  19.966   0.722   7.955
    5    HG   LEU  21           HG       LEU  21  19.229  -2.172   8.488
    6   HD12  LEU  21          HD11      LEU  21  21.479  -1.062   6.780
    7   HD11  LEU  21          HD12      LEU  21  20.036  -1.865   6.162
    8   HD13  LEU  21          HD13      LEU  21  21.194  -2.765   7.141
    9   HD22  LEU  21          HD21      LEU  21  20.443  -1.494  10.363
   10   HD21  LEU  21          HD22      LEU  21  21.368  -0.289   9.475
   11   HD23  LEU  21          HD23      LEU  21  21.765  -1.992   9.312

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ALA  22           H        ALA  22  16.461   1.111   7.594
    2    HA   ALA  22           HA       ALA  22  17.004   3.868   7.619
    3    HB3  ALA  22           HB1      ALA  22  15.567   2.641   5.958
    4    HB2  ALA  22           HB2      ALA  22  14.874   4.150   6.550
    5    HB1  ALA  22           HB3      ALA  22  14.293   2.606   7.177

  No H/Q in entry =           5
  In of MODEL   76
    1    H    TYR  23           H        TYR  23  14.540   2.041   9.487
    2    HA   TYR  23           HA       TYR  23  13.609   4.267  10.972
    3    HB2  TYR  23           HB2      TYR  23  12.369   2.157  10.959
    4    HB3  TYR  23           HB3      TYR  23  13.716   1.336  11.749
    5    HD1  TYR  23           HD1      TYR  23  11.222   4.078  12.190
    6    HD2  TYR  23           HD2      TYR  23  13.964   1.379  14.102
    7    HE1  TYR  23           HE1      TYR  23  10.341   4.753  14.408
    8    HE2  TYR  23           HE2      TYR  23  13.082   2.053  16.318
    9    HH   TYR  23           HH       TYR  23  10.489   4.491  16.601

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ALA  24           H        ALA  24  16.262   1.983  11.541
    2    HA   ALA  24           HA       ALA  24  16.983   2.957  14.098
    3    HB1  ALA  24           HB1      ALA  24  18.333   1.163  13.893
    4    HB3  ALA  24           HB2      ALA  24  19.341   2.092  12.782
    5    HB2  ALA  24           HB3      ALA  24  18.033   1.090  12.158

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ALA  25           H        ALA  25  17.879   3.910  10.809
    2    HA   ALA  25           HA       ALA  25  19.839   5.836  11.433
    3    HB1  ALA  25           HB1      ALA  25  19.077   4.908   9.124
    4    HB3  ALA  25           HB2      ALA  25  19.583   6.594   9.221
    5    HB2  ALA  25           HB3      ALA  25  17.867   6.190   9.182

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LEU  26           H        LEU  26  16.319   6.075  11.141
    2    HA   LEU  26           HA       LEU  26  16.109   8.853  11.618
    3    HB2  LEU  26           HB2      LEU  26  14.227   7.629  10.716
    4    HB3  LEU  26           HB3      LEU  26  14.162   6.590  12.135
    5    HG   LEU  26           HG       LEU  26  13.587   8.538  13.542
    6   HD12  LEU  26          HD11      LEU  26  12.905  10.650  12.246
    7   HD11  LEU  26          HD12      LEU  26  13.859  10.006  10.913
    8   HD13  LEU  26          HD13      LEU  26  14.634  10.377  12.454
    9   HD21  LEU  26          HD21      LEU  26  11.863   8.248  11.063
   10   HD23  LEU  26          HD22      LEU  26  11.333   8.935  12.595
   11   HD22  LEU  26          HD23      LEU  26  11.780   7.233  12.503

  No H/Q in entry =          11
  In of MODEL   76
    1    H    LYS  27           H        LYS  27  16.036   6.057  13.791
    2    HA   LYS  27           HA       LYS  27  15.493   7.405  16.181
    3    HB2  LYS  27           HB2      LYS  27  15.509   4.932  15.895
    4    HB3  LYS  27           HB3      LYS  27  17.272   4.980  15.819
    5    HG2  LYS  27           HG2      LYS  27  17.368   5.948  18.075
    6    HG3  LYS  27           HG3      LYS  27  15.602   5.970  18.154
    7    HD2  LYS  27           HD2      LYS  27  15.565   3.505  17.898
    8    HD3  LYS  27           HD3      LYS  27  17.330   3.490  17.853
    9    HE2  LYS  27           HE2      LYS  27  17.410   4.461  20.116
   10    HE3  LYS  27           HE3      LYS  27  15.645   4.506  20.165
   11    HZ3  LYS  27           HZ1      LYS  27  16.449   2.542  21.285
   12    HZ2  LYS  27           HZ2      LYS  27  17.338   2.071  19.913
   13    HZ1  LYS  27           HZ3      LYS  27  15.638   2.082  19.866

  No H/Q in entry =          13
  In of MODEL   76
    1    H    GLN  28           H        GLN  28  18.576   6.826  14.524
    2    HA   GLN  28           HA       GLN  28  20.302   7.889  16.491
    3    HB2  GLN  28           HB2      GLN  28  20.526   7.856  13.470
    4    HB3  GLN  28           HB3      GLN  28  21.836   8.334  14.552
    5    HG2  GLN  28           HG2      GLN  28  20.428   5.652  14.656
    6    HG3  GLN  28           HG3      GLN  28  21.971   5.935  13.852
    7   HE21  GLN  28          HE21      GLN  28  23.125   7.738  15.786
    8   HE22  GLN  28          HE22      GLN  28  23.402   6.861  17.212

  No H/Q in entry =           8
  In of MODEL   76
    1    H    ALA  29           H        ALA  29  18.504   9.399  13.845
    2    HA   ALA  29           HA       ALA  29  19.517  12.014  14.099
    3    HB2  ALA  29           HB1      ALA  29  17.792  12.669  12.666
    4    HB1  ALA  29           HB2      ALA  29  16.657  11.494  13.330
    5    HB3  ALA  29           HB3      ALA  29  17.965  10.956  12.277

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LYS  30           H        LYS  30  16.764  10.413  15.661
    2    HA   LYS  30           HA       LYS  30  15.785  12.659  17.055
    3    HB2  LYS  30           HB2      LYS  30  15.674   9.713  17.737
    4    HB3  LYS  30           HB3      LYS  30  14.831  10.959  18.657
    5    HG2  LYS  30           HG2      LYS  30  13.669  11.667  16.567
    6    HG3  LYS  30           HG3      LYS  30  14.452  10.334  15.714
    7    HD2  LYS  30           HD2      LYS  30  13.403   8.719  17.250
    8    HD3  LYS  30           HD3      LYS  30  12.630  10.040  18.126
    9    HE2  LYS  30           HE2      LYS  30  11.425  10.695  16.062
   10    HE3  LYS  30           HE3      LYS  30  12.177   9.344  15.205
   11    HZ2  LYS  30           HZ1      LYS  30   9.885   8.937  16.126
   12    HZ1  LYS  30           HZ2      LYS  30  10.582   8.975  17.681
   13    HZ3  LYS  30           HZ3      LYS  30  11.064   7.797  16.551

  No H/Q in entry =          13
  In of MODEL   76
    1    H    GLN  31           H        GLN  31  18.450  10.472  17.723
    2    HA   GLN  31           HA       GLN  31  18.833  11.463  20.419
    3    HB2  GLN  31           HB2      GLN  31  20.818   9.897  18.763
    4    HB3  GLN  31           HB3      GLN  31  20.718  10.008  20.520
    5    HG2  GLN  31           HG2      GLN  31  18.186   9.073  19.792
    6    HG3  GLN  31           HG3      GLN  31  19.263   8.232  18.684
    7   HE21  GLN  31          HE21      GLN  31  17.759   7.074  20.981
    8   HE22  GLN  31          HE22      GLN  31  18.932   6.400  22.004

  No H/Q in entry =           8
  In of MODEL   76
    1    H    GLY  32           H        GLY  32  19.301  12.803  17.453
    2    HA3  GLY  32           HA2      GLY  32  20.285  14.848  16.937
    3    HA2  GLY  32           HA3      GLY  32  21.073  14.836  18.510

  No H/Q in entry =           3
  In of MODEL   76
    1    H    ASP  33           H        ASP  33  21.447  11.957  16.702
    2    HA   ASP  33           HA       ASP  33  24.266  12.624  16.187
    3    HB2  ASP  33           HB2      ASP  33  22.749  10.013  16.311
    4    HB3  ASP  33           HB3      ASP  33  24.426  10.127  15.784

  No H/Q in entry =           4
  In of MODEL   76
    1    H    PHE  34           H        PHE  34  23.754  13.964  14.326
    2    HA   PHE  34           HA       PHE  34  22.357  13.004  12.057
    3    HB2  PHE  34           HB2      PHE  34  24.502  15.128  12.263
    4    HB3  PHE  34           HB3      PHE  34  23.488  14.853  10.848
    5    HD1  PHE  34           HD1      PHE  34  23.803  16.762  13.772
    6    HD2  PHE  34           HD2      PHE  34  20.871  14.678  11.425
    7    HE1  PHE  34           HE1      PHE  34  22.011  18.160  14.765
    8    HE2  PHE  34           HE2      PHE  34  19.083  16.075  12.421
    9    HZ   PHE  34           HZ       PHE  34  19.656  17.817  14.087

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ALA  35           H        ALA  35  25.750  12.795  12.998
    2    HA   ALA  35           HA       ALA  35  26.804  11.990  10.513
    3    HB3  ALA  35           HB1      ALA  35  28.513  10.799  12.191
    4    HB2  ALA  35           HB2      ALA  35  27.675  11.819  13.361
    5    HB1  ALA  35           HB3      ALA  35  28.488  12.550  11.979

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ALA  36           H        ALA  36  25.734  10.016  13.284
    2    HA   ALA  36           HA       ALA  36  26.184   7.537  11.979
    3    HB2  ALA  36           HB1      ALA  36  25.791   6.775  14.057
    4    HB3  ALA  36           HB2      ALA  36  24.102   7.277  13.943
    5    HB1  ALA  36           HB3      ALA  36  25.319   8.399  14.552

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ALA  37           H        ALA  37  23.373   9.671  12.185
    2    HA   ALA  37           HA       ALA  37  21.489   7.918  11.031
    3    HB3  ALA  37           HB1      ALA  37  21.730  10.878  11.342
    4    HB1  ALA  37           HB2      ALA  37  20.424   9.799  11.831
    5    HB2  ALA  37           HB3      ALA  37  20.582  10.285  10.142

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LYS  38           H        LYS  38  23.567  10.384   9.531
    2    HA   LYS  38           HA       LYS  38  22.875   9.980   6.864
    3    HB2  LYS  38           HB2      LYS  38  24.717  11.520   8.286
    4    HB3  LYS  38           HB3      LYS  38  25.727  10.536   7.233
    5    HG2  LYS  38           HG2      LYS  38  24.527  11.326   5.266
    6    HG3  LYS  38           HG3      LYS  38  23.354  12.176   6.277
    7    HD2  LYS  38           HD2      LYS  38  24.968  13.764   7.011
    8    HD3  LYS  38           HD3      LYS  38  26.315  12.778   6.441
    9    HE2  LYS  38           HE2      LYS  38  25.934  14.663   4.912
   10    HE3  LYS  38           HE3      LYS  38  25.579  13.133   4.102
   11    HZ3  LYS  38           HZ1      LYS  38  23.381  13.585   4.018
   12    HZ2  LYS  38           HZ2      LYS  38  23.910  15.198   4.108
   13    HZ1  LYS  38           HZ3      LYS  38  23.361  14.404   5.505

  No H/Q in entry =          13
  In of MODEL   76
    1    H    ALA  39           H        ALA  39  25.422   8.360   8.758
    2    HA   ALA  39           HA       ALA  39  26.446   6.785   6.655
    3    HB2  ALA  39           HB1      ALA  39  26.410   5.799   9.492
    4    HB1  ALA  39           HB2      ALA  39  27.358   7.225   9.069
    5    HB3  ALA  39           HB3      ALA  39  27.691   5.680   8.286

  No H/Q in entry =           5
  In of MODEL   76
    1    H    MET  40           H        MET  40  23.876   6.157   8.998
    2    HA   MET  40           HA       MET  40  23.412   3.459   8.251
    3    HB2  MET  40           HB2      MET  40  21.626   5.497   9.594
    4    HB3  MET  40           HB3      MET  40  21.212   3.790   9.414
    5    HG2  MET  40           HG2      MET  40  23.789   4.714  10.713
    6    HG3  MET  40           HG3      MET  40  22.312   4.435  11.632
    7    HE3  MET  40           HE1      MET  40  21.743   0.801  11.789
    8    HE2  MET  40           HE2      MET  40  20.862   2.113  11.009
    9    HE1  MET  40           HE3      MET  40  21.634   2.385  12.570

  No H/Q in entry =           9
  In of MODEL   76
    1    H    MET  41           H        MET  41  21.983   6.525   7.116
    2    HA   MET  41           HA       MET  41  19.991   5.348   5.473
    3    HB2  MET  41           HB2      MET  41  21.468   7.939   4.952
    4    HB3  MET  41           HB3      MET  41  19.925   7.455   4.259
    5    HG2  MET  41           HG2      MET  41  19.229   7.247   6.823
    6    HG3  MET  41           HG3      MET  41  20.544   8.400   7.029
    7    HE2  MET  41           HE1      MET  41  19.920   9.716   3.714
    8    HE1  MET  41           HE2      MET  41  20.904  10.143   5.110
    9    HE3  MET  41           HE3      MET  41  19.623  11.229   4.580

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ASP  42           H        ASP  42  23.354   6.269   4.862
    2    HA   ASP  42           HA       ASP  42  23.392   5.817   2.099
    3    HB2  ASP  42           HB2      ASP  42  25.179   6.797   3.842
    4    HB3  ASP  42           HB3      ASP  42  25.830   5.171   3.688

  No H/Q in entry =           4
  In of MODEL   76
    1    H    GLN  43           H        GLN  43  24.164   3.639   4.787
    2    HA   GLN  43           HA       GLN  43  24.793   1.393   3.174
    3    HB2  GLN  43           HB2      GLN  43  23.826   1.555   6.038
    4    HB3  GLN  43           HB3      GLN  43  24.387   0.071   5.260
    5    HG2  GLN  43           HG2      GLN  43  26.543   1.282   4.717
    6    HG3  GLN  43           HG3      GLN  43  25.982   2.602   5.738
    7   HE21  GLN  43          HE21      GLN  43  28.233   1.616   6.723
    8   HE22  GLN  43          HE22      GLN  43  27.981   0.524   7.996

  No H/Q in entry =           8
  In of MODEL   76
    1    H    SER  44           H        SER  44  21.767   2.521   4.627
    2    HA   SER  44           HA       SER  44  20.181   0.287   3.967
    3    HB2  SER  44           HB2      SER  44  19.766   2.807   5.141
    4    HB3  SER  44           HB3      SER  44  18.705   2.777   3.736
    5    HG   SER  44           HG       SER  44  17.643   1.822   5.472

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ARG  45           H        ARG  45  20.894   3.265   2.172
    2    HA   ARG  45           HA       ARG  45  19.324   2.800  -0.107
    3    HB2  ARG  45           HB2      ARG  45  20.483   4.929   0.473
    4    HB3  ARG  45           HB3      ARG  45  22.018   4.175   0.051
    5    HG2  ARG  45           HG2      ARG  45  21.189   3.790  -2.251
    6    HG3  ARG  45           HG3      ARG  45  19.666   4.567  -1.828
    7    HD2  ARG  45           HD2      ARG  45  20.932   6.657  -1.251
    8    HD3  ARG  45           HD3      ARG  45  22.416   5.884  -1.855
    9    HE   ARG  45           HE       ARG  45  20.446   5.667  -3.855
   10   HH21  ARG  45          HH11      ARG  45  20.407   7.051  -5.607
   11   HH22  ARG  45          HH12      ARG  45  21.170   8.599  -5.505
   12   HH11  ARG  45          HH21      ARG  45  22.213   8.149  -2.242
   13   HH12  ARG  45          HH22      ARG  45  22.191   9.220  -3.597

  No H/Q in entry =          13
  In of MODEL   76
    1    H    MET  46           H        MET  46  22.700   1.912   0.568
    2    HA   MET  46           HA       MET  46  23.254   0.738  -1.937
    3    HB2  MET  46           HB2      MET  46  24.415   0.394   0.827
    4    HB3  MET  46           HB3      MET  46  25.038  -0.500  -0.563
    5    HG2  MET  46           HG2      MET  46  25.470   1.605  -1.752
    6    HG3  MET  46           HG3      MET  46  24.797   2.520  -0.409
    7    HE1  MET  46           HE1      MET  46  27.280   0.171  -1.741
    8    HE3  MET  46           HE2      MET  46  27.411  -0.707  -0.220
    9    HE2  MET  46           HE3      MET  46  28.746   0.308  -0.762

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ALA  47           H        ALA  47  21.926  -0.616   1.055
    2    HA   ALA  47           HA       ALA  47  21.848  -3.322   0.232
    3    HB2  ALA  47           HB1      ALA  47  21.517  -2.878   2.547
    4    HB3  ALA  47           HB2      ALA  47  19.966  -3.472   1.954
    5    HB1  ALA  47           HB3      ALA  47  20.206  -1.744   2.221

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LEU  48           H        LEU  48  19.497  -0.685  -0.057
    2    HA   LEU  48           HA       LEU  48  17.423  -2.202  -1.279
    3    HB2  LEU  48           HB2      LEU  48  18.084   0.751  -1.384
    4    HB3  LEU  48           HB3      LEU  48  16.598   0.050  -2.026
    5    HG   LEU  48           HG       LEU  48  17.509  -0.277   0.842
    6   HD13  LEU  48          HD11      LEU  48  17.095   2.026   0.682
    7   HD12  LEU  48          HD12      LEU  48  15.545   1.380   1.218
    8   HD11  LEU  48          HD13      LEU  48  15.783   1.814  -0.475
    9   HD22  LEU  48          HD21      LEU  48  15.967  -1.983   0.479
   10   HD21  LEU  48          HD22      LEU  48  15.071  -1.068  -0.734
   11   HD23  LEU  48          HD23      LEU  48  14.894  -0.676   0.977

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ASN  49           H        ASN  49  20.092  -0.273  -2.549
    2    HA   ASN  49           HA       ASN  49  19.385  -0.333  -5.259
    3    HB2  ASN  49           HB2      ASN  49  21.085   1.174  -4.375
    4    HB3  ASN  49           HB3      ASN  49  22.115  -0.188  -3.947
    5   HD21  ASN  49          HD21      ASN  49  21.031   1.845  -6.578
    6   HD22  ASN  49          HD22      ASN  49  22.061   1.194  -7.759

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLU  50           H        GLU  50  21.401  -2.550  -3.355
    2    HA   GLU  50           HA       GLU  50  22.053  -4.292  -5.508
    3    HB2  GLU  50           HB2      GLU  50  23.295  -4.287  -3.367
    4    HB3  GLU  50           HB3      GLU  50  21.866  -4.916  -2.546
    5    HG2  GLU  50           HG2      GLU  50  21.920  -6.939  -3.922
    6    HG3  GLU  50           HG3      GLU  50  23.280  -6.305  -4.846

  No H/Q in entry =           6
  In of MODEL   76
    1    H    ALA  51           H        ALA  51  19.445  -4.235  -3.127
    2    HA   ALA  51           HA       ALA  51  18.254  -6.698  -3.879
    3    HB3  ALA  51           HB1      ALA  51  16.696  -6.198  -2.287
    4    HB1  ALA  51           HB2      ALA  51  16.477  -4.546  -2.869
    5    HB2  ALA  51           HB3      ALA  51  17.856  -4.946  -1.844

  No H/Q in entry =           5
  In of MODEL   76
    1    H    HIS  52           H        HIS  52  17.660  -3.340  -4.877
    2    HA   HIS  52           HA       HIS  52  15.508  -3.845  -6.636
    3    HB2  HIS  52           HB2      HIS  52  16.100  -1.588  -5.873
    4    HB3  HIS  52           HB3      HIS  52  17.620  -1.679  -6.763
    5    HD1  HIS  52           HD1      HIS  52  17.343  -2.027  -9.448
    6    HD2  HIS  52           HD2      HIS  52  13.957  -0.709  -7.405
    7    HE1  HIS  52           HE1      HIS  52  15.772  -1.083 -11.197
    8    HE2  HIS  52           HE2      HIS  52  13.703  -0.275  -9.966

  No H/Q in entry =           8
  In of MODEL   76
    1    H    LEU  53           H        LEU  53  19.016  -3.860  -7.142
    2    HA   LEU  53           HA       LEU  53  19.014  -4.155  -9.945
    3    HB2  LEU  53           HB2      LEU  53  20.989  -4.936  -7.816
    4    HB3  LEU  53           HB3      LEU  53  21.269  -5.318  -9.512
    5    HG   LEU  53           HG       LEU  53  20.636  -2.509  -8.549
    6   HD13  LEU  53          HD11      LEU  53  23.008  -2.046  -8.579
    7   HD12  LEU  53          HD12      LEU  53  23.364  -3.669  -9.173
    8   HD11  LEU  53          HD13      LEU  53  22.751  -3.444  -7.539
    9   HD22  LEU  53          HD21      LEU  53  20.306  -2.541 -10.881
   10   HD21  LEU  53          HD22      LEU  53  21.565  -3.746 -11.136
   11   HD23  LEU  53          HD23      LEU  53  22.002  -2.087 -10.777

  No H/Q in entry =          11
  In of MODEL   76
    1    H    VAL  54           H        VAL  54  18.948  -6.561  -7.335
    2    HA   VAL  54           HA       VAL  54  19.029  -8.843  -9.013
    3    HB   VAL  54           HB       VAL  54  17.934  -8.436  -6.219
    4   HG12  VAL  54          HG11      VAL  54  18.250 -11.055  -6.241
    5   HG11  VAL  54          HG12      VAL  54  18.029 -10.873  -7.981
    6   HG13  VAL  54          HG13      VAL  54  16.765 -10.347  -6.872
    7   HG22  VAL  54          HG21      VAL  54  20.254  -8.234  -6.043
    8   HG21  VAL  54          HG22      VAL  54  20.560  -9.317  -7.399
    9   HG23  VAL  54          HG23      VAL  54  20.060  -9.974  -5.840

  No H/Q in entry =           9
  In of MODEL   76
    1    H    GLN  55           H        GLN  55  16.334  -6.942  -7.660
    2    HA   GLN  55           HA       GLN  55  14.286  -8.592  -8.704
    3    HB2  GLN  55           HB2      GLN  55  13.576  -7.076  -7.051
    4    HB3  GLN  55           HB3      GLN  55  14.357  -5.704  -7.834
    5    HG2  GLN  55           HG2      GLN  55  12.603  -5.365  -9.285
    6    HG3  GLN  55           HG3      GLN  55  12.273  -7.083  -9.460
    7   HE21  GLN  55          HE21      GLN  55  10.282  -7.632  -8.618
    8   HE22  GLN  55          HE22      GLN  55   9.537  -6.885  -7.288

  No H/Q in entry =           8
  In of MODEL   76
    1    H    THR  56           H        THR  56  16.005  -5.787 -10.079
    2    HA   THR  56           HA       THR  56  14.520  -5.405 -12.394
    3    HB   THR  56           HB       THR  56  17.542  -5.324 -12.292
    4    HG1  THR  56           HG1      THR  56  15.632  -3.386 -11.499
    5   HG21  THR  56          HG21      THR  56  15.416  -3.990 -13.969
    6   HG23  THR  56          HG22      THR  56  16.777  -4.971 -14.512
    7   HG22  THR  56          HG23      THR  56  17.060  -3.355 -13.859

  No H/Q in entry =           7
  In of MODEL   76
    1    H    LYS  57           H        LYS  57  17.175  -7.713 -11.855
    2    HA   LYS  57           HA       LYS  57  17.119  -8.889 -14.441
    3    HB2  LYS  57           HB2      LYS  57  18.947  -9.160 -12.740
    4    HB3  LYS  57           HB3      LYS  57  17.860 -10.153 -11.780
    5    HG2  LYS  57           HG2      LYS  57  17.705 -11.790 -13.596
    6    HG3  LYS  57           HG3      LYS  57  18.736 -10.790 -14.613
    7    HD2  LYS  57           HD2      LYS  57  20.583 -11.037 -12.985
    8    HD3  LYS  57           HD3      LYS  57  19.556 -12.058 -11.978
    9    HE2  LYS  57           HE2      LYS  57  21.004 -13.473 -13.360
   10    HE3  LYS  57           HE3      LYS  57  19.336 -13.665 -13.894
   11    HZ3  LYS  57           HZ1      LYS  57  19.699 -12.324 -15.748
   12    HZ2  LYS  57           HZ2      LYS  57  21.082 -13.307 -15.665
   13    HZ1  LYS  57           HZ3      LYS  57  21.150 -11.694 -15.138

  No H/Q in entry =          13
  In of MODEL   76
    1    H    LEU  58           H        LEU  58  15.399  -9.573 -11.434
    2    HA   LEU  58           HA       LEU  58  14.153 -11.938 -12.359
    3    HB2  LEU  58           HB2      LEU  58  13.409 -10.046 -10.134
    4    HB3  LEU  58           HB3      LEU  58  12.592 -11.580 -10.444
    5    HG   LEU  58           HG       LEU  58  15.577 -11.312  -9.950
    6   HD11  LEU  58          HD11      LEU  58  13.243 -11.737  -8.111
    7   HD13  LEU  58          HD12      LEU  58  14.703 -10.778  -7.872
    8   HD12  LEU  58          HD13      LEU  58  14.775 -12.536  -7.751
    9   HD22  LEU  58          HD21      LEU  58  15.433 -13.366 -10.989
   10   HD21  LEU  58          HD22      LEU  58  13.727 -13.575 -10.594
   11   HD23  LEU  58          HD23      LEU  58  14.960 -13.887  -9.373

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  59           H        ILE  59  13.475  -8.594 -13.004
    2    HA   ILE  59           HA       ILE  59  10.739  -9.231 -13.892
    3    HB   ILE  59           HB       ILE  59  11.567  -6.961 -12.685
    4   HG12  ILE  59          HG12      ILE  59   9.631  -6.807 -15.006
    5   HG13  ILE  59          HG13      ILE  59   9.227  -7.594 -13.503
    6   HG21  ILE  59          HG21      ILE  59  13.080  -6.555 -14.768
    7   HG23  ILE  59          HG22      ILE  59  12.127  -5.215 -14.172
    8   HG22  ILE  59          HG23      ILE  59  11.596  -6.125 -15.584
    9   HD12  ILE  59          HD11      ILE  59   8.479  -5.222 -13.556
   10   HD11  ILE  59          HD12      ILE  59  10.165  -4.733 -13.719
   11   HD13  ILE  59          HD13      ILE  59   9.620  -5.542 -12.249

  No H/Q in entry =          11
  In of MODEL   76
    1    H    GLU  60           H        GLU  60  13.918  -8.377 -15.211
    2    HA   GLU  60           HA       GLU  60  13.082  -7.956 -17.899
    3    HB2  GLU  60           HB2      GLU  60  15.328  -7.788 -18.386
    4    HB3  GLU  60           HB3      GLU  60  15.399  -7.550 -16.642
    5    HG2  GLU  60           HG2      GLU  60  15.747 -10.054 -16.416
    6    HG3  GLU  60           HG3      GLU  60  15.933 -10.112 -18.168

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLY  61           H        GLY  61  14.091 -10.852 -16.125
    2    HA3  GLY  61           HA2      GLY  61  13.496 -12.482 -18.526
    3    HA2  GLY  61           HA3      GLY  61  14.555 -12.975 -17.209

  No H/Q in entry =           3
  In of MODEL   76
    1    H    ASP  62           H        ASP  62  11.448 -11.425 -16.762
    2    HA   ASP  62           HA       ASP  62  10.540 -13.343 -14.910
    3    HB2  ASP  62           HB2      ASP  62   8.411 -12.142 -15.038
    4    HB3  ASP  62           HB3      ASP  62   9.764 -11.021 -14.930

  No H/Q in entry =           4
  In of MODEL   76
    1    H    ALA  63           H        ALA  63   9.584 -15.307 -15.166
    2    HA   ALA  63           HA       ALA  63   7.812 -15.855 -17.405
    3    HB3  ALA  63           HB1      ALA  63  10.405 -17.407 -17.165
    4    HB2  ALA  63           HB2      ALA  63  10.035 -16.240 -18.433
    5    HB1  ALA  63           HB3      ALA  63   9.103 -17.731 -18.310

  No H/Q in entry =           5
  In of MODEL   76
    1    H    GLY  64           H        GLY  64   9.141 -18.721 -16.663
    2    HA3  GLY  64           HA2      GLY  64   8.863 -20.261 -14.883
    3    HA2  GLY  64           HA3      GLY  64   7.718 -19.155 -14.137

  No H/Q in entry =           3
  In of MODEL   76
    1    H    GLU  65           H        GLU  65   6.679 -19.033 -17.161
    2    HA   GLU  65           HA       GLU  65   5.193 -21.568 -17.087
    3    HB2  GLU  65           HB2      GLU  65   3.938 -18.828 -17.223
    4    HB3  GLU  65           HB3      GLU  65   3.078 -20.334 -17.541
    5    HG2  GLU  65           HG2      GLU  65   4.542 -19.699 -14.965
    6    HG3  GLU  65           HG3      GLU  65   2.799 -19.555 -15.187

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLY  66           H        GLY  66   3.964 -22.015 -18.987
    2    HA3  GLY  66           HA2      GLY  66   5.437 -21.842 -21.367
    3    HA2  GLY  66           HA3      GLY  66   3.791 -22.423 -21.217

  No H/Q in entry =           3
  In of MODEL   76
    1    H    LYS  67           H        LYS  67   2.555 -20.088 -20.338
    2    HA   LYS  67           HA       LYS  67   2.416 -18.628 -22.841
    3    HB2  LYS  67           HB2      LYS  67   0.664 -18.682 -20.390
    4    HB3  LYS  67           HB3      LYS  67   0.352 -17.652 -21.792
    5    HG2  LYS  67           HG2      LYS  67   0.329 -19.628 -23.258
    6    HG3  LYS  67           HG3      LYS  67   0.669 -20.668 -21.878
    7    HD2  LYS  67           HD2      LYS  67  -1.458 -19.989 -20.834
    8    HD3  LYS  67           HD3      LYS  67  -1.800 -18.941 -22.214
    9    HE2  LYS  67           HE2      LYS  67  -1.738 -20.901 -23.717
   10    HE3  LYS  67           HE3      LYS  67  -1.412 -21.947 -22.336
   11    HZ3  LYS  67           HZ1      LYS  67  -3.551 -21.978 -21.807
   12    HZ2  LYS  67           HZ2      LYS  67  -3.874 -21.214 -23.288
   13    HZ1  LYS  67           HZ3      LYS  67  -3.677 -20.289 -21.877

  No H/Q in entry =          13
  In of MODEL   76
    1    H    MET  68           H        MET  68   1.419 -16.261 -22.201
    2    HA   MET  68           HA       MET  68   3.658 -14.620 -21.833
    3    HB2  MET  68           HB2      MET  68   0.700 -14.038 -21.750
    4    HB3  MET  68           HB3      MET  68   1.940 -12.784 -21.701
    5    HG2  MET  68           HG2      MET  68   2.854 -13.599 -23.844
    6    HG3  MET  68           HG3      MET  68   1.609 -14.847 -23.899
    7    HE2  MET  68           HE1      MET  68   0.153 -12.731 -26.644
    8    HE1  MET  68           HE2      MET  68   0.699 -14.302 -26.066
    9    HE3  MET  68           HE3      MET  68   1.875 -13.025 -26.366

  No H/Q in entry =           9
  In of MODEL   76
    1    H    LYS  69           H        LYS  69   2.051 -16.263 -19.386
    2    HA   LYS  69           HA       LYS  69   1.815 -14.317 -17.376
    3    HB2  LYS  69           HB2      LYS  69   2.164 -17.308 -17.213
    4    HB3  LYS  69           HB3      LYS  69   1.822 -16.289 -15.813
    5    HG2  LYS  69           HG2      LYS  69  -0.231 -15.479 -16.840
    6    HG3  LYS  69           HG3      LYS  69   0.128 -16.362 -18.324
    7    HD2  LYS  69           HD2      LYS  69  -1.407 -17.751 -17.181
    8    HD3  LYS  69           HD3      LYS  69   0.166 -18.472 -16.832
    9    HE2  LYS  69           HE2      LYS  69   0.249 -17.429 -14.662
   10    HE3  LYS  69           HE3      LYS  69  -1.175 -16.451 -15.019
   11    HZ3  LYS  69           HZ1      LYS  69  -2.520 -18.110 -14.463
   12    HZ2  LYS  69           HZ2      LYS  69  -1.165 -18.883 -13.792
   13    HZ1  LYS  69           HZ3      LYS  69  -1.655 -19.246 -15.377

  No H/Q in entry =          13
  In of MODEL   76
    1    H    VAL  70           H        VAL  70   2.985 -14.189 -15.283
    2    HA   VAL  70           HA       VAL  70   5.914 -14.540 -15.595
    3    HB   VAL  70           HB       VAL  70   6.185 -12.425 -14.341
    4   HG13  VAL  70          HG11      VAL  70   6.242 -12.313 -16.768
    5   HG12  VAL  70          HG12      VAL  70   5.359 -10.908 -16.167
    6   HG11  VAL  70          HG13      VAL  70   4.482 -12.278 -16.845
    7   HG21  VAL  70          HG21      VAL  70   3.154 -12.275 -14.591
    8   HG23  VAL  70          HG22      VAL  70   4.187 -10.961 -14.029
    9   HG22  VAL  70          HG23      VAL  70   4.061 -12.446 -13.087

  No H/Q in entry =           9
  In of MODEL   76
    1    H    SER  71           H        SER  71   7.045 -14.491 -13.457
    2    HA   SER  71           HA       SER  71   6.055 -16.463 -11.691
    3    HB2  SER  71           HB2      SER  71   8.473 -15.831 -11.985
    4    HB3  SER  71           HB3      SER  71   8.144 -14.358 -11.074
    5    HG   SER  71           HG       SER  71   7.117 -16.164  -9.602

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LEU  72           H        LEU  72   4.693 -16.332 -10.033
    2    HA   LEU  72           HA       LEU  72   3.157 -14.019  -9.540
    3    HB2  LEU  72           HB2      LEU  72   3.471 -16.592  -8.000
    4    HB3  LEU  72           HB3      LEU  72   2.318 -15.334  -7.558
    5    HG   LEU  72           HG       LEU  72   2.403 -16.593 -10.318
    6   HD11  LEU  72          HD11      LEU  72   0.939 -17.391  -7.806
    7   HD13  LEU  72          HD12      LEU  72   1.824 -18.414  -8.937
    8   HD12  LEU  72          HD13      LEU  72   0.260 -17.740  -9.397
    9   HD23  LEU  72          HD21      LEU  72  -0.077 -15.775 -10.146
   10   HD22  LEU  72          HD22      LEU  72   1.163 -14.578 -10.483
   11   HD21  LEU  72          HD23      LEU  72   0.518 -14.743  -8.852

  No H/Q in entry =          11
  In of MODEL   76
    1    H    VAL  73           H        VAL  73   5.846 -15.475  -7.831
    2    HA   VAL  73           HA       VAL  73   5.836 -13.960  -5.487
    3    HB   VAL  73           HB       VAL  73   7.980 -14.818  -5.079
    4   HG12  VAL  73          HG11      VAL  73   6.884 -16.820  -7.055
    5   HG11  VAL  73          HG12      VAL  73   6.082 -16.500  -5.517
    6   HG13  VAL  73          HG13      VAL  73   7.729 -17.129  -5.540
    7   HG22  VAL  73          HG21      VAL  73   9.220 -14.010  -6.951
    8   HG21  VAL  73          HG22      VAL  73   8.228 -14.915  -8.091
    9   HG23  VAL  73          HG23      VAL  73   9.346 -15.768  -7.027

  No H/Q in entry =           9
  In of MODEL   76
    1    H    LEU  74           H        LEU  74   6.764 -13.044  -8.675
    2    HA   LEU  74           HA       LEU  74   8.723 -11.103  -8.207
    3    HB2  LEU  74           HB2      LEU  74   8.231 -11.825 -10.441
    4    HB3  LEU  74           HB3      LEU  74   6.562 -11.277 -10.304
    5    HG   LEU  74           HG       LEU  74   7.343  -8.943 -10.088
    6   HD12  LEU  74          HD11      LEU  74   9.825  -8.603 -10.712
    7   HD11  LEU  74          HD12      LEU  74  10.040 -10.293 -10.261
    8   HD13  LEU  74          HD13      LEU  74   9.480  -9.127  -9.064
    9   HD22  LEU  74          HD21      LEU  74   7.638  -8.690 -12.349
   10   HD21  LEU  74          HD22      LEU  74   7.080 -10.346 -12.295
   11   HD23  LEU  74          HD23      LEU  74   8.790 -10.020 -12.457

  No H/Q in entry =          11
  In of MODEL   76
    1    H    VAL  75           H        VAL  75   5.222 -10.708  -8.488
    2    HA   VAL  75           HA       VAL  75   5.143  -7.956  -7.879
    3    HB   VAL  75           HB       VAL  75   3.056 -10.097  -7.464
    4   HG12  VAL  75          HG11      VAL  75   1.481  -8.139  -7.319
    5   HG11  VAL  75          HG12      VAL  75   2.873  -7.067  -7.302
    6   HG13  VAL  75          HG13      VAL  75   2.616  -8.188  -5.975
    7   HG21  VAL  75          HG21      VAL  75   3.957  -9.472  -9.807
    8   HG23  VAL  75          HG22      VAL  75   3.185  -7.910  -9.549
    9   HG22  VAL  75          HG23      VAL  75   2.212  -9.382  -9.574

  No H/Q in entry =           9
  In of MODEL   76
    1    H    GLU  76           H        GLU  76   4.924 -10.848  -5.786
    2    HA   GLU  76           HA       GLU  76   4.504  -9.505  -3.346
    3    HB2  GLU  76           HB2      GLU  76   4.313 -11.965  -3.581
    4    HB3  GLU  76           HB3      GLU  76   6.040 -12.073  -3.880
    5    HG2  GLU  76           HG2      GLU  76   5.672 -12.670  -1.573
    6    HG3  GLU  76           HG3      GLU  76   6.430 -11.088  -1.575

  No H/Q in entry =           6
  In of MODEL   76
    1    H    ALA  77           H        ALA  77   7.531 -10.407  -4.975
    2    HA   ALA  77           HA       ALA  77   9.262  -9.383  -2.984
    3    HB3  ALA  77           HB1      ALA  77   9.946  -9.410  -5.915
    4    HB1  ALA  77           HB2      ALA  77   9.807 -10.908  -4.996
    5    HB2  ALA  77           HB3      ALA  77  11.002  -9.698  -4.532

  No H/Q in entry =           5
  In of MODEL   76
    1    H    GLN  78           H        GLN  78   7.818  -7.940  -5.860
    2    HA   GLN  78           HA       GLN  78   9.178  -5.465  -5.763
    3    HB2  GLN  78           HB2      GLN  78   7.845  -6.359  -7.704
    4    HB3  GLN  78           HB3      GLN  78   6.378  -5.989  -6.797
    5    HG2  GLN  78           HG2      GLN  78   7.032  -3.619  -6.693
    6    HG3  GLN  78           HG3      GLN  78   8.503  -3.981  -7.596
    7   HE21  GLN  78          HE21      GLN  78   6.568  -2.148  -8.638
    8   HE22  GLN  78          HE22      GLN  78   5.850  -2.850 -10.007

  No H/Q in entry =           8
  In of MODEL   76
    1    H    LEU  79           H        LEU  79   6.184  -6.605  -4.284
    2    HA   LEU  79           HA       LEU  79   5.216  -4.203  -3.238
    3    HB2  LEU  79           HB2      LEU  79   3.897  -6.251  -3.173
    4    HB3  LEU  79           HB3      LEU  79   5.060  -7.002  -2.085
    5    HG   LEU  79           HG       LEU  79   4.545  -5.372  -0.336
    6   HD13  LEU  79          HD11      LEU  79   4.066  -3.348  -1.363
    7   HD12  LEU  79          HD12      LEU  79   2.448  -3.872  -0.897
    8   HD11  LEU  79          HD13      LEU  79   2.997  -4.084  -2.558
    9   HD23  LEU  79          HD21      LEU  79   1.959  -5.858  -0.201
   10   HD22  LEU  79          HD22      LEU  79   3.096  -7.201  -0.124
   11   HD21  LEU  79          HD23      LEU  79   2.256  -6.850  -1.631

  No H/Q in entry =          11
  In of MODEL   76
    1    H    HIS  80           H        HIS  80   7.420  -6.557  -1.714
    2    HA   HIS  80           HA       HIS  80   7.757  -5.034   0.661
    3    HB2  HIS  80           HB2      HIS  80   9.065  -7.392  -0.580
    4    HB3  HIS  80           HB3      HIS  80  10.001  -6.508   0.626
    5    HD1  HIS  80           HD1      HIS  80   9.552  -7.160   2.973
    6    HD2  HIS  80           HD2      HIS  80   6.286  -7.981   0.514
    7    HE1  HIS  80           HE1      HIS  80   7.803  -8.269   4.445
    8    HE2  HIS  80           HE2      HIS  80   5.807  -8.773   2.955

  No H/Q in entry =           8
  In of MODEL   76
    1    H    LEU  81           H        LEU  81   9.708  -5.294  -2.290
    2    HA   LEU  81           HA       LEU  81  11.774  -3.566  -1.436
    3    HB2  LEU  81           HB2      LEU  81  10.800  -4.335  -4.188
    4    HB3  LEU  81           HB3      LEU  81  12.228  -3.336  -3.916
    5    HG   LEU  81           HG       LEU  81  11.849  -6.065  -2.656
    6   HD12  LEU  81          HD11      LEU  81  13.631  -6.684  -4.443
    7   HD11  LEU  81          HD12      LEU  81  13.054  -5.252  -5.293
    8   HD13  LEU  81          HD13      LEU  81  11.944  -6.575  -4.945
    9   HD23  LEU  81          HD21      LEU  81  14.478  -5.759  -2.687
   10   HD22  LEU  81          HD22      LEU  81  13.522  -5.005  -1.414
   11   HD21  LEU  81          HD23      LEU  81  14.079  -4.045  -2.784

  No H/Q in entry =          11
  In of MODEL   76
    1    H    MET  82           H        MET  82   8.819  -2.905  -3.314
    2    HA   MET  82           HA       MET  82   9.360  -0.177  -3.804
    3    HB2  MET  82           HB2      MET  82   6.797  -1.762  -3.645
    4    HB3  MET  82           HB3      MET  82   6.797  -0.035  -3.996
    5    HG2  MET  82           HG2      MET  82   8.361  -2.103  -5.576
    6    HG3  MET  82           HG3      MET  82   6.787  -1.471  -6.055
    7    HE3  MET  82           HE1      MET  82   7.228   1.991  -7.209
    8    HE2  MET  82           HE2      MET  82   6.883   1.754  -5.497
    9    HE1  MET  82           HE3      MET  82   6.192   0.656  -6.688

  No H/Q in entry =           9
  In of MODEL   76
    1    H    THR  83           H        THR  83   7.609  -1.788  -1.179
    2    HA   THR  83           HA       THR  83   6.792   0.553   0.180
    3    HB   THR  83           HB       THR  83   6.687  -1.036   2.188
    4    HG1  THR  83           HG1      THR  83   7.432  -2.987   1.930
    5   HG22  THR  83          HG21      THR  83   5.001  -2.584   0.739
    6   HG21  THR  83          HG22      THR  83   5.213  -1.248  -0.387
    7   HG23  THR  83          HG23      THR  83   4.603  -0.942   1.240

  No H/Q in entry =           7
  In of MODEL   76
    1    H    SER  84           H        SER  84   9.615  -1.560   0.634
    2    HA   SER  84           HA       SER  84  10.721  -0.151   2.813
    3    HB2  SER  84           HB2      SER  84  11.929  -1.983   0.752
    4    HB3  SER  84           HB3      SER  84  12.902  -1.244   2.022
    5    HG   SER  84           HG       SER  84  10.625  -2.926   2.310

  No H/Q in entry =           5
  In of MODEL   76
    1    H    MET  85           H        MET  85  11.412   0.133  -0.686
    2    HA   MET  85           HA       MET  85  13.423   2.088  -0.456
    3    HB2  MET  85           HB2      MET  85  12.978   0.821  -2.524
    4    HB3  MET  85           HB3      MET  85  11.457   1.690  -2.720
    5    HG2  MET  85           HG2      MET  85  12.670   3.823  -2.857
    6    HG3  MET  85           HG3      MET  85  14.197   2.983  -2.607
    7    HE3  MET  85           HE1      MET  85  11.114   1.744  -5.259
    8    HE2  MET  85           HE2      MET  85  11.447   3.229  -6.147
    9    HE1  MET  85           HE3      MET  85  11.072   3.308  -4.430

  No H/Q in entry =           9
  In of MODEL   76
    1    H    LEU  86           H        LEU  86   9.926   2.442  -0.899
    2    HA   LEU  86           HA       LEU  86   9.873   5.257  -1.059
    3    HB2  LEU  86           HB2      LEU  86   8.010   3.610  -1.614
    4    HB3  LEU  86           HB3      LEU  86   7.711   3.509   0.122
    5    HG   LEU  86           HG       LEU  86   7.562   6.071   0.091
    6   HD11  LEU  86          HD11      LEU  86   8.287   5.652  -2.628
    7   HD13  LEU  86          HD12      LEU  86   7.872   7.175  -1.848
    8   HD12  LEU  86          HD13      LEU  86   6.617   6.225  -2.637
    9   HD23  LEU  86          HD21      LEU  86   5.392   4.741  -1.543
   10   HD22  LEU  86          HD22      LEU  86   5.230   5.992  -0.314
   11   HD21  LEU  86          HD23      LEU  86   5.630   4.342   0.160

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ALA  87           H        ALA  87   9.446   3.060   1.679
    2    HA   ALA  87           HA       ALA  87   8.943   4.961   3.672
    3    HB1  ALA  87           HB1      ALA  87   9.734   2.138   3.550
    4    HB3  ALA  87           HB2      ALA  87   8.633   2.947   4.662
    5    HB2  ALA  87           HB3      ALA  87  10.367   2.967   4.975

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ARG  88           H        ARG  88  12.000   3.529   2.625
    2    HA   ARG  88           HA       ARG  88  13.650   4.885   4.438
    3    HB2  ARG  88           HB2      ARG  88  14.282   2.919   3.008
    4    HB3  ARG  88           HB3      ARG  88  14.416   4.022   1.641
    5    HG2  ARG  88           HG2      ARG  88  15.931   5.313   3.570
    6    HG3  ARG  88           HG3      ARG  88  16.250   3.619   3.930
    7    HD2  ARG  88           HD2      ARG  88  17.481   3.331   2.058
    8    HD3  ARG  88           HD3      ARG  88  16.330   4.216   1.052
    9    HE   ARG  88           HE       ARG  88  18.749   5.259   2.064
   10   HH21  ARG  88          HH11      ARG  88  19.102   7.478   1.880
   11   HH22  ARG  88          HH12      ARG  88  17.754   8.557   1.769
   12   HH11  ARG  88          HH21      ARG  88  15.409   6.031   1.853
   13   HH12  ARG  88          HH22      ARG  88  15.661   7.736   1.729

  No H/Q in entry =          13
  In of MODEL   76
    1    H    GLU  89           H        GLU  89  12.621   5.813   1.140
    2    HA   GLU  89           HA       GLU  89  14.176   8.167   0.973
    3    HB2  GLU  89           HB2      GLU  89  12.991   7.146  -0.961
    4    HB3  GLU  89           HB3      GLU  89  11.462   7.690  -0.271
    5    HG2  GLU  89           HG2      GLU  89  12.172  10.025  -0.429
    6    HG3  GLU  89           HG3      GLU  89  13.764   9.531  -0.999

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LEU  90           H        LEU  90  10.866   7.665   2.160
    2    HA   LEU  90           HA       LEU  90  10.375  10.396   2.765
    3    HB2  LEU  90           HB2      LEU  90   9.187   7.821   3.795
    4    HB3  LEU  90           HB3      LEU  90   8.572   9.416   4.241
    5    HG   LEU  90           HG       LEU  90   8.933   8.556   1.359
    6   HD12  LEU  90          HD11      LEU  90   6.399   8.240   1.465
    7   HD11  LEU  90          HD12      LEU  90   6.586   8.215   3.219
    8   HD13  LEU  90          HD13      LEU  90   7.380   6.989   2.230
    9   HD22  LEU  90          HD21      LEU  90   8.649  10.866   1.308
   10   HD21  LEU  90          HD22      LEU  90   7.690  10.892   2.786
   11   HD23  LEU  90          HD23      LEU  90   6.962  10.352   1.274

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  91           H        ILE  91  11.660   7.694   4.643
    2    HA   ILE  91           HA       ILE  91  11.853   9.039   7.119
    3    HB   ILE  91           HB       ILE  91  13.374   6.702   5.949
    4   HG12  ILE  91          HG12      ILE  91  11.401   6.862   8.247
    5   HG13  ILE  91          HG13      ILE  91  10.898   6.596   6.578
    6   HG22  ILE  91          HG21      ILE  91  13.891   6.466   8.579
    7   HG21  ILE  91          HG22      ILE  91  13.823   8.225   8.493
    8   HG23  ILE  91          HG23      ILE  91  14.979   7.339   7.500
    9   HD13  ILE  91          HD11      ILE  91  11.888   4.490   6.473
   10   HD12  ILE  91          HD12      ILE  91  11.326   4.538   8.144
   11   HD11  ILE  91          HD13      ILE  91  13.023   4.846   7.777

  No H/Q in entry =          11
  In of MODEL   76
    1    H    THR  92           H        THR  92  14.018   8.881   4.325
    2    HA   THR  92           HA       THR  92  16.211  10.254   5.455
    3    HB   THR  92           HB       THR  92  15.171  10.156   2.612
    4    HG1  THR  92           HG1      THR  92  16.001   8.252   2.987
    5   HG22  THR  92          HG21      THR  92  17.739  10.836   2.276
    6   HG21  THR  92          HG22      THR  92  17.463  11.647   3.817
    7   HG23  THR  92          HG23      THR  92  16.469  12.050   2.418

  No H/Q in entry =           7
  In of MODEL   76
    1    H    GLU  93           H        GLU  93  13.298  11.435   3.789
    2    HA   GLU  93           HA       GLU  93  13.909  14.192   3.913
    3    HB2  GLU  93           HB2      GLU  93  11.198  12.832   3.967
    4    HB3  GLU  93           HB3      GLU  93  11.488  14.533   3.603
    5    HG2  GLU  93           HG2      GLU  93  12.786  12.296   2.033
    6    HG3  GLU  93           HG3      GLU  93  11.234  12.990   1.580

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LEU  94           H        LEU  94  12.197  12.027   6.140
    2    HA   LEU  94           HA       LEU  94  11.432  13.963   8.045
    3    HB2  LEU  94           HB2      LEU  94  11.998  11.003   8.286
    4    HB3  LEU  94           HB3      LEU  94  11.457  11.971   9.654
    5    HG   LEU  94           HG       LEU  94   9.924  12.050   7.054
    6   HD11  LEU  94          HD11      LEU  94  10.033   9.813   9.040
    7   HD13  LEU  94          HD12      LEU  94   9.699   9.767   7.310
    8   HD12  LEU  94          HD13      LEU  94   8.444  10.281   8.436
    9   HD23  LEU  94          HD21      LEU  94   8.037  12.447   8.693
   10   HD22  LEU  94          HD22      LEU  94   9.283  13.695   8.716
   11   HD21  LEU  94          HD23      LEU  94   9.237  12.468   9.982

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  95           H        ILE  95  14.391  12.021   7.738
    2    HA   ILE  95           HA       ILE  95  15.608  12.919  10.137
    3    HB   ILE  95           HB       ILE  95  16.794  11.863   7.558
    4   HG12  ILE  95          HG12      ILE  95  16.544  10.643  10.321
    5   HG13  ILE  95          HG13      ILE  95  15.352  10.400   9.046
    6   HG21  ILE  95          HG21      ILE  95  18.103  12.644  10.182
    7   HG23  ILE  95          HG22      ILE  95  18.537  13.182   8.558
    8   HG22  ILE  95          HG23      ILE  95  18.845  11.516   9.048
    9   HD13  ILE  95          HD11      ILE  95  16.802   9.124   7.746
   10   HD12  ILE  95          HD12      ILE  95  17.303   8.660   9.369
   11   HD11  ILE  95          HD13      ILE  95  18.245   9.842   8.461

  No H/Q in entry =          11
  In of MODEL   76
    1    H    GLU  96           H        GLU  96  15.707  14.177   6.810
    2    HA   GLU  96           HA       GLU  96  17.572  16.243   7.267
    3    HB2  GLU  96           HB2      GLU  96  16.862  15.601   5.016
    4    HB3  GLU  96           HB3      GLU  96  15.228  16.164   5.352
    5    HG2  GLU  96           HG2      GLU  96  15.794  18.294   4.815
    6    HG3  GLU  96           HG3      GLU  96  17.115  18.279   5.973

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LEU  97           H        LEU  97  14.069  16.070   7.762
    2    HA   LEU  97           HA       LEU  97  13.679  18.800   8.432
    3    HB2  LEU  97           HB2      LEU  97  12.159  16.277   9.055
    4    HB3  LEU  97           HB3      LEU  97  11.667  17.822   9.748
    5    HG   LEU  97           HG       LEU  97  12.092  17.426   6.771
    6   HD12  LEU  97          HD11      LEU  97   9.566  17.312   6.700
    7   HD11  LEU  97          HD12      LEU  97   9.591  17.098   8.449
    8   HD13  LEU  97          HD13      LEU  97  10.347  15.895   7.403
    9   HD23  LEU  97          HD21      LEU  97  10.365  19.399   6.852
   10   HD22  LEU  97          HD22      LEU  97  12.055  19.747   7.215
   11   HD21  LEU  97          HD23      LEU  97  10.890  19.572   8.526

  No H/Q in entry =          11
  In of MODEL   76
    1    H    HIS  98           H        HIS  98  14.523  15.955  10.390
    2    HA   HIS  98           HA       HIS  98  14.420  17.197  12.918
    3    HB2  HIS  98           HB2      HIS  98  16.138  14.939  11.866
    4    HB3  HIS  98           HB3      HIS  98  16.172  15.464  13.551
    5    HD1  HIS  98           HD1      HIS  98  13.915  13.866  10.989
    6    HD2  HIS  98           HD2      HIS  98  13.890  14.754  15.062
    7    HE1  HIS  98           HE1      HIS  98  11.903  12.674  11.970
    8    HE2  HIS  98           HE2      HIS  98  11.867  13.207  14.447

  No H/Q in entry =           8
  In of MODEL   76
    1    H    GLU  99           H        GLU  99  16.926  17.088  10.435
    2    HA   GLU  99           HA       GLU  99  18.947  18.397  11.936
    3    HB2  GLU  99           HB2      GLU  99  19.380  17.123   9.848
    4    HB3  GLU  99           HB3      GLU  99  18.559  18.390   8.932
    5    HG2  GLU  99           HG2      GLU  99  20.191  20.046   9.705
    6    HG3  GLU  99           HG3      GLU  99  20.983  18.832  10.704

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LYS 100           H        LYS 100  16.388  19.590   9.777
    2    HA   LYS 100           HA       LYS 100  17.202  22.322   9.927
    3    HB2  LYS 100           HB2      LYS 100  14.549  21.053   9.212
    4    HB3  LYS 100           HB3      LYS 100  14.856  22.790   9.130
    5    HG2  LYS 100           HG2      LYS 100  16.798  22.343   7.622
    6    HG3  LYS 100           HG3      LYS 100  16.375  20.628   7.635
    7    HD2  LYS 100           HD2      LYS 100  14.164  21.157   6.680
    8    HD3  LYS 100           HD3      LYS 100  14.570  22.874   6.675
    9    HE2  LYS 100           HE2      LYS 100  16.498  22.394   5.175
   10    HE3  LYS 100           HE3      LYS 100  16.023  20.692   5.138
   11    HZ1  LYS 100           HZ1      LYS 100  14.195  22.901   4.354
   12    HZ3  LYS 100           HZ2      LYS 100  13.996  21.235   4.083
   13    HZ2  LYS 100           HZ3      LYS 100  15.196  22.097   3.245

  No H/Q in entry =          13
  In of MODEL   76
    1    H    LEU 101           H        LEU 101  15.132  20.272  11.916
    2    HA   LEU 101           HA       LEU 101  14.007  22.334  13.532
    3    HB2  LEU 101           HB2      LEU 101  14.440  19.379  13.884
    4    HB3  LEU 101           HB3      LEU 101  13.935  20.351  15.263
    5    HG   LEU 101           HG       LEU 101  12.467  20.469  12.622
    6   HD12  LEU 101          HD11      LEU 101  10.824  18.904  13.910
    7   HD11  LEU 101          HD12      LEU 101  12.234  18.475  14.875
    8   HD13  LEU 101          HD13      LEU 101  12.233  18.182  13.135
    9   HD21  LEU 101          HD21      LEU 101  11.869  21.243  15.492
   10   HD23  LEU 101          HD22      LEU 101  10.584  21.034  14.305
   11   HD22  LEU 101          HD23      LEU 101  11.821  22.264  14.053

  No H/Q in entry =          11
  In of MODEL   76
    1    H    LYS 102           H        LYS 102  17.142  21.712  13.031
    2    HA   LYS 102           HA       LYS 102  19.014  22.564  14.074
    3    HB2  LYS 102           HB2      LYS 102  17.231  24.080  15.254
    4    HB3  LYS 102           HB3      LYS 102  17.458  23.005  16.618
    5    HG2  LYS 102           HG2      LYS 102  19.340  25.015  15.429
    6    HG3  LYS 102           HG3      LYS 102  18.988  24.689  17.112
    7    HD2  LYS 102           HD2      LYS 102  20.611  22.781  15.380
    8    HD3  LYS 102           HD3      LYS 102  21.326  24.091  16.310
    9    HE2  LYS 102           HE2      LYS 102  20.931  21.537  17.266
   10    HE3  LYS 102           HE3      LYS 102  21.177  22.970  18.264
   11    HZ2  LYS 102           HZ1      LYS 102  19.213  21.693  18.910
   12    HZ1  LYS 102           HZ2      LYS 102  18.541  21.939  17.375
   13    HZ3  LYS 102           HZ3      LYS 102  18.799  23.259  18.407

  No H/Q in entry =          13
  In of MODEL   76
    1    H    ALA 103           H        ALA 103  16.979  20.951  16.523
    2    HA   ALA 103           HA       ALA 103  18.730  19.717  18.135
    3    HB2  ALA 103           HB1      ALA 103  17.134  17.719  18.144
    4    HB1  ALA 103           HB2      ALA 103  16.220  18.588  16.910
    5    HB3  ALA 103           HB3      ALA 103  16.433  19.295  18.511

  No H/Q in entry =           5
  In of MODEL   76
    1    H1   ALA   1           H3       ALA   1  -2.112  -6.704 -21.306
    2    H2   ALA   1           H2       ALA   1  -2.906  -8.138 -20.850
    3    H3   ALA   1           H1       ALA   1  -1.310  -8.193 -21.435
    4    HA   ALA   1           HA       ALA   1  -2.184  -8.641 -23.419
    5    HB1  ALA   1           HB1      ALA   1  -4.316  -9.350 -22.911
    6    HB2  ALA   1           HB2      ALA   1  -4.761  -7.830 -23.688
    7    HB3  ALA   1           HB3      ALA   1  -4.667  -7.925 -21.931

  No H/Q in entry =           7
  In of MODEL   76
    1    H    GLU   2           H        GLU   2  -3.044  -7.430 -25.383
    2    HA   GLU   2           HA       GLU   2  -1.649  -5.418 -26.271
    3    HB2  GLU   2           HB2      GLU   2  -4.662  -5.463 -26.532
    4    HB3  GLU   2           HB3      GLU   2  -3.556  -4.599 -27.596
    5    HG2  GLU   2           HG2      GLU   2  -3.087  -6.482 -28.775
    6    HG3  GLU   2           HG3      GLU   2  -2.768  -7.402 -27.310

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLU   3           H        GLU   3  -4.784  -4.148 -25.301
    2    HA   GLU   3           HA       GLU   3  -3.709  -1.604 -24.672
    3    HB2  GLU   3           HB2      GLU   3  -6.399  -2.904 -24.300
    4    HB3  GLU   3           HB3      GLU   3  -6.078  -1.296 -23.646
    5    HG2  GLU   3           HG2      GLU   3  -5.756  -0.354 -25.771
    6    HG3  GLU   3           HG3      GLU   3  -5.385  -1.906 -26.516

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LEU   4           H        LEU   4  -5.273  -3.970 -22.482
    2    HA   LEU   4           HA       LEU   4  -4.856  -2.764 -20.088
    3    HB2  LEU   4           HB2      LEU   4  -4.341  -5.705 -20.591
    4    HB3  LEU   4           HB3      LEU   4  -4.713  -4.968 -19.034
    5    HG   LEU   4           HG       LEU   4  -6.532  -5.011 -21.465
    6   HD13  LEU   4          HD11      LEU   4  -7.717  -6.729 -20.459
    7   HD12  LEU   4          HD12      LEU   4  -7.199  -6.286 -18.833
    8   HD11  LEU   4          HD13      LEU   4  -6.089  -7.127 -19.913
    9   HD23  LEU   4          HD21      LEU   4  -8.176  -4.204 -19.559
   10   HD22  LEU   4          HD22      LEU   4  -7.145  -3.033 -20.380
   11   HD21  LEU   4          HD23      LEU   4  -6.693  -3.639 -18.787

  No H/Q in entry =          11
  In of MODEL   76
    1    H    GLU   5           H        GLU   5  -2.403  -4.609 -21.881
    2    HA   GLU   5           HA       GLU   5  -0.380  -4.354 -19.880
    3    HB2  GLU   5           HB2      GLU   5  -0.357  -6.111 -21.644
    4    HB3  GLU   5           HB3      GLU   5  -0.064  -4.860 -22.852
    5    HG2  GLU   5           HG2      GLU   5   2.029  -4.240 -21.740
    6    HG3  GLU   5           HG3      GLU   5   1.735  -5.435 -20.477

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLU   6           H        GLU   6  -1.061  -2.612 -22.898
    2    HA   GLU   6           HA       GLU   6   1.126  -0.796 -22.656
    3    HB2  GLU   6           HB2      GLU   6  -0.097  -1.284 -24.790
    4    HB3  GLU   6           HB3      GLU   6  -1.477  -0.393 -24.147
    5    HG2  GLU   6           HG2      GLU   6  -0.308   1.215 -25.422
    6    HG3  GLU   6           HG3      GLU   6   0.196   1.539 -23.764

  No H/Q in entry =           6
  In of MODEL   76
    1    H    VAL   7           H        VAL   7  -2.193  -0.855 -21.549
    2    HA   VAL   7           HA       VAL   7  -2.381   1.852 -20.687
    3    HB   VAL   7           HB       VAL   7  -3.843  -0.663 -19.843
    4   HG11  VAL   7          HG11      VAL   7  -4.184   2.222 -18.999
    5   HG13  VAL   7          HG12      VAL   7  -4.074   0.788 -17.978
    6   HG12  VAL   7          HG13      VAL   7  -5.523   1.075 -18.940
    7   HG21  VAL   7          HG21      VAL   7  -4.038   0.434 -22.219
    8   HG23  VAL   7          HG22      VAL   7  -4.960   1.682 -21.380
    9   HG22  VAL   7          HG23      VAL   7  -5.516   0.008 -21.356

  No H/Q in entry =           9
  In of MODEL   76
    1    H    VAL   8           H        VAL   8  -1.382  -1.153 -19.087
    2    HA   VAL   8           HA       VAL   8  -1.008  -0.096 -16.489
    3    HB   VAL   8           HB       VAL   8   0.237  -2.442 -17.931
    4   HG11  VAL   8          HG11      VAL   8   0.719  -1.385 -15.140
    5   HG13  VAL   8          HG12      VAL   8   1.912  -1.829 -16.361
    6   HG12  VAL   8          HG13      VAL   8   0.975  -3.082 -15.548
    7   HG21  VAL   8          HG21      VAL   8  -2.212  -1.974 -16.415
    8   HG23  VAL   8          HG22      VAL   8  -1.227  -3.198 -15.622
    9   HG22  VAL   8          HG23      VAL   8  -1.725  -3.422 -17.295

  No H/Q in entry =           9
  In of MODEL   76
    1    H    MET   9           H        MET   9   1.187  -0.389 -19.281
    2    HA   MET   9           HA       MET   9   3.503   0.628 -18.055
    3    HB2  MET   9           HB2      MET   9   2.495   0.631 -20.892
    4    HB3  MET   9           HB3      MET   9   3.989   1.465 -20.467
    5    HG2  MET   9           HG2      MET   9   4.683  -0.739 -19.322
    6    HG3  MET   9           HG3      MET   9   3.355  -1.475 -20.223
    7    HE3  MET   9           HE1      MET   9   4.237  -1.506 -23.780
    8    HE2  MET   9           HE2      MET   9   3.254  -0.209 -23.105
    9    HE1  MET   9           HE3      MET   9   3.120  -1.840 -22.451

  No H/Q in entry =           9
  In of MODEL   76
    1    H    GLY  10           H        GLY  10   0.799   2.262 -19.668
    2    HA3  GLY  10           HA2      GLY  10   1.786   4.907 -19.420
    3    HA2  GLY  10           HA3      GLY  10   0.090   4.461 -19.596

  No H/Q in entry =           3
  In of MODEL   76
    1    H    LEU  11           H        LEU  11  -0.277   2.917 -17.316
    2    HA   LEU  11           HA       LEU  11  -0.754   4.882 -15.330
    3    HB2  LEU  11           HB2      LEU  11  -0.707   1.865 -15.200
    4    HB3  LEU  11           HB3      LEU  11  -1.182   2.880 -13.839
    5    HG   LEU  11           HG       LEU  11  -2.473   3.026 -16.577
    6   HD13  LEU  11          HD11      LEU  11  -3.058   0.881 -15.829
    7   HD12  LEU  11          HD12      LEU  11  -4.391   1.878 -15.249
    8   HD11  LEU  11          HD13      LEU  11  -3.117   1.379 -14.137
    9   HD22  LEU  11          HD21      LEU  11  -3.029   5.038 -15.543
   10   HD21  LEU  11          HD22      LEU  11  -2.928   4.357 -13.919
   11   HD23  LEU  11          HD23      LEU  11  -4.325   4.010 -14.938

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  12           H        ILE  12   1.764   2.399 -15.642
    2    HA   ILE  12           HA       ILE  12   3.022   2.906 -13.158
    3    HB   ILE  12           HB       ILE  12   4.220   1.879 -15.753
    4   HG12  ILE  12          HG12      ILE  12   2.218   0.654 -14.584
    5   HG13  ILE  12          HG13      ILE  12   3.600  -0.289 -15.103
    6   HG23  ILE  12          HG21      ILE  12   6.017   2.568 -14.301
    7   HG22  ILE  12          HG22      ILE  12   5.902   0.813 -14.179
    8   HG21  ILE  12          HG23      ILE  12   5.244   1.831 -12.899
    9   HD12  ILE  12          HD11      ILE  12   2.775  -0.842 -12.802
   10   HD11  ILE  12          HD12      ILE  12   3.204   0.794 -12.304
   11   HD13  ILE  12          HD13      ILE  12   4.449  -0.316 -12.832

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  13           H        ILE  13   3.570   4.192 -16.415
    2    HA   ILE  13           HA       ILE  13   5.734   5.889 -15.718
    3    HB   ILE  13           HB       ILE  13   3.661   6.008 -17.922
    4   HG12  ILE  13          HG12      ILE  13   5.424   4.126 -17.742
    5   HG13  ILE  13          HG13      ILE  13   5.264   4.958 -19.285
    6   HG22  ILE  13          HG21      ILE  13   5.256   7.616 -19.041
    7   HG21  ILE  13          HG22      ILE  13   6.107   7.761 -17.507
    8   HG23  ILE  13          HG23      ILE  13   4.429   8.283 -17.633
    9   HD11  ILE  13          HD11      ILE  13   7.211   6.191 -17.416
   10   HD13  ILE  13          HD12      ILE  13   7.340   5.879 -19.143
   11   HD12  ILE  13          HD13      ILE  13   7.640   4.582 -17.993

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ASN  14           H        ASN  14   2.227   6.413 -15.913
    2    HA   ASN  14           HA       ASN  14   2.219   9.154 -15.253
    3    HB2  ASN  14           HB2      ASN  14   0.297   7.534 -16.060
    4    HB3  ASN  14           HB3      ASN  14   0.008   7.343 -14.335
    5   HD21  ASN  14          HD21      ASN  14  -2.030   8.527 -15.718
    6   HD22  ASN  14          HD22      ASN  14  -2.075  10.198 -15.436

  No H/Q in entry =           6
  In of MODEL   76
    1    H    SER  15           H        SER  15   1.942   6.262 -13.195
    2    HA   SER  15           HA       SER  15   1.694   7.614 -10.730
    3    HB2  SER  15           HB2      SER  15   2.237   5.517  -9.709
    4    HB3  SER  15           HB3      SER  15   1.391   5.112 -11.198
    5    HG   SER  15           HG       SER  15   3.143   4.224 -11.922

  No H/Q in entry =           5
  In of MODEL   76
    1    H    GLY  16           H        GLY  16   4.526   6.511 -12.554
    2    HA3  GLY  16           HA2      GLY  16   6.494   7.237 -10.655
    3    HA2  GLY  16           HA3      GLY  16   6.762   7.047 -12.386

  No H/Q in entry =           3
  In of MODEL   76
    1    H    GLN  17           H        GLN  17   5.066   9.026 -13.400
    2    HA   GLN  17           HA       GLN  17   6.666  11.353 -13.104
    3    HB2  GLN  17           HB2      GLN  17   5.318  10.919 -15.126
    4    HB3  GLN  17           HB3      GLN  17   3.840  11.100 -14.179
    5    HG2  GLN  17           HG2      GLN  17   4.417  13.419 -13.659
    6    HG3  GLN  17           HG3      GLN  17   5.944  13.254 -14.524
    7   HE21  GLN  17          HE21      GLN  17   4.116  15.235 -15.360
    8   HE22  GLN  17          HE22      GLN  17   3.456  14.787 -16.858

  No H/Q in entry =           8
  In of MODEL   76
    1    H    ALA  18           H        ALA  18   3.586  10.345 -11.702
    2    HA   ALA  18           HA       ALA  18   2.902  12.728 -10.403
    3    HB1  ALA  18           HB1      ALA  18   1.752  10.281 -10.623
    4    HB2  ALA  18           HB2      ALA  18   1.234  11.495  -9.455
    5    HB3  ALA  18           HB3      ALA  18   2.326  10.201  -8.957

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ARG  19           H        ARG  19   4.782   9.943  -9.183
    2    HA   ARG  19           HA       ARG  19   5.371  11.076  -6.663
    3    HB2  ARG  19           HB2      ARG  19   5.760   8.675  -7.217
    4    HB3  ARG  19           HB3      ARG  19   7.098   9.161  -8.261
    5    HG2  ARG  19           HG2      ARG  19   8.262  10.178  -6.352
    6    HG3  ARG  19           HG3      ARG  19   6.904   9.790  -5.297
    7    HD2  ARG  19           HD2      ARG  19   8.663   8.141  -4.988
    8    HD3  ARG  19           HD3      ARG  19   7.268   7.374  -5.753
    9    HE   ARG  19           HE       ARG  19   8.938   8.199  -7.826
   10   HH21  ARG  19          HH11      ARG  19  10.472   6.792  -8.718
   11   HH22  ARG  19          HH12      ARG  19  11.028   5.433  -7.805
   12   HH11  ARG  19          HH21      ARG  19   9.051   6.145  -5.066
   13   HH12  ARG  19          HH22      ARG  19  10.220   5.066  -5.736

  No H/Q in entry =          13
  In of MODEL   76
    1    H    SER  20           H        SER  20   7.129  11.120  -9.746
    2    HA   SER  20           HA       SER  20   9.398  12.516  -8.955
    3    HB2  SER  20           HB2      SER  20   8.820  11.509 -11.264
    4    HB3  SER  20           HB3      SER  20   8.044  13.055 -11.587
    5    HG   SER  20           HG       SER  20  10.074  14.032 -10.997

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LEU  21           H        LEU  21   6.284  13.812 -10.081
    2    HA   LEU  21           HA       LEU  21   6.974  16.552  -9.847
    3    HB2  LEU  21           HB2      LEU  21   4.302  15.139  -9.732
    4    HB3  LEU  21           HB3      LEU  21   4.474  16.893  -9.715
    5    HG   LEU  21           HG       LEU  21   5.634  15.130 -11.892
    6   HD12  LEU  21          HD11      LEU  21   3.041  16.708 -11.915
    7   HD11  LEU  21          HD12      LEU  21   3.155  14.951 -11.794
    8   HD13  LEU  21          HD13      LEU  21   3.705  15.771 -13.255
    9   HD22  LEU  21          HD21      LEU  21   6.754  17.167 -12.094
   10   HD21  LEU  21          HD22      LEU  21   5.419  18.101 -11.427
   11   HD23  LEU  21          HD23      LEU  21   5.333  17.509 -13.077

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ALA  22           H        ALA  22   5.494  14.252  -7.589
    2    HA   ALA  22           HA       ALA  22   4.941  16.046  -5.496
    3    HB3  ALA  22           HB1      ALA  22   4.164  13.659  -5.663
    4    HB2  ALA  22           HB2      ALA  22   4.786  14.115  -4.077
    5    HB1  ALA  22           HB3      ALA  22   5.783  13.160  -5.175

  No H/Q in entry =           5
  In of MODEL   76
    1    H    TYR  23           H        TYR  23   7.855  14.010  -6.008
    2    HA   TYR  23           HA       TYR  23   9.287  15.004  -3.775
    3    HB2  TYR  23           HB2      TYR  23  10.041  13.002  -4.965
    4    HB3  TYR  23           HB3      TYR  23  10.331  13.951  -6.422
    5    HD1  TYR  23           HD1      TYR  23  11.371  13.555  -2.860
    6    HD2  TYR  23           HD2      TYR  23  12.358  15.138  -6.731
    7    HE1  TYR  23           HE1      TYR  23  13.648  14.115  -2.051
    8    HE2  TYR  23           HE2      TYR  23  14.634  15.699  -5.920
    9    HH   TYR  23           HH       TYR  23  15.605  15.019  -2.554

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ALA  24           H        ALA  24   9.043  16.139  -7.128
    2    HA   ALA  24           HA       ALA  24  10.953  18.214  -6.902
    3    HB2  ALA  24           HB1      ALA  24  10.467  18.296  -9.101
    4    HB3  ALA  24           HB2      ALA  24   8.923  19.049  -8.705
    5    HB1  ALA  24           HB3      ALA  24   9.038  17.297  -8.852

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ALA  25           H        ALA  25   7.486  18.038  -6.214
    2    HA   ALA  25           HA       ALA  25   7.028  20.754  -5.614
    3    HB1  ALA  25           HB1      ALA  25   5.355  18.763  -5.798
    4    HB2  ALA  25           HB2      ALA  25   5.015  20.044  -4.633
    5    HB3  ALA  25           HB3      ALA  25   5.710  18.516  -4.088

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LEU  26           H        LEU  26   8.126  18.053  -3.607
    2    HA   LEU  26           HA       LEU  26   8.284  19.464  -1.161
    3    HB2  LEU  26           HB2      LEU  26   8.371  17.048  -1.177
    4    HB3  LEU  26           HB3      LEU  26   9.822  17.058  -2.176
    5    HG   LEU  26           HG       LEU  26  11.076  18.157  -0.351
    6   HD12  LEU  26          HD11      LEU  26   9.895  18.151   1.932
    7   HD11  LEU  26          HD12      LEU  26   8.389  18.025   1.026
    8   HD13  LEU  26          HD13      LEU  26   9.434  19.429   0.808
    9   HD21  LEU  26          HD21      LEU  26   9.552  15.687   0.532
   10   HD23  LEU  26          HD22      LEU  26  11.082  16.239   1.204
   11   HD22  LEU  26          HD23      LEU  26  11.002  15.694  -0.469

  No H/Q in entry =          11
  In of MODEL   76
    1    H    LYS  27           H        LYS  27  10.649  18.904  -3.737
    2    HA   LYS  27           HA       LYS  27  12.861  20.129  -2.542
    3    HB2  LYS  27           HB2      LYS  27  12.917  18.798  -4.645
    4    HB3  LYS  27           HB3      LYS  27  12.139  20.139  -5.484
    5    HG2  LYS  27           HG2      LYS  27  14.020  21.615  -4.931
    6    HG3  LYS  27           HG3      LYS  27  14.795  20.313  -4.020
    7    HD2  LYS  27           HD2      LYS  27  14.893  18.942  -6.088
    8    HD3  LYS  27           HD3      LYS  27  14.164  20.269  -6.991
    9    HE2  LYS  27           HE2      LYS  27  16.067  21.725  -6.404
   10    HE3  LYS  27           HE3      LYS  27  16.801  20.401  -5.492
   11    HZ3  LYS  27           HZ1      LYS  27  17.748  20.516  -7.696
   12    HZ2  LYS  27           HZ2      LYS  27  16.207  20.408  -8.408
   13    HZ1  LYS  27           HZ3      LYS  27  16.843  19.088  -7.546

  No H/Q in entry =          13
  In of MODEL   76
    1    H    GLN  28           H        GLN  28  10.204  21.533  -4.428
    2    HA   GLN  28           HA       GLN  28  11.168  24.184  -4.579
    3    HB2  GLN  28           HB2      GLN  28   8.337  23.116  -4.423
    4    HB3  GLN  28           HB3      GLN  28   8.741  24.794  -4.785
    5    HG2  GLN  28           HG2      GLN  28   9.731  22.411  -6.377
    6    HG3  GLN  28           HG3      GLN  28   8.360  23.417  -6.839
    7   HE21  GLN  28          HE21      GLN  28   9.473  25.973  -6.041
    8   HE22  GLN  28          HE22      GLN  28  10.766  26.317  -7.085

  No H/Q in entry =           8
  In of MODEL   76
    1    H    ALA  29           H        ALA  29   9.280  22.477  -2.119
    2    HA   ALA  29           HA       ALA  29   8.769  24.657  -0.409
    3    HB2  ALA  29           HB1      ALA  29   8.067  23.078   1.161
    4    HB1  ALA  29           HB2      ALA  29   9.276  21.895   0.662
    5    HB3  ALA  29           HB3      ALA  29   7.871  22.200  -0.356

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LYS  30           H        LYS  30  11.492  22.384  -0.550
    2    HA   LYS  30           HA       LYS  30  12.857  23.317   1.734
    3    HB2  LYS  30           HB2      LYS  30  13.901  22.049  -0.808
    4    HB3  LYS  30           HB3      LYS  30  14.912  22.394   0.597
    5    HG2  LYS  30           HG2      LYS  30  13.383  21.004   1.996
    6    HG3  LYS  30           HG3      LYS  30  12.468  20.596   0.540
    7    HD2  LYS  30           HD2      LYS  30  14.491  19.613  -0.469
    8    HD3  LYS  30           HD3      LYS  30  15.425  20.035   0.968
    9    HE2  LYS  30           HE2      LYS  30  13.944  18.596   2.341
   10    HE3  LYS  30           HE3      LYS  30  13.040  18.154   0.887
   11    HZ2  LYS  30           HZ1      LYS  30  14.843  16.566   1.600
   12    HZ1  LYS  30           HZ2      LYS  30  15.973  17.754   1.135
   13    HZ3  LYS  30           HZ3      LYS  30  14.913  17.082  -0.014

  No H/Q in entry =          13
  In of MODEL   76
    1    H    GLN  31           H        GLN  31  12.686  24.548  -1.551
    2    HA   GLN  31           HA       GLN  31  14.851  26.433  -1.157
    3    HB2  GLN  31           HB2      GLN  31  12.765  26.502  -3.340
    4    HB3  GLN  31           HB3      GLN  31  14.386  27.194  -3.367
    5    HG2  GLN  31           HG2      GLN  31  14.853  24.493  -2.823
    6    HG3  GLN  31           HG3      GLN  31  13.526  24.451  -3.976
    7   HE21  GLN  31          HE21      GLN  31  16.359  23.655  -4.442
    8   HE22  GLN  31          HE22      GLN  31  16.908  24.637  -5.712

  No H/Q in entry =           8
  In of MODEL   76
    1    H    GLY  32           H        GLY  32  11.800  26.248   0.048
    2    HA3  GLY  32           HA2      GLY  32  10.672  27.809   1.356
    3    HA2  GLY  32           HA3      GLY  32  11.789  29.046   0.794

  No H/Q in entry =           3
  In of MODEL   76
    1    H    ASP  33           H        ASP  33  10.372  27.165  -1.686
    2    HA   ASP  33           HA       ASP  33   8.696  29.448  -2.490
    3    HB2  ASP  33           HB2      ASP  33   9.755  27.038  -3.973
    4    HB3  ASP  33           HB3      ASP  33   8.592  28.162  -4.672

  No H/Q in entry =           4
  In of MODEL   76
    1    H    PHE  34           H        PHE  34   7.038  28.963  -0.897
    2    HA   PHE  34           HA       PHE  34   5.655  26.493  -0.794
    3    HB2  PHE  34           HB2      PHE  34   4.714  29.277  -0.073
    4    HB3  PHE  34           HB3      PHE  34   3.870  27.785   0.343
    5    HD1  PHE  34           HD1      PHE  34   6.148  30.169   1.531
    6    HD2  PHE  34           HD2      PHE  34   5.458  25.930   1.458
    7    HE1  PHE  34           HE1      PHE  34   7.579  29.899   3.538
    8    HE2  PHE  34           HE2      PHE  34   6.890  25.664   3.462
    9    HZ   PHE  34           HZ       PHE  34   7.945  27.650   4.502

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ALA  35           H        ALA  35   5.191  29.374  -2.773
    2    HA   ALA  35           HA       ALA  35   2.618  28.773  -3.752
    3    HB1  ALA  35           HB1      ALA  35   3.633  30.179  -5.799
    4    HB3  ALA  35           HB2      ALA  35   4.875  30.529  -4.597
    5    HB2  ALA  35           HB3      ALA  35   3.192  30.939  -4.270

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ALA  36           H        ALA  36   5.818  28.104  -5.176
    2    HA   ALA  36           HA       ALA  36   4.782  26.695  -7.411
    3    HB3  ALA  36           HB1      ALA  36   6.928  26.820  -8.068
    4    HB2  ALA  36           HB2      ALA  36   7.434  25.780  -6.736
    5    HB1  ALA  36           HB3      ALA  36   7.337  27.526  -6.504

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ALA  37           H        ALA  37   5.800  25.673  -4.183
    2    HA   ALA  37           HA       ALA  37   5.727  22.888  -4.633
    3    HB2  ALA  37           HB1      ALA  37   5.517  24.661  -2.236
    4    HB1  ALA  37           HB2      ALA  37   6.641  23.343  -2.561
    5    HB3  ALA  37           HB3      ALA  37   4.989  22.989  -2.060

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LYS  38           H        LYS  38   3.222  25.092  -3.398
    2    HA   LYS  38           HA       LYS  38   1.124  23.281  -3.148
    3    HB2  LYS  38           HB2      LYS  38   1.486  26.034  -2.882
    4    HB3  LYS  38           HB3      LYS  38   0.261  25.900  -4.138
    5    HG2  LYS  38           HG2      LYS  38  -1.162  24.567  -2.677
    6    HG3  LYS  38           HG3      LYS  38   0.107  24.495  -1.447
    7    HD2  LYS  38           HD2      LYS  38  -0.066  26.828  -0.977
    8    HD3  LYS  38           HD3      LYS  38  -1.006  27.131  -2.439
    9    HE2  LYS  38           HE2      LYS  38  -2.471  27.152  -0.469
   10    HE3  LYS  38           HE3      LYS  38  -2.868  25.785  -1.515
   11    HZ3  LYS  38           HZ1      LYS  38  -2.115  24.301  -0.008
   12    HZ2  LYS  38           HZ2      LYS  38  -2.442  25.550   1.098
   13    HZ1  LYS  38           HZ3      LYS  38  -0.858  25.300   0.539

  No H/Q in entry =          13
  In of MODEL   76
    1    H    ALA  39           H        ALA  39   2.051  25.204  -6.000
    2    HA   ALA  39           HA       ALA  39  -0.060  24.354  -7.669
    3    HB2  ALA  39           HB1      ALA  39   2.656  25.006  -8.771
    4    HB1  ALA  39           HB2      ALA  39   1.708  26.263  -7.977
    5    HB3  ALA  39           HB3      ALA  39   1.065  25.438  -9.397

  No H/Q in entry =           5
  In of MODEL   76
    1    H    MET  40           H        MET  40   3.186  23.045  -7.164
    2    HA   MET  40           HA       MET  40   3.045  21.041  -9.169
    3    HB2  MET  40           HB2      MET  40   4.707  21.242  -6.651
    4    HB3  MET  40           HB3      MET  40   4.931  19.995  -7.880
    5    HG2  MET  40           HG2      MET  40   4.981  22.956  -8.523
    6    HG3  MET  40           HG3      MET  40   6.435  22.047  -8.110
    7    HE3  MET  40           HE1      MET  40   7.247  19.853 -10.953
    8    HE2  MET  40           HE2      MET  40   6.715  19.521  -9.307
    9    HE1  MET  40           HE3      MET  40   7.807  20.869  -9.617

  No H/Q in entry =           9
  In of MODEL   76
    1    H    MET  41           H        MET  41   2.198  21.057  -5.727
    2    HA   MET  41           HA       MET  41   1.666  18.291  -5.461
    3    HB2  MET  41           HB2      MET  41   0.365  20.640  -4.065
    4    HB3  MET  41           HB3      MET  41   0.216  18.959  -3.568
    5    HG2  MET  41           HG2      MET  41   2.926  19.178  -3.657
    6    HG3  MET  41           HG3      MET  41   2.496  20.833  -3.239
    7    HE2  MET  41           HE1      MET  41  -0.511  19.572  -1.464
    8    HE1  MET  41           HE2      MET  41   0.301  21.087  -1.845
    9    HE3  MET  41           HE3      MET  41   0.274  20.503  -0.181

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ASP  42           H        ASP  42  -0.386  21.027  -6.373
    2    HA   ASP  42           HA       ASP  42  -2.831  19.671  -6.472
    3    HB2  ASP  42           HB2      ASP  42  -2.126  22.242  -6.722
    4    HB3  ASP  42           HB3      ASP  42  -2.311  21.861  -8.430

  No H/Q in entry =           4
  In of MODEL   76
    1    H    GLN  43           H        GLN  43  -0.440  20.279  -9.017
    2    HA   GLN  43           HA       GLN  43  -1.870  18.978 -11.089
    3    HB2  GLN  43           HB2      GLN  43   1.096  19.487 -10.761
    4    HB3  GLN  43           HB3      GLN  43   0.352  18.860 -12.235
    5    HG2  GLN  43           HG2      GLN  43  -1.157  20.889 -12.230
    6    HG3  GLN  43           HG3      GLN  43  -0.177  21.533 -10.916
    7   HE21  GLN  43          HE21      GLN  43  -0.054  23.170 -12.992
    8   HE22  GLN  43          HE22      GLN  43   1.342  22.954 -13.929

  No H/Q in entry =           8
  In of MODEL   76
    1    H    SER  44           H        SER  44   0.526  17.815  -8.754
    2    HA   SER  44           HA       SER  44   0.837  15.217  -9.807
    3    HB2  SER  44           HB2      SER  44   1.778  16.637  -7.577
    4    HB3  SER  44           HB3      SER  44   0.927  15.249  -6.900
    5    HG   SER  44           HG       SER  44   3.028  14.630  -7.373

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ARG  45           H        ARG  45  -1.434  16.519  -7.413
    2    HA   ARG  45           HA       ARG  45  -2.811  14.155  -6.769
    3    HB2  ARG  45           HB2      ARG  45  -2.983  16.313  -5.557
    4    HB3  ARG  45           HB3      ARG  45  -3.866  16.992  -6.921
    5    HG2  ARG  45           HG2      ARG  45  -5.628  15.266  -6.617
    6    HG3  ARG  45           HG3      ARG  45  -4.756  14.642  -5.215
    7    HD2  ARG  45           HD2      ARG  45  -4.939  16.900  -4.137
    8    HD3  ARG  45           HD3      ARG  45  -5.953  17.432  -5.496
    9    HE   ARG  45           HE       ARG  45  -7.045  15.049  -4.453
   10   HH21  ARG  45          HH11      ARG  45  -8.855  15.116  -3.146
   11   HH22  ARG  45          HH12      ARG  45  -9.231  16.549  -2.257
   12   HH11  ARG  45          HH21      ARG  45  -6.475  18.287  -3.414
   13   HH12  ARG  45          HH22      ARG  45  -7.879  18.345  -2.408

  No H/Q in entry =          13
  In of MODEL   76
    1    H    MET  46           H        MET  46  -3.443  16.580  -9.288
    2    HA   MET  46           HA       MET  46  -5.804  15.418 -10.313
    3    HB2  MET  46           HB2      MET  46  -3.724  17.253 -11.514
    4    HB3  MET  46           HB3      MET  46  -5.124  16.705 -12.440
    5    HG2  MET  46           HG2      MET  46  -6.637  17.624 -10.752
    6    HG3  MET  46           HG3      MET  46  -5.270  18.111  -9.756
    7    HE1  MET  46           HE1      MET  46  -7.180  18.306 -12.897
    8    HE3  MET  46           HE2      MET  46  -5.721  18.531 -13.857
    9    HE2  MET  46           HE3      MET  46  -6.844  19.873 -13.645

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ALA  47           H        ALA  47  -2.391  14.942 -11.142
    2    HA   ALA  47           HA       ALA  47  -2.781  13.233 -13.359
    3    HB3  ALA  47           HB1      ALA  47  -0.596  14.118 -13.043
    4    HB2  ALA  47           HB2      ALA  47  -0.450  12.387 -12.726
    5    HB1  ALA  47           HB3      ALA  47  -0.516  13.529 -11.382

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LEU  48           H        LEU  48  -2.444  12.569  -9.897
    2    HA   LEU  48           HA       LEU  48  -2.543   9.731 -10.076
    3    HB2  LEU  48           HB2      LEU  48  -3.262  11.631  -7.832
    4    HB3  LEU  48           HB3      LEU  48  -3.165   9.879  -7.647
    5    HG   LEU  48           HG       LEU  48  -0.885  11.585  -8.676
    6   HD13  LEU  48          HD11      LEU  48  -1.124  12.338  -6.474
    7   HD12  LEU  48          HD12      LEU  48   0.042  11.029  -6.309
    8   HD11  LEU  48          HD13      LEU  48  -1.648  10.764  -5.880
    9   HD22  LEU  48          HD21      LEU  48  -0.400   9.405  -9.344
   10   HD21  LEU  48          HD22      LEU  48  -1.244   8.679  -7.977
   11   HD23  LEU  48          HD23      LEU  48   0.334   9.430  -7.741

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ASN  49           H        ASN  49  -4.996  12.221  -9.606
    2    HA   ASN  49           HA       ASN  49  -7.172  10.553  -9.037
    3    HB2  ASN  49           HB2      ASN  49  -7.238  12.964  -8.684
    4    HB3  ASN  49           HB3      ASN  49  -7.079  13.253 -10.413
    5   HD21  ASN  49          HD21      ASN  49  -9.307  12.371  -7.866
    6   HD22  ASN  49          HD22      ASN  49 -10.703  12.356  -8.829

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLU  50           H        GLU  50  -5.953  11.773 -12.139
    2    HA   GLU  50           HA       GLU  50  -7.939  10.532 -13.756
    3    HB2  GLU  50           HB2      GLU  50  -6.489  12.357 -14.585
    4    HB3  GLU  50           HB3      GLU  50  -5.093  11.283 -14.482
    5    HG2  GLU  50           HG2      GLU  50  -6.099   9.761 -16.112
    6    HG3  GLU  50           HG3      GLU  50  -7.561  10.741 -16.163

  No H/Q in entry =           6
  In of MODEL   76
    1    H    ALA  51           H        ALA  51  -4.746   9.529 -12.621
    2    HA   ALA  51           HA       ALA  51  -4.636   7.087 -14.061
    3    HB2  ALA  51           HB1      ALA  51  -2.634   6.790 -13.002
    4    HB1  ALA  51           HB2      ALA  51  -3.291   7.200 -11.418
    5    HB3  ALA  51           HB3      ALA  51  -2.857   8.480 -12.551

  No H/Q in entry =           5
  In of MODEL   76
    1    H    HIS  52           H        HIS  52  -5.745   7.894 -10.783
    2    HA   HIS  52           HA       HIS  52  -6.416   5.278  -9.959
    3    HB2  HIS  52           HB2      HIS  52  -6.254   7.142  -8.387
    4    HB3  HIS  52           HB3      HIS  52  -7.629   7.932  -9.156
    5    HD1  HIS  52           HD1      HIS  52  -9.934   6.462  -9.109
    6    HD2  HIS  52           HD2      HIS  52  -6.974   5.362  -6.388
    7    HE1  HIS  52           HE1      HIS  52 -11.073   5.041  -7.347
    8    HE2  HIS  52           HE2      HIS  52  -9.280   4.363  -5.681

  No H/Q in entry =           8
  In of MODEL   76
    1    H    LEU  53           H        LEU  53  -8.268   7.751 -11.692
    2    HA   LEU  53           HA       LEU  53 -10.775   6.461 -11.666
    3    HB2  LEU  53           HB2      LEU  53  -9.525   8.457 -13.541
    4    HB3  LEU  53           HB3      LEU  53 -11.129   7.794 -13.843
    5    HG   LEU  53           HG       LEU  53 -10.364   9.098 -11.209
    6   HD13  LEU  53          HD11      LEU  53 -11.392  11.132 -12.005
    7   HD12  LEU  53          HD12      LEU  53 -11.875  10.357 -13.513
    8   HD11  LEU  53          HD13      LEU  53 -10.173  10.663 -13.182
    9   HD22  LEU  53          HD21      LEU  53 -12.346   7.872 -10.845
   10   HD21  LEU  53          HD22      LEU  53 -12.927   8.151 -12.483
   11   HD23  LEU  53          HD23      LEU  53 -12.981   9.446 -11.302

  No H/Q in entry =          11
  In of MODEL   76
    1    H    VAL  54           H        VAL  54  -8.068   6.279 -13.957
    2    HA   VAL  54           HA       VAL  54  -9.328   4.524 -15.791
    3    HB   VAL  54           HB       VAL  54  -6.407   5.022 -15.160
    4   HG12  VAL  54          HG11      VAL  54  -6.208   3.956 -17.562
    5   HG11  VAL  54          HG12      VAL  54  -7.729   3.173 -17.136
    6   HG13  VAL  54          HG13      VAL  54  -6.294   2.909 -16.146
    7   HG22  VAL  54          HG21      VAL  54  -7.195   6.974 -16.175
    8   HG21  VAL  54          HG22      VAL  54  -8.407   6.120 -17.126
    9   HG23  VAL  54          HG23      VAL  54  -6.710   6.041 -17.590

  No H/Q in entry =           9
  In of MODEL   76
    1    H    GLN  55           H        GLN  55  -7.274   3.953 -12.934
    2    HA   GLN  55           HA       GLN  55  -7.193   1.138 -13.215
    3    HB2  GLN  55           HB2      GLN  55  -5.608   2.020 -11.719
    4    HB3  GLN  55           HB3      GLN  55  -6.807   2.981 -10.858
    5    HG2  GLN  55           HG2      GLN  55  -7.472   1.214  -9.541
    6    HG3  GLN  55           HG3      GLN  55  -7.274   0.037 -10.833
    7   HE21  GLN  55          HE21      GLN  55  -5.643  -1.418 -10.382
    8   HE22  GLN  55          HE22      GLN  55  -4.241  -1.076  -9.494

  No H/Q in entry =           8
  In of MODEL   76
    1    H    THR  56           H        THR  56  -9.490   3.291 -11.539
    2    HA   THR  56           HA       THR  56 -11.052   1.399 -10.234
    3    HB   THR  56           HB       THR  56 -12.173   3.800 -11.701
    4    HG1  THR  56           HG1      THR  56 -10.936   3.626  -9.154
    5   HG21  THR  56          HG21      THR  56 -13.014   2.161  -9.310
    6   HG23  THR  56          HG22      THR  56 -13.929   2.487 -10.782
    7   HG22  THR  56          HG23      THR  56 -13.654   3.776  -9.609

  No H/Q in entry =           7
  In of MODEL   76
    1    H    LYS  57           H        LYS  57 -11.317   2.509 -13.607
    2    HA   LYS  57           HA       LYS  57 -13.490   0.831 -14.332
    3    HB2  LYS  57           HB2      LYS  57 -12.629   2.793 -15.648
    4    HB3  LYS  57           HB3      LYS  57 -11.206   1.846 -16.057
    5    HG2  LYS  57           HG2      LYS  57 -12.614   0.184 -17.190
    6    HG3  LYS  57           HG3      LYS  57 -14.058   1.090 -16.758
    7    HD2  LYS  57           HD2      LYS  57 -13.253   3.016 -18.079
    8    HD3  LYS  57           HD3      LYS  57 -11.801   2.117 -18.513
    9    HE2  LYS  57           HE2      LYS  57 -13.441   1.968 -20.336
   10    HE3  LYS  57           HE3      LYS  57 -13.238   0.377 -19.605
   11    HZ3  LYS  57           HZ1      LYS  57 -15.248   0.558 -18.475
   12    HZ2  LYS  57           HZ2      LYS  57 -15.588   1.176 -20.022
   13    HZ1  LYS  57           HZ3      LYS  57 -15.353   2.234 -18.711

  No H/Q in entry =          13
  In of MODEL   76
    1    H    LEU  58           H        LEU  58  -9.986   0.395 -14.345
    2    HA   LEU  58           HA       LEU  58 -10.022  -2.112 -15.653
    3    HB2  LEU  58           HB2      LEU  58  -7.952  -0.838 -13.874
    4    HB3  LEU  58           HB3      LEU  58  -7.710  -2.353 -14.744
    5    HG   LEU  58           HG       LEU  58  -8.485   0.263 -16.073
    6   HD11  LEU  58          HD11      LEU  58  -5.828  -0.983 -15.442
    7   HD13  LEU  58          HD12      LEU  58  -6.320   0.708 -15.371
    8   HD12  LEU  58          HD13      LEU  58  -6.011  -0.051 -16.929
    9   HD22  LEU  58          HD21      LEU  58  -9.094  -1.286 -17.665
   10   HD21  LEU  58          HD22      LEU  58  -8.042  -2.540 -17.013
   11   HD23  LEU  58          HD23      LEU  58  -7.368  -1.260 -18.021

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  59           H        ILE  59 -10.781  -1.234 -12.380
    2    HA   ILE  59           HA       ILE  59 -10.416  -4.008 -11.460
    3    HB   ILE  59           HB       ILE  59  -9.941  -1.754 -10.053
    4   HG12  ILE  59          HG12      ILE  59 -11.291  -4.111  -8.721
    5   HG13  ILE  59          HG13      ILE  59  -9.660  -4.191  -9.338
    6   HG21  ILE  59          HG21      ILE  59 -12.480  -1.230 -10.256
    7   HG23  ILE  59          HG22      ILE  59 -11.737  -1.068  -8.681
    8   HG22  ILE  59          HG23      ILE  59 -12.694  -2.495  -9.069
    9   HD12  ILE  59          HD11      ILE  59  -9.758  -3.605  -6.919
   10   HD11  ILE  59          HD12      ILE  59 -10.606  -2.127  -7.352
   11   HD13  ILE  59          HD13      ILE  59  -8.945  -2.380  -7.888

  No H/Q in entry =          11
  In of MODEL   76
    1    H    GLU  60           H        GLU  60 -12.985  -1.684 -12.203
    2    HA   GLU  60           HA       GLU  60 -15.152  -3.205 -11.160
    3    HB2  GLU  60           HB2      GLU  60 -16.493  -1.580 -12.083
    4    HB3  GLU  60           HB3      GLU  60 -14.960  -0.716 -12.130
    5    HG2  GLU  60           HG2      GLU  60 -14.629  -1.639 -14.472
    6    HG3  GLU  60           HG3      GLU  60 -16.286  -2.203 -14.403

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLY  61           H        GLY  61 -13.538  -3.168 -14.306
    2    HA3  GLY  61           HA2      GLY  61 -15.270  -5.404 -15.180
    3    HA2  GLY  61           HA3      GLY  61 -14.445  -4.293 -16.265

  No H/Q in entry =           3
  In of MODEL   76
    1    H    ASP  62           H        ASP  62 -13.021  -5.768 -13.419
    2    HA   ASP  62           HA       ASP  62 -10.716  -6.620 -14.815
    3    HB2  ASP  62           HB2      ASP  62 -10.133  -7.702 -12.678
    4    HB3  ASP  62           HB3      ASP  62 -10.710  -6.058 -12.430

  No H/Q in entry =           4
  In of MODEL   76
    1    H    ALA  63           H        ALA  63 -10.294  -8.444 -15.978
    2    HA   ALA  63           HA       ALA  63 -11.536 -10.995 -15.341
    3    HB1  ALA  63           HB1      ALA  63 -12.124  -9.672 -18.016
    4    HB3  ALA  63           HB2      ALA  63 -13.299  -9.853 -16.714
    5    HB2  ALA  63           HB3      ALA  63 -12.642 -11.282 -17.516

  No H/Q in entry =           5
  In of MODEL   76
    1    H    GLY  64           H        GLY  64 -11.054 -11.111 -18.530
    2    HA3  GLY  64           HA2      GLY  64  -9.148 -11.344 -19.918
    3    HA2  GLY  64           HA3      GLY  64  -8.132 -11.360 -18.483

  No H/Q in entry =           3
  In of MODEL   76
    1    H    GLU  65           H        GLU  65 -10.498 -13.306 -17.534
    2    HA   GLU  65           HA       GLU  65  -9.523 -15.696 -18.937
    3    HB2  GLU  65           HB2      GLU  65  -9.509 -15.329 -15.940
    4    HB3  GLU  65           HB3      GLU  65  -9.259 -16.871 -16.758
    5    HG2  GLU  65           HG2      GLU  65  -7.577 -14.389 -17.207
    6    HG3  GLU  65           HG3      GLU  65  -7.113 -15.747 -16.182

  No H/Q in entry =           6
  In of MODEL   76
    1    H    GLY  66           H        GLY  66 -10.726 -17.606 -18.539
    2    HA3  GLY  66           HA2      GLY  66 -13.495 -17.332 -18.878
    3    HA2  GLY  66           HA3      GLY  66 -12.640 -18.832 -18.579

  No H/Q in entry =           3
  In of MODEL   76
    1    H    LYS  67           H        LYS  67 -11.629 -18.274 -16.039
    2    HA   LYS  67           HA       LYS  67 -14.024 -18.689 -14.458
    3    HB2  LYS  67           HB2      LYS  67 -11.089 -19.048 -13.883
    4    HB3  LYS  67           HB3      LYS  67 -12.360 -19.349 -12.692
    5    HG2  LYS  67           HG2      LYS  67 -13.438 -20.945 -14.233
    6    HG3  LYS  67           HG3      LYS  67 -12.181 -20.643 -15.431
    7    HD2  LYS  67           HD2      LYS  67 -10.479 -21.512 -13.873
    8    HD3  LYS  67           HD3      LYS  67 -11.734 -21.808 -12.667
    9    HE2  LYS  67           HE2      LYS  67 -12.873 -23.350 -14.228
   10    HE3  LYS  67           HE3      LYS  67 -11.612 -23.062 -15.427
   11    HZ3  LYS  67           HZ1      LYS  67 -10.286 -24.510 -14.427
   12    HZ2  LYS  67           HZ2      LYS  67 -11.595 -24.961 -13.444
   13    HZ1  LYS  67           HZ3      LYS  67 -10.499 -23.777 -12.912

  No H/Q in entry =          13
  In of MODEL   76
    1    H    MET  68           H        MET  68 -13.328 -18.021 -11.988
    2    HA   MET  68           HA       MET  68 -14.117 -15.343 -11.736
    3    HB2  MET  68           HB2      MET  68 -12.930 -17.290  -9.765
    4    HB3  MET  68           HB3      MET  68 -13.536 -15.698  -9.311
    5    HG2  MET  68           HG2      MET  68 -15.744 -16.276 -10.271
    6    HG3  MET  68           HG3      MET  68 -15.133 -17.879 -10.685
    7    HE2  MET  68           HE1      MET  68 -17.338 -19.013  -7.853
    8    HE1  MET  68           HE2      MET  68 -16.822 -19.168  -9.531
    9    HE3  MET  68           HE3      MET  68 -17.724 -17.741  -9.022

  No H/Q in entry =           9
  In of MODEL   76
    1    H    LYS  69           H        LYS  69 -11.033 -16.387 -12.578
    2    HA   LYS  69           HA       LYS  69  -9.384 -14.765 -10.991
    3    HB2  LYS  69           HB2      LYS  69  -8.979 -15.932 -13.743
    4    HB3  LYS  69           HB3      LYS  69  -7.702 -15.107 -12.845
    5    HG2  LYS  69           HG2      LYS  69  -7.903 -16.695 -11.008
    6    HG3  LYS  69           HG3      LYS  69  -9.285 -17.467 -11.784
    7    HD2  LYS  69           HD2      LYS  69  -7.462 -18.872 -12.327
    8    HD3  LYS  69           HD3      LYS  69  -7.685 -17.886 -13.773
    9    HE2  LYS  69           HE2      LYS  69  -5.874 -16.423 -13.149
   10    HE3  LYS  69           HE3      LYS  69  -5.746 -17.174 -11.559
   11    HZ3  LYS  69           HZ1      LYS  69  -4.537 -18.840 -12.370
   12    HZ2  LYS  69           HZ2      LYS  69  -4.313 -17.870 -13.746
   13    HZ1  LYS  69           HZ3      LYS  69  -5.538 -19.049 -13.723

  No H/Q in entry =          13
  In of MODEL   76
    1    H    VAL  70           H        VAL  70  -7.959 -12.965 -11.684
    2    HA   VAL  70           HA       VAL  70  -9.353 -11.013 -13.430
    3    HB   VAL  70           HB       VAL  70  -8.611  -9.255 -11.867
    4   HG13  VAL  70          HG11      VAL  70 -10.845 -10.170 -11.564
    5   HG12  VAL  70          HG12      VAL  70 -10.134  -9.891  -9.974
    6   HG11  VAL  70          HG13      VAL  70 -10.201 -11.524 -10.635
    7   HG21  VAL  70          HG21      VAL  70  -7.638 -11.596 -10.183
    8   HG23  VAL  70          HG22      VAL  70  -7.703  -9.919  -9.646
    9   HG22  VAL  70          HG23      VAL  70  -6.614 -10.385 -10.951

  No H/Q in entry =           9
  In of MODEL   76
    1    H    SER  71           H        SER  71  -7.864  -9.267 -14.169
    2    HA   SER  71           HA       SER  71  -5.607 -10.301 -15.517
    3    HB2  SER  71           HB2      SER  71  -6.913  -8.257 -16.194
    4    HB3  SER  71           HB3      SER  71  -6.163  -7.401 -14.849
    5    HG   SER  71           HG       SER  71  -4.166  -8.480 -16.001

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LEU  72           H        LEU  72  -3.599 -10.610 -14.882
    2    HA   LEU  72           HA       LEU  72  -2.828 -10.416 -12.183
    3    HB2  LEU  72           HB2      LEU  72  -1.227 -10.834 -14.702
    4    HB3  LEU  72           HB3      LEU  72  -0.527 -10.910 -13.088
    5    HG   LEU  72           HG       LEU  72  -2.902 -12.600 -13.937
    6   HD11  LEU  72          HD11      LEU  72   0.067 -13.091 -14.126
    7   HD13  LEU  72          HD12      LEU  72  -1.179 -13.387 -15.338
    8   HD12  LEU  72          HD13      LEU  72  -1.060 -14.434 -13.923
    9   HD23  LEU  72          HD21      LEU  72  -1.863 -14.018 -11.997
   10   HD22  LEU  72          HD22      LEU  72  -2.821 -12.611 -11.565
   11   HD21  LEU  72          HD23      LEU  72  -1.063 -12.518 -11.542

  No H/Q in entry =          11
  In of MODEL   76
    1    H    VAL  73           H        VAL  73  -2.160  -8.381 -14.962
    2    HA   VAL  73           HA       VAL  73  -0.215  -6.694 -13.883
    3    HB   VAL  73           HB       VAL  73  -0.583  -5.309 -15.740
    4   HG12  VAL  73          HG11      VAL  73  -1.697  -7.941 -16.714
    5   HG11  VAL  73          HG12      VAL  73  -0.024  -7.786 -16.182
    6   HG13  VAL  73          HG13      VAL  73  -0.605  -6.837 -17.549
    7   HG22  VAL  73          HG21      VAL  73  -2.885  -4.715 -15.478
    8   HG21  VAL  73          HG22      VAL  73  -3.408  -6.389 -15.654
    9   HG23  VAL  73          HG23      VAL  73  -2.774  -5.511 -17.048

  No H/Q in entry =           9
  In of MODEL   76
    1    H    LEU  74           H        LEU  74  -3.602  -6.807 -13.263
    2    HA   LEU  74           HA       LEU  74  -4.202  -4.154 -12.620
    3    HB2  LEU  74           HB2      LEU  74  -5.943  -5.803 -12.770
    4    HB3  LEU  74           HB3      LEU  74  -5.225  -6.754 -11.473
    5    HG   LEU  74           HG       LEU  74  -5.645  -4.910  -9.884
    6   HD12  LEU  74          HD11      LEU  74  -7.242  -3.093 -10.780
    7   HD11  LEU  74          HD12      LEU  74  -6.697  -3.580 -12.384
    8   HD13  LEU  74          HD13      LEU  74  -5.539  -2.946 -11.215
    9   HD22  LEU  74          HD21      LEU  74  -7.856  -5.462  -9.600
   10   HD21  LEU  74          HD22      LEU  74  -7.363  -6.701 -10.735
   11   HD23  LEU  74          HD23      LEU  74  -8.227  -5.297 -11.315

  No H/Q in entry =          11
  In of MODEL   76
    1    H    VAL  75           H        VAL  75  -3.127  -6.758 -10.497
    2    HA   VAL  75           HA       VAL  75  -2.881  -5.224  -8.146
    3    HB   VAL  75           HB       VAL  75  -1.402  -7.715  -8.980
    4   HG12  VAL  75          HG11      VAL  75  -0.915  -7.886  -6.510
    5   HG11  VAL  75          HG12      VAL  75  -1.571  -6.268  -6.312
    6   HG13  VAL  75          HG13      VAL  75  -0.117  -6.512  -7.265
    7   HG21  VAL  75          HG21      VAL  75  -3.974  -7.654  -8.666
    8   HG23  VAL  75          HG22      VAL  75  -3.628  -7.384  -6.958
    9   HG22  VAL  75          HG23      VAL  75  -3.080  -8.864  -7.746

  No H/Q in entry =           9
  In of MODEL   76
    1    H    GLU  76           H        GLU  76  -0.522  -5.972 -10.732
    2    HA   GLU  76           HA       GLU  76   1.688  -4.638  -9.606
    3    HB2  GLU  76           HB2      GLU  76   1.862  -6.096 -11.599
    4    HB3  GLU  76           HB3      GLU  76   0.921  -4.944 -12.532
    5    HG2  GLU  76           HG2      GLU  76   3.235  -4.579 -13.085
    6    HG3  GLU  76           HG3      GLU  76   2.739  -3.224 -12.091

  No H/Q in entry =           6
  In of MODEL   76
    1    H    ALA  77           H        ALA  77  -0.881  -3.415 -11.739
    2    HA   ALA  77           HA       ALA  77   0.112  -0.770 -11.914
    3    HB3  ALA  77           HB1      ALA  77  -2.824  -1.438 -11.998
    4    HB1  ALA  77           HB2      ALA  77  -1.745  -1.940 -13.300
    5    HB2  ALA  77           HB3      ALA  77  -1.937  -0.228 -12.928

  No H/Q in entry =           5
  In of MODEL   76
    1    H    GLN  78           H        GLN  78  -2.119  -2.336  -9.673
    2    HA   GLN  78           HA       GLN  78  -2.894  -0.026  -8.240
    3    HB2  GLN  78           HB2      GLN  78  -4.006  -2.286  -8.152
    4    HB3  GLN  78           HB3      GLN  78  -2.653  -2.853  -7.175
    5    HG2  GLN  78           HG2      GLN  78  -3.141  -1.123  -5.494
    6    HG3  GLN  78           HG3      GLN  78  -4.494  -0.553  -6.468
    7   HE21  GLN  78          HE21      GLN  78  -4.919  -1.538  -3.813
    8   HE22  GLN  78          HE22      GLN  78  -5.781  -2.996  -3.917

  No H/Q in entry =           8
  In of MODEL   76
    1    H    LEU  79           H        LEU  79  -0.212  -2.290  -7.856
    2    HA   LEU  79           HA       LEU  79   0.811  -1.412  -5.411
    3    HB2  LEU  79           HB2      LEU  79   1.657  -3.415  -6.509
    4    HB3  LEU  79           HB3      LEU  79   2.280  -2.454  -7.847
    5    HG   LEU  79           HG       LEU  79   3.865  -1.328  -6.364
    6   HD13  LEU  79          HD11      LEU  79   2.900  -1.096  -4.277
    7   HD12  LEU  79          HD12      LEU  79   3.982  -2.450  -3.963
    8   HD11  LEU  79          HD13      LEU  79   2.271  -2.744  -4.263
    9   HD23  LEU  79          HD21      LEU  79   5.089  -3.484  -5.499
   10   HD22  LEU  79          HD22      LEU  79   4.854  -3.272  -7.231
   11   HD21  LEU  79          HD23      LEU  79   3.791  -4.347  -6.327

  No H/Q in entry =          11
  In of MODEL   76
    1    H    HIS  80           H        HIS  80   1.622  -0.273  -8.691
    2    HA   HIS  80           HA       HIS  80   3.449   1.706  -7.789
    3    HB2  HIS  80           HB2      HIS  80   2.111   1.031 -10.352
    4    HB3  HIS  80           HB3      HIS  80   2.710   2.681 -10.180
    5    HD1  HIS  80           HD1      HIS  80   5.102   2.983 -10.745
    6    HD2  HIS  80           HD2      HIS  80   4.301  -0.935  -9.566
    7    HE1  HIS  80           HE1      HIS  80   7.287   1.706 -10.960
    8    HE2  HIS  80           HE2      HIS  80   6.810  -0.686 -10.245

  No H/Q in entry =           8
  In of MODEL   76
    1    H    LEU  81           H        LEU  81   0.027   1.875  -8.704
    2    HA   LEU  81           HA       LEU  81  -0.240   4.666  -8.349
    3    HB2  LEU  81           HB2      LEU  81  -2.254   2.421  -8.249
    4    HB3  LEU  81           HB3      LEU  81  -2.703   4.123  -8.136
    5    HG   LEU  81           HG       LEU  81  -1.052   2.989 -10.411
    6   HD12  LEU  81          HD11      LEU  81  -3.308   3.319 -11.666
    7   HD11  LEU  81          HD12      LEU  81  -4.034   3.239 -10.062
    8   HD13  LEU  81          HD13      LEU  81  -3.103   1.875 -10.676
    9   HD23  LEU  81          HD21      LEU  81  -2.168   5.141 -11.472
   10   HD22  LEU  81          HD22      LEU  81  -0.733   5.304 -10.464
   11   HD21  LEU  81          HD23      LEU  81  -2.326   5.648  -9.792

  No H/Q in entry =          11
  In of MODEL   76
    1    H    MET  82           H        MET  82  -0.859   1.963  -6.107
    2    HA   MET  82           HA       MET  82  -1.872   3.534  -3.990
    3    HB2  MET  82           HB2      MET  82  -0.500   0.848  -4.074
    4    HB3  MET  82           HB3      MET  82  -1.050   1.562  -2.560
    5    HG2  MET  82           HG2      MET  82  -2.828   1.086  -4.973
    6    HG3  MET  82           HG3      MET  82  -2.724   0.002  -3.587
    7    HE3  MET  82           HE1      MET  82  -4.395   1.631  -0.729
    8    HE2  MET  82           HE2      MET  82  -2.668   1.911  -0.944
    9    HE1  MET  82           HE3      MET  82  -3.365   0.356  -1.396

  No H/Q in entry =           9
  In of MODEL   76
    1    H    THR  83           H        THR  83   1.415   2.454  -4.748
    2    HA   THR  83           HA       THR  83   2.675   3.541  -2.462
    3    HB   THR  83           HB       THR  83   4.743   3.497  -3.974
    4    HG1  THR  83           HG1      THR  83   4.466   2.985  -5.997
    5   HG22  THR  83          HG21      THR  83   4.293   0.841  -4.317
    6   HG21  THR  83          HG22      THR  83   3.024   1.212  -3.151
    7   HG23  THR  83          HG23      THR  83   4.711   1.553  -2.760

  No H/Q in entry =           7
  In of MODEL   76
    1    H    SER  84           H        SER  84   2.244   4.845  -5.745
    2    HA   SER  84           HA       SER  84   3.592   7.282  -5.297
    3    HB2  SER  84           HB2      SER  84   1.485   6.464  -7.284
    4    HB3  SER  84           HB3      SER  84   2.163   8.091  -7.259
    5    HG   SER  84           HG       SER  84   3.530   5.618  -7.594

  No H/Q in entry =           5
  In of MODEL   76
    1    H    MET  85           H        MET  85   0.101   6.524  -5.067
    2    HA   MET  85           HA       MET  85  -0.749   9.129  -4.431
    3    HB2  MET  85           HB2      MET  85  -2.282   7.323  -5.085
    4    HB3  MET  85           HB3      MET  85  -1.968   6.509  -3.553
    5    HG2  MET  85           HG2      MET  85  -2.846   8.447  -2.322
    6    HG3  MET  85           HG3      MET  85  -3.116   9.301  -3.840
    7    HE3  MET  85           HE1      MET  85  -4.140   5.248  -3.082
    8    HE2  MET  85           HE2      MET  85  -5.281   5.878  -1.895
    9    HE1  MET  85           HE3      MET  85  -3.582   6.329  -1.798

  No H/Q in entry =           9
  In of MODEL   76
    1    H    LEU  86           H        LEU  86   0.209   6.451  -2.324
    2    HA   LEU  86           HA       LEU  86  -0.279   7.736   0.137
    3    HB2  LEU  86           HB2      LEU  86   0.177   5.268  -0.284
    4    HB3  LEU  86           HB3      LEU  86   1.882   5.698  -0.407
    5    HG   LEU  86           HG       LEU  86   1.600   6.842   1.875
    6   HD11  LEU  86          HD11      LEU  86  -1.103   6.081   1.448
    7   HD13  LEU  86          HD12      LEU  86  -0.410   6.817   2.891
    8   HD12  LEU  86          HD13      LEU  86  -0.505   5.062   2.761
    9   HD23  LEU  86          HD21      LEU  86   1.171   3.849   1.983
   10   HD22  LEU  86          HD22      LEU  86   2.193   4.850   3.012
   11   HD21  LEU  86          HD23      LEU  86   2.663   4.537   1.342

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ALA  87           H        ALA  87   2.667   7.453  -1.809
    2    HA   ALA  87           HA       ALA  87   4.406   8.849  -0.105
    3    HB3  ALA  87           HB1      ALA  87   4.450   7.856  -2.821
    4    HB2  ALA  87           HB2      ALA  87   5.805   8.177  -1.743
    5    HB1  ALA  87           HB3      ALA  87   5.173   9.466  -2.766

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ARG  88           H        ARG  88   2.410  10.008  -2.781
    2    HA   ARG  88           HA       ARG  88   3.191  12.695  -2.658
    3    HB2  ARG  88           HB2      ARG  88   1.901  11.559  -4.500
    4    HB3  ARG  88           HB3      ARG  88   0.462  11.697  -3.490
    5    HG2  ARG  88           HG2      ARG  88   1.488  14.275  -3.406
    6    HG3  ARG  88           HG3      ARG  88   1.881  13.773  -5.047
    7    HD2  ARG  88           HD2      ARG  88  -0.273  13.862  -5.705
    8    HD3  ARG  88           HD3      ARG  88  -0.835  12.999  -4.272
    9    HE   ARG  88           HE       ARG  88  -1.027  15.780  -4.666
   10   HH21  ARG  88          HH11      ARG  88  -1.519  17.097  -2.908
   11   HH22  ARG  88          HH12      ARG  88  -1.194  16.547  -1.301
   12   HH11  ARG  88          HH21      ARG  88   0.028  13.498  -2.328
   13   HH12  ARG  88          HH22      ARG  88  -0.335  14.503  -0.972

  No H/Q in entry =          13
  In of MODEL   76
    1    H    GLU  89           H        GLU  89   0.515  11.014  -0.981
    2    HA   GLU  89           HA       GLU  89  -0.565  13.319   0.262
    3    HB2  GLU  89           HB2      GLU  89  -1.689  11.083   0.179
    4    HB3  GLU  89           HB3      GLU  89  -0.544  10.515   1.395
    5    HG2  GLU  89           HG2      GLU  89  -1.331  12.204   2.982
    6    HG3  GLU  89           HG3      GLU  89  -2.404  12.887   1.763

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LEU  90           H        LEU  90   1.902  11.012   1.373
    2    HA   LEU  90           HA       LEU  90   2.308  12.235   3.905
    3    HB2  LEU  90           HB2      LEU  90   4.045  10.470   2.181
    4    HB3  LEU  90           HB3      LEU  90   4.496  10.972   3.816
    5    HG   LEU  90           HG       LEU  90   1.846   9.639   3.193
    6   HD12  LEU  90          HD11      LEU  90   2.999   7.582   4.164
    7   HD11  LEU  90          HD12      LEU  90   4.519   8.436   3.901
    8   HD13  LEU  90          HD13      LEU  90   3.479   8.042   2.530
    9   HD22  LEU  90          HD21      LEU  90   1.624  10.547   5.327
   10   HD21  LEU  90          HD22      LEU  90   3.348  10.432   5.676
   11   HD23  LEU  90          HD23      LEU  90   2.338   8.987   5.732

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  91           H        ILE  91   3.854  12.638   0.752
    2    HA   ILE  91           HA       ILE  91   5.852  14.456   1.568
    3    HB   ILE  91           HB       ILE  91   4.489  13.991  -1.091
    4   HG12  ILE  91          HG12      ILE  91   7.338  13.487  -0.174
    5   HG13  ILE  91          HG13      ILE  91   6.055  12.292   0.004
    6   HG22  ILE  91          HG21      ILE  91   6.703  15.336  -1.810
    7   HG21  ILE  91          HG22      ILE  91   6.425  16.126  -0.257
    8   HG23  ILE  91          HG23      ILE  91   5.179  16.168  -1.503
    9   HD13  ILE  91          HD11      ILE  91   5.838  11.988  -2.302
   10   HD12  ILE  91          HD12      ILE  91   7.577  12.223  -2.119
   11   HD11  ILE  91          HD13      ILE  91   6.560  13.554  -2.676

  No H/Q in entry =          11
  In of MODEL   76
    1    H    THR  92           H        THR  92   2.474  14.908   0.627
    2    HA   THR  92           HA       THR  92   2.456  17.732   0.589
    3    HB   THR  92           HB       THR  92   0.295  15.739   1.313
    4    HG1  THR  92           HG1      THR  92   0.560  15.576  -0.779
    5   HG22  THR  92          HG21      THR  92  -1.111  17.911   0.634
    6   HG21  THR  92          HG22      THR  92   0.297  18.726   1.311
    7   HG23  THR  92          HG23      THR  92  -0.630  17.600   2.302

  No H/Q in entry =           7
  In of MODEL   76
    1    H    GLU  93           H        GLU  93   1.949  15.412   3.234
    2    HA   GLU  93           HA       GLU  93   1.462  17.302   5.277
    3    HB2  GLU  93           HB2      GLU  93   2.770  14.571   5.467
    4    HB3  GLU  93           HB3      GLU  93   2.107  15.490   6.820
    5    HG2  GLU  93           HG2      GLU  93   0.447  14.737   4.406
    6    HG3  GLU  93           HG3      GLU  93   0.571  13.703   5.824

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LEU  94           H        LEU  94   4.441  15.819   4.060
    2    HA   LEU  94           HA       LEU  94   6.231  16.945   5.924
    3    HB2  LEU  94           HB2      LEU  94   6.576  15.998   3.078
    4    HB3  LEU  94           HB3      LEU  94   7.926  16.644   4.008
    5    HG   LEU  94           HG       LEU  94   6.199  14.446   5.158
    6   HD11  LEU  94          HD11      LEU  94   8.254  14.229   2.986
    7   HD13  LEU  94          HD12      LEU  94   6.809  13.258   3.267
    8   HD12  LEU  94          HD13      LEU  94   8.252  12.992   4.245
    9   HD23  LEU  94          HD21      LEU  94   8.408  13.892   6.265
   10   HD22  LEU  94          HD22      LEU  94   7.755  15.469   6.706
   11   HD21  LEU  94          HD23      LEU  94   9.072  15.353   5.538

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  95           H        ILE  95   5.037  18.145   2.805
    2    HA   ILE  95           HA       ILE  95   6.617  20.497   2.735
    3    HB   ILE  95           HB       ILE  95   3.947  19.834   1.473
    4   HG12  ILE  95          HG12      ILE  95   6.715  20.170   0.287
    5   HG13  ILE  95          HG13      ILE  95   6.069  18.615   0.802
    6   HG21  ILE  95          HG21      ILE  95   5.701  22.296   1.240
    7   HG23  ILE  95          HG22      ILE  95   3.983  22.232   1.628
    8   HG22  ILE  95          HG23      ILE  95   4.534  21.842  -0.002
    9   HD13  ILE  95          HD11      ILE  95   4.477  18.558  -0.898
   10   HD12  ILE  95          HD12      ILE  95   5.814  19.378  -1.705
   11   HD11  ILE  95          HD13      ILE  95   4.457  20.313  -1.080

  No H/Q in entry =          11
  In of MODEL   76
    1    H    GLU  96           H        GLU  96   3.391  19.847   4.085
    2    HA   GLU  96           HA       GLU  96   2.795  22.490   4.868
    3    HB2  GLU  96           HB2      GLU  96   1.114  20.714   4.898
    4    HB3  GLU  96           HB3      GLU  96   1.996  19.873   6.170
    5    HG2  GLU  96           HG2      GLU  96   1.010  21.148   7.768
    6    HG3  GLU  96           HG3      GLU  96   1.537  22.626   6.973

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LEU  97           H        LEU  97   4.657  19.920   6.439
    2    HA   LEU  97           HA       LEU  97   5.066  21.248   8.913
    3    HB2  LEU  97           HB2      LEU  97   6.568  19.084   7.453
    4    HB3  LEU  97           HB3      LEU  97   7.189  19.754   8.959
    5    HG   LEU  97           HG       LEU  97   4.370  18.674   8.693
    6   HD12  LEU  97          HD11      LEU  97   5.324  16.649   9.872
    7   HD11  LEU  97          HD12      LEU  97   6.931  17.276   9.503
    8   HD13  LEU  97          HD13      LEU  97   5.834  16.833   8.194
    9   HD23  LEU  97          HD21      LEU  97   4.869  18.358  11.246
   10   HD22  LEU  97          HD22      LEU  97   4.484  19.976  10.661
   11   HD21  LEU  97          HD23      LEU  97   6.160  19.527  10.971

  No H/Q in entry =          11
  In of MODEL   76
    1    H    HIS  98           H        HIS  98   6.880  21.280   5.853
    2    HA   HIS  98           HA       HIS  98   9.057  22.843   6.724
    3    HB2  HIS  98           HB2      HIS  98   7.712  22.615   4.021
    4    HB3  HIS  98           HB3      HIS  98   9.162  23.585   4.292
    5    HD1  HIS  98           HD1      HIS  98   7.935  20.020   4.307
    6    HD2  HIS  98           HD2      HIS  98  11.533  22.097   4.681
    7    HE1  HIS  98           HE1      HIS  98   9.781  18.283   4.202
    8    HE2  HIS  98           HE2      HIS  98  11.976  19.527   4.430

  No H/Q in entry =           8
  In of MODEL   76
    1    H    GLU  99           H        GLU  99   5.819  23.701   5.616
    2    HA   GLU  99           HA       GLU  99   6.209  26.515   5.573
    3    HB2  GLU  99           HB2      GLU  99   4.304  25.363   4.468
    4    HB3  GLU  99           HB3      GLU  99   3.636  24.992   6.057
    5    HG2  GLU  99           HG2      GLU  99   3.476  27.381   6.580
    6    HG3  GLU  99           HG3      GLU  99   4.226  27.789   5.040

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LYS 100           H        LYS 100   5.116  24.265   8.098
    2    HA   LYS 100           HA       LYS 100   4.574  26.306  10.018
    3    HB2  LYS 100           HB2      LYS 100   5.142  23.350  10.330
    4    HB3  LYS 100           HB3      LYS 100   4.725  24.414  11.679
    5    HG2  LYS 100           HG2      LYS 100   2.639  25.071  10.475
    6    HG3  LYS 100           HG3      LYS 100   3.037  23.910   9.205
    7    HD2  LYS 100           HD2      LYS 100   2.981  22.076  10.854
    8    HD3  LYS 100           HD3      LYS 100   2.601  23.231  12.134
    9    HE2  LYS 100           HE2      LYS 100   0.527  23.872  10.914
   10    HE3  LYS 100           HE3      LYS 100   0.899  22.660   9.682
   11    HZ1  LYS 100           HZ1      LYS 100   0.683  21.972  12.561
   12    HZ3  LYS 100           HZ2      LYS 100   0.638  20.928  11.219
   13    HZ2  LYS 100           HZ3      LYS 100  -0.667  21.971  11.531

  No H/Q in entry =          13
  In of MODEL   76
    1    H    LEU 101           H        LEU 101   7.473  24.504   9.116
    2    HA   LEU 101           HA       LEU 101   9.116  25.319  11.296
    3    HB2  LEU 101           HB2      LEU 101   9.654  24.351   8.500
    4    HB3  LEU 101           HB3      LEU 101  10.977  25.002   9.462
    5    HG   LEU 101           HG       LEU 101   9.155  22.847  10.542
    6   HD12  LEU 101          HD11      LEU 101  11.190  21.346   9.884
    7   HD11  LEU 101          HD12      LEU 101  11.541  22.617   8.715
    8   HD13  LEU 101          HD13      LEU 101  10.006  21.752   8.643
    9   HD21  LEU 101          HD21      LEU 101  11.898  23.935  11.228
   10   HD23  LEU 101          HD22      LEU 101  11.357  22.361  11.805
   11   HD22  LEU 101          HD23      LEU 101  10.481  23.818  12.271

  No H/Q in entry =          11
  In of MODEL   76
    1    H    LYS 102           H        LYS 102   7.503  27.207   9.200
    2    HA   LYS 102           HA       LYS 102   7.587  29.502   8.925
    3    HB2  LYS 102           HB2      LYS 102   9.189  29.362  10.992
    4    HB3  LYS 102           HB3      LYS 102  10.468  29.559   9.811
    5    HG2  LYS 102           HG2      LYS 102   8.389  31.516  10.727
    6    HG3  LYS 102           HG3      LYS 102  10.098  31.769  10.446
    7    HD2  LYS 102           HD2      LYS 102   8.102  31.374   8.179
    8    HD3  LYS 102           HD3      LYS 102   8.506  32.946   8.853
    9    HE2  LYS 102           HE2      LYS 102   9.834  31.771   6.745
   10    HE3  LYS 102           HE3      LYS 102  10.476  33.067   7.755
   11    HZ2  LYS 102           HZ1      LYS 102  11.983  31.156   7.536
   12    HZ1  LYS 102           HZ2      LYS 102  10.830  30.173   8.292
   13    HZ3  LYS 102           HZ3      LYS 102  11.545  31.450   9.148

  No H/Q in entry =          13
  In of MODEL   76
    1    H    ALA 103           H        ALA 103  10.825  28.150   8.289
    2    HA   ALA 103           HA       ALA 103  11.758  29.539   6.206
    3    HB2  ALA 103           HB1      ALA 103  12.614  27.327   5.245
    4    HB1  ALA 103           HB2      ALA 103  11.739  26.547   6.561
    5    HB3  ALA 103           HB3      ALA 103  13.041  27.682   6.919

  No H/Q in entry =           5
  In of MODEL   76
    1    H1   LYS   3           H1       LYS   3 -30.748   5.238 -20.442
    2    H2   LYS   3           H3       LYS   3 -29.706   4.907 -21.741
    3    H3   LYS   3           H2       LYS   3 -31.094   3.960 -21.503
    4    HA   LYS   3           HA       LYS   3 -30.124   2.650 -20.004
    5    HB2  LYS   3           HB2      LYS   3 -27.816   4.040 -21.313
    6    HB3  LYS   3           HB3      LYS   3 -27.520   2.893 -20.007
    7    HG2  LYS   3           HG2      LYS   3 -28.867   1.226 -21.336
    8    HG3  LYS   3           HG3      LYS   3 -28.791   2.370 -22.677
    9    HD2  LYS   3           HD2      LYS   3 -26.310   2.299 -22.530
   10    HD3  LYS   3           HD3      LYS   3 -26.454   1.052 -21.292
   11    HE2  LYS   3           HE2      LYS   3 -27.870  -0.222 -23.009
   12    HE3  LYS   3           HE3      LYS   3 -27.225   0.914 -24.193
   13    HZ3  LYS   3           HZ1      LYS   3 -25.400  -0.295 -24.341
   14    HZ2  LYS   3           HZ2      LYS   3 -26.052  -1.425 -23.254
   15    HZ1  LYS   3           HZ3      LYS   3 -25.103  -0.141 -22.676

  No H/Q in entry =          15
  In of MODEL   76
    1    H    LYS   4           H        LYS   4 -30.252   2.598 -17.942
    2    HA   LYS   4           HA       LYS   4 -29.616   4.965 -16.369
    3    HB2  LYS   4           HB2      LYS   4 -30.805   2.287 -15.595
    4    HB3  LYS   4           HB3      LYS   4 -30.645   3.676 -14.522
    5    HG2  LYS   4           HG2      LYS   4 -32.360   3.481 -17.003
    6    HG3  LYS   4           HG3      LYS   4 -32.914   3.598 -15.334
    7    HD2  LYS   4           HD2      LYS   4 -32.259   5.839 -15.140
    8    HD3  LYS   4           HD3      LYS   4 -31.167   5.735 -16.520
    9    HE2  LYS   4           HE2      LYS   4 -33.092   7.058 -17.114
   10    HE3  LYS   4           HE3      LYS   4 -33.116   5.543 -18.018
   11    HZ3  LYS   4           HZ1      LYS   4 -34.736   4.676 -16.491
   12    HZ2  LYS   4           HZ2      LYS   4 -35.289   6.136 -17.161
   13    HZ1  LYS   4           HZ3      LYS   4 -34.690   6.103 -15.572

  No H/Q in entry =          13
  In of MODEL   76
    1    H    HIS   5           H        HIS   5 -28.210   5.141 -14.730
    2    HA   HIS   5           HA       HIS   5 -25.893   3.333 -14.896
    3    HB2  HIS   5           HB2      HIS   5 -26.228   6.134 -13.823
    4    HB3  HIS   5           HB3      HIS   5 -24.736   5.203 -13.710
    5    HD1  HIS   5           HD1      HIS   5 -23.223   6.353 -15.295
    6    HD2  HIS   5           HD2      HIS   5 -26.955   5.611 -16.959
    7    HE1  HIS   5           HE1      HIS   5 -22.971   6.828 -17.761
    8    HE2  HIS   5           HE2      HIS   5 -25.248   6.365 -18.743

  No H/Q in entry =           8
  In of MODEL   76
    1    H    ILE   6           H        ILE   6 -25.694   1.822 -13.503
    2    HA   ILE   6           HA       ILE   6 -26.775   2.197 -10.792
    3    HB   ILE   6           HB       ILE   6 -25.863  -0.322 -12.187
    4   HG12  ILE   6          HG12      ILE   6 -28.647   0.613 -11.480
    5   HG13  ILE   6          HG13      ILE   6 -27.947   0.712 -13.095
    6   HG23  ILE   6          HG21      ILE   6 -26.290  -1.497 -10.288
    7   HG22  ILE   6          HG22      ILE   6 -27.486  -0.339  -9.703
    8   HG21  ILE   6          HG23      ILE   6 -25.765   0.025  -9.566
    9   HD13  ILE   6          HD11      ILE   6 -28.361  -1.433 -13.518
   10   HD12  ILE   6          HD12      ILE   6 -29.431  -1.367 -12.116
   11   HD11  ILE   6          HD13      ILE   6 -27.774  -1.948 -11.936

  No H/Q in entry =          11
  In of MODEL   76
    1    H    TYR   7           H        TYR   7 -25.073   2.918  -9.470
    2    HA   TYR   7           HA       TYR   7 -22.327   1.968 -10.007
    3    HB2  TYR   7           HB2      TYR   7 -23.374   4.451  -8.672
    4    HB3  TYR   7           HB3      TYR   7 -21.682   3.958  -8.625
    5    HD1  TYR   7           HD1      TYR   7 -22.596   2.868 -11.707
    6    HD2  TYR   7           HD2      TYR   7 -22.050   6.543  -9.617
    7    HE1  TYR   7           HE1      TYR   7 -22.100   4.010 -13.833
    8    HE2  TYR   7           HE2      TYR   7 -21.598   7.690 -11.737
    9    HH   TYR   7           HH       TYR   7 -21.732   7.503 -13.970

  No H/Q in entry =           9
  In of MODEL   76
    1    H    LEU   8           H        LEU   8 -21.397   0.688  -8.586
    2    HA   LEU   8           HA       LEU   8 -22.620   0.296  -5.926
    3    HB2  LEU   8           HB2      LEU   8 -20.831  -1.423  -7.621
    4    HB3  LEU   8           HB3      LEU   8 -21.076  -1.732  -5.902
    5    HG   LEU   8           HG       LEU   8 -23.537  -1.955  -6.407
    6   HD13  LEU   8          HD11      LEU   8 -23.602  -0.834  -8.572
    7   HD12  LEU   8          HD12      LEU   8 -24.104  -2.513  -8.758
    8   HD11  LEU   8          HD13      LEU   8 -22.483  -2.018  -9.245
    9   HD23  LEU   8          HD21      LEU   8 -22.176  -4.051  -7.961
   10   HD22  LEU   8          HD22      LEU   8 -23.312  -4.172  -6.618
   11   HD21  LEU   8          HD23      LEU   8 -21.621  -3.786  -6.310

  No H/Q in entry =          11
  In of MODEL   76
    1    H    PHE   9           H        PHE   9 -21.424   0.802  -4.114
    2    HA   PHE   9           HA       PHE   9 -18.633   1.751  -4.561
    3    HB2  PHE   9           HB2      PHE   9 -20.760   2.875  -2.747
    4    HB3  PHE   9           HB3      PHE   9 -19.058   3.292  -2.613
    5    HD1  PHE   9           HD1      PHE   9 -17.916   4.523  -4.402
    6    HD2  PHE   9           HD2      PHE   9 -22.116   3.675  -4.610
    7    HE1  PHE   9           HE1      PHE   9 -18.157   6.168  -6.236
    8    HE2  PHE   9           HE2      PHE   9 -22.359   5.333  -6.440
    9    HZ   PHE   9           HZ       PHE   9 -20.377   6.575  -7.260

  No H/Q in entry =           9
  In of MODEL   76
    1    H    SER  10           H        SER  10 -17.073   0.847  -3.368
    2    HA   SER  10           HA       SER  10 -17.366   0.051  -0.650
    3    HB2  SER  10           HB2      SER  10 -18.531  -1.865  -1.672
    4    HB3  SER  10           HB3      SER  10 -17.140  -2.148  -2.707
    5    HG   SER  10           HG       SER  10 -16.113  -3.012  -1.094

  No H/Q in entry =           5
  In of MODEL   76
    1    H    SER  11           H        SER  11 -15.382   0.196   0.251
    2    HA   SER  11           HA       SER  11 -13.154   1.020  -1.244
    3    HB2  SER  11           HB2      SER  11 -12.075   1.233   0.772
    4    HB3  SER  11           HB3      SER  11 -13.756   1.216   1.309
    5    HG   SER  11           HG       SER  11 -11.749  -0.586   1.735

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ALA  12           H        ALA  12 -14.292  -1.705  -1.977
    2    HA   ALA  12           HA       ALA  12 -11.690  -2.955  -2.361
    3    HB1  ALA  12           HB1      ALA  12 -13.948  -4.330  -0.903
    4    HB3  ALA  12           HB2      ALA  12 -12.291  -4.085  -0.350
    5    HB2  ALA  12           HB3      ALA  12 -12.621  -5.210  -1.668

  No H/Q in entry =           5
  In of MODEL   76
    1    H    GLY  13           H        GLY  13 -12.398  -2.021  -4.461
    2    HA3  GLY  13           HA2      GLY  13 -14.577  -2.805  -5.977
    3    HA2  GLY  13           HA3      GLY  13 -13.006  -2.368  -6.664

  No H/Q in entry =           3
  In of MODEL   76
    1    H    MET  14           H        MET  14 -11.509  -4.592  -5.586
    2    HA   MET  14           HA       MET  14 -11.830  -6.437  -7.637
    3    HB2  MET  14           HB2      MET  14  -9.787  -6.413  -6.295
    4    HB3  MET  14           HB3      MET  14 -10.659  -7.045  -4.899
    5    HG2  MET  14           HG2      MET  14 -11.179  -9.105  -6.177
    6    HG3  MET  14           HG3      MET  14 -10.298  -8.463  -7.564
    7    HE3  MET  14           HE1      MET  14  -6.805  -8.510  -6.950
    8    HE2  MET  14           HE2      MET  14  -7.446  -7.132  -6.058
    9    HE1  MET  14           HE3      MET  14  -8.199  -7.616  -7.575

  No H/Q in entry =           9
  In of MODEL   76
    1    H    SER  15           H        SER  15 -13.150  -6.764  -4.341
    2    HA   SER  15           HA       SER  15 -14.420  -9.280  -4.983
    3    HB2  SER  15           HB2      SER  15 -14.775  -7.438  -2.612
    4    HB3  SER  15           HB3      SER  15 -15.744  -8.890  -2.850
    5    HG   SER  15           HG       SER  15 -12.900  -8.885  -2.917

  No H/Q in entry =           5
  In of MODEL   76
    1    H    THR  16           H        THR  16 -15.557  -5.903  -4.744
    2    HA   THR  16           HA       THR  16 -18.326  -6.454  -5.335
    3    HB   THR  16           HB       THR  16 -16.774  -3.904  -5.900
    4    HG1  THR  16           HG1      THR  16 -16.404  -4.370  -3.788
    5   HG21  THR  16          HG21      THR  16 -19.681  -4.484  -5.280
    6   HG23  THR  16          HG22      THR  16 -19.030  -3.958  -6.843
    7   HG22  THR  16          HG23      THR  16 -18.989  -2.876  -5.444

  No H/Q in entry =           7
  In of MODEL   76
    1    H    SER  17           H        SER  17 -15.445  -5.935  -7.115
    2    HA   SER  17           HA       SER  17 -16.485  -5.322  -9.687
    3    HB2  SER  17           HB2      SER  17 -13.869  -6.572  -8.826
    4    HB3  SER  17           HB3      SER  17 -14.252  -6.218 -10.511
    5    HG   SER  17           HG       SER  17 -13.164  -4.595  -8.866

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LEU  18           H        LEU  18 -15.934  -8.391  -8.080
    2    HA   LEU  18           HA       LEU  18 -16.411 -10.001 -10.387
    3    HB2  LEU  18           HB2      LEU  18 -15.254 -10.866  -8.404
    4    HB3  LEU  18           HB3      LEU  18 -16.716 -10.637  -7.447
    5    HG   LEU  18           HG       LEU  18 -17.884 -12.253  -8.939
    6   HD12  LEU  18          HD11      LEU  18 -16.183 -13.749 -10.231
    7   HD11  LEU  18          HD12      LEU  18 -15.145 -12.324 -10.167
    8   HD13  LEU  18          HD13      LEU  18 -16.716 -12.236 -10.962
    9   HD22  LEU  18          HD21      LEU  18 -17.029 -12.978  -6.830
   10   HD21  LEU  18          HD22      LEU  18 -15.420 -13.212  -7.517
   11   HD23  LEU  18          HD23      LEU  18 -16.757 -14.240  -8.033

  No H/Q in entry =          11
  In of MODEL   76
    1    H    LEU  19           H        LEU  19 -18.497  -8.704  -7.809
    2    HA   LEU  19           HA       LEU  19 -20.911  -9.957  -8.681
    3    HB2  LEU  19           HB2      LEU  19 -20.699  -8.999  -6.454
    4    HB3  LEU  19           HB3      LEU  19 -20.487  -7.394  -7.151
    5    HG   LEU  19           HG       LEU  19 -22.789  -7.329  -7.846
    6   HD11  LEU  19          HD11      LEU  19 -22.696 -10.217  -7.123
    7   HD13  LEU  19          HD12      LEU  19 -23.507  -9.419  -8.470
    8   HD12  LEU  19          HD13      LEU  19 -24.203  -9.343  -6.852
    9   HD22  LEU  19          HD21      LEU  19 -22.673  -6.486  -5.729
   10   HD21  LEU  19          HD22      LEU  19 -22.125  -8.010  -5.030
   11   HD23  LEU  19          HD23      LEU  19 -23.819  -7.803  -5.476

  No H/Q in entry =          11
  In of MODEL   76
    1    H    VAL  20           H        VAL  20 -19.430  -6.809  -9.458
    2    HA   VAL  20           HA       VAL  20 -21.493  -5.868 -11.150
    3    HB   VAL  20           HB       VAL  20 -18.509  -5.240 -11.183
    4   HG13  VAL  20          HG11      VAL  20 -19.285  -4.756 -13.401
    5   HG12  VAL  20          HG12      VAL  20 -19.219  -3.220 -12.537
    6   HG11  VAL  20          HG13      VAL  20 -20.768  -4.026 -12.788
    7   HG21  VAL  20          HG21      VAL  20 -20.921  -3.886 -10.023
    8   HG23  VAL  20          HG22      VAL  20 -19.404  -3.033 -10.300
    9   HG22  VAL  20          HG23      VAL  20 -19.451  -4.413  -9.204

  No H/Q in entry =           9
  In of MODEL   76
    1    H    SER  21           H        SER  21 -18.672  -7.922 -11.980
    2    HA   SER  21           HA       SER  21 -19.351  -7.943 -14.761
    3    HB2  SER  21           HB2      SER  21 -17.877  -9.898 -14.954
    4    HB3  SER  21           HB3      SER  21 -17.102  -8.605 -14.043
    5    HG   SER  21           HG       SER  21 -17.223  -9.742 -12.262

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LYS  22           H        LYS  22 -20.487 -10.028 -12.137
    2    HA   LYS  22           HA       LYS  22 -21.935 -11.748 -13.942
    3    HB2  LYS  22           HB2      LYS  22 -21.230 -12.189 -11.469
    4    HB3  LYS  22           HB3      LYS  22 -22.728 -11.343 -11.084
    5    HG2  LYS  22           HG2      LYS  22 -24.048 -13.001 -12.149
    6    HG3  LYS  22           HG3      LYS  22 -22.631 -13.750 -12.884
    7    HD2  LYS  22           HD2      LYS  22 -22.390 -13.646 -10.001
    8    HD3  LYS  22           HD3      LYS  22 -23.864 -14.482 -10.495
    9    HE2  LYS  22           HE2      LYS  22 -22.443 -15.883 -12.033
   10    HE3  LYS  22           HE3      LYS  22 -21.023 -15.147 -11.288
   11    HZ2  LYS  22           HZ1      LYS  22 -23.003 -16.968 -10.073
   12    HZ1  LYS  22           HZ2      LYS  22 -21.982 -16.000  -9.121
   13    HZ3  LYS  22           HZ3      LYS  22 -21.317 -17.148 -10.180

  No H/Q in entry =          13
  In of MODEL   76
    1    H    MET  23           H        MET  23 -22.764  -8.756 -12.233
    2    HA   MET  23           HA       MET  23 -25.549  -8.893 -12.842
    3    HB2  MET  23           HB2      MET  23 -23.751  -6.539 -12.303
    4    HB3  MET  23           HB3      MET  23 -25.490  -6.400 -12.554
    5    HG2  MET  23           HG2      MET  23 -25.943  -7.621 -10.546
    6    HG3  MET  23           HG3      MET  23 -24.234  -8.005 -10.337
    7    HE2  MET  23           HE1      MET  23 -26.617  -4.334  -9.399
    8    HE1  MET  23           HE2      MET  23 -26.804  -5.368 -10.813
    9    HE3  MET  23           HE3      MET  23 -25.784  -3.932 -10.901

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ARG  24           H        ARG  24 -22.744  -7.509 -14.582
    2    HA   ARG  24           HA       ARG  24 -24.177  -6.317 -16.692
    3    HB2  ARG  24           HB2      ARG  24 -21.757  -5.871 -16.236
    4    HB3  ARG  24           HB3      ARG  24 -21.379  -7.488 -16.774
    5    HG2  ARG  24           HG2      ARG  24 -22.162  -6.941 -19.075
    6    HG3  ARG  24           HG3      ARG  24 -22.562  -5.294 -18.518
    7    HD2  ARG  24           HD2      ARG  24 -19.804  -6.592 -18.332
    8    HD3  ARG  24           HD3      ARG  24 -20.302  -5.451 -19.574
    9    HE   ARG  24           HE       ARG  24 -20.752  -3.997 -17.418
   10   HH21  ARG  24          HH11      ARG  24 -19.377  -2.229 -17.598
   11   HH22  ARG  24          HH12      ARG  24 -17.669  -2.478 -17.693
   12   HH11  ARG  24          HH21      ARG  24 -18.088  -5.968 -18.105
   13   HH12  ARG  24          HH22      ARG  24 -16.915  -4.694 -17.983

  No H/Q in entry =          13
  In of MODEL   76
    1    H    ALA  25           H        ALA  25 -23.033  -9.626 -16.227
    2    HA   ALA  25           HA       ALA  25 -23.551 -10.578 -18.847
    3    HB1  ALA  25           HB1      ALA  25 -22.862 -12.570 -18.037
    4    HB3  ALA  25           HB2      ALA  25 -23.973 -12.501 -16.670
    5    HB2  ALA  25           HB3      ALA  25 -22.429 -11.654 -16.595

  No H/Q in entry =           5
  In of MODEL   76
    1    H    GLN  26           H        GLN  26 -25.492 -10.507 -15.897
    2    HA   GLN  26           HA       GLN  26 -27.783 -11.779 -16.949
    3    HB2  GLN  26           HB2      GLN  26 -27.380  -9.925 -14.623
    4    HB3  GLN  26           HB3      GLN  26 -28.921 -10.680 -15.001
    5    HG2  GLN  26           HG2      GLN  26 -26.341 -12.087 -14.370
    6    HG3  GLN  26           HG3      GLN  26 -27.745 -11.951 -13.319
    7   HE21  GLN  26          HE21      GLN  26 -26.458 -14.155 -14.453
    8   HE22  GLN  26          HE22      GLN  26 -27.459 -15.247 -15.242

  No H/Q in entry =           8
  In of MODEL   76
    1    H    ALA  27           H        ALA  27 -26.898  -8.358 -16.670
    2    HA   ALA  27           HA       ALA  27 -29.365  -7.328 -17.595
    3    HB1  ALA  27           HB1      ALA  27 -27.613  -5.946 -16.470
    4    HB3  ALA  27           HB2      ALA  27 -28.152  -5.251 -17.999
    5    HB2  ALA  27           HB3      ALA  27 -26.610  -6.099 -17.913

  No H/Q in entry =           5
  In of MODEL   76
    1    H    GLU  28           H        GLU  28 -26.582  -8.599 -19.305
    2    HA   GLU  28           HA       GLU  28 -27.429  -7.678 -21.901
    3    HB2  GLU  28           HB2      GLU  28 -25.069  -8.307 -21.157
    4    HB3  GLU  28           HB3      GLU  28 -25.591  -9.984 -21.308
    5    HG2  GLU  28           HG2      GLU  28 -24.376  -9.280 -23.263
    6    HG3  GLU  28           HG3      GLU  28 -26.056  -9.637 -23.662

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LYS  29           H        LYS  29 -27.630 -10.712 -20.120
    2    HA   LYS  29           HA       LYS  29 -28.840 -12.281 -22.109
    3    HB2  LYS  29           HB2      LYS  29 -27.860 -13.167 -20.026
    4    HB3  LYS  29           HB3      LYS  29 -29.175 -12.432 -19.111
    5    HG2  LYS  29           HG2      LYS  29 -30.781 -13.867 -20.182
    6    HG3  LYS  29           HG3      LYS  29 -29.533 -14.536 -21.231
    7    HD2  LYS  29           HD2      LYS  29 -28.448 -15.615 -19.407
    8    HD3  LYS  29           HD3      LYS  29 -29.410 -14.732 -18.225
    9    HE2  LYS  29           HE2      LYS  29 -30.126 -17.103 -18.515
   10    HE3  LYS  29           HE3      LYS  29 -31.405 -15.935 -18.858
   11    HZ1  LYS  29           HZ1      LYS  29 -30.745 -16.165 -21.255
   12    HZ3  LYS  29           HZ2      LYS  29 -31.478 -17.532 -20.559
   13    HZ2  LYS  29           HZ3      LYS  29 -29.797 -17.497 -20.793

  No H/Q in entry =          13
  In of MODEL   76
    1    H    TYR  30           H        TYR  30 -30.347 -10.087 -19.751
    2    HA   TYR  30           HA       TYR  30 -32.956 -10.618 -21.074
    3    HB2  TYR  30           HB2      TYR  30 -32.420  -9.344 -18.381
    4    HB3  TYR  30           HB3      TYR  30 -34.009  -9.646 -19.085
    5    HD1  TYR  30           HD1      TYR  30 -34.888 -11.955 -19.235
    6    HD2  TYR  30           HD2      TYR  30 -31.129 -11.120 -17.418
    7    HE1  TYR  30           HE1      TYR  30 -34.808 -14.246 -18.338
    8    HE2  TYR  30           HE2      TYR  30 -31.049 -13.397 -16.524
    9    HH   TYR  30           HH       TYR  30 -32.623 -15.819 -17.578

  No H/Q in entry =           9
  In of MODEL   76
    1    H    GLU  31           H        GLU  31 -30.780  -8.637 -21.875
    2    HA   GLU  31           HA       GLU  31 -30.695  -6.516 -22.784
    3    HB2  GLU  31           HB2      GLU  31 -33.562  -7.285 -23.376
    4    HB3  GLU  31           HB3      GLU  31 -32.706  -5.940 -24.131
    5    HG2  GLU  31           HG2      GLU  31 -31.175  -7.410 -25.203
    6    HG3  GLU  31           HG3      GLU  31 -31.760  -8.792 -24.278

  No H/Q in entry =           6
  In of MODEL   76
    1    H    VAL  32           H        VAL  32 -31.002  -6.302 -20.069
    2    HA   VAL  32           HA       VAL  32 -32.910  -4.186 -19.572
    3    HB   VAL  32           HB       VAL  32 -30.570  -5.084 -17.860
    4   HG12  VAL  32          HG11      VAL  32 -32.186  -4.199 -16.061
    5   HG11  VAL  32          HG12      VAL  32 -32.979  -3.359 -17.394
    6   HG13  VAL  32          HG13      VAL  32 -31.289  -3.022 -17.021
    7   HG21  VAL  32          HG21      VAL  32 -32.292  -6.852 -18.542
    8   HG23  VAL  32          HG22      VAL  32 -33.385  -5.989 -17.458
    9   HG22  VAL  32          HG23      VAL  32 -31.883  -6.672 -16.836

  No H/Q in entry =           9
  In of MODEL   76
    1    HA   PRO  33           HA       PRO  33 -29.846  -1.293 -21.251
    2    HB2  PRO  33           HB2      PRO  33 -31.385   0.914 -21.279
    3    HB3  PRO  33           HB3      PRO  33 -31.796  -0.439 -22.334
    4    HG2  PRO  33           HG2      PRO  33 -32.879   0.183 -19.585
    5    HG3  PRO  33           HG3      PRO  33 -33.784  -0.099 -21.072
    6    HD2  PRO  33           HD2      PRO  33 -33.370  -2.094 -19.304
    7    HD3  PRO  33           HD3      PRO  33 -33.361  -2.409 -21.039

  No H/Q in entry =           7
  In of MODEL   76
    1    H    VAL  34           H        VAL  34 -28.653  -1.739 -19.233
    2    HA   VAL  34           HA       VAL  34 -28.460   0.756 -17.681
    3    HB   VAL  34           HB       VAL  34 -27.938  -0.616 -15.661
    4   HG12  VAL  34          HG11      VAL  34 -30.350  -1.506 -15.410
    5   HG11  VAL  34          HG12      VAL  34 -30.615  -0.816 -17.010
    6   HG13  VAL  34          HG13      VAL  34 -30.126   0.223 -15.671
    7   HG21  VAL  34          HG21      VAL  34 -28.022  -2.726 -17.588
    8   HG23  VAL  34          HG22      VAL  34 -29.128  -3.044 -16.250
    9   HG22  VAL  34          HG23      VAL  34 -27.425  -2.723 -15.929

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ILE  35           H        ILE  35 -26.523   1.252 -16.784
    2    HA   ILE  35           HA       ILE  35 -24.155  -0.098 -17.901
    3    HB   ILE  35           HB       ILE  35 -24.620   2.817 -17.229
    4   HG12  ILE  35          HG12      ILE  35 -23.525   1.418 -19.677
    5   HG13  ILE  35          HG13      ILE  35 -25.172   2.028 -19.506
    6   HG21  ILE  35          HG21      ILE  35 -22.031   1.307 -17.375
    7   HG23  ILE  35          HG22      ILE  35 -22.546   2.531 -16.215
    8   HG22  ILE  35          HG23      ILE  35 -22.107   3.001 -17.857
    9   HD11  ILE  35          HD11      ILE  35 -23.820   4.264 -18.945
   10   HD13  ILE  35          HD12      ILE  35 -24.289   3.806 -20.583
   11   HD12  ILE  35          HD13      ILE  35 -22.654   3.479 -20.010

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ILE  36           H        ILE  36 -22.976  -1.038 -16.215
    2    HA   ILE  36           HA       ILE  36 -23.534  -0.310 -13.392
    3    HB   ILE  36           HB       ILE  36 -22.633  -3.045 -14.353
    4   HG12  ILE  36          HG12      ILE  36 -25.476  -2.246 -13.731
    5   HG13  ILE  36          HG13      ILE  36 -24.842  -2.288 -15.376
    6   HG23  ILE  36          HG21      ILE  36 -23.055  -3.789 -12.221
    7   HG22  ILE  36          HG22      ILE  36 -24.214  -2.505 -11.880
    8   HG21  ILE  36          HG23      ILE  36 -22.485  -2.153 -11.898
    9   HD13  ILE  36          HD11      ILE  36 -24.973  -4.510 -15.494
   10   HD12  ILE  36          HD12      ILE  36 -26.092  -4.345 -14.143
   11   HD11  ILE  36          HD13      ILE  36 -24.399  -4.732 -13.841

  No H/Q in entry =          11
  In of MODEL   76
    1    H    GLU  37           H        GLU  37 -21.805   0.389 -12.248
    2    HA   GLU  37           HA       GLU  37 -19.072  -0.408 -13.027
    3    HB2  GLU  37           HB2      GLU  37 -20.048   2.393 -12.506
    4    HB3  GLU  37           HB3      GLU  37 -18.345   1.933 -12.498
    5    HG2  GLU  37           HG2      GLU  37 -18.416   1.415 -14.830
    6    HG3  GLU  37           HG3      GLU  37 -20.159   1.674 -14.876

  No H/Q in entry =           6
  In of MODEL   76
    1    H    ALA  38           H        ALA  38 -17.647  -0.555 -11.281
    2    HA   ALA  38           HA       ALA  38 -18.787  -0.276  -8.560
    3    HB1  ALA  38           HB1      ALA  38 -16.995  -2.248  -9.838
    4    HB3  ALA  38           HB2      ALA  38 -18.095  -2.440  -8.472
    5    HB2  ALA  38           HB3      ALA  38 -16.501  -1.726  -8.227

  No H/Q in entry =           5
  In of MODEL   76
    1    H    PHE  39           H        PHE  39 -17.620   1.012  -7.094
    2    HA   PHE  39           HA       PHE  39 -15.078   2.212  -7.944
    3    HB2  PHE  39           HB2      PHE  39 -17.261   3.874  -6.707
    4    HB3  PHE  39           HB3      PHE  39 -15.750   4.421  -7.431
    5    HD1  PHE  39           HD1      PHE  39 -15.615   4.962  -9.693
    6    HD2  PHE  39           HD2      PHE  39 -19.037   2.909  -8.190
    7    HE1  PHE  39           HE1      PHE  39 -16.772   5.336 -11.851
    8    HE2  PHE  39           HE2      PHE  39 -20.202   3.269 -10.336
    9    HZ   PHE  39           HZ       PHE  39 -19.066   4.455 -12.184

  No H/Q in entry =           9
  In of MODEL   76
    1    HA   PRO  40           HA       PRO  40 -14.295   1.652  -3.596
    2    HB2  PRO  40           HB2      PRO  40 -12.581   3.717  -3.009
    3    HB3  PRO  40           HB3      PRO  40 -12.078   2.350  -4.003
    4    HG2  PRO  40           HG2      PRO  40 -13.113   5.035  -4.902
    5    HG3  PRO  40           HG3      PRO  40 -11.651   4.194  -5.416
    6    HD2  PRO  40           HD2      PRO  40 -13.816   4.011  -6.904
    7    HD3  PRO  40           HD3      PRO  40 -12.849   2.566  -6.616

  No H/Q in entry =           7
  In of MODEL   76
    1    H    GLU  41           H        GLU  41 -15.011   2.708  -1.535
    2    HA   GLU  41           HA       GLU  41 -17.279   4.375  -1.675
    3    HB2  GLU  41           HB2      GLU  41 -17.346   4.247   0.642
    4    HB3  GLU  41           HB3      GLU  41 -16.488   2.769   0.201
    5    HG2  GLU  41           HG2      GLU  41 -15.236   5.319   1.222
    6    HG3  GLU  41           HG3      GLU  41 -15.484   3.838   2.147

  No H/Q in entry =           6
  In of MODEL   76
    1    H    THR  42           H        THR  42 -13.962   5.342  -1.639
    2    HA   THR  42           HA       THR  42 -14.398   7.946  -0.551
    3    HB   THR  42           HB       THR  42 -12.211   8.507  -1.608
    4    HG1  THR  42           HG1      THR  42 -11.799   7.390  -3.339
    5   HG23  THR  42          HG21      THR  42 -12.258   7.392   0.583
    6   HG22  THR  42          HG22      THR  42 -10.876   6.845  -0.367
    7   HG21  THR  42          HG23      THR  42 -12.301   5.819  -0.215

  No H/Q in entry =           7
  In of MODEL   76
    1    H    LEU  43           H        LEU  43 -15.167   6.708  -3.635
    2    HA   LEU  43           HA       LEU  43 -15.423   9.433  -4.730
    3    HB2  LEU  43           HB2      LEU  43 -15.692   6.724  -6.022
    4    HB3  LEU  43           HB3      LEU  43 -15.900   8.265  -6.852
    5    HG   LEU  43           HG       LEU  43 -13.317   7.219  -5.717
    6   HD13  LEU  43          HD11      LEU  43 -12.667   6.751  -7.928
    7   HD12  LEU  43          HD12      LEU  43 -14.024   7.647  -8.606
    8   HD11  LEU  43          HD13      LEU  43 -14.303   6.104  -7.799
    9   HD21  LEU  43          HD21      LEU  43 -14.098   9.762  -7.127
   10   HD23  LEU  43          HD22      LEU  43 -12.439   9.161  -7.148
   11   HD22  LEU  43          HD23      LEU  43 -13.210   9.569  -5.615

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ALA  44           H        ALA  44 -17.412   7.655  -2.877
    2    HA   ALA  44           HA       ALA  44 -19.835   7.419  -4.284
    3    HB2  ALA  44           HB1      ALA  44 -19.760   6.393  -2.139
    4    HB3  ALA  44           HB2      ALA  44 -20.897   7.730  -1.965
    5    HB1  ALA  44           HB3      ALA  44 -19.251   7.889  -1.356

  No H/Q in entry =           5
  In of MODEL   76
    1    H    GLY  45           H        GLY  45 -18.516  10.303  -2.820
    2    HA3  GLY  45           HA2      GLY  45 -20.960  11.746  -3.335
    3    HA2  GLY  45           HA3      GLY  45 -19.448  12.420  -2.728

  No H/Q in entry =           3
  In of MODEL   76
    1    H    GLU  46           H        GLU  46 -17.816  11.414  -4.917
    2    HA   GLU  46           HA       GLU  46 -18.417  13.542  -6.802
    3    HB2  GLU  46           HB2      GLU  46 -16.193  11.502  -6.648
    4    HB3  GLU  46           HB3      GLU  46 -16.299  12.760  -7.879
    5    HG2  GLU  46           HG2      GLU  46 -16.085  14.476  -6.191
    6    HG3  GLU  46           HG3      GLU  46 -16.080  13.258  -4.917

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LYS  47           H        LYS  47 -18.229  10.011  -7.082
    2    HA   LYS  47           HA       LYS  47 -19.227  10.100  -9.804
    3    HB2  LYS  47           HB2      LYS  47 -18.600   7.839  -7.905
    4    HB3  LYS  47           HB3      LYS  47 -19.254   7.591  -9.523
    5    HG2  LYS  47           HG2      LYS  47 -16.631   8.902  -8.864
    6    HG3  LYS  47           HG3      LYS  47 -16.848   7.263  -9.475
    7    HD2  LYS  47           HD2      LYS  47 -17.473   9.854 -10.869
    8    HD3  LYS  47           HD3      LYS  47 -16.297   8.628 -11.339
    9    HE2  LYS  47           HE2      LYS  47 -18.345   7.059 -11.480
   10    HE3  LYS  47           HE3      LYS  47 -19.282   8.551 -11.521
   11    HZ2  LYS  47           HZ1      LYS  47 -17.504   7.415 -13.510
   12    HZ1  LYS  47           HZ2      LYS  47 -17.430   9.102 -13.324
   13    HZ3  LYS  47           HZ3      LYS  47 -18.907   8.353 -13.707

  No H/Q in entry =          13
  In of MODEL   76
    1    H    GLY  48           H        GLY  48 -20.659   9.454  -6.678
    2    HA3  GLY  48           HA2      GLY  48 -22.995   8.200  -7.457
    3    HA2  GLY  48           HA3      GLY  48 -22.840   9.257  -6.054

  No H/Q in entry =           3
  In of MODEL   76
    1    H    GLN  49           H        GLN  49 -22.234  11.621  -7.704
    2    HA   GLN  49           HA       GLN  49 -24.801  12.683  -7.992
    3    HB2  GLN  49           HB2      GLN  49 -22.221  13.531  -9.291
    4    HB3  GLN  49           HB3      GLN  49 -23.699  14.474  -9.304
    5    HG2  GLN  49           HG2      GLN  49 -23.634  14.604  -6.865
    6    HG3  GLN  49           HG3      GLN  49 -22.168  13.639  -6.851
    7   HE21  GLN  49          HE21      GLN  49 -22.133  15.920  -5.672
    8   HE22  GLN  49          HE22      GLN  49 -21.204  17.163  -6.337

  No H/Q in entry =           8
  In of MODEL   76
    1    H    ASN  50           H        ASN  50 -23.004  10.732 -10.232
    2    HA   ASN  50           HA       ASN  50 -24.819  11.486 -12.419
    3    HB2  ASN  50           HB2      ASN  50 -22.210   9.979 -12.489
    4    HB3  ASN  50           HB3      ASN  50 -23.214  10.330 -13.889
    5   HD21  ASN  50          HD21      ASN  50 -20.654  11.286 -12.217
    6   HD22  ASN  50          HD22      ASN  50 -20.431  12.909 -12.620

  No H/Q in entry =           6
  In of MODEL   76
    1    H    ALA  51           H        ALA  51 -24.857   9.226 -10.076
    2    HA   ALA  51           HA       ALA  51 -25.539   6.994 -11.837
    3    HB2  ALA  51           HB1      ALA  51 -25.001   5.727 -10.073
    4    HB3  ALA  51           HB2      ALA  51 -26.176   6.562  -9.060
    5    HB1  ALA  51           HB3      ALA  51 -24.541   7.201  -9.221

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ASP  52           H        ASP  52 -27.533   5.914 -11.728
    2    HA   ASP  52           HA       ASP  52 -29.764   7.739 -11.225
    3    HB2  ASP  52           HB2      ASP  52 -29.474   5.169 -12.778
    4    HB3  ASP  52           HB3      ASP  52 -31.045   5.895 -12.434

  No H/Q in entry =           4
  In of MODEL   76
    1    H    VAL  53           H        VAL  53 -28.164   4.921 -10.026
    2    HA   VAL  53           HA       VAL  53 -29.700   5.132  -7.574
    3    HB   VAL  53           HB       VAL  53 -31.028   3.417  -8.799
    4   HG11  VAL  53          HG11      VAL  53 -29.213   2.522 -10.216
    5   HG13  VAL  53          HG12      VAL  53 -30.061   1.251  -9.334
    6   HG12  VAL  53          HG13      VAL  53 -28.478   1.799  -8.785
    7   HG23  VAL  53          HG21      VAL  53 -30.246   1.526  -6.993
    8   HG22  VAL  53          HG22      VAL  53 -31.406   2.828  -6.726
    9   HG21  VAL  53          HG23      VAL  53 -29.717   3.043  -6.262

  No H/Q in entry =           9
  In of MODEL   76
    1    H    VAL  54           H        VAL  54 -28.447   4.789  -5.853
    2    HA   VAL  54           HA       VAL  54 -25.654   3.955  -6.324
    3    HB   VAL  54           HB       VAL  54 -26.833   5.811  -4.194
    4   HG11  VAL  54          HG11      VAL  54 -24.226   4.419  -4.326
    5   HG13  VAL  54          HG12      VAL  54 -25.044   5.147  -2.945
    6   HG12  VAL  54          HG13      VAL  54 -24.110   6.157  -4.048
    7   HG22  VAL  54          HG21      VAL  54 -25.956   7.590  -5.336
    8   HG21  VAL  54          HG22      VAL  54 -26.439   6.535  -6.665
    9   HG23  VAL  54          HG23      VAL  54 -24.750   6.604  -6.164

  No H/Q in entry =           9
  In of MODEL   76
    1    H    LEU  55           H        LEU  55 -25.063   2.072  -5.577
    2    HA   LEU  55           HA       LEU  55 -26.635   0.831  -3.407
    3    HB2  LEU  55           HB2      LEU  55 -24.977  -0.409  -5.590
    4    HB3  LEU  55           HB3      LEU  55 -25.775  -1.300  -4.292
    5    HG   LEU  55           HG       LEU  55 -27.149   0.176  -6.528
    6   HD13  LEU  55          HD11      LEU  55 -26.779  -1.721  -7.655
    7   HD12  LEU  55          HD12      LEU  55 -27.770  -2.559  -6.461
    8   HD11  LEU  55          HD13      LEU  55 -26.023  -2.462  -6.247
    9   HD23  LEU  55          HD21      LEU  55 -28.489  -1.709  -4.641
   10   HD22  LEU  55          HD22      LEU  55 -29.169  -0.373  -5.573
   11   HD21  LEU  55          HD23      LEU  55 -28.207  -0.043  -4.133

  No H/Q in entry =          11
  In of MODEL   76
    1    H    LEU  56           H        LEU  56 -25.547   0.331  -1.535
    2    HA   LEU  56           HA       LEU  56 -22.618   0.766  -1.491
    3    HB2  LEU  56           HB2      LEU  56 -24.508   0.630   0.845
    4    HB3  LEU  56           HB3      LEU  56 -22.805   1.083   0.880
    5    HG   LEU  56           HG       LEU  56 -25.087   2.687  -0.242
    6   HD11  LEU  56          HD11      LEU  56 -24.064   2.427   2.333
    7   HD13  LEU  56          HD12      LEU  56 -25.051   3.760   1.733
    8   HD12  LEU  56          HD13      LEU  56 -23.294   3.886   1.707
    9   HD23  LEU  56          HD21      LEU  56 -23.157   4.403  -0.433
   10   HD22  LEU  56          HD22      LEU  56 -23.475   3.246  -1.726
   11   HD21  LEU  56          HD23      LEU  56 -22.160   2.958  -0.588

  No H/Q in entry =          11
  In of MODEL   76
    1    H    GLY  57           H        GLY  57 -21.238  -0.821  -0.835
    2    HA3  GLY  57           HA2      GLY  57 -22.121  -3.526  -0.952
    3    HA2  GLY  57           HA3      GLY  57 -20.523  -2.990  -0.440

  No H/Q in entry =           3
  In of MODEL   76
    1    HA   PRO  58           HA       PRO  58 -23.458  -3.910   3.207
    2    HB2  PRO  58           HB2      PRO  58 -22.765  -6.476   3.950
    3    HB3  PRO  58           HB3      PRO  58 -24.115  -6.131   2.869
    4    HG2  PRO  58           HG2      PRO  58 -21.349  -7.006   2.225
    5    HG3  PRO  58           HG3      PRO  58 -22.880  -7.515   1.515
    6    HD2  PRO  58           HD2      PRO  58 -21.248  -5.729   0.277
    7    HD3  PRO  58           HD3      PRO  58 -23.004  -5.672   0.105

  No H/Q in entry =           7
  In of MODEL   76
    1    H    GLN  59           H        GLN  59 -20.061  -4.360   2.749
    2    HA   GLN  59           HA       GLN  59 -19.413  -4.250   5.534
    3    HB2  GLN  59           HB2      GLN  59 -17.641  -3.287   3.296
    4    HB3  GLN  59           HB3      GLN  59 -17.162  -3.866   4.879
    5    HG2  GLN  59           HG2      GLN  59 -16.646  -5.652   3.519
    6    HG3  GLN  59           HG3      GLN  59 -18.235  -6.098   4.118
    7   HE21  GLN  59          HE21      GLN  59 -18.956  -7.068   2.571
    8   HE22  GLN  59          HE22      GLN  59 -19.338  -6.870   0.964

  No H/Q in entry =           8
  In of MODEL   76
    1    H    ILE  60           H        ILE  60 -20.292  -1.808   3.186
    2    HA   ILE  60           HA       ILE  60 -19.543   0.245   5.177
    3    HB   ILE  60           HB       ILE  60 -19.742   1.890   3.260
    4   HG12  ILE  60          HG12      ILE  60 -19.406  -0.437   1.411
    5   HG13  ILE  60          HG13      ILE  60 -21.023   0.116   1.844
    6   HG21  ILE  60          HG21      ILE  60 -17.607   1.087   4.112
    7   HG23  ILE  60          HG22      ILE  60 -17.552   1.437   2.384
    8   HG22  ILE  60          HG23      ILE  60 -17.648  -0.233   2.943
    9   HD13  ILE  60          HD11      ILE  60 -20.670   1.351  -0.070
   10   HD12  ILE  60          HD12      ILE  60 -18.931   1.467   0.198
   11   HD11  ILE  60          HD13      ILE  60 -20.036   2.473   1.134

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ALA  61           H        ALA  61 -21.979  -1.369   5.220
    2    HA   ALA  61           HA       ALA  61 -24.206   0.244   4.607
    3    HB1  ALA  61           HB1      ALA  61 -25.454  -1.205   5.948
    4    HB2  ALA  61           HB2      ALA  61 -24.090  -1.533   7.019
    5    HB3  ALA  61           HB3      ALA  61 -24.115  -2.210   5.391

  No H/Q in entry =           5
  In of MODEL   76
    1    H    TYR  62           H        TYR  62 -22.106   0.280   7.489
    2    HA   TYR  62           HA       TYR  62 -23.744   1.985   9.027
    3    HB2  TYR  62           HB2      TYR  62 -21.753   2.494  10.314
    4    HB3  TYR  62           HB3      TYR  62 -21.781   0.773   9.930
    5    HD1  TYR  62           HD1      TYR  62 -20.125  -0.198   8.397
    6    HD2  TYR  62           HD2      TYR  62 -20.030   3.965   9.358
    7    HE1  TYR  62           HE1      TYR  62 -17.875  -0.024   7.402
    8    HE2  TYR  62           HE2      TYR  62 -17.766   4.134   8.365
    9    HH   TYR  62           HH       TYR  62 -16.041   1.285   7.332

  No H/Q in entry =           9
  In of MODEL   76
    1    H    MET  63           H        MET  63 -22.004   2.744   6.200
    2    HA   MET  63           HA       MET  63 -21.897   5.606   6.778
    3    HB2  MET  63           HB2      MET  63 -21.176   3.986   4.335
    4    HB3  MET  63           HB3      MET  63 -21.010   5.738   4.449
    5    HG2  MET  63           HG2      MET  63 -19.370   5.472   6.224
    6    HG3  MET  63           HG3      MET  63 -19.540   3.721   6.123
    7    HE3  MET  63           HE1      MET  63 -16.115   5.020   4.444
    8    HE2  MET  63           HE2      MET  63 -16.662   3.701   5.478
    9    HE1  MET  63           HE3      MET  63 -17.011   5.372   5.924

  No H/Q in entry =           9
  In of MODEL   76
    1    H    LEU  64           H        LEU  64 -24.401   3.678   5.798
    2    HA   LEU  64           HA       LEU  64 -25.546   4.992   3.617
    3    HB2  LEU  64           HB2      LEU  64 -26.425   2.915   4.590
    4    HB3  LEU  64           HB3      LEU  64 -26.948   3.815   6.015
    5    HG   LEU  64           HG       LEU  64 -28.608   4.994   4.671
    6   HD13  LEU  64          HD11      LEU  64 -28.243   5.143   2.443
    7   HD12  LEU  64          HD12      LEU  64 -28.865   3.495   2.343
    8   HD11  LEU  64          HD13      LEU  64 -27.128   3.779   2.456
    9   HD23  LEU  64          HD21      LEU  64 -29.066   2.145   4.026
   10   HD22  LEU  64          HD22      LEU  64 -30.101   3.304   4.858
   11   HD21  LEU  64          HD23      LEU  64 -28.748   2.562   5.710

  No H/Q in entry =          11
  In of MODEL   76
    1    HA   PRO  65           HA       PRO  65 -27.863   8.232   6.146
    2    HB2  PRO  65           HB2      PRO  65 -25.951   8.511   8.465
    3    HB3  PRO  65           HB3      PRO  65 -27.694   8.771   8.434
    4    HG2  PRO  65           HG2      PRO  65 -26.776   6.570   9.491
    5    HG3  PRO  65           HG3      PRO  65 -28.154   6.475   8.395
    6    HD2  PRO  65           HD2      PRO  65 -25.252   5.867   7.828
    7    HD3  PRO  65           HD3      PRO  65 -26.682   4.945   7.364

  No H/Q in entry =           7
  In of MODEL   76
    1    H    GLU  66           H        GLU  66 -24.313   8.223   6.355
    2    HA   GLU  66           HA       GLU  66 -24.028  11.004   5.842
    3    HB2  GLU  66           HB2      GLU  66 -22.169   8.692   5.359
    4    HB3  GLU  66           HB3      GLU  66 -21.728  10.380   5.096
    5    HG2  GLU  66           HG2      GLU  66 -22.034  10.848   7.436
    6    HG3  GLU  66           HG3      GLU  66 -22.551   9.186   7.719

  No H/Q in entry =           6
  In of MODEL   76
    1    H    ILE  67           H        ILE  67 -24.018   8.164   3.707
    2    HA   ILE  67           HA       ILE  67 -23.532   9.779   1.360
    3    HB   ILE  67           HB       ILE  67 -24.409   6.872   1.630
    4   HG12  ILE  67          HG12      ILE  67 -21.757   8.032   0.758
    5   HG13  ILE  67          HG13      ILE  67 -22.112   7.680   2.448
    6   HG21  ILE  67          HG21      ILE  67 -24.285   8.655  -0.669
    7   HG23  ILE  67          HG22      ILE  67 -24.896   7.003  -0.571
    8   HG22  ILE  67          HG23      ILE  67 -23.178   7.294  -0.847
    9   HD12  ILE  67          HD11      ILE  67 -21.585   5.816   0.194
   10   HD11  ILE  67          HD12      ILE  67 -22.643   5.288   1.502
   11   HD13  ILE  67          HD13      ILE  67 -20.988   5.784   1.853

  No H/Q in entry =          11
  In of MODEL   76
    1    H    GLN  68           H        GLN  68 -26.452   8.764   2.928
    2    HA   GLN  68           HA       GLN  68 -28.213   9.592   0.851
    3    HB2  GLN  68           HB2      GLN  68 -28.578   9.357   3.834
    4    HB3  GLN  68           HB3      GLN  68 -29.865   9.896   2.768
    5    HG2  GLN  68           HG2      GLN  68 -29.826   7.813   1.580
    6    HG3  GLN  68           HG3      GLN  68 -28.404   7.286   2.459
    7   HE21  GLN  68          HE21      GLN  68 -30.564   5.902   2.301
    8   HE22  GLN  68          HE22      GLN  68 -31.442   5.498   3.703

  No H/Q in entry =           8
  In of MODEL   76
    1    H    ARG  69           H        ARG  69 -26.725  11.387   3.572
    2    HA   ARG  69           HA       ARG  69 -28.093  13.837   3.010
    3    HB2  ARG  69           HB2      ARG  69 -25.803  12.998   4.723
    4    HB3  ARG  69           HB3      ARG  69 -25.882  14.701   4.289
    5    HG2  ARG  69           HG2      ARG  69 -28.234  14.763   5.171
    6    HG3  ARG  69           HG3      ARG  69 -28.030  13.097   5.724
    7    HD2  ARG  69           HD2      ARG  69 -26.391  15.502   6.599
    8    HD3  ARG  69           HD3      ARG  69 -27.550  14.630   7.588
    9    HE   ARG  69           HE       ARG  69 -24.897  13.683   6.777
   10   HH21  ARG  69          HH11      ARG  69 -24.121  11.979   8.076
   11   HH22  ARG  69          HH12      ARG  69 -25.186  11.201   9.200
   12   HH11  ARG  69          HH21      ARG  69 -27.911  13.180   8.385
   13   HH12  ARG  69          HH22      ARG  69 -27.331  11.880   9.372

  No H/Q in entry =          13
  In of MODEL   76
    1    H    LEU  70           H        LEU  70 -25.163  12.401   1.819
    2    HA   LEU  70           HA       LEU  70 -24.023  14.725   0.594
    3    HB2  LEU  70           HB2      LEU  70 -23.036  12.443   1.323
    4    HB3  LEU  70           HB3      LEU  70 -23.587  11.905  -0.263
    5    HG   LEU  70           HG       LEU  70 -21.965  13.244  -1.346
    6   HD11  LEU  70          HD11      LEU  70 -21.252  14.211   1.432
    7   HD13  LEU  70          HD12      LEU  70 -21.909  15.186   0.117
    8   HD12  LEU  70          HD13      LEU  70 -20.285  14.510  -0.014
    9   HD22  LEU  70          HD21      LEU  70 -20.529  11.551  -0.988
   10   HD21  LEU  70          HD22      LEU  70 -21.503  11.081   0.405
   11   HD23  LEU  70          HD23      LEU  70 -20.134  12.172   0.614

  No H/Q in entry =          11
  In of MODEL   76
    1    H    LEU  71           H        LEU  71 -26.117  12.119  -0.492
    2    HA   LEU  71           HA       LEU  71 -26.557  13.494  -3.087
    3    HB2  LEU  71           HB2      LEU  71 -26.760  10.530  -2.523
    4    HB3  LEU  71           HB3      LEU  71 -26.837  11.325  -4.094
    5    HG   LEU  71           HG       LEU  71 -24.381  11.427  -2.343
    6   HD12  LEU  71          HD11      LEU  71 -24.333   9.697  -4.705
    7   HD11  LEU  71          HD12      LEU  71 -25.387   9.121  -3.415
    8   HD13  LEU  71          HD13      LEU  71 -23.681   9.426  -3.088
    9   HD22  LEU  71          HD21      LEU  71 -24.438  13.178  -3.915
   10   HD21  LEU  71          HD22      LEU  71 -24.880  12.076  -5.220
   11   HD23  LEU  71          HD23      LEU  71 -23.284  11.969  -4.477

  No H/Q in entry =          11
  In of MODEL   76
    1    HA   PRO  72           HA       PRO  72 -30.516  13.130  -0.594
    2    HB2  PRO  72           HB2      PRO  72 -31.382  15.679  -0.816
    3    HB3  PRO  72           HB3      PRO  72 -30.112  15.282   0.341
    4    HG2  PRO  72           HG2      PRO  72 -29.830  16.361  -2.451
    5    HG3  PRO  72           HG3      PRO  72 -29.122  16.979  -0.959
    6    HD2  PRO  72           HD2      PRO  72 -27.713  15.357  -2.607
    7    HD3  PRO  72           HD3      PRO  72 -27.521  15.265  -0.857

  No H/Q in entry =           7
  In of MODEL   76
    1    H    ASN  73           H        ASN  73 -29.777  13.952  -3.821
    2    HA   ASN  73           HA       ASN  73 -32.610  13.601  -4.545
    3    HB2  ASN  73           HB2      ASN  73 -32.072  14.621  -6.669
    4    HB3  ASN  73           HB3      ASN  73 -31.604  15.660  -5.332
    5   HD21  ASN  73          HD21      ASN  73 -30.709  15.597  -7.977
    6   HD22  ASN  73          HD22      ASN  73 -29.035  15.436  -8.101

  No H/Q in entry =           6
  In of MODEL   76
    1    H    LYS  74           H        LYS  74 -30.638  11.376  -3.952
    2    HA   LYS  74           HA       LYS  74 -31.105   9.872  -6.458
    3    HB2  LYS  74           HB2      LYS  74 -28.634   9.662  -4.733
    4    HB3  LYS  74           HB3      LYS  74 -28.957   8.784  -6.228
    5    HG2  LYS  74           HG2      LYS  74 -28.711  11.761  -6.142
    6    HG3  LYS  74           HG3      LYS  74 -27.323  10.694  -6.351
    7    HD2  LYS  74           HD2      LYS  74 -28.363   9.679  -8.293
    8    HD3  LYS  74           HD3      LYS  74 -29.797  10.682  -8.068
    9    HE2  LYS  74           HE2      LYS  74 -28.562  12.673  -8.549
   10    HE3  LYS  74           HE3      LYS  74 -27.036  11.789  -8.546
   11    HZ2  LYS  74           HZ1      LYS  74 -28.428  12.293 -10.749
   12    HZ1  LYS  74           HZ2      LYS  74 -29.091  10.785 -10.336
   13    HZ3  LYS  74           HZ3      LYS  74 -27.417  10.940 -10.577

  No H/Q in entry =          13
  In of MODEL   76
    1    HA   PRO  75           HA       PRO  75 -32.600   7.009  -3.417
    2    HB2  PRO  75           HB2      PRO  75 -32.844   4.724  -4.914
    3    HB3  PRO  75           HB3      PRO  75 -33.971   6.070  -5.083
    4    HG2  PRO  75           HG2      PRO  75 -31.567   5.408  -6.739
    5    HG3  PRO  75           HG3      PRO  75 -33.199   5.820  -7.265
    6    HD2  PRO  75           HD2      PRO  75 -31.266   7.693  -7.229
    7    HD3  PRO  75           HD3      PRO  75 -32.918   8.108  -6.769

  No H/Q in entry =           7
  In of MODEL   76
    1    H    VAL  76           H        VAL  76 -31.197   6.019  -1.948
    2    HA   VAL  76           HA       VAL  76 -28.689   4.774  -2.910
    3    HB   VAL  76           HB       VAL  76 -29.080   6.350  -0.329
    4   HG11  VAL  76          HG11      VAL  76 -26.670   5.014  -1.576
    5   HG13  VAL  76          HG12      VAL  76 -27.423   4.628  -0.028
    6   HG12  VAL  76          HG13      VAL  76 -26.575   6.159  -0.237
    7   HG22  VAL  76          HG21      VAL  76 -28.384   8.214  -1.271
    8   HG21  VAL  76          HG22      VAL  76 -28.867   7.452  -2.787
    9   HG23  VAL  76          HG23      VAL  76 -27.183   7.391  -2.266

  No H/Q in entry =           9
  In of MODEL   76
    1    H    GLU  77           H        GLU  77 -28.490   2.648  -2.198
    2    HA   GLU  77           HA       GLU  77 -29.374   1.971   0.456
    3    HB2  GLU  77           HB2      GLU  77 -30.955   0.296  -0.064
    4    HB3  GLU  77           HB3      GLU  77 -31.482   1.785  -0.850
    5    HG2  GLU  77           HG2      GLU  77 -30.789   0.939  -2.980
    6    HG3  GLU  77           HG3      GLU  77 -30.169  -0.526  -2.219

  No H/Q in entry =           6
  In of MODEL   76
    1    H    VAL  78           H        VAL  78 -29.066  -0.085   1.216
    2    HA   VAL  78           HA       VAL  78 -26.366  -0.881   0.461
    3    HB   VAL  78           HB       VAL  78 -28.160  -1.671   2.796
    4   HG11  VAL  78          HG11      VAL  78 -25.776  -2.937   1.814
    5   HG13  VAL  78          HG12      VAL  78 -26.736  -3.350   3.236
    6   HG12  VAL  78          HG13      VAL  78 -25.426  -2.178   3.367
    7   HG22  VAL  78          HG21      VAL  78 -26.756  -0.247   4.130
    8   HG21  VAL  78          HG22      VAL  78 -27.446   0.664   2.787
    9   HG23  VAL  78          HG23      VAL  78 -25.763   0.139   2.724

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ILE  79           H        ILE  79 -25.789  -2.824  -0.341
    2    HA   ILE  79           HA       ILE  79 -27.794  -4.367  -1.700
    3    HB   ILE  79           HB       ILE  79 -24.812  -4.871  -1.345
    4   HG12  ILE  79          HG12      ILE  79 -26.364  -3.872  -3.738
    5   HG13  ILE  79          HG13      ILE  79 -25.537  -2.810  -2.597
    6   HG22  ILE  79          HG21      ILE  79 -25.823  -6.153  -3.651
    7   HG21  ILE  79          HG22      ILE  79 -26.857  -6.620  -2.301
    8   HG23  ILE  79          HG23      ILE  79 -25.116  -6.890  -2.213
    9   HD13  ILE  79          HD11      ILE  79 -24.056  -2.995  -4.356
   10   HD12  ILE  79          HD12      ILE  79 -24.380  -4.715  -4.575
   11   HD11  ILE  79          HD13      ILE  79 -23.450  -4.164  -3.181

  No H/Q in entry =          11
  In of MODEL   76
    1    H    ASP  80           H        ASP  80 -28.675  -6.267  -1.068
    2    HA   ASP  80           HA       ASP  80 -28.719  -7.054   1.615
    3    HB2  ASP  80           HB2      ASP  80 -30.407  -7.707  -0.064
    4    HB3  ASP  80           HB3      ASP  80 -29.214  -8.746  -0.844

  No H/Q in entry =           4
  In of MODEL   76
    1    H    SER  81           H        SER  81 -27.223  -8.132   2.849
    2    HA   SER  81           HA       SER  81 -24.682  -8.853   1.782
    3    HB2  SER  81           HB2      SER  81 -24.145  -9.677   3.992
    4    HB3  SER  81           HB3      SER  81 -25.047  -8.172   4.163
    5    HG   SER  81           HG       SER  81 -25.919 -10.811   4.569

  No H/Q in entry =           5
  In of MODEL   76
    1    H    LEU  82           H        LEU  82 -27.396 -10.941   2.092
    2    HA   LEU  82           HA       LEU  82 -25.823 -13.322   1.733
    3    HB2  LEU  82           HB2      LEU  82 -28.749 -12.731   1.341
    4    HB3  LEU  82           HB3      LEU  82 -28.034 -14.338   1.225
    5    HG   LEU  82           HG       LEU  82 -28.082 -12.649   3.708
    6   HD12  LEU  82          HD11      LEU  82 -29.707 -15.092   2.958
    7   HD11  LEU  82          HD12      LEU  82 -30.325 -13.439   2.974
    8   HD13  LEU  82          HD13      LEU  82 -29.798 -14.198   4.476
    9   HD21  LEU  82          HD21      LEU  82 -27.034 -15.362   2.955
   10   HD23  LEU  82          HD22      LEU  82 -27.492 -15.003   4.619
   11   HD22  LEU  82          HD23      LEU  82 -26.222 -14.064   3.833

  No H/Q in entry =          11
  In of MODEL   76
    1    H    LEU  83           H        LEU  83 -27.714 -11.190  -0.352
    2    HA   LEU  83           HA       LEU  83 -27.416 -12.653  -2.754
    3    HB2  LEU  83           HB2      LEU  83 -27.859  -9.722  -2.248
    4    HB3  LEU  83           HB3      LEU  83 -27.826 -10.437  -3.859
    5    HG   LEU  83           HG       LEU  83 -29.940 -10.739  -1.746
    6   HD13  LEU  83          HD11      LEU  83 -30.660  -8.942  -2.917
    7   HD12  LEU  83          HD12      LEU  83 -31.071 -10.112  -4.170
    8   HD11  LEU  83          HD13      LEU  83 -29.538  -9.244  -4.241
    9   HD23  LEU  83          HD21      LEU  83 -29.973 -12.114  -4.417
   10   HD22  LEU  83          HD22      LEU  83 -30.994 -12.406  -3.010
   11   HD21  LEU  83          HD23      LEU  83 -29.303 -12.904  -2.990

  No H/Q in entry =          11
  In of MODEL   76
    1    H    TYR  84           H        TYR  84 -25.534 -10.189  -1.110
    2    HA   TYR  84           HA       TYR  84 -23.594  -9.786  -3.188
    3    HB2  TYR  84           HB2      TYR  84 -24.223  -8.259  -1.187
    4    HB3  TYR  84           HB3      TYR  84 -23.123  -9.279  -0.262
    5    HD1  TYR  84           HD1      TYR  84 -20.810  -8.883  -0.298
    6    HD2  TYR  84           HD2      TYR  84 -23.291  -7.069  -3.263
    7    HE1  TYR  84           HE1      TYR  84 -18.875  -7.566  -1.093
    8    HE2  TYR  84           HE2      TYR  84 -21.363  -5.755  -4.075
    9    HH   TYR  84           HH       TYR  84 -18.207  -6.458  -3.287

  No H/Q in entry =           9
  In of MODEL   76
    1    H    GLY  85           H        GLY  85 -23.460 -11.658  -0.151
    2    HA3  GLY  85           HA2      GLY  85 -20.863 -12.610  -0.496
    3    HA2  GLY  85           HA3      GLY  85 -22.126 -13.421   0.431

  No H/Q in entry =           3
  In of MODEL   76
    1    H    LYS  86           H        LYS  86 -23.893 -13.890  -1.679
    2    HA   LYS  86           HA       LYS  86 -22.786 -16.312  -2.794
    3    HB2  LYS  86           HB2      LYS  86 -25.430 -14.881  -3.042
    4    HB3  LYS  86           HB3      LYS  86 -25.094 -16.459  -3.752
    5    HG2  LYS  86           HG2      LYS  86 -24.805 -17.393  -1.536
    6    HG3  LYS  86           HG3      LYS  86 -25.147 -15.814  -0.829
    7    HD2  LYS  86           HD2      LYS  86 -27.337 -15.783  -1.913
    8    HD3  LYS  86           HD3      LYS  86 -26.997 -17.336  -2.674
    9    HE2  LYS  86           HE2      LYS  86 -28.410 -17.642  -0.721
   10    HE3  LYS  86           HE3      LYS  86 -26.827 -18.369  -0.450
   11    HZ2  LYS  86           HZ1      LYS  86 -28.088 -16.187   0.918
   12    HZ1  LYS  86           HZ2      LYS  86 -26.517 -15.800   0.396
   13    HZ3  LYS  86           HZ3      LYS  86 -26.771 -17.147   1.397

  No H/Q in entry =          13
  In of MODEL   76
    1    H    VAL  87           H        VAL  87 -22.750 -13.139  -3.825
    2    HA   VAL  87           HA       VAL  87 -22.382 -12.049  -5.803
    3    HB   VAL  87           HB       VAL  87 -21.249 -14.628  -6.940
    4   HG13  VAL  87          HG11      VAL  87 -19.910 -13.204  -8.259
    5   HG12  VAL  87          HG12      VAL  87 -20.147 -11.831  -7.176
    6   HG11  VAL  87          HG13      VAL  87 -21.464 -12.373  -8.216
    7   HG23  VAL  87          HG21      VAL  87 -19.051 -13.778  -5.905
    8   HG22  VAL  87          HG22      VAL  87 -20.177 -14.665  -4.880
    9   HG21  VAL  87          HG23      VAL  87 -20.092 -12.908  -4.781

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ASP  88           H        ASP  88 -24.907 -12.687  -5.518
    2    HA   ASP  88           HA       ASP  88 -25.935 -14.011  -7.901
    3    HB2  ASP  88           HB2      ASP  88 -27.016 -14.160  -5.607
    4    HB3  ASP  88           HB3      ASP  88 -27.469 -12.467  -5.796

  No H/Q in entry =           4
  In of MODEL   76
    1    H    GLY  89           H        GLY  89 -25.173 -12.822  -9.568
    2    HA3  GLY  89           HA2      GLY  89 -25.357 -10.062  -9.896
    3    HA2  GLY  89           HA3      GLY  89 -25.277 -11.241 -11.204

  No H/Q in entry =           3
  In of MODEL   76
    1    H    LEU  90           H        LEU  90 -27.735 -12.583 -10.788
    2    HA   LEU  90           HA       LEU  90 -29.510 -10.708 -12.051
    3    HB2  LEU  90           HB2      LEU  90 -29.545 -13.128 -12.528
    4    HB3  LEU  90           HB3      LEU  90 -30.111 -13.424 -10.884
    5    HG   LEU  90           HG       LEU  90 -32.218 -12.335 -11.374
    6   HD13  LEU  90          HD11      LEU  90 -31.990 -10.658 -12.916
    7   HD12  LEU  90          HD12      LEU  90 -32.483 -11.947 -14.017
    8   HD11  LEU  90          HD13      LEU  90 -30.776 -11.538 -13.847
    9   HD23  LEU  90          HD21      LEU  90 -32.053 -14.069 -13.732
   10   HD22  LEU  90          HD22      LEU  90 -33.085 -14.174 -12.306
   11   HD21  LEU  90          HD23      LEU  90 -31.429 -14.779 -12.243

  No H/Q in entry =          11
  In of MODEL   76
    1    H    GLY  91           H        GLY  91 -29.454 -12.068  -8.801
    2    HA3  GLY  91           HA2      GLY  91 -31.834 -10.924  -7.897
    3    HA2  GLY  91           HA3      GLY  91 -30.475 -11.408  -6.882

  No H/Q in entry =           3
  In of MODEL   76
    1    H    VAL  92           H        VAL  92 -28.534  -9.610  -7.746
    2    HA   VAL  92           HA       VAL  92 -29.389  -7.247  -6.330
    3    HB   VAL  92           HB       VAL  92 -26.785  -7.773  -7.809
    4   HG12  VAL  92          HG11      VAL  92 -27.042  -5.789  -5.574
    5   HG11  VAL  92          HG12      VAL  92 -27.652  -5.317  -7.162
    6   HG13  VAL  92          HG13      VAL  92 -25.959  -5.771  -6.967
    7   HG22  VAL  92          HG21      VAL  92 -26.615  -9.288  -6.141
    8   HG21  VAL  92          HG22      VAL  92 -27.802  -8.467  -5.126
    9   HG23  VAL  92          HG23      VAL  92 -26.147  -7.864  -5.213

  No H/Q in entry =           9
  In of MODEL   76
    1    H    LEU  93           H        LEU  93 -28.855  -8.056  -9.700
    2    HA   LEU  93           HA       LEU  93 -29.176  -5.465 -10.757
    3    HB2  LEU  93           HB2      LEU  93 -28.473  -7.379 -12.110
    4    HB3  LEU  93           HB3      LEU  93 -30.069  -8.105 -11.915
    5    HG   LEU  93           HG       LEU  93 -31.046  -6.198 -13.160
    6   HD11  LEU  93          HD11      LEU  93 -29.221  -4.572 -12.660
    7   HD13  LEU  93          HD12      LEU  93 -29.597  -4.679 -14.380
    8   HD12  LEU  93          HD13      LEU  93 -28.164  -5.480 -13.740
    9   HD23  LEU  93          HD21      LEU  93 -29.921  -6.858 -15.381
   10   HD22  LEU  93          HD22      LEU  93 -30.791  -8.079 -14.452
   11   HD21  LEU  93          HD23      LEU  93 -29.029  -8.014 -14.393

  No H/Q in entry =          11
  In of MODEL   76
    1    H    LYS  94           H        LYS  94 -31.570  -7.985  -9.884
    2    HA   LYS  94           HA       LYS  94 -33.896  -6.584 -10.656
    3    HB2  LYS  94           HB2      LYS  94 -33.448  -8.676  -8.533
    4    HB3  LYS  94           HB3      LYS  94 -35.037  -8.002  -8.889
    5    HG2  LYS  94           HG2      LYS  94 -34.861  -8.878 -11.182
    6    HG3  LYS  94           HG3      LYS  94 -33.312  -9.606 -10.766
    7    HD2  LYS  94           HD2      LYS  94 -34.493 -10.864  -8.926
    8    HD3  LYS  94           HD3      LYS  94 -36.017 -10.251  -9.564
    9    HE2  LYS  94           HE2      LYS  94 -35.415 -11.274 -11.769
   10    HE3  LYS  94           HE3      LYS  94 -34.024 -12.019 -10.980
   11    HZ3  LYS  94           HZ1      LYS  94 -35.861 -13.557 -11.150
   12    HZ2  LYS  94           HZ2      LYS  94 -36.872 -12.495 -10.291
   13    HZ1  LYS  94           HZ3      LYS  94 -35.535 -13.205  -9.521

  No H/Q in entry =          13
  In of MODEL   76
    1    H    ALA  95           H        ALA  95 -32.184  -6.563  -7.541
    2    HA   ALA  95           HA       ALA  95 -34.092  -4.929  -6.200
    3    HB2  ALA  95           HB1      ALA  95 -31.733  -6.266  -5.518
    4    HB3  ALA  95           HB2      ALA  95 -32.757  -5.317  -4.441
    5    HB1  ALA  95           HB3      ALA  95 -31.383  -4.560  -5.246

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ALA  96           H        ALA  96 -31.379  -4.154  -8.236
    2    HA   ALA  96           HA       ALA  96 -31.321  -1.361  -7.579
    3    HB2  ALA  96           HB1      ALA  96 -29.883  -1.220  -9.646
    4    HB3  ALA  96           HB2      ALA  96 -30.169  -2.941  -9.901
    5    HB1  ALA  96           HB3      ALA  96 -29.309  -2.394  -8.462

  No H/Q in entry =           5
  In of MODEL   76
    1    H    VAL  97           H        VAL  97 -32.747  -3.198 -10.242
    2    HA   VAL  97           HA       VAL  97 -33.778  -0.959 -11.636
    3    HB   VAL  97           HB       VAL  97 -34.576  -3.888 -11.580
    4   HG11  VAL  97          HG11      VAL  97 -36.356  -1.913 -12.218
    5   HG13  VAL  97          HG12      VAL  97 -36.383  -3.537 -12.905
    6   HG12  VAL  97          HG13      VAL  97 -35.602  -2.222 -13.783
    7   HG21  VAL  97          HG21      VAL  97 -33.230  -2.144 -13.645
    8   HG23  VAL  97          HG22      VAL  97 -33.667  -3.838 -13.877
    9   HG22  VAL  97          HG23      VAL  97 -32.463  -3.394 -12.665

  No H/Q in entry =           9
  In of MODEL   76
    1    H    ALA  98           H        ALA  98 -35.047  -3.032  -9.051
    2    HA   ALA  98           HA       ALA  98 -37.622  -1.879  -8.844
    3    HB1  ALA  98           HB1      ALA  98 -36.642  -4.027  -7.681
    4    HB3  ALA  98           HB2      ALA  98 -37.857  -3.068  -6.834
    5    HB2  ALA  98           HB3      ALA  98 -36.151  -2.898  -6.419

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ALA  99           H        ALA  99 -34.606  -0.999  -7.122
    2    HA   ALA  99           HA       ALA  99 -35.799   1.051  -5.590
    3    HB1  ALA  99           HB1      ALA  99 -33.124   0.139  -6.201
    4    HB2  ALA  99           HB2      ALA  99 -33.729   0.951  -4.757
    5    HB3  ALA  99           HB3      ALA  99 -33.206   1.900  -6.148

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ILE 100           H        ILE 100 -34.637   1.041  -8.908
    2    HA   ILE 100           HA       ILE 100 -34.811   3.876  -9.255
    3    HB   ILE 100           HB       ILE 100 -34.826   1.632 -11.302
    4   HG12  ILE 100          HG12      ILE 100 -32.691   3.657 -10.639
    5   HG13  ILE 100          HG13      ILE 100 -32.748   2.038  -9.941
    6   HG21  ILE 100          HG21      ILE 100 -35.247   4.543 -11.572
    7   HG23  ILE 100          HG22      ILE 100 -35.711   3.226 -12.651
    8   HG22  ILE 100          HG23      ILE 100 -34.058   3.843 -12.672
    9   HD12  ILE 100          HD11      ILE 100 -32.117   2.878 -12.732
   10   HD11  ILE 100          HD12      ILE 100 -32.784   1.273 -12.432
   11   HD13  ILE 100          HD13      ILE 100 -31.266   1.751 -11.676

  No H/Q in entry =          11
  In of MODEL   76
    1    H    LYS 101           H        LYS 101 -37.074   1.233  -9.952
    2    HA   LYS 101           HA       LYS 101 -39.120   2.833 -11.097
    3    HB2  LYS 101           HB2      LYS 101 -39.042   0.109  -9.849
    4    HB3  LYS 101           HB3      LYS 101 -40.582   0.851 -10.282
    5    HG2  LYS 101           HG2      LYS 101 -40.024   0.890 -12.564
    6    HG3  LYS 101           HG3      LYS 101 -38.338   0.499 -12.231
    7    HD2  LYS 101           HD2      LYS 101 -39.552  -1.448 -13.080
    8    HD3  LYS 101           HD3      LYS 101 -38.985  -1.707 -11.430
    9    HE2  LYS 101           HE2      LYS 101 -41.064  -2.385 -10.970
   10    HE3  LYS 101           HE3      LYS 101 -41.521  -0.683 -11.063
   11    HZ3  LYS 101           HZ1      LYS 101 -42.335  -0.932 -13.203
   12    HZ2  LYS 101           HZ2      LYS 101 -42.821  -2.376 -12.451
   13    HZ1  LYS 101           HZ3      LYS 101 -41.475  -2.370 -13.487

  No H/Q in entry =          13
  In of MODEL   76
    1    H    LYS 102           H        LYS 102 -38.744   1.494  -7.812
    2    HA   LYS 102           HA       LYS 102 -41.035   2.734  -6.749
    3    HB2  LYS 102           HB2      LYS 102 -39.835   0.915  -5.611
    4    HB3  LYS 102           HB3      LYS 102 -38.455   1.983  -5.362
    5    HG2  LYS 102           HG2      LYS 102 -39.827   3.436  -3.974
    6    HG3  LYS 102           HG3      LYS 102 -41.210   2.372  -4.227
    7    HD2  LYS 102           HD2      LYS 102 -40.020   0.554  -3.078
    8    HD3  LYS 102           HD3      LYS 102 -38.639   1.620  -2.824
    9    HE2  LYS 102           HE2      LYS 102 -40.044   3.153  -1.530
   10    HE3  LYS 102           HE3      LYS 102 -41.444   2.117  -1.807
   11    HZ1  LYS 102           HZ1      LYS 102 -39.760   0.410  -0.668
   12    HZ3  LYS 102           HZ2      LYS 102 -40.905   1.331   0.183
   13    HZ2  LYS 102           HZ3      LYS 102 -39.291   1.854   0.093

  No H/Q in entry =          13
  In of MODEL   76
    1    H    ALA 103           H        ALA 103 -38.047   4.088  -7.711
    2    HA   ALA 103           HA       ALA 103 -38.337   6.475  -6.037
    3    HB2  ALA 103           HB1      ALA 103 -36.290   7.147  -7.569
    4    HB3  ALA 103           HB2      ALA 103 -36.238   5.415  -7.892
    5    HB1  ALA 103           HB3      ALA 103 -36.073   6.009  -6.240

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ALA 104           H        ALA 104 -38.834   5.602  -9.370
    2    HA   ALA 104           HA       ALA 104 -39.398   8.356 -10.130
    3    HB2  ALA 104           HB1      ALA 104 -39.359   7.597 -12.303
    4    HB1  ALA 104           HB2      ALA 104 -40.099   6.050 -11.887
    5    HB3  ALA 104           HB3      ALA 104 -38.388   6.329 -11.556

  No H/Q in entry =           5
  In of MODEL   76
    1    H    ALA 105           H        ALA 105 -41.070   6.326  -8.300
    2    HA   ALA 105           HA       ALA 105 -43.495   7.713  -8.420
    3    HB2  ALA 105           HB1      ALA 105 -44.164   6.767 -10.447
    4    HB3  ALA 105           HB2      ALA 105 -44.840   5.626  -9.286
    5    HB1  ALA 105           HB3      ALA 105 -43.337   5.243 -10.125

  No H/Q in entry =           5
  In of MODEL   77
    1    H1   ALA   1           H3       ALA   1 -12.213 -15.731  -2.442
    2    H2   ALA   1           H2       ALA   1 -11.268 -16.874  -3.277
    3    H3   ALA   1           H1       ALA   1 -12.408 -15.930  -4.117
    4    HA   ALA   1           HA       ALA   1 -13.808 -17.630  -3.881
    5    HB3  ALA   1           HB1      ALA   1 -12.414 -19.402  -3.412
    6    HB1  ALA   1           HB2      ALA   1 -13.177 -19.288  -1.826
    7    HB2  ALA   1           HB3      ALA   1 -11.600 -18.547  -2.101

  No H/Q in entry =           7
  In of MODEL   77
    1    H    GLU   2           H        GLU   2 -15.438 -18.483  -2.233
    2    HA   GLU   2           HA       GLU   2 -17.090 -16.762  -1.183
    3    HB2  GLU   2           HB2      GLU   2 -16.158 -19.186   0.368
    4    HB3  GLU   2           HB3      GLU   2 -17.683 -18.335   0.615
    5    HG2  GLU   2           HG2      GLU   2 -18.655 -19.423  -1.123
    6    HG3  GLU   2           HG3      GLU   2 -17.327 -19.024  -2.202

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLU   3           H        GLU   3 -15.189 -18.113   1.449
    2    HA   GLU   3           HA       GLU   3 -15.417 -15.758   3.004
    3    HB2  GLU   3           HB2      GLU   3 -13.833 -18.305   3.263
    4    HB3  GLU   3           HB3      GLU   3 -13.607 -16.984   4.410
    5    HG2  GLU   3           HG2      GLU   3 -15.803 -17.134   5.219
    6    HG3  GLU   3           HG3      GLU   3 -16.392 -17.936   3.768

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LEU   4           H        LEU   4 -12.457 -17.238   1.627
    2    HA   LEU   4           HA       LEU   4 -10.625 -15.335   2.231
    3    HB2  LEU   4           HB2      LEU   4 -10.844 -16.635  -0.493
    4    HB3  LEU   4           HB3      LEU   4  -9.395 -15.914   0.197
    5    HG   LEU   4           HG       LEU   4 -10.894 -18.310   1.306
    6   HD13  LEU   4          HD11      LEU   4  -9.258 -19.667   0.385
    7   HD12  LEU   4          HD12      LEU   4  -8.048 -18.384   0.362
    8   HD11  LEU   4          HD13      LEU   4  -9.331 -18.407  -0.846
    9   HD23  LEU   4          HD21      LEU   4  -8.649 -18.372   2.697
   10   HD22  LEU   4          HD22      LEU   4  -9.972 -17.332   3.219
   11   HD21  LEU   4          HD23      LEU   4  -8.605 -16.644   2.342

  No H/Q in entry =          11
  In of MODEL   77
    1    H    GLU   5           H        GLU   5 -12.948 -15.130  -0.453
    2    HA   GLU   5           HA       GLU   5 -11.939 -12.647  -1.452
    3    HB2  GLU   5           HB2      GLU   5 -13.275 -14.226  -2.825
    4    HB3  GLU   5           HB3      GLU   5 -14.679 -13.880  -1.815
    5    HG2  GLU   5           HG2      GLU   5 -14.572 -11.509  -2.445
    6    HG3  GLU   5           HG3      GLU   5 -13.141 -11.824  -3.425

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLU   6           H        GLU   6 -14.674 -13.523   0.629
    2    HA   GLU   6           HA       GLU   6 -15.579 -10.846   1.022
    3    HB2  GLU   6           HB2      GLU   6 -16.004 -13.385   2.612
    4    HB3  GLU   6           HB3      GLU   6 -16.803 -11.856   2.976
    5    HG2  GLU   6           HG2      GLU   6 -17.829 -11.820   0.764
    6    HG3  GLU   6           HG3      GLU   6 -16.964 -13.287   0.310

  No H/Q in entry =           6
  In of MODEL   77
    1    H    VAL   7           H        VAL   7 -13.280 -12.955   2.606
    2    HA   VAL   7           HA       VAL   7 -12.823 -11.378   4.934
    3    HB   VAL   7           HB       VAL   7 -11.114 -13.424   3.494
    4   HG11  VAL   7          HG11      VAL   7 -10.657 -11.889   6.058
    5   HG13  VAL   7          HG12      VAL   7  -9.551 -12.105   4.703
    6   HG12  VAL   7          HG13      VAL   7  -9.909 -13.460   5.772
    7   HG21  VAL   7          HG21      VAL   7 -13.370 -13.986   4.704
    8   HG23  VAL   7          HG22      VAL   7 -12.450 -13.711   6.183
    9   HG22  VAL   7          HG23      VAL   7 -11.952 -14.972   5.057

  No H/Q in entry =           9
  In of MODEL   77
    1    H    VAL   8           H        VAL   8 -11.298 -11.497   1.730
    2    HA   VAL   8           HA       VAL   8  -9.236  -9.624   2.231
    3    HB   VAL   8           HB       VAL   8 -10.688 -10.312  -0.335
    4   HG13  VAL   8          HG11      VAL   8  -9.737  -8.183  -0.740
    5   HG12  VAL   8          HG12      VAL   8  -8.515  -9.312  -1.330
    6   HG11  VAL   8          HG13      VAL   8  -8.314  -8.538   0.241
    7   HG23  VAL   8          HG21      VAL   8  -7.851 -11.093   0.114
    8   HG22  VAL   8          HG22      VAL   8  -9.175 -12.023  -0.582
    9   HG21  VAL   8          HG23      VAL   8  -9.012 -11.903   1.167

  No H/Q in entry =           9
  In of MODEL   77
    1    H    MET   9           H        MET   9 -12.577  -9.234   1.055
    2    HA   MET   9           HA       MET   9 -12.510  -6.458   0.618
    3    HB2  MET   9           HB2      MET   9 -14.731  -8.326   1.447
    4    HB3  MET   9           HB3      MET   9 -15.006  -6.599   1.211
    5    HG2  MET   9           HG2      MET   9 -13.754  -7.037  -1.078
    6    HG3  MET   9           HG3      MET   9 -14.286  -8.696  -0.803
    7    HE1  MET   9           HE1      MET   9 -16.587  -8.805   0.607
    8    HE3  MET   9           HE2      MET   9 -18.073  -8.101  -0.021
    9    HE2  MET   9           HE3      MET   9 -17.062  -7.167   1.077

  No H/Q in entry =           9
  In of MODEL   77
    1    H    GLY  10           H        GLY  10 -13.187  -8.346   3.544
    2    HA3  GLY  10           HA2      GLY  10 -13.743  -6.160   5.258
    3    HA2  GLY  10           HA3      GLY  10 -13.181  -7.748   5.776

  No H/Q in entry =           3
  In of MODEL   77
    1    H    LEU  11           H        LEU  11 -10.730  -7.874   4.473
    2    HA   LEU  11           HA       LEU  11  -9.037  -6.438   6.236
    3    HB2  LEU  11           HB2      LEU  11  -8.478  -7.865   3.633
    4    HB3  LEU  11           HB3      LEU  11  -7.213  -7.159   4.636
    5    HG   LEU  11           HG       LEU  11  -9.219  -9.191   5.646
    6   HD13  LEU  11          HD11      LEU  11  -7.990 -10.429   4.088
    7   HD12  LEU  11          HD12      LEU  11  -7.062 -10.666   5.568
    8   HD11  LEU  11          HD13      LEU  11  -6.516  -9.502   4.362
    9   HD22  LEU  11          HD21      LEU  11  -8.375  -8.176   7.565
   10   HD21  LEU  11          HD22      LEU  11  -6.834  -7.775   6.809
   11   HD23  LEU  11          HD23      LEU  11  -7.162  -9.431   7.319

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  12           H        ILE  12  -9.923  -5.895   2.842
    2    HA   ILE  12           HA       ILE  12  -8.231  -3.665   2.421
    3    HB   ILE  12           HB       ILE  12 -10.878  -4.339   1.114
    4   HG12  ILE  12          HG12      ILE  12  -8.839  -5.988   1.049
    5   HG13  ILE  12          HG13      ILE  12  -9.693  -5.633  -0.438
    6   HG21  ILE  12          HG21      ILE  12  -8.648  -2.454   0.283
    7   HG23  ILE  12          HG22      ILE  12 -10.305  -2.011   0.670
    8   HG22  ILE  12          HG23      ILE  12  -9.953  -2.957  -0.747
    9   HD12  ILE  12          HD11      ILE  12  -7.185  -5.579  -0.626
   10   HD11  ILE  12          HD12      ILE  12  -7.185  -4.208   0.480
   11   HD13  ILE  12          HD13      ILE  12  -7.955  -4.072  -1.082

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  13           H        ILE  13 -11.597  -3.933   3.499
    2    HA   ILE  13           HA       ILE  13 -12.060  -1.146   3.763
    3    HB   ILE  13           HB       ILE  13 -13.269  -3.569   5.113
    4   HG12  ILE  13          HG12      ILE  13 -13.486  -2.989   2.576
    5   HG13  ILE  13          HG13      ILE  13 -14.905  -3.485   3.473
    6   HG23  ILE  13          HG21      ILE  13 -13.817  -1.943   6.686
    7   HG22  ILE  13          HG22      ILE  13 -15.183  -1.810   5.587
    8   HG21  ILE  13          HG23      ILE  13 -13.864  -0.645   5.496
    9   HD11  ILE  13          HD11      ILE  13 -14.151  -0.580   3.079
   10   HD13  ILE  13          HD12      ILE  13 -15.650  -1.232   3.710
   11   HD12  ILE  13          HD13      ILE  13 -15.259  -1.460   2.021

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ASN  14           H        ASN  14 -10.957  -3.633   6.046
    2    HA   ASN  14           HA       ASN  14 -10.769  -1.992   8.330
    3    HB2  ASN  14           HB2      ASN  14 -10.511  -4.599   8.013
    4    HB3  ASN  14           HB3      ASN  14  -8.802  -4.210   7.863
    5   HD21  ASN  14          HD21      ASN  14  -9.447  -5.733  10.038
    6   HD22  ASN  14          HD22      ASN  14  -9.427  -4.811  11.461

  No H/Q in entry =           6
  In of MODEL   77
    1    H    SER  15           H        SER  15  -8.354  -2.815   5.851
    2    HA   SER  15           HA       SER  15  -6.218  -1.318   6.932
    3    HB2  SER  15           HB2      SER  15  -5.187  -1.533   4.778
    4    HB3  SER  15           HB3      SER  15  -6.139  -2.996   5.001
    5    HG   SER  15           HG       SER  15  -6.515  -0.855   3.281

  No H/Q in entry =           5
  In of MODEL   77
    1    H    GLY  16           H        GLY  16  -8.810  -0.458   4.671
    2    HA3  GLY  16           HA2      GLY  16  -7.954   2.184   4.121
    3    HA2  GLY  16           HA3      GLY  16  -9.603   1.586   3.952

  No H/Q in entry =           3
  In of MODEL   77
    1    H    GLN  17           H        GLN  17 -10.157   0.863   6.599
    2    HA   GLN  17           HA       GLN  17 -10.875   3.367   7.734
    3    HB2  GLN  17           HB2      GLN  17 -10.784   0.580   8.901
    4    HB3  GLN  17           HB3      GLN  17 -11.392   1.977   9.790
    5    HG2  GLN  17           HG2      GLN  17 -13.078   2.379   8.060
    6    HG3  GLN  17           HG3      GLN  17 -12.440   1.043   7.103
    7   HE21  GLN  17          HE21      GLN  17 -15.080   1.618   8.809
    8   HE22  GLN  17          HE22      GLN  17 -15.300   0.138   9.611

  No H/Q in entry =           8
  In of MODEL   77
    1    H    ALA  18           H        ALA  18  -8.244   1.093   8.368
    2    HA   ALA  18           HA       ALA  18  -7.160   2.314  10.643
    3    HB2  ALA  18           HB1      ALA  18  -6.538   0.098   9.281
    4    HB3  ALA  18           HB2      ALA  18  -5.383   0.885  10.357
    5    HB1  ALA  18           HB3      ALA  18  -5.298   1.162   8.616

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ARG  19           H        ARG  19  -6.373   2.835   7.198
    2    HA   ARG  19           HA       ARG  19  -4.483   4.888   7.633
    3    HB2  ARG  19           HB2      ARG  19  -4.796   3.744   5.437
    4    HB3  ARG  19           HB3      ARG  19  -6.340   4.580   5.252
    5    HG2  ARG  19           HG2      ARG  19  -5.218   6.755   5.323
    6    HG3  ARG  19           HG3      ARG  19  -3.668   5.974   5.636
    7    HD2  ARG  19           HD2      ARG  19  -3.783   6.561   3.291
    8    HD3  ARG  19           HD3      ARG  19  -3.864   4.801   3.439
    9    HE   ARG  19           HE       ARG  19  -6.500   5.702   3.417
   10   HH21  ARG  19          HH11      ARG  19  -7.686   5.852   1.493
   11   HH22  ARG  19          HH12      ARG  19  -6.857   5.931  -0.023
   12   HH11  ARG  19          HH21      ARG  19  -3.715   5.771   1.397
   13   HH12  ARG  19          HH22      ARG  19  -4.607   5.882  -0.077

  No H/Q in entry =          13
  In of MODEL   77
    1    H    SER  20           H        SER  20  -7.978   4.992   7.015
    2    HA   SER  20           HA       SER  20  -8.344   7.746   6.961
    3    HB2  SER  20           HB2      SER  20 -10.133   6.128   6.458
    4    HB3  SER  20           HB3      SER  20 -10.190   5.669   8.158
    5    HG   SER  20           HG       SER  20 -10.974   7.642   8.668

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LEU  21           H        LEU  21  -8.351   5.567   9.769
    2    HA   LEU  21           HA       LEU  21  -8.808   7.564  11.728
    3    HB2  LEU  21           HB2      LEU  21  -7.445   4.869  11.902
    4    HB3  LEU  21           HB3      LEU  21  -7.770   5.886  13.301
    5    HG   LEU  21           HG       LEU  21  -9.917   4.969  11.365
    6   HD12  LEU  21          HD11      LEU  21  -9.139   3.811  14.058
    7   HD11  LEU  21          HD12      LEU  21  -8.881   3.036  12.495
    8   HD13  LEU  21          HD13      LEU  21 -10.522   3.310  13.083
    9   HD23  LEU  21          HD21      LEU  21 -11.277   5.472  13.581
   10   HD22  LEU  21          HD22      LEU  21 -10.835   6.810  12.526
   11   HD21  LEU  21          HD23      LEU  21  -9.896   6.491  13.976

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ALA  22           H        ALA  22  -5.844   6.200  10.338
    2    HA   ALA  22           HA       ALA  22  -3.977   7.523  11.968
    3    HB2  ALA  22           HB1      ALA  22  -3.546   5.668  10.281
    4    HB1  ALA  22           HB2      ALA  22  -2.355   6.969  10.321
    5    HB3  ALA  22           HB3      ALA  22  -3.566   6.919   9.039

  No H/Q in entry =           5
  In of MODEL   77
    1    H    TYR  23           H        TYR  23  -5.282   8.530   8.777
    2    HA   TYR  23           HA       TYR  23  -3.955  11.031   8.710
    3    HB2  TYR  23           HB2      TYR  23  -5.022  10.111   6.715
    4    HB3  TYR  23           HB3      TYR  23  -6.605  10.216   7.487
    5    HD1  TYR  23           HD1      TYR  23  -3.705  12.260   6.335
    6    HD2  TYR  23           HD2      TYR  23  -7.847  12.227   7.470
    7    HE1  TYR  23           HE1      TYR  23  -3.933  14.608   5.569
    8    HE2  TYR  23           HE2      TYR  23  -8.076  14.575   6.703
    9    HH   TYR  23           HH       TYR  23  -5.477  16.209   4.992

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ALA  24           H        ALA  24  -7.078  10.044  10.074
    2    HA   ALA  24           HA       ALA  24  -7.929  12.631  10.837
    3    HB1  ALA  24           HB1      ALA  24  -9.745  11.374  11.297
    4    HB2  ALA  24           HB2      ALA  24  -8.924  10.807  12.750
    5    HB3  ALA  24           HB3      ALA  24  -8.787   9.894  11.249

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ALA  25           H        ALA  25  -5.925  10.183  12.426
    2    HA   ALA  25           HA       ALA  25  -5.606  11.440  14.928
    3    HB2  ALA  25           HB1      ALA  25  -4.825   9.090  14.114
    4    HB3  ALA  25           HB2      ALA  25  -3.819   9.954  15.279
    5    HB1  ALA  25           HB3      ALA  25  -3.374   9.936  13.572

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LEU  26           H        LEU  26  -3.800  11.742  11.896
    2    HA   LEU  26           HA       LEU  26  -1.853  13.571  12.820
    3    HB2  LEU  26           HB2      LEU  26  -1.536  12.417  10.720
    4    HB3  LEU  26           HB3      LEU  26  -3.009  13.119  10.056
    5    HG   LEU  26           HG       LEU  26  -2.003  15.373  10.194
    6   HD12  LEU  26          HD11      LEU  26   0.533  15.403  10.621
    7   HD11  LEU  26          HD12      LEU  26   0.311  13.823  11.367
    8   HD13  LEU  26          HD13      LEU  26  -0.505  15.235  12.037
    9   HD21  LEU  26          HD21      LEU  26  -0.245  13.323   8.811
   10   HD23  LEU  26          HD22      LEU  26  -0.293  15.044   8.438
   11   HD22  LEU  26          HD23      LEU  26  -1.711  14.040   8.143

  No H/Q in entry =          11
  In of MODEL   77
    1    H    LYS  27           H        LYS  27  -5.029  14.040  11.325
    2    HA   LYS  27           HA       LYS  27  -4.983  16.828  11.123
    3    HB2  LYS  27           HB2      LYS  27  -6.716  15.343  10.131
    4    HB3  LYS  27           HB3      LYS  27  -7.381  15.087  11.744
    5    HG2  LYS  27           HG2      LYS  27  -7.820  17.492  11.974
    6    HG3  LYS  27           HG3      LYS  27  -7.105  17.789  10.386
    7    HD2  LYS  27           HD2      LYS  27  -8.826  16.347   9.343
    8    HD3  LYS  27           HD3      LYS  27  -9.548  16.067  10.930
    9    HE2  LYS  27           HE2      LYS  27 -10.000  18.477  11.167
   10    HE3  LYS  27           HE3      LYS  27  -9.251  18.779   9.596
   11    HZ3  LYS  27           HZ1      LYS  27 -11.626  18.645   9.342
   12    HZ2  LYS  27           HZ2      LYS  27 -11.673  17.130  10.113
   13    HZ1  LYS  27           HZ3      LYS  27 -10.921  17.294   8.595

  No H/Q in entry =          13
  In of MODEL   77
    1    H    GLN  28           H        GLN  28  -5.879  14.743  13.849
    2    HA   GLN  28           HA       GLN  28  -6.790  16.746  15.617
    3    HB2  GLN  28           HB2      GLN  28  -5.383  14.121  16.170
    4    HB3  GLN  28           HB3      GLN  28  -6.133  15.124  17.413
    5    HG2  GLN  28           HG2      GLN  28  -7.579  13.995  15.000
    6    HG3  GLN  28           HG3      GLN  28  -7.643  13.309  16.622
    7   HE21  GLN  28          HE21      GLN  28  -9.509  15.105  14.641
    8   HE22  GLN  28          HE22      GLN  28 -10.266  16.123  15.767

  No H/Q in entry =           8
  In of MODEL   77
    1    H    ALA  29           H        ALA  29  -3.564  15.458  14.947
    2    HA   ALA  29           HA       ALA  29  -2.140  16.862  16.930
    3    HB1  ALA  29           HB1      ALA  29  -0.202  16.174  15.822
    4    HB3  ALA  29           HB2      ALA  29  -0.948  16.294  14.229
    5    HB2  ALA  29           HB3      ALA  29  -1.373  14.962  15.303

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LYS  30           H        LYS  30  -2.982  17.735  13.595
    2    HA   LYS  30           HA       LYS  30  -1.575  20.177  13.499
    3    HB2  LYS  30           HB2      LYS  30  -4.097  19.298  12.078
    4    HB3  LYS  30           HB3      LYS  30  -3.263  20.813  11.737
    5    HG2  LYS  30           HG2      LYS  30  -1.190  19.521  11.235
    6    HG3  LYS  30           HG3      LYS  30  -2.096  18.025  11.478
    7    HD2  LYS  30           HD2      LYS  30  -3.652  18.662   9.674
    8    HD3  LYS  30           HD3      LYS  30  -2.768  20.171   9.434
    9    HE2  LYS  30           HE2      LYS  30  -0.732  18.878   8.866
   10    HE3  LYS  30           HE3      LYS  30  -1.635  17.375   9.076
   11    HZ2  LYS  30           HZ1      LYS  30  -1.447  18.243   6.733
   12    HZ1  LYS  30           HZ2      LYS  30  -2.493  19.506   7.195
   13    HZ3  LYS  30           HZ3      LYS  30  -3.018  17.889   7.266

  No H/Q in entry =          13
  In of MODEL   77
    1    H    GLN  31           H        GLN  31  -4.682  19.326  14.897
    2    HA   GLN  31           HA       GLN  31  -5.447  22.083  15.342
    3    HB2  GLN  31           HB2      GLN  31  -6.633  19.639  16.661
    4    HB3  GLN  31           HB3      GLN  31  -7.391  21.210  16.410
    5    HG2  GLN  31           HG2      GLN  31  -6.669  20.430  13.825
    6    HG3  GLN  31           HG3      GLN  31  -7.198  18.927  14.571
    7   HE21  GLN  31          HE21      GLN  31  -8.597  20.499  12.461
    8   HE22  GLN  31          HE22      GLN  31 -10.114  20.892  13.111

  No H/Q in entry =           8
  In of MODEL   77
    1    H    GLY  32           H        GLY  32  -3.142  20.156  16.675
    2    HA3  GLY  32           HA2      GLY  32  -1.750  20.619  18.484
    3    HA2  GLY  32           HA3      GLY  32  -2.881  21.863  19.000

  No H/Q in entry =           3
  In of MODEL   77
    1    H    ASP  33           H        ASP  33  -4.302  18.825  18.335
    2    HA   ASP  33           HA       ASP  33  -4.727  18.370  21.213
    3    HB2  ASP  33           HB2      ASP  33  -6.122  17.357  18.730
    4    HB3  ASP  33           HB3      ASP  33  -6.476  16.749  20.345

  No H/Q in entry =           4
  In of MODEL   77
    1    H    PHE  34           H        PHE  34  -2.561  17.517  21.530
    2    HA   PHE  34           HA       PHE  34  -1.556  15.266  20.136
    3    HB2  PHE  34           HB2      PHE  34  -0.951  16.253  22.932
    4    HB3  PHE  34           HB3      PHE  34  -0.020  15.028  22.070
    5    HD1  PHE  34           HD1      PHE  34  -0.192  18.454  22.802
    6    HD2  PHE  34           HD2      PHE  34   0.651  15.748  19.573
    7    HE1  PHE  34           HE1      PHE  34   1.110  20.223  21.652
    8    HE2  PHE  34           HE2      PHE  34   1.948  17.520  18.429
    9    HZ   PHE  34           HZ       PHE  34   2.180  19.755  19.473

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ALA  35           H        ALA  35  -3.609  15.548  22.989
    2    HA   ALA  35           HA       ALA  35  -3.404  12.886  23.888
    3    HB3  ALA  35           HB1      ALA  35  -5.865  13.515  24.734
    4    HB1  ALA  35           HB2      ALA  35  -5.328  15.133  24.279
    5    HB2  ALA  35           HB3      ALA  35  -4.420  14.209  25.475

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ALA  36           H        ALA  36  -5.842  14.404  21.776
    2    HA   ALA  36           HA       ALA  36  -7.258  11.993  21.294
    3    HB1  ALA  36           HB1      ALA  36  -8.708  13.416  20.330
    4    HB3  ALA  36           HB2      ALA  36  -7.529  13.835  19.086
    5    HB2  ALA  36           HB3      ALA  36  -7.560  14.723  20.609

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ALA  37           H        ALA  37  -4.568  13.576  19.636
    2    HA   ALA  37           HA       ALA  37  -4.524  11.939  17.341
    3    HB3  ALA  37           HB1      ALA  37  -2.536  13.650  18.771
    4    HB2  ALA  37           HB2      ALA  37  -3.059  13.705  17.089
    5    HB1  ALA  37           HB3      ALA  37  -1.909  12.474  17.616

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LYS  38           H        LYS  38  -2.782  11.634  20.427
    2    HA   LYS  38           HA       LYS  38  -1.456   9.232  19.946
    3    HB2  LYS  38           HB2      LYS  38  -1.788  10.997  22.089
    4    HB3  LYS  38           HB3      LYS  38  -2.411   9.468  22.703
    5    HG2  LYS  38           HG2      LYS  38  -0.316   8.345  22.178
    6    HG3  LYS  38           HG3      LYS  38   0.298   9.789  21.366
    7    HD2  LYS  38           HD2      LYS  38   0.459  11.009  23.401
    8    HD3  LYS  38           HD3      LYS  38  -0.565   9.860  24.264
    9    HE2  LYS  38           HE2      LYS  38   1.787   9.543  24.894
   10    HE3  LYS  38           HE3      LYS  38   1.185   8.126  24.028
   11    HZ3  LYS  38           HZ1      LYS  38   2.494   8.543  22.253
   12    HZ2  LYS  38           HZ2      LYS  38   3.445   9.371  23.393
   13    HZ1  LYS  38           HZ3      LYS  38   2.371  10.231  22.396

  No H/Q in entry =          13
  In of MODEL   77
    1    H    ALA  39           H        ALA  39  -4.701   9.731  21.333
    2    HA   ALA  39           HA       ALA  39  -5.266   7.013  21.837
    3    HB3  ALA  39           HB1      ALA  39  -7.420   8.959  21.058
    4    HB2  ALA  39           HB2      ALA  39  -6.528   9.186  22.563
    5    HB1  ALA  39           HB3      ALA  39  -7.445   7.703  22.297

  No H/Q in entry =           5
  In of MODEL   77
    1    H    MET  40           H        MET  40  -5.836   9.024  18.986
    2    HA   MET  40           HA       MET  40  -7.307   7.093  17.520
    3    HB2  MET  40           HB2      MET  40  -5.691   9.486  16.621
    4    HB3  MET  40           HB3      MET  40  -6.713   8.527  15.547
    5    HG2  MET  40           HG2      MET  40  -7.758   9.778  18.099
    6    HG3  MET  40           HG3      MET  40  -7.808  10.612  16.548
    7    HE3  MET  40           HE1      MET  40 -10.383   8.993  14.473
    8    HE2  MET  40           HE2      MET  40  -8.629   9.109  14.333
    9    HE1  MET  40           HE3      MET  40  -9.549  10.476  14.961

  No H/Q in entry =           9
  In of MODEL   77
    1    H    MET  41           H        MET  41  -3.816   7.828  17.659
    2    HA   MET  41           HA       MET  41  -3.049   6.071  15.563
    3    HB2  MET  41           HB2      MET  41  -1.444   6.739  18.043
    4    HB3  MET  41           HB3      MET  41  -0.819   6.089  16.531
    5    HG2  MET  41           HG2      MET  41  -1.970   8.272  15.520
    6    HG3  MET  41           HG3      MET  41  -1.741   8.861  17.165
    7    HE2  MET  41           HE1      MET  41   1.174   6.761  17.542
    8    HE1  MET  41           HE2      MET  41   0.382   8.056  18.436
    9    HE3  MET  41           HE3      MET  41   2.008   8.298  17.801

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ASP  42           H        ASP  42  -3.450   5.600  19.048
    2    HA   ASP  42           HA       ASP  42  -2.416   3.006  19.215
    3    HB2  ASP  42           HB2      ASP  42  -3.298   4.767  21.032
    4    HB3  ASP  42           HB3      ASP  42  -4.725   3.742  20.953

  No H/Q in entry =           4
  In of MODEL   77
    1    H    GLN  43           H        GLN  43  -5.747   4.111  18.697
    2    HA   GLN  43           HA       GLN  43  -6.890   1.523  18.499
    3    HB2  GLN  43           HB2      GLN  43  -7.807   4.175  17.364
    4    HB3  GLN  43           HB3      GLN  43  -8.770   2.696  17.338
    5    HG2  GLN  43           HG2      GLN  43  -8.489   2.577  19.847
    6    HG3  GLN  43           HG3      GLN  43  -7.764   4.181  19.778
    7   HE21  GLN  43          HE21      GLN  43  -9.951   4.263  21.268
    8   HE22  GLN  43          HE22      GLN  43 -11.307   4.838  20.429

  No H/Q in entry =           8
  In of MODEL   77
    1    H    SER  44           H        SER  44  -5.538   3.736  16.092
    2    HA   SER  44           HA       SER  44  -6.228   2.250  13.800
    3    HB2  SER  44           HB2      SER  44  -4.973   4.634  14.249
    4    HB3  SER  44           HB3      SER  44  -3.617   3.637  13.726
    5    HG   SER  44           HG       SER  44  -4.720   4.608  11.957

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ARG  45           H        ARG  45  -3.361   2.138  15.895
    2    HA   ARG  45           HA       ARG  45  -1.874   0.183  14.521
    3    HB2  ARG  45           HB2      ARG  45  -1.041   1.605  16.393
    4    HB3  ARG  45           HB3      ARG  45  -2.038   0.675  17.509
    5    HG2  ARG  45           HG2      ARG  45  -0.804  -1.384  16.874
    6    HG3  ARG  45           HG3      ARG  45   0.217  -0.430  15.800
    7    HD2  ARG  45           HD2      ARG  45   0.942   0.952  17.759
    8    HD3  ARG  45           HD3      ARG  45   0.014  -0.122  18.828
    9    HE   ARG  45           HE       ARG  45   1.721  -1.719  17.257
   10   HH21  ARG  45          HH11      ARG  45   3.617  -2.542  18.104
   11   HH22  ARG  45          HH12      ARG  45   4.383  -1.755  19.439
   12   HH11  ARG  45          HH21      ARG  45   2.013   0.749  19.647
   13   HH12  ARG  45          HH22      ARG  45   3.475   0.110  20.310

  No H/Q in entry =          13
  In of MODEL   77
    1    H    MET  46           H        MET  46  -4.285  -0.136  17.110
    2    HA   MET  46           HA       MET  46  -4.119  -2.935  17.419
    3    HB2  MET  46           HB2      MET  46  -6.295  -0.930  18.005
    4    HB3  MET  46           HB3      MET  46  -6.497  -2.650  18.350
    5    HG2  MET  46           HG2      MET  46  -4.510  -2.631  19.775
    6    HG3  MET  46           HG3      MET  46  -4.211  -0.945  19.382
    7    HE1  MET  46           HE1      MET  46  -6.451  -3.531  20.564
    8    HE3  MET  46           HE2      MET  46  -7.964  -2.629  20.552
    9    HE2  MET  46           HE3      MET  46  -7.156  -2.959  22.082

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ALA  47           H        ALA  47  -6.128  -0.918  15.313
    2    HA   ALA  47           HA       ALA  47  -7.741  -2.968  14.240
    3    HB3  ALA  47           HB1      ALA  47  -8.417  -0.731  13.819
    4    HB1  ALA  47           HB2      ALA  47  -7.921  -1.365  12.250
    5    HB2  ALA  47           HB3      ALA  47  -6.845  -0.297  13.152

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LEU  48           H        LEU  48  -4.616  -1.663  13.204
    2    HA   LEU  48           HA       LEU  48  -4.325  -3.255  10.865
    3    HB2  LEU  48           HB2      LEU  48  -2.276  -1.978  12.684
    4    HB3  LEU  48           HB3      LEU  48  -1.899  -2.699  11.119
    5    HG   LEU  48           HG       LEU  48  -3.922  -0.479  11.497
    6   HD13  LEU  48          HD11      LEU  48  -1.802   0.394  12.173
    7   HD12  LEU  48          HD12      LEU  48  -2.068   0.948  10.520
    8   HD11  LEU  48          HD13      LEU  48  -0.974  -0.400  10.835
    9   HD22  LEU  48          HD21      LEU  48  -4.384  -1.464   9.419
   10   HD21  LEU  48          HD22      LEU  48  -2.700  -1.901   9.133
   11   HD23  LEU  48          HD23      LEU  48  -3.216  -0.222   8.970

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ASN  49           H        ASN  49  -3.297  -3.652  14.217
    2    HA   ASN  49           HA       ASN  49  -1.697  -5.917  13.896
    3    HB2  ASN  49           HB2      ASN  49  -1.716  -4.596  15.943
    4    HB3  ASN  49           HB3      ASN  49  -3.388  -5.043  16.255
    5   HD21  ASN  49          HD21      ASN  49  -0.138  -6.503  15.867
    6   HD22  ASN  49          HD22      ASN  49  -0.432  -7.802  16.919

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLU  50           H        GLU  50  -5.168  -5.635  14.549
    2    HA   GLU  50           HA       GLU  50  -5.687  -8.434  14.656
    3    HB2  GLU  50           HB2      GLU  50  -7.274  -6.743  15.523
    4    HB3  GLU  50           HB3      GLU  50  -7.557  -6.178  13.874
    5    HG2  GLU  50           HG2      GLU  50  -8.424  -8.373  13.233
    6    HG3  GLU  50           HG3      GLU  50  -8.053  -9.017  14.828

  No H/Q in entry =           6
  In of MODEL   77
    1    H    ALA  51           H        ALA  51  -5.736  -6.036  12.059
    2    HA   ALA  51           HA       ALA  51  -6.715  -7.762  10.032
    3    HB2  ALA  51           HB1      ALA  51  -6.483  -5.951   8.663
    4    HB1  ALA  51           HB2      ALA  51  -4.845  -5.606   9.220
    5    HB3  ALA  51           HB3      ALA  51  -6.233  -5.090  10.182

  No H/Q in entry =           5
  In of MODEL   77
    1    H    HIS  52           H        HIS  52  -3.427  -6.864  11.033
    2    HA   HIS  52           HA       HIS  52  -2.022  -8.358   9.092
    3    HB2  HIS  52           HB2      HIS  52  -0.998  -6.623  10.545
    4    HB3  HIS  52           HB3      HIS  52  -1.165  -7.710  11.923
    5    HD1  HIS  52           HD1      HIS  52   0.170 -10.043  11.724
    6    HD2  HIS  52           HD2      HIS  52   1.256  -7.101   8.977
    7    HE1  HIS  52           HE1      HIS  52   2.406 -10.748  10.767
    8    HE2  HIS  52           HE2      HIS  52   3.082  -8.965   9.089

  No H/Q in entry =           8
  In of MODEL   77
    1    H    LEU  53           H        LEU  53  -3.253  -9.230  12.298
    2    HA   LEU  53           HA       LEU  53  -2.065 -11.778  12.498
    3    HB2  LEU  53           HB2      LEU  53  -4.555 -10.590  13.699
    4    HB3  LEU  53           HB3      LEU  53  -4.098 -12.266  13.995
    5    HG   LEU  53           HG       LEU  53  -2.190  -9.956  14.472
    6   HD13  LEU  53          HD11      LEU  53  -4.002  -9.509  15.950
    7   HD12  LEU  53          HD12      LEU  53  -2.814 -10.375  16.922
    8   HD11  LEU  53          HD13      LEU  53  -4.232 -11.218  16.307
    9   HD21  LEU  53          HD21      LEU  53  -2.254 -12.888  15.211
   10   HD23  LEU  53          HD22      LEU  53  -1.323 -11.741  16.167
   11   HD22  LEU  53          HD23      LEU  53  -0.937 -11.982  14.474

  No H/Q in entry =          11
  In of MODEL   77
    1    H    VAL  54           H        VAL  54  -5.165 -10.738  11.119
    2    HA   VAL  54           HA       VAL  54  -6.085 -13.329  10.427
    3    HB   VAL  54           HB       VAL  54  -6.715 -10.594   9.289
    4   HG12  VAL  54          HG11      VAL  54  -8.818 -11.965   8.466
    5   HG11  VAL  54          HG12      VAL  54  -7.712 -13.335   8.545
    6   HG13  VAL  54          HG13      VAL  54  -7.341 -11.961   7.504
    7   HG22  VAL  54          HG21      VAL  54  -7.634 -10.628  11.435
    8   HG21  VAL  54          HG22      VAL  54  -7.895 -12.371  11.415
    9   HG23  VAL  54          HG23      VAL  54  -8.967 -11.310  10.503

  No H/Q in entry =           9
  In of MODEL   77
    1    H    GLN  55           H        GLN  55  -4.194 -10.886   8.648
    2    HA   GLN  55           HA       GLN  55  -4.056 -12.351   6.232
    3    HB2  GLN  55           HB2      GLN  55  -3.443 -10.089   6.045
    4    HB3  GLN  55           HB3      GLN  55  -2.340 -10.170   7.416
    5    HG2  GLN  55           HG2      GLN  55  -0.619 -11.023   6.149
    6    HG3  GLN  55           HG3      GLN  55  -1.691 -11.994   5.149
    7   HE21  GLN  55          HE21      GLN  55  -1.693 -11.304   3.028
    8   HE22  GLN  55          HE22      GLN  55  -1.486  -9.701   2.518

  No H/Q in entry =           8
  In of MODEL   77
    1    H    THR  56           H        THR  56  -1.966 -12.338   9.124
    2    HA   THR  56           HA       THR  56   0.110 -13.946   8.218
    3    HB   THR  56           HB       THR  56  -1.143 -14.205  10.959
    4    HG1  THR  56           HG1      THR  56   0.487 -12.494  11.379
    5   HG21  THR  56          HG21      THR  56   1.589 -14.695   9.779
    6   HG23  THR  56          HG22      THR  56   0.583 -15.801  10.716
    7   HG22  THR  56          HG23      THR  56   1.369 -14.435  11.509

  No H/Q in entry =           7
  In of MODEL   77
    1    H    LYS  57           H        LYS  57  -3.022 -14.968   9.565
    2    HA   LYS  57           HA       LYS  57  -2.587 -17.766   9.322
    3    HB2  LYS  57           HB2      LYS  57  -4.401 -16.744  10.675
    4    HB3  LYS  57           HB3      LYS  57  -5.161 -16.161   9.201
    5    HG2  LYS  57           HG2      LYS  57  -6.303 -18.174   9.869
    6    HG3  LYS  57           HG3      LYS  57  -5.356 -18.547   8.432
    7    HD2  LYS  57           HD2      LYS  57  -3.689 -19.689   9.697
    8    HD3  LYS  57           HD3      LYS  57  -4.293 -19.042  11.222
    9    HE2  LYS  57           HE2      LYS  57  -6.373 -20.342  10.968
   10    HE3  LYS  57           HE3      LYS  57  -5.814 -20.972   9.419
   11    HZ1  LYS  57           HZ1      LYS  57  -3.770 -21.686  10.844
   12    HZ3  LYS  57           HZ2      LYS  57  -5.183 -22.632  10.821
   13    HZ2  LYS  57           HZ3      LYS  57  -4.878 -21.587  12.127

  No H/Q in entry =          13
  In of MODEL   77
    1    H    LEU  58           H        LEU  58  -3.895 -15.318   7.138
    2    HA   LEU  58           HA       LEU  58  -4.695 -17.140   5.128
    3    HB2  LEU  58           HB2      LEU  58  -4.074 -14.195   4.995
    4    HB3  LEU  58           HB3      LEU  58  -4.734 -15.129   3.652
    5    HG   LEU  58           HG       LEU  58  -6.028 -14.943   6.392
    6   HD11  LEU  58          HD11      LEU  58  -6.307 -13.295   3.898
    7   HD13  LEU  58          HD12      LEU  58  -6.304 -12.787   5.587
    8   HD12  LEU  58          HD13      LEU  58  -7.727 -13.574   4.908
    9   HD22  LEU  58          HD21      LEU  58  -6.995 -16.848   5.518
   10   HD21  LEU  58          HD22      LEU  58  -6.644 -16.398   3.849
   11   HD23  LEU  58          HD23      LEU  58  -8.009 -15.665   4.692

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  59           H        ILE  59  -1.558 -15.944   6.006
    2    HA   ILE  59           HA       ILE  59  -0.449 -16.677   3.376
    3    HB   ILE  59           HB       ILE  59   0.320 -14.615   4.946
    4   HG12  ILE  59          HG12      ILE  59   2.421 -16.274   3.540
    5   HG13  ILE  59          HG13      ILE  59   1.229 -15.346   2.666
    6   HG23  ILE  59          HG21      ILE  59   2.153 -15.106   6.350
    7   HG22  ILE  59          HG22      ILE  59   2.391 -16.693   5.656
    8   HG21  ILE  59          HG23      ILE  59   1.024 -16.386   6.726
    9   HD11  ILE  59          HD11      ILE  59   1.955 -13.315   3.979
   10   HD13  ILE  59          HD12      ILE  59   3.173 -13.949   2.876
   11   HD12  ILE  59          HD13      ILE  59   3.284 -14.289   4.603

  No H/Q in entry =          11
  In of MODEL   77
    1    H    GLU  60           H        GLU  60  -0.484 -17.782   6.744
    2    HA   GLU  60           HA       GLU  60   1.539 -19.770   6.492
    3    HB2  GLU  60           HB2      GLU  60   0.769 -18.984   8.677
    4    HB3  GLU  60           HB3      GLU  60  -0.840 -19.631   8.364
    5    HG2  GLU  60           HG2      GLU  60   0.106 -21.912   8.223
    6    HG3  GLU  60           HG3      GLU  60   1.713 -21.261   8.541

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLY  61           H        GLY  61  -1.970 -19.851   5.985
    2    HA3  GLY  61           HA2      GLY  61  -1.729 -22.645   5.030
    3    HA2  GLY  61           HA3      GLY  61  -3.214 -21.902   5.614

  No H/Q in entry =           3
  In of MODEL   77
    1    H    ASP  62           H        ASP  62  -0.964 -20.336   3.423
    2    HA   ASP  62           HA       ASP  62  -2.967 -19.609   1.578
    3    HB2  ASP  62           HB2      ASP  62  -1.070 -18.870   0.181
    4    HB3  ASP  62           HB3      ASP  62  -0.893 -18.348   1.853

  No H/Q in entry =           4
  In of MODEL   77
    1    H    ALA  63           H        ALA  63  -0.746 -22.383   1.622
    2    HA   ALA  63           HA       ALA  63  -1.799 -23.276  -0.996
    3    HB1  ALA  63           HB1      ALA  63   0.590 -24.086   0.636
    4    HB3  ALA  63           HB2      ALA  63   0.547 -23.389  -0.983
    5    HB2  ALA  63           HB3      ALA  63   0.010 -25.050  -0.724

  No H/Q in entry =           5
  In of MODEL   77
    1    H    GLY  64           H        GLY  64  -1.733 -25.913  -0.875
    2    HA3  GLY  64           HA2      GLY  64  -2.438 -27.847   0.347
    3    HA2  GLY  64           HA3      GLY  64  -3.231 -26.790   1.503

  No H/Q in entry =           3
  In of MODEL   77
    1    H    GLU  65           H        GLU  65  -4.296 -25.243  -0.967
    2    HA   GLU  65           HA       GLU  65  -6.824 -26.509  -0.999
    3    HB2  GLU  65           HB2      GLU  65  -5.657 -24.346  -2.748
    4    HB3  GLU  65           HB3      GLU  65  -7.339 -24.872  -2.831
    5    HG2  GLU  65           HG2      GLU  65  -7.669 -24.298  -0.476
    6    HG3  GLU  65           HG3      GLU  65  -5.973 -23.843  -0.330

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLY  66           H        GLY  66  -4.137 -26.580  -3.194
    2    HA3  GLY  66           HA2      GLY  66  -4.908 -29.037  -4.394
    3    HA2  GLY  66           HA3      GLY  66  -5.184 -27.695  -5.488

  No H/Q in entry =           3
  In of MODEL   77
    1    H    LYS  67           H        LYS  67  -3.425 -26.523  -6.281
    2    HA   LYS  67           HA       LYS  67  -1.002 -28.102  -6.521
    3    HB2  LYS  67           HB2      LYS  67  -2.031 -25.680  -7.988
    4    HB3  LYS  67           HB3      LYS  67  -0.478 -26.451  -8.336
    5    HG2  LYS  67           HG2      LYS  67  -1.628 -28.603  -8.720
    6    HG3  LYS  67           HG3      LYS  67  -3.178 -27.836  -8.382
    7    HD2  LYS  67           HD2      LYS  67  -2.857 -26.327 -10.306
    8    HD3  LYS  67           HD3      LYS  67  -1.301 -27.090 -10.644
    9    HE2  LYS  67           HE2      LYS  67  -2.421 -29.258 -10.978
   10    HE3  LYS  67           HE3      LYS  67  -3.979 -28.514 -10.619
   11    HZ2  LYS  67           HZ1      LYS  67  -2.778 -28.692 -13.077
   12    HZ1  LYS  67           HZ2      LYS  67  -2.571 -27.069 -12.623
   13    HZ3  LYS  67           HZ3      LYS  67  -4.127 -27.747 -12.678

  No H/Q in entry =          13
  In of MODEL   77
    1    H    MET  68           H        MET  68   0.935 -26.457  -7.112
    2    HA   MET  68           HA       MET  68   2.032 -25.682  -4.641
    3    HB2  MET  68           HB2      MET  68   2.871 -25.052  -7.470
    4    HB3  MET  68           HB3      MET  68   3.859 -24.736  -6.043
    5    HG2  MET  68           HG2      MET  68   2.777 -27.458  -6.821
    6    HG3  MET  68           HG3      MET  68   4.425 -26.908  -7.130
    7    HE1  MET  68           HE1      MET  68   6.030 -26.269  -5.665
    8    HE3  MET  68           HE2      MET  68   6.236 -26.751  -3.983
    9    HE2  MET  68           HE3      MET  68   5.305 -25.307  -4.371

  No H/Q in entry =           9
  In of MODEL   77
    1    H    LYS  69           H        LYS  69   0.447 -23.751  -7.153
    2    HA   LYS  69           HA       LYS  69   1.255 -21.222  -6.401
    3    HB2  LYS  69           HB2      LYS  69  -1.195 -22.228  -7.759
    4    HB3  LYS  69           HB3      LYS  69  -1.070 -20.520  -7.321
    5    HG2  LYS  69           HG2      LYS  69  -0.167 -21.206  -9.640
    6    HG3  LYS  69           HG3      LYS  69   0.872 -20.203  -8.627
    7    HD2  LYS  69           HD2      LYS  69   2.224 -22.058  -7.999
    8    HD3  LYS  69           HD3      LYS  69   1.049 -23.219  -8.620
    9    HE2  LYS  69           HE2      LYS  69   1.585 -22.769 -10.855
   10    HE3  LYS  69           HE3      LYS  69   2.265 -21.187 -10.472
   11    HZ3  LYS  69           HZ1      LYS  69   4.209 -22.250 -10.587
   12    HZ2  LYS  69           HZ2      LYS  69   3.508 -23.788 -10.421
   13    HZ1  LYS  69           HZ3      LYS  69   3.828 -22.845  -9.045

  No H/Q in entry =          13
  In of MODEL   77
    1    H    VAL  70           H        VAL  70  -0.267 -19.431  -5.595
    2    HA   VAL  70           HA       VAL  70  -1.602 -20.282  -3.086
    3    HB   VAL  70           HB       VAL  70  -0.740 -18.196  -2.055
    4   HG11  VAL  70          HG11      VAL  70   1.408 -19.963  -3.265
    5   HG13  VAL  70          HG12      VAL  70   0.517 -20.294  -1.777
    6   HG12  VAL  70          HG13      VAL  70   1.617 -18.918  -1.859
    7   HG21  VAL  70          HG21      VAL  70   0.731 -17.908  -4.706
    8   HG23  VAL  70          HG22      VAL  70   1.102 -16.970  -3.260
    9   HG22  VAL  70          HG23      VAL  70  -0.467 -16.797  -4.040

  No H/Q in entry =           9
  In of MODEL   77
    1    H    SER  71           H        SER  71  -3.060 -18.537  -2.248
    2    HA   SER  71           HA       SER  71  -5.036 -17.835  -4.141
    3    HB2  SER  71           HB2      SER  71  -5.387 -18.079  -1.639
    4    HB3  SER  71           HB3      SER  71  -4.575 -16.530  -1.437
    5    HG   SER  71           HG       SER  71  -6.203 -15.771  -3.036

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LEU  72           H        LEU  72  -5.168 -16.203  -5.497
    2    HA   LEU  72           HA       LEU  72  -3.050 -14.399  -5.969
    3    HB2  LEU  72           HB2      LEU  72  -5.909 -14.452  -6.930
    4    HB3  LEU  72           HB3      LEU  72  -4.715 -13.287  -7.493
    5    HG   LEU  72           HG       LEU  72  -4.282 -16.288  -7.633
    6   HD13  LEU  72          HD11      LEU  72  -4.952 -16.169  -9.965
    7   HD12  LEU  72          HD12      LEU  72  -5.204 -14.427  -9.843
    8   HD11  LEU  72          HD13      LEU  72  -6.266 -15.535  -8.974
    9   HD23  LEU  72          HD21      LEU  72  -2.723 -15.418  -9.539
   10   HD22  LEU  72          HD22      LEU  72  -2.169 -15.227  -7.885
   11   HD21  LEU  72          HD23      LEU  72  -2.867 -13.856  -8.741

  No H/Q in entry =          11
  In of MODEL   77
    1    H    VAL  73           H        VAL  73  -6.150 -14.031  -4.354
    2    HA   VAL  73           HA       VAL  73  -6.186 -11.260  -4.002
    3    HB   VAL  73           HB       VAL  73  -7.908 -11.614  -2.421
    4   HG13  VAL  73          HG11      VAL  73  -9.351 -13.161  -3.584
    5   HG12  VAL  73          HG12      VAL  73  -7.968 -14.022  -4.256
    6   HG11  VAL  73          HG13      VAL  73  -8.328 -12.379  -4.789
    7   HG22  VAL  73          HG21      VAL  73  -7.087 -13.060  -0.791
    8   HG21  VAL  73          HG22      VAL  73  -6.480 -14.215  -1.977
    9   HG23  VAL  73          HG23      VAL  73  -8.210 -14.122  -1.640

  No H/Q in entry =           9
  In of MODEL   77
    1    H    LEU  74           H        LEU  74  -4.265 -13.635  -2.410
    2    HA   LEU  74           HA       LEU  74  -3.861 -12.497   0.115
    3    HB2  LEU  74           HB2      LEU  74  -3.082 -14.717  -0.377
    4    HB3  LEU  74           HB3      LEU  74  -2.024 -14.112  -1.651
    5    HG   LEU  74           HG       LEU  74  -0.717 -12.859   0.033
    6   HD13  LEU  74          HD11      LEU  74  -2.283 -12.365   1.752
    7   HD12  LEU  74          HD12      LEU  74  -1.205 -13.562   2.472
    8   HD11  LEU  74          HD13      LEU  74  -2.793 -14.048   1.878
    9   HD21  LEU  74          HD21      LEU  74  -0.533 -15.432  -0.572
   10   HD23  LEU  74          HD22      LEU  74  -0.944 -15.593   1.120
   11   HD22  LEU  74          HD23      LEU  74   0.493 -14.707   0.664

  No H/Q in entry =          11
  In of MODEL   77
    1    H    VAL  75           H        VAL  75  -1.955 -12.109  -2.833
    2    HA   VAL  75           HA       VAL  75  -0.155 -10.192  -1.814
    3    HB   VAL  75           HB       VAL  75  -1.100 -10.664  -4.643
    4   HG12  VAL  75          HG11      VAL  75   0.982  -9.375  -5.246
    5   HG11  VAL  75          HG12      VAL  75   1.177  -8.977  -3.545
    6   HG13  VAL  75          HG13      VAL  75  -0.219  -8.382  -4.430
    7   HG23  VAL  75          HG21      VAL  75   1.215 -11.714  -4.759
    8   HG22  VAL  75          HG22      VAL  75   0.058 -12.580  -3.745
    9   HG21  VAL  75          HG23      VAL  75   1.292 -11.559  -3.003

  No H/Q in entry =           9
  In of MODEL   77
    1    H    GLU  76           H        GLU  76  -3.297  -9.832  -3.486
    2    HA   GLU  76           HA       GLU  76  -3.338  -7.018  -3.586
    3    HB2  GLU  76           HB2      GLU  76  -4.995  -8.476  -4.749
    4    HB3  GLU  76           HB3      GLU  76  -5.671  -8.928  -3.191
    5    HG2  GLU  76           HG2      GLU  76  -6.310  -6.583  -2.770
    6    HG3  GLU  76           HG3      GLU  76  -5.640  -6.099  -4.315

  No H/Q in entry =           6
  In of MODEL   77
    1    H    ALA  77           H        ALA  77  -4.468  -9.243  -1.053
    2    HA   ALA  77           HA       ALA  77  -5.425  -7.238   0.703
    3    HB3  ALA  77           HB1      ALA  77  -5.564  -8.938   2.341
    4    HB1  ALA  77           HB2      ALA  77  -4.260  -9.869   1.607
    5    HB2  ALA  77           HB3      ALA  77  -5.828  -9.770   0.810

  No H/Q in entry =           5
  In of MODEL   77
    1    H    GLN  78           H        GLN  78  -2.282  -8.799   0.352
    2    HA   GLN  78           HA       GLN  78  -1.030  -7.645   2.608
    3    HB2  GLN  78           HB2      GLN  78  -0.170  -9.588   1.255
    4    HB3  GLN  78           HB3      GLN  78   0.276  -8.444  -0.007
    5    HG2  GLN  78           HG2      GLN  78   1.731  -7.253   1.586
    6    HG3  GLN  78           HG3      GLN  78   1.291  -8.402   2.848
    7   HE21  GLN  78          HE21      GLN  78   4.015  -8.134   2.033
    8   HE22  GLN  78          HE22      GLN  78   4.480  -9.556   1.232

  No H/Q in entry =           8
  In of MODEL   77
    1    H    LEU  79           H        LEU  79  -1.377  -6.581  -0.740
    2    HA   LEU  79           HA       LEU  79   0.319  -4.361  -0.718
    3    HB2  LEU  79           HB2      LEU  79  -0.702  -5.163  -2.777
    4    HB3  LEU  79           HB3      LEU  79  -2.307  -4.764  -2.175
    5    HG   LEU  79           HG       LEU  79  -1.752  -2.379  -2.146
    6   HD13  LEU  79          HD11      LEU  79   0.487  -2.146  -1.624
    7   HD12  LEU  79          HD12      LEU  79   0.545  -1.858  -3.362
    8   HD11  LEU  79          HD13      LEU  79   0.989  -3.438  -2.715
    9   HD23  LEU  79          HD21      LEU  79  -1.106  -2.182  -4.696
   10   HD22  LEU  79          HD22      LEU  79  -2.638  -2.924  -4.244
   11   HD21  LEU  79          HD23      LEU  79  -1.268  -3.938  -4.683

  No H/Q in entry =          11
  In of MODEL   77
    1    H    HIS  80           H        HIS  80  -3.152  -4.508   0.092
    2    HA   HIS  80           HA       HIS  80  -3.334  -1.751   0.756
    3    HB2  HIS  80           HB2      HIS  80  -5.048  -4.151   1.066
    4    HB3  HIS  80           HB3      HIS  80  -5.367  -2.810   2.170
    5    HD1  HIS  80           HD1      HIS  80  -6.972  -1.165   1.256
    6    HD2  HIS  80           HD2      HIS  80  -4.775  -2.987  -1.783
    7    HE1  HIS  80           HE1      HIS  80  -7.798  -0.163  -0.927
    8    HE2  HIS  80           HE2      HIS  80  -6.465  -1.268  -2.788

  No H/Q in entry =           8
  In of MODEL   77
    1    H    LEU  81           H        LEU  81  -2.868  -4.649   2.750
    2    HA   LEU  81           HA       LEU  81  -2.860  -3.303   5.235
    3    HB2  LEU  81           HB2      LEU  81  -1.651  -5.925   4.360
    4    HB3  LEU  81           HB3      LEU  81  -1.629  -5.367   6.034
    5    HG   LEU  81           HG       LEU  81  -4.169  -5.606   4.395
    6   HD12  LEU  81          HD11      LEU  81  -4.489  -7.670   5.940
    7   HD11  LEU  81          HD12      LEU  81  -2.738  -7.609   6.134
    8   HD13  LEU  81          HD13      LEU  81  -3.440  -7.835   4.531
    9   HD23  LEU  81          HD21      LEU  81  -5.024  -5.805   6.892
   10   HD22  LEU  81          HD22      LEU  81  -4.688  -4.218   6.204
   11   HD21  LEU  81          HD23      LEU  81  -3.510  -4.985   7.269

  No H/Q in entry =          11
  In of MODEL   77
    1    H    MET  82           H        MET  82  -0.174  -4.220   3.076
    2    HA   MET  82           HA       MET  82   1.906  -3.337   4.769
    3    HB2  MET  82           HB2      MET  82   1.703  -3.677   1.776
    4    HB3  MET  82           HB3      MET  82   3.185  -3.114   2.546
    5    HG2  MET  82           HG2      MET  82   1.760  -5.696   3.263
    6    HG3  MET  82           HG3      MET  82   3.137  -5.594   2.169
    7    HE3  MET  82           HE1      MET  82   6.148  -4.875   4.166
    8    HE2  MET  82           HE2      MET  82   5.235  -3.503   3.545
    9    HE1  MET  82           HE3      MET  82   5.320  -4.993   2.609

  No H/Q in entry =           9
  In of MODEL   77
    1    H    THR  83           H        THR  83   0.105  -1.684   2.205
    2    HA   THR  83           HA       THR  83   1.531   0.756   2.299
    3    HB   THR  83           HB       THR  83  -0.636   1.694   1.303
    4    HG1  THR  83           HG1      THR  83  -2.293   0.406   1.189
    5   HG22  THR  83          HG21      THR  83  -0.367  -0.125  -0.697
    6   HG21  THR  83          HG22      THR  83   1.128  -0.426   0.186
    7   HG23  THR  83          HG23      THR  83   0.778   1.189  -0.430

  No H/Q in entry =           7
  In of MODEL   77
    1    H    SER  84           H        SER  84  -1.488  -0.259   3.886
    2    HA   SER  84           HA       SER  84  -1.976   2.173   5.230
    3    HB2  SER  84           HB2      SER  84  -2.828  -0.660   5.790
    4    HB3  SER  84           HB3      SER  84  -3.318   0.684   6.821
    5    HG   SER  84           HG       SER  84  -3.766   0.373   4.027

  No H/Q in entry =           5
  In of MODEL   77
    1    H    MET  85           H        MET  85  -0.288  -0.769   6.365
    2    HA   MET  85           HA       MET  85   0.226   0.153   8.972
    3    HB2  MET  85           HB2      MET  85   0.506  -2.192   8.293
    4    HB3  MET  85           HB3      MET  85   1.897  -1.736   7.308
    5    HG2  MET  85           HG2      MET  85   3.063  -0.908   9.315
    6    HG3  MET  85           HG3      MET  85   1.667  -1.332  10.306
    7    HE2  MET  85           HE1      MET  85   1.931  -4.871  11.128
    8    HE1  MET  85           HE2      MET  85   0.762  -3.621  10.711
    9    HE3  MET  85           HE3      MET  85   2.060  -3.261  11.844

  No H/Q in entry =           9
  In of MODEL   77
    1    H    LEU  86           H        LEU  86   2.174   0.398   6.029
    2    HA   LEU  86           HA       LEU  86   4.392   1.694   7.195
    3    HB2  LEU  86           HB2      LEU  86   4.203   0.613   4.885
    4    HB3  LEU  86           HB3      LEU  86   3.407   2.100   4.369
    5    HG   LEU  86           HG       LEU  86   5.439   3.333   5.359
    6   HD11  LEU  86          HD11      LEU  86   6.124   0.717   6.161
    7   HD13  LEU  86          HD12      LEU  86   7.136   2.155   6.263
    8   HD12  LEU  86          HD13      LEU  86   7.245   1.107   4.852
    9   HD23  LEU  86          HD21      LEU  86   6.154   1.566   3.011
   10   HD22  LEU  86          HD22      LEU  86   6.558   3.260   3.275
   11   HD21  LEU  86          HD23      LEU  86   4.904   2.803   2.869

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ALA  87           H        ALA  87   1.494   2.956   5.598
    2    HA   ALA  87           HA       ALA  87   2.106   5.682   5.685
    3    HB1  ALA  87           HB1      ALA  87  -0.212   4.070   5.134
    4    HB3  ALA  87           HB2      ALA  87   0.112   5.728   4.635
    5    HB2  ALA  87           HB3      ALA  87  -0.690   5.412   6.175

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ARG  88           H        ARG  88   0.393   3.691   8.067
    2    HA   ARG  88           HA       ARG  88  -0.113   5.744   9.912
    3    HB2  ARG  88           HB2      ARG  88  -1.067   3.398   9.974
    4    HB3  ARG  88           HB3      ARG  88   0.467   2.888  10.687
    5    HG2  ARG  88           HG2      ARG  88  -0.003   4.965  12.305
    6    HG3  ARG  88           HG3      ARG  88  -1.670   4.651  11.842
    7    HD2  ARG  88           HD2      ARG  88  -1.794   2.802  13.088
    8    HD3  ARG  88           HD3      ARG  88  -0.206   2.210  12.563
    9    HE   ARG  88           HE       ARG  88  -0.742   3.477  15.015
   10   HH21  ARG  88          HH11      ARG  88   0.817   4.479  16.260
   11   HH22  ARG  88          HH12      ARG  88   2.342   4.896  15.562
   12   HH11  ARG  88          HH21      ARG  88   1.550   3.644  12.448
   13   HH12  ARG  88          HH22      ARG  88   2.766   4.407  13.416

  No H/Q in entry =          13
  In of MODEL   77
    1    H    GLU  89           H        GLU  89   2.670   3.508   9.701
    2    HA   GLU  89           HA       GLU  89   3.927   4.389  12.050
    3    HB2  GLU  89           HB2      GLU  89   4.579   2.366  10.709
    4    HB3  GLU  89           HB3      GLU  89   5.366   3.456   9.566
    5    HG2  GLU  89           HG2      GLU  89   6.849   4.293  11.316
    6    HG3  GLU  89           HG3      GLU  89   6.003   3.342  12.532

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LEU  90           H        LEU  90   4.265   5.544   8.724
    2    HA   LEU  90           HA       LEU  90   6.205   7.533   9.317
    3    HB2  LEU  90           HB2      LEU  90   4.206   7.214   7.081
    4    HB3  LEU  90           HB3      LEU  90   5.444   8.477   7.108
    5    HG   LEU  90           HG       LEU  90   6.099   5.537   7.445
    6   HD12  LEU  90          HD11      LEU  90   6.860   5.766   5.008
    7   HD11  LEU  90          HD12      LEU  90   5.853   7.212   4.955
    8   HD13  LEU  90          HD13      LEU  90   5.122   5.643   5.295
    9   HD22  LEU  90          HD21      LEU  90   8.000   6.675   8.135
   10   HD21  LEU  90          HD22      LEU  90   7.663   8.082   7.126
   11   HD23  LEU  90          HD23      LEU  90   8.317   6.614   6.402

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  91           H        ILE  91   2.667   7.569   9.153
    2    HA   ILE  91           HA       ILE  91   2.338  10.343   9.602
    3    HB   ILE  91           HB       ILE  91   0.531   7.977  10.137
    4   HG12  ILE  91          HG12      ILE  91   0.304  10.260   8.151
    5   HG13  ILE  91          HG13      ILE  91   1.158   8.761   7.783
    6   HG22  ILE  91          HG21      ILE  91  -1.190  10.045  10.193
    7   HG21  ILE  91          HG22      ILE  91   0.213  10.868  10.872
    8   HG23  ILE  91          HG23      ILE  91  -0.435   9.434  11.666
    9   HD13  ILE  91          HD11      ILE  91  -0.794   7.484   7.819
   10   HD12  ILE  91          HD12      ILE  91  -1.372   9.002   7.134
   11   HD11  ILE  91          HD13      ILE  91  -1.652   8.639   8.838

  No H/Q in entry =          11
  In of MODEL   77
    1    H    THR  92           H        THR  92   2.717   7.600  11.805
    2    HA   THR  92           HA       THR  92   2.270   8.976  14.227
    3    HB   THR  92           HB       THR  92   4.070   6.632  13.571
    4    HG1  THR  92           HG1      THR  92   2.097   5.885  13.461
    5   HG22  THR  92          HG21      THR  92   3.673   6.351  16.203
    6   HG21  THR  92          HG22      THR  92   3.617   8.110  16.129
    7   HG23  THR  92          HG23      THR  92   5.049   7.247  15.563

  No H/Q in entry =           7
  In of MODEL   77
    1    H    GLU  93           H        GLU  93   5.227   8.513  12.307
    2    HA   GLU  93           HA       GLU  93   6.980   9.932  14.011
    3    HB2  GLU  93           HB2      GLU  93   7.081   9.616  10.997
    4    HB3  GLU  93           HB3      GLU  93   8.419  10.140  12.017
    5    HG2  GLU  93           HG2      GLU  93   6.995   7.510  12.459
    6    HG3  GLU  93           HG3      GLU  93   8.385   7.656  11.389

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LEU  94           H        LEU  94   4.948  10.955  11.289
    2    HA   LEU  94           HA       LEU  94   5.765  13.656  11.191
    3    HB2  LEU  94           HB2      LEU  94   3.173  12.301  10.426
    4    HB3  LEU  94           HB3      LEU  94   3.440  14.027  10.185
    5    HG   LEU  94           HG       LEU  94   5.453  12.031   9.145
    6   HD11  LEU  94          HD11      LEU  94   2.719  12.592   8.070
    7   HD13  LEU  94          HD12      LEU  94   3.696  11.132   7.950
    8   HD12  LEU  94          HD13      LEU  94   4.042  12.510   6.906
    9   HD23  LEU  94          HD21      LEU  94   5.719  13.865   7.423
   10   HD22  LEU  94          HD22      LEU  94   6.128  14.357   9.067
   11   HD21  LEU  94          HD23      LEU  94   4.582  14.831   8.361

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  95           H        ILE  95   3.212  12.050  13.071
    2    HA   ILE  95           HA       ILE  95   2.173  14.404  14.261
    3    HB   ILE  95           HB       ILE  95   2.175  11.523  15.187
    4   HG12  ILE  95          HG12      ILE  95  -0.034  13.304  14.126
    5   HG13  ILE  95          HG13      ILE  95   0.923  12.241  13.099
    6   HG21  ILE  95          HG21      ILE  95   0.896  14.000  16.381
    7   HG23  ILE  95          HG22      ILE  95   1.936  12.828  17.191
    8   HG22  ILE  95          HG23      ILE  95   0.302  12.373  16.709
    9   HD13  ILE  95          HD11      ILE  95   0.009  10.306  14.015
   10   HD12  ILE  95          HD12      ILE  95  -1.370  11.400  14.084
   11   HD11  ILE  95          HD13      ILE  95  -0.412  11.099  15.534

  No H/Q in entry =          11
  In of MODEL   77
    1    H    GLU  96           H        GLU  96   4.756  12.176  15.269
    2    HA   GLU  96           HA       GLU  96   5.303  13.374  17.763
    3    HB2  GLU  96           HB2      GLU  96   6.247  11.212  17.121
    4    HB3  GLU  96           HB3      GLU  96   7.189  11.981  15.846
    5    HG2  GLU  96           HG2      GLU  96   8.832  12.525  17.315
    6    HG3  GLU  96           HG3      GLU  96   7.683  13.342  18.365

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LEU  97           H        LEU  97   6.396  14.141  14.482
    2    HA   LEU  97           HA       LEU  97   8.284  16.132  15.202
    3    HB2  LEU  97           HB2      LEU  97   6.703  15.587  12.700
    4    HB3  LEU  97           HB3      LEU  97   7.726  17.015  12.826
    5    HG   LEU  97           HG       LEU  97   8.744  14.215  13.392
    6   HD12  LEU  97          HD11      LEU  97   9.753  14.404  11.079
    7   HD11  LEU  97          HD12      LEU  97   8.707  15.798  10.810
    8   HD13  LEU  97          HD13      LEU  97   8.001  14.208  11.102
    9   HD23  LEU  97          HD21      LEU  97  10.921  15.487  12.659
   10   HD22  LEU  97          HD22      LEU  97  10.295  15.759  14.285
   11   HD21  LEU  97          HD23      LEU  97   9.990  16.942  13.014

  No H/Q in entry =          11
  In of MODEL   77
    1    H    HIS  98           H        HIS  98   4.797  16.277  14.531
    2    HA   HIS  98           HA       HIS  98   4.504  19.077  14.663
    3    HB2  HIS  98           HB2      HIS  98   2.605  16.832  15.381
    4    HB3  HIS  98           HB3      HIS  98   2.142  18.534  15.434
    5    HD1  HIS  98           HD1      HIS  98   3.168  15.815  13.035
    6    HD2  HIS  98           HD2      HIS  98   1.803  19.752  12.905
    7    HE1  HIS  98           HE1      HIS  98   2.622  16.304  10.608
    8    HE2  HIS  98           HE2      HIS  98   1.794  18.696  10.508

  No H/Q in entry =           8
  In of MODEL   77
    1    H    GLU  99           H        GLU  99   4.619  16.590  17.164
    2    HA   GLU  99           HA       GLU  99   4.005  18.287  19.358
    3    HB2  GLU  99           HB2      GLU  99   3.909  15.805  19.456
    4    HB3  GLU  99           HB3      GLU  99   5.669  15.755  19.356
    5    HG2  GLU  99           HG2      GLU  99   5.851  17.048  21.431
    6    HG3  GLU  99           HG3      GLU  99   4.098  17.193  21.518

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LYS 100           H        LYS 100   7.063  17.347  17.809
    2    HA   LYS 100           HA       LYS 100   8.713  18.745  19.673
    3    HB2  LYS 100           HB2      LYS 100   9.223  17.817  16.837
    4    HB3  LYS 100           HB3      LYS 100  10.450  18.584  17.851
    5    HG2  LYS 100           HG2      LYS 100  10.061  16.836  19.591
    6    HG3  LYS 100           HG3      LYS 100   8.932  16.034  18.494
    7    HD2  LYS 100           HD2      LYS 100  10.733  15.746  16.836
    8    HD3  LYS 100           HD3      LYS 100  11.867  16.559  17.917
    9    HE2  LYS 100           HE2      LYS 100  11.458  14.806  19.634
   10    HE3  LYS 100           HE3      LYS 100  10.386  13.972  18.504
   11    HZ1  LYS 100           HZ1      LYS 100  13.212  14.634  17.862
   12    HZ3  LYS 100           HZ2      LYS 100  12.169  13.582  17.029
   13    HZ2  LYS 100           HZ3      LYS 100  12.749  13.162  18.571

  No H/Q in entry =          13
  In of MODEL   77
    1    H    LEU 101           H        LEU 101   7.036  19.674  16.709
    2    HA   LEU 101           HA       LEU 101   8.258  22.228  16.379
    3    HB2  LEU 101           HB2      LEU 101   5.664  21.001  15.480
    4    HB3  LEU 101           HB3      LEU 101   5.921  22.731  15.273
    5    HG   LEU 101           HG       LEU 101   7.956  20.709  14.318
    6   HD12  LEU 101          HD11      LEU 101   6.815  21.217  12.027
    7   HD11  LEU 101          HD12      LEU 101   5.412  21.652  13.001
    8   HD13  LEU 101          HD13      LEU 101   6.072  20.019  13.086
    9   HD21  LEU 101          HD21      LEU 101   7.339  23.623  13.758
   10   HD23  LEU 101          HD22      LEU 101   8.322  22.660  12.656
   11   HD22  LEU 101          HD23      LEU 101   8.857  22.917  14.317

  No H/Q in entry =          11
  In of MODEL   77
    1    H    LYS 102           H        LYS 102   6.706  21.095  18.987
    2    HA   LYS 102           HA       LYS 102   6.067  22.190  20.916
    3    HB2  LYS 102           HB2      LYS 102   7.361  24.176  19.797
    4    HB3  LYS 102           HB3      LYS 102   5.765  24.785  19.414
    5    HG2  LYS 102           HG2      LYS 102   7.129  24.526  22.072
    6    HG3  LYS 102           HG3      LYS 102   6.183  25.857  21.438
    7    HD2  LYS 102           HD2      LYS 102   4.928  23.225  22.312
    8    HD3  LYS 102           HD3      LYS 102   5.175  24.585  23.396
    9    HE2  LYS 102           HE2      LYS 102   2.902  24.189  21.897
   10    HE3  LYS 102           HE3      LYS 102   3.406  25.733  22.580
   11    HZ2  LYS 102           HZ1      LYS 102   2.887  25.842  20.198
   12    HZ1  LYS 102           HZ2      LYS 102   4.147  24.756  19.882
   13    HZ3  LYS 102           HZ3      LYS 102   4.491  26.286  20.526

  No H/Q in entry =          13
  In of MODEL   77
    1    H    ALA 103           H        ALA 103   4.447  23.736  18.140
    2    HA   ALA 103           HA       ALA 103   1.990  24.320  19.014
    3    HB1  ALA 103           HB1      ALA 103   1.100  23.481  16.767
    4    HB2  ALA 103           HB2      ALA 103   2.747  22.939  16.445
    5    HB3  ALA 103           HB3      ALA 103   2.417  24.652  16.710

  No H/Q in entry =           5
  In of MODEL   77
    1    H1   ALA   1           H3       ALA   1  10.572 -20.212  -6.208
    2    H2   ALA   1           H2       ALA   1   9.614 -20.416  -7.599
    3    H3   ALA   1           H1       ALA   1   9.167 -21.160  -6.137
    4    HA   ALA   1           HA       ALA   1  10.204 -22.973  -6.872
    5    HB1  ALA   1           HB1      ALA   1  10.311 -22.614  -9.147
    6    HB2  ALA   1           HB2      ALA   1  12.037 -22.470  -8.810
    7    HB3  ALA   1           HB3      ALA   1  11.045 -21.020  -8.966

  No H/Q in entry =           7
  In of MODEL   77
    1    H    GLU   2           H        GLU   2  12.484 -23.932  -6.919
    2    HA   GLU   2           HA       GLU   2  13.856 -23.855  -4.701
    3    HB2  GLU   2           HB2      GLU   2  15.225 -23.729  -7.394
    4    HB3  GLU   2           HB3      GLU   2  15.944 -24.343  -5.906
    5    HG2  GLU   2           HG2      GLU   2  14.920 -26.356  -6.151
    6    HG3  GLU   2           HG3      GLU   2  13.353 -25.604  -6.417

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLU   3           H        GLU   3  15.645 -21.998  -7.095
    2    HA   GLU   3           HA       GLU   3  16.796 -20.315  -5.130
    3    HB2  GLU   3           HB2      GLU   3  16.753 -20.313  -8.141
    4    HB3  GLU   3           HB3      GLU   3  17.500 -18.986  -7.250
    5    HG2  GLU   3           HG2      GLU   3  19.153 -20.367  -6.320
    6    HG3  GLU   3           HG3      GLU   3  18.202 -21.830  -6.545

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LEU   4           H        LEU   4  14.529 -19.458  -7.771
    2    HA   LEU   4           HA       LEU   4  14.070 -16.847  -7.162
    3    HB2  LEU   4           HB2      LEU   4  11.890 -18.813  -7.902
    4    HB3  LEU   4           HB3      LEU   4  11.823 -17.064  -8.101
    5    HG   LEU   4           HG       LEU   4  13.786 -18.936  -9.465
    6   HD13  LEU   4          HD11      LEU   4  12.493 -18.782 -11.381
    7   HD12  LEU   4          HD12      LEU   4  11.790 -17.234 -10.917
    8   HD11  LEU   4          HD13      LEU   4  11.227 -18.722 -10.158
    9   HD23  LEU   4          HD21      LEU   4  14.138 -16.692 -10.816
   10   HD22  LEU   4          HD22      LEU   4  14.990 -16.938  -9.292
   11   HD21  LEU   4          HD23      LEU   4  13.541 -15.936  -9.338

  No H/Q in entry =          11
  In of MODEL   77
    1    H    GLU   5           H        GLU   5  12.567 -19.625  -5.526
    2    HA   GLU   5           HA       GLU   5  10.888 -18.047  -3.831
    3    HB2  GLU   5           HB2      GLU   5  10.450 -20.420  -4.350
    4    HB3  GLU   5           HB3      GLU   5  11.884 -20.866  -3.424
    5    HG2  GLU   5           HG2      GLU   5  10.929 -19.850  -1.409
    6    HG3  GLU   5           HG3      GLU   5   9.510 -19.340  -2.324

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLU   6           H        GLU   6  14.026 -19.639  -3.374
    2    HA   GLU   6           HA       GLU   6  14.371 -18.783  -0.675
    3    HB2  GLU   6           HB2      GLU   6  16.334 -19.730  -2.774
    4    HB3  GLU   6           HB3      GLU   6  16.780 -19.386  -1.101
    5    HG2  GLU   6           HG2      GLU   6  15.198 -21.066  -0.299
    6    HG3  GLU   6           HG3      GLU   6  14.649 -21.371  -1.947

  No H/Q in entry =           6
  In of MODEL   77
    1    H    VAL   7           H        VAL   7  15.155 -17.460  -3.821
    2    HA   VAL   7           HA       VAL   7  16.845 -15.339  -2.950
    3    HB   VAL   7           HB       VAL   7  15.149 -15.697  -5.434
    4   HG11  VAL   7          HG11      VAL   7  17.046 -13.491  -4.614
    5   HG13  VAL   7          HG12      VAL   7  15.407 -13.342  -5.245
    6   HG12  VAL   7          HG13      VAL   7  16.719 -13.850  -6.309
    7   HG21  VAL   7          HG21      VAL   7  17.248 -17.161  -4.856
    8   HG23  VAL   7          HG22      VAL   7  18.160 -15.703  -5.251
    9   HG22  VAL   7          HG23      VAL   7  17.126 -16.450  -6.466

  No H/Q in entry =           9
  In of MODEL   77
    1    H    VAL   8           H        VAL   8  13.354 -15.597  -3.521
    2    HA   VAL   8           HA       VAL   8  12.696 -12.886  -3.053
    3    HB   VAL   8           HB       VAL   8  11.079 -15.414  -2.637
    4   HG13  VAL   8          HG11      VAL   8  10.035 -13.785  -1.259
    5   HG12  VAL   8          HG12      VAL   8   9.136 -13.720  -2.775
    6   HG11  VAL   8          HG13      VAL   8  10.347 -12.490  -2.414
    7   HG23  VAL   8          HG21      VAL   8  10.411 -13.483  -4.799
    8   HG22  VAL   8          HG22      VAL   8  10.482 -15.243  -4.846
    9   HG21  VAL   8          HG23      VAL   8  11.961 -14.300  -4.999

  No H/Q in entry =           9
  In of MODEL   77
    1    H    MET   9           H        MET   9  12.944 -15.693  -0.872
    2    HA   MET   9           HA       MET   9  12.122 -14.418   1.495
    3    HB2  MET   9           HB2      MET   9  13.990 -16.715   0.939
    4    HB3  MET   9           HB3      MET   9  13.759 -16.116   2.582
    5    HG2  MET   9           HG2      MET   9  11.465 -16.669   2.592
    6    HG3  MET   9           HG3      MET   9  11.400 -16.791   0.833
    7    HE3  MET   9           HE1      MET   9  14.638 -18.250   2.411
    8    HE2  MET   9           HE2      MET   9  14.009 -19.607   3.341
    9    HE1  MET   9           HE3      MET   9  13.533 -17.965   3.761

  No H/Q in entry =           9
  In of MODEL   77
    1    H    GLY  10           H        GLY  10  15.309 -14.652  -0.048
    2    HA3  GLY  10           HA2      GLY  10  16.763 -13.235   1.928
    3    HA2  GLY  10           HA3      GLY  10  17.234 -13.402   0.237

  No H/Q in entry =           3
  In of MODEL   77
    1    H    LEU  11           H        LEU  11  15.074 -12.175  -1.012
    2    HA   LEU  11           HA       LEU  11  15.765  -9.432  -0.846
    3    HB2  LEU  11           HB2      LEU  11  13.400 -10.836  -2.092
    4    HB3  LEU  11           HB3      LEU  11  13.685  -9.102  -2.250
    5    HG   LEU  11           HG       LEU  11  15.711 -11.216  -3.029
    6   HD13  LEU  11          HD11      LEU  11  13.971 -11.579  -4.556
    7   HD12  LEU  11          HD12      LEU  11  14.980 -10.400  -5.392
    8   HD11  LEU  11          HD13      LEU  11  13.505  -9.878  -4.581
    9   HD22  LEU  11          HD21      LEU  11  16.946  -9.255  -2.798
   10   HD21  LEU  11          HD22      LEU  11  15.575  -8.216  -3.183
   11   HD23  LEU  11          HD23      LEU  11  16.410  -9.086  -4.468

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  12           H        ILE  12  12.987 -11.251   0.409
    2    HA   ILE  12           HA       ILE  12  11.594  -9.024   1.462
    3    HB   ILE  12           HB       ILE  12  11.620 -11.908   2.407
    4   HG12  ILE  12          HG12      ILE  12  10.938 -11.269  -0.039
    5   HG13  ILE  12          HG13      ILE  12   9.905 -12.354   0.870
    6   HG21  ILE  12          HG21      ILE  12   9.707  -9.623   2.982
    7   HG23  ILE  12          HG22      ILE  12  10.669 -10.525   4.151
    8   HG22  ILE  12          HG23      ILE  12   9.335 -11.314   3.311
    9   HD12  ILE  12          HD11      ILE  12   8.673 -10.556  -0.360
   10   HD11  ILE  12          HD12      ILE  12   9.499  -9.362   0.637
   11   HD13  ILE  12          HD13      ILE  12   8.403 -10.511   1.372

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  13           H        ILE  13  13.976 -11.233   2.879
    2    HA   ILE  13           HA       ILE  13  14.002 -10.053   5.459
    3    HB   ILE  13           HB       ILE  13  16.065 -11.631   3.902
    4   HG12  ILE  13          HG12      ILE  13  13.780 -12.585   4.747
    5   HG13  ILE  13          HG13      ILE  13  15.252 -13.518   5.001
    6   HG23  ILE  13          HG21      ILE  13  17.453 -10.531   5.425
    7   HG22  ILE  13          HG22      ILE  13  17.025 -11.979   6.324
    8   HG21  ILE  13          HG23      ILE  13  16.211 -10.454   6.674
    9   HD11  ILE  13          HD11      ILE  13  14.158 -11.614   7.099
   10   HD13  ILE  13          HD12      ILE  13  15.386 -12.861   7.295
   11   HD12  ILE  13          HD13      ILE  13  13.709 -13.316   7.023

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ASN  14           H        ASN  14  15.969  -9.525   2.550
    2    HA   ASN  14           HA       ASN  14  17.710  -7.585   3.619
    3    HB2  ASN  14           HB2      ASN  14  17.698  -8.852   1.303
    4    HB3  ASN  14           HB3      ASN  14  16.808  -7.434   0.762
    5   HD21  ASN  14          HD21      ASN  14  19.254  -7.775  -0.412
    6   HD22  ASN  14          HD22      ASN  14  20.394  -6.692   0.220

  No H/Q in entry =           6
  In of MODEL   77
    1    H    SER  15           H        SER  15  14.608  -7.237   1.912
    2    HA   SER  15           HA       SER  15  14.496  -4.416   1.967
    3    HB2  SER  15           HB2      SER  15  12.166  -4.663   1.462
    4    HB3  SER  15           HB3      SER  15  12.966  -6.027   0.693
    5    HG   SER  15           HG       SER  15  11.252  -5.946   2.867

  No H/Q in entry =           5
  In of MODEL   77
    1    H    GLY  16           H        GLY  16  13.391  -6.875   4.266
    2    HA3  GLY  16           HA2      GLY  16  12.161  -5.126   6.118
    3    HA2  GLY  16           HA3      GLY  16  12.775  -6.734   6.483

  No H/Q in entry =           3
  In of MODEL   77
    1    H    GLN  17           H        GLN  17  15.488  -6.401   5.903
    2    HA   GLN  17           HA       GLN  17  16.434  -5.179   8.288
    3    HB2  GLN  17           HB2      GLN  17  17.857  -6.042   5.758
    4    HB3  GLN  17           HB3      GLN  17  18.704  -5.422   7.175
    5    HG2  GLN  17           HG2      GLN  17  17.761  -7.209   8.557
    6    HG3  GLN  17           HG3      GLN  17  16.838  -7.811   7.181
    7   HE21  GLN  17          HE21      GLN  17  19.387  -8.755   8.889
    8   HE22  GLN  17          HE22      GLN  17  20.407  -9.350   7.670

  No H/Q in entry =           8
  In of MODEL   77
    1    H    ALA  18           H        ALA  18  16.260  -4.102   4.927
    2    HA   ALA  18           HA       ALA  18  17.694  -1.709   5.160
    3    HB2  ALA  18           HB1      ALA  18  16.587  -2.925   3.088
    4    HB3  ALA  18           HB2      ALA  18  16.850  -1.181   3.073
    5    HB1  ALA  18           HB3      ALA  18  15.250  -1.828   3.435

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ARG  19           H        ARG  19  14.192  -2.299   5.540
    2    HA   ARG  19           HA       ARG  19  13.519   0.351   6.251
    3    HB2  ARG  19           HB2      ARG  19  11.842  -1.402   5.657
    4    HB3  ARG  19           HB3      ARG  19  12.177  -2.199   7.196
    5    HG2  ARG  19           HG2      ARG  19  11.459  -0.208   8.431
    6    HG3  ARG  19           HG3      ARG  19  11.216   0.668   6.921
    7    HD2  ARG  19           HD2      ARG  19   9.071  -0.130   7.731
    8    HD3  ARG  19           HD3      ARG  19   9.498  -1.009   6.257
    9    HE   ARG  19           HE       ARG  19  10.447  -2.551   8.367
   10   HH21  ARG  19          HH11      ARG  19   9.194  -4.191   9.301
   11   HH22  ARG  19          HH12      ARG  19   7.475  -4.165   9.121
   12   HH11  ARG  19          HH21      ARG  19   7.457  -1.260   7.257
   13   HH12  ARG  19          HH22      ARG  19   6.492  -2.506   7.960

  No H/Q in entry =          13
  In of MODEL   77
    1    H    SER  20           H        SER  20  14.369  -2.478   8.216
    2    HA   SER  20           HA       SER  20  14.073  -1.378  10.751
    3    HB2  SER  20           HB2      SER  20  14.583  -3.761  10.360
    4    HB3  SER  20           HB3      SER  20  16.207  -3.323   9.832
    5    HG   SER  20           HG       SER  20  16.711  -2.717  11.860

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LEU  21           H        LEU  21  16.927  -1.315   8.629
    2    HA   LEU  21           HA       LEU  21  18.592   0.172  10.375
    3    HB2  LEU  21           HB2      LEU  21  18.585  -0.103   7.362
    4    HB3  LEU  21           HB3      LEU  21  19.833   0.762   8.255
    5    HG   LEU  21           HG       LEU  21  19.098  -2.132   8.788
    6   HD12  LEU  21          HD11      LEU  21  21.380  -1.000   7.140
    7   HD11  LEU  21          HD12      LEU  21  19.981  -1.857   6.497
    8   HD13  LEU  21          HD13      LEU  21  21.136  -2.704   7.525
    9   HD23  LEU  21          HD21      LEU  21  21.581  -1.951   9.701
   10   HD22  LEU  21          HD22      LEU  21  20.250  -1.398  10.712
   11   HD21  LEU  21          HD23      LEU  21  21.212  -0.233   9.817

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ALA  22           H        ALA  22  16.340   1.139   7.808
    2    HA   ALA  22           HA       ALA  22  16.877   3.898   7.824
    3    HB3  ALA  22           HB1      ALA  22  15.483   2.654   6.139
    4    HB2  ALA  22           HB2      ALA  22  14.773   4.167   6.702
    5    HB1  ALA  22           HB3      ALA  22  14.180   2.627   7.327

  No H/Q in entry =           5
  In of MODEL   77
    1    H    TYR  23           H        TYR  23  14.372   2.081   9.647
    2    HA   TYR  23           HA       TYR  23  13.401   4.318  11.091
    3    HB2  TYR  23           HB2      TYR  23  12.168   2.202  11.062
    4    HB3  TYR  23           HB3      TYR  23  13.495   1.394  11.897
    5    HD1  TYR  23           HD1      TYR  23  10.965   4.113  12.240
    6    HD2  TYR  23           HD2      TYR  23  13.697   1.482  14.256
    7    HE1  TYR  23           HE1      TYR  23  10.021   4.808  14.427
    8    HE2  TYR  23           HE2      TYR  23  12.753   2.177  16.442
    9    HH   TYR  23           HH       TYR  23   9.917   4.265  16.639

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ALA  24           H        ALA  24  16.043   2.043  11.742
    2    HA   ALA  24           HA       ALA  24  16.700   3.039  14.308
    3    HB1  ALA  24           HB1      ALA  24  18.058   1.246  14.151
    4    HB3  ALA  24           HB2      ALA  24  19.091   2.168  13.057
    5    HB2  ALA  24           HB3      ALA  24  17.800   1.159  12.409

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ALA  25           H        ALA  25  17.674   3.968  11.034
    2    HA   ALA  25           HA       ALA  25  19.616   5.902  11.689
    3    HB1  ALA  25           HB1      ALA  25  18.911   4.954   9.371
    4    HB3  ALA  25           HB2      ALA  25  19.412   6.641   9.466
    5    HB2  ALA  25           HB3      ALA  25  17.698   6.234   9.388

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LEU  26           H        LEU  26  16.103   6.131  11.310
    2    HA   LEU  26           HA       LEU  26  15.877   8.913  11.760
    3    HB2  LEU  26           HB2      LEU  26  14.020   7.678  10.823
    4    HB3  LEU  26           HB3      LEU  26  13.921   6.650  12.247
    5    HG   LEU  26           HG       LEU  26  13.309   8.608  13.624
    6   HD12  LEU  26          HD11      LEU  26  12.655  10.709  12.296
    7   HD11  LEU  26          HD12      LEU  26  13.642  10.056  10.991
    8   HD13  LEU  26          HD13      LEU  26  14.379  10.441  12.547
    9   HD21  LEU  26          HD21      LEU  26  11.646   8.296  11.106
   10   HD23  LEU  26          HD22      LEU  26  11.078   8.994  12.620
   11   HD22  LEU  26          HD23      LEU  26  11.530   7.292  12.552

  No H/Q in entry =          11
  In of MODEL   77
    1    H    LYS  27           H        LYS  27  15.756   6.134  13.953
    2    HA   LYS  27           HA       LYS  27  15.152   7.501  16.317
    3    HB2  LYS  27           HB2      LYS  27  15.180   5.025  16.053
    4    HB3  LYS  27           HB3      LYS  27  16.944   5.077  16.019
    5    HG2  LYS  27           HG2      LYS  27  16.983   6.062  18.268
    6    HG3  LYS  27           HG3      LYS  27  15.216   6.082  18.305
    7    HD2  LYS  27           HD2      LYS  27  15.190   3.615  18.068
    8    HD3  LYS  27           HD3      LYS  27  16.955   3.603  18.066
    9    HE2  LYS  27           HE2      LYS  27  16.978   4.592  20.322
   10    HE3  LYS  27           HE3      LYS  27  15.212   4.634  20.328
   11    HZ3  LYS  27           HZ1      LYS  27  15.992   2.681  21.483
   12    HZ2  LYS  27           HZ2      LYS  27  16.915   2.201  20.137
   13    HZ1  LYS  27           HZ3      LYS  27  15.217   2.208  20.048

  No H/Q in entry =          13
  In of MODEL   77
    1    H    GLN  28           H        GLN  28  18.276   6.915  14.742
    2    HA   GLN  28           HA       GLN  28  19.951   7.997  16.741
    3    HB2  GLN  28           HB2      GLN  28  20.253   7.950  13.727
    4    HB3  GLN  28           HB3      GLN  28  21.536   8.420  14.844
    5    HG2  GLN  28           HG2      GLN  28  20.112   5.745  14.888
    6    HG3  GLN  28           HG3      GLN  28  21.692   6.027  14.160
    7   HE21  GLN  28          HE21      GLN  28  20.429   4.721  16.870
    8   HE22  GLN  28          HE22      GLN  28  21.624   5.144  18.000

  No H/Q in entry =           8
  In of MODEL   77
    1    H    ALA  29           H        ALA  29  18.215   9.482  14.039
    2    HA   ALA  29           HA       ALA  29  19.217  12.101  14.297
    3    HB2  ALA  29           HB1      ALA  29  17.527  12.740  12.817
    4    HB1  ALA  29           HB2      ALA  29  16.378  11.569  13.463
    5    HB3  ALA  29           HB3      ALA  29  17.713  11.025  12.446

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LYS  30           H        LYS  30  16.430  10.507  15.804
    2    HA   LYS  30           HA       LYS  30  15.413  12.762  17.156
    3    HB2  LYS  30           HB2      LYS  30  15.292   9.821  17.859
    4    HB3  LYS  30           HB3      LYS  30  14.424  11.074  18.749
    5    HG2  LYS  30           HG2      LYS  30  13.312  11.762  16.624
    6    HG3  LYS  30           HG3      LYS  30  14.118  10.424  15.802
    7    HD2  LYS  30           HD2      LYS  30  13.034   8.819  17.325
    8    HD3  LYS  30           HD3      LYS  30  12.238  10.146  18.172
    9    HE2  LYS  30           HE2      LYS  30  11.082  10.782  16.073
   10    HE3  LYS  30           HE3      LYS  30  11.858   9.426  15.246
   11    HZ2  LYS  30           HZ1      LYS  30   9.544   9.022  16.115
   12    HZ1  LYS  30           HZ2      LYS  30  10.204   9.073  17.685
   13    HZ3  LYS  30           HZ3      LYS  30  10.715   7.887  16.577

  No H/Q in entry =          13
  In of MODEL   77
    1    H    GLN  31           H        GLN  31  18.065  10.586  17.906
    2    HA   GLN  31           HA       GLN  31  18.382  11.600  20.603
    3    HB2  GLN  31           HB2      GLN  31  20.409  10.024  19.008
    4    HB3  GLN  31           HB3      GLN  31  20.266  10.148  20.762
    5    HG2  GLN  31           HG2      GLN  31  17.754   9.203  19.980
    6    HG3  GLN  31           HG3      GLN  31  18.859   8.356  18.906
    7   HE21  GLN  31          HE21      GLN  31  17.302   7.213  21.174
    8   HE22  GLN  31          HE22      GLN  31  18.451   6.549  22.230

  No H/Q in entry =           8
  In of MODEL   77
    1    H    GLY  32           H        GLY  32  18.919  12.916  17.639
    2    HA3  GLY  32           HA2      GLY  32  19.911  14.959  17.130
    3    HA2  GLY  32           HA3      GLY  32  20.661  14.961  18.721

  No H/Q in entry =           3
  In of MODEL   77
    1    H    ASP  33           H        ASP  33  21.084  12.068  16.946
    2    HA   ASP  33           HA       ASP  33  23.914  12.736  16.494
    3    HB2  ASP  33           HB2      ASP  33  22.398  10.124  16.603
    4    HB3  ASP  33           HB3      ASP  33  24.087  10.236  16.116

  No H/Q in entry =           4
  In of MODEL   77
    1    H    PHE  34           H        PHE  34  23.445  14.061  14.611
    2    HA   PHE  34           HA       PHE  34  22.105  13.080  12.317
    3    HB2  PHE  34           HB2      PHE  34  24.240  15.209  12.557
    4    HB3  PHE  34           HB3      PHE  34  23.261  14.921  11.121
    5    HD1  PHE  34           HD1      PHE  34  23.502  16.854  14.036
    6    HD2  PHE  34           HD2      PHE  34  20.632  14.746  11.635
    7    HE1  PHE  34           HE1      PHE  34  21.684  18.256  14.974
    8    HE2  PHE  34           HE2      PHE  34  18.818  16.147  12.576
    9    HZ   PHE  34           HZ       PHE  34  19.347  17.903  14.241

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ALA  35           H        ALA  35  25.474  12.885  13.341
    2    HA   ALA  35           HA       ALA  35  26.590  12.061  10.890
    3    HB3  ALA  35           HB1      ALA  35  28.259  10.888  12.618
    4    HB2  ALA  35           HB2      ALA  35  27.392  11.915  13.759
    5    HB1  ALA  35           HB3      ALA  35  28.237  12.637  12.391

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ALA  36           H        ALA  36  25.456  10.108  13.650
    2    HA   ALA  36           HA       ALA  36  25.942   7.619  12.376
    3    HB2  ALA  36           HB1      ALA  36  25.499   6.873  14.449
    4    HB3  ALA  36           HB2      ALA  36  23.813   7.371  14.291
    5    HB1  ALA  36           HB3      ALA  36  25.013   8.501  14.920

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ALA  37           H        ALA  37  23.124   9.750  12.496
    2    HA   ALA  37           HA       ALA  37  21.270   7.984  11.311
    3    HB3  ALA  37           HB1      ALA  37  21.499  10.946  11.604
    4    HB1  ALA  37           HB2      ALA  37  20.183   9.870  12.070
    5    HB2  ALA  37           HB3      ALA  37  20.381  10.341  10.382

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LYS  38           H        LYS  38  23.381  10.442   9.843
    2    HA   LYS  38           HA       LYS  38  22.754  10.015   7.162
    3    HB2  LYS  38           HB2      LYS  38  24.559  11.570   8.616
    4    HB3  LYS  38           HB3      LYS  38  25.595  10.579   7.596
    5    HG2  LYS  38           HG2      LYS  38  24.442  11.351   5.594
    6    HG3  LYS  38           HG3      LYS  38  23.243  12.207   6.569
    7    HD2  LYS  38           HD2      LYS  38  24.837  13.804   7.329
    8    HD3  LYS  38           HD3      LYS  38  26.198  12.816   6.801
    9    HE2  LYS  38           HE2      LYS  38  25.851  14.688   5.247
   10    HE3  LYS  38           HE3      LYS  38  25.519  13.151   4.441
   11    HZ3  LYS  38           HZ1      LYS  38  23.323  13.598   4.300
   12    HZ2  LYS  38           HZ2      LYS  38  23.846  15.212   4.390
   13    HZ1  LYS  38           HZ3      LYS  38  23.265  14.429   5.780

  No H/Q in entry =          13
  In of MODEL   77
    1    H    ALA  39           H        ALA  39  25.257   8.415   9.131
    2    HA   ALA  39           HA       ALA  39  26.335   6.825   7.066
    3    HB2  ALA  39           HB1      ALA  39  26.231   5.862   9.909
    4    HB1  ALA  39           HB2      ALA  39  27.187   7.287   9.498
    5    HB3  ALA  39           HB3      ALA  39  27.541   5.736   8.736

  No H/Q in entry =           5
  In of MODEL   77
    1    H    MET  40           H        MET  40  23.710   6.211   9.351
    2    HA   MET  40           HA       MET  40  23.269   3.507   8.615
    3    HB2  MET  40           HB2      MET  40  21.447   5.551   9.898
    4    HB3  MET  40           HB3      MET  40  21.040   3.842   9.721
    5    HG2  MET  40           HG2      MET  40  23.584   4.782  11.075
    6    HG3  MET  40           HG3      MET  40  22.085   4.507  11.961
    7    HE3  MET  40           HE1      MET  40  21.518   0.874  12.133
    8    HE2  MET  40           HE2      MET  40  20.654   2.177  11.321
    9    HE1  MET  40           HE3      MET  40  21.388   2.464  12.898

  No H/Q in entry =           9
  In of MODEL   77
    1    H    MET  41           H        MET  41  21.862   6.561   7.421
    2    HA   MET  41           HA       MET  41  19.913   5.367   5.739
    3    HB2  MET  41           HB2      MET  41  21.398   7.956   5.233
    4    HB3  MET  41           HB3      MET  41  19.873   7.463   4.507
    5    HG2  MET  41           HG2      MET  41  19.114   7.275   7.055
    6    HG3  MET  41           HG3      MET  41  20.423   8.432   7.283
    7    HE2  MET  41           HE1      MET  41  19.877   9.720   3.944
    8    HE1  MET  41           HE2      MET  41  20.826  10.159   5.360
    9    HE3  MET  41           HE3      MET  41  19.557  11.239   4.790

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ASP  42           H        ASP  42  23.288   6.289   5.203
    2    HA   ASP  42           HA       ASP  42  23.394   5.815   2.445
    3    HB2  ASP  42           HB2      ASP  42  25.136   6.812   4.223
    4    HB3  ASP  42           HB3      ASP  42  25.794   5.186   4.099

  No H/Q in entry =           4
  In of MODEL   77
    1    H    GLN  43           H        GLN  43  24.104   3.660   5.169
    2    HA   GLN  43           HA       GLN  43  24.776   1.402   3.590
    3    HB2  GLN  43           HB2      GLN  43  23.739   1.585   6.428
    4    HB3  GLN  43           HB3      GLN  43  24.322   0.096   5.676
    5    HG2  GLN  43           HG2      GLN  43  26.488   1.307   5.176
    6    HG3  GLN  43           HG3      GLN  43  25.900   2.634   6.172
    7   HE21  GLN  43          HE21      GLN  43  28.128   1.661   7.220
    8   HE22  GLN  43          HE22      GLN  43  27.847   0.578   8.495

  No H/Q in entry =           8
  In of MODEL   77
    1    H    SER  44           H        SER  44  21.713   2.536   4.960
    2    HA   SER  44           HA       SER  44  20.148   0.293   4.279
    3    HB2  SER  44           HB2      SER  44  19.701   2.822   5.423
    4    HB3  SER  44           HB3      SER  44  18.673   2.779   3.993
    5    HG   SER  44           HG       SER  44  17.571   1.836   5.710

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ARG  45           H        ARG  45  20.900   3.258   2.478
    2    HA   ARG  45           HA       ARG  45  19.386   2.772   0.166
    3    HB2  ARG  45           HB2      ARG  45  20.527   4.908   0.756
    4    HB3  ARG  45           HB3      ARG  45  22.073   4.153   0.378
    5    HG2  ARG  45           HG2      ARG  45  21.301   3.748  -1.940
    6    HG3  ARG  45           HG3      ARG  45  19.767   4.526  -1.561
    7    HD2  ARG  45           HD2      ARG  45  21.015   6.622  -0.970
    8    HD3  ARG  45           HD3      ARG  45  22.514   5.848  -1.532
    9    HE   ARG  45           HE       ARG  45  20.594   5.611  -3.577
   10   HH21  ARG  45          HH11      ARG  45  20.596   6.981  -5.340
   11   HH22  ARG  45          HH12      ARG  45  21.353   8.530  -5.232
   12   HH11  ARG  45          HH21      ARG  45  22.317   8.109  -1.942
   13   HH12  ARG  45          HH22      ARG  45  22.326   9.169  -3.305

  No H/Q in entry =          13
  In of MODEL   77
    1    H    MET  46           H        MET  46  22.746   1.896   0.929
    2    HA   MET  46           HA       MET  46  23.363   0.703  -1.552
    3    HB2  MET  46           HB2      MET  46  24.456   0.376   1.242
    4    HB3  MET  46           HB3      MET  46  25.118  -0.518  -0.130
    5    HG2  MET  46           HG2      MET  46  25.572   1.585  -1.312
    6    HG3  MET  46           HG3      MET  46  24.857   2.502   0.008
    7    HE1  MET  46           HE1      MET  46  27.220   0.007  -1.144
    8    HE3  MET  46           HE2      MET  46  27.671  -0.678   0.416
    9    HE2  MET  46           HE3      MET  46  28.787   0.399  -0.422

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ALA  47           H        ALA  47  21.965  -0.629   1.418
    2    HA   ALA  47           HA       ALA  47  21.912  -3.342   0.615
    3    HB2  ALA  47           HB1      ALA  47  21.524  -2.881   2.918
    4    HB3  ALA  47           HB2      ALA  47  19.989  -3.482   2.292
    5    HB1  ALA  47           HB3      ALA  47  20.219  -1.751   2.551

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LEU  48           H        LEU  48  19.564  -0.712   0.248
    2    HA   LEU  48           HA       LEU  48  17.523  -2.243  -1.011
    3    HB2  LEU  48           HB2      LEU  48  18.181   0.710  -1.124
    4    HB3  LEU  48           HB3      LEU  48  16.712   0.002  -1.797
    5    HG   LEU  48           HG       LEU  48  17.553  -0.301   1.096
    6   HD13  LEU  48          HD11      LEU  48  17.140   2.001   0.907
    7   HD12  LEU  48          HD12      LEU  48  15.578   1.355   1.410
    8   HD11  LEU  48          HD13      LEU  48  15.857   1.777  -0.280
    9   HD22  LEU  48          HD21      LEU  48  16.024  -2.013   0.709
   10   HD21  LEU  48          HD22      LEU  48  15.156  -1.109  -0.533
   11   HD23  LEU  48          HD23      LEU  48  14.937  -0.704   1.169

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ASN  49           H        ASN  49  20.218  -0.319  -2.232
    2    HA   ASN  49           HA       ASN  49  19.578  -0.403  -4.958
    3    HB2  ASN  49           HB2      ASN  49  21.254   1.114  -4.042
    4    HB3  ASN  49           HB3      ASN  49  22.275  -0.243  -3.583
    5   HD21  ASN  49          HD21      ASN  49  20.799   1.279  -6.473
    6   HD22  ASN  49          HD22      ASN  49  22.045   0.829  -7.533

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLU  50           H        GLU  50  21.551  -2.600  -2.987
    2    HA   GLU  50           HA       GLU  50  22.257  -4.358  -5.110
    3    HB2  GLU  50           HB2      GLU  50  23.447  -4.334  -2.939
    4    HB3  GLU  50           HB3      GLU  50  22.000  -4.959  -2.148
    5    HG2  GLU  50           HG2      GLU  50  22.091  -6.993  -3.506
    6    HG3  GLU  50           HG3      GLU  50  23.472  -6.363  -4.402

  No H/Q in entry =           6
  In of MODEL   77
    1    H    ALA  51           H        ALA  51  19.593  -4.287  -2.794
    2    HA   ALA  51           HA       ALA  51  18.425  -6.758  -3.554
    3    HB3  ALA  51           HB1      ALA  51  16.828  -6.248  -2.005
    4    HB1  ALA  51           HB2      ALA  51  16.620  -4.602  -2.605
    5    HB2  ALA  51           HB3      ALA  51  17.974  -4.990  -1.544

  No H/Q in entry =           5
  In of MODEL   77
    1    H    HIS  52           H        HIS  52  17.849  -3.409  -4.593
    2    HA   HIS  52           HA       HIS  52  15.741  -3.933  -6.400
    3    HB2  HIS  52           HB2      HIS  52  16.385  -1.669  -5.601
    4    HB3  HIS  52           HB3      HIS  52  17.849  -1.768  -6.577
    5    HD1  HIS  52           HD1      HIS  52  17.454  -2.041  -9.232
    6    HD2  HIS  52           HD2      HIS  52  14.119  -0.880  -7.017
    7    HE1  HIS  52           HE1      HIS  52  15.773  -1.126 -10.892
    8    HE2  HIS  52           HE2      HIS  52  13.735  -0.414  -9.557

  No H/Q in entry =           8
  In of MODEL   77
    1    H    LEU  53           H        LEU  53  19.261  -3.945  -6.820
    2    HA   LEU  53           HA       LEU  53  19.328  -4.263  -9.620
    3    HB2  LEU  53           HB2      LEU  53  21.252  -5.030  -7.439
    4    HB3  LEU  53           HB3      LEU  53  21.573  -5.411  -9.129
    5    HG   LEU  53           HG       LEU  53  20.899  -2.604  -8.195
    6   HD13  LEU  53          HD11      LEU  53  22.913  -3.111  -7.036
    7   HD12  LEU  53          HD12      LEU  53  23.427  -2.265  -8.496
    8   HD11  LEU  53          HD13      LEU  53  23.559  -4.017  -8.402
    9   HD21  LEU  53          HD21      LEU  53  22.000  -3.826 -10.734
   10   HD23  LEU  53          HD22      LEU  53  22.317  -2.141 -10.336
   11   HD22  LEU  53          HD23      LEU  53  20.668  -2.689 -10.568

  No H/Q in entry =          11
  In of MODEL   77
    1    H    VAL  54           H        VAL  54  19.202  -6.647  -6.993
    2    HA   VAL  54           HA       VAL  54  19.328  -8.943  -8.650
    3    HB   VAL  54           HB       VAL  54  18.164  -8.516  -5.887
    4   HG12  VAL  54          HG11      VAL  54  18.485 -11.134  -5.880
    5   HG11  VAL  54          HG12      VAL  54  18.307 -10.967  -7.626
    6   HG13  VAL  54          HG13      VAL  54  17.015 -10.434  -6.553
    7   HG22  VAL  54          HG21      VAL  54  20.480  -8.308  -5.656
    8   HG21  VAL  54          HG22      VAL  54  20.820  -9.401  -6.996
    9   HG23  VAL  54          HG23      VAL  54  20.284 -10.047  -5.444

  No H/Q in entry =           9
  In of MODEL   77
    1    H    GLN  55           H        GLN  55  16.598  -7.036  -7.379
    2    HA   GLN  55           HA       GLN  55  14.579  -8.699  -8.458
    3    HB2  GLN  55           HB2      GLN  55  13.826  -7.171  -6.836
    4    HB3  GLN  55           HB3      GLN  55  14.623  -5.804  -7.610
    5    HG2  GLN  55           HG2      GLN  55  12.905  -5.479  -9.106
    6    HG3  GLN  55           HG3      GLN  55  12.582  -7.200  -9.276
    7   HE21  GLN  55          HE21      GLN  55  10.571  -7.746  -8.478
    8   HE22  GLN  55          HE22      GLN  55   9.794  -6.990  -7.173

  No H/Q in entry =           8
  In of MODEL   77
    1    H    THR  56           H        THR  56  16.325  -5.902  -9.814
    2    HA   THR  56           HA       THR  56  14.896  -5.541 -12.168
    3    HB   THR  56           HB       THR  56  17.915  -5.457 -12.003
    4    HG1  THR  56           HG1      THR  56  17.375  -3.185 -11.448
    5   HG21  THR  56          HG21      THR  56  15.814  -4.159 -13.733
    6   HG23  THR  56          HG22      THR  56  17.226  -5.090 -14.232
    7   HG22  THR  56          HG23      THR  56  17.430  -3.468 -13.569

  No H/Q in entry =           7
  In of MODEL   77
    1    H    LYS  57           H        LYS  57  17.542  -7.839 -11.545
    2    HA   LYS  57           HA       LYS  57  17.551  -9.036 -14.122
    3    HB2  LYS  57           HB2      LYS  57  19.358  -9.314 -12.440
    4    HB3  LYS  57           HB3      LYS  57  18.253 -10.214 -11.411
    5    HG2  LYS  57           HG2      LYS  57  19.617 -11.807 -12.597
    6    HG3  LYS  57           HG3      LYS  57  17.990 -11.894 -13.263
    7    HD2  LYS  57           HD2      LYS  57  18.612 -10.687 -15.220
    8    HD3  LYS  57           HD3      LYS  57  20.137 -10.162 -14.508
    9    HE2  LYS  57           HE2      LYS  57  20.964 -12.481 -14.509
   10    HE3  LYS  57           HE3      LYS  57  19.432 -13.049 -15.171
   11    HZ1  LYS  57           HZ1      LYS  57  19.974 -11.258 -16.977
   12    HZ3  LYS  57           HZ2      LYS  57  20.640 -12.818 -17.063
   13    HZ2  LYS  57           HZ3      LYS  57  21.569 -11.527 -16.467

  No H/Q in entry =          13
  In of MODEL   77
    1    H    LEU  58           H        LEU  58  15.759  -9.700 -11.152
    2    HA   LEU  58           HA       LEU  58  14.540 -12.074 -12.089
    3    HB2  LEU  58           HB2      LEU  58  13.738 -10.166  -9.898
    4    HB3  LEU  58           HB3      LEU  58  12.932 -11.704 -10.215
    5    HG   LEU  58           HG       LEU  58  15.904 -11.426  -9.651
    6   HD11  LEU  58          HD11      LEU  58  13.526 -11.841  -7.866
    7   HD13  LEU  58          HD12      LEU  58  14.979 -10.877  -7.599
    8   HD12  LEU  58          HD13      LEU  58  15.050 -12.633  -7.462
    9   HD22  LEU  58          HD21      LEU  58  15.789 -13.489 -10.676
   10   HD21  LEU  58          HD22      LEU  58  14.074 -13.697 -10.321
   11   HD23  LEU  58          HD23      LEU  58  15.278 -13.997  -9.068

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  59           H        ILE  59  13.872  -8.737 -12.777
    2    HA   ILE  59           HA       ILE  59  11.160  -9.386 -13.726
    3    HB   ILE  59           HB       ILE  59  11.966  -7.101 -12.522
    4   HG12  ILE  59          HG12      ILE  59  10.059  -6.974 -14.867
    5   HG13  ILE  59          HG13      ILE  59   9.640  -7.758 -13.366
    6   HG23  ILE  59          HG21      ILE  59  12.521  -5.377 -14.043
    7   HG22  ILE  59          HG22      ILE  59  12.051  -6.322 -15.438
    8   HG21  ILE  59          HG23      ILE  59  13.528  -6.708 -14.560
    9   HD11  ILE  59          HD11      ILE  59  10.257  -5.614 -12.170
   10   HD13  ILE  59          HD12      ILE  59   8.829  -5.509 -13.197
   11   HD12  ILE  59          HD13      ILE  59  10.370  -4.860 -13.761

  No H/Q in entry =          11
  In of MODEL   77
    1    H    GLU  60           H        GLU  60  14.368  -8.537 -14.974
    2    HA   GLU  60           HA       GLU  60  13.598  -8.139 -17.685
    3    HB2  GLU  60           HB2      GLU  60  15.774  -7.406 -16.826
    4    HB3  GLU  60           HB3      GLU  60  16.235  -9.079 -16.523
    5    HG2  GLU  60           HG2      GLU  60  16.050  -9.572 -18.937
    6    HG3  GLU  60           HG3      GLU  60  15.586  -7.900 -19.242

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLY  61           H        GLY  61  14.568 -11.019 -15.864
    2    HA3  GLY  61           HA2      GLY  61  14.034 -12.669 -18.265
    3    HA2  GLY  61           HA3      GLY  61  15.062 -13.149 -16.919

  No H/Q in entry =           3
  In of MODEL   77
    1    H    ASP  62           H        ASP  62  11.941 -11.602 -16.560
    2    HA   ASP  62           HA       ASP  62  10.993 -13.503 -14.712
    3    HB2  ASP  62           HB2      ASP  62   8.847 -12.318 -14.943
    4    HB3  ASP  62           HB3      ASP  62  10.195 -11.202 -14.751

  No H/Q in entry =           4
  In of MODEL   77
    1    H    ALA  63           H        ALA  63  10.504 -13.249 -18.234
    2    HA   ALA  63           HA       ALA  63   8.753 -15.641 -18.158
    3    HB2  ALA  63           HB1      ALA  63   9.303 -13.536 -20.249
    4    HB3  ALA  63           HB2      ALA  63   7.769 -13.940 -19.482
    5    HB1  ALA  63           HB3      ALA  63   8.491 -15.049 -20.648

  No H/Q in entry =           5
  In of MODEL   77
    1    H    GLY  64           H        GLY  64   9.170 -16.881 -20.421
    2    HA3  GLY  64           HA2      GLY  64  10.826 -17.839 -21.874
    3    HA2  GLY  64           HA3      GLY  64  12.054 -17.416 -20.688

  No H/Q in entry =           3
  In of MODEL   77
    1    H    GLU  65           H        GLU  65  10.056 -18.462 -18.564
    2    HA   GLU  65           HA       GLU  65  11.234 -21.015 -18.311
    3    HB2  GLU  65           HB2      GLU  65   8.863 -19.779 -16.919
    4    HB3  GLU  65           HB3      GLU  65   9.556 -21.338 -16.474
    5    HG2  GLU  65           HG2      GLU  65  11.728 -20.284 -16.060
    6    HG3  GLU  65           HG3      GLU  65  11.086 -18.721 -16.563

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLY  66           H        GLY  66   8.161 -19.972 -19.543
    2    HA3  GLY  66           HA2      GLY  66   7.759 -22.305 -21.114
    3    HA2  GLY  66           HA3      GLY  66   6.696 -22.301 -19.722

  No H/Q in entry =           3
  In of MODEL   77
    1    H    LYS  67           H        LYS  67   5.082 -20.729 -19.556
    2    HA   LYS  67           HA       LYS  67   4.091 -19.830 -22.127
    3    HB2  LYS  67           HB2      LYS  67   2.860 -20.002 -19.383
    4    HB3  LYS  67           HB3      LYS  67   2.011 -19.345 -20.788
    5    HG2  LYS  67           HG2      LYS  67   2.417 -21.446 -22.019
    6    HG3  LYS  67           HG3      LYS  67   3.255 -22.107 -20.618
    7    HD2  LYS  67           HD2      LYS  67   1.186 -21.905 -19.286
    8    HD3  LYS  67           HD3      LYS  67   0.347 -21.258 -20.697
    9    HE2  LYS  67           HE2      LYS  67   0.791 -23.335 -21.936
   10    HE3  LYS  67           HE3      LYS  67   1.664 -23.986 -20.550
   11    HZ2  LYS  67           HZ1      LYS  67  -1.026 -24.203 -21.038
   12    HZ1  LYS  67           HZ2      LYS  67  -0.912 -23.041 -19.805
   13    HZ3  LYS  67           HZ3      LYS  67  -0.226 -24.582 -19.591

  No H/Q in entry =          13
  In of MODEL   77
    1    H    MET  68           H        MET  68   2.510 -17.799 -21.651
    2    HA   MET  68           HA       MET  68   4.164 -15.536 -21.878
    3    HB2  MET  68           HB2      MET  68   1.187 -15.802 -21.464
    4    HB3  MET  68           HB3      MET  68   2.001 -14.286 -21.851
    5    HG2  MET  68           HG2      MET  68   2.138 -16.801 -23.537
    6    HG3  MET  68           HG3      MET  68   1.110 -15.410 -23.882
    7    HE1  MET  68           HE1      MET  68   1.696 -13.252 -24.296
    8    HE3  MET  68           HE2      MET  68   3.202 -12.634 -24.969
    9    HE2  MET  68           HE3      MET  68   3.024 -12.790 -23.223

  No H/Q in entry =           9
  In of MODEL   77
    1    H    LYS  69           H        LYS  69   2.292 -16.724 -19.086
    2    HA   LYS  69           HA       LYS  69   2.302 -14.435 -17.527
    3    HB2  LYS  69           HB2      LYS  69   2.574 -17.216 -16.394
    4    HB3  LYS  69           HB3      LYS  69   1.746 -15.825 -15.689
    5    HG2  LYS  69           HG2      LYS  69   0.923 -17.513 -18.041
    6    HG3  LYS  69           HG3      LYS  69  -0.023 -17.054 -16.625
    7    HD2  LYS  69           HD2      LYS  69   0.235 -14.629 -17.485
    8    HD3  LYS  69           HD3      LYS  69   0.715 -15.369 -19.013
    9    HE2  LYS  69           HE2      LYS  69  -1.469 -16.824 -18.601
   10    HE3  LYS  69           HE3      LYS  69  -1.936 -15.431 -17.627
   11    HZ3  LYS  69           HZ1      LYS  69  -2.526 -14.449 -19.505
   12    HZ2  LYS  69           HZ2      LYS  69  -1.868 -15.698 -20.449
   13    HZ1  LYS  69           HZ3      LYS  69  -0.893 -14.398 -19.956

  No H/Q in entry =          13
  In of MODEL   77
    1    H    VAL  70           H        VAL  70   3.398 -14.443 -15.192
    2    HA   VAL  70           HA       VAL  70   6.323 -14.800 -15.512
    3    HB   VAL  70           HB       VAL  70   6.627 -12.662 -14.304
    4   HG11  VAL  70          HG11      VAL  70   4.900 -12.482 -16.792
    5   HG13  VAL  70          HG12      VAL  70   6.654 -12.668 -16.760
    6   HG12  VAL  70          HG13      VAL  70   5.913 -11.180 -16.169
    7   HG21  VAL  70          HG21      VAL  70   3.596 -12.511 -14.540
    8   HG23  VAL  70          HG22      VAL  70   4.624 -11.154 -14.083
    9   HG22  VAL  70          HG23      VAL  70   4.529 -12.575 -13.045

  No H/Q in entry =           9
  In of MODEL   77
    1    H    SER  71           H        SER  71   7.443 -14.682 -13.354
    2    HA   SER  71           HA       SER  71   6.448 -16.617 -11.557
    3    HB2  SER  71           HB2      SER  71   8.860 -15.983 -11.818
    4    HB3  SER  71           HB3      SER  71   8.509 -14.475 -10.978
    5    HG   SER  71           HG       SER  71   7.574 -15.964  -9.314

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LEU  72           H        LEU  72   5.034 -16.468  -9.957
    2    HA   LEU  72           HA       LEU  72   3.483 -14.154  -9.520
    3    HB2  LEU  72           HB2      LEU  72   3.762 -16.715  -7.958
    4    HB3  LEU  72           HB3      LEU  72   2.602 -15.455  -7.545
    5    HG   LEU  72           HG       LEU  72   2.741 -16.719 -10.301
    6   HD13  LEU  72          HD11      LEU  72   0.914 -18.163  -9.633
    7   HD12  LEU  72          HD12      LEU  72   0.840 -17.407  -8.043
    8   HD11  LEU  72          HD13      LEU  72   2.236 -18.388  -8.486
    9   HD23  LEU  72          HD21      LEU  72   0.256 -15.916 -10.177
   10   HD22  LEU  72          HD22      LEU  72   1.493 -14.705 -10.474
   11   HD21  LEU  72          HD23      LEU  72   0.813 -14.891  -8.860

  No H/Q in entry =          11
  In of MODEL   77
    1    H    VAL  73           H        VAL  73   6.131 -15.591  -7.736
    2    HA   VAL  73           HA       VAL  73   6.061 -14.056  -5.404
    3    HB   VAL  73           HB       VAL  73   8.249 -14.860  -4.973
    4   HG13  VAL  73          HG11      VAL  73   8.005 -17.226  -5.407
    5   HG12  VAL  73          HG12      VAL  73   6.941 -16.912  -6.778
    6   HG11  VAL  73          HG13      VAL  73   6.396 -16.559  -5.139
    7   HG22  VAL  73          HG21      VAL  73   9.596 -14.326  -6.785
    8   HG21  VAL  73          HG22      VAL  73   8.426 -14.919  -7.963
    9   HG23  VAL  73          HG23      VAL  73   9.402 -16.060  -7.038

  No H/Q in entry =           9
  In of MODEL   77
    1    H    LEU  74           H        LEU  74   7.065 -13.164  -8.577
    2    HA   LEU  74           HA       LEU  74   9.009 -11.216  -8.076
    3    HB2  LEU  74           HB2      LEU  74   8.568 -11.961 -10.316
    4    HB3  LEU  74           HB3      LEU  74   6.898 -11.404 -10.223
    5    HG   LEU  74           HG       LEU  74   7.689  -9.072 -10.003
    6   HD13  LEU  74          HD11      LEU  74   9.802  -9.247  -8.946
    7   HD12  LEU  74          HD12      LEU  74  10.191  -8.766 -10.596
    8   HD11  LEU  74          HD13      LEU  74  10.377 -10.448 -10.100
    9   HD21  LEU  74          HD21      LEU  74   7.458 -10.507 -12.225
   10   HD23  LEU  74          HD22      LEU  74   9.169 -10.154 -12.316
   11   HD22  LEU  74          HD23      LEU  74   8.020  -8.836 -12.261

  No H/Q in entry =          11
  In of MODEL   77
    1    H    VAL  75           H        VAL  75   5.515 -10.830  -8.446
    2    HA   VAL  75           HA       VAL  75   5.417  -8.074  -7.861
    3    HB   VAL  75           HB       VAL  75   3.325 -10.216  -7.481
    4   HG12  VAL  75          HG11      VAL  75   1.743  -8.258  -7.391
    5   HG11  VAL  75          HG12      VAL  75   3.135  -7.185  -7.340
    6   HG13  VAL  75          HG13      VAL  75   2.841  -8.302  -6.015
    7   HG23  VAL  75          HG21      VAL  75   2.422  -9.059  -9.557
    8   HG22  VAL  75          HG22      VAL  75   3.935  -9.931  -9.799
    9   HG21  VAL  75          HG23      VAL  75   3.945  -8.174  -9.640

  No H/Q in entry =           9
  In of MODEL   77
    1    H    GLU  76           H        GLU  76   5.152 -10.949  -5.751
    2    HA   GLU  76           HA       GLU  76   4.671  -9.587  -3.333
    3    HB2  GLU  76           HB2      GLU  76   4.507 -12.062  -3.591
    4    HB3  GLU  76           HB3      GLU  76   6.250 -12.147  -3.776
    5    HG2  GLU  76           HG2      GLU  76   6.561 -11.272  -1.496
    6    HG3  GLU  76           HG3      GLU  76   4.826 -11.135  -1.283

  No H/Q in entry =           6
  In of MODEL   77
    1    H    ALA  77           H        ALA  77   7.738 -10.496  -4.880
    2    HA   ALA  77           HA       ALA  77   9.418  -9.453  -2.856
    3    HB2  ALA  77           HB1      ALA  77  11.196  -9.768  -4.365
    4    HB3  ALA  77           HB2      ALA  77  10.165  -9.510  -5.772
    5    HB1  ALA  77           HB3      ALA  77  10.020 -10.997  -4.835

  No H/Q in entry =           5
  In of MODEL   77
    1    H    GLN  78           H        GLN  78   8.042  -8.036  -5.778
    2    HA   GLN  78           HA       GLN  78   9.395  -5.558  -5.668
    3    HB2  GLN  78           HB2      GLN  78   8.108  -6.473  -7.631
    4    HB3  GLN  78           HB3      GLN  78   6.621  -6.092  -6.764
    5    HG2  GLN  78           HG2      GLN  78   7.273  -3.723  -6.670
    6    HG3  GLN  78           HG3      GLN  78   8.768  -4.094  -7.528
    7   HE21  GLN  78          HE21      GLN  78   6.874  -2.271  -8.648
    8   HE22  GLN  78          HE22      GLN  78   6.188  -2.986 -10.026

  No H/Q in entry =           8
  In of MODEL   77
    1    H    LEU  79           H        LEU  79   6.367  -6.692  -4.253
    2    HA   LEU  79           HA       LEU  79   5.370  -4.283  -3.251
    3    HB2  LEU  79           HB2      LEU  79   4.053  -6.334  -3.201
    4    HB3  LEU  79           HB3      LEU  79   5.192  -7.074  -2.079
    5    HG   LEU  79           HG       LEU  79   4.631  -5.430  -0.356
    6   HD13  LEU  79          HD11      LEU  79   4.174  -3.416  -1.410
    7   HD12  LEU  79          HD12      LEU  79   2.545  -3.939  -0.980
    8   HD11  LEU  79          HD13      LEU  79   3.135  -4.163  -2.625
    9   HD23  LEU  79          HD21      LEU  79   2.044  -5.919  -0.280
   10   HD22  LEU  79          HD22      LEU  79   3.181  -7.260  -0.165
   11   HD21  LEU  79          HD23      LEU  79   2.377  -6.923  -1.694

  No H/Q in entry =          11
  In of MODEL   77
    1    H    HIS  80           H        HIS  80   7.541  -6.620  -1.654
    2    HA   HIS  80           HA       HIS  80   7.817  -5.078   0.716
    3    HB2  HIS  80           HB2      HIS  80   9.160  -7.444  -0.474
    4    HB3  HIS  80           HB3      HIS  80  10.064  -6.547   0.747
    5    HD1  HIS  80           HD1      HIS  80   9.559  -7.182   3.088
    6    HD2  HIS  80           HD2      HIS  80   6.356  -8.029   0.557
    7    HE1  HIS  80           HE1      HIS  80   7.777  -8.282   4.526
    8    HE2  HIS  80           HE2      HIS  80   5.818  -8.802   2.992

  No H/Q in entry =           8
  In of MODEL   77
    1    H    LEU  81           H        LEU  81   9.840  -5.358  -2.185
    2    HA   LEU  81           HA       LEU  81  11.881  -3.619  -1.295
    3    HB2  LEU  81           HB2      LEU  81  10.976  -4.412  -4.063
    4    HB3  LEU  81           HB3      LEU  81  12.396  -3.408  -3.764
    5    HG   LEU  81           HG       LEU  81  11.991  -6.128  -2.492
    6   HD12  LEU  81          HD11      LEU  81  13.816  -6.758  -4.230
    7   HD11  LEU  81          HD12      LEU  81  13.258  -5.333  -5.106
    8   HD13  LEU  81          HD13      LEU  81  12.142  -6.656  -4.774
    9   HD23  LEU  81          HD21      LEU  81  14.619  -5.817  -2.462
   10   HD22  LEU  81          HD22      LEU  81  13.631  -5.054  -1.218
   11   HD21  LEU  81          HD23      LEU  81  14.220  -4.104  -2.582

  No H/Q in entry =          11
  In of MODEL   77
    1    H    MET  82           H        MET  82   8.972  -2.979  -3.250
    2    HA   MET  82           HA       MET  82   9.520  -0.254  -3.748
    3    HB2  MET  82           HB2      MET  82   6.956  -1.843  -3.638
    4    HB3  MET  82           HB3      MET  82   6.962  -0.118  -4.003
    5    HG2  MET  82           HG2      MET  82   8.567  -2.196  -5.528
    6    HG3  MET  82           HG3      MET  82   7.005  -1.571  -6.050
    7    HE3  MET  82           HE1      MET  82   7.468   1.883  -7.221
    8    HE2  MET  82           HE2      MET  82   7.082   1.658  -5.516
    9    HE1  MET  82           HE3      MET  82   6.422   0.549  -6.715

  No H/Q in entry =           9
  In of MODEL   77
    1    H    THR  83           H        THR  83   7.708  -1.847  -1.154
    2    HA   THR  83           HA       THR  83   6.855   0.504   0.166
    3    HB   THR  83           HB       THR  83   6.704  -1.070   2.184
    4    HG1  THR  83           HG1      THR  83   7.458  -3.022   1.960
    5   HG22  THR  83          HG21      THR  83   5.056  -2.632   0.707
    6   HG21  THR  83          HG22      THR  83   5.293  -1.305  -0.424
    7   HG23  THR  83          HG23      THR  83   4.643  -0.988   1.185

  No H/Q in entry =           7
  In of MODEL   77
    1    H    SER  84           H        SER  84   9.670  -1.601   0.706
    2    HA   SER  84           HA       SER  84  10.719  -0.172   2.900
    3    HB2  SER  84           HB2      SER  84  11.981  -2.019   0.883
    4    HB3  SER  84           HB3      SER  84  12.921  -1.267   2.171
    5    HG   SER  84           HG       SER  84  10.640  -2.951   2.417

  No H/Q in entry =           5
  In of MODEL   77
    1    H    MET  85           H        MET  85  11.495   0.086  -0.584
    2    HA   MET  85           HA       MET  85  13.497   2.045  -0.321
    3    HB2  MET  85           HB2      MET  85  13.108   0.762  -2.388
    4    HB3  MET  85           HB3      MET  85  11.587   1.623  -2.628
    5    HG2  MET  85           HG2      MET  85  12.797   3.762  -2.746
    6    HG3  MET  85           HG3      MET  85  14.320   2.924  -2.468
    7    HE2  MET  85           HE1      MET  85  15.488   1.668  -5.682
    8    HE1  MET  85           HE2      MET  85  15.415   1.270  -3.967
    9    HE3  MET  85           HE3      MET  85  15.830   2.906  -4.464

  No H/Q in entry =           9
  In of MODEL   77
    1    H    LEU  86           H        LEU  86  10.011   2.390  -0.852
    2    HA   LEU  86           HA       LEU  86   9.956   5.203  -1.035
    3    HB2  LEU  86           HB2      LEU  86   8.111   3.548  -1.622
    4    HB3  LEU  86           HB3      LEU  86   7.770   3.460   0.106
    5    HG   LEU  86           HG       LEU  86   7.617   6.021   0.051
    6   HD11  LEU  86          HD11      LEU  86   8.408   5.582  -2.645
    7   HD13  LEU  86          HD12      LEU  86   7.972   7.111  -1.888
    8   HD12  LEU  86          HD13      LEU  86   6.738   6.151  -2.700
    9   HD23  LEU  86          HD21      LEU  86   5.490   4.674  -1.624
   10   HD22  LEU  86          HD22      LEU  86   5.296   5.935  -0.409
   11   HD21  LEU  86          HD23      LEU  86   5.687   4.290   0.087

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ALA  87           H        ALA  87   9.467   3.027   1.709
    2    HA   ALA  87           HA       ALA  87   8.912   4.944   3.674
    3    HB1  ALA  87           HB1      ALA  87   9.711   2.121   3.594
    4    HB3  ALA  87           HB2      ALA  87   8.582   2.937   4.672
    5    HB2  ALA  87           HB3      ALA  87  10.308   2.963   5.027

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ARG  88           H        ARG  88  11.997   3.509   2.713
    2    HA   ARG  88           HA       ARG  88  13.600   4.883   4.555
    3    HB2  ARG  88           HB2      ARG  88  14.270   2.906   3.156
    4    HB3  ARG  88           HB3      ARG  88  14.435   3.998   1.783
    5    HG2  ARG  88           HG2      ARG  88  15.900   5.308   3.738
    6    HG3  ARG  88           HG3      ARG  88  16.213   3.618   4.120
    7    HD2  ARG  88           HD2      ARG  88  17.490   3.317   2.281
    8    HD3  ARG  88           HD3      ARG  88  16.362   4.191   1.241
    9    HE   ARG  88           HE       ARG  88  18.754   5.248   2.302
   10   HH21  ARG  88          HH11      ARG  88  19.108   7.465   2.108
   11   HH22  ARG  88          HH12      ARG  88  17.761   8.541   1.957
   12   HH11  ARG  88          HH21      ARG  88  15.419   6.011   2.003
   13   HH12  ARG  88          HH22      ARG  88  15.671   7.715   1.873

  No H/Q in entry =          13
  In of MODEL   77
    1    H    GLU  89           H        GLU  89  12.649   5.782   1.225
    2    HA   GLU  89           HA       GLU  89  14.204   8.137   1.077
    3    HB2  GLU  89           HB2      GLU  89  13.068   7.099  -0.877
    4    HB3  GLU  89           HB3      GLU  89  11.522   7.645  -0.229
    5    HG2  GLU  89           HG2      GLU  89  12.232   9.981  -0.388
    6    HG3  GLU  89           HG3      GLU  89  13.837   9.485  -0.915

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LEU  90           H        LEU  90  10.867   7.639   2.187
    2    HA   LEU  90           HA       LEU  90  10.357  10.374   2.758
    3    HB2  LEU  90           HB2      LEU  90   9.148   7.805   3.779
    4    HB3  LEU  90           HB3      LEU  90   8.520   9.402   4.198
    5    HG   LEU  90           HG       LEU  90   8.952   8.520   1.332
    6   HD12  LEU  90          HD11      LEU  90   6.417   8.199   1.379
    7   HD11  LEU  90          HD12      LEU  90   6.562   8.189   3.137
    8   HD13  LEU  90          HD13      LEU  90   7.382   6.956   2.178
    9   HD22  LEU  90          HD21      LEU  90   8.666  10.829   1.255
   10   HD21  LEU  90          HD22      LEU  90   7.671  10.865   2.710
   11   HD23  LEU  90          HD23      LEU  90   6.981  10.311   1.184

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  91           H        ILE  91  11.600   7.689   4.689
    2    HA   ILE  91           HA       ILE  91  11.731   9.055   7.157
    3    HB   ILE  91           HB       ILE  91  13.284   6.711   6.043
    4   HG12  ILE  91          HG12      ILE  91  11.255   6.886   8.291
    5   HG13  ILE  91          HG13      ILE  91  10.793   6.606   6.613
    6   HG22  ILE  91          HG21      ILE  91  13.738   6.497   8.687
    7   HG21  ILE  91          HG22      ILE  91  13.668   8.256   8.585
    8   HG23  ILE  91          HG23      ILE  91  14.849   7.364   7.627
    9   HD13  ILE  91          HD11      ILE  91  11.790   4.501   6.550
   10   HD12  ILE  91          HD12      ILE  91  11.187   4.562   8.206
   11   HD11  ILE  91          HD13      ILE  91  12.891   4.869   7.877

  No H/Q in entry =          11
  In of MODEL   77
    1    H    THR  92           H        THR  92  13.963   8.878   4.418
    2    HA   THR  92           HA       THR  92  16.126  10.265   5.590
    3    HB   THR  92           HB       THR  92  15.156  10.142   2.724
    4    HG1  THR  92           HG1      THR  92  15.979   8.242   3.134
    5   HG22  THR  92          HG21      THR  92  17.730  10.824   2.444
    6   HG21  THR  92          HG22      THR  92  17.415  11.646   3.972
    7   HG23  THR  92          HG23      THR  92  16.455  12.036   2.545

  No H/Q in entry =           7
  In of MODEL   77
    1    H    GLU  93           H        GLU  93  13.252  11.426   3.844
    2    HA   GLU  93           HA       GLU  93  13.855  14.185   3.960
    3    HB2  GLU  93           HB2      GLU  93  11.146  12.821   3.959
    4    HB3  GLU  93           HB3      GLU  93  11.442  14.520   3.589
    5    HG2  GLU  93           HG2      GLU  93  12.781  12.273   2.069
    6    HG3  GLU  93           HG3      GLU  93  11.240  12.960   1.573

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LEU  94           H        LEU  94  12.093  12.035   6.162
    2    HA   LEU  94           HA       LEU  94  11.279  13.985   8.033
    3    HB2  LEU  94           HB2      LEU  94  11.844  11.028   8.312
    4    HB3  LEU  94           HB3      LEU  94  11.268  12.006   9.658
    5    HG   LEU  94           HG       LEU  94   9.799  12.061   7.021
    6   HD11  LEU  94          HD11      LEU  94   9.863   9.841   9.027
    7   HD13  LEU  94          HD12      LEU  94   9.571   9.780   7.290
    8   HD12  LEU  94          HD13      LEU  94   8.288  10.301   8.381
    9   HD23  LEU  94          HD21      LEU  94   7.872  12.468   8.610
   10   HD22  LEU  94          HD22      LEU  94   9.114  13.718   8.654
   11   HD21  LEU  94          HD23      LEU  94   9.041  12.502   9.928

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  95           H        ILE  95  14.248  12.046   7.814
    2    HA   ILE  95           HA       ILE  95  15.405  12.966  10.234
    3    HB   ILE  95           HB       ILE  95  16.655  11.892   7.693
    4   HG12  ILE  95          HG12      ILE  95  16.340  10.693  10.459
    5   HG13  ILE  95          HG13      ILE  95  15.180  10.438   9.158
    6   HG21  ILE  95          HG21      ILE  95  17.898  12.696  10.342
    7   HG23  ILE  95          HG22      ILE  95  18.371  13.222   8.725
    8   HG22  ILE  95          HG23      ILE  95  18.669  11.561   9.236
    9   HD13  ILE  95          HD11      ILE  95  16.663   9.154   7.903
   10   HD12  ILE  95          HD12      ILE  95  17.125   8.704   9.542
   11   HD11  ILE  95          HD13      ILE  95  18.087   9.881   8.648

  No H/Q in entry =          11
  In of MODEL   77
    1    H    GLU  96           H        GLU  96  15.582  14.197   6.900
    2    HA   GLU  96           HA       GLU  96  17.432  16.270   7.386
    3    HB2  GLU  96           HB2      GLU  96  16.778  15.609   5.124
    4    HB3  GLU  96           HB3      GLU  96  15.135  16.171   5.415
    5    HG2  GLU  96           HG2      GLU  96  15.711  18.299   4.875
    6    HG3  GLU  96           HG3      GLU  96  17.003  18.296   6.064

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LEU  97           H        LEU  97  13.918  16.094   7.796
    2    HA   LEU  97           HA       LEU  97  13.507  18.830   8.435
    3    HB2  LEU  97           HB2      LEU  97  11.977  16.309   9.042
    4    HB3  LEU  97           HB3      LEU  97  11.466  17.858   9.710
    5    HG   LEU  97           HG       LEU  97  11.963  17.439   6.748
    6   HD12  LEU  97          HD11      LEU  97   9.440  17.319   6.616
    7   HD11  LEU  97          HD12      LEU  97   9.424  17.120   8.366
    8   HD13  LEU  97          HD13      LEU  97  10.206  15.910   7.349
    9   HD23  LEU  97          HD21      LEU  97  10.231  19.409   6.770
   10   HD22  LEU  97          HD22      LEU  97  11.912  19.763   7.172
   11   HD21  LEU  97          HD23      LEU  97  10.716  19.597   8.455

  No H/Q in entry =          11
  In of MODEL   77
    1    H    HIS  98           H        HIS  98  14.309  16.002  10.436
    2    HA   HIS  98           HA       HIS  98  14.142  17.264  12.951
    3    HB2  HIS  98           HB2      HIS  98  15.889  15.001  11.959
    4    HB3  HIS  98           HB3      HIS  98  15.881  15.540  13.640
    5    HD1  HIS  98           HD1      HIS  98  13.690  13.916  11.037
    6    HD2  HIS  98           HD2      HIS  98  13.564  14.838  15.100
    7    HE1  HIS  98           HE1      HIS  98  11.656  12.729  11.979
    8    HE2  HIS  98           HE2      HIS  98  11.560  13.281  14.449

  No H/Q in entry =           8
  In of MODEL   77
    1    H    GLU  99           H        GLU  99  16.708  17.140  10.530
    2    HA   GLU  99           HA       GLU  99  18.689  18.465  12.069
    3    HB2  GLU  99           HB2      GLU  99  19.175  17.175  10.003
    4    HB3  GLU  99           HB3      GLU  99  18.375  18.433   9.057
    5    HG2  GLU  99           HG2      GLU  99  19.984  20.098   9.856
    6    HG3  GLU  99           HG3      GLU  99  20.754  18.894  10.883

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LYS 100           H        LYS 100  16.181  19.635   9.839
    2    HA   LYS 100           HA       LYS 100  16.987  22.370   9.986
    3    HB2  LYS 100           HB2      LYS 100  14.354  21.090   9.218
    4    HB3  LYS 100           HB3      LYS 100  14.660  22.827   9.129
    5    HG2  LYS 100           HG2      LYS 100  16.639  22.371   7.673
    6    HG3  LYS 100           HG3      LYS 100  16.219  20.656   7.689
    7    HD2  LYS 100           HD2      LYS 100  14.031  21.173   6.677
    8    HD3  LYS 100           HD3      LYS 100  14.434  22.890   6.668
    9    HE2  LYS 100           HE2      LYS 100  16.399  22.402   5.219
   10    HE3  LYS 100           HE3      LYS 100  15.927  20.699   5.183
   11    HZ1  LYS 100           HZ1      LYS 100  14.115  22.899   4.338
   12    HZ3  LYS 100           HZ2      LYS 100  13.926  21.230   4.075
   13    HZ2  LYS 100           HZ3      LYS 100  15.144  22.087   3.260

  No H/Q in entry =          13
  In of MODEL   77
    1    H    LEU 101           H        LEU 101  14.872  20.332  11.941
    2    HA   LEU 101           HA       LEU 101  13.706  22.405  13.513
    3    HB2  LEU 101           HB2      LEU 101  14.134  19.454  13.899
    4    HB3  LEU 101           HB3      LEU 101  13.595  20.436  15.257
    5    HG   LEU 101           HG       LEU 101  12.191  20.529  12.581
    6   HD12  LEU 101          HD11      LEU 101  10.520  18.972  13.841
    7   HD11  LEU 101          HD12      LEU 101  11.907  18.554  14.843
    8   HD13  LEU 101          HD13      LEU 101  11.949  18.247  13.107
    9   HD21  LEU 101          HD21      LEU 101  11.523  21.325  15.429
   10   HD23  LEU 101          HD22      LEU 101  10.267  21.104  14.212
   11   HD22  LEU 101          HD23      LEU 101  11.508  22.335  13.981

  No H/Q in entry =          11
  In of MODEL   77
    1    H    LYS 102           H        LYS 102  16.853  21.785  13.093
    2    HA   LYS 102           HA       LYS 102  18.697  22.649  14.175
    3    HB2  LYS 102           HB2      LYS 102  16.883  24.171  15.298
    4    HB3  LYS 102           HB3      LYS 102  17.079  23.108  16.676
    5    HG2  LYS 102           HG2      LYS 102  18.986  25.111  15.517
    6    HG3  LYS 102           HG3      LYS 102  18.594  24.799  17.194
    7    HD2  LYS 102           HD2      LYS 102  20.262  22.879  15.517
    8    HD3  LYS 102           HD3      LYS 102  20.952  24.199  16.453
    9    HE2  LYS 102           HE2      LYS 102  20.538  21.652  17.420
   10    HE3  LYS 102           HE3      LYS 102  20.757  23.093  18.412
   11    HZ2  LYS 102           HZ1      LYS 102  18.780  21.817  19.020
   12    HZ1  LYS 102           HZ2      LYS 102  18.145  22.049  17.468
   13    HZ3  LYS 102           HZ3      LYS 102  18.376  23.378  18.495

  No H/Q in entry =          13
  In of MODEL   77
    1    H    ALA 103           H        ALA 103  16.606  21.052  16.586
    2    HA   ALA 103           HA       ALA 103  18.320  19.835  18.250
    3    HB2  ALA 103           HB1      ALA 103  16.728  17.833  18.236
    4    HB1  ALA 103           HB2      ALA 103  15.842  18.690  16.974
    5    HB3  ALA 103           HB3      ALA 103  16.015  19.411  18.573

  No H/Q in entry =           5
  In of MODEL   77
    1    H1   ALA   1           H3       ALA   1  -1.511  -6.944 -21.471
    2    H2   ALA   1           H2       ALA   1  -2.314  -8.375 -21.021
    3    H3   ALA   1           H1       ALA   1  -0.704  -8.432 -21.568
    4    HA   ALA   1           HA       ALA   1  -1.529  -8.898 -23.569
    5    HB1  ALA   1           HB1      ALA   1  -3.672  -9.607 -23.106
    6    HB2  ALA   1           HB2      ALA   1  -4.100  -8.094 -23.906
    7    HB3  ALA   1           HB3      ALA   1  -4.049  -8.175 -22.147

  No H/Q in entry =           7
  In of MODEL   77
    1    H    GLU   2           H        GLU   2  -2.343  -7.704 -25.562
    2    HA   GLU   2           HA       GLU   2  -0.931  -5.697 -26.432
    3    HB2  GLU   2           HB2      GLU   2  -3.936  -5.750 -26.766
    4    HB3  GLU   2           HB3      GLU   2  -2.806  -4.892 -27.810
    5    HG2  GLU   2           HG2      GLU   2  -2.305  -6.784 -28.962
    6    HG3  GLU   2           HG3      GLU   2  -2.020  -7.691 -27.483

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLU   3           H        GLU   3  -4.090  -4.425 -25.549
    2    HA   GLU   3           HA       GLU   3  -3.035  -1.874 -24.915
    3    HB2  GLU   3           HB2      GLU   3  -5.731  -3.177 -24.598
    4    HB3  GLU   3           HB3      GLU   3  -5.429  -1.563 -23.950
    5    HG2  GLU   3           HG2      GLU   3  -5.057  -0.638 -26.074
    6    HG3  GLU   3           HG3      GLU   3  -4.665  -2.194 -26.796

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LEU   4           H        LEU   4  -4.648  -4.226 -22.744
    2    HA   LEU   4           HA       LEU   4  -4.291  -2.999 -20.351
    3    HB2  LEU   4           HB2      LEU   4  -3.759  -5.943 -20.818
    4    HB3  LEU   4           HB3      LEU   4  -4.170  -5.195 -19.276
    5    HG   LEU   4           HG       LEU   4  -5.930  -5.261 -21.750
    6   HD13  LEU   4          HD11      LEU   4  -7.136  -6.973 -20.759
    7   HD12  LEU   4          HD12      LEU   4  -6.658  -6.515 -19.125
    8   HD11  LEU   4          HD13      LEU   4  -5.520  -7.364 -20.170
    9   HD23  LEU   4          HD21      LEU   4  -7.621  -4.442 -19.891
   10   HD22  LEU   4          HD22      LEU   4  -6.573  -3.275 -20.696
   11   HD21  LEU   4          HD23      LEU   4  -6.158  -3.867 -19.088

  No H/Q in entry =          11
  In of MODEL   77
    1    H    GLU   5           H        GLU   5  -1.792  -4.854 -22.069
    2    HA   GLU   5           HA       GLU   5   0.181  -4.579 -20.021
    3    HB2  GLU   5           HB2      GLU   5   0.236  -6.346 -21.785
    4    HB3  GLU   5           HB3      GLU   5   0.588  -5.098 -22.980
    5    HG2  GLU   5           HG2      GLU   5   2.639  -4.494 -21.770
    6    HG3  GLU   5           HG3      GLU   5   2.289  -5.711 -20.544

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLU   6           H        GLU   6  -0.429  -2.863 -23.069
    2    HA   GLU   6           HA       GLU   6   1.748  -1.041 -22.789
    3    HB2  GLU   6           HB2      GLU   6  -0.807  -0.917 -24.407
    4    HB3  GLU   6           HB3      GLU   6   0.481   0.283 -24.517
    5    HG2  GLU   6           HG2      GLU   6   2.073  -1.430 -25.206
    6    HG3  GLU   6           HG3      GLU   6   0.856  -2.687 -24.990

  No H/Q in entry =           6
  In of MODEL   77
    1    H    VAL   7           H        VAL   7  -1.597  -1.097 -21.763
    2    HA   VAL   7           HA       VAL   7  -1.810   1.616 -20.927
    3    HB   VAL   7           HB       VAL   7  -3.289  -0.894 -20.099
    4   HG11  VAL   7          HG11      VAL   7  -3.655   1.996 -19.287
    5   HG13  VAL   7          HG12      VAL   7  -3.567   0.571 -18.251
    6   HG12  VAL   7          HG13      VAL   7  -4.993   0.847 -19.251
    7   HG21  VAL   7          HG21      VAL   7  -3.427   0.183 -22.488
    8   HG23  VAL   7          HG22      VAL   7  -4.372   1.436 -21.681
    9   HG22  VAL   7          HG23      VAL   7  -4.925  -0.239 -21.658

  No H/Q in entry =           9
  In of MODEL   77
    1    H    VAL   8           H        VAL   8  -0.845  -1.373 -19.279
    2    HA   VAL   8           HA       VAL   8  -0.536  -0.296 -16.681
    3    HB   VAL   8           HB       VAL   8   0.841  -2.624 -18.040
    4   HG13  VAL   8          HG11      VAL   8   2.300  -2.001 -16.274
    5   HG12  VAL   8          HG12      VAL   8   1.296  -3.279 -15.589
    6   HG11  VAL   8          HG13      VAL   8   0.962  -1.592 -15.202
    7   HG23  VAL   8          HG21      VAL   8  -1.067  -3.075 -15.812
    8   HG22  VAL   8          HG22      VAL   8  -0.949  -3.888 -17.370
    9   HG21  VAL   8          HG23      VAL   8  -1.803  -2.355 -17.242

  No H/Q in entry =           9
  In of MODEL   77
    1    H    MET   9           H        MET   9   1.726  -0.607 -19.417
    2    HA   MET   9           HA       MET   9   4.010   0.425 -18.143
    3    HB2  MET   9           HB2      MET   9   3.073   0.420 -21.006
    4    HB3  MET   9           HB3      MET   9   4.565   1.236 -20.542
    5    HG2  MET   9           HG2      MET   9   5.582  -0.768 -19.826
    6    HG3  MET   9           HG3      MET   9   4.037  -1.612 -19.707
    7    HE3  MET   9           HE1      MET   9   4.363   0.733 -22.789
    8    HE2  MET   9           HE2      MET   9   5.639  -0.056 -23.713
    9    HE1  MET   9           HE3      MET   9   5.991   0.596 -22.115

  No H/Q in entry =           9
  In of MODEL   77
    1    H    GLY  10           H        GLY  10   1.343   2.041 -19.834
    2    HA3  GLY  10           HA2      GLY  10   2.320   4.689 -19.584
    3    HA2  GLY  10           HA3      GLY  10   0.629   4.238 -19.798

  No H/Q in entry =           3
  In of MODEL   77
    1    H    LEU  11           H        LEU  11   0.209   2.713 -17.514
    2    HA   LEU  11           HA       LEU  11  -0.320   4.692 -15.557
    3    HB2  LEU  11           HB2      LEU  11  -0.270   1.676 -15.401
    4    HB3  LEU  11           HB3      LEU  11  -0.780   2.702 -14.061
    5    HG   LEU  11           HG       LEU  11  -2.004   2.823 -16.831
    6   HD13  LEU  11          HD11      LEU  11  -2.604   0.683 -16.079
    7   HD12  LEU  11          HD12      LEU  11  -3.952   1.683 -15.540
    8   HD11  LEU  11          HD13      LEU  11  -2.704   1.195 -14.394
    9   HD22  LEU  11          HD21      LEU  11  -2.589   4.842 -15.826
   10   HD21  LEU  11          HD22      LEU  11  -2.526   4.175 -14.195
   11   HD23  LEU  11          HD23      LEU  11  -3.898   3.817 -15.244

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  12           H        ILE  12   2.210   2.211 -15.787
    2    HA   ILE  12           HA       ILE  12   3.406   2.741 -13.278
    3    HB   ILE  12           HB       ILE  12   4.670   1.696 -15.834
    4   HG12  ILE  12          HG12      ILE  12   2.641   0.475 -14.712
    5   HG13  ILE  12          HG13      ILE  12   4.041  -0.469 -15.180
    6   HG21  ILE  12          HG21      ILE  12   5.621   1.644 -12.952
    7   HG23  ILE  12          HG22      ILE  12   6.420   2.410 -14.324
    8   HG22  ILE  12          HG23      ILE  12   6.320   0.653 -14.230
    9   HD12  ILE  12          HD11      ILE  12   3.151  -1.004 -12.902
   10   HD11  ILE  12          HD12      ILE  12   3.552   0.639 -12.405
   11   HD13  ILE  12          HD13      ILE  12   4.821  -0.466 -12.883

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  13           H        ILE  13   4.031   4.002 -16.531
    2    HA   ILE  13           HA       ILE  13   6.175   5.709 -15.796
    3    HB   ILE  13           HB       ILE  13   4.156   5.797 -18.051
    4   HG12  ILE  13          HG12      ILE  13   5.992   3.956 -17.764
    5   HG13  ILE  13          HG13      ILE  13   5.756   4.697 -19.343
    6   HG23  ILE  13          HG21      ILE  13   4.794   8.040 -17.996
    7   HG22  ILE  13          HG22      ILE  13   6.001   7.365 -19.085
    8   HG21  ILE  13          HG23      ILE  13   6.416   7.680 -17.401
    9   HD11  ILE  13          HD11      ILE  13   7.823   5.700 -17.354
   10   HD13  ILE  13          HD12      ILE  13   7.666   6.121 -19.055
   11   HD12  ILE  13          HD13      ILE  13   8.175   4.500 -18.596

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ASN  14           H        ASN  14   2.672   6.225 -16.080
    2    HA   ASN  14           HA       ASN  14   2.643   8.971 -15.443
    3    HB2  ASN  14           HB2      ASN  14   0.744   7.340 -16.283
    4    HB3  ASN  14           HB3      ASN  14   0.414   7.163 -14.564
    5   HD21  ASN  14          HD21      ASN  14  -1.592   8.332 -16.005
    6   HD22  ASN  14          HD22      ASN  14  -1.646  10.005 -15.738

  No H/Q in entry =           6
  In of MODEL   77
    1    H    SER  15           H        SER  15   2.321   6.095 -13.368
    2    HA   SER  15           HA       SER  15   2.011   7.467 -10.921
    3    HB2  SER  15           HB2      SER  15   2.542   5.378  -9.870
    4    HB3  SER  15           HB3      SER  15   1.720   4.963 -11.369
    5    HG   SER  15           HG       SER  15   4.360   4.623 -10.622

  No H/Q in entry =           5
  In of MODEL   77
    1    H    GLY  16           H        GLY  16   4.889   6.354 -12.667
    2    HA3  GLY  16           HA2      GLY  16   6.809   7.099 -10.727
    3    HA2  GLY  16           HA3      GLY  16   7.119   6.896 -12.449

  No H/Q in entry =           3
  In of MODEL   77
    1    H    GLN  17           H        GLN  17   5.445   8.863 -13.519
    2    HA   GLN  17           HA       GLN  17   7.033  11.196 -13.203
    3    HB2  GLN  17           HB2      GLN  17   4.287  10.781 -14.416
    4    HB3  GLN  17           HB3      GLN  17   5.154  12.316 -14.484
    5    HG2  GLN  17           HG2      GLN  17   7.018  11.247 -15.655
    6    HG3  GLN  17           HG3      GLN  17   6.217   9.681 -15.538
    7   HE21  GLN  17          HE21      GLN  17   6.861  11.845 -17.834
    8   HE22  GLN  17          HE22      GLN  17   5.428  11.799 -18.742

  No H/Q in entry =           8
  In of MODEL   77
    1    H    ALA  18           H        ALA  18   3.921  10.193 -11.869
    2    HA   ALA  18           HA       ALA  18   3.202  12.585 -10.606
    3    HB1  ALA  18           HB1      ALA  18   2.062  10.134 -10.834
    4    HB2  ALA  18           HB2      ALA  18   1.514  11.356  -9.690
    5    HB3  ALA  18           HB3      ALA  18   2.595  10.069  -9.155

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ARG  19           H        ARG  19   5.057   9.813  -9.319
    2    HA   ARG  19           HA       ARG  19   5.583  10.968  -6.794
    3    HB2  ARG  19           HB2      ARG  19   5.988   8.563  -7.320
    4    HB3  ARG  19           HB3      ARG  19   7.351   9.044  -8.334
    5    HG2  ARG  19           HG2      ARG  19   8.466  10.078  -6.406
    6    HG3  ARG  19           HG3      ARG  19   7.084   9.696  -5.381
    7    HD2  ARG  19           HD2      ARG  19   8.837   8.053  -5.016
    8    HD3  ARG  19           HD3      ARG  19   7.463   7.277  -5.808
    9    HE   ARG  19           HE       ARG  19   9.181   8.089  -7.847
   10   HH21  ARG  19          HH11      ARG  19  10.740   6.677  -8.690
   11   HH22  ARG  19          HH12      ARG  19  11.275   5.326  -7.752
   12   HH11  ARG  19          HH21      ARG  19   9.231   6.057  -5.069
   13   HH12  ARG  19          HH22      ARG  19  10.418   4.975  -5.701

  No H/Q in entry =          13
  In of MODEL   77
    1    H    SER  20           H        SER  20   7.415  10.991  -9.834
    2    HA   SER  20           HA       SER  20   9.661  12.397  -8.999
    3    HB2  SER  20           HB2      SER  20   9.442  11.407 -11.249
    4    HB3  SER  20           HB3      SER  20   8.244  12.627 -11.664
    5    HG   SER  20           HG       SER  20   9.778  14.164 -11.624

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LEU  21           H        LEU  21   6.573  13.678 -10.211
    2    HA   LEU  21           HA       LEU  21   7.253  16.421  -9.983
    3    HB2  LEU  21           HB2      LEU  21   4.579  15.007  -9.915
    4    HB3  LEU  21           HB3      LEU  21   4.753  16.761  -9.920
    5    HG   LEU  21           HG       LEU  21   5.951  14.960 -12.045
    6   HD12  LEU  21          HD11      LEU  21   3.376  16.565 -12.133
    7   HD11  LEU  21          HD12      LEU  21   3.475  14.807 -12.017
    8   HD13  LEU  21          HD13      LEU  21   4.063  15.628 -13.461
    9   HD23  LEU  21          HD21      LEU  21   5.740  17.288 -13.282
   10   HD22  LEU  21          HD22      LEU  21   7.103  17.018 -12.200
   11   HD21  LEU  21          HD23      LEU  21   5.718  17.949 -11.649

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ALA  22           H        ALA  22   5.722  14.137  -7.742
    2    HA   ALA  22           HA       ALA  22   5.115  15.946  -5.678
    3    HB3  ALA  22           HB1      ALA  22   4.347  13.557  -5.845
    4    HB2  ALA  22           HB2      ALA  22   4.929  14.026  -4.248
    5    HB1  ALA  22           HB3      ALA  22   5.955  13.065  -5.314

  No H/Q in entry =           5
  In of MODEL   77
    1    H    TYR  23           H        TYR  23   8.045  13.912  -6.103
    2    HA   TYR  23           HA       TYR  23   9.420  14.926  -3.844
    3    HB2  TYR  23           HB2      TYR  23  10.205  12.916  -5.001
    4    HB3  TYR  23           HB3      TYR  23  10.532  13.857  -6.456
    5    HD1  TYR  23           HD1      TYR  23  11.477  13.486  -2.866
    6    HD2  TYR  23           HD2      TYR  23  12.565  15.042  -6.720
    7    HE1  TYR  23           HE1      TYR  23  13.732  14.053  -2.001
    8    HE2  TYR  23           HE2      TYR  23  14.819  15.611  -5.854
    9    HH   TYR  23           HH       TYR  23  15.847  14.632  -2.625

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ALA  24           H        ALA  24   9.256  16.034  -7.211
    2    HA   ALA  24           HA       ALA  24  11.156  18.115  -6.955
    3    HB2  ALA  24           HB1      ALA  24  10.724  18.178  -9.166
    4    HB3  ALA  24           HB2      ALA  24   9.169  18.931  -8.814
    5    HB1  ALA  24           HB3      ALA  24   9.291  17.178  -8.943

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ALA  25           H        ALA  25   7.674  17.938  -6.351
    2    HA   ALA  25           HA       ALA  25   7.197  20.657  -5.783
    3    HB1  ALA  25           HB1      ALA  25   5.532  18.662  -5.992
    4    HB2  ALA  25           HB2      ALA  25   5.162  19.951  -4.846
    5    HB3  ALA  25           HB3      ALA  25   5.846  18.429  -4.272

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LEU  26           H        LEU  26   8.250  17.975  -3.729
    2    HA   LEU  26           HA       LEU  26   8.346  19.406  -1.291
    3    HB2  LEU  26           HB2      LEU  26   8.437  16.989  -1.285
    4    HB3  LEU  26           HB3      LEU  26   9.912  16.995  -2.249
    5    HG   LEU  26           HG       LEU  26  11.120  18.111  -0.403
    6   HD12  LEU  26          HD11      LEU  26   9.883  18.120   1.851
    7   HD11  LEU  26          HD12      LEU  26   8.400  17.985   0.909
    8   HD13  LEU  26          HD13      LEU  26   9.448  19.389   0.705
    9   HD21  LEU  26          HD21      LEU  26   9.579  15.645   0.463
   10   HD23  LEU  26          HD22      LEU  26  11.092  16.205   1.167
   11   HD22  LEU  26          HD23      LEU  26  11.053  15.646  -0.503

  No H/Q in entry =          11
  In of MODEL   77
    1    H    LYS  27           H        LYS  27  10.774  18.830  -3.804
    2    HA   LYS  27           HA       LYS  27  12.954  20.068  -2.566
    3    HB2  LYS  27           HB2      LYS  27  13.063  18.721  -4.656
    4    HB3  LYS  27           HB3      LYS  27  12.304  20.054  -5.525
    5    HG2  LYS  27           HG2      LYS  27  14.168  21.537  -4.939
    6    HG3  LYS  27           HG3      LYS  27  14.923  20.244  -3.998
    7    HD2  LYS  27           HD2      LYS  27  15.074  18.856  -6.052
    8    HD3  LYS  27           HD3      LYS  27  14.365  20.175  -6.983
    9    HE2  LYS  27           HE2      LYS  27  16.251  21.639  -6.362
   10    HE3  LYS  27           HE3      LYS  27  16.964  20.324  -5.421
   11    HZ3  LYS  27           HZ1      LYS  27  17.964  20.423  -7.603
   12    HZ2  LYS  27           HZ2      LYS  27  16.441  20.306  -8.351
   13    HZ1  LYS  27           HZ3      LYS  27  17.059  18.995  -7.463

  No H/Q in entry =          13
  In of MODEL   77
    1    H    GLN  28           H        GLN  28  10.342  21.452  -4.527
    2    HA   GLN  28           HA       GLN  28  11.304  24.104  -4.676
    3    HB2  GLN  28           HB2      GLN  28   8.471  23.033  -4.580
    4    HB3  GLN  28           HB3      GLN  28   8.884  24.707  -4.948
    5    HG2  GLN  28           HG2      GLN  28   9.888  22.300  -6.494
    6    HG3  GLN  28           HG3      GLN  28   8.556  23.336  -7.002
    7   HE21  GLN  28          HE21      GLN  28  11.685  22.841  -7.743
    8   HE22  GLN  28          HE22      GLN  28  12.179  24.427  -8.094

  No H/Q in entry =           8
  In of MODEL   77
    1    H    ALA  29           H        ALA  29   9.360  22.413  -2.249
    2    HA   ALA  29           HA       ALA  29   8.804  24.606  -0.570
    3    HB2  ALA  29           HB1      ALA  29   8.067  23.038   0.995
    4    HB1  ALA  29           HB2      ALA  29   9.290  21.853   0.536
    5    HB3  ALA  29           HB3      ALA  29   7.909  22.147  -0.519

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LYS  30           H        LYS  30  11.533  22.337  -0.626
    2    HA   LYS  30           HA       LYS  30  12.841  23.291   1.682
    3    HB2  LYS  30           HB2      LYS  30  13.948  22.004  -0.823
    4    HB3  LYS  30           HB3      LYS  30  14.925  22.363   0.603
    5    HG2  LYS  30           HG2      LYS  30  13.364  20.981   1.976
    6    HG3  LYS  30           HG3      LYS  30  12.486  20.559   0.502
    7    HD2  LYS  30           HD2      LYS  30  14.534  19.572  -0.450
    8    HD3  LYS  30           HD3      LYS  30  15.432  20.007   1.006
    9    HE2  LYS  30           HE2      LYS  30  13.921  18.577   2.354
   10    HE3  LYS  30           HE3      LYS  30  13.053  18.121   0.882
   11    HZ2  LYS  30           HZ1      LYS  30  14.841  16.542   1.651
   12    HZ1  LYS  30           HZ2      LYS  30  15.980  17.729   1.205
   13    HZ3  LYS  30           HZ3      LYS  30  14.950  17.046   0.036

  No H/Q in entry =          13
  In of MODEL   77
    1    H    GLN  31           H        GLN  31  12.747  24.495  -1.615
    2    HA   GLN  31           HA       GLN  31  14.899  26.387  -1.184
    3    HB2  GLN  31           HB2      GLN  31  12.866  26.435  -3.418
    4    HB3  GLN  31           HB3      GLN  31  14.486  27.130  -3.411
    5    HG2  GLN  31           HG2      GLN  31  14.945  24.434  -2.834
    6    HG3  GLN  31           HG3      GLN  31  13.646  24.380  -4.018
    7   HE21  GLN  31          HE21      GLN  31  16.491  23.586  -4.409
    8   HE22  GLN  31          HE22      GLN  31  17.070  24.559  -5.673

  No H/Q in entry =           8
  In of MODEL   77
    1    H    GLY  32           H        GLY  32  11.819  26.206  -0.052
    2    HA3  GLY  32           HA2      GLY  32  10.658  27.775   1.215
    3    HA2  GLY  32           HA3      GLY  32  11.786  29.010   0.670

  No H/Q in entry =           3
  In of MODEL   77
    1    H    ASP  33           H        ASP  33  10.433  27.106  -1.828
    2    HA   ASP  33           HA       ASP  33   8.773  29.380  -2.691
    3    HB2  ASP  33           HB2      ASP  33   9.872  26.960  -4.128
    4    HB3  ASP  33           HB3      ASP  33   8.724  28.075  -4.864

  No H/Q in entry =           4
  In of MODEL   77
    1    H    PHE  34           H        PHE  34   7.077  28.904  -1.135
    2    HA   PHE  34           HA       PHE  34   5.696  26.433  -1.045
    3    HB2  PHE  34           HB2      PHE  34   4.733  29.220  -0.370
    4    HB3  PHE  34           HB3      PHE  34   3.882  27.730   0.037
    5    HD1  PHE  34           HD1      PHE  34   6.127  30.128   1.262
    6    HD2  PHE  34           HD2      PHE  34   5.446  25.887   1.206
    7    HE1  PHE  34           HE1      PHE  34   7.509  29.877   3.305
    8    HE2  PHE  34           HE2      PHE  34   6.830  25.640   3.246
    9    HZ   PHE  34           HZ       PHE  34   7.855  27.636   4.295

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ALA  35           H        ALA  35   5.276  29.296  -3.058
    2    HA   ALA  35           HA       ALA  35   2.729  28.683  -4.095
    3    HB3  ALA  35           HB1      ALA  35   3.790  30.074  -6.128
    4    HB2  ALA  35           HB2      ALA  35   5.003  30.436  -4.899
    5    HB1  ALA  35           HB3      ALA  35   3.311  30.845  -4.616

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ALA  36           H        ALA  36   5.963  28.008  -5.435
    2    HA   ALA  36           HA       ALA  36   4.984  26.579  -7.682
    3    HB3  ALA  36           HB1      ALA  36   7.146  26.703  -8.289
    4    HB2  ALA  36           HB2      ALA  36   7.621  25.675  -6.936
    5    HB1  ALA  36           HB3      ALA  36   7.515  27.422  -6.721

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ALA  37           H        ALA  37   5.926  25.585  -4.423
    2    HA   ALA  37           HA       ALA  37   5.868  22.797  -4.852
    3    HB2  ALA  37           HB1      ALA  37   5.597  24.588  -2.475
    4    HB1  ALA  37           HB2      ALA  37   6.731  23.270  -2.762
    5    HB3  ALA  37           HB3      ALA  37   5.068  22.917  -2.299

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LYS  38           H        LYS  38   3.330  25.005  -3.696
    2    HA   LYS  38           HA       LYS  38   1.230  23.193  -3.482
    3    HB2  LYS  38           HB2      LYS  38   1.581  25.949  -3.230
    4    HB3  LYS  38           HB3      LYS  38   0.387  25.801  -4.514
    5    HG2  LYS  38           HG2      LYS  38  -1.069  24.478  -3.078
    6    HG3  LYS  38           HG3      LYS  38   0.170  24.418  -1.816
    7    HD2  LYS  38           HD2      LYS  38  -0.018  26.755  -1.370
    8    HD3  LYS  38           HD3      LYS  38  -0.923  27.044  -2.856
    9    HE2  LYS  38           HE2      LYS  38  -2.435  27.078  -0.924
   10    HE3  LYS  38           HE3      LYS  38  -2.805  25.702  -1.967
   11    HZ3  LYS  38           HZ1      LYS  38  -2.086  24.231  -0.431
   12    HZ2  LYS  38           HZ2      LYS  38  -2.442  25.489   0.657
   13    HZ1  LYS  38           HZ3      LYS  38  -0.845  25.238   0.139

  No H/Q in entry =          13
  In of MODEL   77
    1    H    ALA  39           H        ALA  39   2.223  25.095  -6.327
    2    HA   ALA  39           HA       ALA  39   0.154  24.227  -8.039
    3    HB2  ALA  39           HB1      ALA  39   2.896  24.875  -9.081
    4    HB1  ALA  39           HB2      ALA  39   1.926  26.136  -8.320
    5    HB3  ALA  39           HB3      ALA  39   1.319  25.299  -9.749

  No H/Q in entry =           5
  In of MODEL   77
    1    H    MET  40           H        MET  40   3.390  22.928  -7.445
    2    HA   MET  40           HA       MET  40   3.301  20.908  -9.436
    3    HB2  MET  40           HB2      MET  40   4.901  21.132  -6.881
    4    HB3  MET  40           HB3      MET  40   5.157  19.876  -8.094
    5    HG2  MET  40           HG2      MET  40   5.217  22.832  -8.759
    6    HG3  MET  40           HG3      MET  40   6.662  21.929  -8.304
    7    HE3  MET  40           HE1      MET  40   7.547  19.714 -11.108
    8    HE2  MET  40           HE2      MET  40   6.976  19.394  -9.473
    9    HE1  MET  40           HE3      MET  40   8.072  20.742  -9.768

  No H/Q in entry =           9
  In of MODEL   77
    1    H    MET  41           H        MET  41   2.370  20.950  -6.017
    2    HA   MET  41           HA       MET  41   1.837  18.186  -5.741
    3    HB2  MET  41           HB2      MET  41   0.498  20.543  -4.396
    4    HB3  MET  41           HB3      MET  41   0.340  18.865  -3.889
    5    HG2  MET  41           HG2      MET  41   3.051  19.089  -3.914
    6    HG3  MET  41           HG3      MET  41   2.608  20.747  -3.520
    7    HE2  MET  41           HE1      MET  41  -0.439  19.494  -1.808
    8    HE1  MET  41           HE2      MET  41   0.379  21.007  -2.182
    9    HE3  MET  41           HE3      MET  41   0.313  20.437  -0.514

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ASP  42           H        ASP  42  -0.197  20.910  -6.724
    2    HA   ASP  42           HA       ASP  42  -2.637  19.548  -6.872
    3    HB2  ASP  42           HB2      ASP  42  -1.930  22.119  -7.126
    4    HB3  ASP  42           HB3      ASP  42  -2.073  21.724  -8.835

  No H/Q in entry =           4
  In of MODEL   77
    1    H    GLN  43           H        GLN  43  -0.185  20.140  -9.363
    2    HA   GLN  43           HA       GLN  43  -1.563  18.820 -11.458
    3    HB2  GLN  43           HB2      GLN  43   1.394  19.337 -11.063
    4    HB3  GLN  43           HB3      GLN  43   0.687  18.697 -12.549
    5    HG2  GLN  43           HG2      GLN  43  -0.825  20.723 -12.597
    6    HG3  GLN  43           HG3      GLN  43   0.121  21.380 -11.265
    7   HE21  GLN  43          HE21      GLN  43   0.291  23.000 -13.351
    8   HE22  GLN  43          HE22      GLN  43   1.711  22.780 -14.252

  No H/Q in entry =           8
  In of MODEL   77
    1    H    SER  44           H        SER  44   0.778  17.681  -9.057
    2    HA   SER  44           HA       SER  44   1.119  15.074 -10.081
    3    HB2  SER  44           HB2      SER  44   2.003  16.514  -7.840
    4    HB3  SER  44           HB3      SER  44   1.138  15.130  -7.173
    5    HG   SER  44           HG       SER  44   3.251  14.511  -7.590

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ARG  45           H        ARG  45  -1.212  16.392  -7.753
    2    HA   ARG  45           HA       ARG  45  -2.600  14.030  -7.124
    3    HB2  ARG  45           HB2      ARG  45  -2.805  16.198  -5.934
    4    HB3  ARG  45           HB3      ARG  45  -3.656  16.864  -7.324
    5    HG2  ARG  45           HG2      ARG  45  -5.422  15.137  -7.049
    6    HG3  ARG  45           HG3      ARG  45  -4.583  14.526  -5.622
    7    HD2  ARG  45           HD2      ARG  45  -4.796  16.792  -4.567
    8    HD3  ARG  45           HD3      ARG  45  -5.778  17.311  -5.954
    9    HE   ARG  45           HE       ARG  45  -6.890  14.934  -4.919
   10   HH21  ARG  45          HH11      ARG  45  -8.732  15.008  -3.656
   11   HH22  ARG  45          HH12      ARG  45  -9.132  16.448  -2.789
   12   HH11  ARG  45          HH21      ARG  45  -6.352  18.182  -3.893
   13   HH12  ARG  45          HH22      ARG  45  -7.779  18.245  -2.921

  No H/Q in entry =          13
  In of MODEL   77
    1    H    MET  46           H        MET  46  -3.175  16.433  -9.678
    2    HA   MET  46           HA       MET  46  -5.508  15.259 -10.750
    3    HB2  MET  46           HB2      MET  46  -3.403  17.088 -11.915
    4    HB3  MET  46           HB3      MET  46  -4.780  16.530 -12.870
    5    HG2  MET  46           HG2      MET  46  -6.334  17.462 -11.228
    6    HG3  MET  46           HG3      MET  46  -4.993  17.955 -10.201
    7    HE1  MET  46           HE1      MET  46  -6.615  17.943 -13.442
    8    HE3  MET  46           HE2      MET  46  -5.309  18.609 -14.416
    9    HE2  MET  46           HE3      MET  46  -6.685  19.623 -13.989

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ALA  47           H        ALA  47  -2.075  14.783 -11.492
    2    HA   ALA  47           HA       ALA  47  -2.408  13.055 -13.704
    3    HB3  ALA  47           HB1      ALA  47  -0.233  13.947 -13.342
    4    HB2  ALA  47           HB2      ALA  47  -0.092  12.219 -13.007
    5    HB1  ALA  47           HB3      ALA  47  -0.192  13.371 -11.675

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LEU  48           H        LEU  48  -2.154  12.420 -10.229
    2    HA   LEU  48           HA       LEU  48  -2.244   9.580 -10.387
    3    HB2  LEU  48           HB2      LEU  48  -3.021  11.497  -8.177
    4    HB3  LEU  48           HB3      LEU  48  -2.925   9.747  -7.976
    5    HG   LEU  48           HG       LEU  48  -0.624  11.449  -8.963
    6   HD13  LEU  48          HD11      LEU  48  -0.918  12.219  -6.773
    7   HD12  LEU  48          HD12      LEU  48   0.246  10.913  -6.569
    8   HD11  LEU  48          HD13      LEU  48  -1.453  10.648  -6.179
    9   HD22  LEU  48          HD21      LEU  48  -0.119   9.264  -9.601
   10   HD21  LEU  48          HD22      LEU  48  -0.994   8.548  -8.249
   11   HD23  LEU  48          HD23      LEU  48   0.576   9.303  -7.981

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ASN  49           H        ASN  49  -4.712  12.069  -9.997
    2    HA   ASN  49           HA       ASN  49  -6.898  10.401  -9.468
    3    HB2  ASN  49           HB2      ASN  49  -6.971  12.818  -9.140
    4    HB3  ASN  49           HB3      ASN  49  -6.782  13.089 -10.868
    5   HD21  ASN  49          HD21      ASN  49  -9.001  11.540  -8.516
    6   HD22  ASN  49          HD22      ASN  49 -10.401  11.800  -9.437

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLU  50           H        GLU  50  -5.606  11.599 -12.549
    2    HA   GLU  50           HA       GLU  50  -7.551  10.341 -14.204
    3    HB2  GLU  50           HB2      GLU  50  -6.084  12.162 -15.012
    4    HB3  GLU  50           HB3      GLU  50  -4.689  11.092 -14.867
    5    HG2  GLU  50           HG2      GLU  50  -5.652   9.555 -16.508
    6    HG3  GLU  50           HG3      GLU  50  -7.114  10.531 -16.602

  No H/Q in entry =           6
  In of MODEL   77
    1    H    ALA  51           H        ALA  51  -4.385   9.353 -12.983
    2    HA   ALA  51           HA       ALA  51  -4.235   6.900 -14.400
    3    HB2  ALA  51           HB1      ALA  51  -2.259   6.615 -13.291
    4    HB1  ALA  51           HB2      ALA  51  -2.955   7.037 -11.726
    5    HB3  ALA  51           HB3      ALA  51  -2.496   8.308 -12.859

  No H/Q in entry =           5
  In of MODEL   77
    1    H    HIS  52           H        HIS  52  -5.425   7.731 -11.157
    2    HA   HIS  52           HA       HIS  52  -6.111   5.121 -10.328
    3    HB2  HIS  52           HB2      HIS  52  -5.981   7.088  -8.821
    4    HB3  HIS  52           HB3      HIS  52  -7.442   7.731  -9.571
    5    HD1  HIS  52           HD1      HIS  52  -9.637   6.181  -9.339
    6    HD2  HIS  52           HD2      HIS  52  -6.455   5.196  -6.833
    7    HE1  HIS  52           HE1      HIS  52 -10.587   4.687  -7.528
    8    HE2  HIS  52           HE2      HIS  52  -8.659   4.078  -5.990

  No H/Q in entry =           8
  In of MODEL   77
    1    H    LEU  53           H        LEU  53  -7.925   7.576 -12.126
    2    HA   LEU  53           HA       LEU  53 -10.429   6.282 -12.150
    3    HB2  LEU  53           HB2      LEU  53  -9.139   8.261 -14.017
    4    HB3  LEU  53           HB3      LEU  53 -10.737   7.597 -14.341
    5    HG   LEU  53           HG       LEU  53 -10.030   8.909 -11.698
    6   HD13  LEU  53          HD11      LEU  53  -9.729  10.659 -13.274
    7   HD12  LEU  53          HD12      LEU  53 -11.386  10.854 -12.700
    8   HD11  LEU  53          HD13      LEU  53 -11.074  10.108 -14.264
    9   HD21  LEU  53          HD21      LEU  53 -12.587   8.047 -13.062
   10   HD23  LEU  53          HD22      LEU  53 -12.604   9.314 -11.840
   11   HD22  LEU  53          HD23      LEU  53 -12.064   7.700 -11.418

  No H/Q in entry =          11
  In of MODEL   77
    1    H    VAL  54           H        VAL  54  -7.667   6.086 -14.374
    2    HA   VAL  54           HA       VAL  54  -8.879   4.314 -16.223
    3    HB   VAL  54           HB       VAL  54  -5.975   4.823 -15.526
    4   HG12  VAL  54          HG11      VAL  54  -5.716   3.738 -17.913
    5   HG11  VAL  54          HG12      VAL  54  -7.245   2.956 -17.518
    6   HG13  VAL  54          HG13      VAL  54  -5.835   2.703 -16.492
    7   HG22  VAL  54          HG21      VAL  54  -6.741   6.766 -16.575
    8   HG21  VAL  54          HG22      VAL  54  -7.929   5.901 -17.549
    9   HG23  VAL  54          HG23      VAL  54  -6.220   5.822 -17.971

  No H/Q in entry =           9
  In of MODEL   77
    1    H    GLN  55           H        GLN  55  -6.895   3.770 -13.313
    2    HA   GLN  55           HA       GLN  55  -6.802   0.953 -13.568
    3    HB2  GLN  55           HB2      GLN  55  -5.255   1.850 -12.042
    4    HB3  GLN  55           HB3      GLN  55  -6.476   2.816 -11.218
    5    HG2  GLN  55           HG2      GLN  55  -7.170   1.058  -9.904
    6    HG3  GLN  55           HG3      GLN  55  -6.938  -0.129 -11.181
    7   HE21  GLN  55          HE21      GLN  55  -5.316  -1.577 -10.678
    8   HE22  GLN  55          HE22      GLN  55  -3.937  -1.225  -9.759

  No H/Q in entry =           8
  In of MODEL   77
    1    H    THR  56           H        THR  56  -9.142   3.115 -11.966
    2    HA   THR  56           HA       THR  56 -10.732   1.231 -10.684
    3    HB   THR  56           HB       THR  56 -11.830   3.613 -12.197
    4    HG1  THR  56           HG1      THR  56 -11.433   4.607 -10.054
    5   HG21  THR  56          HG21      THR  56 -12.712   1.964  -9.834
    6   HG23  THR  56          HG22      THR  56 -13.613   2.353 -11.301
    7   HG22  THR  56          HG23      THR  56 -13.318   3.600 -10.088

  No H/Q in entry =           7
  In of MODEL   77
    1    H    LYS  57           H        LYS  57 -10.917   2.313 -14.072
    2    HA   LYS  57           HA       LYS  57 -13.069   0.625 -14.836
    3    HB2  LYS  57           HB2      LYS  57 -12.249   2.554 -16.173
    4    HB3  LYS  57           HB3      LYS  57 -10.743   1.696 -16.471
    5    HG2  LYS  57           HG2      LYS  57 -12.151   1.425 -18.412
    6    HG3  LYS  57           HG3      LYS  57 -12.067  -0.124 -17.582
    7    HD2  LYS  57           HD2      LYS  57 -14.257   0.123 -16.675
    8    HD3  LYS  57           HD3      LYS  57 -14.317   1.837 -17.080
    9    HE2  LYS  57           HE2      LYS  57 -14.329   1.291 -19.482
   10    HE3  LYS  57           HE3      LYS  57 -14.219  -0.430 -19.114
   11    HZ1  LYS  57           HZ1      LYS  57 -16.321   0.092 -17.694
   12    HZ3  LYS  57           HZ2      LYS  57 -16.453  -0.179 -19.366
   13    HZ2  LYS  57           HZ3      LYS  57 -16.474   1.407 -18.755

  No H/Q in entry =          13
  In of MODEL   77
    1    H    LEU  58           H        LEU  58  -9.565   0.195 -14.761
    2    HA   LEU  58           HA       LEU  58  -9.565  -2.322 -16.048
    3    HB2  LEU  58           HB2      LEU  58  -7.541  -1.029 -14.230
    4    HB3  LEU  58           HB3      LEU  58  -7.275  -2.551 -15.082
    5    HG   LEU  58           HG       LEU  58  -8.022   0.053 -16.451
    6   HD11  LEU  58          HD11      LEU  58  -5.379  -1.183 -15.745
    7   HD13  LEU  58          HD12      LEU  58  -5.875   0.508 -15.700
    8   HD12  LEU  58          HD13      LEU  58  -5.528  -0.264 -17.244
    9   HD22  LEU  58          HD21      LEU  58  -8.589  -1.510 -18.044
   10   HD21  LEU  58          HD22      LEU  58  -7.551  -2.757 -17.356
   11   HD23  LEU  58          HD23      LEU  58  -6.856  -1.484 -18.358

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  59           H        ILE  59 -10.404  -1.418 -12.802
    2    HA   ILE  59           HA       ILE  59 -10.057  -4.185 -11.851
    3    HB   ILE  59           HB       ILE  59  -9.621  -1.918 -10.451
    4   HG12  ILE  59          HG12      ILE  59 -11.001  -4.259  -9.123
    5   HG13  ILE  59          HG13      ILE  59  -9.361  -4.356  -9.714
    6   HG23  ILE  59          HG21      ILE  59 -11.461  -1.233  -9.142
    7   HG22  ILE  59          HG22      ILE  59 -12.400  -2.656  -9.534
    8   HG21  ILE  59          HG23      ILE  59 -12.154  -1.392 -10.738
    9   HD11  ILE  59          HD11      ILE  59  -8.830  -2.309  -8.343
   10   HD13  ILE  59          HD12      ILE  59  -9.206  -3.747  -7.402
   11   HD12  ILE  59          HD13      ILE  59 -10.420  -2.483  -7.605

  No H/Q in entry =          11
  In of MODEL   77
    1    H    GLU  60           H        GLU  60 -12.612  -1.871 -12.674
    2    HA   GLU  60           HA       GLU  60 -14.801  -3.388 -11.672
    3    HB2  GLU  60           HB2      GLU  60 -15.041  -1.029 -12.256
    4    HB3  GLU  60           HB3      GLU  60 -14.661  -1.379 -13.939
    5    HG2  GLU  60           HG2      GLU  60 -16.678  -2.824 -14.075
    6    HG3  GLU  60           HG3      GLU  60 -17.073  -2.401 -12.422

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLY  61           H        GLY  61 -13.111  -3.374 -14.778
    2    HA3  GLY  61           HA2      GLY  61 -14.817  -5.620 -15.676
    3    HA2  GLY  61           HA3      GLY  61 -13.967  -4.516 -16.750

  No H/Q in entry =           3
  In of MODEL   77
    1    H    ASP  62           H        ASP  62 -12.607  -5.960 -13.858
    2    HA   ASP  62           HA       ASP  62 -10.270  -6.831 -15.182
    3    HB2  ASP  62           HB2      ASP  62  -9.780  -7.944 -13.021
    4    HB3  ASP  62           HB3      ASP  62 -10.304  -6.276 -12.809

  No H/Q in entry =           4
  In of MODEL   77
    1    H    ALA  63           H        ALA  63 -13.280  -8.564 -14.373
    2    HA   ALA  63           HA       ALA  63 -12.162 -11.056 -15.536
    3    HB2  ALA  63           HB1      ALA  63 -14.586 -10.440 -13.822
    4    HB1  ALA  63           HB2      ALA  63 -13.207 -11.459 -13.414
    5    HB3  ALA  63           HB3      ALA  63 -14.377 -11.998 -14.620

  No H/Q in entry =           5
  In of MODEL   77
    1    H    GLY  64           H        GLY  64 -14.191 -12.320 -16.558
    2    HA3  GLY  64           HA2      GLY  64 -16.062 -12.177 -18.057
    3    HA2  GLY  64           HA3      GLY  64 -15.561 -10.541 -18.465

  No H/Q in entry =           3
  In of MODEL   77
    1    H    GLU  65           H        GLU  65 -12.681 -11.666 -18.515
    2    HA   GLU  65           HA       GLU  65 -12.543 -11.980 -21.316
    3    HB2  GLU  65           HB2      GLU  65 -10.519 -12.527 -19.150
    4    HB3  GLU  65           HB3      GLU  65 -10.158 -12.644 -20.872
    5    HG2  GLU  65           HG2      GLU  65 -10.818 -10.306 -21.194
    6    HG3  GLU  65           HG3      GLU  65 -11.243 -10.175 -19.488

  No H/Q in entry =           6
  In of MODEL   77
    1    H    GLY  66           H        GLY  66 -12.568 -14.273 -18.708
    2    HA3  GLY  66           HA2      GLY  66 -13.472 -16.426 -20.325
    3    HA2  GLY  66           HA3      GLY  66 -11.785 -16.633 -19.897

  No H/Q in entry =           3
  In of MODEL   77
    1    H    LYS  67           H        LYS  67 -11.214 -16.965 -17.738
    2    HA   LYS  67           HA       LYS  67 -13.268 -18.320 -16.201
    3    HB2  LYS  67           HB2      LYS  67 -10.268 -18.196 -15.957
    4    HB3  LYS  67           HB3      LYS  67 -11.306 -19.104 -14.851
    5    HG2  LYS  67           HG2      LYS  67 -12.247 -20.364 -16.749
    6    HG3  LYS  67           HG3      LYS  67 -11.229 -19.454 -17.863
    7    HD2  LYS  67           HD2      LYS  67  -9.213 -20.359 -16.783
    8    HD3  LYS  67           HD3      LYS  67 -10.220 -21.250 -15.640
    9    HE2  LYS  67           HE2      LYS  67 -11.246 -22.503 -17.494
   10    HE3  LYS  67           HE3      LYS  67 -10.271 -21.598 -18.653
   11    HZ2  LYS  67           HZ1      LYS  67  -9.570 -23.930 -17.388
   12    HZ1  LYS  67           HZ2      LYS  67  -8.661 -22.730 -16.600
   13    HZ3  LYS  67           HZ3      LYS  67  -8.546 -22.918 -18.285

  No H/Q in entry =          13
  In of MODEL   77
    1    H    MET  68           H        MET  68 -12.534 -18.274 -13.710
    2    HA   MET  68           HA       MET  68 -13.665 -15.943 -12.629
    3    HB2  MET  68           HB2      MET  68 -12.063 -18.147 -11.331
    4    HB3  MET  68           HB3      MET  68 -12.969 -16.919 -10.448
    5    HG2  MET  68           HG2      MET  68 -14.168 -18.817 -12.486
    6    HG3  MET  68           HG3      MET  68 -14.267 -19.024 -10.737
    7    HE1  MET  68           HE1      MET  68 -15.174 -17.647  -9.176
    8    HE3  MET  68           HE2      MET  68 -16.509 -16.512  -9.367
    9    HE2  MET  68           HE3      MET  68 -14.852 -15.956  -9.587

  No H/Q in entry =           9
  In of MODEL   77
    1    H    LYS  69           H        LYS  69 -10.236 -16.825 -13.007
    2    HA   LYS  69           HA       LYS  69  -9.104 -15.012 -11.247
    3    HB2  LYS  69           HB2      LYS  69  -8.142 -16.327 -13.754
    4    HB3  LYS  69           HB3      LYS  69  -7.124 -15.123 -12.961
    5    HG2  LYS  69           HG2      LYS  69  -6.839 -17.591 -12.233
    6    HG3  LYS  69           HG3      LYS  69  -6.992 -16.380 -10.961
    7    HD2  LYS  69           HD2      LYS  69  -9.283 -16.939 -10.572
    8    HD3  LYS  69           HD3      LYS  69  -9.368 -17.905 -12.047
    9    HE2  LYS  69           HE2      LYS  69  -8.064 -19.638 -11.137
   10    HE3  LYS  69           HE3      LYS  69  -7.400 -18.601  -9.875
   11    HZ3  LYS  69           HZ1      LYS  69  -8.959 -19.567  -8.615
   12    HZ2  LYS  69           HZ2      LYS  69  -9.890 -20.065  -9.944
   13    HZ1  LYS  69           HZ3      LYS  69 -10.024 -18.475  -9.358

  No H/Q in entry =          13
  In of MODEL   77
    1    H    VAL  70           H        VAL  70  -7.507 -13.195 -11.974
    2    HA   VAL  70           HA       VAL  70  -8.910 -11.293 -13.766
    3    HB   VAL  70           HB       VAL  70  -8.237  -9.501 -12.199
    4   HG11  VAL  70          HG11      VAL  70  -9.824 -11.763 -10.946
    5   HG13  VAL  70          HG12      VAL  70 -10.471 -10.507 -12.003
    6   HG12  VAL  70          HG13      VAL  70  -9.856 -10.084 -10.406
    7   HG21  VAL  70          HG21      VAL  70  -7.268 -11.833 -10.502
    8   HG23  VAL  70          HG22      VAL  70  -7.448 -10.183  -9.913
    9   HG22  VAL  70          HG23      VAL  70  -6.271 -10.543 -11.174

  No H/Q in entry =           9
  In of MODEL   77
    1    H    SER  71           H        SER  71  -7.435  -9.496 -14.450
    2    HA   SER  71           HA       SER  71  -5.132 -10.482 -15.754
    3    HB2  SER  71           HB2      SER  71  -6.451  -8.454 -16.448
    4    HB3  SER  71           HB3      SER  71  -5.755  -7.597 -15.074
    5    HG   SER  71           HG       SER  71  -3.668  -8.369 -16.034

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LEU  72           H        LEU  72  -3.148 -10.800 -15.053
    2    HA   LEU  72           HA       LEU  72  -2.443 -10.583 -12.338
    3    HB2  LEU  72           HB2      LEU  72  -0.781 -11.019 -14.813
    4    HB3  LEU  72           HB3      LEU  72  -0.120 -11.081 -13.182
    5    HG   LEU  72           HG       LEU  72  -2.474 -12.780 -14.066
    6   HD13  LEU  72          HD11      LEU  72  -0.897 -14.609 -14.373
    7   HD12  LEU  72          HD12      LEU  72   0.446 -13.576 -13.888
    8   HD11  LEU  72          HD13      LEU  72  -0.407 -13.259 -15.399
    9   HD23  LEU  72          HD21      LEU  72  -1.483 -14.187 -12.104
   10   HD22  LEU  72          HD22      LEU  72  -2.421 -12.762 -11.687
   11   HD21  LEU  72          HD23      LEU  72  -0.661 -12.699 -11.647

  No H/Q in entry =          11
  In of MODEL   77
    1    H    VAL  73           H        VAL  73  -1.711  -8.570 -15.116
    2    HA   VAL  73           HA       VAL  73   0.204  -6.871 -14.004
    3    HB   VAL  73           HB       VAL  73  -0.185  -5.449 -15.862
    4   HG13  VAL  73          HG11      VAL  73  -0.133  -7.019 -17.701
    5   HG12  VAL  73          HG12      VAL  73  -0.975  -8.238 -16.746
    6   HG11  VAL  73          HG13      VAL  73   0.673  -7.772 -16.327
    7   HG22  VAL  73          HG21      VAL  73  -2.458  -4.945 -15.908
    8   HG21  VAL  73          HG22      VAL  73  -2.939  -6.630 -15.726
    9   HG23  VAL  73          HG23      VAL  73  -2.337  -6.047 -17.278

  No H/Q in entry =           9
  In of MODEL   77
    1    H    LEU  74           H        LEU  74  -3.196  -6.985 -13.465
    2    HA   LEU  74           HA       LEU  74  -3.817  -4.328 -12.858
    3    HB2  LEU  74           HB2      LEU  74  -5.545  -5.994 -13.041
    4    HB3  LEU  74           HB3      LEU  74  -4.862  -6.916 -11.704
    5    HG   LEU  74           HG       LEU  74  -5.332  -5.034 -10.167
    6   HD13  LEU  74          HD11      LEU  74  -5.218  -3.100 -11.529
    7   HD12  LEU  74          HD12      LEU  74  -6.932  -3.261 -11.157
    8   HD11  LEU  74          HD13      LEU  74  -6.319  -3.776 -12.730
    9   HD21  LEU  74          HD21      LEU  74  -7.028  -6.882 -11.030
   10   HD23  LEU  74          HD22      LEU  74  -7.857  -5.463 -11.634
   11   HD22  LEU  74          HD23      LEU  74  -7.540  -5.611  -9.923

  No H/Q in entry =          11
  In of MODEL   77
    1    H    VAL  75           H        VAL  75  -2.789  -6.913 -10.688
    2    HA   VAL  75           HA       VAL  75  -2.603  -5.359  -8.345
    3    HB   VAL  75           HB       VAL  75  -1.105  -7.857  -9.126
    4   HG12  VAL  75          HG11      VAL  75  -0.667  -8.004  -6.643
    5   HG11  VAL  75          HG12      VAL  75  -1.320  -6.381  -6.476
    6   HG13  VAL  75          HG13      VAL  75   0.150  -6.641  -7.399
    7   HG23  VAL  75          HG21      VAL  75  -2.771  -8.807  -7.450
    8   HG22  VAL  75          HG22      VAL  75  -3.482  -8.238  -8.960
    9   HG21  VAL  75          HG23      VAL  75  -3.599  -7.250  -7.503

  No H/Q in entry =           9
  In of MODEL   77
    1    H    GLU  76           H        GLU  76  -0.180  -6.123 -10.867
    2    HA   GLU  76           HA       GLU  76   1.999  -4.776  -9.699
    3    HB2  GLU  76           HB2      GLU  76   2.160  -6.266 -11.701
    4    HB3  GLU  76           HB3      GLU  76   1.331  -5.043 -12.653
    5    HG2  GLU  76           HG2      GLU  76   3.171  -3.451 -12.231
    6    HG3  GLU  76           HG3      GLU  76   4.019  -4.651 -11.276

  No H/Q in entry =           6
  In of MODEL   77
    1    H    ALA  77           H        ALA  77  -0.520  -3.576 -11.903
    2    HA   ALA  77           HA       ALA  77   0.473  -0.930 -12.076
    3    HB2  ALA  77           HB1      ALA  77  -1.574  -0.390 -13.118
    4    HB3  ALA  77           HB2      ALA  77  -2.454  -1.636 -12.233
    5    HB1  ALA  77           HB3      ALA  77  -1.331  -2.092 -13.514

  No H/Q in entry =           5
  In of MODEL   77
    1    H    GLN  78           H        GLN  78  -1.809  -2.483  -9.876
    2    HA   GLN  78           HA       GLN  78  -2.623  -0.163  -8.482
    3    HB2  GLN  78           HB2      GLN  78  -3.734  -2.422  -8.401
    4    HB3  GLN  78           HB3      GLN  78  -2.403  -2.981  -7.390
    5    HG2  GLN  78           HG2      GLN  78  -2.930  -1.239  -5.732
    6    HG3  GLN  78           HG3      GLN  78  -4.263  -0.678  -6.741
    7   HE21  GLN  78          HE21      GLN  78  -4.771  -1.629  -4.100
    8   HE22  GLN  78          HE22      GLN  78  -5.618  -3.096  -4.209

  No H/Q in entry =           8
  In of MODEL   77
    1    H    LEU  79           H        LEU  79   0.053  -2.418  -8.014
    2    HA   LEU  79           HA       LEU  79   1.014  -1.518  -5.552
    3    HB2  LEU  79           HB2      LEU  79   1.891  -3.528  -6.613
    4    HB3  LEU  79           HB3      LEU  79   2.545  -2.577  -7.943
    5    HG   LEU  79           HG       LEU  79   4.091  -1.436  -6.432
    6   HD13  LEU  79          HD11      LEU  79   3.075  -1.189  -4.371
    7   HD12  LEU  79          HD12      LEU  79   4.152  -2.538  -4.019
    8   HD11  LEU  79          HD13      LEU  79   2.449  -2.838  -4.359
    9   HD23  LEU  79          HD21      LEU  79   5.298  -3.583  -5.520
   10   HD22  LEU  79          HD22      LEU  79   5.104  -3.386  -7.259
   11   HD21  LEU  79          HD23      LEU  79   4.021  -4.455  -6.372

  No H/Q in entry =          11
  In of MODEL   77
    1    H    HIS  80           H        HIS  80   1.903  -0.404  -8.821
    2    HA   HIS  80           HA       HIS  80   3.704   1.585  -7.890
    3    HB2  HIS  80           HB2      HIS  80   2.430   0.887 -10.480
    4    HB3  HIS  80           HB3      HIS  80   3.023   2.540 -10.307
    5    HD1  HIS  80           HD1      HIS  80   5.427   2.842 -10.815
    6    HD2  HIS  80           HD2      HIS  80   4.604  -1.068  -9.625
    7    HE1  HIS  80           HE1      HIS  80   7.619   1.567 -10.967
    8    HE2  HIS  80           HE2      HIS  80   7.129  -0.819 -10.245

  No H/Q in entry =           8
  In of MODEL   77
    1    H    LEU  81           H        LEU  81   0.306   1.741  -8.890
    2    HA   LEU  81           HA       LEU  81   0.025   4.533  -8.564
    3    HB2  LEU  81           HB2      LEU  81  -1.987   2.286  -8.494
    4    HB3  LEU  81           HB3      LEU  81  -2.442   3.988  -8.407
    5    HG   LEU  81           HG       LEU  81  -0.734   2.838 -10.631
    6   HD12  LEU  81          HD11      LEU  81  -2.959   3.154 -11.944
    7   HD11  LEU  81          HD12      LEU  81  -3.724   3.086 -10.357
    8   HD13  LEU  81          HD13      LEU  81  -2.776   1.719 -10.937
    9   HD23  LEU  81          HD21      LEU  81  -1.828   4.980 -11.737
   10   HD22  LEU  81          HD22      LEU  81  -0.418   5.154 -10.696
   11   HD21  LEU  81          HD23      LEU  81  -2.027   5.500 -10.065

  No H/Q in entry =          11
  In of MODEL   77
    1    H    MET  82           H        MET  82  -0.643   1.848  -6.316
    2    HA   MET  82           HA       MET  82  -1.710   3.434  -4.237
    3    HB2  MET  82           HB2      MET  82  -0.332   0.749  -4.266
    4    HB3  MET  82           HB3      MET  82  -0.921   1.475  -2.772
    5    HG2  MET  82           HG2      MET  82  -2.638   0.976  -5.223
    6    HG3  MET  82           HG3      MET  82  -2.566  -0.096  -3.826
    7    HE3  MET  82           HE1      MET  82  -4.309   1.552  -1.023
    8    HE2  MET  82           HE2      MET  82  -2.578   1.833  -1.198
    9    HE1  MET  82           HE3      MET  82  -3.260   0.274  -1.654

  No H/Q in entry =           9
  In of MODEL   77
    1    H    THR  83           H        THR  83   1.596   2.354  -4.906
    2    HA   THR  83           HA       THR  83   2.798   3.462  -2.599
    3    HB   THR  83           HB       THR  83   4.902   3.410  -4.060
    4    HG1  THR  83           HG1      THR  83   4.675   2.881  -6.085
    5   HG22  THR  83          HG21      THR  83   4.465   0.750  -4.392
    6   HG21  THR  83          HG22      THR  83   3.168   1.128  -3.260
    7   HG23  THR  83          HG23      THR  83   4.844   1.475  -2.831

  No H/Q in entry =           7
  In of MODEL   77
    1    H    SER  84           H        SER  84   2.445   4.738  -5.902
    2    HA   SER  84           HA       SER  84   3.777   7.181  -5.441
    3    HB2  SER  84           HB2      SER  84   1.720   6.343  -7.472
    4    HB3  SER  84           HB3      SER  84   2.395   7.972  -7.444
    5    HG   SER  84           HG       SER  84   3.774   5.499  -7.725

  No H/Q in entry =           5
  In of MODEL   77
    1    H    MET  85           H        MET  85   0.283   6.418  -5.290
    2    HA   MET  85           HA       MET  85  -0.587   9.028  -4.696
    3    HB2  MET  85           HB2      MET  85  -2.104   7.219  -5.373
    4    HB3  MET  85           HB3      MET  85  -1.820   6.409  -3.832
    5    HG2  MET  85           HG2      MET  85  -2.723   8.359  -2.627
    6    HG3  MET  85           HG3      MET  85  -2.976   9.194  -4.158
    7    HE2  MET  85           HE1      MET  85  -6.171   8.069  -5.505
    8    HE1  MET  85           HE2      MET  85  -4.537   8.512  -5.993
    9    HE3  MET  85           HE3      MET  85  -5.376   9.470  -4.777

  No H/Q in entry =           9
  In of MODEL   77
    1    H    LEU  86           H        LEU  86   0.325   6.368  -2.545
    2    HA   LEU  86           HA       LEU  86  -0.225   7.672  -0.107
    3    HB2  LEU  86           HB2      LEU  86   0.245   5.202  -0.496
    4    HB3  LEU  86           HB3      LEU  86   1.952   5.633  -0.581
    5    HG   LEU  86           HG       LEU  86   1.612   6.796   1.684
    6   HD11  LEU  86          HD11      LEU  86  -1.079   6.026   1.197
    7   HD13  LEU  86          HD12      LEU  86  -0.422   6.775   2.651
    8   HD12  LEU  86          HD13      LEU  86  -0.510   5.019   2.533
    9   HD23  LEU  86          HD21      LEU  86   1.186   3.803   1.806
   10   HD22  LEU  86          HD22      LEU  86   2.181   4.814   2.851
   11   HD21  LEU  86          HD23      LEU  86   2.692   4.489   1.195

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ALA  87           H        ALA  87   2.767   7.379  -1.978
    2    HA   ALA  87           HA       ALA  87   4.462   8.792  -0.244
    3    HB3  ALA  87           HB1      ALA  87   4.573   7.778  -2.950
    4    HB2  ALA  87           HB2      ALA  87   5.901   8.110  -1.842
    5    HB1  ALA  87           HB3      ALA  87   5.292   9.389  -2.890

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ARG  88           H        ARG  88   2.530   9.925  -2.977
    2    HA   ARG  88           HA       ARG  88   3.303  12.615  -2.856
    3    HB2  ARG  88           HB2      ARG  88   2.060  11.462  -4.721
    4    HB3  ARG  88           HB3      ARG  88   0.597  11.605  -3.746
    5    HG2  ARG  88           HG2      ARG  88   1.615  14.186  -3.658
    6    HG3  ARG  88           HG3      ARG  88   2.049  13.671  -5.286
    7    HD2  ARG  88           HD2      ARG  88  -0.088  13.750  -5.996
    8    HD3  ARG  88           HD3      ARG  88  -0.683  12.898  -4.571
    9    HE   ARG  88           HE       ARG  88  -0.870  15.676  -4.991
   10   HH21  ARG  88          HH11      ARG  88  -1.407  17.006  -3.257
   11   HH22  ARG  88          HH12      ARG  88  -1.120  16.469  -1.637
   12   HH11  ARG  88          HH21      ARG  88   0.131  13.414  -2.610
   13   HH12  ARG  88          HH22      ARG  88  -0.267  14.430  -1.271

  No H/Q in entry =          13
  In of MODEL   77
    1    H    GLU  89           H        GLU  89   0.590  10.942  -1.231
    2    HA   GLU  89           HA       GLU  89  -0.524  13.255  -0.034
    3    HB2  GLU  89           HB2      GLU  89  -1.642  11.016  -0.126
    4    HB3  GLU  89           HB3      GLU  89  -0.526  10.461   1.122
    5    HG2  GLU  89           HG2      GLU  89  -1.354  12.160   2.676
    6    HG3  GLU  89           HG3      GLU  89  -2.399  12.831   1.426

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LEU  90           H        LEU  90   1.919  10.962   1.155
    2    HA   LEU  90           HA       LEU  90   2.262  12.207   3.686
    3    HB2  LEU  90           HB2      LEU  90   4.043  10.431   2.020
    4    HB3  LEU  90           HB3      LEU  90   4.453  10.947   3.660
    5    HG   LEU  90           HG       LEU  90   1.821   9.604   2.985
    6   HD12  LEU  90          HD11      LEU  90   2.953   7.557   4.000
    7   HD11  LEU  90          HD12      LEU  90   4.478   8.412   3.767
    8   HD13  LEU  90          HD13      LEU  90   3.473   8.005   2.374
    9   HD22  LEU  90          HD21      LEU  90   1.545  10.528   5.105
   10   HD21  LEU  90          HD22      LEU  90   3.261  10.419   5.497
   11   HD23  LEU  90          HD23      LEU  90   2.253   8.973   5.540

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  91           H        ILE  91   3.883  12.587   0.568
    2    HA   ILE  91           HA       ILE  91   5.857  14.416   1.418
    3    HB   ILE  91           HB       ILE  91   4.560  13.926  -1.269
    4   HG12  ILE  91          HG12      ILE  91   7.387  13.435  -0.279
    5   HG13  ILE  91          HG13      ILE  91   6.102  12.239  -0.123
    6   HG22  ILE  91          HG21      ILE  91   6.789  15.270  -1.945
    7   HG21  ILE  91          HG22      ILE  91   6.471  16.071  -0.406
    8   HG23  ILE  91          HG23      ILE  91   5.256  16.101  -1.682
    9   HD13  ILE  91          HD11      ILE  91   5.941  11.916  -2.431
   10   HD12  ILE  91          HD12      ILE  91   7.675  12.156  -2.208
   11   HD11  ILE  91          HD13      ILE  91   6.670  13.480  -2.800

  No H/Q in entry =          11
  In of MODEL   77
    1    H    THR  92           H        THR  92   2.502  14.853   0.392
    2    HA   THR  92           HA       THR  92   2.481  17.676   0.330
    3    HB   THR  92           HB       THR  92   0.306  15.685   1.018
    4    HG1  THR  92           HG1      THR  92   0.622  15.506  -1.065
    5   HG22  THR  92          HG21      THR  92  -1.087  17.849   0.288
    6   HG21  THR  92          HG22      THR  92   0.303  18.672   0.992
    7   HG23  THR  92          HG23      THR  92  -0.646  17.553   1.969

  No H/Q in entry =           7
  In of MODEL   77
    1    H    GLU  93           H        GLU  93   1.914  15.377   2.982
    2    HA   GLU  93           HA       GLU  93   1.374  17.283   4.997
    3    HB2  GLU  93           HB2      GLU  93   2.681  14.556   5.241
    4    HB3  GLU  93           HB3      GLU  93   1.984  15.484   6.569
    5    HG2  GLU  93           HG2      GLU  93   0.384  14.709   4.122
    6    HG3  GLU  93           HG3      GLU  93   0.476  13.686   5.551

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LEU  94           H        LEU  94   4.384  15.795   3.864
    2    HA   LEU  94           HA       LEU  94   6.126  16.940   5.762
    3    HB2  LEU  94           HB2      LEU  94   6.542  15.971   2.933
    4    HB3  LEU  94           HB3      LEU  94   7.867  16.627   3.890
    5    HG   LEU  94           HG       LEU  94   6.117  14.434   5.016
    6   HD11  LEU  94          HD11      LEU  94   8.224  14.204   2.896
    7   HD13  LEU  94          HD12      LEU  94   6.775  13.233   3.150
    8   HD12  LEU  94          HD13      LEU  94   8.194  12.977   4.165
    9   HD23  LEU  94          HD21      LEU  94   8.299  13.894   6.180
   10   HD22  LEU  94          HD22      LEU  94   7.633  15.473   6.593
   11   HD21  LEU  94          HD23      LEU  94   8.978  15.350   5.458

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  95           H        ILE  95   5.006  18.113   2.605
    2    HA   ILE  95           HA       ILE  95   6.583  20.467   2.554
    3    HB   ILE  95           HB       ILE  95   3.945  19.788   1.234
    4   HG12  ILE  95          HG12      ILE  95   6.741  20.120   0.113
    5   HG13  ILE  95          HG13      ILE  95   6.086  18.568   0.624
    6   HG21  ILE  95          HG21      ILE  95   5.701  22.252   1.023
    7   HG23  ILE  95          HG22      ILE  95   3.974  22.188   1.369
    8   HG22  ILE  95          HG23      ILE  95   4.565  21.786  -0.243
    9   HD13  ILE  95          HD11      ILE  95   4.536  18.495  -1.114
   10   HD12  ILE  95          HD12      ILE  95   5.891  19.310  -1.894
   11   HD11  ILE  95          HD13      ILE  95   4.516  20.248  -1.310

  No H/Q in entry =          11
  In of MODEL   77
    1    H    GLU  96           H        GLU  96   3.326  19.822   3.831
    2    HA   GLU  96           HA       GLU  96   2.707  22.470   4.578
    3    HB2  GLU  96           HB2      GLU  96   1.029  20.690   4.581
    4    HB3  GLU  96           HB3      GLU  96   1.881  19.861   5.881
    5    HG2  GLU  96           HG2      GLU  96   0.855  21.147   7.445
    6    HG3  GLU  96           HG3      GLU  96   1.398  22.620   6.651

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LEU  97           H        LEU  97   4.535  19.916   6.214
    2    HA   LEU  97           HA       LEU  97   4.882  21.264   8.687
    3    HB2  LEU  97           HB2      LEU  97   6.422  19.092   7.282
    4    HB3  LEU  97           HB3      LEU  97   7.005  19.776   8.797
    5    HG   LEU  97           HG       LEU  97   4.195  18.688   8.470
    6   HD12  LEU  97          HD11      LEU  97   5.123  16.674   9.689
    7   HD11  LEU  97          HD12      LEU  97   6.738  17.301   9.354
    8   HD13  LEU  97          HD13      LEU  97   5.674  16.845   8.022
    9   HD23  LEU  97          HD21      LEU  97   4.632  18.393  11.038
   10   HD22  LEU  97          HD22      LEU  97   4.259  20.006  10.430
   11   HD21  LEU  97          HD23      LEU  97   5.928  19.562  10.785

  No H/Q in entry =          11
  In of MODEL   77
    1    H    HIS  98           H        HIS  98   6.769  21.275   5.672
    2    HA   HIS  98           HA       HIS  98   8.922  22.850   6.583
    3    HB2  HIS  98           HB2      HIS  98   7.643  22.597   3.850
    4    HB3  HIS  98           HB3      HIS  98   9.084  23.572   4.148
    5    HD1  HIS  98           HD1      HIS  98   7.864  20.005   4.162
    6    HD2  HIS  98           HD2      HIS  98  11.448  22.092   4.606
    7    HE1  HIS  98           HE1      HIS  98   9.714  18.270   4.116
    8    HE2  HIS  98           HE2      HIS  98  11.901  19.521   4.387

  No H/Q in entry =           8
  In of MODEL   77
    1    H    GLU  99           H        GLU  99   5.709  23.693   5.389
    2    HA   GLU  99           HA       GLU  99   6.096  26.507   5.333
    3    HB2  GLU  99           HB2      GLU  99   4.220  25.342   4.192
    4    HB3  GLU  99           HB3      GLU  99   3.515  24.983   5.767
    5    HG2  GLU  99           HG2      GLU  99   3.338  27.375   6.267
    6    HG3  GLU  99           HG3      GLU  99   4.124  27.773   4.742

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LYS 100           H        LYS 100   4.945  24.275   7.849
    2    HA   LYS 100           HA       LYS 100   4.354  26.331   9.739
    3    HB2  LYS 100           HB2      LYS 100   4.919  23.378  10.088
    4    HB3  LYS 100           HB3      LYS 100   4.467  24.452  11.418
    5    HG2  LYS 100           HG2      LYS 100   2.410  25.095  10.158
    6    HG3  LYS 100           HG3      LYS 100   2.841  23.925   8.908
    7    HD2  LYS 100           HD2      LYS 100   2.749  22.105  10.569
    8    HD3  LYS 100           HD3      LYS 100   2.335  23.269  11.830
    9    HE2  LYS 100           HE2      LYS 100   0.291  23.896  10.556
   10    HE3  LYS 100           HE3      LYS 100   0.694  22.675   9.342
   11    HZ1  LYS 100           HZ1      LYS 100   0.410  22.009  12.222
   12    HZ3  LYS 100           HZ2      LYS 100   0.399  20.955  10.887
   13    HZ2  LYS 100           HZ3      LYS 100  -0.915  21.998  11.159

  No H/Q in entry =          13
  In of MODEL   77
    1    H    LEU 101           H        LEU 101   7.277  24.527   8.922
    2    HA   LEU 101           HA       LEU 101   8.865  25.362  11.134
    3    HB2  LEU 101           HB2      LEU 101   9.472  24.373   8.360
    4    HB3  LEU 101           HB3      LEU 101  10.771  25.035   9.349
    5    HG   LEU 101           HG       LEU 101   8.926  22.884  10.402
    6   HD12  LEU 101          HD11      LEU 101  10.979  21.383   9.806
    7   HD11  LEU 101          HD12      LEU 101  11.356  22.644   8.635
    8   HD13  LEU 101          HD13      LEU 101   9.826  21.776   8.533
    9   HD21  LEU 101          HD21      LEU 101  11.650  23.984  11.145
   10   HD23  LEU 101          HD22      LEU 101  11.098  22.413  11.722
   11   HD22  LEU 101          HD23      LEU 101  10.208  23.872  12.155

  No H/Q in entry =          11
  In of MODEL   77
    1    H    LYS 102           H        LYS 102   7.300  27.230   8.984
    2    HA   LYS 102           HA       LYS 102   7.387  29.523   8.693
    3    HB2  LYS 102           HB2      LYS 102   8.939  29.403  10.800
    4    HB3  LYS 102           HB3      LYS 102  10.245  29.593   9.648
    5    HG2  LYS 102           HG2      LYS 102   8.141  31.553  10.498
    6    HG3  LYS 102           HG3      LYS 102   9.856  31.807  10.256
    7    HD2  LYS 102           HD2      LYS 102   7.917  31.390   7.945
    8    HD3  LYS 102           HD3      LYS 102   8.301  32.969   8.615
    9    HE2  LYS 102           HE2      LYS 102   9.682  31.779   6.550
   10    HE3  LYS 102           HE3      LYS 102  10.297  33.084   7.564
   11    HZ2  LYS 102           HZ1      LYS 102  11.812  31.174   7.398
   12    HZ1  LYS 102           HZ2      LYS 102  10.643  30.196   8.134
   13    HZ3  LYS 102           HZ3      LYS 102  11.334  31.481   8.997

  No H/Q in entry =          13
  In of MODEL   77
    1    H    ALA 103           H        ALA 103  10.642  28.173   8.147
    2    HA   ALA 103           HA       ALA 103  11.622  29.546   6.076
    3    HB2  ALA 103           HB1      ALA 103  12.505  27.329   5.154
    4    HB1  ALA 103           HB2      ALA 103  11.600  26.558   6.455
    5    HB3  ALA 103           HB3      ALA 103  12.891  27.697   6.835

  No H/Q in entry =           5
  In of MODEL   77
    1    H1   LYS   3           H1       LYS   3 -31.576   5.932 -19.626
    2    H2   LYS   3           H3       LYS   3 -30.597   5.656 -20.986
    3    H3   LYS   3           H2       LYS   3 -31.971   4.695 -20.721
    4    HA   LYS   3           HA       LYS   3 -30.928   3.330 -19.323
    5    HB2  LYS   3           HB2      LYS   3 -28.688   4.779 -20.685
    6    HB3  LYS   3           HB3      LYS   3 -28.327   3.581 -19.442
    7    HG2  LYS   3           HG2      LYS   3 -29.735   1.965 -20.770
    8    HG3  LYS   3           HG3      LYS   3 -29.726   3.160 -22.066
    9    HD2  LYS   3           HD2      LYS   3 -27.240   3.093 -22.042
   10    HD3  LYS   3           HD3      LYS   3 -27.322   1.796 -20.849
   11    HE2  LYS   3           HE2      LYS   3 -28.818   0.587 -22.545
   12    HE3  LYS   3           HE3      LYS   3 -28.232   1.772 -23.712
   13    HZ3  LYS   3           HZ1      LYS   3 -26.415   0.576 -23.997
   14    HZ2  LYS   3           HZ2      LYS   3 -27.012  -0.599 -22.926
   15    HZ1  LYS   3           HZ3      LYS   3 -26.039   0.664 -22.344

  No H/Q in entry =          15
  In of MODEL   77
    1    H    LYS   4           H        LYS   4 -30.955   3.196 -17.261
    2    HA   LYS   4           HA       LYS   4 -30.248   5.501 -15.627
    3    HB2  LYS   4           HB2      LYS   4 -31.394   2.790 -14.904
    4    HB3  LYS   4           HB3      LYS   4 -31.183   4.136 -13.786
    5    HG2  LYS   4           HG2      LYS   4 -33.017   4.034 -16.186
    6    HG3  LYS   4           HG3      LYS   4 -33.489   4.082 -14.489
    7    HD2  LYS   4           HD2      LYS   4 -32.828   6.317 -14.238
    8    HD3  LYS   4           HD3      LYS   4 -31.805   6.272 -15.673
    9    HE2  LYS   4           HE2      LYS   4 -33.758   7.610 -16.119
   10    HE3  LYS   4           HE3      LYS   4 -33.824   6.133 -17.080
   11    HZ3  LYS   4           HZ1      LYS   4 -35.366   5.200 -15.512
   12    HZ2  LYS   4           HZ2      LYS   4 -35.953   6.684 -16.096
   13    HZ1  LYS   4           HZ3      LYS   4 -35.278   6.589 -14.541

  No H/Q in entry =          13
  In of MODEL   77
    1    H    HIS   5           H        HIS   5 -28.763   5.617 -14.052
    2    HA   HIS   5           HA       HIS   5 -26.455   3.824 -14.403
    3    HB2  HIS   5           HB2      HIS   5 -26.740   6.579 -13.203
    4    HB3  HIS   5           HB3      HIS   5 -25.243   5.649 -13.199
    5    HD1  HIS   5           HD1      HIS   5 -23.811   6.866 -14.810
    6    HD2  HIS   5           HD2      HIS   5 -27.619   6.178 -16.319
    7    HE1  HIS   5           HE1      HIS   5 -23.679   7.439 -17.264
    8    HE2  HIS   5           HE2      HIS   5 -26.001   7.008 -18.152

  No H/Q in entry =           8
  In of MODEL   77
    1    H    ILE   6           H        ILE   6 -26.186   2.261 -13.082
    2    HA   ILE   6           HA       ILE   6 -27.134   2.524 -10.308
    3    HB   ILE   6           HB       ILE   6 -26.288   0.064 -11.846
    4   HG12  ILE   6          HG12      ILE   6 -29.036   0.962 -10.967
    5   HG13  ILE   6          HG13      ILE   6 -28.415   1.127 -12.610
    6   HG23  ILE   6          HG21      ILE   6 -26.621  -1.187  -9.977
    7   HG22  ILE   6          HG22      ILE   6 -27.788  -0.056  -9.289
    8   HG21  ILE   6          HG23      ILE   6 -26.063   0.307  -9.220
    9   HD13  ILE   6          HD11      ILE   6 -28.847  -1.001 -13.097
   10   HD12  ILE   6          HD12      ILE   6 -29.846  -0.995 -11.644
   11   HD11  ILE   6          HD13      ILE   6 -28.183  -1.576 -11.568

  No H/Q in entry =          11
  In of MODEL   77
    1    H    TYR   7           H        TYR   7 -25.371   3.197  -9.045
    2    HA   TYR   7           HA       TYR   7 -22.654   2.278  -9.751
    3    HB2  TYR   7           HB2      TYR   7 -23.638   4.703  -8.268
    4    HB3  TYR   7           HB3      TYR   7 -21.945   4.214  -8.323
    5    HD1  TYR   7           HD1      TYR   7 -23.006   3.243 -11.398
    6    HD2  TYR   7           HD2      TYR   7 -22.364   6.834  -9.192
    7    HE1  TYR   7           HE1      TYR   7 -22.616   4.471 -13.499
    8    HE2  TYR   7           HE2      TYR   7 -22.016   8.067 -11.284
    9    HH   TYR   7           HH       TYR   7 -22.258   7.968 -13.514

  No H/Q in entry =           9
  In of MODEL   77
    1    H    LEU   8           H        LEU   8 -21.653   0.945  -8.427
    2    HA   LEU   8           HA       LEU   8 -22.745   0.445  -5.729
    3    HB2  LEU   8           HB2      LEU   8 -21.039  -1.199  -7.576
    4    HB3  LEU   8           HB3      LEU   8 -21.200  -1.578  -5.861
    5    HG   LEU   8           HG       LEU   8 -23.682  -1.789  -6.255
    6   HD13  LEU   8          HD11      LEU   8 -23.854  -0.583  -8.367
    7   HD12  LEU   8          HD12      LEU   8 -24.361  -2.255  -8.596
    8   HD11  LEU   8          HD13      LEU   8 -22.767  -1.736  -9.140
    9   HD23  LEU   8          HD21      LEU   8 -22.396  -3.818  -7.955
   10   HD22  LEU   8          HD22      LEU   8 -23.465  -3.996  -6.564
   11   HD21  LEU   8          HD23      LEU   8 -21.760  -3.616  -6.323

  No H/Q in entry =          11
  In of MODEL   77
    1    H    PHE   9           H        PHE   9 -21.457   0.864  -3.961
    2    HA   PHE   9           HA       PHE   9 -18.688   1.825  -4.508
    3    HB2  PHE   9           HB2      PHE   9 -20.689   2.884  -2.516
    4    HB3  PHE   9           HB3      PHE   9 -18.985   3.316  -2.522
    5    HD1  PHE   9           HD1      PHE   9 -18.028   4.658  -4.318
    6    HD2  PHE   9           HD2      PHE   9 -22.202   3.664  -4.282
    7    HE1  PHE   9           HE1      PHE   9 -18.446   6.349  -6.078
    8    HE2  PHE   9           HE2      PHE   9 -22.621   5.367  -6.039
    9    HZ   PHE   9           HZ       PHE   9 -20.741   6.705  -6.943

  No H/Q in entry =           9
  In of MODEL   77
    1    H    SER  10           H        SER  10 -17.074   0.904  -3.402
    2    HA   SER  10           HA       SER  10 -17.243  -0.006  -0.714
    3    HB2  SER  10           HB2      SER  10 -18.454  -1.881  -1.795
    4    HB3  SER  10           HB3      SER  10 -17.070  -2.139  -2.845
    5    HG   SER  10           HG       SER  10 -16.007  -3.013  -1.253

  No H/Q in entry =           5
  In of MODEL   77
    1    H    SER  11           H        SER  11 -15.207   0.107   0.103
    2    HA   SER  11           HA       SER  11 -13.065   1.015  -1.457
    3    HB2  SER  11           HB2      SER  11 -13.533   1.024   1.150
    4    HB3  SER  11           HB3      SER  11 -12.489  -0.399   1.092
    5    HG   SER  11           HG       SER  11 -11.940   2.232   0.167

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ALA  12           H        ALA  12 -14.218  -1.671  -2.303
    2    HA   ALA  12           HA       ALA  12 -11.628  -2.867  -2.882
    3    HB3  ALA  12           HB1      ALA  12 -12.423  -3.967  -0.765
    4    HB2  ALA  12           HB2      ALA  12 -12.162  -5.077  -2.109
    5    HB1  ALA  12           HB3      ALA  12 -13.801  -4.589  -1.679

  No H/Q in entry =           5
  In of MODEL   77
    1    H    GLY  13           H        GLY  13 -12.374  -1.901  -4.909
    2    HA3  GLY  13           HA2      GLY  13 -14.649  -2.569  -6.351
    3    HA2  GLY  13           HA3      GLY  13 -13.103  -2.127  -7.090

  No H/Q in entry =           3
  In of MODEL   77
    1    H    MET  14           H        MET  14 -11.553  -4.396  -6.288
    2    HA   MET  14           HA       MET  14 -12.100  -6.148  -8.372
    3    HB2  MET  14           HB2      MET  14  -9.935  -6.199  -7.238
    4    HB3  MET  14           HB3      MET  14 -10.674  -6.888  -5.792
    5    HG2  MET  14           HG2      MET  14 -11.338  -8.885  -7.096
    6    HG3  MET  14           HG3      MET  14 -10.602  -8.186  -8.540
    7    HE1  MET  14           HE1      MET  14  -8.433  -7.523  -8.849
    8    HE3  MET  14           HE2      MET  14  -6.975  -8.217  -8.144
    9    HE2  MET  14           HE3      MET  14  -7.758  -6.849  -7.358

  No H/Q in entry =           9
  In of MODEL   77
    1    H    SER  15           H        SER  15 -13.105  -6.603  -4.980
    2    HA   SER  15           HA       SER  15 -14.424  -9.096  -5.560
    3    HB2  SER  15           HB2      SER  15 -14.559  -7.278  -3.158
    4    HB3  SER  15           HB3      SER  15 -15.641  -8.657  -3.339
    5    HG   SER  15           HG       SER  15 -14.013  -9.722  -2.528

  No H/Q in entry =           5
  In of MODEL   77
    1    H    THR  16           H        THR  16 -15.613  -5.742  -5.142
    2    HA   THR  16           HA       THR  16 -18.393  -6.347  -5.608
    3    HB   THR  16           HB       THR  16 -16.944  -3.731  -6.148
    4    HG1  THR  16           HG1      THR  16 -17.655  -5.019  -3.779
    5   HG22  THR  16          HG21      THR  16 -19.785  -4.339  -5.295
    6   HG21  THR  16          HG22      THR  16 -19.295  -3.931  -6.949
    7   HG23  THR  16          HG23      THR  16 -19.118  -2.749  -5.645

  No H/Q in entry =           7
  In of MODEL   77
    1    H    SER  17           H        SER  17 -15.628  -5.711  -7.511
    2    HA   SER  17           HA       SER  17 -16.793  -4.999 -10.005
    3    HB2  SER  17           HB2      SER  17 -14.137  -6.278  -9.325
    4    HB3  SER  17           HB3      SER  17 -14.602  -5.850 -10.972
    5    HG   SER  17           HG       SER  17 -13.384  -4.208  -9.934

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LEU  18           H        LEU  18 -16.160  -8.128  -8.550
    2    HA   LEU  18           HA       LEU  18 -16.746  -9.647 -10.892
    3    HB2  LEU  18           HB2      LEU  18 -15.492 -10.581  -8.998
    4    HB3  LEU  18           HB3      LEU  18 -16.914 -10.405  -7.970
    5    HG   LEU  18           HG       LEU  18 -18.137 -11.973  -9.453
    6   HD11  LEU  18          HD11      LEU  18 -15.487 -11.938 -10.866
    7   HD13  LEU  18          HD12      LEU  18 -17.111 -11.842 -11.546
    8   HD12  LEU  18          HD13      LEU  18 -16.504 -13.376 -10.925
    9   HD21  LEU  18          HD21      LEU  18 -15.614 -12.833  -8.098
   10   HD23  LEU  18          HD22      LEU  18 -16.744 -13.990  -8.804
   11   HD22  LEU  18          HD23      LEU  18 -17.276 -12.913  -7.513

  No H/Q in entry =          11
  In of MODEL   77
    1    H    LEU  19           H        LEU  19 -18.706  -8.460  -8.166
    2    HA   LEU  19           HA       LEU  19 -21.159  -9.686  -8.969
    3    HB2  LEU  19           HB2      LEU  19 -20.882  -8.839  -6.724
    4    HB3  LEU  19           HB3      LEU  19 -20.628  -7.207  -7.339
    5    HG   LEU  19           HG       LEU  19 -22.963  -7.070  -8.009
    6   HD11  LEU  19          HD11      LEU  19 -23.161  -9.858  -6.857
    7   HD13  LEU  19          HD12      LEU  19 -23.389  -9.405  -8.545
    8   HD12  LEU  19          HD13      LEU  19 -24.535  -8.856  -7.325
    9   HD23  LEU  19          HD21      LEU  19 -23.949  -7.215  -5.701
   10   HD22  LEU  19          HD22      LEU  19 -22.463  -6.275  -5.840
   11   HD21  LEU  19          HD23      LEU  19 -22.415  -7.908  -5.175

  No H/Q in entry =          11
  In of MODEL   77
    1    H    VAL  20           H        VAL  20 -19.721  -6.504  -9.692
    2    HA   VAL  20           HA       VAL  20 -21.864  -5.504 -11.244
    3    HB   VAL  20           HB       VAL  20 -18.887  -4.864 -11.392
    4   HG13  VAL  20          HG11      VAL  20 -19.809  -4.323 -13.558
    5   HG12  VAL  20          HG12      VAL  20 -19.621  -2.819 -12.656
    6   HG11  VAL  20          HG13      VAL  20 -21.215  -3.556 -12.819
    7   HG21  VAL  20          HG21      VAL  20 -21.246  -3.533 -10.096
    8   HG23  VAL  20          HG22      VAL  20 -19.712  -2.709 -10.371
    9   HG22  VAL  20          HG23      VAL  20 -19.772  -4.135  -9.335

  No H/Q in entry =           9
  In of MODEL   77
    1    H    SER  21           H        SER  21 -19.085  -7.514 -12.291
    2    HA   SER  21           HA       SER  21 -19.898  -7.426 -15.034
    3    HB2  SER  21           HB2      SER  21 -18.435  -9.372 -15.373
    4    HB3  SER  21           HB3      SER  21 -17.616  -8.108 -14.458
    5    HG   SER  21           HG       SER  21 -17.763  -9.281 -12.659

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LYS  22           H        LYS  22 -20.903  -9.617 -12.443
    2    HA   LYS  22           HA       LYS  22 -22.435 -11.270 -14.242
    3    HB2  LYS  22           HB2      LYS  22 -21.625 -11.920 -11.909
    4    HB3  LYS  22           HB3      LYS  22 -22.958 -10.942 -11.297
    5    HG2  LYS  22           HG2      LYS  22 -23.770 -13.132 -11.273
    6    HG3  LYS  22           HG3      LYS  22 -24.477 -12.411 -12.719
    7    HD2  LYS  22           HD2      LYS  22 -22.824 -13.502 -14.117
    8    HD3  LYS  22           HD3      LYS  22 -22.009 -14.149 -12.692
    9    HE2  LYS  22           HE2      LYS  22 -24.001 -15.478 -12.150
   10    HE3  LYS  22           HE3      LYS  22 -24.829 -14.824 -13.563
   11    HZ3  LYS  22           HZ1      LYS  22 -24.022 -16.972 -14.092
   12    HZ2  LYS  22           HZ2      LYS  22 -22.458 -16.601 -13.540
   13    HZ1  LYS  22           HZ3      LYS  22 -23.066 -15.850 -14.936

  No H/Q in entry =          13
  In of MODEL   77
    1    H    MET  23           H        MET  23 -23.184  -8.350 -12.378
    2    HA   MET  23           HA       MET  23 -25.994  -8.473 -12.856
    3    HB2  MET  23           HB2      MET  23 -24.176  -6.136 -12.311
    4    HB3  MET  23           HB3      MET  23 -25.926  -5.993 -12.472
    5    HG2  MET  23           HG2      MET  23 -26.278  -7.294 -10.494
    6    HG3  MET  23           HG3      MET  23 -24.560  -7.680 -10.384
    7    HE2  MET  23           HE1      MET  23 -26.901  -4.058  -9.186
    8    HE1  MET  23           HE2      MET  23 -27.155  -5.035 -10.630
    9    HE3  MET  23           HE3      MET  23 -26.141  -3.594 -10.710

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ARG  24           H        ARG  24 -23.279  -7.012 -14.673
    2    HA   ARG  24           HA       ARG  24 -24.815  -5.741 -16.662
    3    HB2  ARG  24           HB2      ARG  24 -21.983  -6.835 -16.722
    4    HB3  ARG  24           HB3      ARG  24 -22.683  -5.945 -18.051
    5    HG2  ARG  24           HG2      ARG  24 -22.918  -3.923 -16.636
    6    HG3  ARG  24           HG3      ARG  24 -22.269  -4.837 -15.248
    7    HD2  ARG  24           HD2      ARG  24 -20.189  -5.299 -16.546
    8    HD3  ARG  24           HD3      ARG  24 -20.844  -4.348 -17.874
    9    HE   ARG  24           HE       ARG  24 -20.883  -2.514 -16.005
   10   HH21  ARG  24          HH11      ARG  24 -19.429  -0.933 -16.667
   11   HH22  ARG  24          HH12      ARG  24 -17.763  -1.342 -16.893
   12   HH11  ARG  24          HH21      ARG  24 -18.453  -4.799 -16.577
   13   HH12  ARG  24          HH22      ARG  24 -17.195  -3.629 -16.827

  No H/Q in entry =          13
  In of MODEL   77
    1    H    ALA  25           H        ALA  25 -23.645  -9.062 -16.385
    2    HA   ALA  25           HA       ALA  25 -24.287  -9.912 -19.013
    3    HB1  ALA  25           HB1      ALA  25 -23.558 -11.932 -18.318
    4    HB3  ALA  25           HB2      ALA  25 -24.601 -11.920 -16.896
    5    HB2  ALA  25           HB3      ALA  25 -23.057 -11.072 -16.861

  No H/Q in entry =           5
  In of MODEL   77
    1    H    GLN  26           H        GLN  26 -26.084  -9.964 -15.971
    2    HA   GLN  26           HA       GLN  26 -28.421 -11.201 -16.962
    3    HB2  GLN  26           HB2      GLN  26 -27.909  -9.440 -14.585
    4    HB3  GLN  26           HB3      GLN  26 -29.465 -10.184 -14.917
    5    HG2  GLN  26           HG2      GLN  26 -26.856 -11.606 -14.470
    6    HG3  GLN  26           HG3      GLN  26 -28.207 -11.517 -13.347
    7   HE21  GLN  26          HE21      GLN  26 -26.974 -13.669 -14.628
    8   HE22  GLN  26          HE22      GLN  26 -28.010 -14.733 -15.411

  No H/Q in entry =           8
  In of MODEL   77
    1    H    ALA  27           H        ALA  27 -27.528  -7.791 -16.590
    2    HA   ALA  27           HA       ALA  27 -30.039  -6.733 -17.352
    3    HB1  ALA  27           HB1      ALA  27 -28.236  -5.391 -16.259
    4    HB3  ALA  27           HB2      ALA  27 -28.850  -4.638 -17.731
    5    HB2  ALA  27           HB3      ALA  27 -27.304  -5.484 -17.754

  No H/Q in entry =           5
  In of MODEL   77
    1    H    GLU  28           H        GLU  28 -27.341  -7.926 -19.244
    2    HA   GLU  28           HA       GLU  28 -28.313  -6.906 -21.756
    3    HB2  GLU  28           HB2      GLU  28 -25.920  -7.557 -21.154
    4    HB3  GLU  28           HB3      GLU  28 -26.446  -9.228 -21.346
    5    HG2  GLU  28           HG2      GLU  28 -25.328  -8.442 -23.328
    6    HG3  GLU  28           HG3      GLU  28 -27.025  -8.788 -23.659

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LYS  29           H        LYS  29 -28.424 -10.009 -20.091
    2    HA   LYS  29           HA       LYS  29 -29.727 -11.501 -22.079
    3    HB2  LYS  29           HB2      LYS  29 -28.646 -12.466 -20.083
    4    HB3  LYS  29           HB3      LYS  29 -29.917 -11.772 -19.077
    5    HG2  LYS  29           HG2      LYS  29 -31.570 -13.169 -20.126
    6    HG3  LYS  29           HG3      LYS  29 -30.373 -13.792 -21.260
    7    HD2  LYS  29           HD2      LYS  29 -29.200 -14.939 -19.536
    8    HD3  LYS  29           HD3      LYS  29 -30.105 -14.106 -18.273
    9    HE2  LYS  29           HE2      LYS  29 -30.831 -16.466 -18.622
   10    HE3  LYS  29           HE3      LYS  29 -32.125 -15.291 -18.856
   11    HZ1  LYS  29           HZ1      LYS  29 -31.583 -15.423 -21.289
   12    HZ3  LYS  29           HZ2      LYS  29 -32.278 -16.818 -20.613
   13    HZ2  LYS  29           HZ3      LYS  29 -30.612 -16.768 -20.928

  No H/Q in entry =          13
  In of MODEL   77
    1    H    TYR  30           H        TYR  30 -31.122  -9.408 -19.566
    2    HA   TYR  30           HA       TYR  30 -33.790  -9.894 -20.780
    3    HB2  TYR  30           HB2      TYR  30 -33.126  -8.726 -18.069
    4    HB3  TYR  30           HB3      TYR  30 -34.746  -9.006 -18.706
    5    HD1  TYR  30           HD1      TYR  30 -35.629 -11.310 -18.905
    6    HD2  TYR  30           HD2      TYR  30 -31.787 -10.534 -17.241
    7    HE1  TYR  30           HE1      TYR  30 -35.501 -13.635 -18.105
    8    HE2  TYR  30           HE2      TYR  30 -31.661 -12.845 -16.443
    9    HH   TYR  30           HH       TYR  30 -33.280 -15.229 -17.516

  No H/Q in entry =           9
  In of MODEL   77
    1    H    GLU  31           H        GLU  31 -31.658  -7.877 -21.607
    2    HA   GLU  31           HA       GLU  31 -31.621  -5.720 -22.434
    3    HB2  GLU  31           HB2      GLU  31 -34.511  -6.475 -22.917
    4    HB3  GLU  31           HB3      GLU  31 -33.695  -5.098 -23.658
    5    HG2  GLU  31           HG2      GLU  31 -32.216  -6.519 -24.861
    6    HG3  GLU  31           HG3      GLU  31 -32.753  -7.939 -23.964

  No H/Q in entry =           6
  In of MODEL   77
    1    H    VAL  32           H        VAL  32 -31.795  -5.615 -19.701
    2    HA   VAL  32           HA       VAL  32 -33.679  -3.526 -19.028
    3    HB   VAL  32           HB       VAL  32 -31.258  -4.484 -17.468
    4   HG12  VAL  32          HG11      VAL  32 -32.787  -3.677 -15.560
    5   HG11  VAL  32          HG12      VAL  32 -33.644  -2.787 -16.818
    6   HG13  VAL  32          HG13      VAL  32 -31.938  -2.459 -16.514
    7   HG21  VAL  32          HG21      VAL  32 -33.009  -6.230 -18.136
    8   HG23  VAL  32          HG22      VAL  32 -34.049  -5.414 -16.968
    9   HG22  VAL  32          HG23      VAL  32 -32.517  -6.116 -16.446

  No H/Q in entry =           9
  In of MODEL   77
    1    HA   PRO  33           HA       PRO  33 -30.705  -0.559 -20.737
    2    HB2  PRO  33           HB2      PRO  33 -32.246   1.642 -20.603
    3    HB3  PRO  33           HB3      PRO  33 -32.707   0.331 -21.689
    4    HG2  PRO  33           HG2      PRO  33 -33.656   0.839 -18.869
    5    HG3  PRO  33           HG3      PRO  33 -34.631   0.614 -20.321
    6    HD2  PRO  33           HD2      PRO  33 -34.129  -1.449 -18.655
    7    HD3  PRO  33           HD3      PRO  33 -34.205  -1.694 -20.401

  No H/Q in entry =           7
  In of MODEL   77
    1    H    VAL  34           H        VAL  34 -29.415  -1.081 -18.799
    2    HA   VAL  34           HA       VAL  34 -29.151   1.351 -17.159
    3    HB   VAL  34           HB       VAL  34 -28.529  -0.098 -15.225
    4   HG12  VAL  34          HG11      VAL  34 -30.925  -1.006 -14.892
    5   HG11  VAL  34          HG12      VAL  34 -31.268  -0.253 -16.448
    6   HG13  VAL  34          HG13      VAL  34 -30.716   0.734 -15.095
    7   HG21  VAL  34          HG21      VAL  34 -28.704  -2.131 -17.228
    8   HG23  VAL  34          HG22      VAL  34 -29.742  -2.505 -15.850
    9   HG22  VAL  34          HG23      VAL  34 -28.026  -2.192 -15.600

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ILE  35           H        ILE  35 -27.173   1.817 -16.339
    2    HA   ILE  35           HA       ILE  35 -24.860   0.521 -17.623
    3    HB   ILE  35           HB       ILE  35 -25.297   3.406 -16.813
    4   HG12  ILE  35          HG12      ILE  35 -24.319   2.108 -19.364
    5   HG13  ILE  35          HG13      ILE  35 -25.956   2.705 -19.090
    6   HG21  ILE  35          HG21      ILE  35 -22.714   1.911 -17.144
    7   HG23  ILE  35          HG22      ILE  35 -23.175   3.085 -15.913
    8   HG22  ILE  35          HG23      ILE  35 -22.817   3.622 -17.555
    9   HD11  ILE  35          HD11      ILE  35 -24.582   4.921 -18.507
   10   HD13  ILE  35          HD12      ILE  35 -25.130   4.527 -20.137
   11   HD12  ILE  35          HD13      ILE  35 -23.467   4.183 -19.657

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ILE  36           H        ILE  36 -23.599  -0.482 -16.034
    2    HA   ILE  36           HA       ILE  36 -24.020   0.132 -13.160
    3    HB   ILE  36           HB       ILE  36 -23.163  -2.560 -14.272
    4   HG12  ILE  36          HG12      ILE  36 -25.975  -1.795 -13.482
    5   HG13  ILE  36          HG13      ILE  36 -25.420  -1.770 -15.155
    6   HG23  ILE  36          HG21      ILE  36 -23.480  -3.390 -12.154
    7   HG22  ILE  36          HG22      ILE  36 -24.622  -2.123 -11.706
    8   HG21  ILE  36          HG23      ILE  36 -22.898  -1.765 -11.794
    9   HD13  ILE  36          HD11      ILE  36 -25.553  -3.986 -15.357
   10   HD12  ILE  36          HD12      ILE  36 -26.606  -3.878 -13.946
   11   HD11  ILE  36          HD13      ILE  36 -24.900  -4.272 -13.744

  No H/Q in entry =          11
  In of MODEL   77
    1    H    GLU  37           H        GLU  37 -22.239   0.791 -12.075
    2    HA   GLU  37           HA       GLU  37 -19.546   0.034 -13.016
    3    HB2  GLU  37           HB2      GLU  37 -20.475   2.812 -12.306
    4    HB3  GLU  37           HB3      GLU  37 -18.782   2.342 -12.466
    5    HG2  GLU  37           HG2      GLU  37 -19.108   1.882 -14.817
    6    HG3  GLU  37           HG3      GLU  37 -20.819   2.284 -14.673

  No H/Q in entry =           6
  In of MODEL   77
    1    H    ALA  38           H        ALA  38 -18.038  -0.178 -11.348
    2    HA   ALA  38           HA       ALA  38 -19.044  -0.010  -8.567
    3    HB1  ALA  38           HB1      ALA  38 -17.314  -1.924 -10.007
    4    HB3  ALA  38           HB2      ALA  38 -18.345  -2.173  -8.598
    5    HB2  ALA  38           HB3      ALA  38 -16.743  -1.465  -8.403

  No H/Q in entry =           5
  In of MODEL   77
    1    H    PHE  39           H        PHE  39 -17.809   1.222  -7.109
    2    HA   PHE  39           HA       PHE  39 -15.313   2.464  -8.032
    3    HB2  PHE  39           HB2      PHE  39 -17.662   3.956  -6.858
    4    HB3  PHE  39           HB3      PHE  39 -16.048   4.632  -7.067
    5    HD1  PHE  39           HD1      PHE  39 -15.110   4.797  -9.401
    6    HD2  PHE  39           HD2      PHE  39 -19.218   4.001  -8.582
    7    HE1  PHE  39           HE1      PHE  39 -15.697   5.523 -11.698
    8    HE2  PHE  39           HE2      PHE  39 -19.819   4.717 -10.867
    9    HZ   PHE  39           HZ       PHE  39 -18.061   5.451 -12.442

  No H/Q in entry =           9
  In of MODEL   77
    1    HA   PRO  40           HA       PRO  40 -14.320   1.735  -3.754
    2    HB2  PRO  40           HB2      PRO  40 -12.581   3.781  -3.169
    3    HB3  PRO  40           HB3      PRO  40 -12.125   2.455  -4.239
    4    HG2  PRO  40           HG2      PRO  40 -13.203   5.170  -4.981
    5    HG3  PRO  40           HG3      PRO  40 -11.769   4.353  -5.599
    6    HD2  PRO  40           HD2      PRO  40 -14.005   4.224  -6.985
    7    HD3  PRO  40           HD3      PRO  40 -13.022   2.772  -6.801

  No H/Q in entry =           7
  In of MODEL   77
    1    H    GLU  41           H        GLU  41 -14.936   2.705  -1.620
    2    HA   GLU  41           HA       GLU  41 -17.210   4.368  -1.584
    3    HB2  GLU  41           HB2      GLU  41 -16.681   4.532   0.898
    4    HB3  GLU  41           HB3      GLU  41 -16.925   2.911   0.248
    5    HG2  GLU  41           HG2      GLU  41 -15.105   2.610   1.626
    6    HG3  GLU  41           HG3      GLU  41 -14.343   2.860   0.056

  No H/Q in entry =           6
  In of MODEL   77
    1    H    THR  42           H        THR  42 -13.896   5.345  -1.670
    2    HA   THR  42           HA       THR  42 -14.283   7.901  -0.460
    3    HB   THR  42           HB       THR  42 -12.148   8.512  -1.569
    4    HG1  THR  42           HG1      THR  42 -11.844   5.942  -2.566
    5   HG21  THR  42          HG21      THR  42 -12.178   5.737  -0.356
    6   HG23  THR  42          HG22      THR  42 -12.085   7.254   0.540
    7   HG22  THR  42          HG23      THR  42 -10.756   6.768  -0.511

  No H/Q in entry =           7
  In of MODEL   77
    1    H    LEU  43           H        LEU  43 -15.198   6.785  -3.549
    2    HA   LEU  43           HA       LEU  43 -15.512   9.550  -4.521
    3    HB2  LEU  43           HB2      LEU  43 -15.865   6.902  -5.915
    4    HB3  LEU  43           HB3      LEU  43 -16.067   8.484  -6.666
    5    HG   LEU  43           HG       LEU  43 -13.463   7.366  -5.657
    6   HD12  LEU  43          HD11      LEU  43 -14.203   7.849  -8.521
    7   HD11  LEU  43          HD12      LEU  43 -14.597   6.321  -7.735
    8   HD13  LEU  43          HD13      LEU  43 -12.917   6.839  -7.859
    9   HD23  LEU  43          HD21      LEU  43 -12.568   9.301  -7.016
   10   HD22  LEU  43          HD22      LEU  43 -13.424   9.749  -5.541
   11   HD21  LEU  43          HD23      LEU  43 -14.222   9.905  -7.105

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ALA  44           H        ALA  44 -17.405   7.694  -2.645
    2    HA   ALA  44           HA       ALA  44 -19.893   7.505  -3.943
    3    HB2  ALA  44           HB1      ALA  44 -19.713   6.396  -1.845
    4    HB3  ALA  44           HB2      ALA  44 -20.842   7.721  -1.565
    5    HB1  ALA  44           HB3      ALA  44 -19.168   7.861  -1.029

  No H/Q in entry =           5
  In of MODEL   77
    1    H    GLY  45           H        GLY  45 -18.510  10.334  -2.430
    2    HA3  GLY  45           HA2      GLY  45 -20.977  11.789  -2.769
    3    HA2  GLY  45           HA3      GLY  45 -19.439  12.443  -2.209

  No H/Q in entry =           3
  In of MODEL   77
    1    H    GLU  46           H        GLU  46 -17.914  11.529  -4.513
    2    HA   GLU  46           HA       GLU  46 -18.608  13.728  -6.280
    3    HB2  GLU  46           HB2      GLU  46 -16.377  11.692  -6.314
    4    HB3  GLU  46           HB3      GLU  46 -16.544  12.996  -7.489
    5    HG2  GLU  46           HG2      GLU  46 -14.998  13.850  -6.015
    6    HG3  GLU  46           HG3      GLU  46 -16.508  14.544  -5.425

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LYS  47           H        LYS  47 -18.429  10.212  -6.709
    2    HA   LYS  47           HA       LYS  47 -19.558  10.405  -9.374
    3    HB2  LYS  47           HB2      LYS  47 -18.961   8.014  -7.623
    4    HB3  LYS  47           HB3      LYS  47 -19.495   7.935  -9.302
    5    HG2  LYS  47           HG2      LYS  47 -16.998   9.385  -8.523
    6    HG3  LYS  47           HG3      LYS  47 -17.007   7.645  -8.808
    7    HD2  LYS  47           HD2      LYS  47 -17.914   8.003 -11.044
    8    HD3  LYS  47           HD3      LYS  47 -17.943   9.743 -10.761
    9    HE2  LYS  47           HE2      LYS  47 -15.996   9.178 -12.058
   10    HE3  LYS  47           HE3      LYS  47 -15.494   9.697 -10.451
   11    HZ1  LYS  47           HZ1      LYS  47 -15.869   7.003 -10.231
   12    HZ3  LYS  47           HZ2      LYS  47 -14.380   7.812 -10.341
   13    HZ2  LYS  47           HZ3      LYS  47 -15.115   7.193 -11.742

  No H/Q in entry =          13
  In of MODEL   77
    1    H    GLY  48           H        GLY  48 -20.835   9.632  -6.211
    2    HA3  GLY  48           HA2      GLY  48 -23.206   8.401  -6.925
    3    HA2  GLY  48           HA3      GLY  48 -22.984   9.402  -5.490

  No H/Q in entry =           3
  In of MODEL   77
    1    H    GLN  49           H        GLN  49 -22.461  11.832  -7.072
    2    HA   GLN  49           HA       GLN  49 -25.041  12.896  -7.193
    3    HB2  GLN  49           HB2      GLN  49 -22.528  13.804  -8.581
    4    HB3  GLN  49           HB3      GLN  49 -24.007  14.742  -8.484
    5    HG2  GLN  49           HG2      GLN  49 -23.823  14.775  -6.048
    6    HG3  GLN  49           HG3      GLN  49 -22.357  13.814  -6.144
    7   HE21  GLN  49          HE21      GLN  49 -22.268  16.048  -4.877
    8   HE22  GLN  49          HE22      GLN  49 -21.374  17.319  -5.537

  No H/Q in entry =           8
  In of MODEL   77
    1    H    ASN  50           H        ASN  50 -23.353  11.042  -9.593
    2    HA   ASN  50           HA       ASN  50 -25.273  11.875 -11.658
    3    HB2  ASN  50           HB2      ASN  50 -22.668  10.381 -11.914
    4    HB3  ASN  50           HB3      ASN  50 -23.739  10.785 -13.248
    5   HD21  ASN  50          HD21      ASN  50 -21.102  11.682 -11.666
    6   HD22  ASN  50          HD22      ASN  50 -20.901  13.321 -12.014

  No H/Q in entry =           6
  In of MODEL   77
    1    H    ALA  51           H        ALA  51 -25.194   9.525  -9.407
    2    HA   ALA  51           HA       ALA  51 -25.958   7.362 -11.221
    3    HB2  ALA  51           HB1      ALA  51 -25.334   6.027  -9.537
    4    HB3  ALA  51           HB2      ALA  51 -26.459   6.818  -8.435
    5    HB1  ALA  51           HB3      ALA  51 -24.834   7.468  -8.651

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ASP  52           H        ASP  52 -27.943   6.272 -11.058
    2    HA   ASP  52           HA       ASP  52 -30.149   8.069 -10.375
    3    HB2  ASP  52           HB2      ASP  52 -29.931   5.563 -12.041
    4    HB3  ASP  52           HB3      ASP  52 -31.483   6.270 -11.592

  No H/Q in entry =           4
  In of MODEL   77
    1    H    VAL  53           H        VAL  53 -28.488   5.210  -9.369
    2    HA   VAL  53           HA       VAL  53 -29.905   5.319  -6.839
    3    HB   VAL  53           HB       VAL  53 -31.288   3.650  -8.065
    4   HG11  VAL  53          HG11      VAL  53 -29.542   2.816  -9.602
    5   HG13  VAL  53          HG12      VAL  53 -30.344   1.509  -8.732
    6   HG12  VAL  53          HG13      VAL  53 -28.739   2.040  -8.239
    7   HG23  VAL  53          HG21      VAL  53 -30.416   1.691  -6.376
    8   HG22  VAL  53          HG22      VAL  53 -31.563   2.977  -6.001
    9   HG21  VAL  53          HG23      VAL  53 -29.855   3.179  -5.612

  No H/Q in entry =           9
  In of MODEL   77
    1    H    VAL  54           H        VAL  54 -28.568   4.912  -5.196
    2    HA   VAL  54           HA       VAL  54 -25.800   4.107  -5.833
    3    HB   VAL  54           HB       VAL  54 -26.877   5.872  -3.577
    4   HG11  VAL  54          HG11      VAL  54 -24.278   4.495  -3.891
    5   HG13  VAL  54          HG12      VAL  54 -25.028   5.165  -2.443
    6   HG12  VAL  54          HG13      VAL  54 -24.151   6.221  -3.550
    7   HG22  VAL  54          HG21      VAL  54 -26.060   7.698  -4.689
    8   HG21  VAL  54          HG22      VAL  54 -26.604   6.696  -6.033
    9   HG23  VAL  54          HG23      VAL  54 -24.893   6.750  -5.613

  No H/Q in entry =           9
  In of MODEL   77
    1    H    LEU  55           H        LEU  55 -25.170   2.197  -5.193
    2    HA   LEU  55           HA       LEU  55 -26.635   0.866  -3.000
    3    HB2  LEU  55           HB2      LEU  55 -25.083  -0.282  -5.307
    4    HB3  LEU  55           HB3      LEU  55 -25.814  -1.226  -4.009
    5    HG   LEU  55           HG       LEU  55 -27.298   0.334  -6.116
    6   HD13  LEU  55          HD11      LEU  55 -26.981  -1.517  -7.334
    7   HD12  LEU  55          HD12      LEU  55 -27.911  -2.404  -6.127
    8   HD11  LEU  55          HD13      LEU  55 -26.156  -2.311  -5.995
    9   HD23  LEU  55          HD21      LEU  55 -28.542  -1.629  -4.243
   10   HD22  LEU  55          HD22      LEU  55 -29.268  -0.261  -5.086
   11   HD21  LEU  55          HD23      LEU  55 -28.239   0.015  -3.682

  No H/Q in entry =          11
  In of MODEL   77
    1    H    LEU  56           H        LEU  56 -25.455   0.295  -1.204
    2    HA   LEU  56           HA       LEU  56 -22.528   0.738  -1.285
    3    HB2  LEU  56           HB2      LEU  56 -24.303   0.503   1.132
    4    HB3  LEU  56           HB3      LEU  56 -22.601   0.961   1.103
    5    HG   LEU  56           HG       LEU  56 -24.936   2.599   0.159
    6   HD11  LEU  56          HD11      LEU  56 -23.790   2.241   2.669
    7   HD13  LEU  56          HD12      LEU  56 -24.807   3.593   2.170
    8   HD12  LEU  56          HD13      LEU  56 -23.053   3.726   2.064
    9   HD23  LEU  56          HD21      LEU  56 -23.021   4.328  -0.058
   10   HD22  LEU  56          HD22      LEU  56 -23.400   3.222  -1.379
   11   HD21  LEU  56          HD23      LEU  56 -22.030   2.894  -0.319

  No H/Q in entry =          11
  In of MODEL   77
    1    H    GLY  57           H        GLY  57 -21.117  -0.869  -0.761
    2    HA3  GLY  57           HA2      GLY  57 -21.997  -3.570  -0.944
    3    HA2  GLY  57           HA3      GLY  57 -20.379  -3.049  -0.481

  No H/Q in entry =           3
  In of MODEL   77
    1    HA   PRO  58           HA       PRO  58 -23.134  -4.123   3.260
    2    HB2  PRO  58           HB2      PRO  58 -22.402  -6.716   3.865
    3    HB3  PRO  58           HB3      PRO  58 -23.803  -6.331   2.865
    4    HG2  PRO  58           HG2      PRO  58 -21.070  -7.170   2.053
    5    HG3  PRO  58           HG3      PRO  58 -22.634  -7.657   1.399
    6    HD2  PRO  58           HD2      PRO  58 -21.066  -5.818   0.155
    7    HD3  PRO  58           HD3      PRO  58 -22.828  -5.760   0.071

  No H/Q in entry =           7
  In of MODEL   77
    1    H    GLN  59           H        GLN  59 -19.762  -4.543   2.620
    2    HA   GLN  59           HA       GLN  59 -18.980  -4.543   5.373
    3    HB2  GLN  59           HB2      GLN  59 -17.421  -3.655   2.939
    4    HB3  GLN  59           HB3      GLN  59 -16.753  -3.890   4.542
    5    HG2  GLN  59           HG2      GLN  59 -16.477  -5.736   2.753
    6    HG3  GLN  59           HG3      GLN  59 -16.882  -6.189   4.400
    7   HE21  GLN  59          HE21      GLN  59 -18.237  -7.564   4.375
    8   HE22  GLN  59          HE22      GLN  59 -19.596  -8.088   3.570

  No H/Q in entry =           8
  In of MODEL   77
    1    H    ILE  60           H        ILE  60 -19.975  -2.013   3.168
    2    HA   ILE  60           HA       ILE  60 -19.133  -0.037   5.200
    3    HB   ILE  60           HB       ILE  60 -19.417   1.683   3.368
    4   HG12  ILE  60          HG12      ILE  60 -19.190  -0.552   1.396
    5   HG13  ILE  60          HG13      ILE  60 -20.782  -0.034   1.951
    6   HG23  ILE  60          HG21      ILE  60 -17.259   1.464   2.637
    7   HG22  ILE  60          HG22      ILE  60 -17.363  -0.292   2.523
    8   HG21  ILE  60          HG23      ILE  60 -17.262   0.485   4.103
    9   HD13  ILE  60          HD11      ILE  60 -20.506   1.258   0.042
   10   HD12  ILE  60          HD12      ILE  60 -18.773   1.456   0.303
   11   HD11  ILE  60          HD13      ILE  60 -19.921   2.355   1.293

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ALA  61           H        ALA  61 -21.562  -1.661   5.298
    2    HA   ALA  61           HA       ALA  61 -23.818  -0.031   4.858
    3    HB1  ALA  61           HB1      ALA  61 -24.997  -1.537   6.199
    4    HB2  ALA  61           HB2      ALA  61 -23.583  -1.902   7.189
    5    HB3  ALA  61           HB3      ALA  61 -23.686  -2.513   5.538

  No H/Q in entry =           5
  In of MODEL   77
    1    H    TYR  62           H        TYR  62 -21.581  -0.103   7.634
    2    HA   TYR  62           HA       TYR  62 -23.145   1.535   9.316
    3    HB2  TYR  62           HB2      TYR  62 -21.108   1.982  10.536
    4    HB3  TYR  62           HB3      TYR  62 -21.125   0.287  10.054
    5    HD1  TYR  62           HD1      TYR  62 -19.497  -0.579   8.450
    6    HD2  TYR  62           HD2      TYR  62 -19.480   3.554   9.540
    7    HE1  TYR  62           HE1      TYR  62 -17.298  -0.307   7.369
    8    HE2  TYR  62           HE2      TYR  62 -17.267   3.820   8.459
    9    HH   TYR  62           HH       TYR  62 -16.036   2.565   6.549

  No H/Q in entry =           9
  In of MODEL   77
    1    H    MET  63           H        MET  63 -21.545   2.411   6.441
    2    HA   MET  63           HA       MET  63 -21.413   5.248   7.126
    3    HB2  MET  63           HB2      MET  63 -20.809   3.727   4.589
    4    HB3  MET  63           HB3      MET  63 -20.642   5.476   4.763
    5    HG2  MET  63           HG2      MET  63 -18.902   5.172   6.410
    6    HG3  MET  63           HG3      MET  63 -19.097   3.423   6.323
    7    HE2  MET  63           HE1      MET  63 -17.093   6.351   3.781
    8    HE1  MET  63           HE2      MET  63 -18.653   6.548   4.578
    9    HE3  MET  63           HE3      MET  63 -18.584   6.050   2.887

  No H/Q in entry =           9
  In of MODEL   77
    1    H    LEU  64           H        LEU  64 -23.959   3.353   6.192
    2    HA   LEU  64           HA       LEU  64 -25.211   4.748   4.123
    3    HB2  LEU  64           HB2      LEU  64 -26.039   2.632   5.055
    4    HB3  LEU  64           HB3      LEU  64 -26.493   3.471   6.537
    5    HG   LEU  64           HG       LEU  64 -28.219   4.697   5.324
    6   HD13  LEU  64          HD11      LEU  64 -27.962   4.938   3.088
    7   HD12  LEU  64          HD12      LEU  64 -28.586   3.292   2.953
    8   HD11  LEU  64          HD13      LEU  64 -26.846   3.577   2.993
    9   HD23  LEU  64          HD21      LEU  64 -28.704   1.876   4.589
   10   HD22  LEU  64          HD22      LEU  64 -29.699   2.998   5.516
   11   HD21  LEU  64          HD23      LEU  64 -28.304   2.226   6.270

  No H/Q in entry =          11
  In of MODEL   77
    1    HA   PRO  65           HA       PRO  65 -27.407   7.878   6.889
    2    HB2  PRO  65           HB2      PRO  65 -25.386   8.071   9.122
    3    HB3  PRO  65           HB3      PRO  65 -27.128   8.326   9.185
    4    HG2  PRO  65           HG2      PRO  65 -26.157   6.088  10.108
    5    HG3  PRO  65           HG3      PRO  65 -27.587   6.032   9.078
    6    HD2  PRO  65           HD2      PRO  65 -24.714   5.456   8.346
    7    HD3  PRO  65           HD3      PRO  65 -26.164   4.549   7.917

  No H/Q in entry =           7
  In of MODEL   77
    1    H    GLU  66           H        GLU  66 -23.851   7.871   6.924
    2    HA   GLU  66           HA       GLU  66 -23.596  10.673   6.510
    3    HB2  GLU  66           HB2      GLU  66 -21.758   8.388   5.845
    4    HB3  GLU  66           HB3      GLU  66 -21.334  10.086   5.628
    5    HG2  GLU  66           HG2      GLU  66 -21.526  10.460   7.997
    6    HG3  GLU  66           HG3      GLU  66 -22.026   8.786   8.239

  No H/Q in entry =           6
  In of MODEL   77
    1    H    ILE  67           H        ILE  67 -23.684   7.920   4.266
    2    HA   ILE  67           HA       ILE  67 -23.316   9.628   1.964
    3    HB   ILE  67           HB       ILE  67 -24.174   6.710   2.161
    4   HG12  ILE  67          HG12      ILE  67 -21.570   7.911   1.208
    5   HG13  ILE  67          HG13      ILE  67 -21.841   7.493   2.898
    6   HG21  ILE  67          HG21      ILE  67 -24.164   8.583  -0.070
    7   HG23  ILE  67          HG22      ILE  67 -24.768   6.927  -0.008
    8   HG22  ILE  67          HG23      ILE  67 -23.066   7.233  -0.355
    9   HD12  ILE  67          HD11      ILE  67 -21.423   5.719   0.548
   10   HD11  ILE  67          HD12      ILE  67 -22.415   5.138   1.883
   11   HD13  ILE  67          HD13      ILE  67 -20.745   5.625   2.174

  No H/Q in entry =          11
  In of MODEL   77
    1    H    GLN  68           H        GLN  68 -26.155   8.542   3.631
    2    HA   GLN  68           HA       GLN  68 -28.016   9.445   1.675
    3    HB2  GLN  68           HB2      GLN  68 -28.235   9.092   4.660
    4    HB3  GLN  68           HB3      GLN  68 -29.572   9.668   3.680
    5    HG2  GLN  68           HG2      GLN  68 -29.589   7.634   2.410
    6    HG3  GLN  68           HG3      GLN  68 -28.125   7.077   3.198
    7   HE21  GLN  68          HE21      GLN  68 -30.289   5.693   3.090
    8   HE22  GLN  68          HE22      GLN  68 -31.096   5.231   4.514

  No H/Q in entry =           8
  In of MODEL   77
    1    H    ARG  69           H        ARG  69 -26.400  11.137   4.390
    2    HA   ARG  69           HA       ARG  69 -27.797  13.603   3.993
    3    HB2  ARG  69           HB2      ARG  69 -25.425  12.704   5.559
    4    HB3  ARG  69           HB3      ARG  69 -25.527  14.420   5.196
    5    HG2  ARG  69           HG2      ARG  69 -27.834  14.440   6.193
    6    HG3  ARG  69           HG3      ARG  69 -27.601  12.754   6.668
    7    HD2  ARG  69           HD2      ARG  69 -25.925  15.130   7.559
    8    HD3  ARG  69           HD3      ARG  69 -27.033  14.214   8.567
    9    HE   ARG  69           HE       ARG  69 -24.421  13.309   7.592
   10   HH21  ARG  69          HH11      ARG  69 -23.581  11.558   8.783
   11   HH22  ARG  69          HH12      ARG  69 -24.588  10.733   9.925
   12   HH11  ARG  69          HH21      ARG  69 -27.354  12.733   9.323
   13   HH12  ARG  69          HH22      ARG  69 -26.724  11.396  10.228

  No H/Q in entry =          13
  In of MODEL   77
    1    H    LEU  70           H        LEU  70 -24.927  12.224   2.605
    2    HA   LEU  70           HA       LEU  70 -23.851  14.598   1.419
    3    HB2  LEU  70           HB2      LEU  70 -22.825  12.292   2.009
    4    HB3  LEU  70           HB3      LEU  70 -23.453  11.816   0.431
    5    HG   LEU  70           HG       LEU  70 -21.886  13.203  -0.674
    6   HD11  LEU  70          HD11      LEU  70 -21.042  14.062   2.102
    7   HD13  LEU  70          HD12      LEU  70 -21.762  15.086   0.859
    8   HD12  LEU  70          HD13      LEU  70 -20.146  14.421   0.623
    9   HD22  LEU  70          HD21      LEU  70 -20.432  11.502  -0.454
   10   HD21  LEU  70          HD22      LEU  70 -21.338  10.974   0.964
   11   HD23  LEU  70          HD23      LEU  70 -19.962  12.060   1.151

  No H/Q in entry =          11
  In of MODEL   77
    1    H    LEU  71           H        LEU  71 -25.990  12.030   0.334
    2    HA   LEU  71           HA       LEU  71 -26.558  13.507  -2.180
    3    HB2  LEU  71           HB2      LEU  71 -26.731  10.522  -1.724
    4    HB3  LEU  71           HB3      LEU  71 -26.884  11.378  -3.258
    5    HG   LEU  71           HG       LEU  71 -24.345  11.418  -1.626
    6   HD12  LEU  71          HD11      LEU  71 -24.410   9.783  -4.054
    7   HD11  LEU  71          HD12      LEU  71 -25.400   9.154  -2.738
    8   HD13  LEU  71          HD13      LEU  71 -23.680   9.450  -2.482
    9   HD22  LEU  71          HD21      LEU  71 -24.482  13.229  -3.122
   10   HD21  LEU  71          HD22      LEU  71 -24.984  12.179  -4.446
   11   HD23  LEU  71          HD23      LEU  71 -23.354  12.049  -3.787

  No H/Q in entry =          11
  In of MODEL   77
    1    HA   PRO  72           HA       PRO  72 -30.391  13.030   0.485
    2    HB2  PRO  72           HB2      PRO  72 -31.271  15.584   0.407
    3    HB3  PRO  72           HB3      PRO  72 -29.946  15.146   1.485
    4    HG2  PRO  72           HG2      PRO  72 -29.800  16.335  -1.273
    5    HG3  PRO  72           HG3      PRO  72 -29.022  16.897   0.207
    6    HD2  PRO  72           HD2      PRO  72 -27.692  15.345  -1.571
    7    HD3  PRO  72           HD3      PRO  72 -27.416  15.184   0.163

  No H/Q in entry =           7
  In of MODEL   77
    1    H    ASN  73           H        ASN  73 -29.810  13.983  -2.738
    2    HA   ASN  73           HA       ASN  73 -32.675  13.651  -3.337
    3    HB2  ASN  73           HB2      ASN  73 -32.242  14.755  -5.442
    4    HB3  ASN  73           HB3      ASN  73 -31.711  15.742  -4.089
    5   HD21  ASN  73          HD21      ASN  73 -30.946  15.787  -6.775
    6   HD22  ASN  73          HD22      ASN  73 -29.280  15.638  -6.986

  No H/Q in entry =           6
  In of MODEL   77
    1    H    LYS  74           H        LYS  74 -30.673  11.411  -2.929
    2    HA   LYS  74           HA       LYS  74 -31.260  10.005  -5.468
    3    HB2  LYS  74           HB2      LYS  74 -28.707   9.735  -3.875
    4    HB3  LYS  74           HB3      LYS  74 -29.102   8.917  -5.387
    5    HG2  LYS  74           HG2      LYS  74 -28.855  11.889  -5.194
    6    HG3  LYS  74           HG3      LYS  74 -27.477  10.835  -5.511
    7    HD2  LYS  74           HD2      LYS  74 -28.610   9.895  -7.440
    8    HD3  LYS  74           HD3      LYS  74 -30.032  10.884  -7.106
    9    HE2  LYS  74           HE2      LYS  74 -28.825  12.897  -7.567
   10    HE3  LYS  74           HE3      LYS  74 -27.300  12.017  -7.673
   11    HZ2  LYS  74           HZ1      LYS  74 -28.798  12.604  -9.783
   12    HZ1  LYS  74           HZ2      LYS  74 -29.438  11.079  -9.400
   13    HZ3  LYS  74           HZ3      LYS  74 -27.778  11.249  -9.716

  No H/Q in entry =          13
  In of MODEL   77
    1    HA   PRO  75           HA       PRO  75 -32.602   7.019  -2.475
    2    HB2  PRO  75           HB2      PRO  75 -32.915   4.795  -4.048
    3    HB3  PRO  75           HB3      PRO  75 -34.050   6.143  -4.108
    4    HG2  PRO  75           HG2      PRO  75 -31.729   5.556  -5.904
    5    HG3  PRO  75           HG3      PRO  75 -33.385   5.981  -6.334
    6    HD2  PRO  75           HD2      PRO  75 -31.454   7.858  -6.317
    7    HD3  PRO  75           HD3      PRO  75 -33.082   8.250  -5.761

  No H/Q in entry =           7
  In of MODEL   77
    1    H    VAL  76           H        VAL  76 -31.127   5.976  -1.116
    2    HA   VAL  76           HA       VAL  76 -28.668   4.779  -2.247
    3    HB   VAL  76           HB       VAL  76 -28.935   6.250   0.410
    4   HG11  VAL  76          HG11      VAL  76 -26.586   4.974  -1.004
    5   HG13  VAL  76          HG12      VAL  76 -27.263   4.523   0.562
    6   HG12  VAL  76          HG13      VAL  76 -26.428   6.065   0.374
    7   HG22  VAL  76          HG21      VAL  76 -28.288   8.152  -0.489
    8   HG21  VAL  76          HG22      VAL  76 -28.843   7.450  -2.009
    9   HG23  VAL  76          HG23      VAL  76 -27.136   7.373  -1.573

  No H/Q in entry =           9
  In of MODEL   77
    1    H    GLU  77           H        GLU  77 -28.431   2.627  -1.631
    2    HA   GLU  77           HA       GLU  77 -29.184   1.842   1.033
    3    HB2  GLU  77           HB2      GLU  77 -30.786   0.184   0.525
    4    HB3  GLU  77           HB3      GLU  77 -31.353   1.702  -0.175
    5    HG2  GLU  77           HG2      GLU  77 -30.763   0.942  -2.367
    6    HG3  GLU  77           HG3      GLU  77 -30.105  -0.549  -1.698

  No H/Q in entry =           6
  In of MODEL   77
    1    H    VAL  78           H        VAL  78 -28.837  -0.240   1.695
    2    HA   VAL  78           HA       VAL  78 -26.176  -0.998   0.780
    3    HB   VAL  78           HB       VAL  78 -27.853  -1.886   3.166
    4   HG11  VAL  78          HG11      VAL  78 -25.518  -3.104   2.020
    5   HG13  VAL  78          HG12      VAL  78 -26.407  -3.576   3.469
    6   HG12  VAL  78          HG13      VAL  78 -25.093  -2.406   3.582
    7   HG22  VAL  78          HG21      VAL  78 -26.388  -0.511   4.485
    8   HG21  VAL  78          HG22      VAL  78 -27.144   0.451   3.214
    9   HG23  VAL  78          HG23      VAL  78 -25.465  -0.067   3.049

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ILE  79           H        ILE  79 -25.636  -2.905  -0.126
    2    HA   ILE  79           HA       ILE  79 -27.702  -4.400  -1.447
    3    HB   ILE  79           HB       ILE  79 -24.706  -4.907  -1.257
    4   HG12  ILE  79          HG12      ILE  79 -26.374  -3.820  -3.530
    5   HG13  ILE  79          HG13      ILE  79 -25.494  -2.801  -2.389
    6   HG22  ILE  79          HG21      ILE  79 -25.825  -6.100  -3.560
    7   HG21  ILE  79          HG22      ILE  79 -26.792  -6.624  -2.181
    8   HG23  ILE  79          HG23      ILE  79 -25.049  -6.892  -2.189
    9   HD13  ILE  79          HD11      ILE  79 -24.099  -2.911  -4.223
   10   HD12  ILE  79          HD12      ILE  79 -24.431  -4.623  -4.495
   11   HD11  ILE  79          HD13      ILE  79 -23.435  -4.123  -3.127

  No H/Q in entry =          11
  In of MODEL   77
    1    H    ASP  80           H        ASP  80 -28.548  -6.327  -0.849
    2    HA   ASP  80           HA       ASP  80 -28.460  -7.219   1.799
    3    HB2  ASP  80           HB2      ASP  80 -30.228  -7.810   0.181
    4    HB3  ASP  80           HB3      ASP  80 -29.073  -8.813  -0.698

  No H/Q in entry =           4
  In of MODEL   77
    1    H    SER  81           H        SER  81 -26.905  -8.341   2.916
    2    HA   SER  81           HA       SER  81 -24.418  -9.011   1.700
    3    HB2  SER  81           HB2      SER  81 -23.773  -9.919   3.846
    4    HB3  SER  81           HB3      SER  81 -24.669  -8.426   4.120
    5    HG   SER  81           HG       SER  81 -26.538  -9.949   4.290

  No H/Q in entry =           5
  In of MODEL   77
    1    H    LEU  82           H        LEU  82 -27.111 -11.118   2.057
    2    HA   LEU  82           HA       LEU  82 -25.554 -13.478   1.527
    3    HB2  LEU  82           HB2      LEU  82 -28.496 -12.876   1.310
    4    HB3  LEU  82           HB3      LEU  82 -27.790 -14.475   1.080
    5    HG   LEU  82           HG       LEU  82 -27.698 -12.909   3.641
    6   HD11  LEU  82          HD11      LEU  82 -29.518 -15.082   2.609
    7   HD13  LEU  82          HD12      LEU  82 -29.960 -13.533   3.333
    8   HD12  LEU  82          HD13      LEU  82 -29.276 -14.813   4.336
    9   HD22  LEU  82          HD21      LEU  82 -25.846 -14.342   3.590
   10   HD21  LEU  82          HD22      LEU  82 -26.722 -15.590   2.705
   11   HD23  LEU  82          HD23      LEU  82 -27.079 -15.303   4.409

  No H/Q in entry =          11
  In of MODEL   77
    1    H    LEU  83           H        LEU  83 -27.548 -11.271  -0.378
    2    HA   LEU  83           HA       LEU  83 -27.364 -12.635  -2.847
    3    HB2  LEU  83           HB2      LEU  83 -27.785  -9.729  -2.203
    4    HB3  LEU  83           HB3      LEU  83 -27.830 -10.379  -3.842
    5    HG   LEU  83           HG       LEU  83 -29.839 -10.771  -1.642
    6   HD13  LEU  83          HD11      LEU  83 -30.618  -8.932  -2.704
    7   HD12  LEU  83          HD12      LEU  83 -31.088 -10.052  -3.981
    8   HD11  LEU  83          HD13      LEU  83 -29.560  -9.177  -4.092
    9   HD23  LEU  83          HD21      LEU  83 -29.999 -12.040  -4.361
   10   HD22  LEU  83          HD22      LEU  83 -30.951 -12.391  -2.920
   11   HD21  LEU  83          HD23      LEU  83 -29.261 -12.884  -3.002

  No H/Q in entry =          11
  In of MODEL   77
    1    H    TYR  84           H        TYR  84 -25.408 -10.233  -1.200
    2    HA   TYR  84           HA       TYR  84 -23.572  -9.741  -3.351
    3    HB2  TYR  84           HB2      TYR  84 -24.054  -8.221  -1.375
    4    HB3  TYR  84           HB3      TYR  84 -23.099  -9.334  -0.397
    5    HD1  TYR  84           HD1      TYR  84 -20.694  -9.875  -1.419
    6    HD2  TYR  84           HD2      TYR  84 -22.973  -6.362  -2.255
    7    HE1  TYR  84           HE1      TYR  84 -18.625  -8.712  -2.108
    8    HE2  TYR  84           HE2      TYR  84 -20.915  -5.191  -2.957
    9    HH   TYR  84           HH       TYR  84 -17.782  -6.900  -3.015

  No H/Q in entry =           9
  In of MODEL   77
    1    H    GLY  85           H        GLY  85 -23.288 -11.732  -0.401
    2    HA3  GLY  85           HA2      GLY  85 -20.709 -12.661  -0.908
    3    HA2  GLY  85           HA3      GLY  85 -21.924 -13.512   0.045

  No H/Q in entry =           3
  In of MODEL   77
    1    H    LYS  86           H        LYS  86 -23.791 -13.904  -1.995
    2    HA   LYS  86           HA       LYS  86 -22.736 -16.276  -3.257
    3    HB2  LYS  86           HB2      LYS  86 -24.992 -16.057  -2.246
    4    HB3  LYS  86           HB3      LYS  86 -25.401 -14.875  -3.489
    5    HG2  LYS  86           HG2      LYS  86 -25.246 -16.571  -5.185
    6    HG3  LYS  86           HG3      LYS  86 -24.764 -17.761  -3.975
    7    HD2  LYS  86           HD2      LYS  86 -26.869 -17.354  -2.757
    8    HD3  LYS  86           HD3      LYS  86 -27.353 -16.197  -3.995
    9    HE2  LYS  86           HE2      LYS  86 -26.800 -19.124  -4.462
   10    HE3  LYS  86           HE3      LYS  86 -28.399 -18.391  -4.335
   11    HZ3  LYS  86           HZ1      LYS  86 -28.277 -17.919  -6.483
   12    HZ2  LYS  86           HZ2      LYS  86 -26.689 -18.518  -6.576
   13    HZ1  LYS  86           HZ3      LYS  86 -26.960 -16.890  -6.178

  No H/Q in entry =          13
  In of MODEL   77
    1    H    VAL  87           H        VAL  87 -22.755 -13.063  -4.162
    2    HA   VAL  87           HA       VAL  87 -22.485 -11.895  -6.109
    3    HB   VAL  87           HB       VAL  87 -21.405 -14.423  -7.401
    4   HG11  VAL  87          HG11      VAL  87 -21.680 -12.155  -8.604
    5   HG13  VAL  87          HG12      VAL  87 -20.097 -12.930  -8.698
    6   HG12  VAL  87          HG13      VAL  87 -20.362 -11.595  -7.578
    7   HG21  VAL  87          HG21      VAL  87 -20.458 -14.203  -5.103
    8   HG23  VAL  87          HG22      VAL  87 -19.815 -12.633  -5.579
    9   HG22  VAL  87          HG23      VAL  87 -19.267 -14.095  -6.397

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ASP  88           H        ASP  88 -24.993 -12.552  -5.728
    2    HA   ASP  88           HA       ASP  88 -26.133 -13.784  -8.109
    3    HB2  ASP  88           HB2      ASP  88 -27.101 -14.027  -5.773
    4    HB3  ASP  88           HB3      ASP  88 -27.566 -12.330  -5.874

  No H/Q in entry =           4
  In of MODEL   77
    1    H    GLY  89           H        GLY  89 -25.455 -12.528  -9.762
    2    HA3  GLY  89           HA2      GLY  89 -25.657  -9.758  -9.971
    3    HA2  GLY  89           HA3      GLY  89 -25.640 -10.883 -11.328

  No H/Q in entry =           3
  In of MODEL   77
    1    H    LEU  90           H        LEU  90 -28.073 -12.249 -10.847
    2    HA   LEU  90           HA       LEU  90 -29.909 -10.331 -11.947
    3    HB2  LEU  90           HB2      LEU  90 -29.965 -12.729 -12.518
    4    HB3  LEU  90           HB3      LEU  90 -30.449 -13.093 -10.861
    5    HG   LEU  90           HG       LEU  90 -32.580 -11.992 -11.205
    6   HD13  LEU  90          HD11      LEU  90 -32.429 -10.254 -12.688
    7   HD12  LEU  90          HD12      LEU  90 -32.972 -11.500 -13.814
    8   HD11  LEU  90          HD13      LEU  90 -31.260 -11.094 -13.711
    9   HD23  LEU  90          HD21      LEU  90 -32.526 -13.631 -13.634
   10   HD22  LEU  90          HD22      LEU  90 -33.488 -13.796 -12.165
   11   HD21  LEU  90          HD23      LEU  90 -31.830 -14.397 -12.207

  No H/Q in entry =          11
  In of MODEL   77
    1    H    GLY  91           H        GLY  91 -29.695 -11.818  -8.759
    2    HA3  GLY  91           HA2      GLY  91 -32.029 -10.719  -7.697
    3    HA2  GLY  91           HA3      GLY  91 -30.623 -11.239  -6.769

  No H/Q in entry =           3
  In of MODEL   77
    1    H    VAL  92           H        VAL  92 -28.727  -9.401  -7.654
    2    HA   VAL  92           HA       VAL  92 -29.516  -7.100  -6.105
    3    HB   VAL  92           HB       VAL  92 -26.986  -7.557  -7.727
    4   HG12  VAL  92          HG11      VAL  92 -27.137  -5.665  -5.406
    5   HG11  VAL  92          HG12      VAL  92 -27.824  -5.131  -6.943
    6   HG13  VAL  92          HG13      VAL  92 -26.123  -5.587  -6.848
    7   HG22  VAL  92          HG21      VAL  92 -26.733  -9.138  -6.132
    8   HG21  VAL  92          HG22      VAL  92 -27.871  -8.361  -5.029
    9   HG23  VAL  92          HG23      VAL  92 -26.223  -7.749  -5.171

  No H/Q in entry =           9
  In of MODEL   77
    1    H    LEU  93           H        LEU  93 -29.145  -7.772  -9.526
    2    HA   LEU  93           HA       LEU  93 -29.520  -5.142 -10.462
    3    HB2  LEU  93           HB2      LEU  93 -28.882  -6.998 -11.924
    4    HB3  LEU  93           HB3      LEU  93 -30.465  -7.736 -11.680
    5    HG   LEU  93           HG       LEU  93 -31.504  -5.785 -12.800
    6   HD11  LEU  93          HD11      LEU  93 -29.658  -4.175 -12.323
    7   HD13  LEU  93          HD12      LEU  93 -30.118  -4.214 -14.027
    8   HD12  LEU  93          HD13      LEU  93 -28.654  -5.036 -13.489
    9   HD23  LEU  93          HD21      LEU  93 -30.487  -6.354 -15.097
   10   HD22  LEU  93          HD22      LEU  93 -31.310  -7.613 -14.176
   11   HD21  LEU  93          HD23      LEU  93 -29.546  -7.544 -14.200

  No H/Q in entry =          11
  In of MODEL   77
    1    H    LYS  94           H        LYS  94 -31.866  -7.703  -9.575
    2    HA   LYS  94           HA       LYS  94 -34.229  -6.280 -10.178
    3    HB2  LYS  94           HB2      LYS  94 -33.675  -8.454  -8.164
    4    HB3  LYS  94           HB3      LYS  94 -35.280  -7.771  -8.416
    5    HG2  LYS  94           HG2      LYS  94 -35.216  -8.554 -10.747
    6    HG3  LYS  94           HG3      LYS  94 -33.646  -9.293 -10.435
    7    HD2  LYS  94           HD2      LYS  94 -34.734 -10.628  -8.592
    8    HD3  LYS  94           HD3      LYS  94 -36.289  -9.994  -9.132
    9    HE2  LYS  94           HE2      LYS  94 -35.794 -10.927 -11.401
   10    HE3  LYS  94           HE3      LYS  94 -34.365 -11.698 -10.711
   11    HZ3  LYS  94           HZ1      LYS  94 -36.205 -13.234 -10.854
   12    HZ2  LYS  94           HZ2      LYS  94 -37.176 -12.211  -9.904
   13    HZ1  LYS  94           HZ3      LYS  94 -35.802 -12.946  -9.230

  No H/Q in entry =          13
  In of MODEL   77
    1    H    ALA  95           H        ALA  95 -32.368  -6.376  -7.151
    2    HA   ALA  95           HA       ALA  95 -34.211  -4.804  -5.655
    3    HB2  ALA  95           HB1      ALA  95 -31.820  -6.160  -5.142
    4    HB3  ALA  95           HB2      ALA  95 -32.791  -5.257  -3.980
    5    HB1  ALA  95           HB3      ALA  95 -31.459  -4.463  -4.820

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ALA  96           H        ALA  96 -31.601  -3.939  -7.787
    2    HA   ALA  96           HA       ALA  96 -31.514  -1.174  -7.024
    3    HB2  ALA  96           HB1      ALA  96 -30.180  -0.947  -9.150
    4    HB3  ALA  96           HB2      ALA  96 -30.475  -2.657  -9.460
    5    HB1  ALA  96           HB3      ALA  96 -29.546  -2.165  -8.044

  No H/Q in entry =           5
  In of MODEL   77
    1    H    VAL  97           H        VAL  97 -33.066  -2.909  -9.686
    2    HA   VAL  97           HA       VAL  97 -34.166  -0.621 -10.938
    3    HB   VAL  97           HB       VAL  97 -34.957  -3.552 -10.960
    4   HG11  VAL  97          HG11      VAL  97 -36.768  -1.558 -11.432
    5   HG13  VAL  97          HG12      VAL  97 -36.826  -3.154 -12.181
    6   HG12  VAL  97          HG13      VAL  97 -36.091  -1.802 -13.042
    7   HG21  VAL  97          HG21      VAL  97 -33.714  -1.723 -13.016
    8   HG23  VAL  97          HG22      VAL  97 -34.160  -3.406 -13.294
    9   HG22  VAL  97          HG23      VAL  97 -32.899  -3.008 -12.125

  No H/Q in entry =           9
  In of MODEL   77
    1    H    ALA  98           H        ALA  98 -35.305  -2.798  -8.379
    2    HA   ALA  98           HA       ALA  98 -37.868  -1.662  -8.001
    3    HB1  ALA  98           HB1      ALA  98 -36.830  -3.852  -6.974
    4    HB3  ALA  98           HB2      ALA  98 -38.004  -2.931  -6.031
    5    HB2  ALA  98           HB3      ALA  98 -36.281  -2.771  -5.692

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ALA  99           H        ALA  99 -34.774  -0.841  -6.394
    2    HA   ALA  99           HA       ALA  99 -35.894   1.142  -4.726
    3    HB1  ALA  99           HB1      ALA  99 -33.251   0.263  -5.501
    4    HB2  ALA  99           HB2      ALA  99 -33.786   1.015  -3.999
    5    HB3  ALA  99           HB3      ALA  99 -33.333   2.021  -5.374

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ILE 100           H        ILE 100 -34.894   1.267  -8.093
    2    HA   ILE 100           HA       ILE 100 -35.090   4.114  -8.319
    3    HB   ILE 100           HB       ILE 100 -35.201   1.952 -10.451
    4   HG12  ILE 100          HG12      ILE 100 -33.038   3.956  -9.811
    5   HG13  ILE 100          HG13      ILE 100 -33.059   2.311  -9.176
    6   HG21  ILE 100          HG21      ILE 100 -35.638   4.870 -10.585
    7   HG23  ILE 100          HG22      ILE 100 -36.151   3.595 -11.690
    8   HG22  ILE 100          HG23      ILE 100 -34.503   4.218 -11.767
    9   HD12  ILE 100          HD11      ILE 100 -32.565   3.263 -11.958
   10   HD11  ILE 100          HD12      ILE 100 -33.214   1.645 -11.691
   11   HD13  ILE 100          HD13      ILE 100 -31.662   2.098 -10.991

  No H/Q in entry =          11
  In of MODEL   77
    1    H    LYS 101           H        LYS 101 -37.380   1.492  -9.010
    2    HA   LYS 101           HA       LYS 101 -39.481   3.130  -9.989
    3    HB2  LYS 101           HB2      LYS 101 -39.338   0.359  -8.855
    4    HB3  LYS 101           HB3      LYS 101 -40.898   1.113  -9.184
    5    HG2  LYS 101           HG2      LYS 101 -40.452   1.243 -11.488
    6    HG3  LYS 101           HG3      LYS 101 -38.752   0.846 -11.253
    7    HD2  LYS 101           HD2      LYS 101 -40.003  -1.070 -12.118
    8    HD3  LYS 101           HD3      LYS 101 -39.355  -1.393 -10.509
    9    HE2  LYS 101           HE2      LYS 101 -41.409  -2.096  -9.977
   10    HE3  LYS 101           HE3      LYS 101 -41.874  -0.394  -9.979
   11    HZ3  LYS 101           HZ1      LYS 101 -42.789  -0.560 -12.085
   12    HZ2  LYS 101           HZ2      LYS 101 -43.236  -2.033 -11.369
   13    HZ1  LYS 101           HZ3      LYS 101 -41.942  -1.982 -12.467

  No H/Q in entry =          13
  In of MODEL   77
    1    H    LYS 102           H        LYS 102 -38.944   1.663  -6.783
    2    HA   LYS 102           HA       LYS 102 -41.182   2.852  -5.561
    3    HB2  LYS 102           HB2      LYS 102 -39.926   0.993  -4.557
    4    HB3  LYS 102           HB3      LYS 102 -38.537   2.055  -4.332
    5    HG2  LYS 102           HG2      LYS 102 -39.841   3.448  -2.823
    6    HG3  LYS 102           HG3      LYS 102 -41.234   2.390  -3.049
    7    HD2  LYS 102           HD2      LYS 102 -39.988   0.532  -2.034
    8    HD3  LYS 102           HD3      LYS 102 -38.597   1.591  -1.805
    9    HE2  LYS 102           HE2      LYS 102 -39.939   3.067  -0.385
   10    HE3  LYS 102           HE3      LYS 102 -41.350   2.038  -0.633
   11    HZ1  LYS 102           HZ1      LYS 102 -39.610   0.293   0.354
   12    HZ3  LYS 102           HZ2      LYS 102 -40.713   1.176   1.295
   13    HZ2  LYS 102           HZ3      LYS 102 -39.106   1.707   1.148

  No H/Q in entry =          13
  In of MODEL   77
    1    H    ALA 103           H        ALA 103 -38.246   4.253  -6.612
    2    HA   ALA 103           HA       ALA 103 -38.458   6.571  -4.833
    3    HB2  ALA 103           HB1      ALA 103 -36.489   7.310  -6.434
    4    HB3  ALA 103           HB2      ALA 103 -36.451   5.592  -6.828
    5    HB1  ALA 103           HB3      ALA 103 -36.206   6.120  -5.164

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ALA 104           H        ALA 104 -39.115   5.829  -8.170
    2    HA   ALA 104           HA       ALA 104 -39.720   8.610  -8.792
    3    HB2  ALA 104           HB1      ALA 104 -39.785   7.937 -10.992
    4    HB1  ALA 104           HB2      ALA 104 -40.501   6.373 -10.602
    5    HB3  ALA 104           HB3      ALA 104 -38.776   6.644 -10.344

  No H/Q in entry =           5
  In of MODEL   77
    1    H    ALA 105           H        ALA 105 -41.297   6.502  -6.964
    2    HA   ALA 105           HA       ALA 105 -43.727   7.886  -6.912
    3    HB2  ALA 105           HB1      ALA 105 -44.492   7.018  -8.940
    4    HB3  ALA 105           HB2      ALA 105 -45.110   5.830  -7.794
    5    HB1  ALA 105           HB3      ALA 105 -43.649   5.485  -8.718

  No H/Q in entry =           5
  In of MODEL   78
    1    H1   ALA   1           H3       ALA   1 -12.545 -15.272  -2.400
    2    H2   ALA   1           H2       ALA   1 -11.626 -16.433  -3.240
    3    H3   ALA   1           H1       ALA   1 -12.749 -15.464  -4.075
    4    HA   ALA   1           HA       ALA   1 -14.184 -17.135  -3.837
    5    HB3  ALA   1           HB1      ALA   1 -12.826 -18.936  -3.375
    6    HB1  ALA   1           HB2      ALA   1 -13.581 -18.808  -1.787
    7    HB2  ALA   1           HB3      ALA   1 -11.990 -18.101  -2.065

  No H/Q in entry =           7
  In of MODEL   78
    1    H    GLU   2           H        GLU   2 -15.826 -17.956  -2.186
    2    HA   GLU   2           HA       GLU   2 -17.439 -16.201  -1.128
    3    HB2  GLU   2           HB2      GLU   2 -16.553 -18.647   0.417
    4    HB3  GLU   2           HB3      GLU   2 -18.059 -17.765   0.669
    5    HG2  GLU   2           HG2      GLU   2 -19.059 -18.829  -1.067
    6    HG3  GLU   2           HG3      GLU   2 -17.727 -18.456  -2.150

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLU   3           H        GLU   3 -15.559 -17.596   1.497
    2    HA   GLU   3           HA       GLU   3 -15.732 -15.239   3.055
    3    HB2  GLU   3           HB2      GLU   3 -14.201 -17.819   3.306
    4    HB3  GLU   3           HB3      GLU   3 -13.943 -16.506   4.454
    5    HG2  GLU   3           HG2      GLU   3 -16.141 -16.611   5.270
    6    HG3  GLU   3           HG3      GLU   3 -16.751 -17.397   3.820

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LEU   4           H        LEU   4 -12.808 -16.780   1.667
    2    HA   LEU   4           HA       LEU   4 -10.934 -14.916   2.269
    3    HB2  LEU   4           HB2      LEU   4 -11.189 -16.207  -0.457
    4    HB3  LEU   4           HB3      LEU   4  -9.723 -15.518   0.230
    5    HG   LEU   4           HG       LEU   4 -11.269 -17.884   1.339
    6   HD13  LEU   4          HD11      LEU   4  -9.664 -19.273   0.411
    7   HD12  LEU   4          HD12      LEU   4  -8.428 -18.016   0.387
    8   HD11  LEU   4          HD13      LEU   4  -9.715 -18.010  -0.817
    9   HD23  LEU   4          HD21      LEU   4  -9.021 -17.996   2.724
   10   HD22  LEU   4          HD22      LEU   4 -10.321 -16.929   3.252
   11   HD21  LEU   4          HD23      LEU   4  -8.943 -16.269   2.372

  No H/Q in entry =          11
  In of MODEL   78
    1    H    GLU   5           H        GLU   5 -13.260 -14.658  -0.408
    2    HA   GLU   5           HA       GLU   5 -12.203 -12.196  -1.406
    3    HB2  GLU   5           HB2      GLU   5 -13.600 -13.782  -2.747
    4    HB3  GLU   5           HB3      GLU   5 -14.989 -13.320  -1.764
    5    HG2  GLU   5           HG2      GLU   5 -15.045 -11.974  -3.763
    6    HG3  GLU   5           HG3      GLU   5 -14.562 -10.927  -2.428

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLU   6           H        GLU   6 -14.949 -13.017   0.682
    2    HA   GLU   6           HA       GLU   6 -15.797 -10.322   1.081
    3    HB2  GLU   6           HB2      GLU   6 -16.271 -12.856   2.665
    4    HB3  GLU   6           HB3      GLU   6 -17.032 -11.311   3.042
    5    HG2  GLU   6           HG2      GLU   6 -18.066 -11.240   0.831
    6    HG3  GLU   6           HG3      GLU   6 -17.243 -12.728   0.371

  No H/Q in entry =           6
  In of MODEL   78
    1    H    VAL   7           H        VAL   7 -13.537 -12.482   2.655
    2    HA   VAL   7           HA       VAL   7 -13.041 -10.919   4.984
    3    HB   VAL   7           HB       VAL   7 -11.379 -12.998   3.535
    4   HG11  VAL   7          HG11      VAL   7 -10.882 -11.477   6.101
    5   HG13  VAL   7          HG12      VAL   7  -9.785 -11.714   4.742
    6   HG12  VAL   7          HG13      VAL   7 -10.168 -13.063   5.810
    7   HG21  VAL   7          HG21      VAL   7 -13.643 -13.514   4.752
    8   HG23  VAL   7          HG22      VAL   7 -12.713 -13.261   6.229
    9   HG22  VAL   7          HG23      VAL   7 -12.245 -14.530   5.099

  No H/Q in entry =           9
  In of MODEL   78
    1    H    VAL   8           H        VAL   8 -11.527 -11.064   1.776
    2    HA   VAL   8           HA       VAL   8  -9.426  -9.236   2.273
    3    HB   VAL   8           HB       VAL   8 -10.900  -9.886  -0.291
    4   HG11  VAL   8          HG11      VAL   8  -8.539  -8.116   0.308
    5   HG13  VAL   8          HG12      VAL   8  -9.905  -7.817  -0.768
    6   HG12  VAL   8          HG13      VAL   8  -8.643  -8.956  -1.242
    7   HG23  VAL   8          HG21      VAL   8  -8.081 -10.737   0.142
    8   HG22  VAL   8          HG22      VAL   8  -9.433 -11.636  -0.540
    9   HG21  VAL   8          HG23      VAL   8  -9.253 -11.516   1.207

  No H/Q in entry =           9
  In of MODEL   78
    1    H    MET   9           H        MET   9 -12.760  -8.774   1.108
    2    HA   MET   9           HA       MET   9 -12.637  -5.999   0.675
    3    HB2  MET   9           HB2      MET   9 -14.888  -7.834   1.490
    4    HB3  MET   9           HB3      MET   9 -15.136  -6.097   1.293
    5    HG2  MET   9           HG2      MET   9 -14.269  -6.243  -1.020
    6    HG3  MET   9           HG3      MET   9 -14.056  -7.983  -0.821
    7    HE3  MET   9           HE1      MET   9 -17.923  -5.560  -0.991
    8    HE2  MET   9           HE2      MET   9 -16.573  -5.283  -2.088
    9    HE1  MET   9           HE3      MET   9 -16.346  -5.073  -0.355

  No H/Q in entry =           9
  In of MODEL   78
    1    H    GLY  10           H        GLY  10 -13.344  -7.877   3.600
    2    HA3  GLY  10           HA2      GLY  10 -13.849  -5.682   5.319
    3    HA2  GLY  10           HA3      GLY  10 -13.319  -7.283   5.833

  No H/Q in entry =           3
  In of MODEL   78
    1    H    LEU  11           H        LEU  11 -10.875  -7.458   4.522
    2    HA   LEU  11           HA       LEU  11  -9.147  -6.062   6.282
    3    HB2  LEU  11           HB2      LEU  11  -8.626  -7.495   3.675
    4    HB3  LEU  11           HB3      LEU  11  -7.343  -6.818   4.675
    5    HG   LEU  11           HG       LEU  11  -9.389  -8.809   5.688
    6   HD13  LEU  11          HD11      LEU  11  -8.191 -10.070   4.125
    7   HD12  LEU  11          HD12      LEU  11  -7.263 -10.329   5.601
    8   HD11  LEU  11          HD13      LEU  11  -6.697  -9.175   4.395
    9   HD22  LEU  11          HD21      LEU  11  -8.518  -7.815   7.606
   10   HD21  LEU  11          HD22      LEU  11  -6.971  -7.445   6.846
   11   HD23  LEU  11          HD23      LEU  11  -7.332  -9.095   7.354

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  12           H        ILE  12 -10.032  -5.494   2.891
    2    HA   ILE  12           HA       ILE  12  -8.294  -3.300   2.468
    3    HB   ILE  12           HB       ILE  12 -10.959  -3.914   1.168
    4   HG12  ILE  12          HG12      ILE  12  -8.960  -5.610   1.096
    5   HG13  ILE  12          HG13      ILE  12  -9.809  -5.233  -0.388
    6   HG23  ILE  12          HG21      ILE  12 -10.388  -1.623   0.686
    7   HG22  ILE  12          HG22      ILE  12  -9.932  -2.554  -0.735
    8   HG21  ILE  12          HG23      ILE  12  -8.726  -2.050   0.413
    9   HD13  ILE  12          HD11      ILE  12  -8.049  -3.721  -1.058
   10   HD12  ILE  12          HD12      ILE  12  -7.298  -5.240  -0.570
   11   HD11  ILE  12          HD13      ILE  12  -7.268  -3.862   0.506

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  13           H        ILE  13 -11.661  -3.498   3.556
    2    HA   ILE  13           HA       ILE  13 -12.064  -0.703   3.826
    3    HB   ILE  13           HB       ILE  13 -13.321  -3.104   5.174
    4   HG12  ILE  13          HG12      ILE  13 -13.540  -2.530   2.644
    5   HG13  ILE  13          HG13      ILE  13 -14.976  -2.961   3.548
    6   HG22  ILE  13          HG21      ILE  13 -15.186  -1.392   5.722
    7   HG21  ILE  13          HG22      ILE  13 -13.949  -0.161   5.499
    8   HG23  ILE  13          HG23      ILE  13 -13.755  -1.389   6.748
    9   HD13  ILE  13          HD11      ILE  13 -15.608  -0.630   3.790
   10   HD12  ILE  13          HD12      ILE  13 -15.278  -0.960   2.101
   11   HD11  ILE  13          HD13      ILE  13 -14.081  -0.119   3.060

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ASN  14           H        ASN  14 -11.008  -3.216   6.101
    2    HA   ASN  14           HA       ASN  14 -10.778  -1.583   8.388
    3    HB2  ASN  14           HB2      ASN  14 -10.576  -4.195   8.065
    4    HB3  ASN  14           HB3      ASN  14  -8.860  -3.842   7.911
    5   HD21  ASN  14          HD21      ASN  14  -9.530  -5.354  10.086
    6   HD22  ASN  14          HD22      ASN  14  -9.487  -4.435  11.510

  No H/Q in entry =           6
  In of MODEL   78
    1    H    SER  15           H        SER  15  -8.388  -2.453   5.900
    2    HA   SER  15           HA       SER  15  -6.218  -1.003   6.976
    3    HB2  SER  15           HB2      SER  15  -5.198  -1.237   4.819
    4    HB3  SER  15           HB3      SER  15  -6.181  -2.679   5.043
    5    HG   SER  15           HG       SER  15  -6.481  -0.569   3.294

  No H/Q in entry =           5
  In of MODEL   78
    1    H    GLY  16           H        GLY  16  -8.798  -0.085   4.725
    2    HA3  GLY  16           HA2      GLY  16  -7.888   2.539   4.176
    3    HA2  GLY  16           HA3      GLY  16  -9.550   1.976   4.011

  No H/Q in entry =           3
  In of MODEL   78
    1    H    GLN  17           H        GLN  17 -10.111   1.261   6.659
    2    HA   GLN  17           HA       GLN  17 -10.773   3.778   7.800
    3    HB2  GLN  17           HB2      GLN  17 -10.730   0.993   8.975
    4    HB3  GLN  17           HB3      GLN  17 -11.325   2.403   9.851
    5    HG2  GLN  17           HG2      GLN  17 -12.370   1.487   7.155
    6    HG3  GLN  17           HG3      GLN  17 -13.150   1.146   8.699
    7   HE21  GLN  17          HE21      GLN  17 -13.486   3.161   6.147
    8   HE22  GLN  17          HE22      GLN  17 -14.066   4.550   6.931

  No H/Q in entry =           8
  In of MODEL   78
    1    H    ALA  18           H        ALA  18  -8.188   1.447   8.423
    2    HA   ALA  18           HA       ALA  18  -7.072   2.642  10.696
    3    HB2  ALA  18           HB1      ALA  18  -6.501   0.415   9.329
    4    HB3  ALA  18           HB2      ALA  18  -5.326   1.176  10.402
    5    HB1  ALA  18           HB3      ALA  18  -5.240   1.454   8.661

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ARG  19           H        ARG  19  -6.285   3.152   7.249
    2    HA   ARG  19           HA       ARG  19  -4.350   5.164   7.681
    3    HB2  ARG  19           HB2      ARG  19  -4.694   4.030   5.485
    4    HB3  ARG  19           HB3      ARG  19  -6.221   4.899   5.305
    5    HG2  ARG  19           HG2      ARG  19  -5.053   7.049   5.376
    6    HG3  ARG  19           HG3      ARG  19  -3.519   6.236   5.683
    7    HD2  ARG  19           HD2      ARG  19  -3.629   6.828   3.340
    8    HD3  ARG  19           HD3      ARG  19  -3.746   5.070   3.485
    9    HE   ARG  19           HE       ARG  19  -6.363   6.027   3.473
   10   HH21  ARG  19          HH11      ARG  19  -7.551   6.205   1.552
   11   HH22  ARG  19          HH12      ARG  19  -6.726   6.268   0.034
   12   HH11  ARG  19          HH21      ARG  19  -3.583   6.040   1.444
   13   HH12  ARG  19          HH22      ARG  19  -4.477   6.172  -0.027

  No H/Q in entry =          13
  In of MODEL   78
    1    H    SER  20           H        SER  20  -7.845   5.342   7.075
    2    HA   SER  20           HA       SER  20  -8.152   8.104   7.026
    3    HB2  SER  20           HB2      SER  20 -10.053   6.798   6.486
    4    HB3  SER  20           HB3      SER  20  -9.963   5.902   8.001
    5    HG   SER  20           HG       SER  20 -10.269   8.697   8.013

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LEU  21           H        LEU  21  -8.197   5.921   9.830
    2    HA   LEU  21           HA       LEU  21  -8.605   7.924  11.794
    3    HB2  LEU  21           HB2      LEU  21  -7.299   5.201  11.959
    4    HB3  LEU  21           HB3      LEU  21  -7.599   6.222  13.361
    5    HG   LEU  21           HG       LEU  21  -9.769   5.351  11.430
    6   HD13  LEU  21          HD11      LEU  21  -8.955   3.349  12.461
    7   HD12  LEU  21          HD12      LEU  21 -10.410   3.803  13.347
    8   HD11  LEU  21          HD13      LEU  21  -8.819   4.137  14.034
    9   HD21  LEU  21          HD21      LEU  21  -9.687   6.904  14.003
   10   HD23  LEU  21          HD22      LEU  21 -11.097   5.897  13.688
   11   HD22  LEU  21          HD23      LEU  21 -10.677   7.189  12.574

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ALA  22           H        ALA  22  -5.675   6.500  10.393
    2    HA   ALA  22           HA       ALA  22  -3.776   7.780  12.018
    3    HB2  ALA  22           HB1      ALA  22  -3.389   5.920  10.328
    4    HB1  ALA  22           HB2      ALA  22  -2.170   7.195  10.365
    5    HB3  ALA  22           HB3      ALA  22  -3.386   7.172   9.087

  No H/Q in entry =           5
  In of MODEL   78
    1    H    TYR  23           H        TYR  23  -5.069   8.820   8.833
    2    HA   TYR  23           HA       TYR  23  -3.689  11.293   8.766
    3    HB2  TYR  23           HB2      TYR  23  -4.782  10.399   6.772
    4    HB3  TYR  23           HB3      TYR  23  -6.360  10.535   7.550
    5    HD1  TYR  23           HD1      TYR  23  -3.424  12.518   6.384
    6    HD2  TYR  23           HD2      TYR  23  -7.558  12.575   7.547
    7    HE1  TYR  23           HE1      TYR  23  -3.604  14.871   5.623
    8    HE2  TYR  23           HE2      TYR  23  -7.739  14.927   6.784
    9    HH   TYR  23           HH       TYR  23  -6.443  16.798   6.273

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ALA  24           H        ALA  24  -6.828  10.369  10.139
    2    HA   ALA  24           HA       ALA  24  -7.622  12.973  10.908
    3    HB1  ALA  24           HB1      ALA  24  -9.463  11.753  11.372
    4    HB2  ALA  24           HB2      ALA  24  -8.650  11.168  12.821
    5    HB3  ALA  24           HB3      ALA  24  -8.537  10.254  11.318

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ALA  25           H        ALA  25  -5.666  10.481  12.486
    2    HA   ALA  25           HA       ALA  25  -5.312  11.727  14.989
    3    HB2  ALA  25           HB1      ALA  25  -4.584   9.362  14.170
    4    HB3  ALA  25           HB2      ALA  25  -3.556  10.203  15.333
    5    HB1  ALA  25           HB3      ALA  25  -3.117  10.178  13.625

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LEU  26           H        LEU  26  -3.510  11.995  11.953
    2    HA   LEU  26           HA       LEU  26  -1.522  13.781  12.873
    3    HB2  LEU  26           HB2      LEU  26  -1.236  12.624  10.770
    4    HB3  LEU  26           HB3      LEU  26  -2.695  13.358  10.112
    5    HG   LEU  26           HG       LEU  26  -1.642  15.590  10.250
    6   HD12  LEU  26          HD11      LEU  26   0.896  15.566  10.670
    7   HD11  LEU  26          HD12      LEU  26   0.643  13.989  11.413
    8   HD13  LEU  26          HD13      LEU  26  -0.141  15.418  12.088
    9   HD21  LEU  26          HD21      LEU  26   0.068  13.506   8.859
   10   HD23  LEU  26          HD22      LEU  26   0.056  15.227   8.488
   11   HD22  LEU  26          HD23      LEU  26  -1.384  14.255   8.197

  No H/Q in entry =          11
  In of MODEL   78
    1    H    LYS  27           H        LYS  27  -4.692  14.319  11.389
    2    HA   LYS  27           HA       LYS  27  -4.587  17.106  11.191
    3    HB2  LYS  27           HB2      LYS  27  -6.355  15.660  10.202
    4    HB3  LYS  27           HB3      LYS  27  -7.019  15.415  11.816
    5    HG2  LYS  27           HG2      LYS  27  -7.407  17.828  12.051
    6    HG3  LYS  27           HG3      LYS  27  -6.690  18.113  10.462
    7    HD2  LYS  27           HD2      LYS  27  -8.446  16.709   9.422
    8    HD3  LYS  27           HD3      LYS  27  -9.168  16.442  11.010
    9    HE2  LYS  27           HE2      LYS  27  -9.568  18.861  11.253
   10    HE3  LYS  27           HE3      LYS  27  -8.818  19.149   9.679
   11    HZ3  LYS  27           HZ1      LYS  27 -11.196  19.066   9.432
   12    HZ2  LYS  27           HZ2      LYS  27 -11.273  17.551  10.202
   13    HZ1  LYS  27           HZ3      LYS  27 -10.522  17.701   8.682

  No H/Q in entry =          13
  In of MODEL   78
    1    H    GLN  28           H        GLN  28  -5.519  15.036  13.916
    2    HA   GLN  28           HA       GLN  28  -6.382  17.056  15.691
    3    HB2  GLN  28           HB2      GLN  28  -5.030  14.399  16.234
    4    HB3  GLN  28           HB3      GLN  28  -5.752  15.417  17.482
    5    HG2  GLN  28           HG2      GLN  28  -7.230  14.315  15.075
    6    HG3  GLN  28           HG3      GLN  28  -7.310  13.644  16.703
    7   HE21  GLN  28          HE21      GLN  28  -9.108  15.498  14.696
    8   HE22  GLN  28          HE22      GLN  28  -9.849  16.531  15.819

  No H/Q in entry =           8
  In of MODEL   78
    1    H    ALA  29           H        ALA  29  -3.186  15.700  15.008
    2    HA   ALA  29           HA       ALA  29  -1.726  17.071  16.989
    3    HB1  ALA  29           HB1      ALA  29   0.194  16.344  15.874
    4    HB3  ALA  29           HB2      ALA  29  -0.555  16.483  14.283
    5    HB2  ALA  29           HB3      ALA  29  -1.004  15.158  15.357

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LYS  30           H        LYS  30  -2.560  17.967  13.658
    2    HA   LYS  30           HA       LYS  30  -1.102  20.379  13.561
    3    HB2  LYS  30           HB2      LYS  30  -3.647  19.556  12.147
    4    HB3  LYS  30           HB3      LYS  30  -2.782  21.054  11.805
    5    HG2  LYS  30           HG2      LYS  30  -0.738  19.719  11.295
    6    HG3  LYS  30           HG3      LYS  30  -1.675  18.242  11.538
    7    HD2  LYS  30           HD2      LYS  30  -3.222  18.914   9.741
    8    HD3  LYS  30           HD3      LYS  30  -2.308  20.404   9.500
    9    HE2  LYS  30           HE2      LYS  30  -0.301  19.069   8.924
   10    HE3  LYS  30           HE3      LYS  30  -1.234  17.585   9.134
   11    HZ2  LYS  30           HZ1      LYS  30  -1.036  18.453   6.792
   12    HZ1  LYS  30           HZ2      LYS  30  -2.054  19.737   7.259
   13    HZ3  LYS  30           HZ3      LYS  30  -2.612  18.131   7.329

  No H/Q in entry =          13
  In of MODEL   78
    1    H    GLN  31           H        GLN  31  -4.222  19.591  14.967
    2    HA   GLN  31           HA       GLN  31  -4.927  22.363  15.419
    3    HB2  GLN  31           HB2      GLN  31  -6.161  19.943  16.738
    4    HB3  GLN  31           HB3      GLN  31  -6.887  21.530  16.492
    5    HG2  GLN  31           HG2      GLN  31  -6.188  20.739  13.903
    6    HG3  GLN  31           HG3      GLN  31  -6.747  19.246  14.649
    7   HE21  GLN  31          HE21      GLN  31  -8.119  20.850  12.545
    8   HE22  GLN  31          HE22      GLN  31  -9.625  21.274  13.200

  No H/Q in entry =           8
  In of MODEL   78
    1    H    GLY  32           H        GLY  32  -2.660  20.386  16.742
    2    HA3  GLY  32           HA2      GLY  32  -1.252  20.817  18.547
    3    HA2  GLY  32           HA3      GLY  32  -2.355  22.084  19.069

  No H/Q in entry =           3
  In of MODEL   78
    1    H    ASP  33           H        ASP  33  -3.843  19.077  18.403
    2    HA   ASP  33           HA       ASP  33  -4.268  18.627  21.282
    3    HB2  ASP  33           HB2      ASP  33  -5.692  17.648  18.802
    4    HB3  ASP  33           HB3      ASP  33  -6.053  17.044  20.417

  No H/Q in entry =           4
  In of MODEL   78
    1    H    PHE  34           H        PHE  34  -2.119  17.728  21.591
    2    HA   PHE  34           HA       PHE  34  -1.166  15.458  20.190
    3    HB2  PHE  34           HB2      PHE  34  -0.533  16.427  22.986
    4    HB3  PHE  34           HB3      PHE  34   0.370  15.185  22.120
    5    HD1  PHE  34           HD1      PHE  34   0.273  18.613  22.857
    6    HD2  PHE  34           HD2      PHE  34   1.048  15.894  19.622
    7    HE1  PHE  34           HE1      PHE  34   1.609  20.356  21.706
    8    HE2  PHE  34           HE2      PHE  34   2.379  17.640  18.476
    9    HZ   PHE  34           HZ       PHE  34   2.661  19.868  19.522

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ALA  35           H        ALA  35  -3.204  15.779  23.050
    2    HA   ALA  35           HA       ALA  35  -3.053  13.112  23.945
    3    HB3  ALA  35           HB1      ALA  35  -5.497  13.792  24.799
    4    HB1  ALA  35           HB2      ALA  35  -4.928  15.398  24.345
    5    HB2  ALA  35           HB3      ALA  35  -4.036  14.454  25.537

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ALA  36           H        ALA  36  -5.465  14.684  21.843
    2    HA   ALA  36           HA       ALA  36  -6.933  12.305  21.361
    3    HB1  ALA  36           HB1      ALA  36  -8.355  13.760  20.404
    4    HB3  ALA  36           HB2      ALA  36  -7.172  14.155  19.157
    5    HB2  ALA  36           HB3      ALA  36  -7.179  15.042  20.681

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ALA  37           H        ALA  37  -4.215  13.833  19.698
    2    HA   ALA  37           HA       ALA  37  -4.213  12.199  17.400
    3    HB3  ALA  37           HB1      ALA  37  -2.185  13.865  18.827
    4    HB2  ALA  37           HB2      ALA  37  -2.711  13.934  17.146
    5    HB1  ALA  37           HB3      ALA  37  -1.586  12.678  17.668

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LYS  38           H        LYS  38  -2.468  11.852  20.480
    2    HA   LYS  38           HA       LYS  38  -1.195   9.424  19.991
    3    HB2  LYS  38           HB2      LYS  38  -1.482  11.192  22.138
    4    HB3  LYS  38           HB3      LYS  38  -2.136   9.676  22.752
    5    HG2  LYS  38           HG2      LYS  38  -0.066   8.510  22.218
    6    HG3  LYS  38           HG3      LYS  38   0.576   9.942  21.406
    7    HD2  LYS  38           HD2      LYS  38   0.768  11.155  23.443
    8    HD3  LYS  38           HD3      LYS  38  -0.277  10.026  24.307
    9    HE2  LYS  38           HE2      LYS  38   2.069   9.658  24.930
   10    HE3  LYS  38           HE3      LYS  38   1.435   8.256  24.064
   11    HZ3  LYS  38           HZ1      LYS  38   2.748   8.647  22.285
   12    HZ2  LYS  38           HZ2      LYS  38   3.719   9.454  23.424
   13    HZ1  LYS  38           HZ3      LYS  38   2.660  10.338  22.431

  No H/Q in entry =          13
  In of MODEL   78
    1    H    ALA  39           H        ALA  39  -4.424   9.989  21.389
    2    HA   ALA  39           HA       ALA  39  -5.045   7.283  21.891
    3    HB3  ALA  39           HB1      ALA  39  -7.159   9.275  21.122
    4    HB2  ALA  39           HB2      ALA  39  -6.259   9.481  22.624
    5    HB1  ALA  39           HB3      ALA  39  -7.208   8.017  22.358

  No H/Q in entry =           5
  In of MODEL   78
    1    H    MET  40           H        MET  40  -5.581   9.310  19.045
    2    HA   MET  40           HA       MET  40  -7.097   7.412  17.580
    3    HB2  MET  40           HB2      MET  40  -5.433   9.772  16.680
    4    HB3  MET  40           HB3      MET  40  -6.478   8.837  15.608
    5    HG2  MET  40           HG2      MET  40  -7.489  10.106  18.165
    6    HG3  MET  40           HG3      MET  40  -7.526  10.943  16.615
    7    HE3  MET  40           HE1      MET  40 -10.141   9.382  14.546
    8    HE2  MET  40           HE2      MET  40  -8.386   9.461  14.400
    9    HE1  MET  40           HE3      MET  40  -9.275  10.846  15.033

  No H/Q in entry =           9
  In of MODEL   78
    1    H    MET  41           H        MET  41  -3.591   8.073  17.709
    2    HA   MET  41           HA       MET  41  -2.867   6.304  15.609
    3    HB2  MET  41           HB2      MET  41  -1.241   6.934  18.085
    4    HB3  MET  41           HB3      MET  41  -0.635   6.273  16.570
    5    HG2  MET  41           HG2      MET  41  -1.742   8.482  15.566
    6    HG3  MET  41           HG3      MET  41  -1.496   9.063  17.211
    7    HE2  MET  41           HE1      MET  41   1.375   6.902  17.576
    8    HE1  MET  41           HE2      MET  41   0.613   8.212  18.474
    9    HE3  MET  41           HE3      MET  41   2.243   8.420  17.834

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ASP  42           H        ASP  42  -3.268   5.836  19.094
    2    HA   ASP  42           HA       ASP  42  -2.288   3.221  19.254
    3    HB2  ASP  42           HB2      ASP  42  -3.127   4.997  21.076
    4    HB3  ASP  42           HB3      ASP  42  -4.576   4.003  21.000

  No H/Q in entry =           4
  In of MODEL   78
    1    H    GLN  43           H        GLN  43  -5.597   4.396  18.748
    2    HA   GLN  43           HA       GLN  43  -6.795   1.834  18.549
    3    HB2  GLN  43           HB2      GLN  43  -7.659   4.506  17.421
    4    HB3  GLN  43           HB3      GLN  43  -8.653   3.048  17.396
    5    HG2  GLN  43           HG2      GLN  43  -8.367   2.918  19.904
    6    HG3  GLN  43           HG3      GLN  43  -7.608   4.508  19.835
    7   HE21  GLN  43          HE21      GLN  43  -9.788   4.633  21.332
    8   HE22  GLN  43          HE22      GLN  43 -11.135   5.238  20.498

  No H/Q in entry =           8
  In of MODEL   78
    1    H    SER  44           H        SER  44  -5.403   4.021  16.142
    2    HA   SER  44           HA       SER  44  -6.132   2.554  13.850
    3    HB2  SER  44           HB2      SER  44  -4.826   4.910  14.298
    4    HB3  SER  44           HB3      SER  44  -3.492   3.885  13.770
    5    HG   SER  44           HG       SER  44  -4.580   4.882  12.006

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ARG  45           H        ARG  45  -3.261   2.378  15.936
    2    HA   ARG  45           HA       ARG  45  -1.820   0.394  14.554
    3    HB2  ARG  45           HB2      ARG  45  -0.952   1.795  16.426
    4    HB3  ARG  45           HB3      ARG  45  -1.965   0.885  17.544
    5    HG2  ARG  45           HG2      ARG  45  -0.776  -1.199  16.902
    6    HG3  ARG  45           HG3      ARG  45   0.261  -0.265  15.826
    7    HD2  ARG  45           HD2      ARG  45   1.022   1.098  17.784
    8    HD3  ARG  45           HD3      ARG  45   0.075   0.042  18.855
    9    HE   ARG  45           HE       ARG  45   1.742  -1.588  17.276
   10   HH21  ARG  45          HH11      ARG  45   3.623  -2.452  18.117
   11   HH22  ARG  45          HH12      ARG  45   4.410  -1.684  19.450
   12   HH11  ARG  45          HH21      ARG  45   2.094   0.869  19.669
   13   HH12  ARG  45          HH22      ARG  45   3.544   0.199  20.327

  No H/Q in entry =          13
  In of MODEL   78
    1    H    MET  46           H        MET  46  -4.229   0.122  17.150
    2    HA   MET  46           HA       MET  46  -4.122  -2.680  17.454
    3    HB2  MET  46           HB2      MET  46  -6.258  -0.634  18.047
    4    HB3  MET  46           HB3      MET  46  -6.486  -2.349  18.397
    5    HG2  MET  46           HG2      MET  46  -4.457  -2.348  19.789
    6    HG3  MET  46           HG3      MET  46  -4.196  -0.648  19.428
    7    HE3  MET  46           HE1      MET  46  -4.180  -1.350  22.384
    8    HE2  MET  46           HE2      MET  46  -5.247  -0.106  23.025
    9    HE1  MET  46           HE3      MET  46  -4.141   0.285  21.712

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ALA  47           H        ALA  47  -6.094  -0.618  15.358
    2    HA   ALA  47           HA       ALA  47  -7.753  -2.632  14.286
    3    HB3  ALA  47           HB1      ALA  47  -8.384  -0.380  13.871
    4    HB1  ALA  47           HB2      ALA  47  -7.905  -1.023  12.300
    5    HB2  ALA  47           HB3      ALA  47  -6.804   0.021  13.200

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LEU  48           H        LEU  48  -4.605  -1.392  13.243
    2    HA   LEU  48           HA       LEU  48  -4.354  -2.985  10.901
    3    HB2  LEU  48           HB2      LEU  48  -2.273  -1.755  12.715
    4    HB3  LEU  48           HB3      LEU  48  -1.917  -2.482  11.148
    5    HG   LEU  48           HG       LEU  48  -3.890  -0.220  11.536
    6   HD13  LEU  48          HD11      LEU  48  -1.751   0.608  12.207
    7   HD12  LEU  48          HD12      LEU  48  -2.010   1.169  10.555
    8   HD11  LEU  48          HD13      LEU  48  -0.944  -0.202  10.864
    9   HD22  LEU  48          HD21      LEU  48  -4.380  -1.192   9.458
   10   HD21  LEU  48          HD22      LEU  48  -2.706  -1.664   9.166
   11   HD23  LEU  48          HD23      LEU  48  -3.187   0.026   9.007

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ASN  49           H        ASN  49  -3.325  -3.409  14.249
    2    HA   ASN  49           HA       ASN  49  -1.774  -5.708  13.919
    3    HB2  ASN  49           HB2      ASN  49  -1.758  -4.391  15.969
    4    HB3  ASN  49           HB3      ASN  49  -3.437  -4.800  16.284
    5   HD21  ASN  49          HD21      ASN  49  -0.240  -6.366  15.843
    6   HD22  ASN  49          HD22      ASN  49  -0.555  -7.647  16.910

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLU  50           H        GLU  50  -5.236  -5.354  14.584
    2    HA   GLU  50           HA       GLU  50  -5.814  -8.140  14.688
    3    HB2  GLU  50           HB2      GLU  50  -7.362  -6.418  15.562
    4    HB3  GLU  50           HB3      GLU  50  -7.638  -5.845  13.916
    5    HG2  GLU  50           HG2      GLU  50  -8.553  -8.020  13.273
    6    HG3  GLU  50           HG3      GLU  50  -8.190  -8.674  14.867

  No H/Q in entry =           6
  In of MODEL   78
    1    H    ALA  51           H        ALA  51  -5.820  -5.738  12.095
    2    HA   ALA  51           HA       ALA  51  -6.841  -7.440  10.068
    3    HB3  ALA  51           HB1      ALA  51  -6.575  -5.632   8.702
    4    HB1  ALA  51           HB2      ALA  51  -4.929  -5.322   9.254
    5    HB2  ALA  51           HB3      ALA  51  -6.303  -4.779  10.220

  No H/Q in entry =           5
  In of MODEL   78
    1    H    HIS  52           H        HIS  52  -3.532  -6.613  11.061
    2    HA   HIS  52           HA       HIS  52  -2.165  -8.133   9.113
    3    HB2  HIS  52           HB2      HIS  52  -1.109  -6.420  10.577
    4    HB3  HIS  52           HB3      HIS  52  -1.278  -7.521  11.942
    5    HD1  HIS  52           HD1      HIS  52   0.197  -9.677  11.937
    6    HD2  HIS  52           HD2      HIS  52   0.946  -7.101   8.746
    7    HE1  HIS  52           HE1      HIS  52   2.368 -10.451  10.885
    8    HE2  HIS  52           HE2      HIS  52   2.838  -8.891   8.938

  No H/Q in entry =           8
  In of MODEL   78
    1    H    LEU  53           H        LEU  53  -3.405  -8.985  12.321
    2    HA   LEU  53           HA       LEU  53  -2.270 -11.558  12.514
    3    HB2  LEU  53           HB2      LEU  53  -4.731 -10.321  13.723
    4    HB3  LEU  53           HB3      LEU  53  -4.306 -12.005  14.017
    5    HG   LEU  53           HG       LEU  53  -2.359  -9.726  14.494
    6   HD12  LEU  53          HD11      LEU  53  -2.966 -10.081  16.930
    7   HD11  LEU  53          HD12      LEU  53  -4.352 -11.018  16.372
    8   HD13  LEU  53          HD13      LEU  53  -4.221  -9.312  15.963
    9   HD23  LEU  53          HD21      LEU  53  -1.509 -11.543  16.175
   10   HD22  LEU  53          HD22      LEU  53  -1.131 -11.738  14.468
   11   HD21  LEU  53          HD23      LEU  53  -2.429 -12.672  15.188

  No H/Q in entry =          11
  In of MODEL   78
    1    H    VAL  54           H        VAL  54  -5.352 -10.450  11.146
    2    HA   VAL  54           HA       VAL  54  -6.328 -13.020  10.454
    3    HB   VAL  54           HB       VAL  54  -6.904 -10.271   9.321
    4   HG12  VAL  54          HG11      VAL  54  -9.038 -11.595   8.503
    5   HG11  VAL  54          HG12      VAL  54  -7.960 -12.988   8.576
    6   HG13  VAL  54          HG13      VAL  54  -7.564 -11.621   7.536
    7   HG22  VAL  54          HG21      VAL  54  -7.817 -10.289  11.470
    8   HG21  VAL  54          HG22      VAL  54  -8.114 -12.025  11.448
    9   HG23  VAL  54          HG23      VAL  54  -9.166 -10.940  10.541

  No H/Q in entry =           9
  In of MODEL   78
    1    H    GLN  55           H        GLN  55  -4.391 -10.614   8.672
    2    HA   GLN  55           HA       GLN  55  -4.292 -12.078   6.253
    3    HB2  GLN  55           HB2      GLN  55  -3.631  -9.830   6.067
    4    HB3  GLN  55           HB3      GLN  55  -2.526  -9.936   7.435
    5    HG2  GLN  55           HG2      GLN  55  -0.827 -10.823   6.162
    6    HG3  GLN  55           HG3      GLN  55  -1.923 -11.769   5.164
    7   HE21  GLN  55          HE21      GLN  55  -1.917 -11.077   3.043
    8   HE22  GLN  55          HE22      GLN  55  -1.678  -9.477   2.536

  No H/Q in entry =           8
  In of MODEL   78
    1    H    THR  56           H        THR  56  -2.193 -12.114   9.139
    2    HA   THR  56           HA       THR  56  -0.154 -13.764   8.224
    3    HB   THR  56           HB       THR  56  -1.407 -13.989  10.969
    4    HG1  THR  56           HG1      THR  56  -0.419 -11.854   9.774
    5   HG22  THR  56          HG21      THR  56   0.931 -14.484  11.629
    6   HG21  THR  56          HG22      THR  56   1.414 -14.377   9.936
    7   HG23  THR  56          HG23      THR  56   0.317 -15.653  10.462

  No H/Q in entry =           7
  In of MODEL   78
    1    H    LYS  57           H        LYS  57  -3.303 -14.722   9.579
    2    HA   LYS  57           HA       LYS  57  -2.928 -17.528   9.331
    3    HB2  LYS  57           HB2      LYS  57  -4.721 -16.394  10.674
    4    HB3  LYS  57           HB3      LYS  57  -5.496 -15.920   9.171
    5    HG2  LYS  57           HG2      LYS  57  -5.805 -18.270   8.553
    6    HG3  LYS  57           HG3      LYS  57  -4.975 -18.783  10.020
    7    HD2  LYS  57           HD2      LYS  57  -6.734 -17.700  11.388
    8    HD3  LYS  57           HD3      LYS  57  -7.575 -17.216   9.916
    9    HE2  LYS  57           HE2      LYS  57  -7.859 -19.581   9.280
   10    HE3  LYS  57           HE3      LYS  57  -6.983 -20.096  10.719
   11    HZ1  LYS  57           HZ1      LYS  57  -9.020 -18.329  11.485
   12    HZ3  LYS  57           HZ2      LYS  57  -8.843 -19.974  11.871
   13    HZ2  LYS  57           HZ3      LYS  57  -9.695 -19.513  10.474

  No H/Q in entry =          13
  In of MODEL   78
    1    H    LEU  58           H        LEU  58  -4.191 -15.050   7.155
    2    HA   LEU  58           HA       LEU  58  -5.035 -16.851   5.144
    3    HB2  LEU  58           HB2      LEU  58  -4.352 -13.919   5.014
    4    HB3  LEU  58           HB3      LEU  58  -5.036 -14.837   3.671
    5    HG   LEU  58           HG       LEU  58  -6.318 -14.628   6.416
    6   HD11  LEU  58          HD11      LEU  58  -6.569 -12.971   3.925
    7   HD13  LEU  58          HD12      LEU  58  -6.550 -12.466   5.615
    8   HD12  LEU  58          HD13      LEU  58  -7.991 -13.221   4.938
    9   HD22  LEU  58          HD21      LEU  58  -7.327 -16.511   5.541
   10   HD21  LEU  58          HD22      LEU  58  -6.972 -16.066   3.872
   11   HD23  LEU  58          HD23      LEU  58  -8.318 -15.306   4.721

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  59           H        ILE  59  -1.871 -15.723   6.014
    2    HA   ILE  59           HA       ILE  59  -0.786 -16.475   3.380
    3    HB   ILE  59           HB       ILE  59   0.032 -14.431   4.947
    4   HG12  ILE  59          HG12      ILE  59   2.086 -16.142   3.532
    5   HG13  ILE  59          HG13      ILE  59   0.923 -15.170   2.668
    6   HG21  ILE  59          HG21      ILE  59   0.723 -16.235   6.710
    7   HG23  ILE  59          HG22      ILE  59   1.846 -14.939   6.363
    8   HG22  ILE  59          HG23      ILE  59   2.078 -16.533   5.647
    9   HD12  ILE  59          HD11      ILE  59   2.928 -14.150   4.680
   10   HD11  ILE  59          HD12      ILE  59   1.716 -13.152   3.881
   11   HD13  ILE  59          HD13      ILE  59   2.999 -13.907   2.936

  No H/Q in entry =          11
  In of MODEL   78
    1    H    GLU  60           H        GLU  60  -0.834 -17.584   6.746
    2    HA   GLU  60           HA       GLU  60   1.146 -19.614   6.485
    3    HB2  GLU  60           HB2      GLU  60   0.411 -18.824   8.675
    4    HB3  GLU  60           HB3      GLU  60  -1.221 -19.412   8.365
    5    HG2  GLU  60           HG2      GLU  60  -0.353 -21.726   8.208
    6    HG3  GLU  60           HG3      GLU  60   1.274 -21.131   8.534

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLY  61           H        GLY  61  -2.365 -19.620   5.989
    2    HA3  GLY  61           HA2      GLY  61  -2.186 -22.418   5.029
    3    HA2  GLY  61           HA3      GLY  61  -3.654 -21.644   5.619

  No H/Q in entry =           3
  In of MODEL   78
    1    H    ASP  62           H        ASP  62  -1.381 -20.116   3.426
    2    HA   ASP  62           HA       ASP  62  -3.427 -19.479   1.546
    3    HB2  ASP  62           HB2      ASP  62  -1.568 -18.516   0.243
    4    HB3  ASP  62           HB3      ASP  62  -1.503 -18.018   1.931

  No H/Q in entry =           4
  In of MODEL   78
    1    H    ALA  63           H        ALA  63  -3.828 -22.091   1.535
    2    HA   ALA  63           HA       ALA  63  -2.224 -23.704  -0.155
    3    HB2  ALA  63           HB1      ALA  63  -3.754 -24.884   1.145
    4    HB1  ALA  63           HB2      ALA  63  -4.446 -24.966  -0.475
    5    HB3  ALA  63           HB3      ALA  63  -5.096 -23.826   0.703

  No H/Q in entry =           5
  In of MODEL   78
    1    H    GLY  64           H        GLY  64  -4.905 -21.498  -0.770
    2    HA3  GLY  64           HA2      GLY  64  -5.643 -20.478  -2.691
    3    HA2  GLY  64           HA3      GLY  64  -4.144 -20.980  -3.457

  No H/Q in entry =           3
  In of MODEL   78
    1    H    GLU  65           H        GLU  65  -5.544 -21.287  -5.377
    2    HA   GLU  65           HA       GLU  65  -7.621 -23.200  -5.399
    3    HB2  GLU  65           HB2      GLU  65  -5.899 -22.156  -7.647
    4    HB3  GLU  65           HB3      GLU  65  -7.337 -23.153  -7.871
    5    HG2  GLU  65           HG2      GLU  65  -7.296 -20.497  -6.410
    6    HG3  GLU  65           HG3      GLU  65  -7.823 -20.714  -8.078

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLY  66           H        GLY  66  -4.217 -23.442  -6.128
    2    HA3  GLY  66           HA2      GLY  66  -4.408 -26.359  -6.449
    3    HA2  GLY  66           HA3      GLY  66  -3.120 -25.357  -7.086

  No H/Q in entry =           3
  In of MODEL   78
    1    H    LYS  67           H        LYS  67  -2.263 -27.469  -5.873
    2    HA   LYS  67           HA       LYS  67  -2.028 -27.465  -3.082
    3    HB2  LYS  67           HB2      LYS  67  -0.362 -28.747  -5.238
    4    HB3  LYS  67           HB3      LYS  67  -0.135 -29.064  -3.514
    5    HG2  LYS  67           HG2      LYS  67  -2.491 -29.750  -3.315
    6    HG3  LYS  67           HG3      LYS  67  -2.740 -29.418  -5.028
    7    HD2  LYS  67           HD2      LYS  67  -1.034 -31.137  -5.586
    8    HD3  LYS  67           HD3      LYS  67  -0.872 -31.502  -3.867
    9    HE2  LYS  67           HE2      LYS  67  -3.482 -31.669  -5.396
   10    HE3  LYS  67           HE3      LYS  67  -2.441 -33.052  -5.066
   11    HZ1  LYS  67           HZ1      LYS  67  -2.718 -31.856  -2.643
   12    HZ3  LYS  67           HZ2      LYS  67  -3.569 -33.227  -3.174
   13    HZ2  LYS  67           HZ3      LYS  67  -4.259 -31.683  -3.327

  No H/Q in entry =          13
  In of MODEL   78
    1    H    MET  68           H        MET  68   0.160 -26.231  -5.533
    2    HA   MET  68           HA       MET  68   2.009 -25.154  -3.544
    3    HB2  MET  68           HB2      MET  68   2.119 -25.391  -6.548
    4    HB3  MET  68           HB3      MET  68   3.371 -24.606  -5.584
    5    HG2  MET  68           HG2      MET  68   3.731 -26.674  -4.320
    6    HG3  MET  68           HG3      MET  68   2.434 -27.468  -5.215
    7    HE2  MET  68           HE1      MET  68   6.612 -26.273  -6.527
    8    HE1  MET  68           HE2      MET  68   5.698 -25.809  -5.093
    9    HE3  MET  68           HE3      MET  68   5.397 -24.990  -6.623

  No H/Q in entry =           9
  In of MODEL   78
    1    H    LYS  69           H        LYS  69  -0.324 -23.999  -5.919
    2    HA   LYS  69           HA       LYS  69   0.557 -21.298  -5.899
    3    HB2  LYS  69           HB2      LYS  69  -0.685 -22.233  -7.777
    4    HB3  LYS  69           HB3      LYS  69  -2.124 -22.362  -6.759
    5    HG2  LYS  69           HG2      LYS  69  -2.131 -19.956  -6.383
    6    HG3  LYS  69           HG3      LYS  69  -0.628 -19.781  -7.289
    7    HD2  LYS  69           HD2      LYS  69  -1.756 -20.627  -9.319
    8    HD3  LYS  69           HD3      LYS  69  -3.263 -20.775  -8.411
    9    HE2  LYS  69           HE2      LYS  69  -3.231 -18.354  -7.947
   10    HE3  LYS  69           HE3      LYS  69  -1.721 -18.200  -8.845
   11    HZ1  LYS  69           HZ1      LYS  69  -3.065 -19.317 -10.722
   12    HZ3  LYS  69           HZ2      LYS  69  -3.287 -17.660 -10.416
   13    HZ2  LYS  69           HZ3      LYS  69  -4.422 -18.792  -9.851

  No H/Q in entry =          13
  In of MODEL   78
    1    H    VAL  70           H        VAL  70  -0.399 -19.412  -5.085
    2    HA   VAL  70           HA       VAL  70  -1.940 -19.804  -2.584
    3    HB   VAL  70           HB       VAL  70  -1.003 -17.625  -1.895
    4   HG11  VAL  70          HG11      VAL  70   0.223 -19.787  -1.474
    5   HG13  VAL  70          HG12      VAL  70   1.269 -18.366  -1.528
    6   HG12  VAL  70          HG13      VAL  70   1.187 -19.455  -2.913
    7   HG23  VAL  70          HG21      VAL  70   0.787 -16.577  -3.310
    8   HG22  VAL  70          HG22      VAL  70  -0.791 -16.562  -4.093
    9   HG21  VAL  70          HG23      VAL  70   0.421 -17.740  -4.585

  No H/Q in entry =           9
  In of MODEL   78
    1    H    SER  71           H        SER  71  -3.489 -18.124  -2.057
    2    HA   SER  71           HA       SER  71  -5.329 -17.565  -4.135
    3    HB2  SER  71           HB2      SER  71  -5.907 -17.720  -1.682
    4    HB3  SER  71           HB3      SER  71  -5.106 -16.171  -1.445
    5    HG   SER  71           HG       SER  71  -7.441 -16.115  -1.832

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LEU  72           H        LEU  72  -5.520 -15.888  -5.478
    2    HA   LEU  72           HA       LEU  72  -3.367 -14.128  -5.954
    3    HB2  LEU  72           HB2      LEU  72  -6.231 -14.104  -6.903
    4    HB3  LEU  72           HB3      LEU  72  -5.001 -12.983  -7.478
    5    HG   LEU  72           HG       LEU  72  -4.697 -16.001  -7.612
    6   HD13  LEU  72          HD11      LEU  72  -5.424 -15.920  -9.879
    7   HD12  LEU  72          HD12      LEU  72  -5.384 -14.157  -9.906
    8   HD11  LEU  72          HD13      LEU  72  -6.625 -14.997  -8.975
    9   HD21  LEU  72          HD21      LEU  72  -3.118 -13.636  -8.592
   10   HD23  LEU  72          HD22      LEU  72  -3.079 -15.119  -9.531
   11   HD22  LEU  72          HD23      LEU  72  -2.534 -15.126  -7.856

  No H/Q in entry =          11
  In of MODEL   78
    1    H    VAL  73           H        VAL  73  -6.453 -13.697  -4.328
    2    HA   VAL  73           HA       VAL  73  -6.430 -10.926  -3.972
    3    HB   VAL  73           HB       VAL  73  -8.150 -11.249  -2.378
    4   HG11  VAL  73          HG11      VAL  73  -8.443 -12.103  -4.820
    5   HG13  VAL  73          HG12      VAL  73  -9.659 -12.547  -3.623
    6   HG12  VAL  73          HG13      VAL  73  -8.417 -13.710  -4.092
    7   HG23  VAL  73          HG21      VAL  73  -8.511 -13.751  -1.619
    8   HG22  VAL  73          HG22      VAL  73  -7.350 -12.732  -0.769
    9   HG21  VAL  73          HG23      VAL  73  -6.789 -13.895  -1.971

  No H/Q in entry =           9
  In of MODEL   78
    1    H    LEU  74           H        LEU  74  -4.554 -13.344  -2.390
    2    HA   LEU  74           HA       LEU  74  -4.118 -12.218   0.136
    3    HB2  LEU  74           HB2      LEU  74  -3.388 -14.454  -0.361
    4    HB3  LEU  74           HB3      LEU  74  -2.323 -13.870  -1.639
    5    HG   LEU  74           HG       LEU  74  -0.986 -12.643   0.043
    6   HD11  LEU  74          HD11      LEU  74  -3.067 -13.814   1.898
    7   HD13  LEU  74          HD12      LEU  74  -2.540 -12.134   1.771
    8   HD12  LEU  74          HD13      LEU  74  -1.470 -13.343   2.480
    9   HD21  LEU  74          HD21      LEU  74  -0.847 -15.213  -0.577
   10   HD23  LEU  74          HD22      LEU  74  -1.255 -15.380   1.116
   11   HD22  LEU  74          HD23      LEU  74   0.195 -14.516   0.661

  No H/Q in entry =          11
  In of MODEL   78
    1    H    VAL  75           H        VAL  75  -2.214 -11.867  -2.818
    2    HA   VAL  75           HA       VAL  75  -0.371  -9.989  -1.801
    3    HB   VAL  75           HB       VAL  75  -1.334 -10.443  -4.628
    4   HG11  VAL  75          HG11      VAL  75   0.983  -8.782  -3.542
    5   HG13  VAL  75          HG12      VAL  75  -0.416  -8.178  -4.418
    6   HG12  VAL  75          HG13      VAL  75   0.759  -9.195  -5.238
    7   HG21  VAL  75          HG21      VAL  75   1.136 -11.307  -3.079
    8   HG23  VAL  75          HG22      VAL  75   0.867 -11.608  -4.796
    9   HG22  VAL  75          HG23      VAL  75  -0.183 -12.359  -3.594

  No H/Q in entry =           9
  In of MODEL   78
    1    H    GLU  76           H        GLU  76  -3.509  -9.561  -3.463
    2    HA   GLU  76           HA       GLU  76  -3.492  -6.746  -3.559
    3    HB2  GLU  76           HB2      GLU  76  -5.185  -8.125  -4.731
    4    HB3  GLU  76           HB3      GLU  76  -5.844  -8.636  -3.186
    5    HG2  GLU  76           HG2      GLU  76  -7.270  -6.886  -4.029
    6    HG3  GLU  76           HG3      GLU  76  -6.368  -6.205  -2.689

  No H/Q in entry =           6
  In of MODEL   78
    1    H    ALA  77           H        ALA  77  -4.660  -8.951  -1.025
    2    HA   ALA  77           HA       ALA  77  -5.570  -6.929   0.736
    3    HB3  ALA  77           HB1      ALA  77  -6.326  -9.116   1.194
    4    HB2  ALA  77           HB2      ALA  77  -5.198  -8.764   2.501
    5    HB1  ALA  77           HB3      ALA  77  -4.695  -9.784   1.155

  No H/Q in entry =           5
  In of MODEL   78
    1    H    GLN  78           H        GLN  78  -2.461  -8.555   0.373
    2    HA   GLN  78           HA       GLN  78  -1.178  -7.431   2.627
    3    HB2  GLN  78           HB2      GLN  78  -0.363  -9.391   1.272
    4    HB3  GLN  78           HB3      GLN  78   0.101  -8.255   0.006
    5    HG2  GLN  78           HG2      GLN  78   1.591  -7.098   1.585
    6    HG3  GLN  78           HG3      GLN  78   1.128  -8.224   2.857
    7   HE21  GLN  78          HE21      GLN  78   3.854  -8.037   2.045
    8   HE22  GLN  78          HE22      GLN  78   4.282  -9.475   1.249

  No H/Q in entry =           8
  In of MODEL   78
    1    H    LEU  79           H        LEU  79  -1.513  -6.355  -0.719
    2    HA   LEU  79           HA       LEU  79   0.229  -4.172  -0.699
    3    HB2  LEU  79           HB2      LEU  79  -0.815  -4.948  -2.755
    4    HB3  LEU  79           HB3      LEU  79  -2.409  -4.517  -2.148
    5    HG   LEU  79           HG       LEU  79  -1.804  -2.144  -2.117
    6   HD13  LEU  79          HD11      LEU  79   0.441  -1.959  -1.601
    7   HD12  LEU  79          HD12      LEU  79   0.500  -1.670  -3.340
    8   HD11  LEU  79          HD13      LEU  79   0.913  -3.260  -2.696
    9   HD23  LEU  79          HD21      LEU  79  -1.161  -1.957  -4.668
   10   HD22  LEU  79          HD22      LEU  79  -2.707  -2.667  -4.213
   11   HD21  LEU  79          HD23      LEU  79  -1.360  -3.709  -4.657

  No H/Q in entry =          11
  In of MODEL   78
    1    H    HIS  80           H        HIS  80  -3.242  -4.246   0.123
    2    HA   HIS  80           HA       HIS  80  -3.362  -1.487   0.791
    3    HB2  HIS  80           HB2      HIS  80  -5.126  -3.852   1.103
    4    HB3  HIS  80           HB3      HIS  80  -5.413  -2.506   2.209
    5    HD1  HIS  80           HD1      HIS  80  -6.987  -0.826   1.303
    6    HD2  HIS  80           HD2      HIS  80  -4.837  -2.689  -1.746
    7    HE1  HIS  80           HE1      HIS  80  -7.797   0.197  -0.876
    8    HE2  HIS  80           HE2      HIS  80  -6.493  -0.933  -2.743

  No H/Q in entry =           8
  In of MODEL   78
    1    H    LEU  81           H        LEU  81  -2.952  -4.398   2.779
    2    HA   LEU  81           HA       LEU  81  -2.908  -3.056   5.266
    3    HB2  LEU  81           HB2      LEU  81  -1.757  -5.702   4.383
    4    HB3  LEU  81           HB3      LEU  81  -1.719  -5.147   6.058
    5    HG   LEU  81           HG       LEU  81  -4.268  -5.329   4.426
    6   HD12  LEU  81          HD11      LEU  81  -4.627  -7.389   5.970
    7   HD11  LEU  81          HD12      LEU  81  -2.874  -7.365   6.158
    8   HD13  LEU  81          HD13      LEU  81  -3.586  -7.573   4.558
    9   HD23  LEU  81          HD21      LEU  81  -5.120  -5.515   6.926
   10   HD22  LEU  81          HD22      LEU  81  -4.752  -3.934   6.239
   11   HD21  LEU  81          HD23      LEU  81  -3.587  -4.727   7.300

  No H/Q in entry =          11
  In of MODEL   78
    1    H    MET  82           H        MET  82  -0.248  -4.026   3.097
    2    HA   MET  82           HA       MET  82   1.855  -3.190   4.785
    3    HB2  MET  82           HB2      MET  82   1.635  -3.520   1.792
    4    HB3  MET  82           HB3      MET  82   3.131  -2.991   2.559
    5    HG2  MET  82           HG2      MET  82   1.655  -5.543   3.276
    6    HG3  MET  82           HG3      MET  82   3.030  -5.468   2.178
    7    HE3  MET  82           HE1      MET  82   6.061  -4.816   4.167
    8    HE2  MET  82           HE2      MET  82   5.176  -3.424   3.550
    9    HE1  MET  82           HE3      MET  82   5.226  -4.914   2.612

  No H/Q in entry =           9
  In of MODEL   78
    1    H    THR  83           H        THR  83   0.081  -1.495   2.229
    2    HA   THR  83           HA       THR  83   1.558   0.914   2.322
    3    HB   THR  83           HB       THR  83  -0.591   1.899   1.335
    4    HG1  THR  83           HG1      THR  83  -2.276   0.647   1.224
    5   HG22  THR  83          HG21      THR  83  -0.367   0.078  -0.669
    6   HG21  THR  83          HG22      THR  83   1.124  -0.256   0.210
    7   HG23  THR  83          HG23      THR  83   0.807   1.367  -0.403

  No H/Q in entry =           7
  In of MODEL   78
    1    H    SER  84           H        SER  84  -1.477  -0.040   3.918
    2    HA   SER  84           HA       SER  84  -1.908   2.400   5.266
    3    HB2  SER  84           HB2      SER  84  -2.819  -0.415   5.824
    4    HB3  SER  84           HB3      SER  84  -3.277   0.937   6.859
    5    HG   SER  84           HG       SER  84  -3.740   0.640   4.066

  No H/Q in entry =           5
  In of MODEL   78
    1    H    MET  85           H        MET  85  -0.280  -0.579   6.392
    2    HA   MET  85           HA       MET  85   0.261   0.329   8.999
    3    HB2  MET  85           HB2      MET  85   0.492  -2.020   8.331
    4    HB3  MET  85           HB3      MET  85   1.875  -1.598   7.320
    5    HG2  MET  85           HG2      MET  85   3.104  -0.808   9.296
    6    HG3  MET  85           HG3      MET  85   1.710  -1.156  10.317
    7    HE1  MET  85           HE1      MET  85   4.241  -2.291   7.909
    8    HE3  MET  85           HE2      MET  85   3.220  -3.584   7.285
    9    HE2  MET  85           HE3      MET  85   4.621  -3.976   8.277

  No H/Q in entry =           9
  In of MODEL   78
    1    H    LEU  86           H        LEU  86   2.206   0.536   6.051
    2    HA   LEU  86           HA       LEU  86   4.454   1.784   7.211
    3    HB2  LEU  86           HB2      LEU  86   4.235   0.711   4.900
    4    HB3  LEU  86           HB3      LEU  86   3.469   2.215   4.389
    5    HG   LEU  86           HG       LEU  86   5.529   3.403   5.374
    6   HD11  LEU  86          HD11      LEU  86   6.162   0.772   6.170
    7   HD13  LEU  86          HD12      LEU  86   7.204   2.189   6.271
    8   HD12  LEU  86          HD13      LEU  86   7.286   1.140   4.858
    9   HD23  LEU  86          HD21      LEU  86   6.200   1.625   3.021
   10   HD22  LEU  86          HD22      LEU  86   6.640   3.310   3.286
   11   HD21  LEU  86          HD23      LEU  86   4.976   2.889   2.885

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ALA  87           H        ALA  87   1.579   3.110   5.625
    2    HA   ALA  87           HA       ALA  87   2.248   5.822   5.714
    3    HB1  ALA  87           HB1      ALA  87  -0.105   4.259   5.168
    4    HB3  ALA  87           HB2      ALA  87   0.252   5.912   4.670
    5    HB2  ALA  87           HB3      ALA  87  -0.552   5.610   6.213

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ARG  88           H        ARG  88   0.501   3.864   8.099
    2    HA   ARG  88           HA       ARG  88   0.043   5.924   9.948
    3    HB2  ARG  88           HB2      ARG  88  -0.960   3.598  10.010
    4    HB3  ARG  88           HB3      ARG  88   0.566   3.055  10.717
    5    HG2  ARG  88           HG2      ARG  88   0.145   5.139  12.340
    6    HG3  ARG  88           HG3      ARG  88  -1.530   4.861  11.881
    7    HD2  ARG  88           HD2      ARG  88  -1.689   3.013  13.125
    8    HD3  ARG  88           HD3      ARG  88  -0.116   2.389  12.594
    9    HE   ARG  88           HE       ARG  88  -0.617   3.663  15.050
   10   HH21  ARG  88          HH11      ARG  88   0.967   4.630  16.292
   11   HH22  ARG  88          HH12      ARG  88   2.498   5.015  15.589
   12   HH11  ARG  88          HH21      ARG  88   1.670   3.785  12.476
   13   HH12  ARG  88          HH22      ARG  88   2.904   4.521  13.441

  No H/Q in entry =          13
  In of MODEL   78
    1    H    GLU  89           H        GLU  89   2.778   3.630   9.725
    2    HA   GLU  89           HA       GLU  89   4.061   4.480  12.072
    3    HB2  GLU  89           HB2      GLU  89   4.666   2.447  10.726
    4    HB3  GLU  89           HB3      GLU  89   5.472   3.521   9.581
    5    HG2  GLU  89           HG2      GLU  89   6.978   4.324  11.328
    6    HG3  GLU  89           HG3      GLU  89   6.116   3.389  12.546

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LEU  90           H        LEU  90   4.413   5.634   8.746
    2    HA   LEU  90           HA       LEU  90   6.396   7.580   9.336
    3    HB2  LEU  90           HB2      LEU  90   4.385   7.306   7.106
    4    HB3  LEU  90           HB3      LEU  90   5.649   8.543   7.131
    5    HG   LEU  90           HG       LEU  90   6.243   5.589   7.461
    6   HD12  LEU  90          HD11      LEU  90   7.000   5.806   5.022
    7   HD11  LEU  90          HD12      LEU  90   6.024   7.273   4.975
    8   HD13  LEU  90          HD13      LEU  90   5.262   5.720   5.315
    9   HD22  LEU  90          HD21      LEU  90   8.169   6.687   8.147
   10   HD21  LEU  90          HD22      LEU  90   7.859   8.102   7.141
   11   HD23  LEU  90          HD23      LEU  90   8.480   6.621   6.413

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  91           H        ILE  91   2.859   7.691   9.183
    2    HA   ILE  91           HA       ILE  91   2.590  10.471   9.637
    3    HB   ILE  91           HB       ILE  91   0.736   8.143  10.175
    4   HG12  ILE  91          HG12      ILE  91   0.551  10.433   8.192
    5   HG13  ILE  91          HG13      ILE  91   1.371   8.916   7.819
    6   HG22  ILE  91          HG21      ILE  91  -0.942  10.246  10.239
    7   HG21  ILE  91          HG22      ILE  91   0.480  11.038  10.914
    8   HG23  ILE  91          HG23      ILE  91  -0.195   9.617  11.708
    9   HD13  ILE  91          HD11      ILE  91  -0.606   7.681   7.860
   10   HD12  ILE  91          HD12      ILE  91  -1.155   9.212   7.179
   11   HD11  ILE  91          HD13      ILE  91  -1.437   8.853   8.883

  No H/Q in entry =          11
  In of MODEL   78
    1    H    THR  92           H        THR  92   2.918   7.717  11.835
    2    HA   THR  92           HA       THR  92   2.508   9.098  14.261
    3    HB   THR  92           HB       THR  92   4.255   6.718  13.595
    4    HG1  THR  92           HG1      THR  92   2.268   6.013  13.491
    5   HG22  THR  92          HG21      THR  92   3.861   6.441  16.228
    6   HG21  THR  92          HG22      THR  92   3.842   8.201  16.157
    7   HG23  THR  92          HG23      THR  92   5.253   7.309  15.585

  No H/Q in entry =           7
  In of MODEL   78
    1    H    GLU  93           H        GLU  93   5.449   8.576  12.330
    2    HA   GLU  93           HA       GLU  93   7.236   9.955  14.032
    3    HB2  GLU  93           HB2      GLU  93   7.321   9.641  11.016
    4    HB3  GLU  93           HB3      GLU  93   8.673  10.136  12.033
    5    HG2  GLU  93           HG2      GLU  93   7.196   7.536  12.475
    6    HG3  GLU  93           HG3      GLU  93   8.584   7.653  11.402

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LEU  94           H        LEU  94   5.218  11.025  11.317
    2    HA   LEU  94           HA       LEU  94   6.092  13.708  11.221
    3    HB2  LEU  94           HB2      LEU  94   3.469  12.409  10.462
    4    HB3  LEU  94           HB3      LEU  94   3.771  14.130  10.223
    5    HG   LEU  94           HG       LEU  94   5.739  12.093   9.173
    6   HD11  LEU  94          HD11      LEU  94   3.014  12.714   8.107
    7   HD13  LEU  94          HD12      LEU  94   3.960  11.233   7.982
    8   HD12  LEU  94          HD13      LEU  94   4.331  12.606   6.939
    9   HD23  LEU  94          HD21      LEU  94   6.038  13.924   7.453
   10   HD22  LEU  94          HD22      LEU  94   6.463  14.404   9.096
   11   HD21  LEU  94          HD23      LEU  94   4.925  14.912   8.396

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  95           H        ILE  95   3.511  12.153  13.107
    2    HA   ILE  95           HA       ILE  95   2.526  14.527  14.302
    3    HB   ILE  95           HB       ILE  95   2.469  11.645  15.224
    4   HG12  ILE  95          HG12      ILE  95   0.295  13.474  14.173
    5   HG13  ILE  95          HG13      ILE  95   1.227  12.392  13.142
    6   HG21  ILE  95          HG21      ILE  95   1.247  14.147  16.426
    7   HG23  ILE  95          HG22      ILE  95   2.264  12.952  17.231
    8   HG22  ILE  95          HG23      ILE  95   0.619  12.532  16.753
    9   HD13  ILE  95          HD11      ILE  95   0.275  10.476  14.057
   10   HD12  ILE  95          HD12      ILE  95  -1.080  11.599  14.132
   11   HD11  ILE  95          HD13      ILE  95  -0.125  11.275  15.579

  No H/Q in entry =          11
  In of MODEL   78
    1    H    GLU  96           H        GLU  96   5.064  12.244  15.300
    2    HA   GLU  96           HA       GLU  96   5.644  13.426  17.794
    3    HB2  GLU  96           HB2      GLU  96   6.540  11.245  17.146
    4    HB3  GLU  96           HB3      GLU  96   7.494  11.996  15.868
    5    HG2  GLU  96           HG2      GLU  96   9.153  12.503  17.334
    6    HG3  GLU  96           HG3      GLU  96   8.024  13.343  18.388

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LEU  97           H        LEU  97   6.742  14.175  14.511
    2    HA   LEU  97           HA       LEU  97   8.675  16.124  15.228
    3    HB2  LEU  97           HB2      LEU  97   7.075  15.616  12.729
    4    HB3  LEU  97           HB3      LEU  97   8.128  17.022  12.854
    5    HG   LEU  97           HG       LEU  97   9.089  14.200  13.413
    6   HD12  LEU  97          HD11      LEU  97  10.094  14.372  11.098
    7   HD11  LEU  97          HD12      LEU  97   9.076  15.788  10.834
    8   HD13  LEU  97          HD13      LEU  97   8.339  14.213  11.126
    9   HD23  LEU  97          HD21      LEU  97  11.289  15.427  12.675
   10   HD22  LEU  97          HD22      LEU  97  10.674  15.710  14.303
   11   HD21  LEU  97          HD23      LEU  97  10.391  16.901  13.036

  No H/Q in entry =          11
  In of MODEL   78
    1    H    HIS  98           H        HIS  98   5.189  16.343  14.567
    2    HA   HIS  98           HA       HIS  98   4.956  19.149  14.705
    3    HB2  HIS  98           HB2      HIS  98   3.012  16.944  15.425
    4    HB3  HIS  98           HB3      HIS  98   2.585  18.655  15.482
    5    HD1  HIS  98           HD1      HIS  98   3.546  15.919  13.076
    6    HD2  HIS  98           HD2      HIS  98   2.264  19.884  12.956
    7    HE1  HIS  98           HE1      HIS  98   3.003  16.423  10.652
    8    HE2  HIS  98           HE2      HIS  98   2.225  18.831  10.557

  No H/Q in entry =           8
  In of MODEL   78
    1    H    GLU  99           H        GLU  99   5.026  16.656  17.202
    2    HA   GLU  99           HA       GLU  99   4.454  18.362  19.400
    3    HB2  GLU  99           HB2      GLU  99   4.306  15.883  19.495
    4    HB3  GLU  99           HB3      GLU  99   6.065  15.796  19.389
    5    HG2  GLU  99           HG2      GLU  99   6.280  17.081  21.465
    6    HG3  GLU  99           HG3      GLU  99   4.532  17.264  21.558

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LYS 100           H        LYS 100   7.488  17.361  17.840
    2    HA   LYS 100           HA       LYS 100   9.172  18.720  19.701
    3    HB2  LYS 100           HB2      LYS 100   9.654  17.787  16.862
    4    HB3  LYS 100           HB3      LYS 100  10.900  18.526  17.873
    5    HG2  LYS 100           HG2      LYS 100  10.479  16.783  19.611
    6    HG3  LYS 100           HG3      LYS 100   9.330  16.008  18.517
    7    HD2  LYS 100           HD2      LYS 100  11.120  15.684  16.853
    8    HD3  LYS 100           HD3      LYS 100  12.274  16.471  17.932
    9    HE2  LYS 100           HE2      LYS 100  11.833  14.724  19.648
   10    HE3  LYS 100           HE3      LYS 100  10.741  13.915  18.520
   11    HZ1  LYS 100           HZ1      LYS 100  13.577  14.518  17.870
   12    HZ3  LYS 100           HZ2      LYS 100  12.510  13.489  17.039
   13    HZ2  LYS 100           HZ3      LYS 100  13.086  13.055  18.578

  No H/Q in entry =          13
  In of MODEL   78
    1    H    LEU 101           H        LEU 101   7.506  19.690  16.743
    2    HA   LEU 101           HA       LEU 101   8.781  22.217  16.413
    3    HB2  LEU 101           HB2      LEU 101   6.159  21.047  15.521
    4    HB3  LEU 101           HB3      LEU 101   6.451  22.772  15.316
    5    HG   LEU 101           HG       LEU 101   8.440  20.709  14.351
    6   HD12  LEU 101          HD11      LEU 101   7.304  21.244  12.065
    7   HD11  LEU 101          HD12      LEU 101   5.913  21.706  13.043
    8   HD13  LEU 101          HD13      LEU 101   6.538  20.060  13.124
    9   HD21  LEU 101          HD21      LEU 101   7.883  23.636  13.798
   10   HD23  LEU 101          HD22      LEU 101   8.842  22.654  12.691
   11   HD22  LEU 101          HD23      LEU 101   9.387  22.897  14.351

  No H/Q in entry =          11
  In of MODEL   78
    1    H    LYS 102           H        LYS 102   7.213  21.114  19.025
    2    HA   LYS 102           HA       LYS 102   6.604  22.218  20.957
    3    HB2  LYS 102           HB2      LYS 102   7.935  24.178  19.837
    4    HB3  LYS 102           HB3      LYS 102   6.352  24.822  19.460
    5    HG2  LYS 102           HG2      LYS 102   7.718  24.530  22.114
    6    HG3  LYS 102           HG3      LYS 102   6.799  25.882  21.485
    7    HD2  LYS 102           HD2      LYS 102   5.491  23.275  22.358
    8    HD3  LYS 102           HD3      LYS 102   5.770  24.628  23.444
    9    HE2  LYS 102           HE2      LYS 102   3.484  24.282  21.951
   10    HE3  LYS 102           HE3      LYS 102   4.023  25.815  22.635
   11    HZ2  LYS 102           HZ1      LYS 102   3.499  25.938  20.255
   12    HZ1  LYS 102           HZ2      LYS 102   4.735  24.826  19.933
   13    HZ3  LYS 102           HZ3      LYS 102   5.113  26.347  20.578

  No H/Q in entry =          13
  In of MODEL   78
    1    H    ALA 103           H        ALA 103   5.008  23.803  18.189
    2    HA   ALA 103           HA       ALA 103   2.567  24.438  19.071
    3    HB1  ALA 103           HB1      ALA 103   1.652  23.620  16.826
    4    HB2  ALA 103           HB2      ALA 103   3.287  23.044  16.498
    5    HB3  ALA 103           HB3      ALA 103   2.993  24.764  16.766

  No H/Q in entry =           5
  In of MODEL   78
    1    H1   ALA   1           H3       ALA   1  10.129 -20.227  -6.244
    2    H2   ALA   1           H2       ALA   1   9.162 -20.408  -7.632
    3    H3   ALA   1           H1       ALA   1   8.705 -21.145  -6.170
    4    HA   ALA   1           HA       ALA   1   9.700 -22.978  -6.910
    5    HB1  ALA   1           HB1      ALA   1   9.808 -22.619  -9.185
    6    HB2  ALA   1           HB2      ALA   1  11.538 -22.512  -8.854
    7    HB3  ALA   1           HB3      ALA   1  10.576 -21.040  -9.004

  No H/Q in entry =           7
  In of MODEL   78
    1    H    GLU   2           H        GLU   2  11.960 -23.985  -6.966
    2    HA   GLU   2           HA       GLU   2  13.340 -23.941  -4.752
    3    HB2  GLU   2           HB2      GLU   2  14.703 -23.839  -7.449
    4    HB3  GLU   2           HB3      GLU   2  15.413 -24.470  -5.964
    5    HG2  GLU   2           HG2      GLU   2  14.347 -26.461  -6.209
    6    HG3  GLU   2           HG3      GLU   2  12.795 -25.676  -6.469

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLU   3           H        GLU   3  15.160 -22.118  -7.149
    2    HA   GLU   3           HA       GLU   3  16.352 -20.462  -5.185
    3    HB2  GLU   3           HB2      GLU   3  16.301 -20.455  -8.196
    4    HB3  GLU   3           HB3      GLU   3  17.078 -19.146  -7.306
    5    HG2  GLU   3           HG2      GLU   3  18.705 -20.563  -6.383
    6    HG3  GLU   3           HG3      GLU   3  17.722 -22.005  -6.607

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LEU   4           H        LEU   4  14.096 -19.554  -7.818
    2    HA   LEU   4           HA       LEU   4  13.694 -16.936  -7.204
    3    HB2  LEU   4           HB2      LEU   4  11.471 -18.854  -7.940
    4    HB3  LEU   4           HB3      LEU   4  11.440 -17.103  -8.136
    5    HG   LEU   4           HG       LEU   4  13.359 -19.014  -9.509
    6   HD13  LEU   4          HD11      LEU   4  12.064 -18.830 -11.420
    7   HD12  LEU   4          HD12      LEU   4  11.395 -17.268 -10.952
    8   HD11  LEU   4          HD13      LEU   4  10.803 -18.745 -10.193
    9   HD23  LEU   4          HD21      LEU   4  13.754 -16.776 -10.857
   10   HD22  LEU   4          HD22      LEU   4  14.605 -17.042  -9.337
   11   HD21  LEU   4          HD23      LEU   4  13.178 -16.009  -9.376

  No H/Q in entry =          11
  In of MODEL   78
    1    H    GLU   5           H        GLU   5  12.138 -19.683  -5.567
    2    HA   GLU   5           HA       GLU   5  10.498 -18.072  -3.864
    3    HB2  GLU   5           HB2      GLU   5  10.045 -20.456  -4.407
    4    HB3  GLU   5           HB3      GLU   5  11.436 -20.904  -3.419
    5    HG2  GLU   5           HG2      GLU   5   9.480 -21.086  -2.022
    6    HG3  GLU   5           HG3      GLU   5  10.373 -19.656  -1.504

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLU   6           H        GLU   6  13.603 -19.731  -3.420
    2    HA   GLU   6           HA       GLU   6  13.974 -18.887  -0.720
    3    HB2  GLU   6           HB2      GLU   6  15.909 -19.873  -2.827
    4    HB3  GLU   6           HB3      GLU   6  16.370 -19.539  -1.157
    5    HG2  GLU   6           HG2      GLU   6  14.758 -21.185  -0.347
    6    HG3  GLU   6           HG3      GLU   6  14.192 -21.477  -1.991

  No H/Q in entry =           6
  In of MODEL   78
    1    H    VAL   7           H        VAL   7  14.776 -17.576  -3.867
    2    HA   VAL   7           HA       VAL   7  16.513 -15.493  -2.997
    3    HB   VAL   7           HB       VAL   7  14.802 -15.811  -5.477
    4   HG11  VAL   7          HG11      VAL   7  16.749 -13.646  -4.660
    5   HG13  VAL   7          HG12      VAL   7  15.111 -13.462  -5.285
    6   HG12  VAL   7          HG13      VAL   7  16.409 -13.996  -6.354
    7   HG21  VAL   7          HG21      VAL   7  16.872 -17.320  -4.908
    8   HG23  VAL   7          HG22      VAL   7  17.813 -15.881  -5.303
    9   HG22  VAL   7          HG23      VAL   7  16.760 -16.603  -6.517

  No H/Q in entry =           9
  In of MODEL   78
    1    H    VAL   8           H        VAL   8  13.016 -15.676  -3.559
    2    HA   VAL   8           HA       VAL   8  12.416 -12.953  -3.084
    3    HB   VAL   8           HB       VAL   8  10.746 -15.445  -2.664
    4   HG11  VAL   8          HG11      VAL   8  10.137 -12.516  -2.336
    5   HG13  VAL   8          HG12      VAL   8   9.650 -13.872  -1.319
    6   HG12  VAL   8          HG13      VAL   8   8.871 -13.617  -2.879
    7   HG23  VAL   8          HG21      VAL   8  10.112 -13.506  -4.829
    8   HG22  VAL   8          HG22      VAL   8  10.154 -15.267  -4.873
    9   HG21  VAL   8          HG23      VAL   8  11.648 -14.349  -5.029

  No H/Q in entry =           9
  In of MODEL   78
    1    H    MET   9           H        MET   9  12.612 -15.767  -0.908
    2    HA   MET   9           HA       MET   9  11.825 -14.479   1.463
    3    HB2  MET   9           HB2      MET   9  13.680 -16.797   0.924
    4    HB3  MET   9           HB3      MET   9  13.384 -16.213   2.562
    5    HG2  MET   9           HG2      MET   9  10.958 -16.549   2.248
    6    HG3  MET   9           HG3      MET   9  11.255 -17.136   0.611
    7    HE3  MET   9           HE1      MET   9  12.353 -19.067   4.599
    8    HE2  MET   9           HE2      MET   9  10.795 -18.300   4.303
    9    HE1  MET   9           HE3      MET   9  12.273 -17.347   4.198

  No H/Q in entry =           9
  In of MODEL   78
    1    H    GLY  10           H        GLY  10  15.001 -14.778  -0.090
    2    HA3  GLY  10           HA2      GLY  10  16.491 -13.395   1.884
    3    HA2  GLY  10           HA3      GLY  10  16.953 -13.569   0.191

  No H/Q in entry =           3
  In of MODEL   78
    1    H    LEU  11           H        LEU  11  14.816 -12.295  -1.050
    2    HA   LEU  11           HA       LEU  11  15.565  -9.567  -0.882
    3    HB2  LEU  11           HB2      LEU  11  13.166 -10.919  -2.122
    4    HB3  LEU  11           HB3      LEU  11  13.488  -9.192  -2.279
    5    HG   LEU  11           HG       LEU  11  15.466 -11.346  -3.067
    6   HD13  LEU  11          HD11      LEU  11  13.714 -11.670  -4.590
    7   HD12  LEU  11          HD12      LEU  11  14.746 -10.512  -5.427
    8   HD11  LEU  11          HD13      LEU  11  13.284  -9.960  -4.610
    9   HD22  LEU  11          HD21      LEU  11  16.743  -9.413  -2.837
   10   HD21  LEU  11          HD22      LEU  11  15.393  -8.343  -3.216
   11   HD23  LEU  11          HD23      LEU  11  16.206  -9.230  -4.505

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  12           H        ILE  12  12.753 -11.330   0.379
    2    HA   ILE  12           HA       ILE  12  11.410  -9.075   1.440
    3    HB   ILE  12           HB       ILE  12  11.379 -11.958   2.387
    4   HG12  ILE  12          HG12      ILE  12  10.712 -11.311  -0.062
    5   HG13  ILE  12          HG13      ILE  12   9.657 -12.374   0.847
    6   HG23  ILE  12          HG21      ILE  12  10.446 -10.592   4.132
    7   HG22  ILE  12          HG22      ILE  12   9.079 -11.293   3.264
    8   HG21  ILE  12          HG23      ILE  12   9.546  -9.617   2.971
    9   HD13  ILE  12          HD11      ILE  12   8.184 -10.512   1.357
   10   HD12  ILE  12          HD12      ILE  12   8.455 -10.563  -0.383
   11   HD11  ILE  12          HD13      ILE  12   9.296  -9.385   0.601

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  13           H        ILE  13  13.750 -11.336   2.846
    2    HA   ILE  13           HA       ILE  13  13.808 -10.161   5.428
    3    HB   ILE  13           HB       ILE  13  15.835 -11.777   3.863
    4   HG12  ILE  13          HG12      ILE  13  13.533 -12.689   4.706
    5   HG13  ILE  13          HG13      ILE  13  14.985 -13.650   4.962
    6   HG22  ILE  13          HG21      ILE  13  16.842 -12.161   6.216
    7   HG21  ILE  13          HG22      ILE  13  15.986 -10.697   6.685
    8   HG23  ILE  13          HG23      ILE  13  17.211 -10.634   5.417
    9   HD13  ILE  13          HD11      ILE  13  15.136 -12.920   7.278
   10   HD12  ILE  13          HD12      ILE  13  13.489 -13.467   6.985
   11   HD11  ILE  13          HD13      ILE  13  13.847 -11.745   7.028

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ASN  14           H        ASN  14  15.777  -9.670   2.513
    2    HA   ASN  14           HA       ASN  14  17.562  -7.768   3.580
    3    HB2  ASN  14           HB2      ASN  14  17.516  -9.031   1.262
    4    HB3  ASN  14           HB3      ASN  14  16.655  -7.594   0.726
    5   HD21  ASN  14          HD21      ASN  14  19.089  -7.985  -0.457
    6   HD22  ASN  14          HD22      ASN  14  20.254  -6.928   0.174

  No H/Q in entry =           6
  In of MODEL   78
    1    H    SER  15           H        SER  15  14.462  -7.352   1.883
    2    HA   SER  15           HA       SER  15  14.410  -4.530   1.943
    3    HB2  SER  15           HB2      SER  15  12.075  -4.726   1.443
    4    HB3  SER  15           HB3      SER  15  12.843  -6.109   0.673
    5    HG   SER  15           HG       SER  15  11.097  -5.995   2.800

  No H/Q in entry =           5
  In of MODEL   78
    1    H    GLY  16           H        GLY  16  13.261  -6.969   4.242
    2    HA3  GLY  16           HA2      GLY  16  12.074  -5.197   6.099
    3    HA2  GLY  16           HA3      GLY  16  12.654  -6.819   6.460

  No H/Q in entry =           3
  In of MODEL   78
    1    H    GLN  17           H        GLN  17  15.373  -6.542   5.873
    2    HA   GLN  17           HA       GLN  17  16.351  -5.344   8.257
    3    HB2  GLN  17           HB2      GLN  17  17.756  -6.222   5.720
    4    HB3  GLN  17           HB3      GLN  17  18.613  -5.640   7.148
    5    HG2  GLN  17           HG2      GLN  17  16.672  -7.968   7.142
    6    HG3  GLN  17           HG3      GLN  17  18.427  -8.131   7.082
    7   HE21  GLN  17          HE21      GLN  17  16.005  -8.436   9.245
    8   HE22  GLN  17          HE22      GLN  17  16.775  -7.883  10.652

  No H/Q in entry =           8
  In of MODEL   78
    1    H    ALA  18           H        ALA  18  16.190  -4.258   4.898
    2    HA   ALA  18           HA       ALA  18  17.675  -1.896   5.130
    3    HB1  ALA  18           HB1      ALA  18  16.536  -3.085   3.059
    4    HB3  ALA  18           HB2      ALA  18  16.836  -1.347   3.046
    5    HB2  ALA  18           HB3      ALA  18  15.223  -1.961   3.412

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ARG  19           H        ARG  19  14.163  -2.412   5.520
    2    HA   ARG  19           HA       ARG  19  13.548   0.250   6.237
    3    HB2  ARG  19           HB2      ARG  19  11.833  -1.466   5.645
    4    HB3  ARG  19           HB3      ARG  19  12.155  -2.273   7.182
    5    HG2  ARG  19           HG2      ARG  19  11.483  -0.269   8.423
    6    HG3  ARG  19           HG3      ARG  19  11.254   0.614   6.915
    7    HD2  ARG  19           HD2      ARG  19   9.095  -0.139   7.730
    8    HD3  ARG  19           HD3      ARG  19   9.499  -1.025   6.253
    9    HE   ARG  19           HE       ARG  19  10.422  -2.590   8.358
   10   HH21  ARG  19          HH11      ARG  19   9.138  -4.205   9.293
   11   HH22  ARG  19          HH12      ARG  19   7.419  -4.142   9.119
   12   HH11  ARG  19          HH21      ARG  19   7.456  -1.235   7.259
   13   HH12  ARG  19          HH22      ARG  19   6.467  -2.461   7.964

  No H/Q in entry =          13
  In of MODEL   78
    1    H    SER  20           H        SER  20  14.344  -2.600   8.194
    2    HA   SER  20           HA       SER  20  14.079  -1.498  10.732
    3    HB2  SER  20           HB2      SER  20  14.497  -3.831  10.609
    4    HB3  SER  20           HB3      SER  20  15.957  -3.596   9.650
    5    HG   SER  20           HG       SER  20  15.736  -2.456  12.211

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LEU  21           H        LEU  21  16.927  -1.492   8.602
    2    HA   LEU  21           HA       LEU  21  18.628  -0.042  10.345
    3    HB2  LEU  21           HB2      LEU  21  18.607  -0.310   7.331
    4    HB3  LEU  21           HB3      LEU  21  19.877   0.522   8.224
    5    HG   LEU  21           HG       LEU  21  19.076  -2.354   8.750
    6   HD13  LEU  21          HD11      LEU  21  19.941  -2.308   6.517
    7   HD12  LEU  21          HD12      LEU  21  21.269  -2.844   7.546
    8   HD11  LEU  21          HD13      LEU  21  21.222  -1.180   6.967
    9   HD21  LEU  21          HD21      LEU  21  21.202  -0.495   9.784
   10   HD23  LEU  21          HD22      LEU  21  21.586  -2.207   9.659
   11   HD22  LEU  21          HD23      LEU  21  20.251  -1.682  10.671

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ALA  22           H        ALA  22  16.389   0.976   7.786
    2    HA   ALA  22           HA       ALA  22  16.984   3.723   7.805
    3    HB3  ALA  22           HB1      ALA  22  15.560   2.511   6.122
    4    HB2  ALA  22           HB2      ALA  22  14.883   4.038   6.689
    5    HB1  ALA  22           HB3      ALA  22  14.260   2.510   7.314

  No H/Q in entry =           5
  In of MODEL   78
    1    H    TYR  23           H        TYR  23  14.447   1.956   9.632
    2    HA   TYR  23           HA       TYR  23  13.528   4.211  11.083
    3    HB2  TYR  23           HB2      TYR  23  12.249   2.123  11.056
    4    HB3  TYR  23           HB3      TYR  23  13.561   1.284  11.882
    5    HD1  TYR  23           HD1      TYR  23  11.093   4.054  12.243
    6    HD2  TYR  23           HD2      TYR  23  13.778   1.362  14.241
    7    HE1  TYR  23           HE1      TYR  23  10.174   4.765  14.437
    8    HE2  TYR  23           HE2      TYR  23  12.859   2.071  16.433
    9    HH   TYR  23           HH       TYR  23  11.643   3.774  17.450

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ALA  24           H        ALA  24  16.124   1.880  11.722
    2    HA   ALA  24           HA       ALA  24  16.810   2.858  14.288
    3    HB3  ALA  24           HB1      ALA  24  18.129   1.037  14.124
    4    HB2  ALA  24           HB2      ALA  24  19.177   1.938  13.028
    5    HB1  ALA  24           HB3      ALA  24  17.863   0.958  12.383

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ALA  25           H        ALA  25  17.792   3.771  11.012
    2    HA   ALA  25           HA       ALA  25  19.777   5.663  11.665
    3    HB1  ALA  25           HB1      ALA  25  19.045   4.733   9.347
    4    HB3  ALA  25           HB2      ALA  25  19.582   6.410   9.443
    5    HB2  ALA  25           HB3      ALA  25  17.859   6.039   9.370

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LEU  26           H        LEU  26  16.268   5.967  11.297
    2    HA   LEU  26           HA       LEU  26  16.102   8.752  11.751
    3    HB2  LEU  26           HB2      LEU  26  14.217   7.558  10.818
    4    HB3  LEU  26           HB3      LEU  26  14.101   6.530  12.241
    5    HG   LEU  26           HG       LEU  26  13.534   8.498  13.623
    6   HD12  LEU  26          HD11      LEU  26  12.921  10.615  12.299
    7   HD11  LEU  26          HD12      LEU  26  13.890   9.942  10.991
    8   HD13  LEU  26          HD13      LEU  26  14.640  10.309  12.545
    9   HD21  LEU  26          HD21      LEU  26  11.858   8.225  11.110
   10   HD23  LEU  26          HD22      LEU  26  11.309   8.932  12.626
   11   HD22  LEU  26          HD23      LEU  26  11.725   7.222  12.554

  No H/Q in entry =          11
  In of MODEL   78
    1    H    LYS  27           H        LYS  27  15.930   5.973  13.940
    2    HA   LYS  27           HA       LYS  27  15.362   7.348  16.309
    3    HB2  LYS  27           HB2      LYS  27  15.337   4.873  16.040
    4    HB3  LYS  27           HB3      LYS  27  17.101   4.887  16.001
    5    HG2  LYS  27           HG2      LYS  27  17.168   5.868  18.252
    6    HG3  LYS  27           HG3      LYS  27  15.402   5.925  18.294
    7    HD2  LYS  27           HD2      LYS  27  15.323   3.460  18.053
    8    HD3  LYS  27           HD3      LYS  27  17.087   3.411  18.045
    9    HE2  LYS  27           HE2      LYS  27  17.138   4.395  20.303
   10    HE3  LYS  27           HE3      LYS  27  15.374   4.474  20.315
   11    HZ3  LYS  27           HZ1      LYS  27  16.116   2.504  21.464
   12    HZ2  LYS  27           HZ2      LYS  27  17.024   2.006  20.114
   13    HZ1  LYS  27           HZ3      LYS  27  15.327   2.049  20.031

  No H/Q in entry =          13
  In of MODEL   78
    1    H    GLN  28           H        GLN  28  18.468   6.699  14.722
    2    HA   GLN  28           HA       GLN  28  20.172   7.742  16.718
    3    HB2  GLN  28           HB2      GLN  28  20.465   7.696  13.703
    4    HB3  GLN  28           HB3      GLN  28  21.759   8.134  14.817
    5    HG2  GLN  28           HG2      GLN  28  20.280   5.488  14.836
    6    HG3  GLN  28           HG3      GLN  28  21.878   5.745  14.140
    7   HE21  GLN  28          HE21      GLN  28  20.536   4.447  16.818
    8   HE22  GLN  28          HE22      GLN  28  21.717   4.835  17.972

  No H/Q in entry =           8
  In of MODEL   78
    1    H    ALA  29           H        ALA  29  18.460   9.267  14.024
    2    HA   ALA  29           HA       ALA  29  19.517  11.864  14.283
    3    HB2  ALA  29           HB1      ALA  29  17.837  12.542  12.809
    4    HB1  ALA  29           HB2      ALA  29  16.665  11.394  13.456
    5    HB3  ALA  29           HB3      ALA  29  17.985  10.823  12.435

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LYS  30           H        LYS  30  16.702  10.327  15.796
    2    HA   LYS  30           HA       LYS  30  15.737  12.601  17.154
    3    HB2  LYS  30           HB2      LYS  30  15.556   9.663  17.854
    4    HB3  LYS  30           HB3      LYS  30  14.717  10.932  18.747
    5    HG2  LYS  30           HG2      LYS  30  13.613  11.647  16.628
    6    HG3  LYS  30           HG3      LYS  30  14.388  10.293  15.801
    7    HD2  LYS  30           HD2      LYS  30  13.276   8.709  17.325
    8    HD3  LYS  30           HD3      LYS  30  12.511  10.051  18.176
    9    HE2  LYS  30           HE2      LYS  30  11.362  10.714  16.082
   10    HE3  LYS  30           HE3      LYS  30  12.106   9.344  15.251
   11    HZ2  LYS  30           HZ1      LYS  30   9.787   8.987  16.126
   12    HZ1  LYS  30           HZ2      LYS  30  10.453   9.022  17.694
   13    HZ3  LYS  30           HZ3      LYS  30  10.935   7.827  16.583

  No H/Q in entry =          13
  In of MODEL   78
    1    H    GLN  31           H        GLN  31  18.345  10.369  17.893
    2    HA   GLN  31           HA       GLN  31  18.691  11.371  20.590
    3    HB2  GLN  31           HB2      GLN  31  20.679   9.755  18.987
    4    HB3  GLN  31           HB3      GLN  31  20.544   9.880  20.741
    5    HG2  GLN  31           HG2      GLN  31  18.011   8.989  19.966
    6    HG3  GLN  31           HG3      GLN  31  19.094   8.120  18.887
    7   HE21  GLN  31          HE21      GLN  31  17.520   7.008  21.158
    8   HE22  GLN  31          HE22      GLN  31  18.658   6.318  22.210

  No H/Q in entry =           8
  In of MODEL   78
    1    H    GLY  32           H        GLY  32  19.247  12.680  17.626
    2    HA3  GLY  32           HA2      GLY  32  20.280  14.702  17.117
    3    HA2  GLY  32           HA3      GLY  32  21.034  14.687  18.707

  No H/Q in entry =           3
  In of MODEL   78
    1    H    ASP  33           H        ASP  33  21.391  11.788  16.926
    2    HA   ASP  33           HA       ASP  33  24.233  12.397  16.466
    3    HB2  ASP  33           HB2      ASP  33  22.663   9.817  16.575
    4    HB3  ASP  33           HB3      ASP  33  24.352   9.895  16.084

  No H/Q in entry =           4
  In of MODEL   78
    1    H    PHE  34           H        PHE  34  23.786  13.734  14.586
    2    HA   PHE  34           HA       PHE  34  22.419  12.785  12.295
    3    HB2  PHE  34           HB2      PHE  34  24.599  14.869  12.532
    4    HB3  PHE  34           HB3      PHE  34  23.610  14.604  11.098
    5    HD1  PHE  34           HD1      PHE  34  23.901  16.527  14.015
    6    HD2  PHE  34           HD2      PHE  34  20.979  14.483  11.620
    7    HE1  PHE  34           HE1      PHE  34  22.116  17.965  14.961
    8    HE2  PHE  34           HE2      PHE  34  19.198  15.921  12.569
    9    HZ   PHE  34           HZ       PHE  34  19.770  17.663  14.235

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ALA  35           H        ALA  35  25.786  12.517  13.309
    2    HA   ALA  35           HA       ALA  35  26.877  11.675  10.852
    3    HB3  ALA  35           HB1      ALA  35  28.526  10.464  12.574
    4    HB2  ALA  35           HB2      ALA  35  27.685  11.507  13.719
    5    HB1  ALA  35           HB3      ALA  35  28.541  12.213  12.349

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ALA  36           H        ALA  36  25.711   9.741  13.613
    2    HA   ALA  36           HA       ALA  36  26.140   7.245  12.334
    3    HB2  ALA  36           HB1      ALA  36  25.688   6.505  14.408
    4    HB3  ALA  36           HB2      ALA  36  24.012   7.039  14.255
    5    HB1  ALA  36           HB3      ALA  36  25.238   8.142  14.882

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ALA  37           H        ALA  37  23.368   9.434  12.466
    2    HA   ALA  37           HA       ALA  37  21.474   7.709  11.284
    3    HB3  ALA  37           HB1      ALA  37  21.766  10.666  11.581
    4    HB1  ALA  37           HB2      ALA  37  20.429   9.617  12.049
    5    HB2  ALA  37           HB3      ALA  37  20.632  10.087  10.361

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LYS  38           H        LYS  38  23.631  10.125   9.813
    2    HA   LYS  38           HA       LYS  38  22.987   9.716   7.133
    3    HB2  LYS  38           HB2      LYS  38  24.829  11.230   8.584
    4    HB3  LYS  38           HB3      LYS  38  25.841  10.219   7.559
    5    HG2  LYS  38           HG2      LYS  38  24.698  11.018   5.562
    6    HG3  LYS  38           HG3      LYS  38  23.521  11.898   6.542
    7    HD2  LYS  38           HD2      LYS  38  25.150  13.459   7.300
    8    HD3  LYS  38           HD3      LYS  38  26.489  12.444   6.765
    9    HE2  LYS  38           HE2      LYS  38  26.177  14.325   5.216
   10    HE3  LYS  38           HE3      LYS  38  25.809  12.796   4.409
   11    HZ3  LYS  38           HZ1      LYS  38  23.623  13.290   4.275
   12    HZ2  LYS  38           HZ2      LYS  38  24.181  14.893   4.366
   13    HZ1  LYS  38           HZ3      LYS  38  23.587  14.120   5.756

  No H/Q in entry =          13
  In of MODEL   78
    1    H    ALA  39           H        ALA  39  25.462   8.060   9.092
    2    HA   ALA  39           HA       ALA  39  26.500   6.451   7.022
    3    HB2  ALA  39           HB1      ALA  39  26.384   5.486   9.864
    4    HB1  ALA  39           HB2      ALA  39  27.369   6.890   9.452
    5    HB3  ALA  39           HB3      ALA  39  27.688   5.334   8.686

  No H/Q in entry =           5
  In of MODEL   78
    1    H    MET  40           H        MET  40  23.869   5.889   9.314
    2    HA   MET  40           HA       MET  40  23.369   3.195   8.575
    3    HB2  MET  40           HB2      MET  40  21.595   5.276   9.867
    4    HB3  MET  40           HB3      MET  40  21.152   3.576   9.689
    5    HG2  MET  40           HG2      MET  40  23.718   4.460  11.036
    6    HG3  MET  40           HG3      MET  40  22.217   4.215  11.926
    7    HE3  MET  40           HE1      MET  40  21.574   0.595  12.095
    8    HE2  MET  40           HE2      MET  40  20.735   1.917  11.288
    9    HE1  MET  40           HE3      MET  40  21.479   2.186  12.862

  No H/Q in entry =           9
  In of MODEL   78
    1    H    MET  41           H        MET  41  22.024   6.280   7.390
    2    HA   MET  41           HA       MET  41  20.044   5.130   5.712
    3    HB2  MET  41           HB2      MET  41  21.582   7.689   5.206
    4    HB3  MET  41           HB3      MET  41  20.045   7.229   4.484
    5    HG2  MET  41           HG2      MET  41  19.290   7.053   7.033
    6    HG3  MET  41           HG3      MET  41  20.623   8.182   7.259
    7    HE2  MET  41           HE1      MET  41  20.094   9.486   3.924
    8    HE1  MET  41           HE2      MET  41  21.058   9.903   5.338
    9    HE3  MET  41           HE3      MET  41  19.809  11.011   4.773

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ASP  42           H        ASP  42  23.437   5.982   5.167
    2    HA   ASP  42           HA       ASP  42  23.524   5.510   2.409
    3    HB2  ASP  42           HB2      ASP  42  25.293   6.467   4.183
    4    HB3  ASP  42           HB3      ASP  42  25.915   4.828   4.054

  No H/Q in entry =           4
  In of MODEL   78
    1    H    GLN  43           H        GLN  43  24.197   3.336   5.127
    2    HA   GLN  43           HA       GLN  43  24.816   1.067   3.542
    3    HB2  GLN  43           HB2      GLN  43  23.792   1.268   6.384
    4    HB3  GLN  43           HB3      GLN  43  24.341  -0.232   5.628
    5    HG2  GLN  43           HG2      GLN  43  26.530   0.934   5.123
    6    HG3  GLN  43           HG3      GLN  43  25.974   2.271   6.123
    7   HE21  GLN  43          HE21      GLN  43  28.184   1.249   7.162
    8   HE22  GLN  43          HE22      GLN  43  27.884   0.171   8.436

  No H/Q in entry =           8
  In of MODEL   78
    1    H    SER  44           H        SER  44  21.782   2.264   4.923
    2    HA   SER  44           HA       SER  44  20.168   0.055   4.244
    3    HB2  SER  44           HB2      SER  44  19.778   2.591   5.393
    4    HB3  SER  44           HB3      SER  44  18.745   2.572   3.966
    5    HG   SER  44           HG       SER  44  17.629   1.650   5.686

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ARG  45           H        ARG  45  20.976   3.006   2.445
    2    HA   ARG  45           HA       ARG  45  19.446   2.556   0.137
    3    HB2  ARG  45           HB2      ARG  45  20.634   4.667   0.727
    4    HB3  ARG  45           HB3      ARG  45  22.162   3.880   0.343
    5    HG2  ARG  45           HG2      ARG  45  21.375   3.495  -1.973
    6    HG3  ARG  45           HG3      ARG  45  19.858   4.304  -1.588
    7    HD2  ARG  45           HD2      ARG  45  21.152   6.373  -0.999
    8    HD3  ARG  45           HD3      ARG  45  22.633   5.568  -1.566
    9    HE   ARG  45           HE       ARG  45  20.701   5.375  -3.605
   10   HH21  ARG  45          HH11      ARG  45  20.727   6.747  -5.367
   11   HH22  ARG  45          HH12      ARG  45  21.517   8.280  -5.259
   12   HH11  ARG  45          HH21      ARG  45  22.482   7.833  -1.972
   13   HH12  ARG  45          HH22      ARG  45  22.510   8.895  -3.334

  No H/Q in entry =          13
  In of MODEL   78
    1    H    MET  46           H        MET  46  22.789   1.608   0.889
    2    HA   MET  46           HA       MET  46  23.372   0.406  -1.596
    3    HB2  MET  46           HB2      MET  46  24.467   0.043   1.194
    4    HB3  MET  46           HB3      MET  46  25.109  -0.850  -0.188
    5    HG2  MET  46           HG2      MET  46  25.585   1.264  -1.354
    6    HG3  MET  46           HG3      MET  46  24.906   2.173  -0.009
    7    HE3  MET  46           HE1      MET  46  27.650   3.029  -0.895
    8    HE2  MET  46           HE2      MET  46  28.532   3.096   0.627
    9    HE1  MET  46           HE3      MET  46  26.851   3.621   0.566

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ALA  47           H        ALA  47  21.956  -0.901   1.376
    2    HA   ALA  47           HA       ALA  47  21.843  -3.611   0.569
    3    HB2  ALA  47           HB1      ALA  47  21.472  -3.145   2.874
    4    HB3  ALA  47           HB2      ALA  47  19.923  -3.713   2.252
    5    HB1  ALA  47           HB3      ALA  47  20.191  -1.988   2.513

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LEU  48           H        LEU  48  19.550  -0.931   0.213
    2    HA   LEU  48           HA       LEU  48  17.473  -2.417  -1.042
    3    HB2  LEU  48           HB2      LEU  48  18.194   0.522  -1.152
    4    HB3  LEU  48           HB3      LEU  48  16.708  -0.154  -1.821
    5    HG   LEU  48           HG       LEU  48  17.551  -0.479   1.068
    6   HD13  LEU  48          HD11      LEU  48  17.186   1.831   0.884
    7   HD12  LEU  48          HD12      LEU  48  15.612   1.218   1.391
    8   HD11  LEU  48          HD13      LEU  48  15.895   1.636  -0.300
    9   HD22  LEU  48          HD21      LEU  48  15.985  -2.158   0.684
   10   HD21  LEU  48          HD22      LEU  48  15.133  -1.234  -0.554
   11   HD23  LEU  48          HD23      LEU  48  14.928  -0.827   1.149

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ASN  49           H        ASN  49  20.205  -0.549  -2.268
    2    HA   ASN  49           HA       ASN  49  19.555  -0.614  -4.992
    3    HB2  ASN  49           HB2      ASN  49  21.264   0.866  -4.086
    4    HB3  ASN  49           HB3      ASN  49  22.256  -0.510  -3.621
    5   HD21  ASN  49          HD21      ASN  49  20.788   0.987  -6.533
    6   HD22  ASN  49          HD22      ASN  49  22.037   0.524  -7.583

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLU  50           H        GLU  50  21.487  -2.856  -3.031
    2    HA   GLU  50           HA       GLU  50  22.150  -4.625  -5.158
    3    HB2  GLU  50           HB2      GLU  50  23.346  -4.629  -2.991
    4    HB3  GLU  50           HB3      GLU  50  21.889  -5.225  -2.197
    5    HG2  GLU  50           HG2      GLU  50  21.933  -7.258  -3.558
    6    HG3  GLU  50           HG3      GLU  50  23.324  -6.656  -4.457

  No H/Q in entry =           6
  In of MODEL   78
    1    H    ALA  51           H        ALA  51  19.494  -4.501  -2.834
    2    HA   ALA  51           HA       ALA  51  18.272  -6.946  -3.594
    3    HB3  ALA  51           HB1      ALA  51  16.691  -6.405  -2.039
    4    HB1  ALA  51           HB2      ALA  51  16.516  -4.754  -2.636
    5    HB2  ALA  51           HB3      ALA  51  17.865  -5.172  -1.580

  No H/Q in entry =           5
  In of MODEL   78
    1    H    HIS  52           H        HIS  52  17.764  -3.584  -4.626
    2    HA   HIS  52           HA       HIS  52  15.640  -4.061  -6.428
    3    HB2  HIS  52           HB2      HIS  52  16.346  -1.812  -5.621
    4    HB3  HIS  52           HB3      HIS  52  17.792  -1.940  -6.622
    5    HD1  HIS  52           HD1      HIS  52  17.467  -1.878  -9.217
    6    HD2  HIS  52           HD2      HIS  52  13.955  -1.290  -7.050
    7    HE1  HIS  52           HE1      HIS  52  15.748  -1.005 -10.860
    8    HE2  HIS  52           HE2      HIS  52  13.602  -0.642  -9.554

  No H/Q in entry =           8
  In of MODEL   78
    1    H    LEU  53           H        LEU  53  19.158  -4.146  -6.858
    2    HA   LEU  53           HA       LEU  53  19.209  -4.461  -9.659
    3    HB2  LEU  53           HB2      LEU  53  21.123  -5.269  -7.484
    4    HB3  LEU  53           HB3      LEU  53  21.431  -5.660  -9.174
    5    HG   LEU  53           HG       LEU  53  20.816  -2.836  -8.251
    6   HD12  LEU  53          HD11      LEU  53  23.304  -2.488  -8.433
    7   HD11  LEU  53          HD12      LEU  53  23.486  -4.238  -8.548
    8   HD13  LEU  53          HD13      LEU  53  22.827  -3.515  -7.085
    9   HD23  LEU  53          HD21      LEU  53  22.277  -2.435 -10.396
   10   HD22  LEU  53          HD22      LEU  53  20.586  -2.889 -10.590
   11   HD21  LEU  53          HD23      LEU  53  21.845  -4.091 -10.803

  No H/Q in entry =          11
  In of MODEL   78
    1    H    VAL  54           H        VAL  54  19.041  -6.846  -7.035
    2    HA   VAL  54           HA       VAL  54  19.113  -9.142  -8.696
    3    HB   VAL  54           HB       VAL  54  17.967  -8.694  -5.929
    4   HG12  VAL  54          HG11      VAL  54  18.233 -11.319  -5.927
    5   HG11  VAL  54          HG12      VAL  54  18.053 -11.145  -7.672
    6   HG13  VAL  54          HG13      VAL  54  16.775 -10.586  -6.594
    7   HG22  VAL  54          HG21      VAL  54  20.287  -8.536  -5.705
    8   HG21  VAL  54          HG22      VAL  54  20.601  -9.634  -7.047
    9   HG23  VAL  54          HG23      VAL  54  20.055 -10.270  -5.495

  No H/Q in entry =           9
  In of MODEL   78
    1    H    GLN  55           H        GLN  55  16.428  -7.179  -7.414
    2    HA   GLN  55           HA       GLN  55  14.371  -8.797  -8.489
    3    HB2  GLN  55           HB2      GLN  55  13.656  -7.256  -6.862
    4    HB3  GLN  55           HB3      GLN  55  14.479  -5.906  -7.637
    5    HG2  GLN  55           HG2      GLN  55  12.763  -5.542  -9.127
    6    HG3  GLN  55           HG3      GLN  55  12.403  -7.255  -9.298
    7   HE21  GLN  55          HE21      GLN  55  10.384  -7.760  -8.495
    8   HE22  GLN  55          HE22      GLN  55   9.627  -6.990  -7.186

  No H/Q in entry =           8
  In of MODEL   78
    1    H    THR  56           H        THR  56  16.172  -6.036  -9.846
    2    HA   THR  56           HA       THR  56  14.743  -5.641 -12.195
    3    HB   THR  56           HB       THR  56  17.764  -5.619 -12.032
    4    HG1  THR  56           HG1      THR  56  16.016  -4.279 -10.575
    5   HG22  THR  56          HG21      THR  56  17.496  -3.786 -13.688
    6   HG21  THR  56          HG22      THR  56  15.753  -4.061 -13.678
    7   HG23  THR  56          HG23      THR  56  16.842  -5.316 -14.276

  No H/Q in entry =           7
  In of MODEL   78
    1    H    LYS  57           H        LYS  57  17.342  -7.996 -11.584
    2    HA   LYS  57           HA       LYS  57  17.318  -9.189 -14.163
    3    HB2  LYS  57           HB2      LYS  57  19.102  -9.481 -12.417
    4    HB3  LYS  57           HB3      LYS  57  17.975 -10.452 -11.481
    5    HG2  LYS  57           HG2      LYS  57  17.834 -12.090 -13.298
    6    HG3  LYS  57           HG3      LYS  57  18.911 -11.113 -14.290
    7    HD2  LYS  57           HD2      LYS  57  20.707 -11.392 -12.609
    8    HD3  LYS  57           HD3      LYS  57  19.634 -12.394 -11.632
    9    HE2  LYS  57           HE2      LYS  57  19.459 -14.028 -13.473
   10    HE3  LYS  57           HE3      LYS  57  20.509 -13.033 -14.479
   11    HZ1  LYS  57           HZ1      LYS  57  21.755 -13.444 -12.003
   12    HZ3  LYS  57           HZ2      LYS  57  22.256 -13.960 -13.540
   13    HZ2  LYS  57           HZ3      LYS  57  21.247 -14.949 -12.598

  No H/Q in entry =          13
  In of MODEL   78
    1    H    LEU  58           H        LEU  58  15.522  -9.819 -11.188
    2    HA   LEU  58           HA       LEU  58  14.250 -12.165 -12.124
    3    HB2  LEU  58           HB2      LEU  58  13.495 -10.244  -9.928
    4    HB3  LEU  58           HB3      LEU  58  12.656 -11.764 -10.245
    5    HG   LEU  58           HG       LEU  58  15.634 -11.550  -9.690
    6   HD11  LEU  58          HD11      LEU  58  13.254 -11.917  -7.898
    7   HD13  LEU  58          HD12      LEU  58  14.728 -10.985  -7.635
    8   HD12  LEU  58          HD13      LEU  58  14.762 -12.743  -7.500
    9   HD22  LEU  58          HD21      LEU  58  15.473 -13.608 -10.718
   10   HD21  LEU  58          HD22      LEU  58  13.755 -13.781 -10.358
   11   HD23  LEU  58          HD23      LEU  58  14.956 -14.108  -9.109

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  59           H        ILE  59  13.650  -8.814 -12.806
    2    HA   ILE  59           HA       ILE  59  10.922  -9.404 -13.747
    3    HB   ILE  59           HB       ILE  59  11.771  -7.142 -12.539
    4   HG12  ILE  59          HG12      ILE  59   9.877  -6.983 -14.896
    5   HG13  ILE  59          HG13      ILE  59   9.435  -7.730 -13.382
    6   HG21  ILE  59          HG21      ILE  59  13.332  -6.774 -14.588
    7   HG23  ILE  59          HG22      ILE  59  12.381  -5.415 -14.034
    8   HG22  ILE  59          HG23      ILE  59  11.875  -6.338 -15.447
    9   HD12  ILE  59          HD11      ILE  59  10.335  -4.873 -13.753
   10   HD11  ILE  59          HD12      ILE  59   9.999  -5.616 -12.191
   11   HD13  ILE  59          HD13      ILE  59   8.698  -5.406 -13.364

  No H/Q in entry =          11
  In of MODEL   78
    1    H    GLU  60           H        GLU  60  14.144  -8.621 -15.004
    2    HA   GLU  60           HA       GLU  60  13.373  -8.203 -17.712
    3    HB2  GLU  60           HB2      GLU  60  15.565  -7.511 -16.876
    4    HB3  GLU  60           HB3      GLU  60  15.991  -9.187 -16.546
    5    HG2  GLU  60           HG2      GLU  60  15.793  -9.714 -18.953
    6    HG3  GLU  60           HG3      GLU  60  15.374  -8.034 -19.283

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLY  61           H        GLY  61  14.288 -11.105 -15.898
    2    HA3  GLY  61           HA2      GLY  61  13.713 -12.740 -18.300
    3    HA2  GLY  61           HA3      GLY  61  14.734 -13.244 -16.958

  No H/Q in entry =           3
  In of MODEL   78
    1    H    ASP  62           H        ASP  62  11.650 -11.630 -16.580
    2    HA   ASP  62           HA       ASP  62  10.669 -13.650 -14.825
    3    HB2  ASP  62           HB2      ASP  62   8.635 -12.274 -14.775
    4    HB3  ASP  62           HB3      ASP  62  10.081 -11.295 -14.547

  No H/Q in entry =           4
  In of MODEL   78
    1    H    ALA  63           H        ALA  63  11.128 -15.271 -16.855
    2    HA   ALA  63           HA       ALA  63   9.151 -15.504 -18.881
    3    HB1  ALA  63           HB1      ALA  63  11.105 -16.762 -19.237
    4    HB3  ALA  63           HB2      ALA  63   9.910 -17.985 -18.807
    5    HB2  ALA  63           HB3      ALA  63  11.080 -17.436 -17.607

  No H/Q in entry =           5
  In of MODEL   78
    1    H    GLY  64           H        GLY  64   9.373 -16.734 -15.592
    2    HA3  GLY  64           HA2      GLY  64   7.789 -17.570 -14.156
    3    HA2  GLY  64           HA3      GLY  64   6.563 -16.965 -15.262

  No H/Q in entry =           3
  In of MODEL   78
    1    H    GLU  65           H        GLU  65   5.416 -18.978 -14.642
    2    HA   GLU  65           HA       GLU  65   6.456 -21.526 -15.266
    3    HB2  GLU  65           HB2      GLU  65   3.597 -20.596 -15.007
    4    HB3  GLU  65           HB3      GLU  65   4.092 -22.284 -15.127
    5    HG2  GLU  65           HG2      GLU  65   5.049 -20.353 -12.997
    6    HG3  GLU  65           HG3      GLU  65   3.782 -21.556 -12.764

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLY  66           H        GLY  66   4.457 -19.320 -17.089
    2    HA3  GLY  66           HA2      GLY  66   4.613 -21.025 -19.480
    3    HA2  GLY  66           HA3      GLY  66   3.394 -19.801 -19.192

  No H/Q in entry =           3
  In of MODEL   78
    1    H    LYS  67           H        LYS  67   4.465 -19.723 -21.565
    2    HA   LYS  67           HA       LYS  67   6.891 -18.398 -21.946
    3    HB2  LYS  67           HB2      LYS  67   4.432 -18.599 -23.676
    4    HB3  LYS  67           HB3      LYS  67   5.957 -17.896 -24.225
    5    HG2  LYS  67           HG2      LYS  67   7.138 -19.982 -23.663
    6    HG3  LYS  67           HG3      LYS  67   5.632 -20.689 -23.086
    7    HD2  LYS  67           HD2      LYS  67   4.665 -20.444 -25.358
    8    HD3  LYS  67           HD3      LYS  67   6.209 -19.802 -25.925
    9    HE2  LYS  67           HE2      LYS  67   5.872 -22.520 -24.626
   10    HE3  LYS  67           HE3      LYS  67   5.938 -22.258 -26.369
   11    HZ1  LYS  67           HZ1      LYS  67   8.101 -20.909 -25.434
   12    HZ3  LYS  67           HZ2      LYS  67   8.125 -22.454 -26.138
   13    HZ2  LYS  67           HZ3      LYS  67   8.064 -22.288 -24.448

  No H/Q in entry =          13
  In of MODEL   78
    1    H    MET  68           H        MET  68   3.640 -17.085 -21.774
    2    HA   MET  68           HA       MET  68   4.579 -14.329 -21.946
    3    HB2  MET  68           HB2      MET  68   1.829 -15.566 -21.891
    4    HB3  MET  68           HB3      MET  68   2.124 -13.829 -21.958
    5    HG2  MET  68           HG2      MET  68   3.384 -14.102 -24.046
    6    HG3  MET  68           HG3      MET  68   3.148 -15.848 -23.975
    7    HE2  MET  68           HE1      MET  68   0.195 -12.524 -24.902
    8    HE1  MET  68           HE2      MET  68   1.818 -12.437 -24.224
    9    HE3  MET  68           HE3      MET  68   0.458 -12.852 -23.183

  No H/Q in entry =           9
  In of MODEL   78
    1    H    LYS  69           H        LYS  69   3.223 -16.505 -19.506
    2    HA   LYS  69           HA       LYS  69   2.548 -14.441 -17.658
    3    HB2  LYS  69           HB2      LYS  69   1.426 -16.615 -17.652
    4    HB3  LYS  69           HB3      LYS  69   2.932 -17.394 -17.157
    5    HG2  LYS  69           HG2      LYS  69   2.981 -16.080 -15.100
    6    HG3  LYS  69           HG3      LYS  69   1.539 -15.198 -15.600
    7    HD2  LYS  69           HD2      LYS  69   0.249 -17.306 -15.586
    8    HD3  LYS  69           HD3      LYS  69   1.691 -18.178 -15.058
    9    HE2  LYS  69           HE2      LYS  69   1.793 -16.788 -13.023
   10    HE3  LYS  69           HE3      LYS  69   0.355 -15.914 -13.548
   11    HZ1  LYS  69           HZ1      LYS  69  -0.663 -18.268 -13.674
   12    HZ3  LYS  69           HZ2      LYS  69  -0.523 -17.501 -12.166
   13    HZ2  LYS  69           HZ3      LYS  69   0.597 -18.694 -12.622

  No H/Q in entry =          13
  In of MODEL   78
    1    H    VAL  70           H        VAL  70   3.423 -13.952 -15.578
    2    HA   VAL  70           HA       VAL  70   6.360 -14.322 -15.412
    3    HB   VAL  70           HB       VAL  70   6.349 -12.244 -14.081
    4   HG11  VAL  70          HG11      VAL  70   6.533 -12.216 -16.595
    5   HG13  VAL  70          HG12      VAL  70   5.885 -10.726 -15.912
    6   HG12  VAL  70          HG13      VAL  70   4.802 -11.895 -16.665
    7   HG23  VAL  70          HG21      VAL  70   4.234 -10.915 -13.937
    8   HG22  VAL  70          HG22      VAL  70   4.115 -12.450 -13.079
    9   HG21  VAL  70          HG23      VAL  70   3.359 -12.264 -14.660

  No H/Q in entry =           9
  In of MODEL   78
    1    H    SER  71           H        SER  71   7.257 -14.513 -13.252
    2    HA   SER  71           HA       SER  71   6.030 -16.495 -11.652
    3    HB2  SER  71           HB2      SER  71   8.487 -16.048 -11.735
    4    HB3  SER  71           HB3      SER  71   8.210 -14.554 -10.843
    5    HG   SER  71           HG       SER  71   8.754 -16.486  -9.574

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LEU  72           H        LEU  72   4.659 -16.361  -9.970
    2    HA   LEU  72           HA       LEU  72   3.159 -14.015  -9.525
    3    HB2  LEU  72           HB2      LEU  72   3.390 -16.576  -7.951
    4    HB3  LEU  72           HB3      LEU  72   2.244 -15.297  -7.561
    5    HG   LEU  72           HG       LEU  72   2.395 -16.619 -10.290
    6   HD13  LEU  72          HD11      LEU  72   0.588 -18.038  -9.637
    7   HD12  LEU  72          HD12      LEU  72   0.349 -17.157  -8.130
    8   HD11  LEU  72          HD13      LEU  72   1.782 -18.161  -8.344
    9   HD21  LEU  72          HD21      LEU  72   0.555 -14.643  -8.954
   10   HD23  LEU  72          HD22      LEU  72  -0.088 -15.704 -10.196
   11   HD22  LEU  72          HD23      LEU  72   1.225 -14.597 -10.580

  No H/Q in entry =          11
  In of MODEL   78
    1    H    VAL  73           H        VAL  73   5.782 -15.510  -7.751
    2    HA   VAL  73           HA       VAL  73   5.752 -13.979  -5.417
    3    HB   VAL  73           HB       VAL  73   7.923 -14.830  -4.992
    4   HG11  VAL  73          HG11      VAL  73   5.911 -16.456  -5.358
    5   HG13  VAL  73          HG12      VAL  73   7.535 -17.130  -5.221
    6   HG12  VAL  73          HG13      VAL  73   6.788 -16.943  -6.808
    7   HG23  VAL  73          HG21      VAL  73   9.061 -16.043  -7.045
    8   HG22  VAL  73          HG22      VAL  73   9.263 -14.306  -6.823
    9   HG21  VAL  73          HG23      VAL  73   8.087 -14.915  -7.987

  No H/Q in entry =           9
  In of MODEL   78
    1    H    LEU  74           H        LEU  74   6.764 -13.103  -8.591
    2    HA   LEU  74           HA       LEU  74   8.750 -11.197  -8.094
    3    HB2  LEU  74           HB2      LEU  74   8.284 -11.932 -10.333
    4    HB3  LEU  74           HB3      LEU  74   6.629 -11.334 -10.234
    5    HG   LEU  74           HG       LEU  74   7.481  -9.022 -10.011
    6   HD11  LEU  74          HD11      LEU  74  10.131 -10.463 -10.142
    7   HD13  LEU  74          HD12      LEU  74   9.597  -9.265  -8.965
    8   HD12  LEU  74          HD13      LEU  74   9.982  -8.770 -10.612
    9   HD21  LEU  74          HD21      LEU  74   7.194 -10.439 -12.235
   10   HD23  LEU  74          HD22      LEU  74   8.914 -10.144 -12.335
   11   HD22  LEU  74          HD23      LEU  74   7.811  -8.789 -12.271

  No H/Q in entry =          11
  In of MODEL   78
    1    H    VAL  75           H        VAL  75   5.264 -10.737  -8.452
    2    HA   VAL  75           HA       VAL  75   5.226  -7.980  -7.862
    3    HB   VAL  75           HB       VAL  75   3.091 -10.079  -7.483
    4   HG11  VAL  75          HG11      VAL  75   2.962  -7.035  -7.318
    5   HG13  VAL  75          HG12      VAL  75   2.645  -8.167  -6.011
    6   HG12  VAL  75          HG13      VAL  75   1.556  -8.093  -7.387
    7   HG21  VAL  75          HG21      VAL  75   3.629  -7.979  -9.611
    8   HG23  VAL  75          HG22      VAL  75   2.211  -9.024  -9.564
    9   HG22  VAL  75          HG23      VAL  75   3.813  -9.721  -9.810

  No H/Q in entry =           9
  In of MODEL   78
    1    H    GLU  76           H        GLU  76   4.907 -10.853  -5.756
    2    HA   GLU  76           HA       GLU  76   4.462  -9.484  -3.334
    3    HB2  GLU  76           HB2      GLU  76   4.231 -11.943  -3.560
    4    HB3  GLU  76           HB3      GLU  76   5.961 -12.086  -3.816
    5    HG2  GLU  76           HG2      GLU  76   5.536 -12.657  -1.516
    6    HG3  GLU  76           HG3      GLU  76   6.307 -11.082  -1.509

  No H/Q in entry =           6
  In of MODEL   78
    1    H    ALA  77           H        ALA  77   7.505 -10.456  -4.892
    2    HA   ALA  77           HA       ALA  77   9.212  -9.451  -2.872
    3    HB1  ALA  77           HB1      ALA  77  10.224 -10.923  -4.400
    4    HB2  ALA  77           HB2      ALA  77  10.890  -9.349  -4.837
    5    HB3  ALA  77           HB3      ALA  77   9.590 -10.053  -5.797

  No H/Q in entry =           5
  In of MODEL   78
    1    H    GLN  78           H        GLN  78   7.857  -8.001  -5.787
    2    HA   GLN  78           HA       GLN  78   9.263  -5.552  -5.678
    3    HB2  GLN  78           HB2      GLN  78   7.950  -6.438  -7.639
    4    HB3  GLN  78           HB3      GLN  78   6.475  -6.026  -6.766
    5    HG2  GLN  78           HG2      GLN  78   7.177  -3.671  -6.674
    6    HG3  GLN  78           HG3      GLN  78   8.663  -4.073  -7.533
    7   HE21  GLN  78          HE21      GLN  78   6.829  -2.208  -8.662
    8   HE22  GLN  78          HE22      GLN  78   6.120  -2.908 -10.037

  No H/Q in entry =           8
  In of MODEL   78
    1    H    LEU  79           H        LEU  79   6.217  -6.624  -4.256
    2    HA   LEU  79           HA       LEU  79   5.274  -4.197  -3.246
    3    HB2  LEU  79           HB2      LEU  79   3.914  -6.219  -3.196
    4    HB3  LEU  79           HB3      LEU  79   5.040  -6.984  -2.079
    5    HG   LEU  79           HG       LEU  79   4.520  -5.332  -0.351
    6   HD13  LEU  79          HD11      LEU  79   4.101  -3.307  -1.401
    7   HD12  LEU  79          HD12      LEU  79   2.464  -3.796  -0.967
    8   HD11  LEU  79          HD13      LEU  79   3.043  -4.030  -2.614
    9   HD23  LEU  79          HD21      LEU  79   1.923  -5.767  -0.268
   10   HD22  LEU  79          HD22      LEU  79   3.032  -7.131  -0.158
   11   HD21  LEU  79          HD23      LEU  79   2.230  -6.774  -1.685

  No H/Q in entry =          11
  In of MODEL   78
    1    H    HIS  80           H        HIS  80   7.400  -6.582  -1.660
    2    HA   HIS  80           HA       HIS  80   7.716  -5.048   0.711
    3    HB2  HIS  80           HB2      HIS  80   9.004  -7.440  -0.486
    4    HB3  HIS  80           HB3      HIS  80   9.931  -6.566   0.734
    5    HD1  HIS  80           HD1      HIS  80   9.420  -7.193   3.075
    6    HD2  HIS  80           HD2      HIS  80   6.192  -7.968   0.553
    7    HE1  HIS  80           HE1      HIS  80   7.620  -8.257   4.517
    8    HE2  HIS  80           HE2      HIS  80   5.645  -8.734   2.988

  No H/Q in entry =           8
  In of MODEL   78
    1    H    LEU  81           H        LEU  81   9.723  -5.367  -2.196
    2    HA   LEU  81           HA       LEU  81  11.803  -3.673  -1.310
    3    HB2  LEU  81           HB2      LEU  81  10.873  -4.442  -4.076
    4    HB3  LEU  81           HB3      LEU  81  12.314  -3.469  -3.781
    5    HG   LEU  81           HG       LEU  81  11.856  -6.182  -2.511
    6   HD12  LEU  81          HD11      LEU  81  13.662  -6.848  -4.256
    7   HD11  LEU  81          HD12      LEU  81  13.132  -5.410  -5.128
    8   HD13  LEU  81          HD13      LEU  81  11.989  -6.709  -4.794
    9   HD23  LEU  81          HD21      LEU  81  14.491  -5.927  -2.489
   10   HD22  LEU  81          HD22      LEU  81  13.523  -5.145  -1.241
   11   HD21  LEU  81          HD23      LEU  81  14.127  -4.205  -2.605

  No H/Q in entry =          11
  In of MODEL   78
    1    H    MET  82           H        MET  82   8.902  -2.968  -3.255
    2    HA   MET  82           HA       MET  82   9.506  -0.255  -3.751
    3    HB2  MET  82           HB2      MET  82   6.910  -1.789  -3.635
    4    HB3  MET  82           HB3      MET  82   6.950  -0.065  -3.998
    5    HG2  MET  82           HG2      MET  82   8.507  -2.174  -5.530
    6    HG3  MET  82           HG3      MET  82   6.956  -1.515  -6.047
    7    HE3  MET  82           HE1      MET  82   7.489   1.930  -7.214
    8    HE2  MET  82           HE2      MET  82   7.104   1.711  -5.509
    9    HE1  MET  82           HE3      MET  82   6.417   0.618  -6.706

  No H/Q in entry =           9
  In of MODEL   78
    1    H    THR  83           H        THR  83   7.669  -1.814  -1.153
    2    HA   THR  83           HA       THR  83   6.869   0.553   0.173
    3    HB   THR  83           HB       THR  83   6.692  -1.020   2.189
    4    HG1  THR  83           HG1      THR  83   7.404  -2.987   1.960
    5   HG22  THR  83          HG21      THR  83   5.007  -2.546   0.714
    6   HG21  THR  83          HG22      THR  83   5.268  -1.222  -0.416
    7   HG23  THR  83          HG23      THR  83   4.630  -0.893   1.196

  No H/Q in entry =           7
  In of MODEL   78
    1    H    SER  84           H        SER  84   9.641  -1.612   0.701
    2    HA   SER  84           HA       SER  84  10.727  -0.209   2.894
    3    HB2  SER  84           HB2      SER  84  11.943  -2.078   0.871
    4    HB3  SER  84           HB3      SER  84  12.903  -1.349   2.156
    5    HG   SER  84           HG       SER  84  10.588  -2.984   2.407

  No H/Q in entry =           5
  In of MODEL   78
    1    H    MET  85           H        MET  85  11.497   0.038  -0.592
    2    HA   MET  85           HA       MET  85  13.541   1.955  -0.333
    3    HB2  MET  85           HB2      MET  85  13.123   0.686  -2.401
    4    HB3  MET  85           HB3      MET  85  11.616   1.571  -2.633
    5    HG2  MET  85           HG2      MET  85  12.855   3.689  -2.761
    6    HG3  MET  85           HG3      MET  85  14.368   2.833  -2.477
    7    HE1  MET  85           HE1      MET  85  11.302   3.272  -4.449
    8    HE3  MET  85           HE2      MET  85  11.291   1.604  -5.016
    9    HE2  MET  85           HE3      MET  85  11.688   2.900  -6.136

  No H/Q in entry =           9
  In of MODEL   78
    1    H    LEU  86           H        LEU  86  10.062   2.373  -0.852
    2    HA   LEU  86           HA       LEU  86  10.066   5.187  -1.031
    3    HB2  LEU  86           HB2      LEU  86   8.184   3.573  -1.614
    4    HB3  LEU  86           HB3      LEU  86   7.847   3.489   0.114
    5    HG   LEU  86           HG       LEU  86   7.748   6.053   0.064
    6   HD11  LEU  86          HD11      LEU  86   8.521   5.601  -2.636
    7   HD13  LEU  86          HD12      LEU  86   8.120   7.138  -1.875
    8   HD12  LEU  86          HD13      LEU  86   6.863   6.206  -2.685
    9   HD23  LEU  86          HD21      LEU  86   5.587   4.754  -1.606
   10   HD22  LEU  86          HD22      LEU  86   5.424   6.017  -0.389
   11   HD21  LEU  86          HD23      LEU  86   5.782   4.363   0.103

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ALA  87           H        ALA  87   9.539   3.018   1.711
    2    HA   ALA  87           HA       ALA  87   9.031   4.943   3.681
    3    HB1  ALA  87           HB1      ALA  87   9.770   2.104   3.594
    4    HB3  ALA  87           HB2      ALA  87   8.661   2.942   4.677
    5    HB2  ALA  87           HB3      ALA  87  10.389   2.931   5.027

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ARG  88           H        ARG  88  12.082   3.445   2.708
    2    HA   ARG  88           HA       ARG  88  13.719   4.781   4.547
    3    HB2  ARG  88           HB2      ARG  88  14.343   2.794   3.143
    4    HB3  ARG  88           HB3      ARG  88  14.526   3.884   1.772
    5    HG2  ARG  88           HG2      ARG  88  16.025   5.160   3.724
    6    HG3  ARG  88           HG3      ARG  88  16.303   3.463   4.102
    7    HD2  ARG  88           HD2      ARG  88  17.568   3.137   2.259
    8    HD3  ARG  88           HD3      ARG  88  16.456   4.037   1.223
    9    HE   ARG  88           HE       ARG  88  18.872   5.041   2.279
   10   HH21  ARG  88          HH11      ARG  88  19.272   7.251   2.087
   11   HH22  ARG  88          HH12      ARG  88  17.948   8.355   1.941
   12   HH11  ARG  88          HH21      ARG  88  15.554   5.876   1.992
   13   HH12  ARG  88          HH22      ARG  88  15.841   7.574   1.863

  No H/Q in entry =          13
  In of MODEL   78
    1    H    GLU  89           H        GLU  89  12.777   5.706   1.222
    2    HA   GLU  89           HA       GLU  89  14.381   8.028   1.072
    3    HB2  GLU  89           HB2      GLU  89  13.218   7.017  -0.880
    4    HB3  GLU  89           HB3      GLU  89  11.685   7.595  -0.226
    5    HG2  GLU  89           HG2      GLU  89  12.444   9.915  -0.384
    6    HG3  GLU  89           HG3      GLU  89  14.037   9.386  -0.917

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LEU  90           H        LEU  90  11.037   7.598   2.192
    2    HA   LEU  90           HA       LEU  90  10.587  10.343   2.769
    3    HB2  LEU  90           HB2      LEU  90   9.328   7.798   3.790
    4    HB3  LEU  90           HB3      LEU  90   8.735   9.408   4.213
    5    HG   LEU  90           HG       LEU  90   9.139   8.521   1.344
    6   HD12  LEU  90          HD11      LEU  90   6.598   8.254   1.399
    7   HD11  LEU  90          HD12      LEU  90   6.748   8.238   3.156
    8   HD13  LEU  90          HD13      LEU  90   7.539   6.990   2.192
    9   HD22  LEU  90          HD21      LEU  90   8.902  10.836   1.272
   10   HD21  LEU  90          HD22      LEU  90   7.912  10.890   2.729
   11   HD23  LEU  90          HD23      LEU  90   7.206  10.354   1.205

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  91           H        ILE  91  11.779   7.630   4.691
    2    HA   ILE  91           HA       ILE  91  11.946   8.988   7.161
    3    HB   ILE  91           HB       ILE  91  13.446   6.614   6.039
    4   HG12  ILE  91          HG12      ILE  91  11.428   6.828   8.294
    5   HG13  ILE  91          HG13      ILE  91  10.956   6.560   6.617
    6   HG22  ILE  91          HG21      ILE  91  13.903   6.386   8.681
    7   HG21  ILE  91          HG22      ILE  91  13.871   8.146   8.582
    8   HG23  ILE  91          HG23      ILE  91  15.030   7.231   7.619
    9   HD13  ILE  91          HD11      ILE  91  11.907   4.435   6.547
   10   HD12  ILE  91          HD12      ILE  91  11.311   4.506   8.205
   11   HD11  ILE  91          HD13      ILE  91  13.021   4.778   7.872

  No H/Q in entry =          11
  In of MODEL   78
    1    H    THR  92           H        THR  92  14.166   8.768   4.415
    2    HA   THR  92           HA       THR  92  16.361  10.107   5.582
    3    HB   THR  92           HB       THR  92  15.380  10.009   2.719
    4    HG1  THR  92           HG1      THR  92  16.164   8.092   3.124
    5   HG22  THR  92          HG21      THR  92  17.967  10.637   2.433
    6   HG21  THR  92          HG22      THR  92  17.674  11.464   3.962
    7   HG23  THR  92          HG23      THR  92  16.718  11.876   2.539

  No H/Q in entry =           7
  In of MODEL   78
    1    H    GLU  93           H        GLU  93  13.507  11.332   3.847
    2    HA   GLU  93           HA       GLU  93  14.168  14.078   3.966
    3    HB2  GLU  93           HB2      GLU  93  11.432  12.771   3.971
    4    HB3  GLU  93           HB3      GLU  93  11.762  14.463   3.602
    5    HG2  GLU  93           HG2      GLU  93  13.049  12.191   2.075
    6    HG3  GLU  93           HG3      GLU  93  11.521  12.911   1.585

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LEU  94           H        LEU  94  12.368  11.962   6.170
    2    HA   LEU  94           HA       LEU  94  11.601  13.925   8.046
    3    HB2  LEU  94           HB2      LEU  94  12.105  10.957   8.318
    4    HB3  LEU  94           HB3      LEU  94  11.553  11.945   9.668
    5    HG   LEU  94           HG       LEU  94  10.078  12.035   7.036
    6   HD11  LEU  94          HD11      LEU  94  10.102   9.811   9.038
    7   HD13  LEU  94          HD12      LEU  94   9.803   9.758   7.302
    8   HD12  LEU  94          HD13      LEU  94   8.535  10.305   8.398
    9   HD23  LEU  94          HD21      LEU  94   8.165  12.479   8.632
   10   HD22  LEU  94          HD22      LEU  94   9.433  13.703   8.673
   11   HD21  LEU  94          HD23      LEU  94   9.338  12.487   9.946

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  95           H        ILE  95  14.528  11.925   7.815
    2    HA   ILE  95           HA       ILE  95  15.712  12.816  10.232
    3    HB   ILE  95           HB       ILE  95  16.931  11.720   7.686
    4   HG12  ILE  95          HG12      ILE  95  16.599  10.524  10.452
    5   HG13  ILE  95          HG13      ILE  95  15.430  10.295   9.153
    6   HG21  ILE  95          HG21      ILE  95  18.199  12.493  10.332
    7   HG23  ILE  95          HG22      ILE  95  18.678  13.011   8.715
    8   HG22  ILE  95          HG23      ILE  95  18.943  11.344   9.222
    9   HD13  ILE  95          HD11      ILE  95  16.882   8.982   7.893
   10   HD12  ILE  95          HD12      ILE  95  17.339   8.520   9.529
   11   HD11  ILE  95          HD13      ILE  95  18.323   9.677   8.634

  No H/Q in entry =          11
  In of MODEL   78
    1    H    GLU  96           H        GLU  96  15.904  14.049   6.900
    2    HA   GLU  96           HA       GLU  96  17.800  16.081   7.383
    3    HB2  GLU  96           HB2      GLU  96  17.125  15.438   5.122
    4    HB3  GLU  96           HB3      GLU  96  15.495  16.034   5.419
    5    HG2  GLU  96           HG2      GLU  96  16.114  18.150   4.880
    6    HG3  GLU  96           HG3      GLU  96  17.409  18.117   6.066

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LEU  97           H        LEU  97  14.284  15.979   7.804
    2    HA   LEU  97           HA       LEU  97  13.932  18.721   8.448
    3    HB2  LEU  97           HB2      LEU  97  12.352  16.233   9.056
    4    HB3  LEU  97           HB3      LEU  97  11.875  17.791   9.728
    5    HG   LEU  97           HG       LEU  97  12.355  17.366   6.764
    6   HD12  LEU  97          HD11      LEU  97   9.829  17.300   6.640
    7   HD11  LEU  97          HD12      LEU  97   9.814  17.098   8.390
    8   HD13  LEU  97          HD13      LEU  97  10.567  15.874   7.368
    9   HD23  LEU  97          HD21      LEU  97  10.665  19.372   6.794
   10   HD22  LEU  97          HD22      LEU  97  12.353  19.690   7.191
   11   HD21  LEU  97          HD23      LEU  97  11.158  19.547   8.478

  No H/Q in entry =          11
  In of MODEL   78
    1    H    HIS  98           H        HIS  98  14.681  15.874  10.443
    2    HA   HIS  98           HA       HIS  98  14.548  17.135  12.960
    3    HB2  HIS  98           HB2      HIS  98  16.244  14.837  11.959
    4    HB3  HIS  98           HB3      HIS  98  16.252  15.374  13.641
    5    HD1  HIS  98           HD1      HIS  98  14.020  13.801  11.042
    6    HD2  HIS  98           HD2      HIS  98  13.926  14.719  15.108
    7    HE1  HIS  98           HE1      HIS  98  11.964  12.655  11.989
    8    HE2  HIS  98           HE2      HIS  98  11.887  13.206  14.460

  No H/Q in entry =           8
  In of MODEL   78
    1    H    GLU  99           H        GLU  99  17.103  16.961  10.530
    2    HA   GLU  99           HA       GLU  99  19.117  18.242  12.066
    3    HB2  GLU  99           HB2      GLU  99  19.569  16.945   9.996
    4    HB3  GLU  99           HB3      GLU  99  18.792  18.221   9.055
    5    HG2  GLU  99           HG2      GLU  99  20.439  19.850   9.851
    6    HG3  GLU  99           HG3      GLU  99  21.186  18.628  10.874

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LYS 100           H        LYS 100  16.627  19.468   9.845
    2    HA   LYS 100           HA       LYS 100  17.492  22.185   9.994
    3    HB2  LYS 100           HB2      LYS 100  14.829  20.962   9.232
    4    HB3  LYS 100           HB3      LYS 100  15.172  22.693   9.144
    5    HG2  LYS 100           HG2      LYS 100  17.136  22.197   7.681
    6    HG3  LYS 100           HG3      LYS 100  16.680  20.491   7.696
    7    HD2  LYS 100           HD2      LYS 100  14.500  21.056   6.692
    8    HD3  LYS 100           HD3      LYS 100  14.939  22.764   6.684
    9    HE2  LYS 100           HE2      LYS 100  16.889  22.237   5.228
   10    HE3  LYS 100           HE3      LYS 100  16.382  20.545   5.192
   11    HZ1  LYS 100           HZ1      LYS 100  14.613  22.783   4.356
   12    HZ3  LYS 100           HZ2      LYS 100  14.388  21.119   4.091
   13    HZ2  LYS 100           HZ3      LYS 100  15.622  21.951   3.273

  No H/Q in entry =          13
  In of MODEL   78
    1    H    LEU 101           H        LEU 101  15.340  20.189  11.952
    2    HA   LEU 101           HA       LEU 101  14.222  22.284  13.531
    3    HB2  LEU 101           HB2      LEU 101  14.590  19.323  13.912
    4    HB3  LEU 101           HB3      LEU 101  14.075  20.315  15.273
    5    HG   LEU 101           HG       LEU 101  12.666  20.442  12.601
    6   HD12  LEU 101          HD11      LEU 101  10.965  18.918  13.864
    7   HD11  LEU 101          HD12      LEU 101  12.347  18.470  14.861
    8   HD13  LEU 101          HD13      LEU 101  12.377  18.164  13.124
    9   HD21  LEU 101          HD21      LEU 101  12.023  21.247  15.452
   10   HD23  LEU 101          HD22      LEU 101  10.759  21.055  14.239
   11   HD22  LEU 101          HD23      LEU 101  12.025  22.259  14.005

  No H/Q in entry =          11
  In of MODEL   78
    1    H    LYS 102           H        LYS 102  17.354  21.598  13.100
    2    HA   LYS 102           HA       LYS 102  19.219  22.421  14.177
    3    HB2  LYS 102           HB2      LYS 102  17.441  23.979  15.309
    4    HB3  LYS 102           HB3      LYS 102  17.619  22.910  16.685
    5    HG2  LYS 102           HG2      LYS 102  19.564  24.875  15.522
    6    HG3  LYS 102           HG3      LYS 102  19.171  24.568  17.200
    7    HD2  LYS 102           HD2      LYS 102  20.793  22.616  15.515
    8    HD3  LYS 102           HD3      LYS 102  21.513  23.920  16.451
    9    HE2  LYS 102           HE2      LYS 102  21.049  21.380  17.416
   10    HE3  LYS 102           HE3      LYS 102  21.302  22.815  18.409
   11    HZ2  LYS 102           HZ1      LYS 102  19.300  21.580  19.022
   12    HZ1  LYS 102           HZ2      LYS 102  18.665  21.828  17.472
   13    HZ3  LYS 102           HZ3      LYS 102  18.927  23.151  18.500

  No H/Q in entry =          13
  In of MODEL   78
    1    H    ALA 103           H        ALA 103  17.103  20.865  16.593
    2    HA   ALA 103           HA       ALA 103  18.796  19.609  18.250
    3    HB2  ALA 103           HB1      ALA 103  17.161  17.642  18.238
    4    HB1  ALA 103           HB2      ALA 103  16.290  18.519  16.980
    5    HB3  ALA 103           HB3      ALA 103  16.483  19.233  18.580

  No H/Q in entry =           5
  In of MODEL   78
    1    H1   ALA   1           H3       ALA   1  -1.718  -6.683 -21.449
    2    H2   ALA   1           H2       ALA   1  -2.550  -8.098 -20.999
    3    H3   ALA   1           H1       ALA   1  -0.943  -8.188 -21.551
    4    HA   ALA   1           HA       ALA   1  -1.784  -8.633 -23.550
    5    HB1  ALA   1           HB1      ALA   1  -3.940  -9.297 -23.082
    6    HB2  ALA   1           HB2      ALA   1  -4.338  -7.775 -23.878
    7    HB3  ALA   1           HB3      ALA   1  -4.283  -7.859 -22.119

  No H/Q in entry =           7
  In of MODEL   78
    1    H    GLU   2           H        GLU   2  -2.579  -7.419 -25.539
    2    HA   GLU   2           HA       GLU   2  -1.127  -5.441 -26.411
    3    HB2  GLU   2           HB2      GLU   2  -4.134  -5.430 -26.735
    4    HB3  GLU   2           HB3      GLU   2  -2.989  -4.595 -27.781
    5    HG2  GLU   2           HG2      GLU   2  -2.532  -6.495 -28.938
    6    HG3  GLU   2           HG3      GLU   2  -2.261  -7.410 -27.461

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLU   3           H        GLU   3  -4.256  -4.104 -25.516
    2    HA   GLU   3           HA       GLU   3  -3.146  -1.577 -24.881
    3    HB2  GLU   3           HB2      GLU   3  -5.867  -2.823 -24.558
    4    HB3  GLU   3           HB3      GLU   3  -5.529  -1.217 -23.908
    5    HG2  GLU   3           HG2      GLU   3  -5.145  -0.296 -26.032
    6    HG3  GLU   3           HG3      GLU   3  -4.788  -1.860 -26.758

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LEU   4           H        LEU   4  -4.801  -3.897 -22.709
    2    HA   LEU   4           HA       LEU   4  -4.411  -2.683 -20.315
    3    HB2  LEU   4           HB2      LEU   4  -3.943  -5.636 -20.788
    4    HB3  LEU   4           HB3      LEU   4  -4.333  -4.882 -19.244
    5    HG   LEU   4           HG       LEU   4  -6.101  -4.906 -21.712
    6   HD13  LEU   4          HD11      LEU   4  -7.340  -6.594 -20.720
    7   HD12  LEU   4          HD12      LEU   4  -6.848  -6.150 -19.087
    8   HD11  LEU   4          HD13      LEU   4  -5.731  -7.020 -20.137
    9   HD23  LEU   4          HD21      LEU   4  -7.769  -4.055 -19.847
   10   HD22  LEU   4          HD22      LEU   4  -6.699  -2.910 -20.653
   11   HD21  LEU   4          HD23      LEU   4  -6.292  -3.513 -19.048

  No H/Q in entry =          11
  In of MODEL   78
    1    H    GLU   5           H        GLU   5  -1.957  -4.587 -22.043
    2    HA   GLU   5           HA       GLU   5   0.028  -4.357 -20.001
    3    HB2  GLU   5           HB2      GLU   5   0.034  -6.120 -21.776
    4    HB3  GLU   5           HB3      GLU   5   0.424  -4.874 -22.962
    5    HG2  GLU   5           HG2      GLU   5   2.496  -5.905 -22.297
    6    HG3  GLU   5           HG3      GLU   5   2.451  -4.302 -21.563

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLU   6           H        GLU   6  -0.555  -2.623 -23.045
    2    HA   GLU   6           HA       GLU   6   1.660  -0.848 -22.769
    3    HB2  GLU   6           HB2      GLU   6  -0.896  -0.668 -24.379
    4    HB3  GLU   6           HB3      GLU   6   0.415   0.505 -24.490
    5    HG2  GLU   6           HG2      GLU   6   1.971  -1.237 -25.188
    6    HG3  GLU   6           HG3      GLU   6   0.733  -2.470 -24.970

  No H/Q in entry =           6
  In of MODEL   78
    1    H    VAL   7           H        VAL   7  -1.681  -0.835 -21.732
    2    HA   VAL   7           HA       VAL   7  -1.835   1.881 -20.892
    3    HB   VAL   7           HB       VAL   7  -3.363  -0.600 -20.063
    4   HG11  VAL   7          HG11      VAL   7  -3.666   2.297 -19.245
    5   HG13  VAL   7          HG12      VAL   7  -3.606   0.868 -18.212
    6   HG12  VAL   7          HG13      VAL   7  -5.028   1.176 -19.207
    7   HG21  VAL   7          HG21      VAL   7  -3.487   0.484 -22.450
    8   HG23  VAL   7          HG22      VAL   7  -4.402   1.756 -21.638
    9   HG22  VAL   7          HG23      VAL   7  -4.990   0.093 -21.615

  No H/Q in entry =           9
  In of MODEL   78
    1    H    VAL   8           H        VAL   8  -0.928  -1.131 -19.251
    2    HA   VAL   8           HA       VAL   8  -0.589  -0.064 -16.653
    3    HB   VAL   8           HB       VAL   8   0.759  -2.413 -18.009
    4   HG11  VAL   8          HG11      VAL   8   0.907  -1.317 -15.211
    5   HG13  VAL   8          HG12      VAL   8   2.204  -1.944 -16.228
    6   HG12  VAL   8          HG13      VAL   8   1.054  -3.053 -15.481
    7   HG23  VAL   8          HG21      VAL   8  -1.224  -2.812 -15.827
    8   HG22  VAL   8          HG22      VAL   8  -1.050  -3.668 -17.355
    9   HG21  VAL   8          HG23      VAL   8  -1.894  -2.125 -17.305

  No H/Q in entry =           9
  In of MODEL   78
    1    H    MET   9           H        MET   9   1.658  -0.419 -19.396
    2    HA   MET   9           HA       MET   9   3.968   0.562 -18.127
    3    HB2  MET   9           HB2      MET   9   3.028   0.624 -20.994
    4    HB3  MET   9           HB3      MET   9   4.564   1.340 -20.510
    5    HG2  MET   9           HG2      MET   9   5.273  -0.822 -19.551
    6    HG3  MET   9           HG3      MET   9   3.737  -1.540 -20.039
    7    HE3  MET   9           HE1      MET   9   7.179  -0.058 -22.640
    8    HE2  MET   9           HE2      MET   9   7.427  -1.015 -21.182
    9    HE1  MET   9           HE3      MET   9   6.640   0.557 -21.074

  No H/Q in entry =           9
  In of MODEL   78
    1    H    GLY  10           H        GLY  10   1.330   2.237 -19.808
    2    HA3  GLY  10           HA2      GLY  10   2.363   4.864 -19.557
    3    HA2  GLY  10           HA3      GLY  10   0.662   4.449 -19.766

  No H/Q in entry =           3
  In of MODEL   78
    1    H    LEU  11           H        LEU  11   0.218   2.929 -17.484
    2    HA   LEU  11           HA       LEU  11  -0.264   4.916 -15.522
    3    HB2  LEU  11           HB2      LEU  11  -0.277   1.900 -15.371
    4    HB3  LEU  11           HB3      LEU  11  -0.761   2.934 -14.027
    5    HG   LEU  11           HG       LEU  11  -1.991   3.085 -16.793
    6   HD13  LEU  11          HD11      LEU  11  -2.634   0.957 -16.043
    7   HD12  LEU  11          HD12      LEU  11  -3.958   1.984 -15.498
    8   HD11  LEU  11          HD13      LEU  11  -2.718   1.468 -14.356
    9   HD22  LEU  11          HD21      LEU  11  -2.530   5.114 -15.784
   10   HD21  LEU  11          HD22      LEU  11  -2.476   4.444 -14.154
   11   HD23  LEU  11          HD23      LEU  11  -3.858   4.116 -15.199

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  12           H        ILE  12   2.213   2.383 -15.764
    2    HA   ILE  12           HA       ILE  12   3.428   2.883 -13.257
    3    HB   ILE  12           HB       ILE  12   4.658   1.814 -15.819
    4   HG12  ILE  12          HG12      ILE  12   2.611   0.634 -14.687
    5   HG13  ILE  12          HG13      ILE  12   3.990  -0.339 -15.160
    6   HG23  ILE  12          HG21      ILE  12   6.449   2.466 -14.357
    7   HG22  ILE  12          HG22      ILE  12   6.277   0.720 -14.184
    8   HG21  ILE  12          HG23      ILE  12   5.628   1.795 -12.948
    9   HD13  ILE  12          HD11      ILE  12   4.794  -0.360 -12.873
   10   HD12  ILE  12          HD12      ILE  12   3.101  -0.851 -12.876
   11   HD11  ILE  12          HD13      ILE  12   3.543   0.770 -12.386

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  13           H        ILE  13   4.068   4.136 -16.511
    2    HA   ILE  13           HA       ILE  13   6.250   5.796 -15.779
    3    HB   ILE  13           HB       ILE  13   4.226   5.934 -18.028
    4   HG12  ILE  13          HG12      ILE  13   6.012   4.046 -17.752
    5   HG13  ILE  13          HG13      ILE  13   5.797   4.801 -19.328
    6   HG22  ILE  13          HG21      ILE  13   6.014   7.468 -19.096
    7   HG21  ILE  13          HG22      ILE  13   6.608   7.715 -17.458
    8   HG23  ILE  13          HG23      ILE  13   4.961   8.184 -17.875
    9   HD13  ILE  13          HD11      ILE  13   7.756   6.212 -18.984
   10   HD12  ILE  13          HD12      ILE  13   8.204   4.548 -18.630
   11   HD11  ILE  13          HD13      ILE  13   7.889   5.670 -17.312

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ASN  14           H        ASN  14   2.759   6.386 -16.052
    2    HA   ASN  14           HA       ASN  14   2.789   9.131 -15.410
    3    HB2  ASN  14           HB2      ASN  14   0.854   7.542 -16.247
    4    HB3  ASN  14           HB3      ASN  14   0.525   7.370 -14.527
    5   HD21  ASN  14          HD21      ASN  14  -1.460   8.582 -15.961
    6   HD22  ASN  14          HD22      ASN  14  -1.478  10.256 -15.690

  No H/Q in entry =           6
  In of MODEL   78
    1    H    SER  15           H        SER  15   2.413   6.260 -13.339
    2    HA   SER  15           HA       SER  15   2.140   7.634 -10.889
    3    HB2  SER  15           HB2      SER  15   2.633   5.532  -9.842
    4    HB3  SER  15           HB3      SER  15   1.792   5.138 -11.338
    5    HG   SER  15           HG       SER  15   4.405   4.692 -10.592

  No H/Q in entry =           5
  In of MODEL   78
    1    H    GLY  16           H        GLY  16   4.988   6.463 -12.645
    2    HA3  GLY  16           HA2      GLY  16   6.929   7.165 -10.710
    3    HA2  GLY  16           HA3      GLY  16   7.230   6.957 -12.434

  No H/Q in entry =           3
  In of MODEL   78
    1    H    GLN  17           H        GLN  17   5.595   8.961 -13.496
    2    HA   GLN  17           HA       GLN  17   7.232  11.259 -13.181
    3    HB2  GLN  17           HB2      GLN  17   4.477  10.901 -14.389
    4    HB3  GLN  17           HB3      GLN  17   5.369  12.421 -14.452
    5    HG2  GLN  17           HG2      GLN  17   6.410   9.776 -15.504
    6    HG3  GLN  17           HG3      GLN  17   5.685  11.035 -16.502
    7   HE21  GLN  17          HE21      GLN  17   8.647   9.870 -15.759
    8   HE22  GLN  17          HE22      GLN  17   9.559  11.302 -15.810

  No H/Q in entry =           8
  In of MODEL   78
    1    H    ALA  18           H        ALA  18   4.104  10.321 -11.839
    2    HA   ALA  18           HA       ALA  18   3.439  12.725 -10.570
    3    HB1  ALA  18           HB1      ALA  18   2.247  10.299 -10.798
    4    HB2  ALA  18           HB2      ALA  18   1.729  11.531  -9.650
    5    HB3  ALA  18           HB3      ALA  18   2.784  10.220  -9.121

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ARG  19           H        ARG  19   5.239   9.913  -9.293
    2    HA   ARG  19           HA       ARG  19   5.797  11.053  -6.768
    3    HB2  ARG  19           HB2      ARG  19   6.150   8.641  -7.298
    4    HB3  ARG  19           HB3      ARG  19   7.520   9.093  -8.316
    5    HG2  ARG  19           HG2      ARG  19   8.663  10.101  -6.390
    6    HG3  ARG  19           HG3      ARG  19   7.276   9.747  -5.362
    7    HD2  ARG  19           HD2      ARG  19   8.995   8.066  -5.004
    8    HD3  ARG  19           HD3      ARG  19   7.602   7.321  -5.793
    9    HE   ARG  19           HE       ARG  19   9.331   8.099  -7.836
   10   HH21  ARG  19          HH11      ARG  19  10.856   6.656  -8.686
   11   HH22  ARG  19          HH12      ARG  19  11.366   5.293  -7.752
   12   HH11  ARG  19          HH21      ARG  19   9.346   6.063  -5.061
   13   HH12  ARG  19          HH22      ARG  19  10.508   4.957  -5.698

  No H/Q in entry =          13
  In of MODEL   78
    1    H    SER  20           H        SER  20   7.620  11.041  -9.814
    2    HA   SER  20           HA       SER  20   9.898  12.398  -8.984
    3    HB2  SER  20           HB2      SER  20   9.911  11.525 -11.189
    4    HB3  SER  20           HB3      SER  20   8.434  12.380 -11.618
    5    HG   SER  20           HG       SER  20  10.705  13.806 -10.774

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LEU  21           H        LEU  21   6.834  13.746 -10.184
    2    HA   LEU  21           HA       LEU  21   7.572  16.474  -9.954
    3    HB2  LEU  21           HB2      LEU  21   4.870  15.116  -9.883
    4    HB3  LEU  21           HB3      LEU  21   5.078  16.865  -9.880
    5    HG   LEU  21           HG       LEU  21   6.237  15.051 -12.015
    6   HD13  LEU  21          HD11      LEU  21   3.857  14.833 -12.185
    7   HD12  LEU  21          HD12      LEU  21   4.335  16.008 -13.412
    8   HD11  LEU  21          HD13      LEU  21   3.613  16.557 -11.900
    9   HD21  LEU  21          HD21      LEU  21   6.080  18.026 -11.574
   10   HD23  LEU  21          HD22      LEU  21   6.054  17.422 -13.228
   11   HD22  LEU  21          HD23      LEU  21   7.427  17.074 -12.191

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ALA  22           H        ALA  22   6.000  14.219  -7.712
    2    HA   ALA  22           HA       ALA  22   5.438  16.038  -5.643
    3    HB3  ALA  22           HB1      ALA  22   4.619  13.665  -5.811
    4    HB2  ALA  22           HB2      ALA  22   5.216  14.120  -4.215
    5    HB1  ALA  22           HB3      ALA  22   6.218  13.138  -5.286

  No H/Q in entry =           5
  In of MODEL   78
    1    H    TYR  23           H        TYR  23   8.323  13.942  -6.080
    2    HA   TYR  23           HA       TYR  23   9.726  14.924  -3.823
    3    HB2  TYR  23           HB2      TYR  23  10.466  12.900  -4.984
    4    HB3  TYR  23           HB3      TYR  23  10.805  13.833  -6.441
    5    HD1  TYR  23           HD1      TYR  23  11.765  13.431  -2.858
    6    HD2  TYR  23           HD2      TYR  23  12.857  14.990  -6.710
    7    HE1  TYR  23           HE1      TYR  23  14.034  13.952  -2.005
    8    HE2  TYR  23           HE2      TYR  23  15.126  15.513  -5.856
    9    HH   TYR  23           HH       TYR  23  16.304  15.841  -3.853

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ALA  24           H        ALA  24   9.575  16.040  -7.188
    2    HA   ALA  24           HA       ALA  24  11.519  18.080  -6.936
    3    HB2  ALA  24           HB1      ALA  24  11.082  18.156  -9.145
    4    HB3  ALA  24           HB2      ALA  24   9.544  18.941  -8.787
    5    HB1  ALA  24           HB3      ALA  24   9.629  17.186  -8.920

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ALA  25           H        ALA  25   8.036  17.976  -6.321
    2    HA   ALA  25           HA       ALA  25   7.618  20.703  -5.748
    3    HB1  ALA  25           HB1      ALA  25   5.912  18.744  -5.955
    4    HB2  ALA  25           HB2      ALA  25   5.572  20.039  -4.805
    5    HB3  ALA  25           HB3      ALA  25   6.225  18.502  -4.235

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LEU  26           H        LEU  26   8.621  17.997  -3.700
    2    HA   LEU  26           HA       LEU  26   8.755  19.421  -1.261
    3    HB2  LEU  26           HB2      LEU  26   8.795  17.003  -1.259
    4    HB3  LEU  26           HB3      LEU  26  10.267  16.979  -2.227
    5    HG   LEU  26           HG       LEU  26  11.504  18.067  -0.384
    6   HD12  LEU  26          HD11      LEU  26  10.274  18.099   1.874
    7   HD11  LEU  26          HD12      LEU  26   8.786  17.996   0.937
    8   HD13  LEU  26          HD13      LEU  26   9.862  19.378   0.732
    9   HD21  LEU  26          HD21      LEU  26   9.913  15.633   0.483
   10   HD23  LEU  26          HD22      LEU  26  11.440  16.160   1.184
   11   HD22  LEU  26          HD23      LEU  26  11.385  15.604  -0.487

  No H/Q in entry =          11
  In of MODEL   78
    1    H    LYS  27           H        LYS  27  11.162  18.798  -3.783
    2    HA   LYS  27           HA       LYS  27  13.372  19.988  -2.550
    3    HB2  LYS  27           HB2      LYS  27  13.446  18.642  -4.641
    4    HB3  LYS  27           HB3      LYS  27  12.713  19.992  -5.506
    5    HG2  LYS  27           HG2      LYS  27  14.610  21.435  -4.923
    6    HG3  LYS  27           HG3      LYS  27  15.340  20.125  -3.987
    7    HD2  LYS  27           HD2      LYS  27  15.455  18.737  -6.043
    8    HD3  LYS  27           HD3      LYS  27  14.771  20.072  -6.971
    9    HE2  LYS  27           HE2      LYS  27  16.689  21.495  -6.353
   10    HE3  LYS  27           HE3      LYS  27  17.378  20.164  -5.416
   11    HZ3  LYS  27           HZ1      LYS  27  18.373  20.245  -7.601
   12    HZ2  LYS  27           HZ2      LYS  27  16.846  20.161  -8.344
   13    HZ1  LYS  27           HZ3      LYS  27  17.438  18.836  -7.461

  No H/Q in entry =          13
  In of MODEL   78
    1    H    GLN  28           H        GLN  28  10.783  21.430  -4.500
    2    HA   GLN  28           HA       GLN  28  11.801  24.061  -4.648
    3    HB2  GLN  28           HB2      GLN  28   8.944  23.055  -4.540
    4    HB3  GLN  28           HB3      GLN  28   9.396  24.717  -4.918
    5    HG2  GLN  28           HG2      GLN  28  10.322  22.274  -6.457
    6    HG3  GLN  28           HG3      GLN  28   9.031  23.360  -6.968
    7   HE21  GLN  28          HE21      GLN  28  12.159  22.744  -7.671
    8   HE22  GLN  28          HE22      GLN  28  12.705  24.309  -8.042

  No H/Q in entry =           8
  In of MODEL   78
    1    H    ALA  29           H        ALA  29   9.829  22.408  -2.217
    2    HA   ALA  29           HA       ALA  29   9.325  24.609  -0.533
    3    HB2  ALA  29           HB1      ALA  29   8.559  23.055   1.032
    4    HB1  ALA  29           HB2      ALA  29   9.756  21.845   0.567
    5    HB3  ALA  29           HB3      ALA  29   8.378  22.170  -0.483

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LYS  30           H        LYS  30  12.005  22.284  -0.602
    2    HA   LYS  30           HA       LYS  30  13.340  23.206   1.704
    3    HB2  LYS  30           HB2      LYS  30  14.412  21.900  -0.806
    4    HB3  LYS  30           HB3      LYS  30  15.400  22.236   0.617
    5    HG2  LYS  30           HG2      LYS  30  13.815  20.885   1.993
    6    HG3  LYS  30           HG3      LYS  30  12.924  20.484   0.521
    7    HD2  LYS  30           HD2      LYS  30  14.948  19.455  -0.438
    8    HD3  LYS  30           HD3      LYS  30  15.859  19.869   1.015
    9    HE2  LYS  30           HE2      LYS  30  14.322  18.469   2.366
   10    HE3  LYS  30           HE3      LYS  30  13.440  18.034   0.896
   11    HZ2  LYS  30           HZ1      LYS  30  15.197  16.417   1.657
   12    HZ1  LYS  30           HZ2      LYS  30  16.360  17.580   1.209
   13    HZ3  LYS  30           HZ3      LYS  30  15.311  16.920   0.042

  No H/Q in entry =          13
  In of MODEL   78
    1    H    GLN  31           H        GLN  31  13.262  24.417  -1.591
    2    HA   GLN  31           HA       GLN  31  15.454  26.263  -1.164
    3    HB2  GLN  31           HB2      GLN  31  13.416  26.357  -3.391
    4    HB3  GLN  31           HB3      GLN  31  15.050  27.017  -3.389
    5    HG2  GLN  31           HG2      GLN  31  15.454  24.311  -2.816
    6    HG3  GLN  31           HG3      GLN  31  14.151  24.287  -3.997
    7   HE21  GLN  31          HE21      GLN  31  16.977  23.433  -4.398
    8   HE22  GLN  31          HE22      GLN  31  17.572  24.396  -5.662

  No H/Q in entry =           8
  In of MODEL   78
    1    H    GLY  32           H        GLY  32  12.375  26.145  -0.023
    2    HA3  GLY  32           HA2      GLY  32  11.251  27.736   1.251
    3    HA2  GLY  32           HA3      GLY  32  12.403  28.948   0.704

  No H/Q in entry =           3
  In of MODEL   78
    1    H    ASP  33           H        ASP  33  11.002  27.077  -1.793
    2    HA   ASP  33           HA       ASP  33   9.388  29.386  -2.647
    3    HB2  ASP  33           HB2      ASP  33  10.431  26.946  -4.092
    4    HB3  ASP  33           HB3      ASP  33   9.305  28.087  -4.822

  No H/Q in entry =           4
  In of MODEL   78
    1    H    PHE  34           H        PHE  34   7.687  28.944  -1.087
    2    HA   PHE  34           HA       PHE  34   6.255  26.502  -0.997
    3    HB2  PHE  34           HB2      PHE  34   5.353  29.308  -0.314
    4    HB3  PHE  34           HB3      PHE  34   4.472  27.836   0.094
    5    HD1  PHE  34           HD1      PHE  34   6.771  30.184   1.315
    6    HD2  PHE  34           HD2      PHE  34   6.000  25.959   1.254
    7    HE1  PHE  34           HE1      PHE  34   8.153  29.901   3.353
    8    HE2  PHE  34           HE2      PHE  34   7.385  25.680   3.291
    9    HZ   PHE  34           HZ       PHE  34   8.455  27.652   4.339

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ALA  35           H        ALA  35   5.889  29.377  -3.004
    2    HA   ALA  35           HA       ALA  35   3.326  28.819  -4.034
    3    HB1  ALA  35           HB1      ALA  35   4.411  30.191  -6.068
    4    HB3  ALA  35           HB2      ALA  35   5.634  30.525  -4.842
    5    HB2  ALA  35           HB3      ALA  35   3.952  30.969  -4.553

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ALA  36           H        ALA  36   6.542  28.079  -5.384
    2    HA   ALA  36           HA       ALA  36   5.526  26.674  -7.631
    3    HB3  ALA  36           HB1      ALA  36   7.688  26.753  -8.244
    4    HB2  ALA  36           HB2      ALA  36   8.145  25.713  -6.894
    5    HB1  ALA  36           HB3      ALA  36   8.077  27.462  -6.676

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ALA  37           H        ALA  37   6.456  25.655  -4.376
    2    HA   ALA  37           HA       ALA  37   6.338  22.869  -4.809
    3    HB2  ALA  37           HB1      ALA  37   6.112  24.662  -2.429
    4    HB1  ALA  37           HB2      ALA  37   7.218  23.321  -2.722
    5    HB3  ALA  37           HB3      ALA  37   5.548  23.002  -2.253

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LYS  38           H        LYS  38   3.851  25.129  -3.642
    2    HA   LYS  38           HA       LYS  38   1.714  23.361  -3.425
    3    HB2  LYS  38           HB2      LYS  38   2.123  26.109  -3.169
    4    HB3  LYS  38           HB3      LYS  38   0.923  25.989  -4.450
    5    HG2  LYS  38           HG2      LYS  38  -0.556  24.694  -3.011
    6    HG3  LYS  38           HG3      LYS  38   0.685  24.606  -1.753
    7    HD2  LYS  38           HD2      LYS  38   0.548  26.945  -1.303
    8    HD3  LYS  38           HD3      LYS  38  -0.356  27.256  -2.786
    9    HE2  LYS  38           HE2      LYS  38  -1.861  27.319  -0.849
   10    HE3  LYS  38           HE3      LYS  38  -2.263  25.953  -1.893
   11    HZ3  LYS  38           HZ1      LYS  38  -1.571  24.465  -0.361
   12    HZ2  LYS  38           HZ2      LYS  38  -1.896  25.728   0.730
   13    HZ1  LYS  38           HZ3      LYS  38  -0.306  25.444   0.206

  No H/Q in entry =          13
  In of MODEL   78
    1    H    ALA  39           H        ALA  39   2.737  25.246  -6.269
    2    HA   ALA  39           HA       ALA  39   0.646  24.425  -7.976
    3    HB2  ALA  39           HB1      ALA  39   3.397  25.017  -9.025
    4    HB1  ALA  39           HB2      ALA  39   2.456  26.297  -8.260
    5    HB3  ALA  39           HB3      ALA  39   1.828  25.475  -9.688

  No H/Q in entry =           5
  In of MODEL   78
    1    H    MET  40           H        MET  40   3.855  23.057  -7.394
    2    HA   MET  40           HA       MET  40   3.717  21.042  -9.388
    3    HB2  MET  40           HB2      MET  40   5.330  21.229  -6.837
    4    HB3  MET  40           HB3      MET  40   5.556  19.969  -8.053
    5    HG2  MET  40           HG2      MET  40   5.676  22.924  -8.714
    6    HG3  MET  40           HG3      MET  40   7.103  21.991  -8.264
    7    HE3  MET  40           HE1      MET  40   7.932  19.761 -11.075
    8    HE2  MET  40           HE2      MET  40   7.360  19.451  -9.439
    9    HE1  MET  40           HE3      MET  40   8.484  20.776  -9.735

  No H/Q in entry =           9
  In of MODEL   78
    1    H    MET  41           H        MET  41   2.799  21.099  -5.966
    2    HA   MET  41           HA       MET  41   2.208  18.346  -5.692
    3    HB2  MET  41           HB2      MET  41   0.923  20.729  -4.340
    4    HB3  MET  41           HB3      MET  41   0.732  19.054  -3.835
    5    HG2  MET  41           HG2      MET  41   3.446  19.220  -3.868
    6    HG3  MET  41           HG3      MET  41   3.040  20.887  -3.470
    7    HE2  MET  41           HE1      MET  41  -0.028  19.696  -1.751
    8    HE1  MET  41           HE2      MET  41   0.821  21.192  -2.125
    9    HE3  MET  41           HE3      MET  41   0.748  20.620  -0.458

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ASP  42           H        ASP  42   0.228  21.114  -6.665
    2    HA   ASP  42           HA       ASP  42  -2.240  19.804  -6.807
    3    HB2  ASP  42           HB2      ASP  42  -1.479  22.360  -7.059
    4    HB3  ASP  42           HB3      ASP  42  -1.636  21.970  -8.769

  No H/Q in entry =           4
  In of MODEL   78
    1    H    GLN  43           H        GLN  43   0.216  20.348  -9.305
    2    HA   GLN  43           HA       GLN  43  -1.195  19.060 -11.398
    3    HB2  GLN  43           HB2      GLN  43   1.773  19.515 -11.012
    4    HB3  GLN  43           HB3      GLN  43   1.048  18.892 -12.496
    5    HG2  GLN  43           HG2      GLN  43  -0.421  20.950 -12.537
    6    HG3  GLN  43           HG3      GLN  43   0.543  21.584 -11.207
    7   HE21  GLN  43          HE21      GLN  43   0.741  23.204 -13.290
    8   HE22  GLN  43          HE22      GLN  43   2.152  22.955 -14.196

  No H/Q in entry =           8
  In of MODEL   78
    1    H    SER  44           H        SER  44   1.128  17.869  -9.006
    2    HA   SER  44           HA       SER  44   1.411  15.257 -10.034
    3    HB2  SER  44           HB2      SER  44   2.332  16.674  -7.795
    4    HB3  SER  44           HB3      SER  44   1.440  15.308  -7.127
    5    HG   SER  44           HG       SER  44   3.539  14.645  -7.551

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ARG  45           H        ARG  45  -0.885  16.620  -7.698
    2    HA   ARG  45           HA       ARG  45  -2.320  14.287  -7.068
    3    HB2  ARG  45           HB2      ARG  45  -2.476  16.457  -5.873
    4    HB3  ARG  45           HB3      ARG  45  -3.316  17.143  -7.261
    5    HG2  ARG  45           HG2      ARG  45  -5.117  15.453  -6.982
    6    HG3  ARG  45           HG3      ARG  45  -4.288  14.822  -5.559
    7    HD2  ARG  45           HD2      ARG  45  -4.450  17.091  -4.500
    8    HD3  ARG  45           HD3      ARG  45  -5.424  17.633  -5.883
    9    HE   ARG  45           HE       ARG  45  -6.583  15.278  -4.848
   10   HH21  ARG  45          HH11      ARG  45  -8.419  15.389  -3.580
   11   HH22  ARG  45          HH12      ARG  45  -8.786  16.835  -2.709
   12   HH11  ARG  45          HH21      ARG  45  -5.974  18.512  -3.819
   13   HH12  ARG  45          HH22      ARG  45  -7.396  18.604  -2.843

  No H/Q in entry =          13
  In of MODEL   78
    1    H    MET  46           H        MET  46  -2.852  16.706  -9.616
    2    HA   MET  46           HA       MET  46  -5.213  15.582 -10.683
    3    HB2  MET  46           HB2      MET  46  -3.070  17.358 -11.867
    4    HB3  MET  46           HB3      MET  46  -4.481  16.845 -12.798
    5    HG2  MET  46           HG2      MET  46  -5.971  17.808 -11.097
    6    HG3  MET  46           HG3      MET  46  -4.581  18.292 -10.132
    7    HE3  MET  46           HE1      MET  46  -6.608  20.474 -10.709
    8    HE2  MET  46           HE2      MET  46  -5.567  21.785 -11.254
    9    HE1  MET  46           HE3      MET  46  -5.032  20.731  -9.947

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ALA  47           H        ALA  47  -1.793  15.035 -11.436
    2    HA   ALA  47           HA       ALA  47  -2.169  13.318 -13.650
    3    HB3  ALA  47           HB1      ALA  47   0.025  14.164 -13.293
    4    HB2  ALA  47           HB2      ALA  47   0.131  12.433 -12.962
    5    HB1  ALA  47           HB3      ALA  47   0.059  13.584 -11.627

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LEU  48           H        LEU  48  -1.918  12.673 -10.176
    2    HA   LEU  48           HA       LEU  48  -2.068   9.835 -10.339
    3    HB2  LEU  48           HB2      LEU  48  -2.797  11.765  -8.123
    4    HB3  LEU  48           HB3      LEU  48  -2.738  10.013  -7.925
    5    HG   LEU  48           HG       LEU  48  -0.405  11.668  -8.916
    6   HD13  LEU  48          HD11      LEU  48  -0.675  12.440  -6.725
    7   HD12  LEU  48          HD12      LEU  48   0.461  11.110  -6.527
    8   HD11  LEU  48          HD13      LEU  48  -1.242  10.880  -6.132
    9   HD22  LEU  48          HD21      LEU  48   0.052   9.474  -9.559
   10   HD21  LEU  48          HD22      LEU  48  -0.834   8.774  -8.206
   11   HD23  LEU  48          HD23      LEU  48   0.753   9.495  -7.942

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ASN  49           H        ASN  49  -4.482  12.375  -9.937
    2    HA   ASN  49           HA       ASN  49  -6.701  10.754  -9.404
    3    HB2  ASN  49           HB2      ASN  49  -6.726  13.168  -9.070
    4    HB3  ASN  49           HB3      ASN  49  -6.529  13.441 -10.797
    5   HD21  ASN  49          HD21      ASN  49  -8.776  11.854  -8.489
    6   HD22  ASN  49          HD22      ASN  49 -10.173  12.180  -9.395

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLU  50           H        GLU  50  -5.393  11.929 -12.487
    2    HA   GLU  50           HA       GLU  50  -7.369  10.714 -14.138
    3    HB2  GLU  50           HB2      GLU  50  -5.867  12.505 -14.947
    4    HB3  GLU  50           HB3      GLU  50  -4.494  11.406 -14.808
    5    HG2  GLU  50           HG2      GLU  50  -5.495   9.892 -16.449
    6    HG3  GLU  50           HG3      GLU  50  -6.936  10.899 -16.537

  No H/Q in entry =           6
  In of MODEL   78
    1    H    ALA  51           H        ALA  51  -4.221   9.658 -12.928
    2    HA   ALA  51           HA       ALA  51  -4.128   7.205 -14.349
    3    HB2  ALA  51           HB1      ALA  51  -2.155   6.876 -13.246
    4    HB1  ALA  51           HB2      ALA  51  -2.837   7.310 -11.680
    5    HB3  ALA  51           HB3      ALA  51  -2.354   8.573 -12.811

  No H/Q in entry =           5
  In of MODEL   78
    1    H    HIS  52           H        HIS  52  -5.289   8.055 -11.101
    2    HA   HIS  52           HA       HIS  52  -6.028   5.458 -10.275
    3    HB2  HIS  52           HB2      HIS  52  -5.852   7.431  -8.770
    4    HB3  HIS  52           HB3      HIS  52  -7.312   8.090  -9.508
    5    HD1  HIS  52           HD1      HIS  52  -9.561   6.839  -9.040
    6    HD2  HIS  52           HD2      HIS  52  -6.289   5.272  -6.989
    7    HE1  HIS  52           HE1      HIS  52 -10.499   5.285  -7.274
    8    HE2  HIS  52           HE2      HIS  52  -8.516   4.322  -6.014

  No H/Q in entry =           8
  In of MODEL   78
    1    H    LEU  53           H        LEU  53  -7.795   7.955 -12.063
    2    HA   LEU  53           HA       LEU  53 -10.326   6.713 -12.081
    3    HB2  LEU  53           HB2      LEU  53  -8.999   8.670 -13.946
    4    HB3  LEU  53           HB3      LEU  53 -10.610   8.037 -14.272
    5    HG   LEU  53           HG       LEU  53  -9.877   9.332 -11.627
    6   HD12  LEU  53          HD11      LEU  53 -11.095  11.337 -12.559
    7   HD11  LEU  53          HD12      LEU  53 -11.025  10.566 -14.144
    8   HD13  LEU  53          HD13      LEU  53  -9.539  11.024 -13.317
    9   HD23  LEU  53          HD21      LEU  53 -12.455   9.780 -11.778
   10   HD22  LEU  53          HD22      LEU  53 -11.902   8.172 -11.325
   11   HD21  LEU  53          HD23      LEU  53 -12.454   8.478 -12.960

  No H/Q in entry =          11
  In of MODEL   78
    1    H    VAL  54           H        VAL  54  -7.576   6.463 -14.314
    2    HA   VAL  54           HA       VAL  54  -8.831   4.720 -16.162
    3    HB   VAL  54           HB       VAL  54  -5.915   5.166 -15.473
    4   HG12  VAL  54          HG11      VAL  54  -5.685   4.080 -17.863
    5   HG11  VAL  54          HG12      VAL  54  -7.230   3.329 -17.463
    6   HG13  VAL  54          HG13      VAL  54  -5.822   3.045 -16.442
    7   HG22  VAL  54          HG21      VAL  54  -6.643   7.126 -16.517
    8   HG21  VAL  54          HG22      VAL  54  -7.852   6.289 -17.488
    9   HG23  VAL  54          HG23      VAL  54  -6.146   6.174 -17.915

  No H/Q in entry =           9
  In of MODEL   78
    1    H    GLN  55           H        GLN  55  -6.849   4.129 -13.259
    2    HA   GLN  55           HA       GLN  55  -6.817   1.312 -13.519
    3    HB2  GLN  55           HB2      GLN  55  -5.246   2.173 -11.995
    4    HB3  GLN  55           HB3      GLN  55  -6.444   3.163 -11.167
    5    HG2  GLN  55           HG2      GLN  55  -7.171   1.419  -9.853
    6    HG3  GLN  55           HG3      GLN  55  -6.968   0.229 -11.132
    7   HE21  GLN  55          HE21      GLN  55  -5.376  -1.254 -10.637
    8   HE22  GLN  55          HE22      GLN  55  -3.986  -0.932  -9.721

  No H/Q in entry =           8
  In of MODEL   78
    1    H    THR  56           H        THR  56  -9.106   3.520 -11.906
    2    HA   THR  56           HA       THR  56 -10.731   1.668 -10.622
    3    HB   THR  56           HB       THR  56 -11.772   4.081 -12.127
    4    HG1  THR  56           HG1      THR  56  -9.916   3.990 -10.267
    5   HG22  THR  56          HG21      THR  56 -13.406   4.116 -10.261
    6   HG21  THR  56          HG22      THR  56 -12.680   2.642  -9.620
    7   HG23  THR  56          HG23      THR  56 -13.493   2.619 -11.185

  No H/Q in entry =           7
  In of MODEL   78
    1    H    LYS  57           H        LYS  57 -10.904   2.759 -14.007
    2    HA   LYS  57           HA       LYS  57 -13.093   1.118 -14.767
    3    HB2  LYS  57           HB2      LYS  57 -12.171   3.053 -16.079
    4    HB3  LYS  57           HB3      LYS  57 -10.754   2.080 -16.448
    5    HG2  LYS  57           HG2      LYS  57 -12.157   0.435 -17.607
    6    HG3  LYS  57           HG3      LYS  57 -13.600   1.358 -17.206
    7    HD2  LYS  57           HD2      LYS  57 -12.736   3.276 -18.512
    8    HD3  LYS  57           HD3      LYS  57 -11.300   2.342 -18.929
    9    HE2  LYS  57           HE2      LYS  57 -12.694   0.670 -20.081
   10    HE3  LYS  57           HE3      LYS  57 -14.156   1.549 -19.637
   11    HZ1  LYS  57           HZ1      LYS  57 -12.367   3.332 -20.850
   12    HZ3  LYS  57           HZ2      LYS  57 -13.895   2.826 -21.398
   13    HZ2  LYS  57           HZ3      LYS  57 -12.498   1.962 -21.841

  No H/Q in entry =          13
  In of MODEL   78
    1    H    LEU  58           H        LEU  58  -9.599   0.614 -14.703
    2    HA   LEU  58           HA       LEU  58  -9.656  -1.901 -15.995
    3    HB2  LEU  58           HB2      LEU  58  -7.600  -0.653 -14.181
    4    HB3  LEU  58           HB3      LEU  58  -7.369  -2.179 -15.036
    5    HG   LEU  58           HG       LEU  58  -8.065   0.442 -16.398
    6   HD11  LEU  58          HD11      LEU  58  -5.447  -0.851 -15.703
    7   HD13  LEU  58          HD12      LEU  58  -5.906   0.850 -15.653
    8   HD12  LEU  58          HD13      LEU  58  -5.580   0.074 -17.200
    9   HD22  LEU  58          HD21      LEU  58  -8.670  -1.106 -17.992
   10   HD21  LEU  58          HD22      LEU  58  -7.656  -2.376 -17.310
   11   HD23  LEU  58          HD23      LEU  58  -6.937  -1.116 -18.312

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  59           H        ILE  59 -10.466  -0.985 -12.745
    2    HA   ILE  59           HA       ILE  59 -10.174  -3.759 -11.799
    3    HB   ILE  59           HB       ILE  59  -9.685  -1.505 -10.397
    4   HG12  ILE  59          HG12      ILE  59 -11.110  -3.826  -9.079
    5   HG13  ILE  59          HG13      ILE  59  -9.468  -3.940  -9.658
    6   HG21  ILE  59          HG21      ILE  59 -12.207  -0.930 -10.657
    7   HG23  ILE  59          HG22      ILE  59 -11.497  -0.777  -9.066
    8   HG22  ILE  59          HG23      ILE  59 -12.475  -2.185  -9.470
    9   HD12  ILE  59          HD11      ILE  59 -10.489  -1.970  -7.627
   10   HD11  ILE  59          HD12      ILE  59  -8.844  -1.992  -8.247
   11   HD13  ILE  59          HD13      ILE  59  -9.445  -3.347  -7.290

  No H/Q in entry =          11
  In of MODEL   78
    1    H    GLU  60           H        GLU  60 -12.682  -1.391 -12.611
    2    HA   GLU  60           HA       GLU  60 -14.900  -2.863 -11.604
    3    HB2  GLU  60           HB2      GLU  60 -15.130  -0.513 -12.166
    4    HB3  GLU  60           HB3      GLU  60 -14.696  -0.830 -13.842
    5    HG2  GLU  60           HG2      GLU  60 -16.719  -2.274 -14.059
    6    HG3  GLU  60           HG3      GLU  60 -17.174  -1.836 -12.425

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLY  61           H        GLY  61 -13.219  -2.879 -14.715
    2    HA3  GLY  61           HA2      GLY  61 -14.976  -5.088 -15.611
    3    HA2  GLY  61           HA3      GLY  61 -14.106  -4.000 -16.686

  No H/Q in entry =           3
  In of MODEL   78
    1    H    ASP  62           H        ASP  62 -12.765  -5.474 -13.800
    2    HA   ASP  62           HA       ASP  62 -10.519  -6.493 -15.249
    3    HB2  ASP  62           HB2      ASP  62  -9.825  -7.340 -13.038
    4    HB3  ASP  62           HB3      ASP  62 -10.320  -5.653 -12.958

  No H/Q in entry =           4
  In of MODEL   78
    1    H    ALA  63           H        ALA  63 -12.370  -7.760 -16.647
    2    HA   ALA  63           HA       ALA  63 -13.394 -10.221 -15.670
    3    HB1  ALA  63           HB1      ALA  63 -14.307  -9.450 -17.716
    4    HB3  ALA  63           HB2      ALA  63 -13.294 -10.806 -18.210
    5    HB2  ALA  63           HB3      ALA  63 -12.715  -9.151 -18.412

  No H/Q in entry =           5
  In of MODEL   78
    1    H    GLY  64           H        GLY  64 -10.342  -9.321 -17.158
    2    HA3  GLY  64           HA2      GLY  64  -8.299 -10.363 -17.230
    3    HA2  GLY  64           HA3      GLY  64  -8.888 -11.465 -15.994

  No H/Q in entry =           3
  In of MODEL   78
    1    H    GLU  65           H        GLU  65  -7.635 -13.089 -17.226
    2    HA   GLU  65           HA       GLU  65  -8.303 -13.782 -19.879
    3    HB2  GLU  65           HB2      GLU  65  -7.051 -15.443 -17.691
    4    HB3  GLU  65           HB3      GLU  65  -7.143 -15.922 -19.387
    5    HG2  GLU  65           HG2      GLU  65  -5.840 -13.369 -18.399
    6    HG3  GLU  65           HG3      GLU  65  -4.964 -14.848 -18.795

  No H/Q in entry =           6
  In of MODEL   78
    1    H    GLY  66           H        GLY  66  -9.454 -14.955 -16.802
    2    HA3  GLY  66           HA2      GLY  66 -11.472 -16.651 -18.107
    3    HA2  GLY  66           HA3      GLY  66 -10.881 -16.863 -16.471

  No H/Q in entry =           3
  In of MODEL   78
    1    H    LYS  67           H        LYS  67 -13.469 -16.963 -16.695
    2    HA   LYS  67           HA       LYS  67 -14.944 -14.590 -16.727
    3    HB2  LYS  67           HB2      LYS  67 -15.518 -17.286 -15.512
    4    HB3  LYS  67           HB3      LYS  67 -16.711 -15.984 -15.608
    5    HG2  LYS  67           HG2      LYS  67 -16.396 -15.864 -18.051
    6    HG3  LYS  67           HG3      LYS  67 -15.200 -17.157 -17.964
    7    HD2  LYS  67           HD2      LYS  67 -16.944 -18.673 -17.042
    8    HD3  LYS  67           HD3      LYS  67 -18.132 -17.380 -17.226
    9    HE2  LYS  67           HE2      LYS  67 -16.463 -18.477 -19.508
   10    HE3  LYS  67           HE3      LYS  67 -18.108 -19.005 -19.149
   11    HZ1  LYS  67           HZ1      LYS  67 -18.276 -16.288 -19.170
   12    HZ3  LYS  67           HZ2      LYS  67 -18.748 -17.325 -20.430
   13    HZ2  LYS  67           HZ3      LYS  67 -17.203 -16.617 -20.443

  No H/Q in entry =          13
  In of MODEL   78
    1    H    MET  68           H        MET  68 -13.660 -16.386 -14.002
    2    HA   MET  68           HA       MET  68 -14.534 -14.377 -12.075
    3    HB2  MET  68           HB2      MET  68 -13.243 -17.087 -11.782
    4    HB3  MET  68           HB3      MET  68 -13.625 -16.032 -10.422
    5    HG2  MET  68           HG2      MET  68 -15.995 -16.023 -11.075
    6    HG3  MET  68           HG3      MET  68 -15.624 -17.047 -12.464
    7    HE2  MET  68           HE1      MET  68 -15.716 -18.042  -8.030
    8    HE1  MET  68           HE2      MET  68 -15.773 -16.476  -8.838
    9    HE3  MET  68           HE3      MET  68 -14.225 -17.291  -8.618

  No H/Q in entry =           9
  In of MODEL   78
    1    H    LYS  69           H        LYS  69 -11.501 -15.503 -13.516
    2    HA   LYS  69           HA       LYS  69  -9.824 -14.248 -11.581
    3    HB2  LYS  69           HB2      LYS  69  -9.096 -16.189 -12.883
    4    HB3  LYS  69           HB3      LYS  69  -9.140 -15.223 -14.359
    5    HG2  LYS  69           HG2      LYS  69  -7.441 -13.708 -13.458
    6    HG3  LYS  69           HG3      LYS  69  -7.440 -14.585 -11.929
    7    HD2  LYS  69           HD2      LYS  69  -6.660 -16.619 -13.097
    8    HD3  LYS  69           HD3      LYS  69  -6.642 -15.730 -14.622
    9    HE2  LYS  69           HE2      LYS  69  -4.991 -14.153 -13.693
   10    HE3  LYS  69           HE3      LYS  69  -5.013 -15.027 -12.162
   11    HZ1  LYS  69           HZ1      LYS  69  -4.445 -17.042 -13.655
   12    HZ3  LYS  69           HZ2      LYS  69  -3.218 -15.952 -13.221
   13    HZ2  LYS  69           HZ3      LYS  69  -3.928 -15.869 -14.763

  No H/Q in entry =          13
  In of MODEL   78
    1    H    VAL  70           H        VAL  70  -8.325 -12.510 -11.810
    2    HA   VAL  70           HA       VAL  70  -9.278 -10.348 -13.601
    3    HB   VAL  70           HB       VAL  70  -8.320  -8.815 -11.930
    4   HG11  VAL  70          HG11      VAL  70 -10.685  -9.682 -11.759
    5   HG13  VAL  70          HG12      VAL  70  -9.998  -9.162 -10.219
    6   HG12  VAL  70          HG13      VAL  70 -10.100 -10.880 -10.605
    7   HG23  VAL  70          HG21      VAL  70  -7.522  -9.750  -9.748
    8   HG22  VAL  70          HG22      VAL  70  -6.500 -10.237 -11.098
    9   HG21  VAL  70          HG23      VAL  70  -7.662 -11.375 -10.419

  No H/Q in entry =           9
  In of MODEL   78
    1    H    SER  71           H        SER  71  -7.636  -8.889 -14.416
    2    HA   SER  71           HA       SER  71  -5.452 -10.190 -15.663
    3    HB2  SER  71           HB2      SER  71  -6.558  -8.104 -16.508
    4    HB3  SER  71           HB3      SER  71  -5.811  -7.222 -15.179
    5    HG   SER  71           HG       SER  71  -4.612  -7.212 -17.194

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LEU  72           H        LEU  72  -3.417 -10.514 -15.032
    2    HA   LEU  72           HA       LEU  72  -2.699 -10.316 -12.319
    3    HB2  LEU  72           HB2      LEU  72  -1.043 -10.774 -14.796
    4    HB3  LEU  72           HB3      LEU  72  -0.394 -10.871 -13.162
    5    HG   LEU  72           HG       LEU  72  -2.774 -12.505 -14.103
    6   HD13  LEU  72          HD11      LEU  72  -1.293 -14.332 -14.501
    7   HD12  LEU  72          HD12      LEU  72   0.064 -13.486 -13.760
    8   HD11  LEU  72          HD13      LEU  72  -0.563 -12.949 -15.320
    9   HD21  LEU  72          HD21      LEU  72  -1.061 -12.428 -11.624
   10   HD23  LEU  72          HD22      LEU  72  -1.832 -13.935 -12.092
   11   HD22  LEU  72          HD23      LEU  72  -2.815 -12.515 -11.745

  No H/Q in entry =          11
  In of MODEL   78
    1    H    VAL  73           H        VAL  73  -1.933  -8.314 -15.096
    2    HA   VAL  73           HA       VAL  73   0.021  -6.658 -13.987
    3    HB   VAL  73           HB       VAL  73  -0.344  -5.225 -15.842
    4   HG11  VAL  73          HG11      VAL  73   0.320  -7.728 -16.200
    5   HG13  VAL  73          HG12      VAL  73  -0.103  -6.751 -17.604
    6   HG12  VAL  73          HG13      VAL  73  -1.281  -7.872 -16.923
    7   HG23  VAL  73          HG21      VAL  73  -2.510  -5.769 -17.252
    8   HG22  VAL  73          HG22      VAL  73  -2.607  -4.675 -15.874
    9   HG21  VAL  73          HG23      VAL  73  -3.123  -6.352 -15.705

  No H/Q in entry =           9
  In of MODEL   78
    1    H    LEU  74           H        LEU  74  -3.379  -6.701 -13.438
    2    HA   LEU  74           HA       LEU  74  -3.942  -4.032 -12.826
    3    HB2  LEU  74           HB2      LEU  74  -5.707  -5.658 -13.004
    4    HB3  LEU  74           HB3      LEU  74  -5.038  -6.600 -11.675
    5    HG   LEU  74           HG       LEU  74  -5.457  -4.713 -10.130
    6   HD11  LEU  74          HD11      LEU  74  -6.439  -3.435 -12.682
    7   HD13  LEU  74          HD12      LEU  74  -5.319  -2.777 -11.490
    8   HD12  LEU  74          HD13      LEU  74  -7.037  -2.910 -11.108
    9   HD21  LEU  74          HD21      LEU  74  -7.193  -6.528 -10.985
   10   HD23  LEU  74          HD22      LEU  74  -8.001  -5.091 -11.576
   11   HD22  LEU  74          HD23      LEU  74  -7.670  -5.253  -9.868

  No H/Q in entry =          11
  In of MODEL   78
    1    H    VAL  75           H        VAL  75  -2.962  -6.642 -10.663
    2    HA   VAL  75           HA       VAL  75  -2.736  -5.096  -8.318
    3    HB   VAL  75           HB       VAL  75  -1.293  -7.624  -9.107
    4   HG11  VAL  75          HG11      VAL  75  -1.470  -6.150  -6.440
    5   HG13  VAL  75          HG12      VAL  75  -0.014  -6.438  -7.380
    6   HG12  VAL  75          HG13      VAL  75  -0.854  -7.787  -6.636
    7   HG21  VAL  75          HG21      VAL  75  -3.702  -7.023  -7.351
    8   HG23  VAL  75          HG22      VAL  75  -2.977  -8.618  -7.557
    9   HG22  VAL  75          HG23      VAL  75  -3.747  -7.815  -8.927

  No H/Q in entry =           9
  In of MODEL   78
    1    H    GLU  76           H        GLU  76  -0.338  -5.907 -10.848
    2    HA   GLU  76           HA       GLU  76   1.873  -4.608  -9.685
    3    HB2  GLU  76           HB2      GLU  76   2.056  -6.086 -11.666
    4    HB3  GLU  76           HB3      GLU  76   1.164  -4.915 -12.625
    5    HG2  GLU  76           HG2      GLU  76   3.508  -4.621 -13.119
    6    HG3  GLU  76           HG3      GLU  76   3.008  -3.236 -12.166

  No H/Q in entry =           6
  In of MODEL   78
    1    H    ALA  77           H        ALA  77  -0.627  -3.351 -11.879
    2    HA   ALA  77           HA       ALA  77   0.421  -0.727 -12.051
    3    HB1  ALA  77           HB1      ALA  77  -1.191  -1.313 -13.677
    4    HB2  ALA  77           HB2      ALA  77  -2.025  -0.160 -12.634
    5    HB3  ALA  77           HB3      ALA  77  -2.333  -1.888 -12.461

  No H/Q in entry =           5
  In of MODEL   78
    1    H    GLN  78           H        GLN  78  -1.886  -2.235  -9.847
    2    HA   GLN  78           HA       GLN  78  -2.647   0.100  -8.447
    3    HB2  GLN  78           HB2      GLN  78  -3.803  -2.138  -8.367
    4    HB3  GLN  78           HB3      GLN  78  -2.483  -2.723  -7.357
    5    HG2  GLN  78           HG2      GLN  78  -2.973  -0.975  -5.698
    6    HG3  GLN  78           HG3      GLN  78  -4.292  -0.380  -6.705
    7   HE21  GLN  78          HE21      GLN  78  -4.822  -1.325  -4.067
    8   HE22  GLN  78          HE22      GLN  78  -5.704  -2.772  -4.178

  No H/Q in entry =           8
  In of MODEL   78
    1    H    LEU  79           H        LEU  79  -0.018  -2.212  -7.990
    2    HA   LEU  79           HA       LEU  79   0.970  -1.337  -5.530
    3    HB2  LEU  79           HB2      LEU  79   1.801  -3.363  -6.597
    4    HB3  LEU  79           HB3      LEU  79   2.470  -2.424  -7.928
    5    HG   LEU  79           HG       LEU  79   4.045  -1.318  -6.419
    6   HD13  LEU  79          HD11      LEU  79   3.041  -1.053  -4.355
    7   HD12  LEU  79          HD12      LEU  79   4.090  -2.425  -4.009
    8   HD11  LEU  79          HD13      LEU  79   2.380  -2.689  -4.343
    9   HD23  LEU  79          HD21      LEU  79   5.209  -3.491  -5.514
   10   HD22  LEU  79          HD22      LEU  79   5.014  -3.287  -7.252
   11   HD21  LEU  79          HD23      LEU  79   3.912  -4.335  -6.364

  No H/Q in entry =          11
  In of MODEL   78
    1    H    HIS  80           H        HIS  80   1.872  -0.237  -8.800
    2    HA   HIS  80           HA       HIS  80   3.717   1.713  -7.872
    3    HB2  HIS  80           HB2      HIS  80   2.421   1.046 -10.459
    4    HB3  HIS  80           HB3      HIS  80   3.049   2.686 -10.286
    5    HD1  HIS  80           HD1      HIS  80   5.458   2.938 -10.801
    6    HD2  HIS  80           HD2      HIS  80   4.556  -0.956  -9.614
    7    HE1  HIS  80           HE1      HIS  80   7.622   1.617 -10.961
    8    HE2  HIS  80           HE2      HIS  80   7.083  -0.760 -10.241

  No H/Q in entry =           8
  In of MODEL   78
    1    H    LEU  81           H        LEU  81   0.320   1.942  -8.861
    2    HA   LEU  81           HA       LEU  81   0.100   4.739  -8.530
    3    HB2  LEU  81           HB2      LEU  81  -1.959   2.534  -8.458
    4    HB3  LEU  81           HB3      LEU  81  -2.378   4.246  -8.366
    5    HG   LEU  81           HG       LEU  81  -0.702   3.064 -10.598
    6   HD12  LEU  81          HD11      LEU  81  -2.923   3.428 -11.903
    7   HD11  LEU  81          HD12      LEU  81  -3.685   3.374 -10.314
    8   HD13  LEU  81          HD13      LEU  81  -2.767   1.988 -10.899
    9   HD23  LEU  81          HD21      LEU  81  -1.753   5.230 -11.697
   10   HD22  LEU  81          HD22      LEU  81  -0.336   5.372 -10.659
   11   HD21  LEU  81          HD23      LEU  81  -1.936   5.752 -10.024

  No H/Q in entry =          11
  In of MODEL   78
    1    H    MET  82           H        MET  82  -0.618   2.065  -6.284
    2    HA   MET  82           HA       MET  82  -1.645   3.670  -4.199
    3    HB2  MET  82           HB2      MET  82  -0.324   0.957  -4.236
    4    HB3  MET  82           HB3      MET  82  -0.893   1.692  -2.740
    5    HG2  MET  82           HG2      MET  82  -2.628   1.234  -5.186
    6    HG3  MET  82           HG3      MET  82  -2.574   0.158  -3.791
    7    HE3  MET  82           HE1      MET  82  -4.273   1.839  -0.980
    8    HE2  MET  82           HE2      MET  82  -2.537   2.083  -1.160
    9    HE1  MET  82           HE3      MET  82  -3.254   0.540  -1.617

  No H/Q in entry =           9
  In of MODEL   78
    1    H    THR  83           H        THR  83   1.636   2.521  -4.880
    2    HA   THR  83           HA       THR  83   2.868   3.601  -2.575
    3    HB   THR  83           HB       THR  83   4.965   3.506  -4.043
    4    HG1  THR  83           HG1      THR  83   4.721   2.985  -6.068
    5   HG22  THR  83          HG21      THR  83   4.471   0.857  -4.378
    6   HG21  THR  83          HG22      THR  83   3.186   1.260  -3.241
    7   HG23  THR  83          HG23      THR  83   4.870   1.571  -2.817

  No H/Q in entry =           7
  In of MODEL   78
    1    H    SER  84           H        SER  84   2.531   4.889  -5.876
    2    HA   SER  84           HA       SER  84   3.916   7.303  -5.415
    3    HB2  SER  84           HB2      SER  84   1.836   6.511  -7.441
    4    HB3  SER  84           HB3      SER  84   2.545   8.125  -7.412
    5    HG   SER  84           HG       SER  84   3.871   5.625  -7.701

  No H/Q in entry =           5
  In of MODEL   78
    1    H    MET  85           H        MET  85   0.407   6.613  -5.254
    2    HA   MET  85           HA       MET  85  -0.405   9.239  -4.653
    3    HB2  MET  85           HB2      MET  85  -1.964   7.468  -5.328
    4    HB3  MET  85           HB3      MET  85  -1.690   6.645  -3.793
    5    HG2  MET  85           HG2      MET  85  -2.555   8.592  -2.571
    6    HG3  MET  85           HG3      MET  85  -2.778   9.459  -4.090
    7    HE1  MET  85           HE1      MET  85  -3.425   6.512  -2.007
    8    HE3  MET  85           HE2      MET  85  -3.767   5.454  -3.376
    9    HE2  MET  85           HE3      MET  85  -5.081   5.979  -2.327

  No H/Q in entry =           9
  In of MODEL   78
    1    H    LEU  86           H        LEU  86   0.456   6.558  -2.509
    2    HA   LEU  86           HA       LEU  86  -0.058   7.870  -0.067
    3    HB2  LEU  86           HB2      LEU  86   0.358   5.390  -0.462
    4    HB3  LEU  86           HB3      LEU  86   2.073   5.786  -0.552
    5    HG   LEU  86           HG       LEU  86   1.765   6.951   1.716
    6   HD11  LEU  86          HD11      LEU  86  -0.942   6.239   1.237
    7   HD13  LEU  86          HD12      LEU  86  -0.266   6.972   2.690
    8   HD12  LEU  86          HD13      LEU  86  -0.391   5.218   2.569
    9   HD23  LEU  86          HD21      LEU  86   1.276   3.968   1.835
   10   HD22  LEU  86          HD22      LEU  86   2.296   4.956   2.879
   11   HD21  LEU  86          HD23      LEU  86   2.795   4.623   1.221

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ALA  87           H        ALA  87   2.921   7.516  -1.949
    2    HA   ALA  87           HA       ALA  87   4.650   8.890  -0.218
    3    HB3  ALA  87           HB1      ALA  87   4.733   7.878  -2.926
    4    HB2  ALA  87           HB2      ALA  87   6.070   8.180  -1.821
    5    HB1  ALA  87           HB3      ALA  87   5.485   9.474  -2.865

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ARG  88           H        ARG  88   2.735  10.069  -2.942
    2    HA   ARG  88           HA       ARG  88   3.565  12.741  -2.821
    3    HB2  ARG  88           HB2      ARG  88   2.292  11.617  -4.683
    4    HB3  ARG  88           HB3      ARG  88   0.835  11.790  -3.703
    5    HG2  ARG  88           HG2      ARG  88   1.908  14.348  -3.615
    6    HG3  ARG  88           HG3      ARG  88   2.326  13.827  -5.245
    7    HD2  ARG  88           HD2      ARG  88   0.189  13.953  -5.948
    8    HD3  ARG  88           HD3      ARG  88  -0.420  13.111  -4.522
    9    HE   ARG  88           HE       ARG  88  -0.549  15.892  -4.938
   10   HH21  ARG  88          HH11      ARG  88  -1.053  17.231  -3.200
   11   HH22  ARG  88          HH12      ARG  88  -0.772  16.686  -1.582
   12   HH11  ARG  88          HH21      ARG  88   0.412  13.606  -2.563
   13   HH12  ARG  88          HH22      ARG  88   0.039  14.628  -1.222

  No H/Q in entry =          13
  In of MODEL   78
    1    H    GLU  89           H        GLU  89   0.822  11.123  -1.190
    2    HA   GLU  89           HA       GLU  89  -0.239  13.457   0.015
    3    HB2  GLU  89           HB2      GLU  89  -1.405  11.243  -0.077
    4    HB3  GLU  89           HB3      GLU  89  -0.296  10.662   1.166
    5    HG2  GLU  89           HG2      GLU  89  -1.084  12.376   2.725
    6    HG3  GLU  89           HG3      GLU  89  -2.118  13.071   1.480

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LEU  90           H        LEU  90   2.159  11.111   1.193
    2    HA   LEU  90           HA       LEU  90   2.535  12.345   3.725
    3    HB2  LEU  90           HB2      LEU  90   4.273  10.534   2.050
    4    HB3  LEU  90           HB3      LEU  90   4.699  11.039   3.690
    5    HG   LEU  90           HG       LEU  90   2.037   9.753   3.021
    6   HD12  LEU  90          HD11      LEU  90   3.130   7.681   4.030
    7   HD11  LEU  90          HD12      LEU  90   4.671   8.503   3.792
    8   HD13  LEU  90          HD13      LEU  90   3.654   8.120   2.403
    9   HD22  LEU  90          HD21      LEU  90   1.788  10.679   5.143
   10   HD21  LEU  90          HD22      LEU  90   3.502  10.533   5.529
   11   HD23  LEU  90          HD23      LEU  90   2.464   9.109   5.573

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  91           H        ILE  91   4.155  12.695   0.602
    2    HA   ILE  91           HA       ILE  91   6.170  14.481   1.449
    3    HB   ILE  91           HB       ILE  91   4.854  14.023  -1.235
    4   HG12  ILE  91          HG12      ILE  91   7.673  13.471  -0.254
    5   HG13  ILE  91          HG13      ILE  91   6.364  12.302  -0.097
    6   HG22  ILE  91          HG21      ILE  91   7.109  15.320  -1.916
    7   HG21  ILE  91          HG22      ILE  91   6.813  16.126  -0.375
    8   HG23  ILE  91          HG23      ILE  91   5.594  16.183  -1.647
    9   HD13  ILE  91          HD11      ILE  91   6.189  11.985  -2.405
   10   HD12  ILE  91          HD12      ILE  91   7.928  12.189  -2.186
   11   HD11  ILE  91          HD13      ILE  91   6.949  13.535  -2.773

  No H/Q in entry =          11
  In of MODEL   78
    1    H    THR  92           H        THR  92   2.821  14.990   0.433
    2    HA   THR  92           HA       THR  92   2.859  17.814   0.376
    3    HB   THR  92           HB       THR  92   0.645  15.868   1.067
    4    HG1  THR  92           HG1      THR  92   0.951  15.685  -1.017
    5   HG22  THR  92          HG21      THR  92  -0.704  18.062   0.345
    6   HG21  THR  92          HG22      THR  92   0.705  18.854   1.046
    7   HG23  THR  92          HG23      THR  92  -0.264  17.753   2.024

  No H/Q in entry =           7
  In of MODEL   78
    1    H    GLU  93           H        GLU  93   2.252  15.523   3.026
    2    HA   GLU  93           HA       GLU  93   1.759  17.436   5.045
    3    HB2  GLU  93           HB2      GLU  93   3.008  14.682   5.281
    4    HB3  GLU  93           HB3      GLU  93   2.336  15.623   6.613
    5    HG2  GLU  93           HG2      GLU  93   0.712  14.885   4.170
    6    HG3  GLU  93           HG3      GLU  93   0.787  13.858   5.597

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LEU  94           H        LEU  94   4.733  15.887   3.901
    2    HA   LEU  94           HA       LEU  94   6.505  16.992   5.795
    3    HB2  LEU  94           HB2      LEU  94   6.891  16.019   2.964
    4    HB3  LEU  94           HB3      LEU  94   8.233  16.645   3.917
    5    HG   LEU  94           HG       LEU  94   6.441  14.488   5.045
    6   HD11  LEU  94          HD11      LEU  94   8.536  14.217   2.919
    7   HD13  LEU  94          HD12      LEU  94   7.067  13.276   3.176
    8   HD12  LEU  94          HD13      LEU  94   8.484  12.989   4.186
    9   HD23  LEU  94          HD21      LEU  94   8.615  13.900   6.203
   10   HD22  LEU  94          HD22      LEU  94   7.983  15.493   6.619
   11   HD21  LEU  94          HD23      LEU  94   9.322  15.343   5.480

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  95           H        ILE  95   5.401  18.193   2.644
    2    HA   ILE  95           HA       ILE  95   7.027  20.514   2.591
    3    HB   ILE  95           HB       ILE  95   4.371  19.893   1.278
    4   HG12  ILE  95          HG12      ILE  95   7.170  20.167   0.149
    5   HG13  ILE  95          HG13      ILE  95   6.483  18.629   0.660
    6   HG21  ILE  95          HG21      ILE  95   6.177  22.319   1.066
    7   HG23  ILE  95          HG22      ILE  95   4.450  22.291   1.417
    8   HG22  ILE  95          HG23      ILE  95   5.028  21.879  -0.198
    9   HD13  ILE  95          HD11      ILE  95   4.927  18.591  -1.073
   10   HD12  ILE  95          HD12      ILE  95   6.296  19.379  -1.857
   11   HD11  ILE  95          HD13      ILE  95   4.944  20.344  -1.266

  No H/Q in entry =          11
  In of MODEL   78
    1    H    GLU  96           H        GLU  96   3.761  19.935   3.877
    2    HA   GLU  96           HA       GLU  96   3.200  22.595   4.631
    3    HB2  GLU  96           HB2      GLU  96   1.484  20.851   4.636
    4    HB3  GLU  96           HB3      GLU  96   2.323  20.002   5.932
    5    HG2  GLU  96           HG2      GLU  96   1.329  21.307   7.501
    6    HG3  GLU  96           HG3      GLU  96   1.900  22.769   6.707

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LEU  97           H        LEU  97   4.979  20.000   6.257
    2    HA   LEU  97           HA       LEU  97   5.361  21.337   8.730
    3    HB2  LEU  97           HB2      LEU  97   6.851  19.134   7.317
    4    HB3  LEU  97           HB3      LEU  97   7.453  19.804   8.832
    5    HG   LEU  97           HG       LEU  97   4.619  18.776   8.512
    6   HD12  LEU  97          HD11      LEU  97   5.509  16.741   9.725
    7   HD11  LEU  97          HD12      LEU  97   7.135  17.335   9.386
    8   HD13  LEU  97          HD13      LEU  97   6.058  16.903   8.057
    9   HD23  LEU  97          HD21      LEU  97   5.059  18.468  11.078
   10   HD22  LEU  97          HD22      LEU  97   4.718  20.089  10.474
   11   HD21  LEU  97          HD23      LEU  97   6.378  19.610  10.823

  No H/Q in entry =          11
  In of MODEL   78
    1    H    HIS  98           H        HIS  98   7.239  21.313   5.710
    2    HA   HIS  98           HA       HIS  98   9.427  22.840   6.616
    3    HB2  HIS  98           HB2      HIS  98   8.135  22.619   3.887
    4    HB3  HIS  98           HB3      HIS  98   9.597  23.563   4.182
    5    HD1  HIS  98           HD1      HIS  98   8.302  20.022   4.194
    6    HD2  HIS  98           HD2      HIS  98  11.931  22.032   4.631
    7    HE1  HIS  98           HE1      HIS  98  10.115  18.249   4.140
    8    HE2  HIS  98           HE2      HIS  98  12.329  19.453   4.406

  No H/Q in entry =           8
  In of MODEL   78
    1    H    GLU  99           H        GLU  99   6.230  23.753   5.434
    2    HA   GLU  99           HA       GLU  99   6.676  26.558   5.381
    3    HB2  GLU  99           HB2      GLU  99   4.772  25.435   4.244
    4    HB3  GLU  99           HB3      GLU  99   4.064  25.088   5.821
    5    HG2  GLU  99           HG2      GLU  99   3.939  27.483   6.324
    6    HG3  GLU  99           HG3      GLU  99   4.729  27.866   4.797

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LYS 100           H        LYS 100   5.486  24.347   7.897
    2    HA   LYS 100           HA       LYS 100   4.944  26.412   9.792
    3    HB2  LYS 100           HB2      LYS 100   5.447  23.447  10.135
    4    HB3  LYS 100           HB3      LYS 100   5.022  24.529  11.468
    5    HG2  LYS 100           HG2      LYS 100   2.975  25.217  10.215
    6    HG3  LYS 100           HG3      LYS 100   3.378  24.040   8.962
    7    HD2  LYS 100           HD2      LYS 100   3.252  22.219  10.621
    8    HD3  LYS 100           HD3      LYS 100   2.867  23.390  11.885
    9    HE2  LYS 100           HE2      LYS 100   0.832  24.062  10.618
   10    HE3  LYS 100           HE3      LYS 100   1.206  22.834   9.401
   11    HZ1  LYS 100           HZ1      LYS 100   0.917  22.171  12.280
   12    HZ3  LYS 100           HZ2      LYS 100   0.880  21.119  10.944
   13    HZ2  LYS 100           HZ3      LYS 100  -0.411  22.189  11.222

  No H/Q in entry =          13
  In of MODEL   78
    1    H    LEU 101           H        LEU 101   7.825  24.548   8.963
    2    HA   LEU 101           HA       LEU 101   9.438  25.346  11.172
    3    HB2  LEU 101           HB2      LEU 101  10.016  24.349   8.394
    4    HB3  LEU 101           HB3      LEU 101  11.331  24.981   9.379
    5    HG   LEU 101           HG       LEU 101   9.444  22.869  10.436
    6   HD12  LEU 101          HD11      LEU 101  11.463  21.325   9.831
    7   HD11  LEU 101          HD12      LEU 101  11.864  22.580   8.661
    8   HD13  LEU 101          HD13      LEU 101  10.314  21.745   8.562
    9   HD21  LEU 101          HD21      LEU 101  12.193  23.909  11.172
   10   HD23  LEU 101          HD22      LEU 101  11.610  22.350  11.748
   11   HD22  LEU 101          HD23      LEU 101  10.752  23.826  12.186

  No H/Q in entry =          11
  In of MODEL   78
    1    H    LYS 102           H        LYS 102   7.906  27.250   9.029
    2    HA   LYS 102           HA       LYS 102   8.040  29.541   8.741
    3    HB2  LYS 102           HB2      LYS 102   9.596  29.385  10.843
    4    HB3  LYS 102           HB3      LYS 102  10.903  29.549   9.687
    5    HG2  LYS 102           HG2      LYS 102   8.843  31.552  10.546
    6    HG3  LYS 102           HG3      LYS 102  10.562  31.770  10.300
    7    HD2  LYS 102           HD2      LYS 102   8.607  31.398   7.994
    8    HD3  LYS 102           HD3      LYS 102   9.027  32.967   8.666
    9    HE2  LYS 102           HE2      LYS 102  10.376  31.752   6.594
   10    HE3  LYS 102           HE3      LYS 102  11.021  33.042   7.609
   11    HZ2  LYS 102           HZ1      LYS 102  12.495  31.100   7.435
   12    HZ1  LYS 102           HZ2      LYS 102  11.308  30.146   8.173
   13    HZ3  LYS 102           HZ3      LYS 102  12.029  31.414   9.036

  No H/Q in entry =          13
  In of MODEL   78
    1    H    ALA 103           H        ALA 103  11.264  28.123   8.183
    2    HA   ALA 103           HA       ALA 103  12.267  29.479   6.111
    3    HB2  ALA 103           HB1      ALA 103  13.100  27.245   5.183
    4    HB1  ALA 103           HB2      ALA 103  12.183  26.491   6.486
    5    HB3  ALA 103           HB3      ALA 103  13.499  27.603   6.863

  No H/Q in entry =           5
  In of MODEL   78
    1    H1   LYS   3           H1       LYS   3 -32.001   5.365 -19.707
    2    H2   LYS   3           H3       LYS   3 -31.004   5.163 -21.066
    3    H3   LYS   3           H2       LYS   3 -32.329   4.129 -20.823
    4    HA   LYS   3           HA       LYS   3 -31.224   2.796 -19.444
    5    HB2  LYS   3           HB2      LYS   3 -29.054   4.378 -20.770
    6    HB3  LYS   3           HB3      LYS   3 -28.639   3.180 -19.544
    7    HG2  LYS   3           HG2      LYS   3 -29.957   1.516 -20.907
    8    HG3  LYS   3           HG3      LYS   3 -30.002   2.733 -22.182
    9    HD2  LYS   3           HD2      LYS   3 -27.517   2.789 -22.146
   10    HD3  LYS   3           HD3      LYS   3 -27.539   1.471 -20.975
   11    HE2  LYS   3           HE2      LYS   3 -28.964   0.216 -22.699
   12    HE3  LYS   3           HE3      LYS   3 -28.433   1.449 -23.843
   13    HZ3  LYS   3           HZ1      LYS   3 -26.557   0.351 -24.138
   14    HZ2  LYS   3           HZ2      LYS   3 -27.098  -0.871 -23.090
   15    HZ1  LYS   3           HZ3      LYS   3 -26.194   0.430 -22.481

  No H/Q in entry =          15
  In of MODEL   78
    1    H    LYS   4           H        LYS   4 -31.254   2.624 -17.383
    2    HA   LYS   4           HA       LYS   4 -30.672   4.935 -15.708
    3    HB2  LYS   4           HB2      LYS   4 -31.682   2.158 -15.037
    4    HB3  LYS   4           HB3      LYS   4 -31.546   3.494 -13.895
    5    HG2  LYS   4           HG2      LYS   4 -33.361   3.339 -16.307
    6    HG3  LYS   4           HG3      LYS   4 -33.843   3.335 -14.612
    7    HD2  LYS   4           HD2      LYS   4 -33.297   5.597 -14.320
    8    HD3  LYS   4           HD3      LYS   4 -32.265   5.627 -15.749
    9    HE2  LYS   4           HE2      LYS   4 -34.282   6.872 -16.184
   10    HE3  LYS   4           HE3      LYS   4 -34.268   5.410 -17.170
   11    HZ3  LYS   4           HZ1      LYS   4 -35.769   4.374 -15.626
   12    HZ2  LYS   4           HZ2      LYS   4 -36.428   5.835 -16.188
   13    HZ1  LYS   4           HZ3      LYS   4 -35.756   5.750 -14.631

  No H/Q in entry =          13
  In of MODEL   78
    1    H    HIS   5           H        HIS   5 -29.202   5.099 -14.123
    2    HA   HIS   5           HA       HIS   5 -26.805   3.431 -14.491
    3    HB2  HIS   5           HB2      HIS   5 -27.235   6.147 -13.248
    4    HB3  HIS   5           HB3      HIS   5 -25.693   5.294 -13.251
    5    HD1  HIS   5           HD1      HIS   5 -24.316   6.608 -14.833
    6    HD2  HIS   5           HD2      HIS   5 -28.077   5.755 -16.374
    7    HE1  HIS   5           HE1      HIS   5 -24.202   7.229 -17.277
    8    HE2  HIS   5           HE2      HIS   5 -26.495   6.696 -18.185

  No H/Q in entry =           8
  In of MODEL   78
    1    H    ILE   6           H        ILE   6 -26.463   1.860 -13.195
    2    HA   ILE   6           HA       ILE   6 -27.436   2.029 -10.423
    3    HB   ILE   6           HB       ILE   6 -26.460  -0.359 -11.996
    4   HG12  ILE   6          HG12      ILE   6 -29.255   0.383 -11.119
    5   HG13  ILE   6          HG13      ILE   6 -28.634   0.608 -12.755
    6   HG23  ILE   6          HG21      ILE   6 -26.738  -1.656 -10.150
    7   HG22  ILE   6          HG22      ILE   6 -27.965  -0.598  -9.450
    8   HG21  ILE   6          HG23      ILE   6 -26.261  -0.149  -9.366
    9   HD13  ILE   6          HD11      ILE   6 -28.956  -1.531 -13.279
   10   HD12  ILE   6          HD12      ILE   6 -29.962  -1.599 -11.831
   11   HD11  ILE   6          HD13      ILE   6 -28.271  -2.097 -11.755

  No H/Q in entry =          11
  In of MODEL   78
    1    H    TYR   7           H        TYR   7 -25.716   2.768  -9.138
    2    HA   TYR   7           HA       TYR   7 -22.951   2.000  -9.844
    3    HB2  TYR   7           HB2      TYR   7 -24.063   4.346  -8.327
    4    HB3  TYR   7           HB3      TYR   7 -22.349   3.944  -8.381
    5    HD1  TYR   7           HD1      TYR   7 -23.344   2.974 -11.478
    6    HD2  TYR   7           HD2      TYR   7 -22.896   6.554  -9.209
    7    HE1  TYR   7           HE1      TYR   7 -23.007   4.255 -13.555
    8    HE2  TYR   7           HE2      TYR   7 -22.600   7.837 -11.279
    9    HH   TYR   7           HH       TYR   7 -22.827   7.765 -13.510

  No H/Q in entry =           9
  In of MODEL   78
    1    H    LEU   8           H        LEU   8 -21.892   0.697  -8.539
    2    HA   LEU   8           HA       LEU   8 -22.970   0.096  -5.855
    3    HB2  LEU   8           HB2      LEU   8 -21.174  -1.429  -7.720
    4    HB3  LEU   8           HB3      LEU   8 -21.323  -1.843  -6.012
    5    HG   LEU   8           HG       LEU   8 -23.789  -2.172  -6.423
    6   HD13  LEU   8          HD11      LEU   8 -24.012  -0.941  -8.517
    7   HD12  LEU   8          HD12      LEU   8 -24.434  -2.633  -8.775
    8   HD11  LEU   8          HD13      LEU   8 -22.865  -2.025  -9.302
    9   HD23  LEU   8          HD21      LEU   8 -22.396  -4.104  -8.149
   10   HD22  LEU   8          HD22      LEU   8 -23.460  -4.360  -6.767
   11   HD21  LEU   8          HD23      LEU   8 -21.779  -3.899  -6.511

  No H/Q in entry =          11
  In of MODEL   78
    1    H    PHE   9           H        PHE   9 -21.711   0.547  -4.072
    2    HA   PHE   9           HA       PHE   9 -18.996   1.666  -4.587
    3    HB2  PHE   9           HB2      PHE   9 -21.021   2.576  -2.544
    4    HB3  PHE   9           HB3      PHE   9 -19.363   3.150  -2.644
    5    HD1  PHE   9           HD1      PHE   9 -18.635   4.607  -4.433
    6    HD2  PHE   9           HD2      PHE   9 -22.672   3.161  -4.287
    7    HE1  PHE   9           HE1      PHE   9 -19.285   6.245  -6.173
    8    HE2  PHE   9           HE2      PHE   9 -23.324   4.810  -6.023
    9    HZ   PHE   9           HZ       PHE   9 -21.629   6.348  -6.972

  No H/Q in entry =           9
  In of MODEL   78
    1    H    SER  10           H        SER  10 -17.339   0.824  -3.482
    2    HA   SER  10           HA       SER  10 -17.478  -0.125  -0.805
    3    HB2  SER  10           HB2      SER  10 -17.323  -2.446  -1.074
    4    HB3  SER  10           HB3      SER  10 -18.564  -1.993  -2.230
    5    HG   SER  10           HG       SER  10 -15.811  -2.221  -2.847

  No H/Q in entry =           5
  In of MODEL   78
    1    H    SER  11           H        SER  11 -15.468   0.119   0.023
    2    HA   SER  11           HA       SER  11 -13.354   1.130  -1.520
    3    HB2  SER  11           HB2      SER  11 -12.899  -0.223   1.113
    4    HB3  SER  11           HB3      SER  11 -12.131   1.221   0.449
    5    HG   SER  11           HG       SER  11 -14.859   0.958   1.222

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ALA  12           H        ALA  12 -14.360  -1.606  -2.355
    2    HA   ALA  12           HA       ALA  12 -11.715  -2.688  -2.902
    3    HB2  ALA  12           HB1      ALA  12 -11.930  -4.114  -1.129
    4    HB3  ALA  12           HB2      ALA  12 -12.828  -5.050  -2.322
    5    HB1  ALA  12           HB3      ALA  12 -13.694  -4.055  -1.154

  No H/Q in entry =           5
  In of MODEL   78
    1    H    GLY  13           H        GLY  13 -12.577  -1.704  -4.912
    2    HA3  GLY  13           HA2      GLY  13 -14.774  -2.507  -6.377
    3    HA2  GLY  13           HA3      GLY  13 -13.246  -1.992  -7.107

  No H/Q in entry =           3
  In of MODEL   78
    1    H    MET  14           H        MET  14 -11.711  -4.272  -6.040
    2    HA   MET  14           HA       MET  14 -12.012  -6.026  -8.203
    3    HB2  MET  14           HB2      MET  14  -9.935  -6.000  -6.922
    4    HB3  MET  14           HB3      MET  14 -10.750  -6.691  -5.519
    5    HG2  MET  14           HG2      MET  14 -11.268  -8.723  -6.847
    6    HG3  MET  14           HG3      MET  14 -10.429  -8.024  -8.233
    7    HE3  MET  14           HE1      MET  14  -6.845  -7.978  -7.529
    8    HE2  MET  14           HE2      MET  14  -7.735  -6.602  -6.881
    9    HE1  MET  14           HE3      MET  14  -8.252  -7.342  -8.393

  No H/Q in entry =           9
  In of MODEL   78
    1    H    SER  15           H        SER  15 -13.191  -6.554  -4.870
    2    HA   SER  15           HA       SER  15 -14.419  -9.063  -5.555
    3    HB2  SER  15           HB2      SER  15 -13.891  -8.552  -3.191
    4    HB3  SER  15           HB3      SER  15 -15.082  -7.255  -3.215
    5    HG   SER  15           HG       SER  15 -15.768  -9.414  -2.402

  No H/Q in entry =           5
  In of MODEL   78
    1    H    THR  16           H        THR  16 -15.638  -5.736  -5.297
    2    HA   THR  16           HA       THR  16 -18.400  -6.369  -5.867
    3    HB   THR  16           HB       THR  16 -16.957  -3.741  -6.352
    4    HG1  THR  16           HG1      THR  16 -16.675  -4.695  -4.205
    5   HG21  THR  16          HG21      THR  16 -19.362  -4.169  -7.163
    6   HG23  THR  16          HG22      THR  16 -19.102  -2.745  -6.140
    7   HG22  THR  16          HG23      THR  16 -19.793  -4.223  -5.458

  No H/Q in entry =           7
  In of MODEL   78
    1    H    SER  17           H        SER  17 -15.543  -5.663  -7.700
    2    HA   SER  17           HA       SER  17 -16.731  -4.968 -10.188
    3    HB2  SER  17           HB2      SER  17 -14.016  -6.120  -9.513
    4    HB3  SER  17           HB3      SER  17 -14.494  -5.694 -11.157
    5    HG   SER  17           HG       SER  17 -14.872  -3.787  -9.166

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LEU  18           H        LEU  18 -15.948  -8.086  -8.781
    2    HA   LEU  18           HA       LEU  18 -16.445  -9.593 -11.152
    3    HB2  LEU  18           HB2      LEU  18 -15.154 -10.530  -9.312
    4    HB3  LEU  18           HB3      LEU  18 -16.541 -10.374  -8.234
    5    HG   LEU  18           HG       LEU  18 -17.781 -12.007  -9.550
    6   HD12  LEU  18          HD11      LEU  18 -16.372 -13.270 -11.313
    7   HD11  LEU  18          HD12      LEU  18 -15.347 -11.836 -11.311
    8   HD13  LEU  18          HD13      LEU  18 -17.045 -11.705 -11.763
    9   HD22  LEU  18          HD21      LEU  18 -16.561 -12.920  -7.773
   10   HD21  LEU  18          HD22      LEU  18 -15.037 -12.806  -8.657
   11   HD23  LEU  18          HD23      LEU  18 -16.263 -13.970  -9.160

  No H/Q in entry =          11
  In of MODEL   78
    1    H    LEU  19           H        LEU  19 -18.475  -8.551  -8.418
    2    HA   LEU  19           HA       LEU  19 -20.859  -9.885  -9.254
    3    HB2  LEU  19           HB2      LEU  19 -20.659  -9.077  -6.997
    4    HB3  LEU  19           HB3      LEU  19 -20.441  -7.424  -7.568
    5    HG   LEU  19           HG       LEU  19 -22.787  -7.402  -8.330
    6   HD12  LEU  19          HD11      LEU  19 -24.281  -9.212  -7.460
    7   HD11  LEU  19          HD12      LEU  19 -22.836 -10.136  -7.049
    8   HD13  LEU  19          HD13      LEU  19 -23.182  -9.743  -8.733
    9   HD21  LEU  19          HD21      LEU  19 -22.183  -8.017  -5.453
   10   HD23  LEU  19          HD22      LEU  19 -23.763  -7.459  -6.002
   11   HD22  LEU  19          HD23      LEU  19 -22.342  -6.440  -6.227

  No H/Q in entry =          11
  In of MODEL   78
    1    H    VAL  20           H        VAL  20 -19.580  -6.624  -9.917
    2    HA   VAL  20           HA       VAL  20 -21.764  -5.707 -11.463
    3    HB   VAL  20           HB       VAL  20 -18.821  -4.916 -11.609
    4   HG13  VAL  20          HG11      VAL  20 -19.690  -4.289 -13.726
    5   HG12  VAL  20          HG12      VAL  20 -19.789  -2.829 -12.743
    6   HG11  VAL  20          HG13      VAL  20 -21.234  -3.794 -13.035
    7   HG21  VAL  20          HG21      VAL  20 -21.219  -3.796 -10.204
    8   HG23  VAL  20          HG22      VAL  20 -19.791  -2.818 -10.534
    9   HG22  VAL  20          HG23      VAL  20 -19.657  -4.261  -9.529

  No H/Q in entry =           9
  In of MODEL   78
    1    H    SER  21           H        SER  21 -18.882  -7.556 -12.528
    2    HA   SER  21           HA       SER  21 -19.686  -7.463 -15.274
    3    HB2  SER  21           HB2      SER  21 -18.125  -9.327 -15.637
    4    HB3  SER  21           HB3      SER  21 -17.375  -8.039 -14.697
    5    HG   SER  21           HG       SER  21 -17.308  -9.282 -12.998

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LYS  22           H        LYS  22 -20.591  -9.746 -12.725
    2    HA   LYS  22           HA       LYS  22 -22.029 -11.442 -14.560
    3    HB2  LYS  22           HB2      LYS  22 -21.953 -11.175 -11.575
    4    HB3  LYS  22           HB3      LYS  22 -23.211 -12.137 -12.350
    5    HG2  LYS  22           HG2      LYS  22 -21.135 -13.358 -11.505
    6    HG3  LYS  22           HG3      LYS  22 -21.687 -13.718 -13.140
    7    HD2  LYS  22           HD2      LYS  22 -19.983 -12.276 -14.077
    8    HD3  LYS  22           HD3      LYS  22 -19.473 -11.782 -12.462
    9    HE2  LYS  22           HE2      LYS  22 -18.772 -14.083 -11.974
   10    HE3  LYS  22           HE3      LYS  22 -19.299 -14.592 -13.578
   11    HZ3  LYS  22           HZ1      LYS  22 -17.503 -13.684 -14.561
   12    HZ2  LYS  22           HZ2      LYS  22 -16.810 -13.982 -13.038
   13    HZ1  LYS  22           HZ3      LYS  22 -17.357 -12.424 -13.432

  No H/Q in entry =          13
  In of MODEL   78
    1    H    MET  23           H        MET  23 -22.933  -8.597 -12.652
    2    HA   MET  23           HA       MET  23 -25.732  -8.852 -13.147
    3    HB2  MET  23           HB2      MET  23 -24.036  -6.435 -12.553
    4    HB3  MET  23           HB3      MET  23 -25.790  -6.379 -12.722
    5    HG2  MET  23           HG2      MET  23 -26.085  -7.729 -10.767
    6    HG3  MET  23           HG3      MET  23 -24.351  -8.030 -10.653
    7    HE2  MET  23           HE1      MET  23 -26.876  -4.551  -9.409
    8    HE1  MET  23           HE2      MET  23 -27.074  -5.516 -10.871
    9    HE3  MET  23           HE3      MET  23 -26.134  -4.023 -10.921

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ARG  24           H        ARG  24 -23.085  -7.226 -14.924
    2    HA   ARG  24           HA       ARG  24 -24.674  -6.001 -16.900
    3    HB2  ARG  24           HB2      ARG  24 -22.259  -5.454 -16.520
    4    HB3  ARG  24           HB3      ARG  24 -21.826  -7.014 -17.176
    5    HG2  ARG  24           HG2      ARG  24 -22.756  -6.367 -19.398
    6    HG3  ARG  24           HG3      ARG  24 -23.194  -4.777 -18.720
    7    HD2  ARG  24           HD2      ARG  24 -20.378  -5.962 -18.755
    8    HD3  ARG  24           HD3      ARG  24 -20.987  -4.766 -19.892
    9    HE   ARG  24           HE       ARG  24 -21.384  -3.435 -17.678
   10   HH21  ARG  24          HH11      ARG  24 -20.008  -1.660 -17.768
   11   HH22  ARG  24          HH12      ARG  24 -18.297  -1.906 -17.856
   12   HH11  ARG  24          HH21      ARG  24 -18.713  -5.374 -18.425
   13   HH12  ARG  24          HH22      ARG  24 -17.542  -4.107 -18.234

  No H/Q in entry =          13
  In of MODEL   78
    1    H    ALA  25           H        ALA  25 -23.339  -9.263 -16.673
    2    HA   ALA  25           HA       ALA  25 -23.926 -10.099 -19.318
    3    HB1  ALA  25           HB1      ALA  25 -23.098 -12.091 -18.652
    4    HB3  ALA  25           HB2      ALA  25 -24.147 -12.156 -17.236
    5    HB2  ALA  25           HB3      ALA  25 -22.648 -11.232 -17.179

  No H/Q in entry =           5
  In of MODEL   78
    1    H    GLN  26           H        GLN  26 -25.732 -10.293 -16.287
    2    HA   GLN  26           HA       GLN  26 -27.999 -11.630 -17.311
    3    HB2  GLN  26           HB2      GLN  26 -27.587  -9.884 -14.903
    4    HB3  GLN  26           HB3      GLN  26 -29.102 -10.701 -15.255
    5    HG2  GLN  26           HG2      GLN  26 -26.427 -11.996 -14.817
    6    HG3  GLN  26           HG3      GLN  26 -27.785 -11.995 -13.700
    7   HE21  GLN  26          HE21      GLN  26 -26.439 -14.061 -15.010
    8   HE22  GLN  26          HE22      GLN  26 -27.417 -15.161 -15.817

  No H/Q in entry =           8
  In of MODEL   78
    1    H    ALA  27           H        ALA  27 -27.280  -8.185 -16.877
    2    HA   ALA  27           HA       ALA  27 -29.838  -7.242 -17.636
    3    HB1  ALA  27           HB1      ALA  27 -28.109  -5.830 -16.509
    4    HB3  ALA  27           HB2      ALA  27 -28.755  -5.083 -17.973
    5    HB2  ALA  27           HB3      ALA  27 -27.167  -5.851 -18.002

  No H/Q in entry =           5
  In of MODEL   78
    1    H    GLU  28           H        GLU  28 -27.074  -8.265 -19.533
    2    HA   GLU  28           HA       GLU  28 -28.086  -7.253 -22.033
    3    HB2  GLU  28           HB2      GLU  28 -25.666  -7.793 -21.429
    4    HB3  GLU  28           HB3      GLU  28 -26.105  -9.485 -21.651
    5    HG2  GLU  28           HG2      GLU  28 -25.019  -8.611 -23.613
    6    HG3  GLU  28           HG3      GLU  28 -26.695  -9.036 -23.959

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LYS  29           H        LYS  29 -28.047 -10.386 -20.419
    2    HA   LYS  29           HA       LYS  29 -29.264 -11.909 -22.440
    3    HB2  LYS  29           HB2      LYS  29 -28.144 -12.851 -20.453
    4    HB3  LYS  29           HB3      LYS  29 -29.453 -12.239 -19.444
    5    HG2  LYS  29           HG2      LYS  29 -31.029 -13.700 -20.524
    6    HG3  LYS  29           HG3      LYS  29 -29.798 -14.242 -21.662
    7    HD2  LYS  29           HD2      LYS  29 -28.576 -15.358 -19.951
    8    HD3  LYS  29           HD3      LYS  29 -29.527 -14.593 -18.680
    9    HE2  LYS  29           HE2      LYS  29 -30.131 -16.980 -19.072
   10    HE3  LYS  29           HE3      LYS  29 -31.484 -15.867 -19.293
   11    HZ1  LYS  29           HZ1      LYS  29 -30.923 -15.931 -21.725
   12    HZ3  LYS  29           HZ2      LYS  29 -31.551 -17.370 -21.077
   13    HZ2  LYS  29           HZ3      LYS  29 -29.888 -17.232 -21.380

  No H/Q in entry =          13
  In of MODEL   78
    1    H    TYR  30           H        TYR  30 -30.774  -9.930 -19.900
    2    HA   TYR  30           HA       TYR  30 -33.409 -10.530 -21.137
    3    HB2  TYR  30           HB2      TYR  30 -32.817  -9.376 -18.402
    4    HB3  TYR  30           HB3      TYR  30 -34.418  -9.726 -19.052
    5    HD1  TYR  30           HD1      TYR  30 -35.183 -12.068 -19.295
    6    HD2  TYR  30           HD2      TYR  30 -31.392 -11.128 -17.597
    7    HE1  TYR  30           HE1      TYR  30 -34.941 -14.396 -18.533
    8    HE2  TYR  30           HE2      TYR  30 -31.154 -13.443 -16.838
    9    HH   TYR  30           HH       TYR  30 -32.645 -15.887 -17.958

  No H/Q in entry =           9
  In of MODEL   78
    1    H    GLU  31           H        GLU  31 -31.377  -8.394 -21.917
    2    HA   GLU  31           HA       GLU  31 -31.446  -6.224 -22.709
    3    HB2  GLU  31           HB2      GLU  31 -34.291  -7.116 -23.220
    4    HB3  GLU  31           HB3      GLU  31 -33.543  -5.688 -23.933
    5    HG2  GLU  31           HG2      GLU  31 -31.988  -7.012 -25.152
    6    HG3  GLU  31           HG3      GLU  31 -32.457  -8.471 -24.281

  No H/Q in entry =           6
  In of MODEL   78
    1    H    VAL  32           H        VAL  32 -31.637  -6.175 -19.975
    2    HA   VAL  32           HA       VAL  32 -33.627  -4.195 -19.278
    3    HB   VAL  32           HB       VAL  32 -31.168  -5.056 -17.721
    4   HG12  VAL  32          HG11      VAL  32 -32.744  -4.359 -15.808
    5   HG11  VAL  32          HG12      VAL  32 -33.641  -3.493 -17.055
    6   HG13  VAL  32          HG13      VAL  32 -31.955  -3.084 -16.737
    7   HG21  VAL  32          HG21      VAL  32 -32.826  -6.876 -18.427
    8   HG23  VAL  32          HG22      VAL  32 -33.911  -6.134 -17.251
    9   HG22  VAL  32          HG23      VAL  32 -32.348  -6.766 -16.733

  No H/Q in entry =           9
  In of MODEL   78
    1    HA   PRO  33           HA       PRO  33 -30.799  -1.054 -20.921
    2    HB2  PRO  33           HB2      PRO  33 -32.451   1.064 -20.758
    3    HB3  PRO  33           HB3      PRO  33 -32.839  -0.249 -21.870
    4    HG2  PRO  33           HG2      PRO  33 -33.825   0.163 -19.045
    5    HG3  PRO  33           HG3      PRO  33 -34.780  -0.087 -20.506
    6    HD2  PRO  33           HD2      PRO  33 -34.183  -2.149 -18.874
    7    HD3  PRO  33           HD3      PRO  33 -34.238  -2.369 -20.622

  No H/Q in entry =           7
  In of MODEL   78
    1    H    VAL  34           H        VAL  34 -29.493  -1.543 -18.985
    2    HA   VAL  34           HA       VAL  34 -29.359   0.872 -17.304
    3    HB   VAL  34           HB       VAL  34 -28.674  -0.577 -15.389
    4   HG12  VAL  34          HG11      VAL  34 -31.024  -1.609 -15.085
    5   HG11  VAL  34          HG12      VAL  34 -31.397  -0.849 -16.631
    6   HG13  VAL  34          HG13      VAL  34 -30.902   0.142 -15.258
    7   HG21  VAL  34          HG21      VAL  34 -28.737  -2.581 -17.427
    8   HG23  VAL  34          HG22      VAL  34 -29.761  -3.030 -16.062
    9   HG22  VAL  34          HG23      VAL  34 -28.065  -2.636 -15.798

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ILE  35           H        ILE  35 -27.411   1.423 -16.465
    2    HA   ILE  35           HA       ILE  35 -25.031   0.266 -17.757
    3    HB   ILE  35           HB       ILE  35 -25.615   3.111 -16.902
    4   HG12  ILE  35          HG12      ILE  35 -24.562   1.909 -19.470
    5   HG13  ILE  35          HG13      ILE  35 -26.228   2.417 -19.194
    6   HG21  ILE  35          HG21      ILE  35 -22.960   1.755 -17.244
    7   HG23  ILE  35          HG22      ILE  35 -23.484   2.883 -15.996
    8   HG22  ILE  35          HG23      ILE  35 -23.146   3.465 -17.626
    9   HD11  ILE  35          HD11      ILE  35 -24.971   4.689 -18.567
   10   HD13  ILE  35          HD12      ILE  35 -25.490   4.297 -20.206
   11   HD12  ILE  35          HD13      ILE  35 -23.815   4.028 -19.723

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ILE  36           H        ILE  36 -23.728  -0.698 -16.178
    2    HA   ILE  36           HA       ILE  36 -24.193  -0.155 -13.297
    3    HB   ILE  36           HB       ILE  36 -23.196  -2.780 -14.449
    4   HG12  ILE  36          HG12      ILE  36 -26.046  -2.172 -13.662
    5   HG13  ILE  36          HG13      ILE  36 -25.485  -2.090 -15.331
    6   HG23  ILE  36          HG21      ILE  36 -23.481  -3.662 -12.346
    7   HG22  ILE  36          HG22      ILE  36 -24.687  -2.462 -11.883
    8   HG21  ILE  36          HG23      ILE  36 -22.982  -2.015 -11.956
    9   HD13  ILE  36          HD11      ILE  36 -25.506  -4.307 -15.570
   10   HD12  ILE  36          HD12      ILE  36 -26.570  -4.276 -14.164
   11   HD11  ILE  36          HD13      ILE  36 -24.847  -4.587 -13.958

  No H/Q in entry =          11
  In of MODEL   78
    1    H    GLU  37           H        GLU  37 -22.451   0.574 -12.191
    2    HA   GLU  37           HA       GLU  37 -19.719  -0.030 -13.130
    3    HB2  GLU  37           HB2      GLU  37 -20.807   2.683 -12.401
    4    HB3  GLU  37           HB3      GLU  37 -19.087   2.312 -12.513
    5    HG2  GLU  37           HG2      GLU  37 -19.270   1.920 -14.865
    6    HG3  GLU  37           HG3      GLU  37 -21.022   2.098 -14.799

  No H/Q in entry =           6
  In of MODEL   78
    1    H    ALA  38           H        ALA  38 -18.211  -0.193 -11.457
    2    HA   ALA  38           HA       ALA  38 -19.237  -0.123  -8.681
    3    HB1  ALA  38           HB1      ALA  38 -17.406  -1.924 -10.142
    4    HB3  ALA  38           HB2      ALA  38 -18.430  -2.249  -8.744
    5    HB2  ALA  38           HB3      ALA  38 -16.866  -1.463  -8.527

  No H/Q in entry =           5
  In of MODEL   78
    1    H    PHE  39           H        PHE  39 -18.072   1.145  -7.194
    2    HA   PHE  39           HA       PHE  39 -15.638   2.526  -8.084
    3    HB2  PHE  39           HB2      PHE  39 -17.954   3.939  -6.759
    4    HB3  PHE  39           HB3      PHE  39 -16.427   4.658  -7.263
    5    HD1  PHE  39           HD1      PHE  39 -15.943   5.037  -9.614
    6    HD2  PHE  39           HD2      PHE  39 -19.701   3.494  -8.320
    7    HE1  PHE  39           HE1      PHE  39 -16.920   5.600 -11.821
    8    HE2  PHE  39           HE2      PHE  39 -20.689   4.043 -10.515
    9    HZ   PHE  39           HZ       PHE  39 -19.298   5.068 -12.282

  No H/Q in entry =           9
  In of MODEL   78
    1    HA   PRO  40           HA       PRO  40 -14.629   1.775  -3.813
    2    HB2  PRO  40           HB2      PRO  40 -12.999   3.898  -3.185
    3    HB3  PRO  40           HB3      PRO  40 -12.471   2.613  -4.272
    4    HG2  PRO  40           HG2      PRO  40 -13.681   5.283  -4.978
    5    HG3  PRO  40           HG3      PRO  40 -12.205   4.545  -5.602
    6    HD2  PRO  40           HD2      PRO  40 -14.424   4.333  -6.999
    7    HD3  PRO  40           HD3      PRO  40 -13.373   2.928  -6.836

  No H/Q in entry =           7
  In of MODEL   78
    1    H    GLU  41           H        GLU  41 -15.304   2.677  -1.666
    2    HA   GLU  41           HA       GLU  41 -17.659   4.223  -1.614
    3    HB2  GLU  41           HB2      GLU  41 -17.603   3.983   0.700
    4    HB3  GLU  41           HB3      GLU  41 -16.720   2.565   0.132
    5    HG2  GLU  41           HG2      GLU  41 -15.533   3.392   1.997
    6    HG3  GLU  41           HG3      GLU  41 -14.597   3.836   0.570

  No H/Q in entry =           6
  In of MODEL   78
    1    H    THR  42           H        THR  42 -14.398   5.367  -1.667
    2    HA   THR  42           HA       THR  42 -14.919   7.880  -0.416
    3    HB   THR  42           HB       THR  42 -12.811   8.615  -1.494
    4    HG1  THR  42           HG1      THR  42 -12.876   7.601  -3.447
    5   HG21  THR  42          HG21      THR  42 -12.840   5.866  -0.238
    6   HG23  THR  42          HG22      THR  42 -12.547   7.413   0.559
    7   HG22  THR  42          HG23      THR  42 -11.354   6.760  -0.562

  No H/Q in entry =           7
  In of MODEL   78
    1    H    LEU  43           H        LEU  43 -15.762   6.771  -3.528
    2    HA   LEU  43           HA       LEU  43 -16.210   9.533  -4.456
    3    HB2  LEU  43           HB2      LEU  43 -16.419   6.893  -5.895
    4    HB3  LEU  43           HB3      LEU  43 -16.705   8.473  -6.620
    5    HG   LEU  43           HG       LEU  43 -14.049   7.457  -5.635
    6   HD12  LEU  43          HD11      LEU  43 -14.810   8.032  -8.478
    7   HD11  LEU  43          HD12      LEU  43 -15.128   6.453  -7.761
    8   HD13  LEU  43          HD13      LEU  43 -13.476   7.058  -7.858
    9   HD22  LEU  43          HD21      LEU  43 -14.081   9.820  -5.413
   10   HD21  LEU  43          HD22      LEU  43 -14.941  10.027  -6.939
   11   HD23  LEU  43          HD23      LEU  43 -13.261   9.494  -6.939

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ALA  44           H        ALA  44 -18.016   7.551  -2.622
    2    HA   ALA  44           HA       ALA  44 -20.486   7.260  -3.935
    3    HB2  ALA  44           HB1      ALA  44 -20.259   6.126  -1.856
    4    HB3  ALA  44           HB2      ALA  44 -21.456   7.387  -1.559
    5    HB1  ALA  44           HB3      ALA  44 -19.793   7.602  -1.012

  No H/Q in entry =           5
  In of MODEL   78
    1    H    GLY  45           H        GLY  45 -19.254  10.130  -2.369
    2    HA3  GLY  45           HA2      GLY  45 -21.790  11.463  -2.697
    3    HA2  GLY  45           HA3      GLY  45 -20.289  12.184  -2.118

  No H/Q in entry =           3
  In of MODEL   78
    1    H    GLU  46           H        GLU  46 -18.709  11.387  -4.428
    2    HA   GLU  46           HA       GLU  46 -19.506  13.579  -6.162
    3    HB2  GLU  46           HB2      GLU  46 -17.173  11.660  -6.211
    4    HB3  GLU  46           HB3      GLU  46 -17.401  12.966  -7.373
    5    HG2  GLU  46           HG2      GLU  46 -15.915  13.894  -5.889
    6    HG3  GLU  46           HG3      GLU  46 -17.461  14.485  -5.280

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LYS  47           H        LYS  47 -19.148  10.083  -6.649
    2    HA   LYS  47           HA       LYS  47 -20.273  10.265  -9.316
    3    HB2  LYS  47           HB2      LYS  47 -18.528   8.539  -8.264
    4    HB3  LYS  47           HB3      LYS  47 -20.014   7.664  -7.896
    5    HG2  LYS  47           HG2      LYS  47 -19.392   6.782  -9.930
    6    HG3  LYS  47           HG3      LYS  47 -20.558   8.022 -10.390
    7    HD2  LYS  47           HD2      LYS  47 -18.612   9.590 -10.683
    8    HD3  LYS  47           HD3      LYS  47 -17.555   8.194 -10.483
    9    HE2  LYS  47           HE2      LYS  47 -18.460   7.142 -12.425
   10    HE3  LYS  47           HE3      LYS  47 -19.728   8.360 -12.558
   11    HZ1  LYS  47           HZ1      LYS  47 -17.821   9.998 -12.760
   12    HZ3  LYS  47           HZ2      LYS  47 -18.143   9.000 -14.096
   13    HZ2  LYS  47           HZ3      LYS  47 -16.839   8.648 -13.065

  No H/Q in entry =          13
  In of MODEL   78
    1    H    GLY  48           H        GLY  48 -21.524   9.374  -6.173
    2    HA3  GLY  48           HA2      GLY  48 -23.826   8.038  -6.921
    3    HA2  GLY  48           HA3      GLY  48 -23.661   9.025  -5.469

  No H/Q in entry =           3
  In of MODEL   78
    1    H    GLN  49           H        GLN  49 -23.254  11.504  -7.007
    2    HA   GLN  49           HA       GLN  49 -25.884  12.439  -7.124
    3    HB2  GLN  49           HB2      GLN  49 -23.413  13.495  -8.483
    4    HB3  GLN  49           HB3      GLN  49 -24.937  14.356  -8.379
    5    HG2  GLN  49           HG2      GLN  49 -24.768  14.356  -5.942
    6    HG3  GLN  49           HG3      GLN  49 -23.255  13.473  -6.045
    7   HE21  GLN  49          HE21      GLN  49 -23.284  15.686  -4.741
    8   HE22  GLN  49          HE22      GLN  49 -22.452  17.012  -5.375

  No H/Q in entry =           8
  In of MODEL   78
    1    H    ASN  50           H        ASN  50 -24.094  10.713  -9.545
    2    HA   ASN  50           HA       ASN  50 -26.043  11.483 -11.607
    3    HB2  ASN  50           HB2      ASN  50 -23.365  10.127 -11.874
    4    HB3  ASN  50           HB3      ASN  50 -24.449  10.499 -13.206
    5   HD21  ASN  50          HD21      ASN  50 -21.869  11.501 -11.595
    6   HD22  ASN  50          HD22      ASN  50 -21.749  13.152 -11.915

  No H/Q in entry =           6
  In of MODEL   78
    1    H    ALA  51           H        ALA  51 -25.855   9.102  -9.394
    2    HA   ALA  51           HA       ALA  51 -26.502   6.934 -11.248
    3    HB2  ALA  51           HB1      ALA  51 -25.818   5.605  -9.585
    4    HB3  ALA  51           HB2      ALA  51 -26.987   6.319  -8.475
    5    HB1  ALA  51           HB3      ALA  51 -25.396   7.053  -8.671

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ASP  52           H        ASP  52 -28.429   5.743 -11.115
    2    HA   ASP  52           HA       ASP  52 -30.726   7.415 -10.414
    3    HB2  ASP  52           HB2      ASP  52 -30.375   4.952 -12.120
    4    HB3  ASP  52           HB3      ASP  52 -31.963   5.572 -11.668

  No H/Q in entry =           4
  In of MODEL   78
    1    H    VAL  53           H        VAL  53 -28.929   4.627  -9.446
    2    HA   VAL  53           HA       VAL  53 -30.361   4.621  -6.923
    3    HB   VAL  53           HB       VAL  53 -31.653   2.906  -8.184
    4   HG11  VAL  53          HG11      VAL  53 -29.859   2.188  -9.726
    5   HG13  VAL  53          HG12      VAL  53 -30.599   0.827  -8.881
    6   HG12  VAL  53          HG13      VAL  53 -29.024   1.430  -8.371
    7   HG23  VAL  53          HG21      VAL  53 -30.690   0.965  -6.523
    8   HG22  VAL  53          HG22      VAL  53 -31.902   2.185  -6.134
    9   HG21  VAL  53          HG23      VAL  53 -30.208   2.466  -5.731

  No H/Q in entry =           9
  In of MODEL   78
    1    H    VAL  54           H        VAL  54 -29.013   4.254  -5.279
    2    HA   VAL  54           HA       VAL  54 -26.205   3.600  -5.915
    3    HB   VAL  54           HB       VAL  54 -27.380   5.271  -3.636
    4   HG11  VAL  54          HG11      VAL  54 -24.714   4.032  -3.958
    5   HG13  VAL  54          HG12      VAL  54 -25.503   4.640  -2.504
    6   HG12  VAL  54          HG13      VAL  54 -24.675   5.756  -3.588
    7   HG22  VAL  54          HG21      VAL  54 -26.650   7.154  -4.712
    8   HG21  VAL  54          HG22      VAL  54 -27.137   6.149  -6.076
    9   HG23  VAL  54          HG23      VAL  54 -25.434   6.282  -5.645

  No H/Q in entry =           9
  In of MODEL   78
    1    H    LEU  55           H        LEU  55 -25.483   1.714  -5.303
    2    HA   LEU  55           HA       LEU  55 -26.887   0.275  -3.140
    3    HB2  LEU  55           HB2      LEU  55 -25.269  -0.754  -5.459
    4    HB3  LEU  55           HB3      LEU  55 -25.959  -1.755  -4.180
    5    HG   LEU  55           HG       LEU  55 -27.509  -0.238  -6.269
    6   HD13  LEU  55          HD11      LEU  55 -27.093  -2.049  -7.515
    7   HD12  LEU  55          HD12      LEU  55 -27.984  -3.003  -6.329
    8   HD11  LEU  55          HD13      LEU  55 -26.235  -2.823  -6.185
    9   HD23  LEU  55          HD21      LEU  55 -28.662  -2.291  -4.435
   10   HD22  LEU  55          HD22      LEU  55 -29.452  -0.947  -5.260
   11   HD21  LEU  55          HD23      LEU  55 -28.444  -0.644  -3.845

  No H/Q in entry =          11
  In of MODEL   78
    1    H    LEU  56           H        LEU  56 -25.690  -0.266  -1.348
    2    HA   LEU  56           HA       LEU  56 -22.788   0.324  -1.405
    3    HB2  LEU  56           HB2      LEU  56 -24.560  -0.039   0.998
    4    HB3  LEU  56           HB3      LEU  56 -22.883   0.502   0.986
    5    HG   LEU  56           HG       LEU  56 -25.294   2.038   0.056
    6   HD11  LEU  56          HD11      LEU  56 -24.142   1.696   2.565
    7   HD13  LEU  56          HD12      LEU  56 -25.224   3.002   2.084
    8   HD12  LEU  56          HD13      LEU  56 -23.478   3.225   1.990
    9   HD23  LEU  56          HD21      LEU  56 -23.467   3.865  -0.122
   10   HD22  LEU  56          HD22      LEU  56 -23.783   2.763  -1.463
   11   HD21  LEU  56          HD23      LEU  56 -22.404   2.487  -0.401

  No H/Q in entry =          11
  In of MODEL   78
    1    H    GLY  57           H        GLY  57 -21.300  -1.218  -0.901
    2    HA3  GLY  57           HA2      GLY  57 -22.042  -3.956  -1.134
    3    HA2  GLY  57           HA3      GLY  57 -20.454  -3.361  -0.653

  No H/Q in entry =           3
  In of MODEL   78
    1    HA   PRO  58           HA       PRO  58 -23.169  -4.636   3.054
    2    HB2  PRO  58           HB2      PRO  58 -22.310  -7.199   3.621
    3    HB3  PRO  58           HB3      PRO  58 -23.724  -6.869   2.620
    4    HG2  PRO  58           HG2      PRO  58 -20.948  -7.556   1.808
    5    HG3  PRO  58           HG3      PRO  58 -22.482  -8.109   1.138
    6    HD2  PRO  58           HD2      PRO  58 -21.003  -6.173  -0.067
    7    HD3  PRO  58           HD3      PRO  58 -22.766  -6.201  -0.159

  No H/Q in entry =           7
  In of MODEL   78
    1    H    GLN  59           H        GLN  59 -19.777  -4.876   2.426
    2    HA   GLN  59           HA       GLN  59 -19.007  -4.883   5.182
    3    HB2  GLN  59           HB2      GLN  59 -17.518  -3.957   2.724
    4    HB3  GLN  59           HB3      GLN  59 -16.823  -4.016   4.330
    5    HG2  GLN  59           HG2      GLN  59 -16.075  -5.984   3.406
    6    HG3  GLN  59           HG3      GLN  59 -17.514  -6.516   4.261
    7   HE21  GLN  59          HE21      GLN  59 -17.236  -8.103   2.752
    8   HE22  GLN  59          HE22      GLN  59 -17.926  -8.361   1.260

  No H/Q in entry =           8
  In of MODEL   78
    1    H    ILE  60           H        ILE  60 -20.120  -2.369   3.015
    2    HA   ILE  60           HA       ILE  60 -19.388  -0.388   5.084
    3    HB   ILE  60           HB       ILE  60 -19.761   1.345   3.274
    4   HG12  ILE  60          HG12      ILE  60 -19.382  -0.850   1.280
    5   HG13  ILE  60          HG13      ILE  60 -21.007  -0.426   1.818
    6   HG23  ILE  60          HG21      ILE  60 -17.590   1.118   2.344
    7   HG22  ILE  60          HG22      ILE  60 -17.577  -0.615   2.667
    8   HG21  ILE  60          HG23      ILE  60 -17.549   0.531   4.006
    9   HD12  ILE  60          HD11      ILE  60 -19.074   1.164   0.182
   10   HD11  ILE  60          HD12      ILE  60 -20.230   2.019   1.202
   11   HD13  ILE  60          HD13      ILE  60 -20.804   0.919  -0.051

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ALA  61           H        ALA  61 -21.732  -2.133   5.142
    2    HA   ALA  61           HA       ALA  61 -24.066  -0.613   4.716
    3    HB1  ALA  61           HB1      ALA  61 -25.174  -2.198   6.026
    4    HB2  ALA  61           HB2      ALA  61 -23.748  -2.508   7.017
    5    HB3  ALA  61           HB3      ALA  61 -23.812  -3.096   5.356

  No H/Q in entry =           5
  In of MODEL   78
    1    H    TYR  62           H        TYR  62 -21.841  -0.617   7.502
    2    HA   TYR  62           HA       TYR  62 -23.493   0.911   9.203
    3    HB2  TYR  62           HB2      TYR  62 -21.498   1.425  10.452
    4    HB3  TYR  62           HB3      TYR  62 -21.405  -0.252   9.916
    5    HD1  TYR  62           HD1      TYR  62 -19.762  -0.934   8.206
    6    HD2  TYR  62           HD2      TYR  62 -19.916   3.097   9.615
    7    HE1  TYR  62           HE1      TYR  62 -17.577  -0.488   7.155
    8    HE2  TYR  62           HE2      TYR  62 -17.716   3.538   8.566
    9    HH   TYR  62           HH       TYR  62 -16.378   1.518   6.291

  No H/Q in entry =           9
  In of MODEL   78
    1    H    MET  63           H        MET  63 -21.926   1.915   6.352
    2    HA   MET  63           HA       MET  63 -21.941   4.742   7.086
    3    HB2  MET  63           HB2      MET  63 -21.249   3.298   4.527
    4    HB3  MET  63           HB3      MET  63 -21.170   5.048   4.731
    5    HG2  MET  63           HG2      MET  63 -19.426   4.801   6.386
    6    HG3  MET  63           HG3      MET  63 -19.531   3.046   6.261
    7    HE2  MET  63           HE1      MET  63 -17.667   6.109   3.727
    8    HE1  MET  63           HE2      MET  63 -19.184   6.240   4.616
    9    HE3  MET  63           HE3      MET  63 -19.197   5.773   2.915

  No H/Q in entry =           9
  In of MODEL   78
    1    H    LEU  64           H        LEU  64 -24.383   2.737   6.106
    2    HA   LEU  64           HA       LEU  64 -25.695   4.103   4.053
    3    HB2  LEU  64           HB2      LEU  64 -26.419   1.932   4.946
    4    HB3  LEU  64           HB3      LEU  64 -26.922   2.723   6.440
    5    HG   LEU  64           HG       LEU  64 -28.701   3.881   5.238
    6   HD13  LEU  64          HD11      LEU  64 -28.447   4.170   3.008
    7   HD12  LEU  64          HD12      LEU  64 -28.987   2.499   2.842
    8   HD11  LEU  64          HD13      LEU  64 -27.263   2.870   2.895
    9   HD23  LEU  64          HD21      LEU  64 -29.040   1.051   4.452
   10   HD22  LEU  64          HD22      LEU  64 -30.094   2.105   5.393
   11   HD21  LEU  64          HD23      LEU  64 -28.667   1.392   6.142

  No H/Q in entry =          11
  In of MODEL   78
    1    HA   PRO  65           HA       PRO  65 -28.060   7.070   6.860
    2    HB2  PRO  65           HB2      PRO  65 -26.060   7.327   9.107
    3    HB3  PRO  65           HB3      PRO  65 -27.813   7.494   9.164
    4    HG2  PRO  65           HG2      PRO  65 -26.735   5.292  10.055
    5    HG3  PRO  65           HG3      PRO  65 -28.156   5.182   9.016
    6    HD2  PRO  65           HD2      PRO  65 -25.254   4.764   8.291
    7    HD3  PRO  65           HD3      PRO  65 -26.654   3.791   7.838

  No H/Q in entry =           7
  In of MODEL   78
    1    H    GLU  66           H        GLU  66 -24.507   7.242   6.915
    2    HA   GLU  66           HA       GLU  66 -24.392  10.060   6.547
    3    HB2  GLU  66           HB2      GLU  66 -22.439   7.882   5.855
    4    HB3  GLU  66           HB3      GLU  66 -22.099   9.603   5.669
    5    HG2  GLU  66           HG2      GLU  66 -22.321   9.926   8.043
    6    HG3  GLU  66           HG3      GLU  66 -22.736   8.226   8.253

  No H/Q in entry =           6
  In of MODEL   78
    1    H    ILE  67           H        ILE  67 -24.331   7.345   4.258
    2    HA   ILE  67           HA       ILE  67 -24.038   9.108   1.987
    3    HB   ILE  67           HB       ILE  67 -24.749   6.146   2.130
    4   HG12  ILE  67          HG12      ILE  67 -22.204   7.494   1.212
    5   HG13  ILE  67          HG13      ILE  67 -22.462   7.034   2.893
    6   HG21  ILE  67          HG21      ILE  67 -24.824   8.055  -0.068
    7   HG23  ILE  67          HG22      ILE  67 -25.343   6.371  -0.038
    8   HG22  ILE  67          HG23      ILE  67 -23.658   6.767  -0.371
    9   HD12  ILE  67          HD11      ILE  67 -21.944   5.325   0.516
   10   HD11  ILE  67          HD12      ILE  67 -22.912   4.670   1.836
   11   HD13  ILE  67          HD13      ILE  67 -21.270   5.236   2.143

  No H/Q in entry =          11
  In of MODEL   78
    1    H    GLN  68           H        GLN  68 -26.826   7.852   3.620
    2    HA   GLN  68           HA       GLN  68 -28.722   8.693   1.669
    3    HB2  GLN  68           HB2      GLN  68 -28.936   8.279   4.647
    4    HB3  GLN  68           HB3      GLN  68 -30.297   8.803   3.669
    5    HG2  GLN  68           HG2      GLN  68 -30.205   6.793   2.365
    6    HG3  GLN  68           HG3      GLN  68 -28.719   6.298   3.152
    7   HE21  GLN  68          HE21      GLN  68 -30.809   4.808   3.008
    8   HE22  GLN  68          HE22      GLN  68 -31.599   4.282   4.421

  No H/Q in entry =           8
  In of MODEL   78
    1    H    ARG  69           H        ARG  69 -27.206  10.418   4.421
    2    HA   ARG  69           HA       ARG  69 -28.724  12.817   4.057
    3    HB2  ARG  69           HB2      ARG  69 -26.317  12.011   5.620
    4    HB3  ARG  69           HB3      ARG  69 -26.504  13.727   5.287
    5    HG2  ARG  69           HG2      ARG  69 -28.812  13.614   6.271
    6    HG3  ARG  69           HG3      ARG  69 -28.498  11.934   6.719
    7    HD2  ARG  69           HD2      ARG  69 -26.947  14.376   7.658
    8    HD3  ARG  69           HD3      ARG  69 -28.013  13.388   8.645
    9    HE   ARG  69           HE       ARG  69 -25.354  12.633   7.668
   10   HH21  ARG  69          HH11      ARG  69 -24.432  10.906   8.835
   11   HH22  ARG  69          HH12      ARG  69 -25.402  10.013   9.957
   12   HH11  ARG  69          HH21      ARG  69 -28.262  11.881   9.374
   13   HH12  ARG  69          HH22      ARG  69 -27.570  10.562  10.260

  No H/Q in entry =          13
  In of MODEL   78
    1    H    LEU  70           H        LEU  70 -25.781  11.608   2.662
    2    HA   LEU  70           HA       LEU  70 -24.821  14.052   1.522
    3    HB2  LEU  70           HB2      LEU  70 -23.684  11.792   2.078
    4    HB3  LEU  70           HB3      LEU  70 -24.278  11.312   0.490
    5    HG   LEU  70           HG       LEU  70 -22.779  12.794  -0.584
    6   HD11  LEU  70          HD11      LEU  70 -21.992  13.647   2.211
    7   HD13  LEU  70          HD12      LEU  70 -22.757  14.654   0.981
    8   HD12  LEU  70          HD13      LEU  70 -21.108  14.076   0.743
    9   HD22  LEU  70          HD21      LEU  70 -21.242  11.165  -0.384
   10   HD21  LEU  70          HD22      LEU  70 -22.126  10.567   1.020
   11   HD23  LEU  70          HD23      LEU  70 -20.807  11.719   1.232

  No H/Q in entry =          11
  In of MODEL   78
    1    H    LEU  71           H        LEU  71 -26.823  11.400   0.382
    2    HA   LEU  71           HA       LEU  71 -27.453  12.888  -2.109
    3    HB2  LEU  71           HB2      LEU  71 -27.477   9.890  -1.705
    4    HB3  LEU  71           HB3      LEU  71 -27.665  10.764  -3.225
    5    HG   LEU  71           HG       LEU  71 -25.140  10.903  -1.578
    6   HD12  LEU  71          HD11      LEU  71 -25.112   9.309  -4.033
    7   HD11  LEU  71          HD12      LEU  71 -26.074   8.609  -2.734
    8   HD13  LEU  71          HD13      LEU  71 -24.373   8.987  -2.464
    9   HD22  LEU  71          HD21      LEU  71 -25.361  12.732  -3.045
   10   HD21  LEU  71          HD22      LEU  71 -25.804  11.680  -4.389
   11   HD23  LEU  71          HD23      LEU  71 -24.173  11.620  -3.723

  No H/Q in entry =          11
  In of MODEL   78
    1    HA   PRO  72           HA       PRO  72 -31.269  12.174   0.526
    2    HB2  PRO  72           HB2      PRO  72 -32.276  14.680   0.487
    3    HB3  PRO  72           HB3      PRO  72 -30.935  14.291   1.564
    4    HG2  PRO  72           HG2      PRO  72 -30.838  15.534  -1.174
    5    HG3  PRO  72           HG3      PRO  72 -30.095  16.108   0.320
    6    HD2  PRO  72           HD2      PRO  72 -28.680  14.656  -1.476
    7    HD3  PRO  72           HD3      PRO  72 -28.405  14.480   0.256

  No H/Q in entry =           7
  In of MODEL   78
    1    H    ASN  73           H        ASN  73 -30.723  13.208  -2.678
    2    HA   ASN  73           HA       ASN  73 -33.563  12.743  -3.298
    3    HB2  ASN  73           HB2      ASN  73 -33.177  13.904  -5.382
    4    HB3  ASN  73           HB3      ASN  73 -32.703  14.893  -4.010
    5   HD21  ASN  73          HD21      ASN  73 -31.929  15.022  -6.691
    6   HD22  ASN  73          HD22      ASN  73 -30.255  14.960  -6.894

  No H/Q in entry =           6
  In of MODEL   78
    1    H    LYS  74           H        LYS  74 -31.454  10.600  -2.917
    2    HA   LYS  74           HA       LYS  74 -31.956   9.210  -5.482
    3    HB2  LYS  74           HB2      LYS  74 -29.401   9.041  -3.879
    4    HB3  LYS  74           HB3      LYS  74 -29.746   8.230  -5.406
    5    HG2  LYS  74           HG2      LYS  74 -29.652  11.208  -5.163
    6    HG3  LYS  74           HG3      LYS  74 -28.220  10.230  -5.490
    7    HD2  LYS  74           HD2      LYS  74 -29.296   9.266  -7.441
    8    HD3  LYS  74           HD3      LYS  74 -30.768  10.176  -7.098
    9    HE2  LYS  74           HE2      LYS  74 -29.661  12.255  -7.519
   10    HE3  LYS  74           HE3      LYS  74 -28.093  11.455  -7.631
   11    HZ2  LYS  74           HZ1      LYS  74 -29.609  12.003  -9.740
   12    HZ1  LYS  74           HZ2      LYS  74 -30.174  10.440  -9.385
   13    HZ3  LYS  74           HZ3      LYS  74 -28.522  10.698  -9.688

  No H/Q in entry =          13
  In of MODEL   78
    1    HA   PRO  75           HA       PRO  75 -33.160   6.110  -2.546
    2    HB2  PRO  75           HB2      PRO  75 -33.353   3.900  -4.158
    3    HB3  PRO  75           HB3      PRO  75 -34.555   5.189  -4.202
    4    HG2  PRO  75           HG2      PRO  75 -32.198   4.751  -5.994
    5    HG3  PRO  75           HG3      PRO  75 -33.872   5.100  -6.425
    6    HD2  PRO  75           HD2      PRO  75 -32.038   7.071  -6.367
    7    HD3  PRO  75           HD3      PRO  75 -33.688   7.369  -5.813

  No H/Q in entry =           7
  In of MODEL   78
    1    H    VAL  76           H        VAL  76 -31.641   5.120  -1.196
    2    HA   VAL  76           HA       VAL  76 -29.119   4.067  -2.333
    3    HB   VAL  76           HB       VAL  76 -29.472   5.478   0.346
    4   HG11  VAL  76          HG11      VAL  76 -27.056   4.345  -1.077
    5   HG13  VAL  76          HG12      VAL  76 -27.716   3.835   0.478
    6   HG12  VAL  76          HG13      VAL  76 -26.959   5.419   0.320
    7   HG22  VAL  76          HG21      VAL  76 -28.919   7.426  -0.517
    8   HG21  VAL  76          HG22      VAL  76 -29.430   6.721  -2.053
    9   HG23  VAL  76          HG23      VAL  76 -27.723   6.723  -1.608

  No H/Q in entry =           9
  In of MODEL   78
    1    H    GLU  77           H        GLU  77 -28.777   1.920  -1.752
    2    HA   GLU  77           HA       GLU  77 -29.501   1.053   0.894
    3    HB2  GLU  77           HB2      GLU  77 -31.016  -0.674   0.350
    4    HB3  GLU  77           HB3      GLU  77 -31.655   0.824  -0.328
    5    HG2  GLU  77           HG2      GLU  77 -31.017   0.132  -2.529
    6    HG3  GLU  77           HG3      GLU  77 -30.288  -1.335  -1.880

  No H/Q in entry =           6
  In of MODEL   78
    1    H    VAL  78           H        VAL  78 -29.053  -1.021   1.524
    2    HA   VAL  78           HA       VAL  78 -26.353  -1.627   0.611
    3    HB   VAL  78           HB       VAL  78 -27.994  -2.639   2.973
    4   HG11  VAL  78          HG11      VAL  78 -25.595  -3.718   1.818
    5   HG13  VAL  78          HG12      VAL  78 -26.466  -4.259   3.255
    6   HG12  VAL  78          HG13      VAL  78 -25.213  -3.026   3.395
    7   HG22  VAL  78          HG21      VAL  78 -26.606  -1.214   4.321
    8   HG21  VAL  78          HG22      VAL  78 -27.404  -0.270   3.064
    9   HG23  VAL  78          HG23      VAL  78 -25.701  -0.700   2.899

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ILE  79           H        ILE  79 -25.714  -3.490  -0.324
    2    HA   ILE  79           HA       ILE  79 -27.695  -5.063  -1.682
    3    HB   ILE  79           HB       ILE  79 -24.678  -5.422  -1.483
    4   HG12  ILE  79          HG12      ILE  79 -26.388  -4.383  -3.747
    5   HG13  ILE  79          HG13      ILE  79 -25.566  -3.340  -2.585
    6   HG22  ILE  79          HG21      ILE  79 -25.725  -6.631  -3.812
    7   HG21  ILE  79          HG22      ILE  79 -26.670  -7.226  -2.448
    8   HG23  ILE  79          HG23      ILE  79 -24.916  -7.405  -2.450
    9   HD13  ILE  79          HD11      ILE  79 -24.159  -3.349  -4.413
   10   HD12  ILE  79          HD12      ILE  79 -24.403  -5.069  -4.715
   11   HD11  ILE  79          HD13      ILE  79 -23.440  -4.544  -3.332

  No H/Q in entry =          11
  In of MODEL   78
    1    H    ASP  80           H        ASP  80 -28.446  -7.041  -1.120
    2    HA   ASP  80           HA       ASP  80 -28.325  -7.971   1.514
    3    HB2  ASP  80           HB2      ASP  80 -30.054  -8.624  -0.125
    4    HB3  ASP  80           HB3      ASP  80 -28.845  -9.553  -1.013

  No H/Q in entry =           4
  In of MODEL   78
    1    H    SER  81           H        SER  81 -26.721  -9.032   2.620
    2    HA   SER  81           HA       SER  81 -24.197  -9.555   1.407
    3    HB2  SER  81           HB2      SER  81 -23.572 -10.574   3.558
    4    HB3  SER  81           HB3      SER  81 -24.372  -9.022   3.799
    5    HG   SER  81           HG       SER  81 -26.042  -9.981   4.651

  No H/Q in entry =           5
  In of MODEL   78
    1    H    LEU  82           H        LEU  82 -26.782 -11.802   1.714
    2    HA   LEU  82           HA       LEU  82 -25.107 -14.072   1.153
    3    HB2  LEU  82           HB2      LEU  82 -28.067 -13.749   0.725
    4    HB3  LEU  82           HB3      LEU  82 -27.172 -15.259   0.875
    5    HG   LEU  82           HG       LEU  82 -27.617 -13.263   3.075
    6   HD13  LEU  82          HD11      LEU  82 -29.137 -14.913   3.983
    7   HD12  LEU  82          HD12      LEU  82 -28.761 -16.035   2.673
    8   HD11  LEU  82          HD13      LEU  82 -29.638 -14.543   2.332
    9   HD21  LEU  82          HD21      LEU  82 -26.156 -15.887   2.843
   10   HD23  LEU  82          HD22      LEU  82 -26.699 -15.253   4.395
   11   HD22  LEU  82          HD23      LEU  82 -25.541 -14.340   3.428

  No H/Q in entry =          11
  In of MODEL   78
    1    H    LEU  83           H        LEU  83 -27.199 -11.935  -0.726
    2    HA   LEU  83           HA       LEU  83 -26.936 -13.248  -3.216
    3    HB2  LEU  83           HB2      LEU  83 -27.506 -10.376  -2.527
    4    HB3  LEU  83           HB3      LEU  83 -27.512 -11.000  -4.176
    5    HG   LEU  83           HG       LEU  83 -29.506 -11.531  -1.994
    6   HD13  LEU  83          HD11      LEU  83 -30.372  -9.715  -3.030
    7   HD12  LEU  83          HD12      LEU  83 -30.779 -10.836  -4.327
    8   HD11  LEU  83          HD13      LEU  83 -29.297  -9.884  -4.416
    9   HD23  LEU  83          HD21      LEU  83 -29.590 -12.759  -4.735
   10   HD22  LEU  83          HD22      LEU  83 -30.531 -13.182  -3.304
   11   HD21  LEU  83          HD23      LEU  83 -28.817 -13.588  -3.385

  No H/Q in entry =          11
  In of MODEL   78
    1    H    TYR  84           H        TYR  84 -25.111 -10.777  -1.518
    2    HA   TYR  84           HA       TYR  84 -23.292 -10.157  -3.652
    3    HB2  TYR  84           HB2      TYR  84 -23.842  -8.675  -1.684
    4    HB3  TYR  84           HB3      TYR  84 -22.896  -9.772  -0.680
    5    HD1  TYR  84           HD1      TYR  84 -20.432 -10.061  -1.183
    6    HD2  TYR  84           HD2      TYR  84 -22.788  -6.967  -2.947
    7    HE1  TYR  84           HE1      TYR  84 -18.364  -8.846  -1.782
    8    HE2  TYR  84           HE2      TYR  84 -20.730  -5.747  -3.562
    9    HH   TYR  84           HH       TYR  84 -17.514  -7.068  -2.709

  No H/Q in entry =           9
  In of MODEL   78
    1    H    GLY  85           H        GLY  85 -22.922 -12.181  -0.733
    2    HA3  GLY  85           HA2      GLY  85 -20.298 -12.971  -1.242
    3    HA2  GLY  85           HA3      GLY  85 -21.473 -13.897  -0.310

  No H/Q in entry =           3
  In of MODEL   78
    1    H    LYS  86           H        LYS  86 -23.307 -14.347  -2.366
    2    HA   LYS  86           HA       LYS  86 -22.128 -16.642  -3.661
    3    HB2  LYS  86           HB2      LYS  86 -24.560 -16.014  -2.671
    4    HB3  LYS  86           HB3      LYS  86 -24.820 -15.648  -4.375
    5    HG2  LYS  86           HG2      LYS  86 -24.372 -17.896  -4.989
    6    HG3  LYS  86           HG3      LYS  86 -23.891 -18.297  -3.340
    7    HD2  LYS  86           HD2      LYS  86 -26.181 -18.993  -3.655
    8    HD3  LYS  86           HD3      LYS  86 -26.160 -17.605  -2.570
    9    HE2  LYS  86           HE2      LYS  86 -27.012 -16.170  -4.186
   10    HE3  LYS  86           HE3      LYS  86 -26.526 -17.222  -5.515
   11    HZ3  LYS  86           HZ1      LYS  86 -28.241 -18.715  -5.061
   12    HZ2  LYS  86           HZ2      LYS  86 -28.975 -17.194  -4.874
   13    HZ1  LYS  86           HZ3      LYS  86 -28.516 -18.089  -3.506

  No H/Q in entry =          13
  In of MODEL   78
    1    H    VAL  87           H        VAL  87 -22.305 -13.420  -4.512
    2    HA   VAL  87           HA       VAL  87 -22.086 -12.206  -6.440
    3    HB   VAL  87           HB       VAL  87 -20.876 -14.652  -7.773
    4   HG12  VAL  87          HG11      VAL  87 -19.837 -11.837  -7.892
    5   HG11  VAL  87          HG12      VAL  87 -21.266 -12.270  -8.834
    6   HG13  VAL  87          HG13      VAL  87 -19.740 -13.110  -9.106
    7   HG23  VAL  87          HG21      VAL  87 -18.679 -13.813  -6.784
    8   HG22  VAL  87          HG22      VAL  87 -19.748 -14.730  -5.725
    9   HG21  VAL  87          HG23      VAL  87 -19.674 -12.974  -5.596

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ASP  88           H        ASP  88 -24.558 -12.995  -6.082
    2    HA   ASP  88           HA       ASP  88 -25.624 -14.243  -8.489
    3    HB2  ASP  88           HB2      ASP  88 -26.589 -14.574  -6.163
    4    HB3  ASP  88           HB3      ASP  88 -27.139 -12.900  -6.238

  No H/Q in entry =           4
  In of MODEL   78
    1    H    GLY  89           H        GLY  89 -25.002 -12.927 -10.118
    2    HA3  GLY  89           HA2      GLY  89 -25.343 -10.167 -10.282
    3    HA2  GLY  89           HA3      GLY  89 -25.264 -11.266 -11.657

  No H/Q in entry =           3
  In of MODEL   78
    1    H    LEU  90           H        LEU  90 -27.627 -12.762 -11.212
    2    HA   LEU  90           HA       LEU  90 -29.552 -10.920 -12.290
    3    HB2  LEU  90           HB2      LEU  90 -29.484 -13.309 -12.901
    4    HB3  LEU  90           HB3      LEU  90 -29.957 -13.724 -11.254
    5    HG   LEU  90           HG       LEU  90 -32.139 -12.726 -11.590
    6   HD13  LEU  90          HD11      LEU  90 -32.069 -10.959 -13.043
    7   HD12  LEU  90          HD12      LEU  90 -32.544 -12.210 -14.193
    8   HD11  LEU  90          HD13      LEU  90 -30.854 -11.720 -14.074
    9   HD23  LEU  90          HD21      LEU  90 -31.992 -14.318 -14.047
   10   HD22  LEU  90          HD22      LEU  90 -32.950 -14.557 -12.586
   11   HD21  LEU  90          HD23      LEU  90 -31.265 -15.073 -12.628

  No H/Q in entry =          11
  In of MODEL   78
    1    H    GLY  91           H        GLY  91 -29.277 -12.449  -9.126
    2    HA3  GLY  91           HA2      GLY  91 -31.669 -11.486  -8.059
    3    HA2  GLY  91           HA3      GLY  91 -30.242 -11.949  -7.132

  No H/Q in entry =           3
  In of MODEL   78
    1    H    VAL  92           H        VAL  92 -28.438 -10.005  -7.976
    2    HA   VAL  92           HA       VAL  92 -29.350  -7.773  -6.392
    3    HB   VAL  92           HB       VAL  92 -26.792  -8.075  -8.009
    4   HG12  VAL  92          HG11      VAL  92 -27.049  -6.231  -5.657
    5   HG11  VAL  92          HG12      VAL  92 -27.754  -5.708  -7.189
    6   HG13  VAL  92          HG13      VAL  92 -26.034  -6.079  -7.093
    7   HG22  VAL  92          HG21      VAL  92 -26.467  -9.667  -6.439
    8   HG21  VAL  92          HG22      VAL  92 -27.647  -8.967  -5.329
    9   HG23  VAL  92          HG23      VAL  92 -26.032  -8.270  -5.453

  No H/Q in entry =           9
  In of MODEL   78
    1    H    LEU  93           H        LEU  93 -28.929  -8.367  -9.823
    2    HA   LEU  93           HA       LEU  93 -29.432  -5.744 -10.717
    3    HB2  LEU  93           HB2      LEU  93 -28.694  -7.541 -12.206
    4    HB3  LEU  93           HB3      LEU  93 -30.239  -8.362 -11.983
    5    HG   LEU  93           HG       LEU  93 -31.369  -6.447 -13.077
    6   HD11  LEU  93          HD11      LEU  93 -29.610  -4.753 -12.563
    7   HD13  LEU  93          HD12      LEU  93 -30.060  -4.787 -14.269
    8   HD12  LEU  93          HD13      LEU  93 -28.559  -5.544 -13.737
    9   HD23  LEU  93          HD21      LEU  93 -30.316  -6.924 -15.377
   10   HD22  LEU  93          HD22      LEU  93 -31.078  -8.238 -14.482
   11   HD21  LEU  93          HD23      LEU  93 -29.320  -8.081 -14.494

  No H/Q in entry =          11
  In of MODEL   78
    1    H    LYS  94           H        LYS  94 -31.650  -8.434  -9.886
    2    HA   LYS  94           HA       LYS  94 -34.078  -7.122 -10.478
    3    HB2  LYS  94           HB2      LYS  94 -33.425  -9.299  -8.497
    4    HB3  LYS  94           HB3      LYS  94 -35.062  -8.694  -8.746
    5    HG2  LYS  94           HG2      LYS  94 -34.947  -9.433 -11.091
    6    HG3  LYS  94           HG3      LYS  94 -33.343 -10.098 -10.782
    7    HD2  LYS  94           HD2      LYS  94 -34.372 -11.516  -8.967
    8    HD3  LYS  94           HD3      LYS  94 -35.953 -10.952  -9.504
    9    HE2  LYS  94           HE2      LYS  94 -35.401 -11.821 -11.787
   10    HE3  LYS  94           HE3      LYS  94 -33.939 -12.531 -11.101
   11    HZ3  LYS  94           HZ1      LYS  94 -35.698 -14.155 -11.280
   12    HZ2  LYS  94           HZ2      LYS  94 -36.723 -13.198 -10.319
   13    HZ1  LYS  94           HZ3      LYS  94 -35.318 -13.875  -9.649

  No H/Q in entry =          13
  In of MODEL   78
    1    H    ALA  95           H        ALA  95 -32.229  -7.176  -7.443
    2    HA   ALA  95           HA       ALA  95 -34.156  -5.723  -5.931
    3    HB2  ALA  95           HB1      ALA  95 -31.702  -6.966  -5.427
    4    HB3  ALA  95           HB2      ALA  95 -32.723  -6.133  -4.255
    5    HB1  ALA  95           HB3      ALA  95 -31.429  -5.260  -5.075

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ALA  96           H        ALA  96 -31.583  -4.693  -8.033
    2    HA   ALA  96           HA       ALA  96 -31.640  -1.940  -7.225
    3    HB2  ALA  96           HB1      ALA  96 -30.307  -1.610  -9.340
    4    HB3  ALA  96           HB2      ALA  96 -30.515  -3.328  -9.679
    5    HB1  ALA  96           HB3      ALA  96 -29.620  -2.813  -8.249

  No H/Q in entry =           5
  In of MODEL   78
    1    H    VAL  97           H        VAL  97 -33.090  -3.706  -9.923
    2    HA   VAL  97           HA       VAL  97 -34.298  -1.455 -11.142
    3    HB   VAL  97           HB       VAL  97 -34.940  -4.421 -11.218
    4   HG11  VAL  97          HG11      VAL  97 -36.847  -2.514 -11.666
    5   HG13  VAL  97          HG12      VAL  97 -36.820  -4.097 -12.443
    6   HG12  VAL  97          HG13      VAL  97 -36.151  -2.697 -13.277
    7   HG21  VAL  97          HG21      VAL  97 -33.781  -2.498 -13.236
    8   HG23  VAL  97          HG22      VAL  97 -34.140  -4.197 -13.546
    9   HG22  VAL  97          HG23      VAL  97 -32.907  -3.755 -12.363

  No H/Q in entry =           9
  In of MODEL   78
    1    H    ALA  98           H        ALA  98 -35.337  -3.730  -8.627
    2    HA   ALA  98           HA       ALA  98 -37.957  -2.732  -8.244
    3    HB1  ALA  98           HB1      ALA  98 -36.814  -4.883  -7.248
    4    HB3  ALA  98           HB2      ALA  98 -38.037  -4.039  -6.297
    5    HB2  ALA  98           HB3      ALA  98 -36.325  -3.798  -5.946

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ALA  99           H        ALA  99 -34.916  -1.783  -6.607
    2    HA   ALA  99           HA       ALA  99 -36.141   0.113  -4.912
    3    HB1  ALA  99           HB1      ALA  99 -33.453  -0.618  -5.687
    4    HB2  ALA  99           HB2      ALA  99 -34.034   0.081  -4.175
    5    HB3  ALA  99           HB3      ALA  99 -33.624   1.131  -5.532

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ILE 100           H        ILE 100 -35.134   0.345  -8.272
    2    HA   ILE 100           HA       ILE 100 -35.471   3.182  -8.450
    3    HB   ILE 100           HB       ILE 100 -35.464   1.053 -10.618
    4   HG12  ILE 100          HG12      ILE 100 -33.408   3.154  -9.934
    5   HG13  ILE 100          HG13      ILE 100 -33.349   1.498  -9.326
    6   HG21  ILE 100          HG21      ILE 100 -36.047   3.948 -10.706
    7   HG23  ILE 100          HG22      ILE 100 -36.490   2.668 -11.836
    8   HG22  ILE 100          HG23      ILE 100 -34.875   3.375 -11.893
    9   HD12  ILE 100          HD11      ILE 100 -32.890   2.521 -12.090
   10   HD11  ILE 100          HD12      ILE 100 -33.459   0.868 -11.853
   11   HD13  ILE 100          HD13      ILE 100 -31.934   1.387 -11.138

  No H/Q in entry =          11
  In of MODEL   78
    1    H    LYS 101           H        LYS 101 -37.623   0.461  -9.198
    2    HA   LYS 101           HA       LYS 101 -39.799   2.006 -10.161
    3    HB2  LYS 101           HB2      LYS 101 -39.522  -0.772  -9.073
    4    HB3  LYS 101           HB3      LYS 101 -41.117  -0.093  -9.398
    5    HG2  LYS 101           HG2      LYS 101 -40.667   0.099 -11.696
    6    HG3  LYS 101           HG3      LYS 101 -38.950  -0.216 -11.459
    7    HD2  LYS 101           HD2      LYS 101 -40.099  -2.178 -12.363
    8    HD3  LYS 101           HD3      LYS 101 -39.444  -2.495 -10.756
    9    HE2  LYS 101           HE2      LYS 101 -41.461  -3.308 -10.246
   10    HE3  LYS 101           HE3      LYS 101 -42.011  -1.632 -10.222
   11    HZ3  LYS 101           HZ1      LYS 101 -42.908  -1.809 -12.336
   12    HZ2  LYS 101           HZ2      LYS 101 -43.283  -3.315 -11.646
   13    HZ1  LYS 101           HZ3      LYS 101 -41.989  -3.181 -12.738

  No H/Q in entry =          13
  In of MODEL   78
    1    H    LYS 102           H        LYS 102 -39.204   0.514  -6.976
    2    HA   LYS 102           HA       LYS 102 -41.505   1.568  -5.749
    3    HB2  LYS 102           HB2      LYS 102 -40.161  -0.242  -4.767
    4    HB3  LYS 102           HB3      LYS 102 -38.829   0.885  -4.518
    5    HG2  LYS 102           HG2      LYS 102 -40.209   2.184  -2.993
    6    HG3  LYS 102           HG3      LYS 102 -41.545   1.062  -3.244
    7    HD2  LYS 102           HD2      LYS 102 -40.212  -0.749  -2.253
    8    HD3  LYS 102           HD3      LYS 102 -38.876   0.376  -1.999
    9    HE2  LYS 102           HE2      LYS 102 -40.299   1.757  -0.561
   10    HE3  LYS 102           HE3      LYS 102 -41.654   0.664  -0.835
   11    HZ1  LYS 102           HZ1      LYS 102 -39.833  -1.007   0.133
   12    HZ3  LYS 102           HZ2      LYS 102 -40.984  -0.197   1.082
   13    HZ2  LYS 102           HZ3      LYS 102 -39.405   0.417   0.953

  No H/Q in entry =          13
  In of MODEL   78
    1    H    ALA 103           H        ALA 103 -38.639   3.134  -6.759
    2    HA   ALA 103           HA       ALA 103 -38.975   5.408  -4.943
    3    HB2  ALA 103           HB1      ALA 103 -37.038   6.271  -6.520
    4    HB3  ALA 103           HB2      ALA 103 -36.912   4.564  -6.943
    5    HB1  ALA 103           HB3      ALA 103 -36.702   5.076  -5.269

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ALA 104           H        ALA 104 -39.579   4.690  -8.296
    2    HA   ALA 104           HA       ALA 104 -40.320   7.447  -8.874
    3    HB2  ALA 104           HB1      ALA 104 -40.341   6.808 -11.085
    4    HB1  ALA 104           HB2      ALA 104 -40.979   5.204 -10.726
    5    HB3  ALA 104           HB3      ALA 104 -39.271   5.557 -10.453

  No H/Q in entry =           5
  In of MODEL   78
    1    H    ALA 105           H        ALA 105 -41.798   5.232  -7.090
    2    HA   ALA 105           HA       ALA 105 -44.295   6.491  -7.028
    3    HB2  ALA 105           HB1      ALA 105 -45.005   5.620  -9.075
    4    HB3  ALA 105           HB2      ALA 105 -45.568   4.382  -7.952
    5    HB1  ALA 105           HB3      ALA 105 -44.088   4.127  -8.875

  No H/Q in entry =           5
  In of MODEL   79
    1    H1   ALA   1           H3       ALA   1 -12.221 -15.914  -2.259
    2    H2   ALA   1           H2       ALA   1 -11.281 -17.051  -3.107
    3    H3   ALA   1           H1       ALA   1 -12.435 -16.111  -3.931
    4    HA   ALA   1           HA       ALA   1 -13.824 -17.819  -3.682
    5    HB3  ALA   1           HB1      ALA   1 -12.416 -19.584  -3.232
    6    HB1  ALA   1           HB2      ALA   1 -13.161 -19.476  -1.637
    7    HB2  ALA   1           HB3      ALA   1 -11.591 -18.727  -1.929

  No H/Q in entry =           7
  In of MODEL   79
    1    H    GLU   2           H        GLU   2 -15.430 -18.682  -2.017
    2    HA   GLU   2           HA       GLU   2 -17.079 -16.970  -0.945
    3    HB2  GLU   2           HB2      GLU   2 -16.116 -19.392   0.592
    4    HB3  GLU   2           HB3      GLU   2 -17.642 -18.549   0.857
    5    HG2  GLU   2           HG2      GLU   2 -18.630 -19.640  -0.870
    6    HG3  GLU   2           HG3      GLU   2 -17.317 -19.232  -1.964

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLU   3           H        GLU   3 -15.141 -18.316   1.663
    2    HA   GLU   3           HA       GLU   3 -15.362 -15.964   3.224
    3    HB2  GLU   3           HB2      GLU   3 -13.763 -18.503   3.461
    4    HB3  GLU   3           HB3      GLU   3 -13.529 -17.183   4.607
    5    HG2  GLU   3           HG2      GLU   3 -15.716 -17.345   5.441
    6    HG3  GLU   3           HG3      GLU   3 -16.317 -18.148   3.996

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LEU   4           H        LEU   4 -12.410 -17.428   1.810
    2    HA   LEU   4           HA       LEU   4 -10.581 -15.516   2.396
    3    HB2  LEU   4           HB2      LEU   4 -10.825 -16.813  -0.328
    4    HB3  LEU   4           HB3      LEU   4  -9.372 -16.086   0.347
    5    HG   LEU   4           HG       LEU   4 -10.846 -18.491   1.469
    6   HD13  LEU   4          HD11      LEU   4  -9.214 -19.838   0.527
    7   HD12  LEU   4          HD12      LEU   4  -8.011 -18.550   0.492
    8   HD11  LEU   4          HD13      LEU   4  -9.308 -18.577  -0.701
    9   HD23  LEU   4          HD21      LEU   4  -8.585 -18.544   2.834
   10   HD22  LEU   4          HD22      LEU   4  -9.907 -17.511   3.374
   11   HD21  LEU   4          HD23      LEU   4  -8.554 -16.816   2.482

  No H/Q in entry =          11
  In of MODEL   79
    1    H    GLU   5           H        GLU   5 -12.936 -15.319  -0.261
    2    HA   GLU   5           HA       GLU   5 -11.952 -12.830  -1.267
    3    HB2  GLU   5           HB2      GLU   5 -13.298 -14.420  -2.622
    4    HB3  GLU   5           HB3      GLU   5 -14.693 -14.069  -1.601
    5    HG2  GLU   5           HG2      GLU   5 -14.580 -11.696  -2.237
    6    HG3  GLU   5           HG3      GLU   5 -13.168 -12.026  -3.240

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLU   6           H        GLU   6 -14.658 -13.722   0.844
    2    HA   GLU   6           HA       GLU   6 -15.572 -11.050   1.251
    3    HB2  GLU   6           HB2      GLU   6 -16.987 -13.046   1.659
    4    HB3  GLU   6           HB3      GLU   6 -15.943 -13.491   3.008
    5    HG2  GLU   6           HG2      GLU   6 -16.470 -11.379   4.141
    6    HG3  GLU   6           HG3      GLU   6 -17.481 -10.889   2.783

  No H/Q in entry =           6
  In of MODEL   79
    1    H    VAL   7           H        VAL   7 -13.243 -13.150   2.805
    2    HA   VAL   7           HA       VAL   7 -12.768 -11.574   5.130
    3    HB   VAL   7           HB       VAL   7 -11.065 -13.609   3.667
    4   HG11  VAL   7          HG11      VAL   7 -10.586 -12.076   6.228
    5   HG13  VAL   7          HG12      VAL   7  -9.494 -12.284   4.860
    6   HG12  VAL   7          HG13      VAL   7  -9.834 -13.643   5.931
    7   HG21  VAL   7          HG21      VAL   7 -13.304 -14.185   4.902
    8   HG23  VAL   7          HG22      VAL   7 -12.368 -13.907   6.371
    9   HG22  VAL   7          HG23      VAL   7 -11.877 -15.164   5.238

  No H/Q in entry =           9
  In of MODEL   79
    1    H    VAL   8           H        VAL   8 -11.279 -11.680   1.909
    2    HA   VAL   8           HA       VAL   8  -9.221  -9.798   2.388
    3    HB   VAL   8           HB       VAL   8 -10.691 -10.571  -0.138
    4   HG12  VAL   8          HG11      VAL   8  -8.572  -9.424  -1.174
    5   HG11  VAL   8          HG12      VAL   8  -8.521  -8.543   0.354
    6   HG13  VAL   8          HG13      VAL   8  -9.941  -8.422  -0.685
    7   HG21  VAL   8          HG21      VAL   8  -9.010 -12.128   1.215
    8   HG23  VAL   8          HG22      VAL   8  -7.787 -11.094   0.483
    9   HG22  VAL   8          HG23      VAL   8  -8.875 -12.024  -0.542

  No H/Q in entry =           9
  In of MODEL   79
    1    H    MET   9           H        MET   9 -12.577  -9.424   1.252
    2    HA   MET   9           HA       MET   9 -12.529  -6.646   0.818
    3    HB2  MET   9           HB2      MET   9 -14.699  -8.582   1.586
    4    HB3  MET   9           HB3      MET   9 -15.031  -6.849   1.530
    5    HG2  MET   9           HG2      MET   9 -13.994  -6.891  -0.818
    6    HG3  MET   9           HG3      MET   9 -14.128  -8.647  -0.722
    7    HE2  MET   9           HE1      MET   9 -16.911  -9.374   0.678
    8    HE1  MET   9           HE2      MET   9 -15.946  -9.973  -0.669
    9    HE3  MET   9           HE3      MET   9 -17.645  -9.578  -0.919

  No H/Q in entry =           9
  In of MODEL   79
    1    H    GLY  10           H        GLY  10 -13.162  -8.542   3.749
    2    HA3  GLY  10           HA2      GLY  10 -13.709  -6.361   5.473
    3    HA2  GLY  10           HA3      GLY  10 -13.133  -7.947   5.982

  No H/Q in entry =           3
  In of MODEL   79
    1    H    LEU  11           H        LEU  11 -10.697  -8.059   4.650
    2    HA   LEU  11           HA       LEU  11  -8.991  -6.617   6.395
    3    HB2  LEU  11           HB2      LEU  11  -8.455  -8.037   3.783
    4    HB3  LEU  11           HB3      LEU  11  -7.182  -7.327   4.773
    5    HG   LEU  11           HG       LEU  11  -9.166  -9.370   5.803
    6   HD13  LEU  11          HD11      LEU  11  -7.950 -10.600   4.229
    7   HD12  LEU  11          HD12      LEU  11  -7.003 -10.834   5.698
    8   HD11  LEU  11          HD13      LEU  11  -6.477  -9.666   4.487
    9   HD22  LEU  11          HD21      LEU  11  -8.305  -8.354   7.714
   10   HD21  LEU  11          HD22      LEU  11  -6.775  -7.944   6.941
   11   HD23  LEU  11          HD23      LEU  11  -7.088  -9.602   7.452

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  12           H        ILE  12  -9.919  -6.074   3.012
    2    HA   ILE  12           HA       ILE  12  -8.243  -3.834   2.575
    3    HB   ILE  12           HB       ILE  12 -10.901  -4.522   1.297
    4   HG12  ILE  12          HG12      ILE  12  -8.859  -6.161   1.203
    5   HG13  ILE  12          HG13      ILE  12  -9.724  -5.800  -0.276
    6   HG21  ILE  12          HG21      ILE  12  -8.693  -2.621   0.442
    7   HG23  ILE  12          HG22      ILE  12 -10.346  -2.188   0.854
    8   HG22  ILE  12          HG23      ILE  12 -10.011  -3.129  -0.570
    9   HD13  ILE  12          HD11      ILE  12  -8.007  -4.218  -0.929
   10   HD12  ILE  12          HD12      ILE  12  -7.225  -5.736  -0.490
   11   HD11  ILE  12          HD13      ILE  12  -7.207  -4.386   0.622

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  13           H        ILE  13 -11.594  -4.121   3.691
    2    HA   ILE  13           HA       ILE  13 -12.068  -1.336   3.965
    3    HB   ILE  13           HB       ILE  13 -13.250  -3.768   5.326
    4   HG12  ILE  13          HG12      ILE  13 -13.513  -3.258   2.809
    5   HG13  ILE  13          HG13      ILE  13 -14.953  -3.637   3.730
    6   HG22  ILE  13          HG21      ILE  13 -15.166  -1.997   5.780
    7   HG21  ILE  13          HG22      ILE  13 -13.835  -0.848   5.739
    8   HG23  ILE  13          HG23      ILE  13 -13.826  -2.163   6.911
    9   HD11  ILE  13          HD11      ILE  13 -14.228  -0.764   3.641
   10   HD13  ILE  13          HD12      ILE  13 -15.794  -1.544   3.543
   11   HD12  ILE  13          HD13      ILE  13 -14.775  -1.482   2.122

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ASN  14           H        ASN  14 -10.927  -3.821   6.231
    2    HA   ASN  14           HA       ASN  14 -10.720  -2.183   8.516
    3    HB2  ASN  14           HB2      ASN  14 -10.453  -4.788   8.191
    4    HB3  ASN  14           HB3      ASN  14  -8.748  -4.391   8.023
    5   HD21  ASN  14          HD21      ASN  14  -9.360  -5.920  10.202
    6   HD22  ASN  14          HD22      ASN  14  -9.328  -5.000  11.627

  No H/Q in entry =           6
  In of MODEL   79
    1    H    SER  15           H        SER  15  -8.330  -2.990   6.008
    2    HA   SER  15           HA       SER  15  -6.189  -1.484   7.065
    3    HB2  SER  15           HB2      SER  15  -5.180  -1.695   4.902
    4    HB3  SER  15           HB3      SER  15  -6.129  -3.160   5.130
    5    HG   SER  15           HG       SER  15  -7.656  -2.400   3.777

  No H/Q in entry =           5
  In of MODEL   79
    1    H    GLY  16           H        GLY  16  -8.811  -0.634   4.836
    2    HA3  GLY  16           HA2      GLY  16  -7.975   2.013   4.280
    3    HA2  GLY  16           HA3      GLY  16  -9.623   1.407   4.129

  No H/Q in entry =           3
  In of MODEL   79
    1    H    GLN  17           H        GLN  17 -10.142   0.677   6.782
    2    HA   GLN  17           HA       GLN  17 -10.860   3.177   7.928
    3    HB2  GLN  17           HB2      GLN  17 -10.735   0.393   9.103
    4    HB3  GLN  17           HB3      GLN  17 -11.357   1.787   9.985
    5    HG2  GLN  17           HG2      GLN  17 -13.055   2.158   8.260
    6    HG3  GLN  17           HG3      GLN  17 -12.404   0.826   7.306
    7   HE21  GLN  17          HE21      GLN  17 -14.831   1.563   9.498
    8   HE22  GLN  17          HE22      GLN  17 -15.119   0.004  10.106

  No H/Q in entry =           8
  In of MODEL   79
    1    H    ALA  18           H        ALA  18  -8.210   0.914   8.529
    2    HA   ALA  18           HA       ALA  18  -7.106   2.138  10.793
    3    HB2  ALA  18           HB1      ALA  18  -6.489  -0.073   9.421
    4    HB3  ALA  18           HB2      ALA  18  -5.325   0.718  10.484
    5    HB1  ALA  18           HB3      ALA  18  -5.261   0.998   8.742

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ARG  19           H        ARG  19  -6.362   2.668   7.339
    2    HA   ARG  19           HA       ARG  19  -4.477   4.729   7.755
    3    HB2  ARG  19           HB2      ARG  19  -4.810   3.587   5.562
    4    HB3  ARG  19           HB3      ARG  19  -6.360   4.415   5.396
    5    HG2  ARG  19           HG2      ARG  19  -5.248   6.596   5.457
    6    HG3  ARG  19           HG3      ARG  19  -3.691   5.822   5.750
    7    HD2  ARG  19           HD2      ARG  19  -3.836   6.412   3.408
    8    HD3  ARG  19           HD3      ARG  19  -3.906   4.651   3.554
    9    HE   ARG  19           HE       ARG  19  -6.547   5.540   3.564
   10   HH21  ARG  19          HH11      ARG  19  -7.756   5.687   1.654
   11   HH22  ARG  19          HH12      ARG  19  -6.946   5.771   0.129
   12   HH11  ARG  19          HH21      ARG  19  -3.786   5.625   1.512
   13   HH12  ARG  19          HH22      ARG  19  -4.696   5.734   0.049

  No H/Q in entry =          13
  In of MODEL   79
    1    H    SER  20           H        SER  20  -7.980   4.817   7.179
    2    HA   SER  20           HA       SER  20  -8.360   7.569   7.133
    3    HB2  SER  20           HB2      SER  20 -10.227   6.205   6.609
    4    HB3  SER  20           HB3      SER  20 -10.106   5.325   8.130
    5    HG   SER  20           HG       SER  20 -10.805   7.125   9.211

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LEU  21           H        LEU  21  -8.323   5.387   9.937
    2    HA   LEU  21           HA       LEU  21  -8.767   7.378  11.905
    3    HB2  LEU  21           HB2      LEU  21  -7.512   4.639  11.982
    4    HB3  LEU  21           HB3      LEU  21  -7.563   5.664  13.413
    5    HG   LEU  21           HG       LEU  21 -10.017   4.946  11.782
    6   HD11  LEU  21          HD11      LEU  21  -8.813   3.647  14.235
    7   HD13  LEU  21          HD12      LEU  21  -9.200   2.887  12.692
    8   HD12  LEU  21          HD13      LEU  21 -10.497   3.421  13.762
    9   HD22  LEU  21          HD21      LEU  21 -10.675   6.798  13.025
   10   HD21  LEU  21          HD22      LEU  21  -9.516   6.494  14.315
   11   HD23  LEU  21          HD23      LEU  21 -10.985   5.537  14.215

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ALA  22           H        ALA  22  -5.813   6.031  10.478
    2    HA   ALA  22           HA       ALA  22  -3.934   7.360  12.088
    3    HB2  ALA  22           HB1      ALA  22  -3.513   5.510  10.394
    4    HB1  ALA  22           HB2      ALA  22  -2.328   6.817  10.421
    5    HB3  ALA  22           HB3      ALA  22  -3.554   6.762   9.153

  No H/Q in entry =           5
  In of MODEL   79
    1    H    TYR  23           H        TYR  23  -5.280   8.366   8.914
    2    HA   TYR  23           HA       TYR  23  -3.967  10.874   8.835
    3    HB2  TYR  23           HB2      TYR  23  -5.054   9.950   6.851
    4    HB3  TYR  23           HB3      TYR  23  -6.628  10.048   7.642
    5    HD1  TYR  23           HD1      TYR  23  -3.747  12.105   6.463
    6    HD2  TYR  23           HD2      TYR  23  -7.878  12.053   7.636
    7    HE1  TYR  23           HE1      TYR  23  -3.991  14.452   5.701
    8    HE2  TYR  23           HE2      TYR  23  -8.123  14.401   6.873
    9    HH   TYR  23           HH       TYR  23  -5.529  16.056   5.159

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ALA  24           H        ALA  24  -7.069   9.869  10.235
    2    HA   ALA  24           HA       ALA  24  -7.923  12.451  11.011
    3    HB1  ALA  24           HB1      ALA  24  -9.727  11.184  11.490
    4    HB2  ALA  24           HB2      ALA  24  -8.887  10.620  12.933
    5    HB3  ALA  24           HB3      ALA  24  -8.764   9.709  11.428

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ALA  25           H        ALA  25  -5.889  10.011  12.572
    2    HA   ALA  25           HA       ALA  25  -5.547  11.266  15.072
    3    HB2  ALA  25           HB1      ALA  25  -4.764   8.921  14.246
    4    HB3  ALA  25           HB2      ALA  25  -3.749   9.788  15.401
    5    HB1  ALA  25           HB3      ALA  25  -3.324   9.775  13.689

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LEU  26           H        LEU  26  -3.778  11.581  12.021
    2    HA   LEU  26           HA       LEU  26  -1.830  13.418  12.924
    3    HB2  LEU  26           HB2      LEU  26  -1.531  12.269  10.819
    4    HB3  LEU  26           HB3      LEU  26  -3.015  12.964  10.173
    5    HG   LEU  26           HG       LEU  26  -2.019  15.223  10.303
    6   HD12  LEU  26          HD11      LEU  26   0.521  15.265  10.700
    7   HD11  LEU  26          HD12      LEU  26   0.317  13.682  11.446
    8   HD13  LEU  26          HD13      LEU  26  -0.499  15.090  12.128
    9   HD21  LEU  26          HD21      LEU  26  -0.267  13.184   8.896
   10   HD23  LEU  26          HD22      LEU  26  -0.328  14.905   8.526
   11   HD22  LEU  26          HD23      LEU  26  -1.744  13.895   8.247

  No H/Q in entry =          11
  In of MODEL   79
    1    H    LYS  27           H        LYS  27  -5.025  13.873  11.467
    2    HA   LYS  27           HA       LYS  27  -4.995  16.662  11.269
    3    HB2  LYS  27           HB2      LYS  27  -6.733  15.170  10.294
    4    HB3  LYS  27           HB3      LYS  27  -7.377  14.908  11.915
    5    HG2  LYS  27           HG2      LYS  27  -7.825  17.310  12.154
    6    HG3  LYS  27           HG3      LYS  27  -7.130  17.613  10.558
    7    HD2  LYS  27           HD2      LYS  27  -8.857  16.164   9.533
    8    HD3  LYS  27           HD3      LYS  27  -9.558  15.878  11.127
    9    HE2  LYS  27           HE2      LYS  27 -10.020  18.286  11.373
   10    HE3  LYS  27           HE3      LYS  27  -9.290  18.594   9.794
   11    HZ3  LYS  27           HZ1      LYS  27 -11.668  18.449   9.567
   12    HZ2  LYS  27           HZ2      LYS  27 -11.698  16.932  10.337
   13    HZ1  LYS  27           HZ3      LYS  27 -10.965  17.102   8.811

  No H/Q in entry =          13
  In of MODEL   79
    1    H    GLN  28           H        GLN  28  -5.849  14.569  14.002
    2    HA   GLN  28           HA       GLN  28  -6.749  16.565  15.784
    3    HB2  GLN  28           HB2      GLN  28  -5.324  13.944  16.315
    4    HB3  GLN  28           HB3      GLN  28  -6.061  14.943  17.569
    5    HG2  GLN  28           HG2      GLN  28  -7.532  13.806  15.174
    6    HG3  GLN  28           HG3      GLN  28  -7.579  13.128  16.801
    7   HE21  GLN  28          HE21      GLN  28  -9.424  14.966  14.807
    8   HE22  GLN  28          HE22      GLN  28 -10.191  15.964  15.945

  No H/Q in entry =           8
  In of MODEL   79
    1    H    ALA  29           H        ALA  29  -3.525  15.293  15.073
    2    HA   ALA  29           HA       ALA  29  -2.085  16.702  17.042
    3    HB1  ALA  29           HB1      ALA  29  -0.156  16.025  15.911
    4    HB3  ALA  29           HB2      ALA  29  -0.922  16.144  14.327
    5    HB2  ALA  29           HB3      ALA  29  -1.327  14.808  15.404

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LYS  30           H        LYS  30  -2.970  17.575  13.719
    2    HA   LYS  30           HA       LYS  30  -1.576  20.024  13.609
    3    HB2  LYS  30           HB2      LYS  30  -4.111  19.135  12.217
    4    HB3  LYS  30           HB3      LYS  30  -3.288  20.655  11.868
    5    HG2  LYS  30           HG2      LYS  30  -1.214  19.374  11.341
    6    HG3  LYS  30           HG3      LYS  30  -2.110  17.873  11.591
    7    HD2  LYS  30           HD2      LYS  30  -3.690  18.505   9.807
    8    HD3  LYS  30           HD3      LYS  30  -2.817  20.018   9.559
    9    HE2  LYS  30           HE2      LYS  30  -0.781  18.736   8.965
   10    HE3  LYS  30           HE3      LYS  30  -1.674  17.228   9.183
   11    HZ2  LYS  30           HZ1      LYS  30  -1.518  18.100   6.840
   12    HZ1  LYS  30           HZ2      LYS  30  -2.565  19.357   7.316
   13    HZ3  LYS  30           HZ3      LYS  30  -3.080  17.738   7.390

  No H/Q in entry =          13
  In of MODEL   79
    1    H    GLN  31           H        GLN  31  -4.662  19.156  15.042
    2    HA   GLN  31           HA       GLN  31  -5.436  21.909  15.500
    3    HB2  GLN  31           HB2      GLN  31  -6.595  19.457  16.830
    4    HB3  GLN  31           HB3      GLN  31  -7.364  21.025  16.590
    5    HG2  GLN  31           HG2      GLN  31  -6.667  20.252  13.995
    6    HG3  GLN  31           HG3      GLN  31  -7.180  18.745  14.745
    7   HE21  GLN  31          HE21      GLN  31  -8.611  20.313  12.654
    8   HE22  GLN  31          HE22      GLN  31 -10.122  20.697  13.322

  No H/Q in entry =           8
  In of MODEL   79
    1    H    GLY  32           H        GLY  32  -3.106  19.991  16.804
    2    HA3  GLY  32           HA2      GLY  32  -1.695  20.459  18.596
    3    HA2  GLY  32           HA3      GLY  32  -2.826  21.697  19.128

  No H/Q in entry =           3
  In of MODEL   79
    1    H    ASP  33           H        ASP  33  -4.240  18.652  18.475
    2    HA   ASP  33           HA       ASP  33  -4.629  18.191  21.357
    3    HB2  ASP  33           HB2      ASP  33  -6.048  17.175  18.889
    4    HB3  ASP  33           HB3      ASP  33  -6.380  16.562  20.507

  No H/Q in entry =           4
  In of MODEL   79
    1    H    PHE  34           H        PHE  34  -2.455  17.349  21.647
    2    HA   PHE  34           HA       PHE  34  -1.456  15.104  20.238
    3    HB2  PHE  34           HB2      PHE  34  -0.823  16.090  23.029
    4    HB3  PHE  34           HB3      PHE  34   0.104  14.871  22.155
    5    HD1  PHE  34           HD1      PHE  34  -0.077  18.296  22.893
    6    HD2  PHE  34           HD2      PHE  34   0.742  15.597  19.651
    7    HE1  PHE  34           HE1      PHE  34   1.204  20.073  21.731
    8    HE2  PHE  34           HE2      PHE  34   2.017  17.378  18.494
    9    HZ   PHE  34           HZ       PHE  34   2.250  19.612  19.538

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ALA  35           H        ALA  35  -3.477  15.372  23.116
    2    HA   ALA  35           HA       ALA  35  -3.248  12.710  24.009
    3    HB3  ALA  35           HB1      ALA  35  -5.702  13.326  24.884
    4    HB1  ALA  35           HB2      ALA  35  -5.178  14.946  24.425
    5    HB2  ALA  35           HB3      ALA  35  -4.252  14.025  25.609

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ALA  36           H        ALA  36  -5.718  14.218  21.927
    2    HA   ALA  36           HA       ALA  36  -7.127  11.801  21.458
    3    HB1  ALA  36           HB1      ALA  36  -8.595  13.219  20.513
    4    HB3  ALA  36           HB2      ALA  36  -7.433  13.645  19.256
    5    HB2  ALA  36           HB3      ALA  36  -7.451  14.531  20.781

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ALA  37           H        ALA  37  -4.465  13.400  19.772
    2    HA   ALA  37           HA       ALA  37  -4.440  11.767  17.473
    3    HB3  ALA  37           HB1      ALA  37  -2.444  13.485  18.883
    4    HB2  ALA  37           HB2      ALA  37  -2.986  13.540  17.207
    5    HB1  ALA  37           HB3      ALA  37  -1.824  12.314  17.719

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LYS  38           H        LYS  38  -2.660  11.465  20.539
    2    HA   LYS  38           HA       LYS  38  -1.328   9.071  20.039
    3    HB2  LYS  38           HB2      LYS  38  -1.644  10.831  22.188
    4    HB3  LYS  38           HB3      LYS  38  -2.252   9.299  22.807
    5    HG2  LYS  38           HG2      LYS  38  -0.157   8.187  22.255
    6    HG3  LYS  38           HG3      LYS  38   0.440   9.635  21.439
    7    HD2  LYS  38           HD2      LYS  38   0.618  10.853  23.473
    8    HD3  LYS  38           HD3      LYS  38  -0.390   9.698  24.347
    9    HE2  LYS  38           HE2      LYS  38   1.971   9.391  24.949
   10    HE3  LYS  38           HE3      LYS  38   1.366   7.973  24.088
   11    HZ3  LYS  38           HZ1      LYS  38   2.652   8.398  22.298
   12    HZ2  LYS  38           HZ2      LYS  38   3.612   9.229  23.429
   13    HZ1  LYS  38           HZ3      LYS  38   2.522  10.085  22.446

  No H/Q in entry =          13
  In of MODEL   79
    1    H    ALA  39           H        ALA  39  -4.559   9.552  21.464
    2    HA   ALA  39           HA       ALA  39  -5.105   6.830  21.971
    3    HB3  ALA  39           HB1      ALA  39  -7.277   8.767  21.220
    4    HB2  ALA  39           HB2      ALA  39  -6.369   8.996  22.715
    5    HB1  ALA  39           HB3      ALA  39  -7.282   7.509  22.457

  No H/Q in entry =           5
  In of MODEL   79
    1    H    MET  40           H        MET  40  -5.718   8.843  19.130
    2    HA   MET  40           HA       MET  40  -7.196   6.906  17.678
    3    HB2  MET  40           HB2      MET  40  -5.603   9.309  16.764
    4    HB3  MET  40           HB3      MET  40  -6.632   8.346  15.700
    5    HG2  MET  40           HG2      MET  40  -7.654   9.589  18.266
    6    HG3  MET  40           HG3      MET  40  -7.726  10.424  16.717
    7    HE3  MET  40           HE1      MET  40 -10.317   8.796  14.670
    8    HE2  MET  40           HE2      MET  40  -8.565   8.920  14.509
    9    HE1  MET  40           HE3      MET  40  -9.484  10.281  15.150

  No H/Q in entry =           9
  In of MODEL   79
    1    H    MET  41           H        MET  41  -3.708   7.658  17.777
    2    HA   MET  41           HA       MET  41  -2.956   5.909  15.670
    3    HB2  MET  41           HB2      MET  41  -1.325   6.580  18.132
    4    HB3  MET  41           HB3      MET  41  -0.716   5.936  16.612
    5    HG2  MET  41           HG2      MET  41  -1.889   8.115  15.618
    6    HG3  MET  41           HG3      MET  41  -1.644   8.702  17.261
    7    HE2  MET  41           HE1      MET  41   1.286   6.617  17.601
    8    HE1  MET  41           HE2      MET  41   0.498   7.906  18.505
    9    HE3  MET  41           HE3      MET  41   2.116   8.158  17.852

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ASP  42           H        ASP  42  -3.315   5.431  19.158
    2    HA   ASP  42           HA       ASP  42  -2.266   2.842  19.309
    3    HB2  ASP  42           HB2      ASP  42  -3.135   4.596  21.139
    4    HB3  ASP  42           HB3      ASP  42  -4.558   3.564  21.076

  No H/Q in entry =           4
  In of MODEL   79
    1    H    GLN  43           H        GLN  43  -5.608   3.930  18.833
    2    HA   GLN  43           HA       GLN  43  -6.740   1.338  18.644
    3    HB2  GLN  43           HB2      GLN  43  -7.684   3.986  17.523
    4    HB3  GLN  43           HB3      GLN  43  -8.640   2.503  17.506
    5    HG2  GLN  43           HG2      GLN  43  -8.329   2.381  20.012
    6    HG3  GLN  43           HG3      GLN  43  -7.612   3.989  19.937
    7   HE21  GLN  43          HE21      GLN  43  -9.782   4.058  21.452
    8   HE22  GLN  43          HE22      GLN  43 -11.151   4.627  20.630

  No H/Q in entry =           8
  In of MODEL   79
    1    H    SER  44           H        SER  44  -5.427   3.560  16.224
    2    HA   SER  44           HA       SER  44  -6.137   2.074  13.939
    3    HB2  SER  44           HB2      SER  44  -4.889   4.463  14.376
    4    HB3  SER  44           HB3      SER  44  -3.534   3.474  13.836
    5    HG   SER  44           HG       SER  44  -4.662   4.442  12.081

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ARG  45           H        ARG  45  -3.245   1.973  16.000
    2    HA   ARG  45           HA       ARG  45  -1.764   0.027  14.606
    3    HB2  ARG  45           HB2      ARG  45  -0.917   1.451  16.470
    4    HB3  ARG  45           HB3      ARG  45  -1.896   0.515  17.596
    5    HG2  ARG  45           HG2      ARG  45  -0.659  -1.538  16.944
    6    HG3  ARG  45           HG3      ARG  45   0.344  -0.577  15.860
    7    HD2  ARG  45           HD2      ARG  45   1.085   0.806  17.811
    8    HD3  ARG  45           HD3      ARG  45   0.175  -0.274  18.890
    9    HE   ARG  45           HE       ARG  45   1.872  -1.861  17.297
   10   HH21  ARG  45          HH11      ARG  45   3.781  -2.675  18.121
   11   HH22  ARG  45          HH12      ARG  45   4.559  -1.887  19.447
   12   HH11  ARG  45          HH21      ARG  45   2.179   0.605  19.687
   13   HH12  ARG  45          HH22      ARG  45   3.652  -0.027  20.332

  No H/Q in entry =          13
  In of MODEL   79
    1    H    MET  46           H        MET  46  -4.143  -0.307  17.222
    2    HA   MET  46           HA       MET  46  -3.960  -3.105  17.525
    3    HB2  MET  46           HB2      MET  46  -6.159  -1.128  18.127
    4    HB3  MET  46           HB3      MET  46  -6.310  -2.845  18.502
    5    HG2  MET  46           HG2      MET  46  -3.934  -2.483  19.612
    6    HG3  MET  46           HG3      MET  46  -4.459  -0.807  19.685
    7    HE1  MET  46           HE1      MET  46  -7.226  -0.731  19.849
    8    HE3  MET  46           HE2      MET  46  -8.033  -1.345  21.288
    9    HE2  MET  46           HE3      MET  46  -7.874  -2.375  19.870

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ALA  47           H        ALA  47  -6.003  -1.096  15.445
    2    HA   ALA  47           HA       ALA  47  -7.619  -3.152  14.388
    3    HB3  ALA  47           HB1      ALA  47  -8.311  -0.917  13.979
    4    HB1  ALA  47           HB2      ALA  47  -7.830  -1.547  12.404
    5    HB2  ALA  47           HB3      ALA  47  -6.748  -0.475  13.294

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LEU  48           H        LEU  48  -4.513  -1.830  13.318
    2    HA   LEU  48           HA       LEU  48  -4.241  -3.417  10.974
    3    HB2  LEU  48           HB2      LEU  48  -2.177  -2.132  12.770
    4    HB3  LEU  48           HB3      LEU  48  -1.815  -2.850  11.200
    5    HG   LEU  48           HG       LEU  48  -3.844  -0.640  11.605
    6   HD13  LEU  48          HD11      LEU  48  -1.721   0.243  12.258
    7   HD12  LEU  48          HD12      LEU  48  -2.009   0.797  10.608
    8   HD11  LEU  48          HD13      LEU  48  -0.904  -0.546  10.908
    9   HD22  LEU  48          HD21      LEU  48  -4.325  -1.625   9.531
   10   HD21  LEU  48          HD22      LEU  48  -2.643  -2.053   9.224
   11   HD23  LEU  48          HD23      LEU  48  -3.169  -0.376   9.070

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ASN  49           H        ASN  49  -3.172  -3.814  14.313
    2    HA   ASN  49           HA       ASN  49  -1.564  -6.071  13.969
    3    HB2  ASN  49           HB2      ASN  49  -1.587  -4.734  16.018
    4    HB3  ASN  49           HB3      ASN  49  -3.238  -5.235  16.355
    5   HD21  ASN  49          HD21      ASN  49  -2.592  -6.247  18.373
    6   HD22  ASN  49          HD22      ASN  49  -1.720  -7.703  18.389

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLU  50           H        GLU  50  -5.029  -5.807  14.663
    2    HA   GLU  50           HA       GLU  50  -5.533  -8.608  14.772
    3    HB2  GLU  50           HB2      GLU  50  -7.118  -6.926  15.660
    4    HB3  GLU  50           HB3      GLU  50  -7.423  -6.361  14.016
    5    HG2  GLU  50           HG2      GLU  50  -8.286  -8.559  13.381
    6    HG3  GLU  50           HG3      GLU  50  -7.893  -9.203  14.971

  No H/Q in entry =           6
  In of MODEL   79
    1    H    ALA  51           H        ALA  51  -5.624  -6.207  12.179
    2    HA   ALA  51           HA       ALA  51  -6.618  -7.935  10.162
    3    HB2  ALA  51           HB1      ALA  51  -6.411  -6.120   8.793
    4    HB1  ALA  51           HB2      ALA  51  -4.769  -5.768   9.332
    5    HB3  ALA  51           HB3      ALA  51  -6.147  -5.261  10.310

  No H/Q in entry =           5
  In of MODEL   79
    1    H    HIS  52           H        HIS  52  -3.323  -7.022  11.126
    2    HA   HIS  52           HA       HIS  52  -1.933  -8.506   9.166
    3    HB2  HIS  52           HB2      HIS  52  -0.858  -6.787  10.557
    4    HB3  HIS  52           HB3      HIS  52  -1.081  -7.798  11.985
    5    HD1  HIS  52           HD1      HIS  52   0.151 -10.219  11.864
    6    HD2  HIS  52           HD2      HIS  52   1.455  -7.354   9.130
    7    HE1  HIS  52           HE1      HIS  52   2.398 -11.016  11.007
    8    HE2  HIS  52           HE2      HIS  52   3.204  -9.281   9.338

  No H/Q in entry =           8
  In of MODEL   79
    1    H    LEU  53           H        LEU  53  -3.123  -9.389  12.385
    2    HA   LEU  53           HA       LEU  53  -1.920 -11.932  12.568
    3    HB2  LEU  53           HB2      LEU  53  -4.402 -10.760  13.798
    4    HB3  LEU  53           HB3      LEU  53  -3.932 -12.432  14.088
    5    HG   LEU  53           HG       LEU  53  -2.036 -10.107  14.547
    6   HD12  LEU  53          HD11      LEU  53  -2.636 -10.617  17.018
    7   HD11  LEU  53          HD12      LEU  53  -4.091 -11.362  16.360
    8   HD13  LEU  53          HD13      LEU  53  -3.773  -9.655  16.080
    9   HD21  LEU  53          HD21      LEU  53  -2.064 -13.042  15.282
   10   HD23  LEU  53          HD22      LEU  53  -1.125 -11.887  16.222
   11   HD22  LEU  53          HD23      LEU  53  -0.767 -12.126  14.521

  No H/Q in entry =          11
  In of MODEL   79
    1    H    VAL  54           H        VAL  54  -5.041 -10.905  11.226
    2    HA   VAL  54           HA       VAL  54  -5.956 -13.500  10.542
    3    HB   VAL  54           HB       VAL  54  -6.613 -10.766   9.415
    4   HG12  VAL  54          HG11      VAL  54  -8.718 -12.146   8.614
    5   HG11  VAL  54          HG12      VAL  54  -7.605 -13.510   8.678
    6   HG13  VAL  54          HG13      VAL  54  -7.253 -12.134   7.635
    7   HG22  VAL  54          HG21      VAL  54  -7.507 -10.808  11.572
    8   HG21  VAL  54          HG22      VAL  54  -7.759 -12.551  11.552
    9   HG23  VAL  54          HG23      VAL  54  -8.847 -11.495  10.653

  No H/Q in entry =           9
  In of MODEL   79
    1    H    GLN  55           H        GLN  55  -4.098 -11.044   8.744
    2    HA   GLN  55           HA       GLN  55  -3.981 -12.505   6.324
    3    HB2  GLN  55           HB2      GLN  55  -3.381 -10.240   6.133
    4    HB3  GLN  55           HB3      GLN  55  -2.262 -10.317   7.491
    5    HG2  GLN  55           HG2      GLN  55  -0.552 -11.160   6.203
    6    HG3  GLN  55           HG3      GLN  55  -1.630 -12.135   5.215
    7   HE21  GLN  55          HE21      GLN  55  -1.661 -11.442   3.094
    8   HE22  GLN  55          HE22      GLN  55  -1.468  -9.837   2.585

  No H/Q in entry =           8
  In of MODEL   79
    1    H    THR  56           H        THR  56  -1.858 -12.486   9.192
    2    HA   THR  56           HA       THR  56   0.216 -14.082   8.260
    3    HB   THR  56           HB       THR  56  -1.014 -14.322  11.015
    4    HG1  THR  56           HG1      THR  56   0.795 -12.428   9.936
    5   HG21  THR  56          HG21      THR  56   0.992 -15.782   9.964
    6   HG23  THR  56          HG22      THR  56   0.956 -15.299  11.661
    7   HG22  THR  56          HG23      THR  56   1.913 -14.377  10.500

  No H/Q in entry =           7
  In of MODEL   79
    1    H    LYS  57           H        LYS  57  -2.895 -15.122   9.641
    2    HA   LYS  57           HA       LYS  57  -2.449 -17.917   9.389
    3    HB2  LYS  57           HB2      LYS  57  -4.259 -16.832  10.748
    4    HB3  LYS  57           HB3      LYS  57  -5.060 -16.376   9.251
    5    HG2  LYS  57           HG2      LYS  57  -5.449 -18.666   8.656
    6    HG3  LYS  57           HG3      LYS  57  -4.405 -19.246   9.952
    7    HD2  LYS  57           HD2      LYS  57  -6.999 -19.290  10.301
    8    HD3  LYS  57           HD3      LYS  57  -5.974 -18.733  11.622
    9    HE2  LYS  57           HE2      LYS  57  -6.423 -16.420  11.100
   10    HE3  LYS  57           HE3      LYS  57  -7.222 -16.845   9.589
   11    HZ3  LYS  57           HZ1      LYS  57  -9.074 -17.586  10.665
   12    HZ2  LYS  57           HZ2      LYS  57  -8.594 -16.349  11.726
   13    HZ1  LYS  57           HZ3      LYS  57  -8.245 -17.971  12.095

  No H/Q in entry =          13
  In of MODEL   79
    1    H    LEU  58           H        LEU  58  -3.795 -15.473   7.224
    2    HA   LEU  58           HA       LEU  58  -4.609 -17.296   5.221
    3    HB2  LEU  58           HB2      LEU  58  -4.004 -14.347   5.085
    4    HB3  LEU  58           HB3      LEU  58  -4.675 -15.283   3.748
    5    HG   LEU  58           HG       LEU  58  -5.938 -15.107   6.503
    6   HD11  LEU  58          HD11      LEU  58  -6.254 -13.457   4.016
    7   HD13  LEU  58          HD12      LEU  58  -6.234 -12.951   5.705
    8   HD12  LEU  58          HD13      LEU  58  -7.661 -13.744   5.041
    9   HD22  LEU  58          HD21      LEU  58  -6.906 -17.015   5.638
   10   HD21  LEU  58          HD22      LEU  58  -6.577 -16.562   3.966
   11   HD23  LEU  58          HD23      LEU  58  -7.935 -15.837   4.825

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  59           H        ILE  59  -1.468 -16.085   6.064
    2    HA   ILE  59           HA       ILE  59  -0.386 -16.810   3.420
    3    HB   ILE  59           HB       ILE  59   0.391 -14.744   4.981
    4   HG12  ILE  59          HG12      ILE  59   2.483 -16.398   3.553
    5   HG13  ILE  59          HG13      ILE  59   1.282 -15.469   2.693
    6   HG21  ILE  59          HG21      ILE  59   1.141 -16.516   6.743
    7   HG23  ILE  59          HG22      ILE  59   2.241 -15.207   6.372
    8   HG22  ILE  59          HG23      ILE  59   2.487 -16.804   5.667
    9   HD11  ILE  59          HD11      ILE  59   3.099 -14.276   4.781
   10   HD13  ILE  59          HD12      ILE  59   2.043 -13.403   3.674
   11   HD12  ILE  59          HD13      ILE  59   3.461 -14.251   3.056

  No H/Q in entry =          11
  In of MODEL   79
    1    H    GLU  60           H        GLU  60  -0.377 -17.919   6.787
    2    HA   GLU  60           HA       GLU  60   1.653 -19.896   6.508
    3    HB2  GLU  60           HB2      GLU  60   0.943 -19.148   8.708
    4    HB3  GLU  60           HB3      GLU  60  -0.697 -19.723   8.412
    5    HG2  GLU  60           HG2      GLU  60   1.628 -21.629   8.222
    6    HG3  GLU  60           HG3      GLU  60   0.936 -21.228   9.792

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLY  61           H        GLY  61  -1.860 -19.995   6.042
    2    HA3  GLY  61           HA2      GLY  61  -1.617 -22.786   5.080
    3    HA2  GLY  61           HA3      GLY  61  -3.099 -22.051   5.683

  No H/Q in entry =           3
  In of MODEL   79
    1    H    ASP  62           H        ASP  62  -0.882 -20.472   3.467
    2    HA   ASP  62           HA       ASP  62  -2.532 -19.360   1.710
    3    HB2  ASP  62           HB2      ASP  62  -0.820 -19.686  -0.036
    4    HB3  ASP  62           HB3      ASP  62  -0.098 -19.258   1.511

  No H/Q in entry =           4
  In of MODEL   79
    1    H    ALA  63           H        ALA  63  -3.542 -19.863  -0.338
    2    HA   ALA  63           HA       ALA  63  -5.049 -22.267  -0.357
    3    HB2  ALA  63           HB1      ALA  63  -6.009 -20.460  -1.498
    4    HB1  ALA  63           HB2      ALA  63  -5.516 -21.572  -2.775
    5    HB3  ALA  63           HB3      ALA  63  -4.540 -20.145  -2.424

  No H/Q in entry =           5
  In of MODEL   79
    1    H    GLY  64           H        GLY  64  -4.804 -24.150  -1.527
    2    HA3  GLY  64           HA2      GLY  64  -3.775 -25.812  -2.745
    3    HA2  GLY  64           HA3      GLY  64  -2.733 -24.589  -3.453

  No H/Q in entry =           3
  In of MODEL   79
    1    H    GLU  65           H        GLU  65  -3.208 -26.418  -0.414
    2    HA   GLU  65           HA       GLU  65  -0.709 -25.848   0.695
    3    HB2  GLU  65           HB2      GLU  65  -2.504 -28.246   1.043
    4    HB3  GLU  65           HB3      GLU  65  -1.058 -27.958   2.013
    5    HG2  GLU  65           HG2      GLU  65  -1.954 -25.820   2.780
    6    HG3  GLU  65           HG3      GLU  65  -3.367 -26.013   1.746

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLY  66           H        GLY  66  -1.692 -28.520  -1.344
    2    HA3  GLY  66           HA2      GLY  66   0.736 -29.952  -1.395
    3    HA2  GLY  66           HA3      GLY  66  -0.574 -30.093  -2.549

  No H/Q in entry =           3
  In of MODEL   79
    1    H    LYS  67           H        LYS  67  -0.585 -27.546  -3.617
    2    HA   LYS  67           HA       LYS  67   1.769 -27.682  -5.315
    3    HB2  LYS  67           HB2      LYS  67  -0.839 -26.188  -5.542
    4    HB3  LYS  67           HB3      LYS  67   0.462 -26.086  -6.736
    5    HG2  LYS  67           HG2      LYS  67   0.402 -28.532  -7.029
    6    HG3  LYS  67           HG3      LYS  67  -0.886 -28.650  -5.831
    7    HD2  LYS  67           HD2      LYS  67  -2.349 -27.275  -7.265
    8    HD3  LYS  67           HD3      LYS  67  -1.060 -27.156  -8.465
    9    HE2  LYS  67           HE2      LYS  67  -1.061 -29.604  -8.727
   10    HE3  LYS  67           HE3      LYS  67  -2.329 -29.741  -7.510
   11    HZ3  LYS  67           HZ1      LYS  67  -3.876 -29.212  -8.991
   12    HZ2  LYS  67           HZ2      LYS  67  -2.698 -29.432 -10.194
   13    HZ1  LYS  67           HZ3      LYS  67  -3.001 -27.881  -9.570

  No H/Q in entry =          13
  In of MODEL   79
    1    H    MET  68           H        MET  68   3.024 -25.962  -5.945
    2    HA   MET  68           HA       MET  68   4.012 -24.328  -3.872
    3    HB2  MET  68           HB2      MET  68   4.477 -24.244  -6.854
    4    HB3  MET  68           HB3      MET  68   5.427 -23.352  -5.665
    5    HG2  MET  68           HG2      MET  68   5.077 -26.364  -5.688
    6    HG3  MET  68           HG3      MET  68   6.497 -25.511  -6.298
    7    HE2  MET  68           HE1      MET  68   7.067 -23.124  -4.076
    8    HE1  MET  68           HE2      MET  68   7.942 -24.156  -5.206
    9    HE3  MET  68           HE3      MET  68   8.374 -24.167  -3.497

  No H/Q in entry =           9
  In of MODEL   79
    1    H    LYS  69           H        LYS  69   1.271 -23.811  -5.750
    2    HA   LYS  69           HA       LYS  69   1.546 -20.931  -5.905
    3    HB2  LYS  69           HB2      LYS  69  -0.653 -22.770  -6.799
    4    HB3  LYS  69           HB3      LYS  69  -0.721 -21.011  -6.954
    5    HG2  LYS  69           HG2      LYS  69   1.372 -21.025  -8.240
    6    HG3  LYS  69           HG3      LYS  69   1.472 -22.778  -8.076
    7    HD2  LYS  69           HD2      LYS  69  -0.693 -22.994  -9.273
    8    HD3  LYS  69           HD3      LYS  69  -0.728 -21.242  -9.487
    9    HE2  LYS  69           HE2      LYS  69   1.520 -23.023 -10.469
   10    HE3  LYS  69           HE3      LYS  69   0.184 -22.472 -11.478
   11    HZ1  LYS  69           HZ1      LYS  69   1.307 -20.289 -10.085
   12    HZ3  LYS  69           HZ2      LYS  69   1.182 -20.536 -11.762
   13    HZ2  LYS  69           HZ3      LYS  69   2.532 -21.121 -10.913

  No H/Q in entry =          13
  In of MODEL   79
    1    H    VAL  70           H        VAL  70  -0.018 -19.396  -5.134
    2    HA   VAL  70           HA       VAL  70  -1.450 -20.228  -2.675
    3    HB   VAL  70           HB       VAL  70  -0.780 -18.070  -1.660
    4   HG11  VAL  70          HG11      VAL  70   0.647 -20.309  -1.676
    5   HG13  VAL  70          HG12      VAL  70   1.286 -18.837  -0.943
    6   HG12  VAL  70          HG13      VAL  70   1.792 -19.305  -2.565
    7   HG22  VAL  70          HG21      VAL  70  -0.456 -16.698  -3.644
    8   HG21  VAL  70          HG22      VAL  70   0.812 -17.772  -4.231
    9   HG23  VAL  70          HG23      VAL  70   1.093 -16.783  -2.801

  No H/Q in entry =           9
  In of MODEL   79
    1    H    SER  71           H        SER  71  -3.073 -18.564  -2.016
    2    HA   SER  71           HA       SER  71  -4.933 -18.033  -4.071
    3    HB2  SER  71           HB2      SER  71  -5.501 -18.219  -1.626
    4    HB3  SER  71           HB3      SER  71  -4.724 -16.661  -1.367
    5    HG   SER  71           HG       SER  71  -6.240 -16.013  -3.189

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LEU  72           H        LEU  72  -5.210 -16.346  -5.397
    2    HA   LEU  72           HA       LEU  72  -3.107 -14.531  -5.890
    3    HB2  LEU  72           HB2      LEU  72  -5.978 -14.592  -6.817
    4    HB3  LEU  72           HB3      LEU  72  -4.791 -13.426  -7.397
    5    HG   LEU  72           HG       LEU  72  -4.368 -16.429  -7.541
    6   HD12  LEU  72          HD11      LEU  72  -4.947 -16.175  -9.953
    7   HD11  LEU  72          HD12      LEU  72  -5.428 -14.507  -9.636
    8   HD13  LEU  72          HD13      LEU  72  -6.317 -15.837  -8.894
    9   HD22  LEU  72          HD21      LEU  72  -2.260 -15.434  -7.809
   10   HD21  LEU  72          HD22      LEU  72  -2.908 -14.002  -8.589
   11   HD23  LEU  72          HD23      LEU  72  -2.825 -15.523  -9.473

  No H/Q in entry =          11
  In of MODEL   79
    1    H    VAL  73           H        VAL  73  -6.190 -14.181  -4.239
    2    HA   VAL  73           HA       VAL  73  -6.236 -11.410  -3.883
    3    HB   VAL  73           HB       VAL  73  -7.961 -11.766  -2.330
    4   HG13  VAL  73          HG11      VAL  73  -9.394 -13.213  -3.504
    5   HG12  VAL  73          HG12      VAL  73  -8.089 -14.326  -3.910
    6   HG11  VAL  73          HG13      VAL  73  -8.199 -12.763  -4.721
    7   HG22  VAL  73          HG21      VAL  73  -6.900 -13.141  -0.689
    8   HG21  VAL  73          HG22      VAL  73  -6.619 -14.435  -1.854
    9   HG23  VAL  73          HG23      VAL  73  -8.256 -14.091  -1.296

  No H/Q in entry =           9
  In of MODEL   79
    1    H    LEU  74           H        LEU  74  -4.284 -13.778  -2.317
    2    HA   LEU  74           HA       LEU  74  -3.856 -12.641   0.205
    3    HB2  LEU  74           HB2      LEU  74  -3.075 -14.859  -0.310
    4    HB3  LEU  74           HB3      LEU  74  -2.024 -14.239  -1.582
    5    HG   LEU  74           HG       LEU  74  -0.714 -12.996   0.104
    6   HD11  LEU  74          HD11      LEU  74  -2.796 -14.181   1.944
    7   HD13  LEU  74          HD12      LEU  74  -2.261 -12.503   1.834
    8   HD12  LEU  74          HD13      LEU  74  -1.202 -13.722   2.543
    9   HD21  LEU  74          HD21      LEU  74  -0.547 -15.578  -0.502
   10   HD23  LEU  74          HD22      LEU  74  -0.924 -15.724   1.200
   11   HD22  LEU  74          HD23      LEU  74   0.502 -14.842   0.708

  No H/Q in entry =          11
  In of MODEL   79
    1    H    VAL  75           H        VAL  75  -1.987 -12.240  -2.765
    2    HA   VAL  75           HA       VAL  75  -0.185 -10.315  -1.763
    3    HB   VAL  75           HB       VAL  75  -1.160 -10.794  -4.581
    4   HG11  VAL  75          HG11      VAL  75   1.120  -9.071  -3.513
    5   HG13  VAL  75          HG12      VAL  75  -0.300  -8.507  -4.382
    6   HG12  VAL  75          HG13      VAL  75   0.897  -9.493  -5.208
    7   HG21  VAL  75          HG21      VAL  75   1.250 -11.666  -2.958
    8   HG23  VAL  75          HG22      VAL  75   1.177 -11.809  -4.714
    9   HG22  VAL  75          HG23      VAL  75   0.033 -12.700  -3.708

  No H/Q in entry =           9
  In of MODEL   79
    1    H    GLU  76           H        GLU  76  -3.348  -9.969  -3.398
    2    HA   GLU  76           HA       GLU  76  -3.404  -7.155  -3.494
    3    HB2  GLU  76           HB2      GLU  76  -5.065  -8.648  -4.628
    4    HB3  GLU  76           HB3      GLU  76  -5.736  -9.056  -3.057
    5    HG2  GLU  76           HG2      GLU  76  -6.385  -6.719  -2.688
    6    HG3  GLU  76           HG3      GLU  76  -5.674  -6.243  -4.218

  No H/Q in entry =           6
  In of MODEL   79
    1    H    ALA  77           H        ALA  77  -4.493  -9.389  -0.950
    2    HA   ALA  77           HA       ALA  77  -5.440  -7.391   0.819
    3    HB1  ALA  77           HB1      ALA  77  -4.307 -10.111   1.519
    4    HB2  ALA  77           HB2      ALA  77  -5.975  -9.806   1.038
    5    HB3  ALA  77           HB3      ALA  77  -5.350  -9.119   2.536

  No H/Q in entry =           5
  In of MODEL   79
    1    H    GLN  78           H        GLN  78  -2.293  -8.936   0.429
    2    HA   GLN  78           HA       GLN  78  -1.021  -7.779   2.672
    3    HB2  GLN  78           HB2      GLN  78  -0.167  -9.716   1.305
    4    HB3  GLN  78           HB3      GLN  78   0.260  -8.567   0.041
    5    HG2  GLN  78           HG2      GLN  78   1.727  -7.374   1.619
    6    HG3  GLN  78           HG3      GLN  78   1.306  -8.525   2.885
    7   HE21  GLN  78          HE21      GLN  78   3.244  -9.711   3.139
    8   HE22  GLN  78          HE22      GLN  78   4.037 -10.507   1.866

  No H/Q in entry =           8
  In of MODEL   79
    1    H    LEU  79           H        LEU  79  -1.412  -6.712  -0.670
    2    HA   LEU  79           HA       LEU  79   0.273  -4.484  -0.665
    3    HB2  LEU  79           HB2      LEU  79  -0.768  -5.288  -2.713
    4    HB3  LEU  79           HB3      LEU  79  -2.368  -4.898  -2.092
    5    HG   LEU  79           HG       LEU  79  -1.825  -2.511  -2.066
    6   HD13  LEU  79          HD11      LEU  79   0.419  -2.267  -1.569
    7   HD12  LEU  79          HD12      LEU  79   0.456  -1.976  -3.308
    8   HD11  LEU  79          HD13      LEU  79   0.915  -3.555  -2.668
    9   HD23  LEU  79          HD21      LEU  79  -1.209  -2.307  -4.622
   10   HD22  LEU  79          HD22      LEU  79  -2.732  -3.056  -4.153
   11   HD21  LEU  79          HD23      LEU  79  -1.362  -4.064  -4.610

  No H/Q in entry =          11
  In of MODEL   79
    1    H    HIS  80           H        HIS  80  -3.188  -4.649   0.186
    2    HA   HIS  80           HA       HIS  80  -3.375  -1.894   0.856
    3    HB2  HIS  80           HB2      HIS  80  -5.074  -4.304   1.183
    4    HB3  HIS  80           HB3      HIS  80  -5.386  -2.966   2.291
    5    HD1  HIS  80           HD1      HIS  80  -7.011  -1.327   1.399
    6    HD2  HIS  80           HD2      HIS  80  -4.840  -3.134  -1.668
    7    HE1  HIS  80           HE1      HIS  80  -7.866  -0.326  -0.773
    8    HE2  HIS  80           HE2      HIS  80  -6.549  -1.422  -2.651

  No H/Q in entry =           8
  In of MODEL   79
    1    H    LEU  81           H        LEU  81  -2.872  -4.792   2.840
    2    HA   LEU  81           HA       LEU  81  -2.841  -3.450   5.327
    3    HB2  LEU  81           HB2      LEU  81  -1.629  -6.065   4.434
    4    HB3  LEU  81           HB3      LEU  81  -1.591  -5.509   6.108
    5    HG   LEU  81           HG       LEU  81  -4.149  -5.758   4.498
    6   HD12  LEU  81          HD11      LEU  81  -4.441  -7.826   6.044
    7   HD11  LEU  81          HD12      LEU  81  -2.687  -7.756   6.218
    8   HD13  LEU  81          HD13      LEU  81  -3.408  -7.984   4.623
    9   HD23  LEU  81          HD21      LEU  81  -4.974  -5.965   7.005
   10   HD22  LEU  81          HD22      LEU  81  -4.654  -4.375   6.316
   11   HD21  LEU  81          HD23      LEU  81  -3.459  -5.138   7.366

  No H/Q in entry =          11
  In of MODEL   79
    1    H    MET  82           H        MET  82  -0.176  -4.350   3.135
    2    HA   MET  82           HA       MET  82   1.919  -3.460   4.805
    3    HB2  MET  82           HB2      MET  82   1.682  -3.796   1.814
    4    HB3  MET  82           HB3      MET  82   3.170  -3.228   2.568
    5    HG2  MET  82           HG2      MET  82   1.767  -5.818   3.298
    6    HG3  MET  82           HG3      MET  82   3.131  -5.707   2.188
    7    HE3  MET  82           HE1      MET  82   6.161  -4.976   4.151
    8    HE2  MET  82           HE2      MET  82   5.235  -3.607   3.542
    9    HE1  MET  82           HE3      MET  82   5.315  -5.096   2.603

  No H/Q in entry =           9
  In of MODEL   79
    1    H    THR  83           H        THR  83   0.080  -1.812   2.265
    2    HA   THR  83           HA       THR  83   1.495   0.635   2.345
    3    HB   THR  83           HB       THR  83  -0.688   1.563   1.377
    4    HG1  THR  83           HG1      THR  83  -2.340   0.268   1.280
    5   HG22  THR  83          HG21      THR  83  -0.434  -0.251  -0.629
    6   HG21  THR  83          HG22      THR  83   1.073  -0.547   0.236
    7   HG23  THR  83          HG23      THR  83   0.708   1.068  -0.373

  No H/Q in entry =           7
  In of MODEL   79
    1    H    SER  84           H        SER  84  -1.501  -0.398   3.967
    2    HA   SER  84           HA       SER  84  -1.985   2.030   5.319
    3    HB2  SER  84           HB2      SER  84  -2.816  -0.807   5.885
    4    HB3  SER  84           HB3      SER  84  -3.300   0.532   6.924
    5    HG   SER  84           HG       SER  84  -3.780   0.223   4.134

  No H/Q in entry =           5
  In of MODEL   79
    1    H    MET  85           H        MET  85  -0.269  -0.905   6.431
    2    HA   MET  85           HA       MET  85   0.270   0.016   9.033
    3    HB2  MET  85           HB2      MET  85   0.555  -2.327   8.345
    4    HB3  MET  85           HB3      MET  85   1.934  -1.862   7.347
    5    HG2  MET  85           HG2      MET  85   3.122  -1.043   9.339
    6    HG3  MET  85           HG3      MET  85   1.734  -1.451  10.347
    7    HE1  MET  85           HE1      MET  85   4.344  -2.470   7.967
    8    HE3  MET  85           HE2      MET  85   3.358  -3.769   7.298
    9    HE2  MET  85           HE3      MET  85   4.753  -4.157   8.301

  No H/Q in entry =           9
  In of MODEL   79
    1    H    LEU  86           H        LEU  86   2.184   0.274   6.068
    2    HA   LEU  86           HA       LEU  86   4.408   1.580   7.209
    3    HB2  LEU  86           HB2      LEU  86   4.198   0.502   4.900
    4    HB3  LEU  86           HB3      LEU  86   3.388   1.985   4.396
    5    HG   LEU  86           HG       LEU  86   5.425   3.227   5.363
    6   HD11  LEU  86          HD11      LEU  86   6.133   0.613   6.154
    7   HD13  LEU  86          HD12      LEU  86   7.139   2.056   6.246
    8   HD12  LEU  86          HD13      LEU  86   7.236   1.010   4.832
    9   HD23  LEU  86          HD21      LEU  86   6.122   1.467   3.005
   10   HD22  LEU  86          HD22      LEU  86   6.520   3.163   3.266
   11   HD21  LEU  86          HD23      LEU  86   4.864   2.698   2.879

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ALA  87           H        ALA  87   1.486   2.830   5.648
    2    HA   ALA  87           HA       ALA  87   2.085   5.559   5.732
    3    HB1  ALA  87           HB1      ALA  87  -0.231   3.936   5.205
    4    HB3  ALA  87           HB2      ALA  87   0.079   5.597   4.705
    5    HB2  ALA  87           HB3      ALA  87  -0.704   5.274   6.254

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ARG  88           H        ARG  88   0.410   3.556   8.131
    2    HA   ARG  88           HA       ARG  88  -0.085   5.604   9.985
    3    HB2  ARG  88           HB2      ARG  88  -1.027   3.253  10.055
    4    HB3  ARG  88           HB3      ARG  88   0.519   2.749  10.749
    5    HG2  ARG  88           HG2      ARG  88   0.057   4.822  12.375
    6    HG3  ARG  88           HG3      ARG  88  -1.613   4.500  11.931
    7    HD2  ARG  88           HD2      ARG  88  -1.714   2.649  13.175
    8    HD3  ARG  88           HD3      ARG  88  -0.129   2.066  12.632
    9    HE   ARG  88           HE       ARG  88  -0.643   3.326  15.092
   10   HH21  ARG  88          HH11      ARG  88   0.926   4.335  16.320
   11   HH22  ARG  88          HH12      ARG  88   2.440   4.760  15.605
   12   HH11  ARG  88          HH21      ARG  88   1.618   3.508  12.498
   13   HH12  ARG  88          HH22      ARG  88   2.841   4.276  13.452

  No H/Q in entry =          13
  In of MODEL   79
    1    H    GLU  89           H        GLU  89   2.706   3.382   9.738
    2    HA   GLU  89           HA       GLU  89   3.986   4.266  12.073
    3    HB2  GLU  89           HB2      GLU  89   4.633   2.248  10.722
    4    HB3  GLU  89           HB3      GLU  89   5.401   3.343   9.571
    5    HG2  GLU  89           HG2      GLU  89   6.900   4.186  11.305
    6    HG3  GLU  89           HG3      GLU  89   6.073   3.229  12.530

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LEU  90           H        LEU  90   4.280   5.428   8.745
    2    HA   LEU  90           HA       LEU  90   6.217   7.425   9.319
    3    HB2  LEU  90           HB2      LEU  90   4.194   7.099   7.106
    4    HB3  LEU  90           HB3      LEU  90   5.426   8.368   7.120
    5    HG   LEU  90           HG       LEU  90   6.099   5.431   7.445
    6   HD12  LEU  90          HD11      LEU  90   6.830   5.667   5.000
    7   HD11  LEU  90          HD12      LEU  90   5.815   7.108   4.961
    8   HD13  LEU  90          HD13      LEU  90   5.097   5.536   5.307
    9   HD22  LEU  90          HD21      LEU  90   8.002   6.578   8.114
   10   HD21  LEU  90          HD22      LEU  90   7.646   7.985   7.112
   11   HD23  LEU  90          HD23      LEU  90   8.299   6.520   6.378

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  91           H        ILE  91   2.677   7.443   9.196
    2    HA   ILE  91           HA       ILE  91   2.339  10.216   9.653
    3    HB   ILE  91           HB       ILE  91   0.551   7.840  10.206
    4   HG12  ILE  91          HG12      ILE  91   0.289  10.124   8.226
    5   HG13  ILE  91          HG13      ILE  91   1.146   8.630   7.845
    6   HG22  ILE  91          HG21      ILE  91  -1.180   9.899  10.285
    7   HG21  ILE  91          HG22      ILE  91   0.227  10.728  10.948
    8   HG23  ILE  91          HG23      ILE  91  -0.405   9.290  11.747
    9   HD13  ILE  91          HD11      ILE  91  -0.798   7.343   7.902
   10   HD12  ILE  91          HD12      ILE  91  -1.392   8.859   7.227
   11   HD11  ILE  91          HD13      ILE  91  -1.651   8.493   8.933

  No H/Q in entry =          11
  In of MODEL   79
    1    H    THR  92           H        THR  92   2.758   7.471  11.848
    2    HA   THR  92           HA       THR  92   2.332   8.842  14.276
    3    HB   THR  92           HB       THR  92   4.136   6.508  13.596
    4    HG1  THR  92           HG1      THR  92   2.166   5.751  13.508
    5   HG22  THR  92          HG21      THR  92   3.771   6.220  16.232
    6   HG21  THR  92          HG22      THR  92   3.706   7.980  16.161
    7   HG23  THR  92          HG23      THR  92   5.135   7.125  15.577

  No H/Q in entry =           7
  In of MODEL   79
    1    H    GLU  93           H        GLU  93   5.269   8.396  12.321
    2    HA   GLU  93           HA       GLU  93   7.035   9.821  14.007
    3    HB2  GLU  93           HB2      GLU  93   7.102   9.510  10.991
    4    HB3  GLU  93           HB3      GLU  93   8.449  10.039  11.996
    5    HG2  GLU  93           HG2      GLU  93   7.044   7.402  12.451
    6    HG3  GLU  93           HG3      GLU  93   8.420   7.556  11.365

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LEU  94           H        LEU  94   4.966  10.838  11.310
    2    HA   LEU  94           HA       LEU  94   5.769  13.543  11.207
    3    HB2  LEU  94           HB2      LEU  94   3.174  12.177  10.470
    4    HB3  LEU  94           HB3      LEU  94   3.430  13.905  10.229
    5    HG   LEU  94           HG       LEU  94   5.441  11.919   9.162
    6   HD11  LEU  94          HD11      LEU  94   2.691  12.469   8.120
    7   HD13  LEU  94          HD12      LEU  94   3.675  11.013   7.986
    8   HD12  LEU  94          HD13      LEU  94   4.001  12.395   6.940
    9   HD23  LEU  94          HD21      LEU  94   5.677  13.757   7.440
   10   HD22  LEU  94          HD22      LEU  94   6.103  14.249   9.079
   11   HD21  LEU  94          HD23      LEU  94   4.547  14.716   8.392

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  95           H        ILE  95   3.246  11.921  13.114
    2    HA   ILE  95           HA       ILE  95   2.209  14.269  14.319
    3    HB   ILE  95           HB       ILE  95   2.236  11.386  15.241
    4   HG12  ILE  95          HG12      ILE  95   0.006  13.158  14.209
    5   HG13  ILE  95          HG13      ILE  95   0.956  12.101  13.169
    6   HG21  ILE  95          HG21      ILE  95   0.959  13.856  16.454
    7   HG23  ILE  95          HG22      ILE  95   2.014  12.688  17.250
    8   HG22  ILE  95          HG23      ILE  95   0.376  12.225  16.786
    9   HD13  ILE  95          HD11      ILE  95   0.062  10.161  14.092
   10   HD12  ILE  95          HD12      ILE  95  -1.321  11.248  14.179
   11   HD11  ILE  95          HD13      ILE  95  -0.345  10.950  15.617

  No H/Q in entry =          11
  In of MODEL   79
    1    H    GLU  96           H        GLU  96   4.814  12.053  15.294
    2    HA   GLU  96           HA       GLU  96   5.384  13.250  17.783
    3    HB2  GLU  96           HB2      GLU  96   6.331  11.093  17.127
    4    HB3  GLU  96           HB3      GLU  96   7.255  11.869  15.842
    5    HG2  GLU  96           HG2      GLU  96   8.912  12.419  17.293
    6    HG3  GLU  96           HG3      GLU  96   7.771  13.229  18.357

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LEU  97           H        LEU  97   6.435  14.027  14.491
    2    HA   LEU  97           HA       LEU  97   8.322  16.026  15.192
    3    HB2  LEU  97           HB2      LEU  97   6.715  15.476  12.707
    4    HB3  LEU  97           HB3      LEU  97   7.732  16.909  12.823
    5    HG   LEU  97           HG       LEU  97   8.770  14.113  13.373
    6   HD12  LEU  97          HD11      LEU  97   9.751  14.312  11.050
    7   HD11  LEU  97          HD12      LEU  97   8.695  15.700  10.795
    8   HD13  LEU  97          HD13      LEU  97   8.001  14.107  11.093
    9   HD23  LEU  97          HD21      LEU  97  10.932  15.397  12.617
   10   HD22  LEU  97          HD22      LEU  97  10.323  15.664  14.251
   11   HD21  LEU  97          HD23      LEU  97   9.998  16.848  12.986

  No H/Q in entry =          11
  In of MODEL   79
    1    H    HIS  98           H        HIS  98   4.826  16.154  14.561
    2    HA   HIS  98           HA       HIS  98   4.521  18.953  14.701
    3    HB2  HIS  98           HB2      HIS  98   2.642  16.698  15.438
    4    HB3  HIS  98           HB3      HIS  98   2.171  18.397  15.499
    5    HD1  HIS  98           HD1      HIS  98   3.182  15.687  13.084
    6    HD2  HIS  98           HD2      HIS  98   1.796  19.617  12.975
    7    HE1  HIS  98           HE1      HIS  98   2.605  16.176  10.665
    8    HE2  HIS  98           HE2      HIS  98   1.765  18.564  10.577

  No H/Q in entry =           8
  In of MODEL   79
    1    H    GLU  99           H        GLU  99   4.677  16.463  17.197
    2    HA   GLU  99           HA       GLU  99   4.080  18.154  19.401
    3    HB2  GLU  99           HB2      GLU  99   3.998  15.671  19.496
    4    HB3  GLU  99           HB3      GLU  99   5.757  15.631  19.376
    5    HG2  GLU  99           HG2      GLU  99   5.957  16.921  21.450
    6    HG3  GLU  99           HG3      GLU  99   4.205  17.058  21.557

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LYS 100           H        LYS 100   7.126  17.232  17.814
    2    HA   LYS 100           HA       LYS 100   8.790  18.634  19.661
    3    HB2  LYS 100           HB2      LYS 100   9.271  17.714  16.818
    4    HB3  LYS 100           HB3      LYS 100  10.506  18.485  17.818
    5    HG2  LYS 100           HG2      LYS 100  10.146  16.732  19.560
    6    HG3  LYS 100           HG3      LYS 100   9.009  15.927  18.476
    7    HD2  LYS 100           HD2      LYS 100  10.792  15.650  16.796
    8    HD3  LYS 100           HD3      LYS 100  11.934  16.467  17.866
    9    HE2  LYS 100           HE2      LYS 100  11.554  14.709  19.585
   10    HE3  LYS 100           HE3      LYS 100  10.473  13.872  18.466
   11    HZ1  LYS 100           HZ1      LYS 100  13.287  14.549  17.792
   12    HZ3  LYS 100           HZ2      LYS 100  12.240  13.492  16.970
   13    HZ2  LYS 100           HZ3      LYS 100  12.840  13.073  18.504

  No H/Q in entry =          13
  In of MODEL   79
    1    H    LEU 101           H        LEU 101   7.074  19.560  16.718
    2    HA   LEU 101           HA       LEU 101   8.280  22.120  16.377
    3    HB2  LEU 101           HB2      LEU 101   5.681  20.882  15.507
    4    HB3  LEU 101           HB3      LEU 101   5.927  22.614  15.300
    5    HG   LEU 101           HG       LEU 101   7.961  20.603  14.318
    6   HD12  LEU 101          HD11      LEU 101   6.791  21.108  12.041
    7   HD11  LEU 101          HD12      LEU 101   5.397  21.534  13.032
    8   HD13  LEU 101          HD13      LEU 101   6.066  19.905  13.107
    9   HD21  LEU 101          HD21      LEU 101   7.323  23.514  13.770
   10   HD23  LEU 101          HD22      LEU 101   8.298  22.558  12.655
   11   HD22  LEU 101          HD23      LEU 101   8.850  22.815  14.310

  No H/Q in entry =          11
  In of MODEL   79
    1    H    LYS 102           H        LYS 102   6.763  20.976  19.002
    2    HA   LYS 102           HA       LYS 102   6.142  22.064  20.940
    3    HB2  LYS 102           HB2      LYS 102   7.413  24.058  19.809
    4    HB3  LYS 102           HB3      LYS 102   5.810  24.660  19.445
    5    HG2  LYS 102           HG2      LYS 102   7.206  24.405  22.087
    6    HG3  LYS 102           HG3      LYS 102   6.246  25.732  21.466
    7    HD2  LYS 102           HD2      LYS 102   5.014  23.092  22.351
    8    HD3  LYS 102           HD3      LYS 102   5.267  24.452  23.434
    9    HE2  LYS 102           HE2      LYS 102   2.978  24.046  21.960
   10    HE3  LYS 102           HE3      LYS 102   3.483  25.592  22.641
   11    HZ2  LYS 102           HZ1      LYS 102   2.936  25.702  20.265
   12    HZ1  LYS 102           HZ2      LYS 102   4.197  24.623  19.932
   13    HZ3  LYS 102           HZ3      LYS 102   4.541  26.153  20.574

  No H/Q in entry =          13
  In of MODEL   79
    1    H    ALA 103           H        ALA 103   4.482  23.607  18.186
    2    HA   ALA 103           HA       ALA 103   2.033  24.178  19.088
    3    HB1  ALA 103           HB1      ALA 103   1.120  23.337  16.851
    4    HB2  ALA 103           HB2      ALA 103   2.766  22.804  16.509
    5    HB3  ALA 103           HB3      ALA 103   2.430  24.515  16.780

  No H/Q in entry =           5
  In of MODEL   79
    1    H1   ALA   1           H3       ALA   1  10.540 -20.276  -6.297
    2    H2   ALA   1           H2       ALA   1   9.566 -20.482  -7.676
    3    H3   ALA   1           H1       ALA   1   9.141 -21.231  -6.211
    4    HA   ALA   1           HA       ALA   1  10.177 -23.038  -6.960
    5    HB1  ALA   1           HB1      ALA   1  10.256 -22.676  -9.236
    6    HB2  ALA   1           HB2      ALA   1  11.986 -22.523  -8.919
    7    HB3  ALA   1           HB3      ALA   1  10.984 -21.077  -9.061

  No H/Q in entry =           7
  In of MODEL   79
    1    H    GLU   2           H        GLU   2  12.462 -23.985  -7.036
    2    HA   GLU   2           HA       GLU   2  13.859 -23.905  -4.834
    3    HB2  GLU   2           HB2      GLU   2  15.196 -23.768  -7.542
    4    HB3  GLU   2           HB3      GLU   2  15.935 -24.380  -6.063
    5    HG2  GLU   2           HG2      GLU   2  14.919 -26.398  -6.299
    6    HG3  GLU   2           HG3      GLU   2  13.345 -25.654  -6.546

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLU   3           H        GLU   3  15.611 -22.035  -7.245
    2    HA   GLU   3           HA       GLU   3  16.776 -20.349  -5.292
    3    HB2  GLU   3           HB2      GLU   3  16.699 -20.343  -8.302
    4    HB3  GLU   3           HB3      GLU   3  17.449 -19.015  -7.418
    5    HG2  GLU   3           HG2      GLU   3  19.120 -20.388  -6.509
    6    HG3  GLU   3           HG3      GLU   3  18.174 -21.856  -6.725

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LEU   4           H        LEU   4  14.474 -19.500  -7.905
    2    HA   LEU   4           HA       LEU   4  14.010 -16.893  -7.287
    3    HB2  LEU   4           HB2      LEU   4  11.831 -18.869  -8.004
    4    HB3  LEU   4           HB3      LEU   4  11.753 -17.120  -8.200
    5    HG   LEU   4           HG       LEU   4  13.709 -18.979  -9.589
    6   HD13  LEU   4          HD11      LEU   4  12.394 -18.829 -11.490
    7   HD12  LEU   4          HD12      LEU   4  11.688 -17.286 -11.015
    8   HD11  LEU   4          HD13      LEU   4  11.141 -18.778 -10.252
    9   HD23  LEU   4          HD21      LEU   4  14.034 -16.732 -10.941
   10   HD22  LEU   4          HD22      LEU   4  14.905 -16.975  -9.428
   11   HD21  LEU   4          HD23      LEU   4  13.451 -15.980  -9.455

  No H/Q in entry =          11
  In of MODEL   79
    1    H    GLU   5           H        GLU   5  12.539 -19.680  -5.638
    2    HA   GLU   5           HA       GLU   5  10.873 -18.113  -3.921
    3    HB2  GLU   5           HB2      GLU   5  10.445 -20.489  -4.440
    4    HB3  GLU   5           HB3      GLU   5  11.887 -20.927  -3.523
    5    HG2  GLU   5           HG2      GLU   5  10.938 -19.909  -1.504
    6    HG3  GLU   5           HG3      GLU   5   9.509 -19.418  -2.412

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLU   6           H        GLU   6  14.024 -19.690  -3.503
    2    HA   GLU   6           HA       GLU   6  14.396 -18.836  -0.806
    3    HB2  GLU   6           HB2      GLU   6  15.617 -20.748  -1.802
    4    HB3  GLU   6           HB3      GLU   6  16.466 -19.629  -2.871
    5    HG2  GLU   6           HG2      GLU   6  17.415 -18.465  -0.928
    6    HG3  GLU   6           HG3      GLU   6  16.541 -19.543   0.160

  No H/Q in entry =           6
  In of MODEL   79
    1    H    VAL   7           H        VAL   7  15.137 -17.505  -3.960
    2    HA   VAL   7           HA       VAL   7  16.826 -15.377  -3.105
    3    HB   VAL   7           HB       VAL   7  15.103 -15.740  -5.570
    4   HG11  VAL   7          HG11      VAL   7  16.999 -13.525  -4.769
    5   HG13  VAL   7          HG12      VAL   7  15.352 -13.384  -5.380
    6   HG12  VAL   7          HG13      VAL   7  16.654 -13.883  -6.460
    7   HG21  VAL   7          HG21      VAL   7  17.216 -17.194  -5.018
    8   HG23  VAL   7          HG22      VAL   7  18.116 -15.731  -5.421
    9   HG22  VAL   7          HG23      VAL   7  17.072 -16.481  -6.626

  No H/Q in entry =           9
  In of MODEL   79
    1    H    VAL   8           H        VAL   8  13.330 -15.651  -3.636
    2    HA   VAL   8           HA       VAL   8  12.664 -12.944  -3.156
    3    HB   VAL   8           HB       VAL   8  11.107 -15.514  -2.836
    4   HG12  VAL   8          HG11      VAL   8   9.126 -13.795  -2.746
    5   HG11  VAL   8          HG12      VAL   8  10.356 -12.680  -2.151
    6   HG13  VAL   8          HG13      VAL   8  10.012 -14.165  -1.267
    7   HG22  VAL   8          HG21      VAL   8  10.826 -15.211  -5.080
    8   HG21  VAL   8          HG22      VAL   8  11.687 -13.676  -5.010
    9   HG23  VAL   8          HG23      VAL   8   9.951 -13.722  -4.722

  No H/Q in entry =           9
  In of MODEL   79
    1    H    MET   9           H        MET   9  12.951 -15.753  -0.982
    2    HA   MET   9           HA       MET   9  12.151 -14.485   1.396
    3    HB2  MET   9           HB2      MET   9  14.007 -16.780   0.805
    4    HB3  MET   9           HB3      MET   9  13.828 -16.176   2.452
    5    HG2  MET   9           HG2      MET   9  11.288 -16.401   2.068
    6    HG3  MET   9           HG3      MET   9  11.715 -17.376   0.662
    7    HE2  MET   9           HE1      MET   9  14.181 -19.202   1.389
    8    HE1  MET   9           HE2      MET   9  12.655 -19.435   0.540
    9    HE3  MET   9           HE3      MET   9  13.121 -20.551   1.820

  No H/Q in entry =           9
  In of MODEL   79
    1    H    GLY  10           H        GLY  10  15.321 -14.701  -0.184
    2    HA3  GLY  10           HA2      GLY  10  16.791 -13.280   1.777
    3    HA2  GLY  10           HA3      GLY  10  17.242 -13.442   0.080

  No H/Q in entry =           3
  In of MODEL   79
    1    H    LEU  11           H        LEU  11  15.062 -12.224  -1.142
    2    HA   LEU  11           HA       LEU  11  15.742  -9.478  -0.980
    3    HB2  LEU  11           HB2      LEU  11  13.369 -10.892  -2.200
    4    HB3  LEU  11           HB3      LEU  11  13.644  -9.157  -2.359
    5    HG   LEU  11           HG       LEU  11  15.671 -11.259  -3.165
    6   HD13  LEU  11          HD11      LEU  11  13.915 -11.629  -4.672
    7   HD12  LEU  11          HD12      LEU  11  14.909 -10.444  -5.518
    8   HD11  LEU  11          HD13      LEU  11  13.440  -9.930  -4.689
    9   HD22  LEU  11          HD21      LEU  11  16.899  -9.293  -2.945
   10   HD21  LEU  11          HD22      LEU  11  15.518  -8.259  -3.313
   11   HD23  LEU  11          HD23      LEU  11  16.342  -9.124  -4.609

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  12           H        ILE  12  12.987 -11.313   0.305
    2    HA   ILE  12           HA       ILE  12  11.595  -9.094   1.377
    3    HB   ILE  12           HB       ILE  12  11.647 -11.978   2.321
    4   HG12  ILE  12          HG12      ILE  12  10.940 -11.352  -0.119
    5   HG13  ILE  12          HG13      ILE  12   9.911 -12.431   0.803
    6   HG21  ILE  12          HG21      ILE  12   9.717  -9.711   2.906
    7   HG23  ILE  12          HG22      ILE  12  10.709 -10.587   4.071
    8   HG22  ILE  12          HG23      ILE  12   9.376 -11.404   3.256
    9   HD13  ILE  12          HD11      ILE  12   8.402 -10.605   1.311
   10   HD12  ILE  12          HD12      ILE  12   8.681 -10.631  -0.430
   11   HD11  ILE  12          HD13      ILE  12   9.495  -9.449   0.571

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  13           H        ILE  13  14.005 -11.293   2.763
    2    HA   ILE  13           HA       ILE  13  14.055 -10.117   5.344
    3    HB   ILE  13           HB       ILE  13  16.109 -11.681   3.762
    4   HG12  ILE  13          HG12      ILE  13  13.871 -12.693   4.570
    5   HG13  ILE  13          HG13      ILE  13  15.352 -13.572   4.939
    6   HG22  ILE  13          HG21      ILE  13  17.051 -12.034   6.205
    7   HG21  ILE  13          HG22      ILE  13  16.289 -10.480   6.513
    8   HG23  ILE  13          HG23      ILE  13  17.534 -10.618   5.272
    9   HD11  ILE  13          HD11      ILE  13  14.536 -11.586   6.991
   10   HD13  ILE  13          HD12      ILE  13  15.151 -13.223   7.182
   11   HD12  ILE  13          HD13      ILE  13  13.455 -12.962   6.797

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ASN  14           H        ASN  14  15.986  -9.575   2.413
    2    HA   ASN  14           HA       ASN  14  17.730  -7.627   3.465
    3    HB2  ASN  14           HB2      ASN  14  17.696  -8.891   1.147
    4    HB3  ASN  14           HB3      ASN  14  16.793  -7.477   0.619
    5   HD21  ASN  14          HD21      ASN  14  19.227  -7.804  -0.585
    6   HD22  ASN  14          HD22      ASN  14  20.369  -6.717   0.036

  No H/Q in entry =           6
  In of MODEL   79
    1    H    SER  15           H        SER  15  14.605  -7.292   1.795
    2    HA   SER  15           HA       SER  15  14.480  -4.472   1.855
    3    HB2  SER  15           HB2      SER  15  12.147  -4.729   1.375
    4    HB3  SER  15           HB3      SER  15  12.944  -6.091   0.598
    5    HG   SER  15           HG       SER  15  12.243  -7.421   2.173

  No H/Q in entry =           5
  In of MODEL   79
    1    H    GLY  16           H        GLY  16  13.415  -6.940   4.163
    2    HA3  GLY  16           HA2      GLY  16  12.198  -5.200   6.031
    3    HA2  GLY  16           HA3      GLY  16  12.823  -6.806   6.387

  No H/Q in entry =           3
  In of MODEL   79
    1    H    GLN  17           H        GLN  17  15.529  -6.458   5.776
    2    HA   GLN  17           HA       GLN  17  16.495  -5.235   8.152
    3    HB2  GLN  17           HB2      GLN  17  17.892  -6.090   5.604
    4    HB3  GLN  17           HB3      GLN  17  18.755  -5.464   7.009
    5    HG2  GLN  17           HG2      GLN  17  17.839  -7.255   8.406
    6    HG3  GLN  17           HG3      GLN  17  16.902  -7.863   7.042
    7   HE21  GLN  17          HE21      GLN  17  19.735  -8.420   8.716
    8   HE22  GLN  17          HE22      GLN  17  20.634  -9.167   7.485

  No H/Q in entry =           8
  In of MODEL   79
    1    H    ALA  18           H        ALA  18  16.278  -4.154   4.795
    2    HA   ALA  18           HA       ALA  18  17.702  -1.754   5.015
    3    HB2  ALA  18           HB1      ALA  18  16.577  -2.972   2.953
    4    HB3  ALA  18           HB2      ALA  18  16.832  -1.228   2.938
    5    HB1  ALA  18           HB3      ALA  18  15.238  -1.882   3.318

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ARG  19           H        ARG  19  14.208  -2.362   5.435
    2    HA   ARG  19           HA       ARG  19  13.530   0.284   6.157
    3    HB2  ARG  19           HB2      ARG  19  11.855  -1.476   5.580
    4    HB3  ARG  19           HB3      ARG  19  12.212  -2.274   7.114
    5    HG2  ARG  19           HG2      ARG  19  11.499  -0.289   8.361
    6    HG3  ARG  19           HG3      ARG  19  11.234   0.588   6.855
    7    HD2  ARG  19           HD2      ARG  19   9.102  -0.221   7.688
    8    HD3  ARG  19           HD3      ARG  19   9.516  -1.096   6.208
    9    HE   ARG  19           HE       ARG  19  10.497  -2.636   8.305
   10   HH21  ARG  19          HH11      ARG  19   9.264  -4.284   9.250
   11   HH22  ARG  19          HH12      ARG  19   7.543  -4.266   9.091
   12   HH11  ARG  19          HH21      ARG  19   7.489  -1.359   7.232
   13   HH12  ARG  19          HH22      ARG  19   6.538  -2.610   7.944

  No H/Q in entry =          13
  In of MODEL   79
    1    H    SER  20           H        SER  20  14.417  -2.544   8.107
    2    HA   SER  20           HA       SER  20  14.145  -1.449  10.648
    3    HB2  SER  20           HB2      SER  20  14.623  -3.770  10.522
    4    HB3  SER  20           HB3      SER  20  16.066  -3.499   9.548
    5    HG   SER  20           HG       SER  20  17.082  -2.644  11.324

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LEU  21           H        LEU  21  16.973  -1.369   8.493
    2    HA   LEU  21           HA       LEU  21  18.651   0.124  10.222
    3    HB2  LEU  21           HB2      LEU  21  18.599  -0.296   7.238
    4    HB3  LEU  21           HB3      LEU  21  19.770   0.787   7.987
    5    HG   LEU  21           HG       LEU  21  19.394  -2.106   8.820
    6   HD11  LEU  21          HD11      LEU  21  21.301  -0.832   6.843
    7   HD13  LEU  21          HD12      LEU  21  20.180  -2.165   6.559
    8   HD12  LEU  21          HD13      LEU  21  21.598  -2.409   7.577
    9   HD22  LEU  21          HD21      LEU  21  20.522  -1.137  10.609
   10   HD21  LEU  21          HD22      LEU  21  21.253   0.122   9.621
   11   HD23  LEU  21          HD23      LEU  21  21.901  -1.510   9.579

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ALA  22           H        ALA  22  16.365   1.084   7.682
    2    HA   ALA  22           HA       ALA  22  16.888   3.845   7.696
    3    HB3  ALA  22           HB1      ALA  22  15.481   2.597   6.025
    4    HB2  ALA  22           HB2      ALA  22  14.770   4.105   6.599
    5    HB1  ALA  22           HB3      ALA  22  14.193   2.562   7.228

  No H/Q in entry =           5
  In of MODEL   79
    1    H    TYR  23           H        TYR  23  14.414   2.013   9.545
    2    HA   TYR  23           HA       TYR  23  13.448   4.243  11.004
    3    HB2  TYR  23           HB2      TYR  23  12.226   2.121  10.987
    4    HB3  TYR  23           HB3      TYR  23  13.566   1.319  11.805
    5    HD1  TYR  23           HD1      TYR  23  11.045   4.044  12.179
    6    HD2  TYR  23           HD2      TYR  23  13.776   1.385  14.161
    7    HE1  TYR  23           HE1      TYR  23  10.122   4.734  14.377
    8    HE2  TYR  23           HE2      TYR  23  12.852   2.073  16.357
    9    HH   TYR  23           HH       TYR  23  10.012   4.132  16.593

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ALA  24           H        ALA  24  16.110   1.981  11.620
    2    HA   ALA  24           HA       ALA  24  16.792   2.976  14.181
    3    HB1  ALA  24           HB1      ALA  24  18.156   1.190  14.005
    4    HB3  ALA  24           HB2      ALA  24  19.172   2.119  12.900
    5    HB2  ALA  24           HB3      ALA  24  17.878   1.104  12.266

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ALA  25           H        ALA  25  17.722   3.914  10.897
    2    HA   ALA  25           HA       ALA  25  19.662   5.858  11.532
    3    HB1  ALA  25           HB1      ALA  25  18.935   4.909   9.220
    4    HB3  ALA  25           HB2      ALA  25  19.429   6.599   9.312
    5    HB2  ALA  25           HB3      ALA  25  17.716   6.183   9.254

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LEU  26           H        LEU  26  16.144   6.070  11.194
    2    HA   LEU  26           HA       LEU  26  15.909   8.850  11.651
    3    HB2  LEU  26           HB2      LEU  26  14.048   7.607  10.733
    4    HB3  LEU  26           HB3      LEU  26  13.971   6.577  12.158
    5    HG   LEU  26           HG       LEU  26  13.365   8.530  13.544
    6   HD12  LEU  26          HD11      LEU  26  12.685  10.629  12.226
    7   HD11  LEU  26          HD12      LEU  26  13.661   9.982  10.910
    8   HD13  LEU  26          HD13      LEU  26  14.414  10.369  12.457
    9   HD21  LEU  26          HD21      LEU  26  11.674   8.212  11.045
   10   HD23  LEU  26          HD22      LEU  26  11.121   8.905  12.567
   11   HD22  LEU  26          HD23      LEU  26  11.580   7.206  12.491

  No H/Q in entry =          11
  In of MODEL   79
    1    H    LYS  27           H        LYS  27  15.828   6.067  13.841
    2    HA   LYS  27           HA       LYS  27  15.245   7.427  16.214
    3    HB2  LYS  27           HB2      LYS  27  15.282   4.952  15.946
    4    HB3  LYS  27           HB3      LYS  27  17.045   5.012  15.891
    5    HG2  LYS  27           HG2      LYS  27  17.105   5.995  18.142
    6    HG3  LYS  27           HG3      LYS  27  15.339   6.006  18.199
    7    HD2  LYS  27           HD2      LYS  27  15.322   3.539  17.959
    8    HD3  LYS  27           HD3      LYS  27  17.087   3.536  17.936
    9    HE2  LYS  27           HE2      LYS  27  17.132   4.522  20.193
   10    HE3  LYS  27           HE3      LYS  27  15.366   4.555  20.219
   11    HZ3  LYS  27           HZ1      LYS  27  16.169   2.605  21.362
   12    HZ2  LYS  27           HZ2      LYS  27  17.078   2.131  20.005
   13    HZ1  LYS  27           HZ3      LYS  27  15.380   2.130  19.936

  No H/Q in entry =          13
  In of MODEL   79
    1    H    GLN  28           H        GLN  28  18.353   6.859  14.601
    2    HA   GLN  28           HA       GLN  28  20.046   7.946  16.582
    3    HB2  GLN  28           HB2      GLN  28  20.315   7.908  13.565
    4    HB3  GLN  28           HB3      GLN  28  21.607   8.380  14.668
    5    HG2  GLN  28           HG2      GLN  28  20.197   5.696  14.702
    6    HG3  GLN  28           HG3      GLN  28  21.780   5.994  13.989
    7   HE21  GLN  28          HE21      GLN  28  20.503   4.663  16.681
    8   HE22  GLN  28          HE22      GLN  28  21.686   5.084  17.822

  No H/Q in entry =           8
  In of MODEL   79
    1    H    ALA  29           H        ALA  29  18.272   9.427  13.903
    2    HA   ALA  29           HA       ALA  29  19.264  12.050  14.154
    3    HB2  ALA  29           HB1      ALA  29  17.553  12.684  12.694
    4    HB1  ALA  29           HB2      ALA  29  16.417  11.506  13.351
    5    HB3  ALA  29           HB3      ALA  29  17.743  10.969  12.319

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LYS  30           H        LYS  30  16.502  10.440  15.691
    2    HA   LYS  30           HA       LYS  30  15.490  12.689  17.058
    3    HB2  LYS  30           HB2      LYS  30  15.391   9.746  17.758
    4    HB3  LYS  30           HB3      LYS  30  14.528  10.993  18.659
    5    HG2  LYS  30           HG2      LYS  30  13.387  11.679  16.549
    6    HG3  LYS  30           HG3      LYS  30  14.190  10.346  15.715
    7    HD2  LYS  30           HD2      LYS  30  13.133   8.734  17.248
    8    HD3  LYS  30           HD3      LYS  30  12.340  10.056  18.106
    9    HE2  LYS  30           HE2      LYS  30  11.156  10.688  16.022
   10    HE3  LYS  30           HE3      LYS  30  11.929   9.337  15.184
   11    HZ2  LYS  30           HZ1      LYS  30   9.628   8.921  16.079
   12    HZ1  LYS  30           HZ2      LYS  30  10.305   8.973  17.642
   13    HZ3  LYS  30           HZ3      LYS  30  10.809   7.791  16.526

  No H/Q in entry =          13
  In of MODEL   79
    1    H    GLN  31           H        GLN  31  18.161  10.525  17.774
    2    HA   GLN  31           HA       GLN  31  18.504  11.536  20.467
    3    HB2  GLN  31           HB2      GLN  31  20.520   9.973  18.847
    4    HB3  GLN  31           HB3      GLN  31  20.397  10.094  20.602
    5    HG2  GLN  31           HG2      GLN  31  17.881   9.137  19.849
    6    HG3  GLN  31           HG3      GLN  31  18.977   8.297  18.760
    7   HE21  GLN  31          HE21      GLN  31  17.453   7.144  21.045
    8   HE22  GLN  31          HE22      GLN  31  18.617   6.484  22.087

  No H/Q in entry =           8
  In of MODEL   79
    1    H    GLY  32           H        GLY  32  19.000  12.859  17.500
    2    HA3  GLY  32           HA2      GLY  32  19.976  14.908  16.982
    3    HA2  GLY  32           HA3      GLY  32  20.744  14.912  18.565

  No H/Q in entry =           3
  In of MODEL   79
    1    H    ASP  33           H        ASP  33  21.162  12.023  16.781
    2    HA   ASP  33           HA       ASP  33  23.982  12.706  16.297
    3    HB2  ASP  33           HB2      ASP  33  22.481  10.086  16.419
    4    HB3  ASP  33           HB3      ASP  33  24.163  10.208  15.913

  No H/Q in entry =           4
  In of MODEL   79
    1    H    PHE  34           H        PHE  34  23.485  14.031  14.421
    2    HA   PHE  34           HA       PHE  34  22.123  13.047  12.141
    3    HB2  PHE  34           HB2      PHE  34  24.250  15.186  12.360
    4    HB3  PHE  34           HB3      PHE  34  23.256  14.895  10.934
    5    HD1  PHE  34           HD1      PHE  34  23.521  16.826  13.849
    6    HD2  PHE  34           HD2      PHE  34  20.634  14.706  11.479
    7    HE1  PHE  34           HE1      PHE  34  21.708  18.217  14.810
    8    HE2  PHE  34           HE2      PHE  34  18.824  16.097  12.444
    9    HZ   PHE  34           HZ       PHE  34  19.364  17.854  14.105

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ALA  35           H        ALA  35  25.505  12.867  13.126
    2    HA   ALA  35           HA       ALA  35  26.596  12.052  10.660
    3    HB3  ALA  35           HB1      ALA  35  28.291  10.885  12.367
    4    HB2  ALA  35           HB2      ALA  35  27.432  11.906  13.520
    5    HB1  ALA  35           HB3      ALA  35  28.258  12.634  12.143

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ALA  36           H        ALA  36  25.504  10.089  13.430
    2    HA   ALA  36           HA       ALA  36  25.988   7.605  12.148
    3    HB2  ALA  36           HB1      ALA  36  25.573   6.854  14.225
    4    HB3  ALA  36           HB2      ALA  36  23.882   7.344  14.087
    5    HB1  ALA  36           HB3      ALA  36  25.084   8.478  14.703

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ALA  37           H        ALA  37  23.160   9.722  12.303
    2    HA   ALA  37           HA       ALA  37  21.302   7.948  11.137
    3    HB3  ALA  37           HB1      ALA  37  21.520  10.911  11.432
    4    HB1  ALA  37           HB2      ALA  37  20.215   9.827  11.912
    5    HB2  ALA  37           HB3      ALA  37  20.391  10.302  10.222

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LYS  38           H        LYS  38  23.383  10.418   9.648
    2    HA   LYS  38           HA       LYS  38  22.727   9.992   6.975
    3    HB2  LYS  38           HB2      LYS  38  24.541  11.554   8.410
    4    HB3  LYS  38           HB3      LYS  38  25.571  10.570   7.376
    5    HG2  LYS  38           HG2      LYS  38  24.390  11.339   5.389
    6    HG3  LYS  38           HG3      LYS  38  23.199  12.188   6.379
    7    HD2  LYS  38           HD2      LYS  38  24.793  13.791   7.123
    8    HD3  LYS  38           HD3      LYS  38  26.153  12.811   6.577
    9    HE2  LYS  38           HE2      LYS  38  25.779  14.683   5.031
   10    HE3  LYS  38           HE3      LYS  38  25.444  13.146   4.226
   11    HZ3  LYS  38           HZ1      LYS  38  23.245  13.582   4.112
   12    HZ2  LYS  38           HZ2      LYS  38  23.761  15.199   4.198
   13    HZ1  LYS  38           HZ3      LYS  38  23.200  14.411   5.593

  No H/Q in entry =          13
  In of MODEL   79
    1    H    ALA  39           H        ALA  39  25.260   8.402   8.911
    2    HA   ALA  39           HA       ALA  39  26.322   6.821   6.832
    3    HB2  ALA  39           HB1      ALA  39  26.257   5.853   9.675
    4    HB1  ALA  39           HB2      ALA  39  27.200   7.283   9.255
    5    HB3  ALA  39           HB3      ALA  39  27.553   5.735   8.487

  No H/Q in entry =           5
  In of MODEL   79
    1    H    MET  40           H        MET  40  23.727   6.190   9.147
    2    HA   MET  40           HA       MET  40  23.291   3.485   8.412
    3    HB2  MET  40           HB2      MET  40  21.474   5.518   9.719
    4    HB3  MET  40           HB3      MET  40  21.074   3.808   9.544
    5    HG2  MET  40           HG2      MET  40  23.628   4.758  10.870
    6    HG3  MET  40           HG3      MET  40  22.141   4.474  11.772
    7    HE3  MET  40           HE1      MET  40  21.595   0.838  11.946
    8    HE2  MET  40           HE2      MET  40  20.715   2.138  11.147
    9    HE1  MET  40           HE3      MET  40  21.465   2.427  12.715

  No H/Q in entry =           9
  In of MODEL   79
    1    H    MET  41           H        MET  41  21.856   6.533   7.238
    2    HA   MET  41           HA       MET  41  19.893   5.332   5.578
    3    HB2  MET  41           HB2      MET  41  21.358   7.929   5.059
    4    HB3  MET  41           HB3      MET  41  19.828   7.430   4.350
    5    HG2  MET  41           HG2      MET  41  19.100   7.234   6.906
    6    HG3  MET  41           HG3      MET  41  20.405   8.398   7.121
    7    HE2  MET  41           HE1      MET  41  19.814   9.688   3.790
    8    HE1  MET  41           HE2      MET  41  20.778  10.130   5.195
    9    HE3  MET  41           HE3      MET  41  19.496  11.204   4.641

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ASP  42           H        ASP  42  23.257   6.271   5.003
    2    HA   ASP  42           HA       ASP  42  23.333   5.802   2.245
    3    HB2  ASP  42           HB2      ASP  42  25.091   6.805   4.004
    4    HB3  ASP  42           HB3      ASP  42  25.755   5.183   3.869

  No H/Q in entry =           4
  In of MODEL   79
    1    H    GLN  43           H        GLN  43  24.086   3.647   4.957
    2    HA   GLN  43           HA       GLN  43  24.750   1.395   3.366
    3    HB2  GLN  43           HB2      GLN  43  23.746   1.569   6.217
    4    HB3  GLN  43           HB3      GLN  43  24.327   0.084   5.456
    5    HG2  GLN  43           HG2      GLN  43  26.481   1.306   4.932
    6    HG3  GLN  43           HG3      GLN  43  25.898   2.628   5.937
    7   HE21  GLN  43          HE21      GLN  43  28.143   1.665   6.957
    8   HE22  GLN  43          HE22      GLN  43  27.882   0.579   8.234

  No H/Q in entry =           8
  In of MODEL   79
    1    H    SER  44           H        SER  44  21.698   2.511   4.774
    2    HA   SER  44           HA       SER  44  20.136   0.262   4.108
    3    HB2  SER  44           HB2      SER  44  19.689   2.787   5.261
    4    HB3  SER  44           HB3      SER  44  18.646   2.741   3.843
    5    HG   SER  44           HG       SER  44  17.568   1.790   5.571

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ARG  45           H        ARG  45  20.852   3.233   2.303
    2    HA   ARG  45           HA       ARG  45  19.314   2.743   0.008
    3    HB2  ARG  45           HB2      ARG  45  20.451   4.884   0.588
    4    HB3  ARG  45           HB3      ARG  45  21.997   4.137   0.190
    5    HG2  ARG  45           HG2      ARG  45  21.199   3.731  -2.119
    6    HG3  ARG  45           HG3      ARG  45  19.666   4.501  -1.721
    7    HD2  ARG  45           HD2      ARG  45  20.910   6.603  -1.142
    8    HD3  ARG  45           HD3      ARG  45  22.407   5.837  -1.722
    9    HE   ARG  45           HE       ARG  45  20.463   5.593  -3.745
   10   HH21  ARG  45          HH11      ARG  45  20.438   6.965  -5.506
   11   HH22  ARG  45          HH12      ARG  45  21.189   8.518  -5.405
   12   HH11  ARG  45          HH21      ARG  45  22.193   8.097  -2.127
   13   HH12  ARG  45          HH22      ARG  45  22.181   9.159  -3.488

  No H/Q in entry =          13
  In of MODEL   79
    1    H    MET  46           H        MET  46  22.686   1.882   0.731
    2    HA   MET  46           HA       MET  46  23.280   0.696  -1.759
    3    HB2  MET  46           HB2      MET  46  24.410   0.405   1.022
    4    HB3  MET  46           HB3      MET  46  25.044  -0.536  -0.333
    5    HG2  MET  46           HG2      MET  46  25.696   1.420  -1.524
    6    HG3  MET  46           HG3      MET  46  24.731   2.467  -0.490
    7    HE3  MET  46           HE1      MET  46  26.459  -0.403   1.431
    8    HE2  MET  46           HE2      MET  46  28.166   0.002   1.296
    9    HE1  MET  46           HE3      MET  46  27.252  -0.418  -0.150

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ALA  47           H        ALA  47  21.924  -0.647   1.224
    2    HA   ALA  47           HA       ALA  47  21.875  -3.359   0.418
    3    HB2  ALA  47           HB1      ALA  47  21.511  -2.903   2.726
    4    HB3  ALA  47           HB2      ALA  47  19.972  -3.511   2.118
    5    HB1  ALA  47           HB3      ALA  47  20.197  -1.780   2.377

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LEU  48           H        LEU  48  19.510  -0.741   0.082
    2    HA   LEU  48           HA       LEU  48  17.461  -2.280  -1.155
    3    HB2  LEU  48           HB2      LEU  48  18.104   0.677  -1.271
    4    HB3  LEU  48           HB3      LEU  48  16.631  -0.038  -1.928
    5    HG   LEU  48           HG       LEU  48  17.507  -0.341   0.954
    6   HD13  LEU  48          HD11      LEU  48  17.080   1.959   0.773
    7   HD12  LEU  48          HD12      LEU  48  15.527   1.305   1.294
    8   HD11  LEU  48          HD13      LEU  48  15.784   1.730  -0.399
    9   HD22  LEU  48          HD21      LEU  48  15.982  -2.060   0.583
   10   HD21  LEU  48          HD22      LEU  48  15.095  -1.159  -0.648
   11   HD23  LEU  48          HD23      LEU  48  14.894  -0.757   1.058

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ASN  49           H        ASN  49  20.133  -0.341  -2.404
    2    HA   ASN  49           HA       ASN  49  19.462  -0.424  -5.123
    3    HB2  ASN  49           HB2      ASN  49  21.147   1.092  -4.193
    4    HB3  ASN  49           HB3      ASN  49  22.188  -0.271  -3.803
    5   HD21  ASN  49          HD21      ASN  49  23.879   0.541  -5.216
    6   HD22  ASN  49          HD22      ASN  49  23.732   0.460  -6.905

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLU  50           H        GLU  50  21.468  -2.614  -3.178
    2    HA   GLU  50           HA       GLU  50  22.159  -4.366  -5.312
    3    HB2  GLU  50           HB2      GLU  50  23.373  -4.339  -3.155
    4    HB3  GLU  50           HB3      GLU  50  21.939  -4.972  -2.348
    5    HG2  GLU  50           HG2      GLU  50  22.024  -7.003  -3.710
    6    HG3  GLU  50           HG3      GLU  50  23.391  -6.366  -4.621

  No H/Q in entry =           6
  In of MODEL   79
    1    H    ALA  51           H        ALA  51  19.521  -4.311  -2.965
    2    HA   ALA  51           HA       ALA  51  18.356  -6.787  -3.715
    3    HB3  ALA  51           HB1      ALA  51  16.775  -6.287  -2.146
    4    HB1  ALA  51           HB2      ALA  51  16.552  -4.641  -2.742
    5    HB2  ALA  51           HB3      ALA  51  17.920  -5.024  -1.697

  No H/Q in entry =           5
  In of MODEL   79
    1    H    HIS  52           H        HIS  52  17.751  -3.440  -4.742
    2    HA   HIS  52           HA       HIS  52  15.626  -3.971  -6.525
    3    HB2  HIS  52           HB2      HIS  52  16.204  -1.705  -5.764
    4    HB3  HIS  52           HB3      HIS  52  17.724  -1.792  -6.652
    5    HD1  HIS  52           HD1      HIS  52  17.459  -2.140  -9.334
    6    HD2  HIS  52           HD2      HIS  52  14.048  -0.866  -7.303
    7    HE1  HIS  52           HE1      HIS  52  15.880  -1.222 -11.090
    8    HE2  HIS  52           HE2      HIS  52  13.796  -0.441  -9.868

  No H/Q in entry =           8
  In of MODEL   79
    1    H    LEU  53           H        LEU  53  19.141  -3.966  -6.986
    2    HA   LEU  53           HA       LEU  53  19.176  -4.279  -9.787
    3    HB2  LEU  53           HB2      LEU  53  21.130  -5.043  -7.631
    4    HB3  LEU  53           HB3      LEU  53  21.433  -5.415  -9.326
    5    HG   LEU  53           HG       LEU  53  20.755  -2.615  -8.374
    6   HD12  LEU  53          HD11      LEU  53  23.297  -2.288  -8.740
    7   HD11  LEU  53          HD12      LEU  53  23.406  -4.040  -8.576
    8   HD13  LEU  53          HD13      LEU  53  22.783  -3.070  -7.247
    9   HD21  LEU  53          HD21      LEU  53  21.832  -3.821 -10.929
   10   HD23  LEU  53          HD22      LEU  53  22.147  -2.136 -10.528
   11   HD22  LEU  53          HD23      LEU  53  20.497  -2.691 -10.743

  No H/Q in entry =          11
  In of MODEL   79
    1    H    VAL  54           H        VAL  54  19.093  -6.668  -7.162
    2    HA   VAL  54           HA       VAL  54  19.211  -8.961  -8.825
    3    HB   VAL  54           HB       VAL  54  18.077  -8.543  -6.048
    4   HG12  VAL  54          HG11      VAL  54  18.411 -11.159  -6.048
    5   HG11  VAL  54          HG12      VAL  54  18.211 -10.991  -7.792
    6   HG13  VAL  54          HG13      VAL  54  16.930 -10.465  -6.702
    7   HG22  VAL  54          HG21      VAL  54  20.394  -8.324  -5.843
    8   HG21  VAL  54          HG22      VAL  54  20.725  -9.414  -7.188
    9   HG23  VAL  54          HG23      VAL  54  20.209 -10.064  -5.632

  No H/Q in entry =           9
  In of MODEL   79
    1    H    GLN  55           H        GLN  55  16.486  -7.069  -7.519
    2    HA   GLN  55           HA       GLN  55  14.463  -8.740  -8.577
    3    HB2  GLN  55           HB2      GLN  55  13.722  -7.218  -6.943
    4    HB3  GLN  55           HB3      GLN  55  14.503  -5.846  -7.725
    5    HG2  GLN  55           HG2      GLN  55  12.765  -5.528  -9.201
    6    HG3  GLN  55           HG3      GLN  55  12.449  -7.249  -9.369
    7   HE21  GLN  55          HE21      GLN  55  10.451  -7.807  -8.548
    8   HE22  GLN  55          HE22      GLN  55   9.685  -7.057  -7.233

  No H/Q in entry =           8
  In of MODEL   79
    1    H    THR  56           H        THR  56  16.180  -5.932  -9.949
    2    HA   THR  56           HA       THR  56  14.721  -5.575 -12.285
    3    HB   THR  56           HB       THR  56  17.742  -5.469 -12.124
    4    HG1  THR  56           HG1      THR  56  15.760  -3.593 -11.364
    5   HG21  THR  56          HG21      THR  56  16.179  -5.150 -14.301
    6   HG23  THR  56          HG22      THR  56  17.669  -4.242 -14.052
    7   HG22  THR  56          HG23      THR  56  16.114  -3.511 -13.651

  No H/Q in entry =           7
  In of MODEL   79
    1    H    LYS  57           H        LYS  57  17.386  -7.861 -11.697
    2    HA   LYS  57           HA       LYS  57  17.370  -9.054 -14.276
    3    HB2  LYS  57           HB2      LYS  57  19.063  -9.249 -12.280
    4    HB3  LYS  57           HB3      LYS  57  18.013 -10.550 -11.737
    5    HG2  LYS  57           HG2      LYS  57  18.276 -11.484 -14.142
    6    HG3  LYS  57           HG3      LYS  57  19.656 -10.398 -14.260
    7    HD2  LYS  57           HD2      LYS  57  19.325 -12.871 -12.637
    8    HD3  LYS  57           HD3      LYS  57  20.769 -12.224 -13.415
    9    HE2  LYS  57           HE2      LYS  57  20.698 -10.362 -11.637
   10    HE3  LYS  57           HE3      LYS  57  19.539 -11.371 -10.776
   11    HZ1  LYS  57           HZ1      LYS  57  21.162 -13.167 -10.793
   12    HZ3  LYS  57           HZ2      LYS  57  21.771 -11.789 -10.010
   13    HZ2  LYS  57           HZ3      LYS  57  22.280 -12.169 -11.584

  No H/Q in entry =          13
  In of MODEL   79
    1    H    LEU  58           H        LEU  58  15.617  -9.731 -11.286
    2    HA   LEU  58           HA       LEU  58  14.399 -12.110 -12.211
    3    HB2  LEU  58           HB2      LEU  58  13.613 -10.209 -10.009
    4    HB3  LEU  58           HB3      LEU  58  12.811 -11.750 -10.319
    5    HG   LEU  58           HG       LEU  58  15.787 -11.459  -9.789
    6   HD11  LEU  58          HD11      LEU  58  13.433 -11.888  -7.976
    7   HD13  LEU  58          HD12      LEU  58  14.884 -10.918  -7.726
    8   HD12  LEU  58          HD13      LEU  58  14.966 -12.673  -7.592
    9   HD22  LEU  58          HD21      LEU  58  15.671 -13.520 -10.816
   10   HD21  LEU  58          HD22      LEU  58  13.961 -13.738 -10.441
   11   HD23  LEU  58          HD23      LEU  58  15.181 -14.034  -9.202

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  59           H        ILE  59  13.706  -8.776 -12.887
    2    HA   ILE  59           HA       ILE  59  10.986  -9.437 -13.805
    3    HB   ILE  59           HB       ILE  59  11.786  -7.153 -12.604
    4   HG12  ILE  59          HG12      ILE  59   9.872  -7.024 -14.944
    5   HG13  ILE  59          HG13      ILE  59   9.460  -7.813 -13.443
    6   HG21  ILE  59          HG21      ILE  59  13.315  -6.750 -14.677
    7   HG23  ILE  59          HG22      ILE  59  12.347  -5.413 -14.099
    8   HG22  ILE  59          HG23      ILE  59  11.836  -6.337 -15.508
    9   HD11  ILE  59          HD11      ILE  59  10.440  -4.966 -13.579
   10   HD13  ILE  59          HD12      ILE  59   9.730  -5.780 -12.186
   11   HD12  ILE  59          HD13      ILE  59   8.729  -5.397 -13.589

  No H/Q in entry =          11
  In of MODEL   79
    1    H    GLU  60           H        GLU  60  14.175  -8.569 -15.089
    2    HA   GLU  60           HA       GLU  60  13.371  -8.172 -17.791
    3    HB2  GLU  60           HB2      GLU  60  15.546  -7.411 -17.013
    4    HB3  GLU  60           HB3      GLU  60  16.019  -9.060 -16.617
    5    HG2  GLU  60           HG2      GLU  60  15.170  -8.384 -19.422
    6    HG3  GLU  60           HG3      GLU  60  16.811  -8.026 -18.889

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLY  61           H        GLY  61  14.377 -11.049 -15.985
    2    HA3  GLY  61           HA2      GLY  61  13.824 -12.699 -18.383
    3    HA2  GLY  61           HA3      GLY  61  14.869 -13.176 -17.049

  No H/Q in entry =           3
  In of MODEL   79
    1    H    ASP  62           H        ASP  62  11.746 -11.644 -16.649
    2    HA   ASP  62           HA       ASP  62  10.673 -13.059 -14.675
    3    HB2  ASP  62           HB2      ASP  62   8.450 -12.663 -15.644
    4    HB3  ASP  62           HB3      ASP  62   9.491 -11.252 -15.814

  No H/Q in entry =           4
  In of MODEL   79
    1    H    ALA  63           H        ALA  63   9.301 -14.941 -14.381
    2    HA   ALA  63           HA       ALA  63  10.236 -17.300 -15.661
    3    HB3  ALA  63           HB1      ALA  63   9.334 -17.570 -13.492
    4    HB2  ALA  63           HB2      ALA  63   8.139 -18.310 -14.554
    5    HB1  ALA  63           HB3      ALA  63   7.858 -16.696 -13.901

  No H/Q in entry =           5
  In of MODEL   79
    1    H    GLY  64           H        GLY  64   9.351 -18.570 -17.242
    2    HA3  GLY  64           HA2      GLY  64   8.071 -19.171 -19.059
    3    HA2  GLY  64           HA3      GLY  64   6.826 -18.068 -18.489

  No H/Q in entry =           3
  In of MODEL   79
    1    H    GLU  65           H        GLU  65  10.005 -18.090 -20.120
    2    HA   GLU  65           HA       GLU  65   9.918 -15.445 -21.026
    3    HB2  GLU  65           HB2      GLU  65  11.300 -17.868 -22.169
    4    HB3  GLU  65           HB3      GLU  65  11.543 -16.231 -22.778
    5    HG2  GLU  65           HG2      GLU  65  12.286 -15.489 -20.565
    6    HG3  GLU  65           HG3      GLU  65  11.987 -17.097 -19.906

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLY  66           H        GLY  66   8.853 -18.389 -22.591
    2    HA3  GLY  66           HA2      GLY  66   8.025 -17.303 -25.057
    3    HA2  GLY  66           HA3      GLY  66   7.534 -18.845 -24.390

  No H/Q in entry =           3
  In of MODEL   79
    1    H    LYS  67           H        LYS  67   6.214 -18.011 -22.110
    2    HA   LYS  67           HA       LYS  67   3.746 -17.023 -23.278
    3    HB2  LYS  67           HB2      LYS  67   4.386 -18.321 -20.634
    4    HB3  LYS  67           HB3      LYS  67   2.767 -17.789 -21.101
    5    HG2  LYS  67           HG2      LYS  67   2.873 -19.201 -23.118
    6    HG3  LYS  67           HG3      LYS  67   4.494 -19.728 -22.671
    7    HD2  LYS  67           HD2      LYS  67   3.599 -20.723 -20.596
    8    HD3  LYS  67           HD3      LYS  67   1.974 -20.207 -21.056
    9    HE2  LYS  67           HE2      LYS  67   2.111 -21.567 -23.106
   10    HE3  LYS  67           HE3      LYS  67   3.739 -22.080 -22.662
   11    HZ3  LYS  67           HZ1      LYS  67   2.938 -23.584 -21.258
   12    HZ2  LYS  67           HZ2      LYS  67   1.416 -23.322 -21.965
   13    HZ1  LYS  67           HZ3      LYS  67   1.855 -22.486 -20.552

  No H/Q in entry =          13
  In of MODEL   79
    1    H    MET  68           H        MET  68   2.429 -15.468 -22.421
    2    HA   MET  68           HA       MET  68   3.636 -13.024 -21.744
    3    HB2  MET  68           HB2      MET  68   0.753 -13.908 -21.592
    4    HB3  MET  68           HB3      MET  68   1.300 -12.237 -21.450
    5    HG2  MET  68           HG2      MET  68   1.829 -14.033 -23.833
    6    HG3  MET  68           HG3      MET  68   0.586 -12.784 -23.766
    7    HE2  MET  68           HE1      MET  68   2.025 -10.234 -22.259
    8    HE1  MET  68           HE2      MET  68   0.803 -10.538 -23.490
    9    HE3  MET  68           HE3      MET  68   2.185  -9.513 -23.866

  No H/Q in entry =           9
  In of MODEL   79
    1    H    LYS  69           H        LYS  69   3.012 -15.604 -19.644
    2    HA   LYS  69           HA       LYS  69   2.351 -13.954 -17.351
    3    HB2  LYS  69           HB2      LYS  69   2.702 -16.931 -17.676
    4    HB3  LYS  69           HB3      LYS  69   2.334 -16.159 -16.132
    5    HG2  LYS  69           HG2      LYS  69   0.317 -15.139 -17.103
    6    HG3  LYS  69           HG3      LYS  69   0.685 -15.879 -18.660
    7    HD2  LYS  69           HD2      LYS  69   0.514 -18.122 -17.620
    8    HD3  LYS  69           HD3      LYS  69   0.095 -17.363 -16.083
    9    HE2  LYS  69           HE2      LYS  69  -1.468 -16.982 -18.653
   10    HE3  LYS  69           HE3      LYS  69  -1.909 -18.124 -17.385
   11    HZ1  LYS  69           HZ1      LYS  69  -1.409 -15.577 -16.273
   12    HZ3  LYS  69           HZ2      LYS  69  -2.831 -16.503 -16.224
   13    HZ2  LYS  69           HZ3      LYS  69  -2.551 -15.437 -17.517

  No H/Q in entry =          13
  In of MODEL   79
    1    H    VAL  70           H        VAL  70   3.473 -14.066 -15.267
    2    HA   VAL  70           HA       VAL  70   6.394 -14.510 -15.501
    3    HB   VAL  70           HB       VAL  70   6.723 -12.485 -14.114
    4   HG11  VAL  70          HG11      VAL  70   6.446 -12.576 -16.757
    5   HG13  VAL  70          HG12      VAL  70   6.645 -11.035 -15.922
    6   HG12  VAL  70          HG13      VAL  70   5.038 -11.571 -16.414
    7   HG22  VAL  70          HG21      VAL  70   4.582 -12.408 -12.939
    8   HG21  VAL  70          HG22      VAL  70   3.719 -12.208 -14.463
    9   HG23  VAL  70          HG23      VAL  70   4.756 -10.915 -13.862

  No H/Q in entry =           9
  In of MODEL   79
    1    H    SER  71           H        SER  71   7.429 -14.624 -13.308
    2    HA   SER  71           HA       SER  71   6.275 -16.638 -11.702
    3    HB2  SER  71           HB2      SER  71   8.718 -16.134 -11.821
    4    HB3  SER  71           HB3      SER  71   8.422 -14.652 -10.914
    5    HG   SER  71           HG       SER  71   7.299 -16.235  -9.406

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LEU  72           H        LEU  72   4.939 -16.554  -9.976
    2    HA   LEU  72           HA       LEU  72   3.382 -14.249  -9.518
    3    HB2  LEU  72           HB2      LEU  72   3.694 -16.804  -7.949
    4    HB3  LEU  72           HB3      LEU  72   2.521 -15.554  -7.544
    5    HG   LEU  72           HG       LEU  72   2.671 -16.848 -10.286
    6   HD12  LEU  72          HD11      LEU  72   0.698 -18.172  -9.538
    7   HD11  LEU  72          HD12      LEU  72   0.915 -17.535  -7.909
    8   HD13  LEU  72          HD13      LEU  72   2.154 -18.567  -8.623
    9   HD22  LEU  72          HD21      LEU  72   1.432 -14.864 -10.518
   10   HD21  LEU  72          HD22      LEU  72   0.760 -14.962  -8.899
   11   HD23  LEU  72          HD23      LEU  72   0.173 -16.040 -10.161

  No H/Q in entry =          11
  In of MODEL   79
    1    H    VAL  73           H        VAL  73   6.059 -15.675  -7.766
    2    HA   VAL  73           HA       VAL  73   6.008 -14.144  -5.432
    3    HB   VAL  73           HB       VAL  73   8.163 -14.976  -4.997
    4   HG13  VAL  73          HG11      VAL  73   7.887 -17.283  -5.360
    5   HG12  VAL  73          HG12      VAL  73   7.146 -17.039  -6.942
    6   HG11  VAL  73          HG13      VAL  73   6.242 -16.662  -5.476
    7   HG22  VAL  73          HG21      VAL  73   9.410 -14.198  -6.876
    8   HG21  VAL  73          HG22      VAL  73   8.421 -15.121  -8.007
    9   HG23  VAL  73          HG23      VAL  73   9.537 -15.956  -6.926

  No H/Q in entry =           9
  In of MODEL   79
    1    H    LEU  74           H        LEU  74   6.971 -13.242  -8.614
    2    HA   LEU  74           HA       LEU  74   8.911 -11.285  -8.134
    3    HB2  LEU  74           HB2      LEU  74   8.438 -12.038 -10.369
    4    HB3  LEU  74           HB3      LEU  74   6.774 -11.469 -10.256
    5    HG   LEU  74           HG       LEU  74   7.583  -9.143 -10.044
    6   HD11  LEU  74          HD11      LEU  74  10.259 -10.535 -10.181
    7   HD13  LEU  74          HD12      LEU  74   9.710  -9.338  -9.010
    8   HD12  LEU  74          HD13      LEU  74  10.078  -8.848 -10.663
    9   HD21  LEU  74          HD21      LEU  74   7.321 -10.579 -12.264
   10   HD23  LEU  74          HD22      LEU  74   9.031 -10.226 -12.374
   11   HD22  LEU  74          HD23      LEU  74   7.882  -8.908 -12.304

  No H/Q in entry =          11
  In of MODEL   79
    1    H    VAL  75           H        VAL  75   5.411 -10.916  -8.462
    2    HA   VAL  75           HA       VAL  75   5.306  -8.161  -7.872
    3    HB   VAL  75           HB       VAL  75   3.229 -10.315  -7.474
    4   HG11  VAL  75          HG11      VAL  75   3.033  -7.277  -7.297
    5   HG13  VAL  75          HG12      VAL  75   2.734  -8.424  -5.999
    6   HG12  VAL  75          HG13      VAL  75   1.647  -8.360  -7.377
    7   HG21  VAL  75          HG21      VAL  75   3.832  -8.271  -9.630
    8   HG23  VAL  75          HG22      VAL  75   2.296  -9.130  -9.532
    9   HG22  VAL  75          HG23      VAL  75   3.793 -10.026  -9.800

  No H/Q in entry =           9
  In of MODEL   79
    1    H    GLU  76           H        GLU  76   5.080 -11.041  -5.763
    2    HA   GLU  76           HA       GLU  76   4.620  -9.684  -3.337
    3    HB2  GLU  76           HB2      GLU  76   4.477 -12.169  -3.622
    4    HB3  GLU  76           HB3      GLU  76   6.224 -12.228  -3.781
    5    HG2  GLU  76           HG2      GLU  76   6.494 -11.363  -1.497
    6    HG3  GLU  76           HG3      GLU  76   4.754 -11.232  -1.309

  No H/Q in entry =           6
  In of MODEL   79
    1    H    ALA  77           H        ALA  77   7.673 -10.576  -4.922
    2    HA   ALA  77           HA       ALA  77   9.371  -9.527  -2.916
    3    HB3  ALA  77           HB1      ALA  77   9.925  -9.776  -5.882
    4    HB1  ALA  77           HB2      ALA  77  10.125 -11.072  -4.705
    5    HB2  ALA  77           HB3      ALA  77  11.129  -9.625  -4.602

  No H/Q in entry =           5
  In of MODEL   79
    1    H    GLN  78           H        GLN  78   7.954  -8.113  -5.819
    2    HA   GLN  78           HA       GLN  78   9.297  -5.629  -5.721
    3    HB2  GLN  78           HB2      GLN  78   7.993  -6.544  -7.672
    4    HB3  GLN  78           HB3      GLN  78   6.514  -6.179  -6.787
    5    HG2  GLN  78           HG2      GLN  78   7.151  -3.804  -6.692
    6    HG3  GLN  78           HG3      GLN  78   8.635  -4.162  -7.574
    7   HE21  GLN  78          HE21      GLN  78   8.247  -3.210  -9.613
    8   HE22  GLN  78          HE22      GLN  78   6.894  -3.558 -10.578

  No H/Q in entry =           8
  In of MODEL   79
    1    H    LEU  79           H        LEU  79   6.291  -6.780  -4.273
    2    HA   LEU  79           HA       LEU  79   5.294  -4.378  -3.256
    3    HB2  LEU  79           HB2      LEU  79   3.988  -6.434  -3.194
    4    HB3  LEU  79           HB3      LEU  79   5.143  -7.170  -2.086
    5    HG   LEU  79           HG       LEU  79   4.595  -5.532  -0.354
    6   HD13  LEU  79          HD11      LEU  79   4.115  -3.518  -1.400
    7   HD12  LEU  79          HD12      LEU  79   2.494  -4.050  -0.952
    8   HD11  LEU  79          HD13      LEU  79   3.066  -4.269  -2.604
    9   HD23  LEU  79          HD21      LEU  79   2.011  -6.034  -0.249
   10   HD22  LEU  79          HD22      LEU  79   3.156  -7.369  -0.149
   11   HD21  LEU  79          HD23      LEU  79   2.332  -7.034  -1.668

  No H/Q in entry =          11
  In of MODEL   79
    1    H    HIS  80           H        HIS  80   7.495  -6.706  -1.688
    2    HA   HIS  80           HA       HIS  80   7.791  -5.165   0.681
    3    HB2  HIS  80           HB2      HIS  80   9.131  -7.523  -0.528
    4    HB3  HIS  80           HB3      HIS  80  10.046  -6.624   0.684
    5    HD1  HIS  80           HD1      HIS  80   9.571  -7.264   3.029
    6    HD2  HIS  80           HD2      HIS  80   6.343  -8.124   0.535
    7    HE1  HIS  80           HE1      HIS  80   7.811  -8.375   4.487
    8    HE2  HIS  80           HE2      HIS  80   5.837  -8.903   2.975

  No H/Q in entry =           8
  In of MODEL   79
    1    H    LEU  81           H        LEU  81   9.781  -5.431  -2.243
    2    HA   LEU  81           HA       LEU  81  11.824  -3.684  -1.375
    3    HB2  LEU  81           HB2      LEU  81  10.890  -4.477  -4.133
    4    HB3  LEU  81           HB3      LEU  81  12.308  -3.466  -3.850
    5    HG   LEU  81           HG       LEU  81  11.932  -6.190  -2.577
    6   HD12  LEU  81          HD11      LEU  81  13.740  -6.809  -4.337
    7   HD11  LEU  81          HD12      LEU  81  13.165  -5.386  -5.204
    8   HD13  LEU  81          HD13      LEU  81  12.060  -6.714  -4.861
    9   HD23  LEU  81          HD21      LEU  81  14.559  -5.867  -2.577
   10   HD22  LEU  81          HD22      LEU  81  13.582  -5.111  -1.321
   11   HD21  LEU  81          HD23      LEU  81  14.150  -4.155  -2.690

  No H/Q in entry =          11
  In of MODEL   79
    1    H    MET  82           H        MET  82   8.889  -3.055  -3.295
    2    HA   MET  82           HA       MET  82   9.418  -0.327  -3.796
    3    HB2  MET  82           HB2      MET  82   6.863  -1.929  -3.658
    4    HB3  MET  82           HB3      MET  82   6.856  -0.204  -4.021
    5    HG2  MET  82           HG2      MET  82   8.454  -2.271  -5.567
    6    HG3  MET  82           HG3      MET  82   6.882  -1.653  -6.070
    7    HE3  MET  82           HE1      MET  82   7.315   1.805  -7.241
    8    HE2  MET  82           HE2      MET  82   6.950   1.576  -5.533
    9    HE1  MET  82           HE3      MET  82   6.281   0.465  -6.725

  No H/Q in entry =           9
  In of MODEL   79
    1    H    THR  83           H        THR  83   7.644  -1.933  -1.183
    2    HA   THR  83           HA       THR  83   6.794   0.412   0.151
    3    HB   THR  83           HB       THR  83   6.675  -1.165   2.168
    4    HG1  THR  83           HG1      THR  83   7.436  -3.113   1.932
    5   HG22  THR  83          HG21      THR  83   5.018  -2.734   0.707
    6   HG21  THR  83          HG22      THR  83   5.235  -1.403  -0.424
    7   HG23  THR  83          HG23      THR  83   4.603  -1.092   1.192

  No H/Q in entry =           7
  In of MODEL   79
    1    H    SER  84           H        SER  84   9.626  -1.679   0.654
    2    HA   SER  84           HA       SER  84  10.694  -0.248   2.838
    3    HB2  SER  84           HB2      SER  84  11.941  -2.086   0.804
    4    HB3  SER  84           HB3      SER  84  12.893  -1.331   2.082
    5    HG   SER  84           HG       SER  84  10.623  -3.027   2.352

  No H/Q in entry =           5
  In of MODEL   79
    1    H    MET  85           H        MET  85  11.427   0.018  -0.654
    2    HA   MET  85           HA       MET  85  13.423   1.987  -0.412
    3    HB2  MET  85           HB2      MET  85  13.014   0.704  -2.476
    4    HB3  MET  85           HB3      MET  85  11.488   1.561  -2.698
    5    HG2  MET  85           HG2      MET  85  12.690   3.703  -2.827
    6    HG3  MET  85           HG3      MET  85  14.219   2.871  -2.565
    7    HE1  MET  85           HE1      MET  85  11.145   3.332  -4.528
    8    HE3  MET  85           HE2      MET  85  11.111   1.648  -5.043
    9    HE2  MET  85           HE3      MET  85  11.506   2.905  -6.207

  No H/Q in entry =           9
  In of MODEL   79
    1    H    LEU  86           H        LEU  86   9.930   2.315  -0.901
    2    HA   LEU  86           HA       LEU  86   9.859   5.128  -1.080
    3    HB2  LEU  86           HB2      LEU  86   8.015   3.465  -1.647
    4    HB3  LEU  86           HB3      LEU  86   7.695   3.373   0.084
    5    HG   LEU  86           HG       LEU  86   7.528   5.933   0.035
    6   HD11  LEU  86          HD11      LEU  86   8.290   5.502  -2.671
    7   HD13  LEU  86          HD12      LEU  86   7.855   7.028  -1.907
    8   HD12  LEU  86          HD13      LEU  86   6.617   6.063  -2.706
    9   HD23  LEU  86          HD21      LEU  86   5.388   4.578  -1.617
   10   HD22  LEU  86          HD22      LEU  86   5.202   5.837  -0.399
   11   HD21  LEU  86          HD23      LEU  86   5.608   4.193   0.091

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ALA  87           H        ALA  87   9.412   2.946   1.667
    2    HA   ALA  87           HA       ALA  87   8.871   4.857   3.641
    3    HB1  ALA  87           HB1      ALA  87   9.683   2.038   3.547
    4    HB3  ALA  87           HB2      ALA  87   8.562   2.847   4.640
    5    HB2  ALA  87           HB3      ALA  87  10.292   2.882   4.974

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ARG  88           H        ARG  88  11.951   3.439   2.642
    2    HA   ARG  88           HA       ARG  88  13.568   4.818   4.466
    3    HB2  ARG  88           HB2      ARG  88  14.232   2.847   3.057
    4    HB3  ARG  88           HB3      ARG  88  14.375   3.942   1.685
    5    HG2  ARG  88           HG2      ARG  88  15.857   5.256   3.624
    6    HG3  ARG  88           HG3      ARG  88  16.183   3.567   3.999
    7    HD2  ARG  88           HD2      ARG  88  17.440   3.275   2.145
    8    HD3  ARG  88           HD3      ARG  88  16.296   4.145   1.119
    9    HE   ARG  88           HE       ARG  88  18.694   5.212   2.154
   10   HH21  ARG  88          HH11      ARG  88  19.035   7.432   1.960
   11   HH22  ARG  88          HH12      ARG  88  17.681   8.501   1.825
   12   HH11  ARG  88          HH21      ARG  88  15.352   5.960   1.896
   13   HH12  ARG  88          HH22      ARG  88  15.594   7.665   1.765

  No H/Q in entry =          13
  In of MODEL   79
    1    H    GLU  89           H        GLU  89  12.575   5.718   1.150
    2    HA   GLU  89           HA       GLU  89  14.117   8.081   0.987
    3    HB2  GLU  89           HB2      GLU  89  12.963   7.040  -0.956
    4    HB3  GLU  89           HB3      GLU  89  11.421   7.577  -0.288
    5    HG2  GLU  89           HG2      GLU  89  12.118   9.916  -0.453
    6    HG3  GLU  89           HG3      GLU  89  13.720   9.429  -0.999

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LEU  90           H        LEU  90  10.795   7.564   2.135
    2    HA   LEU  90           HA       LEU  90  10.278  10.296   2.716
    3    HB2  LEU  90           HB2      LEU  90   9.094   7.719   3.747
    4    HB3  LEU  90           HB3      LEU  90   8.463   9.313   4.176
    5    HG   LEU  90           HG       LEU  90   8.866   8.437   1.303
    6   HD12  LEU  90          HD11      LEU  90   6.333   8.103   1.380
    7   HD11  LEU  90          HD12      LEU  90   6.498   8.092   3.136
    8   HD13  LEU  90          HD13      LEU  90   7.313   6.864   2.165
    9   HD22  LEU  90          HD21      LEU  90   8.567  10.744   1.234
   10   HD21  LEU  90          HD22      LEU  90   7.589  10.773   2.700
   11   HD23  LEU  90          HD23      LEU  90   6.884  10.219   1.182

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  91           H        ILE  91  11.557   7.615   4.628
    2    HA   ILE  91           HA       ILE  91  11.709   8.978   7.097
    3    HB   ILE  91           HB       ILE  91  13.261   6.643   5.962
    4   HG12  ILE  91          HG12      ILE  91  11.257   6.804   8.233
    5   HG13  ILE  91          HG13      ILE  91  10.778   6.524   6.560
    6   HG22  ILE  91          HG21      ILE  91  13.747   6.428   8.599
    7   HG21  ILE  91          HG22      ILE  91  13.667   8.186   8.501
    8   HG23  ILE  91          HG23      ILE  91  14.841   7.301   7.528
    9   HD13  ILE  91          HD11      ILE  91  11.784   4.424   6.482
   10   HD12  ILE  91          HD12      ILE  91  11.200   4.480   8.145
   11   HD11  ILE  91          HD13      ILE  91  12.899   4.797   7.797

  No H/Q in entry =          11
  In of MODEL   79
    1    H    THR  92           H        THR  92  13.910   8.815   4.332
    2    HA   THR  92           HA       THR  92  16.080  10.211   5.480
    3    HB   THR  92           HB       THR  92  15.077  10.087   2.625
    4    HG1  THR  92           HG1      THR  92  15.915   8.191   3.023
    5   HG22  THR  92          HG21      THR  92  17.644  10.783   2.317
    6   HG21  THR  92          HG22      THR  92  17.343  11.602   3.849
    7   HG23  THR  92          HG23      THR  92  16.364  11.989   2.435

  No H/Q in entry =           7
  In of MODEL   79
    1    H    GLU  93           H        GLU  93  13.181  11.361   3.769
    2    HA   GLU  93           HA       GLU  93  13.771  14.123   3.883
    3    HB2  GLU  93           HB2      GLU  93  11.069  12.745   3.912
    4    HB3  GLU  93           HB3      GLU  93  11.352  14.446   3.540
    5    HG2  GLU  93           HG2      GLU  93  12.684  12.207   2.002
    6    HG3  GLU  93           HG3      GLU  93  11.134  12.888   1.525

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LEU  94           H        LEU  94  12.045  11.961   6.102
    2    HA   LEU  94           HA       LEU  94  11.243  13.904   7.985
    3    HB2  LEU  94           HB2      LEU  94  11.827  10.950   8.253
    4    HB3  LEU  94           HB3      LEU  94  11.261  11.923   9.607
    5    HG   LEU  94           HG       LEU  94   9.761  11.975   6.988
    6   HD11  LEU  94          HD11      LEU  94   9.860   9.752   8.989
    7   HD13  LEU  94          HD12      LEU  94   9.548   9.691   7.256
    8   HD12  LEU  94          HD13      LEU  94   8.275  10.205   8.362
    9   HD23  LEU  94          HD21      LEU  94   7.851  12.369   8.600
   10   HD22  LEU  94          HD22      LEU  94   9.087  13.625   8.631
   11   HD21  LEU  94          HD23      LEU  94   9.035  12.407   9.904

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  95           H        ILE  95  14.219  11.980   7.728
    2    HA   ILE  95           HA       ILE  95  15.400  12.902  10.136
    3    HB   ILE  95           HB       ILE  95  16.625  11.838   7.579
    4   HG12  ILE  95          HG12      ILE  95  16.349  10.634  10.347
    5   HG13  ILE  95          HG13      ILE  95  15.175  10.375   9.059
    6   HG21  ILE  95          HG21      ILE  95  17.895  12.644  10.215
    7   HG23  ILE  95          HG22      ILE  95  18.347  13.175   8.593
    8   HG22  ILE  95          HG23      ILE  95  18.659  11.515   9.098
    9   HD13  ILE  95          HD11      ILE  95  16.649   9.100   7.786
   10   HD12  ILE  95          HD12      ILE  95  17.133   8.650   9.418
   11   HD11  ILE  95          HD13      ILE  95  18.078   9.833   8.515

  No H/Q in entry =          11
  In of MODEL   79
    1    H    GLU  96           H        GLU  96  15.532  14.139   6.802
    2    HA   GLU  96           HA       GLU  96  17.378  16.221   7.270
    3    HB2  GLU  96           HB2      GLU  96  16.700  15.560   5.014
    4    HB3  GLU  96           HB3      GLU  96  15.058  16.113   5.325
    5    HG2  GLU  96           HG2      GLU  96  15.617  18.244   4.782
    6    HG3  GLU  96           HG3      GLU  96  16.923  18.246   5.956

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LEU  97           H        LEU  97  13.869  16.027   7.721
    2    HA   LEU  97           HA       LEU  97  13.452  18.759   8.368
    3    HB2  LEU  97           HB2      LEU  97  11.942  16.230   8.989
    4    HB3  LEU  97           HB3      LEU  97  11.431  17.775   9.665
    5    HG   LEU  97           HG       LEU  97  11.896  17.363   6.697
    6   HD12  LEU  97          HD11      LEU  97   9.372  17.231   6.594
    7   HD11  LEU  97          HD12      LEU  97   9.377  17.029   8.345
    8   HD13  LEU  97          HD13      LEU  97  10.153  15.824   7.316
    9   HD23  LEU  97          HD21      LEU  97  10.154  19.324   6.742
   10   HD22  LEU  97          HD22      LEU  97  11.838  19.686   7.125
   11   HD21  LEU  97          HD23      LEU  97  10.657  19.512   8.422

  No H/Q in entry =          11
  In of MODEL   79
    1    H    HIS  98           H        HIS  98  14.291  15.932  10.356
    2    HA   HIS  98           HA       HIS  98  14.147  17.190  12.874
    3    HB2  HIS  98           HB2      HIS  98  15.894  14.937  11.859
    4    HB3  HIS  98           HB3      HIS  98  15.902  15.474  13.540
    5    HD1  HIS  98           HD1      HIS  98  13.690  13.843  10.960
    6    HD2  HIS  98           HD2      HIS  98  13.607  14.758  15.027
    7    HE1  HIS  98           HE1      HIS  98  11.673  12.644  11.924
    8    HE2  HIS  98           HE2      HIS  98  11.602  13.193  14.397

  No H/Q in entry =           8
  In of MODEL   79
    1    H    GLU  99           H        GLU  99  16.685  17.082  10.423
    2    HA   GLU  99           HA       GLU  99  18.678  18.415  11.941
    3    HB2  GLU  99           HB2      GLU  99  19.146  17.131   9.867
    4    HB3  GLU  99           HB3      GLU  99  18.329  18.385   8.933
    5    HG2  GLU  99           HG2      GLU  99  19.939  20.057   9.715
    6    HG3  GLU  99           HG3      GLU  99  20.726  18.855  10.732

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LYS 100           H        LYS 100  16.138  19.576   9.742
    2    HA   LYS 100           HA       LYS 100  16.933  22.314   9.884
    3    HB2  LYS 100           HB2      LYS 100  14.297  21.022   9.145
    4    HB3  LYS 100           HB3      LYS 100  14.594  22.761   9.054
    5    HG2  LYS 100           HG2      LYS 100  16.557  22.317   7.575
    6    HG3  LYS 100           HG3      LYS 100  16.146  20.600   7.593
    7    HD2  LYS 100           HD2      LYS 100  13.944  21.107   6.607
    8    HD3  LYS 100           HD3      LYS 100  14.338  22.827   6.596
    9    HE2  LYS 100           HE2      LYS 100  16.288  22.351   5.123
   10    HE3  LYS 100           HE3      LYS 100  15.825  20.645   5.091
   11    HZ1  LYS 100           HZ1      LYS 100  13.992  22.837   4.270
   12    HZ3  LYS 100           HZ2      LYS 100  13.808  21.167   4.007
   13    HZ2  LYS 100           HZ3      LYS 100  15.013  22.032   3.180

  No H/Q in entry =          13
  In of MODEL   79
    1    H    LEU 101           H        LEU 101  14.851  20.263  11.860
    2    HA   LEU 101           HA       LEU 101  13.692  22.328  13.448
    3    HB2  LEU 101           HB2      LEU 101  14.140  19.378  13.826
    4    HB3  LEU 101           HB3      LEU 101  13.612  20.356  15.191
    5    HG   LEU 101           HG       LEU 101  12.176  20.446  12.531
    6   HD12  LEU 101          HD11      LEU 101  10.527  18.879  13.809
    7   HD11  LEU 101          HD12      LEU 101  11.929  18.466  14.794
    8   HD13  LEU 101          HD13      LEU 101  11.951  18.162  13.057
    9   HD21  LEU 101          HD21      LEU 101  11.537  21.235  15.389
   10   HD23  LEU 101          HD22      LEU 101  10.268  21.010  14.186
   11   HD22  LEU 101          HD23      LEU 101  11.500  22.246  13.942

  No H/Q in entry =          11
  In of MODEL   79
    1    H    LYS 102           H        LYS 102  16.837  21.724  12.991
    2    HA   LYS 102           HA       LYS 102  18.690  22.596  14.053
    3    HB2  LYS 102           HB2      LYS 102  16.881  24.107  15.199
    4    HB3  LYS 102           HB3      LYS 102  17.098  23.043  16.574
    5    HG2  LYS 102           HG2      LYS 102  18.982  25.058  15.395
    6    HG3  LYS 102           HG3      LYS 102  18.611  24.741  17.076
    7    HD2  LYS 102           HD2      LYS 102  20.269  22.832  15.377
    8    HD3  LYS 102           HD3      LYS 102  20.963  24.154  16.307
    9    HE2  LYS 102           HE2      LYS 102  20.574  21.603  17.275
   10    HE3  LYS 102           HE3      LYS 102  20.797  23.044  18.267
   11    HZ2  LYS 102           HZ1      LYS 102  18.834  21.758  18.896
   12    HZ1  LYS 102           HZ2      LYS 102  18.179  21.989  17.351
   13    HZ3  LYS 102           HZ3      LYS 102  18.415  23.318  18.377

  No H/Q in entry =          13
  In of MODEL   79
    1    H    ALA 103           H        ALA 103  16.635  20.985  16.486
    2    HA   ALA 103           HA       ALA 103  18.374  19.774  18.128
    3    HB2  ALA 103           HB1      ALA 103  16.792  17.765  18.130
    4    HB1  ALA 103           HB2      ALA 103  15.887  18.619  16.879
    5    HB3  ALA 103           HB3      ALA 103  16.075  19.338  18.477

  No H/Q in entry =           5
  In of MODEL   79
    1    H1   ALA   1           H3       ALA   1  -1.786  -7.046 -21.398
    2    H2   ALA   1           H2       ALA   1  -2.577  -8.483 -20.942
    3    H3   ALA   1           H1       ALA   1  -0.973  -8.531 -21.507
    4    HA   ALA   1           HA       ALA   1  -1.819  -8.998 -23.499
    5    HB1  ALA   1           HB1      ALA   1  -3.953  -9.718 -23.013
    6    HB2  ALA   1           HB2      ALA   1  -4.397  -8.206 -23.805
    7    HB3  ALA   1           HB3      ALA   1  -4.325  -8.289 -22.047

  No H/Q in entry =           7
  In of MODEL   79
    1    H    GLU   2           H        GLU   2  -2.662  -7.805 -25.481
    2    HA   GLU   2           HA       GLU   2  -1.270  -5.790 -26.365
    3    HB2  GLU   2           HB2      GLU   2  -4.279  -5.857 -26.663
    4    HB3  GLU   2           HB3      GLU   2  -3.165  -4.993 -27.719
    5    HG2  GLU   2           HG2      GLU   2  -2.668  -6.880 -28.880
    6    HG3  GLU   2           HG3      GLU   2  -2.361  -7.788 -27.405

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLU   3           H        GLU   3  -4.425  -4.535 -25.443
    2    HA   GLU   3           HA       GLU   3  -3.376  -1.980 -24.817
    3    HB2  GLU   3           HB2      GLU   3  -6.061  -3.296 -24.471
    4    HB3  GLU   3           HB3      GLU   3  -5.759  -1.681 -23.824
    5    HG2  GLU   3           HG2      GLU   3  -5.417  -0.751 -25.950
    6    HG3  GLU   3           HG3      GLU   3  -5.026  -2.305 -26.680

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LEU   4           H        LEU   4  -4.951  -4.342 -22.631
    2    HA   LEU   4           HA       LEU   4  -4.573  -3.118 -20.241
    3    HB2  LEU   4           HB2      LEU   4  -4.031  -6.058 -20.718
    4    HB3  LEU   4           HB3      LEU   4  -4.428  -5.314 -19.170
    5    HG   LEU   4           HG       LEU   4  -6.216  -5.385 -21.624
    6   HD13  LEU   4          HD11      LEU   4  -7.402  -7.104 -20.621
    7   HD12  LEU   4          HD12      LEU   4  -6.907  -6.647 -18.992
    8   HD11  LEU   4          HD13      LEU   4  -5.778  -7.488 -20.052
    9   HD23  LEU   4          HD21      LEU   4  -7.889  -4.577 -19.744
   10   HD22  LEU   4          HD22      LEU   4  -6.856  -3.404 -20.559
   11   HD21  LEU   4          HD23      LEU   4  -6.420  -3.997 -18.957

  No H/Q in entry =          11
  In of MODEL   79
    1    H    GLU   5           H        GLU   5  -2.085  -4.957 -21.990
    2    HA   GLU   5           HA       GLU   5  -0.089  -4.676 -19.965
    3    HB2  GLU   5           HB2      GLU   5  -0.035  -6.443 -21.721
    4    HB3  GLU   5           HB3      GLU   5   0.274  -5.196 -22.930
    5    HG2  GLU   5           HG2      GLU   5   2.343  -4.560 -21.774
    6    HG3  GLU   5           HG3      GLU   5   2.034  -5.766 -20.527

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLU   6           H        GLU   6  -0.743  -2.958 -23.003
    2    HA   GLU   6           HA       GLU   6   1.428  -1.126 -22.746
    3    HB2  GLU   6           HB2      GLU   6   0.291  -1.603 -24.902
    4    HB3  GLU   6           HB3      GLU   6  -1.161  -0.814 -24.286
    5    HG2  GLU   6           HG2      GLU   6   0.089   1.285 -23.992
    6    HG3  GLU   6           HG3      GLU   6   1.552   0.502 -24.586

  No H/Q in entry =           6
  In of MODEL   79
    1    H    VAL   7           H        VAL   7  -1.904  -1.200 -21.680
    2    HA   VAL   7           HA       VAL   7  -2.121   1.511 -20.839
    3    HB   VAL   7           HB       VAL   7  -3.577  -1.008 -19.997
    4   HG11  VAL   7          HG11      VAL   7  -3.948   1.879 -19.176
    5   HG13  VAL   7          HG12      VAL   7  -3.842   0.453 -18.144
    6   HG12  VAL   7          HG13      VAL   7  -5.280   0.724 -19.127
    7   HG21  VAL   7          HG21      VAL   7  -3.749   0.072 -22.383
    8   HG23  VAL   7          HG22      VAL   7  -4.690   1.319 -21.563
    9   HG22  VAL   7          HG23      VAL   7  -5.235  -0.358 -21.536

  No H/Q in entry =           9
  In of MODEL   79
    1    H    VAL   8           H        VAL   8  -1.122  -1.476 -19.206
    2    HA   VAL   8           HA       VAL   8  -0.788  -0.400 -16.611
    3    HB   VAL   8           HB       VAL   8   0.482  -2.749 -18.023
    4   HG12  VAL   8          HG11      VAL   8   1.155  -3.341 -15.575
    5   HG11  VAL   8          HG12      VAL   8   0.992  -1.610 -15.279
    6   HG13  VAL   8          HG13      VAL   8   2.156  -2.196 -16.466
    7   HG22  VAL   8          HG21      VAL   8  -1.481  -3.730 -17.393
    8   HG21  VAL   8          HG22      VAL   8  -1.967  -2.276 -16.526
    9   HG23  VAL   8          HG23      VAL   8  -0.997  -3.499 -15.714

  No H/Q in entry =           9
  In of MODEL   79
    1    H    MET   9           H        MET   9   1.443  -0.696 -19.373
    2    HA   MET   9           HA       MET   9   3.737   0.345 -18.124
    3    HB2  MET   9           HB2      MET   9   2.766   0.324 -20.974
    4    HB3  MET   9           HB3      MET   9   4.249   1.170 -20.536
    5    HG2  MET   9           HG2      MET   9   4.943  -1.023 -19.369
    6    HG3  MET   9           HG3      MET   9   3.629  -1.774 -20.277
    7    HE2  MET   9           HE1      MET   9   3.558  -0.546 -23.184
    8    HE1  MET   9           HE2      MET   9   3.416  -2.160 -22.495
    9    HE3  MET   9           HE3      MET   9   4.548  -1.868 -23.812

  No H/Q in entry =           9
  In of MODEL   79
    1    H    GLY  10           H        GLY  10   1.043   1.950 -19.782
    2    HA3  GLY  10           HA2      GLY  10   2.009   4.603 -19.539
    3    HA2  GLY  10           HA3      GLY  10   0.318   4.144 -19.734

  No H/Q in entry =           3
  In of MODEL   79
    1    H    LEU  11           H        LEU  11  -0.067   2.613 -17.448
    2    HA   LEU  11           HA       LEU  11  -0.584   4.587 -15.482
    3    HB2  LEU  11           HB2      LEU  11  -0.517   1.571 -15.331
    4    HB3  LEU  11           HB3      LEU  11  -1.017   2.592 -13.984
    5    HG   LEU  11           HG       LEU  11  -2.274   2.711 -16.738
    6   HD13  LEU  11          HD11      LEU  11  -2.854   0.567 -15.983
    7   HD12  LEU  11          HD12      LEU  11  -4.200   1.559 -15.427
    8   HD11  LEU  11          HD13      LEU  11  -2.937   1.076 -14.296
    9   HD22  LEU  11          HD21      LEU  11  -2.856   4.726 -15.724
   10   HD21  LEU  11          HD22      LEU  11  -2.771   4.057 -14.095
   11   HD23  LEU  11          HD23      LEU  11  -4.153   3.694 -15.129

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  12           H        ILE  12   1.956   2.119 -15.745
    2    HA   ILE  12           HA       ILE  12   3.178   2.651 -13.249
    3    HB   ILE  12           HB       ILE  12   4.415   1.614 -15.822
    4   HG12  ILE  12          HG12      ILE  12   2.409   0.381 -14.673
    5   HG13  ILE  12          HG13      ILE  12   3.808  -0.555 -15.157
    6   HG21  ILE  12          HG21      ILE  12   5.407   1.558 -12.952
    7   HG23  ILE  12          HG22      ILE  12   6.178   2.346 -14.330
    8   HG22  ILE  12          HG23      ILE  12   6.098   0.587 -14.251
    9   HD13  ILE  12          HD11      ILE  12   4.632  -0.553 -12.877
   10   HD12  ILE  12          HD12      ILE  12   2.953  -1.091 -12.868
   11   HD11  ILE  12          HD13      ILE  12   3.354   0.541 -12.380

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  13           H        ILE  13   3.759   3.920 -16.508
    2    HA   ILE  13           HA       ILE  13   5.903   5.637 -15.795
    3    HB   ILE  13           HB       ILE  13   3.856   5.721 -18.027
    4   HG12  ILE  13          HG12      ILE  13   5.637   3.861 -17.812
    5   HG13  ILE  13          HG13      ILE  13   5.492   4.683 -19.361
    6   HG22  ILE  13          HG21      ILE  13   5.744   7.265 -19.060
    7   HG21  ILE  13          HG22      ILE  13   6.091   7.624 -17.372
    8   HG23  ILE  13          HG23      ILE  13   4.492   7.962 -18.031
    9   HD11  ILE  13          HD11      ILE  13   7.399   5.938 -17.464
   10   HD13  ILE  13          HD12      ILE  13   7.553   5.635 -19.190
   11   HD12  ILE  13          HD13      ILE  13   7.853   4.336 -18.042

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ASN  14           H        ASN  14   2.395   6.135 -16.037
    2    HA   ASN  14           HA       ASN  14   2.359   8.880 -15.396
    3    HB2  ASN  14           HB2      ASN  14   0.459   7.241 -16.216
    4    HB3  ASN  14           HB3      ASN  14   0.149   7.060 -14.493
    5   HD21  ASN  14          HD21      ASN  14  -1.879   8.221 -15.910
    6   HD22  ASN  14          HD22      ASN  14  -1.938   9.894 -15.639

  No H/Q in entry =           6
  In of MODEL   79
    1    H    SER  15           H        SER  15   2.076   6.000 -13.322
    2    HA   SER  15           HA       SER  15   1.787   7.366 -10.869
    3    HB2  SER  15           HB2      SER  15   2.337   5.279  -9.827
    4    HB3  SER  15           HB3      SER  15   1.505   4.861 -11.320
    5    HG   SER  15           HG       SER  15   3.397   4.313 -12.243

  No H/Q in entry =           5
  In of MODEL   79
    1    H    GLY  16           H        GLY  16   4.650   6.271 -12.650
    2    HA3  GLY  16           HA2      GLY  16   6.589   7.023 -10.732
    3    HA2  GLY  16           HA3      GLY  16   6.880   6.823 -12.458

  No H/Q in entry =           3
  In of MODEL   79
    1    H    GLN  17           H        GLN  17   5.184   8.783 -13.505
    2    HA   GLN  17           HA       GLN  17   6.764  11.124 -13.205
    3    HB2  GLN  17           HB2      GLN  17   4.010  10.688 -14.391
    4    HB3  GLN  17           HB3      GLN  17   4.855  12.235 -14.456
    5    HG2  GLN  17           HG2      GLN  17   6.719  11.208 -15.656
    6    HG3  GLN  17           HG3      GLN  17   5.953   9.624 -15.534
    7   HE21  GLN  17          HE21      GLN  17   6.361  12.185 -17.650
    8   HE22  GLN  17          HE22      GLN  17   4.986  11.950 -18.618

  No H/Q in entry =           8
  In of MODEL   79
    1    H    ALA  18           H        ALA  18   3.673  10.104 -11.835
    2    HA   ALA  18           HA       ALA  18   2.957  12.490 -10.561
    3    HB1  ALA  18           HB1      ALA  18   1.826  10.034 -10.779
    4    HB2  ALA  18           HB2      ALA  18   1.286  11.252  -9.626
    5    HB3  ALA  18           HB3      ALA  18   2.380   9.969  -9.106

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ARG  19           H        ARG  19   4.840   9.726  -9.299
    2    HA   ARG  19           HA       ARG  19   5.390  10.880  -6.779
    3    HB2  ARG  19           HB2      ARG  19   5.801   8.478  -7.313
    4    HB3  ARG  19           HB3      ARG  19   7.150   8.966  -8.343
    5    HG2  ARG  19           HG2      ARG  19   8.282  10.003  -6.426
    6    HG3  ARG  19           HG3      ARG  19   6.914   9.613  -5.386
    7    HD2  ARG  19           HD2      ARG  19   8.679   7.978  -5.043
    8    HD3  ARG  19           HD3      ARG  19   7.300   7.197  -5.820
    9    HE   ARG  19           HE       ARG  19   8.990   8.020  -7.878
   10   HH21  ARG  19          HH11      ARG  19  10.545   6.617  -8.741
   11   HH22  ARG  19          HH12      ARG  19  11.098   5.268  -7.812
   12   HH11  ARG  19          HH21      ARG  19   9.082   5.985  -5.103
   13   HH12  ARG  19          HH22      ARG  19  10.267   4.910  -5.751

  No H/Q in entry =          13
  In of MODEL   79
    1    H    SER  20           H        SER  20   7.186  10.916  -9.840
    2    HA   SER  20           HA       SER  20   9.435  12.332  -9.030
    3    HB2  SER  20           HB2      SER  20   9.454  11.460 -11.235
    4    HB3  SER  20           HB3      SER  20   7.949  12.274 -11.651
    5    HG   SER  20           HG       SER  20   9.012  14.215 -11.644

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LEU  21           H        LEU  21   6.327  13.600 -10.203
    2    HA   LEU  21           HA       LEU  21   6.995  16.346  -9.979
    3    HB2  LEU  21           HB2      LEU  21   4.381  14.847 -10.006
    4    HB3  LEU  21           HB3      LEU  21   4.433  16.593  -9.774
    5    HG   LEU  21           HG       LEU  21   5.749  15.183 -12.114
    6   HD11  LEU  21          HD11      LEU  21   2.997  16.412 -11.827
    7   HD13  LEU  21          HD12      LEU  21   3.403  14.775 -12.346
    8   HD12  LEU  21          HD13      LEU  21   3.765  16.146 -13.392
    9   HD22  LEU  21          HD21      LEU  21   6.749  17.285 -12.050
   10   HD21  LEU  21          HD22      LEU  21   5.362  18.054 -11.287
   11   HD23  LEU  21          HD23      LEU  21   5.319  17.676 -13.001

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ALA  22           H        ALA  22   5.502  14.050  -7.724
    2    HA   ALA  22           HA       ALA  22   4.910  15.854  -5.650
    3    HB3  ALA  22           HB1      ALA  22   4.152  13.461  -5.812
    4    HB2  ALA  22           HB2      ALA  22   4.751  13.931  -4.221
    5    HB1  ALA  22           HB3      ALA  22   5.768  12.976  -5.300

  No H/Q in entry =           5
  In of MODEL   79
    1    H    TYR  23           H        TYR  23   7.845  13.834  -6.112
    2    HA   TYR  23           HA       TYR  23   9.241  14.853  -3.868
    3    HB2  TYR  23           HB2      TYR  23  10.023  12.848  -5.036
    4    HB3  TYR  23           HB3      TYR  23  10.327  13.791  -6.495
    5    HD1  TYR  23           HD1      TYR  23  11.310  13.446  -2.909
    6    HD2  TYR  23           HD2      TYR  23  12.360  14.965  -6.789
    7    HE1  TYR  23           HE1      TYR  23  13.572  14.024  -2.071
    8    HE2  TYR  23           HE2      TYR  23  14.621  15.544  -5.950
    9    HH   TYR  23           HH       TYR  23  15.707  14.553  -2.761

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ALA  24           H        ALA  24   9.033  15.965  -7.231
    2    HA   ALA  24           HA       ALA  24  10.925  18.054  -6.995
    3    HB2  ALA  24           HB1      ALA  24  10.467  18.118  -9.200
    4    HB3  ALA  24           HB2      ALA  24   8.912  18.864  -8.829
    5    HB1  ALA  24           HB3      ALA  24   9.041  17.111  -8.962

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ALA  25           H        ALA  25   7.451  17.859  -6.350
    2    HA   ALA  25           HA       ALA  25   6.967  20.575  -5.773
    3    HB1  ALA  25           HB1      ALA  25   5.311  18.572  -5.966
    4    HB2  ALA  25           HB2      ALA  25   4.947  19.858  -4.813
    5    HB3  ALA  25           HB3      ALA  25   5.645  18.338  -4.249

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LEU  26           H        LEU  26   8.058  17.896  -3.735
    2    HA   LEU  26           HA       LEU  26   8.175  19.323  -1.296
    3    HB2  LEU  26           HB2      LEU  26   8.279  16.907  -1.295
    4    HB3  LEU  26           HB3      LEU  26   9.742  16.921  -2.276
    5    HG   LEU  26           HG       LEU  26  10.966  18.041  -0.443
    6   HD12  LEU  26          HD11      LEU  26   9.755  18.041   1.826
    7   HD11  LEU  26          HD12      LEU  26   8.262  17.899   0.901
    8   HD13  LEU  26          HD13      LEU  26   9.300  19.309   0.687
    9   HD21  LEU  26          HD21      LEU  26   9.447  15.566   0.438
   10   HD23  LEU  26          HD22      LEU  26  10.965  16.133   1.125
   11   HD22  LEU  26          HD23      LEU  26  10.910  15.576  -0.545

  No H/Q in entry =          11
  In of MODEL   79
    1    H    LYS  27           H        LYS  27  10.576  18.763  -3.839
    2    HA   LYS  27           HA       LYS  27  12.764  20.010  -2.624
    3    HB2  LYS  27           HB2      LYS  27  12.856  18.666  -4.717
    4    HB3  LYS  27           HB3      LYS  27  12.080  19.997  -5.575
    5    HG2  LYS  27           HG2      LYS  27  13.944  21.489  -5.008
    6    HG3  LYS  27           HG3      LYS  27  14.716  20.198  -4.079
    7    HD2  LYS  27           HD2      LYS  27  14.850  18.814  -6.136
    8    HD3  LYS  27           HD3      LYS  27  14.123  20.130  -7.057
    9    HE2  LYS  27           HE2      LYS  27  16.009  21.603  -6.456
   10    HE3  LYS  27           HE3      LYS  27  16.740  20.291  -5.525
   11    HZ3  LYS  27           HZ1      LYS  27  17.714  20.397  -7.718
   12    HZ2  LYS  27           HZ2      LYS  27  16.183  20.274  -8.449
   13    HZ1  LYS  27           HZ3      LYS  27  16.817  18.965  -7.570

  No H/Q in entry =          13
  In of MODEL   79
    1    H    GLN  28           H        GLN  28  10.123  21.384  -4.553
    2    HA   GLN  28           HA       GLN  28  11.070  24.041  -4.709
    3    HB2  GLN  28           HB2      GLN  28   8.241  22.961  -4.576
    4    HB3  GLN  28           HB3      GLN  28   8.647  24.634  -4.957
    5    HG2  GLN  28           HG2      GLN  28   9.629  22.218  -6.505
    6    HG3  GLN  28           HG3      GLN  28   8.298  23.260  -7.003
    7   HE21  GLN  28          HE21      GLN  28  11.458  22.751  -7.703
    8   HE22  GLN  28          HE22      GLN  28  11.939  24.331  -8.096

  No H/Q in entry =           8
  In of MODEL   79
    1    H    ALA  29           H        ALA  29   9.163  22.337  -2.261
    2    HA   ALA  29           HA       ALA  29   8.616  24.524  -0.573
    3    HB2  ALA  29           HB1      ALA  29   7.905  22.951   0.999
    4    HB1  ALA  29           HB2      ALA  29   9.128  21.772   0.523
    5    HB3  ALA  29           HB3      ALA  29   7.733  22.061  -0.515

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LYS  30           H        LYS  30  11.355  22.269  -0.664
    2    HA   LYS  30           HA       LYS  30  12.685  23.226   1.630
    3    HB2  LYS  30           HB2      LYS  30  13.770  21.948  -0.890
    4    HB3  LYS  30           HB3      LYS  30  14.761  22.310   0.526
    5    HG2  LYS  30           HG2      LYS  30  13.223  20.918   1.914
    6    HG3  LYS  30           HG3      LYS  30  12.330  20.495   0.450
    7    HD2  LYS  30           HD2      LYS  30  14.372  19.519  -0.527
    8    HD3  LYS  30           HD3      LYS  30  15.285  19.957   0.919
    9    HE2  LYS  30           HE2      LYS  30  13.796  18.517   2.282
   10    HE3  LYS  30           HE3      LYS  30  12.914  18.059   0.820
   11    HZ2  LYS  30           HZ1      LYS  30  14.718  16.488   1.566
   12    HZ1  LYS  30           HZ2      LYS  30  15.846  17.681   1.108
   13    HZ3  LYS  30           HZ3      LYS  30  14.805  16.994  -0.050

  No H/Q in entry =          13
  In of MODEL   79
    1    H    GLN  31           H        GLN  31  12.547  24.435  -1.664
    2    HA   GLN  31           HA       GLN  31  14.694  26.337  -1.255
    3    HB2  GLN  31           HB2      GLN  31  12.635  26.378  -3.465
    4    HB3  GLN  31           HB3      GLN  31  14.252  27.081  -3.477
    5    HG2  GLN  31           HG2      GLN  31  14.731  24.386  -2.908
    6    HG3  GLN  31           HG3      GLN  31  13.419  24.328  -4.078
    7   HE21  GLN  31          HE21      GLN  31  16.263  23.548  -4.503
    8   HE22  GLN  31          HE22      GLN  31  16.821  24.526  -5.772

  No H/Q in entry =           8
  In of MODEL   79
    1    H    GLY  32           H        GLY  32  11.629  26.139  -0.088
    2    HA3  GLY  32           HA2      GLY  32  10.475  27.700   1.195
    3    HA2  GLY  32           HA3      GLY  32  11.590  28.942   0.639

  No H/Q in entry =           3
  In of MODEL   79
    1    H    ASP  33           H        ASP  33  10.217  27.035  -1.846
    2    HA   ASP  33           HA       ASP  33   8.536  29.301  -2.687
    3    HB2  ASP  33           HB2      ASP  33   9.630  26.889  -4.140
    4    HB3  ASP  33           HB3      ASP  33   8.469  28.000  -4.861

  No H/Q in entry =           4
  In of MODEL   79
    1    H    PHE  34           H        PHE  34   6.861  28.815  -1.111
    2    HA   PHE  34           HA       PHE  34   5.494  26.336  -1.009
    3    HB2  PHE  34           HB2      PHE  34   4.525  29.118  -0.319
    4    HB3  PHE  34           HB3      PHE  34   3.686  27.623   0.096
    5    HD1  PHE  34           HD1      PHE  34   5.933  30.031   1.298
    6    HD2  PHE  34           HD2      PHE  34   5.273  25.787   1.244
    7    HE1  PHE  34           HE1      PHE  34   7.340  29.784   3.324
    8    HE2  PHE  34           HE2      PHE  34   6.681  25.544   3.268
    9    HZ   PHE  34           HZ       PHE  34   7.709  27.544   4.308

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ALA  35           H        ALA  35   5.036  29.201  -3.013
    2    HA   ALA  35           HA       ALA  35   2.480  28.576  -4.021
    3    HB3  ALA  35           HB1      ALA  35   3.511  29.976  -6.064
    4    HB2  ALA  35           HB2      ALA  35   4.736  30.341  -4.849
    5    HB1  ALA  35           HB3      ALA  35   3.045  30.742  -4.545

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ALA  36           H        ALA  36   5.702  27.920  -5.399
    2    HA   ALA  36           HA       ALA  36   4.704  26.489  -7.637
    3    HB3  ALA  36           HB1      ALA  36   6.858  26.625  -8.269
    4    HB2  ALA  36           HB2      ALA  36   7.354  25.596  -6.923
    5    HB1  ALA  36           HB3      ALA  36   7.241  27.343  -6.705

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ALA  37           H        ALA  37   5.688  25.495  -4.391
    2    HA   ALA  37           HA       ALA  37   5.639  22.707  -4.823
    3    HB2  ALA  37           HB1      ALA  37   5.387  24.494  -2.441
    4    HB1  ALA  37           HB2      ALA  37   6.524  23.182  -2.743
    5    HB3  ALA  37           HB3      ALA  37   4.868  22.819  -2.261

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LYS  38           H        LYS  38   3.104  24.901  -3.634
    2    HA   LYS  38           HA       LYS  38   1.015  23.078  -3.399
    3    HB2  LYS  38           HB2      LYS  38   1.356  25.835  -3.147
    4    HB3  LYS  38           HB3      LYS  38   0.148  25.684  -4.417
    5    HG2  LYS  38           HG2      LYS  38  -1.285  24.352  -2.966
    6    HG3  LYS  38           HG3      LYS  38  -0.032  24.296  -1.719
    7    HD2  LYS  38           HD2      LYS  38  -0.226  26.631  -1.267
    8    HD3  LYS  38           HD3      LYS  38  -1.149  26.917  -2.742
    9    HE2  LYS  38           HE2      LYS  38  -2.639  26.942  -0.792
   10    HE3  LYS  38           HE3      LYS  38  -3.014  25.565  -1.833
   11    HZ3  LYS  38           HZ1      LYS  38  -2.270  24.096  -0.307
   12    HZ2  LYS  38           HZ2      LYS  38  -2.619  25.350   0.786
   13    HZ1  LYS  38           HZ3      LYS  38  -1.027  25.107   0.249

  No H/Q in entry =          13
  In of MODEL   79
    1    H    ALA  39           H        ALA  39   1.965  24.989  -6.252
    2    HA   ALA  39           HA       ALA  39  -0.118  24.114  -7.941
    3    HB2  ALA  39           HB1      ALA  39   2.607  24.776  -9.014
    4    HB1  ALA  39           HB2      ALA  39   1.640  26.032  -8.240
    5    HB3  ALA  39           HB3      ALA  39   1.021  25.194  -9.663

  No H/Q in entry =           5
  In of MODEL   79
    1    H    MET  40           H        MET  40   3.130  22.830  -7.387
    2    HA   MET  40           HA       MET  40   3.028  20.812  -9.380
    3    HB2  MET  40           HB2      MET  40   4.657  21.040  -6.843
    4    HB3  MET  40           HB3      MET  40   4.905  19.787  -8.061
    5    HG2  MET  40           HG2      MET  40   4.943  22.744  -8.723
    6    HG3  MET  40           HG3      MET  40   6.397  21.848  -8.285
    7    HE3  MET  40           HE1      MET  40   7.260  19.641 -11.103
    8    HE2  MET  40           HE2      MET  40   6.710  19.316  -9.462
    9    HE1  MET  40           HE3      MET  40   7.796  20.670  -9.767

  No H/Q in entry =           9
  In of MODEL   79
    1    H    MET  41           H        MET  41   2.137  20.845  -5.950
    2    HA   MET  41           HA       MET  41   1.621  18.077  -5.672
    3    HB2  MET  41           HB2      MET  41   0.286  20.426  -4.308
    4    HB3  MET  41           HB3      MET  41   0.142  18.747  -3.801
    5    HG2  MET  41           HG2      MET  41   2.851  18.984  -3.858
    6    HG3  MET  41           HG3      MET  41   2.405  20.639  -3.456
    7    HE2  MET  41           HE1      MET  41  -0.616  19.368  -1.711
    8    HE1  MET  41           HE2      MET  41   0.191  20.886  -2.092
    9    HE3  MET  41           HE3      MET  41   0.146  20.313  -0.425

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ASP  42           H        ASP  42  -0.438  20.792  -6.627
    2    HA   ASP  42           HA       ASP  42  -2.873  19.419  -6.749
    3    HB2  ASP  42           HB2      ASP  42  -2.182  21.994  -7.007
    4    HB3  ASP  42           HB3      ASP  42  -2.343  21.600  -8.714

  No H/Q in entry =           4
  In of MODEL   79
    1    H    GLN  43           H        GLN  43  -0.453  20.026  -9.267
    2    HA   GLN  43           HA       GLN  43  -1.848  18.702 -11.348
    3    HB2  GLN  43           HB2      GLN  43   1.110  19.234 -10.987
    4    HB3  GLN  43           HB3      GLN  43   0.389  18.592 -12.465
    5    HG2  GLN  43           HG2      GLN  43  -1.134  20.611 -12.493
    6    HG3  GLN  43           HG3      GLN  43  -0.175  21.271 -11.171
    7   HE21  GLN  43          HE21      GLN  43  -0.037  22.895 -13.256
    8   HE22  GLN  43          HE22      GLN  43   1.372  22.682 -14.174

  No H/Q in entry =           8
  In of MODEL   79
    1    H    SER  44           H        SER  44   0.526  17.572  -8.976
    2    HA   SER  44           HA       SER  44   0.867  14.968 -10.007
    3    HB2  SER  44           HB2      SER  44   1.770  16.409  -7.775
    4    HB3  SER  44           HB3      SER  44   0.920  15.020  -7.100
    5    HG   SER  44           HG       SER  44   3.032  14.413  -7.543

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ARG  45           H        ARG  45  -1.443  16.271  -7.651
    2    HA   ARG  45           HA       ARG  45  -2.811  13.901  -7.009
    3    HB2  ARG  45           HB2      ARG  45  -3.014  16.067  -5.813
    4    HB3  ARG  45           HB3      ARG  45  -3.883  16.731  -7.193
    5    HG2  ARG  45           HG2      ARG  45  -5.637  14.994  -6.900
    6    HG3  ARG  45           HG3      ARG  45  -4.779  14.385  -5.483
    7    HD2  ARG  45           HD2      ARG  45  -4.991  16.649  -4.423
    8    HD3  ARG  45           HD3      ARG  45  -5.991  17.165  -5.797
    9    HE   ARG  45           HE       ARG  45  -7.080  14.781  -4.753
   10   HH21  ARG  45          HH11      ARG  45  -8.907  14.844  -3.469
   11   HH22  ARG  45          HH12      ARG  45  -9.305  16.281  -2.595
   12   HH11  ARG  45          HH21      ARG  45  -6.546  18.030  -3.728
   13   HH12  ARG  45          HH22      ARG  45  -7.962  18.085  -2.740

  No H/Q in entry =          13
  In of MODEL   79
    1    H    MET  46           H        MET  46  -3.428  16.306  -9.552
    2    HA   MET  46           HA       MET  46  -5.768  15.121 -10.599
    3    HB2  MET  46           HB2      MET  46  -3.694  16.989 -11.745
    4    HB3  MET  46           HB3      MET  46  -5.025  16.387 -12.739
    5    HG2  MET  46           HG2      MET  46  -6.661  17.383 -11.342
    6    HG3  MET  46           HG3      MET  46  -5.512  17.642 -10.035
    7    HE3  MET  46           HE1      MET  46  -4.009  18.268 -13.538
    8    HE2  MET  46           HE2      MET  46  -4.884  19.689 -14.099
    9    HE1  MET  46           HE3      MET  46  -5.750  18.176 -13.837

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ALA  47           H        ALA  47  -2.341  14.663 -11.382
    2    HA   ALA  47           HA       ALA  47  -2.692  12.936 -13.592
    3    HB3  ALA  47           HB1      ALA  47  -0.517  13.839 -13.254
    4    HB2  ALA  47           HB2      ALA  47  -0.363  12.111 -12.924
    5    HB1  ALA  47           HB3      ALA  47  -0.453  13.261 -11.589

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LEU  48           H        LEU  48  -2.394  12.298 -10.121
    2    HA   LEU  48           HA       LEU  48  -2.471   9.458 -10.283
    3    HB2  LEU  48           HB2      LEU  48  -3.232  11.368  -8.061
    4    HB3  LEU  48           HB3      LEU  48  -3.125   9.618  -7.863
    5    HG   LEU  48           HG       LEU  48  -0.844  11.333  -8.874
    6   HD13  LEU  48          HD11      LEU  48  -1.116  12.098  -6.681
    7   HD12  LEU  48          HD12      LEU  48   0.056  10.798  -6.492
    8   HD11  LEU  48          HD13      LEU  48  -1.637  10.524  -6.083
    9   HD22  LEU  48          HD21      LEU  48  -0.336   9.151  -9.522
   10   HD21  LEU  48          HD22      LEU  48  -1.192   8.429  -8.160
   11   HD23  LEU  48          HD23      LEU  48   0.378   9.192  -7.910

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ASN  49           H        ASN  49  -4.947  11.934  -9.860
    2    HA   ASN  49           HA       ASN  49  -7.119  10.255  -9.308
    3    HB2  ASN  49           HB2      ASN  49  -7.175  12.683  -8.986
    4    HB3  ASN  49           HB3      ASN  49  -7.054  12.936 -10.724
    5   HD21  ASN  49          HD21      ASN  49  -9.135  14.045 -10.738
    6   HD22  ASN  49          HD22      ASN  49 -10.586  13.182 -10.575

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLU  50           H        GLU  50  -5.868  11.464 -12.403
    2    HA   GLU  50           HA       GLU  50  -7.826  10.198 -14.036
    3    HB2  GLU  50           HB2      GLU  50  -6.377  12.027 -14.858
    4    HB3  GLU  50           HB3      GLU  50  -4.976  10.964 -14.731
    5    HG2  GLU  50           HG2      GLU  50  -5.951   9.424 -16.363
    6    HG3  GLU  50           HG3      GLU  50  -7.418  10.393 -16.439

  No H/Q in entry =           6
  In of MODEL   79
    1    H    ALA  51           H        ALA  51  -4.641   9.224 -12.854
    2    HA   ALA  51           HA       ALA  51  -4.496   6.774 -14.276
    3    HB2  ALA  51           HB1      ALA  51  -2.506   6.497 -13.190
    4    HB1  ALA  51           HB2      ALA  51  -3.185   6.913 -11.617
    5    HB3  ALA  51           HB3      ALA  51  -2.746   8.188 -12.753

  No H/Q in entry =           5
  In of MODEL   79
    1    H    HIS  52           H        HIS  52  -5.652   7.594 -11.018
    2    HA   HIS  52           HA       HIS  52  -6.315   4.979 -10.185
    3    HB2  HIS  52           HB2      HIS  52  -6.182   6.880  -8.638
    4    HB3  HIS  52           HB3      HIS  52  -7.584   7.618  -9.415
    5    HD1  HIS  52           HD1      HIS  52  -9.844   6.086  -9.338
    6    HD2  HIS  52           HD2      HIS  52  -6.842   5.094  -6.623
    7    HE1  HIS  52           HE1      HIS  52 -10.933   4.649  -7.558
    8    HE2  HIS  52           HE2      HIS  52  -9.114   4.036  -5.896

  No H/Q in entry =           8
  In of MODEL   79
    1    H    LEU  53           H        LEU  53  -8.162   7.428 -11.958
    2    HA   LEU  53           HA       LEU  53 -10.660   6.121 -11.955
    3    HB2  LEU  53           HB2      LEU  53  -9.401   8.111 -13.832
    4    HB3  LEU  53           HB3      LEU  53 -10.999   7.439 -14.141
    5    HG   LEU  53           HG       LEU  53 -10.273   8.750 -11.504
    6   HD12  LEU  53          HD11      LEU  53 -11.671  10.679 -12.506
    7   HD11  LEU  53          HD12      LEU  53 -11.327   9.938 -14.069
    8   HD13  LEU  53          HD13      LEU  53 -10.007  10.517 -13.055
    9   HD21  LEU  53          HD21      LEU  53 -12.842   7.884 -12.844
   10   HD23  LEU  53          HD22      LEU  53 -12.846   9.136 -11.606
   11   HD22  LEU  53          HD23      LEU  53 -12.295   7.519 -11.212

  No H/Q in entry =          11
  In of MODEL   79
    1    H    VAL  54           H        VAL  54  -7.923   5.943 -14.211
    2    HA   VAL  54           HA       VAL  54  -9.148   4.168 -16.048
    3    HB   VAL  54           HB       VAL  54  -6.239   4.690 -15.385
    4   HG12  VAL  54          HG11      VAL  54  -6.002   3.609 -17.777
    5   HG11  VAL  54          HG12      VAL  54  -7.523   2.819 -17.364
    6   HG13  VAL  54          HG13      VAL  54  -6.099   2.571 -16.355
    7   HG22  VAL  54          HG21      VAL  54  -7.027   6.630 -16.422
    8   HG21  VAL  54          HG22      VAL  54  -8.221   5.761 -17.383
    9   HG23  VAL  54          HG23      VAL  54  -6.517   5.691 -17.825

  No H/Q in entry =           9
  In of MODEL   79
    1    H    GLN  55           H        GLN  55  -7.127   3.629 -13.163
    2    HA   GLN  55           HA       GLN  55  -7.023   0.813 -13.423
    3    HB2  GLN  55           HB2      GLN  55  -5.463   1.716 -11.913
    4    HB3  GLN  55           HB3      GLN  55  -6.679   2.674 -11.074
    5    HG2  GLN  55           HG2      GLN  55  -7.349   0.911  -9.754
    6    HG3  GLN  55           HG3      GLN  55  -7.126  -0.273 -11.036
    7   HE21  GLN  55          HE21      GLN  55  -5.492  -1.714 -10.554
    8   HE22  GLN  55          HE22      GLN  55  -4.103  -1.356  -9.651

  No H/Q in entry =           8
  In of MODEL   79
    1    H    THR  56           H        THR  56  -9.356   2.961 -11.791
    2    HA   THR  56           HA       THR  56 -10.921   1.067 -10.493
    3    HB   THR  56           HB       THR  56 -12.002   3.473 -11.985
    4    HG1  THR  56           HG1      THR  56 -10.765   3.216  -9.452
    5   HG21  THR  56          HG21      THR  56 -13.341   1.506 -10.618
    6   HG23  THR  56          HG22      THR  56 -13.929   3.156 -10.832
    7   HG22  THR  56          HG23      THR  56 -13.075   2.706  -9.355

  No H/Q in entry =           7
  In of MODEL   79
    1    H    LYS  57           H        LYS  57 -11.151   2.153 -13.876
    2    HA   LYS  57           HA       LYS  57 -13.303   0.456 -14.618
    3    HB2  LYS  57           HB2      LYS  57 -12.447   2.413 -15.938
    4    HB3  LYS  57           HB3      LYS  57 -11.004   1.482 -16.317
    5    HG2  LYS  57           HG2      LYS  57 -12.261  -0.128 -17.569
    6    HG3  LYS  57           HG3      LYS  57 -13.792   0.527 -17.001
    7    HD2  LYS  57           HD2      LYS  57 -12.958   1.170 -19.393
    8    HD3  LYS  57           HD3      LYS  57 -13.632   2.434 -18.367
    9    HE2  LYS  57           HE2      LYS  57 -11.439   3.227 -17.757
   10    HE3  LYS  57           HE3      LYS  57 -10.654   1.831 -18.497
   11    HZ3  LYS  57           HZ1      LYS  57 -10.999   2.622 -20.588
   12    HZ2  LYS  57           HZ2      LYS  57 -10.827   4.092 -19.752
   13    HZ1  LYS  57           HZ3      LYS  57 -12.373   3.519 -20.163

  No H/Q in entry =          13
  In of MODEL   79
    1    H    LEU  58           H        LEU  58  -9.796   0.043 -14.584
    2    HA   LEU  58           HA       LEU  58  -9.799  -2.473 -15.876
    3    HB2  LEU  58           HB2      LEU  58  -7.760  -1.172 -14.079
    4    HB3  LEU  58           HB3      LEU  58  -7.497  -2.691 -14.936
    5    HG   LEU  58           HG       LEU  58  -8.273  -0.089 -16.292
    6   HD11  LEU  58          HD11      LEU  58  -5.616  -1.313 -15.619
    7   HD13  LEU  58          HD12      LEU  58  -6.119   0.375 -15.566
    8   HD12  LEU  58          HD13      LEU  58  -5.786  -0.392 -17.115
    9   HD22  LEU  58          HD21      LEU  58  -8.851  -1.653 -17.881
   10   HD21  LEU  58          HD22      LEU  58  -7.799  -2.896 -17.207
   11   HD23  LEU  58          HD23      LEU  58  -7.121  -1.617 -18.216

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  59           H        ILE  59 -10.605  -1.578 -12.619
    2    HA   ILE  59           HA       ILE  59 -10.233  -4.344 -11.676
    3    HB   ILE  59           HB       ILE  59  -9.790  -2.077 -10.278
    4   HG12  ILE  59          HG12      ILE  59 -11.148  -4.423  -8.935
    5   HG13  ILE  59          HG13      ILE  59  -9.516  -4.517  -9.547
    6   HG21  ILE  59          HG21      ILE  59 -12.338  -1.583 -10.520
    7   HG23  ILE  59          HG22      ILE  59 -11.606  -1.382  -8.945
    8   HG22  ILE  59          HG23      ILE  59 -12.546  -2.827  -9.310
    9   HD11  ILE  59          HD11      ILE  59 -10.430  -2.392  -7.627
   10   HD13  ILE  59          HD12      ILE  59  -8.772  -2.737  -8.105
   11   HD12  ILE  59          HD13      ILE  59  -9.662  -3.891  -7.110

  No H/Q in entry =          11
  In of MODEL   79
    1    H    GLU  60           H        GLU  60 -12.808  -2.042 -12.466
    2    HA   GLU  60           HA       GLU  60 -14.978  -3.571 -11.440
    3    HB2  GLU  60           HB2      GLU  60 -15.259  -1.221 -12.007
    4    HB3  GLU  60           HB3      GLU  60 -14.856  -1.543 -13.690
    5    HG2  GLU  60           HG2      GLU  60 -17.155  -2.993 -12.402
    6    HG3  GLU  60           HG3      GLU  60 -17.375  -1.365 -13.008

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLY  61           H        GLY  61 -13.325  -3.544 -14.566
    2    HA3  GLY  61           HA2      GLY  61 -15.030  -5.797 -15.447
    3    HA2  GLY  61           HA3      GLY  61 -14.198  -4.687 -16.529

  No H/Q in entry =           3
  In of MODEL   79
    1    H    ASP  62           H        ASP  62 -12.797  -6.129 -13.655
    2    HA   ASP  62           HA       ASP  62 -10.365  -6.799 -14.529
    3    HB2  ASP  62           HB2      ASP  62 -10.386  -8.666 -12.915
    4    HB3  ASP  62           HB3      ASP  62 -11.159  -7.229 -12.254

  No H/Q in entry =           4
  In of MODEL   79
    1    H    ALA  63           H        ALA  63  -9.280  -8.660 -15.464
    2    HA   ALA  63           HA       ALA  63 -10.501  -9.710 -17.808
    3    HB1  ALA  63           HB1      ALA  63  -8.120  -9.598 -17.773
    4    HB2  ALA  63           HB2      ALA  63  -8.481 -11.321 -17.681
    5    HB3  ALA  63           HB3      ALA  63  -8.026 -10.435 -16.225

  No H/Q in entry =           5
  In of MODEL   79
    1    H    GLY  64           H        GLY  64 -11.414 -11.653 -18.255
    2    HA3  GLY  64           HA2      GLY  64 -12.421 -13.697 -17.926
    3    HA2  GLY  64           HA3      GLY  64 -11.544 -13.841 -16.409

  No H/Q in entry =           3
  In of MODEL   79
    1    H    GLU  65           H        GLU  65 -14.301 -12.114 -17.882
    2    HA   GLU  65           HA       GLU  65 -15.447 -11.216 -15.498
    3    HB2  GLU  65           HB2      GLU  65 -16.722 -11.894 -18.146
    4    HB3  GLU  65           HB3      GLU  65 -17.581 -11.111 -16.817
    5    HG2  GLU  65           HG2      GLU  65 -15.980  -9.263 -16.829
    6    HG3  GLU  65           HG3      GLU  65 -15.047 -10.053 -18.098

  No H/Q in entry =           6
  In of MODEL   79
    1    H    GLY  66           H        GLY  66 -16.040 -14.165 -17.292
    2    HA3  GLY  66           HA2      GLY  66 -18.073 -15.266 -15.686
    3    HA2  GLY  66           HA3      GLY  66 -17.051 -16.145 -16.807

  No H/Q in entry =           3
  In of MODEL   79
    1    H    LYS  67           H        LYS  67 -14.577 -15.783 -15.658
    2    HA   LYS  67           HA       LYS  67 -14.767 -17.607 -13.409
    3    HB2  LYS  67           HB2      LYS  67 -12.452 -16.683 -15.105
    4    HB3  LYS  67           HB3      LYS  67 -12.301 -17.834 -13.770
    5    HG2  LYS  67           HG2      LYS  67 -13.972 -19.303 -14.835
    6    HG3  LYS  67           HG3      LYS  67 -14.137 -18.157 -16.164
    7    HD2  LYS  67           HD2      LYS  67 -11.768 -18.488 -16.756
    8    HD3  LYS  67           HD3      LYS  67 -11.592 -19.625 -15.417
    9    HE2  LYS  67           HE2      LYS  67 -13.306 -21.088 -16.420
   10    HE3  LYS  67           HE3      LYS  67 -13.501 -19.950 -17.753
   11    HZ3  LYS  67           HZ1      LYS  67 -11.696 -20.735 -18.754
   12    HZ2  LYS  67           HZ2      LYS  67 -11.745 -22.032 -17.659
   13    HZ1  LYS  67           HZ3      LYS  67 -10.769 -20.679 -17.336

  No H/Q in entry =          13
  In of MODEL   79
    1    H    MET  68           H        MET  68 -13.689 -17.440 -11.490
    2    HA   MET  68           HA       MET  68 -13.901 -15.000 -10.120
    3    HB2  MET  68           HB2      MET  68 -12.453 -17.542  -9.381
    4    HB3  MET  68           HB3      MET  68 -12.798 -16.219  -8.268
    5    HG2  MET  68           HG2      MET  68 -14.889 -17.767  -9.825
    6    HG3  MET  68           HG3      MET  68 -14.502 -18.019  -8.122
    7    HE2  MET  68           HE1      MET  68 -14.129 -14.997  -6.878
    8    HE1  MET  68           HE2      MET  68 -14.689 -16.588  -6.370
    9    HE3  MET  68           HE3      MET  68 -15.750 -15.192  -6.194

  No H/Q in entry =           9
  In of MODEL   79
    1    H    LYS  69           H        LYS  69 -11.388 -15.920 -12.201
    2    HA   LYS  69           HA       LYS  69  -9.290 -14.594 -10.700
    3    HB2  LYS  69           HB2      LYS  69  -9.311 -16.016 -13.359
    4    HB3  LYS  69           HB3      LYS  69  -7.872 -15.241 -12.694
    5    HG2  LYS  69           HG2      LYS  69  -8.046 -16.628 -10.666
    6    HG3  LYS  69           HG3      LYS  69  -9.507 -17.384 -11.298
    7    HD2  LYS  69           HD2      LYS  69  -8.207 -18.243 -13.230
    8    HD3  LYS  69           HD3      LYS  69  -6.746 -17.532 -12.544
    9    HE2  LYS  69           HE2      LYS  69  -8.481 -19.567 -11.116
   10    HE3  LYS  69           HE3      LYS  69  -7.009 -19.965 -11.999
   11    HZ1  LYS  69           HZ1      LYS  69  -6.525 -17.818 -10.231
   12    HZ3  LYS  69           HZ2      LYS  69  -5.798 -19.352 -10.270
   13    HZ2  LYS  69           HZ3      LYS  69  -7.222 -19.104  -9.374

  No H/Q in entry =          13
  In of MODEL   79
    1    H    VAL  70           H        VAL  70  -7.872 -12.928 -11.548
    2    HA   VAL  70           HA       VAL  70  -9.185 -11.060 -13.440
    3    HB   VAL  70           HB       VAL  70  -8.352  -9.211 -12.030
    4   HG11  VAL  70          HG11      VAL  70 -10.608 -10.589 -11.692
    5   HG13  VAL  70          HG12      VAL  70 -10.162  -9.290 -10.585
    6   HG12  VAL  70          HG13      VAL  70  -9.863 -10.971 -10.140
    7   HG22  VAL  70          HG21      VAL  70  -6.431 -10.261 -10.967
    8   HG21  VAL  70          HG22      VAL  70  -7.460 -11.486 -10.229
    9   HG23  VAL  70          HG23      VAL  70  -7.561  -9.811  -9.690

  No H/Q in entry =           9
  In of MODEL   79
    1    H    SER  71           H        SER  71  -7.600  -9.432 -14.285
    2    HA   SER  71           HA       SER  71  -5.403 -10.680 -15.551
    3    HB2  SER  71           HB2      SER  71  -6.560  -8.644 -16.415
    4    HB3  SER  71           HB3      SER  71  -5.861  -7.720 -15.087
    5    HG   SER  71           HG       SER  71  -3.796  -8.738 -15.966

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LEU  72           H        LEU  72  -3.329 -10.920 -14.967
    2    HA   LEU  72           HA       LEU  72  -2.593 -10.703 -12.260
    3    HB2  LEU  72           HB2      LEU  72  -0.953 -11.122 -14.754
    4    HB3  LEU  72           HB3      LEU  72  -0.281 -11.193 -13.129
    5    HG   LEU  72           HG       LEU  72  -2.633 -12.895 -14.013
    6   HD12  LEU  72          HD11      LEU  72  -0.963 -14.736 -14.191
    7   HD11  LEU  72          HD12      LEU  72   0.326 -13.560 -13.939
    8   HD13  LEU  72          HD13      LEU  72  -0.685 -13.465 -15.382
    9   HD22  LEU  72          HD21      LEU  72  -2.605 -12.902 -11.661
   10   HD21  LEU  72          HD22      LEU  72  -0.854 -12.787 -11.571
   11   HD23  LEU  72          HD23      LEU  72  -1.612 -14.304 -12.049

  No H/Q in entry =          11
  In of MODEL   79
    1    H    VAL  73           H        VAL  73  -1.904  -8.683 -15.044
    2    HA   VAL  73           HA       VAL  73   0.016  -6.975 -13.952
    3    HB   VAL  73           HB       VAL  73  -0.348  -5.596 -15.819
    4   HG13  VAL  73          HG11      VAL  73  -0.241  -7.131 -17.594
    5   HG12  VAL  73          HG12      VAL  73  -1.415  -8.216 -16.850
    6   HG11  VAL  73          HG13      VAL  73   0.221  -8.109 -16.202
    7   HG22  VAL  73          HG21      VAL  73  -2.662  -5.042 -15.605
    8   HG21  VAL  73          HG22      VAL  73  -3.152  -6.727 -15.768
    9   HG23  VAL  73          HG23      VAL  73  -2.514  -5.855 -17.163

  No H/Q in entry =           9
  In of MODEL   79
    1    H    LEU  74           H        LEU  74  -3.378  -7.107 -13.373
    2    HA   LEU  74           HA       LEU  74  -4.004  -4.454 -12.756
    3    HB2  LEU  74           HB2      LEU  74  -5.726  -6.127 -12.919
    4    HB3  LEU  74           HB3      LEU  74  -5.023  -7.049 -11.594
    5    HG   LEU  74           HG       LEU  74  -5.481  -5.169 -10.049
    6   HD11  LEU  74          HD11      LEU  74  -6.491  -3.922 -12.603
    7   HD13  LEU  74          HD12      LEU  74  -5.414  -3.226 -11.394
    8   HD12  LEU  74          HD13      LEU  74  -7.131  -3.421 -11.037
    9   HD21  LEU  74          HD21      LEU  74  -7.177  -7.030 -10.897
   10   HD23  LEU  74          HD22      LEU  74  -8.028  -5.613 -11.468
   11   HD22  LEU  74          HD23      LEU  74  -7.672  -5.775  -9.766

  No H/Q in entry =          11
  In of MODEL   79
    1    H    VAL  75           H        VAL  75  -2.938  -7.037 -10.602
    2    HA   VAL  75           HA       VAL  75  -2.733  -5.486  -8.258
    3    HB   VAL  75           HB       VAL  75  -1.227  -7.973  -9.058
    4   HG11  VAL  75          HG11      VAL  75  -1.432  -6.506  -6.390
    5   HG13  VAL  75          HG12      VAL  75   0.027  -6.756  -7.337
    6   HG12  VAL  75          HG13      VAL  75  -0.774  -8.127  -6.588
    7   HG21  VAL  75          HG21      VAL  75  -3.715  -7.379  -7.427
    8   HG23  VAL  75          HG22      VAL  75  -2.880  -8.931  -7.360
    9   HG22  VAL  75          HG23      VAL  75  -3.598  -8.380  -8.875

  No H/Q in entry =           9
  In of MODEL   79
    1    H    GLU  76           H        GLU  76  -0.336  -6.234 -10.810
    2    HA   GLU  76           HA       GLU  76   1.851  -4.878  -9.665
    3    HB2  GLU  76           HB2      GLU  76   1.994  -6.364 -11.672
    4    HB3  GLU  76           HB3      GLU  76   1.150  -5.143 -12.611
    5    HG2  GLU  76           HG2      GLU  76   2.983  -3.551 -12.248
    6    HG3  GLU  76           HG3      GLU  76   3.838  -4.708 -11.247

  No H/Q in entry =           6
  In of MODEL   79
    1    H    ALA  77           H        ALA  77  -0.700  -3.687 -11.838
    2    HA   ALA  77           HA       ALA  77   0.277  -1.036 -12.018
    3    HB3  ALA  77           HB1      ALA  77  -2.589  -2.002 -12.226
    4    HB1  ALA  77           HB2      ALA  77  -1.423  -1.993 -13.550
    5    HB2  ALA  77           HB3      ALA  77  -1.957  -0.472 -12.837

  No H/Q in entry =           5
  In of MODEL   79
    1    H    GLN  78           H        GLN  78  -1.971  -2.603  -9.795
    2    HA   GLN  78           HA       GLN  78  -2.780  -0.289  -8.388
    3    HB2  GLN  78           HB2      GLN  78  -3.881  -2.551  -8.296
    4    HB3  GLN  78           HB3      GLN  78  -2.534  -3.109  -7.306
    5    HG2  GLN  78           HG2      GLN  78  -3.043  -1.379  -5.633
    6    HG3  GLN  78           HG3      GLN  78  -4.389  -0.814  -6.620
    7   HE21  GLN  78          HE21      GLN  78  -6.204  -1.467  -5.392
    8   HE22  GLN  78          HE22      GLN  78  -6.480  -3.067  -4.894

  No H/Q in entry =           8
  In of MODEL   79
    1    H    LEU  79           H        LEU  79  -0.088  -2.532  -7.954
    2    HA   LEU  79           HA       LEU  79   0.898  -1.631  -5.502
    3    HB2  LEU  79           HB2      LEU  79   1.772  -3.635  -6.576
    4    HB3  LEU  79           HB3      LEU  79   2.405  -2.679  -7.913
    5    HG   LEU  79           HG       LEU  79   3.964  -1.532  -6.418
    6   HD13  LEU  79          HD11      LEU  79   2.970  -1.293  -4.345
    7   HD12  LEU  79          HD12      LEU  79   4.058  -2.637  -4.008
    8   HD11  LEU  79          HD13      LEU  79   2.353  -2.946  -4.328
    9   HD23  LEU  79          HD21      LEU  79   5.192  -3.674  -5.523
   10   HD22  LEU  79          HD22      LEU  79   4.977  -3.476  -7.259
   11   HD21  LEU  79          HD23      LEU  79   3.910  -4.552  -6.361

  No H/Q in entry =          11
  In of MODEL   79
    1    H    HIS  80           H        HIS  80   1.743  -0.508  -8.780
    2    HA   HIS  80           HA       HIS  80   3.545   1.489  -7.867
    3    HB2  HIS  80           HB2      HIS  80   2.244   0.789 -10.443
    4    HB3  HIS  80           HB3      HIS  80   2.830   2.444 -10.274
    5    HD1  HIS  80           HD1      HIS  80   5.227   2.759 -10.810
    6    HD2  HIS  80           HD2      HIS  80   4.438  -1.157  -9.616
    7    HE1  HIS  80           HE1      HIS  80   7.424   1.495 -10.990
    8    HE2  HIS  80           HE2      HIS  80   6.954  -0.895 -10.265

  No H/Q in entry =           8
  In of MODEL   79
    1    H    LEU  81           H        LEU  81   0.134   1.629  -8.827
    2    HA   LEU  81           HA       LEU  81  -0.156   4.420  -8.493
    3    HB2  LEU  81           HB2      LEU  81  -2.156   2.162  -8.404
    4    HB3  LEU  81           HB3      LEU  81  -2.619   3.862  -8.308
    5    HG   LEU  81           HG       LEU  81  -0.931   2.724 -10.554
    6   HD12  LEU  81          HD11      LEU  81  -3.173   3.030 -11.841
    7   HD11  LEU  81          HD12      LEU  81  -3.919   2.956 -10.245
    8   HD13  LEU  81          HD13      LEU  81  -2.971   1.595 -10.838
    9   HD23  LEU  81          HD21      LEU  81  -2.048   4.862 -11.644
   10   HD22  LEU  81          HD22      LEU  81  -0.627   5.041 -10.619
   11   HD21  LEU  81          HD23      LEU  81  -2.230   5.379  -9.969

  No H/Q in entry =          11
  In of MODEL   79
    1    H    MET  82           H        MET  82  -0.785   1.728  -6.242
    2    HA   MET  82           HA       MET  82  -1.836   3.306  -4.148
    3    HB2  MET  82           HB2      MET  82  -0.444   0.628  -4.197
    4    HB3  MET  82           HB3      MET  82  -1.019   1.349  -2.695
    5    HG2  MET  82           HG2      MET  82  -2.762   0.845  -5.127
    6    HG3  MET  82           HG3      MET  82  -2.669  -0.229  -3.733
    7    HE3  MET  82           HE1      MET  82  -4.387   1.407  -0.907
    8    HE2  MET  82           HE2      MET  82  -2.660   1.697  -1.101
    9    HE1  MET  82           HE3      MET  82  -3.340   0.135  -1.552

  No H/Q in entry =           9
  In of MODEL   79
    1    H    THR  83           H        THR  83   1.468   2.243  -4.857
    2    HA   THR  83           HA       THR  83   2.691   3.354  -2.563
    3    HB   THR  83           HB       THR  83   4.778   3.314  -4.048
    4    HG1  THR  83           HG1      THR  83   4.531   2.787  -6.071
    5   HG22  THR  83          HG21      THR  83   4.351   0.653  -4.379
    6   HG21  THR  83          HG22      THR  83   3.065   1.023  -3.232
    7   HG23  THR  83          HG23      THR  83   4.744   1.378  -2.821

  No H/Q in entry =           7
  In of MODEL   79
    1    H    SER  84           H        SER  84   2.293   4.633  -5.860
    2    HA   SER  84           HA       SER  84   3.618   7.082  -5.411
    3    HB2  SER  84           HB2      SER  84   1.543   6.237  -7.419
    4    HB3  SER  84           HB3      SER  84   2.210   7.869  -7.396
    5    HG   SER  84           HG       SER  84   3.598   5.403  -7.697

  No H/Q in entry =           5
  In of MODEL   79
    1    H    MET  85           H        MET  85   0.131   6.302  -5.220
    2    HA   MET  85           HA       MET  85  -0.745   8.906  -4.612
    3    HB2  MET  85           HB2      MET  85  -2.258   7.085  -5.274
    4    HB3  MET  85           HB3      MET  85  -1.957   6.283  -3.733
    5    HG2  MET  85           HG2      MET  85  -2.861   8.227  -2.525
    6    HG3  MET  85           HG3      MET  85  -3.125   9.062  -4.054
    7    HE1  MET  85           HE1      MET  85  -3.714   6.157  -1.875
    8    HE3  MET  85           HE2      MET  85  -3.936   5.065  -3.239
    9    HE2  MET  85           HE3      MET  85  -5.320   5.518  -2.249

  No H/Q in entry =           9
  In of MODEL   79
    1    H    LEU  86           H        LEU  86   0.204   6.248  -2.475
    2    HA   LEU  86           HA       LEU  86  -0.323   7.546  -0.029
    3    HB2  LEU  86           HB2      LEU  86   0.154   5.078  -0.428
    4    HB3  LEU  86           HB3      LEU  86   1.858   5.518  -0.532
    5    HG   LEU  86           HG       LEU  86   1.539   6.676   1.739
    6   HD11  LEU  86          HD11      LEU  86  -1.153   5.893   1.282
    7   HD13  LEU  86          HD12      LEU  86  -0.484   6.643   2.729
    8   HD12  LEU  86          HD13      LEU  86  -0.565   4.887   2.609
    9   HD23  LEU  86          HD21      LEU  86   1.129   3.680   1.861
   10   HD22  LEU  86          HD22      LEU  86   2.131   4.695   2.896
   11   HD21  LEU  86          HD23      LEU  86   2.624   4.375   1.234

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ALA  87           H        ALA  87   2.648   7.270  -1.936
    2    HA   ALA  87           HA       ALA  87   4.356   8.689  -0.220
    3    HB3  ALA  87           HB1      ALA  87   4.441   7.679  -2.928
    4    HB2  ALA  87           HB2      ALA  87   5.780   8.016  -1.835
    5    HB1  ALA  87           HB3      ALA  87   5.152   9.294  -2.874

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ARG  88           H        ARG  88   2.387   9.817  -2.928
    2    HA   ARG  88           HA       ARG  88   3.148  12.510  -2.813
    3    HB2  ARG  88           HB2      ARG  88   1.889  11.353  -4.664
    4    HB3  ARG  88           HB3      ARG  88   0.437  11.488  -3.672
    5    HG2  ARG  88           HG2      ARG  88   1.443  14.073  -3.592
    6    HG3  ARG  88           HG3      ARG  88   1.860  13.563  -5.226
    7    HD2  ARG  88           HD2      ARG  88  -0.285  13.633  -5.911
    8    HD3  ARG  88           HD3      ARG  88  -0.859  12.775  -4.480
    9    HE   ARG  88           HE       ARG  88  -1.065  15.553  -4.894
   10   HH21  ARG  88          HH11      ARG  88  -1.588  16.878  -3.152
   11   HH22  ARG  88          HH12      ARG  88  -1.280  16.340  -1.536
   12   HH11  ARG  88          HH21      ARG  88  -0.024  13.293  -2.528
   13   HH12  ARG  88          HH22      ARG  88  -0.412  14.305  -1.183

  No H/Q in entry =          13
  In of MODEL   79
    1    H    GLU  89           H        GLU  89   0.462  10.821  -1.159
    2    HA   GLU  89           HA       GLU  89  -0.649  13.127   0.055
    3    HB2  GLU  89           HB2      GLU  89  -1.757  10.882  -0.027
    4    HB3  GLU  89           HB3      GLU  89  -0.624  10.331   1.207
    5    HG2  GLU  89           HG2      GLU  89  -1.442  12.024   2.773
    6    HG3  GLU  89           HG3      GLU  89  -2.504  12.692   1.536

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LEU  90           H        LEU  90   1.819  10.844   1.212
    2    HA   LEU  90           HA       LEU  90   2.185  12.087   3.741
    3    HB2  LEU  90           HB2      LEU  90   3.955  10.322   2.051
    4    HB3  LEU  90           HB3      LEU  90   4.382  10.838   3.688
    5    HG   LEU  90           HG       LEU  90   1.749   9.483   3.041
    6   HD12  LEU  90          HD11      LEU  90   2.903   7.441   4.040
    7   HD11  LEU  90          HD12      LEU  90   4.421   8.303   3.790
    8   HD13  LEU  90          HD13      LEU  90   3.402   7.893   2.409
    9   HD22  LEU  90          HD21      LEU  90   1.494  10.403   5.166
   10   HD21  LEU  90          HD22      LEU  90   3.214  10.302   5.537
   11   HD23  LEU  90          HD23      LEU  90   2.214   8.851   5.590

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  91           H        ILE  91   3.768  12.479   0.605
    2    HA   ILE  91           HA       ILE  91   5.743  14.317   1.435
    3    HB   ILE  91           HB       ILE  91   4.417  13.825  -1.238
    4   HG12  ILE  91          HG12      ILE  91   7.257  13.346  -0.282
    5   HG13  ILE  91          HG13      ILE  91   5.981  12.144  -0.113
    6   HG22  ILE  91          HG21      ILE  91   6.631  15.180  -1.938
    7   HG21  ILE  91          HG22      ILE  91   6.328  15.978  -0.394
    8   HG23  ILE  91          HG23      ILE  91   5.097  16.004  -1.656
    9   HD13  ILE  91          HD11      ILE  91   5.795  11.823  -2.419
   10   HD12  ILE  91          HD12      ILE  91   7.529  12.072  -2.216
   11   HD11  ILE  91          HD13      ILE  91   6.511  13.392  -2.794

  No H/Q in entry =          11
  In of MODEL   79
    1    H    THR  92           H        THR  92   2.374  14.739   0.448
    2    HA   THR  92           HA       THR  92   2.338  17.562   0.391
    3    HB   THR  92           HB       THR  92   0.181  15.560   1.101
    4    HG1  THR  92           HG1      THR  92   0.474  15.384  -0.986
    5   HG22  THR  92          HG21      THR  92  -1.231  17.718   0.390
    6   HG21  THR  92          HG22      THR  92   0.163  18.547   1.080
    7   HG23  THR  92          HG23      THR  92  -0.769  17.421   2.066

  No H/Q in entry =           7
  In of MODEL   79
    1    H    GLU  93           H        GLU  93   1.813  15.257   3.045
    2    HA   GLU  93           HA       GLU  93   1.287  17.157   5.069
    3    HB2  GLU  93           HB2      GLU  93   2.610  14.436   5.294
    4    HB3  GLU  93           HB3      GLU  93   1.925  15.359   6.632
    5    HG2  GLU  93           HG2      GLU  93   0.300  14.579   4.202
    6    HG3  GLU  93           HG3      GLU  93   0.414  13.555   5.628

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LEU  94           H        LEU  94   4.291  15.686   3.899
    2    HA   LEU  94           HA       LEU  94   6.050  16.836   5.778
    3    HB2  LEU  94           HB2      LEU  94   6.437  15.874   2.944
    4    HB3  LEU  94           HB3      LEU  94   7.771  16.534   3.886
    5    HG   LEU  94           HG       LEU  94   6.045  14.332   5.029
    6   HD11  LEU  94          HD11      LEU  94   8.128  14.115   2.884
    7   HD13  LEU  94          HD12      LEU  94   6.686  13.136   3.153
    8   HD12  LEU  94          HD13      LEU  94   8.119  12.887   4.152
    9   HD23  LEU  94          HD21      LEU  94   8.243  13.800   6.167
   10   HD22  LEU  94          HD22      LEU  94   7.574  15.376   6.590
   11   HD21  LEU  94          HD23      LEU  94   8.906  15.261   5.439

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  95           H        ILE  95   4.888  18.008   2.637
    2    HA   ILE  95           HA       ILE  95   6.452  20.371   2.571
    3    HB   ILE  95           HB       ILE  95   3.802  19.680   1.280
    4   HG12  ILE  95          HG12      ILE  95   6.583  20.027   0.127
    5   HG13  ILE  95          HG13      ILE  95   5.942  18.472   0.644
    6   HG21  ILE  95          HG21      ILE  95   5.543  22.153   1.053
    7   HG23  ILE  95          HG22      ILE  95   3.820  22.080   1.419
    8   HG22  ILE  95          HG23      ILE  95   4.395  21.683  -0.201
    9   HD13  ILE  95          HD11      ILE  95   4.372  18.393  -1.076
   10   HD12  ILE  95          HD12      ILE  95   5.713  19.216  -1.871
   11   HD11  ILE  95          HD13      ILE  95   4.342  20.146  -1.269

  No H/Q in entry =          11
  In of MODEL   79
    1    H    GLU  96           H        GLU  96   3.213  19.707   3.885
    2    HA   GLU  96           HA       GLU  96   2.590  22.351   4.643
    3    HB2  GLU  96           HB2      GLU  96   0.921  20.563   4.663
    4    HB3  GLU  96           HB3      GLU  96   1.792  19.737   5.952
    5    HG2  GLU  96           HG2      GLU  96   0.778  21.015   7.529
    6    HG3  GLU  96           HG3      GLU  96   1.304  22.492   6.731

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LEU  97           H        LEU  97   4.450  19.804   6.254
    2    HA   LEU  97           HA       LEU  97   4.818  21.150   8.724
    3    HB2  LEU  97           HB2      LEU  97   6.353  18.987   7.298
    4    HB3  LEU  97           HB3      LEU  97   6.950  19.672   8.807
    5    HG   LEU  97           HG       LEU  97   4.142  18.571   8.512
    6   HD12  LEU  97          HD11      LEU  97   5.094  16.560   9.716
    7   HD11  LEU  97          HD12      LEU  97   6.702  17.196   9.364
    8   HD13  LEU  97          HD13      LEU  97   5.625  16.737   8.044
    9   HD23  LEU  97          HD21      LEU  97   4.611  18.275  11.073
   10   HD22  LEU  97          HD22      LEU  97   4.223  19.886  10.473
   11   HD21  LEU  97          HD23      LEU  97   5.897  19.451  10.807

  No H/Q in entry =          11
  In of MODEL   79
    1    H    HIS  98           H        HIS  98   6.670  21.175   5.687
    2    HA   HIS  98           HA       HIS  98   8.826  22.759   6.575
    3    HB2  HIS  98           HB2      HIS  98   7.517  22.504   3.857
    4    HB3  HIS  98           HB3      HIS  98   8.956  23.486   4.140
    5    HD1  HIS  98           HD1      HIS  98   7.754  19.912   4.163
    6    HD2  HIS  98           HD2      HIS  98  11.332  22.017   4.569
    7    HE1  HIS  98           HE1      HIS  98   9.612  18.187   4.092
    8    HE2  HIS  98           HE2      HIS  98  11.795  19.448   4.340

  No H/Q in entry =           8
  In of MODEL   79
    1    H    GLU  99           H        GLU  99   5.596  23.588   5.421
    2    HA   GLU  99           HA       GLU  99   5.968  26.403   5.364
    3    HB2  GLU  99           HB2      GLU  99   4.084  25.231   4.243
    4    HB3  GLU  99           HB3      GLU  99   3.399  24.866   5.826
    5    HG2  GLU  99           HG2      GLU  99   3.216  27.257   6.331
    6    HG3  GLU  99           HG3      GLU  99   3.982  27.661   4.798

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LYS 100           H        LYS 100   4.857  24.162   7.890
    2    HA   LYS 100           HA       LYS 100   4.278  26.213   9.790
    3    HB2  LYS 100           HB2      LYS 100   4.861  23.262  10.128
    4    HB3  LYS 100           HB3      LYS 100   4.420  24.332  11.465
    5    HG2  LYS 100           HG2      LYS 100   2.345  24.967  10.230
    6    HG3  LYS 100           HG3      LYS 100   2.767  23.801   8.973
    7    HD2  LYS 100           HD2      LYS 100   2.703  21.978  10.633
    8    HD3  LYS 100           HD3      LYS 100   2.298  23.138  11.900
    9    HE2  LYS 100           HE2      LYS 100   0.236  23.757  10.650
   10    HE3  LYS 100           HE3      LYS 100   0.632  22.539   9.430
   11    HZ1  LYS 100           HZ1      LYS 100   0.384  21.868  12.312
   12    HZ3  LYS 100           HZ2      LYS 100   0.363  20.816  10.976
   13    HZ2  LYS 100           HZ3      LYS 100  -0.953  21.852  11.265

  No H/Q in entry =          13
  In of MODEL   79
    1    H    LEU 101           H        LEU 101   7.200  24.424   8.936
    2    HA   LEU 101           HA       LEU 101   8.810  25.264  11.131
    3    HB2  LEU 101           HB2      LEU 101   9.389  24.282   8.348
    4    HB3  LEU 101           HB3      LEU 101  10.696  24.949   9.323
    5    HG   LEU 101           HG       LEU 101   8.875  22.788  10.394
    6   HD12  LEU 101          HD11      LEU 101  10.928  21.297   9.772
    7   HD11  LEU 101          HD12      LEU 101  11.285  22.563   8.599
    8   HD13  LEU 101          HD13      LEU 101   9.757  21.687   8.513
    9   HD21  LEU 101          HD21      LEU 101  11.601  23.900  11.107
   10   HD23  LEU 101          HD22      LEU 101  11.064  22.326  11.688
   11   HD22  LEU 101          HD23      LEU 101  10.172  23.780  12.134

  No H/Q in entry =          11
  In of MODEL   79
    1    H    LYS 102           H        LYS 102   7.210  27.128   9.002
    2    HA   LYS 102           HA       LYS 102   7.282  29.421   8.713
    3    HB2  LYS 102           HB2      LYS 102   8.859  29.306  10.802
    4    HB3  LYS 102           HB3      LYS 102  10.152  29.504   9.635
    5    HG2  LYS 102           HG2      LYS 102   8.048  31.453  10.512
    6    HG3  LYS 102           HG3      LYS 102   9.759  31.716  10.250
    7    HD2  LYS 102           HD2      LYS 102   7.794  31.292   7.962
    8    HD3  LYS 102           HD3      LYS 102   8.179  32.872   8.630
    9    HE2  LYS 102           HE2      LYS 102   9.541  31.692   6.547
   10    HE3  LYS 102           HE3      LYS 102  10.162  32.999   7.556
   11    HZ2  LYS 102           HZ1      LYS 102  11.684  31.097   7.369
   12    HZ1  LYS 102           HZ2      LYS 102  10.528  30.111   8.117
   13    HZ3  LYS 102           HZ3      LYS 102  11.223  31.398   8.974

  No H/Q in entry =          13
  In of MODEL   79
    1    H    ALA 103           H        ALA 103  10.538  28.088   8.127
    2    HA   ALA 103           HA       ALA 103  11.487  29.469   6.047
    3    HB2  ALA 103           HB1      ALA 103  12.370  27.258   5.111
    4    HB1  ALA 103           HB2      ALA 103  11.484  26.480   6.422
    5    HB3  ALA 103           HB3      ALA 103  12.774  27.626   6.789

  No H/Q in entry =           5
  In of MODEL   79
    1    H1   LYS   3           H1       LYS   3 -30.949   5.870 -20.121
    2    H2   LYS   3           H3       LYS   3 -29.936   5.550 -21.446
    3    H3   LYS   3           H2       LYS   3 -31.333   4.619 -21.202
    4    HA   LYS   3           HA       LYS   3 -30.356   3.264 -19.747
    5    HB2  LYS   3           HB2      LYS   3 -28.051   4.647 -21.071
    6    HB3  LYS   3           HB3      LYS   3 -27.748   3.468 -19.794
    7    HG2  LYS   3           HG2      LYS   3 -29.145   1.850 -21.131
    8    HG3  LYS   3           HG3      LYS   3 -29.077   3.019 -22.449
    9    HD2  LYS   3           HD2      LYS   3 -26.595   2.908 -22.352
   10    HD3  LYS   3           HD3      LYS   3 -26.736   1.639 -21.137
   11    HE2  LYS   3           HE2      LYS   3 -28.202   0.421 -22.851
   12    HE3  LYS   3           HE3      LYS   3 -27.562   1.572 -24.024
   13    HZ3  LYS   3           HZ1      LYS   3 -25.758   0.339 -24.231
   14    HZ2  LYS   3           HZ2      LYS   3 -26.407  -0.804 -23.155
   15    HZ1  LYS   3           HZ3      LYS   3 -25.429   0.454 -22.570

  No H/Q in entry =          15
  In of MODEL   79
    1    H    LYS   4           H        LYS   4 -30.446   3.171 -17.684
    2    HA   LYS   4           HA       LYS   4 -29.745   5.496 -16.076
    3    HB2  LYS   4           HB2      LYS   4 -30.960   2.821 -15.334
    4    HB3  LYS   4           HB3      LYS   4 -30.758   4.186 -14.236
    5    HG2  LYS   4           HG2      LYS   4 -32.522   4.066 -16.688
    6    HG3  LYS   4           HG3      LYS   4 -33.043   4.156 -15.006
    7    HD2  LYS   4           HD2      LYS   4 -32.351   6.384 -14.781
    8    HD3  LYS   4           HD3      LYS   4 -31.286   6.292 -16.183
    9    HE2  LYS   4           HE2      LYS   4 -33.202   7.655 -16.713
   10    HE3  LYS   4           HE3      LYS   4 -33.265   6.161 -17.647
   11    HZ3  LYS   4           HZ1      LYS   4 -34.870   5.285 -16.107
   12    HZ2  LYS   4           HZ2      LYS   4 -35.413   6.767 -16.736
   13    HZ1  LYS   4           HZ3      LYS   4 -34.785   6.692 -15.160

  No H/Q in entry =          13
  In of MODEL   79
    1    H    HIS   5           H        HIS   5 -28.305   5.619 -14.460
    2    HA   HIS   5           HA       HIS   5 -26.020   3.780 -14.708
    3    HB2  HIS   5           HB2      HIS   5 -26.292   6.563 -13.571
    4    HB3  HIS   5           HB3      HIS   5 -24.812   5.608 -13.505
    5    HD1  HIS   5           HD1      HIS   5 -23.312   6.768 -15.097
    6    HD2  HIS   5           HD2      HIS   5 -27.086   6.115 -16.703
    7    HE1  HIS   5           HE1      HIS   5 -23.099   7.289 -17.557
    8    HE2  HIS   5           HE2      HIS   5 -25.401   6.880 -18.505

  No H/Q in entry =           8
  In of MODEL   79
    1    H    ILE   6           H        ILE   6 -25.818   2.239 -13.350
    2    HA   ILE   6           HA       ILE   6 -26.841   2.574 -10.611
    3    HB   ILE   6           HB       ILE   6 -25.994   0.070 -12.074
    4   HG12  ILE   6          HG12      ILE   6 -28.751   1.032 -11.295
    5   HG13  ILE   6          HG13      ILE   6 -28.079   1.154 -12.921
    6   HG23  ILE   6          HG21      ILE   6 -26.404  -1.137 -10.191
    7   HG22  ILE   6          HG22      ILE   6 -27.570   0.028  -9.561
    8   HG21  ILE   6          HG23      ILE   6 -25.842   0.362  -9.448
    9   HD13  ILE   6          HD11      ILE   6 -28.534  -0.976 -13.379
   10   HD12  ILE   6          HD12      ILE   6 -29.575  -0.923 -11.956
   11   HD11  ILE   6          HD13      ILE   6 -27.925  -1.532 -11.819

  No H/Q in entry =          11
  In of MODEL   79
    1    H    TYR   7           H        TYR   7 -25.105   3.242  -9.309
    2    HA   TYR   7           HA       TYR   7 -22.384   2.263  -9.916
    3    HB2  TYR   7           HB2      TYR   7 -23.367   4.734  -8.511
    4    HB3  TYR   7           HB3      TYR   7 -21.684   4.214  -8.507
    5    HD1  TYR   7           HD1      TYR   7 -22.670   3.201 -11.592
    6    HD2  TYR   7           HD2      TYR   7 -22.031   6.824  -9.440
    7    HE1  TYR   7           HE1      TYR   7 -22.198   4.379 -13.704
    8    HE2  TYR   7           HE2      TYR   7 -21.600   8.008 -11.544
    9    HH   TYR   7           HH       TYR   7 -21.779   7.868 -13.777

  No H/Q in entry =           9
  In of MODEL   79
    1    H    LEU   8           H        LEU   8 -21.446   0.941  -8.538
    2    HA   LEU   8           HA       LEU   8 -22.625   0.513  -5.864
    3    HB2  LEU   8           HB2      LEU   8 -20.895  -1.197  -7.627
    4    HB3  LEU   8           HB3      LEU   8 -21.113  -1.538  -5.910
    5    HG   LEU   8           HG       LEU   8 -23.586  -1.714  -6.373
    6   HD13  LEU   8          HD11      LEU   8 -23.675  -0.548  -8.514
    7   HD12  LEU   8          HD12      LEU   8 -24.204  -2.217  -8.724
    8   HD11  LEU   8          HD13      LEU   8 -22.586  -1.735  -9.231
    9   HD23  LEU   8          HD21      LEU   8 -22.286  -3.799  -7.995
   10   HD22  LEU   8          HD22      LEU   8 -23.399  -3.930  -6.633
   11   HD21  LEU   8          HD23      LEU   8 -21.696  -3.576  -6.348

  No H/Q in entry =          11
  In of MODEL   79
    1    H    PHE   9           H        PHE   9 -21.392   0.958  -4.067
    2    HA   PHE   9           HA       PHE   9 -18.595   1.874  -4.547
    3    HB2  PHE   9           HB2      PHE   9 -20.658   2.997  -2.659
    4    HB3  PHE   9           HB3      PHE   9 -18.948   3.400  -2.589
    5    HD1  PHE   9           HD1      PHE   9 -17.876   4.676  -4.373
    6    HD2  PHE   9           HD2      PHE   9 -22.073   3.791  -4.493
    7    HE1  PHE   9           HE1      PHE   9 -18.177   6.342  -6.181
    8    HE2  PHE   9           HE2      PHE   9 -22.374   5.469  -6.296
    9    HZ   PHE   9           HZ       PHE   9 -20.424   6.741  -7.145

  No H/Q in entry =           9
  In of MODEL   79
    1    H    SER  10           H        SER  10 -17.023   0.965  -3.367
    2    HA   SER  10           HA       SER  10 -17.285   0.119  -0.669
    3    HB2  SER  10           HB2      SER  10 -17.182  -2.250  -0.899
    4    HB3  SER  10           HB3      SER  10 -18.514  -1.715  -1.910
    5    HG   SER  10           HG       SER  10 -17.319  -2.038  -3.687

  No H/Q in entry =           5
  In of MODEL   79
    1    H    SER  11           H        SER  11 -15.278   0.221   0.193
    2    HA   SER  11           HA       SER  11 -13.060   1.012  -1.336
    3    HB2  SER  11           HB2      SER  11 -13.621   1.134   1.261
    4    HB3  SER  11           HB3      SER  11 -12.590  -0.299   1.285
    5    HG   SER  11           HG       SER  11 -10.928   0.875   0.529

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ALA  12           H        ALA  12 -14.266  -1.660  -2.106
    2    HA   ALA  12           HA       ALA  12 -11.706  -2.969  -2.552
    3    HB3  ALA  12           HB1      ALA  12 -12.277  -4.114  -0.547
    4    HB2  ALA  12           HB2      ALA  12 -12.680  -5.213  -1.866
    5    HB1  ALA  12           HB3      ALA  12 -13.957  -4.309  -1.055

  No H/Q in entry =           5
  In of MODEL   79
    1    H    GLY  13           H        GLY  13 -12.483  -1.962  -4.609
    2    HA3  GLY  13           HA2      GLY  13 -14.703  -2.739  -6.084
    3    HA2  GLY  13           HA3      GLY  13 -13.161  -2.245  -6.798

  No H/Q in entry =           3
  In of MODEL   79
    1    H    MET  14           H        MET  14 -11.629  -4.489  -5.737
    2    HA   MET  14           HA       MET  14 -11.881  -6.288  -7.841
    3    HB2  MET  14           HB2      MET  14  -9.901  -6.211  -6.316
    4    HB3  MET  14           HB3      MET  14 -10.835  -7.087  -5.105
    5    HG2  MET  14           HG2      MET  14  -9.629  -8.781  -6.229
    6    HG3  MET  14           HG3      MET  14 -11.213  -8.839  -7.001
    7    HE2  MET  14           HE1      MET  14  -7.186  -7.759  -8.734
    8    HE1  MET  14           HE2      MET  14  -7.628  -8.917  -7.481
    9    HE3  MET  14           HE3      MET  14  -7.679  -7.191  -7.132

  No H/Q in entry =           9
  In of MODEL   79
    1    H    SER  15           H        SER  15 -13.240  -6.721  -4.585
    2    HA   SER  15           HA       SER  15 -14.532  -9.203  -5.334
    3    HB2  SER  15           HB2      SER  15 -14.731  -7.496  -2.860
    4    HB3  SER  15           HB3      SER  15 -15.871  -8.805  -3.160
    5    HG   SER  15           HG       SER  15 -13.032  -9.067  -3.200

  No H/Q in entry =           5
  In of MODEL   79
    1    H    THR  16           H        THR  16 -15.623  -5.818  -4.944
    2    HA   THR  16           HA       THR  16 -18.408  -6.317  -5.482
    3    HB   THR  16           HB       THR  16 -16.835  -3.777  -6.035
    4    HG1  THR  16           HG1      THR  16 -16.426  -3.988  -3.972
    5   HG22  THR  16          HG21      THR  16 -19.727  -4.274  -5.284
    6   HG21  THR  16          HG22      THR  16 -19.152  -3.861  -6.909
    7   HG23  THR  16          HG23      THR  16 -18.993  -2.704  -5.580

  No H/Q in entry =           7
  In of MODEL   79
    1    H    SER  17           H        SER  17 -15.570  -5.799  -7.314
    2    HA   SER  17           HA       SER  17 -16.647  -5.118  -9.855
    3    HB2  SER  17           HB2      SER  17 -14.034  -6.406  -9.053
    4    HB3  SER  17           HB3      SER  17 -14.440  -6.051 -10.731
    5    HG   SER  17           HG       SER  17 -13.438  -4.422  -8.907

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LEU  18           H        LEU  18 -16.114  -8.227  -8.320
    2    HA   LEU  18           HA       LEU  18 -16.657  -9.782 -10.649
    3    HB2  LEU  18           HB2      LEU  18 -15.476 -10.721  -8.725
    4    HB3  LEU  18           HB3      LEU  18 -16.896 -10.461  -7.712
    5    HG   LEU  18           HG       LEU  18 -18.162 -12.008  -9.231
    6   HD13  LEU  18          HD11      LEU  18 -16.904 -11.976 -11.237
    7   HD12  LEU  18          HD12      LEU  18 -16.606 -13.570 -10.544
    8   HD11  LEU  18          HD13      LEU  18 -15.395 -12.301 -10.388
    9   HD22  LEU  18          HD21      LEU  18 -17.348 -13.972  -8.193
   10   HD21  LEU  18          HD22      LEU  18 -17.150 -12.637  -7.055
   11   HD23  LEU  18          HD23      LEU  18 -15.756 -13.252  -7.943

  No H/Q in entry =          11
  In of MODEL   79
    1    H    LEU  19           H        LEU  19 -18.676  -8.506  -8.005
    2    HA   LEU  19           HA       LEU  19 -21.124  -9.706  -8.857
    3    HB2  LEU  19           HB2      LEU  19 -20.845  -8.790  -6.615
    4    HB3  LEU  19           HB3      LEU  19 -20.642  -7.175  -7.289
    5    HG   LEU  19           HG       LEU  19 -22.956  -7.072  -7.910
    6   HD12  LEU  19          HD11      LEU  19 -24.380  -9.102  -6.996
    7   HD11  LEU  19          HD12      LEU  19 -22.882  -9.988  -7.280
    8   HD13  LEU  19          HD13      LEU  19 -23.673  -9.145  -8.611
    9   HD22  LEU  19          HD21      LEU  19 -22.595  -6.367  -5.709
   10   HD21  LEU  19          HD22      LEU  19 -22.393  -8.017  -5.120
   11   HD23  LEU  19          HD23      LEU  19 -23.986  -7.445  -5.615

  No H/Q in entry =          11
  In of MODEL   79
    1    H    VAL  20           H        VAL  20 -19.610  -6.565  -9.599
    2    HA   VAL  20           HA       VAL  20 -21.689  -5.560 -11.232
    3    HB   VAL  20           HB       VAL  20 -18.697  -4.977 -11.342
    4   HG12  VAL  20          HG11      VAL  20 -19.490  -2.867 -12.555
    5   HG11  VAL  20          HG12      VAL  20 -21.007  -3.723 -12.829
    6   HG13  VAL  20          HG13      VAL  20 -19.503  -4.360 -13.493
    7   HG22  VAL  20          HG21      VAL  20 -19.447  -4.160  -9.314
    8   HG21  VAL  20          HG22      VAL  20 -21.026  -3.721  -9.959
    9   HG23  VAL  20          HG23      VAL  20 -19.608  -2.761 -10.377

  No H/Q in entry =           9
  In of MODEL   79
    1    H    SER  21           H        SER  21 -18.916  -7.638 -12.157
    2    HA   SER  21           HA       SER  21 -19.648  -7.591 -14.925
    3    HB2  SER  21           HB2      SER  21 -18.209  -9.568 -15.182
    4    HB3  SER  21           HB3      SER  21 -17.396  -8.301 -14.267
    5    HG   SER  21           HG       SER  21 -17.455  -9.482 -12.524

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LYS  22           H        LYS  22 -20.766  -9.712 -12.321
    2    HA   LYS  22           HA       LYS  22 -22.273 -11.374 -14.132
    3    HB2  LYS  22           HB2      LYS  22 -22.633 -10.949 -11.163
    4    HB3  LYS  22           HB3      LYS  22 -23.407 -12.207 -12.124
    5    HG2  LYS  22           HG2      LYS  22 -20.425 -11.964 -11.774
    6    HG3  LYS  22           HG3      LYS  22 -21.457 -12.971 -10.762
    7    HD2  LYS  22           HD2      LYS  22 -22.154 -14.242 -12.745
    8    HD3  LYS  22           HD3      LYS  22 -21.105 -13.240 -13.748
    9    HE2  LYS  22           HE2      LYS  22 -19.989 -15.334 -13.286
   10    HE3  LYS  22           HE3      LYS  22 -19.150 -14.035 -12.438
   11    HZ2  LYS  22           HZ1      LYS  22 -19.401 -16.026 -11.085
   12    HZ1  LYS  22           HZ2      LYS  22 -21.092 -15.909 -11.204
   13    HZ3  LYS  22           HZ3      LYS  22 -20.211 -14.700 -10.400

  No H/Q in entry =          13
  In of MODEL   79
    1    H    MET  23           H        MET  23 -23.025  -8.406 -12.349
    2    HA   MET  23           HA       MET  23 -25.823  -8.490 -12.907
    3    HB2  MET  23           HB2      MET  23 -23.980  -6.173 -12.355
    4    HB3  MET  23           HB3      MET  23 -25.721  -6.004 -12.570
    5    HG2  MET  23           HG2      MET  23 -26.154  -7.258 -10.578
    6    HG3  MET  23           HG3      MET  23 -24.447  -7.671 -10.410
    7    HE2  MET  23           HE1      MET  23 -26.757  -3.987  -9.353
    8    HE1  MET  23           HE2      MET  23 -26.987  -4.988 -10.784
    9    HE3  MET  23           HE3      MET  23 -25.946  -3.566 -10.863

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ARG  24           H        ARG  24 -23.031  -7.112 -14.672
    2    HA   ARG  24           HA       ARG  24 -24.484  -5.856 -16.729
    3    HB2  ARG  24           HB2      ARG  24 -21.672  -7.001 -16.688
    4    HB3  ARG  24           HB3      ARG  24 -22.319  -6.121 -18.051
    5    HG2  ARG  24           HG2      ARG  24 -22.544  -4.068 -16.690
    6    HG3  ARG  24           HG3      ARG  24 -21.979  -4.965 -15.256
    7    HD2  ARG  24           HD2      ARG  24 -20.067  -3.793 -16.208
    8    HD3  ARG  24           HD3      ARG  24 -19.891  -5.515 -16.518
    9    HE   ARG  24           HE       ARG  24 -21.045  -4.635 -18.781
   10   HH21  ARG  24          HH11      ARG  24 -19.637  -5.294 -20.403
   11   HH22  ARG  24          HH12      ARG  24 -17.979  -4.804 -20.351
   12   HH11  ARG  24          HH21      ARG  24 -18.341  -3.542 -17.065
   13   HH12  ARG  24          HH22      ARG  24 -17.225  -3.759 -18.375

  No H/Q in entry =          13
  In of MODEL   79
    1    H    ALA  25           H        ALA  25 -23.382  -9.190 -16.354
    2    HA   ALA  25           HA       ALA  25 -23.963 -10.081 -18.981
    3    HB1  ALA  25           HB1      ALA  25 -23.289 -12.098 -18.226
    4    HB3  ALA  25           HB2      ALA  25 -24.374 -12.041 -16.836
    5    HB2  ALA  25           HB3      ALA  25 -22.816 -11.219 -16.773

  No H/Q in entry =           5
  In of MODEL   79
    1    H    GLN  26           H        GLN  26 -25.848 -10.041 -15.994
    2    HA   GLN  26           HA       GLN  26 -28.177 -11.258 -17.028
    3    HB2  GLN  26           HB2      GLN  26 -27.702  -9.457 -14.673
    4    HB3  GLN  26           HB3      GLN  26 -29.261 -10.182 -15.037
    5    HG2  GLN  26           HG2      GLN  26 -26.692 -11.638 -14.483
    6    HG3  GLN  26           HG3      GLN  26 -28.074 -11.504 -13.403
    7   HE21  GLN  26          HE21      GLN  26 -26.842 -13.703 -14.606
    8   HE22  GLN  26          HE22      GLN  26 -27.873 -14.764 -15.398

  No H/Q in entry =           8
  In of MODEL   79
    1    H    ALA  27           H        ALA  27 -27.234  -7.856 -16.697
    2    HA   ALA  27           HA       ALA  27 -29.703  -6.771 -17.554
    3    HB1  ALA  27           HB1      ALA  27 -27.909  -5.438 -16.435
    4    HB3  ALA  27           HB2      ALA  27 -28.466  -4.704 -17.938
    5    HB2  ALA  27           HB3      ALA  27 -26.935  -5.577 -17.900

  No H/Q in entry =           5
  In of MODEL   79
    1    H    GLU  28           H        GLU  28 -26.972  -8.048 -19.342
    2    HA   GLU  28           HA       GLU  28 -27.852  -7.062 -21.902
    3    HB2  GLU  28           HB2      GLU  28 -25.490  -7.741 -21.217
    4    HB3  GLU  28           HB3      GLU  28 -26.039  -9.407 -21.391
    5    HG2  GLU  28           HG2      GLU  28 -24.851  -8.681 -23.354
    6    HG3  GLU  28           HG3      GLU  28 -26.543  -9.004 -23.728

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LYS  29           H        LYS  29 -28.066 -10.129 -20.179
    2    HA   LYS  29           HA       LYS  29 -29.338 -11.638 -22.176
    3    HB2  LYS  29           HB2      LYS  29 -28.332 -12.582 -20.130
    4    HB3  LYS  29           HB3      LYS  29 -29.620 -11.846 -19.176
    5    HG2  LYS  29           HG2      LYS  29 -31.266 -13.234 -20.245
    6    HG3  LYS  29           HG3      LYS  29 -30.048 -13.901 -21.331
    7    HD2  LYS  29           HD2      LYS  29 -28.946 -15.033 -19.550
    8    HD3  LYS  29           HD3      LYS  29 -29.873 -14.160 -18.332
    9    HE2  LYS  29           HE2      LYS  29 -30.629 -16.513 -18.656
   10    HE3  LYS  29           HE3      LYS  29 -31.896 -15.320 -18.951
   11    HZ1  LYS  29           HZ1      LYS  29 -31.285 -15.511 -21.363
   12    HZ3  LYS  29           HZ2      LYS  29 -32.025 -16.879 -20.682
   13    HZ2  LYS  29           HZ3      LYS  29 -30.349 -16.865 -20.947

  No H/Q in entry =          13
  In of MODEL   79
    1    H    TYR  30           H        TYR  30 -30.768  -9.471 -19.746
    2    HA   TYR  30           HA       TYR  30 -33.408  -9.936 -21.029
    3    HB2  TYR  30           HB2      TYR  30 -32.802  -8.725 -18.322
    4    HB3  TYR  30           HB3      TYR  30 -34.408  -8.990 -19.001
    5    HD1  TYR  30           HD1      TYR  30 -35.325 -11.282 -19.181
    6    HD2  TYR  30           HD2      TYR  30 -31.521 -10.539 -17.419
    7    HE1  TYR  30           HE1      TYR  30 -35.262 -13.592 -18.332
    8    HE2  TYR  30           HE2      TYR  30 -31.458 -12.835 -16.574
    9    HH   TYR  30           HH       TYR  30 -33.087 -15.212 -17.646

  No H/Q in entry =           9
  In of MODEL   79
    1    H    GLU  31           H        GLU  31 -31.217  -7.973 -21.831
    2    HA   GLU  31           HA       GLU  31 -31.117  -5.834 -22.700
    3    HB2  GLU  31           HB2      GLU  31 -34.005  -6.549 -23.253
    4    HB3  GLU  31           HB3      GLU  31 -33.145  -5.201 -23.996
    5    HG2  GLU  31           HG2      GLU  31 -31.656  -6.672 -25.126
    6    HG3  GLU  31           HG3      GLU  31 -32.245  -8.063 -24.218

  No H/Q in entry =           6
  In of MODEL   79
    1    H    VAL  32           H        VAL  32 -31.370  -5.671 -19.975
    2    HA   VAL  32           HA       VAL  32 -33.235  -3.537 -19.399
    3    HB   VAL  32           HB       VAL  32 -30.878  -4.504 -17.751
    4   HG12  VAL  32          HG11      VAL  32 -32.447  -3.633 -15.904
    5   HG11  VAL  32          HG12      VAL  32 -33.252  -2.755 -17.204
    6   HG13  VAL  32          HG13      VAL  32 -31.550  -2.450 -16.857
    7   HG21  VAL  32          HG21      VAL  32 -32.640  -6.233 -18.435
    8   HG23  VAL  32          HG22      VAL  32 -33.698  -5.377 -17.314
    9   HG22  VAL  32          HG23      VAL  32 -32.195  -6.093 -16.733

  No H/Q in entry =           9
  In of MODEL   79
    1    HA   PRO  33           HA       PRO  33 -30.161  -0.656 -21.078
    2    HB2  PRO  33           HB2      PRO  33 -31.667   1.573 -21.032
    3    HB3  PRO  33           HB3      PRO  33 -32.118   0.249 -22.106
    4    HG2  PRO  33           HG2      PRO  33 -33.139   0.830 -19.325
    5    HG3  PRO  33           HG3      PRO  33 -34.076   0.592 -20.800
    6    HD2  PRO  33           HD2      PRO  33 -33.659  -1.445 -19.081
    7    HD3  PRO  33           HD3      PRO  33 -33.689  -1.724 -20.822

  No H/Q in entry =           7
  In of MODEL   79
    1    H    VAL  34           H        VAL  34 -28.937  -1.162 -19.092
    2    HA   VAL  34           HA       VAL  34 -28.677   1.299 -17.494
    3    HB   VAL  34           HB       VAL  34 -28.138  -0.121 -15.514
    4   HG12  VAL  34          HG11      VAL  34 -30.559  -0.982 -15.234
    5   HG11  VAL  34          HG12      VAL  34 -30.842  -0.255 -16.814
    6   HG13  VAL  34          HG13      VAL  34 -30.313   0.750 -15.465
    7   HG21  VAL  34          HG21      VAL  34 -28.291  -2.192 -17.480
    8   HG23  VAL  34          HG22      VAL  34 -29.375  -2.519 -16.127
    9   HG22  VAL  34          HG23      VAL  34 -27.662  -2.230 -15.832

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ILE  35           H        ILE  35 -26.717   1.747 -16.625
    2    HA   ILE  35           HA       ILE  35 -24.391   0.385 -17.814
    3    HB   ILE  35           HB       ILE  35 -24.800   3.293 -17.074
    4   HG12  ILE  35          HG12      ILE  35 -23.771   1.928 -19.571
    5   HG13  ILE  35          HG13      ILE  35 -25.405   2.558 -19.355
    6   HG21  ILE  35          HG21      ILE  35 -22.236   1.748 -17.300
    7   HG23  ILE  35          HG22      ILE  35 -22.710   2.955 -16.106
    8   HG22  ILE  35          HG23      ILE  35 -22.295   3.452 -17.746
    9   HD11  ILE  35          HD11      ILE  35 -24.010   4.763 -18.776
   10   HD13  ILE  35          HD12      ILE  35 -24.516   4.345 -20.414
   11   HD12  ILE  35          HD13      ILE  35 -22.875   3.983 -19.878

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ILE  36           H        ILE  36 -23.194  -0.605 -16.169
    2    HA   ILE  36           HA       ILE  36 -23.689   0.072 -13.322
    3    HB   ILE  36           HB       ILE  36 -22.847  -2.656 -14.355
    4   HG12  ILE  36          HG12      ILE  36 -25.667  -1.828 -13.663
    5   HG13  ILE  36          HG13      ILE  36 -25.063  -1.844 -15.320
    6   HG23  ILE  36          HG21      ILE  36 -23.241  -3.437 -12.230
    7   HG22  ILE  36          HG22      ILE  36 -24.373  -2.142 -11.841
    8   HG21  ILE  36          HG23      ILE  36 -22.640  -1.815 -11.886
    9   HD13  ILE  36          HD11      ILE  36 -25.230  -4.062 -15.481
   10   HD12  ILE  36          HD12      ILE  36 -26.321  -3.908 -14.106
   11   HD11  ILE  36          HD13      ILE  36 -24.629  -4.326 -13.844

  No H/Q in entry =          11
  In of MODEL   79
    1    H    GLU  37           H        GLU  37 -21.927   0.722 -12.197
    2    HA   GLU  37           HA       GLU  37 -19.222  -0.099 -13.044
    3    HB2  GLU  37           HB2      GLU  37 -20.126   2.707 -12.421
    4    HB3  GLU  37           HB3      GLU  37 -18.437   2.209 -12.511
    5    HG2  GLU  37           HG2      GLU  37 -18.671   1.721 -14.858
    6    HG3  GLU  37           HG3      GLU  37 -20.389   2.112 -14.792

  No H/Q in entry =           6
  In of MODEL   79
    1    H    ALA  38           H        ALA  38 -17.768  -0.302 -11.328
    2    HA   ALA  38           HA       ALA  38 -18.852  -0.062  -8.583
    3    HB1  ALA  38           HB1      ALA  38 -17.114  -2.034  -9.932
    4    HB3  ALA  38           HB2      ALA  38 -18.191  -2.237  -8.551
    5    HB2  ALA  38           HB3      ALA  38 -16.583  -1.552  -8.321

  No H/Q in entry =           5
  In of MODEL   79
    1    H    PHE  39           H        PHE  39 -17.638   1.178  -7.112
    2    HA   PHE  39           HA       PHE  39 -15.094   2.358  -7.986
    3    HB2  PHE  39           HB2      PHE  39 -17.518   3.875  -7.033
    4    HB3  PHE  39           HB3      PHE  39 -15.888   4.541  -6.959
    5    HD1  PHE  39           HD1      PHE  39 -14.566   4.556  -9.185
    6    HD2  PHE  39           HD2      PHE  39 -18.807   4.212  -8.903
    7    HE1  PHE  39           HE1      PHE  39 -14.775   5.364 -11.519
    8    HE2  PHE  39           HE2      PHE  39 -19.031   5.012 -11.227
    9    HZ   PHE  39           HZ       PHE  39 -17.019   5.560 -12.554

  No H/Q in entry =           9
  In of MODEL   79
    1    HA   PRO  40           HA       PRO  40 -14.239   1.698  -3.667
    2    HB2  PRO  40           HB2      PRO  40 -12.482   3.723  -3.070
    3    HB3  PRO  40           HB3      PRO  40 -12.019   2.371  -4.104
    4    HG2  PRO  40           HG2      PRO  40 -13.032   5.091  -4.922
    5    HG3  PRO  40           HG3      PRO  40 -11.592   4.243  -5.483
    6    HD2  PRO  40           HD2      PRO  40 -13.786   4.113  -6.938
    7    HD3  PRO  40           HD3      PRO  40 -12.833   2.651  -6.691

  No H/Q in entry =           7
  In of MODEL   79
    1    H    GLU  41           H        GLU  41 -14.900   2.722  -1.572
    2    HA   GLU  41           HA       GLU  41 -17.145   4.424  -1.635
    3    HB2  GLU  41           HB2      GLU  41 -17.017   4.430   0.758
    4    HB3  GLU  41           HB3      GLU  41 -16.588   2.815   0.191
    5    HG2  GLU  41           HG2      GLU  41 -14.210   3.341   0.536
    6    HG3  GLU  41           HG3      GLU  41 -14.663   4.936   1.139

  No H/Q in entry =           6
  In of MODEL   79
    1    H    THR  42           H        THR  42 -13.813   5.341  -1.643
    2    HA   THR  42           HA       THR  42 -14.190   7.928  -0.495
    3    HB   THR  42           HB       THR  42 -12.014   8.479  -1.567
    4    HG1  THR  42           HG1      THR  42 -11.063   7.000  -2.906
    5   HG23  THR  42          HG21      THR  42 -11.862   7.396   0.557
    6   HG22  THR  42          HG22      THR  42 -10.711   6.573  -0.498
    7   HG21  THR  42          HG23      THR  42 -12.268   5.828  -0.142

  No H/Q in entry =           7
  In of MODEL   79
    1    H    LEU  43           H        LEU  43 -15.035   6.766  -3.587
    2    HA   LEU  43           HA       LEU  43 -15.271   9.515  -4.623
    3    HB2  LEU  43           HB2      LEU  43 -15.594   6.834  -5.959
    4    HB3  LEU  43           HB3      LEU  43 -15.813   8.391  -6.757
    5    HG   LEU  43           HG       LEU  43 -13.203   7.354  -5.679
    6   HD11  LEU  43          HD11      LEU  43 -14.340   6.257  -7.766
    7   HD13  LEU  43          HD12      LEU  43 -12.635   6.699  -7.819
    8   HD12  LEU  43          HD13      LEU  43 -13.839   7.745  -8.571
    9   HD23  LEU  43          HD21      LEU  43 -12.435   9.274  -7.267
   10   HD22  LEU  43          HD22      LEU  43 -13.018   9.670  -5.649
   11   HD21  LEU  43          HD23      LEU  43 -14.077   9.878  -7.043

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ALA  44           H        ALA  44 -17.250   7.730  -2.767
    2    HA   ALA  44           HA       ALA  44 -19.702   7.558  -4.133
    3    HB2  ALA  44           HB1      ALA  44 -19.604   6.488  -2.010
    4    HB3  ALA  44           HB2      ALA  44 -20.717   7.838  -1.789
    5    HB1  ALA  44           HB3      ALA  44 -19.056   7.960  -1.207

  No H/Q in entry =           5
  In of MODEL   79
    1    H    GLY  45           H        GLY  45 -18.313  10.393  -2.636
    2    HA3  GLY  45           HA2      GLY  45 -20.743  11.882  -3.077
    3    HA2  GLY  45           HA3      GLY  45 -19.211  12.521  -2.484

  No H/Q in entry =           3
  In of MODEL   79
    1    H    GLU  46           H        GLU  46 -17.636  11.535  -4.724
    2    HA   GLU  46           HA       GLU  46 -18.240  13.710  -6.553
    3    HB2  GLU  46           HB2      GLU  46 -15.938  12.270  -5.754
    4    HB3  GLU  46           HB3      GLU  46 -16.155  11.971  -7.479
    5    HG2  GLU  46           HG2      GLU  46 -16.066  14.710  -6.236
    6    HG3  GLU  46           HG3      GLU  46 -14.668  13.891  -6.931

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LYS  47           H        LYS  47 -18.111  10.183  -6.908
    2    HA   LYS  47           HA       LYS  47 -19.158  10.342  -9.608
    3    HB2  LYS  47           HB2      LYS  47 -18.635   7.986  -7.788
    4    HB3  LYS  47           HB3      LYS  47 -19.152   7.866  -9.470
    5    HG2  LYS  47           HG2      LYS  47 -16.632   9.273  -8.676
    6    HG3  LYS  47           HG3      LYS  47 -16.687   7.537  -8.980
    7    HD2  LYS  47           HD2      LYS  47 -17.605   7.970 -11.217
    8    HD3  LYS  47           HD3      LYS  47 -17.504   9.703 -10.911
    9    HE2  LYS  47           HE2      LYS  47 -15.084   9.524 -10.661
   10    HE3  LYS  47           HE3      LYS  47 -15.179   7.787 -10.944
   11    HZ3  LYS  47           HZ1      LYS  47 -14.715   8.515 -13.021
   12    HZ2  LYS  47           HZ2      LYS  47 -15.508  10.002 -12.818
   13    HZ1  LYS  47           HZ3      LYS  47 -16.411   8.587 -13.089

  No H/Q in entry =          13
  In of MODEL   79
    1    H    GLY  48           H        GLY  48 -20.540   9.655  -6.469
    2    HA3  GLY  48           HA2      GLY  48 -22.910   8.450  -7.229
    3    HA2  GLY  48           HA3      GLY  48 -22.713   9.476  -5.808

  No H/Q in entry =           3
  In of MODEL   79
    1    H    GLN  49           H        GLN  49 -22.101  11.864  -7.422
    2    HA   GLN  49           HA       GLN  49 -24.657  12.970  -7.640
    3    HB2  GLN  49           HB2      GLN  49 -22.089  13.806  -8.969
    4    HB3  GLN  49           HB3      GLN  49 -23.553  14.772  -8.935
    5    HG2  GLN  49           HG2      GLN  49 -23.439  14.849  -6.497
    6    HG3  GLN  49           HG3      GLN  49 -21.989  13.863  -6.529
    7   HE21  GLN  49          HE21      GLN  49 -21.897  16.120  -5.305
    8   HE22  GLN  49          HE22      GLN  49 -20.963  17.362  -5.962

  No H/Q in entry =           8
  In of MODEL   79
    1    H    ASN  50           H        ASN  50 -22.933  11.039  -9.951
    2    HA   ASN  50           HA       ASN  50 -24.776  11.864 -12.088
    3    HB2  ASN  50           HB2      ASN  50 -22.192  10.320 -12.238
    4    HB3  ASN  50           HB3      ASN  50 -23.216  10.715 -13.611
    5   HD21  ASN  50          HD21      ASN  50 -20.612  11.599 -11.969
    6   HD22  ASN  50          HD22      ASN  50 -20.372  13.226 -12.343

  No H/Q in entry =           6
  In of MODEL   79
    1    H    ALA  51           H        ALA  51 -24.804   9.557  -9.790
    2    HA   ALA  51           HA       ALA  51 -25.553   7.372 -11.583
    3    HB2  ALA  51           HB1      ALA  51 -25.002   6.061  -9.856
    4    HB3  ALA  51           HB2      ALA  51 -26.145   6.893  -8.802
    5    HB1  ALA  51           HB3      ALA  51 -24.503   7.510  -8.983

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ASP  52           H        ASP  52 -27.561   6.320 -11.458
    2    HA   ASP  52           HA       ASP  52 -29.754   8.167 -10.875
    3    HB2  ASP  52           HB2      ASP  52 -29.533   5.625 -12.485
    4    HB3  ASP  52           HB3      ASP  52 -31.085   6.368 -12.096

  No H/Q in entry =           4
  In of MODEL   79
    1    H    VAL  53           H        VAL  53 -28.174   5.301  -9.764
    2    HA   VAL  53           HA       VAL  53 -29.662   5.485  -7.279
    3    HB   VAL  53           HB       VAL  53 -31.039   3.816  -8.513
    4   HG11  VAL  53          HG11      VAL  53 -29.264   2.922  -9.982
    5   HG13  VAL  53          HG12      VAL  53 -30.113   1.647  -9.110
    6   HG12  VAL  53          HG13      VAL  53 -28.513   2.160  -8.581
    7   HG23  VAL  53          HG21      VAL  53 -30.250   1.877  -6.762
    8   HG22  VAL  53          HG22      VAL  53 -31.385   3.190  -6.446
    9   HG21  VAL  53          HG23      VAL  53 -29.686   3.370  -6.011

  No H/Q in entry =           9
  In of MODEL   79
    1    H    VAL  54           H        VAL  54 -28.381   5.088  -5.591
    2    HA   VAL  54           HA       VAL  54 -25.611   4.224  -6.130
    3    HB   VAL  54           HB       VAL  54 -26.722   6.052  -3.941
    4   HG11  VAL  54          HG11      VAL  54 -24.140   4.625  -4.151
    5   HG13  VAL  54          HG12      VAL  54 -24.919   5.337  -2.740
    6   HG12  VAL  54          HG13      VAL  54 -23.991   6.355  -3.842
    7   HG22  VAL  54          HG21      VAL  54 -25.839   7.840  -5.065
    8   HG21  VAL  54          HG22      VAL  54 -26.362   6.822  -6.405
    9   HG23  VAL  54          HG23      VAL  54 -24.664   6.854  -5.935

  No H/Q in entry =           9
  In of MODEL   79
    1    H    LEU  55           H        LEU  55 -25.034   2.316  -5.434
    2    HA   LEU  55           HA       LEU  55 -26.585   1.056  -3.259
    3    HB2  LEU  55           HB2      LEU  55 -24.987  -0.165  -5.497
    4    HB3  LEU  55           HB3      LEU  55 -25.772  -1.069  -4.203
    5    HG   LEU  55           HG       LEU  55 -27.166   0.472  -6.382
    6   HD13  LEU  55          HD11      LEU  55 -26.846  -1.407  -7.555
    7   HD12  LEU  55          HD12      LEU  55 -27.827  -2.255  -6.359
    8   HD11  LEU  55          HD13      LEU  55 -26.075  -2.188  -6.176
    9   HD23  LEU  55          HD21      LEU  55 -28.500  -1.430  -4.509
   10   HD22  LEU  55          HD22      LEU  55 -29.176  -0.067  -5.400
   11   HD21  LEU  55          HD23      LEU  55 -28.183   0.219  -3.971

  No H/Q in entry =          11
  In of MODEL   79
    1    H    LEU  56           H        LEU  56 -25.468   0.501  -1.419
    2    HA   LEU  56           HA       LEU  56 -22.533   0.891  -1.421
    3    HB2  LEU  56           HB2      LEU  56 -24.382   0.737   0.946
    4    HB3  LEU  56           HB3      LEU  56 -22.671   1.164   0.958
    5    HG   LEU  56           HG       LEU  56 -24.949   2.823  -0.086
    6   HD11  LEU  56          HD11      LEU  56 -23.882   2.496   2.463
    7   HD13  LEU  56          HD12      LEU  56 -24.860   3.855   1.907
    8   HD12  LEU  56          HD13      LEU  56 -23.101   3.955   1.851
    9   HD23  LEU  56          HD21      LEU  56 -22.997   4.514  -0.281
   10   HD22  LEU  56          HD22      LEU  56 -23.357   3.388  -1.591
   11   HD21  LEU  56          HD23      LEU  56 -22.024   3.058  -0.484

  No H/Q in entry =          11
  In of MODEL   79
    1    H    GLY  57           H        GLY  57 -21.166  -0.728  -0.825
    2    HA3  GLY  57           HA2      GLY  57 -22.091  -3.417  -0.981
    3    HA2  GLY  57           HA3      GLY  57 -20.476  -2.915  -0.485

  No H/Q in entry =           3
  In of MODEL   79
    1    HA   PRO  58           HA       PRO  58 -23.357  -3.866   3.197
    2    HB2  PRO  58           HB2      PRO  58 -22.688  -6.457   3.874
    3    HB3  PRO  58           HB3      PRO  58 -24.053  -6.070   2.827
    4    HG2  PRO  58           HG2      PRO  58 -21.313  -6.972   2.112
    5    HG3  PRO  58           HG3      PRO  58 -22.865  -7.445   1.422
    6    HD2  PRO  58           HD2      PRO  58 -21.229  -5.657   0.189
    7    HD3  PRO  58           HD3      PRO  58 -22.986  -5.571   0.052

  No H/Q in entry =           7
  In of MODEL   79
    1    H    GLN  59           H        GLN  59 -19.976  -4.357   2.665
    2    HA   GLN  59           HA       GLN  59 -19.273  -4.314   5.440
    3    HB2  GLN  59           HB2      GLN  59 -17.505  -3.296   3.231
    4    HB3  GLN  59           HB3      GLN  59 -17.037  -4.009   4.761
    5    HG2  GLN  59           HG2      GLN  59 -16.658  -5.822   3.488
    6    HG3  GLN  59           HG3      GLN  59 -18.385  -6.072   3.682
    7   HE21  GLN  59          HE21      GLN  59 -16.006  -5.304   1.667
    8   HE22  GLN  59          HE22      GLN  59 -16.552  -5.216   0.100

  No H/Q in entry =           8
  In of MODEL   79
    1    H    ILE  60           H        ILE  60 -20.159  -1.811   3.157
    2    HA   ILE  60           HA       ILE  60 -19.342   0.190   5.174
    3    HB   ILE  60           HB       ILE  60 -19.554   1.876   3.295
    4   HG12  ILE  60          HG12      ILE  60 -19.271  -0.407   1.386
    5   HG13  ILE  60          HG13      ILE  60 -20.879   0.131   1.871
    6   HG23  ILE  60          HG21      ILE  60 -17.379   1.514   2.481
    7   HG22  ILE  60          HG22      ILE  60 -17.492  -0.225   2.754
    8   HG21  ILE  60          HG23      ILE  60 -17.424   0.880   4.126
    9   HD12  ILE  60          HD11      ILE  60 -18.814   1.554   0.239
   10   HD11  ILE  60          HD12      ILE  60 -19.956   2.502   1.193
   11   HD13  ILE  60          HD13      ILE  60 -20.547   1.391  -0.042

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ALA  61           H        ALA  61 -21.802  -1.390   5.232
    2    HA   ALA  61           HA       ALA  61 -24.015   0.269   4.694
    3    HB1  ALA  61           HB1      ALA  61 -25.258  -1.189   6.029
    4    HB2  ALA  61           HB2      ALA  61 -23.880  -1.558   7.067
    5    HB3  ALA  61           HB3      ALA  61 -23.946  -2.202   5.426

  No H/Q in entry =           5
  In of MODEL   79
    1    H    TYR  62           H        TYR  62 -21.861   0.215   7.535
    2    HA   TYR  62           HA       TYR  62 -23.444   1.912   9.138
    3    HB2  TYR  62           HB2      TYR  62 -21.435   2.351  10.409
    4    HB3  TYR  62           HB3      TYR  62 -21.470   0.646   9.961
    5    HD1  TYR  62           HD1      TYR  62 -19.889  -0.234   8.256
    6    HD2  TYR  62           HD2      TYR  62 -19.674   3.819   9.594
    7    HE1  TYR  62           HE1      TYR  62 -17.655  -0.020   7.235
    8    HE2  TYR  62           HE2      TYR  62 -17.426   4.028   8.574
    9    HH   TYR  62           HH       TYR  62 -15.681   2.773   7.775

  No H/Q in entry =           9
  In of MODEL   79
    1    H    MET  63           H        MET  63 -21.746   2.703   6.294
    2    HA   MET  63           HA       MET  63 -21.584   5.550   6.928
    3    HB2  MET  63           HB2      MET  63 -20.939   3.976   4.434
    4    HB3  MET  63           HB3      MET  63 -20.732   5.721   4.592
    5    HG2  MET  63           HG2      MET  63 -19.060   5.381   6.315
    6    HG3  MET  63           HG3      MET  63 -19.280   3.636   6.197
    7    HE2  MET  63           HE1      MET  63 -17.176   6.440   3.368
    8    HE1  MET  63           HE2      MET  63 -18.257   6.816   4.710
    9    HE3  MET  63           HE3      MET  63 -18.925   6.415   3.126

  No H/Q in entry =           9
  In of MODEL   79
    1    H    LEU  64           H        LEU  64 -24.135   3.681   5.957
    2    HA   LEU  64           HA       LEU  64 -25.301   5.055   3.825
    3    HB2  LEU  64           HB2      LEU  64 -26.193   2.973   4.774
    4    HB3  LEU  64           HB3      LEU  64 -26.675   3.850   6.226
    5    HG   LEU  64           HG       LEU  64 -28.342   5.081   4.937
    6   HD13  LEU  64          HD11      LEU  64 -28.017   5.271   2.706
    7   HD12  LEU  64          HD12      LEU  64 -28.665   3.634   2.585
    8   HD11  LEU  64          HD13      LEU  64 -26.923   3.890   2.670
    9   HD23  LEU  64          HD21      LEU  64 -28.856   2.253   4.244
   10   HD22  LEU  64          HD22      LEU  64 -29.857   3.410   5.119
   11   HD21  LEU  64          HD23      LEU  64 -28.499   2.630   5.929

  No H/Q in entry =          11
  In of MODEL   79
    1    HA   PRO  65           HA       PRO  65 -27.522   8.277   6.463
    2    HB2  PRO  65           HB2      PRO  65 -25.562   8.480   8.750
    3    HB3  PRO  65           HB3      PRO  65 -27.300   8.767   8.757
    4    HG2  PRO  65           HG2      PRO  65 -26.397   6.531   9.752
    5    HG3  PRO  65           HG3      PRO  65 -27.797   6.480   8.681
    6    HD2  PRO  65           HD2      PRO  65 -24.915   5.840   8.046
    7    HD3  PRO  65           HD3      PRO  65 -26.367   4.949   7.591

  No H/Q in entry =           7
  In of MODEL   79
    1    H    GLU  66           H        GLU  66 -23.968   8.211   6.604
    2    HA   GLU  66           HA       GLU  66 -23.652  10.998   6.141
    3    HB2  GLU  66           HB2      GLU  66 -21.836   8.670   5.576
    4    HB3  GLU  66           HB3      GLU  66 -21.376  10.356   5.340
    5    HG2  GLU  66           HG2      GLU  66 -21.629  10.780   7.693
    6    HG3  GLU  66           HG3      GLU  66 -22.166   9.121   7.953

  No H/Q in entry =           6
  In of MODEL   79
    1    H    ILE  67           H        ILE  67 -23.723   8.203   3.951
    2    HA   ILE  67           HA       ILE  67 -23.257   9.857   1.628
    3    HB   ILE  67           HB       ILE  67 -24.173   6.959   1.856
    4   HG12  ILE  67          HG12      ILE  67 -21.520   8.096   0.956
    5   HG13  ILE  67          HG13      ILE  67 -21.848   7.716   2.646
    6   HG21  ILE  67          HG21      ILE  67 -24.065   8.786  -0.410
    7   HG23  ILE  67          HG22      ILE  67 -24.699   7.143  -0.333
    8   HG22  ILE  67          HG23      ILE  67 -22.983   7.412  -0.636
    9   HD12  ILE  67          HD11      ILE  67 -21.393   5.890   0.344
   10   HD11  ILE  67          HD12      ILE  67 -22.434   5.352   1.661
   11   HD13  ILE  67          HD13      ILE  67 -20.765   5.816   1.991

  No H/Q in entry =          11
  In of MODEL   79
    1    H    GLN  68           H        GLN  68 -26.162   8.854   3.231
    2    HA   GLN  68           HA       GLN  68 -27.949   9.749   1.203
    3    HB2  GLN  68           HB2      GLN  68 -28.262   9.460   4.188
    4    HB3  GLN  68           HB3      GLN  68 -29.559  10.040   3.158
    5    HG2  GLN  68           HG2      GLN  68 -29.576   7.981   1.927
    6    HG3  GLN  68           HG3      GLN  68 -28.145   7.416   2.768
    7   HE21  GLN  68          HE21      GLN  68 -30.329   6.066   2.623
    8   HE22  GLN  68          HE22      GLN  68 -31.186   5.647   4.032

  No H/Q in entry =           8
  In of MODEL   79
    1    H    ARG  69           H        ARG  69 -26.384  11.468   3.931
    2    HA   ARG  69           HA       ARG  69 -27.726  13.949   3.445
    3    HB2  ARG  69           HB2      ARG  69 -25.416  13.040   5.097
    4    HB3  ARG  69           HB3      ARG  69 -25.477  14.752   4.699
    5    HG2  ARG  69           HG2      ARG  69 -27.811  14.831   5.627
    6    HG3  ARG  69           HG3      ARG  69 -27.622  13.150   6.141
    7    HD2  ARG  69           HD2      ARG  69 -25.931  15.515   7.034
    8    HD3  ARG  69           HD3      ARG  69 -27.084  14.638   8.027
    9    HE   ARG  69           HE       ARG  69 -24.461  13.670   7.147
   10   HH21  ARG  69          HH11      ARG  69 -23.687  11.928   8.396
   11   HH22  ARG  69          HH12      ARG  69 -24.741  11.144   9.524
   12   HH11  ARG  69          HH21      ARG  69 -27.453  13.179   8.801
   13   HH12  ARG  69          HH22      ARG  69 -26.873  11.850   9.751

  No H/Q in entry =          13
  In of MODEL   79
    1    H    LEU  70           H        LEU  70 -24.840  12.493   2.170
    2    HA   LEU  70           HA       LEU  70 -23.688  14.824   0.970
    3    HB2  LEU  70           HB2      LEU  70 -22.722  12.514   1.634
    4    HB3  LEU  70           HB3      LEU  70 -23.311  12.017   0.049
    5    HG   LEU  70           HG       LEU  70 -21.688  13.353  -1.038
    6   HD11  LEU  70          HD11      LEU  70 -20.911  14.254   1.745
    7   HD13  LEU  70          HD12      LEU  70 -21.575  15.264   0.462
    8   HD12  LEU  70          HD13      LEU  70 -19.965  14.567   0.287
    9   HD22  LEU  70          HD21      LEU  70 -20.272  11.633  -0.741
   10   HD21  LEU  70          HD22      LEU  70 -21.228  11.148   0.660
   11   HD23  LEU  70          HD23      LEU  70 -19.838  12.215   0.866

  No H/Q in entry =          11
  In of MODEL   79
    1    H    LEU  71           H        LEU  71 -25.840  12.273  -0.128
    2    HA   LEU  71           HA       LEU  71 -26.308  13.707  -2.686
    3    HB2  LEU  71           HB2      LEU  71 -26.546  10.736  -2.178
    4    HB3  LEU  71           HB3      LEU  71 -26.640  11.563  -3.732
    5    HG   LEU  71           HG       LEU  71 -24.151  11.592  -2.026
    6   HD12  LEU  71          HD11      LEU  71 -24.173   9.911  -4.422
    7   HD11  LEU  71          HD12      LEU  71 -25.212   9.325  -3.124
    8   HD13  LEU  71          HD13      LEU  71 -23.496   9.596  -2.824
    9   HD22  LEU  71          HD21      LEU  71 -24.211  13.376  -3.560
   10   HD21  LEU  71          HD22      LEU  71 -24.693  12.308  -4.879
   11   HD23  LEU  71          HD23      LEU  71 -23.086  12.163  -4.168

  No H/Q in entry =          11
  In of MODEL   79
    1    HA   PRO  72           HA       PRO  72 -30.225  13.351  -0.126
    2    HB2  PRO  72           HB2      PRO  72 -31.057  15.916  -0.279
    3    HB3  PRO  72           HB3      PRO  72 -29.771  15.477   0.845
    4    HG2  PRO  72           HG2      PRO  72 -29.525  16.609  -1.930
    5    HG3  PRO  72           HG3      PRO  72 -28.780  17.185  -0.440
    6    HD2  PRO  72           HD2      PRO  72 -27.426  15.576  -2.147
    7    HD3  PRO  72           HD3      PRO  72 -27.204  15.445  -0.403

  No H/Q in entry =           7
  In of MODEL   79
    1    H    ASN  73           H        ASN  73 -29.535  14.228  -3.349
    2    HA   ASN  73           HA       ASN  73 -32.386  13.932  -4.026
    3    HB2  ASN  73           HB2      ASN  73 -31.871  14.987  -6.138
    4    HB3  ASN  73           HB3      ASN  73 -31.363  15.992  -4.790
    5   HD21  ASN  73          HD21      ASN  73 -30.520  15.969  -7.453
    6   HD22  ASN  73          HD22      ASN  73 -28.850  15.788  -7.611

  No H/Q in entry =           6
  In of MODEL   79
    1    H    LYS  74           H        LYS  74 -30.437  11.667  -3.515
    2    HA   LYS  74           HA       LYS  74 -30.973  10.222  -6.042
    3    HB2  LYS  74           HB2      LYS  74 -28.473   9.939  -4.369
    4    HB3  LYS  74           HB3      LYS  74 -28.838   9.097  -5.875
    5    HG2  LYS  74           HG2      LYS  74 -28.545  12.068  -5.734
    6    HG3  LYS  74           HG3      LYS  74 -27.177  10.985  -5.990
    7    HD2  LYS  74           HD2      LYS  74 -28.270  10.026  -7.932
    8    HD3  LYS  74           HD3      LYS  74 -29.683  11.045  -7.661
    9    HE2  LYS  74           HE2      LYS  74 -28.428  13.028  -8.125
   10    HE3  LYS  74           HE3      LYS  74 -26.915  12.120  -8.168
   11    HZ2  LYS  74           HZ1      LYS  74 -28.341  12.690 -10.333
   12    HZ1  LYS  74           HZ2      LYS  74 -29.019  11.183  -9.939
   13    HZ3  LYS  74           HZ3      LYS  74 -27.348  11.319 -10.208

  No H/Q in entry =          13
  In of MODEL   79
    1    HA   PRO  75           HA       PRO  75 -32.455   7.320  -3.031
    2    HB2  PRO  75           HB2      PRO  75 -32.761   5.070  -4.569
    3    HB3  PRO  75           HB3      PRO  75 -33.870   6.435  -4.689
    4    HG2  PRO  75           HG2      PRO  75 -31.508   5.772  -6.403
    5    HG3  PRO  75           HG3      PRO  75 -33.143   6.217  -6.891
    6    HD2  PRO  75           HD2      PRO  75 -31.181   8.062  -6.853
    7    HD3  PRO  75           HD3      PRO  75 -32.817   8.491  -6.354

  No H/Q in entry =           7
  In of MODEL   79
    1    H    VAL  76           H        VAL  76 -31.039   6.279  -1.609
    2    HA   VAL  76           HA       VAL  76 -28.569   5.017  -2.644
    3    HB   VAL  76           HB       VAL  76 -28.887   6.546  -0.025
    4   HG11  VAL  76          HG11      VAL  76 -26.522   5.201  -1.344
    5   HG13  VAL  76          HG12      VAL  76 -27.252   4.794   0.210
    6   HG12  VAL  76          HG13      VAL  76 -26.384   6.317   0.016
    7   HG22  VAL  76          HG21      VAL  76 -28.181   8.419  -0.942
    8   HG21  VAL  76          HG22      VAL  76 -28.705   7.695  -2.464
    9   HG23  VAL  76          HG23      VAL  76 -27.012   7.598  -1.976

  No H/Q in entry =           9
  In of MODEL   79
    1    H    GLU  77           H        GLU  77 -28.388   2.875  -1.979
    2    HA   GLU  77           HA       GLU  77 -29.233   2.156   0.677
    3    HB2  GLU  77           HB2      GLU  77 -30.849   0.516   0.154
    4    HB3  GLU  77           HB3      GLU  77 -31.367   2.029  -0.591
    5    HG2  GLU  77           HG2      GLU  77 -30.727   1.215  -2.750
    6    HG3  GLU  77           HG3      GLU  77 -30.115  -0.273  -2.032

  No H/Q in entry =           6
  In of MODEL   79
    1    H    VAL  78           H        VAL  78 -28.941   0.081   1.389
    2    HA   VAL  78           HA       VAL  78 -26.269  -0.740   0.568
    3    HB   VAL  78           HB       VAL  78 -28.030  -1.550   2.921
    4   HG11  VAL  78          HG11      VAL  78 -25.685  -2.830   1.868
    5   HG13  VAL  78          HG12      VAL  78 -26.624  -3.259   3.299
    6   HG12  VAL  78          HG13      VAL  78 -25.294  -2.109   3.428
    7   HG22  VAL  78          HG21      VAL  78 -26.580  -0.174   4.255
    8   HG21  VAL  78          HG22      VAL  78 -27.282   0.775   2.945
    9   HG23  VAL  78          HG23      VAL  78 -25.608   0.225   2.838

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ILE  79           H        ILE  79 -25.737  -2.673  -0.284
    2    HA   ILE  79           HA       ILE  79 -27.790  -4.159  -1.636
    3    HB   ILE  79           HB       ILE  79 -24.810  -4.713  -1.348
    4   HG12  ILE  79          HG12      ILE  79 -26.392  -3.644  -3.690
    5   HG13  ILE  79          HG13      ILE  79 -25.528  -2.618  -2.543
    6   HG22  ILE  79          HG21      ILE  79 -25.882  -5.934  -3.659
    7   HG21  ILE  79          HG22      ILE  79 -26.899  -6.413  -2.299
    8   HG23  ILE  79          HG23      ILE  79 -25.160  -6.710  -2.250
    9   HD13  ILE  79          HD11      ILE  79 -24.082  -2.788  -4.333
   10   HD12  ILE  79          HD12      ILE  79 -24.436  -4.498  -4.581
   11   HD11  ILE  79          HD13      ILE  79 -23.472  -3.989  -3.194

  No H/Q in entry =          11
  In of MODEL   79
    1    H    ASP  80           H        ASP  80 -28.686  -6.059  -1.025
    2    HA   ASP  80           HA       ASP  80 -28.692  -6.898   1.641
    3    HB2  ASP  80           HB2      ASP  80 -30.422  -7.493  -0.017
    4    HB3  ASP  80           HB3      ASP  80 -29.260  -8.532  -0.841

  No H/Q in entry =           4
  In of MODEL   79
    1    H    SER  81           H        SER  81 -27.190  -8.024   2.825
    2    HA   SER  81           HA       SER  81 -24.681  -8.761   1.697
    3    HB2  SER  81           HB2      SER  81 -24.179  -9.742   3.897
    4    HB3  SER  81           HB3      SER  81 -24.871  -8.129   4.063
    5    HG   SER  81           HG       SER  81 -25.875 -10.585   4.788

  No H/Q in entry =           5
  In of MODEL   79
    1    H    LEU  82           H        LEU  82 -27.420 -10.814   2.015
    2    HA   LEU  82           HA       LEU  82 -25.890 -13.211   1.578
    3    HB2  LEU  82           HB2      LEU  82 -28.814 -12.563   1.263
    4    HB3  LEU  82           HB3      LEU  82 -28.130 -14.178   1.084
    5    HG   LEU  82           HG       LEU  82 -28.074 -12.566   3.617
    6   HD11  LEU  82          HD11      LEU  82 -30.363 -13.239   2.941
    7   HD13  LEU  82          HD12      LEU  82 -29.815 -14.101   4.380
    8   HD12  LEU  82          HD13      LEU  82 -29.813 -14.911   2.813
    9   HD23  LEU  82          HD21      LEU  82 -27.545 -14.963   4.444
   10   HD22  LEU  82          HD22      LEU  82 -26.264 -14.051   3.645
   11   HD21  LEU  82          HD23      LEU  82 -27.149 -15.290   2.755

  No H/Q in entry =          11
  In of MODEL   79
    1    H    LEU  83           H        LEU  83 -27.787 -11.008  -0.427
    2    HA   LEU  83           HA       LEU  83 -27.557 -12.426  -2.863
    3    HB2  LEU  83           HB2      LEU  83 -27.945  -9.500  -2.290
    4    HB3  LEU  83           HB3      LEU  83 -27.954 -10.182  -3.915
    5    HG   LEU  83           HG       LEU  83 -30.032 -10.496  -1.768
    6   HD13  LEU  83          HD11      LEU  83 -30.747  -8.665  -2.890
    7   HD12  LEU  83          HD12      LEU  83 -31.199  -9.803  -4.157
    8   HD11  LEU  83          HD13      LEU  83 -29.654  -8.957  -4.241
    9   HD23  LEU  83          HD21      LEU  83 -30.136 -11.815  -4.466
   10   HD22  LEU  83          HD22      LEU  83 -31.136 -12.121  -3.047
   11   HD21  LEU  83          HD23      LEU  83 -29.452 -12.644  -3.068

  No H/Q in entry =          11
  In of MODEL   79
    1    H    TYR  84           H        TYR  84 -25.607 -10.024  -1.206
    2    HA   TYR  84           HA       TYR  84 -23.701  -9.607  -3.312
    3    HB2  TYR  84           HB2      TYR  84 -24.249  -8.081  -1.315
    4    HB3  TYR  84           HB3      TYR  84 -23.225  -9.161  -0.371
    5    HD1  TYR  84           HD1      TYR  84 -20.880  -8.931  -0.389
    6    HD2  TYR  84           HD2      TYR  84 -23.219  -6.878  -3.313
    7    HE1  TYR  84           HE1      TYR  84 -18.863  -7.708  -1.126
    8    HE2  TYR  84           HE2      TYR  84 -21.210  -5.656  -4.067
    9    HH   TYR  84           HH       TYR  84 -19.058  -5.116  -3.471

  No H/Q in entry =           9
  In of MODEL   79
    1    H    GLY  85           H        GLY  85 -23.538 -11.543  -0.316
    2    HA3  GLY  85           HA2      GLY  85 -20.963 -12.526  -0.729
    3    HA2  GLY  85           HA3      GLY  85 -22.221 -13.336   0.204

  No H/Q in entry =           3
  In of MODEL   79
    1    H    LYS  86           H        LYS  86 -24.033 -13.737  -1.880
    2    HA   LYS  86           HA       LYS  86 -22.984 -16.151  -3.065
    3    HB2  LYS  86           HB2      LYS  86 -25.615 -14.699  -3.359
    4    HB3  LYS  86           HB3      LYS  86 -25.285 -16.342  -3.904
    5    HG2  LYS  86           HG2      LYS  86 -25.044 -15.615  -1.031
    6    HG3  LYS  86           HG3      LYS  86 -26.609 -15.990  -1.754
    7    HD2  LYS  86           HD2      LYS  86 -24.311 -17.794  -2.341
    8    HD3  LYS  86           HD3      LYS  86 -25.062 -17.898  -0.749
    9    HE2  LYS  86           HE2      LYS  86 -27.259 -18.205  -1.859
   10    HE3  LYS  86           HE3      LYS  86 -26.427 -18.233  -3.414
   11    HZ3  LYS  86           HZ1      LYS  86 -25.135 -20.129  -2.655
   12    HZ2  LYS  86           HZ2      LYS  86 -26.796 -20.469  -2.567
   13    HZ1  LYS  86           HZ3      LYS  86 -25.929 -20.100  -1.155

  No H/Q in entry =          13
  In of MODEL   79
    1    H    VAL  87           H        VAL  87 -22.920 -12.959  -4.032
    2    HA   VAL  87           HA       VAL  87 -22.572 -11.834  -5.994
    3    HB   VAL  87           HB       VAL  87 -21.525 -14.350  -7.303
    4   HG11  VAL  87          HG11      VAL  87 -21.584 -11.872  -8.223
    5   HG13  VAL  87          HG12      VAL  87 -20.164 -12.883  -8.492
    6   HG12  VAL  87          HG13      VAL  87 -20.159 -11.681  -7.202
    7   HG22  VAL  87          HG21      VAL  87 -20.558 -14.646  -5.181
    8   HG21  VAL  87          HG22      VAL  87 -20.252 -12.921  -4.990
    9   HG23  VAL  87          HG23      VAL  87 -19.319 -13.860  -6.155

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ASP  88           H        ASP  88 -25.101 -12.441  -5.675
    2    HA   ASP  88           HA       ASP  88 -26.193 -13.701  -8.063
    3    HB2  ASP  88           HB2      ASP  88 -27.233 -13.880  -5.752
    4    HB3  ASP  88           HB3      ASP  88 -27.664 -12.177  -5.900

  No H/Q in entry =           4
  In of MODEL   79
    1    H    GLY  89           H        GLY  89 -25.446 -12.490  -9.720
    2    HA3  GLY  89           HA2      GLY  89 -25.592  -9.721  -9.989
    3    HA2  GLY  89           HA3      GLY  89 -25.557 -10.873 -11.322

  No H/Q in entry =           3
  In of MODEL   79
    1    H    LEU  90           H        LEU  90 -28.025 -12.189 -10.887
    2    HA   LEU  90           HA       LEU  90 -29.795 -10.261 -12.077
    3    HB2  LEU  90           HB2      LEU  90 -29.876 -12.670 -12.603
    4    HB3  LEU  90           HB3      LEU  90 -30.415 -12.991 -10.954
    5    HG   LEU  90           HG       LEU  90 -32.514 -11.861 -11.382
    6   HD13  LEU  90          HD11      LEU  90 -32.290 -10.157 -12.894
    7   HD12  LEU  90          HD12      LEU  90 -32.823 -11.415 -14.011
    8   HD11  LEU  90          HD13      LEU  90 -31.107 -11.036 -13.865
    9   HD23  LEU  90          HD21      LEU  90 -32.420 -13.549 -13.777
   10   HD22  LEU  90          HD22      LEU  90 -33.426 -13.669 -12.333
   11   HD21  LEU  90          HD23      LEU  90 -31.779 -14.299 -12.315

  No H/Q in entry =          11
  In of MODEL   79
    1    H    GLY  91           H        GLY  91 -29.699 -11.688  -8.857
    2    HA3  GLY  91           HA2      GLY  91 -32.044 -10.527  -7.885
    3    HA2  GLY  91           HA3      GLY  91 -30.675 -11.052  -6.906

  No H/Q in entry =           3
  In of MODEL   79
    1    H    VAL  92           H        VAL  92 -28.721  -9.266  -7.771
    2    HA   VAL  92           HA       VAL  92 -29.515  -6.920  -6.291
    3    HB   VAL  92           HB       VAL  92 -26.947  -7.454  -7.829
    4   HG12  VAL  92          HG11      VAL  92 -27.132  -5.513  -5.551
    5   HG11  VAL  92          HG12      VAL  92 -27.764  -4.998  -7.117
    6   HG13  VAL  92          HG13      VAL  92 -26.075  -5.481  -6.964
    7   HG22  VAL  92          HG21      VAL  92 -26.768  -9.005  -6.197
    8   HG21  VAL  92          HG22      VAL  92 -27.924  -8.188  -5.143
    9   HG23  VAL  92          HG23      VAL  92 -26.262  -7.607  -5.248

  No H/Q in entry =           9
  In of MODEL   79
    1    H    LEU  93           H        LEU  93 -29.056  -7.667  -9.686
    2    HA   LEU  93           HA       LEU  93 -29.357  -5.052 -10.685
    3    HB2  LEU  93           HB2      LEU  93 -28.709  -6.947 -12.090
    4    HB3  LEU  93           HB3      LEU  93 -30.312  -7.653 -11.878
    5    HG   LEU  93           HG       LEU  93 -31.282  -5.707 -13.067
    6   HD11  LEU  93          HD11      LEU  93 -29.424  -4.118 -12.568
    7   HD13  LEU  93          HD12      LEU  93 -29.834  -4.185 -14.282
    8   HD12  LEU  93          HD13      LEU  93 -28.402  -5.021 -13.686
    9   HD23  LEU  93          HD21      LEU  93 -30.211  -6.339 -15.321
   10   HD22  LEU  93          HD22      LEU  93 -31.082  -7.565 -14.400
   11   HD21  LEU  93          HD23      LEU  93 -29.316  -7.528 -14.373

  No H/Q in entry =          11
  In of MODEL   79
    1    H    LYS  94           H        LYS  94 -31.773  -7.553  -9.817
    2    HA   LYS  94           HA       LYS  94 -34.090  -6.103 -10.516
    3    HB2  LYS  94           HB2      LYS  94 -33.635  -8.244  -8.445
    4    HB3  LYS  94           HB3      LYS  94 -35.220  -7.539  -8.758
    5    HG2  LYS  94           HG2      LYS  94 -35.101  -8.371 -11.071
    6    HG3  LYS  94           HG3      LYS  94 -33.554  -9.129 -10.698
    7    HD2  LYS  94           HD2      LYS  94 -34.720 -10.408  -8.861
    8    HD3  LYS  94           HD3      LYS  94 -36.247  -9.758  -9.459
    9    HE2  LYS  94           HE2      LYS  94 -35.702 -10.746 -11.693
   10    HE3  LYS  94           HE3      LYS  94 -34.308 -11.527 -10.948
   11    HZ3  LYS  94           HZ1      LYS  94 -36.170 -13.033 -11.113
   12    HZ2  LYS  94           HZ2      LYS  94 -37.150 -11.975 -10.213
   13    HZ1  LYS  94           HZ3      LYS  94 -35.810 -12.721  -9.484

  No H/Q in entry =          13
  In of MODEL   79
    1    H    ALA  95           H        ALA  95 -32.321  -6.169  -7.435
    2    HA   ALA  95           HA       ALA  95 -34.180  -4.536  -6.025
    3    HB2  ALA  95           HB1      ALA  95 -31.828  -5.922  -5.415
    4    HB3  ALA  95           HB2      ALA  95 -32.818  -4.980  -4.300
    5    HB1  ALA  95           HB3      ALA  95 -31.447  -4.227  -5.116

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ALA  96           H        ALA  96 -31.493  -3.759  -8.095
    2    HA   ALA  96           HA       ALA  96 -31.380  -0.981  -7.385
    3    HB2  ALA  96           HB1      ALA  96 -29.980  -0.819  -9.475
    4    HB3  ALA  96           HB2      ALA  96 -30.297  -2.530  -9.760
    5    HB1  ALA  96           HB3      ALA  96 -29.401  -2.026  -8.326

  No H/Q in entry =           5
  In of MODEL   79
    1    H    VAL  97           H        VAL  97 -32.884  -2.742 -10.057
    2    HA   VAL  97           HA       VAL  97 -33.907  -0.462 -11.385
    3    HB   VAL  97           HB       VAL  97 -34.748  -3.378 -11.373
    4   HG11  VAL  97          HG11      VAL  97 -36.509  -1.365 -11.937
    5   HG13  VAL  97          HG12      VAL  97 -36.573  -2.973 -12.656
    6   HG12  VAL  97          HG13      VAL  97 -35.790  -1.653 -13.522
    7   HG21  VAL  97          HG21      VAL  97 -33.414  -1.613 -13.427
    8   HG23  VAL  97          HG22      VAL  97 -33.881  -3.294 -13.685
    9   HG22  VAL  97          HG23      VAL  97 -32.648  -2.894 -12.487

  No H/Q in entry =           9
  In of MODEL   79
    1    H    ALA  98           H        ALA  98 -35.159  -2.567  -8.820
    2    HA   ALA  98           HA       ALA  98 -37.710  -1.381  -8.539
    3    HB1  ALA  98           HB1      ALA  98 -36.741  -3.566  -7.439
    4    HB3  ALA  98           HB2      ALA  98 -37.926  -2.607  -6.550
    5    HB2  ALA  98           HB3      ALA  98 -36.210  -2.470  -6.164

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ALA  99           H        ALA  99 -34.651  -0.580  -6.858
    2    HA   ALA  99           HA       ALA  99 -35.783   1.456  -5.262
    3    HB1  ALA  99           HB1      ALA  99 -33.134   0.517  -5.943
    4    HB2  ALA  99           HB2      ALA  99 -33.700   1.307  -4.471
    5    HB3  ALA  99           HB3      ALA  99 -33.188   2.276  -5.852

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ILE 100           H        ILE 100 -34.684   1.496  -8.602
    2    HA   ILE 100           HA       ILE 100 -34.822   4.340  -8.889
    3    HB   ILE 100           HB       ILE 100 -34.909   2.138 -10.979
    4   HG12  ILE 100          HG12      ILE 100 -32.731   4.118 -10.316
    5   HG13  ILE 100          HG13      ILE 100 -32.800   2.487  -9.649
    6   HG21  ILE 100          HG21      ILE 100 -35.291   5.059 -11.183
    7   HG23  ILE 100          HG22      ILE 100 -35.795   3.772 -12.279
    8   HG22  ILE 100          HG23      ILE 100 -34.133   4.365 -12.318
    9   HD12  ILE 100          HD11      ILE 100 -32.208   3.373 -12.435
   10   HD11  ILE 100          HD12      ILE 100 -32.894   1.772 -12.155
   11   HD13  ILE 100          HD13      ILE 100 -31.354   2.212 -11.418

  No H/Q in entry =          11
  In of MODEL   79
    1    H    LYS 101           H        LYS 101 -37.138   1.745  -9.595
    2    HA   LYS 101           HA       LYS 101 -39.179   3.398 -10.668
    3    HB2  LYS 101           HB2      LYS 101 -39.119   0.649  -9.477
    4    HB3  LYS 101           HB3      LYS 101 -40.655   1.422  -9.866
    5    HG2  LYS 101           HG2      LYS 101 -40.140   1.498 -12.157
    6    HG3  LYS 101           HG3      LYS 101 -38.454   1.077 -11.864
    7    HD2  LYS 101           HD2      LYS 101 -39.714  -0.835 -12.728
    8    HD3  LYS 101           HD3      LYS 101 -39.120  -1.136 -11.096
    9    HE2  LYS 101           HE2      LYS 101 -41.200  -1.792 -10.610
   10    HE3  LYS 101           HE3      LYS 101 -41.633  -0.082 -10.659
   11    HZ3  LYS 101           HZ1      LYS 101 -42.490  -0.276 -12.787
   12    HZ2  LYS 101           HZ2      LYS 101 -42.983  -1.727 -12.055
   13    HZ1  LYS 101           HZ3      LYS 101 -41.658  -1.720 -13.117

  No H/Q in entry =          13
  In of MODEL   79
    1    H    LYS 102           H        LYS 102 -38.763   1.987  -7.418
    2    HA   LYS 102           HA       LYS 102 -41.013   3.238  -6.288
    3    HB2  LYS 102           HB2      LYS 102 -39.820   1.378  -5.209
    4    HB3  LYS 102           HB3      LYS 102 -38.420   2.421  -4.966
    5    HG2  LYS 102           HG2      LYS 102 -39.744   3.866  -3.523
    6    HG3  LYS 102           HG3      LYS 102 -41.147   2.828  -3.770
    7    HD2  LYS 102           HD2      LYS 102 -39.964   0.969  -2.681
    8    HD3  LYS 102           HD3      LYS 102 -38.561   2.009  -2.433
    9    HE2  LYS 102           HE2      LYS 102 -39.919   3.535  -1.081
   10    HE3  LYS 102           HE3      LYS 102 -41.340   2.526  -1.352
   11    HZ1  LYS 102           HZ1      LYS 102 -39.660   0.773  -0.279
   12    HZ3  LYS 102           HZ2      LYS 102 -40.774   1.693   0.611
   13    HZ2  LYS 102           HZ3      LYS 102 -39.155   2.193   0.502

  No H/Q in entry =          13
  In of MODEL   79
    1    H    ALA 103           H        ALA 103 -38.024   4.567  -7.279
    2    HA   ALA 103           HA       ALA 103 -38.247   6.924  -5.553
    3    HB2  ALA 103           HB1      ALA 103 -36.219   7.596  -7.108
    4    HB3  ALA 103           HB2      ALA 103 -36.199   5.870  -7.468
    5    HB1  ALA 103           HB3      ALA 103 -35.994   6.428  -5.807

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ALA 104           H        ALA 104 -38.819   6.126  -8.892
    2    HA   ALA 104           HA       ALA 104 -39.356   8.905  -9.585
    3    HB2  ALA 104           HB1      ALA 104 -39.369   8.188 -11.773
    4    HB1  ALA 104           HB2      ALA 104 -40.124   6.645 -11.374
    5    HB3  ALA 104           HB3      ALA 104 -38.404   6.892 -11.070

  No H/Q in entry =           5
  In of MODEL   79
    1    H    ALA 105           H        ALA 105 -41.023   6.862  -7.764
    2    HA   ALA 105           HA       ALA 105 -43.429   8.287  -7.811
    3    HB2  ALA 105           HB1      ALA 105 -44.150   7.392  -9.843
    4    HB3  ALA 105           HB2      ALA 105 -44.821   6.238  -8.693
    5    HB1  ALA 105           HB3      ALA 105 -43.341   5.849  -9.567

  No H/Q in entry =           5
  In of MODEL   80
    1    H1   ALA   1           H3       ALA   1 -12.270 -15.699  -2.466
    2    H2   ALA   1           H2       ALA   1 -11.332 -16.843  -3.306
    3    H3   ALA   1           H1       ALA   1 -12.471 -15.893  -4.140
    4    HA   ALA   1           HA       ALA   1 -13.876 -17.588  -3.905
    5    HB3  ALA   1           HB1      ALA   1 -12.488 -19.366  -3.443
    6    HB1  ALA   1           HB2      ALA   1 -13.246 -19.253  -1.855
    7    HB2  ALA   1           HB3      ALA   1 -11.667 -18.518  -2.132

  No H/Q in entry =           7
  In of MODEL   80
    1    H    GLU   2           H        GLU   2 -15.505 -18.439  -2.254
    2    HA   GLU   2           HA       GLU   2 -17.148 -16.713  -1.195
    3    HB2  GLU   2           HB2      GLU   2 -16.220 -19.144   0.348
    4    HB3  GLU   2           HB3      GLU   2 -17.741 -18.288   0.601
    5    HG2  GLU   2           HG2      GLU   2 -18.723 -19.369  -1.136
    6    HG3  GLU   2           HG3      GLU   2 -17.397 -18.972  -2.218

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLU   3           H        GLU   3 -15.245 -18.077   1.429
    2    HA   GLU   3           HA       GLU   3 -15.459 -15.725   2.989
    3    HB2  GLU   3           HB2      GLU   3 -13.884 -18.278   3.239
    4    HB3  GLU   3           HB3      GLU   3 -13.649 -16.961   4.388
    5    HG2  GLU   3           HG2      GLU   3 -15.844 -17.104   5.202
    6    HG3  GLU   3           HG3      GLU   3 -16.440 -17.900   3.752

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LEU   4           H        LEU   4 -12.508 -17.213   1.600
    2    HA   LEU   4           HA       LEU   4 -10.667 -15.318   2.204
    3    HB2  LEU   4           HB2      LEU   4 -10.899 -16.611  -0.523
    4    HB3  LEU   4           HB3      LEU   4  -9.445 -15.898   0.165
    5    HG   LEU   4           HG       LEU   4 -10.950 -18.290   1.272
    6   HD13  LEU   4          HD11      LEU   4  -9.322 -19.651   0.344
    7   HD12  LEU   4          HD12      LEU   4  -8.107 -18.373   0.320
    8   HD11  LEU   4          HD13      LEU   4  -9.394 -18.389  -0.884
    9   HD23  LEU   4          HD21      LEU   4  -8.702 -18.365   2.657
   10   HD22  LEU   4          HD22      LEU   4 -10.019 -17.320   3.186
   11   HD21  LEU   4          HD23      LEU   4  -8.653 -16.636   2.306

  No H/Q in entry =          11
  In of MODEL   80
    1    H    GLU   5           H        GLU   5 -12.997 -15.099  -0.474
    2    HA   GLU   5           HA       GLU   5 -11.982 -12.618  -1.470
    3    HB2  GLU   5           HB2      GLU   5 -13.327 -14.189  -2.842
    4    HB3  GLU   5           HB3      GLU   5 -14.728 -13.840  -1.828
    5    HG2  GLU   5           HG2      GLU   5 -14.613 -11.467  -2.451
    6    HG3  GLU   5           HG3      GLU   5 -13.186 -11.786  -3.437

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLU   6           H        GLU   6 -14.714 -13.487   0.617
    2    HA   GLU   6           HA       GLU   6 -15.608 -10.808   1.019
    3    HB2  GLU   6           HB2      GLU   6 -17.049 -12.785   1.414
    4    HB3  GLU   6           HB3      GLU   6 -16.016 -13.252   2.764
    5    HG2  GLU   6           HG2      GLU   6 -16.523 -11.135   3.904
    6    HG3  GLU   6           HG3      GLU   6 -17.528 -10.632   2.547

  No H/Q in entry =           6
  In of MODEL   80
    1    H    VAL   7           H        VAL   7 -13.312 -12.930   2.591
    2    HA   VAL   7           HA       VAL   7 -12.843 -11.360   4.921
    3    HB   VAL   7           HB       VAL   7 -11.145 -13.409   3.472
    4   HG11  VAL   7          HG11      VAL   7 -10.675 -11.881   6.038
    5   HG13  VAL   7          HG12      VAL   7  -9.574 -12.098   4.679
    6   HG12  VAL   7          HG13      VAL   7  -9.934 -13.455   5.747
    7   HG21  VAL   7          HG21      VAL   7 -13.400 -13.965   4.687
    8   HG23  VAL   7          HG22      VAL   7 -12.475 -13.697   6.164
    9   HG22  VAL   7          HG23      VAL   7 -11.985 -14.957   5.034

  No H/Q in entry =           9
  In of MODEL   80
    1    H    VAL   8           H        VAL   8 -11.327 -11.477   1.713
    2    HA   VAL   8           HA       VAL   8  -9.257  -9.613   2.212
    3    HB   VAL   8           HB       VAL   8 -10.712 -10.368  -0.328
    4   HG11  VAL   8          HG11      VAL   8  -8.536  -8.358   0.192
    5   HG13  VAL   8          HG12      VAL   8  -9.930  -8.235  -0.883
    6   HG12  VAL   8          HG13      VAL   8  -8.557  -9.247  -1.332
    7   HG22  VAL   8          HG21      VAL   8  -8.907 -11.838  -0.718
    8   HG21  VAL   8          HG22      VAL   8  -9.073 -11.944   1.032
    9   HG23  VAL   8          HG23      VAL   8  -7.813 -10.934   0.331

  No H/Q in entry =           9
  In of MODEL   80
    1    H    MET   9           H        MET   9 -12.599  -9.208   1.047
    2    HA   MET   9           HA       MET   9 -12.523  -6.431   0.615
    3    HB2  MET   9           HB2      MET   9 -14.721  -8.339   1.376
    4    HB3  MET   9           HB3      MET   9 -15.030  -6.604   1.293
    5    HG2  MET   9           HG2      MET   9 -13.949  -6.704  -1.044
    6    HG3  MET   9           HG3      MET   9 -14.145  -8.453  -0.922
    7    HE2  MET   9           HE1      MET   9 -16.748  -8.933   0.664
    8    HE1  MET   9           HE2      MET   9 -16.224  -9.722  -0.821
    9    HE3  MET   9           HE3      MET   9 -17.863  -9.088  -0.700

  No H/Q in entry =           9
  In of MODEL   80
    1    H    GLY  10           H        GLY  10 -13.199  -8.323   3.539
    2    HA3  GLY  10           HA2      GLY  10 -13.741  -6.138   5.260
    3    HA2  GLY  10           HA3      GLY  10 -13.184  -7.730   5.773

  No H/Q in entry =           3
  In of MODEL   80
    1    H    LEU  11           H        LEU  11 -10.737  -7.862   4.462
    2    HA   LEU  11           HA       LEU  11  -9.034  -6.437   6.223
    3    HB2  LEU  11           HB2      LEU  11  -8.488  -7.860   3.615
    4    HB3  LEU  11           HB3      LEU  11  -7.217  -7.161   4.617
    5    HG   LEU  11           HG       LEU  11  -9.228  -9.188   5.627
    6   HD13  LEU  11          HD11      LEU  11  -8.008 -10.427   4.064
    7   HD12  LEU  11          HD12      LEU  11  -7.077 -10.671   5.540
    8   HD11  LEU  11          HD13      LEU  11  -6.530  -9.506   4.335
    9   HD22  LEU  11          HD21      LEU  11  -8.375  -8.180   7.547
   10   HD21  LEU  11          HD22      LEU  11  -6.834  -7.783   6.787
   11   HD23  LEU  11          HD23      LEU  11  -7.167  -9.439   7.294

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  12           H        ILE  12  -9.928  -5.883   2.833
    2    HA   ILE  12           HA       ILE  12  -8.227  -3.658   2.412
    3    HB   ILE  12           HB       ILE  12 -10.880  -4.323   1.111
    4   HG12  ILE  12          HG12      ILE  12  -8.851  -5.977   1.031
    5   HG13  ILE  12          HG13      ILE  12  -9.697  -5.604  -0.457
    6   HG21  ILE  12          HG21      ILE  12  -8.661  -2.415   0.311
    7   HG23  ILE  12          HG22      ILE  12 -10.337  -2.005   0.650
    8   HG22  ILE  12          HG23      ILE  12  -9.925  -2.943  -0.756
    9   HD13  ILE  12          HD11      ILE  12  -7.961  -4.049  -1.097
   10   HD12  ILE  12          HD12      ILE  12  -7.189  -5.562  -0.628
   11   HD11  ILE  12          HD13      ILE  12  -7.185  -4.201   0.469

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  13           H        ILE  13 -11.591  -3.916   3.499
    2    HA   ILE  13           HA       ILE  13 -12.043  -1.127   3.771
    3    HB   ILE  13           HB       ILE  13 -13.257  -3.542   5.134
    4   HG12  ILE  13          HG12      ILE  13 -13.464  -2.988   2.587
    5   HG13  ILE  13          HG13      ILE  13 -14.883  -3.483   3.487
    6   HG22  ILE  13          HG21      ILE  13 -15.162  -1.863   5.641
    7   HG21  ILE  13          HG22      ILE  13 -13.951  -0.610   5.405
    8   HG23  ILE  13          HG23      ILE  13 -13.737  -1.810   6.676
    9   HD11  ILE  13          HD11      ILE  13 -14.171  -0.569   3.159
   10   HD13  ILE  13          HD12      ILE  13 -15.698  -1.280   3.638
   11   HD12  ILE  13          HD13      ILE  13 -15.161  -1.440   1.982

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ASN  14           H        ASN  14 -10.943  -3.624   6.045
    2    HA   ASN  14           HA       ASN  14 -10.742  -1.988   8.332
    3    HB2  ASN  14           HB2      ASN  14 -10.496  -4.596   8.008
    4    HB3  ASN  14           HB3      ASN  14  -8.785  -4.214   7.855
    5   HD21  ASN  14          HD21      ASN  14  -9.430  -5.739  10.028
    6   HD22  ASN  14          HD22      ASN  14  -9.402  -4.820  11.453

  No H/Q in entry =           6
  In of MODEL   80
    1    H    SER  15           H        SER  15  -8.337  -2.815   5.844
    2    HA   SER  15           HA       SER  15  -6.193  -1.329   6.922
    3    HB2  SER  15           HB2      SER  15  -5.169  -1.545   4.766
    4    HB3  SER  15           HB3      SER  15  -6.128  -3.003   4.987
    5    HG   SER  15           HG       SER  15  -6.906  -0.661   3.586

  No H/Q in entry =           5
  In of MODEL   80
    1    H    GLY  16           H        GLY  16  -8.788  -0.454   4.671
    2    HA3  GLY  16           HA2      GLY  16  -7.923   2.185   4.123
    3    HA2  GLY  16           HA3      GLY  16  -9.575   1.594   3.958

  No H/Q in entry =           3
  In of MODEL   80
    1    H    GLN  17           H        GLN  17 -10.124   0.867   6.606
    2    HA   GLN  17           HA       GLN  17 -10.829   3.372   7.748
    3    HB2  GLN  17           HB2      GLN  17 -10.733   0.591   8.932
    4    HB3  GLN  17           HB3      GLN  17 -11.368   1.993   9.794
    5    HG2  GLN  17           HG2      GLN  17 -12.369   1.045   7.092
    6    HG3  GLN  17           HG3      GLN  17 -13.149   0.675   8.630
    7   HE21  GLN  17          HE21      GLN  17 -13.510   2.699   6.081
    8   HE22  GLN  17          HE22      GLN  17 -14.145   4.064   6.868

  No H/Q in entry =           8
  In of MODEL   80
    1    H    ALA  18           H        ALA  18  -8.205   1.086   8.370
    2    HA   ALA  18           HA       ALA  18  -7.110   2.298  10.644
    3    HB2  ALA  18           HB1      ALA  18  -6.501   0.083   9.275
    4    HB3  ALA  18           HB2      ALA  18  -5.339   0.863  10.349
    5    HB1  ALA  18           HB3      ALA  18  -5.258   1.143   8.609

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ARG  19           H        ARG  19  -6.331   2.824   7.197
    2    HA   ARG  19           HA       ARG  19  -4.432   4.869   7.632
    3    HB2  ARG  19           HB2      ARG  19  -4.756   3.730   5.435
    4    HB3  ARG  19           HB3      ARG  19  -6.297   4.573   5.255
    5    HG2  ARG  19           HG2      ARG  19  -5.166   6.743   5.328
    6    HG3  ARG  19           HG3      ARG  19  -3.619   5.956   5.634
    7    HD2  ARG  19           HD2      ARG  19  -3.738   6.549   3.291
    8    HD3  ARG  19           HD3      ARG  19  -3.825   4.788   3.435
    9    HE   ARG  19           HE       ARG  19  -6.458   5.700   3.423
   10   HH21  ARG  19          HH11      ARG  19  -7.649   5.859   1.503
   11   HH22  ARG  19          HH12      ARG  19  -6.824   5.937  -0.015
   12   HH11  ARG  19          HH21      ARG  19  -3.679   5.763   1.395
   13   HH12  ARG  19          HH22      ARG  19  -4.575   5.880  -0.076

  No H/Q in entry =          13
  In of MODEL   80
    1    H    SER  20           H        SER  20  -7.928   4.987   7.024
    2    HA   SER  20           HA       SER  20  -8.284   7.743   6.977
    3    HB2  SER  20           HB2      SER  20 -10.080   6.135   6.476
    4    HB3  SER  20           HB3      SER  20 -10.134   5.669   8.174
    5    HG   SER  20           HG       SER  20 -10.426   8.350   7.322

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LEU  21           H        LEU  21  -8.291   5.558   9.780
    2    HA   LEU  21           HA       LEU  21  -8.735   7.553  11.745
    3    HB2  LEU  21           HB2      LEU  21  -7.384   4.851  11.907
    4    HB3  LEU  21           HB3      LEU  21  -7.696   5.867  13.310
    5    HG   LEU  21           HG       LEU  21  -9.857   4.962  11.385
    6   HD11  LEU  21          HD11      LEU  21  -8.756   3.053  12.571
    7   HD13  LEU  21          HD12      LEU  21 -10.445   3.269  13.030
    8   HD12  LEU  21          HD13      LEU  21  -9.162   3.821  14.106
    9   HD23  LEU  21          HD21      LEU  21 -11.212   5.480  13.593
   10   HD22  LEU  21          HD22      LEU  21 -10.749   6.818  12.547
   11   HD21  LEU  21          HD23      LEU  21  -9.821   6.479  13.999

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ALA  22           H        ALA  22  -5.780   6.180  10.343
    2    HA   ALA  22           HA       ALA  22  -3.903   7.492  11.971
    3    HB2  ALA  22           HB1      ALA  22  -3.484   5.639  10.279
    4    HB1  ALA  22           HB2      ALA  22  -2.288   6.935  10.318
    5    HB3  ALA  22           HB3      ALA  22  -3.503   6.892   9.039

  No H/Q in entry =           5
  In of MODEL   80
    1    H    TYR  23           H        TYR  23  -5.213   8.511   8.786
    2    HA   TYR  23           HA       TYR  23  -3.877  11.007   8.721
    3    HB2  TYR  23           HB2      TYR  23  -4.952  10.098   6.725
    4    HB3  TYR  23           HB3      TYR  23  -6.533  10.202   7.503
    5    HD1  TYR  23           HD1      TYR  23  -3.634  12.247   6.349
    6    HD2  TYR  23           HD2      TYR  23  -7.773  12.214   7.498
    7    HE1  TYR  23           HE1      TYR  23  -3.862  14.598   5.592
    8    HE2  TYR  23           HE2      TYR  23  -8.001  14.565   6.740
    9    HH   TYR  23           HH       TYR  23  -5.729  16.099   4.802

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ALA  24           H        ALA  24  -7.000  10.029  10.092
    2    HA   ALA  24           HA       ALA  24  -7.838  12.618  10.863
    3    HB1  ALA  24           HB1      ALA  24  -9.658  11.366  11.325
    4    HB2  ALA  24           HB2      ALA  24  -8.835  10.794  12.775
    5    HB3  ALA  24           HB3      ALA  24  -8.706   9.883  11.271

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ALA  25           H        ALA  25  -5.840  10.159  12.440
    2    HA   ALA  25           HA       ALA  25  -5.508  11.409  14.944
    3    HB2  ALA  25           HB1      ALA  25  -4.739   9.058  14.123
    4    HB3  ALA  25           HB2      ALA  25  -3.726   9.915  15.287
    5    HB1  ALA  25           HB3      ALA  25  -3.286   9.900  13.579

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LEU  26           H        LEU  26  -3.710  11.711  11.908
    2    HA   LEU  26           HA       LEU  26  -1.753  13.530  12.830
    3    HB2  LEU  26           HB2      LEU  26  -1.447  12.380  10.726
    4    HB3  LEU  26           HB3      LEU  26  -2.919  13.088  10.068
    5    HG   LEU  26           HG       LEU  26  -1.904  15.338  10.208
    6   HD12  LEU  26          HD11      LEU  26   0.633  15.358  10.628
    7   HD11  LEU  26          HD12      LEU  26   0.408  13.776  11.371
    8   HD13  LEU  26          HD13      LEU  26  -0.401  15.191  12.046
    9   HD21  LEU  26          HD21      LEU  26  -0.158  13.285   8.816
   10   HD23  LEU  26          HD22      LEU  26  -0.200  15.006   8.447
   11   HD22  LEU  26          HD23      LEU  26  -1.623  14.009   8.154

  No H/Q in entry =          11
  In of MODEL   80
    1    H    LYS  27           H        LYS  27  -4.932  14.014  11.346
    2    HA   LYS  27           HA       LYS  27  -4.875  16.803  11.150
    3    HB2  LYS  27           HB2      LYS  27  -6.617  15.327  10.159
    4    HB3  LYS  27           HB3      LYS  27  -7.278  15.069  11.773
    5    HG2  LYS  27           HG2      LYS  27  -7.708  17.475  12.010
    6    HG3  LYS  27           HG3      LYS  27  -6.995  17.773  10.421
    7    HD2  LYS  27           HD2      LYS  27  -8.726  16.341   9.379
    8    HD3  LYS  27           HD3      LYS  27  -9.444  16.060  10.967
    9    HE2  LYS  27           HE2      LYS  27  -9.886  18.471  11.211
   10    HE3  LYS  27           HE3      LYS  27  -9.140  18.773   9.638
   11    HZ3  LYS  27           HZ1      LYS  27 -11.517  18.650   9.391
   12    HZ2  LYS  27           HZ2      LYS  27 -11.568  17.133  10.159
   13    HZ1  LYS  27           HZ3      LYS  27 -10.819  17.297   8.640

  No H/Q in entry =          13
  In of MODEL   80
    1    H    GLN  28           H        GLN  28  -5.772  14.715  13.873
    2    HA   GLN  28           HA       GLN  28  -6.670  16.718  15.649
    3    HB2  GLN  28           HB2      GLN  28  -5.272  14.085  16.190
    4    HB3  GLN  28           HB3      GLN  28  -6.012  15.089  17.439
    5    HG2  GLN  28           HG2      GLN  28  -7.475  13.978  15.027
    6    HG3  GLN  28           HG3      GLN  28  -7.533  13.281  16.646
    7   HE21  GLN  28          HE21      GLN  28  -9.394  15.107  14.683
    8   HE22  GLN  28          HE22      GLN  28 -10.145  16.117  15.821

  No H/Q in entry =           8
  In of MODEL   80
    1    H    ALA  29           H        ALA  29  -3.451  15.419  14.966
    2    HA   ALA  29           HA       ALA  29  -2.015  16.813  16.948
    3    HB1  ALA  29           HB1      ALA  29  -0.083  16.120  15.833
    4    HB3  ALA  29           HB2      ALA  29  -0.834  16.247  14.242
    5    HB2  ALA  29           HB3      ALA  29  -1.260  14.914  15.315

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LYS  30           H        LYS  30  -2.864  17.697  13.618
    2    HA   LYS  30           HA       LYS  30  -1.447  20.133  13.522
    3    HB2  LYS  30           HB2      LYS  30  -3.978  19.268  12.107
    4    HB3  LYS  30           HB3      LYS  30  -3.139  20.780  11.767
    5    HG2  LYS  30           HG2      LYS  30  -1.072  19.481  11.256
    6    HG3  LYS  30           HG3      LYS  30  -1.983  17.988  11.498
    7    HD2  LYS  30           HD2      LYS  30  -3.541  18.635   9.701
    8    HD3  LYS  30           HD3      LYS  30  -2.653  20.140   9.461
    9    HE2  LYS  30           HE2      LYS  30  -0.623  18.841   8.884
   10    HE3  LYS  30           HE3      LYS  30  -1.531  17.341   9.093
   11    HZ2  LYS  30           HZ1      LYS  30  -1.347  18.214   6.752
   12    HZ1  LYS  30           HZ2      LYS  30  -2.387  19.479   7.220
   13    HZ3  LYS  30           HZ3      LYS  30  -2.917  17.864   7.288

  No H/Q in entry =          13
  In of MODEL   80
    1    H    GLN  31           H        GLN  31  -4.554  19.291  14.927
    2    HA   GLN  31           HA       GLN  31  -5.307  22.050  15.381
    3    HB2  GLN  31           HB2      GLN  31  -6.499  19.608  16.698
    4    HB3  GLN  31           HB3      GLN  31  -7.252  21.183  16.453
    5    HG2  GLN  31           HG2      GLN  31  -6.540  20.405  13.864
    6    HG3  GLN  31           HG3      GLN  31  -7.072  18.902  14.608
    7   HE21  GLN  31          HE21      GLN  31  -8.471  20.484  12.505
    8   HE22  GLN  31          HE22      GLN  31  -9.985  20.882  13.161

  No H/Q in entry =           8
  In of MODEL   80
    1    H    GLY  32           H        GLY  32  -3.006  20.112  16.703
    2    HA3  GLY  32           HA2      GLY  32  -1.607  20.565  18.508
    3    HA2  GLY  32           HA3      GLY  32  -2.731  21.813  19.031

  No H/Q in entry =           3
  In of MODEL   80
    1    H    ASP  33           H        ASP  33  -4.166  18.781  18.363
    2    HA   ASP  33           HA       ASP  33  -4.585  18.322  21.242
    3    HB2  ASP  33           HB2      ASP  33  -5.991  17.320  18.760
    4    HB3  ASP  33           HB3      ASP  33  -6.342  16.709  20.375

  No H/Q in entry =           4
  In of MODEL   80
    1    H    PHE  34           H        PHE  34  -2.421  17.460  21.550
    2    HA   PHE  34           HA       PHE  34  -1.429  15.208  20.148
    3    HB2  PHE  34           HB2      PHE  34  -0.812  16.186  22.945
    4    HB3  PHE  34           HB3      PHE  34   0.112  14.960  22.078
    5    HD1  PHE  34           HD1      PHE  34  -0.045  18.385  22.817
    6    HD2  PHE  34           HD2      PHE  34   0.778  15.682  19.580
    7    HE1  PHE  34           HE1      PHE  34   1.261  20.152  21.668
    8    HE2  PHE  34           HE2      PHE  34   2.079  17.452  18.436
    9    HZ   PHE  34           HZ       PHE  34   2.323  19.683  19.484

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ALA  35           H        ALA  35  -3.472  15.491  23.008
    2    HA   ALA  35           HA       ALA  35  -3.275  12.827  23.901
    3    HB3  ALA  35           HB1      ALA  35  -5.731  13.464  24.755
    4    HB1  ALA  35           HB2      ALA  35  -5.189  15.080  24.302
    5    HB2  ALA  35           HB3      ALA  35  -4.282  14.150  25.494

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ALA  36           H        ALA  36  -5.713  14.359  21.799
    2    HA   ALA  36           HA       ALA  36  -7.140  11.954  21.316
    3    HB1  ALA  36           HB1      ALA  36  -8.587  13.385  20.359
    4    HB3  ALA  36           HB2      ALA  36  -7.410  13.802  19.113
    5    HB2  ALA  36           HB3      ALA  36  -7.433  14.687  20.638

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ALA  37           H        ALA  37  -4.449  13.531  19.654
    2    HA   ALA  37           HA       ALA  37  -4.418  11.899  17.355
    3    HB3  ALA  37           HB1      ALA  37  -2.419  13.599  18.783
    4    HB2  ALA  37           HB2      ALA  37  -2.946  13.659  17.103
    5    HB1  ALA  37           HB3      ALA  37  -1.800  12.423  17.624

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LYS  38           H        LYS  38  -2.668  11.580  20.435
    2    HA   LYS  38           HA       LYS  38  -1.353   9.174  19.945
    3    HB2  LYS  38           HB2      LYS  38  -1.671  10.935  22.093
    4    HB3  LYS  38           HB3      LYS  38  -2.299   9.408  22.706
    5    HG2  LYS  38           HG2      LYS  38  -0.209   8.278  22.172
    6    HG3  LYS  38           HG3      LYS  38   0.408   9.721  21.361
    7    HD2  LYS  38           HD2      LYS  38   0.579  10.936  23.398
    8    HD3  LYS  38           HD3      LYS  38  -0.447   9.789  24.262
    9    HE2  LYS  38           HE2      LYS  38   1.906   9.461  24.884
   10    HE3  LYS  38           HE3      LYS  38   1.296   8.049  24.017
   11    HZ3  LYS  38           HZ1      LYS  38   2.602   8.464  22.239
   12    HZ2  LYS  38           HZ2      LYS  38   3.559   9.286  23.379
   13    HZ1  LYS  38           HZ3      LYS  38   2.486  10.153  22.387

  No H/Q in entry =          13
  In of MODEL   80
    1    H    ALA  39           H        ALA  39  -4.591   9.683  21.343
    2    HA   ALA  39           HA       ALA  39  -5.166   6.965  21.842
    3    HB3  ALA  39           HB1      ALA  39  -7.314   8.921  21.074
    4    HB2  ALA  39           HB2      ALA  39  -6.417   9.142  22.577
    5    HB1  ALA  39           HB3      ALA  39  -7.341   7.662  22.310

  No H/Q in entry =           5
  In of MODEL   80
    1    H    MET  40           H        MET  40  -5.736   8.985  18.998
    2    HA   MET  40           HA       MET  40  -7.219   7.062  17.532
    3    HB2  MET  40           HB2      MET  40  -5.596   9.451  16.634
    4    HB3  MET  40           HB3      MET  40  -6.624   8.499  15.560
    5    HG2  MET  40           HG2      MET  40  -7.658   9.749  18.118
    6    HG3  MET  40           HG3      MET  40  -7.708  10.586  16.569
    7    HE3  MET  40           HE1      MET  40 -10.296   8.982  14.498
    8    HE2  MET  40           HE2      MET  40  -8.542   9.091  14.353
    9    HE1  MET  40           HE3      MET  40  -9.455  10.460  14.987

  No H/Q in entry =           9
  In of MODEL   80
    1    H    MET  41           H        MET  41  -3.724   7.784  17.662
    2    HA   MET  41           HA       MET  41  -2.970   6.029  15.560
    3    HB2  MET  41           HB2      MET  41  -1.355   6.685  18.037
    4    HB3  MET  41           HB3      MET  41  -0.738   6.036  16.522
    5    HG2  MET  41           HG2      MET  41  -1.883   8.225  15.519
    6    HG3  MET  41           HG3      MET  41  -1.647   8.810  17.165
    7    HE2  MET  41           HE1      MET  41   1.261   6.698  17.528
    8    HE1  MET  41           HE2      MET  41   0.476   7.994  18.427
    9    HE3  MET  41           HE3      MET  41   2.102   8.232  17.788

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ASP  42           H        ASP  42  -3.363   5.552  19.045
    2    HA   ASP  42           HA       ASP  42  -2.339   2.954  19.203
    3    HB2  ASP  42           HB2      ASP  42  -3.209   4.714  21.026
    4    HB3  ASP  42           HB3      ASP  42  -4.640   3.695  20.950

  No H/Q in entry =           4
  In of MODEL   80
    1    H    GLN  43           H        GLN  43  -5.667   4.072  18.698
    2    HA   GLN  43           HA       GLN  43  -6.820   1.490  18.497
    3    HB2  GLN  43           HB2      GLN  43  -7.731   4.147  17.370
    4    HB3  GLN  43           HB3      GLN  43  -8.699   2.672  17.344
    5    HG2  GLN  43           HG2      GLN  43  -8.411   2.546  19.852
    6    HG3  GLN  43           HG3      GLN  43  -7.680   4.148  19.784
    7   HE21  GLN  43          HE21      GLN  43  -9.862   4.234  21.281
    8   HE22  GLN  43          HE22      GLN  43 -11.219   4.817  20.447

  No H/Q in entry =           8
  In of MODEL   80
    1    H    SER  44           H        SER  44  -5.467   3.702  16.091
    2    HA   SER  44           HA       SER  44  -6.169   2.224  13.798
    3    HB2  SER  44           HB2      SER  44  -4.904   4.602  14.248
    4    HB3  SER  44           HB3      SER  44  -3.553   3.601  13.719
    5    HG   SER  44           HG       SER  44  -4.658   4.580  11.956

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ARG  45           H        ARG  45  -3.296   2.096  15.884
    2    HA   ARG  45           HA       ARG  45  -1.821   0.138  14.502
    3    HB2  ARG  45           HB2      ARG  45  -0.977   1.553  16.375
    4    HB3  ARG  45           HB3      ARG  45  -1.975   0.625  17.492
    5    HG2  ARG  45           HG2      ARG  45  -0.750  -1.438  16.848
    6    HG3  ARG  45           HG3      ARG  45   0.271  -0.485  15.774
    7    HD2  ARG  45           HD2      ARG  45   1.007   0.889  17.733
    8    HD3  ARG  45           HD3      ARG  45   0.079  -0.183  18.803
    9    HE   ARG  45           HE       ARG  45   1.775  -1.784  17.223
   10   HH21  ARG  45          HH11      ARG  45   3.670  -2.615  18.063
   11   HH22  ARG  45          HH12      ARG  45   4.443  -1.835  19.397
   12   HH11  ARG  45          HH21      ARG  45   2.083   0.678  19.618
   13   HH12  ARG  45          HH22      ARG  45   3.544   0.032  20.275

  No H/Q in entry =          13
  In of MODEL   80
    1    H    MET  46           H        MET  46  -4.225  -0.177  17.097
    2    HA   MET  46           HA       MET  46  -4.070  -2.977  17.399
    3    HB2  MET  46           HB2      MET  46  -6.223  -0.957  18.004
    4    HB3  MET  46           HB3      MET  46  -6.455  -2.676  18.327
    5    HG2  MET  46           HG2      MET  46  -4.422  -2.693  19.722
    6    HG3  MET  46           HG3      MET  46  -4.178  -0.983  19.401
    7    HE1  MET  46           HE1      MET  46  -4.140  -0.154  21.756
    8    HE3  MET  46           HE2      MET  46  -4.162  -1.824  22.311
    9    HE2  MET  46           HE3      MET  46  -5.243  -0.644  23.047

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ALA  47           H        ALA  47  -6.077  -0.948  15.304
    2    HA   ALA  47           HA       ALA  47  -7.701  -2.990  14.231
    3    HB3  ALA  47           HB1      ALA  47  -8.370  -0.748  13.817
    4    HB1  ALA  47           HB2      ALA  47  -7.880  -1.381  12.245
    5    HB2  ALA  47           HB3      ALA  47  -6.797  -0.319  13.147

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LEU  48           H        LEU  48  -4.574  -1.694  13.189
    2    HA   LEU  48           HA       LEU  48  -4.296  -3.282  10.846
    3    HB2  LEU  48           HB2      LEU  48  -2.236  -2.016  12.661
    4    HB3  LEU  48           HB3      LEU  48  -1.867  -2.736  11.094
    5    HG   LEU  48           HG       LEU  48  -3.880  -0.509  11.482
    6   HD13  LEU  48          HD11      LEU  48  -1.755   0.355  12.154
    7   HD12  LEU  48          HD12      LEU  48  -2.024   0.913  10.503
    8   HD11  LEU  48          HD13      LEU  48  -0.934  -0.440  10.811
    9   HD22  LEU  48          HD21      LEU  48  -4.352  -1.488   9.404
   10   HD21  LEU  48          HD22      LEU  48  -2.671  -1.931   9.112
   11   HD23  LEU  48          HD23      LEU  48  -3.180  -0.249   8.954

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ASN  49           H        ASN  49  -3.260  -3.690  14.194
    2    HA   ASN  49           HA       ASN  49  -1.669  -5.961  13.863
    3    HB2  ASN  49           HB2      ASN  49  -1.674  -4.648  15.913
    4    HB3  ASN  49           HB3      ASN  49  -3.348  -5.081  16.226
    5   HD21  ASN  49          HD21      ASN  49  -0.112  -6.567  15.832
    6   HD22  ASN  49          HD22      ASN  49  -0.416  -7.868  16.879

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLU  50           H        GLU  50  -5.138  -5.667  14.527
    2    HA   GLU  50           HA       GLU  50  -5.667  -8.464  14.629
    3    HB2  GLU  50           HB2      GLU  50  -7.245  -6.769  15.504
    4    HB3  GLU  50           HB3      GLU  50  -7.531  -6.199  13.858
    5    HG2  GLU  50           HG2      GLU  50  -8.408  -8.389  13.214
    6    HG3  GLU  50           HG3      GLU  50  -8.034  -9.038  14.807

  No H/Q in entry =           6
  In of MODEL   80
    1    H    ALA  51           H        ALA  51  -5.714  -6.060  12.037
    2    HA   ALA  51           HA       ALA  51  -6.705  -7.778  10.009
    3    HB2  ALA  51           HB1      ALA  51  -6.470  -5.964   8.644
    4    HB1  ALA  51           HB2      ALA  51  -4.830  -5.627   9.197
    5    HB3  ALA  51           HB3      ALA  51  -6.213  -5.109  10.164

  No H/Q in entry =           5
  In of MODEL   80
    1    H    HIS  52           H        HIS  52  -3.411  -6.895  11.003
    2    HA   HIS  52           HA       HIS  52  -2.017  -8.390   9.054
    3    HB2  HIS  52           HB2      HIS  52  -1.002  -6.655  10.533
    4    HB3  HIS  52           HB3      HIS  52  -1.134  -7.779  11.884
    5    HD1  HIS  52           HD1      HIS  52   0.330  -9.977  11.753
    6    HD2  HIS  52           HD2      HIS  52   1.123  -7.181   8.763
    7    HE1  HIS  52           HE1      HIS  52   2.528 -10.661  10.697
    8    HE2  HIS  52           HE2      HIS  52   3.025  -8.966   8.872

  No H/Q in entry =           8
  In of MODEL   80
    1    H    LEU  53           H        LEU  53  -3.243  -9.265  12.262
    2    HA   LEU  53           HA       LEU  53  -2.064 -11.818  12.454
    3    HB2  LEU  53           HB2      LEU  53  -4.546 -10.623  13.664
    4    HB3  LEU  53           HB3      LEU  53  -4.095 -12.301  13.955
    5    HG   LEU  53           HG       LEU  53  -2.186  -9.992  14.437
    6   HD11  LEU  53          HD11      LEU  53  -4.065 -11.369  16.379
    7   HD13  LEU  53          HD12      LEU  53  -4.146  -9.684  15.867
    8   HD12  LEU  53          HD13      LEU  53  -2.790 -10.245  16.838
    9   HD22  LEU  53          HD21      LEU  53  -0.914 -11.978  14.411
   10   HD21  LEU  53          HD22      LEU  53  -2.224 -12.934  15.097
   11   HD23  LEU  53          HD23      LEU  53  -1.316 -11.835  16.119

  No H/Q in entry =          11
  In of MODEL   80
    1    H    VAL  54           H        VAL  54  -5.164 -10.763  11.086
    2    HA   VAL  54           HA       VAL  54  -6.096 -13.349  10.391
    3    HB   VAL  54           HB       VAL  54  -6.719 -10.609   9.260
    4   HG12  VAL  54          HG11      VAL  54  -8.829 -11.969   8.440
    5   HG11  VAL  54          HG12      VAL  54  -7.728 -13.343   8.513
    6   HG13  VAL  54          HG13      VAL  54  -7.355 -11.969   7.474
    7   HG22  VAL  54          HG21      VAL  54  -7.632 -10.644  11.409
    8   HG21  VAL  54          HG22      VAL  54  -7.899 -12.385  11.386
    9   HG23  VAL  54          HG23      VAL  54  -8.970 -11.318  10.479

  No H/Q in entry =           9
  In of MODEL   80
    1    H    GLN  55           H        GLN  55  -4.201 -10.908   8.612
    2    HA   GLN  55           HA       GLN  55  -4.076 -12.369   6.192
    3    HB2  GLN  55           HB2      GLN  55  -3.454 -10.109   6.008
    4    HB3  GLN  55           HB3      GLN  55  -2.347 -10.197   7.375
    5    HG2  GLN  55           HG2      GLN  55  -0.633 -11.054   6.102
    6    HG3  GLN  55           HG3      GLN  55  -1.712 -12.018   5.103
    7   HE21  GLN  55          HE21      GLN  55  -1.718 -11.324   2.983
    8   HE22  GLN  55          HE22      GLN  55  -1.506  -9.720   2.477

  No H/Q in entry =           8
  In of MODEL   80
    1    H    THR  56           H        THR  56  -1.977 -12.370   9.078
    2    HA   THR  56           HA       THR  56   0.090 -13.984   8.163
    3    HB   THR  56           HB       THR  56  -1.160 -14.230  10.907
    4    HG1  THR  56           HG1      THR  56   0.524 -12.274   9.768
    5   HG23  THR  56          HG21      THR  56   1.040 -14.871  11.611
    6   HG22  THR  56          HG22      THR  56   1.732 -14.433  10.049
    7   HG21  THR  56          HG23      THR  56   0.666 -15.832  10.182

  No H/Q in entry =           7
  In of MODEL   80
    1    H    LYS  57           H        LYS  57  -3.042 -14.997   9.516
    2    HA   LYS  57           HA       LYS  57  -2.618 -17.796   9.266
    3    HB2  LYS  57           HB2      LYS  57  -4.426 -16.747  10.621
    4    HB3  LYS  57           HB3      LYS  57  -5.195 -16.197   9.141
    5    HG2  LYS  57           HG2      LYS  57  -6.323 -18.203   9.845
    6    HG3  LYS  57           HG3      LYS  57  -5.373 -18.599   8.415
    7    HD2  LYS  57           HD2      LYS  57  -3.699 -19.705   9.703
    8    HD3  LYS  57           HD3      LYS  57  -4.305 -19.031  11.214
    9    HE2  LYS  57           HE2      LYS  57  -5.039 -21.340  11.089
   10    HE3  LYS  57           HE3      LYS  57  -6.457 -20.326  10.831
   11    HZ2  LYS  57           HZ1      LYS  57  -5.949 -22.291   9.240
   12    HZ1  LYS  57           HZ2      LYS  57  -4.871 -21.194   8.518
   13    HZ3  LYS  57           HZ3      LYS  57  -6.526 -20.822   8.615

  No H/Q in entry =          13
  In of MODEL   80
    1    H    LEU  58           H        LEU  58  -3.923 -15.339   7.091
    2    HA   LEU  58           HA       LEU  58  -4.736 -17.153   5.079
    3    HB2  LEU  58           HB2      LEU  58  -4.104 -14.210   4.951
    4    HB3  LEU  58           HB3      LEU  58  -4.772 -15.138   3.607
    5    HG   LEU  58           HG       LEU  58  -6.057 -14.953   6.352
    6   HD11  LEU  58          HD11      LEU  58  -6.337 -13.299   3.863
    7   HD13  LEU  58          HD12      LEU  58  -6.327 -12.795   5.553
    8   HD12  LEU  58          HD13      LEU  58  -7.755 -13.575   4.875
    9   HD22  LEU  58          HD21      LEU  58  -7.034 -16.852   5.476
   10   HD21  LEU  58          HD22      LEU  58  -6.686 -16.400   3.807
   11   HD23  LEU  58          HD23      LEU  58  -8.045 -15.664   4.656

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  59           H        ILE  59  -1.592 -15.971   5.951
    2    HA   ILE  59           HA       ILE  59  -0.494 -16.703   3.316
    3    HB   ILE  59           HB       ILE  59   0.288 -14.646   4.890
    4   HG12  ILE  59          HG12      ILE  59   2.367 -16.314   3.460
    5   HG13  ILE  59          HG13      ILE  59   1.184 -15.358   2.606
    6   HG23  ILE  59          HG21      ILE  59   2.113 -15.147   6.295
    7   HG22  ILE  59          HG22      ILE  59   2.366 -16.722   5.579
    8   HG21  ILE  59          HG23      ILE  59   0.997 -16.443   6.654
    9   HD13  ILE  59          HD11      ILE  59   1.957 -13.320   3.692
   10   HD12  ILE  59          HD12      ILE  59   3.325 -14.133   2.936
   11   HD11  ILE  59          HD13      ILE  59   3.080 -14.253   4.679

  No H/Q in entry =          11
  In of MODEL   80
    1    H    GLU  60           H        GLU  60  -0.523 -17.815   6.682
    2    HA   GLU  60           HA       GLU  60   1.491 -19.809   6.419
    3    HB2  GLU  60           HB2      GLU  60   0.722 -19.018   8.607
    4    HB3  GLU  60           HB3      GLU  60  -0.883 -19.676   8.297
    5    HG2  GLU  60           HG2      GLU  60   0.074 -21.950   8.157
    6    HG3  GLU  60           HG3      GLU  60   1.680 -21.291   8.464

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLY  61           H        GLY  61  -2.019 -19.876   5.923
    2    HA3  GLY  61           HA2      GLY  61  -1.792 -22.669   4.961
    3    HA2  GLY  61           HA3      GLY  61  -3.273 -21.922   5.551

  No H/Q in entry =           3
  In of MODEL   80
    1    H    ASP  62           H        ASP  62  -1.021 -20.362   3.355
    2    HA   ASP  62           HA       ASP  62  -3.031 -19.617   1.524
    3    HB2  ASP  62           HB2      ASP  62  -1.146 -18.864   0.128
    4    HB3  ASP  62           HB3      ASP  62  -0.939 -18.375   1.807

  No H/Q in entry =           4
  In of MODEL   80
    1    H    ALA  63           H        ALA  63  -4.012 -21.858   1.231
    2    HA   ALA  63           HA       ALA  63  -2.656 -23.878  -0.257
    3    HB2  ALA  63           HB1      ALA  63  -5.624 -23.440  -0.343
    4    HB3  ALA  63           HB2      ALA  63  -4.825 -24.064   1.100
    5    HB1  ALA  63           HB3      ALA  63  -4.725 -24.958  -0.419

  No H/Q in entry =           5
  In of MODEL   80
    1    H    GLY  64           H        GLY  64  -4.689 -21.126  -1.143
    2    HA3  GLY  64           HA2      GLY  64  -4.939 -19.984  -3.121
    3    HA2  GLY  64           HA3      GLY  64  -3.525 -20.833  -3.722

  No H/Q in entry =           3
  In of MODEL   80
    1    H    GLU  65           H        GLU  65  -5.037 -20.595  -5.716
    2    HA   GLU  65           HA       GLU  65  -7.347 -22.191  -5.917
    3    HB2  GLU  65           HB2      GLU  65  -5.455 -21.161  -8.027
    4    HB3  GLU  65           HB3      GLU  65  -6.960 -22.005  -8.396
    5    HG2  GLU  65           HG2      GLU  65  -8.243 -20.324  -7.169
    6    HG3  GLU  65           HG3      GLU  65  -6.758 -19.500  -6.702

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLY  66           H        GLY  66  -4.003 -22.868  -6.638
    2    HA3  GLY  66           HA2      GLY  66  -4.610 -25.686  -7.222
    3    HA2  GLY  66           HA3      GLY  66  -3.169 -24.833  -7.745

  No H/Q in entry =           3
  In of MODEL   80
    1    H    LYS  67           H        LYS  67  -2.376 -26.970  -6.818
    2    HA   LYS  67           HA       LYS  67  -2.351 -27.515  -4.082
    3    HB2  LYS  67           HB2      LYS  67  -0.443 -28.297  -6.280
    4    HB3  LYS  67           HB3      LYS  67  -0.398 -28.976  -4.648
    5    HG2  LYS  67           HG2      LYS  67  -2.747 -29.691  -4.870
    6    HG3  LYS  67           HG3      LYS  67  -2.803 -29.014  -6.497
    7    HD2  LYS  67           HD2      LYS  67  -1.070 -30.586  -7.235
    8    HD3  LYS  67           HD3      LYS  67  -0.952 -31.241  -5.600
    9    HE2  LYS  67           HE2      LYS  67  -2.393 -32.679  -6.971
   10    HE3  LYS  67           HE3      LYS  67  -3.342 -31.900  -5.705
   11    HZ1  LYS  67           HZ1      LYS  67  -3.328 -30.188  -7.890
   12    HZ3  LYS  67           HZ2      LYS  67  -4.637 -31.077  -7.276
   13    HZ2  LYS  67           HZ3      LYS  67  -3.659 -31.736  -8.499

  No H/Q in entry =          13
  In of MODEL   80
    1    H    MET  68           H        MET  68   0.621 -26.724  -5.755
    2    HA   MET  68           HA       MET  68   1.968 -25.795  -3.446
    3    HB2  MET  68           HB2      MET  68   2.614 -25.623  -6.386
    4    HB3  MET  68           HB3      MET  68   3.723 -25.116  -5.112
    5    HG2  MET  68           HG2      MET  68   3.659 -27.370  -4.136
    6    HG3  MET  68           HG3      MET  68   2.519 -27.887  -5.380
    7    HE1  MET  68           HE1      MET  68   5.783 -26.586  -4.371
    8    HE3  MET  68           HE2      MET  68   5.893 -25.552  -5.795
    9    HE2  MET  68           HE3      MET  68   6.949 -26.956  -5.649

  No H/Q in entry =           9
  In of MODEL   80
    1    H    LYS  69           H        LYS  69   0.455 -24.043  -6.148
    2    HA   LYS  69           HA       LYS  69   1.458 -21.512  -5.611
    3    HB2  LYS  69           HB2      LYS  69  -1.252 -22.107  -6.772
    4    HB3  LYS  69           HB3      LYS  69  -0.315 -20.620  -6.962
    5    HG2  LYS  69           HG2      LYS  69   1.564 -22.150  -7.861
    6    HG3  LYS  69           HG3      LYS  69   0.301 -23.368  -8.038
    7    HD2  LYS  69           HD2      LYS  69   0.653 -20.777  -9.491
    8    HD3  LYS  69           HD3      LYS  69   0.186 -22.358 -10.120
    9    HE2  LYS  69           HE2      LYS  69  -1.967 -22.076  -8.731
   10    HE3  LYS  69           HE3      LYS  69  -1.510 -20.378  -8.600
   11    HZ2  LYS  69           HZ1      LYS  69  -2.993 -20.851 -10.491
   12    HZ1  LYS  69           HZ2      LYS  69  -1.791 -21.847 -11.163
   13    HZ3  LYS  69           HZ3      LYS  69  -1.509 -20.182 -10.969

  No H/Q in entry =          13
  In of MODEL   80
    1    H    VAL  70           H        VAL  70  -0.266 -19.594  -5.234
    2    HA   VAL  70           HA       VAL  70  -1.609 -20.079  -2.637
    3    HB   VAL  70           HB       VAL  70  -0.785 -17.871  -1.881
    4   HG13  VAL  70          HG11      VAL  70   1.536 -18.526  -1.489
    5   HG12  VAL  70          HG12      VAL  70   1.458 -19.680  -2.821
    6   HG11  VAL  70          HG13      VAL  70   0.494 -19.944  -1.368
    7   HG22  VAL  70          HG21      VAL  70  -0.419 -16.585  -3.829
    8   HG21  VAL  70          HG22      VAL  70   0.468 -17.882  -4.627
    9   HG23  VAL  70          HG23      VAL  70   1.227 -16.972  -3.324

  No H/Q in entry =           9
  In of MODEL   80
    1    H    SER  71           H        SER  71  -3.184 -18.378  -2.113
    2    HA   SER  71           HA       SER  71  -5.006 -17.875  -4.232
    3    HB2  SER  71           HB2      SER  71  -5.662 -18.049  -1.814
    4    HB3  SER  71           HB3      SER  71  -4.855 -16.513  -1.518
    5    HG   SER  71           HG       SER  71  -6.973 -16.048  -1.917

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LEU  72           H        LEU  72  -5.236 -16.191  -5.543
    2    HA   LEU  72           HA       LEU  72  -3.113 -14.394  -6.016
    3    HB2  LEU  72           HB2      LEU  72  -5.976 -14.420  -6.967
    4    HB3  LEU  72           HB3      LEU  72  -4.767 -13.276  -7.540
    5    HG   LEU  72           HG       LEU  72  -4.397 -16.287  -7.674
    6   HD13  LEU  72          HD11      LEU  72  -6.307 -15.692  -9.060
    7   HD12  LEU  72          HD12      LEU  72  -4.921 -15.997 -10.107
    8   HD11  LEU  72          HD13      LEU  72  -5.418 -14.341  -9.763
    9   HD23  LEU  72          HD21      LEU  72  -2.816 -15.426  -9.586
   10   HD22  LEU  72          HD22      LEU  72  -2.252 -15.314  -7.927
   11   HD21  LEU  72          HD23      LEU  72  -2.900 -13.888  -8.733

  No H/Q in entry =          11
  In of MODEL   80
    1    H    VAL  73           H        VAL  73  -6.206 -14.017  -4.391
    2    HA   VAL  73           HA       VAL  73  -6.231 -11.247  -4.034
    3    HB   VAL  73           HB       VAL  73  -7.976 -11.587  -2.503
    4   HG13  VAL  73          HG11      VAL  73  -9.406 -13.011  -3.696
    5   HG12  VAL  73          HG12      VAL  73  -8.119 -14.162  -4.051
    6   HG11  VAL  73          HG13      VAL  73  -8.175 -12.615  -4.896
    7   HG21  VAL  73          HG21      VAL  73  -6.655 -14.262  -1.998
    8   HG23  VAL  73          HG22      VAL  73  -8.295 -13.902  -1.459
    9   HG22  VAL  73          HG23      VAL  73  -6.936 -12.960  -0.843

  No H/Q in entry =           9
  In of MODEL   80
    1    H    LEU  74           H        LEU  74  -4.314 -13.633  -2.452
    2    HA   LEU  74           HA       LEU  74  -3.898 -12.502   0.074
    3    HB2  LEU  74           HB2      LEU  74  -3.128 -14.722  -0.417
    4    HB3  LEU  74           HB3      LEU  74  -2.080 -14.125  -1.703
    5    HG   LEU  74           HG       LEU  74  -0.747 -12.877  -0.038
    6   HD13  LEU  74          HD11      LEU  74  -2.284 -12.356   1.694
    7   HD12  LEU  74          HD12      LEU  74  -1.222 -13.569   2.410
    8   HD11  LEU  74          HD13      LEU  74  -2.821 -14.031   1.830
    9   HD21  LEU  74          HD21      LEU  74  -0.588 -15.454  -0.628
   10   HD23  LEU  74          HD22      LEU  74  -0.988 -15.604   1.067
   11   HD22  LEU  74          HD23      LEU  74   0.452 -14.733   0.597

  No H/Q in entry =          11
  In of MODEL   80
    1    H    VAL  75           H        VAL  75  -2.000 -12.115  -2.879
    2    HA   VAL  75           HA       VAL  75  -0.190 -10.207  -1.861
    3    HB   VAL  75           HB       VAL  75  -1.144 -10.675  -4.687
    4   HG11  VAL  75          HG11      VAL  75   1.128  -8.963  -3.589
    5   HG13  VAL  75          HG12      VAL  75  -0.267  -8.400  -4.497
    6   HG12  VAL  75          HG13      VAL  75   0.944  -9.398  -5.285
    7   HG23  VAL  75          HG21      VAL  75   1.140 -11.747  -4.829
    8   HG22  VAL  75          HG22      VAL  75   0.024 -12.584  -3.748
    9   HG21  VAL  75          HG23      VAL  75   1.284 -11.545  -3.081

  No H/Q in entry =           9
  In of MODEL   80
    1    H    GLU  76           H        GLU  76  -3.335  -9.832  -3.523
    2    HA   GLU  76           HA       GLU  76  -3.365  -7.017  -3.617
    3    HB2  GLU  76           HB2      GLU  76  -5.030  -8.489  -4.770
    4    HB3  GLU  76           HB3      GLU  76  -5.715  -8.903  -3.206
    5    HG2  GLU  76           HG2      GLU  76  -6.335  -6.550  -2.828
    6    HG3  GLU  76           HG3      GLU  76  -5.635  -6.090  -4.367

  No H/Q in entry =           6
  In of MODEL   80
    1    H    ALA  77           H        ALA  77  -4.497  -9.243  -1.085
    2    HA   ALA  77           HA       ALA  77  -5.441  -7.238   0.678
    3    HB3  ALA  77           HB1      ALA  77  -5.238  -9.002   2.426
    4    HB1  ALA  77           HB2      ALA  77  -4.401 -10.022   1.259
    5    HB2  ALA  77           HB3      ALA  77  -6.079  -9.563   0.981

  No H/Q in entry =           5
  In of MODEL   80
    1    H    GLN  78           H        GLN  78  -2.305  -8.811   0.314
    2    HA   GLN  78           HA       GLN  78  -1.042  -7.666   2.569
    3    HB2  GLN  78           HB2      GLN  78  -0.189  -9.609   1.218
    4    HB3  GLN  78           HB3      GLN  78   0.247  -8.470  -0.053
    5    HG2  GLN  78           HG2      GLN  78   1.721  -7.278   1.518
    6    HG3  GLN  78           HG3      GLN  78   1.285  -8.411   2.794
    7   HE21  GLN  78          HE21      GLN  78   4.006  -8.149   1.931
    8   HE22  GLN  78          HE22      GLN  78   4.457  -9.590   1.154

  No H/Q in entry =           8
  In of MODEL   80
    1    H    LEU  79           H        LEU  79  -1.394  -6.594  -0.776
    2    HA   LEU  79           HA       LEU  79   0.310  -4.381  -0.754
    3    HB2  LEU  79           HB2      LEU  79  -0.720  -5.174  -2.811
    4    HB3  LEU  79           HB3      LEU  79  -2.321  -4.770  -2.204
    5    HG   LEU  79           HG       LEU  79  -1.758  -2.388  -2.171
    6   HD13  LEU  79          HD11      LEU  79   0.484  -2.164  -1.655
    7   HD12  LEU  79          HD12      LEU  79   0.538  -1.873  -3.393
    8   HD11  LEU  79          HD13      LEU  79   0.978  -3.456  -2.750
    9   HD23  LEU  79          HD21      LEU  79  -1.118  -2.188  -4.722
   10   HD22  LEU  79          HD22      LEU  79  -2.651  -2.924  -4.267
   11   HD21  LEU  79          HD23      LEU  79  -1.286  -3.943  -4.712

  No H/Q in entry =          11
  In of MODEL   80
    1    H    HIS  80           H        HIS  80  -3.159  -4.516   0.067
    2    HA   HIS  80           HA       HIS  80  -3.328  -1.760   0.737
    3    HB2  HIS  80           HB2      HIS  80  -5.051  -4.154   1.047
    4    HB3  HIS  80           HB3      HIS  80  -5.361  -2.814   2.154
    5    HD1  HIS  80           HD1      HIS  80  -6.963  -1.161   1.248
    6    HD2  HIS  80           HD2      HIS  80  -4.781  -2.985  -1.801
    7    HE1  HIS  80           HE1      HIS  80  -7.791  -0.151  -0.930
    8    HE2  HIS  80           HE2      HIS  80  -6.467  -1.257  -2.797

  No H/Q in entry =           8
  In of MODEL   80
    1    H    LEU  81           H        LEU  81  -2.868  -4.664   2.724
    2    HA   LEU  81           HA       LEU  81  -2.847  -3.323   5.211
    3    HB2  LEU  81           HB2      LEU  81  -1.651  -5.948   4.327
    4    HB3  LEU  81           HB3      LEU  81  -1.622  -5.394   6.002
    5    HG   LEU  81           HG       LEU  81  -4.168  -5.619   4.370
    6   HD12  LEU  81          HD11      LEU  81  -4.491  -7.686   5.911
    7   HD11  LEU  81          HD12      LEU  81  -2.739  -7.631   6.100
    8   HD13  LEU  81          HD13      LEU  81  -3.447  -7.851   4.499
    9   HD23  LEU  81          HD21      LEU  81  -5.016  -5.821   6.869
   10   HD22  LEU  81          HD22      LEU  81  -4.676  -4.233   6.183
   11   HD21  LEU  81          HD23      LEU  81  -3.498  -5.007   7.243

  No H/Q in entry =          11
  In of MODEL   80
    1    H    MET  82           H        MET  82  -0.171  -4.246   3.042
    2    HA   MET  82           HA       MET  82   1.918  -3.375   4.731
    3    HB2  MET  82           HB2      MET  82   1.704  -3.707   1.738
    4    HB3  MET  82           HB3      MET  82   3.190  -3.152   2.505
    5    HG2  MET  82           HG2      MET  82   1.758  -5.730   3.221
    6    HG3  MET  82           HG3      MET  82   3.132  -5.631   2.123
    7    HE3  MET  82           HE1      MET  82   6.151  -4.928   4.113
    8    HE2  MET  82           HE2      MET  82   5.242  -3.550   3.497
    9    HE1  MET  82           HE3      MET  82   5.318  -5.039   2.558

  No H/Q in entry =           9
  In of MODEL   80
    1    H    THR  83           H        THR  83   0.115  -1.709   2.176
    2    HA   THR  83           HA       THR  83   1.550   0.725   2.271
    3    HB   THR  83           HB       THR  83  -0.615   1.673   1.284
    4    HG1  THR  83           HG1      THR  83  -2.278   0.393   1.171
    5   HG22  THR  83          HG21      THR  83  -0.360  -0.142  -0.721
    6   HG21  THR  83          HG22      THR  83   1.137  -0.451   0.157
    7   HG23  THR  83          HG23      THR  83   0.792   1.167  -0.454

  No H/Q in entry =           7
  In of MODEL   80
    1    H    SER  84           H        SER  84  -1.468  -0.282   3.865
    2    HA   SER  84           HA       SER  84  -1.942   2.149   5.215
    3    HB2  SER  84           HB2      SER  84  -2.804  -0.681   5.771
    4    HB3  SER  84           HB3      SER  84  -3.285   0.662   6.807
    5    HG   SER  84           HG       SER  84  -3.743   0.359   4.013

  No H/Q in entry =           5
  In of MODEL   80
    1    H    MET  85           H        MET  85  -0.263  -0.802   6.340
    2    HA   MET  85           HA       MET  85   0.262   0.113   8.947
    3    HB2  MET  85           HB2      MET  85   0.532  -2.232   8.260
    4    HB3  MET  85           HB3      MET  85   1.924  -1.778   7.274
    5    HG2  MET  85           HG2      MET  85   3.096  -0.965   9.282
    6    HG3  MET  85           HG3      MET  85   1.698  -1.378  10.273
    7    HE1  MET  85           HE1      MET  85   4.027  -2.671   7.564
    8    HE3  MET  85           HE2      MET  85   4.675  -4.177   8.210
    9    HE2  MET  85           HE3      MET  85   5.089  -2.647   8.976

  No H/Q in entry =           9
  In of MODEL   80
    1    H    LEU  86           H        LEU  86   2.204   0.356   5.999
    2    HA   LEU  86           HA       LEU  86   4.429   1.641   7.161
    3    HB2  LEU  86           HB2      LEU  86   4.230   0.566   4.849
    4    HB3  LEU  86           HB3      LEU  86   3.438   2.057   4.339
    5    HG   LEU  86           HG       LEU  86   5.477   3.280   5.325
    6   HD11  LEU  86          HD11      LEU  86   6.155   0.660   6.120
    7   HD13  LEU  86          HD12      LEU  86   7.173   2.094   6.222
    8   HD12  LEU  86          HD13      LEU  86   7.273   1.048   4.808
    9   HD23  LEU  86          HD21      LEU  86   6.179   1.516   2.971
   10   HD22  LEU  86          HD22      LEU  86   6.590   3.208   3.238
   11   HD21  LEU  86          HD23      LEU  86   4.933   2.758   2.836

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ALA  87           H        ALA  87   1.532   2.918   5.575
    2    HA   ALA  87           HA       ALA  87   2.154   5.642   5.666
    3    HB1  ALA  87           HB1      ALA  87  -0.171   4.039   5.118
    4    HB3  ALA  87           HB2      ALA  87   0.158   5.698   4.622
    5    HB2  ALA  87           HB3      ALA  87  -0.641   5.381   6.164

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ARG  88           H        ARG  88   0.441   3.652   8.049
    2    HA   ARG  88           HA       ARG  88  -0.052   5.703   9.900
    3    HB2  ARG  88           HB2      ARG  88  -1.015   3.360   9.960
    4    HB3  ARG  88           HB3      ARG  88   0.520   2.843  10.667
    5    HG2  ARG  88           HG2      ARG  88   0.062   4.918  12.291
    6    HG3  ARG  88           HG3      ARG  88  -1.607   4.611  11.832
    7    HD2  ARG  88           HD2      ARG  88  -1.735   2.761  13.074
    8    HD3  ARG  88           HD3      ARG  88  -0.151   2.164  12.544
    9    HE   ARG  88           HE       ARG  88  -0.675   3.427  15.000
   10   HH21  ARG  88          HH11      ARG  88   0.892   4.420  16.243
   11   HH22  ARG  88          HH12      ARG  88   2.416   4.833  15.541
   12   HH11  ARG  88          HH21      ARG  88   1.611   3.591  12.426
   13   HH12  ARG  88          HH22      ARG  88   2.832   4.347  13.392

  No H/Q in entry =          13
  In of MODEL   80
    1    H    GLU  89           H        GLU  89   2.722   3.456   9.676
    2    HA   GLU  89           HA       GLU  89   3.989   4.327  12.023
    3    HB2  GLU  89           HB2      GLU  89   4.629   2.305  10.676
    4    HB3  GLU  89           HB3      GLU  89   5.418   3.394   9.533
    5    HG2  GLU  89           HG2      GLU  89   6.909   4.222  11.280
    6    HG3  GLU  89           HG3      GLU  89   6.063   3.272  12.497

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LEU  90           H        LEU  90   4.322   5.489   8.698
    2    HA   LEU  90           HA       LEU  90   6.271   7.469   9.291
    3    HB2  LEU  90           HB2      LEU  90   4.265   7.162   7.060
    4    HB3  LEU  90           HB3      LEU  90   5.508   8.420   7.085
    5    HG   LEU  90           HG       LEU  90   6.153   5.477   7.414
    6   HD12  LEU  90          HD11      LEU  90   6.907   5.708   4.976
    7   HD11  LEU  90          HD12      LEU  90   5.905   7.159   4.929
    8   HD13  LEU  90          HD13      LEU  90   5.170   5.592   5.268
    9   HD22  LEU  90          HD21      LEU  90   8.060   6.607   8.101
   10   HD21  LEU  90          HD22      LEU  90   7.725   8.017   7.096
   11   HD23  LEU  90          HD23      LEU  90   8.371   6.548   6.367

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  91           H        ILE  91   2.733   7.518   9.137
    2    HA   ILE  91           HA       ILE  91   2.416  10.293   9.593
    3    HB   ILE  91           HB       ILE  91   0.602   7.933  10.128
    4   HG12  ILE  91          HG12      ILE  91   0.377  10.221   8.147
    5   HG13  ILE  91          HG13      ILE  91   1.224   8.719   7.774
    6   HG22  ILE  91          HG21      ILE  91  -1.112  10.007  10.193
    7   HG21  ILE  91          HG22      ILE  91   0.296  10.823  10.870
    8   HG23  ILE  91          HG23      ILE  91  -0.355   9.390  11.662
    9   HD13  ILE  91          HD11      ILE  91  -0.732   7.450   7.813
   10   HD12  ILE  91          HD12      ILE  91  -1.306   8.971   7.133
   11   HD11  ILE  91          HD13      ILE  91  -1.583   8.607   8.836

  No H/Q in entry =          11
  In of MODEL   80
    1    H    THR  92           H        THR  92   2.791   7.544  11.789
    2    HA   THR  92           HA       THR  92   2.356   8.916  14.215
    3    HB   THR  92           HB       THR  92   4.145   6.567  13.548
    4    HG1  THR  92           HG1      THR  92   2.169   5.827  13.443
    5   HG22  THR  92          HG21      THR  92   3.755   6.281  16.181
    6   HG21  THR  92          HG22      THR  92   3.706   8.041  16.111
    7   HG23  THR  92          HG23      THR  92   5.132   7.174  15.539

  No H/Q in entry =           7
  In of MODEL   80
    1    H    GLU  93           H        GLU  93   5.306   8.446  12.285
    2    HA   GLU  93           HA       GLU  93   7.069   9.854  13.988
    3    HB2  GLU  93           HB2      GLU  93   7.160   9.545  10.972
    4    HB3  GLU  93           HB3      GLU  93   8.503  10.061  11.990
    5    HG2  GLU  93           HG2      GLU  93   7.071   7.436  12.430
    6    HG3  GLU  93           HG3      GLU  93   8.457   7.578  11.356

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LEU  94           H        LEU  94   5.033  10.891  11.274
    2    HA   LEU  94           HA       LEU  94   5.861  13.589  11.179
    3    HB2  LEU  94           HB2      LEU  94   3.261  12.246  10.419
    4    HB3  LEU  94           HB3      LEU  94   3.533  13.972  10.181
    5    HG   LEU  94           HG       LEU  94   5.536  11.970   9.131
    6   HD11  LEU  94          HD11      LEU  94   2.801  12.544   8.064
    7   HD13  LEU  94          HD12      LEU  94   3.773  11.080   7.938
    8   HD12  LEU  94          HD13      LEU  94   4.121  12.460   6.897
    9   HD23  LEU  94          HD21      LEU  94   5.804  13.807   7.412
   10   HD22  LEU  94          HD22      LEU  94   6.220  14.293   9.055
   11   HD21  LEU  94          HD23      LEU  94   4.674  14.775   8.355

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  95           H        ILE  95   3.307  11.989  13.063
    2    HA   ILE  95           HA       ILE  95   2.280  14.344  14.261
    3    HB   ILE  95           HB       ILE  95   2.274  11.461  15.180
    4   HG12  ILE  95          HG12      ILE  95   0.068  13.253  14.130
    5   HG13  ILE  95          HG13      ILE  95   1.019  12.188  13.098
    6   HG21  ILE  95          HG21      ILE  95   1.008  13.941  16.384
    7   HG23  ILE  95          HG22      ILE  95   2.046  12.763  17.188
    8   HG22  ILE  95          HG23      ILE  95   0.408  12.315  16.710
    9   HD13  ILE  95          HD11      ILE  95   0.100  10.255  14.012
   10   HD12  ILE  95          HD12      ILE  95  -1.275  11.355  14.088
   11   HD11  ILE  95          HD13      ILE  95  -0.314  11.047  15.534

  No H/Q in entry =          11
  In of MODEL   80
    1    H    GLU  96           H        GLU  96   4.857  12.105  15.257
    2    HA   GLU  96           HA       GLU  96   5.416  13.295  17.752
    3    HB2  GLU  96           HB2      GLU  96   6.350  11.130  17.103
    4    HB3  GLU  96           HB3      GLU  96   7.291  11.899  15.826
    5    HG2  GLU  96           HG2      GLU  96   8.941  12.433  17.292
    6    HG3  GLU  96           HG3      GLU  96   7.798  13.253  18.346

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LEU  97           H        LEU  97   6.502  14.065  14.469
    2    HA   LEU  97           HA       LEU  97   8.401  16.047  15.188
    3    HB2  LEU  97           HB2      LEU  97   6.810  15.513  12.689
    4    HB3  LEU  97           HB3      LEU  97   7.839  16.937  12.815
    5    HG   LEU  97           HG       LEU  97   8.848  14.131  13.372
    6   HD12  LEU  97          HD11      LEU  97   9.851  14.323  11.057
    7   HD11  LEU  97          HD12      LEU  97   8.809  15.721  10.794
    8   HD13  LEU  97          HD13      LEU  97   8.099  14.133  11.085
    9   HD23  LEU  97          HD21      LEU  97  11.027  15.397  12.636
   10   HD22  LEU  97          HD22      LEU  97  10.407  15.668  14.264
   11   HD21  LEU  97          HD23      LEU  97  10.103  16.855  12.997

  No H/Q in entry =          11
  In of MODEL   80
    1    H    HIS  98           H        HIS  98   4.912  16.206  14.528
    2    HA   HIS  98           HA       HIS  98   4.630  19.008  14.667
    3    HB2  HIS  98           HB2      HIS  98   2.724  16.769  15.385
    4    HB3  HIS  98           HB3      HIS  98   2.268  18.472  15.443
    5    HD1  HIS  98           HD1      HIS  98   3.277  15.754  13.036
    6    HD2  HIS  98           HD2      HIS  98   1.927  19.697  12.917
    7    HE1  HIS  98           HE1      HIS  98   2.725  16.251  10.611
    8    HE2  HIS  98           HE2      HIS  98   1.907  18.646  10.518

  No H/Q in entry =           8
  In of MODEL   80
    1    H    GLU  99           H        GLU  99   4.743  16.514  17.162
    2    HA   GLU  99           HA       GLU  99   4.141  18.209  19.361
    3    HB2  GLU  99           HB2      GLU  99   4.036  15.727  19.454
    4    HB3  GLU  99           HB3      GLU  99   5.796  15.671  19.349
    5    HG2  GLU  99           HG2      GLU  99   5.989  16.958  21.426
    6    HG3  GLU  99           HG3      GLU  99   4.237  17.110  21.518

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LYS 100           H        LYS 100   7.192  17.261  17.801
    2    HA   LYS 100           HA       LYS 100   8.852  18.648  19.663
    3    HB2  LYS 100           HB2      LYS 100   9.351  17.725  16.824
    4    HB3  LYS 100           HB3      LYS 100  10.583  18.485  17.836
    5    HG2  LYS 100           HG2      LYS 100  10.192  16.734  19.573
    6    HG3  LYS 100           HG3      LYS 100   9.058  15.939  18.478
    7    HD2  LYS 100           HD2      LYS 100  10.853  15.648  16.814
    8    HD3  LYS 100           HD3      LYS 100  11.993  16.454  17.894
    9    HE2  LYS 100           HE2      LYS 100  11.582  14.699  19.608
   10    HE3  LYS 100           HE3      LYS 100  10.504  13.872  18.479
   11    HZ1  LYS 100           HZ1      LYS 100  13.330  14.524  17.831
   12    HZ3  LYS 100           HZ2      LYS 100  12.281  13.477  16.999
   13    HZ2  LYS 100           HZ3      LYS 100  12.864  13.052  18.537

  No H/Q in entry =          13
  In of MODEL   80
    1    H    LEU 101           H        LEU 101   7.171  19.591  16.706
    2    HA   LEU 101           HA       LEU 101   8.402  22.140  16.378
    3    HB2  LEU 101           HB2      LEU 101   5.800  20.925  15.484
    4    HB3  LEU 101           HB3      LEU 101   6.063  22.655  15.280
    5    HG   LEU 101           HG       LEU 101   8.088  20.627  14.315
    6   HD12  LEU 101          HD11      LEU 101   6.942  21.145  12.028
    7   HD11  LEU 101          HD12      LEU 101   5.543  21.582  13.007
    8   HD13  LEU 101          HD13      LEU 101   6.197  19.947  13.087
    9   HD21  LEU 101          HD21      LEU 101   7.480  23.545  13.763
   10   HD23  LEU 101          HD22      LEU 101   8.456  22.580  12.657
   11   HD22  LEU 101          HD23      LEU 101   8.997  22.831  14.316

  No H/Q in entry =          11
  In of MODEL   80
    1    H    LYS 102           H        LYS 102   6.852  21.008  18.989
    2    HA   LYS 102           HA       LYS 102   6.224  22.100  20.922
    3    HB2  LYS 102           HB2      LYS 102   7.522  24.084  19.803
    4    HB3  LYS 102           HB3      LYS 102   5.928  24.700  19.426
    5    HG2  LYS 102           HG2      LYS 102   7.298  24.430  22.080
    6    HG3  LYS 102           HG3      LYS 102   6.355  25.766  21.452
    7    HD2  LYS 102           HD2      LYS 102   5.092  23.137  22.323
    8    HD3  LYS 102           HD3      LYS 102   5.348  24.494  23.410
    9    HE2  LYS 102           HE2      LYS 102   3.069  24.109  21.916
   10    HE3  LYS 102           HE3      LYS 102   3.581  25.650  22.602
   11    HZ2  LYS 102           HZ1      LYS 102   3.056  25.766  20.221
   12    HZ1  LYS 102           HZ2      LYS 102   4.310  24.676  19.898
   13    HZ3  LYS 102           HZ3      LYS 102   4.662  26.203  20.545

  No H/Q in entry =          13
  In of MODEL   80
    1    H    ALA 103           H        ALA 103   4.601  23.659  18.154
    2    HA   ALA 103           HA       ALA 103   2.150  24.251  19.036
    3    HB1  ALA 103           HB1      ALA 103   1.249  23.420  16.790
    4    HB2  ALA 103           HB2      ALA 103   2.894  22.872  16.462
    5    HB3  ALA 103           HB3      ALA 103   2.570  24.586  16.731

  No H/Q in entry =           5
  In of MODEL   80
    1    H1   ALA   1           H3       ALA   1  10.487 -20.259  -6.308
    2    H2   ALA   1           H2       ALA   1   9.523 -20.456  -7.696
    3    H3   ALA   1           H1       ALA   1   9.078 -21.202  -6.235
    4    HA   ALA   1           HA       ALA   1  10.105 -23.017  -6.976
    5    HB1  ALA   1           HB1      ALA   1  10.207 -22.654  -9.251
    6    HB2  ALA   1           HB2      ALA   1  11.935 -22.517  -8.919
    7    HB3  ALA   1           HB3      ALA   1  10.948 -21.062  -9.068

  No H/Q in entry =           7
  In of MODEL   80
    1    H    GLU   2           H        GLU   2  12.382 -23.984  -7.032
    2    HA   GLU   2           HA       GLU   2  13.760 -23.918  -4.818
    3    HB2  GLU   2           HB2      GLU   2  15.122 -23.791  -7.515
    4    HB3  GLU   2           HB3      GLU   2  15.843 -24.411  -6.030
    5    HG2  GLU   2           HG2      GLU   2  14.811 -26.419  -6.276
    6    HG3  GLU   2           HG3      GLU   2  13.246 -25.661  -6.536

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLU   3           H        GLU   3  15.549 -22.062  -7.213
    2    HA   GLU   3           HA       GLU   3  16.713 -20.388  -5.248
    3    HB2  GLU   3           HB2      GLU   3  16.661 -20.379  -8.258
    4    HB3  GLU   3           HB3      GLU   3  17.416 -19.058  -7.367
    5    HG2  GLU   3           HG2      GLU   3  19.066 -20.447  -6.445
    6    HG3  GLU   3           HG3      GLU   3  18.109 -21.906  -6.670

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LEU   4           H        LEU   4  14.441 -19.517  -7.881
    2    HA   LEU   4           HA       LEU   4  13.994 -16.906  -7.265
    3    HB2  LEU   4           HB2      LEU   4  11.805 -18.862  -8.002
    4    HB3  LEU   4           HB3      LEU   4  11.744 -17.112  -8.197
    5    HG   LEU   4           HG       LEU   4  13.696 -18.988  -9.571
    6   HD13  LEU   4          HD11      LEU   4  12.398 -18.825 -11.483
    7   HD12  LEU   4          HD12      LEU   4  11.702 -17.275 -11.014
    8   HD11  LEU   4          HD13      LEU   4  11.135 -18.763 -10.256
    9   HD23  LEU   4          HD21      LEU   4  14.052 -16.743 -10.918
   10   HD22  LEU   4          HD22      LEU   4  14.908 -16.995  -9.398
   11   HD21  LEU   4          HD23      LEU   4  13.463 -15.987  -9.437

  No H/Q in entry =          11
  In of MODEL   80
    1    H    GLU   5           H        GLU   5  12.485 -19.681  -5.631
    2    HA   GLU   5           HA       GLU   5  10.818 -18.100  -3.927
    3    HB2  GLU   5           HB2      GLU   5  10.363 -20.468  -4.447
    4    HB3  GLU   5           HB3      GLU   5  11.803 -20.925  -3.536
    5    HG2  GLU   5           HG2      GLU   5  10.872 -19.918  -1.507
    6    HG3  GLU   5           HG3      GLU   5   9.450 -19.390  -2.406

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLU   6           H        GLU   6  13.951 -19.705  -3.483
    2    HA   GLU   6           HA       GLU   6  14.306 -18.857  -0.782
    3    HB2  GLU   6           HB2      GLU   6  15.520 -20.779  -1.770
    4    HB3  GLU   6           HB3      GLU   6  16.388 -19.666  -2.829
    5    HG2  GLU   6           HG2      GLU   6  17.331 -18.515  -0.877
    6    HG3  GLU   6           HG3      GLU   6  16.435 -19.583   0.202

  No H/Q in entry =           6
  In of MODEL   80
    1    H    VAL   7           H        VAL   7  15.087 -17.530  -3.928
    2    HA   VAL   7           HA       VAL   7  16.787 -15.418  -3.057
    3    HB   VAL   7           HB       VAL   7  15.083 -15.763  -5.537
    4   HG11  VAL   7          HG11      VAL   7  16.991 -13.566  -4.718
    5   HG13  VAL   7          HG12      VAL   7  15.351 -13.410  -5.343
    6   HG12  VAL   7          HG13      VAL   7  16.658 -13.920  -6.413
    7   HG21  VAL   7          HG21      VAL   7  17.178 -17.237  -4.968
    8   HG23  VAL   7          HG22      VAL   7  18.094 -15.782  -5.362
    9   HG22  VAL   7          HG23      VAL   7  17.054 -16.521  -6.577

  No H/Q in entry =           9
  In of MODEL   80
    1    H    VAL   8           H        VAL   8  13.294 -15.660  -3.619
    2    HA   VAL   8           HA       VAL   8  12.647 -12.948  -3.143
    3    HB   VAL   8           HB       VAL   8  11.065 -15.504  -2.839
    4   HG11  VAL   8          HG11      VAL   8  10.326 -12.662  -2.173
    5   HG13  VAL   8          HG12      VAL   8   9.977 -14.136  -1.272
    6   HG12  VAL   8          HG13      VAL   8   9.097 -13.782  -2.757
    7   HG23  VAL   8          HG21      VAL   8   9.940 -13.704  -4.735
    8   HG22  VAL   8          HG22      VAL   8  10.806 -15.200  -5.073
    9   HG21  VAL   8          HG23      VAL   8  11.680 -13.673  -5.015

  No H/Q in entry =           9
  In of MODEL   80
    1    H    MET   9           H        MET   9  12.891 -15.760  -0.968
    2    HA   MET   9           HA       MET   9  12.081 -14.488   1.403
    3    HB2  MET   9           HB2      MET   9  13.936 -16.791   0.836
    4    HB3  MET   9           HB3      MET   9  13.717 -16.194   2.481
    5    HG2  MET   9           HG2      MET   9  11.180 -16.403   2.009
    6    HG3  MET   9           HG3      MET   9  11.661 -17.404   0.637
    7    HE2  MET   9           HE1      MET   9  14.160 -18.998   1.478
    8    HE1  MET   9           HE2      MET   9  12.705 -19.558   0.658
    9    HE3  MET   9           HE3      MET   9  13.330 -20.455   2.039

  No H/Q in entry =           9
  In of MODEL   80
    1    H    GLY  10           H        GLY  10  15.263 -14.731  -0.149
    2    HA3  GLY  10           HA2      GLY  10  16.728 -13.324   1.826
    3    HA2  GLY  10           HA3      GLY  10  17.193 -13.489   0.133

  No H/Q in entry =           3
  In of MODEL   80
    1    H    LEU  11           H        LEU  11  15.034 -12.251  -1.107
    2    HA   LEU  11           HA       LEU  11  15.737  -9.511  -0.937
    3    HB2  LEU  11           HB2      LEU  11  13.362 -10.903  -2.179
    4    HB3  LEU  11           HB3      LEU  11  13.654  -9.170  -2.335
    5    HG   LEU  11           HG       LEU  11  15.669 -11.290  -3.124
    6   HD13  LEU  11          HD11      LEU  11  13.923 -11.643  -4.647
    7   HD12  LEU  11          HD12      LEU  11  14.935 -10.466  -5.483
    8   HD11  LEU  11          HD13      LEU  11  13.463  -9.940  -4.666
    9   HD22  LEU  11          HD21      LEU  11  16.912  -9.334  -2.892
   10   HD21  LEU  11          HD22      LEU  11  15.544  -8.288  -3.271
   11   HD23  LEU  11          HD23      LEU  11  16.372  -9.159  -4.560

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  12           H        ILE  12  12.955 -11.322   0.322
    2    HA   ILE  12           HA       ILE  12  11.573  -9.092   1.384
    3    HB   ILE  12           HB       ILE  12  11.591 -11.978   2.323
    4   HG12  ILE  12          HG12      ILE  12  10.906 -11.337  -0.119
    5   HG13  ILE  12          HG13      ILE  12   9.864 -12.411   0.792
    6   HG21  ILE  12          HG21      ILE  12   9.692  -9.686   2.910
    7   HG23  ILE  12          HG22      ILE  12  10.651 -10.598   4.074
    8   HG22  ILE  12          HG23      ILE  12   9.310 -11.376   3.232
    9   HD13  ILE  12          HD11      ILE  12   8.365 -10.576   1.296
   10   HD12  ILE  12          HD12      ILE  12   8.653 -10.599  -0.442
   11   HD11  ILE  12          HD13      ILE  12   9.471  -9.424   0.567

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  13           H        ILE  13  13.951 -11.313   2.789
    2    HA   ILE  13           HA       ILE  13  13.989 -10.139   5.372
    3    HB   ILE  13           HB       ILE  13  16.049 -11.714   3.808
    4   HG12  ILE  13          HG12      ILE  13  13.758 -12.672   4.631
    5   HG13  ILE  13          HG13      ILE  13  15.227 -13.608   4.887
    6   HG22  ILE  13          HG21      ILE  13  17.043 -12.093   6.171
    7   HG21  ILE  13          HG22      ILE  13  16.163 -10.642   6.635
    8   HG23  ILE  13          HG23      ILE  13  17.396 -10.559   5.377
    9   HD11  ILE  13          HD11      ILE  13  14.175 -11.706   7.001
   10   HD13  ILE  13          HD12      ILE  13  15.330 -13.022   7.184
   11   HD12  ILE  13          HD13      ILE  13  13.632 -13.379   6.894

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ASN  14           H        ASN  14  15.950  -9.612   2.458
    2    HA   ASN  14           HA       ASN  14  17.701  -7.681   3.526
    3    HB2  ASN  14           HB2      ASN  14  17.677  -8.942   1.208
    4    HB3  ASN  14           HB3      ASN  14  16.791  -7.520   0.672
    5   HD21  ASN  14          HD21      ASN  14  19.232  -7.868  -0.510
    6   HD22  ASN  14          HD22      ASN  14  20.379  -6.791   0.121

  No H/Q in entry =           6
  In of MODEL   80
    1    H    SER  15           H        SER  15  14.595  -7.317   1.829
    2    HA   SER  15           HA       SER  15  14.494  -4.496   1.891
    3    HB2  SER  15           HB2      SER  15  12.162  -4.733   1.392
    4    HB3  SER  15           HB3      SER  15  12.955  -6.098   0.619
    5    HG   SER  15           HG       SER  15  11.656  -6.086   3.141

  No H/Q in entry =           5
  In of MODEL   80
    1    H    GLY  16           H        GLY  16  13.387  -6.956   4.188
    2    HA3  GLY  16           HA2      GLY  16  12.169  -5.206   6.046
    3    HA2  GLY  16           HA3      GLY  16  12.777  -6.818   6.406

  No H/Q in entry =           3
  In of MODEL   80
    1    H    GLN  17           H        GLN  17  15.491  -6.494   5.819
    2    HA   GLN  17           HA       GLN  17  16.448  -5.281   8.204
    3    HB2  GLN  17           HB2      GLN  17  17.875  -6.122   5.666
    4    HB3  GLN  17           HB3      GLN  17  18.713  -5.544   7.107
    5    HG2  GLN  17           HG2      GLN  17  16.802  -7.895   7.068
    6    HG3  GLN  17           HG3      GLN  17  18.558  -8.038   7.006
    7   HE21  GLN  17          HE21      GLN  17  16.117  -8.356   9.163
    8   HE22  GLN  17          HE22      GLN  17  16.891  -7.828  10.578

  No H/Q in entry =           8
  In of MODEL   80
    1    H    ALA  18           H        ALA  18  16.269  -4.196   4.846
    2    HA   ALA  18           HA       ALA  18  17.712  -1.808   5.080
    3    HB2  ALA  18           HB1      ALA  18  16.594  -3.015   3.008
    4    HB3  ALA  18           HB2      ALA  18  16.865  -1.273   2.997
    5    HB1  ALA  18           HB3      ALA  18  15.263  -1.914   3.362

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ARG  19           H        ARG  19  14.210  -2.385   5.469
    2    HA   ARG  19           HA       ARG  19  13.549   0.265   6.188
    3    HB2  ARG  19           HB2      ARG  19  11.863  -1.480   5.595
    4    HB3  ARG  19           HB3      ARG  19  12.199  -2.282   7.131
    5    HG2  ARG  19           HG2      ARG  19  11.493  -0.291   8.373
    6    HG3  ARG  19           HG3      ARG  19  11.249   0.589   6.865
    7    HD2  ARG  19           HD2      ARG  19   9.103  -0.202   7.680
    8    HD3  ARG  19           HD3      ARG  19   9.522  -1.080   6.202
    9    HE   ARG  19           HE       ARG  19  10.472  -2.629   8.306
   10   HH21  ARG  19          HH11      ARG  19   9.215  -4.267   9.240
   11   HH22  ARG  19          HH12      ARG  19   7.496  -4.234   9.066
   12   HH11  ARG  19          HH21      ARG  19   7.484  -1.325   7.208
   13   HH12  ARG  19          HH22      ARG  19   6.516  -2.568   7.911

  No H/Q in entry =          13
  In of MODEL   80
    1    H    SER  20           H        SER  20  14.394  -2.572   8.144
    2    HA   SER  20           HA       SER  20  14.109  -1.476  10.682
    3    HB2  SER  20           HB2      SER  20  14.608  -3.859  10.288
    4    HB3  SER  20           HB3      SER  20  16.229  -3.429   9.749
    5    HG   SER  20           HG       SER  20  15.217  -2.645  12.270

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LEU  21           H        LEU  21  16.957  -1.419   8.552
    2    HA   LEU  21           HA       LEU  21  18.632   0.058  10.297
    3    HB2  LEU  21           HB2      LEU  21  18.616  -0.205   7.282
    4    HB3  LEU  21           HB3      LEU  21  19.873   0.645   8.179
    5    HG   LEU  21           HG       LEU  21  19.115  -2.246   8.696
    6   HD11  LEU  21          HD11      LEU  21  20.010  -1.885   6.387
    7   HD13  LEU  21          HD12      LEU  21  21.081  -2.862   7.392
    8   HD12  LEU  21          HD13      LEU  21  21.457  -1.165   7.098
    9   HD23  LEU  21          HD21      LEU  21  21.583  -2.114   9.621
   10   HD22  LEU  21          HD22      LEU  21  20.273  -1.500  10.622
   11   HD21  LEU  21          HD23      LEU  21  21.274  -0.382   9.710

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ALA  22           H        ALA  22  16.377   1.039   7.738
    2    HA   ALA  22           HA       ALA  22  16.925   3.796   7.759
    3    HB3  ALA  22           HB1      ALA  22  15.521   2.561   6.075
    4    HB2  ALA  22           HB2      ALA  22  14.818   4.075   6.643
    5    HB1  ALA  22           HB3      ALA  22  14.222   2.537   7.266

  No H/Q in entry =           5
  In of MODEL   80
    1    H    TYR  23           H        TYR  23  14.418   1.984   9.584
    2    HA   TYR  23           HA       TYR  23  13.459   4.222  11.036
    3    HB2  TYR  23           HB2      TYR  23  12.214   2.115  11.011
    4    HB3  TYR  23           HB3      TYR  23  13.542   1.294  11.830
    5    HD1  TYR  23           HD1      TYR  23  11.041   4.035  12.209
    6    HD2  TYR  23           HD2      TYR  23  13.754   1.356  14.188
    7    HE1  TYR  23           HE1      TYR  23  10.119   4.723  14.408
    8    HE2  TYR  23           HE2      TYR  23  12.831   2.043  16.384
    9    HH   TYR  23           HH       TYR  23   9.945   3.758  16.709

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ALA  24           H        ALA  24  16.095   1.936  11.675
    2    HA   ALA  24           HA       ALA  24  16.763   2.923  14.241
    3    HB1  ALA  24           HB1      ALA  24  18.114   1.126  14.076
    4    HB3  ALA  24           HB2      ALA  24  19.147   2.046  12.981
    5    HB2  ALA  24           HB3      ALA  24  17.850   1.043  12.335

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ALA  25           H        ALA  25  17.731   3.855  10.967
    2    HA   ALA  25           HA       ALA  25  19.682   5.781  11.620
    3    HB1  ALA  25           HB1      ALA  25  18.967   4.840   9.302
    4    HB3  ALA  25           HB2      ALA  25  19.475   6.526   9.399
    5    HB2  ALA  25           HB3      ALA  25  17.759   6.126   9.326

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LEU  26           H        LEU  26  16.169   6.025  11.252
    2    HA   LEU  26           HA       LEU  26  15.955   8.806  11.708
    3    HB2  LEU  26           HB2      LEU  26  14.091   7.580  10.774
    4    HB3  LEU  26           HB3      LEU  26  13.993   6.550  12.197
    5    HG   LEU  26           HG       LEU  26  13.392   8.507  13.580
    6   HD12  LEU  26          HD11      LEU  26  12.742  10.613  12.257
    7   HD11  LEU  26          HD12      LEU  26  13.723   9.959  10.948
    8   HD13  LEU  26          HD13      LEU  26  14.466  10.338  12.503
    9   HD21  LEU  26          HD21      LEU  26  11.720   8.206  11.065
   10   HD23  LEU  26          HD22      LEU  26  11.159   8.903  12.582
   11   HD22  LEU  26          HD23      LEU  26  11.604   7.200  12.510

  No H/Q in entry =          11
  In of MODEL   80
    1    H    LYS  27           H        LYS  27  15.830   6.023  13.895
    2    HA   LYS  27           HA       LYS  27  15.238   7.386  16.265
    3    HB2  LYS  27           HB2      LYS  27  15.256   4.912  15.995
    4    HB3  LYS  27           HB3      LYS  27  17.020   4.956  15.956
    5    HG2  LYS  27           HG2      LYS  27  17.069   5.937  18.207
    6    HG3  LYS  27           HG3      LYS  27  15.302   5.963  18.249
    7    HD2  LYS  27           HD2      LYS  27  15.266   3.497  18.007
    8    HD3  LYS  27           HD3      LYS  27  17.031   3.478  17.999
    9    HE2  LYS  27           HE2      LYS  27  17.064   4.462  20.258
   10    HE3  LYS  27           HE3      LYS  27  15.299   4.511  20.269
   11    HZ3  LYS  27           HZ1      LYS  27  16.075   2.552  21.417
   12    HZ2  LYS  27           HZ2      LYS  27  16.992   2.072  20.067
   13    HZ1  LYS  27           HZ3      LYS  27  15.294   2.085  19.984

  No H/Q in entry =          13
  In of MODEL   80
    1    H    GLN  28           H        GLN  28  18.355   6.792  14.679
    2    HA   GLN  28           HA       GLN  28  20.040   7.863  16.675
    3    HB2  GLN  28           HB2      GLN  28  20.336   7.825  13.660
    4    HB3  GLN  28           HB3      GLN  28  21.622   8.283  14.776
    5    HG2  GLN  28           HG2      GLN  28  20.182   5.615  14.807
    6    HG3  GLN  28           HG3      GLN  28  21.766   5.892  14.084
    7   HE21  GLN  28          HE21      GLN  28  20.500   4.567  16.778
    8   HE22  GLN  28          HE22      GLN  28  21.689   4.981  17.915

  No H/Q in entry =           8
  In of MODEL   80
    1    H    ALA  29           H        ALA  29  18.303   9.361  13.982
    2    HA   ALA  29           HA       ALA  29  19.315  11.975  14.243
    3    HB2  ALA  29           HB1      ALA  29  17.624  12.625  12.769
    4    HB1  ALA  29           HB2      ALA  29  16.472  11.457  13.415
    5    HB3  ALA  29           HB3      ALA  29  17.801  10.909  12.394

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LYS  30           H        LYS  30  16.526  10.389  15.754
    2    HA   LYS  30           HA       LYS  30  15.522  12.645  17.114
    3    HB2  LYS  30           HB2      LYS  30  15.392   9.703  17.811
    4    HB3  LYS  30           HB3      LYS  30  14.531  10.957  18.706
    5    HG2  LYS  30           HG2      LYS  30  13.415  11.654  16.586
    6    HG3  LYS  30           HG3      LYS  30  14.214  10.315  15.758
    7    HD2  LYS  30           HD2      LYS  30  13.128   8.711  17.281
    8    HD3  LYS  30           HD3      LYS  30  12.340  10.039  18.133
    9    HE2  LYS  30           HE2      LYS  30  11.181  10.684  16.040
   10    HE3  LYS  30           HE3      LYS  30  11.949   9.327  15.207
   11    HZ2  LYS  30           HZ1      LYS  30   9.636   8.930  16.082
   12    HZ1  LYS  30           HZ2      LYS  30  10.300   8.975  17.650
   13    HZ3  LYS  30           HZ3      LYS  30  10.804   7.789  16.538

  No H/Q in entry =          13
  In of MODEL   80
    1    H    GLN  31           H        GLN  31  18.168  10.457  17.852
    2    HA   GLN  31           HA       GLN  31  18.496  11.464  20.549
    3    HB2  GLN  31           HB2      GLN  31  20.512   9.883  18.945
    4    HB3  GLN  31           HB3      GLN  31  20.375  10.005  20.700
    5    HG2  GLN  31           HG2      GLN  31  17.857   9.070  19.924
    6    HG3  GLN  31           HG3      GLN  31  18.956   8.221  18.844
    7   HE21  GLN  31          HE21      GLN  31  17.401   7.080  21.114
    8   HE22  GLN  31          HE22      GLN  31  18.550   6.410  22.166

  No H/Q in entry =           8
  In of MODEL   80
    1    H    GLY  32           H        GLY  32  19.030  12.784  17.587
    2    HA3  GLY  32           HA2      GLY  32  20.029  14.824  17.079
    3    HA2  GLY  32           HA3      GLY  32  20.783  14.821  18.669

  No H/Q in entry =           3
  In of MODEL   80
    1    H    ASP  33           H        ASP  33  21.190  11.929  16.886
    2    HA   ASP  33           HA       ASP  33  24.021  12.588  16.428
    3    HB2  ASP  33           HB2      ASP  33  22.495   9.981  16.535
    4    HB3  ASP  33           HB3      ASP  33  24.183  10.088  16.044

  No H/Q in entry =           4
  In of MODEL   80
    1    H    PHE  34           H        PHE  34  23.552  13.918  14.548
    2    HA   PHE  34           HA       PHE  34  22.201  12.948  12.256
    3    HB2  PHE  34           HB2      PHE  34  24.345  15.068  12.495
    4    HB3  PHE  34           HB3      PHE  34  23.361  14.787  11.061
    5    HD1  PHE  34           HD1      PHE  34  23.618  16.713  13.979
    6    HD2  PHE  34           HD2      PHE  34  20.732  14.620  11.583
    7    HE1  PHE  34           HE1      PHE  34  21.808  18.120  14.926
    8    HE2  PHE  34           HE2      PHE  34  18.926  16.027  12.532
    9    HZ   PHE  34           HZ       PHE  34  19.468  17.777  14.199

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ALA  35           H        ALA  35  25.572  12.737  13.271
    2    HA   ALA  35           HA       ALA  35  26.678  11.915  10.814
    3    HB3  ALA  35           HB1      ALA  35  28.348  10.731  12.535
    4    HB2  ALA  35           HB2      ALA  35  27.488  11.760  13.681
    5    HB1  ALA  35           HB3      ALA  35  28.332  12.481  12.311

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ALA  36           H        ALA  36  25.545   9.960  13.573
    2    HA   ALA  36           HA       ALA  36  26.017   7.472  12.292
    3    HB2  ALA  36           HB1      ALA  36  25.578   6.723  14.365
    4    HB3  ALA  36           HB2      ALA  36  23.893   7.228  14.213
    5    HB1  ALA  36           HB3      ALA  36  25.099   8.352  14.841

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ALA  37           H        ALA  37  23.207   9.613  12.425
    2    HA   ALA  37           HA       ALA  37  21.344   7.857  11.241
    3    HB3  ALA  37           HB1      ALA  37  21.585  10.818  11.541
    4    HB1  ALA  37           HB2      ALA  37  20.266   9.745  12.008
    5    HB2  ALA  37           HB3      ALA  37  20.461  10.220  10.320

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LYS  38           H        LYS  38  23.459  10.310   9.773
    2    HA   LYS  38           HA       LYS  38  22.823   9.892   7.093
    3    HB2  LYS  38           HB2      LYS  38  24.638  11.436   8.545
    4    HB3  LYS  38           HB3      LYS  38  25.668  10.444   7.520
    5    HG2  LYS  38           HG2      LYS  38  24.512  11.225   5.523
    6    HG3  LYS  38           HG3      LYS  38  23.319  12.083   6.503
    7    HD2  LYS  38           HD2      LYS  38  24.921  13.672   7.262
    8    HD3  LYS  38           HD3      LYS  38  26.277  12.680   6.727
    9    HE2  LYS  38           HE2      LYS  38  25.933  14.557   5.179
   10    HE3  LYS  38           HE3      LYS  38  25.592  13.023   4.371
   11    HZ3  LYS  38           HZ1      LYS  38  23.398  13.478   4.237
   12    HZ2  LYS  38           HZ2      LYS  38  23.928  15.091   4.329
   13    HZ1  LYS  38           HZ3      LYS  38  23.347  14.307   5.719

  No H/Q in entry =          13
  In of MODEL   80
    1    H    ALA  39           H        ALA  39  25.326   8.277   9.051
    2    HA   ALA  39           HA       ALA  39  26.392   6.688   6.980
    3    HB2  ALA  39           HB1      ALA  39  26.292   5.719   9.821
    4    HB1  ALA  39           HB2      ALA  39  27.253   7.141   9.410
    5    HB3  ALA  39           HB3      ALA  39  27.598   5.591   8.644

  No H/Q in entry =           5
  In of MODEL   80
    1    H    MET  40           H        MET  40  23.771   6.080   9.271
    2    HA   MET  40           HA       MET  40  23.317   3.378   8.530
    3    HB2  MET  40           HB2      MET  40  21.507   5.427   9.823
    4    HB3  MET  40           HB3      MET  40  21.093   3.720   9.643
    5    HG2  MET  40           HG2      MET  40  23.644   4.647  10.992
    6    HG3  MET  40           HG3      MET  40  22.147   4.376  11.881
    7    HE3  MET  40           HE1      MET  40  21.567   0.745  12.048
    8    HE2  MET  40           HE2      MET  40  20.706   2.053  11.241
    9    HE1  MET  40           HE3      MET  40  21.444   2.333  12.816

  No H/Q in entry =           9
  In of MODEL   80
    1    H    MET  41           H        MET  41  21.919   6.440   7.346
    2    HA   MET  41           HA       MET  41  19.960   5.257   5.668
    3    HB2  MET  41           HB2      MET  41  21.453   7.842   5.163
    4    HB3  MET  41           HB3      MET  41  19.925   7.357   4.441
    5    HG2  MET  41           HG2      MET  41  19.173   7.166   6.990
    6    HG3  MET  41           HG3      MET  41  20.486   8.317   7.217
    7    HE2  MET  41           HE1      MET  41  19.936   9.615   3.883
    8    HE1  MET  41           HE2      MET  41  20.891  10.047   5.297
    9    HE3  MET  41           HE3      MET  41  19.624  11.133   4.733

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ASP  42           H        ASP  42  23.338   6.168   5.124
    2    HA   ASP  42           HA       ASP  42  23.433   5.699   2.365
    3    HB2  ASP  42           HB2      ASP  42  25.185   6.686   4.140
    4    HB3  ASP  42           HB3      ASP  42  25.836   5.058   4.010

  No H/Q in entry =           4
  In of MODEL   80
    1    H    GLN  43           H        GLN  43  24.143   3.536   5.082
    2    HA   GLN  43           HA       GLN  43  24.802   1.279   3.496
    3    HB2  GLN  43           HB2      GLN  43  23.774   1.460   6.338
    4    HB3  GLN  43           HB3      GLN  43  24.349  -0.030   5.581
    5    HG2  GLN  43           HG2      GLN  43  26.518   1.174   5.077
    6    HG3  GLN  43           HG3      GLN  43  25.938   2.501   6.078
    7   HE21  GLN  43          HE21      GLN  43  28.165   1.516   7.117
    8   HE22  GLN  43          HE22      GLN  43  27.884   0.432   8.390

  No H/Q in entry =           8
  In of MODEL   80
    1    H    SER  44           H        SER  44  21.748   2.422   4.877
    2    HA   SER  44           HA       SER  44  20.171   0.186   4.196
    3    HB2  SER  44           HB2      SER  44  19.737   2.714   5.347
    4    HB3  SER  44           HB3      SER  44  18.706   2.679   3.920
    5    HG   SER  44           HG       SER  44  17.605   1.736   5.638

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ARG  45           H        ARG  45  20.930   3.152   2.400
    2    HA   ARG  45           HA       ARG  45  19.407   2.677   0.091
    3    HB2  ARG  45           HB2      ARG  45  20.558   4.808   0.682
    4    HB3  ARG  45           HB3      ARG  45  22.101   4.047   0.298
    5    HG2  ARG  45           HG2      ARG  45  21.320   3.650  -2.019
    6    HG3  ARG  45           HG3      ARG  45  19.790   4.433  -1.633
    7    HD2  ARG  45           HD2      ARG  45  21.048   6.524  -1.042
    8    HD3  ARG  45           HD3      ARG  45  22.542   5.745  -1.609
    9    HE   ARG  45           HE       ARG  45  20.615   5.520  -3.650
   10   HH21  ARG  45          HH11      ARG  45  20.617   6.893  -5.410
   11   HH22  ARG  45          HH12      ARG  45  21.380   8.440  -5.300
   12   HH11  ARG  45          HH21      ARG  45  22.353   8.007  -2.014
   13   HH12  ARG  45          HH22      ARG  45  22.362   9.070  -3.375

  No H/Q in entry =          13
  In of MODEL   80
    1    H    MET  46           H        MET  46  22.766   1.786   0.843
    2    HA   MET  46           HA       MET  46  23.371   0.596  -1.643
    3    HB2  MET  46           HB2      MET  46  24.472   0.265   1.147
    4    HB3  MET  46           HB3      MET  46  25.123  -0.637  -0.224
    5    HG2  MET  46           HG2      MET  46  25.545   1.484  -1.421
    6    HG3  MET  46           HG3      MET  46  24.905   2.384  -0.052
    7    HE1  MET  46           HE1      MET  46  26.900   3.828   0.382
    8    HE3  MET  46           HE2      MET  46  27.648   3.184  -1.076
    9    HE2  MET  46           HE3      MET  46  28.583   3.285   0.416

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ALA  47           H        ALA  47  21.977  -0.737   1.328
    2    HA   ALA  47           HA       ALA  47  21.911  -3.448   0.519
    3    HB2  ALA  47           HB1      ALA  47  21.531  -2.990   2.824
    4    HB3  ALA  47           HB2      ALA  47  19.992  -3.584   2.202
    5    HB1  ALA  47           HB3      ALA  47  20.230  -1.855   2.464

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LEU  48           H        LEU  48  19.572  -0.808   0.165
    2    HA   LEU  48           HA       LEU  48  17.521  -2.328  -1.092
    3    HB2  LEU  48           HB2      LEU  48  18.191   0.623  -1.200
    4    HB3  LEU  48           HB3      LEU  48  16.717  -0.079  -1.870
    5    HG   LEU  48           HG       LEU  48  17.565  -0.391   1.019
    6   HD13  LEU  48          HD11      LEU  48  17.160   1.913   0.836
    7   HD12  LEU  48          HD12      LEU  48  15.597   1.272   1.343
    8   HD11  LEU  48          HD13      LEU  48  15.873   1.696  -0.348
    9   HD22  LEU  48          HD21      LEU  48  16.028  -2.096   0.633
   10   HD21  LEU  48          HD22      LEU  48  15.160  -1.186  -0.604
   11   HD23  LEU  48          HD23      LEU  48  14.948  -0.784   1.100

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ASN  49           H        ASN  49  20.221  -0.412  -2.316
    2    HA   ASN  49           HA       ASN  49  19.572  -0.487  -5.041
    3    HB2  ASN  49           HB2      ASN  49  21.256   1.022  -4.129
    4    HB3  ASN  49           HB3      ASN  49  22.273  -0.339  -3.672
    5   HD21  ASN  49          HD21      ASN  49  20.821   1.221  -6.550
    6   HD22  ASN  49          HD22      ASN  49  22.054   0.748  -7.616

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLU  50           H        GLU  50  21.542  -2.696  -3.080
    2    HA   GLU  50           HA       GLU  50  22.236  -4.452  -5.209
    3    HB2  GLU  50           HB2      GLU  50  23.432  -4.438  -3.041
    4    HB3  GLU  50           HB3      GLU  50  21.985  -5.059  -2.248
    5    HG2  GLU  50           HG2      GLU  50  22.064  -7.090  -3.610
    6    HG3  GLU  50           HG3      GLU  50  23.444  -6.464  -4.509

  No H/Q in entry =           6
  In of MODEL   80
    1    H    ALA  51           H        ALA  51  19.578  -4.376  -2.885
    2    HA   ALA  51           HA       ALA  51  18.399  -6.841  -3.647
    3    HB3  ALA  51           HB1      ALA  51  16.808  -6.329  -2.092
    4    HB1  ALA  51           HB2      ALA  51  16.604  -4.680  -2.688
    5    HB2  ALA  51           HB3      ALA  51  17.960  -5.076  -1.632

  No H/Q in entry =           5
  In of MODEL   80
    1    H    HIS  52           H        HIS  52  17.832  -3.488  -4.677
    2    HA   HIS  52           HA       HIS  52  15.717  -4.000  -6.479
    3    HB2  HIS  52           HB2      HIS  52  16.400  -1.740  -5.664
    4    HB3  HIS  52           HB3      HIS  52  17.832  -1.844  -6.688
    5    HD1  HIS  52           HD1      HIS  52  17.432  -1.888  -9.298
    6    HD2  HIS  52           HD2      HIS  52  14.010  -1.150  -7.034
    7    HE1  HIS  52           HE1      HIS  52  15.683  -1.015 -10.908
    8    HE2  HIS  52           HE2      HIS  52  13.591  -0.560  -9.543

  No H/Q in entry =           8
  In of MODEL   80
    1    H    LEU  53           H        LEU  53  19.236  -4.024  -6.909
    2    HA   LEU  53           HA       LEU  53  19.293  -4.336  -9.710
    3    HB2  LEU  53           HB2      LEU  53  21.221  -5.109  -7.535
    4    HB3  LEU  53           HB3      LEU  53  21.536  -5.499  -9.223
    5    HG   LEU  53           HG       LEU  53  20.882  -2.685  -8.297
    6   HD11  LEU  53          HD11      LEU  53  23.588  -4.000  -8.688
    7   HD13  LEU  53          HD12      LEU  53  22.924  -3.414  -7.163
    8   HD12  LEU  53          HD13      LEU  53  23.332  -2.275  -8.441
    9   HD22  LEU  53          HD21      LEU  53  20.621  -2.745 -10.640
   10   HD21  LEU  53          HD22      LEU  53  21.898  -3.941 -10.842
   11   HD23  LEU  53          HD23      LEU  53  22.310  -2.274 -10.484

  No H/Q in entry =          11
  In of MODEL   80
    1    H    VAL  54           H        VAL  54  19.166  -6.726  -7.088
    2    HA   VAL  54           HA       VAL  54  19.279  -9.019  -8.751
    3    HB   VAL  54           HB       VAL  54  18.125  -8.593  -5.984
    4   HG12  VAL  54          HG11      VAL  54  18.435 -11.212  -5.983
    5   HG11  VAL  54          HG12      VAL  54  18.252 -11.040  -7.728
    6   HG13  VAL  54          HG13      VAL  54  16.966 -10.505  -6.650
    7   HG22  VAL  54          HG21      VAL  54  20.441  -8.394  -5.759
    8   HG21  VAL  54          HG22      VAL  54  20.774  -9.486  -7.101
    9   HG23  VAL  54          HG23      VAL  54  20.239 -10.133  -5.550

  No H/Q in entry =           9
  In of MODEL   80
    1    H    GLN  55           H        GLN  55  16.559  -7.104  -7.467
    2    HA   GLN  55           HA       GLN  55  14.531  -8.756  -8.545
    3    HB2  GLN  55           HB2      GLN  55  13.789  -7.229  -6.916
    4    HB3  GLN  55           HB3      GLN  55  14.589  -5.864  -7.690
    5    HG2  GLN  55           HG2      GLN  55  12.867  -5.529  -9.181
    6    HG3  GLN  55           HG3      GLN  55  12.537  -7.248  -9.353
    7   HE21  GLN  55          HE21      GLN  55  10.527  -7.788  -8.550
    8   HE22  GLN  55          HE22      GLN  55   9.756  -7.032  -7.241

  No H/Q in entry =           8
  In of MODEL   80
    1    H    THR  56           H        THR  56  16.284  -5.963  -9.899
    2    HA   THR  56           HA       THR  56  14.849  -5.591 -12.248
    3    HB   THR  56           HB       THR  56  17.869  -5.516 -12.078
    4    HG1  THR  56           HG1      THR  56  15.882  -3.713 -11.195
    5   HG23  THR  56          HG21      THR  56  17.719  -3.909 -13.840
    6   HG22  THR  56          HG22      THR  56  15.970  -3.774 -13.657
    7   HG21  THR  56          HG23      THR  56  16.676  -5.252 -14.313

  No H/Q in entry =           7
  In of MODEL   80
    1    H    LYS  57           H        LYS  57  17.488  -7.901 -11.638
    2    HA   LYS  57           HA       LYS  57  17.485  -9.093 -14.218
    3    HB2  LYS  57           HB2      LYS  57  19.291  -9.375 -12.526
    4    HB3  LYS  57           HB3      LYS  57  18.184 -10.294 -11.516
    5    HG2  LYS  57           HG2      LYS  57  19.551 -11.870 -12.714
    6    HG3  LYS  57           HG3      LYS  57  17.934 -11.941 -13.404
    7    HD2  LYS  57           HD2      LYS  57  18.587 -10.689 -15.327
    8    HD3  LYS  57           HD3      LYS  57  20.111 -10.201 -14.586
    9    HE2  LYS  57           HE2      LYS  57  20.590 -11.973 -16.175
   10    HE3  LYS  57           HE3      LYS  57  20.792 -12.642 -14.556
   11    HZ2  LYS  57           HZ1      LYS  57  19.394 -13.890 -16.336
   12    HZ1  LYS  57           HZ2      LYS  57  18.167 -12.825 -15.845
   13    HZ3  LYS  57           HZ3      LYS  57  18.893 -13.866 -14.717

  No H/Q in entry =          13
  In of MODEL   80
    1    H    LEU  58           H        LEU  58  15.700  -9.756 -11.244
    2    HA   LEU  58           HA       LEU  58  14.469 -12.123 -12.182
    3    HB2  LEU  58           HB2      LEU  58  13.681 -10.217  -9.985
    4    HB3  LEU  58           HB3      LEU  58  12.868 -11.751 -10.303
    5    HG   LEU  58           HG       LEU  58  15.842 -11.486  -9.747
    6   HD11  LEU  58          HD11      LEU  58  13.468 -11.895  -7.955
    7   HD13  LEU  58          HD12      LEU  58  14.925 -10.938  -7.691
    8   HD12  LEU  58          HD13      LEU  58  14.990 -12.695  -7.558
    9   HD22  LEU  58          HD21      LEU  58  15.716 -13.546 -10.776
   10   HD21  LEU  58          HD22      LEU  58  14.001 -13.749 -10.417
   11   HD23  LEU  58          HD23      LEU  58  15.208 -14.056  -9.167

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  59           H        ILE  59  13.812  -8.783 -12.861
    2    HA   ILE  59           HA       ILE  59  11.094  -9.419 -13.803
    3    HB   ILE  59           HB       ILE  59  11.912  -7.140 -12.597
    4   HG12  ILE  59          HG12      ILE  59   9.994  -7.025 -14.936
    5   HG13  ILE  59          HG13      ILE  59   9.582  -7.773 -13.414
    6   HG23  ILE  59          HG21      ILE  59  12.484  -5.418 -14.108
    7   HG22  ILE  59          HG22      ILE  59  11.982  -6.341 -15.507
    8   HG21  ILE  59          HG23      ILE  59  13.465  -6.757 -14.652
    9   HD13  ILE  59          HD11      ILE  59   9.982  -5.691 -12.213
   10   HD12  ILE  59          HD12      ILE  59   8.835  -5.403 -13.521
   11   HD11  ILE  59          HD13      ILE  59  10.523  -4.918 -13.705

  No H/Q in entry =          11
  In of MODEL   80
    1    H    GLU  60           H        GLU  60  14.302  -8.579 -15.059
    2    HA   GLU  60           HA       GLU  60  13.525  -8.173 -17.767
    3    HB2  GLU  60           HB2      GLU  60  15.706  -7.447 -16.918
    4    HB3  GLU  60           HB3      GLU  60  16.161  -9.121 -16.611
    5    HG2  GLU  60           HG2      GLU  60  15.975  -9.622 -19.021
    6    HG3  GLU  60           HG3      GLU  60  15.508  -7.951 -19.333

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLY  61           H        GLY  61  14.490 -11.060 -15.955
    2    HA3  GLY  61           HA2      GLY  61  13.943 -12.703 -18.358
    3    HA2  GLY  61           HA3      GLY  61  14.972 -13.190 -17.016

  No H/Q in entry =           3
  In of MODEL   80
    1    H    ASP  62           H        ASP  62  11.857 -11.633 -16.647
    2    HA   ASP  62           HA       ASP  62  10.914 -13.540 -14.799
    3    HB2  ASP  62           HB2      ASP  62   8.795 -12.327 -14.962
    4    HB3  ASP  62           HB3      ASP  62  10.151 -11.212 -14.839

  No H/Q in entry =           4
  In of MODEL   80
    1    H    ALA  63           H        ALA  63  11.349 -15.547 -16.156
    2    HA   ALA  63           HA       ALA  63   9.747 -16.165 -18.437
    3    HB2  ALA  63           HB1      ALA  63  10.796 -18.212 -16.488
    4    HB1  ALA  63           HB2      ALA  63  11.875 -17.348 -17.580
    5    HB3  ALA  63           HB3      ALA  63  10.588 -18.363 -18.233

  No H/Q in entry =           5
  In of MODEL   80
    1    H    GLY  64           H        GLY  64   9.362 -16.683 -14.971
    2    HA3  GLY  64           HA2      GLY  64   7.506 -17.114 -13.687
    3    HA2  GLY  64           HA3      GLY  64   6.520 -16.733 -15.092

  No H/Q in entry =           3
  In of MODEL   80
    1    H    GLU  65           H        GLU  65   5.308 -18.601 -13.914
    2    HA   GLU  65           HA       GLU  65   6.305 -21.228 -14.067
    3    HB2  GLU  65           HB2      GLU  65   3.478 -20.189 -13.971
    4    HB3  GLU  65           HB3      GLU  65   3.894 -21.899 -13.866
    5    HG2  GLU  65           HG2      GLU  65   5.269 -21.478 -11.890
    6    HG3  GLU  65           HG3      GLU  65   4.953 -19.748 -12.011

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLY  66           H        GLY  66   4.389 -19.355 -16.298
    2    HA3  GLY  66           HA2      GLY  66   4.522 -21.480 -18.328
    3    HA2  GLY  66           HA3      GLY  66   3.338 -20.189 -18.295

  No H/Q in entry =           3
  In of MODEL   80
    1    H    LYS  67           H        LYS  67   4.172 -20.288 -20.614
    2    HA   LYS  67           HA       LYS  67   6.696 -19.381 -21.356
    3    HB2  LYS  67           HB2      LYS  67   4.046 -19.236 -22.788
    4    HB3  LYS  67           HB3      LYS  67   5.601 -18.869 -23.547
    5    HG2  LYS  67           HG2      LYS  67   6.435 -21.108 -22.934
    6    HG3  LYS  67           HG3      LYS  67   4.891 -21.479 -22.171
    7    HD2  LYS  67           HD2      LYS  67   3.745 -21.256 -24.326
    8    HD3  LYS  67           HD3      LYS  67   5.267 -20.819 -25.106
    9    HE2  LYS  67           HE2      LYS  67   4.790 -23.202 -25.464
   10    HE3  LYS  67           HE3      LYS  67   6.220 -23.010 -24.452
   11    HZ1  LYS  67           HZ1      LYS  67   4.000 -23.045 -22.773
   12    HZ3  LYS  67           HZ2      LYS  67   5.226 -24.211 -22.908
   13    HZ2  LYS  67           HZ3      LYS  67   3.820 -24.339 -23.853

  No H/Q in entry =          13
  In of MODEL   80
    1    H    MET  68           H        MET  68   3.906 -17.429 -22.115
    2    HA   MET  68           HA       MET  68   5.286 -14.971 -22.162
    3    HB2  MET  68           HB2      MET  68   2.347 -15.644 -22.099
    4    HB3  MET  68           HB3      MET  68   2.970 -14.009 -22.324
    5    HG2  MET  68           HG2      MET  68   4.209 -14.732 -24.315
    6    HG3  MET  68           HG3      MET  68   3.641 -16.386 -24.084
    7    HE1  MET  68           HE1      MET  68   2.983 -12.827 -24.698
    8    HE3  MET  68           HE2      MET  68   1.536 -12.886 -23.695
    9    HE2  MET  68           HE3      MET  68   1.383 -12.681 -25.438

  No H/Q in entry =           9
  In of MODEL   80
    1    H    LYS  69           H        LYS  69   3.238 -16.417 -19.617
    2    HA   LYS  69           HA       LYS  69   2.909 -14.147 -18.035
    3    HB2  LYS  69           HB2      LYS  69   2.901 -17.083 -17.393
    4    HB3  LYS  69           HB3      LYS  69   2.604 -15.864 -16.151
    5    HG2  LYS  69           HG2      LYS  69   0.702 -15.004 -17.302
    6    HG3  LYS  69           HG3      LYS  69   1.110 -15.881 -18.778
    7    HD2  LYS  69           HD2      LYS  69  -0.771 -16.843 -17.274
    8    HD3  LYS  69           HD3      LYS  69   0.465 -17.958 -17.862
    9    HE2  LYS  69           HE2      LYS  69   1.625 -17.925 -15.772
   10    HE3  LYS  69           HE3      LYS  69   0.691 -16.545 -15.198
   11    HZ2  LYS  69           HZ1      LYS  69   0.102 -19.035 -14.556
   12    HZ1  LYS  69           HZ2      LYS  69  -0.818 -18.908 -15.978
   13    HZ3  LYS  69           HZ3      LYS  69  -1.079 -17.826 -14.693

  No H/Q in entry =          13
  In of MODEL   80
    1    H    VAL  70           H        VAL  70   3.685 -14.296 -15.534
    2    HA   VAL  70           HA       VAL  70   6.644 -14.447 -15.508
    3    HB   VAL  70           HB       VAL  70   6.659 -12.389 -14.140
    4   HG13  VAL  70          HG11      VAL  70   6.188 -10.831 -15.955
    5   HG12  VAL  70          HG12      VAL  70   5.150 -12.018 -16.744
    6   HG11  VAL  70          HG13      VAL  70   6.887 -12.301 -16.634
    7   HG22  VAL  70          HG21      VAL  70   4.548 -12.324 -13.063
    8   HG21  VAL  70          HG22      VAL  70   3.679 -12.605 -14.570
    9   HG23  VAL  70          HG23      VAL  70   4.421 -11.036 -14.262

  No H/Q in entry =           9
  In of MODEL   80
    1    H    SER  71           H        SER  71   7.526 -14.571 -13.298
    2    HA   SER  71           HA       SER  71   6.299 -16.600 -11.736
    3    HB2  SER  71           HB2      SER  71   8.754 -16.154 -11.798
    4    HB3  SER  71           HB3      SER  71   8.474 -14.660 -10.907
    5    HG   SER  71           HG       SER  71   8.880 -16.166  -9.375

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LEU  72           H        LEU  72   4.951 -16.485 -10.032
    2    HA   LEU  72           HA       LEU  72   3.411 -14.166  -9.586
    3    HB2  LEU  72           HB2      LEU  72   3.686 -16.725  -8.016
    4    HB3  LEU  72           HB3      LEU  72   2.520 -15.465  -7.621
    5    HG   LEU  72           HG       LEU  72   2.684 -16.761 -10.361
    6   HD13  LEU  72          HD11      LEU  72   2.130 -18.485  -8.724
    7   HD12  LEU  72          HD12      LEU  72   0.676 -18.052  -9.622
    8   HD11  LEU  72          HD13      LEU  72   0.920 -17.434  -7.989
    9   HD23  LEU  72          HD21      LEU  72   0.199 -15.938 -10.271
   10   HD22  LEU  72          HD22      LEU  72   1.451 -14.750 -10.594
   11   HD21  LEU  72          HD23      LEU  72   0.762 -14.885  -8.980

  No H/Q in entry =          11
  In of MODEL   80
    1    H    VAL  73           H        VAL  73   6.059 -15.617  -7.812
    2    HA   VAL  73           HA       VAL  73   6.002 -14.088  -5.478
    3    HB   VAL  73           HB       VAL  73   8.147 -14.937  -5.026
    4   HG13  VAL  73          HG11      VAL  73   7.851 -17.242  -5.386
    5   HG12  VAL  73          HG12      VAL  73   7.124 -16.994  -6.974
    6   HG11  VAL  73          HG13      VAL  73   6.213 -16.605  -5.515
    7   HG21  VAL  73          HG21      VAL  73   8.420 -15.072  -8.033
    8   HG23  VAL  73          HG22      VAL  73   9.510 -15.945  -6.959
    9   HG22  VAL  73          HG23      VAL  73   9.427 -14.185  -6.889

  No H/Q in entry =           9
  In of MODEL   80
    1    H    LEU  74           H        LEU  74   7.000 -13.192  -8.651
    2    HA   LEU  74           HA       LEU  74   8.952 -11.253  -8.152
    3    HB2  LEU  74           HB2      LEU  74   8.506 -11.988 -10.392
    4    HB3  LEU  74           HB3      LEU  74   6.836 -11.434 -10.294
    5    HG   LEU  74           HG       LEU  74   7.623  -9.101 -10.071
    6   HD13  LEU  74          HD11      LEU  74   9.738  -9.284  -9.012
    7   HD12  LEU  74          HD12      LEU  74  10.120  -8.781 -10.658
    8   HD11  LEU  74          HD13      LEU  74  10.315 -10.468 -10.184
    9   HD21  LEU  74          HD21      LEU  74   7.392 -10.529 -12.296
   10   HD23  LEU  74          HD22      LEU  74   9.102 -10.178 -12.387
   11   HD22  LEU  74          HD23      LEU  74   7.954  -8.860 -12.329

  No H/Q in entry =          11
  In of MODEL   80
    1    H    VAL  75           H        VAL  75   5.459 -10.853  -8.510
    2    HA   VAL  75           HA       VAL  75   5.374  -8.097  -7.919
    3    HB   VAL  75           HB       VAL  75   3.274 -10.232  -7.539
    4   HG11  VAL  75          HG11      VAL  75   3.096  -7.192  -7.375
    5   HG13  VAL  75          HG12      VAL  75   2.794  -8.329  -6.069
    6   HG12  VAL  75          HG13      VAL  75   1.707  -8.270  -7.449
    7   HG23  VAL  75          HG21      VAL  75   2.371  -9.100  -9.612
    8   HG22  VAL  75          HG22      VAL  75   3.909  -9.923  -9.860
    9   HG21  VAL  75          HG23      VAL  75   3.864  -8.168  -9.687

  No H/Q in entry =           9
  In of MODEL   80
    1    H    GLU  76           H        GLU  76   5.104 -10.976  -5.815
    2    HA   GLU  76           HA       GLU  76   4.635  -9.617  -3.392
    3    HB2  GLU  76           HB2      GLU  76   4.472 -12.099  -3.679
    4    HB3  GLU  76           HB3      GLU  76   6.220 -12.175  -3.823
    5    HG2  GLU  76           HG2      GLU  76   6.474 -11.306  -1.537
    6    HG3  GLU  76           HG3      GLU  76   4.733 -11.174  -1.362

  No H/Q in entry =           6
  In of MODEL   80
    1    H    ALA  77           H        ALA  77   7.693 -10.535  -4.950
    2    HA   ALA  77           HA       ALA  77   9.383  -9.503  -2.929
    3    HB2  ALA  77           HB1      ALA  77  11.135  -9.525  -4.689
    4    HB3  ALA  77           HB2      ALA  77   9.890  -9.861  -5.892
    5    HB1  ALA  77           HB3      ALA  77  10.228 -11.037  -4.622

  No H/Q in entry =           5
  In of MODEL   80
    1    H    GLN  78           H        GLN  78   8.004  -8.074  -5.844
    2    HA   GLN  78           HA       GLN  78   9.368  -5.601  -5.732
    3    HB2  GLN  78           HB2      GLN  78   8.072  -6.506  -7.695
    4    HB3  GLN  78           HB3      GLN  78   6.589  -6.124  -6.822
    5    HG2  GLN  78           HG2      GLN  78   7.248  -3.757  -6.723
    6    HG3  GLN  78           HG3      GLN  78   8.738  -4.129  -7.587
    7   HE21  GLN  78          HE21      GLN  78   6.841  -2.298  -8.693
    8   HE22  GLN  78          HE22      GLN  78   6.152  -3.007 -10.073

  No H/Q in entry =           8
  In of MODEL   80
    1    H    LEU  79           H        LEU  79   6.339  -6.727  -4.311
    2    HA   LEU  79           HA       LEU  79   5.355  -4.317  -3.300
    3    HB2  LEU  79           HB2      LEU  79   4.030  -6.362  -3.252
    4    HB3  LEU  79           HB3      LEU  79   5.168  -7.109  -2.135
    5    HG   LEU  79           HG       LEU  79   4.620  -5.467  -0.406
    6   HD13  LEU  79          HD11      LEU  79   4.167  -3.448  -1.455
    7   HD12  LEU  79          HD12      LEU  79   2.538  -3.967  -1.021
    8   HD11  LEU  79          HD13      LEU  79   3.122  -4.189  -2.668
    9   HD23  LEU  79          HD21      LEU  79   2.030  -5.947  -0.324
   10   HD22  LEU  79          HD22      LEU  79   3.163  -7.292  -0.215
   11   HD21  LEU  79          HD23      LEU  79   2.355  -6.948  -1.741

  No H/Q in entry =          11
  In of MODEL   80
    1    H    HIS  80           H        HIS  80   7.521  -6.666  -1.715
    2    HA   HIS  80           HA       HIS  80   7.810  -5.129   0.657
    3    HB2  HIS  80           HB2      HIS  80   9.140  -7.498  -0.542
    4    HB3  HIS  80           HB3      HIS  80  10.051  -6.608   0.679
    5    HD1  HIS  80           HD1      HIS  80   9.550  -7.245   3.019
    6    HD2  HIS  80           HD2      HIS  80   6.337  -8.075   0.496
    7    HE1  HIS  80           HE1      HIS  80   7.769  -8.342   4.461
    8    HE2  HIS  80           HE2      HIS  80   5.803  -8.851   2.931

  No H/Q in entry =           8
  In of MODEL   80
    1    H    LEU  81           H        LEU  81   9.823  -5.411  -2.250
    2    HA   LEU  81           HA       LEU  81  11.874  -3.682  -1.362
    3    HB2  LEU  81           HB2      LEU  81  10.957  -4.465  -4.129
    4    HB3  LEU  81           HB3      LEU  81  12.382  -3.467  -3.833
    5    HG   LEU  81           HG       LEU  81  11.970  -6.188  -2.565
    6   HD12  LEU  81          HD11      LEU  81  13.788  -6.822  -4.310
    7   HD11  LEU  81          HD12      LEU  81  13.233  -5.393  -5.181
    8   HD13  LEU  81          HD13      LEU  81  12.113  -6.712  -4.849
    9   HD23  LEU  81          HD21      LEU  81  14.600  -5.888  -2.542
   10   HD22  LEU  81          HD22      LEU  81  13.618  -5.124  -1.294
   11   HD21  LEU  81          HD23      LEU  81  14.206  -4.173  -2.657

  No H/Q in entry =          11
  In of MODEL   80
    1    H    MET  82           H        MET  82   8.961  -3.026  -3.307
    2    HA   MET  82           HA       MET  82   9.518  -0.302  -3.801
    3    HB2  MET  82           HB2      MET  82   6.949  -1.881  -3.687
    4    HB3  MET  82           HB3      MET  82   6.960  -0.156  -4.049
    5    HG2  MET  82           HG2      MET  82   8.553  -2.237  -5.582
    6    HG3  MET  82           HG3      MET  82   6.991  -1.604  -6.099
    7    HE3  MET  82           HE1      MET  82   7.464   1.850  -7.263
    8    HE2  MET  82           HE2      MET  82   7.083   1.623  -5.558
    9    HE1  MET  82           HE3      MET  82   6.415   0.520  -6.757

  No H/Q in entry =           9
  In of MODEL   80
    1    H    THR  83           H        THR  83   7.708  -1.894  -1.205
    2    HA   THR  83           HA       THR  83   6.867   0.457   0.123
    3    HB   THR  83           HB       THR  83   6.716  -1.120   2.138
    4    HG1  THR  83           HG1      THR  83   7.462  -3.075   1.907
    5   HG22  THR  83          HG21      THR  83   5.059  -2.673   0.661
    6   HG21  THR  83          HG22      THR  83   5.297  -1.344  -0.468
    7   HG23  THR  83          HG23      THR  83   4.653  -1.028   1.144

  No H/Q in entry =           7
  In of MODEL   80
    1    H    SER  84           H        SER  84   9.676  -1.659   0.649
    2    HA   SER  84           HA       SER  84  10.737  -0.240   2.843
    3    HB2  SER  84           HB2      SER  84  11.986  -2.087   0.819
    4    HB3  SER  84           HB3      SER  84  12.933  -1.341   2.106
    5    HG   SER  84           HG       SER  84  10.646  -3.017   2.355

  No H/Q in entry =           5
  In of MODEL   80
    1    H    MET  85           H        MET  85  11.503   0.023  -0.642
    2    HA   MET  85           HA       MET  85  13.514   1.974  -0.381
    3    HB2  MET  85           HB2      MET  85  13.109   0.695  -2.450
    4    HB3  MET  85           HB3      MET  85  11.596   1.570  -2.684
    5    HG2  MET  85           HG2      MET  85  12.829   3.699  -2.794
    6    HG3  MET  85           HG3      MET  85  14.344   2.841  -2.530
    7    HE1  MET  85           HE1      MET  85  11.126   2.826  -4.543
    8    HE3  MET  85           HE2      MET  85  11.642   2.802  -6.226
    9    HE2  MET  85           HE3      MET  85  11.965   4.220  -5.238

  No H/Q in entry =           9
  In of MODEL   80
    1    H    LEU  86           H        LEU  86  10.028   2.333  -0.900
    2    HA   LEU  86           HA       LEU  86   9.984   5.147  -1.078
    3    HB2  LEU  86           HB2      LEU  86   8.130   3.501  -1.663
    4    HB3  LEU  86           HB3      LEU  86   7.794   3.410   0.066
    5    HG   LEU  86           HG       LEU  86   7.651   5.972   0.018
    6   HD11  LEU  86          HD11      LEU  86   8.433   5.535  -2.682
    7   HD13  LEU  86          HD12      LEU  86   8.004   7.064  -1.921
    8   HD12  LEU  86          HD13      LEU  86   6.764   6.111  -2.731
    9   HD23  LEU  86          HD21      LEU  86   5.513   4.637  -1.654
   10   HD22  LEU  86          HD22      LEU  86   5.328   5.896  -0.436
   11   HD21  LEU  86          HD23      LEU  86   5.714   4.248   0.055

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ALA  87           H        ALA  87   9.493   2.967   1.663
    2    HA   ALA  87           HA       ALA  87   8.952   4.881   3.634
    3    HB1  ALA  87           HB1      ALA  87   9.740   2.056   3.546
    4    HB3  ALA  87           HB2      ALA  87   8.617   2.874   4.629
    5    HB2  ALA  87           HB3      ALA  87  10.344   2.892   4.978

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ARG  88           H        ARG  88  12.028   3.437   2.661
    2    HA   ARG  88           HA       ARG  88  13.642   4.800   4.501
    3    HB2  ARG  88           HB2      ARG  88  14.301   2.824   3.096
    4    HB3  ARG  88           HB3      ARG  88  14.465   3.919   1.725
    5    HG2  ARG  88           HG2      ARG  88  15.942   5.219   3.679
    6    HG3  ARG  88           HG3      ARG  88  16.249   3.527   4.056
    7    HD2  ARG  88           HD2      ARG  88  17.519   3.224   2.212
    8    HD3  ARG  88           HD3      ARG  88  16.392   4.106   1.177
    9    HE   ARG  88           HE       ARG  88  18.791   5.151   2.234
   10   HH21  ARG  88          HH11      ARG  88  19.152   7.367   2.044
   11   HH22  ARG  88          HH12      ARG  88  17.810   8.448   1.899
   12   HH11  ARG  88          HH21      ARG  88  15.458   5.928   1.947
   13   HH12  ARG  88          HH22      ARG  88  15.716   7.631   1.819

  No H/Q in entry =          13
  In of MODEL   80
    1    H    GLU  89           H        GLU  89  12.685   5.711   1.176
    2    HA   GLU  89           HA       GLU  89  14.249   8.060   1.028
    3    HB2  GLU  89           HB2      GLU  89  13.103   7.031  -0.925
    4    HB3  GLU  89           HB3      GLU  89  11.561   7.581  -0.271
    5    HG2  GLU  89           HG2      GLU  89  12.279   9.914  -0.427
    6    HG3  GLU  89           HG3      GLU  89  13.881   9.413  -0.960

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LEU  90           H        LEU  90  10.913   7.572   2.147
    2    HA   LEU  90           HA       LEU  90  10.415  10.308   2.726
    3    HB2  LEU  90           HB2      LEU  90   9.199   7.741   3.745
    4    HB3  LEU  90           HB3      LEU  90   8.579   9.340   4.169
    5    HG   LEU  90           HG       LEU  90   8.999   8.462   1.299
    6   HD12  LEU  90          HD11      LEU  90   6.463   8.151   1.354
    7   HD11  LEU  90          HD12      LEU  90   6.612   8.137   3.111
    8   HD13  LEU  90          HD13      LEU  90   7.425   6.903   2.146
    9   HD22  LEU  90          HD21      LEU  90   8.722  10.773   1.229
   10   HD21  LEU  90          HD22      LEU  90   7.731  10.809   2.686
   11   HD23  LEU  90          HD23      LEU  90   7.035  10.262   1.162

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  91           H        ILE  91  11.654   7.615   4.647
    2    HA   ILE  91           HA       ILE  91  11.796   8.974   7.118
    3    HB   ILE  91           HB       ILE  91  13.337   6.627   5.995
    4   HG12  ILE  91          HG12      ILE  91  11.316   6.804   8.249
    5   HG13  ILE  91          HG13      ILE  91  10.848   6.530   6.571
    6   HG22  ILE  91          HG21      ILE  91  13.798   6.405   8.636
    7   HG21  ILE  91          HG22      ILE  91  13.735   8.165   8.538
    8   HG23  ILE  91          HG23      ILE  91  14.910   7.270   7.575
    9   HD13  ILE  91          HD11      ILE  91  11.836   4.421   6.500
   10   HD12  ILE  91          HD12      ILE  91  11.238   4.480   8.158
   11   HD11  ILE  91          HD13      ILE  91  12.943   4.782   7.825

  No H/Q in entry =          11
  In of MODEL   80
    1    H    THR  92           H        THR  92  14.020   8.794   4.372
    2    HA   THR  92           HA       THR  92  16.192  10.170   5.540
    3    HB   THR  92           HB       THR  92  15.213  10.057   2.677
    4    HG1  THR  92           HG1      THR  92  16.030   8.154   3.081
    5   HG22  THR  92          HG21      THR  92  17.788  10.730   2.392
    6   HG21  THR  92          HG22      THR  92  17.482  11.550   3.922
    7   HG23  THR  92          HG23      THR  92  16.518  11.947   2.499

  No H/Q in entry =           7
  In of MODEL   80
    1    H    GLU  93           H        GLU  93  13.318  11.347   3.805
    2    HA   GLU  93           HA       GLU  93  13.931  14.103   3.926
    3    HB2  GLU  93           HB2      GLU  93  11.217  12.749   3.930
    4    HB3  GLU  93           HB3      GLU  93  11.518  14.448   3.562
    5    HG2  GLU  93           HG2      GLU  93  12.845  12.199   2.034
    6    HG3  GLU  93           HG3      GLU  93  11.304  12.893   1.544

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LEU  94           H        LEU  94  12.167  11.955   6.129
    2    HA   LEU  94           HA       LEU  94  11.366  13.904   8.006
    3    HB2  LEU  94           HB2      LEU  94  11.921  10.944   8.276
    4    HB3  LEU  94           HB3      LEU  94  11.352  11.921   9.627
    5    HG   LEU  94           HG       LEU  94   9.876  11.988   6.994
    6   HD11  LEU  94          HD11      LEU  94   9.938   9.763   8.995
    7   HD13  LEU  94          HD12      LEU  94   9.640   9.707   7.259
    8   HD12  LEU  94          HD13      LEU  94   8.363  10.231   8.354
    9   HD23  LEU  94          HD21      LEU  94   7.955  12.398   8.590
   10   HD22  LEU  94          HD22      LEU  94   9.202  13.644   8.632
   11   HD21  LEU  94          HD23      LEU  94   9.128  12.425   9.904

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  95           H        ILE  95  14.327  11.954   7.774
    2    HA   ILE  95           HA       ILE  95  15.495  12.864  10.192
    3    HB   ILE  95           HB       ILE  95  16.733  11.791   7.646
    4   HG12  ILE  95          HG12      ILE  95  16.422  10.587  10.410
    5   HG13  ILE  95          HG13      ILE  95  15.257  10.339   9.111
    6   HG21  ILE  95          HG21      ILE  95  17.987  12.584  10.293
    7   HG23  ILE  95          HG22      ILE  95  18.457  13.112   8.676
    8   HG22  ILE  95          HG23      ILE  95  18.751  11.449   9.182
    9   HD13  ILE  95          HD11      ILE  95  16.731   9.052   7.850
   10   HD12  ILE  95          HD12      ILE  95  17.196   8.597   9.486
   11   HD11  ILE  95          HD13      ILE  95  18.160   9.772   8.592

  No H/Q in entry =          11
  In of MODEL   80
    1    H    GLU  96           H        GLU  96  15.667  14.102   6.861
    2    HA   GLU  96           HA       GLU  96  17.527  16.167   7.346
    3    HB2  GLU  96           HB2      GLU  96  16.863  15.513   5.084
    4    HB3  GLU  96           HB3      GLU  96  15.223  16.081   5.381
    5    HG2  GLU  96           HG2      GLU  96  15.806  18.207   4.844
    6    HG3  GLU  96           HG3      GLU  96  17.101  18.197   6.030

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LEU  97           H        LEU  97  14.013  16.004   7.766
    2    HA   LEU  97           HA       LEU  97  13.614  18.739   8.412
    3    HB2  LEU  97           HB2      LEU  97  12.077  16.223   9.018
    4    HB3  LEU  97           HB3      LEU  97  11.573  17.772   9.690
    5    HG   LEU  97           HG       LEU  97  12.060  17.358   6.726
    6   HD12  LEU  97          HD11      LEU  97   9.536  17.248   6.601
    7   HD11  LEU  97          HD12      LEU  97   9.524  17.045   8.351
    8   HD13  LEU  97          HD13      LEU  97  10.299  15.834   7.329
    9   HD23  LEU  97          HD21      LEU  97  10.336  19.335   6.758
   10   HD22  LEU  97          HD22      LEU  97  12.019  19.681   7.155
   11   HD21  LEU  97          HD23      LEU  97  10.826  19.517   8.442

  No H/Q in entry =          11
  In of MODEL   80
    1    H    HIS  98           H        HIS  98  14.411  15.904  10.404
    2    HA   HIS  98           HA       HIS  98  14.256  17.161  12.922
    3    HB2  HIS  98           HB2      HIS  98  15.992  14.893  11.921
    4    HB3  HIS  98           HB3      HIS  98  15.990  15.429  13.603
    5    HD1  HIS  98           HD1      HIS  98  13.786  13.819  11.002
    6    HD2  HIS  98           HD2      HIS  98  13.675  14.732  15.068
    7    HE1  HIS  98           HE1      HIS  98  11.750  12.637  11.948
    8    HE2  HIS  98           HE2      HIS  98  11.663  13.185  14.420

  No H/Q in entry =           8
  In of MODEL   80
    1    H    GLU  99           H        GLU  99  16.814  17.032  10.494
    2    HA   GLU  99           HA       GLU  99  18.806  18.346  12.030
    3    HB2  GLU  99           HB2      GLU  99  19.281  17.059   9.960
    4    HB3  GLU  99           HB3      GLU  99  18.482  18.322   9.019
    5    HG2  GLU  99           HG2      GLU  99  20.100  19.979   9.817
    6    HG3  GLU  99           HG3      GLU  99  20.868  18.770  10.839

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LYS 100           H        LYS 100  16.296  19.531   9.810
    2    HA   LYS 100           HA       LYS 100  17.113  22.262   9.961
    3    HB2  LYS 100           HB2      LYS 100  14.472  20.994   9.197
    4    HB3  LYS 100           HB3      LYS 100  14.785  22.731   9.111
    5    HG2  LYS 100           HG2      LYS 100  16.757  22.270   7.648
    6    HG3  LYS 100           HG3      LYS 100  16.331  20.556   7.662
    7    HD2  LYS 100           HD2      LYS 100  14.142  21.084   6.657
    8    HD3  LYS 100           HD3      LYS 100  14.551  22.800   6.651
    9    HE2  LYS 100           HE2      LYS 100  16.510  22.308   5.195
   10    HE3  LYS 100           HE3      LYS 100  16.032  20.607   5.157
   11    HZ1  LYS 100           HZ1      LYS 100  14.226  22.815   4.322
   12    HZ3  LYS 100           HZ2      LYS 100  14.030  21.147   4.056
   13    HZ2  LYS 100           HZ3      LYS 100  15.249  22.001   3.240

  No H/Q in entry =          13
  In of MODEL   80
    1    H    LEU 101           H        LEU 101  14.995  20.228  11.917
    2    HA   LEU 101           HA       LEU 101  13.841  22.302  13.497
    3    HB2  LEU 101           HB2      LEU 101  14.260  19.349  13.876
    4    HB3  LEU 101           HB3      LEU 101  13.728  20.330  15.237
    5    HG   LEU 101           HG       LEU 101  12.317  20.435  12.565
    6   HD12  LEU 101          HD11      LEU 101  10.643  18.881  13.827
    7   HD11  LEU 101          HD12      LEU 101  12.032  18.456  14.824
    8   HD13  LEU 101          HD13      LEU 101  12.067  18.152  13.087
    9   HD21  LEU 101          HD21      LEU 101  11.660  21.227  15.417
   10   HD23  LEU 101          HD22      LEU 101  10.400  21.014  14.204
   11   HD22  LEU 101          HD23      LEU 101  11.645  22.240  13.971

  No H/Q in entry =          11
  In of MODEL   80
    1    H    LYS 102           H        LYS 102  16.985  21.671  13.066
    2    HA   LYS 102           HA       LYS 102  18.835  22.525  14.145
    3    HB2  LYS 102           HB2      LYS 102  17.031  24.052  15.277
    4    HB3  LYS 102           HB3      LYS 102  17.226  22.985  16.652
    5    HG2  LYS 102           HG2      LYS 102  19.138  24.984  15.491
    6    HG3  LYS 102           HG3      LYS 102  18.749  24.669  17.169
    7    HD2  LYS 102           HD2      LYS 102  20.405  22.747  15.483
    8    HD3  LYS 102           HD3      LYS 102  21.103  24.062  16.420
    9    HE2  LYS 102           HE2      LYS 102  20.682  21.514  17.383
   10    HE3  LYS 102           HE3      LYS 102  20.910  22.953  18.377
   11    HZ2  LYS 102           HZ1      LYS 102  18.930  21.683  18.988
   12    HZ1  LYS 102           HZ2      LYS 102  18.291  21.921  17.438
   13    HZ3  LYS 102           HZ3      LYS 102  18.529  23.247  18.467

  No H/Q in entry =          13
  In of MODEL   80
    1    H    ALA 103           H        ALA 103  16.746  20.932  16.559
    2    HA   ALA 103           HA       ALA 103  18.459  19.704  18.215
    3    HB2  ALA 103           HB1      ALA 103  16.859  17.709  18.202
    4    HB1  ALA 103           HB2      ALA 103  15.973  18.572  16.944
    5    HB3  ALA 103           HB3      ALA 103  16.153  19.288  18.544

  No H/Q in entry =           5
  In of MODEL   80
    1    H1   ALA   1           H3       ALA   1  -1.590  -6.911 -21.506
    2    H2   ALA   1           H2       ALA   1  -2.397  -8.340 -21.058
    3    H3   ALA   1           H1       ALA   1  -0.789  -8.402 -21.609
    4    HA   ALA   1           HA       ALA   1  -1.621  -8.861 -23.608
    5    HB1  ALA   1           HB1      ALA   1  -3.766  -9.562 -23.141
    6    HB2  ALA   1           HB2      ALA   1  -4.190  -8.046 -23.937
    7    HB3  ALA   1           HB3      ALA   1  -4.134  -8.130 -22.178

  No H/Q in entry =           7
  In of MODEL   80
    1    H    GLU   2           H        GLU   2  -2.437  -7.659 -25.597
    2    HA   GLU   2           HA       GLU   2  -1.019  -5.655 -26.467
    3    HB2  GLU   2           HB2      GLU   2  -4.026  -5.696 -26.792
    4    HB3  GLU   2           HB3      GLU   2  -2.895  -4.840 -27.837
    5    HG2  GLU   2           HG2      GLU   2  -2.405  -6.732 -28.995
    6    HG3  GLU   2           HG3      GLU   2  -2.119  -7.643 -27.518

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLU   3           H        GLU   3  -4.171  -4.373 -25.572
    2    HA   GLU   3           HA       GLU   3  -3.104  -1.828 -24.935
    3    HB2  GLU   3           HB2      GLU   3  -5.804  -3.120 -24.613
    4    HB3  GLU   3           HB3      GLU   3  -5.494  -1.509 -23.962
    5    HG2  GLU   3           HG2      GLU   3  -5.125  -0.581 -26.085
    6    HG3  GLU   3           HG3      GLU   3  -4.741  -2.138 -26.812

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LEU   4           H        LEU   4  -4.720  -4.178 -22.765
    2    HA   LEU   4           HA       LEU   4  -4.352  -2.958 -20.370
    3    HB2  LEU   4           HB2      LEU   4  -3.832  -5.903 -20.845
    4    HB3  LEU   4           HB3      LEU   4  -4.236  -5.157 -19.300
    5    HG   LEU   4           HG       LEU   4  -6.003  -5.210 -21.769
    6   HD13  LEU   4          HD11      LEU   4  -7.213  -6.919 -20.778
    7   HD12  LEU   4          HD12      LEU   4  -6.728  -6.468 -19.145
    8   HD11  LEU   4          HD13      LEU   4  -5.597  -7.318 -20.195
    9   HD23  LEU   4          HD21      LEU   4  -7.685  -4.389 -19.904
   10   HD22  LEU   4          HD22      LEU   4  -6.635  -3.224 -20.709
   11   HD21  LEU   4          HD23      LEU   4  -6.218  -3.822 -19.104

  No H/Q in entry =          11
  In of MODEL   80
    1    H    GLU   5           H        GLU   5  -1.865  -4.818 -22.099
    2    HA   GLU   5           HA       GLU   5   0.116  -4.556 -20.056
    3    HB2  GLU   5           HB2      GLU   5   0.179  -6.325 -21.803
    4    HB3  GLU   5           HB3      GLU   5   0.487  -5.085 -23.019
    5    HG2  GLU   5           HG2      GLU   5   2.561  -4.448 -21.879
    6    HG3  GLU   5           HG3      GLU   5   2.249  -5.632 -20.610

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLU   6           H        GLU   6  -0.497  -2.830 -23.099
    2    HA   GLU   6           HA       GLU   6   1.688  -1.018 -22.821
    3    HB2  GLU   6           HB2      GLU   6   0.574  -1.478 -24.988
    4    HB3  GLU   6           HB3      GLU   6  -0.885  -0.692 -24.386
    5    HG2  GLU   6           HG2      GLU   6   0.355   1.408 -24.078
    6    HG3  GLU   6           HG3      GLU   6   1.831   0.629 -24.642

  No H/Q in entry =           6
  In of MODEL   80
    1    H    VAL   7           H        VAL   7  -1.654  -1.063 -21.785
    2    HA   VAL   7           HA       VAL   7  -1.854   1.649 -20.943
    3    HB   VAL   7           HB       VAL   7  -3.340  -0.858 -20.116
    4   HG11  VAL   7          HG11      VAL   7  -3.692   2.032 -19.296
    5   HG13  VAL   7          HG12      VAL   7  -3.608   0.605 -18.264
    6   HG12  VAL   7          HG13      VAL   7  -5.035   0.889 -19.260
    7   HG21  VAL   7          HG21      VAL   7  -3.481   0.225 -22.502
    8   HG23  VAL   7          HG22      VAL   7  -4.418   1.480 -21.690
    9   HG22  VAL   7          HG23      VAL   7  -4.978  -0.192 -21.669

  No H/Q in entry =           9
  In of MODEL   80
    1    H    VAL   8           H        VAL   8  -0.896  -1.348 -19.304
    2    HA   VAL   8           HA       VAL   8  -0.575  -0.277 -16.705
    3    HB   VAL   8           HB       VAL   8   0.694  -2.634 -18.106
    4   HG11  VAL   8          HG11      VAL   8   1.189  -1.481 -15.371
    5   HG13  VAL   8          HG12      VAL   8   2.350  -2.132 -16.528
    6   HG12  VAL   8          HG13      VAL   8   1.300  -3.222 -15.624
    7   HG23  VAL   8          HG21      VAL   8  -0.831  -3.367 -15.814
    8   HG22  VAL   8          HG22      VAL   8  -1.267  -3.609 -17.504
    9   HG21  VAL   8          HG23      VAL   8  -1.788  -2.153 -16.661

  No H/Q in entry =           9
  In of MODEL   80
    1    H    MET   9           H        MET   9   1.678  -0.591 -19.448
    2    HA   MET   9           HA       MET   9   3.970   0.429 -18.178
    3    HB2  MET   9           HB2      MET   9   3.023   0.422 -21.036
    4    HB3  MET   9           HB3      MET   9   4.512   1.249 -20.583
    5    HG2  MET   9           HG2      MET   9   5.154  -0.962 -19.406
    6    HG3  MET   9           HG3      MET   9   3.856  -1.687 -20.357
    7    HE2  MET   9           HE1      MET   9   3.807  -0.251 -23.086
    8    HE1  MET   9           HE2      MET   9   3.730  -1.976 -22.733
    9    HE3  MET   9           HE3      MET   9   4.844  -1.384 -23.962

  No H/Q in entry =           9
  In of MODEL   80
    1    H    GLY  10           H        GLY  10   1.304   2.059 -19.858
    2    HA3  GLY  10           HA2      GLY  10   2.291   4.703 -19.606
    3    HA2  GLY  10           HA3      GLY  10   0.598   4.259 -19.815

  No H/Q in entry =           3
  In of MODEL   80
    1    H    LEU  11           H        LEU  11   0.179   2.731 -17.534
    2    HA   LEU  11           HA       LEU  11  -0.337   4.708 -15.571
    3    HB2  LEU  11           HB2      LEU  11  -0.298   1.691 -15.422
    4    HB3  LEU  11           HB3      LEU  11  -0.800   2.716 -14.078
    5    HG   LEU  11           HG       LEU  11  -2.032   2.848 -16.844
    6   HD13  LEU  11          HD11      LEU  11  -2.638   0.709 -16.095
    7   HD12  LEU  11          HD12      LEU  11  -3.980   1.712 -15.550
    8   HD11  LEU  11          HD13      LEU  11  -2.731   1.217 -14.408
    9   HD22  LEU  11          HD21      LEU  11  -2.606   4.867 -15.833
   10   HD21  LEU  11          HD22      LEU  11  -2.540   4.196 -14.204
   11   HD23  LEU  11          HD23      LEU  11  -3.917   3.846 -15.250

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  12           H        ILE  12   2.183   2.218 -15.814
    2    HA   ILE  12           HA       ILE  12   3.389   2.737 -13.306
    3    HB   ILE  12           HB       ILE  12   4.634   1.689 -15.870
    4   HG12  ILE  12          HG12      ILE  12   2.613   0.473 -14.729
    5   HG13  ILE  12          HG13      ILE  12   4.008  -0.474 -15.204
    6   HG21  ILE  12          HG21      ILE  12   5.613   1.660 -12.998
    7   HG23  ILE  12          HG22      ILE  12   6.406   2.393 -14.391
    8   HG22  ILE  12          HG23      ILE  12   6.289   0.640 -14.266
    9   HD13  ILE  12          HD11      ILE  12   4.824  -0.466 -12.917
   10   HD12  ILE  12          HD12      ILE  12   3.146  -1.008 -12.921
   11   HD11  ILE  12          HD13      ILE  12   3.539   0.627 -12.431

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  13           H        ILE  13   4.008   4.003 -16.559
    2    HA   ILE  13           HA       ILE  13   6.161   5.700 -15.826
    3    HB   ILE  13           HB       ILE  13   4.134   5.816 -18.074
    4   HG12  ILE  13          HG12      ILE  13   5.933   3.939 -17.800
    5   HG13  ILE  13          HG13      ILE  13   5.706   4.690 -19.375
    6   HG22  ILE  13          HG21      ILE  13   5.931   7.354 -19.138
    7   HG21  ILE  13          HG22      ILE  13   6.494   7.617 -17.491
    8   HG23  ILE  13          HG23      ILE  13   4.849   8.067 -17.939
    9   HD11  ILE  13          HD11      ILE  13   7.775   5.734 -17.423
   10   HD13  ILE  13          HD12      ILE  13   7.666   6.001 -19.159
   11   HD12  ILE  13          HD13      ILE  13   8.130   4.420 -18.542

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ASN  14           H        ASN  14   2.660   6.230 -16.099
    2    HA   ASN  14           HA       ASN  14   2.643   8.974 -15.456
    3    HB2  ASN  14           HB2      ASN  14   0.735   7.353 -16.294
    4    HB3  ASN  14           HB3      ASN  14   0.409   7.174 -14.574
    5   HD21  ASN  14          HD21      ASN  14  -1.596   8.353 -16.007
    6   HD22  ASN  14          HD22      ASN  14  -1.643  10.026 -15.736

  No H/Q in entry =           6
  In of MODEL   80
    1    H    SER  15           H        SER  15   2.316   6.096 -13.386
    2    HA   SER  15           HA       SER  15   2.018   7.463 -10.935
    3    HB2  SER  15           HB2      SER  15   2.546   5.369  -9.890
    4    HB3  SER  15           HB3      SER  15   1.715   4.962 -11.387
    5    HG   SER  15           HG       SER  15   4.522   5.054 -10.981

  No H/Q in entry =           5
  In of MODEL   80
    1    H    GLY  16           H        GLY  16   4.887   6.343 -12.692
    2    HA3  GLY  16           HA2      GLY  16   6.815   7.077 -10.756
    3    HA2  GLY  16           HA3      GLY  16   7.120   6.875 -12.480

  No H/Q in entry =           3
  In of MODEL   80
    1    H    GLN  17           H        GLN  17   5.450   8.851 -13.541
    2    HA   GLN  17           HA       GLN  17   7.048  11.178 -13.224
    3    HB2  GLN  17           HB2      GLN  17   4.296  10.777 -14.430
    4    HB3  GLN  17           HB3      GLN  17   5.171  12.308 -14.498
    5    HG2  GLN  17           HG2      GLN  17   6.232   9.671 -15.552
    6    HG3  GLN  17           HG3      GLN  17   5.507  10.934 -16.547
    7   HE21  GLN  17          HE21      GLN  17   8.470   9.771 -15.782
    8   HE22  GLN  17          HE22      GLN  17   9.379  11.204 -15.831

  No H/Q in entry =           8
  In of MODEL   80
    1    H    ALA  18           H        ALA  18   3.937  10.184 -11.883
    2    HA   ALA  18           HA       ALA  18   3.230  12.576 -10.613
    3    HB1  ALA  18           HB1      ALA  18   2.080  10.130 -10.843
    4    HB2  ALA  18           HB2      ALA  18   1.540  11.352  -9.694
    5    HB3  ALA  18           HB3      ALA  18   2.618  10.059  -9.165

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ARG  19           H        ARG  19   5.078   9.794  -9.337
    2    HA   ARG  19           HA       ARG  19   5.616  10.942  -6.811
    3    HB2  ARG  19           HB2      ARG  19   6.010   8.536  -7.343
    4    HB3  ARG  19           HB3      ARG  19   7.372   9.014  -8.361
    5    HG2  ARG  19           HG2      ARG  19   8.497  10.039  -6.434
    6    HG3  ARG  19           HG3      ARG  19   7.116   9.660  -5.406
    7    HD2  ARG  19           HD2      ARG  19   8.864   8.010  -5.049
    8    HD3  ARG  19           HD3      ARG  19   7.485   7.241  -5.839
    9    HE   ARG  19           HE       ARG  19   9.200   8.050  -7.881
   10   HH21  ARG  19          HH11      ARG  19  10.750   6.635  -8.732
   11   HH22  ARG  19          HH12      ARG  19  11.283   5.280  -7.798
   12   HH11  ARG  19          HH21      ARG  19   9.250   6.013  -5.107
   13   HH12  ARG  19          HH22      ARG  19  10.430   4.928  -5.745

  No H/Q in entry =          13
  In of MODEL   80
    1    H    SER  20           H        SER  20   7.439  10.964  -9.857
    2    HA   SER  20           HA       SER  20   9.693  12.359  -9.025
    3    HB2  SER  20           HB2      SER  20   9.470  11.376 -11.275
    4    HB3  SER  20           HB3      SER  20   8.267  12.595 -11.684
    5    HG   SER  20           HG       SER  20  10.844  13.273 -10.742

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LEU  21           H        LEU  21   6.606  13.655 -10.225
    2    HA   LEU  21           HA       LEU  21   7.298  16.395  -9.993
    3    HB2  LEU  21           HB2      LEU  21   4.617  14.994  -9.918
    4    HB3  LEU  21           HB3      LEU  21   4.800  16.746  -9.924
    5    HG   LEU  21           HG       LEU  21   5.980  14.936 -12.052
    6   HD11  LEU  21          HD11      LEU  21   3.476  14.840 -11.968
    7   HD13  LEU  21          HD12      LEU  21   4.096  15.553 -13.457
    8   HD12  LEU  21          HD13      LEU  21   3.441  16.589 -12.190
    9   HD23  LEU  21          HD21      LEU  21   5.781  17.268 -13.288
   10   HD22  LEU  21          HD22      LEU  21   7.148  16.985 -12.213
   11   HD21  LEU  21          HD23      LEU  21   5.774  17.927 -11.655

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ALA  22           H        ALA  22   5.764  14.112  -7.753
    2    HA   ALA  22           HA       ALA  22   5.170  15.919  -5.683
    3    HB3  ALA  22           HB1      ALA  22   4.393  13.533  -5.853
    4    HB2  ALA  22           HB2      ALA  22   4.981  13.997  -4.256
    5    HB1  ALA  22           HB3      ALA  22   6.000  13.033  -5.328

  No H/Q in entry =           5
  In of MODEL   80
    1    H    TYR  23           H        TYR  23   8.091  13.874  -6.121
    2    HA   TYR  23           HA       TYR  23   9.477  14.878  -3.863
    3    HB2  TYR  23           HB2      TYR  23  10.252  12.868  -5.024
    4    HB3  TYR  23           HB3      TYR  23  10.574  13.807  -6.481
    5    HD1  TYR  23           HD1      TYR  23  11.534  13.441  -2.893
    6    HD2  TYR  23           HD2      TYR  23  12.612  14.980  -6.757
    7    HE1  TYR  23           HE1      TYR  23  13.795  14.003  -2.040
    8    HE2  TYR  23           HE2      TYR  23  14.873  15.542  -5.903
    9    HH   TYR  23           HH       TYR  23  16.096  14.338  -3.014

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ALA  24           H        ALA  24   9.307  15.994  -7.227
    2    HA   ALA  24           HA       ALA  24  11.216  18.067  -6.973
    3    HB2  ALA  24           HB1      ALA  24  10.778  18.137  -9.182
    4    HB3  ALA  24           HB2      ALA  24   9.226  18.895  -8.824
    5    HB1  ALA  24           HB3      ALA  24   9.341  17.142  -8.958

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ALA  25           H        ALA  25   7.735  17.902  -6.359
    2    HA   ALA  25           HA       ALA  25   7.270  20.622  -5.784
    3    HB1  ALA  25           HB1      ALA  25   5.597  18.634  -5.993
    4    HB2  ALA  25           HB2      ALA  25   5.235  19.922  -4.842
    5    HB3  ALA  25           HB3      ALA  25   5.915  18.396  -4.273

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LEU  26           H        LEU  26   8.319  17.931  -3.738
    2    HA   LEU  26           HA       LEU  26   8.428  19.357  -1.298
    3    HB2  LEU  26           HB2      LEU  26   8.509  16.940  -1.298
    4    HB3  LEU  26           HB3      LEU  26   9.981  16.941  -2.266
    5    HG   LEU  26           HG       LEU  26  11.199  18.049  -0.421
    6   HD12  LEU  26          HD11      LEU  26   9.969  18.058   1.837
    7   HD11  LEU  26          HD12      LEU  26   8.482  17.930   0.899
    8   HD13  LEU  26          HD13      LEU  26   9.535  19.331   0.695
    9   HD21  LEU  26          HD21      LEU  26   9.651  15.587   0.444
   10   HD23  LEU  26          HD22      LEU  26  11.168  16.140   1.145
   11   HD22  LEU  26          HD23      LEU  26  11.122  15.585  -0.526

  No H/Q in entry =          11
  In of MODEL   80
    1    H    LYS  27           H        LYS  27  10.846  18.777  -3.820
    2    HA   LYS  27           HA       LYS  27  13.034  20.004  -2.585
    3    HB2  LYS  27           HB2      LYS  27  13.132  18.661  -4.678
    4    HB3  LYS  27           HB3      LYS  27  12.375  19.998  -5.542
    5    HG2  LYS  27           HG2      LYS  27  14.247  21.473  -4.958
    6    HG3  LYS  27           HG3      LYS  27  14.999  20.175  -4.022
    7    HD2  LYS  27           HD2      LYS  27  15.139  18.791  -6.079
    8    HD3  LYS  27           HD3      LYS  27  14.433  20.115  -7.006
    9    HE2  LYS  27           HE2      LYS  27  16.326  21.570  -6.387
   10    HE3  LYS  27           HE3      LYS  27  17.037  20.251  -5.451
   11    HZ3  LYS  27           HZ1      LYS  27  18.031  20.350  -7.636
   12    HZ2  LYS  27           HZ2      LYS  27  16.506  20.241  -8.379
   13    HZ1  LYS  27           HZ3      LYS  27  17.121  18.926  -7.496

  No H/Q in entry =          13
  In of MODEL   80
    1    H    GLN  28           H        GLN  28  10.422  21.402  -4.536
    2    HA   GLN  28           HA       GLN  28  11.393  24.050  -4.682
    3    HB2  GLN  28           HB2      GLN  28   8.553  22.997  -4.573
    4    HB3  GLN  28           HB3      GLN  28   8.980  24.665  -4.953
    5    HG2  GLN  28           HG2      GLN  28   9.970  22.246  -6.488
    6    HG3  GLN  28           HG3      GLN  28   8.631  23.273  -6.995
    7   HE21  GLN  28          HE21      GLN  28  11.765  22.785  -7.739
    8   HE22  GLN  28          HE22      GLN  28  12.246  24.369  -8.112

  No H/Q in entry =           8
  In of MODEL   80
    1    H    ALA  29           H        ALA  29   9.450  22.362  -2.252
    2    HA   ALA  29           HA       ALA  29   8.907  24.553  -0.567
    3    HB2  ALA  29           HB1      ALA  29   8.169  22.984   0.997
    4    HB1  ALA  29           HB2      ALA  29   9.386  21.796   0.532
    5    HB3  ALA  29           HB3      ALA  29   8.003  22.098  -0.518

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LYS  30           H        LYS  30  11.628  22.274  -0.636
    2    HA   LYS  30           HA       LYS  30  12.946  23.218   1.671
    3    HB2  LYS  30           HB2      LYS  30  14.041  21.932  -0.840
    4    HB3  LYS  30           HB3      LYS  30  15.023  22.284   0.584
    5    HG2  LYS  30           HG2      LYS  30  13.461  20.905   1.958
    6    HG3  LYS  30           HG3      LYS  30  12.577  20.490   0.486
    7    HD2  LYS  30           HD2      LYS  30  14.619  19.497  -0.474
    8    HD3  LYS  30           HD3      LYS  30  15.522  19.925   0.980
    9    HE2  LYS  30           HE2      LYS  30  14.009  18.498   2.329
   10    HE3  LYS  30           HE3      LYS  30  13.136  18.049   0.859
   11    HZ2  LYS  30           HZ1      LYS  30  14.919  16.462   1.619
   12    HZ1  LYS  30           HZ2      LYS  30  16.062  17.645   1.172
   13    HZ3  LYS  30           HZ3      LYS  30  15.026  16.968   0.004

  No H/Q in entry =          13
  In of MODEL   80
    1    H    GLN  31           H        GLN  31  12.847  24.429  -1.623
    2    HA   GLN  31           HA       GLN  31  15.008  26.312  -1.195
    3    HB2  GLN  31           HB2      GLN  31  12.968  26.373  -3.422
    4    HB3  GLN  31           HB3      GLN  31  14.591  27.061  -3.419
    5    HG2  GLN  31           HG2      GLN  31  15.041  24.362  -2.849
    6    HG3  GLN  31           HG3      GLN  31  13.739  24.316  -4.029
    7   HE21  GLN  31          HE21      GLN  31  16.580  23.512  -4.430
    8   HE22  GLN  31          HE22      GLN  31  17.158  24.485  -5.694

  No H/Q in entry =           8
  In of MODEL   80
    1    H    GLY  32           H        GLY  32  11.931  26.141  -0.055
    2    HA3  GLY  32           HA2      GLY  32  10.779  27.711   1.220
    3    HA2  GLY  32           HA3      GLY  32  11.910  28.943   0.674

  No H/Q in entry =           3
  In of MODEL   80
    1    H    ASP  33           H        ASP  33  10.542  27.050  -1.824
    2    HA   ASP  33           HA       ASP  33   8.888  29.331  -2.677
    3    HB2  ASP  33           HB2      ASP  33   9.974  26.911  -4.123
    4    HB3  ASP  33           HB3      ASP  33   8.829  28.032  -4.853

  No H/Q in entry =           4
  In of MODEL   80
    1    H    PHE  34           H        PHE  34   7.196  28.859  -1.117
    2    HA   PHE  34           HA       PHE  34   5.806  26.393  -1.029
    3    HB2  PHE  34           HB2      PHE  34   4.855  29.183  -0.345
    4    HB3  PHE  34           HB3      PHE  34   4.000  27.695   0.062
    5    HD1  PHE  34           HD1      PHE  34   6.257  30.081   1.285
    6    HD2  PHE  34           HD2      PHE  34   5.560  25.843   1.221
    7    HE1  PHE  34           HE1      PHE  34   7.644  29.821   3.323
    8    HE2  PHE  34           HE2      PHE  34   6.948  25.587   3.258
    9    HZ   PHE  34           HZ       PHE  34   7.984  27.577   4.308

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ALA  35           H        ALA  35   5.390  29.263  -3.035
    2    HA   ALA  35           HA       ALA  35   2.838  28.661  -4.065
    3    HB1  ALA  35           HB1      ALA  35   3.899  30.053  -6.098
    4    HB3  ALA  35           HB2      ALA  35   5.116  30.407  -4.872
    5    HB2  ALA  35           HB3      ALA  35   3.427  30.822  -4.583

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ALA  36           H        ALA  36   6.066  27.977  -5.416
    2    HA   ALA  36           HA       ALA  36   5.075  26.557  -7.664
    3    HB3  ALA  36           HB1      ALA  36   7.235  26.674  -8.276
    4    HB2  ALA  36           HB2      ALA  36   7.710  25.640  -6.927
    5    HB1  ALA  36           HB3      ALA  36   7.612  27.388  -6.708

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ALA  37           H        ALA  37   6.022  25.552  -4.410
    2    HA   ALA  37           HA       ALA  37   5.953  22.765  -4.845
    3    HB2  ALA  37           HB1      ALA  37   5.695  24.552  -2.463
    4    HB1  ALA  37           HB2      ALA  37   6.823  23.230  -2.756
    5    HB3  ALA  37           HB3      ALA  37   5.160  22.882  -2.288

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LYS  38           H        LYS  38   3.426  24.981  -3.676
    2    HA   LYS  38           HA       LYS  38   1.320  23.175  -3.460
    3    HB2  LYS  38           HB2      LYS  38   1.682  25.929  -3.203
    4    HB3  LYS  38           HB3      LYS  38   0.484  25.790  -4.484
    5    HG2  LYS  38           HG2      LYS  38  -0.973  24.469  -3.047
    6    HG3  LYS  38           HG3      LYS  38   0.269  24.401  -1.788
    7    HD2  LYS  38           HD2      LYS  38   0.091  26.738  -1.337
    8    HD3  LYS  38           HD3      LYS  38  -0.817  27.033  -2.820
    9    HE2  LYS  38           HE2      LYS  38  -2.323  27.069  -0.882
   10    HE3  LYS  38           HE3      LYS  38  -2.701  25.697  -1.928
   11    HZ3  LYS  38           HZ1      LYS  38  -1.984  24.220  -0.397
   12    HZ2  LYS  38           HZ2      LYS  38  -2.331  25.476   0.695
   13    HZ1  LYS  38           HZ3      LYS  38  -0.737  25.220   0.171

  No H/Q in entry =          13
  In of MODEL   80
    1    H    ALA  39           H        ALA  39   2.311  25.080  -6.304
    2    HA   ALA  39           HA       ALA  39   0.235  24.224  -8.012
    3    HB2  ALA  39           HB1      ALA  39   2.976  24.864  -9.060
    4    HB1  ALA  39           HB2      ALA  39   2.013  26.127  -8.293
    5    HB3  ALA  39           HB3      ALA  39   1.399  25.295  -9.722

  No H/Q in entry =           5
  In of MODEL   80
    1    H    MET  40           H        MET  40   3.467  22.911  -7.430
    2    HA   MET  40           HA       MET  40   3.364  20.896  -9.425
    3    HB2  MET  40           HB2      MET  40   4.973  21.108  -6.874
    4    HB3  MET  40           HB3      MET  40   5.220  19.853  -8.091
    5    HG2  MET  40           HG2      MET  40   5.290  22.811  -8.750
    6    HG3  MET  40           HG3      MET  40   6.733  21.902  -8.300
    7    HE3  MET  40           HE1      MET  40   7.601  19.689 -11.112
    8    HE2  MET  40           HE2      MET  40   7.033  19.368  -9.476
    9    HE1  MET  40           HE3      MET  40   8.134  20.712  -9.771

  No H/Q in entry =           9
  In of MODEL   80
    1    H    MET  41           H        MET  41   2.444  20.934  -6.003
    2    HA   MET  41           HA       MET  41   1.901  18.171  -5.732
    3    HB2  MET  41           HB2      MET  41   0.575  20.531  -4.378
    4    HB3  MET  41           HB3      MET  41   0.412  18.853  -3.874
    5    HG2  MET  41           HG2      MET  41   3.123  19.066  -3.906
    6    HG3  MET  41           HG3      MET  41   2.688  20.725  -3.508
    7    HE2  MET  41           HE1      MET  41  -0.359  19.479  -1.790
    8    HE1  MET  41           HE2      MET  41   0.464  20.990  -2.162
    9    HE3  MET  41           HE3      MET  41   0.400  20.417  -0.496

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ASP  42           H        ASP  42  -0.126  20.905  -6.703
    2    HA   ASP  42           HA       ASP  42  -2.571  19.553  -6.847
    3    HB2  ASP  42           HB2      ASP  42  -1.855  22.122  -7.097
    4    HB3  ASP  42           HB3      ASP  42  -2.005  21.731  -8.806

  No H/Q in entry =           4
  In of MODEL   80
    1    H    GLN  43           H        GLN  43  -0.125  20.141  -9.344
    2    HA   GLN  43           HA       GLN  43  -1.513  18.831 -11.438
    3    HB2  GLN  43           HB2      GLN  43   1.447  19.336 -11.050
    4    HB3  GLN  43           HB3      GLN  43   0.733  18.702 -12.535
    5    HG2  GLN  43           HG2      GLN  43  -0.771  20.734 -12.574
    6    HG3  GLN  43           HG3      GLN  43   0.182  21.384 -11.244
    7   HE21  GLN  43          HE21      GLN  43   0.352  23.008 -13.326
    8   HE22  GLN  43          HE22      GLN  43   1.767  22.784 -14.232

  No H/Q in entry =           8
  In of MODEL   80
    1    H    SER  44           H        SER  44   0.830  17.678  -9.046
    2    HA   SER  44           HA       SER  44   1.158  15.072 -10.076
    3    HB2  SER  44           HB2      SER  44   2.054  16.503  -7.835
    4    HB3  SER  44           HB3      SER  44   1.186  15.121  -7.168
    5    HG   SER  44           HG       SER  44   3.296  14.496  -7.593

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ARG  45           H        ARG  45  -1.161  16.393  -7.739
    2    HA   ARG  45           HA       ARG  45  -2.556  14.035  -7.111
    3    HB2  ARG  45           HB2      ARG  45  -2.750  16.202  -5.915
    4    HB3  ARG  45           HB3      ARG  45  -3.601  16.874  -7.302
    5    HG2  ARG  45           HG2      ARG  45  -5.373  15.153  -7.025
    6    HG3  ARG  45           HG3      ARG  45  -4.533  14.536  -5.602
    7    HD2  ARG  45           HD2      ARG  45  -4.734  16.801  -4.541
    8    HD3  ARG  45           HD3      ARG  45  -5.718  17.327  -5.924
    9    HE   ARG  45           HE       ARG  45  -6.836  14.952  -4.891
   10   HH21  ARG  45          HH11      ARG  45  -8.674  15.030  -3.623
   11   HH22  ARG  45          HH12      ARG  45  -9.066  16.469  -2.752
   12   HH11  ARG  45          HH21      ARG  45  -6.283  18.195  -3.860
   13   HH12  ARG  45          HH22      ARG  45  -7.707  18.261  -2.884

  No H/Q in entry =          13
  In of MODEL   80
    1    H    MET  46           H        MET  46  -3.129  16.447  -9.657
    2    HA   MET  46           HA       MET  46  -5.470  15.283 -10.726
    3    HB2  MET  46           HB2      MET  46  -3.363  17.112 -11.885
    4    HB3  MET  46           HB3      MET  46  -4.735  16.554 -12.848
    5    HG2  MET  46           HG2      MET  46  -6.290  17.461 -11.167
    6    HG3  MET  46           HG3      MET  46  -4.931  18.010 -10.193
    7    HE1  MET  46           HE1      MET  46  -5.524  20.450 -10.057
    8    HE3  MET  46           HE2      MET  46  -7.061  20.056 -10.822
    9    HE2  MET  46           HE3      MET  46  -6.124  21.432 -11.400

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ALA  47           H        ALA  47  -2.041  14.796 -11.479
    2    HA   ALA  47           HA       ALA  47  -2.387  13.074 -13.693
    3    HB3  ALA  47           HB1      ALA  47  -0.208  13.957 -13.336
    4    HB2  ALA  47           HB2      ALA  47  -0.072  12.228 -13.005
    5    HB1  ALA  47           HB3      ALA  47  -0.164  13.377 -11.670

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LEU  48           H        LEU  48  -2.125  12.431 -10.220
    2    HA   LEU  48           HA       LEU  48  -2.227   9.591 -10.385
    3    HB2  LEU  48           HB2      LEU  48  -2.990  11.507  -8.168
    4    HB3  LEU  48           HB3      LEU  48  -2.901   9.755  -7.971
    5    HG   LEU  48           HG       LEU  48  -0.596  11.451  -8.961
    6   HD13  LEU  48          HD11      LEU  48  -0.880  12.218  -6.769
    7   HD12  LEU  48          HD12      LEU  48   0.279  10.907  -6.571
    8   HD11  LEU  48          HD13      LEU  48  -1.420  10.647  -6.177
    9   HD22  LEU  48          HD21      LEU  48  -0.101   9.266  -9.605
   10   HD21  LEU  48          HD22      LEU  48  -0.975   8.550  -8.252
   11   HD23  LEU  48          HD23      LEU  48   0.599   9.298  -7.988

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ASN  49           H        ASN  49  -4.684  12.089  -9.982
    2    HA   ASN  49           HA       ASN  49  -6.875  10.429  -9.450
    3    HB2  ASN  49           HB2      ASN  49  -6.941  12.844  -9.115
    4    HB3  ASN  49           HB3      ASN  49  -6.749  13.120 -10.842
    5   HD21  ASN  49          HD21      ASN  49  -8.974  11.560  -8.502
    6   HD22  ASN  49          HD22      ASN  49 -10.374  11.838  -9.417

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLU  50           H        GLU  50  -5.587  11.629 -12.533
    2    HA   GLU  50           HA       GLU  50  -7.542  10.381 -14.185
    3    HB2  GLU  50           HB2      GLU  50  -6.070  12.198 -14.992
    4    HB3  GLU  50           HB3      GLU  50  -4.679  11.123 -14.854
    5    HG2  GLU  50           HG2      GLU  50  -5.653   9.593 -16.495
    6    HG3  GLU  50           HG3      GLU  50  -7.111  10.575 -16.584

  No H/Q in entry =           6
  In of MODEL   80
    1    H    ALA  51           H        ALA  51  -4.376   9.379 -12.975
    2    HA   ALA  51           HA       ALA  51  -4.240   6.928 -14.398
    3    HB2  ALA  51           HB1      ALA  51  -2.262   6.633 -13.294
    4    HB1  ALA  51           HB2      ALA  51  -2.951   7.054 -11.727
    5    HB3  ALA  51           HB3      ALA  51  -2.491   8.326 -12.858

  No H/Q in entry =           5
  In of MODEL   80
    1    H    HIS  52           H        HIS  52  -5.417   7.757 -11.149
    2    HA   HIS  52           HA       HIS  52  -6.110   5.147 -10.324
    3    HB2  HIS  52           HB2      HIS  52  -5.968   7.138  -8.829
    4    HB3  HIS  52           HB3      HIS  52  -7.457   7.745  -9.554
    5    HD1  HIS  52           HD1      HIS  52  -9.648   6.335  -9.134
    6    HD2  HIS  52           HD2      HIS  52  -6.326   5.058  -6.965
    7    HE1  HIS  52           HE1      HIS  52 -10.521   4.779  -7.335
    8    HE2  HIS  52           HE2      HIS  52  -8.506   3.992  -6.004

  No H/Q in entry =           8
  In of MODEL   80
    1    H    LEU  53           H        LEU  53  -7.920   7.613 -12.111
    2    HA   LEU  53           HA       LEU  53 -10.429   6.328 -12.131
    3    HB2  LEU  53           HB2      LEU  53  -9.136   8.309 -13.994
    4    HB3  LEU  53           HB3      LEU  53 -10.736   7.649 -14.321
    5    HG   LEU  53           HG       LEU  53 -10.025   8.955 -11.676
    6   HD11  LEU  53          HD11      LEU  53 -11.287  10.190 -14.142
    7   HD13  LEU  53          HD12      LEU  53  -9.715  10.605 -13.458
    8   HD12  LEU  53          HD13      LEU  53 -11.190  10.964 -12.565
    9   HD22  LEU  53          HD21      LEU  53 -12.035   7.767 -11.362
   10   HD21  LEU  53          HD22      LEU  53 -12.559   8.037 -13.021
   11   HD23  LEU  53          HD23      LEU  53 -12.637   9.344 -11.856

  No H/Q in entry =          11
  In of MODEL   80
    1    H    VAL  54           H        VAL  54  -7.675   6.128 -14.363
    2    HA   VAL  54           HA       VAL  54  -8.899   4.364 -16.212
    3    HB   VAL  54           HB       VAL  54  -5.991   4.860 -15.523
    4   HG12  VAL  54          HG11      VAL  54  -5.743   3.779 -17.914
    5   HG11  VAL  54          HG12      VAL  54  -7.274   3.002 -17.515
    6   HG13  VAL  54          HG13      VAL  54  -5.862   2.741 -16.494
    7   HG22  VAL  54          HG21      VAL  54  -6.753   6.808 -16.565
    8   HG21  VAL  54          HG22      VAL  54  -7.947   5.950 -17.538
    9   HG23  VAL  54          HG23      VAL  54  -6.240   5.866 -17.965

  No H/Q in entry =           9
  In of MODEL   80
    1    H    GLN  55           H        GLN  55  -6.908   3.806 -13.310
    2    HA   GLN  55           HA       GLN  55  -6.827   0.989 -13.571
    3    HB2  GLN  55           HB2      GLN  55  -5.272   1.877 -12.047
    4    HB3  GLN  55           HB3      GLN  55  -6.487   2.845 -11.218
    5    HG2  GLN  55           HG2      GLN  55  -7.184   1.088  -9.906
    6    HG3  GLN  55           HG3      GLN  55  -6.961  -0.097 -11.186
    7   HE21  GLN  55          HE21      GLN  55  -5.343  -1.553 -10.691
    8   HE22  GLN  55          HE22      GLN  55  -3.959  -1.208  -9.775

  No H/Q in entry =           8
  In of MODEL   80
    1    H    THR  56           H        THR  56  -9.155   3.156 -11.958
    2    HA   THR  56           HA       THR  56 -10.748   1.276 -10.676
    3    HB   THR  56           HB       THR  56 -11.829   3.673 -12.179
    4    HG1  THR  56           HG1      THR  56 -10.466   3.448  -9.717
    5   HG23  THR  56          HG21      THR  56 -13.578   3.639 -10.550
    6   HG22  THR  56          HG22      THR  56 -12.724   2.453  -9.562
    7   HG21  THR  56          HG23      THR  56 -13.404   1.980 -11.120

  No H/Q in entry =           7
  In of MODEL   80
    1    H    LYS  57           H        LYS  57 -10.939   2.366 -14.060
    2    HA   LYS  57           HA       LYS  57 -13.099   0.688 -14.822
    3    HB2  LYS  57           HB2      LYS  57 -12.263   2.622 -16.153
    4    HB3  LYS  57           HB3      LYS  57 -10.774   1.742 -16.468
    5    HG2  LYS  57           HG2      LYS  57 -12.190   1.489 -18.397
    6    HG3  LYS  57           HG3      LYS  57 -12.148  -0.060 -17.563
    7    HD2  LYS  57           HD2      LYS  57 -14.328   0.261 -16.643
    8    HD3  LYS  57           HD3      LYS  57 -14.342   1.970 -17.073
    9    HE2  LYS  57           HE2      LYS  57 -15.724   0.790 -18.682
   10    HE3  LYS  57           HE3      LYS  57 -14.247   1.278 -19.513
   11    HZ2  LYS  57           HZ1      LYS  57 -15.129  -1.147 -19.691
   12    HZ1  LYS  57           HZ2      LYS  57 -14.336  -1.342 -18.200
   13    HZ3  LYS  57           HZ3      LYS  57 -13.464  -0.847 -19.573

  No H/Q in entry =          13
  In of MODEL   80
    1    H    LEU  58           H        LEU  58  -9.596   0.245 -14.757
    2    HA   LEU  58           HA       LEU  58  -9.610  -2.270 -16.050
    3    HB2  LEU  58           HB2      LEU  58  -7.576  -0.989 -14.235
    4    HB3  LEU  58           HB3      LEU  58  -7.318  -2.509 -15.091
    5    HG   LEU  58           HG       LEU  58  -8.060   0.100 -16.452
    6   HD11  LEU  58          HD11      LEU  58  -5.419  -1.148 -15.757
    7   HD13  LEU  58          HD12      LEU  58  -5.908   0.545 -15.706
    8   HD12  LEU  58          HD13      LEU  58  -5.568  -0.225 -17.253
    9   HD22  LEU  58          HD21      LEU  58  -8.637  -1.457 -18.047
   10   HD21  LEU  58          HD22      LEU  58  -7.602  -2.710 -17.365
   11   HD23  LEU  58          HD23      LEU  58  -6.904  -1.437 -18.366

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  59           H        ILE  59 -10.436  -1.370 -12.800
    2    HA   ILE  59           HA       ILE  59 -10.097  -4.140 -11.856
    3    HB   ILE  59           HB       ILE  59  -9.649  -1.876 -10.452
    4   HG12  ILE  59          HG12      ILE  59 -11.025  -4.233  -9.143
    5   HG13  ILE  59          HG13      ILE  59  -9.376  -4.303  -9.713
    6   HG23  ILE  59          HG21      ILE  59 -11.481  -1.175  -9.149
    7   HG22  ILE  59          HG22      ILE  59 -12.418  -2.607  -9.510
    8   HG21  ILE  59          HG23      ILE  59 -12.192  -1.360 -10.734
    9   HD13  ILE  59          HD11      ILE  59  -8.741  -2.453  -8.272
   10   HD12  ILE  59          HD12      ILE  59  -9.497  -3.713  -7.305
   11   HD11  ILE  59          HD13      ILE  59 -10.409  -2.265  -7.740

  No H/Q in entry =          11
  In of MODEL   80
    1    H    GLU  60           H        GLU  60 -12.645  -1.815 -12.667
    2    HA   GLU  60           HA       GLU  60 -14.837  -3.326 -11.662
    3    HB2  GLU  60           HB2      GLU  60 -15.069  -0.963 -12.240
    4    HB3  GLU  60           HB3      GLU  60 -14.696  -1.313 -13.925
    5    HG2  GLU  60           HG2      GLU  60 -16.720  -2.734 -14.071
    6    HG3  GLU  60           HG3      GLU  60 -17.103  -2.347 -12.407

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLY  61           H        GLY  61 -13.156  -3.311 -14.772
    2    HA3  GLY  61           HA2      GLY  61 -14.874  -5.549 -15.670
    3    HA2  GLY  61           HA3      GLY  61 -14.023  -4.445 -16.745

  No H/Q in entry =           3
  In of MODEL   80
    1    H    ASP  62           H        ASP  62 -12.664  -5.906 -13.859
    2    HA   ASP  62           HA       ASP  62 -10.335  -6.778 -15.210
    3    HB2  ASP  62           HB2      ASP  62  -9.778  -7.820 -13.050
    4    HB3  ASP  62           HB3      ASP  62 -10.372  -6.177 -12.832

  No H/Q in entry =           4
  In of MODEL   80
    1    H    ALA  63           H        ALA  63 -11.505  -8.032 -16.991
    2    HA   ALA  63           HA       ALA  63 -12.802 -10.517 -16.473
    3    HB3  ALA  63           HB1      ALA  63 -11.136  -9.938 -18.929
    4    HB1  ALA  63           HB2      ALA  63 -12.674  -9.118 -18.666
    5    HB2  ALA  63           HB3      ALA  63 -12.623 -10.876 -18.813

  No H/Q in entry =           5
  In of MODEL   80
    1    H    GLY  64           H        GLY  64  -9.452  -9.600 -17.033
    2    HA3  GLY  64           HA2      GLY  64  -7.472 -10.665 -16.569
    3    HA2  GLY  64           HA3      GLY  64  -8.386 -11.822 -15.610

  No H/Q in entry =           3
  In of MODEL   80
    1    H    GLU  65           H        GLU  65  -6.570 -13.173 -16.705
    2    HA   GLU  65           HA       GLU  65  -6.737 -13.789 -19.445
    3    HB2  GLU  65           HB2      GLU  65  -5.655 -15.374 -17.120
    4    HB3  GLU  65           HB3      GLU  65  -5.491 -15.878 -18.803
    5    HG2  GLU  65           HG2      GLU  65  -4.314 -13.807 -19.345
    6    HG3  GLU  65           HG3      GLU  65  -4.542 -13.220 -17.699

  No H/Q in entry =           6
  In of MODEL   80
    1    H    GLY  66           H        GLY  66  -8.247 -15.241 -16.657
    2    HA3  GLY  66           HA2      GLY  66  -9.836 -17.046 -18.352
    3    HA2  GLY  66           HA3      GLY  66  -9.503 -17.295 -16.650

  No H/Q in entry =           3
  In of MODEL   80
    1    H    LYS  67           H        LYS  67 -11.923 -17.681 -16.943
    2    HA   LYS  67           HA       LYS  67 -13.750 -15.630 -17.369
    3    HB2  LYS  67           HB2      LYS  67 -13.977 -18.157 -15.742
    4    HB3  LYS  67           HB3      LYS  67 -15.347 -17.118 -16.150
    5    HG2  LYS  67           HG2      LYS  67 -14.818 -17.357 -18.551
    6    HG3  LYS  67           HG3      LYS  67 -13.456 -18.399 -18.148
    7    HD2  LYS  67           HD2      LYS  67 -14.975 -20.048 -17.160
    8    HD3  LYS  67           HD3      LYS  67 -16.353 -18.993 -17.483
    9    HE2  LYS  67           HE2      LYS  67 -16.164 -20.702 -19.244
   10    HE3  LYS  67           HE3      LYS  67 -15.857 -19.098 -19.907
   11    HZ1  LYS  67           HZ1      LYS  67 -13.430 -20.083 -18.984
   12    HZ3  LYS  67           HZ2      LYS  67 -13.903 -19.827 -20.596
   13    HZ2  LYS  67           HZ3      LYS  67 -14.155 -21.340 -19.864

  No H/Q in entry =          13
  In of MODEL   80
    1    H    MET  68           H        MET  68 -13.583 -17.075 -14.202
    2    HA   MET  68           HA       MET  68 -14.520 -14.813 -12.808
    3    HB2  MET  68           HB2      MET  68 -13.170 -17.344 -11.878
    4    HB3  MET  68           HB3      MET  68 -13.858 -16.145 -10.784
    5    HG2  MET  68           HG2      MET  68 -16.057 -16.410 -11.852
    6    HG3  MET  68           HG3      MET  68 -15.375 -17.584 -12.981
    7    HE1  MET  68           HE1      MET  68 -16.203 -16.517  -9.573
    8    HE3  MET  68           HE2      MET  68 -14.714 -17.214  -8.938
    9    HE2  MET  68           HE3      MET  68 -16.265 -17.952  -8.540

  No H/Q in entry =           9
  In of MODEL   80
    1    H    LYS  69           H        LYS  69 -11.183 -16.023 -13.235
    2    HA   LYS  69           HA       LYS  69  -9.951 -14.452 -11.296
    3    HB2  LYS  69           HB2      LYS  69  -8.943 -15.672 -13.853
    4    HB3  LYS  69           HB3      LYS  69  -7.874 -14.778 -12.771
    5    HG2  LYS  69           HG2      LYS  69  -8.292 -16.280 -10.958
    6    HG3  LYS  69           HG3      LYS  69  -9.652 -17.022 -11.796
    7    HD2  LYS  69           HD2      LYS  69  -7.391 -18.298 -11.778
    8    HD3  LYS  69           HD3      LYS  69  -8.254 -18.164 -13.311
    9    HE2  LYS  69           HE2      LYS  69  -6.838 -16.391 -14.064
   10    HE3  LYS  69           HE3      LYS  69  -6.145 -16.170 -12.458
   11    HZ2  LYS  69           HZ1      LYS  69  -4.962 -17.586 -14.343
   12    HZ1  LYS  69           HZ2      LYS  69  -5.897 -18.819 -13.642
   13    HZ3  LYS  69           HZ3      LYS  69  -4.791 -17.943 -12.694

  No H/Q in entry =          13
  In of MODEL   80
    1    H    VAL  70           H        VAL  70  -7.977 -12.914 -12.077
    2    HA   VAL  70           HA       VAL  70  -9.122 -10.728 -13.716
    3    HB   VAL  70           HB       VAL  70  -8.189  -9.125 -12.092
    4   HG13  VAL  70          HG11      VAL  70  -9.850  -9.493 -10.331
    5   HG12  VAL  70          HG12      VAL  70  -9.987 -11.191 -10.788
    6   HG11  VAL  70          HG13      VAL  70 -10.541  -9.933 -11.893
    7   HG22  VAL  70          HG21      VAL  70  -6.364 -10.252 -11.070
    8   HG21  VAL  70          HG22      VAL  70  -7.342 -11.673 -10.710
    9   HG23  VAL  70          HG23      VAL  70  -7.571 -10.190  -9.786

  No H/Q in entry =           9
  In of MODEL   80
    1    H    SER  71           H        SER  71  -7.458  -9.205 -14.472
    2    HA   SER  71           HA       SER  71  -5.266 -10.518 -15.719
    3    HB2  SER  71           HB2      SER  71  -6.374  -8.470 -16.621
    4    HB3  SER  71           HB3      SER  71  -5.687  -7.549 -15.285
    5    HG   SER  71           HG       SER  71  -4.256  -7.362 -16.942

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LEU  72           H        LEU  72  -3.223 -10.775 -15.092
    2    HA   LEU  72           HA       LEU  72  -2.509 -10.567 -12.379
    3    HB2  LEU  72           HB2      LEU  72  -0.852 -11.000 -14.859
    4    HB3  LEU  72           HB3      LEU  72  -0.193 -11.075 -13.228
    5    HG   LEU  72           HG       LEU  72  -2.547 -12.760 -14.142
    6   HD13  LEU  72          HD11      LEU  72  -0.585 -13.365 -15.470
    7   HD12  LEU  72          HD12      LEU  72  -0.880 -14.615 -14.262
    8   HD11  LEU  72          HD13      LEU  72   0.408 -13.436 -14.013
    9   HD23  LEU  72          HD21      LEU  72  -1.581 -14.170 -12.158
   10   HD22  LEU  72          HD22      LEU  72  -2.552 -12.759 -11.769
   11   HD21  LEU  72          HD23      LEU  72  -0.795 -12.668 -11.682

  No H/Q in entry =          11
  In of MODEL   80
    1    H    VAL  73           H        VAL  73  -1.778  -8.550 -15.155
    2    HA   VAL  73           HA       VAL  73   0.147  -6.861 -14.044
    3    HB   VAL  73           HB       VAL  73  -0.188  -5.477 -15.913
    4   HG13  VAL  73          HG11      VAL  73  -0.088  -7.012 -17.692
    5   HG12  VAL  73          HG12      VAL  73  -1.268  -8.091 -16.949
    6   HG11  VAL  73          HG13      VAL  73   0.366  -7.990 -16.297
    7   HG21  VAL  73          HG21      VAL  73  -3.002  -6.588 -15.903
    8   HG23  VAL  73          HG22      VAL  73  -2.338  -5.701 -17.273
    9   HG22  VAL  73          HG23      VAL  73  -2.504  -4.908 -15.706

  No H/Q in entry =           9
  In of MODEL   80
    1    H    LEU  74           H        LEU  74  -3.252  -6.963 -13.496
    2    HA   LEU  74           HA       LEU  74  -3.860  -4.305 -12.882
    3    HB2  LEU  74           HB2      LEU  74  -5.601  -5.953 -13.060
    4    HB3  LEU  74           HB3      LEU  74  -4.913  -6.895 -11.739
    5    HG   LEU  74           HG       LEU  74  -5.363  -5.034 -10.176
    6   HD13  LEU  74          HD11      LEU  74  -5.226  -3.091 -11.538
    7   HD12  LEU  74          HD12      LEU  74  -6.931  -3.220 -11.111
    8   HD11  LEU  74          HD13      LEU  74  -6.381  -3.732 -12.706
    9   HD21  LEU  74          HD21      LEU  74  -7.082  -6.853 -11.064
   10   HD23  LEU  74          HD22      LEU  74  -7.900  -5.415 -11.633
   11   HD22  LEU  74          HD23      LEU  74  -7.571  -5.600  -9.928

  No H/Q in entry =          11
  In of MODEL   80
    1    H    VAL  75           H        VAL  75  -2.837  -6.899 -10.720
    2    HA   VAL  75           HA       VAL  75  -2.637  -5.351  -8.374
    3    HB   VAL  75           HB       VAL  75  -1.151  -7.851  -9.163
    4   HG11  VAL  75          HG11      VAL  75  -1.352  -6.378  -6.498
    5   HG13  VAL  75          HG12      VAL  75   0.109  -6.652  -7.436
    6   HG12  VAL  75          HG13      VAL  75  -0.716  -8.009  -6.689
    7   HG23  VAL  75          HG21      VAL  75  -2.814  -8.837  -7.544
    8   HG22  VAL  75          HG22      VAL  75  -3.560  -8.166  -8.995
    9   HG21  VAL  75          HG23      VAL  75  -3.611  -7.264  -7.479

  No H/Q in entry =           9
  In of MODEL   80
    1    H    GLU  76           H        GLU  76  -0.225  -6.119 -10.905
    2    HA   GLU  76           HA       GLU  76   1.963  -4.782  -9.740
    3    HB2  GLU  76           HB2      GLU  76   2.113  -6.268 -11.746
    4    HB3  GLU  76           HB3      GLU  76   1.285  -5.042 -12.692
    5    HG2  GLU  76           HG2      GLU  76   3.127  -3.458 -12.295
    6    HG3  GLU  76           HG3      GLU  76   3.972  -4.641 -11.315

  No H/Q in entry =           6
  In of MODEL   80
    1    H    ALA  77           H        ALA  77  -0.558  -3.567 -11.934
    2    HA   ALA  77           HA       ALA  77   0.444  -0.925 -12.104
    3    HB2  ALA  77           HB1      ALA  77  -1.857  -0.347 -12.853
    4    HB3  ALA  77           HB2      ALA  77  -2.389  -1.963 -12.391
    5    HB1  ALA  77           HB3      ALA  77  -1.211  -1.762 -13.688

  No H/Q in entry =           5
  In of MODEL   80
    1    H    GLN  78           H        GLN  78  -1.837  -2.474  -9.901
    2    HA   GLN  78           HA       GLN  78  -2.638  -0.154  -8.500
    3    HB2  GLN  78           HB2      GLN  78  -3.757  -2.410  -8.421
    4    HB3  GLN  78           HB3      GLN  78  -2.425  -2.975  -7.414
    5    HG2  GLN  78           HG2      GLN  78  -2.942  -1.235  -5.751
    6    HG3  GLN  78           HG3      GLN  78  -4.275  -0.666  -6.755
    7   HE21  GLN  78          HE21      GLN  78  -4.737  -1.648  -4.097
    8   HE22  GLN  78          HE22      GLN  78  -5.608  -3.101  -4.214

  No H/Q in entry =           8
  In of MODEL   80
    1    H    LEU  79           H        LEU  79   0.030  -2.420  -8.044
    2    HA   LEU  79           HA       LEU  79   1.003  -1.530  -5.583
    3    HB2  LEU  79           HB2      LEU  79   1.869  -3.541  -6.651
    4    HB3  LEU  79           HB3      LEU  79   2.522  -2.590  -7.981
    5    HG   LEU  79           HG       LEU  79   4.077  -1.458  -6.472
    6   HD13  LEU  79          HD11      LEU  79   3.068  -1.211  -4.407
    7   HD12  LEU  79          HD12      LEU  79   4.141  -2.565  -4.062
    8   HD11  LEU  79          HD13      LEU  79   2.435  -2.858  -4.397
    9   HD23  LEU  79          HD21      LEU  79   5.278  -3.611  -5.568
   10   HD22  LEU  79          HD22      LEU  79   5.080  -3.409  -7.306
   11   HD21  LEU  79          HD23      LEU  79   3.996  -4.476  -6.418

  No H/Q in entry =          11
  In of MODEL   80
    1    H    HIS  80           H        HIS  80   1.886  -0.412  -8.852
    2    HA   HIS  80           HA       HIS  80   3.697   1.568  -7.922
    3    HB2  HIS  80           HB2      HIS  80   2.413   0.881 -10.510
    4    HB3  HIS  80           HB3      HIS  80   3.013   2.531 -10.335
    5    HD1  HIS  80           HD1      HIS  80   5.417   2.825 -10.850
    6    HD2  HIS  80           HD2      HIS  80   4.582  -1.085  -9.666
    7    HE1  HIS  80           HE1      HIS  80   7.603   1.542 -11.011
    8    HE2  HIS  80           HE2      HIS  80   7.106  -0.844 -10.292

  No H/Q in entry =           8
  In of MODEL   80
    1    H    LEU  81           H        LEU  81   0.297   1.739  -8.912
    2    HA   LEU  81           HA       LEU  81   0.028   4.532  -8.579
    3    HB2  LEU  81           HB2      LEU  81  -1.992   2.292  -8.508
    4    HB3  LEU  81           HB3      LEU  81  -2.441   3.996  -8.416
    5    HG   LEU  81           HG       LEU  81  -0.744   2.845 -10.648
    6   HD12  LEU  81          HD11      LEU  81  -2.971   3.171 -11.953
    7   HD11  LEU  81          HD12      LEU  81  -3.732   3.103 -10.364
    8   HD13  LEU  81          HD13      LEU  81  -2.790   1.734 -10.950
    9   HD23  LEU  81          HD21      LEU  81  -1.832   4.993 -11.746
   10   HD22  LEU  81          HD22      LEU  81  -0.418   5.159 -10.708
   11   HD21  LEU  81          HD23      LEU  81  -2.024   5.510 -10.072

  No H/Q in entry =          11
  In of MODEL   80
    1    H    MET  82           H        MET  82  -0.644   1.844  -6.335
    2    HA   MET  82           HA       MET  82  -1.699   3.430  -4.249
    3    HB2  MET  82           HB2      MET  82  -0.331   0.740  -4.288
    4    HB3  MET  82           HB3      MET  82  -0.913   1.465  -2.791
    5    HG2  MET  82           HG2      MET  82  -2.639   0.978  -5.238
    6    HG3  MET  82           HG3      MET  82  -2.567  -0.098  -3.844
    7    HE3  MET  82           HE1      MET  82  -4.295   1.551  -1.032
    8    HE2  MET  82           HE2      MET  82  -2.564   1.826  -1.211
    9    HE1  MET  82           HE3      MET  82  -3.254   0.271  -1.669

  No H/Q in entry =           9
  In of MODEL   80
    1    H    THR  83           H        THR  83   1.601   2.339  -4.930
    2    HA   THR  83           HA       THR  83   2.814   3.437  -2.624
    3    HB   THR  83           HB       THR  83   4.913   3.380  -4.092
    4    HG1  THR  83           HG1      THR  83   4.679   2.856  -6.117
    5   HG22  THR  83          HG21      THR  83   4.465   0.723  -4.429
    6   HG21  THR  83          HG22      THR  83   3.173   1.103  -3.292
    7   HG23  THR  83          HG23      THR  83   4.852   1.443  -2.867

  No H/Q in entry =           7
  In of MODEL   80
    1    H    SER  84           H        SER  84   2.456   4.722  -5.924
    2    HA   SER  84           HA       SER  84   3.799   7.159  -5.461
    3    HB2  SER  84           HB2      SER  84   1.733   6.333  -7.488
    4    HB3  SER  84           HB3      SER  84   2.415   7.959  -7.459
    5    HG   SER  84           HG       SER  84   3.783   5.482  -7.749

  No H/Q in entry =           5
  In of MODEL   80
    1    H    MET  85           H        MET  85   0.303   6.409  -5.302
    2    HA   MET  85           HA       MET  85  -0.555   9.020  -4.699
    3    HB2  MET  85           HB2      MET  85  -2.078   7.213  -5.376
    4    HB3  MET  85           HB3      MET  85  -1.798   6.408  -3.833
    5    HG2  MET  85           HG2      MET  85  -2.689   8.368  -2.634
    6    HG3  MET  85           HG3      MET  85  -2.946   9.193  -4.170
    7    HE1  MET  85           HE1      MET  85  -3.462   5.936  -2.307
    8    HE3  MET  85           HE2      MET  85  -5.184   5.591  -2.447
    9    HE2  MET  85           HE3      MET  85  -4.645   6.976  -1.504

  No H/Q in entry =           9
  In of MODEL   80
    1    H    LEU  86           H        LEU  86   0.352   6.353  -2.557
    2    HA   LEU  86           HA       LEU  86  -0.186   7.653  -0.114
    3    HB2  LEU  86           HB2      LEU  86   0.273   5.182  -0.510
    4    HB3  LEU  86           HB3      LEU  86   1.982   5.607  -0.600
    5    HG   LEU  86           HG       LEU  86   1.653   6.766   1.669
    6   HD11  LEU  86          HD11      LEU  86  -1.042   6.007   1.189
    7   HD13  LEU  86          HD12      LEU  86  -0.378   6.751   2.642
    8   HD12  LEU  86          HD13      LEU  86  -0.473   4.995   2.520
    9   HD23  LEU  86          HD21      LEU  86   1.216   3.774   1.785
   10   HD22  LEU  86          HD22      LEU  86   2.218   4.779   2.830
   11   HD21  LEU  86          HD23      LEU  86   2.723   4.456   1.172

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ALA  87           H        ALA  87   2.800   7.353  -1.995
    2    HA   ALA  87           HA       ALA  87   4.505   8.755  -0.263
    3    HB3  ALA  87           HB1      ALA  87   4.605   7.747  -2.971
    4    HB2  ALA  87           HB2      ALA  87   5.937   8.071  -1.866
    5    HB1  ALA  87           HB3      ALA  87   5.330   9.355  -2.910

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ARG  88           H        ARG  88   2.570   9.902  -2.987
    2    HA   ARG  88           HA       ARG  88   3.353  12.589  -2.863
    3    HB2  ARG  88           HB2      ARG  88   2.100  11.444  -4.726
    4    HB3  ARG  88           HB3      ARG  88   0.641  11.591  -3.747
    5    HG2  ARG  88           HG2      ARG  88   1.670  14.167  -3.657
    6    HG3  ARG  88           HG3      ARG  88   2.097  13.654  -5.287
    7    HD2  ARG  88           HD2      ARG  88  -0.042  13.744  -5.991
    8    HD3  ARG  88           HD3      ARG  88  -0.636  12.891  -4.566
    9    HE   ARG  88           HE       ARG  88  -0.814  15.670  -4.979
   10   HH21  ARG  88          HH11      ARG  88  -1.341  16.998  -3.241
   11   HH22  ARG  88          HH12      ARG  88  -1.051  16.457  -1.623
   12   HH11  ARG  88          HH21      ARG  88   0.186  13.399  -2.606
   13   HH12  ARG  88          HH22      ARG  88  -0.204  14.414  -1.264

  No H/Q in entry =          13
  In of MODEL   80
    1    H    GLU  89           H        GLU  89   0.638  10.923  -1.234
    2    HA   GLU  89           HA       GLU  89  -0.463  13.237  -0.028
    3    HB2  GLU  89           HB2      GLU  89  -1.590  11.003  -0.122
    4    HB3  GLU  89           HB3      GLU  89  -0.472  10.440   1.121
    5    HG2  GLU  89           HG2      GLU  89  -1.289  12.140   2.681
    6    HG3  GLU  89           HG3      GLU  89  -2.335  12.817   1.436

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LEU  90           H        LEU  90   1.975  10.932   1.149
    2    HA   LEU  90           HA       LEU  90   2.330  12.170   3.681
    3    HB2  LEU  90           HB2      LEU  90   4.099  10.391   2.006
    4    HB3  LEU  90           HB3      LEU  90   4.516  10.902   3.646
    5    HG   LEU  90           HG       LEU  90   1.877   9.570   2.976
    6   HD12  LEU  90          HD11      LEU  90   3.004   7.517   3.983
    7   HD11  LEU  90          HD12      LEU  90   4.531   8.366   3.747
    8   HD13  LEU  90          HD13      LEU  90   3.521   7.966   2.357
    9   HD22  LEU  90          HD21      LEU  90   1.611  10.491   5.098
   10   HD21  LEU  90          HD22      LEU  90   3.327  10.374   5.485
   11   HD23  LEU  90          HD23      LEU  90   2.314   8.932   5.528

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  91           H        ILE  91   3.944  12.550   0.560
    2    HA   ILE  91           HA       ILE  91   5.927  14.370   1.408
    3    HB   ILE  91           HB       ILE  91   4.621  13.891  -1.276
    4   HG12  ILE  91          HG12      ILE  91   7.448  13.387  -0.296
    5   HG13  ILE  91          HG13      ILE  91   6.159  12.196  -0.139
    6   HG22  ILE  91          HG21      ILE  91   6.852  15.228  -1.957
    7   HG21  ILE  91          HG22      ILE  91   6.542  16.027  -0.415
    8   HG23  ILE  91          HG23      ILE  91   5.323  16.065  -1.687
    9   HD13  ILE  91          HD11      ILE  91   5.991  11.878  -2.447
   10   HD12  ILE  91          HD12      ILE  91   7.726  12.111  -2.228
   11   HD11  ILE  91          HD13      ILE  91   6.724  13.441  -2.815

  No H/Q in entry =          11
  In of MODEL   80
    1    H    THR  92           H        THR  92   2.571  14.822   0.392
    2    HA   THR  92           HA       THR  92   2.560  17.646   0.337
    3    HB   THR  92           HB       THR  92   0.380  15.662   1.026
    4    HG1  THR  92           HG1      THR  92   0.689  15.486  -1.058
    5   HG22  THR  92          HG21      THR  92  -1.007  17.833   0.305
    6   HG21  THR  92          HG22      THR  92   0.388  18.649   1.007
    7   HG23  THR  92          HG23      THR  92  -0.562  17.531   1.984

  No H/Q in entry =           7
  In of MODEL   80
    1    H    GLU  93           H        GLU  93   1.992  15.343   2.985
    2    HA   GLU  93           HA       GLU  93   1.465  17.246   5.005
    3    HB2  GLU  93           HB2      GLU  93   2.762  14.514   5.239
    4    HB3  GLU  93           HB3      GLU  93   2.073  15.442   6.572
    5    HG2  GLU  93           HG2      GLU  93   0.463  14.678   4.128
    6    HG3  GLU  93           HG3      GLU  93   0.555  13.652   5.554

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LEU  94           H        LEU  94   4.466  15.750   3.861
    2    HA   LEU  94           HA       LEU  94   6.218  16.883   5.756
    3    HB2  LEU  94           HB2      LEU  94   6.622  15.919   2.924
    4    HB3  LEU  94           HB3      LEU  94   7.953  16.568   3.878
    5    HG   LEU  94           HG       LEU  94   6.198  14.380   5.005
    6   HD11  LEU  94          HD11      LEU  94   8.297  14.146   2.878
    7   HD13  LEU  94          HD12      LEU  94   6.845  13.180   3.134
    8   HD12  LEU  94          HD13      LEU  94   8.267  12.917   4.144
    9   HD23  LEU  94          HD21      LEU  94   8.381  13.828   6.162
   10   HD22  LEU  94          HD22      LEU  94   7.722  15.409   6.579
   11   HD21  LEU  94          HD23      LEU  94   9.063  15.284   5.440

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  95           H        ILE  95   5.094  18.068   2.605
    2    HA   ILE  95           HA       ILE  95   6.680  20.416   2.555
    3    HB   ILE  95           HB       ILE  95   4.036  19.750   1.241
    4   HG12  ILE  95          HG12      ILE  95   6.829  20.074   0.112
    5   HG13  ILE  95          HG13      ILE  95   6.170  18.523   0.622
    6   HG21  ILE  95          HG21      ILE  95   5.800  22.208   1.030
    7   HG23  ILE  95          HG22      ILE  95   4.073  22.149   1.381
    8   HG22  ILE  95          HG23      ILE  95   4.658  21.748  -0.234
    9   HD13  ILE  95          HD11      ILE  95   4.614  18.460  -1.112
   10   HD12  ILE  95          HD12      ILE  95   5.970  19.272  -1.894
   11   HD11  ILE  95          HD13      ILE  95   4.601  20.213  -1.304

  No H/Q in entry =          11
  In of MODEL   80
    1    H    GLU  96           H        GLU  96   3.424  19.780   3.840
    2    HA   GLU  96           HA       GLU  96   2.817  22.429   4.595
    3    HB2  GLU  96           HB2      GLU  96   1.132  20.656   4.598
    4    HB3  GLU  96           HB3      GLU  96   1.985  19.821   5.894
    5    HG2  GLU  96           HG2      GLU  96   0.968  21.108   7.463
    6    HG3  GLU  96           HG3      GLU  96   1.514  22.580   6.671

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LEU  97           H        LEU  97   4.640  19.865   6.220
    2    HA   LEU  97           HA       LEU  97   4.999  21.206   8.694
    3    HB2  LEU  97           HB2      LEU  97   6.527  19.031   7.280
    4    HB3  LEU  97           HB3      LEU  97   7.117  19.709   8.795
    5    HG   LEU  97           HG       LEU  97   4.301  18.633   8.474
    6   HD12  LEU  97          HD11      LEU  97   5.226  16.613   9.685
    7   HD11  LEU  97          HD12      LEU  97   6.842  17.235   9.347
    8   HD13  LEU  97          HD13      LEU  97   5.773  16.786   8.017
    9   HD23  LEU  97          HD21      LEU  97   4.746  18.331  11.039
   10   HD22  LEU  97          HD22      LEU  97   4.377  19.946  10.437
   11   HD21  LEU  97          HD23      LEU  97   6.045  19.496  10.785

  No H/Q in entry =          11
  In of MODEL   80
    1    H    HIS  98           H        HIS  98   6.878  21.216   5.674
    2    HA   HIS  98           HA       HIS  98   9.039  22.781   6.582
    3    HB2  HIS  98           HB2      HIS  98   7.752  22.539   3.852
    4    HB3  HIS  98           HB3      HIS  98   9.197  23.508   4.148
    5    HD1  HIS  98           HD1      HIS  98   7.963  19.945   4.158
    6    HD2  HIS  98           HD2      HIS  98  11.556  22.018   4.596
    7    HE1  HIS  98           HE1      HIS  98   9.807  18.204   4.102
    8    HE2  HIS  98           HE2      HIS  98  11.999  19.445   4.370

  No H/Q in entry =           8
  In of MODEL   80
    1    H    GLU  99           H        GLU  99   5.827  23.639   5.399
    2    HA   GLU  99           HA       GLU  99   6.224  26.451   5.348
    3    HB2  GLU  99           HB2      GLU  99   4.341  25.297   4.210
    4    HB3  GLU  99           HB3      GLU  99   3.638  24.937   5.786
    5    HG2  GLU  99           HG2      GLU  99   3.472  27.329   6.292
    6    HG3  GLU  99           HG3      GLU  99   4.255  27.726   4.765

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LYS 100           H        LYS 100   5.072  24.218   7.862
    2    HA   LYS 100           HA       LYS 100   4.494  26.272   9.759
    3    HB2  LYS 100           HB2      LYS 100   5.048  23.317  10.100
    4    HB3  LYS 100           HB3      LYS 100   4.605  24.390  11.433
    5    HG2  LYS 100           HG2      LYS 100   2.547  25.044  10.181
    6    HG3  LYS 100           HG3      LYS 100   2.969  23.874   8.927
    7    HD2  LYS 100           HD2      LYS 100   2.875  22.051  10.585
    8    HD3  LYS 100           HD3      LYS 100   2.469  23.214  11.849
    9    HE2  LYS 100           HE2      LYS 100   0.424  23.851  10.582
   10    HE3  LYS 100           HE3      LYS 100   0.819  22.631   9.365
   11    HZ1  LYS 100           HZ1      LYS 100   0.540  21.961  12.244
   12    HZ3  LYS 100           HZ2      LYS 100   0.522  20.909  10.906
   13    HZ2  LYS 100           HZ3      LYS 100  -0.788  21.957  11.185

  No H/Q in entry =          13
  In of MODEL   80
    1    H    LEU 101           H        LEU 101   7.407  24.459   8.929
    2    HA   LEU 101           HA       LEU 101   9.005  25.283  11.139
    3    HB2  LEU 101           HB2      LEU 101   9.601  24.298   8.361
    4    HB3  LEU 101           HB3      LEU 101  10.905  24.952   9.347
    5    HG   LEU 101           HG       LEU 101   9.055  22.807  10.401
    6   HD12  LEU 101          HD11      LEU 101  11.100  21.299   9.796
    7   HD11  LEU 101          HD12      LEU 101  11.479  22.562   8.626
    8   HD13  LEU 101          HD13      LEU 101   9.944  21.700   8.526
    9   HD21  LEU 101          HD21      LEU 101  11.785  23.894  11.139
   10   HD23  LEU 101          HD22      LEU 101  11.229  22.325  11.714
   11   HD22  LEU 101          HD23      LEU 101  10.346  23.786  12.152

  No H/Q in entry =          11
  In of MODEL   80
    1    H    LYS 102           H        LYS 102   7.441  27.162   8.998
    2    HA   LYS 102           HA       LYS 102   7.536  29.455   8.711
    3    HB2  LYS 102           HB2      LYS 102   9.094  29.325  10.813
    4    HB3  LYS 102           HB3      LYS 102  10.398  29.512   9.658
    5    HG2  LYS 102           HG2      LYS 102   8.304  31.478  10.518
    6    HG3  LYS 102           HG3      LYS 102  10.019  31.727  10.272
    7    HD2  LYS 102           HD2      LYS 102   8.071  31.322   7.965
    8    HD3  LYS 102           HD3      LYS 102   8.464  32.897   8.638
    9    HE2  LYS 102           HE2      LYS 102   9.834  31.707   6.566
   10    HE3  LYS 102           HE3      LYS 102  10.457  33.008   7.582
   11    HZ2  LYS 102           HZ1      LYS 102  11.964  31.092   7.407
   12    HZ1  LYS 102           HZ2      LYS 102  10.793  30.117   8.144
   13    HZ3  LYS 102           HZ3      LYS 102  11.492  31.397   9.008

  No H/Q in entry =          13
  In of MODEL   80
    1    H    ALA 103           H        ALA 103  10.784  28.094   8.152
    2    HA   ALA 103           HA       ALA 103  11.764  29.468   6.082
    3    HB2  ALA 103           HB1      ALA 103  12.636  27.249   5.152
    4    HB1  ALA 103           HB2      ALA 103  11.732  26.479   6.454
    5    HB3  ALA 103           HB3      ALA 103  13.028  27.613   6.833

  No H/Q in entry =           5
  In of MODEL   80
    1    H1   LYS   3           H1       LYS   3 -31.861   5.607 -19.682
    2    H2   LYS   3           H3       LYS   3 -30.871   5.360 -21.039
    3    H3   LYS   3           H2       LYS   3 -32.212   4.353 -20.771
    4    HA   LYS   3           HA       LYS   3 -31.124   3.032 -19.365
    5    HB2  LYS   3           HB2      LYS   3 -28.933   4.552 -20.730
    6    HB3  LYS   3           HB3      LYS   3 -28.533   3.374 -19.480
    7    HG2  LYS   3           HG2      LYS   3 -29.881   1.702 -20.804
    8    HG3  LYS   3           HG3      LYS   3 -29.911   2.891 -22.105
    9    HD2  LYS   3           HD2      LYS   3 -27.426   2.910 -22.076
   10    HD3  LYS   3           HD3      LYS   3 -27.464   1.618 -20.878
   11    HE2  LYS   3           HE2      LYS   3 -28.913   0.349 -22.571
   12    HE3  LYS   3           HE3      LYS   3 -28.367   1.548 -23.742
   13    HZ3  LYS   3           HZ1      LYS   3 -26.509   0.415 -24.018
   14    HZ2  LYS   3           HZ2      LYS   3 -27.067  -0.776 -22.943
   15    HZ1  LYS   3           HZ3      LYS   3 -26.139   0.524 -22.364

  No H/Q in entry =          15
  In of MODEL   80
    1    H    LYS   4           H        LYS   4 -31.151   2.905 -17.302
    2    HA   LYS   4           HA       LYS   4 -30.528   5.241 -15.678
    3    HB2  LYS   4           HB2      LYS   4 -31.580   2.495 -14.945
    4    HB3  LYS   4           HB3      LYS   4 -31.418   3.853 -13.832
    5    HG2  LYS   4           HG2      LYS   4 -33.242   3.675 -16.235
    6    HG3  LYS   4           HG3      LYS   4 -33.719   3.716 -14.539
    7    HD2  LYS   4           HD2      LYS   4 -33.138   5.974 -14.298
    8    HD3  LYS   4           HD3      LYS   4 -32.109   5.956 -15.730
    9    HE2  LYS   4           HE2      LYS   4 -34.109   7.224 -16.186
   10    HE3  LYS   4           HE3      LYS   4 -34.120   5.742 -17.140
   11    HZ3  LYS   4           HZ1      LYS   4 -35.633   4.762 -15.571
   12    HZ2  LYS   4           HZ2      LYS   4 -36.270   6.222 -16.163
   13    HZ1  LYS   4           HZ3      LYS   4 -35.595   6.158 -14.606

  No H/Q in entry =          13
  In of MODEL   80
    1    H    HIS   5           H        HIS   5 -29.051   5.415 -14.101
    2    HA   HIS   5           HA       HIS   5 -26.680   3.703 -14.438
    3    HB2  HIS   5           HB2      HIS   5 -27.065   6.452 -13.252
    4    HB3  HIS   5           HB3      HIS   5 -25.537   5.575 -13.242
    5    HD1  HIS   5           HD1      HIS   5 -24.144   6.834 -14.855
    6    HD2  HIS   5           HD2      HIS   5 -27.922   6.007 -16.368
    7    HE1  HIS   5           HE1      HIS   5 -24.028   7.400 -17.312
    8    HE2  HIS   5           HE2      HIS   5 -26.331   6.885 -18.203

  No H/Q in entry =           8
  In of MODEL   80
    1    H    ILE   6           H        ILE   6 -26.360   2.156 -13.111
    2    HA   ILE   6           HA       ILE   6 -27.322   2.398 -10.341
    3    HB   ILE   6           HB       ILE   6 -26.388  -0.037 -11.865
    4   HG12  ILE   6          HG12      ILE   6 -29.167   0.768 -10.996
    5   HG13  ILE   6          HG13      ILE   6 -28.548   0.948 -12.637
    6   HG23  ILE   6          HG21      ILE   6 -26.681  -1.290  -9.990
    7   HG22  ILE   6          HG22      ILE   6 -27.888  -0.198  -9.311
    8   HG21  ILE   6          HG23      ILE   6 -26.177   0.226  -9.240
    9   HD13  ILE   6          HD11      ILE   6 -28.905  -1.196 -13.115
   10   HD12  ILE   6          HD12      ILE   6 -29.907  -1.218 -11.664
   11   HD11  ILE   6          HD13      ILE   6 -28.224  -1.741 -11.582

  No H/Q in entry =          11
  In of MODEL   80
    1    H    TYR   7           H        TYR   7 -25.586   3.138  -9.075
    2    HA   TYR   7           HA       TYR   7 -22.837   2.312  -9.772
    3    HB2  TYR   7           HB2      TYR   7 -23.908   4.708  -8.303
    4    HB3  TYR   7           HB3      TYR   7 -22.200   4.277  -8.353
    5    HD1  TYR   7           HD1      TYR   7 -23.219   3.257 -11.426
    6    HD2  TYR   7           HD2      TYR   7 -22.708   6.877  -9.235
    7    HE1  TYR   7           HE1      TYR   7 -22.868   4.488 -13.530
    8    HE2  TYR   7           HE2      TYR   7 -22.400   8.112 -11.333
    9    HH   TYR   7           HH       TYR   7 -22.634   7.995 -13.562

  No H/Q in entry =           9
  In of MODEL   80
    1    H    LEU   8           H        LEU   8 -21.793   1.021  -8.442
    2    HA   LEU   8           HA       LEU   8 -22.873   0.495  -5.744
    3    HB2  LEU   8           HB2      LEU   8 -21.106  -1.098  -7.579
    4    HB3  LEU   8           HB3      LEU   8 -21.257  -1.473  -5.864
    5    HG   LEU   8           HG       LEU   8 -23.730  -1.773  -6.260
    6   HD13  LEU   8          HD11      LEU   8 -23.940  -0.583  -8.379
    7   HD12  LEU   8          HD12      LEU   8 -24.388  -2.273  -8.600
    8   HD11  LEU   8          HD13      LEU   8 -22.811  -1.701  -9.145
    9   HD23  LEU   8          HD21      LEU   8 -22.370  -3.763  -7.949
   10   HD22  LEU   8          HD22      LEU   8 -23.435  -3.973  -6.559
   11   HD21  LEU   8          HD23      LEU   8 -21.746  -3.532  -6.316

  No H/Q in entry =          11
  In of MODEL   80
    1    H    PHE   9           H        PHE   9 -21.610   0.948  -3.975
    2    HA   PHE   9           HA       PHE   9 -18.872   2.012  -4.490
    3    HB2  PHE   9           HB2      PHE   9 -20.928   3.016  -2.525
    4    HB3  PHE   9           HB3      PHE   9 -19.243   3.517  -2.537
    5    HD1  PHE   9           HD1      PHE   9 -18.346   4.889  -4.334
    6    HD2  PHE   9           HD2      PHE   9 -22.467   3.697  -4.316
    7    HE1  PHE   9           HE1      PHE   9 -18.832   6.539  -6.116
    8    HE2  PHE   9           HE2      PHE   9 -22.955   5.359  -6.093
    9    HZ   PHE   9           HZ       PHE   9 -21.134   6.776  -6.999

  No H/Q in entry =           9
  In of MODEL   80
    1    H    SER  10           H        SER  10 -17.238   1.160  -3.350
    2    HA   SER  10           HA       SER  10 -17.421   0.283  -0.654
    3    HB2  SER  10           HB2      SER  10 -18.565  -1.644  -1.695
    4    HB3  SER  10           HB3      SER  10 -17.183  -1.873  -2.755
    5    HG   SER  10           HG       SER  10 -16.930  -3.218  -1.018

  No H/Q in entry =           5
  In of MODEL   80
    1    H    SER  11           H        SER  11 -15.393   0.343   0.207
    2    HA   SER  11           HA       SER  11 -13.240   1.311  -1.334
    3    HB2  SER  11           HB2      SER  11 -13.752   1.382   1.254
    4    HB3  SER  11           HB3      SER  11 -12.720  -0.050   1.260
    5    HG   SER  11           HG       SER  11 -11.051   1.151   0.739

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ALA  12           H        ALA  12 -14.339  -1.399  -2.154
    2    HA   ALA  12           HA       ALA  12 -11.729  -2.581  -2.659
    3    HB3  ALA  12           HB1      ALA  12 -12.359  -3.710  -0.593
    4    HB2  ALA  12           HB2      ALA  12 -12.427  -4.843  -1.941
    5    HB1  ALA  12           HB3      ALA  12 -13.917  -4.161  -1.291

  No H/Q in entry =           5
  In of MODEL   80
    1    H    GLY  13           H        GLY  13 -12.535  -1.608  -4.707
    2    HA3  GLY  13           HA2      GLY  13 -14.746  -2.428  -6.170
    3    HA2  GLY  13           HA3      GLY  13 -13.217  -1.908  -6.894

  No H/Q in entry =           3
  In of MODEL   80
    1    H    MET  14           H        MET  14 -11.697  -4.167  -5.742
    2    HA   MET  14           HA       MET  14 -11.789  -5.936  -7.864
    3    HB2  MET  14           HB2      MET  14  -9.948  -5.942  -6.206
    4    HB3  MET  14           HB3      MET  14 -11.000  -6.748  -5.044
    5    HG2  MET  14           HG2      MET  14  -9.604  -8.412  -6.154
    6    HG3  MET  14           HG3      MET  14 -11.268  -8.629  -6.697
    7    HE2  MET  14           HE1      MET  14  -8.017  -9.074  -7.820
    8    HE1  MET  14           HE2      MET  14  -7.720  -7.375  -7.458
    9    HE3  MET  14           HE3      MET  14  -7.604  -7.947  -9.120

  No H/Q in entry =           9
  In of MODEL   80
    1    H    SER  15           H        SER  15 -13.138  -6.751  -4.685
    2    HA   SER  15           HA       SER  15 -14.523  -9.051  -5.690
    3    HB2  SER  15           HB2      SER  15 -14.114  -9.182  -3.368
    4    HB3  SER  15           HB3      SER  15 -14.729  -7.556  -3.084
    5    HG   SER  15           HG       SER  15 -16.797  -8.278  -3.468

  No H/Q in entry =           5
  In of MODEL   80
    1    H    THR  16           H        THR  16 -15.529  -5.681  -5.098
    2    HA   THR  16           HA       THR  16 -18.339  -6.069  -5.584
    3    HB   THR  16           HB       THR  16 -16.712  -3.567  -6.149
    4    HG1  THR  16           HG1      THR  16 -16.751  -4.830  -3.913
    5   HG21  THR  16          HG21      THR  16 -19.091  -3.607  -6.876
    6   HG23  THR  16          HG22      THR  16 -18.805  -2.430  -5.581
    7   HG22  THR  16          HG23      THR  16 -19.563  -3.989  -5.225

  No H/Q in entry =           7
  In of MODEL   80
    1    H    SER  17           H        SER  17 -15.541  -5.418  -7.485
    2    HA   SER  17           HA       SER  17 -16.725  -4.757  -9.983
    3    HB2  SER  17           HB2      SER  17 -14.030  -5.965  -9.319
    4    HB3  SER  17           HB3      SER  17 -14.512  -5.501 -10.950
    5    HG   SER  17           HG       SER  17 -13.644  -3.681 -10.315

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LEU  18           H        LEU  18 -15.987  -7.856  -8.513
    2    HA   LEU  18           HA       LEU  18 -16.515  -9.405 -10.849
    3    HB2  LEU  18           HB2      LEU  18 -15.234 -10.280  -8.941
    4    HB3  LEU  18           HB3      LEU  18 -16.670 -10.161  -7.926
    5    HG   LEU  18           HG       LEU  18 -17.812 -11.813  -9.313
    6   HD13  LEU  18          HD11      LEU  18 -16.995 -11.556 -11.484
    7   HD12  LEU  18          HD12      LEU  18 -16.217 -13.051 -10.967
    8   HD11  LEU  18          HD13      LEU  18 -15.314 -11.537 -10.952
    9   HD23  LEU  18          HD21      LEU  18 -16.321 -13.749  -8.812
   10   HD22  LEU  18          HD22      LEU  18 -16.645 -12.669  -7.454
   11   HD21  LEU  18          HD23      LEU  18 -15.099 -12.584  -8.298

  No H/Q in entry =          11
  In of MODEL   80
    1    H    LEU  19           H        LEU  19 -18.521  -8.274  -8.133
    2    HA   LEU  19           HA       LEU  19 -20.927  -9.589  -8.934
    3    HB2  LEU  19           HB2      LEU  19 -20.704  -8.733  -6.695
    4    HB3  LEU  19           HB3      LEU  19 -20.470  -7.096  -7.304
    5    HG   LEU  19           HG       LEU  19 -22.807  -7.020  -8.019
    6   HD13  LEU  19          HD11      LEU  19 -23.371  -9.252  -8.529
    7   HD12  LEU  19          HD12      LEU  19 -24.296  -8.880  -7.074
    8   HD11  LEU  19          HD13      LEU  19 -22.818  -9.836  -6.959
    9   HD23  LEU  19          HD21      LEU  19 -22.620  -7.918  -5.156
   10   HD22  LEU  19          HD22      LEU  19 -23.739  -6.751  -5.860
   11   HD21  LEU  19          HD23      LEU  19 -22.026  -6.360  -5.728

  No H/Q in entry =          11
  In of MODEL   80
    1    H    VAL  20           H        VAL  20 -19.600  -6.362  -9.669
    2    HA   VAL  20           HA       VAL  20 -21.774  -5.444 -11.229
    3    HB   VAL  20           HB       VAL  20 -18.820  -4.702 -11.386
    4   HG11  VAL  20          HG11      VAL  20 -21.200  -3.449 -12.779
    5   HG13  VAL  20          HG12      VAL  20 -19.802  -4.201 -13.546
    6   HG12  VAL  20          HG13      VAL  20 -19.612  -2.693 -12.653
    7   HG22  VAL  20          HG21      VAL  20 -19.652  -3.967  -9.337
    8   HG21  VAL  20          HG22      VAL  20 -21.210  -3.518 -10.025
    9   HG23  VAL  20          HG23      VAL  20 -19.777  -2.555 -10.386

  No H/Q in entry =           9
  In of MODEL   80
    1    H    SER  21           H        SER  21 -18.924  -7.361 -12.262
    2    HA   SER  21           HA       SER  21 -19.734  -7.314 -15.007
    3    HB2  SER  21           HB2      SER  21 -18.203  -9.209 -15.335
    4    HB3  SER  21           HB3      SER  21 -17.431  -7.914 -14.423
    5    HG   SER  21           HG       SER  21 -17.505  -9.089 -12.635

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LYS  22           H        LYS  22 -20.667  -9.527 -12.407
    2    HA   LYS  22           HA       LYS  22 -22.136 -11.240 -14.202
    3    HB2  LYS  22           HB2      LYS  22 -22.429 -10.876 -11.217
    4    HB3  LYS  22           HB3      LYS  22 -23.170 -12.157 -12.174
    5    HG2  LYS  22           HG2      LYS  22 -20.197 -11.765 -11.868
    6    HG3  LYS  22           HG3      LYS  22 -21.165 -12.876 -10.899
    7    HD2  LYS  22           HD2      LYS  22 -21.818 -14.068 -12.961
    8    HD3  LYS  22           HD3      LYS  22 -20.784 -12.982 -13.893
    9    HE2  LYS  22           HE2      LYS  22 -19.797 -14.787 -11.677
   10    HE3  LYS  22           HE3      LYS  22 -19.743 -15.201 -13.390
   11    HZ2  LYS  22           HZ1      LYS  22 -18.213 -13.144 -11.937
   12    HZ1  LYS  22           HZ2      LYS  22 -18.422 -13.051 -13.621
   13    HZ3  LYS  22           HZ3      LYS  22 -17.643 -14.395 -12.935

  No H/Q in entry =          13
  In of MODEL   80
    1    H    MET  23           H        MET  23 -22.991  -8.341 -12.353
    2    HA   MET  23           HA       MET  23 -25.794  -8.563 -12.835
    3    HB2  MET  23           HB2      MET  23 -24.060  -6.162 -12.298
    4    HB3  MET  23           HB3      MET  23 -25.813  -6.081 -12.463
    5    HG2  MET  23           HG2      MET  23 -26.124  -7.384 -10.479
    6    HG3  MET  23           HG3      MET  23 -24.394  -7.709 -10.364
    7    HE2  MET  23           HE1      MET  23 -26.861  -4.165  -9.187
    8    HE1  MET  23           HE2      MET  23 -27.078  -5.158 -10.627
    9    HE3  MET  23           HE3      MET  23 -26.115  -3.682 -10.712

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ARG  24           H        ARG  24 -23.128  -7.017 -14.654
    2    HA   ARG  24           HA       ARG  24 -24.703  -5.809 -16.651
    3    HB2  ARG  24           HB2      ARG  24 -22.278  -5.293 -16.289
    4    HB3  ARG  24           HB3      ARG  24 -21.873  -6.872 -16.914
    5    HG2  ARG  24           HG2      ARG  24 -22.821  -6.249 -19.145
    6    HG3  ARG  24           HG3      ARG  24 -23.194  -4.632 -18.493
    7    HD2  ARG  24           HD2      ARG  24 -20.738  -4.448 -17.832
    8    HD3  ARG  24           HD3      ARG  24 -20.473  -5.926 -18.748
    9    HE   ARG  24           HE       ARG  24 -20.597  -4.874 -20.716
   10   HH21  ARG  24          HH11      ARG  24 -19.506  -3.072 -21.497
   11   HH22  ARG  24          HH12      ARG  24 -19.942  -1.496 -20.934
   12   HH11  ARG  24          HH21      ARG  24 -22.004  -2.851 -18.396
   13   HH12  ARG  24          HH22      ARG  24 -21.428  -1.376 -19.106

  No H/Q in entry =          13
  In of MODEL   80
    1    H    ALA  25           H        ALA  25 -23.419  -9.086 -16.357
    2    HA   ALA  25           HA       ALA  25 -24.027  -9.969 -18.983
    3    HB1  ALA  25           HB1      ALA  25 -23.228 -11.959 -18.276
    4    HB3  ALA  25           HB2      ALA  25 -24.274 -11.978 -16.857
    5    HB2  ALA  25           HB3      ALA  25 -22.760 -11.076 -16.823

  No H/Q in entry =           5
  In of MODEL   80
    1    H    GLN  26           H        GLN  26 -25.826 -10.071 -15.945
    2    HA   GLN  26           HA       GLN  26 -28.117 -11.393 -16.933
    3    HB2  GLN  26           HB2      GLN  26 -27.671  -9.604 -14.564
    4    HB3  GLN  26           HB3      GLN  26 -29.199 -10.404 -14.895
    5    HG2  GLN  26           HG2      GLN  26 -26.543 -11.731 -14.437
    6    HG3  GLN  26           HG3      GLN  26 -27.899 -11.685 -13.316
    7   HE21  GLN  26          HE21      GLN  26 -26.589 -13.799 -14.585
    8   HE22  GLN  26          HE22      GLN  26 -27.585 -14.900 -15.366

  No H/Q in entry =           8
  In of MODEL   80
    1    H    ALA  27           H        ALA  27 -27.343  -7.952 -16.575
    2    HA   ALA  27           HA       ALA  27 -29.888  -6.986 -17.346
    3    HB1  ALA  27           HB1      ALA  27 -28.135  -5.576 -16.256
    4    HB3  ALA  27           HB2      ALA  27 -28.773  -4.851 -17.733
    5    HB2  ALA  27           HB3      ALA  27 -27.198  -5.644 -17.749

  No H/Q in entry =           5
  In of MODEL   80
    1    H    GLU  28           H        GLU  28 -27.146  -8.092 -19.228
    2    HA   GLU  28           HA       GLU  28 -28.149  -7.118 -21.748
    3    HB2  GLU  28           HB2      GLU  28 -25.736  -7.682 -21.138
    4    HB3  GLU  28           HB3      GLU  28 -26.202  -9.371 -21.324
    5    HG2  GLU  28           HG2      GLU  28 -25.109  -8.556 -23.306
    6    HG3  GLU  28           HG3      GLU  28 -26.792  -8.963 -23.638

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LYS  29           H        LYS  29 -28.154 -10.216 -20.067
    2    HA   LYS  29           HA       LYS  29 -29.401 -11.761 -22.051
    3    HB2  LYS  29           HB2      LYS  29 -28.290 -12.679 -20.048
    4    HB3  LYS  29           HB3      LYS  29 -29.586 -12.026 -19.048
    5    HG2  LYS  29           HG2      LYS  29 -31.188 -13.483 -20.094
    6    HG3  LYS  29           HG3      LYS  29 -29.969 -14.069 -21.223
    7    HD2  LYS  29           HD2      LYS  29 -28.759 -15.167 -19.491
    8    HD3  LYS  29           HD3      LYS  29 -29.695 -14.361 -18.235
    9    HE2  LYS  29           HE2      LYS  29 -30.337 -16.746 -18.575
   10    HE3  LYS  29           HE3      LYS  29 -31.672 -15.617 -18.816
   11    HZ1  LYS  29           HZ1      LYS  29 -31.121 -15.742 -21.246
   12    HZ3  LYS  29           HZ2      LYS  29 -31.768 -17.157 -20.567
   13    HZ2  LYS  29           HZ3      LYS  29 -30.103 -17.050 -20.878

  No H/Q in entry =          13
  In of MODEL   80
    1    H    TYR  30           H        TYR  30 -30.872  -9.706 -19.551
    2    HA   TYR  30           HA       TYR  30 -33.520 -10.291 -20.768
    3    HB2  TYR  30           HB2      TYR  30 -32.902  -9.088 -18.060
    4    HB3  TYR  30           HB3      TYR  30 -34.510  -9.428 -18.698
    5    HD1  TYR  30           HD1      TYR  30 -35.311 -11.762 -18.889
    6    HD2  TYR  30           HD2      TYR  30 -31.503 -10.845 -17.221
    7    HE1  TYR  30           HE1      TYR  30 -35.105 -14.077 -18.078
    8    HE2  TYR  30           HE2      TYR  30 -31.298 -13.146 -16.413
    9    HH   TYR  30           HH       TYR  30 -32.830 -15.590 -17.477

  No H/Q in entry =           9
  In of MODEL   80
    1    H    GLU  31           H        GLU  31 -31.458  -8.204 -21.599
    2    HA   GLU  31           HA       GLU  31 -31.494  -6.051 -22.436
    3    HB2  GLU  31           HB2      GLU  31 -34.356  -6.909 -22.922
    4    HB3  GLU  31           HB3      GLU  31 -33.587  -5.507 -23.666
    5    HG2  GLU  31           HG2      GLU  31 -32.057  -6.881 -24.860
    6    HG3  GLU  31           HG3      GLU  31 -32.546  -8.314 -23.958

  No H/Q in entry =           6
  In of MODEL   80
    1    H    VAL  32           H        VAL  32 -31.677  -5.940 -19.704
    2    HA   VAL  32           HA       VAL  32 -33.635  -3.915 -19.044
    3    HB   VAL  32           HB       VAL  32 -31.185  -4.781 -17.475
    4   HG12  VAL  32          HG11      VAL  32 -32.745  -4.019 -15.574
    5   HG11  VAL  32          HG12      VAL  32 -33.630  -3.166 -16.837
    6   HG13  VAL  32          HG13      VAL  32 -31.938  -2.777 -16.532
    7   HG21  VAL  32          HG21      VAL  32 -32.873  -6.590 -18.138
    8   HG23  VAL  32          HG22      VAL  32 -33.942  -5.806 -16.976
    9   HG22  VAL  32          HG23      VAL  32 -32.389  -6.451 -16.448

  No H/Q in entry =           9
  In of MODEL   80
    1    HA   PRO  33           HA       PRO  33 -30.763  -0.854 -20.761
    2    HB2  PRO  33           HB2      PRO  33 -32.381   1.293 -20.639
    3    HB3  PRO  33           HB3      PRO  33 -32.793  -0.039 -21.722
    4    HG2  PRO  33           HG2      PRO  33 -33.764   0.449 -18.905
    5    HG3  PRO  33           HG3      PRO  33 -34.728   0.183 -20.357
    6    HD2  PRO  33           HD2      PRO  33 -34.158  -1.853 -18.682
    7    HD3  PRO  33           HD3      PRO  33 -34.221  -2.109 -20.425

  No H/Q in entry =           7
  In of MODEL   80
    1    H    VAL  34           H        VAL  34 -29.458  -1.322 -18.818
    2    HA   VAL  34           HA       VAL  34 -29.283   1.125 -17.189
    3    HB   VAL  34           HB       VAL  34 -28.615  -0.293 -15.247
    4   HG12  VAL  34          HG11      VAL  34 -30.979  -1.282 -14.915
    5   HG11  VAL  34          HG12      VAL  34 -31.344  -0.549 -16.475
    6   HG13  VAL  34          HG13      VAL  34 -30.830   0.463 -15.125
    7   HG21  VAL  34          HG21      VAL  34 -28.715  -2.340 -17.241
    8   HG23  VAL  34          HG22      VAL  34 -29.742  -2.743 -15.864
    9   HG22  VAL  34          HG23      VAL  34 -28.038  -2.369 -15.612

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ILE  35           H        ILE  35 -27.324   1.664 -16.368
    2    HA   ILE  35           HA       ILE  35 -24.966   0.442 -17.641
    3    HB   ILE  35           HB       ILE  35 -25.503   3.314 -16.845
    4   HG12  ILE  35          HG12      ILE  35 -24.476   2.040 -19.389
    5   HG13  ILE  35          HG13      ILE  35 -26.133   2.581 -19.121
    6   HG21  ILE  35          HG21      ILE  35 -22.871   1.910 -17.165
    7   HG23  ILE  35          HG22      ILE  35 -23.373   3.073 -15.940
    8   HG22  ILE  35          HG23      ILE  35 -23.031   3.615 -17.584
    9   HD11  ILE  35          HD11      ILE  35 -24.840   4.846 -18.544
   10   HD13  ILE  35          HD12      ILE  35 -25.369   4.427 -20.174
   11   HD12  ILE  35          HD13      ILE  35 -23.698   4.143 -19.689

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ILE  36           H        ILE  36 -23.673  -0.507 -16.045
    2    HA   ILE  36           HA       ILE  36 -24.122   0.104 -13.176
    3    HB   ILE  36           HB       ILE  36 -23.168  -2.561 -14.273
    4   HG12  ILE  36          HG12      ILE  36 -26.006  -1.892 -13.492
    5   HG13  ILE  36          HG13      ILE  36 -25.450  -1.854 -15.164
    6   HG23  ILE  36          HG21      ILE  36 -23.461  -3.392 -12.151
    7   HG22  ILE  36          HG22      ILE  36 -24.647  -2.164 -11.711
    8   HG21  ILE  36          HG23      ILE  36 -22.936  -1.747 -11.799
    9   HD13  ILE  36          HD11      ILE  36 -25.505  -4.075 -15.355
   10   HD12  ILE  36          HD12      ILE  36 -26.564  -3.997 -13.949
   11   HD11  ILE  36          HD13      ILE  36 -24.846  -4.330 -13.740

  No H/Q in entry =          11
  In of MODEL   80
    1    H    GLU  37           H        GLU  37 -22.365   0.830 -12.089
    2    HA   GLU  37           HA       GLU  37 -19.646   0.163 -13.022
    3    HB2  GLU  37           HB2      GLU  37 -20.576   2.917 -12.220
    4    HB3  GLU  37           HB3      GLU  37 -18.920   2.454 -12.611
    5    HG2  GLU  37           HG2      GLU  37 -21.216   2.414 -14.548
    6    HG3  GLU  37           HG3      GLU  37 -20.053   3.729 -14.385

  No H/Q in entry =           6
  In of MODEL   80
    1    H    ALA  38           H        ALA  38 -18.135   0.012 -11.350
    2    HA   ALA  38           HA       ALA  38 -19.153   0.156  -8.573
    3    HB1  ALA  38           HB1      ALA  38 -17.353  -1.703 -10.000
    4    HB3  ALA  38           HB2      ALA  38 -18.379  -1.982  -8.593
    5    HB2  ALA  38           HB3      ALA  38 -16.802  -1.216  -8.398

  No H/Q in entry =           5
  In of MODEL   80
    1    H    PHE  39           H        PHE  39 -17.963   1.438  -7.118
    2    HA   PHE  39           HA       PHE  39 -15.511   2.762  -8.042
    3    HB2  PHE  39           HB2      PHE  39 -17.989   4.131  -7.014
    4    HB3  PHE  39           HB3      PHE  39 -16.395   4.883  -6.947
    5    HD1  PHE  39           HD1      PHE  39 -15.102   4.938  -9.218
    6    HD2  PHE  39           HD2      PHE  39 -19.327   4.514  -8.829
    7    HE1  PHE  39           HE1      PHE  39 -15.387   5.782 -11.531
    8    HE2  PHE  39           HE2      PHE  39 -19.629   5.347 -11.134
    9    HZ   PHE  39           HZ       PHE  39 -17.662   5.954 -12.503

  No H/Q in entry =           9
  In of MODEL   80
    1    HA   PRO  40           HA       PRO  40 -14.500   2.086  -3.759
    2    HB2  PRO  40           HB2      PRO  40 -12.836   4.194  -3.180
    3    HB3  PRO  40           HB3      PRO  40 -12.332   2.880  -4.242
    4    HG2  PRO  40           HG2      PRO  40 -13.503   5.554  -4.999
    5    HG3  PRO  40           HG3      PRO  40 -12.040   4.782  -5.612
    6    HD2  PRO  40           HD2      PRO  40 -14.266   4.571  -7.001
    7    HD3  PRO  40           HD3      PRO  40 -13.236   3.154  -6.809

  No H/Q in entry =           7
  In of MODEL   80
    1    H    GLU  41           H        GLU  41 -15.156   3.045  -1.630
    2    HA   GLU  41           HA       GLU  41 -17.486   4.627  -1.606
    3    HB2  GLU  41           HB2      GLU  41 -16.961   4.824   0.879
    4    HB3  GLU  41           HB3      GLU  41 -17.161   3.193   0.235
    5    HG2  GLU  41           HG2      GLU  41 -15.334   2.973   1.633
    6    HG3  GLU  41           HG3      GLU  41 -14.590   3.185   0.048

  No H/Q in entry =           6
  In of MODEL   80
    1    H    THR  42           H        THR  42 -14.209   5.719  -1.691
    2    HA   THR  42           HA       THR  42 -14.686   8.265  -0.492
    3    HB   THR  42           HB       THR  42 -12.571   8.945  -1.596
    4    HG1  THR  42           HG1      THR  42 -12.693   6.342  -2.734
    5   HG23  THR  42          HG21      THR  42 -11.146   7.472  -0.388
    6   HG22  THR  42          HG22      THR  42 -12.290   6.134  -0.532
    7   HG21  THR  42          HG23      THR  42 -12.663   7.503   0.514

  No H/Q in entry =           7
  In of MODEL   80
    1    H    LEU  43           H        LEU  43 -15.556   7.103  -3.578
    2    HA   LEU  43           HA       LEU  43 -15.964   9.852  -4.564
    3    HB2  LEU  43           HB2      LEU  43 -16.201   7.181  -5.939
    4    HB3  LEU  43           HB3      LEU  43 -16.494   8.743  -6.702
    5    HG   LEU  43           HG       LEU  43 -13.822   7.803  -5.688
    6   HD11  LEU  43          HD11      LEU  43 -14.926   6.633  -7.734
    7   HD13  LEU  43          HD12      LEU  43 -13.263   7.203  -7.857
    8   HD12  LEU  43          HD13      LEU  43 -14.571   8.148  -8.565
    9   HD22  LEU  43          HD21      LEU  43 -13.744  10.129  -5.665
   10   HD21  LEU  43          HD22      LEU  43 -14.832  10.281  -7.046
   11   HD23  LEU  43          HD23      LEU  43 -13.167   9.752  -7.288

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ALA  44           H        ALA  44 -17.796   7.939  -2.683
    2    HA   ALA  44           HA       ALA  44 -20.272   7.658  -3.984
    3    HB2  ALA  44           HB1      ALA  44 -20.058   6.566  -1.881
    4    HB3  ALA  44           HB2      ALA  44 -21.233   7.851  -1.609
    5    HB1  ALA  44           HB3      ALA  44 -19.566   8.052  -1.070

  No H/Q in entry =           5
  In of MODEL   80
    1    H    GLY  45           H        GLY  45 -18.991  10.541  -2.482
    2    HA3  GLY  45           HA2      GLY  45 -21.508  11.906  -2.832
    3    HA2  GLY  45           HA3      GLY  45 -19.994  12.617  -2.272

  No H/Q in entry =           3
  In of MODEL   80
    1    H    GLU  46           H        GLU  46 -18.433  11.746  -4.569
    2    HA   GLU  46           HA       GLU  46 -19.201  13.912  -6.347
    3    HB2  GLU  46           HB2      GLU  46 -16.901  11.951  -6.384
    4    HB3  GLU  46           HB3      GLU  46 -17.109  13.263  -7.545
    5    HG2  GLU  46           HG2      GLU  46 -16.749  13.607  -4.575
    6    HG3  GLU  46           HG3      GLU  46 -15.478  13.789  -5.784

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LYS  47           H        LYS  47 -18.898  10.402  -6.760
    2    HA   LYS  47           HA       LYS  47 -20.028  10.544  -9.427
    3    HB2  LYS  47           HB2      LYS  47 -18.739   8.519  -7.742
    4    HB3  LYS  47           HB3      LYS  47 -20.086   7.898  -8.697
    5    HG2  LYS  47           HG2      LYS  47 -18.013   7.594  -9.884
    6    HG3  LYS  47           HG3      LYS  47 -19.021   8.772 -10.723
    7    HD2  LYS  47           HD2      LYS  47 -17.756  10.595  -9.746
    8    HD3  LYS  47           HD3      LYS  47 -16.786   9.452  -8.819
    9    HE2  LYS  47           HE2      LYS  47 -15.931   8.491 -10.897
   10    HE3  LYS  47           HE3      LYS  47 -16.904   9.630 -11.824
   11    HZ2  LYS  47           HZ1      LYS  47 -14.586  10.177 -10.090
   12    HZ1  LYS  47           HZ2      LYS  47 -15.686  11.401 -10.505
   13    HZ3  LYS  47           HZ3      LYS  47 -14.816  10.592 -11.720

  No H/Q in entry =          13
  In of MODEL   80
    1    H    GLY  48           H        GLY  48 -21.284   9.740  -6.263
    2    HA3  GLY  48           HA2      GLY  48 -23.609   8.424  -6.976
    3    HA2  GLY  48           HA3      GLY  48 -23.424   9.440  -5.546

  No H/Q in entry =           3
  In of MODEL   80
    1    H    GLN  49           H        GLN  49 -22.984  11.878  -7.138
    2    HA   GLN  49           HA       GLN  49 -25.600  12.851  -7.268
    3    HB2  GLN  49           HB2      GLN  49 -23.116  13.839  -8.656
    4    HB3  GLN  49           HB3      GLN  49 -24.627  14.726  -8.566
    5    HG2  GLN  49           HG2      GLN  49 -24.450  14.776  -6.130
    6    HG3  GLN  49           HG3      GLN  49 -22.951  13.868  -6.218
    7   HE21  GLN  49          HE21      GLN  49 -22.942  16.109  -4.962
    8   HE22  GLN  49          HE22      GLN  49 -22.092  17.407  -5.625

  No H/Q in entry =           8
  In of MODEL   80
    1    H    ASN  50           H        ASN  50 -23.842  11.046  -9.657
    2    HA   ASN  50           HA       ASN  50 -25.786  11.803 -11.729
    3    HB2  ASN  50           HB2      ASN  50 -23.129  10.399 -11.973
    4    HB3  ASN  50           HB3      ASN  50 -24.211  10.760 -13.311
    5   HD21  ASN  50          HD21      ASN  50 -21.611  11.756 -11.728
    6   HD22  ASN  50          HD22      ASN  50 -21.467  13.398 -12.084

  No H/Q in entry =           6
  In of MODEL   80
    1    H    ALA  51           H        ALA  51 -25.629   9.467  -9.467
    2    HA   ALA  51           HA       ALA  51 -26.313   7.270 -11.272
    3    HB2  ALA  51           HB1      ALA  51 -25.647   5.966  -9.582
    4    HB3  ALA  51           HB2      ALA  51 -26.801   6.722  -8.485
    5    HB1  ALA  51           HB3      ALA  51 -25.199   7.427  -8.701

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ASP  52           H        ASP  52 -28.259   6.112 -11.109
    2    HA   ASP  52           HA       ASP  52 -30.529   7.833 -10.437
    3    HB2  ASP  52           HB2      ASP  52 -30.221   5.331 -12.092
    4    HB3  ASP  52           HB3      ASP  52 -31.798   5.985 -11.649

  No H/Q in entry =           4
  In of MODEL   80
    1    H    VAL  53           H        VAL  53 -28.771   5.040  -9.416
    2    HA   VAL  53           HA       VAL  53 -30.196   5.110  -6.888
    3    HB   VAL  53           HB       VAL  53 -31.518   3.389  -8.109
    4   HG11  VAL  53          HG11      VAL  53 -29.741   2.610  -9.640
    5   HG13  VAL  53          HG12      VAL  53 -30.499   1.279  -8.765
    6   HG12  VAL  53          HG13      VAL  53 -28.913   1.869  -8.272
    7   HG23  VAL  53          HG21      VAL  53 -30.580   1.469  -6.410
    8   HG22  VAL  53          HG22      VAL  53 -31.772   2.716  -6.044
    9   HG21  VAL  53          HG23      VAL  53 -30.073   2.979  -5.652

  No H/Q in entry =           9
  In of MODEL   80
    1    H    VAL  54           H        VAL  54 -28.849   4.758  -5.241
    2    HA   VAL  54           HA       VAL  54 -26.054   4.047  -5.871
    3    HB   VAL  54           HB       VAL  54 -27.196   5.783  -3.624
    4   HG11  VAL  54          HG11      VAL  54 -24.550   4.496  -3.926
    5   HG13  VAL  54          HG12      VAL  54 -25.325   5.147  -2.483
    6   HG12  VAL  54          HG13      VAL  54 -24.483   6.228  -3.593
    7   HG22  VAL  54          HG21      VAL  54 -26.440   7.632  -4.742
    8   HG21  VAL  54          HG22      VAL  54 -26.947   6.605  -6.083
    9   HG23  VAL  54          HG23      VAL  54 -25.240   6.721  -5.660

  No H/Q in entry =           9
  In of MODEL   80
    1    H    LEU  55           H        LEU  55 -25.359   2.163  -5.219
    2    HA   LEU  55           HA       LEU  55 -26.780   0.792  -3.023
    3    HB2  LEU  55           HB2      LEU  55 -25.184  -0.311  -5.323
    4    HB3  LEU  55           HB3      LEU  55 -25.885  -1.274  -4.022
    5    HG   LEU  55           HG       LEU  55 -27.418   0.223  -6.137
    6   HD13  LEU  55          HD11      LEU  55 -27.034  -1.621  -7.347
    7   HD12  LEU  55          HD12      LEU  55 -27.936  -2.535  -6.138
    8   HD11  LEU  55          HD13      LEU  55 -26.184  -2.379  -6.003
    9   HD23  LEU  55          HD21      LEU  55 -28.597  -1.773  -4.258
   10   HD22  LEU  55          HD22      LEU  55 -29.369  -0.435  -5.110
   11   HD21  LEU  55          HD23      LEU  55 -28.352  -0.117  -3.704

  No H/Q in entry =          11
  In of MODEL   80
    1    H    LEU  56           H        LEU  56 -25.585   0.271  -1.223
    2    HA   LEU  56           HA       LEU  56 -22.675   0.814  -1.300
    3    HB2  LEU  56           HB2      LEU  56 -24.446   0.529   1.115
    4    HB3  LEU  56           HB3      LEU  56 -22.760   1.046   1.087
    5    HG   LEU  56           HG       LEU  56 -25.149   2.598   0.131
    6   HD11  LEU  56          HD11      LEU  56 -23.996   2.291   2.644
    7   HD13  LEU  56          HD12      LEU  56 -25.059   3.605   2.138
    8   HD12  LEU  56          HD13      LEU  56 -23.311   3.798   2.034
    9   HD23  LEU  56          HD21      LEU  56 -23.296   4.392  -0.090
   10   HD22  LEU  56          HD22      LEU  56 -23.632   3.267  -1.407
   11   HD21  LEU  56          HD23      LEU  56 -22.254   2.992  -0.343

  No H/Q in entry =          11
  In of MODEL   80
    1    H    GLY  57           H        GLY  57 -21.210  -0.740  -0.766
    2    HA3  GLY  57           HA2      GLY  57 -21.996  -3.471  -0.937
    3    HA2  GLY  57           HA3      GLY  57 -20.397  -2.891  -0.476

  No H/Q in entry =           3
  In of MODEL   80
    1    HA   PRO  58           HA       PRO  58 -23.120  -4.044   3.265
    2    HB2  PRO  58           HB2      PRO  58 -22.299  -6.606   3.884
    3    HB3  PRO  58           HB3      PRO  58 -23.710  -6.276   2.879
    4    HG2  PRO  58           HG2      PRO  58 -20.948  -7.023   2.077
    5    HG3  PRO  58           HG3      PRO  58 -22.492  -7.567   1.421
    6    HD2  PRO  58           HD2      PRO  58 -20.988  -5.678   0.173
    7    HD3  PRO  58           HD3      PRO  58 -22.750  -5.682   0.085

  No H/Q in entry =           7
  In of MODEL   80
    1    H    GLN  59           H        GLN  59 -19.734  -4.349   2.633
    2    HA   GLN  59           HA       GLN  59 -18.957  -4.308   5.388
    3    HB2  GLN  59           HB2      GLN  59 -17.413  -3.349   2.973
    4    HB3  GLN  59           HB3      GLN  59 -16.753  -3.616   4.574
    5    HG2  GLN  59           HG2      GLN  59 -17.943  -5.735   2.792
    6    HG3  GLN  59           HG3      GLN  59 -16.228  -5.436   3.016
    7   HE21  GLN  59          HE21      GLN  59 -18.421  -7.304   3.806
    8   HE22  GLN  59          HE22      GLN  59 -18.178  -8.082   5.256

  No H/Q in entry =           8
  In of MODEL   80
    1    H    ILE  60           H        ILE  60 -20.036  -1.825   3.170
    2    HA   ILE  60           HA       ILE  60 -19.267   0.188   5.194
    3    HB   ILE  60           HB       ILE  60 -19.089   1.846   3.549
    4   HG12  ILE  60          HG12      ILE  60 -20.612   0.047   1.663
    5   HG13  ILE  60          HG13      ILE  60 -21.237   1.493   2.456
    6   HG21  ILE  60          HG21      ILE  60 -18.201  -0.702   2.241
    7   HG23  ILE  60          HG22      ILE  60 -17.270   0.315   3.339
    8   HG22  ILE  60          HG23      ILE  60 -17.714   0.918   1.744
    9   HD13  ILE  60          HD11      ILE  60 -19.945   2.928   1.122
   10   HD12  ILE  60          HD12      ILE  60 -20.472   1.681  -0.006
   11   HD11  ILE  60          HD13      ILE  60 -18.836   1.642   0.650

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ALA  61           H        ALA  61 -21.639  -1.519   5.295
    2    HA   ALA  61           HA       ALA  61 -23.950   0.029   4.844
    3    HB1  ALA  61           HB1      ALA  61 -25.078  -1.510   6.190
    4    HB2  ALA  61           HB2      ALA  61 -23.654  -1.821   7.184
    5    HB3  ALA  61           HB3      ALA  61 -23.732  -2.444   5.535

  No H/Q in entry =           5
  In of MODEL   80
    1    H    TYR  62           H        TYR  62 -21.717   0.049   7.623
    2    HA   TYR  62           HA       TYR  62 -23.340   1.638   9.295
    3    HB2  TYR  62           HB2      TYR  62 -21.333   2.148  10.528
    4    HB3  TYR  62           HB3      TYR  62 -21.268   0.458  10.027
    5    HD1  TYR  62           HD1      TYR  62 -19.662  -0.272   8.285
    6    HD2  TYR  62           HD2      TYR  62 -19.706   3.763   9.693
    7    HE1  TYR  62           HE1      TYR  62 -17.474   0.120   7.220
    8    HE2  TYR  62           HE2      TYR  62 -17.503   4.149   8.629
    9    HH   TYR  62           HH       TYR  62 -15.780   3.166   7.637

  No H/Q in entry =           9
  In of MODEL   80
    1    H    MET  63           H        MET  63 -21.765   2.556   6.419
    2    HA   MET  63           HA       MET  63 -21.734   5.398   7.093
    3    HB2  MET  63           HB2      MET  63 -21.072   3.888   4.563
    4    HB3  MET  63           HB3      MET  63 -20.967   5.642   4.728
    5    HG2  MET  63           HG2      MET  63 -19.243   5.372   6.433
    6    HG3  MET  63           HG3      MET  63 -19.337   3.622   6.244
    7    HE3  MET  63           HE1      MET  63 -16.020   4.771   4.661
    8    HE2  MET  63           HE2      MET  63 -16.656   3.150   4.948
    9    HE1  MET  63           HE3      MET  63 -16.890   4.416   6.155

  No H/Q in entry =           9
  In of MODEL   80
    1    H    LEU  64           H        LEU  64 -24.211   3.412   6.162
    2    HA   LEU  64           HA       LEU  64 -25.507   4.753   4.084
    3    HB2  LEU  64           HB2      LEU  64 -26.262   2.614   5.025
    4    HB3  LEU  64           HB3      LEU  64 -26.748   3.444   6.503
    5    HG   LEU  64           HG       LEU  64 -28.513   4.604   5.281
    6   HD13  LEU  64          HD11      LEU  64 -28.261   4.842   3.043
    7   HD12  LEU  64          HD12      LEU  64 -28.827   3.176   2.916
    8   HD11  LEU  64          HD13      LEU  64 -27.097   3.521   2.956
    9   HD23  LEU  64          HD21      LEU  64 -28.898   1.763   4.557
   10   HD22  LEU  64          HD22      LEU  64 -29.933   2.854   5.478
   11   HD21  LEU  64          HD23      LEU  64 -28.515   2.135   6.238

  No H/Q in entry =          11
  In of MODEL   80
    1    HA   PRO  65           HA       PRO  65 -27.817   7.817   6.832
    2    HB2  PRO  65           HB2      PRO  65 -25.807   8.090   9.068
    3    HB3  PRO  65           HB3      PRO  65 -27.557   8.285   9.127
    4    HG2  PRO  65           HG2      PRO  65 -26.511   6.086  10.061
    5    HG3  PRO  65           HG3      PRO  65 -27.936   5.977   9.030
    6    HD2  PRO  65           HD2      PRO  65 -25.044   5.498   8.305
    7    HD3  PRO  65           HD3      PRO  65 -26.459   4.538   7.877

  No H/Q in entry =           7
  In of MODEL   80
    1    H    GLU  66           H        GLU  66 -24.261   7.935   6.875
    2    HA   GLU  66           HA       GLU  66 -24.104  10.741   6.447
    3    HB2  GLU  66           HB2      GLU  66 -22.186   8.519   5.796
    4    HB3  GLU  66           HB3      GLU  66 -21.822  10.230   5.573
    5    HG2  GLU  66           HG2      GLU  66 -22.030  10.608   7.940
    6    HG3  GLU  66           HG3      GLU  66 -22.473   8.919   8.187

  No H/Q in entry =           6
  In of MODEL   80
    1    H    ILE  67           H        ILE  67 -24.092   7.978   4.215
    2    HA   ILE  67           HA       ILE  67 -23.778   9.687   1.907
    3    HB   ILE  67           HB       ILE  67 -24.535   6.741   2.116
    4   HG12  ILE  67          HG12      ILE  67 -21.972   8.029   1.161
    5   HG13  ILE  67          HG13      ILE  67 -22.232   7.608   2.853
    6   HG21  ILE  67          HG21      ILE  67 -24.586   8.603  -0.124
    7   HG23  ILE  67          HG22      ILE  67 -25.131   6.928  -0.056
    8   HG22  ILE  67          HG23      ILE  67 -23.442   7.291  -0.401
    9   HD12  ILE  67          HD11      ILE  67 -21.748   5.841   0.512
   10   HD11  ILE  67          HD12      ILE  67 -22.722   5.230   1.848
   11   HD13  ILE  67          HD13      ILE  67 -21.071   5.777   2.139

  No H/Q in entry =          11
  In of MODEL   80
    1    H    GLN  68           H        GLN  68 -26.580   8.510   3.573
    2    HA   GLN  68           HA       GLN  68 -28.468   9.338   1.610
    3    HB2  GLN  68           HB2      GLN  68 -28.682   8.991   4.597
    4    HB3  GLN  68           HB3      GLN  68 -30.037   9.516   3.611
    5    HG2  GLN  68           HG2      GLN  68 -29.980   7.477   2.350
    6    HG3  GLN  68           HG3      GLN  68 -28.498   6.976   3.143
    7   HE21  GLN  68          HE21      GLN  68 -30.612   5.516   3.038
    8   HE22  GLN  68          HE22      GLN  68 -31.406   5.032   4.462

  No H/Q in entry =           8
  In of MODEL   80
    1    H    ARG  69           H        ARG  69 -26.919  11.097   4.321
    2    HA   ARG  69           HA       ARG  69 -28.400  13.512   3.909
    3    HB2  ARG  69           HB2      ARG  69 -26.002  12.703   5.484
    4    HB3  ARG  69           HB3      ARG  69 -26.162  14.414   5.114
    5    HG2  ARG  69           HG2      ARG  69 -28.470  14.357   6.106
    6    HG3  ARG  69           HG3      ARG  69 -28.180  12.682   6.589
    7    HD2  ARG  69           HD2      ARG  69 -26.589  15.120   7.471
    8    HD3  ARG  69           HD3      ARG  69 -27.667  14.169   8.483
    9    HE   ARG  69           HE       ARG  69 -25.023  13.352   7.515
   10   HH21  ARG  69          HH11      ARG  69 -24.125  11.636   8.716
   11   HH22  ARG  69          HH12      ARG  69 -25.105  10.782   9.860
   12   HH11  ARG  69          HH21      ARG  69 -27.937  12.682   9.244
   13   HH12  ARG  69          HH22      ARG  69 -27.263  11.372  10.157

  No H/Q in entry =          13
  In of MODEL   80
    1    H    LEU  70           H        LEU  70 -25.480  12.227   2.533
    2    HA   LEU  70           HA       LEU  70 -24.486  14.632   1.338
    3    HB2  LEU  70           HB2      LEU  70 -23.382  12.367   1.941
    4    HB3  LEU  70           HB3      LEU  70 -23.988  11.862   0.364
    5    HG   LEU  70           HG       LEU  70 -22.469  13.297  -0.745
    6   HD11  LEU  70          HD11      LEU  70 -21.661  14.198   2.029
    7   HD13  LEU  70          HD12      LEU  70 -22.414  15.190   0.780
    8   HD12  LEU  70          HD13      LEU  70 -20.775  14.581   0.550
    9   HD22  LEU  70          HD21      LEU  70 -20.958  11.649  -0.515
   10   HD21  LEU  70          HD22      LEU  70 -21.847  11.096   0.905
   11   HD23  LEU  70          HD23      LEU  70 -20.510  12.231   1.089

  No H/Q in entry =          11
  In of MODEL   80
    1    H    LEU  71           H        LEU  71 -26.532  11.988   0.260
    2    HA   LEU  71           HA       LEU  71 -27.146  13.431  -2.261
    3    HB2  LEU  71           HB2      LEU  71 -27.215  10.444  -1.793
    4    HB3  LEU  71           HB3      LEU  71 -27.395  11.287  -3.330
    5    HG   LEU  71           HG       LEU  71 -24.863  11.423  -1.693
    6   HD12  LEU  71          HD11      LEU  71 -24.866   9.777  -4.113
    7   HD11  LEU  71          HD12      LEU  71 -25.836   9.119  -2.797
    8   HD13  LEU  71          HD13      LEU  71 -24.128   9.476  -2.540
    9   HD22  LEU  71          HD21      LEU  71 -25.059  13.223  -3.198
   10   HD21  LEU  71          HD22      LEU  71 -25.522  12.150  -4.518
   11   HD23  LEU  71          HD23      LEU  71 -23.890  12.079  -3.855

  No H/Q in entry =          11
  In of MODEL   80
    1    HA   PRO  72           HA       PRO  72 -30.965  12.834   0.399
    2    HB2  PRO  72           HB2      PRO  72 -31.933  15.354   0.309
    3    HB3  PRO  72           HB3      PRO  72 -30.596  14.967   1.391
    4    HG2  PRO  72           HG2      PRO  72 -30.486  16.149  -1.373
    5    HG3  PRO  72           HG3      PRO  72 -29.731  16.743   0.106
    6    HD2  PRO  72           HD2      PRO  72 -28.344  15.231  -1.662
    7    HD3  PRO  72           HD3      PRO  72 -28.067  15.087   0.073

  No H/Q in entry =           7
  In of MODEL   80
    1    H    ASN  73           H        ASN  73 -30.412  13.791  -2.827
    2    HA   ASN  73           HA       ASN  73 -33.262  13.356  -3.430
    3    HB2  ASN  73           HB2      ASN  73 -32.863  14.466  -5.539
    4    HB3  ASN  73           HB3      ASN  73 -32.370  15.477  -4.190
    5   HD21  ASN  73          HD21      ASN  73 -31.602  15.536  -6.875
    6   HD22  ASN  73          HD22      ASN  73 -29.931  15.445  -7.082

  No H/Q in entry =           6
  In of MODEL   80
    1    H    LYS  74           H        LYS  74 -31.184  11.190  -3.008
    2    HA   LYS  74           HA       LYS  74 -31.716   9.754  -5.542
    3    HB2  LYS  74           HB2      LYS  74 -29.158   9.580  -3.943
    4    HB3  LYS  74           HB3      LYS  74 -29.522   8.741  -5.451
    5    HG2  LYS  74           HG2      LYS  74 -29.379  11.721  -5.272
    6    HG3  LYS  74           HG3      LYS  74 -27.965  10.714  -5.582
    7    HD2  LYS  74           HD2      LYS  74 -29.060   9.726  -7.508
    8    HD3  LYS  74           HD3      LYS  74 -30.516  10.666  -7.182
    9    HE2  LYS  74           HE2      LYS  74 -29.380  12.718  -7.649
   10    HE3  LYS  74           HE3      LYS  74 -27.824  11.891  -7.749
   11    HZ2  LYS  74           HZ1      LYS  74 -29.338  12.417  -9.864
   12    HZ1  LYS  74           HZ2      LYS  74 -29.925  10.872  -9.475
   13    HZ3  LYS  74           HZ3      LYS  74 -28.272  11.098  -9.788

  No H/Q in entry =          13
  In of MODEL   80
    1    HA   PRO  75           HA       PRO  75 -32.959   6.736  -2.537
    2    HB2  PRO  75           HB2      PRO  75 -33.191   4.495  -4.100
    3    HB3  PRO  75           HB3      PRO  75 -34.373   5.801  -4.169
    4    HG2  PRO  75           HG2      PRO  75 -32.029   5.288  -5.958
    5    HG3  PRO  75           HG3      PRO  75 -33.697   5.654  -6.393
    6    HD2  PRO  75           HD2      PRO  75 -31.834   7.597  -6.380
    7    HD3  PRO  75           HD3      PRO  75 -33.477   7.934  -5.829

  No H/Q in entry =           7
  In of MODEL   80
    1    H    VAL  76           H        VAL  76 -31.451   5.751  -1.171
    2    HA   VAL  76           HA       VAL  76 -28.949   4.635  -2.291
    3    HB   VAL  76           HB       VAL  76 -29.273   6.108   0.358
    4   HG11  VAL  76          HG11      VAL  76 -26.879   4.907  -1.047
    5   HG13  VAL  76          HG12      VAL  76 -27.542   4.441   0.522
    6   HG12  VAL  76          HG13      VAL  76 -26.761   6.009   0.327
    7   HG22  VAL  76          HG21      VAL  76 -28.691   8.028  -0.548
    8   HG21  VAL  76          HG22      VAL  76 -29.219   7.299  -2.067
    9   HG23  VAL  76          HG23      VAL  76 -27.511   7.284  -1.627

  No H/Q in entry =           9
  In of MODEL   80
    1    H    GLU  77           H        GLU  77 -28.639   2.496  -1.666
    2    HA   GLU  77           HA       GLU  77 -29.369   1.697   1.001
    3    HB2  GLU  77           HB2      GLU  77 -30.912  -0.018   0.497
    4    HB3  GLU  77           HB3      GLU  77 -31.529   1.475  -0.211
    5    HG2  GLU  77           HG2      GLU  77 -30.909   0.727  -2.398
    6    HG3  GLU  77           HG3      GLU  77 -30.201  -0.738  -1.720

  No H/Q in entry =           6
  In of MODEL   80
    1    H    VAL  78           H        VAL  78 -28.951  -0.370   1.672
    2    HA   VAL  78           HA       VAL  78 -26.264  -1.038   0.766
    3    HB   VAL  78           HB       VAL  78 -27.913  -1.973   3.153
    4   HG11  VAL  78          HG11      VAL  78 -25.535  -3.113   2.017
    5   HG13  VAL  78          HG12      VAL  78 -26.410  -3.611   3.466
    6   HG12  VAL  78          HG13      VAL  78 -25.138  -2.395   3.577
    7   HG22  VAL  78          HG21      VAL  78 -26.500  -0.541   4.468
    8   HG21  VAL  78          HG22      VAL  78 -27.286   0.388   3.192
    9   HG23  VAL  78          HG23      VAL  78 -25.590  -0.072   3.032

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ILE  79           H        ILE  79 -25.656  -2.929  -0.131
    2    HA   ILE  79           HA       ILE  79 -27.665  -4.501  -1.448
    3    HB   ILE  79           HB       ILE  79 -24.654  -4.903  -1.250
    4   HG12  ILE  79          HG12      ILE  79 -26.355  -3.884  -3.531
    5   HG13  ILE  79          HG13      ILE  79 -25.513  -2.830  -2.394
    6   HG22  ILE  79          HG21      ILE  79 -25.727  -6.144  -3.550
    7   HG21  ILE  79          HG22      ILE  79 -26.677  -6.695  -2.171
    8   HG23  ILE  79          HG23      ILE  79 -24.926  -6.902  -2.174
    9   HD13  ILE  79          HD11      ILE  79 -24.112  -2.900  -4.224
   10   HD12  ILE  79          HD12      ILE  79 -24.383  -4.623  -4.490
   11   HD11  ILE  79          HD13      ILE  79 -23.408  -4.083  -3.122

  No H/Q in entry =          11
  In of MODEL   80
    1    H    ASP  80           H        ASP  80 -28.445  -6.454  -0.843
    2    HA   ASP  80           HA       ASP  80 -28.332  -7.330   1.809
    3    HB2  ASP  80           HB2      ASP  80 -30.075  -7.991   0.190
    4    HB3  ASP  80           HB3      ASP  80 -28.884  -8.957  -0.682

  No H/Q in entry =           4
  In of MODEL   80
    1    H    SER  81           H        SER  81 -26.741  -8.392   2.934
    2    HA   SER  81           HA       SER  81 -24.229  -8.980   1.725
    3    HB2  SER  81           HB2      SER  81 -23.615  -9.966   3.897
    4    HB3  SER  81           HB3      SER  81 -24.385  -8.393   4.106
    5    HG   SER  81           HG       SER  81 -25.210 -10.887   4.869

  No H/Q in entry =           5
  In of MODEL   80
    1    H    LEU  82           H        LEU  82 -26.848 -11.178   2.087
    2    HA   LEU  82           HA       LEU  82 -25.208 -13.486   1.571
    3    HB2  LEU  82           HB2      LEU  82 -28.170 -12.993   1.337
    4    HB3  LEU  82           HB3      LEU  82 -27.402 -14.566   1.132
    5    HG   LEU  82           HG       LEU  82 -27.379 -12.966   3.673
    6   HD13  LEU  82          HD11      LEU  82 -29.062 -14.480   4.469
    7   HD12  LEU  82          HD12      LEU  82 -28.948 -15.462   3.008
    8   HD11  LEU  82          HD13      LEU  82 -29.634 -13.839   2.929
    9   HD23  LEU  82          HD21      LEU  82 -26.682 -15.320   4.481
   10   HD22  LEU  82          HD22      LEU  82 -25.481 -14.345   3.635
   11   HD21  LEU  82          HD23      LEU  82 -26.326 -15.636   2.782

  No H/Q in entry =          11
  In of MODEL   80
    1    H    LEU  83           H        LEU  83 -27.273 -11.358  -0.348
    2    HA   LEU  83           HA       LEU  83 -27.038 -12.726  -2.810
    3    HB2  LEU  83           HB2      LEU  83 -27.562  -9.833  -2.181
    4    HB3  LEU  83           HB3      LEU  83 -27.581 -10.492  -3.815
    5    HG   LEU  83           HG       LEU  83 -29.579 -10.944  -1.619
    6   HD13  LEU  83          HD11      LEU  83 -30.419  -9.138  -2.690
    7   HD12  LEU  83          HD12      LEU  83 -30.847 -10.280  -3.963
    8   HD11  LEU  83          HD13      LEU  83 -29.350  -9.353  -4.075
    9   HD23  LEU  83          HD21      LEU  83 -29.690 -12.229  -4.332
   10   HD22  LEU  83          HD22      LEU  83 -30.631 -12.607  -2.890
   11   HD21  LEU  83          HD23      LEU  83 -28.924 -13.042  -2.966

  No H/Q in entry =          11
  In of MODEL   80
    1    H    TYR  84           H        TYR  84 -25.170 -10.249  -1.169
    2    HA   TYR  84           HA       TYR  84 -23.348  -9.703  -3.321
    3    HB2  TYR  84           HB2      TYR  84 -23.925  -8.249  -1.267
    4    HB3  TYR  84           HB3      TYR  84 -22.791  -9.276  -0.393
    5    HD1  TYR  84           HD1      TYR  84 -20.463  -9.599  -1.762
    6    HD2  TYR  84           HD2      TYR  84 -23.076  -6.233  -2.032
    7    HE1  TYR  84           HE1      TYR  84 -18.582  -8.221  -2.582
    8    HE2  TYR  84           HE2      TYR  84 -21.208  -4.846  -2.863
    9    HH   TYR  84           HH       TYR  84 -17.930  -6.240  -3.211

  No H/Q in entry =           9
  In of MODEL   80
    1    H    GLY  85           H        GLY  85 -23.000 -11.670  -0.361
    2    HA3  GLY  85           HA2      GLY  85 -20.391 -12.510  -0.860
    3    HA2  GLY  85           HA3      GLY  85 -21.577 -13.399   0.096

  No H/Q in entry =           3
  In of MODEL   80
    1    H    LYS  86           H        LYS  86 -23.425 -13.865  -1.945
    2    HA   LYS  86           HA       LYS  86 -22.285 -16.204  -3.194
    3    HB2  LYS  86           HB2      LYS  86 -24.508 -16.226  -2.248
    4    HB3  LYS  86           HB3      LYS  86 -24.989 -14.866  -3.260
    5    HG2  LYS  86           HG2      LYS  86 -25.967 -16.914  -4.045
    6    HG3  LYS  86           HG3      LYS  86 -24.815 -16.288  -5.225
    7    HD2  LYS  86           HD2      LYS  86 -23.126 -17.823  -4.508
    8    HD3  LYS  86           HD3      LYS  86 -24.083 -18.314  -3.112
    9    HE2  LYS  86           HE2      LYS  86 -25.743 -19.320  -4.574
   10    HE3  LYS  86           HE3      LYS  86 -24.847 -18.778  -5.992
   11    HZ1  LYS  86           HZ1      LYS  86 -22.986 -20.087  -4.486
   12    HZ3  LYS  86           HZ2      LYS  86 -23.776 -20.708  -5.856
   13    HZ2  LYS  86           HZ3      LYS  86 -24.379 -21.042  -4.305

  No H/Q in entry =          13
  In of MODEL   80
    1    H    VAL  87           H        VAL  87 -22.414 -12.998  -4.114
    2    HA   VAL  87           HA       VAL  87 -22.181 -11.830  -6.067
    3    HB   VAL  87           HB       VAL  87 -21.007 -14.331  -7.332
    4   HG11  VAL  87          HG11      VAL  87 -21.381 -12.082  -8.560
    5   HG13  VAL  87          HG12      VAL  87 -19.780 -12.814  -8.670
    6   HG12  VAL  87          HG13      VAL  87 -20.062 -11.474  -7.560
    7   HG23  VAL  87          HG21      VAL  87 -18.796 -13.396  -6.393
    8   HG22  VAL  87          HG22      VAL  87 -19.822 -14.367  -5.340
    9   HG21  VAL  87          HG23      VAL  87 -19.819 -12.611  -5.191

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ASP  88           H        ASP  88 -24.665 -12.573  -5.687
    2    HA   ASP  88           HA       ASP  88 -25.757 -13.854  -8.064
    3    HB2  ASP  88           HB2      ASP  88 -26.720 -14.121  -5.729
    4    HB3  ASP  88           HB3      ASP  88 -27.244 -12.440  -5.838

  No H/Q in entry =           4
  In of MODEL   80
    1    H    GLY  89           H        GLY  89 -25.120 -12.583  -9.722
    2    HA3  GLY  89           HA2      GLY  89 -25.419  -9.822  -9.943
    3    HA2  GLY  89           HA3      GLY  89 -25.360 -10.953 -11.296

  No H/Q in entry =           3
  In of MODEL   80
    1    H    LEU  90           H        LEU  90 -27.744 -12.401 -10.813
    2    HA   LEU  90           HA       LEU  90 -29.644 -10.552 -11.925
    3    HB2  LEU  90           HB2      LEU  90 -29.614 -12.954 -12.484
    4    HB3  LEU  90           HB3      LEU  90 -30.089 -13.327 -10.827
    5    HG   LEU  90           HG       LEU  90 -32.256 -12.302 -11.180
    6   HD13  LEU  90          HD11      LEU  90 -32.163 -10.568 -12.671
    7   HD12  LEU  90          HD12      LEU  90 -32.661 -11.836 -13.792
    8   HD11  LEU  90          HD13      LEU  90 -30.964 -11.370 -13.688
    9   HD23  LEU  90          HD21      LEU  90 -32.141 -13.949 -13.602
   10   HD22  LEU  90          HD22      LEU  90 -33.099 -14.142 -12.134
   11   HD21  LEU  90          HD23      LEU  90 -31.421 -14.685 -12.170

  No H/Q in entry =          11
  In of MODEL   80
    1    H    GLY  91           H        GLY  91 -29.384 -12.018  -8.731
    2    HA3  GLY  91           HA2      GLY  91 -31.757 -10.995  -7.677
    3    HA2  GLY  91           HA3      GLY  91 -30.335 -11.461  -6.744

  No H/Q in entry =           3
  In of MODEL   80
    1    H    VAL  92           H        VAL  92 -28.504  -9.563  -7.634
    2    HA   VAL  92           HA       VAL  92 -29.376  -7.284  -6.097
    3    HB   VAL  92           HB       VAL  92 -26.827  -7.660  -7.713
    4   HG12  VAL  92          HG11      VAL  92 -27.050  -5.763  -5.400
    5   HG11  VAL  92          HG12      VAL  92 -27.751  -5.261  -6.941
    6   HG13  VAL  92          HG13      VAL  92 -26.036  -5.657  -6.841
    7   HG22  VAL  92          HG21      VAL  92 -26.523  -9.222  -6.110
    8   HG21  VAL  92          HG22      VAL  92 -27.690  -8.482  -5.012
    9   HG23  VAL  92          HG23      VAL  92 -26.064  -7.813  -5.154

  No H/Q in entry =           9
  In of MODEL   80
    1    H    LEU  93           H        LEU  93 -28.974  -7.957  -9.515
    2    HA   LEU  93           HA       LEU  93 -29.439  -5.347 -10.464
    3    HB2  LEU  93           HB2      LEU  93 -28.733  -7.186 -11.915
    4    HB3  LEU  93           HB3      LEU  93 -30.291  -7.978 -11.671
    5    HG   LEU  93           HG       LEU  93 -31.395  -6.069 -12.802
    6   HD11  LEU  93          HD11      LEU  93 -29.608  -4.393 -12.329
    7   HD13  LEU  93          HD12      LEU  93 -30.062  -4.457 -14.033
    8   HD12  LEU  93          HD13      LEU  93 -28.571  -5.224 -13.489
    9   HD23  LEU  93          HD21      LEU  93 -30.355  -6.612 -15.094
   10   HD22  LEU  93          HD22      LEU  93 -31.134  -7.895 -14.169
   11   HD21  LEU  93          HD23      LEU  93 -29.374  -7.765 -14.190

  No H/Q in entry =          11
  In of MODEL   80
    1    H    LYS  94           H        LYS  94 -31.696  -7.984  -9.569
    2    HA   LYS  94           HA       LYS  94 -34.106  -6.647 -10.182
    3    HB2  LYS  94           HB2      LYS  94 -33.480  -8.791  -8.157
    4    HB3  LYS  94           HB3      LYS  94 -35.108  -8.165  -8.415
    5    HG2  LYS  94           HG2      LYS  94 -35.012  -8.957 -10.743
    6    HG3  LYS  94           HG3      LYS  94 -33.417  -9.639 -10.425
    7    HD2  LYS  94           HD2      LYS  94 -34.462 -11.003  -8.578
    8    HD3  LYS  94           HD3      LYS  94 -36.038 -10.426  -9.123
    9    HE2  LYS  94           HE2      LYS  94 -35.505 -11.351 -11.387
   10    HE3  LYS  94           HE3      LYS  94 -34.052 -12.069 -10.691
   11    HZ3  LYS  94           HZ1      LYS  94 -35.837 -13.668 -10.830
   12    HZ2  LYS  94           HZ2      LYS  94 -36.845 -12.676  -9.887
   13    HZ1  LYS  94           HZ3      LYS  94 -35.448 -13.360  -9.206

  No H/Q in entry =          13
  In of MODEL   80
    1    H    ALA  95           H        ALA  95 -32.249  -6.664  -7.151
    2    HA   ALA  95           HA       ALA  95 -34.148  -5.150  -5.666
    3    HB2  ALA  95           HB1      ALA  95 -31.712  -6.420  -5.142
    4    HB3  ALA  95           HB2      ALA  95 -32.716  -5.546  -3.986
    5    HB1  ALA  95           HB3      ALA  95 -31.411  -4.710  -4.828

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ALA  96           H        ALA  96 -31.566  -4.205  -7.797
    2    HA   ALA  96           HA       ALA  96 -31.577  -1.435  -7.047
    3    HB2  ALA  96           HB1      ALA  96 -30.246  -1.170  -9.172
    4    HB3  ALA  96           HB2      ALA  96 -30.482  -2.892  -9.474
    5    HB1  ALA  96           HB3      ALA  96 -29.574  -2.361  -8.058

  No H/Q in entry =           5
  In of MODEL   80
    1    H    VAL  97           H        VAL  97 -33.062  -3.235  -9.704
    2    HA   VAL  97           HA       VAL  97 -34.239  -0.992 -10.968
    3    HB   VAL  97           HB       VAL  97 -34.927  -3.949 -10.978
    4   HG11  VAL  97          HG11      VAL  97 -36.805  -2.022 -11.462
    5   HG13  VAL  97          HG12      VAL  97 -36.807  -3.622 -12.205
    6   HG12  VAL  97          HG13      VAL  97 -36.117  -2.250 -13.071
    7   HG21  VAL  97          HG21      VAL  97 -33.744  -2.087 -13.040
    8   HG23  VAL  97          HG22      VAL  97 -34.131  -3.787 -13.311
    9   HG22  VAL  97          HG23      VAL  97 -32.888  -3.339 -12.141

  No H/Q in entry =           9
  In of MODEL   80
    1    H    ALA  98           H        ALA  98 -35.306  -3.196  -8.401
    2    HA   ALA  98           HA       ALA  98 -37.909  -2.150  -8.033
    3    HB1  ALA  98           HB1      ALA  98 -36.796  -4.297  -6.993
    4    HB3  ALA  98           HB2      ALA  98 -38.004  -3.414  -6.058
    5    HB2  ALA  98           HB3      ALA  98 -36.288  -3.192  -5.717

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ALA  99           H        ALA  99 -34.848  -1.214  -6.424
    2    HA   ALA  99           HA       ALA  99 -36.040   0.737  -4.767
    3    HB1  ALA  99           HB1      ALA  99 -33.365  -0.052  -5.534
    4    HB2  ALA  99           HB2      ALA  99 -33.931   0.688  -4.035
    5    HB3  ALA  99           HB3      ALA  99 -33.509   1.701  -5.415

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ILE 100           H        ILE 100 -35.039   0.882  -8.134
    2    HA   ILE 100           HA       ILE 100 -35.332   3.719  -8.372
    3    HB   ILE 100           HB       ILE 100 -35.364   1.545 -10.493
    4   HG12  ILE 100          HG12      ILE 100 -33.274   3.626  -9.861
    5   HG13  ILE 100          HG13      ILE 100 -33.239   1.984  -9.217
    6   HG21  ILE 100          HG21      ILE 100 -35.902   4.445 -10.642
    7   HG23  ILE 100          HG22      ILE 100 -36.368   3.148 -11.743
    8   HG22  ILE 100          HG23      ILE 100 -34.743   3.828 -11.819
    9   HD12  ILE 100          HD11      ILE 100 -32.772   2.940 -12.003
   10   HD11  ILE 100          HD12      ILE 100 -33.366   1.302 -11.730
   11   HD13  ILE 100          HD13      ILE 100 -31.831   1.812 -11.029

  No H/Q in entry =          11
  In of MODEL   80
    1    H    LYS 101           H        LYS 101 -37.529   1.015  -9.056
    2    HA   LYS 101           HA       LYS 101 -39.683   2.575 -10.046
    3    HB2  LYS 101           HB2      LYS 101 -39.446  -0.184  -8.899
    4    HB3  LYS 101           HB3      LYS 101 -41.031   0.514  -9.235
    5    HG2  LYS 101           HG2      LYS 101 -40.585   0.648 -11.538
    6    HG3  LYS 101           HG3      LYS 101 -38.872   0.312 -11.297
    7    HD2  LYS 101           HD2      LYS 101 -40.055  -1.651 -12.157
    8    HD3  LYS 101           HD3      LYS 101 -39.399  -1.944 -10.546
    9    HE2  LYS 101           HE2      LYS 101 -41.428  -2.714 -10.014
   10    HE3  LYS 101           HE3      LYS 101 -41.951  -1.030 -10.024
   11    HZ3  LYS 101           HZ1      LYS 101 -42.857  -1.238 -12.131
   12    HZ2  LYS 101           HZ2      LYS 101 -43.253  -2.723 -11.408
   13    HZ1  LYS 101           HZ3      LYS 101 -41.960  -2.632 -12.505

  No H/Q in entry =          13
  In of MODEL   80
    1    H    LYS 102           H        LYS 102 -39.102   1.142  -6.832
    2    HA   LYS 102           HA       LYS 102 -41.382   2.257  -5.620
    3    HB2  LYS 102           HB2      LYS 102 -40.064   0.447  -4.605
    4    HB3  LYS 102           HB3      LYS 102 -38.714   1.559  -4.383
    5    HG2  LYS 102           HG2      LYS 102 -40.069   2.912  -2.883
    6    HG3  LYS 102           HG3      LYS 102 -41.424   1.805  -3.107
    7    HD2  LYS 102           HD2      LYS 102 -40.115  -0.004  -2.079
    8    HD3  LYS 102           HD3      LYS 102 -38.762   1.105  -1.854
    9    HE2  LYS 102           HE2      LYS 102 -40.159   2.539  -0.442
   10    HE3  LYS 102           HE3      LYS 102 -41.532   1.460  -0.689
   11    HZ1  LYS 102           HZ1      LYS 102 -39.734  -0.218   0.309
   12    HZ3  LYS 102           HZ2      LYS 102 -40.869   0.630   1.245
   13    HZ2  LYS 102           HZ3      LYS 102 -39.282   1.216   1.098

  No H/Q in entry =          13
  In of MODEL   80
    1    H    ALA 103           H        ALA 103 -38.495   3.756  -6.672
    2    HA   ALA 103           HA       ALA 103 -38.791   6.073  -4.904
    3    HB2  ALA 103           HB1      ALA 103 -36.846   6.872  -6.504
    4    HB3  ALA 103           HB2      ALA 103 -36.747   5.154  -6.891
    5    HB1  ALA 103           HB3      ALA 103 -36.524   5.699  -5.228

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ALA 104           H        ALA 104 -39.415   5.294  -8.238
    2    HA   ALA 104           HA       ALA 104 -40.115   8.049  -8.874
    3    HB2  ALA 104           HB1      ALA 104 -40.153   7.364 -11.071
    4    HB1  ALA 104           HB2      ALA 104 -40.814   5.777 -10.675
    5    HB3  ALA 104           HB3      ALA 104 -39.101   6.109 -10.415

  No H/Q in entry =           5
  In of MODEL   80
    1    H    ALA 105           H        ALA 105 -41.622   5.895  -7.040
    2    HA   ALA 105           HA       ALA 105 -44.099   7.193  -6.999
    3    HB2  ALA 105           HB1      ALA 105 -44.830   6.291  -9.024
    4    HB3  ALA 105           HB2      ALA 105 -45.408   5.086  -7.873
    5    HB1  ALA 105           HB3      ALA 105 -43.934   4.789  -8.794

  No H/Q in entry =           5
  In of MODEL   81
    1    H1   ALA   1           H3       ALA   1 -12.502 -15.197  -2.434
    2    H2   ALA   1           H2       ALA   1 -11.583 -16.357  -3.274
    3    H3   ALA   1           H1       ALA   1 -12.703 -15.387  -4.109
    4    HA   ALA   1           HA       ALA   1 -14.138 -17.057  -3.878
    5    HB3  ALA   1           HB1      ALA   1 -12.782 -18.859  -3.416
    6    HB1  ALA   1           HB2      ALA   1 -13.541 -18.734  -1.829
    7    HB2  ALA   1           HB3      ALA   1 -11.949 -18.027  -2.103

  No H/Q in entry =           7
  In of MODEL   81
    1    H    GLU   2           H        GLU   2 -15.785 -17.880  -2.232
    2    HA   GLU   2           HA       GLU   2 -17.400 -16.127  -1.174
    3    HB2  GLU   2           HB2      GLU   2 -16.518 -18.576   0.368
    4    HB3  GLU   2           HB3      GLU   2 -18.024 -17.694   0.619
    5    HG2  GLU   2           HG2      GLU   2 -19.021 -18.755  -1.122
    6    HG3  GLU   2           HG3      GLU   2 -17.686 -18.381  -2.201

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLU   3           H        GLU   3 -15.526 -17.527   1.452
    2    HA   GLU   3           HA       GLU   3 -15.702 -15.173   3.014
    3    HB2  GLU   3           HB2      GLU   3 -14.173 -17.754   3.264
    4    HB3  GLU   3           HB3      GLU   3 -13.917 -16.442   4.415
    5    HG2  GLU   3           HG2      GLU   3 -16.116 -16.548   5.225
    6    HG3  GLU   3           HG3      GLU   3 -16.723 -17.332   3.772

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LEU   4           H        LEU   4 -12.775 -16.712   1.630
    2    HA   LEU   4           HA       LEU   4 -10.902 -14.850   2.239
    3    HB2  LEU   4           HB2      LEU   4 -11.151 -16.136  -0.490
    4    HB3  LEU   4           HB3      LEU   4  -9.686 -15.449   0.202
    5    HG   LEU   4           HG       LEU   4 -11.235 -17.816   1.304
    6   HD13  LEU   4          HD11      LEU   4  -9.629 -19.204   0.377
    7   HD12  LEU   4          HD12      LEU   4  -8.392 -17.948   0.357
    8   HD11  LEU   4          HD13      LEU   4  -9.677 -17.939  -0.850
    9   HD23  LEU   4          HD21      LEU   4  -8.991 -17.931   2.693
   10   HD22  LEU   4          HD22      LEU   4 -10.291 -16.864   3.220
   11   HD21  LEU   4          HD23      LEU   4  -8.911 -16.203   2.344

  No H/Q in entry =          11
  In of MODEL   81
    1    H    GLU   5           H        GLU   5 -13.222 -14.587  -0.443
    2    HA   GLU   5           HA       GLU   5 -12.162 -12.123  -1.434
    3    HB2  GLU   5           HB2      GLU   5 -13.528 -13.660  -2.818
    4    HB3  GLU   5           HB3      GLU   5 -14.924 -13.307  -1.800
    5    HG2  GLU   5           HG2      GLU   5 -14.796 -10.934  -2.406
    6    HG3  GLU   5           HG3      GLU   5 -13.365 -11.250  -3.388

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLU   6           H        GLU   6 -14.913 -12.947   0.646
    2    HA   GLU   6           HA       GLU   6 -15.761 -10.252   1.048
    3    HB2  GLU   6           HB2      GLU   6 -17.234 -12.210   1.437
    4    HB3  GLU   6           HB3      GLU   6 -16.215 -12.687   2.795
    5    HG2  GLU   6           HG2      GLU   6 -16.698 -10.565   3.930
    6    HG3  GLU   6           HG3      GLU   6 -17.680 -10.043   2.563

  No H/Q in entry =           6
  In of MODEL   81
    1    H    VAL   7           H        VAL   7 -13.506 -12.416   2.623
    2    HA   VAL   7           HA       VAL   7 -13.014 -10.857   4.956
    3    HB   VAL   7           HB       VAL   7 -11.350 -12.933   3.508
    4   HG11  VAL   7          HG11      VAL   7 -10.858 -11.417   6.077
    5   HG13  VAL   7          HG12      VAL   7  -9.757 -11.652   4.720
    6   HG12  VAL   7          HG13      VAL   7 -10.144 -13.003   5.785
    7   HG21  VAL   7          HG21      VAL   7 -13.616 -13.451   4.718
    8   HG23  VAL   7          HG22      VAL   7 -12.689 -13.201   6.198
    9   HG22  VAL   7          HG23      VAL   7 -12.219 -14.469   5.067

  No H/Q in entry =           9
  In of MODEL   81
    1    H    VAL   8           H        VAL   8 -11.493 -10.997   1.751
    2    HA   VAL   8           HA       VAL   8  -9.392  -9.170   2.256
    3    HB   VAL   8           HB       VAL   8 -10.861  -9.824  -0.310
    4   HG13  VAL   8          HG11      VAL   8  -9.876  -7.715  -0.722
    5   HG12  VAL   8          HG12      VAL   8  -8.665  -8.859  -1.302
    6   HG11  VAL   8          HG13      VAL   8  -8.463  -8.084   0.268
    7   HG23  VAL   8          HG21      VAL   8  -8.035 -10.653   0.126
    8   HG22  VAL   8          HG22      VAL   8  -9.378 -11.562  -0.561
    9   HG21  VAL   8          HG23      VAL   8  -9.204 -11.443   1.187

  No H/Q in entry =           9
  In of MODEL   81
    1    H    MET   9           H        MET   9 -12.724  -8.705   1.084
    2    HA   MET   9           HA       MET   9 -12.599  -5.930   0.656
    3    HB2  MET   9           HB2      MET   9 -14.845  -7.778   1.445
    4    HB3  MET   9           HB3      MET   9 -15.103  -6.039   1.291
    5    HG2  MET   9           HG2      MET   9 -14.267  -6.112  -1.025
    6    HG3  MET   9           HG3      MET   9 -13.992  -7.848  -0.874
    7    HE2  MET   9           HE1      MET   9 -17.908  -5.527  -0.933
    8    HE1  MET   9           HE2      MET   9 -16.297  -4.998  -0.456
    9    HE3  MET   9           HE3      MET   9 -17.289  -5.907   0.680

  No H/Q in entry =           9
  In of MODEL   81
    1    H    GLY  10           H        GLY  10 -13.313  -7.813   3.577
    2    HA3  GLY  10           HA2      GLY  10 -13.821  -5.621   5.298
    3    HA2  GLY  10           HA3      GLY  10 -13.293  -7.222   5.811

  No H/Q in entry =           3
  In of MODEL   81
    1    H    LEU  11           H        LEU  11 -10.846  -7.396   4.505
    2    HA   LEU  11           HA       LEU  11  -9.121  -6.003   6.271
    3    HB2  LEU  11           HB2      LEU  11  -8.595  -7.432   3.663
    4    HB3  LEU  11           HB3      LEU  11  -7.314  -6.757   4.667
    5    HG   LEU  11           HG       LEU  11  -9.363  -8.749   5.672
    6   HD13  LEU  11          HD11      LEU  11  -8.162 -10.008   4.109
    7   HD12  LEU  11          HD12      LEU  11  -7.238 -10.270   5.587
    8   HD11  LEU  11          HD13      LEU  11  -6.668  -9.114   4.384
    9   HD22  LEU  11          HD21      LEU  11  -8.496  -7.759   7.594
   10   HD21  LEU  11          HD22      LEU  11  -6.947  -7.388   6.838
   11   HD23  LEU  11          HD23      LEU  11  -7.310  -9.038   7.342

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  12           H        ILE  12  -9.999  -5.429   2.879
    2    HA   ILE  12           HA       ILE  12  -8.259  -3.235   2.464
    3    HB   ILE  12           HB       ILE  12 -10.921  -3.848   1.157
    4   HG12  ILE  12          HG12      ILE  12  -8.922  -5.542   1.085
    5   HG13  ILE  12          HG13      ILE  12  -9.764  -5.158  -0.403
    6   HG23  ILE  12          HG21      ILE  12 -10.323  -1.544   0.708
    7   HG22  ILE  12          HG22      ILE  12  -9.930  -2.472  -0.734
    8   HG21  ILE  12          HG23      ILE  12  -8.680  -1.999   0.379
    9   HD13  ILE  12          HD11      ILE  12  -8.001  -3.641  -1.055
   10   HD12  ILE  12          HD12      ILE  12  -7.255  -5.164  -0.577
   11   HD11  ILE  12          HD13      ILE  12  -7.226  -3.797   0.510

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  13           H        ILE  13 -11.629  -3.434   3.544
    2    HA   ILE  13           HA       ILE  13 -12.032  -0.639   3.818
    3    HB   ILE  13           HB       ILE  13 -13.292  -3.040   5.163
    4   HG12  ILE  13          HG12      ILE  13 -13.499  -2.456   2.628
    5   HG13  ILE  13          HG13      ILE  13 -14.931  -2.913   3.526
    6   HG22  ILE  13          HG21      ILE  13 -15.135  -1.427   5.808
    7   HG21  ILE  13          HG22      ILE  13 -14.047  -0.107   5.400
    8   HG23  ILE  13          HG23      ILE  13 -13.634  -1.215   6.706
    9   HD13  ILE  13          HD11      ILE  13 -15.636  -0.621   3.744
   10   HD12  ILE  13          HD12      ILE  13 -15.205  -0.888   2.066
   11   HD11  ILE  13          HD13      ILE  13 -14.088  -0.045   3.116

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ASN  14           H        ASN  14 -10.981  -3.156   6.091
    2    HA   ASN  14           HA       ASN  14 -10.756  -1.527   8.381
    3    HB2  ASN  14           HB2      ASN  14 -10.555  -4.139   8.055
    4    HB3  ASN  14           HB3      ASN  14  -8.838  -3.786   7.905
    5   HD21  ASN  14          HD21      ASN  14  -9.513  -5.301  10.075
    6   HD22  ASN  14          HD22      ASN  14  -9.472  -4.385  11.502

  No H/Q in entry =           6
  In of MODEL   81
    1    H    SER  15           H        SER  15  -8.361  -2.394   5.897
    2    HA   SER  15           HA       SER  15  -6.193  -0.946   6.981
    3    HB2  SER  15           HB2      SER  15  -5.167  -1.178   4.826
    4    HB3  SER  15           HB3      SER  15  -6.154  -2.619   5.044
    5    HG   SER  15           HG       SER  15  -7.709  -1.746   3.736

  No H/Q in entry =           5
  In of MODEL   81
    1    H    GLY  16           H        GLY  16  -8.768  -0.024   4.725
    2    HA3  GLY  16           HA2      GLY  16  -7.856   2.601   4.182
    3    HA2  GLY  16           HA3      GLY  16  -9.517   2.039   4.013

  No H/Q in entry =           3
  In of MODEL   81
    1    H    GLN  17           H        GLN  17 -10.085   1.319   6.659
    2    HA   GLN  17           HA       GLN  17 -10.748   3.835   7.802
    3    HB2  GLN  17           HB2      GLN  17 -11.026   0.999   8.559
    4    HB3  GLN  17           HB3      GLN  17 -10.914   2.115   9.920
    5    HG2  GLN  17           HG2      GLN  17 -13.266   1.642   8.928
    6    HG3  GLN  17           HG3      GLN  17 -12.824   3.319   9.248
    7   HE21  GLN  17          HE21      GLN  17 -14.607   3.613   7.478
    8   HE22  GLN  17          HE22      GLN  17 -14.074   3.607   5.866

  No H/Q in entry =           8
  In of MODEL   81
    1    H    ALA  18           H        ALA  18  -8.166   1.502   8.427
    2    HA   ALA  18           HA       ALA  18  -7.054   2.693  10.705
    3    HB2  ALA  18           HB1      ALA  18  -6.481   0.468   9.335
    4    HB3  ALA  18           HB2      ALA  18  -5.308   1.227  10.412
    5    HB1  ALA  18           HB3      ALA  18  -5.218   1.508   8.672

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ARG  19           H        ARG  19  -6.259   3.209   7.260
    2    HA   ARG  19           HA       ARG  19  -4.325   5.219   7.700
    3    HB2  ARG  19           HB2      ARG  19  -4.665   4.089   5.501
    4    HB3  ARG  19           HB3      ARG  19  -6.191   4.958   5.320
    5    HG2  ARG  19           HG2      ARG  19  -5.022   7.109   5.397
    6    HG3  ARG  19           HG3      ARG  19  -3.489   6.294   5.706
    7    HD2  ARG  19           HD2      ARG  19  -3.594   6.891   3.363
    8    HD3  ARG  19           HD3      ARG  19  -3.712   5.133   3.505
    9    HE   ARG  19           HE       ARG  19  -6.328   6.090   3.489
   10   HH21  ARG  19          HH11      ARG  19  -7.512   6.272   1.566
   11   HH22  ARG  19          HH12      ARG  19  -6.683   6.337   0.050
   12   HH11  ARG  19          HH21      ARG  19  -3.544   6.106   1.466
   13   HH12  ARG  19          HH22      ARG  19  -4.435   6.241  -0.006

  No H/Q in entry =          13
  In of MODEL   81
    1    H    SER  20           H        SER  20  -7.818   5.399   7.086
    2    HA   SER  20           HA       SER  20  -8.125   8.161   7.041
    3    HB2  SER  20           HB2      SER  20  -9.949   6.588   6.534
    4    HB3  SER  20           HB3      SER  20 -10.011   6.116   8.229
    5    HG   SER  20           HG       SER  20 -10.088   8.792   7.993

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LEU  21           H        LEU  21  -8.176   5.974   9.842
    2    HA   LEU  21           HA       LEU  21  -8.589   7.974  11.808
    3    HB2  LEU  21           HB2      LEU  21  -7.284   5.250  11.971
    4    HB3  LEU  21           HB3      LEU  21  -7.585   6.269  13.374
    5    HG   LEU  21           HG       LEU  21  -9.753   5.399  11.439
    6   HD13  LEU  21          HD11      LEU  21  -8.898   3.408  12.495
    7   HD12  LEU  21          HD12      LEU  21 -10.401   3.833  13.313
    8   HD11  LEU  21          HD13      LEU  21  -8.851   4.199  14.071
    9   HD21  LEU  21          HD21      LEU  21  -9.680   6.943  14.021
   10   HD23  LEU  21          HD22      LEU  21 -11.095   5.952  13.679
   11   HD22  LEU  21          HD23      LEU  21 -10.647   7.249  12.581

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ALA  22           H        ALA  22  -5.655   6.551  10.411
    2    HA   ALA  22           HA       ALA  22  -3.760   7.828  12.043
    3    HB2  ALA  22           HB1      ALA  22  -3.369   5.970  10.350
    4    HB1  ALA  22           HB2      ALA  22  -2.151   7.245  10.393
    5    HB3  ALA  22           HB3      ALA  22  -3.364   7.225   9.112

  No H/Q in entry =           5
  In of MODEL   81
    1    H    TYR  23           H        TYR  23  -5.045   8.874   8.857
    2    HA   TYR  23           HA       TYR  23  -3.665  11.346   8.797
    3    HB2  TYR  23           HB2      TYR  23  -4.754  10.454   6.800
    4    HB3  TYR  23           HB3      TYR  23  -6.334  10.592   7.574
    5    HD1  TYR  23           HD1      TYR  23  -3.386  12.579   6.438
    6    HD2  TYR  23           HD2      TYR  23  -7.533  12.626   7.551
    7    HE1  TYR  23           HE1      TYR  23  -3.561  14.934   5.678
    8    HE2  TYR  23           HE2      TYR  23  -7.710  14.981   6.790
    9    HH   TYR  23           HH       TYR  23  -4.933  16.644   5.305

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ALA  24           H        ALA  24  -6.807  10.421  10.161
    2    HA   ALA  24           HA       ALA  24  -7.602  13.024  10.933
    3    HB1  ALA  24           HB1      ALA  24  -9.444  11.804  11.390
    4    HB2  ALA  24           HB2      ALA  24  -8.634  11.215  12.841
    5    HB3  ALA  24           HB3      ALA  24  -8.519  10.304  11.336

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ALA  25           H        ALA  25  -5.650  10.528  12.512
    2    HA   ALA  25           HA       ALA  25  -5.301  11.770  15.017
    3    HB2  ALA  25           HB1      ALA  25  -4.572   9.407  14.195
    4    HB3  ALA  25           HB2      ALA  25  -3.547  10.245  15.362
    5    HB1  ALA  25           HB3      ALA  25  -3.104  10.223  13.655

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LEU  26           H        LEU  26  -3.492  12.043  11.985
    2    HA   LEU  26           HA       LEU  26  -1.506  13.827  12.913
    3    HB2  LEU  26           HB2      LEU  26  -1.215  12.673  10.809
    4    HB3  LEU  26           HB3      LEU  26  -2.673  13.408  10.149
    5    HG   LEU  26           HG       LEU  26  -1.620  15.640  10.293
    6   HD12  LEU  26          HD11      LEU  26   0.917  15.615  10.718
    7   HD11  LEU  26          HD12      LEU  26   0.662  14.037  11.459
    8   HD13  LEU  26          HD13      LEU  26  -0.123  15.465  12.134
    9   HD21  LEU  26          HD21      LEU  26   0.093  13.558   8.902
   10   HD23  LEU  26          HD22      LEU  26   0.082  15.280   8.534
   11   HD22  LEU  26          HD23      LEU  26  -1.357  14.308   8.238

  No H/Q in entry =          11
  In of MODEL   81
    1    H    LYS  27           H        LYS  27  -4.672  14.368  11.423
    2    HA   LYS  27           HA       LYS  27  -4.567  17.156  11.230
    3    HB2  LYS  27           HB2      LYS  27  -6.332  15.711  10.234
    4    HB3  LYS  27           HB3      LYS  27  -7.001  15.464  11.847
    5    HG2  LYS  27           HG2      LYS  27  -7.388  17.877  12.085
    6    HG3  LYS  27           HG3      LYS  27  -6.668  18.164  10.498
    7    HD2  LYS  27           HD2      LYS  27  -8.421  16.763   9.452
    8    HD3  LYS  27           HD3      LYS  27  -9.147  16.493  11.038
    9    HE2  LYS  27           HE2      LYS  27  -9.548  18.911  11.283
   10    HE3  LYS  27           HE3      LYS  27  -8.793  19.202   9.712
   11    HZ3  LYS  27           HZ1      LYS  27 -11.171  19.120   9.460
   12    HZ2  LYS  27           HZ2      LYS  27 -11.250  17.604  10.227
   13    HZ1  LYS  27           HZ3      LYS  27 -10.496  17.756   8.709

  No H/Q in entry =          13
  In of MODEL   81
    1    H    GLN  28           H        GLN  28  -5.505  15.081  13.949
    2    HA   GLN  28           HA       GLN  28  -6.372  17.098  15.725
    3    HB2  GLN  28           HB2      GLN  28  -5.019  14.441  16.269
    4    HB3  GLN  28           HB3      GLN  28  -5.749  15.457  17.515
    5    HG2  GLN  28           HG2      GLN  28  -7.216  14.363  15.098
    6    HG3  GLN  28           HG3      GLN  28  -7.297  13.676  16.720
    7   HE21  GLN  28          HE21      GLN  28  -9.099  15.541  14.727
    8   HE22  GLN  28          HE22      GLN  28  -9.846  16.562  15.858

  No H/Q in entry =           8
  In of MODEL   81
    1    H    ALA  29           H        ALA  29  -3.174  15.743  15.047
    2    HA   ALA  29           HA       ALA  29  -1.719  17.110  17.035
    3    HB1  ALA  29           HB1      ALA  29   0.203  16.384  15.923
    4    HB3  ALA  29           HB2      ALA  29  -0.542  16.526  14.330
    5    HB2  ALA  29           HB3      ALA  29  -0.994  15.199  15.401

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LYS  30           H        LYS  30  -2.545  18.012  13.703
    2    HA   LYS  30           HA       LYS  30  -1.086  20.423  13.613
    3    HB2  LYS  30           HB2      LYS  30  -3.628  19.603  12.192
    4    HB3  LYS  30           HB3      LYS  30  -2.762  21.101  11.855
    5    HG2  LYS  30           HG2      LYS  30  -0.717  19.767  11.347
    6    HG3  LYS  30           HG3      LYS  30  -1.655  18.290  11.585
    7    HD2  LYS  30           HD2      LYS  30  -3.198  18.965   9.786
    8    HD3  LYS  30           HD3      LYS  30  -2.282  20.455   9.549
    9    HE2  LYS  30           HE2      LYS  30  -0.275  19.122   8.976
   10    HE3  LYS  30           HE3      LYS  30  -1.209  17.637   9.181
   11    HZ2  LYS  30           HZ1      LYS  30  -1.005  18.509   6.841
   12    HZ1  LYS  30           HZ2      LYS  30  -2.024  19.792   7.308
   13    HZ3  LYS  30           HZ3      LYS  30  -2.583  18.187   7.374

  No H/Q in entry =          13
  In of MODEL   81
    1    H    GLN  31           H        GLN  31  -4.209  19.634  15.011
    2    HA   GLN  31           HA       GLN  31  -4.915  22.406  15.466
    3    HB2  GLN  31           HB2      GLN  31  -6.152  19.983  16.779
    4    HB3  GLN  31           HB3      GLN  31  -6.877  21.571  16.533
    5    HG2  GLN  31           HG2      GLN  31  -6.173  20.784  13.945
    6    HG3  GLN  31           HG3      GLN  31  -6.733  19.290  14.687
    7   HE21  GLN  31          HE21      GLN  31  -8.100  20.898  12.583
    8   HE22  GLN  31          HE22      GLN  31  -9.608  21.322  13.235

  No H/Q in entry =           8
  In of MODEL   81
    1    H    GLY  32           H        GLY  32  -2.651  20.426  16.791
    2    HA3  GLY  32           HA2      GLY  32  -1.247  20.853  18.599
    3    HA2  GLY  32           HA3      GLY  32  -2.351  22.119  19.121

  No H/Q in entry =           3
  In of MODEL   81
    1    H    ASP  33           H        ASP  33  -3.838  19.113  18.447
    2    HA   ASP  33           HA       ASP  33  -4.270  18.659  21.325
    3    HB2  ASP  33           HB2      ASP  33  -5.688  17.684  18.839
    4    HB3  ASP  33           HB3      ASP  33  -6.054  17.078  20.453

  No H/Q in entry =           4
  In of MODEL   81
    1    H    PHE  34           H        PHE  34  -2.122  17.759  21.636
    2    HA   PHE  34           HA       PHE  34  -1.166  15.491  20.234
    3    HB2  PHE  34           HB2      PHE  34  -0.539  16.456  23.033
    4    HB3  PHE  34           HB3      PHE  34   0.366  15.214  22.167
    5    HD1  PHE  34           HD1      PHE  34   0.267  18.641  22.909
    6    HD2  PHE  34           HD2      PHE  34   1.050  15.927  19.671
    7    HE1  PHE  34           HE1      PHE  34   1.606  20.386  21.764
    8    HE2  PHE  34           HE2      PHE  34   2.384  17.675  18.531
    9    HZ   PHE  34           HZ       PHE  34   2.664  19.901  19.582

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ALA  35           H        ALA  35  -3.211  15.807  23.090
    2    HA   ALA  35           HA       ALA  35  -3.062  13.139  23.981
    3    HB3  ALA  35           HB1      ALA  35  -5.508  13.818  24.830
    4    HB1  ALA  35           HB2      ALA  35  -4.937  15.425  24.380
    5    HB2  ALA  35           HB3      ALA  35  -4.048  14.478  25.573

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ALA  36           H        ALA  36  -5.469  14.715  21.875
    2    HA   ALA  36           HA       ALA  36  -6.936  12.337  21.387
    3    HB1  ALA  36           HB1      ALA  36  -8.356  13.794  20.428
    4    HB3  ALA  36           HB2      ALA  36  -7.170  14.191  19.185
    5    HB2  ALA  36           HB3      ALA  36  -7.180  15.076  20.711

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ALA  37           H        ALA  37  -4.214  13.868  19.732
    2    HA   ALA  37           HA       ALA  37  -4.207  12.238  17.431
    3    HB3  ALA  37           HB1      ALA  37  -2.182  13.901  18.865
    4    HB2  ALA  37           HB2      ALA  37  -2.705  13.973  17.184
    5    HB1  ALA  37           HB3      ALA  37  -1.581  12.716  17.706

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LYS  38           H        LYS  38  -2.469  11.885  20.515
    2    HA   LYS  38           HA       LYS  38  -1.196   9.457  20.025
    3    HB2  LYS  38           HB2      LYS  38  -1.488  11.221  22.173
    4    HB3  LYS  38           HB3      LYS  38  -2.143   9.705  22.784
    5    HG2  LYS  38           HG2      LYS  38  -0.073   8.539  22.252
    6    HG3  LYS  38           HG3      LYS  38   0.571   9.972  21.445
    7    HD2  LYS  38           HD2      LYS  38   0.760  11.182  23.483
    8    HD3  LYS  38           HD3      LYS  38  -0.288  10.052  24.344
    9    HE2  LYS  38           HE2      LYS  38   2.057   9.682  24.971
   10    HE3  LYS  38           HE3      LYS  38   1.425   8.282  24.101
   11    HZ3  LYS  38           HZ1      LYS  38   2.741   8.676  22.326
   12    HZ2  LYS  38           HZ2      LYS  38   3.710   9.480  23.468
   13    HZ1  LYS  38           HZ3      LYS  38   2.654  10.366  22.475

  No H/Q in entry =          13
  In of MODEL   81
    1    H    ALA  39           H        ALA  39  -4.428  10.021  21.416
    2    HA   ALA  39           HA       ALA  39  -5.051   7.314  21.912
    3    HB3  ALA  39           HB1      ALA  39  -7.163   9.308  21.141
    4    HB2  ALA  39           HB2      ALA  39  -6.266   9.511  22.647
    5    HB1  ALA  39           HB3      ALA  39  -7.214   8.048  22.376

  No H/Q in entry =           5
  In of MODEL   81
    1    H    MET  40           H        MET  40  -5.580   9.346  19.068
    2    HA   MET  40           HA       MET  40  -7.093   7.451  17.597
    3    HB2  MET  40           HB2      MET  40  -5.427   9.812  16.705
    4    HB3  MET  40           HB3      MET  40  -6.470   8.879  15.628
    5    HG2  MET  40           HG2      MET  40  -7.486  10.144  18.186
    6    HG3  MET  40           HG3      MET  40  -7.519  10.984  16.637
    7    HE3  MET  40           HE1      MET  40 -10.130   9.427  14.559
    8    HE2  MET  40           HE2      MET  40  -8.375   9.506  14.418
    9    HE1  MET  40           HE3      MET  40  -9.264  10.890  15.051

  No H/Q in entry =           9
  In of MODEL   81
    1    H    MET  41           H        MET  41  -3.587   8.111  17.735
    2    HA   MET  41           HA       MET  41  -2.859   6.345  15.633
    3    HB2  MET  41           HB2      MET  41  -1.238   6.970  18.114
    4    HB3  MET  41           HB3      MET  41  -0.629   6.313  16.599
    5    HG2  MET  41           HG2      MET  41  -1.734   8.523  15.596
    6    HG3  MET  41           HG3      MET  41  -1.491   9.101  17.243
    7    HE2  MET  41           HE1      MET  41   1.379   6.939  17.610
    8    HE1  MET  41           HE2      MET  41   0.615   8.247  18.509
    9    HE3  MET  41           HE3      MET  41   2.246   8.457  17.873

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ASP  42           H        ASP  42  -3.268   5.872  19.116
    2    HA   ASP  42           HA       ASP  42  -2.289   3.256  19.274
    3    HB2  ASP  42           HB2      ASP  42  -3.132   5.029  21.097
    4    HB3  ASP  42           HB3      ASP  42  -4.581   4.035  21.017

  No H/Q in entry =           4
  In of MODEL   81
    1    H    GLN  43           H        GLN  43  -5.596   4.433  18.763
    2    HA   GLN  43           HA       GLN  43  -6.794   1.871  18.557
    3    HB2  GLN  43           HB2      GLN  43  -7.656   4.546  17.432
    4    HB3  GLN  43           HB3      GLN  43  -8.650   3.088  17.402
    5    HG2  GLN  43           HG2      GLN  43  -8.370   2.954  19.910
    6    HG3  GLN  43           HG3      GLN  43  -7.610   4.543  19.846
    7   HE21  GLN  43          HE21      GLN  43  -9.793   4.666  21.338
    8   HE22  GLN  43          HE22      GLN  43 -11.138   5.273  20.502

  No H/Q in entry =           8
  In of MODEL   81
    1    H    SER  44           H        SER  44  -5.397   4.062  16.157
    2    HA   SER  44           HA       SER  44  -6.121   2.599  13.861
    3    HB2  SER  44           HB2      SER  44  -4.815   4.954  14.316
    4    HB3  SER  44           HB3      SER  44  -3.481   3.930  13.788
    5    HG   SER  44           HG       SER  44  -4.565   4.930  12.024

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ARG  45           H        ARG  45  -3.255   2.419  15.952
    2    HA   ARG  45           HA       ARG  45  -1.812   0.436  14.571
    3    HB2  ARG  45           HB2      ARG  45  -0.947   1.835  16.447
    4    HB3  ARG  45           HB3      ARG  45  -1.963   0.923  17.561
    5    HG2  ARG  45           HG2      ARG  45  -0.773  -1.161  16.918
    6    HG3  ARG  45           HG3      ARG  45   0.267  -0.225  15.846
    7    HD2  ARG  45           HD2      ARG  45   1.023   1.135  17.808
    8    HD3  ARG  45           HD3      ARG  45   0.073   0.077  18.875
    9    HE   ARG  45           HE       ARG  45   1.744  -1.551  17.297
   10   HH21  ARG  45          HH11      ARG  45   3.623  -2.416  18.140
   11   HH22  ARG  45          HH12      ARG  45   4.407  -1.651  19.477
   12   HH11  ARG  45          HH21      ARG  45   2.091   0.903  19.695
   13   HH12  ARG  45          HH22      ARG  45   3.539   0.231  20.355

  No H/Q in entry =          13
  In of MODEL   81
    1    H    MET  46           H        MET  46  -4.226   0.161  17.160
    2    HA   MET  46           HA       MET  46  -4.121  -2.642  17.460
    3    HB2  MET  46           HB2      MET  46  -6.265  -0.602  18.047
    4    HB3  MET  46           HB3      MET  46  -6.479  -2.317  18.407
    5    HG2  MET  46           HG2      MET  46  -4.450  -2.291  19.797
    6    HG3  MET  46           HG3      MET  46  -4.204  -0.591  19.428
    7    HE3  MET  46           HE1      MET  46  -4.814  -1.155  22.971
    8    HE2  MET  46           HE2      MET  46  -4.971   0.537  22.512
    9    HE1  MET  46           HE3      MET  46  -3.806  -0.488  21.682

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ALA  47           H        ALA  47  -6.087  -0.576  15.363
    2    HA   ALA  47           HA       ALA  47  -7.745  -2.587  14.285
    3    HB3  ALA  47           HB1      ALA  47  -8.374  -0.334  13.872
    4    HB1  ALA  47           HB2      ALA  47  -7.892  -0.974  12.301
    5    HB2  ALA  47           HB3      ALA  47  -6.792   0.068  13.205

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LEU  48           H        LEU  48  -4.594  -1.346  13.251
    2    HA   LEU  48           HA       LEU  48  -4.338  -2.936  10.906
    3    HB2  LEU  48           HB2      LEU  48  -2.261  -1.709  12.727
    4    HB3  LEU  48           HB3      LEU  48  -1.901  -2.433  11.159
    5    HG   LEU  48           HG       LEU  48  -3.875  -0.172  11.546
    6   HD13  LEU  48          HD11      LEU  48  -1.737   0.654  12.224
    7   HD12  LEU  48          HD12      LEU  48  -1.992   1.219  10.572
    8   HD11  LEU  48          HD13      LEU  48  -0.927  -0.153  10.882
    9   HD22  LEU  48          HD21      LEU  48  -4.360  -1.139   9.466
   10   HD21  LEU  48          HD22      LEU  48  -2.686  -1.612   9.177
   11   HD23  LEU  48          HD23      LEU  48  -3.166   0.079   9.020

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ASN  49           H        ASN  49  -3.317  -3.366  14.256
    2    HA   ASN  49           HA       ASN  49  -1.765  -5.664  13.926
    3    HB2  ASN  49           HB2      ASN  49  -1.759  -4.344  15.977
    4    HB3  ASN  49           HB3      ASN  49  -3.436  -4.767  16.290
    5   HD21  ASN  49          HD21      ASN  49  -0.199  -6.251  15.925
    6   HD22  ASN  49          HD22      ASN  49  -0.518  -7.563  16.954

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLU  50           H        GLU  50  -5.229  -5.310  14.583
    2    HA   GLU  50           HA       GLU  50  -5.808  -8.097  14.681
    3    HB2  GLU  50           HB2      GLU  50  -7.357  -6.375  15.555
    4    HB3  GLU  50           HB3      GLU  50  -7.630  -5.799  13.909
    5    HG2  GLU  50           HG2      GLU  50  -8.544  -7.973  13.261
    6    HG3  GLU  50           HG3      GLU  50  -8.185  -8.630  14.854

  No H/Q in entry =           6
  In of MODEL   81
    1    H    ALA  51           H        ALA  51  -5.807  -5.690  12.092
    2    HA   ALA  51           HA       ALA  51  -6.825  -7.388  10.060
    3    HB3  ALA  51           HB1      ALA  51  -6.555  -5.578   8.697
    4    HB1  ALA  51           HB2      ALA  51  -4.910  -5.270   9.254
    5    HB2  ALA  51           HB3      ALA  51  -6.286  -4.728  10.218

  No H/Q in entry =           5
  In of MODEL   81
    1    H    HIS  52           H        HIS  52  -3.517  -6.564  11.061
    2    HA   HIS  52           HA       HIS  52  -2.146  -8.081   9.114
    3    HB2  HIS  52           HB2      HIS  52  -1.100  -6.367  10.593
    4    HB3  HIS  52           HB3      HIS  52  -1.259  -7.485  11.946
    5    HD1  HIS  52           HD1      HIS  52   0.208  -9.657  11.888
    6    HD2  HIS  52           HD2      HIS  52   0.973  -6.994   8.773
    7    HE1  HIS  52           HE1      HIS  52   2.384 -10.401  10.828
    8    HE2  HIS  52           HE2      HIS  52   2.864  -8.788   8.927

  No H/Q in entry =           8
  In of MODEL   81
    1    H    LEU  53           H        LEU  53  -3.394  -8.938  12.318
    2    HA   LEU  53           HA       LEU  53  -2.260 -11.511  12.510
    3    HB2  LEU  53           HB2      LEU  53  -4.722 -10.274  13.716
    4    HB3  LEU  53           HB3      LEU  53  -4.303 -11.960  14.006
    5    HG   LEU  53           HG       LEU  53  -2.349  -9.688  14.493
    6   HD13  LEU  53          HD11      LEU  53  -4.307  -9.336  15.919
    7   HD12  LEU  53          HD12      LEU  53  -2.960  -9.926  16.891
    8   HD11  LEU  53          HD13      LEU  53  -4.260 -11.018  16.434
    9   HD23  LEU  53          HD21      LEU  53  -1.523 -11.521  16.180
   10   HD22  LEU  53          HD22      LEU  53  -1.119 -11.694  14.475
   11   HD21  LEU  53          HD23      LEU  53  -2.427 -12.638  15.163

  No H/Q in entry =          11
  In of MODEL   81
    1    H    VAL  54           H        VAL  54  -5.338 -10.401  11.136
    2    HA   VAL  54           HA       VAL  54  -6.314 -12.969  10.437
    3    HB   VAL  54           HB       VAL  54  -6.887 -10.217   9.308
    4   HG12  VAL  54          HG11      VAL  54  -9.019 -11.540   8.483
    5   HG11  VAL  54          HG12      VAL  54  -7.942 -12.933   8.556
    6   HG13  VAL  54          HG13      VAL  54  -7.543 -11.565   7.519
    7   HG22  VAL  54          HG21      VAL  54  -7.804 -10.239  11.455
    8   HG21  VAL  54          HG22      VAL  54  -8.102 -11.975  11.430
    9   HG23  VAL  54          HG23      VAL  54  -9.152 -10.889  10.522

  No H/Q in entry =           9
  In of MODEL   81
    1    H    GLN  55           H        GLN  55  -4.373 -10.560   8.664
    2    HA   GLN  55           HA       GLN  55  -4.268 -12.021   6.243
    3    HB2  GLN  55           HB2      GLN  55  -3.606  -9.772   6.062
    4    HB3  GLN  55           HB3      GLN  55  -2.504  -9.880   7.432
    5    HG2  GLN  55           HG2      GLN  55  -0.803 -10.766   6.161
    6    HG3  GLN  55           HG3      GLN  55  -1.897 -11.710   5.160
    7   HE21  GLN  55          HE21      GLN  55  -1.886 -11.014   3.040
    8   HE22  GLN  55          HE22      GLN  55  -1.645  -9.414   2.536

  No H/Q in entry =           8
  In of MODEL   81
    1    H    THR  56           H        THR  56  -2.176 -12.062   9.133
    2    HA   THR  56           HA       THR  56  -0.135 -13.710   8.220
    3    HB   THR  56           HB       THR  56  -1.397 -13.932  10.962
    4    HG1  THR  56           HG1      THR  56  -0.132 -11.867   9.717
    5   HG21  THR  56          HG21      THR  56   1.393 -14.401   9.882
    6   HG23  THR  56          HG22      THR  56   0.295 -15.612  10.545
    7   HG22  THR  56          HG23      THR  56   0.991 -14.381  11.599

  No H/Q in entry =           7
  In of MODEL   81
    1    H    LYS  57           H        LYS  57  -3.287 -14.670   9.566
    2    HA   LYS  57           HA       LYS  57  -2.912 -17.476   9.314
    3    HB2  LYS  57           HB2      LYS  57  -4.709 -16.333  10.652
    4    HB3  LYS  57           HB3      LYS  57  -5.484 -15.875   9.143
    5    HG2  LYS  57           HG2      LYS  57  -5.823 -18.209   8.549
    6    HG3  LYS  57           HG3      LYS  57  -4.929 -18.736   9.972
    7    HD2  LYS  57           HD2      LYS  57  -7.233 -18.940  10.559
    8    HD3  LYS  57           HD3      LYS  57  -6.678 -17.472  11.362
    9    HE2  LYS  57           HE2      LYS  57  -7.677 -16.074   9.663
   10    HE3  LYS  57           HE3      LYS  57  -8.034 -17.462   8.637
   11    HZ1  LYS  57           HZ1      LYS  57  -9.119 -17.702  11.281
   12    HZ3  LYS  57           HZ2      LYS  57  -9.873 -17.910   9.772
   13    HZ2  LYS  57           HZ3      LYS  57  -9.721 -16.355  10.441

  No H/Q in entry =          13
  In of MODEL   81
    1    H    LEU  58           H        LEU  58  -4.170 -14.994   7.139
    2    HA   LEU  58           HA       LEU  58  -5.010 -16.791   5.124
    3    HB2  LEU  58           HB2      LEU  58  -4.326 -13.859   5.000
    4    HB3  LEU  58           HB3      LEU  58  -5.007 -14.775   3.654
    5    HG   LEU  58           HG       LEU  58  -6.295 -14.570   6.397
    6   HD11  LEU  58          HD11      LEU  58  -6.541 -12.909   3.909
    7   HD13  LEU  58          HD12      LEU  58  -6.525 -12.406   5.599
    8   HD12  LEU  58          HD13      LEU  58  -7.965 -13.160   4.918
    9   HD22  LEU  58          HD21      LEU  58  -7.303 -16.451   5.517
   10   HD21  LEU  58          HD22      LEU  58  -6.944 -16.003   3.849
   11   HD23  LEU  58          HD23      LEU  58  -8.292 -15.245   4.696

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  59           H        ILE  59  -1.848 -15.665   6.003
    2    HA   ILE  59           HA       ILE  59  -0.757 -16.414   3.370
    3    HB   ILE  59           HB       ILE  59   0.058 -14.373   4.948
    4   HG12  ILE  59          HG12      ILE  59   2.111 -16.075   3.522
    5   HG13  ILE  59          HG13      ILE  59   0.947 -15.100   2.663
    6   HG23  ILE  59          HG21      ILE  59   1.885 -14.910   6.345
    7   HG22  ILE  59          HG22      ILE  59   2.084 -16.500   5.644
    8   HG21  ILE  59          HG23      ILE  59   0.729 -16.165   6.720
    9   HD12  ILE  59          HD11      ILE  59   3.125 -13.929   3.018
   10   HD11  ILE  59          HD12      ILE  59   2.835 -14.015   4.753
   11   HD13  ILE  59          HD13      ILE  59   1.758 -13.071   3.724

  No H/Q in entry =          11
  In of MODEL   81
    1    H    GLU  60           H        GLU  60  -0.813 -17.528   6.734
    2    HA   GLU  60           HA       GLU  60   1.167 -19.558   6.474
    3    HB2  GLU  60           HB2      GLU  60   0.424 -18.769   8.663
    4    HB3  GLU  60           HB3      GLU  60  -1.205 -19.363   8.349
    5    HG2  GLU  60           HG2      GLU  60  -0.343 -21.672   8.209
    6    HG3  GLU  60           HG3      GLU  60   1.291 -21.082   8.500

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLY  61           H        GLY  61  -2.342 -19.563   5.970
    2    HA3  GLY  61           HA2      GLY  61  -2.163 -22.358   5.006
    3    HA2  GLY  61           HA3      GLY  61  -3.631 -21.586   5.594

  No H/Q in entry =           3
  In of MODEL   81
    1    H    ASP  62           H        ASP  62  -1.353 -20.053   3.409
    2    HA   ASP  62           HA       ASP  62  -3.403 -19.440   1.517
    3    HB2  ASP  62           HB2      ASP  62  -1.518 -17.934   1.929
    4    HB3  ASP  62           HB3      ASP  62  -0.394 -19.163   1.358

  No H/Q in entry =           4
  In of MODEL   81
    1    H    ALA  63           H        ALA  63  -4.192 -20.749  -0.046
    2    HA   ALA  63           HA       ALA  63  -2.386 -22.426  -1.614
    3    HB3  ALA  63           HB1      ALA  63  -3.881 -24.438  -1.257
    4    HB2  ALA  63           HB2      ALA  63  -4.529 -23.590   0.146
    5    HB1  ALA  63           HB3      ALA  63  -2.818 -24.017   0.088

  No H/Q in entry =           5
  In of MODEL   81
    1    H    GLY  64           H        GLY  64  -5.771 -23.134  -1.245
    2    HA3  GLY  64           HA2      GLY  64  -7.622 -22.304  -2.477
    3    HA2  GLY  64           HA3      GLY  64  -6.507 -21.509  -3.575

  No H/Q in entry =           3
  In of MODEL   81
    1    H    GLU  65           H        GLU  65  -6.645 -22.367  -5.568
    2    HA   GLU  65           HA       GLU  65  -7.915 -24.716  -6.245
    3    HB2  GLU  65           HB2      GLU  65  -5.705 -23.253  -7.683
    4    HB3  GLU  65           HB3      GLU  65  -6.603 -24.598  -8.389
    5    HG2  GLU  65           HG2      GLU  65  -8.704 -23.389  -8.120
    6    HG3  GLU  65           HG3      GLU  65  -7.872 -22.070  -7.302

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLY  66           H        GLY  66  -6.913 -26.532  -7.464
    2    HA3  GLY  66           HA2      GLY  66  -5.458 -28.211  -5.746
    3    HA2  GLY  66           HA3      GLY  66  -5.828 -28.530  -7.429

  No H/Q in entry =           3
  In of MODEL   81
    1    H    LYS  67           H        LYS  67  -4.427 -26.264  -8.473
    2    HA   LYS  67           HA       LYS  67  -1.827 -27.417  -8.685
    3    HB2  LYS  67           HB2      LYS  67  -3.072 -24.934  -9.852
    4    HB3  LYS  67           HB3      LYS  67  -1.435 -25.477 -10.238
    5    HG2  LYS  67           HG2      LYS  67  -2.313 -27.657 -10.969
    6    HG3  LYS  67           HG3      LYS  67  -3.949 -27.145 -10.562
    7    HD2  LYS  67           HD2      LYS  67  -3.798 -25.336 -12.238
    8    HD3  LYS  67           HD3      LYS  67  -2.164 -25.862 -12.651
    9    HE2  LYS  67           HE2      LYS  67  -3.044 -28.082 -13.293
   10    HE3  LYS  67           HE3      LYS  67  -4.677 -27.544 -12.899
   11    HZ2  LYS  67           HZ1      LYS  67  -2.971 -26.820 -15.157
   12    HZ1  LYS  67           HZ2      LYS  67  -3.999 -25.619 -14.537
   13    HZ3  LYS  67           HZ3      LYS  67  -4.645 -27.083 -15.104

  No H/Q in entry =          13
  In of MODEL   81
    1    H    MET  68           H        MET  68   0.170 -26.301  -8.519
    2    HA   MET  68           HA       MET  68   0.877 -25.515  -5.994
    3    HB2  MET  68           HB2      MET  68   2.189 -24.772  -8.611
    4    HB3  MET  68           HB3      MET  68   2.952 -24.639  -7.026
    5    HG2  MET  68           HG2      MET  68   1.844 -27.205  -8.201
    6    HG3  MET  68           HG3      MET  68   3.552 -26.760  -8.185
    7    HE1  MET  68           HE1      MET  68   4.856 -26.217  -6.404
    8    HE3  MET  68           HE2      MET  68   4.809 -26.942  -4.798
    9    HE2  MET  68           HE3      MET  68   3.960 -25.428  -5.100

  No H/Q in entry =           9
  In of MODEL   81
    1    H    LYS  69           H        LYS  69  -1.144 -23.688  -7.838
    2    HA   LYS  69           HA       LYS  69  -0.101 -21.082  -7.480
    3    HB2  LYS  69           HB2      LYS  69  -2.969 -21.856  -7.955
    4    HB3  LYS  69           HB3      LYS  69  -2.248 -20.263  -8.208
    5    HG2  LYS  69           HG2      LYS  69  -1.250 -22.778  -9.566
    6    HG3  LYS  69           HG3      LYS  69  -2.415 -21.676 -10.299
    7    HD2  LYS  69           HD2      LYS  69  -0.676 -19.826  -9.808
    8    HD3  LYS  69           HD3      LYS  69   0.465 -21.152  -9.581
    9    HE2  LYS  69           HE2      LYS  69  -0.015 -21.992 -11.830
   10    HE3  LYS  69           HE3      LYS  69  -1.229 -20.735 -12.060
   11    HZ3  LYS  69           HZ1      LYS  69   0.364 -19.088 -12.148
   12    HZ2  LYS  69           HZ2      LYS  69   1.124 -20.363 -12.975
   13    HZ1  LYS  69           HZ3      LYS  69   1.543 -20.022 -11.364

  No H/Q in entry =          13
  In of MODEL   81
    1    H    VAL  70           H        VAL  70  -1.208 -19.286  -6.330
    2    HA   VAL  70           HA       VAL  70  -2.162 -20.105  -3.642
    3    HB   VAL  70           HB       VAL  70  -0.945 -18.135  -2.744
    4   HG11  VAL  70          HG11      VAL  70   0.663 -20.176  -4.296
    5   HG13  VAL  70          HG12      VAL  70   0.203 -20.236  -2.593
    6   HG12  VAL  70          HG13      VAL  70   1.390 -19.054  -3.145
    7   HG21  VAL  70          HG21      VAL  70   0.032 -17.889  -5.616
    8   HG23  VAL  70          HG22      VAL  70   0.789 -17.069  -4.253
    9   HG22  VAL  70          HG23      VAL  70  -0.872 -16.685  -4.694

  No H/Q in entry =           9
  In of MODEL   81
    1    H    SER  71           H        SER  71  -3.345 -18.343  -2.536
    2    HA   SER  71           HA       SER  71  -5.506 -17.357  -4.064
    3    HB2  SER  71           HB2      SER  71  -5.457 -17.744  -1.536
    4    HB3  SER  71           HB3      SER  71  -4.562 -16.233  -1.410
    5    HG   SER  71           HG       SER  71  -6.571 -15.516  -1.299

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LEU  72           H        LEU  72  -5.471 -15.809  -5.498
    2    HA   LEU  72           HA       LEU  72  -3.316 -14.050  -5.965
    3    HB2  LEU  72           HB2      LEU  72  -6.180 -14.014  -6.920
    4    HB3  LEU  72           HB3      LEU  72  -4.937 -12.905  -7.496
    5    HG   LEU  72           HG       LEU  72  -4.651 -15.926  -7.616
    6   HD13  LEU  72          HD11      LEU  72  -6.563 -15.189  -8.993
    7   HD12  LEU  72          HD12      LEU  72  -5.217 -15.701 -10.011
    8   HD11  LEU  72          HD13      LEU  72  -5.538 -13.984  -9.773
    9   HD23  LEU  72          HD21      LEU  72  -3.038 -15.131  -9.521
   10   HD22  LEU  72          HD22      LEU  72  -2.481 -15.001  -7.862
   11   HD21  LEU  72          HD23      LEU  72  -3.090 -13.576  -8.698

  No H/Q in entry =          11
  In of MODEL   81
    1    H    VAL  73           H        VAL  73  -6.406 -13.621  -4.346
    2    HA   VAL  73           HA       VAL  73  -6.383 -10.851  -3.985
    3    HB   VAL  73           HB       VAL  73  -8.110 -11.174  -2.400
    4   HG13  VAL  73          HG11      VAL  73  -9.564 -12.782  -3.543
    5   HG12  VAL  73          HG12      VAL  73  -8.166 -13.514  -4.327
    6   HG11  VAL  73          HG13      VAL  73  -8.636 -11.861  -4.727
    7   HG23  VAL  73          HG21      VAL  73  -8.455 -13.700  -1.660
    8   HG22  VAL  73          HG22      VAL  73  -7.348 -12.649  -0.777
    9   HG21  VAL  73          HG23      VAL  73  -6.720 -13.794  -1.962

  No H/Q in entry =           9
  In of MODEL   81
    1    H    LEU  74           H        LEU  74  -4.511 -13.272  -2.403
    2    HA   LEU  74           HA       LEU  74  -4.081 -12.150   0.126
    3    HB2  LEU  74           HB2      LEU  74  -3.350 -14.384  -0.372
    4    HB3  LEU  74           HB3      LEU  74  -2.283 -13.800  -1.648
    5    HG   LEU  74           HG       LEU  74  -0.965 -12.556   0.054
    6   HD12  LEU  74          HD11      LEU  74  -1.435 -13.343   2.475
    7   HD11  LEU  74          HD12      LEU  74  -3.032 -13.794   1.876
    8   HD13  LEU  74          HD13      LEU  74  -2.505 -12.112   1.802
    9   HD22  LEU  74          HD21      LEU  74   0.242 -14.424   0.663
   10   HD21  LEU  74          HD22      LEU  74  -0.749 -15.064  -0.627
   11   HD23  LEU  74          HD23      LEU  74  -1.201 -15.364   1.035

  No H/Q in entry =          11
  In of MODEL   81
    1    H    VAL  75           H        VAL  75  -2.170 -11.794  -2.823
    2    HA   VAL  75           HA       VAL  75  -0.328  -9.919  -1.799
    3    HB   VAL  75           HB       VAL  75  -1.285 -10.369  -4.627
    4   HG12  VAL  75          HG11      VAL  75   0.807  -9.107  -5.239
    5   HG11  VAL  75          HG12      VAL  75   1.023  -8.719  -3.540
    6   HG13  VAL  75          HG13      VAL  75  -0.371  -8.098  -4.408
    7   HG21  VAL  75          HG21      VAL  75  -0.065 -12.212  -3.326
    8   HG23  VAL  75          HG22      VAL  75   1.329 -11.131  -3.296
    9   HG22  VAL  75          HG23      VAL  75   0.694 -11.710  -4.837

  No H/Q in entry =           9
  In of MODEL   81
    1    H    GLU  76           H        GLU  76  -3.463  -9.487  -3.467
    2    HA   GLU  76           HA       GLU  76  -3.444  -6.672  -3.559
    3    HB2  GLU  76           HB2      GLU  76  -5.134  -8.052  -4.737
    4    HB3  GLU  76           HB3      GLU  76  -5.800  -8.560  -3.192
    5    HG2  GLU  76           HG2      GLU  76  -7.221  -6.809  -4.037
    6    HG3  GLU  76           HG3      GLU  76  -6.319  -6.125  -2.699

  No H/Q in entry =           6
  In of MODEL   81
    1    H    ALA  77           H        ALA  77  -4.620  -8.880  -1.031
    2    HA   ALA  77           HA       ALA  77  -5.532  -6.861   0.732
    3    HB1  ALA  77           HB1      ALA  77  -4.415  -9.495   1.672
    4    HB2  ALA  77           HB2      ALA  77  -5.952  -9.411   0.811
    5    HB3  ALA  77           HB3      ALA  77  -5.752  -8.560   2.342

  No H/Q in entry =           5
  In of MODEL   81
    1    H    GLN  78           H        GLN  78  -2.423  -8.488   0.373
    2    HA   GLN  78           HA       GLN  78  -1.145  -7.368   2.631
    3    HB2  GLN  78           HB2      GLN  78  -0.330  -9.325   1.268
    4    HB3  GLN  78           HB3      GLN  78   0.144  -8.183   0.013
    5    HG2  GLN  78           HG2      GLN  78   1.625  -7.038   1.613
    6    HG3  GLN  78           HG3      GLN  78   1.154  -8.177   2.871
    7   HE21  GLN  78          HE21      GLN  78   3.890  -7.945   2.010
    8   HE22  GLN  78          HE22      GLN  78   4.319  -9.391   1.230

  No H/Q in entry =           8
  In of MODEL   81
    1    H    LEU  79           H        LEU  79  -1.472  -6.286  -0.713
    2    HA   LEU  79           HA       LEU  79   0.271  -4.103  -0.685
    3    HB2  LEU  79           HB2      LEU  79  -0.769  -4.876  -2.746
    4    HB3  LEU  79           HB3      LEU  79  -2.364  -4.445  -2.141
    5    HG   LEU  79           HG       LEU  79  -1.759  -2.073  -2.105
    6   HD13  LEU  79          HD11      LEU  79   0.485  -1.889  -1.584
    7   HD12  LEU  79          HD12      LEU  79   0.548  -1.597  -3.321
    8   HD11  LEU  79          HD13      LEU  79   0.959  -3.189  -2.679
    9   HD23  LEU  79          HD21      LEU  79  -1.110  -1.882  -4.654
   10   HD22  LEU  79          HD22      LEU  79  -2.657  -2.591  -4.203
   11   HD21  LEU  79          HD23      LEU  79  -1.310  -3.634  -4.647

  No H/Q in entry =          11
  In of MODEL   81
    1    H    HIS  80           H        HIS  80  -3.202  -4.178   0.128
    2    HA   HIS  80           HA       HIS  80  -3.324  -1.420   0.801
    3    HB2  HIS  80           HB2      HIS  80  -5.089  -3.785   1.105
    4    HB3  HIS  80           HB3      HIS  80  -5.378  -2.441   2.213
    5    HD1  HIS  80           HD1      HIS  80  -6.949  -0.759   1.306
    6    HD2  HIS  80           HD2      HIS  80  -4.793  -2.617  -1.741
    7    HE1  HIS  80           HE1      HIS  80  -7.754   0.268  -0.873
    8    HE2  HIS  80           HE2      HIS  80  -6.447  -0.859  -2.739

  No H/Q in entry =           8
  In of MODEL   81
    1    H    LEU  81           H        LEU  81  -2.918  -4.334   2.785
    2    HA   LEU  81           HA       LEU  81  -2.879  -2.997   5.275
    3    HB2  LEU  81           HB2      LEU  81  -1.727  -5.641   4.390
    4    HB3  LEU  81           HB3      LEU  81  -1.693  -5.089   6.065
    5    HG   LEU  81           HG       LEU  81  -4.238  -5.268   4.428
    6   HD12  LEU  81          HD11      LEU  81  -4.601  -7.331   5.967
    7   HD11  LEU  81          HD12      LEU  81  -2.849  -7.307   6.159
    8   HD13  LEU  81          HD13      LEU  81  -3.557  -7.513   4.557
    9   HD23  LEU  81          HD21      LEU  81  -5.095  -5.458   6.925
   10   HD22  LEU  81          HD22      LEU  81  -4.726  -3.876   6.242
   11   HD21  LEU  81          HD23      LEU  81  -3.564  -4.671   7.304

  No H/Q in entry =          11
  In of MODEL   81
    1    H    MET  82           H        MET  82  -0.215  -3.964   3.110
    2    HA   MET  82           HA       MET  82   1.885  -3.132   4.804
    3    HB2  MET  82           HB2      MET  82   1.671  -3.457   1.810
    4    HB3  MET  82           HB3      MET  82   3.165  -2.929   2.581
    5    HG2  MET  82           HG2      MET  82   1.687  -5.482   3.291
    6    HG3  MET  82           HG3      MET  82   3.065  -5.405   2.196
    7    HE3  MET  82           HE1      MET  82   6.092  -4.758   4.192
    8    HE2  MET  82           HE2      MET  82   5.208  -3.364   3.576
    9    HE1  MET  82           HE3      MET  82   5.260  -4.853   2.635

  No H/Q in entry =           9
  In of MODEL   81
    1    H    THR  83           H        THR  83   0.117  -1.432   2.247
    2    HA   THR  83           HA       THR  83   1.594   0.977   2.347
    3    HB   THR  83           HB       THR  83  -0.552   1.964   1.357
    4    HG1  THR  83           HG1      THR  83  -2.237   0.713   1.240
    5   HG22  THR  83          HG21      THR  83  -0.325   0.146  -0.649
    6   HG21  THR  83          HG22      THR  83   1.164  -0.190   0.232
    7   HG23  THR  83          HG23      THR  83   0.849   1.435  -0.379

  No H/Q in entry =           7
  In of MODEL   81
    1    H    SER  84           H        SER  84  -1.444   0.021   3.934
    2    HA   SER  84           HA       SER  84  -1.879   2.459   5.286
    3    HB2  SER  84           HB2      SER  84  -2.791  -0.357   5.838
    4    HB3  SER  84           HB3      SER  84  -3.251   0.993   6.874
    5    HG   SER  84           HG       SER  84  -3.708   0.702   4.079

  No H/Q in entry =           5
  In of MODEL   81
    1    H    MET  85           H        MET  85  -0.254  -0.523   6.411
    2    HA   MET  85           HA       MET  85   0.282   0.380   9.020
    3    HB2  MET  85           HB2      MET  85   0.513  -1.967   8.344
    4    HB3  MET  85           HB3      MET  85   1.902  -1.543   7.344
    5    HG2  MET  85           HG2      MET  85   3.109  -0.742   9.336
    6    HG3  MET  85           HG3      MET  85   1.715  -1.130  10.343
    7    HE1  MET  85           HE1      MET  85   4.944  -2.245   8.847
    8    HE3  MET  85           HE2      MET  85   3.921  -2.745   7.501
    9    HE2  MET  85           HE3      MET  85   4.766  -3.959   8.455

  No H/Q in entry =           9
  In of MODEL   81
    1    H    LEU  86           H        LEU  86   2.233   0.593   6.076
    2    HA   LEU  86           HA       LEU  86   4.479   1.837   7.244
    3    HB2  LEU  86           HB2      LEU  86   4.266   0.769   4.931
    4    HB3  LEU  86           HB3      LEU  86   3.501   2.274   4.421
    5    HG   LEU  86           HG       LEU  86   5.559   3.460   5.412
    6   HD11  LEU  86          HD11      LEU  86   6.189   0.827   6.205
    7   HD13  LEU  86          HD12      LEU  86   7.232   2.243   6.311
    8   HD12  LEU  86          HD13      LEU  86   7.317   1.197   4.896
    9   HD23  LEU  86          HD21      LEU  86   6.235   1.685   3.058
   10   HD22  LEU  86          HD22      LEU  86   6.674   3.370   3.327
   11   HD21  LEU  86          HD23      LEU  86   5.011   2.949   2.921

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ALA  87           H        ALA  87   1.608   3.167   5.654
    2    HA   ALA  87           HA       ALA  87   2.277   5.879   5.749
    3    HB1  ALA  87           HB1      ALA  87  -0.074   4.318   5.195
    4    HB3  ALA  87           HB2      ALA  87   0.284   5.971   4.701
    5    HB2  ALA  87           HB3      ALA  87  -0.523   5.666   6.241

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ARG  88           H        ARG  88   0.524   3.917   8.127
    2    HA   ARG  88           HA       ARG  88   0.064   5.974   9.978
    3    HB2  ARG  88           HB2      ARG  88  -0.940   3.648  10.034
    4    HB3  ARG  88           HB3      ARG  88   0.584   3.103  10.743
    5    HG2  ARG  88           HG2      ARG  88   0.160   5.185  12.369
    6    HG3  ARG  88           HG3      ARG  88  -1.514   4.908  11.906
    7    HD2  ARG  88           HD2      ARG  88  -1.677   3.058  13.146
    8    HD3  ARG  88           HD3      ARG  88  -0.102   2.434  12.618
    9    HE   ARG  88           HE       ARG  88  -0.609   3.704  15.075
   10   HH21  ARG  88          HH11      ARG  88   0.972   4.669  16.322
   11   HH22  ARG  88          HH12      ARG  88   2.505   5.055  15.623
   12   HH11  ARG  88          HH21      ARG  88   1.684   3.831  12.506
   13   HH12  ARG  88          HH22      ARG  88   2.916   4.564  13.475

  No H/Q in entry =          13
  In of MODEL   81
    1    H    GLU  89           H        GLU  89   2.798   3.679   9.757
    2    HA   GLU  89           HA       GLU  89   4.076   4.526  12.108
    3    HB2  GLU  89           HB2      GLU  89   4.684   2.494  10.760
    4    HB3  GLU  89           HB3      GLU  89   5.493   3.570   9.620
    5    HG2  GLU  89           HG2      GLU  89   6.995   4.370  11.371
    6    HG3  GLU  89           HG3      GLU  89   6.130   3.433  12.585

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LEU  90           H        LEU  90   4.436   5.685   8.785
    2    HA   LEU  90           HA       LEU  90   6.418   7.630   9.383
    3    HB2  LEU  90           HB2      LEU  90   4.412   7.360   7.148
    4    HB3  LEU  90           HB3      LEU  90   5.676   8.597   7.178
    5    HG   LEU  90           HG       LEU  90   6.269   5.642   7.505
    6   HD12  LEU  90          HD11      LEU  90   7.031   5.862   5.068
    7   HD11  LEU  90          HD12      LEU  90   6.056   7.330   5.021
    8   HD13  LEU  90          HD13      LEU  90   5.292   5.776   5.356
    9   HD22  LEU  90          HD21      LEU  90   8.194   6.738   8.197
   10   HD21  LEU  90          HD22      LEU  90   7.886   8.155   7.193
   11   HD23  LEU  90          HD23      LEU  90   8.508   6.675   6.464

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  91           H        ILE  91   2.881   7.741   9.223
    2    HA   ILE  91           HA       ILE  91   2.612  10.521   9.681
    3    HB   ILE  91           HB       ILE  91   0.756   8.192  10.210
    4   HG12  ILE  91          HG12      ILE  91   0.576  10.486   8.232
    5   HG13  ILE  91          HG13      ILE  91   1.397   8.970   7.858
    6   HG22  ILE  91          HG21      ILE  91  -0.921  10.296  10.274
    7   HG21  ILE  91          HG22      ILE  91   0.500  11.087  10.954
    8   HG23  ILE  91          HG23      ILE  91  -0.178   9.664  11.744
    9   HD13  ILE  91          HD11      ILE  91  -0.581   7.735   7.891
   10   HD12  ILE  91          HD12      ILE  91  -1.127   9.267   7.212
   11   HD11  ILE  91          HD13      ILE  91  -1.414   8.905   8.915

  No H/Q in entry =          11
  In of MODEL   81
    1    H    THR  92           H        THR  92   2.935   7.763  11.875
    2    HA   THR  92           HA       THR  92   2.519   9.141  14.302
    3    HB   THR  92           HB       THR  92   4.268   6.761  13.636
    4    HG1  THR  92           HG1      THR  92   2.280   6.056  13.526
    5   HG22  THR  92          HG21      THR  92   3.868   6.479  16.268
    6   HG21  THR  92          HG22      THR  92   3.849   8.240  16.199
    7   HG23  THR  92          HG23      THR  92   5.262   7.348  15.629

  No H/Q in entry =           7
  In of MODEL   81
    1    H    GLU  93           H        GLU  93   5.464   8.620  12.377
    2    HA   GLU  93           HA       GLU  93   7.248   9.996  14.085
    3    HB2  GLU  93           HB2      GLU  93   7.340   9.688  11.069
    4    HB3  GLU  93           HB3      GLU  93   8.690  10.180  12.090
    5    HG2  GLU  93           HG2      GLU  93   7.211   7.580  12.524
    6    HG3  GLU  93           HG3      GLU  93   8.602   7.699  11.454

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LEU  94           H        LEU  94   5.237  11.071  11.368
    2    HA   LEU  94           HA       LEU  94   6.111  13.754  11.278
    3    HB2  LEU  94           HB2      LEU  94   3.490  12.458  10.511
    4    HB3  LEU  94           HB3      LEU  94   3.793  14.179  10.275
    5    HG   LEU  94           HG       LEU  94   5.763  12.143   9.227
    6   HD11  LEU  94          HD11      LEU  94   3.040  12.766   8.156
    7   HD13  LEU  94          HD12      LEU  94   3.986  11.285   8.030
    8   HD12  LEU  94          HD13      LEU  94   4.360  12.660   6.990
    9   HD23  LEU  94          HD21      LEU  94   6.066  13.977   7.510
   10   HD22  LEU  94          HD22      LEU  94   6.487  14.454   9.155
   11   HD21  LEU  94          HD23      LEU  94   4.951  14.964   8.452

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  95           H        ILE  95   3.526  12.197  13.155
    2    HA   ILE  95           HA       ILE  95   2.538  14.569  14.353
    3    HB   ILE  95           HB       ILE  95   2.479  11.685  15.270
    4   HG12  ILE  95          HG12      ILE  95   0.308  13.517  14.217
    5   HG13  ILE  95          HG13      ILE  95   1.242  12.437  13.185
    6   HG21  ILE  95          HG21      ILE  95   1.255  14.186  16.473
    7   HG23  ILE  95          HG22      ILE  95   2.270  12.989  17.278
    8   HG22  ILE  95          HG23      ILE  95   0.626  12.570  16.796
    9   HD13  ILE  95          HD11      ILE  95   0.287  10.519  14.096
   10   HD12  ILE  95          HD12      ILE  95  -1.068  11.642  14.170
   11   HD11  ILE  95          HD13      ILE  95  -0.116  11.316  15.617

  No H/Q in entry =          11
  In of MODEL   81
    1    H    GLU  96           H        GLU  96   5.074  12.283  15.352
    2    HA   GLU  96           HA       GLU  96   5.648  13.461  17.849
    3    HB2  GLU  96           HB2      GLU  96   6.545  11.281  17.199
    4    HB3  GLU  96           HB3      GLU  96   7.502  12.035  15.925
    5    HG2  GLU  96           HG2      GLU  96   9.158  12.538  17.396
    6    HG3  GLU  96           HG3      GLU  96   8.028  13.377  18.449

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LEU  97           H        LEU  97   6.754  14.215  14.570
    2    HA   LEU  97           HA       LEU  97   8.686  16.163  15.295
    3    HB2  LEU  97           HB2      LEU  97   7.091  15.659  12.792
    4    HB3  LEU  97           HB3      LEU  97   8.145  17.065  12.921
    5    HG   LEU  97           HG       LEU  97   9.103  14.242  13.478
    6   HD12  LEU  97          HD11      LEU  97  10.114  14.418  11.165
    7   HD11  LEU  97          HD12      LEU  97   9.097  15.834  10.901
    8   HD13  LEU  97          HD13      LEU  97   8.359  14.259  11.189
    9   HD23  LEU  97          HD21      LEU  97  11.306  15.470  12.747
   10   HD22  LEU  97          HD22      LEU  97  10.687  15.750  14.374
   11   HD21  LEU  97          HD23      LEU  97  10.407  16.944  13.108

  No H/Q in entry =          11
  In of MODEL   81
    1    H    HIS  98           H        HIS  98   5.201  16.384  14.627
    2    HA   HIS  98           HA       HIS  98   4.969  19.190  14.769
    3    HB2  HIS  98           HB2      HIS  98   3.023  16.984  15.481
    4    HB3  HIS  98           HB3      HIS  98   2.597  18.695  15.540
    5    HD1  HIS  98           HD1      HIS  98   3.562  15.962  13.131
    6    HD2  HIS  98           HD2      HIS  98   2.281  19.928  13.015
    7    HE1  HIS  98           HE1      HIS  98   3.024  16.471  10.706
    8    HE2  HIS  98           HE2      HIS  98   2.248  18.880  10.614

  No H/Q in entry =           8
  In of MODEL   81
    1    H    GLU  99           H        GLU  99   5.033  16.692  17.261
    2    HA   GLU  99           HA       GLU  99   4.457  18.395  19.461
    3    HB2  GLU  99           HB2      GLU  99   4.308  15.915  19.551
    4    HB3  GLU  99           HB3      GLU  99   6.067  15.829  19.450
    5    HG2  GLU  99           HG2      GLU  99   6.278  17.110  21.528
    6    HG3  GLU  99           HG3      GLU  99   4.529  17.293  21.617

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LYS 100           H        LYS 100   7.493  17.396  17.906
    2    HA   LYS 100           HA       LYS 100   9.174  18.751  19.773
    3    HB2  LYS 100           HB2      LYS 100   9.662  17.823  16.934
    4    HB3  LYS 100           HB3      LYS 100  10.906  18.560  17.949
    5    HG2  LYS 100           HG2      LYS 100  10.481  16.814  19.683
    6    HG3  LYS 100           HG3      LYS 100   9.334  16.041  18.586
    7    HD2  LYS 100           HD2      LYS 100  11.127  15.719  16.925
    8    HD3  LYS 100           HD3      LYS 100  12.279  16.505  18.008
    9    HE2  LYS 100           HE2      LYS 100  11.834  14.755  19.719
   10    HE3  LYS 100           HE3      LYS 100  10.744  13.948  18.587
   11    HZ1  LYS 100           HZ1      LYS 100  13.582  14.551  17.945
   12    HZ3  LYS 100           HZ2      LYS 100  12.517  13.524  17.110
   13    HZ2  LYS 100           HZ3      LYS 100  13.089  13.087  18.649

  No H/Q in entry =          13
  In of MODEL   81
    1    H    LEU 101           H        LEU 101   7.515  19.726  16.814
    2    HA   LEU 101           HA       LEU 101   8.791  22.254  16.491
    3    HB2  LEU 101           HB2      LEU 101   6.171  21.086  15.590
    4    HB3  LEU 101           HB3      LEU 101   6.464  22.811  15.389
    5    HG   LEU 101           HG       LEU 101   8.455  20.749  14.425
    6   HD12  LEU 101          HD11      LEU 101   7.323  21.289  12.137
    7   HD11  LEU 101          HD12      LEU 101   5.931  21.750  13.114
    8   HD13  LEU 101          HD13      LEU 101   6.555  20.103  13.193
    9   HD21  LEU 101          HD21      LEU 101   7.899  23.677  13.875
   10   HD23  LEU 101          HD22      LEU 101   8.861  22.697  12.770
   11   HD22  LEU 101          HD23      LEU 101   9.402  22.937  14.431

  No H/Q in entry =          11
  In of MODEL   81
    1    H    LYS 102           H        LYS 102   7.217  21.147  19.097
    2    HA   LYS 102           HA       LYS 102   6.604  22.248  21.030
    3    HB2  LYS 102           HB2      LYS 102   7.939  24.209  19.916
    4    HB3  LYS 102           HB3      LYS 102   6.356  24.854  19.536
    5    HG2  LYS 102           HG2      LYS 102   7.716  24.557  22.193
    6    HG3  LYS 102           HG3      LYS 102   6.799  25.910  21.564
    7    HD2  LYS 102           HD2      LYS 102   5.488  23.302  22.430
    8    HD3  LYS 102           HD3      LYS 102   5.765  24.654  23.519
    9    HE2  LYS 102           HE2      LYS 102   3.482  24.311  22.020
   10    HE3  LYS 102           HE3      LYS 102   4.020  25.842  22.708
   11    HZ2  LYS 102           HZ1      LYS 102   3.502  25.969  20.327
   12    HZ1  LYS 102           HZ2      LYS 102   4.738  24.858  20.006
   13    HZ3  LYS 102           HZ3      LYS 102   5.115  26.378  20.654

  No H/Q in entry =          13
  In of MODEL   81
    1    H    ALA 103           H        ALA 103   5.015  23.838  18.261
    2    HA   ALA 103           HA       ALA 103   2.572  24.472  19.138
    3    HB1  ALA 103           HB1      ALA 103   1.662  23.658  16.890
    4    HB2  ALA 103           HB2      ALA 103   3.297  23.082  16.565
    5    HB3  ALA 103           HB3      ALA 103   3.003  24.801  16.835

  No H/Q in entry =           5
  In of MODEL   81
    1    H1   ALA   1           H3       ALA   1  10.179 -20.152  -6.236
    2    H2   ALA   1           H2       ALA   1   9.215 -20.330  -7.626
    3    H3   ALA   1           H1       ALA   1   8.754 -21.070  -6.167
    4    HA   ALA   1           HA       ALA   1   9.751 -22.902  -6.908
    5    HB1  ALA   1           HB1      ALA   1   9.863 -22.538  -9.182
    6    HB2  ALA   1           HB2      ALA   1  11.593 -22.432  -8.846
    7    HB3  ALA   1           HB3      ALA   1  10.632 -20.960  -8.996

  No H/Q in entry =           7
  In of MODEL   81
    1    H    GLU   2           H        GLU   2  12.010 -23.909  -6.960
    2    HA   GLU   2           HA       GLU   2  13.385 -23.869  -4.743
    3    HB2  GLU   2           HB2      GLU   2  14.754 -23.763  -7.437
    4    HB3  GLU   2           HB3      GLU   2  15.461 -24.397  -5.951
    5    HG2  GLU   2           HG2      GLU   2  14.395 -26.387  -6.202
    6    HG3  GLU   2           HG3      GLU   2  12.844 -25.601  -6.464

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLU   3           H        GLU   3  15.211 -22.042  -7.133
    2    HA   GLU   3           HA       GLU   3  16.400 -20.391  -5.164
    3    HB2  GLU   3           HB2      GLU   3  16.355 -20.378  -8.174
    4    HB3  GLU   3           HB3      GLU   3  17.130 -19.071  -7.280
    5    HG2  GLU   3           HG2      GLU   3  18.754 -20.490  -6.356
    6    HG3  GLU   3           HG3      GLU   3  17.772 -21.932  -6.585

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LEU   4           H        LEU   4  14.149 -19.478  -7.800
    2    HA   LEU   4           HA       LEU   4  13.747 -16.860  -7.182
    3    HB2  LEU   4           HB2      LEU   4  11.525 -18.776  -7.926
    4    HB3  LEU   4           HB3      LEU   4  11.495 -17.025  -8.120
    5    HG   LEU   4           HG       LEU   4  13.416 -18.934  -9.491
    6   HD13  LEU   4          HD11      LEU   4  12.126 -18.746 -11.406
    7   HD12  LEU   4          HD12      LEU   4  11.455 -17.185 -10.936
    8   HD11  LEU   4          HD13      LEU   4  10.862 -18.664 -10.181
    9   HD23  LEU   4          HD21      LEU   4  13.815 -16.694 -10.835
   10   HD22  LEU   4          HD22      LEU   4  14.663 -16.962  -9.313
   11   HD21  LEU   4          HD23      LEU   4  13.236 -15.929  -9.354

  No H/Q in entry =          11
  In of MODEL   81
    1    H    GLU   5           H        GLU   5  12.186 -19.610  -5.554
    2    HA   GLU   5           HA       GLU   5  10.543 -18.001  -3.852
    3    HB2  GLU   5           HB2      GLU   5  10.065 -20.370  -4.385
    4    HB3  GLU   5           HB3      GLU   5  11.478 -20.841  -3.441
    5    HG2  GLU   5           HG2      GLU   5  10.515 -19.775  -1.444
    6    HG3  GLU   5           HG3      GLU   5   9.104 -19.285  -2.383

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLU   6           H        GLU   6  13.647 -19.662  -3.403
    2    HA   GLU   6           HA       GLU   6  14.011 -18.823  -0.701
    3    HB2  GLU   6           HB2      GLU   6  15.194 -20.764  -1.682
    4    HB3  GLU   6           HB3      GLU   6  16.079 -19.670  -2.747
    5    HG2  GLU   6           HG2      GLU   6  17.059 -18.536  -0.812
    6    HG3  GLU   6           HG3      GLU   6  16.129 -19.559   0.283

  No H/Q in entry =           6
  In of MODEL   81
    1    H    VAL   7           H        VAL   7  14.821 -17.506  -3.844
    2    HA   VAL   7           HA       VAL   7  16.557 -15.425  -2.967
    3    HB   VAL   7           HB       VAL   7  14.851 -15.738  -5.451
    4   HG11  VAL   7          HG11      VAL   7  16.796 -13.576  -4.626
    5   HG13  VAL   7          HG12      VAL   7  15.160 -13.390  -5.254
    6   HG12  VAL   7          HG13      VAL   7  16.460 -13.922  -6.322
    7   HG21  VAL   7          HG21      VAL   7  16.919 -17.249  -4.880
    8   HG23  VAL   7          HG22      VAL   7  17.862 -15.809  -5.270
    9   HG22  VAL   7          HG23      VAL   7  16.811 -16.530  -6.487

  No H/Q in entry =           9
  In of MODEL   81
    1    H    VAL   8           H        VAL   8  13.061 -15.606  -3.537
    2    HA   VAL   8           HA       VAL   8  12.461 -12.883  -3.059
    3    HB   VAL   8           HB       VAL   8  10.787 -15.373  -2.639
    4   HG13  VAL   8          HG11      VAL   8   9.757 -13.732  -1.283
    5   HG12  VAL   8          HG12      VAL   8   8.892 -13.611  -2.814
    6   HG11  VAL   8          HG13      VAL   8  10.140 -12.433  -2.411
    7   HG23  VAL   8          HG21      VAL   8  10.174 -13.440  -4.817
    8   HG22  VAL   8          HG22      VAL   8  10.197 -15.200  -4.852
    9   HG21  VAL   8          HG23      VAL   8  11.702 -14.300  -5.006

  No H/Q in entry =           9
  In of MODEL   81
    1    H    MET   9           H        MET   9  12.651 -15.702  -0.887
    2    HA   MET   9           HA       MET   9  11.858 -14.417   1.485
    3    HB2  MET   9           HB2      MET   9  13.698 -16.742   0.935
    4    HB3  MET   9           HB3      MET   9  13.434 -16.154   2.576
    5    HG2  MET   9           HG2      MET   9  11.013 -16.490   2.328
    6    HG3  MET   9           HG3      MET   9  11.250 -17.035   0.667
    7    HE2  MET   9           HE1      MET   9  12.358 -19.025   4.593
    8    HE1  MET   9           HE2      MET   9  12.120 -17.319   4.221
    9    HE3  MET   9           HE3      MET   9  13.668 -18.083   3.872

  No H/Q in entry =           9
  In of MODEL   81
    1    H    GLY  10           H        GLY  10  15.039 -14.714  -0.061
    2    HA3  GLY  10           HA2      GLY  10  16.524 -13.335   1.918
    3    HA2  GLY  10           HA3      GLY  10  16.989 -13.507   0.226

  No H/Q in entry =           3
  In of MODEL   81
    1    H    LEU  11           H        LEU  11  14.856 -12.230  -1.018
    2    HA   LEU  11           HA       LEU  11  15.605  -9.503  -0.843
    3    HB2  LEU  11           HB2      LEU  11  13.209 -10.852  -2.091
    4    HB3  LEU  11           HB3      LEU  11  13.532  -9.124  -2.244
    5    HG   LEU  11           HG       LEU  11  15.511 -11.278  -3.032
    6   HD13  LEU  11          HD11      LEU  11  13.762 -11.599  -4.559
    7   HD12  LEU  11          HD12      LEU  11  14.796 -10.439  -5.392
    8   HD11  LEU  11          HD13      LEU  11  13.332  -9.888  -4.577
    9   HD22  LEU  11          HD21      LEU  11  16.788  -9.345  -2.796
   10   HD21  LEU  11          HD22      LEU  11  15.439  -8.275  -3.176
   11   HD23  LEU  11          HD23      LEU  11  16.254  -9.159  -4.465

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  12           H        ILE  12  12.790 -11.266   0.408
    2    HA   ILE  12           HA       ILE  12  11.445  -9.014   1.470
    3    HB   ILE  12           HB       ILE  12  11.411 -11.899   2.409
    4   HG12  ILE  12          HG12      ILE  12  10.744 -11.242  -0.038
    5   HG13  ILE  12          HG13      ILE  12   9.687 -12.306   0.869
    6   HG23  ILE  12          HG21      ILE  12  10.488 -10.508   4.153
    7   HG22  ILE  12          HG22      ILE  12   9.130 -11.253   3.311
    8   HG21  ILE  12          HG23      ILE  12   9.555  -9.573   2.986
    9   HD13  ILE  12          HD11      ILE  12   8.213 -10.450   1.379
   10   HD12  ILE  12          HD12      ILE  12   8.496 -10.482  -0.360
   11   HD11  ILE  12          HD13      ILE  12   9.331  -9.315   0.642

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  13           H        ILE  13  13.781 -11.277   2.877
    2    HA   ILE  13           HA       ILE  13  13.834 -10.107   5.461
    3    HB   ILE  13           HB       ILE  13  15.863 -11.722   3.898
    4   HG12  ILE  13          HG12      ILE  13  13.559 -12.631   4.740
    5   HG13  ILE  13          HG13      ILE  13  15.011 -13.595   4.992
    6   HG22  ILE  13          HG21      ILE  13  16.963 -12.093   6.150
    7   HG21  ILE  13          HG22      ILE  13  15.991 -10.770   6.779
    8   HG23  ILE  13          HG23      ILE  13  17.165 -10.469   5.497
    9   HD13  ILE  13          HD11      ILE  13  15.161 -12.883   7.309
   10   HD12  ILE  13          HD12      ILE  13  13.506 -13.406   7.015
   11   HD11  ILE  13          HD13      ILE  13  13.889 -11.690   7.065

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ASN  14           H        ASN  14  15.810  -9.611   2.552
    2    HA   ASN  14           HA       ASN  14  17.593  -7.712   3.626
    3    HB2  ASN  14           HB2      ASN  14  17.551  -8.971   1.306
    4    HB3  ASN  14           HB3      ASN  14  16.692  -7.533   0.770
    5   HD21  ASN  14          HD21      ASN  14  19.129  -7.922  -0.408
    6   HD22  ASN  14          HD22      ASN  14  20.293  -6.866   0.227

  No H/Q in entry =           6
  In of MODEL   81
    1    H    SER  15           H        SER  15  14.497  -7.292   1.923
    2    HA   SER  15           HA       SER  15  14.446  -4.470   1.987
    3    HB2  SER  15           HB2      SER  15  12.112  -4.664   1.480
    4    HB3  SER  15           HB3      SER  15  12.881  -6.048   0.711
    5    HG   SER  15           HG       SER  15  12.202  -7.339   2.382

  No H/Q in entry =           5
  In of MODEL   81
    1    H    GLY  16           H        GLY  16  13.291  -6.913   4.279
    2    HA3  GLY  16           HA2      GLY  16  12.100  -5.144   6.137
    3    HA2  GLY  16           HA3      GLY  16  12.679  -6.766   6.497

  No H/Q in entry =           3
  In of MODEL   81
    1    H    GLN  17           H        GLN  17  15.399  -6.489   5.916
    2    HA   GLN  17           HA       GLN  17  16.372  -5.295   8.304
    3    HB2  GLN  17           HB2      GLN  17  17.535  -6.605   5.926
    4    HB3  GLN  17           HB3      GLN  17  18.589  -5.425   6.704
    5    HG2  GLN  17           HG2      GLN  17  18.666  -7.873   7.560
    6    HG3  GLN  17           HG3      GLN  17  18.576  -6.580   8.755
    7   HE21  GLN  17          HE21      GLN  17  17.623  -8.523  10.068
    8   HE22  GLN  17          HE22      GLN  17  15.946  -8.759   9.951

  No H/Q in entry =           8
  In of MODEL   81
    1    H    ALA  18           H        ALA  18  16.219  -4.204   4.947
    2    HA   ALA  18           HA       ALA  18  17.704  -1.842   5.186
    3    HB1  ALA  18           HB1      ALA  18  16.569  -3.027   3.111
    4    HB3  ALA  18           HB2      ALA  18  16.870  -1.290   3.102
    5    HB2  ALA  18           HB3      ALA  18  15.256  -1.903   3.463

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ARG  19           H        ARG  19  14.191  -2.358   5.568
    2    HA   ARG  19           HA       ARG  19  13.575   0.303   6.288
    3    HB2  ARG  19           HB2      ARG  19  11.860  -1.412   5.689
    4    HB3  ARG  19           HB3      ARG  19  12.179  -2.221   7.225
    5    HG2  ARG  19           HG2      ARG  19  11.505  -0.219   8.468
    6    HG3  ARG  19           HG3      ARG  19  11.280   0.667   6.961
    7    HD2  ARG  19           HD2      ARG  19   9.119  -0.088   7.770
    8    HD3  ARG  19           HD3      ARG  19   9.525  -0.971   6.293
    9    HE   ARG  19           HE       ARG  19  10.443  -2.539   8.397
   10   HH21  ARG  19          HH11      ARG  19   9.157  -4.156   9.326
   11   HH22  ARG  19          HH12      ARG  19   7.438  -4.092   9.149
   12   HH11  ARG  19          HH21      ARG  19   7.481  -1.182   7.294
   13   HH12  ARG  19          HH22      ARG  19   6.490  -2.409   7.994

  No H/Q in entry =          13
  In of MODEL   81
    1    H    SER  20           H        SER  20  14.366  -2.550   8.242
    2    HA   SER  20           HA       SER  20  14.095  -1.453  10.781
    3    HB2  SER  20           HB2      SER  20  14.555  -3.846  10.379
    4    HB3  SER  20           HB3      SER  20  16.188  -3.439   9.856
    5    HG   SER  20           HG       SER  20  15.632  -2.290  12.227

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LEU  21           H        LEU  21  16.948  -1.444   8.657
    2    HA   LEU  21           HA       LEU  21  18.646   0.002  10.407
    3    HB2  LEU  21           HB2      LEU  21  18.630  -0.263   7.393
    4    HB3  LEU  21           HB3      LEU  21  19.898   0.572   8.286
    5    HG   LEU  21           HG       LEU  21  19.102  -2.307   8.810
    6   HD13  LEU  21          HD11      LEU  21  19.978  -2.195   6.561
    7   HD12  LEU  21          HD12      LEU  21  21.256  -2.829   7.598
    8   HD11  LEU  21          HD13      LEU  21  21.299  -1.146   7.075
    9   HD21  LEU  21          HD21      LEU  21  21.234  -0.448   9.843
   10   HD23  LEU  21          HD22      LEU  21  21.597  -2.168   9.741
   11   HD22  LEU  21          HD23      LEU  21  20.262  -1.611  10.738

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ALA  22           H        ALA  22  16.413   1.025   7.844
    2    HA   ALA  22           HA       ALA  22  17.009   3.772   7.869
    3    HB3  ALA  22           HB1      ALA  22  15.588   2.564   6.181
    4    HB2  ALA  22           HB2      ALA  22  14.910   4.089   6.749
    5    HB1  ALA  22           HB3      ALA  22  14.285   2.561   7.370

  No H/Q in entry =           5
  In of MODEL   81
    1    H    TYR  23           H        TYR  23  14.467   2.003   9.688
    2    HA   TYR  23           HA       TYR  23  13.545   4.255  11.140
    3    HB2  TYR  23           HB2      TYR  23  12.268   2.166  11.106
    4    HB3  TYR  23           HB3      TYR  23  13.577   1.328  11.939
    5    HD1  TYR  23           HD1      TYR  23  11.127   4.120  12.289
    6    HD2  TYR  23           HD2      TYR  23  13.760   1.383  14.296
    7    HE1  TYR  23           HE1      TYR  23  10.198   4.831  14.478
    8    HE2  TYR  23           HE2      TYR  23  12.830   2.092  16.483
    9    HH   TYR  23           HH       TYR  23  10.182   4.471  16.670

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ALA  24           H        ALA  24  16.139   1.923  11.781
    2    HA   ALA  24           HA       ALA  24  16.819   2.896  14.351
    3    HB3  ALA  24           HB1      ALA  24  18.138   1.075  14.186
    4    HB2  ALA  24           HB2      ALA  24  19.190   1.978  13.094
    5    HB1  ALA  24           HB3      ALA  24  17.877   0.999  12.444

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ALA  25           H        ALA  25  17.810   3.814  11.079
    2    HA   ALA  25           HA       ALA  25  19.793   5.705  11.738
    3    HB1  ALA  25           HB1      ALA  25  19.066   4.779   9.417
    4    HB3  ALA  25           HB2      ALA  25  19.603   6.455   9.517
    5    HB2  ALA  25           HB3      ALA  25  17.881   6.085   9.440

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LEU  26           H        LEU  26  16.286   6.010  11.363
    2    HA   LEU  26           HA       LEU  26  16.119   8.795  11.822
    3    HB2  LEU  26           HB2      LEU  26  14.236   7.602  10.882
    4    HB3  LEU  26           HB3      LEU  26  14.117   6.573  12.304
    5    HG   LEU  26           HG       LEU  26  13.547   8.539  13.688
    6   HD12  LEU  26          HD11      LEU  26  12.937  10.657  12.366
    7   HD11  LEU  26          HD12      LEU  26  13.909   9.987  11.059
    8   HD13  LEU  26          HD13      LEU  26  14.656  10.351  12.615
    9   HD21  LEU  26          HD21      LEU  26  11.876   8.270  11.170
   10   HD23  LEU  26          HD22      LEU  26  11.324   8.975  12.687
   11   HD22  LEU  26          HD23      LEU  26  11.740   7.264  12.613

  No H/Q in entry =          11
  In of MODEL   81
    1    H    LYS  27           H        LYS  27  15.941   6.012  14.006
    2    HA   LYS  27           HA       LYS  27  15.369   7.383  16.376
    3    HB2  LYS  27           HB2      LYS  27  15.343   4.909  16.103
    4    HB3  LYS  27           HB3      LYS  27  17.108   4.922  16.067
    5    HG2  LYS  27           HG2      LYS  27  17.170   5.900  18.320
    6    HG3  LYS  27           HG3      LYS  27  15.403   5.957  18.358
    7    HD2  LYS  27           HD2      LYS  27  15.324   3.492  18.114
    8    HD3  LYS  27           HD3      LYS  27  17.089   3.442  18.109
    9    HE2  LYS  27           HE2      LYS  27  17.135   4.423  20.369
   10    HE3  LYS  27           HE3      LYS  27  15.371   4.503  20.377
   11    HZ3  LYS  27           HZ1      LYS  27  16.110   2.530  21.524
   12    HZ2  LYS  27           HZ2      LYS  27  17.021   2.035  20.176
   13    HZ1  LYS  27           HZ3      LYS  27  15.324   2.078  20.089

  No H/Q in entry =          13
  In of MODEL   81
    1    H    GLN  28           H        GLN  28  18.478   6.736  14.795
    2    HA   GLN  28           HA       GLN  28  20.178   7.775  16.796
    3    HB2  GLN  28           HB2      GLN  28  20.476   7.732  13.782
    4    HB3  GLN  28           HB3      GLN  28  21.768   8.171  14.899
    5    HG2  GLN  28           HG2      GLN  28  20.289   5.527  14.941
    6    HG3  GLN  28           HG3      GLN  28  21.870   5.776  14.204
    7   HE21  GLN  28          HE21      GLN  28  20.594   4.491  16.919
    8   HE22  GLN  28          HE22      GLN  28  21.802   4.886  18.043

  No H/Q in entry =           8
  In of MODEL   81
    1    H    ALA  29           H        ALA  29  18.472   9.306  14.101
    2    HA   ALA  29           HA       ALA  29  19.529  11.902  14.367
    3    HB2  ALA  29           HB1      ALA  29  17.852  12.582  12.890
    4    HB1  ALA  29           HB2      ALA  29  16.679  11.434  13.533
    5    HB3  ALA  29           HB3      ALA  29  18.001  10.864  12.513

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LYS  30           H        LYS  30  16.710  10.363  15.871
    2    HA   LYS  30           HA       LYS  30  15.743  12.635  17.231
    3    HB2  LYS  30           HB2      LYS  30  15.559   9.695  17.925
    4    HB3  LYS  30           HB3      LYS  30  14.719  10.963  18.819
    5    HG2  LYS  30           HG2      LYS  30  13.620  11.682  16.698
    6    HG3  LYS  30           HG3      LYS  30  14.396  10.329  15.870
    7    HD2  LYS  30           HD2      LYS  30  13.280   8.743  17.389
    8    HD3  LYS  30           HD3      LYS  30  12.514  10.084  18.241
    9    HE2  LYS  30           HE2      LYS  30  11.370  10.751  16.146
   10    HE3  LYS  30           HE3      LYS  30  12.115   9.382  15.314
   11    HZ2  LYS  30           HZ1      LYS  30   9.794   9.024  16.183
   12    HZ1  LYS  30           HZ2      LYS  30  10.456   9.057  17.753
   13    HZ3  LYS  30           HZ3      LYS  30  10.941   7.863  16.641

  No H/Q in entry =          13
  In of MODEL   81
    1    H    GLN  31           H        GLN  31  18.349  10.400  17.972
    2    HA   GLN  31           HA       GLN  31  18.689  11.398  20.671
    3    HB2  GLN  31           HB2      GLN  31  20.680   9.785  19.069
    4    HB3  GLN  31           HB3      GLN  31  20.542   9.906  20.824
    5    HG2  GLN  31           HG2      GLN  31  18.009   9.017  20.041
    6    HG3  GLN  31           HG3      GLN  31  19.095   8.150  18.963
    7   HE21  GLN  31          HE21      GLN  31  17.516   7.034  21.229
    8   HE22  GLN  31          HE22      GLN  31  18.651   6.342  22.282

  No H/Q in entry =           8
  In of MODEL   81
    1    H    GLY  32           H        GLY  32  19.252  12.712  17.711
    2    HA3  GLY  32           HA2      GLY  32  20.287  14.735  17.208
    3    HA2  GLY  32           HA3      GLY  32  21.037  14.716  18.799

  No H/Q in entry =           3
  In of MODEL   81
    1    H    ASP  33           H        ASP  33  21.398  11.820  17.014
    2    HA   ASP  33           HA       ASP  33  24.240  12.430  16.561
    3    HB2  ASP  33           HB2      ASP  33  22.669   9.850  16.663
    4    HB3  ASP  33           HB3      ASP  33  24.360   9.928  16.175

  No H/Q in entry =           4
  In of MODEL   81
    1    H    PHE  34           H        PHE  34  23.798  13.770  14.682
    2    HA   PHE  34           HA       PHE  34  22.436  12.826  12.387
    3    HB2  PHE  34           HB2      PHE  34  24.616  14.908  12.632
    4    HB3  PHE  34           HB3      PHE  34  23.630  14.646  11.196
    5    HD1  PHE  34           HD1      PHE  34  23.915  16.564  14.117
    6    HD2  PHE  34           HD2      PHE  34  20.998  14.524  11.712
    7    HE1  PHE  34           HE1      PHE  34  22.128  18.001  15.061
    8    HE2  PHE  34           HE2      PHE  34  19.215  15.962  12.659
    9    HZ   PHE  34           HZ       PHE  34  19.784  17.700  14.329

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ALA  35           H        ALA  35  25.801  12.555  13.408
    2    HA   ALA  35           HA       ALA  35  26.897  11.716  10.952
    3    HB3  ALA  35           HB1      ALA  35  28.542  10.502  12.675
    4    HB2  ALA  35           HB2      ALA  35  27.698  11.544  13.821
    5    HB1  ALA  35           HB3      ALA  35  28.557  12.251  12.454

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ALA  36           H        ALA  36  25.724   9.778  13.707
    2    HA   ALA  36           HA       ALA  36  26.155   7.284  12.425
    3    HB2  ALA  36           HB1      ALA  36  25.699   6.541  14.496
    4    HB3  ALA  36           HB2      ALA  36  24.023   7.075  14.341
    5    HB1  ALA  36           HB3      ALA  36  25.248   8.177  14.972

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ALA  37           H        ALA  37  23.383   9.474  12.554
    2    HA   ALA  37           HA       ALA  37  21.492   7.752  11.365
    3    HB3  ALA  37           HB1      ALA  37  21.784  10.708  11.668
    4    HB1  ALA  37           HB2      ALA  37  20.446   9.658  12.131
    5    HB2  ALA  37           HB3      ALA  37  20.652  10.131  10.444

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LYS  38           H        LYS  38  23.653  10.169   9.903
    2    HA   LYS  38           HA       LYS  38  23.015   9.764   7.221
    3    HB2  LYS  38           HB2      LYS  38  24.853  11.276   8.679
    4    HB3  LYS  38           HB3      LYS  38  25.868  10.266   7.654
    5    HG2  LYS  38           HG2      LYS  38  24.730  11.069   5.656
    6    HG3  LYS  38           HG3      LYS  38  23.550  11.948   6.635
    7    HD2  LYS  38           HD2      LYS  38  25.178  13.507   7.399
    8    HD3  LYS  38           HD3      LYS  38  26.518  12.492   6.866
    9    HE2  LYS  38           HE2      LYS  38  26.210  14.376   5.319
   10    HE3  LYS  38           HE3      LYS  38  25.843  12.849   4.508
   11    HZ3  LYS  38           HZ1      LYS  38  23.658  13.343   4.371
   12    HZ2  LYS  38           HZ2      LYS  38  24.216  14.946   4.466
   13    HZ1  LYS  38           HZ3      LYS  38  23.619  14.171   5.853

  No H/Q in entry =          13
  In of MODEL   81
    1    H    ALA  39           H        ALA  39  25.484   8.105   9.182
    2    HA   ALA  39           HA       ALA  39  26.527   6.499   7.112
    3    HB2  ALA  39           HB1      ALA  39  26.405   5.529   9.952
    4    HB1  ALA  39           HB2      ALA  39  27.390   6.934   9.544
    5    HB3  ALA  39           HB3      ALA  39  27.711   5.379   8.777

  No H/Q in entry =           5
  In of MODEL   81
    1    H    MET  40           H        MET  40  23.891   5.934   9.398
    2    HA   MET  40           HA       MET  40  23.392   3.242   8.653
    3    HB2  MET  40           HB2      MET  40  21.615   5.321   9.944
    4    HB3  MET  40           HB3      MET  40  21.172   3.622   9.762
    5    HG2  MET  40           HG2      MET  40  23.736   4.502  11.116
    6    HG3  MET  40           HG3      MET  40  22.232   4.256  12.003
    7    HE3  MET  40           HE1      MET  40  21.588   0.636  12.164
    8    HE2  MET  40           HE2      MET  40  20.752   1.960  11.357
    9    HE1  MET  40           HE3      MET  40  21.492   2.226  12.934

  No H/Q in entry =           9
  In of MODEL   81
    1    H    MET  41           H        MET  41  22.050   6.329   7.470
    2    HA   MET  41           HA       MET  41  20.074   5.182   5.786
    3    HB2  MET  41           HB2      MET  41  21.613   7.741   5.287
    4    HB3  MET  41           HB3      MET  41  20.078   7.283   4.561
    5    HG2  MET  41           HG2      MET  41  19.317   7.103   7.109
    6    HG3  MET  41           HG3      MET  41  20.650   8.231   7.340
    7    HE2  MET  41           HE1      MET  41  20.129   9.542   4.005
    8    HE1  MET  41           HE2      MET  41  21.089   9.956   5.422
    9    HE3  MET  41           HE3      MET  41  19.843  11.064   4.856

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ASP  42           H        ASP  42  23.468   6.034   5.249
    2    HA   ASP  42           HA       ASP  42  23.561   5.567   2.491
    3    HB2  ASP  42           HB2      ASP  42  25.326   6.520   4.270
    4    HB3  ASP  42           HB3      ASP  42  25.948   4.882   4.140

  No H/Q in entry =           4
  In of MODEL   81
    1    H    GLN  43           H        GLN  43  24.227   3.388   5.207
    2    HA   GLN  43           HA       GLN  43  24.849   1.122   3.619
    3    HB2  GLN  43           HB2      GLN  43  23.819   1.318   6.459
    4    HB3  GLN  43           HB3      GLN  43  24.369  -0.181   5.702
    5    HG2  GLN  43           HG2      GLN  43  26.560   0.985   5.203
    6    HG3  GLN  43           HG3      GLN  43  26.002   2.321   6.205
    7   HE21  GLN  43          HE21      GLN  43  28.209   1.297   7.247
    8   HE22  GLN  43          HE22      GLN  43  27.907   0.216   8.519

  No H/Q in entry =           8
  In of MODEL   81
    1    H    SER  44           H        SER  44  21.813   2.317   4.996
    2    HA   SER  44           HA       SER  44  20.199   0.110   4.309
    3    HB2  SER  44           HB2      SER  44  19.807   2.644   5.462
    4    HB3  SER  44           HB3      SER  44  18.778   2.628   4.032
    5    HG   SER  44           HG       SER  44  17.657   1.703   5.748

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ARG  45           H        ARG  45  21.013   3.064   2.517
    2    HA   ARG  45           HA       ARG  45  19.487   2.618   0.205
    3    HB2  ARG  45           HB2      ARG  45  20.674   4.727   0.801
    4    HB3  ARG  45           HB3      ARG  45  22.204   3.940   0.419
    5    HG2  ARG  45           HG2      ARG  45  21.421   3.560  -1.900
    6    HG3  ARG  45           HG3      ARG  45  19.904   4.369  -1.517
    7    HD2  ARG  45           HD2      ARG  45  21.197   6.436  -0.920
    8    HD3  ARG  45           HD3      ARG  45  22.679   5.632  -1.486
    9    HE   ARG  45           HE       ARG  45  20.752   5.443  -3.530
   10   HH21  ARG  45          HH11      ARG  45  20.782   6.817  -5.289
   11   HH22  ARG  45          HH12      ARG  45  21.572   8.351  -5.176
   12   HH11  ARG  45          HH21      ARG  45  22.530   7.898  -1.888
   13   HH12  ARG  45          HH22      ARG  45  22.560   8.962  -3.248

  No H/Q in entry =          13
  In of MODEL   81
    1    H    MET  46           H        MET  46  22.828   1.668   0.962
    2    HA   MET  46           HA       MET  46  23.417   0.470  -1.523
    3    HB2  MET  46           HB2      MET  46  24.505   0.093   1.269
    4    HB3  MET  46           HB3      MET  46  25.155  -0.784  -0.120
    5    HG2  MET  46           HG2      MET  46  25.615   1.349  -1.265
    6    HG3  MET  46           HG3      MET  46  24.945   2.235   0.098
    7    HE3  MET  46           HE1      MET  46  28.476   2.928  -0.401
    8    HE2  MET  46           HE2      MET  46  27.894   3.471   1.169
    9    HE1  MET  46           HE3      MET  46  26.814   3.508  -0.223

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ALA  47           H        ALA  47  21.994  -0.842   1.443
    2    HA   ALA  47           HA       ALA  47  21.882  -3.550   0.632
    3    HB2  ALA  47           HB1      ALA  47  21.506  -3.088   2.936
    4    HB3  ALA  47           HB2      ALA  47  19.958  -3.655   2.310
    5    HB1  ALA  47           HB3      ALA  47  20.226  -1.930   2.575

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LEU  48           H        LEU  48  19.591  -0.870   0.275
    2    HA   LEU  48           HA       LEU  48  17.516  -2.352  -0.987
    3    HB2  LEU  48           HB2      LEU  48  18.237   0.587  -1.091
    4    HB3  LEU  48           HB3      LEU  48  16.753  -0.088  -1.764
    5    HG   LEU  48           HG       LEU  48  17.590  -0.418   1.126
    6   HD13  LEU  48          HD11      LEU  48  17.225   1.892   0.945
    7   HD12  LEU  48          HD12      LEU  48  15.651   1.279   1.448
    8   HD11  LEU  48          HD13      LEU  48  15.937   1.700  -0.241
    9   HD22  LEU  48          HD21      LEU  48  16.024  -2.096   0.736
   10   HD21  LEU  48          HD22      LEU  48  15.175  -1.170  -0.503
   11   HD23  LEU  48          HD23      LEU  48  14.966  -0.765   1.201

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ASN  49           H        ASN  49  20.251  -0.483  -2.203
    2    HA   ASN  49           HA       ASN  49  19.607  -0.544  -4.930
    3    HB2  ASN  49           HB2      ASN  49  21.316   0.934  -4.012
    4    HB3  ASN  49           HB3      ASN  49  22.307  -0.445  -3.555
    5   HD21  ASN  49          HD21      ASN  49  20.900   1.164  -6.427
    6   HD22  ASN  49          HD22      ASN  49  22.125   0.670  -7.492

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLU  50           H        GLU  50  21.534  -2.789  -2.968
    2    HA   GLU  50           HA       GLU  50  22.201  -4.555  -5.097
    3    HB2  GLU  50           HB2      GLU  50  23.393  -4.563  -2.927
    4    HB3  GLU  50           HB3      GLU  50  21.934  -5.159  -2.137
    5    HG2  GLU  50           HG2      GLU  50  21.980  -7.190  -3.501
    6    HG3  GLU  50           HG3      GLU  50  23.373  -6.587  -4.396

  No H/Q in entry =           6
  In of MODEL   81
    1    H    ALA  51           H        ALA  51  19.540  -4.434  -2.778
    2    HA   ALA  51           HA       ALA  51  18.319  -6.877  -3.545
    3    HB3  ALA  51           HB1      ALA  51  16.735  -6.339  -1.993
    4    HB1  ALA  51           HB2      ALA  51  16.561  -4.686  -2.588
    5    HB2  ALA  51           HB3      ALA  51  17.908  -5.107  -1.529

  No H/Q in entry =           5
  In of MODEL   81
    1    H    HIS  52           H        HIS  52  17.814  -3.514  -4.573
    2    HA   HIS  52           HA       HIS  52  15.694  -3.986  -6.380
    3    HB2  HIS  52           HB2      HIS  52  16.406  -1.740  -5.565
    4    HB3  HIS  52           HB3      HIS  52  17.847  -1.868  -6.573
    5    HD1  HIS  52           HD1      HIS  52  17.499  -1.831  -9.173
    6    HD2  HIS  52           HD2      HIS  52  14.018  -1.180  -6.975
    7    HE1  HIS  52           HE1      HIS  52  15.776  -0.947 -10.805
    8    HE2  HIS  52           HE2      HIS  52  13.648  -0.544  -9.479

  No H/Q in entry =           8
  In of MODEL   81
    1    H    LEU  53           H        LEU  53  19.213  -4.073  -6.803
    2    HA   LEU  53           HA       LEU  53  19.270  -4.382  -9.604
    3    HB2  LEU  53           HB2      LEU  53  21.180  -5.200  -7.428
    4    HB3  LEU  53           HB3      LEU  53  21.491  -5.578  -9.120
    5    HG   LEU  53           HG       LEU  53  20.878  -2.763  -8.170
    6   HD13  LEU  53          HD11      LEU  53  22.904  -3.550  -7.030
    7   HD12  LEU  53          HD12      LEU  53  23.325  -2.377  -8.278
    8   HD11  LEU  53          HD13      LEU  53  23.571  -4.096  -8.566
    9   HD23  LEU  53          HD21      LEU  53  22.325  -2.340 -10.320
   10   HD22  LEU  53          HD22      LEU  53  20.634  -2.791 -10.508
   11   HD21  LEU  53          HD23      LEU  53  21.890  -3.992 -10.740

  No H/Q in entry =          11
  In of MODEL   81
    1    H    VAL  54           H        VAL  54  19.096  -6.772  -6.984
    2    HA   VAL  54           HA       VAL  54  19.171  -9.065  -8.649
    3    HB   VAL  54           HB       VAL  54  18.019  -8.622  -5.884
    4   HG12  VAL  54          HG11      VAL  54  18.284 -11.246  -5.885
    5   HG11  VAL  54          HG12      VAL  54  18.108 -11.069  -7.631
    6   HG13  VAL  54          HG13      VAL  54  16.828 -10.512  -6.554
    7   HG22  VAL  54          HG21      VAL  54  20.339  -8.464  -5.654
    8   HG21  VAL  54          HG22      VAL  54  20.655  -9.560  -6.997
    9   HG23  VAL  54          HG23      VAL  54  20.106 -10.199  -5.448

  No H/Q in entry =           9
  In of MODEL   81
    1    H    GLN  55           H        GLN  55  16.483  -7.104  -7.369
    2    HA   GLN  55           HA       GLN  55  14.428  -8.719  -8.452
    3    HB2  GLN  55           HB2      GLN  55  13.710  -7.181  -6.824
    4    HB3  GLN  55           HB3      GLN  55  14.536  -5.829  -7.595
    5    HG2  GLN  55           HG2      GLN  55  12.823  -5.463  -9.088
    6    HG3  GLN  55           HG3      GLN  55  12.463  -7.175  -9.263
    7   HE21  GLN  55          HE21      GLN  55  10.442  -7.681  -8.465
    8   HE22  GLN  55          HE22      GLN  55   9.682  -6.913  -7.157

  No H/Q in entry =           8
  In of MODEL   81
    1    H    THR  56           H        THR  56  16.233  -5.956  -9.801
    2    HA   THR  56           HA       THR  56  14.810  -5.557 -12.152
    3    HB   THR  56           HB       THR  56  17.830  -5.535 -11.976
    4    HG1  THR  56           HG1      THR  56  15.921  -4.026 -10.730
    5   HG21  THR  56          HG21      THR  56  15.810  -4.035 -13.663
    6   HG23  THR  56          HG22      THR  56  16.984  -5.225 -14.225
    7   HG22  THR  56          HG23      THR  56  17.535  -3.664 -13.615

  No H/Q in entry =           7
  In of MODEL   81
    1    H    LYS  57           H        LYS  57  17.407  -7.913 -11.539
    2    HA   LYS  57           HA       LYS  57  17.388  -9.102 -14.120
    3    HB2  LYS  57           HB2      LYS  57  19.168  -9.398 -12.371
    4    HB3  LYS  57           HB3      LYS  57  18.039 -10.370 -11.439
    5    HG2  LYS  57           HG2      LYS  57  17.921 -12.028 -13.212
    6    HG3  LYS  57           HG3      LYS  57  18.928 -11.035 -14.259
    7    HD2  LYS  57           HD2      LYS  57  20.398 -12.669 -13.341
    8    HD3  LYS  57           HD3      LYS  57  20.725 -11.194 -12.433
    9    HE2  LYS  57           HE2      LYS  57  19.412 -11.955 -10.560
   10    HE3  LYS  57           HE3      LYS  57  18.774 -13.321 -11.474
   11    HZ1  LYS  57           HZ1      LYS  57  21.637 -13.245 -11.421
   12    HZ3  LYS  57           HZ2      LYS  57  20.576 -14.521 -11.062
   13    HZ2  LYS  57           HZ3      LYS  57  20.957 -13.371  -9.873

  No H/Q in entry =          13
  In of MODEL   81
    1    H    LEU  58           H        LEU  58  15.585  -9.736 -11.150
    2    HA   LEU  58           HA       LEU  58  14.315 -12.081 -12.093
    3    HB2  LEU  58           HB2      LEU  58  13.556 -10.163  -9.896
    4    HB3  LEU  58           HB3      LEU  58  12.717 -11.683 -10.217
    5    HG   LEU  58           HG       LEU  58  15.694 -11.470  -9.654
    6   HD11  LEU  58          HD11      LEU  58  13.310 -11.840  -7.869
    7   HD13  LEU  58          HD12      LEU  58  14.783 -10.909  -7.600
    8   HD12  LEU  58          HD13      LEU  58  14.817 -12.666  -7.469
    9   HD22  LEU  58          HD21      LEU  58  15.534 -13.527 -10.687
   10   HD21  LEU  58          HD22      LEU  58  13.815 -13.700 -10.331
   11   HD23  LEU  58          HD23      LEU  58  15.014 -14.029  -9.079

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  59           H        ILE  59  13.718  -8.729 -12.770
    2    HA   ILE  59           HA       ILE  59  10.991  -9.316 -13.718
    3    HB   ILE  59           HB       ILE  59  11.843  -7.054 -12.507
    4   HG12  ILE  59          HG12      ILE  59   9.944  -6.887 -14.858
    5   HG13  ILE  59          HG13      ILE  59   9.506  -7.649 -13.351
    6   HG23  ILE  59          HG21      ILE  59  12.457  -5.341 -14.009
    7   HG22  ILE  59          HG22      ILE  59  11.943  -6.249 -15.413
    8   HG21  ILE  59          HG23      ILE  59  13.414  -6.698 -14.554
    9   HD12  ILE  59          HD11      ILE  59   8.810  -5.253 -13.462
   10   HD11  ILE  59          HD12      ILE  59  10.514  -4.814 -13.566
   11   HD13  ILE  59          HD13      ILE  59   9.894  -5.598 -12.113

  No H/Q in entry =          11
  In of MODEL   81
    1    H    GLU  60           H        GLU  60  14.216  -8.531 -14.967
    2    HA   GLU  60           HA       GLU  60  13.452  -8.109 -17.676
    3    HB2  GLU  60           HB2      GLU  60  15.640  -7.417 -16.842
    4    HB3  GLU  60           HB3      GLU  60  16.066  -9.091 -16.499
    5    HG2  GLU  60           HG2      GLU  60  15.901  -9.638 -18.896
    6    HG3  GLU  60           HG3      GLU  60  15.442  -7.973 -19.250

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLY  61           H        GLY  61  14.362 -11.014 -15.865
    2    HA3  GLY  61           HA2      GLY  61  13.791 -12.645 -18.271
    3    HA2  GLY  61           HA3      GLY  61  14.809 -13.151 -16.927

  No H/Q in entry =           3
  In of MODEL   81
    1    H    ASP  62           H        ASP  62  11.725 -11.537 -16.553
    2    HA   ASP  62           HA       ASP  62  10.740 -13.575 -14.815
    3    HB2  ASP  62           HB2      ASP  62  10.171 -11.228 -14.490
    4    HB3  ASP  62           HB3      ASP  62   9.363 -11.188 -16.054

  No H/Q in entry =           4
  In of MODEL   81
    1    H    ALA  63           H        ALA  63   9.782 -15.464 -15.380
    2    HA   ALA  63           HA       ALA  63   7.850 -15.541 -17.574
    3    HB1  ALA  63           HB1      ALA  63   9.047 -17.550 -18.592
    4    HB3  ALA  63           HB2      ALA  63  10.463 -17.059 -17.665
    5    HB2  ALA  63           HB3      ALA  63   9.793 -15.980 -18.889

  No H/Q in entry =           5
  In of MODEL   81
    1    H    GLY  64           H        GLY  64   9.614 -18.348 -16.560
    2    HA3  GLY  64           HA2      GLY  64   9.134 -19.879 -14.812
    3    HA2  GLY  64           HA3      GLY  64   7.592 -19.074 -14.563

  No H/Q in entry =           3
  In of MODEL   81
    1    H    GLU  65           H        GLU  65   5.960 -20.431 -15.024
    2    HA   GLU  65           HA       GLU  65   6.121 -22.807 -16.387
    3    HB2  GLU  65           HB2      GLU  65   3.759 -20.958 -16.088
    4    HB3  GLU  65           HB3      GLU  65   3.641 -22.598 -16.724
    5    HG2  GLU  65           HG2      GLU  65   4.577 -23.503 -14.655
    6    HG3  GLU  65           HG3      GLU  65   4.793 -21.875 -14.014

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLY  66           H        GLY  66   4.870 -23.405 -18.340
    2    HA3  GLY  66           HA2      GLY  66   6.067 -22.386 -20.667
    3    HA2  GLY  66           HA3      GLY  66   4.728 -23.515 -20.609

  No H/Q in entry =           3
  In of MODEL   81
    1    H    LYS  67           H        LYS  67   2.896 -21.802 -19.271
    2    HA   LYS  67           HA       LYS  67   1.834 -20.420 -21.517
    3    HB2  LYS  67           HB2      LYS  67   0.945 -20.651 -18.647
    4    HB3  LYS  67           HB3      LYS  67   0.015 -19.806 -19.891
    5    HG2  LYS  67           HG2      LYS  67  -0.014 -21.844 -21.272
    6    HG3  LYS  67           HG3      LYS  67   0.933 -22.694 -20.055
    7    HD2  LYS  67           HD2      LYS  67  -0.883 -22.385 -18.417
    8    HD3  LYS  67           HD3      LYS  67  -1.836 -21.533 -19.635
    9    HE2  LYS  67           HE2      LYS  67  -1.813 -23.539 -21.069
   10    HE3  LYS  67           HE3      LYS  67  -0.856 -24.395 -19.860
   11    HZ2  LYS  67           HZ1      LYS  67  -3.676 -23.622 -19.792
   12    HZ1  LYS  67           HZ2      LYS  67  -2.823 -23.644 -18.324
   13    HZ3  LYS  67           HZ3      LYS  67  -2.933 -25.053 -19.267

  No H/Q in entry =          13
  In of MODEL   81
    1    H    MET  68           H        MET  68   1.108 -18.279 -21.621
    2    HA   MET  68           HA       MET  68   2.974 -16.310 -21.503
    3    HB2  MET  68           HB2      MET  68  -0.020 -16.016 -21.235
    4    HB3  MET  68           HB3      MET  68   1.089 -14.708 -21.647
    5    HG2  MET  68           HG2      MET  68   0.780 -17.277 -23.226
    6    HG3  MET  68           HG3      MET  68   0.066 -15.726 -23.668
    7    HE1  MET  68           HE1      MET  68   1.113 -13.726 -24.010
    8    HE3  MET  68           HE2      MET  68   2.698 -13.462 -24.731
    9    HE2  MET  68           HE3      MET  68   2.537 -13.538 -22.978

  No H/Q in entry =           9
  In of MODEL   81
    1    H    LYS  69           H        LYS  69   1.842 -17.705 -18.702
    2    HA   LYS  69           HA       LYS  69   1.435 -15.448 -17.042
    3    HB2  LYS  69           HB2      LYS  69   2.235 -18.248 -16.233
    4    HB3  LYS  69           HB3      LYS  69   1.513 -17.021 -15.189
    5    HG2  LYS  69           HG2      LYS  69   0.209 -18.030 -17.729
    6    HG3  LYS  69           HG3      LYS  69  -0.142 -18.682 -16.128
    7    HD2  LYS  69           HD2      LYS  69  -0.625 -16.227 -15.461
    8    HD3  LYS  69           HD3      LYS  69  -0.708 -15.921 -17.197
    9    HE2  LYS  69           HE2      LYS  69  -2.450 -17.616 -17.447
   10    HE3  LYS  69           HE3      LYS  69  -2.328 -18.028 -15.737
   11    HZ3  LYS  69           HZ1      LYS  69  -3.251 -16.024 -15.101
   12    HZ2  LYS  69           HZ2      LYS  69  -4.155 -16.416 -16.484
   13    HZ1  LYS  69           HZ3      LYS  69  -2.911 -15.263 -16.577

  No H/Q in entry =          13
  In of MODEL   81
    1    H    VAL  70           H        VAL  70   2.708 -14.994 -14.994
    2    HA   VAL  70           HA       VAL  70   5.629 -15.028 -15.507
    3    HB   VAL  70           HB       VAL  70   5.716 -12.762 -14.507
    4   HG11  VAL  70          HG11      VAL  70   3.912 -13.158 -16.908
    5   HG13  VAL  70          HG12      VAL  70   5.653 -12.876 -16.912
    6   HG12  VAL  70          HG13      VAL  70   4.553 -11.586 -16.433
    7   HG21  VAL  70          HG21      VAL  70   2.691 -13.075 -14.492
    8   HG23  VAL  70          HG22      VAL  70   3.510 -11.523 -14.318
    9   HG22  VAL  70          HG23      VAL  70   3.735 -12.779 -13.101

  No H/Q in entry =           9
  In of MODEL   81
    1    H    SER  71           H        SER  71   6.895 -14.637 -13.499
    2    HA   SER  71           HA       SER  71   6.254 -16.463 -11.442
    3    HB2  SER  71           HB2      SER  71   8.560 -15.584 -12.038
    4    HB3  SER  71           HB3      SER  71   8.127 -14.103 -11.189
    5    HG   SER  71           HG       SER  71   8.925 -15.259  -9.579

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LEU  72           H        LEU  72   4.718 -16.278  -9.967
    2    HA   LEU  72           HA       LEU  72   3.217 -13.933  -9.522
    3    HB2  LEU  72           HB2      LEU  72   3.446 -16.495  -7.949
    4    HB3  LEU  72           HB3      LEU  72   2.296 -15.216  -7.564
    5    HG   LEU  72           HG       LEU  72   2.458 -16.532 -10.295
    6   HD13  LEU  72          HD11      LEU  72   1.856 -18.201  -8.585
    7   HD12  LEU  72          HD12      LEU  72   0.463 -17.812  -9.591
    8   HD11  LEU  72          HD13      LEU  72   0.599 -17.125  -7.973
    9   HD23  LEU  72          HD21      LEU  72  -0.016 -15.654 -10.221
   10   HD22  LEU  72          HD22      LEU  72   1.266 -14.507 -10.574
   11   HD21  LEU  72          HD23      LEU  72   0.580 -14.587  -8.954

  No H/Q in entry =          11
  In of MODEL   81
    1    H    VAL  73           H        VAL  73   5.836 -15.431  -7.744
    2    HA   VAL  73           HA       VAL  73   5.801 -13.904  -5.408
    3    HB   VAL  73           HB       VAL  73   7.972 -14.756  -4.981
    4   HG13  VAL  73          HG11      VAL  73   7.700 -17.131  -5.508
    5   HG12  VAL  73          HG12      VAL  73   6.537 -16.737  -6.773
    6   HG11  VAL  73          HG13      VAL  73   6.139 -16.432  -5.082
    7   HG23  VAL  73          HG21      VAL  73   9.093 -15.976  -7.051
    8   HG22  VAL  73          HG22      VAL  73   9.330 -14.249  -6.794
    9   HG21  VAL  73          HG23      VAL  73   8.143 -14.809  -7.971

  No H/Q in entry =           9
  In of MODEL   81
    1    H    LEU  74           H        LEU  74   6.821 -13.023  -8.578
    2    HA   LEU  74           HA       LEU  74   8.806 -11.118  -8.073
    3    HB2  LEU  74           HB2      LEU  74   8.343 -11.851 -10.315
    4    HB3  LEU  74           HB3      LEU  74   6.689 -11.248 -10.219
    5    HG   LEU  74           HG       LEU  74   7.571  -8.937  -9.959
    6   HD12  LEU  74          HD11      LEU  74  10.059  -8.726 -10.649
    7   HD11  LEU  74          HD12      LEU  74  10.191 -10.421 -10.182
    8   HD13  LEU  74          HD13      LEU  74   9.717  -9.211  -8.990
    9   HD22  LEU  74          HD21      LEU  74   7.887  -8.671 -12.229
   10   HD21  LEU  74          HD22      LEU  74   7.158 -10.260 -12.165
   11   HD23  LEU  74          HD23      LEU  74   8.890 -10.113 -12.365

  No H/Q in entry =          11
  In of MODEL   81
    1    H    VAL  75           H        VAL  75   5.321 -10.657  -8.438
    2    HA   VAL  75           HA       VAL  75   5.283  -7.900  -7.844
    3    HB   VAL  75           HB       VAL  75   3.146  -9.999  -7.470
    4   HG12  VAL  75          HG11      VAL  75   1.608  -8.004  -7.377
    5   HG11  VAL  75          HG12      VAL  75   3.025  -6.967  -7.311
    6   HG13  VAL  75          HG13      VAL  75   2.698  -8.085  -5.997
    7   HG21  VAL  75          HG21      VAL  75   4.089  -9.433  -9.793
    8   HG23  VAL  75          HG22      VAL  75   3.404  -7.825  -9.563
    9   HG22  VAL  75          HG23      VAL  75   2.348  -9.237  -9.595

  No H/Q in entry =           9
  In of MODEL   81
    1    H    GLU  76           H        GLU  76   4.958 -10.777  -5.744
    2    HA   GLU  76           HA       GLU  76   4.508  -9.412  -3.320
    3    HB2  GLU  76           HB2      GLU  76   4.276 -11.870  -3.552
    4    HB3  GLU  76           HB3      GLU  76   6.007 -12.012  -3.802
    5    HG2  GLU  76           HG2      GLU  76   5.572 -12.589  -1.505
    6    HG3  GLU  76           HG3      GLU  76   6.350 -11.016  -1.492

  No H/Q in entry =           6
  In of MODEL   81
    1    H    ALA  77           H        ALA  77   7.554 -10.382  -4.873
    2    HA   ALA  77           HA       ALA  77   9.257  -9.381  -2.848
    3    HB3  ALA  77           HB1      ALA  77  10.010  -9.436  -5.761
    4    HB1  ALA  77           HB2      ALA  77   9.818 -10.928  -4.840
    5    HB2  ALA  77           HB3      ALA  77  11.027  -9.740  -4.353

  No H/Q in entry =           5
  In of MODEL   81
    1    H    GLN  78           H        GLN  78   7.909  -7.926  -5.764
    2    HA   GLN  78           HA       GLN  78   9.316  -5.477  -5.646
    3    HB2  GLN  78           HB2      GLN  78   8.009  -6.357  -7.613
    4    HB3  GLN  78           HB3      GLN  78   6.531  -5.951  -6.743
    5    HG2  GLN  78           HG2      GLN  78   7.235  -3.595  -6.638
    6    HG3  GLN  78           HG3      GLN  78   8.717  -3.995  -7.506
    7   HE21  GLN  78          HE21      GLN  78   6.836  -2.127  -8.596
    8   HE22  GLN  78          HE22      GLN  78   6.138  -2.822  -9.980

  No H/Q in entry =           8
  In of MODEL   81
    1    H    LEU  79           H        LEU  79   6.265  -6.551  -4.233
    2    HA   LEU  79           HA       LEU  79   5.321  -4.125  -3.222
    3    HB2  LEU  79           HB2      LEU  79   3.960  -6.147  -3.178
    4    HB3  LEU  79           HB3      LEU  79   5.083  -6.915  -2.059
    5    HG   LEU  79           HG       LEU  79   4.560  -5.265  -0.330
    6   HD13  LEU  79          HD11      LEU  79   4.145  -3.238  -1.378
    7   HD12  LEU  79          HD12      LEU  79   2.506  -3.728  -0.948
    8   HD11  LEU  79          HD13      LEU  79   3.089  -3.959  -2.594
    9   HD23  LEU  79          HD21      LEU  79   1.963  -5.700  -0.254
   10   HD22  LEU  79          HD22      LEU  79   3.071  -7.064  -0.143
   11   HD21  LEU  79          HD23      LEU  79   2.273  -6.705  -1.671

  No H/Q in entry =          11
  In of MODEL   81
    1    H    HIS  80           H        HIS  80   7.443  -6.513  -1.635
    2    HA   HIS  80           HA       HIS  80   7.754  -4.984   0.740
    3    HB2  HIS  80           HB2      HIS  80   9.044  -7.375  -0.459
    4    HB3  HIS  80           HB3      HIS  80   9.969  -6.502   0.765
    5    HD1  HIS  80           HD1      HIS  80   9.452  -7.133   3.103
    6    HD2  HIS  80           HD2      HIS  80   6.229  -7.904   0.573
    7    HE1  HIS  80           HE1      HIS  80   7.648  -8.200   4.540
    8    HE2  HIS  80           HE2      HIS  80   5.677  -8.673   3.006

  No H/Q in entry =           8
  In of MODEL   81
    1    H    LEU  81           H        LEU  81   9.767  -5.298  -2.163
    2    HA   LEU  81           HA       LEU  81  11.846  -3.607  -1.270
    3    HB2  LEU  81           HB2      LEU  81  10.921  -4.371  -4.040
    4    HB3  LEU  81           HB3      LEU  81  12.363  -3.398  -3.739
    5    HG   LEU  81           HG       LEU  81  11.901  -6.113  -2.475
    6   HD12  LEU  81          HD11      LEU  81  13.711  -6.777  -4.217
    7   HD11  LEU  81          HD12      LEU  81  13.183  -5.338  -5.088
    8   HD13  LEU  81          HD13      LEU  81  12.039  -6.637  -4.759
    9   HD23  LEU  81          HD21      LEU  81  14.536  -5.859  -2.447
   10   HD22  LEU  81          HD22      LEU  81  13.565  -5.079  -1.199
   11   HD21  LEU  81          HD23      LEU  81  14.172  -4.137  -2.561

  No H/Q in entry =          11
  In of MODEL   81
    1    H    MET  82           H        MET  82   8.949  -2.898  -3.220
    2    HA   MET  82           HA       MET  82   9.555  -0.184  -3.710
    3    HB2  MET  82           HB2      MET  82   6.958  -1.718  -3.603
    4    HB3  MET  82           HB3      MET  82   7.000   0.007  -3.962
    5    HG2  MET  82           HG2      MET  82   8.560  -2.099  -5.495
    6    HG3  MET  82           HG3      MET  82   7.010  -1.439  -6.014
    7    HE3  MET  82           HE1      MET  82   7.546   2.008  -7.174
    8    HE2  MET  82           HE2      MET  82   7.157   1.786  -5.470
    9    HE1  MET  82           HE3      MET  82   6.473   0.695  -6.671

  No H/Q in entry =           9
  In of MODEL   81
    1    H    THR  83           H        THR  83   7.712  -1.746  -1.119
    2    HA   THR  83           HA       THR  83   6.910   0.618   0.209
    3    HB   THR  83           HB       THR  83   6.727  -0.959   2.222
    4    HG1  THR  83           HG1      THR  83   7.439  -2.925   1.991
    5   HG22  THR  83          HG21      THR  83   5.046  -2.481   0.741
    6   HG21  THR  83          HG22      THR  83   5.310  -1.155  -0.386
    7   HG23  THR  83          HG23      THR  83   4.668  -0.829   1.225

  No H/Q in entry =           7
  In of MODEL   81
    1    H    SER  84           H        SER  84   9.680  -1.548   0.739
    2    HA   SER  84           HA       SER  84  10.762  -0.149   2.937
    3    HB2  SER  84           HB2      SER  84  11.981  -2.016   0.914
    4    HB3  SER  84           HB3      SER  84  12.939  -1.289   2.202
    5    HG   SER  84           HG       SER  84  10.623  -2.924   2.445

  No H/Q in entry =           5
  In of MODEL   81
    1    H    MET  85           H        MET  85  11.539   0.103  -0.546
    2    HA   MET  85           HA       MET  85  13.583   2.019  -0.279
    3    HB2  MET  85           HB2      MET  85  13.166   0.752  -2.350
    4    HB3  MET  85           HB3      MET  85  11.663   1.644  -2.585
    5    HG2  MET  85           HG2      MET  85  12.922   3.760  -2.689
    6    HG3  MET  85           HG3      MET  85  14.426   2.881  -2.431
    7    HE1  MET  85           HE1      MET  85  11.911   4.228  -4.825
    8    HE3  MET  85           HE2      MET  85  11.161   2.644  -4.654
    9    HE2  MET  85           HE3      MET  85  11.855   3.115  -6.201

  No H/Q in entry =           9
  In of MODEL   81
    1    H    LEU  86           H        LEU  86  10.105   2.439  -0.805
    2    HA   LEU  86           HA       LEU  86  10.110   5.253  -0.980
    3    HB2  LEU  86           HB2      LEU  86   8.230   3.641  -1.570
    4    HB3  LEU  86           HB3      LEU  86   7.888   3.554   0.158
    5    HG   LEU  86           HG       LEU  86   7.790   6.118   0.112
    6   HD11  LEU  86          HD11      LEU  86   8.570   5.671  -2.587
    7   HD13  LEU  86          HD12      LEU  86   8.167   7.206  -1.825
    8   HD12  LEU  86          HD13      LEU  86   6.912   6.276  -2.639
    9   HD23  LEU  86          HD21      LEU  86   5.633   4.822  -1.566
   10   HD22  LEU  86          HD22      LEU  86   5.467   6.083  -0.347
   11   HD21  LEU  86          HD23      LEU  86   5.824   4.429   0.143

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ALA  87           H        ALA  87   9.577   3.080   1.758
    2    HA   ALA  87           HA       ALA  87   9.065   5.001   3.730
    3    HB1  ALA  87           HB1      ALA  87   9.803   2.162   3.640
    4    HB3  ALA  87           HB2      ALA  87   8.693   2.999   4.722
    5    HB2  ALA  87           HB3      ALA  87  10.420   2.987   5.075

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ARG  88           H        ARG  88  12.117   3.504   2.761
    2    HA   ARG  88           HA       ARG  88  13.751   4.837   4.606
    3    HB2  ARG  88           HB2      ARG  88  14.378   2.852   3.200
    4    HB3  ARG  88           HB3      ARG  88  14.564   3.944   1.831
    5    HG2  ARG  88           HG2      ARG  88  16.059   5.216   3.789
    6    HG3  ARG  88           HG3      ARG  88  16.336   3.519   4.164
    7    HD2  ARG  88           HD2      ARG  88  17.605   3.196   2.323
    8    HD3  ARG  88           HD3      ARG  88  16.495   4.098   1.287
    9    HE   ARG  88           HE       ARG  88  18.910   5.100   2.349
   10   HH21  ARG  88          HH11      ARG  88  19.310   7.310   2.163
   11   HH22  ARG  88          HH12      ARG  88  17.987   8.415   2.016
   12   HH11  ARG  88          HH21      ARG  88  15.592   5.935   2.056
   13   HH12  ARG  88          HH22      ARG  88  15.880   7.634   1.931

  No H/Q in entry =          13
  In of MODEL   81
    1    H    GLU  89           H        GLU  89  12.817   5.768   1.280
    2    HA   GLU  89           HA       GLU  89  14.422   8.090   1.138
    3    HB2  GLU  89           HB2      GLU  89  13.262   7.082  -0.819
    4    HB3  GLU  89           HB3      GLU  89  11.728   7.659  -0.167
    5    HG2  GLU  89           HG2      GLU  89  12.488   9.979  -0.319
    6    HG3  GLU  89           HG3      GLU  89  14.082   9.451  -0.849

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LEU  90           H        LEU  90  11.076   7.659   2.249
    2    HA   LEU  90           HA       LEU  90  10.625  10.403   2.830
    3    HB2  LEU  90           HB2      LEU  90   9.362   7.856   3.844
    4    HB3  LEU  90           HB3      LEU  90   8.769   9.466   4.268
    5    HG   LEU  90           HG       LEU  90   9.180   8.583   1.399
    6   HD12  LEU  90          HD11      LEU  90   6.638   8.317   1.448
    7   HD11  LEU  90          HD12      LEU  90   6.784   8.298   3.205
    8   HD13  LEU  90          HD13      LEU  90   7.576   7.051   2.241
    9   HD22  LEU  90          HD21      LEU  90   8.943  10.898   1.330
   10   HD21  LEU  90          HD22      LEU  90   7.950  10.951   2.786
   11   HD23  LEU  90          HD23      LEU  90   7.247  10.417   1.259

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  91           H        ILE  91  11.812   7.686   4.751
    2    HA   ILE  91           HA       ILE  91  11.974   9.040   7.223
    3    HB   ILE  91           HB       ILE  91  13.475   6.667   6.101
    4   HG12  ILE  91          HG12      ILE  91  11.452   6.878   8.351
    5   HG13  ILE  91          HG13      ILE  91  10.983   6.613   6.672
    6   HG22  ILE  91          HG21      ILE  91  13.927   6.435   8.743
    7   HG21  ILE  91          HG22      ILE  91  13.894   8.195   8.647
    8   HG23  ILE  91          HG23      ILE  91  15.055   7.281   7.685
    9   HD13  ILE  91          HD11      ILE  91  11.935   4.488   6.601
   10   HD12  ILE  91          HD12      ILE  91  11.335   4.556   8.258
   11   HD11  ILE  91          HD13      ILE  91  13.045   4.828   7.929

  No H/Q in entry =          11
  In of MODEL   81
    1    H    THR  92           H        THR  92  14.199   8.824   4.482
    2    HA   THR  92           HA       THR  92  16.392  10.161   5.656
    3    HB   THR  92           HB       THR  92  15.418  10.068   2.790
    4    HG1  THR  92           HG1      THR  92  16.200   8.150   3.194
    5   HG22  THR  92          HG21      THR  92  18.005  10.696   2.511
    6   HG21  THR  92          HG22      THR  92  17.710  11.520   4.041
    7   HG23  THR  92          HG23      THR  92  16.756  11.935   2.617

  No H/Q in entry =           7
  In of MODEL   81
    1    H    GLU  93           H        GLU  93  13.543  11.389   3.916
    2    HA   GLU  93           HA       GLU  93  14.204  14.134   4.041
    3    HB2  GLU  93           HB2      GLU  93  11.467  12.828   4.039
    4    HB3  GLU  93           HB3      GLU  93  11.798  14.521   3.673
    5    HG2  GLU  93           HG2      GLU  93  13.088  12.251   2.145
    6    HG3  GLU  93           HG3      GLU  93  11.562  12.973   1.653

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LEU  94           H        LEU  94  12.399  12.015   6.238
    2    HA   LEU  94           HA       LEU  94  11.628  13.976   8.116
    3    HB2  LEU  94           HB2      LEU  94  12.130  11.007   8.384
    4    HB3  LEU  94           HB3      LEU  94  11.576  11.992   9.735
    5    HG   LEU  94           HG       LEU  94  10.106  12.088   7.099
    6   HD11  LEU  94          HD11      LEU  94  10.125   9.860   9.097
    7   HD13  LEU  94          HD12      LEU  94   9.830   9.811   7.361
    8   HD12  LEU  94          HD13      LEU  94   8.560  10.355   8.454
    9   HD23  LEU  94          HD21      LEU  94   8.190  12.530   8.691
   10   HD22  LEU  94          HD22      LEU  94   9.459  13.753   8.738
   11   HD21  LEU  94          HD23      LEU  94   9.360  12.535  10.008

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  95           H        ILE  95  14.555  11.975   7.888
    2    HA   ILE  95           HA       ILE  95  15.733  12.861  10.309
    3    HB   ILE  95           HB       ILE  95  16.958  11.769   7.764
    4   HG12  ILE  95          HG12      ILE  95  16.620  10.568  10.527
    5   HG13  ILE  95          HG13      ILE  95  15.453  10.342   9.225
    6   HG21  ILE  95          HG21      ILE  95  18.220  12.538  10.414
    7   HG23  ILE  95          HG22      ILE  95  18.703  13.059   8.799
    8   HG22  ILE  95          HG23      ILE  95  18.966  11.390   9.304
    9   HD13  ILE  95          HD11      ILE  95  16.907   9.031   7.966
   10   HD12  ILE  95          HD12      ILE  95  17.361   8.566   9.602
   11   HD11  ILE  95          HD13      ILE  95  18.347   9.725   8.711

  No H/Q in entry =          11
  In of MODEL   81
    1    H    GLU  96           H        GLU  96  15.933  14.100   6.979
    2    HA   GLU  96           HA       GLU  96  17.828  16.131   7.471
    3    HB2  GLU  96           HB2      GLU  96  17.158  15.492   5.207
    4    HB3  GLU  96           HB3      GLU  96  15.528  16.088   5.501
    5    HG2  GLU  96           HG2      GLU  96  16.149  18.204   4.967
    6    HG3  GLU  96           HG3      GLU  96  17.441  18.169   6.156

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LEU  97           H        LEU  97  14.311  16.029   7.884
    2    HA   LEU  97           HA       LEU  97  13.959  18.771   8.531
    3    HB2  LEU  97           HB2      LEU  97  12.377  16.281   9.131
    4    HB3  LEU  97           HB3      LEU  97  11.899  17.838   9.805
    5    HG   LEU  97           HG       LEU  97  12.385  17.419   6.841
    6   HD12  LEU  97          HD11      LEU  97   9.860  17.353   6.711
    7   HD11  LEU  97          HD12      LEU  97   9.840  17.149   8.461
    8   HD13  LEU  97          HD13      LEU  97  10.596  15.925   7.439
    9   HD23  LEU  97          HD21      LEU  97  10.696  19.425   6.871
   10   HD22  LEU  97          HD22      LEU  97  12.383  19.742   7.272
   11   HD21  LEU  97          HD23      LEU  97  11.185  19.597   8.557

  No H/Q in entry =          11
  In of MODEL   81
    1    H    HIS  98           H        HIS  98  14.702  15.919  10.523
    2    HA   HIS  98           HA       HIS  98  14.564  17.177  13.041
    3    HB2  HIS  98           HB2      HIS  98  16.262  14.880  12.041
    4    HB3  HIS  98           HB3      HIS  98  16.267  15.413  13.724
    5    HD1  HIS  98           HD1      HIS  98  14.040  13.846  11.117
    6    HD2  HIS  98           HD2      HIS  98  13.937  14.756  15.184
    7    HE1  HIS  98           HE1      HIS  98  11.982  12.699  12.057
    8    HE2  HIS  98           HE2      HIS  98  11.899  13.245  14.529

  No H/Q in entry =           8
  In of MODEL   81
    1    H    GLU  99           H        GLU  99  17.125  17.006  10.618
    2    HA   GLU  99           HA       GLU  99  19.136  18.283  12.159
    3    HB2  GLU  99           HB2      GLU  99  19.592  16.990  10.089
    4    HB3  GLU  99           HB3      GLU  99  18.818  18.267   9.148
    5    HG2  GLU  99           HG2      GLU  99  20.463  19.895   9.951
    6    HG3  GLU  99           HG3      GLU  99  21.208  18.671  10.973

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LYS 100           H        LYS 100  16.651  19.514   9.935
    2    HA   LYS 100           HA       LYS 100  17.516  22.230  10.091
    3    HB2  LYS 100           HB2      LYS 100  14.855  21.009   9.321
    4    HB3  LYS 100           HB3      LYS 100  15.199  22.740   9.237
    5    HG2  LYS 100           HG2      LYS 100  17.165  22.247   7.778
    6    HG3  LYS 100           HG3      LYS 100  16.709  20.541   7.788
    7    HD2  LYS 100           HD2      LYS 100  14.532  21.108   6.780
    8    HD3  LYS 100           HD3      LYS 100  14.971  22.816   6.776
    9    HE2  LYS 100           HE2      LYS 100  16.924  22.291   5.324
   10    HE3  LYS 100           HE3      LYS 100  16.416  20.599   5.284
   11    HZ1  LYS 100           HZ1      LYS 100  14.651  22.839   4.447
   12    HZ3  LYS 100           HZ2      LYS 100  14.426  21.175   4.179
   13    HZ2  LYS 100           HZ3      LYS 100  15.661  22.009   3.366

  No H/Q in entry =          13
  In of MODEL   81
    1    H    LEU 101           H        LEU 101  15.360  20.232  12.041
    2    HA   LEU 101           HA       LEU 101  14.239  22.324  13.620
    3    HB2  LEU 101           HB2      LEU 101  14.605  19.363  13.997
    4    HB3  LEU 101           HB3      LEU 101  14.087  20.352  15.359
    5    HG   LEU 101           HG       LEU 101  12.684  20.484  12.684
    6   HD12  LEU 101          HD11      LEU 101  10.980  18.959  13.941
    7   HD11  LEU 101          HD12      LEU 101  12.360  18.508  14.940
    8   HD13  LEU 101          HD13      LEU 101  12.393  18.206  13.202
    9   HD21  LEU 101          HD21      LEU 101  12.035  21.285  15.535
   10   HD23  LEU 101          HD22      LEU 101  10.774  21.095  14.319
   11   HD22  LEU 101          HD23      LEU 101  12.040  22.299  14.090

  No H/Q in entry =          11
  In of MODEL   81
    1    H    LYS 102           H        LYS 102  17.372  21.638  13.196
    2    HA   LYS 102           HA       LYS 102  19.235  22.459  14.279
    3    HB2  LYS 102           HB2      LYS 102  17.454  24.016  15.409
    4    HB3  LYS 102           HB3      LYS 102  17.629  22.944  16.783
    5    HG2  LYS 102           HG2      LYS 102  19.577  24.910  15.628
    6    HG3  LYS 102           HG3      LYS 102  19.180  24.601  17.305
    7    HD2  LYS 102           HD2      LYS 102  20.805  22.652  15.620
    8    HD3  LYS 102           HD3      LYS 102  21.524  23.953  16.560
    9    HE2  LYS 102           HE2      LYS 102  21.057  21.412  17.519
   10    HE3  LYS 102           HE3      LYS 102  21.308  22.845  18.516
   11    HZ2  LYS 102           HZ1      LYS 102  19.304  21.610  19.121
   12    HZ1  LYS 102           HZ2      LYS 102  18.673  21.861  17.571
   13    HZ3  LYS 102           HZ3      LYS 102  18.933  23.181  18.601

  No H/Q in entry =          13
  In of MODEL   81
    1    H    ALA 103           H        ALA 103  17.112  20.899  16.687
    2    HA   ALA 103           HA       ALA 103  18.801  19.640  18.345
    3    HB2  ALA 103           HB1      ALA 103  17.166  17.673  18.326
    4    HB1  ALA 103           HB2      ALA 103  16.298  18.553  17.068
    5    HB3  ALA 103           HB3      ALA 103  16.487  19.264  18.669

  No H/Q in entry =           5
  In of MODEL   81
    1    H1   ALA   1           H3       ALA   1  -1.631  -6.579 -21.444
    2    H2   ALA   1           H2       ALA   1  -2.464  -7.994 -20.999
    3    H3   ALA   1           H1       ALA   1  -0.856  -8.084 -21.547
    4    HA   ALA   1           HA       ALA   1  -1.693  -8.525 -23.548
    5    HB1  ALA   1           HB1      ALA   1  -3.850  -9.189 -23.087
    6    HB2  ALA   1           HB2      ALA   1  -4.246  -7.665 -23.881
    7    HB3  ALA   1           HB3      ALA   1  -4.195  -7.753 -22.122

  No H/Q in entry =           7
  In of MODEL   81
    1    H    GLU   2           H        GLU   2  -2.483  -7.308 -25.537
    2    HA   GLU   2           HA       GLU   2  -1.028  -5.328 -26.402
    3    HB2  GLU   2           HB2      GLU   2  -4.035  -5.316 -26.734
    4    HB3  GLU   2           HB3      GLU   2  -2.887  -4.479 -27.775
    5    HG2  GLU   2           HG2      GLU   2  -2.428  -6.378 -28.934
    6    HG3  GLU   2           HG3      GLU   2  -2.161  -7.296 -27.458

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLU   3           H        GLU   3  -4.159  -3.992 -25.512
    2    HA   GLU   3           HA       GLU   3  -3.050  -1.466 -24.871
    3    HB2  GLU   3           HB2      GLU   3  -5.772  -2.712 -24.555
    4    HB3  GLU   3           HB3      GLU   3  -5.435  -1.107 -23.902
    5    HG2  GLU   3           HG2      GLU   3  -5.046  -0.183 -26.024
    6    HG3  GLU   3           HG3      GLU   3  -4.688  -1.746 -26.751

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LEU   4           H        LEU   4  -4.711  -3.790 -22.706
    2    HA   LEU   4           HA       LEU   4  -4.326  -2.579 -20.309
    3    HB2  LEU   4           HB2      LEU   4  -3.857  -5.532 -20.786
    4    HB3  LEU   4           HB3      LEU   4  -4.250  -4.781 -19.242
    5    HG   LEU   4           HG       LEU   4  -6.013  -4.800 -21.714
    6   HD13  LEU   4          HD11      LEU   4  -7.255  -6.490 -20.727
    7   HD12  LEU   4          HD12      LEU   4  -6.766  -6.048 -19.092
    8   HD11  LEU   4          HD13      LEU   4  -5.647  -6.917 -20.142
    9   HD23  LEU   4          HD21      LEU   4  -7.684  -3.952 -19.851
   10   HD22  LEU   4          HD22      LEU   4  -6.612  -2.805 -20.653
   11   HD21  LEU   4          HD23      LEU   4  -6.209  -3.411 -19.048

  No H/Q in entry =          11
  In of MODEL   81
    1    H    GLU   5           H        GLU   5  -1.868  -4.481 -22.035
    2    HA   GLU   5           HA       GLU   5   0.113  -4.255 -19.988
    3    HB2  GLU   5           HB2      GLU   5   0.154  -6.025 -21.730
    4    HB3  GLU   5           HB3      GLU   5   0.473  -4.793 -22.951
    5    HG2  GLU   5           HG2      GLU   5   2.557  -4.174 -21.814
    6    HG3  GLU   5           HG3      GLU   5   2.238  -5.363 -20.550

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLU   6           H        GLU   6  -0.464  -2.516 -23.030
    2    HA   GLU   6           HA       GLU   6   1.752  -0.743 -22.746
    3    HB2  GLU   6           HB2      GLU   6   0.647  -1.174 -24.918
    4    HB3  GLU   6           HB3      GLU   6  -0.812  -0.383 -24.319
    5    HG2  GLU   6           HG2      GLU   6   0.423   1.711 -24.006
    6    HG3  GLU   6           HG3      GLU   6   1.910   0.931 -24.540

  No H/Q in entry =           6
  In of MODEL   81
    1    H    VAL   7           H        VAL   7  -1.592  -0.730 -21.717
    2    HA   VAL   7           HA       VAL   7  -1.747   1.984 -20.872
    3    HB   VAL   7           HB       VAL   7  -3.278  -0.497 -20.051
    4   HG11  VAL   7          HG11      VAL   7  -3.581   2.398 -19.229
    5   HG13  VAL   7          HG12      VAL   7  -3.524   0.968 -18.198
    6   HG12  VAL   7          HG13      VAL   7  -4.944   1.278 -19.196
    7   HG21  VAL   7          HG21      VAL   7  -3.396   0.591 -22.437
    8   HG23  VAL   7          HG22      VAL   7  -4.312   1.861 -21.625
    9   HG22  VAL   7          HG23      VAL   7  -4.901   0.198 -21.606

  No H/Q in entry =           9
  In of MODEL   81
    1    H    VAL   8           H        VAL   8  -0.845  -1.031 -19.235
    2    HA   VAL   8           HA       VAL   8  -0.510   0.032 -16.634
    3    HB   VAL   8           HB       VAL   8   0.839  -2.316 -17.992
    4   HG13  VAL   8          HG11      VAL   8   2.270  -1.747 -16.192
    5   HG12  VAL   8          HG12      VAL   8   1.212  -2.991 -15.526
    6   HG11  VAL   8          HG13      VAL   8   0.921  -1.294 -15.150
    7   HG23  VAL   8          HG21      VAL   8  -1.151  -2.708 -15.810
    8   HG22  VAL   8          HG22      VAL   8  -0.968  -3.574 -17.332
    9   HG21  VAL   8          HG23      VAL   8  -1.815  -2.032 -17.296

  No H/Q in entry =           9
  In of MODEL   81
    1    H    MET   9           H        MET   9   1.742  -0.319 -19.372
    2    HA   MET   9           HA       MET   9   4.049   0.659 -18.098
    3    HB2  MET   9           HB2      MET   9   3.114   0.713 -20.964
    4    HB3  MET   9           HB3      MET   9   4.642   1.449 -20.483
    5    HG2  MET   9           HG2      MET   9   5.396  -0.691 -19.539
    6    HG3  MET   9           HG3      MET   9   3.857  -1.436 -19.971
    7    HE2  MET   9           HE1      MET   9   7.251   0.013 -22.611
    8    HE1  MET   9           HE2      MET   9   6.796   0.518 -20.986
    9    HE3  MET   9           HE3      MET   9   5.962   1.200 -22.379

  No H/Q in entry =           9
  In of MODEL   81
    1    H    GLY  10           H        GLY  10   1.416   2.338 -19.781
    2    HA3  GLY  10           HA2      GLY  10   2.449   4.964 -19.523
    3    HA2  GLY  10           HA3      GLY  10   0.749   4.550 -19.737

  No H/Q in entry =           3
  In of MODEL   81
    1    H    LEU  11           H        LEU  11   0.299   3.026 -17.458
    2    HA   LEU  11           HA       LEU  11  -0.187   5.010 -15.494
    3    HB2  LEU  11           HB2      LEU  11  -0.201   1.993 -15.348
    4    HB3  LEU  11           HB3      LEU  11  -0.688   3.025 -14.004
    5    HG   LEU  11           HG       LEU  11  -1.912   3.181 -16.772
    6   HD13  LEU  11          HD11      LEU  11  -2.557   1.052 -16.027
    7   HD12  LEU  11          HD12      LEU  11  -3.882   2.079 -15.483
    8   HD11  LEU  11          HD13      LEU  11  -2.644   1.561 -14.340
    9   HD22  LEU  11          HD21      LEU  11  -2.452   5.209 -15.761
   10   HD21  LEU  11          HD22      LEU  11  -2.402   4.536 -14.132
   11   HD23  LEU  11          HD23      LEU  11  -3.782   4.211 -15.181

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  12           H        ILE  12   2.289   2.477 -15.735
    2    HA   ILE  12           HA       ILE  12   3.499   2.972 -13.224
    3    HB   ILE  12           HB       ILE  12   4.733   1.906 -15.786
    4   HG12  ILE  12          HG12      ILE  12   2.685   0.726 -14.653
    5   HG13  ILE  12          HG13      ILE  12   4.062  -0.245 -15.132
    6   HG23  ILE  12          HG21      ILE  12   6.516   2.568 -14.310
    7   HG22  ILE  12          HG22      ILE  12   6.359   0.817 -14.164
    8   HG21  ILE  12          HG23      ILE  12   5.699   1.869 -12.913
    9   HD13  ILE  12          HD11      ILE  12   4.870  -0.278 -12.848
   10   HD12  ILE  12          HD12      ILE  12   3.175  -0.762 -12.847
   11   HD11  ILE  12          HD13      ILE  12   3.626   0.855 -12.354

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  13           H        ILE  13   4.147   4.230 -16.474
    2    HA   ILE  13           HA       ILE  13   6.328   5.889 -15.735
    3    HB   ILE  13           HB       ILE  13   4.309   6.034 -17.988
    4   HG12  ILE  13          HG12      ILE  13   6.100   4.144 -17.703
    5   HG13  ILE  13          HG13      ILE  13   5.867   4.887 -19.282
    6   HG22  ILE  13          HG21      ILE  13   5.975   7.603 -19.074
    7   HG21  ILE  13          HG22      ILE  13   6.769   7.751 -17.511
    8   HG23  ILE  13          HG23      ILE  13   5.104   8.296 -17.706
    9   HD13  ILE  13          HD11      ILE  13   7.829   6.290 -18.985
   10   HD12  ILE  13          HD12      ILE  13   8.283   4.638 -18.581
   11   HD11  ILE  13          HD13      ILE  13   7.968   5.799 -17.297

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ASN  14           H        ASN  14   2.837   6.480 -16.015
    2    HA   ASN  14           HA       ASN  14   2.867   9.224 -15.368
    3    HB2  ASN  14           HB2      ASN  14   0.933   7.637 -16.212
    4    HB3  ASN  14           HB3      ASN  14   0.600   7.462 -14.493
    5   HD21  ASN  14          HD21      ASN  14  -1.381   8.677 -15.929
    6   HD22  ASN  14          HD22      ASN  14  -1.399  10.351 -15.656

  No H/Q in entry =           6
  In of MODEL   81
    1    H    SER  15           H        SER  15   2.486   6.349 -13.303
    2    HA   SER  15           HA       SER  15   2.207   7.719 -10.851
    3    HB2  SER  15           HB2      SER  15   2.693   5.616  -9.807
    4    HB3  SER  15           HB3      SER  15   1.862   5.223 -11.308
    5    HG   SER  15           HG       SER  15   3.827   4.769 -12.254

  No H/Q in entry =           5
  In of MODEL   81
    1    H    GLY  16           H        GLY  16   5.059   6.551 -12.603
    2    HA3  GLY  16           HA2      GLY  16   6.996   7.249 -10.662
    3    HA2  GLY  16           HA3      GLY  16   7.300   7.044 -12.386

  No H/Q in entry =           3
  In of MODEL   81
    1    H    GLN  17           H        GLN  17   5.668   9.050 -13.448
    2    HA   GLN  17           HA       GLN  17   7.306  11.347 -13.126
    3    HB2  GLN  17           HB2      GLN  17   4.560  10.974 -14.350
    4    HB3  GLN  17           HB3      GLN  17   5.427  12.510 -14.388
    5    HG2  GLN  17           HG2      GLN  17   6.247   9.886 -15.642
    6    HG3  GLN  17           HG3      GLN  17   5.959  11.429 -16.444
    7   HE21  GLN  17          HE21      GLN  17   8.461   9.931 -16.635
    8   HE22  GLN  17          HE22      GLN  17   9.669  10.891 -15.926

  No H/Q in entry =           8
  In of MODEL   81
    1    H    ALA  18           H        ALA  18   4.174  10.407 -11.792
    2    HA   ALA  18           HA       ALA  18   3.507  12.810 -10.521
    3    HB1  ALA  18           HB1      ALA  18   2.315  10.384 -10.756
    4    HB2  ALA  18           HB2      ALA  18   1.794  11.614  -9.607
    5    HB3  ALA  18           HB3      ALA  18   2.848  10.302  -9.077

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ARG  19           H        ARG  19   5.304   9.995  -9.244
    2    HA   ARG  19           HA       ARG  19   5.856  11.130  -6.716
    3    HB2  ARG  19           HB2      ARG  19   6.210   8.719  -7.250
    4    HB3  ARG  19           HB3      ARG  19   7.582   9.173  -8.264
    5    HG2  ARG  19           HG2      ARG  19   8.721  10.177  -6.334
    6    HG3  ARG  19           HG3      ARG  19   7.331   9.821  -5.309
    7    HD2  ARG  19           HD2      ARG  19   9.049   8.140  -4.950
    8    HD3  ARG  19           HD3      ARG  19   7.658   7.396  -5.744
    9    HE   ARG  19           HE       ARG  19   9.391   8.177  -7.781
   10   HH21  ARG  19          HH11      ARG  19  10.918   6.736  -8.631
   11   HH22  ARG  19          HH12      ARG  19  11.425   5.371  -7.698
   12   HH11  ARG  19          HH21      ARG  19   9.400   6.137  -5.010
   13   HH12  ARG  19          HH22      ARG  19  10.563   5.031  -5.646

  No H/Q in entry =          13
  In of MODEL   81
    1    H    SER  20           H        SER  20   7.686  11.123  -9.758
    2    HA   SER  20           HA       SER  20   9.962  12.478  -8.920
    3    HB2  SER  20           HB2      SER  20   9.721  11.501 -11.173
    4    HB3  SER  20           HB3      SER  20   8.548  12.747 -11.582
    5    HG   SER  20           HG       SER  20  10.778  13.839 -10.541

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LEU  21           H        LEU  21   6.901  13.829 -10.125
    2    HA   LEU  21           HA       LEU  21   7.640  16.556  -9.889
    3    HB2  LEU  21           HB2      LEU  21   4.937  15.198  -9.826
    4    HB3  LEU  21           HB3      LEU  21   5.145  16.948  -9.819
    5    HG   LEU  21           HG       LEU  21   6.302  15.134 -11.957
    6   HD13  LEU  21          HD11      LEU  21   3.904  14.949 -12.098
    7   HD12  LEU  21          HD12      LEU  21   4.417  16.069 -13.361
    8   HD11  LEU  21          HD13      LEU  21   3.703  16.687 -11.872
    9   HD21  LEU  21          HD21      LEU  21   6.172  18.106 -11.504
   10   HD23  LEU  21          HD22      LEU  21   6.137  17.512 -13.162
   11   HD22  LEU  21          HD23      LEU  21   7.510  17.145 -12.128

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ALA  22           H        ALA  22   6.062  14.298  -7.654
    2    HA   ALA  22           HA       ALA  22   5.496  16.113  -5.583
    3    HB3  ALA  22           HB1      ALA  22   4.677  13.741  -5.757
    4    HB2  ALA  22           HB2      ALA  22   5.270  14.193  -4.159
    5    HB1  ALA  22           HB3      ALA  22   6.274  13.213  -5.229

  No H/Q in entry =           5
  In of MODEL   81
    1    H    TYR  23           H        TYR  23   8.381  14.018  -6.017
    2    HA   TYR  23           HA       TYR  23   9.780  14.995  -3.756
    3    HB2  TYR  23           HB2      TYR  23  10.522  12.973  -4.920
    4    HB3  TYR  23           HB3      TYR  23  10.865  13.910  -6.373
    5    HD1  TYR  23           HD1      TYR  23  11.801  13.535  -2.778
    6    HD2  TYR  23           HD2      TYR  23  12.930  15.029  -6.645
    7    HE1  TYR  23           HE1      TYR  23  14.069  14.052  -1.917
    8    HE2  TYR  23           HE2      TYR  23  15.197  15.548  -5.782
    9    HH   TYR  23           HH       TYR  23  16.110  14.765  -2.426

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ALA  24           H        ALA  24   9.637  16.117  -7.119
    2    HA   ALA  24           HA       ALA  24  11.581  18.156  -6.859
    3    HB2  ALA  24           HB1      ALA  24  11.148  18.236  -9.069
    4    HB3  ALA  24           HB2      ALA  24   9.610  19.021  -8.713
    5    HB1  ALA  24           HB3      ALA  24   9.694  17.266  -8.849

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ALA  25           H        ALA  25   8.096  18.052  -6.252
    2    HA   ALA  25           HA       ALA  25   7.678  20.778  -5.675
    3    HB1  ALA  25           HB1      ALA  25   5.971  18.820  -5.889
    4    HB2  ALA  25           HB2      ALA  25   5.629  20.113  -4.738
    5    HB3  ALA  25           HB3      ALA  25   6.281  18.575  -4.170

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LEU  26           H        LEU  26   8.675  18.068  -3.630
    2    HA   LEU  26           HA       LEU  26   8.804  19.489  -1.188
    3    HB2  LEU  26           HB2      LEU  26   8.843  17.070  -1.190
    4    HB3  LEU  26           HB3      LEU  26  10.317  17.047  -2.155
    5    HG   LEU  26           HG       LEU  26  11.550  18.131  -0.307
    6   HD12  LEU  26          HD11      LEU  26  10.316  18.160   1.948
    7   HD11  LEU  26          HD12      LEU  26   8.829  18.059   1.007
    8   HD13  LEU  26          HD13      LEU  26   9.906  19.442   0.807
    9   HD21  LEU  26          HD21      LEU  26   9.957  15.696   0.552
   10   HD23  LEU  26          HD22      LEU  26  11.483  16.222   1.257
   11   HD22  LEU  26          HD23      LEU  26  11.431  15.669  -0.415

  No H/Q in entry =          11
  In of MODEL   81
    1    H    LYS  27           H        LYS  27  11.217  18.869  -3.706
    2    HA   LYS  27           HA       LYS  27  13.423  20.056  -2.466
    3    HB2  LYS  27           HB2      LYS  27  13.503  18.714  -4.559
    4    HB3  LYS  27           HB3      LYS  27  12.771  20.065  -5.423
    5    HG2  LYS  27           HG2      LYS  27  14.667  21.507  -4.834
    6    HG3  LYS  27           HG3      LYS  27  15.395  20.195  -3.899
    7    HD2  LYS  27           HD2      LYS  27  15.515  18.811  -5.956
    8    HD3  LYS  27           HD3      LYS  27  14.833  20.147  -6.883
    9    HE2  LYS  27           HE2      LYS  27  16.750  21.569  -6.259
   10    HE3  LYS  27           HE3      LYS  27  17.436  20.236  -5.323
   11    HZ3  LYS  27           HZ1      LYS  27  18.436  20.320  -7.505
   12    HZ2  LYS  27           HZ2      LYS  27  16.910  20.238  -8.252
   13    HZ1  LYS  27           HZ3      LYS  27  17.501  18.912  -7.370

  No H/Q in entry =          13
  In of MODEL   81
    1    H    GLN  28           H        GLN  28  10.840  21.502  -4.420
    2    HA   GLN  28           HA       GLN  28  11.858  24.133  -4.561
    3    HB2  GLN  28           HB2      GLN  28   9.002  23.126  -4.462
    4    HB3  GLN  28           HB3      GLN  28   9.454  24.789  -4.831
    5    HG2  GLN  28           HG2      GLN  28  10.408  22.363  -6.378
    6    HG3  GLN  28           HG3      GLN  28   9.090  23.418  -6.884
    7   HE21  GLN  28          HE21      GLN  28  12.230  22.879  -7.599
    8   HE22  GLN  28          HE22      GLN  28  12.736  24.456  -7.969

  No H/Q in entry =           8
  In of MODEL   81
    1    H    ALA  29           H        ALA  29   9.881  22.477  -2.137
    2    HA   ALA  29           HA       ALA  29   9.373  24.675  -0.450
    3    HB2  ALA  29           HB1      ALA  29   8.604  23.118   1.110
    4    HB1  ALA  29           HB2      ALA  29   9.801  21.909   0.646
    5    HB3  ALA  29           HB3      ALA  29   8.426  22.236  -0.406

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LYS  30           H        LYS  30  12.054  22.349  -0.517
    2    HA   LYS  30           HA       LYS  30  13.383  23.267   1.794
    3    HB2  LYS  30           HB2      LYS  30  14.461  21.965  -0.717
    4    HB3  LYS  30           HB3      LYS  30  15.446  22.298   0.710
    5    HG2  LYS  30           HG2      LYS  30  13.857  20.945   2.079
    6    HG3  LYS  30           HG3      LYS  30  12.969  20.547   0.605
    7    HD2  LYS  30           HD2      LYS  30  14.995  19.519  -0.352
    8    HD3  LYS  30           HD3      LYS  30  15.903  19.931   1.105
    9    HE2  LYS  30           HE2      LYS  30  14.363  18.528   2.449
   10    HE3  LYS  30           HE3      LYS  30  13.484  18.096   0.977
   11    HZ2  LYS  30           HZ1      LYS  30  15.238  16.477   1.739
   12    HZ1  LYS  30           HZ2      LYS  30  16.402  17.641   1.296
   13    HZ3  LYS  30           HZ3      LYS  30  15.356  16.983   0.125

  No H/Q in entry =          13
  In of MODEL   81
    1    H    GLN  31           H        GLN  31  13.313  24.484  -1.500
    2    HA   GLN  31           HA       GLN  31  15.505  26.328  -1.064
    3    HB2  GLN  31           HB2      GLN  31  13.471  26.426  -3.296
    4    HB3  GLN  31           HB3      GLN  31  15.106  27.086  -3.289
    5    HG2  GLN  31           HG2      GLN  31  15.507  24.379  -2.720
    6    HG3  GLN  31           HG3      GLN  31  14.207  24.357  -3.904
    7   HE21  GLN  31          HE21      GLN  31  17.034  23.504  -4.300
    8   HE22  GLN  31          HE22      GLN  31  17.632  24.468  -5.561

  No H/Q in entry =           8
  In of MODEL   81
    1    H    GLY  32           H        GLY  32  12.423  26.209   0.069
    2    HA3  GLY  32           HA2      GLY  32  11.296  27.798   1.343
    3    HA2  GLY  32           HA3      GLY  32  12.450  29.011   0.801

  No H/Q in entry =           3
  In of MODEL   81
    1    H    ASP  33           H        ASP  33  11.054  27.144  -1.702
    2    HA   ASP  33           HA       ASP  33   9.442  29.455  -2.556
    3    HB2  ASP  33           HB2      ASP  33  10.488  27.017  -4.002
    4    HB3  ASP  33           HB3      ASP  33   9.364  28.160  -4.733

  No H/Q in entry =           4
  In of MODEL   81
    1    H    PHE  34           H        PHE  34   7.738  29.011  -1.000
    2    HA   PHE  34           HA       PHE  34   6.305  26.569  -0.917
    3    HB2  PHE  34           HB2      PHE  34   5.402  29.375  -0.232
    4    HB3  PHE  34           HB3      PHE  34   4.520  27.902   0.171
    5    HD1  PHE  34           HD1      PHE  34   6.817  30.247   1.401
    6    HD2  PHE  34           HD2      PHE  34   6.045  26.022   1.332
    7    HE1  PHE  34           HE1      PHE  34   8.194  29.960   3.442
    8    HE2  PHE  34           HE2      PHE  34   7.425  25.739   3.371
    9    HZ   PHE  34           HZ       PHE  34   8.494  27.709   4.425

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ALA  35           H        ALA  35   5.944  29.448  -2.921
    2    HA   ALA  35           HA       ALA  35   3.384  28.892  -3.957
    3    HB1  ALA  35           HB1      ALA  35   4.473  30.268  -5.986
    4    HB3  ALA  35           HB2      ALA  35   5.694  30.599  -4.757
    5    HB2  ALA  35           HB3      ALA  35   4.011  31.043  -4.471

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ALA  36           H        ALA  36   6.602  28.153  -5.302
    2    HA   ALA  36           HA       ALA  36   5.591  26.753  -7.553
    3    HB3  ALA  36           HB1      ALA  36   7.754  26.833  -8.161
    4    HB2  ALA  36           HB2      ALA  36   8.208  25.790  -6.812
    5    HB1  ALA  36           HB3      ALA  36   8.140  27.539  -6.591

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ALA  37           H        ALA  37   6.513  25.728  -4.298
    2    HA   ALA  37           HA       ALA  37   6.396  22.943  -4.736
    3    HB2  ALA  37           HB1      ALA  37   6.165  24.732  -2.353
    4    HB1  ALA  37           HB2      ALA  37   7.271  23.391  -2.645
    5    HB3  ALA  37           HB3      ALA  37   5.600  23.072  -2.181

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LYS  38           H        LYS  38   3.907  25.202  -3.570
    2    HA   LYS  38           HA       LYS  38   1.769  23.434  -3.361
    3    HB2  LYS  38           HB2      LYS  38   2.178  26.181  -3.100
    4    HB3  LYS  38           HB3      LYS  38   0.981  26.063  -4.383
    5    HG2  LYS  38           HG2      LYS  38  -0.502  24.767  -2.950
    6    HG3  LYS  38           HG3      LYS  38   0.736  24.676  -1.690
    7    HD2  LYS  38           HD2      LYS  38   0.599  27.015  -1.236
    8    HD3  LYS  38           HD3      LYS  38  -0.301  27.328  -2.720
    9    HE2  LYS  38           HE2      LYS  38  -1.811  27.388  -0.786
   10    HE3  LYS  38           HE3      LYS  38  -2.211  26.024  -1.834
   11    HZ3  LYS  38           HZ1      LYS  38  -1.522  24.533  -0.303
   12    HZ2  LYS  38           HZ2      LYS  38  -1.850  25.794   0.789
   13    HZ1  LYS  38           HZ3      LYS  38  -0.259  25.511   0.269

  No H/Q in entry =          13
  In of MODEL   81
    1    H    ALA  39           H        ALA  39   2.799  25.323  -6.200
    2    HA   ALA  39           HA       ALA  39   0.711  24.506  -7.913
    3    HB2  ALA  39           HB1      ALA  39   3.465  25.098  -8.955
    4    HB1  ALA  39           HB2      ALA  39   2.523  26.378  -8.189
    5    HB3  ALA  39           HB3      ALA  39   1.898  25.558  -9.620

  No H/Q in entry =           5
  In of MODEL   81
    1    H    MET  40           H        MET  40   3.919  23.136  -7.326
    2    HA   MET  40           HA       MET  40   3.785  21.124  -9.324
    3    HB2  MET  40           HB2      MET  40   5.392  21.306  -6.769
    4    HB3  MET  40           HB3      MET  40   5.620  20.048  -7.987
    5    HG2  MET  40           HG2      MET  40   5.743  23.005  -8.642
    6    HG3  MET  40           HG3      MET  40   7.168  22.070  -8.191
    7    HE3  MET  40           HE1      MET  40   8.003  19.845 -11.003
    8    HE2  MET  40           HE2      MET  40   7.427  19.533  -9.369
    9    HE1  MET  40           HE3      MET  40   8.552  20.857  -9.660

  No H/Q in entry =           9
  In of MODEL   81
    1    H    MET  41           H        MET  41   2.859  21.176  -5.903
    2    HA   MET  41           HA       MET  41   2.267  18.422  -5.636
    3    HB2  MET  41           HB2      MET  41   0.979  20.803  -4.282
    4    HB3  MET  41           HB3      MET  41   0.786  19.128  -3.780
    5    HG2  MET  41           HG2      MET  41   3.501  19.293  -3.807
    6    HG3  MET  41           HG3      MET  41   3.094  20.959  -3.408
    7    HE2  MET  41           HE1      MET  41   0.022  19.766  -1.697
    8    HE1  MET  41           HE2      MET  41   0.872  21.263  -2.067
    9    HE3  MET  41           HE3      MET  41   0.795  20.688  -0.401

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ASP  42           H        ASP  42   0.290  21.192  -6.609
    2    HA   ASP  42           HA       ASP  42  -2.179  19.884  -6.759
    3    HB2  ASP  42           HB2      ASP  42  -1.417  22.439  -7.004
    4    HB3  ASP  42           HB3      ASP  42  -1.570  22.053  -8.715

  No H/Q in entry =           4
  In of MODEL   81
    1    H    GLN  43           H        GLN  43   0.283  20.431  -9.250
    2    HA   GLN  43           HA       GLN  43  -1.124  19.147 -11.348
    3    HB2  GLN  43           HB2      GLN  43   1.844  19.600 -10.954
    4    HB3  GLN  43           HB3      GLN  43   1.122  18.980 -12.441
    5    HG2  GLN  43           HG2      GLN  43  -0.347  21.039 -12.482
    6    HG3  GLN  43           HG3      GLN  43   0.615  21.670 -11.148
    7   HE21  GLN  43          HE21      GLN  43   0.818  23.293 -13.229
    8   HE22  GLN  43          HE22      GLN  43   2.231  23.046 -14.132

  No H/Q in entry =           8
  In of MODEL   81
    1    H    SER  44           H        SER  44   1.194  17.951  -8.953
    2    HA   SER  44           HA       SER  44   1.478  15.341  -9.985
    3    HB2  SER  44           HB2      SER  44   2.395  16.754  -7.741
    4    HB3  SER  44           HB3      SER  44   1.501  15.387  -7.078
    5    HG   SER  44           HG       SER  44   3.600  14.725  -7.498

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ARG  45           H        ARG  45  -0.822  16.700  -7.651
    2    HA   ARG  45           HA       ARG  45  -2.260  14.367  -7.029
    3    HB2  ARG  45           HB2      ARG  45  -2.418  16.535  -5.831
    4    HB3  ARG  45           HB3      ARG  45  -3.254  17.223  -7.219
    5    HG2  ARG  45           HG2      ARG  45  -5.057  15.534  -6.947
    6    HG3  ARG  45           HG3      ARG  45  -4.231  14.900  -5.523
    7    HD2  ARG  45           HD2      ARG  45  -4.394  17.167  -4.461
    8    HD3  ARG  45           HD3      ARG  45  -5.365  17.711  -5.845
    9    HE   ARG  45           HE       ARG  45  -6.528  15.356  -4.816
   10   HH21  ARG  45          HH11      ARG  45  -8.366  15.465  -3.552
   11   HH22  ARG  45          HH12      ARG  45  -8.735  16.909  -2.680
   12   HH11  ARG  45          HH21      ARG  45  -5.919  18.587  -3.780
   13   HH12  ARG  45          HH22      ARG  45  -7.344  18.678  -2.808

  No H/Q in entry =          13
  In of MODEL   81
    1    H    MET  46           H        MET  46  -2.785  16.790  -9.574
    2    HA   MET  46           HA       MET  46  -5.144  15.669 -10.648
    3    HB2  MET  46           HB2      MET  46  -2.999  17.447 -11.823
    4    HB3  MET  46           HB3      MET  46  -4.406  16.936 -12.760
    5    HG2  MET  46           HG2      MET  46  -5.902  17.897 -11.066
    6    HG3  MET  46           HG3      MET  46  -4.518  18.374 -10.090
    7    HE3  MET  46           HE1      MET  46  -6.444  21.244 -11.244
    8    HE2  MET  46           HE2      MET  46  -4.858  21.683 -10.620
    9    HE1  MET  46           HE3      MET  46  -5.724  20.315  -9.923

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ALA  47           H        ALA  47  -1.723  15.123 -11.395
    2    HA   ALA  47           HA       ALA  47  -2.094  13.409 -13.612
    3    HB3  ALA  47           HB1      ALA  47   0.099  14.254 -13.249
    4    HB2  ALA  47           HB2      ALA  47   0.205  12.522 -12.920
    5    HB1  ALA  47           HB3      ALA  47   0.130  13.671 -11.584

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LEU  48           H        LEU  48  -1.851  12.758 -10.139
    2    HA   LEU  48           HA       LEU  48  -2.001   9.921 -10.306
    3    HB2  LEU  48           HB2      LEU  48  -2.735  11.847  -8.089
    4    HB3  LEU  48           HB3      LEU  48  -2.677  10.094  -7.894
    5    HG   LEU  48           HG       LEU  48  -0.341  11.750  -8.877
    6   HD13  LEU  48          HD11      LEU  48  -0.616  12.519  -6.685
    7   HD12  LEU  48          HD12      LEU  48   0.520  11.188  -6.486
    8   HD11  LEU  48          HD13      LEU  48  -1.185  10.958  -6.096
    9   HD22  LEU  48          HD21      LEU  48   0.117   9.557  -9.523
   10   HD21  LEU  48          HD22      LEU  48  -0.772   8.855  -8.172
   11   HD23  LEU  48          HD23      LEU  48   0.814   9.576  -7.904

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ASN  49           H        ASN  49  -4.416  12.461  -9.906
    2    HA   ASN  49           HA       ASN  49  -6.636  10.839  -9.380
    3    HB2  ASN  49           HB2      ASN  49  -6.661  13.253  -9.042
    4    HB3  ASN  49           HB3      ASN  49  -6.461  13.528 -10.769
    5   HD21  ASN  49          HD21      ASN  49  -8.726  12.086  -8.402
    6   HD22  ASN  49          HD22      ASN  49 -10.114  12.354  -9.337

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLU  50           H        GLU  50  -5.321  12.019 -12.459
    2    HA   GLU  50           HA       GLU  50  -7.294  10.808 -14.116
    3    HB2  GLU  50           HB2      GLU  50  -5.789  12.599 -14.919
    4    HB3  GLU  50           HB3      GLU  50  -4.417  11.499 -14.779
    5    HG2  GLU  50           HG2      GLU  50  -5.415   9.988 -16.424
    6    HG3  GLU  50           HG3      GLU  50  -6.855  10.996 -16.514

  No H/Q in entry =           6
  In of MODEL   81
    1    H    ALA  51           H        ALA  51  -4.149   9.749 -12.901
    2    HA   ALA  51           HA       ALA  51  -4.053   7.298 -14.326
    3    HB2  ALA  51           HB1      ALA  51  -2.082   6.967 -13.219
    4    HB1  ALA  51           HB2      ALA  51  -2.768   7.398 -11.653
    5    HB3  ALA  51           HB3      ALA  51  -2.282   8.663 -12.782

  No H/Q in entry =           5
  In of MODEL   81
    1    H    HIS  52           H        HIS  52  -5.221   8.143 -11.079
    2    HA   HIS  52           HA       HIS  52  -5.963   5.545 -10.259
    3    HB2  HIS  52           HB2      HIS  52  -5.789   7.527  -8.759
    4    HB3  HIS  52           HB3      HIS  52  -7.260   8.168  -9.488
    5    HD1  HIS  52           HD1      HIS  52  -9.491   6.874  -9.026
    6    HD2  HIS  52           HD2      HIS  52  -6.194   5.384  -6.957
    7    HE1  HIS  52           HE1      HIS  52 -10.404   5.317  -7.249
    8    HE2  HIS  52           HE2      HIS  52  -8.406   4.400  -5.978

  No H/Q in entry =           8
  In of MODEL   81
    1    H    LEU  53           H        LEU  53  -7.725   8.045 -12.046
    2    HA   LEU  53           HA       LEU  53 -10.256   6.804 -12.073
    3    HB2  LEU  53           HB2      LEU  53  -8.925   8.764 -13.930
    4    HB3  LEU  53           HB3      LEU  53 -10.535   8.132 -14.262
    5    HG   LEU  53           HG       LEU  53  -9.810   9.421 -11.613
    6   HD13  LEU  53          HD11      LEU  53  -9.466  11.057 -13.418
    7   HD12  LEU  53          HD12      LEU  53 -10.908  11.459 -12.486
    8   HD11  LEU  53          HD13      LEU  53 -11.062  10.693 -14.063
    9   HD23  LEU  53          HD21      LEU  53 -12.391   9.872 -11.784
   10   HD22  LEU  53          HD22      LEU  53 -11.836   8.272 -11.310
   11   HD21  LEU  53          HD23      LEU  53 -12.378   8.558 -12.952

  No H/Q in entry =          11
  In of MODEL   81
    1    H    VAL  54           H        VAL  54  -7.501   6.557 -14.299
    2    HA   VAL  54           HA       VAL  54  -8.753   4.817 -16.153
    3    HB   VAL  54           HB       VAL  54  -5.838   5.262 -15.457
    4   HG12  VAL  54          HG11      VAL  54  -5.603   4.179 -17.849
    5   HG11  VAL  54          HG12      VAL  54  -7.149   3.428 -17.454
    6   HG13  VAL  54          HG13      VAL  54  -5.744   3.142 -16.430
    7   HG22  VAL  54          HG21      VAL  54  -6.563   7.223 -16.499
    8   HG21  VAL  54          HG22      VAL  54  -7.770   6.388 -17.475
    9   HG23  VAL  54          HG23      VAL  54  -6.064   6.274 -17.898

  No H/Q in entry =           9
  In of MODEL   81
    1    H    GLN  55           H        GLN  55  -6.778   4.221 -13.247
    2    HA   GLN  55           HA       GLN  55  -6.745   1.404 -13.512
    3    HB2  GLN  55           HB2      GLN  55  -5.178   2.263 -11.983
    4    HB3  GLN  55           HB3      GLN  55  -6.377   3.251 -11.156
    5    HG2  GLN  55           HG2      GLN  55  -7.108   1.505  -9.846
    6    HG3  GLN  55           HG3      GLN  55  -6.903   0.318 -11.127
    7   HE21  GLN  55          HE21      GLN  55  -5.312  -1.167 -10.631
    8   HE22  GLN  55          HE22      GLN  55  -3.924  -0.848  -9.712

  No H/Q in entry =           8
  In of MODEL   81
    1    H    THR  56           H        THR  56  -9.038   3.610 -11.900
    2    HA   THR  56           HA       THR  56 -10.666   1.756 -10.623
    3    HB   THR  56           HB       THR  56 -11.703   4.172 -12.126
    4    HG1  THR  56           HG1      THR  56  -9.986   3.954 -10.020
    5   HG21  THR  56          HG21      THR  56 -12.621   2.676  -9.660
    6   HG23  THR  56          HG22      THR  56 -13.452   2.763 -11.213
    7   HG22  THR  56          HG23      THR  56 -13.311   4.204 -10.205

  No H/Q in entry =           7
  In of MODEL   81
    1    H    LYS  57           H        LYS  57 -10.831   2.853 -14.007
    2    HA   LYS  57           HA       LYS  57 -13.019   1.214 -14.774
    3    HB2  LYS  57           HB2      LYS  57 -12.090   3.152 -16.080
    4    HB3  LYS  57           HB3      LYS  57 -10.676   2.176 -16.451
    5    HG2  LYS  57           HG2      LYS  57 -12.041   0.560 -17.650
    6    HG3  LYS  57           HG3      LYS  57 -13.513   1.409 -17.190
    7    HD2  LYS  57           HD2      LYS  57 -13.050   2.112 -19.422
    8    HD3  LYS  57           HD3      LYS  57 -12.538   3.453 -18.401
    9    HE2  LYS  57           HE2      LYS  57 -10.217   2.804 -18.574
   10    HE3  LYS  57           HE3      LYS  57 -10.634   1.284 -19.363
   11    HZ1  LYS  57           HZ1      LYS  57 -11.707   3.580 -20.704
   12    HZ3  LYS  57           HZ2      LYS  57 -10.809   2.277 -21.326
   13    HZ2  LYS  57           HZ3      LYS  57 -10.013   3.603 -20.619

  No H/Q in entry =          13
  In of MODEL   81
    1    H    LEU  58           H        LEU  58  -9.525   0.709 -14.704
    2    HA   LEU  58           HA       LEU  58  -9.580  -1.804 -16.000
    3    HB2  LEU  58           HB2      LEU  58  -7.527  -0.560 -14.179
    4    HB3  LEU  58           HB3      LEU  58  -7.295  -2.084 -15.036
    5    HG   LEU  58           HG       LEU  58  -7.987   0.539 -16.395
    6   HD11  LEU  58          HD11      LEU  58  -5.371  -0.755 -15.696
    7   HD13  LEU  58          HD12      LEU  58  -5.830   0.946 -15.645
    8   HD12  LEU  58          HD13      LEU  58  -5.500   0.172 -17.192
    9   HD22  LEU  58          HD21      LEU  58  -8.589  -1.006 -17.993
   10   HD21  LEU  58          HD22      LEU  58  -7.577  -2.277 -17.311
   11   HD23  LEU  58          HD23      LEU  58  -6.855  -1.016 -18.309

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  59           H        ILE  59 -10.397  -0.893 -12.750
    2    HA   ILE  59           HA       ILE  59 -10.108  -3.669 -11.808
    3    HB   ILE  59           HB       ILE  59  -9.625  -1.413 -10.402
    4   HG12  ILE  59          HG12      ILE  59 -11.039  -3.743  -9.089
    5   HG13  ILE  59          HG13      ILE  59  -9.396  -3.850  -9.671
    6   HG23  ILE  59          HG21      ILE  59 -11.448  -0.694  -9.093
    7   HG22  ILE  59          HG22      ILE  59 -12.409  -2.105  -9.470
    8   HG21  ILE  59          HG23      ILE  59 -12.157  -0.852 -10.683
    9   HD12  ILE  59          HD11      ILE  59  -9.537  -3.253  -7.258
   10   HD11  ILE  59          HD12      ILE  59 -10.352  -1.762  -7.714
   11   HD13  ILE  59          HD13      ILE  59  -8.684  -2.046  -8.214

  No H/Q in entry =          11
  In of MODEL   81
    1    H    GLU  60           H        GLU  60 -12.613  -1.299 -12.621
    2    HA   GLU  60           HA       GLU  60 -14.834  -2.772 -11.622
    3    HB2  GLU  60           HB2      GLU  60 -15.048  -0.415 -12.187
    4    HB3  GLU  60           HB3      GLU  60 -14.634  -0.744 -13.866
    5    HG2  GLU  60           HG2      GLU  60 -16.668  -2.155 -14.075
    6    HG3  GLU  60           HG3      GLU  60 -17.093  -1.762 -12.422

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLY  61           H        GLY  61 -13.146  -2.783 -14.730
    2    HA3  GLY  61           HA2      GLY  61 -14.901  -4.990 -15.633
    3    HA2  GLY  61           HA3      GLY  61 -14.029  -3.900 -16.705

  No H/Q in entry =           3
  In of MODEL   81
    1    H    ASP  62           H        ASP  62 -12.693  -5.378 -13.819
    2    HA   ASP  62           HA       ASP  62 -10.455  -6.411 -15.275
    3    HB2  ASP  62           HB2      ASP  62 -10.220  -5.551 -13.001
    4    HB3  ASP  62           HB3      ASP  62 -11.331  -6.777 -12.401

  No H/Q in entry =           4
  In of MODEL   81
    1    H    ALA  63           H        ALA  63 -10.354  -8.313 -16.368
    2    HA   ALA  63           HA       ALA  63 -11.568 -10.733 -15.254
    3    HB2  ALA  63           HB1      ALA  63 -12.707 -11.191 -17.504
    4    HB1  ALA  63           HB2      ALA  63 -12.469  -9.483 -17.867
    5    HB3  ALA  63           HB3      ALA  63 -13.473  -9.963 -16.498

  No H/Q in entry =           5
  In of MODEL   81
    1    H    GLY  64           H        GLY  64 -10.999 -10.315 -18.643
    2    HA3  GLY  64           HA2      GLY  64  -9.052 -10.730 -19.921
    3    HA2  GLY  64           HA3      GLY  64  -8.286 -11.414 -18.493

  No H/Q in entry =           3
  In of MODEL   81
    1    H    GLU  65           H        GLU  65  -7.871 -13.516 -18.828
    2    HA   GLU  65           HA       GLU  65  -8.886 -15.141 -20.776
    3    HB2  GLU  65           HB2      GLU  65  -7.910 -15.897 -18.024
    4    HB3  GLU  65           HB3      GLU  65  -8.243 -17.071 -19.298
    5    HG2  GLU  65           HG2      GLU  65  -6.616 -15.993 -20.767
    6    HG3  GLU  65           HG3      GLU  65  -6.322 -14.742 -19.560

  No H/Q in entry =           6
  In of MODEL   81
    1    H    GLY  66           H        GLY  66 -10.106 -17.168 -20.480
    2    HA3  GLY  66           HA2      GLY  66 -12.821 -16.674 -19.967
    3    HA2  GLY  66           HA3      GLY  66 -12.101 -18.241 -20.278

  No H/Q in entry =           3
  In of MODEL   81
    1    H    LYS  67           H        LYS  67 -10.372 -18.272 -18.021
    2    HA   LYS  67           HA       LYS  67 -12.171 -19.327 -16.088
    3    HB2  LYS  67           HB2      LYS  67  -9.180 -18.963 -16.110
    4    HB3  LYS  67           HB3      LYS  67 -10.056 -19.783 -14.811
    5    HG2  LYS  67           HG2      LYS  67 -11.039 -21.343 -16.450
    6    HG3  LYS  67           HG3      LYS  67 -10.172 -20.530 -17.750
    7    HD2  LYS  67           HD2      LYS  67  -8.023 -21.145 -16.711
    8    HD3  LYS  67           HD3      LYS  67  -8.887 -21.951 -15.399
    9    HE2  LYS  67           HE2      LYS  67  -9.941 -23.481 -17.026
   10    HE3  LYS  67           HE3      LYS  67  -9.077 -22.680 -18.339
   11    HZ2  LYS  67           HZ1      LYS  67  -8.050 -24.453 -16.245
   12    HZ1  LYS  67           HZ2      LYS  67  -7.026 -23.236 -16.841
   13    HZ3  LYS  67           HZ3      LYS  67  -7.671 -24.399 -17.897

  No H/Q in entry =          13
  In of MODEL   81
    1    H    MET  68           H        MET  68 -12.240 -18.888 -13.867
    2    HA   MET  68           HA       MET  68 -13.132 -16.433 -13.113
    3    HB2  MET  68           HB2      MET  68 -11.745 -18.486 -11.388
    4    HB3  MET  68           HB3      MET  68 -12.734 -17.158 -10.781
    5    HG2  MET  68           HG2      MET  68 -13.698 -19.307 -12.692
    6    HG3  MET  68           HG3      MET  68 -14.029 -19.269 -10.959
    7    HE1  MET  68           HE1      MET  68 -15.015 -17.610  -9.741
    8    HE3  MET  68           HE2      MET  68 -16.345 -16.568 -10.244
    9    HE2  MET  68           HE3      MET  68 -14.684 -15.999 -10.396

  No H/Q in entry =           9
  In of MODEL   81
    1    H    LYS  69           H        LYS  69  -9.960 -16.841 -14.023
    2    HA   LYS  69           HA       LYS  69  -8.593 -15.371 -12.027
    3    HB2  LYS  69           HB2      LYS  69  -7.805 -15.809 -14.913
    4    HB3  LYS  69           HB3      LYS  69  -6.726 -15.335 -13.598
    5    HG2  LYS  69           HG2      LYS  69  -8.387 -17.869 -13.561
    6    HG3  LYS  69           HG3      LYS  69  -6.716 -17.814 -14.119
    7    HD2  LYS  69           HD2      LYS  69  -6.181 -16.730 -11.839
    8    HD3  LYS  69           HD3      LYS  69  -7.775 -17.301 -11.341
    9    HE2  LYS  69           HE2      LYS  69  -7.166 -19.602 -11.897
   10    HE3  LYS  69           HE3      LYS  69  -5.601 -19.066 -12.506
   11    HZ3  LYS  69           HZ1      LYS  69  -4.867 -18.530 -10.394
   12    HZ2  LYS  69           HZ2      LYS  69  -5.748 -19.957 -10.126
   13    HZ1  LYS  69           HZ3      LYS  69  -6.432 -18.448  -9.744

  No H/Q in entry =          13
  In of MODEL   81
    1    H    VAL  70           H        VAL  70  -7.283 -13.348 -12.466
    2    HA   VAL  70           HA       VAL  70  -8.887 -11.305 -13.897
    3    HB   VAL  70           HB       VAL  70  -8.303  -9.738 -12.072
    4   HG11  VAL  70          HG11      VAL  70  -9.739 -12.295 -11.322
    5   HG13  VAL  70          HG12      VAL  70 -10.455 -10.801 -11.927
    6   HG12  VAL  70          HG13      VAL  70  -9.757 -10.852 -10.309
    7   HG21  VAL  70          HG21      VAL  70  -7.085 -12.232 -10.828
    8   HG23  VAL  70          HG22      VAL  70  -7.422 -10.753  -9.929
    9   HG22  VAL  70          HG23      VAL  70  -6.244 -10.737 -11.240

  No H/Q in entry =           9
  In of MODEL   81
    1    H    SER  71           H        SER  71  -7.604  -9.344 -14.392
    2    HA   SER  71           HA       SER  71  -5.244  -9.927 -15.825
    3    HB2  SER  71           HB2      SER  71  -6.800  -7.958 -16.203
    4    HB3  SER  71           HB3      SER  71  -6.074  -7.212 -14.782
    5    HG   SER  71           HG       SER  71  -4.751  -6.514 -16.307

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LEU  72           H        LEU  72  -3.345 -10.420 -15.037
    2    HA   LEU  72           HA       LEU  72  -2.633 -10.227 -12.322
    3    HB2  LEU  72           HB2      LEU  72  -0.973 -10.682 -14.797
    4    HB3  LEU  72           HB3      LEU  72  -0.326 -10.780 -13.162
    5    HG   LEU  72           HG       LEU  72  -2.709 -12.412 -14.095
    6   HD13  LEU  72          HD11      LEU  72  -0.712 -13.003 -15.417
    7   HD12  LEU  72          HD12      LEU  72  -1.116 -14.293 -14.284
    8   HD11  LEU  72          HD13      LEU  72   0.218 -13.195 -13.929
    9   HD23  LEU  72          HD21      LEU  72  -1.783 -13.856 -12.124
   10   HD22  LEU  72          HD22      LEU  72  -2.712 -12.420 -11.720
   11   HD21  LEU  72          HD23      LEU  72  -0.952 -12.383 -11.638

  No H/Q in entry =          11
  In of MODEL   81
    1    H    VAL  73           H        VAL  73  -1.860  -8.221 -15.095
    2    HA   VAL  73           HA       VAL  73   0.092  -6.566 -13.979
    3    HB   VAL  73           HB       VAL  73  -0.266  -5.134 -15.833
    4   HG13  VAL  73          HG11      VAL  73  -0.307  -6.710 -17.688
    5   HG12  VAL  73          HG12      VAL  73  -1.102  -7.921 -16.683
    6   HG11  VAL  73          HG13      VAL  73   0.558  -7.439 -16.337
    7   HG23  VAL  73          HG21      VAL  73  -2.450  -5.720 -17.239
    8   HG22  VAL  73          HG22      VAL  73  -2.506  -4.556 -15.917
    9   HG21  VAL  73          HG23      VAL  73  -3.052  -6.212 -15.655

  No H/Q in entry =           9
  In of MODEL   81
    1    H    LEU  74           H        LEU  74  -3.310  -6.610 -13.437
    2    HA   LEU  74           HA       LEU  74  -3.873  -3.942 -12.821
    3    HB2  LEU  74           HB2      LEU  74  -5.639  -5.565 -13.006
    4    HB3  LEU  74           HB3      LEU  74  -4.973  -6.513 -11.679
    5    HG   LEU  74           HG       LEU  74  -5.378  -4.603 -10.138
    6   HD12  LEU  74          HD11      LEU  74  -7.003  -2.844 -11.107
    7   HD11  LEU  74          HD12      LEU  74  -6.437  -3.378 -12.688
    8   HD13  LEU  74          HD13      LEU  74  -5.299  -2.685 -11.532
    9   HD22  LEU  74          HD21      LEU  74  -7.610  -5.130  -9.858
   10   HD21  LEU  74          HD22      LEU  74  -7.062  -6.448 -10.871
   11   HD23  LEU  74          HD23      LEU  74  -7.936  -5.117 -11.589

  No H/Q in entry =          11
  In of MODEL   81
    1    H    VAL  75           H        VAL  75  -2.899  -6.556 -10.661
    2    HA   VAL  75           HA       VAL  75  -2.678  -5.014  -8.312
    3    HB   VAL  75           HB       VAL  75  -1.232  -7.539  -9.101
    4   HG12  VAL  75          HG11      VAL  75  -0.808  -7.704  -6.615
    5   HG11  VAL  75          HG12      VAL  75  -1.419  -6.065  -6.449
    6   HG13  VAL  75          HG13      VAL  75   0.047  -6.363  -7.369
    7   HG21  VAL  75          HG21      VAL  75  -3.787  -7.480  -8.866
    8   HG23  VAL  75          HG22      VAL  75  -3.523  -7.103  -7.164
    9   HG22  VAL  75          HG23      VAL  75  -2.948  -8.633  -7.829

  No H/Q in entry =           9
  In of MODEL   81
    1    H    GLU  76           H        GLU  76  -0.274  -5.821 -10.839
    2    HA   GLU  76           HA       GLU  76   1.935  -4.525  -9.668
    3    HB2  GLU  76           HB2      GLU  76   2.120  -5.999 -11.652
    4    HB3  GLU  76           HB3      GLU  76   1.232  -4.825 -12.611
    5    HG2  GLU  76           HG2      GLU  76   3.576  -4.531 -13.100
    6    HG3  GLU  76           HG3      GLU  76   3.079  -3.150 -12.139

  No H/Q in entry =           6
  In of MODEL   81
    1    H    ALA  77           H        ALA  77  -0.560  -3.264 -11.866
    2    HA   ALA  77           HA       ALA  77   0.488  -0.639 -12.032
    3    HB3  ALA  77           HB1      ALA  77  -2.455  -1.268 -12.185
    4    HB1  ALA  77           HB2      ALA  77  -1.348  -1.767 -13.464
    5    HB2  ALA  77           HB3      ALA  77  -1.537  -0.057 -13.081

  No H/Q in entry =           5
  In of MODEL   81
    1    H    GLN  78           H        GLN  78  -1.824  -2.150  -9.835
    2    HA   GLN  78           HA       GLN  78  -2.587   0.182  -8.433
    3    HB2  GLN  78           HB2      GLN  78  -3.741  -2.059  -8.361
    4    HB3  GLN  78           HB3      GLN  78  -2.425  -2.640  -7.343
    5    HG2  GLN  78           HG2      GLN  78  -2.927  -0.887  -5.690
    6    HG3  GLN  78           HG3      GLN  78  -4.246  -0.303  -6.704
    7   HE21  GLN  78          HE21      GLN  78  -4.719  -1.281  -4.038
    8   HE22  GLN  78          HE22      GLN  78  -5.619  -2.716  -4.159

  No H/Q in entry =           8
  In of MODEL   81
    1    H    LEU  79           H        LEU  79   0.040  -2.131  -7.974
    2    HA   LEU  79           HA       LEU  79   1.023  -1.260  -5.510
    3    HB2  LEU  79           HB2      LEU  79   1.856  -3.285  -6.578
    4    HB3  LEU  79           HB3      LEU  79   2.528  -2.344  -7.906
    5    HG   LEU  79           HG       LEU  79   4.100  -1.241  -6.393
    6   HD13  LEU  79          HD11      LEU  79   3.091  -0.979  -4.330
    7   HD12  LEU  79          HD12      LEU  79   4.139  -2.352  -3.984
    8   HD11  LEU  79          HD13      LEU  79   2.430  -2.615  -4.323
    9   HD23  LEU  79          HD21      LEU  79   5.261  -3.416  -5.488
   10   HD22  LEU  79          HD22      LEU  79   5.071  -3.209  -7.227
   11   HD21  LEU  79          HD23      LEU  79   3.966  -4.258  -6.342

  No H/Q in entry =          11
  In of MODEL   81
    1    H    HIS  80           H        HIS  80   1.933  -0.155  -8.776
    2    HA   HIS  80           HA       HIS  80   3.776   1.793  -7.841
    3    HB2  HIS  80           HB2      HIS  80   2.486   1.131 -10.432
    4    HB3  HIS  80           HB3      HIS  80   3.113   2.770 -10.254
    5    HD1  HIS  80           HD1      HIS  80   5.523   3.022 -10.764
    6    HD2  HIS  80           HD2      HIS  80   4.618  -0.874  -9.585
    7    HE1  HIS  80           HE1      HIS  80   7.687   1.701 -10.921
    8    HE2  HIS  80           HE2      HIS  80   7.147  -0.677 -10.207

  No H/Q in entry =           8
  In of MODEL   81
    1    H    LEU  81           H        LEU  81   0.381   2.024  -8.837
    2    HA   LEU  81           HA       LEU  81   0.161   4.821  -8.501
    3    HB2  LEU  81           HB2      LEU  81  -1.899   2.616  -8.437
    4    HB3  LEU  81           HB3      LEU  81  -2.317   4.328  -8.344
    5    HG   LEU  81           HG       LEU  81  -0.636   3.149 -10.574
    6   HD12  LEU  81          HD11      LEU  81  -2.855   3.516 -11.884
    7   HD11  LEU  81          HD12      LEU  81  -3.620   3.460 -10.296
    8   HD13  LEU  81          HD13      LEU  81  -2.701   2.075 -10.881
    9   HD23  LEU  81          HD21      LEU  81  -1.685   5.318 -11.672
   10   HD22  LEU  81          HD22      LEU  81  -0.270   5.458 -10.631
   11   HD21  LEU  81          HD23      LEU  81  -1.871   5.837  -9.998

  No H/Q in entry =          11
  In of MODEL   81
    1    H    MET  82           H        MET  82  -0.563   2.143  -6.262
    2    HA   MET  82           HA       MET  82  -1.594   3.745  -4.177
    3    HB2  MET  82           HB2      MET  82  -0.273   1.032  -4.215
    4    HB3  MET  82           HB3      MET  82  -0.845   1.764  -2.719
    5    HG2  MET  82           HG2      MET  82  -2.575   1.310  -5.170
    6    HG3  MET  82           HG3      MET  82  -2.525   0.232  -3.777
    7    HE3  MET  82           HE1      MET  82  -4.229   1.909  -0.966
    8    HE2  MET  82           HE2      MET  82  -2.493   2.153  -1.142
    9    HE1  MET  82           HE3      MET  82  -3.209   0.610  -1.603

  No H/Q in entry =           9
  In of MODEL   81
    1    H    THR  83           H        THR  83   1.688   2.596  -4.852
    2    HA   THR  83           HA       THR  83   2.915   3.671  -2.543
    3    HB   THR  83           HB       THR  83   5.016   3.578  -4.006
    4    HG1  THR  83           HG1      THR  83   4.777   3.062  -6.032
    5   HG22  THR  83          HG21      THR  83   4.522   0.930  -4.346
    6   HG21  THR  83          HG22      THR  83   3.234   1.332  -3.212
    7   HG23  THR  83          HG23      THR  83   4.918   1.642  -2.783

  No H/Q in entry =           7
  In of MODEL   81
    1    H    SER  84           H        SER  84   2.587   4.965  -5.841
    2    HA   SER  84           HA       SER  84   3.971   7.378  -5.374
    3    HB2  SER  84           HB2      SER  84   1.895   6.591  -7.405
    4    HB3  SER  84           HB3      SER  84   2.605   8.205  -7.373
    5    HG   SER  84           HG       SER  84   3.931   5.704  -7.663

  No H/Q in entry =           5
  In of MODEL   81
    1    H    MET  85           H        MET  85   0.462   6.689  -5.222
    2    HA   MET  85           HA       MET  85  -0.351   9.315  -4.618
    3    HB2  MET  85           HB2      MET  85  -1.907   7.540  -5.300
    4    HB3  MET  85           HB3      MET  85  -1.640   6.721  -3.762
    5    HG2  MET  85           HG2      MET  85  -2.493   8.695  -2.553
    6    HG3  MET  85           HG3      MET  85  -2.746   9.525  -4.088
    7    HE1  MET  85           HE1      MET  85  -4.124   7.302  -1.427
    8    HE3  MET  85           HE2      MET  85  -3.434   6.016  -2.416
    9    HE2  MET  85           HE3      MET  85  -5.181   6.134  -2.230

  No H/Q in entry =           9
  In of MODEL   81
    1    H    LEU  86           H        LEU  86   0.505   6.630  -2.477
    2    HA   LEU  86           HA       LEU  86  -0.015   7.937  -0.034
    3    HB2  LEU  86           HB2      LEU  86   0.401   5.458  -0.432
    4    HB3  LEU  86           HB3      LEU  86   2.117   5.854  -0.517
    5    HG   LEU  86           HG       LEU  86   1.804   7.015   1.752
    6   HD11  LEU  86          HD11      LEU  86  -0.903   6.305   1.265
    7   HD13  LEU  86          HD12      LEU  86  -0.229   7.035   2.721
    8   HD12  LEU  86          HD13      LEU  86  -0.355   5.281   2.597
    9   HD23  LEU  86          HD21      LEU  86   1.314   4.032   1.864
   10   HD22  LEU  86          HD22      LEU  86   2.332   5.018   2.912
   11   HD21  LEU  86          HD23      LEU  86   2.834   4.687   1.255

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ALA  87           H        ALA  87   2.969   7.586  -1.909
    2    HA   ALA  87           HA       ALA  87   4.694   8.957  -0.172
    3    HB3  ALA  87           HB1      ALA  87   4.782   7.949  -2.882
    4    HB2  ALA  87           HB2      ALA  87   6.118   8.249  -1.773
    5    HB1  ALA  87           HB3      ALA  87   5.535   9.545  -2.817

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ARG  88           H        ARG  88   2.785  10.140  -2.899
    2    HA   ARG  88           HA       ARG  88   3.615  12.812  -2.771
    3    HB2  ARG  88           HB2      ARG  88   2.346  11.692  -4.638
    4    HB3  ARG  88           HB3      ARG  88   0.888  11.863  -3.661
    5    HG2  ARG  88           HG2      ARG  88   1.961  14.421  -3.566
    6    HG3  ARG  88           HG3      ARG  88   2.382  13.902  -5.196
    7    HD2  ARG  88           HD2      ARG  88   0.247  14.030  -5.904
    8    HD3  ARG  88           HD3      ARG  88  -0.365  13.186  -4.481
    9    HE   ARG  88           HE       ARG  88  -0.493  15.968  -4.892
   10   HH21  ARG  88          HH11      ARG  88  -1.000  17.304  -3.153
   11   HH22  ARG  88          HH12      ARG  88  -0.724  16.756  -1.535
   12   HH11  ARG  88          HH21      ARG  88   0.462  13.678  -2.519
   13   HH12  ARG  88          HH22      ARG  88   0.087  14.698  -1.177

  No H/Q in entry =          13
  In of MODEL   81
    1    H    GLU  89           H        GLU  89   0.868  11.192  -1.149
    2    HA   GLU  89           HA       GLU  89  -0.195  13.524   0.057
    3    HB2  GLU  89           HB2      GLU  89  -1.361  11.310  -0.041
    4    HB3  GLU  89           HB3      GLU  89  -0.255  10.727   1.204
    5    HG2  GLU  89           HG2      GLU  89  -1.045  12.439   2.764
    6    HG3  GLU  89           HG3      GLU  89  -2.077  13.136   1.517

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LEU  90           H        LEU  90   2.200  11.176   1.237
    2    HA   LEU  90           HA       LEU  90   2.571  12.405   3.771
    3    HB2  LEU  90           HB2      LEU  90   4.312  10.596   2.097
    4    HB3  LEU  90           HB3      LEU  90   4.735  11.099   3.739
    5    HG   LEU  90           HG       LEU  90   2.074   9.814   3.062
    6   HD12  LEU  90          HD11      LEU  90   3.164   7.740   4.070
    7   HD11  LEU  90          HD12      LEU  90   4.706   8.563   3.837
    8   HD13  LEU  90          HD13      LEU  90   3.691   8.182   2.445
    9   HD22  LEU  90          HD21      LEU  90   1.820  10.737   5.185
   10   HD21  LEU  90          HD22      LEU  90   3.533  10.590   5.575
   11   HD23  LEU  90          HD23      LEU  90   2.495   9.166   5.615

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  91           H        ILE  91   4.198  12.760   0.653
    2    HA   ILE  91           HA       ILE  91   6.211  14.544   1.507
    3    HB   ILE  91           HB       ILE  91   4.902  14.091  -1.180
    4   HG12  ILE  91          HG12      ILE  91   7.718  13.536  -0.194
    5   HG13  ILE  91          HG13      ILE  91   6.408  12.368  -0.041
    6   HG22  ILE  91          HG21      ILE  91   7.158  15.389  -1.854
    7   HG21  ILE  91          HG22      ILE  91   6.859  16.192  -0.312
    8   HG23  ILE  91          HG23      ILE  91   5.643  16.252  -1.587
    9   HD13  ILE  91          HD11      ILE  91   6.239  12.055  -2.350
   10   HD12  ILE  91          HD12      ILE  91   7.977  12.258  -2.128
   11   HD11  ILE  91          HD13      ILE  91   7.000  13.605  -2.715

  No H/Q in entry =          11
  In of MODEL   81
    1    H    THR  92           H        THR  92   2.865  15.056   0.485
    2    HA   THR  92           HA       THR  92   2.904  17.879   0.433
    3    HB   THR  92           HB       THR  92   0.688  15.933   1.116
    4    HG1  THR  92           HG1      THR  92   0.998  15.753  -0.968
    5   HG22  THR  92          HG21      THR  92  -0.659  18.129   0.394
    6   HG21  THR  92          HG22      THR  92   0.748  18.920   1.100
    7   HG23  THR  92          HG23      THR  92  -0.223  17.817   2.074

  No H/Q in entry =           7
  In of MODEL   81
    1    H    GLU  93           H        GLU  93   2.290  15.584   3.077
    2    HA   GLU  93           HA       GLU  93   1.793  17.494   5.099
    3    HB2  GLU  93           HB2      GLU  93   3.042  14.739   5.333
    4    HB3  GLU  93           HB3      GLU  93   2.366  15.678   6.665
    5    HG2  GLU  93           HG2      GLU  93   0.748  14.945   4.217
    6    HG3  GLU  93           HG3      GLU  93   0.819  13.916   5.642

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LEU  94           H        LEU  94   4.770  15.946   3.959
    2    HA   LEU  94           HA       LEU  94   6.537  17.047   5.859
    3    HB2  LEU  94           HB2      LEU  94   6.930  16.079   3.027
    4    HB3  LEU  94           HB3      LEU  94   8.270  16.703   3.984
    5    HG   LEU  94           HG       LEU  94   6.474  14.545   5.105
    6   HD11  LEU  94          HD11      LEU  94   8.574  14.277   2.982
    7   HD13  LEU  94          HD12      LEU  94   7.105  13.336   3.234
    8   HD12  LEU  94          HD13      LEU  94   8.519  13.047   4.247
    9   HD23  LEU  94          HD21      LEU  94   8.645  13.954   6.266
   10   HD22  LEU  94          HD22      LEU  94   8.013  15.546   6.684
   11   HD21  LEU  94          HD23      LEU  94   9.354  15.398   5.547

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  95           H        ILE  95   5.441  18.254   2.707
    2    HA   ILE  95           HA       ILE  95   7.067  20.575   2.662
    3    HB   ILE  95           HB       ILE  95   4.414  19.956   1.342
    4   HG12  ILE  95          HG12      ILE  95   7.215  20.232   0.219
    5   HG13  ILE  95          HG13      ILE  95   6.528  18.693   0.726
    6   HG21  ILE  95          HG21      ILE  95   6.222  22.383   1.138
    7   HG23  ILE  95          HG22      ILE  95   4.494  22.354   1.485
    8   HG22  ILE  95          HG23      ILE  95   5.075  21.945  -0.129
    9   HD13  ILE  95          HD11      ILE  95   4.975  18.658  -1.010
   10   HD12  ILE  95          HD12      ILE  95   6.346  19.447  -1.790
   11   HD11  ILE  95          HD13      ILE  95   4.993  20.412  -1.201

  No H/Q in entry =          11
  In of MODEL   81
    1    H    GLU  96           H        GLU  96   3.798  19.995   3.940
    2    HA   GLU  96           HA       GLU  96   3.236  22.653   4.696
    3    HB2  GLU  96           HB2      GLU  96   1.520  20.910   4.695
    4    HB3  GLU  96           HB3      GLU  96   2.356  20.059   5.991
    5    HG2  GLU  96           HG2      GLU  96   1.359  21.361   7.560
    6    HG3  GLU  96           HG3      GLU  96   1.932  22.824   6.770

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LEU  97           H        LEU  97   5.011  20.055   6.322
    2    HA   LEU  97           HA       LEU  97   5.388  21.388   8.799
    3    HB2  LEU  97           HB2      LEU  97   6.881  19.187   7.385
    4    HB3  LEU  97           HB3      LEU  97   7.479  19.854   8.902
    5    HG   LEU  97           HG       LEU  97   4.646  18.828   8.575
    6   HD12  LEU  97          HD11      LEU  97   5.533  16.790   9.786
    7   HD11  LEU  97          HD12      LEU  97   7.160  17.384   9.451
    8   HD13  LEU  97          HD13      LEU  97   6.086  16.955   8.119
    9   HD23  LEU  97          HD21      LEU  97   5.080  18.515  11.140
   10   HD22  LEU  97          HD22      LEU  97   4.741  20.137  10.539
   11   HD21  LEU  97          HD23      LEU  97   6.400  19.657  10.890

  No H/Q in entry =          11
  In of MODEL   81
    1    H    HIS  98           H        HIS  98   7.273  21.368   5.782
    2    HA   HIS  98           HA       HIS  98   9.459  22.893   6.696
    3    HB2  HIS  98           HB2      HIS  98   8.174  22.677   3.964
    4    HB3  HIS  98           HB3      HIS  98   9.635  23.620   4.264
    5    HD1  HIS  98           HD1      HIS  98   8.339  20.080   4.267
    6    HD2  HIS  98           HD2      HIS  98  11.967  22.089   4.715
    7    HE1  HIS  98           HE1      HIS  98  10.152  18.306   4.214
    8    HE2  HIS  98           HE2      HIS  98  12.365  19.509   4.487

  No H/Q in entry =           8
  In of MODEL   81
    1    H    GLU  99           H        GLU  99   6.265  23.809   5.508
    2    HA   GLU  99           HA       GLU  99   6.712  26.614   5.461
    3    HB2  GLU  99           HB2      GLU  99   4.811  25.494   4.318
    4    HB3  GLU  99           HB3      GLU  99   4.099  25.144   5.892
    5    HG2  GLU  99           HG2      GLU  99   3.973  27.538   6.400
    6    HG3  GLU  99           HG3      GLU  99   4.766  27.924   4.876

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LYS 100           H        LYS 100   5.515  24.399   7.970
    2    HA   LYS 100           HA       LYS 100   4.970  26.461   9.868
    3    HB2  LYS 100           HB2      LYS 100   5.472  23.496  10.207
    4    HB3  LYS 100           HB3      LYS 100   5.044  24.575  11.541
    5    HG2  LYS 100           HG2      LYS 100   3.000  25.266  10.285
    6    HG3  LYS 100           HG3      LYS 100   3.405  24.091   9.031
    7    HD2  LYS 100           HD2      LYS 100   3.275  22.267  10.686
    8    HD3  LYS 100           HD3      LYS 100   2.887  23.436  11.951
    9    HE2  LYS 100           HE2      LYS 100   0.856  24.111  10.680
   10    HE3  LYS 100           HE3      LYS 100   1.232  22.885   9.463
   11    HZ1  LYS 100           HZ1      LYS 100   0.936  22.217  12.340
   12    HZ3  LYS 100           HZ2      LYS 100   0.902  21.167  11.002
   13    HZ2  LYS 100           HZ3      LYS 100  -0.389  22.237  11.279

  No H/Q in entry =          13
  In of MODEL   81
    1    H    LEU 101           H        LEU 101   7.853  24.598   9.042
    2    HA   LEU 101           HA       LEU 101   9.460  25.392  11.256
    3    HB2  LEU 101           HB2      LEU 101  10.044  24.399   8.478
    4    HB3  LEU 101           HB3      LEU 101  11.357  25.029   9.467
    5    HG   LEU 101           HG       LEU 101   9.468  22.915  10.516
    6   HD12  LEU 101          HD11      LEU 101  11.488  21.372   9.913
    7   HD11  LEU 101          HD12      LEU 101  11.891  22.630   8.746
    8   HD13  LEU 101          HD13      LEU 101  10.342  21.795   8.642
    9   HD21  LEU 101          HD21      LEU 101  12.215  23.954  11.260
   10   HD23  LEU 101          HD22      LEU 101  11.630  22.394  11.832
   11   HD22  LEU 101          HD23      LEU 101  10.772  23.870  12.270

  No H/Q in entry =          11
  In of MODEL   81
    1    H    LYS 102           H        LYS 102   7.934  27.300   9.114
    2    HA   LYS 102           HA       LYS 102   8.069  29.591   8.829
    3    HB2  LYS 102           HB2      LYS 102   9.620  29.431  10.935
    4    HB3  LYS 102           HB3      LYS 102  10.930  29.597   9.782
    5    HG2  LYS 102           HG2      LYS 102   8.869  31.599  10.640
    6    HG3  LYS 102           HG3      LYS 102  10.588  31.817  10.398
    7    HD2  LYS 102           HD2      LYS 102   8.638  31.449   8.087
    8    HD3  LYS 102           HD3      LYS 102   9.057  33.017   8.762
    9    HE2  LYS 102           HE2      LYS 102  10.410  31.805   6.692
   10    HE3  LYS 102           HE3      LYS 102  11.054  33.093   7.710
   11    HZ2  LYS 102           HZ1      LYS 102  12.528  31.152   7.536
   12    HZ1  LYS 102           HZ2      LYS 102  11.338  30.196   8.270
   13    HZ3  LYS 102           HZ3      LYS 102  12.058  31.463   9.136

  No H/Q in entry =          13
  In of MODEL   81
    1    H    ALA 103           H        ALA 103  11.294  28.173   8.276
    2    HA   ALA 103           HA       ALA 103  12.302  29.532   6.209
    3    HB2  ALA 103           HB1      ALA 103  13.137  27.300   5.279
    4    HB1  ALA 103           HB2      ALA 103  12.217  26.544   6.578
    5    HB3  ALA 103           HB3      ALA 103  13.532  27.654   6.961

  No H/Q in entry =           5
  In of MODEL   81
    1    H1   LYS   3           H1       LYS   3 -32.144   5.116 -19.740
    2    H2   LYS   3           H3       LYS   3 -31.146   4.903 -21.097
    3    H3   LYS   3           H2       LYS   3 -32.456   3.857 -20.835
    4    HA   LYS   3           HA       LYS   3 -31.333   2.560 -19.435
    5    HB2  LYS   3           HB2      LYS   3 -29.185   4.149 -20.791
    6    HB3  LYS   3           HB3      LYS   3 -28.753   2.976 -19.546
    7    HG2  LYS   3           HG2      LYS   3 -30.051   1.274 -20.881
    8    HG3  LYS   3           HG3      LYS   3 -30.114   2.469 -22.175
    9    HD2  LYS   3           HD2      LYS   3 -27.630   2.560 -22.144
   10    HD3  LYS   3           HD3      LYS   3 -27.632   1.260 -20.953
   11    HE2  LYS   3           HE2      LYS   3 -29.044  -0.041 -22.654
   12    HE3  LYS   3           HE3      LYS   3 -28.531   1.180 -23.818
   13    HZ3  LYS   3           HZ1      LYS   3 -26.641   0.102 -24.098
   14    HZ2  LYS   3           HZ2      LYS   3 -27.164  -1.111 -23.030
   15    HZ1  LYS   3           HZ3      LYS   3 -26.276   0.212 -22.444

  No H/Q in entry =          15
  In of MODEL   81
    1    H    LYS   4           H        LYS   4 -31.358   2.422 -17.373
    2    HA   LYS   4           HA       LYS   4 -30.802   4.766 -15.736
    3    HB2  LYS   4           HB2      LYS   4 -31.776   1.987 -15.019
    4    HB3  LYS   4           HB3      LYS   4 -31.655   3.343 -13.898
    5    HG2  LYS   4           HG2      LYS   4 -33.471   3.126 -16.305
    6    HG3  LYS   4           HG3      LYS   4 -33.951   3.143 -14.609
    7    HD2  LYS   4           HD2      LYS   4 -33.435   5.416 -14.355
    8    HD3  LYS   4           HD3      LYS   4 -32.404   5.436 -15.787
    9    HE2  LYS   4           HE2      LYS   4 -34.439   6.649 -16.237
   10    HE3  LYS   4           HE3      LYS   4 -34.407   5.171 -17.201
   11    HZ3  LYS   4           HZ1      LYS   4 -35.892   4.141 -15.637
   12    HZ2  LYS   4           HZ2      LYS   4 -36.570   5.584 -16.222
   13    HZ1  LYS   4           HZ3      LYS   4 -35.895   5.532 -14.664

  No H/Q in entry =          13
  In of MODEL   81
    1    H    HIS   5           H        HIS   5 -29.333   4.974 -14.157
    2    HA   HIS   5           HA       HIS   5 -26.914   3.333 -14.501
    3    HB2  HIS   5           HB2      HIS   5 -27.379   6.062 -13.302
    4    HB3  HIS   5           HB3      HIS   5 -25.825   5.229 -13.294
    5    HD1  HIS   5           HD1      HIS   5 -24.468   6.536 -14.899
    6    HD2  HIS   5           HD2      HIS   5 -28.220   5.609 -16.420
    7    HE1  HIS   5           HE1      HIS   5 -24.367   7.119 -17.353
    8    HE2  HIS   5           HE2      HIS   5 -26.653   6.542 -18.248

  No H/Q in entry =           8
  In of MODEL   81
    1    H    ILE   6           H        ILE   6 -26.551   1.788 -13.182
    2    HA   ILE   6           HA       ILE   6 -27.522   1.988 -10.410
    3    HB   ILE   6           HB       ILE   6 -26.517  -0.412 -11.947
    4   HG12  ILE   6          HG12      ILE   6 -29.319   0.308 -11.077
    5   HG13  ILE   6          HG13      ILE   6 -28.704   0.515 -12.717
    6   HG23  ILE   6          HG21      ILE   6 -26.775  -1.683 -10.081
    7   HG22  ILE   6          HG22      ILE   6 -28.015  -0.629  -9.395
    8   HG21  ILE   6          HG23      ILE   6 -26.316  -0.157  -9.321
    9   HD13  ILE   6          HD11      ILE   6 -28.999  -1.636 -13.207
   10   HD12  ILE   6          HD12      ILE   6 -30.001  -1.694 -11.756
   11   HD11  ILE   6          HD13      ILE   6 -28.304  -2.170 -11.676

  No H/Q in entry =          11
  In of MODEL   81
    1    H    TYR   7           H        TYR   7 -25.809   2.770  -9.140
    2    HA   TYR   7           HA       TYR   7 -23.037   2.027  -9.839
    3    HB2  TYR   7           HB2      TYR   7 -24.177   4.383  -8.358
    4    HB3  TYR   7           HB3      TYR   7 -22.458   4.002  -8.408
    5    HD1  TYR   7           HD1      TYR   7 -23.445   2.968 -11.487
    6    HD2  TYR   7           HD2      TYR   7 -23.039   6.591  -9.277
    7    HE1  TYR   7           HE1      TYR   7 -23.127   4.220 -13.586
    8    HE2  TYR   7           HE2      TYR   7 -22.764   7.845 -11.367
    9    HH   TYR   7           HH       TYR   7 -22.993   7.733 -13.598

  No H/Q in entry =           9
  In of MODEL   81
    1    H    LEU   8           H        LEU   8 -21.957   0.760  -8.514
    2    HA   LEU   8           HA       LEU   8 -23.024   0.187  -5.820
    3    HB2  LEU   8           HB2      LEU   8 -21.211  -1.344  -7.663
    4    HB3  LEU   8           HB3      LEU   8 -21.353  -1.734  -5.949
    5    HG   LEU   8           HG       LEU   8 -23.814  -2.101  -6.350
    6   HD13  LEU   8          HD11      LEU   8 -24.057  -0.907  -8.462
    7   HD12  LEU   8          HD12      LEU   8 -24.456  -2.608  -8.693
    8   HD11  LEU   8          HD13      LEU   8 -22.897  -1.987  -9.233
    9   HD23  LEU   8          HD21      LEU   8 -22.398  -4.042  -8.048
   10   HD22  LEU   8          HD22      LEU   8 -23.457  -4.289  -6.660
   11   HD21  LEU   8          HD23      LEU   8 -21.782  -3.802  -6.413

  No H/Q in entry =          11
  In of MODEL   81
    1    H    PHE   9           H        PHE   9 -21.771   0.683  -4.037
    2    HA   PHE   9           HA       PHE   9 -19.064   1.820  -4.567
    3    HB2  PHE   9           HB2      PHE   9 -21.148   2.754  -2.598
    4    HB3  PHE   9           HB3      PHE   9 -19.474   3.289  -2.583
    5    HD1  PHE   9           HD1      PHE   9 -18.576   4.687  -4.364
    6    HD2  PHE   9           HD2      PHE   9 -22.682   3.442  -4.386
    7    HE1  PHE   9           HE1      PHE   9 -19.072   6.349  -6.132
    8    HE2  PHE   9           HE2      PHE   9 -23.179   5.116  -6.149
    9    HZ   PHE   9           HZ       PHE   9 -21.371   6.566  -7.028

  No H/Q in entry =           9
  In of MODEL   81
    1    H    SER  10           H        SER  10 -17.396   1.034  -3.421
    2    HA   SER  10           HA       SER  10 -17.539   0.124  -0.738
    3    HB2  SER  10           HB2      SER  10 -17.361  -2.205  -0.960
    4    HB3  SER  10           HB3      SER  10 -18.620  -1.778  -2.108
    5    HG   SER  10           HG       SER  10 -17.354  -2.299  -3.702

  No H/Q in entry =           5
  In of MODEL   81
    1    H    SER  11           H        SER  11 -15.519   0.305   0.103
    2    HA   SER  11           HA       SER  11 -13.402   1.326  -1.439
    3    HB2  SER  11           HB2      SER  11 -13.917   1.334   1.165
    4    HB3  SER  11           HB3      SER  11 -12.788  -0.022   1.133
    5    HG   SER  11           HG       SER  11 -11.569   1.807   1.345

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ALA  12           H        ALA  12 -14.400  -1.395  -2.299
    2    HA   ALA  12           HA       ALA  12 -11.758  -2.492  -2.817
    3    HB2  ALA  12           HB1      ALA  12 -12.020  -3.849  -0.971
    4    HB3  ALA  12           HB2      ALA  12 -12.785  -4.848  -2.206
    5    HB1  ALA  12           HB3      ALA  12 -13.779  -3.887  -1.113

  No H/Q in entry =           5
  In of MODEL   81
    1    H    GLY  13           H        GLY  13 -12.623  -1.529  -4.840
    2    HA3  GLY  13           HA2      GLY  13 -14.808  -2.389  -6.300
    3    HA2  GLY  13           HA3      GLY  13 -13.291  -1.848  -7.031

  No H/Q in entry =           3
  In of MODEL   81
    1    H    MET  14           H        MET  14 -11.717  -4.091  -5.915
    2    HA   MET  14           HA       MET  14 -11.951  -5.870  -8.058
    3    HB2  MET  14           HB2      MET  14  -9.908  -5.806  -6.720
    4    HB3  MET  14           HB3      MET  14 -10.752  -6.505  -5.339
    5    HG2  MET  14           HG2      MET  14  -9.498  -8.245  -6.530
    6    HG3  MET  14           HG3      MET  14 -11.227  -8.539  -6.721
    7    HE1  MET  14           HE1      MET  14  -8.220  -8.990  -8.287
    8    HE3  MET  14           HE2      MET  14  -7.921  -7.255  -8.368
    9    HE2  MET  14           HE3      MET  14  -8.131  -8.176  -9.856

  No H/Q in entry =           9
  In of MODEL   81
    1    H    SER  15           H        SER  15 -13.169  -6.402  -4.751
    2    HA   SER  15           HA       SER  15 -14.382  -8.917  -5.447
    3    HB2  SER  15           HB2      SER  15 -13.974  -8.682  -3.119
    4    HB3  SER  15           HB3      SER  15 -14.753  -7.102  -3.066
    5    HG   SER  15           HG       SER  15 -16.667  -8.446  -3.882

  No H/Q in entry =           5
  In of MODEL   81
    1    H    THR  16           H        THR  16 -15.620  -5.591  -5.171
    2    HA   THR  16           HA       THR  16 -18.378  -6.232  -5.740
    3    HB   THR  16           HB       THR  16 -16.947  -3.604  -6.266
    4    HG1  THR  16           HG1      THR  16 -18.281  -3.928  -3.889
    5   HG21  THR  16          HG21      THR  16 -19.340  -4.001  -7.054
    6   HG23  THR  16          HG22      THR  16 -19.109  -2.621  -5.967
    7   HG22  THR  16          HG23      THR  16 -19.775  -4.141  -5.355

  No H/Q in entry =           7
  In of MODEL   81
    1    H    SER  17           H        SER  17 -15.525  -5.503  -7.585
    2    HA   SER  17           HA       SER  17 -16.725  -4.864 -10.081
    3    HB2  SER  17           HB2      SER  17 -13.995  -5.969  -9.391
    4    HB3  SER  17           HB3      SER  17 -14.480  -5.577 -11.042
    5    HG   SER  17           HG       SER  17 -14.878  -3.643  -9.079

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LEU  18           H        LEU  18 -15.900  -7.948  -8.626
    2    HA   LEU  18           HA       LEU  18 -16.380  -9.500 -10.971
    3    HB2  LEU  18           HB2      LEU  18 -15.075 -10.364  -9.087
    4    HB3  LEU  18           HB3      LEU  18 -16.496 -10.259  -8.048
    5    HG   LEU  18           HG       LEU  18 -17.641 -11.882  -9.571
    6   HD11  LEU  18          HD11      LEU  18 -14.908 -11.841 -10.834
    7   HD13  LEU  18          HD12      LEU  18 -16.482 -11.696 -11.613
    8   HD12  LEU  18          HD13      LEU  18 -15.958 -13.250 -10.967
    9   HD23  LEU  18          HD21      LEU  18 -15.086 -12.928  -8.398
   10   HD22  LEU  18          HD22      LEU  18 -16.612 -13.788  -8.622
   11   HD21  LEU  18          HD23      LEU  18 -16.503 -12.476  -7.449

  No H/Q in entry =          11
  In of MODEL   81
    1    H    LEU  19           H        LEU  19 -18.421  -8.440  -8.252
    2    HA   LEU  19           HA       LEU  19 -20.787  -9.819  -9.062
    3    HB2  LEU  19           HB2      LEU  19 -20.571  -8.958  -6.816
    4    HB3  LEU  19           HB3      LEU  19 -20.420  -7.312  -7.429
    5    HG   LEU  19           HG       LEU  19 -22.758  -7.329  -8.110
    6   HD13  LEU  19          HD11      LEU  19 -23.397  -9.473  -8.664
    7   HD12  LEU  19          HD12      LEU  19 -24.079  -9.351  -7.042
    8   HD11  LEU  19          HD13      LEU  19 -22.549 -10.192  -7.294
    9   HD23  LEU  19          HD21      LEU  19 -22.670  -8.317  -5.286
   10   HD22  LEU  19          HD22      LEU  19 -23.639  -7.020  -5.985
   11   HD21  LEU  19          HD23      LEU  19 -21.906  -6.796  -5.746

  No H/Q in entry =          11
  In of MODEL   81
    1    H    VAL  20           H        VAL  20 -19.553  -6.552  -9.779
    2    HA   VAL  20           HA       VAL  20 -21.751  -5.688 -11.336
    3    HB   VAL  20           HB       VAL  20 -18.819  -4.862 -11.497
    4   HG13  VAL  20          HG11      VAL  20 -19.629  -4.236 -13.611
    5   HG12  VAL  20          HG12      VAL  20 -19.885  -2.788 -12.638
    6   HG11  VAL  20          HG13      VAL  20 -21.236  -3.865 -12.988
    7   HG21  VAL  20          HG21      VAL  20 -21.225  -3.803 -10.073
    8   HG23  VAL  20          HG22      VAL  20 -19.878  -2.744 -10.485
    9   HG22  VAL  20          HG23      VAL  20 -19.612  -4.142  -9.444

  No H/Q in entry =           9
  In of MODEL   81
    1    H    SER  21           H        SER  21 -18.846  -7.517 -12.375
    2    HA   SER  21           HA       SER  21 -19.656  -7.478 -15.121
    3    HB2  SER  21           HB2      SER  21 -18.070  -9.326 -15.459
    4    HB3  SER  21           HB3      SER  21 -17.336  -8.015 -14.536
    5    HG   SER  21           HG       SER  21 -17.088  -9.304 -12.931

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LYS  22           H        LYS  22 -20.526  -9.732 -12.535
    2    HA   LYS  22           HA       LYS  22 -21.945 -11.475 -14.340
    3    HB2  LYS  22           HB2      LYS  22 -21.101 -11.878 -11.862
    4    HB3  LYS  22           HB3      LYS  22 -22.711 -11.276 -11.468
    5    HG2  LYS  22           HG2      LYS  22 -23.719 -13.060 -12.789
    6    HG3  LYS  22           HG3      LYS  22 -22.117 -13.654 -13.223
    7    HD2  LYS  22           HD2      LYS  22 -21.687 -13.988 -10.764
    8    HD3  LYS  22           HD3      LYS  22 -23.393 -13.628 -10.491
    9    HE2  LYS  22           HE2      LYS  22 -24.045 -15.537 -11.857
   10    HE3  LYS  22           HE3      LYS  22 -22.355 -15.872 -12.238
   11    HZ3  LYS  22           HZ1      LYS  22 -22.342 -17.202 -10.498
   12    HZ2  LYS  22           HZ2      LYS  22 -23.887 -16.697 -10.006
   13    HZ1  LYS  22           HZ3      LYS  22 -22.512 -15.843  -9.493

  No H/Q in entry =          13
  In of MODEL   81
    1    H    MET  23           H        MET  23 -22.883  -8.612 -12.476
    2    HA   MET  23           HA       MET  23 -25.679  -8.913 -12.963
    3    HB2  MET  23           HB2      MET  23 -24.014  -6.464 -12.410
    4    HB3  MET  23           HB3      MET  23 -25.769  -6.433 -12.576
    5    HG2  MET  23           HG2      MET  23 -26.044  -7.756 -10.601
    6    HG3  MET  23           HG3      MET  23 -24.306  -8.032 -10.485
    7    HE2  MET  23           HE1      MET  23 -26.874  -4.567  -9.292
    8    HE1  MET  23           HE2      MET  23 -27.062  -5.557 -10.738
    9    HE3  MET  23           HE3      MET  23 -26.142  -4.054 -10.814

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ARG  24           H        ARG  24 -23.057  -7.280 -14.771
    2    HA   ARG  24           HA       ARG  24 -24.665  -6.108 -16.763
    3    HB2  ARG  24           HB2      ARG  24 -22.253  -5.527 -16.393
    4    HB3  ARG  24           HB3      ARG  24 -21.804  -7.089 -17.032
    5    HG2  ARG  24           HG2      ARG  24 -22.724  -6.485 -19.261
    6    HG3  ARG  24           HG3      ARG  24 -23.223  -4.904 -18.604
    7    HD2  ARG  24           HD2      ARG  24 -20.367  -5.993 -18.626
    8    HD3  ARG  24           HD3      ARG  24 -21.015  -4.812 -19.756
    9    HE   ARG  24           HE       ARG  24 -21.451  -3.555 -17.471
   10   HH21  ARG  24          HH11      ARG  24 -20.243  -1.664 -17.602
   11   HH22  ARG  24          HH12      ARG  24 -18.530  -1.755 -17.823
   12   HH11  ARG  24          HH21      ARG  24 -18.687  -5.231 -18.473
   13   HH12  ARG  24          HH22      ARG  24 -17.619  -3.871 -18.327

  No H/Q in entry =          13
  In of MODEL   81
    1    H    ALA  25           H        ALA  25 -23.286  -9.348 -16.486
    2    HA   ALA  25           HA       ALA  25 -23.866 -10.235 -19.116
    3    HB1  ALA  25           HB1      ALA  25 -23.011 -12.205 -18.420
    4    HB3  ALA  25           HB2      ALA  25 -24.058 -12.260 -17.001
    5    HB2  ALA  25           HB3      ALA  25 -22.570 -11.316 -16.961

  No H/Q in entry =           5
  In of MODEL   81
    1    H    GLN  26           H        GLN  26 -25.665 -10.404 -16.080
    2    HA   GLN  26           HA       GLN  26 -27.916 -11.786 -17.078
    3    HB2  GLN  26           HB2      GLN  26 -27.523  -9.997 -14.698
    4    HB3  GLN  26           HB3      GLN  26 -29.028 -10.838 -15.036
    5    HG2  GLN  26           HG2      GLN  26 -26.336 -12.092 -14.581
    6    HG3  GLN  26           HG3      GLN  26 -27.692 -12.090 -13.462
    7   HE21  GLN  26          HE21      GLN  26 -26.321 -14.158 -14.742
    8   HE22  GLN  26          HE22      GLN  26 -27.285 -15.285 -15.529

  No H/Q in entry =           8
  In of MODEL   81
    1    H    ALA  27           H        ALA  27 -27.242  -8.325 -16.700
    2    HA   ALA  27           HA       ALA  27 -29.812  -7.428 -17.470
    3    HB1  ALA  27           HB1      ALA  27 -28.101  -5.976 -16.370
    4    HB3  ALA  27           HB2      ALA  27 -28.758  -5.261 -17.843
    5    HB2  ALA  27           HB3      ALA  27 -27.161  -6.008 -17.862

  No H/Q in entry =           5
  In of MODEL   81
    1    H    GLU  28           H        GLU  28 -27.038  -8.446 -19.354
    2    HA   GLU  28           HA       GLU  28 -28.066  -7.487 -21.869
    3    HB2  GLU  28           HB2      GLU  28 -25.638  -7.984 -21.260
    4    HB3  GLU  28           HB3      GLU  28 -26.056  -9.686 -21.456
    5    HG2  GLU  28           HG2      GLU  28 -24.985  -8.829 -23.432
    6    HG3  GLU  28           HG3      GLU  28 -26.655  -9.282 -23.769

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LYS  29           H        LYS  29 -27.984 -10.592 -20.206
    2    HA   LYS  29           HA       LYS  29 -29.185 -12.162 -22.200
    3    HB2  LYS  29           HB2      LYS  29 -28.050 -13.059 -20.201
    4    HB3  LYS  29           HB3      LYS  29 -29.365 -12.449 -19.198
    5    HG2  LYS  29           HG2      LYS  29 -30.923 -13.946 -20.253
    6    HG3  LYS  29           HG3      LYS  29 -29.686 -14.490 -21.384
    7    HD2  LYS  29           HD2      LYS  29 -28.447 -15.563 -19.656
    8    HD3  LYS  29           HD3      LYS  29 -29.407 -14.790 -18.396
    9    HE2  LYS  29           HE2      LYS  29 -29.981 -17.191 -18.749
   10    HE3  LYS  29           HE3      LYS  29 -31.348 -16.100 -18.987
   11    HZ1  LYS  29           HZ1      LYS  29 -30.790 -16.195 -21.418
   12    HZ3  LYS  29           HZ2      LYS  29 -31.398 -17.631 -20.745
   13    HZ2  LYS  29           HZ3      LYS  29 -29.737 -17.476 -21.054

  No H/Q in entry =          13
  In of MODEL   81
    1    H    TYR  30           H        TYR  30 -30.716 -10.164 -19.689
    2    HA   TYR  30           HA       TYR  30 -33.346 -10.818 -20.912
    3    HB2  TYR  30           HB2      TYR  30 -32.765  -9.613 -18.197
    4    HB3  TYR  30           HB3      TYR  30 -34.361  -9.993 -18.839
    5    HD1  TYR  30           HD1      TYR  30 -35.096 -12.349 -19.043
    6    HD2  TYR  30           HD2      TYR  30 -31.316 -11.333 -17.367
    7    HE1  TYR  30           HE1      TYR  30 -34.823 -14.662 -18.243
    8    HE2  TYR  30           HE2      TYR  30 -31.046 -13.632 -16.571
    9    HH   TYR  30           HH       TYR  30 -32.507 -16.113 -17.650

  No H/Q in entry =           9
  In of MODEL   81
    1    H    GLU  31           H        GLU  31 -31.343  -8.668 -21.730
    2    HA   GLU  31           HA       GLU  31 -31.441  -6.513 -22.556
    3    HB2  GLU  31           HB2      GLU  31 -34.276  -7.449 -23.048
    4    HB3  GLU  31           HB3      GLU  31 -33.547  -6.023 -23.786
    5    HG2  GLU  31           HG2      GLU  31 -31.976  -7.346 -24.985
    6    HG3  GLU  31           HG3      GLU  31 -32.425  -8.798 -24.091

  No H/Q in entry =           6
  In of MODEL   81
    1    H    VAL  32           H        VAL  32 -31.629  -6.423 -19.822
    2    HA   VAL  32           HA       VAL  32 -33.644  -4.458 -19.155
    3    HB   VAL  32           HB       VAL  32 -31.171  -5.261 -17.588
    4   HG12  VAL  32          HG11      VAL  32 -32.754  -4.554 -15.684
    5   HG11  VAL  32          HG12      VAL  32 -33.663  -3.720 -16.944
    6   HG13  VAL  32          HG13      VAL  32 -31.982  -3.284 -16.635
    7   HG21  VAL  32          HG21      VAL  32 -32.807  -7.114 -18.262
    8   HG23  VAL  32          HG22      VAL  32 -33.899  -6.367 -17.096
    9   HG22  VAL  32          HG23      VAL  32 -32.328  -6.971 -16.571

  No H/Q in entry =           9
  In of MODEL   81
    1    HA   PRO  33           HA       PRO  33 -30.859  -1.307 -20.852
    2    HB2  PRO  33           HB2      PRO  33 -32.538   0.792 -20.721
    3    HB3  PRO  33           HB3      PRO  33 -32.911  -0.543 -21.811
    4    HG2  PRO  33           HG2      PRO  33 -33.898  -0.099 -18.992
    5    HG3  PRO  33           HG3      PRO  33 -34.852  -0.385 -20.446
    6    HD2  PRO  33           HD2      PRO  33 -34.226  -2.413 -18.781
    7    HD3  PRO  33           HD3      PRO  33 -34.281  -2.661 -20.527

  No H/Q in entry =           7
  In of MODEL   81
    1    H    VAL  34           H        VAL  34 -29.544  -1.747 -18.911
    2    HA   VAL  34           HA       VAL  34 -29.439   0.696 -17.268
    3    HB   VAL  34           HB       VAL  34 -28.733  -0.712 -15.333
    4   HG12  VAL  34          HG11      VAL  34 -31.068  -1.771 -15.008
    5   HG11  VAL  34          HG12      VAL  34 -31.452  -1.040 -16.565
    6   HG13  VAL  34          HG13      VAL  34 -30.969  -0.021 -15.209
    7   HG21  VAL  34          HG21      VAL  34 -28.772  -2.751 -17.337
    8   HG23  VAL  34          HG22      VAL  34 -29.789  -3.191 -15.964
    9   HG22  VAL  34          HG23      VAL  34 -28.097  -2.770 -15.709

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ILE  35           H        ILE  35 -27.498   1.286 -16.442
    2    HA   ILE  35           HA       ILE  35 -25.104   0.139 -17.720
    3    HB   ILE  35           HB       ILE  35 -25.725   2.990 -16.909
    4   HG12  ILE  35          HG12      ILE  35 -24.659   1.760 -19.459
    5   HG13  ILE  35          HG13      ILE  35 -26.332   2.251 -19.189
    6   HG21  ILE  35          HG21      ILE  35 -23.052   1.663 -17.234
    7   HG23  ILE  35          HG22      ILE  35 -23.589   2.805 -16.003
    8   HG22  ILE  35          HG23      ILE  35 -23.262   3.364 -17.643
    9   HD11  ILE  35          HD11      ILE  35 -25.103   4.550 -18.600
   10   HD13  ILE  35          HD12      ILE  35 -25.619   4.123 -20.232
   11   HD12  ILE  35          HD13      ILE  35 -23.940   3.885 -19.746

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ILE  36           H        ILE  36 -23.787  -0.782 -16.128
    2    HA   ILE  36           HA       ILE  36 -24.254  -0.199 -13.255
    3    HB   ILE  36           HB       ILE  36 -23.225  -2.830 -14.366
    4   HG12  ILE  36          HG12      ILE  36 -26.081  -2.247 -13.584
    5   HG13  ILE  36          HG13      ILE  36 -25.525  -2.184 -15.256
    6   HG23  ILE  36          HG21      ILE  36 -23.495  -3.681 -12.249
    7   HG22  ILE  36          HG22      ILE  36 -24.716  -2.489 -11.804
    8   HG21  ILE  36          HG23      ILE  36 -23.017  -2.022 -11.887
    9   HD13  ILE  36          HD11      ILE  36 -25.516  -4.404 -15.459
   10   HD12  ILE  36          HD12      ILE  36 -26.579  -4.364 -14.052
   11   HD11  ILE  36          HD13      ILE  36 -24.851  -4.649 -13.844

  No H/Q in entry =          11
  In of MODEL   81
    1    H    GLU  37           H        GLU  37 -22.521   0.571 -12.163
    2    HA   GLU  37           HA       GLU  37 -19.783  -0.013 -13.097
    3    HB2  GLU  37           HB2      GLU  37 -20.890   2.699 -12.391
    4    HB3  GLU  37           HB3      GLU  37 -19.170   2.340 -12.540
    5    HG2  GLU  37           HG2      GLU  37 -19.467   1.847 -14.897
    6    HG3  GLU  37           HG3      GLU  37 -21.194   2.170 -14.754

  No H/Q in entry =           6
  In of MODEL   81
    1    H    ALA  38           H        ALA  38 -18.269  -0.130 -11.425
    2    HA   ALA  38           HA       ALA  38 -19.293  -0.029  -8.647
    3    HB1  ALA  38           HB1      ALA  38 -17.441  -1.828 -10.083
    4    HB3  ALA  38           HB2      ALA  38 -18.458  -2.144  -8.678
    5    HB2  ALA  38           HB3      ALA  38 -16.904  -1.336  -8.476

  No H/Q in entry =           5
  In of MODEL   81
    1    H    PHE  39           H        PHE  39 -18.143   1.278  -7.184
    2    HA   PHE  39           HA       PHE  39 -15.728   2.676  -8.099
    3    HB2  PHE  39           HB2      PHE  39 -18.229   3.978  -7.034
    4    HB3  PHE  39           HB3      PHE  39 -16.657   4.773  -7.023
    5    HD1  PHE  39           HD1      PHE  39 -15.434   4.829  -9.336
    6    HD2  PHE  39           HD2      PHE  39 -19.633   4.316  -8.809
    7    HE1  PHE  39           HE1      PHE  39 -15.810   5.640 -11.647
    8    HE2  PHE  39           HE2      PHE  39 -20.025   5.118 -11.111
    9    HZ   PHE  39           HZ       PHE  39 -18.119   5.753 -12.548

  No H/Q in entry =           9
  In of MODEL   81
    1    HA   PRO  40           HA       PRO  40 -14.703   2.007  -3.818
    2    HB2  PRO  40           HB2      PRO  40 -13.100   4.160  -3.227
    3    HB3  PRO  40           HB3      PRO  40 -12.557   2.866  -4.295
    4    HG2  PRO  40           HG2      PRO  40 -13.802   5.508  -5.039
    5    HG3  PRO  40           HG3      PRO  40 -12.319   4.781  -5.656
    6    HD2  PRO  40           HD2      PRO  40 -14.537   4.515  -7.046
    7    HD3  PRO  40           HD3      PRO  40 -13.465   3.127  -6.860

  No H/Q in entry =           7
  In of MODEL   81
    1    H    GLU  41           H        GLU  41 -15.387   2.935  -1.685
    2    HA   GLU  41           HA       GLU  41 -17.762   4.450  -1.655
    3    HB2  GLU  41           HB2      GLU  41 -17.254   4.643   0.829
    4    HB3  GLU  41           HB3      GLU  41 -17.387   3.011   0.176
    5    HG2  GLU  41           HG2      GLU  41 -15.561   2.861   1.590
    6    HG3  GLU  41           HG3      GLU  41 -14.822   3.092   0.006

  No H/Q in entry =           6
  In of MODEL   81
    1    H    THR  42           H        THR  42 -14.517   5.636  -1.731
    2    HA   THR  42           HA       THR  42 -15.068   8.161  -0.519
    3    HB   THR  42           HB       THR  42 -12.974   8.907  -1.636
    4    HG1  THR  42           HG1      THR  42 -12.913   6.275  -2.700
    5   HG22  THR  42          HG21      THR  42 -12.628   6.120  -0.522
    6   HG21  THR  42          HG22      THR  42 -13.012   7.511   0.494
    7   HG23  THR  42          HG23      THR  42 -11.504   7.476  -0.417

  No H/Q in entry =           7
  In of MODEL   81
    1    H    LEU  43           H        LEU  43 -15.901   6.991  -3.612
    2    HA   LEU  43           HA       LEU  43 -16.386   9.732  -4.584
    3    HB2  LEU  43           HB2      LEU  43 -16.570   7.069  -5.982
    4    HB3  LEU  43           HB3      LEU  43 -16.864   8.637  -6.730
    5    HG   LEU  43           HG       LEU  43 -14.202   7.673  -5.714
    6   HD12  LEU  43          HD11      LEU  43 -14.962   8.128  -8.578
    7   HD11  LEU  43          HD12      LEU  43 -15.260   6.574  -7.803
    8   HD13  LEU  43          HD13      LEU  43 -13.616   7.198  -7.920
    9   HD21  LEU  43          HD21      LEU  43 -15.117  10.178  -7.125
   10   HD23  LEU  43          HD22      LEU  43 -13.429   9.666  -7.082
   11   HD22  LEU  43          HD23      LEU  43 -14.275  10.045  -5.581

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ALA  44           H        ALA  44 -18.164   7.758  -2.715
    2    HA   ALA  44           HA       ALA  44 -20.631   7.413  -4.019
    3    HB2  ALA  44           HB1      ALA  44 -20.387   6.315  -1.922
    4    HB3  ALA  44           HB2      ALA  44 -21.599   7.566  -1.644
    5    HB1  ALA  44           HB3      ALA  44 -19.939   7.812  -1.103

  No H/Q in entry =           5
  In of MODEL   81
    1    H    GLY  45           H        GLY  45 -19.434  10.322  -2.501
    2    HA3  GLY  45           HA2      GLY  45 -21.988  11.617  -2.845
    3    HA2  GLY  45           HA3      GLY  45 -20.496  12.368  -2.280

  No H/Q in entry =           3
  In of MODEL   81
    1    H    GLU  46           H        GLU  46 -18.909  11.554  -4.580
    2    HA   GLU  46           HA       GLU  46 -19.737  13.708  -6.348
    3    HB2  GLU  46           HB2      GLU  46 -17.380  13.439  -5.768
    4    HB3  GLU  46           HB3      GLU  46 -17.388  11.807  -6.437
    5    HG2  GLU  46           HG2      GLU  46 -16.328  13.225  -8.013
    6    HG3  GLU  46           HG3      GLU  46 -17.911  12.801  -8.660

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LYS  47           H        LYS  47 -19.334  10.209  -6.779
    2    HA   LYS  47           HA       LYS  47 -20.465  10.334  -9.447
    3    HB2  LYS  47           HB2      LYS  47 -19.716   7.987  -7.694
    4    HB3  LYS  47           HB3      LYS  47 -20.249   7.869  -9.372
    5    HG2  LYS  47           HG2      LYS  47 -17.844   9.470  -8.599
    6    HG3  LYS  47           HG3      LYS  47 -17.749   7.736  -8.899
    7    HD2  LYS  47           HD2      LYS  47 -18.677   8.052 -11.127
    8    HD3  LYS  47           HD3      LYS  47 -18.835   9.782 -10.830
    9    HE2  LYS  47           HE2      LYS  47 -16.855   9.378 -12.137
   10    HE3  LYS  47           HE3      LYS  47 -16.385   9.913 -10.524
   11    HZ2  LYS  47           HZ1      LYS  47 -15.887   7.424 -11.841
   12    HZ1  LYS  47           HZ2      LYS  47 -16.534   7.222 -10.284
   13    HZ3  LYS  47           HZ3      LYS  47 -15.109   8.120 -10.501

  No H/Q in entry =          13
  In of MODEL   81
    1    H    GLY  48           H        GLY  48 -21.700   9.477  -6.289
    2    HA3  GLY  48           HA2      GLY  48 -23.985   8.099  -7.011
    3    HA2  GLY  48           HA3      GLY  48 -23.831   9.112  -5.575

  No H/Q in entry =           3
  In of MODEL   81
    1    H    GLN  49           H        GLN  49 -23.459  11.571  -7.154
    2    HA   GLN  49           HA       GLN  49 -26.102  12.469  -7.282
    3    HB2  GLN  49           HB2      GLN  49 -23.646  13.535  -8.661
    4    HB3  GLN  49           HB3      GLN  49 -25.182  14.378  -8.568
    5    HG2  GLN  49           HG2      GLN  49 -25.008  14.420  -6.132
    6    HG3  GLN  49           HG3      GLN  49 -23.484  13.555  -6.224
    7   HE21  GLN  49          HE21      GLN  49 -23.541  15.788  -4.955
    8   HE22  GLN  49          HE22      GLN  49 -22.727  17.114  -5.611

  No H/Q in entry =           8
  In of MODEL   81
    1    H    ASN  50           H        ASN  50 -24.292  10.728  -9.678
    2    HA   ASN  50           HA       ASN  50 -26.254  11.440 -11.747
    3    HB2  ASN  50           HB2      ASN  50 -23.559  10.114 -11.997
    4    HB3  ASN  50           HB3      ASN  50 -24.650  10.450 -13.333
    5   HD21  ASN  50          HD21      ASN  50 -22.080  11.511 -11.743
    6   HD22  ASN  50          HD22      ASN  50 -21.983  13.159 -12.089

  No H/Q in entry =           6
  In of MODEL   81
    1    H    ALA  51           H        ALA  51 -26.032   9.097  -9.498
    2    HA   ALA  51           HA       ALA  51 -26.652   6.891 -11.316
    3    HB2  ALA  51           HB1      ALA  51 -25.950   5.598  -9.632
    4    HB3  ALA  51           HB2      ALA  51 -27.126   6.314  -8.532
    5    HB1  ALA  51           HB3      ALA  51 -25.545   7.066  -8.742

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ASP  52           H        ASP  52 -28.565   5.677 -11.160
    2    HA   ASP  52           HA       ASP  52 -30.882   7.329 -10.483
    3    HB2  ASP  52           HB2      ASP  52 -30.501   4.845 -12.150
    4    HB3  ASP  52           HB3      ASP  52 -32.097   5.451 -11.705

  No H/Q in entry =           4
  In of MODEL   81
    1    H    VAL  53           H        VAL  53 -29.047   4.582  -9.473
    2    HA   VAL  53           HA       VAL  53 -30.475   4.598  -6.947
    3    HB   VAL  53           HB       VAL  53 -31.746   2.846  -8.179
    4   HG11  VAL  53          HG11      VAL  53 -29.946   2.126  -9.712
    5   HG13  VAL  53          HG12      VAL  53 -30.666   0.771  -8.844
    6   HG12  VAL  53          HG13      VAL  53 -29.098   1.401  -8.347
    7   HG23  VAL  53          HG21      VAL  53 -30.756   0.944  -6.489
    8   HG22  VAL  53          HG22      VAL  53 -31.983   2.155  -6.116
    9   HG21  VAL  53          HG23      VAL  53 -30.294   2.464  -5.721

  No H/Q in entry =           9
  In of MODEL   81
    1    H    VAL  54           H        VAL  54 -29.120   4.274  -5.301
    2    HA   VAL  54           HA       VAL  54 -26.305   3.648  -5.931
    3    HB   VAL  54           HB       VAL  54 -27.498   5.339  -3.676
    4   HG11  VAL  54          HG11      VAL  54 -24.816   4.130  -3.983
    5   HG13  VAL  54          HG12      VAL  54 -25.611   4.750  -2.537
    6   HG12  VAL  54          HG13      VAL  54 -24.800   5.860  -3.641
    7   HG22  VAL  54          HG21      VAL  54 -26.795   7.214  -4.784
    8   HG21  VAL  54          HG22      VAL  54 -27.270   6.180  -6.131
    9   HG23  VAL  54          HG23      VAL  54 -25.568   6.343  -5.705

  No H/Q in entry =           9
  In of MODEL   81
    1    H    LEU  55           H        LEU  55 -25.557   1.781  -5.290
    2    HA   LEU  55           HA       LEU  55 -26.940   0.359  -3.102
    3    HB2  LEU  55           HB2      LEU  55 -25.312  -0.687  -5.406
    4    HB3  LEU  55           HB3      LEU  55 -25.986  -1.675  -4.110
    5    HG   LEU  55           HG       LEU  55 -27.559  -0.212  -6.220
    6   HD13  LEU  55          HD11      LEU  55 -27.122  -2.038  -7.439
    7   HD12  LEU  55          HD12      LEU  55 -27.998  -2.983  -6.235
    8   HD11  LEU  55          HD13      LEU  55 -26.252  -2.779  -6.097
    9   HD23  LEU  55          HD21      LEU  55 -28.682  -2.252  -4.352
   10   HD22  LEU  55          HD22      LEU  55 -29.491  -0.931  -5.197
   11   HD21  LEU  55          HD23      LEU  55 -28.485  -0.591  -3.789

  No H/Q in entry =          11
  In of MODEL   81
    1    H    LEU  56           H        LEU  56 -25.733  -0.139  -1.303
    2    HA   LEU  56           HA       LEU  56 -22.839   0.489  -1.375
    3    HB2  LEU  56           HB2      LEU  56 -24.603   0.140   1.038
    4    HB3  LEU  56           HB3      LEU  56 -22.933   0.704   1.013
    5    HG   LEU  56           HG       LEU  56 -25.365   2.193   0.063
    6   HD11  LEU  56          HD11      LEU  56 -24.205   1.906   2.576
    7   HD13  LEU  56          HD12      LEU  56 -25.305   3.191   2.075
    8   HD12  LEU  56          HD13      LEU  56 -23.562   3.435   1.975
    9   HD23  LEU  56          HD21      LEU  56 -23.562   4.040  -0.147
   10   HD22  LEU  56          HD22      LEU  56 -23.866   2.913  -1.470
   11   HD21  LEU  56          HD23      LEU  56 -22.482   2.672  -0.406

  No H/Q in entry =          11
  In of MODEL   81
    1    H    GLY  57           H        GLY  57 -21.330  -1.025  -0.847
    2    HA3  GLY  57           HA2      GLY  57 -22.040  -3.777  -1.034
    3    HA2  GLY  57           HA3      GLY  57 -20.457  -3.155  -0.571

  No H/Q in entry =           3
  In of MODEL   81
    1    HA   PRO  58           HA       PRO  58 -23.149  -4.405   3.164
    2    HB2  PRO  58           HB2      PRO  58 -22.255  -6.946   3.770
    3    HB3  PRO  58           HB3      PRO  58 -23.674  -6.651   2.766
    4    HG2  PRO  58           HG2      PRO  58 -20.891  -7.314   1.962
    5    HG3  PRO  58           HG3      PRO  58 -22.419  -7.898   1.302
    6    HD2  PRO  58           HD2      PRO  58 -20.968  -5.962   0.066
    7    HD3  PRO  58           HD3      PRO  58 -22.730  -6.015  -0.024

  No H/Q in entry =           7
  In of MODEL   81
    1    H    GLN  59           H        GLN  59 -19.755  -4.610   2.534
    2    HA   GLN  59           HA       GLN  59 -18.982  -4.562   5.289
    3    HB2  GLN  59           HB2      GLN  59 -17.631  -4.707   2.848
    4    HB3  GLN  59           HB3      GLN  59 -17.131  -3.178   3.541
    5    HG2  GLN  59           HG2      GLN  59 -15.598  -4.972   4.131
    6    HG3  GLN  59           HG3      GLN  59 -16.386  -4.319   5.559
    7   HE21  GLN  59          HE21      GLN  59 -16.439  -5.919   6.701
    8   HE22  GLN  59          HE22      GLN  59 -17.057  -7.462   6.759

  No H/Q in entry =           8
  In of MODEL   81
    1    H    ILE  60           H        ILE  60 -20.130  -2.097   3.084
    2    HA   ILE  60           HA       ILE  60 -19.421  -0.075   5.119
    3    HB   ILE  60           HB       ILE  60 -19.815   1.625   3.285
    4   HG12  ILE  60          HG12      ILE  60 -19.417  -0.591   1.318
    5   HG13  ILE  60          HG13      ILE  60 -21.047  -0.187   1.861
    6   HG21  ILE  60          HG21      ILE  60 -17.590   0.763   4.032
    7   HG23  ILE  60          HG22      ILE  60 -17.645   1.458   2.413
    8   HG22  ILE  60          HG23      ILE  60 -17.616  -0.293   2.621
    9   HD12  ILE  60          HD11      ILE  60 -19.143   1.430   0.211
   10   HD11  ILE  60          HD12      ILE  60 -20.337   2.259   1.208
   11   HD13  ILE  60          HD13      ILE  60 -20.862   1.127  -0.039

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ALA  61           H        ALA  61 -21.742  -1.848   5.209
    2    HA   ALA  61           HA       ALA  61 -24.096  -0.366   4.763
    3    HB1  ALA  61           HB1      ALA  61 -25.181  -1.944   6.100
    4    HB2  ALA  61           HB2      ALA  61 -23.749  -2.220   7.094
    5    HB3  ALA  61           HB3      ALA  61 -23.809  -2.835   5.442

  No H/Q in entry =           5
  In of MODEL   81
    1    H    TYR  62           H        TYR  62 -21.867  -0.297   7.546
    2    HA   TYR  62           HA       TYR  62 -23.536   1.236   9.224
    3    HB2  TYR  62           HB2      TYR  62 -21.553   1.787  10.467
    4    HB3  TYR  62           HB3      TYR  62 -21.425   0.109   9.943
    5    HD1  TYR  62           HD1      TYR  62 -19.746  -0.565   8.284
    6    HD2  TYR  62           HD2      TYR  62 -20.028   3.499   9.573
    7    HE1  TYR  62           HE1      TYR  62 -17.569  -0.084   7.229
    8    HE2  TYR  62           HE2      TYR  62 -17.837   3.976   8.520
    9    HH   TYR  62           HH       TYR  62 -15.729   1.633   7.607

  No H/Q in entry =           9
  In of MODEL   81
    1    H    MET  63           H        MET  63 -21.986   2.214   6.355
    2    HA   MET  63           HA       MET  63 -22.038   5.053   7.043
    3    HB2  MET  63           HB2      MET  63 -21.326   3.572   4.511
    4    HB3  MET  63           HB3      MET  63 -21.280   5.328   4.677
    5    HG2  MET  63           HG2      MET  63 -19.531   5.147   6.338
    6    HG3  MET  63           HG3      MET  63 -19.601   3.389   6.243
    7    HE2  MET  63           HE1      MET  63 -17.789   6.458   3.718
    8    HE1  MET  63           HE2      MET  63 -19.354   6.551   4.529
    9    HE3  MET  63           HE3      MET  63 -19.267   6.071   2.833

  No H/Q in entry =           9
  In of MODEL   81
    1    H    LEU  64           H        LEU  64 -24.456   3.001   6.100
    2    HA   LEU  64           HA       LEU  64 -25.787   4.315   4.029
    3    HB2  LEU  64           HB2      LEU  64 -26.481   2.150   4.956
    4    HB3  LEU  64           HB3      LEU  64 -26.992   2.959   6.438
    5    HG   LEU  64           HG       LEU  64 -28.789   4.074   5.220
    6   HD13  LEU  64          HD11      LEU  64 -28.542   4.331   2.985
    7   HD12  LEU  64          HD12      LEU  64 -29.059   2.650   2.847
    8   HD11  LEU  64          HD13      LEU  64 -27.341   3.044   2.892
    9   HD23  LEU  64          HD21      LEU  64 -29.092   1.228   4.481
   10   HD22  LEU  64          HD22      LEU  64 -30.159   2.284   5.406
   11   HD21  LEU  64          HD23      LEU  64 -28.721   1.602   6.165

  No H/Q in entry =          11
  In of MODEL   81
    1    HA   PRO  65           HA       PRO  65 -28.186   7.297   6.790
    2    HB2  PRO  65           HB2      PRO  65 -26.187   7.616   9.029
    3    HB3  PRO  65           HB3      PRO  65 -27.942   7.761   9.088
    4    HG2  PRO  65           HG2      PRO  65 -26.834   5.587  10.011
    5    HG3  PRO  65           HG3      PRO  65 -28.255   5.442   8.977
    6    HD2  PRO  65           HD2      PRO  65 -25.349   5.050   8.253
    7    HD3  PRO  65           HD3      PRO  65 -26.736   4.053   7.818

  No H/Q in entry =           7
  In of MODEL   81
    1    H    GLU  66           H        GLU  66 -24.636   7.517   6.837
    2    HA   GLU  66           HA       GLU  66 -24.558  10.329   6.425
    3    HB2  GLU  66           HB2      GLU  66 -22.578   8.167   5.763
    4    HB3  GLU  66           HB3      GLU  66 -22.261   9.888   5.549
    5    HG2  GLU  66           HG2      GLU  66 -22.483  10.247   7.918
    6    HG3  GLU  66           HG3      GLU  66 -22.877   8.544   8.157

  No H/Q in entry =           6
  In of MODEL   81
    1    H    ILE  67           H        ILE  67 -24.465   7.578   4.178
    2    HA   ILE  67           HA       ILE  67 -24.198   9.308   1.878
    3    HB   ILE  67           HB       ILE  67 -24.871   6.341   2.071
    4   HG12  ILE  67          HG12      ILE  67 -22.345   7.707   1.126
    5   HG13  ILE  67          HG13      ILE  67 -22.594   7.270   2.815
    6   HG21  ILE  67          HG21      ILE  67 -24.974   8.213  -0.158
    7   HG23  ILE  67          HG22      ILE  67 -25.471   6.523  -0.100
    8   HG22  ILE  67          HG23      ILE  67 -23.791   6.936  -0.442
    9   HD12  ILE  67          HD11      ILE  67 -22.058   5.529   0.466
   10   HD11  ILE  67          HD12      ILE  67 -23.015   4.884   1.797
   11   HD13  ILE  67          HD13      ILE  67 -21.381   5.477   2.093

  No H/Q in entry =          11
  In of MODEL   81
    1    H    GLN  68           H        GLN  68 -26.968   8.043   3.536
    2    HA   GLN  68           HA       GLN  68 -28.877   8.828   1.575
    3    HB2  GLN  68           HB2      GLN  68 -29.082   8.458   4.560
    4    HB3  GLN  68           HB3      GLN  68 -30.450   8.950   3.576
    5    HG2  GLN  68           HG2      GLN  68 -30.335   6.920   2.303
    6    HG3  GLN  68           HG3      GLN  68 -28.840   6.457   3.095
    7   HE21  GLN  68          HE21      GLN  68 -30.912   4.938   2.980
    8   HE22  GLN  68          HE22      GLN  68 -31.693   4.425   4.402

  No H/Q in entry =           8
  In of MODEL   81
    1    H    ARG  69           H        ARG  69 -27.380  10.616   4.296
    2    HA   ARG  69           HA       ARG  69 -28.930  12.988   3.897
    3    HB2  ARG  69           HB2      ARG  69 -26.510  12.240   5.468
    4    HB3  ARG  69           HB3      ARG  69 -26.720  13.949   5.108
    5    HG2  ARG  69           HG2      ARG  69 -29.026  13.820   6.098
    6    HG3  ARG  69           HG3      ARG  69 -28.689  12.152   6.573
    7    HD2  ARG  69           HD2      ARG  69 -27.169  14.628   7.470
    8    HD3  ARG  69           HD3      ARG  69 -28.220  13.643   8.474
    9    HE   ARG  69           HE       ARG  69 -25.553  12.907   7.506
   10   HH21  ARG  69          HH11      ARG  69 -24.607  11.211   8.697
   11   HH22  ARG  69          HH12      ARG  69 -25.563  10.322   9.836
   12   HH11  ARG  69          HH21      ARG  69 -28.447  12.145   9.227
   13   HH12  ARG  69          HH22      ARG  69 -27.737  10.849  10.133

  No H/Q in entry =          13
  In of MODEL   81
    1    H    LEU  70           H        LEU  70 -25.973  11.796   2.517
    2    HA   LEU  70           HA       LEU  70 -25.047  14.235   1.336
    3    HB2  LEU  70           HB2      LEU  70 -23.879  11.998   1.927
    4    HB3  LEU  70           HB3      LEU  70 -24.470  11.485   0.347
    5    HG   LEU  70           HG       LEU  70 -22.992  12.969  -0.753
    6   HD11  LEU  70          HD11      LEU  70 -22.211  13.877   2.027
    7   HD13  LEU  70          HD12      LEU  70 -22.992  14.855   0.782
    8   HD12  LEU  70          HD13      LEU  70 -21.336  14.293   0.551
    9   HD22  LEU  70          HD21      LEU  70 -21.433  11.363  -0.530
   10   HD21  LEU  70          HD22      LEU  70 -22.307  10.778   0.886
   11   HD23  LEU  70          HD23      LEU  70 -21.004  11.950   1.077

  No H/Q in entry =          11
  In of MODEL   81
    1    H    LEU  71           H        LEU  71 -27.016  11.538   0.242
    2    HA   LEU  71           HA       LEU  71 -27.668  12.977  -2.273
    3    HB2  LEU  71           HB2      LEU  71 -27.652   9.988  -1.820
    4    HB3  LEU  71           HB3      LEU  71 -27.855  10.833  -3.354
    5    HG   LEU  71           HG       LEU  71 -25.330  11.032  -1.713
    6   HD12  LEU  71          HD11      LEU  71 -25.284   9.400  -4.142
    7   HD11  LEU  71          HD12      LEU  71 -26.235   8.708  -2.830
    8   HD13  LEU  71          HD13      LEU  71 -24.538   9.112  -2.570
    9   HD22  LEU  71          HD21      LEU  71 -25.576  12.834  -3.208
   10   HD21  LEU  71          HD22      LEU  71 -26.007  11.754  -4.535
   11   HD23  LEU  71          HD23      LEU  71 -24.374  11.727  -3.870

  No H/Q in entry =          11
  In of MODEL   81
    1    HA   PRO  72           HA       PRO  72 -31.471  12.256   0.381
    2    HB2  PRO  72           HB2      PRO  72 -32.510  14.749   0.303
    3    HB3  PRO  72           HB3      PRO  72 -31.164  14.394   1.384
    4    HG2  PRO  72           HG2      PRO  72 -31.086  15.593  -1.373
    5    HG3  PRO  72           HG3      PRO  72 -30.350  16.201   0.109
    6    HD2  PRO  72           HD2      PRO  72 -28.918  14.739  -1.665
    7    HD3  PRO  72           HD3      PRO  72 -28.638  14.595   0.068

  No H/Q in entry =           7
  In of MODEL   81
    1    H    ASN  73           H        ASN  73 -30.943  13.247  -2.840
    2    HA   ASN  73           HA       ASN  73 -33.779  12.733  -3.448
    3    HB2  ASN  73           HB2      ASN  73 -33.410  13.866  -5.551
    4    HB3  ASN  73           HB3      ASN  73 -32.947  14.884  -4.196
    5   HD21  ASN  73          HD21      ASN  73 -32.179  14.979  -6.880
    6   HD22  ASN  73          HD22      ASN  73 -30.506  14.936  -7.085

  No H/Q in entry =           6
  In of MODEL   81
    1    H    LYS  74           H        LYS  74 -31.641  10.625  -3.037
    2    HA   LYS  74           HA       LYS  74 -32.129   9.188  -5.577
    3    HB2  LYS  74           HB2      LYS  74 -29.569   9.079  -3.976
    4    HB3  LYS  74           HB3      LYS  74 -29.906   8.238  -5.490
    5    HG2  LYS  74           HG2      LYS  74 -29.850  11.220  -5.295
    6    HG3  LYS  74           HG3      LYS  74 -28.407  10.255  -5.609
    7    HD2  LYS  74           HD2      LYS  74 -29.471   9.247  -7.541
    8    HD3  LYS  74           HD3      LYS  74 -30.954  10.143  -7.211
    9    HE2  LYS  74           HE2      LYS  74 -29.877  12.229  -7.667
   10    HE3  LYS  74           HE3      LYS  74 -28.297  11.448  -7.769
   11    HZ2  LYS  74           HZ1      LYS  74 -29.824  11.942  -9.884
   12    HZ1  LYS  74           HZ2      LYS  74 -30.368  10.379  -9.503
   13    HZ3  LYS  74           HZ3      LYS  74 -28.720  10.653  -9.814

  No H/Q in entry =          13
  In of MODEL   81
    1    HA   PRO  75           HA       PRO  75 -33.287   6.119  -2.590
    2    HB2  PRO  75           HB2      PRO  75 -33.454   3.882  -4.166
    3    HB3  PRO  75           HB3      PRO  75 -34.673   5.154  -4.228
    4    HG2  PRO  75           HG2      PRO  75 -32.313   4.717  -6.018
    5    HG3  PRO  75           HG3      PRO  75 -33.991   5.038  -6.452
    6    HD2  PRO  75           HD2      PRO  75 -32.184   7.033  -6.428
    7    HD3  PRO  75           HD3      PRO  75 -33.835   7.320  -5.878

  No H/Q in entry =           7
  In of MODEL   81
    1    H    VAL  76           H        VAL  76 -31.754   5.171  -1.227
    2    HA   VAL  76           HA       VAL  76 -29.219   4.133  -2.352
    3    HB   VAL  76           HB       VAL  76 -29.588   5.583   0.305
    4   HG11  VAL  76          HG11      VAL  76 -27.158   4.458  -1.103
    5   HG13  VAL  76          HG12      VAL  76 -27.809   3.964   0.461
    6   HG12  VAL  76          HG13      VAL  76 -27.074   5.556   0.275
    7   HG22  VAL  76          HG21      VAL  76 -29.060   7.523  -0.591
    8   HG21  VAL  76          HG22      VAL  76 -29.565   6.787  -2.113
    9   HG23  VAL  76          HG23      VAL  76 -27.857   6.819  -1.671

  No H/Q in entry =           9
  In of MODEL   81
    1    H    GLU  77           H        GLU  77 -28.848   2.001  -1.736
    2    HA   GLU  77           HA       GLU  77 -29.558   1.167   0.924
    3    HB2  GLU  77           HB2      GLU  77 -31.051  -0.589   0.409
    4    HB3  GLU  77           HB3      GLU  77 -31.710   0.890  -0.291
    5    HG2  GLU  77           HG2      GLU  77 -31.067   0.171  -2.482
    6    HG3  GLU  77           HG3      GLU  77 -30.317  -1.276  -1.811

  No H/Q in entry =           6
  In of MODEL   81
    1    H    VAL  78           H        VAL  78 -29.081  -0.890   1.585
    2    HA   VAL  78           HA       VAL  78 -26.375  -1.476   0.679
    3    HB   VAL  78           HB       VAL  78 -27.999  -2.472   3.058
    4   HG11  VAL  78          HG11      VAL  78 -25.588  -3.537   1.918
    5   HG13  VAL  78          HG12      VAL  78 -26.450  -4.066   3.364
    6   HG12  VAL  78          HG13      VAL  78 -25.214  -2.815   3.482
    7   HG22  VAL  78          HG21      VAL  78 -26.628  -1.007   4.383
    8   HG21  VAL  78          HG22      VAL  78 -27.440  -0.094   3.111
    9   HG23  VAL  78          HG23      VAL  78 -25.731  -0.504   2.950

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ILE  79           H        ILE  79 -25.713  -3.345  -0.227
    2    HA   ILE  79           HA       ILE  79 -27.676  -4.966  -1.556
    3    HB   ILE  79           HB       ILE  79 -24.654  -5.282  -1.357
    4   HG12  ILE  79          HG12      ILE  79 -26.381  -4.301  -3.634
    5   HG13  ILE  79          HG13      ILE  79 -25.570  -3.229  -2.491
    6   HG22  ILE  79          HG21      ILE  79 -25.689  -6.543  -3.666
    7   HG21  ILE  79          HG22      ILE  79 -26.624  -7.127  -2.289
    8   HG23  ILE  79          HG23      ILE  79 -24.867  -7.284  -2.292
    9   HD13  ILE  79          HD11      ILE  79 -24.166  -3.249  -4.320
   10   HD12  ILE  79          HD12      ILE  79 -24.388  -4.977  -4.595
   11   HD11  ILE  79          HD13      ILE  79 -23.430  -4.418  -3.222

  No H/Q in entry =          11
  In of MODEL   81
    1    H    ASP  80           H        ASP  80 -28.400  -6.943  -0.962
    2    HA   ASP  80           HA       ASP  80 -28.263  -7.830   1.686
    3    HB2  ASP  80           HB2      ASP  80 -29.985  -8.532   0.061
    4    HB3  ASP  80           HB3      ASP  80 -28.766  -9.458  -0.814

  No H/Q in entry =           4
  In of MODEL   81
    1    H    SER  81           H        SER  81 -26.643  -8.853   2.806
    2    HA   SER  81           HA       SER  81 -24.115  -9.362   1.597
    3    HB2  SER  81           HB2      SER  81 -23.477 -10.344   3.764
    4    HB3  SER  81           HB3      SER  81 -24.285  -8.793   3.979
    5    HG   SER  81           HG       SER  81 -25.778  -9.744   5.045

  No H/Q in entry =           5
  In of MODEL   81
    1    H    LEU  82           H        LEU  82 -26.671 -11.637   1.945
    2    HA   LEU  82           HA       LEU  82 -24.965 -13.893   1.418
    3    HB2  LEU  82           HB2      LEU  82 -27.939 -13.488   1.176
    4    HB3  LEU  82           HB3      LEU  82 -27.123 -15.037   0.978
    5    HG   LEU  82           HG       LEU  82 -27.180 -13.430   3.515
    6   HD13  LEU  82          HD11      LEU  82 -29.394 -14.291   3.001
    7   HD12  LEU  82          HD12      LEU  82 -28.677 -15.275   4.279
    8   HD11  LEU  82          HD13      LEU  82 -28.722 -15.878   2.622
    9   HD22  LEU  82          HD21      LEU  82 -25.220 -14.708   3.518
   10   HD21  LEU  82          HD22      LEU  82 -25.973 -16.033   2.631
   11   HD23  LEU  82          HD23      LEU  82 -26.384 -15.761   4.324

  No H/Q in entry =          11
  In of MODEL   81
    1    H    LEU  83           H        LEU  83 -27.088 -11.815  -0.491
    2    HA   LEU  83           HA       LEU  83 -26.812 -13.163  -2.961
    3    HB2  LEU  83           HB2      LEU  83 -27.418 -10.290  -2.317
    4    HB3  LEU  83           HB3      LEU  83 -27.418 -10.940  -3.956
    5    HG   LEU  83           HG       LEU  83 -29.403 -11.461  -1.762
    6   HD13  LEU  83          HD11      LEU  83 -30.294  -9.674  -2.825
    7   HD12  LEU  83          HD12      LEU  83 -30.688 -10.821  -4.104
    8   HD11  LEU  83          HD13      LEU  83 -29.218  -9.850  -4.210
    9   HD23  LEU  83          HD21      LEU  83 -29.475 -12.734  -4.483
   10   HD22  LEU  83          HD22      LEU  83 -30.406 -13.146  -3.045
   11   HD21  LEU  83          HD23      LEU  83 -28.688 -13.530  -3.121

  No H/Q in entry =          11
  In of MODEL   81
    1    H    TYR  84           H        TYR  84 -25.017 -10.643  -1.306
    2    HA   TYR  84           HA       TYR  84 -23.209 -10.033  -3.452
    3    HB2  TYR  84           HB2      TYR  84 -23.789  -8.544  -1.482
    4    HB3  TYR  84           HB3      TYR  84 -22.780  -9.598  -0.494
    5    HD1  TYR  84           HD1      TYR  84 -20.327  -9.952  -1.369
    6    HD2  TYR  84           HD2      TYR  84 -22.823  -6.670  -2.481
    7    HE1  TYR  84           HE1      TYR  84 -18.323  -8.670  -2.040
    8    HE2  TYR  84           HE2      TYR  84 -20.830  -5.382  -3.165
    9    HH   TYR  84           HH       TYR  84 -17.559  -6.802  -2.856

  No H/Q in entry =           9
  In of MODEL   81
    1    H    GLY  85           H        GLY  85 -22.808 -12.004  -0.502
    2    HA3  GLY  85           HA2      GLY  85 -20.175 -12.768  -1.002
    3    HA2  GLY  85           HA3      GLY  85 -21.337 -13.695  -0.053

  No H/Q in entry =           3
  In of MODEL   81
    1    H    LYS  86           H        LYS  86 -23.168 -14.202  -2.098
    2    HA   LYS  86           HA       LYS  86 -21.961 -16.501  -3.360
    3    HB2  LYS  86           HB2      LYS  86 -24.706 -15.255  -3.527
    4    HB3  LYS  86           HB3      LYS  86 -24.268 -16.841  -4.160
    5    HG2  LYS  86           HG2      LYS  86 -24.096 -16.148  -1.260
    6    HG3  LYS  86           HG3      LYS  86 -25.543 -16.817  -2.015
    7    HD2  LYS  86           HD2      LYS  86 -24.206 -18.707  -2.865
    8    HD3  LYS  86           HD3      LYS  86 -22.780 -18.045  -2.067
    9    HE2  LYS  86           HE2      LYS  86 -23.847 -18.305   0.101
   10    HE3  LYS  86           HE3      LYS  86 -25.314 -18.903  -0.674
   11    HZ1  LYS  86           HZ1      LYS  86 -22.682 -20.196  -1.090
   12    HZ3  LYS  86           HZ2      LYS  86 -24.228 -20.829  -1.403
   13    HZ2  LYS  86           HZ3      LYS  86 -23.702 -20.629   0.199

  No H/Q in entry =          13
  In of MODEL   81
    1    H    VAL  87           H        VAL  87 -22.180 -13.296  -4.262
    2    HA   VAL  87           HA       VAL  87 -21.979 -12.111  -6.209
    3    HB   VAL  87           HB       VAL  87 -20.771 -14.506  -7.600
    4   HG11  VAL  87          HG11      VAL  87 -21.046 -12.053  -8.493
    5   HG13  VAL  87          HG12      VAL  87 -19.521 -12.901  -8.757
    6   HG12  VAL  87          HG13      VAL  87 -19.659 -11.716  -7.458
    7   HG22  VAL  87          HG21      VAL  87 -18.630 -14.124  -6.503
    8   HG21  VAL  87          HG22      VAL  87 -19.857 -14.620  -5.341
    9   HG23  VAL  87          HG23      VAL  87 -19.376 -12.928  -5.444

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ASP  88           H        ASP  88 -24.441 -12.926  -5.835
    2    HA   ASP  88           HA       ASP  88 -25.494 -14.226  -8.220
    3    HB2  ASP  88           HB2      ASP  88 -26.452 -14.532  -5.887
    4    HB3  ASP  88           HB3      ASP  88 -27.023 -12.867  -5.988

  No H/Q in entry =           4
  In of MODEL   81
    1    H    GLY  89           H        GLY  89 -24.892 -12.928  -9.871
    2    HA3  GLY  89           HA2      GLY  89 -25.270 -10.175 -10.077
    3    HA2  GLY  89           HA3      GLY  89 -25.177 -11.296 -11.435

  No H/Q in entry =           3
  In of MODEL   81
    1    H    LEU  90           H        LEU  90 -27.520 -12.815 -10.963
    2    HA   LEU  90           HA       LEU  90 -29.471 -11.015 -12.067
    3    HB2  LEU  90           HB2      LEU  90 -29.373 -13.412 -12.640
    4    HB3  LEU  90           HB3      LEU  90 -29.837 -13.808 -10.985
    5    HG   LEU  90           HG       LEU  90 -32.032 -12.843 -11.334
    6   HD13  LEU  90          HD11      LEU  90 -31.988 -11.099 -12.815
    7   HD12  LEU  90          HD12      LEU  90 -32.448 -12.375 -13.944
    8   HD11  LEU  90          HD13      LEU  90 -30.766 -11.861 -13.836
    9   HD23  LEU  90          HD21      LEU  90 -31.869 -14.473 -13.765
   10   HD22  LEU  90          HD22      LEU  90 -32.822 -14.701 -12.298
   11   HD21  LEU  90          HD23      LEU  90 -31.129 -15.196 -12.336

  No H/Q in entry =          11
  In of MODEL   81
    1    H    GLY  91           H        GLY  91 -29.171 -12.490  -8.880
    2    HA3  GLY  91           HA2      GLY  91 -31.574 -11.541  -7.824
    3    HA2  GLY  91           HA3      GLY  91 -30.141 -11.971  -6.891

  No H/Q in entry =           3
  In of MODEL   81
    1    H    VAL  92           H        VAL  92 -28.363 -10.017  -7.770
    2    HA   VAL  92           HA       VAL  92 -29.301  -7.771  -6.221
    3    HB   VAL  92           HB       VAL  92 -26.742  -8.066  -7.837
    4   HG12  VAL  92          HG11      VAL  92 -27.020  -6.189  -5.515
    5   HG11  VAL  92          HG12      VAL  92 -27.734  -5.699  -7.052
    6   HG13  VAL  92          HG13      VAL  92 -26.009  -6.046  -6.954
    7   HG22  VAL  92          HG21      VAL  92 -26.394  -9.628  -6.241
    8   HG21  VAL  92          HG22      VAL  92 -27.582  -8.926  -5.141
    9   HG23  VAL  92          HG23      VAL  92 -25.976  -8.211  -5.278

  No H/Q in entry =           9
  In of MODEL   81
    1    H    LEU  93           H        LEU  93 -28.878  -8.415  -9.642
    2    HA   LEU  93           HA       LEU  93 -29.416  -5.815 -10.577
    3    HB2  LEU  93           HB2      LEU  93 -28.657  -7.625 -12.038
    4    HB3  LEU  93           HB3      LEU  93 -30.191  -8.462 -11.800
    5    HG   LEU  93           HG       LEU  93 -31.348  -6.579 -12.921
    6   HD11  LEU  93          HD11      LEU  93 -29.611  -4.855 -12.439
    7   HD13  LEU  93          HD12      LEU  93 -30.061  -4.923 -14.143
    8   HD12  LEU  93          HD13      LEU  93 -28.550  -5.650 -13.602
    9   HD23  LEU  93          HD21      LEU  93 -30.292  -7.080 -15.216
   10   HD22  LEU  93          HD22      LEU  93 -31.035  -8.390 -14.298
   11   HD21  LEU  93          HD23      LEU  93 -29.279  -8.209 -14.317

  No H/Q in entry =          11
  In of MODEL   81
    1    H    LYS  94           H        LYS  94 -31.598  -8.519  -9.699
    2    HA   LYS  94           HA       LYS  94 -34.044  -7.249 -10.308
    3    HB2  LYS  94           HB2      LYS  94 -33.359  -9.384  -8.294
    4    HB3  LYS  94           HB3      LYS  94 -35.004  -8.805  -8.550
    5    HG2  LYS  94           HG2      LYS  94 -34.883  -9.581 -10.883
    6    HG3  LYS  94           HG3      LYS  94 -33.270 -10.219 -10.566
    7    HD2  LYS  94           HD2      LYS  94 -34.278 -11.622  -8.727
    8    HD3  LYS  94           HD3      LYS  94 -35.867 -11.087  -9.271
    9    HE2  LYS  94           HE2      LYS  94 -35.307 -11.986 -11.539
   10    HE3  LYS  94           HE3      LYS  94 -33.835 -12.664 -10.846
   11    HZ3  LYS  94           HZ1      LYS  94 -35.573 -14.313 -10.995
   12    HZ2  LYS  94           HZ2      LYS  94 -36.609 -13.355 -10.048
   13    HZ1  LYS  94           HZ3      LYS  94 -35.194 -14.002  -9.369

  No H/Q in entry =          13
  In of MODEL   81
    1    H    ALA  95           H        ALA  95 -32.189  -7.229  -7.275
    2    HA   ALA  95           HA       ALA  95 -34.134  -5.778  -5.784
    3    HB2  ALA  95           HB1      ALA  95 -31.662  -6.980  -5.264
    4    HB3  ALA  95           HB2      ALA  95 -32.693  -6.143  -4.104
    5    HB1  ALA  95           HB3      ALA  95 -31.411  -5.265  -4.940

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ALA  96           H        ALA  96 -31.577  -4.748  -7.907
    2    HA   ALA  96           HA       ALA  96 -31.668  -1.984  -7.142
    3    HB2  ALA  96           HB1      ALA  96 -30.344  -1.670  -9.264
    4    HB3  ALA  96           HB2      ALA  96 -30.530  -3.396  -9.576
    5    HB1  ALA  96           HB3      ALA  96 -29.639  -2.847  -8.156

  No H/Q in entry =           5
  In of MODEL   81
    1    H    VAL  97           H        VAL  97 -33.100  -3.811  -9.810
    2    HA   VAL  97           HA       VAL  97 -34.338  -1.596 -11.063
    3    HB   VAL  97           HB       VAL  97 -34.942  -4.572 -11.090
    4   HG11  VAL  97          HG11      VAL  97 -36.874  -2.697 -11.566
    5   HG13  VAL  97          HG12      VAL  97 -36.829  -4.292 -12.316
    6   HG12  VAL  97          HG13      VAL  97 -36.178  -2.896 -13.174
    7   HG21  VAL  97          HG21      VAL  97 -33.811  -2.665 -13.141
    8   HG23  VAL  97          HG22      VAL  97 -34.148  -4.374 -13.422
    9   HG22  VAL  97          HG23      VAL  97 -32.919  -3.897 -12.249

  No H/Q in entry =           9
  In of MODEL   81
    1    H    ALA  98           H        ALA  98 -35.344  -3.844  -8.510
    2    HA   ALA  98           HA       ALA  98 -37.976  -2.873  -8.139
    3    HB1  ALA  98           HB1      ALA  98 -36.803  -4.994  -7.110
    4    HB2  ALA  98           HB2      ALA  98 -38.037  -4.151  -6.170
    5    HB3  ALA  98           HB3      ALA  98 -36.327  -3.882  -5.826

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ALA  99           H        ALA  99 -34.945  -1.859  -6.521
    2    HA   ALA  99           HA       ALA  99 -36.194   0.047  -4.856
    3    HB1  ALA  99           HB1      ALA  99 -33.497  -0.661  -5.623
    4    HB2  ALA  99           HB2      ALA  99 -34.084   0.054  -4.122
    5    HB3  ALA  99           HB3      ALA  99 -33.691   1.087  -5.495

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ILE 100           H        ILE 100 -35.194   0.239  -8.220
    2    HA   ILE 100           HA       ILE 100 -35.568   3.068  -8.444
    3    HB   ILE 100           HB       ILE 100 -35.536   0.905 -10.577
    4   HG12  ILE 100          HG12      ILE 100 -33.506   3.042  -9.930
    5   HG13  ILE 100          HG13      ILE 100 -33.425   1.399  -9.295
    6   HG21  ILE 100          HG21      ILE 100 -36.157   3.790 -10.711
    7   HG23  ILE 100          HG22      ILE 100 -36.586   2.486 -11.819
    8   HG22  ILE 100          HG23      ILE 100 -34.980   3.213 -11.890
    9   HD12  ILE 100          HD11      ILE 100 -32.984   2.382 -12.076
   10   HD11  ILE 100          HD12      ILE 100 -33.531   0.726 -11.812
   11   HD13  ILE 100          HD13      ILE 100 -32.012   1.276 -11.108

  No H/Q in entry =          11
  In of MODEL   81
    1    H    LYS 101           H        LYS 101 -37.686   0.307  -9.144
    2    HA   LYS 101           HA       LYS 101 -39.883   1.808 -10.128
    3    HB2  LYS 101           HB2      LYS 101 -39.569  -0.949  -8.996
    4    HB3  LYS 101           HB3      LYS 101 -41.172  -0.295  -9.329
    5    HG2  LYS 101           HG2      LYS 101 -40.728  -0.135 -11.631
    6    HG3  LYS 101           HG3      LYS 101 -39.006  -0.423 -11.391
    7    HD2  LYS 101           HD2      LYS 101 -40.132  -2.414 -12.261
    8    HD3  LYS 101           HD3      LYS 101 -39.470  -2.697 -10.651
    9    HE2  LYS 101           HE2      LYS 101 -41.476  -3.529 -10.125
   10    HE3  LYS 101           HE3      LYS 101 -42.047  -1.860 -10.128
   11    HZ3  LYS 101           HZ1      LYS 101 -42.945  -2.082 -12.237
   12    HZ2  LYS 101           HZ2      LYS 101 -43.299  -3.581 -11.523
   13    HZ1  LYS 101           HZ3      LYS 101 -42.008  -3.447 -12.618

  No H/Q in entry =          13
  In of MODEL   81
    1    H    LYS 102           H        LYS 102 -39.264   0.375  -6.921
    2    HA   LYS 102           HA       LYS 102 -41.577   1.419  -5.706
    3    HB2  LYS 102           HB2      LYS 102 -40.208  -0.357  -4.699
    4    HB3  LYS 102           HB3      LYS 102 -38.890   0.790  -4.469
    5    HG2  LYS 102           HG2      LYS 102 -40.285   2.096  -2.964
    6    HG3  LYS 102           HG3      LYS 102 -41.606   0.953  -3.195
    7    HD2  LYS 102           HD2      LYS 102 -40.248  -0.824  -2.176
    8    HD3  LYS 102           HD3      LYS 102 -38.927   0.321  -1.943
    9    HE2  LYS 102           HE2      LYS 102 -40.366   1.708  -0.524
   10    HE3  LYS 102           HE3      LYS 102 -41.707   0.592  -0.779
   11    HZ1  LYS 102           HZ1      LYS 102 -39.863  -1.040   0.212
   12    HZ3  LYS 102           HZ2      LYS 102 -41.023  -0.230   1.151
   13    HZ2  LYS 102           HZ3      LYS 102 -39.452   0.403   1.009

  No H/Q in entry =          13
  In of MODEL   81
    1    H    ALA 103           H        ALA 103 -38.733   3.005  -6.746
    2    HA   ALA 103           HA       ALA 103 -39.097   5.303  -4.966
    3    HB2  ALA 103           HB1      ALA 103 -37.173   6.166  -6.561
    4    HB3  ALA 103           HB2      ALA 103 -37.024   4.454  -6.957
    5    HB1  ALA 103           HB3      ALA 103 -36.819   4.996  -5.291

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ALA 104           H        ALA 104 -39.694   4.524  -8.306
    2    HA   ALA 104           HA       ALA 104 -40.473   7.262  -8.927
    3    HB2  ALA 104           HB1      ALA 104 -40.489   6.588 -11.129
    4    HB1  ALA 104           HB2      ALA 104 -41.106   4.980 -10.742
    5    HB3  ALA 104           HB3      ALA 104 -39.403   5.361 -10.477

  No H/Q in entry =           5
  In of MODEL   81
    1    H    ALA 105           H        ALA 105 -41.919   5.056  -7.106
    2    HA   ALA 105           HA       ALA 105 -44.433   6.283  -7.061
    3    HB2  ALA 105           HB1      ALA 105 -45.134   5.370  -9.092
    4    HB3  ALA 105           HB2      ALA 105 -45.680   4.143  -7.948
    5    HB1  ALA 105           HB3      ALA 105 -44.197   3.893  -8.869

  No H/Q in entry =           5
  In of MODEL   82
    1    H1   ALA   1           H3       ALA   1 -12.043 -16.140  -2.393
    2    H2   ALA   1           H2       ALA   1 -11.083 -17.269  -3.230
    3    H3   ALA   1           H1       ALA   1 -12.241 -16.345  -4.067
    4    HA   ALA   1           HA       ALA   1 -13.613 -18.067  -3.822
    5    HB3  ALA   1           HB1      ALA   1 -12.190 -19.815  -3.354
    6    HB1  ALA   1           HB2      ALA   1 -12.948 -19.709  -1.766
    7    HB2  ALA   1           HB3      ALA   1 -11.384 -18.945  -2.048

  No H/Q in entry =           7
  In of MODEL   82
    1    H    GLU   2           H        GLU   2 -15.224 -18.942  -2.166
    2    HA   GLU   2           HA       GLU   2 -16.899 -17.244  -1.114
    3    HB2  GLU   2           HB2      GLU   2 -15.922 -19.650   0.439
    4    HB3  GLU   2           HB3      GLU   2 -17.460 -18.823   0.690
    5    HG2  GLU   2           HG2      GLU   2 -18.421 -19.930  -1.042
    6    HG3  GLU   2           HG3      GLU   2 -17.104 -19.512  -2.127

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLU   3           H        GLU   3 -14.967 -18.559   1.515
    2    HA   GLU   3           HA       GLU   3 -15.226 -16.205   3.065
    3    HB2  GLU   3           HB2      GLU   3 -13.601 -18.725   3.324
    4    HB3  GLU   3           HB3      GLU   3 -13.391 -17.399   4.467
    5    HG2  GLU   3           HG2      GLU   3 -15.582 -17.582   5.284
    6    HG3  GLU   3           HG3      GLU   3 -16.164 -18.396   3.838

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LEU   4           H        LEU   4 -12.248 -17.641   1.680
    2    HA   LEU   4           HA       LEU   4 -10.444 -15.708   2.273
    3    HB2  LEU   4           HB2      LEU   4 -10.652 -17.017  -0.448
    4    HB3  LEU   4           HB3      LEU   4  -9.212 -16.272   0.236
    5    HG   LEU   4           HG       LEU   4 -10.669 -18.689   1.355
    6   HD13  LEU   4          HD11      LEU   4  -9.016 -20.022   0.431
    7   HD12  LEU   4          HD12      LEU   4  -7.826 -18.720   0.401
    8   HD11  LEU   4          HD13      LEU   4  -9.113 -18.766  -0.803
    9   HD23  LEU   4          HD21      LEU   4  -8.418 -18.713   2.738
   10   HD22  LEU   4          HD22      LEU   4  -9.756 -17.693   3.263
   11   HD21  LEU   4          HD23      LEU   4  -8.404 -16.986   2.380

  No H/Q in entry =          11
  In of MODEL   82
    1    H    GLU   5           H        GLU   5 -12.780 -15.545  -0.403
    2    HA   GLU   5           HA       GLU   5 -11.814 -13.050  -1.411
    3    HB2  GLU   5           HB2      GLU   5 -13.135 -14.661  -2.769
    4    HB3  GLU   5           HB3      GLU   5 -14.541 -14.316  -1.761
    5    HG2  GLU   5           HG2      GLU   5 -14.456 -11.952  -2.413
    6    HG3  GLU   5           HG3      GLU   5 -13.018 -12.260  -3.386

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLU   6           H        GLU   6 -14.527 -13.964   0.682
    2    HA   GLU   6           HA       GLU   6 -15.473 -11.300   1.073
    3    HB2  GLU   6           HB2      GLU   6 -16.859 -13.327   1.477
    4    HB3  GLU   6           HB3      GLU   6 -15.830 -13.726   2.852
    5    HG2  GLU   6           HG2      GLU   6 -16.415 -11.589   3.923
    6    HG3  GLU   6           HG3      GLU   6 -17.431 -11.170   2.546

  No H/Q in entry =           6
  In of MODEL   82
    1    H    VAL   7           H        VAL   7 -13.135 -13.370   2.653
    2    HA   VAL   7           HA       VAL   7 -12.694 -11.781   4.975
    3    HB   VAL   7           HB       VAL   7 -10.958 -13.802   3.533
    4   HG11  VAL   7          HG11      VAL   7 -10.516 -12.255   6.093
    5   HG13  VAL   7          HG12      VAL   7  -9.411 -12.456   4.734
    6   HG12  VAL   7          HG13      VAL   7  -9.744 -13.815   5.807
    7   HG21  VAL   7          HG21      VAL   7 -13.201 -14.397   4.753
    8   HG23  VAL   7          HG22      VAL   7 -12.279 -14.105   6.229
    9   HG22  VAL   7          HG23      VAL   7 -11.766 -15.360   5.103

  No H/Q in entry =           9
  In of MODEL   82
    1    H    VAL   8           H        VAL   8 -11.179 -11.882   1.767
    2    HA   VAL   8           HA       VAL   8  -9.145  -9.976   2.255
    3    HB   VAL   8           HB       VAL   8 -10.588 -10.765  -0.282
    4   HG11  VAL   8          HG11      VAL   8  -8.430  -8.730   0.229
    5   HG13  VAL   8          HG12      VAL   8  -9.837  -8.614  -0.830
    6   HG12  VAL   8          HG13      VAL   8  -8.462  -9.615  -1.297
    7   HG23  VAL   8          HG21      VAL   8  -7.682 -11.284   0.365
    8   HG22  VAL   8          HG22      VAL   8  -8.772 -12.208  -0.663
    9   HG21  VAL   8          HG23      VAL   8  -8.916 -12.318   1.087

  No H/Q in entry =           9
  In of MODEL   82
    1    H    MET   9           H        MET   9 -12.495  -9.641   1.091
    2    HA   MET   9           HA       MET   9 -12.474  -6.866   0.648
    3    HB2  MET   9           HB2      MET   9 -14.624  -8.829   1.392
    4    HB3  MET   9           HB3      MET   9 -14.981  -7.100   1.356
    5    HG2  MET   9           HG2      MET   9 -13.927  -7.102  -0.989
    6    HG3  MET   9           HG3      MET   9 -14.048  -8.861  -0.913
    7    HE1  MET   9           HE1      MET   9 -15.944 -10.211  -0.824
    8    HE3  MET   9           HE2      MET   9 -17.644  -9.755  -0.911
    9    HE2  MET   9           HE3      MET   9 -16.757  -9.536   0.595

  No H/Q in entry =           9
  In of MODEL   82
    1    H    GLY  10           H        GLY  10 -13.110  -8.758   3.581
    2    HA3  GLY  10           HA2      GLY  10 -13.694  -6.576   5.292
    3    HA2  GLY  10           HA3      GLY  10 -13.106  -8.155   5.812

  No H/Q in entry =           3
  In of MODEL   82
    1    H    LEU  11           H        LEU  11 -10.657  -8.245   4.499
    2    HA   LEU  11           HA       LEU  11  -8.981  -6.779   6.253
    3    HB2  LEU  11           HB2      LEU  11  -8.410  -8.202   3.651
    4    HB3  LEU  11           HB3      LEU  11  -7.152  -7.474   4.648
    5    HG   LEU  11           HG       LEU  11  -9.122  -9.536   5.669
    6   HD13  LEU  11          HD11      LEU  11  -7.880 -10.758   4.110
    7   HD12  LEU  11          HD12      LEU  11  -6.942 -10.977   5.586
    8   HD11  LEU  11          HD13      LEU  11  -6.419  -9.807   4.375
    9   HD22  LEU  11          HD21      LEU  11  -8.287  -8.503   7.583
   10   HD21  LEU  11          HD22      LEU  11  -6.755  -8.079   6.820
   11   HD23  LEU  11          HD23      LEU  11  -7.055  -9.739   7.335

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  12           H        ILE  12  -9.888  -6.257   2.861
    2    HA   ILE  12           HA       ILE  12  -8.232  -4.001   2.428
    3    HB   ILE  12           HB       ILE  12 -10.859  -4.770   1.134
    4   HG12  ILE  12          HG12      ILE  12  -8.781  -6.320   1.008
    5   HG13  ILE  12          HG13      ILE  12  -9.587  -5.913  -0.494
    6   HG21  ILE  12          HG21      ILE  12  -8.764  -2.727   0.328
    7   HG23  ILE  12          HG22      ILE  12 -10.451  -2.409   0.711
    8   HG22  ILE  12          HG23      ILE  12 -10.025  -3.307  -0.716
    9   HD13  ILE  12          HD11      ILE  12  -7.890  -4.229  -0.966
   10   HD12  ILE  12          HD12      ILE  12  -7.102  -5.770  -0.627
   11   HD11  ILE  12          HD13      ILE  12  -7.135  -4.515   0.591

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  13           H        ILE  13 -11.590  -4.320   3.520
    2    HA   ILE  13           HA       ILE  13 -12.096  -1.540   3.780
    3    HB   ILE  13           HB       ILE  13 -13.261  -3.975   5.149
    4   HG12  ILE  13          HG12      ILE  13 -13.485  -3.402   2.600
    5   HG13  ILE  13          HG13      ILE  13 -14.879  -3.957   3.500
    6   HG22  ILE  13          HG21      ILE  13 -15.184  -2.376   5.714
    7   HG21  ILE  13          HG22      ILE  13 -14.063  -1.060   5.389
    8   HG23  ILE  13          HG23      ILE  13 -13.724  -2.204   6.684
    9   HD13  ILE  13          HD11      ILE  13 -15.724  -1.708   3.742
   10   HD12  ILE  13          HD12      ILE  13 -15.313  -1.958   2.057
   11   HD11  ILE  13          HD13      ILE  13 -14.229  -1.040   3.078

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ASN  14           H        ASN  14 -10.945  -4.004   6.064
    2    HA   ASN  14           HA       ASN  14 -10.774  -2.356   8.344
    3    HB2  ASN  14           HB2      ASN  14 -10.477  -4.959   8.031
    4    HB3  ASN  14           HB3      ASN  14  -8.775  -4.544   7.874
    5   HD21  ASN  14          HD21      ASN  14  -9.388  -6.072  10.054
    6   HD22  ASN  14          HD22      ASN  14  -9.377  -5.147  11.476

  No H/Q in entry =           6
  In of MODEL   82
    1    H    SER  15           H        SER  15  -8.356  -3.146   5.857
    2    HA   SER  15           HA       SER  15  -6.240  -1.613   6.927
    3    HB2  SER  15           HB2      SER  15  -5.213  -1.820   4.772
    4    HB3  SER  15           HB3      SER  15  -6.146  -3.295   4.998
    5    HG   SER  15           HG       SER  15  -6.533  -1.179   3.261

  No H/Q in entry =           5
  In of MODEL   82
    1    H    GLY  16           H        GLY  16  -8.853  -0.799   4.674
    2    HA3  GLY  16           HA2      GLY  16  -8.041   1.854   4.115
    3    HA2  GLY  16           HA3      GLY  16  -9.681   1.230   3.953

  No H/Q in entry =           3
  In of MODEL   82
    1    H    GLN  17           H        GLN  17 -10.214   0.504   6.605
    2    HA   GLN  17           HA       GLN  17 -10.967   3.000   7.736
    3    HB2  GLN  17           HB2      GLN  17 -10.825   0.219   8.916
    4    HB3  GLN  17           HB3      GLN  17 -11.461   1.609   9.796
    5    HG2  GLN  17           HG2      GLN  17 -13.155   1.967   8.069
    6    HG3  GLN  17           HG3      GLN  17 -12.489   0.645   7.111
    7   HE21  GLN  17          HE21      GLN  17 -14.923   1.356   9.311
    8   HE22  GLN  17          HE22      GLN  17 -15.202  -0.211   9.907

  No H/Q in entry =           8
  In of MODEL   82
    1    H    ALA  18           H        ALA  18  -8.298   0.768   8.366
    2    HA   ALA  18           HA       ALA  18  -7.225   2.011  10.634
    3    HB2  ALA  18           HB1      ALA  18  -6.574  -0.198   9.274
    4    HB3  ALA  18           HB2      ALA  18  -5.426   0.610  10.344
    5    HB1  ALA  18           HB3      ALA  18  -5.352   0.884   8.602

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ARG  19           H        ARG  19  -6.460   2.537   7.184
    2    HA   ARG  19           HA       ARG  19  -4.600   4.621   7.608
    3    HB2  ARG  19           HB2      ARG  19  -4.904   3.467   5.416
    4    HB3  ARG  19           HB3      ARG  19  -6.461   4.278   5.235
    5    HG2  ARG  19           HG2      ARG  19  -5.373   6.471   5.297
    6    HG3  ARG  19           HG3      ARG  19  -3.810   5.715   5.605
    7    HD2  ARG  19           HD2      ARG  19  -3.943   6.295   3.260
    8    HD3  ARG  19           HD3      ARG  19  -3.996   4.534   3.411
    9    HE   ARG  19           HE       ARG  19  -6.646   5.394   3.398
   10   HH21  ARG  19          HH11      ARG  19  -7.841   5.521   1.478
   11   HH22  ARG  19          HH12      ARG  19  -7.020   5.609  -0.041
   12   HH11  ARG  19          HH21      ARG  19  -3.870   5.502   1.367
   13   HH12  ARG  19          HH22      ARG  19  -4.769   5.596  -0.104

  No H/Q in entry =          13
  In of MODEL   82
    1    H    SER  20           H        SER  20  -8.099   4.668   7.003
    2    HA   SER  20           HA       SER  20  -8.508   7.416   6.945
    3    HB2  SER  20           HB2      SER  20 -10.358   6.038   6.411
    4    HB3  SER  20           HB3      SER  20 -10.236   5.152   7.929
    5    HG   SER  20           HG       SER  20 -10.749   7.936   7.777

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LEU  21           H        LEU  21  -8.470   5.244   9.757
    2    HA   LEU  21           HA       LEU  21  -8.951   7.238  11.714
    3    HB2  LEU  21           HB2      LEU  21  -7.550   4.563  11.884
    4    HB3  LEU  21           HB3      LEU  21  -7.876   5.579  13.285
    5    HG   LEU  21           HG       LEU  21 -10.030   4.636  11.369
    6   HD12  LEU  21          HD11      LEU  21 -10.589   3.108  13.379
    7   HD11  LEU  21          HD12      LEU  21  -8.933   3.416  13.902
    8   HD13  LEU  21          HD13      LEU  21  -9.236   2.637  12.348
    9   HD22  LEU  21          HD21      LEU  21 -10.993   6.421  12.514
   10   HD21  LEU  21          HD22      LEU  21  -9.994   6.197  13.947
   11   HD23  LEU  21          HD23      LEU  21 -11.350   5.121  13.648

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ALA  22           H        ALA  22  -5.971   5.917  10.315
    2    HA   ALA  22           HA       ALA  22  -4.120   7.272  11.935
    3    HB2  ALA  22           HB1      ALA  22  -3.665   5.421  10.251
    4    HB1  ALA  22           HB2      ALA  22  -2.495   6.740  10.283
    5    HB3  ALA  22           HB3      ALA  22  -3.710   6.668   9.006

  No H/Q in entry =           5
  In of MODEL   82
    1    H    TYR  23           H        TYR  23  -5.452   8.252   8.747
    2    HA   TYR  23           HA       TYR  23  -4.165  10.774   8.670
    3    HB2  TYR  23           HB2      TYR  23  -5.224   9.835   6.679
    4    HB3  TYR  23           HB3      TYR  23  -6.805   9.911   7.458
    5    HD1  TYR  23           HD1      TYR  23  -3.947  12.009   6.296
    6    HD2  TYR  23           HD2      TYR  23  -8.084  11.898   7.442
    7    HE1  TYR  23           HE1      TYR  23  -4.222  14.352   5.529
    8    HE2  TYR  23           HE2      TYR  23  -8.360  14.241   6.674
    9    HH   TYR  23           HH       TYR  23  -5.789  15.926   4.965

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ALA  24           H        ALA  24  -7.266   9.740  10.048
    2    HA   ALA  24           HA       ALA  24  -8.155  12.316  10.809
    3    HB1  ALA  24           HB1      ALA  24  -9.949  11.031  11.278
    4    HB2  ALA  24           HB2      ALA  24  -9.114  10.481  12.729
    5    HB3  ALA  24           HB3      ALA  24  -8.969   9.566  11.229

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ALA  25           H        ALA  25  -6.107   9.903  12.395
    2    HA   ALA  25           HA       ALA  25  -5.798  11.171  14.893
    3    HB2  ALA  25           HB1      ALA  25  -4.984   8.831  14.081
    4    HB3  ALA  25           HB2      ALA  25  -3.987   9.713  15.241
    5    HB1  ALA  25           HB3      ALA  25  -3.548   9.699  13.532

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LEU  26           H        LEU  26  -4.009  11.494  11.854
    2    HA   LEU  26           HA       LEU  26  -2.087  13.355  12.766
    3    HB2  LEU  26           HB2      LEU  26  -1.760  12.202  10.667
    4    HB3  LEU  26           HB3      LEU  26  -3.246  12.879  10.008
    5    HG   LEU  26           HG       LEU  26  -2.276  15.149  10.137
    6   HD12  LEU  26          HD11      LEU  26   0.261  15.220  10.554
    7   HD11  LEU  26          HD12      LEU  26   0.068  13.638  11.304
    8   HD13  LEU  26          HD13      LEU  26  -0.769  15.039  11.974
    9   HD21  LEU  26          HD21      LEU  26  -0.491  13.124   8.752
   10   HD23  LEU  26          HD22      LEU  26  -0.567  14.843   8.375
   11   HD22  LEU  26          HD23      LEU  26  -1.970  13.817   8.088

  No H/Q in entry =          11
  In of MODEL   82
    1    H    LYS  27           H        LYS  27  -5.276  13.771  11.283
    2    HA   LYS  27           HA       LYS  27  -5.274  16.559  11.075
    3    HB2  LYS  27           HB2      LYS  27  -6.988  15.045  10.092
    4    HB3  LYS  27           HB3      LYS  27  -7.642  14.782  11.708
    5    HG2  LYS  27           HG2      LYS  27  -8.118  17.180  11.935
    6    HG3  LYS  27           HG3      LYS  27  -7.414  17.485  10.344
    7    HD2  LYS  27           HD2      LYS  27  -9.117  16.014   9.310
    8    HD3  LYS  27           HD3      LYS  27  -9.827  15.726  10.900
    9    HE2  LYS  27           HE2      LYS  27 -10.317  18.129  11.134
   10    HE3  LYS  27           HE3      LYS  27  -9.578  18.439   9.559
   11    HZ3  LYS  27           HZ1      LYS  27 -11.952  18.268   9.314
   12    HZ2  LYS  27           HZ2      LYS  27 -11.973  16.754  10.089
   13    HZ1  LYS  27           HZ3      LYS  27 -11.229  16.926   8.568

  No H/Q in entry =          13
  In of MODEL   82
    1    H    GLN  28           H        GLN  28  -6.127  14.466  13.808
    2    HA   GLN  28           HA       GLN  28  -7.063  16.459  15.576
    3    HB2  GLN  28           HB2      GLN  28  -5.613  13.856  16.129
    4    HB3  GLN  28           HB3      GLN  28  -6.373  14.851  17.372
    5    HG2  GLN  28           HG2      GLN  28  -7.812  13.696  14.967
    6    HG3  GLN  28           HG3      GLN  28  -7.858  13.011  16.591
    7   HE21  GLN  28          HE21      GLN  28  -9.784  14.741  14.631
    8   HE22  GLN  28          HE22      GLN  28 -10.542  15.763  15.753

  No H/Q in entry =           8
  In of MODEL   82
    1    H    ALA  29           H        ALA  29  -3.819  15.220  14.895
    2    HA   ALA  29           HA       ALA  29  -2.410  16.651  16.871
    3    HB1  ALA  29           HB1      ALA  29  -0.466  15.991  15.757
    4    HB3  ALA  29           HB2      ALA  29  -1.220  16.096  14.166
    5    HB2  ALA  29           HB3      ALA  29  -1.619  14.759  15.245

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LYS  30           H        LYS  30  -3.279  17.503  13.537
    2    HA   LYS  30           HA       LYS  30  -1.910  19.966  13.430
    3    HB2  LYS  30           HB2      LYS  30  -4.424  19.045  12.021
    4    HB3  LYS  30           HB3      LYS  30  -3.615  20.572  11.673
    5    HG2  LYS  30           HG2      LYS  30  -1.524  19.312  11.166
    6    HG3  LYS  30           HG3      LYS  30  -2.405  17.802  11.415
    7    HD2  LYS  30           HD2      LYS  30  -3.977  18.411   9.616
    8    HD3  LYS  30           HD3      LYS  30  -3.119  19.932   9.369
    9    HE2  LYS  30           HE2      LYS  30  -1.065  18.670   8.797
   10    HE3  LYS  30           HE3      LYS  30  -1.943  17.154   9.013
   11    HZ2  LYS  30           HZ1      LYS  30  -1.778  18.019   6.668
   12    HZ1  LYS  30           HZ2      LYS  30  -2.842  19.267   7.131
   13    HZ3  LYS  30           HZ3      LYS  30  -3.341  17.642   7.207

  No H/Q in entry =          13
  In of MODEL   82
    1    H    GLN  31           H        GLN  31  -4.998  19.070  14.841
    2    HA   GLN  31           HA       GLN  31  -5.805  21.816  15.283
    3    HB2  GLN  31           HB2      GLN  31  -6.948  19.356  16.613
    4    HB3  GLN  31           HB3      GLN  31  -7.731  20.915  16.361
    5    HG2  GLN  31           HG2      GLN  31  -7.006  20.140  13.775
    6    HG3  GLN  31           HG3      GLN  31  -7.509  18.630  14.526
    7   HE21  GLN  31          HE21      GLN  31  -8.940  20.175  12.418
    8   HE22  GLN  31          HE22      GLN  31 -10.461  20.546  13.073

  No H/Q in entry =           8
  In of MODEL   82
    1    H    GLY  32           H        GLY  32  -3.465  19.928  16.612
    2    HA3  GLY  32           HA2      GLY  32  -2.074  20.417  18.414
    3    HA2  GLY  32           HA3      GLY  32  -3.222  21.644  18.933

  No H/Q in entry =           3
  In of MODEL   82
    1    H    ASP  33           H        ASP  33  -4.598  18.582  18.279
    2    HA   ASP  33           HA       ASP  33  -5.005  18.127  21.160
    3    HB2  ASP  33           HB2      ASP  33  -6.393  17.087  18.684
    4    HB3  ASP  33           HB3      ASP  33  -6.731  16.477  20.302

  No H/Q in entry =           4
  In of MODEL   82
    1    H    PHE  34           H        PHE  34  -2.824  17.309  21.470
    2    HA   PHE  34           HA       PHE  34  -1.789  15.071  20.077
    3    HB2  PHE  34           HB2      PHE  34  -1.190  16.073  22.869
    4    HB3  PHE  34           HB3      PHE  34  -0.242  14.861  22.006
    5    HD1  PHE  34           HD1      PHE  34  -0.466  18.286  22.731
    6    HD2  PHE  34           HD2      PHE  34   0.407  15.586  19.505
    7    HE1  PHE  34           HE1      PHE  34   0.805  20.073  21.573
    8    HE2  PHE  34           HE2      PHE  34   1.673  17.376  18.352
    9    HZ   PHE  34           HZ       PHE  34   1.873  19.616  19.390

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ALA  35           H        ALA  35  -3.836  15.327  22.937
    2    HA   ALA  35           HA       ALA  35  -3.585  12.671  23.842
    3    HB3  ALA  35           HB1      ALA  35  -6.053  13.263  24.695
    4    HB1  ALA  35           HB2      ALA  35  -5.543  14.888  24.235
    5    HB2  ALA  35           HB3      ALA  35  -4.617  13.981  25.430

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ALA  36           H        ALA  36  -6.055  14.145  21.736
    2    HA   ALA  36           HA       ALA  36  -7.435  11.711  21.264
    3    HB1  ALA  36           HB1      ALA  36  -8.910  13.110  20.302
    4    HB3  ALA  36           HB2      ALA  36  -7.743  13.544  19.053
    5    HB2  ALA  36           HB3      ALA  36  -7.782  14.435  20.574

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ALA  37           H        ALA  37  -4.776  13.333  19.593
    2    HA   ALA  37           HA       ALA  37  -4.715  11.692  17.301
    3    HB3  ALA  37           HB1      ALA  37  -2.749  13.437  18.720
    4    HB2  ALA  37           HB2      ALA  37  -3.279  13.480  17.039
    5    HB1  ALA  37           HB3      ALA  37  -2.108  12.268  17.565

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LYS  38           H        LYS  38  -2.957  11.420  20.381
    2    HA   LYS  38           HA       LYS  38  -1.596   9.039  19.900
    3    HB2  LYS  38           HB2      LYS  38  -1.947  10.803  22.040
    4    HB3  LYS  38           HB3      LYS  38  -2.544   9.266  22.660
    5    HG2  LYS  38           HG2      LYS  38  -0.433   8.175  22.129
    6    HG3  LYS  38           HG3      LYS  38   0.155   9.627  21.312
    7    HD2  LYS  38           HD2      LYS  38   0.305  10.853  23.343
    8    HD3  LYS  38           HD3      LYS  38  -0.698   9.691  24.213
    9    HE2  LYS  38           HE2      LYS  38   1.661   9.411  24.835
   10    HE3  LYS  38           HE3      LYS  38   1.078   7.984  23.974
   11    HZ3  LYS  38           HZ1      LYS  38   2.374   8.417  22.193
   12    HZ2  LYS  38           HZ2      LYS  38   3.316   9.262  23.328
   13    HZ1  LYS  38           HZ3      LYS  38   2.225  10.103  22.333

  No H/Q in entry =          13
  In of MODEL   82
    1    H    ALA  39           H        ALA  39  -4.842   9.490  21.298
    2    HA   ALA  39           HA       ALA  39  -5.363   6.764  21.810
    3    HB3  ALA  39           HB1      ALA  39  -7.550   8.674  21.036
    4    HB2  ALA  39           HB2      ALA  39  -6.656   8.919  22.537
    5    HB1  ALA  39           HB3      ALA  39  -7.551   7.421  22.277

  No H/Q in entry =           5
  In of MODEL   82
    1    H    MET  40           H        MET  40  -5.975   8.760  18.957
    2    HA   MET  40           HA       MET  40  -7.421   6.802  17.501
    3    HB2  MET  40           HB2      MET  40  -5.846   9.219  16.591
    4    HB3  MET  40           HB3      MET  40  -6.857   8.242  15.523
    5    HG2  MET  40           HG2      MET  40  -7.912   9.482  18.076
    6    HG3  MET  40           HG3      MET  40  -7.981  10.312  16.523
    7    HE3  MET  40           HE1      MET  40 -10.538   8.648  14.461
    8    HE2  MET  40           HE2      MET  40  -8.787   8.791  14.314
    9    HE1  MET  40           HE3      MET  40  -9.725  10.144  14.943

  No H/Q in entry =           9
  In of MODEL   82
    1    H    MET  41           H        MET  41  -3.942   7.592  17.625
    2    HA   MET  41           HA       MET  41  -3.155   5.844  15.530
    3    HB2  MET  41           HB2      MET  41  -1.551   6.542  18.003
    4    HB3  MET  41           HB3      MET  41  -0.922   5.899  16.489
    5    HG2  MET  41           HG2      MET  41  -2.111   8.061  15.478
    6    HG3  MET  41           HG3      MET  41  -1.885   8.657  17.121
    7    HE2  MET  41           HE1      MET  41   1.064   6.604  17.491
    8    HE1  MET  41           HE2      MET  41   0.255   7.888  18.385
    9    HE3  MET  41           HE3      MET  41   1.875   8.155  17.743

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ASP  42           H        ASP  42  -3.536   5.374  19.017
    2    HA   ASP  42           HA       ASP  42  -2.460   2.797  19.186
    3    HB2  ASP  42           HB2      ASP  42  -3.363   4.548  21.002
    4    HB3  ASP  42           HB3      ASP  42  -4.774   3.501  20.931

  No H/Q in entry =           4
  In of MODEL   82
    1    H    GLN  43           H        GLN  43  -5.810   3.848  18.679
    2    HA   GLN  43           HA       GLN  43  -6.913   1.243  18.490
    3    HB2  GLN  43           HB2      GLN  43  -7.876   3.877  17.353
    4    HB3  GLN  43           HB3      GLN  43  -8.816   2.383  17.334
    5    HG2  GLN  43           HG2      GLN  43  -8.523   2.274  19.842
    6    HG3  GLN  43           HG3      GLN  43  -7.824   3.889  19.767
    7   HE21  GLN  43          HE21      GLN  43 -10.006   3.940  21.265
    8   HE22  GLN  43          HE22      GLN  43 -11.374   4.492  20.430

  No H/Q in entry =           8
  In of MODEL   82
    1    H    SER  44           H        SER  44  -5.605   3.471  16.073
    2    HA   SER  44           HA       SER  44  -6.280   1.969  13.788
    3    HB2  SER  44           HB2      SER  44  -5.061   4.373  14.226
    4    HB3  SER  44           HB3      SER  44  -3.691   3.397  13.700
    5    HG   SER  44           HG       SER  44  -4.817   4.347  11.933

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ARG  45           H        ARG  45  -3.403   1.907  15.871
    2    HA   ARG  45           HA       ARG  45  -1.892  -0.028  14.496
    3    HB2  ARG  45           HB2      ARG  45  -1.074   1.411  16.362
    4    HB3  ARG  45           HB3      ARG  45  -2.052   0.468  17.484
    5    HG2  ARG  45           HG2      ARG  45  -0.788  -1.573  16.848
    6    HG3  ARG  45           HG3      ARG  45   0.214  -0.605  15.769
    7    HD2  ARG  45           HD2      ARG  45   0.924   0.792  17.721
    8    HD3  ARG  45           HD3      ARG  45   0.018  -0.294  18.797
    9    HE   ARG  45           HE       ARG  45   1.743  -1.867  17.223
   10   HH21  ARG  45          HH11      ARG  45   3.655  -2.658  18.064
   11   HH22  ARG  45          HH12      ARG  45   4.414  -1.857  19.394
   12   HH11  ARG  45          HH21      ARG  45   2.005   0.610  19.606
   13   HH12  ARG  45          HH22      ARG  45   3.480  -0.004  20.265

  No H/Q in entry =          13
  In of MODEL   82
    1    H    MET  46           H        MET  46  -4.287  -0.378  17.094
    2    HA   MET  46           HA       MET  46  -4.077  -3.174  17.409
    3    HB2  MET  46           HB2      MET  46  -6.272  -1.196  18.005
    4    HB3  MET  46           HB3      MET  46  -6.462  -2.918  18.341
    5    HG2  MET  46           HG2      MET  46  -4.482  -2.897  19.769
    6    HG3  MET  46           HG3      MET  46  -4.180  -1.212  19.376
    7    HE3  MET  46           HE1      MET  46  -7.863  -2.920  20.335
    8    HE2  MET  46           HE2      MET  46  -7.354  -3.101  22.012
    9    HE1  MET  46           HE3      MET  46  -6.392  -3.822  20.725

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ALA  47           H        ALA  47  -6.124  -1.194  15.306
    2    HA   ALA  47           HA       ALA  47  -7.710  -3.271  14.244
    3    HB3  ALA  47           HB1      ALA  47  -8.422  -1.046  13.821
    4    HB1  ALA  47           HB2      ALA  47  -7.922  -1.676  12.252
    5    HB2  ALA  47           HB3      ALA  47  -6.859  -0.589  13.148

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LEU  48           H        LEU  48  -4.609  -1.919  13.194
    2    HA   LEU  48           HA       LEU  48  -4.302  -3.511  10.857
    3    HB2  LEU  48           HB2      LEU  48  -2.266  -2.198  12.665
    4    HB3  LEU  48           HB3      LEU  48  -1.884  -2.918  11.100
    5    HG   LEU  48           HG       LEU  48  -3.940  -0.729  11.481
    6   HD13  LEU  48          HD11      LEU  48  -1.832   0.180  12.148
    7   HD12  LEU  48          HD12      LEU  48  -2.113   0.725  10.494
    8   HD11  LEU  48          HD13      LEU  48  -0.996  -0.605  10.807
    9   HD22  LEU  48          HD21      LEU  48  -4.394  -1.725   9.407
   10   HD21  LEU  48          HD22      LEU  48  -2.705  -2.137   9.116
   11   HD23  LEU  48          HD23      LEU  48  -3.248  -0.465   8.951

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ASN  49           H        ASN  49  -3.255  -3.885  14.206
    2    HA   ASN  49           HA       ASN  49  -1.621  -6.126  13.883
    3    HB2  ASN  49           HB2      ASN  49  -1.681  -4.775  15.927
    4    HB3  ASN  49           HB3      ASN  49  -3.324  -5.308  16.255
    5   HD21  ASN  49          HD21      ASN  49  -2.881  -6.447  18.198
    6   HD22  ASN  49          HD22      ASN  49  -1.894  -7.826  18.256

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLU  50           H        GLU  50  -5.094  -5.897  14.549
    2    HA   GLU  50           HA       GLU  50  -5.568  -8.703  14.664
    3    HB2  GLU  50           HB2      GLU  50  -7.178  -7.035  15.533
    4    HB3  GLU  50           HB3      GLU  50  -7.477  -6.479  13.885
    5    HG2  GLU  50           HG2      GLU  50  -8.311  -8.688  13.251
    6    HG3  GLU  50           HG3      GLU  50  -7.923  -9.323  14.846

  No H/Q in entry =           6
  In of MODEL   82
    1    H    ALA  51           H        ALA  51  -5.664  -6.312  12.062
    2    HA   ALA  51           HA       ALA  51  -6.624  -8.058  10.043
    3    HB2  ALA  51           HB1      ALA  51  -6.425  -6.246   8.669
    4    HB1  ALA  51           HB2      ALA  51  -4.791  -5.874   9.219
    5    HB3  ALA  51           HB3      ALA  51  -6.183  -5.378  10.185

  No H/Q in entry =           5
  In of MODEL   82
    1    H    HIS  52           H        HIS  52  -3.346  -7.106  11.029
    2    HA   HIS  52           HA       HIS  52  -1.925  -8.581   9.086
    3    HB2  HIS  52           HB2      HIS  52  -0.896  -6.839  10.498
    4    HB3  HIS  52           HB3      HIS  52  -1.090  -7.877  11.910
    5    HD1  HIS  52           HD1      HIS  52   0.233 -10.227  11.806
    6    HD2  HIS  52           HD2      HIS  52   1.385  -7.373   8.994
    7    HE1  HIS  52           HE1      HIS  52   2.483 -10.970  10.911
    8    HE2  HIS  52           HE2      HIS  52   3.198  -9.241   9.195

  No H/Q in entry =           8
  In of MODEL   82
    1    H    LEU  53           H        LEU  53  -3.131  -9.466  12.298
    2    HA   LEU  53           HA       LEU  53  -1.902 -11.995  12.500
    3    HB2  LEU  53           HB2      LEU  53  -4.404 -10.841  13.708
    4    HB3  LEU  53           HB3      LEU  53  -3.925 -12.510  14.004
    5    HG   LEU  53           HG       LEU  53  -2.055 -10.167  14.478
    6   HD11  LEU  53          HD11      LEU  53  -4.098  -9.969  15.886
    7   HD13  LEU  53          HD12      LEU  53  -2.659 -10.316  16.842
    8   HD12  LEU  53          HD13      LEU  53  -3.812 -11.597  16.492
    9   HD23  LEU  53          HD21      LEU  53  -1.146 -11.962  16.160
   10   HD22  LEU  53          HD22      LEU  53  -0.750 -12.127  14.453
   11   HD21  LEU  53          HD23      LEU  53  -2.016 -13.116  15.156

  No H/Q in entry =          11
  In of MODEL   82
    1    H    VAL  54           H        VAL  54  -5.023 -11.007  11.130
    2    HA   VAL  54           HA       VAL  54  -5.905 -13.613  10.448
    3    HB   VAL  54           HB       VAL  54  -6.583 -10.891   9.306
    4   HG12  VAL  54          HG11      VAL  54  -8.667 -12.296   8.494
    5   HG11  VAL  54          HG12      VAL  54  -7.539 -13.649   8.571
    6   HG13  VAL  54          HG13      VAL  54  -7.194 -12.272   7.526
    7   HG22  VAL  54          HG21      VAL  54  -7.493 -10.935  11.456
    8   HG21  VAL  54          HG22      VAL  54  -7.726 -12.681  11.440
    9   HG23  VAL  54          HG23      VAL  54  -8.818 -11.639  10.529

  No H/Q in entry =           9
  In of MODEL   82
    1    H    GLN  55           H        GLN  55  -4.060 -11.144   8.656
    2    HA   GLN  55           HA       GLN  55  -3.908 -12.613   6.242
    3    HB2  GLN  55           HB2      GLN  55  -3.330 -10.342   6.048
    4    HB3  GLN  55           HB3      GLN  55  -2.221 -10.402   7.415
    5    HG2  GLN  55           HG2      GLN  55  -0.492 -11.231   6.143
    6    HG3  GLN  55           HG3      GLN  55  -1.553 -12.221   5.150
    7   HE21  GLN  55          HE21      GLN  55  -1.574 -11.536   3.027
    8   HE22  GLN  55          HE22      GLN  55  -1.394  -9.931   2.513

  No H/Q in entry =           8
  In of MODEL   82
    1    H    THR  56           H        THR  56  -1.807 -12.561   9.126
    2    HA   THR  56           HA       THR  56   0.291 -14.137   8.216
    3    HB   THR  56           HB       THR  56  -0.955 -14.393  10.963
    4    HG1  THR  56           HG1      THR  56   0.427 -12.335   9.715
    5   HG23  THR  56          HG21      THR  56   1.116 -15.195  11.660
    6   HG22  THR  56          HG22      THR  56   1.973 -14.437  10.318
    7   HG21  THR  56          HG23      THR  56   1.006 -15.886  10.042

  No H/Q in entry =           7
  In of MODEL   82
    1    H    LYS  57           H        LYS  57  -2.820 -15.206   9.577
    2    HA   LYS  57           HA       LYS  57  -2.342 -17.997   9.338
    3    HB2  LYS  57           HB2      LYS  57  -4.168 -16.982  10.692
    4    HB3  LYS  57           HB3      LYS  57  -4.948 -16.445   9.212
    5    HG2  LYS  57           HG2      LYS  57  -6.041 -18.470   9.913
    6    HG3  LYS  57           HG3      LYS  57  -5.080 -18.852   8.486
    7    HD2  LYS  57           HD2      LYS  57  -3.397 -19.934   9.779
    8    HD3  LYS  57           HD3      LYS  57  -4.008 -19.258  11.288
    9    HE2  LYS  57           HE2      LYS  57  -5.570 -21.196   9.546
   10    HE3  LYS  57           HE3      LYS  57  -4.628 -21.688  10.951
   11    HZ2  LYS  57           HZ1      LYS  57  -7.179 -20.344  10.815
   12    HZ1  LYS  57           HZ2      LYS  57  -6.098 -19.682  11.945
   13    HZ3  LYS  57           HZ3      LYS  57  -6.526 -21.324  12.038

  No H/Q in entry =          13
  In of MODEL   82
    1    H    LEU  58           H        LEU  58  -3.697 -15.575   7.154
    2    HA   LEU  58           HA       LEU  58  -4.475 -17.414   5.151
    3    HB2  LEU  58           HB2      LEU  58  -3.901 -14.459   5.010
    4    HB3  LEU  58           HB3      LEU  58  -4.552 -15.406   3.671
    5    HG   LEU  58           HG       LEU  58  -5.838 -15.234   6.416
    6   HD11  LEU  58          HD11      LEU  58  -6.152 -13.597   3.919
    7   HD13  LEU  58          HD12      LEU  58  -6.151 -13.085   5.607
    8   HD12  LEU  58          HD13      LEU  58  -7.564 -13.896   4.935
    9   HD22  LEU  58          HD21      LEU  58  -6.778 -17.156   5.549
   10   HD21  LEU  58          HD22      LEU  58  -6.441 -16.705   3.878
   11   HD23  LEU  58          HD23      LEU  58  -7.813 -15.992   4.724

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  59           H        ILE  59  -1.355 -16.166   6.015
    2    HA   ILE  59           HA       ILE  59  -0.244 -16.888   3.382
    3    HB   ILE  59           HB       ILE  59   0.498 -14.811   4.950
    4   HG12  ILE  59          HG12      ILE  59   2.605 -16.443   3.515
    5   HG13  ILE  59          HG13      ILE  59   1.404 -15.507   2.665
    6   HG23  ILE  59          HG21      ILE  59   2.349 -15.273   6.341
    7   HG22  ILE  59          HG22      ILE  59   2.608 -16.855   5.642
    8   HG21  ILE  59          HG23      ILE  59   1.244 -16.572   6.723
    9   HD12  ILE  59          HD11      ILE  59   3.378 -14.425   4.672
   10   HD11  ILE  59          HD12      ILE  59   2.134 -13.467   3.873
   11   HD13  ILE  59          HD13      ILE  59   3.443 -14.179   2.928

  No H/Q in entry =          11
  In of MODEL   82
    1    H    GLU  60           H        GLU  60  -0.249 -17.986   6.752
    2    HA   GLU  60           HA       GLU  60   1.804 -19.942   6.497
    3    HB2  GLU  60           HB2      GLU  60   1.009 -19.147   8.681
    4    HB3  GLU  60           HB3      GLU  60  -0.573 -19.861   8.376
    5    HG2  GLU  60           HG2      GLU  60   0.478 -22.104   8.236
    6    HG3  GLU  60           HG3      GLU  60   2.047 -21.378   8.573

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLY  61           H        GLY  61  -1.704 -20.080   6.004
    2    HA3  GLY  61           HA2      GLY  61  -1.424 -22.872   5.054
    3    HA2  GLY  61           HA3      GLY  61  -2.918 -22.151   5.642

  No H/Q in entry =           3
  In of MODEL   82
    1    H    ASP  62           H        ASP  62  -0.702 -20.552   3.439
    2    HA   ASP  62           HA       ASP  62  -2.573 -19.661   1.637
    3    HB2  ASP  62           HB2      ASP  62  -0.659 -19.478   0.043
    4    HB3  ASP  62           HB3      ASP  62  -0.304 -18.832   1.642

  No H/Q in entry =           4
  In of MODEL   82
    1    H    ALA  63           H        ALA  63  -4.014 -20.736   0.389
    2    HA   ALA  63           HA       ALA  63  -3.603 -23.524  -0.329
    3    HB2  ALA  63           HB1      ALA  63  -5.803 -21.568  -0.982
    4    HB3  ALA  63           HB2      ALA  63  -5.828 -22.837   0.242
    5    HB1  ALA  63           HB3      ALA  63  -5.804 -23.266  -1.469

  No H/Q in entry =           5
  In of MODEL   82
    1    H    GLY  64           H        GLY  64  -5.221 -22.030  -2.806
    2    HA3  GLY  64           HA2      GLY  64  -4.441 -21.045  -4.845
    3    HA2  GLY  64           HA3      GLY  64  -2.831 -21.642  -4.481

  No H/Q in entry =           3
  In of MODEL   82
    1    H    GLU  65           H        GLU  65  -4.281 -21.980  -6.968
    2    HA   GLU  65           HA       GLU  65  -5.464 -24.532  -7.144
    3    HB2  GLU  65           HB2      GLU  65  -4.143 -22.807  -9.237
    4    HB3  GLU  65           HB3      GLU  65  -4.992 -24.310  -9.603
    5    HG2  GLU  65           HG2      GLU  65  -7.046 -23.428  -8.607
    6    HG3  GLU  65           HG3      GLU  65  -6.210 -21.947  -8.147

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLY  66           H        GLY  66  -2.175 -23.465  -7.607
    2    HA3  GLY  66           HA2      GLY  66  -1.132 -26.017  -8.418
    3    HA2  GLY  66           HA3      GLY  66  -0.213 -24.563  -8.084

  No H/Q in entry =           3
  In of MODEL   82
    1    H    LYS  67           H        LYS  67   0.564 -27.149  -7.355
    2    HA   LYS  67           HA       LYS  67  -0.074 -27.916  -4.746
    3    HB2  LYS  67           HB2      LYS  67   2.073 -29.221  -4.891
    4    HB3  LYS  67           HB3      LYS  67   0.954 -29.467  -6.237
    5    HG2  LYS  67           HG2      LYS  67   2.209 -27.581  -7.432
    6    HG3  LYS  67           HG3      LYS  67   3.440 -27.747  -6.182
    7    HD2  LYS  67           HD2      LYS  67   2.703 -29.630  -8.383
    8    HD3  LYS  67           HD3      LYS  67   4.297 -29.207  -7.752
    9    HE2  LYS  67           HE2      LYS  67   3.609 -30.415  -5.603
   10    HE3  LYS  67           HE3      LYS  67   2.243 -31.051  -6.517
   11    HZ2  LYS  67           HZ1      LYS  67   4.188 -32.538  -6.506
   12    HZ1  LYS  67           HZ2      LYS  67   5.085 -31.347  -7.318
   13    HZ3  LYS  67           HZ3      LYS  67   3.738 -32.059  -8.069

  No H/Q in entry =          13
  In of MODEL   82
    1    H    MET  68           H        MET  68   2.511 -25.862  -5.915
    2    HA   MET  68           HA       MET  68   3.365 -25.226  -3.171
    3    HB2  MET  68           HB2      MET  68   4.703 -25.052  -5.854
    4    HB3  MET  68           HB3      MET  68   5.339 -24.191  -4.451
    5    HG2  MET  68           HG2      MET  68   5.524 -26.276  -3.204
    6    HG3  MET  68           HG3      MET  68   4.769 -27.170  -4.525
    7    HE2  MET  68           HE1      MET  68   8.915 -25.378  -4.165
    8    HE1  MET  68           HE2      MET  68   7.465 -25.083  -3.207
    9    HE3  MET  68           HE3      MET  68   7.682 -24.251  -4.746

  No H/Q in entry =           9
  In of MODEL   82
    1    H    LYS  69           H        LYS  69   1.393 -23.919  -5.528
    2    HA   LYS  69           HA       LYS  69   2.184 -21.174  -5.283
    3    HB2  LYS  69           HB2      LYS  69  -0.196 -22.465  -6.578
    4    HB3  LYS  69           HB3      LYS  69   0.064 -20.717  -6.552
    5    HG2  LYS  69           HG2      LYS  69   2.274 -21.021  -7.597
    6    HG3  LYS  69           HG3      LYS  69   2.020 -22.766  -7.631
    7    HD2  LYS  69           HD2      LYS  69   0.062 -22.465  -9.088
    8    HD3  LYS  69           HD3      LYS  69   0.291 -20.716  -9.044
    9    HE2  LYS  69           HE2      LYS  69   2.527 -20.981 -10.058
   10    HE3  LYS  69           HE3      LYS  69   2.296 -22.728 -10.107
   11    HZ2  LYS  69           HZ1      LYS  69   1.730 -21.242 -12.162
   12    HZ1  LYS  69           HZ2      LYS  69   0.264 -21.008 -11.334
   13    HZ3  LYS  69           HZ3      LYS  69   0.759 -22.576 -11.765

  No H/Q in entry =          13
  In of MODEL   82
    1    H    VAL  70           H        VAL  70   0.310 -19.497  -4.922
    2    HA   VAL  70           HA       VAL  70  -1.125 -20.142  -2.411
    3    HB   VAL  70           HB       VAL  70  -0.547 -17.885  -1.579
    4   HG12  VAL  70          HG11      VAL  70   2.101 -19.045  -2.321
    5   HG11  VAL  70          HG12      VAL  70   0.980 -20.073  -1.426
    6   HG13  VAL  70          HG13      VAL  70   1.503 -18.533  -0.743
    7   HG22  VAL  70          HG21      VAL  70  -0.246 -16.719  -3.721
    8   HG21  VAL  70          HG22      VAL  70   1.135 -17.742  -4.109
    9   HG23  VAL  70          HG23      VAL  70   1.242 -16.587  -2.783

  No H/Q in entry =           9
  In of MODEL   82
    1    H    SER  71           H        SER  71  -2.857 -18.564  -1.955
    2    HA   SER  71           HA       SER  71  -4.631 -18.217  -4.129
    3    HB2  SER  71           HB2      SER  71  -5.388 -18.356  -1.764
    4    HB3  SER  71           HB3      SER  71  -4.617 -16.809  -1.433
    5    HG   SER  71           HG       SER  71  -6.328 -16.884  -3.610

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LEU  72           H        LEU  72  -5.003 -16.507  -5.474
    2    HA   LEU  72           HA       LEU  72  -2.916 -14.672  -5.958
    3    HB2  LEU  72           HB2      LEU  72  -5.779 -14.758  -6.905
    4    HB3  LEU  72           HB3      LEU  72  -4.592 -13.593  -7.485
    5    HG   LEU  72           HG       LEU  72  -4.158 -16.595  -7.603
    6   HD11  LEU  72          HD11      LEU  72  -5.344 -14.678  -9.620
    7   HD13  LEU  72          HD12      LEU  72  -6.041 -16.179  -9.012
    8   HD12  LEU  72          HD13      LEU  72  -4.643 -16.228 -10.086
    9   HD22  LEU  72          HD21      LEU  72  -2.051 -15.594  -7.864
   10   HD21  LEU  72          HD22      LEU  72  -2.701 -14.172  -8.664
   11   HD23  LEU  72          HD23      LEU  72  -2.605 -15.702  -9.532

  No H/Q in entry =          11
  In of MODEL   82
    1    H    VAL  73           H        VAL  73  -6.015 -14.349  -4.331
    2    HA   VAL  73           HA       VAL  73  -6.093 -11.578  -3.986
    3    HB   VAL  73           HB       VAL  73  -7.830 -11.945  -2.452
    4   HG12  VAL  73          HG11      VAL  73  -7.810 -14.473  -4.114
    5   HG11  VAL  73          HG12      VAL  73  -8.147 -12.882  -4.794
    6   HG13  VAL  73          HG13      VAL  73  -9.213 -13.558  -3.561
    7   HG22  VAL  73          HG21      VAL  73  -6.774 -13.288  -0.785
    8   HG21  VAL  73          HG22      VAL  73  -6.450 -14.586  -1.933
    9   HG23  VAL  73          HG23      VAL  73  -8.103 -14.270  -1.403

  No H/Q in entry =           9
  In of MODEL   82
    1    H    LEU  74           H        LEU  74  -4.129 -13.919  -2.396
    2    HA   LEU  74           HA       LEU  74  -3.733 -12.769   0.125
    3    HB2  LEU  74           HB2      LEU  74  -2.920 -14.975  -0.357
    4    HB3  LEU  74           HB3      LEU  74  -1.885 -14.364  -1.646
    5    HG   LEU  74           HG       LEU  74  -0.580 -13.078   0.017
    6   HD13  LEU  74          HD11      LEU  74  -2.128 -12.599   1.751
    7   HD12  LEU  74          HD12      LEU  74  -1.032 -13.782   2.464
    8   HD11  LEU  74          HD13      LEU  74  -2.621 -14.287   1.887
    9   HD21  LEU  74          HD21      LEU  74  -0.346 -15.642  -0.582
   10   HD23  LEU  74          HD22      LEU  74  -0.761 -15.818   1.108
   11   HD22  LEU  74          HD23      LEU  74   0.662 -14.906   0.662

  No H/Q in entry =          11
  In of MODEL   82
    1    H    VAL  75           H        VAL  75  -1.845 -12.358  -2.831
    2    HA   VAL  75           HA       VAL  75  -0.072 -10.410  -1.823
    3    HB   VAL  75           HB       VAL  75  -1.019 -10.917  -4.645
    4   HG13  VAL  75          HG11      VAL  75  -0.197  -8.602  -4.458
    5   HG12  VAL  75          HG12      VAL  75   1.017  -9.584  -5.263
    6   HG11  VAL  75          HG13      VAL  75   1.218  -9.155  -3.571
    7   HG21  VAL  75          HG21      VAL  75   0.311 -12.668  -3.268
    8   HG23  VAL  75          HG22      VAL  75   1.660 -11.536  -3.386
    9   HG22  VAL  75          HG23      VAL  75   0.956 -12.224  -4.849

  No H/Q in entry =           9
  In of MODEL   82
    1    H    GLU  76           H        GLU  76  -3.225 -10.104  -3.484
    2    HA   GLU  76           HA       GLU  76  -3.311  -7.290  -3.590
    3    HB2  GLU  76           HB2      GLU  76  -4.953  -8.733  -4.757
    4    HB3  GLU  76           HB3      GLU  76  -5.590  -9.268  -3.210
    5    HG2  GLU  76           HG2      GLU  76  -7.081  -7.571  -4.059
    6    HG3  GLU  76           HG3      GLU  76  -6.213  -6.862  -2.712

  No H/Q in entry =           6
  In of MODEL   82
    1    H    ALA  77           H        ALA  77  -4.396  -9.527  -1.047
    2    HA   ALA  77           HA       ALA  77  -5.378  -7.534   0.708
    3    HB3  ALA  77           HB1      ALA  77  -5.483  -9.232   2.351
    4    HB1  ALA  77           HB2      ALA  77  -4.168 -10.145   1.612
    5    HB2  ALA  77           HB3      ALA  77  -5.741 -10.072   0.822

  No H/Q in entry =           5
  In of MODEL   82
    1    H    GLN  78           H        GLN  78  -2.212  -9.046   0.348
    2    HA   GLN  78           HA       GLN  78  -0.969  -7.867   2.597
    3    HB2  GLN  78           HB2      GLN  78  -0.087  -9.800   1.241
    4    HB3  GLN  78           HB3      GLN  78   0.342  -8.648  -0.021
    5    HG2  GLN  78           HG2      GLN  78   1.784  -7.440   1.568
    6    HG3  GLN  78           HG3      GLN  78   1.358  -8.590   2.834
    7   HE21  GLN  78          HE21      GLN  78   4.080  -8.275   1.989
    8   HE22  GLN  78          HE22      GLN  78   4.562  -9.702   1.205

  No H/Q in entry =           8
  In of MODEL   82
    1    H    LEU  79           H        LEU  79  -1.346  -6.816  -0.752
    2    HA   LEU  79           HA       LEU  79   0.315  -4.571  -0.742
    3    HB2  LEU  79           HB2      LEU  79  -0.701  -5.392  -2.795
    4    HB3  LEU  79           HB3      LEU  79  -2.310  -5.018  -2.188
    5    HG   LEU  79           HG       LEU  79  -1.793  -2.625  -2.166
    6   HD13  LEU  79          HD11      LEU  79   0.444  -2.355  -1.652
    7   HD12  LEU  79          HD12      LEU  79   0.492  -2.070  -3.392
    8   HD11  LEU  79          HD13      LEU  79   0.963  -3.642  -2.743
    9   HD23  LEU  79          HD21      LEU  79  -1.159  -2.423  -4.718
   10   HD22  LEU  79          HD22      LEU  79  -2.677  -3.187  -4.259
   11   HD21  LEU  79          HD23      LEU  79  -1.293  -4.181  -4.701

  No H/Q in entry =          11
  In of MODEL   82
    1    H    HIS  80           H        HIS  80  -3.150  -4.770   0.083
    2    HA   HIS  80           HA       HIS  80  -3.372  -2.015   0.741
    3    HB2  HIS  80           HB2      HIS  80  -5.048  -4.441   1.063
    4    HB3  HIS  80           HB3      HIS  80  -5.384  -3.103   2.165
    5    HD1  HIS  80           HD1      HIS  80  -7.018  -1.485   1.253
    6    HD2  HIS  80           HD2      HIS  80  -4.804  -3.279  -1.790
    7    HE1  HIS  80           HE1      HIS  80  -7.867  -0.501  -0.928
    8    HE2  HIS  80           HE2      HIS  80  -6.524  -1.589  -2.793

  No H/Q in entry =           8
  In of MODEL   82
    1    H    LEU  81           H        LEU  81  -2.854  -4.901   2.740
    2    HA   LEU  81           HA       LEU  81  -2.857  -3.549   5.222
    3    HB2  LEU  81           HB2      LEU  81  -1.611  -6.154   4.347
    4    HB3  LEU  81           HB3      LEU  81  -1.592  -5.592   6.020
    5    HG   LEU  81           HG       LEU  81  -4.133  -5.874   4.391
    6   HD12  LEU  81          HD11      LEU  81  -4.415  -7.940   5.942
    7   HD11  LEU  81          HD12      LEU  81  -2.664  -7.850   6.129
    8   HD13  LEU  81          HD13      LEU  81  -3.369  -8.091   4.530
    9   HD23  LEU  81          HD21      LEU  81  -4.976  -6.081   6.892
   10   HD22  LEU  81          HD22      LEU  81  -4.668  -4.490   6.199
   11   HD21  LEU  81          HD23      LEU  81  -3.473  -5.237   7.262

  No H/Q in entry =          11
  In of MODEL   82
    1    H    MET  82           H        MET  82  -0.166  -4.428   3.054
    2    HA   MET  82           HA       MET  82   1.907  -3.510   4.737
    3    HB2  MET  82           HB2      MET  82   1.697  -3.859   1.746
    4    HB3  MET  82           HB3      MET  82   3.173  -3.272   2.509
    5    HG2  MET  82           HG2      MET  82   1.792  -5.874   3.237
    6    HG3  MET  82           HG3      MET  82   3.163  -5.752   2.138
    7    HE3  MET  82           HE1      MET  82   6.170  -4.982   4.122
    8    HE2  MET  82           HE2      MET  82   5.233  -3.625   3.501
    9    HE1  MET  82           HE3      MET  82   5.338  -5.116   2.568

  No H/Q in entry =           9
  In of MODEL   82
    1    H    THR  83           H        THR  83   0.070  -1.891   2.177
    2    HA   THR  83           HA       THR  83   1.458   0.572   2.260
    3    HB   THR  83           HB       THR  83  -0.727   1.473   1.271
    4    HG1  THR  83           HG1      THR  83  -2.365   0.160   1.165
    5   HG22  THR  83          HG21      THR  83  -0.438  -0.346  -0.727
    6   HG21  THR  83          HG22      THR  83   1.065  -0.621   0.152
    7   HG23  THR  83          HG23      THR  83   0.688   0.987  -0.467

  No H/Q in entry =           7
  In of MODEL   82
    1    H    SER  84           H        SER  84  -1.539  -0.487   3.861
    2    HA   SER  84           HA       SER  84  -2.060   1.940   5.201
    3    HB2  SER  84           HB2      SER  84  -2.865  -0.905   5.770
    4    HB3  SER  84           HB3      SER  84  -3.372   0.433   6.800
    5    HG   SER  84           HG       SER  84  -3.826   0.110   4.009

  No H/Q in entry =           5
  In of MODEL   82
    1    H    MET  85           H        MET  85  -0.322  -0.973   6.337
    2    HA   MET  85           HA       MET  85   0.187  -0.037   8.939
    3    HB2  MET  85           HB2      MET  85   0.501  -2.381   8.247
    4    HB3  MET  85           HB3      MET  85   1.897  -1.896   7.281
    5    HG2  MET  85           HG2      MET  85   3.008  -1.040   9.319
    6    HG3  MET  85           HG3      MET  85   1.615  -1.536  10.280
    7    HE2  MET  85           HE1      MET  85   4.976  -4.065   8.558
    8    HE1  MET  85           HE2      MET  85   4.875  -2.320   8.788
    9    HE3  MET  85           HE3      MET  85   4.010  -3.078   7.454

  No H/Q in entry =           9
  In of MODEL   82
    1    H    LEU  86           H        LEU  86   2.121   0.232   5.989
    2    HA   LEU  86           HA       LEU  86   4.322   1.565   7.143
    3    HB2  LEU  86           HB2      LEU  86   4.142   0.477   4.836
    4    HB3  LEU  86           HB3      LEU  86   3.320   1.950   4.320
    5    HG   LEU  86           HG       LEU  86   5.336   3.217   5.299
    6   HD11  LEU  86          HD11      LEU  86   6.065   0.613   6.104
    7   HD13  LEU  86          HD12      LEU  86   7.055   2.068   6.199
    8   HD12  LEU  86          HD13      LEU  86   7.175   1.018   4.790
    9   HD23  LEU  86          HD21      LEU  86   6.071   1.456   2.952
   10   HD22  LEU  86          HD22      LEU  86   6.448   3.157   3.211
   11   HD21  LEU  86          HD23      LEU  86   4.800   2.673   2.813

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ALA  87           H        ALA  87   1.399   2.779   5.555
    2    HA   ALA  87           HA       ALA  87   1.968   5.514   5.633
    3    HB1  ALA  87           HB1      ALA  87  -0.326   3.864   5.094
    4    HB3  ALA  87           HB2      ALA  87  -0.030   5.526   4.591
    5    HB2  ALA  87           HB3      ALA  87  -0.822   5.201   6.135

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ARG  88           H        ARG  88   0.296   3.502   8.026
    2    HA   ARG  88           HA       ARG  88  -0.236   5.550   9.869
    3    HB2  ARG  88           HB2      ARG  88  -1.152   3.189   9.939
    4    HB3  ARG  88           HB3      ARG  88   0.392   2.705  10.647
    5    HG2  ARG  88           HG2      ARG  88  -0.104   4.778  12.263
    6    HG3  ARG  88           HG3      ARG  88  -1.767   4.437  11.807
    7    HD2  ARG  88           HD2      ARG  88  -1.858   2.589  13.057
    8    HD3  ARG  88           HD3      ARG  88  -0.263   2.021  12.528
    9    HE   ARG  88           HE       ARG  88  -0.810   3.285  14.979
   10   HH21  ARG  88          HH11      ARG  88   0.738   4.314  16.216
   11   HH22  ARG  88          HH12      ARG  88   2.254   4.753  15.511
   12   HH11  ARG  88          HH21      ARG  88   1.470   3.482  12.403
   13   HH12  ARG  88          HH22      ARG  88   2.677   4.266  13.364

  No H/Q in entry =          13
  In of MODEL   82
    1    H    GLU  89           H        GLU  89   2.581   3.357   9.652
    2    HA   GLU  89           HA       GLU  89   3.833   4.263  11.994
    3    HB2  GLU  89           HB2      GLU  89   4.512   2.248  10.655
    4    HB3  GLU  89           HB3      GLU  89   5.278   3.347   9.506
    5    HG2  GLU  89           HG2      GLU  89   6.754   4.212  11.249
    6    HG3  GLU  89           HG3      GLU  89   5.928   3.250  12.471

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LEU  90           H        LEU  90   4.141   5.417   8.664
    2    HA   LEU  90           HA       LEU  90   6.051   7.437   9.246
    3    HB2  LEU  90           HB2      LEU  90   4.050   7.081   7.018
    4    HB3  LEU  90           HB3      LEU  90   5.267   8.364   7.037
    5    HG   LEU  90           HG       LEU  90   5.970   5.435   7.378
    6   HD12  LEU  90          HD11      LEU  90   6.717   5.670   4.938
    7   HD11  LEU  90          HD12      LEU  90   5.688   7.101   4.886
    8   HD13  LEU  90          HD13      LEU  90   4.983   5.521   5.232
    9   HD22  LEU  90          HD21      LEU  90   7.855   6.605   8.058
   10   HD21  LEU  90          HD22      LEU  90   7.492   8.004   7.048
   11   HD23  LEU  90          HD23      LEU  90   8.167   6.544   6.325

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  91           H        ILE  91   2.512   7.417   9.095
    2    HA   ILE  91           HA       ILE  91   2.141  10.187   9.539
    3    HB   ILE  91           HB       ILE  91   0.375   7.794  10.086
    4   HG12  ILE  91          HG12      ILE  91   0.104  10.068   8.096
    5   HG13  ILE  91          HG13      ILE  91   0.979   8.582   7.728
    6   HG22  ILE  91          HG21      ILE  91  -1.379   9.834  10.144
    7   HG21  ILE  91          HG22      ILE  91   0.013  10.681  10.816
    8   HG23  ILE  91          HG23      ILE  91  -0.609   9.239  11.615
    9   HD13  ILE  91          HD11      ILE  91  -0.951   7.274   7.774
   10   HD12  ILE  91          HD12      ILE  91  -1.556   8.782   7.089
   11   HD11  ILE  91          HD13      ILE  91  -1.824   8.419   8.794

  No H/Q in entry =          11
  In of MODEL   82
    1    H    THR  92           H        THR  92   2.572   7.455  11.747
    2    HA   THR  92           HA       THR  92   2.113   8.829  14.168
    3    HB   THR  92           HB       THR  92   3.946   6.512  13.509
    4    HG1  THR  92           HG1      THR  92   1.986   5.734  13.409
    5   HG22  THR  92          HG21      THR  92   3.564   6.230  16.143
    6   HG21  THR  92          HG22      THR  92   3.481   7.988  16.066
    7   HG23  THR  92          HG23      THR  92   4.923   7.147  15.496

  No H/Q in entry =           7
  In of MODEL   82
    1    H    GLU  93           H        GLU  93   5.070   8.408  12.237
    2    HA   GLU  93           HA       GLU  93   6.806   9.858  13.932
    3    HB2  GLU  93           HB2      GLU  93   6.900   9.537  10.917
    4    HB3  GLU  93           HB3      GLU  93   8.234  10.084  11.931
    5    HG2  GLU  93           HG2      GLU  93   6.854   7.434  12.384
    6    HG3  GLU  93           HG3      GLU  93   8.236   7.598  11.309

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LEU  94           H        LEU  94   4.748  10.843  11.215
    2    HA   LEU  94           HA       LEU  94   5.523  13.556  11.108
    3    HB2  LEU  94           HB2      LEU  94   2.949  12.159  10.356
    4    HB3  LEU  94           HB3      LEU  94   3.187  13.889  10.111
    5    HG   LEU  94           HG       LEU  94   5.228  11.922   9.067
    6   HD11  LEU  94          HD11      LEU  94   2.481  12.438   8.001
    7   HD13  LEU  94          HD12      LEU  94   3.481  10.993   7.880
    8   HD12  LEU  94          HD13      LEU  94   3.801  12.374   6.832
    9   HD23  LEU  94          HD21      LEU  94   5.459  13.756   7.340
   10   HD22  LEU  94          HD22      LEU  94   5.866  14.258   8.981
   11   HD21  LEU  94          HD23      LEU  94   4.311  14.706   8.280

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  95           H        ILE  95   3.002  11.914  13.002
    2    HA   ILE  95           HA       ILE  95   1.931  14.254  14.190
    3    HB   ILE  95           HB       ILE  95   1.981  11.376  15.122
    4   HG12  ILE  95          HG12      ILE  95  -0.259  13.120  14.066
    5   HG13  ILE  95          HG13      ILE  95   0.711  12.069  13.038
    6   HG21  ILE  95          HG21      ILE  95   0.668  13.836  16.316
    7   HG23  ILE  95          HG22      ILE  95   1.730  12.681  17.124
    8   HG22  ILE  95          HG23      ILE  95   0.101  12.200  16.649
    9   HD13  ILE  95          HD11      ILE  95  -0.170  10.123  13.961
   10   HD12  ILE  95          HD12      ILE  95  -1.565  11.195  14.033
   11   HD11  ILE  95          HD13      ILE  95  -0.598  10.912  15.480

  No H/Q in entry =          11
  In of MODEL   82
    1    H    GLU  96           H        GLU  96   4.552  12.070  15.193
    2    HA   GLU  96           HA       GLU  96   5.090  13.282  17.683
    3    HB2  GLU  96           HB2      GLU  96   6.065  11.133  17.042
    4    HB3  GLU  96           HB3      GLU  96   6.990  11.915  15.761
    5    HG2  GLU  96           HG2      GLU  96   8.630  12.487  17.223
    6    HG3  GLU  96           HG3      GLU  96   7.472  13.289  18.275

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LEU  97           H        LEU  97   6.158  14.059  14.396
    2    HA   LEU  97           HA       LEU  97   8.018  16.080  15.104
    3    HB2  LEU  97           HB2      LEU  97   6.436  15.505  12.609
    4    HB3  LEU  97           HB3      LEU  97   7.437  16.949  12.728
    5    HG   LEU  97           HG       LEU  97   8.501  14.166  13.296
    6   HD12  LEU  97          HD11      LEU  97   9.497  14.367  10.980
    7   HD11  LEU  97          HD12      LEU  97   8.428  15.743  10.711
    8   HD13  LEU  97          HD13      LEU  97   7.749  14.143  11.010
    9   HD23  LEU  97          HD21      LEU  97  10.654  15.471  12.552
   10   HD22  LEU  97          HD22      LEU  97  10.030  15.737  14.180
   11   HD21  LEU  97          HD23      LEU  97   9.702  16.912  12.908

  No H/Q in entry =          11
  In of MODEL   82
    1    H    HIS  98           H        HIS  98   4.525  16.169  14.446
    2    HA   HIS  98           HA       HIS  98   4.190  18.965  14.574
    3    HB2  HIS  98           HB2      HIS  98   2.328  16.692  15.304
    4    HB3  HIS  98           HB3      HIS  98   1.839  18.386  15.354
    5    HD1  HIS  98           HD1      HIS  98   2.898  15.678  12.958
    6    HD2  HIS  98           HD2      HIS  98   1.471  19.593  12.824
    7    HE1  HIS  98           HE1      HIS  98   2.335  16.153  10.532
    8    HE2  HIS  98           HE2      HIS  98   1.470  18.531  10.429

  No H/Q in entry =           8
  In of MODEL   82
    1    H    GLU  99           H        GLU  99   4.353  16.485  17.079
    2    HA   GLU  99           HA       GLU  99   3.720  18.177  19.272
    3    HB2  GLU  99           HB2      GLU  99   3.664  15.694  19.376
    4    HB3  GLU  99           HB3      GLU  99   5.424  15.672  19.269
    5    HG2  GLU  99           HG2      GLU  99   5.594  16.972  21.340
    6    HG3  GLU  99           HG3      GLU  99   3.839  17.090  21.434

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LYS 100           H        LYS 100   6.787  17.282  17.713
    2    HA   LYS 100           HA       LYS 100   8.422  18.709  19.567
    3    HB2  LYS 100           HB2      LYS 100   8.936  17.784  16.732
    4    HB3  LYS 100           HB3      LYS 100  10.154  18.572  17.739
    5    HG2  LYS 100           HG2      LYS 100   9.799  16.821  19.484
    6    HG3  LYS 100           HG3      LYS 100   8.679  16.000  18.394
    7    HD2  LYS 100           HD2      LYS 100  10.478  15.737  16.730
    8    HD3  LYS 100           HD3      LYS 100  11.603  16.570  17.805
    9    HE2  LYS 100           HE2      LYS 100  11.228  14.814  19.527
   10    HE3  LYS 100           HE3      LYS 100  10.166  13.961  18.403
   11    HZ1  LYS 100           HZ1      LYS 100  12.978  14.666  17.749
   12    HZ3  LYS 100           HZ2      LYS 100  11.949  13.595  16.922
   13    HZ2  LYS 100           HZ3      LYS 100  12.541  13.188  18.462

  No H/Q in entry =          13
  In of MODEL   82
    1    H    LEU 101           H        LEU 101   6.719  19.606  16.608
    2    HA   LEU 101           HA       LEU 101   7.900  22.178  16.268
    3    HB2  LEU 101           HB2      LEU 101   5.322  20.909  15.381
    4    HB3  LEU 101           HB3      LEU 101   5.551  22.642  15.170
    5    HG   LEU 101           HG       LEU 101   7.614  20.650  14.211
    6   HD12  LEU 101          HD11      LEU 101   6.457  21.135  11.924
    7   HD11  LEU 101          HD12      LEU 101   5.051  21.549  12.902
    8   HD13  LEU 101          HD13      LEU 101   5.736  19.928  12.988
    9   HD21  LEU 101          HD21      LEU 101   6.949  23.553  13.648
   10   HD23  LEU 101          HD22      LEU 101   7.943  22.602  12.544
   11   HD22  LEU 101          HD23      LEU 101   8.480  22.871  14.202

  No H/Q in entry =          11
  In of MODEL   82
    1    H    LYS 102           H        LYS 102   6.375  21.027  18.885
    2    HA   LYS 102           HA       LYS 102   5.727  22.115  20.813
    3    HB2  LYS 102           HB2      LYS 102   6.985  24.119  19.685
    4    HB3  LYS 102           HB3      LYS 102   5.379  24.702  19.307
    5    HG2  LYS 102           HG2      LYS 102   6.756  24.470  21.961
    6    HG3  LYS 102           HG3      LYS 102   5.788  25.785  21.327
    7    HD2  LYS 102           HD2      LYS 102   4.577  23.135  22.212
    8    HD3  LYS 102           HD3      LYS 102   4.807  24.502  23.292
    9    HE2  LYS 102           HE2      LYS 102   2.534  24.066  21.802
   10    HE3  LYS 102           HE3      LYS 102   3.017  25.620  22.480
   11    HZ2  LYS 102           HZ1      LYS 102   2.487  25.715  20.100
   12    HZ1  LYS 102           HZ2      LYS 102   3.763  24.649  19.781
   13    HZ3  LYS 102           HZ3      LYS 102   4.086  26.185  20.420

  No H/Q in entry =          13
  In of MODEL   82
    1    H    ALA 103           H        ALA 103   4.072  23.630  18.041
    2    HA   ALA 103           HA       ALA 103   1.610  24.177  18.922
    3    HB1  ALA 103           HB1      ALA 103   0.725  23.319  16.681
    4    HB2  ALA 103           HB2      ALA 103   2.379  22.802  16.354
    5    HB3  ALA 103           HB3      ALA 103   2.022  24.511  16.616

  No H/Q in entry =           5
  In of MODEL   82
    1    H1   ALA   1           H3       ALA   1  10.796 -20.271  -6.236
    2    H2   ALA   1           H2       ALA   1   9.835 -20.492  -7.623
    3    H3   ALA   1           H1       ALA   1   9.406 -21.240  -6.158
    4    HA   ALA   1           HA       ALA   1  10.468 -23.038  -6.893
    5    HB1  ALA   1           HB1      ALA   1  10.561 -22.683  -9.169
    6    HB2  ALA   1           HB2      ALA   1  12.286 -22.511  -8.839
    7    HB3  ALA   1           HB3      ALA   1  11.270 -21.077  -8.994

  No H/Q in entry =           7
  In of MODEL   82
    1    H    GLU   2           H        GLU   2  12.763 -23.961  -6.947
    2    HA   GLU   2           HA       GLU   2  14.141 -23.858  -4.734
    3    HB2  GLU   2           HB2      GLU   2  15.498 -23.716  -7.432
    4    HB3  GLU   2           HB3      GLU   2  16.232 -24.316  -5.945
    5    HG2  GLU   2           HG2      GLU   2  15.240 -26.345  -6.182
    6    HG3  GLU   2           HG3      GLU   2  13.660 -25.618  -6.444

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLU   3           H        GLU   3  15.892 -21.978  -7.139
    2    HA   GLU   3           HA       GLU   3  17.024 -20.273  -5.182
    3    HB2  GLU   3           HB2      GLU   3  16.970 -20.278  -8.192
    4    HB3  GLU   3           HB3      GLU   3  17.699 -18.938  -7.308
    5    HG2  GLU   3           HG2      GLU   3  19.377 -20.291  -6.381
    6    HG3  GLU   3           HG3      GLU   3  18.449 -21.769  -6.599

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LEU   4           H        LEU   4  14.734 -19.458  -7.816
    2    HA   LEU   4           HA       LEU   4  14.236 -16.853  -7.211
    3    HB2  LEU   4           HB2      LEU   4  12.085 -18.855  -7.938
    4    HB3  LEU   4           HB3      LEU   4  11.989 -17.108  -8.141
    5    HG   LEU   4           HG       LEU   4  13.976 -18.951  -9.508
    6   HD13  LEU   4          HD11      LEU   4  12.674 -18.822 -11.420
    7   HD12  LEU   4          HD12      LEU   4  11.948 -17.284 -10.956
    8   HD11  LEU   4          HD13      LEU   4  11.411 -18.779 -10.192
    9   HD23  LEU   4          HD21      LEU   4  14.287 -16.705 -10.865
   10   HD22  LEU   4          HD22      LEU   4  15.149 -16.934  -9.344
   11   HD21  LEU   4          HD23      LEU   4  13.685 -15.955  -9.387

  No H/Q in entry =          11
  In of MODEL   82
    1    H    GLU   5           H        GLU   5  12.783 -19.651  -5.564
    2    HA   GLU   5           HA       GLU   5  11.086 -18.095  -3.865
    3    HB2  GLU   5           HB2      GLU   5  10.686 -20.477  -4.379
    4    HB3  GLU   5           HB3      GLU   5  12.128 -20.898  -3.453
    5    HG2  GLU   5           HG2      GLU   5  11.159 -19.889  -1.441
    6    HG3  GLU   5           HG3      GLU   5   9.730 -19.406  -2.355

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLU   6           H        GLU   6  14.251 -19.637  -3.417
    2    HA   GLU   6           HA       GLU   6  14.592 -18.770  -0.721
    3    HB2  GLU   6           HB2      GLU   6  15.843 -20.672  -1.691
    4    HB3  GLU   6           HB3      GLU   6  16.681 -19.554  -2.769
    5    HG2  GLU   6           HG2      GLU   6  17.617 -18.362  -0.840
    6    HG3  GLU   6           HG3      GLU   6  16.747 -19.431   0.260

  No H/Q in entry =           6
  In of MODEL   82
    1    H    VAL   7           H        VAL   7  15.343 -17.441  -3.873
    2    HA   VAL   7           HA       VAL   7  17.003 -15.293  -3.012
    3    HB   VAL   7           HB       VAL   7  15.303 -15.683  -5.490
    4   HG11  VAL   7          HG11      VAL   7  17.169 -13.445  -4.682
    5   HG13  VAL   7          HG12      VAL   7  15.526 -13.324  -5.306
    6   HG12  VAL   7          HG13      VAL   7  16.841 -13.813  -6.374
    7   HG21  VAL   7          HG21      VAL   7  17.427 -17.112  -4.916
    8   HG23  VAL   7          HG22      VAL   7  18.315 -15.641  -5.317
    9   HG22  VAL   7          HG23      VAL   7  17.288 -16.406  -6.528

  No H/Q in entry =           9
  In of MODEL   82
    1    H    VAL   8           H        VAL   8  13.514 -15.606  -3.570
    2    HA   VAL   8           HA       VAL   8  12.815 -12.905  -3.105
    3    HB   VAL   8           HB       VAL   8  11.284 -15.492  -2.792
    4   HG11  VAL   8          HG11      VAL   8  10.490 -12.664  -2.126
    5   HG13  VAL   8          HG12      VAL   8  10.172 -14.145  -1.224
    6   HG12  VAL   8          HG13      VAL   8   9.282 -13.809  -2.707
    7   HG21  VAL   8          HG21      VAL   8  11.843 -13.629  -4.969
    8   HG23  VAL   8          HG22      VAL   8  10.110 -13.734  -4.676
    9   HG22  VAL   8          HG23      VAL   8  11.029 -15.191  -5.037

  No H/Q in entry =           9
  In of MODEL   82
    1    H    MET   9           H        MET   9  13.116 -15.703  -0.919
    2    HA   MET   9           HA       MET   9  12.283 -14.436   1.448
    3    HB2  MET   9           HB2      MET   9  14.175 -16.709   0.885
    4    HB3  MET   9           HB3      MET   9  13.961 -16.105   2.527
    5    HG2  MET   9           HG2      MET   9  11.429 -16.362   2.092
    6    HG3  MET   9           HG3      MET   9  11.903 -17.348   0.707
    7    HE1  MET   9           HE1      MET   9  12.924 -19.429   0.656
    8    HE3  MET   9           HE2      MET   9  13.472 -20.440   1.989
    9    HE2  MET   9           HE3      MET   9  14.416 -19.032   1.516

  No H/Q in entry =           9
  In of MODEL   82
    1    H    GLY  10           H        GLY  10  15.468 -14.623  -0.106
    2    HA3  GLY  10           HA2      GLY  10  16.907 -13.179   1.861
    3    HA2  GLY  10           HA3      GLY  10  17.373 -13.342   0.169

  No H/Q in entry =           3
  In of MODEL   82
    1    H    LEU  11           H        LEU  11  15.190 -12.153  -1.075
    2    HA   LEU  11           HA       LEU  11  15.839  -9.398  -0.917
    3    HB2  LEU  11           HB2      LEU  11  13.491 -10.842  -2.151
    4    HB3  LEU  11           HB3      LEU  11  13.748  -9.104  -2.314
    5    HG   LEU  11           HG       LEU  11  15.804 -11.188  -3.096
    6   HD13  LEU  11          HD11      LEU  11  14.064 -11.581  -4.616
    7   HD12  LEU  11          HD12      LEU  11  15.052 -10.389  -5.459
    8   HD11  LEU  11          HD13      LEU  11  13.571  -9.888  -4.642
    9   HD22  LEU  11          HD21      LEU  11  17.009  -9.208  -2.874
   10   HD21  LEU  11          HD22      LEU  11  15.620  -8.190  -3.256
   11   HD23  LEU  11          HD23      LEU  11  16.464  -9.050  -4.542

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  12           H        ILE  12  13.094 -11.258   0.352
    2    HA   ILE  12           HA       ILE  12  11.670  -9.051   1.406
    3    HB   ILE  12           HB       ILE  12  11.747 -11.947   2.309
    4   HG12  ILE  12          HG12      ILE  12  10.982 -11.312  -0.082
    5   HG13  ILE  12          HG13      ILE  12   9.912 -12.331   0.863
    6   HG21  ILE  12          HG21      ILE  12   9.859  -9.686   3.036
    7   HG23  ILE  12          HG22      ILE  12  10.856 -10.641   4.134
    8   HG22  ILE  12          HG23      ILE  12   9.488 -11.387   3.309
    9   HD13  ILE  12          HD11      ILE  12   8.547 -10.379   1.422
   10   HD12  ILE  12          HD12      ILE  12   8.714 -10.515  -0.327
   11   HD11  ILE  12          HD13      ILE  12   9.659  -9.334   0.554

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  13           H        ILE  13  14.092 -11.219   2.818
    2    HA   ILE  13           HA       ILE  13  14.109 -10.034   5.396
    3    HB   ILE  13           HB       ILE  13  16.195 -11.577   3.836
    4   HG12  ILE  13          HG12      ILE  13  13.924 -12.568   4.679
    5   HG13  ILE  13          HG13      ILE  13  15.410 -13.480   4.926
    6   HG22  ILE  13          HG21      ILE  13  17.258 -11.914   6.142
    7   HG21  ILE  13          HG22      ILE  13  16.288 -10.554   6.689
    8   HG23  ILE  13          HG23      ILE  13  17.485 -10.324   5.414
    9   HD13  ILE  13          HD11      ILE  13  15.538 -12.791   7.244
   10   HD12  ILE  13          HD12      ILE  13  13.888 -13.331   6.951
   11   HD11  ILE  13          HD13      ILE  13  14.249 -11.610   7.010

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ASN  14           H        ASN  14  16.057  -9.481   2.478
    2    HA   ASN  14           HA       ASN  14  17.771  -7.511   3.536
    3    HB2  ASN  14           HB2      ASN  14  17.770  -8.783   1.223
    4    HB3  ASN  14           HB3      ASN  14  16.856  -7.381   0.682
    5   HD21  ASN  14          HD21      ASN  14  19.302  -7.686  -0.501
    6   HD22  ASN  14          HD22      ASN  14  20.428  -6.584   0.125

  No H/Q in entry =           6
  In of MODEL   82
    1    H    SER  15           H        SER  15  14.657  -7.215   1.840
    2    HA   SER  15           HA       SER  15  14.501  -4.397   1.890
    3    HB2  SER  15           HB2      SER  15  12.175  -4.680   1.389
    4    HB3  SER  15           HB3      SER  15  12.992  -6.040   0.628
    5    HG   SER  15           HG       SER  15  11.273  -5.967   2.795

  No H/Q in entry =           5
  In of MODEL   82
    1    H    GLY  16           H        GLY  16  13.444  -6.868   4.199
    2    HA3  GLY  16           HA2      GLY  16  12.194  -5.134   6.051
    3    HA2  GLY  16           HA3      GLY  16  12.833  -6.732   6.417

  No H/Q in entry =           3
  In of MODEL   82
    1    H    GLN  17           H        GLN  17  15.540  -6.357   5.826
    2    HA   GLN  17           HA       GLN  17  16.474  -5.116   8.205
    3    HB2  GLN  17           HB2      GLN  17  17.903  -5.959   5.671
    4    HB3  GLN  17           HB3      GLN  17  18.745  -5.327   7.086
    5    HG2  GLN  17           HG2      GLN  17  17.843  -7.128   8.471
    6    HG3  GLN  17           HG3      GLN  17  16.909  -7.738   7.107
    7   HE21  GLN  17          HE21      GLN  17  19.793  -8.210   8.765
    8   HE22  GLN  17          HE22      GLN  17  20.674  -8.983   7.538

  No H/Q in entry =           8
  In of MODEL   82
    1    H    ALA  18           H        ALA  18  16.272  -4.049   4.842
    2    HA   ALA  18           HA       ALA  18  17.668  -1.633   5.065
    3    HB2  ALA  18           HB1      ALA  18  16.572  -2.870   2.999
    4    HB3  ALA  18           HB2      ALA  18  16.809  -1.123   2.980
    5    HB1  ALA  18           HB3      ALA  18  15.220  -1.794   3.349

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ARG  19           H        ARG  19  14.178  -2.277   5.460
    2    HA   ARG  19           HA       ARG  19  13.466   0.364   6.168
    3    HB2  ARG  19           HB2      ARG  19  11.815  -1.416   5.583
    4    HB3  ARG  19           HB3      ARG  19  12.168  -2.205   7.123
    5    HG2  ARG  19           HG2      ARG  19  11.423  -0.223   8.357
    6    HG3  ARG  19           HG3      ARG  19  11.161   0.646   6.846
    7    HD2  ARG  19           HD2      ARG  19   9.032  -0.184   7.665
    8    HD3  ARG  19           HD3      ARG  19   9.466  -1.059   6.191
    9    HE   ARG  19           HE       ARG  19  10.448  -2.581   8.301
   10   HH21  ARG  19          HH11      ARG  19   9.225  -4.239   9.243
   11   HH22  ARG  19          HH12      ARG  19   7.505  -4.240   9.070
   12   HH11  ARG  19          HH21      ARG  19   7.434  -1.340   7.200
   13   HH12  ARG  19          HH22      ARG  19   6.491  -2.599   7.909

  No H/Q in entry =          13
  In of MODEL   82
    1    H    SER  20           H        SER  20  14.368  -2.447   8.135
    2    HA   SER  20           HA       SER  20  14.064  -1.347  10.669
    3    HB2  SER  20           HB2      SER  20  14.568  -3.663  10.555
    4    HB3  SER  20           HB3      SER  20  16.015  -3.380   9.591
    5    HG   SER  20           HG       SER  20  15.682  -2.347  12.206

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LEU  21           H        LEU  21  16.908  -1.244   8.536
    2    HA   LEU  21           HA       LEU  21  18.556   0.274  10.273
    3    HB2  LEU  21           HB2      LEU  21  18.543  -0.007   7.259
    4    HB3  LEU  21           HB3      LEU  21  19.780   0.877   8.147
    5    HG   LEU  21           HG       LEU  21  19.091  -2.023   8.697
    6   HD12  LEU  21          HD11      LEU  21  21.349  -2.383   7.496
    7   HD11  LEU  21          HD12      LEU  21  21.108  -0.767   6.833
    8   HD13  LEU  21          HD13      LEU  21  19.942  -2.043   6.487
    9   HD22  LEU  21          HD21      LEU  21  20.252  -1.321  10.590
   10   HD21  LEU  21          HD22      LEU  21  21.152  -0.082   9.725
   11   HD23  LEU  21          HD23      LEU  21  21.613  -1.768   9.568

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ALA  22           H        ALA  22  16.280   1.200   7.712
    2    HA   ALA  22           HA       ALA  22  16.773   3.966   7.720
    3    HB3  ALA  22           HB1      ALA  22  15.393   2.697   6.043
    4    HB2  ALA  22           HB2      ALA  22  14.661   4.200   6.605
    5    HB1  ALA  22           HB3      ALA  22  14.095   2.652   7.235

  No H/Q in entry =           5
  In of MODEL   82
    1    H    TYR  23           H        TYR  23  14.304   2.114   9.556
    2    HA   TYR  23           HA       TYR  23  13.303   4.339  10.999
    3    HB2  TYR  23           HB2      TYR  23  12.102   2.205  10.981
    4    HB3  TYR  23           HB3      TYR  23  13.445   1.418  11.810
    5    HD1  TYR  23           HD1      TYR  23  10.882   4.104  12.162
    6    HD2  TYR  23           HD2      TYR  23  13.653   1.506  14.167
    7    HE1  TYR  23           HE1      TYR  23   9.939   4.788  14.353
    8    HE2  TYR  23           HE2      TYR  23  12.710   2.189  16.356
    9    HH   TYR  23           HH       TYR  23   9.850   4.245  16.564

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ALA  24           H        ALA  24  15.984   2.107  11.644
    2    HA   ALA  24           HA       ALA  24  16.635   3.119  14.207
    3    HB1  ALA  24           HB1      ALA  24  18.020   1.348  14.048
    4    HB3  ALA  24           HB2      ALA  24  19.034   2.283  12.948
    5    HB2  ALA  24           HB3      ALA  24  17.756   1.252  12.307

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ALA  25           H        ALA  25  17.581   4.056  10.927
    2    HA   ALA  25           HA       ALA  25  19.495   6.022  11.570
    3    HB1  ALA  25           HB1      ALA  25  18.796   5.058   9.256
    4    HB3  ALA  25           HB2      ALA  25  19.271   6.753   9.346
    5    HB2  ALA  25           HB3      ALA  25  17.563   6.319   9.276

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LEU  26           H        LEU  26  15.977   6.195  11.204
    2    HA   LEU  26           HA       LEU  26  15.709   8.974  11.649
    3    HB2  LEU  26           HB2      LEU  26  13.868   7.708  10.721
    4    HB3  LEU  26           HB3      LEU  26  13.792   6.682  12.148
    5    HG   LEU  26           HG       LEU  26  13.154   8.633  13.524
    6   HD12  LEU  26          HD11      LEU  26  12.462  10.721  12.193
    7   HD11  LEU  26          HD12      LEU  26  13.454  10.080  10.886
    8   HD13  LEU  26          HD13      LEU  26  14.191  10.480  12.438
    9   HD21  LEU  26          HD21      LEU  26  11.486   8.289  11.012
   10   HD23  LEU  26          HD22      LEU  26  10.913   8.981  12.527
   11   HD22  LEU  26          HD23      LEU  26  11.391   7.287  12.461

  No H/Q in entry =          11
  In of MODEL   82
    1    H    LYS  27           H        LYS  27  15.641   6.198  13.848
    2    HA   LYS  27           HA       LYS  27  15.024   7.560  16.212
    3    HB2  LYS  27           HB2      LYS  27  15.090   5.085  15.953
    4    HB3  LYS  27           HB3      LYS  27  16.852   5.164  15.912
    5    HG2  LYS  27           HG2      LYS  27  16.885   6.155  18.159
    6    HG3  LYS  27           HG3      LYS  27  15.118   6.147  18.202
    7    HD2  LYS  27           HD2      LYS  27  15.129   3.680  17.971
    8    HD3  LYS  27           HD3      LYS  27  16.894   3.696  17.962
    9    HE2  LYS  27           HE2      LYS  27  16.910   4.690  20.216
   10    HE3  LYS  27           HE3      LYS  27  15.144   4.704  20.228
   11    HZ3  LYS  27           HZ1      LYS  27  15.960   2.766  21.384
   12    HZ2  LYS  27           HZ2      LYS  27  16.884   2.298  20.036
   13    HZ1  LYS  27           HZ3      LYS  27  15.187   2.278  19.954

  No H/Q in entry =          13
  In of MODEL   82
    1    H    GLN  28           H        GLN  28  18.151   7.020  14.625
    2    HA   GLN  28           HA       GLN  28  19.816   8.133  16.616
    3    HB2  GLN  28           HB2      GLN  28  20.111   8.090  13.601
    4    HB3  GLN  28           HB3      GLN  28  21.389   8.573  14.716
    5    HG2  GLN  28           HG2      GLN  28  19.997   5.881  14.756
    6    HG3  GLN  28           HG3      GLN  28  21.573   6.184  14.028
    7   HE21  GLN  28          HE21      GLN  28  20.338   4.844  16.729
    8   HE22  GLN  28          HE22      GLN  28  21.521   5.282  17.861

  No H/Q in entry =           8
  In of MODEL   82
    1    H    ALA  29           H        ALA  29  18.047   9.584  13.918
    2    HA   ALA  29           HA       ALA  29  19.009  12.219  14.166
    3    HB2  ALA  29           HB1      ALA  29  17.304  12.829  12.691
    4    HB1  ALA  29           HB2      ALA  29  16.175  11.641  13.344
    5    HB3  ALA  29           HB3      ALA  29  17.514  11.116  12.323

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LYS  30           H        LYS  30  16.253  10.585  15.687
    2    HA   LYS  30           HA       LYS  30  15.206  12.827  17.038
    3    HB2  LYS  30           HB2      LYS  30  15.133   9.886  17.748
    4    HB3  LYS  30           HB3      LYS  30  14.250  11.127  18.638
    5    HG2  LYS  30           HG2      LYS  30  13.118  11.793  16.517
    6    HG3  LYS  30           HG3      LYS  30  13.942  10.466  15.694
    7    HD2  LYS  30           HD2      LYS  30  12.890   8.848  17.225
    8    HD3  LYS  30           HD3      LYS  30  12.076  10.164  18.072
    9    HE2  LYS  30           HE2      LYS  30  10.902  10.776  15.976
   10    HE3  LYS  30           HE3      LYS  30  11.696   9.431  15.149
   11    HZ2  LYS  30           HZ1      LYS  30   9.392   8.993  16.027
   12    HZ1  LYS  30           HZ2      LYS  30  10.057   9.058  17.595
   13    HZ3  LYS  30           HZ3      LYS  30  10.583   7.878  16.488

  No H/Q in entry =          13
  In of MODEL   82
    1    H    GLN  31           H        GLN  31  17.895  10.695  17.783
    2    HA   GLN  31           HA       GLN  31  18.205  11.719  20.476
    3    HB2  GLN  31           HB2      GLN  31  20.251  10.172  18.877
    4    HB3  GLN  31           HB3      GLN  31  20.113  10.298  20.631
    5    HG2  GLN  31           HG2      GLN  31  17.613   9.311  19.861
    6    HG3  GLN  31           HG3      GLN  31  18.727   8.479  18.784
    7   HE21  GLN  31          HE21      GLN  31  17.197   7.317  21.061
    8   HE22  GLN  31          HE22      GLN  31  18.360   6.674  22.114

  No H/Q in entry =           8
  In of MODEL   82
    1    H    GLY  32           H        GLY  32  18.711  13.037  17.507
    2    HA3  GLY  32           HA2      GLY  32  19.669  15.094  16.990
    3    HA2  GLY  32           HA3      GLY  32  20.424  15.112  18.579

  No H/Q in entry =           3
  In of MODEL   82
    1    H    ASP  33           H        ASP  33  20.886  12.222  16.808
    2    HA   ASP  33           HA       ASP  33  23.703  12.933  16.344
    3    HB2  ASP  33           HB2      ASP  33  22.229  10.298  16.464
    4    HB3  ASP  33           HB3      ASP  33  23.914  10.436  15.971

  No H/Q in entry =           4
  In of MODEL   82
    1    H    PHE  34           H        PHE  34  23.207  14.246  14.459
    2    HA   PHE  34           HA       PHE  34  21.873  13.239  12.173
    3    HB2  PHE  34           HB2      PHE  34  23.976  15.402  12.401
    4    HB3  PHE  34           HB3      PHE  34  22.996  15.096  10.968
    5    HD1  PHE  34           HD1      PHE  34  23.217  17.039  13.878
    6    HD2  PHE  34           HD2      PHE  34  20.371  14.880  11.493
    7    HE1  PHE  34           HE1      PHE  34  21.381  18.414  14.820
    8    HE2  PHE  34           HE2      PHE  34  18.539  16.255  12.438
    9    HZ   PHE  34           HZ       PHE  34  19.048  18.023  14.097

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ALA  35           H        ALA  35  25.249  13.099  13.185
    2    HA   ALA  35           HA       ALA  35  26.368  12.288  10.731
    3    HB3  ALA  35           HB1      ALA  35  28.062  11.145  12.455
    4    HB2  ALA  35           HB2      ALA  35  27.183  12.161  13.598
    5    HB1  ALA  35           HB3      ALA  35  28.012  12.893  12.224

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ALA  36           H        ALA  36  25.276  10.323  13.499
    2    HA   ALA  36           HA       ALA  36  25.796   7.840  12.229
    3    HB2  ALA  36           HB1      ALA  36  25.373   7.092  14.306
    4    HB3  ALA  36           HB2      ALA  36  23.679   7.563  14.153
    5    HB1  ALA  36           HB3      ALA  36  24.863   8.712  14.775

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ALA  37           H        ALA  37  22.945   9.926  12.355
    2    HA   ALA  37           HA       ALA  37  21.115   8.128  11.181
    3    HB3  ALA  37           HB1      ALA  37  21.299  11.095  11.467
    4    HB1  ALA  37           HB2      ALA  37  20.001   9.999  11.940
    5    HB2  ALA  37           HB3      ALA  37  20.186  10.470  10.250

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LYS  38           H        LYS  38  23.181  10.616   9.699
    2    HA   LYS  38           HA       LYS  38  22.551  10.174   7.022
    3    HB2  LYS  38           HB2      LYS  38  24.336  11.760   8.466
    4    HB3  LYS  38           HB3      LYS  38  25.385  10.783   7.444
    5    HG2  LYS  38           HG2      LYS  38  24.212  11.533   5.445
    6    HG3  LYS  38           HG3      LYS  38  23.004  12.372   6.423
    7    HD2  LYS  38           HD2      LYS  38  24.574  13.995   7.173
    8    HD3  LYS  38           HD3      LYS  38  25.949  13.028   6.642
    9    HE2  LYS  38           HE2      LYS  38  25.567  14.890   5.086
   10    HE3  LYS  38           HE3      LYS  38  25.256  13.346   4.284
   11    HZ3  LYS  38           HZ1      LYS  38  23.053  13.759   4.151
   12    HZ2  LYS  38           HZ2      LYS  38  23.551  15.381   4.235
   13    HZ1  LYS  38           HZ3      LYS  38  22.987  14.592   5.629

  No H/Q in entry =          13
  In of MODEL   82
    1    H    ALA  39           H        ALA  39  25.086   8.617   8.985
    2    HA   ALA  39           HA       ALA  39  26.181   7.040   6.920
    3    HB2  ALA  39           HB1      ALA  39  26.103   6.082   9.765
    4    HB1  ALA  39           HB2      ALA  39  27.035   7.520   9.347
    5    HB3  ALA  39           HB3      ALA  39  27.411   5.974   8.587

  No H/Q in entry =           5
  In of MODEL   82
    1    H    MET  40           H        MET  40  23.575   6.390   9.216
    2    HA   MET  40           HA       MET  40  23.173   3.677   8.487
    3    HB2  MET  40           HB2      MET  40  21.325   5.696   9.773
    4    HB3  MET  40           HB3      MET  40  20.944   3.981   9.601
    5    HG2  MET  40           HG2      MET  40  23.478   4.963  10.943
    6    HG3  MET  40           HG3      MET  40  21.987   4.667  11.835
    7    HE3  MET  40           HE1      MET  40  21.478   1.025  12.018
    8    HE2  MET  40           HE2      MET  40  20.591   2.313  11.206
    9    HE1  MET  40           HE3      MET  40  21.325   2.615  12.780

  No H/Q in entry =           9
  In of MODEL   82
    1    H    MET  41           H        MET  41  21.715   6.706   7.292
    2    HA   MET  41           HA       MET  41  19.778   5.478   5.620
    3    HB2  MET  41           HB2      MET  41  21.220   8.090   5.103
    4    HB3  MET  41           HB3      MET  41  19.700   7.571   4.384
    5    HG2  MET  41           HG2      MET  41  18.955   7.376   6.935
    6    HG3  MET  41           HG3      MET  41  20.245   8.555   7.156
    7    HE2  MET  41           HE1      MET  41  19.666   9.827   3.816
    8    HE1  MET  41           HE2      MET  41  20.615  10.284   5.227
    9    HE3  MET  41           HE3      MET  41  19.326  11.342   4.659

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ASP  42           H        ASP  42  23.137   6.452   5.069
    2    HA   ASP  42           HA       ASP  42  23.239   5.974   2.312
    3    HB2  ASP  42           HB2      ASP  42  24.972   7.002   4.081
    4    HB3  ASP  42           HB3      ASP  42  25.655   5.386   3.958

  No H/Q in entry =           4
  In of MODEL   82
    1    H    GLN  43           H        GLN  43  23.994   3.836   5.038
    2    HA   GLN  43           HA       GLN  43  24.695   1.586   3.461
    3    HB2  GLN  43           HB2      GLN  43  23.666   1.759   6.303
    4    HB3  GLN  43           HB3      GLN  43  24.269   0.278   5.551
    5    HG2  GLN  43           HG2      GLN  43  26.414   1.521   5.040
    6    HG3  GLN  43           HG3      GLN  43  25.809   2.841   6.036
    7   HE21  GLN  43          HE21      GLN  43  28.056   1.905   7.077
    8   HE22  GLN  43          HE22      GLN  43  27.797   0.821   8.356

  No H/Q in entry =           8
  In of MODEL   82
    1    H    SER  44           H        SER  44  21.620   2.674   4.840
    2    HA   SER  44           HA       SER  44  20.087   0.406   4.170
    3    HB2  SER  44           HB2      SER  44  19.605   2.930   5.310
    4    HB3  SER  44           HB3      SER  44  18.573   2.868   3.884
    5    HG   SER  44           HG       SER  44  17.492   1.911   5.608

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ARG  45           H        ARG  45  20.786   3.378   2.360
    2    HA   ARG  45           HA       ARG  45  19.271   2.864   0.055
    3    HB2  ARG  45           HB2      ARG  45  20.381   5.018   0.636
    4    HB3  ARG  45           HB3      ARG  45  21.937   4.287   0.253
    5    HG2  ARG  45           HG2      ARG  45  21.162   3.865  -2.061
    6    HG3  ARG  45           HG3      ARG  45  19.618   4.619  -1.677
    7    HD2  ARG  45           HD2      ARG  45  20.835   6.736  -1.096
    8    HD3  ARG  45           HD3      ARG  45  22.344   5.984  -1.662
    9    HE   ARG  45           HE       ARG  45  20.420   5.713  -3.699
   10   HH21  ARG  45          HH11      ARG  45  20.393   7.078  -5.465
   11   HH22  ARG  45          HH12      ARG  45  21.126   8.640  -5.363
   12   HH11  ARG  45          HH21      ARG  45  22.110   8.241  -2.076
   13   HH12  ARG  45          HH22      ARG  45  22.097   9.298  -3.441

  No H/Q in entry =          13
  In of MODEL   82
    1    H    MET  46           H        MET  46  22.647   2.042   0.807
    2    HA   MET  46           HA       MET  46  23.273   0.853  -1.674
    3    HB2  MET  46           HB2      MET  46  24.383   0.560   1.117
    4    HB3  MET  46           HB3      MET  46  25.049  -0.342  -0.249
    5    HG2  MET  46           HG2      MET  46  25.484   1.748  -1.452
    6    HG3  MET  46           HG3      MET  46  24.748   2.676  -0.153
    7    HE3  MET  46           HE1      MET  46  27.422  -0.499   0.265
    8    HE2  MET  46           HE2      MET  46  28.731   0.519  -0.327
    9    HE1  MET  46           HE3      MET  46  27.289   0.290  -1.314

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ALA  47           H        ALA  47  21.908  -0.494   1.304
    2    HA   ALA  47           HA       ALA  47  21.894  -3.209   0.507
    3    HB2  ALA  47           HB1      ALA  47  21.508  -2.749   2.810
    4    HB3  ALA  47           HB2      ALA  47  19.980  -3.376   2.192
    5    HB1  ALA  47           HB3      ALA  47  20.184  -1.641   2.447

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LEU  48           H        LEU  48  19.504  -0.617   0.143
    2    HA   LEU  48           HA       LEU  48  17.482  -2.183  -1.105
    3    HB2  LEU  48           HB2      LEU  48  18.094   0.780  -1.226
    4    HB3  LEU  48           HB3      LEU  48  16.634   0.047  -1.892
    5    HG   LEU  48           HG       LEU  48  17.490  -0.236   0.998
    6   HD13  LEU  48          HD11      LEU  48  17.040   2.058   0.805
    7   HD12  LEU  48          HD12      LEU  48  15.490   1.390   1.316
    8   HD11  LEU  48          HD13      LEU  48  15.756   1.812  -0.376
    9   HD22  LEU  48          HD21      LEU  48  15.986  -1.973   0.621
   10   HD21  LEU  48          HD22      LEU  48  15.100  -1.085  -0.620
   11   HD23  LEU  48          HD23      LEU  48  14.881  -0.680   1.083

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ASN  49           H        ASN  49  20.143  -0.220  -2.340
    2    HA   ASN  49           HA       ASN  49  19.493  -0.319  -5.063
    3    HB2  ASN  49           HB2      ASN  49  21.156   1.216  -4.118
    4    HB3  ASN  49           HB3      ASN  49  22.210  -0.137  -3.728
    5   HD21  ASN  49          HD21      ASN  49  23.935   0.425  -5.134
    6   HD22  ASN  49          HD22      ASN  49  23.777   0.465  -6.823

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLU  50           H        GLU  50  21.508  -2.481  -3.095
    2    HA   GLU  50           HA       GLU  50  22.234  -4.232  -5.217
    3    HB2  GLU  50           HB2      GLU  50  23.431  -4.185  -3.051
    4    HB3  GLU  50           HB3      GLU  50  21.998  -4.831  -2.253
    5    HG2  GLU  50           HG2      GLU  50  22.115  -6.866  -3.607
    6    HG3  GLU  50           HG3      GLU  50  23.482  -6.216  -4.509

  No H/Q in entry =           6
  In of MODEL   82
    1    H    ALA  51           H        ALA  51  19.577  -4.198  -2.891
    2    HA   ALA  51           HA       ALA  51  18.446  -6.689  -3.641
    3    HB3  ALA  51           HB1      ALA  51  16.846  -6.201  -2.087
    4    HB1  ALA  51           HB2      ALA  51  16.610  -4.559  -2.690
    5    HB2  ALA  51           HB3      ALA  51  17.975  -4.924  -1.633

  No H/Q in entry =           5
  In of MODEL   82
    1    H    HIS  52           H        HIS  52  17.813  -3.352  -4.685
    2    HA   HIS  52           HA       HIS  52  15.707  -3.913  -6.483
    3    HB2  HIS  52           HB2      HIS  52  16.273  -1.637  -5.714
    4    HB3  HIS  52           HB3      HIS  52  17.783  -1.713  -6.622
    5    HD1  HIS  52           HD1      HIS  52  17.506  -2.027  -9.294
    6    HD2  HIS  52           HD2      HIS  52  14.071  -0.869  -7.235
    7    HE1  HIS  52           HE1      HIS  52  15.890  -1.142 -11.033
    8    HE2  HIS  52           HE2      HIS  52  13.792  -0.430  -9.793

  No H/Q in entry =           8
  In of MODEL   82
    1    H    LEU  53           H        LEU  53  19.225  -3.871  -6.916
    2    HA   LEU  53           HA       LEU  53  19.286  -4.193  -9.716
    3    HB2  LEU  53           HB2      LEU  53  21.229  -4.917  -7.539
    4    HB3  LEU  53           HB3      LEU  53  21.551  -5.312  -9.225
    5    HG   LEU  53           HG       LEU  53  20.839  -2.504  -8.322
    6   HD11  LEU  53          HD11      LEU  53  22.912  -3.300  -7.189
    7   HD13  LEU  53          HD12      LEU  53  23.230  -2.006  -8.345
    8   HD12  LEU  53          HD13      LEU  53  23.598  -3.675  -8.767
    9   HD23  LEU  53          HD21      LEU  53  22.262  -2.059 -10.477
   10   HD22  LEU  53          HD22      LEU  53  20.594  -2.594 -10.661
   11   HD21  LEU  53          HD23      LEU  53  21.908  -3.737 -10.870

  No H/Q in entry =          11
  In of MODEL   82
    1    H    VAL  54           H        VAL  54  19.208  -6.574  -7.083
    2    HA   VAL  54           HA       VAL  54  19.364  -8.871  -8.736
    3    HB   VAL  54           HB       VAL  54  18.204  -8.456  -5.970
    4   HG12  VAL  54          HG11      VAL  54  18.566 -11.069  -5.958
    5   HG11  VAL  54          HG12      VAL  54  18.378 -10.908  -7.704
    6   HG13  VAL  54          HG13      VAL  54  17.082 -10.393  -6.627
    7   HG22  VAL  54          HG21      VAL  54  20.516  -8.211  -5.748
    8   HG21  VAL  54          HG22      VAL  54  20.869  -9.302  -7.086
    9   HG23  VAL  54          HG23      VAL  54  20.349  -9.952  -5.532

  No H/Q in entry =           9
  In of MODEL   82
    1    H    GLN  55           H        GLN  55  16.609  -7.004  -7.458
    2    HA   GLN  55           HA       GLN  55  14.612  -8.701  -8.527
    3    HB2  GLN  55           HB2      GLN  55  13.842  -7.181  -6.904
    4    HB3  GLN  55           HB3      GLN  55  14.614  -5.804  -7.685
    5    HG2  GLN  55           HG2      GLN  55  12.885  -5.509  -9.175
    6    HG3  GLN  55           HG3      GLN  55  12.588  -7.235  -9.340
    7   HE21  GLN  55          HE21      GLN  55  10.590  -7.811  -8.533
    8   HE22  GLN  55          HE22      GLN  55   9.806  -7.064  -7.226

  No H/Q in entry =           8
  In of MODEL   82
    1    H    THR  56           H        THR  56  16.309  -5.880  -9.895
    2    HA   THR  56           HA       THR  56  14.865  -5.546 -12.244
    3    HB   THR  56           HB       THR  56  17.883  -5.412 -12.077
    4    HG1  THR  56           HG1      THR  56  15.866  -3.840 -10.983
    5   HG23  THR  56          HG21      THR  56  17.772  -4.018 -13.934
    6   HG22  THR  56          HG22      THR  56  16.105  -3.547 -13.607
    7   HG21  THR  56          HG23      THR  56  16.455  -5.142 -14.277

  No H/Q in entry =           7
  In of MODEL   82
    1    H    LYS  57           H        LYS  57  17.549  -7.801 -11.627
    2    HA   LYS  57           HA       LYS  57  17.568  -9.004 -14.201
    3    HB2  LYS  57           HB2      LYS  57  19.379  -9.243 -12.508
    4    HB3  LYS  57           HB3      LYS  57  18.291 -10.182 -11.496
    5    HG2  LYS  57           HG2      LYS  57  19.690 -11.733 -12.690
    6    HG3  LYS  57           HG3      LYS  57  18.076 -11.838 -13.381
    7    HD2  LYS  57           HD2      LYS  57  18.703 -10.597 -15.311
    8    HD3  LYS  57           HD3      LYS  57  20.202 -10.043 -14.567
    9    HE2  LYS  57           HE2      LYS  57  19.590 -12.947 -15.215
   10    HE3  LYS  57           HE3      LYS  57  20.563 -11.894 -16.240
   11    HZ2  LYS  57           HZ1      LYS  57  21.227 -13.147 -13.719
   12    HZ1  LYS  57           HZ2      LYS  57  21.731 -11.533 -13.874
   13    HZ3  LYS  57           HZ3      LYS  57  22.231 -12.693 -15.008

  No H/Q in entry =          13
  In of MODEL   82
    1    H    LEU  58           H        LEU  58  15.798  -9.689 -11.223
    2    HA   LEU  58           HA       LEU  58  14.613 -12.084 -12.149
    3    HB2  LEU  58           HB2      LEU  58  13.789 -10.184  -9.960
    4    HB3  LEU  58           HB3      LEU  58  13.006 -11.735 -10.271
    5    HG   LEU  58           HG       LEU  58  15.975 -11.409  -9.718
    6   HD11  LEU  58          HD11      LEU  58  13.611 -11.857  -7.923
    7   HD13  LEU  58          HD12      LEU  58  15.050 -10.871  -7.664
    8   HD12  LEU  58          HD13      LEU  58  15.149 -12.625  -7.524
    9   HD22  LEU  58          HD21      LEU  58  15.889 -13.476 -10.739
   10   HD21  LEU  58          HD22      LEU  58  14.178 -13.711 -10.377
   11   HD23  LEU  58          HD23      LEU  58  15.392 -13.989  -9.127

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  59           H        ILE  59  13.890  -8.760 -12.843
    2    HA   ILE  59           HA       ILE  59  11.184  -9.453 -13.779
    3    HB   ILE  59           HB       ILE  59  11.950  -7.157 -12.580
    4   HG12  ILE  59          HG12      ILE  59  10.052  -7.066 -14.936
    5   HG13  ILE  59          HG13      ILE  59   9.637  -7.839 -13.428
    6   HG23  ILE  59          HG21      ILE  59  12.521  -5.433 -14.081
    7   HG22  ILE  59          HG22      ILE  59  12.018  -6.347 -15.485
    8   HG21  ILE  59          HG23      ILE  59  13.507  -6.762 -14.641
    9   HD12  ILE  59          HD11      ILE  59  10.447  -4.950 -13.764
   10   HD11  ILE  59          HD12      ILE  59  10.094  -5.721 -12.218
   11   HD13  ILE  59          HD13      ILE  59   8.817  -5.533 -13.420

  No H/Q in entry =          11
  In of MODEL   82
    1    H    GLU  60           H        GLU  60  14.374  -8.556 -15.042
    2    HA   GLU  60           HA       GLU  60  13.587  -8.177 -17.751
    3    HB2  GLU  60           HB2      GLU  60  15.755  -7.406 -16.903
    4    HB3  GLU  60           HB3      GLU  60  16.244  -9.071 -16.596
    5    HG2  GLU  60           HG2      GLU  60  16.072  -9.580 -19.001
    6    HG3  GLU  60           HG3      GLU  60  15.555  -7.924 -19.320

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLY  61           H        GLY  61  14.610 -11.037 -15.927
    2    HA3  GLY  61           HA2      GLY  61  14.093 -12.701 -18.323
    3    HA2  GLY  61           HA3      GLY  61  15.133 -13.161 -16.979

  No H/Q in entry =           3
  In of MODEL   82
    1    H    ASP  62           H        ASP  62  11.990 -11.662 -16.608
    2    HA   ASP  62           HA       ASP  62  11.021 -13.358 -14.676
    3    HB2  ASP  62           HB2      ASP  62   8.772 -12.539 -15.349
    4    HB3  ASP  62           HB3      ASP  62   9.957 -11.250 -15.169

  No H/Q in entry =           4
  In of MODEL   82
    1    H    ALA  63           H        ALA  63  10.633 -15.518 -14.678
    2    HA   ALA  63           HA       ALA  63  10.241 -16.971 -17.173
    3    HB2  ALA  63           HB1      ALA  63  10.262 -17.845 -14.274
    4    HB1  ALA  63           HB2      ALA  63  11.567 -18.024 -15.445
    5    HB3  ALA  63           HB3      ALA  63  10.079 -18.952 -15.634

  No H/Q in entry =           5
  In of MODEL   82
    1    H    GLY  64           H        GLY  64   8.480 -18.457 -14.801
    2    HA3  GLY  64           HA2      GLY  64   6.176 -18.255 -14.174
    3    HA2  GLY  64           HA3      GLY  64   5.917 -17.239 -15.585

  No H/Q in entry =           3
  In of MODEL   82
    1    H    GLU  65           H        GLU  65   4.317 -19.505 -14.896
    2    HA   GLU  65           HA       GLU  65   5.098 -21.817 -16.326
    3    HB2  GLU  65           HB2      GLU  65   2.397 -20.854 -15.401
    4    HB3  GLU  65           HB3      GLU  65   2.658 -22.419 -16.169
    5    HG2  GLU  65           HG2      GLU  65   4.254 -23.045 -14.426
    6    HG3  GLU  65           HG3      GLU  65   4.090 -21.459 -13.675

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLY  66           H        GLY  66   3.147 -19.063 -17.199
    2    HA3  GLY  66           HA2      GLY  66   2.459 -20.018 -19.829
    3    HA2  GLY  66           HA3      GLY  66   2.075 -18.451 -19.146

  No H/Q in entry =           3
  In of MODEL   82
    1    H    LYS  67           H        LYS  67   2.866 -18.824 -21.775
    2    HA   LYS  67           HA       LYS  67   5.587 -18.512 -22.305
    3    HB2  LYS  67           HB2      LYS  67   4.551 -17.358 -24.460
    4    HB3  LYS  67           HB3      LYS  67   4.404 -19.096 -24.171
    5    HG2  LYS  67           HG2      LYS  67   2.193 -18.889 -23.339
    6    HG3  LYS  67           HG3      LYS  67   2.353 -17.148 -23.118
    7    HD2  LYS  67           HD2      LYS  67   0.996 -18.010 -25.161
    8    HD3  LYS  67           HD3      LYS  67   2.167 -16.715 -25.422
    9    HE2  LYS  67           HE2      LYS  67   3.786 -18.217 -26.317
   10    HE3  LYS  67           HE3      LYS  67   2.899 -19.630 -25.746
   11    HZ2  LYS  67           HZ1      LYS  67   2.732 -18.749 -28.226
   12    HZ1  LYS  67           HZ2      LYS  67   1.482 -17.828 -27.540
   13    HZ3  LYS  67           HZ3      LYS  67   1.441 -19.523 -27.445

  No H/Q in entry =          13
  In of MODEL   82
    1    H    MET  68           H        MET  68   3.102 -16.063 -21.922
    2    HA   MET  68           HA       MET  68   5.077 -13.896 -22.017
    3    HB2  MET  68           HB2      MET  68   2.072 -13.961 -22.230
    4    HB3  MET  68           HB3      MET  68   2.993 -12.462 -22.103
    5    HG2  MET  68           HG2      MET  68   4.250 -13.019 -24.121
    6    HG3  MET  68           HG3      MET  68   3.433 -14.578 -24.228
    7    HE2  MET  68           HE1      MET  68   1.926 -10.390 -25.043
    8    HE1  MET  68           HE2      MET  68   3.320 -10.930 -24.110
    9    HE3  MET  68           HE3      MET  68   1.724 -10.904 -23.362

  No H/Q in entry =           9
  In of MODEL   82
    1    H    LYS  69           H        LYS  69   3.613 -15.735 -19.616
    2    HA   LYS  69           HA       LYS  69   3.065 -13.615 -17.753
    3    HB2  LYS  69           HB2      LYS  69   3.096 -16.616 -17.492
    4    HB3  LYS  69           HB3      LYS  69   2.739 -15.542 -16.137
    5    HG2  LYS  69           HG2      LYS  69   0.930 -14.486 -17.457
    6    HG3  LYS  69           HG3      LYS  69   1.267 -15.593 -18.787
    7    HD2  LYS  69           HD2      LYS  69   0.726 -17.511 -17.341
    8    HD3  LYS  69           HD3      LYS  69   0.402 -16.412 -15.998
    9    HE2  LYS  69           HE2      LYS  69  -1.391 -15.335 -17.311
   10    HE3  LYS  69           HE3      LYS  69  -1.074 -16.440 -18.646
   11    HZ2  LYS  69           HZ1      LYS  69  -2.913 -16.966 -16.897
   12    HZ1  LYS  69           HZ2      LYS  69  -1.605 -17.555 -15.988
   13    HZ3  LYS  69           HZ3      LYS  69  -1.942 -18.208 -17.520

  No H/Q in entry =          13
  In of MODEL   82
    1    H    VAL  70           H        VAL  70   3.917 -13.974 -15.360
    2    HA   VAL  70           HA       VAL  70   6.863 -14.285 -15.405
    3    HB   VAL  70           HB       VAL  70   7.028 -12.322 -13.919
    4   HG12  VAL  70          HG11      VAL  70   5.420 -11.333 -16.238
    5   HG11  VAL  70          HG12      VAL  70   6.864 -12.286 -16.582
    6   HG13  VAL  70          HG13      VAL  70   6.994 -10.791 -15.657
    7   HG22  VAL  70          HG21      VAL  70   4.808 -12.424 -12.869
    8   HG21  VAL  70          HG22      VAL  70   4.040 -12.110 -14.424
    9   HG23  VAL  70          HG23      VAL  70   5.005 -10.854 -13.649

  No H/Q in entry =           9
  In of MODEL   82
    1    H    SER  71           H        SER  71   7.762 -14.567 -13.205
    2    HA   SER  71           HA       SER  71   6.508 -16.646 -11.759
    3    HB2  SER  71           HB2      SER  71   8.945 -16.260 -11.718
    4    HB3  SER  71           HB3      SER  71   8.689 -14.742 -10.859
    5    HG   SER  71           HG       SER  71   7.443 -16.972  -9.792

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LEU  72           H        LEU  72   5.184 -16.622  -9.972
    2    HA   LEU  72           HA       LEU  72   3.599 -14.332  -9.535
    3    HB2  LEU  72           HB2      LEU  72   3.926 -16.880  -7.959
    4    HB3  LEU  72           HB3      LEU  72   2.739 -15.640  -7.560
    5    HG   LEU  72           HG       LEU  72   2.915 -16.938 -10.299
    6   HD11  LEU  72          HD11      LEU  72   1.309 -17.684  -7.847
    7   HD13  LEU  72          HD12      LEU  72   2.361 -18.719  -8.810
    8   HD12  LEU  72          HD13      LEU  72   0.824 -18.162  -9.474
    9   HD22  LEU  72          HD21      LEU  72   1.658 -14.972 -10.553
   10   HD21  LEU  72          HD22      LEU  72   0.989 -15.056  -8.931
   11   HD23  LEU  72          HD23      LEU  72   0.406 -16.150 -10.181

  No H/Q in entry =          11
  In of MODEL   82
    1    H    VAL  73           H        VAL  73   6.277 -15.723  -7.757
    2    HA   VAL  73           HA       VAL  73   6.191 -14.185  -5.429
    3    HB   VAL  73           HB       VAL  73   8.345 -14.999  -4.970
    4   HG12  VAL  73          HG11      VAL  73   7.238 -17.016  -6.936
    5   HG11  VAL  73          HG12      VAL  73   6.525 -16.733  -5.348
    6   HG13  VAL  73          HG13      VAL  73   8.178 -17.333  -5.478
    7   HG22  VAL  73          HG21      VAL  73   9.601 -14.191  -6.834
    8   HG21  VAL  73          HG22      VAL  73   8.648 -15.138  -7.977
    9   HG23  VAL  73          HG23      VAL  73   9.764 -15.947  -6.877

  No H/Q in entry =           9
  In of MODEL   82
    1    H    LEU  74           H        LEU  74   7.169 -13.284  -8.607
    2    HA   LEU  74           HA       LEU  74   9.084 -11.304  -8.118
    3    HB2  LEU  74           HB2      LEU  74   8.648 -12.059 -10.354
    4    HB3  LEU  74           HB3      LEU  74   6.969 -11.533 -10.257
    5    HG   LEU  74           HG       LEU  74   7.723  -9.185 -10.038
    6   HD13  LEU  74          HD11      LEU  74   9.852  -9.338  -9.000
    7   HD12  LEU  74          HD12      LEU  74  10.210  -8.834 -10.650
    8   HD11  LEU  74          HD13      LEU  74  10.433 -10.516 -10.174
    9   HD21  LEU  74          HD21      LEU  74   7.472 -10.603 -12.257
   10   HD23  LEU  74          HD22      LEU  74   9.186 -10.270 -12.366
   11   HD22  LEU  74          HD23      LEU  74   8.053  -8.939 -12.301

  No H/Q in entry =          11
  In of MODEL   82
    1    H    VAL  75           H        VAL  75   5.583 -10.974  -8.475
    2    HA   VAL  75           HA       VAL  75   5.444  -8.218  -7.895
    3    HB   VAL  75           HB       VAL  75   3.389 -10.395  -7.511
    4   HG13  VAL  75          HG11      VAL  75   2.884  -8.485  -6.025
    5   HG12  VAL  75          HG12      VAL  75   1.782  -8.480  -7.396
    6   HG11  VAL  75          HG13      VAL  75   3.139  -7.366  -7.361
    7   HG21  VAL  75          HG21      VAL  75   4.326  -9.747  -9.837
    8   HG23  VAL  75          HG22      VAL  75   3.508  -8.205  -9.593
    9   HG22  VAL  75          HG23      VAL  75   2.575  -9.701  -9.637

  No H/Q in entry =           9
  In of MODEL   82
    1    H    GLU  76           H        GLU  76   5.232 -11.093  -5.779
    2    HA   GLU  76           HA       GLU  76   4.739  -9.733  -3.361
    3    HB2  GLU  76           HB2      GLU  76   4.597 -12.199  -3.578
    4    HB3  GLU  76           HB3      GLU  76   6.331 -12.279  -3.835
    5    HG2  GLU  76           HG2      GLU  76   5.924 -12.858  -1.532
    6    HG3  GLU  76           HG3      GLU  76   6.648 -11.261  -1.532

  No H/Q in entry =           6
  In of MODEL   82
    1    H    ALA  77           H        ALA  77   7.814 -10.598  -4.918
    2    HA   ALA  77           HA       ALA  77   9.485  -9.523  -2.903
    3    HB2  ALA  77           HB1      ALA  77  11.265  -9.772  -4.446
    4    HB3  ALA  77           HB2      ALA  77  10.189  -9.612  -5.834
    5    HB1  ALA  77           HB3      ALA  77  10.134 -11.068  -4.840

  No H/Q in entry =           5
  In of MODEL   82
    1    H    GLN  78           H        GLN  78   8.075  -8.135  -5.823
    2    HA   GLN  78           HA       GLN  78   9.390  -5.635  -5.723
    3    HB2  GLN  78           HB2      GLN  78   8.110  -6.575  -7.679
    4    HB3  GLN  78           HB3      GLN  78   6.621  -6.215  -6.807
    5    HG2  GLN  78           HG2      GLN  78   7.238  -3.836  -6.722
    6    HG3  GLN  78           HG3      GLN  78   8.733  -4.186  -7.587
    7   HE21  GLN  78          HE21      GLN  78   6.816  -2.394  -8.706
    8   HE22  GLN  78          HE22      GLN  78   6.132  -3.123 -10.077

  No H/Q in entry =           8
  In of MODEL   82
    1    H    LEU  79           H        LEU  79   6.386  -6.814  -4.295
    2    HA   LEU  79           HA       LEU  79   5.355  -4.419  -3.293
    3    HB2  LEU  79           HB2      LEU  79   4.071  -6.489  -3.234
    4    HB3  LEU  79           HB3      LEU  79   5.224  -7.209  -2.115
    5    HG   LEU  79           HG       LEU  79   4.645  -5.571  -0.394
    6   HD13  LEU  79          HD11      LEU  79   4.152  -3.566  -1.450
    7   HD12  LEU  79          HD12      LEU  79   2.534  -4.114  -1.013
    8   HD11  LEU  79          HD13      LEU  79   3.120  -4.332  -2.659
    9   HD23  LEU  79          HD21      LEU  79   2.066  -6.100  -0.307
   10   HD22  LEU  79          HD22      LEU  79   3.224  -7.423  -0.193
   11   HD21  LEU  79          HD23      LEU  79   2.409  -7.101  -1.720

  No H/Q in entry =          11
  In of MODEL   82
    1    H    HIS  80           H        HIS  80   7.568  -6.718  -1.700
    2    HA   HIS  80           HA       HIS  80   7.829  -5.166   0.665
    3    HB2  HIS  80           HB2      HIS  80   9.204  -7.513  -0.525
    4    HB3  HIS  80           HB3      HIS  80  10.099  -6.600   0.692
    5    HD1  HIS  80           HD1      HIS  80   9.613  -7.237   3.035
    6    HD2  HIS  80           HD2      HIS  80   6.414  -8.140   0.519
    7    HE1  HIS  80           HE1      HIS  80   7.854  -8.362   4.483
    8    HE2  HIS  80           HE2      HIS  80   5.898  -8.916   2.957

  No H/Q in entry =           8
  In of MODEL   82
    1    H    LEU  81           H        LEU  81   9.845  -5.421  -2.242
    2    HA   LEU  81           HA       LEU  81  11.862  -3.648  -1.364
    3    HB2  LEU  81           HB2      LEU  81  10.959  -4.461  -4.127
    4    HB3  LEU  81           HB3      LEU  81  12.364  -3.434  -3.836
    5    HG   LEU  81           HG       LEU  81  12.006  -6.158  -2.556
    6   HD12  LEU  81          HD11      LEU  81  13.835  -6.763  -4.300
    7   HD11  LEU  81          HD12      LEU  81  13.251  -5.349  -5.177
    8   HD13  LEU  81          HD13      LEU  81  12.158  -6.688  -4.837
    9   HD23  LEU  81          HD21      LEU  81  14.630  -5.806  -2.537
   10   HD22  LEU  81          HD22      LEU  81  13.634  -5.056  -1.291
   11   HD21  LEU  81          HD23      LEU  81  14.203  -4.099  -2.659

  No H/Q in entry =          11
  In of MODEL   82
    1    H    MET  82           H        MET  82   8.935  -3.058  -3.309
    2    HA   MET  82           HA       MET  82   9.439  -0.326  -3.816
    3    HB2  MET  82           HB2      MET  82   6.901  -1.955  -3.692
    4    HB3  MET  82           HB3      MET  82   6.878  -0.231  -4.061
    5    HG2  MET  82           HG2      MET  82   8.510  -2.287  -5.587
    6    HG3  MET  82           HG3      MET  82   6.936  -1.687  -6.105
    7    HE3  MET  82           HE1      MET  82   7.340   1.771  -7.285
    8    HE2  MET  82           HE2      MET  82   6.965   1.544  -5.579
    9    HE1  MET  82           HE3      MET  82   6.318   0.422  -6.772

  No H/Q in entry =           9
  In of MODEL   82
    1    H    THR  83           H        THR  83   7.662  -1.942  -1.211
    2    HA   THR  83           HA       THR  83   6.777   0.398   0.108
    3    HB   THR  83           HB       THR  83   6.659  -1.173   2.129
    4    HG1  THR  83           HG1      THR  83   7.442  -3.113   1.907
    5   HG22  THR  83          HG21      THR  83   5.030  -2.764   0.662
    6   HG21  THR  83          HG22      THR  83   5.242  -1.436  -0.473
    7   HG23  THR  83          HG23      THR  83   4.593  -1.125   1.137

  No H/Q in entry =           7
  In of MODEL   82
    1    H    SER  84           H        SER  84   9.627  -1.660   0.641
    2    HA   SER  84           HA       SER  84  10.662  -0.210   2.828
    3    HB2  SER  84           HB2      SER  84  11.944  -2.042   0.811
    4    HB3  SER  84           HB3      SER  84  12.878  -1.272   2.093
    5    HG   SER  84           HG       SER  84  10.625  -2.991   2.351

  No H/Q in entry =           5
  In of MODEL   82
    1    H    MET  85           H        MET  85  11.420   0.052  -0.659
    2    HA   MET  85           HA       MET  85  13.392   2.043  -0.408
    3    HB2  MET  85           HB2      MET  85  13.007   0.745  -2.471
    4    HB3  MET  85           HB3      MET  85  11.480   1.596  -2.709
    5    HG2  MET  85           HG2      MET  85  12.693   3.747  -2.808
    6    HG3  MET  85           HG3      MET  85  14.216   2.894  -2.578
    7    HE2  MET  85           HE1      MET  85  11.666   3.276  -6.323
    8    HE1  MET  85           HE2      MET  85  11.682   4.258  -4.862
    9    HE3  MET  85           HE3      MET  85  10.928   2.669  -4.833

  No H/Q in entry =           9
  In of MODEL   82
    1    H    LEU  86           H        LEU  86   9.899   2.331  -0.926
    2    HA   LEU  86           HA       LEU  86   9.800   5.143  -1.116
    3    HB2  LEU  86           HB2      LEU  86   7.978   3.458  -1.692
    4    HB3  LEU  86           HB3      LEU  86   7.645   3.369   0.038
    5    HG   LEU  86           HG       LEU  86   7.452   5.927  -0.022
    6   HD11  LEU  86          HD11      LEU  86   8.240   5.494  -2.721
    7   HD13  LEU  86          HD12      LEU  86   7.783   7.018  -1.965
    8   HD12  LEU  86          HD13      LEU  86   6.561   6.037  -2.771
    9   HD23  LEU  86          HD21      LEU  86   5.340   4.543  -1.686
   10   HD22  LEU  86          HD22      LEU  86   5.131   5.804  -0.474
   11   HD21  LEU  86          HD23      LEU  86   5.550   4.166   0.025

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ALA  87           H        ALA  87   9.355   2.966   1.635
    2    HA   ALA  87           HA       ALA  87   8.777   4.878   3.598
    3    HB1  ALA  87           HB1      ALA  87   9.620   2.068   3.521
    4    HB3  ALA  87           HB2      ALA  87   8.483   2.868   4.602
    5    HB2  ALA  87           HB3      ALA  87  10.210   2.922   4.950

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ARG  88           H        ARG  88  11.881   3.490   2.628
    2    HA   ARG  88           HA       ARG  88  13.469   4.892   4.461
    3    HB2  ARG  88           HB2      ARG  88  14.165   2.924   3.064
    4    HB3  ARG  88           HB3      ARG  88  14.307   4.015   1.688
    5    HG2  ARG  88           HG2      ARG  88  15.759   5.352   3.635
    6    HG3  ARG  88           HG3      ARG  88  16.100   3.668   4.019
    7    HD2  ARG  88           HD2      ARG  88  17.375   3.383   2.176
    8    HD3  ARG  88           HD3      ARG  88  16.229   4.237   1.138
    9    HE   ARG  88           HE       ARG  88  18.608   5.333   2.188
   10   HH21  ARG  88          HH11      ARG  88  18.926   7.556   1.988
   11   HH22  ARG  88          HH12      ARG  88  17.562   8.610   1.839
   12   HH11  ARG  88          HH21      ARG  88  15.260   6.044   1.900
   13   HH12  ARG  88          HH22      ARG  88  15.485   7.751   1.765

  No H/Q in entry =          13
  In of MODEL   82
    1    H    GLU  89           H        GLU  89  12.492   5.770   1.133
    2    HA   GLU  89           HA       GLU  89  14.009   8.148   0.974
    3    HB2  GLU  89           HB2      GLU  89  12.882   7.088  -0.974
    4    HB3  GLU  89           HB3      GLU  89  11.330   7.612  -0.321
    5    HG2  GLU  89           HG2      GLU  89  12.002   9.957  -0.488
    6    HG3  GLU  89           HG3      GLU  89  13.613   9.485  -1.020

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LEU  90           H        LEU  90  10.684   7.600   2.098
    2    HA   LEU  90           HA       LEU  90  10.133  10.328   2.665
    3    HB2  LEU  90           HB2      LEU  90   8.969   7.743   3.696
    4    HB3  LEU  90           HB3      LEU  90   8.317   9.331   4.114
    5    HG   LEU  90           HG       LEU  90   8.753   8.449   1.248
    6   HD12  LEU  90          HD11      LEU  90   6.223   8.089   1.306
    7   HD11  LEU  90          HD12      LEU  90   6.374   8.085   3.063
    8   HD13  LEU  90          HD13      LEU  90   7.210   6.863   2.103
    9   HD22  LEU  90          HD21      LEU  90   8.430  10.753   1.168
   10   HD21  LEU  90          HD22      LEU  90   7.440  10.777   2.626
   11   HD23  LEU  90          HD23      LEU  90   6.753  10.209   1.104

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  91           H        ILE  91  11.426   7.668   4.596
    2    HA   ILE  91           HA       ILE  91  11.544   9.041   7.061
    3    HB   ILE  91           HB       ILE  91  13.130   6.719   5.947
    4   HG12  ILE  91          HG12      ILE  91  11.107   6.867   8.202
    5   HG13  ILE  91          HG13      ILE  91  10.643   6.576   6.526
    6   HG22  ILE  91          HG21      ILE  91  13.597   6.518   8.589
    7   HG21  ILE  91          HG22      ILE  91  13.499   8.275   8.483
    8   HG23  ILE  91          HG23      ILE  91  14.691   7.400   7.523
    9   HD13  ILE  91          HD11      ILE  91  11.672   4.486   6.463
   10   HD12  ILE  91          HD12      ILE  91  11.075   4.542   8.122
   11   HD11  ILE  91          HD13      ILE  91  12.773   4.875   7.786

  No H/Q in entry =          11
  In of MODEL   82
    1    H    THR  92           H        THR  92  13.769   8.893   4.314
    2    HA   THR  92           HA       THR  92  15.914  10.316   5.475
    3    HB   THR  92           HB       THR  92  14.935  10.171   2.612
    4    HG1  THR  92           HG1      THR  92  15.790   8.286   3.024
    5   HG22  THR  92          HG21      THR  92  17.497  10.893   2.322
    6   HG21  THR  92          HG22      THR  92  17.175  11.714   3.849
    7   HG23  THR  92          HG23      THR  92  16.203  12.086   2.425

  No H/Q in entry =           7
  In of MODEL   82
    1    H    GLU  93           H        GLU  93  13.016  11.428   3.737
    2    HA   GLU  93           HA       GLU  93  13.575  14.197   3.846
    3    HB2  GLU  93           HB2      GLU  93  10.889  12.790   3.858
    4    HB3  GLU  93           HB3      GLU  93  11.156  14.492   3.482
    5    HG2  GLU  93           HG2      GLU  93  12.525  12.263   1.963
    6    HG3  GLU  93           HG3      GLU  93  10.971  12.925   1.471

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LEU  94           H        LEU  94  11.856  12.024   6.059
    2    HA   LEU  94           HA       LEU  94  11.018  13.965   7.929
    3    HB2  LEU  94           HB2      LEU  94  11.631  11.018   8.211
    4    HB3  LEU  94           HB3      LEU  94  11.045  11.990   9.558
    5    HG   LEU  94           HG       LEU  94   9.565  12.016   6.926
    6   HD11  LEU  94          HD11      LEU  94   9.672   9.801   8.937
    7   HD13  LEU  94          HD12      LEU  94   9.374   9.732   7.201
    8   HD12  LEU  94          HD13      LEU  94   8.087  10.235   8.296
    9   HD23  LEU  94          HD21      LEU  94   7.638  12.396   8.522
   10   HD22  LEU  94          HD22      LEU  94   8.860  13.665   8.558
   11   HD21  LEU  94          HD23      LEU  94   8.811  12.451   9.835

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  95           H        ILE  95  14.017  12.073   7.702
    2    HA   ILE  95           HA       ILE  95  15.168  13.015  10.116
    3    HB   ILE  95           HB       ILE  95  16.425  11.956   7.572
    4   HG12  ILE  95          HG12      ILE  95  16.140  10.758  10.342
    5   HG13  ILE  95          HG13      ILE  95  14.979  10.482   9.046
    6   HG21  ILE  95          HG21      ILE  95  17.666  12.785  10.215
    7   HG23  ILE  95          HG22      ILE  95  18.124  13.315   8.595
    8   HG22  ILE  95          HG23      ILE  95  18.450  11.660   9.108
    9   HD13  ILE  95          HD11      ILE  95  16.477   9.219   7.789
   10   HD12  ILE  95          HD12      ILE  95  16.953   8.780   9.427
   11   HD11  ILE  95          HD13      ILE  95  17.892   9.969   8.526

  No H/Q in entry =          11
  In of MODEL   82
    1    H    GLU  96           H        GLU  96  15.313  14.242   6.778
    2    HA   GLU  96           HA       GLU  96  17.133  16.345   7.253
    3    HB2  GLU  96           HB2      GLU  96  16.480  15.669   4.995
    4    HB3  GLU  96           HB3      GLU  96  14.830  16.206   5.291
    5    HG2  GLU  96           HG2      GLU  96  15.370  18.341   4.744
    6    HG3  GLU  96           HG3      GLU  96  16.667  18.360   5.928

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LEU  97           H        LEU  97  13.623  16.115   7.677
    2    HA   LEU  97           HA       LEU  97  13.172  18.845   8.311
    3    HB2  LEU  97           HB2      LEU  97  11.684  16.302   8.930
    4    HB3  LEU  97           HB3      LEU  97  11.151  17.844   9.596
    5    HG   LEU  97           HG       LEU  97  11.644  17.427   6.633
    6   HD12  LEU  97          HD11      LEU  97   9.122  17.267   6.511
    7   HD11  LEU  97          HD12      LEU  97   9.115  17.071   8.262
    8   HD13  LEU  97          HD13      LEU  97   9.913  15.871   7.244
    9   HD23  LEU  97          HD21      LEU  97   9.881  19.369   6.658
   10   HD22  LEU  97          HD22      LEU  97  11.557  19.750   7.052
   11   HD21  LEU  97          HD23      LEU  97  10.368  19.568   8.341

  No H/Q in entry =          11
  In of MODEL   82
    1    H    HIS  98           H        HIS  98  14.025  16.034  10.316
    2    HA   HIS  98           HA       HIS  98  13.848  17.299  12.828
    3    HB2  HIS  98           HB2      HIS  98  15.627  15.061  11.835
    4    HB3  HIS  98           HB3      HIS  98  15.616  15.604  13.515
    5    HD1  HIS  98           HD1      HIS  98  13.442  13.941  10.923
    6    HD2  HIS  98           HD2      HIS  98  13.317  14.869  14.985
    7    HE1  HIS  98           HE1      HIS  98  11.430  12.723  11.875
    8    HE2  HIS  98           HE2      HIS  98  11.334  13.280  14.345

  No H/Q in entry =           8
  In of MODEL   82
    1    H    GLU  99           H        GLU  99  16.406  17.210  10.398
    2    HA   GLU  99           HA       GLU  99  18.373  18.570  11.926
    3    HB2  GLU  99           HB2      GLU  99  18.871  17.283   9.861
    4    HB3  GLU  99           HB3      GLU  99  18.047  18.526   8.916
    5    HG2  GLU  99           HG2      GLU  99  19.633  20.218   9.705
    6    HG3  GLU  99           HG3      GLU  99  20.426  19.028  10.732

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LYS 100           H        LYS 100  15.838  19.696   9.703
    2    HA   LYS 100           HA       LYS 100  16.602  22.443   9.842
    3    HB2  LYS 100           HB2      LYS 100  13.986  21.120   9.086
    4    HB3  LYS 100           HB3      LYS 100  14.265  22.862   8.992
    5    HG2  LYS 100           HG2      LYS 100  16.244  22.433   7.530
    6    HG3  LYS 100           HG3      LYS 100  15.852  20.712   7.551
    7    HD2  LYS 100           HD2      LYS 100  13.652  21.192   6.546
    8    HD3  LYS 100           HD3      LYS 100  14.028  22.916   6.532
    9    HE2  LYS 100           HE2      LYS 100  15.995  22.455   5.076
   10    HE3  LYS 100           HE3      LYS 100  15.550  20.745   5.047
   11    HZ1  LYS 100           HZ1      LYS 100  13.700  22.914   4.204
   12    HZ3  LYS 100           HZ2      LYS 100  13.536  21.241   3.945
   13    HZ2  LYS 100           HZ3      LYS 100  14.738  22.116   3.124

  No H/Q in entry =          13
  In of MODEL   82
    1    H    LEU 101           H        LEU 101  14.526  20.376  11.809
    2    HA   LEU 101           HA       LEU 101  13.333  22.434  13.381
    3    HB2  LEU 101           HB2      LEU 101  13.810  19.491  13.772
    4    HB3  LEU 101           HB3      LEU 101  13.260  20.468  15.130
    5    HG   LEU 101           HG       LEU 101  11.845  20.533  12.458
    6   HD12  LEU 101          HD11      LEU 101  10.203  18.952  13.729
    7   HD11  LEU 101          HD12      LEU 101  11.601  18.558  14.727
    8   HD13  LEU 101          HD13      LEU 101  11.640  18.248  12.990
    9   HD21  LEU 101          HD21      LEU 101  11.175  21.324  15.308
   10   HD23  LEU 101          HD22      LEU 101   9.918  21.081  14.096
   11   HD22  LEU 101          HD23      LEU 101  11.138  22.330  13.857

  No H/Q in entry =          11
  In of MODEL   82
    1    H    LYS 102           H        LYS 102  16.488  21.862  12.950
    2    HA   LYS 102           HA       LYS 102  18.323  22.757  14.023
    3    HB2  LYS 102           HB2      LYS 102  16.489  24.254  15.150
    4    HB3  LYS 102           HB3      LYS 102  16.707  23.197  16.530
    5    HG2  LYS 102           HG2      LYS 102  18.578  25.227  15.359
    6    HG3  LYS 102           HG3      LYS 102  18.197  24.912  17.038
    7    HD2  LYS 102           HD2      LYS 102  19.889  23.016  15.359
    8    HD3  LYS 102           HD3      LYS 102  20.561  24.348  16.290
    9    HE2  LYS 102           HE2      LYS 102  20.191  21.797  17.264
   10    HE3  LYS 102           HE3      LYS 102  20.392  23.244  18.252
   11    HZ2  LYS 102           HZ1      LYS 102  18.437  21.938  18.870
   12    HZ1  LYS 102           HZ2      LYS 102  17.793  22.157  17.320
   13    HZ3  LYS 102           HZ3      LYS 102  18.006  23.492  18.343

  No H/Q in entry =          13
  In of MODEL   82
    1    H    ALA 103           H        ALA 103  16.266  21.134  16.446
    2    HA   ALA 103           HA       ALA 103  18.005  19.947  18.106
    3    HB2  ALA 103           HB1      ALA 103  16.444  17.921  18.103
    4    HB1  ALA 103           HB2      ALA 103  15.541  18.761  16.842
    5    HB3  ALA 103           HB3      ALA 103  15.708  19.487  18.439

  No H/Q in entry =           5
  In of MODEL   82
    1    H1   ALA   1           H3       ALA   1  -1.553  -7.227 -21.481
    2    H2   ALA   1           H2       ALA   1  -2.331  -8.670 -21.026
    3    H3   ALA   1           H1       ALA   1  -0.722  -8.703 -21.578
    4    HA   ALA   1           HA       ALA   1  -1.548  -9.187 -23.575
    5    HB1  ALA   1           HB1      ALA   1  -3.677  -9.927 -23.103
    6    HB2  ALA   1           HB2      ALA   1  -4.132  -8.424 -23.904
    7    HB3  ALA   1           HB3      ALA   1  -4.073  -8.500 -22.146

  No H/Q in entry =           7
  In of MODEL   82
    1    H    GLU   2           H        GLU   2  -2.388  -8.010 -25.568
    2    HA   GLU   2           HA       GLU   2  -1.010  -5.982 -26.448
    3    HB2  GLU   2           HB2      GLU   2  -4.016  -6.084 -26.770
    4    HB3  GLU   2           HB3      GLU   2  -2.903  -5.210 -27.820
    5    HG2  GLU   2           HG2      GLU   2  -2.377  -7.097 -28.970
    6    HG3  GLU   2           HG3      GLU   2  -2.072  -7.996 -27.490

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLU   3           H        GLU   3  -4.186  -4.759 -25.556
    2    HA   GLU   3           HA       GLU   3  -3.169  -2.190 -24.931
    3    HB2  GLU   3           HB2      GLU   3  -5.843  -3.534 -24.601
    4    HB3  GLU   3           HB3      GLU   3  -5.564  -1.914 -23.957
    5    HG2  GLU   3           HG2      GLU   3  -5.215  -0.988 -26.084
    6    HG3  GLU   3           HG3      GLU   3  -4.801  -2.540 -26.805

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LEU   4           H        LEU   4  -4.737  -4.562 -22.749
    2    HA   LEU   4           HA       LEU   4  -4.390  -3.325 -20.360
    3    HB2  LEU   4           HB2      LEU   4  -3.814  -6.261 -20.822
    4    HB3  LEU   4           HB3      LEU   4  -4.230  -5.516 -19.281
    5    HG   LEU   4           HG       LEU   4  -5.998  -5.614 -21.748
    6   HD13  LEU   4          HD11      LEU   4  -7.174  -7.343 -20.748
    7   HD12  LEU   4          HD12      LEU   4  -6.697  -6.875 -19.117
    8   HD11  LEU   4          HD13      LEU   4  -5.550  -7.707 -20.165
    9   HD23  LEU   4          HD21      LEU   4  -7.695  -4.818 -19.884
   10   HD22  LEU   4          HD22      LEU   4  -6.668  -3.637 -20.696
   11   HD21  LEU   4          HD23      LEU   4  -6.238  -4.219 -19.088

  No H/Q in entry =          11
  In of MODEL   82
    1    H    GLU   5           H        GLU   5  -1.869  -5.143 -22.083
    2    HA   GLU   5           HA       GLU   5   0.108  -4.833 -20.043
    3    HB2  GLU   5           HB2      GLU   5   0.197  -6.606 -21.791
    4    HB3  GLU   5           HB3      GLU   5   0.496  -5.362 -23.004
    5    HG2  GLU   5           HG2      GLU   5   2.552  -4.694 -21.840
    6    HG3  GLU   5           HG3      GLU   5   2.251  -5.897 -20.588

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLU   6           H        GLU   6  -0.541  -3.133 -23.093
    2    HA   GLU   6           HA       GLU   6   1.608  -1.277 -22.825
    3    HB2  GLU   6           HB2      GLU   6   0.512  -1.762 -24.991
    4    HB3  GLU   6           HB3      GLU   6  -0.972  -1.021 -24.391
    5    HG2  GLU   6           HG2      GLU   6   0.203   1.116 -24.082
    6    HG3  GLU   6           HG3      GLU   6   1.703   0.383 -24.646

  No H/Q in entry =           6
  In of MODEL   82
    1    H    VAL   7           H        VAL   7  -1.731  -1.383 -21.785
    2    HA   VAL   7           HA       VAL   7  -1.984   1.328 -20.955
    3    HB   VAL   7           HB       VAL   7  -3.420  -1.204 -20.116
    4   HG11  VAL   7          HG11      VAL   7  -3.828   1.682 -19.308
    5   HG13  VAL   7          HG12      VAL   7  -3.715   0.261 -18.270
    6   HG12  VAL   7          HG13      VAL   7  -5.148   0.513 -19.265
    7   HG21  VAL   7          HG21      VAL   7  -3.584  -0.134 -22.507
    8   HG23  VAL   7          HG22      VAL   7  -4.545   1.106 -21.699
    9   HG22  VAL   7          HG23      VAL   7  -5.072  -0.577 -21.670

  No H/Q in entry =           9
  In of MODEL   82
    1    H    VAL   8           H        VAL   8  -0.966  -1.642 -19.304
    2    HA   VAL   8           HA       VAL   8  -0.664  -0.554 -16.710
    3    HB   VAL   8           HB       VAL   8   0.647  -2.893 -18.103
    4   HG11  VAL   8          HG11      VAL   8   1.123  -1.725 -15.369
    5   HG13  VAL   8          HG12      VAL   8   2.298  -2.339 -16.532
    6   HG12  VAL   8          HG13      VAL   8   1.281  -3.462 -15.629
    7   HG21  VAL   8          HG21      VAL   8  -1.831  -2.447 -16.622
    8   HG23  VAL   8          HG22      VAL   8  -0.840  -3.659 -15.818
    9   HG22  VAL   8          HG23      VAL   8  -1.316  -3.889 -17.496

  No H/Q in entry =           9
  In of MODEL   82
    1    H    MET   9           H        MET   9   1.592  -0.836 -19.453
    2    HA   MET   9           HA       MET   9   3.865   0.234 -18.190
    3    HB2  MET   9           HB2      MET   9   2.916   0.197 -21.049
    4    HB3  MET   9           HB3      MET   9   4.390   1.055 -20.599
    5    HG2  MET   9           HG2      MET   9   5.084  -1.133 -19.419
    6    HG3  MET   9           HG3      MET   9   3.788  -1.893 -20.346
    7    HE1  MET   9           HE1      MET   9   3.625  -2.257 -22.625
    8    HE3  MET   9           HE2      MET   9   4.739  -1.818 -23.916
    9    HE2  MET   9           HE3      MET   9   3.717  -0.583 -23.186

  No H/Q in entry =           9
  In of MODEL   82
    1    H    GLY  10           H        GLY  10   1.167   1.805 -19.875
    2    HA3  GLY  10           HA2      GLY  10   2.102   4.469 -19.634
    3    HA2  GLY  10           HA3      GLY  10   0.418   3.991 -19.841

  No H/Q in entry =           3
  In of MODEL   82
    1    H    LEU  11           H        LEU  11   0.031   2.464 -17.552
    2    HA   LEU  11           HA       LEU  11  -0.522   4.439 -15.597
    3    HB2  LEU  11           HB2      LEU  11  -0.424   1.425 -15.435
    4    HB3  LEU  11           HB3      LEU  11  -0.946   2.445 -14.095
    5    HG   LEU  11           HG       LEU  11  -2.182   2.541 -16.860
    6   HD13  LEU  11          HD11      LEU  11  -2.745   0.393 -16.102
    7   HD12  LEU  11          HD12      LEU  11  -4.106   1.373 -15.560
    8   HD11  LEU  11          HD13      LEU  11  -2.847   0.907 -14.417
    9   HD22  LEU  11          HD21      LEU  11  -2.794   4.553 -15.858
   10   HD21  LEU  11          HD22      LEU  11  -2.714   3.890 -14.226
   11   HD23  LEU  11          HD23      LEU  11  -4.085   3.509 -15.269

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  12           H        ILE  12   2.046   1.998 -15.832
    2    HA   ILE  12           HA       ILE  12   3.243   2.552 -13.328
    3    HB   ILE  12           HB       ILE  12   4.464   1.490 -15.897
    4   HG12  ILE  12          HG12      ILE  12   2.542   0.223 -14.702
    5   HG13  ILE  12          HG13      ILE  12   3.988  -0.685 -15.094
    6   HG21  ILE  12          HG21      ILE  12   5.557   1.618 -13.071
    7   HG23  ILE  12          HG22      ILE  12   6.280   2.280 -14.536
    8   HG22  ILE  12          HG23      ILE  12   6.203   0.535 -14.302
    9   HD13  ILE  12          HD11      ILE  12   4.765  -0.448 -12.788
   10   HD12  ILE  12          HD12      ILE  12   3.143  -1.138 -12.804
   11   HD11  ILE  12          HD13      ILE  12   3.373   0.551 -12.406

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  13           H        ILE  13   3.835   3.815 -16.587
    2    HA   ILE  13           HA       ILE  13   5.955   5.557 -15.863
    3    HB   ILE  13           HB       ILE  13   3.926   5.615 -18.110
    4   HG12  ILE  13          HG12      ILE  13   5.787   3.794 -17.821
    5   HG13  ILE  13          HG13      ILE  13   5.520   4.519 -19.402
    6   HG22  ILE  13          HG21      ILE  13   5.612   7.216 -19.197
    7   HG21  ILE  13          HG22      ILE  13   6.275   7.458 -17.584
    8   HG23  ILE  13          HG23      ILE  13   4.602   7.896 -17.921
    9   HD13  ILE  13          HD11      ILE  13   7.429   5.999 -19.118
   10   HD12  ILE  13          HD12      ILE  13   7.946   4.366 -18.715
   11   HD11  ILE  13          HD13      ILE  13   7.595   5.517 -17.430

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ASN  14           H        ASN  14   2.444   6.017 -16.135
    2    HA   ASN  14           HA       ASN  14   2.374   8.764 -15.503
    3    HB2  ASN  14           HB2      ASN  14   0.497   7.102 -16.333
    4    HB3  ASN  14           HB3      ASN  14   0.176   6.924 -14.612
    5   HD21  ASN  14          HD21      ASN  14  -1.853   8.057 -16.049
    6   HD22  ASN  14          HD22      ASN  14  -1.932   9.730 -15.784

  No H/Q in entry =           6
  In of MODEL   82
    1    H    SER  15           H        SER  15   2.105   5.888 -13.422
    2    HA   SER  15           HA       SER  15   1.782   7.260 -10.976
    3    HB2  SER  15           HB2      SER  15   2.346   5.182  -9.922
    4    HB3  SER  15           HB3      SER  15   1.531   4.750 -11.422
    5    HG   SER  15           HG       SER  15   4.185   4.472 -10.678

  No H/Q in entry =           5
  In of MODEL   82
    1    H    GLY  16           H        GLY  16   4.671   6.189 -12.731
    2    HA3  GLY  16           HA2      GLY  16   6.586   6.968 -10.799
    3    HA2  GLY  16           HA3      GLY  16   6.893   6.766 -12.522

  No H/Q in entry =           3
  In of MODEL   82
    1    H    GLN  17           H        GLN  17   5.184   8.704 -13.591
    2    HA   GLN  17           HA       GLN  17   6.737  11.063 -13.286
    3    HB2  GLN  17           HB2      GLN  17   3.995  10.597 -14.490
    4    HB3  GLN  17           HB3      GLN  17   4.831  12.150 -14.558
    5    HG2  GLN  17           HG2      GLN  17   6.710  11.126 -15.740
    6    HG3  GLN  17           HG3      GLN  17   5.953   9.539 -15.613
    7   HE21  GLN  17          HE21      GLN  17   6.327  12.143 -17.712
    8   HE22  GLN  17          HE22      GLN  17   4.975  11.870 -18.699

  No H/Q in entry =           8
  In of MODEL   82
    1    H    ALA  18           H        ALA  18   3.646  10.014 -11.937
    2    HA   ALA  18           HA       ALA  18   2.894  12.397 -10.677
    3    HB1  ALA  18           HB1      ALA  18   1.792   9.928 -10.895
    4    HB2  ALA  18           HB2      ALA  18   1.229  11.144  -9.751
    5    HB3  ALA  18           HB3      ALA  18   2.333   9.875  -9.218

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ARG  19           H        ARG  19   4.797   9.658  -9.391
    2    HA   ARG  19           HA       ARG  19   5.314  10.826  -6.870
    3    HB2  ARG  19           HB2      ARG  19   5.756   8.427  -7.392
    4    HB3  ARG  19           HB3      ARG  19   7.107   8.926  -8.413
    5    HG2  ARG  19           HG2      ARG  19   8.213   9.982  -6.492
    6    HG3  ARG  19           HG3      ARG  19   6.841   9.581  -5.461
    7    HD2  ARG  19           HD2      ARG  19   8.621   7.966  -5.098
    8    HD3  ARG  19           HD3      ARG  19   7.256   7.167  -5.884
    9    HE   ARG  19           HE       ARG  19   8.954   8.001  -7.931
   10   HH21  ARG  19          HH11      ARG  19  10.531   6.612  -8.777
   11   HH22  ARG  19          HH12      ARG  19  11.091   5.272  -7.838
   12   HH11  ARG  19          HH21      ARG  19   9.046   5.977  -5.148
   13   HH12  ARG  19          HH22      ARG  19  10.247   4.913  -5.783

  No H/Q in entry =          13
  In of MODEL   82
    1    H    SER  20           H        SER  20   7.134  10.871  -9.918
    2    HA   SER  20           HA       SER  20   9.362  12.314  -9.094
    3    HB2  SER  20           HB2      SER  20   9.407  11.435 -11.297
    4    HB3  SER  20           HB3      SER  20   7.897  12.231 -11.727
    5    HG   SER  20           HG       SER  20  10.222  13.649 -10.956

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LEU  21           H        LEU  21   6.249  13.544 -10.297
    2    HA   LEU  21           HA       LEU  21   6.886  16.298 -10.077
    3    HB2  LEU  21           HB2      LEU  21   4.237  14.838 -10.002
    4    HB3  LEU  21           HB3      LEU  21   4.378  16.595 -10.000
    5    HG   LEU  21           HG       LEU  21   5.605  14.826 -12.136
    6   HD12  LEU  21          HD11      LEU  21   3.648  15.809 -13.511
    7   HD11  LEU  21          HD12      LEU  21   2.904  16.160 -11.951
    8   HD13  LEU  21          HD13      LEU  21   3.277  14.495 -12.394
    9   HD22  LEU  21          HD21      LEU  21   6.714  16.859 -12.356
   10   HD21  LEU  21          HD22      LEU  21   5.382  17.796 -11.686
   11   HD23  LEU  21          HD23      LEU  21   5.295  17.206 -13.338

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ALA  22           H        ALA  22   5.400  13.994  -7.826
    2    HA   ALA  22           HA       ALA  22   4.773  15.799  -5.763
    3    HB3  ALA  22           HB1      ALA  22   4.042  13.397  -5.922
    4    HB2  ALA  22           HB2      ALA  22   4.623  13.879  -4.328
    5    HB1  ALA  22           HB3      ALA  22   5.659  12.932  -5.396

  No H/Q in entry =           5
  In of MODEL   82
    1    H    TYR  23           H        TYR  23   7.732  13.809  -6.195
    2    HA   TYR  23           HA       TYR  23   9.100  14.851  -3.943
    3    HB2  TYR  23           HB2      TYR  23   9.913  12.851  -5.097
    4    HB3  TYR  23           HB3      TYR  23  10.217  13.791  -6.557
    5    HD1  TYR  23           HD1      TYR  23  11.183  13.463  -2.967
    6    HD2  TYR  23           HD2      TYR  23  12.234  14.995  -6.841
    7    HE1  TYR  23           HE1      TYR  23  13.434  14.071  -2.118
    8    HE2  TYR  23           HE2      TYR  23  14.482  15.605  -5.991
    9    HH   TYR  23           HH       TYR  23  15.541  14.666  -2.762

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ALA  24           H        ALA  24   8.906  15.948  -7.312
    2    HA   ALA  24           HA       ALA  24  10.774  18.059  -7.068
    3    HB2  ALA  24           HB1      ALA  24  10.333  18.111  -9.277
    4    HB3  ALA  24           HB2      ALA  24   8.767  18.840  -8.921
    5    HB1  ALA  24           HB3      ALA  24   8.916  17.089  -9.047

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ALA  25           H        ALA  25   7.297  17.829  -6.450
    2    HA   ALA  25           HA       ALA  25   6.780  20.541  -5.887
    3    HB1  ALA  25           HB1      ALA  25   5.146  18.520  -6.085
    4    HB2  ALA  25           HB2      ALA  25   4.760  19.806  -4.940
    5    HB3  ALA  25           HB3      ALA  25   5.469  18.296  -4.365

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LEU  26           H        LEU  26   7.883  17.881  -3.830
    2    HA   LEU  26           HA       LEU  26   7.966  19.318  -1.396
    3    HB2  LEU  26           HB2      LEU  26   8.095  16.904  -1.385
    4    HB3  LEU  26           HB3      LEU  26   9.566  16.930  -2.355
    5    HG   LEU  26           HG       LEU  26  10.763  18.069  -0.516
    6   HD12  LEU  26          HD11      LEU  26   9.535  18.064   1.743
    7   HD11  LEU  26          HD12      LEU  26   8.050  17.903   0.807
    8   HD13  LEU  26          HD13      LEU  26   9.075  19.323   0.596
    9   HD21  LEU  26          HD21      LEU  26   9.264  15.581   0.361
   10   HD23  LEU  26          HD22      LEU  26  10.770  16.167   1.058
   11   HD22  LEU  26          HD23      LEU  26  10.735  15.604  -0.610

  No H/Q in entry =          11
  In of MODEL   82
    1    H    LYS  27           H        LYS  27  10.393  18.775  -3.917
    2    HA   LYS  27           HA       LYS  27  12.557  20.050  -2.690
    3    HB2  LYS  27           HB2      LYS  27  12.680  18.700  -4.777
    4    HB3  LYS  27           HB3      LYS  27  11.897  20.019  -5.646
    5    HG2  LYS  27           HG2      LYS  27  13.740  21.533  -5.070
    6    HG3  LYS  27           HG3      LYS  27  14.518  20.254  -4.130
    7    HD2  LYS  27           HD2      LYS  27  14.683  18.864  -6.181
    8    HD3  LYS  27           HD3      LYS  27  13.950  20.169  -7.113
    9    HE2  LYS  27           HE2      LYS  27  15.815  21.664  -6.502
   10    HE3  LYS  27           HE3      LYS  27  16.553  20.363  -5.561
   11    HZ3  LYS  27           HZ1      LYS  27  17.543  20.473  -7.747
   12    HZ2  LYS  27           HZ2      LYS  27  16.019  20.330  -8.489
   13    HZ1  LYS  27           HZ3      LYS  27  16.660  19.031  -7.601

  No H/Q in entry =          13
  In of MODEL   82
    1    H    GLN  28           H        GLN  28   9.916  21.389  -4.644
    2    HA   GLN  28           HA       GLN  28  10.836  24.055  -4.803
    3    HB2  GLN  28           HB2      GLN  28   8.019  22.944  -4.689
    4    HB3  GLN  28           HB3      GLN  28   8.408  24.621  -5.070
    5    HG2  GLN  28           HG2      GLN  28   9.436  22.215  -6.605
    6    HG3  GLN  28           HG3      GLN  28   8.091  23.234  -7.116
    7   HE21  GLN  28          HE21      GLN  28  11.217  22.767  -7.872
    8   HE22  GLN  28          HE22      GLN  28  11.695  24.357  -8.231

  No H/Q in entry =           8
  In of MODEL   82
    1    H    ALA  29           H        ALA  29   8.928  22.339  -2.364
    2    HA   ALA  29           HA       ALA  29   8.344  24.526  -0.688
    3    HB2  ALA  29           HB1      ALA  29   7.638  22.950   0.883
    4    HB1  ALA  29           HB2      ALA  29   8.877  21.784   0.422
    5    HB3  ALA  29           HB3      ALA  29   7.488  22.054  -0.628

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LYS  30           H        LYS  30  11.109  22.301  -0.750
    2    HA   LYS  30           HA       LYS  30  12.410  23.280   1.552
    3    HB2  LYS  30           HB2      LYS  30  13.528  22.005  -0.955
    4    HB3  LYS  30           HB3      LYS  30  14.504  22.382   0.467
    5    HG2  LYS  30           HG2      LYS  30  12.971  20.979   1.848
    6    HG3  LYS  30           HG3      LYS  30  12.093  20.540   0.379
    7    HD2  LYS  30           HD2      LYS  30  14.154  19.583  -0.579
    8    HD3  LYS  30           HD3      LYS  30  15.050  20.036   0.873
    9    HE2  LYS  30           HE2      LYS  30  13.566  18.585   2.230
   10    HE3  LYS  30           HE3      LYS  30  12.700  18.113   0.762
   11    HZ2  LYS  30           HZ1      LYS  30  14.515  16.564   1.528
   12    HZ1  LYS  30           HZ2      LYS  30  15.634  17.767   1.075
   13    HZ3  LYS  30           HZ3      LYS  30  14.610  17.065  -0.089

  No H/Q in entry =          13
  In of MODEL   82
    1    H    GLN  31           H        GLN  31  12.285  24.475  -1.748
    2    HA   GLN  31           HA       GLN  31  14.408  26.402  -1.329
    3    HB2  GLN  31           HB2      GLN  31  12.367  26.413  -3.555
    4    HB3  GLN  31           HB3      GLN  31  13.976  27.133  -3.556
    5    HG2  GLN  31           HG2      GLN  31  14.479  24.446  -2.975
    6    HG3  GLN  31           HG3      GLN  31  13.177  24.369  -4.154
    7   HE21  GLN  31          HE21      GLN  31  16.032  23.619  -4.554
    8   HE22  GLN  31          HE22      GLN  31  16.590  24.598  -5.822

  No H/Q in entry =           8
  In of MODEL   82
    1    H    GLY  32           H        GLY  32  11.336  26.175  -0.185
    2    HA3  GLY  32           HA2      GLY  32  10.155  27.728   1.084
    3    HA2  GLY  32           HA3      GLY  32  11.262  28.980   0.531

  No H/Q in entry =           3
  In of MODEL   82
    1    H    ASP  33           H        ASP  33   9.929  27.049  -1.958
    2    HA   ASP  33           HA       ASP  33   8.230  29.294  -2.819
    3    HB2  ASP  33           HB2      ASP  33   9.362  26.889  -4.255
    4    HB3  ASP  33           HB3      ASP  33   8.194  27.985  -4.989

  No H/Q in entry =           4
  In of MODEL   82
    1    H    PHE  34           H        PHE  34   6.548  28.796  -1.256
    2    HA   PHE  34           HA       PHE  34   5.207  26.303  -1.155
    3    HB2  PHE  34           HB2      PHE  34   4.203  29.077  -0.483
    4    HB3  PHE  34           HB3      PHE  34   3.376  27.574  -0.069
    5    HD1  PHE  34           HD1      PHE  34   5.588  30.010   1.142
    6    HD2  PHE  34           HD2      PHE  34   4.974  25.759   1.098
    7    HE1  PHE  34           HE1      PHE  34   6.981  29.785   3.180
    8    HE2  PHE  34           HE2      PHE  34   6.369  25.538   3.134
    9    HZ   PHE  34           HZ       PHE  34   7.366  27.553   4.174

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ALA  35           H        ALA  35   4.734  29.155  -3.173
    2    HA   ALA  35           HA       ALA  35   2.193  28.500  -4.198
    3    HB3  ALA  35           HB1      ALA  35   3.225  29.903  -6.239
    4    HB2  ALA  35           HB2      ALA  35   4.436  30.286  -5.015
    5    HB1  ALA  35           HB3      ALA  35   2.739  30.670  -4.726

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ALA  36           H        ALA  36   5.432  27.873  -5.549
    2    HA   ALA  36           HA       ALA  36   4.467  26.424  -7.790
    3    HB3  ALA  36           HB1      ALA  36   6.625  26.581  -8.405
    4    HB2  ALA  36           HB2      ALA  36   7.121  25.562  -7.051
    5    HB1  ALA  36           HB3      ALA  36   6.988  27.309  -6.840

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ALA  37           H        ALA  37   5.436  25.452  -4.532
    2    HA   ALA  37           HA       ALA  37   5.421  22.662  -4.955
    3    HB2  ALA  37           HB1      ALA  37   5.131  24.454  -2.581
    4    HB1  ALA  37           HB2      ALA  37   6.285  23.154  -2.870
    5    HB3  ALA  37           HB3      ALA  37   4.629  22.775  -2.399

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LYS  38           H        LYS  38   2.853  24.833  -3.794
    2    HA   LYS  38           HA       LYS  38   0.783  22.988  -3.568
    3    HB2  LYS  38           HB2      LYS  38   1.091  25.750  -3.323
    4    HB3  LYS  38           HB3      LYS  38  -0.105  25.581  -4.603
    5    HG2  LYS  38           HG2      LYS  38  -1.535  24.238  -3.158
    6    HG3  LYS  38           HG3      LYS  38  -0.291  24.201  -1.901
    7    HD2  LYS  38           HD2      LYS  38  -0.513  26.535  -1.459
    8    HD3  LYS  38           HD3      LYS  38  -1.428  26.806  -2.942
    9    HE2  LYS  38           HE2      LYS  38  -2.934  26.821  -1.004
   10    HE3  LYS  38           HE3      LYS  38  -3.285  25.437  -2.043
   11    HZ3  LYS  38           HZ1      LYS  38  -2.538  23.981  -0.506
   12    HZ2  LYS  38           HZ2      LYS  38  -2.909  25.235   0.580
   13    HZ1  LYS  38           HZ3      LYS  38  -1.310  25.008   0.056

  No H/Q in entry =          13
  In of MODEL   82
    1    H    ALA  39           H        ALA  39   1.734  24.899  -6.421
    2    HA   ALA  39           HA       ALA  39  -0.326  23.996  -8.123
    3    HB2  ALA  39           HB1      ALA  39   2.400  24.684  -9.177
    4    HB1  ALA  39           HB2      ALA  39   1.414  25.932  -8.415
    5    HB3  ALA  39           HB3      ALA  39   0.815  25.082  -9.840

  No H/Q in entry =           5
  In of MODEL   82
    1    H    MET  40           H        MET  40   2.931  22.749  -7.539
    2    HA   MET  40           HA       MET  40   2.867  20.723  -9.525
    3    HB2  MET  40           HB2      MET  40   4.473  20.978  -6.976
    4    HB3  MET  40           HB3      MET  40   4.744  19.723  -8.188
    5    HG2  MET  40           HG2      MET  40   4.755  22.678  -8.860
    6    HG3  MET  40           HG3      MET  40   6.215  21.799  -8.408
    7    HE3  MET  40           HE1      MET  40   7.124  19.592 -11.211
    8    HE2  MET  40           HE2      MET  40   6.565  19.267  -9.573
    9    HE1  MET  40           HE3      MET  40   7.639  20.631  -9.875

  No H/Q in entry =           9
  In of MODEL   82
    1    H    MET  41           H        MET  41   1.949  20.759  -6.102
    2    HA   MET  41           HA       MET  41   1.460  17.986  -5.819
    3    HB2  MET  41           HB2      MET  41   0.089  20.326  -4.474
    4    HB3  MET  41           HB3      MET  41  -0.041  18.647  -3.962
    5    HG2  MET  41           HG2      MET  41   2.666  18.912  -3.998
    6    HG3  MET  41           HG3      MET  41   2.199  20.565  -3.606
    7    HE2  MET  41           HE1      MET  41  -0.822  19.267  -1.880
    8    HE1  MET  41           HE2      MET  41  -0.029  20.792  -2.260
    9    HE3  MET  41           HE3      MET  41  -0.080  20.225  -0.591

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ASP  42           H        ASP  42  -0.621  20.676  -6.800
    2    HA   ASP  42           HA       ASP  42  -3.040  19.276  -6.935
    3    HB2  ASP  42           HB2      ASP  42  -2.374  21.857  -7.197
    4    HB3  ASP  42           HB3      ASP  42  -2.517  21.456  -8.905

  No H/Q in entry =           4
  In of MODEL   82
    1    H    GLN  43           H        GLN  43  -0.607  19.901  -9.437
    2    HA   GLN  43           HA       GLN  43  -1.971  18.554 -11.524
    3    HB2  GLN  43           HB2      GLN  43   0.978  19.119 -11.142
    4    HB3  GLN  43           HB3      GLN  43   0.276  18.464 -12.623
    5    HG2  GLN  43           HG2      GLN  43  -1.268  20.467 -12.670
    6    HG3  GLN  43           HG3      GLN  43  -0.327  21.141 -11.343
    7   HE21  GLN  43          HE21      GLN  43  -0.190  22.759 -13.433
    8   HE22  GLN  43          HE22      GLN  43   1.229  22.559 -14.339

  No H/Q in entry =           8
  In of MODEL   82
    1    H    SER  44           H        SER  44   0.396  17.458  -9.129
    2    HA   SER  44           HA       SER  44   0.774  14.855 -10.149
    3    HB2  SER  44           HB2      SER  44   1.644  16.313  -7.915
    4    HB3  SER  44           HB3      SER  44   0.803  14.917  -7.241
    5    HG   SER  44           HG       SER  44   2.925  14.331  -7.665

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ARG  45           H        ARG  45  -1.569  16.140  -7.815
    2    HA   ARG  45           HA       ARG  45  -2.917  13.758  -7.176
    3    HB2  ARG  45           HB2      ARG  45  -3.152  15.925  -5.989
    4    HB3  ARG  45           HB3      ARG  45  -4.017  16.575  -7.378
    5    HG2  ARG  45           HG2      ARG  45  -5.755  14.821  -7.092
    6    HG3  ARG  45           HG3      ARG  45  -4.902  14.226  -5.667
    7    HD2  ARG  45           HD2      ARG  45  -5.147  16.492  -4.616
    8    HD3  ARG  45           HD3      ARG  45  -6.141  16.992  -6.001
    9    HE   ARG  45           HE       ARG  45  -7.212  14.600  -4.956
   10   HH21  ARG  45          HH11      ARG  45  -9.050  14.648  -3.687
   11   HH22  ARG  45          HH12      ARG  45  -9.470  16.083  -2.821
   12   HH11  ARG  45          HH21      ARG  45  -6.721  17.858  -3.939
   13   HH12  ARG  45          HH22      ARG  45  -8.146  17.901  -2.963

  No H/Q in entry =          13
  In of MODEL   82
    1    H    MET  46           H        MET  46  -3.539  16.147  -9.732
    2    HA   MET  46           HA       MET  46  -5.857  14.933 -10.793
    3    HB2  MET  46           HB2      MET  46  -3.787  16.795 -11.967
    4    HB3  MET  46           HB3      MET  46  -5.153  16.210 -12.920
    5    HG2  MET  46           HG2      MET  46  -6.725  17.121 -11.285
    6    HG3  MET  46           HG3      MET  46  -5.396  17.634 -10.252
    7    HE3  MET  46           HE1      MET  46  -5.629  18.056 -14.383
    8    HE2  MET  46           HE2      MET  46  -6.848  19.317 -14.217
    9    HE1  MET  46           HE3      MET  46  -7.128  17.730 -13.503

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ALA  47           H        ALA  47  -2.420  14.510 -11.547
    2    HA   ALA  47           HA       ALA  47  -2.735  12.772 -13.754
    3    HB3  ALA  47           HB1      ALA  47  -0.573  13.699 -13.403
    4    HB2  ALA  47           HB2      ALA  47  -0.403  11.974 -13.065
    5    HB1  ALA  47           HB3      ALA  47  -0.516  13.127 -11.734

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LEU  48           H        LEU  48  -2.457  12.149 -10.279
    2    HA   LEU  48           HA       LEU  48  -2.503   9.307 -10.431
    3    HB2  LEU  48           HB2      LEU  48  -3.301  11.217  -8.222
    4    HB3  LEU  48           HB3      LEU  48  -3.178   9.469  -8.017
    5    HG   LEU  48           HG       LEU  48  -0.907  11.205  -9.016
    6   HD13  LEU  48          HD11      LEU  48  -1.205  11.975  -6.828
    7   HD12  LEU  48          HD12      LEU  48  -0.020  10.688  -6.625
    8   HD11  LEU  48          HD13      LEU  48  -1.714  10.397  -6.228
    9   HD22  LEU  48          HD21      LEU  48  -0.371   9.027  -9.652
   10   HD21  LEU  48          HD22      LEU  48  -1.229   8.300  -8.295
   11   HD23  LEU  48          HD23      LEU  48   0.330   9.080  -8.035

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ASN  49           H        ASN  49  -5.009  11.758 -10.037
    2    HA   ASN  49           HA       ASN  49  -7.166  10.058  -9.495
    3    HB2  ASN  49           HB2      ASN  49  -7.251  12.488  -9.184
    4    HB3  ASN  49           HB3      ASN  49  -7.120  12.734 -10.921
    5   HD21  ASN  49          HD21      ASN  49  -9.182  13.702 -11.224
    6   HD22  ASN  49          HD22      ASN  49 -10.638  12.877 -10.949

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLU  50           H        GLU  50  -5.905  11.269 -12.584
    2    HA   GLU  50           HA       GLU  50  -7.836   9.977 -14.229
    3    HB2  GLU  50           HB2      GLU  50  -6.400  11.819 -15.046
    4    HB3  GLU  50           HB3      GLU  50  -4.988  10.771 -14.904
    5    HG2  GLU  50           HG2      GLU  50  -5.934   9.215 -16.538
    6    HG3  GLU  50           HG3      GLU  50  -7.411  10.168 -16.629

  No H/Q in entry =           6
  In of MODEL   82
    1    H    ALA  51           H        ALA  51  -4.650   9.041 -13.018
    2    HA   ALA  51           HA       ALA  51  -4.467   6.588 -14.430
    3    HB2  ALA  51           HB1      ALA  51  -2.483   6.336 -13.328
    4    HB1  ALA  51           HB2      ALA  51  -3.179   6.751 -11.762
    5    HB3  ALA  51           HB3      ALA  51  -2.744   8.026 -12.899

  No H/Q in entry =           5
  In of MODEL   82
    1    H    HIS  52           H        HIS  52  -5.657   7.407 -11.184
    2    HA   HIS  52           HA       HIS  52  -6.299   4.788 -10.348
    3    HB2  HIS  52           HB2      HIS  52  -6.197   6.719  -8.820
    4    HB3  HIS  52           HB3      HIS  52  -7.626   7.402  -9.594
    5    HD1  HIS  52           HD1      HIS  52  -9.853   5.870  -9.444
    6    HD2  HIS  52           HD2      HIS  52  -6.765   4.859  -6.833
    7    HE1  HIS  52           HE1      HIS  52 -10.879   4.395  -7.658
    8    HE2  HIS  52           HE2      HIS  52  -9.009   3.770  -6.058

  No H/Q in entry =           8
  In of MODEL   82
    1    H    LEU  53           H        LEU  53  -8.158   7.211 -12.143
    2    HA   LEU  53           HA       LEU  53 -10.642   5.877 -12.156
    3    HB2  LEU  53           HB2      LEU  53  -9.389   7.877 -14.026
    4    HB3  LEU  53           HB3      LEU  53 -10.974   7.182 -14.353
    5    HG   LEU  53           HG       LEU  53 -10.289   8.519 -11.715
    6   HD11  LEU  53          HD11      LEU  53 -10.052  10.100 -13.641
    7   HD13  LEU  53          HD12      LEU  53 -11.382  10.523 -12.561
    8   HD12  LEU  53          HD13      LEU  53 -11.711   9.733 -14.101
    9   HD23  LEU  53          HD21      LEU  53 -12.889   8.848 -11.861
   10   HD22  LEU  53          HD22      LEU  53 -12.258   7.276 -11.387
   11   HD21  LEU  53          HD23      LEU  53 -12.830   7.531 -13.024

  No H/Q in entry =          11
  In of MODEL   82
    1    H    VAL  54           H        VAL  54  -7.886   5.720 -14.389
    2    HA   VAL  54           HA       VAL  54  -9.077   3.925 -16.230
    3    HB   VAL  54           HB       VAL  54  -6.179   4.481 -15.545
    4   HG12  VAL  54          HG11      VAL  54  -5.911   3.395 -17.931
    5   HG11  VAL  54          HG12      VAL  54  -7.427   2.590 -17.528
    6   HG13  VAL  54          HG13      VAL  54  -6.009   2.361 -16.507
    7   HG22  VAL  54          HG21      VAL  54  -6.979   6.409 -16.595
    8   HG21  VAL  54          HG22      VAL  54  -8.157   5.524 -17.562
    9   HG23  VAL  54          HG23      VAL  54  -6.449   5.471 -17.991

  No H/Q in entry =           9
  In of MODEL   82
    1    H    GLN  55           H        GLN  55  -7.073   3.418 -13.326
    2    HA   GLN  55           HA       GLN  55  -6.937   0.603 -13.576
    3    HB2  GLN  55           HB2      GLN  55  -5.398   1.528 -12.057
    4    HB3  GLN  55           HB3      GLN  55  -6.631   2.476 -11.231
    5    HG2  GLN  55           HG2      GLN  55  -7.293   0.711  -9.910
    6    HG3  GLN  55           HG3      GLN  55  -7.047  -0.475 -11.186
    7   HE21  GLN  55          HE21      GLN  55  -5.401  -1.897 -10.686
    8   HE22  GLN  55          HE22      GLN  55  -4.023  -1.522  -9.773

  No H/Q in entry =           8
  In of MODEL   82
    1    H    THR  56           H        THR  56  -9.305   2.731 -11.969
    2    HA   THR  56           HA       THR  56 -10.860   0.826 -10.678
    3    HB   THR  56           HB       THR  56 -11.993   3.192 -12.192
    4    HG1  THR  56           HG1      THR  56 -10.394   3.007  -9.925
    5   HG23  THR  56          HG21      THR  56 -13.813   3.042 -10.755
    6   HG22  THR  56          HG22      THR  56 -12.891   2.198  -9.510
    7   HG21  THR  56          HG23      THR  56 -13.407   1.339 -10.963

  No H/Q in entry =           7
  In of MODEL   82
    1    H    LYS  57           H        LYS  57 -11.075   1.897 -14.066
    2    HA   LYS  57           HA       LYS  57 -13.203   0.174 -14.819
    3    HB2  LYS  57           HB2      LYS  57 -12.407   2.116 -16.159
    4    HB3  LYS  57           HB3      LYS  57 -10.900   1.266 -16.472
    5    HG2  LYS  57           HG2      LYS  57 -12.307   0.973 -18.400
    6    HG3  LYS  57           HG3      LYS  57 -12.245  -0.569 -17.554
    7    HD2  LYS  57           HD2      LYS  57 -14.432  -0.284 -16.653
    8    HD3  LYS  57           HD3      LYS  57 -14.466   1.427 -17.070
    9    HE2  LYS  57           HE2      LYS  57 -14.323  -0.808 -19.122
   10    HE3  LYS  57           HE3      LYS  57 -15.826  -0.023 -18.641
   11    HZ2  LYS  57           HZ1      LYS  57 -13.685   0.955 -20.315
   12    HZ1  LYS  57           HZ2      LYS  57 -14.272   2.083 -19.188
   13    HZ3  LYS  57           HZ3      LYS  57 -15.331   1.361 -20.306

  No H/Q in entry =          13
  In of MODEL   82
    1    H    LEU  58           H        LEU  58  -9.692  -0.201 -14.756
    2    HA   LEU  58           HA       LEU  58  -9.658  -2.721 -16.038
    3    HB2  LEU  58           HB2      LEU  58  -7.647  -1.392 -14.230
    4    HB3  LEU  58           HB3      LEU  58  -7.361  -2.911 -15.080
    5    HG   LEU  58           HG       LEU  58  -8.154  -0.323 -16.451
    6   HD11  LEU  58          HD11      LEU  58  -5.489  -1.515 -15.753
    7   HD13  LEU  58          HD12      LEU  58  -6.011   0.168 -15.710
    8   HD12  LEU  58          HD13      LEU  58  -5.657  -0.602 -17.253
    9   HD22  LEU  58          HD21      LEU  58  -8.702  -1.898 -18.039
   10   HD21  LEU  58          HD22      LEU  58  -7.642  -3.127 -17.353
   11   HD23  LEU  58          HD23      LEU  58  -6.971  -1.845 -18.360

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  59           H        ILE  59 -10.499  -1.823 -12.791
    2    HA   ILE  59           HA       ILE  59 -10.104  -4.582 -11.835
    3    HB   ILE  59           HB       ILE  59  -9.694  -2.310 -10.440
    4   HG12  ILE  59          HG12      ILE  59 -11.046  -4.667  -9.110
    5   HG13  ILE  59          HG13      ILE  59  -9.402  -4.737  -9.693
    6   HG23  ILE  59          HG21      ILE  59 -11.535  -1.603  -9.168
    7   HG22  ILE  59          HG22      ILE  59 -12.442  -3.066  -9.470
    8   HG21  ILE  59          HG23      ILE  59 -12.262  -1.855 -10.737
    9   HD12  ILE  59          HD11      ILE  59 -10.482  -2.798  -7.660
   10   HD11  ILE  59          HD12      ILE  59  -8.842  -2.750  -8.296
   11   HD13  ILE  59          HD13      ILE  59  -9.376  -4.129  -7.335

  No H/Q in entry =          11
  In of MODEL   82
    1    H    GLU  60           H        GLU  60 -12.698  -2.310 -12.654
    2    HA   GLU  60           HA       GLU  60 -14.860  -3.859 -11.640
    3    HB2  GLU  60           HB2      GLU  60 -15.121  -1.497 -12.237
    4    HB3  GLU  60           HB3      GLU  60 -14.772  -1.865 -13.923
    5    HG2  GLU  60           HG2      GLU  60 -16.778  -3.348 -13.980
    6    HG3  GLU  60           HG3      GLU  60 -17.148  -2.868 -12.337

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLY  61           H        GLY  61 -13.182  -3.825 -14.752
    2    HA3  GLY  61           HA2      GLY  61 -14.856  -6.100 -15.639
    3    HA2  GLY  61           HA3      GLY  61 -14.028  -4.985 -16.719

  No H/Q in entry =           3
  In of MODEL   82
    1    H    ASP  62           H        ASP  62 -12.632  -6.399 -13.828
    2    HA   ASP  62           HA       ASP  62 -10.227  -7.137 -14.966
    3    HB2  ASP  62           HB2      ASP  62 -10.011  -8.645 -12.984
    4    HB3  ASP  62           HB3      ASP  62 -10.534  -7.015 -12.571

  No H/Q in entry =           4
  In of MODEL   82
    1    H    ALA  63           H        ALA  63  -9.777  -8.540 -16.596
    2    HA   ALA  63           HA       ALA  63 -11.609 -10.680 -17.327
    3    HB3  ALA  63           HB1      ALA  63  -8.858  -9.863 -18.331
    4    HB1  ALA  63           HB2      ALA  63 -10.407  -9.498 -19.090
    5    HB2  ALA  63           HB3      ALA  63  -9.817 -11.161 -19.044

  No H/Q in entry =           5
  In of MODEL   82
    1    H    GLY  64           H        GLY  64  -8.499 -11.685 -17.853
    2    HA3  GLY  64           HA2      GLY  64  -7.006 -13.005 -16.540
    3    HA2  GLY  64           HA3      GLY  64  -8.310 -13.287 -15.394

  No H/Q in entry =           3
  In of MODEL   82
    1    H    GLU  65           H        GLU  65  -6.700 -15.349 -16.513
    2    HA   GLU  65           HA       GLU  65  -7.954 -16.588 -18.728
    3    HB2  GLU  65           HB2      GLU  65  -6.146 -17.684 -16.578
    4    HB3  GLU  65           HB3      GLU  65  -6.706 -18.635 -17.955
    5    HG2  GLU  65           HG2      GLU  65  -5.708 -17.033 -19.508
    6    HG3  GLU  65           HG3      GLU  65  -5.212 -16.006 -18.164

  No H/Q in entry =           6
  In of MODEL   82
    1    H    GLY  66           H        GLY  66  -8.338 -16.968 -15.282
    2    HA3  GLY  66           HA2      GLY  66 -10.261 -19.107 -15.438
    3    HA2  GLY  66           HA3      GLY  66  -9.727 -18.275 -13.991

  No H/Q in entry =           3
  In of MODEL   82
    1    H    LYS  67           H        LYS  67 -12.361 -19.031 -14.479
    2    HA   LYS  67           HA       LYS  67 -14.018 -17.093 -15.599
    3    HB2  LYS  67           HB2      LYS  67 -15.692 -18.182 -13.854
    4    HB3  LYS  67           HB3      LYS  67 -15.108 -19.075 -15.264
    5    HG2  LYS  67           HG2      LYS  67 -13.469 -20.232 -13.997
    6    HG3  LYS  67           HG3      LYS  67 -13.607 -19.111 -12.645
    7    HD2  LYS  67           HD2      LYS  67 -14.738 -21.446 -12.436
    8    HD3  LYS  67           HD3      LYS  67 -15.655 -20.022 -11.938
    9    HE2  LYS  67           HE2      LYS  67 -16.913 -19.994 -13.961
   10    HE3  LYS  67           HE3      LYS  67 -15.811 -21.123 -14.749
   11    HZ2  LYS  67           HZ1      LYS  67 -18.089 -21.881 -13.660
   12    HZ1  LYS  67           HZ2      LYS  67 -17.091 -22.030 -12.295
   13    HZ3  LYS  67           HZ3      LYS  67 -16.727 -22.890 -13.713

  No H/Q in entry =          13
  In of MODEL   82
    1    H    MET  68           H        MET  68 -13.021 -17.483 -12.257
    2    HA   MET  68           HA       MET  68 -14.268 -14.945 -11.481
    3    HB2  MET  68           HB2      MET  68 -13.181 -17.278  -9.919
    4    HB3  MET  68           HB3      MET  68 -13.673 -15.765  -9.157
    5    HG2  MET  68           HG2      MET  68 -15.927 -15.998 -10.070
    6    HG3  MET  68           HG3      MET  68 -15.450 -17.460 -10.937
    7    HE2  MET  68           HE1      MET  68 -16.190 -16.737  -6.531
    8    HE1  MET  68           HE2      MET  68 -15.864 -15.590  -7.828
    9    HE3  MET  68           HE3      MET  68 -14.524 -16.413  -7.032

  No H/Q in entry =           9
  In of MODEL   82
    1    H    LYS  69           H        LYS  69 -11.205 -15.954 -12.472
    2    HA   LYS  69           HA       LYS  69  -9.654 -14.422 -10.607
    3    HB2  LYS  69           HB2      LYS  69  -8.966 -15.860 -13.165
    4    HB3  LYS  69           HB3      LYS  69  -7.766 -14.972 -12.224
    5    HG2  LYS  69           HG2      LYS  69  -8.350 -16.326 -10.227
    6    HG3  LYS  69           HG3      LYS  69  -9.507 -17.234 -11.197
    7    HD2  LYS  69           HD2      LYS  69  -7.687 -18.000 -12.669
    8    HD3  LYS  69           HD3      LYS  69  -6.523 -17.082 -11.714
    9    HE2  LYS  69           HE2      LYS  69  -7.097 -18.415  -9.720
   10    HE3  LYS  69           HE3      LYS  69  -8.270 -19.330 -10.666
   11    HZ2  LYS  69           HZ1      LYS  69  -5.862 -20.219 -10.332
   12    HZ1  LYS  69           HZ2      LYS  69  -5.498 -19.164 -11.613
   13    HZ3  LYS  69           HZ3      LYS  69  -6.641 -20.404 -11.828

  No H/Q in entry =          13
  In of MODEL   82
    1    H    VAL  70           H        VAL  70  -7.812 -12.953 -11.599
    2    HA   VAL  70           HA       VAL  70  -9.019 -10.956 -13.426
    3    HB   VAL  70           HB       VAL  70  -8.054  -9.185 -12.013
    4   HG12  VAL  70          HG11      VAL  70  -9.612 -10.870 -10.094
    5   HG11  VAL  70          HG12      VAL  70 -10.377 -10.434 -11.624
    6   HG13  VAL  70          HG13      VAL  70  -9.828  -9.172 -10.521
    7   HG22  VAL  70          HG21      VAL  70  -6.173 -10.445 -11.040
    8   HG21  VAL  70          HG22      VAL  70  -7.303 -11.495 -10.188
    9   HG23  VAL  70          HG23      VAL  70  -7.177  -9.793  -9.744

  No H/Q in entry =           9
  In of MODEL   82
    1    H    SER  71           H        SER  71  -7.369  -9.497 -14.358
    2    HA   SER  71           HA       SER  71  -5.239 -10.901 -15.582
    3    HB2  SER  71           HB2      SER  71  -6.279  -8.889 -16.577
    4    HB3  SER  71           HB3      SER  71  -5.629  -7.912 -15.264
    5    HG   SER  71           HG       SER  71  -3.830  -9.546 -16.597

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LEU  72           H        LEU  72  -3.105 -11.095 -15.049
    2    HA   LEU  72           HA       LEU  72  -2.393 -10.861 -12.337
    3    HB2  LEU  72           HB2      LEU  72  -0.728 -11.271 -14.816
    4    HB3  LEU  72           HB3      LEU  72  -0.068 -11.329 -13.185
    5    HG   LEU  72           HG       LEU  72  -2.393 -13.060 -14.086
    6   HD11  LEU  72          HD11      LEU  72   0.589 -13.572 -14.104
    7   HD13  LEU  72          HD12      LEU  72  -0.549 -13.745 -15.440
    8   HD12  LEU  72          HD13      LEU  72  -0.596 -14.879 -14.090
    9   HD22  LEU  72          HD21      LEU  72  -2.398 -13.066 -11.737
   10   HD21  LEU  72          HD22      LEU  72  -0.652 -12.912 -11.621
   11   HD23  LEU  72          HD23      LEU  72  -1.370 -14.447 -12.102

  No H/Q in entry =          11
  In of MODEL   82
    1    H    VAL  73           H        VAL  73  -1.703  -8.842 -15.123
    2    HA   VAL  73           HA       VAL  73   0.190  -7.111 -14.021
    3    HB   VAL  73           HB       VAL  73  -0.172  -5.745 -15.897
    4   HG12  VAL  73          HG11      VAL  73  -1.159  -8.462 -16.794
    5   HG11  VAL  73          HG12      VAL  73   0.518  -8.149 -16.348
    6   HG13  VAL  73          HG13      VAL  73  -0.202  -7.305 -17.719
    7   HG22  VAL  73          HG21      VAL  73  -2.497  -5.214 -15.685
    8   HG21  VAL  73          HG22      VAL  73  -2.967  -6.901 -15.877
    9   HG23  VAL  73          HG23      VAL  73  -2.321  -6.004 -17.251

  No H/Q in entry =           9
  In of MODEL   82
    1    H    LEU  74           H        LEU  74  -3.207  -7.277 -13.469
    2    HA   LEU  74           HA       LEU  74  -3.866  -4.629 -12.866
    3    HB2  LEU  74           HB2      LEU  74  -5.573  -6.312 -13.036
    4    HB3  LEU  74           HB3      LEU  74  -4.867  -7.234 -11.712
    5    HG   LEU  74           HG       LEU  74  -5.346  -5.364 -10.161
    6   HD13  LEU  74          HD11      LEU  74  -5.278  -3.431 -11.539
    7   HD12  LEU  74          HD12      LEU  74  -6.978  -3.610 -11.108
    8   HD11  LEU  74          HD13      LEU  74  -6.414  -4.121 -12.700
    9   HD21  LEU  74          HD21      LEU  74  -7.011  -7.245 -10.973
   10   HD23  LEU  74          HD22      LEU  74  -7.870  -5.863 -11.617
   11   HD22  LEU  74          HD23      LEU  74  -7.555  -5.958  -9.902

  No H/Q in entry =          11
  In of MODEL   82
    1    H    VAL  75           H        VAL  75  -2.790  -7.193 -10.694
    2    HA   VAL  75           HA       VAL  75  -2.620  -5.631  -8.355
    3    HB   VAL  75           HB       VAL  75  -1.095  -8.111  -9.140
    4   HG13  VAL  75          HG11      VAL  75   0.169  -6.863  -7.426
    5   HG12  VAL  75          HG12      VAL  75  -0.623  -8.241  -6.677
    6   HG11  VAL  75          HG13      VAL  75  -1.301  -6.632  -6.484
    7   HG21  VAL  75          HG21      VAL  75  -3.671  -8.070  -8.837
    8   HG23  VAL  75          HG22      VAL  75  -3.333  -7.778  -7.132
    9   HG22  VAL  75          HG23      VAL  75  -2.768  -9.261  -7.901

  No H/Q in entry =           9
  In of MODEL   82
    1    H    GLU  76           H        GLU  76  -0.195  -6.363 -10.885
    2    HA   GLU  76           HA       GLU  76   1.968  -4.979  -9.728
    3    HB2  GLU  76           HB2      GLU  76   2.209  -6.454 -11.700
    4    HB3  GLU  76           HB3      GLU  76   1.265  -5.328 -12.665
    5    HG2  GLU  76           HG2      GLU  76   3.591  -4.935 -13.170
    6    HG3  GLU  76           HG3      GLU  76   3.041  -3.570 -12.217

  No H/Q in entry =           6
  In of MODEL   82
    1    H    ALA  77           H        ALA  77  -0.578  -3.823 -11.925
    2    HA   ALA  77           HA       ALA  77   0.372  -1.162 -12.107
    3    HB2  ALA  77           HB1      ALA  77  -1.716  -0.646 -13.109
    4    HB3  ALA  77           HB2      ALA  77  -2.537  -1.958 -12.263
    5    HB1  ALA  77           HB3      ALA  77  -1.397  -2.322 -13.557

  No H/Q in entry =           5
  In of MODEL   82
    1    H    GLN  78           H        GLN  78  -1.876  -2.746  -9.895
    2    HA   GLN  78           HA       GLN  78  -2.722  -0.436  -8.503
    3    HB2  GLN  78           HB2      GLN  78  -3.796  -2.712  -8.413
    4    HB3  GLN  78           HB3      GLN  78  -2.454  -3.248  -7.407
    5    HG2  GLN  78           HG2      GLN  78  -3.000  -1.515  -5.748
    6    HG3  GLN  78           HG3      GLN  78  -4.343  -0.971  -6.752
    7   HE21  GLN  78          HE21      GLN  78  -4.822  -1.933  -4.107
    8   HE22  GLN  78          HE22      GLN  78  -5.655  -3.409  -4.214

  No H/Q in entry =           8
  In of MODEL   82
    1    H    LEU  79           H        LEU  79  -0.009  -2.648  -8.040
    2    HA   LEU  79           HA       LEU  79   0.948  -1.728  -5.584
    3    HB2  LEU  79           HB2      LEU  79   1.852  -3.726  -6.644
    4    HB3  LEU  79           HB3      LEU  79   2.485  -2.768  -7.979
    5    HG   LEU  79           HG       LEU  79   4.019  -1.599  -6.476
    6   HD13  LEU  79          HD11      LEU  79   3.007  -1.364  -4.412
    7   HD12  LEU  79          HD12      LEU  79   4.106  -2.695  -4.061
    8   HD11  LEU  79          HD13      LEU  79   2.407  -3.023  -4.393
    9   HD23  LEU  79          HD21      LEU  79   5.263  -3.725  -5.563
   10   HD22  LEU  79          HD22      LEU  79   5.060  -3.534  -7.302
   11   HD21  LEU  79          HD23      LEU  79   3.997  -4.619  -6.409

  No H/Q in entry =          11
  In of MODEL   82
    1    H    HIS  80           H        HIS  80   1.806  -0.607  -8.859
    2    HA   HIS  80           HA       HIS  80   3.579   1.413  -7.939
    3    HB2  HIS  80           HB2      HIS  80   2.307   0.689 -10.522
    4    HB3  HIS  80           HB3      HIS  80   2.874   2.351 -10.356
    5    HD1  HIS  80           HD1      HIS  80   5.271   2.690 -10.874
    6    HD2  HIS  80           HD2      HIS  80   4.514  -1.230  -9.672
    7    HE1  HIS  80           HE1      HIS  80   7.482   1.449 -11.031
    8    HE2  HIS  80           HE2      HIS  80   7.032  -0.943 -10.302

  No H/Q in entry =           8
  In of MODEL   82
    1    H    LEU  81           H        LEU  81   0.175   1.513  -8.926
    2    HA   LEU  81           HA       LEU  81  -0.148   4.301  -8.605
    3    HB2  LEU  81           HB2      LEU  81  -2.124   2.022  -8.523
    4    HB3  LEU  81           HB3      LEU  81  -2.606   3.717  -8.437
    5    HG   LEU  81           HG       LEU  81  -0.888   2.590 -10.666
    6   HD12  LEU  81          HD11      LEU  81  -3.123   2.867 -11.971
    7   HD11  LEU  81          HD12      LEU  81  -3.881   2.791 -10.381
    8   HD13  LEU  81          HD13      LEU  81  -2.913   1.438 -10.962
    9   HD23  LEU  81          HD21      LEU  81  -2.020   4.712 -11.772
   10   HD22  LEU  81          HD22      LEU  81  -0.609   4.910 -10.737
   11   HD21  LEU  81          HD23      LEU  81  -2.220   5.232 -10.101

  No H/Q in entry =          11
  In of MODEL   82
    1    H    MET  82           H        MET  82  -0.766   1.610  -6.349
    2    HA   MET  82           HA       MET  82  -1.850   3.184  -4.269
    3    HB2  MET  82           HB2      MET  82  -0.429   0.521  -4.297
    4    HB3  MET  82           HB3      MET  82  -1.024   1.241  -2.803
    5    HG2  MET  82           HG2      MET  82  -2.742   0.710  -5.247
    6    HG3  MET  82           HG3      MET  82  -2.648  -0.358  -3.848
    7    HE3  MET  82           HE1      MET  82  -4.406   1.269  -1.041
    8    HE2  MET  82           HE2      MET  82  -2.681   1.577  -1.223
    9    HE1  MET  82           HE3      MET  82  -3.340   0.006  -1.674

  No H/Q in entry =           9
  In of MODEL   82
    1    H    THR  83           H        THR  83   1.471   2.155  -4.948
    2    HA   THR  83           HA       THR  83   2.664   3.287  -2.649
    3    HB   THR  83           HB       THR  83   4.763   3.264  -4.117
    4    HG1  THR  83           HG1      THR  83   4.537   2.727  -6.140
    5   HG22  THR  83          HG21      THR  83   4.366   0.597  -4.442
    6   HG21  THR  83          HG22      THR  83   3.068   0.957  -3.306
    7   HG23  THR  83          HG23      THR  83   4.740   1.332  -2.884

  No H/Q in entry =           7
  In of MODEL   82
    1    H    SER  84           H        SER  84   2.278   4.550  -5.953
    2    HA   SER  84           HA       SER  84   3.573   7.015  -5.502
    3    HB2  SER  84           HB2      SER  84   1.523   6.140  -7.524
    4    HB3  SER  84           HB3      SER  84   2.172   7.779  -7.502
    5    HG   SER  84           HG       SER  84   3.589   5.328  -7.783

  No H/Q in entry =           5
  In of MODEL   82
    1    H    MET  85           H        MET  85   0.093   6.197  -5.336
    2    HA   MET  85           HA       MET  85  -0.816   8.794  -4.745
    3    HB2  MET  85           HB2      MET  85  -2.305   6.956  -5.412
    4    HB3  MET  85           HB3      MET  85  -2.006   6.160  -3.867
    5    HG2  MET  85           HG2      MET  85  -2.925   8.120  -2.677
    6    HG3  MET  85           HG3      MET  85  -3.222   8.915  -4.221
    7    HE2  MET  85           HE1      MET  85  -5.594   5.627  -2.173
    8    HE1  MET  85           HE2      MET  85  -4.421   6.762  -1.509
    9    HE3  MET  85           HE3      MET  85  -3.866   5.383  -2.453

  No H/Q in entry =           9
  In of MODEL   82
    1    H    LEU  86           H        LEU  86   0.145   6.154  -2.591
    2    HA   LEU  86           HA       LEU  86  -0.416   7.454  -0.154
    3    HB2  LEU  86           HB2      LEU  86   0.091   4.991  -0.540
    4    HB3  LEU  86           HB3      LEU  86   1.791   5.449  -0.632
    5    HG   LEU  86           HG       LEU  86   1.442   6.611   1.632
    6   HD11  LEU  86          HD11      LEU  86  -1.238   5.798   1.157
    7   HD13  LEU  86          HD12      LEU  86  -0.588   6.560   2.607
    8   HD12  LEU  86          HD13      LEU  86  -0.649   4.802   2.492
    9   HD23  LEU  86          HD21      LEU  86   1.063   3.612   1.761
   10   HD22  LEU  86          HD22      LEU  86   2.046   4.641   2.801
   11   HD21  LEU  86          HD23      LEU  86   2.556   4.320   1.144

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ALA  87           H        ALA  87   2.574   7.204  -2.036
    2    HA   ALA  87           HA       ALA  87   4.252   8.647  -0.312
    3    HB3  ALA  87           HB1      ALA  87   4.370   7.629  -3.016
    4    HB2  ALA  87           HB2      ALA  87   5.696   7.984  -1.913
    5    HB1  ALA  87           HB3      ALA  87   5.063   9.251  -2.962

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ARG  88           H        ARG  88   2.293   9.744  -3.039
    2    HA   ARG  88           HA       ARG  88   3.024  12.446  -2.928
    3    HB2  ARG  88           HB2      ARG  88   1.792  11.269  -4.784
    4    HB3  ARG  88           HB3      ARG  88   0.331  11.392  -3.805
    5    HG2  ARG  88           HG2      ARG  88   1.309  13.988  -3.726
    6    HG3  ARG  88           HG3      ARG  88   1.744  13.476  -5.355
    7    HD2  ARG  88           HD2      ARG  88  -0.396  13.521  -6.057
    8    HD3  ARG  88           HD3      ARG  88  -0.973  12.662  -4.627
    9    HE   ARG  88           HE       ARG  88  -1.205  15.436  -5.053
   10   HH21  ARG  88          HH11      ARG  88  -1.756  16.761  -3.320
   11   HH22  ARG  88          HH12      ARG  88  -1.455  16.233  -1.700
   12   HH11  ARG  88          HH21      ARG  88  -0.159  13.195  -2.671
   13   HH12  ARG  88          HH22      ARG  88  -0.568  14.208  -1.333

  No H/Q in entry =          13
  In of MODEL   82
    1    H    GLU  89           H        GLU  89   0.343  10.734  -1.289
    2    HA   GLU  89           HA       GLU  89  -0.802  13.032  -0.092
    3    HB2  GLU  89           HB2      GLU  89  -1.885  10.775  -0.175
    4    HB3  GLU  89           HB3      GLU  89  -0.756  10.240   1.070
    5    HG2  GLU  89           HG2      GLU  89  -1.604  11.930   2.623
    6    HG3  GLU  89           HG3      GLU  89  -2.664  12.582   1.376

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LEU  90           H        LEU  90   1.681  10.780   1.093
    2    HA   LEU  90           HA       LEU  90   2.014  12.036   3.620
    3    HB2  LEU  90           HB2      LEU  90   3.816  10.284   1.950
    4    HB3  LEU  90           HB3      LEU  90   4.225  10.811   3.588
    5    HG   LEU  90           HG       LEU  90   1.611   9.425   2.926
    6   HD12  LEU  90          HD11      LEU  90   2.780   7.398   3.941
    7   HD11  LEU  90          HD12      LEU  90   4.290   8.276   3.700
    8   HD13  LEU  90          HD13      LEU  90   3.286   7.850   2.312
    9   HD22  LEU  90          HD21      LEU  90   1.329  10.349   5.045
   10   HD21  LEU  90          HD22      LEU  90   3.048  10.268   5.430
   11   HD23  LEU  90          HD23      LEU  90   2.063   8.806   5.480

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  91           H        ILE  91   3.617  12.434   0.495
    2    HA   ILE  91           HA       ILE  91   5.566  14.296   1.334
    3    HB   ILE  91           HB       ILE  91   4.266  13.780  -1.348
    4   HG12  ILE  91          HG12      ILE  91   7.104  13.336  -0.367
    5   HG13  ILE  91          HG13      ILE  91   5.839  12.120  -0.204
    6   HG22  ILE  91          HG21      ILE  91   6.471  15.157  -2.035
    7   HG21  ILE  91          HG22      ILE  91   6.147  15.957  -0.497
    8   HG23  ILE  91          HG23      ILE  91   4.926  15.965  -1.768
    9   HD13  ILE  91          HD11      ILE  91   5.675  11.789  -2.511
   10   HD12  ILE  91          HD12      ILE  91   7.405  12.057  -2.295
   11   HD11  ILE  91          HD13      ILE  91   6.377  13.364  -2.886

  No H/Q in entry =          11
  In of MODEL   82
    1    H    THR  92           H        THR  92   2.200  14.678   0.319
    2    HA   THR  92           HA       THR  92   2.134  17.501   0.251
    3    HB   THR  92           HB       THR  92  -0.006  15.477   0.951
    4    HG1  THR  92           HG1      THR  92   0.305  15.298  -1.132
    5   HG22  THR  92          HG21      THR  92  -1.436  17.617   0.222
    6   HG21  THR  92          HG22      THR  92  -0.057  18.464   0.919
    7   HG23  THR  92          HG23      THR  92  -0.984  17.331   1.902

  No H/Q in entry =           7
  In of MODEL   82
    1    H    GLU  93           H        GLU  93   1.613  15.199   2.910
    2    HA   GLU  93           HA       GLU  93   1.051  17.100   4.923
    3    HB2  GLU  93           HB2      GLU  93   2.402  14.394   5.167
    4    HB3  GLU  93           HB3      GLU  93   1.696  15.315   6.497
    5    HG2  GLU  93           HG2      GLU  93   0.099  14.509   4.057
    6    HG3  GLU  93           HG3      GLU  93   0.212  13.491   5.488

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LEU  94           H        LEU  94   4.080  15.657   3.782
    2    HA   LEU  94           HA       LEU  94   5.811  16.833   5.670
    3    HB2  LEU  94           HB2      LEU  94   6.231  15.865   2.842
    4    HB3  LEU  94           HB3      LEU  94   7.550  16.543   3.793
    5    HG   LEU  94           HG       LEU  94   5.839  14.326   4.930
    6   HD11  LEU  94          HD11      LEU  94   7.941  14.124   2.803
    7   HD13  LEU  94          HD12      LEU  94   6.508  13.131   3.064
    8   HD12  LEU  94          HD13      LEU  94   7.935  12.900   4.074
    9   HD23  LEU  94          HD21      LEU  94   8.033  13.823   6.087
   10   HD22  LEU  94          HD22      LEU  94   7.344  15.393   6.499
   11   HD21  LEU  94          HD23      LEU  94   8.686  15.288   5.359

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  95           H        ILE  95   4.661  17.982   2.516
    2    HA   ILE  95           HA       ILE  95   6.201  20.360   2.453
    3    HB   ILE  95           HB       ILE  95   3.569  19.637   1.145
    4   HG12  ILE  95          HG12      ILE  95   6.355  20.010   0.012
    5   HG13  ILE  95          HG13      ILE  95   5.726  18.449   0.529
    6   HG21  ILE  95          HG21      ILE  95   5.284  22.128   0.922
    7   HG23  ILE  95          HG22      ILE  95   3.560  22.037   1.275
    8   HG22  ILE  95          HG23      ILE  95   4.151  21.641  -0.339
    9   HD13  ILE  95          HD11      ILE  95   4.171  18.348  -1.202
   10   HD12  ILE  95          HD12      ILE  95   5.510  19.183  -1.990
   11   HD11  ILE  95          HD13      ILE  95   4.123  20.100  -1.402

  No H/Q in entry =          11
  In of MODEL   82
    1    H    GLU  96           H        GLU  96   2.959  19.667   3.744
    2    HA   GLU  96           HA       GLU  96   2.301  22.307   4.488
    3    HB2  GLU  96           HB2      GLU  96   0.651  20.501   4.501
    4    HB3  GLU  96           HB3      GLU  96   1.522  19.688   5.800
    5    HG2  GLU  96           HG2      GLU  96   0.481  20.961   7.364
    6    HG3  GLU  96           HG3      GLU  96   0.997  22.440   6.565

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LEU  97           H        LEU  97   4.175  19.785   6.123
    2    HA   LEU  97           HA       LEU  97   4.510  21.144   8.591
    3    HB2  LEU  97           HB2      LEU  97   6.079  18.993   7.184
    4    HB3  LEU  97           HB3      LEU  97   6.657  19.689   8.696
    5    HG   LEU  97           HG       LEU  97   3.863  18.557   8.383
    6   HD12  LEU  97          HD11      LEU  97   4.828  16.560   9.602
    7   HD11  LEU  97          HD12      LEU  97   6.431  17.212   9.259
    8   HD13  LEU  97          HD13      LEU  97   5.370  16.737   7.933
    9   HD23  LEU  97          HD21      LEU  97   4.315  18.275  10.949
   10   HD22  LEU  97          HD22      LEU  97   3.914  19.880  10.339
   11   HD21  LEU  97          HD23      LEU  97   5.591  19.463  10.689

  No H/Q in entry =          11
  In of MODEL   82
    1    H    HIS  98           H        HIS  98   6.386  21.178   5.569
    2    HA   HIS  98           HA       HIS  98   8.517  22.788   6.468
    3    HB2  HIS  98           HB2      HIS  98   7.232  22.510   3.740
    4    HB3  HIS  98           HB3      HIS  98   8.658  23.508   4.031
    5    HD1  HIS  98           HD1      HIS  98   7.494  19.922   4.057
    6    HD2  HIS  98           HD2      HIS  98  11.047  22.066   4.484
    7    HE1  HIS  98           HE1      HIS  98   9.372  18.216   4.008
    8    HE2  HIS  98           HE2      HIS  98  11.539  19.502   4.268

  No H/Q in entry =           8
  In of MODEL   82
    1    H    GLU  99           H        GLU  99   5.287  23.578   5.285
    2    HA   GLU  99           HA       GLU  99   5.629  26.398   5.221
    3    HB2  GLU  99           HB2      GLU  99   3.768  25.201   4.090
    4    HB3  GLU  99           HB3      GLU  99   3.074  24.834   5.668
    5    HG2  GLU  99           HG2      GLU  99   2.861  27.225   6.163
    6    HG3  GLU  99           HG3      GLU  99   3.635  27.631   4.635

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LYS 100           H        LYS 100   4.523  24.153   7.746
    2    HA   LYS 100           HA       LYS 100   3.907  26.204   9.634
    3    HB2  LYS 100           HB2      LYS 100   4.519  23.261   9.988
    4    HB3  LYS 100           HB3      LYS 100   4.056  24.331  11.317
    5    HG2  LYS 100           HG2      LYS 100   1.984  24.939  10.063
    6    HG3  LYS 100           HG3      LYS 100   2.428  23.773   8.814
    7    HD2  LYS 100           HD2      LYS 100   2.371  21.955  10.480
    8    HD3  LYS 100           HD3      LYS 100   1.944  23.115  11.740
    9    HE2  LYS 100           HE2      LYS 100  -0.115  23.707  10.472
   10    HE3  LYS 100           HE3      LYS 100   0.303  22.490   9.259
   11    HZ1  LYS 100           HZ1      LYS 100   0.041  21.827  12.141
   12    HZ3  LYS 100           HZ2      LYS 100   0.041  20.769  10.809
   13    HZ2  LYS 100           HZ3      LYS 100  -1.288  21.792  11.084

  No H/Q in entry =          13
  In of MODEL   82
    1    H    LEU 101           H        LEU 101   6.854  24.444   8.810
    2    HA   LEU 101           HA       LEU 101   8.438  25.309  11.015
    3    HB2  LEU 101           HB2      LEU 101   9.050  24.324   8.240
    4    HB3  LEU 101           HB3      LEU 101  10.342  25.008   9.222
    5    HG   LEU 101           HG       LEU 101   8.535  22.831  10.287
    6   HD12  LEU 101          HD11      LEU 101  10.609  21.361   9.686
    7   HD11  LEU 101          HD12      LEU 101  10.962  22.626   8.511
    8   HD13  LEU 101          HD13      LEU 101   9.445  21.733   8.417
    9   HD21  LEU 101          HD21      LEU 101  11.244  23.975  11.018
   10   HD23  LEU 101          HD22      LEU 101  10.719  22.397  11.600
   11   HD22  LEU 101          HD23      LEU 101   9.808  23.843  12.033

  No H/Q in entry =          11
  In of MODEL   82
    1    H    LYS 102           H        LYS 102   6.835  27.148   8.866
    2    HA   LYS 102           HA       LYS 102   6.885  29.441   8.570
    3    HB2  LYS 102           HB2      LYS 102   8.447  29.350  10.671
    4    HB3  LYS 102           HB3      LYS 102   9.746  29.558   9.514
    5    HG2  LYS 102           HG2      LYS 102   7.615  31.487  10.367
    6    HG3  LYS 102           HG3      LYS 102   9.324  31.767  10.118
    7    HD2  LYS 102           HD2      LYS 102   7.383  31.315   7.816
    8    HD3  LYS 102           HD3      LYS 102   7.745  32.901   8.481
    9    HE2  LYS 102           HE2      LYS 102   9.136  31.729   6.413
   10    HE3  LYS 102           HE3      LYS 102   9.735  33.045   7.422
   11    HZ2  LYS 102           HZ1      LYS 102  11.279  31.159   7.254
   12    HZ1  LYS 102           HZ2      LYS 102  10.128  30.164   7.997
   13    HZ3  LYS 102           HZ3      LYS 102  10.802  31.461   8.854

  No H/Q in entry =          13
  In of MODEL   82
    1    H    ALA 103           H        ALA 103  10.159  28.141   8.014
    2    HA   ALA 103           HA       ALA 103  11.110  29.525   5.937
    3    HB2  ALA 103           HB1      ALA 103  12.024  27.320   5.016
    4    HB1  ALA 103           HB2      ALA 103  11.136  26.538   6.322
    5    HB3  ALA 103           HB3      ALA 103  12.411  27.698   6.695

  No H/Q in entry =           5
  In of MODEL   82
    1    H1   LYS   3           H1       LYS   3 -30.992   6.536 -19.574
    2    H2   LYS   3           H3       LYS   3 -30.019   6.226 -20.931
    3    H3   LYS   3           H2       LYS   3 -31.433   5.322 -20.676
    4    HA   LYS   3           HA       LYS   3 -30.455   3.908 -19.280
    5    HB2  LYS   3           HB2      LYS   3 -28.149   5.269 -20.624
    6    HB3  LYS   3           HB3      LYS   3 -27.845   4.052 -19.385
    7    HG2  LYS   3           HG2      LYS   3 -29.312   2.501 -20.729
    8    HG3  LYS   3           HG3      LYS   3 -29.246   3.702 -22.018
    9    HD2  LYS   3           HD2      LYS   3 -26.766   3.530 -21.982
   10    HD3  LYS   3           HD3      LYS   3 -26.908   2.233 -20.797
   11    HE2  LYS   3           HE2      LYS   3 -28.443   1.096 -22.506
   12    HE3  LYS   3           HE3      LYS   3 -27.803   2.261 -23.664
   13    HZ3  LYS   3           HZ1      LYS   3 -26.036   0.991 -23.946
   14    HZ2  LYS   3           HZ2      LYS   3 -26.687  -0.164 -22.884
   15    HZ1  LYS   3           HZ3      LYS   3 -25.665   1.056 -22.290

  No H/Q in entry =          15
  In of MODEL   82
    1    H    LYS   4           H        LYS   4 -30.498   3.764 -17.219
    2    HA   LYS   4           HA       LYS   4 -29.705   6.030 -15.570
    3    HB2  LYS   4           HB2      LYS   4 -30.965   3.366 -14.867
    4    HB3  LYS   4           HB3      LYS   4 -30.705   4.697 -13.740
    5    HG2  LYS   4           HG2      LYS   4 -32.528   4.682 -16.150
    6    HG3  LYS   4           HG3      LYS   4 -33.008   4.742 -14.456
    7    HD2  LYS   4           HD2      LYS   4 -32.257   6.946 -14.190
    8    HD3  LYS   4           HD3      LYS   4 -31.228   6.865 -15.620
    9    HE2  LYS   4           HE2      LYS   4 -33.122   8.286 -16.069
   10    HE3  LYS   4           HE3      LYS   4 -33.243   6.817 -17.038
   11    HZ3  LYS   4           HZ1      LYS   4 -34.831   5.942 -15.483
   12    HZ2  LYS   4           HZ2      LYS   4 -35.353   7.451 -16.062
   13    HZ1  LYS   4           HZ3      LYS   4 -34.690   7.322 -14.503

  No H/Q in entry =          13
  In of MODEL   82
    1    H    HIS   5           H        HIS   5 -28.225   6.077 -13.987
    2    HA   HIS   5           HA       HIS   5 -25.990   4.191 -14.334
    3    HB2  HIS   5           HB2      HIS   5 -26.169   6.950 -13.123
    4    HB3  HIS   5           HB3      HIS   5 -24.711   5.959 -13.117
    5    HD1  HIS   5           HD1      HIS   5 -23.221   7.123 -14.714
    6    HD2  HIS   5           HD2      HIS   5 -27.046   6.601 -16.245
    7    HE1  HIS   5           HE1      HIS   5 -23.054   7.702 -17.165
    8    HE2  HIS   5           HE2      HIS   5 -25.386   7.372 -18.066

  No H/Q in entry =           8
  In of MODEL   82
    1    H    ILE   6           H        ILE   6 -25.793   2.611 -13.021
    2    HA   ILE   6           HA       ILE   6 -26.745   2.901 -10.251
    3    HB   ILE   6           HB       ILE   6 -25.994   0.416 -11.797
    4   HG12  ILE   6          HG12      ILE   6 -28.706   1.422 -10.928
    5   HG13  ILE   6          HG13      ILE   6 -28.070   1.569 -12.566
    6   HG23  ILE   6          HG21      ILE   6 -26.388  -0.830  -9.936
    7   HG22  ILE   6          HG22      ILE   6 -27.511   0.346  -9.248
    8   HG21  ILE   6          HG23      ILE   6 -25.773   0.636  -9.169
    9   HD13  ILE   6          HD11      ILE   6 -28.587  -0.536 -13.067
   10   HD12  ILE   6          HD12      ILE   6 -29.593  -0.496 -11.618
   11   HD11  ILE   6          HD13      ILE   6 -27.956  -1.145 -11.537

  No H/Q in entry =          11
  In of MODEL   82
    1    H    TYR   7           H        TYR   7 -24.962   3.494  -8.974
    2    HA   TYR   7           HA       TYR   7 -22.281   2.466  -9.672
    3    HB2  TYR   7           HB2      TYR   7 -23.171   4.923  -8.182
    4    HB3  TYR   7           HB3      TYR   7 -21.501   4.364  -8.232
    5    HD1  TYR   7           HD1      TYR   7 -22.584   3.454 -11.316
    6    HD2  TYR   7           HD2      TYR   7 -21.806   7.003  -9.089
    7    HE1  TYR   7           HE1      TYR   7 -22.133   4.674 -13.408
    8    HE2  TYR   7           HE2      TYR   7 -21.397   8.231 -11.173
    9    HH   TYR   7           HH       TYR   7 -21.631   8.153 -13.405

  No H/Q in entry =           9
  In of MODEL   82
    1    H    LEU   8           H        LEU   8 -21.343   1.087  -8.350
    2    HA   LEU   8           HA       LEU   8 -22.471   0.619  -5.661
    3    HB2  LEU   8           HB2      LEU   8 -20.824  -1.086  -7.507
    4    HB3  LEU   8           HB3      LEU   8 -21.010  -1.466  -5.795
    5    HG   LEU   8           HG       LEU   8 -23.495  -1.571  -6.203
    6   HD13  LEU   8          HD11      LEU   8 -23.606  -0.349  -8.310
    7   HD12  LEU   8          HD12      LEU   8 -24.182  -1.999  -8.549
    8   HD11  LEU   8          HD13      LEU   8 -22.565  -1.542  -9.083
    9   HD23  LEU   8          HD21      LEU   8 -22.286  -3.643  -7.906
   10   HD22  LEU   8          HD22      LEU   8 -23.369  -3.784  -6.522
   11   HD21  LEU   8          HD23      LEU   8 -21.652  -3.477  -6.270

  No H/Q in entry =          11
  In of MODEL   82
    1    H    PHE   9           H        PHE   9 -21.173   0.981  -3.874
    2    HA   PHE   9           HA       PHE   9 -18.372   1.844  -4.421
    3    HB2  PHE   9           HB2      PHE   9 -20.350   2.946  -2.433
    4    HB3  PHE   9           HB3      PHE   9 -18.628   3.290  -2.376
    5    HD1  PHE   9           HD1      PHE   9 -17.536   4.572  -4.161
    6    HD2  PHE   9           HD2      PHE   9 -21.774   3.901  -4.168
    7    HE1  PHE   9           HE1      PHE   9 -17.812   6.324  -5.889
    8    HE2  PHE   9           HE2      PHE   9 -22.050   5.666  -5.890
    9    HZ   PHE   9           HZ       PHE   9 -20.067   6.873  -6.757

  No H/Q in entry =           9
  In of MODEL   82
    1    H    SER  10           H        SER  10 -16.797   0.802  -3.380
    2    HA   SER  10           HA       SER  10 -16.989  -0.122  -0.689
    3    HB2  SER  10           HB2      SER  10 -18.253  -1.943  -1.804
    4    HB3  SER  10           HB3      SER  10 -16.873  -2.226  -2.853
    5    HG   SER  10           HG       SER  10 -16.238  -2.131  -0.200

  No H/Q in entry =           5
  In of MODEL   82
    1    H    SER  11           H        SER  11 -14.972   0.012   0.111
    2    HA   SER  11           HA       SER  11 -12.793   0.838  -1.436
    3    HB2  SER  11           HB2      SER  11 -11.495   0.657   0.557
    4    HB3  SER  11           HB3      SER  11 -13.119   1.160   1.031
    5    HG   SER  11           HG       SER  11 -12.620  -1.575   0.872

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ALA  12           H        ALA  12 -14.036  -1.878  -2.186
    2    HA   ALA  12           HA       ALA  12 -11.470  -3.119  -2.785
    3    HB1  ALA  12           HB1      ALA  12 -13.654  -4.793  -1.537
    4    HB3  ALA  12           HB2      ALA  12 -12.279  -4.164  -0.632
    5    HB2  ALA  12           HB3      ALA  12 -12.015  -5.296  -1.957

  No H/Q in entry =           5
  In of MODEL   82
    1    H    GLY  13           H        GLY  13 -12.232  -2.166  -4.810
    2    HA3  GLY  13           HA2      GLY  13 -14.519  -2.816  -6.231
    3    HA2  GLY  13           HA3      GLY  13 -12.968  -2.420  -6.985

  No H/Q in entry =           3
  In of MODEL   82
    1    H    MET  14           H        MET  14 -11.509  -4.723  -6.056
    2    HA   MET  14           HA       MET  14 -11.964  -6.493  -8.136
    3    HB2  MET  14           HB2      MET  14  -9.896  -6.608  -6.841
    4    HB3  MET  14           HB3      MET  14 -10.767  -7.238  -5.444
    5    HG2  MET  14           HG2      MET  14 -11.424  -9.227  -6.787
    6    HG3  MET  14           HG3      MET  14 -10.507  -8.591  -8.153
    7    HE2  MET  14           HE1      MET  14  -7.744  -7.386  -6.770
    8    HE1  MET  14           HE2      MET  14  -8.275  -8.107  -8.287
    9    HE3  MET  14           HE3      MET  14  -6.945  -8.838  -7.393

  No H/Q in entry =           9
  In of MODEL   82
    1    H    SER  15           H        SER  15 -13.213  -6.885  -4.827
    2    HA   SER  15           HA       SER  15 -14.626  -9.311  -5.537
    3    HB2  SER  15           HB2      SER  15 -14.738  -7.591  -3.057
    4    HB3  SER  15           HB3      SER  15 -15.853  -8.928  -3.325
    5    HG   SER  15           HG       SER  15 -13.050  -8.955  -2.985

  No H/Q in entry =           5
  In of MODEL   82
    1    H    THR  16           H        THR  16 -15.591  -5.894  -5.078
    2    HA   THR  16           HA       THR  16 -18.404  -6.311  -5.546
    3    HB   THR  16           HB       THR  16 -16.784  -3.799  -6.091
    4    HG1  THR  16           HG1      THR  16 -18.090  -4.035  -3.691
    5   HG21  THR  16          HG21      THR  16 -19.679  -4.348  -5.406
    6   HG23  THR  16          HG22      THR  16 -19.052  -3.643  -6.906
    7   HG22  THR  16          HG23      THR  16 -18.959  -2.743  -5.387

  No H/Q in entry =           7
  In of MODEL   82
    1    H    SER  17           H        SER  17 -15.605  -5.818  -7.439
    2    HA   SER  17           HA       SER  17 -16.726  -5.047  -9.934
    3    HB2  SER  17           HB2      SER  17 -14.129  -6.437  -9.246
    4    HB3  SER  17           HB3      SER  17 -14.567  -5.985 -10.894
    5    HG   SER  17           HG       SER  17 -13.627  -4.190 -10.330

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LEU  18           H        LEU  18 -16.231  -8.207  -8.490
    2    HA   LEU  18           HA       LEU  18 -16.868  -9.689 -10.844
    3    HB2  LEU  18           HB2      LEU  18 -15.664 -10.694  -8.962
    4    HB3  LEU  18           HB3      LEU  18 -17.067 -10.444  -7.923
    5    HG   LEU  18           HG       LEU  18 -18.377 -11.930  -9.455
    6   HD11  LEU  18          HD11      LEU  18 -15.662 -12.139 -10.729
    7   HD13  LEU  18          HD12      LEU  18 -17.230 -11.894 -11.498
    8   HD12  LEU  18          HD13      LEU  18 -16.810 -13.471 -10.834
    9   HD21  LEU  18          HD21      LEU  18 -15.950 -13.039  -8.082
   10   HD23  LEU  18          HD22      LEU  18 -17.312 -14.007  -8.646
   11   HD22  LEU  18          HD23      LEU  18 -17.556 -12.786  -7.398

  No H/Q in entry =          11
  In of MODEL   82
    1    H    LEU  19           H        LEU  19 -18.792  -8.434  -8.122
    2    HA   LEU  19           HA       LEU  19 -21.288  -9.553  -8.944
    3    HB2  LEU  19           HB2      LEU  19 -20.959  -8.715  -6.690
    4    HB3  LEU  19           HB3      LEU  19 -20.688  -7.089  -7.313
    5    HG   LEU  19           HG       LEU  19 -23.015  -6.895  -7.941
    6   HD13  LEU  19          HD11      LEU  19 -23.851  -8.942  -8.572
    7   HD12  LEU  19          HD12      LEU  19 -24.486  -8.855  -6.930
    8   HD11  LEU  19          HD13      LEU  19 -23.034  -9.797  -7.265
    9   HD22  LEU  19          HD21      LEU  19 -22.564  -6.158  -5.763
   10   HD21  LEU  19          HD22      LEU  19 -22.429  -7.804  -5.142
   11   HD23  LEU  19          HD23      LEU  19 -24.004  -7.166  -5.616

  No H/Q in entry =          11
  In of MODEL   82
    1    H    VAL  20           H        VAL  20 -19.716  -6.431  -9.644
    2    HA   VAL  20           HA       VAL  20 -21.808  -5.333 -11.201
    3    HB   VAL  20           HB       VAL  20 -18.806  -4.818 -11.324
    4   HG12  VAL  20          HG11      VAL  20 -19.548  -2.688 -12.542
    5   HG11  VAL  20          HG12      VAL  20 -21.073  -3.521 -12.840
    6   HG13  VAL  20          HG13      VAL  20 -19.568  -4.180 -13.481
    7   HG21  VAL  20          HG21      VAL  20 -21.123  -3.437 -10.017
    8   HG23  VAL  20          HG22      VAL  20 -19.599  -2.610 -10.332
    9   HG22  VAL  20          HG23      VAL  20 -19.632  -4.029  -9.285

  No H/Q in entry =           9
  In of MODEL   82
    1    H    SER  21           H        SER  21 -19.109  -7.453 -12.243
    2    HA   SER  21           HA       SER  21 -19.903  -7.318 -14.991
    3    HB2  SER  21           HB2      SER  21 -18.519  -9.319 -15.334
    4    HB3  SER  21           HB3      SER  21 -17.654  -8.098 -14.403
    5    HG   SER  21           HG       SER  21 -18.637  -9.381 -12.549

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LYS  22           H        LYS  22 -21.011  -9.478 -12.416
    2    HA   LYS  22           HA       LYS  22 -22.601 -11.056 -14.231
    3    HB2  LYS  22           HB2      LYS  22 -21.905 -11.229 -11.525
    4    HB3  LYS  22           HB3      LYS  22 -23.652 -10.995 -11.542
    5    HG2  LYS  22           HG2      LYS  22 -22.187 -13.162 -13.041
    6    HG3  LYS  22           HG3      LYS  22 -22.993 -13.371 -11.487
    7    HD2  LYS  22           HD2      LYS  22 -25.135 -12.757 -12.524
    8    HD3  LYS  22           HD3      LYS  22 -24.322 -12.571 -14.079
    9    HE2  LYS  22           HE2      LYS  22 -23.723 -14.945 -14.065
   10    HE3  LYS  22           HE3      LYS  22 -24.489 -15.143 -12.488
   11    HZ2  LYS  22           HZ1      LYS  22 -25.670 -15.597 -14.862
   12    HZ1  LYS  22           HZ2      LYS  22 -26.222 -14.032 -14.496
   13    HZ3  LYS  22           HZ3      LYS  22 -26.490 -15.306 -13.404

  No H/Q in entry =          13
  In of MODEL   82
    1    H    MET  23           H        MET  23 -23.238  -8.119 -12.356
    2    HA   MET  23           HA       MET  23 -26.049  -8.122 -12.849
    3    HB2  MET  23           HB2      MET  23 -24.138  -5.864 -12.283
    4    HB3  MET  23           HB3      MET  23 -25.879  -5.649 -12.452
    5    HG2  MET  23           HG2      MET  23 -26.296  -6.943 -10.483
    6    HG3  MET  23           HG3      MET  23 -24.597  -7.400 -10.365
    7    HE2  MET  23           HE1      MET  23 -26.790  -3.691  -9.161
    8    HE1  MET  23           HE2      MET  23 -27.078  -4.649 -10.612
    9    HE3  MET  23           HE3      MET  23 -26.005  -3.251 -10.679

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ARG  24           H        ARG  24 -23.266  -6.766 -14.645
    2    HA   ARG  24           HA       ARG  24 -24.737  -5.423 -16.635
    3    HB2  ARG  24           HB2      ARG  24 -22.281  -5.096 -16.260
    4    HB3  ARG  24           HB3      ARG  24 -21.994  -6.697 -16.898
    5    HG2  ARG  24           HG2      ARG  24 -22.854  -5.995 -19.129
    6    HG3  ARG  24           HG3      ARG  24 -23.161  -4.366 -18.470
    7    HD2  ARG  24           HD2      ARG  24 -20.705  -4.315 -17.765
    8    HD3  ARG  24           HD3      ARG  24 -20.502  -5.785 -18.709
    9    HE   ARG  24           HE       ARG  24 -21.511  -4.187 -20.556
   10   HH21  ARG  24          HH11      ARG  24 -19.916  -4.033 -22.134
   11   HH22  ARG  24          HH12      ARG  24 -18.356  -3.417 -21.717
   12   HH11  ARG  24          HH21      ARG  24 -19.115  -3.517 -18.262
   13   HH12  ARG  24          HH22      ARG  24 -17.895  -3.105 -19.425

  No H/Q in entry =          13
  In of MODEL   82
    1    H    ALA  25           H        ALA  25 -23.707  -8.791 -16.370
    2    HA   ALA  25           HA       ALA  25 -24.371  -9.600 -19.005
    3    HB1  ALA  25           HB1      ALA  25 -23.729 -11.651 -18.316
    4    HB3  ALA  25           HB2      ALA  25 -24.779 -11.604 -16.900
    5    HB2  ALA  25           HB3      ALA  25 -23.201 -10.821 -16.853

  No H/Q in entry =           5
  In of MODEL   82
    1    H    GLN  26           H        GLN  26 -26.184  -9.593 -15.973
    2    HA   GLN  26           HA       GLN  26 -28.565 -10.726 -16.980
    3    HB2  GLN  26           HB2      GLN  26 -27.992  -8.999 -14.593
    4    HB3  GLN  26           HB3      GLN  26 -29.576  -9.677 -14.937
    5    HG2  GLN  26           HG2      GLN  26 -27.031 -11.208 -14.483
    6    HG3  GLN  26           HG3      GLN  26 -28.383 -11.068 -13.367
    7   HE21  GLN  26          HE21      GLN  26 -27.233 -13.264 -14.653
    8   HE22  GLN  26          HE22      GLN  26 -28.309 -14.280 -15.446

  No H/Q in entry =           8
  In of MODEL   82
    1    H    ALA  27           H        ALA  27 -27.533  -7.358 -16.587
    2    HA   ALA  27           HA       ALA  27 -29.994  -6.193 -17.357
    3    HB1  ALA  27           HB1      ALA  27 -28.142  -4.932 -16.247
    4    HB3  ALA  27           HB2      ALA  27 -28.717  -4.146 -17.719
    5    HB2  ALA  27           HB3      ALA  27 -27.207  -5.057 -17.738

  No H/Q in entry =           5
  In of MODEL   82
    1    H    GLU  28           H        GLU  28 -27.338  -7.487 -19.241
    2    HA   GLU  28           HA       GLU  28 -28.254  -6.416 -21.753
    3    HB2  GLU  28           HB2      GLU  28 -25.893  -7.168 -21.142
    4    HB3  GLU  28           HB3      GLU  28 -26.486  -8.815 -21.346
    5    HG2  GLU  28           HG2      GLU  28 -25.327  -8.067 -23.318
    6    HG3  GLU  28           HG3      GLU  28 -27.035  -8.341 -23.659

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LYS  29           H        LYS  29 -28.502  -9.519 -20.104
    2    HA   LYS  29           HA       LYS  29 -29.856 -10.947 -22.106
    3    HB2  LYS  29           HB2      LYS  29 -28.825 -11.966 -20.109
    4    HB3  LYS  29           HB3      LYS  29 -30.071 -11.225 -19.107
    5    HG2  LYS  29           HG2      LYS  29 -31.776 -12.546 -20.170
    6    HG3  LYS  29           HG3      LYS  29 -30.601 -13.212 -21.302
    7    HD2  LYS  29           HD2      LYS  29 -29.484 -14.416 -19.577
    8    HD3  LYS  29           HD3      LYS  29 -30.361 -13.553 -18.315
    9    HE2  LYS  29           HE2      LYS  29 -31.182 -15.878 -18.680
   10    HE3  LYS  29           HE3      LYS  29 -32.426 -14.649 -18.915
   11    HZ1  LYS  29           HZ1      LYS  29 -31.877 -14.792 -21.345
   12    HZ3  LYS  29           HZ2      LYS  29 -32.633 -16.160 -20.681
   13    HZ2  LYS  29           HZ3      LYS  29 -30.964 -16.178 -20.986

  No H/Q in entry =          13
  In of MODEL   82
    1    H    TYR  30           H        TYR  30 -31.175  -8.810 -19.590
    2    HA   TYR  30           HA       TYR  30 -33.855  -9.178 -20.821
    3    HB2  TYR  30           HB2      TYR  30 -33.157  -8.052 -18.099
    4    HB3  TYR  30           HB3      TYR  30 -34.784  -8.262 -18.745
    5    HD1  TYR  30           HD1      TYR  30 -35.760 -10.526 -18.962
    6    HD2  TYR  30           HD2      TYR  30 -31.899  -9.919 -17.273
    7    HE1  TYR  30           HE1      TYR  30 -35.734 -12.858 -18.172
    8    HE2  TYR  30           HE2      TYR  30 -31.872 -12.237 -16.487
    9    HH   TYR  30           HH       TYR  30 -33.584 -14.547 -17.580

  No H/Q in entry =           9
  In of MODEL   82
    1    H    GLU  31           H        GLU  31 -31.637  -7.247 -21.625
    2    HA   GLU  31           HA       GLU  31 -31.505  -5.091 -22.442
    3    HB2  GLU  31           HB2      GLU  31 -34.422  -5.723 -22.943
    4    HB3  GLU  31           HB3      GLU  31 -33.547  -4.377 -23.672
    5    HG2  GLU  31           HG2      GLU  31 -32.121  -5.852 -24.874
    6    HG3  GLU  31           HG3      GLU  31 -32.721  -7.252 -23.988

  No H/Q in entry =           6
  In of MODEL   82
    1    H    VAL  32           H        VAL  32 -31.689  -4.992 -19.708
    2    HA   VAL  32           HA       VAL  32 -33.490  -2.830 -19.035
    3    HB   VAL  32           HB       VAL  32 -31.118  -3.895 -17.468
    4   HG12  VAL  32          HG11      VAL  32 -32.622  -3.035 -15.563
    5   HG11  VAL  32          HG12      VAL  32 -33.436  -2.104 -16.821
    6   HG13  VAL  32          HG13      VAL  32 -31.720  -1.849 -16.507
    7   HG21  VAL  32          HG21      VAL  32 -32.936  -5.563 -18.153
    8   HG23  VAL  32          HG22      VAL  32 -33.948  -4.711 -16.986
    9   HG22  VAL  32          HG23      VAL  32 -32.449  -5.478 -16.460

  No H/Q in entry =           9
  In of MODEL   82
    1    HA   PRO  33           HA       PRO  33 -30.386   0.019 -20.714
    2    HB2  PRO  33           HB2      PRO  33 -31.836   2.282 -20.576
    3    HB3  PRO  33           HB3      PRO  33 -32.344   0.997 -21.671
    4    HG2  PRO  33           HG2      PRO  33 -33.285   1.530 -18.853
    5    HG3  PRO  33           HG3      PRO  33 -34.261   1.352 -20.311
    6    HD2  PRO  33           HD2      PRO  33 -33.855  -0.737 -18.653
    7    HD3  PRO  33           HD3      PRO  33 -33.931  -0.971 -20.400

  No H/Q in entry =           7
  In of MODEL   82
    1    H    VAL  34           H        VAL  34 -29.128  -0.565 -18.772
    2    HA   VAL  34           HA       VAL  34 -28.772   1.846 -17.119
    3    HB   VAL  34           HB       VAL  34 -28.221   0.363 -15.188
    4   HG12  VAL  34          HG11      VAL  34 -30.655  -0.446 -14.872
    5   HG11  VAL  34          HG12      VAL  34 -30.957   0.328 -16.426
    6   HG13  VAL  34          HG13      VAL  34 -30.373   1.284 -15.065
    7   HG21  VAL  34          HG21      VAL  34 -28.470  -1.651 -17.201
    8   HG23  VAL  34          HG22      VAL  34 -29.530  -1.988 -15.832
    9   HG22  VAL  34          HG23      VAL  34 -27.803  -1.748 -15.571

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ILE  35           H        ILE  35 -26.781   2.225 -16.286
    2    HA   ILE  35           HA       ILE  35 -24.518   0.840 -17.565
    3    HB   ILE  35           HB       ILE  35 -24.838   3.737 -16.742
    4   HG12  ILE  35          HG12      ILE  35 -23.902   2.413 -19.296
    5   HG13  ILE  35          HG13      ILE  35 -25.515   3.075 -19.026
    6   HG21  ILE  35          HG21      ILE  35 -22.319   2.138 -17.068
    7   HG23  ILE  35          HG22      ILE  35 -22.736   3.324 -15.833
    8   HG22  ILE  35          HG23      ILE  35 -22.348   3.854 -17.469
    9   HD11  ILE  35          HD11      ILE  35 -24.053   5.230 -18.424
   10   HD13  ILE  35          HD12      ILE  35 -24.608   4.867 -20.059
   11   HD12  ILE  35          HD13      ILE  35 -22.963   4.452 -19.572

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ILE  36           H        ILE  36 -23.307  -0.221 -15.974
    2    HA   ILE  36           HA       ILE  36 -23.718   0.395 -13.099
    3    HB   ILE  36           HB       ILE  36 -22.967  -2.324 -14.220
    4   HG12  ILE  36          HG12      ILE  36 -25.749  -1.448 -13.440
    5   HG13  ILE  36          HG13      ILE  36 -25.185  -1.436 -15.111
    6   HG23  ILE  36          HG21      ILE  36 -23.330  -3.151 -12.108
    7   HG22  ILE  36          HG22      ILE  36 -24.421  -1.840 -11.659
    8   HG21  ILE  36          HG23      ILE  36 -22.682  -1.553 -11.737
    9   HD13  ILE  36          HD11      ILE  36 -25.409  -3.644 -15.325
   10   HD12  ILE  36          HD12      ILE  36 -26.464  -3.500 -13.919
   11   HD11  ILE  36          HD13      ILE  36 -24.777  -3.964 -13.709

  No H/Q in entry =          11
  In of MODEL   82
    1    H    GLU  37           H        GLU  37 -21.916   0.974 -12.002
    2    HA   GLU  37           HA       GLU  37 -19.251   0.112 -12.933
    3    HB2  GLU  37           HB2      GLU  37 -20.071   2.921 -12.216
    4    HB3  GLU  37           HB3      GLU  37 -18.398   2.384 -12.364
    5    HG2  GLU  37           HG2      GLU  37 -20.420   2.432 -14.586
    6    HG3  GLU  37           HG3      GLU  37 -19.167   3.639 -14.309

  No H/Q in entry =           6
  In of MODEL   82
    1    H    ALA  38           H        ALA  38 -17.763  -0.171 -11.259
    2    HA   ALA  38           HA       ALA  38 -18.776   0.025  -8.483
    3    HB1  ALA  38           HB1      ALA  38 -17.120  -1.952  -9.923
    4    HB3  ALA  38           HB2      ALA  38 -18.168  -2.166  -8.521
    5    HB2  ALA  38           HB3      ALA  38 -16.538  -1.526  -8.314

  No H/Q in entry =           5
  In of MODEL   82
    1    H    PHE  39           H        PHE  39 -17.499   1.197  -7.011
    2    HA   PHE  39           HA       PHE  39 -14.949   2.339  -7.916
    3    HB2  PHE  39           HB2      PHE  39 -17.322   3.882  -6.890
    4    HB3  PHE  39           HB3      PHE  39 -15.678   4.510  -6.794
    5    HD1  PHE  39           HD1      PHE  39 -14.355   4.482  -9.053
    6    HD2  PHE  39           HD2      PHE  39 -18.605   4.402  -8.712
    7    HE1  PHE  39           HE1      PHE  39 -14.545   5.376 -11.357
    8    HE2  PHE  39           HE2      PHE  39 -18.811   5.286 -11.008
    9    HZ   PHE  39           HZ       PHE  39 -16.787   5.747 -12.349

  No H/Q in entry =           9
  In of MODEL   82
    1    HA   PRO  40           HA       PRO  40 -14.008   1.548  -3.637
    2    HB2  PRO  40           HB2      PRO  40 -12.190   3.517  -3.032
    3    HB3  PRO  40           HB3      PRO  40 -11.784   2.179  -4.107
    4    HG2  PRO  40           HG2      PRO  40 -12.746   4.941  -4.839
    5    HG3  PRO  40           HG3      PRO  40 -11.342   4.068  -5.454
    6    HD2  PRO  40           HD2      PRO  40 -13.573   4.038  -6.853
    7    HD3  PRO  40           HD3      PRO  40 -12.654   2.545  -6.671

  No H/Q in entry =           7
  In of MODEL   82
    1    H    GLU  41           H        GLU  41 -14.596   2.534  -1.500
    2    HA   GLU  41           HA       GLU  41 -16.799   4.289  -1.467
    3    HB2  GLU  41           HB2      GLU  41 -16.702   4.145   0.883
    4    HB3  GLU  41           HB3      GLU  41 -16.116   2.588   0.299
    5    HG2  GLU  41           HG2      GLU  41 -13.795   3.359   0.682
    6    HG3  GLU  41           HG3      GLU  41 -14.436   4.857   1.358

  No H/Q in entry =           6
  In of MODEL   82
    1    H    THR  42           H        THR  42 -13.448   5.128  -1.532
    2    HA   THR  42           HA       THR  42 -13.734   7.691  -0.310
    3    HB   THR  42           HB       THR  42 -11.571   8.219  -1.421
    4    HG1  THR  42           HG1      THR  42 -10.675   6.281  -2.553
    5   HG22  THR  42          HG21      THR  42 -10.263   6.372  -0.372
    6   HG21  THR  42          HG22      THR  42 -11.769   5.484  -0.137
    7   HG23  THR  42          HG23      THR  42 -11.511   7.017   0.693

  No H/Q in entry =           7
  In of MODEL   82
    1    H    LEU  43           H        LEU  43 -14.679   6.630  -3.410
    2    HA   LEU  43           HA       LEU  43 -14.872   9.409  -4.370
    3    HB2  LEU  43           HB2      LEU  43 -15.277   6.768  -5.760
    4    HB3  LEU  43           HB3      LEU  43 -15.503   8.343  -6.517
    5    HG   LEU  43           HG       LEU  43 -12.870   7.272  -5.534
    6   HD11  LEU  43          HD11      LEU  43 -14.037   6.161  -7.570
    7   HD13  LEU  43          HD12      LEU  43 -12.357   6.675  -7.719
    8   HD12  LEU  43          HD13      LEU  43 -13.645   7.667  -8.399
    9   HD23  LEU  43          HD21      LEU  43 -12.019   9.178  -6.944
   10   HD22  LEU  43          HD22      LEU  43 -12.883   9.663  -5.485
   11   HD21  LEU  43          HD23      LEU  43 -13.682   9.752  -7.053

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ALA  44           H        ALA  44 -16.851   7.625  -2.513
    2    HA   ALA  44           HA       ALA  44 -19.337   7.546  -3.823
    3    HB2  ALA  44           HB1      ALA  44 -19.215   6.420  -1.731
    4    HB3  ALA  44           HB2      ALA  44 -20.289   7.789  -1.449
    5    HB1  ALA  44           HB3      ALA  44 -18.614   7.857  -0.905

  No H/Q in entry =           5
  In of MODEL   82
    1    H    GLY  45           H        GLY  45 -17.846  10.308  -2.290
    2    HA3  GLY  45           HA2      GLY  45 -20.248  11.865  -2.634
    3    HA2  GLY  45           HA3      GLY  45 -18.687  12.452  -2.063

  No H/Q in entry =           3
  In of MODEL   82
    1    H    GLU  46           H        GLU  46 -17.190  11.487  -4.364
    2    HA   GLU  46           HA       GLU  46 -17.783  13.722  -6.123
    3    HB2  GLU  46           HB2      GLU  46 -15.638  11.594  -6.156
    4    HB3  GLU  46           HB3      GLU  46 -15.744  12.910  -7.325
    5    HG2  GLU  46           HG2      GLU  46 -15.394  14.539  -5.574
    6    HG3  GLU  46           HG3      GLU  46 -15.380  13.262  -4.357

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LYS  47           H        LYS  47 -17.748  10.203  -6.569
    2    HA   LYS  47           HA       LYS  47 -18.854  10.456  -9.239
    3    HB2  LYS  47           HB2      LYS  47 -17.764   8.306  -7.551
    4    HB3  LYS  47           HB3      LYS  47 -19.114   7.821  -8.576
    5    HG2  LYS  47           HG2      LYS  47 -16.988   7.393  -9.660
    6    HG3  LYS  47           HG3      LYS  47 -17.914   8.609 -10.537
    7    HD2  LYS  47           HD2      LYS  47 -16.615  10.378  -9.450
    8    HD3  LYS  47           HD3      LYS  47 -15.683   9.158  -8.585
    9    HE2  LYS  47           HE2      LYS  47 -14.836   8.281 -10.682
   10    HE3  LYS  47           HE3      LYS  47 -15.823   9.431 -11.582
   11    HZ1  LYS  47           HZ1      LYS  47 -14.594  11.181 -10.232
   12    HZ3  LYS  47           HZ2      LYS  47 -13.753  10.414 -11.491
   13    HZ2  LYS  47           HZ3      LYS  47 -13.476   9.951  -9.881

  No H/Q in entry =          13
  In of MODEL   82
    1    H    GLY  48           H        GLY  48 -20.178   9.721  -6.086
    2    HA3  GLY  48           HA2      GLY  48 -22.594   8.594  -6.818
    3    HA2  GLY  48           HA3      GLY  48 -22.339   9.577  -5.377

  No H/Q in entry =           3
  In of MODEL   82
    1    H    GLN  49           H        GLN  49 -21.707  11.991  -6.944
    2    HA   GLN  49           HA       GLN  49 -24.240  13.162  -7.072
    3    HB2  GLN  49           HB2      GLN  49 -21.684  13.971  -8.443
    4    HB3  GLN  49           HB3      GLN  49 -23.123  14.969  -8.349
    5    HG2  GLN  49           HG2      GLN  49 -22.951  14.982  -5.913
    6    HG3  GLN  49           HG3      GLN  49 -21.526  13.962  -6.006
    7   HE21  GLN  49          HE21      GLN  49 -21.350  16.184  -4.727
    8   HE22  GLN  49          HE22      GLN  49 -20.401  17.420  -5.376

  No H/Q in entry =           8
  In of MODEL   82
    1    H    ASN  50           H        ASN  50 -22.617  11.251  -9.473
    2    HA   ASN  50           HA       ASN  50 -24.490  12.173 -11.544
    3    HB2  ASN  50           HB2      ASN  50 -21.948  10.574 -11.795
    4    HB3  ASN  50           HB3      ASN  50 -22.994  11.028 -13.131
    5   HD21  ASN  50          HD21      ASN  50 -20.331  11.807 -11.531
    6   HD22  ASN  50          HD22      ASN  50 -20.061  13.437 -11.870

  No H/Q in entry =           6
  In of MODEL   82
    1    H    ALA  51           H        ALA  51 -24.520   9.810  -9.304
    2    HA   ALA  51           HA       ALA  51 -25.364   7.690 -11.133
    3    HB2  ALA  51           HB1      ALA  51 -24.804   6.322  -9.453
    4    HB3  ALA  51           HB2      ALA  51 -25.902   7.153  -8.352
    5    HB1  ALA  51           HB3      ALA  51 -24.250   7.736  -8.557

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ASP  52           H        ASP  52 -27.393   6.683 -10.986
    2    HA   ASP  52           HA       ASP  52 -29.526   8.565 -10.305
    3    HB2  ASP  52           HB2      ASP  52 -29.405   6.062 -11.982
    4    HB3  ASP  52           HB3      ASP  52 -30.928   6.831 -11.539

  No H/Q in entry =           4
  In of MODEL   82
    1    H    VAL  53           H        VAL  53 -27.991   5.636  -9.305
    2    HA   VAL  53           HA       VAL  53 -29.415   5.790  -6.782
    3    HB   VAL  53           HB       VAL  53 -30.860   4.187  -8.022
    4   HG11  VAL  53          HG11      VAL  53 -29.143   3.290  -9.556
    5   HG13  VAL  53          HG12      VAL  53 -30.002   2.012  -8.697
    6   HG12  VAL  53          HG13      VAL  53 -28.378   2.474  -8.192
    7   HG23  VAL  53          HG21      VAL  53 -30.078   2.185  -6.340
    8   HG22  VAL  53          HG22      VAL  53 -31.174   3.516  -5.965
    9   HG21  VAL  53          HG23      VAL  53 -29.461   3.645  -5.565

  No H/Q in entry =           9
  In of MODEL   82
    1    H    VAL  54           H        VAL  54 -28.105   5.321  -5.134
    2    HA   VAL  54           HA       VAL  54 -25.370   4.405  -5.762
    3    HB   VAL  54           HB       VAL  54 -26.385   6.202  -3.502
    4   HG11  VAL  54          HG11      VAL  54 -23.844   4.720  -3.810
    5   HG13  VAL  54          HG12      VAL  54 -24.572   5.414  -2.362
    6   HG12  VAL  54          HG13      VAL  54 -23.647   6.437  -3.459
    7   HG22  VAL  54          HG21      VAL  54 -25.485   7.997  -4.600
    8   HG21  VAL  54          HG22      VAL  54 -26.065   7.025  -5.953
    9   HG23  VAL  54          HG23      VAL  54 -24.355   7.006  -5.523

  No H/Q in entry =           9
  In of MODEL   82
    1    H    LEU  55           H        LEU  55 -24.823   2.467  -5.128
    2    HA   LEU  55           HA       LEU  55 -26.353   1.188  -2.948
    3    HB2  LEU  55           HB2      LEU  55 -24.837  -0.012  -5.255
    4    HB3  LEU  55           HB3      LEU  55 -25.615  -0.930  -3.965
    5    HG   LEU  55           HG       LEU  55 -27.022   0.699  -6.070
    6   HD13  LEU  55          HD11      LEU  55 -26.775  -1.157  -7.297
    7   HD12  LEU  55          HD12      LEU  55 -27.749  -2.011  -6.100
    8   HD11  LEU  55          HD13      LEU  55 -25.991  -1.991  -5.957
    9   HD23  LEU  55          HD21      LEU  55 -28.356  -1.219  -4.214
   10   HD22  LEU  55          HD22      LEU  55 -29.021   0.183  -5.054
   11   HD21  LEU  55          HD23      LEU  55 -27.987   0.408  -3.644

  No H/Q in entry =          11
  In of MODEL   82
    1    H    LEU  56           H        LEU  56 -25.208   0.560  -1.151
    2    HA   LEU  56           HA       LEU  56 -22.265   0.881  -1.214
    3    HB2  LEU  56           HB2      LEU  56 -24.060   0.709   1.194
    4    HB3  LEU  56           HB3      LEU  56 -22.340   1.094   1.175
    5    HG   LEU  56           HG       LEU  56 -24.601   2.834   0.227
    6   HD11  LEU  56          HD11      LEU  56 -23.484   2.416   2.741
    7   HD13  LEU  56          HD12      LEU  56 -24.442   3.812   2.244
    8   HD12  LEU  56          HD13      LEU  56 -22.682   3.872   2.147
    9   HD23  LEU  56          HD21      LEU  56 -22.615   4.482   0.028
   10   HD22  LEU  56          HD22      LEU  56 -23.032   3.400  -1.300
   11   HD21  LEU  56          HD23      LEU  56 -21.682   3.009  -0.235

  No H/Q in entry =          11
  In of MODEL   82
    1    H    GLY  57           H        GLY  57 -20.923  -0.786  -0.690
    2    HA3  GLY  57           HA2      GLY  57 -21.917  -3.447  -0.892
    3    HA2  GLY  57           HA3      GLY  57 -20.279  -2.996  -0.421

  No H/Q in entry =           3
  In of MODEL   82
    1    HA   PRO  58           HA       PRO  58 -23.095  -3.973   3.302
    2    HB2  PRO  58           HB2      PRO  58 -22.475  -6.596   3.898
    3    HB3  PRO  58           HB3      PRO  58 -23.853  -6.150   2.894
    4    HG2  PRO  58           HG2      PRO  58 -21.153  -7.098   2.091
    5    HG3  PRO  58           HG3      PRO  58 -22.732  -7.516   1.426
    6    HD2  PRO  58           HD2      PRO  58 -21.083  -5.737   0.200
    7    HD3  PRO  58           HD3      PRO  58 -22.840  -5.605   0.107

  No H/Q in entry =           7
  In of MODEL   82
    1    H    GLN  59           H        GLN  59 -19.740  -4.531   2.677
    2    HA   GLN  59           HA       GLN  59 -18.973  -4.575   5.434
    3    HB2  GLN  59           HB2      GLN  59 -17.342  -3.699   3.046
    4    HB3  GLN  59           HB3      GLN  59 -16.720  -4.064   4.642
    5    HG2  GLN  59           HG2      GLN  59 -18.060  -6.021   2.782
    6    HG3  GLN  59           HG3      GLN  59 -16.331  -5.883   3.053
    7   HE21  GLN  59          HE21      GLN  59 -18.661  -7.602   3.714
    8   HE22  GLN  59          HE22      GLN  59 -18.529  -8.434   5.149

  No H/Q in entry =           8
  In of MODEL   82
    1    H    ILE  60           H        ILE  60 -19.851  -1.995   3.237
    2    HA   ILE  60           HA       ILE  60 -18.938  -0.066   5.284
    3    HB   ILE  60           HB       ILE  60 -19.139   1.673   3.461
    4   HG12  ILE  60          HG12      ILE  60 -19.003  -0.559   1.477
    5   HG13  ILE  60          HG13      ILE  60 -20.572   0.027   2.028
    6   HG21  ILE  60          HG21      ILE  60 -17.041   0.374   4.196
    7   HG23  ILE  60          HG22      ILE  60 -16.990   1.368   2.741
    8   HG22  ILE  60          HG23      ILE  60 -17.169  -0.381   2.607
    9   HD12  ILE  60          HD11      ILE  60 -18.494   1.432   0.391
   10   HD11  ILE  60          HD12      ILE  60 -19.600   2.378   1.387
   11   HD13  ILE  60          HD13      ILE  60 -20.233   1.317   0.129

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ALA  61           H        ALA  61 -21.433  -1.587   5.361
    2    HA   ALA  61           HA       ALA  61 -23.617   0.136   4.918
    3    HB1  ALA  61           HB1      ALA  61 -24.865  -1.325   6.246
    4    HB2  ALA  61           HB2      ALA  61 -23.473  -1.754   7.241
    5    HB3  ALA  61           HB3      ALA  61 -23.592  -2.353   5.586

  No H/Q in entry =           5
  In of MODEL   82
    1    H    TYR  62           H        TYR  62 -21.400  -0.042   7.704
    2    HA   TYR  62           HA       TYR  62 -22.903   1.651   9.387
    3    HB2  TYR  62           HB2      TYR  62 -20.867   1.996  10.629
    4    HB3  TYR  62           HB3      TYR  62 -20.931   0.310  10.115
    5    HD1  TYR  62           HD1      TYR  62 -19.349  -0.554   8.443
    6    HD2  TYR  62           HD2      TYR  62 -19.149   3.512   9.742
    7    HE1  TYR  62           HE1      TYR  62 -17.133  -0.330   7.385
    8    HE2  TYR  62           HE2      TYR  62 -16.920   3.731   8.685
    9    HH   TYR  62           HH       TYR  62 -15.208   2.543   7.818

  No H/Q in entry =           9
  In of MODEL   82
    1    H    MET  63           H        MET  63 -21.253   2.474   6.525
    2    HA   MET  63           HA       MET  63 -21.008   5.300   7.225
    3    HB2  MET  63           HB2      MET  63 -20.455   3.769   4.683
    4    HB3  MET  63           HB3      MET  63 -20.213   5.507   4.868
    5    HG2  MET  63           HG2      MET  63 -18.503   5.108   6.536
    6    HG3  MET  63           HG3      MET  63 -18.764   3.370   6.408
    7    HE3  MET  63           HE1      MET  63 -18.189   6.044   3.046
    8    HE2  MET  63           HE2      MET  63 -16.651   6.271   3.880
    9    HE1  MET  63           HE3      MET  63 -18.169   6.518   4.746

  No H/Q in entry =           9
  In of MODEL   82
    1    H    LEU  64           H        LEU  64 -23.625   3.517   6.269
    2    HA   LEU  64           HA       LEU  64 -24.807   4.973   4.201
    3    HB2  LEU  64           HB2      LEU  64 -25.727   2.888   5.118
    4    HB3  LEU  64           HB3      LEU  64 -26.153   3.738   6.603
    5    HG   LEU  64           HG       LEU  64 -27.821   5.041   5.387
    6   HD13  LEU  64          HD11      LEU  64 -27.543   5.281   3.153
    7   HD12  LEU  64          HD12      LEU  64 -28.233   3.664   3.008
    8   HD11  LEU  64          HD13      LEU  64 -26.483   3.876   3.057
    9   HD23  LEU  64          HD21      LEU  64 -28.418   2.245   4.634
   10   HD22  LEU  64          HD22      LEU  64 -29.370   3.403   5.563
   11   HD21  LEU  64          HD23      LEU  64 -28.014   2.571   6.319

  No H/Q in entry =          11
  In of MODEL   82
    1    HA   PRO  65           HA       PRO  65 -26.886   8.177   6.972
    2    HB2  PRO  65           HB2      PRO  65 -24.870   8.274   9.216
    3    HB3  PRO  65           HB3      PRO  65 -26.601   8.603   9.272
    4    HG2  PRO  65           HG2      PRO  65 -25.728   6.321  10.188
    5    HG3  PRO  65           HG3      PRO  65 -27.154   6.330   9.150
    6    HD2  PRO  65           HD2      PRO  65 -24.303   5.639   8.430
    7    HD3  PRO  65           HD3      PRO  65 -25.787   4.794   7.989

  No H/Q in entry =           7
  In of MODEL   82
    1    H    GLU  66           H        GLU  66 -23.333   8.023   7.026
    2    HA   GLU  66           HA       GLU  66 -22.960  10.813   6.626
    3    HB2  GLU  66           HB2      GLU  66 -21.216   8.458   5.959
    4    HB3  GLU  66           HB3      GLU  66 -20.719  10.138   5.753
    5    HG2  GLU  66           HG2      GLU  66 -20.908  10.508   8.122
    6    HG3  GLU  66           HG3      GLU  66 -21.479   8.855   8.354

  No H/Q in entry =           6
  In of MODEL   82
    1    H    ILE  67           H        ILE  67 -23.151   8.077   4.368
    2    HA   ILE  67           HA       ILE  67 -22.699   9.780   2.077
    3    HB   ILE  67           HB       ILE  67 -23.679   6.899   2.254
    4   HG12  ILE  67          HG12      ILE  67 -21.022   7.996   1.320
    5   HG13  ILE  67          HG13      ILE  67 -21.319   7.581   3.007
    6   HG21  ILE  67          HG21      ILE  67 -23.581   8.781   0.033
    7   HG23  ILE  67          HG22      ILE  67 -24.252   7.151   0.083
    8   HG22  ILE  67          HG23      ILE  67 -22.538   7.388  -0.254
    9   HD12  ILE  67          HD11      ILE  67 -20.963   5.804   0.650
   10   HD11  ILE  67          HD12      ILE  67 -21.986   5.256   1.977
   11   HD13  ILE  67          HD13      ILE  67 -20.299   5.672   2.278

  No H/Q in entry =          11
  In of MODEL   82
    1    H    GLN  68           H        GLN  68 -25.590   8.805   3.723
    2    HA   GLN  68           HA       GLN  68 -27.401   9.793   1.762
    3    HB2  GLN  68           HB2      GLN  68 -27.651   9.435   4.746
    4    HB3  GLN  68           HB3      GLN  68 -28.958  10.072   3.762
    5    HG2  GLN  68           HG2      GLN  68 -29.053   8.046   2.481
    6    HG3  GLN  68           HG3      GLN  68 -27.617   7.425   3.272
    7   HE21  GLN  68          HE21      GLN  68 -29.835   6.133   3.146
    8   HE22  GLN  68          HE22      GLN  68 -30.669   5.698   4.565

  No H/Q in entry =           8
  In of MODEL   82
    1    H    ARG  69           H        ARG  69 -25.731  11.404   4.495
    2    HA   ARG  69           HA       ARG  69 -27.023  13.927   4.103
    3    HB2  ARG  69           HB2      ARG  69 -24.699  12.922   5.676
    4    HB3  ARG  69           HB3      ARG  69 -24.727  14.645   5.322
    5    HG2  ARG  69           HG2      ARG  69 -27.036  14.755   6.307
    6    HG3  ARG  69           HG3      ARG  69 -26.877  13.059   6.776
    7    HD2  ARG  69           HD2      ARG  69 -25.107  15.358   7.686
    8    HD3  ARG  69           HD3      ARG  69 -26.258  14.484   8.684
    9    HE   ARG  69           HE       ARG  69 -23.681  13.476   7.718
   10   HH21  ARG  69          HH11      ARG  69 -22.920  11.685   8.903
   11   HH22  ARG  69          HH12      ARG  69 -23.967  10.898  10.036
   12   HH11  ARG  69          HH21      ARG  69 -26.644  13.014   9.430
   13   HH12  ARG  69          HH22      ARG  69 -26.075  11.648  10.332

  No H/Q in entry =          13
  In of MODEL   82
    1    H    LEU  70           H        LEU  70 -24.204  12.438   2.723
    2    HA   LEU  70           HA       LEU  70 -23.025  14.771   1.554
    3    HB2  LEU  70           HB2      LEU  70 -22.099  12.421   2.137
    4    HB3  LEU  70           HB3      LEU  70 -22.738  11.980   0.555
    5    HG   LEU  70           HG       LEU  70 -21.109  13.306  -0.537
    6   HD11  LEU  70          HD11      LEU  70 -20.245  14.115   2.248
    7   HD13  LEU  70          HD12      LEU  70 -20.914  15.173   1.008
    8   HD12  LEU  70          HD13      LEU  70 -19.326  14.443   0.776
    9   HD22  LEU  70          HD21      LEU  70 -19.728  11.544  -0.317
   10   HD21  LEU  70          HD22      LEU  70 -20.662  11.047   1.093
   11   HD23  LEU  70          HD23      LEU  70 -19.243  12.075   1.292

  No H/Q in entry =          11
  In of MODEL   82
    1    H    LEU  71           H        LEU  71 -25.264  12.300   0.445
    2    HA   LEU  71           HA       LEU  71 -25.757  13.810  -2.064
    3    HB2  LEU  71           HB2      LEU  71 -26.055  10.833  -1.625
    4    HB3  LEU  71           HB3      LEU  71 -26.164  11.702  -3.155
    5    HG   LEU  71           HG       LEU  71 -23.635  11.629  -1.509
    6   HD12  LEU  71          HD11      LEU  71 -23.755  10.011  -3.945
    7   HD11  LEU  71          HD12      LEU  71 -24.777   9.416  -2.638
    8   HD13  LEU  71          HD13      LEU  71 -23.048   9.639  -2.373
    9   HD22  LEU  71          HD21      LEU  71 -23.688  13.451  -2.997
   10   HD21  LEU  71          HD22      LEU  71 -24.227  12.430  -4.329
   11   HD23  LEU  71          HD23      LEU  71 -22.608  12.229  -3.661

  No H/Q in entry =          11
  In of MODEL   82
    1    HA   PRO  72           HA       PRO  72 -29.619  13.480   0.580
    2    HB2  PRO  72           HB2      PRO  72 -30.392  16.069   0.510
    3    HB3  PRO  72           HB3      PRO  72 -29.092  15.571   1.593
    4    HG2  PRO  72           HG2      PRO  72 -28.883  16.766  -1.159
    5    HG3  PRO  72           HG3      PRO  72 -28.089  17.287   0.327
    6    HD2  PRO  72           HD2      PRO  72 -26.815  15.691  -1.452
    7    HD3  PRO  72           HD3      PRO  72 -26.556  15.510   0.282

  No H/Q in entry =           7
  In of MODEL   82
    1    H    ASN  73           H        ASN  73 -28.984  14.423  -2.636
    2    HA   ASN  73           HA       ASN  73 -31.855  14.214  -3.252
    3    HB2  ASN  73           HB2      ASN  73 -31.366  15.309  -5.349
    4    HB3  ASN  73           HB3      ASN  73 -30.802  16.267  -3.988
    5   HD21  ASN  73          HD21      ASN  73 -30.022  16.293  -6.670
    6   HD22  ASN  73          HD22      ASN  73 -28.361  16.076  -6.874

  No H/Q in entry =           6
  In of MODEL   82
    1    H    LYS  74           H        LYS  74 -29.952  11.890  -2.845
    2    HA   LYS  74           HA       LYS  74 -30.582  10.524  -5.393
    3    HB2  LYS  74           HB2      LYS  74 -28.051  10.140  -3.789
    4    HB3  LYS  74           HB3      LYS  74 -28.472   9.346  -5.307
    5    HG2  LYS  74           HG2      LYS  74 -28.103  12.304  -5.098
    6    HG3  LYS  74           HG3      LYS  74 -26.768  11.195  -5.414
    7    HD2  LYS  74           HD2      LYS  74 -27.929  10.313  -7.353
    8    HD3  LYS  74           HD3      LYS  74 -29.310  11.357  -7.021
    9    HE2  LYS  74           HE2      LYS  74 -28.018  13.321  -7.465
   10    HE3  LYS  74           HE3      LYS  74 -26.530  12.379  -7.569
   11    HZ2  LYS  74           HZ1      LYS  74 -27.991  13.038  -9.683
   12    HZ1  LYS  74           HZ2      LYS  74 -28.697  11.539  -9.311
   13    HZ3  LYS  74           HZ3      LYS  74 -27.029  11.641  -9.617

  No H/Q in entry =          13
  In of MODEL   82
    1    HA   PRO  75           HA       PRO  75 -32.062   7.580  -2.422
    2    HB2  PRO  75           HB2      PRO  75 -32.459   5.380  -4.008
    3    HB3  PRO  75           HB3      PRO  75 -33.538   6.773  -4.068
    4    HG2  PRO  75           HG2      PRO  75 -31.233   6.099  -5.854
    5    HG3  PRO  75           HG3      PRO  75 -32.868   6.595  -6.290
    6    HD2  PRO  75           HD2      PRO  75 -30.861   8.390  -6.254
    7    HD3  PRO  75           HD3      PRO  75 -32.475   8.846  -5.705

  No H/Q in entry =           7
  In of MODEL   82
    1    H    VAL  76           H        VAL  76 -30.640   6.471  -1.061
    2    HA   VAL  76           HA       VAL  76 -28.225   5.178  -2.186
    3    HB   VAL  76           HB       VAL  76 -28.446   6.646   0.477
    4   HG11  VAL  76          HG11      VAL  76 -26.144   5.280  -0.932
    5   HG13  VAL  76          HG12      VAL  76 -26.848   4.850   0.629
    6   HG12  VAL  76          HG13      VAL  76 -25.949   6.357   0.452
    7   HG22  VAL  76          HG21      VAL  76 -27.716   8.524  -0.409
    8   HG21  VAL  76          HG22      VAL  76 -28.292   7.853  -1.936
    9   HG23  VAL  76          HG23      VAL  76 -26.591   7.702  -1.491

  No H/Q in entry =           9
  In of MODEL   82
    1    H    GLU  77           H        GLU  77 -28.081   3.016  -1.580
    2    HA   GLU  77           HA       GLU  77 -28.881   2.250   1.077
    3    HB2  GLU  77           HB2      GLU  77 -30.548   0.661   0.551
    4    HB3  GLU  77           HB3      GLU  77 -31.047   2.205  -0.143
    5    HG2  GLU  77           HG2      GLU  77 -30.477   1.432  -2.337
    6    HG3  GLU  77           HG3      GLU  77 -29.886  -0.088  -1.671

  No H/Q in entry =           6
  In of MODEL   82
    1    H    VAL  78           H        VAL  78 -28.623   0.150   1.729
    2    HA   VAL  78           HA       VAL  78 -25.991  -0.712   0.824
    3    HB   VAL  78           HB       VAL  78 -27.717  -1.541   3.197
    4   HG11  VAL  78          HG11      VAL  78 -25.428  -2.849   2.056
    5   HG13  VAL  78          HG12      VAL  78 -26.343  -3.292   3.498
    6   HG12  VAL  78          HG13      VAL  78 -24.983  -2.178   3.624
    7   HG22  VAL  78          HG21      VAL  78 -26.202  -0.234   4.530
    8   HG21  VAL  78          HG22      VAL  78 -26.912   0.764   3.261
    9   HG23  VAL  78          HG23      VAL  78 -25.255   0.179   3.101

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ILE  79           H        ILE  79 -25.527  -2.636  -0.089
    2    HA   ILE  79           HA       ILE  79 -27.646  -4.036  -1.428
    3    HB   ILE  79           HB       ILE  79 -24.674  -4.669  -1.225
    4   HG12  ILE  79          HG12      ILE  79 -26.284  -3.503  -3.502
    5   HG13  ILE  79          HG13      ILE  79 -25.368  -2.526  -2.351
    6   HG22  ILE  79          HG21      ILE  79 -25.830  -5.803  -3.541
    7   HG21  ILE  79          HG22      ILE  79 -26.825  -6.294  -2.169
    8   HG23  ILE  79          HG23      ILE  79 -25.094  -6.633  -2.169
    9   HD13  ILE  79          HD11      ILE  79 -23.970  -2.685  -4.179
   10   HD12  ILE  79          HD12      ILE  79 -24.370  -4.380  -4.461
   11   HD11  ILE  79          HD13      ILE  79 -23.362  -3.929  -3.085

  No H/Q in entry =          11
  In of MODEL   82
    1    H    ASP  80           H        ASP  80 -28.575  -5.930  -0.844
    2    HA   ASP  80           HA       ASP  80 -28.538  -6.837   1.800
    3    HB2  ASP  80           HB2      ASP  80 -30.320  -7.348   0.169
    4    HB3  ASP  80           HB3      ASP  80 -29.203  -8.393  -0.709

  No H/Q in entry =           4
  In of MODEL   82
    1    H    SER  81           H        SER  81 -27.036  -8.029   2.919
    2    HA   SER  81           HA       SER  81 -24.573  -8.796   1.711
    3    HB2  SER  81           HB2      SER  81 -24.044  -9.845   3.875
    4    HB3  SER  81           HB3      SER  81 -24.691  -8.221   4.097
    5    HG   SER  81           HG       SER  81 -26.190  -9.052   5.238

  No H/Q in entry =           5
  In of MODEL   82
    1    H    LEU  82           H        LEU  82 -27.353 -10.791   2.045
    2    HA   LEU  82           HA       LEU  82 -25.892 -13.211   1.510
    3    HB2  LEU  82           HB2      LEU  82 -28.806 -12.488   1.278
    4    HB3  LEU  82           HB3      LEU  82 -28.163 -14.114   1.050
    5    HG   LEU  82           HG       LEU  82 -28.021 -12.558   3.615
    6   HD11  LEU  82          HD11      LEU  82 -29.853 -14.797   2.715
    7   HD13  LEU  82          HD12      LEU  82 -30.329 -13.135   3.074
    8   HD12  LEU  82          HD13      LEU  82 -29.742 -14.184   4.366
    9   HD23  LEU  82          HD21      LEU  82 -27.520 -14.987   4.376
   10   HD22  LEU  82          HD22      LEU  82 -26.238 -14.071   3.581
   11   HD21  LEU  82          HD23      LEU  82 -27.154 -15.274   2.673

  No H/Q in entry =          11
  In of MODEL   82
    1    H    LEU  83           H        LEU  83 -27.783 -10.913  -0.393
    2    HA   LEU  83           HA       LEU  83 -27.643 -12.273  -2.868
    3    HB2  LEU  83           HB2      LEU  83 -27.947  -9.354  -2.212
    4    HB3  LEU  83           HB3      LEU  83 -28.011  -9.994  -3.854
    5    HG   LEU  83           HG       LEU  83 -30.044 -10.313  -1.666
    6   HD13  LEU  83          HD11      LEU  83 -30.741  -8.438  -2.724
    7   HD12  LEU  83          HD12      LEU  83 -31.250  -9.532  -4.008
    8   HD11  LEU  83          HD13      LEU  83 -29.687  -8.720  -4.107
    9   HD23  LEU  83          HD21      LEU  83 -30.242 -11.560  -4.393
   10   HD22  LEU  83          HD22      LEU  83 -31.216 -11.879  -2.958
   11   HD21  LEU  83          HD23      LEU  83 -29.547 -12.442  -3.034

  No H/Q in entry =          11
  In of MODEL   82
    1    H    TYR  84           H        TYR  84 -25.597  -9.961  -1.198
    2    HA   TYR  84           HA       TYR  84 -23.731  -9.536  -3.339
    3    HB2  TYR  84           HB2      TYR  84 -24.187  -8.039  -1.307
    4    HB3  TYR  84           HB3      TYR  84 -23.196  -9.174  -0.395
    5    HD1  TYR  84           HD1      TYR  84 -20.858  -9.729  -1.641
    6    HD2  TYR  84           HD2      TYR  84 -23.117  -6.131  -2.079
    7    HE1  TYR  84           HE1      TYR  84 -18.818  -8.553  -2.393
    8    HE2  TYR  84           HE2      TYR  84 -21.089  -4.947  -2.842
    9    HH   TYR  84           HH       TYR  84 -17.962  -6.673  -3.082

  No H/Q in entry =           9
  In of MODEL   82
    1    H    GLY  85           H        GLY  85 -23.545 -11.551  -0.397
    2    HA3  GLY  85           HA2      GLY  85 -21.006 -12.584  -0.896
    3    HA2  GLY  85           HA3      GLY  85 -22.260 -13.388   0.046

  No H/Q in entry =           3
  In of MODEL   82
    1    H    LYS  86           H        LYS  86 -24.130 -13.691  -2.004
    2    HA   LYS  86           HA       LYS  86 -23.168 -16.099  -3.273
    3    HB2  LYS  86           HB2      LYS  86 -25.487 -15.437  -2.249
    4    HB3  LYS  86           HB3      LYS  86 -25.770 -14.738  -3.841
    5    HG2  LYS  86           HG2      LYS  86 -25.552 -16.888  -4.866
    6    HG3  LYS  86           HG3      LYS  86 -25.140 -17.617  -3.313
    7    HD2  LYS  86           HD2      LYS  86 -27.671 -16.037  -3.701
    8    HD3  LYS  86           HD3      LYS  86 -27.593 -17.759  -4.073
    9    HE2  LYS  86           HE2      LYS  86 -26.634 -17.996  -1.686
   10    HE3  LYS  86           HE3      LYS  86 -27.305 -16.387  -1.427
   11    HZ2  LYS  86           HZ1      LYS  86 -28.647 -18.877  -1.520
   12    HZ1  LYS  86           HZ2      LYS  86 -29.264 -17.850  -2.724
   13    HZ3  LYS  86           HZ3      LYS  86 -29.261 -17.350  -1.102

  No H/Q in entry =          13
  In of MODEL   82
    1    H    VAL  87           H        VAL  87 -23.049 -12.885  -4.162
    2    HA   VAL  87           HA       VAL  87 -22.720 -11.719  -6.103
    3    HB   VAL  87           HB       VAL  87 -21.767 -14.218  -7.507
    4   HG13  VAL  87          HG11      VAL  87 -20.388 -12.751  -8.673
    5   HG12  VAL  87          HG12      VAL  87 -20.326 -11.593  -7.344
    6   HG11  VAL  87          HG13      VAL  87 -21.772 -11.711  -8.344
    7   HG22  VAL  87          HG21      VAL  87 -19.668 -14.219  -6.384
    8   HG21  VAL  87          HG22      VAL  87 -20.928 -14.333  -5.157
    9   HG23  VAL  87          HG23      VAL  87 -20.107 -12.798  -5.438

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ASP  88           H        ASP  88 -25.255 -12.273  -5.737
    2    HA   ASP  88           HA       ASP  88 -26.432 -13.445  -8.130
    3    HB2  ASP  88           HB2      ASP  88 -27.422 -13.660  -5.800
    4    HB3  ASP  88           HB3      ASP  88 -27.815 -11.943  -5.894

  No H/Q in entry =           4
  In of MODEL   82
    1    H    GLY  89           H        GLY  89 -25.694 -12.211  -9.774
    2    HA3  GLY  89           HA2      GLY  89 -25.781  -9.433  -9.969
    3    HA2  GLY  89           HA3      GLY  89 -25.804 -10.552 -11.331

  No H/Q in entry =           3
  In of MODEL   82
    1    H    LEU  90           H        LEU  90 -28.293 -11.818 -10.870
    2    HA   LEU  90           HA       LEU  90 -30.042  -9.820 -11.969
    3    HB2  LEU  90           HB2      LEU  90 -30.195 -12.211 -12.552
    4    HB3  LEU  90           HB3      LEU  90 -30.702 -12.562 -10.900
    5    HG   LEU  90           HG       LEU  90 -32.783 -11.372 -11.249
    6   HD13  LEU  90          HD11      LEU  90 -32.552  -9.636 -12.722
    7   HD12  LEU  90          HD12      LEU  90 -33.141 -10.852 -13.858
    8   HD11  LEU  90          HD13      LEU  90 -31.415 -10.517 -13.744
    9   HD23  LEU  90          HD21      LEU  90 -32.785 -12.999 -13.687
   10   HD22  LEU  90          HD22      LEU  90 -33.760 -13.132 -12.223
   11   HD21  LEU  90          HD23      LEU  90 -32.129 -13.802 -12.259

  No H/Q in entry =          11
  In of MODEL   82
    1    H    GLY  91           H        GLY  91 -29.906 -11.330  -8.789
    2    HA3  GLY  91           HA2      GLY  91 -32.199 -10.140  -7.732
    3    HA2  GLY  91           HA3      GLY  91 -30.820 -10.722  -6.799

  No H/Q in entry =           3
  In of MODEL   82
    1    H    VAL  92           H        VAL  92 -28.845  -8.961  -7.665
    2    HA   VAL  92           HA       VAL  92 -29.546  -6.636  -6.108
    3    HB   VAL  92           HB       VAL  92 -27.028  -7.191  -7.721
    4   HG12  VAL  92          HG11      VAL  92 -27.113  -5.304  -5.391
    5   HG11  VAL  92          HG12      VAL  92 -27.769  -4.736  -6.928
    6   HG13  VAL  92          HG13      VAL  92 -26.090  -5.262  -6.827
    7   HG22  VAL  92          HG21      VAL  92 -26.850  -8.788  -6.132
    8   HG21  VAL  92          HG22      VAL  92 -27.960  -7.970  -5.031
    9   HG23  VAL  92          HG23      VAL  92 -26.288  -7.426  -5.162

  No H/Q in entry =           9
  In of MODEL   82
    1    H    LEU  93           H        LEU  93 -29.185  -7.306  -9.532
    2    HA   LEU  93           HA       LEU  93 -29.446  -4.659 -10.456
    3    HB2  LEU  93           HB2      LEU  93 -28.877  -6.533 -11.924
    4    HB3  LEU  93           HB3      LEU  93 -30.491  -7.206 -11.692
    5    HG   LEU  93           HG       LEU  93 -31.442  -5.207 -12.807
    6   HD11  LEU  93          HD11      LEU  93 -29.534  -3.677 -12.313
    7   HD13  LEU  93          HD12      LEU  93 -29.986  -3.690 -14.018
    8   HD12  LEU  93          HD13      LEU  93 -28.561  -4.574 -13.478
    9   HD23  LEU  93          HD21      LEU  93 -30.438  -5.807 -15.102
   10   HD22  LEU  93          HD22      LEU  93 -31.317  -7.035 -14.191
   11   HD21  LEU  93          HD23      LEU  93 -29.552  -7.039 -14.205

  No H/Q in entry =          11
  In of MODEL   82
    1    H    LYS  94           H        LYS  94 -31.901  -7.124  -9.594
    2    HA   LYS  94           HA       LYS  94 -34.198  -5.602 -10.201
    3    HB2  LYS  94           HB2      LYS  94 -33.746  -7.807  -8.196
    4    HB3  LYS  94           HB3      LYS  94 -35.321  -7.056  -8.452
    5    HG2  LYS  94           HG2      LYS  94 -35.277  -7.830 -10.788
    6    HG3  LYS  94           HG3      LYS  94 -33.740  -8.635 -10.471
    7    HD2  LYS  94           HD2      LYS  94 -34.894  -9.932  -8.641
    8    HD3  LYS  94           HD3      LYS  94 -36.418  -9.232  -9.184
    9    HE2  LYS  94           HE2      LYS  94 -35.950 -10.174 -11.456
   10    HE3  LYS  94           HE3      LYS  94 -34.557 -11.007 -10.763
   11    HZ3  LYS  94           HZ1      LYS  94 -36.459 -12.464 -10.923
   12    HZ2  LYS  94           HZ2      LYS  94 -37.391 -11.406  -9.973
   13    HZ1  LYS  94           HZ3      LYS  94 -36.053 -12.201  -9.295

  No H/Q in entry =          13
  In of MODEL   82
    1    H    ALA  95           H        ALA  95 -32.360  -5.790  -7.166
    2    HA   ALA  95           HA       ALA  95 -34.144  -4.150  -5.671
    3    HB2  ALA  95           HB1      ALA  95 -31.813  -5.606  -5.152
    4    HB3  ALA  95           HB2      ALA  95 -32.753  -4.670  -3.990
    5    HB1  ALA  95           HB3      ALA  95 -31.385  -3.928  -4.820

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ALA  96           H        ALA  96 -31.489  -3.383  -7.785
    2    HA   ALA  96           HA       ALA  96 -31.292  -0.628  -7.007
    3    HB2  ALA  96           HB1      ALA  96 -29.937  -0.446  -9.126
    4    HB3  ALA  96           HB2      ALA  96 -30.302  -2.141  -9.446
    5    HB1  ALA  96           HB3      ALA  96 -29.362  -1.696  -8.023

  No H/Q in entry =           5
  In of MODEL   82
    1    H    VAL  97           H        VAL  97 -32.900  -2.284  -9.686
    2    HA   VAL  97           HA       VAL  97 -33.898   0.054 -10.931
    3    HB   VAL  97           HB       VAL  97 -34.810  -2.842 -10.973
    4   HG11  VAL  97          HG11      VAL  97 -36.533  -0.772 -11.443
    5   HG13  VAL  97          HG12      VAL  97 -36.653  -2.361 -12.201
    6   HG12  VAL  97          HG13      VAL  97 -35.859  -1.037 -13.053
    7   HG21  VAL  97          HG21      VAL  97 -33.481  -1.056 -13.013
    8   HG23  VAL  97          HG22      VAL  97 -33.995  -2.719 -13.302
    9   HG22  VAL  97          HG23      VAL  97 -32.725  -2.378 -12.125

  No H/Q in entry =           9
  In of MODEL   82
    1    H    ALA  98           H        ALA  98 -35.140  -2.086  -8.390
    2    HA   ALA  98           HA       ALA  98 -37.655  -0.848  -8.020
    3    HB1  ALA  98           HB1      ALA  98 -36.715  -3.083  -6.997
    4    HB3  ALA  98           HB2      ALA  98 -37.854  -2.119  -6.057
    5    HB2  ALA  98           HB3      ALA  98 -36.127  -2.033  -5.709

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ALA  99           H        ALA  99 -34.538  -0.164  -6.392
    2    HA   ALA  99           HA       ALA  99 -35.584   1.857  -4.719
    3    HB1  ALA  99           HB1      ALA  99 -32.975   0.873  -5.487
    4    HB2  ALA  99           HB2      ALA  99 -33.487   1.640  -3.983
    5    HB3  ALA  99           HB3      ALA  99 -32.985   2.631  -5.351

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ILE 100           H        ILE 100 -34.563   1.956  -8.082
    2    HA   ILE 100           HA       ILE 100 -34.638   4.810  -8.294
    3    HB   ILE 100           HB       ILE 100 -34.827   2.665 -10.437
    4   HG12  ILE 100          HG12      ILE 100 -32.587   4.574  -9.777
    5   HG13  ILE 100          HG13      ILE 100 -32.680   2.928  -9.149
    6   HG21  ILE 100          HG21      ILE 100 -35.143   5.599 -10.558
    7   HG23  ILE 100          HG22      ILE 100 -35.703   4.352 -11.673
    8   HG22  ILE 100          HG23      ILE 100 -34.029   4.907 -11.739
    9   HD12  ILE 100          HD11      ILE 100 -32.132   3.872 -11.925
   10   HD11  ILE 100          HD12      ILE 100 -32.849   2.282 -11.669
   11   HD13  ILE 100          HD13      ILE 100 -31.283   2.666 -10.959

  No H/Q in entry =          11
  In of MODEL   82
    1    H    LYS 101           H        LYS 101 -37.031   2.289  -9.010
    2    HA   LYS 101           HA       LYS 101 -39.057   4.017  -9.991
    3    HB2  LYS 101           HB2      LYS 101 -39.036   1.237  -8.871
    4    HB3  LYS 101           HB3      LYS 101 -40.561   2.057  -9.204
    5    HG2  LYS 101           HG2      LYS 101 -40.098   2.180 -11.504
    6    HG3  LYS 101           HG3      LYS 101 -38.416   1.712 -11.263
    7    HD2  LYS 101           HD2      LYS 101 -39.743  -0.147 -12.144
    8    HD3  LYS 101           HD3      LYS 101 -39.117  -0.504 -10.534
    9    HE2  LYS 101           HE2      LYS 101 -41.201  -1.124 -10.015
   10    HE3  LYS 101           HE3      LYS 101 -41.594   0.596 -10.011
   11    HZ3  LYS 101           HZ1      LYS 101 -42.505   0.479 -12.122
   12    HZ2  LYS 101           HZ2      LYS 101 -43.016  -0.979 -11.416
   13    HZ1  LYS 101           HZ3      LYS 101 -41.715  -0.976 -12.508

  No H/Q in entry =          13
  In of MODEL   82
    1    H    LYS 102           H        LYS 102 -38.598   2.514  -6.790
    2    HA   LYS 102           HA       LYS 102 -40.792   3.788  -5.574
    3    HB2  LYS 102           HB2      LYS 102 -39.619   1.874  -4.571
    4    HB3  LYS 102           HB3      LYS 102 -38.188   2.876  -4.335
    5    HG2  LYS 102           HG2      LYS 102 -39.442   4.314  -2.826
    6    HG3  LYS 102           HG3      LYS 102 -40.876   3.317  -3.065
    7    HD2  LYS 102           HD2      LYS 102 -39.714   1.404  -2.051
    8    HD3  LYS 102           HD3      LYS 102 -38.281   2.403  -1.810
    9    HE2  LYS 102           HE2      LYS 102 -39.569   3.926  -0.389
   10    HE3  LYS 102           HE3      LYS 102 -41.019   2.958  -0.650
   11    HZ1  LYS 102           HZ1      LYS 102 -39.359   1.138   0.337
   12    HZ3  LYS 102           HZ2      LYS 102 -40.429   2.061   1.277
   13    HZ2  LYS 102           HZ3      LYS 102 -38.801   2.526   1.140

  No H/Q in entry =          13
  In of MODEL   82
    1    H    ALA 103           H        ALA 103 -37.795   5.071  -6.602
    2    HA   ALA 103           HA       ALA 103 -37.920   7.388  -4.812
    3    HB2  ALA 103           HB1      ALA 103 -35.913   8.052  -6.399
    4    HB3  ALA 103           HB2      ALA 103 -35.944   6.335  -6.803
    5    HB1  ALA 103           HB3      ALA 103 -35.686   6.845  -5.135

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ALA 104           H        ALA 104 -38.589   6.690  -8.157
    2    HA   ALA 104           HA       ALA 104 -39.074   9.496  -8.768
    3    HB2  ALA 104           HB1      ALA 104 -39.157   8.837 -10.971
    4    HB1  ALA 104           HB2      ALA 104 -39.938   7.302 -10.592
    5    HB3  ALA 104           HB3      ALA 104 -38.206   7.501 -10.324

  No H/Q in entry =           5
  In of MODEL   82
    1    H    ALA 105           H        ALA 105 -40.748   7.448  -6.958
    2    HA   ALA 105           HA       ALA 105 -43.119   8.930  -6.911
    3    HB2  ALA 105           HB1      ALA 105 -43.908   8.105  -8.947
    4    HB3  ALA 105           HB2      ALA 105 -44.581   6.937  -7.811
    5    HB1  ALA 105           HB3      ALA 105 -43.131   6.537  -8.730

  No H/Q in entry =           5
  In of MODEL   83
    1    H1   ALA   1           H3       ALA   1 -12.391 -15.579  -2.214
    2    H2   ALA   1           H2       ALA   1 -11.466 -16.723  -3.069
    3    H3   ALA   1           H1       ALA   1 -12.612 -15.768  -3.886
    4    HA   ALA   1           HA       ALA   1 -14.019 -17.461  -3.639
    5    HB3  ALA   1           HB1      ALA   1 -12.629 -19.243  -3.200
    6    HB1  ALA   1           HB2      ALA   1 -13.368 -19.132  -1.602
    7    HB2  ALA   1           HB3      ALA   1 -11.791 -18.400  -1.896

  No H/Q in entry =           7
  In of MODEL   83
    1    H    GLU   2           H        GLU   2 -15.630 -18.312  -1.972
    2    HA   GLU   2           HA       GLU   2 -17.256 -16.586  -0.888
    3    HB2  GLU   2           HB2      GLU   2 -16.316 -19.024   0.636
    4    HB3  GLU   2           HB3      GLU   2 -17.832 -18.166   0.910
    5    HG2  GLU   2           HG2      GLU   2 -18.836 -19.238  -0.819
    6    HG3  GLU   2           HG3      GLU   2 -17.522 -18.841  -1.916

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLU   3           H        GLU   3 -15.325 -17.963   1.709
    2    HA   GLU   3           HA       GLU   3 -15.515 -15.615   3.278
    3    HB2  GLU   3           HB2      GLU   3 -13.943 -18.172   3.501
    4    HB3  GLU   3           HB3      GLU   3 -13.692 -16.859   4.651
    5    HG2  GLU   3           HG2      GLU   3 -15.877 -17.000   5.492
    6    HG3  GLU   3           HG3      GLU   3 -16.492 -17.790   4.046

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LEU   4           H        LEU   4 -12.585 -17.106   1.850
    2    HA   LEU   4           HA       LEU   4 -10.732 -15.217   2.437
    3    HB2  LEU   4           HB2      LEU   4 -10.999 -16.501  -0.291
    4    HB3  LEU   4           HB3      LEU   4  -9.536 -15.793   0.382
    5    HG   LEU   4           HG       LEU   4 -11.033 -18.185   1.500
    6   HD13  LEU   4          HD11      LEU   4  -9.419 -19.547   0.548
    7   HD12  LEU   4          HD12      LEU   4  -8.202 -18.272   0.514
    8   HD11  LEU   4          HD13      LEU   4  -9.503 -18.280  -0.675
    9   HD23  LEU   4          HD21      LEU   4  -8.768 -18.269   2.858
   10   HD22  LEU   4          HD22      LEU   4 -10.077 -17.223   3.405
   11   HD21  LEU   4          HD23      LEU   4  -8.719 -16.540   2.512

  No H/Q in entry =          11
  In of MODEL   83
    1    H    GLU   5           H        GLU   5 -13.093 -14.983  -0.211
    2    HA   GLU   5           HA       GLU   5 -12.084 -12.502  -1.212
    3    HB2  GLU   5           HB2      GLU   5 -13.465 -14.093  -2.551
    4    HB3  GLU   5           HB3      GLU   5 -14.851 -13.680  -1.541
    5    HG2  GLU   5           HG2      GLU   5 -14.981 -12.307  -3.513
    6    HG3  GLU   5           HG3      GLU   5 -14.485 -11.265  -2.179

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLU   6           H        GLU   6 -14.793 -13.372   0.905
    2    HA   GLU   6           HA       GLU   6 -15.676 -10.691   1.325
    3    HB2  GLU   6           HB2      GLU   6 -16.895 -12.969   1.775
    4    HB3  GLU   6           HB3      GLU   6 -16.088 -12.878   3.340
    5    HG2  GLU   6           HG2      GLU   6 -18.273 -11.201   2.237
    6    HG3  GLU   6           HG3      GLU   6 -17.944 -11.665   3.904

  No H/Q in entry =           6
  In of MODEL   83
    1    H    VAL   7           H        VAL   7 -13.367 -12.823   2.863
    2    HA   VAL   7           HA       VAL   7 -12.866 -11.262   5.192
    3    HB   VAL   7           HB       VAL   7 -11.191 -13.310   3.717
    4   HG11  VAL   7          HG11      VAL   7 -10.686 -11.791   6.282
    5   HG13  VAL   7          HG12      VAL   7  -9.602 -12.007   4.909
    6   HG12  VAL   7          HG13      VAL   7  -9.953 -13.366   5.977
    7   HG21  VAL   7          HG21      VAL   7 -13.432 -13.865   4.957
    8   HG23  VAL   7          HG22      VAL   7 -12.488 -13.603   6.424
    9   HG22  VAL   7          HG23      VAL   7 -12.015 -14.861   5.284

  No H/Q in entry =           9
  In of MODEL   83
    1    H    VAL   8           H        VAL   8 -11.388 -11.372   1.966
    2    HA   VAL   8           HA       VAL   8  -9.308  -9.515   2.446
    3    HB   VAL   8           HB       VAL   8 -10.801 -10.187  -0.100
    4   HG13  VAL   8          HG11      VAL   8  -9.834  -8.004  -0.395
    5   HG12  VAL   8          HG12      VAL   8  -8.757  -9.150  -1.193
    6   HG11  VAL   8          HG13      VAL   8  -8.333  -8.499   0.390
    7   HG22  VAL   8          HG21      VAL   8  -9.299 -11.914  -0.365
    8   HG21  VAL   8          HG22      VAL   8  -9.089 -11.762   1.377
    9   HG23  VAL   8          HG23      VAL   8  -7.957 -10.970   0.285

  No H/Q in entry =           9
  In of MODEL   83
    1    H    MET   9           H        MET   9 -12.663  -9.098   1.322
    2    HA   MET   9           HA       MET   9 -12.586  -6.320   0.899
    3    HB2  MET   9           HB2      MET   9 -14.793  -8.202   1.717
    4    HB3  MET   9           HB3      MET   9 -15.079  -6.467   1.565
    5    HG2  MET   9           HG2      MET   9 -14.334  -6.510  -0.759
    6    HG3  MET   9           HG3      MET   9 -13.923  -8.220  -0.622
    7    HE1  MET   9           HE1      MET   9 -16.445  -5.529  -0.283
    8    HE3  MET   9           HE2      MET   9 -17.261  -6.458   0.971
    9    HE2  MET   9           HE3      MET   9 -18.035  -6.239  -0.596

  No H/Q in entry =           9
  In of MODEL   83
    1    H    GLY  10           H        GLY  10 -13.231  -8.220   3.825
    2    HA3  GLY  10           HA2      GLY  10 -13.748  -6.039   5.558
    3    HA2  GLY  10           HA3      GLY  10 -13.188  -7.634   6.059

  No H/Q in entry =           3
  In of MODEL   83
    1    H    LEU  11           H        LEU  11 -10.757  -7.767   4.719
    2    HA   LEU  11           HA       LEU  11  -9.030  -6.352   6.464
    3    HB2  LEU  11           HB2      LEU  11  -8.519  -7.768   3.846
    4    HB3  LEU  11           HB3      LEU  11  -7.234  -7.075   4.834
    5    HG   LEU  11           HG       LEU  11  -9.238  -9.100   5.862
    6   HD13  LEU  11          HD11      LEU  11  -8.040 -10.338   4.281
    7   HD12  LEU  11          HD12      LEU  11  -7.091 -10.588   5.745
    8   HD11  LEU  11          HD13      LEU  11  -6.556  -9.421   4.537
    9   HD22  LEU  11          HD21      LEU  11  -8.359  -8.101   7.775
   10   HD21  LEU  11          HD22      LEU  11  -6.827  -7.705   6.998
   11   HD23  LEU  11          HD23      LEU  11  -7.158  -9.361   7.504

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  12           H        ILE  12  -9.963  -5.785   3.086
    2    HA   ILE  12           HA       ILE  12  -8.263  -3.563   2.652
    3    HB   ILE  12           HB       ILE  12 -10.934  -4.211   1.381
    4   HG12  ILE  12          HG12      ILE  12  -8.906  -5.875   1.281
    5   HG13  ILE  12          HG13      ILE  12  -9.786  -5.514  -0.189
    6   HG23  ILE  12          HG21      ILE  12 -10.365  -1.897   0.930
    7   HG22  ILE  12          HG22      ILE  12  -9.993  -2.819  -0.521
    8   HG21  ILE  12          HG23      ILE  12  -8.724  -2.338   0.568
    9   HD13  ILE  12          HD11      ILE  12  -8.064  -3.957  -0.876
   10   HD12  ILE  12          HD12      ILE  12  -7.288  -5.475  -0.431
   11   HD11  ILE  12          HD13      ILE  12  -7.246  -4.117   0.668

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  13           H        ILE  13 -11.614  -3.816   3.778
    2    HA   ILE  13           HA       ILE  13 -12.056  -1.028   4.064
    3    HB   ILE  13           HB       ILE  13 -13.259  -3.445   5.433
    4   HG12  ILE  13          HG12      ILE  13 -13.511  -2.945   2.906
    5   HG13  ILE  13          HG13      ILE  13 -14.951  -3.324   3.827
    6   HG23  ILE  13          HG21      ILE  13 -13.776  -1.795   6.995
    7   HG22  ILE  13          HG22      ILE  13 -15.163  -1.686   5.920
    8   HG21  ILE  13          HG23      ILE  13 -13.853  -0.514   5.788
    9   HD11  ILE  13          HD11      ILE  13 -14.205  -0.449   3.693
   10   HD13  ILE  13          HD12      ILE  13 -15.781  -1.215   3.674
   11   HD12  ILE  13          HD13      ILE  13 -14.819  -1.193   2.213

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ASN  14           H        ASN  14 -10.935  -3.533   6.317
    2    HA   ASN  14           HA       ASN  14 -10.703  -1.906   8.607
    3    HB2  ASN  14           HB2      ASN  14 -10.466  -4.513   8.272
    4    HB3  ASN  14           HB3      ASN  14  -8.757  -4.134   8.099
    5   HD21  ASN  14          HD21      ASN  14  -9.379  -5.664  10.275
    6   HD22  ASN  14          HD22      ASN  14  -9.333  -4.750  11.703

  No H/Q in entry =           6
  In of MODEL   83
    1    H    SER  15           H        SER  15  -8.330  -2.731   6.088
    2    HA   SER  15           HA       SER  15  -6.169  -1.253   7.145
    3    HB2  SER  15           HB2      SER  15  -5.171  -1.464   4.976
    4    HB3  SER  15           HB3      SER  15  -6.131  -2.920   5.204
    5    HG   SER  15           HG       SER  15  -6.554  -0.728   3.539

  No H/Q in entry =           5
  In of MODEL   83
    1    H    GLY  16           H        GLY  16  -8.788  -0.365   4.927
    2    HA3  GLY  16           HA2      GLY  16  -7.924   2.275   4.378
    3    HA2  GLY  16           HA3      GLY  16  -9.579   1.687   4.230

  No H/Q in entry =           3
  In of MODEL   83
    1    H    GLN  17           H        GLN  17 -10.099   0.954   6.882
    2    HA   GLN  17           HA       GLN  17 -10.784   3.457   8.040
    3    HB2  GLN  17           HB2      GLN  17 -12.001   1.344   8.517
    4    HB3  GLN  17           HB3      GLN  17 -10.596   0.760   9.408
    5    HG2  GLN  17           HG2      GLN  17 -12.191   1.708  10.986
    6    HG3  GLN  17           HG3      GLN  17 -10.773   2.754  10.904
    7   HE21  GLN  17          HE21      GLN  17 -11.769   4.782  11.329
    8   HE22  GLN  17          HE22      GLN  17 -12.979   5.447  10.339

  No H/Q in entry =           8
  In of MODEL   83
    1    H    ALA  18           H        ALA  18  -8.158   1.163   8.624
    2    HA   ALA  18           HA       ALA  18  -7.034   2.365  10.889
    3    HB2  ALA  18           HB1      ALA  18  -6.446   0.153   9.506
    4    HB3  ALA  18           HB2      ALA  18  -5.270   0.927  10.568
    5    HB1  ALA  18           HB3      ALA  18  -5.208   1.212   8.828

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ARG  19           H        ARG  19  -6.295   2.900   7.435
    2    HA   ARG  19           HA       ARG  19  -4.385   4.939   7.853
    3    HB2  ARG  19           HB2      ARG  19  -4.738   3.808   5.656
    4    HB3  ARG  19           HB3      ARG  19  -6.279   4.655   5.498
    5    HG2  ARG  19           HG2      ARG  19  -5.143   6.822   5.563
    6    HG3  ARG  19           HG3      ARG  19  -3.594   6.030   5.849
    7    HD2  ARG  19           HD2      ARG  19  -3.740   6.631   3.510
    8    HD3  ARG  19           HD3      ARG  19  -3.829   4.870   3.649
    9    HE   ARG  19           HE       ARG  19  -6.460   5.788   3.671
   10   HH21  ARG  19          HH11      ARG  19  -7.673   5.955   1.765
   11   HH22  ARG  19          HH12      ARG  19  -6.866   6.037   0.238
   12   HH11  ARG  19          HH21      ARG  19  -3.704   5.850   1.610
   13   HH12  ARG  19          HH22      ARG  19  -4.617   5.974   0.150

  No H/Q in entry =          13
  In of MODEL   83
    1    H    SER  20           H        SER  20  -7.889   5.067   7.287
    2    HA   SER  20           HA       SER  20  -8.238   7.824   7.253
    3    HB2  SER  20           HB2      SER  20 -10.124   6.489   6.730
    4    HB3  SER  20           HB3      SER  20 -10.004   5.592   8.241
    5    HG   SER  20           HG       SER  20 -10.667   8.333   7.901

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LEU  21           H        LEU  21  -8.217   5.631  10.049
    2    HA   LEU  21           HA       LEU  21  -8.633   7.620  12.025
    3    HB2  LEU  21           HB2      LEU  21  -7.284   4.916  12.163
    4    HB3  LEU  21           HB3      LEU  21  -7.582   5.927  13.573
    5    HG   LEU  21           HG       LEU  21  -9.766   5.039  11.666
    6   HD13  LEU  21          HD11      LEU  21 -10.298   3.273  13.188
    7   HD12  LEU  21          HD12      LEU  21  -9.159   3.876  14.392
    8   HD11  LEU  21          HD13      LEU  21  -8.562   3.157  12.896
    9   HD23  LEU  21          HD21      LEU  21 -11.099   5.534  13.887
   10   HD22  LEU  21          HD22      LEU  21 -10.629   6.889  12.866
   11   HD21  LEU  21          HD23      LEU  21  -9.697   6.514  14.307

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ALA  22           H        ALA  22  -5.698   6.245  10.584
    2    HA   ALA  22           HA       ALA  22  -3.799   7.547  12.193
    3    HB2  ALA  22           HB1      ALA  22  -3.404   5.699  10.491
    4    HB1  ALA  22           HB2      ALA  22  -2.205   6.992  10.519
    5    HB3  ALA  22           HB3      ALA  22  -3.435   6.956   9.255

  No H/Q in entry =           5
  In of MODEL   83
    1    H    TYR  23           H        TYR  23  -5.144   8.580   9.027
    2    HA   TYR  23           HA       TYR  23  -3.803  11.073   8.954
    3    HB2  TYR  23           HB2      TYR  23  -4.906  10.169   6.969
    4    HB3  TYR  23           HB3      TYR  23  -6.477  10.281   7.766
    5    HD1  TYR  23           HD1      TYR  23  -3.578  12.310   6.582
    6    HD2  TYR  23           HD2      TYR  23  -7.703  12.302   7.774
    7    HE1  TYR  23           HE1      TYR  23  -3.798  14.662   5.831
    8    HE2  TYR  23           HE2      TYR  23  -7.926  14.655   7.021
    9    HH   TYR  23           HH       TYR  23  -5.131  16.432   5.702

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ALA  24           H        ALA  24  -6.912  10.097  10.359
    2    HA   ALA  24           HA       ALA  24  -7.735  12.686  11.148
    3    HB1  ALA  24           HB1      ALA  24  -9.552  11.437  11.628
    4    HB2  ALA  24           HB2      ALA  24  -8.713  10.858  13.066
    5    HB3  ALA  24           HB3      ALA  24  -8.605   9.952  11.558

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ALA  25           H        ALA  25  -5.724  10.217  12.693
    2    HA   ALA  25           HA       ALA  25  -5.359  11.459  15.197
    3    HB2  ALA  25           HB1      ALA  25  -4.605   9.109  14.360
    4    HB3  ALA  25           HB2      ALA  25  -3.577   9.960  15.514
    5    HB1  ALA  25           HB3      ALA  25  -3.157   9.949  13.801

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LEU  26           H        LEU  26  -3.597  11.766  12.141
    2    HA   LEU  26           HA       LEU  26  -1.625  13.578  13.045
    3    HB2  LEU  26           HB2      LEU  26  -1.346  12.433  10.934
    4    HB3  LEU  26           HB3      LEU  26  -2.824  13.147  10.296
    5    HG   LEU  26           HG       LEU  26  -1.803  15.395  10.431
    6   HD12  LEU  26          HD11      LEU  26   0.740  15.407  10.821
    7   HD11  LEU  26          HD12      LEU  26   0.519  13.824  11.561
    8   HD13  LEU  26          HD13      LEU  26  -0.278  15.238  12.251
    9   HD21  LEU  26          HD21      LEU  26  -0.078  13.341   9.012
   10   HD23  LEU  26          HD22      LEU  26  -0.121  15.064   8.648
   11   HD22  LEU  26          HD23      LEU  26  -1.549  14.071   8.370

  No H/Q in entry =          11
  In of MODEL   83
    1    H    LYS  27           H        LYS  27  -4.820  14.074  11.600
    2    HA   LYS  27           HA       LYS  27  -4.759  16.863  11.412
    3    HB2  LYS  27           HB2      LYS  27  -6.516  15.394  10.438
    4    HB3  LYS  27           HB3      LYS  27  -7.158  15.133  12.059
    5    HG2  LYS  27           HG2      LYS  27  -7.579  17.540  12.308
    6    HG3  LYS  27           HG3      LYS  27  -6.885  17.841  10.712
    7    HD2  LYS  27           HD2      LYS  27  -8.632  16.415   9.686
    8    HD3  LYS  27           HD3      LYS  27  -9.331  16.131  11.282
    9    HE2  LYS  27           HE2      LYS  27  -9.765  18.542  11.538
   10    HE3  LYS  27           HE3      LYS  27  -9.037  18.848   9.958
   11    HZ3  LYS  27           HZ1      LYS  27 -11.417  18.731   9.738
   12    HZ2  LYS  27           HZ2      LYS  27 -11.462  17.211  10.502
   13    HZ1  LYS  27           HZ3      LYS  27 -10.731  17.379   8.975

  No H/Q in entry =          13
  In of MODEL   83
    1    H    GLN  28           H        GLN  28  -5.628  14.769  14.140
    2    HA   GLN  28           HA       GLN  28  -6.500  16.769  15.932
    3    HB2  GLN  28           HB2      GLN  28  -5.101  14.133  16.452
    4    HB3  GLN  28           HB3      GLN  28  -5.829  15.134  17.709
    5    HG2  GLN  28           HG2      GLN  28  -7.313  14.026  15.309
    6    HG3  GLN  28           HG3      GLN  28  -7.358  13.328  16.927
    7   HE21  GLN  28          HE21      GLN  28  -9.275  15.100  15.005
    8   HE22  GLN  28          HE22      GLN  28  -9.998  16.134  16.139

  No H/Q in entry =           8
  In of MODEL   83
    1    H    ALA  29           H        ALA  29  -3.292  15.464  15.207
    2    HA   ALA  29           HA       ALA  29  -1.830  16.849  17.176
    3    HB1  ALA  29           HB1      ALA  29   0.087  16.155  16.036
    4    HB3  ALA  29           HB2      ALA  29  -0.682  16.288  14.455
    5    HB2  ALA  29           HB3      ALA  29  -1.099  14.953  15.528

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LYS  30           H        LYS  30  -2.717  17.745  13.859
    2    HA   LYS  30           HA       LYS  30  -1.295  20.178  13.754
    3    HB2  LYS  30           HB2      LYS  30  -3.844  19.323  12.367
    4    HB3  LYS  30           HB3      LYS  30  -3.006  20.835  12.021
    5    HG2  LYS  30           HG2      LYS  30  -0.948  19.532  11.482
    6    HG3  LYS  30           HG3      LYS  30  -1.860  18.040  11.730
    7    HD2  LYS  30           HD2      LYS  30  -3.438  18.697   9.953
    8    HD3  LYS  30           HD3      LYS  30  -2.549  20.201   9.707
    9    HE2  LYS  30           HE2      LYS  30  -0.530  18.899   9.103
   10    HE3  LYS  30           HE3      LYS  30  -1.438  17.400   9.318
   11    HZ2  LYS  30           HZ1      LYS  30  -1.280  18.279   6.978
   12    HZ1  LYS  30           HZ2      LYS  30  -2.311  19.546   7.461
   13    HZ3  LYS  30           HZ3      LYS  30  -2.845  17.932   7.531

  No H/Q in entry =          13
  In of MODEL   83
    1    H    GLN  31           H        GLN  31  -4.387  19.339  15.193
    2    HA   GLN  31           HA       GLN  31  -5.128  22.099  15.664
    3    HB2  GLN  31           HB2      GLN  31  -6.310  19.655  16.988
    4    HB3  GLN  31           HB3      GLN  31  -7.062  21.232  16.757
    5    HG2  GLN  31           HG2      GLN  31  -6.382  20.461  14.157
    6    HG3  GLN  31           HG3      GLN  31  -6.910  18.957  14.903
    7   HE21  GLN  31          HE21      GLN  31  -8.330  20.549  12.822
    8   HE22  GLN  31          HE22      GLN  31  -9.835  20.948  13.496

  No H/Q in entry =           8
  In of MODEL   83
    1    H    GLY  32           H        GLY  32  -2.816  20.150  16.953
    2    HA3  GLY  32           HA2      GLY  32  -1.394  20.595  18.743
    3    HA2  GLY  32           HA3      GLY  32  -2.510  21.844  19.283

  No H/Q in entry =           3
  In of MODEL   83
    1    H    ASP  33           H        ASP  33  -3.960  18.817  18.623
    2    HA   ASP  33           HA       ASP  33  -4.345  18.350  21.505
    3    HB2  ASP  33           HB2      ASP  33  -5.783  17.359  19.037
    4    HB3  ASP  33           HB3      ASP  33  -6.116  16.744  20.654

  No H/Q in entry =           4
  In of MODEL   83
    1    H    PHE  34           H        PHE  34  -2.179  17.482  21.785
    2    HA   PHE  34           HA       PHE  34  -1.209  15.232  20.364
    3    HB2  PHE  34           HB2      PHE  34  -0.557  16.200  23.157
    4    HB3  PHE  34           HB3      PHE  34   0.354  14.974  22.275
    5    HD1  PHE  34           HD1      PHE  34   0.214  18.398  23.026
    6    HD2  PHE  34           HD2      PHE  34   0.992  15.703  19.772
    7    HE1  PHE  34           HE1      PHE  34   1.510  20.165  21.867
    8    HE2  PHE  34           HE2      PHE  34   2.283  17.473  18.617
    9    HZ   PHE  34           HZ       PHE  34   2.544  19.701  19.669

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ALA  35           H        ALA  35  -3.218  15.512  23.249
    2    HA   ALA  35           HA       ALA  35  -3.016  12.844  24.132
    3    HB3  ALA  35           HB1      ALA  35  -5.461  13.484  25.017
    4    HB1  ALA  35           HB2      ALA  35  -4.920  15.100  24.562
    5    HB2  ALA  35           HB3      ALA  35  -4.001  14.165  25.740

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ALA  36           H        ALA  36  -5.476  14.388  22.063
    2    HA   ALA  36           HA       ALA  36  -6.914  11.988  21.590
    3    HB1  ALA  36           HB1      ALA  36  -8.369  13.426  20.655
    4    HB3  ALA  36           HB2      ALA  36  -7.206  13.843  19.396
    5    HB2  ALA  36           HB3      ALA  36  -7.209  14.724  20.923

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ALA  37           H        ALA  37  -4.239  13.564  19.901
    2    HA   ALA  37           HA       ALA  37  -4.239  11.939  17.596
    3    HB3  ALA  37           HB1      ALA  37  -2.220  13.630  19.006
    4    HB2  ALA  37           HB2      ALA  37  -2.767  13.697  17.332
    5    HB1  ALA  37           HB3      ALA  37  -1.617  12.456  17.836

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LYS  38           H        LYS  38  -2.453  11.606  20.655
    2    HA   LYS  38           HA       LYS  38  -1.150   9.199  20.142
    3    HB2  LYS  38           HB2      LYS  38  -1.439  10.954  22.298
    4    HB3  LYS  38           HB3      LYS  38  -2.063   9.426  22.914
    5    HG2  LYS  38           HG2      LYS  38   0.018   8.293  22.352
    6    HG3  LYS  38           HG3      LYS  38   0.629   9.738  21.538
    7    HD2  LYS  38           HD2      LYS  38   0.827  10.946  23.577
    8    HD3  LYS  38           HD3      LYS  38  -0.191   9.799  24.449
    9    HE2  LYS  38           HE2      LYS  38   2.168   9.463  25.043
   10    HE3  LYS  38           HE3      LYS  38   1.545   8.055  24.179
   11    HZ3  LYS  38           HZ1      LYS  38   2.830   8.473  22.386
   12    HZ2  LYS  38           HZ2      LYS  38   3.803   9.289  23.517
   13    HZ1  LYS  38           HZ3      LYS  38   2.719  10.161  22.540

  No H/Q in entry =          13
  In of MODEL   83
    1    H    ALA  39           H        ALA  39  -4.371   9.711  21.579
    2    HA   ALA  39           HA       ALA  39  -4.945   6.993  22.077
    3    HB3  ALA  39           HB1      ALA  39  -7.098   8.957  21.341
    4    HB2  ALA  39           HB2      ALA  39  -6.183   9.170  22.834
    5    HB1  ALA  39           HB3      ALA  39  -7.113   7.694  22.573

  No H/Q in entry =           5
  In of MODEL   83
    1    H    MET  40           H        MET  40  -5.545   9.023  19.246
    2    HA   MET  40           HA       MET  40  -7.049   7.108  17.792
    3    HB2  MET  40           HB2      MET  40  -5.432   9.496  16.882
    4    HB3  MET  40           HB3      MET  40  -6.475   8.549  15.818
    5    HG2  MET  40           HG2      MET  40  -7.475   9.794  18.392
    6    HG3  MET  40           HG3      MET  40  -7.542  10.636  16.846
    7    HE3  MET  40           HE1      MET  40 -10.158   9.044  14.800
    8    HE2  MET  40           HE2      MET  40  -8.406   9.150  14.635
    9    HE1  MET  40           HE3      MET  40  -9.307  10.519  15.284

  No H/Q in entry =           9
  In of MODEL   83
    1    H    MET  41           H        MET  41  -3.552   7.821  17.882
    2    HA   MET  41           HA       MET  41  -2.827   6.071  15.767
    3    HB2  MET  41           HB2      MET  41  -1.181   6.716  18.226
    4    HB3  MET  41           HB3      MET  41  -0.583   6.070  16.702
    5    HG2  MET  41           HG2      MET  41  -1.735   8.265  15.719
    6    HG3  MET  41           HG3      MET  41  -1.478   8.844  17.364
    7    HE2  MET  41           HE1      MET  41   1.429   6.725  17.686
    8    HE1  MET  41           HE2      MET  41   0.658   8.020  18.599
    9    HE3  MET  41           HE3      MET  41   2.277   8.255  17.941

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ASP  42           H        ASP  42  -3.180   5.584  19.254
    2    HA   ASP  42           HA       ASP  42  -2.159   2.983  19.392
    3    HB2  ASP  42           HB2      ASP  42  -3.003   4.740  21.231
    4    HB3  ASP  42           HB3      ASP  42  -4.438   3.724  21.169

  No H/Q in entry =           4
  In of MODEL   83
    1    H    GLN  43           H        GLN  43  -5.491   4.111  18.930
    2    HA   GLN  43           HA       GLN  43  -6.652   1.532  18.735
    3    HB2  GLN  43           HB2      GLN  43  -7.570   4.195  17.627
    4    HB3  GLN  43           HB3      GLN  43  -8.542   2.722  17.608
    5    HG2  GLN  43           HG2      GLN  43  -8.225   2.587  20.112
    6    HG3  GLN  43           HG3      GLN  43  -7.491   4.188  20.041
    7   HE21  GLN  43          HE21      GLN  43  -9.655   4.275  21.563
    8   HE22  GLN  43          HE22      GLN  43 -11.020   4.863  20.748

  No H/Q in entry =           8
  In of MODEL   83
    1    H    SER  44           H        SER  44  -5.322   3.748  16.320
    2    HA   SER  44           HA       SER  44  -6.055   2.279  14.031
    3    HB2  SER  44           HB2      SER  44  -4.779   4.653  14.474
    4    HB3  SER  44           HB3      SER  44  -3.437   3.650  13.925
    5    HG   SER  44           HG       SER  44  -4.561   4.638  12.178

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ARG  45           H        ARG  45  -3.158   2.138  16.083
    2    HA   ARG  45           HA       ARG  45  -1.704   0.181  14.677
    3    HB2  ARG  45           HB2      ARG  45  -0.835   1.588  16.544
    4    HB3  ARG  45           HB3      ARG  45  -1.821   0.659  17.670
    5    HG2  ARG  45           HG2      ARG  45  -0.609  -1.405  17.005
    6    HG3  ARG  45           HG3      ARG  45   0.402  -0.451  15.922
    7    HD2  ARG  45           HD2      ARG  45   1.164   0.916  17.876
    8    HD3  ARG  45           HD3      ARG  45   0.246  -0.158  18.954
    9    HE   ARG  45           HE       ARG  45   1.919  -1.757  17.349
   10   HH21  ARG  45          HH11      ARG  45   3.822  -2.596  18.164
   11   HH22  ARG  45          HH12      ARG  45   4.613  -1.821  19.491
   12   HH11  ARG  45          HH21      ARG  45   2.261   0.696  19.748
   13   HH12  ARG  45          HH22      ARG  45   3.729   0.045  20.385

  No H/Q in entry =          13
  In of MODEL   83
    1    H    MET  46           H        MET  46  -4.078  -0.136  17.299
    2    HA   MET  46           HA       MET  46  -3.926  -2.938  17.591
    3    HB2  MET  46           HB2      MET  46  -6.080  -0.923  18.220
    4    HB3  MET  46           HB3      MET  46  -6.288  -2.643  18.559
    5    HG2  MET  46           HG2      MET  46  -4.253  -2.634  19.936
    6    HG3  MET  46           HG3      MET  46  -3.998  -0.934  19.576
    7    HE2  MET  46           HE1      MET  46  -4.280   0.186  22.225
    8    HE1  MET  46           HE2      MET  46  -3.680  -1.466  22.128
    9    HE3  MET  46           HE3      MET  46  -4.919  -1.056  23.309

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ALA  47           H        ALA  47  -5.953  -0.898  15.526
    2    HA   ALA  47           HA       ALA  47  -7.594  -2.932  14.466
    3    HB3  ALA  47           HB1      ALA  47  -8.263  -0.688  14.067
    4    HB1  ALA  47           HB2      ALA  47  -7.793  -1.318  12.488
    5    HB2  ALA  47           HB3      ALA  47  -6.697  -0.261  13.379

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LEU  48           H        LEU  48  -4.477  -1.641  13.391
    2    HA   LEU  48           HA       LEU  48  -4.230  -3.222  11.040
    3    HB2  LEU  48           HB2      LEU  48  -2.146  -1.967  12.834
    4    HB3  LEU  48           HB3      LEU  48  -1.798  -2.683  11.260
    5    HG   LEU  48           HG       LEU  48  -3.800  -0.452  11.680
    6   HD13  LEU  48          HD11      LEU  48  -1.666   0.405  12.329
    7   HD12  LEU  48          HD12      LEU  48  -1.952   0.969  10.683
    8   HD11  LEU  48          HD13      LEU  48  -0.862  -0.388  10.974
    9   HD22  LEU  48          HD21      LEU  48  -4.299  -1.423   9.604
   10   HD21  LEU  48          HD22      LEU  48  -2.623  -1.869   9.291
   11   HD23  LEU  48          HD23      LEU  48  -3.130  -0.186   9.144

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ASN  49           H        ASN  49  -3.156  -3.643  14.374
    2    HA   ASN  49           HA       ASN  49  -1.574  -5.917  14.017
    3    HB2  ASN  49           HB2      ASN  49  -1.571  -4.590  16.072
    4    HB3  ASN  49           HB3      ASN  49  -3.230  -5.066  16.409
    5   HD21  ASN  49          HD21      ASN  49  -1.238  -5.612  18.302
    6   HD22  ASN  49          HD22      ASN  49  -0.962  -7.285  18.362

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLU  50           H        GLU  50  -5.034  -5.617  14.723
    2    HA   GLU  50           HA       GLU  50  -5.568  -8.412  14.823
    3    HB2  GLU  50           HB2      GLU  50  -7.132  -6.716  15.722
    4    HB3  GLU  50           HB3      GLU  50  -7.436  -6.141  14.081
    5    HG2  GLU  50           HG2      GLU  50  -8.325  -8.327  13.441
    6    HG3  GLU  50           HG3      GLU  50  -7.935  -8.982  15.027

  No H/Q in entry =           6
  In of MODEL   83
    1    H    ALA  51           H        ALA  51  -5.640  -6.001  12.240
    2    HA   ALA  51           HA       ALA  51  -6.660  -7.710  10.218
    3    HB2  ALA  51           HB1      ALA  51  -6.437  -5.893   8.856
    4    HB1  ALA  51           HB2      ALA  51  -4.789  -5.561   9.391
    5    HB3  ALA  51           HB3      ALA  51  -6.159  -5.042  10.375

  No H/Q in entry =           5
  In of MODEL   83
    1    H    HIS  52           H        HIS  52  -3.352  -6.837  11.175
    2    HA   HIS  52           HA       HIS  52  -1.985  -8.329   9.206
    3    HB2  HIS  52           HB2      HIS  52  -0.950  -6.601  10.681
    4    HB3  HIS  52           HB3      HIS  52  -1.064  -7.734  12.027
    5    HD1  HIS  52           HD1      HIS  52   0.017 -10.262  11.239
    6    HD2  HIS  52           HD2      HIS  52   1.526  -6.787   9.499
    7    HE1  HIS  52           HE1      HIS  52   2.297 -10.857  10.313
    8    HE2  HIS  52           HE2      HIS  52   3.231  -8.750   9.248

  No H/Q in entry =           8
  In of MODEL   83
    1    H    LEU  53           H        LEU  53  -3.175  -9.211  12.425
    2    HA   LEU  53           HA       LEU  53  -2.000 -11.768  12.595
    3    HB2  LEU  53           HB2      LEU  53  -4.460 -10.566  13.840
    4    HB3  LEU  53           HB3      LEU  53  -4.020 -12.250  14.116
    5    HG   LEU  53           HG       LEU  53  -2.081  -9.962  14.587
    6   HD13  LEU  53          HD11      LEU  53  -4.025  -9.633  16.039
    7   HD12  LEU  53          HD12      LEU  53  -2.658 -10.210  16.991
    8   HD11  LEU  53          HD13      LEU  53  -3.954 -11.317  16.549
    9   HD23  LEU  53          HD21      LEU  53  -1.210 -11.788  16.252
   10   HD22  LEU  53          HD22      LEU  53  -0.838 -11.962  14.540
   11   HD21  LEU  53          HD23      LEU  53  -2.126 -12.912  15.255

  No H/Q in entry =          11
  In of MODEL   83
    1    H    VAL  54           H        VAL  54  -5.113 -10.701  11.267
    2    HA   VAL  54           HA       VAL  54  -6.059 -13.283  10.576
    3    HB   VAL  54           HB       VAL  54  -6.689 -10.538   9.461
    4   HG12  VAL  54          HG11      VAL  54  -8.812 -11.891   8.662
    5   HG11  VAL  54          HG12      VAL  54  -7.714 -13.268   8.717
    6   HG13  VAL  54          HG13      VAL  54  -7.350 -11.892   7.678
    7   HG22  VAL  54          HG21      VAL  54  -7.576 -10.578  11.621
    8   HG21  VAL  54          HG22      VAL  54  -7.848 -12.318  11.595
    9   HG23  VAL  54          HG23      VAL  54  -8.927 -11.246  10.704

  No H/Q in entry =           9
  In of MODEL   83
    1    H    GLN  55           H        GLN  55  -4.180 -10.842   8.781
    2    HA   GLN  55           HA       GLN  55  -4.087 -12.295   6.355
    3    HB2  GLN  55           HB2      GLN  55  -3.462 -10.036   6.171
    4    HB3  GLN  55           HB3      GLN  55  -2.339 -10.130   7.525
    5    HG2  GLN  55           HG2      GLN  55  -0.643 -10.987   6.229
    6    HG3  GLN  55           HG3      GLN  55  -1.735 -11.946   5.240
    7   HE21  GLN  55          HE21      GLN  55  -1.765 -11.246   3.122
    8   HE22  GLN  55          HE22      GLN  55  -1.555  -9.641   2.618

  No H/Q in entry =           8
  In of MODEL   83
    1    H    THR  56           H        THR  56  -1.954 -12.310   9.216
    2    HA   THR  56           HA       THR  56   0.099 -13.926   8.272
    3    HB   THR  56           HB       THR  56  -1.120 -14.179  11.030
    4    HG1  THR  56           HG1      THR  56  -0.239 -12.015   9.860
    5   HG23  THR  56          HG21      THR  56   0.592 -15.819  10.636
    6   HG22  THR  56          HG22      THR  56   1.322 -14.539  11.606
    7   HG21  THR  56          HG23      THR  56   1.639 -14.625   9.873

  No H/Q in entry =           7
  In of MODEL   83
    1    H    LYS  57           H        LYS  57  -3.019 -14.936   9.659
    2    HA   LYS  57           HA       LYS  57  -2.605 -17.735   9.395
    3    HB2  LYS  57           HB2      LYS  57  -4.398 -16.642  10.766
    4    HB3  LYS  57           HB3      LYS  57  -5.197 -16.160   9.277
    5    HG2  LYS  57           HG2      LYS  57  -5.491 -18.504   8.637
    6    HG3  LYS  57           HG3      LYS  57  -4.631 -19.026  10.083
    7    HD2  LYS  57           HD2      LYS  57  -6.378 -17.991  11.496
    8    HD3  LYS  57           HD3      LYS  57  -7.247 -17.483  10.049
    9    HE2  LYS  57           HE2      LYS  57  -7.489 -19.854   9.365
   10    HE3  LYS  57           HE3      LYS  57  -6.637 -20.368  10.819
   11    HZ1  LYS  57           HZ1      LYS  57  -8.426 -19.018  12.032
   12    HZ3  LYS  57           HZ2      LYS  57  -8.849 -20.537  11.400
   13    HZ2  LYS  57           HZ3      LYS  57  -9.295 -19.118  10.577

  No H/Q in entry =          13
  In of MODEL   83
    1    H    LEU  58           H        LEU  58  -3.931 -15.268   7.244
    2    HA   LEU  58           HA       LEU  58  -4.771 -17.074   5.236
    3    HB2  LEU  58           HB2      LEU  58  -4.134 -14.132   5.110
    4    HB3  LEU  58           HB3      LEU  58  -4.820 -15.055   3.771
    5    HG   LEU  58           HG       LEU  58  -6.072 -14.875   6.532
    6   HD11  LEU  58          HD11      LEU  58  -6.378 -13.213   4.051
    7   HD13  LEU  58          HD12      LEU  58  -6.346 -12.714   5.742
    8   HD12  LEU  58          HD13      LEU  58  -7.784 -13.488   5.079
    9   HD22  LEU  58          HD21      LEU  58  -7.063 -16.769   5.662
   10   HD21  LEU  58          HD22      LEU  58  -6.735 -16.313   3.990
   11   HD23  LEU  58          HD23      LEU  58  -8.082 -15.577   4.857

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  59           H        ILE  59  -1.615 -15.902   6.074
    2    HA   ILE  59           HA       ILE  59  -0.549 -16.628   3.424
    3    HB   ILE  59           HB       ILE  59   0.256 -14.580   5.002
    4   HG12  ILE  59          HG12      ILE  59   2.307 -16.240   3.523
    5   HG13  ILE  59          HG13      ILE  59   1.113 -15.272   2.698
    6   HG23  ILE  59          HG21      ILE  59   2.109 -15.094   6.368
    7   HG22  ILE  59          HG22      ILE  59   2.337 -16.670   5.642
    8   HG21  ILE  59          HG23      ILE  59   0.990 -16.383   6.744
    9   HD13  ILE  59          HD11      ILE  59   3.092 -13.923   2.898
   10   HD12  ILE  59          HD12      ILE  59   3.228 -14.298   4.613
   11   HD11  ILE  59          HD13      ILE  59   1.908 -13.281   4.034

  No H/Q in entry =          11
  In of MODEL   83
    1    H    GLU  60           H        GLU  60  -0.542 -17.750   6.787
    2    HA   GLU  60           HA       GLU  60   1.465 -19.749   6.494
    3    HB2  GLU  60           HB2      GLU  60   0.931 -20.362   8.648
    4    HB3  GLU  60           HB3      GLU  60   0.212 -18.754   8.623
    5    HG2  GLU  60           HG2      GLU  60  -1.960 -19.853   7.887
    6    HG3  GLU  60           HG3      GLU  60  -1.197 -21.405   8.233

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLY  61           H        GLY  61  -2.051 -19.806   6.039
    2    HA3  GLY  61           HA2      GLY  61  -1.842 -22.597   5.066
    3    HA2  GLY  61           HA3      GLY  61  -3.314 -21.848   5.676

  No H/Q in entry =           3
  In of MODEL   83
    1    H    ASP  62           H        ASP  62  -1.088 -20.280   3.462
    2    HA   ASP  62           HA       ASP  62  -3.137 -19.593   1.631
    3    HB2  ASP  62           HB2      ASP  62  -1.270 -18.748   0.251
    4    HB3  ASP  62           HB3      ASP  62  -1.133 -18.231   1.929

  No H/Q in entry =           4
  In of MODEL   83
    1    H    ALA  63           H        ALA  63  -0.764 -22.242   1.643
    2    HA   ALA  63           HA       ALA  63  -1.486 -23.096  -1.053
    3    HB1  ALA  63           HB1      ALA  63   0.247 -24.406   1.042
    4    HB3  ALA  63           HB2      ALA  63   0.803 -23.397  -0.293
    5    HB2  ALA  63           HB3      ALA  63   0.056 -24.961  -0.623

  No H/Q in entry =           5
  In of MODEL   83
    1    H    GLY  64           H        GLY  64  -2.003 -25.550  -1.224
    2    HA3  GLY  64           HA2      GLY  64  -3.118 -27.383   0.142
    3    HA2  GLY  64           HA3      GLY  64  -4.239 -26.119   0.621

  No H/Q in entry =           3
  In of MODEL   83
    1    H    GLU  65           H        GLU  65  -4.187 -24.930  -2.131
    2    HA   GLU  65           HA       GLU  65  -6.405 -26.364  -3.151
    3    HB2  GLU  65           HB2      GLU  65  -4.699 -24.198  -4.375
    4    HB3  GLU  65           HB3      GLU  65  -6.160 -24.840  -5.128
    5    HG2  GLU  65           HG2      GLU  65  -7.490 -24.191  -3.183
    6    HG3  GLU  65           HG3      GLU  65  -6.041 -23.624  -2.355

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLY  66           H        GLY  66  -3.041 -26.284  -4.031
    2    HA3  GLY  66           HA2      GLY  66  -3.066 -28.857  -5.229
    3    HA2  GLY  66           HA3      GLY  66  -2.986 -27.608  -6.455

  No H/Q in entry =           3
  In of MODEL   83
    1    H    LYS  67           H        LYS  67  -1.102 -26.618  -6.868
    2    HA   LYS  67           HA       LYS  67   1.282 -27.780  -5.683
    3    HB2  LYS  67           HB2      LYS  67   2.443 -26.797  -7.591
    4    HB3  LYS  67           HB3      LYS  67   1.014 -27.691  -8.122
    5    HG2  LYS  67           HG2      LYS  67  -0.281 -25.566  -8.134
    6    HG3  LYS  67           HG3      LYS  67   1.184 -24.692  -7.694
    7    HD2  LYS  67           HD2      LYS  67   2.267 -25.447  -9.775
    8    HD3  LYS  67           HD3      LYS  67   0.805 -26.332 -10.215
    9    HE2  LYS  67           HE2      LYS  67  -0.482 -24.225 -10.200
   10    HE3  LYS  67           HE3      LYS  67   0.978 -23.338  -9.763
   11    HZ2  LYS  67           HZ1      LYS  67   0.108 -23.975 -12.304
   12    HZ1  LYS  67           HZ2      LYS  67   1.455 -24.970 -12.023
   13    HZ3  LYS  67           HZ3      LYS  67   1.595 -23.284 -11.873

  No H/Q in entry =          13
  In of MODEL   83
    1    H    MET  68           H        MET  68   2.948 -25.581  -6.539
    2    HA   MET  68           HA       MET  68   3.349 -24.271  -4.085
    3    HB2  MET  68           HB2      MET  68   4.388 -23.718  -6.861
    4    HB3  MET  68           HB3      MET  68   4.956 -22.871  -5.422
    5    HG2  MET  68           HG2      MET  68   5.602 -25.021  -4.404
    6    HG3  MET  68           HG3      MET  68   5.032 -25.875  -5.840
    7    HE2  MET  68           HE1      MET  68   7.339 -27.031  -6.596
    8    HE1  MET  68           HE2      MET  68   7.567 -26.574  -4.909
    9    HE3  MET  68           HE3      MET  68   8.845 -26.259  -6.081

  No H/Q in entry =           9
  In of MODEL   83
    1    H    LYS  69           H        LYS  69   0.983 -23.591  -6.367
    2    HA   LYS  69           HA       LYS  69   1.026 -20.758  -6.329
    3    HB2  LYS  69           HB2      LYS  69  -0.057 -22.022  -8.115
    4    HB3  LYS  69           HB3      LYS  69  -1.303 -22.551  -6.978
    5    HG2  LYS  69           HG2      LYS  69  -2.059 -20.312  -6.617
    6    HG3  LYS  69           HG3      LYS  69  -0.658 -19.634  -7.448
    7    HD2  LYS  69           HD2      LYS  69  -2.916 -19.769  -8.736
    8    HD3  LYS  69           HD3      LYS  69  -1.447 -20.284  -9.566
    9    HE2  LYS  69           HE2      LYS  69  -1.922 -22.596  -9.174
   10    HE3  LYS  69           HE3      LYS  69  -3.204 -22.205  -8.028
   11    HZ3  LYS  69           HZ1      LYS  69  -4.648 -22.081  -9.680
   12    HZ2  LYS  69           HZ2      LYS  69  -3.442 -22.595 -10.760
   13    HZ1  LYS  69           HZ3      LYS  69  -3.702 -20.937 -10.499

  No H/Q in entry =          13
  In of MODEL   83
    1    H    VAL  70           H        VAL  70  -0.339 -19.231  -5.371
    2    HA   VAL  70           HA       VAL  70  -1.721 -20.105  -2.896
    3    HB   VAL  70           HB       VAL  70  -0.952 -17.966  -1.870
    4   HG13  VAL  70          HG11      VAL  70   1.370 -18.673  -1.499
    5   HG12  VAL  70          HG12      VAL  70   1.293 -19.709  -2.925
    6   HG11  VAL  70          HG13      VAL  70   0.301 -20.075  -1.514
    7   HG21  VAL  70          HG21      VAL  70   0.517 -17.717  -4.517
    8   HG23  VAL  70          HG22      VAL  70   1.037 -16.853  -3.071
    9   HG22  VAL  70          HG23      VAL  70  -0.556 -16.539  -3.755

  No H/Q in entry =           9
  In of MODEL   83
    1    H    SER  71           H        SER  71  -3.249 -18.397  -2.112
    2    HA   SER  71           HA       SER  71  -5.185 -17.750  -4.063
    3    HB2  SER  71           HB2      SER  71  -5.658 -17.990  -1.608
    4    HB3  SER  71           HB3      SER  71  -4.804 -16.476  -1.330
    5    HG   SER  71           HG       SER  71  -7.136 -16.900  -2.896

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LEU  72           H        LEU  72  -5.395 -16.078  -5.376
    2    HA   LEU  72           HA       LEU  72  -3.274 -14.285  -5.869
    3    HB2  LEU  72           HB2      LEU  72  -6.149 -14.304  -6.786
    4    HB3  LEU  72           HB3      LEU  72  -4.945 -13.157  -7.369
    5    HG   LEU  72           HG       LEU  72  -4.582 -16.168  -7.521
    6   HD13  LEU  72          HD11      LEU  72  -5.245 -16.008  -9.855
    7   HD12  LEU  72          HD12      LEU  72  -5.458 -14.263  -9.712
    8   HD11  LEU  72          HD13      LEU  72  -6.543 -15.357  -8.854
    9   HD23  LEU  72          HD21      LEU  72  -3.009 -15.314  -9.434
   10   HD22  LEU  72          HD22      LEU  72  -2.437 -15.187  -7.778
   11   HD21  LEU  72          HD23      LEU  72  -3.092 -13.769  -8.594

  No H/Q in entry =          11
  In of MODEL   83
    1    H    VAL  73           H        VAL  73  -6.347 -13.906  -4.206
    2    HA   VAL  73           HA       VAL  73  -6.361 -11.136  -3.840
    3    HB   VAL  73           HB       VAL  73  -8.060 -11.489  -2.232
    4   HG11  VAL  73          HG11      VAL  73  -8.539 -12.219  -4.589
    5   HG13  VAL  73          HG12      VAL  73  -9.529 -13.031  -3.379
    6   HG12  VAL  73          HG13      VAL  73  -8.158 -13.871  -4.103
    7   HG22  VAL  73          HG21      VAL  73  -7.235 -12.956  -0.625
    8   HG21  VAL  73          HG22      VAL  73  -6.638 -14.099  -1.828
    9   HG23  VAL  73          HG23      VAL  73  -8.364 -14.009  -1.477

  No H/Q in entry =           9
  In of MODEL   83
    1    H    LEU  74           H        LEU  74  -4.431 -13.532  -2.289
    2    HA   LEU  74           HA       LEU  74  -3.983 -12.409   0.236
    3    HB2  LEU  74           HB2      LEU  74  -3.227 -14.633  -0.289
    4    HB3  LEU  74           HB3      LEU  74  -2.174 -14.020  -1.563
    5    HG   LEU  74           HG       LEU  74  -0.849 -12.793   0.126
    6   HD13  LEU  74          HD11      LEU  74  -2.386 -12.305   1.865
    7   HD12  LEU  74          HD12      LEU  74  -1.332 -13.538   2.562
    8   HD11  LEU  74          HD13      LEU  74  -2.932 -13.980   1.965
    9   HD23  LEU  74          HD21      LEU  74  -1.061 -15.547   1.216
   10   HD22  LEU  74          HD22      LEU  74   0.339 -14.639   0.693
   11   HD21  LEU  74          HD23      LEU  74  -0.704 -15.376  -0.502

  No H/Q in entry =          11
  In of MODEL   83
    1    H    VAL  75           H        VAL  75  -2.118 -12.018  -2.738
    2    HA   VAL  75           HA       VAL  75  -0.292 -10.117  -1.736
    3    HB   VAL  75           HB       VAL  75  -1.281 -10.569  -4.553
    4   HG12  VAL  75          HG11      VAL  75   0.785  -9.283  -5.188
    5   HG11  VAL  75          HG12      VAL  75   1.031  -8.908  -3.490
    6   HG13  VAL  75          HG13      VAL  75  -0.383  -8.289  -4.326
    7   HG22  VAL  75          HG21      VAL  75   0.874 -11.753  -4.773
    8   HG21  VAL  75          HG22      VAL  75  -0.091 -12.466  -3.479
    9   HG23  VAL  75          HG23      VAL  75   1.254 -11.393  -3.088

  No H/Q in entry =           9
  In of MODEL   83
    1    H    GLU  76           H        GLU  76  -3.455  -9.730  -3.359
    2    HA   GLU  76           HA       GLU  76  -3.480  -6.914  -3.444
    3    HB2  GLU  76           HB2      GLU  76  -5.166  -8.318  -4.601
    4    HB3  GLU  76           HB3      GLU  76  -5.802  -8.839  -3.049
    5    HG2  GLU  76           HG2      GLU  76  -7.259  -7.105  -3.880
    6    HG3  GLU  76           HG3      GLU  76  -6.357  -6.418  -2.542

  No H/Q in entry =           6
  In of MODEL   83
    1    H    ALA  77           H        ALA  77  -4.587  -9.146  -0.906
    2    HA   ALA  77           HA       ALA  77  -5.505  -7.144   0.874
    3    HB1  ALA  77           HB1      ALA  77  -4.438  -9.913   1.481
    4    HB2  ALA  77           HB2      ALA  77  -6.118  -9.499   1.143
    5    HB3  ALA  77           HB3      ALA  77  -5.341  -8.899   2.606

  No H/Q in entry =           5
  In of MODEL   83
    1    H    GLN  78           H        GLN  78  -2.378  -8.723   0.468
    2    HA   GLN  78           HA       GLN  78  -1.085  -7.588   2.712
    3    HB2  GLN  78           HB2      GLN  78  -0.255  -9.530   1.339
    4    HB3  GLN  78           HB3      GLN  78   0.175  -8.383   0.073
    5    HG2  GLN  78           HG2      GLN  78   1.662  -7.205   1.647
    6    HG3  GLN  78           HG3      GLN  78   1.239  -8.357   2.911
    7   HE21  GLN  78          HE21      GLN  78   3.951  -8.088   2.034
    8   HE22  GLN  78          HE22      GLN  78   4.394  -9.514   1.226

  No H/Q in entry =           8
  In of MODEL   83
    1    H    LEU  79           H        LEU  79  -1.475  -6.504  -0.625
    2    HA   LEU  79           HA       LEU  79   0.235  -4.295  -0.617
    3    HB2  LEU  79           HB2      LEU  79  -0.822  -5.080  -2.664
    4    HB3  LEU  79           HB3      LEU  79  -2.415  -4.674  -2.037
    5    HG   LEU  79           HG       LEU  79  -1.845  -2.293  -2.004
    6   HD13  LEU  79          HD11      LEU  79   0.403  -2.077  -1.513
    7   HD12  LEU  79          HD12      LEU  79   0.437  -1.780  -3.251
    8   HD11  LEU  79          HD13      LEU  79   0.881  -3.366  -2.618
    9   HD23  LEU  79          HD21      LEU  79  -1.235  -2.087  -4.561
   10   HD22  LEU  79          HD22      LEU  79  -2.764  -2.821  -4.091
   11   HD21  LEU  79          HD23      LEU  79  -1.407  -3.842  -4.555

  No H/Q in entry =          11
  In of MODEL   83
    1    H    HIS  80           H        HIS  80  -3.225  -4.425   0.244
    2    HA   HIS  80           HA       HIS  80  -3.379  -1.671   0.925
    3    HB2  HIS  80           HB2      HIS  80  -5.103  -4.062   1.248
    4    HB3  HIS  80           HB3      HIS  80  -5.398  -2.725   2.363
    5    HD1  HIS  80           HD1      HIS  80  -7.006  -1.065   1.481
    6    HD2  HIS  80           HD2      HIS  80  -4.865  -2.884  -1.599
    7    HE1  HIS  80           HE1      HIS  80  -7.858  -0.047  -0.683
    8    HE2  HIS  80           HE2      HIS  80  -6.559  -1.150  -2.570

  No H/Q in entry =           8
  In of MODEL   83
    1    H    LEU  81           H        LEU  81  -2.902  -4.582   2.897
    2    HA   LEU  81           HA       LEU  81  -2.849  -3.249   5.388
    3    HB2  LEU  81           HB2      LEU  81  -1.669  -5.874   4.482
    4    HB3  LEU  81           HB3      LEU  81  -1.619  -5.325   6.158
    5    HG   LEU  81           HG       LEU  81  -4.184  -5.539   4.555
    6   HD12  LEU  81          HD11      LEU  81  -4.495  -7.610   6.095
    7   HD11  LEU  81          HD12      LEU  81  -2.740  -7.560   6.263
    8   HD13  LEU  81          HD13      LEU  81  -3.468  -7.774   4.670
    9   HD23  LEU  81          HD21      LEU  81  -5.004  -5.747   7.064
   10   HD22  LEU  81          HD22      LEU  81  -4.668  -4.158   6.380
   11   HD21  LEU  81          HD23      LEU  81  -3.479  -4.938   7.423

  No H/Q in entry =          11
  In of MODEL   83
    1    H    MET  82           H        MET  82  -0.201  -4.171   3.185
    2    HA   MET  82           HA       MET  82   1.910  -3.310   4.852
    3    HB2  MET  82           HB2      MET  82   1.660  -3.633   1.860
    4    HB3  MET  82           HB3      MET  82   3.156  -3.084   2.611
    5    HG2  MET  82           HG2      MET  82   1.727  -5.660   3.336
    6    HG3  MET  82           HG3      MET  82   3.088  -5.561   2.222
    7    HE3  MET  82           HE1      MET  82   6.132  -4.871   4.178
    8    HE2  MET  82           HE2      MET  82   5.219  -3.490   3.577
    9    HE1  MET  82           HE3      MET  82   5.280  -4.975   2.632

  No H/Q in entry =           9
  In of MODEL   83
    1    H    THR  83           H        THR  83   0.081  -1.633   2.323
    2    HA   THR  83           HA       THR  83   1.523   0.798   2.408
    3    HB   THR  83           HB       THR  83  -0.652   1.754   1.450
    4    HG1  THR  83           HG1      THR  83  -2.319   0.478   1.353
    5   HG22  THR  83          HG21      THR  83  -0.425  -0.055  -0.563
    6   HG21  THR  83          HG22      THR  83   1.081  -0.370   0.296
    7   HG23  THR  83          HG23      THR  83   0.733   1.250  -0.306

  No H/Q in entry =           7
  In of MODEL   83
    1    H    SER  84           H        SER  84  -1.478  -0.207   4.035
    2    HA   SER  84           HA       SER  84  -1.931   2.221   5.398
    3    HB2  SER  84           HB2      SER  84  -2.792  -0.609   5.956
    4    HB3  SER  84           HB3      SER  84  -3.258   0.732   7.001
    5    HG   SER  84           HG       SER  84  -3.750   0.439   4.213

  No H/Q in entry =           5
  In of MODEL   83
    1    H    MET  85           H        MET  85  -0.245  -0.738   6.494
    2    HA   MET  85           HA       MET  85   0.313   0.168   9.097
    3    HB2  MET  85           HB2      MET  85   0.569  -2.175   8.406
    4    HB3  MET  85           HB3      MET  85   1.944  -1.724   7.397
    5    HG2  MET  85           HG2      MET  85   3.157  -0.917   9.383
    6    HG3  MET  85           HG3      MET  85   1.774  -1.323  10.399
    7    HE2  MET  85           HE1      MET  85   2.099  -4.817  11.312
    8    HE1  MET  85           HE2      MET  85   0.970  -3.492  11.035
    9    HE3  MET  85           HE3      MET  85   2.419  -3.220  11.998

  No H/Q in entry =           9
  In of MODEL   83
    1    H    LEU  86           H        LEU  86   2.220   0.416   6.127
    2    HA   LEU  86           HA       LEU  86   4.462   1.692   7.266
    3    HB2  LEU  86           HB2      LEU  86   4.233   0.625   4.954
    4    HB3  LEU  86           HB3      LEU  86   3.438   2.120   4.458
    5    HG   LEU  86           HG       LEU  86   5.492   3.335   5.423
    6   HD11  LEU  86          HD11      LEU  86   6.173   0.710   6.202
    7   HD13  LEU  86          HD12      LEU  86   7.195   2.142   6.296
    8   HD12  LEU  86          HD13      LEU  86   7.276   1.100   4.878
    9   HD23  LEU  86          HD21      LEU  86   6.162   1.576   3.056
   10   HD22  LEU  86          HD22      LEU  86   6.579   3.266   3.323
   11   HD21  LEU  86          HD23      LEU  86   4.917   2.821   2.939

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ALA  87           H        ALA  87   1.549   2.981   5.719
    2    HA   ALA  87           HA       ALA  87   2.179   5.703   5.811
    3    HB1  ALA  87           HB1      ALA  87  -0.157   4.107   5.286
    4    HB3  ALA  87           HB2      ALA  87   0.170   5.767   4.791
    5    HB2  ALA  87           HB3      ALA  87  -0.611   5.447   6.342

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ARG  88           H        ARG  88   0.489   3.710   8.209
    2    HA   ARG  88           HA       ARG  88   0.023   5.756  10.071
    3    HB2  ARG  88           HB2      ARG  88  -0.945   3.415  10.135
    4    HB3  ARG  88           HB3      ARG  88   0.597   2.892  10.823
    5    HG2  ARG  88           HG2      ARG  88   0.164   4.963  12.458
    6    HG3  ARG  88           HG3      ARG  88  -1.511   4.662  12.018
    7    HD2  ARG  88           HD2      ARG  88  -1.629   2.808  13.256
    8    HD3  ARG  88           HD3      ARG  88  -0.053   2.209  12.705
    9    HE   ARG  88           HE       ARG  88  -0.545   3.466  15.171
   10   HH21  ARG  88          HH11      ARG  88   1.039   4.451  16.398
   11   HH22  ARG  88          HH12      ARG  88   2.556   4.863  15.680
   12   HH11  ARG  88          HH21      ARG  88   1.711   3.632  12.571
   13   HH12  ARG  88          HH22      ARG  88   2.945   4.383  13.525

  No H/Q in entry =          13
  In of MODEL   83
    1    H    GLU  89           H        GLU  89   2.789   3.504   9.807
    2    HA   GLU  89           HA       GLU  89   4.086   4.364  12.142
    3    HB2  GLU  89           HB2      GLU  89   4.705   2.345  10.781
    4    HB3  GLU  89           HB3      GLU  89   5.482   3.436   9.632
    5    HG2  GLU  89           HG2      GLU  89   6.996   4.255  11.364
    6    HG3  GLU  89           HG3      GLU  89   6.162   3.303  12.588

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LEU  90           H        LEU  90   4.382   5.536   8.817
    2    HA   LEU  90           HA       LEU  90   6.342   7.509   9.392
    3    HB2  LEU  90           HB2      LEU  90   4.309   7.214   7.184
    4    HB3  LEU  90           HB3      LEU  90   5.555   8.469   7.199
    5    HG   LEU  90           HG       LEU  90   6.197   5.523   7.511
    6   HD12  LEU  90          HD11      LEU  90   6.923   5.760   5.065
    7   HD11  LEU  90          HD12      LEU  90   5.924   7.213   5.034
    8   HD13  LEU  90          HD13      LEU  90   5.189   5.647   5.377
    9   HD22  LEU  90          HD21      LEU  90   8.115   6.647   8.179
   10   HD21  LEU  90          HD22      LEU  90   7.771   8.061   7.182
   11   HD23  LEU  90          HD23      LEU  90   8.406   6.592   6.441

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  91           H        ILE  91   2.803   7.567   9.281
    2    HA   ILE  91           HA       ILE  91   2.498  10.341   9.749
    3    HB   ILE  91           HB       ILE  91   0.685   7.984  10.298
    4   HG12  ILE  91          HG12      ILE  91   0.442  10.278   8.328
    5   HG13  ILE  91          HG13      ILE  91   1.281   8.776   7.939
    6   HG22  ILE  91          HG21      ILE  91  -1.023  10.062  10.390
    7   HG21  ILE  91          HG22      ILE  91   0.395  10.872  11.052
    8   HG23  ILE  91          HG23      ILE  91  -0.250   9.438  11.848
    9   HD13  ILE  91          HD11      ILE  91  -0.677   7.511   7.997
   10   HD12  ILE  91          HD12      ILE  91  -1.256   9.036   7.329
   11   HD11  ILE  91          HD13      ILE  91  -1.514   8.666   9.035

  No H/Q in entry =          11
  In of MODEL   83
    1    H    THR  92           H        THR  92   2.892   7.584  11.932
    2    HA   THR  92           HA       THR  92   2.490   8.951  14.367
    3    HB   THR  92           HB       THR  92   4.265   6.599  13.672
    4    HG1  THR  92           HG1      THR  92   2.287   5.864  13.588
    5   HG22  THR  92          HG21      THR  92   3.906   6.306  16.308
    6   HG21  THR  92          HG22      THR  92   3.860   8.066  16.244
    7   HG23  THR  92          HG23      THR  92   5.277   7.198  15.652

  No H/Q in entry =           7
  In of MODEL   83
    1    H    GLU  93           H        GLU  93   5.415   8.479  12.401
    2    HA   GLU  93           HA       GLU  93   7.202   9.878  14.087
    3    HB2  GLU  93           HB2      GLU  93   7.256   9.578  11.069
    4    HB3  GLU  93           HB3      GLU  93   8.612  10.088  12.072
    5    HG2  GLU  93           HG2      GLU  93   7.179   7.465  12.522
    6    HG3  GLU  93           HG3      GLU  93   8.553   7.607  11.432

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LEU  94           H        LEU  94   5.137  10.928  11.400
    2    HA   LEU  94           HA       LEU  94   5.969  13.624  11.304
    3    HB2  LEU  94           HB2      LEU  94   3.357  12.290  10.571
    4    HB3  LEU  94           HB3      LEU  94   3.631  14.016  10.335
    5    HG   LEU  94           HG       LEU  94   5.617  12.012   9.255
    6   HD11  LEU  94          HD11      LEU  94   2.870  12.596   8.223
    7   HD13  LEU  94          HD12      LEU  94   3.837  11.130   8.080
    8   HD12  LEU  94          HD13      LEU  94   4.175  12.512   7.039
    9   HD23  LEU  94          HD21      LEU  94   5.868  13.854   7.538
   10   HD22  LEU  94          HD22      LEU  94   6.305  14.335   9.178
   11   HD21  LEU  94          HD23      LEU  94   4.752  14.822   8.498

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  95           H        ILE  95   3.434  12.024  13.214
    2    HA   ILE  95           HA       ILE  95   2.427  14.378  14.430
    3    HB   ILE  95           HB       ILE  95   2.425  11.492  15.341
    4   HG12  ILE  95          HG12      ILE  95   0.211  13.293  14.323
    5   HG13  ILE  95          HG13      ILE  95   1.147  12.229  13.276
    6   HG21  ILE  95          HG21      ILE  95   1.179  13.971  16.567
    7   HG23  ILE  95          HG22      ILE  95   2.224  12.788  17.356
    8   HG22  ILE  95          HG23      ILE  95   0.580  12.346  16.895
    9   HD13  ILE  95          HD11      ILE  95   0.234  10.295  14.195
   10   HD12  ILE  95          HD12      ILE  95  -1.136  11.398  14.291
   11   HD11  ILE  95          HD13      ILE  95  -0.160  11.083  15.724

  No H/Q in entry =          11
  In of MODEL   83
    1    H    GLU  96           H        GLU  96   5.010  12.130  15.389
    2    HA   GLU  96           HA       GLU  96   5.602  13.311  17.881
    3    HB2  GLU  96           HB2      GLU  96   6.523  11.146  17.214
    4    HB3  GLU  96           HB3      GLU  96   7.450  11.917  15.928
    5    HG2  GLU  96           HG2      GLU  96   9.119  12.442  17.376
    6    HG3  GLU  96           HG3      GLU  96   7.990  13.261  18.447

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LEU  97           H        LEU  97   6.651  14.088  14.588
    2    HA   LEU  97           HA       LEU  97   8.562  16.064  15.290
    3    HB2  LEU  97           HB2      LEU  97   6.941  15.541  12.809
    4    HB3  LEU  97           HB3      LEU  97   7.975  16.963  12.927
    5    HG   LEU  97           HG       LEU  97   8.984  14.153  13.463
    6   HD12  LEU  97          HD11      LEU  97   9.959  14.349  11.137
    7   HD11  LEU  97          HD12      LEU  97   8.918  15.750  10.891
    8   HD13  LEU  97          HD13      LEU  97   8.207  14.163  11.185
    9   HD23  LEU  97          HD21      LEU  97  11.157  15.416  12.705
   10   HD22  LEU  97          HD22      LEU  97  10.556  15.683  14.341
   11   HD21  LEU  97          HD23      LEU  97  10.241  16.875  13.082

  No H/Q in entry =          11
  In of MODEL   83
    1    H    HIS  98           H        HIS  98   5.066  16.234  14.672
    2    HA   HIS  98           HA       HIS  98   4.793  19.035  14.823
    3    HB2  HIS  98           HB2      HIS  98   2.890  16.798  15.557
    4    HB3  HIS  98           HB3      HIS  98   2.439  18.502  15.626
    5    HD1  HIS  98           HD1      HIS  98   3.412  15.790  13.198
    6    HD2  HIS  98           HD2      HIS  98   2.070  19.736  13.108
    7    HE1  HIS  98           HE1      HIS  98   2.833  16.295  10.782
    8    HE2  HIS  98           HE2      HIS  98   2.019  18.692  10.706

  No H/Q in entry =           8
  In of MODEL   83
    1    H    GLU  99           H        GLU  99   4.929  16.534  17.309
    2    HA   GLU  99           HA       GLU  99   4.358  18.223  19.520
    3    HB2  GLU  99           HB2      GLU  99   4.248  15.741  19.607
    4    HB3  GLU  99           HB3      GLU  99   6.006  15.681  19.481
    5    HG2  GLU  99           HG2      GLU  99   6.227  16.962  21.559
    6    HG3  GLU  99           HG3      GLU  99   4.477  17.118  21.673

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LYS 100           H        LYS 100   7.388  17.273  17.921
    2    HA   LYS 100           HA       LYS 100   9.073  18.650  19.767
    3    HB2  LYS 100           HB2      LYS 100   9.536  17.735  16.920
    4    HB3  LYS 100           HB3      LYS 100  10.782  18.489  17.919
    5    HG2  LYS 100           HG2      LYS 100  10.408  16.733  19.655
    6    HG3  LYS 100           HG3      LYS 100   9.258  15.945  18.572
    7    HD2  LYS 100           HD2      LYS 100  11.033  15.654  16.886
    8    HD3  LYS 100           HD3      LYS 100  12.187  16.455  17.954
    9    HE2  LYS 100           HE2      LYS 100  11.793  14.695  19.668
   10    HE3  LYS 100           HE3      LYS 100  10.699  13.874  18.549
   11    HZ1  LYS 100           HZ1      LYS 100  13.519  14.522  17.869
   12    HZ3  LYS 100           HZ2      LYS 100  12.458  13.480  17.046
   13    HZ2  LYS 100           HZ3      LYS 100  13.058  13.048  18.577

  No H/Q in entry =          13
  In of MODEL   83
    1    H    LEU 101           H        LEU 101   7.358  19.606  16.834
    2    HA   LEU 101           HA       LEU 101   8.592  22.154  16.499
    3    HB2  LEU 101           HB2      LEU 101   5.977  20.948  15.632
    4    HB3  LEU 101           HB3      LEU 101   6.241  22.677  15.430
    5    HG   LEU 101           HG       LEU 101   8.249  20.648  14.435
    6   HD12  LEU 101          HD11      LEU 101   7.078  21.175  12.164
    7   HD11  LEU 101          HD12      LEU 101   5.692  21.613  13.160
    8   HD13  LEU 101          HD13      LEU 101   6.343  19.976  13.228
    9   HD21  LEU 101          HD21      LEU 101   7.642  23.568  13.899
   10   HD23  LEU 101          HD22      LEU 101   8.603  22.605  12.778
   11   HD22  LEU 101          HD23      LEU 101   9.164  22.850  14.432

  No H/Q in entry =          11
  In of MODEL   83
    1    H    LYS 102           H        LYS 102   7.071  21.017  19.124
    2    HA   LYS 102           HA       LYS 102   6.468  22.105  21.068
    3    HB2  LYS 102           HB2      LYS 102   7.757  24.089  19.940
    4    HB3  LYS 102           HB3      LYS 102   6.160  24.710  19.583
    5    HG2  LYS 102           HG2      LYS 102   7.561  24.428  22.220
    6    HG3  LYS 102           HG3      LYS 102   6.614  25.769  21.607
    7    HD2  LYS 102           HD2      LYS 102   5.355  23.139  22.486
    8    HD3  LYS 102           HD3      LYS 102   5.627  24.493  23.573
    9    HE2  LYS 102           HE2      LYS 102   3.329  24.118  22.105
   10    HE3  LYS 102           HE3      LYS 102   3.853  25.656  22.790
   11    HZ2  LYS 102           HZ1      LYS 102   3.300  25.780  20.416
   12    HZ1  LYS 102           HZ2      LYS 102   4.548  24.688  20.075
   13    HZ3  LYS 102           HZ3      LYS 102   4.912  26.212  20.722

  No H/Q in entry =          13
  In of MODEL   83
    1    H    ALA 103           H        ALA 103   4.816  23.676  18.325
    2    HA   ALA 103           HA       ALA 103   2.377  24.271  19.237
    3    HB1  ALA 103           HB1      ALA 103   1.448  23.448  17.000
    4    HB2  ALA 103           HB2      ALA 103   3.087  22.898  16.651
    5    HB3  ALA 103           HB3      ALA 103   2.771  24.612  16.929

  No H/Q in entry =           5
  In of MODEL   83
    1    H1   ALA   1           H3       ALA   1  10.307 -20.180  -6.340
    2    H2   ALA   1           H2       ALA   1   9.327 -20.370  -7.717
    3    H3   ALA   1           H1       ALA   1   8.898 -21.119  -6.254
    4    HA   ALA   1           HA       ALA   1   9.912 -22.935  -7.013
    5    HB1  ALA   1           HB1      ALA   1   9.987 -22.565  -9.287
    6    HB2  ALA   1           HB2      ALA   1  11.719 -22.433  -8.975
    7    HB3  ALA   1           HB3      ALA   1  10.734 -20.976  -9.109

  No H/Q in entry =           7
  In of MODEL   83
    1    H    GLU   2           H        GLU   2  12.185 -23.907  -7.099
    2    HA   GLU   2           HA       GLU   2  13.590 -23.851  -4.901
    3    HB2  GLU   2           HB2      GLU   2  14.920 -23.719  -7.613
    4    HB3  GLU   2           HB3      GLU   2  15.657 -24.345  -6.139
    5    HG2  GLU   2           HG2      GLU   2  14.617 -26.350  -6.379
    6    HG3  GLU   2           HG3      GLU   2  13.051 -25.588  -6.618

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLU   3           H        GLU   3  15.355 -21.992  -7.311
    2    HA   GLU   3           HA       GLU   3  16.545 -20.326  -5.355
    3    HB2  GLU   3           HB2      GLU   3  16.458 -20.308  -8.365
    4    HB3  GLU   3           HB3      GLU   3  17.227 -18.991  -7.479
    5    HG2  GLU   3           HG2      GLU   3  18.885 -20.387  -6.580
    6    HG3  GLU   3           HG3      GLU   3  17.921 -21.843  -6.798

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LEU   4           H        LEU   4  14.245 -19.442  -7.958
    2    HA   LEU   4           HA       LEU   4  13.811 -16.832  -7.329
    3    HB2  LEU   4           HB2      LEU   4  11.609 -18.780  -8.046
    4    HB3  LEU   4           HB3      LEU   4  11.550 -17.030  -8.235
    5    HG   LEU   4           HG       LEU   4  13.481 -18.906  -9.638
    6   HD13  LEU   4          HD11      LEU   4  12.161 -18.734 -11.533
    7   HD12  LEU   4          HD12      LEU   4  11.473 -17.185 -11.051
    8   HD11  LEU   4          HD13      LEU   4  10.913 -18.673 -10.291
    9   HD23  LEU   4          HD21      LEU   4  13.826 -16.657 -10.982
   10   HD22  LEU   4          HD22      LEU   4  14.699 -16.916  -9.472
   11   HD21  LEU   4          HD23      LEU   4  13.256 -15.905  -9.491

  No H/Q in entry =          11
  In of MODEL   83
    1    H    GLU   5           H        GLU   5  12.315 -19.609  -5.685
    2    HA   GLU   5           HA       GLU   5  10.672 -18.029  -3.957
    3    HB2  GLU   5           HB2      GLU   5  10.242 -20.414  -4.500
    4    HB3  GLU   5           HB3      GLU   5  11.657 -20.850  -3.540
    5    HG2  GLU   5           HG2      GLU   5   9.731 -21.068  -2.110
    6    HG3  GLU   5           HG3      GLU   5  10.613 -19.629  -1.598

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLU   6           H        GLU   6  13.806 -19.643  -3.555
    2    HA   GLU   6           HA       GLU   6  14.196 -18.804  -0.856
    3    HB2  GLU   6           HB2      GLU   6  15.419 -20.713  -1.732
    4    HB3  GLU   6           HB3      GLU   6  16.165 -19.705  -2.974
    5    HG2  GLU   6           HG2      GLU   6  17.624 -20.144  -0.953
    6    HG3  GLU   6           HG3      GLU   6  17.378 -18.438  -1.329

  No H/Q in entry =           6
  In of MODEL   83
    1    H    VAL   7           H        VAL   7  14.942 -17.469  -4.007
    2    HA   VAL   7           HA       VAL   7  16.658 -15.363  -3.150
    3    HB   VAL   7           HB       VAL   7  14.923 -15.697  -5.611
    4   HG11  VAL   7          HG11      VAL   7  16.846 -13.507  -4.807
    5   HG13  VAL   7          HG12      VAL   7  15.199 -13.345  -5.413
    6   HG12  VAL   7          HG13      VAL   7  16.492 -13.855  -6.499
    7   HG21  VAL   7          HG21      VAL   7  17.021 -17.177  -5.071
    8   HG23  VAL   7          HG22      VAL   7  17.936 -15.723  -5.472
    9   HG22  VAL   7          HG23      VAL   7  16.880 -16.457  -6.676

  No H/Q in entry =           9
  In of MODEL   83
    1    H    VAL   8           H        VAL   8  13.157 -15.596  -3.671
    2    HA   VAL   8           HA       VAL   8  12.522 -12.884  -3.179
    3    HB   VAL   8           HB       VAL   8  10.893 -15.402  -2.746
    4   HG13  VAL   8          HG11      VAL   8   9.949 -13.692  -1.341
    5   HG12  VAL   8          HG12      VAL   8   8.949 -13.763  -2.793
    6   HG11  VAL   8          HG13      VAL   8  10.133 -12.471  -2.601
    7   HG22  VAL   8          HG21      VAL   8  10.267 -15.223  -4.958
    8   HG21  VAL   8          HG22      VAL   8  11.758 -14.296  -5.112
    9   HG23  VAL   8          HG23      VAL   8  10.222 -13.462  -4.899

  No H/Q in entry =           9
  In of MODEL   83
    1    H    MET   9           H        MET   9  12.785 -15.703  -1.016
    2    HA   MET   9           HA       MET   9  12.007 -14.436   1.369
    3    HB2  MET   9           HB2      MET   9  13.877 -16.730   0.790
    4    HB3  MET   9           HB3      MET   9  13.619 -16.151   2.436
    5    HG2  MET   9           HG2      MET   9  11.222 -16.555   2.251
    6    HG3  MET   9           HG3      MET   9  11.405 -17.019   0.558
    7    HE1  MET   9           HE1      MET   9  12.336 -17.502   4.095
    8    HE3  MET   9           HE2      MET   9  13.923 -18.101   3.621
    9    HE2  MET   9           HE3      MET   9  12.747 -19.207   4.324

  No H/Q in entry =           9
  In of MODEL   83
    1    H    GLY  10           H        GLY  10  15.169 -14.682  -0.222
    2    HA3  GLY  10           HA2      GLY  10  16.661 -13.284   1.740
    3    HA2  GLY  10           HA3      GLY  10  17.105 -13.445   0.041

  No H/Q in entry =           3
  In of MODEL   83
    1    H    LEU  11           H        LEU  11  14.935 -12.198  -1.170
    2    HA   LEU  11           HA       LEU  11  15.646  -9.460  -1.000
    3    HB2  LEU  11           HB2      LEU  11  13.253 -10.843  -2.217
    4    HB3  LEU  11           HB3      LEU  11  13.547  -9.110  -2.371
    5    HG   LEU  11           HG       LEU  11  15.548 -11.233  -3.191
    6   HD13  LEU  11          HD11      LEU  11  13.784 -11.577  -4.694
    7   HD12  LEU  11          HD12      LEU  11  14.788 -10.400  -5.539
    8   HD11  LEU  11          HD13      LEU  11  13.328  -9.873  -4.703
    9   HD22  LEU  11          HD21      LEU  11  16.799  -9.281  -2.968
   10   HD21  LEU  11          HD22      LEU  11  15.429  -8.231  -3.327
   11   HD23  LEU  11          HD23      LEU  11  16.239  -9.099  -4.629

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  12           H        ILE  12  12.875 -11.269   0.287
    2    HA   ILE  12           HA       ILE  12  11.511  -9.039   1.372
    3    HB   ILE  12           HB       ILE  12  11.534 -11.927   2.305
    4   HG12  ILE  12          HG12      ILE  12  10.826 -11.280  -0.130
    5   HG13  ILE  12          HG13      ILE  12   9.791 -12.356   0.790
    6   HG23  ILE  12          HG21      ILE  12  10.616 -10.549   4.064
    7   HG22  ILE  12          HG22      ILE  12   9.260 -11.321   3.243
    8   HG21  ILE  12          HG23      ILE  12   9.647  -9.633   2.910
    9   HD13  ILE  12          HD11      ILE  12   8.302 -10.516   1.318
   10   HD12  ILE  12          HD12      ILE  12   8.565 -10.544  -0.425
   11   HD11  ILE  12          HD13      ILE  12   9.399  -9.369   0.568

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  13           H        ILE  13  13.901 -11.270   2.742
    2    HA   ILE  13           HA       ILE  13  13.972 -10.104   5.328
    3    HB   ILE  13           HB       ILE  13  16.009 -11.680   3.735
    4   HG12  ILE  13          HG12      ILE  13  13.752 -12.666   4.540
    5   HG13  ILE  13          HG13      ILE  13  15.222 -13.574   4.875
    6   HG23  ILE  13          HG21      ILE  13  17.433 -10.642   5.250
    7   HG22  ILE  13          HG22      ILE  13  16.955 -12.058   6.176
    8   HG21  ILE  13          HG23      ILE  13  16.193 -10.499   6.494
    9   HD11  ILE  13          HD11      ILE  13  14.417 -11.607   6.964
   10   HD13  ILE  13          HD12      ILE  13  15.078 -13.230   7.132
   11   HD12  ILE  13          HD13      ILE  13  13.371 -13.013   6.770

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ASN  14           H        ASN  14  15.900  -9.573   2.392
    2    HA   ASN  14           HA       ASN  14  17.668  -7.649   3.445
    3    HB2  ASN  14           HB2      ASN  14  17.613  -8.903   1.124
    4    HB3  ASN  14           HB3      ASN  14  16.725  -7.478   0.603
    5   HD21  ASN  14          HD21      ASN  14  19.150  -7.827  -0.609
    6   HD22  ASN  14          HD22      ASN  14  20.307  -6.755   0.012

  No H/Q in entry =           6
  In of MODEL   83
    1    H    SER  15           H        SER  15  14.543  -7.273   1.787
    2    HA   SER  15           HA       SER  15  14.449  -4.452   1.858
    3    HB2  SER  15           HB2      SER  15  12.109  -4.682   1.387
    4    HB3  SER  15           HB3      SER  15  12.891  -6.046   0.599
    5    HG   SER  15           HG       SER  15  11.277  -5.962   2.873

  No H/Q in entry =           5
  In of MODEL   83
    1    H    GLY  16           H        GLY  16  13.364  -6.916   4.161
    2    HA3  GLY  16           HA2      GLY  16  12.172  -5.170   6.039
    3    HA2  GLY  16           HA3      GLY  16  12.781  -6.783   6.387

  No H/Q in entry =           3
  In of MODEL   83
    1    H    GLN  17           H        GLN  17  15.488  -6.464   5.769
    2    HA   GLN  17           HA       GLN  17  16.476  -5.260   8.146
    3    HB2  GLN  17           HB2      GLN  17  17.668  -7.059   6.901
    4    HB3  GLN  17           HB3      GLN  17  18.002  -5.909   5.606
    5    HG2  GLN  17           HG2      GLN  17  19.941  -6.026   7.072
    6    HG3  GLN  17           HG3      GLN  17  19.175  -4.450   7.261
    7   HE21  GLN  17          HE21      GLN  17  19.696  -4.039   9.465
    8   HE22  GLN  17          HE22      GLN  17  19.184  -5.033  10.741

  No H/Q in entry =           8
  In of MODEL   83
    1    H    ALA  18           H        ALA  18  16.259  -4.165   4.793
    2    HA   ALA  18           HA       ALA  18  17.711  -1.781   5.018
    3    HB2  ALA  18           HB1      ALA  18  16.566  -2.979   2.955
    4    HB3  ALA  18           HB2      ALA  18  16.840  -1.237   2.946
    5    HB1  ALA  18           HB3      ALA  18  15.241  -1.876   3.328

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ARG  19           H        ARG  19  14.212  -2.352   5.446
    2    HA   ARG  19           HA       ARG  19  13.566   0.298   6.181
    3    HB2  ARG  19           HB2      ARG  19  11.870  -1.441   5.602
    4    HB3  ARG  19           HB3      ARG  19  12.222  -2.248   7.132
    5    HG2  ARG  19           HG2      ARG  19  11.535  -0.259   8.388
    6    HG3  ARG  19           HG3      ARG  19  11.275   0.626   6.887
    7    HD2  ARG  19           HD2      ARG  19   9.137  -0.163   7.724
    8    HD3  ARG  19           HD3      ARG  19   9.537  -1.037   6.239
    9    HE   ARG  19           HE       ARG  19  10.507  -2.595   8.327
   10   HH21  ARG  19          HH11      ARG  19   9.259  -4.233   9.270
   11   HH22  ARG  19          HH12      ARG  19   7.537  -4.195   9.117
   12   HH11  ARG  19          HH21      ARG  19   7.510  -1.281   7.268
   13   HH12  ARG  19          HH22      ARG  19   6.547  -2.524   7.979

  No H/Q in entry =          13
  In of MODEL   83
    1    H    SER  20           H        SER  20  14.427  -2.546   8.118
    2    HA   SER  20           HA       SER  20  14.175  -1.458  10.663
    3    HB2  SER  20           HB2      SER  20  14.627  -3.784  10.529
    4    HB3  SER  20           HB3      SER  20  16.068  -3.526   9.548
    5    HG   SER  20           HG       SER  20  15.673  -2.817  12.270

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LEU  21           H        LEU  21  16.998  -1.401   8.499
    2    HA   LEU  21           HA       LEU  21  18.697   0.067  10.228
    3    HB2  LEU  21           HB2      LEU  21  18.646  -0.184   7.213
    4    HB3  LEU  21           HB3      LEU  21  19.917   0.655   8.099
    5    HG   LEU  21           HG       LEU  21  19.152  -2.231   8.625
    6   HD13  LEU  21          HD11      LEU  21  20.967  -2.909   7.220
    7   HD12  LEU  21          HD12      LEU  21  21.537  -1.250   7.040
    8   HD11  LEU  21          HD13      LEU  21  20.028  -1.750   6.277
    9   HD23  LEU  21          HD21      LEU  21  21.651  -2.105   9.482
   10   HD22  LEU  21          HD22      LEU  21  20.363  -1.504  10.521
   11   HD21  LEU  21          HD23      LEU  21  21.336  -0.376   9.591

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ALA  22           H        ALA  22  16.414   1.061   7.700
    2    HA   ALA  22           HA       ALA  22  16.968   3.816   7.722
    3    HB3  ALA  22           HB1      ALA  22  15.542   2.590   6.051
    4    HB2  ALA  22           HB2      ALA  22  14.850   4.104   6.633
    5    HB1  ALA  22           HB3      ALA  22  14.257   2.565   7.258

  No H/Q in entry =           5
  In of MODEL   83
    1    H    TYR  23           H        TYR  23  14.479   2.005   9.572
    2    HA   TYR  23           HA       TYR  23  13.543   4.240  11.042
    3    HB2  TYR  23           HB2      TYR  23  12.296   2.133  11.022
    4    HB3  TYR  23           HB3      TYR  23  13.631   1.312  11.831
    5    HD1  TYR  23           HD1      TYR  23  11.139   4.060  12.229
    6    HD2  TYR  23           HD2      TYR  23  13.856   1.369  14.186
    7    HE1  TYR  23           HE1      TYR  23  10.233   4.748  14.435
    8    HE2  TYR  23           HE2      TYR  23  12.950   2.057  16.390
    9    HH   TYR  23           HH       TYR  23  10.425   4.563  16.637

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ALA  24           H        ALA  24  16.181   1.946  11.642
    2    HA   ALA  24           HA       ALA  24  16.882   2.924  14.204
    3    HB1  ALA  24           HB1      ALA  24  18.226   1.124  14.017
    4    HB3  ALA  24           HB2      ALA  24  19.249   2.045  12.913
    5    HB2  ALA  24           HB3      ALA  24  17.942   1.047  12.279

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ALA  25           H        ALA  25  17.813   3.864  10.921
    2    HA   ALA  25           HA       ALA  25  19.776   5.783  11.557
    3    HB1  ALA  25           HB1      ALA  25  19.032   4.852   9.244
    4    HB3  ALA  25           HB2      ALA  25  19.545   6.536   9.341
    5    HB2  ALA  25           HB3      ALA  25  17.827   6.139   9.286

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LEU  26           H        LEU  26  16.260   6.036  11.231
    2    HA   LEU  26           HA       LEU  26  16.058   8.817  11.698
    3    HB2  LEU  26           HB2      LEU  26  14.179   7.598  10.782
    4    HB3  LEU  26           HB3      LEU  26  14.096   6.564  12.203
    5    HG   LEU  26           HG       LEU  26  13.516   8.518  13.599
    6   HD12  LEU  26          HD11      LEU  26  12.856  10.630  12.291
    7   HD11  LEU  26          HD12      LEU  26  13.820   9.977  10.969
    8   HD13  LEU  26          HD13      LEU  26  14.582  10.349  12.516
    9   HD21  LEU  26          HD21      LEU  26  11.814   8.229  11.104
   10   HD23  LEU  26          HD22      LEU  26  11.273   8.922  12.630
   11   HD22  LEU  26          HD23      LEU  26  11.713   7.218  12.547

  No H/Q in entry =          11
  In of MODEL   83
    1    H    LYS  27           H        LYS  27  15.952   6.027  13.878
    2    HA   LYS  27           HA       LYS  27  15.392   7.385  16.259
    3    HB2  LYS  27           HB2      LYS  27  15.400   4.911  15.981
    4    HB3  LYS  27           HB3      LYS  27  17.164   4.951  15.921
    5    HG2  LYS  27           HG2      LYS  27  17.242   5.925  18.175
    6    HG3  LYS  27           HG3      LYS  27  15.476   5.955  18.238
    7    HD2  LYS  27           HD2      LYS  27  15.431   3.490  17.988
    8    HD3  LYS  27           HD3      LYS  27  17.196   3.467  17.960
    9    HE2  LYS  27           HE2      LYS  27  17.258   4.444  20.221
   10    HE3  LYS  27           HE3      LYS  27  15.493   4.496  20.253
   11    HZ3  LYS  27           HZ1      LYS  27  16.278   2.533  21.386
   12    HZ2  LYS  27           HZ2      LYS  27  17.178   2.054  20.024
   13    HZ1  LYS  27           HZ3      LYS  27  15.479   2.072  19.961

  No H/Q in entry =          13
  In of MODEL   83
    1    H    GLN  28           H        GLN  28  18.489   6.788  14.634
    2    HA   GLN  28           HA       GLN  28  20.200   7.849  16.613
    3    HB2  GLN  28           HB2      GLN  28  20.457   7.817  13.595
    4    HB3  GLN  28           HB3      GLN  28  21.758   8.273  14.695
    5    HG2  GLN  28           HG2      GLN  28  20.320   5.605  14.738
    6    HG3  GLN  28           HG3      GLN  28  21.898   5.885  14.003
    7   HE21  GLN  28          HE21      GLN  28  20.698   4.508  16.676
    8   HE22  GLN  28          HE22      GLN  28  21.878   4.940  17.816

  No H/Q in entry =           8
  In of MODEL   83
    1    H    ALA  29           H        ALA  29  18.433   9.359  13.946
    2    HA   ALA  29           HA       ALA  29  19.455  11.970  14.203
    3    HB2  ALA  29           HB1      ALA  29  17.748  12.628  12.751
    4    HB1  ALA  29           HB2      ALA  29  16.601  11.461  13.407
    5    HB3  ALA  29           HB3      ALA  29  17.917  10.913  12.368

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LYS  30           H        LYS  30  16.681  10.385  15.742
    2    HA   LYS  30           HA       LYS  30  15.698  12.640  17.121
    3    HB2  LYS  30           HB2      LYS  30  15.569   9.696  17.810
    4    HB3  LYS  30           HB3      LYS  30  14.722  10.949  18.719
    5    HG2  LYS  30           HG2      LYS  30  13.583  11.655  16.615
    6    HG3  LYS  30           HG3      LYS  30  14.368  10.317  15.774
    7    HD2  LYS  30           HD2      LYS  30  13.297   8.711  17.304
    8    HD3  LYS  30           HD3      LYS  30  12.522  10.038  18.170
    9    HE2  LYS  30           HE2      LYS  30  11.339  10.692  16.092
   10    HE3  LYS  30           HE3      LYS  30  12.094   9.335  15.247
   11    HZ2  LYS  30           HZ1      LYS  30   9.791   8.941  16.147
   12    HZ1  LYS  30           HZ2      LYS  30  10.474   8.980  17.708
   13    HZ3  LYS  30           HZ3      LYS  30  10.962   7.797  16.586

  No H/Q in entry =          13
  In of MODEL   83
    1    H    GLN  31           H        GLN  31  18.348  10.444  17.821
    2    HA   GLN  31           HA       GLN  31  18.710  11.441  20.517
    3    HB2  GLN  31           HB2      GLN  31  20.703   9.861  18.884
    4    HB3  GLN  31           HB3      GLN  31  20.587   9.977  20.641
    5    HG2  GLN  31           HG2      GLN  31  18.058   9.051  19.891
    6    HG3  GLN  31           HG3      GLN  31  19.142   8.203  18.796
    7   HE21  GLN  31          HE21      GLN  31  17.611   7.058  21.081
    8   HE22  GLN  31          HE22      GLN  31  18.771   6.382  22.117

  No H/Q in entry =           8
  In of MODEL   83
    1    H    GLY  32           H        GLY  32  19.212  12.769  17.552
    2    HA3  GLY  32           HA2      GLY  32  20.209  14.809  17.039
    3    HA2  GLY  32           HA3      GLY  32  20.982  14.798  18.620

  No H/Q in entry =           3
  In of MODEL   83
    1    H    ASP  33           H        ASP  33  21.361  11.912  16.823
    2    HA   ASP  33           HA       ASP  33  24.188  12.565  16.333
    3    HB2  ASP  33           HB2      ASP  33  22.657   9.962  16.451
    4    HB3  ASP  33           HB3      ASP  33  24.340  10.066  15.940

  No H/Q in entry =           4
  In of MODEL   83
    1    H    PHE  34           H        PHE  34  23.699  13.902  14.464
    2    HA   PHE  34           HA       PHE  34  22.320  12.942  12.185
    3    HB2  PHE  34           HB2      PHE  34  24.471  15.057  12.405
    4    HB3  PHE  34           HB3      PHE  34  23.469  14.782  10.981
    5    HD1  PHE  34           HD1      PHE  34  23.765  16.699  13.902
    6    HD2  PHE  34           HD2      PHE  34  20.847  14.620  11.534
    7    HE1  PHE  34           HE1      PHE  34  21.970  18.107  14.875
    8    HE2  PHE  34           HE2      PHE  34  19.055  16.028  12.509
    9    HZ   PHE  34           HZ       PHE  34  19.621  17.772  14.175

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ALA  35           H        ALA  35  25.702  12.721  13.158
    2    HA   ALA  35           HA       ALA  35  26.776  11.904  10.686
    3    HB3  ALA  35           HB1      ALA  35  28.464  10.711  12.383
    4    HB2  ALA  35           HB2      ALA  35  27.620  11.737  13.543
    5    HB1  ALA  35           HB3      ALA  35  28.449  12.461  12.166

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ALA  36           H        ALA  36  25.672   9.942  13.452
    2    HA   ALA  36           HA       ALA  36  26.123   7.457  12.159
    3    HB2  ALA  36           HB1      ALA  36  25.706   6.704  14.235
    4    HB3  ALA  36           HB2      ALA  36  24.021   7.213  14.104
    5    HB1  ALA  36           HB3      ALA  36  25.237   8.331  14.721

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ALA  37           H        ALA  37  23.320   9.605  12.331
    2    HA   ALA  37           HA       ALA  37  21.438   7.856  11.165
    3    HB3  ALA  37           HB1      ALA  37  21.690  10.816  11.470
    4    HB1  ALA  37           HB2      ALA  37  20.374   9.745  11.950
    5    HB2  ALA  37           HB3      ALA  37  20.550  10.224  10.261

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LYS  38           H        LYS  38  23.542  10.309   9.678
    2    HA   LYS  38           HA       LYS  38  22.873   9.901   7.005
    3    HB2  LYS  38           HB2      LYS  38  24.709  11.437   8.440
    4    HB3  LYS  38           HB3      LYS  38  25.724  10.445   7.400
    5    HG2  LYS  38           HG2      LYS  38  24.546  11.235   5.419
    6    HG3  LYS  38           HG3      LYS  38  23.367  12.093   6.416
    7    HD2  LYS  38           HD2      LYS  38  24.982  13.676   7.161
    8    HD3  LYS  38           HD3      LYS  38  26.329  12.682   6.607
    9    HE2  LYS  38           HE2      LYS  38  25.971  14.564   5.069
   10    HE3  LYS  38           HE3      LYS  38  25.617  13.034   4.260
   11    HZ3  LYS  38           HZ1      LYS  38  23.422  13.495   4.154
   12    HZ2  LYS  38           HZ2      LYS  38  23.957  15.106   4.245
   13    HZ1  LYS  38           HZ3      LYS  38  23.391  14.319   5.638

  No H/Q in entry =          13
  In of MODEL   83
    1    H    ALA  39           H        ALA  39  25.395   8.275   8.928
    2    HA   ALA  39           HA       ALA  39  26.432   6.689   6.840
    3    HB2  ALA  39           HB1      ALA  39  26.365   5.712   9.679
    4    HB1  ALA  39           HB2      ALA  39  27.323   7.133   9.261
    5    HB3  ALA  39           HB3      ALA  39  27.656   5.584   8.486

  No H/Q in entry =           5
  In of MODEL   83
    1    H    MET  40           H        MET  40  23.838   6.080   9.160
    2    HA   MET  40           HA       MET  40  23.369   3.382   8.416
    3    HB2  MET  40           HB2      MET  40  21.579   5.431   9.737
    4    HB3  MET  40           HB3      MET  40  21.159   3.725   9.557
    5    HG2  MET  40           HG2      MET  40  23.728   4.642  10.878
    6    HG3  MET  40           HG3      MET  40  22.241   4.372  11.784
    7    HE3  MET  40           HE1      MET  40  21.654   0.741  11.946
    8    HE2  MET  40           HE2      MET  40  20.787   2.054  11.154
    9    HE1  MET  40           HE3      MET  40  21.545   2.328  12.721

  No H/Q in entry =           9
  In of MODEL   83
    1    H    MET  41           H        MET  41  21.964   6.450   7.259
    2    HA   MET  41           HA       MET  41  19.983   5.277   5.600
    3    HB2  MET  41           HB2      MET  41  21.476   7.860   5.086
    4    HB3  MET  41           HB3      MET  41  19.937   7.381   4.380
    5    HG2  MET  41           HG2      MET  41  19.215   7.183   6.937
    6    HG3  MET  41           HG3      MET  41  20.534   8.331   7.152
    7    HE2  MET  41           HE1      MET  41  19.947   9.641   3.828
    8    HE1  MET  41           HE2      MET  41  20.920  10.066   5.233
    9    HE3  MET  41           HE3      MET  41  19.649  11.157   4.687

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ASP  42           H        ASP  42  23.355   6.181   5.018
    2    HA   ASP  42           HA       ASP  42  23.417   5.721   2.258
    3    HB2  ASP  42           HB2      ASP  42  25.192   6.698   4.015
    4    HB3  ASP  42           HB3      ASP  42  25.838   5.069   3.872

  No H/Q in entry =           4
  In of MODEL   83
    1    H    GLN  43           H        GLN  43  24.154   3.548   4.959
    2    HA   GLN  43           HA       GLN  43  24.789   1.294   3.358
    3    HB2  GLN  43           HB2      GLN  43  23.795   1.469   6.213
    4    HB3  GLN  43           HB3      GLN  43  24.357  -0.019   5.444
    5    HG2  GLN  43           HG2      GLN  43  26.523   1.180   4.918
    6    HG3  GLN  43           HG3      GLN  43  25.958   2.506   5.931
    7   HE21  GLN  43          HE21      GLN  43  28.196   1.513   6.940
    8   HE22  GLN  43          HE22      GLN  43  27.927   0.425   8.213

  No H/Q in entry =           8
  In of MODEL   83
    1    H    SER  44           H        SER  44  21.754   2.440   4.780
    2    HA   SER  44           HA       SER  44  20.164   0.210   4.111
    3    HB2  SER  44           HB2      SER  44  19.750   2.736   5.274
    4    HB3  SER  44           HB3      SER  44  18.701   2.707   3.859
    5    HG   SER  44           HG       SER  44  17.619   1.761   5.588

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ARG  45           H        ARG  45  20.908   3.180   2.314
    2    HA   ARG  45           HA       ARG  45  19.357   2.716   0.022
    3    HB2  ARG  45           HB2      ARG  45  20.520   4.842   0.606
    4    HB3  ARG  45           HB3      ARG  45  22.056   4.079   0.201
    5    HG2  ARG  45           HG2      ARG  45  21.247   3.691  -2.107
    6    HG3  ARG  45           HG3      ARG  45  19.724   4.476  -1.701
    7    HD2  ARG  45           HD2      ARG  45  20.993   6.562  -1.118
    8    HD3  ARG  45           HD3      ARG  45  22.479   5.781  -1.706
    9    HE   ARG  45           HE       ARG  45  20.527   5.567  -3.724
   10   HH21  ARG  45          HH11      ARG  45  20.511   6.946  -5.480
   11   HH22  ARG  45          HH12      ARG  45  21.280   8.490  -5.375
   12   HH11  ARG  45          HH21      ARG  45  22.290   8.045  -2.101
   13   HH12  ARG  45          HH22      ARG  45  22.286   9.112  -3.459

  No H/Q in entry =          13
  In of MODEL   83
    1    H    MET  46           H        MET  46  22.722   1.815   0.731
    2    HA   MET  46           HA       MET  46  23.295   0.631  -1.765
    3    HB2  MET  46           HB2      MET  46  24.428   0.287   1.011
    4    HB3  MET  46           HB3      MET  46  25.062  -0.610  -0.372
    5    HG2  MET  46           HG2      MET  46  25.482   1.512  -1.562
    6    HG3  MET  46           HG3      MET  46  24.845   2.411  -0.191
    7    HE2  MET  46           HE1      MET  46  27.174   3.834   0.638
    8    HE1  MET  46           HE2      MET  46  27.110   3.424  -1.073
    9    HE3  MET  46           HE3      MET  46  28.605   3.183  -0.172

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ALA  47           H        ALA  47  21.933  -0.708   1.218
    2    HA   ALA  47           HA       ALA  47  21.851  -3.416   0.402
    3    HB2  ALA  47           HB1      ALA  47  21.500  -2.965   2.712
    4    HB3  ALA  47           HB2      ALA  47  19.953  -3.553   2.107
    5    HB1  ALA  47           HB3      ALA  47  20.198  -1.825   2.371

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LEU  48           H        LEU  48  19.515  -0.770   0.083
    2    HA   LEU  48           HA       LEU  48  17.445  -2.282  -1.154
    3    HB2  LEU  48           HB2      LEU  48  18.121   0.668  -1.261
    4    HB3  LEU  48           HB3      LEU  48  16.637  -0.028  -1.915
    5    HG   LEU  48           HG       LEU  48  17.519  -0.351   0.963
    6   HD13  LEU  48          HD11      LEU  48  17.117   1.954   0.792
    7   HD12  LEU  48          HD12      LEU  48  15.559   1.316   1.315
    8   HD11  LEU  48          HD13      LEU  48  15.816   1.744  -0.377
    9   HD22  LEU  48          HD21      LEU  48  15.973  -2.051   0.590
   10   HD21  LEU  48          HD22      LEU  48  15.093  -1.136  -0.634
   11   HD23  LEU  48          HD23      LEU  48  14.902  -0.738   1.073

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ASN  49           H        ASN  49  20.135  -0.368  -2.404
    2    HA   ASN  49           HA       ASN  49  19.454  -0.433  -5.121
    3    HB2  ASN  49           HB2      ASN  49  21.156   1.064  -4.205
    4    HB3  ASN  49           HB3      ASN  49  22.180  -0.308  -3.798
    5   HD21  ASN  49          HD21      ASN  49  23.175   1.702  -5.479
    6   HD22  ASN  49          HD22      ASN  49  23.329   1.097  -7.056

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLU  50           H        GLU  50  21.442  -2.653  -3.191
    2    HA   GLU  50           HA       GLU  50  22.106  -4.404  -5.333
    3    HB2  GLU  50           HB2      GLU  50  23.328  -4.399  -3.180
    4    HB3  GLU  50           HB3      GLU  50  21.889  -5.019  -2.371
    5    HG2  GLU  50           HG2      GLU  50  21.947  -7.046  -3.740
    6    HG3  GLU  50           HG3      GLU  50  23.318  -6.420  -4.653

  No H/Q in entry =           6
  In of MODEL   83
    1    H    ALA  51           H        ALA  51  19.476  -4.328  -2.977
    2    HA   ALA  51           HA       ALA  51  18.282  -6.788  -3.733
    3    HB3  ALA  51           HB1      ALA  51  16.711  -6.277  -2.158
    4    HB1  ALA  51           HB2      ALA  51  16.504  -4.627  -2.746
    5    HB2  ALA  51           HB3      ALA  51  17.872  -5.029  -1.707

  No H/Q in entry =           5
  In of MODEL   83
    1    H    HIS  52           H        HIS  52  17.711  -3.431  -4.746
    2    HA   HIS  52           HA       HIS  52  15.574  -3.932  -6.524
    3    HB2  HIS  52           HB2      HIS  52  16.270  -1.677  -5.711
    4    HB3  HIS  52           HB3      HIS  52  17.691  -1.780  -6.750
    5    HD1  HIS  52           HD1      HIS  52  16.865  -2.569  -9.387
    6    HD2  HIS  52           HD2      HIS  52  14.263  -0.329  -7.024
    7    HE1  HIS  52           HE1      HIS  52  15.207  -1.493 -10.969
    8    HE2  HIS  52           HE2      HIS  52  13.614  -0.123  -9.544

  No H/Q in entry =           8
  In of MODEL   83
    1    H    LEU  53           H        LEU  53  19.087  -3.964  -6.996
    2    HA   LEU  53           HA       LEU  53  19.110  -4.267  -9.798
    3    HB2  LEU  53           HB2      LEU  53  21.061  -5.049  -7.647
    4    HB3  LEU  53           HB3      LEU  53  21.356  -5.439  -9.340
    5    HG   LEU  53           HG       LEU  53  20.713  -2.622  -8.415
    6   HD13  LEU  53          HD11      LEU  53  22.760  -3.379  -7.282
    7   HD12  LEU  53          HD12      LEU  53  23.148  -2.200  -8.533
    8   HD11  LEU  53          HD13      LEU  53  23.425  -3.913  -8.823
    9   HD23  LEU  53          HD21      LEU  53  22.135  -2.201 -10.578
   10   HD22  LEU  53          HD22      LEU  53  20.453  -2.688 -10.752
   11   HD21  LEU  53          HD23      LEU  53  21.732  -3.865 -10.977

  No H/Q in entry =          11
  In of MODEL   83
    1    H    VAL  54           H        VAL  54  19.009  -6.665  -7.182
    2    HA   VAL  54           HA       VAL  54  19.096  -8.952  -8.853
    3    HB   VAL  54           HB       VAL  54  17.976  -8.533  -6.071
    4   HG12  VAL  54          HG11      VAL  54  18.281 -11.153  -6.082
    5   HG11  VAL  54          HG12      VAL  54  18.077 -10.975  -7.825
    6   HG13  VAL  54          HG13      VAL  54  16.805 -10.439  -6.729
    7   HG22  VAL  54          HG21      VAL  54  20.296  -8.340  -5.873
    8   HG21  VAL  54          HG22      VAL  54  20.610  -9.428  -7.223
    9   HG23  VAL  54          HG23      VAL  54  20.092 -10.079  -5.668

  No H/Q in entry =           9
  In of MODEL   83
    1    H    GLN  55           H        GLN  55  16.397  -7.035  -7.532
    2    HA   GLN  55           HA       GLN  55  14.351  -8.680  -8.590
    3    HB2  GLN  55           HB2      GLN  55  13.633  -7.156  -6.948
    4    HB3  GLN  55           HB3      GLN  55  14.427  -5.790  -7.727
    5    HG2  GLN  55           HG2      GLN  55  12.688  -5.446  -9.196
    6    HG3  GLN  55           HG3      GLN  55  12.352  -7.164  -9.370
    7   HE21  GLN  55          HE21      GLN  55  10.350  -7.702  -8.545
    8   HE22  GLN  55          HE22      GLN  55   9.597  -6.948  -7.224

  No H/Q in entry =           8
  In of MODEL   83
    1    H    THR  56           H        THR  56  16.095  -5.886  -9.957
    2    HA   THR  56           HA       THR  56  14.634  -5.504 -12.287
    3    HB   THR  56           HB       THR  56  17.655  -5.437 -12.154
    4    HG1  THR  56           HG1      THR  56  15.929  -4.145 -10.658
    5   HG23  THR  56          HG21      THR  56  16.836  -5.113 -14.390
    6   HG22  THR  56          HG22      THR  56  17.257  -3.521 -13.761
    7   HG21  THR  56          HG23      THR  56  15.567  -4.023 -13.826

  No H/Q in entry =           7
  In of MODEL   83
    1    H    LYS  57           H        LYS  57  17.274  -7.822 -11.715
    2    HA   LYS  57           HA       LYS  57  17.238  -9.005 -14.299
    3    HB2  LYS  57           HB2      LYS  57  19.048  -9.280 -12.580
    4    HB3  LYS  57           HB3      LYS  57  17.947 -10.264 -11.628
    5    HG2  LYS  57           HG2      LYS  57  17.801 -11.904 -13.442
    6    HG3  LYS  57           HG3      LYS  57  18.851 -10.914 -14.449
    7    HD2  LYS  57           HD2      LYS  57  20.675 -11.169 -12.799
    8    HD3  LYS  57           HD3      LYS  57  19.631 -12.181 -11.801
    9    HE2  LYS  57           HE2      LYS  57  19.437 -13.814 -13.652
   10    HE3  LYS  57           HE3      LYS  57  20.486 -12.815 -14.655
   11    HZ1  LYS  57           HZ1      LYS  57  22.115 -13.021 -12.710
   12    HZ3  LYS  57           HZ2      LYS  57  21.917 -14.356 -13.741
   13    HZ2  LYS  57           HZ3      LYS  57  21.158 -14.334 -12.221

  No H/Q in entry =          13
  In of MODEL   83
    1    H    LEU  58           H        LEU  58  15.486  -9.673 -11.306
    2    HA   LEU  58           HA       LEU  58  14.238 -12.035 -12.236
    3    HB2  LEU  58           HB2      LEU  58  13.481 -10.134 -10.024
    4    HB3  LEU  58           HB3      LEU  58  12.661 -11.665 -10.337
    5    HG   LEU  58           HG       LEU  58  15.642 -11.408  -9.816
    6   HD11  LEU  58          HD11      LEU  58  13.288 -11.818  -7.998
    7   HD13  LEU  58          HD12      LEU  58  14.751 -10.865  -7.748
    8   HD12  LEU  58          HD13      LEU  58  14.814 -12.622  -7.621
    9   HD22  LEU  58          HD21      LEU  58  15.499 -13.465 -10.850
   10   HD21  LEU  58          HD22      LEU  58  13.788 -13.665 -10.471
   11   HD23  LEU  58          HD23      LEU  58  15.009 -13.979  -9.237

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  59           H        ILE  59  13.581  -8.691 -12.898
    2    HA   ILE  59           HA       ILE  59  10.851  -9.318 -13.809
    3    HB   ILE  59           HB       ILE  59  11.691  -7.045 -12.605
    4   HG12  ILE  59          HG12      ILE  59   9.744  -6.902 -14.919
    5   HG13  ILE  59          HG13      ILE  59   9.348  -7.680 -13.409
    6   HG23  ILE  59          HG21      ILE  59  12.231  -5.316 -14.128
    7   HG22  ILE  59          HG22      ILE  59  11.731  -6.250 -15.519
    8   HG21  ILE  59          HG23      ILE  59  13.221  -6.651 -14.669
    9   HD13  ILE  59          HD11      ILE  59   8.555  -5.412 -13.268
   10   HD12  ILE  59          HD12      ILE  59  10.117  -4.791 -13.801
   11   HD11  ILE  59          HD13      ILE  59   9.964  -5.548 -12.215

  No H/Q in entry =          11
  In of MODEL   83
    1    H    GLU  60           H        GLU  60  14.046  -8.482 -15.101
    2    HA   GLU  60           HA       GLU  60  13.238  -8.065 -17.798
    3    HB2  GLU  60           HB2      GLU  60  15.489  -7.913 -18.266
    4    HB3  GLU  60           HB3      GLU  60  15.542  -7.662 -16.523
    5    HG2  GLU  60           HG2      GLU  60  15.872 -10.169 -16.279
    6    HG3  GLU  60           HG3      GLU  60  16.090 -10.233 -18.026

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLY  61           H        GLY  61  14.217 -10.960 -16.006
    2    HA3  GLY  61           HA2      GLY  61  13.638 -12.594 -18.408
    3    HA2  GLY  61           HA3      GLY  61  14.682 -13.088 -17.079

  No H/Q in entry =           3
  In of MODEL   83
    1    H    ASP  62           H        ASP  62  11.577 -11.523 -16.665
    2    HA   ASP  62           HA       ASP  62  10.649 -13.477 -14.843
    3    HB2  ASP  62           HB2      ASP  62   8.531 -12.221 -14.949
    4    HB3  ASP  62           HB3      ASP  62   9.919 -11.159 -14.733

  No H/Q in entry =           4
  In of MODEL   83
    1    H    ALA  63           H        ALA  63  10.046 -13.027 -18.328
    2    HA   ALA  63           HA       ALA  63   8.037 -15.153 -18.388
    3    HB3  ALA  63           HB1      ALA  63   9.365 -13.590 -20.619
    4    HB2  ALA  63           HB2      ALA  63   7.799 -13.231 -19.893
    5    HB1  ALA  63           HB3      ALA  63   8.020 -14.712 -20.824

  No H/Q in entry =           5
  In of MODEL   83
    1    H    GLY  64           H        GLY  64   8.385 -16.820 -20.211
    2    HA3  GLY  64           HA2      GLY  64  10.308 -17.987 -21.410
    3    HA2  GLY  64           HA3      GLY  64  11.045 -18.034 -19.816

  No H/Q in entry =           3
  In of MODEL   83
    1    H    GLU  65           H        GLU  65   8.343 -18.505 -18.562
    2    HA   GLU  65           HA       GLU  65   8.490 -21.335 -18.543
    3    HB2  GLU  65           HB2      GLU  65   6.419 -19.437 -17.450
    4    HB3  GLU  65           HB3      GLU  65   6.387 -21.180 -17.181
    5    HG2  GLU  65           HG2      GLU  65   8.598 -21.089 -16.138
    6    HG3  GLU  65           HG3      GLU  65   8.702 -19.360 -16.459

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLY  66           H        GLY  66   6.345 -19.088 -20.109
    2    HA3  GLY  66           HA2      GLY  66   5.621 -20.875 -22.186
    3    HA2  GLY  66           HA3      GLY  66   4.307 -20.710 -21.039

  No H/Q in entry =           3
  In of MODEL   83
    1    H    LYS  67           H        LYS  67   3.033 -18.955 -21.101
    2    HA   LYS  67           HA       LYS  67   3.308 -17.207 -23.401
    3    HB2  LYS  67           HB2      LYS  67   0.985 -16.619 -22.962
    4    HB3  LYS  67           HB3      LYS  67   1.192 -18.375 -22.944
    5    HG2  LYS  67           HG2      LYS  67   1.415 -18.295 -20.465
    6    HG3  LYS  67           HG3      LYS  67   1.111 -16.561 -20.513
    7    HD2  LYS  67           HD2      LYS  67  -1.107 -16.968 -21.503
    8    HD3  LYS  67           HD3      LYS  67  -0.804 -18.707 -21.472
    9    HE2  LYS  67           HE2      LYS  67  -0.566 -18.628 -19.019
   10    HE3  LYS  67           HE3      LYS  67  -0.861 -16.890 -19.043
   11    HZ2  LYS  67           HZ1      LYS  67  -2.745 -18.909 -18.912
   12    HZ1  LYS  67           HZ2      LYS  67  -2.890 -18.244 -20.467
   13    HZ3  LYS  67           HZ3      LYS  67  -3.029 -17.247 -19.098

  No H/Q in entry =          13
  In of MODEL   83
    1    H    MET  68           H        MET  68   1.599 -15.182 -22.306
    2    HA   MET  68           HA       MET  68   3.475 -13.228 -21.592
    3    HB2  MET  68           HB2      MET  68   0.468 -13.298 -21.374
    4    HB3  MET  68           HB3      MET  68   1.436 -11.855 -21.074
    5    HG2  MET  68           HG2      MET  68   2.383 -12.016 -23.349
    6    HG3  MET  68           HG3      MET  68   1.403 -13.450 -23.652
    7    HE2  MET  68           HE1      MET  68  -0.068 -12.562 -25.717
    8    HE1  MET  68           HE2      MET  68   1.327 -11.489 -25.624
    9    HE3  MET  68           HE3      MET  68  -0.281 -10.812 -25.869

  No H/Q in entry =           9
  In of MODEL   83
    1    H    LYS  69           H        LYS  69   2.245 -15.630 -19.554
    2    HA   LYS  69           HA       LYS  69   1.900 -14.128 -17.168
    3    HB2  LYS  69           HB2      LYS  69   0.847 -16.308 -17.511
    4    HB3  LYS  69           HB3      LYS  69   2.433 -17.083 -17.490
    5    HG2  LYS  69           HG2      LYS  69   2.819 -16.448 -15.213
    6    HG3  LYS  69           HG3      LYS  69   1.428 -15.363 -15.215
    7    HD2  LYS  69           HD2      LYS  69   1.159 -17.693 -14.100
    8    HD3  LYS  69           HD3      LYS  69  -0.114 -17.145 -15.192
    9    HE2  LYS  69           HE2      LYS  69   0.725 -18.486 -16.991
   10    HE3  LYS  69           HE3      LYS  69   2.219 -18.831 -16.121
   11    HZ3  LYS  69           HZ1      LYS  69   1.261 -20.548 -15.138
   12    HZ2  LYS  69           HZ2      LYS  69  -0.124 -20.302 -16.089
   13    HZ1  LYS  69           HZ3      LYS  69  -0.006 -19.584 -14.554

  No H/Q in entry =          13
  In of MODEL   83
    1    H    VAL  70           H        VAL  70   3.127 -13.999 -15.246
    2    HA   VAL  70           HA       VAL  70   6.034 -14.510 -15.551
    3    HB   VAL  70           HB       VAL  70   6.388 -12.442 -14.208
    4   HG13  VAL  70          HG11      VAL  70   5.898 -10.874 -16.037
    5   HG12  VAL  70          HG12      VAL  70   4.759 -12.027 -16.734
    6   HG11  VAL  70          HG13      VAL  70   6.480 -12.404 -16.691
    7   HG21  VAL  70          HG21      VAL  70   3.369 -12.313 -14.452
    8   HG23  VAL  70          HG22      VAL  70   4.333 -10.860 -14.188
    9   HG22  VAL  70          HG23      VAL  70   4.353 -12.158 -12.996

  No H/Q in entry =           9
  In of MODEL   83
    1    H    SER  71           H        SER  71   7.146 -14.520 -13.382
    2    HA   SER  71           HA       SER  71   6.076 -16.503 -11.680
    3    HB2  SER  71           HB2      SER  71   8.501 -15.996 -11.878
    4    HB3  SER  71           HB3      SER  71   8.228 -14.463 -11.054
    5    HG   SER  71           HG       SER  71   7.755 -17.084 -10.063

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LEU  72           H        LEU  72   4.737 -16.382  -9.987
    2    HA   LEU  72           HA       LEU  72   3.207 -14.061  -9.516
    3    HB2  LEU  72           HB2      LEU  72   3.495 -16.626  -7.959
    4    HB3  LEU  72           HB3      LEU  72   2.338 -15.364  -7.543
    5    HG   LEU  72           HG       LEU  72   2.464 -16.659 -10.286
    6   HD13  LEU  72          HD11      LEU  72   0.557 -18.018  -9.580
    7   HD12  LEU  72          HD12      LEU  72   0.594 -17.279  -7.981
    8   HD11  LEU  72          HD13      LEU  72   1.923 -18.313  -8.502
    9   HD23  LEU  72          HD21      LEU  72  -0.011 -15.810 -10.174
   10   HD22  LEU  72          HD22      LEU  72   1.249 -14.637 -10.515
   11   HD21  LEU  72          HD23      LEU  72   0.577 -14.757  -8.893

  No H/Q in entry =          11
  In of MODEL   83
    1    H    VAL  73           H        VAL  73   5.873 -15.523  -7.778
    2    HA   VAL  73           HA       VAL  73   5.847 -14.001  -5.438
    3    HB   VAL  73           HB       VAL  73   8.030 -14.825  -5.039
    4   HG11  VAL  73          HG11      VAL  73   6.181 -16.520  -5.189
    5   HG13  VAL  73          HG12      VAL  73   7.780 -17.188  -5.515
    6   HG12  VAL  73          HG13      VAL  73   6.679 -16.843  -6.848
    7   HG22  VAL  73          HG21      VAL  73   9.355 -14.269  -6.866
    8   HG21  VAL  73          HG22      VAL  73   8.176 -14.864  -8.033
    9   HG23  VAL  73          HG23      VAL  73   9.165 -16.005  -7.120

  No H/Q in entry =           9
  In of MODEL   83
    1    H    LEU  74           H        LEU  74   6.810 -13.098  -8.620
    2    HA   LEU  74           HA       LEU  74   8.773 -11.164  -8.138
    3    HB2  LEU  74           HB2      LEU  74   8.284 -11.903 -10.375
    4    HB3  LEU  74           HB3      LEU  74   6.627 -11.317 -10.255
    5    HG   LEU  74           HG       LEU  74   7.463  -9.001 -10.038
    6   HD13  LEU  74          HD11      LEU  74   9.586  -9.213  -9.009
    7   HD12  LEU  74          HD12      LEU  74   9.963  -8.740 -10.665
    8   HD11  LEU  74          HD13      LEU  74  10.123 -10.426 -10.171
    9   HD23  LEU  74          HD21      LEU  74   8.903 -10.091 -12.396
   10   HD22  LEU  74          HD22      LEU  74   7.760  -8.774 -12.277
   11   HD21  LEU  74          HD23      LEU  74   7.177 -10.424 -12.262

  No H/Q in entry =          11
  In of MODEL   83
    1    H    VAL  75           H        VAL  75   5.276 -10.755  -8.454
    2    HA   VAL  75           HA       VAL  75   5.204  -8.001  -7.853
    3    HB   VAL  75           HB       VAL  75   3.102 -10.130  -7.447
    4   HG12  VAL  75          HG11      VAL  75   1.540  -8.151  -7.349
    5   HG11  VAL  75          HG12      VAL  75   2.946  -7.098  -7.298
    6   HG13  VAL  75          HG13      VAL  75   2.643  -8.218  -5.979
    7   HG22  VAL  75          HG21      VAL  75   2.197  -9.162  -9.532
    8   HG21  VAL  75          HG22      VAL  75   3.841  -9.743  -9.783
    9   HG23  VAL  75          HG23      VAL  75   3.534  -8.016  -9.590

  No H/Q in entry =           9
  In of MODEL   83
    1    H    GLU  76           H        GLU  76   4.952 -10.887  -5.755
    2    HA   GLU  76           HA       GLU  76   4.515  -9.534  -3.322
    3    HB2  GLU  76           HB2      GLU  76   4.315 -11.993  -3.550
    4    HB3  GLU  76           HB3      GLU  76   6.043 -12.112  -3.836
    5    HG2  GLU  76           HG2      GLU  76   5.654 -12.699  -1.530
    6    HG3  GLU  76           HG3      GLU  76   6.423 -11.122  -1.533

  No H/Q in entry =           6
  In of MODEL   83
    1    H    ALA  77           H        ALA  77   7.553 -10.454  -4.920
    2    HA   ALA  77           HA       ALA  77   9.269  -9.432  -2.916
    3    HB3  ALA  77           HB1      ALA  77   9.757  -9.754  -5.886
    4    HB1  ALA  77           HB2      ALA  77  10.067 -10.967  -4.644
    5    HB2  ALA  77           HB3      ALA  77  11.006  -9.474  -4.674

  No H/Q in entry =           5
  In of MODEL   83
    1    H    GLN  78           H        GLN  78   7.859  -7.991  -5.809
    2    HA   GLN  78           HA       GLN  78   9.230  -5.522  -5.706
    3    HB2  GLN  78           HB2      GLN  78   7.911  -6.414  -7.657
    4    HB3  GLN  78           HB3      GLN  78   6.437  -6.038  -6.765
    5    HG2  GLN  78           HG2      GLN  78   7.104  -3.670  -6.660
    6    HG3  GLN  78           HG3      GLN  78   8.577  -4.040  -7.554
    7   HE21  GLN  78          HE21      GLN  78   6.643  -2.202  -8.603
    8   HE22  GLN  78          HE22      GLN  78   5.935  -2.902  -9.978

  No H/Q in entry =           8
  In of MODEL   83
    1    H    LEU  79           H        LEU  79   6.216  -6.645  -4.253
    2    HA   LEU  79           HA       LEU  79   5.249  -4.235  -3.223
    3    HB2  LEU  79           HB2      LEU  79   3.920  -6.278  -3.165
    4    HB3  LEU  79           HB3      LEU  79   5.070  -7.030  -2.064
    5    HG   LEU  79           HG       LEU  79   4.546  -5.393  -0.324
    6   HD13  LEU  79          HD11      LEU  79   4.085  -3.370  -1.361
    7   HD12  LEU  79          HD12      LEU  79   2.460  -3.886  -0.909
    8   HD11  LEU  79          HD13      LEU  79   3.024  -4.104  -2.564
    9   HD23  LEU  79          HD21      LEU  79   1.957  -5.867  -0.213
   10   HD22  LEU  79          HD22      LEU  79   3.087  -7.215  -0.121
   11   HD21  LEU  79          HD23      LEU  79   2.262  -6.864  -1.637

  No H/Q in entry =          11
  In of MODEL   83
    1    H    HIS  80           H        HIS  80   7.429  -6.594  -1.671
    2    HA   HIS  80           HA       HIS  80   7.749  -5.065   0.702
    3    HB2  HIS  80           HB2      HIS  80   9.059  -7.433  -0.520
    4    HB3  HIS  80           HB3      HIS  80   9.987  -6.549   0.693
    5    HD1  HIS  80           HD1      HIS  80   9.513  -7.193   3.037
    6    HD2  HIS  80           HD2      HIS  80   6.267  -8.007   0.550
    7    HE1  HIS  80           HE1      HIS  80   7.745  -8.290   4.496
    8    HE2  HIS  80           HE2      HIS  80   5.761  -8.790   2.988

  No H/Q in entry =           8
  In of MODEL   83
    1    H    LEU  81           H        LEU  81   9.727  -5.343  -2.229
    2    HA   LEU  81           HA       LEU  81  11.792  -3.622  -1.360
    3    HB2  LEU  81           HB2      LEU  81  10.841  -4.394  -4.119
    4    HB3  LEU  81           HB3      LEU  81  12.271  -3.400  -3.837
    5    HG   LEU  81           HG       LEU  81  11.868  -6.125  -2.572
    6   HD12  LEU  81          HD11      LEU  81  13.664  -6.757  -4.341
    7   HD11  LEU  81          HD12      LEU  81  13.102  -5.324  -5.201
    8   HD13  LEU  81          HD13      LEU  81  11.983  -6.641  -4.859
    9   HD23  LEU  81          HD21      LEU  81  14.499  -5.830  -2.580
   10   HD22  LEU  81          HD22      LEU  81  13.534  -5.068  -1.317
   11   HD21  LEU  81          HD23      LEU  81  14.108  -4.114  -2.685

  No H/Q in entry =          11
  In of MODEL   83
    1    H    MET  82           H        MET  82   8.858  -2.953  -3.269
    2    HA   MET  82           HA       MET  82   9.416  -0.229  -3.761
    3    HB2  MET  82           HB2      MET  82   6.844  -1.802  -3.622
    4    HB3  MET  82           HB3      MET  82   6.855  -0.076  -3.978
    5    HG2  MET  82           HG2      MET  82   8.425  -2.156  -5.537
    6    HG3  MET  82           HG3      MET  82   6.859  -1.518  -6.033
    7    HE3  MET  82           HE1      MET  82   7.326   1.939  -7.192
    8    HE2  MET  82           HE2      MET  82   6.964   1.708  -5.483
    9    HE1  MET  82           HE3      MET  82   6.279   0.609  -6.677

  No H/Q in entry =           9
  In of MODEL   83
    1    H    THR  83           H        THR  83   7.633  -1.825  -1.149
    2    HA   THR  83           HA       THR  83   6.813   0.524   0.196
    3    HB   THR  83           HB       THR  83   6.683  -1.059   2.208
    4    HG1  THR  83           HG1      THR  83   7.421  -3.014   1.962
    5   HG22  THR  83          HG21      THR  83   5.004  -2.603   0.747
    6   HG21  THR  83          HG22      THR  83   5.232  -1.271  -0.381
    7   HG23  THR  83          HG23      THR  83   4.608  -0.959   1.239

  No H/Q in entry =           7
  In of MODEL   83
    1    H    SER  84           H        SER  84   9.623  -1.600   0.683
    2    HA   SER  84           HA       SER  84  10.714  -0.189   2.869
    3    HB2  SER  84           HB2      SER  84  11.934  -2.033   0.824
    4    HB3  SER  84           HB3      SER  84  12.898  -1.294   2.101
    5    HG   SER  84           HG       SER  84  10.610  -2.965   2.372

  No H/Q in entry =           5
  In of MODEL   83
    1    H    MET  85           H        MET  85  11.439   0.082  -0.624
    2    HA   MET  85           HA       MET  85  13.457   2.028  -0.381
    3    HB2  MET  85           HB2      MET  85  13.030   0.759  -2.449
    4    HB3  MET  85           HB3      MET  85  11.511   1.628  -2.662
    5    HG2  MET  85           HG2      MET  85  12.729   3.762  -2.787
    6    HG3  MET  85           HG3      MET  85  14.252   2.916  -2.537
    7    HE2  MET  85           HE1      MET  85  15.413   1.838  -5.800
    8    HE1  MET  85           HE2      MET  85  15.436   1.462  -4.079
    9    HE3  MET  85           HE3      MET  85  15.687   3.120  -4.610

  No H/Q in entry =           9
  In of MODEL   83
    1    H    LEU  86           H        LEU  86   9.966   2.396  -0.859
    2    HA   LEU  86           HA       LEU  86   9.926   5.211  -1.027
    3    HB2  LEU  86           HB2      LEU  86   8.062   3.570  -1.595
    4    HB3  LEU  86           HB3      LEU  86   7.746   3.475   0.138
    5    HG   LEU  86           HG       LEU  86   7.608   6.038   0.099
    6   HD11  LEU  86          HD11      LEU  86   8.357   5.608  -2.612
    7   HD13  LEU  86          HD12      LEU  86   7.942   7.136  -1.840
    8   HD12  LEU  86          HD13      LEU  86   6.690   6.188  -2.639
    9   HD23  LEU  86          HD21      LEU  86   5.448   4.713  -1.552
   10   HD22  LEU  86          HD22      LEU  86   5.280   5.968  -0.328
   11   HD21  LEU  86          HD23      LEU  86   5.668   4.318   0.154

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ALA  87           H        ALA  87   9.464   3.023   1.713
    2    HA   ALA  87           HA       ALA  87   8.950   4.933   3.696
    3    HB1  ALA  87           HB1      ALA  87   9.730   2.106   3.590
    4    HB3  ALA  87           HB2      ALA  87   8.622   2.923   4.689
    5    HB2  ALA  87           HB3      ALA  87  10.354   2.937   5.018

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ARG  88           H        ARG  88  12.011   3.484   2.682
    2    HA   ARG  88           HA       ARG  88  13.649   4.838   4.507
    3    HB2  ARG  88           HB2      ARG  88  14.287   2.866   3.088
    4    HB3  ARG  88           HB3      ARG  88  14.438   3.964   1.719
    5    HG2  ARG  88           HG2      ARG  88  15.940   5.254   3.659
    6    HG3  ARG  88           HG3      ARG  88  16.248   3.560   4.027
    7    HD2  ARG  88           HD2      ARG  88  17.496   3.261   2.168
    8    HD3  ARG  88           HD3      ARG  88  16.359   4.148   1.149
    9    HE   ARG  88           HE       ARG  88  18.772   5.184   2.180
   10   HH21  ARG  88          HH11      ARG  88  19.137   7.400   1.993
   11   HH22  ARG  88          HH12      ARG  88  17.795   8.485   1.866
   12   HH11  ARG  88          HH21      ARG  88  15.438   5.970   1.935
   13   HH12  ARG  88          HH22      ARG  88  15.699   7.673   1.809

  No H/Q in entry =          13
  In of MODEL   83
    1    H    GLU  89           H        GLU  89  12.656   5.761   1.196
    2    HA   GLU  89           HA       GLU  89  14.223   8.108   1.037
    3    HB2  GLU  89           HB2      GLU  89  13.052   7.087  -0.905
    4    HB3  GLU  89           HB3      GLU  89  11.518   7.639  -0.231
    5    HG2  GLU  89           HG2      GLU  89  12.241   9.971  -0.389
    6    HG3  GLU  89           HG3      GLU  89  13.835   9.468  -0.942

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LEU  90           H        LEU  90  10.899   7.624   2.194
    2    HA   LEU  90           HA       LEU  90  10.415  10.359   2.787
    3    HB2  LEU  90           HB2      LEU  90   9.205   7.792   3.813
    4    HB3  LEU  90           HB3      LEU  90   8.593   9.391   4.249
    5    HG   LEU  90           HG       LEU  90   8.978   8.521   1.372
    6   HD12  LEU  90          HD11      LEU  90   6.442   8.216   1.455
    7   HD11  LEU  90          HD12      LEU  90   6.612   8.196   3.211
    8   HD13  LEU  90          HD13      LEU  90   7.410   6.963   2.233
    9   HD22  LEU  90          HD21      LEU  90   8.705  10.832   1.312
   10   HD21  LEU  90          HD22      LEU  90   7.732  10.867   2.781
   11   HD23  LEU  90          HD23      LEU  90   7.016  10.326   1.263

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  91           H        ILE  91  11.670   7.657   4.685
    2    HA   ILE  91           HA       ILE  91  11.845   9.008   7.158
    3    HB   ILE  91           HB       ILE  91  13.367   6.661   6.010
    4   HG12  ILE  91          HG12      ILE  91  11.373   6.836   8.288
    5   HG13  ILE  91          HG13      ILE  91  10.885   6.568   6.615
    6   HG22  ILE  91          HG21      ILE  91  13.859   6.430   8.645
    7   HG21  ILE  91          HG22      ILE  91  13.798   8.190   8.553
    8   HG23  ILE  91          HG23      ILE  91  14.960   7.296   7.574
    9   HD13  ILE  91          HD11      ILE  91  11.867   4.457   6.526
   10   HD12  ILE  91          HD12      ILE  91  11.289   4.513   8.192
   11   HD11  ILE  91          HD13      ILE  91  12.990   4.812   7.839

  No H/Q in entry =          11
  In of MODEL   83
    1    H    THR  92           H        THR  92  14.036   8.832   4.386
    2    HA   THR  92           HA       THR  92  16.224  10.199   5.532
    3    HB   THR  92           HB       THR  92  15.211  10.097   2.680
    4    HG1  THR  92           HG1      THR  92  16.029   8.191   3.068
    5   HG22  THR  92          HG21      THR  92  17.785  10.765   2.367
    6   HG21  THR  92          HG22      THR  92  17.498  11.582   3.903
    7   HG23  THR  92          HG23      THR  92  16.519  11.985   2.493

  No H/Q in entry =           7
  In of MODEL   83
    1    H    GLU  93           H        GLU  93  13.333  11.388   3.835
    2    HA   GLU  93           HA       GLU  93  13.954  14.142   3.957
    3    HB2  GLU  93           HB2      GLU  93  11.237  12.795   3.989
    4    HB3  GLU  93           HB3      GLU  93  11.538  14.493   3.623
    5    HG2  GLU  93           HG2      GLU  93  12.840  12.246   2.072
    6    HG3  GLU  93           HG3      GLU  93  11.296  12.946   1.603

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LEU  94           H        LEU  94  12.211  11.992   6.174
    2    HA   LEU  94           HA       LEU  94  11.437  13.936   8.067
    3    HB2  LEU  94           HB2      LEU  94  11.988  10.975   8.321
    4    HB3  LEU  94           HB3      LEU  94  11.438  11.949   9.681
    5    HG   LEU  94           HG       LEU  94   9.930  12.027   7.067
    6   HD11  LEU  94          HD11      LEU  94  10.011   9.796   9.060
    7   HD13  LEU  94          HD12      LEU  94   9.693   9.746   7.327
    8   HD12  LEU  94          HD13      LEU  94   8.429  10.269   8.439
    9   HD23  LEU  94          HD21      LEU  94   8.029  12.437   8.686
   10   HD22  LEU  94          HD22      LEU  94   9.280  13.679   8.718
   11   HD21  LEU  94          HD23      LEU  94   9.218  12.457   9.987

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  95           H        ILE  95  14.391  11.981   7.793
    2    HA   ILE  95           HA       ILE  95  15.589  12.880  10.201
    3    HB   ILE  95           HB       ILE  95  16.794  11.812   7.636
    4   HG12  ILE  95          HG12      ILE  95  16.513  10.601  10.400
    5   HG13  ILE  95          HG13      ILE  95  15.332  10.359   9.115
    6   HG21  ILE  95          HG21      ILE  95  18.082  12.594  10.270
    7   HG23  ILE  95          HG22      ILE  95  18.534  13.126   8.649
    8   HG22  ILE  95          HG23      ILE  95  18.829  11.461   9.147
    9   HD13  ILE  95          HD11      ILE  95  16.788   9.073   7.832
   10   HD12  ILE  95          HD12      ILE  95  17.272   8.612   9.461
   11   HD11  ILE  95          HD13      ILE  95  18.228   9.787   8.559

  No H/Q in entry =          11
  In of MODEL   83
    1    H    GLU  96           H        GLU  96  15.724  14.128   6.871
    2    HA   GLU  96           HA       GLU  96  17.595  16.187   7.340
    3    HB2  GLU  96           HB2      GLU  96  16.903  15.542   5.084
    4    HB3  GLU  96           HB3      GLU  96  15.268  16.113   5.403
    5    HG2  GLU  96           HG2      GLU  96  15.849  18.240   4.865
    6    HG3  GLU  96           HG3      GLU  96  17.159  18.222   6.035

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LEU  97           H        LEU  97  14.086  16.031   7.802
    2    HA   LEU  97           HA       LEU  97  13.701  18.765   8.461
    3    HB2  LEU  97           HB2      LEU  97  12.165  16.251   9.077
    4    HB3  LEU  97           HB3      LEU  97  11.673  17.799   9.760
    5    HG   LEU  97           HG       LEU  97  12.124  17.393   6.789
    6   HD12  LEU  97          HD11      LEU  97   9.599  17.289   6.694
    7   HD11  LEU  97          HD12      LEU  97   9.607  17.081   8.443
    8   HD13  LEU  97          HD13      LEU  97  10.366  15.871   7.408
    9   HD23  LEU  97          HD21      LEU  97  10.405  19.373   6.847
   10   HD22  LEU  97          HD22      LEU  97  12.093  19.715   7.226
   11   HD21  LEU  97          HD23      LEU  97  10.915  19.549   8.526

  No H/Q in entry =          11
  In of MODEL   83
    1    H    HIS  98           H        HIS  98  14.515  15.922  10.435
    2    HA   HIS  98           HA       HIS  98  14.393  17.172  12.958
    3    HB2  HIS  98           HB2      HIS  98  16.111  14.903  11.929
    4    HB3  HIS  98           HB3      HIS  98  16.131  15.433  13.613
    5    HD1  HIS  98           HD1      HIS  98  13.892  13.837  11.034
    6    HD2  HIS  98           HD2      HIS  98  13.832  14.738  15.104
    7    HE1  HIS  98           HE1      HIS  98  11.865  12.657  12.000
    8    HE2  HIS  98           HE2      HIS  98  11.808  13.197  14.474

  No H/Q in entry =           8
  In of MODEL   83
    1    H    GLU  99           H        GLU  99  16.922  17.044  10.499
    2    HA   GLU  99           HA       GLU  99  18.934  18.349  12.015
    3    HB2  GLU  99           HB2      GLU  99  19.382  17.068   9.936
    4    HB3  GLU  99           HB3      GLU  99  18.575  18.335   9.009
    5    HG2  GLU  99           HG2      GLU  99  20.206  19.986   9.792
    6    HG3  GLU  99           HG3      GLU  99  20.984  18.771  10.802

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LYS 100           H        LYS 100  16.401  19.547   9.829
    2    HA   LYS 100           HA       LYS 100  17.226  22.276   9.979
    3    HB2  LYS 100           HB2      LYS 100  14.574  21.016   9.243
    4    HB3  LYS 100           HB3      LYS 100  14.889  22.752   9.158
    5    HG2  LYS 100           HG2      LYS 100  16.843  22.291   7.670
    6    HG3  LYS 100           HG3      LYS 100  16.413  20.578   7.684
    7    HD2  LYS 100           HD2      LYS 100  14.214  21.114   6.707
    8    HD3  LYS 100           HD3      LYS 100  14.627  22.829   6.701
    9    HE2  LYS 100           HE2      LYS 100  16.567  22.337   5.220
   10    HE3  LYS 100           HE3      LYS 100  16.085  20.637   5.183
   11    HZ1  LYS 100           HZ1      LYS 100  14.274  22.852   4.376
   12    HZ3  LYS 100           HZ2      LYS 100  14.070  21.186   4.108
   13    HZ2  LYS 100           HZ3      LYS 100  15.282  22.040   3.279

  No H/Q in entry =          13
  In of MODEL   83
    1    H    LEU 101           H        LEU 101  15.127  20.240  11.954
    2    HA   LEU 101           HA       LEU 101  13.997  22.312  13.553
    3    HB2  LEU 101           HB2      LEU 101  14.413  19.356  13.918
    4    HB3  LEU 101           HB3      LEU 101  13.900  20.335  15.289
    5    HG   LEU 101           HG       LEU 101  12.458  20.451  12.634
    6   HD12  LEU 101          HD11      LEU 101  10.795  18.897  13.911
    7   HD11  LEU 101          HD12      LEU 101  12.195  18.465  14.891
    8   HD13  LEU 101          HD13      LEU 101  12.208  18.167  13.152
    9   HD21  LEU 101          HD21      LEU 101  11.836  21.236  15.496
   10   HD23  LEU 101          HD22      LEU 101  10.561  21.029  14.297
   11   HD22  LEU 101          HD23      LEU 101  11.806  22.253  14.053

  No H/Q in entry =          11
  In of MODEL   83
    1    H    LYS 102           H        LYS 102  17.134  21.675  13.084
    2    HA   LYS 102           HA       LYS 102  18.999  22.522  14.143
    3    HB2  LYS 102           HB2      LYS 102  17.211  24.049  15.301
    4    HB3  LYS 102           HB3      LYS 102  17.421  22.978  16.670
    5    HG2  LYS 102           HG2      LYS 102  19.323  24.975  15.493
    6    HG3  LYS 102           HG3      LYS 102  18.954  24.656  17.174
    7    HD2  LYS 102           HD2      LYS 102  20.585  22.736  15.463
    8    HD3  LYS 102           HD3      LYS 102  21.297  24.046  16.395
    9    HE2  LYS 102           HE2      LYS 102  20.882  21.496  17.355
   10    HE3  LYS 102           HE3      LYS 102  21.124  22.931  18.352
   11    HZ2  LYS 102           HZ1      LYS 102  19.149  21.664  18.982
   12    HZ1  LYS 102           HZ2      LYS 102  18.492  21.908  17.441
   13    HZ3  LYS 102           HZ3      LYS 102  18.746  23.230  18.471

  No H/Q in entry =          13
  In of MODEL   83
    1    H    ALA 103           H        ALA 103  16.934  20.925  16.576
    2    HA   ALA 103           HA       ALA 103  18.665  19.688  18.208
    3    HB2  ALA 103           HB1      ALA 103  17.060  17.697  18.208
    4    HB1  ALA 103           HB2      ALA 103  16.161  18.566  16.963
    5    HB3  ALA 103           HB3      ALA 103  16.362  19.277  18.564

  No H/Q in entry =           5
  In of MODEL   83
    1    H1   ALA   1           H3       ALA   1  -1.918  -6.757 -21.353
    2    H2   ALA   1           H2       ALA   1  -2.723  -8.186 -20.899
    3    H3   ALA   1           H1       ALA   1  -1.121  -8.250 -21.470
    4    HA   ALA   1           HA       ALA   1  -1.979  -8.700 -23.461
    5    HB1  ALA   1           HB1      ALA   1  -4.119  -9.398 -22.970
    6    HB2  ALA   1           HB2      ALA   1  -4.549  -7.878 -23.756
    7    HB3  ALA   1           HB3      ALA   1  -4.472  -7.969 -21.998

  No H/Q in entry =           7
  In of MODEL   83
    1    H    GLU   2           H        GLU   2  -2.815  -7.490 -25.436
    2    HA   GLU   2           HA       GLU   2  -1.403  -5.487 -26.316
    3    HB2  GLU   2           HB2      GLU   2  -4.413  -5.520 -26.606
    4    HB3  GLU   2           HB3      GLU   2  -3.293  -4.664 -27.662
    5    HG2  GLU   2           HG2      GLU   2  -2.821  -6.553 -28.831
    6    HG3  GLU   2           HG3      GLU   2  -2.520  -7.470 -27.361

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLU   3           H        GLU   3  -4.541  -4.201 -25.380
    2    HA   GLU   3           HA       GLU   3  -3.461  -1.660 -24.748
    3    HB2  GLU   3           HB2      GLU   3  -6.160  -2.947 -24.398
    4    HB3  GLU   3           HB3      GLU   3  -5.838  -1.339 -23.746
    5    HG2  GLU   3           HG2      GLU   3  -5.492  -0.405 -25.870
    6    HG3  GLU   3           HG3      GLU   3  -5.120  -1.960 -26.607

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LEU   4           H        LEU   4  -5.056  -4.013 -22.566
    2    HA   LEU   4           HA       LEU   4  -4.656  -2.802 -20.172
    3    HB2  LEU   4           HB2      LEU   4  -4.150  -5.746 -20.662
    4    HB3  LEU   4           HB3      LEU   4  -4.533  -5.003 -19.110
    5    HG   LEU   4           HG       LEU   4  -6.329  -5.045 -21.558
    6   HD13  LEU   4          HD11      LEU   4  -7.531  -6.755 -20.558
    7   HD12  LEU   4          HD12      LEU   4  -7.026  -6.309 -18.929
    8   HD11  LEU   4          HD13      LEU   4  -5.910  -7.159 -19.996
    9   HD23  LEU   4          HD21      LEU   4  -7.987  -4.226 -19.670
   10   HD22  LEU   4          HD22      LEU   4  -6.944  -3.061 -20.485
   11   HD21  LEU   4          HD23      LEU   4  -6.509  -3.665 -18.886

  No H/Q in entry =          11
  In of MODEL   83
    1    H    GLU   5           H        GLU   5  -2.195  -4.662 -21.936
    2    HA   GLU   5           HA       GLU   5  -0.189  -4.410 -19.916
    3    HB2  GLU   5           HB2      GLU   5  -0.175  -6.168 -21.693
    4    HB3  GLU   5           HB3      GLU   5   0.175  -4.913 -22.884
    5    HG2  GLU   5           HG2      GLU   5   2.276  -5.901 -22.257
    6    HG3  GLU   5           HG3      GLU   5   2.212  -4.307 -21.508

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLU   6           H        GLU   6  -0.834  -2.674 -22.946
    2    HA   GLU   6           HA       GLU   6   1.358  -0.867 -22.689
    3    HB2  GLU   6           HB2      GLU   6   0.332  -1.235 -24.859
    4    HB3  GLU   6           HB3      GLU   6  -1.225  -0.668 -24.256
    5    HG2  GLU   6           HG2      GLU   6   0.081   1.055 -25.566
    6    HG3  GLU   6           HG3      GLU   6  -0.376   1.563 -23.942

  No H/Q in entry =           6
  In of MODEL   83
    1    H    VAL   7           H        VAL   7  -1.971  -0.908 -21.613
    2    HA   VAL   7           HA       VAL   7  -2.155   1.802 -20.761
    3    HB   VAL   7           HB       VAL   7  -3.637  -0.704 -19.924
    4   HG11  VAL   7          HG11      VAL   7  -3.973   2.184 -19.091
    5   HG13  VAL   7          HG12      VAL   7  -3.879   0.753 -18.064
    6   HG12  VAL   7          HG13      VAL   7  -5.318   1.043 -19.042
    7   HG21  VAL   7          HG21      VAL   7  -3.804   0.387 -22.305
    8   HG23  VAL   7          HG22      VAL   7  -4.729   1.641 -21.478
    9   HG22  VAL   7          HG23      VAL   7  -5.292  -0.030 -21.455

  No H/Q in entry =           9
  In of MODEL   83
    1    H    VAL   8           H        VAL   8  -1.185  -1.202 -19.142
    2    HA   VAL   8           HA       VAL   8  -0.831  -0.140 -16.544
    3    HB   VAL   8           HB       VAL   8   0.526  -2.466 -17.929
    4   HG13  VAL   8          HG11      VAL   8   1.964  -1.765 -16.131
    5   HG12  VAL   8          HG12      VAL   8   1.058  -3.161 -15.547
    6   HG11  VAL   8          HG13      VAL   8   0.592  -1.536 -15.046
    7   HG22  VAL   8          HG21      VAL   8  -1.256  -3.755 -17.226
    8   HG21  VAL   8          HG22      VAL   8  -2.105  -2.214 -17.177
    9   HG23  VAL   8          HG23      VAL   8  -1.410  -2.881 -15.703

  No H/Q in entry =           9
  In of MODEL   83
    1    H    MET   9           H        MET   9   1.389  -0.451 -19.314
    2    HA   MET   9           HA       MET   9   3.698   0.560 -18.069
    3    HB2  MET   9           HB2      MET   9   2.722   0.607 -20.922
    4    HB3  MET   9           HB3      MET   9   4.246   1.363 -20.460
    5    HG2  MET   9           HG2      MET   9   5.075  -0.753 -19.571
    6    HG3  MET   9           HG3      MET   9   3.523  -1.528 -19.896
    7    HE1  MET   9           HE1      MET   9   6.449   0.359 -21.125
    8    HE3  MET   9           HE2      MET   9   5.460   1.104 -22.378
    9    HE2  MET   9           HE3      MET   9   6.698  -0.067 -22.823

  No H/Q in entry =           9
  In of MODEL   83
    1    H    GLY  10           H        GLY  10   1.017   2.202 -19.712
    2    HA3  GLY  10           HA2      GLY  10   2.013   4.842 -19.463
    3    HA2  GLY  10           HA3      GLY  10   0.317   4.403 -19.654

  No H/Q in entry =           3
  In of MODEL   83
    1    H    LEU  11           H        LEU  11  -0.079   2.868 -17.372
    2    HA   LEU  11           HA       LEU  11  -0.567   4.840 -15.397
    3    HB2  LEU  11           HB2      LEU  11  -0.533   1.823 -15.258
    4    HB3  LEU  11           HB3      LEU  11  -1.017   2.845 -13.905
    5    HG   LEU  11           HG       LEU  11  -2.281   2.988 -16.656
    6   HD13  LEU  11          HD11      LEU  11  -2.883   0.848 -15.906
    7   HD12  LEU  11          HD12      LEU  11  -4.216   1.853 -15.342
    8   HD11  LEU  11          HD13      LEU  11  -2.955   1.351 -14.217
    9   HD22  LEU  11          HD21      LEU  11  -2.838   5.006 -15.632
   10   HD21  LEU  11          HD22      LEU  11  -2.755   4.329 -14.006
   11   HD23  LEU  11          HD23      LEU  11  -4.145   3.986 -15.036

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  12           H        ILE  12   1.944   2.345 -15.678
    2    HA   ILE  12           HA       ILE  12   3.181   2.854 -13.183
    3    HB   ILE  12           HB       ILE  12   4.397   1.814 -15.764
    4   HG12  ILE  12          HG12      ILE  12   2.381   0.598 -14.615
    5   HG13  ILE  12          HG13      ILE  12   3.770  -0.352 -15.106
    6   HG23  ILE  12          HG21      ILE  12   6.182   2.503 -14.296
    7   HG22  ILE  12          HG22      ILE  12   6.065   0.749 -14.177
    8   HG21  ILE  12          HG23      ILE  12   5.397   1.766 -12.902
    9   HD13  ILE  12          HD11      ILE  12   4.595  -0.369 -12.827
   10   HD12  ILE  12          HD12      ILE  12   2.911  -0.886 -12.816
   11   HD11  ILE  12          HD13      ILE  12   3.333   0.740 -12.324

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  13           H        ILE  13   3.765   4.128 -16.439
    2    HA   ILE  13           HA       ILE  13   5.930   5.818 -15.727
    3    HB   ILE  13           HB       ILE  13   3.878   5.936 -17.951
    4   HG12  ILE  13          HG12      ILE  13   5.649   4.056 -17.738
    5   HG13  ILE  13          HG13      ILE  13   5.483   4.869 -19.290
    6   HG23  ILE  13          HG21      ILE  13   4.536   8.164 -17.928
    7   HG22  ILE  13          HG22      ILE  13   5.757   7.480 -18.994
    8   HG21  ILE  13          HG23      ILE  13   6.147   7.803 -17.305
    9   HD11  ILE  13          HD11      ILE  13   7.438   6.082 -17.394
   10   HD13  ILE  13          HD12      ILE  13   7.536   5.868 -19.138
   11   HD12  ILE  13          HD13      ILE  13   7.868   4.510 -18.068

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ASN  14           H        ASN  14   2.427   6.357 -15.957
    2    HA   ASN  14           HA       ASN  14   2.424   9.100 -15.304
    3    HB2  ASN  14           HB2      ASN  14   0.503   7.486 -16.125
    4    HB3  ASN  14           HB3      ASN  14   0.197   7.301 -14.402
    5   HD21  ASN  14          HD21      ASN  14  -1.823   8.490 -15.808
    6   HD22  ASN  14          HD22      ASN  14  -1.862  10.162 -15.531

  No H/Q in entry =           6
  In of MODEL   83
    1    H    SER  15           H        SER  15   2.115   6.215 -13.240
    2    HA   SER  15           HA       SER  15   1.850   7.576 -10.782
    3    HB2  SER  15           HB2      SER  15   2.386   5.478  -9.749
    4    HB3  SER  15           HB3      SER  15   1.534   5.077 -11.237
    5    HG   SER  15           HG       SER  15   4.237   4.820 -10.583

  No H/Q in entry =           5
  In of MODEL   83
    1    H    GLY  16           H        GLY  16   4.694   6.455 -12.576
    2    HA3  GLY  16           HA2      GLY  16   6.648   7.178 -10.661
    3    HA2  GLY  16           HA3      GLY  16   6.931   6.981 -12.388

  No H/Q in entry =           3
  In of MODEL   83
    1    H    GLN  17           H        GLN  17   5.254   8.964 -13.423
    2    HA   GLN  17           HA       GLN  17   6.861  11.286 -13.119
    3    HB2  GLN  17           HB2      GLN  17   5.491  10.806 -15.144
    4    HB3  GLN  17           HB3      GLN  17   4.031  11.095 -14.198
    5    HG2  GLN  17           HG2      GLN  17   4.587  13.126 -15.412
    6    HG3  GLN  17           HG3      GLN  17   4.868  13.396 -13.693
    7   HE21  GLN  17          HE21      GLN  17   6.596  14.913 -13.833
    8   HE22  GLN  17          HE22      GLN  17   8.087  14.554 -14.562

  No H/Q in entry =           8
  In of MODEL   83
    1    H    ALA  18           H        ALA  18   3.763  10.295 -11.744
    2    HA   ALA  18           HA       ALA  18   3.077  12.685 -10.458
    3    HB1  ALA  18           HB1      ALA  18   1.919  10.242 -10.682
    4    HB2  ALA  18           HB2      ALA  18   1.395  11.462  -9.523
    5    HB3  ALA  18           HB3      ALA  18   2.477  10.165  -9.011

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ARG  19           H        ARG  19   4.933   9.895  -9.213
    2    HA   ARG  19           HA       ARG  19   5.504  11.033  -6.690
    3    HB2  ARG  19           HB2      ARG  19   5.887   8.629  -7.234
    4    HB3  ARG  19           HB3      ARG  19   7.237   9.106  -8.266
    5    HG2  ARG  19           HG2      ARG  19   8.387  10.123  -6.350
    6    HG3  ARG  19           HG3      ARG  19   7.018   9.744  -5.306
    7    HD2  ARG  19           HD2      ARG  19   8.766   8.088  -4.975
    8    HD3  ARG  19           HD3      ARG  19   7.376   7.325  -5.751
    9    HE   ARG  19           HE       ARG  19   9.068   8.137  -7.811
   10   HH21  ARG  19          HH11      ARG  19  10.605   6.720  -8.685
   11   HH22  ARG  19          HH12      ARG  19  11.146   5.362  -7.762
   12   HH11  ARG  19          HH21      ARG  19   9.147   6.091  -5.044
   13   HH12  ARG  19          HH22      ARG  19  10.317   5.005  -5.700

  No H/Q in entry =          13
  In of MODEL   83
    1    H    SER  20           H        SER  20   7.291  11.060  -9.757
    2    HA   SER  20           HA       SER  20   9.558  12.448  -8.948
    3    HB2  SER  20           HB2      SER  20   9.559  11.584 -11.157
    4    HB3  SER  20           HB3      SER  20   8.063  12.418 -11.565
    5    HG   SER  20           HG       SER  20  10.597  13.579 -11.015

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LEU  21           H        LEU  21   6.460  13.755 -10.107
    2    HA   LEU  21           HA       LEU  21   7.161  16.493  -9.875
    3    HB2  LEU  21           HB2      LEU  21   4.478  15.096  -9.774
    4    HB3  LEU  21           HB3      LEU  21   4.664  16.848  -9.774
    5    HG   LEU  21           HG       LEU  21   5.816  15.046 -11.924
    6   HD13  LEU  21          HD11      LEU  21   3.915  15.547 -13.283
    7   HD12  LEU  21          HD12      LEU  21   3.322  16.745 -12.131
    8   HD11  LEU  21          HD13      LEU  21   3.271  15.031 -11.724
    9   HD23  LEU  21          HD21      LEU  21   5.609  17.380 -13.149
   10   HD22  LEU  21          HD22      LEU  21   6.984  17.095 -12.087
   11   HD21  LEU  21          HD23      LEU  21   5.616  18.036 -11.513

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ALA  22           H        ALA  22   5.649  14.206  -7.624
    2    HA   ALA  22           HA       ALA  22   5.084  16.008  -5.541
    3    HB3  ALA  22           HB1      ALA  22   4.299  13.624  -5.710
    4    HB2  ALA  22           HB2      ALA  22   4.907  14.082  -4.118
    5    HB1  ALA  22           HB3      ALA  22   5.911  13.120  -5.205

  No H/Q in entry =           5
  In of MODEL   83
    1    H    TYR  23           H        TYR  23   7.994  13.958  -6.020
    2    HA   TYR  23           HA       TYR  23   9.409  14.952  -3.776
    3    HB2  TYR  23           HB2      TYR  23  10.165  12.943  -4.954
    4    HB3  TYR  23           HB3      TYR  23  10.474  13.887  -6.410
    5    HD1  TYR  23           HD1      TYR  23  11.480  13.487  -2.841
    6    HD2  TYR  23           HD2      TYR  23  12.505  15.075  -6.699
    7    HE1  TYR  23           HE1      TYR  23  13.752  14.039  -2.011
    8    HE2  TYR  23           HE2      TYR  23  14.775  15.627  -5.869
    9    HH   TYR  23           HH       TYR  23  15.695  15.000  -2.481

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ALA  24           H        ALA  24   9.202  16.079  -7.135
    2    HA   ALA  24           HA       ALA  24  11.118  18.146  -6.897
    3    HB2  ALA  24           HB1      ALA  24  10.654  18.224  -9.100
    4    HB3  ALA  24           HB2      ALA  24   9.109  18.985  -8.721
    5    HB1  ALA  24           HB3      ALA  24   9.218  17.231  -8.862

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ALA  25           H        ALA  25   7.645  17.987  -6.241
    2    HA   ALA  25           HA       ALA  25   7.193  20.706  -5.653
    3    HB1  ALA  25           HB1      ALA  25   5.513  18.723  -5.848
    4    HB2  ALA  25           HB2      ALA  25   5.168  20.008  -4.689
    5    HB3  ALA  25           HB3      ALA  25   5.850  18.479  -4.133

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LEU  26           H        LEU  26   8.260  18.007  -3.628
    2    HA   LEU  26           HA       LEU  26   8.401  19.425  -1.185
    3    HB2  LEU  26           HB2      LEU  26   8.477  17.007  -1.193
    4    HB3  LEU  26           HB3      LEU  26   9.937  17.009  -2.178
    5    HG   LEU  26           HG       LEU  26  11.179  18.108  -0.345
    6   HD12  LEU  26          HD11      LEU  26   9.976  18.113   1.927
    7   HD11  LEU  26          HD12      LEU  26   8.478  17.991   1.007
    8   HD13  LEU  26          HD13      LEU  26   9.532  19.390   0.795
    9   HD21  LEU  26          HD21      LEU  26   9.636  15.647   0.531
   10   HD23  LEU  26          HD22      LEU  26  11.162  16.194   1.216
   11   HD22  LEU  26          HD23      LEU  26  11.096  15.644  -0.457

  No H/Q in entry =          11
  In of MODEL   83
    1    H    LYS  27           H        LYS  27  10.788  18.847  -3.737
    2    HA   LYS  27           HA       LYS  27  12.993  20.065  -2.525
    3    HB2  LYS  27           HB2      LYS  27  13.064  18.728  -4.622
    4    HB3  LYS  27           HB3      LYS  27  12.300  20.070  -5.473
    5    HG2  LYS  27           HG2      LYS  27  14.182  21.539  -4.907
    6    HG3  LYS  27           HG3      LYS  27  14.942  20.236  -3.985
    7    HD2  LYS  27           HD2      LYS  27  15.054  18.859  -6.047
    8    HD3  LYS  27           HD3      LYS  27  14.339  20.187  -6.962
    9    HE2  LYS  27           HE2      LYS  27  16.243  21.636  -6.361
   10    HE3  LYS  27           HE3      LYS  27  16.962  20.312  -5.437
   11    HZ3  LYS  27           HZ1      LYS  27  17.931  20.416  -7.633
   12    HZ2  LYS  27           HZ2      LYS  27  16.396  20.312  -8.359
   13    HZ1  LYS  27           HZ3      LYS  27  17.019  18.993  -7.488

  No H/Q in entry =          13
  In of MODEL   83
    1    H    GLN  28           H        GLN  28  10.361  21.476  -4.440
    2    HA   GLN  28           HA       GLN  28  11.337  24.122  -4.589
    3    HB2  GLN  28           HB2      GLN  28   8.498  23.071  -4.453
    4    HB3  GLN  28           HB3      GLN  28   8.919  24.742  -4.825
    5    HG2  GLN  28           HG2      GLN  28   9.889  22.333  -6.390
    6    HG3  GLN  28           HG3      GLN  28   8.548  23.369  -6.875
    7   HE21  GLN  28          HE21      GLN  28  11.638  22.876  -7.710
    8   HE22  GLN  28          HE22      GLN  28  12.136  24.462  -8.052

  No H/Q in entry =           8
  In of MODEL   83
    1    H    ALA  29           H        ALA  29   9.419  22.431  -2.142
    2    HA   ALA  29           HA       ALA  29   8.902  24.618  -0.443
    3    HB2  ALA  29           HB1      ALA  29   8.178  23.046   1.124
    4    HB1  ALA  29           HB2      ALA  29   9.386  21.856   0.641
    5    HB3  ALA  29           HB3      ALA  29   7.992  22.164  -0.392

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LYS  30           H        LYS  30  11.616  22.332  -0.552
    2    HA   LYS  30           HA       LYS  30  12.963  23.266   1.742
    3    HB2  LYS  30           HB2      LYS  30  14.025  21.985  -0.786
    4    HB3  LYS  30           HB3      LYS  30  15.025  22.331   0.627
    5    HG2  LYS  30           HG2      LYS  30  13.477  20.951   2.015
    6    HG3  LYS  30           HG3      LYS  30  12.574  20.543   0.553
    7    HD2  LYS  30           HD2      LYS  30  14.602  19.548  -0.434
    8    HD3  LYS  30           HD3      LYS  30  15.524  19.970   1.011
    9    HE2  LYS  30           HE2      LYS  30  14.023  18.542   2.373
   10    HE3  LYS  30           HE3      LYS  30  13.131  18.099   0.912
   11    HZ2  LYS  30           HZ1      LYS  30  14.920  16.506   1.646
   12    HZ1  LYS  30           HZ2      LYS  30  16.060  17.688   1.189
   13    HZ3  LYS  30           HZ3      LYS  30  15.008  17.017   0.032

  No H/Q in entry =          13
  In of MODEL   83
    1    H    GLN  31           H        GLN  31  12.828  24.488  -1.547
    2    HA   GLN  31           HA       GLN  31  14.998  26.365  -1.138
    3    HB2  GLN  31           HB2      GLN  31  12.933  26.437  -3.342
    4    HB3  GLN  31           HB3      GLN  31  14.557  27.122  -3.356
    5    HG2  GLN  31           HG2      GLN  31  15.007  24.420  -2.799
    6    HG3  GLN  31           HG3      GLN  31  13.691  24.380  -3.964
    7   HE21  GLN  31          HE21      GLN  31  16.525  23.571  -4.401
    8   HE22  GLN  31          HE22      GLN  31  17.090  24.547  -5.668

  No H/Q in entry =           8
  In of MODEL   83
    1    H    GLY  32           H        GLY  32  11.934  26.197   0.038
    2    HA3  GLY  32           HA2      GLY  32  10.802  27.766   1.331
    3    HA2  GLY  32           HA3      GLY  32  11.929  28.997   0.775

  No H/Q in entry =           3
  In of MODEL   83
    1    H    ASP  33           H        ASP  33  10.527  27.115  -1.713
    2    HA   ASP  33           HA       ASP  33   8.869  29.403  -2.539
    3    HB2  ASP  33           HB2      ASP  33   9.931  26.984  -4.005
    4    HB3  ASP  33           HB3      ASP  33   8.780  28.110  -4.718

  No H/Q in entry =           4
  In of MODEL   83
    1    H    PHE  34           H        PHE  34   7.193  28.930  -0.961
    2    HA   PHE  34           HA       PHE  34   5.799  26.466  -0.863
    3    HB2  PHE  34           HB2      PHE  34   4.863  29.256  -0.160
    4    HB3  PHE  34           HB3      PHE  34   4.009  27.769   0.253
    5    HD1  PHE  34           HD1      PHE  34   6.287  30.146   1.456
    6    HD2  PHE  34           HD2      PHE  34   5.578  25.910   1.388
    7    HE1  PHE  34           HE1      PHE  34   7.697  29.876   3.477
    8    HE2  PHE  34           HE2      PHE  34   6.991  25.644   3.407
    9    HZ   PHE  34           HZ       PHE  34   8.044  27.628   4.451

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ALA  35           H        ALA  35   5.366  29.343  -2.855
    2    HA   ALA  35           HA       ALA  35   2.801  28.750  -3.857
    3    HB1  ALA  35           HB1      ALA  35   3.841  30.146  -5.898
    4    HB3  ALA  35           HB2      ALA  35   5.073  30.493  -4.685
    5    HB2  ALA  35           HB3      ALA  35   3.388  30.912  -4.375

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ALA  36           H        ALA  36   6.011  28.063  -5.248
    2    HA   ALA  36           HA       ALA  36   4.990  26.652  -7.488
    3    HB3  ALA  36           HB1      ALA  36   7.143  26.766  -8.126
    4    HB2  ALA  36           HB2      ALA  36   7.632  25.727  -6.786
    5    HB1  ALA  36           HB3      ALA  36   7.539  27.475  -6.560

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ALA  37           H        ALA  37   5.973  25.635  -4.249
    2    HA   ALA  37           HA       ALA  37   5.892  22.849  -4.691
    3    HB2  ALA  37           HB1      ALA  37   5.667  24.630  -2.301
    4    HB1  ALA  37           HB2      ALA  37   6.788  23.306  -2.612
    5    HB3  ALA  37           HB3      ALA  37   5.130  22.961  -2.126

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LYS  38           H        LYS  38   3.385  25.067  -3.486
    2    HA   LYS  38           HA       LYS  38   1.277  23.266  -3.251
    3    HB2  LYS  38           HB2      LYS  38   1.649  26.019  -2.989
    4    HB3  LYS  38           HB3      LYS  38   0.435  25.886  -4.257
    5    HG2  LYS  38           HG2      LYS  38  -1.008  24.564  -2.806
    6    HG3  LYS  38           HG3      LYS  38   0.249  24.490  -1.563
    7    HD2  LYS  38           HD2      LYS  38   0.082  26.825  -1.102
    8    HD3  LYS  38           HD3      LYS  38  -0.843  27.127  -2.573
    9    HE2  LYS  38           HE2      LYS  38  -2.326  27.161  -0.618
   10    HE3  LYS  38           HE3      LYS  38  -2.720  25.793  -1.663
   11    HZ3  LYS  38           HZ1      LYS  38  -1.988  24.309  -0.145
   12    HZ2  LYS  38           HZ2      LYS  38  -2.319  25.563   0.954
   13    HZ1  LYS  38           HZ3      LYS  38  -0.732  25.305   0.411

  No H/Q in entry =          13
  In of MODEL   83
    1    H    ALA  39           H        ALA  39   2.239  25.177  -6.100
    2    HA   ALA  39           HA       ALA  39   0.140  24.332  -7.786
    3    HB2  ALA  39           HB1      ALA  39   2.870  24.968  -8.864
    4    HB1  ALA  39           HB2      ALA  39   1.919  26.232  -8.083
    5    HB3  ALA  39           HB3      ALA  39   1.287  25.406  -9.507

  No H/Q in entry =           5
  In of MODEL   83
    1    H    MET  40           H        MET  40   3.376  23.010  -7.246
    2    HA   MET  40           HA       MET  40   3.245  21.001  -9.247
    3    HB2  MET  40           HB2      MET  40   4.884  21.201  -6.714
    4    HB3  MET  40           HB3      MET  40   5.114  19.950  -7.937
    5    HG2  MET  40           HG2      MET  40   5.183  22.909  -8.588
    6    HG3  MET  40           HG3      MET  40   6.629  21.995  -8.158
    7    HE3  MET  40           HE1      MET  40   7.458  19.789 -10.987
    8    HE2  MET  40           HE2      MET  40   6.910  19.465  -9.346
    9    HE1  MET  40           HE3      MET  40   8.010  20.807  -9.650

  No H/Q in entry =           9
  In of MODEL   83
    1    H    MET  41           H        MET  41   2.366  21.031  -5.813
    2    HA   MET  41           HA       MET  41   1.819  18.268  -5.544
    3    HB2  MET  41           HB2      MET  41   0.515  20.627  -4.168
    4    HB3  MET  41           HB3      MET  41   0.354  18.947  -3.667
    5    HG2  MET  41           HG2      MET  41   3.065  19.154  -3.731
    6    HG3  MET  41           HG3      MET  41   2.639  20.813  -3.322
    7    HE2  MET  41           HE1      MET  41  -0.390  19.569  -1.572
    8    HE1  MET  41           HE2      MET  41   0.432  21.079  -1.950
    9    HE3  MET  41           HE3      MET  41   0.386  20.501  -0.284

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ASP  42           H        ASP  42  -0.213  21.010  -6.483
    2    HA   ASP  42           HA       ASP  42  -2.663  19.664  -6.602
    3    HB2  ASP  42           HB2      ASP  42  -1.943  22.232  -6.852
    4    HB3  ASP  42           HB3      ASP  42  -2.114  21.846  -8.561

  No H/Q in entry =           4
  In of MODEL   83
    1    H    GLN  43           H        GLN  43  -0.244  20.254  -9.126
    2    HA   GLN  43           HA       GLN  43  -1.660  18.953 -11.207
    3    HB2  GLN  43           HB2      GLN  43   1.305  19.450 -10.853
    4    HB3  GLN  43           HB3      GLN  43   0.572  18.822 -12.332
    5    HG2  GLN  43           HG2      GLN  43  -0.928  20.858 -12.347
    6    HG3  GLN  43           HG3      GLN  43   0.042  21.502 -11.026
    7   HE21  GLN  43          HE21      GLN  43   0.191  23.132 -13.105
    8   HE22  GLN  43          HE22      GLN  43   1.596  22.908 -14.028

  No H/Q in entry =           8
  In of MODEL   83
    1    H    SER  44           H        SER  44   0.708  17.787  -8.847
    2    HA   SER  44           HA       SER  44   1.018  15.184  -9.889
    3    HB2  SER  44           HB2      SER  44   1.944  16.606  -7.654
    4    HB3  SER  44           HB3      SER  44   1.080  15.224  -6.982
    5    HG   SER  44           HG       SER  44   3.183  14.595  -7.433

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ARG  45           H        ARG  45  -1.271  16.503  -7.520
    2    HA   ARG  45           HA       ARG  45  -2.664  14.147  -6.883
    3    HB2  ARG  45           HB2      ARG  45  -2.838  16.310  -5.678
    4    HB3  ARG  45           HB3      ARG  45  -3.704  16.989  -7.053
    5    HG2  ARG  45           HG2      ARG  45  -5.477  15.271  -6.760
    6    HG3  ARG  45           HG3      ARG  45  -4.621  14.647  -5.349
    7    HD2  ARG  45           HD2      ARG  45  -4.805  16.909  -4.279
    8    HD3  ARG  45           HD3      ARG  45  -5.803  17.442  -5.649
    9    HE   ARG  45           HE       ARG  45  -6.915  15.066  -4.610
   10   HH21  ARG  45          HH11      ARG  45  -8.737  15.145  -3.320
   11   HH22  ARG  45          HH12      ARG  45  -9.116  16.582  -2.439
   12   HH11  ARG  45          HH21      ARG  45  -6.342  18.304  -3.575
   13   HH12  ARG  45          HH22      ARG  45  -7.754  18.371  -2.582

  No H/Q in entry =          13
  In of MODEL   83
    1    H    MET  46           H        MET  46  -3.261  16.567  -9.415
    2    HA   MET  46           HA       MET  46  -5.617  15.413 -10.459
    3    HB2  MET  46           HB2      MET  46  -3.517  17.226 -11.659
    4    HB3  MET  46           HB3      MET  46  -4.927  16.694 -12.578
    5    HG2  MET  46           HG2      MET  46  -6.416  17.627 -10.863
    6    HG3  MET  46           HG3      MET  46  -5.027  18.127  -9.905
    7    HE2  MET  46           HE1      MET  46  -5.387  20.994  -9.972
    8    HE1  MET  46           HE2      MET  46  -6.848  20.017 -10.090
    9    HE3  MET  46           HE3      MET  46  -6.625  21.390 -11.173

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ALA  47           H        ALA  47  -2.199  14.920 -11.254
    2    HA   ALA  47           HA       ALA  47  -2.575  13.206 -13.470
    3    HB3  ALA  47           HB1      ALA  47  -0.390  14.083 -13.136
    4    HB2  ALA  47           HB2      ALA  47  -0.254  12.352 -12.812
    5    HB1  ALA  47           HB3      ALA  47  -0.327  13.497 -11.472

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LEU  48           H        LEU  48  -2.274  12.551 -10.002
    2    HA   LEU  48           HA       LEU  48  -2.383   9.712 -10.174
    3    HB2  LEU  48           HB2      LEU  48  -3.116  11.622  -7.943
    4    HB3  LEU  48           HB3      LEU  48  -3.028   9.870  -7.752
    5    HG   LEU  48           HG       LEU  48  -0.731  11.564  -8.764
    6   HD13  LEU  48          HD11      LEU  48  -0.988  12.324  -6.567
    7   HD12  LEU  48          HD12      LEU  48   0.171  11.010  -6.387
    8   HD11  LEU  48          HD13      LEU  48  -1.524  10.753  -5.973
    9   HD22  LEU  48          HD21      LEU  48  -0.250   9.379  -9.421
   10   HD21  LEU  48          HD22      LEU  48  -1.109   8.661  -8.060
   11   HD23  LEU  48          HD23      LEU  48   0.470   9.405  -7.812

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ASN  49           H        ASN  49  -4.830  12.214  -9.735
    2    HA   ASN  49           HA       ASN  49  -7.019  10.557  -9.182
    3    HB2  ASN  49           HB2      ASN  49  -7.056  12.980  -8.847
    4    HB3  ASN  49           HB3      ASN  49  -6.919  13.247 -10.580
    5   HD21  ASN  49          HD21      ASN  49  -9.103  14.320  -9.172
    6   HD22  ASN  49          HD22      ASN  49 -10.517  13.497  -9.619

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLU  50           H        GLU  50  -5.764  11.764 -12.276
    2    HA   GLU  50           HA       GLU  50  -7.741  10.526 -13.908
    3    HB2  GLU  50           HB2      GLU  50  -6.275  12.342 -14.728
    4    HB3  GLU  50           HB3      GLU  50  -4.885  11.263 -14.609
    5    HG2  GLU  50           HG2      GLU  50  -5.882   9.740 -16.244
    6    HG3  GLU  50           HG3      GLU  50  -7.339  10.726 -16.312

  No H/Q in entry =           6
  In of MODEL   83
    1    H    ALA  51           H        ALA  51  -4.564   9.513 -12.739
    2    HA   ALA  51           HA       ALA  51  -4.450   7.066 -14.171
    3    HB2  ALA  51           HB1      ALA  51  -2.460   6.763 -13.092
    4    HB1  ALA  51           HB2      ALA  51  -3.130   7.181 -11.516
    5    HB3  ALA  51           HB3      ALA  51  -2.680   8.455 -12.648

  No H/Q in entry =           5
  In of MODEL   83
    1    H    HIS  52           H        HIS  52  -5.587   7.887 -10.906
    2    HA   HIS  52           HA       HIS  52  -6.277   5.276 -10.081
    3    HB2  HIS  52           HB2      HIS  52  -6.112   7.265  -8.583
    4    HB3  HIS  52           HB3      HIS  52  -7.610   7.873  -9.286
    5    HD1  HIS  52           HD1      HIS  52  -9.550   5.738  -9.296
    6    HD2  HIS  52           HD2      HIS  52  -6.691   5.901  -6.267
    7    HE1  HIS  52           HE1      HIS  52 -10.464   4.367  -7.373
    8    HE2  HIS  52           HE2      HIS  52  -8.732   4.456  -5.518

  No H/Q in entry =           8
  In of MODEL   83
    1    H    LEU  53           H        LEU  53  -8.102   7.753 -11.839
    2    HA   LEU  53           HA       LEU  53 -10.614   6.474 -11.833
    3    HB2  LEU  53           HB2      LEU  53  -9.338   8.459 -13.701
    4    HB3  LEU  53           HB3      LEU  53 -10.941   7.802 -14.018
    5    HG   LEU  53           HG       LEU  53 -10.210   9.092 -11.370
    6   HD13  LEU  53          HD11      LEU  53  -9.904  10.750 -13.153
    7   HD12  LEU  53          HD12      LEU  53 -11.366  11.112 -12.233
    8   HD11  LEU  53          HD13      LEU  53 -11.484  10.351 -13.817
    9   HD23  LEU  53          HD21      LEU  53 -12.797   9.504 -11.511
   10   HD22  LEU  53          HD22      LEU  53 -12.216   7.906 -11.060
   11   HD21  LEU  53          HD23      LEU  53 -12.780   8.202 -12.693

  No H/Q in entry =          11
  In of MODEL   83
    1    H    VAL  54           H        VAL  54  -7.887   6.273 -14.098
    2    HA   VAL  54           HA       VAL  54  -9.137   4.518 -15.938
    3    HB   VAL  54           HB       VAL  54  -6.220   5.006 -15.282
    4   HG12  VAL  54          HG11      VAL  54  -6.002   3.931 -17.678
    5   HG11  VAL  54          HG12      VAL  54  -7.531   3.157 -17.264
    6   HG13  VAL  54          HG13      VAL  54  -6.107   2.889 -16.260
    7   HG22  VAL  54          HG21      VAL  54  -6.989   6.958 -16.309
    8   HG21  VAL  54          HG22      VAL  54  -8.197   6.106 -17.270
    9   HG23  VAL  54          HG23      VAL  54  -6.495   6.019 -17.717

  No H/Q in entry =           9
  In of MODEL   83
    1    H    GLN  55           H        GLN  55  -7.113   3.946 -13.061
    2    HA   GLN  55           HA       GLN  55  -7.042   1.130 -13.332
    3    HB2  GLN  55           HB2      GLN  55  -5.466   2.010 -11.824
    4    HB3  GLN  55           HB3      GLN  55  -6.669   2.979 -10.978
    5    HG2  GLN  55           HG2      GLN  55  -7.355   1.219  -9.662
    6    HG3  GLN  55           HG3      GLN  55  -7.149   0.037 -10.949
    7   HE21  GLN  55          HE21      GLN  55  -5.529  -1.424 -10.477
    8   HE22  GLN  55          HE22      GLN  55  -4.134  -1.085  -9.577

  No H/Q in entry =           8
  In of MODEL   83
    1    H    THR  56           H        THR  56  -9.345   3.298 -11.684
    2    HA   THR  56           HA       THR  56 -10.927   1.417 -10.389
    3    HB   THR  56           HB       THR  56 -12.023   3.819 -11.872
    4    HG1  THR  56           HG1      THR  56 -10.131   3.771 -10.066
    5   HG23  THR  56          HG21      THR  56 -13.780   2.485 -10.963
    6   HG22  THR  56          HG22      THR  56 -13.543   3.812  -9.824
    7   HG21  THR  56          HG23      THR  56 -12.891   2.213  -9.465

  No H/Q in entry =           7
  In of MODEL   83
    1    H    LYS  57           H        LYS  57 -11.155   2.519 -13.767
    2    HA   LYS  57           HA       LYS  57 -13.329   0.848 -14.509
    3    HB2  LYS  57           HB2      LYS  57 -12.455   2.801 -15.825
    4    HB3  LYS  57           HB3      LYS  57 -11.024   1.855 -16.210
    5    HG2  LYS  57           HG2      LYS  57 -12.414   0.182 -17.353
    6    HG3  LYS  57           HG3      LYS  57 -13.864   1.095 -16.950
    7    HD2  LYS  57           HD2      LYS  57 -13.005   3.018 -18.261
    8    HD3  LYS  57           HD3      LYS  57 -11.578   2.078 -18.693
    9    HE2  LYS  57           HE2      LYS  57 -13.008   0.401 -19.811
   10    HE3  LYS  57           HE3      LYS  57 -14.450   1.317 -19.375
   11    HZ1  LYS  57           HZ1      LYS  57 -13.287   3.235 -20.574
   12    HZ3  LYS  57           HZ2      LYS  57 -13.990   2.006 -21.515
   13    HZ2  LYS  57           HZ3      LYS  57 -12.307   2.037 -21.267

  No H/Q in entry =          13
  In of MODEL   83
    1    H    LEU  58           H        LEU  58  -9.827   0.396 -14.487
    2    HA   LEU  58           HA       LEU  58  -9.862  -2.115 -15.788
    3    HB2  LEU  58           HB2      LEU  58  -7.803  -0.844 -13.993
    4    HB3  LEU  58           HB3      LEU  58  -7.559  -2.362 -14.857
    5    HG   LEU  58           HG       LEU  58  -8.310   0.253 -16.201
    6   HD11  LEU  58          HD11      LEU  58  -5.665  -1.003 -15.541
    7   HD13  LEU  58          HD12      LEU  58  -6.149   0.691 -15.479
    8   HD12  LEU  58          HD13      LEU  58  -5.829  -0.075 -17.032
    9   HD22  LEU  58          HD21      LEU  58  -8.910  -1.298 -17.794
   10   HD21  LEU  58          HD22      LEU  58  -7.870  -2.555 -17.128
   11   HD23  LEU  58          HD23      LEU  58  -7.181  -1.281 -18.134

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  59           H        ILE  59 -10.647  -1.223 -12.525
    2    HA   ILE  59           HA       ILE  59 -10.303  -3.997 -11.594
    3    HB   ILE  59           HB       ILE  59  -9.839  -1.732 -10.190
    4   HG12  ILE  59          HG12      ILE  59 -11.185  -4.089  -8.857
    5   HG13  ILE  59          HG13      ILE  59  -9.554  -4.171  -9.474
    6   HG23  ILE  59          HG21      ILE  59 -11.655  -1.059  -8.844
    7   HG22  ILE  59          HG22      ILE  59 -12.596  -2.484  -9.223
    8   HG21  ILE  59          HG23      ILE  59 -12.381  -1.215 -10.427
    9   HD13  ILE  59          HD11      ILE  59  -9.396  -3.586  -7.157
   10   HD12  ILE  59          HD12      ILE  59 -10.592  -2.309  -7.344
   11   HD11  ILE  59          HD13      ILE  59  -8.998  -2.141  -8.081

  No H/Q in entry =          11
  In of MODEL   83
    1    H    GLU  60           H        GLU  60 -12.855  -1.663 -12.367
    2    HA   GLU  60           HA       GLU  60 -15.039  -3.172 -11.341
    3    HB2  GLU  60           HB2      GLU  60 -16.361  -1.541 -12.276
    4    HB3  GLU  60           HB3      GLU  60 -14.823  -0.686 -12.321
    5    HG2  GLU  60           HG2      GLU  60 -14.484  -1.610 -14.656
    6    HG3  GLU  60           HG3      GLU  60 -16.136  -2.188 -14.592

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLY  61           H        GLY  61 -13.395  -3.151 -14.471
    2    HA3  GLY  61           HA2      GLY  61 -15.128  -5.382 -15.356
    3    HA2  GLY  61           HA3      GLY  61 -14.287  -4.277 -16.436

  No H/Q in entry =           3
  In of MODEL   83
    1    H    ASP  62           H        ASP  62 -12.893  -5.744 -13.572
    2    HA   ASP  62           HA       ASP  62 -10.605  -6.658 -14.980
    3    HB2  ASP  62           HB2      ASP  62 -10.006  -7.677 -12.807
    4    HB3  ASP  62           HB3      ASP  62 -10.523  -6.004 -12.628

  No H/Q in entry =           4
  In of MODEL   83
    1    H    ALA  63           H        ALA  63 -13.582  -8.325 -13.938
    2    HA   ALA  63           HA       ALA  63 -12.569 -10.946 -14.772
    3    HB3  ALA  63           HB1      ALA  63 -15.336 -10.039 -13.889
    4    HB2  ALA  63           HB2      ALA  63 -14.108 -10.734 -12.832
    5    HB1  ALA  63           HB3      ALA  63 -14.832 -11.714 -14.108

  No H/Q in entry =           5
  In of MODEL   83
    1    H    GLY  64           H        GLY  64 -14.151 -12.239 -16.178
    2    HA3  GLY  64           HA2      GLY  64 -15.879 -11.844 -18.008
    3    HA2  GLY  64           HA3      GLY  64 -14.729 -10.649 -18.595

  No H/Q in entry =           3
  In of MODEL   83
    1    H    GLU  65           H        GLU  65 -12.429 -12.382 -17.772
    2    HA   GLU  65           HA       GLU  65 -12.074 -13.691 -20.249
    3    HB2  GLU  65           HB2      GLU  65 -10.533 -13.875 -17.664
    4    HB3  GLU  65           HB3      GLU  65 -10.028 -14.663 -19.159
    5    HG2  GLU  65           HG2      GLU  65  -9.970 -12.502 -20.310
    6    HG3  GLU  65           HG3      GLU  65 -10.542 -11.692 -18.853

  No H/Q in entry =           6
  In of MODEL   83
    1    H    GLY  66           H        GLY  66 -12.937 -14.865 -17.085
    2    HA3  GLY  66           HA2      GLY  66 -14.292 -17.160 -18.059
    3    HA2  GLY  66           HA3      GLY  66 -12.748 -17.605 -17.359

  No H/Q in entry =           3
  In of MODEL   83
    1    H    LYS  67           H        LYS  67 -12.537 -17.739 -15.207
    2    HA   LYS  67           HA       LYS  67 -14.969 -17.602 -13.628
    3    HB2  LYS  67           HB2      LYS  67 -13.722 -18.906 -11.991
    4    HB3  LYS  67           HB3      LYS  67 -13.558 -19.617 -13.602
    5    HG2  LYS  67           HG2      LYS  67 -11.407 -18.403 -13.892
    6    HG3  LYS  67           HG3      LYS  67 -11.559 -17.778 -12.251
    7    HD2  LYS  67           HD2      LYS  67 -11.518 -20.075 -11.364
    8    HD3  LYS  67           HD3      LYS  67 -11.386 -20.710 -13.006
    9    HE2  LYS  67           HE2      LYS  67  -9.261 -19.494 -13.314
   10    HE3  LYS  67           HE3      LYS  67  -9.394 -18.844 -11.680
   11    HZ2  LYS  67           HZ1      LYS  67  -8.250 -21.239 -12.434
   12    HZ1  LYS  67           HZ2      LYS  67  -9.700 -21.657 -11.655
   13    HZ3  LYS  67           HZ3      LYS  67  -8.547 -20.699 -10.855

  No H/Q in entry =          13
  In of MODEL   83
    1    H    MET  68           H        MET  68 -13.551 -17.462 -11.136
    2    HA   MET  68           HA       MET  68 -13.916 -14.767 -10.468
    3    HB2  MET  68           HB2      MET  68 -12.502 -17.020  -9.050
    4    HB3  MET  68           HB3      MET  68 -12.776 -15.436  -8.323
    5    HG2  MET  68           HG2      MET  68 -15.205 -15.692  -8.677
    6    HG3  MET  68           HG3      MET  68 -14.931 -17.276  -9.405
    7    HE2  MET  68           HE1      MET  68 -16.330 -18.816  -7.663
    8    HE1  MET  68           HE2      MET  68 -16.914 -17.162  -7.489
    9    HE3  MET  68           HE3      MET  68 -16.596 -18.132  -6.052

  No H/Q in entry =           9
  In of MODEL   83
    1    H    LYS  69           H        LYS  69 -11.277 -16.027 -12.154
    2    HA   LYS  69           HA       LYS  69  -9.160 -14.593 -10.929
    3    HB2  LYS  69           HB2      LYS  69  -9.098 -16.635 -12.525
    4    HB3  LYS  69           HB3      LYS  69  -9.083 -15.423 -13.808
    5    HG2  LYS  69           HG2      LYS  69  -7.176 -14.311 -12.429
    6    HG3  LYS  69           HG3      LYS  69  -7.056 -15.874 -11.623
    7    HD2  LYS  69           HD2      LYS  69  -6.443 -15.154 -14.462
    8    HD3  LYS  69           HD3      LYS  69  -5.560 -16.207 -13.356
    9    HE2  LYS  69           HE2      LYS  69  -7.617 -17.762 -13.490
   10    HE3  LYS  69           HE3      LYS  69  -8.082 -16.811 -14.899
   11    HZ3  LYS  69           HZ1      LYS  69  -6.286 -17.527 -16.095
   12    HZ2  LYS  69           HZ2      LYS  69  -6.600 -18.912 -15.164
   13    HZ1  LYS  69           HZ3      LYS  69  -5.344 -17.856 -14.723

  No H/Q in entry =          13
  In of MODEL   83
    1    H    VAL  70           H        VAL  70  -7.892 -12.821 -11.653
    2    HA   VAL  70           HA       VAL  70  -9.267 -10.910 -13.455
    3    HB   VAL  70           HB       VAL  70  -8.445  -9.106 -11.952
    4   HG13  VAL  70          HG11      VAL  70 -10.143  -9.446 -10.227
    5   HG12  VAL  70          HG12      VAL  70 -10.152 -11.181 -10.546
    6   HG11  VAL  70          HG13      VAL  70 -10.751 -10.057 -11.766
    7   HG21  VAL  70          HG21      VAL  70  -7.530 -11.491 -10.320
    8   HG23  VAL  70          HG22      VAL  70  -7.816  -9.915  -9.585
    9   HG22  VAL  70          HG23      VAL  70  -6.579 -10.096 -10.828

  No H/Q in entry =           9
  In of MODEL   83
    1    H    SER  71           H        SER  71  -7.747  -9.210 -14.248
    2    HA   SER  71           HA       SER  71  -5.510 -10.318 -15.563
    3    HB2  SER  71           HB2      SER  71  -6.735  -8.272 -16.313
    4    HB3  SER  71           HB3      SER  71  -6.043  -7.399 -14.948
    5    HG   SER  71           HG       SER  71  -4.614  -8.720 -17.021

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LEU  72           H        LEU  72  -3.483 -10.637 -14.932
    2    HA   LEU  72           HA       LEU  72  -2.737 -10.439 -12.226
    3    HB2  LEU  72           HB2      LEU  72  -1.110 -10.868 -14.727
    4    HB3  LEU  72           HB3      LEU  72  -0.432 -10.950 -13.104
    5    HG   LEU  72           HG       LEU  72  -2.798 -12.628 -14.002
    6   HD13  LEU  72          HD11      LEU  72  -1.217 -14.470 -14.270
    7   HD12  LEU  72          HD12      LEU  72   0.121 -13.425 -13.793
    8   HD11  LEU  72          HD13      LEU  72  -0.729 -13.131 -15.310
    9   HD23  LEU  72          HD21      LEU  72  -1.817 -14.042 -12.025
   10   HD22  LEU  72          HD22      LEU  72  -2.794 -12.636 -11.631
   11   HD21  LEU  72          HD23      LEU  72  -1.037 -12.536 -11.550

  No H/Q in entry =          11
  In of MODEL   83
    1    H    VAL  73           H        VAL  73  -2.034  -8.415 -15.005
    2    HA   VAL  73           HA       VAL  73  -0.092  -6.734 -13.912
    3    HB   VAL  73           HB       VAL  73  -0.490  -5.308 -15.760
    4   HG11  VAL  73          HG11      VAL  73   0.321  -7.638 -16.259
    5   HG13  VAL  73          HG12      VAL  73  -0.513  -6.871 -17.610
    6   HG12  VAL  73          HG13      VAL  73  -1.344  -8.081 -16.635
    7   HG22  VAL  73          HG21      VAL  73  -2.754  -4.762 -15.756
    8   HG21  VAL  73          HG22      VAL  73  -3.261  -6.440 -15.580
    9   HG23  VAL  73          HG23      VAL  73  -2.677  -5.855 -17.138

  No H/Q in entry =           9
  In of MODEL   83
    1    H    LEU  74           H        LEU  74  -3.484  -6.830 -13.323
    2    HA   LEU  74           HA       LEU  74  -4.079  -4.172 -12.694
    3    HB2  LEU  74           HB2      LEU  74  -5.820  -5.829 -12.859
    4    HB3  LEU  74           HB3      LEU  74  -5.124  -6.759 -11.536
    5    HG   LEU  74           HG       LEU  74  -5.559  -4.878  -9.987
    6   HD13  LEU  74          HD11      LEU  74  -5.457  -2.945 -11.358
    7   HD12  LEU  74          HD12      LEU  74  -7.163  -3.093 -10.941
    8   HD11  LEU  74          HD13      LEU  74  -6.594  -3.614 -12.528
    9   HD23  LEU  74          HD21      LEU  74  -8.136  -5.291 -11.409
   10   HD22  LEU  74          HD22      LEU  74  -7.735  -5.456  -9.713
   11   HD21  LEU  74          HD23      LEU  74  -7.277  -6.716 -10.832

  No H/Q in entry =          11
  In of MODEL   83
    1    H    VAL  75           H        VAL  75  -3.036  -6.775 -10.553
    2    HA   VAL  75           HA       VAL  75  -2.805  -5.235  -8.205
    3    HB   VAL  75           HB       VAL  75  -1.329  -7.736  -9.018
    4   HG12  VAL  75          HG11      VAL  75  -0.861  -7.902  -6.545
    5   HG11  VAL  75          HG12      VAL  75  -1.518  -6.283  -6.353
    6   HG13  VAL  75          HG13      VAL  75  -0.057  -6.527  -7.295
    7   HG22  VAL  75          HG21      VAL  75  -2.983  -8.789  -7.513
    8   HG21  VAL  75          HG22      VAL  75  -3.797  -7.925  -8.817
    9   HG23  VAL  75          HG23      VAL  75  -3.716  -7.215  -7.204

  No H/Q in entry =           9
  In of MODEL   83
    1    H    GLU  76           H        GLU  76  -0.425  -6.001 -10.766
    2    HA   GLU  76           HA       GLU  76   1.780  -4.673  -9.623
    3    HB2  GLU  76           HB2      GLU  76   1.970  -6.137 -11.608
    4    HB3  GLU  76           HB3      GLU  76   1.037  -4.988 -12.554
    5    HG2  GLU  76           HG2      GLU  76   3.364  -4.639 -13.085
    6    HG3  GLU  76           HG3      GLU  76   2.850  -3.268 -12.121

  No H/Q in entry =           6
  In of MODEL   83
    1    H    ALA  77           H        ALA  77  -0.764  -3.445 -11.783
    2    HA   ALA  77           HA       ALA  77   0.242  -0.805 -11.957
    3    HB3  ALA  77           HB1      ALA  77  -2.619  -1.784 -12.184
    4    HB1  ALA  77           HB2      ALA  77  -1.454  -1.691 -13.505
    5    HB2  ALA  77           HB3      ALA  77  -2.022  -0.214 -12.727

  No H/Q in entry =           5
  In of MODEL   83
    1    H    GLN  78           H        GLN  78  -2.016  -2.356  -9.732
    2    HA   GLN  78           HA       GLN  78  -2.795  -0.038  -8.314
    3    HB2  GLN  78           HB2      GLN  78  -3.921  -2.288  -8.227
    4    HB3  GLN  78           HB3      GLN  78  -2.577  -2.865  -7.245
    5    HG2  GLN  78           HG2      GLN  78  -3.060  -1.133  -5.564
    6    HG3  GLN  78           HG3      GLN  78  -4.406  -0.552  -6.543
    7   HE21  GLN  78          HE21      GLN  78  -4.852  -1.536  -3.893
    8   HE22  GLN  78          HE22      GLN  78  -5.722  -2.989  -4.002

  No H/Q in entry =           8
  In of MODEL   83
    1    H    LEU  79           H        LEU  79  -0.127  -2.312  -7.898
    2    HA   LEU  79           HA       LEU  79   0.877  -1.431  -5.446
    3    HB2  LEU  79           HB2      LEU  79   1.725  -3.441  -6.530
    4    HB3  LEU  79           HB3      LEU  79   2.365  -2.487  -7.865
    5    HG   LEU  79           HG       LEU  79   3.941  -1.364  -6.370
    6   HD13  LEU  79          HD11      LEU  79   2.956  -1.121  -4.293
    7   HD12  LEU  79          HD12      LEU  79   4.030  -2.479  -3.965
    8   HD11  LEU  79          HD13      LEU  79   2.320  -2.767  -4.280
    9   HD23  LEU  79          HD21      LEU  79   5.147  -3.522  -5.487
   10   HD22  LEU  79          HD22      LEU  79   4.929  -3.315  -7.222
   11   HD21  LEU  79          HD23      LEU  79   3.853  -4.382  -6.325

  No H/Q in entry =          11
  In of MODEL   83
    1    H    HIS  80           H        HIS  80   1.724  -0.306  -8.721
    2    HA   HIS  80           HA       HIS  80   3.551   1.668  -7.807
    3    HB2  HIS  80           HB2      HIS  80   2.234   0.992 -10.381
    4    HB3  HIS  80           HB3      HIS  80   2.840   2.640 -10.209
    5    HD1  HIS  80           HD1      HIS  80   5.238   2.930 -10.751
    6    HD2  HIS  80           HD2      HIS  80   4.408  -0.982  -9.569
    7    HE1  HIS  80           HE1      HIS  80   7.420   1.642 -10.942
    8    HE2  HIS  80           HE2      HIS  80   6.925  -0.745 -10.225

  No H/Q in entry =           8
  In of MODEL   83
    1    H    LEU  81           H        LEU  81   0.139   1.850  -8.756
    2    HA   LEU  81           HA       LEU  81  -0.119   4.642  -8.411
    3    HB2  LEU  81           HB2      LEU  81  -2.144   2.406  -8.323
    4    HB3  LEU  81           HB3      LEU  81  -2.587   4.111  -8.220
    5    HG   LEU  81           HG       LEU  81  -0.920   2.963 -10.476
    6   HD12  LEU  81          HD11      LEU  81  -3.161   3.299 -11.754
    7   HD11  LEU  81          HD12      LEU  81  -3.903   3.227 -10.156
    8   HD13  LEU  81          HD13      LEU  81  -2.972   1.858 -10.757
    9   HD23  LEU  81          HD21      LEU  81  -2.016   5.117 -11.554
   10   HD22  LEU  81          HD22      LEU  81  -0.589   5.277 -10.533
   11   HD21  LEU  81          HD23      LEU  81  -2.187   5.630  -9.877

  No H/Q in entry =          11
  In of MODEL   83
    1    H    MET  82           H        MET  82  -0.771   1.949  -6.168
    2    HA   MET  82           HA       MET  82  -1.797   3.530  -4.064
    3    HB2  MET  82           HB2      MET  82  -0.436   0.838  -4.128
    4    HB3  MET  82           HB3      MET  82  -0.998   1.559  -2.622
    5    HG2  MET  82           HG2      MET  82  -2.755   1.084  -5.050
    6    HG3  MET  82           HG3      MET  82  -2.669   0.003  -3.660
    7    HE3  MET  82           HE1      MET  82  -4.360   1.648  -0.822
    8    HE2  MET  82           HE2      MET  82  -2.630   1.919  -1.021
    9    HE1  MET  82           HE3      MET  82  -3.329   0.367  -1.476

  No H/Q in entry =           9
  In of MODEL   83
    1    H    THR  83           H        THR  83   1.492   2.434  -4.788
    2    HA   THR  83           HA       THR  83   2.735   3.523  -2.493
    3    HB   THR  83           HB       THR  83   4.816   3.465  -3.986
    4    HG1  THR  83           HG1      THR  83   4.557   2.948  -6.010
    5   HG22  THR  83          HG21      THR  83   4.358   0.810  -4.325
    6   HG21  THR  83          HG22      THR  83   3.080   1.190  -3.172
    7   HG23  THR  83          HG23      THR  83   4.765   1.524  -2.766

  No H/Q in entry =           7
  In of MODEL   83
    1    H    SER  84           H        SER  84   2.341   4.818  -5.784
    2    HA   SER  84           HA       SER  84   3.695   7.251  -5.330
    3    HB2  SER  84           HB2      SER  84   1.603   6.436  -7.335
    4    HB3  SER  84           HB3      SER  84   2.289   8.060  -7.309
    5    HG   SER  84           HG       SER  84   3.648   5.581  -7.623

  No H/Q in entry =           5
  In of MODEL   83
    1    H    MET  85           H        MET  85   0.199   6.508  -5.131
    2    HA   MET  85           HA       MET  85  -0.646   9.120  -4.511
    3    HB2  MET  85           HB2      MET  85  -2.183   7.322  -5.175
    4    HB3  MET  85           HB3      MET  85  -1.883   6.505  -3.641
    5    HG2  MET  85           HG2      MET  85  -2.760   8.450  -2.415
    6    HG3  MET  85           HG3      MET  85  -3.021   9.300  -3.937
    7    HE2  MET  85           HE1      MET  85  -6.298   8.321  -5.152
    8    HE1  MET  85           HE2      MET  85  -4.690   8.851  -5.640
    9    HE3  MET  85           HE3      MET  85  -5.506   9.655  -4.304

  No H/Q in entry =           9
  In of MODEL   83
    1    H    LEU  86           H        LEU  86   0.281   6.443  -2.387
    2    HA   LEU  86           HA       LEU  86  -0.225   7.738   0.065
    3    HB2  LEU  86           HB2      LEU  86   0.223   5.266  -0.344
    4    HB3  LEU  86           HB3      LEU  86   1.932   5.688  -0.452
    5    HG   LEU  86           HG       LEU  86   1.633   6.840   1.824
    6   HD11  LEU  86          HD11      LEU  86  -1.069   6.090   1.373
    7   HD13  LEU  86          HD12      LEU  86  -0.387   6.827   2.821
    8   HD12  LEU  86          HD13      LEU  86  -0.488   5.072   2.695
    9   HD23  LEU  86          HD21      LEU  86   1.190   3.849   1.936
   10   HD22  LEU  86          HD22      LEU  86   2.207   4.849   2.972
   11   HD21  LEU  86          HD23      LEU  86   2.691   4.529   1.307

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ALA  87           H        ALA  87   2.738   7.436  -1.852
    2    HA   ALA  87           HA       ALA  87   4.466   8.829  -0.136
    3    HB3  ALA  87           HB1      ALA  87   4.532   7.829  -2.848
    4    HB2  ALA  87           HB2      ALA  87   5.878   8.147  -1.758
    5    HB1  ALA  87           HB3      ALA  87   5.261   9.435  -2.791

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ARG  88           H        ARG  88   2.501   9.989  -2.833
    2    HA   ARG  88           HA       ARG  88   3.293  12.674  -2.711
    3    HB2  ARG  88           HB2      ARG  88   2.015  11.537  -4.562
    4    HB3  ARG  88           HB3      ARG  88   0.568  11.685  -3.565
    5    HG2  ARG  88           HG2      ARG  88   1.603  14.258  -3.479
    6    HG3  ARG  88           HG3      ARG  88   2.010  13.749  -5.116
    7    HD2  ARG  88           HD2      ARG  88  -0.137  13.846  -5.794
    8    HD3  ARG  88           HD3      ARG  88  -0.716  12.990  -4.364
    9    HE   ARG  88           HE       ARG  88  -0.892  15.771  -4.767
   10   HH21  ARG  88          HH11      ARG  88  -1.395  17.095  -3.018
   11   HH22  ARG  88          HH12      ARG  88  -1.088  16.548  -1.406
   12   HH11  ARG  88          HH21      ARG  88   0.130  13.490  -2.413
   13   HH12  ARG  88          HH22      ARG  88  -0.242  14.501  -1.063

  No H/Q in entry =          13
  In of MODEL   83
    1    H    GLU  89           H        GLU  89   0.593  11.009  -1.054
    2    HA   GLU  89           HA       GLU  89  -0.488  13.322   0.172
    3    HB2  GLU  89           HB2      GLU  89  -1.622  11.090   0.084
    4    HB3  GLU  89           HB3      GLU  89  -0.490  10.522   1.312
    5    HG2  GLU  89           HG2      GLU  89  -1.284  12.218   2.887
    6    HG3  GLU  89           HG3      GLU  89  -2.343  12.902   1.657

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LEU  90           H        LEU  90   1.958  11.007   1.312
    2    HA   LEU  90           HA       LEU  90   2.346  12.237   3.845
    3    HB2  LEU  90           HB2      LEU  90   4.091  10.458   2.142
    4    HB3  LEU  90           HB3      LEU  90   4.529  10.964   3.780
    5    HG   LEU  90           HG       LEU  90   1.879   9.640   3.136
    6   HD12  LEU  90          HD11      LEU  90   3.013   7.581   4.124
    7   HD11  LEU  90          HD12      LEU  90   4.539   8.428   3.872
    8   HD13  LEU  90          HD13      LEU  90   3.511   8.034   2.493
    9   HD22  LEU  90          HD21      LEU  90   1.640  10.555   5.265
   10   HD21  LEU  90          HD22      LEU  90   3.361  10.433   5.631
   11   HD23  LEU  90          HD23      LEU  90   2.344   8.993   5.681

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  91           H        ILE  91   3.923  12.623   0.705
    2    HA   ILE  91           HA       ILE  91   5.921  14.435   1.535
    3    HB   ILE  91           HB       ILE  91   4.582  13.968  -1.135
    4   HG12  ILE  91          HG12      ILE  91   7.419  13.454  -0.189
    5   HG13  ILE  91          HG13      ILE  91   6.130  12.266  -0.021
    6   HG22  ILE  91          HG21      ILE  91   6.808  15.302  -1.837
    7   HG21  ILE  91          HG22      ILE  91   6.519  16.097  -0.289
    8   HG23  ILE  91          HG23      ILE  91   5.284  16.141  -1.547
    9   HD13  ILE  91          HD11      ILE  91   5.933  11.955  -2.328
   10   HD12  ILE  91          HD12      ILE  91   7.671  12.184  -2.129
   11   HD11  ILE  91          HD13      ILE  91   6.666  13.518  -2.700

  No H/Q in entry =          11
  In of MODEL   83
    1    H    THR  92           H        THR  92   2.554  14.899   0.560
    2    HA   THR  92           HA       THR  92   2.549  17.722   0.514
    3    HB   THR  92           HB       THR  92   0.373  15.741   1.224
    4    HG1  THR  92           HG1      THR  92   0.657  15.571  -0.865
    5   HG22  THR  92          HG21      THR  92  -1.018  17.918   0.525
    6   HG21  THR  92          HG22      THR  92   0.387  18.728   1.214
    7   HG23  THR  92          HG23      THR  92  -0.554  17.610   2.198

  No H/Q in entry =           7
  In of MODEL   83
    1    H    GLU  93           H        GLU  93   2.007  15.413   3.162
    2    HA   GLU  93           HA       GLU  93   1.509  17.311   5.194
    3    HB2  GLU  93           HB2      GLU  93   2.802  14.575   5.405
    4    HB3  GLU  93           HB3      GLU  93   2.131  15.501   6.748
    5    HG2  GLU  93           HG2      GLU  93   0.490  14.748   4.321
    6    HG3  GLU  93           HG3      GLU  93   0.597  13.717   5.743

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LEU  94           H        LEU  94   4.493  15.811   4.010
    2    HA   LEU  94           HA       LEU  94   6.270  16.935   5.887
    3    HB2  LEU  94           HB2      LEU  94   6.638  15.979   3.048
    4    HB3  LEU  94           HB3      LEU  94   7.981  16.621   3.988
    5    HG   LEU  94           HG       LEU  94   6.234  14.433   5.128
    6   HD11  LEU  94          HD11      LEU  94   8.308  14.201   2.977
    7   HD13  LEU  94          HD12      LEU  94   6.857  13.238   3.247
    8   HD12  LEU  94          HD13      LEU  94   8.290  12.968   4.239
    9   HD23  LEU  94          HD21      LEU  94   8.430  13.873   6.258
   10   HD22  LEU  94          HD22      LEU  94   7.780  15.455   6.688
   11   HD21  LEU  94          HD23      LEU  94   9.107  15.329   5.533

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  95           H        ILE  95   5.111  18.131   2.754
    2    HA   ILE  95           HA       ILE  95   6.702  20.476   2.691
    3    HB   ILE  95           HB       ILE  95   4.040  19.820   1.407
    4   HG12  ILE  95          HG12      ILE  95   6.821  20.141   0.246
    5   HG13  ILE  95          HG13      ILE  95   6.164  18.590   0.759
    6   HG21  ILE  95          HG21      ILE  95   5.808  22.275   1.183
    7   HG23  ILE  95          HG22      ILE  95   4.085  22.219   1.555
    8   HG22  ILE  95          HG23      ILE  95   4.650  21.822  -0.069
    9   HD13  ILE  95          HD11      ILE  95   4.588  18.536  -0.956
   10   HD12  ILE  95          HD12      ILE  95   5.936  19.347  -1.752
   11   HD11  ILE  95          HD13      ILE  95   4.577  20.290  -1.142

  No H/Q in entry =          11
  In of MODEL   83
    1    H    GLU  96           H        GLU  96   3.460  19.844   4.013
    2    HA   GLU  96           HA       GLU  96   2.868  22.492   4.783
    3    HB2  GLU  96           HB2      GLU  96   1.179  20.723   4.802
    4    HB3  GLU  96           HB3      GLU  96   2.046  19.882   6.085
    5    HG2  GLU  96           HG2      GLU  96   1.050  21.166   7.670
    6    HG3  GLU  96           HG3      GLU  96   1.591  22.639   6.875

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LEU  97           H        LEU  97   4.704  19.918   6.379
    2    HA   LEU  97           HA       LEU  97   5.096  21.251   8.853
    3    HB2  LEU  97           HB2      LEU  97   6.602  19.077   7.414
    4    HB3  LEU  97           HB3      LEU  97   7.211  19.749   8.924
    5    HG   LEU  97           HG       LEU  97   4.390  18.681   8.633
    6   HD12  LEU  97          HD11      LEU  97   5.324  16.654   9.827
    7   HD11  LEU  97          HD12      LEU  97   6.937  17.273   9.472
    8   HD13  LEU  97          HD13      LEU  97   5.851  16.831   8.153
    9   HD23  LEU  97          HD21      LEU  97   4.863  18.370  11.192
   10   HD22  LEU  97          HD22      LEU  97   4.491  19.987  10.599
   11   HD21  LEU  97          HD23      LEU  97   6.162  19.532  10.926

  No H/Q in entry =          11
  In of MODEL   83
    1    H    HIS  98           H        HIS  98   6.939  21.267   5.810
    2    HA   HIS  98           HA       HIS  98   9.114  22.823   6.697
    3    HB2  HIS  98           HB2      HIS  98   7.794  22.593   3.982
    4    HB3  HIS  98           HB3      HIS  98   9.245  23.557   4.264
    5    HD1  HIS  98           HD1      HIS  98   8.003  19.997   4.278
    6    HD2  HIS  98           HD2      HIS  98  11.606  22.060   4.680
    7    HE1  HIS  98           HE1      HIS  98   9.842  18.252   4.195
    8    HE2  HIS  98           HE2      HIS  98  12.040  19.488   4.440

  No H/Q in entry =           8
  In of MODEL   83
    1    H    GLU  99           H        GLU  99   5.890  23.692   5.556
    2    HA   GLU  99           HA       GLU  99   6.293  26.504   5.509
    3    HB2  GLU  99           HB2      GLU  99   4.394  25.357   4.389
    4    HB3  GLU  99           HB3      GLU  99   3.709  24.994   5.973
    5    HG2  GLU  99           HG2      GLU  99   3.555  27.384   6.488
    6    HG3  GLU  99           HG3      GLU  99   4.320  27.785   4.953

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LYS 100           H        LYS 100   5.166  24.266   8.029
    2    HA   LYS 100           HA       LYS 100   4.615  26.315   9.939
    3    HB2  LYS 100           HB2      LYS 100   5.167  23.357  10.265
    4    HB3  LYS 100           HB3      LYS 100   4.741  24.427  11.606
    5    HG2  LYS 100           HG2      LYS 100   2.670  25.090  10.380
    6    HG3  LYS 100           HG3      LYS 100   3.075  23.923   9.118
    7    HD2  LYS 100           HD2      LYS 100   2.996  22.095  10.771
    8    HD3  LYS 100           HD3      LYS 100   2.608  23.255  12.044
    9    HE2  LYS 100           HE2      LYS 100   0.549  23.901  10.803
   10    HE3  LYS 100           HE3      LYS 100   0.927  22.684   9.578
   11    HZ1  LYS 100           HZ1      LYS 100   0.681  22.005  12.457
   12    HZ3  LYS 100           HZ2      LYS 100   0.644  20.958  11.117
   13    HZ2  LYS 100           HZ3      LYS 100  -0.659  22.008  11.415

  No H/Q in entry =          13
  In of MODEL   83
    1    H    LEU 101           H        LEU 101   7.514  24.498   9.069
    2    HA   LEU 101           HA       LEU 101   9.140  25.311  11.262
    3    HB2  LEU 101           HB2      LEU 101   9.700  24.334   8.474
    4    HB3  LEU 101           HB3      LEU 101  11.017  24.982   9.447
    5    HG   LEU 101           HG       LEU 101   9.175  22.837  10.516
    6   HD12  LEU 101          HD11      LEU 101  11.210  21.326   9.882
    7   HD11  LEU 101          HD12      LEU 101  11.578  22.592   8.712
    8   HD13  LEU 101          HD13      LEU 101  10.040  21.734   8.628
    9   HD21  LEU 101          HD21      LEU 101  11.916  23.916  11.225
   10   HD23  LEU 101          HD22      LEU 101  11.363  22.346  11.801
   11   HD22  LEU 101          HD23      LEU 101  10.489  23.808  12.255

  No H/Q in entry =          11
  In of MODEL   83
    1    H    LYS 102           H        LYS 102   7.555  27.201   9.146
    2    HA   LYS 102           HA       LYS 102   7.652  29.494   8.865
    3    HB2  LYS 102           HB2      LYS 102   9.234  29.354  10.948
    4    HB3  LYS 102           HB3      LYS 102  10.525  29.542   9.778
    5    HG2  LYS 102           HG2      LYS 102   8.446  31.510  10.669
    6    HG3  LYS 102           HG3      LYS 102  10.159  31.755  10.403
    7    HD2  LYS 102           HD2      LYS 102   8.183  31.362   8.119
    8    HD3  LYS 102           HD3      LYS 102   8.587  32.935   8.792
    9    HE2  LYS 102           HE2      LYS 102   9.929  31.748   6.700
   10    HE3  LYS 102           HE3      LYS 102  10.568  33.043   7.712
   11    HZ2  LYS 102           HZ1      LYS 102  12.068  31.125   7.513
   12    HZ1  LYS 102           HZ2      LYS 102  10.903  30.150   8.261
   13    HZ3  LYS 102           HZ3      LYS 102  11.616  31.426   9.120

  No H/Q in entry =          13
  In of MODEL   83
    1    H    ALA 103           H        ALA 103  10.890  28.127   8.264
    2    HA   ALA 103           HA       ALA 103  11.849  29.505   6.186
    3    HB2  ALA 103           HB1      ALA 103  12.704  27.287   5.239
    4    HB1  ALA 103           HB2      ALA 103  11.813  26.515   6.549
    5    HB3  ALA 103           HB3      ALA 103  13.117  27.645   6.916

  No H/Q in entry =           5
  In of MODEL   83
    1    H1   LYS   3           H1       LYS   3 -31.137   5.291 -20.280
    2    H2   LYS   3           H3       LYS   3 -30.116   4.978 -21.600
    3    H3   LYS   3           H2       LYS   3 -31.491   4.017 -21.345
    4    HA   LYS   3           HA       LYS   3 -30.483   2.705 -19.873
    5    HB2  LYS   3           HB2      LYS   3 -28.211   4.125 -21.213
    6    HB3  LYS   3           HB3      LYS   3 -27.881   2.971 -19.920
    7    HG2  LYS   3           HG2      LYS   3 -29.237   1.302 -21.239
    8    HG3  LYS   3           HG3      LYS   3 -29.196   2.456 -22.571
    9    HD2  LYS   3           HD2      LYS   3 -26.713   2.405 -22.470
   10    HD3  LYS   3           HD3      LYS   3 -26.823   1.149 -21.239
   11    HE2  LYS   3           HE2      LYS   3 -28.259  -0.126 -22.939
   12    HE3  LYS   3           HE3      LYS   3 -27.646   1.025 -24.126
   13    HZ3  LYS   3           HZ1      LYS   3 -25.813  -0.166 -24.317
   14    HZ2  LYS   3           HZ2      LYS   3 -26.435  -1.311 -23.227
   15    HZ1  LYS   3           HZ3      LYS   3 -25.487  -0.023 -22.657

  No H/Q in entry =          15
  In of MODEL   83
    1    H    LYS   4           H        LYS   4 -30.573   2.636 -17.810
    2    HA   LYS   4           HA       LYS   4 -29.929   4.998 -16.230
    3    HB2  LYS   4           HB2      LYS   4 -31.079   2.304 -15.455
    4    HB3  LYS   4           HB3      LYS   4 -30.912   3.687 -14.375
    5    HG2  LYS   4           HG2      LYS   4 -32.671   3.494 -16.825
    6    HG3  LYS   4           HG3      LYS   4 -33.195   3.594 -15.146
    7    HD2  LYS   4           HD2      LYS   4 -32.556   5.840 -14.948
    8    HD3  LYS   4           HD3      LYS   4 -31.488   5.755 -16.348
    9    HE2  LYS   4           HE2      LYS   4 -33.435   7.065 -16.896
   10    HE3  LYS   4           HE3      LYS   4 -33.463   5.557 -17.811
   11    HZ3  LYS   4           HZ1      LYS   4 -35.047   4.665 -16.261
   12    HZ2  LYS   4           HZ2      LYS   4 -35.624   6.124 -16.910
   13    HZ1  LYS   4           HZ3      LYS   4 -34.996   6.085 -15.332

  No H/Q in entry =          13
  In of MODEL   83
    1    H    HIS   5           H        HIS   5 -28.494   5.175 -14.616
    2    HA   HIS   5           HA       HIS   5 -26.165   3.388 -14.837
    3    HB2  HIS   5           HB2      HIS   5 -26.505   6.178 -13.737
    4    HB3  HIS   5           HB3      HIS   5 -25.002   5.259 -13.658
    5    HD1  HIS   5           HD1      HIS   5 -23.528   6.434 -15.263
    6    HD2  HIS   5           HD2      HIS   5 -27.284   5.671 -16.863
    7    HE1  HIS   5           HE1      HIS   5 -23.326   6.929 -17.730
    8    HE2  HIS   5           HE2      HIS   5 -25.617   6.453 -18.673

  No H/Q in entry =           8
  In of MODEL   83
    1    H    ILE   6           H        ILE   6 -25.927   1.870 -13.460
    2    HA   ILE   6           HA       ILE   6 -26.962   2.215 -10.726
    3    HB   ILE   6           HB       ILE   6 -26.054  -0.286 -12.157
    4   HG12  ILE   6          HG12      ILE   6 -28.832   0.619 -11.392
    5   HG13  ILE   6          HG13      ILE   6 -28.162   0.735 -13.019
    6   HG23  ILE   6          HG21      ILE   6 -26.435  -1.479 -10.260
    7   HG22  ILE   6          HG22      ILE   6 -27.630  -0.335  -9.644
    8   HG21  ILE   6          HG23      ILE   6 -25.910   0.042  -9.536
    9   HD13  ILE   6          HD11      ILE   6 -28.566  -1.409 -13.450
   10   HD12  ILE   6          HD12      ILE   6 -29.609  -1.363 -12.029
   11   HD11  ILE   6          HD13      ILE   6 -27.945  -1.930 -11.883

  No H/Q in entry =          11
  In of MODEL   83
    1    H    TYR   7           H        TYR   7 -25.241   2.940  -9.432
    2    HA   TYR   7           HA       TYR   7 -22.498   2.019 -10.025
    3    HB2  TYR   7           HB2      TYR   7 -23.541   4.484  -8.652
    4    HB3  TYR   7           HB3      TYR   7 -21.846   4.004  -8.640
    5    HD1  TYR   7           HD1      TYR   7 -22.805   2.929 -11.713
    6    HD2  TYR   7           HD2      TYR   7 -22.254   6.592  -9.607
    7    HE1  TYR   7           HE1      TYR   7 -22.359   4.091 -13.840
    8    HE2  TYR   7           HE2      TYR   7 -21.850   7.760 -11.725
    9    HH   TYR   7           HH       TYR   7 -22.023   7.588 -13.956

  No H/Q in entry =           9
  In of MODEL   83
    1    H    LEU   8           H        LEU   8 -21.530   0.737  -8.630
    2    HA   LEU   8           HA       LEU   8 -22.702   0.315  -5.952
    3    HB2  LEU   8           HB2      LEU   8 -20.930  -1.376  -7.691
    4    HB3  LEU   8           HB3      LEU   8 -21.141  -1.699  -5.971
    5    HG   LEU   8           HG       LEU   8 -23.607  -1.940  -6.433
    6   HD13  LEU   8          HD11      LEU   8 -23.722  -0.804  -8.588
    7   HD12  LEU   8          HD12      LEU   8 -24.213  -2.487  -8.777
    8   HD11  LEU   8          HD13      LEU   8 -22.605  -1.974  -9.290
    9   HD23  LEU   8          HD21      LEU   8 -22.258  -4.014  -8.027
   10   HD22  LEU   8          HD22      LEU   8 -23.368  -4.155  -6.664
   11   HD21  LEU   8          HD23      LEU   8 -21.674  -3.755  -6.384

  No H/Q in entry =          11
  In of MODEL   83
    1    H    PHE   9           H        PHE   9 -21.475   0.806  -4.154
    2    HA   PHE   9           HA       PHE   9 -18.700   1.781  -4.648
    3    HB2  PHE   9           HB2      PHE   9 -20.786   2.880  -2.772
    4    HB3  PHE   9           HB3      PHE   9 -19.085   3.319  -2.704
    5    HD1  PHE   9           HD1      PHE   9 -18.037   4.597  -4.502
    6    HD2  PHE   9           HD2      PHE   9 -22.215   3.628  -4.613
    7    HE1  PHE   9           HE1      PHE   9 -18.370   6.238  -6.327
    8    HE2  PHE   9           HE2      PHE   9 -22.549   5.282  -6.433
    9    HZ   PHE   9           HZ       PHE   9 -20.624   6.583  -7.296

  No H/Q in entry =           9
  In of MODEL   83
    1    H    SER  10           H        SER  10 -17.108   0.895  -3.475
    2    HA   SER  10           HA       SER  10 -17.354   0.092  -0.757
    3    HB2  SER  10           HB2      SER  10 -17.298  -2.248  -0.909
    4    HB3  SER  10           HB3      SER  10 -18.500  -1.791  -2.106
    5    HG   SER  10           HG       SER  10 -15.766  -2.395  -2.542

  No H/Q in entry =           5
  In of MODEL   83
    1    H    SER  11           H        SER  11 -15.352   0.237   0.118
    2    HA   SER  11           HA       SER  11 -13.155   1.082  -1.412
    3    HB2  SER  11           HB2      SER  11 -11.985   1.200   0.595
    4    HB3  SER  11           HB3      SER  11 -13.667   1.363   1.106
    5    HG   SER  11           HG       SER  11 -13.211  -1.199   1.014

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ALA  12           H        ALA  12 -14.285  -1.628  -2.153
    2    HA   ALA  12           HA       ALA  12 -11.693  -2.886  -2.575
    3    HB3  ALA  12           HB1      ALA  12 -12.274  -4.016  -0.557
    4    HB2  ALA  12           HB2      ALA  12 -12.609  -5.141  -1.872
    5    HB1  ALA  12           HB3      ALA  12 -13.934  -4.272  -1.100

  No H/Q in entry =           5
  In of MODEL   83
    1    H    GLY  13           H        GLY  13 -12.482  -1.905  -4.648
    2    HA3  GLY  13           HA2      GLY  13 -14.671  -2.720  -6.129
    3    HA2  GLY  13           HA3      GLY  13 -13.124  -2.243  -6.843

  No H/Q in entry =           3
  In of MODEL   83
    1    H    MET  14           H        MET  14 -11.605  -4.487  -5.732
    2    HA   MET  14           HA       MET  14 -11.898  -6.308  -7.824
    3    HB2  MET  14           HB2      MET  14  -9.853  -6.269  -6.481
    4    HB3  MET  14           HB3      MET  14 -10.717  -6.930  -5.094
    5    HG2  MET  14           HG2      MET  14 -11.215  -8.978  -6.404
    6    HG3  MET  14           HG3      MET  14 -10.333  -8.307  -7.777
    7    HE1  MET  14           HE1      MET  14  -8.131  -7.737  -7.939
    8    HE3  MET  14           HE2      MET  14  -6.762  -8.304  -6.987
    9    HE2  MET  14           HE3      MET  14  -7.675  -6.898  -6.448

  No H/Q in entry =           9
  In of MODEL   83
    1    H    SER  15           H        SER  15 -13.188  -6.684  -4.523
    2    HA   SER  15           HA       SER  15 -14.453  -9.197  -5.181
    3    HB2  SER  15           HB2      SER  15 -14.871  -7.373  -2.800
    4    HB3  SER  15           HB3      SER  15 -15.739  -8.886  -3.042
    5    HG   SER  15           HG       SER  15 -13.132  -8.436  -2.275

  No H/Q in entry =           5
  In of MODEL   83
    1    H    THR  16           H        THR  16 -15.588  -5.826  -4.938
    2    HA   THR  16           HA       THR  16 -18.362  -6.386  -5.499
    3    HB   THR  16           HB       THR  16 -16.825  -3.826  -6.064
    4    HG1  THR  16           HG1      THR  16 -18.086  -3.637  -3.794
    5   HG23  THR  16          HG21      THR  16 -19.098  -3.910  -6.980
    6   HG22  THR  16          HG22      THR  16 -19.039  -2.795  -5.603
    7   HG21  THR  16          HG23      THR  16 -19.721  -4.416  -5.415

  No H/Q in entry =           7
  In of MODEL   83
    1    H    SER  17           H        SER  17 -15.496  -5.844  -7.317
    2    HA   SER  17           HA       SER  17 -16.588  -5.221  -9.866
    3    HB2  SER  17           HB2      SER  17 -13.945  -6.439  -9.048
    4    HB3  SER  17           HB3      SER  17 -14.359  -6.112 -10.731
    5    HG   SER  17           HG       SER  17 -14.867  -3.982  -9.141

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LEU  18           H        LEU  18 -15.981  -8.297  -8.292
    2    HA   LEU  18           HA       LEU  18 -16.486  -9.895 -10.601
    3    HB2  LEU  18           HB2      LEU  18 -15.289 -10.706  -8.579
    4    HB3  LEU  18           HB3      LEU  18 -16.803 -10.604  -7.680
    5    HG   LEU  18           HG       LEU  18 -17.784 -12.209  -9.372
    6   HD13  LEU  18          HD11      LEU  18 -16.299 -12.053 -11.207
    7   HD12  LEU  18          HD12      LEU  18 -15.955 -13.626 -10.487
    8   HD11  LEU  18          HD13      LEU  18 -14.881 -12.262 -10.182
    9   HD21  LEU  18          HD21      LEU  18 -17.036 -12.810  -7.101
   10   HD23  LEU  18          HD22      LEU  18 -15.463 -13.243  -7.774
   11   HD22  LEU  18          HD23      LEU  18 -16.907 -14.128  -8.266

  No H/Q in entry =          11
  In of MODEL   83
    1    H    LEU  19           H        LEU  19 -18.536  -8.634  -7.976
    2    HA   LEU  19           HA       LEU  19 -20.955  -9.903  -8.813
    3    HB2  LEU  19           HB2      LEU  19 -20.739  -8.976  -6.587
    4    HB3  LEU  19           HB3      LEU  19 -20.500  -7.362  -7.256
    5    HG   LEU  19           HG       LEU  19 -22.857  -7.447  -8.095
    6   HD12  LEU  19          HD11      LEU  19 -23.007  -9.880  -6.306
    7   HD11  LEU  19          HD12      LEU  19 -23.115  -9.901  -8.065
    8   HD13  LEU  19          HD13      LEU  19 -24.364  -9.097  -7.116
    9   HD23  LEU  19          HD21      LEU  19 -23.823  -7.122  -5.799
   10   HD22  LEU  19          HD22      LEU  19 -22.373  -6.183  -6.156
   11   HD21  LEU  19          HD23      LEU  19 -22.261  -7.630  -5.155

  No H/Q in entry =          11
  In of MODEL   83
    1    H    VAL  20           H        VAL  20 -19.515  -6.737  -9.594
    2    HA   VAL  20           HA       VAL  20 -21.616  -5.801 -11.242
    3    HB   VAL  20           HB       VAL  20 -18.639  -5.146 -11.328
    4   HG11  VAL  20          HG11      VAL  20 -20.941  -4.055 -12.939
    5   HG13  VAL  20          HG12      VAL  20 -19.353  -4.577 -13.501
    6   HG12  VAL  20          HG13      VAL  20 -19.518  -3.071 -12.599
    7   HG21  VAL  20          HG21      VAL  20 -21.035  -3.870 -10.067
    8   HG23  VAL  20          HG22      VAL  20 -19.581  -2.942 -10.428
    9   HG22  VAL  20          HG23      VAL  20 -19.496  -4.320  -9.331

  No H/Q in entry =           9
  In of MODEL   83
    1    H    SER  21           H        SER  21 -18.794  -7.824 -12.138
    2    HA   SER  21           HA       SER  21 -19.524  -7.831 -14.906
    3    HB2  SER  21           HB2      SER  21 -18.039  -9.774 -15.138
    4    HB3  SER  21           HB3      SER  21 -17.257  -8.478 -14.237
    5    HG   SER  21           HG       SER  21 -17.198  -9.679 -12.534

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LYS  22           H        LYS  22 -20.593  -9.944 -12.277
    2    HA   LYS  22           HA       LYS  22 -22.059 -11.664 -14.068
    3    HB2  LYS  22           HB2      LYS  22 -21.821 -11.345 -11.137
    4    HB3  LYS  22           HB3      LYS  22 -23.351 -11.994 -11.724
    5    HG2  LYS  22           HG2      LYS  22 -21.737 -13.746 -11.083
    6    HG3  LYS  22           HG3      LYS  22 -22.226 -13.843 -12.774
    7    HD2  LYS  22           HD2      LYS  22 -19.964 -14.137 -12.992
    8    HD3  LYS  22           HD3      LYS  22 -20.067 -12.383 -13.148
    9    HE2  LYS  22           HE2      LYS  22 -18.529 -12.290 -11.520
   10    HE3  LYS  22           HE3      LYS  22 -19.826 -12.753 -10.419
   11    HZ1  LYS  22           HZ1      LYS  22 -18.236 -14.800 -11.817
   12    HZ3  LYS  22           HZ2      LYS  22 -19.125 -14.934 -10.375
   13    HZ2  LYS  22           HZ3      LYS  22 -17.658 -14.077 -10.392

  No H/Q in entry =          13
  In of MODEL   83
    1    H    MET  23           H        MET  23 -22.883  -8.692 -12.323
    2    HA   MET  23           HA       MET  23 -25.677  -8.850 -12.881
    3    HB2  MET  23           HB2      MET  23 -23.891  -6.483 -12.357
    4    HB3  MET  23           HB3      MET  23 -25.635  -6.359 -12.576
    5    HG2  MET  23           HG2      MET  23 -26.040  -7.597 -10.568
    6    HG3  MET  23           HG3      MET  23 -24.324  -7.967 -10.394
    7    HE2  MET  23           HE1      MET  23 -26.721  -4.325  -9.385
    8    HE1  MET  23           HE2      MET  23 -26.926  -5.351 -10.804
    9    HE3  MET  23           HE3      MET  23 -25.919  -3.905 -10.899

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ARG  24           H        ARG  24 -22.917  -7.429 -14.661
    2    HA   ARG  24           HA       ARG  24 -24.399  -6.233 -16.736
    3    HB2  ARG  24           HB2      ARG  24 -21.969  -5.780 -16.312
    4    HB3  ARG  24           HB3      ARG  24 -21.594  -7.384 -16.892
    5    HG2  ARG  24           HG2      ARG  24 -22.412  -6.798 -19.163
    6    HG3  ARG  24           HG3      ARG  24 -22.845  -5.172 -18.569
    7    HD2  ARG  24           HD2      ARG  24 -20.646  -5.024 -19.602
    8    HD3  ARG  24           HD3      ARG  24 -20.460  -4.888 -17.859
    9    HE   ARG  24           HE       ARG  24 -20.033  -7.500 -18.249
   10   HH21  ARG  24          HH11      ARG  24 -17.980  -7.861 -17.408
   11   HH22  ARG  24          HH12      ARG  24 -16.634  -6.965 -18.021
   12   HH11  ARG  24          HH21      ARG  24 -18.761  -4.794 -19.835
   13   HH12  ARG  24          HH22      ARG  24 -17.106  -5.159 -19.462

  No H/Q in entry =          13
  In of MODEL   83
    1    H    ALA  25           H        ALA  25 -23.217  -9.536 -16.317
    2    HA   ALA  25           HA       ALA  25 -23.774 -10.473 -18.935
    3    HB1  ALA  25           HB1      ALA  25 -23.054 -12.464 -18.152
    4    HB3  ALA  25           HB2      ALA  25 -24.140 -12.415 -16.764
    5    HB2  ALA  25           HB3      ALA  25 -22.603 -11.555 -16.710

  No H/Q in entry =           5
  In of MODEL   83
    1    H    GLN  26           H        GLN  26 -25.662 -10.441 -15.949
    2    HA   GLN  26           HA       GLN  26 -27.961 -11.725 -16.968
    3    HB2  GLN  26           HB2      GLN  26 -27.531  -9.885 -14.635
    4    HB3  GLN  26           HB3      GLN  26 -29.072 -10.650 -14.991
    5    HG2  GLN  26           HG2      GLN  26 -26.470 -12.038 -14.418
    6    HG3  GLN  26           HG3      GLN  26 -27.855 -11.923 -13.341
    7   HE21  GLN  26          HE21      GLN  26 -26.570 -14.107 -14.514
    8   HE22  GLN  26          HE22      GLN  26 -27.576 -15.202 -15.293

  No H/Q in entry =           8
  In of MODEL   83
    1    H    ALA  27           H        ALA  27 -27.100  -8.298 -16.680
    2    HA   ALA  27           HA       ALA  27 -29.593  -7.284 -17.552
    3    HB1  ALA  27           HB1      ALA  27 -27.832  -5.895 -16.448
    4    HB3  ALA  27           HB2      ALA  27 -28.406  -5.192 -17.962
    5    HB2  ALA  27           HB3      ALA  27 -26.854  -6.028 -17.911

  No H/Q in entry =           5
  In of MODEL   83
    1    H    GLU  28           H        GLU  28 -26.831  -8.518 -19.321
    2    HA   GLU  28           HA       GLU  28 -27.733  -7.585 -21.895
    3    HB2  GLU  28           HB2      GLU  28 -25.355  -8.199 -21.199
    4    HB3  GLU  28           HB3      GLU  28 -25.864  -9.879 -21.353
    5    HG2  GLU  28           HG2      GLU  28 -24.692  -9.150 -23.324
    6    HG3  GLU  28           HG3      GLU  28 -26.375  -9.519 -23.695

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LYS  29           H        LYS  29 -27.875 -10.634 -20.133
    2    HA   LYS  29           HA       LYS  29 -29.108 -12.199 -22.110
    3    HB2  LYS  29           HB2      LYS  29 -28.082 -13.091 -20.052
    4    HB3  LYS  29           HB3      LYS  29 -29.387 -12.375 -19.109
    5    HG2  LYS  29           HG2      LYS  29 -31.000 -13.816 -20.162
    6    HG3  LYS  29           HG3      LYS  29 -29.765 -14.466 -21.238
    7    HD2  LYS  29           HD2      LYS  29 -28.637 -15.549 -19.442
    8    HD3  LYS  29           HD3      LYS  29 -29.586 -14.683 -18.236
    9    HE2  LYS  29           HE2      LYS  29 -30.286 -17.058 -18.531
   10    HE3  LYS  29           HE3      LYS  29 -31.581 -15.900 -18.842
   11    HZ1  LYS  29           HZ1      LYS  29 -30.963 -16.107 -21.251
   12    HZ3  LYS  29           HZ2      LYS  29 -31.671 -17.483 -20.552
   13    HZ2  LYS  29           HZ3      LYS  29 -29.996 -17.431 -20.817

  No H/Q in entry =          13
  In of MODEL   83
    1    H    TYR  30           H        TYR  30 -30.591 -10.036 -19.711
    2    HA   TYR  30           HA       TYR  30 -33.218 -10.580 -20.988
    3    HB2  TYR  30           HB2      TYR  30 -32.645  -9.320 -18.297
    4    HB3  TYR  30           HB3      TYR  30 -34.242  -9.632 -18.974
    5    HD1  TYR  30           HD1      TYR  30 -35.105 -11.947 -19.125
    6    HD2  TYR  30           HD2      TYR  30 -31.321 -11.091 -17.370
    7    HE1  TYR  30           HE1      TYR  30 -34.988 -14.244 -18.246
    8    HE2  TYR  30           HE2      TYR  30 -31.204 -13.374 -16.495
    9    HH   TYR  30           HH       TYR  30 -32.776 -15.803 -17.539

  No H/Q in entry =           9
  In of MODEL   83
    1    H    GLU  31           H        GLU  31 -31.074  -8.574 -21.814
    2    HA   GLU  31           HA       GLU  31 -31.025  -6.446 -22.710
    3    HB2  GLU  31           HB2      GLU  31 -33.895  -7.236 -23.256
    4    HB3  GLU  31           HB3      GLU  31 -33.065  -5.878 -24.015
    5    HG2  GLU  31           HG2      GLU  31 -31.541  -7.326 -25.126
    6    HG3  GLU  31           HG3      GLU  31 -32.097  -8.720 -24.200

  No H/Q in entry =           6
  In of MODEL   83
    1    H    VAL  32           H        VAL  32 -31.282  -6.254 -19.988
    2    HA   VAL  32           HA       VAL  32 -33.200  -4.158 -19.440
    3    HB   VAL  32           HB       VAL  32 -30.821  -5.048 -17.778
    4   HG12  VAL  32          HG11      VAL  32 -32.413  -4.191 -15.944
    5   HG11  VAL  32          HG12      VAL  32 -33.237  -3.348 -17.255
    6   HG13  VAL  32          HG13      VAL  32 -31.543  -2.998 -16.911
    7   HG21  VAL  32          HG21      VAL  32 -32.541  -6.827 -18.441
    8   HG23  VAL  32          HG22      VAL  32 -33.621  -5.981 -17.332
    9   HG22  VAL  32          HG23      VAL  32 -32.102  -6.654 -16.742

  No H/Q in entry =           9
  In of MODEL   83
    1    HA   PRO  33           HA       PRO  33 -30.193  -1.226 -21.153
    2    HB2  PRO  33           HB2      PRO  33 -31.752   0.966 -21.137
    3    HB3  PRO  33           HB3      PRO  33 -32.171  -0.382 -22.195
    4    HG2  PRO  33           HG2      PRO  33 -33.208   0.210 -19.422
    5    HG3  PRO  33           HG3      PRO  33 -34.136  -0.068 -20.894
    6    HD2  PRO  33           HD2      PRO  33 -33.674  -2.072 -19.149
    7    HD3  PRO  33           HD3      PRO  33 -33.695  -2.375 -20.887

  No H/Q in entry =           7
  In of MODEL   83
    1    H    VAL  34           H        VAL  34 -28.959  -1.677 -19.161
    2    HA   VAL  34           HA       VAL  34 -28.760   0.808 -17.593
    3    HB   VAL  34           HB       VAL  34 -28.189  -0.573 -15.595
    4   HG12  VAL  34          HG11      VAL  34 -30.589  -1.487 -15.306
    5   HG11  VAL  34          HG12      VAL  34 -30.888  -0.787 -16.895
    6   HG13  VAL  34          HG13      VAL  34 -30.385   0.247 -15.559
    7   HG21  VAL  34          HG21      VAL  34 -28.290  -2.670 -17.536
    8   HG23  VAL  34          HG22      VAL  34 -29.368  -3.007 -16.180
    9   HG22  VAL  34          HG23      VAL  34 -27.662  -2.674 -15.888

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ILE  35           H        ILE  35 -26.811   1.315 -16.730
    2    HA   ILE  35           HA       ILE  35 -24.454  -0.007 -17.900
    3    HB   ILE  35           HB       ILE  35 -24.931   2.900 -17.197
    4   HG12  ILE  35          HG12      ILE  35 -23.868   1.529 -19.675
    5   HG13  ILE  35          HG13      ILE  35 -25.517   2.122 -19.469
    6   HG21  ILE  35          HG21      ILE  35 -22.331   1.414 -17.402
    7   HG23  ILE  35          HG22      ILE  35 -22.836   2.624 -16.224
    8   HG22  ILE  35          HG23      ILE  35 -22.431   3.110 -17.870
    9   HD11  ILE  35          HD11      ILE  35 -24.175   4.366 -18.917
   10   HD13  ILE  35          HD12      ILE  35 -24.670   3.916 -20.549
   11   HD12  ILE  35          HD13      ILE  35 -23.021   3.599 -20.008

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ILE  36           H        ILE  36 -23.234  -0.947 -16.241
    2    HA   ILE  36           HA       ILE  36 -23.747  -0.245 -13.404
    3    HB   ILE  36           HB       ILE  36 -22.840  -2.965 -14.402
    4   HG12  ILE  36          HG12      ILE  36 -25.679  -2.196 -13.722
    5   HG13  ILE  36          HG13      ILE  36 -25.074  -2.220 -15.378
    6   HG23  ILE  36          HG21      ILE  36 -23.217  -3.729 -12.268
    7   HG22  ILE  36          HG22      ILE  36 -24.380  -2.457 -11.896
    8   HG21  ILE  36          HG23      ILE  36 -22.655  -2.089 -11.944
    9   HD13  ILE  36          HD11      ILE  36 -25.187  -4.443 -15.511
   10   HD12  ILE  36          HD12      ILE  36 -26.284  -4.296 -14.138
   11   HD11  ILE  36          HD13      ILE  36 -24.582  -4.671 -13.871

  No H/Q in entry =          11
  In of MODEL   83
    1    H    GLU  37           H        GLU  37 -22.003   0.460 -12.286
    2    HA   GLU  37           HA       GLU  37 -19.278  -0.306 -13.121
    3    HB2  GLU  37           HB2      GLU  37 -20.278   2.481 -12.574
    4    HB3  GLU  37           HB3      GLU  37 -18.569   2.042 -12.576
    5    HG2  GLU  37           HG2      GLU  37 -18.644   1.532 -14.909
    6    HG3  GLU  37           HG3      GLU  37 -20.391   1.769 -14.947

  No H/Q in entry =           6
  In of MODEL   83
    1    H    ALA  38           H        ALA  38 -17.821  -0.453 -11.402
    2    HA   ALA  38           HA       ALA  38 -18.913  -0.204  -8.660
    3    HB1  ALA  38           HB1      ALA  38 -17.128  -2.151  -9.984
    4    HB3  ALA  38           HB2      ALA  38 -18.201  -2.363  -8.600
    5    HB2  ALA  38           HB3      ALA  38 -16.608  -1.637  -8.378

  No H/Q in entry =           5
  In of MODEL   83
    1    H    PHE  39           H        PHE  39 -17.730   1.084  -7.205
    2    HA   PHE  39           HA       PHE  39 -15.215   2.312  -8.093
    3    HB2  PHE  39           HB2      PHE  39 -17.464   3.906  -6.866
    4    HB3  PHE  39           HB3      PHE  39 -15.915   4.514  -7.447
    5    HD1  PHE  39           HD1      PHE  39 -15.524   4.927  -9.756
    6    HD2  PHE  39           HD2      PHE  39 -19.201   3.221  -8.431
    7    HE1  PHE  39           HE1      PHE  39 -16.523   5.384 -11.978
    8    HE2  PHE  39           HE2      PHE  39 -20.208   3.664 -10.642
    9    HZ   PHE  39           HZ       PHE  39 -18.868   4.717 -12.431

  No H/Q in entry =           9
  In of MODEL   83
    1    HA   PRO  40           HA       PRO  40 -14.347   1.728  -3.765
    2    HB2  PRO  40           HB2      PRO  40 -12.639   3.800  -3.192
    3    HB3  PRO  40           HB3      PRO  40 -12.144   2.448  -4.210
    4    HG2  PRO  40           HG2      PRO  40 -13.224   5.132  -5.059
    5    HG3  PRO  40           HG3      PRO  40 -11.760   4.315  -5.608
    6    HD2  PRO  40           HD2      PRO  40 -13.950   4.112  -7.065
    7    HD3  PRO  40           HD3      PRO  40 -12.963   2.675  -6.801

  No H/Q in entry =           7
  In of MODEL   83
    1    H    GLU  41           H        GLU  41 -15.036   2.762  -1.683
    2    HA   GLU  41           HA       GLU  41 -17.320   4.409  -1.769
    3    HB2  GLU  41           HB2      GLU  41 -17.218   4.424   0.615
    4    HB3  GLU  41           HB3      GLU  41 -16.693   2.829   0.077
    5    HG2  GLU  41           HG2      GLU  41 -15.163   3.262   1.725
    6    HG3  GLU  41           HG3      GLU  41 -14.301   3.848   0.303

  No H/Q in entry =           6
  In of MODEL   83
    1    H    THR  42           H        THR  42 -14.011   5.406  -1.787
    2    HA   THR  42           HA       THR  42 -14.450   7.997  -0.672
    3    HB   THR  42           HB       THR  42 -12.286   8.586  -1.741
    4    HG1  THR  42           HG1      THR  42 -12.977   6.755  -3.438
    5   HG23  THR  42          HG21      THR  42 -10.969   7.215  -0.369
    6   HG22  THR  42          HG22      THR  42 -12.008   5.811  -0.619
    7   HG21  THR  42          HG23      THR  42 -12.553   7.138   0.405

  No H/Q in entry =           7
  In of MODEL   83
    1    H    LEU  43           H        LEU  43 -15.264   6.776  -3.750
    2    HA   LEU  43           HA       LEU  43 -15.564   9.506  -4.821
    3    HB2  LEU  43           HB2      LEU  43 -15.839   6.805  -6.130
    4    HB3  LEU  43           HB3      LEU  43 -16.063   8.354  -6.942
    5    HG   LEU  43           HG       LEU  43 -13.460   7.310  -5.852
    6   HD13  LEU  43          HD11      LEU  43 -12.843   6.835  -8.065
    7   HD12  LEU  43          HD12      LEU  43 -14.200   7.745  -8.730
    8   HD11  LEU  43          HD13      LEU  43 -14.484   6.202  -7.926
    9   HD21  LEU  43          HD21      LEU  43 -14.260   9.846  -7.271
   10   HD23  LEU  43          HD22      LEU  43 -12.598   9.255  -7.268
   11   HD22  LEU  43          HD23      LEU  43 -13.390   9.671  -5.748

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ALA  44           H        ALA  44 -17.503   7.697  -2.943
    2    HA   ALA  44           HA       ALA  44 -19.949   7.450  -4.308
    3    HB2  ALA  44           HB1      ALA  44 -19.826   6.410  -2.171
    4    HB3  ALA  44           HB2      ALA  44 -20.971   7.735  -1.969
    5    HB1  ALA  44           HB3      ALA  44 -19.315   7.904  -1.387

  No H/Q in entry =           5
  In of MODEL   83
    1    H    GLY  45           H        GLY  45 -18.628  10.335  -2.847
    2    HA3  GLY  45           HA2      GLY  45 -21.094  11.761  -3.307
    3    HA2  GLY  45           HA3      GLY  45 -19.577  12.443  -2.722

  No H/Q in entry =           3
  In of MODEL   83
    1    H    GLU  46           H        GLU  46 -17.976  11.467  -4.949
    2    HA   GLU  46           HA       GLU  46 -18.631  13.604  -6.806
    3    HB2  GLU  46           HB2      GLU  46 -16.385  11.586  -6.694
    4    HB3  GLU  46           HB3      GLU  46 -16.526  12.835  -7.931
    5    HG2  GLU  46           HG2      GLU  46 -16.308  14.563  -6.251
    6    HG3  GLU  46           HG3      GLU  46 -16.249  13.346  -4.976

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LYS  47           H        LYS  47 -18.417  10.076  -7.116
    2    HA   LYS  47           HA       LYS  47 -19.465  10.176  -9.818
    3    HB2  LYS  47           HB2      LYS  47 -18.859   7.870  -7.961
    4    HB3  LYS  47           HB3      LYS  47 -19.421   7.691  -9.624
    5    HG2  LYS  47           HG2      LYS  47 -16.907   9.163  -8.919
    6    HG3  LYS  47           HG3      LYS  47 -16.943   7.427  -9.225
    7    HD2  LYS  47           HD2      LYS  47 -17.963   7.868 -11.429
    8    HD3  LYS  47           HD3      LYS  47 -17.822   9.597 -11.122
    9    HE2  LYS  47           HE2      LYS  47 -15.394   9.367 -10.946
   10    HE3  LYS  47           HE3      LYS  47 -15.539   7.637 -11.259
   11    HZ3  LYS  47           HZ1      LYS  47 -15.642   8.014 -13.413
   12    HZ2  LYS  47           HZ2      LYS  47 -15.291   9.648 -13.113
   13    HZ1  LYS  47           HZ3      LYS  47 -16.906   9.134 -13.231

  No H/Q in entry =          13
  In of MODEL   83
    1    H    GLY  48           H        GLY  48 -20.834   9.495  -6.672
    2    HA3  GLY  48           HA2      GLY  48 -23.174   8.226  -7.418
    3    HA2  GLY  48           HA3      GLY  48 -23.002   9.274  -6.009

  No H/Q in entry =           3
  In of MODEL   83
    1    H    GLN  49           H        GLN  49 -22.446  11.655  -7.653
    2    HA   GLN  49           HA       GLN  49 -25.028  12.696  -7.886
    3    HB2  GLN  49           HB2      GLN  49 -22.479  13.576  -9.225
    4    HB3  GLN  49           HB3      GLN  49 -23.965  14.508  -9.204
    5    HG2  GLN  49           HG2      GLN  49 -23.856  14.619  -6.766
    6    HG3  GLN  49           HG3      GLN  49 -22.382  13.667  -6.786
    7   HE21  GLN  49          HE21      GLN  49 -22.345  15.941  -5.590
    8   HE22  GLN  49          HE22      GLN  49 -21.440  17.196  -6.263

  No H/Q in entry =           8
  In of MODEL   83
    1    H    ASN  50           H        ASN  50 -23.256  10.778 -10.172
    2    HA   ASN  50           HA       ASN  50 -25.116  11.531 -12.320
    3    HB2  ASN  50           HB2      ASN  50 -22.496  10.048 -12.449
    4    HB3  ASN  50           HB3      ASN  50 -23.528  10.401 -13.827
    5   HD21  ASN  50          HD21      ASN  50 -20.946  11.367 -12.196
    6   HD22  ASN  50          HD22      ASN  50 -20.745  12.995 -12.591

  No H/Q in entry =           6
  In of MODEL   83
    1    H    ALA  51           H        ALA  51 -25.091   9.255  -9.993
    2    HA   ALA  51           HA       ALA  51 -25.787   7.030 -11.759
    3    HB2  ALA  51           HB1      ALA  51 -25.207   5.754 -10.015
    4    HB3  ALA  51           HB2      ALA  51 -26.369   6.572  -8.973
    5    HB1  ALA  51           HB3      ALA  51 -24.743   7.225  -9.160

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ASP  52           H        ASP  52 -27.769   5.931 -11.621
    2    HA   ASP  52           HA       ASP  52 -30.006   7.733 -11.064
    3    HB2  ASP  52           HB2      ASP  52 -29.723   5.177 -12.640
    4    HB3  ASP  52           HB3      ASP  52 -31.292   5.887 -12.262

  No H/Q in entry =           4
  In of MODEL   83
    1    H    VAL  53           H        VAL  53 -28.359   4.921  -9.916
    2    HA   VAL  53           HA       VAL  53 -29.853   5.100  -7.434
    3    HB   VAL  53           HB       VAL  53 -31.188   3.383  -8.647
    4   HG11  VAL  53          HG11      VAL  53 -29.391   2.513 -10.104
    5   HG13  VAL  53          HG12      VAL  53 -30.211   1.229  -9.216
    6   HG12  VAL  53          HG13      VAL  53 -28.625   1.787  -8.692
    7   HG23  VAL  53          HG21      VAL  53 -30.355   1.486  -6.871
    8   HG22  VAL  53          HG22      VAL  53 -31.522   2.775  -6.573
    9   HG21  VAL  53          HG23      VAL  53 -29.828   3.001  -6.138

  No H/Q in entry =           9
  In of MODEL   83
    1    H    VAL  54           H        VAL  54 -28.564   4.755  -5.740
    2    HA   VAL  54           HA       VAL  54 -25.774   3.950  -6.267
    3    HB   VAL  54           HB       VAL  54 -26.930   5.779  -4.102
    4   HG11  VAL  54          HG11      VAL  54 -24.315   4.412  -4.293
    5   HG13  VAL  54          HG12      VAL  54 -25.112   5.123  -2.890
    6   HG12  VAL  54          HG13      VAL  54 -24.208   6.148  -4.005
    7   HG22  VAL  54          HG21      VAL  54 -26.089   7.574  -5.248
    8   HG21  VAL  54          HG22      VAL  54 -26.587   6.525  -6.575
    9   HG23  VAL  54          HG23      VAL  54 -24.891   6.605  -6.104

  No H/Q in entry =           9
  In of MODEL   83
    1    H    LEU  55           H        LEU  55 -25.152   2.066  -5.546
    2    HA   LEU  55           HA       LEU  55 -26.674   0.796  -3.356
    3    HB2  LEU  55           HB2      LEU  55 -25.046  -0.414  -5.578
    4    HB3  LEU  55           HB3      LEU  55 -25.811  -1.321  -4.272
    5    HG   LEU  55           HG       LEU  55 -27.239   0.159  -6.472
    6   HD13  LEU  55          HD11      LEU  55 -26.874  -1.727  -7.619
    7   HD12  LEU  55          HD12      LEU  55 -27.836  -2.581  -6.413
    8   HD11  LEU  55          HD13      LEU  55 -26.085  -2.471  -6.231
    9   HD23  LEU  55          HD21      LEU  55 -28.528  -1.750  -4.575
   10   HD22  LEU  55          HD22      LEU  55 -29.237  -0.414  -5.484
   11   HD21  LEU  55          HD23      LEU  55 -28.251  -0.087  -4.059

  No H/Q in entry =          11
  In of MODEL   83
    1    H    LEU  56           H        LEU  56 -25.547   0.292  -1.508
    2    HA   LEU  56           HA       LEU  56 -22.622   0.752  -1.514
    3    HB2  LEU  56           HB2      LEU  56 -24.468   0.584   0.855
    4    HB3  LEU  56           HB3      LEU  56 -22.769   1.050   0.862
    5    HG   LEU  56           HG       LEU  56 -25.085   2.642  -0.205
    6   HD11  LEU  56          HD11      LEU  56 -24.012   2.373   2.348
    7   HD13  LEU  56          HD12      LEU  56 -25.023   3.701   1.776
    8   HD12  LEU  56          HD13      LEU  56 -23.266   3.843   1.718
    9   HD23  LEU  56          HD21      LEU  56 -23.174   4.377  -0.420
   10   HD22  LEU  56          HD22      LEU  56 -23.505   3.226  -1.715
   11   HD21  LEU  56          HD23      LEU  56 -22.167   2.942  -0.605

  No H/Q in entry =          11
  In of MODEL   83
    1    H    GLY  57           H        GLY  57 -21.217  -0.827  -0.896
    2    HA3  GLY  57           HA2      GLY  57 -22.076  -3.538  -1.017
    3    HA2  GLY  57           HA3      GLY  57 -20.475  -2.992  -0.524

  No H/Q in entry =           3
  In of MODEL   83
    1    HA   PRO  58           HA       PRO  58 -23.336  -3.964   3.164
    2    HB2  PRO  58           HB2      PRO  58 -22.607  -6.530   3.875
    3    HB3  PRO  58           HB3      PRO  58 -23.979  -6.188   2.822
    4    HG2  PRO  58           HG2      PRO  58 -21.217  -7.035   2.120
    5    HG3  PRO  58           HG3      PRO  58 -22.758  -7.553   1.434
    6    HD2  PRO  58           HD2      PRO  58 -21.164  -5.742   0.180
    7    HD3  PRO  58           HD3      PRO  58 -22.923  -5.699   0.041

  No H/Q in entry =           7
  In of MODEL   83
    1    H    GLN  59           H        GLN  59 -19.944  -4.382   2.641
    2    HA   GLN  59           HA       GLN  59 -19.245  -4.286   5.415
    3    HB2  GLN  59           HB2      GLN  59 -17.627  -3.483   2.991
    4    HB3  GLN  59           HB3      GLN  59 -17.000  -3.625   4.621
    5    HG2  GLN  59           HG2      GLN  59 -18.188  -5.881   3.014
    6    HG3  GLN  59           HG3      GLN  59 -16.470  -5.565   3.196
    7   HE21  GLN  59          HE21      GLN  59 -18.631  -7.376   4.151
    8   HE22  GLN  59          HE22      GLN  59 -18.378  -8.023   5.662

  No H/Q in entry =           8
  In of MODEL   83
    1    H    ILE  60           H        ILE  60 -20.189  -1.835   3.100
    2    HA   ILE  60           HA       ILE  60 -19.421   0.210   5.092
    3    HB   ILE  60           HB       ILE  60 -19.665   1.869   3.196
    4   HG12  ILE  60          HG12      ILE  60 -19.350  -0.428   1.308
    5   HG13  ILE  60          HG13      ILE  60 -20.965   0.088   1.794
    6   HG21  ILE  60          HG21      ILE  60 -17.515   0.880   4.034
    7   HG23  ILE  60          HG22      ILE  60 -17.486   1.560   2.407
    8   HG22  ILE  60          HG23      ILE  60 -17.567  -0.187   2.630
    9   HD12  ILE  60          HD11      ILE  60 -18.927   1.531   0.143
   10   HD11  ILE  60          HD12      ILE  60 -20.085   2.466   1.088
   11   HD13  ILE  60          HD13      ILE  60 -20.658   1.333  -0.135

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ALA  61           H        ALA  61 -21.843  -1.426   5.168
    2    HA   ALA  61           HA       ALA  61 -24.094   0.171   4.608
    3    HB1  ALA  61           HB1      ALA  61 -25.304  -1.297   5.961
    4    HB2  ALA  61           HB2      ALA  61 -23.919  -1.621   7.004
    5    HB3  ALA  61           HB3      ALA  61 -23.968  -2.286   5.372

  No H/Q in entry =           5
  In of MODEL   83
    1    H    TYR  62           H        TYR  62 -21.942   0.206   7.451
    2    HA   TYR  62           HA       TYR  62 -23.566   1.885   9.031
    3    HB2  TYR  62           HB2      TYR  62 -21.563   2.395  10.291
    4    HB3  TYR  62           HB3      TYR  62 -21.571   0.681   9.881
    5    HD1  TYR  62           HD1      TYR  62 -19.900  -0.253   8.360
    6    HD2  TYR  62           HD2      TYR  62 -19.903   3.920   9.275
    7    HE1  TYR  62           HE1      TYR  62 -17.671  -0.031   7.331
    8    HE2  TYR  62           HE2      TYR  62 -17.660   4.138   8.248
    9    HH   TYR  62           HH       TYR  62 -15.712   2.553   7.810

  No H/Q in entry =           9
  In of MODEL   83
    1    H    MET  63           H        MET  63 -21.885   2.681   6.179
    2    HA   MET  63           HA       MET  63 -21.792   5.538   6.776
    3    HB2  MET  63           HB2      MET  63 -21.103   3.943   4.307
    4    HB3  MET  63           HB3      MET  63 -20.947   5.696   4.434
    5    HG2  MET  63           HG2      MET  63 -19.278   5.420   6.186
    6    HG3  MET  63           HG3      MET  63 -19.429   3.669   6.051
    7    HE3  MET  63           HE1      MET  63 -16.022   4.592   4.468
    8    HE2  MET  63           HE2      MET  63 -16.771   3.066   4.938
    9    HE1  MET  63           HE3      MET  63 -16.913   4.478   5.987

  No H/Q in entry =           9
  In of MODEL   83
    1    H    LEU  64           H        LEU  64 -24.296   3.596   5.828
    2    HA   LEU  64           HA       LEU  64 -25.493   4.915   3.677
    3    HB2  LEU  64           HB2      LEU  64 -26.336   2.824   4.652
    4    HB3  LEU  64           HB3      LEU  64 -26.840   3.708   6.092
    5    HG   LEU  64           HG       LEU  64 -28.536   4.883   4.788
    6   HD13  LEU  64          HD11      LEU  64 -28.213   5.052   2.554
    7   HD12  LEU  64          HD12      LEU  64 -28.821   3.399   2.454
    8   HD11  LEU  64          HD13      LEU  64 -27.086   3.697   2.536
    9   HD23  LEU  64          HD21      LEU  64 -28.980   2.036   4.129
   10   HD22  LEU  64          HD22      LEU  64 -30.010   3.179   4.990
   11   HD21  LEU  64          HD23      LEU  64 -28.635   2.442   5.811

  No H/Q in entry =          11
  In of MODEL   83
    1    HA   PRO  65           HA       PRO  65 -27.792   8.117   6.273
    2    HB2  PRO  65           HB2      PRO  65 -25.840   8.395   8.558
    3    HB3  PRO  65           HB3      PRO  65 -27.585   8.641   8.561
    4    HG2  PRO  65           HG2      PRO  65 -26.629   6.440   9.584
    5    HG3  PRO  65           HG3      PRO  65 -28.027   6.341   8.514
    6    HD2  PRO  65           HD2      PRO  65 -25.129   5.763   7.888
    7    HD3  PRO  65           HD3      PRO  65 -26.560   4.831   7.444

  No H/Q in entry =           7
  In of MODEL   83
    1    H    GLU  66           H        GLU  66 -24.237   8.137   6.417
    2    HA   GLU  66           HA       GLU  66 -23.988  10.925   5.919
    3    HB2  GLU  66           HB2      GLU  66 -22.116   8.633   5.384
    4    HB3  GLU  66           HB3      GLU  66 -21.696  10.326   5.126
    5    HG2  GLU  66           HG2      GLU  66 -21.962  10.774   7.475
    6    HG3  GLU  66           HG3      GLU  66 -22.460   9.106   7.755

  No H/Q in entry =           6
  In of MODEL   83
    1    H    ILE  67           H        ILE  67 -23.990   8.101   3.764
    2    HA   ILE  67           HA       ILE  67 -23.562   9.737   1.420
    3    HB   ILE  67           HB       ILE  67 -24.408   6.820   1.685
    4   HG12  ILE  67          HG12      ILE  67 -21.783   8.009   0.773
    5   HG13  ILE  67          HG13      ILE  67 -22.104   7.642   2.466
    6   HG21  ILE  67          HG21      ILE  67 -24.343   8.621  -0.603
    7   HG23  ILE  67          HG22      ILE  67 -24.936   6.963  -0.507
    8   HG22  ILE  67          HG23      ILE  67 -23.228   7.270  -0.812
    9   HD12  ILE  67          HD11      ILE  67 -21.603   5.798   0.189
   10   HD11  ILE  67          HD12      ILE  67 -22.633   5.253   1.511
   11   HD13  ILE  67          HD13      ILE  67 -20.975   5.760   1.837

  No H/Q in entry =          11
  In of MODEL   83
    1    H    GLN  68           H        GLN  68 -26.444   8.684   3.034
    2    HA   GLN  68           HA       GLN  68 -28.250   9.511   0.994
    3    HB2  GLN  68           HB2      GLN  68 -28.559   9.252   3.982
    4    HB3  GLN  68           HB3      GLN  68 -29.869   9.788   2.944
    5    HG2  GLN  68           HG2      GLN  68 -29.834   7.714   1.739
    6    HG3  GLN  68           HG3      GLN  68 -28.391   7.193   2.590
    7   HE21  GLN  68          HE21      GLN  68 -30.542   5.791   2.461
    8   HE22  GLN  68          HE22      GLN  68 -31.391   5.369   3.874

  No H/Q in entry =           8
  In of MODEL   83
    1    H    ARG  69           H        ARG  69 -26.729  11.300   3.701
    2    HA   ARG  69           HA       ARG  69 -28.128  13.743   3.182
    3    HB2  ARG  69           HB2      ARG  69 -25.799  12.911   4.847
    4    HB3  ARG  69           HB3      ARG  69 -25.901  14.615   4.428
    5    HG2  ARG  69           HG2      ARG  69 -28.236  14.650   5.353
    6    HG3  ARG  69           HG3      ARG  69 -28.008  12.982   5.890
    7    HD2  ARG  69           HD2      ARG  69 -26.375  15.397   6.753
    8    HD3  ARG  69           HD3      ARG  69 -27.508  14.505   7.756
    9    HE   ARG  69           HE       ARG  69 -24.861  13.589   6.890
   10   HH21  ARG  69          HH11      ARG  69 -24.048  11.883   8.161
   11   HH22  ARG  69          HH12      ARG  69 -25.084  11.088   9.299
   12   HH11  ARG  69          HH21      ARG  69 -27.842  13.049   8.549
   13   HH12  ARG  69          HH22      ARG  69 -27.232  11.745   9.516

  No H/Q in entry =          13
  In of MODEL   83
    1    H    LEU  70           H        LEU  70 -25.208  12.340   1.928
    2    HA   LEU  70           HA       LEU  70 -24.111  14.683   0.699
    3    HB2  LEU  70           HB2      LEU  70 -23.090  12.404   1.394
    4    HB3  LEU  70           HB3      LEU  70 -23.666  11.874  -0.186
    5    HG   LEU  70           HG       LEU  70 -22.074  13.235  -1.288
    6   HD11  LEU  70          HD11      LEU  70 -21.321  14.189   1.484
    7   HD13  LEU  70          HD12      LEU  70 -22.009  15.166   0.187
    8   HD12  LEU  70          HD13      LEU  70 -20.382  14.506   0.022
    9   HD22  LEU  70          HD21      LEU  70 -20.618  11.552  -0.968
   10   HD21  LEU  70          HD22      LEU  70 -21.563  11.063   0.438
   11   HD23  LEU  70          HD23      LEU  70 -20.200  12.165   0.631

  No H/Q in entry =          11
  In of MODEL   83
    1    H    LEU  71           H        LEU  71 -26.201  12.067  -0.368
    2    HA   LEU  71           HA       LEU  71 -26.700  13.458  -2.944
    3    HB2  LEU  71           HB2      LEU  71 -26.868  10.488  -2.397
    4    HB3  LEU  71           HB3      LEU  71 -26.980  11.293  -3.962
    5    HG   LEU  71           HG       LEU  71 -24.493  11.403  -2.255
    6   HD12  LEU  71          HD11      LEU  71 -24.474   9.691  -4.630
    7   HD11  LEU  71          HD12      LEU  71 -25.499   9.098  -3.325
    8   HD13  LEU  71          HD13      LEU  71 -23.790   9.414  -3.028
    9   HD22  LEU  71          HD21      LEU  71 -24.595  13.165  -3.812
   10   HD21  LEU  71          HD22      LEU  71 -25.050  12.069  -5.117
   11   HD23  LEU  71          HD23      LEU  71 -23.440  11.972  -4.404

  No H/Q in entry =          11
  In of MODEL   83
    1    HA   PRO  72           HA       PRO  72 -30.610  13.040  -0.381
    2    HB2  PRO  72           HB2      PRO  72 -31.501  15.583  -0.568
    3    HB3  PRO  72           HB3      PRO  72 -30.208  15.189   0.562
    4    HG2  PRO  72           HG2      PRO  72 -29.986  16.291  -2.227
    5    HG3  PRO  72           HG3      PRO  72 -29.255  16.904  -0.743
    6    HD2  PRO  72           HD2      PRO  72 -27.863  15.306  -2.429
    7    HD3  PRO  72           HD3      PRO  72 -27.640  15.203  -0.683

  No H/Q in entry =           7
  In of MODEL   83
    1    H    ASN  73           H        ASN  73 -29.938  13.892  -3.615
    2    HA   ASN  73           HA       ASN  73 -32.780  13.521  -4.290
    3    HB2  ASN  73           HB2      ASN  73 -32.289  14.560  -6.416
    4    HB3  ASN  73           HB3      ASN  73 -31.806  15.594  -5.080
    5   HD21  ASN  73          HD21      ASN  73 -30.959  15.557  -7.742
    6   HD22  ASN  73          HD22      ASN  73 -29.287  15.414  -7.896

  No H/Q in entry =           6
  In of MODEL   83
    1    H    LYS  74           H        LYS  74 -30.778  11.309  -3.749
    2    HA   LYS  74           HA       LYS  74 -31.277   9.820  -6.258
    3    HB2  LYS  74           HB2      LYS  74 -28.774   9.618  -4.580
    4    HB3  LYS  74           HB3      LYS  74 -29.117   8.748  -6.075
    5    HG2  LYS  74           HG2      LYS  74 -28.895  11.727  -5.972
    6    HG3  LYS  74           HG3      LYS  74 -27.501  10.674  -6.213
    7    HD2  LYS  74           HD2      LYS  74 -28.569   9.663  -8.144
    8    HD3  LYS  74           HD3      LYS  74 -30.006  10.652  -7.886
    9    HE2  LYS  74           HE2      LYS  74 -28.798  12.659  -8.374
   10    HE3  LYS  74           HE3      LYS  74 -27.264  11.787  -8.405
   11    HZ2  LYS  74           HZ1      LYS  74 -28.701  12.295 -10.579
   12    HZ1  LYS  74           HZ2      LYS  74 -29.343  10.779 -10.165
   13    HZ3  LYS  74           HZ3      LYS  74 -27.676  10.949 -10.436

  No H/Q in entry =          13
  In of MODEL   83
    1    HA   PRO  75           HA       PRO  75 -32.692   6.921  -3.212
    2    HB2  PRO  75           HB2      PRO  75 -32.944   4.646  -4.721
    3    HB3  PRO  75           HB3      PRO  75 -34.085   5.982  -4.859
    4    HG2  PRO  75           HG2      PRO  75 -31.707   5.354  -6.563
    5    HG3  PRO  75           HG3      PRO  75 -33.351   5.754  -7.057
    6    HD2  PRO  75           HD2      PRO  75 -31.433   7.644  -7.042
    7    HD3  PRO  75           HD3      PRO  75 -33.081   8.042  -6.549

  No H/Q in entry =           7
  In of MODEL   83
    1    H    VAL  76           H        VAL  76 -31.254   5.932  -1.775
    2    HA   VAL  76           HA       VAL  76 -28.753   4.717  -2.792
    3    HB   VAL  76           HB       VAL  76 -29.110   6.271  -0.194
    4   HG11  VAL  76          HG11      VAL  76 -26.712   4.966  -1.494
    5   HG13  VAL  76          HG12      VAL  76 -27.434   4.562   0.065
    6   HG12  VAL  76          HG13      VAL  76 -26.603   6.102  -0.148
    7   HG22  VAL  76          HG21      VAL  76 -28.448   8.148  -1.134
    8   HG21  VAL  76          HG22      VAL  76 -28.953   7.392  -2.647
    9   HG23  VAL  76          HG23      VAL  76 -27.258   7.342  -2.157

  No H/Q in entry =           9
  In of MODEL   83
    1    H    GLU  77           H        GLU  77 -28.522   2.589  -2.100
    2    HA   GLU  77           HA       GLU  77 -29.352   1.884   0.564
    3    HB2  GLU  77           HB2      GLU  77 -30.928   0.199   0.061
    4    HB3  GLU  77           HB3      GLU  77 -31.481   1.689  -0.704
    5    HG2  GLU  77           HG2      GLU  77 -30.821   0.864  -2.851
    6    HG3  GLU  77           HG3      GLU  77 -30.175  -0.601  -2.114

  No H/Q in entry =           6
  In of MODEL   83
    1    H    VAL  78           H        VAL  78 -29.012  -0.174   1.303
    2    HA   VAL  78           HA       VAL  78 -26.320  -0.941   0.494
    3    HB   VAL  78           HB       VAL  78 -28.063  -1.764   2.856
    4   HG11  VAL  78          HG11      VAL  78 -25.687  -3.002   1.820
    5   HG13  VAL  78          HG12      VAL  78 -26.617  -3.434   3.257
    6   HG12  VAL  78          HG13      VAL  78 -25.314  -2.252   3.371
    7   HG22  VAL  78          HG21      VAL  78 -26.648  -0.337   4.173
    8   HG21  VAL  78          HG22      VAL  78 -27.370   0.577   2.851
    9   HG23  VAL  78          HG23      VAL  78 -25.685   0.067   2.752

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ILE  79           H        ILE  79 -25.741  -2.874  -0.333
    2    HA   ILE  79           HA       ILE  79 -27.757  -4.424  -1.667
    3    HB   ILE  79           HB       ILE  79 -24.765  -4.904  -1.370
    4   HG12  ILE  79          HG12      ILE  79 -26.369  -3.902  -3.727
    5   HG13  ILE  79          HG13      ILE  79 -25.530  -2.841  -2.593
    6   HG22  ILE  79          HG21      ILE  79 -25.806  -6.178  -3.667
    7   HG21  ILE  79          HG22      ILE  79 -26.811  -6.665  -2.301
    8   HG23  ILE  79          HG23      ILE  79 -25.067  -6.920  -2.247
    9   HD13  ILE  79          HD11      ILE  79 -24.080  -2.999  -4.379
   10   HD12  ILE  79          HD12      ILE  79 -24.393  -4.721  -4.606
   11   HD11  ILE  79          HD13      ILE  79 -23.442  -4.171  -3.225

  No H/Q in entry =          11
  In of MODEL   83
    1    H    ASP  80           H        ASP  80 -28.608  -6.337  -1.033
    2    HA   ASP  80           HA       ASP  80 -28.597  -7.143   1.644
    3    HB2  ASP  80           HB2      ASP  80 -30.310  -7.799  -0.008
    4    HB3  ASP  80           HB3      ASP  80 -29.123  -8.821  -0.818

  No H/Q in entry =           4
  In of MODEL   83
    1    H    SER  81           H        SER  81 -27.070  -8.217   2.843
    2    HA   SER  81           HA       SER  81 -24.542  -8.908   1.725
    3    HB2  SER  81           HB2      SER  81 -24.022  -9.854   3.940
    4    HB3  SER  81           HB3      SER  81 -24.744  -8.252   4.082
    5    HG   SER  81           HG       SER  81 -26.066 -10.725   4.397

  No H/Q in entry =           5
  In of MODEL   83
    1    H    LEU  82           H        LEU  82 -27.232 -11.022   2.068
    2    HA   LEU  82           HA       LEU  82 -25.645 -13.387   1.662
    3    HB2  LEU  82           HB2      LEU  82 -28.584 -12.820   1.327
    4    HB3  LEU  82           HB3      LEU  82 -27.855 -14.419   1.190
    5    HG   LEU  82           HG       LEU  82 -27.880 -12.743   3.682
    6   HD11  LEU  82          HD11      LEU  82 -29.511 -15.167   2.884
    7   HD13  LEU  82          HD12      LEU  82 -30.126 -13.522   3.051
    8   HD12  LEU  82          HD13      LEU  82 -29.534 -14.390   4.467
    9   HD21  LEU  82          HD21      LEU  82 -26.805 -15.434   2.896
   10   HD23  LEU  82          HD22      LEU  82 -27.247 -15.098   4.569
   11   HD22  LEU  82          HD23      LEU  82 -26.001 -14.132   3.776

  No H/Q in entry =          11
  In of MODEL   83
    1    H    LEU  83           H        LEU  83 -27.592 -11.256  -0.372
    2    HA   LEU  83           HA       LEU  83 -27.326 -12.698  -2.789
    3    HB2  LEU  83           HB2      LEU  83 -27.785  -9.775  -2.253
    4    HB3  LEU  83           HB3      LEU  83 -27.776 -10.479  -3.870
    5    HG   LEU  83           HG       LEU  83 -29.848 -10.815  -1.721
    6   HD13  LEU  83          HD11      LEU  83 -30.605  -9.015  -2.865
    7   HD12  LEU  83          HD12      LEU  83 -31.029 -10.179  -4.118
    8   HD11  LEU  83          HD13      LEU  83 -29.504  -9.298  -4.211
    9   HD23  LEU  83          HD21      LEU  83 -29.917 -12.170  -4.402
   10   HD22  LEU  83          HD22      LEU  83 -30.911 -12.482  -2.978
   11   HD21  LEU  83          HD23      LEU  83 -29.216 -12.965  -2.992

  No H/Q in entry =          11
  In of MODEL   83
    1    H    TYR  84           H        TYR  84 -25.435 -10.230  -1.162
    2    HA   TYR  84           HA       TYR  84 -23.538  -9.794  -3.272
    3    HB2  TYR  84           HB2      TYR  84 -24.086  -8.212  -1.366
    4    HB3  TYR  84           HB3      TYR  84 -23.165  -9.289  -0.318
    5    HD1  TYR  84           HD1      TYR  84 -20.708  -9.755  -0.996
    6    HD2  TYR  84           HD2      TYR  84 -22.994  -6.480  -2.509
    7    HE1  TYR  84           HE1      TYR  84 -18.616  -8.612  -1.647
    8    HE2  TYR  84           HE2      TYR  84 -20.911  -5.331  -3.175
    9    HH   TYR  84           HH       TYR  84 -17.731  -6.738  -2.380

  No H/Q in entry =           9
  In of MODEL   83
    1    H    GLY  85           H        GLY  85 -23.332 -11.687  -0.251
    2    HA3  GLY  85           HA2      GLY  85 -20.734 -12.614  -0.650
    3    HA2  GLY  85           HA3      GLY  85 -21.972 -13.442   0.293

  No H/Q in entry =           3
  In of MODEL   83
    1    H    LYS  86           H        LYS  86 -23.774 -13.912  -1.788
    2    HA   LYS  86           HA       LYS  86 -22.666 -16.316  -2.941
    3    HB2  LYS  86           HB2      LYS  86 -25.330 -14.920  -3.214
    4    HB3  LYS  86           HB3      LYS  86 -24.970 -16.541  -3.807
    5    HG2  LYS  86           HG2      LYS  86 -24.833 -15.798  -0.915
    6    HG3  LYS  86           HG3      LYS  86 -26.292 -16.408  -1.697
    7    HD2  LYS  86           HD2      LYS  86 -25.037 -18.383  -2.472
    8    HD3  LYS  86           HD3      LYS  86 -23.598 -17.780  -1.652
    9    HE2  LYS  86           HE2      LYS  86 -24.760 -17.915   0.494
   10    HE3  LYS  86           HE3      LYS  86 -26.206 -18.504  -0.322
   11    HZ1  LYS  86           HZ1      LYS  86 -24.051 -20.066  -1.168
   12    HZ3  LYS  86           HZ2      LYS  86 -25.380 -20.542  -0.222
   13    HZ2  LYS  86           HZ3      LYS  86 -23.968 -19.970   0.527

  No H/Q in entry =          13
  In of MODEL   83
    1    H    VAL  87           H        VAL  87 -22.677 -13.135  -3.949
    2    HA   VAL  87           HA       VAL  87 -22.354 -12.029  -5.924
    3    HB   VAL  87           HB       VAL  87 -21.247 -14.533  -7.204
    4   HG11  VAL  87          HG11      VAL  87 -21.284 -12.342  -8.403
    5   HG13  VAL  87          HG12      VAL  87 -19.646 -12.944  -8.146
    6   HG12  VAL  87          HG13      VAL  87 -20.284 -11.657  -7.124
    7   HG23  VAL  87          HG21      VAL  87 -19.822 -12.968  -5.060
    8   HG22  VAL  87          HG22      VAL  87 -19.120 -14.237  -6.059
    9   HG21  VAL  87          HG23      VAL  87 -20.405 -14.625  -4.915

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ASP  88           H        ASP  88 -24.868 -12.690  -5.598
    2    HA   ASP  88           HA       ASP  88 -25.928 -14.007  -7.971
    3    HB2  ASP  88           HB2      ASP  88 -26.965 -14.181  -5.660
    4    HB3  ASP  88           HB3      ASP  88 -27.437 -12.490  -5.828

  No H/Q in entry =           4
  In of MODEL   83
    1    H    GLY  89           H        GLY  89 -25.207 -12.799  -9.643
    2    HA3  GLY  89           HA2      GLY  89 -25.420 -10.038  -9.948
    3    HA2  GLY  89           HA3      GLY  89 -25.356 -11.206 -11.266

  No H/Q in entry =           3
  In of MODEL   83
    1    H    LEU  90           H        LEU  90 -27.793 -12.574 -10.815
    2    HA   LEU  90           HA       LEU  90 -29.607 -10.704 -12.031
    3    HB2  LEU  90           HB2      LEU  90 -29.630 -13.121 -12.525
    4    HB3  LEU  90           HB3      LEU  90 -30.163 -13.435 -10.875
    5    HG   LEU  90           HG       LEU  90 -32.288 -12.359 -11.317
    6   HD13  LEU  90          HD11      LEU  90 -32.103 -10.670 -12.851
    7   HD12  LEU  90          HD12      LEU  90 -32.605 -11.956 -13.952
    8   HD11  LEU  90          HD13      LEU  90 -30.899 -11.533 -13.810
    9   HD23  LEU  90          HD21      LEU  90 -32.151 -14.075 -13.690
   10   HD22  LEU  90          HD22      LEU  90 -33.155 -14.201 -12.247
   11   HD21  LEU  90          HD23      LEU  90 -31.494 -14.791 -12.219

  No H/Q in entry =          11
  In of MODEL   83
    1    H    GLY  91           H        GLY  91 -29.480 -12.088  -8.793
    2    HA3  GLY  91           HA2      GLY  91 -31.852 -10.971  -7.838
    3    HA2  GLY  91           HA3      GLY  91 -30.472 -11.451  -6.851

  No H/Q in entry =           3
  In of MODEL   83
    1    H    VAL  92           H        VAL  92 -28.561  -9.629  -7.737
    2    HA   VAL  92           HA       VAL  92 -29.412  -7.285  -6.288
    3    HB   VAL  92           HB       VAL  92 -26.830  -7.777  -7.818
    4   HG12  VAL  92          HG11      VAL  92 -27.063  -5.811  -5.564
    5   HG11  VAL  92          HG12      VAL  92 -27.706  -5.333  -7.138
    6   HG13  VAL  92          HG13      VAL  92 -26.007  -5.773  -6.976
    7   HG22  VAL  92          HG21      VAL  92 -26.616  -9.303  -6.165
    8   HG21  VAL  92          HG22      VAL  92 -27.792  -8.499  -5.123
    9   HG23  VAL  92          HG23      VAL  92 -26.144  -7.881  -5.234

  No H/Q in entry =           9
  In of MODEL   83
    1    H    LEU  93           H        LEU  93 -28.931  -8.064  -9.674
    2    HA   LEU  93           HA       LEU  93 -29.295  -5.469 -10.705
    3    HB2  LEU  93           HB2      LEU  93 -28.601  -7.366 -12.085
    4    HB3  LEU  93           HB3      LEU  93 -30.186  -8.107 -11.866
    5    HG   LEU  93           HG       LEU  93 -31.202  -6.200 -13.079
    6   HD11  LEU  93          HD11      LEU  93 -29.382  -4.562 -12.599
    7   HD13  LEU  93          HD12      LEU  93 -29.789  -4.660 -14.314
    8   HD12  LEU  93          HD13      LEU  93 -28.337  -5.453 -13.705
    9   HD23  LEU  93          HD21      LEU  93 -30.113  -6.835 -15.325
   10   HD22  LEU  93          HD22      LEU  93 -30.955  -8.070 -14.389
   11   HD21  LEU  93          HD23      LEU  93 -29.192  -7.990 -14.361

  No H/Q in entry =          11
  In of MODEL   83
    1    H    LYS  94           H        LYS  94 -31.651  -8.016  -9.806
    2    HA   LYS  94           HA       LYS  94 -34.002  -6.630 -10.526
    3    HB2  LYS  94           HB2      LYS  94 -33.497  -8.734  -8.427
    4    HB3  LYS  94           HB3      LYS  94 -35.098  -8.071  -8.750
    5    HG2  LYS  94           HG2      LYS  94 -34.957  -8.928 -11.052
    6    HG3  LYS  94           HG3      LYS  94 -33.393  -9.646 -10.669
    7    HD2  LYS  94           HD2      LYS  94 -34.530 -10.928  -8.817
    8    HD3  LYS  94           HD3      LYS  94 -36.072 -10.322  -9.424
    9    HE2  LYS  94           HE2      LYS  94 -35.501 -11.326 -11.646
   10    HE3  LYS  94           HE3      LYS  94 -34.089 -12.063 -10.888
   11    HZ3  LYS  94           HZ1      LYS  94 -35.915 -13.616 -11.036
   12    HZ2  LYS  94           HZ2      LYS  94 -36.921 -12.570 -10.150
   13    HZ1  LYS  94           HZ3      LYS  94 -35.564 -13.273  -9.411

  No H/Q in entry =          13
  In of MODEL   83
    1    H    ALA  95           H        ALA  95 -32.234  -6.615  -7.442
    2    HA   ALA  95           HA       ALA  95 -34.132  -5.009  -6.055
    3    HB2  ALA  95           HB1      ALA  95 -31.749  -6.330  -5.425
    4    HB3  ALA  95           HB2      ALA  95 -32.761  -5.398  -4.324
    5    HB1  ALA  95           HB3      ALA  95 -31.409  -4.623  -5.149

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ALA  96           H        ALA  96 -31.463  -4.195  -8.134
    2    HA   ALA  96           HA       ALA  96 -31.417  -1.406  -7.459
    3    HB2  ALA  96           HB1      ALA  96 -30.019  -1.238  -9.549
    4    HB3  ALA  96           HB2      ALA  96 -30.295  -2.959  -9.813
    5    HB1  ALA  96           HB3      ALA  96 -29.413  -2.415  -8.385

  No H/Q in entry =           5
  In of MODEL   83
    1    H    VAL  97           H        VAL  97 -32.876  -3.237 -10.108
    2    HA   VAL  97           HA       VAL  97 -33.952  -0.997 -11.466
    3    HB   VAL  97           HB       VAL  97 -34.723  -3.933 -11.417
    4   HG11  VAL  97          HG11      VAL  97 -36.530  -1.970 -12.008
    5   HG13  VAL  97          HG12      VAL  97 -36.556  -3.588 -12.707
    6   HG12  VAL  97          HG13      VAL  97 -35.804  -2.261 -13.589
    7   HG21  VAL  97          HG21      VAL  97 -33.429  -2.162 -13.494
    8   HG23  VAL  97          HG22      VAL  97 -33.856  -3.858 -13.731
    9   HG22  VAL  97          HG23      VAL  97 -32.634  -3.413 -12.537

  No H/Q in entry =           9
  In of MODEL   83
    1    H    ALA  98           H        ALA  98 -35.155  -3.100  -8.875
    2    HA   ALA  98           HA       ALA  98 -37.734  -1.971  -8.612
    3    HB1  ALA  98           HB1      ALA  98 -36.716  -4.119  -7.482
    4    HB3  ALA  98           HB2      ALA  98 -37.923  -3.177  -6.607
    5    HB2  ALA  98           HB3      ALA  98 -36.212  -2.994  -6.221

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ALA  99           H        ALA  99 -34.696  -1.077  -6.938
    2    HA   ALA  99           HA       ALA  99 -35.879   0.951  -5.370
    3    HB1  ALA  99           HB1      ALA  99 -33.207   0.067  -6.036
    4    HB2  ALA  99           HB2      ALA  99 -33.794   0.864  -4.576
    5    HB3  ALA  99           HB3      ALA  99 -33.304   1.827  -5.969

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ILE 100           H        ILE 100 -34.778   0.976  -8.709
    2    HA   ILE 100           HA       ILE 100 -34.983   3.812  -9.032
    3    HB   ILE 100           HB       ILE 100 -35.016   1.582 -11.094
    4   HG12  ILE 100          HG12      ILE 100 -32.886   3.621 -10.454
    5   HG13  ILE 100          HG13      ILE 100 -32.916   1.998  -9.767
    6   HG21  ILE 100          HG21      ILE 100 -35.467   4.491 -11.335
    7   HG23  ILE 100          HG22      ILE 100 -35.939   3.178 -12.415
    8   HG22  ILE 100          HG23      ILE 100 -34.292   3.810 -12.462
    9   HD12  ILE 100          HD11      ILE 100 -32.344   2.862 -12.564
   10   HD11  ILE 100          HD12      ILE 100 -32.992   1.249 -12.263
   11   HD13  ILE 100          HD13      ILE 100 -31.463   1.736 -11.532

  No H/Q in entry =          11
  In of MODEL   83
    1    H    LYS 101           H        LYS 101 -37.235   1.154  -9.707
    2    HA   LYS 101           HA       LYS 101 -39.314   2.743 -10.801
    3    HB2  LYS 101           HB2      LYS 101 -39.191   0.012  -9.574
    4    HB3  LYS 101           HB3      LYS 101 -40.744   0.744  -9.976
    5    HG2  LYS 101           HG2      LYS 101 -40.228   0.803 -12.266
    6    HG3  LYS 101           HG3      LYS 101 -38.534   0.425 -11.968
    7    HD2  LYS 101           HD2      LYS 101 -39.747  -1.526 -12.808
    8    HD3  LYS 101           HD3      LYS 101 -39.146  -1.792 -11.171
    9    HE2  LYS 101           HE2      LYS 101 -41.211  -2.492 -10.678
   10    HE3  LYS 101           HE3      LYS 101 -41.685  -0.794 -10.750
   11    HZ3  LYS 101           HZ1      LYS 101 -42.536  -1.035 -12.876
   12    HZ2  LYS 101           HZ2      LYS 101 -42.995  -2.487 -12.126
   13    HZ1  LYS 101           HZ3      LYS 101 -41.669  -2.462 -13.187

  No H/Q in entry =          13
  In of MODEL   83
    1    H    LYS 102           H        LYS 102 -38.867   1.384  -7.534
    2    HA   LYS 102           HA       LYS 102 -41.150   2.595  -6.420
    3    HB2  LYS 102           HB2      LYS 102 -39.913   0.779  -5.318
    4    HB3  LYS 102           HB3      LYS 102 -38.538   1.858  -5.086
    5    HG2  LYS 102           HG2      LYS 102 -39.896   3.289  -3.663
    6    HG3  LYS 102           HG3      LYS 102 -41.275   2.215  -3.898
    7    HD2  LYS 102           HD2      LYS 102 -40.049   0.399  -2.785
    8    HD3  LYS 102           HD3      LYS 102 -38.671   1.475  -2.549
    9    HE2  LYS 102           HE2      LYS 102 -40.067   2.986  -1.217
   10    HE3  LYS 102           HE3      LYS 102 -41.462   1.940  -1.476
   11    HZ1  LYS 102           HZ1      LYS 102 -39.743   0.240  -0.380
   12    HZ3  LYS 102           HZ2      LYS 102 -40.879   1.145   0.498
   13    HZ2  LYS 102           HZ3      LYS 102 -39.273   1.682   0.382

  No H/Q in entry =          13
  In of MODEL   83
    1    H    ALA 103           H        ALA 103 -38.191   3.983  -7.426
    2    HA   ALA 103           HA       ALA 103 -38.471   6.355  -5.731
    3    HB2  ALA 103           HB1      ALA 103 -36.459   7.057  -7.294
    4    HB3  ALA 103           HB2      ALA 103 -36.397   5.327  -7.631
    5    HB1  ALA 103           HB3      ALA 103 -36.208   5.910  -5.978

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ALA 104           H        ALA 104 -39.021   5.503  -9.060
    2    HA   ALA 104           HA       ALA 104 -39.623   8.258  -9.790
    3    HB2  ALA 104           HB1      ALA 104 -39.618   7.514 -11.968
    4    HB1  ALA 104           HB2      ALA 104 -40.336   5.958 -11.549
    5    HB3  ALA 104           HB3      ALA 104 -38.622   6.250 -11.248

  No H/Q in entry =           5
  In of MODEL   83
    1    H    ALA 105           H        ALA 105 -41.243   6.199  -7.943
    2    HA   ALA 105           HA       ALA 105 -43.682   7.566  -8.010
    3    HB2  ALA 105           HB1      ALA 105 -44.379   6.628 -10.031
    4    HB3  ALA 105           HB2      ALA 105 -45.025   5.473  -8.866
    5    HB1  ALA 105           HB3      ALA 105 -43.535   5.110  -9.735

  No H/Q in entry =           5
  In of MODEL   84
    1    H1   ALA   1           H3       ALA   1 -12.124 -15.910  -2.470
    2    H2   ALA   1           H2       ALA   1 -11.174 -17.043  -3.314
    3    H3   ALA   1           H1       ALA   1 -12.324 -16.104  -4.145
    4    HA   ALA   1           HA       ALA   1 -13.711 -17.815  -3.910
    5    HB3  ALA   1           HB1      ALA   1 -12.302 -19.578  -3.454
    6    HB1  ALA   1           HB2      ALA   1 -13.059 -19.476  -1.864
    7    HB2  ALA   1           HB3      ALA   1 -11.488 -18.723  -2.143

  No H/Q in entry =           7
  In of MODEL   84
    1    H    GLU   2           H        GLU   2 -15.327 -18.687  -2.259
    2    HA   GLU   2           HA       GLU   2 -16.988 -16.982  -1.195
    3    HB2  GLU   2           HB2      GLU   2 -16.031 -19.405   0.343
    4    HB3  GLU   2           HB3      GLU   2 -17.561 -18.567   0.599
    5    HG2  GLU   2           HG2      GLU   2 -18.533 -19.655  -1.139
    6    HG3  GLU   2           HG3      GLU   2 -17.213 -19.241  -2.222

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLU   3           H        GLU   3 -15.066 -18.329   1.424
    2    HA   GLU   3           HA       GLU   3 -15.305 -15.982   2.989
    3    HB2  GLU   3           HB2      GLU   3 -13.701 -18.518   3.232
    4    HB3  GLU   3           HB3      GLU   3 -13.479 -17.200   4.383
    5    HG2  GLU   3           HG2      GLU   3 -15.671 -17.370   5.200
    6    HG3  GLU   3           HG3      GLU   3 -16.260 -18.170   3.749

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LEU   4           H        LEU   4 -12.339 -17.435   1.594
    2    HA   LEU   4           HA       LEU   4 -10.519 -15.520   2.198
    3    HB2  LEU   4           HB2      LEU   4 -10.740 -16.811  -0.531
    4    HB3  LEU   4           HB3      LEU   4  -9.293 -16.082   0.156
    5    HG   LEU   4           HG       LEU   4 -10.770 -18.494   1.261
    6   HD13  LEU   4          HD11      LEU   4  -9.128 -19.835   0.328
    7   HD12  LEU   4          HD12      LEU   4  -7.927 -18.543   0.306
    8   HD11  LEU   4          HD13      LEU   4  -9.215 -18.570  -0.897
    9   HD23  LEU   4          HD21      LEU   4  -8.518 -18.545   2.643
   10   HD22  LEU   4          HD22      LEU   4  -9.847 -17.517   3.175
   11   HD21  LEU   4          HD23      LEU   4  -8.489 -16.816   2.295

  No H/Q in entry =          11
  In of MODEL   84
    1    H    GLU   5           H        GLU   5 -12.854 -15.322  -0.476
    2    HA   GLU   5           HA       GLU   5 -11.869 -12.828  -1.469
    3    HB2  GLU   5           HB2      GLU   5 -13.201 -14.417  -2.838
    4    HB3  GLU   5           HB3      GLU   5 -14.604 -14.074  -1.826
    5    HG2  GLU   5           HG2      GLU   5 -14.490 -11.696  -2.451
    6    HG3  GLU   5           HG3      GLU   5 -13.076 -12.023  -3.452

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLU   6           H        GLU   6 -14.588 -13.732   0.620
    2    HA   GLU   6           HA       GLU   6 -15.511 -11.063   1.028
    3    HB2  GLU   6           HB2      GLU   6 -16.923 -13.066   1.420
    4    HB3  GLU   6           HB3      GLU   6 -15.890 -13.508   2.778
    5    HG2  GLU   6           HG2      GLU   6 -16.433 -11.390   3.900
    6    HG3  GLU   6           HG3      GLU   6 -17.444 -10.917   2.538

  No H/Q in entry =           6
  In of MODEL   84
    1    H    VAL   7           H        VAL   7 -13.190 -13.162   2.593
    2    HA   VAL   7           HA       VAL   7 -12.735 -11.591   4.925
    3    HB   VAL   7           HB       VAL   7 -11.017 -13.618   3.470
    4   HG11  VAL   7          HG11      VAL   7 -10.560 -12.090   6.039
    5   HG13  VAL   7          HG12      VAL   7  -9.458 -12.293   4.678
    6   HG12  VAL   7          HG13      VAL   7  -9.802 -13.655   5.744
    7   HG21  VAL   7          HG21      VAL   7 -13.264 -14.202   4.687
    8   HG23  VAL   7          HG22      VAL   7 -12.339 -13.926   6.164
    9   HG22  VAL   7          HG23      VAL   7 -11.837 -15.179   5.031

  No H/Q in entry =           9
  In of MODEL   84
    1    H    VAL   8           H        VAL   8 -11.222 -11.685   1.715
    2    HA   VAL   8           HA       VAL   8  -9.173  -9.800   2.215
    3    HB   VAL   8           HB       VAL   8 -10.630 -10.491  -0.347
    4   HG12  VAL   8          HG11      VAL   8  -8.509  -9.458  -1.373
    5   HG11  VAL   8          HG12      VAL   8  -8.242  -8.718   0.206
    6   HG13  VAL   8          HG13      VAL   8  -9.699  -8.334  -0.712
    7   HG22  VAL   8          HG21      VAL   8  -9.099 -12.196  -0.603
    8   HG21  VAL   8          HG22      VAL   8  -8.931 -12.056   1.144
    9   HG23  VAL   8          HG23      VAL   8  -7.782 -11.246   0.086

  No H/Q in entry =           9
  In of MODEL   84
    1    H    MET   9           H        MET   9 -12.520  -9.430   1.055
    2    HA   MET   9           HA       MET   9 -12.477  -6.652   0.629
    3    HB2  MET   9           HB2      MET   9 -14.647  -8.595   1.374
    4    HB3  MET   9           HB3      MET   9 -14.984  -6.863   1.325
    5    HG2  MET   9           HG2      MET   9 -13.916  -6.899  -1.018
    6    HG3  MET   9           HG3      MET   9 -14.074  -8.653  -0.929
    7    HE3  MET   9           HE1      MET   9 -17.767  -9.386  -0.728
    8    HE2  MET   9           HE2      MET   9 -16.694  -9.211   0.658
    9    HE1  MET   9           HE3      MET   9 -16.100  -9.968  -0.817

  No H/Q in entry =           9
  In of MODEL   84
    1    H    GLY  10           H        GLY  10 -13.127  -8.556   3.550
    2    HA3  GLY  10           HA2      GLY  10 -13.691  -6.381   5.275
    3    HA2  GLY  10           HA3      GLY  10 -13.116  -7.967   5.785

  No H/Q in entry =           3
  In of MODEL   84
    1    H    LEU  11           H        LEU  11 -10.669  -8.069   4.470
    2    HA   LEU  11           HA       LEU  11  -8.980  -6.629   6.232
    3    HB2  LEU  11           HB2      LEU  11  -8.422  -8.040   3.621
    4    HB3  LEU  11           HB3      LEU  11  -7.157  -7.329   4.622
    5    HG   LEU  11           HG       LEU  11  -9.144  -9.380   5.631
    6   HD13  LEU  11          HD11      LEU  11  -7.913 -10.603   4.064
    7   HD12  LEU  11          HD12      LEU  11  -6.976 -10.839   5.538
    8   HD11  LEU  11          HD13      LEU  11  -6.444  -9.666   4.334
    9   HD22  LEU  11          HD21      LEU  11  -8.299  -8.367   7.551
   10   HD21  LEU  11          HD22      LEU  11  -6.764  -7.951   6.790
   11   HD23  LEU  11          HD23      LEU  11  -7.078  -9.611   7.295

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  12           H        ILE  12  -9.884  -6.078   2.843
    2    HA   ILE  12           HA       ILE  12  -8.210  -3.834   2.424
    3    HB   ILE  12           HB       ILE  12 -10.857  -4.523   1.126
    4   HG12  ILE  12          HG12      ILE  12  -8.802  -6.153   1.045
    5   HG13  ILE  12          HG13      ILE  12  -9.670  -5.802  -0.435
    6   HG21  ILE  12          HG21      ILE  12  -8.646  -2.617   0.291
    7   HG23  ILE  12          HG22      ILE  12 -10.304  -2.188   0.692
    8   HG22  ILE  12          HG23      ILE  12  -9.955  -3.124  -0.732
    9   HD11  ILE  12          HD11      ILE  12  -7.166  -4.356   0.470
   10   HD13  ILE  12          HD12      ILE  12  -7.966  -4.216  -1.093
   11   HD12  ILE  12          HD13      ILE  12  -7.170  -5.707  -0.648

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  13           H        ILE  13 -11.569  -4.131   3.515
    2    HA   ILE  13           HA       ILE  13 -12.052  -1.349   3.793
    3    HB   ILE  13           HB       ILE  13 -13.237  -3.777   5.161
    4   HG12  ILE  13          HG12      ILE  13 -13.449  -3.243   2.612
    5   HG13  ILE  13          HG13      ILE  13 -14.865  -3.743   3.512
    6   HG22  ILE  13          HG21      ILE  13 -15.161  -2.129   5.668
    7   HG21  ILE  13          HG22      ILE  13 -13.981  -0.851   5.407
    8   HG23  ILE  13          HG23      ILE  13 -13.730  -2.031   6.691
    9   HD12  ILE  13          HD11      ILE  13 -14.930  -1.586   1.946
   10   HD11  ILE  13          HD12      ILE  13 -14.260  -0.840   3.384
   11   HD13  ILE  13          HD13      ILE  13 -15.813  -1.641   3.475

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ASN  14           H        ASN  14 -10.921  -3.837   6.061
    2    HA   ASN  14           HA       ASN  14 -10.735  -2.204   8.351
    3    HB2  ASN  14           HB2      ASN  14 -10.460  -4.808   8.022
    4    HB3  ASN  14           HB3      ASN  14  -8.754  -4.406   7.867
    5   HD21  ASN  14          HD21      ASN  14  -9.379  -5.942  10.038
    6   HD22  ASN  14          HD22      ASN  14  -9.360  -5.025  11.465

  No H/Q in entry =           6
  In of MODEL   84
    1    H    SER  15           H        SER  15  -8.325  -2.999   5.859
    2    HA   SER  15           HA       SER  15  -6.195  -1.490   6.936
    3    HB2  SER  15           HB2      SER  15  -5.172  -1.690   4.777
    4    HB3  SER  15           HB3      SER  15  -6.113  -3.160   4.999
    5    HG   SER  15           HG       SER  15  -7.024  -2.589   3.198

  No H/Q in entry =           5
  In of MODEL   84
    1    H    GLY  16           H        GLY  16  -8.803  -0.641   4.690
    2    HA3  GLY  16           HA2      GLY  16  -7.969   2.010   4.147
    3    HA2  GLY  16           HA3      GLY  16  -9.614   1.400   3.982

  No H/Q in entry =           3
  In of MODEL   84
    1    H    GLN  17           H        GLN  17 -10.152   0.662   6.629
    2    HA   GLN  17           HA       GLN  17 -10.883   3.157   7.777
    3    HB2  GLN  17           HB2      GLN  17 -12.099   1.064   8.258
    4    HB3  GLN  17           HB3      GLN  17 -10.686   0.444   9.112
    5    HG2  GLN  17           HG2      GLN  17 -10.820   2.334  10.699
    6    HG3  GLN  17           HG3      GLN  17 -12.241   2.941   9.850
    7   HE21  GLN  17          HE21      GLN  17 -14.168   2.313  10.818
    8   HE22  GLN  17          HE22      GLN  17 -14.391   0.885  11.709

  No H/Q in entry =           8
  In of MODEL   84
    1    H    ALA  18           H        ALA  18  -8.233   0.899   8.391
    2    HA   ALA  18           HA       ALA  18  -7.149   2.119  10.666
    3    HB2  ALA  18           HB1      ALA  18  -6.516  -0.086   9.293
    4    HB3  ALA  18           HB2      ALA  18  -5.362   0.705  10.366
    5    HB1  ALA  18           HB3      ALA  18  -5.286   0.989   8.626

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ARG  19           H        ARG  19  -6.380   2.660   7.219
    2    HA   ARG  19           HA       ARG  19  -4.503   4.725   7.655
    3    HB2  ARG  19           HB2      ARG  19  -4.818   3.588   5.456
    4    HB3  ARG  19           HB3      ARG  19  -6.368   4.413   5.281
    5    HG2  ARG  19           HG2      ARG  19  -5.262   6.596   5.356
    6    HG3  ARG  19           HG3      ARG  19  -3.705   5.825   5.659
    7    HD2  ARG  19           HD2      ARG  19  -3.835   6.421   3.317
    8    HD3  ARG  19           HD3      ARG  19  -3.902   4.660   3.458
    9    HE   ARG  19           HE       ARG  19  -6.545   5.542   3.451
   10   HH21  ARG  19          HH11      ARG  19  -7.740   5.691   1.532
   11   HH22  ARG  19          HH12      ARG  19  -6.918   5.781   0.013
   12   HH11  ARG  19          HH21      ARG  19  -3.769   5.639   1.419
   13   HH12  ARG  19          HH22      ARG  19  -4.668   5.749  -0.051

  No H/Q in entry =          13
  In of MODEL   84
    1    H    SER  20           H        SER  20  -8.002   4.806   7.053
    2    HA   SER  20           HA       SER  20  -8.388   7.558   7.011
    3    HB2  SER  20           HB2      SER  20 -10.251   6.200   6.470
    4    HB3  SER  20           HB3      SER  20 -10.133   5.301   7.981
    5    HG   SER  20           HG       SER  20 -10.761   8.060   7.701

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LEU  21           H        LEU  21  -8.367   5.368   9.810
    2    HA   LEU  21           HA       LEU  21  -8.831   7.353  11.780
    3    HB2  LEU  21           HB2      LEU  21  -7.452   4.665  11.931
    4    HB3  LEU  21           HB3      LEU  21  -7.766   5.676  13.339
    5    HG   LEU  21           HG       LEU  21  -9.930   4.758  11.421
    6   HD13  LEU  21          HD11      LEU  21  -9.088   2.765  12.426
    7   HD12  LEU  21          HD12      LEU  21 -10.516   3.202  13.365
    8   HD11  LEU  21          HD13      LEU  21  -8.904   3.548  13.996
    9   HD21  LEU  21          HD21      LEU  21  -9.874   6.275  14.022
   10   HD23  LEU  21          HD22      LEU  21 -11.272   5.268  13.663
   11   HD22  LEU  21          HD23      LEU  21 -10.844   6.590  12.587

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ALA  22           H        ALA  22  -5.862   6.016  10.371
    2    HA   ALA  22           HA       ALA  22  -3.999   7.346  11.998
    3    HB2  ALA  22           HB1      ALA  22  -3.561   5.502  10.302
    4    HB1  ALA  22           HB2      ALA  22  -2.379   6.811  10.342
    5    HB3  ALA  22           HB3      ALA  22  -3.595   6.757   9.065

  No H/Q in entry =           5
  In of MODEL   84
    1    H    TYR  23           H        TYR  23  -5.324   8.357   8.817
    2    HA   TYR  23           HA       TYR  23  -4.016  10.868   8.755
    3    HB2  TYR  23           HB2      TYR  23  -5.086   9.947   6.760
    4    HB3  TYR  23           HB3      TYR  23  -6.666  10.039   7.540
    5    HD1  TYR  23           HD1      TYR  23  -3.778  12.110   6.399
    6    HD2  TYR  23           HD2      TYR  23  -7.924  12.038   7.518
    7    HE1  TYR  23           HE1      TYR  23  -4.024  14.459   5.642
    8    HE2  TYR  23           HE2      TYR  23  -8.170  14.386   6.760
    9    HH   TYR  23           HH       TYR  23  -5.375  16.225   5.542

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ALA  24           H        ALA  24  -7.126   9.852  10.128
    2    HA   ALA  24           HA       ALA  24  -7.992  12.430  10.905
    3    HB1  ALA  24           HB1      ALA  24  -9.797  11.157  11.368
    4    HB2  ALA  24           HB2      ALA  24  -8.966  10.591  12.815
    5    HB3  ALA  24           HB3      ALA  24  -8.829   9.685  11.309

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ALA  25           H        ALA  25  -5.964   9.991  12.475
    2    HA   ALA  25           HA       ALA  25  -5.643  11.240  14.981
    3    HB2  ALA  25           HB1      ALA  25  -4.849   8.899  14.154
    4    HB3  ALA  25           HB2      ALA  25  -3.845   9.766  15.319
    5    HB1  ALA  25           HB3      ALA  25  -3.407   9.758  13.610

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LEU  26           H        LEU  26  -3.853  11.567  11.943
    2    HA   LEU  26           HA       LEU  26  -1.915  13.407  12.866
    3    HB2  LEU  26           HB2      LEU  26  -1.599  12.264  10.760
    4    HB3  LEU  26           HB3      LEU  26  -3.079  12.957  10.105
    5    HG   LEU  26           HG       LEU  26  -2.090  15.218  10.248
    6   HD12  LEU  26          HD11      LEU  26   0.448  15.265  10.664
    7   HD11  LEU  26          HD12      LEU  26   0.241  13.680  11.404
    8   HD13  LEU  26          HD13      LEU  26  -0.583  15.084  12.083
    9   HD21  LEU  26          HD21      LEU  26  -0.323  13.187   8.849
   10   HD23  LEU  26          HD22      LEU  26  -0.385  14.908   8.483
   11   HD22  LEU  26          HD23      LEU  26  -1.796  13.896   8.191

  No H/Q in entry =          11
  In of MODEL   84
    1    H    LYS  27           H        LYS  27  -5.101  13.858  11.387
    2    HA   LYS  27           HA       LYS  27  -5.076  16.647  11.196
    3    HB2  LYS  27           HB2      LYS  27  -6.803  15.154  10.204
    4    HB3  LYS  27           HB3      LYS  27  -7.459  14.886  11.819
    5    HG2  LYS  27           HG2      LYS  27  -7.915  17.286  12.061
    6    HG3  LYS  27           HG3      LYS  27  -7.208  17.595  10.472
    7    HD2  LYS  27           HD2      LYS  27  -8.924  16.145   9.430
    8    HD3  LYS  27           HD3      LYS  27  -9.636  15.853  11.018
    9    HE2  LYS  27           HE2      LYS  27 -10.105  18.259  11.267
   10    HE3  LYS  27           HE3      LYS  27  -9.365  18.573   9.694
   11    HZ3  LYS  27           HZ1      LYS  27 -11.741  18.423   9.449
   12    HZ2  LYS  27           HZ2      LYS  27 -11.773  16.904  10.215
   13    HZ1  LYS  27           HZ3      LYS  27 -11.029  17.079   8.695

  No H/Q in entry =          13
  In of MODEL   84
    1    H    GLN  28           H        GLN  28  -5.945  14.545  13.916
    2    HA   GLN  28           HA       GLN  28  -6.864  16.534  15.697
    3    HB2  GLN  28           HB2      GLN  28  -5.437  13.915  16.231
    4    HB3  GLN  28           HB3      GLN  28  -6.184  14.910  17.483
    5    HG2  GLN  28           HG2      GLN  28  -7.637  13.776  15.076
    6    HG3  GLN  28           HG3      GLN  28  -7.693  13.094  16.701
    7   HE21  GLN  28          HE21      GLN  28  -9.536  14.924  14.702
    8   HE22  GLN  28          HE22      GLN  28 -10.309  15.922  15.836

  No H/Q in entry =           8
  In of MODEL   84
    1    H    ALA  29           H        ALA  29  -3.631  15.272  15.007
    2    HA   ALA  29           HA       ALA  29  -2.209  16.679  16.991
    3    HB1  ALA  29           HB1      ALA  29  -0.270  16.010  15.872
    4    HB3  ALA  29           HB2      ALA  29  -1.025  16.131  14.282
    5    HB2  ALA  29           HB3      ALA  29  -1.435  14.791  15.353

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LYS  30           H        LYS  30  -3.072  17.559  13.663
    2    HA   LYS  30           HA       LYS  30  -1.683  20.012  13.570
    3    HB2  LYS  30           HB2      LYS  30  -4.205  19.120  12.157
    4    HB3  LYS  30           HB3      LYS  30  -3.384  20.643  11.818
    5    HG2  LYS  30           HG2      LYS  30  -1.303  19.368  11.302
    6    HG3  LYS  30           HG3      LYS  30  -2.197  17.864  11.542
    7    HD2  LYS  30           HD2      LYS  30  -3.765  18.497   9.748
    8    HD3  LYS  30           HD3      LYS  30  -2.894  20.013   9.510
    9    HE2  LYS  30           HE2      LYS  30  -0.851  18.738   8.929
   10    HE3  LYS  30           HE3      LYS  30  -1.741  17.227   9.136
   11    HZ2  LYS  30           HZ1      LYS  30  -1.570  18.106   6.796
   12    HZ1  LYS  30           HZ2      LYS  30  -2.623  19.359   7.267
   13    HZ3  LYS  30           HZ3      LYS  30  -3.136  17.738   7.334

  No H/Q in entry =          13
  In of MODEL   84
    1    H    GLN  31           H        GLN  31  -4.778  19.132  14.978
    2    HA   GLN  31           HA       GLN  31  -5.561  21.882  15.437
    3    HB2  GLN  31           HB2      GLN  31  -6.724  19.424  16.752
    4    HB3  GLN  31           HB3      GLN  31  -7.495  20.991  16.510
    5    HG2  GLN  31           HG2      GLN  31  -6.777  20.226  13.919
    6    HG3  GLN  31           HG3      GLN  31  -7.292  18.716  14.661
    7   HE21  GLN  31          HE21      GLN  31  -8.712  20.286  12.563
    8   HE22  GLN  31          HE22      GLN  31 -10.228  20.665  13.221

  No H/Q in entry =           8
  In of MODEL   84
    1    H    GLY  32           H        GLY  32  -3.237  19.967  16.753
    2    HA3  GLY  32           HA2      GLY  32  -1.840  20.433  18.557
    3    HA2  GLY  32           HA3      GLY  32  -2.978  21.667  19.084

  No H/Q in entry =           3
  In of MODEL   84
    1    H    ASP  33           H        ASP  33  -4.380  18.620  18.412
    2    HA   ASP  33           HA       ASP  33  -4.789  18.151  21.290
    3    HB2  ASP  33           HB2      ASP  33  -6.187  17.138  18.809
    4    HB3  ASP  33           HB3      ASP  33  -6.530  16.520  20.423

  No H/Q in entry =           4
  In of MODEL   84
    1    H    PHE  34           H        PHE  34  -2.615  17.313  21.594
    2    HA   PHE  34           HA       PHE  34  -1.600  15.075  20.187
    3    HB2  PHE  34           HB2      PHE  34  -0.990  16.054  22.985
    4    HB3  PHE  34           HB3      PHE  34  -0.053  14.840  22.114
    5    HD1  PHE  34           HD1      PHE  34  -0.248  18.262  22.860
    6    HD2  PHE  34           HD2      PHE  34   0.601  15.575  19.617
    7    HE1  PHE  34           HE1      PHE  34   1.037  20.046  21.712
    8    HE2  PHE  34           HE2      PHE  34   1.881  17.361  18.474
    9    HZ   PHE  34           HZ       PHE  34   2.100  19.593  19.526

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ALA  35           H        ALA  35  -3.643  15.330  23.050
    2    HA   ALA  35           HA       ALA  35  -3.414  12.666  23.938
    3    HB3  ALA  35           HB1      ALA  35  -5.876  13.274  24.796
    4    HB1  ALA  35           HB2      ALA  35  -5.353  14.897  24.346
    5    HB2  ALA  35           HB3      ALA  35  -4.433  13.975  25.534

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ALA  36           H        ALA  36  -5.872  14.174  21.842
    2    HA   ALA  36           HA       ALA  36  -7.272  11.755  21.356
    3    HB1  ALA  36           HB1      ALA  36  -8.736  13.172  20.404
    4    HB3  ALA  36           HB2      ALA  36  -7.566  13.603  19.157
    5    HB2  ALA  36           HB3      ALA  36  -7.597  14.486  20.683

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ALA  37           H        ALA  37  -4.601  13.365  19.693
    2    HA   ALA  37           HA       ALA  37  -4.555  11.737  17.391
    3    HB3  ALA  37           HB1      ALA  37  -2.574  13.457  18.820
    4    HB2  ALA  37           HB2      ALA  37  -3.104  13.515  17.140
    5    HB1  ALA  37           HB3      ALA  37  -1.943  12.290  17.658

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LYS  38           H        LYS  38  -2.797  11.432  20.469
    2    HA   LYS  38           HA       LYS  38  -1.456   9.042  19.973
    3    HB2  LYS  38           HB2      LYS  38  -1.792  10.796  22.124
    4    HB3  LYS  38           HB3      LYS  38  -2.401   9.260  22.735
    5    HG2  LYS  38           HG2      LYS  38  -0.299   8.155  22.196
    6    HG3  LYS  38           HG3      LYS  38   0.300   9.607  21.387
    7    HD2  LYS  38           HD2      LYS  38   0.461  10.820  23.426
    8    HD3  LYS  38           HD3      LYS  38  -0.551   9.660  24.289
    9    HE2  LYS  38           HE2      LYS  38   1.806   9.357  24.908
   10    HE3  LYS  38           HE3      LYS  38   1.211   7.940  24.039
   11    HZ3  LYS  38           HZ1      LYS  38   2.509   8.373  22.260
   12    HZ2  LYS  38           HZ2      LYS  38   3.459   9.204  23.400
   13    HZ1  LYS  38           HZ3      LYS  38   2.374  10.060  22.410

  No H/Q in entry =          13
  In of MODEL   84
    1    H    ALA  39           H        ALA  39  -4.699   9.512  21.375
    2    HA   ALA  39           HA       ALA  39  -5.242   6.787  21.871
    3    HB3  ALA  39           HB1      ALA  39  -7.413   8.721  21.109
    4    HB2  ALA  39           HB2      ALA  39  -6.517   8.948  22.611
    5    HB1  ALA  39           HB3      ALA  39  -7.424   7.459  22.342

  No H/Q in entry =           5
  In of MODEL   84
    1    H    MET  40           H        MET  40  -5.838   8.806  19.030
    2    HA   MET  40           HA       MET  40  -7.301   6.869  17.563
    3    HB2  MET  40           HB2      MET  40  -5.707   9.278  16.667
    4    HB3  MET  40           HB3      MET  40  -6.726   8.316  15.593
    5    HG2  MET  40           HG2      MET  40  -7.770   9.550  18.155
    6    HG3  MET  40           HG3      MET  40  -7.832  10.389  16.607
    7    HE3  MET  40           HE1      MET  40 -10.404   8.760  14.536
    8    HE2  MET  40           HE2      MET  40  -8.652   8.889  14.389
    9    HE1  MET  40           HE3      MET  40  -9.579  10.246  15.027

  No H/Q in entry =           9
  In of MODEL   84
    1    H    MET  41           H        MET  41  -3.815   7.630  17.690
    2    HA   MET  41           HA       MET  41  -3.044   5.887  15.584
    3    HB2  MET  41           HB2      MET  41  -1.433   6.557  18.060
    4    HB3  MET  41           HB3      MET  41  -0.811   5.918  16.542
    5    HG2  MET  41           HG2      MET  41  -1.982   8.096  15.545
    6    HG3  MET  41           HG3      MET  41  -1.750   8.680  17.192
    7    HE2  MET  41           HE1      MET  41   1.182   6.601  17.548
    8    HE1  MET  41           HE2      MET  41   0.384   7.886  18.450
    9    HE3  MET  41           HE3      MET  41   2.006   8.143  17.809

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ASP  42           H        ASP  42  -3.427   5.400  19.068
    2    HA   ASP  42           HA       ASP  42  -2.373   2.813  19.220
    3    HB2  ASP  42           HB2      ASP  42  -3.260   4.560  21.048
    4    HB3  ASP  42           HB3      ASP  42  -4.680   3.525  20.971

  No H/Q in entry =           4
  In of MODEL   84
    1    H    GLN  43           H        GLN  43  -5.714   3.895  18.721
    2    HA   GLN  43           HA       GLN  43  -6.839   1.300  18.517
    3    HB2  GLN  43           HB2      GLN  43  -7.781   3.949  17.397
    4    HB3  GLN  43           HB3      GLN  43  -8.733   2.463  17.369
    5    HG2  GLN  43           HG2      GLN  43  -8.440   2.336  19.876
    6    HG3  GLN  43           HG3      GLN  43  -7.727   3.946  19.811
    7   HE21  GLN  43          HE21      GLN  43  -9.908   4.005  21.310
    8   HE22  GLN  43          HE22      GLN  43 -11.272   4.574  20.479

  No H/Q in entry =           8
  In of MODEL   84
    1    H    SER  44           H        SER  44  -5.513   3.531  16.114
    2    HA   SER  44           HA       SER  44  -6.202   2.050  13.819
    3    HB2  SER  44           HB2      SER  44  -4.964   4.441  14.272
    4    HB3  SER  44           HB3      SER  44  -3.602   3.457  13.739
    5    HG   SER  44           HG       SER  44  -4.720   4.427  11.979

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ARG  45           H        ARG  45  -3.325   1.951  15.901
    2    HA   ARG  45           HA       ARG  45  -1.830   0.012  14.513
    3    HB2  ARG  45           HB2      ARG  45  -1.000   1.433  16.387
    4    HB3  ARG  45           HB3      ARG  45  -1.986   0.491  17.504
    5    HG2  ARG  45           HG2      ARG  45  -0.739  -1.557  16.855
    6    HG3  ARG  45           HG3      ARG  45   0.271  -0.590  15.781
    7    HD2  ARG  45           HD2      ARG  45   0.994   0.789  17.742
    8    HD3  ARG  45           HD3      ARG  45   0.079  -0.296  18.811
    9    HE   ARG  45           HE       ARG  45   1.790  -1.874  17.226
   10   HH21  ARG  45          HH11      ARG  45   3.696  -2.686  18.062
   11   HH22  ARG  45          HH12      ARG  45   4.462  -1.899  19.396
   12   HH11  ARG  45          HH21      ARG  45   2.074   0.586  19.625
   13   HH12  ARG  45          HH22      ARG  45   3.543  -0.044  20.279

  No H/Q in entry =          13
  In of MODEL   84
    1    H    MET  46           H        MET  46  -4.227  -0.335  17.110
    2    HA   MET  46           HA       MET  46  -4.040  -3.134  17.407
    3    HB2  MET  46           HB2      MET  46  -6.221  -1.143  18.015
    4    HB3  MET  46           HB3      MET  46  -6.422  -2.866  18.344
    5    HG2  MET  46           HG2      MET  46  -4.446  -2.864  19.773
    6    HG3  MET  46           HG3      MET  46  -4.124  -1.183  19.382
    7    HE3  MET  46           HE1      MET  46  -7.822  -2.864  20.381
    8    HE2  MET  46           HE2      MET  46  -7.276  -3.050  22.044
    9    HE1  MET  46           HE3      MET  46  -6.345  -3.769  20.733

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ALA  47           H        ALA  47  -6.072  -1.123  15.318
    2    HA   ALA  47           HA       ALA  47  -7.675  -3.181  14.244
    3    HB3  ALA  47           HB1      ALA  47  -8.370  -0.947  13.835
    4    HB1  ALA  47           HB2      ALA  47  -7.875  -1.572  12.262
    5    HB2  ALA  47           HB3      ALA  47  -6.803  -0.499  13.164

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LEU  48           H        LEU  48  -4.564  -1.849  13.201
    2    HA   LEU  48           HA       LEU  48  -4.271  -3.429  10.854
    3    HB2  LEU  48           HB2      LEU  48  -2.224  -2.144  12.669
    4    HB3  LEU  48           HB3      LEU  48  -1.849  -2.857  11.099
    5    HG   LEU  48           HG       LEU  48  -3.886  -0.653  11.495
    6   HD13  LEU  48          HD11      LEU  48  -1.770   0.234  12.166
    7   HD12  LEU  48          HD12      LEU  48  -2.047   0.792  10.516
    8   HD11  LEU  48          HD13      LEU  48  -0.942  -0.549  10.820
    9   HD22  LEU  48          HD21      LEU  48  -4.349  -1.633   9.415
   10   HD21  LEU  48          HD22      LEU  48  -2.664  -2.057   9.120
   11   HD23  LEU  48          HD23      LEU  48  -3.193  -0.380   8.966

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ASN  49           H        ASN  49  -3.227  -3.832  14.199
    2    HA   ASN  49           HA       ASN  49  -1.611  -6.084  13.862
    3    HB2  ASN  49           HB2      ASN  49  -1.658  -4.747  15.914
    4    HB3  ASN  49           HB3      ASN  49  -3.305  -5.266  16.239
    5   HD21  ASN  49          HD21      ASN  49  -2.743  -6.331  18.230
    6   HD22  ASN  49          HD22      ASN  49  -1.823  -7.757  18.258

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLU  50           H        GLU  50  -5.081  -5.830  14.531
    2    HA   GLU  50           HA       GLU  50  -5.579  -8.633  14.629
    3    HB2  GLU  50           HB2      GLU  50  -7.175  -6.957  15.510
    4    HB3  GLU  50           HB3      GLU  50  -7.469  -6.388  13.865
    5    HG2  GLU  50           HG2      GLU  50  -8.322  -8.586  13.218
    6    HG3  GLU  50           HG3      GLU  50  -7.939  -9.234  14.809

  No H/Q in entry =           6
  In of MODEL   84
    1    H    ALA  51           H        ALA  51  -5.656  -6.225  12.042
    2    HA   ALA  51           HA       ALA  51  -6.631  -7.950  10.012
    3    HB2  ALA  51           HB1      ALA  51  -6.419  -6.132   8.650
    4    HB1  ALA  51           HB2      ALA  51  -4.781  -5.777   9.202
    5    HB3  ALA  51           HB3      ALA  51  -6.169  -5.276  10.171

  No H/Q in entry =           5
  In of MODEL   84
    1    H    HIS  52           H        HIS  52  -3.346  -7.032  11.003
    2    HA   HIS  52           HA       HIS  52  -1.938  -8.507   9.050
    3    HB2  HIS  52           HB2      HIS  52  -0.881  -6.789  10.456
    4    HB3  HIS  52           HB3      HIS  52  -1.106  -7.809  11.878
    5    HD1  HIS  52           HD1      HIS  52   0.005 -10.357  11.511
    6    HD2  HIS  52           HD2      HIS  52   1.574  -7.206   9.278
    7    HE1  HIS  52           HE1      HIS  52   2.292 -11.106  10.724
    8    HE2  HIS  52           HE2      HIS  52   3.263  -9.196   9.360

  No H/Q in entry =           8
  In of MODEL   84
    1    H    LEU  53           H        LEU  53  -3.150  -9.402  12.257
    2    HA   LEU  53           HA       LEU  53  -1.942 -11.942  12.443
    3    HB2  LEU  53           HB2      LEU  53  -4.433 -10.775  13.658
    4    HB3  LEU  53           HB3      LEU  53  -3.967 -12.450  13.945
    5    HG   LEU  53           HG       LEU  53  -2.085 -10.119  14.436
    6   HD13  LEU  53          HD11      LEU  53  -3.926  -9.763  15.924
    7   HD12  LEU  53          HD12      LEU  53  -2.669 -10.553  16.873
    8   HD11  LEU  53          HD13      LEU  53  -4.048 -11.480  16.291
    9   HD22  LEU  53          HD21      LEU  53  -0.785 -12.088  14.384
   10   HD21  LEU  53          HD22      LEU  53  -2.075 -13.068  15.071
   11   HD23  LEU  53          HD23      LEU  53  -1.178 -11.963  16.095

  No H/Q in entry =          11
  In of MODEL   84
    1    H    VAL  54           H        VAL  54  -5.055 -10.920  11.081
    2    HA   VAL  54           HA       VAL  54  -5.959 -13.514  10.383
    3    HB   VAL  54           HB       VAL  54  -6.614 -10.780   9.258
    4   HG12  VAL  54          HG11      VAL  54  -8.710 -12.162   8.438
    5   HG11  VAL  54          HG12      VAL  54  -7.594 -13.524   8.507
    6   HG13  VAL  54          HG13      VAL  54  -7.238 -12.144   7.470
    7   HG22  VAL  54          HG21      VAL  54  -7.524 -10.829  11.408
    8   HG21  VAL  54          HG22      VAL  54  -7.771 -12.573  11.382
    9   HG23  VAL  54          HG23      VAL  54  -8.855 -11.517  10.478

  No H/Q in entry =           9
  In of MODEL   84
    1    H    GLN  55           H        GLN  55  -4.094 -11.050   8.605
    2    HA   GLN  55           HA       GLN  55  -3.956 -12.504   6.182
    3    HB2  GLN  55           HB2      GLN  55  -3.359 -10.237   6.002
    4    HB3  GLN  55           HB3      GLN  55  -2.250 -10.315   7.368
    5    HG2  GLN  55           HG2      GLN  55  -0.528 -11.150   6.091
    6    HG3  GLN  55           HG3      GLN  55  -1.597 -12.125   5.092
    7   HE21  GLN  55          HE21      GLN  55  -1.614 -11.427   2.973
    8   HE22  GLN  55          HE22      GLN  55  -1.421  -9.820   2.469

  No H/Q in entry =           8
  In of MODEL   84
    1    H    THR  56           H        THR  56  -1.853 -12.488   9.066
    2    HA   THR  56           HA       THR  56   0.231 -14.076   8.145
    3    HB   THR  56           HB       THR  56  -1.010 -14.350  10.890
    4    HG1  THR  56           HG1      THR  56   0.392 -12.283   9.667
    5   HG21  THR  56          HG21      THR  56   0.926 -15.852   9.999
    6   HG23  THR  56          HG22      THR  56   1.102 -15.096  11.583
    7   HG22  THR  56          HG23      THR  56   1.911 -14.401  10.179

  No H/Q in entry =           7
  In of MODEL   84
    1    H    LYS  57           H        LYS  57  -2.887 -15.127   9.500
    2    HA   LYS  57           HA       LYS  57  -2.433 -17.921   9.245
    3    HB2  LYS  57           HB2      LYS  57  -4.256 -16.843  10.593
    4    HB3  LYS  57           HB3      LYS  57  -5.047 -16.386   9.092
    5    HG2  LYS  57           HG2      LYS  57  -4.343 -19.254   9.360
    6    HG3  LYS  57           HG3      LYS  57  -5.618 -18.669  10.428
    7    HD2  LYS  57           HD2      LYS  57  -6.849 -17.781   8.474
    8    HD3  LYS  57           HD3      LYS  57  -5.580 -18.379   7.404
    9    HE2  LYS  57           HE2      LYS  57  -6.033 -20.693   8.151
   10    HE3  LYS  57           HE3      LYS  57  -7.296 -20.112   9.232
   11    HZ2  LYS  57           HZ1      LYS  57  -7.275 -20.264   6.306
   12    HZ1  LYS  57           HZ2      LYS  57  -8.175 -19.028   7.046
   13    HZ3  LYS  57           HZ3      LYS  57  -8.511 -20.655   7.403

  No H/Q in entry =          13
  In of MODEL   84
    1    H    LEU  58           H        LEU  58  -3.769 -15.474   7.076
    2    HA   LEU  58           HA       LEU  58  -4.563 -17.294   5.062
    3    HB2  LEU  58           HB2      LEU  58  -3.965 -14.343   4.939
    4    HB3  LEU  58           HB3      LEU  58  -4.624 -15.277   3.594
    5    HG   LEU  58           HG       LEU  58  -5.908 -15.111   6.341
    6   HD11  LEU  58          HD11      LEU  58  -6.209 -13.456   3.855
    7   HD13  LEU  58          HD12      LEU  58  -6.203 -12.954   5.546
    8   HD12  LEU  58          HD13      LEU  58  -7.622 -13.749   4.869
    9   HD22  LEU  58          HD21      LEU  58  -6.864 -17.020   5.463
   10   HD21  LEU  58          HD22      LEU  58  -6.523 -16.561   3.794
   11   HD23  LEU  58          HD23      LEU  58  -7.890 -15.842   4.646

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  59           H        ILE  59  -1.432 -16.077   5.932
    2    HA   ILE  59           HA       ILE  59  -0.329 -16.792   3.294
    3    HB   ILE  59           HB       ILE  59   0.432 -14.730   4.871
    4   HG12  ILE  59          HG12      ILE  59   2.540 -16.365   3.447
    5   HG13  ILE  59          HG13      ILE  59   1.335 -15.446   2.582
    6   HG22  ILE  59          HG21      ILE  59   2.535 -16.758   5.564
    7   HG21  ILE  59          HG22      ILE  59   1.166 -16.529   6.628
    8   HG23  ILE  59          HG23      ILE  59   2.259 -15.189   6.281
    9   HD12  ILE  59          HD11      ILE  59   3.507 -14.219   2.965
   10   HD11  ILE  59          HD12      ILE  59   3.124 -14.233   4.684
   11   HD13  ILE  59          HD13      ILE  59   2.078 -13.374   3.554

  No H/Q in entry =          11
  In of MODEL   84
    1    H    GLU  60           H        GLU  60  -0.341 -17.911   6.658
    2    HA   GLU  60           HA       GLU  60   1.695 -19.882   6.389
    3    HB2  GLU  60           HB2      GLU  60   1.034 -19.206   8.593
    4    HB3  GLU  60           HB3      GLU  60  -0.648 -19.629   8.285
    5    HG2  GLU  60           HG2      GLU  60   0.512 -21.354   9.652
    6    HG3  GLU  60           HG3      GLU  60  -0.043 -22.000   8.109

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLY  61           H        GLY  61  -1.814 -19.988   5.897
    2    HA3  GLY  61           HA2      GLY  61  -1.558 -22.776   4.929
    3    HA2  GLY  61           HA3      GLY  61  -3.046 -22.047   5.523

  No H/Q in entry =           3
  In of MODEL   84
    1    H    ASP  62           H        ASP  62  -0.819 -20.449   3.331
    2    HA   ASP  62           HA       ASP  62  -2.892 -19.881   1.452
    3    HB2  ASP  62           HB2      ASP  62  -1.061 -18.841   0.156
    4    HB3  ASP  62           HB3      ASP  62  -1.053 -18.328   1.840

  No H/Q in entry =           4
  In of MODEL   84
    1    H    ALA  63           H        ALA  63  -3.061 -22.572   1.510
    2    HA   ALA  63           HA       ALA  63  -1.402 -24.014  -0.289
    3    HB2  ALA  63           HB1      ALA  63  -4.179 -24.438   0.758
    4    HB1  ALA  63           HB2      ALA  63  -2.705 -25.339   1.113
    5    HB3  ALA  63           HB3      ALA  63  -3.489 -25.515  -0.458

  No H/Q in entry =           5
  In of MODEL   84
    1    H    GLY  64           H        GLY  64  -4.354 -22.122  -0.704
    2    HA3  GLY  64           HA2      GLY  64  -5.332 -21.193  -2.563
    3    HA2  GLY  64           HA3      GLY  64  -3.835 -21.505  -3.427

  No H/Q in entry =           3
  In of MODEL   84
    1    H    GLU  65           H        GLU  65  -5.269 -21.985  -5.270
    2    HA   GLU  65           HA       GLU  65  -7.121 -24.116  -5.196
    3    HB2  GLU  65           HB2      GLU  65  -5.651 -22.830  -7.493
    4    HB3  GLU  65           HB3      GLU  65  -6.899 -24.059  -7.702
    5    HG2  GLU  65           HG2      GLU  65  -8.519 -22.656  -6.518
    6    HG3  GLU  65           HG3      GLU  65  -7.279 -21.441  -6.222

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLY  66           H        GLY  66  -3.746 -23.983  -6.057
    2    HA3  GLY  66           HA2      GLY  66  -3.631 -26.892  -6.457
    3    HA2  GLY  66           HA3      GLY  66  -2.460 -25.737  -7.063

  No H/Q in entry =           3
  In of MODEL   84
    1    H    LYS  67           H        LYS  67  -1.478 -27.876  -5.881
    2    HA   LYS  67           HA       LYS  67  -1.182 -27.841  -3.093
    3    HB2  LYS  67           HB2      LYS  67   0.300 -29.142  -5.345
    4    HB3  LYS  67           HB3      LYS  67   0.887 -29.288  -3.683
    5    HG2  LYS  67           HG2      LYS  67  -0.781 -31.084  -4.501
    6    HG3  LYS  67           HG3      LYS  67  -1.105 -30.327  -2.943
    7    HD2  LYS  67           HD2      LYS  67  -2.788 -28.907  -3.881
    8    HD3  LYS  67           HD3      LYS  67  -2.320 -29.333  -5.529
    9    HE2  LYS  67           HE2      LYS  67  -3.266 -31.461  -5.394
   10    HE3  LYS  67           HE3      LYS  67  -3.165 -31.503  -3.635
   11    HZ2  LYS  67           HZ1      LYS  67  -5.440 -31.139  -4.683
   12    HZ1  LYS  67           HZ2      LYS  67  -4.904 -29.565  -5.030
   13    HZ3  LYS  67           HZ3      LYS  67  -4.989 -30.102  -3.420

  No H/Q in entry =          13
  In of MODEL   84
    1    H    MET  68           H        MET  68   0.894 -26.548  -5.611
    2    HA   MET  68           HA       MET  68   2.759 -25.393  -3.682
    3    HB2  MET  68           HB2      MET  68   2.790 -25.608  -6.692
    4    HB3  MET  68           HB3      MET  68   4.053 -24.818  -5.746
    5    HG2  MET  68           HG2      MET  68   3.168 -27.694  -5.374
    6    HG3  MET  68           HG3      MET  68   4.602 -27.195  -6.274
    7    HE1  MET  68           HE1      MET  68   6.373 -25.997  -5.581
    8    HE3  MET  68           HE2      MET  68   7.124 -26.026  -3.986
    9    HE2  MET  68           HE3      MET  68   5.956 -24.767  -4.379

  No H/Q in entry =           9
  In of MODEL   84
    1    H    LYS  69           H        LYS  69   0.321 -24.331  -5.997
    2    HA   LYS  69           HA       LYS  69   1.113 -21.598  -5.993
    3    HB2  LYS  69           HB2      LYS  69  -0.113 -22.592  -7.859
    4    HB3  LYS  69           HB3      LYS  69  -1.541 -22.745  -6.829
    5    HG2  LYS  69           HG2      LYS  69  -1.620 -20.342  -6.488
    6    HG3  LYS  69           HG3      LYS  69  -0.108 -20.131  -7.371
    7    HD2  LYS  69           HD2      LYS  69  -1.187 -21.024  -9.412
    8    HD3  LYS  69           HD3      LYS  69  -2.704 -21.190  -8.525
    9    HE2  LYS  69           HE2      LYS  69  -1.215 -18.569  -8.835
   10    HE3  LYS  69           HE3      LYS  69  -2.547 -19.071  -9.876
   11    HZ2  LYS  69           HZ1      LYS  69  -2.863 -17.686  -7.620
   12    HZ1  LYS  69           HZ2      LYS  69  -3.050 -19.268  -7.031
   13    HZ3  LYS  69           HZ3      LYS  69  -4.054 -18.698  -8.278

  No H/Q in entry =          13
  In of MODEL   84
    1    H    VAL  70           H        VAL  70   0.057 -19.745  -5.194
    2    HA   VAL  70           HA       VAL  70  -1.463 -20.198  -2.688
    3    HB   VAL  70           HB       VAL  70  -0.583 -17.979  -1.996
    4   HG11  VAL  70          HG11      VAL  70   1.404 -20.100  -2.834
    5   HG13  VAL  70          HG12      VAL  70   0.679 -19.863  -1.243
    6   HG12  VAL  70          HG13      VAL  70   1.859 -18.705  -1.855
    7   HG23  VAL  70          HG21      VAL  70   1.344 -17.047  -3.401
    8   HG22  VAL  70          HG22      VAL  70  -0.261 -16.868  -4.108
    9   HG21  VAL  70          HG23      VAL  70   0.818 -18.133  -4.689

  No H/Q in entry =           9
  In of MODEL   84
    1    H    SER  71           H        SER  71  -3.032 -18.528  -2.152
    2    HA   SER  71           HA       SER  71  -4.873 -17.991  -4.240
    3    HB2  SER  71           HB2      SER  71  -5.492 -18.177  -1.811
    4    HB3  SER  71           HB3      SER  71  -4.679 -16.643  -1.521
    5    HG   SER  71           HG       SER  71  -6.829 -16.215  -1.883

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LEU  72           H        LEU  72  -5.088 -16.317  -5.557
    2    HA   LEU  72           HA       LEU  72  -2.986 -14.496  -6.030
    3    HB2  LEU  72           HB2      LEU  72  -5.851 -14.554  -6.977
    4    HB3  LEU  72           HB3      LEU  72  -4.655 -13.394  -7.550
    5    HG   LEU  72           HG       LEU  72  -4.236 -16.397  -7.685
    6   HD11  LEU  72          HD11      LEU  72  -5.262 -14.498  -9.818
    7   HD13  LEU  72          HD12      LEU  72  -6.195 -15.774  -9.036
    8   HD12  LEU  72          HD13      LEU  72  -4.835 -16.190 -10.077
    9   HD22  LEU  72          HD21      LEU  72  -2.128 -15.399  -7.956
   10   HD21  LEU  72          HD22      LEU  72  -2.780 -13.972  -8.746
   11   HD23  LEU  72          HD23      LEU  72  -2.692 -15.500  -9.620

  No H/Q in entry =          11
  In of MODEL   84
    1    H    VAL  73           H        VAL  73  -6.082 -14.157  -4.400
    2    HA   VAL  73           HA       VAL  73  -6.137 -11.388  -4.038
    3    HB   VAL  73           HB       VAL  73  -7.848 -11.762  -2.445
    4   HG13  VAL  73          HG11      VAL  73  -9.290 -13.298  -3.617
    5   HG12  VAL  73          HG12      VAL  73  -7.910 -14.157  -4.298
    6   HG11  VAL  73          HG13      VAL  73  -8.269 -12.512  -4.821
    7   HG21  VAL  73          HG21      VAL  73  -6.398 -14.356  -2.031
    8   HG23  VAL  73          HG22      VAL  73  -8.127 -14.282  -1.692
    9   HG22  VAL  73          HG23      VAL  73  -7.014 -13.220  -0.831

  No H/Q in entry =           9
  In of MODEL   84
    1    H    LEU  74           H        LEU  74  -4.191 -13.755  -2.463
    2    HA   LEU  74           HA       LEU  74  -3.785 -12.624   0.064
    3    HB2  LEU  74           HB2      LEU  74  -2.991 -14.835  -0.434
    4    HB3  LEU  74           HB3      LEU  74  -1.949 -14.221  -1.718
    5    HG   LEU  74           HG       LEU  74  -0.637 -12.958  -0.042
    6   HD12  LEU  74          HD11      LEU  74  -1.096 -13.684   2.399
    7   HD11  LEU  74          HD12      LEU  74  -2.691 -14.165   1.816
    8   HD13  LEU  74          HD13      LEU  74  -2.179 -12.481   1.696
    9   HD21  LEU  74          HD21      LEU  74  -0.430 -15.525  -0.660
   10   HD23  LEU  74          HD22      LEU  74  -0.832 -15.701   1.034
   11   HD22  LEU  74          HD23      LEU  74   0.594 -14.799   0.578

  No H/Q in entry =          11
  In of MODEL   84
    1    H    VAL  75           H        VAL  75  -1.895 -12.210  -2.890
    2    HA   VAL  75           HA       VAL  75  -0.105 -10.284  -1.871
    3    HB   VAL  75           HB       VAL  75  -1.058 -10.757  -4.697
    4   HG12  VAL  75          HG11      VAL  75   1.016  -9.447  -5.301
    5   HG11  VAL  75          HG12      VAL  75   1.194  -9.036  -3.602
    6   HG13  VAL  75          HG13      VAL  75  -0.205  -8.468  -4.497
    7   HG22  VAL  75          HG21      VAL  75   1.079 -11.938  -4.903
    8   HG21  VAL  75          HG22      VAL  75   0.166 -12.617  -3.555
    9   HG23  VAL  75          HG23      VAL  75   1.506 -11.511  -3.245

  No H/Q in entry =           9
  In of MODEL   84
    1    H    GLU  76           H        GLU  76  -3.256  -9.941  -3.528
    2    HA   GLU  76           HA       GLU  76  -3.319  -7.127  -3.617
    3    HB2  GLU  76           HB2      GLU  76  -4.972  -8.564  -4.787
    4    HB3  GLU  76           HB3      GLU  76  -5.621  -9.076  -3.238
    5    HG2  GLU  76           HG2      GLU  76  -7.084  -7.364  -4.103
    6    HG3  GLU  76           HG3      GLU  76  -6.207  -6.655  -2.762

  No H/Q in entry =           6
  In of MODEL   84
    1    H    ALA  77           H        ALA  77  -4.421  -9.370  -1.087
    2    HA   ALA  77           HA       ALA  77  -5.386  -7.379   0.680
    3    HB1  ALA  77           HB1      ALA  77  -4.254 -10.101   1.374
    4    HB2  ALA  77           HB2      ALA  77  -5.922  -9.791   0.894
    5    HB3  ALA  77           HB3      ALA  77  -5.297  -9.112   2.395

  No H/Q in entry =           5
  In of MODEL   84
    1    H    GLN  78           H        GLN  78  -2.233  -8.916   0.309
    2    HA   GLN  78           HA       GLN  78  -0.979  -7.761   2.565
    3    HB2  GLN  78           HB2      GLN  78  -0.112  -9.693   1.200
    4    HB3  GLN  78           HB3      GLN  78   0.323  -8.539  -0.058
    5    HG2  GLN  78           HG2      GLN  78   1.776  -7.348   1.533
    6    HG3  GLN  78           HG3      GLN  78   1.345  -8.500   2.794
    7   HE21  GLN  78          HE21      GLN  78   4.068  -8.209   1.956
    8   HE22  GLN  78          HE22      GLN  78   4.537  -9.632   1.160

  No H/Q in entry =           8
  In of MODEL   84
    1    H    LEU  79           H        LEU  79  -1.349  -6.687  -0.777
    2    HA   LEU  79           HA       LEU  79   0.331  -4.455  -0.754
    3    HB2  LEU  79           HB2      LEU  79  -0.693  -5.255  -2.811
    4    HB3  LEU  79           HB3      LEU  79  -2.298  -4.871  -2.201
    5    HG   LEU  79           HG       LEU  79  -1.761  -2.482  -2.165
    6   HD13  LEU  79          HD11      LEU  79   0.478  -2.235  -1.651
    7   HD12  LEU  79          HD12      LEU  79   0.527  -1.939  -3.389
    8   HD11  LEU  79          HD13      LEU  79   0.986  -3.519  -2.749
    9   HD23  LEU  79          HD21      LEU  79  -1.127  -2.270  -4.716
   10   HD22  LEU  79          HD22      LEU  79  -2.651  -3.025  -4.261
   11   HD21  LEU  79          HD23      LEU  79  -1.276  -4.028  -4.709

  No H/Q in entry =          11
  In of MODEL   84
    1    H    HIS  80           H        HIS  80  -3.136  -4.630   0.071
    2    HA   HIS  80           HA       HIS  80  -3.334  -1.877   0.747
    3    HB2  HIS  80           HB2      HIS  80  -5.030  -4.292   1.055
    4    HB3  HIS  80           HB3      HIS  80  -5.354  -2.957   2.164
    5    HD1  HIS  80           HD1      HIS  80  -6.975  -1.321   1.264
    6    HD2  HIS  80           HD2      HIS  80  -4.777  -3.114  -1.791
    7    HE1  HIS  80           HE1      HIS  80  -7.817  -0.316  -0.911
    8    HE2  HIS  80           HE2      HIS  80  -6.484  -1.403  -2.783

  No H/Q in entry =           8
  In of MODEL   84
    1    H    LEU  81           H        LEU  81  -2.839  -4.780   2.727
    2    HA   LEU  81           HA       LEU  81  -2.830  -3.443   5.217
    3    HB2  LEU  81           HB2      LEU  81  -1.605  -6.053   4.326
    4    HB3  LEU  81           HB3      LEU  81  -1.581  -5.502   6.003
    5    HG   LEU  81           HG       LEU  81  -4.126  -5.753   4.373
    6   HD12  LEU  81          HD11      LEU  81  -4.424  -7.826   5.911
    7   HD11  LEU  81          HD12      LEU  81  -2.672  -7.752   6.098
    8   HD13  LEU  81          HD13      LEU  81  -3.380  -7.977   4.498
    9   HD23  LEU  81          HD21      LEU  81  -4.969  -5.969   6.873
   10   HD22  LEU  81          HD22      LEU  81  -4.647  -4.376   6.190
   11   HD21  LEU  81          HD23      LEU  81  -3.459  -5.139   7.247

  No H/Q in entry =          11
  In of MODEL   84
    1    H    MET  82           H        MET  82  -0.147  -4.332   3.043
    2    HA   MET  82           HA       MET  82   1.934  -3.441   4.731
    3    HB2  MET  82           HB2      MET  82   1.720  -3.770   1.737
    4    HB3  MET  82           HB3      MET  82   3.201  -3.200   2.503
    5    HG2  MET  82           HG2      MET  82   1.799  -5.795   3.216
    6    HG3  MET  82           HG3      MET  82   3.170  -5.678   2.117
    7    HE3  MET  82           HE1      MET  82   6.184  -4.945   4.104
    8    HE2  MET  82           HE2      MET  82   5.259  -3.577   3.492
    9    HE1  MET  82           HE3      MET  82   5.351  -5.063   2.550

  No H/Q in entry =           9
  In of MODEL   84
    1    H    THR  83           H        THR  83   0.110  -1.791   2.181
    2    HA   THR  83           HA       THR  83   1.518   0.659   2.279
    3    HB   THR  83           HB       THR  83  -0.660   1.585   1.296
    4    HG1  THR  83           HG1      THR  83  -2.308   0.286   1.184
    5   HG22  THR  83          HG21      THR  83  -0.386  -0.224  -0.712
    6   HG21  THR  83          HG22      THR  83   1.114  -0.518   0.163
    7   HG23  THR  83          HG23      THR  83   0.751   1.098  -0.445

  No H/Q in entry =           7
  In of MODEL   84
    1    H    SER  84           H        SER  84  -1.487  -0.385   3.875
    2    HA   SER  84           HA       SER  84  -1.987   2.039   5.230
    3    HB2  SER  84           HB2      SER  84  -2.815  -0.803   5.782
    4    HB3  SER  84           HB3      SER  84  -3.311   0.533   6.821
    5    HG   SER  84           HG       SER  84  -3.769   0.231   4.027

  No H/Q in entry =           5
  In of MODEL   84
    1    H    MET  85           H        MET  85  -0.273  -0.896   6.347
    2    HA   MET  85           HA       MET  85   0.246   0.020   8.955
    3    HB2  MET  85           HB2      MET  85   0.541  -2.321   8.261
    4    HB3  MET  85           HB3      MET  85   1.928  -1.848   7.279
    5    HG2  MET  85           HG2      MET  85   3.081  -1.015   9.297
    6    HG3  MET  85           HG3      MET  85   1.690  -1.475  10.280
    7    HE3  MET  85           HE1      MET  85   3.409  -3.625   7.203
    8    HE2  MET  85           HE2      MET  85   4.780  -4.098   8.205
    9    HE1  MET  85           HE3      MET  85   4.416  -2.391   7.970

  No H/Q in entry =           9
  In of MODEL   84
    1    H    LEU  86           H        LEU  86   2.180   0.291   6.005
    2    HA   LEU  86           HA       LEU  86   4.393   1.599   7.166
    3    HB2  LEU  86           HB2      LEU  86   4.202   0.526   4.853
    4    HB3  LEU  86           HB3      LEU  86   3.393   2.009   4.347
    5    HG   LEU  86           HG       LEU  86   5.420   3.253   5.332
    6   HD11  LEU  86          HD11      LEU  86   6.128   0.639   6.121
    7   HD13  LEU  86          HD12      LEU  86   7.130   2.084   6.225
    8   HD12  LEU  86          HD13      LEU  86   7.240   1.042   4.809
    9   HD23  LEU  86          HD21      LEU  86   6.138   1.500   2.974
   10   HD22  LEU  86          HD22      LEU  86   6.530   3.197   3.244
   11   HD21  LEU  86          HD23      LEU  86   4.878   2.729   2.843

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ALA  87           H        ALA  87   1.479   2.846   5.587
    2    HA   ALA  87           HA       ALA  87   2.071   5.576   5.682
    3    HB1  ALA  87           HB1      ALA  87  -0.237   3.949   5.134
    4    HB3  ALA  87           HB2      ALA  87   0.073   5.612   4.641
    5    HB2  ALA  87           HB3      ALA  87  -0.721   5.283   6.183

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ARG  88           H        ARG  88   0.383   3.563   8.064
    2    HA   ARG  88           HA       ARG  88  -0.130   5.605   9.919
    3    HB2  ARG  88           HB2      ARG  88  -1.067   3.251   9.976
    4    HB3  ARG  88           HB3      ARG  88   0.475   2.750  10.680
    5    HG2  ARG  88           HG2      ARG  88  -0.004   4.817  12.308
    6    HG3  ARG  88           HG3      ARG  88  -1.670   4.492  11.851
    7    HD2  ARG  88           HD2      ARG  88  -1.776   2.638  13.090
    8    HD3  ARG  88           HD3      ARG  88  -0.186   2.060  12.556
    9    HE   ARG  88           HE       ARG  88  -0.721   3.312  15.016
   10   HH21  ARG  88          HH11      ARG  88   0.836   4.321  16.258
   11   HH22  ARG  88          HH12      ARG  88   2.355   4.752  15.555
   12   HH11  ARG  88          HH21      ARG  88   1.560   3.507  12.439
   13   HH12  ARG  88          HH22      ARG  88   2.773   4.275  13.405

  No H/Q in entry =          13
  In of MODEL   84
    1    H    GLU  89           H        GLU  89   2.668   3.390   9.687
    2    HA   GLU  89           HA       GLU  89   3.929   4.271  12.034
    3    HB2  GLU  89           HB2      GLU  89   4.590   2.258  10.683
    4    HB3  GLU  89           HB3      GLU  89   5.364   3.358   9.540
    5    HG2  GLU  89           HG2      GLU  89   6.848   4.200  11.287
    6    HG3  GLU  89           HG3      GLU  89   6.015   3.238  12.504

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LEU  90           H        LEU  90   4.244   5.442   8.711
    2    HA   LEU  90           HA       LEU  90   6.172   7.443   9.304
    3    HB2  LEU  90           HB2      LEU  90   4.166   7.117   7.076
    4    HB3  LEU  90           HB3      LEU  90   5.395   8.390   7.102
    5    HG   LEU  90           HG       LEU  90   6.073   5.453   7.424
    6   HD12  LEU  90          HD11      LEU  90   6.821   5.697   4.986
    7   HD11  LEU  90          HD12      LEU  90   5.804   7.136   4.943
    8   HD13  LEU  90          HD13      LEU  90   5.086   5.561   5.280
    9   HD22  LEU  90          HD21      LEU  90   7.968   6.603   8.111
   10   HD21  LEU  90          HD22      LEU  90   7.616   8.011   7.109
   11   HD23  LEU  90          HD23      LEU  90   8.278   6.551   6.377

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  91           H        ILE  91   2.633   7.453   9.156
    2    HA   ILE  91           HA       ILE  91   2.285  10.223   9.617
    3    HB   ILE  91           HB       ILE  91   0.499   7.842  10.150
    4   HG12  ILE  91          HG12      ILE  91   0.246  10.130   8.174
    5   HG13  ILE  91          HG13      ILE  91   1.109   8.639   7.797
    6   HG22  ILE  91          HG21      ILE  91  -1.238   9.896  10.222
    7   HG21  ILE  91          HG22      ILE  91   0.162  10.727  10.898
    8   HG23  ILE  91          HG23      ILE  91  -0.472   9.285  11.689
    9   HD13  ILE  91          HD11      ILE  91  -0.832   7.348   7.836
   10   HD12  ILE  91          HD12      ILE  91  -1.425   8.864   7.160
   11   HD11  ILE  91          HD13      ILE  91  -1.695   8.493   8.863

  No H/Q in entry =          11
  In of MODEL   84
    1    H    THR  92           H        THR  92   2.694   7.474  11.808
    2    HA   THR  92           HA       THR  92   2.247   8.837  14.237
    3    HB   THR  92           HB       THR  92   4.061   6.509  13.563
    4    HG1  THR  92           HG1      THR  92   2.094   5.748  13.460
    5   HG22  THR  92          HG21      THR  92   3.678   6.214  16.196
    6   HG21  THR  92          HG22      THR  92   3.609   7.973  16.129
    7   HG23  THR  92          HG23      THR  92   5.045   7.123  15.554

  No H/Q in entry =           7
  In of MODEL   84
    1    H    GLU  93           H        GLU  93   5.200   8.403  12.302
    2    HA   GLU  93           HA       GLU  93   6.949   9.829  14.005
    3    HB2  GLU  93           HB2      GLU  93   7.039   9.525  10.989
    4    HB3  GLU  93           HB3      GLU  93   8.378  10.055  12.005
    5    HG2  GLU  93           HG2      GLU  93   6.976   7.413  12.443
    6    HG3  GLU  93           HG3      GLU  93   8.359   7.573  11.368

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LEU  94           H        LEU  94   4.898  10.848  11.295
    2    HA   LEU  94           HA       LEU  94   5.695  13.554  11.205
    3    HB2  LEU  94           HB2      LEU  94   3.109  12.184  10.446
    4    HB3  LEU  94           HB3      LEU  94   3.362  13.913  10.211
    5    HG   LEU  94           HG       LEU  94   5.386  11.935   9.154
    6   HD11  LEU  94          HD11      LEU  94   2.643  12.481   8.092
    7   HD13  LEU  94          HD12      LEU  94   3.631  11.028   7.962
    8   HD12  LEU  94          HD13      LEU  94   3.962  12.413   6.923
    9   HD23  LEU  94          HD21      LEU  94   5.631  13.779   7.438
   10   HD22  LEU  94          HD22      LEU  94   6.044  14.267   9.082
   11   HD21  LEU  94          HD23      LEU  94   4.491  14.732   8.384

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  95           H        ILE  95   3.162  11.922  13.090
    2    HA   ILE  95           HA       ILE  95   2.111  14.264  14.293
    3    HB   ILE  95           HB       ILE  95   2.138  11.379  15.207
    4   HG12  ILE  95          HG12      ILE  95  -0.089  13.148  14.163
    5   HG13  ILE  95          HG13      ILE  95   0.872  12.096  13.128
    6   HG21  ILE  95          HG21      ILE  95   0.846  13.842  16.417
    7   HG23  ILE  95          HG22      ILE  95   1.898  12.674  17.218
    8   HG22  ILE  95          HG23      ILE  95   0.265  12.209  16.740
    9   HD13  ILE  95          HD11      ILE  95  -0.024  10.151  14.040
   10   HD12  ILE  95          HD12      ILE  95  -1.411  11.235  14.119
   11   HD11  ILE  95          HD13      ILE  95  -0.445  10.935  15.563

  No H/Q in entry =          11
  In of MODEL   84
    1    H    GLU  96           H        GLU  96   4.714  12.051  15.282
    2    HA   GLU  96           HA       GLU  96   5.263  13.243  17.778
    3    HB2  GLU  96           HB2      GLU  96   6.220  11.090  17.123
    4    HB3  GLU  96           HB3      GLU  96   7.151  11.872  15.847
    5    HG2  GLU  96           HG2      GLU  96   8.796  12.422  17.312
    6    HG3  GLU  96           HG3      GLU  96   7.646  13.227  18.369

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LEU  97           H        LEU  97   6.336  14.031  14.495
    2    HA   LEU  97           HA       LEU  97   8.213  16.033  15.216
    3    HB2  LEU  97           HB2      LEU  97   6.625  15.486  12.717
    4    HB3  LEU  97           HB3      LEU  97   7.638  16.921  12.845
    5    HG   LEU  97           HG       LEU  97   8.679  14.126  13.395
    6   HD12  LEU  97          HD11      LEU  97   9.676  14.333  11.079
    7   HD11  LEU  97          HD12      LEU  97   8.619  15.720  10.820
    8   HD13  LEU  97          HD13      LEU  97   7.927  14.124  11.109
    9   HD23  LEU  97          HD21      LEU  97  10.843  15.418  12.658
   10   HD22  LEU  97          HD22      LEU  97  10.222  15.679  14.288
   11   HD21  LEU  97          HD23      LEU  97   9.903  16.865  13.024

  No H/Q in entry =          11
  In of MODEL   84
    1    H    HIS  98           H        HIS  98   4.721  16.155  14.559
    2    HA   HIS  98           HA       HIS  98   4.409  18.952  14.704
    3    HB2  HIS  98           HB2      HIS  98   2.529  16.691  15.421
    4    HB3  HIS  98           HB3      HIS  98   2.054  18.389  15.483
    5    HD1  HIS  98           HD1      HIS  98   3.090  15.687  13.069
    6    HD2  HIS  98           HD2      HIS  98   1.695  19.614  12.960
    7    HE1  HIS  98           HE1      HIS  98   2.529  16.182  10.646
    8    HE2  HIS  98           HE2      HIS  98   1.684  18.567  10.559

  No H/Q in entry =           8
  In of MODEL   84
    1    H    GLU  99           H        GLU  99   4.552  16.456  17.195
    2    HA   GLU  99           HA       GLU  99   3.935  18.140  19.398
    3    HB2  GLU  99           HB2      GLU  99   3.858  15.657  19.486
    4    HB3  GLU  99           HB3      GLU  99   5.618  15.621  19.379
    5    HG2  GLU  99           HG2      GLU  99   5.799  16.906  21.458
    6    HG3  GLU  99           HG3      GLU  99   4.046  17.038  21.553

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LYS 100           H        LYS 100   6.994  17.229  17.832
    2    HA   LYS 100           HA       LYS 100   8.641  18.631  19.694
    3    HB2  LYS 100           HB2      LYS 100   9.146  17.719  16.853
    4    HB3  LYS 100           HB3      LYS 100  10.372  18.491  17.864
    5    HG2  LYS 100           HG2      LYS 100  10.003  16.732  19.599
    6    HG3  LYS 100           HG3      LYS 100   8.875  15.927  18.504
    7    HD2  LYS 100           HD2      LYS 100  10.672  15.659  16.837
    8    HD3  LYS 100           HD3      LYS 100  11.804  16.476  17.917
    9    HE2  LYS 100           HE2      LYS 100  11.415  14.713  19.628
   10    HE3  LYS 100           HE3      LYS 100  10.345  13.876  18.500
   11    HZ1  LYS 100           HZ1      LYS 100  13.162  14.561  17.848
   12    HZ3  LYS 100           HZ2      LYS 100  12.124  13.504  17.016
   13    HZ2  LYS 100           HZ3      LYS 100  12.714  13.082  18.553

  No H/Q in entry =          13
  In of MODEL   84
    1    H    LEU 101           H        LEU 101   6.945  19.560  16.741
    2    HA   LEU 101           HA       LEU 101   8.147  22.124  16.416
    3    HB2  LEU 101           HB2      LEU 101   5.558  20.882  15.524
    4    HB3  LEU 101           HB3      LEU 101   5.801  22.615  15.323
    5    HG   LEU 101           HG       LEU 101   7.847  20.611  14.351
    6   HD12  LEU 101          HD11      LEU 101   6.693  21.120  12.067
    7   HD11  LEU 101          HD12      LEU 101   5.291  21.540  13.048
    8   HD13  LEU 101          HD13      LEU 101   5.963  19.912  13.124
    9   HD21  LEU 101          HD21      LEU 101   7.206  23.523  13.805
   10   HD23  LEU 101          HD22      LEU 101   8.192  22.571  12.696
   11   HD22  LEU 101          HD23      LEU 101   8.731  22.825  14.355

  No H/Q in entry =          11
  In of MODEL   84
    1    H    LYS 102           H        LYS 102   6.614  20.970  19.027
    2    HA   LYS 102           HA       LYS 102   5.976  22.051  20.963
    3    HB2  LYS 102           HB2      LYS 102   7.250  24.051  19.847
    4    HB3  LYS 102           HB3      LYS 102   5.648  24.650  19.472
    5    HG2  LYS 102           HG2      LYS 102   7.025  24.391  22.124
    6    HG3  LYS 102           HG3      LYS 102   6.067  25.717  21.499
    7    HD2  LYS 102           HD2      LYS 102   4.835  23.072  22.368
    8    HD3  LYS 102           HD3      LYS 102   5.076  24.430  23.456
    9    HE2  LYS 102           HE2      LYS 102   2.800  24.023  21.965
   10    HE3  LYS 102           HE3      LYS 102   3.295  25.568  22.653
   11    HZ2  LYS 102           HZ1      LYS 102   2.766  25.683  20.273
   12    HZ1  LYS 102           HZ2      LYS 102   4.032  24.608  19.947
   13    HZ3  LYS 102           HZ3      LYS 102   4.368  26.137  20.596

  No H/Q in entry =          13
  In of MODEL   84
    1    H    ALA 103           H        ALA 103   4.332  23.597  18.200
    2    HA   ALA 103           HA       ALA 103   1.875  24.160  19.086
    3    HB1  ALA 103           HB1      ALA 103   0.981  23.322  16.840
    4    HB2  ALA 103           HB2      ALA 103   2.631  22.794  16.509
    5    HB3  ALA 103           HB3      ALA 103   2.289  24.503  16.782

  No H/Q in entry =           5
  In of MODEL   84
    1    H1   ALA   1           H3       ALA   1  10.678 -20.207  -6.351
    2    H2   ALA   1           H2       ALA   1   9.715 -20.412  -7.738
    3    H3   ALA   1           H1       ALA   1   9.280 -21.166  -6.278
    4    HA   ALA   1           HA       ALA   1  10.326 -22.968  -7.024
    5    HB1  ALA   1           HB1      ALA   1  10.421 -22.600  -9.298
    6    HB2  ALA   1           HB2      ALA   1  12.148 -22.444  -8.968
    7    HB3  ALA   1           HB3      ALA   1  11.144 -21.000  -9.114

  No H/Q in entry =           7
  In of MODEL   84
    1    H    GLU   2           H        GLU   2  12.614 -23.910  -7.085
    2    HA   GLU   2           HA       GLU   2  13.994 -23.832  -4.872
    3    HB2  GLU   2           HB2      GLU   2  15.351 -23.685  -7.570
    4    HB3  GLU   2           HB3      GLU   2  16.080 -24.299  -6.088
    5    HG2  GLU   2           HG2      GLU   2  15.071 -26.318  -6.336
    6    HG3  GLU   2           HG3      GLU   2  13.497 -25.577  -6.593

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLU   3           H        GLU   3  15.759 -21.952  -7.266
    2    HA   GLU   3           HA       GLU   3  16.906 -20.268  -5.300
    3    HB2  GLU   3           HB2      GLU   3  16.851 -20.254  -8.310
    4    HB3  GLU   3           HB3      GLU   3  17.592 -18.926  -7.417
    5    HG2  GLU   3           HG2      GLU   3  19.259 -20.298  -6.500
    6    HG3  GLU   3           HG3      GLU   3  18.318 -21.767  -6.726

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LEU   4           H        LEU   4  14.622 -19.418  -7.928
    2    HA   LEU   4           HA       LEU   4  14.146 -16.813  -7.306
    3    HB2  LEU   4           HB2      LEU   4  11.978 -18.792  -8.044
    4    HB3  LEU   4           HB3      LEU   4  11.897 -17.043  -8.236
    5    HG   LEU   4           HG       LEU   4  13.868 -18.894  -9.616
    6   HD13  LEU   4          HD11      LEU   4  12.566 -18.742 -11.526
    7   HD12  LEU   4          HD12      LEU   4  11.853 -17.202 -11.053
    8   HD11  LEU   4          HD13      LEU   4  11.304 -18.697 -10.297
    9   HD23  LEU   4          HD21      LEU   4  14.197 -16.642 -10.959
   10   HD22  LEU   4          HD22      LEU   4  15.057 -16.888  -9.440
   11   HD21  LEU   4          HD23      LEU   4  13.601 -15.896  -9.476

  No H/Q in entry =          11
  In of MODEL   84
    1    H    GLU   5           H        GLU   5  12.671 -19.608  -5.675
    2    HA   GLU   5           HA       GLU   5  10.988 -18.049  -3.966
    3    HB2  GLU   5           HB2      GLU   5  10.565 -20.424  -4.493
    4    HB3  GLU   5           HB3      GLU   5  12.006 -20.863  -3.575
    5    HG2  GLU   5           HG2      GLU   5  11.049 -19.843  -1.555
    6    HG3  GLU   5           HG3      GLU   5   9.615 -19.371  -2.466

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLU   6           H        GLU   6  14.139 -19.620  -3.529
    2    HA   GLU   6           HA       GLU   6  14.489 -18.772  -0.828
    3    HB2  GLU   6           HB2      GLU   6  15.724 -20.678  -1.807
    4    HB3  GLU   6           HB3      GLU   6  16.569 -19.562  -2.884
    5    HG2  GLU   6           HG2      GLU   6  17.517 -18.386  -0.950
    6    HG3  GLU   6           HG3      GLU   6  16.642 -19.454   0.146

  No H/Q in entry =           6
  In of MODEL   84
    1    H    VAL   7           H        VAL   7  15.250 -17.431  -3.972
    2    HA   VAL   7           HA       VAL   7  16.928 -15.301  -3.099
    3    HB   VAL   7           HB       VAL   7  15.224 -15.662  -5.578
    4   HG11  VAL   7          HG11      VAL   7  17.109 -13.445  -4.757
    5   HG13  VAL   7          HG12      VAL   7  15.466 -13.306  -5.380
    6   HG12  VAL   7          HG13      VAL   7  16.777 -13.799  -6.452
    7   HG21  VAL   7          HG21      VAL   7  17.336 -17.112  -5.015
    8   HG23  VAL   7          HG22      VAL   7  18.236 -15.646  -5.407
    9   HG22  VAL   7          HG23      VAL   7  17.202 -16.395  -6.621

  No H/Q in entry =           9
  In of MODEL   84
    1    H    VAL   8           H        VAL   8  13.437 -15.582  -3.657
    2    HA   VAL   8           HA       VAL   8  12.760 -12.879  -3.175
    3    HB   VAL   8           HB       VAL   8  11.159 -15.416  -2.752
    4   HG12  VAL   8          HG11      VAL   8   9.207 -13.749  -2.888
    5   HG11  VAL   8          HG12      VAL   8  10.400 -12.492  -2.563
    6   HG13  VAL   8          HG13      VAL   8  10.123 -13.770  -1.381
    7   HG22  VAL   8          HG21      VAL   8  10.547 -15.251  -4.973
    8   HG21  VAL   8          HG22      VAL   8  12.039 -14.325  -5.114
    9   HG23  VAL   8          HG23      VAL   8  10.501 -13.489  -4.926

  No H/Q in entry =           9
  In of MODEL   84
    1    H    MET   9           H        MET   9  13.038 -15.692  -1.006
    2    HA   MET   9           HA       MET   9  12.217 -14.433   1.369
    3    HB2  MET   9           HB2      MET   9  14.100 -16.713   0.797
    4    HB3  MET   9           HB3      MET   9  13.871 -16.123   2.442
    5    HG2  MET   9           HG2      MET   9  11.339 -16.363   1.968
    6    HG3  MET   9           HG3      MET   9  11.831 -17.350   0.592
    7    HE3  MET   9           HE1      MET   9  13.532 -20.391   1.978
    8    HE2  MET   9           HE2      MET   9  14.343 -18.930   1.418
    9    HE1  MET   9           HE3      MET   9  12.891 -19.494   0.595

  No H/Q in entry =           9
  In of MODEL   84
    1    H    GLY  10           H        GLY  10  15.400 -14.637  -0.188
    2    HA3  GLY  10           HA2      GLY  10  16.852 -13.217   1.788
    3    HA2  GLY  10           HA3      GLY  10  17.316 -13.374   0.094

  No H/Q in entry =           3
  In of MODEL   84
    1    H    LEU  11           H        LEU  11  15.142 -12.158  -1.142
    2    HA   LEU  11           HA       LEU  11  15.814  -9.411  -0.967
    3    HB2  LEU  11           HB2      LEU  11  13.453 -10.827  -2.208
    4    HB3  LEU  11           HB3      LEU  11  13.725  -9.091  -2.361
    5    HG   LEU  11           HG       LEU  11  15.763 -11.186  -3.157
    6   HD13  LEU  11          HD11      LEU  11  14.019 -11.556  -4.679
    7   HD12  LEU  11          HD12      LEU  11  15.016 -10.366  -5.514
    8   HD11  LEU  11          HD13      LEU  11  13.540  -9.858  -4.694
    9   HD22  LEU  11          HD21      LEU  11  16.985  -9.217  -2.923
   10   HD21  LEU  11          HD22      LEU  11  15.605  -8.186  -3.298
   11   HD23  LEU  11          HD23      LEU  11  16.440  -9.045  -4.590

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  12           H        ILE  12  13.054 -11.255   0.292
    2    HA   ILE  12           HA       ILE  12  11.649  -9.043   1.360
    3    HB   ILE  12           HB       ILE  12  11.701 -11.927   2.303
    4   HG12  ILE  12          HG12      ILE  12  11.018 -11.294  -0.147
    5   HG13  ILE  12          HG13      ILE  12   9.998 -12.395   0.759
    6   HG21  ILE  12          HG21      ILE  12   9.769  -9.657   2.869
    7   HG23  ILE  12          HG22      ILE  12  10.732 -10.553   4.042
    8   HG22  ILE  12          HG23      ILE  12   9.406 -11.351   3.196
    9   HD11  ILE  12          HD11      ILE  12   9.544  -9.407   0.560
   10   HD13  ILE  12          HD12      ILE  12   8.453 -10.601   1.259
   11   HD12  ILE  12          HD13      ILE  12   8.755 -10.593  -0.465

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  13           H        ILE  13  14.054 -11.240   2.758
    2    HA   ILE  13           HA       ILE  13  14.082 -10.070   5.343
    3    HB   ILE  13           HB       ILE  13  16.159 -11.618   3.773
    4   HG12  ILE  13          HG12      ILE  13  13.887 -12.615   4.579
    5   HG13  ILE  13          HG13      ILE  13  15.367 -13.524   4.868
    6   HG22  ILE  13          HG21      ILE  13  17.188 -11.988   6.104
    7   HG21  ILE  13          HG22      ILE  13  16.254 -10.590   6.622
    8   HG23  ILE  13          HG23      ILE  13  17.470 -10.417   5.357
    9   HD12  ILE  13          HD11      ILE  13  13.583 -13.078   6.833
   10   HD11  ILE  13          HD12      ILE  13  14.515 -11.592   6.976
   11   HD13  ILE  13          HD13      ILE  13  15.316 -13.148   7.147

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ASN  14           H        ASN  14  16.033  -9.516   2.427
    2    HA   ASN  14           HA       ASN  14  17.764  -7.567   3.497
    3    HB2  ASN  14           HB2      ASN  14  17.751  -8.824   1.176
    4    HB3  ASN  14           HB3      ASN  14  16.848  -7.411   0.644
    5   HD21  ASN  14          HD21      ASN  14  19.291  -7.730  -0.542
    6   HD22  ASN  14          HD22      ASN  14  20.427  -6.641   0.090

  No H/Q in entry =           6
  In of MODEL   84
    1    H    SER  15           H        SER  15  14.652  -7.235   1.804
    2    HA   SER  15           HA       SER  15  14.519  -4.415   1.872
    3    HB2  SER  15           HB2      SER  15  12.189  -4.676   1.374
    4    HB3  SER  15           HB3      SER  15  12.996  -6.034   0.598
    5    HG   SER  15           HG       SER  15  11.682  -7.203   1.736

  No H/Q in entry =           5
  In of MODEL   84
    1    H    GLY  16           H        GLY  16  13.443  -6.892   4.165
    2    HA3  GLY  16           HA2      GLY  16  12.208  -5.159   6.029
    3    HA2  GLY  16           HA3      GLY  16  12.834  -6.764   6.385

  No H/Q in entry =           3
  In of MODEL   84
    1    H    GLN  17           H        GLN  17  15.543  -6.409   5.795
    2    HA   GLN  17           HA       GLN  17  16.489  -5.190   8.181
    3    HB2  GLN  17           HB2      GLN  17  17.739  -6.965   6.996
    4    HB3  GLN  17           HB3      GLN  17  18.024  -5.861   5.651
    5    HG2  GLN  17           HG2      GLN  17  19.222  -4.323   7.169
    6    HG3  GLN  17           HG3      GLN  17  18.955  -5.441   8.505
    7   HE21  GLN  17          HE21      GLN  17  20.703  -6.803   8.874
    8   HE22  GLN  17          HE22      GLN  17  21.812  -7.308   7.693

  No H/Q in entry =           8
  In of MODEL   84
    1    H    ALA  18           H        ALA  18  16.294  -4.100   4.825
    2    HA   ALA  18           HA       ALA  18  17.711  -1.697   5.062
    3    HB2  ALA  18           HB1      ALA  18  16.604  -2.913   2.989
    4    HB3  ALA  18           HB2      ALA  18  16.855  -1.168   2.980
    5    HB1  ALA  18           HB3      ALA  18  15.260  -1.827   3.346

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ARG  19           H        ARG  19  14.216  -2.315   5.454
    2    HA   ARG  19           HA       ARG  19  13.526   0.327   6.179
    3    HB2  ARG  19           HB2      ARG  19  11.859  -1.435   5.585
    4    HB3  ARG  19           HB3      ARG  19  12.207  -2.237   7.119
    5    HG2  ARG  19           HG2      ARG  19  11.479  -0.256   8.365
    6    HG3  ARG  19           HG3      ARG  19  11.223   0.624   6.860
    7    HD2  ARG  19           HD2      ARG  19   9.088  -0.192   7.676
    8    HD3  ARG  19           HD3      ARG  19   9.515  -1.063   6.196
    9    HE   ARG  19           HE       ARG  19  10.484  -2.606   8.296
   10   HH21  ARG  19          HH11      ARG  19   9.248  -4.259   9.228
   11   HH22  ARG  19          HH12      ARG  19   7.528  -4.245   9.056
   12   HH11  ARG  19          HH21      ARG  19   7.480  -1.333   7.204
   13   HH12  ARG  19          HH22      ARG  19   6.528  -2.588   7.906

  No H/Q in entry =          13
  In of MODEL   84
    1    H    SER  20           H        SER  20  14.405  -2.504   8.128
    2    HA   SER  20           HA       SER  20  14.112  -1.416  10.669
    3    HB2  SER  20           HB2      SER  20  14.596  -3.737  10.538
    4    HB3  SER  20           HB3      SER  20  16.048  -3.458   9.579
    5    HG   SER  20           HG       SER  20  15.626  -2.651  12.273

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LEU  21           H        LEU  21  16.956  -1.324   8.535
    2    HA   LEU  21           HA       LEU  21  18.617   0.169  10.281
    3    HB2  LEU  21           HB2      LEU  21  18.599  -0.094   7.267
    4    HB3  LEU  21           HB3      LEU  21  19.845   0.777   8.157
    5    HG   LEU  21           HG       LEU  21  19.134  -2.124   8.685
    6   HD13  LEU  21          HD11      LEU  21  19.996  -2.073   6.458
    7   HD12  LEU  21          HD12      LEU  21  21.357  -2.528   7.482
    8   HD11  LEU  21          HD13      LEU  21  21.219  -0.876   6.882
    9   HD21  LEU  21          HD21      LEU  21  21.206  -0.200   9.713
   10   HD23  LEU  21          HD22      LEU  21  21.640  -1.901   9.590
   11   HD22  LEU  21          HD23      LEU  21  20.291  -1.414  10.603

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ALA  22           H        ALA  22  16.347   1.130   7.727
    2    HA   ALA  22           HA       ALA  22  16.864   3.892   7.752
    3    HB3  ALA  22           HB1      ALA  22  15.472   2.645   6.067
    4    HB2  ALA  22           HB2      ALA  22  14.753   4.150   6.639
    5    HB1  ALA  22           HB3      ALA  22  14.175   2.604   7.260

  No H/Q in entry =           5
  In of MODEL   84
    1    H    TYR  23           H        TYR  23  14.380   2.050   9.577
    2    HA   TYR  23           HA       TYR  23  13.399   4.274  11.035
    3    HB2  TYR  23           HB2      TYR  23  12.181   2.149  11.003
    4    HB3  TYR  23           HB3      TYR  23  13.518   1.348  11.829
    5    HD1  TYR  23           HD1      TYR  23  10.997   4.077  12.196
    6    HD2  TYR  23           HD2      TYR  23  13.701   1.396  14.185
    7    HE1  TYR  23           HE1      TYR  23  10.058   4.756  14.390
    8    HE2  TYR  23           HE2      TYR  23  12.762   2.075  16.377
    9    HH   TYR  23           HH       TYR  23  10.250   4.591  16.600

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ALA  24           H        ALA  24  16.061   2.016  11.665
    2    HA   ALA  24           HA       ALA  24  16.721   3.006  14.233
    3    HB1  ALA  24           HB1      ALA  24  18.091   1.224  14.062
    4    HB3  ALA  24           HB2      ALA  24  19.113   2.158  12.968
    5    HB2  ALA  24           HB3      ALA  24  17.827   1.142  12.322

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ALA  25           H        ALA  25  17.674   3.955  10.959
    2    HA   ALA  25           HA       ALA  25  19.604   5.902  11.613
    3    HB1  ALA  25           HB1      ALA  25  18.897   4.957   9.294
    4    HB3  ALA  25           HB2      ALA  25  19.386   6.648   9.394
    5    HB2  ALA  25           HB3      ALA  25  17.674   6.229   9.322

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LEU  26           H        LEU  26  16.088   6.106  11.250
    2    HA   LEU  26           HA       LEU  26  15.844   8.884  11.712
    3    HB2  LEU  26           HB2      LEU  26  13.992   7.639  10.777
    4    HB3  LEU  26           HB3      LEU  26  13.907   6.605  12.199
    5    HG   LEU  26           HG       LEU  26  13.286   8.553  13.586
    6   HD12  LEU  26          HD11      LEU  26  12.611  10.654  12.268
    7   HD11  LEU  26          HD12      LEU  26  13.598  10.014  10.957
    8   HD13  LEU  26          HD13      LEU  26  14.338  10.398  12.511
    9   HD21  LEU  26          HD21      LEU  26  11.615   8.238  11.074
   10   HD23  LEU  26          HD22      LEU  26  11.048   8.926  12.592
   11   HD22  LEU  26          HD23      LEU  26  11.512   7.228  12.516

  No H/Q in entry =          11
  In of MODEL   84
    1    H    LYS  27           H        LYS  27  15.753   6.096  13.894
    2    HA   LYS  27           HA       LYS  27  15.149   7.448  16.267
    3    HB2  LYS  27           HB2      LYS  27  15.194   4.974  15.992
    4    HB3  LYS  27           HB3      LYS  27  16.957   5.039  15.951
    5    HG2  LYS  27           HG2      LYS  27  16.998   6.016  18.204
    6    HG3  LYS  27           HG3      LYS  27  15.231   6.022  18.248
    7    HD2  LYS  27           HD2      LYS  27  15.222   3.556  18.001
    8    HD3  LYS  27           HD3      LYS  27  16.987   3.557  17.991
    9    HE2  LYS  27           HE2      LYS  27  17.013   4.537  20.252
   10    HE3  LYS  27           HE3      LYS  27  15.247   4.566  20.265
   11    HZ3  LYS  27           HZ1      LYS  27  16.047   2.614  21.409
   12    HZ2  LYS  27           HZ2      LYS  27  16.967   2.147  20.057
   13    HZ1  LYS  27           HZ3      LYS  27  15.269   2.141  19.976

  No H/Q in entry =          13
  In of MODEL   84
    1    H    GLN  28           H        GLN  28  18.270   6.892  14.675
    2    HA   GLN  28           HA       GLN  28  19.946   7.978  16.671
    3    HB2  GLN  28           HB2      GLN  28  20.238   7.950  13.656
    4    HB3  GLN  28           HB3      GLN  28  21.520   8.418  14.773
    5    HG2  GLN  28           HG2      GLN  28  20.112   5.734  14.786
    6    HG3  GLN  28           HG3      GLN  28  21.699   6.035  14.081
    7   HE21  GLN  28          HE21      GLN  28  20.416   4.684  16.756
    8   HE22  GLN  28          HE22      GLN  28  21.590   5.105  17.908

  No H/Q in entry =           8
  In of MODEL   84
    1    H    ALA  29           H        ALA  29  18.188   9.461  13.983
    2    HA   ALA  29           HA       ALA  29  19.171  12.086  14.248
    3    HB2  ALA  29           HB1      ALA  29  17.470  12.720  12.778
    4    HB1  ALA  29           HB2      ALA  29  16.332  11.537  13.423
    5    HB3  ALA  29           HB3      ALA  29  17.667  11.007  12.399

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LYS  30           H        LYS  30  16.402  10.466  15.760
    2    HA   LYS  30           HA       LYS  30  15.375  12.708  17.125
    3    HB2  LYS  30           HB2      LYS  30  15.278   9.764  17.817
    4    HB3  LYS  30           HB3      LYS  30  14.405  11.006  18.715
    5    HG2  LYS  30           HG2      LYS  30  13.278  11.695  16.599
    6    HG3  LYS  30           HG3      LYS  30  14.091  10.366  15.767
    7    HD2  LYS  30           HD2      LYS  30  13.026   8.747  17.288
    8    HD3  LYS  30           HD3      LYS  30  12.224  10.065  18.144
    9    HE2  LYS  30           HE2      LYS  30  11.054  10.700  16.053
   10    HE3  LYS  30           HE3      LYS  30  11.836   9.353  15.217
   11    HZ2  LYS  30           HZ1      LYS  30   9.529   8.929  16.094
   12    HZ1  LYS  30           HZ2      LYS  30  10.195   8.979  17.662
   13    HZ3  LYS  30           HZ3      LYS  30  10.710   7.801  16.547

  No H/Q in entry =          13
  In of MODEL   84
    1    H    GLN  31           H        GLN  31  18.046  10.549  17.856
    2    HA   GLN  31           HA       GLN  31  18.366  11.554  20.555
    3    HB2  GLN  31           HB2      GLN  31  20.398  10.000  18.945
    4    HB3  GLN  31           HB3      GLN  31  20.262  10.116  20.700
    5    HG2  GLN  31           HG2      GLN  31  17.754   9.155  19.925
    6    HG3  GLN  31           HG3      GLN  31  18.860   8.320  18.842
    7   HE21  GLN  31          HE21      GLN  31  17.321   7.157  21.113
    8   HE22  GLN  31          HE22      GLN  31  18.480   6.498  22.162

  No H/Q in entry =           8
  In of MODEL   84
    1    H    GLY  32           H        GLY  32  18.881  12.886  17.594
    2    HA3  GLY  32           HA2      GLY  32  19.856  14.938  17.089
    3    HA2  GLY  32           HA3      GLY  32  20.612  14.940  18.677

  No H/Q in entry =           3
  In of MODEL   84
    1    H    ASP  33           H        ASP  33  21.050  12.057  16.889
    2    HA   ASP  33           HA       ASP  33  23.872  12.748  16.427
    3    HB2  ASP  33           HB2      ASP  33  22.376  10.124  16.532
    4    HB3  ASP  33           HB3      ASP  33  24.063  10.251  16.039

  No H/Q in entry =           4
  In of MODEL   84
    1    H    PHE  34           H        PHE  34  23.386  14.076  14.551
    2    HA   PHE  34           HA       PHE  34  22.043  13.095  12.259
    3    HB2  PHE  34           HB2      PHE  34  24.164  15.239  12.499
    4    HB3  PHE  34           HB3      PHE  34  23.181  14.949  11.066
    5    HD1  PHE  34           HD1      PHE  34  23.420  16.873  13.987
    6    HD2  PHE  34           HD2      PHE  34  20.555  14.752  11.591
    7    HE1  PHE  34           HE1      PHE  34  21.596  18.257  14.939
    8    HE2  PHE  34           HE2      PHE  34  18.734  16.137  12.545
    9    HZ   PHE  34           HZ       PHE  34  19.258  17.890  14.215

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ALA  35           H        ALA  35  25.418  12.920  13.269
    2    HA   ALA  35           HA       ALA  35  26.529  12.115  10.809
    3    HB3  ALA  35           HB1      ALA  35  28.215  10.947  12.525
    4    HB2  ALA  35           HB2      ALA  35  27.345  11.964  13.674
    5    HB1  ALA  35           HB3      ALA  35  28.179  12.697  12.305

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ALA  36           H        ALA  36  25.422  10.142  13.566
    2    HA   ALA  36           HA       ALA  36  25.921   7.662  12.280
    3    HB2  ALA  36           HB1      ALA  36  25.492   6.905  14.352
    4    HB3  ALA  36           HB2      ALA  36  23.802   7.391  14.203
    5    HB1  ALA  36           HB3      ALA  36  24.996   8.527  14.831

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ALA  37           H        ALA  37  23.087   9.772  12.421
    2    HA   ALA  37           HA       ALA  37  21.242   7.997  11.236
    3    HB3  ALA  37           HB1      ALA  37  21.450  10.960  11.541
    4    HB1  ALA  37           HB2      ALA  37  20.144   9.871  12.008
    5    HB2  ALA  37           HB3      ALA  37  20.332  10.351  10.320

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LYS  38           H        LYS  38  23.328  10.476   9.769
    2    HA   LYS  38           HA       LYS  38  22.693  10.056   7.089
    3    HB2  LYS  38           HB2      LYS  38  24.492  11.618   8.542
    4    HB3  LYS  38           HB3      LYS  38  25.532  10.639   7.513
    5    HG2  LYS  38           HG2      LYS  38  24.364  11.410   5.519
    6    HG3  LYS  38           HG3      LYS  38  23.164  12.254   6.503
    7    HD2  LYS  38           HD2      LYS  38  24.748  13.859   7.263
    8    HD3  LYS  38           HD3      LYS  38  26.115  12.884   6.724
    9    HE2  LYS  38           HE2      LYS  38  25.747  14.759   5.180
   10    HE3  LYS  38           HE3      LYS  38  25.423  13.222   4.370
   11    HZ3  LYS  38           HZ1      LYS  38  23.223  13.654   4.240
   12    HZ2  LYS  38           HZ2      LYS  38  23.735  15.272   4.334
   13    HZ1  LYS  38           HZ3      LYS  38  23.165  14.479   5.723

  No H/Q in entry =          13
  In of MODEL   84
    1    H    ALA  39           H        ALA  39  25.216   8.466   9.041
    2    HA   ALA  39           HA       ALA  39  26.297   6.893   6.965
    3    HB2  ALA  39           HB1      ALA  39  26.212   5.917   9.805
    4    HB1  ALA  39           HB2      ALA  39  27.156   7.351   9.395
    5    HB3  ALA  39           HB3      ALA  39  27.518   5.806   8.626

  No H/Q in entry =           5
  In of MODEL   84
    1    H    MET  40           H        MET  40  23.686   6.250   9.259
    2    HA   MET  40           HA       MET  40  23.262   3.545   8.514
    3    HB2  MET  40           HB2      MET  40  21.431   5.571   9.813
    4    HB3  MET  40           HB3      MET  40  21.036   3.860   9.631
    5    HG2  MET  40           HG2      MET  40  23.578   4.813  10.977
    6    HG3  MET  40           HG3      MET  40  22.085   4.524  11.868
    7    HE3  MET  40           HE1      MET  40  21.546   0.886  12.029
    8    HE2  MET  40           HE2      MET  40  20.669   2.186  11.226
    9    HE1  MET  40           HE3      MET  40  21.407   2.472  12.801

  No H/Q in entry =           9
  In of MODEL   84
    1    H    MET  41           H        MET  41  21.828   6.594   7.338
    2    HA   MET  41           HA       MET  41  19.880   5.392   5.660
    3    HB2  MET  41           HB2      MET  41  21.343   7.994   5.158
    4    HB3  MET  41           HB3      MET  41  19.819   7.493   4.436
    5    HG2  MET  41           HG2      MET  41  19.073   7.289   6.986
    6    HG3  MET  41           HG3      MET  41  20.374   8.455   7.214
    7    HE2  MET  41           HE1      MET  41  19.804   9.752   3.882
    8    HE1  MET  41           HE2      MET  41  20.757  10.193   5.296
    9    HE3  MET  41           HE3      MET  41  19.477  11.266   4.736

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ASP  42           H        ASP  42  23.246   6.341   5.113
    2    HA   ASP  42           HA       ASP  42  23.344   5.879   2.353
    3    HB2  ASP  42           HB2      ASP  42  25.086   6.882   4.128
    4    HB3  ASP  42           HB3      ASP  42  25.755   5.261   3.994

  No H/Q in entry =           4
  In of MODEL   84
    1    H    GLN  43           H        GLN  43  24.082   3.718   5.065
    2    HA   GLN  43           HA       GLN  43  24.763   1.472   3.474
    3    HB2  GLN  43           HB2      GLN  43  23.737   1.636   6.317
    4    HB3  GLN  43           HB3      GLN  43  24.328   0.155   5.557
    5    HG2  GLN  43           HG2      GLN  43  26.482   1.383   5.052
    6    HG3  GLN  43           HG3      GLN  43  25.889   2.702   6.057
    7   HE21  GLN  43          HE21      GLN  43  28.129   1.741   7.091
    8   HE22  GLN  43          HE22      GLN  43  27.861   0.651   8.362

  No H/Q in entry =           8
  In of MODEL   84
    1    H    SER  44           H        SER  44  21.698   2.578   4.861
    2    HA   SER  44           HA       SER  44  20.146   0.326   4.178
    3    HB2  SER  44           HB2      SER  44  19.685   2.847   5.334
    4    HB3  SER  44           HB3      SER  44  18.652   2.802   3.908
    5    HG   SER  44           HG       SER  44  17.564   1.844   5.627

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ARG  45           H        ARG  45  20.869   3.304   2.386
    2    HA   ARG  45           HA       ARG  45  19.348   2.816   0.079
    3    HB2  ARG  45           HB2      ARG  45  20.477   4.958   0.672
    4    HB3  ARG  45           HB3      ARG  45  22.027   4.216   0.285
    5    HG2  ARG  45           HG2      ARG  45  21.247   3.814  -2.032
    6    HG3  ARG  45           HG3      ARG  45  19.709   4.580  -1.643
    7    HD2  ARG  45           HD2      ARG  45  20.944   6.683  -1.049
    8    HD3  ARG  45           HD3      ARG  45  22.447   5.922  -1.620
    9    HE   ARG  45           HE       ARG  45  20.519   5.679  -3.658
   10   HH21  ARG  45          HH11      ARG  45  20.503   7.055  -5.416
   11   HH22  ARG  45          HH12      ARG  45  21.250   8.610  -5.305
   12   HH11  ARG  45          HH21      ARG  45  22.231   8.183  -2.020
   13   HH12  ARG  45          HH22      ARG  45  22.227   9.248  -3.379

  No H/Q in entry =          13
  In of MODEL   84
    1    H    MET  46           H        MET  46  22.718   1.962   0.824
    2    HA   MET  46           HA       MET  46  23.333   0.783  -1.664
    3    HB2  MET  46           HB2      MET  46  24.442   0.459   1.124
    4    HB3  MET  46           HB3      MET  46  25.102  -0.433  -0.251
    5    HG2  MET  46           HG2      MET  46  25.556   1.661  -1.434
    6    HG3  MET  46           HG3      MET  46  24.817   2.584  -0.132
    7    HE3  MET  46           HE1      MET  46  27.512  -0.595   0.271
    8    HE2  MET  46           HE2      MET  46  28.798   0.446  -0.337
    9    HE1  MET  46           HE3      MET  46  27.342   0.200  -1.301

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ALA  47           H        ALA  47  21.958  -0.571   1.306
    2    HA   ALA  47           HA       ALA  47  21.922  -3.281   0.492
    3    HB2  ALA  47           HB1      ALA  47  21.540  -2.832   2.798
    4    HB3  ALA  47           HB2      ALA  47  20.007  -3.442   2.177
    5    HB1  ALA  47           HB3      ALA  47  20.226  -1.711   2.442

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LEU  48           H        LEU  48  19.553  -0.667   0.146
    2    HA   LEU  48           HA       LEU  48  17.517  -2.208  -1.111
    3    HB2  LEU  48           HB2      LEU  48  18.154   0.750  -1.215
    4    HB3  LEU  48           HB3      LEU  48  16.687   0.034  -1.884
    5    HG   LEU  48           HG       LEU  48  17.543  -0.274   1.003
    6   HD13  LEU  48          HD11      LEU  48  17.111   2.025   0.825
    7   HD12  LEU  48          HD12      LEU  48  15.556   1.366   1.333
    8   HD11  LEU  48          HD13      LEU  48  15.825   1.796  -0.357
    9   HD22  LEU  48          HD21      LEU  48  16.024  -1.996   0.617
   10   HD21  LEU  48          HD22      LEU  48  15.145  -1.094  -0.618
   11   HD23  LEU  48          HD23      LEU  48  14.930  -0.697   1.087

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ASN  49           H        ASN  49  20.194  -0.260  -2.335
    2    HA   ASN  49           HA       ASN  49  19.542  -0.337  -5.059
    3    HB2  ASN  49           HB2      ASN  49  21.215   1.183  -4.121
    4    HB3  ASN  49           HB3      ASN  49  22.254  -0.177  -3.712
    5   HD21  ASN  49          HD21      ASN  49  23.973   0.574  -5.106
    6   HD22  ASN  49          HD22      ASN  49  23.841   0.510  -6.796

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLU  50           H        GLU  50  21.540  -2.527  -3.105
    2    HA   GLU  50           HA       GLU  50  22.250  -4.271  -5.238
    3    HB2  GLU  50           HB2      GLU  50  23.449  -4.247  -3.072
    4    HB3  GLU  50           HB3      GLU  50  22.010  -4.886  -2.278
    5    HG2  GLU  50           HG2      GLU  50  22.110  -6.914  -3.644
    6    HG3  GLU  50           HG3      GLU  50  23.482  -6.270  -4.544

  No H/Q in entry =           6
  In of MODEL   84
    1    H    ALA  51           H        ALA  51  19.595  -4.229  -2.910
    2    HA   ALA  51           HA       ALA  51  18.442  -6.706  -3.676
    3    HB3  ALA  51           HB1      ALA  51  16.848  -6.215  -2.118
    4    HB1  ALA  51           HB2      ALA  51  16.625  -4.567  -2.711
    5    HB2  ALA  51           HB3      ALA  51  17.987  -4.950  -1.657

  No H/Q in entry =           5
  In of MODEL   84
    1    H    HIS  52           H        HIS  52  17.837  -3.358  -4.699
    2    HA   HIS  52           HA       HIS  52  15.725  -3.890  -6.499
    3    HB2  HIS  52           HB2      HIS  52  16.294  -1.624  -5.727
    4    HB3  HIS  52           HB3      HIS  52  17.820  -1.705  -6.606
    5    HD1  HIS  52           HD1      HIS  52  17.429  -2.320  -9.313
    6    HD2  HIS  52           HD2      HIS  52  14.285  -0.516  -7.253
    7    HE1  HIS  52           HE1      HIS  52  15.895  -1.330 -11.070
    8    HE2  HIS  52           HE2      HIS  52  13.974  -0.226  -9.830

  No H/Q in entry =           8
  In of MODEL   84
    1    H    LEU  53           H        LEU  53  19.243  -3.874  -6.934
    2    HA   LEU  53           HA       LEU  53  19.300  -4.180  -9.735
    3    HB2  LEU  53           HB2      LEU  53  21.239  -4.940  -7.565
    4    HB3  LEU  53           HB3      LEU  53  21.556  -5.316  -9.257
    5    HG   LEU  53           HG       LEU  53  20.873  -2.515  -8.308
    6   HD13  LEU  53          HD11      LEU  53  22.909  -3.046  -7.178
    7   HD12  LEU  53          HD12      LEU  53  23.383  -2.147  -8.618
    8   HD11  LEU  53          HD13      LEU  53  23.545  -3.898  -8.582
    9   HD22  LEU  53          HD21      LEU  53  20.601  -2.559 -10.649
   10   HD21  LEU  53          HD22      LEU  53  21.888  -3.740 -10.869
   11   HD23  LEU  53          HD23      LEU  53  22.285  -2.073 -10.499

  No H/Q in entry =          11
  In of MODEL   84
    1    H    VAL  54           H        VAL  54  19.204  -6.576  -7.117
    2    HA   VAL  54           HA       VAL  54  19.339  -8.864  -8.785
    3    HB   VAL  54           HB       VAL  54  18.184  -8.457  -6.015
    4   HG12  VAL  54          HG11      VAL  54  18.525 -11.072  -6.020
    5   HG11  VAL  54          HG12      VAL  54  18.337 -10.899  -7.764
    6   HG13  VAL  54          HG13      VAL  54  17.046 -10.380  -6.683
    7   HG22  VAL  54          HG21      VAL  54  20.499  -8.233  -5.793
    8   HG21  VAL  54          HG22      VAL  54  20.842  -9.318  -7.138
    9   HG23  VAL  54          HG23      VAL  54  20.317  -9.973  -5.587

  No H/Q in entry =           9
  In of MODEL   84
    1    H    GLN  55           H        GLN  55  16.600  -6.982  -7.494
    2    HA   GLN  55           HA       GLN  55  14.589  -8.656  -8.572
    3    HB2  GLN  55           HB2      GLN  55  13.832  -7.140  -6.940
    4    HB3  GLN  55           HB3      GLN  55  14.616  -5.764  -7.712
    5    HG2  GLN  55           HG2      GLN  55  12.889  -5.446  -9.199
    6    HG3  GLN  55           HG3      GLN  55  12.578  -7.168  -9.375
    7   HE21  GLN  55          HE21      GLN  55  10.575  -7.733  -8.570
    8   HE22  GLN  55          HE22      GLN  55   9.797  -6.987  -7.259

  No H/Q in entry =           8
  In of MODEL   84
    1    H    THR  56           H        THR  56  16.309  -5.840  -9.924
    2    HA   THR  56           HA       THR  56  14.867  -5.480 -12.270
    3    HB   THR  56           HB       THR  56  17.886  -5.372 -12.104
    4    HG1  THR  56           HG1      THR  56  15.892  -3.822 -10.964
    5   HG21  THR  56          HG21      THR  56  16.518  -5.088 -14.313
    6   HG23  THR  56          HG22      THR  56  17.773  -3.912 -13.926
    7   HG22  THR  56          HG23      THR  56  16.079  -3.521 -13.631

  No H/Q in entry =           7
  In of MODEL   84
    1    H    LYS  57           H        LYS  57  17.533  -7.762 -11.667
    2    HA   LYS  57           HA       LYS  57  17.540  -8.948 -14.249
    3    HB2  LYS  57           HB2      LYS  57  19.334  -9.195 -12.509
    4    HB3  LYS  57           HB3      LYS  57  18.237 -10.197 -11.570
    5    HG2  LYS  57           HG2      LYS  57  18.627 -11.013 -14.392
    6    HG3  LYS  57           HG3      LYS  57  20.023 -11.210 -13.339
    7    HD2  LYS  57           HD2      LYS  57  18.635 -12.506 -11.750
    8    HD3  LYS  57           HD3      LYS  57  17.249 -12.336 -12.826
    9    HE2  LYS  57           HE2      LYS  57  18.480 -13.529 -14.610
   10    HE3  LYS  57           HE3      LYS  57  19.872 -13.708 -13.544
   11    HZ2  LYS  57           HZ1      LYS  57  17.254 -15.019 -13.417
   12    HZ1  LYS  57           HZ2      LYS  57  18.107 -14.755 -11.973
   13    HZ3  LYS  57           HZ3      LYS  57  18.804 -15.679 -13.215

  No H/Q in entry =          13
  In of MODEL   84
    1    H    LEU  58           H        LEU  58  15.766  -9.637 -11.274
    2    HA   LEU  58           HA       LEU  58  14.560 -12.016 -12.215
    3    HB2  LEU  58           HB2      LEU  58  13.754 -10.123 -10.013
    4    HB3  LEU  58           HB3      LEU  58  12.958 -11.665 -10.333
    5    HG   LEU  58           HG       LEU  58  15.929 -11.368  -9.780
    6   HD11  LEU  58          HD11      LEU  58  13.563 -11.807  -7.987
    7   HD13  LEU  58          HD12      LEU  58  15.009 -10.835  -7.723
    8   HD12  LEU  58          HD13      LEU  58  15.094 -12.591  -7.593
    9   HD22  LEU  58          HD21      LEU  58  15.825 -13.427 -10.814
   10   HD21  LEU  58          HD22      LEU  58  14.113 -13.650 -10.453
   11   HD23  LEU  58          HD23      LEU  58  15.325 -13.946  -9.205

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  59           H        ILE  59  13.865  -8.682 -12.887
    2    HA   ILE  59           HA       ILE  59  11.153  -9.347 -13.827
    3    HB   ILE  59           HB       ILE  59  11.948  -7.061 -12.617
    4   HG12  ILE  59          HG12      ILE  59  10.025  -6.957 -14.953
    5   HG13  ILE  59          HG13      ILE  59   9.623  -7.723 -13.437
    6   HG22  ILE  59          HG21      ILE  59  12.007  -6.244 -15.509
    7   HG21  ILE  59          HG22      ILE  59  13.490  -6.652 -14.676
    8   HG23  ILE  59          HG23      ILE  59  12.491  -5.316 -14.110
    9   HD12  ILE  59          HD11      ILE  59   8.880  -5.321 -13.607
   10   HD11  ILE  59          HD12      ILE  59  10.584  -4.871 -13.631
   11   HD13  ILE  59          HD13      ILE  59   9.904  -5.670 -12.212

  No H/Q in entry =          11
  In of MODEL   84
    1    H    GLU  60           H        GLU  60  14.350  -8.469 -15.086
    2    HA   GLU  60           HA       GLU  60  13.565  -8.066 -17.792
    3    HB2  GLU  60           HB2      GLU  60  15.720  -7.281 -17.085
    4    HB3  GLU  60           HB3      GLU  60  16.192  -8.887 -16.536
    5    HG2  GLU  60           HG2      GLU  60  17.205  -8.314 -18.739
    6    HG3  GLU  60           HG3      GLU  60  16.149  -9.721 -18.838

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLY  61           H        GLY  61  14.564 -10.946 -15.986
    2    HA3  GLY  61           HA2      GLY  61  14.032 -12.590 -18.392
    3    HA2  GLY  61           HA3      GLY  61  15.069 -13.068 -17.052

  No H/Q in entry =           3
  In of MODEL   84
    1    H    ASP  62           H        ASP  62  11.940 -11.544 -16.668
    2    HA   ASP  62           HA       ASP  62  11.024 -13.610 -14.924
    3    HB2  ASP  62           HB2      ASP  62   8.956 -12.276 -14.844
    4    HB3  ASP  62           HB3      ASP  62  10.388 -11.285 -14.583

  No H/Q in entry =           4
  In of MODEL   84
    1    H    ALA  63           H        ALA  63  11.530 -15.108 -17.093
    2    HA   ALA  63           HA       ALA  63   9.446 -15.353 -19.019
    3    HB2  ALA  63           HB1      ALA  63  11.593 -17.206 -18.005
    4    HB1  ALA  63           HB2      ALA  63  11.459 -16.432 -19.582
    5    HB3  ALA  63           HB3      ALA  63  10.388 -17.768 -19.165

  No H/Q in entry =           5
  In of MODEL   84
    1    H    GLY  64           H        GLY  64   9.994 -16.796 -15.854
    2    HA3  GLY  64           HA2      GLY  64   8.580 -17.848 -14.382
    3    HA2  GLY  64           HA3      GLY  64   7.238 -17.254 -15.349

  No H/Q in entry =           3
  In of MODEL   84
    1    H    GLU  65           H        GLU  65   6.248 -19.364 -14.858
    2    HA   GLU  65           HA       GLU  65   7.408 -21.790 -15.716
    3    HB2  GLU  65           HB2      GLU  65   4.533 -21.036 -15.207
    4    HB3  GLU  65           HB3      GLU  65   5.066 -22.679 -15.563
    5    HG2  GLU  65           HG2      GLU  65   6.546 -22.658 -13.620
    6    HG3  GLU  65           HG3      GLU  65   6.115 -20.983 -13.279

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLY  66           H        GLY  66   5.147 -19.620 -17.265
    2    HA3  GLY  66           HA2      GLY  66   5.274 -21.127 -19.781
    3    HA2  GLY  66           HA3      GLY  66   4.049 -19.948 -19.357

  No H/Q in entry =           3
  In of MODEL   84
    1    H    LYS  67           H        LYS  67   5.117 -19.782 -21.782
    2    HA   LYS  67           HA       LYS  67   7.472 -18.313 -22.102
    3    HB2  LYS  67           HB2      LYS  67   5.127 -18.228 -23.990
    4    HB3  LYS  67           HB3      LYS  67   6.849 -18.103 -24.371
    5    HG2  LYS  67           HG2      LYS  67   5.276 -20.523 -23.518
    6    HG3  LYS  67           HG3      LYS  67   6.393 -20.351 -24.868
    7    HD2  LYS  67           HD2      LYS  67   8.214 -19.989 -23.073
    8    HD3  LYS  67           HD3      LYS  67   7.033 -20.644 -21.937
    9    HE2  LYS  67           HE2      LYS  67   6.796 -22.531 -23.789
   10    HE3  LYS  67           HE3      LYS  67   8.423 -22.001 -24.216
   11    HZ2  LYS  67           HZ1      LYS  67   8.359 -23.815 -22.556
   12    HZ1  LYS  67           HZ2      LYS  67   7.590 -22.758 -21.472
   13    HZ3  LYS  67           HZ3      LYS  67   9.168 -22.428 -22.010

  No H/Q in entry =          13
  In of MODEL   84
    1    H    MET  68           H        MET  68   4.148 -17.208 -21.926
    2    HA   MET  68           HA       MET  68   4.902 -14.396 -22.067
    3    HB2  MET  68           HB2      MET  68   2.233 -15.800 -21.967
    4    HB3  MET  68           HB3      MET  68   2.428 -14.049 -22.053
    5    HG2  MET  68           HG2      MET  68   3.564 -16.008 -24.068
    6    HG3  MET  68           HG3      MET  68   2.085 -15.076 -24.297
    7    HE1  MET  68           HE1      MET  68   1.790 -12.828 -24.324
    8    HE3  MET  68           HE2      MET  68   2.942 -11.583 -24.798
    9    HE2  MET  68           HE3      MET  68   2.820 -12.061 -23.107

  No H/Q in entry =           9
  In of MODEL   84
    1    H    LYS  69           H        LYS  69   3.678 -16.672 -19.637
    2    HA   LYS  69           HA       LYS  69   2.941 -14.655 -17.759
    3    HB2  LYS  69           HB2      LYS  69   1.905 -16.882 -17.792
    4    HB3  LYS  69           HB3      LYS  69   3.436 -17.594 -17.275
    5    HG2  LYS  69           HG2      LYS  69   3.399 -16.293 -15.215
    6    HG3  LYS  69           HG3      LYS  69   1.939 -15.454 -15.738
    7    HD2  LYS  69           HD2      LYS  69   0.718 -17.606 -15.756
    8    HD3  LYS  69           HD3      LYS  69   2.175 -18.428 -15.194
    9    HE2  LYS  69           HE2      LYS  69   0.841 -16.150 -13.705
   10    HE3  LYS  69           HE3      LYS  69   0.566 -17.854 -13.347
   11    HZ2  LYS  69           HZ1      LYS  69   2.470 -16.400 -12.198
   12    HZ1  LYS  69           HZ2      LYS  69   3.342 -17.032 -13.511
   13    HZ3  LYS  69           HZ3      LYS  69   2.581 -18.079 -12.410

  No H/Q in entry =          13
  In of MODEL   84
    1    H    VAL  70           H        VAL  70   3.813 -14.171 -15.673
    2    HA   VAL  70           HA       VAL  70   6.759 -14.472 -15.516
    3    HB   VAL  70           HB       VAL  70   6.686 -12.395 -14.157
    4   HG11  VAL  70          HG11      VAL  70   5.454 -12.365 -16.920
    5   HG13  VAL  70          HG12      VAL  70   7.141 -12.089 -16.484
    6   HG12  VAL  70          HG13      VAL  70   5.918 -10.887 -16.079
    7   HG23  VAL  70          HG21      VAL  70   4.501 -11.083 -14.229
    8   HG22  VAL  70          HG22      VAL  70   4.471 -12.516 -13.204
    9   HG21  VAL  70          HG23      VAL  70   3.717 -12.559 -14.796

  No H/Q in entry =           9
  In of MODEL   84
    1    H    SER  71           H        SER  71   7.649 -14.598 -13.333
    2    HA   SER  71           HA       SER  71   6.456 -16.607 -11.729
    3    HB2  SER  71           HB2      SER  71   8.899 -16.142 -11.794
    4    HB3  SER  71           HB3      SER  71   8.610 -14.619 -10.958
    5    HG   SER  71           HG       SER  71   9.096 -16.172  -9.433

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LEU  72           H        LEU  72   5.095 -16.489 -10.061
    2    HA   LEU  72           HA       LEU  72   3.529 -14.188  -9.609
    3    HB2  LEU  72           HB2      LEU  72   3.836 -16.751  -8.051
    4    HB3  LEU  72           HB3      LEU  72   2.662 -15.502  -7.640
    5    HG   LEU  72           HG       LEU  72   2.819 -16.781 -10.388
    6   HD11  LEU  72          HD11      LEU  72   1.020 -17.467  -8.043
    7   HD13  LEU  72          HD12      LEU  72   2.291 -18.495  -8.702
    8   HD12  LEU  72          HD13      LEU  72   0.867 -18.124  -9.673
    9   HD22  LEU  72          HD21      LEU  72   1.582 -14.802 -10.626
   10   HD21  LEU  72          HD22      LEU  72   0.916 -14.889  -9.003
   11   HD23  LEU  72          HD23      LEU  72   0.318 -15.969 -10.259

  No H/Q in entry =          11
  In of MODEL   84
    1    H    VAL  73           H        VAL  73   6.196 -15.613  -7.841
    2    HA   VAL  73           HA       VAL  73   6.125 -14.088  -5.503
    3    HB   VAL  73           HB       VAL  73   8.319 -14.879  -5.083
    4   HG13  VAL  73          HG11      VAL  73   8.088 -17.241  -5.516
    5   HG12  VAL  73          HG12      VAL  73   7.034 -16.936  -6.897
    6   HG11  VAL  73          HG13      VAL  73   6.471 -16.589  -5.263
    7   HG21  VAL  73          HG21      VAL  73   8.482 -14.933  -8.076
    8   HG23  VAL  73          HG22      VAL  73   9.479 -16.056  -7.153
    9   HG22  VAL  73          HG23      VAL  73   9.650 -14.318  -6.906

  No H/Q in entry =           9
  In of MODEL   84
    1    H    LEU  74           H        LEU  74   7.109 -13.176  -8.676
    2    HA   LEU  74           HA       LEU  74   9.040 -11.215  -8.176
    3    HB2  LEU  74           HB2      LEU  74   8.597 -11.953 -10.417
    4    HB3  LEU  74           HB3      LEU  74   6.922 -11.414 -10.316
    5    HG   LEU  74           HG       LEU  74   7.688  -9.075 -10.093
    6   HD12  LEU  74          HD11      LEU  74  10.182  -8.731 -10.678
    7   HD11  LEU  74          HD12      LEU  74  10.392 -10.416 -10.203
    8   HD13  LEU  74          HD13      LEU  74   9.806  -9.236  -9.032
    9   HD21  LEU  74          HD21      LEU  74   7.461 -10.492 -12.318
   10   HD23  LEU  74          HD22      LEU  74   9.174 -10.150 -12.408
   11   HD22  LEU  74          HD23      LEU  74   8.034  -8.825 -12.350

  No H/Q in entry =          11
  In of MODEL   84
    1    H    VAL  75           H        VAL  75   5.542 -10.854  -8.529
    2    HA   VAL  75           HA       VAL  75   5.426  -8.101  -7.933
    3    HB   VAL  75           HB       VAL  75   3.352 -10.261  -7.557
    4   HG12  VAL  75          HG11      VAL  75   1.753  -8.324  -7.435
    5   HG11  VAL  75          HG12      VAL  75   3.132  -7.234  -7.395
    6   HG13  VAL  75          HG13      VAL  75   2.867  -8.358  -6.072
    7   HG22  VAL  75          HG21      VAL  75   2.459  -9.328  -9.645
    8   HG21  VAL  75          HG22      VAL  75   4.137  -9.809  -9.883
    9   HG23  VAL  75          HG23      VAL  75   3.729  -8.106  -9.669

  No H/Q in entry =           9
  In of MODEL   84
    1    H    GLU  76           H        GLU  76   5.191 -10.987  -5.833
    2    HA   GLU  76           HA       GLU  76   4.710  -9.638  -3.407
    3    HB2  GLU  76           HB2      GLU  76   4.551 -12.104  -3.648
    4    HB3  GLU  76           HB3      GLU  76   6.288 -12.191  -3.890
    5    HG2  GLU  76           HG2      GLU  76   5.853 -12.783  -1.593
    6    HG3  GLU  76           HG3      GLU  76   6.589 -11.191  -1.578

  No H/Q in entry =           6
  In of MODEL   84
    1    H    ALA  77           H        ALA  77   7.777 -10.518  -4.971
    2    HA   ALA  77           HA       ALA  77   9.458  -9.470  -2.950
    3    HB3  ALA  77           HB1      ALA  77  10.029  -9.716  -5.914
    4    HB1  ALA  77           HB2      ALA  77  10.235 -11.008  -4.731
    5    HB2  ALA  77           HB3      ALA  77  11.227  -9.553  -4.630

  No H/Q in entry =           5
  In of MODEL   84
    1    H    GLN  78           H        GLN  78   8.059  -8.052  -5.861
    2    HA   GLN  78           HA       GLN  78   9.395  -5.564  -5.746
    3    HB2  GLN  78           HB2      GLN  78   8.109  -6.477  -7.710
    4    HB3  GLN  78           HB3      GLN  78   6.622  -6.120  -6.835
    5    HG2  GLN  78           HG2      GLN  78   7.239  -3.744  -6.731
    6    HG3  GLN  78           HG3      GLN  78   8.741  -4.089  -7.587
    7   HE21  GLN  78          HE21      GLN  78   6.812  -2.287  -8.693
    8   HE22  GLN  78          HE22      GLN  78   6.145  -3.002 -10.081

  No H/Q in entry =           8
  In of MODEL   84
    1    H    LEU  79           H        LEU  79   6.381  -6.727  -4.324
    2    HA   LEU  79           HA       LEU  79   5.371  -4.329  -3.307
    3    HB2  LEU  79           HB2      LEU  79   4.069  -6.389  -3.260
    4    HB3  LEU  79           HB3      LEU  79   5.218  -7.125  -2.146
    5    HG   LEU  79           HG       LEU  79   4.653  -5.493  -0.414
    6   HD13  LEU  79          HD11      LEU  79   4.176  -3.478  -1.458
    7   HD12  LEU  79          HD12      LEU  79   2.553  -4.015  -1.023
    8   HD11  LEU  79          HD13      LEU  79   3.137  -4.228  -2.671
    9   HD23  LEU  79          HD21      LEU  79   2.069  -6.002  -0.329
   10   HD22  LEU  79          HD22      LEU  79   3.217  -7.334  -0.224
   11   HD21  LEU  79          HD23      LEU  79   2.403  -6.997  -1.749

  No H/Q in entry =          11
  In of MODEL   84
    1    H    HIS  80           H        HIS  80   7.566  -6.657  -1.729
    2    HA   HIS  80           HA       HIS  80   7.841  -5.121   0.645
    3    HB2  HIS  80           HB2      HIS  80   9.195  -7.473  -0.560
    4    HB3  HIS  80           HB3      HIS  80  10.098  -6.575   0.662
    5    HD1  HIS  80           HD1      HIS  80   9.608  -7.222   3.002
    6    HD2  HIS  80           HD2      HIS  80   6.400  -8.083   0.481
    7    HE1  HIS  80           HE1      HIS  80   7.840  -8.341   4.443
    8    HE2  HIS  80           HE2      HIS  80   5.879  -8.870   2.915

  No H/Q in entry =           8
  In of MODEL   84
    1    H    LEU  81           H        LEU  81   9.853  -5.375  -2.264
    2    HA   LEU  81           HA       LEU  81  11.885  -3.625  -1.376
    3    HB2  LEU  81           HB2      LEU  81  10.974  -4.413  -4.144
    4    HB3  LEU  81           HB3      LEU  81  12.387  -3.400  -3.847
    5    HG   LEU  81           HG       LEU  81  12.008  -6.128  -2.584
    6   HD12  LEU  81          HD11      LEU  81  13.830  -6.737  -4.333
    7   HD11  LEU  81          HD12      LEU  81  13.258  -5.314  -5.200
    8   HD13  LEU  81          HD13      LEU  81  12.154  -6.645  -4.869
    9   HD23  LEU  81          HD21      LEU  81  14.634  -5.798  -2.564
   10   HD22  LEU  81          HD22      LEU  81  13.646  -5.047  -1.313
   11   HD21  LEU  81          HD23      LEU  81  14.221  -4.087  -2.675

  No H/Q in entry =          11
  In of MODEL   84
    1    H    MET  82           H        MET  82   8.962  -2.998  -3.316
    2    HA   MET  82           HA       MET  82   9.488  -0.268  -3.806
    3    HB2  MET  82           HB2      MET  82   6.937  -1.875  -3.692
    4    HB3  MET  82           HB3      MET  82   6.928  -0.150  -4.050
    5    HG2  MET  82           HG2      MET  82   8.543  -2.209  -5.589
    6    HG3  MET  82           HG3      MET  82   6.973  -1.593  -6.103
    7    HE3  MET  82           HE1      MET  82   7.406   1.868  -7.261
    8    HE2  MET  82           HE2      MET  82   7.029   1.634  -5.556
    9    HE1  MET  82           HE3      MET  82   6.372   0.525  -6.756

  No H/Q in entry =           9
  In of MODEL   84
    1    H    THR  83           H        THR  83   7.700  -1.884  -1.210
    2    HA   THR  83           HA       THR  83   6.834   0.455   0.123
    3    HB   THR  83           HB       THR  83   6.704  -1.128   2.135
    4    HG1  THR  83           HG1      THR  83   7.471  -3.073   1.900
    5   HG22  THR  83          HG21      THR  83   5.062  -2.697   0.658
    6   HG21  THR  83          HG22      THR  83   5.284  -1.363  -0.469
    7   HG23  THR  83          HG23      THR  83   4.638  -1.057   1.144

  No H/Q in entry =           7
  In of MODEL   84
    1    H    SER  84           H        SER  84   9.667  -1.631   0.642
    2    HA   SER  84           HA       SER  84  10.716  -0.203   2.837
    3    HB2  SER  84           HB2      SER  84  11.982  -2.032   0.808
    4    HB3  SER  84           HB3      SER  84  12.922  -1.279   2.094
    5    HG   SER  84           HG       SER  84  10.655  -2.981   2.343

  No H/Q in entry =           5
  In of MODEL   84
    1    H    MET  85           H        MET  85  11.474   0.074  -0.648
    2    HA   MET  85           HA       MET  85  13.463   2.048  -0.386
    3    HB2  MET  85           HB2      MET  85  13.071   0.768  -2.457
    4    HB3  MET  85           HB3      MET  85  11.546   1.625  -2.688
    5    HG2  MET  85           HG2      MET  85  12.761   3.772  -2.781
    6    HG3  MET  85           HG3      MET  85  14.284   2.920  -2.548
    7    HE3  MET  85           HE1      MET  85  11.139   1.757  -4.984
    8    HE2  MET  85           HE2      MET  85  11.517   3.016  -6.156
    9    HE1  MET  85           HE3      MET  85  11.197   3.455  -4.484

  No H/Q in entry =           9
  In of MODEL   84
    1    H    LEU  86           H        LEU  86   9.973   2.368  -0.901
    2    HA   LEU  86           HA       LEU  86   9.896   5.182  -1.073
    3    HB2  LEU  86           HB2      LEU  86   8.061   3.516  -1.658
    4    HB3  LEU  86           HB3      LEU  86   7.728   3.418   0.071
    5    HG   LEU  86           HG       LEU  86   7.556   5.978   0.027
    6   HD11  LEU  86          HD11      LEU  86   8.339   5.556  -2.675
    7   HD13  LEU  86          HD12      LEU  86   7.894   7.078  -1.910
    8   HD12  LEU  86          HD13      LEU  86   6.664   6.113  -2.721
    9   HD23  LEU  86          HD21      LEU  86   5.431   4.622  -1.645
   10   HD22  LEU  86          HD22      LEU  86   5.233   5.877  -0.424
   11   HD21  LEU  86          HD23      LEU  86   5.639   4.233   0.064

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ALA  87           H        ALA  87   9.434   2.991   1.665
    2    HA   ALA  87           HA       ALA  87   8.874   4.896   3.640
    3    HB1  ALA  87           HB1      ALA  87   9.693   2.079   3.545
    4    HB3  ALA  87           HB2      ALA  87   8.563   2.883   4.631
    5    HB2  ALA  87           HB3      ALA  87  10.291   2.920   4.979

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ARG  88           H        ARG  88  11.965   3.488   2.660
    2    HA   ARG  88           HA       ARG  88  13.565   4.866   4.500
    3    HB2  ARG  88           HB2      ARG  88  14.245   2.900   3.091
    4    HB3  ARG  88           HB3      ARG  88  14.395   3.999   1.722
    5    HG2  ARG  88           HG2      ARG  88  15.859   5.312   3.676
    6    HG3  ARG  88           HG3      ARG  88  16.186   3.622   4.049
    7    HD2  ARG  88           HD2      ARG  88  17.458   3.338   2.204
    8    HD3  ARG  88           HD3      ARG  88  16.319   4.208   1.172
    9    HE   ARG  88           HE       ARG  88  18.707   5.278   2.227
   10   HH21  ARG  88          HH11      ARG  88  19.044   7.499   2.041
   11   HH22  ARG  88          HH12      ARG  88  17.689   8.566   1.899
   12   HH11  ARG  88          HH21      ARG  88  15.366   6.018   1.946
   13   HH12  ARG  88          HH22      ARG  88  15.605   7.725   1.821

  No H/Q in entry =          13
  In of MODEL   84
    1    H    GLU  89           H        GLU  89  12.594   5.772   1.178
    2    HA   GLU  89           HA       GLU  89  14.132   8.139   1.033
    3    HB2  GLU  89           HB2      GLU  89  12.995   7.100  -0.921
    4    HB3  GLU  89           HB3      GLU  89  11.447   7.632  -0.263
    5    HG2  GLU  89           HG2      GLU  89  12.139   9.973  -0.416
    6    HG3  GLU  89           HG3      GLU  89  13.746   9.491  -0.952

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LEU  90           H        LEU  90  10.803   7.611   2.155
    2    HA   LEU  90           HA       LEU  90  10.275  10.340   2.739
    3    HB2  LEU  90           HB2      LEU  90   9.089   7.758   3.755
    4    HB3  LEU  90           HB3      LEU  90   8.451   9.349   4.183
    5    HG   LEU  90           HG       LEU  90   8.878   8.481   1.312
    6   HD12  LEU  90          HD11      LEU  90   6.345   8.142   1.369
    7   HD11  LEU  90          HD12      LEU  90   6.497   8.126   3.126
    8   HD13  LEU  90          HD13      LEU  90   7.322   6.903   2.158
    9   HD22  LEU  90          HD21      LEU  90   8.574  10.789   1.246
   10   HD21  LEU  90          HD22      LEU  90   7.585  10.811   2.704
   11   HD23  LEU  90          HD23      LEU  90   6.893  10.259   1.180

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  91           H        ILE  91  11.546   7.657   4.654
    2    HA   ILE  91           HA       ILE  91  11.677   9.014   7.127
    3    HB   ILE  91           HB       ILE  91  13.242   6.686   5.998
    4   HG12  ILE  91          HG12      ILE  91  11.222   6.837   8.255
    5   HG13  ILE  91          HG13      ILE  91  10.755   6.560   6.577
    6   HG22  ILE  91          HG21      ILE  91  13.709   6.465   8.638
    7   HG21  ILE  91          HG22      ILE  91  13.626   8.224   8.543
    8   HG23  ILE  91          HG23      ILE  91  14.810   7.344   7.577
    9   HD13  ILE  91          HD11      ILE  91  11.767   4.463   6.501
   10   HD12  ILE  91          HD12      ILE  91  11.171   4.512   8.160
   11   HD11  ILE  91          HD13      ILE  91  12.872   4.834   7.825

  No H/Q in entry =          11
  In of MODEL   84
    1    H    THR  92           H        THR  92  13.899   8.864   4.378
    2    HA   THR  92           HA       THR  92  16.056  10.262   5.546
    3    HB   THR  92           HB       THR  92  15.075  10.144   2.684
    4    HG1  THR  92           HG1      THR  92  15.914   8.249   3.083
    5   HG22  THR  92          HG21      THR  92  17.643  10.846   2.396
    6   HG21  THR  92          HG22      THR  92  17.329  11.660   3.928
    7   HG23  THR  92          HG23      THR  92  16.359  12.049   2.508

  No H/Q in entry =           7
  In of MODEL   84
    1    H    GLU  93           H        GLU  93  13.167  11.410   3.817
    2    HA   GLU  93           HA       GLU  93  13.750  14.173   3.942
    3    HB2  GLU  93           HB2      GLU  93  11.051  12.788   3.947
    4    HB3  GLU  93           HB3      GLU  93  11.332  14.490   3.582
    5    HG2  GLU  93           HG2      GLU  93  12.682  12.260   2.048
    6    HG3  GLU  93           HG3      GLU  93  11.133  12.937   1.561

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LEU  94           H        LEU  94  12.013  12.001   6.143
    2    HA   LEU  94           HA       LEU  94  11.193  13.937   8.025
    3    HB2  LEU  94           HB2      LEU  94  11.781  10.983   8.289
    4    HB3  LEU  94           HB3      LEU  94  11.203  11.952   9.642
    5    HG   LEU  94           HG       LEU  94   9.723  12.007   7.012
    6   HD11  LEU  94          HD11      LEU  94   9.812   9.779   9.008
    7   HD13  LEU  94          HD12      LEU  94   9.513   9.722   7.272
    8   HD12  LEU  94          HD13      LEU  94   8.231  10.230   8.371
    9   HD23  LEU  94          HD21      LEU  94   7.799  12.392   8.611
   10   HD22  LEU  94          HD22      LEU  94   9.033  13.651   8.654
   11   HD21  LEU  94          HD23      LEU  94   8.973  12.430   9.924

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  95           H        ILE  95  14.175  12.021   7.785
    2    HA   ILE  95           HA       ILE  95  15.336  12.939  10.204
    3    HB   ILE  95           HB       ILE  95  16.582  11.885   7.654
    4   HG12  ILE  95          HG12      ILE  95  16.288  10.673  10.416
    5   HG13  ILE  95          HG13      ILE  95  15.124  10.414   9.119
    6   HG21  ILE  95          HG21      ILE  95  17.831  12.688  10.301
    7   HG23  ILE  95          HG22      ILE  95  18.293  13.223   8.684
    8   HG22  ILE  95          HG23      ILE  95  18.606  11.563   9.186
    9   HD13  ILE  95          HD11      ILE  95  16.611   9.146   7.853
   10   HD12  ILE  95          HD12      ILE  95  17.084   8.694   9.488
   11   HD11  ILE  95          HD13      ILE  95  18.033   9.881   8.594

  No H/Q in entry =          11
  In of MODEL   84
    1    H    GLU  96           H        GLU  96  15.489  14.186   6.874
    2    HA   GLU  96           HA       GLU  96  17.326  16.270   7.361
    3    HB2  GLU  96           HB2      GLU  96  16.667  15.614   5.099
    4    HB3  GLU  96           HB3      GLU  96  15.021  16.162   5.399
    5    HG2  GLU  96           HG2      GLU  96  15.579  18.296   4.865
    6    HG3  GLU  96           HG3      GLU  96  16.877  18.298   6.049

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LEU  97           H        LEU  97  13.815  16.067   7.786
    2    HA   LEU  97           HA       LEU  97  13.387  18.796   8.437
    3    HB2  LEU  97           HB2      LEU  97  11.878  16.262   9.040
    4    HB3  LEU  97           HB3      LEU  97  11.358  17.804   9.716
    5    HG   LEU  97           HG       LEU  97  11.846  17.401   6.751
    6   HD12  LEU  97          HD11      LEU  97   9.323  17.263   6.629
    7   HD11  LEU  97          HD12      LEU  97   9.316  17.057   8.379
    8   HD13  LEU  97          HD13      LEU  97  10.103  15.857   7.353
    9   HD23  LEU  97          HD21      LEU  97  10.100  19.358   6.788
   10   HD22  LEU  97          HD22      LEU  97  11.779  19.723   7.184
   11   HD21  LEU  97          HD23      LEU  97  10.590  19.543   8.472

  No H/Q in entry =          11
  In of MODEL   84
    1    H    HIS  98           H        HIS  98  14.218  15.966  10.423
    2    HA   HIS  98           HA       HIS  98  14.052  17.217  12.944
    3    HB2  HIS  98           HB2      HIS  98  15.812  14.971  11.936
    4    HB3  HIS  98           HB3      HIS  98  15.807  15.503  13.619
    5    HD1  HIS  98           HD1      HIS  98  13.617  13.874  11.018
    6    HD2  HIS  98           HD2      HIS  98  13.502  14.778  15.086
    7    HE1  HIS  98           HE1      HIS  98  11.596  12.668  11.964
    8    HE2  HIS  98           HE2      HIS  98  11.506  13.210  14.437

  No H/Q in entry =           8
  In of MODEL   84
    1    H    GLU  99           H        GLU  99  16.608  17.122  10.511
    2    HA   GLU  99           HA       GLU  99  18.587  18.456  12.047
    3    HB2  GLU  99           HB2      GLU  99  19.074  17.178   9.974
    4    HB3  GLU  99           HB3      GLU  99  18.260  18.433   9.037
    5    HG2  GLU  99           HG2      GLU  99  19.860  20.107   9.836
    6    HG3  GLU  99           HG3      GLU  99  20.643  18.904  10.855

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LYS 100           H        LYS 100  16.061  19.616   9.833
    2    HA   LYS 100           HA       LYS 100  16.847  22.356   9.988
    3    HB2  LYS 100           HB2      LYS 100  14.220  21.060   9.226
    4    HB3  LYS 100           HB3      LYS 100  14.513  22.800   9.142
    5    HG2  LYS 100           HG2      LYS 100  16.489  22.364   7.676
    6    HG3  LYS 100           HG3      LYS 100  16.082  20.645   7.686
    7    HD2  LYS 100           HD2      LYS 100  13.886  21.150   6.686
    8    HD3  LYS 100           HD3      LYS 100  14.276  22.871   6.682
    9    HE2  LYS 100           HE2      LYS 100  16.238  22.403   5.223
   10    HE3  LYS 100           HE3      LYS 100  15.779  20.697   5.183
   11    HZ1  LYS 100           HZ1      LYS 100  13.947  22.886   4.354
   12    HZ3  LYS 100           HZ2      LYS 100  13.769  21.217   4.085
   13    HZ2  LYS 100           HZ3      LYS 100  14.978  22.086   3.269

  No H/Q in entry =          13
  In of MODEL   84
    1    H    LEU 101           H        LEU 101  14.756  20.295  11.943
    2    HA   LEU 101           HA       LEU 101  13.580  22.352  13.528
    3    HB2  LEU 101           HB2      LEU 101  14.033  19.403  13.901
    4    HB3  LEU 101           HB3      LEU 101  13.492  20.376  15.265
    5    HG   LEU 101           HG       LEU 101  12.076  20.470  12.595
    6   HD12  LEU 101          HD11      LEU 101  10.421  18.895  13.856
    7   HD11  LEU 101          HD12      LEU 101  11.816  18.483  14.851
    8   HD13  LEU 101          HD13      LEU 101  11.853  18.183  13.113
    9   HD21  LEU 101          HD21      LEU 101  11.414  21.249  15.450
   10   HD23  LEU 101          HD22      LEU 101  10.155  21.024  14.237
   11   HD22  LEU 101          HD23      LEU 101  11.385  22.264  14.005

  No H/Q in entry =          11
  In of MODEL   84
    1    H    LYS 102           H        LYS 102  16.730  21.758  13.092
    2    HA   LYS 102           HA       LYS 102  18.573  22.631  14.170
    3    HB2  LYS 102           HB2      LYS 102  16.752  24.135  15.307
    4    HB3  LYS 102           HB3      LYS 102  16.962  23.068  16.680
    5    HG2  LYS 102           HG2      LYS 102  18.849  25.090  15.521
    6    HG3  LYS 102           HG3      LYS 102  18.466  24.768  17.198
    7    HD2  LYS 102           HD2      LYS 102  20.142  22.867  15.507
    8    HD3  LYS 102           HD3      LYS 102  20.826  24.188  16.445
    9    HE2  LYS 102           HE2      LYS 102  20.435  21.635  17.404
   10    HE3  LYS 102           HE3      LYS 102  20.648  23.073  18.401
   11    HZ2  LYS 102           HZ1      LYS 102  18.683  21.780  19.012
   12    HZ1  LYS 102           HZ2      LYS 102  18.040  22.014  17.463
   13    HZ3  LYS 102           HZ3      LYS 102  18.264  23.341  18.494

  No H/Q in entry =          13
  In of MODEL   84
    1    H    ALA 103           H        ALA 103  16.504  21.009  16.584
    2    HA   ALA 103           HA       ALA 103  18.234  19.798  18.236
    3    HB2  ALA 103           HB1      ALA 103  16.656  17.785  18.220
    4    HB1  ALA 103           HB2      ALA 103  15.759  18.640  16.965
    5    HB3  ALA 103           HB3      ALA 103  15.933  19.355  18.567

  No H/Q in entry =           5
  In of MODEL   84
    1    H1   ALA   1           H3       ALA   1  -1.569  -6.968 -21.508
    2    H2   ALA   1           H2       ALA   1  -2.359  -8.407 -21.062
    3    H3   ALA   1           H1       ALA   1  -0.751  -8.450 -21.615
    4    HA   ALA   1           HA       ALA   1  -1.581  -8.914 -23.614
    5    HB1  ALA   1           HB1      ALA   1  -3.716  -9.640 -23.146
    6    HB2  ALA   1           HB2      ALA   1  -4.159  -8.127 -23.938
    7    HB3  ALA   1           HB3      ALA   1  -4.100  -8.215 -22.179

  No H/Q in entry =           7
  In of MODEL   84
    1    H    GLU   2           H        GLU   2  -2.412  -7.718 -25.600
    2    HA   GLU   2           HA       GLU   2  -1.018  -5.697 -26.468
    3    HB2  GLU   2           HB2      GLU   2  -4.025  -5.771 -26.789
    4    HB3  GLU   2           HB3      GLU   2  -2.906  -4.901 -27.834
    5    HG2  GLU   2           HG2      GLU   2  -2.396  -6.784 -28.996
    6    HG3  GLU   2           HG3      GLU   2  -2.097  -7.695 -27.521

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLU   3           H        GLU   3  -4.183  -4.452 -25.566
    2    HA   GLU   3           HA       GLU   3  -3.145  -1.896 -24.926
    3    HB2  GLU   3           HB2      GLU   3  -5.829  -3.219 -24.603
    4    HB3  GLU   3           HB3      GLU   3  -5.537  -1.606 -23.949
    5    HG2  GLU   3           HG2      GLU   3  -5.181  -0.669 -26.071
    6    HG3  GLU   3           HG3      GLU   3  -4.780  -2.220 -26.801

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LEU   4           H        LEU   4  -4.731  -4.268 -22.758
    2    HA   LEU   4           HA       LEU   4  -4.373  -3.049 -20.361
    3    HB2  LEU   4           HB2      LEU   4  -3.821  -5.986 -20.842
    4    HB3  LEU   4           HB3      LEU   4  -4.231  -5.247 -19.296
    5    HG   LEU   4           HG       LEU   4  -6.000  -5.316 -21.762
    6   HD13  LEU   4          HD11      LEU   4  -7.190  -7.041 -20.773
    7   HD12  LEU   4          HD12      LEU   4  -6.708  -6.587 -19.139
    8   HD11  LEU   4          HD13      LEU   4  -5.569  -7.422 -20.193
    9   HD23  LEU   4          HD21      LEU   4  -7.689  -4.517 -19.893
   10   HD22  LEU   4          HD22      LEU   4  -6.653  -3.340 -20.698
   11   HD21  LEU   4          HD23      LEU   4  -6.228  -3.935 -19.094

  No H/Q in entry =          11
  In of MODEL   84
    1    H    GLU   5           H        GLU   5  -1.868  -4.878 -22.097
    2    HA   GLU   5           HA       GLU   5   0.113  -4.596 -20.056
    3    HB2  GLU   5           HB2      GLU   5   0.185  -6.359 -21.816
    4    HB3  GLU   5           HB3      GLU   5   0.496  -5.110 -23.020
    5    HG2  GLU   5           HG2      GLU   5   2.557  -4.467 -21.849
    6    HG3  GLU   5           HG3      GLU   5   2.244  -5.679 -20.607

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLU   6           H        GLU   6  -0.524  -2.872 -23.095
    2    HA   GLU   6           HA       GLU   6   1.641  -1.036 -22.817
    3    HB2  GLU   6           HB2      GLU   6   0.519  -1.512 -24.981
    4    HB3  GLU   6           HB3      GLU   6  -0.938  -0.722 -24.374
    5    HG2  GLU   6           HG2      GLU   6   0.316   1.374 -24.068
    6    HG3  GLU   6           HG3      GLU   6   1.780   0.590 -24.657

  No H/Q in entry =           6
  In of MODEL   84
    1    H    VAL   7           H        VAL   7  -1.698  -1.121 -21.776
    2    HA   VAL   7           HA       VAL   7  -1.928   1.588 -20.929
    3    HB   VAL   7           HB       VAL   7  -3.385  -0.937 -20.105
    4   HG11  VAL   7          HG11      VAL   7  -3.769   1.947 -19.279
    5   HG13  VAL   7          HG12      VAL   7  -3.666   0.519 -18.250
    6   HG12  VAL   7          HG13      VAL   7  -5.098   0.788 -19.243
    7   HG21  VAL   7          HG21      VAL   7  -3.542   0.149 -22.489
    8   HG23  VAL   7          HG22      VAL   7  -4.492   1.391 -21.673
    9   HG22  VAL   7          HG23      VAL   7  -5.033  -0.288 -21.654

  No H/Q in entry =           9
  In of MODEL   84
    1    H    VAL   8           H        VAL   8  -0.935  -1.401 -19.297
    2    HA   VAL   8           HA       VAL   8  -0.622  -0.332 -16.697
    3    HB   VAL   8           HB       VAL   8   0.786  -2.639 -18.062
    4   HG12  VAL   8          HG11      VAL   8   1.215  -3.312 -15.617
    5   HG11  VAL   8          HG12      VAL   8   0.839  -1.637 -15.210
    6   HG13  VAL   8          HG13      VAL   8   2.205  -2.003 -16.262
    7   HG22  VAL   8          HG21      VAL   8  -0.989  -3.954 -17.390
    8   HG21  VAL   8          HG22      VAL   8  -1.860  -2.425 -17.353
    9   HG23  VAL   8          HG23      VAL   8  -1.180  -3.084 -15.870

  No H/Q in entry =           9
  In of MODEL   84
    1    H    MET   9           H        MET   9   1.631  -0.615 -19.443
    2    HA   MET   9           HA       MET   9   3.913   0.428 -18.174
    3    HB2  MET   9           HB2      MET   9   2.962   0.419 -21.032
    4    HB3  MET   9           HB3      MET   9   4.445   1.257 -20.577
    5    HG2  MET   9           HG2      MET   9   5.103  -0.954 -19.406
    6    HG3  MET   9           HG3      MET   9   3.812  -1.685 -20.361
    7    HE3  MET   9           HE1      MET   9   4.808  -1.363 -23.963
    8    HE2  MET   9           HE2      MET   9   3.743  -0.269 -23.085
    9    HE1  MET   9           HE3      MET   9   3.705  -1.994 -22.734

  No H/Q in entry =           9
  In of MODEL   84
    1    H    GLY  10           H        GLY  10   1.227   2.031 -19.848
    2    HA3  GLY  10           HA2      GLY  10   2.184   4.686 -19.591
    3    HA2  GLY  10           HA3      GLY  10   0.496   4.223 -19.800

  No H/Q in entry =           3
  In of MODEL   84
    1    H    LEU  11           H        LEU  11   0.098   2.686 -17.521
    2    HA   LEU  11           HA       LEU  11  -0.438   4.653 -15.553
    3    HB2  LEU  11           HB2      LEU  11  -0.365   1.637 -15.410
    4    HB3  LEU  11           HB3      LEU  11  -0.877   2.653 -14.063
    5    HG   LEU  11           HG       LEU  11  -2.114   2.777 -16.827
    6   HD13  LEU  11          HD11      LEU  11  -2.695   0.629 -16.082
    7   HD12  LEU  11          HD12      LEU  11  -4.047   1.617 -15.533
    8   HD11  LEU  11          HD13      LEU  11  -2.791   1.134 -14.394
    9   HD22  LEU  11          HD21      LEU  11  -2.709   4.787 -15.812
   10   HD21  LEU  11          HD22      LEU  11  -2.634   4.114 -14.184
   11   HD23  LEU  11          HD23      LEU  11  -4.008   3.750 -15.229

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  12           H        ILE  12   2.109   2.192 -15.804
    2    HA   ILE  12           HA       ILE  12   3.312   2.721 -13.297
    3    HB   ILE  12           HB       ILE  12   4.571   1.694 -15.863
    4   HG12  ILE  12          HG12      ILE  12   2.558   0.455 -14.730
    5   HG13  ILE  12          HG13      ILE  12   3.959  -0.476 -15.217
    6   HG21  ILE  12          HG21      ILE  12   5.538   1.625 -12.985
    7   HG23  ILE  12          HG22      ILE  12   6.318   2.426 -14.349
    8   HG22  ILE  12          HG23      ILE  12   6.245   0.667 -14.284
    9   HD11  ILE  12          HD11      ILE  12   3.487   0.612 -12.430
   10   HD13  ILE  12          HD12      ILE  12   4.776  -0.480 -12.931
   11   HD12  ILE  12          HD13      ILE  12   3.113  -1.026 -12.932

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  13           H        ILE  13   3.913   3.999 -16.548
    2    HA   ILE  13           HA       ILE  13   6.048   5.719 -15.815
    3    HB   ILE  13           HB       ILE  13   4.016   5.816 -18.060
    4   HG12  ILE  13          HG12      ILE  13   5.816   3.952 -17.807
    5   HG13  ILE  13          HG13      ILE  13   5.615   4.728 -19.373
    6   HG22  ILE  13          HG21      ILE  13   5.763   7.386 -19.132
    7   HG21  ILE  13          HG22      ILE  13   6.378   7.629 -17.502
    8   HG23  ILE  13          HG23      ILE  13   4.719   8.080 -17.890
    9   HD12  ILE  13          HD11      ILE  13   8.042   4.443 -18.241
   10   HD11  ILE  13          HD12      ILE  13   7.568   5.958 -17.484
   11   HD13  ILE  13          HD13      ILE  13   7.633   5.838 -19.238

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ASN  14           H        ASN  14   2.540   6.210 -16.083
    2    HA   ASN  14           HA       ASN  14   2.494   8.953 -15.434
    3    HB2  ASN  14           HB2      ASN  14   0.603   7.312 -16.272
    4    HB3  ASN  14           HB3      ASN  14   0.282   7.126 -14.553
    5   HD21  ASN  14          HD21      ASN  14  -1.739   8.285 -15.981
    6   HD22  ASN  14          HD22      ASN  14  -1.804   9.957 -15.707

  No H/Q in entry =           6
  In of MODEL   84
    1    H    SER  15           H        SER  15   2.202   6.067 -13.370
    2    HA   SER  15           HA       SER  15   1.892   7.426 -10.916
    3    HB2  SER  15           HB2      SER  15   2.436   5.338  -9.876
    4    HB3  SER  15           HB3      SER  15   1.621   4.920 -11.379
    5    HG   SER  15           HG       SER  15   3.365   3.840 -11.796

  No H/Q in entry =           5
  In of MODEL   84
    1    H    GLY  16           H        GLY  16   4.770   6.342 -12.678
    2    HA3  GLY  16           HA2      GLY  16   6.693   7.094 -10.743
    3    HA2  GLY  16           HA3      GLY  16   6.998   6.899 -12.468

  No H/Q in entry =           3
  In of MODEL   84
    1    H    GLN  17           H        GLN  17   5.305   8.858 -13.523
    2    HA   GLN  17           HA       GLN  17   6.877  11.201 -13.204
    3    HB2  GLN  17           HB2      GLN  17   5.568  10.739 -15.251
    4    HB3  GLN  17           HB3      GLN  17   4.073  10.927 -14.331
    5    HG2  GLN  17           HG2      GLN  17   4.693  13.253 -13.791
    6    HG3  GLN  17           HG3      GLN  17   6.180  13.071 -14.720
    7   HE21  GLN  17          HE21      GLN  17   6.005  13.868 -16.814
    8   HE22  GLN  17          HE22      GLN  17   4.568  13.921 -17.718

  No H/Q in entry =           8
  In of MODEL   84
    1    H    ALA  18           H        ALA  18   3.778  10.171 -11.861
    2    HA   ALA  18           HA       ALA  18   3.047  12.552 -10.585
    3    HB1  ALA  18           HB1      ALA  18   1.924  10.094 -10.818
    4    HB2  ALA  18           HB2      ALA  18   1.372  11.307  -9.667
    5    HB3  ALA  18           HB3      ALA  18   2.465  10.026  -9.142

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ARG  19           H        ARG  19   4.927   9.789  -9.317
    2    HA   ARG  19           HA       ARG  19   5.456  10.937  -6.790
    3    HB2  ARG  19           HB2      ARG  19   5.877   8.538  -7.327
    4    HB3  ARG  19           HB3      ARG  19   7.232   9.032  -8.345
    5    HG2  ARG  19           HG2      ARG  19   8.347  10.067  -6.418
    6    HG3  ARG  19           HG3      ARG  19   6.972   9.671  -5.389
    7    HD2  ARG  19           HD2      ARG  19   8.739   8.039  -5.037
    8    HD3  ARG  19           HD3      ARG  19   7.367   7.256  -5.827
    9    HE   ARG  19           HE       ARG  19   9.071   8.089  -7.870
   10   HH21  ARG  19          HH11      ARG  19  10.636   6.692  -8.725
   11   HH22  ARG  19          HH12      ARG  19  11.185   5.342  -7.795
   12   HH11  ARG  19          HH21      ARG  19   9.147   6.047  -5.100
   13   HH12  ARG  19          HH22      ARG  19  10.339   4.976  -5.741

  No H/Q in entry =          13
  In of MODEL   84
    1    H    SER  20           H        SER  20   7.274  10.986  -9.838
    2    HA   SER  20           HA       SER  20   9.514  12.405  -9.007
    3    HB2  SER  20           HB2      SER  20   9.551  11.540 -11.214
    4    HB3  SER  20           HB3      SER  20   8.048  12.349 -11.639
    5    HG   SER  20           HG       SER  20  10.512  13.608 -10.991

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LEU  21           H        LEU  21   6.411  13.668 -10.200
    2    HA   LEU  21           HA       LEU  21   7.072  16.415  -9.964
    3    HB2  LEU  21           HB2      LEU  21   4.408  14.982  -9.890
    4    HB3  LEU  21           HB3      LEU  21   4.569  16.737  -9.889
    5    HG   LEU  21           HG       LEU  21   5.771  14.951 -12.026
    6   HD13  LEU  21          HD11      LEU  21   3.412  14.666 -12.225
    7   HD12  LEU  21          HD12      LEU  21   3.838  15.900 -13.413
    8   HD11  LEU  21          HD13      LEU  21   3.103  16.369 -11.881
    9   HD21  LEU  21          HD21      LEU  21   5.546  17.921 -11.584
   10   HD23  LEU  21          HD22      LEU  21   5.528  17.318 -13.238
   11   HD22  LEU  21          HD23      LEU  21   6.912  17.001 -12.206

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ALA  22           H        ALA  22   5.567  14.111  -7.726
    2    HA   ALA  22           HA       ALA  22   4.956  15.907  -5.652
    3    HB3  ALA  22           HB1      ALA  22   4.205  13.513  -5.825
    4    HB2  ALA  22           HB2      ALA  22   4.790  13.980  -4.228
    5    HB1  ALA  22           HB3      ALA  22   5.818  13.031  -5.303

  No H/Q in entry =           5
  In of MODEL   84
    1    H    TYR  23           H        TYR  23   7.899  13.896  -6.097
    2    HA   TYR  23           HA       TYR  23   9.276  14.912  -3.840
    3    HB2  TYR  23           HB2      TYR  23  10.072  12.913  -5.007
    4    HB3  TYR  23           HB3      TYR  23  10.383  13.859  -6.461
    5    HD1  TYR  23           HD1      TYR  23  11.348  13.500  -2.873
    6    HD2  TYR  23           HD2      TYR  23  12.410  15.050  -6.737
    7    HE1  TYR  23           HE1      TYR  23  13.603  14.083  -2.021
    8    HE2  TYR  23           HE2      TYR  23  14.663  15.634  -5.884
    9    HH   TYR  23           HH       TYR  23  15.526  15.115  -2.468

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ALA  24           H        ALA  24   9.090  16.032  -7.202
    2    HA   ALA  24           HA       ALA  24  10.975  18.125  -6.946
    3    HB2  ALA  24           HB1      ALA  24  10.533  18.195  -9.155
    4    HB3  ALA  24           HB2      ALA  24   8.974  18.935  -8.793
    5    HB1  ALA  24           HB3      ALA  24   9.108  17.183  -8.930

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ALA  25           H        ALA  25   7.497  17.921  -6.327
    2    HA   ALA  25           HA       ALA  25   7.002  20.634  -5.747
    3    HB1  ALA  25           HB1      ALA  25   5.352  18.627  -5.957
    4    HB2  ALA  25           HB2      ALA  25   4.977  19.909  -4.804
    5    HB3  ALA  25           HB3      ALA  25   5.674  18.390  -4.239

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LEU  26           H        LEU  26   8.084  17.952  -3.708
    2    HA   LEU  26           HA       LEU  26   8.180  19.373  -1.265
    3    HB2  LEU  26           HB2      LEU  26   8.289  16.957  -1.269
    4    HB3  LEU  26           HB3      LEU  26   9.760  16.978  -2.239
    5    HG   LEU  26           HG       LEU  26  10.967  18.095  -0.394
    6   HD12  LEU  26          HD11      LEU  26   9.740  18.087   1.865
    7   HD11  LEU  26          HD12      LEU  26   8.254  17.944   0.930
    8   HD13  LEU  26          HD13      LEU  26   9.290  19.357   0.727
    9   HD21  LEU  26          HD21      LEU  26   9.448  15.615   0.469
   10   HD23  LEU  26          HD22      LEU  26  10.960  16.183   1.169
   11   HD22  LEU  26          HD23      LEU  26  10.918  15.631  -0.503

  No H/Q in entry =          11
  In of MODEL   84
    1    H    LYS  27           H        LYS  27  10.601  18.825  -3.791
    2    HA   LYS  27           HA       LYS  27  12.777  20.075  -2.557
    3    HB2  LYS  27           HB2      LYS  27  12.888  18.737  -4.652
    4    HB3  LYS  27           HB3      LYS  27  12.115  20.067  -5.513
    5    HG2  LYS  27           HG2      LYS  27  13.971  21.562  -4.928
    6    HG3  LYS  27           HG3      LYS  27  14.739  20.271  -3.996
    7    HD2  LYS  27           HD2      LYS  27  14.892  18.893  -6.056
    8    HD3  LYS  27           HD3      LYS  27  14.169  20.210  -6.979
    9    HE2  LYS  27           HE2      LYS  27  16.046  21.685  -6.360
   10    HE3  LYS  27           HE3      LYS  27  16.773  20.372  -5.428
   11    HZ3  LYS  27           HZ1      LYS  27  17.764  20.487  -7.613
   12    HZ2  LYS  27           HZ2      LYS  27  16.238  20.362  -8.355
   13    HZ1  LYS  27           HZ3      LYS  27  16.869  19.052  -7.476

  No H/Q in entry =          13
  In of MODEL   84
    1    H    GLN  28           H        GLN  28  10.147  21.447  -4.501
    2    HA   GLN  28           HA       GLN  28  11.089  24.106  -4.644
    3    HB2  GLN  28           HB2      GLN  28   8.262  23.019  -4.534
    4    HB3  GLN  28           HB3      GLN  28   8.666  24.695  -4.908
    5    HG2  GLN  28           HG2      GLN  28   9.672  22.287  -6.455
    6    HG3  GLN  28           HG3      GLN  28   8.335  23.320  -6.959
    7   HE21  GLN  28          HE21      GLN  28  11.505  22.837  -7.637
    8   HE22  GLN  28          HE22      GLN  28  11.974  24.423  -8.026

  No H/Q in entry =           8
  In of MODEL   84
    1    H    ALA  29           H        ALA  29   9.167  22.392  -2.215
    2    HA   ALA  29           HA       ALA  29   8.603  24.573  -0.524
    3    HB2  ALA  29           HB1      ALA  29   7.884  22.994   1.037
    4    HB1  ALA  29           HB2      ALA  29   9.113  21.820   0.568
    5    HB3  ALA  29           HB3      ALA  29   7.726  22.108  -0.479

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LYS  30           H        LYS  30  11.348  22.325  -0.602
    2    HA   LYS  30           HA       LYS  30  12.659  23.279   1.705
    3    HB2  LYS  30           HB2      LYS  30  13.765  22.011  -0.810
    4    HB3  LYS  30           HB3      LYS  30  14.745  22.371   0.613
    5    HG2  LYS  30           HG2      LYS  30  13.201  20.972   1.987
    6    HG3  LYS  30           HG3      LYS  30  12.319  20.550   0.515
    7    HD2  LYS  30           HD2      LYS  30  14.371  19.582  -0.449
    8    HD3  LYS  30           HD3      LYS  30  15.271  20.018   1.005
    9    HE2  LYS  30           HE2      LYS  30  13.776  18.571   2.353
   10    HE3  LYS  30           HE3      LYS  30  12.906  18.115   0.883
   11    HZ2  LYS  30           HZ1      LYS  30  14.708  16.546   1.639
   12    HZ1  LYS  30           HZ2      LYS  30  15.837  17.743   1.192
   13    HZ3  LYS  30           HZ3      LYS  30  14.806  17.057   0.024

  No H/Q in entry =          13
  In of MODEL   84
    1    H    GLN  31           H        GLN  31  12.542  24.496  -1.587
    2    HA   GLN  31           HA       GLN  31  14.682  26.403  -1.157
    3    HB2  GLN  31           HB2      GLN  31  12.639  26.444  -3.382
    4    HB3  GLN  31           HB3      GLN  31  14.254  27.151  -3.380
    5    HG2  GLN  31           HG2      GLN  31  14.735  24.456  -2.815
    6    HG3  GLN  31           HG3      GLN  31  13.432  24.397  -3.994
    7   HE21  GLN  31          HE21      GLN  31  16.281  23.626  -4.400
    8   HE22  GLN  31          HE22      GLN  31  16.847  24.608  -5.663

  No H/Q in entry =           8
  In of MODEL   84
    1    H    GLY  32           H        GLY  32  11.608  26.194  -0.013
    2    HA3  GLY  32           HA2      GLY  32  10.441  27.749   1.266
    3    HA2  GLY  32           HA3      GLY  32  11.558  28.995   0.721

  No H/Q in entry =           3
  In of MODEL   84
    1    H    ASP  33           H        ASP  33  10.207  27.091  -1.780
    2    HA   ASP  33           HA       ASP  33   8.527  29.355  -2.626
    3    HB2  ASP  33           HB2      ASP  33   9.638  26.950  -4.078
    4    HB3  ASP  33           HB3      ASP  33   8.479  28.060  -4.804

  No H/Q in entry =           4
  In of MODEL   84
    1    H    PHE  34           H        PHE  34   6.842  28.862  -1.065
    2    HA   PHE  34           HA       PHE  34   5.480  26.379  -0.980
    3    HB2  PHE  34           HB2      PHE  34   4.499  29.157  -0.289
    4    HB3  PHE  34           HB3      PHE  34   3.661  27.659   0.116
    5    HD1  PHE  34           HD1      PHE  34   5.893  30.068   1.341
    6    HD2  PHE  34           HD2      PHE  34   5.243  25.823   1.270
    7    HE1  PHE  34           HE1      PHE  34   7.285  29.820   3.377
    8    HE2  PHE  34           HE2      PHE  34   6.637  25.578   3.304
    9    HZ   PHE  34           HZ       PHE  34   7.652  27.578   4.357

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ALA  35           H        ALA  35   5.029  29.248  -2.979
    2    HA   ALA  35           HA       ALA  35   2.483  28.619  -4.007
    3    HB3  ALA  35           HB1      ALA  35   3.525  30.027  -6.039
    4    HB2  ALA  35           HB2      ALA  35   4.740  30.392  -4.814
    5    HB1  ALA  35           HB3      ALA  35   3.046  30.788  -4.522

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ALA  36           H        ALA  36   5.716  27.975  -5.363
    2    HA   ALA  36           HA       ALA  36   4.738  26.547  -7.613
    3    HB3  ALA  36           HB1      ALA  36   6.896  26.689  -8.228
    4    HB2  ALA  36           HB2      ALA  36   7.385  25.659  -6.881
    5    HB1  ALA  36           HB3      ALA  36   7.267  27.405  -6.659

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ALA  37           H        ALA  37   5.701  25.547  -4.362
    2    HA   ALA  37           HA       ALA  37   5.662  22.760  -4.802
    3    HB2  ALA  37           HB1      ALA  37   5.388  24.540  -2.416
    4    HB1  ALA  37           HB2      ALA  37   6.531  23.231  -2.714
    5    HB3  ALA  37           HB3      ALA  37   4.872  22.864  -2.244

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LYS  38           H        LYS  38   3.113  24.945  -3.626
    2    HA   LYS  38           HA       LYS  38   1.027  23.116  -3.411
    3    HB2  LYS  38           HB2      LYS  38   1.359  25.874  -3.149
    4    HB3  LYS  38           HB3      LYS  38   0.160  25.723  -4.429
    5    HG2  LYS  38           HG2      LYS  38  -1.280  24.383  -2.991
    6    HG3  LYS  38           HG3      LYS  38  -0.035  24.327  -1.735
    7    HD2  LYS  38           HD2      LYS  38  -0.238  26.661  -1.279
    8    HD3  LYS  38           HD3      LYS  38  -1.152  26.949  -2.760
    9    HE2  LYS  38           HE2      LYS  38  -2.656  26.964  -0.821
   10    HE3  LYS  38           HE3      LYS  38  -3.020  25.590  -1.868
   11    HZ3  LYS  38           HZ1      LYS  38  -2.284  24.118  -0.341
   12    HZ2  LYS  38           HZ2      LYS  38  -2.644  25.368   0.753
   13    HZ1  LYS  38           HZ3      LYS  38  -1.047  25.131   0.227

  No H/Q in entry =          13
  In of MODEL   84
    1    H    ALA  39           H        ALA  39   1.993  25.037  -6.252
    2    HA   ALA  39           HA       ALA  39  -0.076  24.161  -7.959
    3    HB2  ALA  39           HB1      ALA  39   2.656  24.833  -9.009
    4    HB1  ALA  39           HB2      ALA  39   1.680  26.084  -8.239
    5    HB3  ALA  39           HB3      ALA  39   1.074  25.248  -9.669

  No H/Q in entry =           5
  In of MODEL   84
    1    H    MET  40           H        MET  40   3.172  22.884  -7.383
    2    HA   MET  40           HA       MET  40   3.089  20.870  -9.383
    3    HB2  MET  40           HB2      MET  40   4.698  21.096  -6.833
    4    HB3  MET  40           HB3      MET  40   4.959  19.847  -8.052
    5    HG2  MET  40           HG2      MET  40   4.994  22.806  -8.706
    6    HG3  MET  40           HG3      MET  40   6.447  21.912  -8.260
    7    HE3  MET  40           HE1      MET  40   7.336  19.714 -11.077
    8    HE2  MET  40           HE2      MET  40   6.775  19.384  -9.441
    9    HE1  MET  40           HE3      MET  40   7.860  20.741  -9.735

  No H/Q in entry =           9
  In of MODEL   84
    1    H    MET  41           H        MET  41   2.173  20.893  -5.959
    2    HA   MET  41           HA       MET  41   1.661  18.123  -5.692
    3    HB2  MET  41           HB2      MET  41   0.311  20.465  -4.332
    4    HB3  MET  41           HB3      MET  41   0.167  18.784  -3.831
    5    HG2  MET  41           HG2      MET  41   2.876  19.028  -3.866
    6    HG3  MET  41           HG3      MET  41   2.423  20.681  -3.464
    7    HE2  MET  41           HE1      MET  41  -0.607  19.398  -1.745
    8    HE1  MET  41           HE2      MET  41   0.198  20.919  -2.116
    9    HE3  MET  41           HE3      MET  41   0.143  20.342  -0.450

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ASP  42           H        ASP  42  -0.397  20.836  -6.656
    2    HA   ASP  42           HA       ASP  42  -2.828  19.457  -6.798
    3    HB2  ASP  42           HB2      ASP  42  -2.141  22.034  -7.045
    4    HB3  ASP  42           HB3      ASP  42  -2.288  21.644  -8.755

  No H/Q in entry =           4
  In of MODEL   84
    1    H    GLN  43           H        GLN  43  -0.391  20.077  -9.298
    2    HA   GLN  43           HA       GLN  43  -1.767  18.755 -11.392
    3    HB2  GLN  43           HB2      GLN  43   1.187  19.292 -11.008
    4    HB3  GLN  43           HB3      GLN  43   0.479  18.653 -12.493
    5    HG2  GLN  43           HG2      GLN  43  -1.049  20.668 -12.527
    6    HG3  GLN  43           HG3      GLN  43  -0.101  21.326 -11.196
    7   HE21  GLN  43          HE21      GLN  43   0.048  22.956 -13.276
    8   HE22  GLN  43          HE22      GLN  43   1.465  22.750 -14.183

  No H/Q in entry =           8
  In of MODEL   84
    1    H    SER  44           H        SER  44   0.592  17.623  -9.005
    2    HA   SER  44           HA       SER  44   0.948  15.024 -10.041
    3    HB2  SER  44           HB2      SER  44   1.831  16.461  -7.798
    4    HB3  SER  44           HB3      SER  44   0.979  15.068  -7.133
    5    HG   SER  44           HG       SER  44   3.095  14.467  -7.562

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ARG  45           H        ARG  45  -1.383  16.314  -7.698
    2    HA   ARG  45           HA       ARG  45  -2.751  13.940  -7.073
    3    HB2  ARG  45           HB2      ARG  45  -2.967  16.102  -5.873
    4    HB3  ARG  45           HB3      ARG  45  -3.828  16.767  -7.257
    5    HG2  ARG  45           HG2      ARG  45  -5.580  15.026  -6.981
    6    HG3  ARG  45           HG3      ARG  45  -4.731  14.415  -5.560
    7    HD2  ARG  45           HD2      ARG  45  -4.957  16.676  -4.496
    8    HD3  ARG  45           HD3      ARG  45  -5.947  17.193  -5.876
    9    HE   ARG  45           HE       ARG  45  -7.038  14.804  -4.846
   10   HH21  ARG  45          HH11      ARG  45  -8.875  14.859  -3.575
   11   HH22  ARG  45          HH12      ARG  45  -9.282  16.292  -2.701
   12   HH11  ARG  45          HH21      ARG  45  -6.520  18.051  -3.809
   13   HH12  ARG  45          HH22      ARG  45  -7.943  18.100  -2.831

  No H/Q in entry =          13
  In of MODEL   84
    1    H    MET  46           H        MET  46  -3.354  16.349  -9.614
    2    HA   MET  46           HA       MET  46  -5.683  15.161 -10.682
    3    HB2  MET  46           HB2      MET  46  -3.598  17.013 -11.844
    4    HB3  MET  46           HB3      MET  46  -4.970  16.445 -12.801
    5    HG2  MET  46           HG2      MET  46  -6.535  17.365 -11.172
    6    HG3  MET  46           HG3      MET  46  -5.208  17.844 -10.120
    7    HE3  MET  46           HE1      MET  46  -5.462  18.386 -14.266
    8    HE2  MET  46           HE2      MET  46  -6.692  19.620 -14.010
    9    HE1  MET  46           HE3      MET  46  -6.927  18.002 -13.352

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ALA  47           H        ALA  47  -2.250  14.714 -11.440
    2    HA   ALA  47           HA       ALA  47  -2.580  12.993 -13.657
    3    HB3  ALA  47           HB1      ALA  47  -0.410  13.900 -13.301
    4    HB2  ALA  47           HB2      ALA  47  -0.254  12.171 -12.974
    5    HB1  ALA  47           HB3      ALA  47  -0.358  13.317 -11.636

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LEU  48           H        LEU  48  -2.306  12.346 -10.186
    2    HA   LEU  48           HA       LEU  48  -2.376   9.506 -10.355
    3    HB2  LEU  48           HB2      LEU  48  -3.157  11.408  -8.134
    4    HB3  LEU  48           HB3      LEU  48  -3.048   9.658  -7.940
    5    HG   LEU  48           HG       LEU  48  -0.764  11.381  -8.930
    6   HD13  LEU  48          HD11      LEU  48  -1.054  12.140  -6.737
    7   HD12  LEU  48          HD12      LEU  48   0.121  10.842  -6.543
    8   HD11  LEU  48          HD13      LEU  48  -1.575  10.563  -6.147
    9   HD22  LEU  48          HD21      LEU  48  -0.246   9.203  -9.579
   10   HD21  LEU  48          HD22      LEU  48  -1.110   8.474  -8.226
   11   HD23  LEU  48          HD23      LEU  48   0.456   9.240  -7.963

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ASN  49           H        ASN  49  -4.861  11.975  -9.945
    2    HA   ASN  49           HA       ASN  49  -7.032  10.289  -9.413
    3    HB2  ASN  49           HB2      ASN  49  -7.102  12.714  -9.084
    4    HB3  ASN  49           HB3      ASN  49  -6.959  12.976 -10.817
    5   HD21  ASN  49          HD21      ASN  49  -9.031  14.048 -10.945
    6   HD22  ASN  49          HD22      ASN  49 -10.486  13.195 -10.769

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLU  50           H        GLU  50  -5.762  11.509 -12.495
    2    HA   GLU  50           HA       GLU  50  -7.704  10.243 -14.147
    3    HB2  GLU  50           HB2      GLU  50  -6.254  12.078 -14.953
    4    HB3  GLU  50           HB3      GLU  50  -4.851  11.018 -14.818
    5    HG2  GLU  50           HG2      GLU  50  -5.810   9.480 -16.462
    6    HG3  GLU  50           HG3      GLU  50  -7.279  10.446 -16.546

  No H/Q in entry =           6
  In of MODEL   84
    1    H    ALA  51           H        ALA  51  -4.526   9.274 -12.943
    2    HA   ALA  51           HA       ALA  51  -4.364   6.828 -14.371
    3    HB2  ALA  51           HB1      ALA  51  -2.382   6.553 -13.271
    4    HB1  ALA  51           HB2      ALA  51  -3.074   6.963 -11.702
    5    HB3  ALA  51           HB3      ALA  51  -2.629   8.242 -12.831

  No H/Q in entry =           5
  In of MODEL   84
    1    H    HIS  52           H        HIS  52  -5.546   7.637 -11.119
    2    HA   HIS  52           HA       HIS  52  -6.209   5.018 -10.298
    3    HB2  HIS  52           HB2      HIS  52  -6.093   6.914  -8.745
    4    HB3  HIS  52           HB3      HIS  52  -7.490   7.651  -9.530
    5    HD1  HIS  52           HD1      HIS  52  -9.667   5.870  -9.619
    6    HD2  HIS  52           HD2      HIS  52  -6.843   5.365  -6.596
    7    HE1  HIS  52           HE1      HIS  52 -10.788   4.490  -7.815
    8    HE2  HIS  52           HE2      HIS  52  -9.078   4.174  -5.964

  No H/Q in entry =           8
  In of MODEL   84
    1    H    LEU  53           H        LEU  53  -8.049   7.467 -12.078
    2    HA   LEU  53           HA       LEU  53 -10.544   6.154 -12.097
    3    HB2  LEU  53           HB2      LEU  53  -9.275   8.153 -13.957
    4    HB3  LEU  53           HB3      LEU  53 -10.868   7.475 -14.284
    5    HG   LEU  53           HG       LEU  53 -10.165   8.789 -11.640
    6   HD13  LEU  53          HD11      LEU  53  -9.900  10.526 -13.258
    7   HD12  LEU  53          HD12      LEU  53 -11.527  10.725 -12.604
    8   HD11  LEU  53          HD13      LEU  53 -11.293   9.975 -14.181
    9   HD22  LEU  53          HD21      LEU  53 -12.155   7.568 -11.317
   10   HD21  LEU  53          HD22      LEU  53 -12.692   7.832 -12.971
   11   HD23  LEU  53          HD23      LEU  53 -12.782   9.137 -11.804

  No H/Q in entry =          11
  In of MODEL   84
    1    H    VAL  54           H        VAL  54  -7.790   5.988 -14.333
    2    HA   VAL  54           HA       VAL  54  -8.997   4.215 -16.184
    3    HB   VAL  54           HB       VAL  54  -6.094   4.742 -15.497
    4   HG12  VAL  54          HG11      VAL  54  -5.836   3.668 -17.890
    5   HG11  VAL  54          HG12      VAL  54  -7.359   2.873 -17.491
    6   HG13  VAL  54          HG13      VAL  54  -5.942   2.626 -16.472
    7   HG22  VAL  54          HG21      VAL  54  -6.879   6.683 -16.535
    8   HG21  VAL  54          HG22      VAL  54  -8.064   5.814 -17.507
    9   HG23  VAL  54          HG23      VAL  54  -6.357   5.749 -17.937

  No H/Q in entry =           9
  In of MODEL   84
    1    H    GLN  55           H        GLN  55  -6.996   3.673 -13.285
    2    HA   GLN  55           HA       GLN  55  -6.884   0.858 -13.552
    3    HB2  GLN  55           HB2      GLN  55  -5.336   1.761 -12.028
    4    HB3  GLN  55           HB3      GLN  55  -6.561   2.714 -11.196
    5    HG2  GLN  55           HG2      GLN  55  -7.237   0.946  -9.885
    6    HG3  GLN  55           HG3      GLN  55  -7.002  -0.234 -11.168
    7   HE21  GLN  55          HE21      GLN  55  -5.367  -1.673 -10.678
    8   HE22  GLN  55          HE22      GLN  55  -3.986  -1.314  -9.764

  No H/Q in entry =           8
  In of MODEL   84
    1    H    THR  56           H        THR  56  -9.233   2.996 -11.931
    2    HA   THR  56           HA       THR  56 -10.803   1.096 -10.650
    3    HB   THR  56           HB       THR  56 -11.917   3.480 -12.149
    4    HG1  THR  56           HG1      THR  56 -10.308   3.271  -9.896
    5   HG21  THR  56          HG21      THR  56 -13.366   1.653 -10.958
    6   HG23  THR  56          HG22      THR  56 -13.726   3.357 -10.677
    7   HG22  THR  56          HG23      THR  56 -12.814   2.437  -9.479

  No H/Q in entry =           7
  In of MODEL   84
    1    H    LYS  57           H        LYS  57 -11.011   2.190 -14.032
    2    HA   LYS  57           HA       LYS  57 -13.153   0.489 -14.794
    3    HB2  LYS  57           HB2      LYS  57 -12.290   2.452 -16.103
    4    HB3  LYS  57           HB3      LYS  57 -10.845   1.524 -16.474
    5    HG2  LYS  57           HG2      LYS  57 -13.425   0.200 -17.097
    6    HG3  LYS  57           HG3      LYS  57 -13.019   1.596 -18.090
    7    HD2  LYS  57           HD2      LYS  57 -10.828   0.571 -18.627
    8    HD3  LYS  57           HD3      LYS  57 -11.250  -0.836 -17.653
    9    HE2  LYS  57           HE2      LYS  57 -13.186  -1.284 -19.129
   10    HE3  LYS  57           HE3      LYS  57 -12.777   0.122 -20.111
   11    HZ2  LYS  57           HZ1      LYS  57 -11.399  -2.454 -19.884
   12    HZ1  LYS  57           HZ2      LYS  57 -10.475  -1.068 -20.225
   13    HZ3  LYS  57           HZ3      LYS  57 -11.740  -1.528 -21.263

  No H/Q in entry =          13
  In of MODEL   84
    1    H    LEU  58           H        LEU  58  -9.646   0.085 -14.735
    2    HA   LEU  58           HA       LEU  58  -9.633  -2.427 -16.033
    3    HB2  LEU  58           HB2      LEU  58  -7.611  -1.127 -14.218
    4    HB3  LEU  58           HB3      LEU  58  -7.337  -2.643 -15.078
    5    HG   LEU  58           HG       LEU  58  -8.110  -0.040 -16.433
    6   HD11  LEU  58          HD11      LEU  58  -5.455  -1.259 -15.743
    7   HD13  LEU  58          HD12      LEU  58  -5.963   0.428 -15.689
    8   HD12  LEU  58          HD13      LEU  58  -5.616  -0.334 -17.237
    9   HD22  LEU  58          HD21      LEU  58  -8.672  -1.600 -18.030
   10   HD21  LEU  58          HD22      LEU  58  -7.622  -2.842 -17.351
   11   HD23  LEU  58          HD23      LEU  58  -6.940  -1.560 -18.351

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  59           H        ILE  59 -10.465  -1.543 -12.780
    2    HA   ILE  59           HA       ILE  59 -10.093  -4.311 -11.842
    3    HB   ILE  59           HB       ILE  59  -9.671  -2.043 -10.435
    4   HG12  ILE  59          HG12      ILE  59 -11.014  -4.413  -9.120
    5   HG13  ILE  59          HG13      ILE  59  -9.371  -4.474  -9.707
    6   HG22  ILE  59          HG21      ILE  59 -12.417  -2.795  -9.483
    7   HG21  ILE  59          HG22      ILE  59 -12.223  -1.562 -10.706
    8   HG23  ILE  59          HG23      ILE  59 -11.494  -1.358  -9.116
    9   HD12  ILE  59          HD11      ILE  59  -9.573  -3.872  -7.277
   10   HD11  ILE  59          HD12      ILE  59 -10.353  -2.378  -7.776
   11   HD13  ILE  59          HD13      ILE  59  -8.679  -2.697  -8.236

  No H/Q in entry =          11
  In of MODEL   84
    1    H    GLU  60           H        GLU  60 -12.669  -2.013 -12.645
    2    HA   GLU  60           HA       GLU  60 -14.842  -3.550 -11.640
    3    HB2  GLU  60           HB2      GLU  60 -15.249  -1.255 -12.156
    4    HB3  GLU  60           HB3      GLU  60 -14.628  -1.438 -13.793
    5    HG2  GLU  60           HG2      GLU  60 -17.101  -1.358 -13.776
    6    HG3  GLU  60           HG3      GLU  60 -16.522  -2.906 -14.356

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLY  61           H        GLY  61 -13.166  -3.510 -14.752
    2    HA3  GLY  61           HA2      GLY  61 -14.859  -5.766 -15.652
    3    HA2  GLY  61           HA3      GLY  61 -14.022  -4.651 -16.726

  No H/Q in entry =           3
  In of MODEL   84
    1    H    ASP  62           H        ASP  62 -12.639  -6.097 -13.845
    2    HA   ASP  62           HA       ASP  62 -10.368  -7.045 -15.309
    3    HB2  ASP  62           HB2      ASP  62  -9.646  -7.877 -13.086
    4    HB3  ASP  62           HB3      ASP  62 -10.142  -6.189 -13.038

  No H/Q in entry =           4
  In of MODEL   84
    1    H    ALA  63           H        ALA  63 -12.361  -8.353 -16.595
    2    HA   ALA  63           HA       ALA  63 -13.164 -10.874 -15.572
    3    HB1  ALA  63           HB1      ALA  63 -12.792  -9.738 -18.348
    4    HB3  ALA  63           HB2      ALA  63 -14.298 -10.124 -17.517
    5    HB2  ALA  63           HB3      ALA  63 -13.265 -11.421 -18.122

  No H/Q in entry =           5
  In of MODEL   84
    1    H    GLY  64           H        GLY  64 -10.325  -9.818 -17.357
    2    HA3  GLY  64           HA2      GLY  64  -8.250 -10.757 -17.644
    3    HA2  GLY  64           HA3      GLY  64  -8.654 -11.886 -16.358

  No H/Q in entry =           3
  In of MODEL   84
    1    H    GLU  65           H        GLU  65  -7.482 -13.473 -17.687
    2    HA   GLU  65           HA       GLU  65  -8.357 -14.193 -20.273
    3    HB2  GLU  65           HB2      GLU  65  -6.823 -15.746 -18.192
    4    HB3  GLU  65           HB3      GLU  65  -7.112 -16.329 -19.832
    5    HG2  GLU  65           HG2      GLU  65  -5.990 -14.368 -20.763
    6    HG3  GLU  65           HG3      GLU  65  -5.756 -13.708 -19.145

  No H/Q in entry =           6
  In of MODEL   84
    1    H    GLY  66           H        GLY  66  -9.179 -15.415 -17.109
    2    HA3  GLY  66           HA2      GLY  66 -11.215 -17.215 -18.222
    3    HA2  GLY  66           HA3      GLY  66 -10.518 -17.331 -16.617

  No H/Q in entry =           3
  In of MODEL   84
    1    H    LYS  67           H        LYS  67 -13.143 -17.545 -16.778
    2    HA   LYS  67           HA       LYS  67 -14.675 -15.203 -16.747
    3    HB2  LYS  67           HB2      LYS  67 -15.100 -17.992 -15.749
    4    HB3  LYS  67           HB3      LYS  67 -16.308 -16.737 -15.449
    5    HG2  LYS  67           HG2      LYS  67 -16.543 -18.101 -17.634
    6    HG3  LYS  67           HG3      LYS  67 -16.653 -16.346 -17.753
    7    HD2  LYS  67           HD2      LYS  67 -14.404 -16.172 -18.565
    8    HD3  LYS  67           HD3      LYS  67 -14.067 -17.859 -18.173
    9    HE2  LYS  67           HE2      LYS  67 -15.335 -18.671 -19.955
   10    HE3  LYS  67           HE3      LYS  67 -16.328 -17.216 -20.040
   11    HZ2  LYS  67           HZ1      LYS  67 -14.560 -17.572 -21.826
   12    HZ1  LYS  67           HZ2      LYS  67 -13.439 -17.124 -20.632
   13    HZ3  LYS  67           HZ3      LYS  67 -14.658 -16.040 -21.107

  No H/Q in entry =          13
  In of MODEL   84
    1    H    MET  68           H        MET  68 -13.292 -17.021 -14.085
    2    HA   MET  68           HA       MET  68 -14.175 -15.078 -12.098
    3    HB2  MET  68           HB2      MET  68 -12.775 -17.742 -11.882
    4    HB3  MET  68           HB3      MET  68 -13.194 -16.732 -10.499
    5    HG2  MET  68           HG2      MET  68 -15.179 -17.756 -12.549
    6    HG3  MET  68           HG3      MET  68 -14.919 -18.469 -10.955
    7    HE1  MET  68           HE1      MET  68 -15.170 -17.537  -8.905
    8    HE3  MET  68           HE2      MET  68 -16.253 -16.235  -8.420
    9    HE2  MET  68           HE3      MET  68 -14.606 -15.859  -8.924

  No H/Q in entry =           9
  In of MODEL   84
    1    H    LYS  69           H        LYS  69 -11.135 -16.095 -13.612
    2    HA   LYS  69           HA       LYS  69  -9.467 -14.799 -11.694
    3    HB2  LYS  69           HB2      LYS  69  -8.719 -16.723 -13.025
    4    HB3  LYS  69           HB3      LYS  69  -8.777 -15.734 -14.484
    5    HG2  LYS  69           HG2      LYS  69  -7.099 -14.214 -13.572
    6    HG3  LYS  69           HG3      LYS  69  -7.099 -15.088 -12.041
    7    HD2  LYS  69           HD2      LYS  69  -6.291 -17.117 -13.210
    8    HD3  LYS  69           HD3      LYS  69  -6.252 -16.215 -14.725
    9    HE2  LYS  69           HE2      LYS  69  -4.718 -15.397 -12.243
   10    HE3  LYS  69           HE3      LYS  69  -4.022 -16.343 -13.558
   11    HZ2  LYS  69           HZ1      LYS  69  -3.999 -13.675 -13.458
   12    HZ1  LYS  69           HZ2      LYS  69  -5.409 -13.936 -14.369
   13    HZ3  LYS  69           HZ3      LYS  69  -3.922 -14.566 -14.899

  No H/Q in entry =          13
  In of MODEL   84
    1    H    VAL  70           H        VAL  70  -8.007 -13.027 -11.955
    2    HA   VAL  70           HA       VAL  70  -9.029 -10.898 -13.751
    3    HB   VAL  70           HB       VAL  70  -8.103  -9.331 -12.072
    4   HG11  VAL  70          HG11      VAL  70 -10.078 -11.432 -11.167
    5   HG13  VAL  70          HG12      VAL  70 -10.423  -9.830 -11.823
    6   HG12  VAL  70          HG13      VAL  70  -9.736  -9.994 -10.206
    7   HG23  VAL  70          HG21      VAL  70  -7.470 -10.348  -9.816
    8   HG22  VAL  70          HG22      VAL  70  -6.309 -10.621 -11.113
    9   HG21  VAL  70          HG23      VAL  70  -7.407 -11.912 -10.628

  No H/Q in entry =           9
  In of MODEL   84
    1    H    SER  71           H        SER  71  -7.408  -9.364 -14.510
    2    HA   SER  71           HA       SER  71  -5.178 -10.607 -15.747
    3    HB2  SER  71           HB2      SER  71  -6.318  -8.565 -16.623
    4    HB3  SER  71           HB3      SER  71  -5.656  -7.654 -15.269
    5    HG   SER  71           HG       SER  71  -4.241  -7.424 -16.952

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LEU  72           H        LEU  72  -3.150 -10.862 -15.099
    2    HA   LEU  72           HA       LEU  72  -2.434 -10.651 -12.386
    3    HB2  LEU  72           HB2      LEU  72  -0.776 -11.062 -14.870
    4    HB3  LEU  72           HB3      LEU  72  -0.112 -11.130 -13.241
    5    HG   LEU  72           HG       LEU  72  -2.453 -12.840 -14.141
    6   HD11  LEU  72          HD11      LEU  72   0.502 -13.523 -14.020
    7   HD13  LEU  72          HD12      LEU  72  -0.467 -13.384 -15.486
    8   HD12  LEU  72          HD13      LEU  72  -0.799 -14.674 -14.330
    9   HD22  LEU  72          HD21      LEU  72  -2.451 -12.861 -11.793
   10   HD21  LEU  72          HD22      LEU  72  -0.705 -12.711 -11.681
   11   HD23  LEU  72          HD23      LEU  72  -1.427 -14.243 -12.166

  No H/Q in entry =          11
  In of MODEL   84
    1    H    VAL  73           H        VAL  73  -1.729  -8.621 -15.160
    2    HA   VAL  73           HA       VAL  73   0.178  -6.912 -14.049
    3    HB   VAL  73           HB       VAL  73  -0.229  -5.486 -15.900
    4   HG13  VAL  73          HG11      VAL  73  -0.129  -7.035 -17.733
    5   HG12  VAL  73          HG12      VAL  73  -1.027  -8.254 -16.830
    6   HG11  VAL  73          HG13      VAL  73   0.618  -7.837 -16.351
    7   HG21  VAL  73          HG21      VAL  73  -2.975  -6.687 -15.759
    8   HG23  VAL  73          HG22      VAL  73  -2.381  -6.090 -17.307
    9   HG22  VAL  73          HG23      VAL  73  -2.506  -4.995 -15.930

  No H/Q in entry =           9
  In of MODEL   84
    1    H    LEU  74           H        LEU  74  -3.219  -7.053 -13.496
    2    HA   LEU  74           HA       LEU  74  -3.857  -4.403 -12.876
    3    HB2  LEU  74           HB2      LEU  74  -5.579  -6.068 -13.055
    4    HB3  LEU  74           HB3      LEU  74  -4.878  -7.008 -11.740
    5    HG   LEU  74           HG       LEU  74  -5.342  -5.158 -10.168
    6   HD12  LEU  74          HD11      LEU  74  -6.946  -3.366 -11.096
    7   HD11  LEU  74          HD12      LEU  74  -6.384  -3.862 -12.691
    8   HD13  LEU  74          HD13      LEU  74  -5.242  -3.203 -11.520
    9   HD21  LEU  74          HD21      LEU  74  -7.039  -6.997 -11.041
   10   HD23  LEU  74          HD22      LEU  74  -7.878  -5.575 -11.621
   11   HD22  LEU  74          HD23      LEU  74  -7.547  -5.743  -9.914

  No H/Q in entry =          11
  In of MODEL   84
    1    H    VAL  75           H        VAL  75  -2.801  -6.989 -10.721
    2    HA   VAL  75           HA       VAL  75  -2.616  -5.444  -8.372
    3    HB   VAL  75           HB       VAL  75  -1.101  -7.926  -9.168
    4   HG12  VAL  75          HG11      VAL  75  -0.639  -8.084  -6.698
    5   HG11  VAL  75          HG12      VAL  75  -1.332  -6.480  -6.503
    6   HG13  VAL  75          HG13      VAL  75   0.140  -6.689  -7.438
    7   HG22  VAL  75          HG21      VAL  75  -2.756  -9.020  -7.729
    8   HG21  VAL  75          HG22      VAL  75  -3.593  -8.091  -8.973
    9   HG23  VAL  75          HG23      VAL  75  -3.478  -7.462  -7.328

  No H/Q in entry =           9
  In of MODEL   84
    1    H    GLU  76           H        GLU  76  -0.199  -6.180 -10.907
    2    HA   GLU  76           HA       GLU  76   1.976  -4.821  -9.743
    3    HB2  GLU  76           HB2      GLU  76   2.189  -6.290 -11.731
    4    HB3  GLU  76           HB3      GLU  76   1.275  -5.132 -12.685
    5    HG2  GLU  76           HG2      GLU  76   3.613  -4.784 -13.173
    6    HG3  GLU  76           HG3      GLU  76   3.085  -3.419 -12.208

  No H/Q in entry =           6
  In of MODEL   84
    1    H    ALA  77           H        ALA  77  -0.561  -3.630 -11.931
    2    HA   ALA  77           HA       ALA  77   0.411  -0.977 -12.098
    3    HB3  ALA  77           HB1      ALA  77  -2.453  -1.946 -12.329
    4    HB1  ALA  77           HB2      ALA  77  -1.277  -1.938 -13.644
    5    HB2  ALA  77           HB3      ALA  77  -1.815  -0.416 -12.935

  No H/Q in entry =           5
  In of MODEL   84
    1    H    GLN  78           H        GLN  78  -1.849  -2.555  -9.895
    2    HA   GLN  78           HA       GLN  78  -2.675  -0.247  -8.488
    3    HB2  GLN  78           HB2      GLN  78  -3.769  -2.514  -8.411
    4    HB3  GLN  78           HB3      GLN  78  -2.430  -3.069  -7.410
    5    HG2  GLN  78           HG2      GLN  78  -2.959  -1.350  -5.736
    6    HG3  GLN  78           HG3      GLN  78  -4.292  -0.775  -6.736
    7   HE21  GLN  78          HE21      GLN  78  -4.805  -1.747  -4.108
    8   HE22  GLN  78          HE22      GLN  78  -5.653  -3.214  -4.229

  No H/Q in entry =           8
  In of MODEL   84
    1    H    LEU  79           H        LEU  79   0.019  -2.484  -8.040
    2    HA   LEU  79           HA       LEU  79   0.985  -1.587  -5.579
    3    HB2  LEU  79           HB2      LEU  79   1.872  -3.586  -6.651
    4    HB3  LEU  79           HB3      LEU  79   2.513  -2.626  -7.981
    5    HG   LEU  79           HG       LEU  79   4.057  -1.479  -6.471
    6   HD13  LEU  79          HD11      LEU  79   3.048  -1.248  -4.405
    7   HD12  LEU  79          HD12      LEU  79   4.136  -2.590  -4.064
    8   HD11  LEU  79          HD13      LEU  79   2.434  -2.902  -4.397
    9   HD23  LEU  79          HD21      LEU  79   5.283  -3.620  -5.573
   10   HD22  LEU  79          HD22      LEU  79   5.081  -3.418  -7.310
   11   HD21  LEU  79          HD23      LEU  79   4.010  -4.499  -6.423

  No H/Q in entry =          11
  In of MODEL   84
    1    H    HIS  80           H        HIS  80   1.851  -0.454  -8.847
    2    HA   HIS  80           HA       HIS  80   3.641   1.545  -7.916
    3    HB2  HIS  80           HB2      HIS  80   2.362   0.848 -10.503
    4    HB3  HIS  80           HB3      HIS  80   2.943   2.505 -10.326
    5    HD1  HIS  80           HD1      HIS  80   5.343   2.827 -10.843
    6    HD2  HIS  80           HD2      HIS  80   4.554  -1.094  -9.665
    7    HE1  HIS  80           HE1      HIS  80   7.543   1.568 -11.010
    8    HE2  HIS  80           HE2      HIS  80   7.074  -0.825 -10.295

  No H/Q in entry =           8
  In of MODEL   84
    1    H    LEU  81           H        LEU  81   0.238   1.680  -8.901
    2    HA   LEU  81           HA       LEU  81  -0.062   4.469  -8.562
    3    HB2  LEU  81           HB2      LEU  81  -2.057   2.206  -8.493
    4    HB3  LEU  81           HB3      LEU  81  -2.524   3.905  -8.397
    5    HG   LEU  81           HG       LEU  81  -0.817   2.777 -10.633
    6   HD12  LEU  81          HD11      LEU  81  -3.050   3.081 -11.935
    7   HD11  LEU  81          HD12      LEU  81  -3.808   3.001 -10.345
    8   HD13  LEU  81          HD13      LEU  81  -2.852   1.643 -10.935
    9   HD23  LEU  81          HD21      LEU  81  -1.931   4.915 -11.726
   10   HD22  LEU  81          HD22      LEU  81  -0.518   5.094 -10.690
   11   HD21  LEU  81          HD23      LEU  81  -2.127   5.427 -10.051

  No H/Q in entry =          11
  In of MODEL   84
    1    H    MET  82           H        MET  82  -0.701   1.769  -6.323
    2    HA   MET  82           HA       MET  82  -1.771   3.339  -4.232
    3    HB2  MET  82           HB2      MET  82  -0.373   0.665  -4.278
    4    HB3  MET  82           HB3      MET  82  -0.960   1.380  -2.779
    5    HG2  MET  82           HG2      MET  82  -2.684   0.879  -5.224
    6    HG3  MET  82           HG3      MET  82  -2.599  -0.199  -3.832
    7    HE3  MET  82           HE1      MET  82  -4.341   1.426  -1.015
    8    HE2  MET  82           HE2      MET  82  -2.614   1.720  -1.196
    9    HE1  MET  82           HE3      MET  82  -3.286   0.158  -1.656

  No H/Q in entry =           9
  In of MODEL   84
    1    H    THR  83           H        THR  83   1.541   2.286  -4.919
    2    HA   THR  83           HA       THR  83   2.744   3.394  -2.613
    3    HB   THR  83           HB       THR  83   4.842   3.363  -4.083
    4    HG1  THR  83           HG1      THR  83   4.611   2.841  -6.110
    5   HG22  THR  83          HG21      THR  83   4.424   0.702  -4.425
    6   HG21  THR  83          HG22      THR  83   3.128   1.066  -3.286
    7   HG23  THR  83          HG23      THR  83   4.804   1.424  -2.862

  No H/Q in entry =           7
  In of MODEL   84
    1    H    SER  84           H        SER  84   2.368   4.681  -5.910
    2    HA   SER  84           HA       SER  84   3.683   7.132  -5.445
    3    HB2  SER  84           HB2      SER  84   1.625   6.287  -7.470
    4    HB3  SER  84           HB3      SER  84   2.288   7.920  -7.439
    5    HG   SER  84           HG       SER  84   3.684   5.459  -7.735

  No H/Q in entry =           5
  In of MODEL   84
    1    H    MET  85           H        MET  85   0.196   6.343  -5.282
    2    HA   MET  85           HA       MET  85  -0.690   8.943  -4.673
    3    HB2  MET  85           HB2      MET  85  -2.193   7.118  -5.351
    4    HB3  MET  85           HB3      MET  85  -1.904   6.316  -3.808
    5    HG2  MET  85           HG2      MET  85  -2.807   8.280  -2.614
    6    HG3  MET  85           HG3      MET  85  -3.093   9.083  -4.156
    7    HE3  MET  85           HE1      MET  85  -3.785   5.115  -3.264
    8    HE2  MET  85           HE2      MET  85  -5.220   5.496  -2.315
    9    HE1  MET  85           HE3      MET  85  -3.675   6.222  -1.891

  No H/Q in entry =           9
  In of MODEL   84
    1    H    LEU  86           H        LEU  86   0.250   6.282  -2.537
    2    HA   LEU  86           HA       LEU  86  -0.299   7.572  -0.091
    3    HB2  LEU  86           HB2      LEU  86   0.187   5.106  -0.493
    4    HB3  LEU  86           HB3      LEU  86   1.891   5.551  -0.583
    5    HG   LEU  86           HG       LEU  86   1.552   6.702   1.688
    6   HD11  LEU  86          HD11      LEU  86  -1.135   5.914   1.210
    7   HD13  LEU  86          HD12      LEU  86  -0.478   6.662   2.664
    8   HD12  LEU  86          HD13      LEU  86  -0.553   4.906   2.538
    9   HD23  LEU  86          HD21      LEU  86   1.148   3.705   1.799
   10   HD22  LEU  86          HD22      LEU  86   2.141   4.720   2.845
   11   HD21  LEU  86          HD23      LEU  86   2.647   4.405   1.185

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ALA  87           H        ALA  87   2.687   7.309  -1.977
    2    HA   ALA  87           HA       ALA  87   4.379   8.727  -0.244
    3    HB3  ALA  87           HB1      ALA  87   4.486   7.724  -2.955
    4    HB2  ALA  87           HB2      ALA  87   5.816   8.062  -1.850
    5    HB1  ALA  87           HB3      ALA  87   5.193   9.341  -2.891

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ARG  88           H        ARG  88   2.427   9.857  -2.964
    2    HA   ARG  88           HA       ARG  88   3.180  12.552  -2.836
    3    HB2  ARG  88           HB2      ARG  88   1.938  11.396  -4.699
    4    HB3  ARG  88           HB3      ARG  88   0.478  11.525  -3.718
    5    HG2  ARG  88           HG2      ARG  88   1.478  14.113  -3.624
    6    HG3  ARG  88           HG3      ARG  88   1.909  13.608  -5.256
    7    HD2  ARG  88           HD2      ARG  88  -0.232  13.674  -5.957
    8    HD3  ARG  88           HD3      ARG  88  -0.815  12.812  -4.532
    9    HE   ARG  88           HE       ARG  88  -1.024  15.590  -4.941
   10   HH21  ARG  88          HH11      ARG  88  -1.564  16.909  -3.199
   11   HH22  ARG  88          HH12      ARG  88  -1.266  16.368  -1.583
   12   HH11  ARG  88          HH21      ARG  88   0.004  13.326  -2.573
   13   HH12  ARG  88          HH22      ARG  88  -0.396  14.334  -1.229

  No H/Q in entry =          13
  In of MODEL   84
    1    H    GLU  89           H        GLU  89   0.487  10.852  -1.206
    2    HA   GLU  89           HA       GLU  89  -0.639  13.152   0.005
    3    HB2  GLU  89           HB2      GLU  89  -1.741  10.905  -0.091
    4    HB3  GLU  89           HB3      GLU  89  -0.615  10.353   1.149
    5    HG2  GLU  89           HG2      GLU  89  -1.449  12.041   2.714
    6    HG3  GLU  89           HG3      GLU  89  -2.504  12.709   1.471

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LEU  90           H        LEU  90   1.826  10.872   1.175
    2    HA   LEU  90           HA       LEU  90   2.170  12.109   3.709
    3    HB2  LEU  90           HB2      LEU  90   3.957  10.353   2.028
    4    HB3  LEU  90           HB3      LEU  90   4.371  10.866   3.669
    5    HG   LEU  90           HG       LEU  90   1.746   9.506   2.999
    6   HD12  LEU  90          HD11      LEU  90   2.898   7.464   4.002
    7   HD11  LEU  90          HD12      LEU  90   4.415   8.331   3.765
    8   HD13  LEU  90          HD13      LEU  90   3.407   7.922   2.375
    9   HD22  LEU  90          HD21      LEU  90   1.472  10.420   5.124
   10   HD21  LEU  90          HD22      LEU  90   3.190  10.322   5.508
   11   HD23  LEU  90          HD23      LEU  90   2.193   8.868   5.550

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  91           H        ILE  91   3.776  12.514   0.586
    2    HA   ILE  91           HA       ILE  91   5.740  14.354   1.435
    3    HB   ILE  91           HB       ILE  91   4.435  13.866  -1.248
    4   HG12  ILE  91          HG12      ILE  91   7.269  13.392  -0.272
    5   HG13  ILE  91          HG13      ILE  91   5.994  12.186  -0.116
    6   HG22  ILE  91          HG21      ILE  91   6.651  15.228  -1.929
    7   HG21  ILE  91          HG22      ILE  91   6.334  16.021  -0.385
    8   HG23  ILE  91          HG23      ILE  91   5.113  16.047  -1.656
    9   HD13  ILE  91          HD11      ILE  91   5.826  11.870  -2.425
   10   HD12  ILE  91          HD12      ILE  91   7.559  12.122  -2.208
   11   HD11  ILE  91          HD13      ILE  91   6.541  13.442  -2.790

  No H/Q in entry =          11
  In of MODEL   84
    1    H    THR  92           H        THR  92   2.377  14.770   0.424
    2    HA   THR  92           HA       THR  92   2.335  17.594   0.375
    3    HB   THR  92           HB       THR  92   0.178  15.584   1.063
    4    HG1  THR  92           HG1      THR  92   0.486  15.415  -1.022
    5   HG22  THR  92          HG21      THR  92  -1.235  17.741   0.348
    6   HG21  THR  92          HG22      THR  92   0.152  18.571   1.050
    7   HG23  THR  92          HG23      THR  92  -0.784  17.441   2.026

  No H/Q in entry =           7
  In of MODEL   84
    1    H    GLU  93           H        GLU  93   1.796  15.280   3.019
    2    HA   GLU  93           HA       GLU  93   1.250  17.173   5.044
    3    HB2  GLU  93           HB2      GLU  93   2.579  14.455   5.271
    4    HB3  GLU  93           HB3      GLU  93   1.881  15.373   6.607
    5    HG2  GLU  93           HG2      GLU  93   0.276  14.596   4.163
    6    HG3  GLU  93           HG3      GLU  93   0.381  13.568   5.587

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LEU  94           H        LEU  94   4.267  15.713   3.893
    2    HA   LEU  94           HA       LEU  94   6.008  16.863   5.787
    3    HB2  LEU  94           HB2      LEU  94   6.419  15.908   2.953
    4    HB3  LEU  94           HB3      LEU  94   7.744  16.570   3.907
    5    HG   LEU  94           HG       LEU  94   6.015  14.360   5.031
    6   HD11  LEU  94          HD11      LEU  94   8.114  14.154   2.902
    7   HD13  LEU  94          HD12      LEU  94   6.673  13.171   3.158
    8   HD12  LEU  94          HD13      LEU  94   8.099  12.922   4.166
    9   HD23  LEU  94          HD21      LEU  94   8.206  13.831   6.185
   10   HD22  LEU  94          HD22      LEU  94   7.530  15.404   6.606
   11   HD21  LEU  94          HD23      LEU  94   8.870  15.295   5.465

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  95           H        ILE  95   4.867  18.040   2.640
    2    HA   ILE  95           HA       ILE  95   6.426  20.406   2.592
    3    HB   ILE  95           HB       ILE  95   3.787  19.713   1.280
    4   HG12  ILE  95          HG12      ILE  95   6.576  20.070   0.149
    5   HG13  ILE  95          HG13      ILE  95   5.934  18.511   0.657
    6   HG21  ILE  95          HG21      ILE  95   5.524  22.191   1.072
    7   HG23  ILE  95          HG22      ILE  95   3.799  22.112   1.425
    8   HG22  ILE  95          HG23      ILE  95   4.386  21.721  -0.191
    9   HD13  ILE  95          HD11      ILE  95   4.377  18.433  -1.075
   10   HD12  ILE  95          HD12      ILE  95   5.723  19.262  -1.858
   11   HD11  ILE  95          HD13      ILE  95   4.344  20.187  -1.264

  No H/Q in entry =          11
  In of MODEL   84
    1    H    GLU  96           H        GLU  96   3.179  19.732   3.880
    2    HA   GLU  96           HA       GLU  96   2.543  22.372   4.641
    3    HB2  GLU  96           HB2      GLU  96   0.879  20.580   4.643
    4    HB3  GLU  96           HB3      GLU  96   1.743  19.752   5.937
    5    HG2  GLU  96           HG2      GLU  96   0.713  21.024   7.510
    6    HG3  GLU  96           HG3      GLU  96   1.242  22.504   6.719

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LEU  97           H        LEU  97   4.398  19.825   6.259
    2    HA   LEU  97           HA       LEU  97   4.745  21.166   8.735
    3    HB2  LEU  97           HB2      LEU  97   6.295  19.010   7.315
    4    HB3  LEU  97           HB3      LEU  97   6.879  19.693   8.830
    5    HG   LEU  97           HG       LEU  97   4.076  18.586   8.511
    6   HD12  LEU  97          HD11      LEU  97   5.024  16.574   9.718
    7   HD11  LEU  97          HD12      LEU  97   6.633  17.214   9.378
    8   HD13  LEU  97          HD13      LEU  97   5.567  16.756   8.049
    9   HD23  LEU  97          HD21      LEU  97   4.527  18.284  11.075
   10   HD22  LEU  97          HD22      LEU  97   4.139  19.896  10.476
   11   HD21  LEU  97          HD23      LEU  97   5.812  19.463  10.822

  No H/Q in entry =          11
  In of MODEL   84
    1    H    HIS  98           H        HIS  98   6.619  21.203   5.712
    2    HA   HIS  98           HA       HIS  98   8.764  22.790   6.620
    3    HB2  HIS  98           HB2      HIS  98   7.476  22.539   3.892
    4    HB3  HIS  98           HB3      HIS  98   8.910  23.523   4.188
    5    HD1  HIS  98           HD1      HIS  98   7.717  19.947   4.192
    6    HD2  HIS  98           HD2      HIS  98  11.287  22.059   4.630
    7    HE1  HIS  98           HE1      HIS  98   9.580  18.226   4.131
    8    HE2  HIS  98           HE2      HIS  98  11.758  19.492   4.398

  No H/Q in entry =           8
  In of MODEL   84
    1    H    GLU  99           H        GLU  99   5.540  23.614   5.444
    2    HA   GLU  99           HA       GLU  99   5.906  26.431   5.397
    3    HB2  GLU  99           HB2      GLU  99   4.034  25.257   4.259
    4    HB3  GLU  99           HB3      GLU  99   3.338  24.886   5.836
    5    HG2  GLU  99           HG2      GLU  99   3.146  27.275   6.346
    6    HG3  GLU  99           HG3      GLU  99   3.922  27.685   4.820

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LYS 100           H        LYS 100   4.782  24.180   7.909
    2    HA   LYS 100           HA       LYS 100   4.184  26.224   9.810
    3    HB2  LYS 100           HB2      LYS 100   4.772  23.274  10.145
    4    HB3  LYS 100           HB3      LYS 100   4.318  24.340  11.481
    5    HG2  LYS 100           HG2      LYS 100   2.251  24.973  10.232
    6    HG3  LYS 100           HG3      LYS 100   2.685  23.811   8.976
    7    HD2  LYS 100           HD2      LYS 100   2.613  21.983  10.630
    8    HD3  LYS 100           HD3      LYS 100   2.196  23.139  11.898
    9    HE2  LYS 100           HE2      LYS 100   0.142  23.756  10.634
   10    HE3  LYS 100           HE3      LYS 100   0.549  22.543   9.414
   11    HZ1  LYS 100           HZ1      LYS 100   0.283  21.864  12.292
   12    HZ3  LYS 100           HZ2      LYS 100   0.274  20.815  10.953
   13    HZ2  LYS 100           HZ3      LYS 100  -1.047  21.847  11.235

  No H/Q in entry =          13
  In of MODEL   84
    1    H    LEU 101           H        LEU 101   7.116  24.445   8.973
    2    HA   LEU 101           HA       LEU 101   8.708  25.283  11.182
    3    HB2  LEU 101           HB2      LEU 101   9.311  24.310   8.401
    4    HB3  LEU 101           HB3      LEU 101  10.609  24.977   9.387
    5    HG   LEU 101           HG       LEU 101   8.785  22.809  10.440
    6   HD12  LEU 101          HD11      LEU 101  10.846  21.325   9.829
    7   HD11  LEU 101          HD12      LEU 101  11.209  22.594   8.661
    8   HD13  LEU 101          HD13      LEU 101   9.684  21.715   8.562
    9   HD21  LEU 101          HD21      LEU 101  11.503  23.926  11.176
   10   HD23  LEU 101          HD22      LEU 101  10.965  22.349  11.749
   11   HD22  LEU 101          HD23      LEU 101  10.066  23.799  12.191

  No H/Q in entry =          11
  In of MODEL   84
    1    H    LYS 102           H        LYS 102   7.120  27.149   9.046
    2    HA   LYS 102           HA       LYS 102   7.189  29.443   8.764
    3    HB2  LYS 102           HB2      LYS 102   8.751  29.326  10.864
    4    HB3  LYS 102           HB3      LYS 102  10.051  29.530   9.707
    5    HG2  LYS 102           HG2      LYS 102   7.936  31.471  10.574
    6    HG3  LYS 102           HG3      LYS 102   9.648  31.739  10.326
    7    HD2  LYS 102           HD2      LYS 102   7.702  31.317   8.021
    8    HD3  LYS 102           HD3      LYS 102   8.077  32.896   8.696
    9    HE2  LYS 102           HE2      LYS 102   9.458  31.725   6.620
   10    HE3  LYS 102           HE3      LYS 102  10.068  33.030   7.637
   11    HZ2  LYS 102           HZ1      LYS 102  11.596  31.132   7.457
   12    HZ1  LYS 102           HZ2      LYS 102  10.437  30.142   8.194
   13    HZ3  LYS 102           HZ3      LYS 102  11.123  31.428   9.059

  No H/Q in entry =          13
  In of MODEL   84
    1    H    ALA 103           H        ALA 103  10.451  28.119   8.199
    2    HA   ALA 103           HA       ALA 103  11.413  29.508   6.130
    3    HB2  ALA 103           HB1      ALA 103  12.308  27.301   5.194
    4    HB1  ALA 103           HB2      ALA 103  11.414  26.518   6.496
    5    HB3  ALA 103           HB3      ALA 103  12.699  27.666   6.875

  No H/Q in entry =           5
  In of MODEL   84
    1    H1   LYS   3           H1       LYS   3 -31.446   5.734 -19.800
    2    H2   LYS   3           H3       LYS   3 -30.481   5.394 -21.154
    3    H3   LYS   3           H2       LYS   3 -31.875   4.473 -20.852
    4    HA   LYS   3           HA       LYS   3 -30.855   3.130 -19.416
    5    HB2  LYS   3           HB2      LYS   3 -28.590   4.484 -20.833
    6    HB3  LYS   3           HB3      LYS   3 -28.250   3.320 -19.554
    7    HG2  LYS   3           HG2      LYS   3 -29.699   1.693 -20.825
    8    HG3  LYS   3           HG3      LYS   3 -29.670   2.847 -22.157
    9    HD2  LYS   3           HD2      LYS   3 -27.187   2.724 -22.142
   10    HD3  LYS   3           HD3      LYS   3 -27.292   1.469 -20.908
   11    HE2  LYS   3           HE2      LYS   3 -28.823   0.240 -22.558
   12    HE3  LYS   3           HE3      LYS   3 -28.216   1.374 -23.764
   13    HZ3  LYS   3           HZ1      LYS   3 -26.427   0.129 -24.019
   14    HZ2  LYS   3           HZ2      LYS   3 -27.045  -0.999 -22.909
   15    HZ1  LYS   3           HZ3      LYS   3 -26.041   0.261 -22.370

  No H/Q in entry =          15
  In of MODEL   84
    1    H    LYS   4           H        LYS   4 -30.876   3.061 -17.351
    2    HA   LYS   4           HA       LYS   4 -30.110   5.400 -15.794
    3    HB2  LYS   4           HB2      LYS   4 -31.312   2.741 -14.980
    4    HB3  LYS   4           HB3      LYS   4 -31.066   4.116 -13.906
    5    HG2  LYS   4           HG2      LYS   4 -32.913   3.979 -16.295
    6    HG3  LYS   4           HG3      LYS   4 -33.376   4.091 -14.598
    7    HD2  LYS   4           HD2      LYS   4 -32.666   6.318 -14.421
    8    HD3  LYS   4           HD3      LYS   4 -31.649   6.204 -15.858
    9    HE2  LYS   4           HE2      LYS   4 -33.575   7.571 -16.338
   10    HE3  LYS   4           HE3      LYS   4 -33.678   6.066 -17.252
   11    HZ3  LYS   4           HZ1      LYS   4 -35.234   5.218 -15.649
   12    HZ2  LYS   4           HZ2      LYS   4 -35.790   6.694 -16.277
   13    HZ1  LYS   4           HZ3      LYS   4 -35.109   6.635 -14.722

  No H/Q in entry =          13
  In of MODEL   84
    1    H    HIS   5           H        HIS   5 -28.616   5.533 -14.230
    2    HA   HIS   5           HA       HIS   5 -26.348   3.679 -14.532
    3    HB2  HIS   5           HB2      HIS   5 -26.568   6.476 -13.420
    4    HB3  HIS   5           HB3      HIS   5 -25.092   5.513 -13.392
    5    HD1  HIS   5           HD1      HIS   5 -23.641   6.646 -15.047
    6    HD2  HIS   5           HD2      HIS   5 -27.469   5.997 -16.518
    7    HE1  HIS   5           HE1      HIS   5 -23.508   7.139 -17.518
    8    HE2  HIS   5           HE2      HIS   5 -25.843   6.732 -18.383

  No H/Q in entry =           8
  In of MODEL   84
    1    H    ILE   6           H        ILE   6 -26.108   2.152 -13.164
    2    HA   ILE   6           HA       ILE   6 -27.038   2.524 -10.397
    3    HB   ILE   6           HB       ILE   6 -26.254  -0.001 -11.858
    4   HG12  ILE   6          HG12      ILE   6 -28.977   0.984 -10.998
    5   HG13  ILE   6          HG13      ILE   6 -28.360   1.084 -12.647
    6   HG23  ILE   6          HG21      ILE   6 -26.606  -1.185  -9.949
    7   HG22  ILE   6          HG22      ILE   6 -27.745  -0.007  -9.293
    8   HG21  ILE   6          HG23      ILE   6 -26.012   0.320  -9.243
    9   HD13  ILE   6          HD11      ILE   6 -28.842  -1.048 -13.065
   10   HD12  ILE   6          HD12      ILE   6 -29.833  -0.973 -11.609
   11   HD11  ILE   6          HD13      ILE   6 -28.183  -1.589 -11.520

  No H/Q in entry =          11
  In of MODEL   84
    1    H    TYR   7           H        TYR   7 -25.255   3.197  -9.161
    2    HA   TYR   7           HA       TYR   7 -22.561   2.196  -9.849
    3    HB2  TYR   7           HB2      TYR   7 -23.484   4.688  -8.439
    4    HB3  TYR   7           HB3      TYR   7 -21.804   4.159  -8.486
    5    HD1  TYR   7           HD1      TYR   7 -22.899   3.117 -11.525
    6    HD2  TYR   7           HD2      TYR   7 -22.169   6.760  -9.437
    7    HE1  TYR   7           HE1      TYR   7 -22.493   4.268 -13.664
    8    HE2  TYR   7           HE2      TYR   7 -21.803   7.918 -11.568
    9    HH   TYR   7           HH       TYR   7 -22.058   7.754 -13.793

  No H/Q in entry =           9
  In of MODEL   84
    1    H    LEU   8           H        LEU   8 -21.584   0.884  -8.488
    2    HA   LEU   8           HA       LEU   8 -22.675   0.494  -5.771
    3    HB2  LEU   8           HB2      LEU   8 -21.014  -1.247  -7.572
    4    HB3  LEU   8           HB3      LEU   8 -21.175  -1.567  -5.845
    5    HG   LEU   8           HG       LEU   8 -23.663  -1.734  -6.222
    6   HD13  LEU   8          HD11      LEU   8 -23.819  -0.592  -8.371
    7   HD12  LEU   8          HD12      LEU   8 -24.364  -2.260  -8.544
    8   HD11  LEU   8          HD13      LEU   8 -22.761  -1.793  -9.112
    9   HD23  LEU   8          HD21      LEU   8 -22.430  -3.843  -7.862
   10   HD22  LEU   8          HD22      LEU   8 -23.497  -3.954  -6.462
   11   HD21  LEU   8          HD23      LEU   8 -21.783  -3.606  -6.240

  No H/Q in entry =          11
  In of MODEL   84
    1    H    PHE   9           H        PHE   9 -21.373   0.945  -4.022
    2    HA   PHE   9           HA       PHE   9 -18.586   1.828  -4.607
    3    HB2  PHE   9           HB2      PHE   9 -20.517   2.988  -2.600
    4    HB3  PHE   9           HB3      PHE   9 -18.822   3.430  -2.740
    5    HD1  PHE   9           HD1      PHE   9 -18.006   4.742  -4.601
    6    HD2  PHE   9           HD2      PHE   9 -22.136   3.602  -4.365
    7    HE1  PHE   9           HE1      PHE   9 -18.551   6.334  -6.418
    8    HE2  PHE   9           HE2      PHE   9 -22.682   5.207  -6.178
    9    HZ   PHE   9           HZ       PHE   9 -20.887   6.568  -7.211

  No H/Q in entry =           9
  In of MODEL   84
    1    H    SER  10           H        SER  10 -16.988   0.903  -3.476
    2    HA   SER  10           HA       SER  10 -17.172   0.119  -0.751
    3    HB2  SER  10           HB2      SER  10 -18.448  -1.764  -1.750
    4    HB3  SER  10           HB3      SER  10 -17.067  -2.118  -2.776
    5    HG   SER  10           HG       SER  10 -16.122  -1.930  -0.361

  No H/Q in entry =           5
  In of MODEL   84
    1    H    SER  11           H        SER  11 -15.146   0.162   0.061
    2    HA   SER  11           HA       SER  11 -12.963   0.935  -1.528
    3    HB2  SER  11           HB2      SER  11 -13.438   1.083   1.070
    4    HB3  SER  11           HB3      SER  11 -12.465  -0.389   1.086
    5    HG   SER  11           HG       SER  11 -11.552   1.725  -0.476

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ALA  12           H        ALA  12 -14.221  -1.735  -2.256
    2    HA   ALA  12           HA       ALA  12 -11.679  -3.053  -2.778
    3    HB1  ALA  12           HB1      ALA  12 -13.881  -4.374  -1.191
    4    HB3  ALA  12           HB2      ALA  12 -12.188  -4.179  -0.743
    5    HB2  ALA  12           HB3      ALA  12 -12.631  -5.288  -2.039

  No H/Q in entry =           5
  In of MODEL   84
    1    H    GLY  13           H        GLY  13 -12.486  -2.095  -4.835
    2    HA3  GLY  13           HA2      GLY  13 -14.769  -2.904  -6.221
    3    HA2  GLY  13           HA3      GLY  13 -13.262  -2.385  -6.989

  No H/Q in entry =           3
  In of MODEL   84
    1    H    MET  14           H        MET  14 -11.630  -4.564  -6.030
    2    HA   MET  14           HA       MET  14 -11.911  -6.386  -8.093
    3    HB2  MET  14           HB2      MET  14  -9.897  -6.249  -6.604
    4    HB3  MET  14           HB3      MET  14 -10.776  -7.175  -5.390
    5    HG2  MET  14           HG2      MET  14  -9.597  -8.847  -6.532
    6    HG3  MET  14           HG3      MET  14 -11.146  -8.873  -7.375
    7    HE1  MET  14           HE1      MET  14  -7.707  -9.243  -7.786
    8    HE3  MET  14           HE2      MET  14  -7.459  -7.546  -7.385
    9    HE2  MET  14           HE3      MET  14  -7.065  -8.127  -9.001

  No H/Q in entry =           9
  In of MODEL   84
    1    H    SER  15           H        SER  15 -13.309  -6.715  -4.847
    2    HA   SER  15           HA       SER  15 -14.536  -9.264  -5.581
    3    HB2  SER  15           HB2      SER  15 -14.590  -7.648  -3.042
    4    HB3  SER  15           HB3      SER  15 -15.763  -8.933  -3.319
    5    HG   SER  15           HG       SER  15 -12.989  -9.348  -3.721

  No H/Q in entry =           5
  In of MODEL   84
    1    H    THR  16           H        THR  16 -15.624  -5.904  -5.036
    2    HA   THR  16           HA       THR  16 -18.434  -6.388  -5.425
    3    HB   THR  16           HB       THR  16 -16.882  -3.859  -6.079
    4    HG1  THR  16           HG1      THR  16 -18.061  -3.842  -3.676
    5   HG23  THR  16          HG21      THR  16 -19.232  -3.910  -6.815
    6   HG22  THR  16          HG22      THR  16 -19.020  -2.772  -5.472
    7   HG21  THR  16          HG23      THR  16 -19.731  -4.368  -5.191

  No H/Q in entry =           7
  In of MODEL   84
    1    H    SER  17           H        SER  17 -15.705  -5.874  -7.386
    2    HA   SER  17           HA       SER  17 -16.864  -5.216  -9.895
    3    HB2  SER  17           HB2      SER  17 -14.234  -6.529  -9.185
    4    HB3  SER  17           HB3      SER  17 -14.698  -6.147 -10.843
    5    HG   SER  17           HG       SER  17 -13.787  -4.314 -10.357

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LEU  18           H        LEU  18 -16.295  -8.310  -8.344
    2    HA   LEU  18           HA       LEU  18 -16.925  -9.889 -10.636
    3    HB2  LEU  18           HB2      LEU  18 -15.683 -10.772  -8.697
    4    HB3  LEU  18           HB3      LEU  18 -17.119 -10.564  -7.695
    5    HG   LEU  18           HG       LEU  18 -18.331 -12.181  -9.084
    6   HD12  LEU  18          HD11      LEU  18 -16.707 -13.556 -10.630
    7   HD11  LEU  18          HD12      LEU  18 -15.788 -12.052 -10.658
    8   HD13  LEU  18          HD13      LEU  18 -17.455 -12.077 -11.229
    9   HD21  LEU  18          HD21      LEU  18 -17.070 -12.891  -7.107
   10   HD23  LEU  18          HD22      LEU  18 -15.687 -13.248  -8.143
   11   HD22  LEU  18          HD23      LEU  18 -17.189 -14.150  -8.338

  No H/Q in entry =          11
  In of MODEL   84
    1    H    LEU  19           H        LEU  19 -18.846  -8.572  -7.941
    2    HA   LEU  19           HA       LEU  19 -21.329  -9.767  -8.695
    3    HB2  LEU  19           HB2      LEU  19 -21.027  -8.859  -6.479
    4    HB3  LEU  19           HB3      LEU  19 -20.731  -7.253  -7.144
    5    HG   LEU  19           HG       LEU  19 -23.062  -7.071  -7.809
    6   HD13  LEU  19          HD11      LEU  19 -23.745  -9.263  -8.329
    7   HD12  LEU  19          HD12      LEU  19 -24.630  -8.868  -6.855
    8   HD11  LEU  19          HD13      LEU  19 -23.196  -9.891  -6.775
    9   HD23  LEU  19          HD21      LEU  19 -24.046  -7.057  -5.530
   10   HD22  LEU  19          HD22      LEU  19 -22.470  -6.271  -5.635
   11   HD21  LEU  19          HD23      LEU  19 -22.604  -7.891  -4.949

  No H/Q in entry =          11
  In of MODEL   84
    1    H    VAL  20           H        VAL  20 -19.824  -6.644  -9.524
    2    HA   VAL  20           HA       VAL  20 -21.952  -5.645 -11.098
    3    HB   VAL  20           HB       VAL  20 -18.969  -5.084 -11.418
    4   HG12  VAL  20          HG11      VAL  20 -20.500  -2.853 -12.200
    5   HG11  VAL  20          HG12      VAL  20 -21.251  -4.245 -12.981
    6   HG13  VAL  20          HG13      VAL  20 -19.541  -3.903 -13.242
    7   HG21  VAL  20          HG21      VAL  20 -21.095  -3.939  -9.677
    8   HG23  VAL  20          HG22      VAL  20 -19.800  -2.897 -10.261
    9   HG22  VAL  20          HG23      VAL  20 -19.416  -4.326  -9.302

  No H/Q in entry =           9
  In of MODEL   84
    1    H    SER  21           H        SER  21 -19.223  -7.749 -12.092
    2    HA   SER  21           HA       SER  21 -20.048  -7.729 -14.833
    3    HB2  SER  21           HB2      SER  21 -18.628  -9.716 -15.117
    4    HB3  SER  21           HB3      SER  21 -17.778  -8.444 -14.242
    5    HG   SER  21           HG       SER  21 -18.027 -10.882 -13.504

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LYS  22           H        LYS  22 -21.088  -9.816 -12.169
    2    HA   LYS  22           HA       LYS  22 -22.665 -11.488 -13.910
    3    HB2  LYS  22           HB2      LYS  22 -22.929 -11.027 -10.935
    4    HB3  LYS  22           HB3      LYS  22 -23.729 -12.299 -11.858
    5    HG2  LYS  22           HG2      LYS  22 -20.740 -12.041 -11.570
    6    HG3  LYS  22           HG3      LYS  22 -21.754 -13.066 -10.554
    7    HD2  LYS  22           HD2      LYS  22 -22.473 -14.312 -12.552
    8    HD3  LYS  22           HD3      LYS  22 -21.419 -13.304 -13.546
    9    HE2  LYS  22           HE2      LYS  22 -19.458 -14.137 -12.340
   10    HE3  LYS  22           HE3      LYS  22 -20.497 -15.114 -11.301
   11    HZ1  LYS  22           HZ1      LYS  22 -20.946 -15.654 -14.059
   12    HZ3  LYS  22           HZ2      LYS  22 -20.550 -16.719 -12.797
   13    HZ2  LYS  22           HZ3      LYS  22 -19.320 -15.901 -13.634

  No H/Q in entry =          13
  In of MODEL   84
    1    H    MET  23           H        MET  23 -23.339  -8.497 -12.137
    2    HA   MET  23           HA       MET  23 -26.155  -8.570 -12.599
    3    HB2  MET  23           HB2      MET  23 -24.283  -6.259 -12.135
    4    HB3  MET  23           HB3      MET  23 -26.029  -6.082 -12.294
    5    HG2  MET  23           HG2      MET  23 -26.401  -7.311 -10.274
    6    HG3  MET  23           HG3      MET  23 -24.692  -7.732 -10.159
    7    HE2  MET  23           HE1      MET  23 -26.945  -4.022  -9.067
    8    HE1  MET  23           HE2      MET  23 -27.228  -5.040 -10.478
    9    HE3  MET  23           HE3      MET  23 -26.183  -3.623 -10.607

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ARG  24           H        ARG  24 -23.416  -7.229 -14.472
    2    HA   ARG  24           HA       ARG  24 -24.933  -5.988 -16.494
    3    HB2  ARG  24           HB2      ARG  24 -22.483  -5.594 -16.163
    4    HB3  ARG  24           HB3      ARG  24 -22.167  -7.215 -16.731
    5    HG2  ARG  24           HG2      ARG  24 -21.740  -5.959 -18.676
    6    HG3  ARG  24           HG3      ARG  24 -23.452  -6.405 -18.908
    7    HD2  ARG  24           HD2      ARG  24 -23.253  -4.007 -19.277
    8    HD3  ARG  24           HD3      ARG  24 -24.076  -4.275 -17.745
    9    HE   ARG  24           HE       ARG  24 -22.508  -3.200 -16.619
   10   HH21  ARG  24          HH11      ARG  24 -21.260  -1.356 -16.930
   11   HH22  ARG  24          HH12      ARG  24 -19.966  -1.379 -18.078
   12   HH11  ARG  24          HH21      ARG  24 -21.016  -4.507 -19.361
   13   HH12  ARG  24          HH22      ARG  24 -19.824  -3.253 -19.504

  No H/Q in entry =          13
  In of MODEL   84
    1    H    ALA  25           H        ALA  25 -23.836  -9.324 -16.117
    2    HA   ALA  25           HA       ALA  25 -24.509 -10.241 -18.714
    3    HB1  ALA  25           HB1      ALA  25 -23.821 -12.253 -17.957
    4    HB3  ALA  25           HB2      ALA  25 -24.857 -12.174 -16.533
    5    HB2  ALA  25           HB3      ALA  25 -23.294 -11.360 -16.531

  No H/Q in entry =           5
  In of MODEL   84
    1    H    GLN  26           H        GLN  26 -26.292 -10.157 -15.665
    2    HA   GLN  26           HA       GLN  26 -28.661 -11.372 -16.605
    3    HB2  GLN  26           HB2      GLN  26 -28.098  -9.548 -14.288
    4    HB3  GLN  26           HB3      GLN  26 -29.673 -10.268 -14.591
    5    HG2  GLN  26           HG2      GLN  26 -27.093 -11.732 -14.108
    6    HG3  GLN  26           HG3      GLN  26 -28.437 -11.578 -12.984
    7   HE21  GLN  26          HE21      GLN  26 -27.258 -13.797 -14.201
    8   HE22  GLN  26          HE22      GLN  26 -28.321 -14.862 -14.946

  No H/Q in entry =           8
  In of MODEL   84
    1    H    ALA  27           H        ALA  27 -27.690  -7.972 -16.345
    2    HA   ALA  27           HA       ALA  27 -30.180  -6.883 -17.131
    3    HB1  ALA  27           HB1      ALA  27 -28.342  -5.548 -16.088
    4    HB3  ALA  27           HB2      ALA  27 -28.947  -4.828 -17.581
    5    HB2  ALA  27           HB3      ALA  27 -27.420  -5.709 -17.584

  No H/Q in entry =           5
  In of MODEL   84
    1    H    GLU  28           H        GLU  28 -27.519  -8.196 -18.996
    2    HA   GLU  28           HA       GLU  28 -28.480  -7.234 -21.535
    3    HB2  GLU  28           HB2      GLU  28 -26.099  -7.918 -20.922
    4    HB3  GLU  28           HB3      GLU  28 -26.662  -9.582 -21.059
    5    HG2  GLU  28           HG2      GLU  28 -25.537  -8.885 -23.069
    6    HG3  GLU  28           HG3      GLU  28 -27.243  -9.204 -23.382

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LYS  29           H        LYS  29 -28.652 -10.279 -19.771
    2    HA   LYS  29           HA       LYS  29 -29.997 -11.805 -21.707
    3    HB2  LYS  29           HB2      LYS  29 -28.928 -12.729 -19.685
    4    HB3  LYS  29           HB3      LYS  29 -30.178 -11.976 -18.697
    5    HG2  LYS  29           HG2      LYS  29 -31.867 -13.368 -19.693
    6    HG3  LYS  29           HG3      LYS  29 -30.691 -14.052 -20.812
    7    HD2  LYS  29           HD2      LYS  29 -29.534 -15.171 -19.057
    8    HD3  LYS  29           HD3      LYS  29 -30.415 -14.279 -17.818
    9    HE2  LYS  29           HE2      LYS  29 -31.194 -16.631 -18.089
   10    HE3  LYS  29           HE3      LYS  29 -32.464 -15.435 -18.355
   11    HZ1  LYS  29           HZ1      LYS  29 -31.936 -15.657 -20.785
   12    HZ3  LYS  29           HZ2      LYS  29 -32.659 -17.013 -20.062
   13    HZ2  LYS  29           HZ3      LYS  29 -30.993 -17.011 -20.385

  No H/Q in entry =          13
  In of MODEL   84
    1    H    TYR  30           H        TYR  30 -31.333  -9.602 -19.256
    2    HA   TYR  30           HA       TYR  30 -34.018 -10.067 -20.444
    3    HB2  TYR  30           HB2      TYR  30 -33.315  -8.828 -17.772
    4    HB3  TYR  30           HB3      TYR  30 -34.943  -9.092 -18.394
    5    HD1  TYR  30           HD1      TYR  30 -35.878 -11.381 -18.517
    6    HD2  TYR  30           HD2      TYR  30 -32.012 -10.639 -16.893
    7    HE1  TYR  30           HE1      TYR  30 -35.799 -13.681 -17.643
    8    HE2  TYR  30           HE2      TYR  30 -31.934 -12.926 -16.023
    9    HH   TYR  30           HH       TYR  30 -33.610 -15.305 -17.013

  No H/Q in entry =           9
  In of MODEL   84
    1    H    GLU  31           H        GLU  31 -31.845  -8.124 -21.341
    2    HA   GLU  31           HA       GLU  31 -31.763  -5.996 -22.237
    3    HB2  GLU  31           HB2      GLU  31 -34.672  -6.702 -22.684
    4    HB3  GLU  31           HB3      GLU  31 -33.829  -5.368 -23.471
    5    HG2  GLU  31           HG2      GLU  31 -32.388  -6.858 -24.635
    6    HG3  GLU  31           HG3      GLU  31 -32.952  -8.236 -23.690

  No H/Q in entry =           6
  In of MODEL   84
    1    H    VAL  32           H        VAL  32 -31.922  -5.801 -19.507
    2    HA   VAL  32           HA       VAL  32 -33.757  -3.651 -18.893
    3    HB   VAL  32           HB       VAL  32 -31.350  -4.612 -17.314
    4   HG12  VAL  32          HG11      VAL  32 -32.851  -3.711 -15.426
    5   HG11  VAL  32          HG12      VAL  32 -33.695  -2.843 -16.708
    6   HG13  VAL  32          HG13      VAL  32 -31.981  -2.544 -16.423
    7   HG21  VAL  32          HG21      VAL  32 -33.142  -6.339 -17.919
    8   HG23  VAL  32          HG22      VAL  32 -34.158  -5.464 -16.773
    9   HG22  VAL  32          HG23      VAL  32 -32.641  -6.183 -16.235

  No H/Q in entry =           9
  In of MODEL   84
    1    HA   PRO  33           HA       PRO  33 -30.726  -0.807 -20.707
    2    HB2  PRO  33           HB2      PRO  33 -32.217   1.432 -20.637
    3    HB3  PRO  33           HB3      PRO  33 -32.712   0.098 -21.679
    4    HG2  PRO  33           HG2      PRO  33 -33.635   0.716 -18.873
    5    HG3  PRO  33           HG3      PRO  33 -34.622   0.467 -20.313
    6    HD2  PRO  33           HD2      PRO  33 -34.159  -1.553 -18.586
    7    HD3  PRO  33           HD3      PRO  33 -34.247  -1.852 -20.321

  No H/Q in entry =           7
  In of MODEL   84
    1    H    VAL  34           H        VAL  34 -29.438  -1.296 -18.760
    2    HA   VAL  34           HA       VAL  34 -29.112   1.181 -17.198
    3    HB   VAL  34           HB       VAL  34 -28.513  -0.220 -15.221
    4   HG12  VAL  34          HG11      VAL  34 -30.928  -1.063 -14.851
    5   HG11  VAL  34          HG12      VAL  34 -31.260  -0.352 -16.429
    6   HG13  VAL  34          HG13      VAL  34 -30.681   0.664 -15.109
    7   HG21  VAL  34          HG21      VAL  34 -28.743  -2.311 -17.157
    8   HG23  VAL  34          HG22      VAL  34 -29.783  -2.618 -15.765
    9   HG22  VAL  34          HG23      VAL  34 -28.059  -2.335 -15.532

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ILE  35           H        ILE  35 -27.121   1.628 -16.402
    2    HA   ILE  35           HA       ILE  35 -24.843   0.240 -17.653
    3    HB   ILE  35           HB       ILE  35 -25.211   3.158 -16.933
    4   HG12  ILE  35          HG12      ILE  35 -24.275   1.760 -19.446
    5   HG13  ILE  35          HG13      ILE  35 -25.897   2.401 -19.184
    6   HG21  ILE  35          HG21      ILE  35 -22.665   1.597 -17.227
    7   HG23  ILE  35          HG22      ILE  35 -23.093   2.819 -16.031
    8   HG22  ILE  35          HG23      ILE  35 -22.731   3.296 -17.691
    9   HD11  ILE  35          HD11      ILE  35 -24.472   4.604 -18.677
   10   HD13  ILE  35          HD12      ILE  35 -25.036   4.170 -20.291
   11   HD12  ILE  35          HD13      ILE  35 -23.380   3.806 -19.807

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ILE  36           H        ILE  36 -23.597  -0.739 -16.037
    2    HA   ILE  36           HA       ILE  36 -23.992  -0.025 -13.183
    3    HB   ILE  36           HB       ILE  36 -23.200  -2.770 -14.212
    4   HG12  ILE  36          HG12      ILE  36 -25.989  -1.918 -13.436
    5   HG13  ILE  36          HG13      ILE  36 -25.442  -1.957 -15.112
    6   HG23  ILE  36          HG21      ILE  36 -23.525  -3.525 -12.067
    7   HG22  ILE  36          HG22      ILE  36 -24.637  -2.220 -11.655
    8   HG21  ILE  36          HG23      ILE  36 -22.905  -1.903 -11.762
    9   HD13  ILE  36          HD11      ILE  36 -25.626  -4.176 -15.241
   10   HD12  ILE  36          HD12      ILE  36 -26.670  -4.000 -13.832
   11   HD11  ILE  36          HD13      ILE  36 -24.971  -4.424 -13.623

  No H/Q in entry =          11
  In of MODEL   84
    1    H    GLU  37           H        GLU  37 -22.190   0.627 -12.126
    2    HA   GLU  37           HA       GLU  37 -19.520  -0.219 -13.054
    3    HB2  GLU  37           HB2      GLU  37 -20.355   2.602 -12.395
    4    HB3  GLU  37           HB3      GLU  37 -18.688   2.072 -12.618
    5    HG2  GLU  37           HG2      GLU  37 -20.825   2.054 -14.730
    6    HG3  GLU  37           HG3      GLU  37 -19.565   3.275 -14.550

  No H/Q in entry =           6
  In of MODEL   84
    1    H    ALA  38           H        ALA  38 -18.009  -0.412 -11.386
    2    HA   ALA  38           HA       ALA  38 -18.998  -0.134  -8.608
    3    HB1  ALA  38           HB1      ALA  38 -17.318  -2.130  -9.993
    4    HB3  ALA  38           HB2      ALA  38 -18.349  -2.312  -8.573
    5    HB2  ALA  38           HB3      ALA  38 -16.728  -1.633  -8.406

  No H/Q in entry =           5
  In of MODEL   84
    1    H    PHE  39           H        PHE  39 -17.729   1.116  -7.194
    2    HA   PHE  39           HA       PHE  39 -15.210   2.272  -8.167
    3    HB2  PHE  39           HB2      PHE  39 -17.404   3.913  -6.896
    4    HB3  PHE  39           HB3      PHE  39 -15.833   4.494  -7.446
    5    HD1  PHE  39           HD1      PHE  39 -15.348   4.706  -9.822
    6    HD2  PHE  39           HD2      PHE  39 -19.199   3.537  -8.414
    7    HE1  PHE  39           HE1      PHE  39 -16.308   5.231 -12.046
    8    HE2  PHE  39           HE2      PHE  39 -20.169   4.050 -10.625
    9    HZ   PHE  39           HZ       PHE  39 -18.726   4.868 -12.456

  No H/Q in entry =           9
  In of MODEL   84
    1    HA   PRO  40           HA       PRO  40 -14.213   1.655  -3.872
    2    HB2  PRO  40           HB2      PRO  40 -12.426   3.676  -3.357
    3    HB3  PRO  40           HB3      PRO  40 -12.006   2.312  -4.393
    4    HG2  PRO  40           HG2      PRO  40 -13.035   5.028  -5.203
    5    HG3  PRO  40           HG3      PRO  40 -11.616   4.170  -5.800
    6    HD2  PRO  40           HD2      PRO  40 -13.859   4.031  -7.184
    7    HD3  PRO  40           HD3      PRO  40 -12.905   2.566  -6.951

  No H/Q in entry =           7
  In of MODEL   84
    1    H    GLU  41           H        GLU  41 -14.798   2.708  -1.766
    2    HA   GLU  41           HA       GLU  41 -17.034   4.421  -1.775
    3    HB2  GLU  41           HB2      GLU  41 -16.531   4.635   0.692
    4    HB3  GLU  41           HB3      GLU  41 -16.740   2.990   0.094
    5    HG2  GLU  41           HG2      GLU  41 -14.932   2.804   1.531
    6    HG3  GLU  41           HG3      GLU  41 -14.174   2.937  -0.056

  No H/Q in entry =           6
  In of MODEL   84
    1    H    THR  42           H        THR  42 -13.700   5.320  -1.905
    2    HA   THR  42           HA       THR  42 -14.025   7.922  -0.774
    3    HB   THR  42           HB       THR  42 -11.880   8.449  -1.894
    4    HG1  THR  42           HG1      THR  42 -12.151   7.320  -3.808
    5   HG21  THR  42          HG21      THR  42 -12.042   7.048   0.239
    6   HG23  THR  42          HG22      THR  42 -10.536   6.913  -0.672
    7   HG22  THR  42          HG23      THR  42 -11.753   5.643  -0.787

  No H/Q in entry =           7
  In of MODEL   84
    1    H    LEU  43           H        LEU  43 -14.979   6.728  -3.823
    2    HA   LEU  43           HA       LEU  43 -15.236   9.468  -4.882
    3    HB2  LEU  43           HB2      LEU  43 -15.642   6.781  -6.184
    4    HB3  LEU  43           HB3      LEU  43 -15.835   8.339  -6.986
    5    HG   LEU  43           HG       LEU  43 -13.235   7.212  -5.975
    6   HD11  LEU  43          HD11      LEU  43 -14.469   6.209  -8.063
    7   HD13  LEU  43          HD12      LEU  43 -12.744   6.566  -8.131
    8   HD12  LEU  43          HD13      LEU  43 -13.903   7.686  -8.844
    9   HD22  LEU  43          HD21      LEU  43 -13.035   9.547  -5.898
   10   HD21  LEU  43          HD22      LEU  43 -14.023   9.773  -7.342
   11   HD23  LEU  43          HD23      LEU  43 -12.390   9.124  -7.484

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ALA  44           H        ALA  44 -17.161   7.715  -2.940
    2    HA   ALA  44           HA       ALA  44 -19.659   7.541  -4.221
    3    HB2  ALA  44           HB1      ALA  44 -19.494   6.495  -2.089
    4    HB3  ALA  44           HB2      ALA  44 -20.592   7.853  -1.847
    5    HB1  ALA  44           HB3      ALA  44 -18.912   7.973  -1.323

  No H/Q in entry =           5
  In of MODEL   84
    1    H    GLY  45           H        GLY  45 -18.205  10.385  -2.804
    2    HA3  GLY  45           HA2      GLY  45 -20.642  11.883  -3.179
    3    HA2  GLY  45           HA3      GLY  45 -19.087  12.520  -2.646

  No H/Q in entry =           3
  In of MODEL   84
    1    H    GLU  46           H        GLU  46 -17.592  11.500  -4.926
    2    HA   GLU  46           HA       GLU  46 -18.247  13.658  -6.759
    3    HB2  GLU  46           HB2      GLU  46 -16.063  11.567  -6.753
    4    HB3  GLU  46           HB3      GLU  46 -16.203  12.857  -7.949
    5    HG2  GLU  46           HG2      GLU  46 -15.810  13.266  -4.991
    6    HG3  GLU  46           HG3      GLU  46 -14.534  13.332  -6.206

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LYS  47           H        LYS  47 -18.148  10.125  -7.077
    2    HA   LYS  47           HA       LYS  47 -19.285  10.260  -9.742
    3    HB2  LYS  47           HB2      LYS  47 -17.652   8.470  -8.648
    4    HB3  LYS  47           HB3      LYS  47 -19.181   7.726  -8.179
    5    HG2  LYS  47           HG2      LYS  47 -18.680   6.684 -10.174
    6    HG3  LYS  47           HG3      LYS  47 -19.794   7.959 -10.665
    7    HD2  LYS  47           HD2      LYS  47 -17.918   7.909 -12.180
    8    HD3  LYS  47           HD3      LYS  47 -17.859   9.388 -11.223
    9    HE2  LYS  47           HE2      LYS  47 -15.966   8.777 -10.153
   10    HE3  LYS  47           HE3      LYS  47 -16.414   7.072 -10.111
   11    HZ1  LYS  47           HZ1      LYS  47 -15.990   7.124 -12.593
   12    HZ3  LYS  47           HZ2      LYS  47 -14.636   7.181 -11.571
   13    HZ2  LYS  47           HZ3      LYS  47 -15.196   8.600 -12.319

  No H/Q in entry =          13
  In of MODEL   84
    1    H    GLY  48           H        GLY  48 -20.564   9.615  -6.551
    2    HA3  GLY  48           HA2      GLY  48 -22.964   8.416  -7.217
    3    HA2  GLY  48           HA3      GLY  48 -22.714   9.457  -5.815

  No H/Q in entry =           3
  In of MODEL   84
    1    H    GLN  49           H        GLN  49 -22.144  11.823  -7.476
    2    HA   GLN  49           HA       GLN  49 -24.701  12.940  -7.620
    3    HB2  GLN  49           HB2      GLN  49 -22.175  13.747  -9.045
    4    HB3  GLN  49           HB3      GLN  49 -23.632  14.721  -8.973
    5    HG2  GLN  49           HG2      GLN  49 -23.436  14.826  -6.540
    6    HG3  GLN  49           HG3      GLN  49 -21.992  13.831  -6.610
    7   HE21  GLN  49          HE21      GLN  49 -21.847  16.100  -5.416
    8   HE22  GLN  49          HE22      GLN  49 -20.929  17.330  -6.119

  No H/Q in entry =           8
  In of MODEL   84
    1    H    ASN  50           H        ASN  50 -23.066  10.974  -9.966
    2    HA   ASN  50           HA       ASN  50 -24.975  11.784 -12.049
    3    HB2  ASN  50           HB2      ASN  50 -22.406  10.225 -12.268
    4    HB3  ASN  50           HB3      ASN  50 -23.474  10.610 -13.610
    5   HD21  ASN  50          HD21      ASN  50 -20.811  11.498 -12.068
    6   HD22  ASN  50          HD22      ASN  50 -20.576  13.119 -12.468

  No H/Q in entry =           6
  In of MODEL   84
    1    H    ALA  51           H        ALA  51 -24.938   9.505  -9.725
    2    HA   ALA  51           HA       ALA  51 -25.758   7.303 -11.466
    3    HB2  ALA  51           HB1      ALA  51 -25.156   6.009  -9.744
    4    HB3  ALA  51           HB2      ALA  51 -26.259   6.859  -8.662
    5    HB1  ALA  51           HB3      ALA  51 -24.620   7.465  -8.905

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ASP  52           H        ASP  52 -27.766   6.263 -11.261
    2    HA   ASP  52           HA       ASP  52 -29.929   8.130 -10.627
    3    HB2  ASP  52           HB2      ASP  52 -29.775   5.569 -12.213
    4    HB3  ASP  52           HB3      ASP  52 -31.309   6.324 -11.781

  No H/Q in entry =           4
  In of MODEL   84
    1    H    VAL  53           H        VAL  53 -28.328   5.268  -9.537
    2    HA   VAL  53           HA       VAL  53 -29.730   5.488  -7.006
    3    HB   VAL  53           HB       VAL  53 -31.155   3.813  -8.173
    4   HG11  VAL  53          HG11      VAL  53 -29.435   2.892  -9.690
    5   HG13  VAL  53          HG12      VAL  53 -30.262   1.632  -8.776
    6   HG12  VAL  53          HG13      VAL  53 -28.642   2.142  -8.306
    7   HG23  VAL  53          HG21      VAL  53 -30.319   1.889  -6.427
    8   HG22  VAL  53          HG22      VAL  53 -31.436   3.211  -6.088
    9   HG21  VAL  53          HG23      VAL  53 -29.722   3.388  -5.711

  No H/Q in entry =           9
  In of MODEL   84
    1    H    VAL  54           H        VAL  54 -28.394   5.104  -5.357
    2    HA   VAL  54           HA       VAL  54 -25.649   4.218  -5.979
    3    HB   VAL  54           HB       VAL  54 -26.675   6.076  -3.775
    4   HG11  VAL  54          HG11      VAL  54 -24.109   4.632  -4.056
    5   HG13  VAL  54          HG12      VAL  54 -24.837   5.364  -2.627
    6   HG12  VAL  54          HG13      VAL  54 -23.942   6.365  -3.771
    7   HG22  VAL  54          HG21      VAL  54 -25.822   7.847  -4.948
    8   HG21  VAL  54          HG22      VAL  54 -26.396   6.815  -6.258
    9   HG23  VAL  54          HG23      VAL  54 -24.682   6.845  -5.846

  No H/Q in entry =           9
  In of MODEL   84
    1    H    LEU  55           H        LEU  55 -25.058   2.315  -5.281
    2    HA   LEU  55           HA       LEU  55 -26.541   1.087  -3.040
    3    HB2  LEU  55           HB2      LEU  55 -25.026  -0.168  -5.318
    4    HB3  LEU  55           HB3      LEU  55 -25.773  -1.053  -3.987
    5    HG   LEU  55           HG       LEU  55 -27.231   0.472  -6.135
    6   HD13  LEU  55          HD11      LEU  55 -26.960  -1.423  -7.296
    7   HD12  LEU  55          HD12      LEU  55 -27.905  -2.251  -6.058
    8   HD11  LEU  55          HD13      LEU  55 -26.147  -2.192  -5.936
    9   HD23  LEU  55          HD21      LEU  55 -28.510  -1.402  -4.197
   10   HD22  LEU  55          HD22      LEU  55 -29.209  -0.046  -5.080
   11   HD21  LEU  55          HD23      LEU  55 -28.166   0.251  -3.689

  No H/Q in entry =          11
  In of MODEL   84
    1    H    LEU  56           H        LEU  56 -25.366   0.547  -1.233
    2    HA   LEU  56           HA       LEU  56 -22.431   0.921  -1.339
    3    HB2  LEU  56           HB2      LEU  56 -24.199   0.803   1.091
    4    HB3  LEU  56           HB3      LEU  56 -22.487   1.220   1.041
    5    HG   LEU  56           HG       LEU  56 -24.790   2.881   0.055
    6   HD11  LEU  56          HD11      LEU  56 -23.640   2.578   2.570
    7   HD13  LEU  56          HD12      LEU  56 -24.629   3.935   2.033
    8   HD12  LEU  56          HD13      LEU  56 -22.873   4.025   1.915
    9   HD23  LEU  56          HD21      LEU  56 -22.838   4.559  -0.225
   10   HD22  LEU  56          HD22      LEU  56 -23.247   3.421  -1.508
   11   HD21  LEU  56          HD23      LEU  56 -21.880   3.095  -0.444

  No H/Q in entry =          11
  In of MODEL   84
    1    H    GLY  57           H        GLY  57 -21.053  -0.699  -0.770
    2    HA3  GLY  57           HA2      GLY  57 -21.995  -3.385  -0.863
    3    HA2  GLY  57           HA3      GLY  57 -20.362  -2.885  -0.425

  No H/Q in entry =           3
  In of MODEL   84
    1    HA   PRO  58           HA       PRO  58 -23.123  -3.779   3.359
    2    HB2  PRO  58           HB2      PRO  58 -22.446  -6.366   4.043
    3    HB3  PRO  58           HB3      PRO  58 -23.843  -5.982   3.037
    4    HG2  PRO  58           HG2      PRO  58 -21.132  -6.908   2.242
    5    HG3  PRO  58           HG3      PRO  58 -22.709  -7.380   1.610
    6    HD2  PRO  58           HD2      PRO  58 -21.108  -5.616   0.303
    7    HD3  PRO  58           HD3      PRO  58 -22.868  -5.521   0.223

  No H/Q in entry =           7
  In of MODEL   84
    1    H    GLN  59           H        GLN  59 -19.765  -4.295   2.719
    2    HA   GLN  59           HA       GLN  59 -18.968  -4.225   5.467
    3    HB2  GLN  59           HB2      GLN  59 -17.402  -3.446   3.003
    4    HB3  GLN  59           HB3      GLN  59 -16.733  -3.650   4.610
    5    HG2  GLN  59           HG2      GLN  59 -16.723  -5.554   2.708
    6    HG3  GLN  59           HG3      GLN  59 -16.671  -5.889   4.431
    7   HE21  GLN  59          HE21      GLN  59 -17.974  -6.781   1.899
    8   HE22  GLN  59          HE22      GLN  59 -19.461  -7.497   2.100

  No H/Q in entry =           8
  In of MODEL   84
    1    H    ILE  60           H        ILE  60 -19.918  -1.743   3.189
    2    HA   ILE  60           HA       ILE  60 -19.022   0.276   5.153
    3    HB   ILE  60           HB       ILE  60 -18.767   1.878   3.462
    4   HG12  ILE  60          HG12      ILE  60 -20.392   0.107   1.636
    5   HG13  ILE  60          HG13      ILE  60 -20.930   1.612   2.379
    6   HG23  ILE  60          HG21      ILE  60 -17.027   0.257   3.292
    7   HG22  ILE  60          HG22      ILE  60 -17.451   0.823   1.677
    8   HG21  ILE  60          HG23      ILE  60 -18.014  -0.752   2.235
    9   HD12  ILE  60          HD11      ILE  60 -20.179   1.690  -0.084
   10   HD11  ILE  60          HD12      ILE  60 -18.540   1.545   0.552
   11   HD13  ILE  60          HD13      ILE  60 -19.543   2.923   1.003

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ALA  61           H        ALA  61 -21.487  -1.289   5.312
    2    HA   ALA  61           HA       ALA  61 -23.708   0.375   4.829
    3    HB1  ALA  61           HB1      ALA  61 -24.914  -1.060   6.223
    4    HB2  ALA  61           HB2      ALA  61 -23.504  -1.424   7.218
    5    HB3  ALA  61           HB3      ALA  61 -23.628  -2.086   5.588

  No H/Q in entry =           5
  In of MODEL   84
    1    H    TYR  62           H        TYR  62 -21.461   0.342   7.598
    2    HA   TYR  62           HA       TYR  62 -22.979   2.067   9.233
    3    HB2  TYR  62           HB2      TYR  62 -20.911   2.525  10.415
    4    HB3  TYR  62           HB3      TYR  62 -21.000   0.808  10.024
    5    HD1  TYR  62           HD1      TYR  62 -19.436  -0.199   8.432
    6    HD2  TYR  62           HD2      TYR  62 -19.221   3.970   9.347
    7    HE1  TYR  62           HE1      TYR  62 -17.239  -0.072   7.319
    8    HE2  TYR  62           HE2      TYR  62 -17.011   4.091   8.236
    9    HH   TYR  62           HH       TYR  62 -15.146   2.397   7.732

  No H/Q in entry =           9
  In of MODEL   84
    1    H    MET  63           H        MET  63 -21.374   2.816   6.325
    2    HA   MET  63           HA       MET  63 -21.176   5.669   6.920
    3    HB2  MET  63           HB2      MET  63 -20.616   4.053   4.433
    4    HB3  MET  63           HB3      MET  63 -20.414   5.803   4.544
    5    HG2  MET  63           HG2      MET  63 -18.694   5.491   6.246
    6    HG3  MET  63           HG3      MET  63 -18.887   3.744   6.115
    7    HE2  MET  63           HE1      MET  63 -16.239   3.081   4.795
    8    HE1  MET  63           HE2      MET  63 -16.410   4.366   5.992
    9    HE3  MET  63           HE3      MET  63 -15.525   4.667   4.494

  No H/Q in entry =           9
  In of MODEL   84
    1    H    LEU  64           H        LEU  64 -23.768   3.803   6.057
    2    HA   LEU  64           HA       LEU  64 -24.999   5.160   3.950
    3    HB2  LEU  64           HB2      LEU  64 -25.869   3.093   4.952
    4    HB3  LEU  64           HB3      LEU  64 -26.297   3.989   6.408
    5    HG   LEU  64           HG       LEU  64 -28.000   5.215   5.164
    6   HD13  LEU  64          HD11      LEU  64 -27.749   5.377   2.921
    7   HD12  LEU  64          HD12      LEU  64 -28.410   3.744   2.840
    8   HD11  LEU  64          HD13      LEU  64 -26.665   3.990   2.864
    9   HD23  LEU  64          HD21      LEU  64 -28.552   2.383   4.520
   10   HD22  LEU  64          HD22      LEU  64 -29.516   3.555   5.416
   11   HD21  LEU  64          HD23      LEU  64 -28.137   2.777   6.188

  No H/Q in entry =          11
  In of MODEL   84
    1    HA   PRO  65           HA       PRO  65 -27.112   8.423   6.624
    2    HB2  PRO  65           HB2      PRO  65 -25.076   8.641   8.841
    3    HB3  PRO  65           HB3      PRO  65 -26.812   8.938   8.904
    4    HG2  PRO  65           HG2      PRO  65 -25.886   6.709   9.893
    5    HG3  PRO  65           HG3      PRO  65 -27.322   6.653   8.871
    6    HD2  PRO  65           HD2      PRO  65 -24.466   5.990   8.145
    7    HD3  PRO  65           HD3      PRO  65 -25.938   5.102   7.751

  No H/Q in entry =           7
  In of MODEL   84
    1    H    GLU  66           H        GLU  66 -23.555   8.338   6.646
    2    HA   GLU  66           HA       GLU  66 -23.241  11.119   6.141
    3    HB2  GLU  66           HB2      GLU  66 -21.458   8.774   5.542
    4    HB3  GLU  66           HB3      GLU  66 -20.997  10.455   5.270
    5    HG2  GLU  66           HG2      GLU  66 -21.169  10.907   7.626
    6    HG3  GLU  66           HG3      GLU  66 -21.705   9.254   7.923

  No H/Q in entry =           6
  In of MODEL   84
    1    H    ILE  67           H        ILE  67 -23.401   8.299   3.986
    2    HA   ILE  67           HA       ILE  67 -23.005   9.925   1.630
    3    HB   ILE  67           HB       ILE  67 -23.927   7.034   1.922
    4   HG12  ILE  67          HG12      ILE  67 -21.300   8.147   0.921
    5   HG13  ILE  67          HG13      ILE  67 -21.574   7.788   2.624
    6   HG21  ILE  67          HG21      ILE  67 -23.887   8.836  -0.367
    7   HG23  ILE  67          HG22      ILE  67 -24.526   7.196  -0.250
    8   HG22  ILE  67          HG23      ILE  67 -22.820   7.453  -0.614
    9   HD12  ILE  67          HD11      ILE  67 -21.206   5.933   0.331
   10   HD11  ILE  67          HD12      ILE  67 -22.206   5.416   1.687
   11   HD13  ILE  67          HD13      ILE  67 -20.523   5.874   1.956

  No H/Q in entry =          11
  In of MODEL   84
    1    H    GLN  68           H        GLN  68 -25.859   8.956   3.341
    2    HA   GLN  68           HA       GLN  68 -27.710   9.838   1.364
    3    HB2  GLN  68           HB2      GLN  68 -27.922   9.584   4.362
    4    HB3  GLN  68           HB3      GLN  68 -29.251  10.159   3.369
    5    HG2  GLN  68           HG2      GLN  68 -29.320   8.087   2.163
    6    HG3  GLN  68           HG3      GLN  68 -27.864   7.523   2.963
    7   HE21  GLN  68          HE21      GLN  68 -30.058   6.184   2.907
    8   HE22  GLN  68          HE22      GLN  68 -30.870   5.787   4.349

  No H/Q in entry =           8
  In of MODEL   84
    1    H    ARG  69           H        ARG  69 -26.044  11.579   4.019
    2    HA   ARG  69           HA       ARG  69 -27.388  14.061   3.550
    3    HB2  ARG  69           HB2      ARG  69 -25.029  13.159   5.133
    4    HB3  ARG  69           HB3      ARG  69 -25.095  14.866   4.718
    5    HG2  ARG  69           HG2      ARG  69 -27.395  14.969   5.722
    6    HG3  ARG  69           HG3      ARG  69 -27.199  13.294   6.250
    7    HD2  ARG  69           HD2      ARG  69 -25.465  15.658   7.058
    8    HD3  ARG  69           HD3      ARG  69 -26.589  14.800   8.100
    9    HE   ARG  69           HE       ARG  69 -24.003  13.806   7.143
   10   HH21  ARG  69          HH11      ARG  69 -23.195  12.075   8.385
   11   HH22  ARG  69          HH12      ARG  69 -24.215  11.309   9.556
   12   HH11  ARG  69          HH21      ARG  69 -26.938  13.351   8.903
   13   HH12  ARG  69          HH22      ARG  69 -26.334  12.030   9.847

  No H/Q in entry =          13
  In of MODEL   84
    1    H    LEU  70           H        LEU  70 -24.554  12.576   2.194
    2    HA   LEU  70           HA       LEU  70 -23.433  14.887   0.930
    3    HB2  LEU  70           HB2      LEU  70 -22.456  12.578   1.588
    4    HB3  LEU  70           HB3      LEU  70 -23.101  12.067   0.029
    5    HG   LEU  70           HG       LEU  70 -21.509  13.382  -1.126
    6   HD11  LEU  70          HD11      LEU  70 -20.633  14.309   1.618
    7   HD13  LEU  70          HD12      LEU  70 -21.336  15.309   0.346
    8   HD12  LEU  70          HD13      LEU  70 -19.736  14.601   0.125
    9   HD22  LEU  70          HD21      LEU  70 -20.093  11.657  -0.859
   10   HD21  LEU  70          HD22      LEU  70 -21.003  11.194   0.579
   11   HD23  LEU  70          HD23      LEU  70 -19.602  12.255   0.726

  No H/Q in entry =          11
  In of MODEL   84
    1    H    LEU  71           H        LEU  71 -25.634  12.334  -0.066
    2    HA   LEU  71           HA       LEU  71 -26.180  13.743  -2.622
    3    HB2  LEU  71           HB2      LEU  71 -26.416  10.778  -2.072
    4    HB3  LEU  71           HB3      LEU  71 -26.558  11.588  -3.632
    5    HG   LEU  71           HG       LEU  71 -24.012  11.624  -2.011
    6   HD12  LEU  71          HD11      LEU  71 -24.125   9.916  -4.385
    7   HD11  LEU  71          HD12      LEU  71 -25.122   9.349  -3.047
    8   HD13  LEU  71          HD13      LEU  71 -23.395   9.616  -2.808
    9   HD22  LEU  71          HD21      LEU  71 -24.115  13.390  -3.563
   10   HD21  LEU  71          HD22      LEU  71 -24.647  12.310  -4.851
   11   HD23  LEU  71          HD23      LEU  71 -23.017  12.164  -4.195

  No H/Q in entry =          11
  In of MODEL   84
    1    HA   PRO  72           HA       PRO  72 -30.009  13.436   0.072
    2    HB2  PRO  72           HB2      PRO  72 -30.832  16.005  -0.083
    3    HB3  PRO  72           HB3      PRO  72 -29.512  15.572   1.003
    4    HG2  PRO  72           HG2      PRO  72 -29.354  16.670  -1.792
    5    HG3  PRO  72           HG3      PRO  72 -28.556  17.260  -0.334
    6    HD2  PRO  72           HD2      PRO  72 -27.269  15.624  -2.067
    7    HD3  PRO  72           HD3      PRO  72 -26.990  15.512  -0.330

  No H/Q in entry =           7
  In of MODEL   84
    1    H    ASN  73           H        ASN  73 -29.423  14.273  -3.182
    2    HA   ASN  73           HA       ASN  73 -32.298  13.986  -3.759
    3    HB2  ASN  73           HB2      ASN  73 -31.850  15.014  -5.900
    4    HB3  ASN  73           HB3      ASN  73 -31.291  16.032  -4.581
    5   HD21  ASN  73          HD21      ASN  73 -30.537  15.974  -7.270
    6   HD22  ASN  73          HD22      ASN  73 -28.876  15.781  -7.483

  No H/Q in entry =           6
  In of MODEL   84
    1    H    LYS  74           H        LYS  74 -30.344  11.717  -3.289
    2    HA   LYS  74           HA       LYS  74 -30.973  10.246  -5.779
    3    HB2  LYS  74           HB2      LYS  74 -28.420   9.969  -4.188
    4    HB3  LYS  74           HB3      LYS  74 -28.840   9.112  -5.672
    5    HG2  LYS  74           HG2      LYS  74 -28.527  12.082  -5.574
    6    HG3  LYS  74           HG3      LYS  74 -27.174  10.988  -5.864
    7    HD2  LYS  74           HD2      LYS  74 -28.337  10.013  -7.757
    8    HD3  LYS  74           HD3      LYS  74 -29.734  11.043  -7.450
    9    HE2  LYS  74           HE2      LYS  74 -28.485  13.014  -7.978
   10    HE3  LYS  74           HE3      LYS  74 -26.980  12.097  -8.062
   11    HZ2  LYS  74           HZ1      LYS  74 -28.475  12.651 -10.184
   12    HZ1  LYS  74           HZ2      LYS  74 -29.147  11.153  -9.750
   13    HZ3  LYS  74           HZ3      LYS  74 -27.485  11.276 -10.078

  No H/Q in entry =          13
  In of MODEL   84
    1    HA   PRO  75           HA       PRO  75 -32.368   7.386  -2.687
    2    HB2  PRO  75           HB2      PRO  75 -32.738   5.121  -4.188
    3    HB3  PRO  75           HB3      PRO  75 -33.843   6.490  -4.286
    4    HG2  PRO  75           HG2      PRO  75 -31.544   5.795  -6.071
    5    HG3  PRO  75           HG3      PRO  75 -33.191   6.245  -6.508
    6    HD2  PRO  75           HD2      PRO  75 -31.220   8.077  -6.558
    7    HD3  PRO  75           HD3      PRO  75 -32.837   8.522  -6.008

  No H/Q in entry =           7
  In of MODEL   84
    1    H    VAL  76           H        VAL  76 -30.910   6.353  -1.302
    2    HA   VAL  76           HA       VAL  76 -28.483   5.066  -2.404
    3    HB   VAL  76           HB       VAL  76 -28.705   6.626   0.206
    4   HG11  VAL  76          HG11      VAL  76 -26.392   5.254  -1.176
    5   HG13  VAL  76          HG12      VAL  76 -27.071   4.868   0.406
    6   HG12  VAL  76          HG13      VAL  76 -26.203   6.384   0.165
    7   HG22  VAL  76          HG21      VAL  76 -28.020   8.485  -0.756
    8   HG21  VAL  76          HG22      VAL  76 -28.598   7.747  -2.250
    9   HG23  VAL  76          HG23      VAL  76 -26.891   7.646  -1.819

  No H/Q in entry =           9
  In of MODEL   84
    1    H    GLU  77           H        GLU  77 -28.291   2.930  -1.721
    2    HA   GLU  77           HA       GLU  77 -29.048   2.247   0.970
    3    HB2  GLU  77           HB2      GLU  77 -30.690   0.611   0.520
    4    HB3  GLU  77           HB3      GLU  77 -31.226   2.118  -0.225
    5    HG2  GLU  77           HG2      GLU  77 -30.663   1.276  -2.395
    6    HG3  GLU  77           HG3      GLU  77 -30.036  -0.208  -1.681

  No H/Q in entry =           6
  In of MODEL   84
    1    H    VAL  78           H        VAL  78 -28.745   0.179   1.696
    2    HA   VAL  78           HA       VAL  78 -26.106  -0.666   0.794
    3    HB   VAL  78           HB       VAL  78 -27.790  -1.440   3.214
    4   HG11  VAL  78          HG11      VAL  78 -25.489  -2.745   2.097
    5   HG13  VAL  78          HG12      VAL  78 -26.381  -3.152   3.564
    6   HG12  VAL  78          HG13      VAL  78 -25.042  -2.009   3.636
    7   HG22  VAL  78          HG21      VAL  78 -26.290  -0.057   4.483
    8   HG21  VAL  78          HG22      VAL  78 -27.030   0.880   3.186
    9   HG23  VAL  78          HG23      VAL  78 -25.364   0.320   3.030

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ILE  79           H        ILE  79 -25.613  -2.612  -0.053
    2    HA   ILE  79           HA       ILE  79 -27.717  -4.102  -1.318
    3    HB   ILE  79           HB       ILE  79 -24.733  -4.669  -1.123
    4   HG12  ILE  79          HG12      ILE  79 -26.387  -3.618  -3.423
    5   HG13  ILE  79          HG13      ILE  79 -25.479  -2.584  -2.319
    6   HG22  ILE  79          HG21      ILE  79 -25.889  -5.909  -3.383
    7   HG21  ILE  79          HG22      ILE  79 -26.860  -6.368  -1.984
    8   HG23  ILE  79          HG23      ILE  79 -25.124  -6.674  -1.991
    9   HD13  ILE  79          HD11      ILE  79 -24.095  -2.782  -4.154
   10   HD12  ILE  79          HD12      ILE  79 -24.466  -4.493  -4.370
   11   HD11  ILE  79          HD13      ILE  79 -23.454  -3.974  -3.022

  No H/Q in entry =          11
  In of MODEL   84
    1    H    ASP  80           H        ASP  80 -28.604  -5.989  -0.655
    2    HA   ASP  80           HA       ASP  80 -28.523  -6.799   2.020
    3    HB2  ASP  80           HB2      ASP  80 -30.312  -7.403   0.427
    4    HB3  ASP  80           HB3      ASP  80 -29.183  -8.458  -0.423

  No H/Q in entry =           4
  In of MODEL   84
    1    H    SER  81           H        SER  81 -26.988  -7.919   3.165
    2    HA   SER  81           HA       SER  81 -24.522  -8.683   1.961
    3    HB2  SER  81           HB2      SER  81 -23.951  -9.641   4.155
    4    HB3  SER  81           HB3      SER  81 -24.630  -8.023   4.325
    5    HG   SER  81           HG       SER  81 -26.376  -8.816   5.213

  No H/Q in entry =           5
  In of MODEL   84
    1    H    LEU  82           H        LEU  82 -27.260 -10.718   2.395
    2    HA   LEU  82           HA       LEU  82 -25.758 -13.128   1.934
    3    HB2  LEU  82           HB2      LEU  82 -28.693 -12.609   1.513
    4    HB3  LEU  82           HB3      LEU  82 -27.908 -14.174   1.727
    5    HG   LEU  82           HG       LEU  82 -28.175 -12.050   3.835
    6   HD12  LEU  82          HD11      LEU  82 -29.685 -13.806   4.855
    7   HD11  LEU  82          HD12      LEU  82 -29.636 -14.642   3.301
    8   HD13  LEU  82          HD13      LEU  82 -30.327 -13.022   3.411
    9   HD21  LEU  82          HD21      LEU  82 -26.957 -14.808   3.736
   10   HD23  LEU  82          HD22      LEU  82 -27.384 -14.009   5.249
   11   HD22  LEU  82          HD23      LEU  82 -26.176 -13.290   4.185

  No H/Q in entry =          11
  In of MODEL   84
    1    H    LEU  83           H        LEU  83 -27.711 -10.937  -0.031
    2    HA   LEU  83           HA       LEU  83 -27.570 -12.384  -2.457
    3    HB2  LEU  83           HB2      LEU  83 -27.924  -9.449  -1.904
    4    HB3  LEU  83           HB3      LEU  83 -27.991 -10.149  -3.521
    5    HG   LEU  83           HG       LEU  83 -29.996 -10.427  -1.303
    6   HD13  LEU  83          HD11      LEU  83 -30.739  -8.606  -2.418
    7   HD12  LEU  83          HD12      LEU  83 -31.239  -9.755  -3.657
    8   HD11  LEU  83          HD13      LEU  83 -29.693  -8.918  -3.803
    9   HD23  LEU  83          HD21      LEU  83 -30.198 -11.776  -3.979
   10   HD22  LEU  83          HD22      LEU  83 -31.150 -12.060  -2.524
   11   HD21  LEU  83          HD23      LEU  83 -29.472 -12.594  -2.596

  No H/Q in entry =          11
  In of MODEL   84
    1    H    TYR  84           H        TYR  84 -25.553  -9.974  -0.895
    2    HA   TYR  84           HA       TYR  84 -23.716  -9.591  -3.068
    3    HB2  TYR  84           HB2      TYR  84 -24.192  -8.046  -1.062
    4    HB3  TYR  84           HB3      TYR  84 -23.128  -9.117  -0.153
    5    HD1  TYR  84           HD1      TYR  84 -20.821  -9.627  -1.492
    6    HD2  TYR  84           HD2      TYR  84 -23.216  -6.114  -1.892
    7    HE1  TYR  84           HE1      TYR  84 -18.854  -8.398  -2.346
    8    HE2  TYR  84           HE2      TYR  84 -21.261  -4.877  -2.756
    9    HH   TYR  84           HH       TYR  84 -18.286  -5.645  -2.316

  No H/Q in entry =           9
  In of MODEL   84
    1    H    GLY  85           H        GLY  85 -23.462 -11.494  -0.057
    2    HA3  GLY  85           HA2      GLY  85 -20.908 -12.496  -0.546
    3    HA2  GLY  85           HA3      GLY  85 -22.137 -13.289   0.439

  No H/Q in entry =           3
  In of MODEL   84
    1    H    LYS  86           H        LYS  86 -24.022 -13.703  -1.579
    2    HA   LYS  86           HA       LYS  86 -23.026 -16.137  -2.770
    3    HB2  LYS  86           HB2      LYS  86 -25.273 -15.827  -1.756
    4    HB3  LYS  86           HB3      LYS  86 -25.660 -14.688  -3.044
    5    HG2  LYS  86           HG2      LYS  86 -25.552 -16.451  -4.672
    6    HG3  LYS  86           HG3      LYS  86 -25.083 -17.602  -3.419
    7    HD2  LYS  86           HD2      LYS  86 -27.169 -17.125  -2.208
    8    HD3  LYS  86           HD3      LYS  86 -27.640 -15.988  -3.469
    9    HE2  LYS  86           HE2      LYS  86 -27.664 -17.798  -5.105
   10    HE3  LYS  86           HE3      LYS  86 -27.160 -18.940  -3.860
   11    HZ1  LYS  86           HZ1      LYS  86 -29.378 -17.509  -2.914
   12    HZ3  LYS  86           HZ2      LYS  86 -29.265 -19.169  -3.255
   13    HZ2  LYS  86           HZ3      LYS  86 -29.753 -18.085  -4.467

  No H/Q in entry =          13
  In of MODEL   84
    1    H    VAL  87           H        VAL  87 -22.977 -12.955  -3.776
    2    HA   VAL  87           HA       VAL  87 -22.691 -11.856  -5.761
    3    HB   VAL  87           HB       VAL  87 -21.672 -14.448  -6.973
    4   HG12  VAL  87          HG11      VAL  87 -20.549 -11.661  -7.253
    5   HG11  VAL  87          HG12      VAL  87 -21.908 -12.200  -8.241
    6   HG13  VAL  87          HG13      VAL  87 -20.358 -13.035  -8.341
    7   HG23  VAL  87          HG21      VAL  87 -19.432 -13.842  -6.052
    8   HG22  VAL  87          HG22      VAL  87 -20.591 -14.404  -4.850
    9   HG21  VAL  87          HG23      VAL  87 -20.242 -12.683  -4.999

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ASP  88           H        ASP  88 -25.210 -12.443  -5.349
    2    HA   ASP  88           HA       ASP  88 -26.388 -13.725  -7.685
    3    HB2  ASP  88           HB2      ASP  88 -27.350 -13.872  -5.338
    4    HB3  ASP  88           HB3      ASP  88 -27.778 -12.168  -5.491

  No H/Q in entry =           4
  In of MODEL   84
    1    H    GLY  89           H        GLY  89 -25.691 -12.537  -9.380
    2    HA3  GLY  89           HA2      GLY  89 -25.832  -9.770  -9.676
    3    HA2  GLY  89           HA3      GLY  89 -25.848 -10.938 -10.996

  No H/Q in entry =           3
  In of MODEL   84
    1    H    LEU  90           H        LEU  90 -28.308 -12.234 -10.463
    2    HA   LEU  90           HA       LEU  90 -30.105 -10.311 -11.615
    3    HB2  LEU  90           HB2      LEU  90 -30.217 -12.724 -12.109
    4    HB3  LEU  90           HB3      LEU  90 -30.702 -13.024 -10.441
    5    HG   LEU  90           HG       LEU  90 -32.809 -11.887 -10.810
    6   HD13  LEU  90          HD11      LEU  90 -32.626 -10.202 -12.348
    7   HD12  LEU  90          HD12      LEU  90 -33.203 -11.470 -13.433
    8   HD11  LEU  90          HD13      LEU  90 -31.481 -11.098 -13.349
    9   HD23  LEU  90          HD21      LEU  90 -32.803 -13.602 -13.186
   10   HD22  LEU  90          HD22      LEU  90 -33.761 -13.700 -11.710
   11   HD21  LEU  90          HD23      LEU  90 -32.117 -14.339 -11.739

  No H/Q in entry =          11
  In of MODEL   84
    1    H    GLY  91           H        GLY  91 -29.908 -11.702  -8.383
    2    HA3  GLY  91           HA2      GLY  91 -32.213 -10.516  -7.347
    3    HA2  GLY  91           HA3      GLY  91 -30.814 -11.038  -6.408

  No H/Q in entry =           3
  In of MODEL   84
    1    H    VAL  92           H        VAL  92 -28.883  -9.272  -7.358
    2    HA   VAL  92           HA       VAL  92 -29.614  -6.906  -5.880
    3    HB   VAL  92           HB       VAL  92 -27.102  -7.472  -7.498
    4   HG12  VAL  92          HG11      VAL  92 -27.200  -5.503  -5.237
    5   HG11  VAL  92          HG12      VAL  92 -27.881  -5.004  -6.787
    6   HG13  VAL  92          HG13      VAL  92 -26.191  -5.494  -6.684
    7   HG22  VAL  92          HG21      VAL  92 -26.876  -9.005  -5.854
    8   HG21  VAL  92          HG22      VAL  92 -27.992  -8.170  -4.772
    9   HG23  VAL  92          HG23      VAL  92 -26.331  -7.599  -4.939

  No H/Q in entry =           9
  In of MODEL   84
    1    H    LEU  93           H        LEU  93 -29.273  -7.694  -9.281
    2    HA   LEU  93           HA       LEU  93 -29.594  -5.088 -10.297
    3    HB2  LEU  93           HB2      LEU  93 -29.004  -7.003 -11.703
    4    HB3  LEU  93           HB3      LEU  93 -30.602  -7.698 -11.429
    5    HG   LEU  93           HG       LEU  93 -31.603  -5.760 -12.606
    6   HD11  LEU  93          HD11      LEU  93 -29.720  -4.176 -12.188
    7   HD13  LEU  93          HD12      LEU  93 -30.188  -4.259 -13.888
    8   HD12  LEU  93          HD13      LEU  93 -28.741  -5.097 -13.330
    9   HD23  LEU  93          HD21      LEU  93 -30.610  -6.422 -14.887
   10   HD22  LEU  93          HD22      LEU  93 -31.456  -7.634 -13.924
   11   HD21  LEU  93          HD23      LEU  93 -29.691  -7.605 -13.957

  No H/Q in entry =          11
  In of MODEL   84
    1    H    LYS  94           H        LYS  94 -31.993  -7.566  -9.320
    2    HA   LYS  94           HA       LYS  94 -34.325  -6.111  -9.959
    3    HB2  LYS  94           HB2      LYS  94 -33.811  -8.231  -7.879
    4    HB3  LYS  94           HB3      LYS  94 -35.402  -7.521  -8.146
    5    HG2  LYS  94           HG2      LYS  94 -35.365  -8.379 -10.452
    6    HG3  LYS  94           HG3      LYS  94 -33.810  -9.142 -10.122
    7    HD2  LYS  94           HD2      LYS  94 -34.921 -10.394  -8.233
    8    HD3  LYS  94           HD3      LYS  94 -36.464  -9.743  -8.787
    9    HE2  LYS  94           HE2      LYS  94 -35.999 -10.758 -11.027
   10    HE3  LYS  94           HE3      LYS  94 -34.584 -11.538 -10.319
   11    HZ3  LYS  94           HZ1      LYS  94 -36.460 -13.037 -10.405
   12    HZ2  LYS  94           HZ2      LYS  94 -37.402 -11.963  -9.485
   13    HZ1  LYS  94           HZ3      LYS  94 -36.043 -12.707  -8.792

  No H/Q in entry =          13
  In of MODEL   84
    1    H    ALA  95           H        ALA  95 -32.453  -6.153  -6.937
    2    HA   ALA  95           HA       ALA  95 -34.254  -4.493  -5.485
    3    HB2  ALA  95           HB1      ALA  95 -31.891  -5.885  -4.938
    4    HB3  ALA  95           HB2      ALA  95 -32.836  -4.925  -3.802
    5    HB1  ALA  95           HB3      ALA  95 -31.490  -4.188  -4.671

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ALA  96           H        ALA  96 -31.635  -3.754  -7.653
    2    HA   ALA  96           HA       ALA  96 -31.484  -0.969  -6.978
    3    HB2  ALA  96           HB1      ALA  96 -30.154  -0.838  -9.117
    4    HB3  ALA  96           HB2      ALA  96 -30.489  -2.552  -9.371
    5    HB1  ALA  96           HB3      ALA  96 -29.543  -2.036  -7.974

  No H/Q in entry =           5
  In of MODEL   84
    1    H    VAL  97           H        VAL  97 -33.086  -2.752  -9.579
    2    HA   VAL  97           HA       VAL  97 -34.140  -0.481 -10.897
    3    HB   VAL  97           HB       VAL  97 -34.997  -3.392 -10.824
    4   HG11  VAL  97          HG11      VAL  97 -36.765  -1.375 -11.350
    5   HG13  VAL  97          HG12      VAL  97 -36.862  -2.992 -12.049
    6   HG12  VAL  97          HG13      VAL  97 -36.102  -1.686 -12.955
    7   HG21  VAL  97          HG21      VAL  97 -33.723  -1.658 -12.942
    8   HG23  VAL  97          HG22      VAL  97 -34.208  -3.340 -13.164
    9   HG22  VAL  97          HG23      VAL  97 -32.933  -2.932 -12.013

  No H/Q in entry =           9
  In of MODEL   84
    1    H    ALA  98           H        ALA  98 -35.316  -2.550  -8.266
    2    HA   ALA  98           HA       ALA  98 -37.851  -1.347  -7.915
    3    HB1  ALA  98           HB1      ALA  98 -36.857  -3.525  -6.823
    4    HB3  ALA  98           HB2      ALA  98 -38.007  -2.549  -5.905
    5    HB2  ALA  98           HB3      ALA  98 -36.278  -2.417  -5.579

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ALA  99           H        ALA  99 -34.733  -0.545  -6.347
    2    HA   ALA  99           HA       ALA  99 -35.800   1.515  -4.737
    3    HB1  ALA  99           HB1      ALA  99 -33.181   0.554  -5.496
    4    HB2  ALA  99           HB2      ALA  99 -33.693   1.365  -4.015
    5    HB3  ALA  99           HB3      ALA  99 -33.223   2.315  -5.423

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ILE 100           H        ILE 100 -34.814   1.512  -8.111
    2    HA   ILE 100           HA       ILE 100 -34.947   4.354  -8.426
    3    HB   ILE 100           HB       ILE 100 -35.116   2.129 -10.487
    4   HG12  ILE 100          HG12      ILE 100 -32.906   4.104  -9.921
    5   HG13  ILE 100          HG13      ILE 100 -32.961   2.480  -9.233
    6   HG21  ILE 100          HG21      ILE 100 -35.489   5.050 -10.712
    7   HG23  ILE 100          HG22      ILE 100 -36.036   3.753 -11.775
    8   HG22  ILE 100          HG23      ILE 100 -34.375   4.336 -11.878
    9   HD12  ILE 100          HD11      ILE 100 -32.458   3.331 -12.048
   10   HD11  ILE 100          HD12      ILE 100 -33.144   1.738 -11.726
   11   HD13  ILE 100          HD13      ILE 100 -31.578   2.178 -11.047

  No H/Q in entry =          11
  In of MODEL   84
    1    H    LYS 101           H        LYS 101 -37.298   1.764  -9.025
    2    HA   LYS 101           HA       LYS 101 -39.367   3.415 -10.047
    3    HB2  LYS 101           HB2      LYS 101 -39.281   0.680  -8.826
    4    HB3  LYS 101           HB3      LYS 101 -40.825   1.457  -9.173
    5    HG2  LYS 101           HG2      LYS 101 -40.386   1.504 -11.481
    6    HG3  LYS 101           HG3      LYS 101 -38.694   1.078 -11.240
    7    HD2  LYS 101           HD2      LYS 101 -39.992  -0.837 -12.039
    8    HD3  LYS 101           HD3      LYS 101 -39.344  -1.123 -10.425
    9    HE2  LYS 101           HE2      LYS 101 -41.410  -1.762  -9.861
   10    HE3  LYS 101           HE3      LYS 101 -41.837  -0.051  -9.915
   11    HZ3  LYS 101           HZ1      LYS 101 -42.766  -0.264 -12.011
   12    HZ2  LYS 101           HZ2      LYS 101 -43.242  -1.703 -11.246
   13    HZ1  LYS 101           HZ3      LYS 101 -41.952  -1.716 -12.352

  No H/Q in entry =          13
  In of MODEL   84
    1    H    LYS 102           H        LYS 102 -38.848   2.039  -6.798
    2    HA   LYS 102           HA       LYS 102 -41.053   3.315  -5.606
    3    HB2  LYS 102           HB2      LYS 102 -39.833   1.462  -4.548
    4    HB3  LYS 102           HB3      LYS 102 -38.420   2.499  -4.362
    5    HG2  LYS 102           HG2      LYS 102 -39.686   3.968  -2.894
    6    HG3  LYS 102           HG3      LYS 102 -41.103   2.934  -3.080
    7    HD2  LYS 102           HD2      LYS 102 -39.893   1.082  -2.011
    8    HD3  LYS 102           HD3      LYS 102 -38.478   2.117  -1.822
    9    HE2  LYS 102           HE2      LYS 102 -39.781   3.666  -0.443
   10    HE3  LYS 102           HE3      LYS 102 -41.215   2.662  -0.654
   11    HZ1  LYS 102           HZ1      LYS 102 -39.510   0.911   0.382
   12    HZ3  LYS 102           HZ2      LYS 102 -40.589   1.848   1.298
   13    HZ2  LYS 102           HZ3      LYS 102 -38.972   2.338   1.128

  No H/Q in entry =          13
  In of MODEL   84
    1    H    ALA 103           H        ALA 103 -38.091   4.617  -6.712
    2    HA   ALA 103           HA       ALA 103 -38.244   6.994  -5.007
    3    HB2  ALA 103           HB1      ALA 103 -36.266   7.638  -6.638
    4    HB3  ALA 103           HB2      ALA 103 -36.267   5.907  -6.978
    5    HB1  ALA 103           HB3      ALA 103 -36.004   6.482  -5.332

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ALA 104           H        ALA 104 -38.932   6.162  -8.316
    2    HA   ALA 104           HA       ALA 104 -39.478   8.935  -9.023
    3    HB2  ALA 104           HB1      ALA 104 -39.569   8.194 -11.200
    4    HB1  ALA 104           HB2      ALA 104 -40.317   6.660 -10.758
    5    HB3  ALA 104           HB3      ALA 104 -38.587   6.900 -10.515

  No H/Q in entry =           5
  In of MODEL   84
    1    H    ALA 105           H        ALA 105 -41.093   6.922  -7.123
    2    HA   ALA 105           HA       ALA 105 -43.492   8.361  -7.106
    3    HB2  ALA 105           HB1      ALA 105 -44.285   7.447  -9.102
    4    HB3  ALA 105           HB2      ALA 105 -44.924   6.309  -7.916
    5    HB1  ALA 105           HB3      ALA 105 -43.476   5.903  -8.835

  No H/Q in entry =           5
  In of MODEL   85
    1    H1   ALA   1           H3       ALA   1 -12.025 -16.139  -2.430
    2    H2   ALA   1           H2       ALA   1 -11.063 -17.268  -3.266
    3    H3   ALA   1           H1       ALA   1 -12.221 -16.346  -4.104
    4    HA   ALA   1           HA       ALA   1 -13.592 -18.069  -3.861
    5    HB3  ALA   1           HB1      ALA   1 -12.167 -19.815  -3.391
    6    HB1  ALA   1           HB2      ALA   1 -12.928 -19.710  -1.803
    7    HB2  ALA   1           HB3      ALA   1 -11.364 -18.944  -2.084

  No H/Q in entry =           7
  In of MODEL   85
    1    H    GLU   2           H        GLU   2 -15.203 -18.944  -2.207
    2    HA   GLU   2           HA       GLU   2 -16.882 -17.248  -1.157
    3    HB2  GLU   2           HB2      GLU   2 -15.905 -19.653   0.398
    4    HB3  GLU   2           HB3      GLU   2 -17.443 -18.827   0.646
    5    HG2  GLU   2           HG2      GLU   2 -18.401 -19.936  -1.086
    6    HG3  GLU   2           HG3      GLU   2 -17.083 -19.516  -2.170

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLU   3           H        GLU   3 -14.952 -18.561   1.474
    2    HA   GLU   3           HA       GLU   3 -15.215 -16.206   3.023
    3    HB2  GLU   3           HB2      GLU   3 -13.588 -18.725   3.285
    4    HB3  GLU   3           HB3      GLU   3 -13.380 -17.398   4.428
    5    HG2  GLU   3           HG2      GLU   3 -15.572 -17.583   5.243
    6    HG3  GLU   3           HG3      GLU   3 -16.152 -18.398   3.796

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LEU   4           H        LEU   4 -12.234 -17.640   1.642
    2    HA   LEU   4           HA       LEU   4 -10.432 -15.704   2.238
    3    HB2  LEU   4           HB2      LEU   4 -10.636 -17.015  -0.483
    4    HB3  LEU   4           HB3      LEU   4  -9.198 -16.268   0.202
    5    HG   LEU   4           HG       LEU   4 -10.654 -18.686   1.320
    6   HD13  LEU   4          HD11      LEU   4  -8.997 -20.018   0.398
    7   HD12  LEU   4          HD12      LEU   4  -7.809 -18.715   0.369
    8   HD11  LEU   4          HD13      LEU   4  -9.095 -18.762  -0.836
    9   HD23  LEU   4          HD21      LEU   4  -8.404 -18.708   2.706
   10   HD22  LEU   4          HD22      LEU   4  -9.743 -17.688   3.229
   11   HD21  LEU   4          HD23      LEU   4  -8.391 -16.980   2.347

  No H/Q in entry =          11
  In of MODEL   85
    1    H    GLU   5           H        GLU   5 -12.765 -15.545  -0.441
    2    HA   GLU   5           HA       GLU   5 -11.801 -13.049  -1.449
    3    HB2  GLU   5           HB2      GLU   5 -13.127 -14.678  -2.794
    4    HB3  GLU   5           HB3      GLU   5 -14.534 -14.298  -1.802
    5    HG2  GLU   5           HG2      GLU   5 -14.669 -12.941  -3.791
    6    HG3  GLU   5           HG3      GLU   5 -14.238 -11.880  -2.450

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLU   6           H        GLU   6 -14.515 -13.965   0.641
    2    HA   GLU   6           HA       GLU   6 -15.464 -11.302   1.030
    3    HB2  GLU   6           HB2      GLU   6 -15.915 -13.946   2.374
    4    HB3  GLU   6           HB3      GLU   6 -16.482 -12.469   3.153
    5    HG2  GLU   6           HG2      GLU   6 -18.278 -13.342   1.777
    6    HG3  GLU   6           HG3      GLU   6 -17.664 -11.874   1.022

  No H/Q in entry =           6
  In of MODEL   85
    1    H    VAL   7           H        VAL   7 -13.126 -13.369   2.613
    2    HA   VAL   7           HA       VAL   7 -12.690 -11.779   4.936
    3    HB   VAL   7           HB       VAL   7 -10.950 -13.799   3.497
    4   HG11  VAL   7          HG11      VAL   7 -10.512 -12.250   6.056
    5   HG13  VAL   7          HG12      VAL   7  -9.406 -12.451   4.698
    6   HG12  VAL   7          HG13      VAL   7  -9.739 -13.810   5.772
    7   HG21  VAL   7          HG21      VAL   7 -13.194 -14.396   4.714
    8   HG23  VAL   7          HG22      VAL   7 -12.274 -14.102   6.190
    9   HG22  VAL   7          HG23      VAL   7 -11.758 -15.358   5.066

  No H/Q in entry =           9
  In of MODEL   85
    1    H    VAL   8           H        VAL   8 -11.171 -11.880   1.729
    2    HA   VAL   8           HA       VAL   8  -9.140  -9.971   2.220
    3    HB   VAL   8           HB       VAL   8 -10.587 -10.693  -0.340
    4   HG11  VAL   8          HG11      VAL   8  -8.278  -8.840   0.237
    5   HG13  VAL   8          HG12      VAL   8  -9.680  -8.570  -0.800
    6   HG12  VAL   8          HG13      VAL   8  -8.399  -9.665  -1.318
    7   HG22  VAL   8          HG21      VAL   8  -9.033 -12.380  -0.589
    8   HG21  VAL   8          HG22      VAL   8  -8.883 -12.239   1.160
    9   HG23  VAL   8          HG23      VAL   8  -7.731 -11.418   0.112

  No H/Q in entry =           9
  In of MODEL   85
    1    H    MET   9           H        MET   9 -12.489  -9.641   1.052
    2    HA   MET   9           HA       MET   9 -12.470  -6.865   0.608
    3    HB2  MET   9           HB2      MET   9 -14.634  -8.809   1.387
    4    HB3  MET   9           HB3      MET   9 -14.973  -7.080   1.274
    5    HG2  MET   9           HG2      MET   9 -13.755  -7.309  -1.059
    6    HG3  MET   9           HG3      MET   9 -14.205  -9.006  -0.892
    7    HE2  MET   9           HE1      MET   9 -16.987  -7.944   1.122
    8    HE1  MET   9           HE2      MET   9 -16.493  -9.460   0.375
    9    HE3  MET   9           HE3      MET   9 -18.015  -8.711  -0.097

  No H/Q in entry =           9
  In of MODEL   85
    1    H    GLY  10           H        GLY  10 -13.108  -8.757   3.540
    2    HA3  GLY  10           HA2      GLY  10 -13.696  -6.576   5.250
    3    HA2  GLY  10           HA3      GLY  10 -13.106  -8.153   5.771

  No H/Q in entry =           3
  In of MODEL   85
    1    H    LEU  11           H        LEU  11 -10.656  -8.241   4.461
    2    HA   LEU  11           HA       LEU  11  -8.984  -6.773   6.217
    3    HB2  LEU  11           HB2      LEU  11  -8.408  -8.196   3.615
    4    HB3  LEU  11           HB3      LEU  11  -7.152  -7.467   4.614
    5    HG   LEU  11           HG       LEU  11  -9.121  -9.530   5.633
    6   HD13  LEU  11          HD11      LEU  11  -7.876 -10.751   4.076
    7   HD12  LEU  11          HD12      LEU  11  -6.940 -10.969   5.554
    8   HD11  LEU  11          HD13      LEU  11  -6.416  -9.799   4.343
    9   HD22  LEU  11          HD21      LEU  11  -8.289  -8.496   7.548
   10   HD21  LEU  11          HD22      LEU  11  -6.757  -8.071   6.787
   11   HD23  LEU  11          HD23      LEU  11  -7.056  -9.731   7.302

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  12           H        ILE  12  -9.888  -6.253   2.823
    2    HA   ILE  12           HA       ILE  12  -8.234  -3.996   2.392
    3    HB   ILE  12           HB       ILE  12 -10.869  -4.730   1.094
    4   HG12  ILE  12          HG12      ILE  12  -8.796  -6.326   1.015
    5   HG13  ILE  12          HG13      ILE  12  -9.648  -5.976  -0.475
    6   HG21  ILE  12          HG21      ILE  12  -8.704  -2.765   0.281
    7   HG23  ILE  12          HG22      ILE  12 -10.386  -2.394   0.637
    8   HG22  ILE  12          HG23      ILE  12  -9.968  -3.324  -0.773
    9   HD12  ILE  12          HD11      ILE  12  -7.151  -5.863  -0.666
   10   HD11  ILE  12          HD12      ILE  12  -7.169  -4.522   0.477
   11   HD13  ILE  12          HD13      ILE  12  -7.944  -4.355  -1.080

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  13           H        ILE  13 -11.592  -4.317   3.479
    2    HA   ILE  13           HA       ILE  13 -12.101  -1.538   3.738
    3    HB   ILE  13           HB       ILE  13 -13.265  -3.974   5.108
    4   HG12  ILE  13          HG12      ILE  13 -13.485  -3.396   2.556
    5   HG13  ILE  13          HG13      ILE  13 -14.878  -3.963   3.453
    6   HG23  ILE  13          HG21      ILE  13 -13.869  -2.358   6.660
    7   HG22  ILE  13          HG22      ILE  13 -15.214  -2.223   5.536
    8   HG21  ILE  13          HG23      ILE  13 -13.894  -1.058   5.472
    9   HD12  ILE  13          HD11      ILE  13 -15.315  -1.929   2.000
   10   HD11  ILE  13          HD12      ILE  13 -14.247  -1.050   3.075
   11   HD13  ILE  13          HD13      ILE  13 -15.728  -1.731   3.706

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ASN  14           H        ASN  14 -10.951  -4.000   6.024
    2    HA   ASN  14           HA       ASN  14 -10.784  -2.351   8.304
    3    HB2  ASN  14           HB2      ASN  14 -10.484  -4.955   7.992
    4    HB3  ASN  14           HB3      ASN  14  -8.782  -4.537   7.838
    5   HD21  ASN  14          HD21      ASN  14  -9.396  -6.065  10.017
    6   HD22  ASN  14          HD22      ASN  14  -9.388  -5.140  11.439

  No H/Q in entry =           6
  In of MODEL   85
    1    H    SER  15           H        SER  15  -8.362  -3.140   5.821
    2    HA   SER  15           HA       SER  15  -6.249  -1.604   6.892
    3    HB2  SER  15           HB2      SER  15  -5.221  -1.806   4.735
    4    HB3  SER  15           HB3      SER  15  -6.146  -3.285   4.967
    5    HG   SER  15           HG       SER  15  -6.862  -2.662   3.055

  No H/Q in entry =           5
  In of MODEL   85
    1    H    GLY  16           H        GLY  16  -8.861  -0.794   4.636
    2    HA3  GLY  16           HA2      GLY  16  -8.050   1.861   4.077
    3    HA2  GLY  16           HA3      GLY  16  -9.689   1.235   3.914

  No H/Q in entry =           3
  In of MODEL   85
    1    H    GLN  17           H        GLN  17 -10.225   0.509   6.565
    2    HA   GLN  17           HA       GLN  17 -10.982   3.004   7.695
    3    HB2  GLN  17           HB2      GLN  17 -12.180   0.905   8.189
    4    HB3  GLN  17           HB3      GLN  17 -10.762   0.301   9.046
    5    HG2  GLN  17           HG2      GLN  17 -10.912   2.192  10.626
    6    HG3  GLN  17           HG3      GLN  17 -12.332   2.791   9.773
    7   HE21  GLN  17          HE21      GLN  17 -14.260   2.159  10.735
    8   HE22  GLN  17          HE22      GLN  17 -14.481   0.733  11.631

  No H/Q in entry =           8
  In of MODEL   85
    1    H    ALA  18           H        ALA  18  -8.311   0.775   8.328
    2    HA   ALA  18           HA       ALA  18  -7.243   2.020  10.597
    3    HB2  ALA  18           HB1      ALA  18  -6.587  -0.188   9.239
    4    HB3  ALA  18           HB2      ALA  18  -5.442   0.621  10.310
    5    HB1  ALA  18           HB3      ALA  18  -5.366   0.894   8.568

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ARG  19           H        ARG  19  -6.473   2.546   7.148
    2    HA   ARG  19           HA       ARG  19  -4.616   4.632   7.574
    3    HB2  ARG  19           HB2      ARG  19  -4.916   3.477   5.382
    4    HB3  ARG  19           HB3      ARG  19  -6.474   4.286   5.198
    5    HG2  ARG  19           HG2      ARG  19  -5.389   6.480   5.261
    6    HG3  ARG  19           HG3      ARG  19  -3.825   5.726   5.572
    7    HD2  ARG  19           HD2      ARG  19  -3.956   6.305   3.226
    8    HD3  ARG  19           HD3      ARG  19  -4.007   4.545   3.378
    9    HE   ARG  19           HE       ARG  19  -6.658   5.401   3.361
   10   HH21  ARG  19          HH11      ARG  19  -7.851   5.527   1.440
   11   HH22  ARG  19          HH12      ARG  19  -7.028   5.615  -0.078
   12   HH11  ARG  19          HH21      ARG  19  -3.880   5.512   1.333
   13   HH12  ARG  19          HH22      ARG  19  -4.777   5.604  -0.138

  No H/Q in entry =          13
  In of MODEL   85
    1    H    SER  20           H        SER  20  -8.115   4.675   6.965
    2    HA   SER  20           HA       SER  20  -8.527   7.423   6.905
    3    HB2  SER  20           HB2      SER  20 -10.378   6.050   6.370
    4    HB3  SER  20           HB3      SER  20 -10.251   5.155   7.882
    5    HG   SER  20           HG       SER  20 -11.280   7.703   7.364

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LEU  21           H        LEU  21  -8.490   5.251   9.718
    2    HA   LEU  21           HA       LEU  21  -8.976   7.245  11.674
    3    HB2  LEU  21           HB2      LEU  21  -7.572   4.572  11.846
    4    HB3  LEU  21           HB3      LEU  21  -7.900   5.588  13.247
    5    HG   LEU  21           HG       LEU  21 -10.049   4.637  11.328
    6   HD13  LEU  21          HD11      LEU  21 -10.577   2.901  12.910
    7   HD12  LEU  21          HD12      LEU  21  -9.396   3.516  14.065
    8   HD11  LEU  21          HD13      LEU  21  -8.852   2.776  12.558
    9   HD22  LEU  21          HD21      LEU  21 -10.969   6.465  12.474
   10   HD21  LEU  21          HD22      LEU  21 -10.037   6.163  13.937
   11   HD23  LEU  21          HD23      LEU  21 -11.413   5.140  13.548

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ALA  22           H        ALA  22  -5.992   5.927  10.279
    2    HA   ALA  22           HA       ALA  22  -4.144   7.285  11.901
    3    HB2  ALA  22           HB1      ALA  22  -3.686   5.434  10.218
    4    HB1  ALA  22           HB2      ALA  22  -2.517   6.754  10.251
    5    HB3  ALA  22           HB3      ALA  22  -3.730   6.681   8.972

  No H/Q in entry =           5
  In of MODEL   85
    1    H    TYR  23           H        TYR  23  -5.473   8.262   8.711
    2    HA   TYR  23           HA       TYR  23  -4.189  10.785   8.635
    3    HB2  TYR  23           HB2      TYR  23  -5.246   9.844   6.643
    4    HB3  TYR  23           HB3      TYR  23  -6.828   9.921   7.420
    5    HD1  TYR  23           HD1      TYR  23  -3.959  12.029   6.294
    6    HD2  TYR  23           HD2      TYR  23  -8.115  11.896   7.365
    7    HE1  TYR  23           HE1      TYR  23  -4.230  14.370   5.524
    8    HE2  TYR  23           HE2      TYR  23  -8.388  14.238   6.594
    9    HH   TYR  23           HH       TYR  23  -7.142  16.177   6.134

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ALA  24           H        ALA  24  -7.291   9.749  10.010
    2    HA   ALA  24           HA       ALA  24  -8.183  12.324  10.768
    3    HB1  ALA  24           HB1      ALA  24  -9.977  11.037  11.236
    4    HB2  ALA  24           HB2      ALA  24  -9.143  10.488  12.688
    5    HB3  ALA  24           HB3      ALA  24  -8.995   9.574  11.189

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ALA  25           H        ALA  25  -6.135   9.914  12.357
    2    HA   ALA  25           HA       ALA  25  -5.830  11.182  14.855
    3    HB2  ALA  25           HB1      ALA  25  -5.013   8.844  14.046
    4    HB3  ALA  25           HB2      ALA  25  -4.019   9.727  15.206
    5    HB1  ALA  25           HB3      ALA  25  -3.578   9.713  13.498

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LEU  26           H        LEU  26  -4.038  11.507  11.819
    2    HA   LEU  26           HA       LEU  26  -2.119  13.370  12.733
    3    HB2  LEU  26           HB2      LEU  26  -1.788  12.217  10.635
    4    HB3  LEU  26           HB3      LEU  26  -3.274  12.892   9.973
    5    HG   LEU  26           HG       LEU  26  -2.307  15.163  10.103
    6   HD12  LEU  26          HD11      LEU  26   0.230  15.236  10.523
    7   HD11  LEU  26          HD12      LEU  26   0.037  13.654  11.273
    8   HD13  LEU  26          HD13      LEU  26  -0.801  15.055  11.942
    9   HD21  LEU  26          HD21      LEU  26  -0.518  13.139   8.720
   10   HD23  LEU  26          HD22      LEU  26  -0.595  14.858   8.343
   11   HD22  LEU  26          HD23      LEU  26  -1.997  13.830   8.055

  No H/Q in entry =          11
  In of MODEL   85
    1    H    LYS  27           H        LYS  27  -5.307  13.782  11.245
    2    HA   LYS  27           HA       LYS  27  -5.308  16.570  11.036
    3    HB2  LYS  27           HB2      LYS  27  -7.019  15.054  10.052
    4    HB3  LYS  27           HB3      LYS  27  -7.674  14.790  11.667
    5    HG2  LYS  27           HG2      LYS  27  -8.153  17.188  11.893
    6    HG3  LYS  27           HG3      LYS  27  -7.447  17.493  10.303
    7    HD2  LYS  27           HD2      LYS  27  -9.147  16.020   9.267
    8    HD3  LYS  27           HD3      LYS  27  -9.860  15.732  10.856
    9    HE2  LYS  27           HE2      LYS  27 -10.352  18.135  11.089
   10    HE3  LYS  27           HE3      LYS  27  -9.611  18.445   9.515
   11    HZ3  LYS  27           HZ1      LYS  27 -11.985  18.271   9.267
   12    HZ2  LYS  27           HZ2      LYS  27 -12.005  16.757  10.043
   13    HZ1  LYS  27           HZ3      LYS  27 -11.259  16.930   8.522

  No H/Q in entry =          13
  In of MODEL   85
    1    H    GLN  28           H        GLN  28  -6.162  14.477  13.769
    2    HA   GLN  28           HA       GLN  28  -7.102  16.469  15.535
    3    HB2  GLN  28           HB2      GLN  28  -5.657  13.863  16.082
    4    HB3  GLN  28           HB3      GLN  28  -6.400  14.861  17.333
    5    HG2  GLN  28           HG2      GLN  28  -8.583  14.649  16.229
    6    HG3  GLN  28           HG3      GLN  28  -7.853  13.684  14.947
    7   HE21  GLN  28          HE21      GLN  28  -9.966  12.724  16.727
    8   HE22  GLN  28          HE22      GLN  28  -9.314  11.436  17.620

  No H/Q in entry =           8
  In of MODEL   85
    1    H    ALA  29           H        ALA  29  -3.856  15.233  14.859
    2    HA   ALA  29           HA       ALA  29  -2.451  16.666  16.836
    3    HB1  ALA  29           HB1      ALA  29  -0.504  16.008  15.725
    4    HB3  ALA  29           HB2      ALA  29  -1.257  16.112  14.133
    5    HB2  ALA  29           HB3      ALA  29  -1.656  14.775  15.212

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LYS  30           H        LYS  30  -3.316  17.517  13.501
    2    HA   LYS  30           HA       LYS  30  -1.950  19.981  13.395
    3    HB2  LYS  30           HB2      LYS  30  -4.461  19.057  11.983
    4    HB3  LYS  30           HB3      LYS  30  -3.654  20.585  11.636
    5    HG2  LYS  30           HG2      LYS  30  -1.560  19.327  11.132
    6    HG3  LYS  30           HG3      LYS  30  -2.441  17.816  11.380
    7    HD2  LYS  30           HD2      LYS  30  -4.011  18.423   9.579
    8    HD3  LYS  30           HD3      LYS  30  -3.154  19.945   9.333
    9    HE2  LYS  30           HE2      LYS  30  -1.098  18.685   8.763
   10    HE3  LYS  30           HE3      LYS  30  -1.974  17.168   8.979
   11    HZ2  LYS  30           HZ1      LYS  30  -1.807  18.033   6.634
   12    HZ1  LYS  30           HZ2      LYS  30  -2.873  19.279   7.095
   13    HZ3  LYS  30           HZ3      LYS  30  -3.370  17.654   7.171

  No H/Q in entry =          13
  In of MODEL   85
    1    H    GLN  31           H        GLN  31  -5.039  19.082  14.803
    2    HA   GLN  31           HA       GLN  31  -5.849  21.827  15.243
    3    HB2  GLN  31           HB2      GLN  31  -6.991  19.367  16.572
    4    HB3  GLN  31           HB3      GLN  31  -7.776  20.925  16.319
    5    HG2  GLN  31           HG2      GLN  31  -7.047  20.150  13.733
    6    HG3  GLN  31           HG3      GLN  31  -7.549  18.640  14.485
    7   HE21  GLN  31          HE21      GLN  31  -8.979  20.183  12.374
    8   HE22  GLN  31          HE22      GLN  31 -10.501  20.552  13.027

  No H/Q in entry =           8
  In of MODEL   85
    1    H    GLY  32           H        GLY  32  -3.509  19.943  16.575
    2    HA3  GLY  32           HA2      GLY  32  -2.120  20.433  18.379
    3    HA2  GLY  32           HA3      GLY  32  -3.270  21.660  18.896

  No H/Q in entry =           3
  In of MODEL   85
    1    H    ASP  33           H        ASP  33  -4.642  18.596  18.241
    2    HA   ASP  33           HA       ASP  33  -5.052  18.141  21.122
    3    HB2  ASP  33           HB2      ASP  33  -6.437  17.099  18.645
    4    HB3  ASP  33           HB3      ASP  33  -6.776  16.489  20.262

  No H/Q in entry =           4
  In of MODEL   85
    1    H    PHE  34           H        PHE  34  -2.871  17.326  21.435
    2    HA   PHE  34           HA       PHE  34  -1.832  15.088  20.044
    3    HB2  PHE  34           HB2      PHE  34  -1.237  16.092  22.836
    4    HB3  PHE  34           HB3      PHE  34  -0.287  14.881  21.975
    5    HD1  PHE  34           HD1      PHE  34  -0.515  18.306  22.698
    6    HD2  PHE  34           HD2      PHE  34   0.365  15.605  19.474
    7    HE1  PHE  34           HE1      PHE  34   0.755  20.093  21.541
    8    HE2  PHE  34           HE2      PHE  34   1.630  17.396  18.322
    9    HZ   PHE  34           HZ       PHE  34   1.826  19.637  19.360

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ALA  35           H        ALA  35  -3.882  15.343  22.901
    2    HA   ALA  35           HA       ALA  35  -3.630  12.687  23.807
    3    HB3  ALA  35           HB1      ALA  35  -6.100  13.277  24.657
    4    HB1  ALA  35           HB2      ALA  35  -5.591  14.902  24.197
    5    HB2  ALA  35           HB3      ALA  35  -4.665  13.997  25.393

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ALA  36           H        ALA  36  -6.099  14.158  21.697
    2    HA   ALA  36           HA       ALA  36  -7.475  11.723  21.224
    3    HB1  ALA  36           HB1      ALA  36  -8.951  13.120  20.261
    4    HB3  ALA  36           HB2      ALA  36  -7.783  13.554  19.013
    5    HB2  ALA  36           HB3      ALA  36  -7.825  14.446  20.533

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ALA  37           H        ALA  37  -4.817  13.347  19.556
    2    HA   ALA  37           HA       ALA  37  -4.751  11.705  17.264
    3    HB3  ALA  37           HB1      ALA  37  -2.789  13.453  18.686
    4    HB2  ALA  37           HB2      ALA  37  -3.316  13.495  17.005
    5    HB1  ALA  37           HB3      ALA  37  -2.145  12.285  17.532

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LYS  38           H        LYS  38  -2.996  11.436  20.347
    2    HA   LYS  38           HA       LYS  38  -1.632   9.056  19.868
    3    HB2  LYS  38           HB2      LYS  38  -1.987  10.820  22.008
    4    HB3  LYS  38           HB3      LYS  38  -2.583   9.283  22.628
    5    HG2  LYS  38           HG2      LYS  38  -0.471   8.194  22.099
    6    HG3  LYS  38           HG3      LYS  38   0.117   9.646  21.282
    7    HD2  LYS  38           HD2      LYS  38   0.262  10.874  23.314
    8    HD3  LYS  38           HD3      LYS  38  -0.740   9.710  24.182
    9    HE2  LYS  38           HE2      LYS  38   1.618   9.433  24.807
   10    HE3  LYS  38           HE3      LYS  38   1.038   8.005  23.946
   11    HZ3  LYS  38           HZ1      LYS  38   2.336   8.439  22.167
   12    HZ2  LYS  38           HZ2      LYS  38   3.275   9.286  23.303
   13    HZ1  LYS  38           HZ3      LYS  38   2.185  10.125  22.306

  No H/Q in entry =          13
  In of MODEL   85
    1    H    ALA  39           H        ALA  39  -4.881   9.504  21.263
    2    HA   ALA  39           HA       ALA  39  -5.399   6.778  21.775
    3    HB3  ALA  39           HB1      ALA  39  -7.587   8.686  20.997
    4    HB2  ALA  39           HB2      ALA  39  -6.696   8.932  22.499
    5    HB1  ALA  39           HB3      ALA  39  -7.588   7.433  22.238

  No H/Q in entry =           5
  In of MODEL   85
    1    H    MET  40           H        MET  40  -6.010   8.773  18.920
    2    HA   MET  40           HA       MET  40  -7.452   6.813  17.463
    3    HB2  MET  40           HB2      MET  40  -5.878   9.231  16.554
    4    HB3  MET  40           HB3      MET  40  -6.887   8.252  15.485
    5    HG2  MET  40           HG2      MET  40  -7.947   9.492  18.037
    6    HG3  MET  40           HG3      MET  40  -8.014  10.321  16.484
    7    HE3  MET  40           HE1      MET  40 -10.567   8.654  14.419
    8    HE2  MET  40           HE2      MET  40  -8.816   8.799  14.274
    9    HE1  MET  40           HE3      MET  40  -9.757  10.152  14.901

  No H/Q in entry =           9
  In of MODEL   85
    1    H    MET  41           H        MET  41  -3.973   7.607  17.591
    2    HA   MET  41           HA       MET  41  -3.182   5.858  15.497
    3    HB2  MET  41           HB2      MET  41  -1.582   6.559  17.972
    4    HB3  MET  41           HB3      MET  41  -0.951   5.916  16.460
    5    HG2  MET  41           HG2      MET  41  -2.140   8.077  15.446
    6    HG3  MET  41           HG3      MET  41  -1.917   8.673  17.089
    7    HE2  MET  41           HE1      MET  41   1.034   6.624  17.464
    8    HE1  MET  41           HE2      MET  41   0.222   7.907  18.356
    9    HE3  MET  41           HE3      MET  41   1.843   8.175  17.716

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ASP  42           H        ASP  42  -3.567   5.390  18.984
    2    HA   ASP  42           HA       ASP  42  -2.489   2.814  19.155
    3    HB2  ASP  42           HB2      ASP  42  -3.396   4.564  20.970
    4    HB3  ASP  42           HB3      ASP  42  -4.806   3.515  20.897

  No H/Q in entry =           4
  In of MODEL   85
    1    H    GLN  43           H        GLN  43  -5.839   3.861  18.643
    2    HA   GLN  43           HA       GLN  43  -6.939   1.254  18.454
    3    HB2  GLN  43           HB2      GLN  43  -7.904   3.887  17.315
    4    HB3  GLN  43           HB3      GLN  43  -8.842   2.392  17.295
    5    HG2  GLN  43           HG2      GLN  43  -8.552   2.284  19.804
    6    HG3  GLN  43           HG3      GLN  43  -7.854   3.900  19.729
    7   HE21  GLN  43          HE21      GLN  43 -10.038   3.948  21.224
    8   HE22  GLN  43          HE22      GLN  43 -11.406   4.499  20.388

  No H/Q in entry =           8
  In of MODEL   85
    1    H    SER  44           H        SER  44  -5.630   3.483  16.038
    2    HA   SER  44           HA       SER  44  -6.301   1.980  13.752
    3    HB2  SER  44           HB2      SER  44  -5.086   4.385  14.192
    4    HB3  SER  44           HB3      SER  44  -3.714   3.411  13.668
    5    HG   SER  44           HG       SER  44  -4.838   4.359  11.899

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ARG  45           H        ARG  45  -3.427   1.921  15.840
    2    HA   ARG  45           HA       ARG  45  -1.912  -0.012  14.467
    3    HB2  ARG  45           HB2      ARG  45  -1.098   1.428  16.333
    4    HB3  ARG  45           HB3      ARG  45  -2.077   0.485  17.454
    5    HG2  ARG  45           HG2      ARG  45  -0.809  -1.555  16.821
    6    HG3  ARG  45           HG3      ARG  45   0.193  -0.587  15.742
    7    HD2  ARG  45           HD2      ARG  45   0.900   0.812  17.695
    8    HD3  ARG  45           HD3      ARG  45  -0.007  -0.275  18.770
    9    HE   ARG  45           HE       ARG  45   1.722  -1.847  17.198
   10   HH21  ARG  45          HH11      ARG  45   3.634  -2.636  18.042
   11   HH22  ARG  45          HH12      ARG  45   4.390  -1.833  19.373
   12   HH11  ARG  45          HH21      ARG  45   1.978   0.631  19.581
   13   HH12  ARG  45          HH22      ARG  45   3.452   0.019  20.242

  No H/Q in entry =          13
  In of MODEL   85
    1    H    MET  46           H        MET  46  -4.310  -0.365  17.062
    2    HA   MET  46           HA       MET  46  -4.097  -3.160  17.378
    3    HB2  MET  46           HB2      MET  46  -6.292  -1.182  17.972
    4    HB3  MET  46           HB3      MET  46  -6.487  -2.905  18.304
    5    HG2  MET  46           HG2      MET  46  -4.500  -2.887  19.730
    6    HG3  MET  46           HG3      MET  46  -4.211  -1.196  19.350
    7    HE1  MET  46           HE1      MET  46  -6.281  -3.847  20.805
    8    HE3  MET  46           HE2      MET  46  -7.788  -3.062  20.340
    9    HE2  MET  46           HE3      MET  46  -7.324  -3.126  22.038

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ALA  47           H        ALA  47  -6.144  -1.182  15.272
    2    HA   ALA  47           HA       ALA  47  -7.726  -3.262  14.208
    3    HB3  ALA  47           HB1      ALA  47  -8.441  -1.037  13.784
    4    HB1  ALA  47           HB2      ALA  47  -7.937  -1.667  12.216
    5    HB2  ALA  47           HB3      ALA  47  -6.877  -0.579  13.112

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LEU  48           H        LEU  48  -4.626  -1.907  13.162
    2    HA   LEU  48           HA       LEU  48  -4.314  -3.499  10.826
    3    HB2  LEU  48           HB2      LEU  48  -2.281  -2.183  12.636
    4    HB3  LEU  48           HB3      LEU  48  -1.897  -2.903  11.072
    5    HG   LEU  48           HG       LEU  48  -3.955  -0.716  11.450
    6   HD13  LEU  48          HD11      LEU  48  -1.849   0.195  12.118
    7   HD12  LEU  48          HD12      LEU  48  -2.129   0.740  10.464
    8   HD11  LEU  48          HD13      LEU  48  -1.011  -0.589  10.779
    9   HD22  LEU  48          HD21      LEU  48  -4.406  -1.713   9.375
   10   HD21  LEU  48          HD22      LEU  48  -2.716  -2.123   9.086
   11   HD23  LEU  48          HD23      LEU  48  -3.260  -0.453   8.920

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ASN  49           H        ASN  49  -3.271  -3.871  14.176
    2    HA   ASN  49           HA       ASN  49  -1.634  -6.110  13.856
    3    HB2  ASN  49           HB2      ASN  49  -1.690  -4.766  15.899
    4    HB3  ASN  49           HB3      ASN  49  -3.339  -5.284  16.222
    5   HD21  ASN  49          HD21      ASN  49  -1.362  -5.764  18.143
    6   HD22  ASN  49          HD22      ASN  49  -1.032  -7.427  18.216

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLU  50           H        GLU  50  -5.108  -5.885  14.517
    2    HA   GLU  50           HA       GLU  50  -5.579  -8.691  14.632
    3    HB2  GLU  50           HB2      GLU  50  -7.192  -7.025  15.499
    4    HB3  GLU  50           HB3      GLU  50  -7.489  -6.469  13.850
    5    HG2  GLU  50           HG2      GLU  50  -8.320  -8.679  13.216
    6    HG3  GLU  50           HG3      GLU  50  -7.934  -9.313  14.812

  No H/Q in entry =           6
  In of MODEL   85
    1    H    ALA  51           H        ALA  51  -5.675  -6.301  12.030
    2    HA   ALA  51           HA       ALA  51  -6.630  -8.048  10.010
    3    HB2  ALA  51           HB1      ALA  51  -6.432  -6.236   8.636
    4    HB1  ALA  51           HB2      ALA  51  -4.799  -5.863   9.188
    5    HB3  ALA  51           HB3      ALA  51  -6.192  -5.368  10.151

  No H/Q in entry =           5
  In of MODEL   85
    1    H    HIS  52           H        HIS  52  -3.355  -7.092  11.000
    2    HA   HIS  52           HA       HIS  52  -1.930  -8.567   9.058
    3    HB2  HIS  52           HB2      HIS  52  -0.919  -6.817  10.491
    4    HB3  HIS  52           HB3      HIS  52  -1.086  -7.882  11.885
    5    HD1  HIS  52           HD1      HIS  52   0.361 -10.099  11.868
    6    HD2  HIS  52           HD2      HIS  52   1.256  -7.409   8.811
    7    HE1  HIS  52           HE1      HIS  52   2.585 -10.829  10.900
    8    HE2  HIS  52           HE2      HIS  52   3.143  -9.199   9.034

  No H/Q in entry =           8
  In of MODEL   85
    1    H    LEU  53           H        LEU  53  -3.139  -9.453  12.270
    2    HA   LEU  53           HA       LEU  53  -1.907 -11.980  12.474
    3    HB2  LEU  53           HB2      LEU  53  -4.407 -10.824  13.680
    4    HB3  LEU  53           HB3      LEU  53  -3.937 -12.496  13.973
    5    HG   LEU  53           HG       LEU  53  -2.068 -10.154  14.462
    6   HD13  LEU  53          HD11      LEU  53  -2.657 -10.369  16.840
    7   HD12  LEU  53          HD12      LEU  53  -3.833 -11.623  16.444
    8   HD11  LEU  53          HD13      LEU  53  -4.085  -9.972  15.891
    9   HD22  LEU  53          HD21      LEU  53  -0.738 -12.095  14.420
   10   HD21  LEU  53          HD22      LEU  53  -2.026 -13.105  15.068
   11   HD23  LEU  53          HD23      LEU  53  -1.161 -12.007  16.126

  No H/Q in entry =          11
  In of MODEL   85
    1    H    VAL  54           H        VAL  54  -5.028 -10.995  11.100
    2    HA   VAL  54           HA       VAL  54  -5.906 -13.603  10.417
    3    HB   VAL  54           HB       VAL  54  -6.585 -10.882   9.273
    4   HG12  VAL  54          HG11      VAL  54  -8.666 -12.289   8.459
    5   HG11  VAL  54          HG12      VAL  54  -7.537 -13.640   8.538
    6   HG13  VAL  54          HG13      VAL  54  -7.192 -12.264   7.494
    7   HG22  VAL  54          HG21      VAL  54  -7.497 -10.926  11.422
    8   HG21  VAL  54          HG22      VAL  54  -7.729 -12.672  11.407
    9   HG23  VAL  54          HG23      VAL  54  -8.821 -11.632  10.495

  No H/Q in entry =           9
  In of MODEL   85
    1    H    GLN  55           H        GLN  55  -4.061 -11.133   8.627
    2    HA   GLN  55           HA       GLN  55  -3.905 -12.601   6.214
    3    HB2  GLN  55           HB2      GLN  55  -3.329 -10.330   6.019
    4    HB3  GLN  55           HB3      GLN  55  -2.222 -10.389   7.388
    5    HG2  GLN  55           HG2      GLN  55  -0.490 -11.216   6.119
    6    HG3  GLN  55           HG3      GLN  55  -1.548 -12.207   5.124
    7   HE21  GLN  55          HE21      GLN  55  -1.568 -11.523   3.001
    8   HE22  GLN  55          HE22      GLN  55  -1.389  -9.918   2.487

  No H/Q in entry =           8
  In of MODEL   85
    1    H    THR  56           H        THR  56  -1.808 -12.546   9.100
    2    HA   THR  56           HA       THR  56   0.293 -14.121   8.193
    3    HB   THR  56           HB       THR  56  -0.954 -14.379  10.938
    4    HG1  THR  56           HG1      THR  56  -0.631 -12.199  10.414
    5   HG21  THR  56          HG21      THR  56   0.985 -15.891  10.065
    6   HG23  THR  56          HG22      THR  56   1.153 -15.124  11.644
    7   HG22  THR  56          HG23      THR  56   1.970 -14.440  10.238

  No H/Q in entry =           7
  In of MODEL   85
    1    H    LYS  57           H        LYS  57  -2.818 -15.193   9.550
    2    HA   LYS  57           HA       LYS  57  -2.337 -17.983   9.313
    3    HB2  LYS  57           HB2      LYS  57  -4.171 -16.920  10.653
    4    HB3  LYS  57           HB3      LYS  57  -4.962 -16.469   9.150
    5    HG2  LYS  57           HG2      LYS  57  -5.175 -18.834   8.526
    6    HG3  LYS  57           HG3      LYS  57  -4.348 -19.312  10.006
    7    HD2  LYS  57           HD2      LYS  57  -6.159 -18.313  11.352
    8    HD3  LYS  57           HD3      LYS  57  -6.988 -17.814   9.878
    9    HE2  LYS  57           HE2      LYS  57  -7.969 -19.907  10.714
   10    HE3  LYS  57           HE3      LYS  57  -7.144 -20.218   9.188
   11    HZ3  LYS  57           HZ1      LYS  57  -5.327 -21.170  10.295
   12    HZ2  LYS  57           HZ2      LYS  57  -6.702 -21.826  11.049
   13    HZ1  LYS  57           HZ3      LYS  57  -5.824 -20.585  11.810

  No H/Q in entry =          13
  In of MODEL   85
    1    H    LEU  58           H        LEU  58  -3.691 -15.563   7.127
    2    HA   LEU  58           HA       LEU  58  -4.465 -17.403   5.123
    3    HB2  LEU  58           HB2      LEU  58  -3.894 -14.448   4.982
    4    HB3  LEU  58           HB3      LEU  58  -4.542 -15.397   3.642
    5    HG   LEU  58           HG       LEU  58  -5.832 -15.225   6.385
    6   HD11  LEU  58          HD11      LEU  58  -6.145 -13.589   3.889
    7   HD13  LEU  58          HD12      LEU  58  -6.146 -13.076   5.576
    8   HD12  LEU  58          HD13      LEU  58  -7.557 -13.889   4.902
    9   HD22  LEU  58          HD21      LEU  58  -6.769 -17.148   5.518
   10   HD21  LEU  58          HD22      LEU  58  -6.430 -16.697   3.847
   11   HD23  LEU  58          HD23      LEU  58  -7.805 -15.985   4.692

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  59           H        ILE  59  -1.347 -16.152   5.990
    2    HA   ILE  59           HA       ILE  59  -0.233 -16.874   3.359
    3    HB   ILE  59           HB       ILE  59   0.506 -14.793   4.921
    4   HG12  ILE  59          HG12      ILE  59   2.643 -16.414   3.528
    5   HG13  ILE  59          HG13      ILE  59   1.425 -15.536   2.640
    6   HG23  ILE  59          HG21      ILE  59   2.329 -15.247   6.340
    7   HG22  ILE  59          HG22      ILE  59   2.628 -16.817   5.629
    8   HG21  ILE  59          HG23      ILE  59   1.247 -16.571   6.696
    9   HD11  ILE  59          HD11      ILE  59   2.085 -13.455   3.865
   10   HD13  ILE  59          HD12      ILE  59   3.371 -14.109   2.853
   11   HD12  ILE  59          HD13      ILE  59   3.403 -14.368   4.598

  No H/Q in entry =          11
  In of MODEL   85
    1    H    GLU  60           H        GLU  60  -0.241 -17.970   6.730
    2    HA   GLU  60           HA       GLU  60   1.815 -19.924   6.477
    3    HB2  GLU  60           HB2      GLU  60   1.024 -19.136   8.662
    4    HB3  GLU  60           HB3      GLU  60  -0.563 -19.837   8.354
    5    HG2  GLU  60           HG2      GLU  60   0.444 -22.086   8.235
    6    HG3  GLU  60           HG3      GLU  60   2.038 -21.389   8.522

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLY  61           H        GLY  61  -1.693 -20.066   5.980
    2    HA3  GLY  61           HA2      GLY  61  -1.408 -22.858   5.031
    3    HA2  GLY  61           HA3      GLY  61  -2.904 -22.139   5.617

  No H/Q in entry =           3
  In of MODEL   85
    1    H    ASP  62           H        ASP  62  -0.685 -20.542   3.416
    2    HA   ASP  62           HA       ASP  62  -2.733 -19.900   1.566
    3    HB2  ASP  62           HB2      ASP  62  -0.687 -18.548   1.939
    4    HB3  ASP  62           HB3      ASP  62   0.269 -19.828   1.200

  No H/Q in entry =           4
  In of MODEL   85
    1    H    ALA  63           H        ALA  63  -3.107 -22.572   1.674
    2    HA   ALA  63           HA       ALA  63  -1.622 -24.132  -0.194
    3    HB2  ALA  63           HB1      ALA  63  -2.878 -25.399   1.293
    4    HB1  ALA  63           HB2      ALA  63  -3.811 -25.507  -0.200
    5    HB3  ALA  63           HB3      ALA  63  -4.322 -24.406   1.080

  No H/Q in entry =           5
  In of MODEL   85
    1    H    GLY  64           H        GLY  64  -4.522 -22.127  -0.427
    2    HA3  GLY  64           HA2      GLY  64  -5.624 -21.212  -2.219
    3    HA2  GLY  64           HA3      GLY  64  -4.175 -21.512  -3.166

  No H/Q in entry =           3
  In of MODEL   85
    1    H    GLU  65           H        GLU  65  -4.861 -22.478  -5.010
    2    HA   GLU  65           HA       GLU  65  -7.170 -24.102  -5.158
    3    HB2  GLU  65           HB2      GLU  65  -4.860 -23.745  -7.063
    4    HB3  GLU  65           HB3      GLU  65  -6.297 -24.697  -7.437
    5    HG2  GLU  65           HG2      GLU  65  -7.724 -22.741  -7.082
    6    HG3  GLU  65           HG3      GLU  65  -6.323 -21.779  -6.621

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLY  66           H        GLY  66  -3.777 -24.864  -4.922
    2    HA3  GLY  66           HA2      GLY  66  -4.349 -27.541  -3.958
    3    HA2  GLY  66           HA3      GLY  66  -3.428 -27.451  -5.447

  No H/Q in entry =           3
  In of MODEL   85
    1    H    LYS  67           H        LYS  67  -1.562 -28.301  -4.717
    2    HA   LYS  67           HA       LYS  67  -0.325 -27.772  -2.262
    3    HB2  LYS  67           HB2      LYS  67   0.768 -28.840  -4.861
    4    HB3  LYS  67           HB3      LYS  67   1.679 -28.819  -3.345
    5    HG2  LYS  67           HG2      LYS  67  -0.119 -30.105  -2.243
    6    HG3  LYS  67           HG3      LYS  67  -1.024 -30.136  -3.754
    7    HD2  LYS  67           HD2      LYS  67   0.815 -31.380  -4.832
    8    HD3  LYS  67           HD3      LYS  67   1.716 -31.356  -3.314
    9    HE2  LYS  67           HE2      LYS  67  -0.102 -32.590  -2.202
   10    HE3  LYS  67           HE3      LYS  67  -1.020 -32.602  -3.707
   11    HZ1  LYS  67           HZ1      LYS  67   1.563 -33.567  -4.212
   12    HZ3  LYS  67           HZ2      LYS  67   0.083 -34.390  -4.343
   13    HZ2  LYS  67           HZ3      LYS  67   0.939 -34.404  -2.876

  No H/Q in entry =          13
  In of MODEL   85
    1    H    MET  68           H        MET  68   1.338 -27.018  -5.238
    2    HA   MET  68           HA       MET  68   2.932 -24.961  -4.157
    3    HB2  MET  68           HB2      MET  68   2.354 -25.915  -6.944
    4    HB3  MET  68           HB3      MET  68   3.406 -24.530  -6.649
    5    HG2  MET  68           HG2      MET  68   3.783 -27.234  -5.336
    6    HG3  MET  68           HG3      MET  68   4.628 -26.732  -6.803
    7    HE2  MET  68           HE1      MET  68   7.374 -26.744  -4.381
    8    HE1  MET  68           HE2      MET  68   6.092 -27.794  -4.983
    9    HE3  MET  68           HE3      MET  68   6.032 -27.205  -3.324

  No H/Q in entry =           9
  In of MODEL   85
    1    H    LYS  69           H        LYS  69  -0.019 -24.803  -6.140
    2    HA   LYS  69           HA       LYS  69   0.010 -22.098  -6.734
    3    HB2  LYS  69           HB2      LYS  69  -1.682 -24.138  -7.289
    4    HB3  LYS  69           HB3      LYS  69  -2.673 -23.138  -6.222
    5    HG2  LYS  69           HG2      LYS  69  -1.285 -22.309  -8.777
    6    HG3  LYS  69           HG3      LYS  69  -3.011 -22.266  -8.420
    7    HD2  LYS  69           HD2      LYS  69  -2.310 -20.663  -6.477
    8    HD3  LYS  69           HD3      LYS  69  -0.831 -20.457  -7.418
    9    HE2  LYS  69           HE2      LYS  69  -2.560 -20.126  -9.412
   10    HE3  LYS  69           HE3      LYS  69  -3.634 -19.661  -8.094
   11    HZ2  LYS  69           HZ1      LYS  69  -1.040 -18.448  -8.842
   12    HZ1  LYS  69           HZ2      LYS  69  -1.785 -18.155  -7.345
   13    HZ3  LYS  69           HZ3      LYS  69  -2.563 -17.704  -8.786

  No H/Q in entry =          13
  In of MODEL   85
    1    H    VAL  70           H        VAL  70  -0.211 -20.262  -5.675
    2    HA   VAL  70           HA       VAL  70  -1.275 -20.296  -2.914
    3    HB   VAL  70           HB       VAL  70  -0.141 -17.996  -2.844
    4   HG13  VAL  70          HG11      VAL  70   0.862 -19.912  -1.746
    5   HG12  VAL  70          HG12      VAL  70   2.136 -19.028  -2.590
    6   HG11  VAL  70          HG13      VAL  70   1.486 -20.515  -3.282
    7   HG22  VAL  70          HG21      VAL  70   1.432 -17.411  -4.550
    8   HG21  VAL  70          HG22      VAL  70  -0.014 -17.917  -5.421
    9   HG23  VAL  70          HG23      VAL  70   1.355 -19.016  -5.280

  No H/Q in entry =           9
  In of MODEL   85
    1    H    SER  71           H        SER  71  -2.813 -18.796  -2.283
    2    HA   SER  71           HA       SER  71  -4.840 -18.106  -4.124
    3    HB2  SER  71           HB2      SER  71  -5.135 -18.358  -1.619
    4    HB3  SER  71           HB3      SER  71  -4.319 -16.811  -1.425
    5    HG   SER  71           HG       SER  71  -6.858 -17.400  -2.351

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LEU  72           H        LEU  72  -4.981 -16.500  -5.503
    2    HA   LEU  72           HA       LEU  72  -2.895 -14.663  -5.984
    3    HB2  LEU  72           HB2      LEU  72  -5.757 -14.754  -6.936
    4    HB3  LEU  72           HB3      LEU  72  -4.572 -13.585  -7.513
    5    HG   LEU  72           HG       LEU  72  -4.136 -16.587  -7.635
    6   HD12  LEU  72          HD11      LEU  72  -4.962 -14.771  -9.911
    7   HD11  LEU  72          HD12      LEU  72  -6.116 -15.738  -8.991
    8   HD13  LEU  72          HD13      LEU  72  -4.846 -16.531  -9.922
    9   HD22  LEU  72          HD21      LEU  72  -2.026 -15.582  -7.876
   10   HD21  LEU  72          HD22      LEU  72  -2.672 -14.163  -8.686
   11   HD23  LEU  72          HD23      LEU  72  -2.567 -15.697  -9.548

  No H/Q in entry =          11
  In of MODEL   85
    1    H    VAL  73           H        VAL  73  -5.997 -14.342  -4.362
    2    HA   VAL  73           HA       VAL  73  -6.079 -11.571  -4.017
    3    HB   VAL  73           HB       VAL  73  -7.794 -11.948  -2.437
    4   HG12  VAL  73          HG11      VAL  73  -7.878 -14.420  -4.172
    5   HG11  VAL  73          HG12      VAL  73  -8.108 -12.804  -4.837
    6   HG13  VAL  73          HG13      VAL  73  -9.229 -13.426  -3.625
    7   HG21  VAL  73          HG21      VAL  73  -6.296 -14.501  -1.958
    8   HG23  VAL  73          HG22      VAL  73  -8.033 -14.472  -1.653
    9   HG22  VAL  73          HG23      VAL  73  -6.968 -13.363  -0.789

  No H/Q in entry =           9
  In of MODEL   85
    1    H    LEU  74           H        LEU  74  -4.113 -13.910  -2.424
    2    HA   LEU  74           HA       LEU  74  -3.722 -12.759   0.097
    3    HB2  LEU  74           HB2      LEU  74  -2.909 -14.968  -0.399
    4    HB3  LEU  74           HB3      LEU  74  -1.857 -14.343  -1.669
    5    HG   LEU  74           HG       LEU  74  -0.605 -13.043   0.046
    6   HD11  LEU  74          HD11      LEU  74  -2.645 -14.360   1.835
    7   HD13  LEU  74          HD12      LEU  74  -2.141 -12.669   1.801
    8   HD12  LEU  74          HD13      LEU  74  -1.061 -13.899   2.461
    9   HD21  LEU  74          HD21      LEU  74  -0.256 -15.550  -0.661
   10   HD23  LEU  74          HD22      LEU  74  -0.729 -15.844   0.997
   11   HD22  LEU  74          HD23      LEU  74   0.679 -14.863   0.665

  No H/Q in entry =          11
  In of MODEL   85
    1    H    VAL  75           H        VAL  75  -1.831 -12.347  -2.857
    2    HA   VAL  75           HA       VAL  75  -0.061 -10.397  -1.847
    3    HB   VAL  75           HB       VAL  75  -1.004 -10.899  -4.672
    4   HG11  VAL  75          HG11      VAL  75   1.232  -9.134  -3.582
    5   HG13  VAL  75          HG12      VAL  75  -0.176  -8.604  -4.492
    6   HG12  VAL  75          HG13      VAL  75   1.056  -9.579  -5.276
    7   HG21  VAL  75          HG21      VAL  75   0.225 -12.749  -3.558
    8   HG23  VAL  75          HG22      VAL  75   1.534 -11.633  -3.170
    9   HG22  VAL  75          HG23      VAL  75   1.184 -12.030  -4.853

  No H/Q in entry =           9
  In of MODEL   85
    1    H    GLU  76           H        GLU  76  -3.212 -10.094  -3.512
    2    HA   GLU  76           HA       GLU  76  -3.301  -7.281  -3.619
    3    HB2  GLU  76           HB2      GLU  76  -4.936  -8.767  -4.775
    4    HB3  GLU  76           HB3      GLU  76  -5.599  -9.231  -3.216
    5    HG2  GLU  76           HG2      GLU  76  -6.309  -6.921  -2.791
    6    HG3  GLU  76           HG3      GLU  76  -5.608  -6.391  -4.307

  No H/Q in entry =           6
  In of MODEL   85
    1    H    ALA  77           H        ALA  77  -4.387  -9.519  -1.077
    2    HA   ALA  77           HA       ALA  77  -5.373  -7.526   0.676
    3    HB2  ALA  77           HB1      ALA  77  -5.820  -9.998   0.847
    4    HB3  ALA  77           HB2      ALA  77  -5.367  -9.233   2.370
    5    HB1  ALA  77           HB3      ALA  77  -4.185 -10.190   1.479

  No H/Q in entry =           5
  In of MODEL   85
    1    H    GLN  78           H        GLN  78  -2.205  -9.035   0.320
    2    HA   GLN  78           HA       GLN  78  -0.967  -7.854   2.570
    3    HB2  GLN  78           HB2      GLN  78  -0.077  -9.786   1.222
    4    HB3  GLN  78           HB3      GLN  78   0.345  -8.639  -0.047
    5    HG2  GLN  78           HG2      GLN  78   1.788  -7.420   1.529
    6    HG3  GLN  78           HG3      GLN  78   1.367  -8.559   2.805
    7   HE21  GLN  78          HE21      GLN  78   4.086  -8.265   1.982
    8   HE22  GLN  78          HE22      GLN  78   4.568  -9.690   1.196

  No H/Q in entry =           8
  In of MODEL   85
    1    H    LEU  79           H        LEU  79  -1.340  -6.804  -0.779
    2    HA   LEU  79           HA       LEU  79   0.318  -4.557  -0.767
    3    HB2  LEU  79           HB2      LEU  79  -0.695  -5.380  -2.821
    4    HB3  LEU  79           HB3      LEU  79  -2.304  -5.007  -2.217
    5    HG   LEU  79           HG       LEU  79  -1.789  -2.613  -2.195
    6   HD13  LEU  79          HD11      LEU  79   0.447  -2.341  -1.678
    7   HD12  LEU  79          HD12      LEU  79   0.496  -2.057  -3.418
    8   HD11  LEU  79          HD13      LEU  79   0.968  -3.628  -2.768
    9   HD23  LEU  79          HD21      LEU  79  -1.153  -2.412  -4.746
   10   HD22  LEU  79          HD22      LEU  79  -2.671  -3.178  -4.288
   11   HD21  LEU  79          HD23      LEU  79  -1.285  -4.170  -4.728

  No H/Q in entry =          11
  In of MODEL   85
    1    H    HIS  80           H        HIS  80  -3.148  -4.759   0.053
    2    HA   HIS  80           HA       HIS  80  -3.374  -2.004   0.710
    3    HB2  HIS  80           HB2      HIS  80  -5.047  -4.432   1.031
    4    HB3  HIS  80           HB3      HIS  80  -5.385  -3.094   2.132
    5    HD1  HIS  80           HD1      HIS  80  -7.020  -1.478   1.218
    6    HD2  HIS  80           HD2      HIS  80  -4.801  -3.271  -1.822
    7    HE1  HIS  80           HE1      HIS  80  -7.868  -0.496  -0.965
    8    HE2  HIS  80           HE2      HIS  80  -6.521  -1.583  -2.827

  No H/Q in entry =           8
  In of MODEL   85
    1    H    LEU  81           H        LEU  81  -2.854  -4.889   2.710
    2    HA   LEU  81           HA       LEU  81  -2.862  -3.537   5.192
    3    HB2  LEU  81           HB2      LEU  81  -1.612  -6.141   4.320
    4    HB3  LEU  81           HB3      LEU  81  -1.595  -5.578   5.992
    5    HG   LEU  81           HG       LEU  81  -4.135  -5.863   4.360
    6   HD12  LEU  81          HD11      LEU  81  -4.417  -7.929   5.912
    7   HD11  LEU  81          HD12      LEU  81  -2.666  -7.838   6.101
    8   HD13  LEU  81          HD13      LEU  81  -3.369  -8.080   4.501
    9   HD23  LEU  81          HD21      LEU  81  -4.980  -6.071   6.860
   10   HD22  LEU  81          HD22      LEU  81  -4.673  -4.480   6.168
   11   HD21  LEU  81          HD23      LEU  81  -3.479  -5.225   7.232

  No H/Q in entry =          11
  In of MODEL   85
    1    H    MET  82           H        MET  82  -0.167  -4.414   3.028
    2    HA   MET  82           HA       MET  82   1.903  -3.493   4.714
    3    HB2  MET  82           HB2      MET  82   1.697  -3.843   1.722
    4    HB3  MET  82           HB3      MET  82   3.171  -3.254   2.487
    5    HG2  MET  82           HG2      MET  82   1.792  -5.857   3.214
    6    HG3  MET  82           HG3      MET  82   3.164  -5.735   2.116
    7    HE3  MET  82           HE1      MET  82   6.168  -4.961   4.104
    8    HE2  MET  82           HE2      MET  82   5.231  -3.605   3.481
    9    HE1  MET  82           HE3      MET  82   5.338  -5.096   2.549

  No H/Q in entry =           9
  In of MODEL   85
    1    H    THR  83           H        THR  83   0.067  -1.876   2.150
    2    HA   THR  83           HA       THR  83   1.452   0.587   2.234
    3    HB   THR  83           HB       THR  83  -0.733   1.486   1.242
    4    HG1  THR  83           HG1      THR  83  -2.369   0.171   1.135
    5   HG22  THR  83          HG21      THR  83  -0.439  -0.333  -0.754
    6   HG21  THR  83          HG22      THR  83   1.063  -0.607   0.126
    7   HG23  THR  83          HG23      THR  83   0.686   1.001  -0.493

  No H/Q in entry =           7
  In of MODEL   85
    1    H    SER  84           H        SER  84  -1.546  -0.474   3.832
    2    HA   SER  84           HA       SER  84  -2.070   1.953   5.171
    3    HB2  SER  84           HB2      SER  84  -2.874  -0.892   5.740
    4    HB3  SER  84           HB3      SER  84  -3.383   0.445   6.769
    5    HG   SER  84           HG       SER  84  -3.833   0.120   3.977

  No H/Q in entry =           5
  In of MODEL   85
    1    H    MET  85           H        MET  85  -0.331  -0.958   6.309
    2    HA   MET  85           HA       MET  85   0.174  -0.020   8.913
    3    HB2  MET  85           HB2      MET  85   0.493  -2.362   8.239
    4    HB3  MET  85           HB3      MET  85   1.873  -1.886   7.248
    5    HG2  MET  85           HG2      MET  85   3.017  -1.017   9.262
    6    HG3  MET  85           HG3      MET  85   1.638  -1.500  10.248
    7    HE1  MET  85           HE1      MET  85   0.703  -3.791  10.400
    8    HE3  MET  85           HE2      MET  85   1.906  -3.642  11.678
    9    HE2  MET  85           HE3      MET  85   1.797  -5.133  10.749

  No H/Q in entry =           9
  In of MODEL   85
    1    H    LEU  86           H        LEU  86   2.111   0.249   5.964
    2    HA   LEU  86           HA       LEU  86   4.309   1.585   7.121
    3    HB2  LEU  86           HB2      LEU  86   4.133   0.496   4.814
    4    HB3  LEU  86           HB3      LEU  86   3.311   1.968   4.297
    5    HG   LEU  86           HG       LEU  86   5.324   3.237   5.278
    6   HD11  LEU  86          HD11      LEU  86   6.055   0.635   6.084
    7   HD13  LEU  86          HD12      LEU  86   7.043   2.090   6.180
    8   HD12  LEU  86          HD13      LEU  86   7.166   1.040   4.771
    9   HD23  LEU  86          HD21      LEU  86   6.063   1.477   2.932
   10   HD22  LEU  86          HD22      LEU  86   6.439   3.178   3.191
   11   HD21  LEU  86          HD23      LEU  86   4.791   2.692   2.791

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ALA  87           H        ALA  87   1.387   2.795   5.528
    2    HA   ALA  87           HA       ALA  87   1.953   5.531   5.607
    3    HB1  ALA  87           HB1      ALA  87  -0.339   3.879   5.066
    4    HB3  ALA  87           HB2      ALA  87  -0.044   5.541   4.562
    5    HB2  ALA  87           HB3      ALA  87  -0.837   5.215   6.105

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ARG  88           H        ARG  88   0.280   3.518   7.999
    2    HA   ARG  88           HA       ARG  88  -0.256   5.566   9.840
    3    HB2  ARG  88           HB2      ARG  88  -1.170   3.205   9.910
    4    HB3  ARG  88           HB3      ARG  88   0.374   2.722  10.620
    5    HG2  ARG  88           HG2      ARG  88  -0.126   4.795  12.234
    6    HG3  ARG  88           HG3      ARG  88  -1.789   4.452  11.776
    7    HD2  ARG  88           HD2      ARG  88  -1.879   2.605  13.027
    8    HD3  ARG  88           HD3      ARG  88  -0.283   2.038  12.500
    9    HE   ARG  88           HE       ARG  88  -0.834   3.302  14.950
   10   HH21  ARG  88          HH11      ARG  88   0.712   4.333  16.189
   11   HH22  ARG  88          HH12      ARG  88   2.228   4.774  15.485
   12   HH11  ARG  88          HH21      ARG  88   1.449   3.501  12.376
   13   HH12  ARG  88          HH22      ARG  88   2.654   4.286  13.339

  No H/Q in entry =          13
  In of MODEL   85
    1    H    GLU  89           H        GLU  89   2.564   3.376   9.627
    2    HA   GLU  89           HA       GLU  89   3.812   4.284  11.970
    3    HB2  GLU  89           HB2      GLU  89   4.494   2.270  10.633
    4    HB3  GLU  89           HB3      GLU  89   5.260   3.369   9.485
    5    HG2  GLU  89           HG2      GLU  89   6.733   4.236  11.229
    6    HG3  GLU  89           HG3      GLU  89   5.907   3.274  12.450

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LEU  90           H        LEU  90   4.122   5.437   8.640
    2    HA   LEU  90           HA       LEU  90   6.030   7.460   9.224
    3    HB2  LEU  90           HB2      LEU  90   4.031   7.101   6.994
    4    HB3  LEU  90           HB3      LEU  90   5.248   8.385   7.014
    5    HG   LEU  90           HG       LEU  90   5.953   5.457   7.356
    6   HD12  LEU  90          HD11      LEU  90   6.703   5.692   4.917
    7   HD11  LEU  90          HD12      LEU  90   5.672   7.122   4.864
    8   HD13  LEU  90          HD13      LEU  90   4.969   5.542   5.209
    9   HD22  LEU  90          HD21      LEU  90   7.836   6.629   8.039
   10   HD21  LEU  90          HD22      LEU  90   7.473   8.027   7.028
   11   HD23  LEU  90          HD23      LEU  90   8.150   6.568   6.306

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  91           H        ILE  91   2.491   7.435   9.069
    2    HA   ILE  91           HA       ILE  91   2.117  10.205   9.512
    3    HB   ILE  91           HB       ILE  91   0.352   7.811  10.058
    4   HG12  ILE  91          HG12      ILE  91   0.081  10.084   8.066
    5   HG13  ILE  91          HG13      ILE  91   0.959   8.599   7.700
    6   HG22  ILE  91          HG21      ILE  91  -1.404   9.849  10.113
    7   HG21  ILE  91          HG22      ILE  91  -0.014  10.697  10.786
    8   HG23  ILE  91          HG23      ILE  91  -0.635   9.255  11.585
    9   HD13  ILE  91          HD11      ILE  91  -0.971   7.289   7.744
   10   HD12  ILE  91          HD12      ILE  91  -1.576   8.796   7.057
   11   HD11  ILE  91          HD13      ILE  91  -1.846   8.433   8.762

  No H/Q in entry =          11
  In of MODEL   85
    1    H    THR  92           H        THR  92   2.548   7.474  11.721
    2    HA   THR  92           HA       THR  92   2.084   8.849  14.141
    3    HB   THR  92           HB       THR  92   3.921   6.534  13.485
    4    HG1  THR  92           HG1      THR  92   1.961   5.753  13.383
    5   HG22  THR  92          HG21      THR  92   3.536   6.252  16.119
    6   HG21  THR  92          HG22      THR  92   3.450   8.010  16.041
    7   HG23  THR  92          HG23      THR  92   4.894   7.170  15.473

  No H/Q in entry =           7
  In of MODEL   85
    1    H    GLU  93           H        GLU  93   5.043   8.430  12.214
    2    HA   GLU  93           HA       GLU  93   6.776   9.883  13.910
    3    HB2  GLU  93           HB2      GLU  93   6.875   9.561  10.896
    4    HB3  GLU  93           HB3      GLU  93   8.207  10.110  11.912
    5    HG2  GLU  93           HG2      GLU  93   6.829   7.458  12.364
    6    HG3  GLU  93           HG3      GLU  93   8.212   7.624  11.290

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LEU  94           H        LEU  94   4.721  10.865  11.191
    2    HA   LEU  94           HA       LEU  94   5.493  13.578  11.084
    3    HB2  LEU  94           HB2      LEU  94   2.921  12.179  10.329
    4    HB3  LEU  94           HB3      LEU  94   3.158  13.909  10.083
    5    HG   LEU  94           HG       LEU  94   5.202  11.943   9.043
    6   HD11  LEU  94          HD11      LEU  94   2.456  12.457   7.973
    7   HD13  LEU  94          HD12      LEU  94   3.458  11.012   7.854
    8   HD12  LEU  94          HD13      LEU  94   3.778  12.394   6.806
    9   HD23  LEU  94          HD21      LEU  94   5.433  13.778   7.315
   10   HD22  LEU  94          HD22      LEU  94   5.838  14.280   8.957
   11   HD21  LEU  94          HD23      LEU  94   4.283  14.727   8.254

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  95           H        ILE  95   2.972  11.935  12.975
    2    HA   ILE  95           HA       ILE  95   1.896  14.274  14.161
    3    HB   ILE  95           HB       ILE  95   1.948  11.395  15.094
    4   HG12  ILE  95          HG12      ILE  95  -0.293  13.137  14.035
    5   HG13  ILE  95          HG13      ILE  95   0.680  12.087  13.008
    6   HG21  ILE  95          HG21      ILE  95   0.632  13.854  16.286
    7   HG23  ILE  95          HG22      ILE  95   1.693  12.702  17.096
    8   HG22  ILE  95          HG23      ILE  95   0.065  12.218  16.619
    9   HD13  ILE  95          HD11      ILE  95  -0.200  10.140  13.931
   10   HD12  ILE  95          HD12      ILE  95  -1.596  11.211  14.001
   11   HD11  ILE  95          HD13      ILE  95  -0.631  10.930  15.449

  No H/Q in entry =          11
  In of MODEL   85
    1    H    GLU  96           H        GLU  96   4.518  12.093  15.169
    2    HA   GLU  96           HA       GLU  96   5.052  13.306  17.658
    3    HB2  GLU  96           HB2      GLU  96   6.030  11.158  17.019
    4    HB3  GLU  96           HB3      GLU  96   6.955  11.940  15.739
    5    HG2  GLU  96           HG2      GLU  96   8.593  12.515  17.203
    6    HG3  GLU  96           HG3      GLU  96   7.433  13.315  18.253

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LEU  97           H        LEU  97   6.123  14.083  14.372
    2    HA   LEU  97           HA       LEU  97   7.980  16.107  15.083
    3    HB2  LEU  97           HB2      LEU  97   6.402  15.529  12.586
    4    HB3  LEU  97           HB3      LEU  97   7.401  16.974  12.705
    5    HG   LEU  97           HG       LEU  97   8.467  14.193  13.276
    6   HD12  LEU  97          HD11      LEU  97   9.466  14.394  10.960
    7   HD11  LEU  97          HD12      LEU  97   8.396  15.769  10.690
    8   HD13  LEU  97          HD13      LEU  97   7.719  14.168  10.988
    9   HD23  LEU  97          HD21      LEU  97  10.620  15.499  12.534
   10   HD22  LEU  97          HD22      LEU  97   9.994  15.765  14.161
   11   HD21  LEU  97          HD23      LEU  97   9.666  16.940  12.888

  No H/Q in entry =          11
  In of MODEL   85
    1    H    HIS  98           H        HIS  98   4.488  16.191  14.420
    2    HA   HIS  98           HA       HIS  98   4.149  18.987  14.546
    3    HB2  HIS  98           HB2      HIS  98   2.290  16.712  15.275
    4    HB3  HIS  98           HB3      HIS  98   1.799  18.406  15.324
    5    HD1  HIS  98           HD1      HIS  98   2.864  15.699  12.930
    6    HD2  HIS  98           HD2      HIS  98   1.432  19.612  12.793
    7    HE1  HIS  98           HE1      HIS  98   2.303  16.172  10.503
    8    HE2  HIS  98           HE2      HIS  98   1.435  18.549  10.399

  No H/Q in entry =           8
  In of MODEL   85
    1    H    GLU  99           H        GLU  99   4.312  16.508  17.053
    2    HA   GLU  99           HA       GLU  99   3.675  18.200  19.244
    3    HB2  GLU  99           HB2      GLU  99   3.621  15.717  19.349
    4    HB3  GLU  99           HB3      GLU  99   5.382  15.697  19.244
    5    HG2  GLU  99           HG2      GLU  99   5.547  16.997  21.315
    6    HG3  GLU  99           HG3      GLU  99   3.793  17.114  21.406

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LYS 100           H        LYS 100   6.745  17.308  17.689
    2    HA   LYS 100           HA       LYS 100   8.376  18.737  19.545
    3    HB2  LYS 100           HB2      LYS 100   8.894  17.812  16.711
    4    HB3  LYS 100           HB3      LYS 100  10.111  18.602  17.719
    5    HG2  LYS 100           HG2      LYS 100   9.755  16.851  19.465
    6    HG3  LYS 100           HG3      LYS 100   8.637  16.028  18.373
    7    HD2  LYS 100           HD2      LYS 100  10.439  15.766  16.711
    8    HD3  LYS 100           HD3      LYS 100  11.562  16.601  17.787
    9    HE2  LYS 100           HE2      LYS 100  11.186  14.845  19.510
   10    HE3  LYS 100           HE3      LYS 100  10.126  13.991  18.384
   11    HZ1  LYS 100           HZ1      LYS 100  12.938  14.698  17.733
   12    HZ3  LYS 100           HZ2      LYS 100  11.911  13.626  16.906
   13    HZ2  LYS 100           HZ3      LYS 100  12.502  13.220  18.447

  No H/Q in entry =          13
  In of MODEL   85
    1    H    LEU 101           H        LEU 101   6.676  19.631  16.584
    2    HA   LEU 101           HA       LEU 101   7.855  22.204  16.244
    3    HB2  LEU 101           HB2      LEU 101   5.279  20.932  15.355
    4    HB3  LEU 101           HB3      LEU 101   5.506  22.666  15.143
    5    HG   LEU 101           HG       LEU 101   7.572  20.676  14.188
    6   HD12  LEU 101          HD11      LEU 101   6.417  21.159  11.899
    7   HD11  LEU 101          HD12      LEU 101   5.010  21.572  12.875
    8   HD13  LEU 101          HD13      LEU 101   5.697  19.951  12.963
    9   HD21  LEU 101          HD21      LEU 101   6.905  23.577  13.622
   10   HD23  LEU 101          HD22      LEU 101   7.902  22.628  12.521
   11   HD22  LEU 101          HD23      LEU 101   8.436  22.898  14.179

  No H/Q in entry =          11
  In of MODEL   85
    1    H    LYS 102           H        LYS 102   6.328  21.052  18.859
    2    HA   LYS 102           HA       LYS 102   5.676  22.140  20.787
    3    HB2  LYS 102           HB2      LYS 102   6.933  24.145  19.660
    4    HB3  LYS 102           HB3      LYS 102   5.327  24.727  19.279
    5    HG2  LYS 102           HG2      LYS 102   6.701  24.497  21.935
    6    HG3  LYS 102           HG3      LYS 102   5.732  25.811  21.300
    7    HD2  LYS 102           HD2      LYS 102   4.523  23.160  22.184
    8    HD3  LYS 102           HD3      LYS 102   4.750  24.527  23.264
    9    HE2  LYS 102           HE2      LYS 102   2.480  24.089  21.771
   10    HE3  LYS 102           HE3      LYS 102   2.960  25.643  22.450
   11    HZ2  LYS 102           HZ1      LYS 102   2.433  25.737  20.069
   12    HZ1  LYS 102           HZ2      LYS 102   3.710  24.672  19.752
   13    HZ3  LYS 102           HZ3      LYS 102   4.031  26.209  20.391

  No H/Q in entry =          13
  In of MODEL   85
    1    H    ALA 103           H        ALA 103   4.023  23.653  18.012
    2    HA   ALA 103           HA       ALA 103   1.559  24.198  18.890
    3    HB1  ALA 103           HB1      ALA 103   0.677  23.338  16.648
    4    HB2  ALA 103           HB2      ALA 103   2.333  22.823  16.323
    5    HB3  ALA 103           HB3      ALA 103   1.974  24.531  16.584

  No H/Q in entry =           5
  In of MODEL   85
    1    H1   ALA   1           H3       ALA   1  10.822 -20.247  -6.245
    2    H2   ALA   1           H2       ALA   1   9.864 -20.470  -7.632
    3    H3   ALA   1           H1       ALA   1   9.433 -21.218  -6.168
    4    HA   ALA   1           HA       ALA   1  10.498 -23.015  -6.901
    5    HB1  ALA   1           HB1      ALA   1  10.593 -22.661  -9.177
    6    HB2  ALA   1           HB2      ALA   1  12.318 -22.487  -8.845
    7    HB3  ALA   1           HB3      ALA   1  11.301 -21.053  -9.002

  No H/Q in entry =           7
  In of MODEL   85
    1    H    GLU   2           H        GLU   2  12.794 -23.936  -6.951
    2    HA   GLU   2           HA       GLU   2  14.170 -23.831  -4.737
    3    HB2  GLU   2           HB2      GLU   2  15.530 -23.688  -7.434
    4    HB3  GLU   2           HB3      GLU   2  16.263 -24.286  -5.946
    5    HG2  GLU   2           HG2      GLU   2  15.273 -26.317  -6.183
    6    HG3  GLU   2           HG3      GLU   2  13.692 -25.592  -6.447

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLU   3           H        GLU   3  15.922 -21.950  -7.140
    2    HA   GLU   3           HA       GLU   3  17.049 -20.243  -5.183
    3    HB2  GLU   3           HB2      GLU   3  16.999 -20.249  -8.193
    4    HB3  GLU   3           HB3      GLU   3  17.726 -18.908  -7.308
    5    HG2  GLU   3           HG2      GLU   3  19.404 -20.258  -6.379
    6    HG3  GLU   3           HG3      GLU   3  18.477 -21.738  -6.597

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LEU   4           H        LEU   4  14.761 -19.431  -7.820
    2    HA   LEU   4           HA       LEU   4  14.260 -16.827  -7.216
    3    HB2  LEU   4           HB2      LEU   4  12.112 -18.831  -7.945
    4    HB3  LEU   4           HB3      LEU   4  12.015 -17.084  -8.149
    5    HG   LEU   4           HG       LEU   4  14.006 -18.925  -9.513
    6   HD13  LEU   4          HD11      LEU   4  12.706 -18.798 -11.426
    7   HD12  LEU   4          HD12      LEU   4  11.977 -17.261 -10.964
    8   HD11  LEU   4          HD13      LEU   4  11.441 -18.757 -10.200
    9   HD23  LEU   4          HD21      LEU   4  14.316 -16.679 -10.870
   10   HD22  LEU   4          HD22      LEU   4  15.176 -16.907  -9.348
   11   HD21  LEU   4          HD23      LEU   4  13.711 -15.929  -9.393

  No H/Q in entry =          11
  In of MODEL   85
    1    H    GLU   5           H        GLU   5  12.808 -19.625  -5.570
    2    HA   GLU   5           HA       GLU   5  11.108 -18.071  -3.874
    3    HB2  GLU   5           HB2      GLU   5  10.727 -20.463  -4.397
    4    HB3  GLU   5           HB3      GLU   5  12.152 -20.868  -3.438
    5    HG2  GLU   5           HG2      GLU   5  10.231 -21.122  -2.006
    6    HG3  GLU   5           HG3      GLU   5  11.084 -19.666  -1.498

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLU   6           H        GLU   6  14.273 -19.609  -3.421
    2    HA   GLU   6           HA       GLU   6  14.610 -18.741  -0.725
    3    HB2  GLU   6           HB2      GLU   6  16.409 -19.867  -2.846
    4    HB3  GLU   6           HB3      GLU   6  17.113 -19.179  -1.381
    5    HG2  GLU   6           HG2      GLU   6  16.766 -21.551  -1.017
    6    HG3  GLU   6           HG3      GLU   6  15.606 -20.661  -0.032

  No H/Q in entry =           6
  In of MODEL   85
    1    H    VAL   7           H        VAL   7  15.364 -17.413  -3.877
    2    HA   VAL   7           HA       VAL   7  17.020 -15.262  -3.014
    3    HB   VAL   7           HB       VAL   7  15.324 -15.654  -5.494
    4   HG11  VAL   7          HG11      VAL   7  17.187 -13.414  -4.684
    5   HG13  VAL   7          HG12      VAL   7  15.544 -13.295  -5.311
    6   HG12  VAL   7          HG13      VAL   7  16.861 -13.783  -6.377
    7   HG21  VAL   7          HG21      VAL   7  17.449 -17.081  -4.917
    8   HG23  VAL   7          HG22      VAL   7  18.335 -15.610  -5.318
    9   HG22  VAL   7          HG23      VAL   7  17.311 -16.376  -6.529

  No H/Q in entry =           9
  In of MODEL   85
    1    H    VAL   8           H        VAL   8  13.533 -15.579  -3.577
    2    HA   VAL   8           HA       VAL   8  12.830 -12.879  -3.113
    3    HB   VAL   8           HB       VAL   8  11.254 -15.429  -2.680
    4   HG11  VAL   8          HG11      VAL   8  10.506 -12.516  -2.436
    5   HG13  VAL   8          HG12      VAL   8  10.144 -13.843  -1.331
    6   HG12  VAL   8          HG13      VAL   8   9.298 -13.726  -2.873
    7   HG22  VAL   8          HG21      VAL   8  10.639 -15.277  -4.900
    8   HG21  VAL   8          HG22      VAL   8  12.123 -14.341  -5.044
    9   HG23  VAL   8          HG23      VAL   8  10.579 -13.515  -4.860

  No H/Q in entry =           9
  In of MODEL   85
    1    H    MET   9           H        MET   9  13.131 -15.675  -0.926
    2    HA   MET   9           HA       MET   9  12.294 -14.409   1.440
    3    HB2  MET   9           HB2      MET   9  14.160 -16.693   0.861
    4    HB3  MET   9           HB3      MET   9  14.006 -16.075   2.506
    5    HG2  MET   9           HG2      MET   9  11.766 -16.700   2.677
    6    HG3  MET   9           HG3      MET   9  11.528 -16.691   0.929
    7    HE1  MET   9           HE1      MET   9  13.994 -17.970   3.435
    8    HE3  MET   9           HE2      MET   9  14.915 -18.417   2.001
    9    HE2  MET   9           HE3      MET   9  14.273 -19.675   3.054

  No H/Q in entry =           9
  In of MODEL   85
    1    H    GLY  10           H        GLY  10  15.481 -14.593  -0.110
    2    HA3  GLY  10           HA2      GLY  10  16.916 -13.147   1.859
    3    HA2  GLY  10           HA3      GLY  10  17.385 -13.310   0.167

  No H/Q in entry =           3
  In of MODEL   85
    1    H    LEU  11           H        LEU  11  15.202 -12.123  -1.080
    2    HA   LEU  11           HA       LEU  11  15.847  -9.368  -0.923
    3    HB2  LEU  11           HB2      LEU  11  13.502 -10.815  -2.158
    4    HB3  LEU  11           HB3      LEU  11  13.758  -9.077  -2.322
    5    HG   LEU  11           HG       LEU  11  15.817 -11.158  -3.101
    6   HD13  LEU  11          HD11      LEU  11  14.080 -11.554  -4.623
    7   HD12  LEU  11          HD12      LEU  11  15.067 -10.361  -5.464
    8   HD11  LEU  11          HD13      LEU  11  13.585  -9.861  -4.650
    9   HD22  LEU  11          HD21      LEU  11  17.020  -9.177  -2.878
   10   HD21  LEU  11          HD22      LEU  11  15.631  -8.161  -3.262
   11   HD23  LEU  11          HD23      LEU  11  16.477  -9.021  -4.547

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  12           H        ILE  12  13.103 -11.231   0.344
    2    HA   ILE  12           HA       ILE  12  11.675  -9.025   1.395
    3    HB   ILE  12           HB       ILE  12  11.755 -11.915   2.315
    4   HG12  ILE  12          HG12      ILE  12  11.009 -11.273  -0.097
    5   HG13  ILE  12          HG13      ILE  12   9.972 -12.338   0.832
    6   HG21  ILE  12          HG21      ILE  12   9.828  -9.666   2.981
    7   HG23  ILE  12          HG22      ILE  12  10.837 -10.569   4.109
    8   HG22  ILE  12          HG23      ILE  12   9.493 -11.367   3.296
    9   HD12  ILE  12          HD11      ILE  12   8.732 -10.537  -0.360
   10   HD11  ILE  12          HD12      ILE  12   9.624  -9.340   0.574
   11   HD13  ILE  12          HD13      ILE  12   8.533 -10.445   1.381

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  13           H        ILE  13  14.098 -11.190   2.811
    2    HA   ILE  13           HA       ILE  13  14.111 -10.003   5.389
    3    HB   ILE  13           HB       ILE  13  16.201 -11.545   3.832
    4   HG12  ILE  13          HG12      ILE  13  13.926 -12.536   4.678
    5   HG13  ILE  13          HG13      ILE  13  15.413 -13.448   4.916
    6   HG23  ILE  13          HG21      ILE  13  17.588 -10.467   5.351
    7   HG22  ILE  13          HG22      ILE  13  17.125 -11.879   6.292
    8   HG21  ILE  13          HG23      ILE  13  16.332 -10.330   6.579
    9   HD12  ILE  13          HD11      ILE  13  13.896 -13.297   6.969
   10   HD11  ILE  13          HD12      ILE  13  14.275 -11.579   7.006
   11   HD13  ILE  13          HD13      ILE  13  15.557 -12.763   7.220

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ASN  14           H        ASN  14  16.061  -9.450   2.473
    2    HA   ASN  14           HA       ASN  14  17.772  -7.478   3.533
    3    HB2  ASN  14           HB2      ASN  14  17.775  -8.750   1.220
    4    HB3  ASN  14           HB3      ASN  14  16.860  -7.349   0.678
    5   HD21  ASN  14          HD21      ASN  14  19.308  -7.652  -0.502
    6   HD22  ASN  14          HD22      ASN  14  20.432  -6.549   0.125

  No H/Q in entry =           6
  In of MODEL   85
    1    H    SER  15           H        SER  15  14.660  -7.186   1.833
    2    HA   SER  15           HA       SER  15  14.501  -4.367   1.882
    3    HB2  SER  15           HB2      SER  15  12.174  -4.654   1.383
    4    HB3  SER  15           HB3      SER  15  12.995  -6.007   0.616
    5    HG   SER  15           HG       SER  15  11.485  -7.035   1.723

  No H/Q in entry =           5
  In of MODEL   85
    1    H    GLY  16           H        GLY  16  13.444  -6.839   4.190
    2    HA3  GLY  16           HA2      GLY  16  12.189  -5.106   6.040
    3    HA2  GLY  16           HA3      GLY  16  12.830  -6.703   6.408

  No H/Q in entry =           3
  In of MODEL   85
    1    H    GLN  17           H        GLN  17  15.537  -6.326   5.820
    2    HA   GLN  17           HA       GLN  17  16.467  -5.082   8.199
    3    HB2  GLN  17           HB2      GLN  17  17.735  -6.854   7.026
    4    HB3  GLN  17           HB3      GLN  17  18.013  -5.752   5.676
    5    HG2  GLN  17           HG2      GLN  17  19.194  -4.199   7.191
    6    HG3  GLN  17           HG3      GLN  17  18.931  -5.311   8.533
    7   HE21  GLN  17          HE21      GLN  17  20.701  -6.638   8.920
    8   HE22  GLN  17          HE22      GLN  17  21.814  -7.150   7.745

  No H/Q in entry =           8
  In of MODEL   85
    1    H    ALA  18           H        ALA  18  16.268  -4.017   4.836
    2    HA   ALA  18           HA       ALA  18  17.662  -1.599   5.060
    3    HB2  ALA  18           HB1      ALA  18  16.569  -2.838   2.993
    4    HB3  ALA  18           HB2      ALA  18  16.804  -1.091   2.974
    5    HB1  ALA  18           HB3      ALA  18  15.215  -1.763   3.341

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ARG  19           H        ARG  19  14.171  -2.246   5.450
    2    HA   ARG  19           HA       ARG  19  13.456   0.393   6.157
    3    HB2  ARG  19           HB2      ARG  19  11.807  -1.389   5.571
    4    HB3  ARG  19           HB3      ARG  19  12.159  -2.177   7.111
    5    HG2  ARG  19           HG2      ARG  19  11.411  -0.195   8.344
    6    HG3  ARG  19           HG3      ARG  19  11.149   0.673   6.832
    7    HD2  ARG  19           HD2      ARG  19   9.020  -0.158   7.649
    8    HD3  ARG  19           HD3      ARG  19   9.458  -1.034   6.176
    9    HE   ARG  19           HE       ARG  19  10.438  -2.554   8.288
   10   HH21  ARG  19          HH11      ARG  19   9.215  -4.213   9.228
   11   HH22  ARG  19          HH12      ARG  19   7.496  -4.216   9.053
   12   HH11  ARG  19          HH21      ARG  19   7.424  -1.317   7.182
   13   HH12  ARG  19          HH22      ARG  19   6.482  -2.577   7.891

  No H/Q in entry =          13
  In of MODEL   85
    1    H    SER  20           H        SER  20  14.358  -2.416   8.126
    2    HA   SER  20           HA       SER  20  14.050  -1.315  10.659
    3    HB2  SER  20           HB2      SER  20  14.557  -3.631  10.547
    4    HB3  SER  20           HB3      SER  20  16.004  -3.347   9.584
    5    HG   SER  20           HG       SER  20  15.559  -3.023  12.324

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LEU  21           H        LEU  21  16.897  -1.210   8.530
    2    HA   LEU  21           HA       LEU  21  18.541   0.310  10.268
    3    HB2  LEU  21           HB2      LEU  21  18.531   0.030   7.255
    4    HB3  LEU  21           HB3      LEU  21  19.768   0.914   8.144
    5    HG   LEU  21           HG       LEU  21  19.078  -1.988   8.691
    6   HD13  LEU  21          HD11      LEU  21  20.987  -2.603   7.349
    7   HD12  LEU  21          HD12      LEU  21  21.423  -0.913   7.099
    8   HD11  LEU  21          HD13      LEU  21  19.960  -1.563   6.361
    9   HD22  LEU  21          HD21      LEU  21  20.220  -1.232  10.592
   10   HD21  LEU  21          HD22      LEU  21  21.180  -0.063   9.692
   11   HD23  LEU  21          HD23      LEU  21  21.568  -1.772   9.597

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ALA  22           H        ALA  22  16.267   1.233   7.704
    2    HA   ALA  22           HA       ALA  22  16.757   4.000   7.712
    3    HB3  ALA  22           HB1      ALA  22  15.380   2.729   6.034
    4    HB2  ALA  22           HB2      ALA  22  14.646   4.231   6.595
    5    HB1  ALA  22           HB3      ALA  22  14.081   2.683   7.225

  No H/Q in entry =           5
  In of MODEL   85
    1    H    TYR  23           H        TYR  23  14.288   2.146   9.546
    2    HA   TYR  23           HA       TYR  23  13.283   4.370  10.987
    3    HB2  TYR  23           HB2      TYR  23  12.082   2.237  10.969
    4    HB3  TYR  23           HB3      TYR  23  13.427   1.449  11.796
    5    HD1  TYR  23           HD1      TYR  23  10.884   4.158  12.156
    6    HD2  TYR  23           HD2      TYR  23  13.614   1.510  14.152
    7    HE1  TYR  23           HE1      TYR  23   9.943   4.839  14.349
    8    HE2  TYR  23           HE2      TYR  23  12.673   2.189  16.343
    9    HH   TYR  23           HH       TYR  23  11.430   3.906  17.355

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ALA  24           H        ALA  24  15.965   2.141  11.636
    2    HA   ALA  24           HA       ALA  24  16.612   3.154  14.199
    3    HB1  ALA  24           HB1      ALA  24  17.999   1.384  14.042
    4    HB3  ALA  24           HB2      ALA  24  19.013   2.320  12.943
    5    HB2  ALA  24           HB3      ALA  24  17.738   1.288  12.301

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ALA  25           H        ALA  25  17.561   4.091  10.920
    2    HA   ALA  25           HA       ALA  25  19.472   6.060  11.565
    3    HB1  ALA  25           HB1      ALA  25  18.777   5.094   9.251
    4    HB3  ALA  25           HB2      ALA  25  19.250   6.790   9.341
    5    HB2  ALA  25           HB3      ALA  25  17.543   6.354   9.268

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LEU  26           H        LEU  26  15.955   6.229  11.195
    2    HA   LEU  26           HA       LEU  26  15.683   9.008  11.638
    3    HB2  LEU  26           HB2      LEU  26  13.845   7.739  10.709
    4    HB3  LEU  26           HB3      LEU  26  13.767   6.714  12.136
    5    HG   LEU  26           HG       LEU  26  13.126   8.664  13.510
    6   HD12  LEU  26          HD11      LEU  26  12.433  10.751  12.178
    7   HD11  LEU  26          HD12      LEU  26  13.428  10.111  10.872
    8   HD13  LEU  26          HD13      LEU  26  14.162  10.512  12.425
    9   HD21  LEU  26          HD21      LEU  26  11.462   8.318  10.997
   10   HD23  LEU  26          HD22      LEU  26  10.886   9.010  12.510
   11   HD22  LEU  26          HD23      LEU  26  11.366   7.316  12.446

  No H/Q in entry =          11
  In of MODEL   85
    1    H    LYS  27           H        LYS  27  15.615   6.232  13.838
    2    HA   LYS  27           HA       LYS  27  14.994   7.594  16.201
    3    HB2  LYS  27           HB2      LYS  27  15.063   5.119  15.943
    4    HB3  LYS  27           HB3      LYS  27  16.825   5.200  15.904
    5    HG2  LYS  27           HG2      LYS  27  16.854   6.192  18.151
    6    HG3  LYS  27           HG3      LYS  27  15.086   6.182  18.192
    7    HD2  LYS  27           HD2      LYS  27  15.101   3.714  17.961
    8    HD3  LYS  27           HD3      LYS  27  16.866   3.732  17.954
    9    HE2  LYS  27           HE2      LYS  27  16.878   4.727  20.208
   10    HE3  LYS  27           HE3      LYS  27  15.112   4.739  20.218
   11    HZ3  LYS  27           HZ1      LYS  27  15.928   2.802  21.376
   12    HZ2  LYS  27           HZ2      LYS  27  16.855   2.335  20.029
   13    HZ1  LYS  27           HZ3      LYS  27  15.157   2.313  19.945

  No H/Q in entry =          13
  In of MODEL   85
    1    H    GLN  28           H        GLN  28  18.123   7.057  14.619
    2    HA   GLN  28           HA       GLN  28  19.785   8.172  16.610
    3    HB2  GLN  28           HB2      GLN  28  20.077   8.112  13.596
    4    HB3  GLN  28           HB3      GLN  28  21.353   8.625  14.700
    5    HG2  GLN  28           HG2      GLN  28  21.313   6.431  15.799
    6    HG3  GLN  28           HG3      GLN  28  20.003   5.911  14.740
    7   HE21  GLN  28          HE21      GLN  28  22.634   4.630  14.867
    8   HE22  GLN  28          HE22      GLN  28  23.348   4.822  13.341

  No H/Q in entry =           8
  In of MODEL   85
    1    H    ALA  29           H        ALA  29  18.018   9.621  13.910
    2    HA   ALA  29           HA       ALA  29  18.976  12.257  14.159
    3    HB2  ALA  29           HB1      ALA  29  17.272  12.865  12.682
    4    HB1  ALA  29           HB2      ALA  29  16.144  11.676  13.333
    5    HB3  ALA  29           HB3      ALA  29  17.485  11.151  12.315

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LYS  30           H        LYS  30  16.220  10.620  15.677
    2    HA   LYS  30           HA       LYS  30  15.169  12.862  17.026
    3    HB2  LYS  30           HB2      LYS  30  15.099   9.921  17.737
    4    HB3  LYS  30           HB3      LYS  30  14.213  11.161  18.625
    5    HG2  LYS  30           HG2      LYS  30  13.083  11.825  16.502
    6    HG3  LYS  30           HG3      LYS  30  13.909  10.499  15.681
    7    HD2  LYS  30           HD2      LYS  30  12.857   8.880  17.211
    8    HD3  LYS  30           HD3      LYS  30  12.041  10.195  18.056
    9    HE2  LYS  30           HE2      LYS  30  10.869  10.806  15.959
   10    HE3  LYS  30           HE3      LYS  30  11.665   9.461  15.134
   11    HZ2  LYS  30           HZ1      LYS  30   9.361   9.021  16.009
   12    HZ1  LYS  30           HZ2      LYS  30  10.024   9.087  17.578
   13    HZ3  LYS  30           HZ3      LYS  30  10.552   7.907  16.471

  No H/Q in entry =          13
  In of MODEL   85
    1    H    GLN  31           H        GLN  31  17.859  10.732  17.775
    2    HA   GLN  31           HA       GLN  31  18.165  11.758  20.468
    3    HB2  GLN  31           HB2      GLN  31  20.215  10.212  18.872
    4    HB3  GLN  31           HB3      GLN  31  20.074  10.339  20.626
    5    HG2  GLN  31           HG2      GLN  31  17.576   9.349  19.853
    6    HG3  GLN  31           HG3      GLN  31  18.693   8.518  18.777
    7   HE21  GLN  31          HE21      GLN  31  17.161   7.355  21.053
    8   HE22  GLN  31          HE22      GLN  31  18.323   6.713  22.108

  No H/Q in entry =           8
  In of MODEL   85
    1    H    GLY  32           H        GLY  32  18.673  13.075  17.499
    2    HA3  GLY  32           HA2      GLY  32  19.630  15.133  16.983
    3    HA2  GLY  32           HA3      GLY  32  20.383  15.152  18.572

  No H/Q in entry =           3
  In of MODEL   85
    1    H    ASP  33           H        ASP  33  20.850  12.262  16.803
    2    HA   ASP  33           HA       ASP  33  23.667  12.976  16.342
    3    HB2  ASP  33           HB2      ASP  33  22.196  10.340  16.461
    4    HB3  ASP  33           HB3      ASP  33  23.881  10.479  15.970

  No H/Q in entry =           4
  In of MODEL   85
    1    H    PHE  34           H        PHE  34  23.171  14.288  14.457
    2    HA   PHE  34           HA       PHE  34  21.842  13.280  12.169
    3    HB2  PHE  34           HB2      PHE  34  23.942  15.445  12.399
    4    HB3  PHE  34           HB3      PHE  34  22.964  15.137  10.965
    5    HD1  PHE  34           HD1      PHE  34  23.180  17.081  13.875
    6    HD2  PHE  34           HD2      PHE  34  20.339  14.918  11.487
    7    HE1  PHE  34           HE1      PHE  34  21.341  18.455  14.814
    8    HE2  PHE  34           HE2      PHE  34  18.504  16.292  12.429
    9    HZ   PHE  34           HZ       PHE  34  19.009  18.061  14.089

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ALA  35           H        ALA  35  25.217  13.143  13.185
    2    HA   ALA  35           HA       ALA  35  26.340  12.333  10.733
    3    HB3  ALA  35           HB1      ALA  35  28.033  11.192  12.459
    4    HB2  ALA  35           HB2      ALA  35  27.152  12.207  13.600
    5    HB1  ALA  35           HB3      ALA  35  27.981  12.940  12.228

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ALA  36           H        ALA  36  25.246  10.367  13.500
    2    HA   ALA  36           HA       ALA  36  25.770   7.884  12.232
    3    HB2  ALA  36           HB1      ALA  36  25.346   7.136  14.308
    4    HB3  ALA  36           HB2      ALA  36  23.651   7.605  14.153
    5    HB1  ALA  36           HB3      ALA  36  24.833   8.756  14.775

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ALA  37           H        ALA  37  22.917   9.968  12.353
    2    HA   ALA  37           HA       ALA  37  21.091   8.167  11.177
    3    HB3  ALA  37           HB1      ALA  37  21.270  11.134  11.463
    4    HB1  ALA  37           HB2      ALA  37  19.974  10.037  11.935
    5    HB2  ALA  37           HB3      ALA  37  20.160  10.508  10.245

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LYS  38           H        LYS  38  23.156  10.657   9.698
    2    HA   LYS  38           HA       LYS  38  22.529  10.213   7.020
    3    HB2  LYS  38           HB2      LYS  38  24.311  11.802   8.466
    4    HB3  LYS  38           HB3      LYS  38  25.362  10.826   7.445
    5    HG2  LYS  38           HG2      LYS  38  24.191  11.574   5.444
    6    HG3  LYS  38           HG3      LYS  38  22.980  12.412   6.420
    7    HD2  LYS  38           HD2      LYS  38  24.549  14.037   7.173
    8    HD3  LYS  38           HD3      LYS  38  25.925  13.071   6.643
    9    HE2  LYS  38           HE2      LYS  38  25.543  14.932   5.086
   10    HE3  LYS  38           HE3      LYS  38  25.234  13.388   4.284
   11    HZ3  LYS  38           HZ1      LYS  38  23.031  13.798   4.148
   12    HZ2  LYS  38           HZ2      LYS  38  23.527  15.421   4.233
   13    HZ1  LYS  38           HZ3      LYS  38  22.963  14.631   5.626

  No H/Q in entry =          13
  In of MODEL   85
    1    H    ALA  39           H        ALA  39  25.063   8.660   8.986
    2    HA   ALA  39           HA       ALA  39  26.163   7.084   6.923
    3    HB2  ALA  39           HB1      ALA  39  26.083   6.126   9.768
    4    HB1  ALA  39           HB2      ALA  39  27.013   7.565   9.351
    5    HB3  ALA  39           HB3      ALA  39  27.391   6.019   8.592

  No H/Q in entry =           5
  In of MODEL   85
    1    H    MET  40           H        MET  40  23.554   6.431   9.216
    2    HA   MET  40           HA       MET  40  23.157   3.718   8.487
    3    HB2  MET  40           HB2      MET  40  21.304   5.735   9.770
    4    HB3  MET  40           HB3      MET  40  20.926   4.019   9.598
    5    HG2  MET  40           HG2      MET  40  23.457   5.004  10.943
    6    HG3  MET  40           HG3      MET  40  21.965   4.707  11.834
    7    HE3  MET  40           HE1      MET  40  21.460   1.065  12.016
    8    HE2  MET  40           HE2      MET  40  20.572   2.351  11.204
    9    HE1  MET  40           HE3      MET  40  21.304   2.655  12.778

  No H/Q in entry =           9
  In of MODEL   85
    1    H    MET  41           H        MET  41  21.696   6.745   7.289
    2    HA   MET  41           HA       MET  41  19.763   5.514   5.615
    3    HB2  MET  41           HB2      MET  41  21.203   8.127   5.100
    4    HB3  MET  41           HB3      MET  41  19.685   7.607   4.379
    5    HG2  MET  41           HG2      MET  41  18.936   7.412   6.929
    6    HG3  MET  41           HG3      MET  41  20.225   8.592   7.151
    7    HE2  MET  41           HE1      MET  41  19.649   9.862   3.810
    8    HE1  MET  41           HE2      MET  41  20.595  10.321   5.223
    9    HE3  MET  41           HE3      MET  41  19.306  11.378   4.653

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ASP  42           H        ASP  42  23.121   6.491   5.068
    2    HA   ASP  42           HA       ASP  42  23.227   6.012   2.312
    3    HB2  ASP  42           HB2      ASP  42  24.958   7.043   4.083
    4    HB3  ASP  42           HB3      ASP  42  25.642   5.428   3.961

  No H/Q in entry =           4
  In of MODEL   85
    1    H    GLN  43           H        GLN  43  23.981   3.876   5.039
    2    HA   GLN  43           HA       GLN  43  24.686   1.626   3.463
    3    HB2  GLN  43           HB2      GLN  43  23.654   1.799   6.304
    4    HB3  GLN  43           HB3      GLN  43  24.260   0.318   5.554
    5    HG2  GLN  43           HG2      GLN  43  26.404   1.564   5.045
    6    HG3  GLN  43           HG3      GLN  43  25.796   2.883   6.040
    7   HE21  GLN  43          HE21      GLN  43  28.043   1.950   7.084
    8   HE22  GLN  43          HE22      GLN  43  27.784   0.866   8.362

  No H/Q in entry =           8
  In of MODEL   85
    1    H    SER  44           H        SER  44  21.609   2.712   4.839
    2    HA   SER  44           HA       SER  44  20.079   0.442   4.168
    3    HB2  SER  44           HB2      SER  44  19.593   2.965   5.306
    4    HB3  SER  44           HB3      SER  44  18.563   2.902   3.879
    5    HG   SER  44           HG       SER  44  17.481   1.945   5.601

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ARG  45           H        ARG  45  20.777   3.414   2.357
    2    HA   ARG  45           HA       ARG  45  19.265   2.898   0.050
    3    HB2  ARG  45           HB2      ARG  45  20.372   5.054   0.632
    4    HB3  ARG  45           HB3      ARG  45  21.930   4.324   0.252
    5    HG2  ARG  45           HG2      ARG  45  21.159   3.900  -2.063
    6    HG3  ARG  45           HG3      ARG  45  19.613   4.653  -1.682
    7    HD2  ARG  45           HD2      ARG  45  20.827   6.772  -1.100
    8    HD3  ARG  45           HD3      ARG  45  22.337   6.021  -1.663
    9    HE   ARG  45           HE       ARG  45  20.416   5.747  -3.703
   10   HH21  ARG  45          HH11      ARG  45  20.390   7.112  -5.469
   11   HH22  ARG  45          HH12      ARG  45  21.121   8.674  -5.367
   12   HH11  ARG  45          HH21      ARG  45  22.101   8.277  -2.078
   13   HH12  ARG  45          HH22      ARG  45  22.089   9.334  -3.444

  No H/Q in entry =          13
  In of MODEL   85
    1    H    MET  46           H        MET  46  22.641   2.080   0.807
    2    HA   MET  46           HA       MET  46  23.272   0.891  -1.673
    3    HB2  MET  46           HB2      MET  46  24.379   0.598   1.119
    4    HB3  MET  46           HB3      MET  46  25.048  -0.301  -0.246
    5    HG2  MET  46           HG2      MET  46  25.463   1.801  -1.451
    6    HG3  MET  46           HG3      MET  46  24.752   2.717  -0.128
    7    HE1  MET  46           HE1      MET  46  27.322   0.439  -1.423
    8    HE3  MET  46           HE2      MET  46  27.413  -0.458   0.089
    9    HE2  MET  46           HE3      MET  46  28.753   0.581  -0.393

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ALA  47           H        ALA  47  21.904  -0.457   1.304
    2    HA   ALA  47           HA       ALA  47  21.895  -3.172   0.508
    3    HB2  ALA  47           HB1      ALA  47  21.505  -2.712   2.810
    4    HB3  ALA  47           HB2      ALA  47  19.979  -3.340   2.190
    5    HB1  ALA  47           HB3      ALA  47  20.181  -1.606   2.445

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LEU  48           H        LEU  48  19.502  -0.583   0.140
    2    HA   LEU  48           HA       LEU  48  17.483  -2.151  -1.110
    3    HB2  LEU  48           HB2      LEU  48  18.092   0.812  -1.231
    4    HB3  LEU  48           HB3      LEU  48  16.633   0.078  -1.899
    5    HG   LEU  48           HG       LEU  48  17.487  -0.203   0.992
    6   HD13  LEU  48          HD11      LEU  48  17.034   2.090   0.799
    7   HD12  LEU  48          HD12      LEU  48  15.485   1.420   1.307
    8   HD11  LEU  48          HD13      LEU  48  15.752   1.842  -0.385
    9   HD22  LEU  48          HD21      LEU  48  15.985  -1.942   0.614
   10   HD21  LEU  48          HD22      LEU  48  15.099  -1.056  -0.628
   11   HD23  LEU  48          HD23      LEU  48  14.878  -0.650   1.074

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ASN  49           H        ASN  49  20.143  -0.186  -2.342
    2    HA   ASN  49           HA       ASN  49  19.498  -0.287  -5.067
    3    HB2  ASN  49           HB2      ASN  49  21.153   1.256  -4.140
    4    HB3  ASN  49           HB3      ASN  49  22.204  -0.089  -3.712
    5   HD21  ASN  49          HD21      ASN  49  23.212   1.900  -5.378
    6   HD22  ASN  49          HD22      ASN  49  23.381   1.303  -6.957

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLU  50           H        GLU  50  21.512  -2.446  -3.095
    2    HA   GLU  50           HA       GLU  50  22.243  -4.197  -5.216
    3    HB2  GLU  50           HB2      GLU  50  23.437  -4.147  -3.048
    4    HB3  GLU  50           HB3      GLU  50  22.003  -4.794  -2.252
    5    HG2  GLU  50           HG2      GLU  50  22.125  -6.830  -3.605
    6    HG3  GLU  50           HG3      GLU  50  23.492  -6.179  -4.506

  No H/Q in entry =           6
  In of MODEL   85
    1    H    ALA  51           H        ALA  51  19.583  -4.164  -2.893
    2    HA   ALA  51           HA       ALA  51  18.455  -6.657  -3.644
    3    HB3  ALA  51           HB1      ALA  51  16.853  -6.170  -2.092
    4    HB1  ALA  51           HB2      ALA  51  16.616  -4.529  -2.696
    5    HB2  ALA  51           HB3      ALA  51  17.980  -4.892  -1.637

  No H/Q in entry =           5
  In of MODEL   85
    1    H    HIS  52           H        HIS  52  17.820  -3.321  -4.690
    2    HA   HIS  52           HA       HIS  52  15.717  -3.884  -6.490
    3    HB2  HIS  52           HB2      HIS  52  16.305  -1.608  -5.708
    4    HB3  HIS  52           HB3      HIS  52  17.790  -1.683  -6.656
    5    HD1  HIS  52           HD1      HIS  52  17.513  -1.796  -9.291
    6    HD2  HIS  52           HD2      HIS  52  13.990  -1.037  -7.196
    7    HE1  HIS  52           HE1      HIS  52  15.833  -0.962 -10.992
    8    HE2  HIS  52           HE2      HIS  52  13.680  -0.493  -9.731

  No H/Q in entry =           8
  In of MODEL   85
    1    H    LEU  53           H        LEU  53  19.235  -3.839  -6.919
    2    HA   LEU  53           HA       LEU  53  19.300  -4.162  -9.718
    3    HB2  LEU  53           HB2      LEU  53  21.241  -4.879  -7.537
    4    HB3  LEU  53           HB3      LEU  53  21.565  -5.282  -9.221
    5    HG   LEU  53           HG       LEU  53  20.862  -2.471  -8.315
    6   HD13  LEU  53          HD11      LEU  53  23.265  -1.985  -8.398
    7   HD12  LEU  53          HD12      LEU  53  23.606  -3.669  -8.796
    8   HD11  LEU  53          HD13      LEU  53  22.948  -3.253  -7.217
    9   HD22  LEU  53          HD21      LEU  53  20.584  -2.541 -10.654
   10   HD21  LEU  53          HD22      LEU  53  21.867  -3.729 -10.862
   11   HD23  LEU  53          HD23      LEU  53  22.271  -2.057 -10.519

  No H/Q in entry =          11
  In of MODEL   85
    1    H    VAL  54           H        VAL  54  19.221  -6.542  -7.085
    2    HA   VAL  54           HA       VAL  54  19.381  -8.839  -8.737
    3    HB   VAL  54           HB       VAL  54  18.218  -8.425  -5.972
    4   HG12  VAL  54          HG11      VAL  54  18.582 -11.037  -5.959
    5   HG11  VAL  54          HG12      VAL  54  18.397 -10.877  -7.706
    6   HG13  VAL  54          HG13      VAL  54  17.099 -10.363  -6.630
    7   HG22  VAL  54          HG21      VAL  54  20.530  -8.177  -5.748
    8   HG21  VAL  54          HG22      VAL  54  20.885  -9.268  -7.085
    9   HG23  VAL  54          HG23      VAL  54  20.364  -9.918  -5.531

  No H/Q in entry =           9
  In of MODEL   85
    1    H    GLN  55           H        GLN  55  16.623  -6.975  -7.463
    2    HA   GLN  55           HA       GLN  55  14.629  -8.674  -8.534
    3    HB2  GLN  55           HB2      GLN  55  13.855  -7.155  -6.913
    4    HB3  GLN  55           HB3      GLN  55  14.627  -5.777  -7.692
    5    HG2  GLN  55           HG2      GLN  55  12.900  -5.484  -9.185
    6    HG3  GLN  55           HG3      GLN  55  12.605  -7.210  -9.350
    7   HE21  GLN  55          HE21      GLN  55  10.606  -7.789  -8.545
    8   HE22  GLN  55          HE22      GLN  55   9.819  -7.042  -7.240

  No H/Q in entry =           8
  In of MODEL   85
    1    H    THR  56           H        THR  56  16.325  -5.851  -9.901
    2    HA   THR  56           HA       THR  56  14.884  -5.520 -12.252
    3    HB   THR  56           HB       THR  56  17.901  -5.383 -12.089
    4    HG1  THR  56           HG1      THR  56  16.960  -4.242 -10.372
    5   HG21  THR  56          HG21      THR  56  16.545  -5.118 -14.297
    6   HG23  THR  56          HG22      THR  56  17.765  -3.908 -13.903
    7   HG22  THR  56          HG23      THR  56  16.058  -3.564 -13.618

  No H/Q in entry =           7
  In of MODEL   85
    1    H    LYS  57           H        LYS  57  17.570  -7.772 -11.630
    2    HA   LYS  57           HA       LYS  57  17.592  -8.976 -14.204
    3    HB2  LYS  57           HB2      LYS  57  19.388  -9.196 -12.465
    4    HB3  LYS  57           HB3      LYS  57  18.298 -10.195 -11.514
    5    HG2  LYS  57           HG2      LYS  57  18.201 -11.849 -13.327
    6    HG3  LYS  57           HG3      LYS  57  19.262 -10.851 -14.314
    7    HD2  LYS  57           HD2      LYS  57  21.056 -11.082 -12.638
    8    HD3  LYS  57           HD3      LYS  57  19.999 -12.073 -11.633
    9    HE2  LYS  57           HE2      LYS  57  21.485 -13.523 -12.943
   10    HE3  LYS  57           HE3      LYS  57  19.827 -13.733 -13.505
   11    HZ3  LYS  57           HZ1      LYS  57  20.233 -12.375 -15.366
   12    HZ2  LYS  57           HZ2      LYS  57  21.546 -13.448 -15.275
   13    HZ1  LYS  57           HZ3      LYS  57  21.723 -11.839 -14.761

  No H/Q in entry =          13
  In of MODEL   85
    1    H    LEU  58           H        LEU  58  15.820  -9.662 -11.228
    2    HA   LEU  58           HA       LEU  58  14.638 -12.058 -12.155
    3    HB2  LEU  58           HB2      LEU  58  13.810 -10.158  -9.967
    4    HB3  LEU  58           HB3      LEU  58  13.029 -11.710 -10.279
    5    HG   LEU  58           HG       LEU  58  15.996 -11.381  -9.723
    6   HD11  LEU  58          HD11      LEU  58  13.631 -11.831  -7.930
    7   HD13  LEU  58          HD12      LEU  58  15.068 -10.843  -7.670
    8   HD12  LEU  58          HD13      LEU  58  15.169 -12.598  -7.529
    9   HD22  LEU  58          HD21      LEU  58  15.914 -13.448 -10.743
   10   HD21  LEU  58          HD22      LEU  58  14.203 -13.685 -10.383
   11   HD23  LEU  58          HD23      LEU  58  15.415 -13.961  -9.132

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  59           H        ILE  59  13.912  -8.735 -12.850
    2    HA   ILE  59           HA       ILE  59  11.209  -9.432 -13.790
    3    HB   ILE  59           HB       ILE  59  11.975  -7.133 -12.592
    4   HG12  ILE  59          HG12      ILE  59  10.074  -7.023 -14.942
    5   HG13  ILE  59          HG13      ILE  59   9.663  -7.834 -13.453
    6   HG23  ILE  59          HG21      ILE  59  12.529  -5.407 -14.102
    7   HG22  ILE  59          HG22      ILE  59  12.038  -6.334 -15.502
    8   HG21  ILE  59          HG23      ILE  59  13.527  -6.732 -14.651
    9   HD11  ILE  59          HD11      ILE  59  10.154  -5.729 -12.201
   10   HD13  ILE  59          HD12      ILE  59   8.818  -5.561 -13.340
   11   HD12  ILE  59          HD13      ILE  59  10.412  -4.925 -13.751

  No H/Q in entry =          11
  In of MODEL   85
    1    H    GLU  60           H        GLU  60  14.399  -8.531 -15.049
    2    HA   GLU  60           HA       GLU  60  13.615  -8.154 -17.759
    3    HB2  GLU  60           HB2      GLU  60  15.781  -7.382 -16.908
    4    HB3  GLU  60           HB3      GLU  60  16.271  -9.046 -16.601
    5    HG2  GLU  60           HG2      GLU  60  16.103  -9.551 -19.007
    6    HG3  GLU  60           HG3      GLU  60  15.584  -7.897 -19.325

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLY  61           H        GLY  61  14.638 -11.012 -15.933
    2    HA3  GLY  61           HA2      GLY  61  14.126 -12.677 -18.329
    3    HA2  GLY  61           HA3      GLY  61  15.165 -13.136 -16.984

  No H/Q in entry =           3
  In of MODEL   85
    1    H    ASP  62           H        ASP  62  12.018 -11.642 -16.625
    2    HA   ASP  62           HA       ASP  62  11.124 -13.609 -14.793
    3    HB2  ASP  62           HB2      ASP  62  10.391 -11.248 -14.777
    4    HB3  ASP  62           HB3      ASP  62   9.521 -11.525 -16.282

  No H/Q in entry =           4
  In of MODEL   85
    1    H    ALA  63           H        ALA  63  11.789 -15.245 -16.837
    2    HA   ALA  63           HA       ALA  63   9.741 -15.791 -18.745
    3    HB1  ALA  63           HB1      ALA  63  11.826 -16.748 -19.241
    4    HB3  ALA  63           HB2      ALA  63  10.876 -18.130 -18.700
    5    HB2  ALA  63           HB3      ALA  63  12.034 -17.376 -17.605

  No H/Q in entry =           5
  In of MODEL   85
    1    H    GLY  64           H        GLY  64  10.421 -16.995 -15.499
    2    HA3  GLY  64           HA2      GLY  64   9.116 -18.080 -13.955
    3    HA2  GLY  64           HA3      GLY  64   7.716 -17.587 -14.900

  No H/Q in entry =           3
  In of MODEL   85
    1    H    GLU  65           H        GLU  65   6.514 -19.403 -15.140
    2    HA   GLU  65           HA       GLU  65   7.608 -22.006 -15.263
    3    HB2  GLU  65           HB2      GLU  65   4.879 -20.961 -16.005
    4    HB3  GLU  65           HB3      GLU  65   5.301 -22.673 -15.990
    5    HG2  GLU  65           HG2      GLU  65   5.897 -22.542 -13.625
    6    HG3  GLU  65           HG3      GLU  65   5.581 -20.807 -13.616

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLY  66           H        GLY  66   6.500 -19.814 -17.737
    2    HA3  GLY  66           HA2      GLY  66   8.037 -21.194 -19.776
    3    HA2  GLY  66           HA3      GLY  66   6.306 -21.130 -20.042

  No H/Q in entry =           3
  In of MODEL   85
    1    H    LYS  67           H        LYS  67   6.318 -19.882 -21.833
    2    HA   LYS  67           HA       LYS  67   7.901 -17.625 -22.290
    3    HB2  LYS  67           HB2      LYS  67   5.287 -18.499 -23.511
    4    HB3  LYS  67           HB3      LYS  67   6.273 -17.170 -24.134
    5    HG2  LYS  67           HG2      LYS  67   8.196 -18.694 -24.366
    6    HG3  LYS  67           HG3      LYS  67   7.227 -20.023 -23.739
    7    HD2  LYS  67           HD2      LYS  67   5.685 -19.811 -25.648
    8    HD3  LYS  67           HD3      LYS  67   6.648 -18.472 -26.277
    9    HE2  LYS  67           HE2      LYS  67   8.610 -19.958 -26.452
   10    HE3  LYS  67           HE3      LYS  67   7.651 -21.298 -25.825
   11    HZ1  LYS  67           HZ1      LYS  67   6.270 -20.113 -27.961
   12    HZ3  LYS  67           HZ2      LYS  67   6.900 -21.687 -27.850
   13    HZ2  LYS  67           HZ3      LYS  67   7.860 -20.425 -28.464

  No H/Q in entry =          13
  In of MODEL   85
    1    H    MET  68           H        MET  68   4.431 -17.299 -22.274
    2    HA   MET  68           HA       MET  68   4.403 -14.592 -21.503
    3    HB2  MET  68           HB2      MET  68   2.301 -16.722 -21.745
    4    HB3  MET  68           HB3      MET  68   1.902 -15.104 -21.167
    5    HG2  MET  68           HG2      MET  68   3.359 -15.649 -23.766
    6    HG3  MET  68           HG3      MET  68   1.617 -15.386 -23.649
    7    HE2  MET  68           HE1      MET  68   2.683 -12.320 -25.346
    8    HE1  MET  68           HE2      MET  68   2.821 -14.069 -25.496
    9    HE3  MET  68           HE3      MET  68   4.251 -13.109 -25.124

  No H/Q in entry =           9
  In of MODEL   85
    1    H    LYS  69           H        LYS  69   3.831 -17.536 -19.557
    2    HA   LYS  69           HA       LYS  69   2.811 -16.254 -17.283
    3    HB2  LYS  69           HB2      LYS  69   2.531 -18.622 -17.604
    4    HB3  LYS  69           HB3      LYS  69   4.276 -18.882 -17.521
    5    HG2  LYS  69           HG2      LYS  69   3.069 -19.366 -15.361
    6    HG3  LYS  69           HG3      LYS  69   4.348 -18.159 -15.218
    7    HD2  LYS  69           HD2      LYS  69   2.824 -16.380 -15.057
    8    HD3  LYS  69           HD3      LYS  69   1.508 -17.319 -15.765
    9    HE2  LYS  69           HE2      LYS  69   1.062 -18.443 -13.794
   10    HE3  LYS  69           HE3      LYS  69   2.722 -18.304 -13.217
   11    HZ2  LYS  69           HZ1      LYS  69   0.733 -16.107 -13.364
   12    HZ1  LYS  69           HZ2      LYS  69   2.348 -15.930 -12.873
   13    HZ3  LYS  69           HZ3      LYS  69   1.276 -16.870 -11.951

  No H/Q in entry =          13
  In of MODEL   85
    1    H    VAL  70           H        VAL  70   3.634 -14.982 -15.755
    2    HA   VAL  70           HA       VAL  70   6.563 -14.756 -15.479
    3    HB   VAL  70           HB       VAL  70   5.887 -12.696 -14.121
    4   HG13  VAL  70          HG11      VAL  70   6.721 -12.441 -16.371
    5   HG12  VAL  70          HG12      VAL  70   5.292 -11.417 -16.224
    6   HG11  VAL  70          HG13      VAL  70   5.183 -12.967 -17.056
    7   HG22  VAL  70          HG21      VAL  70   3.629 -11.896 -14.272
    8   HG21  VAL  70          HG22      VAL  70   3.499 -13.593 -13.814
    9   HG23  VAL  70          HG23      VAL  70   3.204 -13.106 -15.483

  No H/Q in entry =           9
  In of MODEL   85
    1    H    SER  71           H        SER  71   7.525 -14.732 -13.393
    2    HA   SER  71           HA       SER  71   6.624 -16.737 -11.589
    3    HB2  SER  71           HB2      SER  71   9.014 -16.042 -11.886
    4    HB3  SER  71           HB3      SER  71   8.633 -14.532 -11.062
    5    HG   SER  71           HG       SER  71   8.917 -17.097 -10.076

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LEU  72           H        LEU  72   5.212 -16.606  -9.988
    2    HA   LEU  72           HA       LEU  72   3.623 -14.317  -9.553
    3    HB2  LEU  72           HB2      LEU  72   3.951 -16.862  -7.973
    4    HB3  LEU  72           HB3      LEU  72   2.760 -15.624  -7.583
    5    HG   LEU  72           HG       LEU  72   2.951 -16.937 -10.314
    6   HD12  LEU  72          HD11      LEU  72   0.969 -17.573  -8.116
    7   HD11  LEU  72          HD12      LEU  72   2.416 -18.533  -8.407
    8   HD13  LEU  72          HD13      LEU  72   1.177 -18.410  -9.654
    9   HD22  LEU  72          HD21      LEU  72   1.700 -14.974 -10.595
   10   HD21  LEU  72          HD22      LEU  72   1.026 -15.035  -8.975
   11   HD23  LEU  72          HD23      LEU  72   0.441 -16.142 -10.214

  No H/Q in entry =          11
  In of MODEL   85
    1    H    VAL  73           H        VAL  73   6.300 -15.704  -7.772
    2    HA   VAL  73           HA       VAL  73   6.211 -14.166  -5.444
    3    HB   VAL  73           HB       VAL  73   8.402 -14.942  -5.008
    4   HG12  VAL  73          HG11      VAL  73   7.257 -17.045  -6.851
    5   HG11  VAL  73          HG12      VAL  73   6.520 -16.659  -5.297
    6   HG13  VAL  73          HG13      VAL  73   8.169 -17.281  -5.362
    7   HG21  VAL  73          HG21      VAL  73   8.597 -14.989  -8.001
    8   HG23  VAL  73          HG22      VAL  73   9.604 -16.092  -7.066
    9   HG22  VAL  73          HG23      VAL  73   9.741 -14.352  -6.819

  No H/Q in entry =           9
  In of MODEL   85
    1    H    LEU  74           H        LEU  74   7.191 -13.265  -8.621
    2    HA   LEU  74           HA       LEU  74   9.103 -11.283  -8.131
    3    HB2  LEU  74           HB2      LEU  74   8.665 -12.044 -10.368
    4    HB3  LEU  74           HB3      LEU  74   6.989 -11.507 -10.272
    5    HG   LEU  74           HG       LEU  74   7.783  -9.161 -10.023
    6   HD11  LEU  74          HD11      LEU  74  10.454 -10.547 -10.249
    7   HD13  LEU  74          HD12      LEU  74   9.942  -9.343  -9.068
    8   HD12  LEU  74          HD13      LEU  74  10.261  -8.864 -10.735
    9   HD21  LEU  74          HD21      LEU  74   7.388 -10.497 -12.240
   10   HD23  LEU  74          HD22      LEU  74   9.118 -10.311 -12.409
   11   HD22  LEU  74          HD23      LEU  74   8.105  -8.889 -12.300

  No H/Q in entry =          11
  In of MODEL   85
    1    H    VAL  75           H        VAL  75   5.603 -10.957  -8.492
    2    HA   VAL  75           HA       VAL  75   5.460  -8.201  -7.914
    3    HB   VAL  75           HB       VAL  75   3.405 -10.378  -7.526
    4   HG11  VAL  75          HG11      VAL  75   3.160  -7.341  -7.380
    5   HG13  VAL  75          HG12      VAL  75   2.890  -8.473  -6.064
    6   HG12  VAL  75          HG13      VAL  75   1.796  -8.452  -7.438
    7   HG21  VAL  75          HG21      VAL  75   4.167  -9.962  -9.852
    8   HG23  VAL  75          HG22      VAL  75   3.805  -8.248  -9.656
    9   HG22  VAL  75          HG23      VAL  75   2.501  -9.434  -9.624

  No H/Q in entry =           9
  In of MODEL   85
    1    H    GLU  76           H        GLU  76   5.249 -11.075  -5.796
    2    HA   GLU  76           HA       GLU  76   4.751  -9.715  -3.380
    3    HB2  GLU  76           HB2      GLU  76   4.641 -12.202  -3.657
    4    HB3  GLU  76           HB3      GLU  76   6.390 -12.242  -3.798
    5    HG2  GLU  76           HG2      GLU  76   6.617 -11.348  -1.514
    6    HG3  GLU  76           HG3      GLU  76   4.874 -11.268  -1.344

  No H/Q in entry =           6
  In of MODEL   85
    1    H    ALA  77           H        ALA  77   7.829 -10.577  -4.933
    2    HA   ALA  77           HA       ALA  77   9.496  -9.500  -2.916
    3    HB1  ALA  77           HB1      ALA  77  10.215 -11.048  -4.769
    4    HB2  ALA  77           HB2      ALA  77  11.277  -9.662  -4.519
    5    HB3  ALA  77           HB3      ALA  77  10.138  -9.669  -5.867

  No H/Q in entry =           5
  In of MODEL   85
    1    H    GLN  78           H        GLN  78   8.089  -8.114  -5.838
    2    HA   GLN  78           HA       GLN  78   9.401  -5.613  -5.737
    3    HB2  GLN  78           HB2      GLN  78   8.124  -6.554  -7.696
    4    HB3  GLN  78           HB3      GLN  78   6.633  -6.197  -6.825
    5    HG2  GLN  78           HG2      GLN  78   7.246  -3.817  -6.738
    6    HG3  GLN  78           HG3      GLN  78   8.744  -4.164  -7.601
    7   HE21  GLN  78          HE21      GLN  78   6.808  -2.376  -8.713
    8   HE22  GLN  78          HE22      GLN  78   6.133  -3.106 -10.090

  No H/Q in entry =           8
  In of MODEL   85
    1    H    LEU  79           H        LEU  79   6.396  -6.795  -4.312
    2    HA   LEU  79           HA       LEU  79   5.361  -4.401  -3.313
    3    HB2  LEU  79           HB2      LEU  79   4.079  -6.472  -3.255
    4    HB3  LEU  79           HB3      LEU  79   5.232  -7.190  -2.134
    5    HG   LEU  79           HG       LEU  79   4.649  -5.552  -0.414
    6   HD13  LEU  79          HD11      LEU  79   4.155  -3.548  -1.471
    7   HD12  LEU  79          HD12      LEU  79   2.537  -4.098  -1.036
    8   HD11  LEU  79          HD13      LEU  79   3.126  -4.316  -2.682
    9   HD23  LEU  79          HD21      LEU  79   2.070  -6.085  -0.330
   10   HD22  LEU  79          HD22      LEU  79   3.230  -7.406  -0.214
   11   HD21  LEU  79          HD23      LEU  79   2.416  -7.086  -1.742

  No H/Q in entry =          11
  In of MODEL   85
    1    H    HIS  80           H        HIS  80   7.575  -6.697  -1.716
    2    HA   HIS  80           HA       HIS  80   7.831  -5.144   0.649
    3    HB2  HIS  80           HB2      HIS  80   9.210  -7.490  -0.538
    4    HB3  HIS  80           HB3      HIS  80  10.103  -6.576   0.679
    5    HD1  HIS  80           HD1      HIS  80   9.614  -7.212   3.022
    6    HD2  HIS  80           HD2      HIS  80   6.419  -8.120   0.502
    7    HE1  HIS  80           HE1      HIS  80   7.855  -8.339   4.468
    8    HE2  HIS  80           HE2      HIS  80   5.901  -8.896   2.940

  No H/Q in entry =           8
  In of MODEL   85
    1    H    LEU  81           H        LEU  81   9.851  -5.397  -2.256
    2    HA   LEU  81           HA       LEU  81  11.865  -3.623  -1.375
    3    HB2  LEU  81           HB2      LEU  81  10.966  -4.437  -4.139
    4    HB3  LEU  81           HB3      LEU  81  12.370  -3.409  -3.847
    5    HG   LEU  81           HG       LEU  81  12.013  -6.132  -2.567
    6   HD12  LEU  81          HD11      LEU  81  13.845  -6.736  -4.308
    7   HD11  LEU  81          HD12      LEU  81  13.261  -5.323  -5.186
    8   HD13  LEU  81          HD13      LEU  81  12.168  -6.663  -4.848
    9   HD23  LEU  81          HD21      LEU  81  14.637  -5.777  -2.544
   10   HD22  LEU  81          HD22      LEU  81  13.639  -5.028  -1.300
   11   HD21  LEU  81          HD23      LEU  81  14.208  -4.071  -2.667

  No H/Q in entry =          11
  In of MODEL   85
    1    H    MET  82           H        MET  82   8.940  -3.036  -3.324
    2    HA   MET  82           HA       MET  82   9.441  -0.304  -3.831
    3    HB2  MET  82           HB2      MET  82   6.905  -1.935  -3.711
    4    HB3  MET  82           HB3      MET  82   6.881  -0.211  -4.080
    5    HG2  MET  82           HG2      MET  82   8.517  -2.266  -5.603
    6    HG3  MET  82           HG3      MET  82   6.943  -1.668  -6.123
    7    HE3  MET  82           HE1      MET  82   7.345   1.790  -7.303
    8    HE2  MET  82           HE2      MET  82   6.967   1.563  -5.598
    9    HE1  MET  82           HE3      MET  82   6.323   0.441  -6.791

  No H/Q in entry =           9
  In of MODEL   85
    1    H    THR  83           H        THR  83   7.664  -1.920  -1.228
    2    HA   THR  83           HA       THR  83   6.774   0.419   0.089
    3    HB   THR  83           HB       THR  83   6.655  -1.151   2.111
    4    HG1  THR  83           HG1      THR  83   7.441  -3.091   1.889
    5   HG22  THR  83          HG21      THR  83   5.030  -2.745   0.641
    6   HG21  THR  83          HG22      THR  83   5.241  -1.417  -0.494
    7   HG23  THR  83          HG23      THR  83   4.590  -1.106   1.116

  No H/Q in entry =           7
  In of MODEL   85
    1    H    SER  84           H        SER  84   9.625  -1.636   0.626
    2    HA   SER  84           HA       SER  84  10.656  -0.185   2.814
    3    HB2  SER  84           HB2      SER  84  11.943  -2.015   0.799
    4    HB3  SER  84           HB3      SER  84  12.874  -1.245   2.082
    5    HG   SER  84           HG       SER  84  10.623  -2.966   2.338

  No H/Q in entry =           5
  In of MODEL   85
    1    H    MET  85           H        MET  85  11.418   0.077  -0.672
    2    HA   MET  85           HA       MET  85  13.388   2.071  -0.420
    3    HB2  MET  85           HB2      MET  85  13.014   0.776  -2.483
    4    HB3  MET  85           HB3      MET  85  11.480   1.612  -2.720
    5    HG2  MET  85           HG2      MET  85  12.672   3.775  -2.821
    6    HG3  MET  85           HG3      MET  85  14.204   2.937  -2.592
    7    HE1  MET  85           HE1      MET  85  15.084   1.113  -4.033
    8    HE3  MET  85           HE2      MET  85  15.702   2.635  -4.669
    9    HE2  MET  85           HE3      MET  85  15.154   1.386  -5.780

  No H/Q in entry =           9
  In of MODEL   85
    1    H    LEU  86           H        LEU  86   9.896   2.355  -0.942
    2    HA   LEU  86           HA       LEU  86   9.793   5.167  -1.132
    3    HB2  LEU  86           HB2      LEU  86   7.974   3.480  -1.710
    4    HB3  LEU  86           HB3      LEU  86   7.639   3.390   0.019
    5    HG   LEU  86           HG       LEU  86   7.444   5.949  -0.042
    6   HD11  LEU  86          HD11      LEU  86   8.235   5.516  -2.739
    7   HD13  LEU  86          HD12      LEU  86   7.775   7.039  -1.985
    8   HD12  LEU  86          HD13      LEU  86   6.556   6.057  -2.792
    9   HD23  LEU  86          HD21      LEU  86   5.335   4.562  -1.708
   10   HD22  LEU  86          HD22      LEU  86   5.123   5.822  -0.496
   11   HD21  LEU  86          HD23      LEU  86   5.543   4.185   0.003

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ALA  87           H        ALA  87   9.347   2.990   1.618
    2    HA   ALA  87           HA       ALA  87   8.766   4.902   3.580
    3    HB1  ALA  87           HB1      ALA  87   9.612   2.093   3.505
    4    HB3  ALA  87           HB2      ALA  87   8.472   2.892   4.584
    5    HB2  ALA  87           HB3      ALA  87  10.198   2.948   4.934

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ARG  88           H        ARG  88  11.872   3.517   2.615
    2    HA   ARG  88           HA       ARG  88  13.456   4.921   4.449
    3    HB2  ARG  88           HB2      ARG  88  14.156   2.953   3.053
    4    HB3  ARG  88           HB3      ARG  88  14.298   4.044   1.678
    5    HG2  ARG  88           HG2      ARG  88  15.747   5.384   3.625
    6    HG3  ARG  88           HG3      ARG  88  16.089   3.700   4.010
    7    HD2  ARG  88           HD2      ARG  88  17.366   3.415   2.169
    8    HD3  ARG  88           HD3      ARG  88  16.221   4.268   1.129
    9    HE   ARG  88           HE       ARG  88  18.597   5.367   2.182
   10   HH21  ARG  88          HH11      ARG  88  18.913   7.590   1.982
   11   HH22  ARG  88          HH12      ARG  88  17.548   8.643   1.831
   12   HH11  ARG  88          HH21      ARG  88  15.249   6.074   1.890
   13   HH12  ARG  88          HH22      ARG  88  15.473   7.782   1.754

  No H/Q in entry =          13
  In of MODEL   85
    1    H    GLU  89           H        GLU  89  12.482   5.797   1.119
    2    HA   GLU  89           HA       GLU  89  13.997   8.177   0.961
    3    HB2  GLU  89           HB2      GLU  89  12.874   7.115  -0.987
    4    HB3  GLU  89           HB3      GLU  89  11.320   7.637  -0.336
    5    HG2  GLU  89           HG2      GLU  89  11.990   9.984  -0.503
    6    HG3  GLU  89           HG3      GLU  89  13.602   9.513  -1.033

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LEU  90           H        LEU  90  10.671   7.626   2.081
    2    HA   LEU  90           HA       LEU  90  10.117  10.353   2.647
    3    HB2  LEU  90           HB2      LEU  90   8.954   7.767   3.678
    4    HB3  LEU  90           HB3      LEU  90   8.300   9.354   4.094
    5    HG   LEU  90           HG       LEU  90   8.740   8.472   1.229
    6   HD12  LEU  90          HD11      LEU  90   6.211   8.109   1.284
    7   HD11  LEU  90          HD12      LEU  90   6.360   8.106   3.041
    8   HD13  LEU  90          HD13      LEU  90   7.198   6.885   2.083
    9   HD22  LEU  90          HD21      LEU  90   8.415  10.776   1.148
   10   HD21  LEU  90          HD22      LEU  90   7.423  10.799   2.605
   11   HD23  LEU  90          HD23      LEU  90   6.739  10.230   1.082

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  91           H        ILE  91  11.410   7.695   4.581
    2    HA   ILE  91           HA       ILE  91  11.524   9.068   7.046
    3    HB   ILE  91           HB       ILE  91  13.113   6.748   5.934
    4   HG12  ILE  91          HG12      ILE  91  11.087   6.894   8.187
    5   HG13  ILE  91          HG13      ILE  91  10.626   6.602   6.510
    6   HG22  ILE  91          HG21      ILE  91  13.577   6.548   8.577
    7   HG21  ILE  91          HG22      ILE  91  13.478   8.306   8.470
    8   HG23  ILE  91          HG23      ILE  91  14.671   7.431   7.512
    9   HD13  ILE  91          HD11      ILE  91  11.657   4.514   6.449
   10   HD12  ILE  91          HD12      ILE  91  11.058   4.569   8.107
   11   HD11  ILE  91          HD13      ILE  91  12.756   4.904   7.773

  No H/Q in entry =          11
  In of MODEL   85
    1    H    THR  92           H        THR  92  13.752   8.922   4.302
    2    HA   THR  92           HA       THR  92  15.894  10.348   5.464
    3    HB   THR  92           HB       THR  92  14.919  10.201   2.601
    4    HG1  THR  92           HG1      THR  92  15.775   8.317   3.014
    5   HG22  THR  92          HG21      THR  92  17.480  10.926   2.313
    6   HG21  THR  92          HG22      THR  92  17.156  11.747   3.839
    7   HG23  THR  92          HG23      THR  92  16.185  12.117   2.415

  No H/Q in entry =           7
  In of MODEL   85
    1    H    GLU  93           H        GLU  93  12.997  11.457   3.723
    2    HA   GLU  93           HA       GLU  93  13.553  14.226   3.831
    3    HB2  GLU  93           HB2      GLU  93  10.868  12.816   3.841
    4    HB3  GLU  93           HB3      GLU  93  11.134  14.518   3.465
    5    HG2  GLU  93           HG2      GLU  93  12.507  12.291   1.948
    6    HG3  GLU  93           HG3      GLU  93  10.953  12.951   1.454

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LEU  94           H        LEU  94  11.833  12.052   6.043
    2    HA   LEU  94           HA       LEU  94  10.992  13.992   7.911
    3    HB2  LEU  94           HB2      LEU  94  11.607  11.046   8.195
    4    HB3  LEU  94           HB3      LEU  94  11.018  12.018   9.541
    5    HG   LEU  94           HG       LEU  94   9.541  12.042   6.908
    6   HD11  LEU  94          HD11      LEU  94   9.648   9.828   8.919
    7   HD13  LEU  94          HD12      LEU  94   9.353   9.757   7.183
    8   HD12  LEU  94          HD13      LEU  94   8.064  10.260   8.275
    9   HD23  LEU  94          HD21      LEU  94   7.612  12.420   8.501
   10   HD22  LEU  94          HD22      LEU  94   8.833  13.691   8.538
   11   HD21  LEU  94          HD23      LEU  94   8.783  12.477   9.816

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  95           H        ILE  95  13.992  12.103   7.689
    2    HA   ILE  95           HA       ILE  95  15.140  13.048  10.103
    3    HB   ILE  95           HB       ILE  95  16.401  11.989   7.562
    4   HG12  ILE  95          HG12      ILE  95  16.113  10.792  10.332
    5   HG13  ILE  95          HG13      ILE  95  14.954  10.514   9.034
    6   HG21  ILE  95          HG21      ILE  95  17.637  12.820  10.206
    7   HG23  ILE  95          HG22      ILE  95  18.097  13.350   8.586
    8   HG22  ILE  95          HG23      ILE  95  18.425  11.696   9.100
    9   HD13  ILE  95          HD11      ILE  95  16.455   9.252   7.779
   10   HD12  ILE  95          HD12      ILE  95  16.929   8.814   9.418
   11   HD11  ILE  95          HD13      ILE  95  17.869  10.004   8.518

  No H/Q in entry =          11
  In of MODEL   85
    1    H    GLU  96           H        GLU  96  15.287  14.274   6.766
    2    HA   GLU  96           HA       GLU  96  17.104  16.379   7.242
    3    HB2  GLU  96           HB2      GLU  96  16.455  15.701   4.983
    4    HB3  GLU  96           HB3      GLU  96  14.804  16.236   5.277
    5    HG2  GLU  96           HG2      GLU  96  15.343  18.372   4.731
    6    HG3  GLU  96           HG3      GLU  96  16.638  18.393   5.917

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LEU  97           H        LEU  97  13.594  16.145   7.662
    2    HA   LEU  97           HA       LEU  97  13.139  18.875   8.295
    3    HB2  LEU  97           HB2      LEU  97  11.654  16.330   8.912
    4    HB3  LEU  97           HB3      LEU  97  11.118  17.872   9.578
    5    HG   LEU  97           HG       LEU  97  11.615  17.454   6.615
    6   HD12  LEU  97          HD11      LEU  97   9.094  17.292   6.490
    7   HD11  LEU  97          HD12      LEU  97   9.085  17.097   8.241
    8   HD13  LEU  97          HD13      LEU  97   9.885  15.897   7.225
    9   HD23  LEU  97          HD21      LEU  97   9.850  19.395   6.637
   10   HD22  LEU  97          HD22      LEU  97  11.525  19.778   7.034
   11   HD21  LEU  97          HD23      LEU  97  10.335  19.595   8.321

  No H/Q in entry =          11
  In of MODEL   85
    1    H    HIS  98           H        HIS  98  13.993  16.066  10.301
    2    HA   HIS  98           HA       HIS  98  13.811  17.331  12.813
    3    HB2  HIS  98           HB2      HIS  98  15.594  15.095  11.823
    4    HB3  HIS  98           HB3      HIS  98  15.581  15.638  13.502
    5    HD1  HIS  98           HD1      HIS  98  13.411  13.972  10.909
    6    HD2  HIS  98           HD2      HIS  98  13.280  14.901  14.970
    7    HE1  HIS  98           HE1      HIS  98  11.400  12.752  11.859
    8    HE2  HIS  98           HE2      HIS  98  11.300  13.310  14.328

  No H/Q in entry =           8
  In of MODEL   85
    1    H    GLU  99           H        GLU  99  16.373  17.244  10.386
    2    HA   GLU  99           HA       GLU  99  18.336  18.606  11.917
    3    HB2  GLU  99           HB2      GLU  99  18.838  17.319   9.852
    4    HB3  GLU  99           HB3      GLU  99  18.014  18.561   8.906
    5    HG2  GLU  99           HG2      GLU  99  19.598  20.255   9.696
    6    HG3  GLU  99           HG3      GLU  99  20.390  19.066  10.725

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LYS 100           H        LYS 100  15.803  19.729   9.690
    2    HA   LYS 100           HA       LYS 100  16.564  22.477   9.829
    3    HB2  LYS 100           HB2      LYS 100  13.950  21.151   9.071
    4    HB3  LYS 100           HB3      LYS 100  14.227  22.893   8.976
    5    HG2  LYS 100           HG2      LYS 100  16.209  22.466   7.516
    6    HG3  LYS 100           HG3      LYS 100  15.818  20.744   7.537
    7    HD2  LYS 100           HD2      LYS 100  13.619  21.222   6.530
    8    HD3  LYS 100           HD3      LYS 100  13.993  22.946   6.516
    9    HE2  LYS 100           HE2      LYS 100  15.962  22.487   5.063
   10    HE3  LYS 100           HE3      LYS 100  15.519  20.777   5.033
   11    HZ1  LYS 100           HZ1      LYS 100  13.668  22.943   4.187
   12    HZ3  LYS 100           HZ2      LYS 100  13.507  21.270   3.929
   13    HZ2  LYS 100           HZ3      LYS 100  14.708  22.146   3.108

  No H/Q in entry =          13
  In of MODEL   85
    1    H    LEU 101           H        LEU 101  14.488  20.408  11.794
    2    HA   LEU 101           HA       LEU 101  13.291  22.465  13.364
    3    HB2  LEU 101           HB2      LEU 101  13.770  19.523  13.756
    4    HB3  LEU 101           HB3      LEU 101  13.218  20.499  15.113
    5    HG   LEU 101           HG       LEU 101  11.806  20.562  12.440
    6   HD12  LEU 101          HD11      LEU 101  10.164  18.980  13.709
    7   HD11  LEU 101          HD12      LEU 101  11.561  18.588  14.708
    8   HD13  LEU 101          HD13      LEU 101  11.603  18.277  12.972
    9   HD21  LEU 101          HD21      LEU 101  11.131  21.354  15.289
   10   HD23  LEU 101          HD22      LEU 101   9.876  21.109  14.075
   11   HD22  LEU 101          HD23      LEU 101  11.096  22.359  13.838

  No H/Q in entry =          11
  In of MODEL   85
    1    H    LYS 102           H        LYS 102  16.447  21.897  12.937
    2    HA   LYS 102           HA       LYS 102  18.279  22.794  14.012
    3    HB2  LYS 102           HB2      LYS 102  16.443  24.289  15.137
    4    HB3  LYS 102           HB3      LYS 102  16.660  23.233  16.517
    5    HG2  LYS 102           HG2      LYS 102  18.530  25.265  15.347
    6    HG3  LYS 102           HG3      LYS 102  18.147  24.950  17.026
    7    HD2  LYS 102           HD2      LYS 102  19.843  23.054  15.350
    8    HD3  LYS 102           HD3      LYS 102  20.513  24.388  16.281
    9    HE2  LYS 102           HE2      LYS 102  20.145  21.837  17.255
   10    HE3  LYS 102           HE3      LYS 102  20.342  23.284  18.243
   11    HZ2  LYS 102           HZ1      LYS 102  18.389  21.976  18.859
   12    HZ1  LYS 102           HZ2      LYS 102  17.746  22.194  17.308
   13    HZ3  LYS 102           HZ3      LYS 102  17.956  23.529  18.331

  No H/Q in entry =          13
  In of MODEL   85
    1    H    ALA 103           H        ALA 103  16.222  21.169  16.433
    2    HA   ALA 103           HA       ALA 103  17.960  19.984  18.095
    3    HB2  ALA 103           HB1      ALA 103  16.401  17.957  18.091
    4    HB1  ALA 103           HB2      ALA 103  15.498  18.796  16.829
    5    HB3  ALA 103           HB3      ALA 103  15.663  19.523  18.426

  No H/Q in entry =           5
  In of MODEL   85
    1    H1   ALA   1           H3       ALA   1  -1.521  -7.221 -21.508
    2    H2   ALA   1           H2       ALA   1  -2.299  -8.665 -21.054
    3    H3   ALA   1           H1       ALA   1  -0.689  -8.696 -21.604
    4    HA   ALA   1           HA       ALA   1  -1.512  -9.181 -23.601
    5    HB1  ALA   1           HB1      ALA   1  -3.641  -9.924 -23.132
    6    HB2  ALA   1           HB2      ALA   1  -4.096  -8.421 -23.934
    7    HB3  ALA   1           HB3      ALA   1  -4.039  -8.496 -22.175

  No H/Q in entry =           7
  In of MODEL   85
    1    H    GLU   2           H        GLU   2  -2.351  -8.006 -25.596
    2    HA   GLU   2           HA       GLU   2  -0.974  -5.977 -26.475
    3    HB2  GLU   2           HB2      GLU   2  -3.979  -6.081 -26.801
    4    HB3  GLU   2           HB3      GLU   2  -2.866  -5.207 -27.849
    5    HG2  GLU   2           HG2      GLU   2  -2.337  -7.094 -28.998
    6    HG3  GLU   2           HG3      GLU   2  -2.032  -7.992 -27.517

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLU   3           H        GLU   3  -4.152  -4.757 -25.586
    2    HA   GLU   3           HA       GLU   3  -3.139  -2.186 -24.961
    3    HB2  GLU   3           HB2      GLU   3  -5.811  -3.533 -24.634
    4    HB3  GLU   3           HB3      GLU   3  -5.535  -1.913 -23.990
    5    HG2  GLU   3           HG2      GLU   3  -5.184  -0.987 -26.118
    6    HG3  GLU   3           HG3      GLU   3  -4.768  -2.539 -26.837

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LEU   4           H        LEU   4  -4.707  -4.559 -22.780
    2    HA   LEU   4           HA       LEU   4  -4.364  -3.321 -20.391
    3    HB2  LEU   4           HB2      LEU   4  -3.784  -6.257 -20.852
    4    HB3  LEU   4           HB3      LEU   4  -4.203  -5.512 -19.311
    5    HG   LEU   4           HG       LEU   4  -5.968  -5.613 -21.780
    6   HD13  LEU   4          HD11      LEU   4  -7.143  -7.342 -20.782
    7   HD12  LEU   4          HD12      LEU   4  -6.668  -6.873 -19.150
    8   HD11  LEU   4          HD13      LEU   4  -5.519  -7.705 -20.197
    9   HD23  LEU   4          HD21      LEU   4  -7.668  -4.818 -19.919
   10   HD22  LEU   4          HD22      LEU   4  -6.641  -3.636 -20.730
   11   HD21  LEU   4          HD23      LEU   4  -6.213  -4.217 -19.121

  No H/Q in entry =          11
  In of MODEL   85
    1    H    GLU   5           H        GLU   5  -1.839  -5.138 -22.111
    2    HA   GLU   5           HA       GLU   5   0.135  -4.825 -20.069
    3    HB2  GLU   5           HB2      GLU   5   0.219  -6.596 -21.825
    4    HB3  GLU   5           HB3      GLU   5   0.539  -5.348 -23.028
    5    HG2  GLU   5           HG2      GLU   5   2.663  -6.274 -22.373
    6    HG3  GLU   5           HG3      GLU   5   2.551  -4.666 -21.660

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLU   6           H        GLU   6  -0.512  -3.126 -23.120
    2    HA   GLU   6           HA       GLU   6   1.635  -1.268 -22.850
    3    HB2  GLU   6           HB2      GLU   6  -0.832  -1.450 -24.544
    4    HB3  GLU   6           HB3      GLU   6   0.069   0.064 -24.490
    5    HG2  GLU   6           HG2      GLU   6   0.927  -1.257 -26.330
    6    HG3  GLU   6           HG3      GLU   6   2.147  -1.229 -25.059

  No H/Q in entry =           6
  In of MODEL   85
    1    H    VAL   7           H        VAL   7  -1.705  -1.377 -21.814
    2    HA   VAL   7           HA       VAL   7  -1.962   1.334 -20.985
    3    HB   VAL   7           HB       VAL   7  -3.396  -1.199 -20.147
    4   HG11  VAL   7          HG11      VAL   7  -3.809   1.687 -19.341
    5   HG13  VAL   7          HG12      VAL   7  -3.695   0.266 -18.302
    6   HG12  VAL   7          HG13      VAL   7  -5.127   0.516 -19.299
    7   HG21  VAL   7          HG21      VAL   7  -3.559  -0.130 -22.538
    8   HG23  VAL   7          HG22      VAL   7  -4.522   1.109 -21.732
    9   HG22  VAL   7          HG23      VAL   7  -5.047  -0.575 -21.703

  No H/Q in entry =           9
  In of MODEL   85
    1    H    VAL   8           H        VAL   8  -0.943  -1.635 -19.332
    2    HA   VAL   8           HA       VAL   8  -0.646  -0.546 -16.738
    3    HB   VAL   8           HB       VAL   8   0.788  -2.848 -18.085
    4   HG11  VAL   8          HG11      VAL   8   0.859  -1.781 -15.264
    5   HG13  VAL   8          HG12      VAL   8   2.209  -2.250 -16.298
    6   HG12  VAL   8          HG13      VAL   8   1.167  -3.486 -15.596
    7   HG22  VAL   8          HG21      VAL   8  -0.968  -4.185 -17.391
    8   HG21  VAL   8          HG22      VAL   8  -1.860  -2.667 -17.405
    9   HG23  VAL   8          HG23      VAL   8  -1.193  -3.278 -15.895

  No H/Q in entry =           9
  In of MODEL   85
    1    H    MET   9           H        MET   9   1.615  -0.826 -19.478
    2    HA   MET   9           HA       MET   9   3.885   0.247 -18.213
    3    HB2  MET   9           HB2      MET   9   2.943   0.249 -21.078
    4    HB3  MET   9           HB3      MET   9   4.443   1.046 -20.604
    5    HG2  MET   9           HG2      MET   9   4.907  -1.259 -19.386
    6    HG3  MET   9           HG3      MET   9   3.753  -1.871 -20.573
    7    HE2  MET   9           HE1      MET   9   4.777   0.778 -22.792
    8    HE1  MET   9           HE2      MET   9   3.771  -0.662 -22.907
    9    HE3  MET   9           HE3      MET   9   5.222  -0.528 -23.897

  No H/Q in entry =           9
  In of MODEL   85
    1    H    GLY  10           H        GLY  10   1.187   1.814 -19.901
    2    HA3  GLY  10           HA2      GLY  10   2.119   4.479 -19.660
    3    HA2  GLY  10           HA3      GLY  10   0.435   3.999 -19.869

  No H/Q in entry =           3
  In of MODEL   85
    1    H    LEU  11           H        LEU  11   0.047   2.473 -17.580
    2    HA   LEU  11           HA       LEU  11  -0.510   4.448 -15.626
    3    HB2  LEU  11           HB2      LEU  11  -0.409   1.434 -15.463
    4    HB3  LEU  11           HB3      LEU  11  -0.933   2.454 -14.124
    5    HG   LEU  11           HG       LEU  11  -2.166   2.548 -16.891
    6   HD13  LEU  11          HD11      LEU  11  -2.728   0.400 -16.133
    7   HD12  LEU  11          HD12      LEU  11  -4.091   1.378 -15.593
    8   HD11  LEU  11          HD13      LEU  11  -2.832   0.914 -14.448
    9   HD22  LEU  11          HD21      LEU  11  -2.782   4.559 -15.890
   10   HD21  LEU  11          HD22      LEU  11  -2.703   3.897 -14.258
   11   HD23  LEU  11          HD23      LEU  11  -4.072   3.514 -15.302

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  12           H        ILE  12   2.061   2.009 -15.857
    2    HA   ILE  12           HA       ILE  12   3.254   2.565 -13.352
    3    HB   ILE  12           HB       ILE  12   4.491   1.512 -15.917
    4   HG12  ILE  12          HG12      ILE  12   2.546   0.254 -14.718
    5   HG13  ILE  12          HG13      ILE  12   3.972  -0.659 -15.163
    6   HG21  ILE  12          HG21      ILE  12   5.548   1.556 -13.071
    7   HG23  ILE  12          HG22      ILE  12   6.270   2.321 -14.486
    8   HG22  ILE  12          HG23      ILE  12   6.233   0.564 -14.356
    9   HD12  ILE  12          HD11      ILE  12   3.167  -1.161 -12.868
   10   HD11  ILE  12          HD12      ILE  12   3.424   0.527 -12.431
   11   HD13  ILE  12          HD13      ILE  12   4.785  -0.482 -12.864

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  13           H        ILE  13   3.849   3.828 -16.610
    2    HA   ILE  13           HA       ILE  13   5.966   5.573 -15.884
    3    HB   ILE  13           HB       ILE  13   3.939   5.629 -18.134
    4   HG12  ILE  13          HG12      ILE  13   5.800   3.809 -17.842
    5   HG13  ILE  13          HG13      ILE  13   5.536   4.532 -19.424
    6   HG23  ILE  13          HG21      ILE  13   4.546   7.866 -18.142
    7   HG22  ILE  13          HG22      ILE  13   5.819   7.199 -19.157
    8   HG21  ILE  13          HG23      ILE  13   6.145   7.556 -17.462
    9   HD12  ILE  13          HD11      ILE  13   7.984   4.382 -18.690
   10   HD11  ILE  13          HD12      ILE  13   7.590   5.582 -17.464
   11   HD13  ILE  13          HD13      ILE  13   7.431   5.986 -19.169

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ASN  14           H        ASN  14   2.455   6.029 -16.161
    2    HA   ASN  14           HA       ASN  14   2.381   8.776 -15.530
    3    HB2  ASN  14           HB2      ASN  14   0.508   7.112 -16.361
    4    HB3  ASN  14           HB3      ASN  14   0.185   6.933 -14.641
    5   HD21  ASN  14          HD21      ASN  14  -1.844   8.064 -16.080
    6   HD22  ASN  14          HD22      ASN  14  -1.926   9.737 -15.817

  No H/Q in entry =           6
  In of MODEL   85
    1    H    SER  15           H        SER  15   2.113   5.900 -13.448
    2    HA   SER  15           HA       SER  15   1.786   7.272 -11.003
    3    HB2  SER  15           HB2      SER  15   2.354   5.195  -9.948
    4    HB3  SER  15           HB3      SER  15   1.535   4.763 -11.445
    5    HG   SER  15           HG       SER  15   3.321   3.593 -11.594

  No H/Q in entry =           5
  In of MODEL   85
    1    H    GLY  16           H        GLY  16   4.677   6.204 -12.754
    2    HA3  GLY  16           HA2      GLY  16   6.590   6.986 -10.820
    3    HA2  GLY  16           HA3      GLY  16   6.899   6.783 -12.543

  No H/Q in entry =           3
  In of MODEL   85
    1    H    GLN  17           H        GLN  17   5.190   8.719 -13.614
    2    HA   GLN  17           HA       GLN  17   6.739  11.080 -13.308
    3    HB2  GLN  17           HB2      GLN  17   5.440  10.595 -15.354
    4    HB3  GLN  17           HB3      GLN  17   3.941  10.767 -14.439
    5    HG2  GLN  17           HG2      GLN  17   4.526  13.105 -13.910
    6    HG3  GLN  17           HG3      GLN  17   6.022  12.937 -14.827
    7   HE21  GLN  17          HE21      GLN  17   5.850  13.724 -16.926
    8   HE22  GLN  17          HE22      GLN  17   4.421  13.752 -17.841

  No H/Q in entry =           8
  In of MODEL   85
    1    H    ALA  18           H        ALA  18   3.648  10.028 -11.963
    2    HA   ALA  18           HA       ALA  18   2.892  12.411 -10.704
    3    HB1  ALA  18           HB1      ALA  18   1.792   9.941 -10.923
    4    HB2  ALA  18           HB2      ALA  18   1.227  11.156  -9.780
    5    HB3  ALA  18           HB3      ALA  18   2.331   9.889  -9.245

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ARG  19           H        ARG  19   4.796   9.674  -9.415
    2    HA   ARG  19           HA       ARG  19   5.309  10.844  -6.894
    3    HB2  ARG  19           HB2      ARG  19   5.754   8.445  -7.415
    4    HB3  ARG  19           HB3      ARG  19   7.106   8.945  -8.434
    5    HG2  ARG  19           HG2      ARG  19   8.208  10.003  -6.512
    6    HG3  ARG  19           HG3      ARG  19   6.835   9.600  -5.482
    7    HD2  ARG  19           HD2      ARG  19   8.616   7.988  -5.117
    8    HD3  ARG  19           HD3      ARG  19   7.254   7.187  -5.904
    9    HE   ARG  19           HE       ARG  19   8.952   8.022  -7.949
   10   HH21  ARG  19          HH11      ARG  19  10.532   6.635  -8.793
   11   HH22  ARG  19          HH12      ARG  19  11.092   5.296  -7.853
   12   HH11  ARG  19          HH21      ARG  19   9.044   5.999  -5.166
   13   HH12  ARG  19          HH22      ARG  19  10.246   4.935  -5.799

  No H/Q in entry =          13
  In of MODEL   85
    1    H    SER  20           H        SER  20   7.132  10.889  -9.939
    2    HA   SER  20           HA       SER  20   9.357  12.335  -9.113
    3    HB2  SER  20           HB2      SER  20   9.412  11.459 -11.314
    4    HB3  SER  20           HB3      SER  20   7.896  12.243 -11.747
    5    HG   SER  20           HG       SER  20  10.477  13.284 -11.535

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LEU  21           H        LEU  21   6.245  13.561 -10.320
    2    HA   LEU  21           HA       LEU  21   6.879  16.316 -10.101
    3    HB2  LEU  21           HB2      LEU  21   4.230  14.857 -10.024
    4    HB3  LEU  21           HB3      LEU  21   4.373  16.613 -10.030
    5    HG   LEU  21           HG       LEU  21   5.601  14.834 -12.156
    6   HD13  LEU  21          HD11      LEU  21   3.701  15.366 -13.560
    7   HD12  LEU  21          HD12      LEU  21   3.025  16.424 -12.320
    8   HD11  LEU  21          HD13      LEU  21   3.090  14.683 -12.053
    9   HD22  LEU  21          HD21      LEU  21   6.711  16.892 -12.316
   10   HD21  LEU  21          HD22      LEU  21   5.317  17.817 -11.764
   11   HD23  LEU  21          HD23      LEU  21   5.348  17.168 -13.397

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ALA  22           H        ALA  22   5.393  14.012  -7.850
    2    HA   ALA  22           HA       ALA  22   4.761  15.816  -5.789
    3    HB3  ALA  22           HB1      ALA  22   4.033  13.413  -5.948
    4    HB2  ALA  22           HB2      ALA  22   4.611  13.897  -4.353
    5    HB1  ALA  22           HB3      ALA  22   5.649  12.950  -5.420

  No H/Q in entry =           5
  In of MODEL   85
    1    H    TYR  23           H        TYR  23   7.723  13.830  -6.216
    2    HA   TYR  23           HA       TYR  23   9.087  14.873  -3.963
    3    HB2  TYR  23           HB2      TYR  23   9.904  12.874  -5.115
    4    HB3  TYR  23           HB3      TYR  23  10.207  13.812  -6.576
    5    HD1  TYR  23           HD1      TYR  23  11.161  13.517  -2.976
    6    HD2  TYR  23           HD2      TYR  23  12.234  14.993  -6.866
    7    HE1  TYR  23           HE1      TYR  23  13.409  14.128  -2.125
    8    HE2  TYR  23           HE2      TYR  23  14.481  15.605  -6.013
    9    HH   TYR  23           HH       TYR  23  15.634  16.028  -4.011

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ALA  24           H        ALA  24   8.896  15.969  -7.332
    2    HA   ALA  24           HA       ALA  24  10.761  18.082  -7.087
    3    HB2  ALA  24           HB1      ALA  24  10.322  18.133  -9.297
    4    HB3  ALA  24           HB2      ALA  24   8.756  18.861  -8.943
    5    HB1  ALA  24           HB3      ALA  24   8.907  17.109  -9.068

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ALA  25           H        ALA  25   7.284  17.848  -6.473
    2    HA   ALA  25           HA       ALA  25   6.763  20.561  -5.911
    3    HB1  ALA  25           HB1      ALA  25   5.132  18.537  -6.111
    4    HB2  ALA  25           HB2      ALA  25   4.742  19.823  -4.967
    5    HB3  ALA  25           HB3      ALA  25   5.453  18.314  -4.391

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LEU  26           H        LEU  26   7.866  17.902  -3.853
    2    HA   LEU  26           HA       LEU  26   7.945  19.340  -1.419
    3    HB2  LEU  26           HB2      LEU  26   8.076  16.925  -1.407
    4    HB3  LEU  26           HB3      LEU  26   9.548  16.953  -2.375
    5    HG   LEU  26           HG       LEU  26  10.742  18.094  -0.535
    6   HD12  LEU  26          HD11      LEU  26   9.511  18.088   1.722
    7   HD11  LEU  26          HD12      LEU  26   8.028  17.926   0.785
    8   HD13  LEU  26          HD13      LEU  26   9.051  19.347   0.575
    9   HD21  LEU  26          HD21      LEU  26   9.244  15.605   0.341
   10   HD23  LEU  26          HD22      LEU  26  10.750  16.192   1.040
   11   HD22  LEU  26          HD23      LEU  26  10.716  15.628  -0.629

  No H/Q in entry =          11
  In of MODEL   85
    1    H    LYS  27           H        LYS  27  10.375  18.799  -3.937
    2    HA   LYS  27           HA       LYS  27  12.537  20.076  -2.708
    3    HB2  LYS  27           HB2      LYS  27  12.664  18.726  -4.794
    4    HB3  LYS  27           HB3      LYS  27  11.880  20.043  -5.664
    5    HG2  LYS  27           HG2      LYS  27  13.721  21.559  -5.087
    6    HG3  LYS  27           HG3      LYS  27  14.499  20.282  -4.145
    7    HD2  LYS  27           HD2      LYS  27  14.669  18.892  -6.195
    8    HD3  LYS  27           HD3      LYS  27  13.935  20.196  -7.129
    9    HE2  LYS  27           HE2      LYS  27  15.798  21.693  -6.516
   10    HE3  LYS  27           HE3      LYS  27  16.535  20.393  -5.573
   11    HZ3  LYS  27           HZ1      LYS  27  17.528  20.503  -7.758
   12    HZ2  LYS  27           HZ2      LYS  27  16.005  20.358  -8.502
   13    HZ1  LYS  27           HZ3      LYS  27  16.647  19.060  -7.613

  No H/Q in entry =          13
  In of MODEL   85
    1    H    GLN  28           H        GLN  28   9.897  21.411  -4.665
    2    HA   GLN  28           HA       GLN  28  10.814  24.078  -4.823
    3    HB2  GLN  28           HB2      GLN  28   8.001  22.957  -4.719
    4    HB3  GLN  28           HB3      GLN  28   8.381  24.640  -5.087
    5    HG2  GLN  28           HG2      GLN  28   9.733  23.926  -7.014
    6    HG3  GLN  28           HG3      GLN  28   9.391  22.238  -6.639
    7   HE21  GLN  28          HE21      GLN  28   8.634  23.572  -9.138
    8   HE22  GLN  28          HE22      GLN  28   6.939  23.553  -9.212

  No H/Q in entry =           8
  In of MODEL   85
    1    H    ALA  29           H        ALA  29   8.905  22.362  -2.386
    2    HA   ALA  29           HA       ALA  29   8.317  24.549  -0.711
    3    HB2  ALA  29           HB1      ALA  29   7.610  22.972   0.859
    4    HB1  ALA  29           HB2      ALA  29   8.852  21.807   0.400
    5    HB3  ALA  29           HB3      ALA  29   7.463  22.075  -0.652

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LYS  30           H        LYS  30  11.084  22.326  -0.770
    2    HA   LYS  30           HA       LYS  30  12.381  23.307   1.533
    3    HB2  LYS  30           HB2      LYS  30  13.504  22.033  -0.971
    4    HB3  LYS  30           HB3      LYS  30  14.477  22.412   0.451
    5    HG2  LYS  30           HG2      LYS  30  12.944  21.007   1.831
    6    HG3  LYS  30           HG3      LYS  30  12.069  20.567   0.361
    7    HD2  LYS  30           HD2      LYS  30  14.131  19.612  -0.594
    8    HD3  LYS  30           HD3      LYS  30  15.025  20.066   0.859
    9    HE2  LYS  30           HE2      LYS  30  13.542  18.614   2.214
   10    HE3  LYS  30           HE3      LYS  30  12.678  18.140   0.745
   11    HZ2  LYS  30           HZ1      LYS  30  14.494  16.593   1.514
   12    HZ1  LYS  30           HZ2      LYS  30  15.612  17.798   1.062
   13    HZ3  LYS  30           HZ3      LYS  30  14.590  17.094  -0.103

  No H/Q in entry =          13
  In of MODEL   85
    1    H    GLN  31           H        GLN  31  12.259  24.502  -1.767
    2    HA   GLN  31           HA       GLN  31  14.380  26.431  -1.346
    3    HB2  GLN  31           HB2      GLN  31  12.341  26.438  -3.574
    4    HB3  GLN  31           HB3      GLN  31  13.949  27.161  -3.574
    5    HG2  GLN  31           HG2      GLN  31  14.454  24.474  -2.991
    6    HG3  GLN  31           HG3      GLN  31  13.154  24.396  -4.172
    7   HE21  GLN  31          HE21      GLN  31  16.011  23.648  -4.568
    8   HE22  GLN  31          HE22      GLN  31  16.569  24.628  -5.836

  No H/Q in entry =           8
  In of MODEL   85
    1    H    GLY  32           H        GLY  32  11.307  26.201  -0.206
    2    HA3  GLY  32           HA2      GLY  32  10.122  27.753   1.061
    3    HA2  GLY  32           HA3      GLY  32  11.228  29.005   0.510

  No H/Q in entry =           3
  In of MODEL   85
    1    H    ASP  33           H        ASP  33   9.900  27.073  -1.980
    2    HA   ASP  33           HA       ASP  33   8.200  29.316  -2.844
    3    HB2  ASP  33           HB2      ASP  33   9.336  26.911  -4.278
    4    HB3  ASP  33           HB3      ASP  33   8.168  28.006  -5.014

  No H/Q in entry =           4
  In of MODEL   85
    1    H    PHE  34           H        PHE  34   6.517  28.816  -1.283
    2    HA   PHE  34           HA       PHE  34   5.178  26.322  -1.183
    3    HB2  PHE  34           HB2      PHE  34   4.170  29.095  -0.513
    4    HB3  PHE  34           HB3      PHE  34   3.345  27.591  -0.099
    5    HD1  PHE  34           HD1      PHE  34   5.553  30.030   1.113
    6    HD2  PHE  34           HD2      PHE  34   4.943  25.778   1.069
    7    HE1  PHE  34           HE1      PHE  34   6.944  29.807   3.153
    8    HE2  PHE  34           HE2      PHE  34   6.336  25.560   3.107
    9    HZ   PHE  34           HZ       PHE  34   7.330  27.575   4.149

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ALA  35           H        ALA  35   4.704  29.173  -3.202
    2    HA   ALA  35           HA       ALA  35   2.166  28.514  -4.231
    3    HB3  ALA  35           HB1      ALA  35   3.198  29.919  -6.270
    4    HB2  ALA  35           HB2      ALA  35   4.408  30.303  -5.045
    5    HB1  ALA  35           HB3      ALA  35   2.710  30.685  -4.758

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ALA  36           H        ALA  36   5.407  27.891  -5.577
    2    HA   ALA  36           HA       ALA  36   4.447  26.440  -7.819
    3    HB3  ALA  36           HB1      ALA  36   6.605  26.599  -8.431
    4    HB2  ALA  36           HB2      ALA  36   7.100  25.582  -7.077
    5    HB1  ALA  36           HB3      ALA  36   6.965  27.328  -6.866

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ALA  37           H        ALA  37   5.413  25.470  -4.560
    2    HA   ALA  37           HA       ALA  37   5.401  22.680  -4.982
    3    HB2  ALA  37           HB1      ALA  37   5.106  24.473  -2.609
    4    HB1  ALA  37           HB2      ALA  37   6.261  23.173  -2.895
    5    HB3  ALA  37           HB3      ALA  37   4.605  22.793  -2.427

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LYS  38           H        LYS  38   2.830  24.849  -3.824
    2    HA   LYS  38           HA       LYS  38   0.760  23.002  -3.601
    3    HB2  LYS  38           HB2      LYS  38   1.066  25.764  -3.356
    4    HB3  LYS  38           HB3      LYS  38  -0.129  25.593  -4.637
    5    HG2  LYS  38           HG2      LYS  38  -1.559  24.250  -3.194
    6    HG3  LYS  38           HG3      LYS  38  -0.316  24.213  -1.935
    7    HD2  LYS  38           HD2      LYS  38  -0.542  26.548  -1.494
    8    HD3  LYS  38           HD3      LYS  38  -1.455  26.818  -2.979
    9    HE2  LYS  38           HE2      LYS  38  -2.963  26.832  -1.042
   10    HE3  LYS  38           HE3      LYS  38  -3.312  25.447  -2.081
   11    HZ3  LYS  38           HZ1      LYS  38  -2.565  23.992  -0.543
   12    HZ2  LYS  38           HZ2      LYS  38  -2.939  25.246   0.542
   13    HZ1  LYS  38           HZ3      LYS  38  -1.339  25.021   0.021

  No H/Q in entry =          13
  In of MODEL   85
    1    H    ALA  39           H        ALA  39   1.714  24.913  -6.453
    2    HA   ALA  39           HA       ALA  39  -0.344  24.007  -8.157
    3    HB2  ALA  39           HB1      ALA  39   2.383  24.698  -9.207
    4    HB1  ALA  39           HB2      ALA  39   1.394  25.945  -8.447
    5    HB3  ALA  39           HB3      ALA  39   0.798  25.094  -9.873

  No H/Q in entry =           5
  In of MODEL   85
    1    H    MET  40           H        MET  40   2.914  22.764  -7.568
    2    HA   MET  40           HA       MET  40   2.854  20.737  -9.555
    3    HB2  MET  40           HB2      MET  40   4.457  20.994  -7.004
    4    HB3  MET  40           HB3      MET  40   4.731  19.739  -8.215
    5    HG2  MET  40           HG2      MET  40   4.740  22.694  -8.887
    6    HG3  MET  40           HG3      MET  40   6.200  21.817  -8.433
    7    HE3  MET  40           HE1      MET  40   7.115  19.610 -11.234
    8    HE2  MET  40           HE2      MET  40   6.554  19.285  -9.597
    9    HE1  MET  40           HE3      MET  40   7.627  20.650  -9.898

  No H/Q in entry =           9
  In of MODEL   85
    1    H    MET  41           H        MET  41   1.932  20.773  -6.133
    2    HA   MET  41           HA       MET  41   1.446  18.000  -5.849
    3    HB2  MET  41           HB2      MET  41   0.071  20.338  -4.506
    4    HB3  MET  41           HB3      MET  41  -0.058  18.659  -3.995
    5    HG2  MET  41           HG2      MET  41   2.649  18.928  -4.027
    6    HG3  MET  41           HG3      MET  41   2.179  20.580  -3.636
    7    HE2  MET  41           HE1      MET  41  -0.842  19.280  -1.914
    8    HE1  MET  41           HE2      MET  41  -0.050  20.805  -2.293
    9    HE3  MET  41           HE3      MET  41  -0.103  20.238  -0.624

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ASP  42           H        ASP  42  -0.637  20.687  -6.834
    2    HA   ASP  42           HA       ASP  42  -3.054  19.285  -6.972
    3    HB2  ASP  42           HB2      ASP  42  -2.391  21.866  -7.233
    4    HB3  ASP  42           HB3      ASP  42  -2.531  21.464  -8.941

  No H/Q in entry =           4
  In of MODEL   85
    1    H    GLN  43           H        GLN  43  -0.619  19.911  -9.470
    2    HA   GLN  43           HA       GLN  43  -1.979  18.563 -11.559
    3    HB2  GLN  43           HB2      GLN  43   0.970  19.131 -11.173
    4    HB3  GLN  43           HB3      GLN  43   0.270  18.475 -12.655
    5    HG2  GLN  43           HG2      GLN  43  -1.276  20.476 -12.704
    6    HG3  GLN  43           HG3      GLN  43  -0.337  21.151 -11.376
    7   HE21  GLN  43          HE21      GLN  43  -0.200  22.769 -13.466
    8   HE22  GLN  43          HE22      GLN  43   1.220  22.570 -14.370

  No H/Q in entry =           8
  In of MODEL   85
    1    H    SER  44           H        SER  44   0.387  17.469  -9.161
    2    HA   SER  44           HA       SER  44   0.768  14.866 -10.179
    3    HB2  SER  44           HB2      SER  44   1.634  16.326  -7.944
    4    HB3  SER  44           HB3      SER  44   0.794  14.929  -7.272
    5    HG   SER  44           HG       SER  44   2.917  14.345  -7.693

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ARG  45           H        ARG  45  -1.579  16.150  -7.849
    2    HA   ARG  45           HA       ARG  45  -2.925  13.767  -7.210
    3    HB2  ARG  45           HB2      ARG  45  -3.163  15.934  -6.025
    4    HB3  ARG  45           HB3      ARG  45  -4.028  16.583  -7.415
    5    HG2  ARG  45           HG2      ARG  45  -5.764  14.827  -7.131
    6    HG3  ARG  45           HG3      ARG  45  -4.912  14.233  -5.704
    7    HD2  ARG  45           HD2      ARG  45  -5.161  16.499  -4.654
    8    HD3  ARG  45           HD3      ARG  45  -6.154  16.998  -6.040
    9    HE   ARG  45           HE       ARG  45  -7.224  14.605  -4.996
   10   HH21  ARG  45          HH11      ARG  45  -9.063  14.651  -3.729
   11   HH22  ARG  45          HH12      ARG  45  -9.486  16.086  -2.865
   12   HH11  ARG  45          HH21      ARG  45  -6.738  17.863  -3.979
   13   HH12  ARG  45          HH22      ARG  45  -8.163  17.905  -3.005

  No H/Q in entry =          13
  In of MODEL   85
    1    H    MET  46           H        MET  46  -3.546  16.154  -9.768
    2    HA   MET  46           HA       MET  46  -5.862  14.938 -10.832
    3    HB2  MET  46           HB2      MET  46  -3.792  16.801 -12.003
    4    HB3  MET  46           HB3      MET  46  -5.157  16.215 -12.958
    5    HG2  MET  46           HG2      MET  46  -6.728  17.116 -11.306
    6    HG3  MET  46           HG3      MET  46  -5.390  17.653 -10.297
    7    HE1  MET  46           HE1      MET  46  -7.258  17.749 -13.458
    8    HE3  MET  46           HE2      MET  46  -5.806  18.011 -14.416
    9    HE2  MET  46           HE3      MET  46  -6.970  19.320 -14.217

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ALA  47           H        ALA  47  -2.424  14.518 -11.581
    2    HA   ALA  47           HA       ALA  47  -2.733  12.779 -13.788
    3    HB3  ALA  47           HB1      ALA  47  -0.573  13.708 -13.434
    4    HB2  ALA  47           HB2      ALA  47  -0.401  11.984 -13.096
    5    HB1  ALA  47           HB3      ALA  47  -0.518  13.137 -11.766

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LEU  48           H        LEU  48  -2.460  12.157 -10.312
    2    HA   LEU  48           HA       LEU  48  -2.502   9.316 -10.463
    3    HB2  LEU  48           HB2      LEU  48  -3.306  11.225  -8.256
    4    HB3  LEU  48           HB3      LEU  48  -3.180   9.477  -8.051
    5    HG   LEU  48           HG       LEU  48  -0.910  11.215  -9.048
    6   HD13  LEU  48          HD11      LEU  48  -1.212  11.986  -6.859
    7   HD12  LEU  48          HD12      LEU  48  -0.025  10.700  -6.655
    8   HD11  LEU  48          HD13      LEU  48  -1.719  10.407  -6.260
    9   HD22  LEU  48          HD21      LEU  48  -0.371   9.037  -9.682
   10   HD21  LEU  48          HD22      LEU  48  -1.230   8.310  -8.326
   11   HD23  LEU  48          HD23      LEU  48   0.328   9.092  -8.064

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ASN  49           H        ASN  49  -5.011  11.764 -10.073
    2    HA   ASN  49           HA       ASN  49  -7.168  10.061  -9.534
    3    HB2  ASN  49           HB2      ASN  49  -7.266  12.485  -9.217
    4    HB3  ASN  49           HB3      ASN  49  -7.112  12.741 -10.951
    5   HD21  ASN  49          HD21      ASN  49  -9.336  13.790  -9.617
    6   HD22  ASN  49          HD22      ASN  49 -10.725  12.927 -10.065

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLU  50           H        GLU  50  -5.903  11.273 -12.622
    2    HA   GLU  50           HA       GLU  50  -7.831   9.978 -14.269
    3    HB2  GLU  50           HB2      GLU  50  -6.397  11.821 -15.084
    4    HB3  GLU  50           HB3      GLU  50  -4.984  10.775 -14.940
    5    HG2  GLU  50           HG2      GLU  50  -5.926   9.218 -16.575
    6    HG3  GLU  50           HG3      GLU  50  -7.404  10.169 -16.668

  No H/Q in entry =           6
  In of MODEL   85
    1    H    ALA  51           H        ALA  51  -4.646   9.047 -13.053
    2    HA   ALA  51           HA       ALA  51  -4.459   6.593 -14.465
    3    HB2  ALA  51           HB1      ALA  51  -2.475   6.344 -13.359
    4    HB1  ALA  51           HB2      ALA  51  -3.174   6.758 -11.795
    5    HB3  ALA  51           HB3      ALA  51  -2.739   8.034 -12.931

  No H/Q in entry =           5
  In of MODEL   85
    1    H    HIS  52           H        HIS  52  -5.654   7.412 -11.220
    2    HA   HIS  52           HA       HIS  52  -6.294   4.792 -10.384
    3    HB2  HIS  52           HB2      HIS  52  -6.194   6.749  -8.871
    4    HB3  HIS  52           HB3      HIS  52  -7.649   7.392  -9.631
    5    HD1  HIS  52           HD1      HIS  52  -9.875   5.984  -9.310
    6    HD2  HIS  52           HD2      HIS  52  -6.653   4.710  -6.996
    7    HE1  HIS  52           HE1      HIS  52 -10.830   4.450  -7.536
    8    HE2  HIS  52           HE2      HIS  52  -8.877   3.664  -6.116

  No H/Q in entry =           8
  In of MODEL   85
    1    H    LEU  53           H        LEU  53  -8.153   7.212 -12.182
    2    HA   LEU  53           HA       LEU  53 -10.635   5.876 -12.197
    3    HB2  LEU  53           HB2      LEU  53  -9.381   7.879 -14.060
    4    HB3  LEU  53           HB3      LEU  53 -10.961   7.179 -14.400
    5    HG   LEU  53           HG       LEU  53 -10.294   8.524 -11.761
    6   HD13  LEU  53          HD11      LEU  53 -11.454  10.502 -12.629
    7   HD12  LEU  53          HD12      LEU  53 -11.699   9.697 -14.179
    8   HD11  LEU  53          HD13      LEU  53 -10.074  10.123 -13.651
    9   HD22  LEU  53          HD21      LEU  53 -12.255   7.271 -11.415
   10   HD21  LEU  53          HD22      LEU  53 -12.794   7.481 -13.077
   11   HD23  LEU  53          HD23      LEU  53 -12.924   8.810 -11.940

  No H/Q in entry =          11
  In of MODEL   85
    1    H    VAL  54           H        VAL  54  -7.877   5.722 -14.427
    2    HA   VAL  54           HA       VAL  54  -9.063   3.925 -16.269
    3    HB   VAL  54           HB       VAL  54  -6.167   4.484 -15.581
    4   HG12  VAL  54          HG11      VAL  54  -5.895   3.397 -17.966
    5   HG11  VAL  54          HG12      VAL  54  -7.410   2.591 -17.565
    6   HG13  VAL  54          HG13      VAL  54  -5.993   2.364 -16.542
    7   HG22  VAL  54          HG21      VAL  54  -6.968   6.411 -16.633
    8   HG21  VAL  54          HG22      VAL  54  -8.143   5.524 -17.601
    9   HG23  VAL  54          HG23      VAL  54  -6.435   5.473 -18.027

  No H/Q in entry =           9
  In of MODEL   85
    1    H    GLN  55           H        GLN  55  -7.063   3.421 -13.363
    2    HA   GLN  55           HA       GLN  55  -6.923   0.606 -13.612
    3    HB2  GLN  55           HB2      GLN  55  -5.387   1.532 -12.091
    4    HB3  GLN  55           HB3      GLN  55  -6.622   2.479 -11.267
    5    HG2  GLN  55           HG2      GLN  55  -7.284   0.714  -9.946
    6    HG3  GLN  55           HG3      GLN  55  -7.035  -0.472 -11.221
    7   HE21  GLN  55          HE21      GLN  55  -5.388  -1.892 -10.719
    8   HE22  GLN  55          HE22      GLN  55  -4.012  -1.515  -9.805

  No H/Q in entry =           8
  In of MODEL   85
    1    H    THR  56           H        THR  56  -9.295   2.732 -12.009
    2    HA   THR  56           HA       THR  56 -10.850   0.825 -10.718
    3    HB   THR  56           HB       THR  56 -11.985   3.189 -12.234
    4    HG1  THR  56           HG1      THR  56 -10.221   3.823 -10.950
    5   HG21  THR  56          HG21      THR  56 -13.441   1.381 -11.063
    6   HG23  THR  56          HG22      THR  56 -13.778   3.079 -10.722
    7   HG22  THR  56          HG23      THR  56 -12.864   2.110  -9.565

  No H/Q in entry =           7
  In of MODEL   85
    1    H    LYS  57           H        LYS  57 -11.062   1.895 -14.108
    2    HA   LYS  57           HA       LYS  57 -13.187   0.170 -14.862
    3    HB2  LYS  57           HB2      LYS  57 -12.342   2.132 -16.182
    4    HB3  LYS  57           HB3      LYS  57 -10.885   1.216 -16.544
    5    HG2  LYS  57           HG2      LYS  57 -12.226  -0.496 -17.689
    6    HG3  LYS  57           HG3      LYS  57 -13.699   0.388 -17.312
    7    HD2  LYS  57           HD2      LYS  57 -12.902   2.306 -18.642
    8    HD3  LYS  57           HD3      LYS  57 -11.411   1.442 -19.011
    9    HE2  LYS  57           HE2      LYS  57 -12.987   1.221 -20.886
   10    HE3  LYS  57           HE3      LYS  57 -12.757  -0.353 -20.126
   11    HZ3  LYS  57           HZ1      LYS  57 -14.804  -0.190 -19.028
   12    HZ2  LYS  57           HZ2      LYS  57 -15.112   0.319 -20.620
   13    HZ1  LYS  57           HZ3      LYS  57 -14.967   1.464 -19.371

  No H/Q in entry =          13
  In of MODEL   85
    1    H    LEU  58           H        LEU  58  -9.676  -0.201 -14.795
    2    HA   LEU  58           HA       LEU  58  -9.638  -2.722 -16.076
    3    HB2  LEU  58           HB2      LEU  58  -7.631  -1.390 -14.267
    4    HB3  LEU  58           HB3      LEU  58  -7.342  -2.909 -15.116
    5    HG   LEU  58           HG       LEU  58  -8.136  -0.322 -16.488
    6   HD11  LEU  58          HD11      LEU  58  -5.471  -1.512 -15.787
    7   HD13  LEU  58          HD12      LEU  58  -5.995   0.171 -15.744
    8   HD12  LEU  58          HD13      LEU  58  -5.638  -0.599 -17.287
    9   HD22  LEU  58          HD21      LEU  58  -8.681  -1.898 -18.076
   10   HD21  LEU  58          HD22      LEU  58  -7.620  -3.126 -17.388
   11   HD23  LEU  58          HD23      LEU  58  -6.948  -1.844 -18.396

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  59           H        ILE  59 -10.483  -1.824 -12.830
    2    HA   ILE  59           HA       ILE  59 -10.087  -4.582 -11.874
    3    HB   ILE  59           HB       ILE  59  -9.678  -2.312 -10.477
    4   HG12  ILE  59          HG12      ILE  59 -11.050  -4.644  -9.129
    5   HG13  ILE  59          HG13      ILE  59  -9.418  -4.757  -9.738
    6   HG23  ILE  59          HG21      ILE  59 -11.520  -1.603  -9.207
    7   HG22  ILE  59          HG22      ILE  59 -12.435  -3.059  -9.521
    8   HG21  ILE  59          HG23      ILE  59 -12.239  -1.844 -10.781
    9   HD11  ILE  59          HD11      ILE  59  -8.823  -2.742  -8.382
   10   HD13  ILE  59          HD12      ILE  59  -9.280  -4.135  -7.411
   11   HD12  ILE  59          HD13      ILE  59 -10.427  -2.817  -7.661

  No H/Q in entry =          11
  In of MODEL   85
    1    H    GLU  60           H        GLU  60 -12.683  -2.314 -12.696
    2    HA   GLU  60           HA       GLU  60 -14.844  -3.865 -11.684
    3    HB2  GLU  60           HB2      GLU  60 -15.085  -1.494 -12.293
    4    HB3  GLU  60           HB3      GLU  60 -14.771  -1.885 -13.981
    5    HG2  GLU  60           HG2      GLU  60 -16.786  -3.343 -13.997
    6    HG3  GLU  60           HG3      GLU  60 -17.119  -2.873 -12.343

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLY  61           H        GLY  61 -13.162  -3.829 -14.795
    2    HA3  GLY  61           HA2      GLY  61 -14.833  -6.106 -15.683
    3    HA2  GLY  61           HA3      GLY  61 -14.004  -4.990 -16.762

  No H/Q in entry =           3
  In of MODEL   85
    1    H    ASP  62           H        ASP  62 -12.616  -6.409 -13.869
    2    HA   ASP  62           HA       ASP  62 -10.290  -7.274 -15.256
    3    HB2  ASP  62           HB2      ASP  62 -10.333  -6.554 -12.882
    4    HB3  ASP  62           HB3      ASP  62 -11.265  -7.992 -12.482

  No H/Q in entry =           4
  In of MODEL   85
    1    H    ALA  63           H        ALA  63 -12.159  -8.529 -16.750
    2    HA   ALA  63           HA       ALA  63 -12.919 -11.153 -15.931
    3    HB3  ALA  63           HB1      ALA  63 -14.061 -10.308 -17.820
    4    HB2  ALA  63           HB2      ALA  63 -12.955 -11.487 -18.525
    5    HB1  ALA  63           HB3      ALA  63 -12.570  -9.765 -18.589

  No H/Q in entry =           5
  In of MODEL   85
    1    H    GLY  64           H        GLY  64 -10.115  -9.858 -17.626
    2    HA3  GLY  64           HA2      GLY  64  -8.014 -10.695 -18.001
    3    HA2  GLY  64           HA3      GLY  64  -8.342 -11.884 -16.747

  No H/Q in entry =           3
  In of MODEL   85
    1    H    GLU  65           H        GLU  65  -7.797 -13.818 -17.602
    2    HA   GLU  65           HA       GLU  65  -7.953 -14.421 -20.359
    3    HB2  GLU  65           HB2      GLU  65  -7.651 -16.210 -17.950
    4    HB3  GLU  65           HB3      GLU  65  -7.540 -16.780 -19.616
    5    HG2  GLU  65           HG2      GLU  65  -5.690 -15.244 -20.054
    6    HG3  GLU  65           HG3      GLU  65  -5.825 -14.585 -18.425

  No H/Q in entry =           6
  In of MODEL   85
    1    H    GLY  66           H        GLY  66 -10.053 -15.155 -17.675
    2    HA3  GLY  66           HA2      GLY  66 -12.303 -15.631 -19.446
    3    HA2  GLY  66           HA3      GLY  66 -11.831 -16.982 -18.434

  No H/Q in entry =           3
  In of MODEL   85
    1    H    LYS  67           H        LYS  67 -13.614 -17.102 -17.194
    2    HA   LYS  67           HA       LYS  67 -15.046 -14.954 -16.113
    3    HB2  LYS  67           HB2      LYS  67 -14.912 -17.858 -15.315
    4    HB3  LYS  67           HB3      LYS  67 -16.091 -16.708 -14.669
    5    HG2  LYS  67           HG2      LYS  67 -16.857 -16.198 -16.957
    6    HG3  LYS  67           HG3      LYS  67 -15.681 -17.337 -17.609
    7    HD2  LYS  67           HD2      LYS  67 -16.787 -19.182 -16.415
    8    HD3  LYS  67           HD3      LYS  67 -17.954 -18.047 -15.734
    9    HE2  LYS  67           HE2      LYS  67 -18.710 -17.450 -18.008
   10    HE3  LYS  67           HE3      LYS  67 -17.541 -18.581 -18.693
   11    HZ1  LYS  67           HZ1      LYS  67 -19.054 -19.907 -16.736
   12    HZ3  LYS  67           HZ2      LYS  67 -18.983 -20.212 -18.406
   13    HZ2  LYS  67           HZ3      LYS  67 -20.124 -19.116 -17.788

  No H/Q in entry =          13
  In of MODEL   85
    1    H    MET  68           H        MET  68 -13.648 -17.322 -13.975
    2    HA   MET  68           HA       MET  68 -13.355 -15.587 -11.779
    3    HB2  MET  68           HB2      MET  68 -12.357 -18.349 -12.405
    4    HB3  MET  68           HB3      MET  68 -11.937 -17.541 -10.894
    5    HG2  MET  68           HG2      MET  68 -14.779 -17.897 -11.882
    6    HG3  MET  68           HG3      MET  68 -13.993 -18.982 -10.733
    7    HE2  MET  68           HE1      MET  68 -16.435 -17.379  -8.559
    8    HE1  MET  68           HE2      MET  68 -16.357 -18.221 -10.104
    9    HE3  MET  68           HE3      MET  68 -16.789 -16.514 -10.062

  No H/Q in entry =           9
  In of MODEL   85
    1    H    LYS  69           H        LYS  69 -10.916 -16.713 -14.141
    2    HA   LYS  69           HA       LYS  69  -8.659 -15.795 -12.766
    3    HB2  LYS  69           HB2      LYS  69  -8.469 -17.379 -14.570
    4    HB3  LYS  69           HB3      LYS  69  -9.079 -16.196 -15.729
    5    HG2  LYS  69           HG2      LYS  69  -6.563 -16.424 -15.715
    6    HG3  LYS  69           HG3      LYS  69  -7.141 -14.787 -15.417
    7    HD2  LYS  69           HD2      LYS  69  -6.632 -14.888 -13.125
    8    HD3  LYS  69           HD3      LYS  69  -6.588 -16.651 -13.118
    9    HE2  LYS  69           HE2      LYS  69  -4.466 -16.742 -14.048
   10    HE3  LYS  69           HE3      LYS  69  -4.644 -15.189 -14.863
   11    HZ2  LYS  69           HZ1      LYS  69  -4.279 -15.612 -11.947
   12    HZ1  LYS  69           HZ2      LYS  69  -4.538 -14.105 -12.686
   13    HZ3  LYS  69           HZ3      LYS  69  -3.126 -14.988 -13.023

  No H/Q in entry =          13
  In of MODEL   85
    1    H    VAL  70           H        VAL  70  -7.828 -13.876 -12.299
    2    HA   VAL  70           HA       VAL  70  -8.828 -11.474 -13.687
    3    HB   VAL  70           HB       VAL  70  -7.650 -10.331 -11.730
    4   HG13  VAL  70          HG11      VAL  70 -10.056 -10.561 -11.746
    5   HG12  VAL  70          HG12      VAL  70  -9.492 -11.010 -10.135
    6   HG11  VAL  70          HG13      VAL  70  -9.943 -12.262 -11.292
    7   HG22  VAL  70          HG21      VAL  70  -6.995 -11.665  -9.835
    8   HG21  VAL  70          HG22      VAL  70  -6.238 -12.409 -11.242
    9   HG23  VAL  70          HG23      VAL  70  -7.688 -13.125 -10.540

  No H/Q in entry =           9
  In of MODEL   85
    1    H    SER  71           H        SER  71  -7.363  -9.861 -14.392
    2    HA   SER  71           HA       SER  71  -5.062 -10.805 -15.774
    3    HB2  SER  71           HB2      SER  71  -6.432  -8.818 -16.463
    4    HB3  SER  71           HB3      SER  71  -5.780  -7.946 -15.078
    5    HG   SER  71           HG       SER  71  -4.605  -8.640 -17.476

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LEU  72           H        LEU  72  -3.077 -11.089 -15.077
    2    HA   LEU  72           HA       LEU  72  -2.368 -10.853 -12.364
    3    HB2  LEU  72           HB2      LEU  72  -0.696 -11.259 -14.840
    4    HB3  LEU  72           HB3      LEU  72  -0.043 -11.322 -13.206
    5    HG   LEU  72           HG       LEU  72  -2.363 -13.050 -14.125
    6   HD12  LEU  72          HD11      LEU  72   0.530 -13.891 -13.831
    7   HD11  LEU  72          HD12      LEU  72  -0.182 -13.441 -15.380
    8   HD13  LEU  72          HD13      LEU  72  -0.805 -14.833 -14.495
    9   HD22  LEU  72          HD21      LEU  72  -2.386 -13.057 -11.776
   10   HD21  LEU  72          HD22      LEU  72  -0.641 -12.909 -11.647
   11   HD23  LEU  72          HD23      LEU  72  -1.360 -14.441 -12.136

  No H/Q in entry =          11
  In of MODEL   85
    1    H    VAL  73           H        VAL  73  -1.677  -8.835 -15.149
    2    HA   VAL  73           HA       VAL  73   0.212  -7.101 -14.046
    3    HB   VAL  73           HB       VAL  73  -0.192  -5.701 -15.911
    4   HG12  VAL  73          HG11      VAL  73  -1.046  -8.428 -16.890
    5   HG11  VAL  73          HG12      VAL  73   0.590  -8.119 -16.307
    6   HG13  VAL  73          HG13      VAL  73  -0.027  -7.243 -17.707
    7   HG21  VAL  73          HG21      VAL  73  -2.947  -6.868 -15.735
    8   HG23  VAL  73          HG22      VAL  73  -2.359  -6.321 -17.303
    9   HG22  VAL  73          HG23      VAL  73  -2.458  -5.188 -15.955

  No H/Q in entry =           9
  In of MODEL   85
    1    H    LEU  74           H        LEU  74  -3.185  -7.270 -13.498
    2    HA   LEU  74           HA       LEU  74  -3.848  -4.623 -12.897
    3    HB2  LEU  74           HB2      LEU  74  -5.550  -6.315 -13.069
    4    HB3  LEU  74           HB3      LEU  74  -4.847  -7.226 -11.736
    5    HG   LEU  74           HG       LEU  74  -5.320  -5.310 -10.214
    6   HD11  LEU  74          HD11      LEU  74  -6.428  -4.174 -12.780
    7   HD13  LEU  74          HD12      LEU  74  -5.349  -3.406 -11.618
    8   HD12  LEU  74          HD13      LEU  74  -7.049  -3.654 -11.213
    9   HD21  LEU  74          HD21      LEU  74  -6.924  -7.262 -10.861
   10   HD23  LEU  74          HD22      LEU  74  -7.827  -5.987 -11.652
   11   HD22  LEU  74          HD23      LEU  74  -7.547  -5.903  -9.930

  No H/Q in entry =          11
  In of MODEL   85
    1    H    VAL  75           H        VAL  75  -2.772  -7.185 -10.723
    2    HA   VAL  75           HA       VAL  75  -2.606  -5.623  -8.384
    3    HB   VAL  75           HB       VAL  75  -1.071  -8.098  -9.163
    4   HG11  VAL  75          HG11      VAL  75  -1.296  -6.620  -6.502
    5   HG13  VAL  75          HG12      VAL  75   0.167  -6.856  -7.445
    6   HG12  VAL  75          HG13      VAL  75  -0.620  -8.235  -6.692
    7   HG21  VAL  75          HG21      VAL  75  -3.543  -8.310  -8.971
    8   HG23  VAL  75          HG22      VAL  75  -3.466  -7.615  -7.352
    9   HG22  VAL  75          HG23      VAL  75  -2.717  -9.179  -7.676

  No H/Q in entry =           9
  In of MODEL   85
    1    H    GLU  76           H        GLU  76  -0.177  -6.352 -10.910
    2    HA   GLU  76           HA       GLU  76   1.983  -4.965  -9.751
    3    HB2  GLU  76           HB2      GLU  76   2.158  -6.459 -11.752
    4    HB3  GLU  76           HB3      GLU  76   1.314  -5.246 -12.704
    5    HG2  GLU  76           HG2      GLU  76   3.130  -3.635 -12.312
    6    HG3  GLU  76           HG3      GLU  76   3.988  -4.797 -11.317

  No H/Q in entry =           6
  In of MODEL   85
    1    H    ALA  77           H        ALA  77  -0.562  -3.813 -11.951
    2    HA   ALA  77           HA       ALA  77   0.386  -1.152 -12.133
    3    HB1  ALA  77           HB1      ALA  77  -1.327  -2.220 -13.640
    4    HB2  ALA  77           HB2      ALA  77  -1.780  -0.621 -13.050
    5    HB3  ALA  77           HB3      ALA  77  -2.496  -2.062 -12.328

  No H/Q in entry =           5
  In of MODEL   85
    1    H    GLN  78           H        GLN  78  -1.864  -2.737  -9.924
    2    HA   GLN  78           HA       GLN  78  -2.713  -0.427  -8.533
    3    HB2  GLN  78           HB2      GLN  78  -3.781  -2.710  -8.446
    4    HB3  GLN  78           HB3      GLN  78  -2.442  -3.236  -7.429
    5    HG2  GLN  78           HG2      GLN  78  -3.006  -1.497  -5.782
    6    HG3  GLN  78           HG3      GLN  78  -4.346  -0.963  -6.798
    7   HE21  GLN  78          HE21      GLN  78  -4.792  -1.942  -4.131
    8   HE22  GLN  78          HE22      GLN  78  -5.636  -3.411  -4.244

  No H/Q in entry =           8
  In of MODEL   85
    1    H    LEU  79           H        LEU  79   0.001  -2.636  -8.067
    2    HA   LEU  79           HA       LEU  79   0.954  -1.715  -5.610
    3    HB2  LEU  79           HB2      LEU  79   1.861  -3.712  -6.668
    4    HB3  LEU  79           HB3      LEU  79   2.495  -2.754  -8.002
    5    HG   LEU  79           HG       LEU  79   4.027  -1.583  -6.498
    6   HD13  LEU  79          HD11      LEU  79   3.011  -1.348  -4.435
    7   HD12  LEU  79          HD12      LEU  79   4.112  -2.678  -4.083
    8   HD11  LEU  79          HD13      LEU  79   2.413  -3.008  -4.417
    9   HD23  LEU  79          HD21      LEU  79   5.271  -3.707  -5.583
   10   HD22  LEU  79          HD22      LEU  79   5.070  -3.517  -7.322
   11   HD21  LEU  79          HD23      LEU  79   4.007  -4.603  -6.430

  No H/Q in entry =          11
  In of MODEL   85
    1    H    HIS  80           H        HIS  80   1.815  -0.594  -8.883
    2    HA   HIS  80           HA       HIS  80   3.585   1.428  -7.962
    3    HB2  HIS  80           HB2      HIS  80   2.316   0.702 -10.547
    4    HB3  HIS  80           HB3      HIS  80   2.881   2.365 -10.380
    5    HD1  HIS  80           HD1      HIS  80   5.279   2.706 -10.895
    6    HD2  HIS  80           HD2      HIS  80   4.525  -1.214  -9.693
    7    HE1  HIS  80           HE1      HIS  80   7.492   1.468 -11.050
    8    HE2  HIS  80           HE2      HIS  80   7.043  -0.925 -10.320

  No H/Q in entry =           8
  In of MODEL   85
    1    H    LEU  81           H        LEU  81   0.182   1.524  -8.954
    2    HA   LEU  81           HA       LEU  81  -0.144   4.312  -8.633
    3    HB2  LEU  81           HB2      LEU  81  -2.118   2.031  -8.553
    4    HB3  LEU  81           HB3      LEU  81  -2.602   3.726  -8.469
    5    HG   LEU  81           HG       LEU  81  -0.881   2.600 -10.695
    6   HD12  LEU  81          HD11      LEU  81  -3.114   2.874 -12.003
    7   HD11  LEU  81          HD12      LEU  81  -3.873   2.798 -10.414
    8   HD13  LEU  81          HD13      LEU  81  -2.904   1.445 -10.993
    9   HD23  LEU  81          HD21      LEU  81  -2.013   4.720 -11.803
   10   HD22  LEU  81          HD22      LEU  81  -0.603   4.920 -10.766
   11   HD21  LEU  81          HD23      LEU  81  -2.216   5.241 -10.132

  No H/Q in entry =          11
  In of MODEL   85
    1    H    MET  82           H        MET  82  -0.762   1.621  -6.378
    2    HA   MET  82           HA       MET  82  -1.850   3.195  -4.300
    3    HB2  MET  82           HB2      MET  82  -0.427   0.533  -4.325
    4    HB3  MET  82           HB3      MET  82  -1.024   1.253  -2.832
    5    HG2  MET  82           HG2      MET  82  -2.739   0.719  -5.277
    6    HG3  MET  82           HG3      MET  82  -2.646  -0.349  -3.878
    7    HE3  MET  82           HE1      MET  82  -4.408   1.278  -1.074
    8    HE2  MET  82           HE2      MET  82  -2.683   1.587  -1.254
    9    HE1  MET  82           HE3      MET  82  -3.341   0.016  -1.705

  No H/Q in entry =           9
  In of MODEL   85
    1    H    THR  83           H        THR  83   1.472   2.168  -4.974
    2    HA   THR  83           HA       THR  83   2.661   3.303  -2.673
    3    HB   THR  83           HB       THR  83   4.762   3.281  -4.140
    4    HG1  THR  83           HG1      THR  83   4.539   2.744  -6.163
    5   HG22  THR  83          HG21      THR  83   4.369   0.614  -4.464
    6   HG21  THR  83          HG22      THR  83   3.068   0.973  -3.330
    7   HG23  THR  83          HG23      THR  83   4.740   1.350  -2.906

  No H/Q in entry =           7
  In of MODEL   85
    1    H    SER  84           H        SER  84   2.278   4.564  -5.979
    2    HA   SER  84           HA       SER  84   3.570   7.031  -5.527
    3    HB2  SER  84           HB2      SER  84   1.523   6.153  -7.551
    4    HB3  SER  84           HB3      SER  84   2.171   7.793  -7.528
    5    HG   SER  84           HG       SER  84   3.590   5.343  -7.807

  No H/Q in entry =           5
  In of MODEL   85
    1    H    MET  85           H        MET  85   0.090   6.209  -5.365
    2    HA   MET  85           HA       MET  85  -0.822   8.805  -4.775
    3    HB2  MET  85           HB2      MET  85  -2.309   6.969  -5.443
    4    HB3  MET  85           HB3      MET  85  -2.009   6.170  -3.902
    5    HG2  MET  85           HG2      MET  85  -2.927   8.130  -2.707
    6    HG3  MET  85           HG3      MET  85  -3.231   8.922  -4.251
    7    HE1  MET  85           HE1      MET  85  -4.598   8.012  -6.096
    8    HE3  MET  85           HE2      MET  85  -5.691   8.959  -5.090
    9    HE2  MET  85           HE3      MET  85  -6.226   7.415  -5.748

  No H/Q in entry =           9
  In of MODEL   85
    1    H    LEU  86           H        LEU  86   0.140   6.167  -2.620
    2    HA   LEU  86           HA       LEU  86  -0.426   7.467  -0.184
    3    HB2  LEU  86           HB2      LEU  86   0.084   5.004  -0.568
    4    HB3  LEU  86           HB3      LEU  86   1.784   5.464  -0.659
    5    HG   LEU  86           HG       LEU  86   1.430   6.626   1.605
    6   HD11  LEU  86          HD11      LEU  86  -1.248   5.810   1.127
    7   HD13  LEU  86          HD12      LEU  86  -0.600   6.574   2.577
    8   HD12  LEU  86          HD13      LEU  86  -0.660   4.816   2.463
    9   HD23  LEU  86          HD21      LEU  86   1.055   3.627   1.734
   10   HD22  LEU  86          HD22      LEU  86   2.036   4.657   2.775
   11   HD21  LEU  86          HD23      LEU  86   2.548   4.336   1.119

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ALA  87           H        ALA  87   2.566   7.220  -2.062
    2    HA   ALA  87           HA       ALA  87   4.241   8.665  -0.336
    3    HB3  ALA  87           HB1      ALA  87   4.363   7.646  -3.040
    4    HB2  ALA  87           HB2      ALA  87   5.688   8.003  -1.935
    5    HB1  ALA  87           HB3      ALA  87   5.055   9.270  -2.985

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ARG  88           H        ARG  88   2.284   9.759  -3.066
    2    HA   ARG  88           HA       ARG  88   3.012  12.462  -2.954
    3    HB2  ARG  88           HB2      ARG  88   1.783  11.283  -4.813
    4    HB3  ARG  88           HB3      ARG  88   0.321  11.405  -3.835
    5    HG2  ARG  88           HG2      ARG  88   1.296  14.002  -3.756
    6    HG3  ARG  88           HG3      ARG  88   1.734  13.490  -5.383
    7    HD2  ARG  88           HD2      ARG  88  -0.406  13.532  -6.088
    8    HD3  ARG  88           HD3      ARG  88  -0.983  12.674  -4.659
    9    HE   ARG  88           HE       ARG  88  -1.217  15.447  -5.086
   10   HH21  ARG  88          HH11      ARG  88  -1.772  16.772  -3.353
   11   HH22  ARG  88          HH12      ARG  88  -1.472  16.245  -1.733
   12   HH11  ARG  88          HH21      ARG  88  -0.172  13.208  -2.702
   13   HH12  ARG  88          HH22      ARG  88  -0.584  14.220  -1.365

  No H/Q in entry =          13
  In of MODEL   85
    1    H    GLU  89           H        GLU  89   0.331  10.748  -1.318
    2    HA   GLU  89           HA       GLU  89  -0.818  13.045  -0.123
    3    HB2  GLU  89           HB2      GLU  89  -1.899  10.787  -0.207
    4    HB3  GLU  89           HB3      GLU  89  -0.770  10.254   1.039
    5    HG2  GLU  89           HG2      GLU  89  -1.622  11.943   2.591
    6    HG3  GLU  89           HG3      GLU  89  -2.682  12.593   1.342

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LEU  90           H        LEU  90   1.666  10.795   1.065
    2    HA   LEU  90           HA       LEU  90   1.994  12.052   3.592
    3    HB2  LEU  90           HB2      LEU  90   3.801  10.302   1.925
    4    HB3  LEU  90           HB3      LEU  90   4.206  10.830   3.563
    5    HG   LEU  90           HG       LEU  90   1.596   9.441   2.898
    6   HD12  LEU  90          HD11      LEU  90   2.765   7.416   3.915
    7   HD11  LEU  90          HD12      LEU  90   4.274   8.295   3.676
    8   HD13  LEU  90          HD13      LEU  90   3.273   7.868   2.287
    9   HD22  LEU  90          HD21      LEU  90   1.310  10.365   5.016
   10   HD21  LEU  90          HD22      LEU  90   3.028  10.286   5.404
   11   HD23  LEU  90          HD23      LEU  90   2.044   8.824   5.453

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  91           H        ILE  91   3.601  12.452   0.469
    2    HA   ILE  91           HA       ILE  91   5.547  14.316   1.309
    3    HB   ILE  91           HB       ILE  91   4.251  13.798  -1.373
    4   HG12  ILE  91          HG12      ILE  91   7.088  13.357  -0.389
    5   HG13  ILE  91          HG13      ILE  91   5.824  12.140  -0.228
    6   HG22  ILE  91          HG21      ILE  91   6.455  15.177  -2.059
    7   HG21  ILE  91          HG22      ILE  91   6.128  15.977  -0.521
    8   HG23  ILE  91          HG23      ILE  91   4.909  15.983  -1.793
    9   HD13  ILE  91          HD11      ILE  91   5.663  11.808  -2.534
   10   HD12  ILE  91          HD12      ILE  91   7.393  12.078  -2.316
   11   HD11  ILE  91          HD13      ILE  91   6.364  13.384  -2.909

  No H/Q in entry =          11
  In of MODEL   85
    1    H    THR  92           H        THR  92   2.182  14.694   0.290
    2    HA   THR  92           HA       THR  92   2.113  17.516   0.222
    3    HB   THR  92           HB       THR  92  -0.026  15.491   0.920
    4    HG1  THR  92           HG1      THR  92   0.287  15.312  -1.163
    5   HG22  THR  92          HG21      THR  92  -1.457  17.630   0.188
    6   HG21  THR  92          HG22      THR  92  -0.080  18.478   0.887
    7   HG23  THR  92          HG23      THR  92  -1.007  17.345   1.869

  No H/Q in entry =           7
  In of MODEL   85
    1    H    GLU  93           H        GLU  93   1.591  15.215   2.880
    2    HA   GLU  93           HA       GLU  93   1.025  17.116   4.892
    3    HB2  GLU  93           HB2      GLU  93   2.378  14.412   5.139
    4    HB3  GLU  93           HB3      GLU  93   1.669  15.332   6.468
    5    HG2  GLU  93           HG2      GLU  93   0.076  14.524   4.026
    6    HG3  GLU  93           HG3      GLU  93   0.189  13.506   5.457

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LEU  94           H        LEU  94   4.057  15.676   3.755
    2    HA   LEU  94           HA       LEU  94   5.784  16.855   5.646
    3    HB2  LEU  94           HB2      LEU  94   6.209  15.886   2.818
    4    HB3  LEU  94           HB3      LEU  94   7.525  16.566   3.770
    5    HG   LEU  94           HG       LEU  94   5.815  14.348   4.906
    6   HD11  LEU  94          HD11      LEU  94   7.920  14.147   2.781
    7   HD13  LEU  94          HD12      LEU  94   6.488  13.153   3.041
    8   HD12  LEU  94          HD13      LEU  94   7.914  12.924   4.053
    9   HD23  LEU  94          HD21      LEU  94   8.009  13.847   6.066
   10   HD22  LEU  94          HD22      LEU  94   7.318  15.416   6.476
   11   HD21  LEU  94          HD23      LEU  94   8.661  15.312   5.338

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  95           H        ILE  95   4.637  18.001   2.489
    2    HA   ILE  95           HA       ILE  95   6.174  20.381   2.428
    3    HB   ILE  95           HB       ILE  95   3.544  19.655   1.117
    4   HG12  ILE  95          HG12      ILE  95   6.331  20.031  -0.013
    5   HG13  ILE  95          HG13      ILE  95   5.704  18.469   0.504
    6   HG21  ILE  95          HG21      ILE  95   5.258  22.147   0.895
    7   HG23  ILE  95          HG22      ILE  95   3.533  22.055   1.246
    8   HG22  ILE  95          HG23      ILE  95   4.127  21.659  -0.367
    9   HD13  ILE  95          HD11      ILE  95   4.150  18.366  -1.229
   10   HD12  ILE  95          HD12      ILE  95   5.489  19.202  -2.016
   11   HD11  ILE  95          HD13      ILE  95   4.101  20.117  -1.430

  No H/Q in entry =          11
  In of MODEL   85
    1    H    GLU  96           H        GLU  96   2.931  19.685   3.715
    2    HA   GLU  96           HA       GLU  96   2.270  22.324   4.458
    3    HB2  GLU  96           HB2      GLU  96   0.622  20.516   4.469
    4    HB3  GLU  96           HB3      GLU  96   1.491  19.705   5.769
    5    HG2  GLU  96           HG2      GLU  96   0.447  20.977   7.332
    6    HG3  GLU  96           HG3      GLU  96   0.963  22.457   6.533

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LEU  97           H        LEU  97   4.145  19.805   6.095
    2    HA   LEU  97           HA       LEU  97   4.475  21.165   8.563
    3    HB2  LEU  97           HB2      LEU  97   6.048  19.015   7.160
    4    HB3  LEU  97           HB3      LEU  97   6.623  19.712   8.672
    5    HG   LEU  97           HG       LEU  97   3.831  18.577   8.355
    6   HD12  LEU  97          HD11      LEU  97   4.796  16.582   9.576
    7   HD11  LEU  97          HD12      LEU  97   6.399  17.235   9.235
    8   HD13  LEU  97          HD13      LEU  97   5.340  16.758   7.907
    9   HD23  LEU  97          HD21      LEU  97   4.280  18.296  10.922
   10   HD22  LEU  97          HD22      LEU  97   3.878  19.901  10.312
   11   HD21  LEU  97          HD23      LEU  97   5.555  19.486  10.663

  No H/Q in entry =          11
  In of MODEL   85
    1    H    HIS  98           H        HIS  98   6.354  21.200   5.544
    2    HA   HIS  98           HA       HIS  98   8.482  22.813   6.445
    3    HB2  HIS  98           HB2      HIS  98   7.201  22.532   3.716
    4    HB3  HIS  98           HB3      HIS  98   8.626  23.532   4.008
    5    HD1  HIS  98           HD1      HIS  98   7.466  19.944   4.034
    6    HD2  HIS  98           HD2      HIS  98  11.016  22.093   4.464
    7    HE1  HIS  98           HE1      HIS  98   9.345  18.241   3.987
    8    HE2  HIS  98           HE2      HIS  98  11.511  19.529   4.249

  No H/Q in entry =           8
  In of MODEL   85
    1    H    GLU  99           H        GLU  99   5.253  23.599   5.258
    2    HA   GLU  99           HA       GLU  99   5.593  26.419   5.194
    3    HB2  GLU  99           HB2      GLU  99   3.734  25.220   4.060
    4    HB3  GLU  99           HB3      GLU  99   3.038  24.853   5.638
    5    HG2  GLU  99           HG2      GLU  99   2.823  27.243   6.132
    6    HG3  GLU  99           HG3      GLU  99   3.598  27.650   4.605

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LYS 100           H        LYS 100   4.486  24.174   7.718
    2    HA   LYS 100           HA       LYS 100   3.865  26.225   9.605
    3    HB2  LYS 100           HB2      LYS 100   4.480  23.282   9.960
    4    HB3  LYS 100           HB3      LYS 100   4.014  24.352  11.288
    5    HG2  LYS 100           HG2      LYS 100   1.943  24.958  10.032
    6    HG3  LYS 100           HG3      LYS 100   2.390  23.792   8.784
    7    HD2  LYS 100           HD2      LYS 100   2.333  21.974  10.449
    8    HD3  LYS 100           HD3      LYS 100   1.903  23.134  11.709
    9    HE2  LYS 100           HE2      LYS 100  -0.155  23.724  10.438
   10    HE3  LYS 100           HE3      LYS 100   0.266  22.507   9.226
   11    HZ1  LYS 100           HZ1      LYS 100   0.000  21.844  12.108
   12    HZ3  LYS 100           HZ2      LYS 100   0.004  20.786  10.776
   13    HZ2  LYS 100           HZ3      LYS 100  -1.327  21.808  11.049

  No H/Q in entry =          13
  In of MODEL   85
    1    H    LEU 101           H        LEU 101   6.815  24.468   8.784
    2    HA   LEU 101           HA       LEU 101   8.395  25.335  10.991
    3    HB2  LEU 101           HB2      LEU 101   9.012  24.349   8.217
    4    HB3  LEU 101           HB3      LEU 101  10.302  25.035   9.201
    5    HG   LEU 101           HG       LEU 101   8.496  22.857  10.264
    6   HD12  LEU 101          HD11      LEU 101  10.572  21.388   9.666
    7   HD11  LEU 101          HD12      LEU 101  10.926  22.653   8.491
    8   HD13  LEU 101          HD13      LEU 101   9.409  21.759   8.395
    9   HD21  LEU 101          HD21      LEU 101  11.203  24.004  10.998
   10   HD23  LEU 101          HD22      LEU 101  10.679  22.425  11.580
   11   HD22  LEU 101          HD23      LEU 101   9.766  23.870  12.011

  No H/Q in entry =          11
  In of MODEL   85
    1    H    LYS 102           H        LYS 102   6.794  27.171   8.840
    2    HA   LYS 102           HA       LYS 102   6.841  29.464   8.543
    3    HB2  LYS 102           HB2      LYS 102   8.400  29.376  10.646
    4    HB3  LYS 102           HB3      LYS 102   9.701  29.585   9.490
    5    HG2  LYS 102           HG2      LYS 102   7.566  31.511  10.341
    6    HG3  LYS 102           HG3      LYS 102   9.276  31.794  10.094
    7    HD2  LYS 102           HD2      LYS 102   7.338  31.339   7.789
    8    HD3  LYS 102           HD3      LYS 102   7.698  32.925   8.454
    9    HE2  LYS 102           HE2      LYS 102   9.093  31.754   6.388
   10    HE3  LYS 102           HE3      LYS 102   9.689  33.071   7.398
   11    HZ2  LYS 102           HZ1      LYS 102  11.235  31.186   7.232
   12    HZ1  LYS 102           HZ2      LYS 102  10.084  30.190   7.974
   13    HZ3  LYS 102           HZ3      LYS 102  10.756  31.489   8.832

  No H/Q in entry =          13
  In of MODEL   85
    1    H    ALA 103           H        ALA 103  10.117  28.168   7.992
    2    HA   ALA 103           HA       ALA 103  11.069  29.552   5.915
    3    HB2  ALA 103           HB1      ALA 103  11.987  27.348   4.996
    4    HB1  ALA 103           HB2      ALA 103  11.098  26.565   6.301
    5    HB3  ALA 103           HB3      ALA 103  12.371  27.727   6.675

  No H/Q in entry =           5
  In of MODEL   85
    1    H1   LYS   3           H1       LYS   3 -30.997   6.666 -19.395
    2    H2   LYS   3           H3       LYS   3 -30.027   6.370 -20.757
    3    H3   LYS   3           H2       LYS   3 -31.443   5.464 -20.508
    4    HA   LYS   3           HA       LYS   3 -30.462   4.035 -19.130
    5    HB2  LYS   3           HB2      LYS   3 -28.158   5.407 -20.466
    6    HB3  LYS   3           HB3      LYS   3 -27.853   4.176 -19.240
    7    HG2  LYS   3           HG2      LYS   3 -29.324   2.642 -20.596
    8    HG3  LYS   3           HG3      LYS   3 -29.261   3.856 -21.873
    9    HD2  LYS   3           HD2      LYS   3 -26.781   3.680 -21.846
   10    HD3  LYS   3           HD3      LYS   3 -26.922   2.371 -20.674
   11    HE2  LYS   3           HE2      LYS   3 -28.465   1.254 -22.390
   12    HE3  LYS   3           HE3      LYS   3 -27.825   2.430 -23.538
   13    HZ3  LYS   3           HZ1      LYS   3 -26.060   1.161 -23.838
   14    HZ2  LYS   3           HZ2      LYS   3 -26.709  -0.004 -22.786
   15    HZ1  LYS   3           HZ3      LYS   3 -25.684   1.208 -22.182

  No H/Q in entry =          15
  In of MODEL   85
    1    H    LYS   4           H        LYS   4 -30.500   3.870 -17.070
    2    HA   LYS   4           HA       LYS   4 -29.698   6.117 -15.400
    3    HB2  LYS   4           HB2      LYS   4 -30.961   3.447 -14.720
    4    HB3  LYS   4           HB3      LYS   4 -30.696   4.767 -13.581
    5    HG2  LYS   4           HG2      LYS   4 -32.527   4.779 -15.987
    6    HG3  LYS   4           HG3      LYS   4 -33.000   4.822 -14.290
    7    HD2  LYS   4           HD2      LYS   4 -32.246   7.022 -14.003
    8    HD3  LYS   4           HD3      LYS   4 -31.220   6.954 -15.436
    9    HE2  LYS   4           HE2      LYS   4 -33.114   8.383 -15.866
   10    HE3  LYS   4           HE3      LYS   4 -33.240   6.925 -16.850
   11    HZ3  LYS   4           HZ1      LYS   4 -34.826   6.035 -15.299
   12    HZ2  LYS   4           HZ2      LYS   4 -35.346   7.550 -15.861
   13    HZ1  LYS   4           HZ3      LYS   4 -34.679   7.405 -14.305

  No H/Q in entry =          13
  In of MODEL   85
    1    H    HIS   5           H        HIS   5 -28.214   6.146 -13.820
    2    HA   HIS   5           HA       HIS   5 -25.984   4.261 -14.194
    3    HB2  HIS   5           HB2      HIS   5 -26.155   7.007 -12.954
    4    HB3  HIS   5           HB3      HIS   5 -24.698   6.014 -12.962
    5    HD1  HIS   5           HD1      HIS   5 -23.211   7.192 -14.550
    6    HD2  HIS   5           HD2      HIS   5 -27.041   6.692 -16.077
    7    HE1  HIS   5           HE1      HIS   5 -23.050   7.797 -16.995
    8    HE2  HIS   5           HE2      HIS   5 -25.384   7.480 -17.895

  No H/Q in entry =           8
  In of MODEL   85
    1    H    ILE   6           H        ILE   6 -25.786   2.667 -12.898
    2    HA   ILE   6           HA       ILE   6 -26.729   2.928 -10.123
    3    HB   ILE   6           HB       ILE   6 -25.985   0.459 -11.696
    4   HG12  ILE   6          HG12      ILE   6 -28.694   1.460 -10.809
    5   HG13  ILE   6          HG13      ILE   6 -28.062   1.623 -12.447
    6   HG23  ILE   6          HG21      ILE   6 -26.376  -0.805  -9.847
    7   HG22  ILE   6          HG22      ILE   6 -27.495   0.364  -9.144
    8   HG21  ILE   6          HG23      ILE   6 -25.757   0.652  -9.066
    9   HD13  ILE   6          HD11      ILE   6 -28.583  -0.477 -12.967
   10   HD12  ILE   6          HD12      ILE   6 -29.585  -0.449 -11.516
   11   HD11  ILE   6          HD13      ILE   6 -27.948  -1.103 -11.446

  No H/Q in entry =          11
  In of MODEL   85
    1    H    TYR   7           H        TYR   7 -24.941   3.506  -8.845
    2    HA   TYR   7           HA       TYR   7 -22.264   2.483  -9.560
    3    HB2  TYR   7           HB2      TYR   7 -23.146   4.925  -8.042
    4    HB3  TYR   7           HB3      TYR   7 -21.477   4.364  -8.102
    5    HD1  TYR   7           HD1      TYR   7 -22.570   3.487 -11.194
    6    HD2  TYR   7           HD2      TYR   7 -21.781   7.012  -8.932
    7    HE1  TYR   7           HE1      TYR   7 -22.122   4.728 -13.274
    8    HE2  TYR   7           HE2      TYR   7 -21.375   8.261 -11.004
    9    HH   TYR   7           HH       TYR   7 -21.616   8.207 -13.235

  No H/Q in entry =           9
  In of MODEL   85
    1    H    LEU   8           H        LEU   8 -21.324   1.088  -8.255
    2    HA   LEU   8           HA       LEU   8 -22.444   0.594  -5.568
    3    HB2  LEU   8           HB2      LEU   8 -20.805  -1.094  -7.437
    4    HB3  LEU   8           HB3      LEU   8 -20.987  -1.491  -5.729
    5    HG   LEU   8           HG       LEU   8 -23.474  -1.590  -6.129
    6   HD13  LEU   8          HD11      LEU   8 -23.589  -0.346  -8.224
    7   HD12  LEU   8          HD12      LEU   8 -24.167  -1.991  -8.478
    8   HD11  LEU   8          HD13      LEU   8 -22.551  -1.532  -9.012
    9   HD23  LEU   8          HD21      LEU   8 -22.272  -3.645  -7.858
   10   HD22  LEU   8          HD22      LEU   8 -23.352  -3.798  -6.472
   11   HD21  LEU   8          HD23      LEU   8 -21.633  -3.496  -6.222

  No H/Q in entry =          11
  In of MODEL   85
    1    H    PHE   9           H        PHE   9 -21.142   0.935  -3.785
    2    HA   PHE   9           HA       PHE   9 -18.345   1.816  -4.327
    3    HB2  PHE   9           HB2      PHE   9 -20.335   2.869  -2.328
    4    HB3  PHE   9           HB3      PHE   9 -18.611   3.196  -2.223
    5    HD1  PHE   9           HD1      PHE   9 -17.462   4.458  -4.018
    6    HD2  PHE   9           HD2      PHE   9 -21.722   3.948  -3.991
    7    HE1  PHE   9           HE1      PHE   9 -17.690   6.262  -5.700
    8    HE2  PHE   9           HE2      PHE   9 -21.950   5.764  -5.667
    9    HZ   PHE   9           HZ       PHE   9 -19.932   6.917  -6.528

  No H/Q in entry =           9
  In of MODEL   85
    1    H    SER  10           H        SER  10 -16.769   0.740  -3.347
    2    HA   SER  10           HA       SER  10 -16.919  -0.240  -0.670
    3    HB2  SER  10           HB2      SER  10 -18.184  -2.044  -1.811
    4    HB3  SER  10           HB3      SER  10 -16.816  -2.291  -2.885
    5    HG   SER  10           HG       SER  10 -16.454  -3.705  -1.303

  No H/Q in entry =           5
  In of MODEL   85
    1    H    SER  11           H        SER  11 -14.899  -0.035   0.098
    2    HA   SER  11           HA       SER  11 -12.747   0.804  -1.470
    3    HB2  SER  11           HB2      SER  11 -11.425   0.640   0.505
    4    HB3  SER  11           HB3      SER  11 -13.052   1.106   1.006
    5    HG   SER  11           HG       SER  11 -12.166  -1.587   0.890

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ALA  12           H        ALA  12 -13.972  -1.936  -2.196
    2    HA   ALA  12           HA       ALA  12 -11.394  -3.143  -2.828
    3    HB1  ALA  12           HB1      ALA  12 -13.493  -4.998  -1.758
    4    HB3  ALA  12           HB2      ALA  12 -12.412  -4.165  -0.642
    5    HB2  ALA  12           HB3      ALA  12 -11.747  -5.230  -1.878

  No H/Q in entry =           5
  In of MODEL   85
    1    H    GLY  13           H        GLY  13 -12.156  -2.197  -4.844
    2    HA3  GLY  13           HA2      GLY  13 -14.443  -2.825  -6.266
    3    HA2  GLY  13           HA3      GLY  13 -12.886  -2.455  -7.021

  No H/Q in entry =           3
  In of MODEL   85
    1    H    MET  14           H        MET  14 -11.451  -4.751  -6.113
    2    HA   MET  14           HA       MET  14 -11.890  -6.535  -8.166
    3    HB2  MET  14           HB2      MET  14  -9.860  -6.652  -6.789
    4    HB3  MET  14           HB3      MET  14 -10.785  -7.317  -5.444
    5    HG2  MET  14           HG2      MET  14  -9.681  -9.136  -6.637
    6    HG3  MET  14           HG3      MET  14 -11.417  -9.252  -6.926
    7    HE3  MET  14           HE1      MET  14  -7.941  -8.122  -8.365
    8    HE2  MET  14           HE2      MET  14  -8.110  -9.026  -9.867
    9    HE1  MET  14           HE3      MET  14  -8.323  -9.849  -8.325

  No H/Q in entry =           9
  In of MODEL   85
    1    H    SER  15           H        SER  15 -13.149  -6.979  -4.859
    2    HA   SER  15           HA       SER  15 -14.596  -9.360  -5.624
    3    HB2  SER  15           HB2      SER  15 -14.603  -7.716  -3.101
    4    HB3  SER  15           HB3      SER  15 -15.835  -8.943  -3.384
    5    HG   SER  15           HG       SER  15 -13.014  -9.355  -3.512

  No H/Q in entry =           5
  In of MODEL   85
    1    H    THR  16           H        THR  16 -15.550  -5.947  -5.068
    2    HA   THR  16           HA       THR  16 -18.363  -6.338  -5.525
    3    HB   THR  16           HB       THR  16 -16.732  -3.830  -6.052
    4    HG1  THR  16           HG1      THR  16 -17.974  -3.920  -3.664
    5   HG21  THR  16          HG21      THR  16 -19.139  -3.925  -6.798
    6   HG23  THR  16          HG22      THR  16 -18.803  -2.671  -5.592
    7   HG22  THR  16          HG23      THR  16 -19.584  -4.186  -5.116

  No H/Q in entry =           7
  In of MODEL   85
    1    H    SER  17           H        SER  17 -15.593  -5.834  -7.431
    2    HA   SER  17           HA       SER  17 -16.719  -5.035  -9.915
    3    HB2  SER  17           HB2      SER  17 -14.122  -6.432  -9.247
    4    HB3  SER  17           HB3      SER  17 -14.564  -5.971 -10.890
    5    HG   SER  17           HG       SER  17 -14.862  -3.965  -9.050

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LEU  18           H        LEU  18 -16.226  -8.210  -8.507
    2    HA   LEU  18           HA       LEU  18 -16.870  -9.667 -10.874
    3    HB2  LEU  18           HB2      LEU  18 -15.662 -10.684  -8.994
    4    HB3  LEU  18           HB3      LEU  18 -17.075 -10.460  -7.964
    5    HG   LEU  18           HG       LEU  18 -18.365 -11.988  -9.362
    6   HD12  LEU  18          HD11      LEU  18 -16.903 -13.325 -11.060
    7   HD11  LEU  18          HD12      LEU  18 -15.867 -11.898 -11.026
    8   HD13  LEU  18          HD13      LEU  18 -17.549 -11.755 -11.537
    9   HD22  LEU  18          HD21      LEU  18 -17.251 -14.023  -8.764
   10   HD21  LEU  18          HD22      LEU  18 -17.039 -12.828  -7.482
   11   HD23  LEU  18          HD23      LEU  18 -15.714 -13.171  -8.594

  No H/Q in entry =          11
  In of MODEL   85
    1    H    LEU  19           H        LEU  19 -18.784  -8.437  -8.134
    2    HA   LEU  19           HA       LEU  19 -21.285  -9.545  -8.960
    3    HB2  LEU  19           HB2      LEU  19 -20.974  -8.743  -6.700
    4    HB3  LEU  19           HB3      LEU  19 -20.655  -7.114  -7.293
    5    HG   LEU  19           HG       LEU  19 -22.976  -6.859  -7.944
    6   HD13  LEU  19          HD11      LEU  19 -23.504  -9.144  -8.578
    7   HD12  LEU  19          HD12      LEU  19 -24.626  -8.606  -7.328
    8   HD11  LEU  19          HD13      LEU  19 -23.293  -9.681  -6.912
    9   HD23  LEU  19          HD21      LEU  19 -23.961  -7.265  -5.568
   10   HD22  LEU  19          HD22      LEU  19 -22.665  -6.092  -5.801
   11   HD21  LEU  19          HD23      LEU  19 -22.299  -7.695  -5.163

  No H/Q in entry =          11
  In of MODEL   85
    1    H    VAL  20           H        VAL  20 -19.710  -6.418  -9.631
    2    HA   VAL  20           HA       VAL  20 -21.806  -5.302 -11.172
    3    HB   VAL  20           HB       VAL  20 -18.803  -4.789 -11.308
    4   HG13  VAL  20          HG11      VAL  20 -19.520  -4.077 -13.431
    5   HG12  VAL  20          HG12      VAL  20 -19.621  -2.612 -12.455
    6   HG11  VAL  20          HG13      VAL  20 -21.081  -3.531 -12.822
    7   HG21  VAL  20          HG21      VAL  20 -21.102  -3.487  -9.911
    8   HG23  VAL  20          HG22      VAL  20 -19.646  -2.574 -10.300
    9   HG22  VAL  20          HG23      VAL  20 -19.543  -3.997  -9.262

  No H/Q in entry =           9
  In of MODEL   85
    1    H    SER  21           H        SER  21 -19.112  -7.413 -12.244
    2    HA   SER  21           HA       SER  21 -19.915  -7.249 -14.987
    3    HB2  SER  21           HB2      SER  21 -18.534  -9.251 -15.354
    4    HB3  SER  21           HB3      SER  21 -17.665  -8.038 -14.417
    5    HG   SER  21           HG       SER  21 -17.433 -10.125 -13.559

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LYS  22           H        LYS  22 -21.018  -9.436 -12.431
    2    HA   LYS  22           HA       LYS  22 -22.615 -10.992 -14.259
    3    HB2  LYS  22           HB2      LYS  22 -22.830 -10.667 -11.263
    4    HB3  LYS  22           HB3      LYS  22 -23.743 -11.830 -12.224
    5    HG2  LYS  22           HG2      LYS  22 -20.738 -11.794 -11.986
    6    HG3  LYS  22           HG3      LYS  22 -21.810 -12.820 -11.033
    7    HD2  LYS  22           HD2      LYS  22 -22.626 -13.871 -13.102
    8    HD3  LYS  22           HD3      LYS  22 -21.524 -12.861 -14.039
    9    HE2  LYS  22           HE2      LYS  22 -19.604 -13.902 -12.948
   10    HE3  LYS  22           HE3      LYS  22 -20.679 -14.872 -11.940
   11    HZ1  LYS  22           HZ1      LYS  22 -20.596 -15.040 -14.897
   12    HZ3  LYS  22           HZ2      LYS  22 -21.408 -16.079 -13.824
   13    HZ2  LYS  22           HZ3      LYS  22 -19.711 -16.060 -13.866

  No H/Q in entry =          13
  In of MODEL   85
    1    H    MET  23           H        MET  23 -23.242  -8.072 -12.352
    2    HA   MET  23           HA       MET  23 -26.055  -8.067 -12.836
    3    HB2  MET  23           HB2      MET  23 -24.139  -5.819 -12.252
    4    HB3  MET  23           HB3      MET  23 -25.881  -5.598 -12.414
    5    HG2  MET  23           HG2      MET  23 -26.294  -6.913 -10.457
    6    HG3  MET  23           HG3      MET  23 -24.594  -7.374 -10.349
    7    HE2  MET  23           HE1      MET  23 -26.779  -3.673  -9.101
    8    HE1  MET  23           HE2      MET  23 -27.072  -4.617 -10.560
    9    HE3  MET  23           HE3      MET  23 -25.998  -3.219 -10.616

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ARG  24           H        ARG  24 -23.275  -6.696 -14.626
    2    HA   ARG  24           HA       ARG  24 -24.751  -5.330 -16.597
    3    HB2  ARG  24           HB2      ARG  24 -21.966  -6.541 -16.662
    4    HB3  ARG  24           HB3      ARG  24 -22.624  -5.612 -17.987
    5    HG2  ARG  24           HG2      ARG  24 -22.809  -3.602 -16.520
    6    HG3  ARG  24           HG3      ARG  24 -22.134  -4.559 -15.174
    7    HD2  ARG  24           HD2      ARG  24 -20.765  -4.162 -17.876
    8    HD3  ARG  24           HD3      ARG  24 -20.424  -3.209 -16.437
    9    HE   ARG  24           HE       ARG  24 -19.935  -5.606 -15.479
   10   HH21  ARG  24          HH11      ARG  24 -17.747  -5.616 -14.965
   11   HH22  ARG  24          HH12      ARG  24 -16.574  -5.342 -16.206
   12   HH11  ARG  24          HH21      ARG  24 -19.078  -4.381 -18.515
   13   HH12  ARG  24          HH22      ARG  24 -17.372  -4.622 -18.305

  No H/Q in entry =          13
  In of MODEL   85
    1    H    ALA  25           H        ALA  25 -23.724  -8.703 -16.371
    2    HA   ALA  25           HA       ALA  25 -24.396  -9.483 -19.012
    3    HB1  ALA  25           HB1      ALA  25 -23.755 -11.543 -18.346
    4    HB3  ALA  25           HB2      ALA  25 -24.801 -11.509 -16.926
    5    HB2  ALA  25           HB3      ALA  25 -23.222 -10.728 -16.876

  No H/Q in entry =           5
  In of MODEL   85
    1    H    GLN  26           H        GLN  26 -26.201  -9.505 -15.975
    2    HA   GLN  26           HA       GLN  26 -28.587 -10.625 -16.988
    3    HB2  GLN  26           HB2      GLN  26 -28.004  -8.923 -14.583
    4    HB3  GLN  26           HB3      GLN  26 -29.590  -9.596 -14.930
    5    HG2  GLN  26           HG2      GLN  26 -27.046 -11.134 -14.500
    6    HG3  GLN  26           HG3      GLN  26 -28.395 -11.005 -13.378
    7   HE21  GLN  26          HE21      GLN  26 -27.252 -13.188 -14.689
    8   HE22  GLN  26          HE22      GLN  26 -28.330 -14.194 -15.491

  No H/Q in entry =           8
  In of MODEL   85
    1    H    ALA  27           H        ALA  27 -27.548  -7.262 -16.562
    2    HA   ALA  27           HA       ALA  27 -30.010  -6.086 -17.313
    3    HB1  ALA  27           HB1      ALA  27 -28.154  -4.840 -16.195
    4    HB3  ALA  27           HB2      ALA  27 -28.731  -4.037 -17.657
    5    HB2  ALA  27           HB3      ALA  27 -27.223  -4.949 -17.690

  No H/Q in entry =           5
  In of MODEL   85
    1    H    GLU  28           H        GLU  28 -27.360  -7.364 -19.218
    2    HA   GLU  28           HA       GLU  28 -28.282  -6.265 -21.716
    3    HB2  GLU  28           HB2      GLU  28 -25.922  -7.027 -21.120
    4    HB3  GLU  28           HB3      GLU  28 -26.517  -8.671 -21.338
    5    HG2  GLU  28           HG2      GLU  28 -25.362  -7.904 -23.305
    6    HG3  GLU  28           HG3      GLU  28 -27.072  -8.172 -23.645

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LYS  29           H        LYS  29 -28.530  -9.386 -20.098
    2    HA   LYS  29           HA       LYS  29 -29.892 -10.790 -22.112
    3    HB2  LYS  29           HB2      LYS  29 -28.857 -11.832 -20.129
    4    HB3  LYS  29           HB3      LYS  29 -30.099 -11.100 -19.115
    5    HG2  LYS  29           HG2      LYS  29 -31.809 -12.408 -20.188
    6    HG3  LYS  29           HG3      LYS  29 -30.637 -13.063 -21.329
    7    HD2  LYS  29           HD2      LYS  29 -29.518 -14.286 -19.620
    8    HD3  LYS  29           HD3      LYS  29 -30.390 -13.435 -18.347
    9    HE2  LYS  29           HE2      LYS  29 -31.215 -15.755 -18.734
   10    HE3  LYS  29           HE3      LYS  29 -32.458 -14.522 -18.952
   11    HZ1  LYS  29           HZ1      LYS  29 -31.916 -14.641 -21.385
   12    HZ3  LYS  29           HZ2      LYS  29 -32.672 -16.015 -20.733
   13    HZ2  LYS  29           HZ3      LYS  29 -31.005 -16.032 -21.043

  No H/Q in entry =          13
  In of MODEL   85
    1    H    TYR  30           H        TYR  30 -31.201  -8.678 -19.569
    2    HA   TYR  30           HA       TYR  30 -33.884  -9.031 -20.796
    3    HB2  TYR  30           HB2      TYR  30 -33.177  -7.933 -18.065
    4    HB3  TYR  30           HB3      TYR  30 -34.807  -8.134 -18.710
    5    HD1  TYR  30           HD1      TYR  30 -35.787 -10.394 -18.945
    6    HD2  TYR  30           HD2      TYR  30 -31.920  -9.810 -17.262
    7    HE1  TYR  30           HE1      TYR  30 -35.761 -12.735 -18.180
    8    HE2  TYR  30           HE2      TYR  30 -31.895 -12.136 -16.501
    9    HH   TYR  30           HH       TYR  30 -33.612 -14.432 -17.612

  No H/Q in entry =           9
  In of MODEL   85
    1    H    GLU  31           H        GLU  31 -31.666  -7.094 -21.587
    2    HA   GLU  31           HA       GLU  31 -31.534  -4.929 -22.382
    3    HB2  GLU  31           HB2      GLU  31 -34.454  -5.552 -22.881
    4    HB3  GLU  31           HB3      GLU  31 -33.578  -4.200 -23.599
    5    HG2  GLU  31           HG2      GLU  31 -32.158  -5.664 -24.821
    6    HG3  GLU  31           HG3      GLU  31 -32.757  -7.073 -23.947

  No H/Q in entry =           6
  In of MODEL   85
    1    H    VAL  32           H        VAL  32 -31.710  -4.859 -19.646
    2    HA   VAL  32           HA       VAL  32 -33.506  -2.701 -18.946
    3    HB   VAL  32           HB       VAL  32 -31.132  -3.785 -17.397
    4   HG12  VAL  32          HG11      VAL  32 -32.629  -2.943 -15.478
    5   HG11  VAL  32          HG12      VAL  32 -33.444  -1.998 -16.724
    6   HG13  VAL  32          HG13      VAL  32 -31.727  -1.748 -16.413
    7   HG21  VAL  32          HG21      VAL  32 -32.954  -5.444 -18.094
    8   HG23  VAL  32          HG22      VAL  32 -33.961  -4.603 -16.915
    9   HG22  VAL  32          HG23      VAL  32 -32.462  -5.376 -16.402

  No H/Q in entry =           9
  In of MODEL   85
    1    HA   PRO  33           HA       PRO  33 -30.402   0.161 -20.603
    2    HB2  PRO  33           HB2      PRO  33 -31.849   2.424 -20.438
    3    HB3  PRO  33           HB3      PRO  33 -32.363   1.152 -21.545
    4    HG2  PRO  33           HG2      PRO  33 -33.295   1.657 -18.719
    5    HG3  PRO  33           HG3      PRO  33 -34.275   1.496 -20.176
    6    HD2  PRO  33           HD2      PRO  33 -33.867  -0.612 -18.541
    7    HD3  PRO  33           HD3      PRO  33 -33.949  -0.828 -20.291

  No H/Q in entry =           7
  In of MODEL   85
    1    H    VAL  34           H        VAL  34 -29.141  -0.445 -18.672
    2    HA   VAL  34           HA       VAL  34 -28.776   1.949 -16.994
    3    HB   VAL  34           HB       VAL  34 -28.222   0.444 -15.081
    4   HG12  VAL  34          HG11      VAL  34 -30.656  -0.365 -14.766
    5   HG11  VAL  34          HG12      VAL  34 -30.962   0.426 -16.312
    6   HG13  VAL  34          HG13      VAL  34 -30.372   1.368 -14.942
    7   HG21  VAL  34          HG21      VAL  34 -28.479  -1.548 -17.114
    8   HG23  VAL  34          HG22      VAL  34 -29.536  -1.898 -15.745
    9   HG22  VAL  34          HG23      VAL  34 -27.808  -1.663 -15.487

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ILE  35           H        ILE  35 -26.783   2.317 -16.163
    2    HA   ILE  35           HA       ILE  35 -24.525   0.941 -17.463
    3    HB   ILE  35           HB       ILE  35 -24.839   3.829 -16.609
    4   HG12  ILE  35          HG12      ILE  35 -23.912   2.531 -19.179
    5   HG13  ILE  35          HG13      ILE  35 -25.522   3.193 -18.898
    6   HG21  ILE  35          HG21      ILE  35 -22.322   2.231 -16.959
    7   HG23  ILE  35          HG22      ILE  35 -22.734   3.405 -15.710
    8   HG22  ILE  35          HG23      ILE  35 -22.350   3.951 -17.343
    9   HD11  ILE  35          HD11      ILE  35 -24.056   5.339 -18.278
   10   HD13  ILE  35          HD12      ILE  35 -24.616   4.994 -19.916
   11   HD12  ILE  35          HD13      ILE  35 -22.971   4.572 -19.437

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ILE  36           H        ILE  36 -23.311  -0.138 -15.887
    2    HA   ILE  36           HA       ILE  36 -23.713   0.449 -13.005
    3    HB   ILE  36           HB       ILE  36 -22.970  -2.260 -14.157
    4   HG12  ILE  36          HG12      ILE  36 -25.748  -1.387 -13.359
    5   HG13  ILE  36          HG13      ILE  36 -25.187  -1.360 -15.032
    6   HG23  ILE  36          HG21      ILE  36 -23.326  -3.107 -12.052
    7   HG22  ILE  36          HG22      ILE  36 -24.414  -1.800 -11.587
    8   HG21  ILE  36          HG23      ILE  36 -22.676  -1.515 -11.665
    9   HD13  ILE  36          HD11      ILE  36 -25.415  -3.565 -15.267
   10   HD12  ILE  36          HD12      ILE  36 -26.467  -3.433 -13.858
   11   HD11  ILE  36          HD13      ILE  36 -24.779  -3.903 -13.658

  No H/Q in entry =          11
  In of MODEL   85
    1    H    GLU  37           H        GLU  37 -21.907   1.014 -11.906
    2    HA   GLU  37           HA       GLU  37 -19.247   0.157 -12.854
    3    HB2  GLU  37           HB2      GLU  37 -20.037   2.961 -12.079
    4    HB3  GLU  37           HB3      GLU  37 -18.376   2.412 -12.295
    5    HG2  GLU  37           HG2      GLU  37 -20.469   2.508 -14.448
    6    HG3  GLU  37           HG3      GLU  37 -19.213   3.716 -14.186

  No H/Q in entry =           6
  In of MODEL   85
    1    H    ALA  38           H        ALA  38 -17.753  -0.144 -11.187
    2    HA   ALA  38           HA       ALA  38 -18.758   0.024  -8.406
    3    HB1  ALA  38           HB1      ALA  38 -17.109  -1.940  -9.871
    4    HB3  ALA  38           HB2      ALA  38 -18.154  -2.167  -8.469
    5    HB2  ALA  38           HB3      ALA  38 -16.522  -1.531  -8.260

  No H/Q in entry =           5
  In of MODEL   85
    1    H    PHE  39           H        PHE  39 -17.475   1.180  -6.926
    2    HA   PHE  39           HA       PHE  39 -14.926   2.327  -7.826
    3    HB2  PHE  39           HB2      PHE  39 -17.312   3.853  -6.816
    4    HB3  PHE  39           HB3      PHE  39 -15.674   4.480  -6.644
    5    HD1  PHE  39           HD1      PHE  39 -14.268   4.545  -8.838
    6    HD2  PHE  39           HD2      PHE  39 -18.526   4.386  -8.686
    7    HE1  PHE  39           HE1      PHE  39 -14.373   5.496 -11.124
    8    HE2  PHE  39           HE2      PHE  39 -18.648   5.328 -10.964
    9    HZ   PHE  39           HZ       PHE  39 -16.576   5.857 -12.203

  No H/Q in entry =           9
  In of MODEL   85
    1    HA   PRO  40           HA       PRO  40 -13.975   1.490  -3.558
    2    HB2  PRO  40           HB2      PRO  40 -12.152   3.450  -2.938
    3    HB3  PRO  40           HB3      PRO  40 -11.751   2.123  -4.028
    4    HG2  PRO  40           HG2      PRO  40 -12.711   4.894  -4.728
    5    HG3  PRO  40           HG3      PRO  40 -11.311   4.024  -5.358
    6    HD2  PRO  40           HD2      PRO  40 -13.546   4.011  -6.752
    7    HD3  PRO  40           HD3      PRO  40 -12.626   2.517  -6.584

  No H/Q in entry =           7
  In of MODEL   85
    1    H    GLU  41           H        GLU  41 -14.555   2.454  -1.410
    2    HA   GLU  41           HA       GLU  41 -16.756   4.212  -1.353
    3    HB2  GLU  41           HB2      GLU  41 -16.714   3.970   0.962
    4    HB3  GLU  41           HB3      GLU  41 -15.969   2.476   0.393
    5    HG2  GLU  41           HG2      GLU  41 -14.707   3.195   2.256
    6    HG3  GLU  41           HG3      GLU  41 -13.735   3.538   0.823

  No H/Q in entry =           6
  In of MODEL   85
    1    H    THR  42           H        THR  42 -13.403   5.047  -1.418
    2    HA   THR  42           HA       THR  42 -13.683   7.599  -0.169
    3    HB   THR  42           HB       THR  42 -11.522   8.134  -1.284
    4    HG1  THR  42           HG1      THR  42 -12.320   6.487  -3.063
    5   HG23  THR  42          HG21      THR  42 -11.333   6.983   0.797
    6   HG22  THR  42          HG22      THR  42 -10.243   6.153  -0.317
    7   HG21  THR  42          HG23      THR  42 -11.813   5.449   0.069

  No H/Q in entry =           7
  In of MODEL   85
    1    H    LEU  43           H        LEU  43 -14.638   6.570  -3.276
    2    HA   LEU  43           HA       LEU  43 -14.830   9.360  -4.208
    3    HB2  LEU  43           HB2      LEU  43 -15.212   6.724  -5.612
    4    HB3  LEU  43           HB3      LEU  43 -15.494   8.295  -6.360
    5    HG   LEU  43           HG       LEU  43 -12.840   7.178  -5.491
    6   HD13  LEU  43          HD11      LEU  43 -13.269   6.123  -7.492
    7   HD12  LEU  43          HD12      LEU  43 -12.523   7.616  -8.062
    8   HD11  LEU  43          HD13      LEU  43 -14.277   7.440  -8.092
    9   HD22  LEU  43          HD21      LEU  43 -12.721   9.511  -5.136
   10   HD21  LEU  43          HD22      LEU  43 -13.673   9.861  -6.580
   11   HD23  LEU  43          HD23      LEU  43 -12.025   9.257  -6.737

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ALA  44           H        ALA  44 -16.806   7.558  -2.363
    2    HA   ALA  44           HA       ALA  44 -19.296   7.497  -3.667
    3    HB3  ALA  44           HB1      ALA  44 -19.169   6.349  -1.587
    4    HB2  ALA  44           HB2      ALA  44 -20.241   7.717  -1.288
    5    HB1  ALA  44           HB3      ALA  44 -18.564   7.777  -0.748

  No H/Q in entry =           5
  In of MODEL   85
    1    H    GLY  45           H        GLY  45 -17.796  10.241  -2.110
    2    HA3  GLY  45           HA2      GLY  45 -20.198  11.805  -2.430
    3    HA2  GLY  45           HA3      GLY  45 -18.634  12.384  -1.857

  No H/Q in entry =           3
  In of MODEL   85
    1    H    GLU  46           H        GLU  46 -17.144  11.441  -4.173
    2    HA   GLU  46           HA       GLU  46 -17.740  13.694  -5.907
    3    HB2  GLU  46           HB2      GLU  46 -15.601  11.560  -5.992
    4    HB3  GLU  46           HB3      GLU  46 -15.704  12.916  -7.116
    5    HG2  GLU  46           HG2      GLU  46 -15.317  13.144  -4.139
    6    HG3  GLU  46           HG3      GLU  46 -14.037  13.267  -5.347

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LYS  47           H        LYS  47 -17.710  10.180  -6.389
    2    HA   LYS  47           HA       LYS  47 -18.824  10.462  -9.053
    3    HB2  LYS  47           HB2      LYS  47 -17.727   8.296  -7.394
    4    HB3  LYS  47           HB3      LYS  47 -19.087   7.821  -8.412
    5    HG2  LYS  47           HG2      LYS  47 -16.966   7.401  -9.514
    6    HG3  LYS  47           HG3      LYS  47 -17.902   8.620 -10.377
    7    HD2  LYS  47           HD2      LYS  47 -16.592  10.389  -9.369
    8    HD3  LYS  47           HD3      LYS  47 -15.703   9.212  -8.403
    9    HE2  LYS  47           HE2      LYS  47 -15.718   9.323 -11.413
   10    HE3  LYS  47           HE3      LYS  47 -14.444   9.969 -10.380
   11    HZ3  LYS  47           HZ1      LYS  47 -13.658   7.941  -9.928
   12    HZ2  LYS  47           HZ2      LYS  47 -14.430   7.516 -11.379
   13    HZ1  LYS  47           HZ3      LYS  47 -15.193   7.214  -9.891

  No H/Q in entry =          13
  In of MODEL   85
    1    H    GLY  48           H        GLY  48 -20.141   9.696  -5.904
    2    HA3  GLY  48           HA2      GLY  48 -22.560   8.580  -6.642
    3    HA2  GLY  48           HA3      GLY  48 -22.299   9.548  -5.191

  No H/Q in entry =           3
  In of MODEL   85
    1    H    GLN  49           H        GLN  49 -21.669  11.978  -6.735
    2    HA   GLN  49           HA       GLN  49 -24.200  13.153  -6.845
    3    HB2  GLN  49           HB2      GLN  49 -21.647  13.973  -8.213
    4    HB3  GLN  49           HB3      GLN  49 -23.084  14.972  -8.104
    5    HG2  GLN  49           HG2      GLN  49 -22.905  14.960  -5.669
    6    HG3  GLN  49           HG3      GLN  49 -21.482  13.939  -5.776
    7   HE21  GLN  49          HE21      GLN  49 -21.300  16.146  -4.476
    8   HE22  GLN  49          HE22      GLN  49 -20.351  17.388  -5.113

  No H/Q in entry =           8
  In of MODEL   85
    1    H    ASN  50           H        ASN  50 -22.587  11.265  -9.269
    2    HA   ASN  50           HA       ASN  50 -24.464  12.211 -11.324
    3    HB2  ASN  50           HB2      ASN  50 -21.926  10.611 -11.599
    4    HB3  ASN  50           HB3      ASN  50 -22.975  11.080 -12.928
    5   HD21  ASN  50          HD21      ASN  50 -20.306  11.839 -11.327
    6   HD22  ASN  50          HD22      ASN  50 -20.035  13.472 -11.651

  No H/Q in entry =           6
  In of MODEL   85
    1    H    ALA  51           H        ALA  51 -24.491   9.825  -9.110
    2    HA   ALA  51           HA       ALA  51 -25.344   7.725 -10.958
    3    HB2  ALA  51           HB1      ALA  51 -24.781   6.339  -9.294
    4    HB3  ALA  51           HB2      ALA  51 -25.874   7.160  -8.182
    5    HB1  ALA  51           HB3      ALA  51 -24.222   7.743  -8.385

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ASP  52           H        ASP  52 -27.373   6.718 -10.816
    2    HA   ASP  52           HA       ASP  52 -29.502   8.598 -10.110
    3    HB2  ASP  52           HB2      ASP  52 -29.388   6.111 -11.813
    4    HB3  ASP  52           HB3      ASP  52 -30.910   6.877 -11.357

  No H/Q in entry =           4
  In of MODEL   85
    1    H    VAL  53           H        VAL  53 -27.968   5.655  -9.144
    2    HA   VAL  53           HA       VAL  53 -29.385   5.786  -6.615
    3    HB   VAL  53           HB       VAL  53 -30.836   4.197  -7.868
    4   HG11  VAL  53          HG11      VAL  53 -29.124   3.313  -9.417
    5   HG13  VAL  53          HG12      VAL  53 -29.983   2.029  -8.568
    6   HG12  VAL  53          HG13      VAL  53 -28.357   2.483  -8.064
    7   HG23  VAL  53          HG21      VAL  53 -30.052   2.178  -6.210
    8   HG22  VAL  53          HG22      VAL  53 -31.144   3.506  -5.817
    9   HG21  VAL  53          HG23      VAL  53 -29.430   3.627  -5.421

  No H/Q in entry =           9
  In of MODEL   85
    1    H    VAL  54           H        VAL  54 -28.072   5.298  -4.976
    2    HA   VAL  54           HA       VAL  54 -25.339   4.384  -5.622
    3    HB   VAL  54           HB       VAL  54 -26.344   6.159  -3.340
    4   HG11  VAL  54          HG11      VAL  54 -23.807   4.677  -3.670
    5   HG13  VAL  54          HG12      VAL  54 -24.530   5.356  -2.213
    6   HG12  VAL  54          HG13      VAL  54 -23.606   6.390  -3.303
    7   HG22  VAL  54          HG21      VAL  54 -25.446   7.965  -4.422
    8   HG21  VAL  54          HG22      VAL  54 -26.031   7.007  -5.783
    9   HG23  VAL  54          HG23      VAL  54 -24.320   6.982  -5.359

  No H/Q in entry =           9
  In of MODEL   85
    1    H    LEU  55           H        LEU  55 -24.793   2.439  -5.009
    2    HA   LEU  55           HA       LEU  55 -26.318   1.140  -2.839
    3    HB2  LEU  55           HB2      LEU  55 -24.811  -0.038  -5.162
    4    HB3  LEU  55           HB3      LEU  55 -25.585  -0.970  -3.879
    5    HG   LEU  55           HG       LEU  55 -26.996   0.684  -5.964
    6   HD13  LEU  55          HD11      LEU  55 -26.756  -1.160  -7.210
    7   HD12  LEU  55          HD12      LEU  55 -27.727  -2.025  -6.019
    8   HD11  LEU  55          HD13      LEU  55 -25.969  -2.009  -5.881
    9   HD23  LEU  55          HD21      LEU  55 -28.328  -1.251  -4.124
   10   HD22  LEU  55          HD22      LEU  55 -28.993   0.159  -4.948
   11   HD21  LEU  55          HD23      LEU  55 -27.956   0.369  -3.537

  No H/Q in entry =          11
  In of MODEL   85
    1    H    LEU  56           H        LEU  56 -25.169   0.491  -1.051
    2    HA   LEU  56           HA       LEU  56 -22.225   0.809  -1.119
    3    HB2  LEU  56           HB2      LEU  56 -24.015   0.615   1.291
    4    HB3  LEU  56           HB3      LEU  56 -22.295   0.998   1.272
    5    HG   LEU  56           HG       LEU  56 -24.555   2.750   0.349
    6   HD11  LEU  56          HD11      LEU  56 -23.431   2.305   2.855
    7   HD13  LEU  56          HD12      LEU  56 -24.388   3.707   2.376
    8   HD12  LEU  56          HD13      LEU  56 -22.629   3.765   2.275
    9   HD23  LEU  56          HD21      LEU  56 -22.566   4.398   0.161
   10   HD22  LEU  56          HD22      LEU  56 -22.989   3.329  -1.177
   11   HD21  LEU  56          HD23      LEU  56 -21.637   2.926  -0.119

  No H/Q in entry =          11
  In of MODEL   85
    1    H    GLY  57           H        GLY  57 -20.886  -0.865  -0.618
    2    HA3  GLY  57           HA2      GLY  57 -21.881  -3.523  -0.842
    3    HA2  GLY  57           HA3      GLY  57 -20.243  -3.078  -0.370

  No H/Q in entry =           3
  In of MODEL   85
    1    HA   PRO  58           HA       PRO  58 -23.050  -4.091   3.349
    2    HB2  PRO  58           HB2      PRO  58 -22.431  -6.720   3.916
    3    HB3  PRO  58           HB3      PRO  58 -23.812  -6.261   2.920
    4    HG2  PRO  58           HG2      PRO  58 -21.116  -7.205   2.100
    5    HG3  PRO  58           HG3      PRO  58 -22.697  -7.613   1.435
    6    HD2  PRO  58           HD2      PRO  58 -21.049  -5.824   0.223
    7    HD3  PRO  58           HD3      PRO  58 -22.806  -5.689   0.137

  No H/Q in entry =           7
  In of MODEL   85
    1    H    GLN  59           H        GLN  59 -19.698  -4.646   2.709
    2    HA   GLN  59           HA       GLN  59 -18.922  -4.720   5.463
    3    HB2  GLN  59           HB2      GLN  59 -17.283  -3.798   3.098
    4    HB3  GLN  59           HB3      GLN  59 -16.673  -4.236   4.681
    5    HG2  GLN  59           HG2      GLN  59 -16.307  -5.992   3.012
    6    HG3  GLN  59           HG3      GLN  59 -17.325  -6.538   4.335
    7   HE21  GLN  59          HE21      GLN  59 -18.413  -7.870   3.363
    8   HE22  GLN  59          HE22      GLN  59 -19.531  -7.985   2.137

  No H/Q in entry =           8
  In of MODEL   85
    1    H    ILE  60           H        ILE  60 -19.803  -2.116   3.295
    2    HA   ILE  60           HA       ILE  60 -18.882  -0.210   5.360
    3    HB   ILE  60           HB       ILE  60 -19.065   1.551   3.567
    4   HG12  ILE  60          HG12      ILE  60 -18.978  -0.621   1.522
    5   HG13  ILE  60          HG13      ILE  60 -20.541  -0.079   2.130
    6   HG23  ILE  60          HG21      ILE  60 -16.923   1.259   2.910
    7   HG22  ILE  60          HG22      ILE  60 -17.143  -0.454   2.554
    8   HG21  ILE  60          HG23      ILE  60 -16.994   0.088   4.225
    9   HD11  ILE  60          HD11      ILE  60 -19.728   2.296   1.528
   10   HD13  ILE  60          HD12      ILE  60 -20.191   1.225   0.206
   11   HD12  ILE  60          HD13      ILE  60 -18.486   1.481   0.578

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ALA  61           H        ALA  61 -21.379  -1.728   5.427
    2    HA   ALA  61           HA       ALA  61 -23.562   0.002   5.008
    3    HB1  ALA  61           HB1      ALA  61 -24.808  -1.471   6.325
    4    HB2  ALA  61           HB2      ALA  61 -23.414  -1.912   7.311
    5    HB3  ALA  61           HB3      ALA  61 -23.539  -2.493   5.651

  No H/Q in entry =           5
  In of MODEL   85
    1    H    TYR  62           H        TYR  62 -21.337  -0.207   7.787
    2    HA   TYR  62           HA       TYR  62 -22.833   1.470   9.492
    3    HB2  TYR  62           HB2      TYR  62 -20.767   1.828  10.709
    4    HB3  TYR  62           HB3      TYR  62 -20.885   0.134  10.236
    5    HD1  TYR  62           HD1      TYR  62 -19.338  -0.819   8.584
    6    HD2  TYR  62           HD2      TYR  62 -19.029   3.281   9.745
    7    HE1  TYR  62           HE1      TYR  62 -17.131  -0.682   7.495
    8    HE2  TYR  62           HE2      TYR  62 -16.808   3.413   8.657
    9    HH   TYR  62           HH       TYR  62 -15.727   1.953   6.598

  No H/Q in entry =           9
  In of MODEL   85
    1    H    MET  63           H        MET  63 -21.190   2.321   6.633
    2    HA   MET  63           HA       MET  63 -20.938   5.138   7.362
    3    HB2  MET  63           HB2      MET  63 -20.396   3.634   4.801
    4    HB3  MET  63           HB3      MET  63 -20.150   5.370   5.006
    5    HG2  MET  63           HG2      MET  63 -18.439   4.947   6.668
    6    HG3  MET  63           HG3      MET  63 -18.699   3.211   6.513
    7    HE1  MET  63           HE1      MET  63 -18.114   6.386   4.896
    8    HE3  MET  63           HE2      MET  63 -18.122   5.938   3.189
    9    HE2  MET  63           HE3      MET  63 -16.589   6.153   4.036

  No H/Q in entry =           9
  In of MODEL   85
    1    H    LEU  64           H        LEU  64 -23.560   3.369   6.395
    2    HA   LEU  64           HA       LEU  64 -24.747   4.848   4.345
    3    HB2  LEU  64           HB2      LEU  64 -25.666   2.755   5.244
    4    HB3  LEU  64           HB3      LEU  64 -26.089   3.591   6.738
    5    HG   LEU  64           HG       LEU  64 -27.757   4.909   5.540
    6   HD13  LEU  64          HD11      LEU  64 -27.486   5.171   3.308
    7   HD12  LEU  64          HD12      LEU  64 -28.178   3.557   3.148
    8   HD11  LEU  64          HD13      LEU  64 -26.428   3.765   3.194
    9   HD23  LEU  64          HD21      LEU  64 -28.361   2.122   4.760
   10   HD22  LEU  64          HD22      LEU  64 -29.309   3.271   5.703
   11   HD21  LEU  64          HD23      LEU  64 -27.951   2.428   6.448

  No H/Q in entry =          11
  In of MODEL   85
    1    HA   PRO  65           HA       PRO  65 -26.814   8.026   7.155
    2    HB2  PRO  65           HB2      PRO  65 -24.791   8.097   9.394
    3    HB3  PRO  65           HB3      PRO  65 -26.521   8.428   9.459
    4    HG2  PRO  65           HG2      PRO  65 -25.649   6.135  10.348
    5    HG3  PRO  65           HG3      PRO  65 -27.078   6.157   9.315
    6    HD2  PRO  65           HD2      PRO  65 -24.231   5.470   8.579
    7    HD3  PRO  65           HD3      PRO  65 -25.717   4.631   8.134

  No H/Q in entry =           7
  In of MODEL   85
    1    H    GLU  66           H        GLU  66 -23.261   7.867   7.197
    2    HA   GLU  66           HA       GLU  66 -22.885  10.660   6.826
    3    HB2  GLU  66           HB2      GLU  66 -21.146   8.309   6.129
    4    HB3  GLU  66           HB3      GLU  66 -20.648   9.991   5.940
    5    HG2  GLU  66           HG2      GLU  66 -20.829  10.336   8.313
    6    HG3  GLU  66           HG3      GLU  66 -21.401   8.682   8.528

  No H/Q in entry =           6
  In of MODEL   85
    1    H    ILE  67           H        ILE  67 -23.086   7.948   4.539
    2    HA   ILE  67           HA       ILE  67 -22.639   9.674   2.265
    3    HB   ILE  67           HB       ILE  67 -23.622   6.793   2.415
    4   HG12  ILE  67          HG12      ILE  67 -20.966   7.896   1.485
    5   HG13  ILE  67          HG13      ILE  67 -21.259   7.463   3.169
    6   HG21  ILE  67          HG21      ILE  67 -23.527   8.697   0.214
    7   HG23  ILE  67          HG22      ILE  67 -24.200   7.068   0.249
    8   HG22  ILE  67          HG23      ILE  67 -22.488   7.307  -0.091
    9   HD12  ILE  67          HD11      ILE  67 -20.912   5.710   0.793
   10   HD11  ILE  67          HD12      ILE  67 -21.932   5.151   2.117
   11   HD13  ILE  67          HD13      ILE  67 -20.244   5.562   2.417

  No H/Q in entry =          11
  In of MODEL   85
    1    H    GLN  68           H        GLN  68 -25.525   8.685   3.909
    2    HA   GLN  68           HA       GLN  68 -27.342   9.697   1.964
    3    HB2  GLN  68           HB2      GLN  68 -27.583   9.308   4.945
    4    HB3  GLN  68           HB3      GLN  68 -28.892   9.956   3.970
    5    HG2  GLN  68           HG2      GLN  68 -28.994   7.945   2.669
    6    HG3  GLN  68           HG3      GLN  68 -27.556   7.314   3.450
    7   HE21  GLN  68          HE21      GLN  68 -29.776   6.026   3.317
    8   HE22  GLN  68          HE22      GLN  68 -30.608   5.577   4.734

  No H/Q in entry =           8
  In of MODEL   85
    1    H    ARG  69           H        ARG  69 -25.662  11.277   4.708
    2    HA   ARG  69           HA       ARG  69 -26.951  13.806   4.347
    3    HB2  ARG  69           HB2      ARG  69 -24.623  12.782   5.902
    4    HB3  ARG  69           HB3      ARG  69 -24.651  14.508   5.567
    5    HG2  ARG  69           HG2      ARG  69 -26.956  14.610   6.560
    6    HG3  ARG  69           HG3      ARG  69 -26.798  12.910   7.009
    7    HD2  ARG  69           HD2      ARG  69 -25.023  15.197   7.939
    8    HD3  ARG  69           HD3      ARG  69 -26.172  14.314   8.931
    9    HE   ARG  69           HE       ARG  69 -23.599  13.313   7.946
   10   HH21  ARG  69          HH11      ARG  69 -22.838  11.508   9.112
   11   HH22  ARG  69          HH12      ARG  69 -23.882  10.711  10.239
   12   HH11  ARG  69          HH21      ARG  69 -26.558  12.837   9.663
   13   HH12  ARG  69          HH22      ARG  69 -25.989  11.460  10.548

  No H/Q in entry =          13
  In of MODEL   85
    1    H    LEU  70           H        LEU  70 -24.139  12.326   2.943
    2    HA   LEU  70           HA       LEU  70 -22.959  14.670   1.796
    3    HB2  LEU  70           HB2      LEU  70 -22.035  12.314   2.351
    4    HB3  LEU  70           HB3      LEU  70 -22.678  11.890   0.765
    5    HG   LEU  70           HG       LEU  70 -21.051  13.224  -0.317
    6   HD11  LEU  70          HD11      LEU  70 -20.177  14.004   2.475
    7   HD13  LEU  70          HD12      LEU  70 -20.850  15.076   1.247
    8   HD12  LEU  70          HD13      LEU  70 -19.263  14.346   1.004
    9   HD22  LEU  70          HD21      LEU  70 -19.672  11.459  -0.119
   10   HD21  LEU  70          HD22      LEU  70 -20.602  10.948   1.289
   11   HD23  LEU  70          HD23      LEU  70 -19.181  11.972   1.495

  No H/Q in entry =          11
  In of MODEL   85
    1    H    LEU  71           H        LEU  71 -25.204  12.214   0.667
    2    HA   LEU  71           HA       LEU  71 -25.702  13.752  -1.825
    3    HB2  LEU  71           HB2      LEU  71 -26.002  10.770  -1.416
    4    HB3  LEU  71           HB3      LEU  71 -26.115  11.654  -2.937
    5    HG   LEU  71           HG       LEU  71 -23.582  11.561  -1.299
    6   HD12  LEU  71          HD11      LEU  71 -23.711   9.969  -3.751
    7   HD11  LEU  71          HD12      LEU  71 -24.730   9.361  -2.447
    8   HD13  LEU  71          HD13      LEU  71 -23.000   9.581  -2.185
    9   HD22  LEU  71          HD21      LEU  71 -23.637  13.400  -2.767
   10   HD21  LEU  71          HD22      LEU  71 -24.181  12.392  -4.108
   11   HD23  LEU  71          HD23      LEU  71 -22.560  12.182  -3.448

  No H/Q in entry =          11
  In of MODEL   85
    1    HA   PRO  72           HA       PRO  72 -29.558  13.399   0.826
    2    HB2  PRO  72           HB2      PRO  72 -30.327  15.989   0.786
    3    HB3  PRO  72           HB3      PRO  72 -29.025  15.478   1.859
    4    HG2  PRO  72           HG2      PRO  72 -28.822  16.702  -0.880
    5    HG3  PRO  72           HG3      PRO  72 -28.023  17.207   0.609
    6    HD2  PRO  72           HD2      PRO  72 -26.756  15.627  -1.190
    7    HD3  PRO  72           HD3      PRO  72 -26.492  15.428   0.542

  No H/Q in entry =           7
  In of MODEL   85
    1    H    ASN  73           H        ASN  73 -28.930  14.375  -2.382
    2    HA   ASN  73           HA       ASN  73 -31.804  14.175  -2.992
    3    HB2  ASN  73           HB2      ASN  73 -31.318  15.293  -5.078
    4    HB3  ASN  73           HB3      ASN  73 -30.749  16.235  -3.709
    5   HD21  ASN  73          HD21      ASN  73 -29.977  16.287  -6.393
    6   HD22  ASN  73          HD22      ASN  73 -28.317  16.070  -6.603

  No H/Q in entry =           6
  In of MODEL   85
    1    H    LYS  74           H        LYS  74 -29.901  11.846  -2.614
    2    HA   LYS  74           HA       LYS  74 -30.540  10.506  -5.175
    3    HB2  LYS  74           HB2      LYS  74 -28.007  10.102  -3.582
    4    HB3  LYS  74           HB3      LYS  74 -28.432   9.324  -5.106
    5    HG2  LYS  74           HG2      LYS  74 -28.059  12.280  -4.868
    6    HG3  LYS  74           HG3      LYS  74 -26.726  11.172  -5.199
    7    HD2  LYS  74           HD2      LYS  74 -27.894  10.311  -7.143
    8    HD3  LYS  74           HD3      LYS  74 -29.273  11.355  -6.797
    9    HE2  LYS  74           HE2      LYS  74 -27.980  13.321  -7.225
   10    HE3  LYS  74           HE3      LYS  74 -26.493  12.378  -7.342
   11    HZ2  LYS  74           HZ1      LYS  74 -27.960  13.062  -9.445
   12    HZ1  LYS  74           HZ2      LYS  74 -28.666  11.560  -9.086
   13    HZ3  LYS  74           HZ3      LYS  74 -26.999  11.663  -9.397

  No H/Q in entry =          13
  In of MODEL   85
    1    HA   PRO  75           HA       PRO  75 -32.017   7.534  -2.230
    2    HB2  PRO  75           HB2      PRO  75 -32.422   5.350  -3.838
    3    HB3  PRO  75           HB3      PRO  75 -33.498   6.746  -3.880
    4    HG2  PRO  75           HG2      PRO  75 -31.200   6.087  -5.680
    5    HG3  PRO  75           HG3      PRO  75 -32.835   6.590  -6.106
    6    HD2  PRO  75           HD2      PRO  75 -30.825   8.383  -6.057
    7    HD3  PRO  75           HD3      PRO  75 -32.437   8.834  -5.498

  No H/Q in entry =           7
  In of MODEL   85
    1    H    VAL  76           H        VAL  76 -30.592   6.408  -0.884
    2    HA   VAL  76           HA       VAL  76 -28.183   5.124  -2.029
    3    HB   VAL  76           HB       VAL  76 -28.394   6.565   0.649
    4   HG11  VAL  76          HG11      VAL  76 -26.099   5.210  -0.781
    5   HG13  VAL  76          HG12      VAL  76 -26.798   4.765   0.777
    6   HG12  VAL  76          HG13      VAL  76 -25.897   6.273   0.614
    7   HG22  VAL  76          HG21      VAL  76 -27.664   8.451  -0.220
    8   HG21  VAL  76          HG22      VAL  76 -28.245   7.796  -1.752
    9   HG23  VAL  76          HG23      VAL  76 -26.544   7.640  -1.313

  No H/Q in entry =           9
  In of MODEL   85
    1    H    GLU  77           H        GLU  77 -28.041   2.955  -1.446
    2    HA   GLU  77           HA       GLU  77 -28.833   2.163   1.204
    3    HB2  GLU  77           HB2      GLU  77 -30.504   0.582   0.667
    4    HB3  GLU  77           HB3      GLU  77 -31.002   2.134  -0.010
    5    HG2  GLU  77           HG2      GLU  77 -30.440   1.383  -2.213
    6    HG3  GLU  77           HG3      GLU  77 -29.849  -0.145  -1.565

  No H/Q in entry =           6
  In of MODEL   85
    1    H    VAL  78           H        VAL  78 -28.577   0.057   1.834
    2    HA   VAL  78           HA       VAL  78 -25.949  -0.800   0.912
    3    HB   VAL  78           HB       VAL  78 -27.668  -1.651   3.281
    4   HG11  VAL  78          HG11      VAL  78 -25.385  -2.950   2.121
    5   HG13  VAL  78          HG12      VAL  78 -26.296  -3.406   3.561
    6   HG12  VAL  78          HG13      VAL  78 -24.934  -2.296   3.695
    7   HG22  VAL  78          HG21      VAL  78 -26.148  -0.361   4.624
    8   HG21  VAL  78          HG22      VAL  78 -26.859   0.652   3.368
    9   HG23  VAL  78          HG23      VAL  78 -25.204   0.066   3.197

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ILE  79           H        ILE  79 -25.490  -2.715  -0.022
    2    HA   ILE  79           HA       ILE  79 -27.614  -4.099  -1.369
    3    HB   ILE  79           HB       ILE  79 -24.643  -4.737  -1.181
    4   HG12  ILE  79          HG12      ILE  79 -26.257  -3.544  -3.441
    5   HG13  ILE  79          HG13      ILE  79 -25.337  -2.582  -2.283
    6   HG22  ILE  79          HG21      ILE  79 -25.807  -5.846  -3.505
    7   HG21  ILE  79          HG22      ILE  79 -26.798  -6.349  -2.136
    8   HG23  ILE  79          HG23      ILE  79 -25.069  -6.690  -2.144
    9   HD13  ILE  79          HD11      ILE  79 -23.944  -2.724  -4.116
   10   HD12  ILE  79          HD12      ILE  79 -24.348  -4.414  -4.414
   11   HD11  ILE  79          HD13      ILE  79 -23.335  -3.980  -3.037

  No H/Q in entry =          11
  In of MODEL   85
    1    H    ASP  80           H        ASP  80 -28.543  -5.997  -0.802
    2    HA   ASP  80           HA       ASP  80 -28.500  -6.932   1.832
    3    HB2  ASP  80           HB2      ASP  80 -30.289  -7.422   0.201
    4    HB3  ASP  80           HB3      ASP  80 -29.176  -8.461  -0.690

  No H/Q in entry =           4
  In of MODEL   85
    1    H    SER  81           H        SER  81 -26.998  -8.136   2.934
    2    HA   SER  81           HA       SER  81 -24.538  -8.894   1.712
    3    HB2  SER  81           HB2      SER  81 -24.008  -9.971   3.863
    4    HB3  SER  81           HB3      SER  81 -24.644  -8.345   4.102
    5    HG   SER  81           HG       SER  81 -25.782 -10.816   4.665

  No H/Q in entry =           5
  In of MODEL   85
    1    H    LEU  82           H        LEU  82 -27.321 -10.889   2.032
    2    HA   LEU  82           HA       LEU  82 -25.865 -13.305   1.469
    3    HB2  LEU  82           HB2      LEU  82 -28.778 -12.579   1.249
    4    HB3  LEU  82           HB3      LEU  82 -28.137 -14.202   1.009
    5    HG   LEU  82           HG       LEU  82 -27.975 -12.669   3.585
    6   HD13  LEU  82          HD11      LEU  82 -30.294 -13.198   3.072
    7   HD12  LEU  82          HD12      LEU  82 -29.711 -14.297   4.324
    8   HD11  LEU  82          HD13      LEU  82 -29.852 -14.855   2.656
    9   HD21  LEU  82          HD21      LEU  82 -27.170 -15.400   2.625
   10   HD23  LEU  82          HD22      LEU  82 -27.497 -15.097   4.331
   11   HD22  LEU  82          HD23      LEU  82 -26.211 -14.213   3.509

  No H/Q in entry =          11
  In of MODEL   85
    1    H    LEU  83           H        LEU  83 -27.756 -10.986  -0.405
    2    HA   LEU  83           HA       LEU  83 -27.627 -12.319  -2.894
    3    HB2  LEU  83           HB2      LEU  83 -27.924  -9.408  -2.208
    4    HB3  LEU  83           HB3      LEU  83 -27.994 -10.030  -3.856
    5    HG   LEU  83           HG       LEU  83 -30.022 -10.370  -1.666
    6   HD13  LEU  83          HD11      LEU  83 -30.719  -8.482  -2.701
    7   HD12  LEU  83          HD12      LEU  83 -31.233  -9.562  -3.995
    8   HD11  LEU  83          HD13      LEU  83 -29.669  -8.752  -4.091
    9   HD23  LEU  83          HD21      LEU  83 -30.230 -11.588  -4.405
   10   HD22  LEU  83          HD22      LEU  83 -31.200 -11.920  -2.971
   11   HD21  LEU  83          HD23      LEU  83 -29.532 -12.484  -3.057

  No H/Q in entry =          11
  In of MODEL   85
    1    H    TYR  84           H        TYR  84 -25.573 -10.028  -1.207
    2    HA   TYR  84           HA       TYR  84 -23.712  -9.583  -3.347
    3    HB2  TYR  84           HB2      TYR  84 -24.144  -8.086  -1.331
    4    HB3  TYR  84           HB3      TYR  84 -23.207  -9.246  -0.392
    5    HD1  TYR  84           HD1      TYR  84 -20.842  -9.847  -1.521
    6    HD2  TYR  84           HD2      TYR  84 -23.016  -6.223  -2.130
    7    HE1  TYR  84           HE1      TYR  84 -18.754  -8.727  -2.219
    8    HE2  TYR  84           HE2      TYR  84 -20.937  -5.092  -2.839
    9    HH   TYR  84           HH       TYR  84 -17.809  -6.789  -2.686

  No H/Q in entry =           9
  In of MODEL   85
    1    H    GLY  85           H        GLY  85 -23.521 -11.628  -0.428
    2    HA3  GLY  85           HA2      GLY  85 -20.984 -12.660  -0.946
    3    HA2  GLY  85           HA3      GLY  85 -22.237 -13.472  -0.007

  No H/Q in entry =           3
  In of MODEL   85
    1    H    LYS  86           H        LYS  86 -24.113 -13.752  -2.055
    2    HA   LYS  86           HA       LYS  86 -23.158 -16.147  -3.352
    3    HB2  LYS  86           HB2      LYS  86 -25.471 -15.503  -2.313
    4    HB3  LYS  86           HB3      LYS  86 -25.760 -14.771  -3.890
    5    HG2  LYS  86           HG2      LYS  86 -25.556 -16.899  -4.960
    6    HG3  LYS  86           HG3      LYS  86 -25.132 -17.661  -3.427
    7    HD2  LYS  86           HD2      LYS  86 -27.665 -16.073  -3.758
    8    HD3  LYS  86           HD3      LYS  86 -27.591 -17.786  -4.167
    9    HE2  LYS  86           HE2      LYS  86 -26.621 -18.088  -1.800
   10    HE3  LYS  86           HE3      LYS  86 -27.261 -16.473  -1.494
   11    HZ3  LYS  86           HZ1      LYS  86 -29.263 -17.351  -1.234
   12    HZ2  LYS  86           HZ2      LYS  86 -28.649 -18.907  -1.536
   13    HZ1  LYS  86           HZ3      LYS  86 -29.228 -17.959  -2.820

  No H/Q in entry =          13
  In of MODEL   85
    1    H    VAL  87           H        VAL  87 -23.037 -12.924  -4.208
    2    HA   VAL  87           HA       VAL  87 -22.712 -11.739  -6.138
    3    HB   VAL  87           HB       VAL  87 -21.739 -14.289  -7.469
    4   HG13  VAL  87          HG11      VAL  87 -20.414 -12.848  -8.774
    5   HG12  VAL  87          HG12      VAL  87 -20.512 -11.541  -7.593
    6   HG11  VAL  87          HG13      VAL  87 -21.912 -11.939  -8.587
    7   HG21  VAL  87          HG21      VAL  87 -20.291 -12.669  -5.388
    8   HG23  VAL  87          HG22      VAL  87 -19.495 -13.784  -6.497
    9   HG22  VAL  87          HG23      VAL  87 -20.680 -14.387  -5.338

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ASP  88           H        ASP  88 -25.246 -12.293  -5.770
    2    HA   ASP  88           HA       ASP  88 -26.433 -13.439  -8.172
    3    HB2  ASP  88           HB2      ASP  88 -27.416 -13.676  -5.841
    4    HB3  ASP  88           HB3      ASP  88 -27.807 -11.958  -5.916

  No H/Q in entry =           4
  In of MODEL   85
    1    H    GLY  89           H        GLY  89 -25.697 -12.188  -9.805
    2    HA3  GLY  89           HA2      GLY  89 -25.780  -9.409  -9.971
    3    HA2  GLY  89           HA3      GLY  89 -25.809 -10.513 -11.345

  No H/Q in entry =           3
  In of MODEL   85
    1    H    LEU  90           H        LEU  90 -28.298 -11.781 -10.889
    2    HA   LEU  90           HA       LEU  90 -30.048  -9.769 -11.963
    3    HB2  LEU  90           HB2      LEU  90 -30.205 -12.153 -12.570
    4    HB3  LEU  90           HB3      LEU  90 -30.709 -12.521 -10.920
    5    HG   LEU  90           HG       LEU  90 -32.789 -11.325 -11.251
    6   HD13  LEU  90          HD11      LEU  90 -32.560  -9.574 -12.707
    7   HD12  LEU  90          HD12      LEU  90 -33.155 -10.777 -13.853
    8   HD11  LEU  90          HD13      LEU  90 -31.426 -10.446 -13.741
    9   HD23  LEU  90          HD21      LEU  90 -32.800 -12.926 -13.706
   10   HD22  LEU  90          HD22      LEU  90 -33.772 -13.073 -12.241
   11   HD21  LEU  90          HD23      LEU  90 -32.141 -13.745 -12.289

  No H/Q in entry =          11
  In of MODEL   85
    1    H    GLY  91           H        GLY  91 -29.905 -11.313  -8.798
    2    HA3  GLY  91           HA2      GLY  91 -32.193 -10.130  -7.723
    3    HA2  GLY  91           HA3      GLY  91 -30.813 -10.723  -6.801

  No H/Q in entry =           3
  In of MODEL   85
    1    H    VAL  92           H        VAL  92 -28.838  -8.957  -7.654
    2    HA   VAL  92           HA       VAL  92 -29.532  -6.647  -6.070
    3    HB   VAL  92           HB       VAL  92 -27.019  -7.188  -7.696
    4   HG12  VAL  92          HG11      VAL  92 -27.094  -5.325  -5.346
    5   HG11  VAL  92          HG12      VAL  92 -27.754  -4.741  -6.875
    6   HG13  VAL  92          HG13      VAL  92 -26.074  -5.270  -6.785
    7   HG22  VAL  92          HG21      VAL  92 -26.838  -8.801  -6.125
    8   HG21  VAL  92          HG22      VAL  92 -27.944  -7.994  -5.011
    9   HG23  VAL  92          HG23      VAL  92 -26.271  -7.451  -5.142

  No H/Q in entry =           9
  In of MODEL   85
    1    H    LEU  93           H        LEU  93 -29.180  -7.282  -9.502
    2    HA   LEU  93           HA       LEU  93 -29.440  -4.625 -10.398
    3    HB2  LEU  93           HB2      LEU  93 -28.879  -6.484 -11.887
    4    HB3  LEU  93           HB3      LEU  93 -30.493  -7.157 -11.657
    5    HG   LEU  93           HG       LEU  93 -31.444  -5.145 -12.749
    6   HD11  LEU  93          HD11      LEU  93 -29.533  -3.624 -12.244
    7   HD13  LEU  93          HD12      LEU  93 -29.989  -3.618 -13.949
    8   HD12  LEU  93          HD13      LEU  93 -28.563  -4.509 -13.422
    9   HD23  LEU  93          HD21      LEU  93 -30.447  -5.722 -15.052
   10   HD22  LEU  93          HD22      LEU  93 -31.325  -6.959 -14.153
   11   HD21  LEU  93          HD23      LEU  93 -29.560  -6.966 -14.172

  No H/Q in entry =          11
  In of MODEL   85
    1    H    LYS  94           H        LYS  94 -31.896  -7.095  -9.555
    2    HA   LYS  94           HA       LYS  94 -34.193  -5.563 -10.140
    3    HB2  LYS  94           HB2      LYS  94 -33.739  -7.789  -8.158
    4    HB3  LYS  94           HB3      LYS  94 -35.313  -7.034  -8.403
    5    HG2  LYS  94           HG2      LYS  94 -35.276  -7.784 -10.746
    6    HG3  LYS  94           HG3      LYS  94 -33.740  -8.594 -10.442
    7    HD2  LYS  94           HD2      LYS  94 -34.890  -9.910  -8.622
    8    HD3  LYS  94           HD3      LYS  94 -36.414  -9.201  -9.155
    9    HE2  LYS  94           HE2      LYS  94 -35.954 -10.121 -11.437
   10    HE3  LYS  94           HE3      LYS  94 -34.562 -10.962 -10.756
   11    HZ3  LYS  94           HZ1      LYS  94 -36.466 -12.415 -10.925
   12    HZ2  LYS  94           HZ2      LYS  94 -37.393 -11.366  -9.962
   13    HZ1  LYS  94           HZ3      LYS  94 -36.054 -12.170  -9.296

  No H/Q in entry =          13
  In of MODEL   85
    1    H    ALA  95           H        ALA  95 -32.347  -5.785  -7.111
    2    HA   ALA  95           HA       ALA  95 -34.124  -4.159  -5.595
    3    HB2  ALA  95           HB1      ALA  95 -31.795  -5.623  -5.097
    4    HB3  ALA  95           HB2      ALA  95 -32.729  -4.698  -3.923
    5    HB1  ALA  95           HB3      ALA  95 -31.362  -3.950  -4.749

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ALA  96           H        ALA  96 -31.474  -3.374  -7.708
    2    HA   ALA  96           HA       ALA  96 -31.271  -0.628  -6.903
    3    HB2  ALA  96           HB1      ALA  96 -29.922  -0.425  -9.023
    4    HB3  ALA  96           HB2      ALA  96 -30.290  -2.117  -9.359
    5    HB1  ALA  96           HB3      ALA  96 -29.345  -1.686  -7.934

  No H/Q in entry =           5
  In of MODEL   85
    1    H    VAL  97           H        VAL  97 -32.889  -2.253  -9.594
    2    HA   VAL  97           HA       VAL  97 -33.887   0.099 -10.812
    3    HB   VAL  97           HB       VAL  97 -34.803  -2.795 -10.881
    4   HG11  VAL  97          HG11      VAL  97 -36.525  -0.719 -11.325
    5   HG13  VAL  97          HG12      VAL  97 -36.650  -2.299 -12.100
    6   HG12  VAL  97          HG13      VAL  97 -35.856  -0.968 -12.938
    7   HG21  VAL  97          HG21      VAL  97 -33.477  -0.990 -12.907
    8   HG23  VAL  97          HG22      VAL  97 -33.994  -2.649 -13.211
    9   HG22  VAL  97          HG23      VAL  97 -32.721  -2.323 -12.034

  No H/Q in entry =           9
  In of MODEL   85
    1    H    ALA  98           H        ALA  98 -35.124  -2.066  -8.290
    2    HA   ALA  98           HA       ALA  98 -37.638  -0.828  -7.899
    3    HB1  ALA  98           HB1      ALA  98 -36.697  -3.075  -6.902
    4    HB3  ALA  98           HB2      ALA  98 -37.833  -2.120  -5.949
    5    HB2  ALA  98           HB3      ALA  98 -36.105  -2.039  -5.605

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ALA  99           H        ALA  99 -34.515  -0.165  -6.273
    2    HA   ALA  99           HA       ALA  99 -35.553   1.839  -4.577
    3    HB1  ALA  99           HB1      ALA  99 -32.948   0.860  -5.362
    4    HB2  ALA  99           HB2      ALA  99 -33.454   1.611  -3.848
    5    HB3  ALA  99           HB3      ALA  99 -32.954   2.617  -5.208

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ILE 100           H        ILE 100 -34.541   1.973  -7.941
    2    HA   ILE 100           HA       ILE 100 -34.613   4.829  -8.123
    3    HB   ILE 100           HB       ILE 100 -34.812   2.706 -10.287
    4   HG12  ILE 100          HG12      ILE 100 -32.566   4.606  -9.614
    5   HG13  ILE 100          HG13      ILE 100 -32.660   2.953  -9.004
    6   HG21  ILE 100          HG21      ILE 100 -35.123   5.642 -10.377
    7   HG23  ILE 100          HG22      ILE 100 -35.688   4.407 -11.504
    8   HG22  ILE 100          HG23      ILE 100 -34.014   4.960 -11.568
    9   HD12  ILE 100          HD11      ILE 100 -32.118   3.925 -11.771
   10   HD11  ILE 100          HD12      ILE 100 -32.838   2.333 -11.529
   11   HD13  ILE 100          HD13      ILE 100 -31.268   2.708 -10.820

  No H/Q in entry =          11
  In of MODEL   85
    1    H    LYS 101           H        LYS 101 -37.012   2.318  -8.858
    2    HA   LYS 101           HA       LYS 101 -39.038   4.058  -9.816
    3    HB2  LYS 101           HB2      LYS 101 -39.018   1.267  -8.725
    4    HB3  LYS 101           HB3      LYS 101 -40.543   2.093  -9.044
    5    HG2  LYS 101           HG2      LYS 101 -40.086   2.239 -11.344
    6    HG3  LYS 101           HG3      LYS 101 -38.404   1.765 -11.113
    7    HD2  LYS 101           HD2      LYS 101 -39.735  -0.082 -12.010
    8    HD3  LYS 101           HD3      LYS 101 -39.106  -0.457 -10.406
    9    HE2  LYS 101           HE2      LYS 101 -41.189  -1.079  -9.887
   10    HE3  LYS 101           HE3      LYS 101 -41.580   0.642  -9.864
   11    HZ3  LYS 101           HZ1      LYS 101 -42.497   0.547 -11.975
   12    HZ2  LYS 101           HZ2      LYS 101 -43.007  -0.916 -11.281
   13    HZ1  LYS 101           HZ3      LYS 101 -41.711  -0.904 -12.376

  No H/Q in entry =          13
  In of MODEL   85
    1    H    LYS 102           H        LYS 102 -38.573   2.522  -6.632
    2    HA   LYS 102           HA       LYS 102 -40.761   3.786  -5.396
    3    HB2  LYS 102           HB2      LYS 102 -39.588   1.861  -4.418
    4    HB3  LYS 102           HB3      LYS 102 -38.155   2.859  -4.174
    5    HG2  LYS 102           HG2      LYS 102 -39.403   4.282  -2.646
    6    HG3  LYS 102           HG3      LYS 102 -40.839   3.289  -2.892
    7    HD2  LYS 102           HD2      LYS 102 -39.675   1.364  -1.902
    8    HD3  LYS 102           HD3      LYS 102 -38.241   2.359  -1.655
    9    HE2  LYS 102           HE2      LYS 102 -39.523   3.869  -0.213
   10    HE3  LYS 102           HE3      LYS 102 -40.975   2.906  -0.481
   11    HZ1  LYS 102           HZ1      LYS 102 -39.315   1.073   0.482
   12    HZ3  LYS 102           HZ2      LYS 102 -40.381   1.988   1.435
   13    HZ2  LYS 102           HZ3      LYS 102 -38.752   2.451   1.299

  No H/Q in entry =          13
  In of MODEL   85
    1    H    ALA 103           H        ALA 103 -37.765   5.076  -6.420
    2    HA   ALA 103           HA       ALA 103 -37.882   7.374  -4.606
    3    HB2  ALA 103           HB1      ALA 103 -35.878   8.052  -6.191
    4    HB3  ALA 103           HB2      ALA 103 -35.912   6.340  -6.612
    5    HB1  ALA 103           HB3      ALA 103 -35.650   6.832  -4.939

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ALA 104           H        ALA 104 -38.561   6.713  -7.955
    2    HA   ALA 104           HA       ALA 104 -39.045   9.525  -8.535
    3    HB2  ALA 104           HB1      ALA 104 -39.133   8.890 -10.745
    4    HB1  ALA 104           HB2      ALA 104 -39.917   7.352 -10.380
    5    HB3  ALA 104           HB3      ALA 104 -38.183   7.545 -10.114

  No H/Q in entry =           5
  In of MODEL   85
    1    H    ALA 105           H        ALA 105 -40.716   7.461  -6.742
    2    HA   ALA 105           HA       ALA 105 -43.084   8.945  -6.674
    3    HB2  ALA 105           HB1      ALA 105 -43.880   8.142  -8.716
    4    HB3  ALA 105           HB2      ALA 105 -44.552   6.964  -7.589
    5    HB1  ALA 105           HB3      ALA 105 -43.105   6.572  -8.516

  No H/Q in entry =           5
  In of MODEL   86
    1    H1   ALA   1           H3       ALA   1 -12.124 -15.962  -2.419
    2    H2   ALA   1           H2       ALA   1 -11.170 -17.100  -3.251
    3    H3   ALA   1           H1       ALA   1 -12.318 -16.168  -4.093
    4    HA   ALA   1           HA       ALA   1 -13.705 -17.878  -3.851
    5    HB3  ALA   1           HB1      ALA   1 -12.297 -19.637  -3.376
    6    HB1  ALA   1           HB2      ALA   1 -13.060 -19.523  -1.790
    7    HB2  ALA   1           HB3      ALA   1 -11.489 -18.772  -2.068

  No H/Q in entry =           7
  In of MODEL   86
    1    H    GLU   2           H        GLU   2 -15.327 -18.737  -2.199
    2    HA   GLU   2           HA       GLU   2 -16.992 -17.025  -1.154
    3    HB2  GLU   2           HB2      GLU   2 -16.040 -19.437   0.405
    4    HB3  GLU   2           HB3      GLU   2 -17.572 -18.597   0.650
    5    HG2  GLU   2           HG2      GLU   2 -18.537 -19.698  -1.084
    6    HG3  GLU   2           HG3      GLU   2 -17.213 -19.292  -2.165

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLU   3           H        GLU   3 -15.080 -18.352   1.482
    2    HA   GLU   3           HA       GLU   3 -15.325 -15.994   3.028
    3    HB2  GLU   3           HB2      GLU   3 -13.721 -18.527   3.296
    4    HB3  GLU   3           HB3      GLU   3 -13.504 -17.201   4.438
    5    HG2  GLU   3           HG2      GLU   3 -15.699 -17.366   5.249
    6    HG3  GLU   3           HG3      GLU   3 -16.283 -18.176   3.801

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LEU   4           H        LEU   4 -12.354 -17.456   1.655
    2    HA   LEU   4           HA       LEU   4 -10.536 -15.536   2.252
    3    HB2  LEU   4           HB2      LEU   4 -10.747 -16.848  -0.468
    4    HB3  LEU   4           HB3      LEU   4  -9.303 -16.113   0.219
    5    HG   LEU   4           HG       LEU   4 -10.783 -18.517   1.337
    6   HD13  LEU   4          HD11      LEU   4  -9.137 -19.864   0.419
    7   HD12  LEU   4          HD12      LEU   4  -7.937 -18.572   0.392
    8   HD11  LEU   4          HD13      LEU   4  -9.220 -18.609  -0.816
    9   HD23  LEU   4          HD21      LEU   4  -8.537 -18.557   2.727
   10   HD22  LEU   4          HD22      LEU   4  -9.867 -17.526   3.247
   11   HD21  LEU   4          HD23      LEU   4  -8.507 -16.830   2.366

  No H/Q in entry =          11
  In of MODEL   86
    1    H    GLU   5           H        GLU   5 -12.862 -15.359  -0.432
    2    HA   GLU   5           HA       GLU   5 -11.873 -12.872  -1.440
    3    HB2  GLU   5           HB2      GLU   5 -14.268 -14.587  -1.912
    4    HB3  GLU   5           HB3      GLU   5 -14.345 -12.900  -2.423
    5    HG2  GLU   5           HG2      GLU   5 -11.878 -14.420  -3.120
    6    HG3  GLU   5           HG3      GLU   5 -13.349 -14.814  -4.010

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLU   6           H        GLU   6 -14.600 -13.762   0.646
    2    HA   GLU   6           HA       GLU   6 -15.526 -11.090   1.030
    3    HB2  GLU   6           HB2      GLU   6 -15.930 -13.625   2.634
    4    HB3  GLU   6           HB3      GLU   6 -16.744 -12.101   2.986
    5    HG2  GLU   6           HG2      GLU   6 -16.882 -13.542   0.323
    6    HG3  GLU   6           HG3      GLU   6 -18.123 -13.630   1.570

  No H/Q in entry =           6
  In of MODEL   86
    1    H    VAL   7           H        VAL   7 -13.209 -13.177   2.620
    2    HA   VAL   7           HA       VAL   7 -12.764 -11.588   4.942
    3    HB   VAL   7           HB       VAL   7 -11.039 -13.625   3.508
    4   HG11  VAL   7          HG11      VAL   7 -10.593 -12.078   6.067
    5   HG13  VAL   7          HG12      VAL   7  -9.486 -12.290   4.712
    6   HG12  VAL   7          HG13      VAL   7  -9.833 -13.645   5.786
    7   HG21  VAL   7          HG21      VAL   7 -13.291 -14.201   4.721
    8   HG23  VAL   7          HG22      VAL   7 -12.371 -13.914   6.199
    9   HG22  VAL   7          HG23      VAL   7 -11.865 -15.175   5.077

  No H/Q in entry =           9
  In of MODEL   86
    1    H    VAL   8           H        VAL   8 -11.239 -11.706   1.738
    2    HA   VAL   8           HA       VAL   8  -9.192  -9.815   2.231
    3    HB   VAL   8           HB       VAL   8 -10.640 -10.528  -0.330
    4   HG11  VAL   8          HG11      VAL   8  -8.361  -8.656   0.263
    5   HG13  VAL   8          HG12      VAL   8  -9.720  -8.439  -0.841
    6   HG12  VAL   8          HG13      VAL   8  -8.400  -9.525  -1.273
    7   HG23  VAL   8          HG21      VAL   8  -7.793 -11.274   0.100
    8   HG22  VAL   8          HG22      VAL   8  -9.116 -12.229  -0.563
    9   HG21  VAL   8          HG23      VAL   8  -8.930 -12.083   1.182

  No H/Q in entry =           9
  In of MODEL   86
    1    H    MET   9           H        MET   9 -12.535  -9.455   1.056
    2    HA   MET   9           HA       MET   9 -12.491  -6.680   0.609
    3    HB2  MET   9           HB2      MET   9 -14.692  -8.571   1.434
    4    HB3  MET   9           HB3      MET   9 -14.987  -6.844   1.217
    5    HG2  MET   9           HG2      MET   9 -14.074  -7.007  -1.092
    6    HG3  MET   9           HG3      MET   9 -13.876  -8.744  -0.868
    7    HE2  MET   9           HE1      MET   9 -16.527  -6.060  -2.192
    8    HE1  MET   9           HE2      MET   9 -16.043  -5.803  -0.518
    9    HE3  MET   9           HE3      MET   9 -17.699  -6.279  -0.885

  No H/Q in entry =           9
  In of MODEL   86
    1    H    GLY  10           H        GLY  10 -13.151  -8.564   3.542
    2    HA3  GLY  10           HA2      GLY  10 -13.723  -6.376   5.249
    3    HA2  GLY  10           HA3      GLY  10 -13.149  -7.958   5.772

  No H/Q in entry =           3
  In of MODEL   86
    1    H    LEU  11           H        LEU  11 -10.697  -8.069   4.468
    2    HA   LEU  11           HA       LEU  11  -9.015  -6.614   6.225
    3    HB2  LEU  11           HB2      LEU  11  -8.446  -8.045   3.626
    4    HB3  LEU  11           HB3      LEU  11  -7.186  -7.327   4.627
    5    HG   LEU  11           HG       LEU  11  -9.176  -9.371   5.644
    6   HD13  LEU  11          HD11      LEU  11  -7.938 -10.605   4.090
    7   HD12  LEU  11          HD12      LEU  11  -7.007 -10.829   5.570
    8   HD11  LEU  11          HD13      LEU  11  -6.471  -9.665   4.360
    9   HD22  LEU  11          HD21      LEU  11  -8.339  -8.343   7.560
   10   HD21  LEU  11          HD22      LEU  11  -6.801  -7.932   6.801
   11   HD23  LEU  11          HD23      LEU  11  -7.116  -9.589   7.317

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  12           H        ILE  12  -9.907  -6.090   2.829
    2    HA   ILE  12           HA       ILE  12  -8.231  -3.848   2.400
    3    HB   ILE  12           HB       ILE  12 -10.878  -4.533   1.095
    4   HG12  ILE  12          HG12      ILE  12  -8.839  -6.190   1.050
    5   HG13  ILE  12          HG13      ILE  12  -9.702  -5.853  -0.437
    6   HG22  ILE  12          HG21      ILE  12  -9.942  -3.162  -0.801
    7   HG21  ILE  12          HG22      ILE  12  -8.643  -2.647   0.268
    8   HG23  ILE  12          HG23      ILE  12 -10.296  -2.246   0.632
    9   HD12  ILE  12          HD11      ILE  12  -7.181  -5.806  -0.612
   10   HD11  ILE  12          HD12      ILE  12  -7.202  -4.390   0.436
   11   HD13  ILE  12          HD13      ILE  12  -7.969  -4.329  -1.133

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  13           H        ILE  13 -11.595  -4.138   3.480
    2    HA   ILE  13           HA       ILE  13 -12.079  -1.354   3.735
    3    HB   ILE  13           HB       ILE  13 -13.269  -3.781   5.098
    4   HG12  ILE  13          HG12      ILE  13 -13.492  -3.240   2.561
    5   HG13  ILE  13          HG13      ILE  13 -14.917  -3.707   3.463
    6   HG22  ILE  13          HG21      ILE  13 -15.178  -2.164   5.665
    7   HG21  ILE  13          HG22      ILE  13 -14.041  -0.859   5.352
    8   HG23  ILE  13          HG23      ILE  13 -13.718  -2.016   6.641
    9   HD11  ILE  13          HD11      ILE  13 -14.128  -0.824   2.983
   10   HD13  ILE  13          HD12      ILE  13 -15.618  -1.425   3.681
   11   HD12  ILE  13          HD13      ILE  13 -15.284  -1.719   1.990

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ASN  14           H        ASN  14 -10.956  -3.824   6.026
    2    HA   ASN  14           HA       ASN  14 -10.779  -2.174   8.305
    3    HB2  ASN  14           HB2      ASN  14 -10.502  -4.781   7.996
    4    HB3  ASN  14           HB3      ASN  14  -8.796  -4.379   7.844
    5   HD21  ASN  14          HD21      ASN  14  -9.428  -5.899  10.024
    6   HD22  ASN  14          HD22      ASN  14  -9.414  -4.972  11.445

  No H/Q in entry =           6
  In of MODEL   86
    1    H    SER  15           H        SER  15  -8.359  -2.987   5.827
    2    HA   SER  15           HA       SER  15  -6.234  -1.470   6.901
    3    HB2  SER  15           HB2      SER  15  -5.204  -1.684   4.747
    4    HB3  SER  15           HB3      SER  15  -6.142  -3.154   4.978
    5    HG   SER  15           HG       SER  15  -6.327  -1.501   2.992

  No H/Q in entry =           5
  In of MODEL   86
    1    H    GLY  16           H        GLY  16  -8.834  -0.638   4.639
    2    HA3  GLY  16           HA2      GLY  16  -7.999   2.008   4.079
    3    HA2  GLY  16           HA3      GLY  16  -9.643   1.397   3.913

  No H/Q in entry =           3
  In of MODEL   86
    1    H    GLN  17           H        GLN  17 -10.190   0.679   6.564
    2    HA   GLN  17           HA       GLN  17 -10.927   3.182   7.690
    3    HB2  GLN  17           HB2      GLN  17 -12.136   1.080   8.176
    4    HB3  GLN  17           HB3      GLN  17 -10.728   0.486   9.059
    5    HG2  GLN  17           HG2      GLN  17 -10.899   2.423  10.600
    6    HG3  GLN  17           HG3      GLN  17 -12.337   2.966   9.737
    7   HE21  GLN  17          HE21      GLN  17 -13.993   2.559  11.251
    8   HE22  GLN  17          HE22      GLN  17 -14.280   1.039  11.951

  No H/Q in entry =           8
  In of MODEL   86
    1    H    ALA  18           H        ALA  18  -8.278   0.930   8.331
    2    HA   ALA  18           HA       ALA  18  -7.203   2.167  10.601
    3    HB2  ALA  18           HB1      ALA  18  -6.564  -0.049   9.246
    4    HB3  ALA  18           HB2      ALA  18  -5.414   0.751  10.318
    5    HB1  ALA  18           HB3      ALA  18  -5.332   1.022   8.576

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ARG  19           H        ARG  19  -6.422   2.682   7.153
    2    HA   ARG  19           HA       ARG  19  -4.547   4.751   7.580
    3    HB2  ARG  19           HB2      ARG  19  -4.852   3.597   5.389
    4    HB3  ARG  19           HB3      ARG  19  -6.403   4.421   5.201
    5    HG2  ARG  19           HG2      ARG  19  -5.297   6.604   5.264
    6    HG3  ARG  19           HG3      ARG  19  -3.742   5.837   5.579
    7    HD2  ARG  19           HD2      ARG  19  -3.863   6.415   3.232
    8    HD3  ARG  19           HD3      ARG  19  -3.930   4.654   3.386
    9    HE   ARG  19           HE       ARG  19  -6.573   5.535   3.362
   10   HH21  ARG  19          HH11      ARG  19  -7.761   5.670   1.438
   11   HH22  ARG  19          HH12      ARG  19  -6.933   5.749  -0.078
   12   HH11  ARG  19          HH21      ARG  19  -3.789   5.619   1.340
   13   HH12  ARG  19          HH22      ARG  19  -4.683   5.718  -0.133

  No H/Q in entry =          13
  In of MODEL   86
    1    H    SER  20           H        SER  20  -8.043   4.826   6.964
    2    HA   SER  20           HA       SER  20  -8.430   7.577   6.901
    3    HB2  SER  20           HB2      SER  20 -10.206   5.944   6.405
    4    HB3  SER  20           HB3      SER  20 -10.259   5.491   8.107
    5    HG   SER  20           HG       SER  20 -10.593   8.154   7.210

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LEU  21           H        LEU  21  -8.419   5.408   9.716
    2    HA   LEU  21           HA       LEU  21  -8.890   7.408  11.669
    3    HB2  LEU  21           HB2      LEU  21  -7.503   4.725  11.853
    4    HB3  LEU  21           HB3      LEU  21  -7.842   5.745  13.247
    5    HG   LEU  21           HG       LEU  21  -9.974   4.796  11.309
    6   HD13  LEU  21          HD11      LEU  21 -10.564   3.140  13.034
    7   HD12  LEU  21          HD12      LEU  21  -9.198   3.668  14.017
    8   HD11  LEU  21          HD13      LEU  21  -8.916   2.884  12.461
    9   HD21  LEU  21          HD21      LEU  21  -9.958   6.358  13.880
   10   HD23  LEU  21          HD22      LEU  21 -11.338   5.315  13.546
   11   HD22  LEU  21          HD23      LEU  21 -10.935   6.618  12.438

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ALA  22           H        ALA  22  -5.916   6.062  10.281
    2    HA   ALA  22           HA       ALA  22  -4.059   7.405  11.905
    3    HB2  ALA  22           HB1      ALA  22  -3.614   5.547  10.225
    4    HB1  ALA  22           HB2      ALA  22  -2.433   6.857  10.259
    5    HB3  ALA  22           HB3      ALA  22  -3.645   6.793   8.978

  No H/Q in entry =           5
  In of MODEL   86
    1    H    TYR  23           H        TYR  23  -5.373   8.391   8.712
    2    HA   TYR  23           HA       TYR  23  -4.065  10.902   8.636
    3    HB2  TYR  23           HB2      TYR  23  -5.126   9.968   6.643
    4    HB3  TYR  23           HB3      TYR  23  -6.710  10.060   7.416
    5    HD1  TYR  23           HD1      TYR  23  -3.822  12.137   6.283
    6    HD2  TYR  23           HD2      TYR  23  -7.976  12.051   7.369
    7    HE1  TYR  23           HE1      TYR  23  -4.071  14.481   5.510
    8    HE2  TYR  23           HE2      TYR  23  -8.227  14.395   6.596
    9    HH   TYR  23           HH       TYR  23  -5.505  16.137   5.105

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ALA  24           H        ALA  24  -7.180   9.895  10.005
    2    HA   ALA  24           HA       ALA  24  -8.050  12.479  10.760
    3    HB1  ALA  24           HB1      ALA  24  -9.856  11.209  11.225
    4    HB2  ALA  24           HB2      ALA  24  -9.030  10.654  12.680
    5    HB3  ALA  24           HB3      ALA  24  -8.888   9.736  11.181

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ALA  25           H        ALA  25  -6.027  10.052  12.355
    2    HA   ALA  25           HA       ALA  25  -5.716  11.320  14.853
    3    HB2  ALA  25           HB1      ALA  25  -4.918   8.973  14.047
    4    HB3  ALA  25           HB2      ALA  25  -3.918   9.849  15.208
    5    HB1  ALA  25           HB3      ALA  25  -3.473   9.828  13.501

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LEU  26           H        LEU  26  -3.914  11.625  11.819
    2    HA   LEU  26           HA       LEU  26  -1.981  13.472  12.736
    3    HB2  LEU  26           HB2      LEU  26  -1.656  12.313  10.639
    4    HB3  LEU  26           HB3      LEU  26  -3.134  13.001   9.974
    5    HG   LEU  26           HG       LEU  26  -2.146  15.264  10.103
    6   HD12  LEU  26          HD11      LEU  26   0.390  15.315  10.529
    7   HD11  LEU  26          HD12      LEU  26   0.181  13.735  11.280
    8   HD13  LEU  26          HD13      LEU  26  -0.646  15.144  11.946
    9   HD21  LEU  26          HD21      LEU  26  -0.373  13.222   8.727
   10   HD23  LEU  26          HD22      LEU  26  -0.434  14.941   8.347
   11   HD22  LEU  26          HD23      LEU  26  -1.844  13.926   8.057

  No H/Q in entry =          11
  In of MODEL   86
    1    H    LYS  27           H        LYS  27  -5.161  13.911  11.241
    2    HA   LYS  27           HA       LYS  27  -5.136  16.699  11.030
    3    HB2  LYS  27           HB2      LYS  27  -6.859  15.198  10.043
    4    HB3  LYS  27           HB3      LYS  27  -7.520  14.941  11.657
    5    HG2  LYS  27           HG2      LYS  27  -7.978  17.344  11.880
    6    HG3  LYS  27           HG3      LYS  27  -7.266  17.641  10.291
    7    HD2  LYS  27           HD2      LYS  27  -8.977  16.182   9.253
    8    HD3  LYS  27           HD3      LYS  27  -9.695  15.902  10.841
    9    HE2  LYS  27           HE2      LYS  27 -10.166  18.309  11.070
   10    HE3  LYS  27           HE3      LYS  27  -9.420  18.612   9.497
   11    HZ3  LYS  27           HZ1      LYS  27 -11.795  18.459   9.245
   12    HZ2  LYS  27           HZ2      LYS  27 -11.830  16.946  10.022
   13    HZ1  LYS  27           HZ3      LYS  27 -11.079  17.110   8.503

  No H/Q in entry =          13
  In of MODEL   86
    1    H    GLN  28           H        GLN  28  -6.015  14.617  13.763
    2    HA   GLN  28           HA       GLN  28  -6.940  16.619  15.525
    3    HB2  GLN  28           HB2      GLN  28  -5.514  14.005  16.085
    4    HB3  GLN  28           HB3      GLN  28  -6.268  15.008  17.326
    5    HG2  GLN  28           HG2      GLN  28  -7.713  13.865  14.918
    6    HG3  GLN  28           HG3      GLN  28  -7.767  13.179  16.541
    7   HE21  GLN  28          HE21      GLN  28  -9.697  14.894  14.594
    8   HE22  GLN  28          HE22      GLN  28 -10.439  15.935  15.710

  No H/Q in entry =           8
  In of MODEL   86
    1    H    ALA  29           H        ALA  29  -3.705  15.353  14.857
    2    HA   ALA  29           HA       ALA  29  -2.290  16.775  16.835
    3    HB1  ALA  29           HB1      ALA  29  -0.347  16.098  15.728
    4    HB3  ALA  29           HB2      ALA  29  -1.096  16.207  14.135
    5    HB2  ALA  29           HB3      ALA  29  -1.509  14.875  15.214

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LYS  30           H        LYS  30  -3.141  17.630  13.497
    2    HA   LYS  30           HA       LYS  30  -1.753  20.082  13.391
    3    HB2  LYS  30           HB2      LYS  30  -4.269  19.179  11.975
    4    HB3  LYS  30           HB3      LYS  30  -3.447  20.700  11.628
    5    HG2  LYS  30           HG2      LYS  30  -1.364  19.422  11.130
    6    HG3  LYS  30           HG3      LYS  30  -2.259  17.919  11.378
    7    HD2  LYS  30           HD2      LYS  30  -3.820  18.538   9.573
    8    HD3  LYS  30           HD3      LYS  30  -2.948  20.053   9.327
    9    HE2  LYS  30           HE2      LYS  30  -0.903  18.774   8.763
   10    HE3  LYS  30           HE3      LYS  30  -1.793  17.264   8.978
   11    HZ2  LYS  30           HZ1      LYS  30  -1.614  18.126   6.633
   12    HZ1  LYS  30           HZ2      LYS  30  -2.670  19.382   7.090
   13    HZ3  LYS  30           HZ3      LYS  30  -3.182  17.761   7.167

  No H/Q in entry =          13
  In of MODEL   86
    1    H    GLN  31           H        GLN  31  -4.852  19.212  14.794
    2    HA   GLN  31           HA       GLN  31  -5.638  21.965  15.230
    3    HB2  GLN  31           HB2      GLN  31  -6.805  19.516  16.559
    4    HB3  GLN  31           HB3      GLN  31  -7.576  21.081  16.303
    5    HG2  GLN  31           HG2      GLN  31  -6.848  20.297  13.720
    6    HG3  GLN  31           HG3      GLN  31  -7.365  18.792  14.471
    7   HE21  GLN  31          HE21      GLN  31  -8.778  20.346  12.356
    8   HE22  GLN  31          HE22      GLN  31 -10.297  20.730  13.006

  No H/Q in entry =           8
  In of MODEL   86
    1    H    GLY  32           H        GLY  32  -3.318  20.060  16.569
    2    HA3  GLY  32           HA2      GLY  32  -1.929  20.540  18.375
    3    HA2  GLY  32           HA3      GLY  32  -3.069  21.778  18.888

  No H/Q in entry =           3
  In of MODEL   86
    1    H    ASP  33           H        ASP  33  -4.467  18.726  18.234
    2    HA   ASP  33           HA       ASP  33  -4.887  18.278  21.114
    3    HB2  ASP  33           HB2      ASP  33  -6.276  17.246  18.635
    4    HB3  ASP  33           HB3      ASP  33  -6.624  16.640  20.252

  No H/Q in entry =           4
  In of MODEL   86
    1    H    PHE  34           H        PHE  34  -2.714  17.443  21.432
    2    HA   PHE  34           HA       PHE  34  -1.693  15.195  20.045
    3    HB2  PHE  34           HB2      PHE  34  -1.094  16.195  22.838
    4    HB3  PHE  34           HB3      PHE  34  -0.153  14.975  21.980
    5    HD1  PHE  34           HD1      PHE  34  -0.352  18.402  22.699
    6    HD2  PHE  34           HD2      PHE  34   0.510  15.691  19.480
    7    HE1  PHE  34           HE1      PHE  34   0.937  20.178  21.543
    8    HE2  PHE  34           HE2      PHE  34   1.793  17.469  18.328
    9    HZ   PHE  34           HZ       PHE  34   2.009  19.709  19.364

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ALA  35           H        ALA  35  -3.746  15.470  22.899
    2    HA   ALA  35           HA       ALA  35  -3.520  12.814  23.807
    3    HB3  ALA  35           HB1      ALA  35  -5.986  13.427  24.652
    4    HB1  ALA  35           HB2      ALA  35  -5.461  15.047  24.191
    5    HB2  ALA  35           HB3      ALA  35  -4.546  14.134  25.390

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ALA  36           H        ALA  36  -5.971  14.305  21.691
    2    HA   ALA  36           HA       ALA  36  -7.369  11.882  21.218
    3    HB1  ALA  36           HB1      ALA  36  -8.830  13.291  20.250
    4    HB3  ALA  36           HB2      ALA  36  -7.655  13.714  19.004
    5    HB2  ALA  36           HB3      ALA  36  -7.692  14.608  20.524

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ALA  37           H        ALA  37  -4.692  13.480  19.553
    2    HA   ALA  37           HA       ALA  37  -4.637  11.835  17.263
    3    HB3  ALA  37           HB1      ALA  37  -2.661  13.566  18.687
    4    HB2  ALA  37           HB2      ALA  37  -3.185  13.612  17.005
    5    HB1  ALA  37           HB3      ALA  37  -2.026  12.391  17.536

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LYS  38           H        LYS  38  -2.890  11.554  20.350
    2    HA   LYS  38           HA       LYS  38  -1.547   9.161  19.876
    3    HB2  LYS  38           HB2      LYS  38  -1.890  10.930  22.013
    4    HB3  LYS  38           HB3      LYS  38  -2.502   9.399  22.633
    5    HG2  LYS  38           HG2      LYS  38  -0.398   8.290  22.110
    6    HG3  LYS  38           HG3      LYS  38   0.204   9.736  21.293
    7    HD2  LYS  38           HD2      LYS  38   0.357  10.964  23.324
    8    HD3  LYS  38           HD3      LYS  38  -0.658   9.811  24.191
    9    HE2  LYS  38           HE2      LYS  38   1.697   9.513  24.821
   10    HE3  LYS  38           HE3      LYS  38   1.106   8.090  23.961
   11    HZ3  LYS  38           HZ1      LYS  38   2.411   8.510  22.183
   12    HZ2  LYS  38           HZ2      LYS  38   3.355   9.349  23.320
   13    HZ1  LYS  38           HZ3      LYS  38   2.274  10.197  22.321

  No H/Q in entry =          13
  In of MODEL   86
    1    H    ALA  39           H        ALA  39  -4.794   9.640  21.264
    2    HA   ALA  39           HA       ALA  39  -5.338   6.919  21.777
    3    HB3  ALA  39           HB1      ALA  39  -7.507   8.846  20.993
    4    HB2  ALA  39           HB2      ALA  39  -6.617   9.085  22.497
    5    HB1  ALA  39           HB3      ALA  39  -7.522   7.594  22.236

  No H/Q in entry =           5
  In of MODEL   86
    1    H    MET  40           H        MET  40  -5.925   8.916  18.920
    2    HA   MET  40           HA       MET  40  -7.382   6.968  17.461
    3    HB2  MET  40           HB2      MET  40  -5.785   9.371  16.553
    4    HB3  MET  40           HB3      MET  40  -6.800   8.400  15.483
    5    HG2  MET  40           HG2      MET  40  -7.854   9.652  18.031
    6    HG3  MET  40           HG3      MET  40  -7.910  10.480  16.477
    7    HE3  MET  40           HE1      MET  40 -10.474   8.835  14.409
    8    HE2  MET  40           HE2      MET  40  -8.722   8.963  14.268
    9    HE1  MET  40           HE3      MET  40  -9.651  10.325  14.892

  No H/Q in entry =           9
  In of MODEL   86
    1    H    MET  41           H        MET  41  -3.897   7.730  17.595
    2    HA   MET  41           HA       MET  41  -3.117   5.973  15.505
    3    HB2  MET  41           HB2      MET  41  -1.516   6.661  17.982
    4    HB3  MET  41           HB3      MET  41  -0.887   6.011  16.472
    5    HG2  MET  41           HG2      MET  41  -2.055   8.181  15.454
    6    HG3  MET  41           HG3      MET  41  -1.830   8.778  17.097
    7    HE2  MET  41           HE1      MET  41   1.101   6.702  17.479
    8    HE1  MET  41           HE2      MET  41   0.300   7.994  18.369
    9    HE3  MET  41           HE3      MET  41   1.924   8.246  17.732

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ASP  42           H        ASP  42  -3.513   5.511  18.992
    2    HA   ASP  42           HA       ASP  42  -2.459   2.926  19.167
    3    HB2  ASP  42           HB2      ASP  42  -3.354   4.686  20.978
    4    HB3  ASP  42           HB3      ASP  42  -4.773   3.650  20.904

  No H/Q in entry =           4
  In of MODEL   86
    1    H    GLN  43           H        GLN  43  -5.799   4.003  18.648
    2    HA   GLN  43           HA       GLN  43  -6.922   1.406  18.459
    3    HB2  GLN  43           HB2      GLN  43  -7.860   4.046  17.315
    4    HB3  GLN  43           HB3      GLN  43  -8.812   2.560  17.295
    5    HG2  GLN  43           HG2      GLN  43  -8.528   2.451  19.804
    6    HG3  GLN  43           HG3      GLN  43  -7.815   4.061  19.729
    7   HE21  GLN  43          HE21      GLN  43 -10.002   4.131  21.220
    8   HE22  GLN  43          HE22      GLN  43 -11.363   4.693  20.380

  No H/Q in entry =           8
  In of MODEL   86
    1    H    SER  44           H        SER  44  -5.588   3.620  16.044
    2    HA   SER  44           HA       SER  44  -6.268   2.121  13.758
    3    HB2  SER  44           HB2      SER  44  -5.031   4.516  14.197
    4    HB3  SER  44           HB3      SER  44  -3.668   3.528  13.677
    5    HG   SER  44           HG       SER  44  -4.780   4.485  11.905

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ARG  45           H        ARG  45  -3.399   2.038  15.851
    2    HA   ARG  45           HA       ARG  45  -1.898   0.090  14.483
    3    HB2  ARG  45           HB2      ARG  45  -1.075   1.525  16.350
    4    HB3  ARG  45           HB3      ARG  45  -2.064   0.591  17.469
    5    HG2  ARG  45           HG2      ARG  45  -0.815  -1.461  16.841
    6    HG3  ARG  45           HG3      ARG  45   0.199  -0.502  15.763
    7    HD2  ARG  45           HD2      ARG  45   0.914   0.892  17.716
    8    HD3  ARG  45           HD3      ARG  45  -0.005  -0.186  18.790
    9    HE   ARG  45           HE       ARG  45   1.713  -1.775  17.223
   10   HH21  ARG  45          HH11      ARG  45   3.616  -2.580  18.072
   11   HH22  ARG  45          HH12      ARG  45   4.377  -1.783  19.404
   12   HH11  ARG  45          HH21      ARG  45   1.987   0.703  19.605
   13   HH12  ARG  45          HH22      ARG  45   3.454   0.078  20.269

  No H/Q in entry =          13
  In of MODEL   86
    1    H    MET  46           H        MET  46  -4.304  -0.238  17.074
    2    HA   MET  46           HA       MET  46  -4.118  -3.035  17.392
    3    HB2  MET  46           HB2      MET  46  -6.304  -1.042  17.976
    4    HB3  MET  46           HB3      MET  46  -6.500  -2.762  18.320
    5    HG2  MET  46           HG2      MET  46  -4.516  -2.737  19.748
    6    HG3  MET  46           HG3      MET  46  -4.220  -1.050  19.353
    7    HE1  MET  46           HE1      MET  46  -6.344  -3.674  20.882
    8    HE3  MET  46           HE2      MET  46  -7.776  -2.882  20.236
    9    HE2  MET  46           HE3      MET  46  -7.488  -2.883  21.972

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ALA  47           H        ALA  47  -6.143  -1.041  15.281
    2    HA   ALA  47           HA       ALA  47  -7.741  -3.107  14.216
    3    HB3  ALA  47           HB1      ALA  47  -8.435  -0.876  13.788
    4    HB1  ALA  47           HB2      ALA  47  -7.934  -1.512  12.221
    5    HB2  ALA  47           HB3      ALA  47  -6.865  -0.433  13.119

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LEU  48           H        LEU  48  -4.627  -1.781  13.174
    2    HA   LEU  48           HA       LEU  48  -4.324  -3.379  10.840
    3    HB2  LEU  48           HB2      LEU  48  -2.284  -2.080  12.653
    4    HB3  LEU  48           HB3      LEU  48  -1.903  -2.804  11.091
    5    HG   LEU  48           HG       LEU  48  -3.942  -0.598  11.462
    6   HD13  LEU  48          HD11      LEU  48  -1.829   0.294  12.134
    7   HD12  LEU  48          HD12      LEU  48  -2.100   0.840  10.479
    8   HD11  LEU  48          HD13      LEU  48  -0.995  -0.499  10.798
    9   HD22  LEU  48          HD21      LEU  48  -4.398  -1.594   9.388
   10   HD21  LEU  48          HD22      LEU  48  -2.711  -2.019   9.102
   11   HD23  LEU  48          HD23      LEU  48  -3.240  -0.344   8.934

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ASN  49           H        ASN  49  -3.292  -3.756  14.193
    2    HA   ASN  49           HA       ASN  49  -1.674  -6.011  13.879
    3    HB2  ASN  49           HB2      ASN  49  -1.707  -4.679  15.922
    4    HB3  ASN  49           HB3      ASN  49  -3.371  -5.147  16.236
    5   HD21  ASN  49          HD21      ASN  49  -0.108  -6.574  15.838
    6   HD22  ASN  49          HD22      ASN  49  -0.382  -7.871  16.896

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLU  50           H        GLU  50  -5.147  -5.753  14.533
    2    HA   GLU  50           HA       GLU  50  -5.645  -8.555  14.649
    3    HB2  GLU  50           HB2      GLU  50  -7.244  -6.873  15.512
    4    HB3  GLU  50           HB3      GLU  50  -7.533  -6.317  13.862
    5    HG2  GLU  50           HG2      GLU  50  -8.383  -8.520  13.228
    6    HG3  GLU  50           HG3      GLU  50  -8.005  -9.156  14.825

  No H/Q in entry =           6
  In of MODEL   86
    1    H    ALA  51           H        ALA  51  -5.713  -6.167  12.044
    2    HA   ALA  51           HA       ALA  51  -6.680  -7.907  10.024
    3    HB2  ALA  51           HB1      ALA  51  -6.463  -6.099   8.649
    4    HB1  ALA  51           HB2      ALA  51  -4.828  -5.739   9.204
    5    HB3  ALA  51           HB3      ALA  51  -6.218  -5.232  10.164

  No H/Q in entry =           5
  In of MODEL   86
    1    H    HIS  52           H        HIS  52  -3.398  -6.980  11.020
    2    HA   HIS  52           HA       HIS  52  -1.983  -8.470   9.083
    3    HB2  HIS  52           HB2      HIS  52  -0.977  -6.721  10.537
    4    HB3  HIS  52           HB3      HIS  52  -1.125  -7.815  11.912
    5    HD1  HIS  52           HD1      HIS  52   0.308 -10.053  11.801
    6    HD2  HIS  52           HD2      HIS  52   1.204  -7.243   8.854
    7    HE1  HIS  52           HE1      HIS  52   2.528 -10.746  10.802
    8    HE2  HIS  52           HE2      HIS  52   3.089  -9.044   9.003

  No H/Q in entry =           8
  In of MODEL   86
    1    H    LEU  53           H        LEU  53  -3.206  -9.341  12.293
    2    HA   LEU  53           HA       LEU  53  -1.998 -11.879  12.502
    3    HB2  LEU  53           HB2      LEU  53  -4.496 -10.706  13.699
    4    HB3  LEU  53           HB3      LEU  53  -4.027 -12.377  14.001
    5    HG   LEU  53           HG       LEU  53  -2.169 -10.025  14.488
    6   HD13  LEU  53          HD11      LEU  53  -2.781 -10.118  16.814
    7   HD12  LEU  53          HD12      LEU  53  -3.790 -11.539  16.547
    8   HD11  LEU  53          HD13      LEU  53  -4.276  -9.979  15.893
    9   HD22  LEU  53          HD21      LEU  53  -0.816 -11.947  14.442
   10   HD21  LEU  53          HD22      LEU  53  -2.095 -12.978  15.073
   11   HD23  LEU  53          HD23      LEU  53  -1.248 -11.880  16.147

  No H/Q in entry =          11
  In of MODEL   86
    1    H    VAL  54           H        VAL  54  -5.107 -10.868  11.120
    2    HA   VAL  54           HA       VAL  54  -6.007 -13.468  10.438
    3    HB   VAL  54           HB       VAL  54  -6.659 -10.742   9.291
    4   HG12  VAL  54          HG11      VAL  54  -8.752 -12.131   8.474
    5   HG11  VAL  54          HG12      VAL  54  -7.635 -13.493   8.556
    6   HG13  VAL  54          HG13      VAL  54  -7.276 -12.120   7.511
    7   HG22  VAL  54          HG21      VAL  54  -7.577 -10.776  11.438
    8   HG21  VAL  54          HG22      VAL  54  -7.824 -12.520  11.424
    9   HG23  VAL  54          HG23      VAL  54  -8.905 -11.471  10.508

  No H/Q in entry =           9
  In of MODEL   86
    1    H    GLN  55           H        GLN  55  -4.136 -11.016   8.650
    2    HA   GLN  55           HA       GLN  55  -3.989 -12.489   6.238
    3    HB2  GLN  55           HB2      GLN  55  -3.392 -10.223   6.043
    4    HB3  GLN  55           HB3      GLN  55  -2.288 -10.290   7.414
    5    HG2  GLN  55           HG2      GLN  55  -0.561 -11.135   6.149
    6    HG3  GLN  55           HG3      GLN  55  -1.627 -12.117   5.153
    7   HE21  GLN  55          HE21      GLN  55  -1.636 -11.435   3.029
    8   HE22  GLN  55          HE22      GLN  55  -1.441  -9.832   2.514

  No H/Q in entry =           8
  In of MODEL   86
    1    H    THR  56           H        THR  56  -1.897 -12.450   9.129
    2    HA   THR  56           HA       THR  56   0.191 -14.045   8.228
    3    HB   THR  56           HB       THR  56  -1.063 -14.290  10.970
    4    HG1  THR  56           HG1      THR  56   0.202 -12.206   9.713
    5   HG21  THR  56          HG21      THR  56   0.878 -15.806  10.080
    6   HG23  THR  56          HG22      THR  56   1.021 -15.073  11.677
    7   HG22  THR  56          HG23      THR  56   1.864 -14.361  10.301

  No H/Q in entry =           7
  In of MODEL   86
    1    H    LYS  57           H        LYS  57  -2.932 -15.086   9.579
    2    HA   LYS  57           HA       LYS  57  -2.476 -17.882   9.346
    3    HB2  LYS  57           HB2      LYS  57  -4.304 -16.794  10.679
    4    HB3  LYS  57           HB3      LYS  57  -5.090 -16.350   9.171
    5    HG2  LYS  57           HG2      LYS  57  -5.290 -18.730   8.565
    6    HG3  LYS  57           HG3      LYS  57  -4.505 -19.184  10.074
    7    HD2  LYS  57           HD2      LYS  57  -7.022 -17.511  10.038
    8    HD3  LYS  57           HD3      LYS  57  -7.079 -19.273  10.038
    9    HE2  LYS  57           HE2      LYS  57  -5.597 -19.214  12.106
   10    HE3  LYS  57           HE3      LYS  57  -5.857 -17.472  12.164
   11    HZ1  LYS  57           HZ1      LYS  57  -8.357 -18.361  11.903
   12    HZ3  LYS  57           HZ2      LYS  57  -7.611 -18.056  13.399
   13    HZ2  LYS  57           HZ3      LYS  57  -7.672 -19.640  12.785

  No H/Q in entry =          13
  In of MODEL   86
    1    H    LEU  58           H        LEU  58  -3.804 -15.452   7.155
    2    HA   LEU  58           HA       LEU  58  -4.591 -17.287   5.151
    3    HB2  LEU  58           HB2      LEU  58  -3.993 -14.337   5.008
    4    HB3  LEU  58           HB3      LEU  58  -4.647 -15.281   3.668
    5    HG   LEU  58           HG       LEU  58  -5.940 -15.095   6.409
    6   HD11  LEU  58          HD11      LEU  58  -6.233 -13.458   3.909
    7   HD13  LEU  58          HD12      LEU  58  -6.233 -12.944   5.596
    8   HD12  LEU  58          HD13      LEU  58  -7.650 -13.744   4.920
    9   HD22  LEU  58          HD21      LEU  58  -6.893 -17.010   5.541
   10   HD21  LEU  58          HD22      LEU  58  -6.546 -16.564   3.871
   11   HD23  LEU  58          HD23      LEU  58  -7.916 -15.839   4.712

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  59           H        ILE  59  -1.463 -16.063   6.024
    2    HA   ILE  59           HA       ILE  59  -0.350 -16.797   3.395
    3    HB   ILE  59           HB       ILE  59   0.404 -14.725   4.967
    4   HG12  ILE  59          HG12      ILE  59   2.502 -16.368   3.533
    5   HG13  ILE  59          HG13      ILE  59   1.305 -15.428   2.680
    6   HG23  ILE  59          HG21      ILE  59   2.259 -15.204   6.351
    7   HG22  ILE  59          HG22      ILE  59   2.492 -16.794   5.659
    8   HG21  ILE  59          HG23      ILE  59   1.135 -16.484   6.742
    9   HD13  ILE  59          HD11      ILE  59   2.055 -13.378   3.740
   10   HD12  ILE  59          HD12      ILE  59   3.445 -14.186   3.018
   11   HD11  ILE  59          HD13      ILE  59   3.172 -14.285   4.757

  No H/Q in entry =          11
  In of MODEL   86
    1    H    GLU  60           H        GLU  60  -0.375 -17.890   6.767
    2    HA   GLU  60           HA       GLU  60   1.663 -19.863   6.521
    3    HB2  GLU  60           HB2      GLU  60   0.877 -19.067   8.702
    4    HB3  GLU  60           HB3      GLU  60  -0.717 -19.750   8.392
    5    HG2  GLU  60           HG2      GLU  60   0.270 -22.011   8.273
    6    HG3  GLU  60           HG3      GLU  60   1.868 -21.328   8.570

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLY  61           H        GLY  61  -1.844 -19.974   6.017
    2    HA3  GLY  61           HA2      GLY  61  -1.583 -22.769   5.071
    3    HA2  GLY  61           HA3      GLY  61  -3.074 -22.035   5.653

  No H/Q in entry =           3
  In of MODEL   86
    1    H    ASP  62           H        ASP  62  -0.837 -20.459   3.456
    2    HA   ASP  62           HA       ASP  62  -2.907 -19.887   1.576
    3    HB2  ASP  62           HB2      ASP  62  -1.011 -18.924   0.249
    4    HB3  ASP  62           HB3      ASP  62  -1.113 -18.312   1.897

  No H/Q in entry =           4
  In of MODEL   86
    1    H    ALA  63           H        ALA  63  -1.553 -22.803   2.084
    2    HA   ALA  63           HA       ALA  63  -0.598 -23.731  -0.388
    3    HB3  ALA  63           HB1      ALA  63  -1.315 -25.962   0.374
    4    HB1  ALA  63           HB2      ALA  63  -2.207 -25.206   1.694
    5    HB2  ALA  63           HB3      ALA  63  -0.449 -25.074   1.630

  No H/Q in entry =           5
  In of MODEL   86
    1    H    GLY  64           H        GLY  64  -3.900 -23.505   0.884
    2    HA3  GLY  64           HA2      GLY  64  -5.957 -23.566  -0.125
    3    HA2  GLY  64           HA3      GLY  64  -5.146 -22.995  -1.575

  No H/Q in entry =           3
  In of MODEL   86
    1    H    GLU  65           H        GLU  65  -6.292 -24.265  -3.042
    2    HA   GLU  65           HA       GLU  65  -6.797 -27.022  -2.650
    3    HB2  GLU  65           HB2      GLU  65  -6.798 -25.324  -5.143
    4    HB3  GLU  65           HB3      GLU  65  -7.300 -27.015  -5.113
    5    HG2  GLU  65           HG2      GLU  65  -9.033 -26.517  -3.473
    6    HG3  GLU  65           HG3      GLU  65  -8.490 -24.844  -3.366

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLY  66           H        GLY  66  -4.293 -25.310  -4.378
    2    HA3  GLY  66           HA2      GLY  66  -2.928 -27.762  -5.173
    3    HA2  GLY  66           HA3      GLY  66  -2.540 -26.137  -5.699

  No H/Q in entry =           3
  In of MODEL   86
    1    H    LYS  67           H        LYS  67  -0.481 -27.640  -5.102
    2    HA   LYS  67           HA       LYS  67   0.295 -27.595  -2.352
    3    HB2  LYS  67           HB2      LYS  67   1.782 -28.248  -4.891
    4    HB3  LYS  67           HB3      LYS  67   2.483 -28.406  -3.276
    5    HG2  LYS  67           HG2      LYS  67   0.641 -29.901  -2.610
    6    HG3  LYS  67           HG3      LYS  67  -0.077 -29.740  -4.210
    7    HD2  LYS  67           HD2      LYS  67   1.924 -30.761  -5.221
    8    HD3  LYS  67           HD3      LYS  67   2.655 -30.914  -3.621
    9    HE2  LYS  67           HE2      LYS  67   0.775 -32.347  -2.898
   10    HE3  LYS  67           HE3      LYS  67   0.056 -32.206  -4.502
   11    HZ3  LYS  67           HZ1      LYS  67   1.321 -33.870  -5.175
   12    HZ2  LYS  67           HZ2      LYS  67   2.024 -33.996  -3.633
   13    HZ1  LYS  67           HZ3      LYS  67   2.721 -32.986  -4.807

  No H/Q in entry =          13
  In of MODEL   86
    1    H    MET  68           H        MET  68   2.424 -26.440  -4.843
    2    HA   MET  68           HA       MET  68   3.675 -24.486  -3.248
    3    HB2  MET  68           HB2      MET  68   3.677 -24.752  -6.256
    4    HB3  MET  68           HB3      MET  68   4.864 -23.885  -5.281
    5    HG2  MET  68           HG2      MET  68   4.279 -26.854  -5.097
    6    HG3  MET  68           HG3      MET  68   5.682 -26.139  -5.892
    7    HE1  MET  68           HE1      MET  68   7.170 -24.653  -5.008
    8    HE3  MET  68           HE2      MET  68   7.925 -24.795  -3.423
    9    HE2  MET  68           HE3      MET  68   6.581 -23.680  -3.654

  No H/Q in entry =           9
  In of MODEL   86
    1    H    LYS  69           H        LYS  69   1.152 -24.163  -5.735
    2    HA   LYS  69           HA       LYS  69   1.216 -21.372  -5.938
    3    HB2  LYS  69           HB2      LYS  69   0.126 -22.822  -7.582
    4    HB3  LYS  69           HB3      LYS  69  -1.167 -23.146  -6.422
    5    HG2  LYS  69           HG2      LYS  69  -1.718 -20.772  -6.309
    6    HG3  LYS  69           HG3      LYS  69  -0.374 -20.382  -7.382
    7    HD2  LYS  69           HD2      LYS  69  -1.421 -21.732  -9.172
    8    HD3  LYS  69           HD3      LYS  69  -2.778 -22.084  -8.101
    9    HE2  LYS  69           HE2      LYS  69  -3.282 -19.680  -7.929
   10    HE3  LYS  69           HE3      LYS  69  -1.915 -19.314  -8.981
   11    HZ1  LYS  69           HZ1      LYS  69  -3.806 -21.259 -10.003
   12    HZ3  LYS  69           HZ2      LYS  69  -3.018 -19.983 -10.800
   13    HZ2  LYS  69           HZ3      LYS  69  -4.400 -19.677  -9.860

  No H/Q in entry =          13
  In of MODEL   86
    1    H    VAL  70           H        VAL  70   0.097 -19.679  -5.069
    2    HA   VAL  70           HA       VAL  70  -1.413 -20.223  -2.572
    3    HB   VAL  70           HB       VAL  70  -0.610 -18.002  -1.806
    4   HG13  VAL  70          HG11      VAL  70   1.644 -18.686  -1.289
    5   HG12  VAL  70          HG12      VAL  70   1.697 -19.747  -2.698
    6   HG11  VAL  70          HG13      VAL  70   0.648 -20.141  -1.336
    7   HG23  VAL  70          HG21      VAL  70   1.389 -17.058  -3.177
    8   HG22  VAL  70          HG22      VAL  70  -0.233 -16.767  -3.798
    9   HG21  VAL  70          HG23      VAL  70   0.763 -18.035  -4.507

  No H/Q in entry =           9
  In of MODEL   86
    1    H    SER  71           H        SER  71  -3.023 -18.577  -2.043
    2    HA   SER  71           HA       SER  71  -4.844 -18.062  -4.146
    3    HB2  SER  71           HB2      SER  71  -5.489 -18.230  -1.729
    4    HB3  SER  71           HB3      SER  71  -4.678 -16.695  -1.435
    5    HG   SER  71           HG       SER  71  -7.129 -17.180  -2.453

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LEU  72           H        LEU  72  -5.077 -16.390  -5.477
    2    HA   LEU  72           HA       LEU  72  -2.974 -14.571  -5.956
    3    HB2  LEU  72           HB2      LEU  72  -5.832 -14.648  -6.914
    4    HB3  LEU  72           HB3      LEU  72  -4.646 -13.477  -7.484
    5    HG   LEU  72           HG       LEU  72  -4.206 -16.478  -7.614
    6   HD11  LEU  72          HD11      LEU  72  -5.411 -14.552  -9.608
    7   HD13  LEU  72          HD12      LEU  72  -6.068 -16.087  -9.040
    8   HD12  LEU  72          HD13      LEU  72  -4.666 -16.071 -10.108
    9   HD23  LEU  72          HD21      LEU  72  -2.642 -15.594  -9.522
   10   HD22  LEU  72          HD22      LEU  72  -2.087 -15.439  -7.863
   11   HD21  LEU  72          HD23      LEU  72  -2.775 -14.046  -8.693

  No H/Q in entry =          11
  In of MODEL   86
    1    H    VAL  73           H        VAL  73  -6.075 -14.221  -4.340
    2    HA   VAL  73           HA       VAL  73  -6.133 -11.449  -3.998
    3    HB   VAL  73           HB       VAL  73  -7.853 -11.810  -2.418
    4   HG13  VAL  73          HG11      VAL  73  -9.309 -13.116  -3.683
    5   HG12  VAL  73          HG12      VAL  73  -8.078 -14.325  -4.040
    6   HG11  VAL  73          HG13      VAL  73  -8.048 -12.766  -4.865
    7   HG22  VAL  73          HG21      VAL  73  -7.027 -13.237  -0.776
    8   HG21  VAL  73          HG22      VAL  73  -6.396 -14.390  -1.951
    9   HG23  VAL  73          HG23      VAL  73  -8.127 -14.321  -1.626

  No H/Q in entry =           9
  In of MODEL   86
    1    H    LEU  74           H        LEU  74  -4.192 -13.805  -2.399
    2    HA   LEU  74           HA       LEU  74  -3.795 -12.654   0.122
    3    HB2  LEU  74           HB2      LEU  74  -3.001 -14.871  -0.366
    4    HB3  LEU  74           HB3      LEU  74  -1.944 -14.259  -1.638
    5    HG   LEU  74           HG       LEU  74  -0.646 -12.998   0.042
    6   HD13  LEU  74          HD11      LEU  74  -2.216 -12.496   1.754
    7   HD12  LEU  74          HD12      LEU  74  -1.142 -13.689   2.485
    8   HD11  LEU  74          HD13      LEU  74  -2.728 -14.179   1.887
    9   HD23  LEU  74          HD21      LEU  74  -0.854 -15.741   1.167
   10   HD22  LEU  74          HD22      LEU  74   0.549 -14.825   0.667
   11   HD21  LEU  74          HD23      LEU  74  -0.461 -15.581  -0.542

  No H/Q in entry =          11
  In of MODEL   86
    1    H    VAL  75           H        VAL  75  -1.894 -12.262  -2.829
    2    HA   VAL  75           HA       VAL  75  -0.109 -10.327  -1.817
    3    HB   VAL  75           HB       VAL  75  -1.052 -10.820  -4.643
    4   HG12  VAL  75          HG11      VAL  75   1.014  -9.511  -5.257
    5   HG11  VAL  75          HG12      VAL  75   1.213  -9.107  -3.559
    6   HG13  VAL  75          HG13      VAL  75  -0.193  -8.526  -4.438
    7   HG21  VAL  75          HG21      VAL  75   1.413 -11.631  -3.060
    8   HG23  VAL  75          HG22      VAL  75   1.206 -11.905  -4.791
    9   HG22  VAL  75          HG23      VAL  75   0.140 -12.708  -3.636

  No H/Q in entry =           9
  In of MODEL   86
    1    H    GLU  76           H        GLU  76  -3.254  -9.998  -3.489
    2    HA   GLU  76           HA       GLU  76  -3.317  -7.184  -3.599
    3    HB2  GLU  76           HB2      GLU  76  -4.962  -8.685  -4.746
    4    HB3  GLU  76           HB3      GLU  76  -5.648  -9.093  -3.181
    5    HG2  GLU  76           HG2      GLU  76  -6.292  -6.744  -2.823
    6    HG3  GLU  76           HG3      GLU  76  -5.593  -6.289  -4.366

  No H/Q in entry =           6
  In of MODEL   86
    1    H    ALA  77           H        ALA  77  -4.428  -9.409  -1.057
    2    HA   ALA  77           HA       ALA  77  -5.400  -7.406   0.692
    3    HB1  ALA  77           HB1      ALA  77  -4.221 -10.045   1.567
    4    HB2  ALA  77           HB2      ALA  77  -5.817  -9.915   0.828
    5    HB3  ALA  77           HB3      ALA  77  -5.485  -9.103   2.357

  No H/Q in entry =           5
  In of MODEL   86
    1    H    GLN  78           H        GLN  78  -2.245  -8.944   0.345
    2    HA   GLN  78           HA       GLN  78  -1.000  -7.772   2.596
    3    HB2  GLN  78           HB2      GLN  78  -0.123  -9.713   1.258
    4    HB3  GLN  78           HB3      GLN  78   0.304  -8.576  -0.018
    5    HG2  GLN  78           HG2      GLN  78   1.758  -7.357   1.552
    6    HG3  GLN  78           HG3      GLN  78   1.335  -8.493   2.830
    7   HE21  GLN  78          HE21      GLN  78   4.052  -8.217   2.010
    8   HE22  GLN  78          HE22      GLN  78   4.524  -9.644   1.220

  No H/Q in entry =           8
  In of MODEL   86
    1    H    LEU  79           H        LEU  79  -1.358  -6.722  -0.755
    2    HA   LEU  79           HA       LEU  79   0.321  -4.490  -0.742
    3    HB2  LEU  79           HB2      LEU  79  -0.695  -5.306  -2.797
    4    HB3  LEU  79           HB3      LEU  79  -2.302  -4.918  -2.196
    5    HG   LEU  79           HG       LEU  79  -1.766  -2.529  -2.176
    6   HD13  LEU  79          HD11      LEU  79   0.472  -2.276  -1.655
    7   HD12  LEU  79          HD12      LEU  79   0.527  -1.994  -3.395
    8   HD11  LEU  79          HD13      LEU  79   0.983  -3.569  -2.742
    9   HD23  LEU  79          HD21      LEU  79  -1.122  -2.336  -4.726
   10   HD22  LEU  79          HD22      LEU  79  -2.648  -3.087  -4.271
   11   HD21  LEU  79          HD23      LEU  79  -1.271  -4.093  -4.707

  No H/Q in entry =          11
  In of MODEL   86
    1    H    HIS  80           H        HIS  80  -3.148  -4.660   0.071
    2    HA   HIS  80           HA       HIS  80  -3.350  -1.902   0.726
    3    HB2  HIS  80           HB2      HIS  80  -5.046  -4.315   1.045
    4    HB3  HIS  80           HB3      HIS  80  -5.375  -2.973   2.144
    5    HD1  HIS  80           HD1      HIS  80  -6.993  -1.343   1.225
    6    HD2  HIS  80           HD2      HIS  80  -4.784  -3.158  -1.809
    7    HE1  HIS  80           HE1      HIS  80  -7.827  -0.355  -0.960
    8    HE2  HIS  80           HE2      HIS  80  -6.487  -1.456  -2.819

  No H/Q in entry =           8
  In of MODEL   86
    1    H    LEU  81           H        LEU  81  -2.861  -4.790   2.729
    2    HA   LEU  81           HA       LEU  81  -2.862  -3.435   5.210
    3    HB2  LEU  81           HB2      LEU  81  -1.633  -6.051   4.343
    4    HB3  LEU  81           HB3      LEU  81  -1.615  -5.487   6.015
    5    HG   LEU  81           HG       LEU  81  -4.154  -5.751   4.378
    6   HD12  LEU  81          HD11      LEU  81  -4.457  -7.813   5.930
    7   HD11  LEU  81          HD12      LEU  81  -2.706  -7.737   6.123
    8   HD13  LEU  81          HD13      LEU  81  -3.408  -7.974   4.522
    9   HD23  LEU  81          HD21      LEU  81  -5.006  -5.948   6.876
   10   HD22  LEU  81          HD22      LEU  81  -4.683  -4.361   6.183
   11   HD21  LEU  81          HD23      LEU  81  -3.498  -5.115   7.250

  No H/Q in entry =          11
  In of MODEL   86
    1    H    MET  82           H        MET  82  -0.170  -4.339   3.052
    2    HA   MET  82           HA       MET  82   1.904  -3.435   4.741
    3    HB2  MET  82           HB2      MET  82   1.701  -3.786   1.749
    4    HB3  MET  82           HB3      MET  82   3.179  -3.210   2.516
    5    HG2  MET  82           HG2      MET  82   1.775  -5.800   3.243
    6    HG3  MET  82           HG3      MET  82   3.151  -5.691   2.148
    7    HE3  MET  82           HE1      MET  82   6.157  -4.942   4.141
    8    HE2  MET  82           HE2      MET  82   5.234  -3.579   3.515
    9    HE1  MET  82           HE3      MET  82   5.329  -5.071   2.584

  No H/Q in entry =           9
  In of MODEL   86
    1    H    THR  83           H        THR  83   0.088  -1.804   2.172
    2    HA   THR  83           HA       THR  83   1.495   0.647   2.256
    3    HB   THR  83           HB       THR  83  -0.679   1.565   1.259
    4    HG1  THR  83           HG1      THR  83  -2.326   0.264   1.150
    5   HG22  THR  83          HG21      THR  83  -0.397  -0.259  -0.735
    6   HG21  THR  83          HG22      THR  83   1.100  -0.546   0.149
    7   HG23  THR  83          HG23      THR  83   0.738   1.065  -0.473

  No H/Q in entry =           7
  In of MODEL   86
    1    H    SER  84           H        SER  84  -1.515  -0.386   3.850
    2    HA   SER  84           HA       SER  84  -2.020   2.047   5.185
    3    HB2  SER  84           HB2      SER  84  -2.850  -0.790   5.755
    4    HB3  SER  84           HB3      SER  84  -3.350   0.553   6.782
    5    HG   SER  84           HG       SER  84  -3.797   0.230   3.989

  No H/Q in entry =           5
  In of MODEL   86
    1    H    MET  85           H        MET  85  -0.310  -0.878   6.330
    2    HA   MET  85           HA       MET  85   0.199   0.057   8.933
    3    HB2  MET  85           HB2      MET  85   0.497  -2.288   8.267
    4    HB3  MET  85           HB3      MET  85   1.880  -1.826   7.272
    5    HG2  MET  85           HG2      MET  85   3.055  -0.988   9.265
    6    HG3  MET  85           HG3      MET  85   1.663  -1.398  10.268
    7    HE3  MET  85           HE1      MET  85   3.302  -3.781   7.250
    8    HE2  MET  85           HE2      MET  85   4.726  -4.058   8.250
    9    HE1  MET  85           HE3      MET  85   4.235  -2.411   7.864

  No H/Q in entry =           9
  In of MODEL   86
    1    H    LEU  86           H        LEU  86   2.144   0.306   5.988
    2    HA   LEU  86           HA       LEU  86   4.352   1.624   7.148
    3    HB2  LEU  86           HB2      LEU  86   4.171   0.534   4.842
    4    HB3  LEU  86           HB3      LEU  86   3.363   2.012   4.322
    5    HG   LEU  86           HG       LEU  86   5.385   3.264   5.305
    6   HD11  LEU  86          HD11      LEU  86   6.091   0.656   6.116
    7   HD13  LEU  86          HD12      LEU  86   7.092   2.103   6.213
    8   HD12  LEU  86          HD13      LEU  86   7.208   1.050   4.805
    9   HD23  LEU  86          HD21      LEU  86   6.113   1.495   2.963
   10   HD22  LEU  86          HD22      LEU  86   6.504   3.193   3.221
   11   HD21  LEU  86          HD23      LEU  86   4.853   2.722   2.818

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ALA  87           H        ALA  87   1.444   2.858   5.548
    2    HA   ALA  87           HA       ALA  87   2.035   5.589   5.625
    3    HB1  ALA  87           HB1      ALA  87  -0.271   3.957   5.081
    4    HB3  ALA  87           HB2      ALA  87   0.040   5.616   4.577
    5    HB2  ALA  87           HB3      ALA  87  -0.759   5.299   6.118

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ARG  88           H        ARG  88   0.338   3.594   8.016
    2    HA   ARG  88           HA       ARG  88  -0.183   5.649   9.854
    3    HB2  ARG  88           HB2      ARG  88  -1.118   3.295   9.925
    4    HB3  ARG  88           HB3      ARG  88   0.420   2.800  10.638
    5    HG2  ARG  88           HG2      ARG  88  -0.065   4.879  12.249
    6    HG3  ARG  88           HG3      ARG  88  -1.729   4.550  11.788
    7    HD2  ARG  88           HD2      ARG  88  -1.839   2.705  13.041
    8    HD3  ARG  88           HD3      ARG  88  -0.247   2.123  12.517
    9    HE   ARG  88           HE       ARG  88  -0.791   3.394  14.965
   10   HH21  ARG  88          HH11      ARG  88   0.761   4.413  16.206
   11   HH22  ARG  88          HH12      ARG  88   2.283   4.839  15.505
   12   HH11  ARG  88          HH21      ARG  88   1.499   3.570  12.396
   13   HH12  ARG  88          HH22      ARG  88   2.708   4.346  13.360

  No H/Q in entry =          13
  In of MODEL   86
    1    H    GLU  89           H        GLU  89   2.618   3.433   9.649
    2    HA   GLU  89           HA       GLU  89   3.869   4.332  11.994
    3    HB2  GLU  89           HB2      GLU  89   4.536   2.310  10.660
    4    HB3  GLU  89           HB3      GLU  89   5.314   3.401   9.512
    5    HG2  GLU  89           HG2      GLU  89   6.792   4.256  11.258
    6    HG3  GLU  89           HG3      GLU  89   5.954   3.303  12.479

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LEU  90           H        LEU  90   4.197   5.478   8.663
    2    HA   LEU  90           HA       LEU  90   6.121   7.484   9.249
    3    HB2  LEU  90           HB2      LEU  90   4.124   7.141   7.015
    4    HB3  LEU  90           HB3      LEU  90   5.352   8.414   7.037
    5    HG   LEU  90           HG       LEU  90   6.030   5.480   7.383
    6   HD12  LEU  90          HD11      LEU  90   6.787   5.707   4.945
    7   HD11  LEU  90          HD12      LEU  90   5.769   7.145   4.888
    8   HD13  LEU  90          HD13      LEU  90   5.051   5.572   5.234
    9   HD22  LEU  90          HD21      LEU  90   7.923   6.636   8.068
   10   HD21  LEU  90          HD22      LEU  90   7.574   8.037   7.055
   11   HD23  LEU  90          HD23      LEU  90   8.239   6.571   6.336

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  91           H        ILE  91   2.583   7.492   9.087
    2    HA   ILE  91           HA       ILE  91   2.233  10.265   9.526
    3    HB   ILE  91           HB       ILE  91   0.445   7.888  10.071
    4   HG12  ILE  91          HG12      ILE  91   0.199  10.161   8.077
    5   HG13  ILE  91          HG13      ILE  91   1.064   8.668   7.713
    6   HG22  ILE  91          HG21      ILE  91  -1.292   9.942  10.120
    7   HG21  ILE  91          HG22      ILE  91   0.105  10.778  10.795
    8   HG23  ILE  91          HG23      ILE  91  -0.532   9.342  11.595
    9   HD13  ILE  91          HD11      ILE  91  -0.877   7.376   7.755
   10   HD12  ILE  91          HD12      ILE  91  -1.468   8.887   7.066
   11   HD11  ILE  91          HD13      ILE  91  -1.744   8.528   8.770

  No H/Q in entry =          11
  In of MODEL   86
    1    H    THR  92           H        THR  92   2.635   7.533  11.739
    2    HA   THR  92           HA       THR  92   2.178   8.914  14.156
    3    HB   THR  92           HB       THR  92   3.995   6.582  13.507
    4    HG1  THR  92           HG1      THR  92   2.029   5.819  13.401
    5   HG22  THR  92          HG21      THR  92   3.603   6.306  16.140
    6   HG21  THR  92          HG22      THR  92   3.533   8.065  16.060
    7   HG23  THR  92          HG23      THR  92   4.971   7.211  15.496

  No H/Q in entry =           7
  In of MODEL   86
    1    H    GLU  93           H        GLU  93   5.138   8.467  12.236
    2    HA   GLU  93           HA       GLU  93   6.881   9.905  13.934
    3    HB2  GLU  93           HB2      GLU  93   6.982   9.579  10.921
    4    HB3  GLU  93           HB3      GLU  93   8.317  10.117  11.938
    5    HG2  GLU  93           HG2      GLU  93   6.914   7.478  12.390
    6    HG3  GLU  93           HG3      GLU  93   8.301   7.630  11.319

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LEU  94           H        LEU  94   4.840  10.903  11.210
    2    HA   LEU  94           HA       LEU  94   5.636  13.609  11.102
    3    HB2  LEU  94           HB2      LEU  94   3.053  12.233  10.343
    4    HB3  LEU  94           HB3      LEU  94   3.307  13.960  10.096
    5    HG   LEU  94           HG       LEU  94   5.335  11.975   9.062
    6   HD11  LEU  94          HD11      LEU  94   2.596  12.512   7.986
    7   HD13  LEU  94          HD12      LEU  94   3.585  11.059   7.870
    8   HD12  LEU  94          HD13      LEU  94   3.919  12.436   6.822
    9   HD23  LEU  94          HD21      LEU  94   5.586  13.806   7.333
   10   HD22  LEU  94          HD22      LEU  94   5.992  14.306   8.975
   11   HD21  LEU  94          HD23      LEU  94   4.442  14.766   8.268

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  95           H        ILE  95   3.096  11.990  12.989
    2    HA   ILE  95           HA       ILE  95   2.040  14.341  14.171
    3    HB   ILE  95           HB       ILE  95   2.064  11.463  15.107
    4   HG12  ILE  95          HG12      ILE  95  -0.159  13.223  14.042
    5   HG13  ILE  95          HG13      ILE  95   0.806  12.164  13.018
    6   HG21  ILE  95          HG21      ILE  95   0.767  13.935  16.294
    7   HG23  ILE  95          HG22      ILE  95   1.817  12.773  17.107
    8   HG22  ILE  95          HG23      ILE  95   0.185  12.304  16.627
    9   HD13  ILE  95          HD11      ILE  95  -0.093  10.226  13.941
   10   HD12  ILE  95          HD12      ILE  95  -1.480  11.309  14.007
   11   HD11  ILE  95          HD13      ILE  95  -0.520  11.021  15.457

  No H/Q in entry =          11
  In of MODEL   86
    1    H    GLU  96           H        GLU  96   4.640  12.137  15.186
    2    HA   GLU  96           HA       GLU  96   5.179  13.347  17.675
    3    HB2  GLU  96           HB2      GLU  96   6.139  11.190  17.040
    4    HB3  GLU  96           HB3      GLU  96   7.075  11.962  15.761
    5    HG2  GLU  96           HG2      GLU  96   8.715  12.524  17.228
    6    HG3  GLU  96           HG3      GLU  96   7.560  13.336  18.276

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LEU  97           H        LEU  97   6.264  14.111  14.391
    2    HA   LEU  97           HA       LEU  97   8.138  16.119  15.103
    3    HB2  LEU  97           HB2      LEU  97   6.560  15.553  12.603
    4    HB3  LEU  97           HB3      LEU  97   7.572  16.989  12.724
    5    HG   LEU  97           HG       LEU  97   8.612  14.199  13.299
    6   HD12  LEU  97          HD11      LEU  97   9.617  14.388  10.985
    7   HD11  LEU  97          HD12      LEU  97   8.561  15.773  10.712
    8   HD13  LEU  97          HD13      LEU  97   7.868  14.179  11.010
    9   HD23  LEU  97          HD21      LEU  97  10.778  15.485  12.560
   10   HD22  LEU  97          HD22      LEU  97  10.151  15.758  14.186
   11   HD21  LEU  97          HD23      LEU  97   9.836  16.935  12.911

  No H/Q in entry =          11
  In of MODEL   86
    1    H    HIS  98           H        HIS  98   4.649  16.235  14.433
    2    HA   HIS  98           HA       HIS  98   4.335  19.033  14.556
    3    HB2  HIS  98           HB2      HIS  98   2.453  16.776  15.283
    4    HB3  HIS  98           HB3      HIS  98   1.978  18.475  15.330
    5    HD1  HIS  98           HD1      HIS  98   3.023  15.755  12.940
    6    HD2  HIS  98           HD2      HIS  98   1.628  19.681  12.797
    7    HE1  HIS  98           HE1      HIS  98   2.472  16.232  10.512
    8    HE2  HIS  98           HE2      HIS  98   1.625  18.616  10.404

  No H/Q in entry =           8
  In of MODEL   86
    1    H    GLU  99           H        GLU  99   4.470  16.555  17.066
    2    HA   GLU  99           HA       GLU  99   3.844  18.255  19.254
    3    HB2  GLU  99           HB2      GLU  99   3.768  15.773  19.361
    4    HB3  GLU  99           HB3      GLU  99   5.528  15.737  19.260
    5    HG2  GLU  99           HG2      GLU  99   5.701  17.038  21.330
    6    HG3  GLU  99           HG3      GLU  99   3.948  17.170  21.417

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LYS 100           H        LYS 100   6.909  17.334  17.706
    2    HA   LYS 100           HA       LYS 100   8.549  18.750  19.564
    3    HB2  LYS 100           HB2      LYS 100   9.065  17.817  16.731
    4    HB3  LYS 100           HB3      LYS 100  10.286  18.597  17.742
    5    HG2  LYS 100           HG2      LYS 100   9.911  16.851  19.488
    6    HG3  LYS 100           HG3      LYS 100   8.788  16.038  18.395
    7    HD2  LYS 100           HD2      LYS 100  10.591  15.758  16.737
    8    HD3  LYS 100           HD3      LYS 100  11.719  16.583  17.815
    9    HE2  LYS 100           HE2      LYS 100  11.324  14.832  19.538
   10    HE3  LYS 100           HE3      LYS 100  10.258  13.987  18.411
   11    HZ1  LYS 100           HZ1      LYS 100  13.078  14.668  17.765
   12    HZ3  LYS 100           HZ2      LYS 100  12.043  13.605  16.937
   13    HZ2  LYS 100           HZ3      LYS 100  12.627  13.194  18.479

  No H/Q in entry =          13
  In of MODEL   86
    1    H    LEU 101           H        LEU 101   6.863  19.657  16.598
    2    HA   LEU 101           HA       LEU 101   8.066  22.219  16.258
    3    HB2  LEU 101           HB2      LEU 101   5.481  20.969  15.365
    4    HB3  LEU 101           HB3      LEU 101   5.724  22.700  15.152
    5    HG   LEU 101           HG       LEU 101   7.774  20.690  14.203
    6   HD12  LEU 101          HD11      LEU 101   6.628  21.182  11.911
    7   HD11  LEU 101          HD12      LEU 101   5.222  21.609  12.884
    8   HD13  LEU 101          HD13      LEU 101   5.894  19.982  12.975
    9   HD21  LEU 101          HD21      LEU 101   7.134  23.598  13.633
   10   HD23  LEU 101          HD22      LEU 101   8.124  22.638  12.535
   11   HD22  LEU 101          HD23      LEU 101   8.658  22.905  14.194

  No H/Q in entry =          11
  In of MODEL   86
    1    H    LYS 102           H        LYS 102   6.524  21.083  18.872
    2    HA   LYS 102           HA       LYS 102   5.878  22.179  20.797
    3    HB2  LYS 102           HB2      LYS 102   7.156  24.171  19.671
    4    HB3  LYS 102           HB3      LYS 102   5.555  24.767  19.286
    5    HG2  LYS 102           HG2      LYS 102   6.922  24.528  21.945
    6    HG3  LYS 102           HG3      LYS 102   5.966  25.849  21.307
    7    HD2  LYS 102           HD2      LYS 102   4.731  23.210  22.190
    8    HD3  LYS 102           HD3      LYS 102   4.969  24.577  23.269
    9    HE2  LYS 102           HE2      LYS 102   2.698  24.157  21.773
   10    HE3  LYS 102           HE3      LYS 102   3.190  25.708  22.451
   11    HZ2  LYS 102           HZ1      LYS 102   2.669  25.804  20.069
   12    HZ1  LYS 102           HZ2      LYS 102   3.937  24.727  19.755
   13    HZ3  LYS 102           HZ3      LYS 102   4.270  26.262  20.394

  No H/Q in entry =          13
  In of MODEL   86
    1    H    ALA 103           H        ALA 103   4.244  23.704  18.017
    2    HA   ALA 103           HA       ALA 103   1.784  24.272  18.890
    3    HB1  ALA 103           HB1      ALA 103   0.899  23.418  16.647
    4    HB2  ALA 103           HB2      ALA 103   2.550  22.887  16.326
    5    HB3  ALA 103           HB3      ALA 103   2.206  24.599  16.585

  No H/Q in entry =           5
  In of MODEL   86
    1    H1   ALA   1           H3       ALA   1  10.693 -20.281  -6.183
    2    H2   ALA   1           H2       ALA   1   9.735 -20.496  -7.572
    3    H3   ALA   1           H1       ALA   1   9.295 -21.239  -6.108
    4    HA   ALA   1           HA       ALA   1  10.345 -23.046  -6.837
    5    HB1  ALA   1           HB1      ALA   1  10.448 -22.695  -9.113
    6    HB2  ALA   1           HB2      ALA   1  12.174 -22.536  -8.778
    7    HB3  ALA   1           HB3      ALA   1  11.170 -21.094  -8.938

  No H/Q in entry =           7
  In of MODEL   86
    1    H    GLU   2           H        GLU   2  12.633 -23.988  -6.882
    2    HA   GLU   2           HA       GLU   2  14.005 -23.893  -4.665
    3    HB2  GLU   2           HB2      GLU   2  15.372 -23.766  -7.359
    4    HB3  GLU   2           HB3      GLU   2  16.096 -24.369  -5.869
    5    HG2  GLU   2           HG2      GLU   2  15.088 -26.390  -6.107
    6    HG3  GLU   2           HG3      GLU   2  13.515 -25.651  -6.374

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLU   3           H        GLU   3  15.779 -22.030  -7.066
    2    HA   GLU   3           HA       GLU   3  16.918 -20.331  -5.108
    3    HB2  GLU   3           HB2      GLU   3  16.874 -20.340  -8.119
    4    HB3  GLU   3           HB3      GLU   3  17.611 -19.005  -7.233
    5    HG2  GLU   3           HG2      GLU   3  19.275 -20.370  -6.299
    6    HG3  GLU   3           HG3      GLU   3  18.335 -21.841  -6.519

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LEU   4           H        LEU   4  14.643 -19.502  -7.751
    2    HA   LEU   4           HA       LEU   4  14.164 -16.892  -7.151
    3    HB2  LEU   4           HB2      LEU   4  11.999 -18.878  -7.882
    4    HB3  LEU   4           HB3      LEU   4  11.919 -17.130  -8.088
    5    HG   LEU   4           HG       LEU   4  13.895 -18.991  -9.446
    6   HD13  LEU   4          HD11      LEU   4  12.600 -18.853 -11.362
    7   HD12  LEU   4          HD12      LEU   4  11.885 -17.310 -10.903
    8   HD11  LEU   4          HD13      LEU   4  11.334 -18.799 -10.138
    9   HD23  LEU   4          HD21      LEU   4  14.229 -16.749 -10.805
   10   HD22  LEU   4          HD22      LEU   4  15.084 -16.983  -9.281
   11   HD21  LEU   4          HD23      LEU   4  13.627 -15.992  -9.329

  No H/Q in entry =          11
  In of MODEL   86
    1    H    GLU   5           H        GLU   5  12.683 -19.676  -5.504
    2    HA   GLU   5           HA       GLU   5  10.994 -18.104  -3.814
    3    HB2  GLU   5           HB2      GLU   5  11.834 -20.950  -3.964
    4    HB3  GLU   5           HB3      GLU   5  11.169 -20.367  -2.437
    5    HG2  GLU   5           HG2      GLU   5   9.731 -19.599  -4.931
    6    HG3  GLU   5           HG3      GLU   5   9.598 -21.276  -4.405

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLU   6           H        GLU   6  14.144 -19.671  -3.353
    2    HA   GLU   6           HA       GLU   6  14.483 -18.803  -0.657
    3    HB2  GLU   6           HB2      GLU   6  16.458 -19.736  -2.752
    4    HB3  GLU   6           HB3      GLU   6  16.894 -19.393  -1.077
    5    HG2  GLU   6           HG2      GLU   6  14.775 -21.386  -1.929
    6    HG3  GLU   6           HG3      GLU   6  16.423 -21.811  -1.467

  No H/Q in entry =           6
  In of MODEL   86
    1    H    VAL   7           H        VAL   7  15.256 -17.485  -3.808
    2    HA   VAL   7           HA       VAL   7  16.930 -15.348  -2.945
    3    HB   VAL   7           HB       VAL   7  15.235 -15.728  -5.427
    4   HG11  VAL   7          HG11      VAL   7  17.116 -13.504  -4.616
    5   HG13  VAL   7          HG12      VAL   7  15.476 -13.370  -5.246
    6   HG12  VAL   7          HG13      VAL   7  16.791 -13.871  -6.310
    7   HG21  VAL   7          HG21      VAL   7  17.346 -17.174  -4.845
    8   HG23  VAL   7          HG22      VAL   7  18.246 -15.710  -5.245
    9   HG22  VAL   7          HG23      VAL   7  17.218 -16.469  -6.458

  No H/Q in entry =           9
  In of MODEL   86
    1    H    VAL   8           H        VAL   8  13.441 -15.635  -3.514
    2    HA   VAL   8           HA       VAL   8  12.762 -12.928  -3.055
    3    HB   VAL   8           HB       VAL   8  11.166 -15.467  -2.632
    4   HG11  VAL   8          HG11      VAL   8  10.456 -12.555  -2.323
    5   HG13  VAL   8          HG12      VAL   8  10.041 -13.913  -1.277
    6   HG12  VAL   8          HG13      VAL   8   9.230 -13.718  -2.831
    7   HG23  VAL   8          HG21      VAL   8  10.485 -13.539  -4.795
    8   HG22  VAL   8          HG22      VAL   8  10.557 -15.298  -4.839
    9   HG21  VAL   8          HG23      VAL   8  12.035 -14.355  -4.996

  No H/Q in entry =           9
  In of MODEL   86
    1    H    MET   9           H        MET   9  13.033 -15.725  -0.864
    2    HA   MET   9           HA       MET   9  12.203 -14.448   1.499
    3    HB2  MET   9           HB2      MET   9  14.132 -16.711   0.982
    4    HB3  MET   9           HB3      MET   9  13.799 -16.132   2.614
    5    HG2  MET   9           HG2      MET   9  11.382 -16.534   2.255
    6    HG3  MET   9           HG3      MET   9  11.736 -17.149   0.639
    7    HE2  MET   9           HE1      MET   9  11.277 -18.415   4.407
    8    HE1  MET   9           HE2      MET   9  12.520 -17.183   4.214
    9    HE3  MET   9           HE3      MET   9  12.977 -18.819   4.679

  No H/Q in entry =           9
  In of MODEL   86
    1    H    GLY  10           H        GLY  10  15.391 -14.663  -0.044
    2    HA3  GLY  10           HA2      GLY  10  16.835 -13.228   1.926
    3    HA2  GLY  10           HA3      GLY  10  17.306 -13.397   0.235

  No H/Q in entry =           3
  In of MODEL   86
    1    H    LEU  11           H        LEU  11  15.136 -12.191  -1.017
    2    HA   LEU  11           HA       LEU  11  15.806  -9.442  -0.861
    3    HB2  LEU  11           HB2      LEU  11  13.451 -10.869  -2.100
    4    HB3  LEU  11           HB3      LEU  11  13.723  -9.133  -2.265
    5    HG   LEU  11           HG       LEU  11  15.764 -11.234  -3.038
    6   HD13  LEU  11          HD11      LEU  11  14.026 -11.616  -4.563
    7   HD12  LEU  11          HD12      LEU  11  15.026 -10.432  -5.404
    8   HD11  LEU  11          HD13      LEU  11  13.547  -9.918  -4.593
    9   HD22  LEU  11          HD21      LEU  11  16.984  -9.263  -2.814
   10   HD21  LEU  11          HD22      LEU  11  15.605  -8.235  -3.202
   11   HD23  LEU  11          HD23      LEU  11  16.446  -9.104  -4.485

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  12           H        ILE  12  13.043 -11.279   0.402
    2    HA   ILE  12           HA       ILE  12  11.633  -9.059   1.448
    3    HB   ILE  12           HB       ILE  12  11.682 -11.937   2.410
    4   HG12  ILE  12          HG12      ILE  12  11.002 -11.316  -0.045
    5   HG13  ILE  12          HG13      ILE  12   9.983 -12.412   0.865
    6   HG22  ILE  12          HG21      ILE  12   9.389 -11.358   3.306
    7   HG21  ILE  12          HG22      ILE  12   9.741  -9.666   2.958
    8   HG23  ILE  12          HG23      ILE  12  10.716 -10.546   4.134
    9   HD12  ILE  12          HD11      ILE  12   8.734 -10.631  -0.381
   10   HD11  ILE  12          HD12      ILE  12   9.530  -9.428   0.631
   11   HD13  ILE  12          HD13      ILE  12   8.447 -10.599   1.351

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  13           H        ILE  13  14.033 -11.244   2.871
    2    HA   ILE  13           HA       ILE  13  14.051 -10.055   5.447
    3    HB   ILE  13           HB       ILE  13  16.127 -11.620   3.895
    4   HG12  ILE  13          HG12      ILE  13  13.853 -12.597   4.730
    5   HG13  ILE  13          HG13      ILE  13  15.332 -13.511   5.005
    6   HG22  ILE  13          HG21      ILE  13  17.170 -11.960   6.220
    7   HG21  ILE  13          HG22      ILE  13  16.231 -10.564   6.733
    8   HG23  ILE  13          HG23      ILE  13  17.441 -10.393   5.461
    9   HD11  ILE  13          HD11      ILE  13  14.120 -11.630   7.064
   10   HD13  ILE  13          HD12      ILE  13  15.454 -12.755   7.297
   11   HD12  ILE  13          HD13      ILE  13  13.828 -13.368   7.023

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ASN  14           H        ASN  14  16.013  -9.522   2.535
    2    HA   ASN  14           HA       ASN  14  17.739  -7.565   3.596
    3    HB2  ASN  14           HB2      ASN  14  17.735  -8.840   1.285
    4    HB3  ASN  14           HB3      ASN  14  16.834  -7.431   0.739
    5   HD21  ASN  14          HD21      ASN  14  19.282  -7.757  -0.435
    6   HD22  ASN  14          HD22      ASN  14  20.415  -6.663   0.193

  No H/Q in entry =           6
  In of MODEL   86
    1    H    SER  15           H        SER  15  14.633  -7.246   1.890
    2    HA   SER  15           HA       SER  15  14.500  -4.426   1.936
    3    HB2  SER  15           HB2      SER  15  12.172  -4.692   1.431
    4    HB3  SER  15           HB3      SER  15  12.981  -6.056   0.669
    5    HG   SER  15           HG       SER  15  11.030  -6.161   2.384

  No H/Q in entry =           5
  In of MODEL   86
    1    H    GLY  16           H        GLY  16  13.415  -6.886   4.244
    2    HA3  GLY  16           HA2      GLY  16  12.173  -5.140   6.090
    3    HA2  GLY  16           HA3      GLY  16  12.799  -6.742   6.460

  No H/Q in entry =           3
  In of MODEL   86
    1    H    GLN  17           H        GLN  17  15.510  -6.390   5.878
    2    HA   GLN  17           HA       GLN  17  16.447  -5.153   8.258
    3    HB2  GLN  17           HB2      GLN  17  17.693  -6.941   7.072
    4    HB3  GLN  17           HB3      GLN  17  18.003  -5.824   5.741
    5    HG2  GLN  17           HG2      GLN  17  19.171  -4.302   7.313
    6    HG3  GLN  17           HG3      GLN  17  18.905  -5.461   8.612
    7   HE21  GLN  17          HE21      GLN  17  20.995  -6.286   8.986
    8   HE22  GLN  17          HE22      GLN  17  21.973  -6.974   7.780

  No H/Q in entry =           8
  In of MODEL   86
    1    H    ALA  18           H        ALA  18  16.264  -4.089   4.893
    2    HA   ALA  18           HA       ALA  18  17.679  -1.684   5.117
    3    HB2  ALA  18           HB1      ALA  18  16.580  -2.915   3.050
    4    HB3  ALA  18           HB2      ALA  18  16.830  -1.170   3.029
    5    HB1  ALA  18           HB3      ALA  18  15.234  -1.827   3.394

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ARG  19           H        ARG  19  14.182  -2.299   5.501
    2    HA   ARG  19           HA       ARG  19  13.489   0.348   6.204
    3    HB2  ARG  19           HB2      ARG  19  11.825  -1.420   5.616
    4    HB3  ARG  19           HB3      ARG  19  12.167  -2.209   7.158
    5    HG2  ARG  19           HG2      ARG  19  11.435  -0.220   8.387
    6    HG3  ARG  19           HG3      ARG  19  11.184   0.649   6.874
    7    HD2  ARG  19           HD2      ARG  19   9.046  -0.162   7.688
    8    HD3  ARG  19           HD3      ARG  19   9.478  -1.043   6.216
    9    HE   ARG  19           HE       ARG  19  10.440  -2.570   8.331
   10   HH21  ARG  19          HH11      ARG  19   9.201  -4.217   9.271
   11   HH22  ARG  19          HH12      ARG  19   7.482  -4.205   9.093
   12   HH11  ARG  19          HH21      ARG  19   7.440  -1.307   7.219
   13   HH12  ARG  19          HH22      ARG  19   6.485  -2.557   7.927

  No H/Q in entry =          13
  In of MODEL   86
    1    H    SER  20           H        SER  20  14.362  -2.468   8.177
    2    HA   SER  20           HA       SER  20  14.059  -1.362  10.709
    3    HB2  SER  20           HB2      SER  20  14.586  -3.741  10.331
    4    HB3  SER  20           HB3      SER  20  16.202  -3.296   9.791
    5    HG   SER  20           HG       SER  20  15.145  -2.570  12.318

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LEU  21           H        LEU  21  16.911  -1.284   8.585
    2    HA   LEU  21           HA       LEU  21  18.565   0.222  10.325
    3    HB2  LEU  21           HB2      LEU  21  18.559  -0.057   7.312
    4    HB3  LEU  21           HB3      LEU  21  19.805   0.811   8.207
    5    HG   LEU  21           HG       LEU  21  19.077  -2.086   8.734
    6   HD13  LEU  21          HD11      LEU  21  21.108  -2.654   7.467
    7   HD12  LEU  21          HD12      LEU  21  21.370  -0.949   7.103
    8   HD11  LEU  21          HD13      LEU  21  19.965  -1.785   6.442
    9   HD21  LEU  21          HD21      LEU  21  21.170  -0.178   9.763
   10   HD23  LEU  21          HD22      LEU  21  21.560  -1.891   9.676
   11   HD22  LEU  21          HD23      LEU  21  20.213  -1.350  10.664

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ALA  22           H        ALA  22  16.304   1.163   7.756
    2    HA   ALA  22           HA       ALA  22  16.820   3.926   7.762
    3    HB3  ALA  22           HB1      ALA  22  15.435   2.666   6.082
    4    HB2  ALA  22           HB2      ALA  22  14.714   4.174   6.640
    5    HB1  ALA  22           HB3      ALA  22  14.133   2.633   7.271

  No H/Q in entry =           5
  In of MODEL   86
    1    H    TYR  23           H        TYR  23  14.330   2.096   9.592
    2    HA   TYR  23           HA       TYR  23  13.343   4.330  11.029
    3    HB2  TYR  23           HB2      TYR  23  12.125   2.205  11.010
    4    HB3  TYR  23           HB3      TYR  23  13.458   1.410  11.845
    5    HD1  TYR  23           HD1      TYR  23  10.923   4.124  12.185
    6    HD2  TYR  23           HD2      TYR  23  13.651   1.491  14.203
    7    HE1  TYR  23           HE1      TYR  23   9.978   4.819  14.372
    8    HE2  TYR  23           HE2      TYR  23  12.706   2.185  16.388
    9    HH   TYR  23           HH       TYR  23   9.976   4.467  16.566

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ALA  24           H        ALA  24  16.003   2.078  11.687
    2    HA   ALA  24           HA       ALA  24  16.654   3.088  14.249
    3    HB1  ALA  24           HB1      ALA  24  18.025   1.305  14.097
    4    HB3  ALA  24           HB2      ALA  24  19.050   2.231  13.000
    5    HB2  ALA  24           HB3      ALA  24  17.767   1.210  12.356

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ALA  25           H        ALA  25  17.618   4.013  10.972
    2    HA   ALA  25           HA       ALA  25  19.546   5.964  11.619
    3    HB1  ALA  25           HB1      ALA  25  18.847   5.003   9.304
    4    HB3  ALA  25           HB2      ALA  25  19.335   6.694   9.393
    5    HB2  ALA  25           HB3      ALA  25  17.624   6.274   9.318

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LEU  26           H        LEU  26  16.031   6.165  11.241
    2    HA   LEU  26           HA       LEU  26  15.784   8.947  11.681
    3    HB2  LEU  26           HB2      LEU  26  13.936   7.694  10.749
    4    HB3  LEU  26           HB3      LEU  26  13.846   6.671  12.178
    5    HG   LEU  26           HG       LEU  26  13.219   8.629  13.548
    6   HD12  LEU  26          HD11      LEU  26  12.549  10.720  12.213
    7   HD11  LEU  26          HD12      LEU  26  13.540  10.069  10.910
    8   HD13  LEU  26          HD13      LEU  26  14.275  10.465  12.464
    9   HD21  LEU  26          HD21      LEU  26  11.558   8.294  11.032
   10   HD23  LEU  26          HD22      LEU  26  10.985   8.993  12.544
   11   HD22  LEU  26          HD23      LEU  26  11.450   7.295  12.482

  No H/Q in entry =          11
  In of MODEL   86
    1    H    LYS  27           H        LYS  27  15.686   6.174  13.884
    2    HA   LYS  27           HA       LYS  27  15.072   7.544  16.244
    3    HB2  LYS  27           HB2      LYS  27  15.119   5.068  15.988
    4    HB3  LYS  27           HB3      LYS  27  16.882   5.133  15.953
    5    HG2  LYS  27           HG2      LYS  27  16.915   6.127  18.199
    6    HG3  LYS  27           HG3      LYS  27  15.148   6.133  18.236
    7    HD2  LYS  27           HD2      LYS  27  15.141   3.665  18.008
    8    HD3  LYS  27           HD3      LYS  27  16.906   3.667  18.005
    9    HE2  LYS  27           HE2      LYS  27  16.923   4.664  20.258
   10    HE3  LYS  27           HE3      LYS  27  15.157   4.692  20.264
   11    HZ3  LYS  27           HZ1      LYS  27  15.953   2.749  21.426
   12    HZ2  LYS  27           HZ2      LYS  27  16.878   2.272  20.080
   13    HZ1  LYS  27           HZ3      LYS  27  15.180   2.265  19.993

  No H/Q in entry =          13
  In of MODEL   86
    1    H    GLN  28           H        GLN  28  18.200   6.977  14.668
    2    HA   GLN  28           HA       GLN  28  19.868   8.079  16.663
    3    HB2  GLN  28           HB2      GLN  28  20.170   8.025  13.649
    4    HB3  GLN  28           HB3      GLN  28  21.448   8.507  14.764
    5    HG2  GLN  28           HG2      GLN  28  20.043   5.822  14.812
    6    HG3  GLN  28           HG3      GLN  28  21.624   6.113  14.088
    7   HE21  GLN  28          HE21      GLN  28  20.429   4.734  16.757
    8   HE22  GLN  28          HE22      GLN  28  21.588   5.197  17.906

  No H/Q in entry =           8
  In of MODEL   86
    1    H    ALA  29           H        ALA  29  18.119   9.541  13.957
    2    HA   ALA  29           HA       ALA  29  19.101  12.169  14.206
    3    HB2  ALA  29           HB1      ALA  29  17.406  12.790  12.724
    4    HB1  ALA  29           HB2      ALA  29  16.266  11.612  13.374
    5    HB3  ALA  29           HB3      ALA  29  17.604  11.074  12.359

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LYS  30           H        LYS  30  16.327  10.558  15.720
    2    HA   LYS  30           HA       LYS  30  15.294  12.811  17.064
    3    HB2  LYS  30           HB2      LYS  30  15.195   9.871  17.778
    4    HB3  LYS  30           HB3      LYS  30  14.319  11.120  18.663
    5    HG2  LYS  30           HG2      LYS  30  13.200  11.792  16.537
    6    HG3  LYS  30           HG3      LYS  30  14.015  10.458  15.719
    7    HD2  LYS  30           HD2      LYS  30  12.945   8.850  17.248
    8    HD3  LYS  30           HD3      LYS  30  12.140  10.174  18.091
    9    HE2  LYS  30           HE2      LYS  30  10.978  10.793  15.991
   10    HE3  LYS  30           HE3      LYS  30  11.763   9.440  15.168
   11    HZ2  LYS  30           HZ1      LYS  30   9.453   9.022  16.039
   12    HZ1  LYS  30           HZ2      LYS  30  10.113   9.084  17.609
   13    HZ3  LYS  30           HZ3      LYS  30  10.633   7.898  16.505

  No H/Q in entry =          13
  In of MODEL   86
    1    H    GLN  31           H        GLN  31  17.963  10.658  17.821
    2    HA   GLN  31           HA       GLN  31  18.273  11.683  20.513
    3    HB2  GLN  31           HB2      GLN  31  20.311  10.117  18.923
    4    HB3  GLN  31           HB3      GLN  31  20.169  10.247  20.676
    5    HG2  GLN  31           HG2      GLN  31  17.663   9.279  19.899
    6    HG3  GLN  31           HG3      GLN  31  18.774   8.437  18.827
    7   HE21  GLN  31          HE21      GLN  31  17.227   7.290  21.100
    8   HE22  GLN  31          HE22      GLN  31  18.382   6.639  22.158

  No H/Q in entry =           8
  In of MODEL   86
    1    H    GLY  32           H        GLY  32  18.799  12.993  17.544
    2    HA3  GLY  32           HA2      GLY  32  19.775  15.041  17.028
    3    HA2  GLY  32           HA3      GLY  32  20.525  15.055  18.619

  No H/Q in entry =           3
  In of MODEL   86
    1    H    ASP  33           H        ASP  33  20.970  12.159  16.854
    2    HA   ASP  33           HA       ASP  33  23.794  12.848  16.398
    3    HB2  ASP  33           HB2      ASP  33  22.298  10.224  16.516
    4    HB3  ASP  33           HB3      ASP  33  23.986  10.348  16.028

  No H/Q in entry =           4
  In of MODEL   86
    1    H    PHE  34           H        PHE  34  23.314  14.162  14.510
    2    HA   PHE  34           HA       PHE  34  21.980  13.163  12.220
    3    HB2  PHE  34           HB2      PHE  34  24.099  15.309  12.452
    4    HB3  PHE  34           HB3      PHE  34  23.122  15.009  11.017
    5    HD1  PHE  34           HD1      PHE  34  23.349  16.954  13.925
    6    HD2  PHE  34           HD2      PHE  34  20.494  14.815  11.534
    7    HE1  PHE  34           HE1      PHE  34  21.521  18.345  14.859
    8    HE2  PHE  34           HE2      PHE  34  18.669  16.206  12.471
    9    HZ   PHE  34           HZ       PHE  34  19.187  17.972  14.129

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ALA  35           H        ALA  35  25.351  12.997  13.243
    2    HA   ALA  35           HA       ALA  35  26.472  12.174  10.794
    3    HB3  ALA  35           HB1      ALA  35  28.151  11.019  12.525
    4    HB2  ALA  35           HB2      ALA  35  27.277  12.044  13.663
    5    HB1  ALA  35           HB3      ALA  35  28.116  12.767  12.292

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ALA  36           H        ALA  36  25.355  10.221  13.561
    2    HA   ALA  36           HA       ALA  36  25.859   7.732  12.296
    3    HB2  ALA  36           HB1      ALA  36  25.423   6.990  14.372
    4    HB3  ALA  36           HB2      ALA  36  23.733   7.475  14.213
    5    HB1  ALA  36           HB3      ALA  36  24.925   8.615  14.837

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ALA  37           H        ALA  37  23.024   9.842  12.410
    2    HA   ALA  37           HA       ALA  37  21.184   8.057  11.232
    3    HB3  ALA  37           HB1      ALA  37  21.390  11.022  11.515
    4    HB1  ALA  37           HB2      ALA  37  20.083   9.937  11.986
    5    HB2  ALA  37           HB3      ALA  37  20.277  10.405  10.295

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LYS  38           H        LYS  38  23.275  10.526   9.754
    2    HA   LYS  38           HA       LYS  38  22.650  10.086   7.076
    3    HB2  LYS  38           HB2      LYS  38  24.443  11.659   8.523
    4    HB3  LYS  38           HB3      LYS  38  25.487  10.673   7.506
    5    HG2  LYS  38           HG2      LYS  38  24.326  11.429   5.502
    6    HG3  LYS  38           HG3      LYS  38  23.122  12.279   6.475
    7    HD2  LYS  38           HD2      LYS  38  24.703  13.891   7.229
    8    HD3  LYS  38           HD3      LYS  38  26.072  12.912   6.702
    9    HE2  LYS  38           HE2      LYS  38  25.710  14.775   5.143
   10    HE3  LYS  38           HE3      LYS  38  25.389  13.233   4.342
   11    HZ3  LYS  38           HZ1      LYS  38  23.190  13.663   4.201
   12    HZ2  LYS  38           HZ2      LYS  38  23.701  15.281   4.285
   13    HZ1  LYS  38           HZ3      LYS  38  23.126  14.498   5.678

  No H/Q in entry =          13
  In of MODEL   86
    1    H    ALA  39           H        ALA  39  25.166   8.511   9.048
    2    HA   ALA  39           HA       ALA  39  26.255   6.923   6.989
    3    HB2  ALA  39           HB1      ALA  39  26.160   5.969   9.835
    4    HB1  ALA  39           HB2      ALA  39  27.105   7.399   9.418
    5    HB3  ALA  39           HB3      ALA  39  27.470   5.849   8.662

  No H/Q in entry =           5
  In of MODEL   86
    1    H    MET  40           H        MET  40  23.636   6.297   9.277
    2    HA   MET  40           HA       MET  40  23.215   3.586   8.550
    3    HB2  MET  40           HB2      MET  40  21.379   5.621   9.828
    4    HB3  MET  40           HB3      MET  40  20.985   3.909   9.657
    5    HG2  MET  40           HG2      MET  40  23.522   4.873  11.006
    6    HG3  MET  40           HG3      MET  40  22.026   4.589  11.893
    7    HE3  MET  40           HE1      MET  40  21.487   0.952  12.079
    8    HE2  MET  40           HE2      MET  40  20.613   2.246  11.263
    9    HE1  MET  40           HE3      MET  40  21.345   2.544  12.838

  No H/Q in entry =           9
  In of MODEL   86
    1    H    MET  41           H        MET  41  21.785   6.625   7.347
    2    HA   MET  41           HA       MET  41  19.844   5.410   5.670
    3    HB2  MET  41           HB2      MET  41  21.308   8.010   5.155
    4    HB3  MET  41           HB3      MET  41  19.787   7.502   4.431
    5    HG2  MET  41           HG2      MET  41  19.031   7.317   6.980
    6    HG3  MET  41           HG3      MET  41  20.331   8.485   7.204
    7    HE2  MET  41           HE1      MET  41  19.773   9.757   3.860
    8    HE1  MET  41           HE2      MET  41  20.720  10.209   5.274
    9    HE3  MET  41           HE3      MET  41  19.442  11.277   4.701

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ASP  42           H        ASP  42  23.212   6.356   5.129
    2    HA   ASP  42           HA       ASP  42  23.319   5.874   2.373
    3    HB2  ASP  42           HB2      ASP  42  25.055   6.890   4.147
    4    HB3  ASP  42           HB3      ASP  42  25.725   5.269   4.027

  No H/Q in entry =           4
  In of MODEL   86
    1    H    GLN  43           H        GLN  43  24.048   3.734   5.104
    2    HA   GLN  43           HA       GLN  43  24.736   1.476   3.532
    3    HB2  GLN  43           HB2      GLN  43  23.700   1.661   6.370
    4    HB3  GLN  43           HB3      GLN  43  24.293   0.174   5.623
    5    HG2  GLN  43           HG2      GLN  43  26.449   1.399   5.117
    6    HG3  GLN  43           HG3      GLN  43  25.852   2.725   6.110
    7   HE21  GLN  43          HE21      GLN  43  28.088   1.773   7.159
    8   HE22  GLN  43          HE22      GLN  43  27.816   0.692   8.438

  No H/Q in entry =           8
  In of MODEL   86
    1    H    SER  44           H        SER  44  21.665   2.591   4.900
    2    HA   SER  44           HA       SER  44  20.117   0.334   4.228
    3    HB2  SER  44           HB2      SER  44  19.651   2.863   5.363
    4    HB3  SER  44           HB3      SER  44  18.623   2.808   3.934
    5    HG   SER  44           HG       SER  44  17.529   1.862   5.655

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ARG  45           H        ARG  45  20.845   3.298   2.416
    2    HA   ARG  45           HA       ARG  45  19.334   2.793   0.107
    3    HB2  ARG  45           HB2      ARG  45  20.459   4.940   0.689
    4    HB3  ARG  45           HB3      ARG  45  22.011   4.195   0.312
    5    HG2  ARG  45           HG2      ARG  45  21.240   3.776  -2.004
    6    HG3  ARG  45           HG3      ARG  45  19.700   4.544  -1.627
    7    HD2  ARG  45           HD2      ARG  45  20.933   6.651  -1.044
    8    HD3  ARG  45           HD3      ARG  45  22.437   5.887  -1.604
    9    HE   ARG  45           HE       ARG  45  20.517   5.628  -3.647
   10   HH21  ARG  45          HH11      ARG  45  20.508   6.991  -5.415
   11   HH22  ARG  45          HH12      ARG  45  21.253   8.547  -5.313
   12   HH11  ARG  45          HH21      ARG  45  22.223   8.145  -2.022
   13   HH12  ARG  45          HH22      ARG  45  22.223   9.200  -3.388

  No H/Q in entry =          13
  In of MODEL   86
    1    H    MET  46           H        MET  46  22.701   1.945   0.871
    2    HA   MET  46           HA       MET  46  23.325   0.748  -1.606
    3    HB2  MET  46           HB2      MET  46  24.423   0.442   1.188
    4    HB3  MET  46           HB3      MET  46  25.090  -0.455  -0.179
    5    HG2  MET  46           HG2      MET  46  25.536   1.640  -1.372
    6    HG3  MET  46           HG3      MET  46  24.805   2.563  -0.066
    7    HE1  MET  46           HE1      MET  46  27.459   0.314  -1.319
    8    HE3  MET  46           HE2      MET  46  27.378  -0.624   0.169
    9    HE2  MET  46           HE3      MET  46  28.801   0.360  -0.166

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ALA  47           H        ALA  47  21.939  -0.584   1.369
    2    HA   ALA  47           HA       ALA  47  21.907  -3.300   0.575
    3    HB2  ALA  47           HB1      ALA  47  21.516  -2.834   2.877
    4    HB3  ALA  47           HB2      ALA  47  19.986  -3.449   2.254
    5    HB1  ALA  47           HB3      ALA  47  20.203  -1.716   2.507

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LEU  48           H        LEU  48  19.538  -0.690   0.200
    2    HA   LEU  48           HA       LEU  48  17.508  -2.241  -1.052
    3    HB2  LEU  48           HB2      LEU  48  18.144   0.717  -1.176
    4    HB3  LEU  48           HB3      LEU  48  16.680  -0.005  -1.845
    5    HG   LEU  48           HG       LEU  48  17.525  -0.291   1.048
    6   HD13  LEU  48          HD11      LEU  48  17.094   2.007   0.851
    7   HD12  LEU  48          HD12      LEU  48  15.537   1.351   1.357
    8   HD11  LEU  48          HD13      LEU  48  15.812   1.769  -0.334
    9   HD22  LEU  48          HD21      LEU  48  16.008  -2.016   0.668
   10   HD21  LEU  48          HD22      LEU  48  15.133  -1.123  -0.577
   11   HD23  LEU  48          HD23      LEU  48  14.912  -0.714   1.125

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ASN  49           H        ASN  49  20.188  -0.301  -2.281
    2    HA   ASN  49           HA       ASN  49  19.547  -0.398  -5.007
    3    HB2  ASN  49           HB2      ASN  49  21.212   1.134  -4.094
    4    HB3  ASN  49           HB3      ASN  49  22.245  -0.214  -3.635
    5   HD21  ASN  49          HD21      ASN  49  20.755   1.295  -6.525
    6   HD22  ASN  49          HD22      ASN  49  22.001   0.849  -7.586

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLU  50           H        GLU  50  21.538  -2.573  -3.029
    2    HA   GLU  50           HA       GLU  50  22.257  -4.333  -5.146
    3    HB2  GLU  50           HB2      GLU  50  23.447  -4.293  -2.976
    4    HB3  GLU  50           HB3      GLU  50  22.006  -4.926  -2.183
    5    HG2  GLU  50           HG2      GLU  50  22.112  -6.964  -3.533
    6    HG3  GLU  50           HG3      GLU  50  23.487  -6.326  -4.432

  No H/Q in entry =           6
  In of MODEL   86
    1    H    ALA  51           H        ALA  51  19.593  -4.274  -2.829
    2    HA   ALA  51           HA       ALA  51  18.444  -6.757  -3.580
    3    HB3  ALA  51           HB1      ALA  51  16.843  -6.255  -2.032
    4    HB1  ALA  51           HB2      ALA  51  16.622  -4.612  -2.637
    5    HB2  ALA  51           HB3      ALA  51  17.980  -4.986  -1.576

  No H/Q in entry =           5
  In of MODEL   86
    1    H    HIS  52           H        HIS  52  17.841  -3.417  -4.630
    2    HA   HIS  52           HA       HIS  52  15.737  -3.963  -6.434
    3    HB2  HIS  52           HB2      HIS  52  16.371  -1.691  -5.639
    4    HB3  HIS  52           HB3      HIS  52  17.828  -1.783  -6.629
    5    HD1  HIS  52           HD1      HIS  52  17.464  -1.930  -9.261
    6    HD2  HIS  52           HD2      HIS  52  14.035  -1.059  -7.056
    7    HE1  HIS  52           HE1      HIS  52  15.749  -1.069 -10.914
    8    HE2  HIS  52           HE2      HIS  52  13.653  -0.532  -9.585

  No H/Q in entry =           8
  In of MODEL   86
    1    H    LEU  53           H        LEU  53  19.256  -3.950  -6.856
    2    HA   LEU  53           HA       LEU  53  19.324  -4.276  -9.655
    3    HB2  LEU  53           HB2      LEU  53  21.255  -5.020  -7.473
    4    HB3  LEU  53           HB3      LEU  53  21.579  -5.408  -9.159
    5    HG   LEU  53           HG       LEU  53  20.903  -2.601  -8.216
    6   HD13  LEU  53          HD11      LEU  53  23.248  -2.113  -8.165
    7   HD12  LEU  53          HD12      LEU  53  23.655  -3.687  -8.849
    8   HD11  LEU  53          HD13      LEU  53  23.030  -3.576  -7.209
    9   HD22  LEU  53          HD21      LEU  53  20.601  -2.616 -10.546
   10   HD21  LEU  53          HD22      LEU  53  21.843  -3.839 -10.794
   11   HD23  LEU  53          HD23      LEU  53  22.303  -2.186 -10.434

  No H/Q in entry =          11
  In of MODEL   86
    1    H    VAL  54           H        VAL  54  19.218  -6.653  -7.020
    2    HA   VAL  54           HA       VAL  54  19.361  -8.953  -8.669
    3    HB   VAL  54           HB       VAL  54  18.195  -8.525  -5.907
    4   HG12  VAL  54          HG11      VAL  54  18.536 -11.141  -5.891
    5   HG11  VAL  54          HG12      VAL  54  18.355 -10.981  -7.638
    6   HG13  VAL  54          HG13      VAL  54  17.060 -10.454  -6.565
    7   HG22  VAL  54          HG21      VAL  54  20.509  -8.299  -5.678
    8   HG21  VAL  54          HG22      VAL  54  20.857  -9.394  -7.014
    9   HG23  VAL  54          HG23      VAL  54  20.327 -10.038  -5.460

  No H/Q in entry =           9
  In of MODEL   86
    1    H    GLN  55           H        GLN  55  16.616  -7.063  -7.403
    2    HA   GLN  55           HA       GLN  55  14.610  -8.745  -8.475
    3    HB2  GLN  55           HB2      GLN  55  13.846  -7.217  -6.858
    4    HB3  GLN  55           HB3      GLN  55  14.633  -5.847  -7.637
    5    HG2  GLN  55           HG2      GLN  55  12.911  -5.540  -9.133
    6    HG3  GLN  55           HG3      GLN  55  12.601  -7.264  -9.297
    7   HE21  GLN  55          HE21      GLN  55  10.595  -7.823  -8.495
    8   HE22  GLN  55          HE22      GLN  55   9.813  -7.068  -7.193

  No H/Q in entry =           8
  In of MODEL   86
    1    H    THR  56           H        THR  56  16.334  -5.939  -9.842
    2    HA   THR  56           HA       THR  56  14.901  -5.597 -12.196
    3    HB   THR  56           HB       THR  56  17.919  -5.486 -12.021
    4    HG1  THR  56           HG1      THR  56  15.960  -4.013 -10.798
    5   HG21  THR  56          HG21      THR  56  16.539  -5.212 -14.233
    6   HG23  THR  56          HG22      THR  56  17.815  -4.055 -13.860
    7   HG22  THR  56          HG23      THR  56  16.129  -3.633 -13.562

  No H/Q in entry =           7
  In of MODEL   86
    1    H    LYS  57           H        LYS  57  17.564  -7.873 -11.567
    2    HA   LYS  57           HA       LYS  57  17.581  -9.079 -14.140
    3    HB2  LYS  57           HB2      LYS  57  19.369  -9.312 -12.392
    4    HB3  LYS  57           HB3      LYS  57  18.269 -10.306 -11.448
    5    HG2  LYS  57           HG2      LYS  57  18.159 -11.944 -13.289
    6    HG3  LYS  57           HG3      LYS  57  19.265 -10.958 -14.239
    7    HD2  LYS  57           HD2      LYS  57  20.012 -11.966 -11.490
    8    HD3  LYS  57           HD3      LYS  57  20.292 -12.934 -12.938
    9    HE2  LYS  57           HE2      LYS  57  21.546 -10.949 -13.906
   10    HE3  LYS  57           HE3      LYS  57  21.444 -10.189 -12.318
   11    HZ1  LYS  57           HZ1      LYS  57  22.353 -12.625 -11.695
   12    HZ3  LYS  57           HZ2      LYS  57  23.345 -11.273 -11.960
   13    HZ2  LYS  57           HZ3      LYS  57  23.082 -12.394 -13.209

  No H/Q in entry =          13
  In of MODEL   86
    1    H    LEU  58           H        LEU  58  15.797  -9.746 -11.166
    2    HA   LEU  58           HA       LEU  58  14.595 -12.132 -12.094
    3    HB2  LEU  58           HB2      LEU  58  13.780 -10.223  -9.909
    4    HB3  LEU  58           HB3      LEU  58  12.986 -11.768 -10.221
    5    HG   LEU  58           HG       LEU  58  15.955 -11.465  -9.659
    6   HD11  LEU  58          HD11      LEU  58  13.582 -11.892  -7.871
    7   HD13  LEU  58          HD12      LEU  58  15.027 -10.917  -7.609
    8   HD12  LEU  58          HD13      LEU  58  15.112 -12.672  -7.466
    9   HD22  LEU  58          HD21      LEU  58  15.855 -13.533 -10.678
   10   HD21  LEU  58          HD22      LEU  58  14.142 -13.753 -10.321
   11   HD23  LEU  58          HD23      LEU  58  15.349 -14.039  -9.067

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  59           H        ILE  59  13.901  -8.803 -12.793
    2    HA   ILE  59           HA       ILE  59  11.193  -9.476 -13.738
    3    HB   ILE  59           HB       ILE  59  11.983  -7.181 -12.543
    4   HG12  ILE  59          HG12      ILE  59  10.072  -7.085 -14.888
    5   HG13  ILE  59          HG13      ILE  59   9.661  -7.854 -13.377
    6   HG23  ILE  59          HG21      ILE  59  12.533  -5.460 -14.064
    7   HG22  ILE  59          HG22      ILE  59  12.054  -6.402 -15.458
    8   HG21  ILE  59          HG23      ILE  59  13.538  -6.790 -14.592
    9   HD13  ILE  59          HD11      ILE  59  10.014  -5.784 -12.150
   10   HD12  ILE  59          HD12      ILE  59   8.887  -5.488 -13.474
   11   HD11  ILE  59          HD13      ILE  59  10.572  -4.986 -13.621

  No H/Q in entry =          11
  In of MODEL   86
    1    H    GLU  60           H        GLU  60  14.394  -8.606 -14.991
    2    HA   GLU  60           HA       GLU  60  13.619  -8.224 -17.704
    3    HB2  GLU  60           HB2      GLU  60  15.790  -7.471 -16.846
    4    HB3  GLU  60           HB3      GLU  60  16.265  -9.139 -16.540
    5    HG2  GLU  60           HG2      GLU  60  16.100  -9.645 -18.946
    6    HG3  GLU  60           HG3      GLU  60  15.590  -7.987 -19.265

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLY  61           H        GLY  61  14.613 -11.090 -15.873
    2    HA3  GLY  61           HA2      GLY  61  14.090 -12.753 -18.268
    3    HA2  GLY  61           HA3      GLY  61  15.122 -13.220 -16.921

  No H/Q in entry =           3
  In of MODEL   86
    1    H    ASP  62           H        ASP  62  11.990 -11.696 -16.567
    2    HA   ASP  62           HA       ASP  62  11.078 -13.725 -14.783
    3    HB2  ASP  62           HB2      ASP  62   8.960 -12.407 -14.829
    4    HB3  ASP  62           HB3      ASP  62  10.386 -11.448 -14.444

  No H/Q in entry =           4
  In of MODEL   86
    1    H    ALA  63           H        ALA  63  11.398 -14.034 -18.017
    2    HA   ALA  63           HA       ALA  63   8.926 -14.882 -19.039
    3    HB2  ALA  63           HB1      ALA  63  10.282 -16.286 -20.590
    4    HB1  ALA  63           HB2      ALA  63  11.706 -15.941 -19.612
    5    HB3  ALA  63           HB3      ALA  63  10.886 -14.634 -20.466

  No H/Q in entry =           5
  In of MODEL   86
    1    H    GLY  64           H        GLY  64  11.398 -16.678 -17.252
    2    HA3  GLY  64           HA2      GLY  64  11.341 -18.653 -16.091
    3    HA2  GLY  64           HA3      GLY  64   9.617 -18.370 -15.896

  No H/Q in entry =           3
  In of MODEL   86
    1    H    GLU  65           H        GLU  65   8.958 -20.500 -16.214
    2    HA   GLU  65           HA       GLU  65   9.931 -22.133 -18.311
    3    HB2  GLU  65           HB2      GLU  65   7.440 -22.319 -16.624
    4    HB3  GLU  65           HB3      GLU  65   7.922 -23.552 -17.789
    5    HG2  GLU  65           HG2      GLU  65  10.036 -23.886 -16.627
    6    HG3  GLU  65           HG3      GLU  65   9.662 -22.576 -15.509

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLY  66           H        GLY  66   7.091 -20.126 -18.017
    2    HA3  GLY  66           HA2      GLY  66   6.188 -20.720 -20.728
    3    HA2  GLY  66           HA3      GLY  66   5.302 -19.827 -19.509

  No H/Q in entry =           3
  In of MODEL   86
    1    H    LYS  67           H        LYS  67   5.244 -18.834 -21.946
    2    HA   LYS  67           HA       LYS  67   7.374 -17.047 -22.578
    3    HB2  LYS  67           HB2      LYS  67   4.578 -17.357 -23.660
    4    HB3  LYS  67           HB3      LYS  67   5.768 -16.231 -24.324
    5    HG2  LYS  67           HG2      LYS  67   7.344 -18.090 -24.683
    6    HG3  LYS  67           HG3      LYS  67   6.175 -19.221 -24.007
    7    HD2  LYS  67           HD2      LYS  67   4.592 -18.666 -25.821
    8    HD3  LYS  67           HD3      LYS  67   5.776 -17.549 -26.504
    9    HE2  LYS  67           HE2      LYS  67   7.376 -19.409 -26.781
   10    HE3  LYS  67           HE3      LYS  67   6.189 -20.528 -26.112
   11    HZ3  LYS  67           HZ1      LYS  67   5.352 -20.746 -28.133
   12    HZ2  LYS  67           HZ2      LYS  67   6.429 -19.591 -28.754
   13    HZ1  LYS  67           HZ3      LYS  67   4.924 -19.106 -28.134

  No H/Q in entry =          13
  In of MODEL   86
    1    H    MET  68           H        MET  68   4.094 -15.925 -22.493
    2    HA   MET  68           HA       MET  68   4.695 -13.316 -21.651
    3    HB2  MET  68           HB2      MET  68   2.042 -14.759 -21.552
    4    HB3  MET  68           HB3      MET  68   2.286 -13.011 -21.541
    5    HG2  MET  68           HG2      MET  68   3.106 -14.892 -23.774
    6    HG3  MET  68           HG3      MET  68   1.723 -13.797 -23.808
    7    HE1  MET  68           HE1      MET  68   1.714 -11.542 -23.454
    8    HE3  MET  68           HE2      MET  68   2.884 -10.391 -24.094
    9    HE2  MET  68           HE3      MET  68   3.030 -10.951 -22.429

  No H/Q in entry =           9
  In of MODEL   86
    1    H    LYS  69           H        LYS  69   3.444 -16.080 -19.751
    2    HA   LYS  69           HA       LYS  69   2.834 -14.634 -17.427
    3    HB2  LYS  69           HB2      LYS  69   2.003 -16.899 -17.908
    4    HB3  LYS  69           HB3      LYS  69   3.622 -17.543 -17.623
    5    HG2  LYS  69           HG2      LYS  69   3.594 -16.698 -15.329
    6    HG3  LYS  69           HG3      LYS  69   2.018 -15.954 -15.600
    7    HD2  LYS  69           HD2      LYS  69   1.039 -18.183 -16.014
    8    HD3  LYS  69           HD3      LYS  69   2.615 -18.924 -15.726
    9    HE2  LYS  69           HE2      LYS  69   2.638 -18.036 -13.437
   10    HE3  LYS  69           HE3      LYS  69   1.089 -17.242 -13.717
   11    HZ1  LYS  69           HZ1      LYS  69   1.183 -20.083 -14.297
   12    HZ3  LYS  69           HZ2      LYS  69  -0.036 -19.163 -13.557
   13    HZ2  LYS  69           HZ3      LYS  69   1.316 -19.665 -12.659

  No H/Q in entry =          13
  In of MODEL   86
    1    H    VAL  70           H        VAL  70   3.839 -14.195 -15.484
    2    HA   VAL  70           HA       VAL  70   6.783 -14.563 -15.409
    3    HB   VAL  70           HB       VAL  70   6.819 -12.500 -14.034
    4   HG13  VAL  70          HG11      VAL  70   6.431 -10.956 -15.862
    5   HG12  VAL  70          HG12      VAL  70   5.328 -12.091 -16.641
    6   HG11  VAL  70          HG13      VAL  70   7.050 -12.459 -16.545
    7   HG23  VAL  70          HG21      VAL  70   4.619 -11.113 -14.162
    8   HG22  VAL  70          HG22      VAL  70   4.692 -12.426 -12.989
    9   HG21  VAL  70          HG23      VAL  70   3.831 -12.652 -14.511

  No H/Q in entry =           9
  In of MODEL   86
    1    H    SER  71           H        SER  71   7.689 -14.689 -13.212
    2    HA   SER  71           HA       SER  71   6.487 -16.701 -11.624
    3    HB2  SER  71           HB2      SER  71   8.927 -16.249 -11.666
    4    HB3  SER  71           HB3      SER  71   8.642 -14.717 -10.843
    5    HG   SER  71           HG       SER  71   8.760 -17.233  -9.845

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LEU  72           H        LEU  72   5.124 -16.592  -9.942
    2    HA   LEU  72           HA       LEU  72   3.555 -14.288  -9.512
    3    HB2  LEU  72           HB2      LEU  72   3.856 -16.839  -7.935
    4    HB3  LEU  72           HB3      LEU  72   2.681 -15.588  -7.537
    5    HG   LEU  72           HG       LEU  72   2.848 -16.893 -10.273
    6   HD11  LEU  72          HD11      LEU  72   1.262 -17.620  -7.807
    7   HD13  LEU  72          HD12      LEU  72   2.249 -18.671  -8.820
    8   HD12  LEU  72          HD13      LEU  72   0.711 -18.056  -9.425
    9   HD23  LEU  72          HD21      LEU  72   0.358 -16.075 -10.180
   10   HD22  LEU  72          HD22      LEU  72   1.607 -14.890 -10.524
   11   HD21  LEU  72          HD23      LEU  72   0.928 -15.006  -8.903

  No H/Q in entry =          11
  In of MODEL   86
    1    H    VAL  73           H        VAL  73   6.216 -15.698  -7.724
    2    HA   VAL  73           HA       VAL  73   6.136 -14.157  -5.398
    3    HB   VAL  73           HB       VAL  73   8.322 -14.949  -4.959
    4   HG13  VAL  73          HG11      VAL  73   7.977 -17.247  -5.154
    5   HG12  VAL  73          HG12      VAL  73   7.320 -17.111  -6.785
    6   HG11  VAL  73          HG13      VAL  73   6.344 -16.629  -5.397
    7   HG22  VAL  73          HG21      VAL  73   9.664 -14.378  -6.771
    8   HG21  VAL  73          HG22      VAL  73   8.517 -15.012  -7.951
    9   HG23  VAL  73          HG23      VAL  73   9.514 -16.119  -7.009

  No H/Q in entry =           9
  In of MODEL   86
    1    H    LEU  74           H        LEU  74   7.131 -13.268  -8.574
    2    HA   LEU  74           HA       LEU  74   9.060 -11.303  -8.081
    3    HB2  LEU  74           HB2      LEU  74   8.616 -12.066 -10.318
    4    HB3  LEU  74           HB3      LEU  74   6.947 -11.507 -10.226
    5    HG   LEU  74           HG       LEU  74   7.736  -9.175 -10.022
    6   HD13  LEU  74          HD11      LEU  74   9.845  -9.355  -8.946
    7   HD12  LEU  74          HD12      LEU  74  10.236  -8.858 -10.591
    8   HD11  LEU  74          HD13      LEU  74  10.429 -10.543 -10.109
    9   HD23  LEU  74          HD21      LEU  74   9.240 -10.267 -12.340
   10   HD22  LEU  74          HD22      LEU  74   8.078  -8.963 -12.257
   11   HD21  LEU  74          HD23      LEU  74   7.516 -10.620 -12.237

  No H/Q in entry =          11
  In of MODEL   86
    1    H    VAL  75           H        VAL  75   5.563 -10.945  -8.450
    2    HA   VAL  75           HA       VAL  75   5.444  -8.187  -7.874
    3    HB   VAL  75           HB       VAL  75   3.368 -10.343  -7.483
    4   HG12  VAL  75          HG11      VAL  75   1.774  -8.389  -7.413
    5   HG11  VAL  75          HG12      VAL  75   3.163  -7.314  -7.353
    6   HG13  VAL  75          HG13      VAL  75   2.863  -8.430  -6.030
    7   HG21  VAL  75          HG21      VAL  75   3.904  -8.275  -9.641
    8   HG23  VAL  75          HG22      VAL  75   2.461  -9.284  -9.574
    9   HG22  VAL  75          HG23      VAL  75   4.044 -10.023  -9.811

  No H/Q in entry =           9
  In of MODEL   86
    1    H    GLU  76           H        GLU  76   5.202 -11.058  -5.755
    2    HA   GLU  76           HA       GLU  76   4.712  -9.691  -3.341
    3    HB2  GLU  76           HB2      GLU  76   4.576 -12.175  -3.608
    4    HB3  GLU  76           HB3      GLU  76   6.324 -12.234  -3.759
    5    HG2  GLU  76           HG2      GLU  76   6.578 -11.350  -1.478
    6    HG3  GLU  76           HG3      GLU  76   4.837 -11.233  -1.299

  No H/Q in entry =           6
  In of MODEL   86
    1    H    ALA  77           H        ALA  77   7.785 -10.582  -4.887
    2    HA   ALA  77           HA       ALA  77   9.458  -9.519  -2.867
    3    HB3  ALA  77           HB1      ALA  77  10.149  -9.643  -5.803
    4    HB1  ALA  77           HB2      ALA  77  10.123 -11.073  -4.772
    5    HB2  ALA  77           HB3      ALA  77  11.243  -9.755  -4.424

  No H/Q in entry =           5
  In of MODEL   86
    1    H    GLN  78           H        GLN  78   8.069  -8.123  -5.793
    2    HA   GLN  78           HA       GLN  78   9.404  -5.634  -5.692
    3    HB2  GLN  78           HB2      GLN  78   8.124  -6.564  -7.653
    4    HB3  GLN  78           HB3      GLN  78   6.634  -6.195  -6.786
    5    HG2  GLN  78           HG2      GLN  78   7.260  -3.820  -6.701
    6    HG3  GLN  78           HG3      GLN  78   8.763  -4.177  -7.552
    7   HE21  GLN  78          HE21      GLN  78   6.852  -2.378  -8.684
    8   HE22  GLN  78          HE22      GLN  78   6.182  -3.105 -10.064

  No H/Q in entry =           8
  In of MODEL   86
    1    H    LEU  79           H        LEU  79   6.386  -6.786  -4.272
    2    HA   LEU  79           HA       LEU  79   5.371  -4.382  -3.277
    3    HB2  LEU  79           HB2      LEU  79   4.070  -6.442  -3.220
    4    HB3  LEU  79           HB3      LEU  79   5.214  -7.169  -2.096
    5    HG   LEU  79           HG       LEU  79   4.642  -5.524  -0.379
    6   HD13  LEU  79          HD11      LEU  79   4.169  -3.517  -1.439
    7   HD12  LEU  79          HD12      LEU  79   2.544  -4.051  -1.006
    8   HD11  LEU  79          HD13      LEU  79   3.135  -4.276  -2.651
    9   HD23  LEU  79          HD21      LEU  79   2.058  -6.033  -0.300
   10   HD22  LEU  79          HD22      LEU  79   3.206  -7.364  -0.180
   11   HD21  LEU  79          HD23      LEU  79   2.398  -7.039  -1.710

  No H/Q in entry =          11
  In of MODEL   86
    1    H    HIS  80           H        HIS  80   7.560  -6.697  -1.674
    2    HA   HIS  80           HA       HIS  80   7.826  -5.144   0.690
    3    HB2  HIS  80           HB2      HIS  80   9.186  -7.503  -0.492
    4    HB3  HIS  80           HB3      HIS  80  10.084  -6.596   0.726
    5    HD1  HIS  80           HD1      HIS  80   9.585  -7.226   3.068
    6    HD2  HIS  80           HD2      HIS  80   6.387  -8.107   0.543
    7    HE1  HIS  80           HE1      HIS  80   7.812  -8.335   4.512
    8    HE2  HIS  80           HE2      HIS  80   5.857  -8.876   2.980

  No H/Q in entry =           8
  In of MODEL   86
    1    H    LEU  81           H        LEU  81   9.849  -5.418  -2.210
    2    HA   LEU  81           HA       LEU  81  11.877  -3.661  -1.328
    3    HB2  LEU  81           HB2      LEU  81  10.976  -4.470  -4.093
    4    HB3  LEU  81           HB3      LEU  81  12.389  -3.454  -3.798
    5    HG   LEU  81           HG       LEU  81  12.005  -6.173  -2.516
    6   HD12  LEU  81          HD11      LEU  81  13.835  -6.795  -4.254
    7   HD11  LEU  81          HD12      LEU  81  13.265  -5.378  -5.134
    8   HD13  LEU  81          HD13      LEU  81  12.160  -6.708  -4.797
    9   HD23  LEU  81          HD21      LEU  81  14.632  -5.842  -2.489
   10   HD22  LEU  81          HD22      LEU  81  13.638  -5.083  -1.247
   11   HD21  LEU  81          HD23      LEU  81  14.219  -4.133  -2.615

  No H/Q in entry =          11
  In of MODEL   86
    1    H    MET  82           H        MET  82   8.962  -3.049  -3.283
    2    HA   MET  82           HA       MET  82   9.489  -0.323  -3.792
    3    HB2  MET  82           HB2      MET  82   6.938  -1.931  -3.675
    4    HB3  MET  82           HB3      MET  82   6.930  -0.208  -4.045
    5    HG2  MET  82           HG2      MET  82   8.550  -2.278  -5.564
    6    HG3  MET  82           HG3      MET  82   6.983  -1.666  -6.087
    7    HE3  MET  82           HE1      MET  82   7.418   1.786  -7.270
    8    HE2  MET  82           HE2      MET  82   7.035   1.565  -5.565
    9    HE1  MET  82           HE3      MET  82   6.383   0.447  -6.759

  No H/Q in entry =           9
  In of MODEL   86
    1    H    THR  83           H        THR  83   7.691  -1.921  -1.190
    2    HA   THR  83           HA       THR  83   6.820   0.428   0.122
    3    HB   THR  83           HB       THR  83   6.683  -1.139   2.145
    4    HG1  THR  83           HG1      THR  83   7.452  -3.086   1.928
    5   HG22  THR  83          HG21      THR  83   5.046  -2.720   0.674
    6   HG21  THR  83          HG22      THR  83   5.272  -1.394  -0.462
    7   HG23  THR  83          HG23      THR  83   4.621  -1.076   1.147

  No H/Q in entry =           7
  In of MODEL   86
    1    H    SER  84           H        SER  84   9.652  -1.653   0.667
    2    HA   SER  84           HA       SER  84  10.691  -0.208   2.856
    3    HB2  SER  84           HB2      SER  84  11.966  -2.052   0.845
    4    HB3  SER  84           HB3      SER  84  12.901  -1.289   2.129
    5    HG   SER  84           HG       SER  84  10.633  -2.989   2.382

  No H/Q in entry =           5
  In of MODEL   86
    1    H    MET  85           H        MET  85  11.463   0.043  -0.629
    2    HA   MET  85           HA       MET  85  13.450   2.019  -0.374
    3    HB2  MET  85           HB2      MET  85  13.073   0.729  -2.437
    4    HB3  MET  85           HB3      MET  85  11.542   1.570  -2.678
    5    HG2  MET  85           HG2      MET  85  12.720   3.721  -2.816
    6    HG3  MET  85           HG3      MET  85  14.255   2.912  -2.518
    7    HE3  MET  85           HE1      MET  85  11.232   1.586  -5.080
    8    HE2  MET  85           HE2      MET  85  11.591   2.912  -6.183
    9    HE1  MET  85           HE3      MET  85  11.196   3.260  -4.505

  No H/Q in entry =           9
  In of MODEL   86
    1    H    LEU  86           H        LEU  86   9.961   2.335  -0.904
    2    HA   LEU  86           HA       LEU  86   9.885   5.147  -1.097
    3    HB2  LEU  86           HB2      LEU  86   8.052   3.476  -1.677
    4    HB3  LEU  86           HB3      LEU  86   7.713   3.391   0.051
    5    HG   LEU  86           HG       LEU  86   7.540   5.951  -0.012
    6   HD11  LEU  86          HD11      LEU  86   8.333   5.509  -2.708
    7   HD13  LEU  86          HD12      LEU  86   7.886   7.037  -1.956
    8   HD12  LEU  86          HD13      LEU  86   6.659   6.065  -2.764
    9   HD23  LEU  86          HD21      LEU  86   5.422   4.582  -1.681
   10   HD22  LEU  86          HD22      LEU  86   5.219   5.846  -0.471
   11   HD21  LEU  86          HD23      LEU  86   5.624   4.205   0.030

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ALA  87           H        ALA  87   9.414   2.977   1.654
    2    HA   ALA  87           HA       ALA  87   8.845   4.896   3.613
    3    HB1  ALA  87           HB1      ALA  87   9.666   2.079   3.542
    4    HB3  ALA  87           HB2      ALA  87   8.531   2.890   4.619
    5    HB2  ALA  87           HB3      ALA  87  10.257   2.931   4.972

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ARG  88           H        ARG  88  11.941   3.482   2.655
    2    HA   ARG  88           HA       ARG  88  13.534   4.874   4.491
    3    HB2  ARG  88           HB2      ARG  88  14.219   2.898   3.099
    4    HB3  ARG  88           HB3      ARG  88  14.374   3.986   1.723
    5    HG2  ARG  88           HG2      ARG  88  15.830   5.314   3.672
    6    HG3  ARG  88           HG3      ARG  88  16.156   3.628   4.059
    7    HD2  ARG  88           HD2      ARG  88  17.435   3.330   2.221
    8    HD3  ARG  88           HD3      ARG  88  16.300   4.192   1.178
    9    HE   ARG  88           HE       ARG  88  18.684   5.271   2.234
   10   HH21  ARG  88          HH11      ARG  88  19.020   7.490   2.033
   11   HH22  ARG  88          HH12      ARG  88  17.665   8.555   1.878
   12   HH11  ARG  88          HH21      ARG  88  15.343   6.008   1.935
   13   HH12  ARG  88          HH22      ARG  88  15.582   7.713   1.798

  No H/Q in entry =          13
  In of MODEL   86
    1    H    GLU  89           H        GLU  89  12.574   5.755   1.159
    2    HA   GLU  89           HA       GLU  89  14.112   8.121   1.002
    3    HB2  GLU  89           HB2      GLU  89  12.982   7.067  -0.948
    4    HB3  GLU  89           HB3      GLU  89  11.432   7.604  -0.301
    5    HG2  GLU  89           HG2      GLU  89  12.124   9.944  -0.468
    6    HG3  GLU  89           HG3      GLU  89  13.733   9.459  -0.995

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LEU  90           H        LEU  90  10.779   7.601   2.116
    2    HA   LEU  90           HA       LEU  90  10.248  10.334   2.678
    3    HB2  LEU  90           HB2      LEU  90   9.060   7.759   3.708
    4    HB3  LEU  90           HB3      LEU  90   8.419   9.353   4.122
    5    HG   LEU  90           HG       LEU  90   8.857   8.464   1.259
    6   HD12  LEU  90          HD11      LEU  90   6.324   8.124   1.309
    7   HD11  LEU  90          HD12      LEU  90   6.470   8.121   3.066
    8   HD13  LEU  90          HD13      LEU  90   7.299   6.892   2.111
    9   HD22  LEU  90          HD21      LEU  90   8.553  10.771   1.174
   10   HD21  LEU  90          HD22      LEU  90   7.559  10.804   2.629
   11   HD23  LEU  90          HD23      LEU  90   6.872  10.240   1.106

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  91           H        ILE  91  11.513   7.666   4.617
    2    HA   ILE  91           HA       ILE  91  11.634   9.041   7.080
    3    HB   ILE  91           HB       ILE  91  13.205   6.705   5.974
    4   HG12  ILE  91          HG12      ILE  91  11.176   6.872   8.222
    5   HG13  ILE  91          HG13      ILE  91  10.715   6.582   6.545
    6   HG22  ILE  91          HG21      ILE  91  13.662   6.504   8.618
    7   HG21  ILE  91          HG22      ILE  91  13.578   8.262   8.510
    8   HG23  ILE  91          HG23      ILE  91  14.766   7.376   7.555
    9   HD13  ILE  91          HD11      ILE  91  11.728   4.485   6.488
   10   HD12  ILE  91          HD12      ILE  91  11.126   4.547   8.145
   11   HD11  ILE  91          HD13      ILE  91  12.827   4.867   7.814

  No H/Q in entry =          11
  In of MODEL   86
    1    H    THR  92           H        THR  92  13.866   8.871   4.341
    2    HA   THR  92           HA       THR  92  16.019  10.279   5.506
    3    HB   THR  92           HB       THR  92  15.049  10.138   2.641
    4    HG1  THR  92           HG1      THR  92  15.887   8.247   3.057
    5   HG22  THR  92          HG21      THR  92  17.617  10.839   2.358
    6   HG21  THR  92          HG22      THR  92  17.297  11.665   3.883
    7   HG23  THR  92          HG23      THR  92  16.332  12.042   2.456

  No H/Q in entry =           7
  In of MODEL   86
    1    H    GLU  93           H        GLU  93  13.136  11.412   3.758
    2    HA   GLU  93           HA       GLU  93  13.717  14.176   3.865
    3    HB2  GLU  93           HB2      GLU  93  11.019  12.791   3.870
    4    HB3  GLU  93           HB3      GLU  93  11.301  14.491   3.493
    5    HG2  GLU  93           HG2      GLU  93  12.657  12.249   1.981
    6    HG3  GLU  93           HG3      GLU  93  11.110  12.922   1.483

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LEU  94           H        LEU  94  11.973  12.020   6.075
    2    HA   LEU  94           HA       LEU  94  11.145  13.970   7.940
    3    HB2  LEU  94           HB2      LEU  94  11.733  11.019   8.228
    4    HB3  LEU  94           HB3      LEU  94  11.150  11.997   9.572
    5    HG   LEU  94           HG       LEU  94   9.679  12.032   6.935
    6   HD11  LEU  94          HD11      LEU  94   9.762   9.819   8.949
    7   HD13  LEU  94          HD12      LEU  94   9.470   9.750   7.212
    8   HD12  LEU  94          HD13      LEU  94   8.183  10.264   8.302
    9   HD23  LEU  94          HD21      LEU  94   7.750  12.429   8.524
   10   HD22  LEU  94          HD22      LEU  94   8.983  13.689   8.563
   11   HD21  LEU  94          HD23      LEU  94   8.919  12.476   9.841

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  95           H        ILE  95  14.129  12.054   7.725
    2    HA   ILE  95           HA       ILE  95  15.280  12.990  10.141
    3    HB   ILE  95           HB       ILE  95  16.537  11.917   7.604
    4   HG12  ILE  95          HG12      ILE  95  16.233  10.726  10.374
    5   HG13  ILE  95          HG13      ILE  95  15.074  10.457   9.074
    6   HG21  ILE  95          HG21      ILE  95  17.775  12.740  10.249
    7   HG23  ILE  95          HG22      ILE  95  18.243  13.264   8.630
    8   HG22  ILE  95          HG23      ILE  95  18.555  11.607   9.146
    9   HD13  ILE  95          HD11      ILE  95  16.566   9.180   7.824
   10   HD12  ILE  95          HD12      ILE  95  17.033   8.740   9.463
   11   HD11  ILE  95          HD13      ILE  95  17.985   9.920   8.565

  No H/Q in entry =          11
  In of MODEL   86
    1    H    GLU  96           H        GLU  96  15.446  14.212   6.803
    2    HA   GLU  96           HA       GLU  96  17.280  16.300   7.281
    3    HB2  GLU  96           HB2      GLU  96  16.630  15.627   5.021
    4    HB3  GLU  96           HB3      GLU  96  14.983  16.177   5.311
    5    HG2  GLU  96           HG2      GLU  96  15.542  18.307   4.764
    6    HG3  GLU  96           HG3      GLU  96  16.835  18.318   5.952

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LEU  97           H        LEU  97  13.768  16.099   7.694
    2    HA   LEU  97           HA       LEU  97  13.336  18.833   8.324
    3    HB2  LEU  97           HB2      LEU  97  11.826  16.303   8.940
    4    HB3  LEU  97           HB3      LEU  97  11.303  17.850   9.603
    5    HG   LEU  97           HG       LEU  97  11.802  17.425   6.642
    6   HD12  LEU  97          HD11      LEU  97   9.280  17.285   6.512
    7   HD11  LEU  97          HD12      LEU  97   9.266  17.092   8.263
    8   HD13  LEU  97          HD13      LEU  97  10.057  15.884   7.249
    9   HD23  LEU  97          HD21      LEU  97  10.055  19.381   6.659
   10   HD22  LEU  97          HD22      LEU  97  11.733  19.750   7.058
   11   HD21  LEU  97          HD23      LEU  97  10.539  19.579   8.343

  No H/Q in entry =          11
  In of MODEL   86
    1    H    HIS  98           H        HIS  98  14.161  16.018  10.334
    2    HA   HIS  98           HA       HIS  98  13.985  17.288  12.844
    3    HB2  HIS  98           HB2      HIS  98  15.750  15.035  11.860
    4    HB3  HIS  98           HB3      HIS  98  15.738  15.580  13.539
    5    HD1  HIS  98           HD1      HIS  98  13.558  13.930  10.942
    6    HD2  HIS  98           HD2      HIS  98  13.428  14.865  15.003
    7    HE1  HIS  98           HE1      HIS  98  11.534  12.730  11.889
    8    HE2  HIS  98           HE2      HIS  98  11.435  13.291  14.358

  No H/Q in entry =           8
  In of MODEL   86
    1    H    GLU  99           H        GLU  99  16.551  17.175  10.422
    2    HA   GLU  99           HA       GLU  99  18.523  18.521  11.956
    3    HB2  GLU  99           HB2      GLU  99  19.018  17.228   9.894
    4    HB3  GLU  99           HB3      GLU  99  18.207  18.476   8.944
    5    HG2  GLU  99           HG2      GLU  99  19.804  20.156   9.736
    6    HG3  GLU  99           HG3      GLU  99  20.584  18.961  10.767

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LYS 100           H        LYS 100  16.005  19.664   9.723
    2    HA   LYS 100           HA       LYS 100  16.790  22.405   9.861
    3    HB2  LYS 100           HB2      LYS 100  14.166  21.103   9.098
    4    HB3  LYS 100           HB3      LYS 100  14.459  22.842   9.003
    5    HG2  LYS 100           HG2      LYS 100  16.440  22.396   7.547
    6    HG3  LYS 100           HG3      LYS 100  16.034  20.677   7.569
    7    HD2  LYS 100           HD2      LYS 100  13.841  21.174   6.557
    8    HD3  LYS 100           HD3      LYS 100  14.231  22.895   6.542
    9    HE2  LYS 100           HE2      LYS 100  16.198  22.417   5.093
   10    HE3  LYS 100           HE3      LYS 100  15.740  20.710   5.064
   11    HZ1  LYS 100           HZ1      LYS 100  13.910  22.892   4.212
   12    HZ3  LYS 100           HZ2      LYS 100  13.734  21.221   3.955
   13    HZ2  LYS 100           HZ3      LYS 100  14.945  22.085   3.137

  No H/Q in entry =          13
  In of MODEL   86
    1    H    LEU 101           H        LEU 101  14.692  20.358  11.823
    2    HA   LEU 101           HA       LEU 101  13.510  22.427  13.389
    3    HB2  LEU 101           HB2      LEU 101  13.962  19.481  13.785
    4    HB3  LEU 101           HB3      LEU 101  13.416  20.464  15.140
    5    HG   LEU 101           HG       LEU 101  12.010  20.537  12.464
    6   HD12  LEU 101          HD11      LEU 101  10.351  18.971  13.731
    7   HD11  LEU 101          HD12      LEU 101  11.742  18.567  14.734
    8   HD13  LEU 101          HD13      LEU 101  11.785  18.255  12.998
    9   HD21  LEU 101          HD21      LEU 101  11.336  21.338  15.310
   10   HD23  LEU 101          HD22      LEU 101  10.082  21.103  14.095
   11   HD22  LEU 101          HD23      LEU 101  11.313  22.342  13.858

  No H/Q in entry =          11
  In of MODEL   86
    1    H    LYS 102           H        LYS 102  16.662  21.830  12.969
    2    HA   LYS 102           HA       LYS 102  18.500  22.712  14.047
    3    HB2  LYS 102           HB2      LYS 102  16.675  24.224  15.166
    4    HB3  LYS 102           HB3      LYS 102  16.879  23.167  16.548
    5    HG2  LYS 102           HG2      LYS 102  18.770  25.181  15.380
    6    HG3  LYS 102           HG3      LYS 102  18.382  24.871  17.059
    7    HD2  LYS 102           HD2      LYS 102  20.064  22.959  15.388
    8    HD3  LYS 102           HD3      LYS 102  20.744  24.287  16.319
    9    HE2  LYS 102           HE2      LYS 102  20.351  21.740  17.295
   10    HE3  LYS 102           HE3      LYS 102  20.559  23.187  18.282
   11    HZ2  LYS 102           HZ1      LYS 102  18.592  21.897  18.895
   12    HZ1  LYS 102           HZ2      LYS 102  17.955  22.120  17.343
   13    HZ3  LYS 102           HZ3      LYS 102  18.175  23.454  18.365

  No H/Q in entry =          13
  In of MODEL   86
    1    H    ALA 103           H        ALA 103  16.423  21.107  16.465
    2    HA   ALA 103           HA       ALA 103  18.147  19.909  18.132
    3    HB2  ALA 103           HB1      ALA 103  16.570  17.895  18.126
    4    HB1  ALA 103           HB2      ALA 103  15.677  18.741  16.862
    5    HB3  ALA 103           HB3      ALA 103  15.845  19.468  18.458

  No H/Q in entry =           5
  In of MODEL   86
    1    H1   ALA   1           H3       ALA   1  -1.501  -7.158 -21.484
    2    H2   ALA   1           H2       ALA   1  -2.292  -8.594 -21.030
    3    H3   ALA   1           H1       ALA   1  -0.682  -8.641 -21.577
    4    HA   ALA   1           HA       ALA   1  -1.505  -9.120 -23.575
    5    HB1  ALA   1           HB1      ALA   1  -3.642  -9.843 -23.109
    6    HB2  ALA   1           HB2      ALA   1  -4.081  -8.337 -23.914
    7    HB3  ALA   1           HB3      ALA   1  -4.029  -8.411 -22.155

  No H/Q in entry =           7
  In of MODEL   86
    1    H    GLU   2           H        GLU   2  -2.329  -7.939 -25.573
    2    HA   GLU   2           HA       GLU   2  -0.932  -5.924 -26.451
    3    HB2  GLU   2           HB2      GLU   2  -3.938  -6.001 -26.782
    4    HB3  GLU   2           HB3      GLU   2  -2.815  -5.139 -27.830
    5    HG2  GLU   2           HG2      GLU   2  -2.300  -7.031 -28.976
    6    HG3  GLU   2           HG3      GLU   2  -2.007  -7.930 -27.493

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLU   3           H        GLU   3  -4.101  -4.674 -25.570
    2    HA   GLU   3           HA       GLU   3  -3.065  -2.112 -24.945
    3    HB2  GLU   3           HB2      GLU   3  -5.751  -3.434 -24.622
    4    HB3  GLU   3           HB3      GLU   3  -5.461  -1.816 -23.980
    5    HG2  GLU   3           HG2      GLU   3  -5.097  -0.895 -26.107
    6    HG3  GLU   3           HG3      GLU   3  -4.694  -2.451 -26.824

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LEU   4           H        LEU   4  -4.659  -4.469 -22.765
    2    HA   LEU   4           HA       LEU   4  -4.310  -3.231 -20.377
    3    HB2  LEU   4           HB2      LEU   4  -3.756  -6.172 -20.834
    4    HB3  LEU   4           HB3      LEU   4  -4.172  -5.422 -19.294
    5    HG   LEU   4           HG       LEU   4  -5.932  -5.510 -21.767
    6   HD13  LEU   4          HD11      LEU   4  -7.125  -7.228 -20.769
    7   HD12  LEU   4          HD12      LEU   4  -6.649  -6.761 -19.137
    8   HD11  LEU   4          HD13      LEU   4  -5.505  -7.604 -20.180
    9   HD23  LEU   4          HD21      LEU   4  -7.628  -4.697 -19.910
   10   HD22  LEU   4          HD22      LEU   4  -6.589  -3.526 -20.720
   11   HD21  LEU   4          HD23      LEU   4  -6.169  -4.109 -19.110

  No H/Q in entry =          11
  In of MODEL   86
    1    H    GLU   5           H        GLU   5  -1.798  -5.072 -22.089
    2    HA   GLU   5           HA       GLU   5   0.175  -4.776 -20.044
    3    HB2  GLU   5           HB2      GLU   5   0.132  -5.705 -22.881
    4    HB3  GLU   5           HB3      GLU   5   1.689  -5.239 -22.196
    5    HG2  GLU   5           HG2      GLU   5  -0.057  -6.991 -20.533
    6    HG3  GLU   5           HG3      GLU   5   0.709  -7.726 -21.940

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLU   6           H        GLU   6  -0.451  -3.074 -23.097
    2    HA   GLU   6           HA       GLU   6   1.712  -1.235 -22.825
    3    HB2  GLU   6           HB2      GLU   6  -0.845  -1.135 -24.442
    4    HB3  GLU   6           HB3      GLU   6   0.436   0.073 -24.557
    5    HG2  GLU   6           HG2      GLU   6   0.826  -2.896 -25.020
    6    HG3  GLU   6           HG3      GLU   6   0.628  -1.704 -26.301

  No H/Q in entry =           6
  In of MODEL   86
    1    H    VAL   7           H        VAL   7  -1.631  -1.313 -21.796
    2    HA   VAL   7           HA       VAL   7  -1.865   1.401 -20.970
    3    HB   VAL   7           HB       VAL   7  -3.323  -1.118 -20.132
    4   HG11  VAL   7          HG11      VAL   7  -3.711   1.772 -19.330
    5   HG13  VAL   7          HG12      VAL   7  -3.613   0.352 -18.290
    6   HG12  VAL   7          HG13      VAL   7  -5.041   0.613 -19.290
    7   HG21  VAL   7          HG21      VAL   7  -3.472  -0.050 -22.525
    8   HG23  VAL   7          HG22      VAL   7  -4.425   1.199 -21.722
    9   HG22  VAL   7          HG23      VAL   7  -4.966  -0.480 -21.692

  No H/Q in entry =           9
  In of MODEL   86
    1    H    VAL   8           H        VAL   8  -0.876  -1.575 -19.312
    2    HA   VAL   8           HA       VAL   8  -0.574  -0.486 -16.719
    3    HB   VAL   8           HB       VAL   8   0.839  -2.804 -18.063
    4   HG11  VAL   8          HG11      VAL   8   0.962  -1.691 -15.268
    5   HG13  VAL   8          HG12      VAL   8   2.276  -2.277 -16.289
    6   HG12  VAL   8          HG13      VAL   8   1.166  -3.421 -15.535
    7   HG23  VAL   8          HG21      VAL   8  -1.134  -3.228 -15.869
    8   HG22  VAL   8          HG22      VAL   8  -0.926  -4.110 -17.378
    9   HG21  VAL   8          HG23      VAL   8  -1.817  -2.594 -17.365

  No H/Q in entry =           9
  In of MODEL   86
    1    H    MET   9           H        MET   9   1.689  -0.789 -19.454
    2    HA   MET   9           HA       MET   9   3.966   0.264 -18.185
    3    HB2  MET   9           HB2      MET   9   3.033   0.291 -21.055
    4    HB3  MET   9           HB3      MET   9   4.551   1.044 -20.568
    5    HG2  MET   9           HG2      MET   9   5.285  -1.109 -19.579
    6    HG3  MET   9           HG3      MET   9   3.782  -1.856 -20.122
    7    HE2  MET   9           HE1      MET   9   7.546  -1.222 -21.317
    8    HE1  MET   9           HE2      MET   9   6.665   0.253 -20.934
    9    HE3  MET   9           HE3      MET   9   7.149  -0.070 -22.596

  No H/Q in entry =           9
  In of MODEL   86
    1    H    GLY  10           H        GLY  10   1.286   1.854 -19.881
    2    HA3  GLY  10           HA2      GLY  10   2.242   4.511 -19.640
    3    HA2  GLY  10           HA3      GLY  10   0.555   4.046 -19.851

  No H/Q in entry =           3
  In of MODEL   86
    1    H    LEU  11           H        LEU  11   0.148   2.525 -17.562
    2    HA   LEU  11           HA       LEU  11  -0.395   4.507 -15.611
    3    HB2  LEU  11           HB2      LEU  11  -0.322   1.492 -15.445
    4    HB3  LEU  11           HB3      LEU  11  -0.840   2.518 -14.108
    5    HG   LEU  11           HG       LEU  11  -2.066   2.621 -16.878
    6   HD13  LEU  11          HD11      LEU  11  -2.649   0.479 -16.118
    7   HD12  LEU  11          HD12      LEU  11  -4.004   1.470 -15.582
    8   HD11  LEU  11          HD13      LEU  11  -2.752   0.996 -14.435
    9   HD22  LEU  11          HD21      LEU  11  -2.665   4.639 -15.880
   10   HD21  LEU  11          HD22      LEU  11  -2.596   3.978 -14.247
   11   HD23  LEU  11          HD23      LEU  11  -3.966   3.606 -15.294

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  12           H        ILE  12   2.153   2.045 -15.835
    2    HA   ILE  12           HA       ILE  12   3.347   2.593 -13.328
    3    HB   ILE  12           HB       ILE  12   4.615   1.548 -15.881
    4   HG12  ILE  12          HG12      ILE  12   2.596   0.320 -14.736
    5   HG13  ILE  12          HG13      ILE  12   3.994  -0.615 -15.229
    6   HG22  ILE  12          HG21      ILE  12   6.271   0.516 -14.262
    7   HG21  ILE  12          HG22      ILE  12   5.576   1.536 -13.002
    8   HG23  ILE  12          HG23      ILE  12   6.368   2.271 -14.395
    9   HD12  ILE  12          HD11      ILE  12   3.146  -1.166 -12.940
   10   HD11  ILE  12          HD12      ILE  12   3.539   0.479 -12.442
   11   HD13  ILE  12          HD13      ILE  12   4.811  -0.614 -12.943

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  13           H        ILE  13   3.960   3.847 -16.586
    2    HA   ILE  13           HA       ILE  13   6.091   5.573 -15.858
    3    HB   ILE  13           HB       ILE  13   4.070   5.642 -18.112
    4   HG12  ILE  13          HG12      ILE  13   5.908   3.807 -17.822
    5   HG13  ILE  13          HG13      ILE  13   5.672   4.545 -19.402
    6   HG22  ILE  13          HG21      ILE  13   5.764   7.233 -19.196
    7   HG21  ILE  13          HG22      ILE  13   6.432   7.470 -17.585
    8   HG23  ILE  13          HG23      ILE  13   4.760   7.920 -17.917
    9   HD11  ILE  13          HD11      ILE  13   7.749   5.517 -17.404
   10   HD13  ILE  13          HD12      ILE  13   7.572   5.998 -19.087
   11   HD12  ILE  13          HD13      ILE  13   8.088   4.362 -18.692

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ASN  14           H        ASN  14   2.585   6.061 -16.142
    2    HA   ASN  14           HA       ASN  14   2.535   8.809 -15.514
    3    HB2  ASN  14           HB2      ASN  14   0.648   7.161 -16.347
    4    HB3  ASN  14           HB3      ASN  14   0.320   6.987 -14.627
    5   HD21  ASN  14          HD21      ASN  14  -1.696   8.135 -16.072
    6   HD22  ASN  14          HD22      ASN  14  -1.762   9.809 -15.810

  No H/Q in entry =           6
  In of MODEL   86
    1    H    SER  15           H        SER  15   2.236   5.938 -13.429
    2    HA   SER  15           HA       SER  15   1.917   7.315 -10.986
    3    HB2  SER  15           HB2      SER  15   2.465   5.234  -9.928
    4    HB3  SER  15           HB3      SER  15   1.643   4.808 -11.426
    5    HG   SER  15           HG       SER  15   4.022   4.057 -10.662

  No H/Q in entry =           5
  In of MODEL   86
    1    H    GLY  16           H        GLY  16   4.802   6.219 -12.730
    2    HA3  GLY  16           HA2      GLY  16   6.718   6.986 -10.794
    3    HA2  GLY  16           HA3      GLY  16   7.028   6.778 -12.516

  No H/Q in entry =           3
  In of MODEL   86
    1    H    GLN  17           H        GLN  17   5.339   8.729 -13.592
    2    HA   GLN  17           HA       GLN  17   6.909  11.075 -13.285
    3    HB2  GLN  17           HB2      GLN  17   5.598  10.586 -15.330
    4    HB3  GLN  17           HB3      GLN  17   4.106  10.804 -14.415
    5    HG2  GLN  17           HG2      GLN  17   4.784  13.133 -13.893
    6    HG3  GLN  17           HG3      GLN  17   6.237  12.912 -14.867
    7   HE21  GLN  17          HE21      GLN  17   5.810  14.216 -16.690
    8   HE22  GLN  17          HE22      GLN  17   4.428  14.057 -17.663

  No H/Q in entry =           8
  In of MODEL   86
    1    H    ALA  18           H        ALA  18   3.806  10.053 -11.945
    2    HA   ALA  18           HA       ALA  18   3.069  12.444 -10.690
    3    HB1  ALA  18           HB1      ALA  18   1.947   9.983 -10.909
    4    HB2  ALA  18           HB2      ALA  18   1.391  11.206  -9.768
    5    HB3  ALA  18           HB3      ALA  18   2.482   9.928  -9.230

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ARG  19           H        ARG  19   4.945   9.691  -9.394
    2    HA   ARG  19           HA       ARG  19   5.464  10.858  -6.874
    3    HB2  ARG  19           HB2      ARG  19   5.888   8.455  -7.391
    4    HB3  ARG  19           HB3      ARG  19   7.246   8.942  -8.408
    5    HG2  ARG  19           HG2      ARG  19   8.355   9.992  -6.485
    6    HG3  ARG  19           HG3      ARG  19   6.976   9.603  -5.457
    7    HD2  ARG  19           HD2      ARG  19   8.742   7.974  -5.087
    8    HD3  ARG  19           HD3      ARG  19   7.373   7.185  -5.876
    9    HE   ARG  19           HE       ARG  19   9.084   8.003  -7.919
   10   HH21  ARG  19          HH11      ARG  19  10.652   6.600  -8.758
   11   HH22  ARG  19          HH12      ARG  19  11.199   5.257  -7.816
   12   HH11  ARG  19          HH21      ARG  19   9.151   5.982  -5.133
   13   HH12  ARG  19          HH22      ARG  19  10.345   4.907  -5.762

  No H/Q in entry =          13
  In of MODEL   86
    1    H    SER  20           H        SER  20   7.294  10.884  -9.915
    2    HA   SER  20           HA       SER  20   9.530  12.311  -9.086
    3    HB2  SER  20           HB2      SER  20   9.320  11.313 -11.331
    4    HB3  SER  20           HB3      SER  20   8.108  12.518 -11.749
    5    HG   SER  20           HG       SER  20  10.707  13.176 -10.835

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LEU  21           H        LEU  21   6.431  13.564 -10.301
    2    HA   LEU  21           HA       LEU  21   7.090  16.313 -10.082
    3    HB2  LEU  21           HB2      LEU  21   4.426  14.880 -10.007
    4    HB3  LEU  21           HB3      LEU  21   4.588  16.634 -10.020
    5    HG   LEU  21           HG       LEU  21   5.792  14.827 -12.137
    6   HD13  LEU  21          HD11      LEU  21   3.900  15.522 -13.559
    7   HD12  LEU  21          HD12      LEU  21   3.206  16.413 -12.204
    8   HD11  LEU  21          HD13      LEU  21   3.329  14.656 -12.133
    9   HD21  LEU  21          HD21      LEU  21   5.581  17.802 -11.721
   10   HD23  LEU  21          HD22      LEU  21   5.568  17.185 -13.371
   11   HD22  LEU  21          HD23      LEU  21   6.946  16.869 -12.329

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ALA  22           H        ALA  22   5.578  14.025  -7.833
    2    HA   ALA  22           HA       ALA  22   4.959  15.837  -5.775
    3    HB3  ALA  22           HB1      ALA  22   4.209  13.441  -5.933
    4    HB2  ALA  22           HB2      ALA  22   4.788  13.920  -4.337
    5    HB1  ALA  22           HB3      ALA  22   5.820  12.963  -5.401

  No H/Q in entry =           5
  In of MODEL   86
    1    H    TYR  23           H        TYR  23   7.904  13.823  -6.194
    2    HA   TYR  23           HA       TYR  23   9.272  14.856  -3.939
    3    HB2  TYR  23           HB2      TYR  23  10.074  12.848  -5.086
    4    HB3  TYR  23           HB3      TYR  23  10.388  13.783  -6.549
    5    HD1  TYR  23           HD1      TYR  23  11.336  13.478  -2.949
    6    HD2  TYR  23           HD2      TYR  23  12.423  14.950  -6.836
    7    HE1  TYR  23           HE1      TYR  23  13.589  14.070  -2.096
    8    HE2  TYR  23           HE2      TYR  23  14.674  15.544  -5.982
    9    HH   TYR  23           HH       TYR  23  15.628  14.787  -2.636

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ALA  24           H        ALA  24   9.098  15.951  -7.310
    2    HA   ALA  24           HA       ALA  24  10.982  18.047  -7.063
    3    HB2  ALA  24           HB1      ALA  24  10.548  18.099  -9.274
    4    HB3  ALA  24           HB2      ALA  24   8.988  18.842  -8.923
    5    HB1  ALA  24           HB3      ALA  24   9.123  17.089  -9.047

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ALA  25           H        ALA  25   7.502  17.846  -6.456
    2    HA   ALA  25           HA       ALA  25   7.004  20.563  -5.897
    3    HB1  ALA  25           HB1      ALA  25   5.355  18.554  -6.099
    4    HB2  ALA  25           HB2      ALA  25   4.975  19.845  -4.956
    5    HB3  ALA  25           HB3      ALA  25   5.671  18.330  -4.377

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LEU  26           H        LEU  26   8.079  17.896  -3.834
    2    HA   LEU  26           HA       LEU  26   8.166  19.336  -1.402
    3    HB2  LEU  26           HB2      LEU  26   8.275  16.920  -1.387
    4    HB3  LEU  26           HB3      LEU  26   9.749  16.934  -2.352
    5    HG   LEU  26           HG       LEU  26  10.950  18.065  -0.511
    6   HD12  LEU  26          HD11      LEU  26   9.714  18.073   1.744
    7   HD11  LEU  26          HD12      LEU  26   8.232  17.923   0.804
    8   HD13  LEU  26          HD13      LEU  26   9.268  19.335   0.594
    9   HD21  LEU  26          HD21      LEU  26   9.428  15.591   0.365
   10   HD23  LEU  26          HD22      LEU  26  10.937  16.165   1.066
   11   HD22  LEU  26          HD23      LEU  26  10.902  15.600  -0.602

  No H/Q in entry =          11
  In of MODEL   86
    1    H    LYS  27           H        LYS  27  10.596  18.770  -3.914
    2    HA   LYS  27           HA       LYS  27  12.767  20.029  -2.682
    3    HB2  LYS  27           HB2      LYS  27  12.886  18.676  -4.767
    4    HB3  LYS  27           HB3      LYS  27  12.116  19.999  -5.640
    5    HG2  LYS  27           HG2      LYS  27  13.969  21.499  -5.060
    6    HG3  LYS  27           HG3      LYS  27  14.734  20.215  -4.116
    7    HD2  LYS  27           HD2      LYS  27  14.895  18.822  -6.164
    8    HD3  LYS  27           HD3      LYS  27  14.175  20.132  -7.100
    9    HE2  LYS  27           HE2      LYS  27  16.050  21.613  -6.485
   10    HE3  LYS  27           HE3      LYS  27  16.774  20.307  -5.540
   11    HZ3  LYS  27           HZ1      LYS  27  17.772  20.405  -7.723
   12    HZ2  LYS  27           HZ2      LYS  27  16.250  20.274  -8.469
   13    HZ1  LYS  27           HZ3      LYS  27  16.878  18.971  -7.578

  No H/Q in entry =          13
  In of MODEL   86
    1    H    GLN  28           H        GLN  28  10.144  21.386  -4.646
    2    HA   GLN  28           HA       GLN  28  11.085  24.045  -4.805
    3    HB2  GLN  28           HB2      GLN  28   8.259  22.955  -4.701
    4    HB3  GLN  28           HB3      GLN  28   8.661  24.629  -5.080
    5    HG2  GLN  28           HG2      GLN  28   9.691  22.223  -6.611
    6    HG3  GLN  28           HG3      GLN  28   8.339  23.232  -7.123
    7   HE21  GLN  28          HE21      GLN  28  11.458  22.785  -7.896
    8   HE22  GLN  28          HE22      GLN  28  11.929  24.376  -8.252

  No H/Q in entry =           8
  In of MODEL   86
    1    H    ALA  29           H        ALA  29   9.155  22.348  -2.370
    2    HA   ALA  29           HA       ALA  29   8.584  24.542  -0.698
    3    HB2  ALA  29           HB1      ALA  29   7.860  22.974   0.872
    4    HB1  ALA  29           HB2      ALA  29   9.091  21.796   0.417
    5    HB3  ALA  29           HB3      ALA  29   7.707  22.076  -0.638

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LYS  30           H        LYS  30  11.331  22.294  -0.749
    2    HA   LYS  30           HA       LYS  30  12.632  23.266   1.556
    3    HB2  LYS  30           HB2      LYS  30  13.748  21.979  -0.946
    4    HB3  LYS  30           HB3      LYS  30  14.722  22.350   0.479
    5    HG2  LYS  30           HG2      LYS  30  13.173  20.961   1.857
    6    HG3  LYS  30           HG3      LYS  30  12.297  20.527   0.385
    7    HD2  LYS  30           HD2      LYS  30  14.353  19.552  -0.564
    8    HD3  LYS  30           HD3      LYS  30  15.248  20.000   0.890
    9    HE2  LYS  30           HE2      LYS  30  13.748  18.562   2.243
   10    HE3  LYS  30           HE3      LYS  30  12.883  18.095   0.773
   11    HZ2  LYS  30           HZ1      LYS  30  14.684  16.533   1.547
   12    HZ1  LYS  30           HZ2      LYS  30  15.814  17.727   1.096
   13    HZ3  LYS  30           HZ3      LYS  30  14.788  17.031  -0.071

  No H/Q in entry =          13
  In of MODEL   86
    1    H    GLN  31           H        GLN  31  12.528  24.458  -1.746
    2    HA   GLN  31           HA       GLN  31  14.665  26.368  -1.322
    3    HB2  GLN  31           HB2      GLN  31  12.630  26.392  -3.555
    4    HB3  GLN  31           HB3      GLN  31  14.245  27.100  -3.552
    5    HG2  GLN  31           HG2      GLN  31  14.725  24.409  -2.965
    6    HG3  GLN  31           HG3      GLN  31  13.426  24.341  -4.149
    7   HE21  GLN  31          HE21      GLN  31  16.277  23.568  -4.539
    8   HE22  GLN  31          HE22      GLN  31  16.847  24.541  -5.806

  No H/Q in entry =           8
  In of MODEL   86
    1    H    GLY  32           H        GLY  32  11.587  26.167  -0.188
    2    HA3  GLY  32           HA2      GLY  32  10.415  27.731   1.075
    3    HA2  GLY  32           HA3      GLY  32  11.533  28.973   0.525

  No H/Q in entry =           3
  In of MODEL   86
    1    H    ASP  33           H        ASP  33  10.193  27.050  -1.966
    2    HA   ASP  33           HA       ASP  33   8.515  29.308  -2.836
    3    HB2  ASP  33           HB2      ASP  33   9.632  26.892  -4.266
    4    HB3  ASP  33           HB3      ASP  33   8.475  27.996  -5.005

  No H/Q in entry =           4
  In of MODEL   86
    1    H    PHE  34           H        PHE  34   6.824  28.825  -1.278
    2    HA   PHE  34           HA       PHE  34   5.462  26.343  -1.179
    3    HB2  PHE  34           HB2      PHE  34   4.478  29.126  -0.513
    4    HB3  PHE  34           HB3      PHE  34   3.639  27.630  -0.099
    5    HD1  PHE  34           HD1      PHE  34   5.866  30.050   1.115
    6    HD2  PHE  34           HD2      PHE  34   5.217  25.804   1.074
    7    HE1  PHE  34           HE1      PHE  34   7.250  29.816   3.158
    8    HE2  PHE  34           HE2      PHE  34   6.604  25.574   3.115
    9    HZ   PHE  34           HZ       PHE  34   7.615  27.582   4.157

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ALA  35           H        ALA  35   5.018  29.197  -3.201
    2    HA   ALA  35           HA       ALA  35   2.476  28.560  -4.234
    3    HB3  ALA  35           HB1      ALA  35   3.525  29.953  -6.273
    4    HB2  ALA  35           HB2      ALA  35   4.736  30.327  -5.045
    5    HB1  ALA  35           HB3      ALA  35   3.041  30.725  -4.763

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ALA  36           H        ALA  36   5.715  27.906  -5.573
    2    HA   ALA  36           HA       ALA  36   4.745  26.461  -7.816
    3    HB3  ALA  36           HB1      ALA  36   6.906  26.600  -8.423
    4    HB2  ALA  36           HB2      ALA  36   7.389  25.579  -7.067
    5    HB1  ALA  36           HB3      ALA  36   7.270  27.327  -6.859

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ALA  37           H        ALA  37   5.696  25.486  -4.554
    2    HA   ALA  37           HA       ALA  37   5.660  22.696  -4.973
    3    HB2  ALA  37           HB1      ALA  37   5.376  24.493  -2.602
    4    HB1  ALA  37           HB2      ALA  37   6.520  23.183  -2.885
    5    HB3  ALA  37           HB3      ALA  37   4.860  22.818  -2.419

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LYS  38           H        LYS  38   3.106  24.889  -3.823
    2    HA   LYS  38           HA       LYS  38   1.019  23.061  -3.602
    3    HB2  LYS  38           HB2      LYS  38   1.349  25.820  -3.359
    4    HB3  LYS  38           HB3      LYS  38   0.156  25.659  -4.642
    5    HG2  LYS  38           HG2      LYS  38  -1.289  24.330  -3.201
    6    HG3  LYS  38           HG3      LYS  38  -0.050  24.284  -1.939
    7    HD2  LYS  38           HD2      LYS  38  -0.255  26.620  -1.501
    8    HD3  LYS  38           HD3      LYS  38  -1.163  26.897  -2.988
    9    HE2  LYS  38           HE2      LYS  38  -2.674  26.927  -1.054
   10    HE3  LYS  38           HE3      LYS  38  -3.034  25.544  -2.093
   11    HZ3  LYS  38           HZ1      LYS  38  -2.303  24.084  -0.552
   12    HZ2  LYS  38           HZ2      LYS  38  -2.668  25.343   0.532
   13    HZ1  LYS  38           HZ3      LYS  38  -1.069  25.102   0.014

  No H/Q in entry =          13
  In of MODEL   86
    1    H    ALA  39           H        ALA  39   1.996  24.960  -6.453
    2    HA   ALA  39           HA       ALA  39  -0.067  24.071  -8.161
    3    HB2  ALA  39           HB1      ALA  39   2.669  24.736  -9.207
    4    HB1  ALA  39           HB2      ALA  39   1.690  25.993  -8.450
    5    HB3  ALA  39           HB3      ALA  39   1.089  25.146  -9.875

  No H/Q in entry =           5
  In of MODEL   86
    1    H    MET  40           H        MET  40   3.179  22.799  -7.565
    2    HA   MET  40           HA       MET  40   3.104  20.771  -9.549
    3    HB2  MET  40           HB2      MET  40   4.704  21.016  -6.995
    4    HB3  MET  40           HB3      MET  40   4.969  19.758  -8.204
    5    HG2  MET  40           HG2      MET  40   5.007  22.712  -8.880
    6    HG3  MET  40           HG3      MET  40   6.458  21.822  -8.422
    7    HE3  MET  40           HE1      MET  40   7.358  19.604 -11.219
    8    HE2  MET  40           HE2      MET  40   6.791  19.286  -9.583
    9    HE1  MET  40           HE3      MET  40   7.877  20.640  -9.883

  No H/Q in entry =           9
  In of MODEL   86
    1    H    MET  41           H        MET  41   2.176  20.818  -6.129
    2    HA   MET  41           HA       MET  41   1.664  18.051  -5.843
    3    HB2  MET  41           HB2      MET  41   0.307  20.402  -4.506
    4    HB3  MET  41           HB3      MET  41   0.163  18.725  -3.993
    5    HG2  MET  41           HG2      MET  41   2.871  18.969  -4.020
    6    HG3  MET  41           HG3      MET  41   2.416  20.626  -3.632
    7    HE2  MET  41           HE1      MET  41  -0.620  19.355  -1.914
    8    HE1  MET  41           HE2      MET  41   0.186  20.873  -2.294
    9    HE3  MET  41           HE3      MET  41   0.125  20.308  -0.624

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ASP  42           H        ASP  42  -0.392  20.756  -6.835
    2    HA   ASP  42           HA       ASP  42  -2.822  19.375  -6.976
    3    HB2  ASP  42           HB2      ASP  42  -2.134  21.950  -7.239
    4    HB3  ASP  42           HB3      ASP  42  -2.276  21.548  -8.947

  No H/Q in entry =           4
  In of MODEL   86
    1    H    GLN  43           H        GLN  43  -0.376  19.977  -9.471
    2    HA   GLN  43           HA       GLN  43  -1.744  18.639 -11.561
    3    HB2  GLN  43           HB2      GLN  43   1.209  19.180 -11.169
    4    HB3  GLN  43           HB3      GLN  43   0.506  18.529 -12.652
    5    HG2  GLN  43           HG2      GLN  43  -1.022  20.544 -12.707
    6    HG3  GLN  43           HG3      GLN  43  -0.080  21.212 -11.378
    7   HE21  GLN  43          HE21      GLN  43   0.077  22.827 -13.469
    8   HE22  GLN  43          HE22      GLN  43   1.497  22.614 -14.370

  No H/Q in entry =           8
  In of MODEL   86
    1    H    SER  44           H        SER  44   0.607  17.526  -9.157
    2    HA   SER  44           HA       SER  44   0.967  14.919 -10.172
    3    HB2  SER  44           HB2      SER  44   1.841  16.373  -7.937
    4    HB3  SER  44           HB3      SER  44   0.987  14.985  -7.265
    5    HG   SER  44           HG       SER  44   3.105  14.381  -7.681

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ARG  45           H        ARG  45  -1.373  16.226  -7.848
    2    HA   ARG  45           HA       ARG  45  -2.742  13.856  -7.210
    3    HB2  ARG  45           HB2      ARG  45  -2.964  16.027  -6.026
    4    HB3  ARG  45           HB3      ARG  45  -3.820  16.681  -7.419
    5    HG2  ARG  45           HG2      ARG  45  -5.572  14.942  -7.137
    6    HG3  ARG  45           HG3      ARG  45  -4.728  14.342  -5.708
    7    HD2  ARG  45           HD2      ARG  45  -4.958  16.611  -4.661
    8    HD3  ARG  45           HD3      ARG  45  -5.944  17.117  -6.049
    9    HE   ARG  45           HE       ARG  45  -7.038  14.735  -5.005
   10   HH21  ARG  45          HH11      ARG  45  -8.880  14.800  -3.742
   11   HH22  ARG  45          HH12      ARG  45  -9.290  16.239  -2.879
   12   HH11  ARG  45          HH21      ARG  45  -6.524  17.990  -3.990
   13   HH12  ARG  45          HH22      ARG  45  -7.952  18.046  -3.018

  No H/Q in entry =          13
  In of MODEL   86
    1    H    MET  46           H        MET  46  -3.337  16.246  -9.771
    2    HA   MET  46           HA       MET  46  -5.662  15.050 -10.838
    3    HB2  MET  46           HB2      MET  46  -3.572  16.893 -12.007
    4    HB3  MET  46           HB3      MET  46  -4.940  16.318 -12.964
    5    HG2  MET  46           HG2      MET  46  -6.509  17.244 -11.334
    6    HG3  MET  46           HG3      MET  46  -5.179  17.747 -10.299
    7    HE1  MET  46           HE1      MET  46  -7.046  17.987 -13.494
    8    HE3  MET  46           HE2      MET  46  -5.521  18.054 -14.370
    9    HE2  MET  46           HE3      MET  46  -6.552  19.483 -14.297

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ALA  47           H        ALA  47  -2.226  14.598 -11.580
    2    HA   ALA  47           HA       ALA  47  -2.547  12.860 -13.786
    3    HB3  ALA  47           HB1      ALA  47  -0.379  13.770 -13.429
    4    HB2  ALA  47           HB2      ALA  47  -0.223  12.044 -13.088
    5    HB1  ALA  47           HB3      ALA  47  -0.332  13.200 -11.759

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LEU  48           H        LEU  48  -2.286  12.239 -10.309
    2    HA   LEU  48           HA       LEU  48  -2.354   9.398 -10.457
    3    HB2  LEU  48           HB2      LEU  48  -3.144  11.317  -8.254
    4    HB3  LEU  48           HB3      LEU  48  -3.035   9.568  -8.046
    5    HG   LEU  48           HG       LEU  48  -0.748  11.284  -9.040
    6   HD13  LEU  48          HD11      LEU  48  -1.046  12.060  -6.854
    7   HD12  LEU  48          HD12      LEU  48   0.128  10.763  -6.646
    8   HD11  LEU  48          HD13      LEU  48  -1.569  10.487  -6.254
    9   HD22  LEU  48          HD21      LEU  48  -0.227   9.101  -9.671
   10   HD21  LEU  48          HD22      LEU  48  -1.095   8.383  -8.316
   11   HD23  LEU  48          HD23      LEU  48   0.469   9.151  -8.052

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ASN  49           H        ASN  49  -4.841  11.869 -10.075
    2    HA   ASN  49           HA       ASN  49  -7.014  10.187  -9.538
    3    HB2  ASN  49           HB2      ASN  49  -7.111  12.601  -9.216
    4    HB3  ASN  49           HB3      ASN  49  -6.914  12.872 -10.943
    5   HD21  ASN  49          HD21      ASN  49  -9.138  11.338  -8.589
    6   HD22  ASN  49          HD22      ASN  49 -10.533  11.575  -9.523

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLU  50           H        GLU  50  -5.732  11.384 -12.625
    2    HA   GLU  50           HA       GLU  50  -7.668  10.105 -14.274
    3    HB2  GLU  50           HB2      GLU  50  -6.216  11.934 -15.089
    4    HB3  GLU  50           HB3      GLU  50  -4.813  10.875 -14.941
    5    HG2  GLU  50           HG2      GLU  50  -5.765   9.325 -16.576
    6    HG3  GLU  50           HG3      GLU  50  -7.235  10.290 -16.673

  No H/Q in entry =           6
  In of MODEL   86
    1    H    ALA  51           H        ALA  51  -4.494   9.146 -13.052
    2    HA   ALA  51           HA       ALA  51  -4.326   6.689 -14.460
    3    HB2  ALA  51           HB1      ALA  51  -2.348   6.423 -13.351
    4    HB1  ALA  51           HB2      ALA  51  -3.046   6.845 -11.788
    5    HB3  ALA  51           HB3      ALA  51  -2.597   8.116 -12.924

  No H/Q in entry =           5
  In of MODEL   86
    1    H    HIS  52           H        HIS  52  -5.521   7.522 -11.219
    2    HA   HIS  52           HA       HIS  52  -6.186   4.909 -10.381
    3    HB2  HIS  52           HB2      HIS  52  -6.071   6.892  -8.886
    4    HB3  HIS  52           HB3      HIS  52  -7.546   7.506  -9.631
    5    HD1  HIS  52           HD1      HIS  52  -9.741   6.046  -9.284
    6    HD2  HIS  52           HD2      HIS  52  -6.473   4.879  -6.975
    7    HE1  HIS  52           HE1      HIS  52 -10.647   4.514  -7.482
    8    HE2  HIS  52           HE2      HIS  52  -8.666   3.795  -6.066

  No H/Q in entry =           8
  In of MODEL   86
    1    H    LEU  53           H        LEU  53  -8.020   7.344 -12.186
    2    HA   LEU  53           HA       LEU  53 -10.514   6.031 -12.204
    3    HB2  LEU  53           HB2      LEU  53  -9.240   8.014 -14.079
    4    HB3  LEU  53           HB3      LEU  53 -10.835   7.336 -14.400
    5    HG   LEU  53           HG       LEU  53 -10.115   8.691 -11.778
    6   HD13  LEU  53          HD11      LEU  53 -11.111  10.705 -12.610
    7   HD12  LEU  53          HD12      LEU  53 -11.669   9.899 -14.076
    8   HD11  LEU  53          HD13      LEU  53  -9.951  10.194 -13.829
    9   HD22  LEU  53          HD21      LEU  53 -12.082   7.463 -11.386
   10   HD21  LEU  53          HD22      LEU  53 -12.643   7.656 -13.042
   11   HD23  LEU  53          HD23      LEU  53 -12.746   9.000 -11.922

  No H/Q in entry =          11
  In of MODEL   86
    1    H    VAL  54           H        VAL  54  -7.752   5.849 -14.429
    2    HA   VAL  54           HA       VAL  54  -8.952   4.061 -16.271
    3    HB   VAL  54           HB       VAL  54  -6.052   4.595 -15.578
    4   HG12  VAL  54          HG11      VAL  54  -5.785   3.503 -17.962
    5   HG11  VAL  54          HG12      VAL  54  -7.308   2.711 -17.562
    6   HG13  VAL  54          HG13      VAL  54  -5.895   2.472 -16.536
    7   HG22  VAL  54          HG21      VAL  54  -6.833   6.528 -16.633
    8   HG21  VAL  54          HG22      VAL  54  -8.015   5.651 -17.603
    9   HG23  VAL  54          HG23      VAL  54  -6.306   5.583 -18.026

  No H/Q in entry =           9
  In of MODEL   86
    1    H    GLN  55           H        GLN  55  -6.961   3.542 -13.360
    2    HA   GLN  55           HA       GLN  55  -6.847   0.725 -13.606
    3    HB2  GLN  55           HB2      GLN  55  -5.306   1.640 -12.084
    4    HB3  GLN  55           HB3      GLN  55  -6.534   2.599 -11.263
    5    HG2  GLN  55           HG2      GLN  55  -7.214   0.840  -9.942
    6    HG3  GLN  55           HG3      GLN  55  -6.974  -0.349 -11.215
    7   HE21  GLN  55          HE21      GLN  55  -5.341  -1.784 -10.708
    8   HE22  GLN  55          HE22      GLN  55  -3.963  -1.418  -9.791

  No H/Q in entry =           8
  In of MODEL   86
    1    H    THR  56           H        THR  56  -9.203   2.875 -12.010
    2    HA   THR  56           HA       THR  56 -10.778   0.983 -10.721
    3    HB   THR  56           HB       THR  56 -11.881   3.360 -12.240
    4    HG1  THR  56           HG1      THR  56 -10.227   3.174 -10.046
    5   HG21  THR  56          HG21      THR  56 -13.345   1.540 -11.059
    6   HG23  THR  56          HG22      THR  56 -13.702   3.246 -10.781
    7   HG22  THR  56          HG23      THR  56 -12.802   2.324  -9.575

  No H/Q in entry =           7
  In of MODEL   86
    1    H    LYS  57           H        LYS  57 -10.973   2.052 -14.112
    2    HA   LYS  57           HA       LYS  57 -13.112   0.345 -14.869
    3    HB2  LYS  57           HB2      LYS  57 -12.246   2.298 -16.189
    4    HB3  LYS  57           HB3      LYS  57 -10.798   1.369 -16.547
    5    HG2  LYS  57           HG2      LYS  57 -12.163  -0.339 -17.683
    6    HG3  LYS  57           HG3      LYS  57 -13.620   0.581 -17.327
    7    HD2  LYS  57           HD2      LYS  57 -11.319   1.801 -18.860
    8    HD3  LYS  57           HD3      LYS  57 -12.585   0.884 -19.675
    9    HE2  LYS  57           HE2      LYS  57 -14.280   2.416 -18.569
   10    HE3  LYS  57           HE3      LYS  57 -12.933   3.414 -18.021
   11    HZ1  LYS  57           HZ1      LYS  57 -12.361   3.123 -20.615
   12    HZ3  LYS  57           HZ2      LYS  57 -13.235   4.431 -19.969
   13    HZ2  LYS  57           HZ3      LYS  57 -14.057   3.117 -20.667

  No H/Q in entry =          13
  In of MODEL   86
    1    H    LEU  58           H        LEU  58  -9.605  -0.058 -14.794
    2    HA   LEU  58           HA       LEU  58  -9.587  -2.580 -16.073
    3    HB2  LEU  58           HB2      LEU  58  -7.571  -1.265 -14.260
    4    HB3  LEU  58           HB3      LEU  58  -7.294  -2.787 -15.107
    5    HG   LEU  58           HG       LEU  58  -8.062  -0.194 -16.485
    6   HD11  LEU  58          HD11      LEU  58  -5.410  -1.407 -15.776
    7   HD13  LEU  58          HD12      LEU  58  -5.918   0.280 -15.736
    8   HD12  LEU  58          HD13      LEU  58  -5.566  -0.494 -17.278
    9   HD22  LEU  58          HD21      LEU  58  -8.618  -1.767 -18.072
   10   HD21  LEU  58          HD22      LEU  58  -7.570  -3.004 -17.381
   11   HD23  LEU  58          HD23      LEU  58  -6.885  -1.728 -18.388

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  59           H        ILE  59 -10.431  -1.671 -12.830
    2    HA   ILE  59           HA       ILE  59 -10.062  -4.432 -11.869
    3    HB   ILE  59           HB       ILE  59  -9.654  -2.143 -10.481
    4   HG12  ILE  59          HG12      ILE  59 -10.962  -4.526  -9.153
    5   HG13  ILE  59          HG13      ILE  59  -9.319  -4.563  -9.739
    6   HG23  ILE  59          HG21      ILE  59 -11.500  -1.503  -9.156
    7   HG22  ILE  59          HG22      ILE  59 -12.408  -2.946  -9.543
    8   HG21  ILE  59          HG23      ILE  59 -12.202  -1.678 -10.747
    9   HD13  ILE  59          HD11      ILE  59  -8.693  -2.717  -8.305
   10   HD12  ILE  59          HD12      ILE  59  -9.457  -3.961  -7.325
   11   HD11  ILE  59          HD13      ILE  59 -10.362  -2.517  -7.781

  No H/Q in entry =          11
  In of MODEL   86
    1    H    GLU  60           H        GLU  60 -12.635  -2.141 -12.699
    2    HA   GLU  60           HA       GLU  60 -14.812  -3.671 -11.691
    3    HB2  GLU  60           HB2      GLU  60 -15.035  -1.301 -12.299
    4    HB3  GLU  60           HB3      GLU  60 -14.714  -1.692 -13.986
    5    HG2  GLU  60           HG2      GLU  60 -16.740  -3.139 -14.013
    6    HG3  GLU  60           HG3      GLU  60 -17.079  -2.658 -12.363

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLY  61           H        GLY  61 -13.123  -3.654 -14.797
    2    HA3  GLY  61           HA2      GLY  61 -14.813  -5.917 -15.687
    3    HA2  GLY  61           HA3      GLY  61 -13.972  -4.809 -16.765

  No H/Q in entry =           3
  In of MODEL   86
    1    H    ASP  62           H        ASP  62 -12.603  -6.237 -13.868
    2    HA   ASP  62           HA       ASP  62 -10.310  -7.168 -15.300
    3    HB2  ASP  62           HB2      ASP  62  -9.672  -8.075 -13.050
    4    HB3  ASP  62           HB3      ASP  62 -10.063  -6.359 -13.043

  No H/Q in entry =           4
  In of MODEL   86
    1    H    ALA  63           H        ALA  63 -13.314  -8.487 -15.339
    2    HA   ALA  63           HA       ALA  63 -13.085 -11.202 -14.695
    3    HB3  ALA  63           HB1      ALA  63 -14.825 -11.544 -16.460
    4    HB1  ALA  63           HB2      ALA  63 -14.545  -9.896 -17.021
    5    HB2  ALA  63           HB3      ALA  63 -15.202 -10.179 -15.408

  No H/Q in entry =           5
  In of MODEL   86
    1    H    GLY  64           H        GLY  64 -12.252  -9.515 -17.690
    2    HA3  GLY  64           HA2      GLY  64 -10.887 -10.054 -19.447
    3    HA2  GLY  64           HA3      GLY  64 -10.031 -11.111 -18.333

  No H/Q in entry =           3
  In of MODEL   86
    1    H    GLU  65           H        GLU  65  -9.741 -12.839 -19.734
    2    HA   GLU  65           HA       GLU  65 -11.789 -13.856 -21.406
    3    HB2  GLU  65           HB2      GLU  65  -9.219 -15.093 -20.425
    4    HB3  GLU  65           HB3      GLU  65 -10.282 -15.853 -21.608
    5    HG2  GLU  65           HG2      GLU  65 -10.047 -13.947 -23.108
    6    HG3  GLU  65           HG3      GLU  65  -9.079 -13.089 -21.911

  No H/Q in entry =           6
  In of MODEL   86
    1    H    GLY  66           H        GLY  66 -10.637 -14.799 -18.249
    2    HA3  GLY  66           HA2      GLY  66 -12.604 -16.937 -17.983
    3    HA2  GLY  66           HA3      GLY  66 -11.275 -16.602 -16.891

  No H/Q in entry =           3
  In of MODEL   86
    1    H    LYS  67           H        LYS  67 -13.594 -17.182 -15.775
    2    HA   LYS  67           HA       LYS  67 -15.308 -14.950 -15.325
    3    HB2  LYS  67           HB2      LYS  67 -15.073 -17.638 -13.983
    4    HB3  LYS  67           HB3      LYS  67 -16.341 -16.461 -13.618
    5    HG2  LYS  67           HG2      LYS  67 -16.993 -16.427 -16.004
    6    HG3  LYS  67           HG3      LYS  67 -15.744 -17.619 -16.359
    7    HD2  LYS  67           HD2      LYS  67 -16.851 -19.245 -14.885
    8    HD3  LYS  67           HD3      LYS  67 -18.088 -18.050 -14.485
    9    HE2  LYS  67           HE2      LYS  67 -18.780 -17.940 -16.838
   10    HE3  LYS  67           HE3      LYS  67 -17.512 -19.084 -17.278
   11    HZ3  LYS  67           HZ1      LYS  67 -18.890 -20.726 -16.795
   12    HZ2  LYS  67           HZ2      LYS  67 -20.095 -19.623 -16.329
   13    HZ1  LYS  67           HZ3      LYS  67 -18.980 -20.199 -15.186

  No H/Q in entry =          13
  In of MODEL   86
    1    H    MET  68           H        MET  68 -14.046 -16.765 -12.656
    2    HA   MET  68           HA       MET  68 -13.932 -14.604 -10.866
    3    HB2  MET  68           HB2      MET  68 -12.538 -17.276 -10.676
    4    HB3  MET  68           HB3      MET  68 -12.893 -16.182  -9.338
    5    HG2  MET  68           HG2      MET  68 -14.953 -17.501 -11.131
    6    HG3  MET  68           HG3      MET  68 -14.581 -17.971  -9.471
    7    HE1  MET  68           HE1      MET  68 -14.608 -16.661  -7.605
    8    HE3  MET  68           HE2      MET  68 -15.835 -15.463  -7.196
    9    HE2  MET  68           HE3      MET  68 -14.309 -14.942  -7.907

  No H/Q in entry =           9
  In of MODEL   86
    1    H    LYS  69           H        LYS  69 -11.292 -16.142 -12.731
    2    HA   LYS  69           HA       LYS  69  -9.179 -14.844 -11.419
    3    HB2  LYS  69           HB2      LYS  69  -8.915 -16.844 -12.823
    4    HB3  LYS  69           HB3      LYS  69  -9.237 -15.871 -14.261
    5    HG2  LYS  69           HG2      LYS  69  -7.283 -14.470 -13.787
    6    HG3  LYS  69           HG3      LYS  69  -6.983 -15.359 -12.295
    7    HD2  LYS  69           HD2      LYS  69  -6.630 -17.428 -13.602
    8    HD3  LYS  69           HD3      LYS  69  -6.904 -16.525 -15.093
    9    HE2  LYS  69           HE2      LYS  69  -4.985 -15.064 -14.564
   10    HE3  LYS  69           HE3      LYS  69  -4.708 -15.967 -13.075
   11    HZ1  LYS  69           HZ1      LYS  69  -4.875 -17.543 -15.508
   12    HZ3  LYS  69           HZ2      LYS  69  -3.830 -17.698 -14.180
   13    HZ2  LYS  69           HZ3      LYS  69  -3.517 -16.536 -15.380

  No H/Q in entry =          13
  In of MODEL   86
    1    H    VAL  70           H        VAL  70  -7.895 -13.063 -11.795
    2    HA   VAL  70           HA       VAL  70  -8.982 -11.022 -13.655
    3    HB   VAL  70           HB       VAL  70  -8.067  -9.359 -12.064
    4   HG13  VAL  70          HG11      VAL  70  -9.798  -9.626 -10.393
    5   HG12  VAL  70          HG12      VAL  70  -9.869 -11.366 -10.682
    6   HG11  VAL  70          HG13      VAL  70 -10.429 -10.242 -11.920
    7   HG23  VAL  70          HG21      VAL  70  -7.499 -10.349  -9.723
    8   HG22  VAL  70          HG22      VAL  70  -6.272 -10.467 -10.983
    9   HG21  VAL  70          HG23      VAL  70  -7.259 -11.872 -10.580

  No H/Q in entry =           9
  In of MODEL   86
    1    H    SER  71           H        SER  71  -7.369  -9.501 -14.481
    2    HA   SER  71           HA       SER  71  -5.144 -10.766 -15.686
    3    HB2  SER  71           HB2      SER  71  -6.265  -8.741 -16.606
    4    HB3  SER  71           HB3      SER  71  -5.623  -7.805 -15.258
    5    HG   SER  71           HG       SER  71  -4.425  -8.556 -17.548

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LEU  72           H        LEU  72  -3.104 -11.005 -15.052
    2    HA   LEU  72           HA       LEU  72  -2.399 -10.773 -12.338
    3    HB2  LEU  72           HB2      LEU  72  -0.734 -11.204 -14.813
    4    HB3  LEU  72           HB3      LEU  72  -0.074 -11.256 -13.182
    5    HG   LEU  72           HG       LEU  72  -2.409 -12.978 -14.072
    6   HD11  LEU  72          HD11      LEU  72   0.570 -13.491 -14.110
    7   HD13  LEU  72          HD12      LEU  72  -0.588 -13.703 -15.422
    8   HD12  LEU  72          HD13      LEU  72  -0.606 -14.805 -14.045
    9   HD23  LEU  72          HD21      LEU  72  -1.401 -14.362 -12.087
   10   HD22  LEU  72          HD22      LEU  72  -2.399 -12.970 -11.702
   11   HD21  LEU  72          HD23      LEU  72  -0.645 -12.841 -11.626

  No H/Q in entry =          11
  In of MODEL   86
    1    H    VAL  73           H        VAL  73  -1.684  -8.764 -15.124
    2    HA   VAL  73           HA       VAL  73   0.218  -7.046 -14.019
    3    HB   VAL  73           HB       VAL  73  -0.175  -5.639 -15.883
    4   HG13  VAL  73          HG11      VAL  73   0.149  -7.166 -17.612
    5   HG12  VAL  73          HG12      VAL  73  -1.074  -8.277 -16.998
    6   HG11  VAL  73          HG13      VAL  73   0.498  -8.169 -16.206
    7   HG22  VAL  73          HG21      VAL  73  -2.449  -5.133 -15.918
    8   HG21  VAL  73          HG22      VAL  73  -2.930  -6.819 -15.737
    9   HG23  VAL  73          HG23      VAL  73  -2.332  -6.235 -17.291

  No H/Q in entry =           9
  In of MODEL   86
    1    H    LEU  74           H        LEU  74  -3.181  -7.184 -13.477
    2    HA   LEU  74           HA       LEU  74  -3.821  -4.530 -12.880
    3    HB2  LEU  74           HB2      LEU  74  -5.536  -6.212 -13.055
    4    HB3  LEU  74           HB3      LEU  74  -4.846  -7.121 -11.713
    5    HG   LEU  74           HG       LEU  74  -5.332  -5.237 -10.187
    6   HD13  LEU  74          HD11      LEU  74  -5.229  -3.310 -11.566
    7   HD12  LEU  74          HD12      LEU  74  -6.940  -3.476 -11.180
    8   HD11  LEU  74          HD13      LEU  74  -6.336  -3.999 -12.753
    9   HD23  LEU  74          HD21      LEU  74  -7.875  -5.699 -11.659
   10   HD22  LEU  74          HD22      LEU  74  -7.514  -5.823  -9.951
   11   HD21  LEU  74          HD23      LEU  74  -7.012  -7.100 -11.031

  No H/Q in entry =          11
  In of MODEL   86
    1    H    VAL  75           H        VAL  75  -2.773  -7.100 -10.701
    2    HA   VAL  75           HA       VAL  75  -2.597  -5.537  -8.364
    3    HB   VAL  75           HB       VAL  75  -1.076  -8.023  -9.134
    4   HG12  VAL  75          HG11      VAL  75  -0.657  -8.159  -6.642
    5   HG11  VAL  75          HG12      VAL  75  -1.310  -6.535  -6.494
    6   HG13  VAL  75          HG13      VAL  75   0.165  -6.803  -7.407
    7   HG21  VAL  75          HG21      VAL  75  -3.532  -7.474  -7.430
    8   HG23  VAL  75          HG22      VAL  75  -2.738  -9.044  -7.557
    9   HG22  VAL  75          HG23      VAL  75  -3.505  -8.325  -8.975

  No H/Q in entry =           9
  In of MODEL   86
    1    H    GLU  76           H        GLU  76  -0.170  -6.291 -10.884
    2    HA   GLU  76           HA       GLU  76   2.000  -4.923  -9.722
    3    HB2  GLU  76           HB2      GLU  76   2.179  -6.416 -11.716
    4    HB3  GLU  76           HB3      GLU  76   1.329  -5.212 -12.673
    5    HG2  GLU  76           HG2      GLU  76   3.144  -3.595 -12.291
    6    HG3  GLU  76           HG3      GLU  76   4.008  -4.754 -11.299

  No H/Q in entry =           6
  In of MODEL   86
    1    H    ALA  77           H        ALA  77  -0.529  -3.749 -11.929
    2    HA   ALA  77           HA       ALA  77   0.442  -1.097 -12.111
    3    HB3  ALA  77           HB1      ALA  77  -2.463  -1.917 -12.289
    4    HB1  ALA  77           HB2      ALA  77  -1.308  -2.206 -13.589
    5    HB2  ALA  77           HB3      ALA  77  -1.670  -0.557 -13.085

  No H/Q in entry =           5
  In of MODEL   86
    1    H    GLN  78           H        GLN  78  -1.826  -2.659  -9.905
    2    HA   GLN  78           HA       GLN  78  -2.657  -0.341  -8.518
    3    HB2  GLN  78           HB2      GLN  78  -3.752  -2.606  -8.428
    4    HB3  GLN  78           HB3      GLN  78  -2.416  -3.154  -7.420
    5    HG2  GLN  78           HG2      GLN  78  -2.948  -1.414  -5.764
    6    HG3  GLN  78           HG3      GLN  78  -4.288  -0.862  -6.768
    7   HE21  GLN  78          HE21      GLN  78  -4.772  -1.819  -4.120
    8   HE22  GLN  78          HE22      GLN  78  -5.614  -3.290  -4.226

  No H/Q in entry =           8
  In of MODEL   86
    1    H    LEU  79           H        LEU  79   0.036  -2.574  -8.044
    2    HA   LEU  79           HA       LEU  79   0.992  -1.658  -5.586
    3    HB2  LEU  79           HB2      LEU  79   1.884  -3.665  -6.640
    4    HB3  LEU  79           HB3      LEU  79   2.529  -2.714  -7.974
    5    HG   LEU  79           HG       LEU  79   4.068  -1.556  -6.468
    6   HD13  LEU  79          HD11      LEU  79   3.051  -1.309  -4.407
    7   HD12  LEU  79          HD12      LEU  79   4.138  -2.649  -4.052
    8   HD11  LEU  79          HD13      LEU  79   2.437  -2.963  -4.389
    9   HD23  LEU  79          HD21      LEU  79   5.291  -3.690  -5.549
   10   HD22  LEU  79          HD22      LEU  79   5.095  -3.500  -7.289
   11   HD21  LEU  79          HD23      LEU  79   4.021  -4.575  -6.397

  No H/Q in entry =          11
  In of MODEL   86
    1    H    HIS  80           H        HIS  80   1.871  -0.549  -8.859
    2    HA   HIS  80           HA       HIS  80   3.657   1.458  -7.936
    3    HB2  HIS  80           HB2      HIS  80   2.387   0.741 -10.523
    4    HB3  HIS  80           HB3      HIS  80   2.967   2.399 -10.356
    5    HD1  HIS  80           HD1      HIS  80   5.368   2.718 -10.867
    6    HD2  HIS  80           HD2      HIS  80   4.576  -1.195  -9.663
    7    HE1  HIS  80           HE1      HIS  80   7.570   1.459 -11.016
    8    HE2  HIS  80           HE2      HIS  80   7.098  -0.929 -10.285

  No H/Q in entry =           8
  In of MODEL   86
    1    H    LEU  81           H        LEU  81   0.257   1.584  -8.935
    2    HA   LEU  81           HA       LEU  81  -0.045   4.375  -8.618
    3    HB2  LEU  81           HB2      LEU  81  -2.040   2.112  -8.540
    4    HB3  LEU  81           HB3      LEU  81  -2.508   3.812  -8.457
    5    HG   LEU  81           HG       LEU  81  -0.792   2.667 -10.679
    6   HD12  LEU  81          HD11      LEU  81  -3.020   2.961 -11.992
    7   HD11  LEU  81          HD12      LEU  81  -3.784   2.893 -10.404
    8   HD13  LEU  81          HD13      LEU  81  -2.825   1.531 -10.980
    9   HD23  LEU  81          HD21      LEU  81  -1.903   4.797 -11.792
   10   HD22  LEU  81          HD22      LEU  81  -0.494   4.985 -10.752
   11   HD21  LEU  81          HD23      LEU  81  -2.105   5.321 -10.122

  No H/Q in entry =          11
  In of MODEL   86
    1    H    MET  82           H        MET  82  -0.691   1.692  -6.361
    2    HA   MET  82           HA       MET  82  -1.770   3.277  -4.286
    3    HB2  MET  82           HB2      MET  82  -0.371   0.603  -4.307
    4    HB3  MET  82           HB3      MET  82  -0.964   1.329  -2.815
    5    HG2  MET  82           HG2      MET  82  -2.679   0.809  -5.263
    6    HG3  MET  82           HG3      MET  82  -2.598  -0.258  -3.863
    7    HE3  MET  82           HE1      MET  82  -4.352   1.387  -1.064
    8    HE2  MET  82           HE2      MET  82  -2.623   1.681  -1.241
    9    HE1  MET  82           HE3      MET  82  -3.294   0.115  -1.692

  No H/Q in entry =           9
  In of MODEL   86
    1    H    THR  83           H        THR  83   1.545   2.220  -4.953
    2    HA   THR  83           HA       THR  83   2.739   3.346  -2.651
    3    HB   THR  83           HB       THR  83   4.843   3.304  -4.113
    4    HG1  THR  83           HG1      THR  83   4.619   2.767  -6.136
    5   HG22  THR  83          HG21      THR  83   4.426   0.641  -4.436
    6   HG21  THR  83          HG22      THR  83   3.127   1.013  -3.305
    7   HG23  THR  83          HG23      THR  83   4.800   1.374  -2.877

  No H/Q in entry =           7
  In of MODEL   86
    1    H    SER  84           H        SER  84   2.374   4.608  -5.959
    2    HA   SER  84           HA       SER  84   3.688   7.063  -5.507
    3    HB2  SER  84           HB2      SER  84   1.637   6.202  -7.534
    4    HB3  SER  84           HB3      SER  84   2.299   7.836  -7.512
    5    HG   SER  84           HG       SER  84   3.697   5.373  -7.785

  No H/Q in entry =           5
  In of MODEL   86
    1    H    MET  85           H        MET  85   0.200   6.273  -5.351
    2    HA   MET  85           HA       MET  85  -0.689   8.878  -4.765
    3    HB2  MET  85           HB2      MET  85  -2.191   7.051  -5.435
    4    HB3  MET  85           HB3      MET  85  -1.904   6.255  -3.888
    5    HG2  MET  85           HG2      MET  85  -2.825   8.202  -2.697
    6    HG3  MET  85           HG3      MET  85  -3.076   9.030  -4.232
    7    HE3  MET  85           HE1      MET  85  -3.925   5.015  -3.449
    8    HE2  MET  85           HE2      MET  85  -5.258   5.501  -2.405
    9    HE1  MET  85           HE3      MET  85  -3.635   6.108  -2.090

  No H/Q in entry =           9
  In of MODEL   86
    1    H    LEU  86           H        LEU  86   0.244   6.233  -2.605
    2    HA   LEU  86           HA       LEU  86  -0.315   7.541  -0.172
    3    HB2  LEU  86           HB2      LEU  86   0.174   5.073  -0.553
    4    HB3  LEU  86           HB3      LEU  86   1.877   5.518  -0.641
    5    HG   LEU  86           HG       LEU  86   1.530   6.685   1.621
    6   HD11  LEU  86          HD11      LEU  86  -1.155   5.893   1.139
    7   HD13  LEU  86          HD12      LEU  86  -0.503   6.652   2.589
    8   HD12  LEU  86          HD13      LEU  86  -0.578   4.895   2.477
    9   HD23  LEU  86          HD21      LEU  86   1.127   3.689   1.753
   10   HD22  LEU  86          HD22      LEU  86   2.115   4.712   2.794
   11   HD21  LEU  86          HD23      LEU  86   2.628   4.385   1.140

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ALA  87           H        ALA  87   2.679   7.265  -2.044
    2    HA   ALA  87           HA       ALA  87   4.363   8.696  -0.316
    3    HB3  ALA  87           HB1      ALA  87   4.481   7.674  -3.018
    4    HB2  ALA  87           HB2      ALA  87   5.807   8.020  -1.912
    5    HB1  ALA  87           HB3      ALA  87   5.188   9.291  -2.964

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ARG  88           H        ARG  88   2.421   9.806  -3.051
    2    HA   ARG  88           HA       ARG  88   3.174  12.502  -2.940
    3    HB2  ARG  88           HB2      ARG  88   1.938  11.332  -4.800
    4    HB3  ARG  88           HB3      ARG  88   0.475  11.468  -3.825
    5    HG2  ARG  88           HG2      ARG  88   1.474  14.056  -3.747
    6    HG3  ARG  88           HG3      ARG  88   1.910  13.539  -5.373
    7    HD2  ARG  88           HD2      ARG  88  -0.228  13.600  -6.082
    8    HD3  ARG  88           HD3      ARG  88  -0.815  12.748  -4.653
    9    HE   ARG  88           HE       ARG  88  -1.024  15.523  -5.083
   10   HH21  ARG  88          HH11      ARG  88  -1.570  16.855  -3.353
   11   HH22  ARG  88          HH12      ARG  88  -1.278  16.326  -1.732
   12   HH11  ARG  88          HH21      ARG  88  -0.004  13.277  -2.695
   13   HH12  ARG  88          HH22      ARG  88  -0.409  14.294  -1.360

  No H/Q in entry =          13
  In of MODEL   86
    1    H    GLU  89           H        GLU  89   0.474  10.814  -1.308
    2    HA   GLU  89           HA       GLU  89  -0.656  13.122  -0.118
    3    HB2  GLU  89           HB2      GLU  89  -1.758  10.874  -0.202
    4    HB3  GLU  89           HB3      GLU  89  -0.636  10.332   1.047
    5    HG2  GLU  89           HG2      GLU  89  -1.476  12.030   2.596
    6    HG3  GLU  89           HG3      GLU  89  -2.527  12.689   1.344

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LEU  90           H        LEU  90   1.805  10.851   1.078
    2    HA   LEU  90           HA       LEU  90   2.139  12.108   3.604
    3    HB2  LEU  90           HB2      LEU  90   3.933  10.340   1.943
    4    HB3  LEU  90           HB3      LEU  90   4.340  10.865   3.581
    5    HG   LEU  90           HG       LEU  90   1.718   9.499   2.912
    6   HD12  LEU  90          HD11      LEU  90   2.867   7.465   3.934
    7   HD11  LEU  90          HD12      LEU  90   4.385   8.330   3.696
    8   HD13  LEU  90          HD13      LEU  90   3.382   7.911   2.306
    9   HD22  LEU  90          HD21      LEU  90   1.437  10.428   5.029
   10   HD21  LEU  90          HD22      LEU  90   3.153  10.334   5.420
   11   HD23  LEU  90          HD23      LEU  90   2.156   8.881   5.469

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  91           H        ILE  91   3.756  12.489   0.484
    2    HA   ILE  91           HA       ILE  91   5.717  14.336   1.327
    3    HB   ILE  91           HB       ILE  91   4.422  13.827  -1.358
    4   HG12  ILE  91          HG12      ILE  91   7.252  13.362  -0.368
    5   HG13  ILE  91          HG13      ILE  91   5.978  12.157  -0.207
    6   HG22  ILE  91          HG21      ILE  91   6.640  15.186  -2.040
    7   HG21  ILE  91          HG22      ILE  91   6.317  15.990  -0.504
    8   HG23  ILE  91          HG23      ILE  91   5.100  16.007  -1.779
    9   HD13  ILE  91          HD11      ILE  91   5.818  11.824  -2.514
   10   HD12  ILE  91          HD12      ILE  91   7.550  12.078  -2.293
   11   HD11  ILE  91          HD13      ILE  91   6.534  13.393  -2.889

  No H/Q in entry =          11
  In of MODEL   86
    1    H    THR  92           H        THR  92   2.357  14.744   0.300
    2    HA   THR  92           HA       THR  92   2.314  17.567   0.229
    3    HB   THR  92           HB       THR  92   0.155  15.562   0.925
    4    HG1  THR  92           HG1      THR  92   0.472  15.377  -1.158
    5   HG22  THR  92          HG21      THR  92  -1.255  17.713   0.188
    6   HG21  THR  92          HG22      THR  92   0.129  18.549   0.889
    7   HG23  THR  92          HG23      THR  92  -0.810  17.425   1.870

  No H/Q in entry =           7
  In of MODEL   86
    1    H    GLU  93           H        GLU  93   1.767  15.273   2.889
    2    HA   GLU  93           HA       GLU  93   1.213  17.181   4.898
    3    HB2  GLU  93           HB2      GLU  93   2.541  14.465   5.150
    4    HB3  GLU  93           HB3      GLU  93   1.838  15.393   6.476
    5    HG2  GLU  93           HG2      GLU  93   0.243  14.597   4.032
    6    HG3  GLU  93           HG3      GLU  93   0.343  13.580   5.465

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LEU  94           H        LEU  94   4.234  15.713   3.768
    2    HA   LEU  94           HA       LEU  94   5.968  16.877   5.661
    3    HB2  LEU  94           HB2      LEU  94   6.390  15.902   2.836
    4    HB3  LEU  94           HB3      LEU  94   7.711  16.571   3.789
    5    HG   LEU  94           HG       LEU  94   5.978  14.369   4.924
    6   HD11  LEU  94          HD11      LEU  94   8.086  14.148   2.804
    7   HD13  LEU  94          HD12      LEU  94   6.644  13.167   3.061
    8   HD12  LEU  94          HD13      LEU  94   8.066  12.926   4.077
    9   HD23  LEU  94          HD21      LEU  94   8.165  13.850   6.089
   10   HD22  LEU  94          HD22      LEU  94   7.487  15.426   6.496
   11   HD21  LEU  94          HD23      LEU  94   8.832  15.309   5.361

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  95           H        ILE  95   4.838  18.031   2.501
    2    HA   ILE  95           HA       ILE  95   6.397  20.397   2.441
    3    HB   ILE  95           HB       ILE  95   3.763  19.693   1.125
    4   HG12  ILE  95          HG12      ILE  95   6.556  20.043   0.001
    5   HG13  ILE  95          HG13      ILE  95   5.913  18.488   0.518
    6   HG21  ILE  95          HG21      ILE  95   5.500  22.170   0.904
    7   HG23  ILE  95          HG22      ILE  95   3.773  22.093   1.252
    8   HG22  ILE  95          HG23      ILE  95   4.367  21.690  -0.360
    9   HD13  ILE  95          HD11      ILE  95   4.362  18.396  -1.219
   10   HD12  ILE  95          HD12      ILE  95   5.710  19.220  -2.003
   11   HD11  ILE  95          HD13      ILE  95   4.330  20.148  -1.421

  No H/Q in entry =          11
  In of MODEL   86
    1    H    GLU  96           H        GLU  96   3.145  19.731   3.722
    2    HA   GLU  96           HA       GLU  96   2.506  22.377   4.461
    3    HB2  GLU  96           HB2      GLU  96   0.842  20.585   4.470
    4    HB3  GLU  96           HB3      GLU  96   1.701  19.767   5.773
    5    HG2  GLU  96           HG2      GLU  96   0.666  21.050   7.333
    6    HG3  GLU  96           HG3      GLU  96   1.197  22.524   6.533

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LEU  97           H        LEU  97   4.355  19.843   6.104
    2    HA   LEU  97           HA       LEU  97   4.692  21.202   8.572
    3    HB2  LEU  97           HB2      LEU  97   6.249  19.037   7.173
    4    HB3  LEU  97           HB3      LEU  97   6.827  19.730   8.686
    5    HG   LEU  97           HG       LEU  97   4.025  18.620   8.365
    6   HD12  LEU  97          HD11      LEU  97   4.970  16.618   9.590
    7   HD11  LEU  97          HD12      LEU  97   6.579  17.256   9.252
    8   HD13  LEU  97          HD13      LEU  97   5.519  16.787   7.922
    9   HD23  LEU  97          HD21      LEU  97   4.467  18.338  10.933
   10   HD22  LEU  97          HD22      LEU  97   4.081  19.945  10.320
   11   HD21  LEU  97          HD23      LEU  97   5.753  19.516  10.675

  No H/Q in entry =          11
  In of MODEL   86
    1    H    HIS  98           H        HIS  98   6.578  21.217   5.556
    2    HA   HIS  98           HA       HIS  98   8.719  22.811   6.460
    3    HB2  HIS  98           HB2      HIS  98   7.441  22.540   3.729
    4    HB3  HIS  98           HB3      HIS  98   8.874  23.527   4.023
    5    HD1  HIS  98           HD1      HIS  98   7.682  19.950   4.049
    6    HD2  HIS  98           HD2      HIS  98  11.250  22.066   4.485
    7    HE1  HIS  98           HE1      HIS  98   9.545  18.230   4.008
    8    HE2  HIS  98           HE2      HIS  98  11.722  19.498   4.274

  No H/Q in entry =           8
  In of MODEL   86
    1    H    GLU  99           H        GLU  99   5.500  23.626   5.265
    2    HA   GLU  99           HA       GLU  99   5.865  26.442   5.199
    3    HB2  GLU  99           HB2      GLU  99   3.997  25.259   4.063
    4    HB3  GLU  99           HB3      GLU  99   3.295  24.900   5.640
    5    HG2  GLU  99           HG2      GLU  99   3.101  27.293   6.132
    6    HG3  GLU  99           HG3      GLU  99   3.882  27.691   4.605

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LYS 100           H        LYS 100   4.732  24.210   7.723
    2    HA   LYS 100           HA       LYS 100   4.126  26.268   9.607
    3    HB2  LYS 100           HB2      LYS 100   4.714  23.321   9.966
    4    HB3  LYS 100           HB3      LYS 100   4.255  24.396  11.292
    5    HG2  LYS 100           HG2      LYS 100   2.192  25.019  10.032
    6    HG3  LYS 100           HG3      LYS 100   2.631  23.848   8.785
    7    HD2  LYS 100           HD2      LYS 100   2.554  22.033  10.453
    8    HD3  LYS 100           HD3      LYS 100   2.132  23.198  11.710
    9    HE2  LYS 100           HE2      LYS 100   0.082  23.805  10.434
   10    HE3  LYS 100           HE3      LYS 100   0.494  22.583   9.225
   11    HZ1  LYS 100           HZ1      LYS 100   0.217  21.925  12.107
   12    HZ3  LYS 100           HZ2      LYS 100   0.213  20.866  10.776
   13    HZ2  LYS 100           HZ3      LYS 100  -1.108  21.900  11.045

  No H/Q in entry =          13
  In of MODEL   86
    1    H    LEU 101           H        LEU 101   7.062  24.484   8.794
    2    HA   LEU 101           HA       LEU 101   8.646  25.339  11.003
    3    HB2  LEU 101           HB2      LEU 101   9.259  24.345   8.232
    4    HB3  LEU 101           HB3      LEU 101  10.553  25.020   9.217
    5    HG   LEU 101           HG       LEU 101   8.726  22.859  10.279
    6   HD12  LEU 101          HD11      LEU 101  10.789  21.371   9.687
    7   HD11  LEU 101          HD12      LEU 101  11.157  22.632   8.512
    8   HD13  LEU 101          HD13      LEU 101   9.632  21.752   8.413
    9   HD21  LEU 101          HD21      LEU 101  11.441  23.982  11.017
   10   HD23  LEU 101          HD22      LEU 101  10.902  22.409  11.599
   11   HD22  LEU 101          HD23      LEU 101  10.001  23.863  12.028

  No H/Q in entry =          11
  In of MODEL   86
    1    H    LYS 102           H        LYS 102   7.065  27.188   8.847
    2    HA   LYS 102           HA       LYS 102   7.134  29.480   8.548
    3    HB2  LYS 102           HB2      LYS 102   8.688  29.379  10.655
    4    HB3  LYS 102           HB3      LYS 102   9.993  29.575   9.501
    5    HG2  LYS 102           HG2      LYS 102   7.874  31.522  10.345
    6    HG3  LYS 102           HG3      LYS 102   9.587  31.788  10.102
    7    HD2  LYS 102           HD2      LYS 102   7.649  31.349   7.793
    8    HD3  LYS 102           HD3      LYS 102   8.022  32.932   8.458
    9    HE2  LYS 102           HE2      LYS 102   9.411  31.747   6.396
   10    HE3  LYS 102           HE3      LYS 102  10.016  33.059   7.405
   11    HZ2  LYS 102           HZ1      LYS 102  11.546  31.161   7.245
   12    HZ1  LYS 102           HZ2      LYS 102  10.384  30.176   7.985
   13    HZ3  LYS 102           HZ3      LYS 102  11.067  31.469   8.843

  No H/Q in entry =          13
  In of MODEL   86
    1    H    ALA 103           H        ALA 103  10.399  28.153   8.005
    2    HA   ALA 103           HA       ALA 103  11.368  29.527   5.929
    3    HB2  ALA 103           HB1      ALA 103  12.267  27.313   5.014
    4    HB1  ALA 103           HB2      ALA 103  11.369  26.539   6.318
    5    HB3  ALA 103           HB3      ALA 103  12.652  27.690   6.693

  No H/Q in entry =           5
  In of MODEL   86
    1    H1   LYS   3           H1       LYS   3 -31.317   6.494 -19.452
    2    H2   LYS   3           H3       LYS   3 -30.341   6.228 -20.816
    3    H3   LYS   3           H2       LYS   3 -31.736   5.292 -20.574
    4    HA   LYS   3           HA       LYS   3 -30.726   3.874 -19.207
    5    HB2  LYS   3           HB2      LYS   3 -28.452   5.304 -20.531
    6    HB3  LYS   3           HB3      LYS   3 -28.120   4.071 -19.314
    7    HG2  LYS   3           HG2      LYS   3 -29.558   2.515 -20.682
    8    HG3  LYS   3           HG3      LYS   3 -29.519   3.741 -21.950
    9    HD2  LYS   3           HD2      LYS   3 -27.037   3.619 -21.923
   10    HD3  LYS   3           HD3      LYS   3 -27.149   2.298 -20.761
   11    HE2  LYS   3           HE2      LYS   3 -28.666   1.160 -22.486
   12    HE3  LYS   3           HE3      LYS   3 -28.053   2.359 -23.625
   13    HZ3  LYS   3           HZ1      LYS   3 -26.261   1.131 -23.933
   14    HZ2  LYS   3           HZ2      LYS   3 -26.885  -0.056 -22.891
   15    HZ1  LYS   3           HZ3      LYS   3 -25.887   1.173 -22.277

  No H/Q in entry =          15
  In of MODEL   86
    1    H    LYS   4           H        LYS   4 -30.762   3.691 -17.148
    2    HA   LYS   4           HA       LYS   4 -30.009   5.943 -15.460
    3    HB2  LYS   4           HB2      LYS   4 -31.214   3.241 -14.802
    4    HB3  LYS   4           HB3      LYS   4 -30.979   4.557 -13.653
    5    HG2  LYS   4           HG2      LYS   4 -32.808   4.548 -16.060
    6    HG3  LYS   4           HG3      LYS   4 -33.283   4.568 -14.363
    7    HD2  LYS   4           HD2      LYS   4 -32.576   6.782 -14.058
    8    HD3  LYS   4           HD3      LYS   4 -31.548   6.747 -15.491
    9    HE2  LYS   4           HE2      LYS   4 -33.473   8.137 -15.911
   10    HE3  LYS   4           HE3      LYS   4 -33.567   6.684 -16.907
   11    HZ3  LYS   4           HZ1      LYS   4 -35.134   5.749 -15.363
   12    HZ2  LYS   4           HZ2      LYS   4 -35.687   7.258 -15.915
   13    HZ1  LYS   4           HZ3      LYS   4 -35.018   7.114 -14.360

  No H/Q in entry =          13
  In of MODEL   86
    1    H    HIS   5           H        HIS   5 -28.527   5.990 -13.880
    2    HA   HIS   5           HA       HIS   5 -26.256   4.158 -14.266
    3    HB2  HIS   5           HB2      HIS   5 -26.487   6.890 -13.004
    4    HB3  HIS   5           HB3      HIS   5 -25.010   5.929 -13.019
    5    HD1  HIS   5           HD1      HIS   5 -23.547   7.151 -14.598
    6    HD2  HIS   5           HD2      HIS   5 -27.364   6.579 -16.130
    7    HE1  HIS   5           HE1      HIS   5 -23.397   7.778 -17.038
    8    HE2  HIS   5           HE2      HIS   5 -25.725   7.417 -17.941

  No H/Q in entry =           8
  In of MODEL   86
    1    H    ILE   6           H        ILE   6 -26.024   2.559 -12.982
    2    HA   ILE   6           HA       ILE   6 -26.974   2.779 -10.205
    3    HB   ILE   6           HB       ILE   6 -26.176   0.338 -11.797
    4   HG12  ILE   6          HG12      ILE   6 -28.907   1.273 -10.904
    5   HG13  ILE   6          HG13      ILE   6 -28.278   1.463 -12.541
    6   HG23  ILE   6          HG21      ILE   6 -26.541  -0.948  -9.957
    7   HG22  ILE   6          HG22      ILE   6 -27.686   0.191  -9.246
    8   HG21  ILE   6          HG23      ILE   6 -25.954   0.515  -9.166
    9   HD13  ILE   6          HD11      ILE   6 -28.754  -0.644 -13.078
   10   HD12  ILE   6          HD12      ILE   6 -29.757  -0.650 -11.626
   11   HD11  ILE   6          HD13      ILE   6 -28.106  -1.268 -11.560

  No H/Q in entry =          11
  In of MODEL   86
    1    H    TYR   7           H        TYR   7 -25.200   3.384  -8.921
    2    HA   TYR   7           HA       TYR   7 -22.501   2.424  -9.643
    3    HB2  TYR   7           HB2      TYR   7 -23.437   4.836  -8.107
    4    HB3  TYR   7           HB3      TYR   7 -21.756   4.311  -8.169
    5    HD1  TYR   7           HD1      TYR   7 -22.828   3.435 -11.268
    6    HD2  TYR   7           HD2      TYR   7 -22.116   6.959  -8.980
    7    HE1  TYR   7           HE1      TYR   7 -22.406   4.702 -13.339
    8    HE2  TYR   7           HE2      TYR   7 -21.738   8.232 -11.042
    9    HH   TYR   7           HH       TYR   7 -21.975   8.189 -13.273

  No H/Q in entry =           9
  In of MODEL   86
    1    H    LEU   8           H        LEU   8 -21.533   1.042  -8.349
    2    HA   LEU   8           HA       LEU   8 -22.643   0.502  -5.666
    3    HB2  LEU   8           HB2      LEU   8 -20.967  -1.136  -7.546
    4    HB3  LEU   8           HB3      LEU   8 -21.140  -1.550  -5.840
    5    HG   LEU   8           HG       LEU   8 -23.625  -1.699  -6.244
    6   HD13  LEU   8          HD11      LEU   8 -23.766  -0.442  -8.329
    7   HD12  LEU   8          HD12      LEU   8 -24.308  -2.097  -8.597
    8   HD11  LEU   8          HD13      LEU   8 -22.702  -1.599  -9.126
    9   HD23  LEU   8          HD21      LEU   8 -22.379  -3.715  -7.988
   10   HD22  LEU   8          HD22      LEU   8 -23.455  -3.901  -6.604
   11   HD21  LEU   8          HD23      LEU   8 -21.744  -3.565  -6.350

  No H/Q in entry =          11
  In of MODEL   86
    1    H    PHE   9           H        PHE   9 -21.353   0.862  -3.880
    2    HA   PHE   9           HA       PHE   9 -18.566   1.785  -4.403
    3    HB2  PHE   9           HB2      PHE   9 -20.548   2.834  -2.386
    4    HB3  PHE   9           HB3      PHE   9 -18.839   3.245  -2.397
    5    HD1  PHE   9           HD1      PHE   9 -17.877   4.609  -4.171
    6    HD2  PHE   9           HD2      PHE   9 -22.062   3.663  -4.132
    7    HE1  PHE   9           HE1      PHE   9 -18.285   6.335  -5.899
    8    HE2  PHE   9           HE2      PHE   9 -22.470   5.401  -5.854
    9    HZ   PHE   9           HZ       PHE   9 -20.580   6.734  -6.744

  No H/Q in entry =           9
  In of MODEL   86
    1    H    SER  10           H        SER  10 -16.979   0.794  -3.339
    2    HA   SER  10           HA       SER  10 -17.156  -0.148  -0.659
    3    HB2  SER  10           HB2      SER  10 -18.403  -1.983  -1.768
    4    HB3  SER  10           HB3      SER  10 -17.025  -2.249  -2.824
    5    HG   SER  10           HG       SER  10 -16.642  -3.616  -1.217

  No H/Q in entry =           5
  In of MODEL   86
    1    H    SER  11           H        SER  11 -15.130  -0.022   0.147
    2    HA   SER  11           HA       SER  11 -12.971   0.852  -1.397
    3    HB2  SER  11           HB2      SER  11 -13.413   0.879   1.190
    4    HB3  SER  11           HB3      SER  11 -12.477  -0.617   1.150
    5    HG   SER  11           HG       SER  11 -10.801   0.640   1.040

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ALA  12           H        ALA  12 -14.180  -1.831  -2.255
    2    HA   ALA  12           HA       ALA  12 -11.604  -3.036  -2.875
    3    HB3  ALA  12           HB1      ALA  12 -12.142  -4.262  -0.869
    4    HB2  ALA  12           HB2      ALA  12 -12.393  -5.327  -2.250
    5    HB1  ALA  12           HB3      ALA  12 -13.777  -4.583  -1.450

  No H/Q in entry =           5
  In of MODEL   86
    1    H    GLY  13           H        GLY  13 -12.338  -2.054  -4.882
    2    HA3  GLY  13           HA2      GLY  13 -14.623  -2.659  -6.326
    3    HA2  GLY  13           HA3      GLY  13 -13.067  -2.258  -7.066

  No H/Q in entry =           3
  In of MODEL   86
    1    H    MET  14           H        MET  14 -11.590  -4.561  -6.263
    2    HA   MET  14           HA       MET  14 -12.137  -6.294  -8.352
    3    HB2  MET  14           HB2      MET  14 -10.000  -6.403  -7.164
    4    HB3  MET  14           HB3      MET  14 -10.791  -7.087  -5.746
    5    HG2  MET  14           HG2      MET  14 -11.478  -9.050  -7.104
    6    HG3  MET  14           HG3      MET  14 -10.657  -8.359  -8.503
    7    HE1  MET  14           HE1      MET  14  -8.452  -7.846  -8.769
    8    HE3  MET  14           HE2      MET  14  -7.050  -8.546  -7.962
    9    HE2  MET  14           HE3      MET  14  -7.841  -7.134  -7.268

  No H/Q in entry =           9
  In of MODEL   86
    1    H    SER  15           H        SER  15 -13.208  -6.766  -4.980
    2    HA   SER  15           HA       SER  15 -14.588  -9.211  -5.620
    3    HB2  SER  15           HB2      SER  15 -14.976  -7.415  -3.207
    4    HB3  SER  15           HB3      SER  15 -15.706  -9.003  -3.430
    5    HG   SER  15           HG       SER  15 -13.270  -8.406  -2.519

  No H/Q in entry =           5
  In of MODEL   86
    1    H    THR  16           H        THR  16 -15.672  -5.830  -5.196
    2    HA   THR  16           HA       THR  16 -18.464  -6.346  -5.702
    3    HB   THR  16           HB       THR  16 -16.934  -3.767  -6.192
    4    HG1  THR  16           HG1      THR  16 -16.595  -4.714  -4.078
    5   HG23  THR  16          HG21      THR  16 -19.017  -2.699  -5.970
    6   HG22  THR  16          HG22      THR  16 -19.759  -4.104  -5.187
    7   HG21  THR  16          HG23      THR  16 -19.394  -4.131  -6.918

  No H/Q in entry =           7
  In of MODEL   86
    1    H    SER  17           H        SER  17 -15.654  -5.763  -7.573
    2    HA   SER  17           HA       SER  17 -16.796  -4.969 -10.051
    3    HB2  SER  17           HB2      SER  17 -14.172  -6.336  -9.415
    4    HB3  SER  17           HB3      SER  17 -14.625  -5.818 -11.039
    5    HG   SER  17           HG       SER  17 -15.065  -3.761  -9.514

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LEU  18           H        LEU  18 -16.234  -8.143  -8.667
    2    HA   LEU  18           HA       LEU  18 -16.845  -9.595 -11.046
    3    HB2  LEU  18           HB2      LEU  18 -15.618 -10.607  -9.182
    4    HB3  LEU  18           HB3      LEU  18 -17.027 -10.409  -8.139
    5    HG   LEU  18           HG       LEU  18 -18.302 -11.950  -9.534
    6   HD13  LEU  18          HD11      LEU  18 -17.535 -11.741 -11.717
    7   HD12  LEU  18          HD12      LEU  18 -16.784 -13.262 -11.233
    8   HD11  LEU  18          HD13      LEU  18 -15.841 -11.773 -11.231
    9   HD21  LEU  18          HD21      LEU  18 -16.759 -12.686  -7.666
   10   HD23  LEU  18          HD22      LEU  18 -15.675 -13.244  -8.940
   11   HD22  LEU  18          HD23      LEU  18 -17.299 -13.917  -8.809

  No H/Q in entry =          11
  In of MODEL   86
    1    H    LEU  19           H        LEU  19 -18.788  -8.428  -8.298
    2    HA   LEU  19           HA       LEU  19 -21.264  -9.583  -9.134
    3    HB2  LEU  19           HB2      LEU  19 -20.961  -8.788  -6.867
    4    HB3  LEU  19           HB3      LEU  19 -20.697  -7.146  -7.453
    5    HG   LEU  19           HG       LEU  19 -23.025  -6.962  -8.096
    6   HD12  LEU  19          HD11      LEU  19 -24.494  -8.928  -7.118
    7   HD11  LEU  19          HD12      LEU  19 -23.034  -9.868  -7.420
    8   HD13  LEU  19          HD13      LEU  19 -23.826  -9.021  -8.747
    9   HD23  LEU  19          HD21      LEU  19 -24.018  -7.215  -5.790
   10   HD22  LEU  19          HD22      LEU  19 -22.543  -6.255  -5.901
   11   HD21  LEU  19          HD23      LEU  19 -22.473  -7.911  -5.300

  No H/Q in entry =          11
  In of MODEL   86
    1    H    VAL  20           H        VAL  20 -19.757  -6.418  -9.780
    2    HA   VAL  20           HA       VAL  20 -21.874  -5.336 -11.314
    3    HB   VAL  20           HB       VAL  20 -18.883  -4.757 -11.441
    4   HG13  VAL  20          HG11      VAL  20 -19.757  -4.129 -13.591
    5   HG12  VAL  20          HG12      VAL  20 -19.600  -2.651 -12.642
    6   HG11  VAL  20          HG13      VAL  20 -21.184  -3.396 -12.860
    7   HG21  VAL  20          HG21      VAL  20 -21.214  -3.501 -10.051
    8   HG23  VAL  20          HG22      VAL  20 -19.763  -2.572 -10.417
    9   HG22  VAL  20          HG23      VAL  20 -19.657  -4.001  -9.389

  No H/Q in entry =           9
  In of MODEL   86
    1    H    SER  21           H        SER  21 -19.135  -7.380 -12.400
    2    HA   SER  21           HA       SER  21 -19.940  -7.212 -15.143
    3    HB2  SER  21           HB2      SER  21 -18.517  -9.181 -15.523
    4    HB3  SER  21           HB3      SER  21 -17.674  -7.956 -14.577
    5    HG   SER  21           HG       SER  21 -18.893 -10.325 -13.644

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LYS  22           H        LYS  22 -20.997  -9.441 -12.604
    2    HA   LYS  22           HA       LYS  22 -22.559 -11.017 -14.445
    3    HB2  LYS  22           HB2      LYS  22 -22.837 -10.720 -11.451
    4    HB3  LYS  22           HB3      LYS  22 -23.642 -11.934 -12.444
    5    HG2  LYS  22           HG2      LYS  22 -20.654 -11.709 -12.122
    6    HG3  LYS  22           HG3      LYS  22 -21.682 -12.793 -11.187
    7    HD2  LYS  22           HD2      LYS  22 -22.390 -13.892 -13.281
    8    HD3  LYS  22           HD3      LYS  22 -21.300 -12.837 -14.182
    9    HE2  LYS  22           HE2      LYS  22 -19.965 -14.223 -11.985
   10    HE3  LYS  22           HE3      LYS  22 -20.679 -15.334 -13.155
   11    HZ1  LYS  22           HZ1      LYS  22 -19.468 -13.628 -14.780
   12    HZ3  LYS  22           HZ2      LYS  22 -18.725 -15.030 -14.173
   13    HZ2  LYS  22           HZ3      LYS  22 -18.430 -13.526 -13.440

  No H/Q in entry =          13
  In of MODEL   86
    1    H    MET  23           H        MET  23 -23.251  -8.128 -12.516
    2    HA   MET  23           HA       MET  23 -26.061  -8.179 -13.002
    3    HB2  MET  23           HB2      MET  23 -24.195  -5.894 -12.400
    4    HB3  MET  23           HB3      MET  23 -25.942  -5.710 -12.561
    5    HG2  MET  23           HG2      MET  23 -26.326  -7.048 -10.615
    6    HG3  MET  23           HG3      MET  23 -24.618  -7.473 -10.510
    7    HE2  MET  23           HE1      MET  23 -26.883  -3.830  -9.234
    8    HE1  MET  23           HE2      MET  23 -27.154  -4.769 -10.700
    9    HE3  MET  23           HE3      MET  23 -26.110  -3.348 -10.745

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ARG  24           H        ARG  24 -23.312  -6.735 -14.779
    2    HA   ARG  24           HA       ARG  24 -24.815  -5.386 -16.741
    3    HB2  ARG  24           HB2      ARG  24 -22.360  -5.025 -16.360
    4    HB3  ARG  24           HB3      ARG  24 -22.050  -6.602 -17.046
    5    HG2  ARG  24           HG2      ARG  24 -21.621  -5.231 -18.902
    6    HG3  ARG  24           HG3      ARG  24 -23.346  -5.607 -19.152
    7    HD2  ARG  24           HD2      ARG  24 -23.043  -3.188 -19.341
    8    HD3  ARG  24           HD3      ARG  24 -23.918  -3.556 -17.860
    9    HE   ARG  24           HE       ARG  24 -22.356  -2.623 -16.608
   10   HH21  ARG  24          HH11      ARG  24 -21.036  -0.808 -16.731
   11   HH22  ARG  24          HH12      ARG  24 -19.705  -0.791 -17.835
   12   HH11  ARG  24          HH21      ARG  24 -20.815  -3.767 -19.395
   13   HH12  ARG  24          HH22      ARG  24 -19.578  -2.551 -19.401

  No H/Q in entry =          13
  In of MODEL   86
    1    H    ALA  25           H        ALA  25 -23.716  -8.737 -16.539
    2    HA   ALA  25           HA       ALA  25 -24.370  -9.512 -19.187
    3    HB1  ALA  25           HB1      ALA  25 -23.685 -11.562 -18.537
    4    HB3  ALA  25           HB2      ALA  25 -24.732 -11.561 -17.118
    5    HB2  ALA  25           HB3      ALA  25 -23.170 -10.747 -17.061

  No H/Q in entry =           5
  In of MODEL   86
    1    H    GLN  26           H        GLN  26 -26.175  -9.596 -16.152
    2    HA   GLN  26           HA       GLN  26 -28.536 -10.759 -17.175
    3    HB2  GLN  26           HB2      GLN  26 -27.992  -9.064 -14.757
    4    HB3  GLN  26           HB3      GLN  26 -29.563  -9.767 -15.110
    5    HG2  GLN  26           HG2      GLN  26 -26.986 -11.254 -14.689
    6    HG3  GLN  26           HG3      GLN  26 -28.337 -11.162 -13.568
    7   HE21  GLN  26          HE21      GLN  26 -27.147 -13.310 -14.896
    8   HE22  GLN  26          HE22      GLN  26 -28.204 -14.334 -15.706

  No H/Q in entry =           8
  In of MODEL   86
    1    H    ALA  27           H        ALA  27 -27.571  -7.378 -16.722
    2    HA   ALA  27           HA       ALA  27 -30.056  -6.250 -17.466
    3    HB1  ALA  27           HB1      ALA  27 -28.228  -4.972 -16.338
    4    HB3  ALA  27           HB2      ALA  27 -28.822  -4.172 -17.793
    5    HB2  ALA  27           HB3      ALA  27 -27.295  -5.050 -17.833

  No H/Q in entry =           5
  In of MODEL   86
    1    H    GLU  28           H        GLU  28 -27.379  -7.456 -19.380
    2    HA   GLU  28           HA       GLU  28 -28.323  -6.358 -21.869
    3    HB2  GLU  28           HB2      GLU  28 -25.946  -7.073 -21.277
    4    HB3  GLU  28           HB3      GLU  28 -26.506  -8.728 -21.509
    5    HG2  GLU  28           HG2      GLU  28 -25.367  -7.921 -23.469
    6    HG3  GLU  28           HG3      GLU  28 -27.070  -8.223 -23.812

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LYS  29           H        LYS  29 -28.503  -9.495 -20.275
    2    HA   LYS  29           HA       LYS  29 -29.834 -10.913 -22.301
    3    HB2  LYS  29           HB2      LYS  29 -28.778 -11.946 -20.325
    4    HB3  LYS  29           HB3      LYS  29 -30.037 -11.250 -19.306
    5    HG2  LYS  29           HG2      LYS  29 -31.716 -12.586 -20.390
    6    HG3  LYS  29           HG3      LYS  29 -30.530 -13.208 -21.536
    7    HD2  LYS  29           HD2      LYS  29 -29.386 -14.419 -19.836
    8    HD3  LYS  29           HD3      LYS  29 -30.277 -13.597 -18.557
    9    HE2  LYS  29           HE2      LYS  29 -31.051 -15.932 -18.962
   10    HE3  LYS  29           HE3      LYS  29 -32.321 -14.724 -19.172
   11    HZ1  LYS  29           HZ1      LYS  29 -31.775 -14.812 -21.606
   12    HZ3  LYS  29           HZ2      LYS  29 -32.501 -16.206 -20.964
   13    HZ2  LYS  29           HZ3      LYS  29 -30.834 -16.186 -21.273

  No H/Q in entry =          13
  In of MODEL   86
    1    H    TYR  30           H        TYR  30 -31.190  -8.849 -19.744
    2    HA   TYR  30           HA       TYR  30 -33.865  -9.250 -20.975
    3    HB2  TYR  30           HB2      TYR  30 -33.183  -8.159 -18.235
    4    HB3  TYR  30           HB3      TYR  30 -34.807  -8.390 -18.882
    5    HD1  TYR  30           HD1      TYR  30 -35.739 -10.669 -19.136
    6    HD2  TYR  30           HD2      TYR  30 -31.886 -10.014 -17.446
    7    HE1  TYR  30           HE1      TYR  30 -35.662 -13.014 -18.389
    8    HE2  TYR  30           HE2      TYR  30 -31.810 -12.344 -16.702
    9    HH   TYR  30           HH       TYR  30 -33.477 -14.669 -17.832

  No H/Q in entry =           9
  In of MODEL   86
    1    H    GLU  31           H        GLU  31 -31.689  -7.261 -21.749
    2    HA   GLU  31           HA       GLU  31 -31.603  -5.087 -22.527
    3    HB2  GLU  31           HB2      GLU  31 -34.507  -5.769 -23.034
    4    HB3  GLU  31           HB3      GLU  31 -33.660  -4.393 -23.740
    5    HG2  GLU  31           HG2      GLU  31 -32.208  -5.816 -24.973
    6    HG3  GLU  31           HG3      GLU  31 -32.778  -7.244 -24.110

  No H/Q in entry =           6
  In of MODEL   86
    1    H    VAL  32           H        VAL  32 -31.781  -5.041 -19.792
    2    HA   VAL  32           HA       VAL  32 -33.624  -2.928 -19.076
    3    HB   VAL  32           HB       VAL  32 -31.227  -3.972 -17.534
    4   HG12  VAL  32          HG11      VAL  32 -32.743  -3.178 -15.610
    5   HG11  VAL  32          HG12      VAL  32 -33.578  -2.241 -16.849
    6   HG13  VAL  32          HG13      VAL  32 -31.867  -1.956 -16.535
    7   HG21  VAL  32          HG21      VAL  32 -33.013  -5.665 -18.244
    8   HG23  VAL  32          HG22      VAL  32 -34.038  -4.855 -17.060
    9   HG22  VAL  32          HG23      VAL  32 -32.523  -5.600 -16.551

  No H/Q in entry =           9
  In of MODEL   86
    1    HA   PRO  33           HA       PRO  33 -30.582   0.013 -20.710
    2    HB2  PRO  33           HB2      PRO  33 -32.077   2.243 -20.528
    3    HB3  PRO  33           HB3      PRO  33 -32.562   0.968 -21.646
    4    HG2  PRO  33           HG2      PRO  33 -33.507   1.431 -18.816
    5    HG3  PRO  33           HG3      PRO  33 -34.483   1.260 -20.275
    6    HD2  PRO  33           HD2      PRO  33 -34.029  -0.851 -18.656
    7    HD3  PRO  33           HD3      PRO  33 -34.106  -1.055 -20.407

  No H/Q in entry =           7
  In of MODEL   86
    1    H    VAL  34           H        VAL  34 -29.308  -0.580 -18.781
    2    HA   VAL  34           HA       VAL  34 -28.996   1.807 -17.086
    3    HB   VAL  34           HB       VAL  34 -28.411   0.301 -15.183
    4   HG12  VAL  34          HG11      VAL  34 -30.827  -0.563 -14.877
    5   HG11  VAL  34          HG12      VAL  34 -31.150   0.233 -16.416
    6   HG13  VAL  34          HG13      VAL  34 -30.581   1.175 -15.039
    7   HG21  VAL  34          HG21      VAL  34 -28.624  -1.681 -17.232
    8   HG23  VAL  34          HG22      VAL  34 -29.673  -2.064 -15.867
    9   HG22  VAL  34          HG23      VAL  34 -27.952  -1.794 -15.605

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ILE  35           H        ILE  35 -27.011   2.212 -16.251
    2    HA   ILE  35           HA       ILE  35 -24.724   0.895 -17.558
    3    HB   ILE  35           HB       ILE  35 -25.101   3.770 -16.683
    4   HG12  ILE  35          HG12      ILE  35 -24.144   2.512 -19.262
    5   HG13  ILE  35          HG13      ILE  35 -25.769   3.136 -18.978
    6   HG21  ILE  35          HG21      ILE  35 -22.550   2.229 -17.044
    7   HG23  ILE  35          HG22      ILE  35 -22.988   3.384 -15.787
    8   HG22  ILE  35          HG23      ILE  35 -22.615   3.951 -17.414
    9   HD11  ILE  35          HD11      ILE  35 -24.350   5.309 -18.341
   10   HD13  ILE  35          HD12      ILE  35 -24.901   4.964 -19.980
   11   HD12  ILE  35          HD13      ILE  35 -23.248   4.574 -19.505

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ILE  36           H        ILE  36 -23.489  -0.169 -15.990
    2    HA   ILE  36           HA       ILE  36 -23.904   0.387 -13.104
    3    HB   ILE  36           HB       ILE  36 -23.102  -2.296 -14.276
    4   HG12  ILE  36          HG12      ILE  36 -25.899  -1.491 -13.474
    5   HG13  ILE  36          HG13      ILE  36 -25.338  -1.438 -15.145
    6   HG23  ILE  36          HG21      ILE  36 -23.442  -3.168 -12.177
    7   HG22  ILE  36          HG22      ILE  36 -24.558  -1.888 -11.703
    8   HG21  ILE  36          HG23      ILE  36 -22.827  -1.564 -11.780
    9   HD13  ILE  36          HD11      ILE  36 -25.519  -3.646 -15.398
   10   HD12  ILE  36          HD12      ILE  36 -26.573  -3.548 -13.989
   11   HD11  ILE  36          HD13      ILE  36 -24.876  -3.982 -13.791

  No H/Q in entry =          11
  In of MODEL   86
    1    H    GLU  37           H        GLU  37 -22.112   0.982 -11.999
    2    HA   GLU  37           HA       GLU  37 -19.433   0.190 -12.953
    3    HB2  GLU  37           HB2      GLU  37 -20.291   2.970 -12.163
    4    HB3  GLU  37           HB3      GLU  37 -18.614   2.461 -12.367
    5    HG2  GLU  37           HG2      GLU  37 -20.691   2.525 -14.537
    6    HG3  GLU  37           HG3      GLU  37 -19.459   3.754 -14.260

  No H/Q in entry =           6
  In of MODEL   86
    1    H    ALA  38           H        ALA  38 -17.935  -0.092 -11.287
    2    HA   ALA  38           HA       ALA  38 -18.945   0.034  -8.505
    3    HB1  ALA  38           HB1      ALA  38 -17.252  -1.884  -9.985
    4    HB3  ALA  38           HB2      ALA  38 -18.292  -2.143  -8.584
    5    HB2  ALA  38           HB3      ALA  38 -16.675  -1.474  -8.368

  No H/Q in entry =           5
  In of MODEL   86
    1    H    PHE  39           H        PHE  39 -17.687   1.205  -7.015
    2    HA   PHE  39           HA       PHE  39 -15.163   2.414  -7.905
    3    HB2  PHE  39           HB2      PHE  39 -17.560   3.893  -6.836
    4    HB3  PHE  39           HB3      PHE  39 -15.927   4.551  -6.753
    5    HD1  PHE  39           HD1      PHE  39 -14.635   4.588  -9.026
    6    HD2  PHE  39           HD2      PHE  39 -18.876   4.405  -8.635
    7    HE1  PHE  39           HE1      PHE  39 -14.872   5.509 -11.315
    8    HE2  PHE  39           HE2      PHE  39 -19.131   5.315 -10.916
    9    HZ   PHE  39           HZ       PHE  39 -17.135   5.842 -12.275

  No H/Q in entry =           9
  In of MODEL   86
    1    HA   PRO  40           HA       PRO  40 -14.196   1.565  -3.642
    2    HB2  PRO  40           HB2      PRO  40 -12.417   3.560  -3.007
    3    HB3  PRO  40           HB3      PRO  40 -11.986   2.250  -4.106
    4    HG2  PRO  40           HG2      PRO  40 -13.005   5.004  -4.786
    5    HG3  PRO  40           HG3      PRO  40 -11.587   4.171  -5.421
    6    HD2  PRO  40           HD2      PRO  40 -13.820   4.120  -6.816
    7    HD3  PRO  40           HD3      PRO  40 -12.869   2.644  -6.661

  No H/Q in entry =           7
  In of MODEL   86
    1    H    GLU  41           H        GLU  41 -14.799   2.500  -1.488
    2    HA   GLU  41           HA       GLU  41 -17.036   4.210  -1.418
    3    HB2  GLU  41           HB2      GLU  41 -16.635   4.252   1.039
    4    HB3  GLU  41           HB3      GLU  41 -16.677   2.628   0.354
    5    HG2  GLU  41           HG2      GLU  41 -14.907   2.473   1.810
    6    HG3  GLU  41           HG3      GLU  41 -14.091   2.864   0.296

  No H/Q in entry =           6
  In of MODEL   86
    1    H    THR  42           H        THR  42 -13.703   5.117  -1.475
    2    HA   THR  42           HA       THR  42 -14.038   7.652  -0.207
    3    HB   THR  42           HB       THR  42 -11.886   8.243  -1.283
    4    HG1  THR  42           HG1      THR  42 -12.661   6.628  -3.117
    5   HG22  THR  42          HG21      THR  42 -11.767   5.383  -0.322
    6   HG21  THR  42          HG22      THR  42 -12.060   6.736   0.773
    7   HG23  THR  42          HG23      THR  42 -10.550   6.646  -0.131

  No H/Q in entry =           7
  In of MODEL   86
    1    H    LEU  43           H        LEU  43 -14.969   6.627  -3.323
    2    HA   LEU  43           HA       LEU  43 -15.220   9.420  -4.232
    3    HB2  LEU  43           HB2      LEU  43 -15.598   6.803  -5.677
    4    HB3  LEU  43           HB3      LEU  43 -15.818   8.396  -6.399
    5    HG   LEU  43           HG       LEU  43 -13.196   7.279  -5.434
    6   HD12  LEU  43          HD11      LEU  43 -13.980   7.799  -8.281
    7   HD11  LEU  43          HD12      LEU  43 -14.334   6.253  -7.514
    8   HD13  LEU  43          HD13      LEU  43 -12.666   6.803  -7.654
    9   HD22  LEU  43          HD21      LEU  43 -13.166   9.659  -5.279
   10   HD21  LEU  43          HD22      LEU  43 -13.988   9.835  -6.830
   11   HD23  LEU  43          HD23      LEU  43 -12.329   9.241  -6.774

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ALA  44           H        ALA  44 -17.158   7.562  -2.404
    2    HA   ALA  44           HA       ALA  44 -19.646   7.457  -3.710
    3    HB2  ALA  44           HB1      ALA  44 -19.496   6.296  -1.639
    4    HB3  ALA  44           HB2      ALA  44 -20.597   7.639  -1.329
    5    HB1  ALA  44           HB3      ALA  44 -18.922   7.730  -0.788

  No H/Q in entry =           5
  In of MODEL   86
    1    H    GLY  45           H        GLY  45 -18.207  10.220  -2.130
    2    HA3  GLY  45           HA2      GLY  45 -20.642  11.735  -2.441
    3    HA2  GLY  45           HA3      GLY  45 -19.091  12.342  -1.862

  No H/Q in entry =           3
  In of MODEL   86
    1    H    GLU  46           H        GLU  46 -17.580  11.449  -4.183
    2    HA   GLU  46           HA       GLU  46 -18.223  13.703  -5.901
    3    HB2  GLU  46           HB2      GLU  46 -16.038  11.617  -6.002
    4    HB3  GLU  46           HB3      GLU  46 -16.169  12.980  -7.114
    5    HG2  GLU  46           HG2      GLU  46 -15.798  13.198  -4.134
    6    HG3  GLU  46           HG3      GLU  46 -14.512  13.343  -5.334

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LYS  47           H        LYS  47 -18.117  10.195  -6.410
    2    HA   LYS  47           HA       LYS  47 -19.234  10.473  -9.072
    3    HB2  LYS  47           HB2      LYS  47 -18.055   8.338  -7.448
    4    HB3  LYS  47           HB3      LYS  47 -19.441   7.815  -8.405
    5    HG2  LYS  47           HG2      LYS  47 -17.407   7.421  -9.624
    6    HG3  LYS  47           HG3      LYS  47 -18.344   8.685 -10.420
    7    HD2  LYS  47           HD2      LYS  47 -16.959  10.395  -9.386
    8    HD3  LYS  47           HD3      LYS  47 -16.047   9.155  -8.526
    9    HE2  LYS  47           HE2      LYS  47 -15.273   8.237 -10.644
   10    HE3  LYS  47           HE3      LYS  47 -16.212   9.445 -11.519
   11    HZ2  LYS  47           HZ1      LYS  47 -13.653   9.677 -10.318
   12    HZ1  LYS  47           HZ2      LYS  47 -14.712  10.862  -9.721
   13    HZ3  LYS  47           HZ3      LYS  47 -14.440  10.730 -11.393

  No H/Q in entry =          13
  In of MODEL   86
    1    H    GLY  48           H        GLY  48 -20.537   9.655  -5.931
    2    HA3  GLY  48           HA2      GLY  48 -22.931   8.491  -6.678
    3    HA2  GLY  48           HA3      GLY  48 -22.691   9.455  -5.221

  No H/Q in entry =           3
  In of MODEL   86
    1    H    GLN  49           H        GLN  49 -22.113  11.908  -6.745
    2    HA   GLN  49           HA       GLN  49 -24.670  13.030  -6.847
    3    HB2  GLN  49           HB2      GLN  49 -22.133  13.915  -8.208
    4    HB3  GLN  49           HB3      GLN  49 -23.592  14.883  -8.092
    5    HG2  GLN  49           HG2      GLN  49 -23.415  14.855  -5.657
    6    HG3  GLN  49           HG3      GLN  49 -21.969  13.866  -5.771
    7   HE21  GLN  49          HE21      GLN  49 -21.836  16.067  -4.454
    8   HE22  GLN  49          HE22      GLN  49 -20.914  17.333  -5.081

  No H/Q in entry =           8
  In of MODEL   86
    1    H    ASN  50           H        ASN  50 -23.015  11.195  -9.285
    2    HA   ASN  50           HA       ASN  50 -24.910  12.117 -11.334
    3    HB2  ASN  50           HB2      ASN  50 -22.338  10.574 -11.619
    4    HB3  ASN  50           HB3      ASN  50 -23.396  11.030 -12.946
    5   HD21  ASN  50          HD21      ASN  50 -20.745  11.835 -11.338
    6   HD22  ASN  50          HD22      ASN  50 -20.509  13.476 -11.647

  No H/Q in entry =           6
  In of MODEL   86
    1    H    ALA  51           H        ALA  51 -24.887   9.714  -9.138
    2    HA   ALA  51           HA       ALA  51 -25.693   7.611 -11.003
    3    HB2  ALA  51           HB1      ALA  51 -25.102   6.224  -9.350
    4    HB3  ALA  51           HB2      ALA  51 -26.213   7.014  -8.231
    5    HB1  ALA  51           HB3      ALA  51 -24.573   7.633  -8.428

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ASP  52           H        ASP  52 -27.701   6.559 -10.870
    2    HA   ASP  52           HA       ASP  52 -29.870   8.386 -10.151
    3    HB2  ASP  52           HB2      ASP  52 -29.701   5.916 -11.873
    4    HB3  ASP  52           HB3      ASP  52 -31.240   6.645 -11.412

  No H/Q in entry =           4
  In of MODEL   86
    1    H    VAL  53           H        VAL  53 -28.273   5.470  -9.207
    2    HA   VAL  53           HA       VAL  53 -29.694   5.551  -6.678
    3    HB   VAL  53           HB       VAL  53 -31.109   3.941  -7.944
    4   HG11  VAL  53          HG11      VAL  53 -29.377   3.106  -9.498
    5   HG13  VAL  53          HG12      VAL  53 -30.209   1.798  -8.660
    6   HG12  VAL  53          HG13      VAL  53 -28.594   2.282  -8.151
    7   HG23  VAL  53          HG21      VAL  53 -30.283   1.926  -6.300
    8   HG22  VAL  53          HG22      VAL  53 -31.404   3.228  -5.899
    9   HG21  VAL  53          HG23      VAL  53 -29.693   3.383  -5.500

  No H/Q in entry =           9
  In of MODEL   86
    1    H    VAL  54           H        VAL  54 -28.370   5.078  -5.042
    2    HA   VAL  54           HA       VAL  54 -25.619   4.229  -5.692
    3    HB   VAL  54           HB       VAL  54 -26.664   5.965  -3.398
    4   HG11  VAL  54          HG11      VAL  54 -24.094   4.540  -3.737
    5   HG13  VAL  54          HG12      VAL  54 -24.833   5.193  -2.276
    6   HG12  VAL  54          HG13      VAL  54 -23.931   6.255  -3.357
    7   HG22  VAL  54          HG21      VAL  54 -25.804   7.798  -4.465
    8   HG21  VAL  54          HG22      VAL  54 -26.367   6.838  -5.834
    9   HG23  VAL  54          HG23      VAL  54 -24.657   6.847  -5.409

  No H/Q in entry =           9
  In of MODEL   86
    1    H    LEU  55           H        LEU  55 -25.032   2.292  -5.094
    2    HA   LEU  55           HA       LEU  55 -26.529   0.944  -2.935
    3    HB2  LEU  55           HB2      LEU  55 -24.995  -0.184  -5.266
    4    HB3  LEU  55           HB3      LEU  55 -25.751  -1.141  -3.991
    5    HG   LEU  55           HG       LEU  55 -27.196   0.497  -6.064
    6   HD13  LEU  55          HD11      LEU  55 -26.915  -1.332  -7.324
    7   HD12  LEU  55          HD12      LEU  55 -27.868  -2.226  -6.140
    8   HD11  LEU  55          HD13      LEU  55 -26.110  -2.173  -6.002
    9   HD23  LEU  55          HD21      LEU  55 -28.487  -1.481  -4.240
   10   HD22  LEU  55          HD22      LEU  55 -29.182  -0.078  -5.053
   11   HD21  LEU  55          HD23      LEU  55 -28.149   0.143  -3.640

  No H/Q in entry =          11
  In of MODEL   86
    1    H    LEU  56           H        LEU  56 -25.368   0.306  -1.151
    2    HA   LEU  56           HA       LEU  56 -22.432   0.688  -1.215
    3    HB2  LEU  56           HB2      LEU  56 -24.217   0.436   1.193
    4    HB3  LEU  56           HB3      LEU  56 -22.507   0.856   1.177
    5    HG   LEU  56           HG       LEU  56 -24.803   2.567   0.266
    6   HD11  LEU  56          HD11      LEU  56 -23.671   2.127   2.769
    7   HD13  LEU  56          HD12      LEU  56 -24.658   3.511   2.300
    8   HD12  LEU  56          HD13      LEU  56 -22.901   3.609   2.201
    9   HD23  LEU  56          HD21      LEU  56 -22.851   4.259   0.093
   10   HD22  LEU  56          HD22      LEU  56 -23.250   3.192  -1.254
   11   HD21  LEU  56          HD23      LEU  56 -21.890   2.811  -0.198

  No H/Q in entry =          11
  In of MODEL   86
    1    H    GLY  57           H        GLY  57 -21.056  -0.960  -0.725
    2    HA3  GLY  57           HA2      GLY  57 -21.997  -3.638  -0.970
    3    HA2  GLY  57           HA3      GLY  57 -20.366  -3.162  -0.497

  No H/Q in entry =           3
  In of MODEL   86
    1    HA   PRO  58           HA       PRO  58 -23.152  -4.262   3.215
    2    HB2  PRO  58           HB2      PRO  58 -22.478  -6.883   3.763
    3    HB3  PRO  58           HB3      PRO  58 -23.867  -6.446   2.769
    4    HG2  PRO  58           HG2      PRO  58 -21.150  -7.325   1.943
    5    HG3  PRO  58           HG3      PRO  58 -22.723  -7.762   1.275
    6    HD2  PRO  58           HD2      PRO  58 -21.114  -5.928   0.078
    7    HD3  PRO  58           HD3      PRO  58 -22.872  -5.831  -0.009

  No H/Q in entry =           7
  In of MODEL   86
    1    H    GLN  59           H        GLN  59 -19.789  -4.740   2.573
    2    HA   GLN  59           HA       GLN  59 -19.014  -4.819   5.327
    3    HB2  GLN  59           HB2      GLN  59 -17.319  -3.736   3.086
    4    HB3  GLN  59           HB3      GLN  59 -16.789  -4.448   4.596
    5    HG2  GLN  59           HG2      GLN  59 -16.376  -6.058   2.934
    6    HG3  GLN  59           HG3      GLN  59 -17.807  -6.615   3.787
    7   HE21  GLN  59          HE21      GLN  59 -18.676  -7.575   2.287
    8   HE22  GLN  59          HE22      GLN  59 -19.381  -7.292   0.807

  No H/Q in entry =           8
  In of MODEL   86
    1    H    ILE  60           H        ILE  60 -19.949  -2.218   3.179
    2    HA   ILE  60           HA       ILE  60 -19.070  -0.309   5.258
    3    HB   ILE  60           HB       ILE  60 -19.314   1.460   3.466
    4   HG12  ILE  60          HG12      ILE  60 -19.134  -0.739   1.447
    5   HG13  ILE  60          HG13      ILE  60 -20.713  -0.187   2.005
    6   HG23  ILE  60          HG21      ILE  60 -17.154   1.239   2.801
    7   HG22  ILE  60          HG22      ILE  60 -17.298  -0.496   2.522
    8   HG21  ILE  60          HG23      ILE  60 -17.193   0.127   4.169
    9   HD11  ILE  60          HD11      ILE  60 -19.742   2.192   1.403
   10   HD13  ILE  60          HD12      ILE  60 -20.413   1.153   0.145
   11   HD12  ILE  60          HD13      ILE  60 -18.667   1.254   0.367

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ALA  61           H        ALA  61 -21.534  -1.880   5.313
    2    HA   ALA  61           HA       ALA  61 -23.754  -0.195   4.906
    3    HB1  ALA  61           HB1      ALA  61 -24.968  -1.705   6.209
    4    HB2  ALA  61           HB2      ALA  61 -23.565  -2.123   7.193
    5    HB3  ALA  61           HB3      ALA  61 -23.677  -2.694   5.529

  No H/Q in entry =           5
  In of MODEL   86
    1    H    TYR  62           H        TYR  62 -21.526  -0.377   7.683
    2    HA   TYR  62           HA       TYR  62 -23.059   1.254   9.400
    3    HB2  TYR  62           HB2      TYR  62 -21.008   1.641  10.627
    4    HB3  TYR  62           HB3      TYR  62 -21.077  -0.048  10.126
    5    HD1  TYR  62           HD1      TYR  62 -19.500  -0.931   8.464
    6    HD2  TYR  62           HD2      TYR  62 -19.309   3.157   9.693
    7    HE1  TYR  62           HE1      TYR  62 -17.295  -0.714   7.384
    8    HE2  TYR  62           HE2      TYR  62 -17.089   3.368   8.615
    9    HH   TYR  62           HH       TYR  62 -15.883   2.203   6.739

  No H/Q in entry =           9
  In of MODEL   86
    1    H    MET  63           H        MET  63 -21.433   2.162   6.549
    2    HA   MET  63           HA       MET  63 -21.243   4.979   7.300
    3    HB2  MET  63           HB2      MET  63 -20.665   3.505   4.730
    4    HB3  MET  63           HB3      MET  63 -20.460   5.244   4.944
    5    HG2  MET  63           HG2      MET  63 -18.741   4.851   6.609
    6    HG3  MET  63           HG3      MET  63 -18.959   3.109   6.437
    7    HE2  MET  63           HE1      MET  63 -16.918   6.123   3.990
    8    HE1  MET  63           HE2      MET  63 -18.447   6.311   4.850
    9    HE3  MET  63           HE3      MET  63 -18.445   5.879   3.140

  No H/Q in entry =           9
  In of MODEL   86
    1    H    LEU  64           H        LEU  64 -23.826   3.161   6.318
    2    HA   LEU  64           HA       LEU  64 -25.043   4.629   4.279
    3    HB2  LEU  64           HB2      LEU  64 -25.918   2.510   5.160
    4    HB3  LEU  64           HB3      LEU  64 -26.358   3.325   6.660
    5    HG   LEU  64           HG       LEU  64 -28.054   4.616   5.471
    6   HD13  LEU  64          HD11      LEU  64 -27.787   4.901   3.242
    7   HD12  LEU  64          HD12      LEU  64 -28.445   3.273   3.068
    8   HD11  LEU  64          HD13      LEU  64 -26.699   3.519   3.117
    9   HD23  LEU  64          HD21      LEU  64 -28.597   1.823   4.669
   10   HD22  LEU  64          HD22      LEU  64 -29.571   2.943   5.621
   11   HD21  LEU  64          HD23      LEU  64 -28.195   2.125   6.360

  No H/Q in entry =          11
  In of MODEL   86
    1    HA   PRO  65           HA       PRO  65 -27.179   7.741   7.111
    2    HB2  PRO  65           HB2      PRO  65 -25.160   7.839   9.352
    3    HB3  PRO  65           HB3      PRO  65 -26.897   8.131   9.417
    4    HG2  PRO  65           HG2      PRO  65 -25.976   5.852  10.290
    5    HG3  PRO  65           HG3      PRO  65 -27.405   5.849   9.256
    6    HD2  PRO  65           HD2      PRO  65 -24.542   5.230   8.517
    7    HD3  PRO  65           HD3      PRO  65 -26.010   4.363   8.064

  No H/Q in entry =           7
  In of MODEL   86
    1    H    GLU  66           H        GLU  66 -23.623   7.657   7.154
    2    HA   GLU  66           HA       GLU  66 -23.308  10.462   6.805
    3    HB2  GLU  66           HB2      GLU  66 -21.519   8.155   6.091
    4    HB3  GLU  66           HB3      GLU  66 -21.057   9.847   5.915
    5    HG2  GLU  66           HG2      GLU  66 -21.247  10.171   8.291
    6    HG3  GLU  66           HG3      GLU  66 -21.783   8.503   8.493

  No H/Q in entry =           6
  In of MODEL   86
    1    H    ILE  67           H        ILE  67 -23.449   7.764   4.498
    2    HA   ILE  67           HA       ILE  67 -23.038   9.516   2.237
    3    HB   ILE  67           HB       ILE  67 -23.959   6.613   2.363
    4   HG12  ILE  67          HG12      ILE  67 -21.327   7.780   1.444
    5   HG13  ILE  67          HG13      ILE  67 -21.612   7.329   3.123
    6   HG21  ILE  67          HG21      ILE  67 -23.904   8.536   0.177
    7   HG23  ILE  67          HG22      ILE  67 -24.542   6.892   0.199
    8   HG22  ILE  67          HG23      ILE  67 -22.834   7.170  -0.137
    9   HD12  ILE  67          HD11      ILE  67 -21.225   5.601   0.735
   10   HD11  ILE  67          HD12      ILE  67 -22.234   5.011   2.054
   11   HD13  ILE  67          HD13      ILE  67 -20.555   5.455   2.359

  No H/Q in entry =          11
  In of MODEL   86
    1    H    GLN  68           H        GLN  68 -25.904   8.453   3.871
    2    HA   GLN  68           HA       GLN  68 -27.740   9.439   1.933
    3    HB2  GLN  68           HB2      GLN  68 -27.975   9.023   4.909
    4    HB3  GLN  68           HB3      GLN  68 -29.298   9.650   3.939
    5    HG2  GLN  68           HG2      GLN  68 -29.354   7.647   2.622
    6    HG3  GLN  68           HG3      GLN  68 -27.904   7.041   3.401
    7   HE21  GLN  68          HE21      GLN  68 -30.096   5.706   3.255
    8   HE22  GLN  68          HE22      GLN  68 -30.918   5.228   4.668

  No H/Q in entry =           8
  In of MODEL   86
    1    H    ARG  69           H        ARG  69 -26.097  11.034   4.690
    2    HA   ARG  69           HA       ARG  69 -27.439  13.538   4.346
    3    HB2  ARG  69           HB2      ARG  69 -25.091  12.552   5.896
    4    HB3  ARG  69           HB3      ARG  69 -25.156  14.279   5.574
    5    HG2  ARG  69           HG2      ARG  69 -27.464  14.326   6.565
    6    HG3  ARG  69           HG3      ARG  69 -27.269  12.624   7.003
    7    HD2  ARG  69           HD2      ARG  69 -25.545  14.942   7.950
    8    HD3  ARG  69           HD3      ARG  69 -26.675  14.028   8.935
    9    HE   ARG  69           HE       ARG  69 -24.081  13.090   7.944
   10   HH21  ARG  69          HH11      ARG  69 -23.281  11.294   9.097
   11   HH22  ARG  69          HH12      ARG  69 -24.309  10.464  10.217
   12   HH11  ARG  69          HH21      ARG  69 -27.028  12.537   9.656
   13   HH12  ARG  69          HH22      ARG  69 -26.430  11.167  10.531

  No H/Q in entry =          13
  In of MODEL   86
    1    H    LEU  70           H        LEU  70 -24.595  12.130   2.933
    2    HA   LEU  70           HA       LEU  70 -23.466  14.507   1.805
    3    HB2  LEU  70           HB2      LEU  70 -22.492  12.167   2.343
    4    HB3  LEU  70           HB3      LEU  70 -23.124  11.742   0.754
    5    HG   LEU  70           HG       LEU  70 -21.526  13.119  -0.317
    6   HD11  LEU  70          HD11      LEU  70 -20.671  13.895   2.481
    7   HD13  LEU  70          HD12      LEU  70 -21.365  14.963   1.261
    8   HD12  LEU  70          HD13      LEU  70 -19.763  14.270   1.013
    9   HD22  LEU  70          HD21      LEU  70 -20.110  11.383  -0.132
   10   HD21  LEU  70          HD22      LEU  70 -21.029  10.842   1.272
   11   HD23  LEU  70          HD23      LEU  70 -19.631  11.894   1.486

  No H/Q in entry =          11
  In of MODEL   86
    1    H    LEU  71           H        LEU  71 -25.657  12.012   0.656
    2    HA   LEU  71           HA       LEU  71 -26.186  13.557  -1.825
    3    HB2  LEU  71           HB2      LEU  71 -26.423  10.568  -1.439
    4    HB3  LEU  71           HB3      LEU  71 -26.554  11.461  -2.952
    5    HG   LEU  71           HG       LEU  71 -24.020  11.409  -1.313
    6   HD12  LEU  71          HD11      LEU  71 -24.113   9.833  -3.778
    7   HD11  LEU  71          HD12      LEU  71 -25.120   9.195  -2.479
    8   HD13  LEU  71          HD13      LEU  71 -23.395   9.448  -2.214
    9   HD22  LEU  71          HD21      LEU  71 -24.114  13.257  -2.768
   10   HD21  LEU  71          HD22      LEU  71 -24.635  12.249  -4.117
   11   HD23  LEU  71          HD23      LEU  71 -23.010  12.069  -3.457

  No H/Q in entry =          11
  In of MODEL   86
    1    HA   PRO  72           HA       PRO  72 -30.035  13.102   0.821
    2    HB2  PRO  72           HB2      PRO  72 -30.859  15.675   0.800
    3    HB3  PRO  72           HB3      PRO  72 -29.547  15.183   1.870
    4    HG2  PRO  72           HG2      PRO  72 -29.370  16.432  -0.860
    5    HG3  PRO  72           HG3      PRO  72 -28.583  16.943   0.635
    6    HD2  PRO  72           HD2      PRO  72 -27.282  15.404  -1.176
    7    HD3  PRO  72           HD3      PRO  72 -27.015  15.198   0.554

  No H/Q in entry =           7
  In of MODEL   86
    1    H    ASN  73           H        ASN  73 -29.427  14.115  -2.378
    2    HA   ASN  73           HA       ASN  73 -32.296  13.858  -2.992
    3    HB2  ASN  73           HB2      ASN  73 -31.832  15.002  -5.070
    4    HB3  ASN  73           HB3      ASN  73 -31.286  15.946  -3.693
    5   HD21  ASN  73          HD21      ASN  73 -30.512  16.036  -6.376
    6   HD22  ASN  73          HD22      ASN  73 -28.848  15.856  -6.587

  No H/Q in entry =           6
  In of MODEL   86
    1    H    LYS  74           H        LYS  74 -30.344  11.568  -2.631
    2    HA   LYS  74           HA       LYS  74 -30.953  10.234  -5.203
    3    HB2  LYS  74           HB2      LYS  74 -28.411   9.873  -3.610
    4    HB3  LYS  74           HB3      LYS  74 -28.818   9.097  -5.141
    5    HG2  LYS  74           HG2      LYS  74 -28.509  12.059  -4.881
    6    HG3  LYS  74           HG3      LYS  74 -27.153  10.983  -5.219
    7    HD2  LYS  74           HD2      LYS  74 -28.300  10.111  -7.171
    8    HD3  LYS  74           HD3      LYS  74 -29.702  11.122  -6.818
    9    HE2  LYS  74           HE2      LYS  74 -28.451  13.119  -7.229
   10    HE3  LYS  74           HE3      LYS  74 -26.944  12.210  -7.352
   11    HZ2  LYS  74           HZ1      LYS  74 -28.424  12.877  -9.452
   12    HZ1  LYS  74           HZ2      LYS  74 -29.098  11.357  -9.104
   13    HZ3  LYS  74           HZ3      LYS  74 -27.434  11.500  -9.413

  No H/Q in entry =          13
  In of MODEL   86
    1    HA   PRO  75           HA       PRO  75 -32.366   7.209  -2.281
    2    HB2  PRO  75           HB2      PRO  75 -32.722   5.028  -3.906
    3    HB3  PRO  75           HB3      PRO  75 -33.828   6.401  -3.938
    4    HG2  PRO  75           HG2      PRO  75 -31.515   5.806  -5.742
    5    HG3  PRO  75           HG3      PRO  75 -33.161   6.277  -6.165
    6    HD2  PRO  75           HD2      PRO  75 -31.191   8.112  -6.100
    7    HD3  PRO  75           HD3      PRO  75 -32.812   8.524  -5.540

  No H/Q in entry =           7
  In of MODEL   86
    1    H    VAL  76           H        VAL  76 -30.918   6.104  -0.943
    2    HA   VAL  76           HA       VAL  76 -28.481   4.880  -2.097
    3    HB   VAL  76           HB       VAL  76 -28.723   6.295   0.593
    4   HG11  VAL  76          HG11      VAL  76 -26.399   5.002  -0.845
    5   HG13  VAL  76          HG12      VAL  76 -27.089   4.530   0.709
    6   HG12  VAL  76          HG13      VAL  76 -26.222   6.057   0.557
    7   HG22  VAL  76          HG21      VAL  76 -28.034   8.204  -0.261
    8   HG21  VAL  76          HG22      VAL  76 -28.600   7.548  -1.798
    9   HG23  VAL  76          HG23      VAL  76 -26.896   7.425  -1.360

  No H/Q in entry =           9
  In of MODEL   86
    1    H    GLU  77           H        GLU  77 -28.291   2.711  -1.530
    2    HA   GLU  77           HA       GLU  77 -29.068   1.882   1.114
    3    HB2  GLU  77           HB2      GLU  77 -30.705   0.269   0.564
    4    HB3  GLU  77           HB3      GLU  77 -31.236   1.814  -0.102
    5    HG2  GLU  77           HG2      GLU  77 -30.657   1.092  -2.310
    6    HG3  GLU  77           HG3      GLU  77 -30.033  -0.428  -1.673

  No H/Q in entry =           6
  In of MODEL   86
    1    H    VAL  78           H        VAL  78 -28.767  -0.224   1.728
    2    HA   VAL  78           HA       VAL  78 -26.120  -1.017   0.802
    3    HB   VAL  78           HB       VAL  78 -27.822  -1.923   3.163
    4   HG11  VAL  78          HG11      VAL  78 -25.511  -3.163   1.994
    5   HG13  VAL  78          HG12      VAL  78 -26.413  -3.651   3.430
    6   HG12  VAL  78          HG13      VAL  78 -25.076  -2.512   3.573
    7   HG22  VAL  78          HG21      VAL  78 -26.332  -0.611   4.517
    8   HG21  VAL  78          HG22      VAL  78 -27.064   0.396   3.267
    9   HG23  VAL  78          HG23      VAL  78 -25.396  -0.153   3.093

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ILE  79           H        ILE  79 -25.619  -2.913  -0.146
    2    HA   ILE  79           HA       ILE  79 -27.713  -4.333  -1.507
    3    HB   ILE  79           HB       ILE  79 -24.729  -4.908  -1.322
    4   HG12  ILE  79          HG12      ILE  79 -26.367  -3.734  -3.573
    5   HG13  ILE  79          HG13      ILE  79 -25.469  -2.761  -2.407
    6   HG22  ILE  79          HG21      ILE  79 -25.868  -6.024  -3.655
    7   HG21  ILE  79          HG22      ILE  79 -26.849  -6.559  -2.290
    8   HG23  ILE  79          HG23      ILE  79 -25.111  -6.863  -2.300
    9   HD13  ILE  79          HD11      ILE  79 -24.072  -2.858  -4.240
   10   HD12  ILE  79          HD12      ILE  79 -24.439  -4.555  -4.552
   11   HD11  ILE  79          HD13      ILE  79 -23.436  -4.110  -3.170

  No H/Q in entry =          11
  In of MODEL   86
    1    H    ASP  80           H        ASP  80 -28.602  -6.255  -0.954
    2    HA   ASP  80           HA       ASP  80 -28.539  -7.209   1.673
    3    HB2  ASP  80           HB2      ASP  80 -30.316  -7.725   0.036
    4    HB3  ASP  80           HB3      ASP  80 -29.179  -8.733  -0.862

  No H/Q in entry =           4
  In of MODEL   86
    1    H    SER  81           H        SER  81 -27.012  -8.389   2.766
    2    HA   SER  81           HA       SER  81 -24.536  -9.084   1.541
    3    HB2  SER  81           HB2      SER  81 -23.981 -10.161   3.683
    4    HB3  SER  81           HB3      SER  81 -24.661  -8.554   3.936
    5    HG   SER  81           HG       SER  81 -25.781 -11.068   4.411

  No H/Q in entry =           5
  In of MODEL   86
    1    H    LEU  82           H        LEU  82 -27.275 -11.141   1.843
    2    HA   LEU  82           HA       LEU  82 -25.767 -13.522   1.262
    3    HB2  LEU  82           HB2      LEU  82 -28.696 -12.858   1.042
    4    HB3  LEU  82           HB3      LEU  82 -28.017 -14.466   0.797
    5    HG   LEU  82           HG       LEU  82 -27.923 -12.931   3.377
    6   HD13  LEU  82          HD11      LEU  82 -29.713 -14.284   4.122
    7   HD12  LEU  82          HD12      LEU  82 -29.560 -15.382   2.750
    8   HD11  LEU  82          HD13      LEU  82 -30.202 -13.756   2.511
    9   HD22  LEU  82          HD21      LEU  82 -26.087 -14.383   3.328
   10   HD21  LEU  82          HD22      LEU  82 -26.969 -15.611   2.420
   11   HD23  LEU  82          HD23      LEU  82 -27.338 -15.340   4.123

  No H/Q in entry =          11
  In of MODEL   86
    1    H    LEU  83           H        LEU  83 -27.708 -11.228  -0.595
    2    HA   LEU  83           HA       LEU  83 -27.547 -12.540  -3.094
    3    HB2  LEU  83           HB2      LEU  83 -27.908  -9.640  -2.386
    4    HB3  LEU  83           HB3      LEU  83 -27.963 -10.251  -4.038
    5    HG   LEU  83           HG       LEU  83 -29.984 -10.652  -1.853
    6   HD13  LEU  83          HD11      LEU  83 -30.722  -8.772  -2.874
    7   HD12  LEU  83          HD12      LEU  83 -31.212  -9.852  -4.177
    8   HD11  LEU  83          HD13      LEU  83 -29.665  -9.008  -4.265
    9   HD23  LEU  83          HD21      LEU  83 -30.165 -11.853  -4.601
   10   HD22  LEU  83          HD22      LEU  83 -31.127 -12.217  -3.170
   11   HD21  LEU  83          HD23      LEU  83 -29.448 -12.744  -3.259

  No H/Q in entry =          11
  In of MODEL   86
    1    H    TYR  84           H        TYR  84 -25.544 -10.218  -1.388
    2    HA   TYR  84           HA       TYR  84 -23.692  -9.716  -3.524
    3    HB2  TYR  84           HB2      TYR  84 -24.163  -8.252  -1.486
    4    HB3  TYR  84           HB3      TYR  84 -23.182  -9.393  -0.569
    5    HD1  TYR  84           HD1      TYR  84 -20.795  -9.384  -0.721
    6    HD2  TYR  84           HD2      TYR  84 -23.116  -6.872  -3.278
    7    HE1  TYR  84           HE1      TYR  84 -18.736  -8.202  -1.409
    8    HE2  TYR  84           HE2      TYR  84 -21.066  -5.689  -3.982
    9    HH   TYR  84           HH       TYR  84 -18.805  -5.277  -3.126

  No H/Q in entry =           9
  In of MODEL   86
    1    H    GLY  85           H        GLY  85 -23.459 -11.780  -0.620
    2    HA3  GLY  85           HA2      GLY  85 -20.900 -12.752  -1.143
    3    HA2  GLY  85           HA3      GLY  85 -22.135 -13.598  -0.211

  No H/Q in entry =           3
  In of MODEL   86
    1    H    LYS  86           H        LYS  86 -24.004 -13.903  -2.263
    2    HA   LYS  86           HA       LYS  86 -22.997 -16.267  -3.578
    3    HB2  LYS  86           HB2      LYS  86 -25.221 -16.172  -2.622
    4    HB3  LYS  86           HB3      LYS  86 -25.622 -14.780  -3.624
    5    HG2  LYS  86           HG2      LYS  86 -26.705 -16.768  -4.430
    6    HG3  LYS  86           HG3      LYS  86 -25.519 -16.192  -5.601
    7    HD2  LYS  86           HD2      LYS  86 -23.932 -17.832  -4.945
    8    HD3  LYS  86           HD3      LYS  86 -24.854 -18.247  -3.500
    9    HE2  LYS  86           HE2      LYS  86 -25.732 -18.729  -6.345
   10    HE3  LYS  86           HE3      LYS  86 -25.104 -19.950  -5.238
   11    HZ1  LYS  86           HZ1      LYS  86 -27.096 -18.687  -3.839
   12    HZ3  LYS  86           HZ2      LYS  86 -27.190 -20.220  -4.565
   13    HZ2  LYS  86           HZ3      LYS  86 -27.729 -18.849  -5.407

  No H/Q in entry =          13
  In of MODEL   86
    1    H    VAL  87           H        VAL  87 -22.945 -13.036  -4.409
    2    HA   VAL  87           HA       VAL  87 -22.644 -11.829  -6.330
    3    HB   VAL  87           HB       VAL  87 -21.633 -14.313  -7.735
    4   HG11  VAL  87          HG11      VAL  87 -21.765 -11.822  -8.627
    5   HG13  VAL  87          HG12      VAL  87 -20.353 -12.821  -8.977
    6   HG12  VAL  87          HG13      VAL  87 -20.294 -11.632  -7.676
    7   HG22  VAL  87          HG21      VAL  87 -20.598 -14.582  -5.626
    8   HG21  VAL  87          HG22      VAL  87 -20.255 -12.859  -5.495
    9   HG23  VAL  87          HG23      VAL  87 -19.397 -13.840  -6.681

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ASP  88           H        ASP  88 -25.166 -12.440  -5.968
    2    HA   ASP  88           HA       ASP  88 -26.326 -13.593  -8.379
    3    HB2  ASP  88           HB2      ASP  88 -27.305 -13.869  -6.052
    4    HB3  ASP  88           HB3      ASP  88 -27.734 -12.160  -6.113

  No H/Q in entry =           4
  In of MODEL   86
    1    H    GLY  89           H        GLY  89 -25.617 -12.314 -10.001
    2    HA3  GLY  89           HA2      GLY  89 -25.760  -9.536 -10.147
    3    HA2  GLY  89           HA3      GLY  89 -25.764 -10.630 -11.530

  No H/Q in entry =           3
  In of MODEL   86
    1    H    LEU  90           H        LEU  90 -28.226 -11.954 -11.085
    2    HA   LEU  90           HA       LEU  90 -30.018  -9.973 -12.145
    3    HB2  LEU  90           HB2      LEU  90 -30.123 -12.356 -12.771
    4    HB3  LEU  90           HB3      LEU  90 -30.620 -12.747 -11.125
    5    HG   LEU  90           HG       LEU  90 -32.725 -11.593 -11.447
    6   HD13  LEU  90          HD11      LEU  90 -32.533  -9.826 -12.890
    7   HD12  LEU  90          HD12      LEU  90 -33.101 -11.033 -14.045
    8   HD11  LEU  90          HD13      LEU  90 -31.380 -10.666 -13.929
    9   HD23  LEU  90          HD21      LEU  90 -32.700 -13.176 -13.914
   10   HD22  LEU  90          HD22      LEU  90 -33.669 -13.355 -12.451
   11   HD21  LEU  90          HD23      LEU  90 -32.025 -13.990 -12.503

  No H/Q in entry =          11
  In of MODEL   86
    1    H    GLY  91           H        GLY  91 -29.843 -11.538  -8.992
    2    HA3  GLY  91           HA2      GLY  91 -32.157 -10.413  -7.910
    3    HA2  GLY  91           HA3      GLY  91 -30.765 -10.983  -6.990

  No H/Q in entry =           3
  In of MODEL   86
    1    H    VAL  92           H        VAL  92 -28.828  -9.167  -7.829
    2    HA   VAL  92           HA       VAL  92 -29.572  -6.886  -6.229
    3    HB   VAL  92           HB       VAL  92 -27.048  -7.360  -7.856
    4   HG12  VAL  92          HG11      VAL  92 -27.164  -5.518  -5.492
    5   HG11  VAL  92          HG12      VAL  92 -27.836  -4.935  -7.018
    6   HG13  VAL  92          HG13      VAL  92 -26.145  -5.429  -6.930
    7   HG22  VAL  92          HG21      VAL  92 -26.833  -8.982  -6.297
    8   HG21  VAL  92          HG22      VAL  92 -27.957  -8.206  -5.179
    9   HG23  VAL  92          HG23      VAL  92 -26.296  -7.627  -5.304

  No H/Q in entry =           9
  In of MODEL   86
    1    H    LEU  93           H        LEU  93 -29.206  -7.487  -9.665
    2    HA   LEU  93           HA       LEU  93 -29.522  -4.829 -10.540
    3    HB2  LEU  93           HB2      LEU  93 -28.920  -6.664 -12.043
    4    HB3  LEU  93           HB3      LEU  93 -30.519  -7.374 -11.819
    5    HG   LEU  93           HG       LEU  93 -31.513  -5.375 -12.897
    6   HD11  LEU  93          HD11      LEU  93 -29.636  -3.815 -12.379
    7   HD13  LEU  93          HD12      LEU  93 -30.090  -3.807 -14.084
    8   HD12  LEU  93          HD13      LEU  93 -28.646  -4.672 -13.562
    9   HD23  LEU  93          HD21      LEU  93 -30.503  -5.912 -15.204
   10   HD22  LEU  93          HD22      LEU  93 -31.354  -7.175 -14.314
   11   HD21  LEU  93          HD23      LEU  93 -29.589  -7.143 -14.332

  No H/Q in entry =          11
  In of MODEL   86
    1    H    LYS  94           H        LYS  94 -31.925  -7.358  -9.718
    2    HA   LYS  94           HA       LYS  94 -34.255  -5.873 -10.293
    3    HB2  LYS  94           HB2      LYS  94 -33.753  -8.103  -8.328
    4    HB3  LYS  94           HB3      LYS  94 -35.343  -7.380  -8.567
    5    HG2  LYS  94           HG2      LYS  94 -35.288  -8.111 -10.917
    6    HG3  LYS  94           HG3      LYS  94 -33.736  -8.891 -10.618
    7    HD2  LYS  94           HD2      LYS  94 -34.857 -10.244  -8.809
    8    HD3  LYS  94           HD3      LYS  94 -36.397  -9.564  -9.337
    9    HE2  LYS  94           HE2      LYS  94 -35.915 -10.456 -11.625
   10    HE3  LYS  94           HE3      LYS  94 -34.506 -11.273 -10.951
   11    HZ3  LYS  94           HZ1      LYS  94 -36.378 -12.765 -11.132
   12    HZ2  LYS  94           HZ2      LYS  94 -37.328 -11.743 -10.162
   13    HZ1  LYS  94           HZ3      LYS  94 -35.973 -12.524  -9.501

  No H/Q in entry =          13
  In of MODEL   86
    1    H    ALA  95           H        ALA  95 -32.405  -6.077  -7.264
    2    HA   ALA  95           HA       ALA  95 -34.218  -4.501  -5.737
    3    HB2  ALA  95           HB1      ALA  95 -31.857  -5.919  -5.249
    4    HB3  ALA  95           HB2      ALA  95 -32.812  -5.023  -4.069
    5    HB1  ALA  95           HB3      ALA  95 -31.461  -4.239  -4.889

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ALA  96           H        ALA  96 -31.584  -3.644  -7.842
    2    HA   ALA  96           HA       ALA  96 -31.441  -0.899  -7.016
    3    HB2  ALA  96           HB1      ALA  96 -30.095  -0.651  -9.133
    4    HB3  ALA  96           HB2      ALA  96 -30.426  -2.348  -9.483
    5    HB1  ALA  96           HB3      ALA  96 -29.492  -1.908  -8.054

  No H/Q in entry =           5
  In of MODEL   86
    1    H    VAL  97           H        VAL  97 -33.022  -2.539  -9.721
    2    HA   VAL  97           HA       VAL  97 -34.069  -0.199 -10.921
    3    HB   VAL  97           HB       VAL  97 -34.923  -3.111 -11.013
    4   HG11  VAL  97          HG11      VAL  97 -36.689  -1.070 -11.443
    5   HG13  VAL  97          HG12      VAL  97 -36.779  -2.646 -12.229
    6   HG12  VAL  97          HG13      VAL  97 -36.014  -1.292 -13.057
    7   HG21  VAL  97          HG21      VAL  97 -33.636  -1.263 -13.024
    8   HG23  VAL  97          HG22      VAL  97 -34.116  -2.930 -13.342
    9   HG22  VAL  97          HG23      VAL  97 -32.851  -2.585 -12.160

  No H/Q in entry =           9
  In of MODEL   86
    1    H    ALA  98           H        ALA  98 -35.262  -2.410  -8.417
    2    HA   ALA  98           HA       ALA  98 -37.801  -1.229  -8.018
    3    HB1  ALA  98           HB1      ALA  98 -36.812  -3.464  -7.038
    4    HB3  ALA  98           HB2      ALA  98 -37.970  -2.540  -6.078
    5    HB2  ALA  98           HB3      ALA  98 -36.243  -2.425  -5.733

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ALA  99           H        ALA  99 -34.694  -0.511  -6.385
    2    HA   ALA  99           HA       ALA  99 -35.777   1.457  -4.674
    3    HB1  ALA  99           HB1      ALA  99 -33.150   0.540  -5.464
    4    HB2  ALA  99           HB2      ALA  99 -33.674   1.269  -3.946
    5    HB3  ALA  99           HB3      ALA  99 -33.195   2.295  -5.297

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ILE 100           H        ILE 100 -34.766   1.638  -8.036
    2    HA   ILE 100           HA       ILE 100 -34.899   4.492  -8.197
    3    HB   ILE 100           HB       ILE 100 -35.051   2.383 -10.377
    4   HG12  ILE 100          HG12      ILE 100 -32.848   4.326  -9.688
    5   HG13  ILE 100          HG13      ILE 100 -32.906   2.666  -9.090
    6   HG21  ILE 100          HG21      ILE 100 -35.426   5.312 -10.445
    7   HG23  ILE 100          HG22      ILE 100 -35.963   4.074 -11.582
    8   HG22  ILE 100          HG23      ILE 100 -34.302   4.664 -11.640
    9   HD12  ILE 100          HD11      ILE 100 -32.383   3.671 -11.850
   10   HD11  ILE 100          HD12      ILE 100 -33.069   2.062 -11.621
   11   HD13  ILE 100          HD13      ILE 100 -31.509   2.466 -10.907

  No H/Q in entry =          11
  In of MODEL   86
    1    H    LYS 101           H        LYS 101 -37.243   1.937  -8.953
    2    HA   LYS 101           HA       LYS 101 -39.306   3.641  -9.898
    3    HB2  LYS 101           HB2      LYS 101 -39.226   0.842  -8.829
    4    HB3  LYS 101           HB3      LYS 101 -40.768   1.637  -9.144
    5    HG2  LYS 101           HG2      LYS 101 -40.313   1.810 -11.442
    6    HG3  LYS 101           HG3      LYS 101 -38.622   1.371 -11.213
    7    HD2  LYS 101           HD2      LYS 101 -39.912  -0.497 -12.124
    8    HD3  LYS 101           HD3      LYS 101 -39.275  -0.871 -10.523
    9    HE2  LYS 101           HE2      LYS 101 -41.345  -1.541 -10.011
   10    HE3  LYS 101           HE3      LYS 101 -41.773   0.170  -9.975
   11    HZ3  LYS 101           HZ1      LYS 101 -42.687   0.072 -12.086
   12    HZ2  LYS 101           HZ2      LYS 101 -43.166  -1.408 -11.404
   13    HZ1  LYS 101           HZ3      LYS 101 -41.869  -1.360 -12.500

  No H/Q in entry =          13
  In of MODEL   86
    1    H    LYS 102           H        LYS 102 -38.809   2.089  -6.725
    2    HA   LYS 102           HA       LYS 102 -41.025   3.297  -5.483
    3    HB2  LYS 102           HB2      LYS 102 -39.811   1.390  -4.518
    4    HB3  LYS 102           HB3      LYS 102 -38.400   2.417  -4.266
    5    HG2  LYS 102           HG2      LYS 102 -39.680   3.802  -2.728
    6    HG3  LYS 102           HG3      LYS 102 -41.093   2.779  -2.982
    7    HD2  LYS 102           HD2      LYS 102 -39.889   0.871  -2.006
    8    HD3  LYS 102           HD3      LYS 102 -38.476   1.896  -1.751
    9    HE2  LYS 102           HE2      LYS 102 -39.792   3.366  -0.298
   10    HE3  LYS 102           HE3      LYS 102 -41.223   2.374  -0.575
   11    HZ1  LYS 102           HZ1      LYS 102 -39.523   0.571   0.376
   12    HZ3  LYS 102           HZ2      LYS 102 -40.609   1.455   1.335
   13    HZ2  LYS 102           HZ3      LYS 102 -38.991   1.955   1.203

  No H/Q in entry =          13
  In of MODEL   86
    1    H    ALA 103           H        ALA 103 -38.057   4.659  -6.494
    2    HA   ALA 103           HA       ALA 103 -38.224   6.940  -4.662
    3    HB2  ALA 103           HB1      ALA 103 -36.234   7.673  -6.241
    4    HB3  ALA 103           HB2      ALA 103 -36.232   5.964  -6.675
    5    HB1  ALA 103           HB3      ALA 103 -35.981   6.449  -4.999

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ALA 104           H        ALA 104 -38.888   6.289  -8.017
    2    HA   ALA 104           HA       ALA 104 -39.431   9.096  -8.576
    3    HB2  ALA 104           HB1      ALA 104 -39.505   8.476 -10.791
    4    HB1  ALA 104           HB2      ALA 104 -40.255   6.918 -10.439
    5    HB3  ALA 104           HB3      ALA 104 -38.526   7.146 -10.171

  No H/Q in entry =           5
  In of MODEL   86
    1    H    ALA 105           H        ALA 105 -41.058   6.981  -6.801
    2    HA   ALA 105           HA       ALA 105 -43.459   8.414  -6.723
    3    HB2  ALA 105           HB1      ALA 105 -44.236   7.610  -8.771
    4    HB3  ALA 105           HB2      ALA 105 -44.883   6.409  -7.654
    5    HB1  ALA 105           HB3      ALA 105 -43.427   6.055  -8.584

  No H/Q in entry =           5
  In of MODEL   87
    1    H1   ALA   1           H3       ALA   1 -12.403 -15.478  -2.467
    2    H2   ALA   1           H2       ALA   1 -11.474 -16.631  -3.306
    3    H3   ALA   1           H1       ALA   1 -12.604 -15.671  -4.142
    4    HA   ALA   1           HA       ALA   1 -14.024 -17.354  -3.908
    5    HB3  ALA   1           HB1      ALA   1 -12.652 -19.144  -3.444
    6    HB1  ALA   1           HB2      ALA   1 -13.411 -19.024  -1.857
    7    HB2  ALA   1           HB3      ALA   1 -11.825 -18.303  -2.133

  No H/Q in entry =           7
  In of MODEL   87
    1    H    GLU   2           H        GLU   2 -15.662 -18.190  -2.259
    2    HA   GLU   2           HA       GLU   2 -17.291 -16.450  -1.202
    3    HB2  GLU   2           HB2      GLU   2 -16.387 -18.889   0.342
    4    HB3  GLU   2           HB3      GLU   2 -17.901 -18.020   0.593
    5    HG2  GLU   2           HG2      GLU   2 -18.889 -19.092  -1.145
    6    HG3  GLU   2           HG3      GLU   2 -17.559 -18.707  -2.226

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLU   3           H        GLU   3 -15.403 -17.831   1.424
    2    HA   GLU   3           HA       GLU   3 -15.599 -15.476   2.984
    3    HB2  GLU   3           HB2      GLU   3 -14.047 -18.043   3.235
    4    HB3  GLU   3           HB3      GLU   3 -13.801 -16.728   4.385
    5    HG2  GLU   3           HG2      GLU   3 -15.999 -16.852   5.197
    6    HG3  GLU   3           HG3      GLU   3 -16.600 -17.643   3.745

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LEU   4           H        LEU   4 -12.659 -16.991   1.599
    2    HA   LEU   4           HA       LEU   4 -10.803 -15.112   2.204
    3    HB2  LEU   4           HB2      LEU   4 -11.043 -16.403  -0.523
    4    HB3  LEU   4           HB3      LEU   4  -9.583 -15.702   0.167
    5    HG   LEU   4           HG       LEU   4 -11.111 -18.081   1.273
    6   HD13  LEU   4          HD11      LEU   4  -9.493 -19.457   0.346
    7   HD12  LEU   4          HD12      LEU   4  -8.267 -18.189   0.324
    8   HD11  LEU   4          HD13      LEU   4  -9.553 -18.193  -0.882
    9   HD23  LEU   4          HD21      LEU   4  -8.864 -18.175   2.660
   10   HD22  LEU   4          HD22      LEU   4 -10.173 -17.119   3.187
   11   HD21  LEU   4          HD23      LEU   4  -8.800 -16.447   2.309

  No H/Q in entry =          11
  In of MODEL   87
    1    H    GLU   5           H        GLU   5 -13.127 -14.872  -0.476
    2    HA   GLU   5           HA       GLU   5 -12.090 -12.400  -1.471
    3    HB2  GLU   5           HB2      GLU   5 -14.520 -14.063  -1.950
    4    HB3  GLU   5           HB3      GLU   5 -14.562 -12.372  -2.452
    5    HG2  GLU   5           HG2      GLU   5 -12.126 -13.937  -3.159
    6    HG3  GLU   5           HG3      GLU   5 -13.605 -14.303  -4.047

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLU   6           H        GLU   6 -14.831 -13.246   0.613
    2    HA   GLU   6           HA       GLU   6 -15.702 -10.558   1.013
    3    HB2  GLU   6           HB2      GLU   6 -16.158 -13.098   2.592
    4    HB3  GLU   6           HB3      GLU   6 -16.932 -11.560   2.972
    5    HG2  GLU   6           HG2      GLU   6 -17.126 -12.964   0.293
    6    HG3  GLU   6           HG3      GLU   6 -18.362 -13.028   1.546

  No H/Q in entry =           6
  In of MODEL   87
    1    H    VAL   7           H        VAL   7 -13.427 -12.700   2.588
    2    HA   VAL   7           HA       VAL   7 -12.947 -11.134   4.919
    3    HB   VAL   7           HB       VAL   7 -11.266 -13.198   3.471
    4   HG11  VAL   7          HG11      VAL   7 -10.785 -11.674   6.039
    5   HG13  VAL   7          HG12      VAL   7  -9.684 -11.901   4.681
    6   HG12  VAL   7          HG13      VAL   7 -10.058 -13.254   5.748
    7   HG21  VAL   7          HG21      VAL   7 -13.527 -13.734   4.684
    8   HG23  VAL   7          HG22      VAL   7 -12.601 -13.474   6.163
    9   HG22  VAL   7          HG23      VAL   7 -12.121 -14.739   5.033

  No H/Q in entry =           9
  In of MODEL   87
    1    H    VAL   8           H        VAL   8 -11.428 -11.264   1.713
    2    HA   VAL   8           HA       VAL   8  -9.343  -9.419   2.214
    3    HB   VAL   8           HB       VAL   8 -10.807 -10.078  -0.353
    4   HG13  VAL   8          HG11      VAL   8  -9.799  -7.916  -0.643
    5   HG12  VAL   8          HG12      VAL   8  -8.717  -9.082  -1.407
    6   HG11  VAL   8          HG13      VAL   8  -8.324  -8.428   0.181
    7   HG23  VAL   8          HG21      VAL   8  -7.985 -10.911   0.083
    8   HG22  VAL   8          HG22      VAL   8  -9.330 -11.819  -0.601
    9   HG21  VAL   8          HG23      VAL   8  -9.152 -11.698   1.147

  No H/Q in entry =           9
  In of MODEL   87
    1    H    MET   9           H        MET   9 -12.679  -8.985   1.044
    2    HA   MET   9           HA       MET   9 -12.579  -6.209   0.613
    3    HB2  MET   9           HB2      MET   9 -14.813  -8.068   1.419
    4    HB3  MET   9           HB3      MET   9 -15.080  -6.332   1.236
    5    HG2  MET   9           HG2      MET   9 -14.173  -6.465  -1.078
    6    HG3  MET   9           HG3      MET   9 -14.013  -8.212  -0.890
    7    HE2  MET   9           HE1      MET   9 -16.547  -5.415  -2.109
    8    HE1  MET   9           HE2      MET   9 -16.168  -5.246  -0.397
    9    HE3  MET   9           HE3      MET   9 -17.803  -5.676  -0.891

  No H/Q in entry =           9
  In of MODEL   87
    1    H    GLY  10           H        GLY  10 -13.275  -8.095   3.536
    2    HA3  GLY  10           HA2      GLY  10 -13.800  -5.905   5.256
    3    HA2  GLY  10           HA3      GLY  10 -13.257  -7.501   5.770

  No H/Q in entry =           3
  In of MODEL   87
    1    H    LEU  11           H        LEU  11 -10.810  -7.655   4.462
    2    HA   LEU  11           HA       LEU  11  -9.096  -6.245   6.225
    3    HB2  LEU  11           HB2      LEU  11  -8.560  -7.672   3.618
    4    HB3  LEU  11           HB3      LEU  11  -7.284  -6.985   4.621
    5    HG   LEU  11           HG       LEU  11  -9.314  -8.994   5.629
    6   HD13  LEU  11          HD11      LEU  11  -8.104 -10.244   4.067
    7   HD12  LEU  11          HD12      LEU  11  -7.176 -10.496   5.545
    8   HD11  LEU  11          HD13      LEU  11  -6.617  -9.336   4.340
    9   HD22  LEU  11          HD21      LEU  11  -8.454  -7.994   7.550
   10   HD21  LEU  11          HD22      LEU  11  -6.910  -7.610   6.792
   11   HD23  LEU  11          HD23      LEU  11  -7.257  -9.263   7.298

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  12           H        ILE  12  -9.982  -5.683   2.833
    2    HA   ILE  12           HA       ILE  12  -8.261  -3.473   2.414
    3    HB   ILE  12           HB       ILE  12 -10.916  -4.122   1.110
    4   HG12  ILE  12          HG12      ILE  12  -8.887  -5.778   1.029
    5   HG13  ILE  12          HG13      ILE  12  -9.738  -5.406  -0.456
    6   HG21  ILE  12          HG21      ILE  12  -8.685  -2.236   0.287
    7   HG23  ILE  12          HG22      ILE  12 -10.342  -1.793   0.677
    8   HG22  ILE  12          HG23      ILE  12  -9.990  -2.732  -0.745
    9   HD12  ILE  12          HD11      ILE  12  -7.241  -5.361  -0.664
   10   HD11  ILE  12          HD12      ILE  12  -7.212  -4.024   0.483
   11   HD13  ILE  12          HD13      ILE  12  -7.992  -3.830  -1.069

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  13           H        ILE  13 -11.629  -3.701   3.497
    2    HA   ILE  13           HA       ILE  13 -12.056  -0.909   3.768
    3    HB   ILE  13           HB       ILE  13 -13.294  -3.322   5.112
    4   HG12  ILE  13          HG12      ILE  13 -13.510  -2.721   2.578
    5   HG13  ILE  13          HG13      ILE  13 -14.930  -3.211   3.476
    6   HG21  ILE  13          HG21      ILE  13 -13.878  -0.391   5.471
    7   HG23  ILE  13          HG22      ILE  13 -13.788  -1.649   6.697
    8   HG22  ILE  13          HG23      ILE  13 -15.181  -1.567   5.621
    9   HD13  ILE  13          HD11      ILE  13 -15.659  -0.923   3.734
   10   HD12  ILE  13          HD12      ILE  13 -15.267  -1.186   2.045
   11   HD11  ILE  13          HD13      ILE  13 -14.134  -0.328   3.066

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ASN  14           H        ASN  14 -10.981  -3.415   6.044
    2    HA   ASN  14           HA       ASN  14 -10.769  -1.781   8.332
    3    HB2  ASN  14           HB2      ASN  14 -10.545  -4.391   8.008
    4    HB3  ASN  14           HB3      ASN  14  -8.831  -4.023   7.857
    5   HD21  ASN  14          HD21      ASN  14  -9.491  -5.543  10.029
    6   HD22  ASN  14          HD22      ASN  14  -9.457  -4.624  11.454

  No H/Q in entry =           6
  In of MODEL   87
    1    H    SER  15           H        SER  15  -8.368  -2.630   5.847
    2    HA   SER  15           HA       SER  15  -6.212  -1.162   6.927
    3    HB2  SER  15           HB2      SER  15  -5.185  -1.390   4.775
    4    HB3  SER  15           HB3      SER  15  -6.163  -2.837   4.990
    5    HG   SER  15           HG       SER  15  -7.592  -2.113   3.561

  No H/Q in entry =           5
  In of MODEL   87
    1    H    GLY  16           H        GLY  16  -8.796  -0.264   4.673
    2    HA3  GLY  16           HA2      GLY  16  -7.908   2.368   4.126
    3    HA2  GLY  16           HA3      GLY  16  -9.565   1.790   3.959

  No H/Q in entry =           3
  In of MODEL   87
    1    H    GLN  17           H        GLN  17 -10.124   1.069   6.606
    2    HA   GLN  17           HA       GLN  17 -10.808   3.580   7.747
    3    HB2  GLN  17           HB2      GLN  17 -12.087   1.550   8.245
    4    HB3  GLN  17           HB3      GLN  17 -10.683   0.848   9.050
    5    HG2  GLN  17           HG2      GLN  17 -10.704   2.630  10.721
    6    HG3  GLN  17           HG3      GLN  17 -12.038   3.426   9.888
    7   HE21  GLN  17          HE21      GLN  17 -12.302   2.585  12.606
    8   HE22  GLN  17          HE22      GLN  17 -13.425   1.314  12.667

  No H/Q in entry =           8
  In of MODEL   87
    1    H    ALA  18           H        ALA  18  -8.205   1.271   8.372
    2    HA   ALA  18           HA       ALA  18  -7.102   2.474  10.647
    3    HB2  ALA  18           HB1      ALA  18  -6.511   0.253   9.280
    4    HB3  ALA  18           HB2      ALA  18  -5.343   1.023  10.355
    5    HB1  ALA  18           HB3      ALA  18  -5.258   1.302   8.615

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ARG  19           H        ARG  19  -6.315   2.992   7.202
    2    HA   ARG  19           HA       ARG  19  -4.398   5.020   7.638
    3    HB2  ARG  19           HB2      ARG  19  -4.729   3.885   5.441
    4    HB3  ARG  19           HB3      ARG  19  -6.263   4.741   5.260
    5    HG2  ARG  19           HG2      ARG  19  -5.113   6.901   5.333
    6    HG3  ARG  19           HG3      ARG  19  -3.573   6.100   5.642
    7    HD2  ARG  19           HD2      ARG  19  -3.684   6.694   3.299
    8    HD3  ARG  19           HD3      ARG  19  -3.787   4.935   3.443
    9    HE   ARG  19           HE       ARG  19  -6.412   5.869   3.427
   10   HH21  ARG  19          HH11      ARG  19  -7.599   6.038   1.505
   11   HH22  ARG  19          HH12      ARG  19  -6.772   6.109  -0.011
   12   HH11  ARG  19          HH21      ARG  19  -3.629   5.907   1.403
   13   HH12  ARG  19          HH22      ARG  19  -4.523   6.032  -0.070

  No H/Q in entry =          13
  In of MODEL   87
    1    H    SER  20           H        SER  20  -7.892   5.169   7.027
    2    HA   SER  20           HA       SER  20  -8.224   7.928   6.979
    3    HB2  SER  20           HB2      SER  20 -10.111   6.605   6.436
    4    HB3  SER  20           HB3      SER  20 -10.017   5.711   7.951
    5    HG   SER  20           HG       SER  20 -10.371   8.507   7.920

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LEU  21           H        LEU  21  -8.253   5.744   9.782
    2    HA   LEU  21           HA       LEU  21  -8.682   7.742  11.747
    3    HB2  LEU  21           HB2      LEU  21  -7.351   5.031  11.912
    4    HB3  LEU  21           HB3      LEU  21  -7.665   6.049  13.315
    5    HG   LEU  21           HG       LEU  21  -9.822   5.156  11.378
    6   HD12  LEU  21          HD11      LEU  21  -9.248   4.021  14.124
    7   HD11  LEU  21          HD12      LEU  21  -8.666   3.275  12.636
    8   HD13  LEU  21          HD13      LEU  21 -10.400   3.422  12.928
    9   HD22  LEU  21          HD21      LEU  21 -10.728   6.990  12.510
   10   HD21  LEU  21          HD22      LEU  21  -9.787   6.702  13.969
   11   HD23  LEU  21          HD23      LEU  21 -11.175   5.688  13.609

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ALA  22           H        ALA  22  -5.737   6.343  10.348
    2    HA   ALA  22           HA       ALA  22  -3.852   7.639  11.978
    3    HB2  ALA  22           HB1      ALA  22  -3.446   5.783  10.287
    4    HB1  ALA  22           HB2      ALA  22  -2.239   7.068  10.327
    5    HB3  ALA  22           HB3      ALA  22  -3.453   7.036   9.047

  No H/Q in entry =           5
  In of MODEL   87
    1    H    TYR  23           H        TYR  23  -5.149   8.670   8.791
    2    HA   TYR  23           HA       TYR  23  -3.791  11.154   8.727
    3    HB2  TYR  23           HB2      TYR  23  -4.873  10.253   6.731
    4    HB3  TYR  23           HB3      TYR  23  -6.453  10.373   7.506
    5    HD1  TYR  23           HD1      TYR  23  -3.523  12.398   6.386
    6    HD2  TYR  23           HD2      TYR  23  -7.680  12.387   7.467
    7    HE1  TYR  23           HE1      TYR  23  -3.726  14.751   5.627
    8    HE2  TYR  23           HE2      TYR  23  -7.884  14.740   6.707
    9    HH   TYR  23           HH       TYR  23  -5.434  16.298   4.880

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ALA  24           H        ALA  24  -6.923  10.203  10.095
    2    HA   ALA  24           HA       ALA  24  -7.740  12.799  10.865
    3    HB1  ALA  24           HB1      ALA  24  -9.571  11.564  11.325
    4    HB2  ALA  24           HB2      ALA  24  -8.755  10.984  12.776
    5    HB3  ALA  24           HB3      ALA  24  -8.633  10.072  11.272

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ALA  25           H        ALA  25  -5.765  10.323  12.445
    2    HA   ALA  25           HA       ALA  25  -5.426  11.571  14.949
    3    HB2  ALA  25           HB1      ALA  25  -4.676   9.213  14.129
    4    HB3  ALA  25           HB2      ALA  25  -3.658  10.061  15.294
    5    HB1  ALA  25           HB3      ALA  25  -3.216  10.042  13.586

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LEU  26           H        LEU  26  -3.621  11.856  11.915
    2    HA   LEU  26           HA       LEU  26  -1.650  13.658  12.839
    3    HB2  LEU  26           HB2      LEU  26  -1.351  12.505  10.736
    4    HB3  LEU  26           HB3      LEU  26  -2.816  13.227  10.076
    5    HG   LEU  26           HG       LEU  26  -1.782  15.468  10.217
    6   HD12  LEU  26          HD11      LEU  26   0.755  15.465  10.640
    7   HD11  LEU  26          HD12      LEU  26   0.515  13.886  11.383
    8   HD13  LEU  26          HD13      LEU  26  -0.282  15.307  12.057
    9   HD21  LEU  26          HD21      LEU  26  -0.052  13.399   8.827
   10   HD23  LEU  26          HD22      LEU  26  -0.079  15.121   8.458
   11   HD22  LEU  26          HD23      LEU  26  -1.510  14.136   8.163

  No H/Q in entry =          11
  In of MODEL   87
    1    H    LYS  27           H        LYS  27  -4.822  14.170  11.351
    2    HA   LYS  27           HA       LYS  27  -4.741  16.958  11.155
    3    HB2  LYS  27           HB2      LYS  27  -6.495  15.498  10.162
    4    HB3  LYS  27           HB3      LYS  27  -7.160  15.246  11.775
    5    HG2  LYS  27           HG2      LYS  27  -7.569  17.656  12.012
    6    HG3  LYS  27           HG3      LYS  27  -6.852  17.947  10.423
    7    HD2  LYS  27           HD2      LYS  27  -8.594  16.529   9.380
    8    HD3  LYS  27           HD3      LYS  27  -9.316  16.255  10.967
    9    HE2  LYS  27           HE2      LYS  27  -9.737  18.670  11.210
   10    HE3  LYS  27           HE3      LYS  27  -8.987  18.966   9.638
   11    HZ3  LYS  27           HZ1      LYS  27 -11.364  18.863   9.388
   12    HZ2  LYS  27           HZ2      LYS  27 -11.429  17.346  10.156
   13    HZ1  LYS  27           HZ3      LYS  27 -10.677  17.504   8.638

  No H/Q in entry =          13
  In of MODEL   87
    1    H    GLN  28           H        GLN  28  -5.659  14.879  13.877
    2    HA   GLN  28           HA       GLN  28  -6.542  16.890  15.652
    3    HB2  GLN  28           HB2      GLN  28  -5.168  14.244  16.194
    4    HB3  GLN  28           HB3      GLN  28  -5.899  15.255  17.443
    5    HG2  GLN  28           HG2      GLN  28  -7.381  14.178  15.028
    6    HG3  GLN  28           HG3      GLN  28  -7.428  13.449  16.632
    7   HE21  GLN  28          HE21      GLN  28  -7.535  15.840  18.212
    8   HE22  GLN  28          HE22      GLN  28  -9.015  16.611  17.904

  No H/Q in entry =           8
  In of MODEL   87
    1    H    ALA  29           H        ALA  29  -3.333  15.562  14.973
    2    HA   ALA  29           HA       ALA  29  -1.888  16.944  16.957
    3    HB1  ALA  29           HB1      ALA  29   0.039  16.234  15.844
    4    HB3  ALA  29           HB2      ALA  29  -0.708  16.367  14.253
    5    HB2  ALA  29           HB3      ALA  29  -1.148  15.038  15.325

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LYS  30           H        LYS  30  -2.725  17.835  13.625
    2    HA   LYS  30           HA       LYS  30  -1.287  20.259  13.531
    3    HB2  LYS  30           HB2      LYS  30  -3.823  19.415  12.113
    4    HB3  LYS  30           HB3      LYS  30  -2.971  20.920  11.774
    5    HG2  LYS  30           HG2      LYS  30  -0.914  19.603  11.266
    6    HG3  LYS  30           HG3      LYS  30  -1.839  18.118  11.507
    7    HD2  LYS  30           HD2      LYS  30  -3.390  18.778   9.707
    8    HD3  LYS  30           HD3      LYS  30  -2.487  20.276   9.469
    9    HE2  LYS  30           HE2      LYS  30  -0.469  18.959   8.895
   10    HE3  LYS  30           HE3      LYS  30  -1.390  17.467   9.102
   11    HZ2  LYS  30           HZ1      LYS  30  -1.195  18.338   6.762
   12    HZ1  LYS  30           HZ2      LYS  30  -2.225  19.613   7.228
   13    HZ3  LYS  30           HZ3      LYS  30  -2.769  18.002   7.296

  No H/Q in entry =          13
  In of MODEL   87
    1    H    GLN  31           H        GLN  31  -4.403  19.444  14.933
    2    HA   GLN  31           HA       GLN  31  -5.132  22.210  15.385
    3    HB2  GLN  31           HB2      GLN  31  -6.347  19.778  16.701
    4    HB3  GLN  31           HB3      GLN  31  -7.086  21.359  16.455
    5    HG2  GLN  31           HG2      GLN  31  -6.377  20.575  13.867
    6    HG3  GLN  31           HG3      GLN  31  -6.924  19.077  14.611
    7   HE21  GLN  31          HE21      GLN  31  -8.307  20.671  12.506
    8   HE22  GLN  31          HE22      GLN  31  -9.817  21.082  13.159

  No H/Q in entry =           8
  In of MODEL   87
    1    H    GLY  32           H        GLY  32  -2.850  20.251  16.710
    2    HA3  GLY  32           HA2      GLY  32  -1.449  20.693  18.517
    3    HA2  GLY  32           HA3      GLY  32  -2.563  21.950  19.039

  No H/Q in entry =           3
  In of MODEL   87
    1    H    ASP  33           H        ASP  33  -4.024  18.931  18.369
    2    HA   ASP  33           HA       ASP  33  -4.449  18.475  21.247
    3    HB2  ASP  33           HB2      ASP  33  -5.862  17.486  18.764
    4    HB3  ASP  33           HB3      ASP  33  -6.220  16.878  20.379

  No H/Q in entry =           4
  In of MODEL   87
    1    H    PHE  34           H        PHE  34  -2.294  17.595  21.558
    2    HA   PHE  34           HA       PHE  34  -1.319  15.334  20.158
    3    HB2  PHE  34           HB2      PHE  34  -0.698  16.307  22.955
    4    HB3  PHE  34           HB3      PHE  34   0.217  15.072  22.089
    5    HD1  PHE  34           HD1      PHE  34   0.089  18.499  22.828
    6    HD2  PHE  34           HD2      PHE  34   0.892  15.789  19.593
    7    HE1  PHE  34           HE1      PHE  34   1.412  20.254  21.680
    8    HE2  PHE  34           HE2      PHE  34   2.210  17.547  18.450
    9    HZ   PHE  34           HZ       PHE  34   2.472  19.777  19.498

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ALA  35           H        ALA  35  -3.364  15.635  23.015
    2    HA   ALA  35           HA       ALA  35  -3.191  12.970  23.909
    3    HB3  ALA  35           HB1      ALA  35  -5.643  13.628  24.760
    4    HB1  ALA  35           HB2      ALA  35  -5.086  15.239  24.307
    5    HB2  ALA  35           HB3      ALA  35  -4.188  14.302  25.500

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ALA  36           H        ALA  36  -5.614  14.522  21.804
    2    HA   ALA  36           HA       ALA  36  -7.060  12.131  21.319
    3    HB1  ALA  36           HB1      ALA  36  -8.493  13.574  20.360
    4    HB3  ALA  36           HB2      ALA  36  -7.312  13.980  19.115
    5    HB2  ALA  36           HB3      ALA  36  -7.329  14.866  20.640

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ALA  37           H        ALA  37  -4.353  13.683  19.660
    2    HA   ALA  37           HA       ALA  37  -4.334  12.051  17.361
    3    HB3  ALA  37           HB1      ALA  37  -2.322  13.733  18.792
    4    HB2  ALA  37           HB2      ALA  37  -2.847  13.799  17.110
    5    HB1  ALA  37           HB3      ALA  37  -1.712  12.552  17.633

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LYS  38           H        LYS  38  -2.590  11.717  20.444
    2    HA   LYS  38           HA       LYS  38  -1.296   9.300  19.955
    3    HB2  LYS  38           HB2      LYS  38  -1.602  11.064  22.102
    4    HB3  LYS  38           HB3      LYS  38  -2.243   9.542  22.715
    5    HG2  LYS  38           HG2      LYS  38  -0.163   8.394  22.183
    6    HG3  LYS  38           HG3      LYS  38   0.468   9.832  21.373
    7    HD2  LYS  38           HD2      LYS  38   0.647  11.045  23.410
    8    HD3  LYS  38           HD3      LYS  38  -0.390   9.907  24.273
    9    HE2  LYS  38           HE2      LYS  38   1.959   9.559  24.898
   10    HE3  LYS  38           HE3      LYS  38   1.338   8.152  24.031
   11    HZ3  LYS  38           HZ1      LYS  38   2.649   8.556  22.254
   12    HZ2  LYS  38           HZ2      LYS  38   3.612   9.369  23.395
   13    HZ1  LYS  38           HZ3      LYS  38   2.548  10.245  22.401

  No H/Q in entry =          13
  In of MODEL   87
    1    H    ALA  39           H        ALA  39  -4.532   9.837  21.349
    2    HA   ALA  39           HA       ALA  39  -5.131   7.124  21.848
    3    HB3  ALA  39           HB1      ALA  39  -7.260   9.099  21.077
    4    HB2  ALA  39           HB2      ALA  39  -6.364   9.312  22.581
    5    HB1  ALA  39           HB3      ALA  39  -7.300   7.841  22.313

  No H/Q in entry =           5
  In of MODEL   87
    1    H    MET  40           H        MET  40  -5.680   9.149  19.002
    2    HA   MET  40           HA       MET  40  -7.177   7.239  17.535
    3    HB2  MET  40           HB2      MET  40  -5.533   9.614  16.638
    4    HB3  MET  40           HB3      MET  40  -6.568   8.670  15.564
    5    HG2  MET  40           HG2      MET  40  -7.594   9.929  18.121
    6    HG3  MET  40           HG3      MET  40  -7.635  10.767  16.571
    7    HE3  MET  40           HE1      MET  40 -10.234   9.185  14.497
    8    HE2  MET  40           HE2      MET  40  -8.479   9.279  14.354
    9    HE1  MET  40           HE3      MET  40  -9.381  10.656  14.987

  No H/Q in entry =           9
  In of MODEL   87
    1    H    MET  41           H        MET  41  -3.677   7.930  17.669
    2    HA   MET  41           HA       MET  41  -2.935   6.168  15.569
    3    HB2  MET  41           HB2      MET  41  -1.318   6.810  18.047
    4    HB3  MET  41           HB3      MET  41  -0.704   6.156  16.533
    5    HG2  MET  41           HG2      MET  41  -1.829   8.355  15.528
    6    HG3  MET  41           HG3      MET  41  -1.590   8.938  17.174
    7    HE2  MET  41           HE1      MET  41   1.299   6.801  17.542
    8    HE1  MET  41           HE2      MET  41   0.525   8.104  18.440
    9    HE3  MET  41           HE3      MET  41   2.153   8.327  17.802

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ASP  42           H        ASP  42  -3.337   5.695  19.053
    2    HA   ASP  42           HA       ASP  42  -2.336   3.088  19.212
    3    HB2  ASP  42           HB2      ASP  42  -3.192   4.856  21.035
    4    HB3  ASP  42           HB3      ASP  42  -4.632   3.850  20.956

  No H/Q in entry =           4
  In of MODEL   87
    1    H    GLN  43           H        GLN  43  -5.653   4.235  18.703
    2    HA   GLN  43           HA       GLN  43  -6.829   1.663  18.501
    3    HB2  GLN  43           HB2      GLN  43  -7.715   4.329  17.373
    4    HB3  GLN  43           HB3      GLN  43  -8.696   2.862  17.346
    5    HG2  GLN  43           HG2      GLN  43  -8.412   2.733  19.854
    6    HG3  GLN  43           HG3      GLN  43  -7.667   4.329  19.787
    7   HE21  GLN  43          HE21      GLN  43  -9.850   4.435  21.281
    8   HE22  GLN  43          HE22      GLN  43 -11.201   5.029  20.446

  No H/Q in entry =           8
  In of MODEL   87
    1    H    SER  44           H        SER  44  -5.453   3.863  16.097
    2    HA   SER  44           HA       SER  44  -6.165   2.391  13.803
    3    HB2  SER  44           HB2      SER  44  -4.880   4.758  14.254
    4    HB3  SER  44           HB3      SER  44  -3.537   3.746  13.727
    5    HG   SER  44           HG       SER  44  -4.631   4.734  11.962

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ARG  45           H        ARG  45  -3.296   2.239  15.892
    2    HA   ARG  45           HA       ARG  45  -1.837   0.268  14.512
    3    HB2  ARG  45           HB2      ARG  45  -0.983   1.675  16.386
    4    HB3  ARG  45           HB3      ARG  45  -1.990   0.756  17.501
    5    HG2  ARG  45           HG2      ARG  45  -0.783  -1.318  16.860
    6    HG3  ARG  45           HG3      ARG  45   0.249  -0.374  15.786
    7    HD2  ARG  45           HD2      ARG  45   0.994   0.995  17.746
    8    HD3  ARG  45           HD3      ARG  45   0.055  -0.070  18.815
    9    HE   ARG  45           HE       ARG  45   1.739  -1.685  17.238
   10   HH21  ARG  45          HH11      ARG  45   3.626  -2.533  18.080
   11   HH22  ARG  45          HH12      ARG  45   4.404  -1.759  19.415
   12   HH11  ARG  45          HH21      ARG  45   2.065   0.774  19.633
   13   HH12  ARG  45          HH22      ARG  45   3.520   0.116  20.292

  No H/Q in entry =          13
  In of MODEL   87
    1    H    MET  46           H        MET  46  -4.247  -0.026  17.104
    2    HA   MET  46           HA       MET  46  -4.116  -2.827  17.407
    3    HB2  MET  46           HB2      MET  46  -6.262  -0.794  18.003
    4    HB3  MET  46           HB3      MET  46  -6.491  -2.512  18.340
    5    HG2  MET  46           HG2      MET  46  -4.504  -2.531  19.764
    6    HG3  MET  46           HG3      MET  46  -4.177  -0.850  19.377
    7    HE2  MET  46           HE1      MET  46  -7.242  -2.768  22.054
    8    HE1  MET  46           HE2      MET  46  -6.440  -3.415  20.627
    9    HE3  MET  46           HE3      MET  46  -7.930  -2.494  20.448

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ALA  47           H        ALA  47  -6.103  -0.781  15.309
    2    HA   ALA  47           HA       ALA  47  -7.744  -2.809  14.234
    3    HB3  ALA  47           HB1      ALA  47  -8.392  -0.562  13.819
    4    HB1  ALA  47           HB2      ALA  47  -7.906  -1.199  12.248
    5    HB2  ALA  47           HB3      ALA  47  -6.815  -0.146  13.151

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LEU  48           H        LEU  48  -4.604  -1.540  13.196
    2    HA   LEU  48           HA       LEU  48  -4.337  -3.130  10.853
    3    HB2  LEU  48           HB2      LEU  48  -2.268  -1.883  12.671
    4    HB3  LEU  48           HB3      LEU  48  -1.904  -2.606  11.104
    5    HG   LEU  48           HG       LEU  48  -3.898  -0.362  11.490
    6   HD13  LEU  48          HD11      LEU  48  -1.766   0.484  12.165
    7   HD12  LEU  48          HD12      LEU  48  -2.028   1.044  10.513
    8   HD11  LEU  48          HD13      LEU  48  -0.950  -0.318  10.823
    9   HD22  LEU  48          HD21      LEU  48  -4.375  -1.336   9.411
   10   HD21  LEU  48          HD22      LEU  48  -2.698  -1.794   9.121
   11   HD23  LEU  48          HD23      LEU  48  -3.193  -0.108   8.963

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ASN  49           H        ASN  49  -3.309  -3.548  14.202
    2    HA   ASN  49           HA       ASN  49  -1.737  -5.833  13.873
    3    HB2  ASN  49           HB2      ASN  49  -1.724  -4.527  15.925
    4    HB3  ASN  49           HB3      ASN  49  -3.408  -4.926  16.233
    5   HD21  ASN  49          HD21      ASN  49  -0.125  -6.091  16.459
    6   HD22  ASN  49          HD22      ASN  49  -0.491  -7.545  17.252

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLU  50           H        GLU  50  -5.204  -5.508  14.533
    2    HA   GLU  50           HA       GLU  50  -5.758  -8.300  14.635
    3    HB2  GLU  50           HB2      GLU  50  -7.322  -6.591  15.508
    4    HB3  GLU  50           HB3      GLU  50  -7.601  -6.020  13.862
    5    HG2  GLU  50           HG2      GLU  50  -8.496  -8.202  13.216
    6    HG3  GLU  50           HG3      GLU  50  -8.130  -8.854  14.810

  No H/Q in entry =           6
  In of MODEL   87
    1    H    ALA  51           H        ALA  51  -5.781  -5.897  12.043
    2    HA   ALA  51           HA       ALA  51  -6.784  -7.606  10.014
    3    HB2  ALA  51           HB1      ALA  51  -6.532  -5.794   8.649
    4    HB1  ALA  51           HB2      ALA  51  -4.890  -5.471   9.204
    5    HB3  ALA  51           HB3      ALA  51  -6.269  -4.941  10.169

  No H/Q in entry =           5
  In of MODEL   87
    1    H    HIS  52           H        HIS  52  -3.484  -6.751  11.012
    2    HA   HIS  52           HA       HIS  52  -2.101  -8.258   9.065
    3    HB2  HIS  52           HB2      HIS  52  -1.059  -6.538  10.528
    4    HB3  HIS  52           HB3      HIS  52  -1.226  -7.637  11.896
    5    HD1  HIS  52           HD1      HIS  52   0.269  -9.777  11.908
    6    HD2  HIS  52           HD2      HIS  52   1.001  -7.217   8.699
    7    HE1  HIS  52           HE1      HIS  52   2.446 -10.541  10.865
    8    HE2  HIS  52           HE2      HIS  52   2.907  -8.990   8.907

  No H/Q in entry =           8
  In of MODEL   87
    1    H    LEU  53           H        LEU  53  -3.338  -9.122  12.271
    2    HA   LEU  53           HA       LEU  53  -2.182 -11.686  12.464
    3    HB2  LEU  53           HB2      LEU  53  -4.653 -10.469  13.671
    4    HB3  LEU  53           HB3      LEU  53  -4.220 -12.151  13.963
    5    HG   LEU  53           HG       LEU  53  -2.287  -9.861  14.446
    6   HD12  LEU  53          HD11      LEU  53  -2.899 -10.264  16.890
    7   HD11  LEU  53          HD12      LEU  53  -4.304 -11.148  16.297
    8   HD13  LEU  53          HD13      LEU  53  -4.120  -9.437  15.927
    9   HD23  LEU  53          HD21      LEU  53  -1.436 -11.681  16.131
   10   HD22  LEU  53          HD22      LEU  53  -1.041 -11.859  14.425
   11   HD21  LEU  53          HD23      LEU  53  -2.338 -12.809  15.126

  No H/Q in entry =          11
  In of MODEL   87
    1    H    VAL  54           H        VAL  54  -5.271 -10.604  11.092
    2    HA   VAL  54           HA       VAL  54  -6.224 -13.181  10.397
    3    HB   VAL  54           HB       VAL  54  -6.822 -10.436   9.265
    4   HG12  VAL  54          HG11      VAL  54  -8.943 -11.778   8.443
    5   HG11  VAL  54          HG12      VAL  54  -7.854 -13.162   8.517
    6   HG13  VAL  54          HG13      VAL  54  -7.468 -11.791   7.479
    7   HG22  VAL  54          HG21      VAL  54  -7.738 -10.463  11.413
    8   HG21  VAL  54          HG22      VAL  54  -8.020 -12.202  11.390
    9   HG23  VAL  54          HG23      VAL  54  -9.080 -11.126  10.481

  No H/Q in entry =           9
  In of MODEL   87
    1    H    GLN  55           H        GLN  55  -4.306 -10.758   8.620
    2    HA   GLN  55           HA       GLN  55  -4.191 -12.220   6.200
    3    HB2  GLN  55           HB2      GLN  55  -3.549  -9.965   6.016
    4    HB3  GLN  55           HB3      GLN  55  -2.445 -10.063   7.385
    5    HG2  GLN  55           HG2      GLN  55  -0.737 -10.935   6.114
    6    HG3  GLN  55           HG3      GLN  55  -1.823 -11.890   5.114
    7   HE21  GLN  55          HE21      GLN  55  -1.820 -11.196   2.994
    8   HE22  GLN  55          HE22      GLN  55  -1.593  -9.594   2.488

  No H/Q in entry =           8
  In of MODEL   87
    1    H    THR  56           H        THR  56  -2.096 -12.239   9.088
    2    HA   THR  56           HA       THR  56  -0.041 -13.871   8.176
    3    HB   THR  56           HB       THR  56  -1.297 -14.109  10.919
    4    HG1  THR  56           HG1      THR  56   0.058 -12.054   9.675
    5   HG22  THR  56          HG21      THR  56   1.617 -14.271  10.158
    6   HG21  THR  56          HG22      THR  56   0.570 -15.690  10.099
    7   HG23  THR  56          HG23      THR  56   0.833 -14.850  11.627

  No H/Q in entry =           7
  In of MODEL   87
    1    H    LYS  57           H        LYS  57  -3.183 -14.857   9.525
    2    HA   LYS  57           HA       LYS  57  -2.784 -17.659   9.276
    3    HB2  LYS  57           HB2      LYS  57  -4.588 -16.554  10.620
    4    HB3  LYS  57           HB3      LYS  57  -5.362 -16.065   9.121
    5    HG2  LYS  57           HG2      LYS  57  -5.689 -18.396   8.480
    6    HG3  LYS  57           HG3      LYS  57  -4.821 -18.940   9.912
    7    HD2  LYS  57           HD2      LYS  57  -6.553 -17.866  11.343
    8    HD3  LYS  57           HD3      LYS  57  -7.443 -17.408   9.891
    9    HE2  LYS  57           HE2      LYS  57  -6.760 -20.259  10.698
   10    HE3  LYS  57           HE3      LYS  57  -8.345 -19.514  10.883
   11    HZ2  LYS  57           HZ1      LYS  57  -7.037 -20.513   8.504
   12    HZ1  LYS  57           HZ2      LYS  57  -7.835 -19.026   8.311
   13    HZ3  LYS  57           HZ3      LYS  57  -8.690 -20.385   8.868

  No H/Q in entry =          13
  In of MODEL   87
    1    H    LEU  58           H        LEU  58  -4.065 -15.191   7.100
    2    HA   LEU  58           HA       LEU  58  -4.891 -16.998   5.087
    3    HB2  LEU  58           HB2      LEU  58  -4.233 -14.060   4.959
    4    HB3  LEU  58           HB3      LEU  58  -4.908 -14.983   3.615
    5    HG   LEU  58           HG       LEU  58  -6.195 -14.786   6.358
    6   HD11  LEU  58          HD11      LEU  58  -6.457 -13.130   3.868
    7   HD13  LEU  58          HD12      LEU  58  -6.445 -12.626   5.558
    8   HD12  LEU  58          HD13      LEU  58  -7.878 -13.393   4.879
    9   HD22  LEU  58          HD21      LEU  58  -7.187 -16.677   5.481
   10   HD21  LEU  58          HD22      LEU  58  -6.833 -16.228   3.813
   11   HD23  LEU  58          HD23      LEU  58  -8.187 -15.481   4.660

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  59           H        ILE  59  -1.739 -15.843   5.962
    2    HA   ILE  59           HA       ILE  59  -0.643 -16.585   3.329
    3    HB   ILE  59           HB       ILE  59   0.156 -14.533   4.896
    4   HG12  ILE  59          HG12      ILE  59   2.235 -16.226   3.497
    5   HG13  ILE  59          HG13      ILE  59   1.060 -15.281   2.620
    6   HG21  ILE  59          HG21      ILE  59   0.852 -16.314   6.670
    7   HG23  ILE  59          HG22      ILE  59   1.982 -15.029   6.308
    8   HG22  ILE  59          HG23      ILE  59   2.204 -16.632   5.609
    9   HD13  ILE  59          HD11      ILE  59   1.815 -13.235   3.771
   10   HD12  ILE  59          HD12      ILE  59   3.141 -14.005   2.903
   11   HD11  ILE  59          HD13      ILE  59   3.006 -14.187   4.653

  No H/Q in entry =          11
  In of MODEL   87
    1    H    GLU  60           H        GLU  60  -0.686 -17.696   6.695
    2    HA   GLU  60           HA       GLU  60   1.311 -19.709   6.435
    3    HB2  GLU  60           HB2      GLU  60   0.557 -18.920   8.624
    4    HB3  GLU  60           HB3      GLU  60  -1.062 -19.541   8.311
    5    HG2  GLU  60           HG2      GLU  60  -0.157 -21.835   8.167
    6    HG3  GLU  60           HG3      GLU  60   1.463 -21.213   8.475

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLY  61           H        GLY  61  -2.199 -19.745   5.934
    2    HA3  GLY  61           HA2      GLY  61  -1.995 -22.540   4.972
    3    HA2  GLY  61           HA3      GLY  61  -3.470 -21.779   5.561

  No H/Q in entry =           3
  In of MODEL   87
    1    H    ASP  62           H        ASP  62  -1.202 -20.241   3.368
    2    HA   ASP  62           HA       ASP  62  -3.215 -19.493   1.532
    3    HB2  ASP  62           HB2      ASP  62  -1.332 -18.709   0.156
    4    HB3  ASP  62           HB3      ASP  62  -1.134 -18.233   1.839

  No H/Q in entry =           4
  In of MODEL   87
    1    H    ALA  63           H        ALA  63  -4.137 -21.786   1.270
    2    HA   ALA  63           HA       ALA  63  -2.741 -23.743  -0.268
    3    HB3  ALA  63           HB1      ALA  63  -5.726 -23.362  -0.143
    4    HB2  ALA  63           HB2      ALA  63  -4.787 -24.146   1.127
    5    HB1  ALA  63           HB3      ALA  63  -4.840 -24.849  -0.490

  No H/Q in entry =           5
  In of MODEL   87
    1    H    GLY  64           H        GLY  64  -4.870 -21.043  -1.066
    2    HA3  GLY  64           HA2      GLY  64  -5.237 -19.906  -3.026
    3    HA2  GLY  64           HA3      GLY  64  -3.799 -20.680  -3.668

  No H/Q in entry =           3
  In of MODEL   87
    1    H    GLU  65           H        GLU  65  -5.350 -20.498  -5.631
    2    HA   GLU  65           HA       GLU  65  -7.594 -22.194  -5.800
    3    HB2  GLU  65           HB2      GLU  65  -5.802 -21.122  -7.981
    4    HB3  GLU  65           HB3      GLU  65  -7.350 -21.923  -8.256
    5    HG2  GLU  65           HG2      GLU  65  -7.009 -19.472  -6.511
    6    HG3  GLU  65           HG3      GLU  65  -7.503 -19.411  -8.201

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLY  66           H        GLY  66  -4.232 -22.715  -6.531
    2    HA3  GLY  66           HA2      GLY  66  -4.730 -25.559  -7.119
    3    HA2  GLY  66           HA3      GLY  66  -3.386 -24.637  -7.762

  No H/Q in entry =           3
  In of MODEL   87
    1    H    LYS  67           H        LYS  67  -2.489 -26.778  -6.838
    2    HA   LYS  67           HA       LYS  67  -2.176 -27.135  -4.071
    3    HB2  LYS  67           HB2      LYS  67  -0.828 -28.218  -6.507
    4    HB3  LYS  67           HB3      LYS  67  -0.178 -28.588  -4.905
    5    HG2  LYS  67           HG2      LYS  67  -1.964 -30.200  -5.843
    6    HG3  LYS  67           HG3      LYS  67  -2.188 -29.615  -4.196
    7    HD2  LYS  67           HD2      LYS  67  -3.849 -28.044  -4.875
    8    HD3  LYS  67           HD3      LYS  67  -3.449 -28.251  -6.580
    9    HE2  LYS  67           HE2      LYS  67  -4.458 -30.358  -6.701
   10    HE3  LYS  67           HE3      LYS  67  -4.339 -30.622  -4.963
   11    HZ3  LYS  67           HZ1      LYS  67  -6.566 -30.134  -5.308
   12    HZ2  LYS  67           HZ2      LYS  67  -6.237 -28.915  -6.444
   13    HZ1  LYS  67           HZ3      LYS  67  -5.926 -28.649  -4.796

  No H/Q in entry =          13
  In of MODEL   87
    1    H    MET  68           H        MET  68   0.510 -26.465  -6.237
    2    HA   MET  68           HA       MET  68   2.270 -25.521  -4.254
    3    HB2  MET  68           HB2      MET  68   2.320 -25.176  -7.253
    4    HB3  MET  68           HB3      MET  68   3.674 -24.836  -6.174
    5    HG2  MET  68           HG2      MET  68   2.284 -27.521  -6.399
    6    HG3  MET  68           HG3      MET  68   3.808 -27.112  -7.191
    7    HE1  MET  68           HE1      MET  68   5.726 -26.333  -6.248
    8    HE3  MET  68           HE2      MET  68   6.419 -26.831  -4.707
    9    HE2  MET  68           HE3      MET  68   5.454 -25.360  -4.797

  No H/Q in entry =           9
  In of MODEL   87
    1    H    LYS  69           H        LYS  69   0.193 -23.739  -6.527
    2    HA   LYS  69           HA       LYS  69   1.284 -21.195  -5.936
    3    HB2  LYS  69           HB2      LYS  69  -1.292 -21.985  -7.260
    4    HB3  LYS  69           HB3      LYS  69  -0.763 -20.308  -7.081
    5    HG2  LYS  69           HG2      LYS  69   1.341 -20.830  -8.241
    6    HG3  LYS  69           HG3      LYS  69   0.838 -22.511  -8.412
    7    HD2  LYS  69           HD2      LYS  69  -1.071 -21.833  -9.784
    8    HD3  LYS  69           HD3      LYS  69  -0.648 -20.133  -9.563
    9    HE2  LYS  69           HE2      LYS  69   0.198 -20.928 -11.726
   10    HE3  LYS  69           HE3      LYS  69   1.542 -20.553 -10.651
   11    HZ2  LYS  69           HZ1      LYS  69   0.408 -23.254 -11.133
   12    HZ1  LYS  69           HZ2      LYS  69   1.696 -22.895 -10.083
   13    HZ3  LYS  69           HZ3      LYS  69   1.873 -22.668 -11.757

  No H/Q in entry =          13
  In of MODEL   87
    1    H    VAL  70           H        VAL  70  -0.399 -19.330  -5.381
    2    HA   VAL  70           HA       VAL  70  -1.765 -20.025  -2.842
    3    HB   VAL  70           HB       VAL  70  -0.958 -17.858  -1.931
    4   HG13  VAL  70          HG11      VAL  70   0.308 -19.849  -1.376
    5   HG12  VAL  70          HG12      VAL  70   1.449 -18.540  -1.692
    6   HG11  VAL  70          HG13      VAL  70   1.168 -19.780  -2.915
    7   HG22  VAL  70          HG21      VAL  70  -0.565 -16.495  -3.847
    8   HG21  VAL  70          HG22      VAL  70   0.419 -17.734  -4.623
    9   HG23  VAL  70          HG23      VAL  70   1.056 -16.846  -3.241

  No H/Q in entry =           9
  In of MODEL   87
    1    H    SER  71           H        SER  71  -3.308 -18.312  -2.179
    2    HA   SER  71           HA       SER  71  -5.184 -17.707  -4.207
    3    HB2  SER  71           HB2      SER  71  -5.741 -17.909  -1.765
    4    HB3  SER  71           HB3      SER  71  -4.894 -16.391  -1.482
    5    HG   SER  71           HG       SER  71  -6.378 -15.561  -3.189

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LEU  72           H        LEU  72  -5.370 -16.032  -5.536
    2    HA   LEU  72           HA       LEU  72  -3.231 -14.254  -6.007
    3    HB2  LEU  72           HB2      LEU  72  -6.093 -14.258  -6.961
    4    HB3  LEU  72           HB3      LEU  72  -4.875 -13.121  -7.532
    5    HG   LEU  72           HG       LEU  72  -4.519 -16.133  -7.666
    6   HD12  LEU  72          HD11      LEU  72  -4.997 -15.753 -10.142
    7   HD11  LEU  72          HD12      LEU  72  -5.630 -14.172  -9.685
    8   HD13  LEU  72          HD13      LEU  72  -6.395 -15.637  -9.072
    9   HD22  LEU  72          HD21      LEU  72  -2.386 -15.182  -7.910
   10   HD21  LEU  72          HD22      LEU  72  -2.996 -13.743  -8.711
   11   HD23  LEU  72          HD23      LEU  72  -2.934 -15.274  -9.581

  No H/Q in entry =          11
  In of MODEL   87
    1    H    VAL  73           H        VAL  73  -6.323 -13.850  -4.385
    2    HA   VAL  73           HA       VAL  73  -6.324 -11.080  -4.028
    3    HB   VAL  73           HB       VAL  73  -8.046 -11.417  -2.441
    4   HG12  VAL  73          HG11      VAL  73  -8.126 -13.798  -4.313
    5   HG11  VAL  73          HG12      VAL  73  -8.505 -12.147  -4.799
    6   HG13  VAL  73          HG13      VAL  73  -9.508 -12.965  -3.601
    7   HG22  VAL  73          HG21      VAL  73  -7.246 -12.881  -0.820
    8   HG21  VAL  73          HG22      VAL  73  -6.650 -14.036  -2.012
    9   HG23  VAL  73          HG23      VAL  73  -8.378 -13.927  -1.677

  No H/Q in entry =           9
  In of MODEL   87
    1    H    LEU  74           H        LEU  74  -4.429 -13.483  -2.444
    2    HA   LEU  74           HA       LEU  74  -4.007 -12.355   0.082
    3    HB2  LEU  74           HB2      LEU  74  -3.257 -14.583  -0.416
    4    HB3  LEU  74           HB3      LEU  74  -2.194 -13.989  -1.690
    5    HG   LEU  74           HG       LEU  74  -0.864 -12.760  -0.009
    6   HD12  LEU  74          HD11      LEU  74  -1.363 -13.454   2.432
    7   HD11  LEU  74          HD12      LEU  74  -2.963 -13.905   1.840
    8   HD13  LEU  74          HD13      LEU  74  -2.414 -12.234   1.712
    9   HD21  LEU  74          HD21      LEU  74  -0.725 -15.339  -0.607
   10   HD23  LEU  74          HD22      LEU  74  -1.137 -15.488   1.087
   11   HD22  LEU  74          HD23      LEU  74   0.314 -14.628   0.625

  No H/Q in entry =          11
  In of MODEL   87
    1    H    VAL  75           H        VAL  75  -2.102 -11.985  -2.868
    2    HA   VAL  75           HA       VAL  75  -0.276 -10.092  -1.848
    3    HB   VAL  75           HB       VAL  75  -1.232 -10.551  -4.676
    4   HG11  VAL  75          HG11      VAL  75   1.068  -8.872  -3.580
    5   HG13  VAL  75          HG12      VAL  75  -0.329  -8.282  -4.468
    6   HG12  VAL  75          HG13      VAL  75   0.860  -9.290  -5.277
    7   HG22  VAL  75          HG21      VAL  75  -0.083 -12.468  -3.697
    8   HG21  VAL  75          HG22      VAL  75   1.205 -11.428  -3.087
    9   HG23  VAL  75          HG23      VAL  75   1.017 -11.672  -4.825

  No H/Q in entry =           9
  In of MODEL   87
    1    H    GLU  76           H        GLU  76  -3.416  -9.690  -3.514
    2    HA   GLU  76           HA       GLU  76  -3.422  -6.875  -3.608
    3    HB2  GLU  76           HB2      GLU  76  -5.097  -8.342  -4.759
    4    HB3  GLU  76           HB3      GLU  76  -5.793  -8.732  -3.194
    5    HG2  GLU  76           HG2      GLU  76  -6.392  -6.376  -2.839
    6    HG3  GLU  76           HG3      GLU  76  -5.668  -5.928  -4.371

  No H/Q in entry =           6
  In of MODEL   87
    1    H    ALA  77           H        ALA  77  -4.575  -9.091  -1.077
    2    HA   ALA  77           HA       ALA  77  -5.504  -7.078   0.684
    3    HB3  ALA  77           HB1      ALA  77  -6.168  -9.389   0.996
    4    HB2  ALA  77           HB2      ALA  77  -5.308  -8.846   2.435
    5    HB1  ALA  77           HB3      ALA  77  -4.493  -9.875   1.259

  No H/Q in entry =           5
  In of MODEL   87
    1    H    GLN  78           H        GLN  78  -2.382  -8.678   0.324
    2    HA   GLN  78           HA       GLN  78  -1.111  -7.544   2.581
    3    HB2  GLN  78           HB2      GLN  78  -0.308  -9.497   1.158
    4    HB3  GLN  78           HB3      GLN  78   0.230  -8.305  -0.023
    5    HG2  GLN  78           HG2      GLN  78   1.716  -7.290   1.599
    6    HG3  GLN  78           HG3      GLN  78   1.099  -8.331   2.878
    7   HE21  GLN  78          HE21      GLN  78   2.314  -8.899  -0.489
    8   HE22  GLN  78          HE22      GLN  78   3.355 -10.164  -0.041

  No H/Q in entry =           8
  In of MODEL   87
    1    H    LEU  79           H        LEU  79  -1.451  -6.469  -0.764
    2    HA   LEU  79           HA       LEU  79   0.273  -4.271  -0.741
    3    HB2  LEU  79           HB2      LEU  79  -0.761  -5.055  -2.799
    4    HB3  LEU  79           HB3      LEU  79  -2.360  -4.637  -2.194
    5    HG   LEU  79           HG       LEU  79  -1.775  -2.260  -2.161
    6   HD13  LEU  79          HD11      LEU  79   0.467  -2.056  -1.642
    7   HD12  LEU  79          HD12      LEU  79   0.526  -1.765  -3.380
    8   HD11  LEU  79          HD13      LEU  79   0.952  -3.352  -2.736
    9   HD23  LEU  79          HD21      LEU  79  -1.130  -2.066  -4.711
   10   HD22  LEU  79          HD22      LEU  79  -2.671  -2.788  -4.258
   11   HD21  LEU  79          HD23      LEU  79  -1.314  -3.820  -4.701

  No H/Q in entry =          11
  In of MODEL   87
    1    H    HIS  80           H        HIS  80  -3.198  -4.375   0.076
    2    HA   HIS  80           HA       HIS  80  -3.343  -1.618   0.746
    3    HB2  HIS  80           HB2      HIS  80  -5.087  -3.997   1.054
    4    HB3  HIS  80           HB3      HIS  80  -5.388  -2.655   2.160
    5    HD1  HIS  80           HD1      HIS  80  -6.974  -0.987   1.252
    6    HD2  HIS  80           HD2      HIS  80  -4.805  -2.830  -1.794
    7    HE1  HIS  80           HE1      HIS  80  -7.790   0.029  -0.927
    8    HE2  HIS  80           HE2      HIS  80  -6.474  -1.088  -2.793

  No H/Q in entry =           8
  In of MODEL   87
    1    H    LEU  81           H        LEU  81  -2.911  -4.526   2.733
    2    HA   LEU  81           HA       LEU  81  -2.882  -3.185   5.220
    3    HB2  LEU  81           HB2      LEU  81  -1.707  -5.821   4.337
    4    HB3  LEU  81           HB3      LEU  81  -1.676  -5.266   6.013
    5    HG   LEU  81           HG       LEU  81  -4.221  -5.470   4.377
    6   HD12  LEU  81          HD11      LEU  81  -4.565  -7.533   5.919
    7   HD11  LEU  81          HD12      LEU  81  -2.812  -7.494   6.110
    8   HD13  LEU  81          HD13      LEU  81  -3.521  -7.708   4.508
    9   HD23  LEU  81          HD21      LEU  81  -5.075  -5.664   6.875
   10   HD22  LEU  81          HD22      LEU  81  -4.720  -4.079   6.190
   11   HD21  LEU  81          HD23      LEU  81  -3.550  -4.863   7.252

  No H/Q in entry =          11
  In of MODEL   87
    1    H    MET  82           H        MET  82  -0.211  -4.131   3.055
    2    HA   MET  82           HA       MET  82   1.883  -3.279   4.746
    3    HB2  MET  82           HB2      MET  82   1.670  -3.609   1.753
    4    HB3  MET  82           HB3      MET  82   3.160  -3.067   2.521
    5    HG2  MET  82           HG2      MET  82   1.704  -5.632   3.235
    6    HG3  MET  82           HG3      MET  82   3.081  -5.545   2.139
    7    HE3  MET  82           HE1      MET  82   6.104  -4.869   4.133
    8    HE2  MET  82           HE2      MET  82   5.207  -3.483   3.516
    9    HE1  MET  82           HE3      MET  82   5.271  -4.972   2.577

  No H/Q in entry =           9
  In of MODEL   87
    1    H    THR  83           H        THR  83   0.098  -1.598   2.189
    2    HA   THR  83           HA       THR  83   1.554   0.824   2.285
    3    HB   THR  83           HB       THR  83  -0.602   1.791   1.295
    4    HG1  THR  83           HG1      THR  83  -2.275   0.525   1.181
    5   HG22  THR  83          HG21      THR  83  -0.360  -0.026  -0.709
    6   HG21  THR  83          HG22      THR  83   1.133  -0.348   0.171
    7   HG23  THR  83          HG23      THR  83   0.803   1.273  -0.441

  No H/Q in entry =           7
  In of MODEL   87
    1    H    SER  84           H        SER  84  -1.474  -0.156   3.876
    2    HA   SER  84           HA       SER  84  -1.929   2.279   5.225
    3    HB2  SER  84           HB2      SER  84  -2.816  -0.544   5.780
    4    HB3  SER  84           HB3      SER  84  -3.287   0.803   6.815
    5    HG   SER  84           HG       SER  84  -3.744   0.505   4.021

  No H/Q in entry =           5
  In of MODEL   87
    1    H    MET  85           H        MET  85  -0.277  -0.687   6.352
    2    HA   MET  85           HA       MET  85   0.253   0.224   8.960
    3    HB2  MET  85           HB2      MET  85   0.503  -2.123   8.273
    4    HB3  MET  85           HB3      MET  85   1.899  -1.682   7.289
    5    HG2  MET  85           HG2      MET  85   3.072  -0.871   9.303
    6    HG3  MET  85           HG3      MET  85   1.672  -1.290  10.289
    7    HE1  MET  85           HE1      MET  85   0.623  -3.514  10.420
    8    HE3  MET  85           HE2      MET  85   1.819  -3.484  11.714
    9    HE2  MET  85           HE3      MET  85   1.622  -4.937  10.739

  No H/Q in entry =           9
  In of MODEL   87
    1    H    LEU  86           H        LEU  86   2.200   0.450   6.014
    2    HA   LEU  86           HA       LEU  86   4.435   1.716   7.178
    3    HB2  LEU  86           HB2      LEU  86   4.229   0.642   4.867
    4    HB3  LEU  86           HB3      LEU  86   3.451   2.140   4.355
    5    HG   LEU  86           HG       LEU  86   5.500   3.345   5.344
    6   HD11  LEU  86          HD11      LEU  86   6.153   0.719   6.139
    7   HD13  LEU  86          HD12      LEU  86   7.184   2.144   6.243
    8   HD12  LEU  86          HD13      LEU  86   7.277   1.097   4.829
    9   HD23  LEU  86          HD21      LEU  86   6.189   1.574   2.991
   10   HD22  LEU  86          HD22      LEU  86   6.614   3.263   3.258
   11   HD21  LEU  86          HD23      LEU  86   4.954   2.828   2.854

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ALA  87           H        ALA  87   1.551   3.018   5.589
    2    HA   ALA  87           HA       ALA  87   2.197   5.736   5.680
    3    HB1  ALA  87           HB1      ALA  87  -0.141   4.154   5.130
    4    HB3  ALA  87           HB2      ALA  87   0.202   5.809   4.634
    5    HB2  ALA  87           HB3      ALA  87  -0.601   5.500   6.175

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ARG  88           H        ARG  88   0.463   3.762   8.062
    2    HA   ARG  88           HA       ARG  88  -0.014   5.816   9.912
    3    HB2  ARG  88           HB2      ARG  88  -0.997   3.482   9.971
    4    HB3  ARG  88           HB3      ARG  88   0.532   2.951  10.680
    5    HG2  ARG  88           HG2      ARG  88   0.091   5.031  12.303
    6    HG3  ARG  88           HG3      ARG  88  -1.580   4.739  11.842
    7    HD2  ARG  88           HD2      ARG  88  -1.726   2.889  13.084
    8    HD3  ARG  88           HD3      ARG  88  -0.147   2.278  12.556
    9    HE   ARG  88           HE       ARG  88  -0.663   3.546  15.011
   10   HH21  ARG  88          HH11      ARG  88   0.911   4.526  16.256
   11   HH22  ARG  88          HH12      ARG  88   2.440   4.925  15.556
   12   HH11  ARG  88          HH21      ARG  88   1.628   3.690  12.440
   13   HH12  ARG  88          HH22      ARG  88   2.854   4.436  13.408

  No H/Q in entry =          13
  In of MODEL   87
    1    H    GLU  89           H        GLU  89   2.741   3.546   9.691
    2    HA   GLU  89           HA       GLU  89   4.013   4.406  12.040
    3    HB2  GLU  89           HB2      GLU  89   4.637   2.378  10.694
    4    HB3  GLU  89           HB3      GLU  89   5.436   3.460   9.551
    5    HG2  GLU  89           HG2      GLU  89   6.932   4.275  11.301
    6    HG3  GLU  89           HG3      GLU  89   6.076   3.332  12.517

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LEU  90           H        LEU  90   4.360   5.564   8.716
    2    HA   LEU  90           HA       LEU  90   6.325   7.527   9.310
    3    HB2  LEU  90           HB2      LEU  90   4.319   7.237   7.077
    4    HB3  LEU  90           HB3      LEU  90   5.573   8.485   7.104
    5    HG   LEU  90           HG       LEU  90   6.192   5.536   7.433
    6   HD12  LEU  90          HD11      LEU  90   6.951   5.761   4.996
    7   HD11  LEU  90          HD12      LEU  90   5.962   7.220   4.948
    8   HD13  LEU  90          HD13      LEU  90   5.213   5.660   5.286
    9   HD22  LEU  90          HD21      LEU  90   8.108   6.649   8.123
   10   HD21  LEU  90          HD22      LEU  90   7.786   8.062   7.118
   11   HD23  LEU  90          HD23      LEU  90   8.421   6.587   6.389

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  91           H        ILE  91   2.788   7.608   9.152
    2    HA   ILE  91           HA       ILE  91   2.494  10.385   9.607
    3    HB   ILE  91           HB       ILE  91   0.659   8.041  10.140
    4   HG12  ILE  91          HG12      ILE  91   0.457  10.330   8.160
    5   HG13  ILE  91          HG13      ILE  91   1.291   8.822   7.787
    6   HG22  ILE  91          HG21      ILE  91  -1.036  10.130  10.204
    7   HG21  ILE  91          HG22      ILE  91   0.378  10.934  10.882
    8   HG23  ILE  91          HG23      ILE  91  -0.286   9.506  11.674
    9   HD13  ILE  91          HD11      ILE  91  -0.676   7.569   7.823
   10   HD12  ILE  91          HD12      ILE  91  -1.236   9.096   7.143
   11   HD11  ILE  91          HD13      ILE  91  -1.518   8.733   8.846

  No H/Q in entry =          11
  In of MODEL   87
    1    H    THR  92           H        THR  92   2.843   7.633  11.804
    2    HA   THR  92           HA       THR  92   2.417   9.009  14.230
    3    HB   THR  92           HB       THR  92   4.186   6.644  13.565
    4    HG1  THR  92           HG1      THR  92   2.204   5.922  13.458
    5   HG22  THR  92          HG21      THR  92   3.790   6.362  16.197
    6   HG21  THR  92          HG22      THR  92   3.757   8.122  16.127
    7   HG23  THR  92          HG23      THR  92   5.176   7.243  15.557

  No H/Q in entry =           7
  In of MODEL   87
    1    H    GLU  93           H        GLU  93   5.365   8.513  12.303
    2    HA   GLU  93           HA       GLU  93   7.138   9.906  14.008
    3    HB2  GLU  93           HB2      GLU  93   7.230   9.595  10.992
    4    HB3  GLU  93           HB3      GLU  93   8.577  10.100  12.012
    5    HG2  GLU  93           HG2      GLU  93   7.121   7.488  12.450
    6    HG3  GLU  93           HG3      GLU  93   8.510   7.618  11.378

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LEU  94           H        LEU  94   5.115  10.961  11.291
    2    HA   LEU  94           HA       LEU  94   5.966  13.651  11.198
    3    HB2  LEU  94           HB2      LEU  94   3.355  12.331  10.434
    4    HB3  LEU  94           HB3      LEU  94   3.644  14.054  10.197
    5    HG   LEU  94           HG       LEU  94   5.630  12.034   9.149
    6   HD11  LEU  94          HD11      LEU  94   2.901  12.632   8.079
    7   HD13  LEU  94          HD12      LEU  94   3.860  11.160   7.954
    8   HD12  LEU  94          HD13      LEU  94   4.221  12.536   6.913
    9   HD23  LEU  94          HD21      LEU  94   5.916  13.869   7.430
   10   HD22  LEU  94          HD22      LEU  94   6.334  14.352   9.074
   11   HD21  LEU  94          HD23      LEU  94   4.793  14.847   8.372

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  95           H        ILE  95   3.396  12.073  13.079
    2    HA   ILE  95           HA       ILE  95   2.389  14.438  14.275
    3    HB   ILE  95           HB       ILE  95   2.356  11.554  15.195
    4   HG12  ILE  95          HG12      ILE  95   0.168  13.366  14.142
    5   HG13  ILE  95          HG13      ILE  95   1.110  12.293  13.111
    6   HG21  ILE  95          HG21      ILE  95   1.111  14.045  16.397
    7   HG23  ILE  95          HG22      ILE  95   2.137  12.858  17.202
    8   HG22  ILE  95          HG23      ILE  95   0.496  12.425  16.722
    9   HD13  ILE  95          HD11      ILE  95   0.173  10.368  14.024
   10   HD12  ILE  95          HD12      ILE  95  -1.192  11.479  14.098
   11   HD11  ILE  95          HD13      ILE  95  -0.236  11.163  15.545

  No H/Q in entry =          11
  In of MODEL   87
    1    H    GLU  96           H        GLU  96   4.945  12.175  15.274
    2    HA   GLU  96           HA       GLU  96   5.511  13.361  17.770
    3    HB2  GLU  96           HB2      GLU  96   6.427  11.188  17.122
    4    HB3  GLU  96           HB3      GLU  96   7.376  11.949  15.846
    5    HG2  GLU  96           HG2      GLU  96   9.029  12.468  17.314
    6    HG3  GLU  96           HG3      GLU  96   7.892  13.298  18.367

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LEU  97           H        LEU  97   6.608  14.121  14.489
    2    HA   LEU  97           HA       LEU  97   8.523  16.086  15.210
    3    HB2  LEU  97           HB2      LEU  97   6.931  15.566  12.709
    4    HB3  LEU  97           HB3      LEU  97   7.972  16.981  12.836
    5    HG   LEU  97           HG       LEU  97   8.956  14.167  13.394
    6   HD12  LEU  97          HD11      LEU  97   9.962  14.349  11.081
    7   HD11  LEU  97          HD12      LEU  97   8.934  15.756  10.816
    8   HD13  LEU  97          HD13      LEU  97   8.209  14.175  11.106
    9   HD23  LEU  97          HD21      LEU  97  11.147  15.414  12.660
   10   HD22  LEU  97          HD22      LEU  97  10.527  15.690  14.288
   11   HD21  LEU  97          HD23      LEU  97  10.235  16.880  13.021

  No H/Q in entry =          11
  In of MODEL   87
    1    H    HIS  98           H        HIS  98   5.036  16.277  14.545
    2    HA   HIS  98           HA       HIS  98   4.779  19.080  14.683
    3    HB2  HIS  98           HB2      HIS  98   2.853  16.858  15.400
    4    HB3  HIS  98           HB3      HIS  98   2.412  18.565  15.457
    5    HD1  HIS  98           HD1      HIS  98   3.399  15.839  13.051
    6    HD2  HIS  98           HD2      HIS  98   2.083  19.793  12.931
    7    HE1  HIS  98           HE1      HIS  98   2.855  16.340  10.626
    8    HE2  HIS  98           HE2      HIS  98   2.057  18.742  10.532

  No H/Q in entry =           8
  In of MODEL   87
    1    H    GLU  99           H        GLU  99   4.866  16.586  17.179
    2    HA   GLU  99           HA       GLU  99   4.277  18.286  19.377
    3    HB2  GLU  99           HB2      GLU  99   4.151  15.805  19.470
    4    HB3  GLU  99           HB3      GLU  99   5.910  15.734  19.367
    5    HG2  GLU  99           HG2      GLU  99   6.112  17.020  21.444
    6    HG3  GLU  99           HG3      GLU  99   4.361  17.187  21.535

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LYS 100           H        LYS 100   7.322  17.312  17.821
    2    HA   LYS 100           HA       LYS 100   8.992  18.684  19.685
    3    HB2  LYS 100           HB2      LYS 100   9.485  17.757  16.846
    4    HB3  LYS 100           HB3      LYS 100  10.723  18.506  17.859
    5    HG2  LYS 100           HG2      LYS 100  10.315  16.758  19.596
    6    HG3  LYS 100           HG3      LYS 100   9.175  15.974  18.500
    7    HD2  LYS 100           HD2      LYS 100  10.969  15.666  16.838
    8    HD3  LYS 100           HD3      LYS 100  12.115  16.463  17.920
    9    HE2  LYS 100           HE2      LYS 100  11.687  14.711  19.633
   10    HE3  LYS 100           HE3      LYS 100  10.603  13.894  18.503
   11    HZ1  LYS 100           HZ1      LYS 100  13.435  14.521  17.858
   12    HZ3  LYS 100           HZ2      LYS 100  12.378  13.483  17.025
   13    HZ2  LYS 100           HZ3      LYS 100  12.955  13.053  18.564

  No H/Q in entry =          13
  In of MODEL   87
    1    H    LEU 101           H        LEU 101   7.322  19.641  16.726
    2    HA   LEU 101           HA       LEU 101   8.576  22.180  16.399
    3    HB2  LEU 101           HB2      LEU 101   5.965  20.988  15.502
    4    HB3  LEU 101           HB3      LEU 101   6.243  22.715  15.298
    5    HG   LEU 101           HG       LEU 101   8.251  20.669  14.335
    6   HD12  LEU 101          HD11      LEU 101   7.112  21.197  12.048
    7   HD11  LEU 101          HD12      LEU 101   5.717  21.647  13.025
    8   HD13  LEU 101          HD13      LEU 101   6.356  20.006  13.106
    9   HD21  LEU 101          HD21      LEU 101   7.669  23.592  13.783
   10   HD23  LEU 101          HD22      LEU 101   8.638  22.619  12.678
   11   HD22  LEU 101          HD23      LEU 101   9.179  22.865  14.338

  No H/Q in entry =          11
  In of MODEL   87
    1    H    LYS 102           H        LYS 102   7.013  21.061  19.008
    2    HA   LYS 102           HA       LYS 102   6.392  22.159  20.940
    3    HB2  LYS 102           HB2      LYS 102   7.708  24.131  19.823
    4    HB3  LYS 102           HB3      LYS 102   6.120  24.761  19.443
    5    HG2  LYS 102           HG2      LYS 102   7.485  24.480  22.099
    6    HG3  LYS 102           HG3      LYS 102   6.555  25.824  21.470
    7    HD2  LYS 102           HD2      LYS 102   5.268  23.206  22.340
    8    HD3  LYS 102           HD3      LYS 102   5.534  24.561  23.427
    9    HE2  LYS 102           HE2      LYS 102   3.253  24.196  21.930
   10    HE3  LYS 102           HE3      LYS 102   3.778  25.733  22.616
   11    HZ2  LYS 102           HZ1      LYS 102   3.257  25.853  20.235
   12    HZ1  LYS 102           HZ2      LYS 102   4.502  24.752  19.914
   13    HZ3  LYS 102           HZ3      LYS 102   4.867  26.276  20.561

  No H/Q in entry =          13
  In of MODEL   87
    1    H    ALA 103           H        ALA 103   4.787  23.732  18.170
    2    HA   ALA 103           HA       ALA 103   2.339  24.345  19.049
    3    HB1  ALA 103           HB1      ALA 103   1.434  23.522  16.802
    4    HB2  ALA 103           HB2      ALA 103   3.074  22.960  16.477
    5    HB3  ALA 103           HB3      ALA 103   2.765  24.676  16.745

  No H/Q in entry =           5
  In of MODEL   87
    1    H1   ALA   1           H3       ALA   1  10.317 -20.238  -6.281
    2    H2   ALA   1           H2       ALA   1   9.354 -20.426  -7.671
    3    H3   ALA   1           H1       ALA   1   8.900 -21.168  -6.210
    4    HA   ALA   1           HA       ALA   1   9.913 -22.992  -6.950
    5    HB1  ALA   1           HB1      ALA   1  10.021 -22.630  -9.225
    6    HB2  ALA   1           HB2      ALA   1  11.749 -22.509  -8.890
    7    HB3  ALA   1           HB3      ALA   1  10.775 -21.045  -9.041

  No H/Q in entry =           7
  In of MODEL   87
    1    H    GLU   2           H        GLU   2  12.181 -23.980  -7.003
    2    HA   GLU   2           HA       GLU   2  13.557 -23.925  -4.787
    3    HB2  GLU   2           HB2      GLU   2  14.923 -23.810  -7.482
    4    HB3  GLU   2           HB3      GLU   2  15.637 -24.436  -5.997
    5    HG2  GLU   2           HG2      GLU   2  14.588 -26.436  -6.244
    6    HG3  GLU   2           HG3      GLU   2  13.030 -25.664  -6.506

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLU   3           H        GLU   3  15.365 -22.085  -7.180
    2    HA   GLU   3           HA       GLU   3  16.541 -20.421  -5.214
    3    HB2  GLU   3           HB2      GLU   3  16.493 -20.412  -8.224
    4    HB3  GLU   3           HB3      GLU   3  17.258 -19.097  -7.333
    5    HG2  GLU   3           HG2      GLU   3  18.895 -20.500  -6.408
    6    HG3  GLU   3           HG3      GLU   3  17.926 -21.951  -6.634

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LEU   4           H        LEU   4  14.280 -19.530  -7.850
    2    HA   LEU   4           HA       LEU   4  13.855 -16.915  -7.234
    3    HB2  LEU   4           HB2      LEU   4  11.650 -18.852  -7.974
    4    HB3  LEU   4           HB3      LEU   4  11.604 -17.102  -8.170
    5    HG   LEU   4           HG       LEU   4  13.541 -18.995  -9.541
    6   HD13  LEU   4          HD11      LEU   4  12.247 -18.821 -11.454
    7   HD12  LEU   4          HD12      LEU   4  11.564 -17.265 -10.986
    8   HD11  LEU   4          HD13      LEU   4  10.984 -18.748 -10.229
    9   HD23  LEU   4          HD21      LEU   4  13.919 -16.753 -10.887
   10   HD22  LEU   4          HD22      LEU   4  14.770 -17.013  -9.366
   11   HD21  LEU   4          HD23      LEU   4  13.334 -15.992  -9.407

  No H/Q in entry =          11
  In of MODEL   87
    1    H    GLU   5           H        GLU   5  12.320 -19.677  -5.602
    2    HA   GLU   5           HA       GLU   5  10.664 -18.082  -3.900
    3    HB2  GLU   5           HB2      GLU   5  11.452 -20.944  -4.060
    4    HB3  GLU   5           HB3      GLU   5  10.787 -20.351  -2.536
    5    HG2  GLU   5           HG2      GLU   5   9.380 -19.546  -5.035
    6    HG3  GLU   5           HG3      GLU   5   9.217 -21.226  -4.524

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLU   6           H        GLU   6  13.783 -19.714  -3.452
    2    HA   GLU   6           HA       GLU   6  14.142 -18.869  -0.751
    3    HB2  GLU   6           HB2      GLU   6  16.098 -19.826  -2.853
    4    HB3  GLU   6           HB3      GLU   6  16.538 -19.507  -1.174
    5    HG2  GLU   6           HG2      GLU   6  14.369 -21.441  -2.037
    6    HG3  GLU   6           HG3      GLU   6  16.012 -21.915  -1.604

  No H/Q in entry =           6
  In of MODEL   87
    1    H    VAL   7           H        VAL   7  14.938 -17.549  -3.896
    2    HA   VAL   7           HA       VAL   7  16.656 -15.451  -3.023
    3    HB   VAL   7           HB       VAL   7  14.951 -15.782  -5.506
    4   HG11  VAL   7          HG11      VAL   7  16.878 -13.602  -4.684
    5   HG13  VAL   7          HG12      VAL   7  15.240 -13.432  -5.312
    6   HG12  VAL   7          HG13      VAL   7  16.544 -13.953  -6.379
    7   HG21  VAL   7          HG21      VAL   7  17.033 -17.274  -4.934
    8   HG23  VAL   7          HG22      VAL   7  17.963 -15.827  -5.327
    9   HG22  VAL   7          HG23      VAL   7  16.917 -16.558  -6.543

  No H/Q in entry =           9
  In of MODEL   87
    1    H    VAL   8           H        VAL   8  13.161 -15.664  -3.590
    2    HA   VAL   8           HA       VAL   8  12.538 -12.946  -3.115
    3    HB   VAL   8           HB       VAL   8  10.887 -15.451  -2.694
    4   HG13  VAL   8          HG11      VAL   8   9.927 -13.738  -1.310
    5   HG12  VAL   8          HG12      VAL   8   8.955 -13.792  -2.782
    6   HG11  VAL   8          HG13      VAL   8  10.151 -12.515  -2.561
    7   HG23  VAL   8          HG21      VAL   8  10.246 -13.524  -4.866
    8   HG22  VAL   8          HG22      VAL   8  10.299 -15.284  -4.905
    9   HG21  VAL   8          HG23      VAL   8  11.787 -14.357  -5.061

  No H/Q in entry =           9
  In of MODEL   87
    1    H    MET   9           H        MET   9  12.754 -15.760  -0.939
    2    HA   MET   9           HA       MET   9  11.953 -14.480   1.431
    3    HB2  MET   9           HB2      MET   9  13.826 -16.783   0.892
    4    HB3  MET   9           HB3      MET   9  13.527 -16.201   2.531
    5    HG2  MET   9           HG2      MET   9  11.093 -16.539   2.192
    6    HG3  MET   9           HG3      MET   9  11.421 -17.169   0.576
    7    HE2  MET   9           HE1      MET   9  10.969 -18.360   4.352
    8    HE1  MET   9           HE2      MET   9  12.291 -17.214   4.148
    9    HE3  MET   9           HE3      MET   9  12.639 -18.877   4.616

  No H/Q in entry =           9
  In of MODEL   87
    1    H    GLY  10           H        GLY  10  15.134 -14.751  -0.117
    2    HA3  GLY  10           HA2      GLY  10  16.609 -13.357   1.859
    3    HA2  GLY  10           HA3      GLY  10  17.074 -13.526   0.167

  No H/Q in entry =           3
  In of MODEL   87
    1    H    LEU  11           H        LEU  11  14.929 -12.269  -1.076
    2    HA   LEU  11           HA       LEU  11  15.654  -9.535  -0.905
    3    HB2  LEU  11           HB2      LEU  11  13.269 -10.907  -2.150
    4    HB3  LEU  11           HB3      LEU  11  13.576  -9.176  -2.305
    5    HG   LEU  11           HG       LEU  11  15.574 -11.314  -3.092
    6   HD13  LEU  11          HD11      LEU  11  13.827 -11.652  -4.617
    7   HD12  LEU  11          HD12      LEU  11  14.850 -10.484  -5.452
    8   HD11  LEU  11          HD13      LEU  11  13.382  -9.945  -4.637
    9   HD22  LEU  11          HD21      LEU  11  16.834  -9.369  -2.859
   10   HD21  LEU  11          HD22      LEU  11  15.476  -8.312  -3.239
   11   HD23  LEU  11          HD23      LEU  11  16.297  -9.190  -4.527

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  12           H        ILE  12  12.855 -11.322   0.351
    2    HA   ILE  12           HA       ILE  12  11.492  -9.080   1.411
    3    HB   ILE  12           HB       ILE  12  11.486 -11.974   2.325
    4   HG12  ILE  12          HG12      ILE  12  10.770 -11.301  -0.093
    5   HG13  ILE  12          HG13      ILE  12   9.709 -12.349   0.826
    6   HG21  ILE  12          HG21      ILE  12   9.627  -9.667   2.984
    7   HG23  ILE  12          HG22      ILE  12  10.595 -10.612   4.114
    8   HG22  ILE  12          HG23      ILE  12   9.230 -11.358   3.286
    9   HD12  ILE  12          HD11      ILE  12   8.524 -10.503  -0.371
   10   HD11  ILE  12          HD12      ILE  12   9.418  -9.343   0.610
   11   HD13  ILE  12          HD13      ILE  12   8.293 -10.448   1.368

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  13           H        ILE  13  13.849 -11.322   2.819
    2    HA   ILE  13           HA       ILE  13  13.894 -10.148   5.402
    3    HB   ILE  13           HB       ILE  13  15.934 -11.748   3.837
    4   HG12  ILE  13          HG12      ILE  13  13.637 -12.673   4.689
    5   HG13  ILE  13          HG13      ILE  13  15.097 -13.627   4.931
    6   HG21  ILE  13          HG21      ILE  13  16.091 -10.577   6.604
    7   HG23  ILE  13          HG22      ILE  13  17.342 -10.664   5.372
    8   HG22  ILE  13          HG23      ILE  13  16.885 -12.113   6.266
    9   HD13  ILE  13          HD11      ILE  13  15.256 -12.924   7.249
   10   HD12  ILE  13          HD12      ILE  13  13.599 -13.446   6.963
   11   HD11  ILE  13          HD13      ILE  13  13.981 -11.730   7.016

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ASN  14           H        ASN  14  15.863  -9.638   2.490
    2    HA   ASN  14           HA       ASN  14  17.630  -7.722   3.560
    3    HB2  ASN  14           HB2      ASN  14  17.597  -8.984   1.242
    4    HB3  ASN  14           HB3      ASN  14  16.725  -7.554   0.705
    5   HD21  ASN  14          HD21      ASN  14  19.164  -7.923  -0.474
    6   HD22  ASN  14          HD22      ASN  14  20.319  -6.856   0.159

  No H/Q in entry =           6
  In of MODEL   87
    1    H    SER  15           H        SER  15  14.529  -7.331   1.859
    2    HA   SER  15           HA       SER  15  14.453  -4.510   1.921
    3    HB2  SER  15           HB2      SER  15  12.120  -4.725   1.417
    4    HB3  SER  15           HB3      SER  15  12.901  -6.101   0.647
    5    HG   SER  15           HG       SER  15  12.084  -7.425   2.127

  No H/Q in entry =           5
  In of MODEL   87
    1    H    GLY  16           H        GLY  16  13.321  -6.960   4.217
    2    HA3  GLY  16           HA2      GLY  16  12.116  -5.200   6.074
    3    HA2  GLY  16           HA3      GLY  16  12.710  -6.816   6.434

  No H/Q in entry =           3
  In of MODEL   87
    1    H    GLN  17           H        GLN  17  15.427  -6.516   5.851
    2    HA   GLN  17           HA       GLN  17  16.391  -5.311   8.237
    3    HB2  GLN  17           HB2      GLN  17  17.627  -7.104   7.099
    4    HB3  GLN  17           HB3      GLN  17  17.892  -6.054   5.706
    5    HG2  GLN  17           HG2      GLN  17  19.177  -4.496   7.084
    6    HG3  GLN  17           HG3      GLN  17  18.857  -5.468   8.520
    7   HE21  GLN  17          HE21      GLN  17  21.536  -4.973   7.678
    8   HE22  GLN  17          HE22      GLN  17  22.209  -6.433   7.132

  No H/Q in entry =           8
  In of MODEL   87
    1    H    ALA  18           H        ALA  18  16.226  -4.225   4.878
    2    HA   ALA  18           HA       ALA  18  17.690  -1.850   5.114
    3    HB1  ALA  18           HB1      ALA  18  16.564  -3.047   3.041
    4    HB3  ALA  18           HB2      ALA  18  16.850  -1.307   3.029
    5    HB2  ALA  18           HB3      ALA  18  15.242  -1.934   3.393

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ARG  19           H        ARG  19  14.182  -2.396   5.499
    2    HA   ARG  19           HA       ARG  19  13.544   0.260   6.217
    3    HB2  ARG  19           HB2      ARG  19  11.844  -1.470   5.621
    4    HB3  ARG  19           HB3      ARG  19  12.171  -2.275   7.158
    5    HG2  ARG  19           HG2      ARG  19  11.480  -0.278   8.399
    6    HG3  ARG  19           HG3      ARG  19  11.246   0.604   6.891
    7    HD2  ARG  19           HD2      ARG  19   9.092  -0.168   7.703
    8    HD3  ARG  19           HD3      ARG  19   9.505  -1.050   6.226
    9    HE   ARG  19           HE       ARG  19  10.439  -2.607   8.332
   10   HH21  ARG  19          HH11      ARG  19   9.167  -4.234   9.263
   11   HH22  ARG  19          HH12      ARG  19   7.448  -4.186   9.087
   12   HH11  ARG  19          HH21      ARG  19   7.464  -1.277   7.229
   13   HH12  ARG  19          HH22      ARG  19   6.484  -2.512   7.931

  No H/Q in entry =          13
  In of MODEL   87
    1    H    SER  20           H        SER  20  14.361  -2.584   8.173
    2    HA   SER  20           HA       SER  20  14.083  -1.486  10.712
    3    HB2  SER  20           HB2      SER  20  14.522  -3.813  10.596
    4    HB3  SER  20           HB3      SER  20  15.972  -3.572   9.626
    5    HG   SER  20           HG       SER  20  15.720  -2.480  12.217

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LEU  21           H        LEU  21  16.934  -1.454   8.585
    2    HA   LEU  21           HA       LEU  21  18.620   0.009  10.332
    3    HB2  LEU  21           HB2      LEU  21  18.606  -0.254   7.317
    4    HB3  LEU  21           HB3      LEU  21  19.869   0.584   8.214
    5    HG   LEU  21           HG       LEU  21  19.086  -2.299   8.734
    6   HD12  LEU  21          HD11      LEU  21  21.498  -1.313   7.193
    7   HD11  LEU  21          HD12      LEU  21  20.010  -1.841   6.409
    8   HD13  LEU  21          HD13      LEU  21  20.944  -2.977   7.380
    9   HD22  LEU  21          HD21      LEU  21  20.243  -1.617  10.648
   10   HD21  LEU  21          HD22      LEU  21  21.223  -0.442   9.778
   11   HD23  LEU  21          HD23      LEU  21  21.587  -2.155   9.646

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ALA  22           H        ALA  22  16.376   1.009   7.770
    2    HA   ALA  22           HA       ALA  22  16.948   3.761   7.791
    3    HB3  ALA  22           HB1      ALA  22  15.536   2.539   6.106
    4    HB2  ALA  22           HB2      ALA  22  14.846   4.059   6.673
    5    HB1  ALA  22           HB3      ALA  22  14.235   2.525   7.295

  No H/Q in entry =           5
  In of MODEL   87
    1    H    TYR  23           H        TYR  23  14.423   1.972   9.614
    2    HA   TYR  23           HA       TYR  23  13.483   4.218  11.065
    3    HB2  TYR  23           HB2      TYR  23  12.221   2.119  11.036
    4    HB3  TYR  23           HB3      TYR  23  13.540   1.290  11.862
    5    HD1  TYR  23           HD1      TYR  23  11.073   4.067  12.226
    6    HD2  TYR  23           HD2      TYR  23  13.728   1.341  14.219
    7    HE1  TYR  23           HE1      TYR  23  10.147   4.767  14.419
    8    HE2  TYR  23           HE2      TYR  23  12.801   2.040  16.410
    9    HH   TYR  23           HH       TYR  23   9.952   3.955  16.674

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ALA  24           H        ALA  24  16.098   1.908  11.706
    2    HA   ALA  24           HA       ALA  24  16.772   2.891  14.274
    3    HB1  ALA  24           HB1      ALA  24  18.106   1.081  14.110
    4    HB3  ALA  24           HB2      ALA  24  19.149   1.992  13.016
    5    HB2  ALA  24           HB3      ALA  24  17.844   1.001  12.369

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ALA  25           H        ALA  25  17.751   3.814  11.000
    2    HA   ALA  25           HA       ALA  25  19.718   5.723  11.656
    3    HB1  ALA  25           HB1      ALA  25  18.998   4.788   9.336
    4    HB3  ALA  25           HB2      ALA  25  19.520   6.469   9.435
    5    HB2  ALA  25           HB3      ALA  25  17.801   6.084   9.359

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LEU  26           H        LEU  26  16.208   5.997  11.283
    2    HA   LEU  26           HA       LEU  26  16.018   8.780  11.739
    3    HB2  LEU  26           HB2      LEU  26  14.144   7.570  10.802
    4    HB3  LEU  26           HB3      LEU  26  14.035   6.541  12.225
    5    HG   LEU  26           HG       LEU  26  13.449   8.504  13.607
    6   HD12  LEU  26          HD11      LEU  26  12.820  10.615  12.284
    7   HD11  LEU  26          HD12      LEU  26  13.797   9.952  10.977
    8   HD13  LEU  26          HD13      LEU  26  14.541  10.325  12.532
    9   HD21  LEU  26          HD21      LEU  26  11.779   8.217  11.091
   10   HD23  LEU  26          HD22      LEU  26  11.222   8.919  12.607
   11   HD22  LEU  26          HD23      LEU  26  11.652   7.212  12.535

  No H/Q in entry =          11
  In of MODEL   87
    1    H    LYS  27           H        LYS  27  15.866   5.998  13.926
    2    HA   LYS  27           HA       LYS  27  15.283   7.367  16.295
    3    HB2  LYS  27           HB2      LYS  27  15.279   4.892  16.025
    4    HB3  LYS  27           HB3      LYS  27  17.043   4.921  15.988
    5    HG2  LYS  27           HG2      LYS  27  17.099   5.902  18.240
    6    HG3  LYS  27           HG3      LYS  27  15.332   5.944  18.279
    7    HD2  LYS  27           HD2      LYS  27  15.275   3.478  18.037
    8    HD3  LYS  27           HD3      LYS  27  17.039   3.443  18.032
    9    HE2  LYS  27           HE2      LYS  27  17.079   4.427  20.290
   10    HE3  LYS  27           HE3      LYS  27  15.314   4.491  20.299
   11    HZ3  LYS  27           HZ1      LYS  27  16.071   2.526  21.449
   12    HZ2  LYS  27           HZ2      LYS  27  16.985   2.038  20.100
   13    HZ1  LYS  27           HZ3      LYS  27  15.288   2.066  20.015

  No H/Q in entry =          13
  In of MODEL   87
    1    H    GLN  28           H        GLN  28  18.397   6.745  14.713
    2    HA   GLN  28           HA       GLN  28  20.089   7.802  16.711
    3    HB2  GLN  28           HB2      GLN  28  20.385   7.756  13.697
    4    HB3  GLN  28           HB3      GLN  28  21.675   8.212  14.810
    5    HG2  GLN  28           HG2      GLN  28  20.220   5.553  14.866
    6    HG3  GLN  28           HG3      GLN  28  21.796   5.814  14.120
    7   HE21  GLN  28          HE21      GLN  28  22.960   7.552  16.070
    8   HE22  GLN  28          HE22      GLN  28  23.147   6.684  17.516

  No H/Q in entry =           8
  In of MODEL   87
    1    H    ALA  29           H        ALA  29  18.367   9.314  14.016
    2    HA   ALA  29           HA       ALA  29  19.403  11.920  14.278
    3    HB2  ALA  29           HB1      ALA  29  17.718  12.584  12.802
    4    HB1  ALA  29           HB2      ALA  29  16.555  11.426  13.447
    5    HB3  ALA  29           HB3      ALA  29  17.881  10.867  12.427

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LYS  30           H        LYS  30  16.598  10.358  15.786
    2    HA   LYS  30           HA       LYS  30  15.612  12.623  17.144
    3    HB2  LYS  30           HB2      LYS  30  15.455   9.682  17.841
    4    HB3  LYS  30           HB3      LYS  30  14.604  10.944  18.735
    5    HG2  LYS  30           HG2      LYS  30  13.497  11.650  16.614
    6    HG3  LYS  30           HG3      LYS  30  14.285  10.304  15.787
    7    HD2  LYS  30           HD2      LYS  30  13.184   8.710  17.309
    8    HD3  LYS  30           HD3      LYS  30  12.406  10.045  18.160
    9    HE2  LYS  30           HE2      LYS  30  11.255  10.699  16.065
   10    HE3  LYS  30           HE3      LYS  30  12.012   9.336  15.233
   11    HZ2  LYS  30           HZ1      LYS  30   9.695   8.959  16.105
   12    HZ1  LYS  30           HZ2      LYS  30  10.358   8.999  17.674
   13    HZ3  LYS  30           HZ3      LYS  30  10.852   7.809  16.563

  No H/Q in entry =          13
  In of MODEL   87
    1    H    GLN  31           H        GLN  31  18.238  10.412  17.886
    2    HA   GLN  31           HA       GLN  31  18.571  11.416  20.583
    3    HB2  GLN  31           HB2      GLN  31  20.576   9.818  18.982
    4    HB3  GLN  31           HB3      GLN  31  20.437   9.941  20.736
    5    HG2  GLN  31           HG2      GLN  31  17.912   9.028  19.957
    6    HG3  GLN  31           HG3      GLN  31  19.005   8.170  18.879
    7   HE21  GLN  31          HE21      GLN  31  17.437   7.042  21.147
    8   HE22  GLN  31          HE22      GLN  31  18.579   6.362  22.200

  No H/Q in entry =           8
  In of MODEL   87
    1    H    GLY  32           H        GLY  32  19.120  12.731  17.621
    2    HA3  GLY  32           HA2      GLY  32  20.137  14.763  17.115
    3    HA2  GLY  32           HA3      GLY  32  20.889  14.753  18.705

  No H/Q in entry =           3
  In of MODEL   87
    1    H    ASP  33           H        ASP  33  21.273  11.858  16.923
    2    HA   ASP  33           HA       ASP  33  24.110  12.491  16.468
    3    HB2  ASP  33           HB2      ASP  33  22.562   9.898  16.574
    4    HB3  ASP  33           HB3      ASP  33  24.252   9.990  16.085

  No H/Q in entry =           4
  In of MODEL   87
    1    H    PHE  34           H        PHE  34  23.655  13.826  14.588
    2    HA   PHE  34           HA       PHE  34  22.299  12.867  12.294
    3    HB2  PHE  34           HB2      PHE  34  24.461  14.968  12.536
    4    HB3  PHE  34           HB3      PHE  34  23.476  14.696  11.100
    5    HD1  PHE  34           HD1      PHE  34  23.746  16.620  14.019
    6    HD2  PHE  34           HD2      PHE  34  20.846  14.552  11.619
    7    HE1  PHE  34           HE1      PHE  34  21.948  18.042  14.963
    8    HE2  PHE  34           HE2      PHE  34  19.051  15.975  12.566
    9    HZ   PHE  34           HZ       PHE  34  19.606  17.720  14.234

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ALA  35           H        ALA  35  25.667  12.627  13.313
    2    HA   ALA  35           HA       ALA  35  26.768  11.795  10.858
    3    HB3  ALA  35           HB1      ALA  35  28.426  10.597  12.580
    4    HB2  ALA  35           HB2      ALA  35  27.573  11.633  13.725
    5    HB1  ALA  35           HB3      ALA  35  28.425  12.347  12.357

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ALA  36           H        ALA  36  25.615   9.850  13.615
    2    HA   ALA  36           HA       ALA  36  26.067   7.358  12.336
    3    HB2  ALA  36           HB1      ALA  36  25.619   6.614  14.408
    4    HB3  ALA  36           HB2      ALA  36  23.939   7.133  14.254
    5    HB1  ALA  36           HB3      ALA  36  25.154   8.246  14.883

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ALA  37           H        ALA  37  23.276   9.524  12.465
    2    HA   ALA  37           HA       ALA  37  21.399   7.784  11.279
    3    HB3  ALA  37           HB1      ALA  37  21.665  10.742  11.578
    4    HB1  ALA  37           HB2      ALA  37  20.337   9.682  12.044
    5    HB2  ALA  37           HB3      ALA  37  20.538  10.154  10.356

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LYS  38           H        LYS  38  23.537  10.218   9.812
    2    HA   LYS  38           HA       LYS  38  22.901   9.805   7.132
    3    HB2  LYS  38           HB2      LYS  38  24.727  11.334   8.586
    4    HB3  LYS  38           HB3      LYS  38  25.750  10.332   7.562
    5    HG2  LYS  38           HG2      LYS  38  24.603  11.123   5.564
    6    HG3  LYS  38           HG3      LYS  38  23.417  11.992   6.543
    7    HD2  LYS  38           HD2      LYS  38  25.031  13.567   7.304
    8    HD3  LYS  38           HD3      LYS  38  26.379  12.563   6.771
    9    HE2  LYS  38           HE2      LYS  38  26.053  14.443   5.222
   10    HE3  LYS  38           HE3      LYS  38  25.700  12.912   4.413
   11    HZ3  LYS  38           HZ1      LYS  38  23.510  13.386   4.277
   12    HZ2  LYS  38           HZ2      LYS  38  24.054  14.994   4.370
   13    HZ1  LYS  38           HZ3      LYS  38  23.465  14.215   5.758

  No H/Q in entry =          13
  In of MODEL   87
    1    H    ALA  39           H        ALA  39  25.386   8.169   9.093
    2    HA   ALA  39           HA       ALA  39  26.441   6.571   7.023
    3    HB2  ALA  39           HB1      ALA  39  26.330   5.603   9.865
    4    HB1  ALA  39           HB2      ALA  39  27.303   7.016   9.455
    5    HB3  ALA  39           HB3      ALA  39  27.636   5.463   8.689

  No H/Q in entry =           5
  In of MODEL   87
    1    H    MET  40           H        MET  40  23.812   5.985   9.312
    2    HA   MET  40           HA       MET  40  23.336   3.288   8.570
    3    HB2  MET  40           HB2      MET  40  21.542   5.352   9.861
    4    HB3  MET  40           HB3      MET  40  21.114   3.649   9.681
    5    HG2  MET  40           HG2      MET  40  23.671   4.554  11.032
    6    HG3  MET  40           HG3      MET  40  22.170   4.296  11.920
    7    HE3  MET  40           HE1      MET  40  21.559   0.670  12.086
    8    HE2  MET  40           HE2      MET  40  20.710   1.985  11.278
    9    HE1  MET  40           HE3      MET  40  21.449   2.260  12.854

  No H/Q in entry =           9
  In of MODEL   87
    1    H    MET  41           H        MET  41  21.966   6.362   7.385
    2    HA   MET  41           HA       MET  41  19.999   5.196   5.704
    3    HB2  MET  41           HB2      MET  41  21.515   7.768   5.201
    4    HB3  MET  41           HB3      MET  41  19.983   7.295   4.477
    5    HG2  MET  41           HG2      MET  41  19.227   7.111   7.025
    6    HG3  MET  41           HG3      MET  41  20.550   8.251   7.254
    7    HE2  MET  41           HE1      MET  41  20.015   9.553   3.918
    8    HE1  MET  41           HE2      MET  41  20.972   9.977   5.334
    9    HE3  MET  41           HE3      MET  41  19.715  11.074   4.768

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ASP  42           H        ASP  42  23.385   6.076   5.164
    2    HA   ASP  42           HA       ASP  42  23.480   5.607   2.405
    3    HB2  ASP  42           HB2      ASP  42  25.238   6.578   4.182
    4    HB3  ASP  42           HB3      ASP  42  25.875   4.945   4.053

  No H/Q in entry =           4
  In of MODEL   87
    1    H    GLN  43           H        GLN  43  24.168   3.437   5.124
    2    HA   GLN  43           HA       GLN  43  24.808   1.175   3.538
    3    HB2  GLN  43           HB2      GLN  43  23.779   1.365   6.379
    4    HB3  GLN  43           HB3      GLN  43  24.341  -0.129   5.622
    5    HG2  GLN  43           HG2      GLN  43  26.521   1.055   5.121
    6    HG3  GLN  43           HG3      GLN  43  25.952   2.387   6.121
    7   HE21  GLN  43          HE21      GLN  43  28.170   1.384   7.163
    8   HE22  GLN  43          HE22      GLN  43  27.877   0.302   8.436

  No H/Q in entry =           8
  In of MODEL   87
    1    H    SER  44           H        SER  44  21.762   2.345   4.916
    2    HA   SER  44           HA       SER  44  20.168   0.123   4.233
    3    HB2  SER  44           HB2      SER  44  19.754   2.655   5.383
    4    HB3  SER  44           HB3      SER  44  18.724   2.628   3.954
    5    HG   SER  44           HG       SER  44  17.613   1.695   5.672

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ARG  45           H        ARG  45  20.954   3.082   2.437
    2    HA   ARG  45           HA       ARG  45  19.430   2.620   0.127
    3    HB2  ARG  45           HB2      ARG  45  20.599   4.740   0.719
    4    HB3  ARG  45           HB3      ARG  45  22.135   3.967   0.337
    5    HG2  ARG  45           HG2      ARG  45  21.354   3.576  -1.981
    6    HG3  ARG  45           HG3      ARG  45  19.830   4.373  -1.597
    7    HD2  ARG  45           HD2      ARG  45  21.106   6.452  -1.005
    8    HD3  ARG  45           HD3      ARG  45  22.594   5.660  -1.570
    9    HE   ARG  45           HE       ARG  45  20.667   5.452  -3.613
   10   HH21  ARG  45          HH11      ARG  45  20.683   6.825  -5.373
   11   HH22  ARG  45          HH12      ARG  45  21.460   8.365  -5.263
   12   HH11  ARG  45          HH21      ARG  45  22.425   7.924  -1.975
   13   HH12  ARG  45          HH22      ARG  45  22.445   8.986  -3.336

  No H/Q in entry =          13
  In of MODEL   87
    1    H    MET  46           H        MET  46  22.780   1.700   0.882
    2    HA   MET  46           HA       MET  46  23.378   0.505  -1.603
    3    HB2  MET  46           HB2      MET  46  24.473   0.164   1.189
    4    HB3  MET  46           HB3      MET  46  25.118  -0.744  -0.182
    5    HG2  MET  46           HG2      MET  46  25.602   1.348  -1.371
    6    HG3  MET  46           HG3      MET  46  24.901   2.280  -0.054
    7    HE2  MET  46           HE1      MET  46  28.819   0.116  -0.430
    8    HE1  MET  46           HE2      MET  46  27.288  -0.193  -1.243
    9    HE3  MET  46           HE3      MET  46  27.620  -0.952   0.312

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ALA  47           H        ALA  47  21.968  -0.816   1.367
    2    HA   ALA  47           HA       ALA  47  21.880  -3.526   0.558
    3    HB2  ALA  47           HB1      ALA  47  21.501  -3.065   2.863
    4    HB3  ALA  47           HB2      ALA  47  19.958  -3.646   2.238
    5    HB1  ALA  47           HB3      ALA  47  20.211  -1.919   2.501

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LEU  48           H        LEU  48  19.564  -0.866   0.201
    2    HA   LEU  48           HA       LEU  48  17.502  -2.369  -1.058
    3    HB2  LEU  48           HB2      LEU  48  18.198   0.576  -1.166
    4    HB3  LEU  48           HB3      LEU  48  16.718  -0.112  -1.837
    5    HG   LEU  48           HG       LEU  48  17.561  -0.431   1.053
    6   HD13  LEU  48          HD11      LEU  48  17.175   1.875   0.869
    7   HD12  LEU  48          HD12      LEU  48  15.607   1.249   1.374
    8   HD11  LEU  48          HD13      LEU  48  15.888   1.670  -0.316
    9   HD22  LEU  48          HD21      LEU  48  16.009  -2.123   0.665
   10   HD21  LEU  48          HD22      LEU  48  15.151  -1.206  -0.574
   11   HD23  LEU  48          HD23      LEU  48  14.940  -0.802   1.130

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ASN  49           H        ASN  49  20.220  -0.477  -2.279
    2    HA   ASN  49           HA       ASN  49  19.574  -0.546  -5.005
    3    HB2  ASN  49           HB2      ASN  49  21.268   0.950  -4.102
    4    HB3  ASN  49           HB3      ASN  49  22.269  -0.415  -3.624
    5   HD21  ASN  49          HD21      ASN  49  21.291   1.595  -6.312
    6   HD22  ASN  49          HD22      ASN  49  22.344   0.913  -7.455

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLU  50           H        GLU  50  21.522  -2.772  -3.042
    2    HA   GLU  50           HA       GLU  50  22.203  -4.534  -5.169
    3    HB2  GLU  50           HB2      GLU  50  23.396  -4.530  -3.001
    4    HB3  GLU  50           HB3      GLU  50  21.943  -5.138  -2.209
    5    HG2  GLU  50           HG2      GLU  50  22.006  -7.170  -3.571
    6    HG3  GLU  50           HG3      GLU  50  23.393  -6.556  -4.468

  No H/Q in entry =           6
  In of MODEL   87
    1    H    ALA  51           H        ALA  51  19.543  -4.434  -2.848
    2    HA   ALA  51           HA       ALA  51  18.343  -6.889  -3.612
    3    HB3  ALA  51           HB1      ALA  51  16.755  -6.363  -2.059
    4    HB1  ALA  51           HB2      ALA  51  16.567  -4.713  -2.656
    5    HB2  ALA  51           HB3      ALA  51  17.918  -5.120  -1.597

  No H/Q in entry =           5
  In of MODEL   87
    1    H    HIS  52           H        HIS  52  17.807  -3.532  -4.643
    2    HA   HIS  52           HA       HIS  52  15.690  -4.025  -6.448
    3    HB2  HIS  52           HB2      HIS  52  16.371  -1.771  -5.642
    4    HB3  HIS  52           HB3      HIS  52  17.825  -1.886  -6.632
    5    HD1  HIS  52           HD1      HIS  52  17.532  -1.774  -9.218
    6    HD2  HIS  52           HD2      HIS  52  13.972  -1.319  -7.099
    7    HE1  HIS  52           HE1      HIS  52  15.814  -0.931 -10.877
    8    HE2  HIS  52           HE2      HIS  52  13.638  -0.647  -9.600

  No H/Q in entry =           8
  In of MODEL   87
    1    H    LEU  53           H        LEU  53  19.209  -4.080  -6.874
    2    HA   LEU  53           HA       LEU  53  19.267  -4.393  -9.674
    3    HB2  LEU  53           HB2      LEU  53  21.186  -5.190  -7.498
    4    HB3  LEU  53           HB3      LEU  53  21.499  -5.570  -9.190
    5    HG   LEU  53           HG       LEU  53  20.861  -2.756  -8.250
    6   HD12  LEU  53          HD11      LEU  53  23.382  -2.431  -8.521
    7   HD11  LEU  53          HD12      LEU  53  23.513  -4.189  -8.487
    8   HD13  LEU  53          HD13      LEU  53  22.872  -3.328  -7.094
    9   HD23  LEU  53          HD21      LEU  53  22.297  -2.319 -10.396
   10   HD22  LEU  53          HD22      LEU  53  20.618  -2.810 -10.591
   11   HD21  LEU  53          HD23      LEU  53  21.903  -3.982 -10.812

  No H/Q in entry =          11
  In of MODEL   87
    1    H    VAL  54           H        VAL  54  19.116  -6.781  -7.052
    2    HA   VAL  54           HA       VAL  54  19.210  -9.075  -8.715
    3    HB   VAL  54           HB       VAL  54  18.056  -8.639  -5.949
    4   HG12  VAL  54          HG11      VAL  54  18.344 -11.261  -5.947
    5   HG11  VAL  54          HG12      VAL  54  18.165 -11.088  -7.693
    6   HG13  VAL  54          HG13      VAL  54  16.882 -10.540  -6.616
    7   HG22  VAL  54          HG21      VAL  54  20.375  -8.461  -5.721
    8   HG21  VAL  54          HG22      VAL  54  20.699  -9.555  -7.063
    9   HG23  VAL  54          HG23      VAL  54  20.157 -10.197  -5.513

  No H/Q in entry =           9
  In of MODEL   87
    1    H    GLN  55           H        GLN  55  16.506  -7.136  -7.434
    2    HA   GLN  55           HA       GLN  55  14.464  -8.771  -8.514
    3    HB2  GLN  55           HB2      GLN  55  13.734  -7.237  -6.887
    4    HB3  GLN  55           HB3      GLN  55  14.547  -5.879  -7.660
    5    HG2  GLN  55           HG2      GLN  55  12.830  -5.529  -9.152
    6    HG3  GLN  55           HG3      GLN  55  12.485  -7.245  -9.325
    7   HE21  GLN  55          HE21      GLN  55  10.469  -7.768  -8.524
    8   HE22  GLN  55          HE22      GLN  55   9.704  -7.005  -7.217

  No H/Q in entry =           8
  In of MODEL   87
    1    H    THR  56           H        THR  56  16.244  -5.993  -9.867
    2    HA   THR  56           HA       THR  56  14.815  -5.609 -12.217
    3    HB   THR  56           HB       THR  56  17.835  -5.561 -12.045
    4    HG1  THR  56           HG1      THR  56  15.882  -4.001 -10.874
    5   HG22  THR  56          HG21      THR  56  16.003  -3.741 -13.603
    6   HG21  THR  56          HG22      THR  56  16.569  -5.272 -14.270
    7   HG23  THR  56          HG23      THR  56  17.731  -4.018 -13.833

  No H/Q in entry =           7
  In of MODEL   87
    1    H    LYS  57           H        LYS  57  17.433  -7.942 -11.604
    2    HA   LYS  57           HA       LYS  57  17.423  -9.134 -14.184
    3    HB2  LYS  57           HB2      LYS  57  19.206  -9.412 -12.435
    4    HB3  LYS  57           HB3      LYS  57  18.087 -10.393 -11.502
    5    HG2  LYS  57           HG2      LYS  57  17.972 -12.044 -13.295
    6    HG3  LYS  57           HG3      LYS  57  19.004 -11.049 -14.316
    7    HD2  LYS  57           HD2      LYS  57  20.839 -11.269 -12.662
    8    HD3  LYS  57           HD3      LYS  57  19.812 -12.304 -11.672
    9    HE2  LYS  57           HE2      LYS  57  20.649 -12.898 -14.533
   10    HE3  LYS  57           HE3      LYS  57  21.346 -13.653 -13.102
   11    HZ2  LYS  57           HZ1      LYS  57  18.785 -14.111 -14.375
   12    HZ1  LYS  57           HZ2      LYS  57  18.758 -14.076 -12.677
   13    HZ3  LYS  57           HZ3      LYS  57  19.768 -15.174 -13.491

  No H/Q in entry =          13
  In of MODEL   87
    1    H    LEU  58           H        LEU  58  15.628  -9.781 -11.212
    2    HA   LEU  58           HA       LEU  58  14.377 -12.138 -12.151
    3    HB2  LEU  58           HB2      LEU  58  13.603 -10.224  -9.955
    4    HB3  LEU  58           HB3      LEU  58  12.778 -11.751 -10.274
    5    HG   LEU  58           HG       LEU  58  15.753 -11.512  -9.714
    6   HD11  LEU  58          HD11      LEU  58  13.374 -11.901  -7.926
    7   HD13  LEU  58          HD12      LEU  58  14.839 -10.956  -7.660
    8   HD12  LEU  58          HD13      LEU  58  14.888 -12.713  -7.527
    9   HD22  LEU  58          HD21      LEU  58  15.610 -13.571 -10.744
   10   HD21  LEU  58          HD22      LEU  58  13.893 -13.759 -10.387
   11   HD23  LEU  58          HD23      LEU  58  15.096 -14.076  -9.136

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  59           H        ILE  59  13.750  -8.791 -12.832
    2    HA   ILE  59           HA       ILE  59  11.028  -9.404 -13.777
    3    HB   ILE  59           HB       ILE  59  11.859  -7.134 -12.567
    4   HG12  ILE  59          HG12      ILE  59   9.962  -6.979 -14.920
    5   HG13  ILE  59          HG13      ILE  59   9.529  -7.752 -13.417
    6   HG21  ILE  59          HG21      ILE  59  13.409  -6.757 -14.630
    7   HG23  ILE  59          HG22      ILE  59  12.459  -5.405 -14.059
    8   HG22  ILE  59          HG23      ILE  59  11.942  -6.320 -15.472
    9   HD13  ILE  59          HD11      ILE  59  10.004  -5.675 -12.182
   10   HD12  ILE  59          HD12      ILE  59   8.779  -5.409 -13.422
   11   HD11  ILE  59          HD13      ILE  59  10.442  -4.887 -13.699

  No H/Q in entry =          11
  In of MODEL   87
    1    H    GLU  60           H        GLU  60  14.245  -8.592 -15.029
    2    HA   GLU  60           HA       GLU  60  13.475  -8.179 -17.738
    3    HB2  GLU  60           HB2      GLU  60  15.660  -7.470 -16.894
    4    HB3  GLU  60           HB3      GLU  60  16.101  -9.145 -16.572
    5    HG2  GLU  60           HG2      GLU  60  15.922  -9.666 -18.977
    6    HG3  GLU  60           HG3      GLU  60  15.464  -7.997 -19.307

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLY  61           H        GLY  61  14.412 -11.075 -15.924
    2    HA3  GLY  61           HA2      GLY  61  13.854 -12.713 -18.328
    3    HA2  GLY  61           HA3      GLY  61  14.878 -13.209 -16.985

  No H/Q in entry =           3
  In of MODEL   87
    1    H    ASP  62           H        ASP  62  11.776 -11.623 -16.620
    2    HA   ASP  62           HA       ASP  62  10.817 -13.541 -14.783
    3    HB2  ASP  62           HB2      ASP  62   8.717 -12.290 -14.912
    4    HB3  ASP  62           HB3      ASP  62  10.094 -11.199 -14.782

  No H/Q in entry =           4
  In of MODEL   87
    1    H    ALA  63           H        ALA  63  11.244 -15.511 -16.230
    2    HA   ALA  63           HA       ALA  63   9.566 -16.058 -18.478
    3    HB2  ALA  63           HB1      ALA  63  10.816 -18.074 -16.596
    4    HB1  ALA  63           HB2      ALA  63  11.699 -17.271 -17.894
    5    HB3  ALA  63           HB3      ALA  63  10.343 -18.332 -18.275

  No H/Q in entry =           5
  In of MODEL   87
    1    H    GLY  64           H        GLY  64   9.304 -16.674 -15.019
    2    HA3  GLY  64           HA2      GLY  64   7.508 -17.183 -13.683
    3    HA2  GLY  64           HA3      GLY  64   6.466 -16.740 -15.027

  No H/Q in entry =           3
  In of MODEL   87
    1    H    GLU  65           H        GLU  65   5.287 -18.652 -13.908
    2    HA   GLU  65           HA       GLU  65   6.272 -21.274 -14.217
    3    HB2  GLU  65           HB2      GLU  65   3.426 -20.286 -14.020
    4    HB3  GLU  65           HB3      GLU  65   3.916 -21.975 -13.894
    5    HG2  GLU  65           HG2      GLU  65   4.996 -19.773 -12.119
    6    HG3  GLU  65           HG3      GLU  65   3.654 -20.824 -11.669

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLY  66           H        GLY  66   4.230 -19.315 -16.264
    2    HA3  GLY  66           HA2      GLY  66   4.372 -21.307 -18.427
    3    HA2  GLY  66           HA3      GLY  66   3.118 -20.094 -18.262

  No H/Q in entry =           3
  In of MODEL   87
    1    H    LYS  67           H        LYS  67   3.968 -20.109 -20.635
    2    HA   LYS  67           HA       LYS  67   6.389 -18.872 -21.301
    3    HB2  LYS  67           HB2      LYS  67   3.884 -18.797 -22.972
    4    HB3  LYS  67           HB3      LYS  67   5.565 -18.814 -23.520
    5    HG2  LYS  67           HG2      LYS  67   3.959 -21.046 -22.296
    6    HG3  LYS  67           HG3      LYS  67   4.940 -21.065 -23.759
    7    HD2  LYS  67           HD2      LYS  67   6.951 -20.654 -22.190
    8    HD3  LYS  67           HD3      LYS  67   5.859 -21.135 -20.889
    9    HE2  LYS  67           HE2      LYS  67   5.341 -23.157 -22.536
   10    HE3  LYS  67           HE3      LYS  67   6.948 -22.767 -23.149
   11    HZ3  LYS  67           HZ1      LYS  67   7.482 -24.197 -21.480
   12    HZ2  LYS  67           HZ2      LYS  67   6.152 -23.766 -20.516
   13    HZ1  LYS  67           HZ3      LYS  67   7.505 -22.743 -20.607

  No H/Q in entry =          13
  In of MODEL   87
    1    H    MET  68           H        MET  68   3.258 -17.403 -21.917
    2    HA   MET  68           HA       MET  68   4.187 -14.764 -22.175
    3    HB2  MET  68           HB2      MET  68   1.415 -15.822 -21.610
    4    HB3  MET  68           HB3      MET  68   1.784 -14.170 -22.102
    5    HG2  MET  68           HG2      MET  68   2.515 -16.641 -23.697
    6    HG3  MET  68           HG3      MET  68   1.124 -15.608 -24.028
    7    HE1  MET  68           HE1      MET  68   1.089 -13.360 -24.408
    8    HE3  MET  68           HE2      MET  68   2.275 -12.423 -25.314
    9    HE2  MET  68           HE3      MET  68   2.378 -12.496 -23.557

  No H/Q in entry =           9
  In of MODEL   87
    1    H    LYS  69           H        LYS  69   2.732 -16.395 -19.343
    2    HA   LYS  69           HA       LYS  69   2.482 -14.022 -17.805
    3    HB2  LYS  69           HB2      LYS  69   2.403 -16.941 -17.063
    4    HB3  LYS  69           HB3      LYS  69   2.133 -15.646 -15.893
    5    HG2  LYS  69           HG2      LYS  69   0.310 -14.752 -17.287
    6    HG3  LYS  69           HG3      LYS  69   0.578 -16.035 -18.467
    7    HD2  LYS  69           HD2      LYS  69  -0.002 -17.730 -16.804
    8    HD3  LYS  69           HD3      LYS  69  -0.192 -16.483 -15.570
    9    HE2  LYS  69           HE2      LYS  69  -2.390 -17.086 -16.457
   10    HE3  LYS  69           HE3      LYS  69  -1.988 -15.440 -16.944
   11    HZ1  LYS  69           HZ1      LYS  69  -1.607 -17.860 -18.617
   12    HZ3  LYS  69           HZ2      LYS  69  -1.268 -16.263 -19.081
   13    HZ2  LYS  69           HZ3      LYS  69  -2.870 -16.744 -18.789

  No H/Q in entry =          13
  In of MODEL   87
    1    H    VAL  70           H        VAL  70   3.409 -14.164 -15.368
    2    HA   VAL  70           HA       VAL  70   6.349 -14.505 -15.523
    3    HB   VAL  70           HB       VAL  70   6.565 -12.435 -14.177
    4   HG13  VAL  70          HG11      VAL  70   6.834 -12.217 -16.566
    5   HG12  VAL  70          HG12      VAL  70   5.861 -10.851 -16.022
    6   HG11  VAL  70          HG13      VAL  70   5.089 -12.222 -16.815
    7   HG22  VAL  70          HG21      VAL  70   4.483 -12.259 -13.023
    8   HG21  VAL  70          HG22      VAL  70   3.558 -12.425 -14.515
    9   HG23  VAL  70          HG23      VAL  70   4.442 -10.936 -14.187

  No H/Q in entry =           9
  In of MODEL   87
    1    H    SER  71           H        SER  71   7.348 -14.575 -13.333
    2    HA   SER  71           HA       SER  71   6.184 -16.554 -11.681
    3    HB2  SER  71           HB2      SER  71   8.630 -16.073 -11.813
    4    HB3  SER  71           HB3      SER  71   8.347 -14.564 -10.949
    5    HG   SER  71           HG       SER  71   7.249 -16.034  -9.363

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LEU  72           H        LEU  72   4.820 -16.416 -10.013
    2    HA   LEU  72           HA       LEU  72   3.299 -14.084  -9.569
    3    HB2  LEU  72           HB2      LEU  72   3.550 -16.646  -8.001
    4    HB3  LEU  72           HB3      LEU  72   2.396 -15.375  -7.603
    5    HG   LEU  72           HG       LEU  72   2.545 -16.660 -10.349
    6   HD12  LEU  72          HD11      LEU  72   0.452 -17.873  -9.550
    7   HD11  LEU  72          HD12      LEU  72   0.897 -17.386  -7.916
    8   HD13  LEU  72          HD13      LEU  72   1.970 -18.433  -8.845
    9   HD22  LEU  72          HD21      LEU  72   1.331 -14.662 -10.578
   10   HD21  LEU  72          HD22      LEU  72   0.654 -14.757  -8.961
   11   HD23  LEU  72          HD23      LEU  72   0.055 -15.822 -10.229

  No H/Q in entry =          11
  In of MODEL   87
    1    H    VAL  73           H        VAL  73   5.932 -15.557  -7.791
    2    HA   VAL  73           HA       VAL  73   5.886 -14.027  -5.457
    3    HB   VAL  73           HB       VAL  73   8.065 -14.859  -5.031
    4   HG12  VAL  73          HG11      VAL  73   6.706 -16.886  -6.829
    5   HG11  VAL  73          HG12      VAL  73   6.202 -16.537  -5.176
    6   HG13  VAL  73          HG13      VAL  73   7.796 -17.223  -5.486
    7   HG22  VAL  73          HG21      VAL  73   9.404 -14.330  -6.857
    8   HG21  VAL  73          HG22      VAL  73   8.230 -14.935  -8.025
    9   HG23  VAL  73          HG23      VAL  73   9.208 -16.067  -7.090

  No H/Q in entry =           9
  In of MODEL   87
    1    H    LEU  74           H        LEU  74   6.895 -13.141  -8.629
    2    HA   LEU  74           HA       LEU  74   8.864 -11.219  -8.128
    3    HB2  LEU  74           HB2      LEU  74   8.407 -11.957 -10.368
    4    HB3  LEU  74           HB3      LEU  74   6.747 -11.372 -10.272
    5    HG   LEU  74           HG       LEU  74   7.578  -9.053 -10.048
    6   HD12  LEU  74          HD11      LEU  74  10.085  -8.793 -10.650
    7   HD11  LEU  74          HD12      LEU  74  10.239 -10.475 -10.148
    8   HD13  LEU  74          HD13      LEU  74   9.691  -9.258  -8.996
    9   HD21  LEU  74          HD21      LEU  74   7.308 -10.467 -12.272
   10   HD23  LEU  74          HD22      LEU  74   9.028 -10.170 -12.367
   11   HD22  LEU  74          HD23      LEU  74   7.923  -8.816 -12.307

  No H/Q in entry =          11
  In of MODEL   87
    1    H    VAL  75           H        VAL  75   5.375 -10.788  -8.491
    2    HA   VAL  75           HA       VAL  75   5.313  -8.032  -7.900
    3    HB   VAL  75           HB       VAL  75   3.193 -10.148  -7.519
    4   HG11  VAL  75          HG11      VAL  75   3.047  -7.105  -7.362
    5   HG13  VAL  75          HG12      VAL  75   2.725  -8.237  -6.057
    6   HG12  VAL  75          HG13      VAL  75   1.645  -8.167  -7.442
    7   HG22  VAL  75          HG21      VAL  75   3.870  -9.830  -9.841
    8   HG21  VAL  75          HG22      VAL  75   3.777  -8.079  -9.666
    9   HG23  VAL  75          HG23      VAL  75   2.306  -9.051  -9.604

  No H/Q in entry =           9
  In of MODEL   87
    1    H    GLU  76           H        GLU  76   5.015 -10.909  -5.795
    2    HA   GLU  76           HA       GLU  76   4.555  -9.545  -3.373
    3    HB2  GLU  76           HB2      GLU  76   4.374 -12.029  -3.667
    4    HB3  GLU  76           HB3      GLU  76   6.122 -12.115  -3.798
    5    HG2  GLU  76           HG2      GLU  76   6.365 -11.247  -1.509
    6    HG3  GLU  76           HG3      GLU  76   4.623 -11.103  -1.349

  No H/Q in entry =           6
  In of MODEL   87
    1    H    ALA  77           H        ALA  77   7.608 -10.490  -4.928
    2    HA   ALA  77           HA       ALA  77   9.304  -9.472  -2.905
    3    HB1  ALA  77           HB1      ALA  77  10.159 -11.006  -4.574
    4    HB2  ALA  77           HB2      ALA  77  11.050  -9.489  -4.687
    5    HB3  ALA  77           HB3      ALA  77   9.795  -9.863  -5.866

  No H/Q in entry =           5
  In of MODEL   87
    1    H    GLN  78           H        GLN  78   7.941  -8.032  -5.821
    2    HA   GLN  78           HA       GLN  78   9.326  -5.571  -5.708
    3    HB2  GLN  78           HB2      GLN  78   7.980  -6.513  -7.652
    4    HB3  GLN  78           HB3      GLN  78   6.531  -6.003  -6.787
    5    HG2  GLN  78           HG2      GLN  78   7.253  -3.693  -6.823
    6    HG3  GLN  78           HG3      GLN  78   8.807  -4.146  -7.524
    7   HE21  GLN  78          HE21      GLN  78   5.347  -4.886  -8.307
    8   HE22  GLN  78          HE22      GLN  78   5.509  -4.541  -9.961

  No H/Q in entry =           8
  In of MODEL   87
    1    H    LEU  79           H        LEU  79   6.286  -6.670  -4.291
    2    HA   LEU  79           HA       LEU  79   5.321  -4.251  -3.281
    3    HB2  LEU  79           HB2      LEU  79   3.979  -6.285  -3.234
    4    HB3  LEU  79           HB3      LEU  79   5.109  -7.041  -2.116
    5    HG   LEU  79           HG       LEU  79   4.573  -5.395  -0.388
    6   HD13  LEU  79          HD11      LEU  79   4.139  -3.372  -1.437
    7   HD12  LEU  79          HD12      LEU  79   2.505  -3.876  -1.005
    8   HD11  LEU  79          HD13      LEU  79   3.089  -4.104  -2.652
    9   HD23  LEU  79          HD21      LEU  79   1.979  -5.852  -0.309
   10   HD22  LEU  79          HD22      LEU  79   3.100  -7.206  -0.198
   11   HD21  LEU  79          HD23      LEU  79   2.297  -6.856  -1.726

  No H/Q in entry =          11
  In of MODEL   87
    1    H    HIS  80           H        HIS  80   7.465  -6.619  -1.694
    2    HA   HIS  80           HA       HIS  80   7.765  -5.084   0.679
    3    HB2  HIS  80           HB2      HIS  80   9.075  -7.465  -0.518
    4    HB3  HIS  80           HB3      HIS  80   9.993  -6.583   0.704
    5    HD1  HIS  80           HD1      HIS  80   9.484  -7.215   3.044
    6    HD2  HIS  80           HD2      HIS  80   6.266  -8.017   0.517
    7    HE1  HIS  80           HE1      HIS  80   7.690  -8.296   4.483
    8    HE2  HIS  80           HE2      HIS  80   5.723  -8.789   2.951

  No H/Q in entry =           8
  In of MODEL   87
    1    H    LEU  81           H        LEU  81   9.778  -5.384  -2.225
    2    HA   LEU  81           HA       LEU  81  11.843  -3.673  -1.335
    3    HB2  LEU  81           HB2      LEU  81  10.923  -4.449  -4.103
    4    HB3  LEU  81           HB3      LEU  81  12.356  -3.463  -3.805
    5    HG   LEU  81           HG       LEU  81  11.919  -6.180  -2.538
    6   HD12  LEU  81          HD11      LEU  81  13.733  -6.830  -4.281
    7   HD11  LEU  81          HD12      LEU  81  13.192  -5.396  -5.152
    8   HD13  LEU  81          HD13      LEU  81  12.060  -6.705  -4.821
    9   HD23  LEU  81          HD21      LEU  81  14.551  -5.903  -2.512
   10   HD22  LEU  81          HD22      LEU  81  13.575  -5.131  -1.265
   11   HD21  LEU  81          HD23      LEU  81  14.173  -4.185  -2.627

  No H/Q in entry =          11
  In of MODEL   87
    1    H    MET  82           H        MET  82   8.939  -2.992  -3.284
    2    HA   MET  82           HA       MET  82   9.520  -0.273  -3.778
    3    HB2  MET  82           HB2      MET  82   6.937  -1.830  -3.667
    4    HB3  MET  82           HB3      MET  82   6.964  -0.105  -4.028
    5    HG2  MET  82           HG2      MET  82   8.540  -2.199  -5.560
    6    HG3  MET  82           HG3      MET  82   6.985  -1.553  -6.078
    7    HE3  MET  82           HE1      MET  82   7.489   1.897  -7.242
    8    HE2  MET  82           HE2      MET  82   7.104   1.673  -5.538
    9    HE1  MET  82           HE3      MET  82   6.428   0.575  -6.737

  No H/Q in entry =           9
  In of MODEL   87
    1    H    THR  83           H        THR  83   7.693  -1.849  -1.183
    2    HA   THR  83           HA       THR  83   6.871   0.509   0.143
    3    HB   THR  83           HB       THR  83   6.704  -1.066   2.158
    4    HG1  THR  83           HG1      THR  83   7.433  -3.027   1.928
    5   HG22  THR  83          HG21      THR  83   5.035  -2.605   0.680
    6   HG21  THR  83          HG22      THR  83   5.286  -1.278  -0.449
    7   HG23  THR  83          HG23      THR  83   4.643  -0.956   1.162

  No H/Q in entry =           7
  In of MODEL   87
    1    H    SER  84           H        SER  84   9.661  -1.631   0.673
    2    HA   SER  84           HA       SER  84  10.732  -0.221   2.869
    3    HB2  SER  84           HB2      SER  84  11.966  -2.079   0.846
    4    HB3  SER  84           HB3      SER  84  12.918  -1.342   2.134
    5    HG   SER  84           HG       SER  84  10.617  -2.997   2.380

  No H/Q in entry =           5
  In of MODEL   87
    1    H    MET  85           H        MET  85  11.504   0.035  -0.615
    2    HA   MET  85           HA       MET  85  13.531   1.969  -0.352
    3    HB2  MET  85           HB2      MET  85  13.126   0.697  -2.422
    4    HB3  MET  85           HB3      MET  85  11.613   1.572  -2.657
    5    HG2  MET  85           HG2      MET  85  12.849   3.702  -2.763
    6    HG3  MET  85           HG3      MET  85  14.363   2.839  -2.508
    7    HE1  MET  85           HE1      MET  85  15.207   0.999  -3.862
    8    HE3  MET  85           HE2      MET  85  15.889   2.425  -4.640
    9    HE2  MET  85           HE3      MET  85  15.257   1.115  -5.628

  No H/Q in entry =           9
  In of MODEL   87
    1    H    LEU  86           H        LEU  86  10.050   2.358  -0.876
    2    HA   LEU  86           HA       LEU  86  10.030   5.172  -1.054
    3    HB2  LEU  86           HB2      LEU  86   8.163   3.542  -1.641
    4    HB3  LEU  86           HB3      LEU  86   7.824   3.454   0.088
    5    HG   LEU  86           HG       LEU  86   7.703   6.017   0.039
    6   HD11  LEU  86          HD11      LEU  86   8.484   5.574  -2.660
    7   HD13  LEU  86          HD12      LEU  86   8.069   7.107  -1.899
    8   HD12  LEU  86          HD13      LEU  86   6.821   6.164  -2.711
    9   HD23  LEU  86          HD21      LEU  86   5.556   4.701  -1.636
   10   HD22  LEU  86          HD22      LEU  86   5.380   5.962  -0.418
   11   HD21  LEU  86          HD23      LEU  86   5.752   4.310   0.074

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ALA  87           H        ALA  87   9.518   2.997   1.687
    2    HA   ALA  87           HA       ALA  87   8.990   4.916   3.657
    3    HB1  ALA  87           HB1      ALA  87   9.754   2.083   3.569
    4    HB3  ALA  87           HB2      ALA  87   8.637   2.911   4.651
    5    HB2  ALA  87           HB3      ALA  87  10.364   2.915   5.003

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ARG  88           H        ARG  88  12.055   3.444   2.687
    2    HA   ARG  88           HA       ARG  88  13.678   4.794   4.529
    3    HB2  ARG  88           HB2      ARG  88  14.321   2.812   3.125
    4    HB3  ARG  88           HB3      ARG  88  14.497   3.905   1.755
    5    HG2  ARG  88           HG2      ARG  88  15.983   5.192   3.710
    6    HG3  ARG  88           HG3      ARG  88  16.275   3.497   4.087
    7    HD2  ARG  88           HD2      ARG  88  17.545   3.184   2.246
    8    HD3  ARG  88           HD3      ARG  88  16.427   4.075   1.209
    9    HE   ARG  88           HE       ARG  88  18.833   5.099   2.269
   10   HH21  ARG  88          HH11      ARG  88  19.214   7.312   2.079
   11   HH22  ARG  88          HH12      ARG  88  17.881   8.405   1.932
   12   HH11  ARG  88          HH21      ARG  88  15.507   5.905   1.977
   13   HH12  ARG  88          HH22      ARG  88  15.781   7.606   1.850

  No H/Q in entry =          13
  In of MODEL   87
    1    H    GLU  89           H        GLU  89  12.734   5.712   1.203
    2    HA   GLU  89           HA       GLU  89  14.318   8.048   1.057
    3    HB2  GLU  89           HB2      GLU  89  13.166   7.028  -0.897
    4    HB3  GLU  89           HB3      GLU  89  11.627   7.593  -0.245
    5    HG2  GLU  89           HG2      GLU  89  12.367   9.919  -0.401
    6    HG3  GLU  89           HG3      GLU  89  13.965   9.404  -0.931

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LEU  90           H        LEU  90  10.977   7.589   2.172
    2    HA   LEU  90           HA       LEU  90  10.502  10.329   2.750
    3    HB2  LEU  90           HB2      LEU  90   9.263   7.773   3.768
    4    HB3  LEU  90           HB3      LEU  90   8.655   9.378   4.191
    5    HG   LEU  90           HG       LEU  90   9.072   8.496   1.322
    6   HD12  LEU  90          HD11      LEU  90   6.533   8.207   1.373
    7   HD11  LEU  90          HD12      LEU  90   6.680   8.192   3.131
    8   HD13  LEU  90          HD13      LEU  90   7.483   6.951   2.167
    9   HD22  LEU  90          HD21      LEU  90   8.814  10.809   1.251
   10   HD21  LEU  90          HD22      LEU  90   7.823  10.854   2.707
   11   HD23  LEU  90          HD23      LEU  90   7.123  10.313   1.182

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  91           H        ILE  91  11.715   7.625   4.673
    2    HA   ILE  91           HA       ILE  91  11.866   8.984   7.144
    3    HB   ILE  91           HB       ILE  91  13.388   6.623   6.023
    4   HG12  ILE  91          HG12      ILE  91  11.365   6.818   8.274
    5   HG13  ILE  91          HG13      ILE  91  10.897   6.548   6.596
    6   HG22  ILE  91          HG21      ILE  91  13.843   6.398   8.665
    7   HG21  ILE  91          HG22      ILE  91  13.796   8.158   8.566
    8   HG23  ILE  91          HG23      ILE  91  14.964   7.253   7.605
    9   HD13  ILE  91          HD11      ILE  91  11.867   4.430   6.526
   10   HD12  ILE  91          HD12      ILE  91  11.268   4.495   8.184
   11   HD11  ILE  91          HD13      ILE  91  12.975   4.782   7.853

  No H/Q in entry =          11
  In of MODEL   87
    1    H    THR  92           H        THR  92  14.092   8.785   4.401
    2    HA   THR  92           HA       THR  92  16.274  10.141   5.571
    3    HB   THR  92           HB       THR  92  15.298  10.037   2.707
    4    HG1  THR  92           HG1      THR  92  16.098   8.126   3.112
    5   HG22  THR  92          HG21      THR  92  17.879  10.687   2.425
    6   HG21  THR  92          HG22      THR  92  17.578  11.510   3.954
    7   HG23  THR  92          HG23      THR  92  16.620  11.915   2.530

  No H/Q in entry =           7
  In of MODEL   87
    1    H    GLU  93           H        GLU  93  13.412  11.343   3.833
    2    HA   GLU  93           HA       GLU  93  14.050  14.094   3.954
    3    HB2  GLU  93           HB2      GLU  93  11.324  12.764   3.955
    4    HB3  GLU  93           HB3      GLU  93  11.640  14.459   3.588
    5    HG2  GLU  93           HG2      GLU  93  12.949  12.199   2.061
    6    HG3  GLU  93           HG3      GLU  93  11.415  12.906   1.569

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LEU  94           H        LEU  94  12.264  11.962   6.155
    2    HA   LEU  94           HA       LEU  94  11.478  13.917   8.031
    3    HB2  LEU  94           HB2      LEU  94  12.007  10.953   8.302
    4    HB3  LEU  94           HB3      LEU  94  11.445  11.935   9.652
    5    HG   LEU  94           HG       LEU  94   9.972  12.015   7.018
    6   HD11  LEU  94          HD11      LEU  94  10.012   9.789   9.018
    7   HD13  LEU  94          HD12      LEU  94   9.717   9.736   7.282
    8   HD12  LEU  94          HD13      LEU  94   8.442  10.270   8.376
    9   HD23  LEU  94          HD21      LEU  94   8.053  12.442   8.611
   10   HD22  LEU  94          HD22      LEU  94   9.311  13.676   8.655
   11   HD21  LEU  94          HD23      LEU  94   9.224  12.458   9.927

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  95           H        ILE  95  14.422  11.942   7.803
    2    HA   ILE  95           HA       ILE  95  15.595  12.841  10.222
    3    HB   ILE  95           HB       ILE  95  16.827  11.757   7.677
    4   HG12  ILE  95          HG12      ILE  95  16.501  10.557  10.442
    5   HG13  ILE  95          HG13      ILE  95  15.336  10.319   9.141
    6   HG21  ILE  95          HG21      ILE  95  18.084  12.540  10.326
    7   HG23  ILE  95          HG22      ILE  95  18.561  13.063   8.709
    8   HG22  ILE  95          HG23      ILE  95  18.839  11.398   9.216
    9   HD13  ILE  95          HD11      ILE  95  16.801   9.019   7.882
   10   HD12  ILE  95          HD12      ILE  95  17.260   8.560   9.519
   11   HD11  ILE  95          HD13      ILE  95  18.235   9.726   8.626

  No H/Q in entry =          11
  In of MODEL   87
    1    H    GLU  96           H        GLU  96  15.781  14.078   6.891
    2    HA   GLU  96           HA       GLU  96  17.659  16.126   7.378
    3    HB2  GLU  96           HB2      GLU  96  16.993  15.478   5.115
    4    HB3  GLU  96           HB3      GLU  96  15.357  16.061   5.410
    5    HG2  GLU  96           HG2      GLU  96  15.959  18.182   4.874
    6    HG3  GLU  96           HG3      GLU  96  17.253  18.160   6.061

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LEU  97           H        LEU  97  14.143  15.994   7.794
    2    HA   LEU  97           HA       LEU  97  13.768  18.733   8.439
    3    HB2  LEU  97           HB2      LEU  97  12.208  16.230   9.043
    4    HB3  LEU  97           HB3      LEU  97  11.717  17.784   9.715
    5    HG   LEU  97           HG       LEU  97  12.204  17.365   6.752
    6   HD12  LEU  97          HD11      LEU  97   9.679  17.277   6.624
    7   HD11  LEU  97          HD12      LEU  97   9.663  17.075   8.374
    8   HD13  LEU  97          HD13      LEU  97  10.428  15.857   7.352
    9   HD23  LEU  97          HD21      LEU  97  10.497  19.357   6.781
   10   HD22  LEU  97          HD22      LEU  97  12.182  19.689   7.180
   11   HD21  LEU  97          HD23      LEU  97  10.986  19.535   8.466

  No H/Q in entry =          11
  In of MODEL   87
    1    H    HIS  98           H        HIS  98  14.537  15.891  10.433
    2    HA   HIS  98           HA       HIS  98  14.390  17.149  12.951
    3    HB2  HIS  98           HB2      HIS  98  16.108  14.866  11.951
    4    HB3  HIS  98           HB3      HIS  98  16.108  15.402  13.633
    5    HD1  HIS  98           HD1      HIS  98  13.893  13.812  11.030
    6    HD2  HIS  98           HD2      HIS  98  13.786  14.726  15.096
    7    HE1  HIS  98           HE1      HIS  98  11.846  12.648  11.973
    8    HE2  HIS  98           HE2      HIS  98  11.761  13.197  14.445

  No H/Q in entry =           8
  In of MODEL   87
    1    H    GLU  99           H        GLU  99  16.950  16.998  10.525
    2    HA   GLU  99           HA       GLU  99  18.951  18.295  12.064
    3    HB2  GLU  99           HB2      GLU  99  19.417  17.004   9.994
    4    HB3  GLU  99           HB3      GLU  99  18.631  18.273   9.052
    5    HG2  GLU  99           HG2      GLU  99  20.263  19.916   9.852
    6    HG3  GLU  99           HG3      GLU  99  21.019  18.700  10.876

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LYS 100           H        LYS 100  16.454  19.502   9.840
    2    HA   LYS 100           HA       LYS 100  17.295  22.226   9.992
    3    HB2  LYS 100           HB2      LYS 100  14.645  20.980   9.226
    4    HB3  LYS 100           HB3      LYS 100  14.972  22.714   9.139
    5    HG2  LYS 100           HG2      LYS 100  16.942  22.236   7.679
    6    HG3  LYS 100           HG3      LYS 100  16.501  20.526   7.692
    7    HD2  LYS 100           HD2      LYS 100  14.318  21.073   6.685
    8    HD3  LYS 100           HD3      LYS 100  14.742  22.785   6.679
    9    HE2  LYS 100           HE2      LYS 100  16.699  22.276   5.225
   10    HE3  LYS 100           HE3      LYS 100  16.206  20.579   5.187
   11    HZ1  LYS 100           HZ1      LYS 100  14.420  22.802   4.350
   12    HZ3  LYS 100           HZ2      LYS 100  14.209  21.136   4.084
   13    HZ2  LYS 100           HZ3      LYS 100  15.437  21.980   3.269

  No H/Q in entry =          13
  In of MODEL   87
    1    H    LEU 101           H        LEU 101  15.158  20.210  11.946
    2    HA   LEU 101           HA       LEU 101  14.020  22.294  13.524
    3    HB2  LEU 101           HB2      LEU 101  14.412  19.337  13.904
    4    HB3  LEU 101           HB3      LEU 101  13.887  20.323  15.265
    5    HG   LEU 101           HG       LEU 101  12.481  20.440  12.591
    6   HD12  LEU 101          HD11      LEU 101  10.791  18.901  13.851
    7   HD11  LEU 101          HD12      LEU 101  12.175  18.463  14.850
    8   HD13  LEU 101          HD13      LEU 101  12.210  18.160  13.112
    9   HD21  LEU 101          HD21      LEU 101  11.827  21.238  15.442
   10   HD23  LEU 101          HD22      LEU 101  10.566  21.036  14.227
   11   HD22  LEU 101          HD23      LEU 101  11.822  22.251  13.996

  No H/Q in entry =          11
  In of MODEL   87
    1    H    LYS 102           H        LYS 102  17.158  21.635  13.098
    2    HA   LYS 102           HA       LYS 102  19.015  22.474  14.178
    3    HB2  LYS 102           HB2      LYS 102  17.222  24.016  15.308
    4    HB3  LYS 102           HB3      LYS 102  17.407  22.948  16.684
    5    HG2  LYS 102           HG2      LYS 102  19.337  24.930  15.525
    6    HG3  LYS 102           HG3      LYS 102  18.944  24.618  17.202
    7    HD2  LYS 102           HD2      LYS 102  20.585  22.682  15.518
    8    HD3  LYS 102           HD3      LYS 102  21.293  23.990  16.456
    9    HE2  LYS 102           HE2      LYS 102  20.849  21.447  17.418
   10    HE3  LYS 102           HE3      LYS 102  21.088  22.883  18.413
   11    HZ2  LYS 102           HZ1      LYS 102  19.096  21.631  19.022
   12    HZ1  LYS 102           HZ2      LYS 102  18.461  21.874  17.471
   13    HZ3  LYS 102           HZ3      LYS 102  18.710  23.198  18.500

  No H/Q in entry =          13
  In of MODEL   87
    1    H    ALA 103           H        ALA 103  16.908  20.898  16.590
    2    HA   ALA 103           HA       ALA 103  18.609  19.656  18.248
    3    HB2  ALA 103           HB1      ALA 103  16.992  17.675  18.233
    4    HB1  ALA 103           HB2      ALA 103  16.115  18.546  16.974
    5    HB3  ALA 103           HB3      ALA 103  16.299  19.260  18.575

  No H/Q in entry =           5
  In of MODEL   87
    1    H1   ALA   1           H3       ALA   1  -1.624  -6.786 -21.495
    2    H2   ALA   1           H2       ALA   1  -2.444  -8.208 -21.048
    3    H3   ALA   1           H1       ALA   1  -0.835  -8.284 -21.597
    4    HA   ALA   1           HA       ALA   1  -1.670  -8.735 -23.597
    5    HB1  ALA   1           HB1      ALA   1  -3.821  -9.418 -23.133
    6    HB2  ALA   1           HB2      ALA   1  -4.231  -7.898 -23.929
    7    HB3  ALA   1           HB3      ALA   1  -4.178  -7.983 -22.170

  No H/Q in entry =           7
  In of MODEL   87
    1    H    GLU   2           H        GLU   2  -2.472  -7.527 -25.587
    2    HA   GLU   2           HA       GLU   2  -1.036  -5.536 -26.455
    3    HB2  GLU   2           HB2      GLU   2  -4.043  -5.550 -26.784
    4    HB3  GLU   2           HB3      GLU   2  -2.903  -4.705 -27.828
    5    HG2  GLU   2           HG2      GLU   2  -2.428  -6.600 -28.985
    6    HG3  GLU   2           HG3      GLU   2  -2.152  -7.514 -27.508

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLU   3           H        GLU   3  -4.178  -4.226 -25.564
    2    HA   GLU   3           HA       GLU   3  -3.090  -1.690 -24.927
    3    HB2  GLU   3           HB2      GLU   3  -5.801  -2.959 -24.607
    4    HB3  GLU   3           HB3      GLU   3  -5.478  -1.351 -23.956
    5    HG2  GLU   3           HG2      GLU   3  -5.098  -0.426 -26.079
    6    HG3  GLU   3           HG3      GLU   3  -4.727  -1.986 -26.806

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LEU   4           H        LEU   4  -4.729  -4.026 -22.758
    2    HA   LEU   4           HA       LEU   4  -4.352  -2.809 -20.363
    3    HB2  LEU   4           HB2      LEU   4  -3.858  -5.758 -20.837
    4    HB3  LEU   4           HB3      LEU   4  -4.257  -5.008 -19.293
    5    HG   LEU   4           HG       LEU   4  -6.021  -5.046 -21.764
    6   HD13  LEU   4          HD11      LEU   4  -7.247  -6.745 -20.774
    7   HD12  LEU   4          HD12      LEU   4  -6.761  -6.298 -19.140
    8   HD11  LEU   4          HD13      LEU   4  -5.636  -7.158 -20.189
    9   HD23  LEU   4          HD21      LEU   4  -7.699  -4.210 -19.900
   10   HD22  LEU   4          HD22      LEU   4  -6.637  -3.055 -20.705
   11   HD21  LEU   4          HD23      LEU   4  -6.227  -3.656 -19.099

  No H/Q in entry =          11
  In of MODEL   87
    1    H    GLU   5           H        GLU   5  -1.880  -4.691 -22.088
    2    HA   GLU   5           HA       GLU   5   0.101  -4.446 -20.044
    3    HB2  GLU   5           HB2      GLU   5   0.040  -5.355 -22.888
    4    HB3  GLU   5           HB3      GLU   5   1.606  -4.931 -22.195
    5    HG2  GLU   5           HG2      GLU   5  -0.190  -6.656 -20.555
    6    HG3  GLU   5           HG3      GLU   5   0.571  -7.396 -21.963

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLU   6           H        GLU   6  -0.493  -2.715 -23.087
    2    HA   GLU   6           HA       GLU   6   1.707  -0.922 -22.807
    3    HB2  GLU   6           HB2      GLU   6  -0.848  -0.765 -24.421
    4    HB3  GLU   6           HB3      GLU   6   0.451   0.423 -24.528
    5    HG2  GLU   6           HG2      GLU   6   0.793  -2.549 -25.011
    6    HG3  GLU   6           HG3      GLU   6   0.614  -1.346 -26.285

  No H/Q in entry =           6
  In of MODEL   87
    1    H    VAL   7           H        VAL   7  -1.636  -0.938 -21.775
    2    HA   VAL   7           HA       VAL   7  -1.814   1.776 -20.933
    3    HB   VAL   7           HB       VAL   7  -3.323  -0.718 -20.108
    4   HG11  VAL   7          HG11      VAL   7  -3.651   2.176 -19.289
    5   HG13  VAL   7          HG12      VAL   7  -3.580   0.747 -18.256
    6   HG12  VAL   7          HG13      VAL   7  -5.003   1.043 -19.253
    7   HG21  VAL   7          HG21      VAL   7  -3.452   0.367 -22.494
    8   HG23  VAL   7          HG22      VAL   7  -4.379   1.630 -21.683
    9   HG22  VAL   7          HG23      VAL   7  -4.953  -0.038 -21.662

  No H/Q in entry =           9
  In of MODEL   87
    1    H    VAL   8           H        VAL   8  -0.884  -1.229 -19.293
    2    HA   VAL   8           HA       VAL   8  -0.557  -0.161 -16.694
    3    HB   VAL   8           HB       VAL   8   0.810  -2.498 -18.050
    4   HG13  VAL   8          HG11      VAL   8   2.218  -1.819 -16.227
    5   HG12  VAL   8          HG12      VAL   8   1.271  -3.188 -15.644
    6   HG11  VAL   8          HG13      VAL   8   0.830  -1.547 -15.174
    7   HG23  VAL   8          HG21      VAL   8  -1.173  -2.903 -15.866
    8   HG22  VAL   8          HG22      VAL   8  -0.983  -3.772 -17.385
    9   HG21  VAL   8          HG23      VAL   8  -1.843  -2.237 -17.353

  No H/Q in entry =           9
  In of MODEL   87
    1    H    MET   9           H        MET   9   1.696  -0.494 -19.433
    2    HA   MET   9           HA       MET   9   3.996   0.505 -18.161
    3    HB2  MET   9           HB2      MET   9   3.060   0.561 -21.029
    4    HB3  MET   9           HB3      MET   9   4.589   1.291 -20.542
    5    HG2  MET   9           HG2      MET   9   5.295  -0.875 -19.563
    6    HG3  MET   9           HG3      MET   9   3.780  -1.600 -20.103
    7    HE2  MET   9           HE1      MET   9   7.537  -0.990 -21.272
    8    HE1  MET   9           HE2      MET   9   6.671   0.511 -20.957
    9    HE3  MET   9           HE3      MET   9   7.175   0.121 -22.598

  No H/Q in entry =           9
  In of MODEL   87
    1    H    GLY  10           H        GLY  10   1.347   2.159 -19.845
    2    HA3  GLY  10           HA2      GLY  10   2.356   4.794 -19.591
    3    HA2  GLY  10           HA3      GLY  10   0.660   4.365 -19.803

  No H/Q in entry =           3
  In of MODEL   87
    1    H    LEU  11           H        LEU  11   0.225   2.840 -17.522
    2    HA   LEU  11           HA       LEU  11  -0.276   4.822 -15.559
    3    HB2  LEU  11           HB2      LEU  11  -0.264   1.805 -15.410
    4    HB3  LEU  11           HB3      LEU  11  -0.759   2.834 -14.067
    5    HG   LEU  11           HG       LEU  11  -1.986   2.977 -16.834
    6   HD13  LEU  11          HD11      LEU  11  -2.612   0.843 -16.086
    7   HD12  LEU  11          HD12      LEU  11  -3.946   1.858 -15.542
    8   HD11  LEU  11          HD13      LEU  11  -2.702   1.352 -14.399
    9   HD22  LEU  11          HD21      LEU  11  -2.543   5.001 -15.824
   10   HD21  LEU  11          HD22      LEU  11  -2.486   4.329 -14.195
   11   HD23  LEU  11          HD23      LEU  11  -3.864   3.991 -15.242

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  12           H        ILE  12   2.222   2.310 -15.799
    2    HA   ILE  12           HA       ILE  12   3.429   2.819 -13.290
    3    HB   ILE  12           HB       ILE  12   4.664   1.757 -15.853
    4   HG12  ILE  12          HG12      ILE  12   2.639   0.556 -14.711
    5   HG13  ILE  12          HG13      ILE  12   4.029  -0.402 -15.176
    6   HG21  ILE  12          HG21      ILE  12   5.648   1.708 -12.982
    7   HG23  ILE  12          HG22      ILE  12   6.437   2.464 -14.366
    8   HG22  ILE  12          HG23      ILE  12   6.325   0.708 -14.266
    9   HD12  ILE  12          HD11      ILE  12   3.154  -0.917 -12.892
   10   HD11  ILE  12          HD12      ILE  12   3.549   0.732 -12.409
   11   HD13  ILE  12          HD13      ILE  12   4.823  -0.372 -12.878

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  13           H        ILE  13   4.064   4.079 -16.542
    2    HA   ILE  13           HA       ILE  13   6.230   5.757 -15.807
    3    HB   ILE  13           HB       ILE  13   4.209   5.875 -18.059
    4   HG12  ILE  13          HG12      ILE  13   6.027   4.013 -17.774
    5   HG13  ILE  13          HG13      ILE  13   5.789   4.754 -19.352
    6   HG21  ILE  13          HG21      ILE  13   6.499   7.715 -17.405
    7   HG23  ILE  13          HG22      ILE  13   4.889   8.121 -17.988
    8   HG22  ILE  13          HG23      ILE  13   6.072   7.421 -19.091
    9   HD13  ILE  13          HD11      ILE  13   7.730   6.184 -19.050
   10   HD12  ILE  13          HD12      ILE  13   8.207   4.539 -18.644
   11   HD11  ILE  13          HD13      ILE  13   7.871   5.696 -17.362

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ASN  14           H        ASN  14   2.734   6.318 -16.084
    2    HA   ASN  14           HA       ASN  14   2.741   9.062 -15.441
    3    HB2  ASN  14           HB2      ASN  14   0.820   7.458 -16.281
    4    HB3  ASN  14           HB3      ASN  14   0.490   7.281 -14.562
    5   HD21  ASN  14          HD21      ASN  14  -1.503   8.478 -15.998
    6   HD22  ASN  14          HD22      ASN  14  -1.536  10.151 -15.726

  No H/Q in entry =           6
  In of MODEL   87
    1    H    SER  15           H        SER  15   2.386   6.187 -13.372
    2    HA   SER  15           HA       SER  15   2.097   7.557 -10.921
    3    HB2  SER  15           HB2      SER  15   2.599   5.460  -9.875
    4    HB3  SER  15           HB3      SER  15   1.777   5.056 -11.379
    5    HG   SER  15           HG       SER  15   3.616   4.365 -12.228

  No H/Q in entry =           5
  In of MODEL   87
    1    H    GLY  16           H        GLY  16   4.958   6.412 -12.674
    2    HA3  GLY  16           HA2      GLY  16   6.890   7.129 -10.736
    3    HA2  GLY  16           HA3      GLY  16   7.195   6.925 -12.459

  No H/Q in entry =           3
  In of MODEL   87
    1    H    GLN  17           H        GLN  17   5.544   8.915 -13.522
    2    HA   GLN  17           HA       GLN  17   7.162  11.227 -13.204
    3    HB2  GLN  17           HB2      GLN  17   5.870  10.815 -15.257
    4    HB3  GLN  17           HB3      GLN  17   4.364  10.975 -14.352
    5    HG2  GLN  17           HG2      GLN  17   4.887  13.296 -13.813
    6    HG3  GLN  17           HG3      GLN  17   6.456  13.154 -14.606
    7   HE21  GLN  17          HE21      GLN  17   4.536  15.096 -15.470
    8   HE22  GLN  17          HE22      GLN  17   4.000  14.657 -17.020

  No H/Q in entry =           8
  In of MODEL   87
    1    H    ALA  18           H        ALA  18   4.040  10.261 -11.867
    2    HA   ALA  18           HA       ALA  18   3.353  12.659 -10.598
    3    HB1  ALA  18           HB1      ALA  18   2.182  10.223 -10.829
    4    HB2  ALA  18           HB2      ALA  18   1.651  11.450  -9.681
    5    HB3  ALA  18           HB3      ALA  18   2.717  10.148  -9.151

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ARG  19           H        ARG  19   5.175   9.861  -9.319
    2    HA   ARG  19           HA       ARG  19   5.720  11.004  -6.793
    3    HB2  ARG  19           HB2      ARG  19   6.094   8.596  -7.324
    4    HB3  ARG  19           HB3      ARG  19   7.461   9.061  -8.340
    5    HG2  ARG  19           HG2      ARG  19   8.593  10.077  -6.412
    6    HG3  ARG  19           HG3      ARG  19   7.207   9.710  -5.385
    7    HD2  ARG  19           HD2      ARG  19   8.940   8.044  -5.026
    8    HD3  ARG  19           HD3      ARG  19   7.555   7.287  -5.818
    9    HE   ARG  19           HE       ARG  19   9.280   8.082  -7.858
   10   HH21  ARG  19          HH11      ARG  19  10.819   6.652  -8.707
   11   HH22  ARG  19          HH12      ARG  19  11.338   5.293  -7.773
   12   HH11  ARG  19          HH21      ARG  19   9.309   6.044  -5.084
   13   HH12  ARG  19          HH22      ARG  19  10.480   4.949  -5.720

  No H/Q in entry =          13
  In of MODEL   87
    1    H    SER  20           H        SER  20   7.547  11.010  -9.836
    2    HA   SER  20           HA       SER  20   9.812  12.386  -9.002
    3    HB2  SER  20           HB2      SER  20   9.838  11.515 -11.208
    4    HB3  SER  20           HB3      SER  20   8.352  12.355 -11.638
    5    HG   SER  20           HG       SER  20  10.647  13.768 -10.812

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LEU  21           H        LEU  21   6.738  13.709 -10.206
    2    HA   LEU  21           HA       LEU  21   7.453  16.443  -9.973
    3    HB2  LEU  21           HB2      LEU  21   4.760  15.064  -9.902
    4    HB3  LEU  21           HB3      LEU  21   4.958  16.815  -9.907
    5    HG   LEU  21           HG       LEU  21   6.129  14.998 -12.034
    6   HD12  LEU  21          HD11      LEU  21   3.638  16.702 -12.271
    7   HD11  LEU  21          HD12      LEU  21   3.586  14.983 -11.875
    8   HD13  LEU  21          HD13      LEU  21   4.248  15.512 -13.421
    9   HD22  LEU  21          HD21      LEU  21   7.307  17.003 -12.230
   10   HD21  LEU  21          HD22      LEU  21   5.977  17.981 -11.616
   11   HD23  LEU  21          HD23      LEU  21   5.923  17.362 -13.259

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ALA  22           H        ALA  22   5.897  14.173  -7.735
    2    HA   ALA  22           HA       ALA  22   5.317  15.985  -5.666
    3    HB3  ALA  22           HB1      ALA  22   4.518  13.606  -5.836
    4    HB2  ALA  22           HB2      ALA  22   5.109  14.065  -4.239
    5    HB1  ALA  22           HB3      ALA  22   6.120  13.093  -5.309

  No H/Q in entry =           5
  In of MODEL   87
    1    H    TYR  23           H        TYR  23   8.220  13.915  -6.100
    2    HA   TYR  23           HA       TYR  23   9.611  14.907  -3.841
    3    HB2  TYR  23           HB2      TYR  23  10.370  12.890  -5.001
    4    HB3  TYR  23           HB3      TYR  23  10.702  13.826  -6.457
    5    HD1  TYR  23           HD1      TYR  23  11.647  13.478  -2.860
    6    HD2  TYR  23           HD2      TYR  23  12.761  14.955  -6.738
    7    HE1  TYR  23           HE1      TYR  23  13.911  14.019  -2.005
    8    HE2  TYR  23           HE2      TYR  23  15.024  15.497  -5.881
    9    HH   TYR  23           HH       TYR  23  16.161  14.368  -2.854

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ALA  24           H        ALA  24   9.456  16.024  -7.205
    2    HA   ALA  24           HA       ALA  24  11.382  18.080  -6.948
    3    HB2  ALA  24           HB1      ALA  24  10.947  18.154  -9.158
    4    HB3  ALA  24           HB2      ALA  24   9.402  18.926  -8.802
    5    HB1  ALA  24           HB3      ALA  24   9.502  17.171  -8.936

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ALA  25           H        ALA  25   7.899  17.946  -6.338
    2    HA   ALA  25           HA       ALA  25   7.457  20.670  -5.765
    3    HB1  ALA  25           HB1      ALA  25   5.768  18.696  -5.975
    4    HB2  ALA  25           HB2      ALA  25   5.415  19.987  -4.825
    5    HB3  ALA  25           HB3      ALA  25   6.081  18.455  -4.255

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LEU  26           H        LEU  26   8.480  17.970  -3.717
    2    HA   LEU  26           HA       LEU  26   8.598  19.395  -1.277
    3    HB2  LEU  26           HB2      LEU  26   8.659  16.977  -1.276
    4    HB3  LEU  26           HB3      LEU  26  10.132  16.966  -2.242
    5    HG   LEU  26           HG       LEU  26  11.357  18.063  -0.396
    6   HD12  LEU  26          HD11      LEU  26  10.124  18.083   1.860
    7   HD11  LEU  26          HD12      LEU  26   8.638  17.968   0.920
    8   HD13  LEU  26          HD13      LEU  26   9.703  19.360   0.718
    9   HD21  LEU  26          HD21      LEU  26   9.786  15.615   0.467
   10   HD23  LEU  26          HD22      LEU  26  11.308  16.154   1.170
   11   HD22  LEU  26          HD23      LEU  26  11.259  15.600  -0.501

  No H/Q in entry =          11
  In of MODEL   87
    1    H    LYS  27           H        LYS  27  11.014  18.793  -3.795
    2    HA   LYS  27           HA       LYS  27  13.212  20.001  -2.559
    3    HB2  LYS  27           HB2      LYS  27  13.301  18.657  -4.651
    4    HB3  LYS  27           HB3      LYS  27  12.557  20.001  -5.516
    5    HG2  LYS  27           HG2      LYS  27  14.441  21.460  -4.930
    6    HG3  LYS  27           HG3      LYS  27  15.180  20.156  -3.993
    7    HD2  LYS  27           HD2      LYS  27  15.311  18.770  -6.050
    8    HD3  LYS  27           HD3      LYS  27  14.617  20.100  -6.978
    9    HE2  LYS  27           HE2      LYS  27  16.522  21.539  -6.356
   10    HE3  LYS  27           HE3      LYS  27  17.220  20.213  -5.420
   11    HZ3  LYS  27           HZ1      LYS  27  18.218  20.304  -7.603
   12    HZ2  LYS  27           HZ2      LYS  27  16.692  20.208  -8.348
   13    HZ1  LYS  27           HZ3      LYS  27  17.295  18.887  -7.465

  No H/Q in entry =          13
  In of MODEL   87
    1    H    GLN  28           H        GLN  28  10.614  21.422  -4.512
    2    HA   GLN  28           HA       GLN  28  11.609  24.062  -4.657
    3    HB2  GLN  28           HB2      GLN  28   8.761  23.032  -4.553
    4    HB3  GLN  28           HB3      GLN  28   9.200  24.698  -4.929
    5    HG2  GLN  28           HG2      GLN  28  10.190  22.280  -6.467
    6    HG3  GLN  28           HG3      GLN  28   8.841  23.295  -6.971
    7   HE21  GLN  28          HE21      GLN  28   9.897  25.860  -6.277
    8   HE22  GLN  28          HE22      GLN  28  11.246  26.169  -7.262

  No H/Q in entry =           8
  In of MODEL   87
    1    H    ALA  29           H        ALA  29   9.648  22.391  -2.230
    2    HA   ALA  29           HA       ALA  29   9.123  24.587  -0.545
    3    HB2  ALA  29           HB1      ALA  29   8.368  23.025   1.018
    4    HB1  ALA  29           HB2      ALA  29   9.576  21.825   0.554
    5    HB3  ALA  29           HB3      ALA  29   8.197  22.139  -0.498

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LYS  30           H        LYS  30  11.823  22.284  -0.611
    2    HA   LYS  30           HA       LYS  30  13.147  23.216   1.697
    3    HB2  LYS  30           HB2      LYS  30  14.233  21.921  -0.813
    4    HB3  LYS  30           HB3      LYS  30  15.217  22.264   0.613
    5    HG2  LYS  30           HG2      LYS  30  13.641  20.899   1.985
    6    HG3  LYS  30           HG3      LYS  30  12.755  20.492   0.512
    7    HD2  LYS  30           HD2      LYS  30  14.790  19.481  -0.445
    8    HD3  LYS  30           HD3      LYS  30  15.695  19.902   1.010
    9    HE2  LYS  30           HE2      LYS  30  14.168  18.487   2.357
   10    HE3  LYS  30           HE3      LYS  30  13.292  18.046   0.886
   11    HZ2  LYS  30           HZ1      LYS  30  15.061  16.443   1.649
   12    HZ1  LYS  30           HZ2      LYS  30  16.215  17.616   1.203
   13    HZ3  LYS  30           HZ3      LYS  30  15.174  16.948   0.034

  No H/Q in entry =          13
  In of MODEL   87
    1    H    GLN  31           H        GLN  31  13.063  24.429  -1.597
    2    HA   GLN  31           HA       GLN  31  15.239  26.293  -1.166
    3    HB2  GLN  31           HB2      GLN  31  13.203  26.371  -3.396
    4    HB3  GLN  31           HB3      GLN  31  14.832  27.045  -3.391
    5    HG2  GLN  31           HG2      GLN  31  15.257  24.342  -2.820
    6    HG3  GLN  31           HG3      GLN  31  13.956  24.307  -4.002
    7   HE21  GLN  31          HE21      GLN  31  16.790  23.478  -4.400
    8   HE22  GLN  31          HE22      GLN  31  17.379  24.447  -5.662

  No H/Q in entry =           8
  In of MODEL   87
    1    H    GLY  32           H        GLY  32  12.159  26.148  -0.030
    2    HA3  GLY  32           HA2      GLY  32  11.020  27.729   1.243
    3    HA2  GLY  32           HA3      GLY  32  12.162  28.950   0.699

  No H/Q in entry =           3
  In of MODEL   87
    1    H    ASP  33           H        ASP  33  10.781  27.069  -1.801
    2    HA   ASP  33           HA       ASP  33   9.148  29.365  -2.657
    3    HB2  ASP  33           HB2      ASP  33  10.214  26.935  -4.101
    4    HB3  ASP  33           HB3      ASP  33   9.079  28.066  -4.832

  No H/Q in entry =           4
  In of MODEL   87
    1    H    PHE  34           H        PHE  34   7.449  28.908  -1.099
    2    HA   PHE  34           HA       PHE  34   6.038  26.453  -1.012
    3    HB2  PHE  34           HB2      PHE  34   5.111  29.252  -0.329
    4    HB3  PHE  34           HB3      PHE  34   4.242  27.771   0.077
    5    HD1  PHE  34           HD1      PHE  34   6.519  30.138   1.302
    6    HD2  PHE  34           HD2      PHE  34   5.784  25.906   1.238
    7    HE1  PHE  34           HE1      PHE  34   7.901  29.866   3.342
    8    HE2  PHE  34           HE2      PHE  34   7.168  25.638   3.276
    9    HZ   PHE  34           HZ       PHE  34   8.220  27.619   4.328

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ALA  35           H        ALA  35   5.650  29.327  -3.018
    2    HA   ALA  35           HA       ALA  35   3.094  28.747  -4.052
    3    HB1  ALA  35           HB1      ALA  35   4.169  30.130  -6.083
    4    HB3  ALA  35           HB2      ALA  35   5.388  30.473  -4.856
    5    HB2  ALA  35           HB3      ALA  35   3.702  30.903  -4.569

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ALA  36           H        ALA  36   6.317  28.035  -5.398
    2    HA   ALA  36           HA       ALA  36   5.316  26.623  -7.647
    3    HB3  ALA  36           HB1      ALA  36   7.479  26.721  -8.257
    4    HB2  ALA  36           HB2      ALA  36   7.943  25.684  -6.907
    5    HB1  ALA  36           HB3      ALA  36   7.859  27.433  -6.689

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ALA  37           H        ALA  37   6.250  25.610  -4.392
    2    HA   ALA  37           HA       ALA  37   6.158  22.824  -4.827
    3    HB2  ALA  37           HB1      ALA  37   5.913  24.614  -2.445
    4    HB1  ALA  37           HB2      ALA  37   7.030  23.282  -2.737
    5    HB3  ALA  37           HB3      ALA  37   5.363  22.949  -2.272

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LYS  38           H        LYS  38   3.649  25.062  -3.661
    2    HA   LYS  38           HA       LYS  38   1.527  23.275  -3.448
    3    HB2  LYS  38           HB2      LYS  38   1.913  26.026  -3.191
    4    HB3  LYS  38           HB3      LYS  38   0.715  25.897  -4.473
    5    HG2  LYS  38           HG2      LYS  38  -0.755  24.589  -3.037
    6    HG3  LYS  38           HG3      LYS  38   0.485  24.511  -1.778
    7    HD2  LYS  38           HD2      LYS  38   0.327  26.848  -1.326
    8    HD3  LYS  38           HD3      LYS  38  -0.577  27.152  -2.810
    9    HE2  LYS  38           HE2      LYS  38  -2.085  27.201  -0.875
   10    HE3  LYS  38           HE3      LYS  38  -2.474  25.832  -1.921
   11    HZ3  LYS  38           HZ1      LYS  38  -1.771  24.349  -0.389
   12    HZ2  LYS  38           HZ2      LYS  38  -2.109  25.608   0.702
   13    HZ1  LYS  38           HZ3      LYS  38  -0.516  25.338   0.181

  No H/Q in entry =          13
  In of MODEL   87
    1    H    ALA  39           H        ALA  39   2.538  25.171  -6.290
    2    HA   ALA  39           HA       ALA  39   0.457  24.333  -8.001
    3    HB2  ALA  39           HB1      ALA  39   3.204  24.949  -9.045
    4    HB1  ALA  39           HB2      ALA  39   2.251  26.220  -8.280
    5    HB3  ALA  39           HB3      ALA  39   1.632  25.394  -9.710

  No H/Q in entry =           5
  In of MODEL   87
    1    H    MET  40           H        MET  40   3.676  22.992  -7.415
    2    HA   MET  40           HA       MET  40   3.559  20.977  -9.410
    3    HB2  MET  40           HB2      MET  40   5.166  21.176  -6.857
    4    HB3  MET  40           HB3      MET  40   5.404  19.919  -8.073
    5    HG2  MET  40           HG2      MET  40   5.501  22.875  -8.733
    6    HG3  MET  40           HG3      MET  40   6.934  21.954  -8.281
    7    HE3  MET  40           HE1      MET  40   7.786  19.733 -11.092
    8    HE2  MET  40           HE2      MET  40   7.214  19.418  -9.456
    9    HE1  MET  40           HE3      MET  40   8.327  20.752  -9.750

  No H/Q in entry =           9
  In of MODEL   87
    1    H    MET  41           H        MET  41   2.635  21.024  -5.989
    2    HA   MET  41           HA       MET  41   2.067  18.266  -5.718
    3    HB2  MET  41           HB2      MET  41   0.760  20.637  -4.366
    4    HB3  MET  41           HB3      MET  41   0.582  18.960  -3.862
    5    HG2  MET  41           HG2      MET  41   3.295  19.150  -3.891
    6    HG3  MET  41           HG3      MET  41   2.874  20.813  -3.493
    7    HE2  MET  41           HE1      MET  41  -0.186  19.594  -1.779
    8    HE1  MET  41           HE2      MET  41   0.651  21.098  -2.151
    9    HE3  MET  41           HE3      MET  41   0.580  20.525  -0.484

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ASP  42           H        ASP  42   0.065  21.017  -6.692
    2    HA   ASP  42           HA       ASP  42  -2.392  19.687  -6.839
    3    HB2  ASP  42           HB2      ASP  42  -1.653  22.249  -7.088
    4    HB3  ASP  42           HB3      ASP  42  -1.804  21.860  -8.798

  No H/Q in entry =           4
  In of MODEL   87
    1    H    GLN  43           H        GLN  43   0.063  20.253  -9.333
    2    HA   GLN  43           HA       GLN  43  -1.334  18.955 -11.429
    3    HB2  GLN  43           HB2      GLN  43   1.629  19.434 -11.037
    4    HB3  GLN  43           HB3      GLN  43   0.912  18.806 -12.523
    5    HG2  GLN  43           HG2      GLN  43  -0.575  20.852 -12.565
    6    HG3  GLN  43           HG3      GLN  43   0.382  21.493 -11.233
    7   HE21  GLN  43          HE21      GLN  43   0.569  23.116 -13.315
    8   HE22  GLN  43          HE22      GLN  43   1.984  22.879 -14.219

  No H/Q in entry =           8
  In of MODEL   87
    1    H    SER  44           H        SER  44   0.996  17.782  -9.034
    2    HA   SER  44           HA       SER  44   1.302  15.173 -10.063
    3    HB2  SER  44           HB2      SER  44   2.208  16.597  -7.821
    4    HB3  SER  44           HB3      SER  44   1.327  15.222  -7.156
    5    HG   SER  44           HG       SER  44   3.432  14.578  -7.578

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ARG  45           H        ARG  45  -1.008  16.515  -7.729
    2    HA   ARG  45           HA       ARG  45  -2.424  14.169  -7.103
    3    HB2  ARG  45           HB2      ARG  45  -2.600  16.337  -5.907
    4    HB3  ARG  45           HB3      ARG  45  -3.445  17.017  -7.295
    5    HG2  ARG  45           HG2      ARG  45  -5.232  15.312  -7.020
    6    HG3  ARG  45           HG3      ARG  45  -4.399  14.687  -5.596
    7    HD2  ARG  45           HD2      ARG  45  -4.582  16.954  -4.536
    8    HD3  ARG  45           HD3      ARG  45  -5.558  17.488  -5.920
    9    HE   ARG  45           HE       ARG  45  -6.699  15.123  -4.888
   10   HH21  ARG  45          HH11      ARG  45  -8.538  15.217  -3.622
   11   HH22  ARG  45          HH12      ARG  45  -8.918  16.660  -2.752
   12   HH11  ARG  45          HH21      ARG  45  -6.119  18.361  -3.856
   13   HH12  ARG  45          HH22      ARG  45  -7.543  18.440  -2.882

  No H/Q in entry =          13
  In of MODEL   87
    1    H    MET  46           H        MET  46  -2.973  16.585  -9.650
    2    HA   MET  46           HA       MET  46  -5.323  15.442 -10.721
    3    HB2  MET  46           HB2      MET  46  -3.197  17.248 -11.884
    4    HB3  MET  46           HB3      MET  46  -4.580  16.707 -12.841
    5    HG2  MET  46           HG2      MET  46  -6.124  17.653 -11.195
    6    HG3  MET  46           HG3      MET  46  -4.777  18.131 -10.169
    7    HE2  MET  46           HE1      MET  46  -6.390  19.848 -13.998
    8    HE1  MET  46           HE2      MET  46  -6.472  18.197 -13.390
    9    HE3  MET  46           HE3      MET  46  -5.088  18.706 -14.356

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ALA  47           H        ALA  47  -1.898  14.925 -11.470
    2    HA   ALA  47           HA       ALA  47  -2.256  13.206 -13.685
    3    HB3  ALA  47           HB1      ALA  47  -0.069  14.070 -13.325
    4    HB2  ALA  47           HB2      ALA  47   0.051  12.340 -12.994
    5    HB1  ALA  47           HB3      ALA  47  -0.033  13.490 -11.659

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LEU  48           H        LEU  48  -2.004  12.560 -10.211
    2    HA   LEU  48           HA       LEU  48  -2.130   9.722 -10.376
    3    HB2  LEU  48           HB2      LEU  48  -2.879  11.644  -8.160
    4    HB3  LEU  48           HB3      LEU  48  -2.805   9.892  -7.963
    5    HG   LEU  48           HG       LEU  48  -0.484  11.568  -8.950
    6   HD13  LEU  48          HD11      LEU  48  -0.765  12.337  -6.759
    7   HD12  LEU  48          HD12      LEU  48   0.383  11.016  -6.559
    8   HD11  LEU  48          HD13      LEU  48  -1.319  10.772  -6.167
    9   HD22  LEU  48          HD21      LEU  48  -0.008   9.378  -9.594
   10   HD21  LEU  48          HD22      LEU  48  -0.890   8.670  -8.241
   11   HD23  LEU  48          HD23      LEU  48   0.690   9.405  -7.975

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ASN  49           H        ASN  49  -4.566  12.241  -9.976
    2    HA   ASN  49           HA       ASN  49  -6.772  10.600  -9.447
    3    HB2  ASN  49           HB2      ASN  49  -6.827  13.011  -9.108
    4    HB3  ASN  49           HB3      ASN  49  -6.613  13.293 -10.831
    5   HD21  ASN  49          HD21      ASN  49  -8.924  12.430  -8.349
    6   HD22  ASN  49          HD22      ASN  49 -10.292  12.439  -9.353

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLU  50           H        GLU  50  -5.470  11.788 -12.528
    2    HA   GLU  50           HA       GLU  50  -7.433  10.558 -14.182
    3    HB2  GLU  50           HB2      GLU  50  -5.944  12.362 -14.988
    4    HB3  GLU  50           HB3      GLU  50  -4.563  11.274 -14.848
    5    HG2  GLU  50           HG2      GLU  50  -5.549   9.753 -16.491
    6    HG3  GLU  50           HG3      GLU  50  -6.998  10.748 -16.581

  No H/Q in entry =           6
  In of MODEL   87
    1    H    ALA  51           H        ALA  51  -4.278   9.528 -12.969
    2    HA   ALA  51           HA       ALA  51  -4.161   7.076 -14.391
    3    HB2  ALA  51           HB1      ALA  51  -2.187   6.764 -13.285
    4    HB1  ALA  51           HB2      ALA  51  -2.875   7.191 -11.719
    5    HB3  ALA  51           HB3      ALA  51  -2.402   8.459 -12.850

  No H/Q in entry =           5
  In of MODEL   87
    1    H    HIS  52           H        HIS  52  -5.335   7.915 -11.144
    2    HA   HIS  52           HA       HIS  52  -6.052   5.312 -10.320
    3    HB2  HIS  52           HB2      HIS  52  -5.895   7.282  -8.812
    4    HB3  HIS  52           HB3      HIS  52  -7.357   7.933  -9.553
    5    HD1  HIS  52           HD1      HIS  52  -9.602   6.698  -9.071
    6    HD2  HIS  52           HD2      HIS  52  -6.325   5.089  -7.060
    7    HE1  HIS  52           HE1      HIS  52 -10.538   5.130  -7.316
    8    HE2  HIS  52           HE2      HIS  52  -8.552   4.140  -6.080

  No H/Q in entry =           8
  In of MODEL   87
    1    H    LEU  53           H        LEU  53  -7.838   7.794 -12.109
    2    HA   LEU  53           HA       LEU  53 -10.359   6.531 -12.132
    3    HB2  LEU  53           HB2      LEU  53  -9.047   8.498 -13.997
    4    HB3  LEU  53           HB3      LEU  53 -10.654   7.855 -14.320
    5    HG   LEU  53           HG       LEU  53  -9.925   9.155 -11.676
    6   HD12  LEU  53          HD11      LEU  53 -11.219  11.132 -12.643
    7   HD11  LEU  53          HD12      LEU  53 -11.022  10.368 -14.221
    8   HD13  LEU  53          HD13      LEU  53  -9.608  10.879 -13.304
    9   HD23  LEU  53          HD21      LEU  53 -12.507   9.585 -11.827
   10   HD22  LEU  53          HD22      LEU  53 -11.940   7.983 -11.366
   11   HD21  LEU  53          HD23      LEU  53 -12.496   8.277 -13.002

  No H/Q in entry =          11
  In of MODEL   87
    1    H    VAL  54           H        VAL  54  -7.603   6.306 -14.360
    2    HA   VAL  54           HA       VAL  54  -8.841   4.553 -16.211
    3    HB   VAL  54           HB       VAL  54  -5.930   5.024 -15.518
    4   HG12  VAL  54          HG11      VAL  54  -5.687   3.940 -17.908
    5   HG11  VAL  54          HG12      VAL  54  -7.226   3.177 -17.512
    6   HG13  VAL  54          HG13      VAL  54  -5.817   2.904 -16.489
    7   HG22  VAL  54          HG21      VAL  54  -6.673   6.978 -16.562
    8   HG21  VAL  54          HG22      VAL  54  -7.873   6.131 -17.535
    9   HG23  VAL  54          HG23      VAL  54  -6.166   6.031 -17.960

  No H/Q in entry =           9
  In of MODEL   87
    1    H    GLN  55           H        GLN  55  -6.858   3.977 -13.306
    2    HA   GLN  55           HA       GLN  55  -6.801   1.160 -13.567
    3    HB2  GLN  55           HB2      GLN  55  -5.240   2.034 -12.042
    4    HB3  GLN  55           HB3      GLN  55  -6.448   3.014 -11.214
    5    HG2  GLN  55           HG2      GLN  55  -7.162   1.262  -9.902
    6    HG3  GLN  55           HG3      GLN  55  -6.947   0.075 -11.182
    7   HE21  GLN  55          HE21      GLN  55  -5.343  -1.395 -10.685
    8   HE22  GLN  55          HE22      GLN  55  -3.957  -1.062  -9.768

  No H/Q in entry =           8
  In of MODEL   87
    1    H    THR  56           H        THR  56  -9.112   3.348 -11.957
    2    HA   THR  56           HA       THR  56 -10.723   1.482 -10.676
    3    HB   THR  56           HB       THR  56 -11.780   3.887 -12.181
    4    HG1  THR  56           HG1      THR  56 -10.128   3.658  -9.989
    5   HG22  THR  56          HG21      THR  56 -12.703   2.787  -9.534
    6   HG21  THR  56          HG22      THR  56 -13.317   2.134 -11.054
    7   HG23  THR  56          HG23      THR  56 -13.574   3.833 -10.654

  No H/Q in entry =           7
  In of MODEL   87
    1    H    LYS  57           H        LYS  57 -10.900   2.573 -14.061
    2    HA   LYS  57           HA       LYS  57 -13.074   0.914 -14.825
    3    HB2  LYS  57           HB2      LYS  57 -12.167   2.858 -16.134
    4    HB3  LYS  57           HB3      LYS  57 -10.741   1.898 -16.501
    5    HG2  LYS  57           HG2      LYS  57 -12.102   0.253 -17.684
    6    HG3  LYS  57           HG3      LYS  57 -13.573   1.120 -17.254
    7    HD2  LYS  57           HD2      LYS  57 -12.773   3.090 -18.534
    8    HD3  LYS  57           HD3      LYS  57 -11.327   2.195 -18.994
    9    HE2  LYS  57           HE2      LYS  57 -14.178   1.368 -19.653
   10    HE3  LYS  57           HE3      LYS  57 -13.054   2.109 -20.791
   11    HZ2  LYS  57           HZ1      LYS  57 -13.132  -0.597 -19.761
   12    HZ1  LYS  57           HZ2      LYS  57 -11.584   0.092 -19.876
   13    HZ3  LYS  57           HZ3      LYS  57 -12.573  -0.016 -21.253

  No H/Q in entry =          13
  In of MODEL   87
    1    H    LEU  58           H        LEU  58  -9.576   0.440 -14.756
    2    HA   LEU  58           HA       LEU  58  -9.610  -2.075 -16.050
    3    HB2  LEU  58           HB2      LEU  58  -7.566  -0.811 -14.232
    4    HB3  LEU  58           HB3      LEU  58  -7.321  -2.334 -15.088
    5    HG   LEU  58           HG       LEU  58  -8.038   0.281 -16.449
    6   HD11  LEU  58          HD11      LEU  58  -5.410  -0.989 -15.751
    7   HD13  LEU  58          HD12      LEU  58  -5.884   0.708 -15.701
    8   HD12  LEU  58          HD13      LEU  58  -5.549  -0.065 -17.247
    9   HD22  LEU  58          HD21      LEU  58  -8.627  -1.271 -18.045
   10   HD21  LEU  58          HD22      LEU  58  -7.604  -2.532 -17.362
   11   HD23  LEU  58          HD23      LEU  58  -6.894  -1.266 -18.362

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  59           H        ILE  59 -10.432  -1.167 -12.800
    2    HA   ILE  59           HA       ILE  59 -10.118  -3.940 -11.856
    3    HB   ILE  59           HB       ILE  59  -9.650  -1.682 -10.451
    4   HG12  ILE  59          HG12      ILE  59 -11.060  -4.011  -9.131
    5   HG13  ILE  59          HG13      ILE  59  -9.419  -4.121  -9.716
    6   HG21  ILE  59          HG21      ILE  59 -12.177  -1.130 -10.716
    7   HG23  ILE  59          HG22      ILE  59 -11.469  -0.968  -9.125
    8   HG22  ILE  59          HG23      ILE  59 -12.435  -2.386  -9.526
    9   HD13  ILE  59          HD11      ILE  59  -8.754  -2.236  -8.303
   10   HD12  ILE  59          HD12      ILE  59  -9.450  -3.524  -7.329
   11   HD11  ILE  59          HD13      ILE  59 -10.406  -2.093  -7.711

  No H/Q in entry =          11
  In of MODEL   87
    1    H    GLU  60           H        GLU  60 -12.645  -1.593 -12.670
    2    HA   GLU  60           HA       GLU  60 -14.851  -3.084 -11.667
    3    HB2  GLU  60           HB2      GLU  60 -15.075  -0.725 -12.239
    4    HB3  GLU  60           HB3      GLU  60 -14.679  -1.063 -13.920
    5    HG2  GLU  60           HG2      GLU  60 -16.707  -2.504 -14.080
    6    HG3  GLU  60           HG3      GLU  60 -17.121  -2.062 -12.437

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLY  61           H        GLY  61 -13.166  -3.084 -14.776
    2    HA3  GLY  61           HA2      GLY  61 -14.903  -5.307 -15.676
    3    HA2  GLY  61           HA3      GLY  61 -14.041  -4.211 -16.749

  No H/Q in entry =           3
  In of MODEL   87
    1    H    ASP  62           H        ASP  62 -12.698  -5.685 -13.862
    2    HA   ASP  62           HA       ASP  62 -10.381  -6.585 -15.224
    3    HB2  ASP  62           HB2      ASP  62  -9.818  -7.608 -13.053
    4    HB3  ASP  62           HB3      ASP  62 -10.382  -5.953 -12.856

  No H/Q in entry =           4
  In of MODEL   87
    1    H    ALA  63           H        ALA  63 -11.629  -7.841 -16.970
    2    HA   ALA  63           HA       ALA  63 -12.893 -10.332 -16.376
    3    HB3  ALA  63           HB1      ALA  63 -11.382  -9.563 -18.898
    4    HB1  ALA  63           HB2      ALA  63 -13.036  -9.055 -18.561
    5    HB2  ALA  63           HB3      ALA  63 -12.662 -10.768 -18.759

  No H/Q in entry =           5
  In of MODEL   87
    1    H    GLY  64           H        GLY  64  -9.583  -9.376 -17.067
    2    HA3  GLY  64           HA2      GLY  64  -7.572 -10.426 -16.729
    3    HA2  GLY  64           HA3      GLY  64  -8.420 -11.572 -15.699

  No H/Q in entry =           3
  In of MODEL   87
    1    H    GLU  65           H        GLU  65  -6.682 -12.953 -16.849
    2    HA   GLU  65           HA       GLU  65  -6.982 -13.609 -19.572
    3    HB2  GLU  65           HB2      GLU  65  -5.792 -15.196 -17.297
    4    HB3  GLU  65           HB3      GLU  65  -5.665 -15.648 -18.998
    5    HG2  GLU  65           HG2      GLU  65  -4.747 -12.990 -17.868
    6    HG3  GLU  65           HG3      GLU  65  -3.683 -14.361 -18.173

  No H/Q in entry =           6
  In of MODEL   87
    1    H    GLY  66           H        GLY  66  -8.346 -15.006 -16.686
    2    HA3  GLY  66           HA2      GLY  66 -10.041 -16.814 -18.278
    3    HA2  GLY  66           HA3      GLY  66  -9.553 -17.110 -16.621

  No H/Q in entry =           3
  In of MODEL   87
    1    H    LYS  67           H        LYS  67 -12.013 -17.491 -16.776
    2    HA   LYS  67           HA       LYS  67 -13.808 -15.340 -16.896
    3    HB2  LYS  67           HB2      LYS  67 -13.942 -18.144 -15.872
    4    HB3  LYS  67           HB3      LYS  67 -15.293 -17.039 -15.589
    5    HG2  LYS  67           HG2      LYS  67 -15.329 -18.419 -17.780
    6    HG3  LYS  67           HG3      LYS  67 -15.655 -16.691 -17.896
    7    HD2  LYS  67           HD2      LYS  67 -13.463 -16.229 -18.709
    8    HD3  LYS  67           HD3      LYS  67 -12.881 -17.836 -18.262
    9    HE2  LYS  67           HE2      LYS  67 -14.036 -18.887 -20.016
   10    HE3  LYS  67           HE3      LYS  67 -15.163 -17.543 -20.203
   11    HZ3  LYS  67           HZ1      LYS  67 -13.721 -17.301 -21.980
   12    HZ2  LYS  67           HZ2      LYS  67 -12.352 -17.731 -21.073
   13    HZ1  LYS  67           HZ3      LYS  67 -13.087 -16.217 -20.840

  No H/Q in entry =          13
  In of MODEL   87
    1    H    MET  68           H        MET  68 -13.311 -17.219 -13.976
    2    HA   MET  68           HA       MET  68 -14.271 -15.282 -12.185
    3    HB2  MET  68           HB2      MET  68 -12.511 -17.687 -11.704
    4    HB3  MET  68           HB3      MET  68 -13.339 -16.772 -10.444
    5    HG2  MET  68           HG2      MET  68 -14.727 -18.119 -12.778
    6    HG3  MET  68           HG3      MET  68 -14.612 -18.799 -11.154
    7    HE1  MET  68           HE1      MET  68 -15.236 -17.835  -9.176
    8    HE3  MET  68           HE2      MET  68 -16.670 -16.849  -8.894
    9    HE2  MET  68           HE3      MET  68 -15.117 -16.069  -9.190

  No H/Q in entry =           9
  In of MODEL   87
    1    H    LYS  69           H        LYS  69 -10.898 -16.040 -13.108
    2    HA   LYS  69           HA       LYS  69  -9.735 -14.401 -11.105
    3    HB2  LYS  69           HB2      LYS  69  -8.629 -15.604 -13.639
    4    HB3  LYS  69           HB3      LYS  69  -7.637 -14.699 -12.493
    5    HG2  LYS  69           HG2      LYS  69  -8.311 -16.245 -10.686
    6    HG3  LYS  69           HG3      LYS  69  -9.300 -17.149 -11.831
    7    HD2  LYS  69           HD2      LYS  69  -7.319 -17.739 -13.132
    8    HD3  LYS  69           HD3      LYS  69  -6.303 -16.761 -12.073
    9    HE2  LYS  69           HE2      LYS  69  -6.160 -19.128 -11.429
   10    HE3  LYS  69           HE3      LYS  69  -6.942 -18.195 -10.155
   11    HZ2  LYS  69           HZ1      LYS  69  -8.331 -19.798 -12.234
   12    HZ1  LYS  69           HZ2      LYS  69  -9.090 -18.889 -11.018
   13    HZ3  LYS  69           HZ3      LYS  69  -8.142 -20.238 -10.608

  No H/Q in entry =          13
  In of MODEL   87
    1    H    VAL  70           H        VAL  70  -7.876 -12.772 -11.938
    2    HA   VAL  70           HA       VAL  70  -9.143 -10.748 -13.693
    3    HB   VAL  70           HB       VAL  70  -8.300  -9.016 -12.144
    4   HG13  VAL  70          HG11      VAL  70 -10.598  -9.699 -11.868
    5   HG12  VAL  70          HG12      VAL  70  -9.900  -9.551 -10.254
    6   HG11  VAL  70          HG13      VAL  70 -10.114 -11.144 -10.981
    7   HG22  VAL  70          HG21      VAL  70  -6.434 -10.057 -11.069
    8   HG21  VAL  70          HG22      VAL  70  -7.402 -11.447 -10.584
    9   HG23  VAL  70          HG23      VAL  70  -7.643  -9.888  -9.796

  No H/Q in entry =           9
  In of MODEL   87
    1    H    SER  71           H        SER  71  -7.552  -9.134 -14.472
    2    HA   SER  71           HA       SER  71  -5.324 -10.338 -15.729
    3    HB2  SER  71           HB2      SER  71  -6.488  -8.286 -16.558
    4    HB3  SER  71           HB3      SER  71  -5.800  -7.392 -15.206
    5    HG   SER  71           HG       SER  71  -3.720  -8.302 -16.055

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LEU  72           H        LEU  72  -3.298 -10.635 -15.083
    2    HA   LEU  72           HA       LEU  72  -2.586 -10.433 -12.368
    3    HB2  LEU  72           HB2      LEU  72  -0.925 -10.877 -14.845
    4    HB3  LEU  72           HB3      LEU  72  -0.275 -10.966 -13.211
    5    HG   LEU  72           HG       LEU  72  -2.647 -12.619 -14.131
    6   HD12  LEU  72          HD11      LEU  72  -0.911 -14.492 -14.164
    7   HD11  LEU  72          HD12      LEU  72   0.316 -13.227 -14.144
    8   HD13  LEU  72          HD13      LEU  72  -0.815 -13.334 -15.492
    9   HD22  LEU  72          HD21      LEU  72  -2.653 -12.648 -11.782
   10   HD21  LEU  72          HD22      LEU  72  -0.904 -12.543 -11.665
   11   HD23  LEU  72          HD23      LEU  72  -1.663 -14.054 -12.159

  No H/Q in entry =          11
  In of MODEL   87
    1    H    VAL  73           H        VAL  73  -1.833  -8.423 -15.144
    2    HA   VAL  73           HA       VAL  73   0.105  -6.750 -14.031
    3    HB   VAL  73           HB       VAL  73  -0.269  -5.321 -15.887
    4   HG12  VAL  73          HG11      VAL  73  -1.097  -8.098 -16.773
    5   HG11  VAL  73          HG12      VAL  73   0.558  -7.652 -16.361
    6   HG13  VAL  73          HG13      VAL  73  -0.246  -6.886 -17.729
    7   HG22  VAL  73          HG21      VAL  73  -2.537  -4.787 -15.920
    8   HG21  VAL  73          HG22      VAL  73  -3.038  -6.468 -15.752
    9   HG23  VAL  73          HG23      VAL  73  -2.430  -5.880 -17.300

  No H/Q in entry =           9
  In of MODEL   87
    1    H    LEU  74           H        LEU  74  -3.296  -6.823 -13.487
    2    HA   LEU  74           HA       LEU  74  -3.882  -4.159 -12.874
    3    HB2  LEU  74           HB2      LEU  74  -5.632  -5.801 -13.055
    4    HB3  LEU  74           HB3      LEU  74  -4.958  -6.737 -11.724
    5    HG   LEU  74           HG       LEU  74  -5.402  -4.861 -10.177
    6   HD12  LEU  74          HD11      LEU  74  -6.969  -3.053 -11.148
    7   HD11  LEU  74          HD12      LEU  74  -6.383  -3.571 -12.727
    8   HD13  LEU  74          HD13      LEU  74  -5.254  -2.920 -11.537
    9   HD21  LEU  74          HD21      LEU  74  -7.130  -6.673 -11.067
   10   HD23  LEU  74          HD22      LEU  74  -7.937  -5.229 -11.638
   11   HD22  LEU  74          HD23      LEU  74  -7.610  -5.416  -9.932

  No H/Q in entry =          11
  In of MODEL   87
    1    H    VAL  75           H        VAL  75  -2.883  -6.762 -10.711
    2    HA   VAL  75           HA       VAL  75  -2.673  -5.216  -8.365
    3    HB   VAL  75           HB       VAL  75  -1.206  -7.729  -9.152
    4   HG11  VAL  75          HG11      VAL  75  -1.393  -6.240  -6.495
    5   HG13  VAL  75          HG12      VAL  75   0.065  -6.558  -7.423
    6   HG12  VAL  75          HG13      VAL  75  -0.795  -7.887  -6.666
    7   HG22  VAL  75          HG21      VAL  75  -3.621  -8.011  -8.991
    8   HG21  VAL  75          HG22      VAL  75  -3.662  -7.124  -7.467
    9   HG23  VAL  75          HG23      VAL  75  -2.888  -8.707  -7.546

  No H/Q in entry =           9
  In of MODEL   87
    1    H    GLU  76           H        GLU  76  -0.265  -6.005 -10.892
    2    HA   GLU  76           HA       GLU  76   1.934  -4.687  -9.725
    3    HB2  GLU  76           HB2      GLU  76   2.065  -6.176 -11.734
    4    HB3  GLU  76           HB3      GLU  76   1.261  -4.933 -12.679
    5    HG2  GLU  76           HG2      GLU  76   3.127  -3.382 -12.273
    6    HG3  GLU  76           HG3      GLU  76   3.946  -4.578 -11.287

  No H/Q in entry =           6
  In of MODEL   87
    1    H    ALA  77           H        ALA  77  -0.574  -3.451 -11.922
    2    HA   ALA  77           HA       ALA  77   0.451  -0.818 -12.091
    3    HB1  ALA  77           HB1      ALA  77  -1.199  -1.609 -13.686
    4    HB2  ALA  77           HB2      ALA  77  -1.866  -0.224 -12.820
    5    HB3  ALA  77           HB3      ALA  77  -2.379  -1.857 -12.397

  No H/Q in entry =           5
  In of MODEL   87
    1    H    GLN  78           H        GLN  78  -1.846  -2.346  -9.891
    2    HA   GLN  78           HA       GLN  78  -2.629  -0.019  -8.490
    3    HB2  GLN  78           HB2      GLN  78  -3.723  -2.317  -8.434
    4    HB3  GLN  78           HB3      GLN  78  -2.432  -2.811  -7.340
    5    HG2  GLN  78           HG2      GLN  78  -3.074  -1.116  -5.734
    6    HG3  GLN  78           HG3      GLN  78  -4.266  -0.452  -6.848
    7   HE21  GLN  78          HE21      GLN  78  -3.492  -3.780  -5.644
    8   HE22  GLN  78          HE22      GLN  78  -5.103  -4.163  -5.271

  No H/Q in entry =           8
  In of MODEL   87
    1    H    LEU  79           H        LEU  79   0.020  -2.309  -8.032
    2    HA   LEU  79           HA       LEU  79   0.997  -1.427  -5.570
    3    HB2  LEU  79           HB2      LEU  79   1.846  -3.445  -6.636
    4    HB3  LEU  79           HB3      LEU  79   2.509  -2.500  -7.966
    5    HG   LEU  79           HG       LEU  79   4.073  -1.381  -6.454
    6   HD13  LEU  79          HD11      LEU  79   3.063  -1.126  -4.391
    7   HD12  LEU  79          HD12      LEU  79   4.123  -2.489  -4.044
    8   HD11  LEU  79          HD13      LEU  79   2.416  -2.767  -4.381
    9   HD23  LEU  79          HD21      LEU  79   5.254  -3.545  -5.549
   10   HD22  LEU  79          HD22      LEU  79   5.060  -3.342  -7.287
   11   HD21  LEU  79          HD23      LEU  79   3.965  -4.399  -6.401

  No H/Q in entry =          11
  In of MODEL   87
    1    H    HIS  80           H        HIS  80   1.894  -0.317  -8.838
    2    HA   HIS  80           HA       HIS  80   3.721   1.648  -7.906
    3    HB2  HIS  80           HB2      HIS  80   2.434   0.972 -10.495
    4    HB3  HIS  80           HB3      HIS  80   3.048   2.616 -10.320
    5    HD1  HIS  80           HD1      HIS  80   5.455   2.889 -10.831
    6    HD2  HIS  80           HD2      HIS  80   4.585  -1.013  -9.648
    7    HE1  HIS  80           HE1      HIS  80   7.630   1.587 -10.989
    8    HE2  HIS  80           HE2      HIS  80   7.111  -0.795 -10.271

  No H/Q in entry =           8
  In of MODEL   87
    1    H    LEU  81           H        LEU  81   0.323   1.848  -8.900
    2    HA   LEU  81           HA       LEU  81   0.079   4.644  -8.567
    3    HB2  LEU  81           HB2      LEU  81  -1.962   2.421  -8.499
    4    HB3  LEU  81           HB3      LEU  81  -2.395   4.129  -8.407
    5    HG   LEU  81           HG       LEU  81  -0.705   2.963 -10.637
    6   HD12  LEU  81          HD11      LEU  81  -2.928   3.309 -11.945
    7   HD11  LEU  81          HD12      LEU  81  -3.692   3.247 -10.357
    8   HD13  LEU  81          HD13      LEU  81  -2.761   1.870 -10.941
    9   HD23  LEU  81          HD21      LEU  81  -1.774   5.120 -11.736
   10   HD22  LEU  81          HD22      LEU  81  -0.360   5.274 -10.697
   11   HD21  LEU  81          HD23      LEU  81  -1.963   5.640 -10.063

  No H/Q in entry =          11
  In of MODEL   87
    1    H    MET  82           H        MET  82  -0.620   1.962  -6.324
    2    HA   MET  82           HA       MET  82  -1.663   3.557  -4.239
    3    HB2  MET  82           HB2      MET  82  -0.319   0.855  -4.276
    4    HB3  MET  82           HB3      MET  82  -0.896   1.585  -2.780
    5    HG2  MET  82           HG2      MET  82  -2.623   1.113  -5.229
    6    HG3  MET  82           HG3      MET  82  -2.563   0.037  -3.835
    7    HE3  MET  82           HE1      MET  82  -4.280   1.701  -1.025
    8    HE2  MET  82           HE2      MET  82  -2.546   1.961  -1.202
    9    HE1  MET  82           HE3      MET  82  -3.249   0.411  -1.661

  No H/Q in entry =           9
  In of MODEL   87
    1    H    THR  83           H        THR  83   1.628   2.437  -4.916
    2    HA   THR  83           HA       THR  83   2.848   3.525  -2.609
    3    HB   THR  83           HB       THR  83   4.948   3.449  -4.074
    4    HG1  THR  83           HG1      THR  83   4.712   2.928  -6.099
    5   HG22  THR  83          HG21      THR  83   4.477   0.796  -4.411
    6   HG21  THR  83          HG22      THR  83   3.187   1.188  -3.276
    7   HG23  THR  83          HG23      THR  83   4.868   1.513  -2.849

  No H/Q in entry =           7
  In of MODEL   87
    1    H    SER  84           H        SER  84   2.505   4.812  -5.909
    2    HA   SER  84           HA       SER  84   3.868   7.237  -5.445
    3    HB2  SER  84           HB2      SER  84   1.798   6.430  -7.474
    4    HB3  SER  84           HB3      SER  84   2.494   8.050  -7.444
    5    HG   SER  84           HG       SER  84   3.841   5.561  -7.732

  No H/Q in entry =           5
  In of MODEL   87
    1    H    MET  85           H        MET  85   0.366   6.518  -5.289
    2    HA   MET  85           HA       MET  85  -0.470   9.137  -4.688
    3    HB2  MET  85           HB2      MET  85  -2.008   7.343  -5.366
    4    HB3  MET  85           HB3      MET  85  -1.737   6.535  -3.823
    5    HG2  MET  85           HG2      MET  85  -2.607   8.512  -2.629
    6    HG3  MET  85           HG3      MET  85  -2.867   9.328  -4.169
    7    HE1  MET  85           HE1      MET  85  -4.214   8.496  -6.028
    8    HE3  MET  85           HE2      MET  85  -5.349   9.428  -5.056
    9    HE2  MET  85           HE3      MET  85  -5.852   7.891  -5.753

  No H/Q in entry =           9
  In of MODEL   87
    1    H    LEU  86           H        LEU  86   0.411   6.462  -2.544
    2    HA   LEU  86           HA       LEU  86  -0.118   7.767  -0.103
    3    HB2  LEU  86           HB2      LEU  86   0.320   5.292  -0.498
    4    HB3  LEU  86           HB3      LEU  86   2.032   5.702  -0.585
    5    HG   LEU  86           HG       LEU  86   1.711   6.864   1.683
    6   HD11  LEU  86          HD11      LEU  86  -0.990   6.129   1.199
    7   HD13  LEU  86          HD12      LEU  86  -0.322   6.866   2.654
    8   HD12  LEU  86          HD13      LEU  86  -0.432   5.112   2.531
    9   HD23  LEU  86          HD21      LEU  86   1.247   3.876   1.799
   10   HD22  LEU  86          HD22      LEU  86   2.257   4.873   2.845
   11   HD21  LEU  86          HD23      LEU  86   2.761   4.544   1.188

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ALA  87           H        ALA  87   2.867   7.441  -1.980
    2    HA   ALA  87           HA       ALA  87   4.582   8.828  -0.246
    3    HB3  ALA  87           HB1      ALA  87   4.677   7.818  -2.954
    4    HB2  ALA  87           HB2      ALA  87   6.010   8.131  -1.847
    5    HB1  ALA  87           HB3      ALA  87   5.416   9.420  -2.892

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ARG  88           H        ARG  88   2.660   9.992  -2.972
    2    HA   ARG  88           HA       ARG  88   3.467  12.671  -2.848
    3    HB2  ARG  88           HB2      ARG  88   2.207  11.537  -4.712
    4    HB3  ARG  88           HB3      ARG  88   0.747  11.697  -3.735
    5    HG2  ARG  88           HG2      ARG  88   1.798  14.265  -3.643
    6    HG3  ARG  88           HG3      ARG  88   2.223  13.748  -5.273
    7    HD2  ARG  88           HD2      ARG  88   0.086  13.856  -5.979
    8    HD3  ARG  88           HD3      ARG  88  -0.518  13.008  -4.555
    9    HE   ARG  88           HE       ARG  88  -0.670  15.789  -4.969
   10   HH21  ARG  88          HH11      ARG  88  -1.188  17.122  -3.231
   11   HH22  ARG  88          HH12      ARG  88  -0.905  16.578  -1.613
   12   HH11  ARG  88          HH21      ARG  88   0.307  13.509  -2.594
   13   HH12  ARG  88          HH22      ARG  88  -0.077  14.527  -1.253

  No H/Q in entry =          13
  In of MODEL   87
    1    H    GLU  89           H        GLU  89   0.736  11.029  -1.222
    2    HA   GLU  89           HA       GLU  89  -0.346  13.353  -0.017
    3    HB2  GLU  89           HB2      GLU  89  -1.493  11.129  -0.112
    4    HB3  GLU  89           HB3      GLU  89  -0.382  10.557   1.132
    5    HG2  GLU  89           HG2      GLU  89  -1.186  12.263   2.691
    6    HG3  GLU  89           HG3      GLU  89  -2.224  12.950   1.444

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LEU  90           H        LEU  90   2.070  11.027   1.162
    2    HA   LEU  90           HA       LEU  90   2.432  12.262   3.696
    3    HB2  LEU  90           HB2      LEU  90   4.188  10.467   2.022
    4    HB3  LEU  90           HB3      LEU  90   4.607  10.975   3.663
    5    HG   LEU  90           HG       LEU  90   1.957   9.666   2.990
    6   HD12  LEU  90          HD11      LEU  90   3.066   7.603   3.999
    7   HD11  LEU  90          HD12      LEU  90   4.600   8.439   3.764
    8   HD13  LEU  90          HD13      LEU  90   3.588   8.048   2.373
    9   HD22  LEU  90          HD21      LEU  90   1.697  10.589   5.112
   10   HD21  LEU  90          HD22      LEU  90   3.412  10.458   5.501
   11   HD23  LEU  90          HD23      LEU  90   2.385   9.025   5.542

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  91           H        ILE  91   4.053  12.628   0.576
    2    HA   ILE  91           HA       ILE  91   6.051  14.430   1.426
    3    HB   ILE  91           HB       ILE  91   4.744  13.963  -1.260
    4   HG12  ILE  91          HG12      ILE  91   7.565  13.434  -0.275
    5   HG13  ILE  91          HG13      ILE  91   6.266  12.254  -0.120
    6   HG22  ILE  91          HG21      ILE  91   6.988  15.280  -1.937
    7   HG21  ILE  91          HG22      ILE  91   6.683  16.082  -0.396
    8   HG23  ILE  91          HG23      ILE  91   5.466  16.130  -1.669
    9   HD13  ILE  91          HD11      ILE  91   6.098  11.938  -2.429
   10   HD12  ILE  91          HD12      ILE  91   7.834  12.156  -2.208
   11   HD11  ILE  91          HD13      ILE  91   6.845  13.494  -2.795

  No H/Q in entry =          11
  In of MODEL   87
    1    H    THR  92           H        THR  92   2.700  14.912   0.406
    2    HA   THR  92           HA       THR  92   2.714  17.735   0.351
    3    HB   THR  92           HB       THR  92   0.516  15.770   1.038
    4    HG1  THR  92           HG1      THR  92   0.826  15.591  -1.046
    5   HG22  THR  92          HG21      THR  92  -0.851  17.954   0.315
    6   HG21  THR  92          HG22      THR  92   0.550  18.758   1.019
    7   HG23  THR  92          HG23      THR  92  -0.411  17.648   1.994

  No H/Q in entry =           7
  In of MODEL   87
    1    H    GLU  93           H        GLU  93   2.123  15.438   2.998
    2    HA   GLU  93           HA       GLU  93   1.610  17.346   5.018
    3    HB2  GLU  93           HB2      GLU  93   2.883  14.602   5.254
    4    HB3  GLU  93           HB3      GLU  93   2.200  15.537   6.586
    5    HG2  GLU  93           HG2      GLU  93   0.587  14.786   4.140
    6    HG3  GLU  93           HG3      GLU  93   0.668  13.760   5.566

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LEU  94           H        LEU  94   4.600  15.823   3.877
    2    HA   LEU  94           HA       LEU  94   6.359  16.941   5.774
    3    HB2  LEU  94           HB2      LEU  94   6.758  15.974   2.943
    4    HB3  LEU  94           HB3      LEU  94   8.093  16.610   3.899
    5    HG   LEU  94           HG       LEU  94   6.317  14.438   5.023
    6   HD11  LEU  94          HD11      LEU  94   8.418  14.185   2.900
    7   HD13  LEU  94          HD12      LEU  94   6.957  13.232   3.154
    8   HD12  LEU  94          HD13      LEU  94   8.375  12.957   4.166
    9   HD23  LEU  94          HD21      LEU  94   8.494  13.867   6.183
   10   HD22  LEU  94          HD22      LEU  94   7.849  15.455   6.600
   11   HD21  LEU  94          HD23      LEU  94   9.190  15.317   5.462

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  95           H        ILE  95   5.249  18.135   2.622
    2    HA   ILE  95           HA       ILE  95   6.855  20.470   2.574
    3    HB   ILE  95           HB       ILE  95   4.207  19.827   1.256
    4   HG12  ILE  95          HG12      ILE  95   7.005  20.126   0.131
    5   HG13  ILE  95          HG13      ILE  95   6.331  18.581   0.640
    6   HG21  ILE  95          HG21      ILE  95   5.993  22.269   1.048
    7   HG23  ILE  95          HG22      ILE  95   4.266  22.225   1.397
    8   HG22  ILE  95          HG23      ILE  95   4.849  21.819  -0.217
    9   HD13  ILE  95          HD11      ILE  95   4.777  18.531  -1.095
   10   HD12  ILE  95          HD12      ILE  95   6.141  19.331  -1.876
   11   HD11  ILE  95          HD13      ILE  95   4.780  20.284  -1.287

  No H/Q in entry =          11
  In of MODEL   87
    1    H    GLU  96           H        GLU  96   3.592  19.863   3.855
    2    HA   GLU  96           HA       GLU  96   3.008  22.517   4.609
    3    HB2  GLU  96           HB2      GLU  96   1.307  20.758   4.610
    4    HB3  GLU  96           HB3      GLU  96   2.152  19.916   5.907
    5    HG2  GLU  96           HG2      GLU  96   1.144  21.211   7.475
    6    HG3  GLU  96           HG3      GLU  96   1.704  22.679   6.683

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LEU  97           H        LEU  97   4.807  19.937   6.236
    2    HA   LEU  97           HA       LEU  97   5.174  21.275   8.711
    3    HB2  LEU  97           HB2      LEU  97   6.685  19.086   7.298
    4    HB3  LEU  97           HB3      LEU  97   7.279  19.760   8.814
    5    HG   LEU  97           HG       LEU  97   4.454  18.708   8.490
    6   HD12  LEU  97          HD11      LEU  97   5.360  16.680   9.703
    7   HD11  LEU  97          HD12      LEU  97   6.981  17.288   9.366
    8   HD13  LEU  97          HD13      LEU  97   5.910  16.848   8.035
    9   HD23  LEU  97          HD21      LEU  97   4.893  18.402  11.056
   10   HD22  LEU  97          HD22      LEU  97   4.539  20.021  10.453
   11   HD21  LEU  97          HD23      LEU  97   6.202  19.556  10.804

  No H/Q in entry =          11
  In of MODEL   87
    1    H    HIS  98           H        HIS  98   7.057  21.269   5.693
    2    HA   HIS  98           HA       HIS  98   9.230  22.814   6.603
    3    HB2  HIS  98           HB2      HIS  98   7.944  22.583   3.872
    4    HB3  HIS  98           HB3      HIS  98   9.397  23.540   4.170
    5    HD1  HIS  98           HD1      HIS  98   8.133  19.988   4.178
    6    HD2  HIS  98           HD2      HIS  98  11.743  22.029   4.621
    7    HE1  HIS  98           HE1      HIS  98   9.961  18.230   4.125
    8    HE2  HIS  98           HE2      HIS  98  12.164  19.453   4.395

  No H/Q in entry =           8
  In of MODEL   87
    1    H    GLU  99           H        GLU  99   6.027  23.700   5.417
    2    HA   GLU  99           HA       GLU  99   6.449  26.509   5.366
    3    HB2  GLU  99           HB2      GLU  99   4.557  25.371   4.226
    4    HB3  GLU  99           HB3      GLU  99   3.849  25.017   5.801
    5    HG2  GLU  99           HG2      GLU  99   3.703  27.410   6.306
    6    HG3  GLU  99           HG3      GLU  99   4.492  27.801   4.781

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LYS 100           H        LYS 100   5.274  24.286   7.879
    2    HA   LYS 100           HA       LYS 100   4.712  26.346   9.775
    3    HB2  LYS 100           HB2      LYS 100   5.240  23.385  10.117
    4    HB3  LYS 100           HB3      LYS 100   4.804  24.462  11.449
    5    HG2  LYS 100           HG2      LYS 100   2.753  25.134  10.194
    6    HG3  LYS 100           HG3      LYS 100   3.167  23.961   8.941
    7    HD2  LYS 100           HD2      LYS 100   3.055  22.138  10.599
    8    HD3  LYS 100           HD3      LYS 100   2.658  23.305  11.863
    9    HE2  LYS 100           HE2      LYS 100   0.620  23.960  10.593
   10    HE3  LYS 100           HE3      LYS 100   1.006  22.737   9.376
   11    HZ1  LYS 100           HZ1      LYS 100   0.718  22.069  12.255
   12    HZ3  LYS 100           HZ2      LYS 100   0.691  21.018  10.918
   13    HZ2  LYS 100           HZ3      LYS 100  -0.609  22.077  11.195

  No H/Q in entry =          13
  In of MODEL   87
    1    H    LEU 101           H        LEU 101   7.610  24.507   8.949
    2    HA   LEU 101           HA       LEU 101   9.213  25.317  11.160
    3    HB2  LEU 101           HB2      LEU 101   9.803  24.327   8.383
    4    HB3  LEU 101           HB3      LEU 101  11.111  24.970   9.371
    5    HG   LEU 101           HG       LEU 101   9.242  22.840  10.423
    6   HD12  LEU 101          HD11      LEU 101  11.274  21.314   9.820
    7   HD11  LEU 101          HD12      LEU 101  11.666  22.574   8.651
    8   HD13  LEU 101          HD13      LEU 101  10.124  21.725   8.549
    9   HD21  LEU 101          HD21      LEU 101  11.980  23.904  11.163
   10   HD23  LEU 101          HD22      LEU 101  11.410  22.339  11.738
   11   HD22  LEU 101          HD23      LEU 101  10.539  23.808  12.175

  No H/Q in entry =          11
  In of MODEL   87
    1    H    LYS 102           H        LYS 102   7.668  27.210   9.017
    2    HA   LYS 102           HA       LYS 102   7.783  29.501   8.730
    3    HB2  LYS 102           HB2      LYS 102   9.337  29.357  10.834
    4    HB3  LYS 102           HB3      LYS 102  10.644  29.533   9.680
    5    HG2  LYS 102           HG2      LYS 102   8.566  31.518  10.538
    6    HG3  LYS 102           HG3      LYS 102  10.284  31.751  10.294
    7    HD2  LYS 102           HD2      LYS 102   8.335  31.364   7.985
    8    HD3  LYS 102           HD3      LYS 102   8.741  32.936   8.658
    9    HE2  LYS 102           HE2      LYS 102  10.103  31.733   6.588
   10    HE3  LYS 102           HE3      LYS 102  10.736  33.028   7.604
   11    HZ2  LYS 102           HZ1      LYS 102  12.227  31.100   7.431
   12    HZ1  LYS 102           HZ2      LYS 102  11.046  30.135   8.167
   13    HZ3  LYS 102           HZ3      LYS 102  11.755  31.409   9.031

  No H/Q in entry =          13
  In of MODEL   87
    1    H    ALA 103           H        ALA 103  11.020  28.112   8.176
    2    HA   ALA 103           HA       ALA 103  12.014  29.477   6.106
    3    HB2  ALA 103           HB1      ALA 103  12.868  27.251   5.178
    4    HB1  ALA 103           HB2      ALA 103  11.955  26.488   6.479
    5    HB3  ALA 103           HB3      ALA 103  13.261  27.611   6.859

  No H/Q in entry =           5
  In of MODEL   87
    1    H1   LYS   3           H1       LYS   3 -31.907   5.484 -19.681
    2    H2   LYS   3           H3       LYS   3 -30.917   5.247 -21.041
    3    H3   LYS   3           H2       LYS   3 -32.258   4.239 -20.781
    4    HA   LYS   3           HA       LYS   3 -31.172   2.905 -19.386
    5    HB2  LYS   3           HB2      LYS   3 -28.978   4.434 -20.738
    6    HB3  LYS   3           HB3      LYS   3 -28.581   3.246 -19.497
    7    HG2  LYS   3           HG2      LYS   3 -29.929   1.586 -20.836
    8    HG3  LYS   3           HG3      LYS   3 -29.958   2.787 -22.126
    9    HD2  LYS   3           HD2      LYS   3 -27.473   2.803 -22.097
   10    HD3  LYS   3           HD3      LYS   3 -27.513   1.501 -20.910
   11    HE2  LYS   3           HE2      LYS   3 -28.962   0.248 -22.613
   12    HE3  LYS   3           HE3      LYS   3 -28.415   1.456 -23.775
   13    HZ3  LYS   3           HZ1      LYS   3 -26.557   0.324 -24.059
   14    HZ2  LYS   3           HZ2      LYS   3 -27.116  -0.876 -22.995
   15    HZ1  LYS   3           HZ3      LYS   3 -26.188   0.418 -22.404

  No H/Q in entry =          15
  In of MODEL   87
    1    H    LYS   4           H        LYS   4 -31.200   2.761 -17.324
    2    HA   LYS   4           HA       LYS   4 -30.575   5.083 -15.680
    3    HB2  LYS   4           HB2      LYS   4 -31.629   2.332 -14.970
    4    HB3  LYS   4           HB3      LYS   4 -31.468   3.681 -13.846
    5    HG2  LYS   4           HG2      LYS   4 -33.291   3.525 -16.252
    6    HG3  LYS   4           HG3      LYS   4 -33.769   3.550 -14.556
    7    HD2  LYS   4           HD2      LYS   4 -33.186   5.806 -14.295
    8    HD3  LYS   4           HD3      LYS   4 -32.157   5.800 -15.727
    9    HE2  LYS   4           HE2      LYS   4 -34.154   7.073 -16.173
   10    HE3  LYS   4           HE3      LYS   4 -34.167   5.598 -17.140
   11    HZ3  LYS   4           HZ1      LYS   4 -35.681   4.608 -15.580
   12    HZ2  LYS   4           HZ2      LYS   4 -36.316   6.072 -16.159
   13    HZ1  LYS   4           HZ3      LYS   4 -35.642   5.996 -14.603

  No H/Q in entry =          13
  In of MODEL   87
    1    H    HIS   5           H        HIS   5 -29.099   5.243 -14.102
    2    HA   HIS   5           HA       HIS   5 -26.730   3.531 -14.453
    3    HB2  HIS   5           HB2      HIS   5 -27.113   6.270 -13.243
    4    HB3  HIS   5           HB3      HIS   5 -25.584   5.392 -13.239
    5    HD1  HIS   5           HD1      HIS   5 -24.190   6.664 -14.842
    6    HD2  HIS   5           HD2      HIS   5 -27.969   5.852 -16.363
    7    HE1  HIS   5           HE1      HIS   5 -24.073   7.250 -17.293
    8    HE2  HIS   5           HE2      HIS   5 -26.376   6.743 -18.190

  No H/Q in entry =           8
  In of MODEL   87
    1    H    ILE   6           H        ILE   6 -26.411   1.973 -13.138
    2    HA   ILE   6           HA       ILE   6 -27.375   2.193 -10.365
    3    HB   ILE   6           HB       ILE   6 -26.442  -0.230 -11.910
    4   HG12  ILE   6          HG12      ILE   6 -29.220   0.569 -11.035
    5   HG13  ILE   6          HG13      ILE   6 -28.602   0.762 -12.675
    6   HG23  ILE   6          HG21      ILE   6 -26.737  -1.498 -10.046
    7   HG22  ILE   6          HG22      ILE   6 -27.944  -0.411  -9.357
    8   HG21  ILE   6          HG23      ILE   6 -26.232   0.010  -9.282
    9   HD13  ILE   6          HD11      ILE   6 -28.960  -1.377 -13.171
   10   HD12  ILE   6          HD12      ILE   6 -29.963  -1.410 -11.720
   11   HD11  ILE   6          HD13      ILE   6 -28.280  -1.935 -11.642

  No H/Q in entry =          11
  In of MODEL   87
    1    H    TYR   7           H        TYR   7 -25.639   2.921  -9.094
    2    HA   TYR   7           HA       TYR   7 -22.889   2.098  -9.796
    3    HB2  TYR   7           HB2      TYR   7 -23.959   4.482  -8.307
    4    HB3  TYR   7           HB3      TYR   7 -22.251   4.050  -8.360
    5    HD1  TYR   7           HD1      TYR   7 -23.270   3.057 -11.442
    6    HD2  TYR   7           HD2      TYR   7 -22.758   6.659  -9.221
    7    HE1  TYR   7           HE1      TYR   7 -22.917   4.305 -13.536
    8    HE2  TYR   7           HE2      TYR   7 -22.446   7.910 -11.307
    9    HH   TYR   7           HH       TYR   7 -22.679   7.812 -13.538

  No H/Q in entry =           9
  In of MODEL   87
    1    H    LEU   8           H        LEU   8 -21.848   0.796  -8.476
    2    HA   LEU   8           HA       LEU   8 -22.930   0.248  -5.783
    3    HB2  LEU   8           HB2      LEU   8 -21.163  -1.331  -7.632
    4    HB3  LEU   8           HB3      LEU   8 -21.315  -1.721  -5.918
    5    HG   LEU   8           HG       LEU   8 -23.787  -2.015  -6.320
    6   HD13  LEU   8          HD11      LEU   8 -23.995  -0.808  -8.428
    7   HD12  LEU   8          HD12      LEU   8 -24.445  -2.496  -8.664
    8   HD11  LEU   8          HD13      LEU   8 -22.868  -1.920  -9.202
    9   HD23  LEU   8          HD21      LEU   8 -22.429  -3.992  -8.023
   10   HD22  LEU   8          HD22      LEU   8 -23.495  -4.212  -6.636
   11   HD21  LEU   8          HD23      LEU   8 -21.805  -3.776  -6.389

  No H/Q in entry =          11
  In of MODEL   87
    1    H    PHE   9           H        PHE   9 -21.660   0.707  -4.007
    2    HA   PHE   9           HA       PHE   9 -18.933   1.785  -4.543
    3    HB2  PHE   9           HB2      PHE   9 -20.995   2.751  -2.569
    4    HB3  PHE   9           HB3      PHE   9 -19.306   3.238  -2.530
    5    HD1  PHE   9           HD1      PHE   9 -18.343   4.598  -4.322
    6    HD2  PHE   9           HD2      PHE   9 -22.500   3.538  -4.326
    7    HE1  PHE   9           HE1      PHE   9 -18.774   6.296  -6.073
    8    HE2  PHE   9           HE2      PHE   9 -22.934   5.247  -6.072
    9    HZ   PHE   9           HZ       PHE   9 -21.068   6.623  -6.951

  No H/Q in entry =           9
  In of MODEL   87
    1    H    SER  10           H        SER  10 -17.268   0.926  -3.426
    2    HA   SER  10           HA       SER  10 -17.427   0.025  -0.742
    3    HB2  SER  10           HB2      SER  10 -17.192  -2.339  -1.019
    4    HB3  SER  10           HB3      SER  10 -18.600  -1.853  -1.950
    5    HG   SER  10           HG       SER  10 -16.898  -1.614  -3.702

  No H/Q in entry =           5
  In of MODEL   87
    1    H    SER  11           H        SER  11 -15.404   0.190   0.076
    2    HA   SER  11           HA       SER  11 -13.270   1.125  -1.485
    3    HB2  SER  11           HB2      SER  11 -12.085   1.269   0.487
    4    HB3  SER  11           HB3      SER  11 -13.747   1.246   1.084
    5    HG   SER  11           HG       SER  11 -12.817  -1.259   0.707

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ALA  12           H        ALA  12 -14.363  -1.604  -2.277
    2    HA   ALA  12           HA       ALA  12 -11.743  -2.765  -2.808
    3    HB3  ALA  12           HB1      ALA  12 -12.686  -5.079  -2.175
    4    HB1  ALA  12           HB2      ALA  12 -13.874  -4.188  -1.227
    5    HB2  ALA  12           HB3      ALA  12 -12.157  -4.020  -0.865

  No H/Q in entry =           5
  In of MODEL   87
    1    H    GLY  13           H        GLY  13 -12.648  -1.734  -4.822
    2    HA3  GLY  13           HA2      GLY  13 -14.840  -2.571  -6.274
    3    HA2  GLY  13           HA3      GLY  13 -13.322  -2.041  -7.013

  No H/Q in entry =           3
  In of MODEL   87
    1    H    MET  14           H        MET  14 -11.748  -4.282  -5.952
    2    HA   MET  14           HA       MET  14 -11.993  -6.049  -8.091
    3    HB2  MET  14           HB2      MET  14  -9.988  -5.930  -6.585
    4    HB3  MET  14           HB3      MET  14 -10.873  -6.884  -5.396
    5    HG2  MET  14           HG2      MET  14  -9.696  -8.538  -6.556
    6    HG3  MET  14           HG3      MET  14 -11.224  -8.532  -7.437
    7    HE1  MET  14           HE1      MET  14  -7.771  -8.885  -7.742
    8    HE3  MET  14           HE2      MET  14  -7.530  -7.190  -7.329
    9    HE2  MET  14           HE3      MET  14  -7.098  -7.767  -8.937

  No H/Q in entry =           9
  In of MODEL   87
    1    H    SER  15           H        SER  15 -13.226  -6.604  -4.798
    2    HA   SER  15           HA       SER  15 -14.472  -9.099  -5.529
    3    HB2  SER  15           HB2      SER  15 -14.040  -8.936  -3.205
    4    HB3  SER  15           HB3      SER  15 -14.766  -7.335  -3.102
    5    HG   SER  15           HG       SER  15 -16.180  -9.712  -3.794

  No H/Q in entry =           5
  In of MODEL   87
    1    H    THR  16           H        THR  16 -15.650  -5.758  -5.175
    2    HA   THR  16           HA       THR  16 -18.429  -6.332  -5.704
    3    HB   THR  16           HB       THR  16 -16.932  -3.738  -6.215
    4    HG1  THR  16           HG1      THR  16 -18.261  -3.871  -3.875
    5   HG22  THR  16          HG21      THR  16 -19.803  -4.307  -5.440
    6   HG21  THR  16          HG22      THR  16 -19.263  -3.913  -7.081
    7   HG23  THR  16          HG23      THR  16 -19.107  -2.727  -5.776

  No H/Q in entry =           7
  In of MODEL   87
    1    H    SER  17           H        SER  17 -15.603  -5.657  -7.570
    2    HA   SER  17           HA       SER  17 -16.784  -4.974 -10.064
    3    HB2  SER  17           HB2      SER  17 -14.087  -6.162  -9.380
    4    HB3  SER  17           HB3      SER  17 -14.562  -5.751 -11.027
    5    HG   SER  17           HG       SER  17 -14.971  -3.779  -9.141

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LEU  18           H        LEU  18 -16.049  -8.086  -8.619
    2    HA   LEU  18           HA       LEU  18 -16.576  -9.615 -10.968
    3    HB2  LEU  18           HB2      LEU  18 -15.297 -10.511  -9.072
    4    HB3  LEU  18           HB3      LEU  18 -16.729 -10.391  -8.051
    5    HG   LEU  18           HG       LEU  18 -17.884 -12.031  -9.437
    6   HD13  LEU  18          HD11      LEU  18 -17.102 -11.788 -11.614
    7   HD12  LEU  18          HD12      LEU  18 -16.276 -13.262 -11.105
    8   HD11  LEU  18          HD13      LEU  18 -15.415 -11.724 -11.107
    9   HD23  LEU  18          HD21      LEU  18 -15.164 -13.084  -8.745
   10   HD22  LEU  18          HD22      LEU  18 -16.709 -13.939  -8.730
   11   HD21  LEU  18          HD23      LEU  18 -16.389 -12.679  -7.540

  No H/Q in entry =          11
  In of MODEL   87
    1    H    LEU  19           H        LEU  19 -18.584  -8.506  -8.243
    2    HA   LEU  19           HA       LEU  19 -20.991  -9.811  -9.057
    3    HB2  LEU  19           HB2      LEU  19 -20.733  -8.956  -6.806
    4    HB3  LEU  19           HB3      LEU  19 -20.561  -7.314  -7.424
    5    HG   LEU  19           HG       LEU  19 -22.941  -7.448  -8.202
    6   HD13  LEU  19          HD11      LEU  19 -24.369  -9.169  -7.238
    7   HD12  LEU  19          HD12      LEU  19 -22.973  -9.921  -6.466
    8   HD11  LEU  19          HD13      LEU  19 -23.112  -9.915  -8.224
    9   HD23  LEU  19          HD21      LEU  19 -23.846  -7.180  -5.890
   10   HD22  LEU  19          HD22      LEU  19 -22.402  -6.229  -6.235
   11   HD21  LEU  19          HD23      LEU  19 -22.277  -7.706  -5.281

  No H/Q in entry =          11
  In of MODEL   87
    1    H    VAL  20           H        VAL  20 -19.660  -6.580  -9.764
    2    HA   VAL  20           HA       VAL  20 -21.833  -5.647 -11.318
    3    HB   VAL  20           HB       VAL  20 -18.878  -4.907 -11.479
    4   HG11  VAL  20          HG11      VAL  20 -21.265  -3.855 -12.977
    5   HG13  VAL  20          HG12      VAL  20 -19.653  -4.233 -13.584
    6   HG12  VAL  20          HG13      VAL  20 -19.910  -2.791 -12.601
    7   HG23  VAL  20          HG21      VAL  20 -19.777  -2.789 -10.416
    8   HG22  VAL  20          HG22      VAL  20 -19.734  -4.229  -9.401
    9   HG21  VAL  20          HG23      VAL  20 -21.258  -3.697 -10.110

  No H/Q in entry =           9
  In of MODEL   87
    1    H    SER  21           H        SER  21 -18.984  -7.557 -12.365
    2    HA   SER  21           HA       SER  21 -19.793  -7.487 -15.110
    3    HB2  SER  21           HB2      SER  21 -18.262  -9.378 -15.454
    4    HB3  SER  21           HB3      SER  21 -17.490  -8.094 -14.528
    5    HG   SER  21           HG       SER  21 -18.702  -9.761 -12.858

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LYS  22           H        LYS  22 -20.728  -9.722 -12.529
    2    HA   LYS  22           HA       LYS  22 -22.199 -11.417 -14.339
    3    HB2  LYS  22           HB2      LYS  22 -22.411 -11.075 -11.346
    4    HB3  LYS  22           HB3      LYS  22 -23.277 -12.294 -12.280
    5    HG2  LYS  22           HG2      LYS  22 -20.281 -12.143 -12.318
    6    HG3  LYS  22           HG3      LYS  22 -21.144 -12.996 -11.039
    7    HD2  LYS  22           HD2      LYS  22 -21.710 -13.590 -13.923
    8    HD3  LYS  22           HD3      LYS  22 -20.328 -14.323 -13.106
    9    HE2  LYS  22           HE2      LYS  22 -21.855 -15.253 -11.398
   10    HE3  LYS  22           HE3      LYS  22 -23.226 -14.558 -12.264
   11    HZ1  LYS  22           HZ1      LYS  22 -22.284 -15.945 -14.217
   12    HZ3  LYS  22           HZ2      LYS  22 -23.224 -16.696 -13.018
   13    HZ2  LYS  22           HZ3      LYS  22 -21.533 -16.843 -12.986

  No H/Q in entry =          13
  In of MODEL   87
    1    H    MET  23           H        MET  23 -23.051  -8.533 -12.466
    2    HA   MET  23           HA       MET  23 -25.855  -8.749 -12.951
    3    HB2  MET  23           HB2      MET  23 -24.119  -6.353 -12.393
    4    HB3  MET  23           HB3      MET  23 -25.871  -6.269 -12.558
    5    HG2  MET  23           HG2      MET  23 -26.184  -7.589 -10.586
    6    HG3  MET  23           HG3      MET  23 -24.455  -7.917 -10.472
    7    HE2  MET  23           HE1      MET  23 -26.919  -4.381  -9.267
    8    HE1  MET  23           HE2      MET  23 -27.137  -5.361 -10.715
    9    HE3  MET  23           HE3      MET  23 -26.173  -3.885 -10.787

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ARG  24           H        ARG  24 -23.187  -7.189 -14.756
    2    HA   ARG  24           HA       ARG  24 -24.760  -5.963 -16.744
    3    HB2  ARG  24           HB2      ARG  24 -21.896  -6.971 -16.823
    4    HB3  ARG  24           HB3      ARG  24 -22.628  -6.068 -18.126
    5    HG2  ARG  24           HG2      ARG  24 -22.886  -4.080 -16.690
    6    HG3  ARG  24           HG3      ARG  24 -22.266  -5.006 -15.297
    7    HD2  ARG  24           HD2      ARG  24 -20.408  -3.742 -16.222
    8    HD3  ARG  24           HD3      ARG  24 -20.183  -5.439 -16.624
    9    HE   ARG  24           HE       ARG  24 -20.204  -5.008 -18.789
   10   HH21  ARG  24          HH11      ARG  24 -19.429  -3.393 -20.147
   11   HH22  ARG  24          HH12      ARG  24 -20.199  -1.844 -20.163
   12   HH11  ARG  24          HH21      ARG  24 -22.133  -2.654 -17.311
   13   HH12  ARG  24          HH22      ARG  24 -21.804  -1.420 -18.487

  No H/Q in entry =          13
  In of MODEL   87
    1    H    ALA  25           H        ALA  25 -23.479  -9.245 -16.477
    2    HA   ALA  25           HA       ALA  25 -24.086 -10.105 -19.110
    3    HB1  ALA  25           HB1      ALA  25 -23.289 -12.102 -18.420
    4    HB3  ALA  25           HB2      ALA  25 -24.335 -12.131 -17.001
    5    HB2  ALA  25           HB3      ALA  25 -22.821 -11.231 -16.959

  No H/Q in entry =           5
  In of MODEL   87
    1    H    GLN  26           H        GLN  26 -25.887 -10.230 -16.073
    2    HA   GLN  26           HA       GLN  26 -28.178 -11.542 -17.073
    3    HB2  GLN  26           HB2      GLN  26 -27.731  -9.773 -14.689
    4    HB3  GLN  26           HB3      GLN  26 -29.261 -10.569 -15.028
    5    HG2  GLN  26           HG2      GLN  26 -26.606 -11.902 -14.579
    6    HG3  GLN  26           HG3      GLN  26 -27.962 -11.864 -13.459
    7   HE21  GLN  26          HE21      GLN  26 -26.653 -13.969 -14.746
    8   HE22  GLN  26          HE22      GLN  26 -27.651 -15.064 -15.535

  No H/Q in entry =           8
  In of MODEL   87
    1    H    ALA  27           H        ALA  27 -27.402  -8.105 -16.686
    2    HA   ALA  27           HA       ALA  27 -29.946  -7.129 -17.451
    3    HB1  ALA  27           HB1      ALA  27 -28.192  -5.731 -16.348
    4    HB3  ALA  27           HB2      ALA  27 -28.829  -4.993 -17.819
    5    HB2  ALA  27           HB3      ALA  27 -27.254  -5.786 -17.841

  No H/Q in entry =           5
  In of MODEL   87
    1    H    GLU  28           H        GLU  28 -27.204  -8.222 -19.341
    2    HA   GLU  28           HA       GLU  28 -28.205  -7.226 -21.852
    3    HB2  GLU  28           HB2      GLU  28 -25.792  -7.798 -21.246
    4    HB3  GLU  28           HB3      GLU  28 -26.260  -9.485 -21.446
    5    HG2  GLU  28           HG2      GLU  28 -25.165  -8.655 -23.422
    6    HG3  GLU  28           HG3      GLU  28 -26.848  -9.056 -23.758

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LYS  29           H        LYS  29 -28.213 -10.338 -20.198
    2    HA   LYS  29           HA       LYS  29 -29.460 -11.866 -22.195
    3    HB2  LYS  29           HB2      LYS  29 -28.352 -12.802 -20.200
    4    HB3  LYS  29           HB3      LYS  29 -29.648 -12.156 -19.195
    5    HG2  LYS  29           HG2      LYS  29 -31.250 -13.603 -20.253
    6    HG3  LYS  29           HG3      LYS  29 -30.030 -14.180 -21.387
    7    HD2  LYS  29           HD2      LYS  29 -28.822 -15.294 -19.663
    8    HD3  LYS  29           HD3      LYS  29 -29.758 -14.498 -18.401
    9    HE2  LYS  29           HE2      LYS  29 -30.402 -16.879 -18.760
   10    HE3  LYS  29           HE3      LYS  29 -31.736 -15.748 -18.993
   11    HZ1  LYS  29           HZ1      LYS  29 -31.184 -15.852 -21.425
   12    HZ3  LYS  29           HZ2      LYS  29 -31.832 -17.272 -20.756
   13    HZ2  LYS  29           HZ3      LYS  29 -30.168 -17.165 -21.066

  No H/Q in entry =          13
  In of MODEL   87
    1    H    TYR  30           H        TYR  30 -30.931  -9.831 -19.678
    2    HA   TYR  30           HA       TYR  30 -33.578 -10.403 -20.901
    3    HB2  TYR  30           HB2      TYR  30 -32.962  -9.224 -18.183
    4    HB3  TYR  30           HB3      TYR  30 -34.569  -9.556 -18.826
    5    HD1  TYR  30           HD1      TYR  30 -35.372 -11.888 -19.035
    6    HD2  TYR  30           HD2      TYR  30 -31.564 -10.988 -17.358
    7    HE1  TYR  30           HE1      TYR  30 -35.168 -14.210 -18.244
    8    HE2  TYR  30           HE2      TYR  30 -31.361 -13.296 -16.570
    9    HH   TYR  30           HH       TYR  30 -32.895 -15.731 -17.655

  No H/Q in entry =           9
  In of MODEL   87
    1    H    GLU  31           H        GLU  31 -31.515  -8.311 -21.714
    2    HA   GLU  31           HA       GLU  31 -31.549  -6.151 -22.534
    3    HB2  GLU  31           HB2      GLU  31 -34.411  -7.002 -23.027
    4    HB3  GLU  31           HB3      GLU  31 -33.641  -5.596 -23.760
    5    HG2  GLU  31           HG2      GLU  31 -32.111  -6.960 -24.965
    6    HG3  GLU  31           HG3      GLU  31 -32.602  -8.401 -24.074

  No H/Q in entry =           6
  In of MODEL   87
    1    H    VAL  32           H        VAL  32 -31.733  -6.063 -19.800
    2    HA   VAL  32           HA       VAL  32 -33.690  -4.042 -19.124
    3    HB   VAL  32           HB       VAL  32 -31.240  -4.923 -17.562
    4   HG12  VAL  32          HG11      VAL  32 -32.800  -4.175 -15.654
    5   HG11  VAL  32          HG12      VAL  32 -33.685  -3.311 -16.911
    6   HG13  VAL  32          HG13      VAL  32 -31.992  -2.926 -16.603
    7   HG21  VAL  32          HG21      VAL  32 -32.929  -6.725 -18.241
    8   HG23  VAL  32          HG22      VAL  32 -33.999  -5.949 -17.072
    9   HG22  VAL  32          HG23      VAL  32 -32.445  -6.600 -16.549

  No H/Q in entry =           9
  In of MODEL   87
    1    HA   PRO  33           HA       PRO  33 -30.813  -0.969 -20.814
    2    HB2  PRO  33           HB2      PRO  33 -32.429   1.178 -20.676
    3    HB3  PRO  33           HB3      PRO  33 -32.842  -0.144 -21.769
    4    HG2  PRO  33           HG2      PRO  33 -33.814   0.321 -18.948
    5    HG3  PRO  33           HG3      PRO  33 -34.778   0.068 -20.404
    6    HD2  PRO  33           HD2      PRO  33 -34.210  -1.982 -18.745
    7    HD3  PRO  33           HD3      PRO  33 -34.273  -2.224 -20.491

  No H/Q in entry =           7
  In of MODEL   87
    1    H    VAL  34           H        VAL  34 -29.511  -1.454 -18.875
    2    HA   VAL  34           HA       VAL  34 -29.333   0.979 -17.225
    3    HB   VAL  34           HB       VAL  34 -28.667  -0.455 -15.295
    4   HG12  VAL  34          HG11      VAL  34 -31.032  -1.446 -14.972
    5   HG11  VAL  34          HG12      VAL  34 -31.396  -0.699 -16.526
    6   HG13  VAL  34          HG13      VAL  34 -30.882   0.301 -15.168
    7   HG21  VAL  34          HG21      VAL  34 -28.768  -2.485 -17.306
    8   HG23  VAL  34          HG22      VAL  34 -29.796  -2.900 -15.932
    9   HG22  VAL  34          HG23      VAL  34 -28.093  -2.529 -15.677

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ILE  35           H        ILE  35 -27.375   1.509 -16.399
    2    HA   ILE  35           HA       ILE  35 -25.017   0.297 -17.681
    3    HB   ILE  35           HB       ILE  35 -25.552   3.162 -16.862
    4   HG12  ILE  35          HG12      ILE  35 -24.525   1.909 -19.416
    5   HG13  ILE  35          HG13      ILE  35 -26.182   2.448 -19.143
    6   HG21  ILE  35          HG21      ILE  35 -22.921   1.757 -17.192
    7   HG23  ILE  35          HG22      ILE  35 -23.423   2.911 -15.957
    8   HG22  ILE  35          HG23      ILE  35 -23.079   3.466 -17.596
    9   HD11  ILE  35          HD11      ILE  35 -24.886   4.708 -18.548
   10   HD13  ILE  35          HD12      ILE  35 -25.416   4.302 -20.181
   11   HD12  ILE  35          HD13      ILE  35 -23.744   4.013 -19.698

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ILE  36           H        ILE  36 -23.726  -0.667 -16.093
    2    HA   ILE  36           HA       ILE  36 -24.175  -0.080 -13.218
    3    HB   ILE  36           HB       ILE  36 -23.223  -2.737 -14.338
    4   HG12  ILE  36          HG12      ILE  36 -26.062  -2.072 -13.552
    5   HG13  ILE  36          HG13      ILE  36 -25.503  -2.020 -15.225
    6   HG23  ILE  36          HG21      ILE  36 -23.518  -3.586 -12.224
    7   HG22  ILE  36          HG22      ILE  36 -24.703  -2.360 -11.774
    8   HG21  ILE  36          HG23      ILE  36 -22.991  -1.943 -11.856
    9   HD13  ILE  36          HD11      ILE  36 -25.561  -4.239 -15.434
   10   HD12  ILE  36          HD12      ILE  36 -26.621  -4.172 -14.026
   11   HD11  ILE  36          HD13      ILE  36 -24.902  -4.509 -13.820

  No H/Q in entry =          11
  In of MODEL   87
    1    H    GLU  37           H        GLU  37 -22.418   0.635 -12.126
    2    HA   GLU  37           HA       GLU  37 -19.699  -0.027 -13.063
    3    HB2  GLU  37           HB2      GLU  37 -20.730   2.714 -12.354
    4    HB3  GLU  37           HB3      GLU  37 -19.020   2.308 -12.492
    5    HG2  GLU  37           HG2      GLU  37 -19.285   1.858 -14.845
    6    HG3  GLU  37           HG3      GLU  37 -21.019   2.158 -14.730

  No H/Q in entry =           6
  In of MODEL   87
    1    H    ALA  38           H        ALA  38 -18.190  -0.193 -11.392
    2    HA   ALA  38           HA       ALA  38 -19.207  -0.070  -8.613
    3    HB1  ALA  38           HB1      ALA  38 -17.410  -1.919 -10.056
    4    HB3  ALA  38           HB2      ALA  38 -18.436  -2.209  -8.651
    5    HB2  ALA  38           HB3      ALA  38 -16.858  -1.448  -8.448

  No H/Q in entry =           5
  In of MODEL   87
    1    H    PHE  39           H        PHE  39 -18.019   1.197  -7.146
    2    HA   PHE  39           HA       PHE  39 -15.564   2.527  -8.059
    3    HB2  PHE  39           HB2      PHE  39 -18.042   3.890  -7.022
    4    HB3  PHE  39           HB3      PHE  39 -16.448   4.640  -6.945
    5    HD1  PHE  39           HD1      PHE  39 -15.149   4.706  -9.216
    6    HD2  PHE  39           HD2      PHE  39 -19.376   4.299  -8.834
    7    HE1  PHE  39           HE1      PHE  39 -15.427   5.570 -11.521
    8    HE2  PHE  39           HE2      PHE  39 -19.670   5.155 -11.132
    9    HZ   PHE  39           HZ       PHE  39 -17.700   5.763 -12.494

  No H/Q in entry =           9
  In of MODEL   87
    1    HA   PRO  40           HA       PRO  40 -14.556   1.815  -3.782
    2    HB2  PRO  40           HB2      PRO  40 -12.890   3.917  -3.185
    3    HB3  PRO  40           HB3      PRO  40 -12.386   2.612  -4.257
    4    HG2  PRO  40           HG2      PRO  40 -13.556   5.291  -4.993
    5    HG3  PRO  40           HG3      PRO  40 -12.092   4.525  -5.611
    6    HD2  PRO  40           HD2      PRO  40 -14.319   4.327  -7.002
    7    HD3  PRO  40           HD3      PRO  40 -13.289   2.907  -6.821

  No H/Q in entry =           7
  In of MODEL   87
    1    H    GLU  41           H        GLU  41 -15.211   2.756  -1.645
    2    HA   GLU  41           HA       GLU  41 -17.541   4.341  -1.608
    3    HB2  GLU  41           HB2      GLU  41 -17.482   4.132   0.709
    4    HB3  GLU  41           HB3      GLU  41 -16.627   2.690   0.158
    5    HG2  GLU  41           HG2      GLU  41 -15.428   3.531   2.015
    6    HG3  GLU  41           HG3      GLU  41 -14.479   3.910   0.578

  No H/Q in entry =           6
  In of MODEL   87
    1    H    THR  42           H        THR  42 -14.262   5.430  -1.683
    2    HA   THR  42           HA       THR  42 -14.738   7.967  -0.464
    3    HB   THR  42           HB       THR  42 -12.623   8.653  -1.579
    4    HG1  THR  42           HG1      THR  42 -11.710   6.497  -2.599
    5   HG23  THR  42          HG21      THR  42 -12.517   7.425   0.542
    6   HG22  THR  42          HG22      THR  42 -11.174   6.963  -0.506
    7   HG21  THR  42          HG23      THR  42 -12.565   5.895  -0.332

  No H/Q in entry =           7
  In of MODEL   87
    1    H    LEU  43           H        LEU  43 -15.608   6.831  -3.559
    2    HA   LEU  43           HA       LEU  43 -16.012   9.589  -4.522
    3    HB2  LEU  43           HB2      LEU  43 -16.251   6.928  -5.919
    4    HB3  LEU  43           HB3      LEU  43 -16.543   8.496  -6.670
    5    HG   LEU  43           HG       LEU  43 -13.875   7.529  -5.674
    6   HD11  LEU  43          HD11      LEU  43 -14.999   6.434  -7.757
    7   HD13  LEU  43          HD12      LEU  43 -13.323   6.973  -7.851
    8   HD12  LEU  43          HD13      LEU  43 -14.607   7.966  -8.540
    9   HD21  LEU  43          HD21      LEU  43 -14.854  10.046  -6.989
   10   HD23  LEU  43          HD22      LEU  43 -13.185   9.513  -7.190
   11   HD22  LEU  43          HD23      LEU  43 -13.810   9.862  -5.579

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ALA  44           H        ALA  44 -17.846   7.661  -2.658
    2    HA   ALA  44           HA       ALA  44 -20.323   7.394  -3.962
    3    HB2  ALA  44           HB1      ALA  44 -20.111   6.283  -1.869
    4    HB3  ALA  44           HB2      ALA  44 -21.285   7.568  -1.585
    5    HB1  ALA  44           HB3      ALA  44 -19.618   7.762  -1.046

  No H/Q in entry =           5
  In of MODEL   87
    1    H    GLY  45           H        GLY  45 -19.040  10.262  -2.435
    2    HA3  GLY  45           HA2      GLY  45 -21.555  11.633  -2.775
    3    HA2  GLY  45           HA3      GLY  45 -20.041  12.337  -2.209

  No H/Q in entry =           3
  In of MODEL   87
    1    H    GLU  46           H        GLU  46 -18.480  11.484  -4.512
    2    HA   GLU  46           HA       GLU  46 -19.246  13.666  -6.273
    3    HB2  GLU  46           HB2      GLU  46 -16.944  11.709  -6.298
    4    HB3  GLU  46           HB3      GLU  46 -17.154  12.998  -7.483
    5    HG2  GLU  46           HG2      GLU  46 -16.926  14.670  -5.752
    6    HG3  GLU  46           HG3      GLU  46 -16.813  13.413  -4.520

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LYS  47           H        LYS  47 -18.946  10.159  -6.714
    2    HA   LYS  47           HA       LYS  47 -20.074  10.324  -9.381
    3    HB2  LYS  47           HB2      LYS  47 -19.363   7.967  -7.629
    4    HB3  LYS  47           HB3      LYS  47 -19.950   7.841  -9.288
    5    HG2  LYS  47           HG2      LYS  47 -17.466   9.357  -8.572
    6    HG3  LYS  47           HG3      LYS  47 -17.456   7.631  -8.934
    7    HD2  LYS  47           HD2      LYS  47 -18.572   8.142 -11.099
    8    HD3  LYS  47           HD3      LYS  47 -18.382   9.857 -10.739
    9    HE2  LYS  47           HE2      LYS  47 -16.118   7.881 -10.929
   10    HE3  LYS  47           HE3      LYS  47 -16.616   8.970 -12.223
   11    HZ2  LYS  47           HZ1      LYS  47 -15.216   9.544  -9.741
   12    HZ1  LYS  47           HZ2      LYS  47 -16.342  10.701 -10.265
   13    HZ3  LYS  47           HZ3      LYS  47 -15.052  10.254 -11.275

  No H/Q in entry =          13
  In of MODEL   87
    1    H    GLY  48           H        GLY  48 -21.331   9.495  -6.225
    2    HA3  GLY  48           HA2      GLY  48 -23.657   8.187  -6.950
    3    HA2  GLY  48           HA3      GLY  48 -23.473   9.190  -5.510

  No H/Q in entry =           3
  In of MODEL   87
    1    H    GLN  49           H        GLN  49 -23.030  11.642  -7.082
    2    HA   GLN  49           HA       GLN  49 -25.644  12.619  -7.205
    3    HB2  GLN  49           HB2      GLN  49 -23.160  13.616  -8.583
    4    HB3  GLN  49           HB3      GLN  49 -24.669  14.503  -8.487
    5    HG2  GLN  49           HG2      GLN  49 -24.493  14.533  -6.051
    6    HG3  GLN  49           HG3      GLN  49 -22.995  13.624  -6.146
    7   HE21  GLN  49          HE21      GLN  49 -22.985  15.854  -4.871
    8   HE22  GLN  49          HE22      GLN  49 -22.134  17.157  -5.523

  No H/Q in entry =           8
  In of MODEL   87
    1    H    ASN  50           H        ASN  50 -23.887  10.832  -9.608
    2    HA   ASN  50           HA       ASN  50 -25.830  11.607 -11.675
    3    HB2  ASN  50           HB2      ASN  50 -23.175  10.204 -11.930
    4    HB3  ASN  50           HB3      ASN  50 -24.256  10.577 -13.265
    5   HD21  ASN  50          HD21      ASN  50 -21.655  11.556 -11.672
    6   HD22  ASN  50          HD22      ASN  50 -21.510  13.202 -12.014

  No H/Q in entry =           6
  In of MODEL   87
    1    H    ALA  51           H        ALA  51 -25.676   9.252  -9.432
    2    HA   ALA  51           HA       ALA  51 -26.361   7.072 -11.257
    3    HB2  ALA  51           HB1      ALA  51 -25.696   5.753  -9.577
    4    HB3  ALA  51           HB2      ALA  51 -26.851   6.501  -8.474
    5    HB1  ALA  51           HB3      ALA  51 -25.247   7.206  -8.683

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ASP  52           H        ASP  52 -28.309   5.915 -11.103
    2    HA   ASP  52           HA       ASP  52 -30.576   7.632 -10.419
    3    HB2  ASP  52           HB2      ASP  52 -30.269   5.142 -12.094
    4    HB3  ASP  52           HB3      ASP  52 -31.846   5.794 -11.646

  No H/Q in entry =           4
  In of MODEL   87
    1    H    VAL  53           H        VAL  53 -28.821   4.828  -9.419
    2    HA   VAL  53           HA       VAL  53 -30.248   4.878  -6.892
    3    HB   VAL  53           HB       VAL  53 -31.570   3.169  -8.128
    4   HG11  VAL  53          HG11      VAL  53 -29.793   2.401  -9.665
    5   HG13  VAL  53          HG12      VAL  53 -30.552   1.064  -8.800
    6   HG12  VAL  53          HG13      VAL  53 -28.967   1.647  -8.302
    7   HG23  VAL  53          HG21      VAL  53 -30.635   1.234  -6.445
    8   HG22  VAL  53          HG22      VAL  53 -31.826   2.479  -6.068
    9   HG21  VAL  53          HG23      VAL  53 -30.128   2.737  -5.673

  No H/Q in entry =           9
  In of MODEL   87
    1    H    VAL  54           H        VAL  54 -28.901   4.510  -5.248
    2    HA   VAL  54           HA       VAL  54 -26.106   3.804  -5.881
    3    HB   VAL  54           HB       VAL  54 -27.248   5.522  -3.621
    4   HG11  VAL  54          HG11      VAL  54 -24.603   4.235  -3.934
    5   HG13  VAL  54          HG12      VAL  54 -25.379   4.874  -2.484
    6   HG12  VAL  54          HG13      VAL  54 -24.535   5.964  -3.586
    7   HG22  VAL  54          HG21      VAL  54 -26.490   7.379  -4.724
    8   HG21  VAL  54          HG22      VAL  54 -26.998   6.364  -6.073
    9   HG23  VAL  54          HG23      VAL  54 -25.291   6.474  -5.648

  No H/Q in entry =           9
  In of MODEL   87
    1    H    LEU  55           H        LEU  55 -25.414   1.913  -5.246
    2    HA   LEU  55           HA       LEU  55 -26.837   0.526  -3.061
    3    HB2  LEU  55           HB2      LEU  55 -25.241  -0.560  -5.370
    4    HB3  LEU  55           HB3      LEU  55 -25.943  -1.533  -4.077
    5    HG   LEU  55           HG       LEU  55 -27.474  -0.018  -6.182
    6   HD13  LEU  55          HD11      LEU  55 -27.092  -1.852  -7.406
    7   HD12  LEU  55          HD12      LEU  55 -27.994  -2.775  -6.205
    8   HD11  LEU  55          HD13      LEU  55 -26.243  -2.622  -6.067
    9   HD23  LEU  55          HD21      LEU  55 -28.655  -2.029  -4.319
   10   HD22  LEU  55          HD22      LEU  55 -29.425  -0.682  -5.160
   11   HD21  LEU  55          HD23      LEU  55 -28.409  -0.377  -3.752

  No H/Q in entry =          11
  In of MODEL   87
    1    H    LEU  56           H        LEU  56 -25.643  -0.012  -1.266
    2    HA   LEU  56           HA       LEU  56 -22.732   0.530  -1.337
    3    HB2  LEU  56           HB2      LEU  56 -24.504   0.226   1.076
    4    HB3  LEU  56           HB3      LEU  56 -22.819   0.740   1.052
    5    HG   LEU  56           HG       LEU  56 -25.206   2.303   0.108
    6   HD11  LEU  56          HD11      LEU  56 -24.055   1.975   2.619
    7   HD13  LEU  56          HD12      LEU  56 -25.116   3.293   2.123
    8   HD12  LEU  56          HD13      LEU  56 -23.366   3.486   2.022
    9   HD23  LEU  56          HD21      LEU  56 -23.350   4.097  -0.098
   10   HD22  LEU  56          HD22      LEU  56 -23.688   2.984  -1.423
   11   HD21  LEU  56          HD23      LEU  56 -22.310   2.698  -0.362

  No H/Q in entry =          11
  In of MODEL   87
    1    H    GLY  57           H        GLY  57 -21.269  -1.031  -0.816
    2    HA3  GLY  57           HA2      GLY  57 -22.057  -3.759  -1.010
    3    HA2  GLY  57           HA3      GLY  57 -20.458  -3.184  -0.542

  No H/Q in entry =           3
  In of MODEL   87
    1    HA   PRO  58           HA       PRO  58 -23.183  -4.366   3.187
    2    HB2  PRO  58           HB2      PRO  58 -22.365  -6.934   3.785
    3    HB3  PRO  58           HB3      PRO  58 -23.776  -6.595   2.783
    4    HG2  PRO  58           HG2      PRO  58 -21.014  -7.337   1.975
    5    HG3  PRO  58           HG3      PRO  58 -22.558  -7.874   1.315
    6    HD2  PRO  58           HD2      PRO  58 -21.051  -5.978   0.082
    7    HD3  PRO  58           HD3      PRO  58 -22.814  -5.979  -0.007

  No H/Q in entry =           7
  In of MODEL   87
    1    H    GLN  59           H        GLN  59 -19.797  -4.670   2.554
    2    HA   GLN  59           HA       GLN  59 -19.022  -4.653   5.309
    3    HB2  GLN  59           HB2      GLN  59 -17.518  -3.769   2.843
    4    HB3  GLN  59           HB3      GLN  59 -16.823  -3.846   4.449
    5    HG2  GLN  59           HG2      GLN  59 -17.926  -6.177   2.889
    6    HG3  GLN  59           HG3      GLN  59 -16.225  -5.787   3.086
    7   HE21  GLN  59          HE21      GLN  59 -18.300  -7.693   4.027
    8   HE22  GLN  59          HE22      GLN  59 -18.039  -8.314   5.549

  No H/Q in entry =           8
  In of MODEL   87
    1    H    ILE  60           H        ILE  60 -20.098  -2.149   3.112
    2    HA   ILE  60           HA       ILE  60 -19.328  -0.155   5.153
    3    HB   ILE  60           HB       ILE  60 -19.669   1.562   3.327
    4   HG12  ILE  60          HG12      ILE  60 -19.354  -0.657   1.348
    5   HG13  ILE  60          HG13      ILE  60 -20.966  -0.199   1.899
    6   HG21  ILE  60          HG21      ILE  60 -17.473   0.533   4.068
    7   HG23  ILE  60          HG22      ILE  60 -17.505   1.378   2.522
    8   HG22  ILE  60          HG23      ILE  60 -17.540  -0.384   2.564
    9   HD12  ILE  60          HD11      ILE  60 -19.013   1.356   0.248
   10   HD11  ILE  60          HD12      ILE  60 -20.171   2.225   1.255
   11   HD13  ILE  60          HD13      ILE  60 -20.744   1.118   0.006

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ALA  61           H        ALA  61 -21.701  -1.859   5.239
    2    HA   ALA  61           HA       ALA  61 -24.010  -0.307   4.799
    3    HB1  ALA  61           HB1      ALA  61 -25.141  -1.855   6.132
    4    HB2  ALA  61           HB2      ALA  61 -23.718  -2.177   7.124
    5    HB3  ALA  61           HB3      ALA  61 -23.796  -2.785   5.470

  No H/Q in entry =           5
  In of MODEL   87
    1    H    TYR  62           H        TYR  62 -21.779  -0.312   7.580
    2    HA   TYR  62           HA       TYR  62 -23.402   1.265   9.265
    3    HB2  TYR  62           HB2      TYR  62 -21.384   1.777  10.492
    4    HB3  TYR  62           HB3      TYR  62 -21.343   0.083  10.004
    5    HD1  TYR  62           HD1      TYR  62 -19.684  -0.720   8.397
    6    HD2  TYR  62           HD2      TYR  62 -19.805   3.405   9.509
    7    HE1  TYR  62           HE1      TYR  62 -17.493  -0.371   7.322
    8    HE2  TYR  62           HE2      TYR  62 -17.599   3.748   8.435
    9    HH   TYR  62           HH       TYR  62 -16.091   1.186   6.574

  No H/Q in entry =           9
  In of MODEL   87
    1    H    MET  63           H        MET  63 -21.825   2.206   6.397
    2    HA   MET  63           HA       MET  63 -21.792   5.043   7.094
    3    HB2  MET  63           HB2      MET  63 -21.126   3.549   4.557
    4    HB3  MET  63           HB3      MET  63 -21.028   5.303   4.728
    5    HG2  MET  63           HG2      MET  63 -19.304   5.031   6.436
    6    HG3  MET  63           HG3      MET  63 -19.390   3.282   6.234
    7    HE3  MET  63           HE1      MET  63 -16.108   4.572   4.790
    8    HE2  MET  63           HE2      MET  63 -16.618   2.884   4.795
    9    HE1  MET  63           HE3      MET  63 -17.003   3.925   6.167

  No H/Q in entry =           9
  In of MODEL   87
    1    H    LEU  64           H        LEU  64 -24.269   3.066   6.146
    2    HA   LEU  64           HA       LEU  64 -25.563   4.425   4.080
    3    HB2  LEU  64           HB2      LEU  64 -26.321   2.279   5.001
    4    HB3  LEU  64           HB3      LEU  64 -26.807   3.097   6.486
    5    HG   LEU  64           HG       LEU  64 -28.571   4.269   5.273
    6   HD13  LEU  64          HD11      LEU  64 -28.317   4.525   3.038
    7   HD12  LEU  64          HD12      LEU  64 -28.884   2.861   2.896
    8   HD11  LEU  64          HD13      LEU  64 -27.155   3.203   2.941
    9   HD23  LEU  64          HD21      LEU  64 -28.958   1.435   4.525
   10   HD22  LEU  64          HD22      LEU  64 -29.992   2.518   5.455
   11   HD21  LEU  64          HD23      LEU  64 -28.574   1.792   6.209

  No H/Q in entry =          11
  In of MODEL   87
    1    HA   PRO  65           HA       PRO  65 -27.871   7.468   6.852
    2    HB2  PRO  65           HB2      PRO  65 -25.863   7.720   9.090
    3    HB3  PRO  65           HB3      PRO  65 -27.613   7.917   9.151
    4    HG2  PRO  65           HG2      PRO  65 -26.569   5.710  10.067
    5    HG3  PRO  65           HG3      PRO  65 -27.993   5.609   9.033
    6    HD2  PRO  65           HD2      PRO  65 -25.101   5.134   8.306
    7    HD3  PRO  65           HD3      PRO  65 -26.518   4.179   7.869

  No H/Q in entry =           7
  In of MODEL   87
    1    H    GLU  66           H        GLU  66 -24.317   7.583   6.896
    2    HA   GLU  66           HA       GLU  66 -24.157  10.392   6.492
    3    HB2  GLU  66           HB2      GLU  66 -22.241   8.175   5.824
    4    HB3  GLU  66           HB3      GLU  66 -21.874   9.887   5.615
    5    HG2  GLU  66           HG2      GLU  66 -22.084  10.244   7.984
    6    HG3  GLU  66           HG3      GLU  66 -22.527   8.554   8.218

  No H/Q in entry =           6
  In of MODEL   87
    1    H    ILE  67           H        ILE  67 -24.146   7.647   4.238
    2    HA   ILE  67           HA       ILE  67 -23.830   9.376   1.944
    3    HB   ILE  67           HB       ILE  67 -24.589   6.429   2.127
    4   HG12  ILE  67          HG12      ILE  67 -22.024   7.722   1.185
    5   HG13  ILE  67          HG13      ILE  67 -22.285   7.288   2.873
    6   HG21  ILE  67          HG21      ILE  67 -24.638   8.310  -0.096
    7   HG23  ILE  67          HG22      ILE  67 -25.184   6.634  -0.042
    8   HG22  ILE  67          HG23      ILE  67 -23.494   6.999  -0.384
    9   HD12  ILE  67          HD11      ILE  67 -21.802   5.540   0.518
   10   HD11  ILE  67          HD12      ILE  67 -22.777   4.919   1.848
   11   HD13  ILE  67          HD13      ILE  67 -21.125   5.461   2.145

  No H/Q in entry =          11
  In of MODEL   87
    1    H    GLN  68           H        GLN  68 -26.634   8.187   3.599
    2    HA   GLN  68           HA       GLN  68 -28.520   9.033   1.642
    3    HB2  GLN  68           HB2      GLN  68 -28.734   8.662   4.626
    4    HB3  GLN  68           HB3      GLN  68 -30.088   9.196   3.645
    5    HG2  GLN  68           HG2      GLN  68 -30.033   7.168   2.365
    6    HG3  GLN  68           HG3      GLN  68 -28.552   6.658   3.155
    7   HE21  GLN  68          HE21      GLN  68 -30.668   5.201   3.036
    8   HE22  GLN  68          HE22      GLN  68 -31.463   4.707   4.457

  No H/Q in entry =           8
  In of MODEL   87
    1    H    ARG  69           H        ARG  69 -26.970  10.769   4.367
    2    HA   ARG  69           HA       ARG  69 -28.449  13.188   3.976
    3    HB2  ARG  69           HB2      ARG  69 -26.052  12.363   5.544
    4    HB3  ARG  69           HB3      ARG  69 -26.211  14.078   5.189
    5    HG2  ARG  69           HG2      ARG  69 -28.520  14.015   6.180
    6    HG3  ARG  69           HG3      ARG  69 -28.231  12.335   6.649
    7    HD2  ARG  69           HD2      ARG  69 -26.638  14.764   7.553
    8    HD3  ARG  69           HD3      ARG  69 -27.718  13.806   8.555
    9    HE   ARG  69           HE       ARG  69 -25.074  12.995   7.582
   10   HH21  ARG  69          HH11      ARG  69 -24.177  11.268   8.769
   11   HH22  ARG  69          HH12      ARG  69 -25.158  10.405   9.905
   12   HH11  ARG  69          HH21      ARG  69 -27.989  12.313   9.304
   13   HH12  ARG  69          HH22      ARG  69 -27.317  10.995  10.206

  No H/Q in entry =          13
  In of MODEL   87
    1    H    LEU  70           H        LEU  70 -25.529  11.913   2.590
    2    HA   LEU  70           HA       LEU  70 -24.533  14.327   1.416
    3    HB2  LEU  70           HB2      LEU  70 -23.431  12.055   2.000
    4    HB3  LEU  70           HB3      LEU  70 -24.038  11.564   0.419
    5    HG   LEU  70           HG       LEU  70 -22.516  13.008  -0.678
    6   HD11  LEU  70          HD11      LEU  70 -21.709  13.883   2.104
    7   HD13  LEU  70          HD12      LEU  70 -22.460  14.887   0.864
    8   HD12  LEU  70          HD13      LEU  70 -20.822  14.279   0.629
    9   HD22  LEU  70          HD21      LEU  70 -21.006  11.356  -0.460
   10   HD21  LEU  70          HD22      LEU  70 -21.897  10.791   0.954
   11   HD23  LEU  70          HD23      LEU  70 -20.559  11.923   1.148

  No H/Q in entry =          11
  In of MODEL   87
    1    H    LEU  71           H        LEU  71 -26.581  11.692   0.316
    2    HA   LEU  71           HA       LEU  71 -27.192  13.158  -2.194
    3    HB2  LEU  71           HB2      LEU  71 -27.264  10.167  -1.750
    4    HB3  LEU  71           HB3      LEU  71 -27.443  11.023  -3.281
    5    HG   LEU  71           HG       LEU  71 -24.911  11.144  -1.642
    6   HD12  LEU  71          HD11      LEU  71 -24.914   9.517  -4.076
    7   HD11  LEU  71          HD12      LEU  71 -25.886   8.849  -2.765
    8   HD13  LEU  71          HD13      LEU  71 -24.178   9.202  -2.504
    9   HD22  LEU  71          HD21      LEU  71 -25.106  12.955  -3.132
   10   HD21  LEU  71          HD22      LEU  71 -25.570  11.894  -4.461
   11   HD23  LEU  71          HD23      LEU  71 -23.937  11.817  -3.797

  No H/Q in entry =          11
  In of MODEL   87
    1    HA   PRO  72           HA       PRO  72 -31.013  12.540   0.460
    2    HB2  PRO  72           HB2      PRO  72 -31.978  15.063   0.390
    3    HB3  PRO  72           HB3      PRO  72 -30.642  14.666   1.469
    4    HG2  PRO  72           HG2      PRO  72 -30.531  15.871  -1.285
    5    HG3  PRO  72           HG3      PRO  72 -29.775  16.452   0.199
    6    HD2  PRO  72           HD2      PRO  72 -28.389  14.953  -1.581
    7    HD3  PRO  72           HD3      PRO  72 -28.112  14.795   0.153

  No H/Q in entry =           7
  In of MODEL   87
    1    H    ASN  73           H        ASN  73 -30.458  13.525  -2.759
    2    HA   ASN  73           HA       ASN  73 -33.308  13.098  -3.366
    3    HB2  ASN  73           HB2      ASN  73 -32.907  14.225  -5.466
    4    HB3  ASN  73           HB3      ASN  73 -32.414  15.224  -4.108
    5   HD21  ASN  73          HD21      ASN  73 -31.644  15.306  -6.792
    6   HD22  ASN  73          HD22      ASN  73 -29.973  15.214  -6.999

  No H/Q in entry =           6
  In of MODEL   87
    1    H    LYS  74           H        LYS  74 -31.232  10.926  -2.962
    2    HA   LYS  74           HA       LYS  74 -31.764   9.512  -5.507
    3    HB2  LYS  74           HB2      LYS  74 -29.207   9.322  -3.908
    4    HB3  LYS  74           HB3      LYS  74 -29.571   8.496  -5.424
    5    HG2  LYS  74           HG2      LYS  74 -29.426  11.475  -5.220
    6    HG3  LYS  74           HG3      LYS  74 -28.012  10.469  -5.538
    7    HD2  LYS  74           HD2      LYS  74 -29.108   9.499  -7.473
    8    HD3  LYS  74           HD3      LYS  74 -30.564  10.436  -7.139
    9    HE2  LYS  74           HE2      LYS  74 -29.424  12.492  -7.589
   10    HE3  LYS  74           HE3      LYS  74 -27.869  11.664  -7.695
   11    HZ2  LYS  74           HZ1      LYS  74 -29.382  12.209  -9.807
   12    HZ1  LYS  74           HZ2      LYS  74 -29.971  10.661  -9.430
   13    HZ3  LYS  74           HZ3      LYS  74 -28.316  10.889  -9.742

  No H/Q in entry =          13
  In of MODEL   87
    1    HA   PRO  75           HA       PRO  75 -33.011   6.470  -2.528
    2    HB2  PRO  75           HB2      PRO  75 -33.245   4.243  -4.111
    3    HB3  PRO  75           HB3      PRO  75 -34.425   5.550  -4.169
    4    HG2  PRO  75           HG2      PRO  75 -32.081   5.050  -5.961
    5    HG3  PRO  75           HG3      PRO  75 -33.749   5.421  -6.393
    6    HD2  PRO  75           HD2      PRO  75 -31.884   7.362  -6.364
    7    HD3  PRO  75           HD3      PRO  75 -33.526   7.695  -5.811

  No H/Q in entry =           7
  In of MODEL   87
    1    H    VAL  76           H        VAL  76 -31.505   5.473  -1.170
    2    HA   VAL  76           HA       VAL  76 -29.003   4.364  -2.299
    3    HB   VAL  76           HB       VAL  76 -29.327   5.815   0.363
    4   HG11  VAL  76          HG11      VAL  76 -26.933   4.624  -1.051
    5   HG13  VAL  76          HG12      VAL  76 -27.598   4.145   0.512
    6   HG12  VAL  76          HG13      VAL  76 -26.816   5.714   0.332
    7   HG22  VAL  76          HG21      VAL  76 -28.743   7.742  -0.527
    8   HG21  VAL  76          HG22      VAL  76 -29.270   7.026  -2.052
    9   HG23  VAL  76          HG23      VAL  76 -27.563   7.005  -1.612

  No H/Q in entry =           9
  In of MODEL   87
    1    H    GLU  77           H        GLU  77 -28.694   2.219  -1.691
    2    HA   GLU  77           HA       GLU  77 -29.427   1.399   0.969
    3    HB2  GLU  77           HB2      GLU  77 -30.972  -0.311   0.450
    4    HB3  GLU  77           HB3      GLU  77 -31.587   1.189  -0.246
    5    HG2  GLU  77           HG2      GLU  77 -30.967   0.458  -2.439
    6    HG3  GLU  77           HG3      GLU  77 -30.260  -1.013  -1.773

  No H/Q in entry =           6
  In of MODEL   87
    1    H    VAL  78           H        VAL  78 -29.011  -0.674   1.624
    2    HA   VAL  78           HA       VAL  78 -26.323  -1.337   0.712
    3    HB   VAL  78           HB       VAL  78 -27.975  -2.291   3.090
    4   HG11  VAL  78          HG11      VAL  78 -25.597  -3.424   1.946
    5   HG13  VAL  78          HG12      VAL  78 -26.473  -3.931   3.391
    6   HG12  VAL  78          HG13      VAL  78 -25.201  -2.718   3.512
    7   HG22  VAL  78          HG21      VAL  78 -26.561  -0.872   4.419
    8   HG21  VAL  78          HG22      VAL  78 -27.346   0.069   3.151
    9   HG23  VAL  78          HG23      VAL  78 -25.650  -0.391   2.986

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ILE  79           H        ILE  79 -25.718  -3.221  -0.200
    2    HA   ILE  79           HA       ILE  79 -27.728  -4.780  -1.532
    3    HB   ILE  79           HB       ILE  79 -24.717  -5.186  -1.335
    4   HG12  ILE  79          HG12      ILE  79 -26.416  -4.147  -3.609
    5   HG13  ILE  79          HG13      ILE  79 -25.573  -3.103  -2.463
    6   HG22  ILE  79          HG21      ILE  79 -25.790  -6.407  -3.647
    7   HG21  ILE  79          HG22      ILE  79 -26.741  -6.969  -2.272
    8   HG23  ILE  79          HG23      ILE  79 -24.989  -7.177  -2.276
    9   HD13  ILE  79          HD11      ILE  79 -24.171  -3.159  -4.292
   10   HD12  ILE  79          HD12      ILE  79 -24.444  -4.879  -4.572
   11   HD11  ILE  79          HD13      ILE  79 -23.469  -4.352  -3.199

  No H/Q in entry =          11
  In of MODEL   87
    1    H    ASP  80           H        ASP  80 -28.509  -6.737  -0.943
    2    HA   ASP  80           HA       ASP  80 -28.398  -7.635   1.702
    3    HB2  ASP  80           HB2      ASP  80 -30.140  -8.282   0.077
    4    HB3  ASP  80           HB3      ASP  80 -28.949  -9.240  -0.803

  No H/Q in entry =           4
  In of MODEL   87
    1    H    SER  81           H        SER  81 -26.808  -8.709   2.818
    2    HA   SER  81           HA       SER  81 -24.296  -9.288   1.606
    3    HB2  SER  81           HB2      SER  81 -23.626 -10.184   3.750
    4    HB3  SER  81           HB3      SER  81 -24.572  -8.722   4.028
    5    HG   SER  81           HG       SER  81 -25.609 -11.342   4.114

  No H/Q in entry =           5
  In of MODEL   87
    1    H    LEU  82           H        LEU  82 -26.918 -11.487   1.948
    2    HA   LEU  82           HA       LEU  82 -25.280 -13.791   1.414
    3    HB2  LEU  82           HB2      LEU  82 -28.241 -13.298   1.176
    4    HB3  LEU  82           HB3      LEU  82 -27.471 -14.870   0.970
    5    HG   LEU  82           HG       LEU  82 -27.456 -13.276   3.516
    6   HD13  LEU  82          HD11      LEU  82 -29.702 -13.983   3.148
    7   HD12  LEU  82          HD12      LEU  82 -28.994 -15.180   4.234
    8   HD11  LEU  82          HD13      LEU  82 -29.179 -15.547   2.520
    9   HD22  LEU  82          HD21      LEU  82 -25.558 -14.654   3.480
   10   HD21  LEU  82          HD22      LEU  82 -26.400 -15.943   2.620
   11   HD23  LEU  82          HD23      LEU  82 -26.763 -15.633   4.318

  No H/Q in entry =          11
  In of MODEL   87
    1    H    LEU  83           H        LEU  83 -27.342 -11.646  -0.488
    2    HA   LEU  83           HA       LEU  83 -27.107 -12.994  -2.962
    3    HB2  LEU  83           HB2      LEU  83 -27.629 -10.106  -2.308
    4    HB3  LEU  83           HB3      LEU  83 -27.648 -10.751  -3.949
    5    HG   LEU  83           HG       LEU  83 -29.646 -11.220  -1.756
    6   HD13  LEU  83          HD11      LEU  83 -30.484  -9.404  -2.814
    7   HD12  LEU  83          HD12      LEU  83 -30.913 -10.535  -4.095
    8   HD11  LEU  83          HD13      LEU  83 -29.416  -9.608  -4.199
    9   HD23  LEU  83          HD21      LEU  83 -29.757 -12.482  -4.480
   10   HD22  LEU  83          HD22      LEU  83 -30.700 -12.872  -3.043
   11   HD21  LEU  83          HD23      LEU  83 -28.994 -13.306  -3.121

  No H/Q in entry =          11
  In of MODEL   87
    1    H    TYR  84           H        TYR  84 -25.237 -10.532  -1.300
    2    HA   TYR  84           HA       TYR  84 -23.414  -9.970  -3.446
    3    HB2  TYR  84           HB2      TYR  84 -23.948  -8.470  -1.472
    4    HB3  TYR  84           HB3      TYR  84 -22.972  -9.557  -0.486
    5    HD1  TYR  84           HD1      TYR  84 -20.524  -9.941  -1.255
    6    HD2  TYR  84           HD2      TYR  84 -22.931  -6.668  -2.570
    7    HE1  TYR  84           HE1      TYR  84 -18.480  -8.720  -1.919
    8    HE2  TYR  84           HE2      TYR  84 -20.897  -5.441  -3.248
    9    HH   TYR  84           HH       TYR  84 -18.489  -6.085  -3.908

  No H/Q in entry =           9
  In of MODEL   87
    1    H    GLY  85           H        GLY  85 -23.069 -11.962  -0.502
    2    HA3  GLY  85           HA2      GLY  85 -20.460 -12.801  -1.007
    3    HA2  GLY  85           HA3      GLY  85 -21.647 -13.696  -0.059

  No H/Q in entry =           3
  In of MODEL   87
    1    H    LYS  86           H        LYS  86 -23.494 -14.142  -2.104
    2    HA   LYS  86           HA       LYS  86 -22.357 -16.473  -3.374
    3    HB2  LYS  86           HB2      LYS  86 -24.617 -16.348  -2.371
    4    HB3  LYS  86           HB3      LYS  86 -25.067 -15.160  -3.593
    5    HG2  LYS  86           HG2      LYS  86 -24.872 -16.815  -5.318
    6    HG3  LYS  86           HG3      LYS  86 -24.328 -18.009  -4.139
    7    HD2  LYS  86           HD2      LYS  86 -26.433 -17.715  -2.889
    8    HD3  LYS  86           HD3      LYS  86 -26.977 -16.554  -4.098
    9    HE2  LYS  86           HE2      LYS  86 -26.261 -19.419  -4.701
   10    HE3  LYS  86           HE3      LYS  86 -27.902 -18.843  -4.413
   11    HZ2  LYS  86           HZ1      LYS  86 -26.133 -18.356  -6.691
   12    HZ1  LYS  86           HZ2      LYS  86 -27.181 -17.100  -6.232
   13    HZ3  LYS  86           HZ3      LYS  86 -27.810 -18.618  -6.658

  No H/Q in entry =          13
  In of MODEL   87
    1    H    VAL  87           H        VAL  87 -22.483 -13.260  -4.266
    2    HA   VAL  87           HA       VAL  87 -22.248 -12.075  -6.209
    3    HB   VAL  87           HB       VAL  87 -21.090 -14.542  -7.541
    4   HG11  VAL  87          HG11      VAL  87 -21.401 -12.143  -8.577
    5   HG13  VAL  87          HG12      VAL  87 -19.889 -13.014  -8.838
    6   HG12  VAL  87          HG13      VAL  87 -19.980 -11.751  -7.611
    7   HG23  VAL  87          HG21      VAL  87 -18.888 -13.891  -6.532
    8   HG22  VAL  87          HG22      VAL  87 -20.037 -14.627  -5.416
    9   HG21  VAL  87          HG23      VAL  87 -19.785 -12.882  -5.399

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ASP  88           H        ASP  88 -24.732 -12.819  -5.837
    2    HA   ASP  88           HA       ASP  88 -25.825 -14.080  -8.225
    3    HB2  ASP  88           HB2      ASP  88 -26.788 -14.364  -5.892
    4    HB3  ASP  88           HB3      ASP  88 -27.311 -12.682  -5.988

  No H/Q in entry =           4
  In of MODEL   87
    1    H    GLY  89           H        GLY  89 -25.185 -12.794  -9.871
    2    HA3  GLY  89           HA2      GLY  89 -25.482 -10.032 -10.070
    3    HA2  GLY  89           HA3      GLY  89 -25.423 -11.151 -11.431

  No H/Q in entry =           3
  In of MODEL   87
    1    H    LEU  90           H        LEU  90 -27.809 -12.601 -10.962
    2    HA   LEU  90           HA       LEU  90 -29.707 -10.742 -12.059
    3    HB2  LEU  90           HB2      LEU  90 -29.679 -13.139 -12.639
    4    HB3  LEU  90           HB3      LEU  90 -30.155 -13.525 -10.986
    5    HG   LEU  90           HG       LEU  90 -32.320 -12.495 -11.330
    6   HD13  LEU  90          HD11      LEU  90 -32.226 -10.749 -12.806
    7   HD12  LEU  90          HD12      LEU  90 -32.724 -12.008 -13.938
    8   HD11  LEU  90          HD13      LEU  90 -31.026 -11.543 -13.829
    9   HD23  LEU  90          HD21      LEU  90 -32.206 -14.122 -13.766
   10   HD22  LEU  90          HD22      LEU  90 -33.165 -14.326 -12.300
   11   HD21  LEU  90          HD23      LEU  90 -31.488 -14.871 -12.339

  No H/Q in entry =          11
  In of MODEL   87
    1    H    GLY  91           H        GLY  91 -29.449 -12.234  -8.877
    2    HA3  GLY  91           HA2      GLY  91 -31.822 -11.218  -7.816
    3    HA2  GLY  91           HA3      GLY  91 -30.402 -11.693  -6.886

  No H/Q in entry =           3
  In of MODEL   87
    1    H    VAL  92           H        VAL  92 -28.567  -9.789  -7.760
    2    HA   VAL  92           HA       VAL  92 -29.438  -7.522  -6.204
    3    HB   VAL  92           HB       VAL  92 -26.890  -7.887  -7.822
    4   HG12  VAL  92          HG11      VAL  92 -27.111  -6.010  -5.494
    5   HG11  VAL  92          HG12      VAL  92 -27.811  -5.494  -7.030
    6   HG13  VAL  92          HG13      VAL  92 -26.097  -5.893  -6.933
    7   HG22  VAL  92          HG21      VAL  92 -26.587  -9.464  -6.232
    8   HG21  VAL  92          HG22      VAL  92 -27.753  -8.731  -5.129
    9   HG23  VAL  92          HG23      VAL  92 -26.127  -8.063  -5.265

  No H/Q in entry =           9
  In of MODEL   87
    1    H    LEU  93           H        LEU  93 -29.036  -8.168  -9.627
    2    HA   LEU  93           HA       LEU  93 -29.498  -5.549 -10.554
    3    HB2  LEU  93           HB2      LEU  93 -28.793  -7.377 -12.021
    4    HB3  LEU  93           HB3      LEU  93 -30.351  -8.169 -11.783
    5    HG   LEU  93           HG       LEU  93 -31.453  -6.250 -12.899
    6   HD11  LEU  93          HD11      LEU  93 -29.665  -4.579 -12.412
    7   HD13  LEU  93          HD12      LEU  93 -30.118  -4.628 -14.117
    8   HD12  LEU  93          HD13      LEU  93 -28.628  -5.402 -13.578
    9   HD23  LEU  93          HD21      LEU  93 -30.412  -6.774 -15.196
   10   HD22  LEU  93          HD22      LEU  93 -31.194  -8.065 -14.282
   11   HD21  LEU  93          HD23      LEU  93 -29.433  -7.936 -14.300

  No H/Q in entry =          11
  In of MODEL   87
    1    H    LYS  94           H        LYS  94 -31.758  -8.191  -9.683
    2    HA   LYS  94           HA       LYS  94 -34.166  -6.848 -10.286
    3    HB2  LYS  94           HB2      LYS  94 -33.544  -9.009  -8.279
    4    HB3  LYS  94           HB3      LYS  94 -35.170  -8.380  -8.532
    5    HG2  LYS  94           HG2      LYS  94 -35.073  -9.152 -10.867
    6    HG3  LYS  94           HG3      LYS  94 -33.480  -9.837 -10.554
    7    HD2  LYS  94           HD2      LYS  94 -34.528 -11.216  -8.718
    8    HD3  LYS  94           HD3      LYS  94 -36.101 -10.633  -9.259
    9    HE2  LYS  94           HE2      LYS  94 -35.568 -11.541 -11.530
   10    HE3  LYS  94           HE3      LYS  94 -34.117 -12.264 -10.840
   11    HZ3  LYS  94           HZ1      LYS  94 -35.904 -13.861 -10.993
   12    HZ2  LYS  94           HZ2      LYS  94 -36.910 -12.876 -10.043
   13    HZ1  LYS  94           HZ3      LYS  94 -35.514 -13.567  -9.367

  No H/Q in entry =          13
  In of MODEL   87
    1    H    ALA  95           H        ALA  95 -32.310  -6.891  -7.254
    2    HA   ALA  95           HA       ALA  95 -34.210  -5.389  -5.758
    3    HB2  ALA  95           HB1      ALA  95 -31.775  -6.665  -5.243
    4    HB3  ALA  95           HB2      ALA  95 -32.778  -5.800  -4.080
    5    HB1  ALA  95           HB3      ALA  95 -31.473  -4.959  -4.914

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ALA  96           H        ALA  96 -31.624  -4.427  -7.880
    2    HA   ALA  96           HA       ALA  96 -31.634  -1.664  -7.106
    3    HB2  ALA  96           HB1      ALA  96 -30.303  -1.383  -9.228
    4    HB3  ALA  96           HB2      ALA  96 -30.539  -3.101  -9.545
    5    HB1  ALA  96           HB3      ALA  96 -29.632  -2.584  -8.124

  No H/Q in entry =           5
  In of MODEL   87
    1    H    VAL  97           H        VAL  97 -33.120  -3.440  -9.779
    2    HA   VAL  97           HA       VAL  97 -34.294  -1.186 -11.024
    3    HB   VAL  97           HB       VAL  97 -34.985  -4.142 -11.059
    4   HG11  VAL  97          HG11      VAL  97 -36.861  -2.210 -11.528
    5   HG13  VAL  97          HG12      VAL  97 -36.863  -3.804 -12.284
    6   HG12  VAL  97          HG13      VAL  97 -36.172  -2.425 -13.138
    7   HG21  VAL  97          HG21      VAL  97 -33.800  -2.265 -13.106
    8   HG23  VAL  97          HG22      VAL  97 -34.187  -3.961 -13.391
    9   HG22  VAL  97          HG23      VAL  97 -32.944  -3.525 -12.217

  No H/Q in entry =           9
  In of MODEL   87
    1    H    ALA  98           H        ALA  98 -35.365  -3.411  -8.477
    2    HA   ALA  98           HA       ALA  98 -37.966  -2.365  -8.102
    3    HB1  ALA  98           HB1      ALA  98 -36.856  -4.522  -7.079
    4    HB3  ALA  98           HB2      ALA  98 -38.063  -3.645  -6.136
    5    HB2  ALA  98           HB3      ALA  98 -36.347  -3.428  -5.793

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ALA  99           H        ALA  99 -34.905  -1.445  -6.482
    2    HA   ALA  99           HA       ALA  99 -36.096   0.492  -4.809
    3    HB1  ALA  99           HB1      ALA  99 -33.422  -0.293  -5.582
    4    HB2  ALA  99           HB2      ALA  99 -33.987   0.436  -4.078
    5    HB3  ALA  99           HB3      ALA  99 -33.564   1.460  -5.449

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ILE 100           H        ILE 100 -35.094   0.664  -8.174
    2    HA   ILE 100           HA       ILE 100 -35.385   3.504  -8.390
    3    HB   ILE 100           HB       ILE 100 -35.416   1.348 -10.530
    4   HG12  ILE 100          HG12      ILE 100 -33.325   3.422  -9.877
    5   HG13  ILE 100          HG13      ILE 100 -33.292   1.775  -9.248
    6   HG21  ILE 100          HG21      ILE 100 -35.953   4.249 -10.654
    7   HG23  ILE 100          HG22      ILE 100 -36.420   2.963 -11.766
    8   HG22  ILE 100          HG23      ILE 100 -34.793   3.642 -11.836
    9   HD12  ILE 100          HD11      ILE 100 -32.823   2.753 -12.026
   10   HD11  ILE 100          HD12      ILE 100 -33.419   1.113 -11.767
   11   HD13  ILE 100          HD13      ILE 100 -31.884   1.616 -11.061

  No H/Q in entry =          11
  In of MODEL   87
    1    H    LYS 101           H        LYS 101 -37.582   0.808  -9.097
    2    HA   LYS 101           HA       LYS 101 -39.735   2.377 -10.075
    3    HB2  LYS 101           HB2      LYS 101 -39.502  -0.392  -8.951
    4    HB3  LYS 101           HB3      LYS 101 -41.085   0.310  -9.282
    5    HG2  LYS 101           HG2      LYS 101 -40.639   0.465 -11.583
    6    HG3  LYS 101           HG3      LYS 101 -38.925   0.125 -11.345
    7    HD2  LYS 101           HD2      LYS 101 -40.110  -1.829 -12.222
    8    HD3  LYS 101           HD3      LYS 101 -39.455  -2.137 -10.612
    9    HE2  LYS 101           HE2      LYS 101 -41.485  -2.911 -10.087
   10    HE3  LYS 101           HE3      LYS 101 -42.006  -1.225 -10.084
   11    HZ3  LYS 101           HZ1      LYS 101 -42.911  -1.415 -12.193
   12    HZ2  LYS 101           HZ2      LYS 101 -43.309  -2.906 -11.483
   13    HZ1  LYS 101           HZ3      LYS 101 -42.016  -2.806 -12.579

  No H/Q in entry =          13
  In of MODEL   87
    1    H    LYS 102           H        LYS 102 -39.157   0.917  -6.873
    2    HA   LYS 102           HA       LYS 102 -41.437   2.024  -5.653
    3    HB2  LYS 102           HB2      LYS 102 -40.121   0.206  -4.651
    4    HB3  LYS 102           HB3      LYS 102 -38.769   1.313  -4.420
    5    HG2  LYS 102           HG2      LYS 102 -40.125   2.654  -2.908
    6    HG3  LYS 102           HG3      LYS 102 -41.479   1.551  -3.143
    7    HD2  LYS 102           HD2      LYS 102 -40.173  -0.268  -2.131
    8    HD3  LYS 102           HD3      LYS 102 -38.819   0.838  -1.894
    9    HE2  LYS 102           HE2      LYS 102 -40.216   2.261  -0.472
   10    HE3  LYS 102           HE3      LYS 102 -41.589   1.186  -0.728
   11    HZ1  LYS 102           HZ1      LYS 102 -39.794  -0.502   0.257
   12    HZ3  LYS 102           HZ2      LYS 102 -40.928   0.339   1.198
   13    HZ2  LYS 102           HZ3      LYS 102 -39.340   0.925   1.058

  No H/Q in entry =          13
  In of MODEL   87
    1    H    ALA 103           H        ALA 103 -38.548   3.529  -6.690
    2    HA   ALA 103           HA       ALA 103 -38.842   5.831  -4.904
    3    HB2  ALA 103           HB1      ALA 103 -36.896   6.643  -6.496
    4    HB3  ALA 103           HB2      ALA 103 -36.798   4.929  -6.897
    5    HB1  ALA 103           HB3      ALA 103 -36.576   5.459  -5.230

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ALA 104           H        ALA 104 -39.466   5.081  -8.245
    2    HA   ALA 104           HA       ALA 104 -40.164   7.842  -8.858
    3    HB2  ALA 104           HB1      ALA 104 -40.201   7.176 -11.061
    4    HB1  ALA 104           HB2      ALA 104 -40.864   5.587 -10.679
    5    HB3  ALA 104           HB3      ALA 104 -39.151   5.915 -10.414

  No H/Q in entry =           5
  In of MODEL   87
    1    H    ALA 105           H        ALA 105 -41.673   5.674  -7.042
    2    HA   ALA 105           HA       ALA 105 -44.149   6.975  -6.990
    3    HB2  ALA 105           HB1      ALA 105 -44.879   6.089  -9.024
    4    HB3  ALA 105           HB2      ALA 105 -45.459   4.876  -7.883
    5    HB1  ALA 105           HB3      ALA 105 -43.986   4.584  -8.806

  No H/Q in entry =           5
  In of MODEL   88
    1    H1   ALA   1           H3       ALA   1 -12.493 -15.341  -2.291
    2    H2   ALA   1           H2       ALA   1 -11.577 -16.493  -3.145
    3    H3   ALA   1           H1       ALA   1 -12.712 -15.526  -3.964
    4    HA   ALA   1           HA       ALA   1 -14.136 -17.205  -3.722
    5    HB3  ALA   1           HB1      ALA   1 -12.764 -19.001  -3.281
    6    HB1  ALA   1           HB2      ALA   1 -13.506 -18.885  -1.685
    7    HB2  ALA   1           HB3      ALA   1 -11.921 -18.168  -1.975

  No H/Q in entry =           7
  In of MODEL   88
    1    H    GLU   2           H        GLU   2 -15.759 -18.043  -2.058
    2    HA   GLU   2           HA       GLU   2 -17.370 -16.302  -0.977
    3    HB2  GLU   2           HB2      GLU   2 -16.457 -18.751   0.547
    4    HB3  GLU   2           HB3      GLU   2 -17.965 -17.878   0.818
    5    HG2  GLU   2           HG2      GLU   2 -18.976 -18.939  -0.914
    6    HG3  GLU   2           HG3      GLU   2 -17.656 -18.554  -2.007

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLU   3           H        GLU   3 -15.458 -17.700   1.623
    2    HA   GLU   3           HA       GLU   3 -15.629 -15.352   3.195
    3    HB2  GLU   3           HB2      GLU   3 -14.083 -17.925   3.418
    4    HB3  GLU   3           HB3      GLU   3 -13.821 -16.615   4.570
    5    HG2  GLU   3           HG2      GLU   3 -16.009 -16.736   5.406
    6    HG3  GLU   3           HG3      GLU   3 -16.629 -17.519   3.958

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LEU   4           H        LEU   4 -12.710 -16.870   1.771
    2    HA   LEU   4           HA       LEU   4 -10.841 -14.999   2.364
    3    HB2  LEU   4           HB2      LEU   4 -11.114 -16.278  -0.365
    4    HB3  LEU   4           HB3      LEU   4  -9.645 -15.585   0.311
    5    HG   LEU   4           HG       LEU   4 -11.168 -17.964   1.424
    6   HD13  LEU   4          HD11      LEU   4  -9.566 -19.340   0.474
    7   HD12  LEU   4          HD12      LEU   4  -8.336 -18.077   0.444
    8   HD11  LEU   4          HD13      LEU   4  -9.634 -18.072  -0.748
    9   HD23  LEU   4          HD21      LEU   4  -8.907 -18.071   2.787
   10   HD22  LEU   4          HD22      LEU   4 -10.207 -17.013   3.332
   11   HD21  LEU   4          HD23      LEU   4  -8.841 -16.341   2.442

  No H/Q in entry =          11
  In of MODEL   88
    1    H    GLU   5           H        GLU   5 -13.193 -14.741  -0.289
    2    HA   GLU   5           HA       GLU   5 -12.159 -12.268  -1.285
    3    HB2  GLU   5           HB2      GLU   5 -14.595 -13.924  -1.747
    4    HB3  GLU   5           HB3      GLU   5 -14.645 -12.230  -2.236
    5    HG2  GLU   5           HG2      GLU   5 -12.219 -13.794  -2.984
    6    HG3  GLU   5           HG3      GLU   5 -13.709 -14.141  -3.860

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLU   6           H        GLU   6 -14.880 -13.114   0.825
    2    HA   GLU   6           HA       GLU   6 -15.738 -10.425   1.246
    3    HB2  GLU   6           HB2      GLU   6 -17.205 -12.376   1.647
    4    HB3  GLU   6           HB3      GLU   6 -16.160 -12.878   2.975
    5    HG2  GLU   6           HG2      GLU   6 -16.613 -10.774   4.154
    6    HG3  GLU   6           HG3      GLU   6 -17.625 -10.229   2.818

  No H/Q in entry =           6
  In of MODEL   88
    1    H    VAL   7           H        VAL   7 -13.453 -12.581   2.787
    2    HA   VAL   7           HA       VAL   7 -12.942 -11.026   5.119
    3    HB   VAL   7           HB       VAL   7 -11.284 -13.089   3.645
    4   HG11  VAL   7          HG11      VAL   7 -10.770 -11.578   6.213
    5   HG13  VAL   7          HG12      VAL   7  -9.685 -11.803   4.842
    6   HG12  VAL   7          HG13      VAL   7 -10.051 -13.159   5.908
    7   HG21  VAL   7          HG21      VAL   7 -13.533 -13.624   4.880
    8   HG23  VAL   7          HG22      VAL   7 -12.590 -13.373   6.349
    9   HG22  VAL   7          HG23      VAL   7 -12.127 -14.634   5.209

  No H/Q in entry =           9
  In of MODEL   88
    1    H    VAL   8           H        VAL   8 -11.459 -11.148   1.896
    2    HA   VAL   8           HA       VAL   8  -9.362  -9.311   2.382
    3    HB   VAL   8           HB       VAL   8 -10.857  -9.958  -0.170
    4   HG13  VAL   8          HG11      VAL   8  -9.870  -7.836  -0.558
    5   HG12  VAL   8          HG12      VAL   8  -8.692  -8.985  -1.194
    6   HG11  VAL   8          HG13      VAL   8  -8.433  -8.241   0.384
    7   HG21  VAL   8          HG21      VAL   8  -9.184 -11.582   1.304
    8   HG23  VAL   8          HG22      VAL   8  -8.034 -10.785   0.235
    9   HG22  VAL   8          HG23      VAL   8  -9.373 -11.703  -0.445

  No H/Q in entry =           9
  In of MODEL   88
    1    H    MET   9           H        MET   9 -12.710  -8.861   1.251
    2    HA   MET   9           HA       MET   9 -12.605  -6.084   0.831
    3    HB2  MET   9           HB2      MET   9 -14.835  -7.940   1.650
    4    HB3  MET   9           HB3      MET   9 -15.100  -6.203   1.483
    5    HG2  MET   9           HG2      MET   9 -14.237  -6.316  -0.842
    6    HG3  MET   9           HG3      MET   9 -14.046  -8.061  -0.670
    7    HE1  MET   9           HE1      MET   9 -16.294  -5.135  -0.114
    8    HE3  MET   9           HE2      MET   9 -17.881  -5.586  -0.730
    9    HE2  MET   9           HE3      MET   9 -16.557  -5.298  -1.856

  No H/Q in entry =           9
  In of MODEL   88
    1    H    GLY  10           H        GLY  10 -13.275  -7.980   3.753
    2    HA3  GLY  10           HA2      GLY  10 -13.775  -5.796   5.488
    3    HA2  GLY  10           HA3      GLY  10 -13.232  -7.396   5.989

  No H/Q in entry =           3
  In of MODEL   88
    1    H    LEU  11           H        LEU  11 -10.799  -7.552   4.654
    2    HA   LEU  11           HA       LEU  11  -9.062  -6.155   6.404
    3    HB2  LEU  11           HB2      LEU  11  -8.559  -7.573   3.785
    4    HB3  LEU  11           HB3      LEU  11  -7.270  -6.894   4.777
    5    HG   LEU  11           HG       LEU  11  -9.295  -8.901   5.799
    6   HD13  LEU  11          HD11      LEU  11  -8.106 -10.148   4.219
    7   HD12  LEU  11          HD12      LEU  11  -7.163 -10.409   5.685
    8   HD11  LEU  11          HD13      LEU  11  -6.613  -9.246   4.479
    9   HD22  LEU  11          HD21      LEU  11  -8.411  -7.912   7.714
   10   HD21  LEU  11          HD22      LEU  11  -6.874  -7.530   6.941
   11   HD23  LEU  11          HD23      LEU  11  -7.221  -9.184   7.445

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  12           H        ILE  12  -9.982  -5.576   3.025
    2    HA   ILE  12           HA       ILE  12  -8.260  -3.370   2.596
    3    HB   ILE  12           HB       ILE  12 -10.932  -3.997   1.318
    4   HG12  ILE  12          HG12      ILE  12  -8.924  -5.676   1.214
    5   HG13  ILE  12          HG13      ILE  12  -9.782  -5.288  -0.263
    6   HG21  ILE  12          HG21      ILE  12  -8.693  -2.123   0.492
    7   HG23  ILE  12          HG22      ILE  12 -10.352  -1.680   0.871
    8   HG22  ILE  12          HG23      ILE  12  -9.992  -2.619  -0.549
    9   HD13  ILE  12          HD11      ILE  12  -8.034  -3.744  -0.911
   10   HD12  ILE  12          HD12      ILE  12  -7.280  -5.275  -0.473
   11   HD11  ILE  12          HD13      ILE  12  -7.238  -3.928   0.640

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  13           H        ILE  13 -11.616  -3.592   3.715
    2    HA   ILE  13           HA       ILE  13 -12.031  -0.800   4.003
    3    HB   ILE  13           HB       ILE  13 -13.262  -3.210   5.357
    4   HG12  ILE  13          HG12      ILE  13 -13.506  -2.661   2.831
    5   HG13  ILE  13          HG13      ILE  13 -14.940  -3.070   3.749
    6   HG23  ILE  13          HG21      ILE  13 -13.726  -1.544   6.934
    7   HG22  ILE  13          HG22      ILE  13 -15.141  -1.464   5.892
    8   HG21  ILE  13          HG23      ILE  13 -13.853  -0.275   5.719
    9   HD13  ILE  13          HD11      ILE  13 -15.787  -0.927   3.656
   10   HD12  ILE  13          HD12      ILE  13 -14.836  -0.923   2.184
   11   HD11  ILE  13          HD13      ILE  13 -14.177  -0.199   3.633

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ASN  14           H        ASN  14 -10.939  -3.318   6.256
    2    HA   ASN  14           HA       ASN  14 -10.697  -1.695   8.548
    3    HB2  ASN  14           HB2      ASN  14 -10.485  -4.305   8.211
    4    HB3  ASN  14           HB3      ASN  14  -8.772  -3.942   8.042
    5   HD21  ASN  14          HD21      ASN  14  -9.413  -5.468  10.215
    6   HD22  ASN  14          HD22      ASN  14  -9.361  -4.556  11.644

  No H/Q in entry =           6
  In of MODEL   88
    1    H    SER  15           H        SER  15  -8.326  -2.541   6.033
    2    HA   SER  15           HA       SER  15  -6.153  -1.084   7.096
    3    HB2  SER  15           HB2      SER  15  -5.152  -1.305   4.930
    4    HB3  SER  15           HB3      SER  15  -6.129  -2.752   5.152
    5    HG   SER  15           HG       SER  15  -6.527  -0.547   3.494

  No H/Q in entry =           5
  In of MODEL   88
    1    H    GLY  16           H        GLY  16  -8.759  -0.169   4.874
    2    HA3  GLY  16           HA2      GLY  16  -7.869   2.462   4.329
    3    HA2  GLY  16           HA3      GLY  16  -9.529   1.891   4.177

  No H/Q in entry =           3
  In of MODEL   88
    1    H    GLN  17           H        GLN  17 -10.061   1.160   6.827
    2    HA   GLN  17           HA       GLN  17 -10.725   3.668   7.986
    3    HB2  GLN  17           HB2      GLN  17 -10.658   0.877   9.145
    4    HB3  GLN  17           HB3      GLN  17 -11.249   2.279  10.037
    5    HG2  GLN  17           HG2      GLN  17 -12.945   2.696   8.326
    6    HG3  GLN  17           HG3      GLN  17 -12.320   1.365   7.352
    7   HE21  GLN  17          HE21      GLN  17 -14.721   2.119   9.573
    8   HE22  GLN  17          HE22      GLN  17 -15.038   0.555  10.155

  No H/Q in entry =           8
  In of MODEL   88
    1    H    ALA  18           H        ALA  18  -8.123   1.348   8.573
    2    HA   ALA  18           HA       ALA  18  -6.992   2.538  10.842
    3    HB2  ALA  18           HB1      ALA  18  -6.422   0.321   9.458
    4    HB3  ALA  18           HB2      ALA  18  -5.241   1.083  10.524
    5    HB1  ALA  18           HB3      ALA  18  -5.173   1.369   8.784

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ARG  19           H        ARG  19  -6.240   3.069   7.390
    2    HA   ARG  19           HA       ARG  19  -4.312   5.089   7.814
    3    HB2  ARG  19           HB2      ARG  19  -4.671   3.964   5.615
    4    HB3  ARG  19           HB3      ARG  19  -6.203   4.825   5.455
    5    HG2  ARG  19           HG2      ARG  19  -5.046   6.982   5.525
    6    HG3  ARG  19           HG3      ARG  19  -3.505   6.175   5.813
    7    HD2  ARG  19           HD2      ARG  19  -3.640   6.779   3.474
    8    HD3  ARG  19           HD3      ARG  19  -3.747   5.019   3.612
    9    HE   ARG  19           HE       ARG  19  -6.369   5.962   3.629
   10   HH21  ARG  19          HH11      ARG  19  -7.576   6.143   1.721
   11   HH22  ARG  19          HH12      ARG  19  -6.765   6.218   0.195
   12   HH11  ARG  19          HH21      ARG  19  -3.608   6.000   1.574
   13   HH12  ARG  19          HH22      ARG  19  -4.517   6.134   0.112

  No H/Q in entry =          13
  In of MODEL   88
    1    H    SER  20           H        SER  20  -7.812   5.252   7.241
    2    HA   SER  20           HA       SER  20  -8.135   8.012   7.209
    3    HB2  SER  20           HB2      SER  20 -10.034   6.699   6.680
    4    HB3  SER  20           HB3      SER  20  -9.924   5.794   8.189
    5    HG   SER  20           HG       SER  20 -10.448   7.720   9.288

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LEU  21           H        LEU  21  -8.142   5.815  10.003
    2    HA   LEU  21           HA       LEU  21  -8.542   7.807  11.980
    3    HB2  LEU  21           HB2      LEU  21  -7.221   5.088  12.119
    4    HB3  LEU  21           HB3      LEU  21  -7.510   6.102  13.529
    5    HG   LEU  21           HG       LEU  21  -9.700   5.237  11.618
    6   HD12  LEU  21          HD11      LEU  21 -10.292   3.717  13.632
    7   HD11  LEU  21          HD12      LEU  21  -8.617   3.964  14.128
    8   HD13  LEU  21          HD13      LEU  21  -8.974   3.207  12.574
    9   HD23  LEU  21          HD21      LEU  21 -11.024   5.744  13.849
   10   HD22  LEU  21          HD22      LEU  21 -10.560   7.088  12.811
   11   HD21  LEU  21          HD23      LEU  21  -9.617   6.725  14.247

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ALA  22           H        ALA  22  -5.618   6.405  10.544
    2    HA   ALA  22           HA       ALA  22  -3.710   7.687  12.158
    3    HB2  ALA  22           HB1      ALA  22  -3.329   5.837  10.455
    4    HB1  ALA  22           HB2      ALA  22  -2.117   7.118  10.487
    5    HB3  ALA  22           HB3      ALA  22  -3.345   7.095   9.221

  No H/Q in entry =           5
  In of MODEL   88
    1    H    TYR  23           H        TYR  23  -5.038   8.736   8.991
    2    HA   TYR  23           HA       TYR  23  -3.673  11.216   8.923
    3    HB2  TYR  23           HB2      TYR  23  -4.778  10.328   6.934
    4    HB3  TYR  23           HB3      TYR  23  -6.350  10.447   7.727
    5    HD1  TYR  23           HD1      TYR  23  -3.424  12.479   6.603
    6    HD2  TYR  23           HD2      TYR  23  -7.578  12.458   7.692
    7    HE1  TYR  23           HE1      TYR  23  -3.631  14.836   5.858
    8    HE2  TYR  23           HE2      TYR  23  -7.787  14.815   6.946
    9    HH   TYR  23           HH       TYR  23  -5.084  16.490   5.381

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ALA  24           H        ALA  24  -6.794  10.269  10.320
    2    HA   ALA  24           HA       ALA  24  -7.594  12.865  11.110
    3    HB1  ALA  24           HB1      ALA  24  -9.424  11.633  11.585
    4    HB2  ALA  24           HB2      ALA  24  -8.594  11.045  13.024
    5    HB3  ALA  24           HB3      ALA  24  -8.491  10.139  11.515

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ALA  25           H        ALA  25  -5.610  10.375  12.657
    2    HA   ALA  25           HA       ALA  25  -5.239  11.611  15.163
    3    HB2  ALA  25           HB1      ALA  25  -4.506   9.254  14.325
    4    HB3  ALA  25           HB2      ALA  25  -3.472  10.095  15.483
    5    HB1  ALA  25           HB3      ALA  25  -3.049  10.081  13.770

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LEU  26           H        LEU  26  -3.467  11.904  12.111
    2    HA   LEU  26           HA       LEU  26  -1.480  13.695  13.022
    3    HB2  LEU  26           HB2      LEU  26  -1.207  12.551  10.910
    4    HB3  LEU  26           HB3      LEU  26  -2.677  13.279  10.269
    5    HG   LEU  26           HG       LEU  26  -1.634  15.517  10.409
    6   HD12  LEU  26          HD11      LEU  26   0.907  15.504  10.804
    7   HD11  LEU  26          HD12      LEU  26   0.670  13.922  11.542
    8   HD13  LEU  26          HD13      LEU  26  -0.115  15.343  12.231
    9   HD21  LEU  26          HD21      LEU  26   0.074  13.448   8.991
   10   HD23  LEU  26          HD22      LEU  26   0.049  15.172   8.629
   11   HD22  LEU  26          HD23      LEU  26  -1.389  14.193   8.346

  No H/Q in entry =          11
  In of MODEL   88
    1    H    LYS  27           H        LYS  27  -4.666  14.224  11.570
    2    HA   LYS  27           HA       LYS  27  -4.579  17.013  11.385
    3    HB2  LYS  27           HB2      LYS  27  -6.348  15.562  10.405
    4    HB3  LYS  27           HB3      LYS  27  -6.996  15.305  12.024
    5    HG2  LYS  27           HG2      LYS  27  -7.394  17.715  12.275
    6    HG3  LYS  27           HG3      LYS  27  -6.694  18.011  10.681
    7    HD2  LYS  27           HD2      LYS  27  -8.451  16.604   9.650
    8    HD3  LYS  27           HD3      LYS  27  -9.157  16.325  11.244
    9    HE2  LYS  27           HE2      LYS  27  -9.568  18.740  11.502
   10    HE3  LYS  27           HE3      LYS  27  -8.834  19.040   9.923
   11    HZ3  LYS  27           HZ1      LYS  27 -11.214  18.946   9.698
   12    HZ2  LYS  27           HZ2      LYS  27 -11.276  17.426  10.461
   13    HZ1  LYS  27           HZ3      LYS  27 -10.540  17.588   8.935

  No H/Q in entry =          13
  In of MODEL   88
    1    H    GLN  28           H        GLN  28  -5.473  14.924  14.108
    2    HA   GLN  28           HA       GLN  28  -6.330  16.931  15.901
    3    HB2  GLN  28           HB2      GLN  28  -4.961  14.277  16.415
    4    HB3  GLN  28           HB3      GLN  28  -5.670  15.285  17.678
    5    HG2  GLN  28           HG2      GLN  28  -7.176  14.193  15.283
    6    HG3  GLN  28           HG3      GLN  28  -7.233  13.511  16.908
    7   HE21  GLN  28          HE21      GLN  28  -9.104  15.318  14.960
    8   HE22  GLN  28          HE22      GLN  28  -9.817  16.364  16.090

  No H/Q in entry =           8
  In of MODEL   88
    1    H    ALA  29           H        ALA  29  -3.134  15.596  15.181
    2    HA   ALA  29           HA       ALA  29  -1.663  16.964  17.156
    3    HB1  ALA  29           HB1      ALA  29   0.250  16.253  16.019
    4    HB3  ALA  29           HB2      ALA  29  -0.514  16.395  14.436
    5    HB2  ALA  29           HB3      ALA  29  -0.946  15.063  15.507

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LYS  30           H        LYS  30  -2.533  17.872  13.837
    2    HA   LYS  30           HA       LYS  30  -1.088  20.292  13.738
    3    HB2  LYS  30           HB2      LYS  30  -3.642  19.462  12.344
    4    HB3  LYS  30           HB3      LYS  30  -2.788  20.966  12.001
    5    HG2  LYS  30           HG2      LYS  30  -0.742  19.645  11.465
    6    HG3  LYS  30           HG3      LYS  30  -1.669  18.162  11.710
    7    HD2  LYS  30           HD2      LYS  30  -3.237  18.835   9.930
    8    HD3  LYS  30           HD3      LYS  30  -2.332  20.330   9.688
    9    HE2  LYS  30           HE2      LYS  30  -0.325  19.010   9.087
   10    HE3  LYS  30           HE3      LYS  30  -1.248  17.519   9.298
   11    HZ2  LYS  30           HZ1      LYS  30  -1.076  18.400   6.959
   12    HZ1  LYS  30           HZ2      LYS  30  -2.096  19.676   7.442
   13    HZ3  LYS  30           HZ3      LYS  30  -2.645  18.067   7.509

  No H/Q in entry =          13
  In of MODEL   88
    1    H    GLN  31           H        GLN  31  -4.191  19.481  15.169
    2    HA   GLN  31           HA       GLN  31  -4.906  22.247  15.641
    3    HB2  GLN  31           HB2      GLN  31  -6.115  19.813  16.961
    4    HB3  GLN  31           HB3      GLN  31  -6.851  21.398  16.729
    5    HG2  GLN  31           HG2      GLN  31  -6.173  20.623  14.130
    6    HG3  GLN  31           HG3      GLN  31  -6.716  19.124  14.873
    7   HE21  GLN  31          HE21      GLN  31  -8.117  20.731  12.790
    8   HE22  GLN  31          HE22      GLN  31  -9.619  21.144  13.462

  No H/Q in entry =           8
  In of MODEL   88
    1    H    GLY  32           H        GLY  32  -2.616  20.276  16.933
    2    HA3  GLY  32           HA2      GLY  32  -1.194  20.705  18.727
    3    HA2  GLY  32           HA3      GLY  32  -2.298  21.963  19.266

  No H/Q in entry =           3
  In of MODEL   88
    1    H    ASP  33           H        ASP  33  -3.776  18.952  18.599
    2    HA   ASP  33           HA       ASP  33  -4.172  18.485  21.480
    3    HB2  ASP  33           HB2      ASP  33  -5.614  17.511  19.008
    4    HB3  ASP  33           HB3      ASP  33  -5.957  16.898  20.624

  No H/Q in entry =           4
  In of MODEL   88
    1    H    PHE  34           H        PHE  34  -2.016  17.597  21.764
    2    HA   PHE  34           HA       PHE  34  -1.064  15.339  20.343
    3    HB2  PHE  34           HB2      PHE  34  -0.409  16.298  23.138
    4    HB3  PHE  34           HB3      PHE  34   0.492  15.064  22.257
    5    HD1  PHE  34           HD1      PHE  34   0.383  18.488  23.011
    6    HD2  PHE  34           HD2      PHE  34   1.143  15.789  19.756
    7    HE1  PHE  34           HE1      PHE  34   1.699  20.244  21.857
    8    HE2  PHE  34           HE2      PHE  34   2.454  17.548  18.606
    9    HZ   PHE  34           HZ       PHE  34   2.734  19.772  19.661

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ALA  35           H        ALA  35  -3.077  15.634  23.224
    2    HA   ALA  35           HA       ALA  35  -2.902  12.964  24.104
    3    HB3  ALA  35           HB1      ALA  35  -5.343  13.627  24.984
    4    HB1  ALA  35           HB2      ALA  35  -4.786  15.238  24.533
    5    HB2  ALA  35           HB3      ALA  35  -3.878  14.293  25.712

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ALA  36           H        ALA  36  -5.343  14.534  22.032
    2    HA   ALA  36           HA       ALA  36  -6.802  12.149  21.553
    3    HB1  ALA  36           HB1      ALA  36  -8.241  13.601  20.616
    4    HB3  ALA  36           HB2      ALA  36  -7.072  14.009  19.360
    5    HB2  ALA  36           HB3      ALA  36  -7.069  14.888  20.889

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ALA  37           H        ALA  37  -4.109  13.700  19.871
    2    HA   ALA  37           HA       ALA  37  -4.119  12.077  17.565
    3    HB3  ALA  37           HB1      ALA  37  -2.087  13.747  18.981
    4    HB2  ALA  37           HB2      ALA  37  -2.630  13.821  17.306
    5    HB1  ALA  37           HB3      ALA  37  -1.493  12.569  17.811

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LYS  38           H        LYS  38  -2.344  11.724  20.627
    2    HA   LYS  38           HA       LYS  38  -1.063   9.305  20.115
    3    HB2  LYS  38           HB2      LYS  38  -1.339  11.061  22.272
    4    HB3  LYS  38           HB3      LYS  38  -1.979   9.539  22.885
    5    HG2  LYS  38           HG2      LYS  38   0.092   8.386  22.326
    6    HG3  LYS  38           HG3      LYS  38   0.718   9.826  21.515
    7    HD2  LYS  38           HD2      LYS  38   0.924  11.030  23.556
    8    HD3  LYS  38           HD3      LYS  38  -0.108   9.892  24.425
    9    HE2  LYS  38           HE2      LYS  38   2.247   9.533  25.023
   10    HE3  LYS  38           HE3      LYS  38   1.612   8.132  24.156
   11    HZ3  LYS  38           HZ1      LYS  38   2.905   8.539  22.367
   12    HZ2  LYS  38           HZ2      LYS  38   3.883   9.344  23.501
   13    HZ1  LYS  38           HZ3      LYS  38   2.811  10.228  22.522

  No H/Q in entry =          13
  In of MODEL   88
    1    H    ALA  39           H        ALA  39  -4.281   9.847  21.546
    2    HA   ALA  39           HA       ALA  39  -4.883   7.134  22.040
    3    HB3  ALA  39           HB1      ALA  39  -7.015   9.119  21.300
    4    HB2  ALA  39           HB2      ALA  39  -6.102   9.323  22.796
    5    HB1  ALA  39           HB3      ALA  39  -7.045   7.855  22.531

  No H/Q in entry =           5
  In of MODEL   88
    1    H    MET  40           H        MET  40  -5.457   9.173  19.209
    2    HA   MET  40           HA       MET  40  -6.976   7.274  17.750
    3    HB2  MET  40           HB2      MET  40  -5.334   9.647  16.845
    4    HB3  MET  40           HB3      MET  40  -6.384   8.712  15.778
    5    HG2  MET  40           HG2      MET  40  -7.378   9.963  18.351
    6    HG3  MET  40           HG3      MET  40  -7.433  10.807  16.806
    7    HE3  MET  40           HE1      MET  40 -10.059   9.243  14.753
    8    HE2  MET  40           HE2      MET  40  -8.306   9.332  14.592
    9    HE1  MET  40           HE3      MET  40  -9.196  10.708  15.240

  No H/Q in entry =           9
  In of MODEL   88
    1    H    MET  41           H        MET  41  -3.473   7.953  17.849
    2    HA   MET  41           HA       MET  41  -2.760   6.198  15.733
    3    HB2  MET  41           HB2      MET  41  -1.113   6.824  18.197
    4    HB3  MET  41           HB3      MET  41  -0.518   6.175  16.672
    5    HG2  MET  41           HG2      MET  41  -1.647   8.382  15.690
    6    HG3  MET  41           HG3      MET  41  -1.388   8.956  17.336
    7    HE2  MET  41           HE1      MET  41   1.498   6.809  17.662
    8    HE1  MET  41           HE2      MET  41   0.738   8.110  18.574
    9    HE3  MET  41           HE3      MET  41   2.360   8.331  17.920

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ASP  42           H        ASP  42  -3.125   5.711  19.219
    2    HA   ASP  42           HA       ASP  42  -2.130   3.100  19.357
    3    HB2  ASP  42           HB2      ASP  42  -2.961   4.863  21.196
    4    HB3  ASP  42           HB3      ASP  42  -4.405   3.862  21.129

  No H/Q in entry =           4
  In of MODEL   88
    1    H    GLN  43           H        GLN  43  -5.449   4.260  18.888
    2    HA   GLN  43           HA       GLN  43  -6.636   1.693  18.688
    3    HB2  GLN  43           HB2      GLN  43  -7.525   4.366  17.581
    4    HB3  GLN  43           HB3      GLN  43  -8.511   2.903  17.558
    5    HG2  GLN  43           HG2      GLN  43  -8.201   2.762  20.063
    6    HG3  GLN  43           HG3      GLN  43  -7.451   4.356  19.995
    7   HE21  GLN  43          HE21      GLN  43  -9.617   4.462  21.512
    8   HE22  GLN  43          HE22      GLN  43 -10.975   5.064  20.695

  No H/Q in entry =           8
  In of MODEL   88
    1    H    SER  44           H        SER  44  -5.279   3.899  16.278
    2    HA   SER  44           HA       SER  44  -6.021   2.439  13.986
    3    HB2  SER  44           HB2      SER  44  -4.723   4.800  14.434
    4    HB3  SER  44           HB3      SER  44  -3.389   3.785  13.888
    5    HG   SER  44           HG       SER  44  -4.499   4.785  12.139

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ARG  45           H        ARG  45  -3.130   2.268  16.044
    2    HA   ARG  45           HA       ARG  45  -1.692   0.299  14.639
    3    HB2  ARG  45           HB2      ARG  45  -0.813   1.696  16.510
    4    HB3  ARG  45           HB3      ARG  45  -1.811   0.774  17.632
    5    HG2  ARG  45           HG2      ARG  45  -0.617  -1.300  16.969
    6    HG3  ARG  45           HG3      ARG  45   0.405  -0.355  15.888
    7    HD2  ARG  45           HD2      ARG  45   1.177   1.002  17.846
    8    HD3  ARG  45           HD3      ARG  45   0.245  -0.064  18.920
    9    HE   ARG  45           HE       ARG  45   1.907  -1.677  17.318
   10   HH21  ARG  45          HH11      ARG  45   3.800  -2.535  18.136
   11   HH22  ARG  45          HH12      ARG  45   4.595  -1.769  19.465
   12   HH11  ARG  45          HH21      ARG  45   2.268   0.770  19.719
   13   HH12  ARG  45          HH22      ARG  45   3.727   0.105  20.360

  No H/Q in entry =          13
  In of MODEL   88
    1    H    MET  46           H        MET  46  -4.074   0.002  17.256
    2    HA   MET  46           HA       MET  46  -3.950  -2.802  17.545
    3    HB2  MET  46           HB2      MET  46  -6.091  -0.771  18.169
    4    HB3  MET  46           HB3      MET  46  -6.306  -2.488  18.513
    5    HG2  MET  46           HG2      MET  46  -4.258  -2.478  19.882
    6    HG3  MET  46           HG3      MET  46  -4.021  -0.774  19.531
    7    HE1  MET  46           HE1      MET  46  -3.841  -0.035  21.785
    8    HE3  MET  46           HE2      MET  46  -4.084  -1.573  22.605
    9    HE2  MET  46           HE3      MET  46  -5.020  -0.165  23.095

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ALA  47           H        ALA  47  -5.952  -0.740  15.478
    2    HA   ALA  47           HA       ALA  47  -7.611  -2.758  14.412
    3    HB3  ALA  47           HB1      ALA  47  -8.257  -0.507  14.014
    4    HB1  ALA  47           HB2      ALA  47  -7.790  -1.139  12.436
    5    HB2  ALA  47           HB3      ALA  47  -6.686  -0.094  13.330

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LEU  48           H        LEU  48  -4.479  -1.495  13.346
    2    HA   LEU  48           HA       LEU  48  -4.242  -3.076  10.993
    3    HB2  LEU  48           HB2      LEU  48  -2.150  -1.843  12.794
    4    HB3  LEU  48           HB3      LEU  48  -1.805  -2.561  11.220
    5    HG   LEU  48           HG       LEU  48  -3.787  -0.311  11.637
    6   HD13  LEU  48          HD11      LEU  48  -1.646   0.524  12.292
    7   HD12  LEU  48          HD12      LEU  48  -1.924   1.093  10.646
    8   HD11  LEU  48          HD13      LEU  48  -0.847  -0.274  10.938
    9   HD22  LEU  48          HD21      LEU  48  -4.291  -1.275   9.559
   10   HD21  LEU  48          HD22      LEU  48  -2.618  -1.737   9.249
   11   HD23  LEU  48          HD23      LEU  48  -3.109  -0.049   9.103

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ASN  49           H        ASN  49  -3.179  -3.511  14.329
    2    HA   ASN  49           HA       ASN  49  -1.619  -5.799  13.974
    3    HB2  ASN  49           HB2      ASN  49  -1.617  -4.467  16.029
    4    HB3  ASN  49           HB3      ASN  49  -3.274  -4.947  16.366
    5   HD21  ASN  49          HD21      ASN  49  -1.252  -5.489  18.242
    6   HD22  ASN  49          HD22      ASN  49  -0.985  -7.164  18.306

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLU  50           H        GLU  50  -5.077  -5.467  14.672
    2    HA   GLU  50           HA       GLU  50  -5.639  -8.257  14.768
    3    HB2  GLU  50           HB2      GLU  50  -7.188  -6.547  15.666
    4    HB3  GLU  50           HB3      GLU  50  -7.483  -5.968  14.025
    5    HG2  GLU  50           HG2      GLU  50  -8.392  -8.144  13.380
    6    HG3  GLU  50           HG3      GLU  50  -8.011  -8.804  14.967

  No H/Q in entry =           6
  In of MODEL   88
    1    H    ALA  51           H        ALA  51  -5.682  -5.842  12.187
    2    HA   ALA  51           HA       ALA  51  -6.713  -7.540  10.162
    3    HB2  ALA  51           HB1      ALA  51  -6.470  -5.723   8.802
    4    HB1  ALA  51           HB2      ALA  51  -4.820  -5.408   9.341
    5    HB3  ALA  51           HB3      ALA  51  -6.187  -4.877  10.322

  No H/Q in entry =           5
  In of MODEL   88
    1    H    HIS  52           H        HIS  52  -3.399  -6.700  11.127
    2    HA   HIS  52           HA       HIS  52  -2.043  -8.203   9.159
    3    HB2  HIS  52           HB2      HIS  52  -0.981  -6.491  10.620
    4    HB3  HIS  52           HB3      HIS  52  -1.134  -7.599  11.983
    5    HD1  HIS  52           HD1      HIS  52   0.216  -9.898  11.783
    6    HD2  HIS  52           HD2      HIS  52   1.196  -7.008   8.942
    7    HE1  HIS  52           HE1      HIS  52   2.416 -10.620  10.756
    8    HE2  HIS  52           HE2      HIS  52   3.027  -8.869   9.022

  No H/Q in entry =           8
  In of MODEL   88
    1    H    LEU  53           H        LEU  53  -3.248  -9.077  12.375
    2    HA   LEU  53           HA       LEU  53  -2.098 -11.645  12.545
    3    HB2  LEU  53           HB2      LEU  53  -4.547 -10.418  13.785
    4    HB3  LEU  53           HB3      LEU  53  -4.128 -12.108  14.060
    5    HG   LEU  53           HG       LEU  53  -2.165  -9.844  14.540
    6   HD12  LEU  53          HD11      LEU  53  -2.757 -10.260  16.988
    7   HD11  LEU  53          HD12      LEU  53  -4.180 -11.120  16.400
    8   HD13  LEU  53          HD13      LEU  53  -3.975  -9.408  16.043
    9   HD21  LEU  53          HD21      LEU  53  -2.273 -12.785  15.234
   10   HD23  LEU  53          HD22      LEU  53  -1.306 -11.671  16.196
   11   HD22  LEU  53          HD23      LEU  53  -0.950 -11.893  14.493

  No H/Q in entry =          11
  In of MODEL   88
    1    H    VAL  54           H        VAL  54  -5.198 -10.547  11.211
    2    HA   VAL  54           HA       VAL  54  -6.167 -13.119  10.515
    3    HB   VAL  54           HB       VAL  54  -6.769 -10.367   9.402
    4   HG12  VAL  54          HG11      VAL  54  -8.903 -11.698   8.597
    5   HG11  VAL  54          HG12      VAL  54  -7.817 -13.086   8.653
    6   HG13  VAL  54          HG13      VAL  54  -7.438 -11.712   7.616
    7   HG22  VAL  54          HG21      VAL  54  -7.661 -10.400  11.559
    8   HG21  VAL  54          HG22      VAL  54  -7.949 -12.138  11.531
    9   HG23  VAL  54          HG23      VAL  54  -9.016 -11.054  10.639

  No H/Q in entry =           9
  In of MODEL   88
    1    H    GLN  55           H        GLN  55  -4.260 -10.694   8.727
    2    HA   GLN  55           HA       GLN  55  -4.176 -12.145   6.300
    3    HB2  GLN  55           HB2      GLN  55  -3.529  -9.892   6.119
    4    HB3  GLN  55           HB3      GLN  55  -2.410  -9.999   7.476
    5    HG2  GLN  55           HG2      GLN  55  -0.719 -10.871   6.182
    6    HG3  GLN  55           HG3      GLN  55  -1.819 -11.819   5.190
    7   HE21  GLN  55          HE21      GLN  55  -1.837 -11.116   3.073
    8   HE22  GLN  55          HE22      GLN  55  -1.611  -9.512   2.571

  No H/Q in entry =           8
  In of MODEL   88
    1    H    THR  56           H        THR  56  -2.050 -12.184   9.166
    2    HA   THR  56           HA       THR  56  -0.011 -13.818   8.224
    3    HB   THR  56           HB       THR  56  -1.289 -13.839  10.972
    4    HG1  THR  56           HG1      THR  56  -0.317 -11.858  10.052
    5   HG23  THR  56          HG21      THR  56  -0.007 -15.781  10.983
    6   HG22  THR  56          HG22      THR  56   1.179 -14.584  11.502
    7   HG21  THR  56          HG23      THR  56   1.158 -15.138   9.827

  No H/Q in entry =           7
  In of MODEL   88
    1    H    LYS  57           H        LYS  57  -3.141 -14.800   9.603
    2    HA   LYS  57           HA       LYS  57  -2.754 -17.603   9.338
    3    HB2  LYS  57           HB2      LYS  57  -4.540 -16.489  10.704
    4    HB3  LYS  57           HB3      LYS  57  -5.332 -16.005   9.212
    5    HG2  LYS  57           HG2      LYS  57  -5.630 -18.355   8.578
    6    HG3  LYS  57           HG3      LYS  57  -4.794 -18.872  10.040
    7    HD2  LYS  57           HD2      LYS  57  -6.551 -17.808  11.420
    8    HD3  LYS  57           HD3      LYS  57  -7.398 -17.309   9.956
    9    HE2  LYS  57           HE2      LYS  57  -7.672 -19.674   9.297
   10    HE3  LYS  57           HE3      LYS  57  -6.806 -20.195  10.740
   11    HZ1  LYS  57           HZ1      LYS  57  -8.902 -18.408  11.411
   12    HZ3  LYS  57           HZ2      LYS  57  -8.637 -20.001  11.937
   13    HZ2  LYS  57           HZ3      LYS  57  -9.504 -19.711  10.504

  No H/Q in entry =          13
  In of MODEL   88
    1    H    LEU  58           H        LEU  58  -4.051 -15.121   7.186
    2    HA   LEU  58           HA       LEU  58  -4.904 -16.917   5.175
    3    HB2  LEU  58           HB2      LEU  58  -4.238 -13.981   5.052
    4    HB3  LEU  58           HB3      LEU  58  -4.930 -14.896   3.712
    5    HG   LEU  58           HG       LEU  58  -6.187 -14.707   6.469
    6   HD11  LEU  58          HD11      LEU  58  -6.471 -13.039   3.990
    7   HD13  LEU  58          HD12      LEU  58  -6.438 -12.542   5.681
    8   HD12  LEU  58          HD13      LEU  58  -7.882 -13.302   5.015
    9   HD22  LEU  58          HD21      LEU  58  -7.194 -16.590   5.595
   10   HD21  LEU  58          HD22      LEU  58  -6.857 -16.136   3.925
   11   HD23  LEU  58          HD23      LEU  58  -8.199 -15.387   4.790

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  59           H        ILE  59  -1.739 -15.776   6.021
    2    HA   ILE  59           HA       ILE  59  -0.674 -16.510   3.372
    3    HB   ILE  59           HB       ILE  59   0.147 -14.469   4.947
    4   HG12  ILE  59          HG12      ILE  59   2.194 -16.155   3.492
    5   HG13  ILE  59          HG13      ILE  59   1.014 -15.186   2.650
    6   HG22  ILE  59          HG21      ILE  59   2.183 -16.578   5.625
    7   HG21  ILE  59          HG22      ILE  59   0.851 -16.252   6.710
    8   HG23  ILE  59          HG23      ILE  59   2.007 -14.981   6.314
    9   HD12  ILE  59          HD11      ILE  59   3.051 -14.174   4.632
   10   HD11  ILE  59          HD12      ILE  59   1.806 -13.173   3.889
   11   HD13  ILE  59          HD13      ILE  59   3.068 -13.897   2.892

  No H/Q in entry =          11
  In of MODEL   88
    1    H    GLU  60           H        GLU  60  -0.685 -17.635   6.733
    2    HA   GLU  60           HA       GLU  60   1.303 -19.653   6.443
    3    HB2  GLU  60           HB2      GLU  60   0.600 -18.892   8.646
    4    HB3  GLU  60           HB3      GLU  60  -1.043 -19.454   8.348
    5    HG2  GLU  60           HG2      GLU  60   1.283 -21.364   8.174
    6    HG3  GLU  60           HG3      GLU  60   0.551 -20.980   9.730

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLY  61           H        GLY  61  -2.212 -19.676   5.981
    2    HA3  GLY  61           HA2      GLY  61  -2.028 -22.467   5.005
    3    HA2  GLY  61           HA3      GLY  61  -3.494 -21.705   5.613

  No H/Q in entry =           3
  In of MODEL   88
    1    H    ASP  62           H        ASP  62  -1.244 -20.163   3.402
    2    HA   ASP  62           HA       ASP  62  -3.259 -19.377   1.595
    3    HB2  ASP  62           HB2      ASP  62  -1.401 -18.620   0.199
    4    HB3  ASP  62           HB3      ASP  62  -1.107 -18.204   1.884

  No H/Q in entry =           4
  In of MODEL   88
    1    H    ALA  63           H        ALA  63  -4.064 -21.852   1.574
    2    HA   ALA  63           HA       ALA  63  -2.773 -23.691  -0.173
    3    HB1  ALA  63           HB1      ALA  63  -5.106 -24.688  -0.341
    4    HB3  ALA  63           HB2      ALA  63  -5.619 -23.404   0.753
    5    HB2  ALA  63           HB3      ALA  63  -4.411 -24.578   1.278

  No H/Q in entry =           5
  In of MODEL   88
    1    H    GLY  64           H        GLY  64  -5.170 -21.142  -0.651
    2    HA3  GLY  64           HA2      GLY  64  -6.041 -20.153  -2.526
    3    HA2  GLY  64           HA3      GLY  64  -4.489 -20.501  -3.271

  No H/Q in entry =           3
  In of MODEL   88
    1    H    GLU  65           H        GLU  65  -4.954 -21.309  -5.255
    2    HA   GLU  65           HA       GLU  65  -7.299 -22.734  -5.878
    3    HB2  GLU  65           HB2      GLU  65  -4.657 -22.553  -7.321
    4    HB3  GLU  65           HB3      GLU  65  -6.089 -23.338  -7.990
    5    HG2  GLU  65           HG2      GLU  65  -7.358 -21.257  -7.807
    6    HG3  GLU  65           HG3      GLU  65  -5.982 -20.460  -7.048

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLY  66           H        GLY  66  -6.676 -24.845  -7.347
    2    HA3  GLY  66           HA2      GLY  66  -6.593 -27.002  -5.547
    3    HA2  GLY  66           HA3      GLY  66  -6.501 -27.111  -7.293

  No H/Q in entry =           3
  In of MODEL   88
    1    H    LYS  67           H        LYS  67  -4.092 -25.552  -7.522
    2    HA   LYS  67           HA       LYS  67  -2.193 -27.669  -6.984
    3    HB2  LYS  67           HB2      LYS  67  -2.031 -25.111  -8.568
    4    HB3  LYS  67           HB3      LYS  67  -0.689 -26.250  -8.407
    5    HG2  LYS  67           HG2      LYS  67  -2.165 -28.068  -9.254
    6    HG3  LYS  67           HG3      LYS  67  -3.448 -26.885  -9.497
    7    HD2  LYS  67           HD2      LYS  67  -0.721 -26.624 -10.782
    8    HD3  LYS  67           HD3      LYS  67  -2.076 -27.442 -11.564
    9    HE2  LYS  67           HE2      LYS  67  -3.424 -25.303 -11.105
   10    HE3  LYS  67           HE3      LYS  67  -1.875 -24.541 -10.749
   11    HZ2  LYS  67           HZ1      LYS  67  -2.995 -25.340 -13.281
   12    HZ1  LYS  67           HZ2      LYS  67  -1.374 -25.799 -13.070
   13    HZ3  LYS  67           HZ3      LYS  67  -1.823 -24.166 -12.936

  No H/Q in entry =          13
  In of MODEL   88
    1    H    MET  68           H        MET  68   0.169 -26.454  -6.845
    2    HA   MET  68           HA       MET  68   0.492 -25.959  -4.074
    3    HB2  MET  68           HB2      MET  68   2.414 -25.629  -6.381
    4    HB3  MET  68           HB3      MET  68   2.864 -25.602  -4.676
    5    HG2  MET  68           HG2      MET  68   1.434 -27.904  -4.747
    6    HG3  MET  68           HG3      MET  68   2.078 -27.893  -6.390
    7    HE2  MET  68           HE1      MET  68   4.997 -25.987  -5.062
    8    HE1  MET  68           HE2      MET  68   4.320 -26.578  -6.578
    9    HE3  MET  68           HE3      MET  68   5.782 -27.315  -5.927

  No H/Q in entry =           9
  In of MODEL   88
    1    H    LYS  69           H        LYS  69  -0.434 -23.814  -6.511
    2    HA   LYS  69           HA       LYS  69   0.989 -21.498  -5.839
    3    HB2  LYS  69           HB2      LYS  69  -1.784 -21.595  -7.000
    4    HB3  LYS  69           HB3      LYS  69  -0.627 -20.263  -7.106
    5    HG2  LYS  69           HG2      LYS  69   0.983 -22.007  -8.136
    6    HG3  LYS  69           HG3      LYS  69  -0.461 -22.992  -8.377
    7    HD2  LYS  69           HD2      LYS  69   0.308 -20.401  -9.660
    8    HD3  LYS  69           HD3      LYS  69  -0.432 -21.833 -10.380
    9    HE2  LYS  69           HE2      LYS  69  -2.494 -21.285  -8.944
   10    HE3  LYS  69           HE3      LYS  69  -1.747 -19.709  -8.683
   11    HZ3  LYS  69           HZ1      LYS  69  -2.561 -19.086 -10.626
   12    HZ2  LYS  69           HZ2      LYS  69  -3.163 -20.644 -10.936
   13    HZ1  LYS  69           HZ3      LYS  69  -1.580 -20.235 -11.398

  No H/Q in entry =          13
  In of MODEL   88
    1    H    VAL  70           H        VAL  70  -0.721 -19.430  -5.419
    2    HA   VAL  70           HA       VAL  70  -1.915 -19.910  -2.750
    3    HB   VAL  70           HB       VAL  70  -0.976 -17.725  -2.028
    4   HG12  VAL  70          HG11      VAL  70   1.375 -18.485  -1.810
    5   HG11  VAL  70          HG12      VAL  70   1.072 -19.721  -3.033
    6   HG13  VAL  70          HG13      VAL  70   0.233 -19.789  -1.483
    7   HG21  VAL  70          HG21      VAL  70   0.504 -17.843  -4.690
    8   HG23  VAL  70          HG22      VAL  70   0.810 -16.673  -3.408
    9   HG22  VAL  70          HG23      VAL  70  -0.737 -16.667  -4.251

  No H/Q in entry =           9
  In of MODEL   88
    1    H    SER  71           H        SER  71  -3.406 -18.182  -2.113
    2    HA   SER  71           HA       SER  71  -5.320 -17.572  -4.118
    3    HB2  SER  71           HB2      SER  71  -5.837 -17.781  -1.664
    4    HB3  SER  71           HB3      SER  71  -4.986 -16.264  -1.394
    5    HG   SER  71           HG       SER  71  -7.495 -16.668  -2.228

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LEU  72           H        LEU  72  -5.495 -15.904  -5.438
    2    HA   LEU  72           HA       LEU  72  -3.356 -14.131  -5.925
    3    HB2  LEU  72           HB2      LEU  72  -6.227 -14.125  -6.848
    4    HB3  LEU  72           HB3      LEU  72  -5.015 -12.984  -7.425
    5    HG   LEU  72           HG       LEU  72  -4.679 -15.999  -7.586
    6   HD11  LEU  72          HD11      LEU  72  -5.640 -14.028  -9.683
    7   HD13  LEU  72          HD12      LEU  72  -6.593 -15.319  -8.952
    8   HD12  LEU  72          HD13      LEU  72  -5.228 -15.715  -9.995
    9   HD21  LEU  72          HD21      LEU  72  -3.149 -13.608  -8.598
   10   HD23  LEU  72          HD22      LEU  72  -3.075 -15.115  -9.497
   11   HD22  LEU  72          HD23      LEU  72  -2.530 -15.062  -7.822

  No H/Q in entry =          11
  In of MODEL   88
    1    H    VAL  73           H        VAL  73  -6.428 -13.724  -4.268
    2    HA   VAL  73           HA       VAL  73  -6.417 -10.955  -3.899
    3    HB   VAL  73           HB       VAL  73  -8.122 -11.293  -2.294
    4   HG12  VAL  73          HG11      VAL  73  -8.314 -13.720  -4.084
    5   HG11  VAL  73          HG12      VAL  73  -8.506 -12.080  -4.702
    6   HG13  VAL  73          HG13      VAL  73  -9.626 -12.701  -3.488
    7   HG21  VAL  73          HG21      VAL  73  -6.729 -13.920  -1.896
    8   HG23  VAL  73          HG22      VAL  73  -8.453 -13.808  -1.542
    9   HG22  VAL  73          HG23      VAL  73  -7.309 -12.772  -0.689

  No H/Q in entry =           9
  In of MODEL   88
    1    H    LEU  74           H        LEU  74  -4.513 -13.371  -2.346
    2    HA   LEU  74           HA       LEU  74  -4.060 -12.255   0.181
    3    HB2  LEU  74           HB2      LEU  74  -3.324 -14.485  -0.341
    4    HB3  LEU  74           HB3      LEU  74  -2.266 -13.883  -1.617
    5    HG   LEU  74           HG       LEU  74  -0.925 -12.670   0.068
    6   HD13  LEU  74          HD11      LEU  74  -2.453 -12.157   1.807
    7   HD12  LEU  74          HD12      LEU  74  -1.415 -13.401   2.506
    8   HD11  LEU  74          HD13      LEU  74  -3.021 -13.824   1.911
    9   HD23  LEU  74          HD21      LEU  74  -1.178 -15.423   1.158
   10   HD22  LEU  74          HD22      LEU  74   0.238 -14.529   0.652
   11   HD21  LEU  74          HD23      LEU  74  -0.800 -15.248  -0.555

  No H/Q in entry =          11
  In of MODEL   88
    1    H    VAL  75           H        VAL  75  -2.185 -11.878  -2.789
    2    HA   VAL  75           HA       VAL  75  -0.342  -9.996  -1.781
    3    HB   VAL  75           HB       VAL  75  -1.330 -10.442  -4.600
    4   HG13  VAL  75          HG11      VAL  75  -0.417  -8.156  -4.370
    5   HG12  VAL  75          HG12      VAL  75   0.731  -9.171  -5.231
    6   HG11  VAL  75          HG13      VAL  75   0.997  -8.792  -3.536
    7   HG23  VAL  75          HG21      VAL  75   1.341 -11.169  -3.385
    8   HG22  VAL  75          HG22      VAL  75   0.581 -11.826  -4.835
    9   HG21  VAL  75          HG23      VAL  75  -0.044 -12.253  -3.241

  No H/Q in entry =           9
  In of MODEL   88
    1    H    GLU  76           H        GLU  76  -3.499  -9.577  -3.411
    2    HA   GLU  76           HA       GLU  76  -3.496  -6.761  -3.493
    3    HB2  GLU  76           HB2      GLU  76  -5.193  -8.143  -4.657
    4    HB3  GLU  76           HB3      GLU  76  -5.835  -8.667  -3.108
    5    HG2  GLU  76           HG2      GLU  76  -7.274  -6.915  -3.942
    6    HG3  GLU  76           HG3      GLU  76  -6.381  -6.251  -2.588

  No H/Q in entry =           6
  In of MODEL   88
    1    H    ALA  77           H        ALA  77  -4.630  -8.984  -0.959
    2    HA   ALA  77           HA       ALA  77  -5.533  -6.976   0.821
    3    HB2  ALA  77           HB1      ALA  77  -6.170  -9.324   1.087
    4    HB3  ALA  77           HB2      ALA  77  -5.385  -8.735   2.552
    5    HB1  ALA  77           HB3      ALA  77  -4.494  -9.757   1.427

  No H/Q in entry =           5
  In of MODEL   88
    1    H    GLN  78           H        GLN  78  -2.420  -8.584   0.420
    2    HA   GLN  78           HA       GLN  78  -1.121  -7.464   2.668
    3    HB2  GLN  78           HB2      GLN  78  -0.312  -9.412   1.285
    4    HB3  GLN  78           HB3      GLN  78   0.145  -8.261   0.033
    5    HG2  GLN  78           HG2      GLN  78   1.636  -7.120   1.623
    6    HG3  GLN  78           HG3      GLN  78   1.181  -8.265   2.881
    7   HE21  GLN  78          HE21      GLN  78   1.090 -10.285   0.388
    8   HE22  GLN  78          HE22      GLN  78   2.716 -10.765   0.287

  No H/Q in entry =           8
  In of MODEL   88
    1    H    LEU  79           H        LEU  79  -1.493  -6.374  -0.669
    2    HA   LEU  79           HA       LEU  79   0.237  -4.181  -0.655
    3    HB2  LEU  79           HB2      LEU  79  -0.822  -4.953  -2.705
    4    HB3  LEU  79           HB3      LEU  79  -2.412  -4.533  -2.081
    5    HG   LEU  79           HG       LEU  79  -1.819  -2.158  -2.044
    6   HD13  LEU  79          HD11      LEU  79   0.429  -1.963  -1.548
    7   HD12  LEU  79          HD12      LEU  79   0.470  -1.665  -3.286
    8   HD11  LEU  79          HD13      LEU  79   0.897  -3.256  -2.654
    9   HD23  LEU  79          HD21      LEU  79  -1.202  -1.955  -4.600
   10   HD22  LEU  79          HD22      LEU  79  -2.739  -2.674  -4.133
   11   HD21  LEU  79          HD23      LEU  79  -1.391  -3.708  -4.596

  No H/Q in entry =          11
  In of MODEL   88
    1    H    HIS  80           H        HIS  80  -3.225  -4.278   0.199
    2    HA   HIS  80           HA       HIS  80  -3.354  -1.523   0.882
    3    HB2  HIS  80           HB2      HIS  80  -5.102  -3.898   1.199
    4    HB3  HIS  80           HB3      HIS  80  -5.386  -2.559   2.314
    5    HD1  HIS  80           HD1      HIS  80  -6.977  -0.883   1.431
    6    HD2  HIS  80           HD2      HIS  80  -4.847  -2.720  -1.647
    7    HE1  HIS  80           HE1      HIS  80  -7.813   0.145  -0.735
    8    HE2  HIS  80           HE2      HIS  80  -6.521  -0.968  -2.620

  No H/Q in entry =           8
  In of MODEL   88
    1    H    LEU  81           H        LEU  81  -2.910  -4.441   2.852
    2    HA   LEU  81           HA       LEU  81  -2.849  -3.111   5.345
    3    HB2  LEU  81           HB2      LEU  81  -1.693  -5.746   4.438
    4    HB3  LEU  81           HB3      LEU  81  -1.641  -5.200   6.115
    5    HG   LEU  81           HG       LEU  81  -4.205  -5.388   4.507
    6   HD12  LEU  81          HD11      LEU  81  -4.538  -7.457   6.043
    7   HD11  LEU  81          HD12      LEU  81  -2.784  -7.424   6.215
    8   HD13  LEU  81          HD13      LEU  81  -3.510  -7.629   4.620
    9   HD23  LEU  81          HD21      LEU  81  -5.032  -5.590   7.013
   10   HD22  LEU  81          HD22      LEU  81  -4.679  -4.003   6.331
   11   HD21  LEU  81          HD23      LEU  81  -3.500  -4.796   7.376

  No H/Q in entry =          11
  In of MODEL   88
    1    H    MET  82           H        MET  82  -0.205  -4.056   3.146
    2    HA   MET  82           HA       MET  82   1.910  -3.218   4.818
    3    HB2  MET  82           HB2      MET  82   1.664  -3.534   1.826
    4    HB3  MET  82           HB3      MET  82   3.164  -3.001   2.581
    5    HG2  MET  82           HG2      MET  82   1.707  -5.564   3.300
    6    HG3  MET  82           HG3      MET  82   3.072  -5.477   2.189
    7    HE3  MET  82           HE1      MET  82   6.119  -4.819   4.153
    8    HE2  MET  82           HE2      MET  82   5.220  -3.428   3.551
    9    HE1  MET  82           HE3      MET  82   5.269  -4.913   2.605

  No H/Q in entry =           9
  In of MODEL   88
    1    H    THR  83           H        THR  83   0.103  -1.520   2.288
    2    HA   THR  83           HA       THR  83   1.568   0.897   2.378
    3    HB   THR  83           HB       THR  83  -0.595   1.875   1.417
    4    HG1  THR  83           HG1      THR  83  -2.274   0.615   1.315
    5   HG22  THR  83          HG21      THR  83  -0.381   0.065  -0.598
    6   HG21  THR  83          HG22      THR  83   1.120  -0.265   0.264
    7   HG23  THR  83          HG23      THR  83   0.789   1.359  -0.337

  No H/Q in entry =           7
  In of MODEL   88
    1    H    SER  84           H        SER  84  -1.446  -0.081   3.998
    2    HA   SER  84           HA       SER  84  -1.878   2.350   5.362
    3    HB2  SER  84           HB2      SER  84  -2.768  -0.472   5.915
    4    HB3  SER  84           HB3      SER  84  -3.224   0.872   6.961
    5    HG   SER  84           HG       SER  84  -3.712   0.587   4.171

  No H/Q in entry =           5
  In of MODEL   88
    1    H    MET  85           H        MET  85  -0.224  -0.626   6.458
    2    HA   MET  85           HA       MET  85   0.338   0.272   9.064
    3    HB2  MET  85           HB2      MET  85   0.573  -2.072   8.375
    4    HB3  MET  85           HB3      MET  85   1.951  -1.635   7.364
    5    HG2  MET  85           HG2      MET  85   3.184  -0.855   9.339
    6    HG3  MET  85           HG3      MET  85   1.794  -1.213  10.364
    7    HE3  MET  85           HE1      MET  85   3.306  -3.738   7.342
    8    HE2  MET  85           HE2      MET  85   4.762  -3.923   8.318
    9    HE1  MET  85           HE3      MET  85   4.210  -2.313   7.864

  No H/Q in entry =           9
  In of MODEL   88
    1    H    LEU  86           H        LEU  86   2.253   0.504   6.099
    2    HA   LEU  86           HA       LEU  86   4.505   1.758   7.244
    3    HB2  LEU  86           HB2      LEU  86   4.271   0.695   4.930
    4    HB3  LEU  86           HB3      LEU  86   3.491   2.198   4.434
    5    HG   LEU  86           HG       LEU  86   5.555   3.392   5.405
    6   HD11  LEU  86          HD11      LEU  86   6.208   0.760   6.182
    7   HD13  LEU  86          HD12      LEU  86   7.245   2.182   6.280
    8   HD12  LEU  86          HD13      LEU  86   7.319   1.141   4.861
    9   HD23  LEU  86          HD21      LEU  86   6.213   1.629   3.037
   10   HD22  LEU  86          HD22      LEU  86   6.646   3.315   3.307
   11   HD21  LEU  86          HD23      LEU  86   4.980   2.887   2.919

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ALA  87           H        ALA  87   1.608   3.076   5.692
    2    HA   ALA  87           HA       ALA  87   2.264   5.792   5.788
    3    HB1  ALA  87           HB1      ALA  87  -0.086   4.219   5.256
    4    HB3  ALA  87           HB2      ALA  87   0.258   5.876   4.764
    5    HB2  ALA  87           HB3      ALA  87  -0.530   5.562   6.312

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ARG  88           H        ARG  88   0.550   3.813   8.179
    2    HA   ARG  88           HA       ARG  88   0.099   5.861  10.043
    3    HB2  ARG  88           HB2      ARG  88  -0.891   3.530  10.103
    4    HB3  ARG  88           HB3      ARG  88   0.644   2.991  10.793
    5    HG2  ARG  88           HG2      ARG  88   0.227   5.065  12.430
    6    HG3  ARG  88           HG3      ARG  88  -1.450   4.780  11.985
    7    HD2  ARG  88           HD2      ARG  88  -1.588   2.926  13.221
    8    HD3  ARG  88           HD3      ARG  88  -0.016   2.312  12.673
    9    HE   ARG  88           HE       ARG  88  -0.501   3.571  15.140
   10   HH21  ARG  88          HH11      ARG  88   1.089   4.541  16.371
   11   HH22  ARG  88          HH12      ARG  88   2.611   4.938  15.656
   12   HH11  ARG  88          HH21      ARG  88   1.761   3.719  12.545
   13   HH12  ARG  88          HH22      ARG  88   3.000   4.456  13.501

  No H/Q in entry =          13
  In of MODEL   88
    1    H    GLU  89           H        GLU  89   2.844   3.583   9.783
    2    HA   GLU  89           HA       GLU  89   4.144   4.428  12.121
    3    HB2  GLU  89           HB2      GLU  89   4.747   2.405  10.760
    4    HB3  GLU  89           HB3      GLU  89   5.537   3.489   9.613
    5    HG2  GLU  89           HG2      GLU  89   7.055   4.292  11.350
    6    HG3  GLU  89           HG3      GLU  89   6.209   3.346  12.571

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LEU  90           H        LEU  90   4.459   5.600   8.798
    2    HA   LEU  90           HA       LEU  90   6.437   7.554   9.379
    3    HB2  LEU  90           HB2      LEU  90   4.406   7.280   7.167
    4    HB3  LEU  90           HB3      LEU  90   5.664   8.524   7.186
    5    HG   LEU  90           HG       LEU  90   6.276   5.572   7.496
    6   HD12  LEU  90          HD11      LEU  90   7.010   5.804   5.052
    7   HD11  LEU  90          HD12      LEU  90   6.025   7.267   5.020
    8   HD13  LEU  90          HD13      LEU  90   5.274   5.707   5.360
    9   HD22  LEU  90          HD21      LEU  90   8.203   6.676   8.169
   10   HD21  LEU  90          HD22      LEU  90   7.876   8.094   7.174
   11   HD23  LEU  90          HD23      LEU  90   8.498   6.620   6.432

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  91           H        ILE  91   2.898   7.647   9.260
    2    HA   ILE  91           HA       ILE  91   2.619  10.423   9.731
    3    HB   ILE  91           HB       ILE  91   0.782   8.083  10.274
    4   HG12  ILE  91          HG12      ILE  91   0.566  10.381   8.305
    5   HG13  ILE  91          HG13      ILE  91   1.391   8.871   7.917
    6   HG22  ILE  91          HG21      ILE  91  -0.906  10.177  10.364
    7   HG21  ILE  91          HG22      ILE  91   0.518  10.973  11.030
    8   HG23  ILE  91          HG23      ILE  91  -0.142   9.544  11.823
    9   HD13  ILE  91          HD11      ILE  91  -0.580   7.625   7.970
   10   HD12  ILE  91          HD12      ILE  91  -1.142   9.156   7.302
   11   HD11  ILE  91          HD13      ILE  91  -1.407   8.787   9.006

  No H/Q in entry =          11
  In of MODEL   88
    1    H    THR  92           H        THR  92   2.982   7.660  11.912
    2    HA   THR  92           HA       THR  92   2.587   9.028  14.348
    3    HB   THR  92           HB       THR  92   4.341   6.660  13.654
    4    HG1  THR  92           HG1      THR  92   2.356   5.944  13.565
    5   HG22  THR  92          HG21      THR  92   3.973   6.367  16.289
    6   HG21  THR  92          HG22      THR  92   3.944   8.128  16.227
    7   HG23  THR  92          HG23      THR  92   5.355   7.247  15.637

  No H/Q in entry =           7
  In of MODEL   88
    1    H    GLU  93           H        GLU  93   5.513   8.530  12.387
    2    HA   GLU  93           HA       GLU  93   7.309   9.910  14.078
    3    HB2  GLU  93           HB2      GLU  93   7.366   9.612  11.061
    4    HB3  GLU  93           HB3      GLU  93   8.726  10.109  12.067
    5    HG2  GLU  93           HG2      GLU  93   7.266   7.499  12.511
    6    HG3  GLU  93           HG3      GLU  93   8.644   7.629  11.425

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LEU  94           H        LEU  94   5.260  10.983  11.388
    2    HA   LEU  94           HA       LEU  94   6.118  13.671  11.297
    3    HB2  LEU  94           HB2      LEU  94   3.495  12.362  10.556
    4    HB3  LEU  94           HB3      LEU  94   3.786  14.086  10.323
    5    HG   LEU  94           HG       LEU  94   5.755  12.064   9.245
    6   HD11  LEU  94          HD11      LEU  94   3.016  12.676   8.208
    7   HD13  LEU  94          HD12      LEU  94   3.969  11.201   8.066
    8   HD12  LEU  94          HD13      LEU  94   4.323  12.580   7.027
    9   HD23  LEU  94          HD21      LEU  94   6.028  13.905   7.531
   10   HD22  LEU  94          HD22      LEU  94   6.465  14.380   9.172
   11   HD21  LEU  94          HD23      LEU  94   4.918  14.883   8.489

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  95           H        ILE  95   3.564  12.093  13.199
    2    HA   ILE  95           HA       ILE  95   2.577  14.456  14.416
    3    HB   ILE  95           HB       ILE  95   2.545  11.569  15.324
    4   HG12  ILE  95          HG12      ILE  95   0.351  13.392  14.303
    5   HG13  ILE  95          HG13      ILE  95   1.279  12.320  13.257
    6   HG21  ILE  95          HG21      ILE  95   1.321  14.059  16.550
    7   HG23  ILE  95          HG22      ILE  95   2.352  12.865  17.340
    8   HG22  ILE  95          HG23      ILE  95   0.704  12.439  16.875
    9   HD13  ILE  95          HD11      ILE  95   0.345  10.394  14.172
   10   HD12  ILE  95          HD12      ILE  95  -1.015  11.510  14.266
   11   HD11  ILE  95          HD13      ILE  95  -0.045  11.184  15.701

  No H/Q in entry =          11
  In of MODEL   88
    1    H    GLU  96           H        GLU  96   5.136  12.181  15.378
    2    HA   GLU  96           HA       GLU  96   5.734  13.354  17.873
    3    HB2  GLU  96           HB2      GLU  96   6.635  11.181  17.205
    4    HB3  GLU  96           HB3      GLU  96   7.573  11.944  15.923
    5    HG2  GLU  96           HG2      GLU  96   9.243  12.452  17.375
    6    HG3  GLU  96           HG3      GLU  96   8.120  13.281  18.444

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LEU  97           H        LEU  97   6.797  14.125  14.583
    2    HA   LEU  97           HA       LEU  97   8.726  16.081  15.291
    3    HB2  LEU  97           HB2      LEU  97   7.105  15.577  12.806
    4    HB3  LEU  97           HB3      LEU  97   8.152  16.988  12.928
    5    HG   LEU  97           HG       LEU  97   9.133  14.168  13.463
    6   HD12  LEU  97          HD11      LEU  97  10.115  14.357  11.140
    7   HD11  LEU  97          HD12      LEU  97   9.088  15.769  10.892
    8   HD13  LEU  97          HD13      LEU  97   8.361  14.188  11.183
    9   HD23  LEU  97          HD21      LEU  97  11.320  15.411  12.711
   10   HD22  LEU  97          HD22      LEU  97  10.719  15.682  14.346
   11   HD21  LEU  97          HD23      LEU  97  10.417  16.878  13.087

  No H/Q in entry =          11
  In of MODEL   88
    1    H    HIS  98           H        HIS  98   5.233  16.285  14.665
    2    HA   HIS  98           HA       HIS  98   4.987  19.089  14.819
    3    HB2  HIS  98           HB2      HIS  98   3.061  16.870  15.546
    4    HB3  HIS  98           HB3      HIS  98   2.626  18.578  15.616
    5    HD1  HIS  98           HD1      HIS  98   3.578  15.859  13.187
    6    HD2  HIS  98           HD2      HIS  98   2.274  19.818  13.098
    7    HE1  HIS  98           HE1      HIS  98   3.010  16.372  10.771
    8    HE2  HIS  98           HE2      HIS  98   2.219  18.777  10.695

  No H/Q in entry =           8
  In of MODEL   88
    1    H    GLU  99           H        GLU  99   5.093  16.584  17.302
    2    HA   GLU  99           HA       GLU  99   4.533  18.276  19.514
    3    HB2  GLU  99           HB2      GLU  99   4.400  15.796  19.598
    4    HB3  GLU  99           HB3      GLU  99   6.157  15.719  19.476
    5    HG2  GLU  99           HG2      GLU  99   6.386  16.995  21.556
    6    HG3  GLU  99           HG3      GLU  99   4.637  17.168  21.666

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LYS 100           H        LYS 100   7.557  17.299  17.921
    2    HA   LYS 100           HA       LYS 100   9.252  18.658  19.772
    3    HB2  LYS 100           HB2      LYS 100   9.712  17.741  16.924
    4    HB3  LYS 100           HB3      LYS 100  10.963  18.482  17.927
    5    HG2  LYS 100           HG2      LYS 100  10.568  16.728  19.661
    6    HG3  LYS 100           HG3      LYS 100   9.413  15.952  18.574
    7    HD2  LYS 100           HD2      LYS 100  11.189  15.646  16.892
    8    HD3  LYS 100           HD3      LYS 100  12.349  16.434  17.964
    9    HE2  LYS 100           HE2      LYS 100  11.934  14.676  19.674
   10    HE3  LYS 100           HE3      LYS 100  10.835  13.867  18.553
   11    HZ1  LYS 100           HZ1      LYS 100  13.662  14.489  17.879
   12    HZ3  LYS 100           HZ2      LYS 100  12.592  13.458  17.053
   13    HZ2  LYS 100           HZ3      LYS 100  13.185  13.019  18.585

  No H/Q in entry =          13
  In of MODEL   88
    1    H    LEU 101           H        LEU 101   7.553  19.633  16.836
    2    HA   LEU 101           HA       LEU 101   8.812  22.169  16.506
    3    HB2  LEU 101           HB2      LEU 101   6.187  20.989  15.632
    4    HB3  LEU 101           HB3      LEU 101   6.469  22.716  15.433
    5    HG   LEU 101           HG       LEU 101   8.459  20.669  14.440
    6   HD12  LEU 101          HD11      LEU 101   7.298  21.209  12.167
    7   HD11  LEU 101          HD12      LEU 101   5.914  21.659  13.161
    8   HD13  LEU 101          HD13      LEU 101   6.549  20.016  13.228
    9   HD21  LEU 101          HD21      LEU 101   7.881  23.595  13.906
   10   HD23  LEU 101          HD22      LEU 101   8.835  22.624  12.786
   11   HD22  LEU 101          HD23      LEU 101   9.395  22.862  14.441

  No H/Q in entry =          11
  In of MODEL   88
    1    H    LYS 102           H        LYS 102   7.274  21.044  19.127
    2    HA   LYS 102           HA       LYS 102   6.677  22.136  21.070
    3    HB2  LYS 102           HB2      LYS 102   7.988  24.109  19.948
    4    HB3  LYS 102           HB3      LYS 102   6.398  24.745  19.588
    5    HG2  LYS 102           HG2      LYS 102   7.790  24.448  22.228
    6    HG3  LYS 102           HG3      LYS 102   6.858  25.798  21.614
    7    HD2  LYS 102           HD2      LYS 102   5.572  23.180  22.487
    8    HD3  LYS 102           HD3      LYS 102   5.854  24.530  23.576
    9    HE2  LYS 102           HE2      LYS 102   3.556  24.179  22.103
   10    HE3  LYS 102           HE3      LYS 102   4.093  25.710  22.790
   11    HZ2  LYS 102           HZ1      LYS 102   3.547  25.843  20.416
   12    HZ1  LYS 102           HZ2      LYS 102   4.785  24.739  20.076
   13    HZ3  LYS 102           HZ3      LYS 102   5.162  26.259  20.725

  No H/Q in entry =          13
  In of MODEL   88
    1    H    ALA 103           H        ALA 103   5.047  23.726  18.325
    2    HA   ALA 103           HA       ALA 103   2.611  24.343  19.233
    3    HB1  ALA 103           HB1      ALA 103   1.679  23.532  16.993
    4    HB2  ALA 103           HB2      ALA 103   3.314  22.966  16.647
    5    HB3  ALA 103           HB3      ALA 103   3.014  24.683  16.926

  No H/Q in entry =           5
  In of MODEL   88
    1    H1   ALA   1           H3       ALA   1  10.169 -20.157  -6.372
    2    H2   ALA   1           H2       ALA   1   9.190 -20.336  -7.752
    3    H3   ALA   1           H1       ALA   1   8.750 -21.082  -6.290
    4    HA   ALA   1           HA       ALA   1   9.748 -22.907  -7.048
    5    HB1  ALA   1           HB1      ALA   1   9.833 -22.535  -9.322
    6    HB2  ALA   1           HB2      ALA   1  11.565 -22.421  -9.006
    7    HB3  ALA   1           HB3      ALA   1  10.594 -20.953  -9.141

  No H/Q in entry =           7
  In of MODEL   88
    1    H    GLU   2           H        GLU   2  12.012 -23.901  -7.130
    2    HA   GLU   2           HA       GLU   2  13.413 -23.860  -4.929
    3    HB2  GLU   2           HB2      GLU   2  14.750 -23.738  -7.639
    4    HB3  GLU   2           HB3      GLU   2  15.478 -24.373  -6.163
    5    HG2  GLU   2           HG2      GLU   2  14.420 -26.368  -6.408
    6    HG3  GLU   2           HG3      GLU   2  12.861 -25.590  -6.649

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLU   3           H        GLU   3  15.201 -22.016  -7.334
    2    HA   GLU   3           HA       GLU   3  16.403 -20.364  -5.374
    3    HB2  GLU   3           HB2      GLU   3  16.323 -20.342  -8.383
    4    HB3  GLU   3           HB3      GLU   3  17.102 -19.033  -7.494
    5    HG2  GLU   3           HG2      GLU   3  18.744 -20.446  -6.593
    6    HG3  GLU   3           HG3      GLU   3  17.768 -21.892  -6.815

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LEU   4           H        LEU   4  14.117 -19.455  -7.981
    2    HA   LEU   4           HA       LEU   4  13.707 -16.841  -7.350
    3    HB2  LEU   4           HB2      LEU   4  11.488 -18.768  -8.074
    4    HB3  LEU   4           HB3      LEU   4  11.446 -17.017  -8.261
    5    HG   LEU   4           HG       LEU   4  13.362 -18.910  -9.662
    6   HD13  LEU   4          HD11      LEU   4  12.048 -18.723 -11.560
    7   HD12  LEU   4          HD12      LEU   4  11.374 -17.168 -11.077
    8   HD11  LEU   4          HD13      LEU   4  10.797 -18.652 -10.320
    9   HD23  LEU   4          HD21      LEU   4  13.732 -16.663 -11.002
   10   HD22  LEU   4          HD22      LEU   4  14.599 -16.932  -9.491
   11   HD21  LEU   4          HD23      LEU   4  13.166 -15.907  -9.512

  No H/Q in entry =          11
  In of MODEL   88
    1    H    GLU   5           H        GLU   5  12.181 -19.605  -5.712
    2    HA   GLU   5           HA       GLU   5  10.549 -18.011  -3.986
    3    HB2  GLU   5           HB2      GLU   5  11.323 -20.875  -4.171
    4    HB3  GLU   5           HB3      GLU   5  10.684 -20.289  -2.633
    5    HG2  GLU   5           HG2      GLU   5   9.244 -19.471  -5.110
    6    HG3  GLU   5           HG3      GLU   5   9.075 -21.148  -4.592

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLU   6           H        GLU   6  13.667 -19.656  -3.579
    2    HA   GLU   6           HA       GLU   6  14.059 -18.823  -0.878
    3    HB2  GLU   6           HB2      GLU   6  15.241 -20.754  -1.873
    4    HB3  GLU   6           HB3      GLU   6  16.104 -19.656  -2.953
    5    HG2  GLU   6           HG2      GLU   6  17.087 -18.504  -1.018
    6    HG3  GLU   6           HG3      GLU   6  16.205 -19.568   0.077

  No H/Q in entry =           6
  In of MODEL   88
    1    H    VAL   7           H        VAL   7  14.824 -17.492  -4.026
    2    HA   VAL   7           HA       VAL   7  16.559 -15.404  -3.163
    3    HB   VAL   7           HB       VAL   7  14.826 -15.719  -5.628
    4   HG11  VAL   7          HG11      VAL   7  16.768 -13.548  -4.818
    5   HG13  VAL   7          HG12      VAL   7  15.124 -13.370  -5.427
    6   HG12  VAL   7          HG13      VAL   7  16.415 -13.891  -6.511
    7   HG21  VAL   7          HG21      VAL   7  16.909 -17.220  -5.086
    8   HG23  VAL   7          HG22      VAL   7  17.839 -15.774  -5.482
    9   HG22  VAL   7          HG23      VAL   7  16.778 -16.496  -6.690

  No H/Q in entry =           9
  In of MODEL   88
    1    H    VAL   8           H        VAL   8  13.057 -15.603  -3.692
    2    HA   VAL   8           HA       VAL   8  12.448 -12.885  -3.199
    3    HB   VAL   8           HB       VAL   8  10.792 -15.386  -2.767
    4   HG13  VAL   8          HG11      VAL   8   9.784 -13.737  -1.391
    5   HG12  VAL   8          HG12      VAL   8   8.882 -13.649  -2.903
    6   HG11  VAL   8          HG13      VAL   8  10.122 -12.447  -2.545
    7   HG21  VAL   8          HG21      VAL   8  11.673 -14.306  -5.145
    8   HG23  VAL   8          HG22      VAL   8  10.153 -13.444  -4.923
    9   HG22  VAL   8          HG23      VAL   8  10.165 -15.204  -4.978

  No H/Q in entry =           9
  In of MODEL   88
    1    H    MET   9           H        MET   9  12.678 -15.709  -1.038
    2    HA   MET   9           HA       MET   9  11.907 -14.437   1.346
    3    HB2  MET   9           HB2      MET   9  13.765 -16.744   0.776
    4    HB3  MET   9           HB3      MET   9  13.491 -16.168   2.420
    5    HG2  MET   9           HG2      MET   9  11.055 -16.501   2.124
    6    HG3  MET   9           HG3      MET   9  11.347 -17.107   0.492
    7    HE1  MET   9           HE1      MET   9  12.343 -17.257   4.073
    8    HE3  MET   9           HE2      MET   9  12.493 -18.959   4.499
    9    HE2  MET   9           HE3      MET   9  10.900 -18.268   4.208

  No H/Q in entry =           9
  In of MODEL   88
    1    H    GLY  10           H        GLY  10  15.070 -14.711  -0.237
    2    HA3  GLY  10           HA2      GLY  10  16.572 -13.330   1.729
    3    HA2  GLY  10           HA3      GLY  10  17.018 -13.494   0.031

  No H/Q in entry =           3
  In of MODEL   88
    1    H    LEU  11           H        LEU  11  14.863 -12.225  -1.183
    2    HA   LEU  11           HA       LEU  11  15.599  -9.494  -1.009
    3    HB2  LEU  11           HB2      LEU  11  13.196 -10.853  -2.233
    4    HB3  LEU  11           HB3      LEU  11  13.507  -9.123  -2.385
    5    HG   LEU  11           HG       LEU  11  15.489 -11.263  -3.202
    6   HD13  LEU  11          HD11      LEU  11  13.725 -11.589  -4.710
    7   HD12  LEU  11          HD12      LEU  11  14.742 -10.421  -5.551
    8   HD11  LEU  11          HD13      LEU  11  13.285  -9.880  -4.718
    9   HD22  LEU  11          HD21      LEU  11  16.758  -9.324  -2.974
   10   HD21  LEU  11          HD22      LEU  11  15.399  -8.260  -3.336
   11   HD23  LEU  11          HD23      LEU  11  16.204  -9.135  -4.637

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  12           H        ILE  12  12.808 -11.277   0.270
    2    HA   ILE  12           HA       ILE  12  11.464  -9.036   1.354
    3    HB   ILE  12           HB       ILE  12  11.456 -11.925   2.283
    4   HG12  ILE  12          HG12      ILE  12  10.757 -11.269  -0.152
    5   HG13  ILE  12          HG13      ILE  12   9.711 -12.333   0.765
    6   HG21  ILE  12          HG21      ILE  12   9.583  -9.615   2.890
    7   HG23  ILE  12          HG22      ILE  12  10.548 -10.534   4.044
    8   HG22  ILE  12          HG23      ILE  12   9.194 -11.302   3.217
    9   HD13  ILE  12          HD11      ILE  12   8.248 -10.468   1.299
   10   HD12  ILE  12          HD12      ILE  12   8.498 -10.515  -0.444
   11   HD11  ILE  12          HD13      ILE  12   9.355  -9.342   0.533

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  13           H        ILE  13  13.828 -11.291   2.727
    2    HA   ILE  13           HA       ILE  13  13.905 -10.128   5.314
    3    HB   ILE  13           HB       ILE  13  15.925 -11.726   3.722
    4   HG12  ILE  13          HG12      ILE  13  13.649 -12.673   4.554
    5   HG13  ILE  13          HG13      ILE  13  15.111 -13.608   4.848
    6   HG23  ILE  13          HG21      ILE  13  17.336 -10.641   5.244
    7   HG22  ILE  13          HG22      ILE  13  16.920 -12.110   6.117
    8   HG21  ILE  13          HG23      ILE  13  16.113 -10.592   6.511
    9   HD13  ILE  13          HD11      ILE  13  15.031 -13.256   7.134
   10   HD12  ILE  13          HD12      ILE  13  13.317 -13.055   6.786
   11   HD11  ILE  13          HD13      ILE  13  14.349 -11.641   6.950

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ASN  14           H        ASN  14  15.844  -9.612   2.383
    2    HA   ASN  14           HA       ASN  14  17.629  -7.706   3.442
    3    HB2  ASN  14           HB2      ASN  14  17.567  -8.958   1.119
    4    HB3  ASN  14           HB3      ASN  14  16.693  -7.523   0.598
    5   HD21  ASN  14          HD21      ASN  14  19.118  -7.895  -0.609
    6   HD22  ASN  14          HD22      ASN  14  20.284  -6.835   0.015

  No H/Q in entry =           6
  In of MODEL   88
    1    H    SER  15           H        SER  15  14.511  -7.298   1.777
    2    HA   SER  15           HA       SER  15  14.444  -4.477   1.851
    3    HB2  SER  15           HB2      SER  15  12.106  -4.683   1.372
    4    HB3  SER  15           HB3      SER  15  12.873  -6.058   0.589
    5    HG   SER  15           HG       SER  15  11.239  -5.951   2.842

  No H/Q in entry =           5
  In of MODEL   88
    1    H    GLY  16           H        GLY  16  13.330  -6.933   4.149
    2    HA3  GLY  16           HA2      GLY  16  12.151  -5.177   6.026
    3    HA2  GLY  16           HA3      GLY  16  12.743  -6.797   6.374

  No H/Q in entry =           3
  In of MODEL   88
    1    H    GLN  17           H        GLN  17  15.455  -6.503   5.762
    2    HA   GLN  17           HA       GLN  17  16.449  -5.311   8.142
    3    HB2  GLN  17           HB2      GLN  17  17.832  -6.172   5.588
    4    HB3  GLN  17           HB3      GLN  17  18.702  -5.588   7.008
    5    HG2  GLN  17           HG2      GLN  17  17.761  -7.379   8.371
    6    HG3  GLN  17           HG3      GLN  17  16.779  -7.931   7.016
    7   HE21  GLN  17          HE21      GLN  17  19.670  -8.544   8.616
    8   HE22  GLN  17          HE22      GLN  17  20.498  -9.331   7.362

  No H/Q in entry =           8
  In of MODEL   88
    1    H    ALA  18           H        ALA  18  16.251  -4.210   4.790
    2    HA   ALA  18           HA       ALA  18  17.725  -1.841   5.020
    3    HB1  ALA  18           HB1      ALA  18  16.573  -3.026   2.954
    4    HB3  ALA  18           HB2      ALA  18  16.864  -1.287   2.947
    5    HB2  ALA  18           HB3      ALA  18  15.258  -1.910   3.325

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ARG  19           H        ARG  19  14.220  -2.378   5.441
    2    HA   ARG  19           HA       ARG  19  13.598   0.277   6.177
    3    HB2  ARG  19           HB2      ARG  19  11.886  -1.445   5.593
    4    HB3  ARG  19           HB3      ARG  19  12.227  -2.257   7.122
    5    HG2  ARG  19           HG2      ARG  19  11.557  -0.263   8.379
    6    HG3  ARG  19           HG3      ARG  19  11.308   0.626   6.878
    7    HD2  ARG  19           HD2      ARG  19   9.161  -0.143   7.710
    8    HD3  ARG  19           HD3      ARG  19   9.555  -1.019   6.225
    9    HE   ARG  19           HE       ARG  19  10.507  -2.589   8.313
   10   HH21  ARG  19          HH11      ARG  19   9.240  -4.216   9.252
   11   HH22  ARG  19          HH12      ARG  19   7.519  -4.161   9.095
   12   HH11  ARG  19          HH21      ARG  19   7.524  -1.245   7.249
   13   HH12  ARG  19          HH22      ARG  19   6.548  -2.479   7.957

  No H/Q in entry =          13
  In of MODEL   88
    1    H    SER  20           H        SER  20  14.427  -2.578   8.113
    2    HA   SER  20           HA       SER  20  14.180  -1.489  10.658
    3    HB2  SER  20           HB2      SER  20  14.610  -3.819  10.524
    4    HB3  SER  20           HB3      SER  20  16.054  -3.575   9.545
    5    HG   SER  20           HG       SER  20  17.031  -2.609  11.356

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LEU  21           H        LEU  21  17.008  -1.458   8.501
    2    HA   LEU  21           HA       LEU  21  18.718  -0.008  10.235
    3    HB2  LEU  21           HB2      LEU  21  18.669  -0.262   7.220
    4    HB3  LEU  21           HB3      LEU  21  19.943   0.575   8.105
    5    HG   LEU  21           HG       LEU  21  19.165  -2.309   8.628
    6   HD12  LEU  21          HD11      LEU  21  21.438  -2.690   7.426
    7   HD11  LEU  21          HD12      LEU  21  21.177  -1.084   6.748
    8   HD13  LEU  21          HD13      LEU  21  20.015  -2.371   6.433
    9   HD23  LEU  21          HD21      LEU  21  21.658  -2.185   9.510
   10   HD22  LEU  21          HD22      LEU  21  20.358  -1.597  10.539
   11   HD21  LEU  21          HD23      LEU  21  21.335  -0.457   9.629

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ALA  22           H        ALA  22  16.450   1.011   7.703
    2    HA   ALA  22           HA       ALA  22  17.030   3.761   7.729
    3    HB3  ALA  22           HB1      ALA  22  15.596   2.550   6.054
    4    HB2  ALA  22           HB2      ALA  22  14.917   4.070   6.635
    5    HB1  ALA  22           HB3      ALA  22  14.308   2.536   7.258

  No H/Q in entry =           5
  In of MODEL   88
    1    H    TYR  23           H        TYR  23  14.520   1.972   9.572
    2    HA   TYR  23           HA       TYR  23  13.602   4.214  11.042
    3    HB2  TYR  23           HB2      TYR  23  12.335   2.120  11.017
    4    HB3  TYR  23           HB3      TYR  23  13.659   1.284  11.827
    5    HD1  TYR  23           HD1      TYR  23  11.210   4.072  12.229
    6    HD2  TYR  23           HD2      TYR  23  13.866   1.318  14.182
    7    HE1  TYR  23           HE1      TYR  23  10.309   4.766  14.435
    8    HE2  TYR  23           HE2      TYR  23  12.966   2.011  16.385
    9    HH   TYR  23           HH       TYR  23  10.243   4.269  16.630

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ALA  24           H        ALA  24  16.217   1.894  11.645
    2    HA   ALA  24           HA       ALA  24  16.921   2.863  14.210
    3    HB3  ALA  24           HB1      ALA  24  18.248   1.050  14.024
    4    HB2  ALA  24           HB2      ALA  24  19.282   1.962  12.923
    5    HB1  ALA  24           HB3      ALA  24  17.967   0.978  12.285

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ALA  25           H        ALA  25  17.868   3.797  10.929
    2    HA   ALA  25           HA       ALA  25  19.849   5.697  11.572
    3    HB1  ALA  25           HB1      ALA  25  19.100   4.774   9.256
    4    HB3  ALA  25           HB2      ALA  25  19.629   6.453   9.356
    5    HB2  ALA  25           HB3      ALA  25  17.908   6.074   9.297

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LEU  26           H        LEU  26  16.336   5.984  11.239
    2    HA   LEU  26           HA       LEU  26  16.159   8.766  11.708
    3    HB2  LEU  26           HB2      LEU  26  14.271   7.566  10.787
    4    HB3  LEU  26           HB3      LEU  26  14.175   6.531  12.207
    5    HG   LEU  26           HG       LEU  26  13.610   8.489  13.603
    6   HD12  LEU  26          HD11      LEU  26  12.974  10.609  12.296
    7   HD11  LEU  26          HD12      LEU  26  13.934   9.948  10.975
    8   HD13  LEU  26          HD13      LEU  26  14.696  10.312  12.524
    9   HD21  LEU  26          HD21      LEU  26  11.911   8.219  11.104
   10   HD23  LEU  26          HD22      LEU  26  11.374   8.916  12.629
   11   HD22  LEU  26          HD23      LEU  26  11.797   7.208  12.545

  No H/Q in entry =          11
  In of MODEL   88
    1    H    LYS  27           H        LYS  27  16.022   5.975  13.885
    2    HA   LYS  27           HA       LYS  27  15.469   7.335  16.266
    3    HB2  LYS  27           HB2      LYS  27  15.455   4.862  15.986
    4    HB3  LYS  27           HB3      LYS  27  17.218   4.885  15.929
    5    HG2  LYS  27           HG2      LYS  27  17.301   5.856  18.185
    6    HG3  LYS  27           HG3      LYS  27  15.535   5.903  18.243
    7    HD2  LYS  27           HD2      LYS  27  15.467   3.439  17.992
    8    HD3  LYS  27           HD3      LYS  27  17.232   3.399  17.967
    9    HE2  LYS  27           HE2      LYS  27  17.299   4.373  20.229
   10    HE3  LYS  27           HE3      LYS  27  15.534   4.442  20.257
   11    HZ3  LYS  27           HZ1      LYS  27  16.298   2.470  21.390
   12    HZ2  LYS  27           HZ2      LYS  27  17.196   1.984  20.029
   13    HZ1  LYS  27           HZ3      LYS  27  15.498   2.018  19.963

  No H/Q in entry =          13
  In of MODEL   88
    1    H    GLN  28           H        GLN  28  18.564   6.711  14.647
    2    HA   GLN  28           HA       GLN  28  20.281   7.753  16.631
    3    HB2  GLN  28           HB2      GLN  28  20.545   7.721  13.614
    4    HB3  GLN  28           HB3      GLN  28  21.847   8.164  14.717
    5    HG2  GLN  28           HG2      GLN  28  20.385   5.509  14.747
    6    HG3  GLN  28           HG3      GLN  28  21.971   5.777  14.027
    7   HE21  GLN  28          HE21      GLN  28  20.709   4.431  16.702
    8   HE22  GLN  28          HE22      GLN  28  21.894   4.840  17.847

  No H/Q in entry =           8
  In of MODEL   88
    1    H    ALA  29           H        ALA  29  18.535   9.283  13.962
    2    HA   ALA  29           HA       ALA  29  19.582  11.884  14.223
    3    HB2  ALA  29           HB1      ALA  29  17.884  12.559  12.769
    4    HB1  ALA  29           HB2      ALA  29  16.724  11.402  13.421
    5    HB3  ALA  29           HB3      ALA  29  18.037  10.843  12.385

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LYS  30           H        LYS  30  16.788  10.324  15.755
    2    HA   LYS  30           HA       LYS  30  15.825  12.587  17.134
    3    HB2  LYS  30           HB2      LYS  30  15.665   9.644  17.820
    4    HB3  LYS  30           HB3      LYS  30  14.829  10.904  18.728
    5    HG2  LYS  30           HG2      LYS  30  13.701  11.623  16.623
    6    HG3  LYS  30           HG3      LYS  30  14.475  10.278  15.781
    7    HD2  LYS  30           HD2      LYS  30  13.386   8.681  17.308
    8    HD3  LYS  30           HD3      LYS  30  12.622  10.014  18.173
    9    HE2  LYS  30           HE2      LYS  30  11.450  10.682  16.094
   10    HE3  LYS  30           HE3      LYS  30  12.193   9.319  15.248
   11    HZ2  LYS  30           HZ1      LYS  30   9.884   8.946  16.143
   12    HZ1  LYS  30           HZ2      LYS  30  10.564   8.977  17.706
   13    HZ3  LYS  30           HZ3      LYS  30  11.043   7.790  16.584

  No H/Q in entry =          13
  In of MODEL   88
    1    H    GLN  31           H        GLN  31  18.451  10.364  17.837
    2    HA   GLN  31           HA       GLN  31  18.817  11.355  20.535
    3    HB2  GLN  31           HB2      GLN  31  20.799   9.758  18.905
    4    HB3  GLN  31           HB3      GLN  31  20.680   9.874  20.662
    5    HG2  GLN  31           HG2      GLN  31  18.144   8.973  19.906
    6    HG3  GLN  31           HG3      GLN  31  19.222   8.115  18.812
    7   HE21  GLN  31          HE21      GLN  31  17.675   6.983  21.093
    8   HE22  GLN  31          HE22      GLN  31  18.826   6.294  22.131

  No H/Q in entry =           8
  In of MODEL   88
    1    H    GLY  32           H        GLY  32  19.338  12.682  17.573
    2    HA3  GLY  32           HA2      GLY  32  20.356  14.712  17.064
    3    HA2  GLY  32           HA3      GLY  32  21.125  14.693  18.646

  No H/Q in entry =           3
  In of MODEL   88
    1    H    ASP  33           H        ASP  33  21.481  11.804  16.848
    2    HA   ASP  33           HA       ASP  33  24.315  12.431  16.365
    3    HB2  ASP  33           HB2      ASP  33  22.759   9.842  16.476
    4    HB3  ASP  33           HB3      ASP  33  24.444   9.931  15.969

  No H/Q in entry =           4
  In of MODEL   88
    1    H    PHE  34           H        PHE  34  23.843  13.775  14.495
    2    HA   PHE  34           HA       PHE  34  22.459  12.830  12.212
    3    HB2  PHE  34           HB2      PHE  34  24.631  14.924  12.440
    4    HB3  PHE  34           HB3      PHE  34  23.629  14.660  11.013
    5    HD1  PHE  34           HD1      PHE  34  23.937  16.571  13.937
    6    HD2  PHE  34           HD2      PHE  34  21.004  14.523  11.560
    7    HE1  PHE  34           HE1      PHE  34  22.154  17.995  14.907
    8    HE2  PHE  34           HE2      PHE  34  19.224  15.947  12.533
    9    HZ   PHE  34           HZ       PHE  34  19.803  17.684  14.202

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ALA  35           H        ALA  35  25.837  12.575  13.193
    2    HA   ALA  35           HA       ALA  35  26.909  11.750  10.723
    3    HB3  ALA  35           HB1      ALA  35  28.581  10.539  12.422
    4    HB2  ALA  35           HB2      ALA  35  27.745  11.573  13.581
    5    HB1  ALA  35           HB3      ALA  35  28.584  12.290  12.206

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ALA  36           H        ALA  36  25.780   9.797  13.484
    2    HA   ALA  36           HA       ALA  36  26.210   7.309  12.189
    3    HB2  ALA  36           HB1      ALA  36  25.781   6.557  14.263
    4    HB3  ALA  36           HB2      ALA  36  24.101   7.083  14.129
    5    HB1  ALA  36           HB3      ALA  36  25.327   8.189  14.750

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ALA  37           H        ALA  37  23.427   9.483  12.358
    2    HA   ALA  37           HA       ALA  37  21.531   7.754  11.185
    3    HB3  ALA  37           HB1      ALA  37  21.811  10.711  11.494
    4    HB1  ALA  37           HB2      ALA  37  20.484   9.652  11.970
    5    HB2  ALA  37           HB3      ALA  37  20.668  10.131  10.282

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LYS  38           H        LYS  38  23.662  10.188   9.706
    2    HA   LYS  38           HA       LYS  38  22.995   9.788   7.031
    3    HB2  LYS  38           HB2      LYS  38  24.842  11.305   8.472
    4    HB3  LYS  38           HB3      LYS  38  25.850  10.305   7.432
    5    HG2  LYS  38           HG2      LYS  38  24.684  11.108   5.450
    6    HG3  LYS  38           HG3      LYS  38  23.512  11.976   6.446
    7    HD2  LYS  38           HD2      LYS  38  25.139  13.543   7.196
    8    HD3  LYS  38           HD3      LYS  38  26.478  12.537   6.643
    9    HE2  LYS  38           HE2      LYS  38  26.142  14.424   5.107
   10    HE3  LYS  38           HE3      LYS  38  25.775  12.898   4.295
   11    HZ3  LYS  38           HZ1      LYS  38  23.585  13.380   4.185
   12    HZ2  LYS  38           HZ2      LYS  38  24.135  14.985   4.278
   13    HZ1  LYS  38           HZ3      LYS  38  23.559  14.203   5.670

  No H/Q in entry =          13
  In of MODEL   88
    1    H    ALA  39           H        ALA  39  25.496   8.136   8.958
    2    HA   ALA  39           HA       ALA  39  26.523   6.543   6.870
    3    HB2  ALA  39           HB1      ALA  39  26.440   5.563   9.708
    4    HB1  ALA  39           HB2      ALA  39  27.413   6.975   9.294
    5    HB3  ALA  39           HB3      ALA  39  27.733   5.424   8.518

  No H/Q in entry =           5
  In of MODEL   88
    1    H    MET  40           H        MET  40  23.918   5.956   9.184
    2    HA   MET  40           HA       MET  40  23.425   3.264   8.437
    3    HB2  MET  40           HB2      MET  40  21.652   5.328   9.756
    4    HB3  MET  40           HB3      MET  40  21.216   3.627   9.573
    5    HG2  MET  40           HG2      MET  40  23.791   4.518  10.900
    6    HG3  MET  40           HG3      MET  40  22.299   4.261  11.803
    7    HE3  MET  40           HE1      MET  40  21.677   0.636  11.960
    8    HE2  MET  40           HE2      MET  40  20.824   1.958  11.168
    9    HE1  MET  40           HE3      MET  40  21.581   2.223  12.737

  No H/Q in entry =           9
  In of MODEL   88
    1    H    MET  41           H        MET  41  22.052   6.347   7.279
    2    HA   MET  41           HA       MET  41  20.063   5.195   5.615
    3    HB2  MET  41           HB2      MET  41  21.582   7.764   5.107
    4    HB3  MET  41           HB3      MET  41  20.041   7.299   4.397
    5    HG2  MET  41           HG2      MET  41  19.311   7.107   6.953
    6    HG3  MET  41           HG3      MET  41  20.640   8.242   7.172
    7    HE2  MET  41           HE1      MET  41  20.073   9.560   3.848
    8    HE1  MET  41           HE2      MET  41  21.048   9.975   5.255
    9    HE3  MET  41           HE3      MET  41  19.788  11.078   4.707

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ASP  42           H        ASP  42  23.446   6.067   5.042
    2    HA   ASP  42           HA       ASP  42  23.509   5.609   2.281
    3    HB2  ASP  42           HB2      ASP  42  25.289   6.567   4.043
    4    HB3  ASP  42           HB3      ASP  42  25.920   4.932   3.900

  No H/Q in entry =           4
  In of MODEL   88
    1    H    GLN  43           H        GLN  43  24.219   3.425   4.982
    2    HA   GLN  43           HA       GLN  43  24.835   1.168   3.380
    3    HB2  GLN  43           HB2      GLN  43  23.837   1.349   6.232
    4    HB3  GLN  43           HB3      GLN  43  24.387  -0.144   5.463
    5    HG2  GLN  43           HG2      GLN  43  26.565   1.035   4.943
    6    HG3  GLN  43           HG3      GLN  43  26.011   2.365   5.956
    7   HE21  GLN  43          HE21      GLN  43  28.236   1.350   6.969
    8   HE22  GLN  43          HE22      GLN  43  27.954   0.264   8.240

  No H/Q in entry =           8
  In of MODEL   88
    1    H    SER  44           H        SER  44  21.808   2.341   4.796
    2    HA   SER  44           HA       SER  44  20.199   0.128   4.121
    3    HB2  SER  44           HB2      SER  44  19.807   2.656   5.286
    4    HB3  SER  44           HB3      SER  44  18.761   2.638   3.869
    5    HG   SER  44           HG       SER  44  17.666   1.702   5.594

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ARG  45           H        ARG  45  20.975   3.092   2.329
    2    HA   ARG  45           HA       ARG  45  19.425   2.645   0.033
    3    HB2  ARG  45           HB2      ARG  45  20.608   4.759   0.622
    4    HB3  ARG  45           HB3      ARG  45  22.137   3.982   0.220
    5    HG2  ARG  45           HG2      ARG  45  21.329   3.604  -2.091
    6    HG3  ARG  45           HG3      ARG  45  19.812   4.404  -1.687
    7    HD2  ARG  45           HD2      ARG  45  21.101   6.476  -1.100
    8    HD3  ARG  45           HD3      ARG  45  22.580   5.682  -1.685
    9    HE   ARG  45           HE       ARG  45  20.631   5.488  -3.707
   10   HH21  ARG  45          HH11      ARG  45  20.632   6.869  -5.462
   11   HH22  ARG  45          HH12      ARG  45  21.415   8.406  -5.354
   12   HH11  ARG  45          HH21      ARG  45  22.414   7.948  -2.078
   13   HH12  ARG  45          HH22      ARG  45  22.423   9.016  -3.435

  No H/Q in entry =          13
  In of MODEL   88
    1    H    MET  46           H        MET  46  22.780   1.711   0.749
    2    HA   MET  46           HA       MET  46  23.347   0.524  -1.748
    3    HB2  MET  46           HB2      MET  46  24.469   0.140   1.030
    4    HB3  MET  46           HB3      MET  46  25.109  -0.723  -0.372
    5    HG2  MET  46           HG2      MET  46  25.520   1.435  -1.510
    6    HG3  MET  46           HG3      MET  46  24.892   2.294  -0.109
    7    HE1  MET  46           HE1      MET  46  26.774   3.708   0.183
    8    HE3  MET  46           HE2      MET  46  27.828   3.087  -1.083
    9    HE2  MET  46           HE3      MET  46  28.445   3.268   0.558

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ALA  47           H        ALA  47  21.965  -0.805   1.231
    2    HA   ALA  47           HA       ALA  47  21.859  -3.511   0.412
    3    HB2  ALA  47           HB1      ALA  47  21.507  -3.059   2.722
    4    HB3  ALA  47           HB2      ALA  47  19.956  -3.632   2.113
    5    HB1  ALA  47           HB3      ALA  47  20.217  -1.907   2.380

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LEU  48           H        LEU  48  19.549  -0.842   0.091
    2    HA   LEU  48           HA       LEU  48  17.468  -2.333  -1.152
    3    HB2  LEU  48           HB2      LEU  48  18.172   0.610  -1.254
    4    HB3  LEU  48           HB3      LEU  48  16.683  -0.071  -1.913
    5    HG   LEU  48           HG       LEU  48  17.556  -0.405   0.967
    6   HD13  LEU  48          HD11      LEU  48  17.176   1.904   0.797
    7   HD12  LEU  48          HD12      LEU  48  15.611   1.280   1.316
    8   HD11  LEU  48          HD13      LEU  48  15.875   1.708  -0.375
    9   HD22  LEU  48          HD21      LEU  48  15.994  -2.090   0.589
   10   HD21  LEU  48          HD22      LEU  48  15.126  -1.165  -0.636
   11   HD23  LEU  48          HD23      LEU  48  14.935  -0.767   1.071

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ASN  49           H        ASN  49  20.178  -0.444  -2.394
    2    HA   ASN  49           HA       ASN  49  19.503  -0.500  -5.113
    3    HB2  ASN  49           HB2      ASN  49  21.220   0.977  -4.178
    4    HB3  ASN  49           HB3      ASN  49  22.232  -0.410  -3.793
    5   HD21  ASN  49          HD21      ASN  49  23.227   1.620  -5.461
    6   HD22  ASN  49          HD22      ASN  49  23.371   1.026  -7.043

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLU  50           H        GLU  50  21.465  -2.741  -3.181
    2    HA   GLU  50           HA       GLU  50  22.117  -4.496  -5.323
    3    HB2  GLU  50           HB2      GLU  50  23.334  -4.504  -3.167
    4    HB3  GLU  50           HB3      GLU  50  21.888  -5.111  -2.362
    5    HG2  GLU  50           HG2      GLU  50  21.929  -7.138  -3.733
    6    HG3  GLU  50           HG3      GLU  50  23.308  -6.524  -4.643

  No H/Q in entry =           6
  In of MODEL   88
    1    H    ALA  51           H        ALA  51  19.483  -4.397  -2.973
    2    HA   ALA  51           HA       ALA  51  18.267  -6.845  -3.734
    3    HB3  ALA  51           HB1      ALA  51  16.697  -6.320  -2.161
    4    HB1  ALA  51           HB2      ALA  51  16.508  -4.667  -2.749
    5    HB2  ALA  51           HB3      ALA  51  17.869  -5.083  -1.707

  No H/Q in entry =           5
  In of MODEL   88
    1    H    HIS  52           H        HIS  52  17.731  -3.481  -4.744
    2    HA   HIS  52           HA       HIS  52  15.592  -3.960  -6.528
    3    HB2  HIS  52           HB2      HIS  52  16.289  -1.712  -5.720
    4    HB3  HIS  52           HB3      HIS  52  17.732  -1.828  -6.726
    5    HD1  HIS  52           HD1      HIS  52  17.317  -1.988  -9.362
    6    HD2  HIS  52           HD2      HIS  52  13.970  -0.964  -7.097
    7    HE1  HIS  52           HE1      HIS  52  15.610  -1.058 -10.986
    8    HE2  HIS  52           HE2      HIS  52  13.564  -0.428  -9.620

  No H/Q in entry =           8
  In of MODEL   88
    1    H    LEU  53           H        LEU  53  19.106  -4.025  -6.993
    2    HA   LEU  53           HA       LEU  53  19.133  -4.326  -9.795
    3    HB2  LEU  53           HB2      LEU  53  21.071  -5.128  -7.640
    4    HB3  LEU  53           HB3      LEU  53  21.366  -5.520  -9.333
    5    HG   LEU  53           HG       LEU  53  20.752  -2.698  -8.400
    6   HD12  LEU  53          HD11      LEU  53  23.273  -2.390  -8.710
    7   HD11  LEU  53          HD12      LEU  53  23.392  -4.148  -8.661
    8   HD13  LEU  53          HD13      LEU  53  22.775  -3.268  -7.267
    9   HD21  LEU  53          HD21      LEU  53  21.796  -3.947 -10.949
   10   HD23  LEU  53          HD22      LEU  53  22.154  -2.268 -10.559
   11   HD22  LEU  53          HD23      LEU  53  20.490  -2.782 -10.768

  No H/Q in entry =          11
  In of MODEL   88
    1    H    VAL  54           H        VAL  54  19.003  -6.725  -7.181
    2    HA   VAL  54           HA       VAL  54  19.071  -9.012  -8.855
    3    HB   VAL  54           HB       VAL  54  17.949  -8.584  -6.075
    4   HG12  VAL  54          HG11      VAL  54  18.228 -11.206  -6.087
    5   HG11  VAL  54          HG12      VAL  54  18.031 -11.025  -7.830
    6   HG13  VAL  54          HG13      VAL  54  16.761 -10.479  -6.737
    7   HG22  VAL  54          HG21      VAL  54  20.270  -8.414  -5.872
    8   HG21  VAL  54          HG22      VAL  54  20.577  -9.504  -7.222
    9   HG23  VAL  54          HG23      VAL  54  20.049 -10.150  -5.668

  No H/Q in entry =           9
  In of MODEL   88
    1    H    GLN  55           H        GLN  55  16.387  -7.070  -7.537
    2    HA   GLN  55           HA       GLN  55  14.329  -8.693  -8.601
    3    HB2  GLN  55           HB2      GLN  55  13.621  -7.164  -6.960
    4    HB3  GLN  55           HB3      GLN  55  14.430  -5.805  -7.735
    5    HG2  GLN  55           HG2      GLN  55  12.698  -5.444  -9.208
    6    HG3  GLN  55           HG3      GLN  55  12.346  -7.158  -9.384
    7   HE21  GLN  55          HE21      GLN  55  10.337  -7.677  -8.564
    8   HE22  GLN  55          HE22      GLN  55   9.588  -6.917  -7.244

  No H/Q in entry =           8
  In of MODEL   88
    1    H    THR  56           H        THR  56  16.103  -5.916  -9.961
    2    HA   THR  56           HA       THR  56  14.650  -5.517 -12.295
    3    HB   THR  56           HB       THR  56  17.657  -5.413 -11.939
    4    HG1  THR  56           HG1      THR  56  16.213  -4.057 -10.620
    5   HG23  THR  56          HG21      THR  56  17.403  -5.374 -14.252
    6   HG22  THR  56          HG22      THR  56  17.269  -3.660 -13.860
    7   HG21  THR  56          HG23      THR  56  15.814  -4.611 -14.166

  No H/Q in entry =           7
  In of MODEL   88
    1    H    LYS  57           H        LYS  57  17.266  -7.861 -11.720
    2    HA   LYS  57           HA       LYS  57  17.224  -9.041 -14.304
    3    HB2  LYS  57           HB2      LYS  57  19.029  -9.336 -12.586
    4    HB3  LYS  57           HB3      LYS  57  17.917 -10.306 -11.631
    5    HG2  LYS  57           HG2      LYS  57  17.754 -11.951 -13.435
    6    HG3  LYS  57           HG3      LYS  57  18.806 -10.974 -14.452
    7    HD2  LYS  57           HD2      LYS  57  20.639 -11.238 -12.814
    8    HD3  LYS  57           HD3      LYS  57  19.591 -12.234 -11.802
    9    HE2  LYS  57           HE2      LYS  57  19.375 -13.880 -13.634
   10    HE3  LYS  57           HE3      LYS  57  20.416 -12.894 -14.659
   11    HZ1  LYS  57           HZ1      LYS  57  21.623 -13.365 -12.138
   12    HZ3  LYS  57           HZ2      LYS  57  22.202 -13.725 -13.693
   13    HZ2  LYS  57           HZ3      LYS  57  21.204 -14.832 -12.879

  No H/Q in entry =          13
  In of MODEL   88
    1    H    LEU  58           H        LEU  58  15.460  -9.695 -11.316
    2    HA   LEU  58           HA       LEU  58  14.192 -12.044 -12.251
    3    HB2  LEU  58           HB2      LEU  58  13.448 -10.137 -10.039
    4    HB3  LEU  58           HB3      LEU  58  12.613 -11.660 -10.355
    5    HG   LEU  58           HG       LEU  58  15.595 -11.433  -9.827
    6   HD11  LEU  58          HD11      LEU  58  13.234 -11.822  -8.015
    7   HD13  LEU  58          HD12      LEU  58  14.705 -10.883  -7.761
    8   HD12  LEU  58          HD13      LEU  58  14.751 -12.641  -7.635
    9   HD22  LEU  58          HD21      LEU  58  15.435 -13.487 -10.864
   10   HD21  LEU  58          HD22      LEU  58  13.721 -13.671 -10.489
   11   HD23  LEU  58          HD23      LEU  58  14.936 -13.998  -9.252

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  59           H        ILE  59  13.568  -8.693 -12.911
    2    HA   ILE  59           HA       ILE  59  10.834  -9.293 -13.829
    3    HB   ILE  59           HB       ILE  59  11.685  -7.031 -12.619
    4   HG12  ILE  59          HG12      ILE  59   9.763  -6.866 -14.952
    5   HG13  ILE  59          HG13      ILE  59   9.343  -7.633 -13.442
    6   HG22  ILE  59          HG21      ILE  59  11.761  -6.204 -15.508
    7   HG21  ILE  59          HG22      ILE  59  13.235  -6.652 -14.678
    8   HG23  ILE  59          HG23      ILE  59  12.270  -5.295 -14.105
    9   HD12  ILE  59          HD11      ILE  59  10.218  -4.766 -13.791
   10   HD11  ILE  59          HD12      ILE  59   9.905  -5.530 -12.233
   11   HD13  ILE  59          HD13      ILE  59   8.590  -5.315 -13.390

  No H/Q in entry =          11
  In of MODEL   88
    1    H    GLU  60           H        GLU  60  14.039  -8.486 -15.112
    2    HA   GLU  60           HA       GLU  60  13.241  -8.059 -17.811
    3    HB2  GLU  60           HB2      GLU  60  15.432  -7.349 -17.025
    4    HB3  GLU  60           HB3      GLU  60  15.872  -9.013 -16.648
    5    HG2  GLU  60           HG2      GLU  60  15.043  -8.257 -19.444
    6    HG3  GLU  60           HG3      GLU  60  16.699  -7.995 -18.901

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLY  61           H        GLY  61  14.189 -10.965 -16.020
    2    HA3  GLY  61           HA2      GLY  61  13.599 -12.591 -18.425
    3    HA2  GLY  61           HA3      GLY  61  14.636 -13.096 -17.095

  No H/Q in entry =           3
  In of MODEL   88
    1    H    ASP  62           H        ASP  62  11.542 -11.503 -16.692
    2    HA   ASP  62           HA       ASP  62  10.599 -13.397 -14.833
    3    HB2  ASP  62           HB2      ASP  62   8.501 -12.163 -14.952
    4    HB3  ASP  62           HB3      ASP  62   9.864 -11.049 -14.902

  No H/Q in entry =           4
  In of MODEL   88
    1    H    ALA  63           H        ALA  63  11.199 -15.255 -16.556
    2    HA   ALA  63           HA       ALA  63   9.327 -15.865 -18.615
    3    HB3  ALA  63           HB1      ALA  63  10.226 -18.248 -18.237
    4    HB2  ALA  63           HB2      ALA  63  11.279 -17.524 -17.023
    5    HB1  ALA  63           HB3      ALA  63  11.394 -17.013 -18.708

  No H/Q in entry =           5
  In of MODEL   88
    1    H    GLY  64           H        GLY  64   9.506 -16.663 -15.190
    2    HA3  GLY  64           HA2      GLY  64   8.010 -17.599 -13.727
    3    HA2  GLY  64           HA3      GLY  64   6.769 -16.873 -14.739

  No H/Q in entry =           3
  In of MODEL   88
    1    H    GLU  65           H        GLU  65   5.256 -18.432 -15.016
    2    HA   GLU  65           HA       GLU  65   5.803 -21.192 -15.024
    3    HB2  GLU  65           HB2      GLU  65   3.418 -19.652 -16.039
    4    HB3  GLU  65           HB3      GLU  65   3.481 -21.411 -15.941
    5    HG2  GLU  65           HG2      GLU  65   3.883 -21.302 -13.536
    6    HG3  GLU  65           HG3      GLU  65   3.932 -19.541 -13.598

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLY  66           H        GLY  66   4.505 -22.350 -17.004
    2    HA3  GLY  66           HA2      GLY  66   6.375 -22.601 -19.085
    3    HA2  GLY  66           HA3      GLY  66   4.768 -23.298 -19.056

  No H/Q in entry =           3
  In of MODEL   88
    1    H    LYS  67           H        LYS  67   3.382 -20.790 -18.893
    2    HA   LYS  67           HA       LYS  67   3.402 -20.124 -21.706
    3    HB2  LYS  67           HB2      LYS  67   1.553 -19.400 -19.439
    4    HB3  LYS  67           HB3      LYS  67   1.318 -18.867 -21.108
    5    HG2  LYS  67           HG2      LYS  67   1.385 -21.245 -21.847
    6    HG3  LYS  67           HG3      LYS  67   1.519 -21.743 -20.163
    7    HD2  LYS  67           HD2      LYS  67  -0.775 -20.065 -21.199
    8    HD3  LYS  67           HD3      LYS  67  -0.828 -21.828 -21.123
    9    HE2  LYS  67           HE2      LYS  67  -0.177 -21.599 -18.659
   10    HE3  LYS  67           HE3      LYS  67  -0.535 -19.881 -18.828
   11    HZ2  LYS  67           HZ1      LYS  67  -2.335 -22.138 -18.719
   12    HZ1  LYS  67           HZ2      LYS  67  -2.702 -21.006 -19.929
   13    HZ3  LYS  67           HZ3      LYS  67  -2.601 -20.515 -18.305

  No H/Q in entry =          13
  In of MODEL   88
    1    H    MET  68           H        MET  68   2.481 -17.686 -21.925
    2    HA   MET  68           HA       MET  68   4.756 -16.029 -21.854
    3    HB2  MET  68           HB2      MET  68   1.843 -15.428 -22.354
    4    HB3  MET  68           HB3      MET  68   3.142 -14.257 -22.587
    5    HG2  MET  68           HG2      MET  68   4.136 -15.535 -24.317
    6    HG3  MET  68           HG3      MET  68   3.217 -16.979 -23.891
    7    HE1  MET  68           HE1      MET  68   2.773 -13.265 -24.532
    8    HE3  MET  68           HE2      MET  68   1.280 -13.603 -23.661
    9    HE2  MET  68           HE3      MET  68   1.214 -13.121 -25.354

  No H/Q in entry =           9
  In of MODEL   88
    1    H    LYS  69           H        LYS  69   2.723 -16.741 -19.260
    2    HA   LYS  69           HA       LYS  69   2.408 -14.206 -18.065
    3    HB2  LYS  69           HB2      LYS  69   2.308 -17.009 -16.979
    4    HB3  LYS  69           HB3      LYS  69   2.046 -15.599 -15.949
    5    HG2  LYS  69           HG2      LYS  69   0.169 -14.879 -17.232
    6    HG3  LYS  69           HG3      LYS  69   0.552 -15.992 -18.546
    7    HD2  LYS  69           HD2      LYS  69  -1.357 -16.650 -16.922
    8    HD3  LYS  69           HD3      LYS  69  -0.149 -17.877 -17.310
    9    HE2  LYS  69           HE2      LYS  69   1.006 -17.531 -15.245
   10    HE3  LYS  69           HE3      LYS  69   0.099 -16.058 -14.908
   11    HZ3  LYS  69           HZ1      LYS  69  -1.016 -17.571 -13.632
   12    HZ2  LYS  69           HZ2      LYS  69  -0.759 -18.856 -14.711
   13    HZ1  LYS  69           HZ3      LYS  69  -1.921 -17.669 -15.062

  No H/Q in entry =          13
  In of MODEL   88
    1    H    VAL  70           H        VAL  70   3.217 -14.332 -15.445
    2    HA   VAL  70           HA       VAL  70   6.177 -14.387 -15.529
    3    HB   VAL  70           HB       VAL  70   6.170 -12.293 -14.192
    4   HG12  VAL  70          HG11      VAL  70   5.538 -10.789 -16.065
    5   HG11  VAL  70          HG12      VAL  70   4.713 -12.136 -16.848
    6   HG13  VAL  70          HG13      VAL  70   6.462 -12.179 -16.631
    7   HG21  VAL  70          HG21      VAL  70   3.185 -12.322 -14.798
    8   HG23  VAL  70          HG22      VAL  70   4.062 -10.974 -14.076
    9   HG22  VAL  70          HG23      VAL  70   3.914 -12.497 -13.201

  No H/Q in entry =           9
  In of MODEL   88
    1    H    SER  71           H        SER  71   7.139 -14.438 -13.354
    2    HA   SER  71           HA       SER  71   6.012 -16.443 -11.690
    3    HB2  SER  71           HB2      SER  71   8.454 -15.950 -11.856
    4    HB3  SER  71           HB3      SER  71   8.174 -14.438 -10.996
    5    HG   SER  71           HG       SER  71   8.481 -16.897 -10.011

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LEU  72           H        LEU  72   4.644 -16.301 -10.027
    2    HA   LEU  72           HA       LEU  72   3.135 -13.966  -9.557
    3    HB2  LEU  72           HB2      LEU  72   3.395 -16.538  -8.009
    4    HB3  LEU  72           HB3      LEU  72   2.255 -15.265  -7.583
    5    HG   LEU  72           HG       LEU  72   2.356 -16.547 -10.333
    6   HD11  LEU  72          HD11      LEU  72   0.581 -17.179  -7.956
    7   HD13  LEU  72          HD12      LEU  72   1.783 -18.251  -8.670
    8   HD12  LEU  72          HD13      LEU  72   0.345 -17.806  -9.587
    9   HD21  LEU  72          HD21      LEU  72   0.547 -14.592  -8.931
   10   HD23  LEU  72          HD22      LEU  72  -0.134 -15.646 -10.161
   11   HD22  LEU  72          HD23      LEU  72   1.167 -14.535 -10.577

  No H/Q in entry =          11
  In of MODEL   88
    1    H    VAL  73           H        VAL  73   5.783 -15.455  -7.815
    2    HA   VAL  73           HA       VAL  73   5.767 -13.935  -5.473
    3    HB   VAL  73           HB       VAL  73   7.941 -14.781  -5.070
    4   HG12  VAL  73          HG11      VAL  73   6.728 -16.853  -6.900
    5   HG11  VAL  73          HG12      VAL  73   5.980 -16.426  -5.360
    6   HG13  VAL  73          HG13      VAL  73   7.608 -17.103  -5.396
    7   HG21  VAL  73          HG21      VAL  73   8.090 -14.817  -8.064
    8   HG23  VAL  73          HG22      VAL  73   9.064 -15.970  -7.156
    9   HG22  VAL  73          HG23      VAL  73   9.278 -14.240  -6.894

  No H/Q in entry =           9
  In of MODEL   88
    1    H    LEU  74           H        LEU  74   6.745 -13.039  -8.652
    2    HA   LEU  74           HA       LEU  74   8.725 -11.125  -8.164
    3    HB2  LEU  74           HB2      LEU  74   8.235 -11.856 -10.403
    4    HB3  LEU  74           HB3      LEU  74   6.583 -11.254 -10.285
    5    HG   LEU  74           HG       LEU  74   7.439  -8.946 -10.066
    6   HD13  LEU  74          HD11      LEU  74   9.557  -9.179  -9.029
    7   HD12  LEU  74          HD12      LEU  74   9.945  -8.708 -10.682
    8   HD11  LEU  74          HD13      LEU  74  10.087 -10.395 -10.191
    9   HD23  LEU  74          HD21      LEU  74   8.876 -10.062 -12.417
   10   HD22  LEU  74          HD22      LEU  74   7.759  -8.720 -12.305
   11   HD21  LEU  74          HD23      LEU  74   7.143 -10.357 -12.292

  No H/Q in entry =          11
  In of MODEL   88
    1    H    VAL  75           H        VAL  75   5.234 -10.681  -8.487
    2    HA   VAL  75           HA       VAL  75   5.187  -7.927  -7.884
    3    HB   VAL  75           HB       VAL  75   3.065 -10.038  -7.489
    4   HG13  VAL  75          HG11      VAL  75   2.623  -8.118  -6.005
    5   HG12  VAL  75          HG12      VAL  75   1.527  -8.059  -7.378
    6   HG11  VAL  75          HG13      VAL  75   2.930  -7.002  -7.332
    7   HG23  VAL  75          HG21      VAL  75   3.227  -7.856  -9.574
    8   HG22  VAL  75          HG22      VAL  75   2.263  -9.332  -9.610
    9   HG21  VAL  75          HG23      VAL  75   4.012  -9.414  -9.826

  No H/Q in entry =           9
  In of MODEL   88
    1    H    GLU  76           H        GLU  76   4.903 -10.812  -5.789
    2    HA   GLU  76           HA       GLU  76   4.473  -9.458  -3.356
    3    HB2  GLU  76           HB2      GLU  76   4.251 -11.915  -3.588
    4    HB3  GLU  76           HB3      GLU  76   5.978 -12.050  -3.869
    5    HG2  GLU  76           HG2      GLU  76   5.572 -12.636  -1.564
    6    HG3  GLU  76           HG3      GLU  76   6.362 -11.069  -1.563

  No H/Q in entry =           6
  In of MODEL   88
    1    H    ALA  77           H        ALA  77   7.506 -10.406  -4.948
    2    HA   ALA  77           HA       ALA  77   9.227  -9.402  -2.939
    3    HB1  ALA  77           HB1      ALA  77   9.991 -10.947  -4.690
    4    HB2  ALA  77           HB2      ALA  77  10.972  -9.483  -4.671
    5    HB3  ALA  77           HB3      ALA  77   9.736  -9.699  -5.910

  No H/Q in entry =           5
  In of MODEL   88
    1    H    GLN  78           H        GLN  78   7.837  -7.945  -5.834
    2    HA   GLN  78           HA       GLN  78   9.231  -5.489  -5.726
    3    HB2  GLN  78           HB2      GLN  78   7.903  -6.373  -7.677
    4    HB3  GLN  78           HB3      GLN  78   6.436  -5.969  -6.790
    5    HG2  GLN  78           HG2      GLN  78   7.140  -3.612  -6.690
    6    HG3  GLN  78           HG3      GLN  78   8.608  -4.010  -7.579
    7   HE21  GLN  78          HE21      GLN  78   6.593  -6.077  -9.013
    8   HE22  GLN  78          HE22      GLN  78   5.929  -5.098 -10.230

  No H/Q in entry =           8
  In of MODEL   88
    1    H    LEU  79           H        LEU  79   6.204  -6.584  -4.280
    2    HA   LEU  79           HA       LEU  79   5.258  -4.167  -3.250
    3    HB2  LEU  79           HB2      LEU  79   3.909  -6.196  -3.197
    4    HB3  LEU  79           HB3      LEU  79   5.049  -6.961  -2.094
    5    HG   LEU  79           HG       LEU  79   4.537  -5.320  -0.354
    6   HD13  LEU  79          HD11      LEU  79   4.098  -3.292  -1.389
    7   HD12  LEU  79          HD12      LEU  79   2.467  -3.793  -0.942
    8   HD11  LEU  79          HD13      LEU  79   3.033  -4.015  -2.595
    9   HD23  LEU  79          HD21      LEU  79   1.943  -5.769  -0.248
   10   HD22  LEU  79          HD22      LEU  79   3.060  -7.128  -0.155
   11   HD21  LEU  79          HD23      LEU  79   2.242  -6.768  -1.673

  No H/Q in entry =          11
  In of MODEL   88
    1    H    HIS  80           H        HIS  80   7.411  -6.548  -1.696
    2    HA   HIS  80           HA       HIS  80   7.741  -5.025   0.680
    3    HB2  HIS  80           HB2      HIS  80   9.031  -7.404  -0.541
    4    HB3  HIS  80           HB3      HIS  80   9.965  -6.530   0.674
    5    HD1  HIS  80           HD1      HIS  80   9.479  -7.171   3.017
    6    HD2  HIS  80           HD2      HIS  80   6.231  -7.952   0.522
    7    HE1  HIS  80           HE1      HIS  80   7.698  -8.253   4.471
    8    HE2  HIS  80           HE2      HIS  80   5.712  -8.732   2.958

  No H/Q in entry =           8
  In of MODEL   88
    1    H    LEU  81           H        LEU  81   9.723  -5.318  -2.247
    2    HA   LEU  81           HA       LEU  81  11.802  -3.618  -1.372
    3    HB2  LEU  81           HB2      LEU  81  10.850  -4.379  -4.134
    4    HB3  LEU  81           HB3      LEU  81  12.289  -3.399  -3.847
    5    HG   LEU  81           HG       LEU  81  11.857  -6.120  -2.587
    6   HD12  LEU  81          HD11      LEU  81  13.650  -6.768  -4.352
    7   HD11  LEU  81          HD12      LEU  81  13.104  -5.329  -5.211
    8   HD13  LEU  81          HD13      LEU  81  11.972  -6.636  -4.874
    9   HD23  LEU  81          HD21      LEU  81  14.490  -5.851  -2.588
   10   HD22  LEU  81          HD22      LEU  81  13.530  -5.081  -1.327
   11   HD21  LEU  81          HD23      LEU  81  14.116  -4.132  -2.692

  No H/Q in entry =          11
  In of MODEL   88
    1    H    MET  82           H        MET  82   8.879  -2.919  -3.286
    2    HA   MET  82           HA       MET  82   9.464  -0.200  -3.775
    3    HB2  MET  82           HB2      MET  82   6.877  -1.749  -3.643
    4    HB3  MET  82           HB3      MET  82   6.906  -0.023  -3.997
    5    HG2  MET  82           HG2      MET  82   8.459  -2.116  -5.554
    6    HG3  MET  82           HG3      MET  82   6.900  -1.462  -6.053
    7    HE3  MET  82           HE1      MET  82   7.403   1.991  -7.208
    8    HE2  MET  82           HE2      MET  82   7.035   1.761  -5.500
    9    HE1  MET  82           HE3      MET  82   6.342   0.671  -6.697

  No H/Q in entry =           9
  In of MODEL   88
    1    H    THR  83           H        THR  83   7.660  -1.781  -1.168
    2    HA   THR  83           HA       THR  83   6.860   0.574   0.178
    3    HB   THR  83           HB       THR  83   6.710  -1.010   2.187
    4    HG1  THR  83           HG1      THR  83   7.430  -2.972   1.942
    5   HG22  THR  83          HG21      THR  83   5.020  -2.537   0.721
    6   HG21  THR  83          HG22      THR  83   5.263  -1.206  -0.405
    7   HG23  THR  83          HG23      THR  83   4.639  -0.888   1.214

  No H/Q in entry =           7
  In of MODEL   88
    1    H    SER  84           H        SER  84   9.649  -1.578   0.668
    2    HA   SER  84           HA       SER  84  10.748  -0.180   2.858
    3    HB2  SER  84           HB2      SER  84  11.954  -2.033   0.814
    4    HB3  SER  84           HB3      SER  84  12.923  -1.305   2.094
    5    HG   SER  84           HG       SER  84  10.619  -2.954   2.358

  No H/Q in entry =           5
  In of MODEL   88
    1    H    MET  85           H        MET  85  11.484   0.088  -0.633
    2    HA   MET  85           HA       MET  85  13.519   2.014  -0.384
    3    HB2  MET  85           HB2      MET  85  13.097   0.758  -2.455
    4    HB3  MET  85           HB3      MET  85  11.574   1.623  -2.667
    5    HG2  MET  85           HG2      MET  85  12.772   3.756  -2.814
    6    HG3  MET  85           HG3      MET  85  14.302   2.936  -2.521
    7    HE3  MET  85           HE1      MET  85  11.292   1.600  -5.159
    8    HE2  MET  85           HE2      MET  85  11.618   3.024  -6.144
    9    HE1  MET  85           HE3      MET  85  11.215   3.216  -4.443

  No H/Q in entry =           9
  In of MODEL   88
    1    H    LEU  86           H        LEU  86  10.034   2.417  -0.868
    2    HA   LEU  86           HA       LEU  86  10.021   5.231  -1.034
    3    HB2  LEU  86           HB2      LEU  86   8.142   3.610  -1.607
    4    HB3  LEU  86           HB3      LEU  86   7.822   3.516   0.124
    5    HG   LEU  86           HG       LEU  86   7.709   6.080   0.088
    6   HD11  LEU  86          HD11      LEU  86   8.459   5.645  -2.622
    7   HD13  LEU  86          HD12      LEU  86   8.057   7.176  -1.850
    8   HD12  LEU  86          HD13      LEU  86   6.798   6.241  -2.652
    9   HD23  LEU  86          HD21      LEU  86   5.540   4.777  -1.569
   10   HD22  LEU  86          HD22      LEU  86   5.381   6.033  -0.344
   11   HD21  LEU  86          HD23      LEU  86   5.752   4.379   0.137

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ALA  87           H        ALA  87   9.531   3.046   1.703
    2    HA   ALA  87           HA       ALA  87   9.032   4.958   3.687
    3    HB1  ALA  87           HB1      ALA  87   9.785   2.124   3.579
    4    HB3  ALA  87           HB2      ALA  87   8.682   2.951   4.677
    5    HB2  ALA  87           HB3      ALA  87  10.413   2.948   5.009

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ARG  88           H        ARG  88  12.081   3.482   2.678
    2    HA   ARG  88           HA       ARG  88  13.728   4.818   4.508
    3    HB2  ARG  88           HB2      ARG  88  14.350   2.840   3.088
    4    HB3  ARG  88           HB3      ARG  88  14.514   3.938   1.721
    5    HG2  ARG  88           HG2      ARG  88  16.025   5.212   3.665
    6    HG3  ARG  88           HG3      ARG  88  16.316   3.515   4.032
    7    HD2  ARG  88           HD2      ARG  88  17.565   3.205   2.175
    8    HD3  ARG  88           HD3      ARG  88  16.438   4.104   1.155
    9    HE   ARG  88           HE       ARG  88  18.859   5.116   2.192
   10   HH21  ARG  88          HH11      ARG  88  19.246   7.329   2.008
   11   HH22  ARG  88          HH12      ARG  88  17.914   8.427   1.880
   12   HH11  ARG  88          HH21      ARG  88  15.533   5.934   1.941
   13   HH12  ARG  88          HH22      ARG  88  15.811   7.635   1.817

  No H/Q in entry =          13
  In of MODEL   88
    1    H    GLU  89           H        GLU  89  12.751   5.754   1.196
    2    HA   GLU  89           HA       GLU  89  14.341   8.085   1.043
    3    HB2  GLU  89           HB2      GLU  89  13.165   7.077  -0.903
    4    HB3  GLU  89           HB3      GLU  89  11.635   7.644  -0.232
    5    HG2  GLU  89           HG2      GLU  89  12.380   9.968  -0.386
    6    HG3  GLU  89           HG3      GLU  89  13.971   9.451  -0.936

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LEU  90           H        LEU  90  11.010   7.632   2.192
    2    HA   LEU  90           HA       LEU  90  10.551  10.371   2.786
    3    HB2  LEU  90           HB2      LEU  90   9.315   7.815   3.807
    4    HB3  LEU  90           HB3      LEU  90   8.717   9.419   4.243
    5    HG   LEU  90           HG       LEU  90   9.100   8.548   1.366
    6   HD12  LEU  90          HD11      LEU  90   6.560   8.268   1.444
    7   HD11  LEU  90          HD12      LEU  90   6.727   8.244   3.200
    8   HD13  LEU  90          HD13      LEU  90   7.515   7.005   2.222
    9   HD22  LEU  90          HD21      LEU  90   8.849  10.862   1.308
   10   HD21  LEU  90          HD22      LEU  90   7.873  10.905   2.775
   11   HD23  LEU  90          HD23      LEU  90   7.155  10.372   1.255

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  91           H        ILE  91  11.776   7.655   4.684
    2    HA   ILE  91           HA       ILE  91  11.959   9.002   7.159
    3    HB   ILE  91           HB       ILE  91  13.460   6.642   6.012
    4   HG12  ILE  91          HG12      ILE  91  11.463   6.834   8.286
    5   HG13  ILE  91          HG13      ILE  91  10.976   6.572   6.612
    6   HG22  ILE  91          HG21      ILE  91  13.944   6.403   8.648
    7   HG21  ILE  91          HG22      ILE  91  13.901   8.164   8.557
    8   HG23  ILE  91          HG23      ILE  91  15.056   7.260   7.580
    9   HD13  ILE  91          HD11      ILE  91  11.938   4.452   6.523
   10   HD12  ILE  91          HD12      ILE  91  11.357   4.511   8.187
   11   HD11  ILE  91          HD13      ILE  91  13.062   4.794   7.839

  No H/Q in entry =          11
  In of MODEL   88
    1    H    THR  92           H        THR  92  14.153   8.808   4.392
    2    HA   THR  92           HA       THR  92  16.353  10.152   5.544
    3    HB   THR  92           HB       THR  92  15.345  10.063   2.690
    4    HG1  THR  92           HG1      THR  92  16.143   8.148   3.078
    5   HG22  THR  92          HG21      THR  92  17.925  10.707   2.382
    6   HG21  THR  92          HG22      THR  92  17.643  11.524   3.919
    7   HG23  THR  92          HG23      THR  92  16.671  11.938   2.507

  No H/Q in entry =           7
  In of MODEL   88
    1    H    GLU  93           H        GLU  93  13.476  11.371   3.842
    2    HA   GLU  93           HA       GLU  93  14.124  14.119   3.968
    3    HB2  GLU  93           HB2      GLU  93  11.394  12.798   3.993
    4    HB3  GLU  93           HB3      GLU  93  11.712  14.494   3.629
    5    HG2  GLU  93           HG2      GLU  93  12.996  12.236   2.079
    6    HG3  GLU  93           HG3      GLU  93  11.460  12.950   1.607

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LEU  94           H        LEU  94  12.356  11.983   6.179
    2    HA   LEU  94           HA       LEU  94  11.596  13.933   8.072
    3    HB2  LEU  94           HB2      LEU  94  12.118  10.966   8.325
    4    HB3  LEU  94           HB3      LEU  94  11.574  11.944   9.685
    5    HG   LEU  94           HG       LEU  94  10.073  12.040   7.067
    6   HD11  LEU  94          HD11      LEU  94  10.128   9.806   9.057
    7   HD13  LEU  94          HD12      LEU  94   9.813   9.760   7.324
    8   HD12  LEU  94          HD13      LEU  94   8.552  10.295   8.434
    9   HD23  LEU  94          HD21      LEU  94   8.173  12.466   8.683
   10   HD22  LEU  94          HD22      LEU  94   9.435  13.696   8.718
   11   HD21  LEU  94          HD23      LEU  94   9.358  12.473   9.986

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  95           H        ILE  95  14.531  11.949   7.803
    2    HA   ILE  95           HA       ILE  95  15.733  12.835  10.214
    3    HB   ILE  95           HB       ILE  95  16.934  11.758   7.651
    4   HG12  ILE  95          HG12      ILE  95  16.634  10.546  10.413
    5   HG13  ILE  95          HG13      ILE  95  15.454  10.318   9.125
    6   HG21  ILE  95          HG21      ILE  95  18.222  12.525  10.289
    7   HG23  ILE  95          HG22      ILE  95  18.683  13.054   8.669
    8   HG22  ILE  95          HG23      ILE  95  18.962  11.385   9.166
    9   HD13  ILE  95          HD11      ILE  95  16.901   9.019   7.844
   10   HD12  ILE  95          HD12      ILE  95  17.376   8.551   9.474
   11   HD11  ILE  95          HD13      ILE  95  18.345   9.718   8.575

  No H/Q in entry =          11
  In of MODEL   88
    1    H    GLU  96           H        GLU  96  15.887  14.085   6.886
    2    HA   GLU  96           HA       GLU  96  17.776  16.125   7.361
    3    HB2  GLU  96           HB2      GLU  96  17.084  15.489   5.103
    4    HB3  GLU  96           HB3      GLU  96  15.454  16.075   5.418
    5    HG2  GLU  96           HG2      GLU  96  16.056  18.197   4.885
    6    HG3  GLU  96           HG3      GLU  96  17.363  18.166   6.057

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LEU  97           H        LEU  97  14.265  16.002   7.815
    2    HA   LEU  97           HA       LEU  97  13.906  18.740   8.476
    3    HB2  LEU  97           HB2      LEU  97  12.344  16.239   9.086
    4    HB3  LEU  97           HB3      LEU  97  11.865  17.792   9.770
    5    HG   LEU  97           HG       LEU  97  12.319  17.384   6.799
    6   HD12  LEU  97          HD11      LEU  97   9.793  17.305   6.699
    7   HD11  LEU  97          HD12      LEU  97   9.795  17.095   8.448
    8   HD13  LEU  97          HD13      LEU  97  10.545  15.879   7.413
    9   HD23  LEU  97          HD21      LEU  97  10.619  19.381   6.856
   10   HD22  LEU  97          HD22      LEU  97  12.310  19.706   7.238
   11   HD21  LEU  97          HD23      LEU  97  11.127  19.551   8.536

  No H/Q in entry =          11
  In of MODEL   88
    1    H    HIS  98           H        HIS  98  14.688  15.886  10.449
    2    HA   HIS  98           HA       HIS  98  14.572  17.135  12.973
    3    HB2  HIS  98           HB2      HIS  98  16.271  14.851  11.946
    4    HB3  HIS  98           HB3      HIS  98  16.292  15.379  13.630
    5    HD1  HIS  98           HD1      HIS  98  14.043  13.807  11.044
    6    HD2  HIS  98           HD2      HIS  98  13.983  14.704  15.115
    7    HE1  HIS  98           HE1      HIS  98  12.003  12.646  12.004
    8    HE2  HIS  98           HE2      HIS  98  11.946  13.184  14.479

  No H/Q in entry =           8
  In of MODEL   88
    1    H    GLU  99           H        GLU  99  17.105  16.986  10.519
    2    HA   GLU  99           HA       GLU  99  19.127  18.270  12.041
    3    HB2  GLU  99           HB2      GLU  99  19.566  16.986   9.961
    4    HB3  GLU  99           HB3      GLU  99  18.774  18.262   9.034
    5    HG2  GLU  99           HG2      GLU  99  20.419  19.896   9.822
    6    HG3  GLU  99           HG3      GLU  99  21.183  18.673  10.833

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LYS 100           H        LYS 100  16.610  19.494   9.851
    2    HA   LYS 100           HA       LYS 100  17.461  22.214  10.005
    3    HB2  LYS 100           HB2      LYS 100  14.798  20.981   9.262
    4    HB3  LYS 100           HB3      LYS 100  15.131  22.714   9.179
    5    HG2  LYS 100           HG2      LYS 100  17.083  22.236   7.696
    6    HG3  LYS 100           HG3      LYS 100  16.637  20.527   7.706
    7    HD2  LYS 100           HD2      LYS 100  14.445  21.085   6.725
    8    HD3  LYS 100           HD3      LYS 100  14.874  22.796   6.722
    9    HE2  LYS 100           HE2      LYS 100  16.813  22.287   5.245
   10    HE3  LYS 100           HE3      LYS 100  16.314  20.592   5.205
   11    HZ1  LYS 100           HZ1      LYS 100  14.527  22.825   4.397
   12    HZ3  LYS 100           HZ2      LYS 100  14.308  21.161   4.126
   13    HZ2  LYS 100           HZ3      LYS 100  15.529  22.004   3.301

  No H/Q in entry =          13
  In of MODEL   88
    1    H    LEU 101           H        LEU 101  15.338  20.198  11.973
    2    HA   LEU 101           HA       LEU 101  14.224  22.278  13.572
    3    HB2  LEU 101           HB2      LEU 101  14.611  19.318  13.935
    4    HB3  LEU 101           HB3      LEU 101  14.105  20.301  15.306
    5    HG   LEU 101           HG       LEU 101  12.669  20.433  12.648
    6   HD12  LEU 101          HD11      LEU 101  10.989  18.894  13.920
    7   HD11  LEU 101          HD12      LEU 101  12.382  18.448  14.902
    8   HD13  LEU 101          HD13      LEU 101  12.397  18.151  13.163
    9   HD21  LEU 101          HD21      LEU 101  12.049  21.221  15.510
   10   HD23  LEU 101          HD22      LEU 101  10.775  21.028  14.307
   11   HD22  LEU 101          HD23      LEU 101  12.032  22.240  14.068

  No H/Q in entry =          11
  In of MODEL   88
    1    H    LYS 102           H        LYS 102  17.356  21.611  13.109
    2    HA   LYS 102           HA       LYS 102  19.227  22.439  14.173
    3    HB2  LYS 102           HB2      LYS 102  17.452  23.983  15.329
    4    HB3  LYS 102           HB3      LYS 102  17.648  22.908  16.698
    5    HG2  LYS 102           HG2      LYS 102  19.572  24.888  15.527
    6    HG3  LYS 102           HG3      LYS 102  19.196  24.571  17.206
    7    HD2  LYS 102           HD2      LYS 102  20.812  22.636  15.497
    8    HD3  LYS 102           HD3      LYS 102  21.534  23.939  16.432
    9    HE2  LYS 102           HE2      LYS 102  21.093  21.393  17.389
   10    HE3  LYS 102           HE3      LYS 102  21.347  22.824  18.387
   11    HZ2  LYS 102           HZ1      LYS 102  19.358  21.575  19.012
   12    HZ1  LYS 102           HZ2      LYS 102  18.707  21.827  17.469
   13    HZ3  LYS 102           HZ3      LYS 102  18.971  23.146  18.501

  No H/Q in entry =          13
  In of MODEL   88
    1    H    ALA 103           H        ALA 103  17.142  20.860  16.600
    2    HA   ALA 103           HA       ALA 103  18.857  19.605  18.235
    3    HB2  ALA 103           HB1      ALA 103  17.233  17.629  18.229
    4    HB1  ALA 103           HB2      ALA 103  16.345  18.508  16.983
    5    HB3  ALA 103           HB3      ALA 103  16.549  19.216  18.585

  No H/Q in entry =           5
  In of MODEL   88
    1    H1   ALA   1           H3       ALA   1  -1.893  -6.601 -21.398
    2    H2   ALA   1           H2       ALA   1  -2.713  -8.023 -20.948
    3    H3   ALA   1           H1       ALA   1  -1.111  -8.102 -21.515
    4    HA   ALA   1           HA       ALA   1  -1.968  -8.542 -23.508
    5    HB1  ALA   1           HB1      ALA   1  -4.116  -9.219 -23.023
    6    HB2  ALA   1           HB2      ALA   1  -4.530  -7.695 -23.808
    7    HB3  ALA   1           HB3      ALA   1  -4.458  -7.788 -22.050

  No H/Q in entry =           7
  In of MODEL   88
    1    H    GLU   2           H        GLU   2  -2.788  -7.322 -25.483
    2    HA   GLU   2           HA       GLU   2  -1.355  -5.332 -26.359
    3    HB2  GLU   2           HB2      GLU   2  -4.365  -5.335 -26.655
    4    HB3  GLU   2           HB3      GLU   2  -3.234  -4.489 -27.707
    5    HG2  GLU   2           HG2      GLU   2  -2.778  -6.381 -28.878
    6    HG3  GLU   2           HG3      GLU   2  -2.489  -7.302 -27.408

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLU   3           H        GLU   3  -4.482  -4.016 -25.428
    2    HA   GLU   3           HA       GLU   3  -3.380  -1.486 -24.791
    3    HB2  GLU   3           HB2      GLU   3  -6.091  -2.748 -24.448
    4    HB3  GLU   3           HB3      GLU   3  -5.756  -1.143 -23.794
    5    HG2  GLU   3           HG2      GLU   3  -5.396  -0.210 -25.917
    6    HG3  GLU   3           HG3      GLU   3  -5.038  -1.768 -26.654

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LEU   4           H        LEU   4  -5.002  -3.826 -22.615
    2    HA   LEU   4           HA       LEU   4  -4.596  -2.621 -20.219
    3    HB2  LEU   4           HB2      LEU   4  -4.116  -5.569 -20.711
    4    HB3  LEU   4           HB3      LEU   4  -4.496  -4.825 -19.159
    5    HG   LEU   4           HG       LEU   4  -6.287  -4.847 -21.611
    6   HD13  LEU   4          HD11      LEU   4  -7.508  -6.546 -20.615
    7   HD12  LEU   4          HD12      LEU   4  -7.003  -6.107 -18.985
    8   HD11  LEU   4          HD13      LEU   4  -5.891  -6.966 -20.050
    9   HD23  LEU   4          HD21      LEU   4  -7.942  -4.013 -19.726
   10   HD22  LEU   4          HD22      LEU   4  -6.885  -2.858 -20.537
   11   HD21  LEU   4          HD23      LEU   4  -6.460  -3.467 -18.938

  No H/Q in entry =          11
  In of MODEL   88
    1    H    GLU   5           H        GLU   5  -2.148  -4.503 -21.979
    2    HA   GLU   5           HA       GLU   5  -0.145  -4.273 -19.955
    3    HB2  GLU   5           HB2      GLU   5  -0.243  -5.173 -22.800
    4    HB3  GLU   5           HB3      GLU   5   1.333  -4.752 -22.129
    5    HG2  GLU   5           HG2      GLU   5  -0.440  -6.479 -20.467
    6    HG3  GLU   5           HG3      GLU   5   0.300  -7.216 -21.887

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLU   6           H        GLU   6  -0.767  -2.527 -22.984
    2    HA   GLU   6           HA       GLU   6   1.442  -0.742 -22.721
    3    HB2  GLU   6           HB2      GLU   6   0.320  -1.169 -24.881
    4    HB3  GLU   6           HB3      GLU   6  -1.142  -0.399 -24.264
    5    HG2  GLU   6           HG2      GLU   6   0.082   1.706 -23.942
    6    HG3  GLU   6           HG3      GLU   6   1.563   0.945 -24.519

  No H/Q in entry =           6
  In of MODEL   88
    1    H    VAL   7           H        VAL   7  -1.889  -0.752 -21.652
    2    HA   VAL   7           HA       VAL   7  -2.049   1.959 -20.797
    3    HB   VAL   7           HB       VAL   7  -3.557  -0.534 -19.966
    4   HG11  VAL   7          HG11      VAL   7  -3.867   2.357 -19.131
    5   HG13  VAL   7          HG12      VAL   7  -3.789   0.924 -18.106
    6   HG12  VAL   7          HG13      VAL   7  -5.223   1.229 -19.086
    7   HG21  VAL   7          HG21      VAL   7  -3.708   0.561 -22.347
    8   HG23  VAL   7          HG22      VAL   7  -4.622   1.824 -21.520
    9   HG22  VAL   7          HG23      VAL   7  -5.202   0.158 -21.500

  No H/Q in entry =           9
  In of MODEL   88
    1    H    VAL   8           H        VAL   8  -1.111  -1.056 -19.180
    2    HA   VAL   8           HA       VAL   8  -0.753   0.000 -16.580
    3    HB   VAL   8           HB       VAL   8   0.588  -2.337 -17.964
    4   HG13  VAL   8          HG11      VAL   8   2.041  -1.733 -16.178
    5   HG12  VAL   8          HG12      VAL   8   1.033  -3.024 -15.526
    6   HG11  VAL   8          HG13      VAL   8   0.693  -1.347 -15.108
    7   HG21  VAL   8          HG21      VAL   8  -2.055  -2.062 -17.214
    8   HG23  VAL   8          HG22      VAL   8  -1.351  -2.744 -15.753
    9   HG22  VAL   8          HG23      VAL   8  -1.213  -3.608 -17.279

  No H/Q in entry =           9
  In of MODEL   88
    1    H    MET   9           H        MET   9   1.470  -0.329 -19.346
    2    HA   MET   9           HA       MET   9   3.786   0.658 -18.094
    3    HB2  MET   9           HB2      MET   9   2.819   0.727 -20.952
    4    HB3  MET   9           HB3      MET   9   4.355   1.452 -20.479
    5    HG2  MET   9           HG2      MET   9   5.072  -0.717 -19.520
    6    HG3  MET   9           HG3      MET   9   3.546  -1.438 -20.035
    7    HE1  MET   9           HE1      MET   9   6.440   0.688 -20.993
    8    HE3  MET   9           HE2      MET   9   6.990   0.140 -22.573
    9    HE2  MET   9           HE3      MET   9   7.255  -0.871 -21.156

  No H/Q in entry =           9
  In of MODEL   88
    1    H    GLY  10           H        GLY  10   1.124   2.327 -19.742
    2    HA3  GLY  10           HA2      GLY  10   2.145   4.958 -19.488
    3    HA2  GLY  10           HA3      GLY  10   0.445   4.535 -19.683

  No H/Q in entry =           3
  In of MODEL   88
    1    H    LEU  11           H        LEU  11   0.030   3.002 -17.404
    2    HA   LEU  11           HA       LEU  11  -0.443   4.976 -15.427
    3    HB2  LEU  11           HB2      LEU  11  -0.439   1.959 -15.291
    4    HB3  LEU  11           HB3      LEU  11  -0.916   2.984 -13.938
    5    HG   LEU  11           HG       LEU  11  -2.173   3.142 -16.691
    6   HD13  LEU  11          HD11      LEU  11  -2.797   1.007 -15.946
    7   HD12  LEU  11          HD12      LEU  11  -4.122   2.024 -15.383
    8   HD11  LEU  11          HD13      LEU  11  -2.868   1.510 -14.256
    9   HD22  LEU  11          HD21      LEU  11  -2.713   5.164 -15.667
   10   HD21  LEU  11          HD22      LEU  11  -2.640   4.485 -14.041
   11   HD23  LEU  11          HD23      LEU  11  -4.030   4.156 -15.075

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  12           H        ILE  12   2.044   2.458 -15.705
    2    HA   ILE  12           HA       ILE  12   3.280   2.952 -13.208
    3    HB   ILE  12           HB       ILE  12   4.489   1.901 -15.787
    4   HG12  ILE  12          HG12      ILE  12   2.464   0.702 -14.644
    5   HG13  ILE  12          HG13      ILE  12   3.847  -0.261 -15.123
    6   HG21  ILE  12          HG21      ILE  12   5.490   1.822 -12.923
    7   HG23  ILE  12          HG22      ILE  12   6.274   2.588 -14.303
    8   HG22  ILE  12          HG23      ILE  12   6.154   0.831 -14.219
    9   HD13  ILE  12          HD11      ILE  12   4.662  -0.275 -12.839
   10   HD12  ILE  12          HD12      ILE  12   2.973  -0.778 -12.834
   11   HD11  ILE  12          HD13      ILE  12   3.406   0.847 -12.347

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  13           H        ILE  13   3.883   4.224 -16.461
    2    HA   ILE  13           HA       ILE  13   6.063   5.892 -15.742
    3    HB   ILE  13           HB       ILE  13   4.017   6.033 -17.970
    4   HG12  ILE  13          HG12      ILE  13   5.780   4.138 -17.746
    5   HG13  ILE  13          HG13      ILE  13   5.603   4.940 -19.303
    6   HG23  ILE  13          HG21      ILE  13   4.716   8.266 -17.874
    7   HG22  ILE  13          HG22      ILE  13   5.847   7.575 -19.031
    8   HG21  ILE  13          HG23      ILE  13   6.352   7.845 -17.364
    9   HD13  ILE  13          HD11      ILE  13   7.684   5.932 -19.169
   10   HD12  ILE  13          HD12      ILE  13   7.995   4.583 -18.084
   11   HD11  ILE  13          HD13      ILE  13   7.560   6.156 -17.425

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ASN  14           H        ASN  14   2.566   6.465 -15.979
    2    HA   ASN  14           HA       ASN  14   2.588   9.207 -15.324
    3    HB2  ASN  14           HB2      ASN  14   0.653   7.612 -16.150
    4    HB3  ASN  14           HB3      ASN  14   0.342   7.429 -14.428
    5   HD21  ASN  14          HD21      ASN  14  -1.663   8.638 -15.837
    6   HD22  ASN  14          HD22      ASN  14  -1.687  10.311 -15.558

  No H/Q in entry =           6
  In of MODEL   88
    1    H    SER  15           H        SER  15   2.247   6.324 -13.263
    2    HA   SER  15           HA       SER  15   1.989   7.684 -10.804
    3    HB2  SER  15           HB2      SER  15   2.493   5.581  -9.773
    4    HB3  SER  15           HB3      SER  15   1.656   5.186 -11.270
    5    HG   SER  15           HG       SER  15   4.350   4.912 -10.586

  No H/Q in entry =           5
  In of MODEL   88
    1    H    GLY  16           H        GLY  16   4.827   6.537 -12.593
    2    HA3  GLY  16           HA2      GLY  16   6.783   7.240 -10.673
    3    HA2  GLY  16           HA3      GLY  16   7.068   7.042 -12.400

  No H/Q in entry =           3
  In of MODEL   88
    1    H    GLN  17           H        GLN  17   5.412   9.042 -13.437
    2    HA   GLN  17           HA       GLN  17   7.041  11.348 -13.127
    3    HB2  GLN  17           HB2      GLN  17   4.274  10.984 -14.307
    4    HB3  GLN  17           HB3      GLN  17   5.164  12.506 -14.376
    5    HG2  GLN  17           HG2      GLN  17   6.985  11.435 -15.592
    6    HG3  GLN  17           HG3      GLN  17   6.195   9.866 -15.447
    7   HE21  GLN  17          HE21      GLN  17   6.601  12.438 -17.570
    8   HE22  GLN  17          HE22      GLN  17   5.223  12.198 -18.532

  No H/Q in entry =           8
  In of MODEL   88
    1    H    ALA  18           H        ALA  18   3.931  10.386 -11.759
    2    HA   ALA  18           HA       ALA  18   3.265  12.781 -10.472
    3    HB1  ALA  18           HB1      ALA  18   2.084  10.350 -10.701
    4    HB2  ALA  18           HB2      ALA  18   1.569  11.573  -9.542
    5    HB3  ALA  18           HB3      ALA  18   2.637  10.265  -9.029

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ARG  19           H        ARG  19   5.092   9.972  -9.226
    2    HA   ARG  19           HA       ARG  19   5.667  11.102  -6.701
    3    HB2  ARG  19           HB2      ARG  19   6.028   8.695  -7.246
    4    HB3  ARG  19           HB3      ARG  19   7.386   9.160  -8.275
    5    HG2  ARG  19           HG2      ARG  19   8.541  10.164  -6.355
    6    HG3  ARG  19           HG3      ARG  19   7.166   9.797  -5.315
    7    HD2  ARG  19           HD2      ARG  19   8.897   8.124  -4.982
    8    HD3  ARG  19           HD3      ARG  19   7.501   7.375  -5.762
    9    HE   ARG  19           HE       ARG  19   9.206   8.173  -7.817
   10   HH21  ARG  19          HH11      ARG  19  10.731   6.742  -8.689
   11   HH22  ARG  19          HH12      ARG  19  11.257   5.377  -7.766
   12   HH11  ARG  19          HH21      ARG  19   9.259   6.123  -5.052
   13   HH12  ARG  19          HH22      ARG  19  10.420   5.027  -5.706

  No H/Q in entry =          13
  In of MODEL   88
    1    H    SER  20           H        SER  20   7.461  11.115  -9.764
    2    HA   SER  20           HA       SER  20   9.740  12.480  -8.949
    3    HB2  SER  20           HB2      SER  20   9.741  11.620 -11.158
    4    HB3  SER  20           HB3      SER  20   8.251  12.464 -11.569
    5    HG   SER  20           HG       SER  20   9.390  14.418 -11.403

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LEU  21           H        LEU  21   6.658  13.818 -10.113
    2    HA   LEU  21           HA       LEU  21   7.384  16.548  -9.877
    3    HB2  LEU  21           HB2      LEU  21   4.689  15.178  -9.784
    4    HB3  LEU  21           HB3      LEU  21   4.890  16.928  -9.780
    5    HG   LEU  21           HG       LEU  21   6.034  15.120 -11.930
    6   HD12  LEU  21          HD11      LEU  21   4.096  16.182 -13.282
    7   HD11  LEU  21          HD12      LEU  21   3.380  16.538 -11.710
    8   HD13  LEU  21          HD13      LEU  21   3.699  14.868 -12.175
    9   HD23  LEU  21          HD21      LEU  21   5.859  17.445 -13.159
   10   HD22  LEU  21          HD22      LEU  21   7.213  17.172 -12.066
   11   HD21  LEU  21          HD23      LEU  21   5.832  18.114 -11.531

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ALA  22           H        ALA  22   5.845  14.274  -7.631
    2    HA   ALA  22           HA       ALA  22   5.293  16.080  -5.548
    3    HB3  ALA  22           HB1      ALA  22   4.485  13.703  -5.720
    4    HB2  ALA  22           HB2      ALA  22   5.095  14.154  -4.127
    5    HB1  ALA  22           HB3      ALA  22   6.091  13.183  -5.213

  No H/Q in entry =           5
  In of MODEL   88
    1    H    TYR  23           H        TYR  23   8.184  14.002  -6.023
    2    HA   TYR  23           HA       TYR  23   9.604  14.980  -3.775
    3    HB2  TYR  23           HB2      TYR  23  10.344  12.965  -4.951
    4    HB3  TYR  23           HB3      TYR  23  10.663  13.907  -6.407
    5    HD1  TYR  23           HD1      TYR  23  11.643  13.552  -2.820
    6    HD2  TYR  23           HD2      TYR  23  12.723  15.021  -6.711
    7    HE1  TYR  23           HE1      TYR  23  13.918  14.083  -1.988
    8    HE2  TYR  23           HE2      TYR  23  14.998  15.553  -5.878
    9    HH   TYR  23           HH       TYR  23  16.015  14.651  -2.608

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ALA  24           H        ALA  24   9.415  16.112  -7.132
    2    HA   ALA  24           HA       ALA  24  11.351  18.160  -6.888
    3    HB2  ALA  24           HB1      ALA  24  10.892  18.245  -9.093
    4    HB3  ALA  24           HB2      ALA  24   9.354  19.020  -8.716
    5    HB1  ALA  24           HB3      ALA  24   9.446  17.266  -8.858

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ALA  25           H        ALA  25   7.874  18.035  -6.240
    2    HA   ALA  25           HA       ALA  25   7.447  20.757  -5.650
    3    HB1  ALA  25           HB1      ALA  25   5.749  18.790  -5.851
    4    HB2  ALA  25           HB2      ALA  25   5.413  20.078  -4.691
    5    HB3  ALA  25           HB3      ALA  25   6.080  18.541  -4.136

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LEU  26           H        LEU  26   8.484  18.046  -3.626
    2    HA   LEU  26           HA       LEU  26   8.633  19.460  -1.181
    3    HB2  LEU  26           HB2      LEU  26   8.686  17.042  -1.191
    4    HB3  LEU  26           HB3      LEU  26  10.149  17.030  -2.173
    5    HG   LEU  26           HG       LEU  26  11.397  18.115  -0.336
    6   HD12  LEU  26          HD11      LEU  26  10.189  18.130   1.933
    7   HD11  LEU  26          HD12      LEU  26   8.692  18.024   1.010
    8   HD13  LEU  26          HD13      LEU  26   9.759  19.413   0.801
    9   HD21  LEU  26          HD21      LEU  26   9.828  15.669   0.534
   10   HD23  LEU  26          HD22      LEU  26  11.358  16.200   1.222
   11   HD22  LEU  26          HD23      LEU  26  11.290  15.653  -0.451

  No H/Q in entry =          11
  In of MODEL   88
    1    H    LYS  27           H        LYS  27  11.020  18.861  -3.728
    2    HA   LYS  27           HA       LYS  27  13.234  20.057  -2.510
    3    HB2  LYS  27           HB2      LYS  27  13.296  18.722  -4.609
    4    HB3  LYS  27           HB3      LYS  27  12.547  20.072  -5.460
    5    HG2  LYS  27           HG2      LYS  27  14.442  21.522  -4.888
    6    HG3  LYS  27           HG3      LYS  27  15.188  20.211  -3.966
    7    HD2  LYS  27           HD2      LYS  27  15.291  18.834  -6.029
    8    HD3  LYS  27           HD3      LYS  27  14.591  20.170  -6.944
    9    HE2  LYS  27           HE2      LYS  27  16.508  21.600  -6.337
   10    HE3  LYS  27           HE3      LYS  27  17.212  20.269  -5.414
   11    HZ3  LYS  27           HZ1      LYS  27  18.186  20.365  -7.607
   12    HZ2  LYS  27           HZ2      LYS  27  16.652  20.277  -8.336
   13    HZ1  LYS  27           HZ3      LYS  27  17.260  18.951  -7.465

  No H/Q in entry =          13
  In of MODEL   88
    1    H    GLN  28           H        GLN  28  10.620  21.495  -4.429
    2    HA   GLN  28           HA       GLN  28  11.622  24.132  -4.574
    3    HB2  GLN  28           HB2      GLN  28   8.773  23.108  -4.446
    4    HB3  GLN  28           HB3      GLN  28   9.210  24.776  -4.814
    5    HG2  GLN  28           HG2      GLN  28  10.147  22.354  -6.381
    6    HG3  GLN  28           HG3      GLN  28   8.834  23.424  -6.871
    7   HE21  GLN  28          HE21      GLN  28  11.937  22.859  -7.655
    8   HE22  GLN  28          HE22      GLN  28  12.466  24.435  -8.003

  No H/Q in entry =           8
  In of MODEL   88
    1    H    ALA  29           H        ALA  29   9.682  22.457  -2.132
    2    HA   ALA  29           HA       ALA  29   9.182  24.647  -0.433
    3    HB2  ALA  29           HB1      ALA  29   8.440  23.080   1.131
    4    HB1  ALA  29           HB2      ALA  29   9.638  21.879   0.649
    5    HB3  ALA  29           HB3      ALA  29   8.249  22.202  -0.386

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LYS  30           H        LYS  30  11.874  22.336  -0.538
    2    HA   LYS  30           HA       LYS  30  13.226  23.254   1.760
    3    HB2  LYS  30           HB2      LYS  30  14.281  21.966  -0.767
    4    HB3  LYS  30           HB3      LYS  30  15.281  22.300   0.649
    5    HG2  LYS  30           HG2      LYS  30  13.716  20.934   2.032
    6    HG3  LYS  30           HG3      LYS  30  12.813  20.536   0.567
    7    HD2  LYS  30           HD2      LYS  30  14.833  19.522  -0.416
    8    HD3  LYS  30           HD3      LYS  30  15.756  19.934   1.031
    9    HE2  LYS  30           HE2      LYS  30  14.239  18.519   2.388
   10    HE3  LYS  30           HE3      LYS  30  13.346  18.087   0.925
   11    HZ2  LYS  30           HZ1      LYS  30  15.118  16.475   1.662
   12    HZ1  LYS  30           HZ2      LYS  30  16.270  17.646   1.208
   13    HZ3  LYS  30           HZ3      LYS  30  15.214  16.987   0.048

  No H/Q in entry =          13
  In of MODEL   88
    1    H    GLN  31           H        GLN  31  13.110  24.481  -1.529
    2    HA   GLN  31           HA       GLN  31  15.297  26.336  -1.113
    3    HB2  GLN  31           HB2      GLN  31  13.237  26.430  -3.320
    4    HB3  GLN  31           HB3      GLN  31  14.868  27.099  -3.330
    5    HG2  GLN  31           HG2      GLN  31  15.291  24.393  -2.775
    6    HG3  GLN  31           HG3      GLN  31  13.977  24.367  -3.943
    7   HE21  GLN  31          HE21      GLN  31  16.804  23.530  -4.375
    8   HE22  GLN  31          HE22      GLN  31  17.382  24.502  -5.640

  No H/Q in entry =           8
  In of MODEL   88
    1    H    GLY  32           H        GLY  32  12.229  26.196   0.056
    2    HA3  GLY  32           HA2      GLY  32  11.109  27.775   1.348
    3    HA2  GLY  32           HA3      GLY  32  12.249  28.995   0.797

  No H/Q in entry =           3
  In of MODEL   88
    1    H    ASP  33           H        ASP  33  10.834  27.129  -1.696
    2    HA   ASP  33           HA       ASP  33   9.200  29.434  -2.524
    3    HB2  ASP  33           HB2      ASP  33  10.243  27.006  -3.990
    4    HB3  ASP  33           HB3      ASP  33   9.104  28.145  -4.704

  No H/Q in entry =           4
  In of MODEL   88
    1    H    PHE  34           H        PHE  34   7.517  28.976  -0.950
    2    HA   PHE  34           HA       PHE  34   6.098  26.525  -0.858
    3    HB2  PHE  34           HB2      PHE  34   5.188  29.323  -0.153
    4    HB3  PHE  34           HB3      PHE  34   4.319  27.844   0.256
    5    HD1  PHE  34           HD1      PHE  34   6.617  30.199   1.467
    6    HD2  PHE  34           HD2      PHE  34   5.868  25.970   1.393
    7    HE1  PHE  34           HE1      PHE  34   8.020  29.913   3.490
    8    HE2  PHE  34           HE2      PHE  34   7.273  25.688   3.414
    9    HZ   PHE  34           HZ       PHE  34   8.343  27.661   4.463

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ALA  35           H        ALA  35   5.698  29.408  -2.848
    2    HA   ALA  35           HA       ALA  35   3.129  28.842  -3.856
    3    HB1  ALA  35           HB1      ALA  35   4.187  30.229  -5.893
    4    HB3  ALA  35           HB2      ALA  35   5.420  30.564  -4.677
    5    HB2  ALA  35           HB3      ALA  35   3.739  30.998  -4.370

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ALA  36           H        ALA  36   6.335  28.125  -5.240
    2    HA   ALA  36           HA       ALA  36   5.306  26.726  -7.484
    3    HB3  ALA  36           HB1      ALA  36   7.461  26.820  -8.117
    4    HB2  ALA  36           HB2      ALA  36   7.937  25.775  -6.777
    5    HB1  ALA  36           HB3      ALA  36   7.861  27.523  -6.550

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ALA  37           H        ALA  37   6.272  25.696  -4.244
    2    HA   ALA  37           HA       ALA  37   6.165  22.912  -4.689
    3    HB2  ALA  37           HB1      ALA  37   5.952  24.692  -2.298
    4    HB1  ALA  37           HB2      ALA  37   7.061  23.358  -2.608
    5    HB3  ALA  37           HB3      ALA  37   5.398  23.028  -2.125

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LYS  38           H        LYS  38   3.677  25.153  -3.487
    2    HA   LYS  38           HA       LYS  38   1.551  23.372  -3.258
    3    HB2  LYS  38           HB2      LYS  38   1.949  26.120  -2.993
    4    HB3  LYS  38           HB3      LYS  38   0.737  26.000  -4.263
    5    HG2  LYS  38           HG2      LYS  38  -0.722  24.691  -2.817
    6    HG3  LYS  38           HG3      LYS  38   0.531  24.604  -1.571
    7    HD2  LYS  38           HD2      LYS  38   0.386  26.940  -1.108
    8    HD3  LYS  38           HD3      LYS  38  -0.533  27.253  -2.581
    9    HE2  LYS  38           HE2      LYS  38  -2.020  27.298  -0.629
   10    HE3  LYS  38           HE3      LYS  38  -2.424  25.935  -1.677
   11    HZ3  LYS  38           HZ1      LYS  38  -1.710  24.443  -0.159
   12    HZ2  LYS  38           HZ2      LYS  38  -2.032  25.699   0.941
   13    HZ1  LYS  38           HZ3      LYS  38  -0.446  25.426   0.401

  No H/Q in entry =          13
  In of MODEL   88
    1    H    ALA  39           H        ALA  39   2.538  25.276  -6.103
    2    HA   ALA  39           HA       ALA  39   0.435  24.453  -7.795
    3    HB2  ALA  39           HB1      ALA  39   3.173  25.064  -8.867
    4    HB1  ALA  39           HB2      ALA  39   2.233  26.336  -8.086
    5    HB3  ALA  39           HB3      ALA  39   1.595  25.517  -9.512

  No H/Q in entry =           5
  In of MODEL   88
    1    H    MET  40           H        MET  40   3.656  23.099  -7.250
    2    HA   MET  40           HA       MET  40   3.511  21.093  -9.252
    3    HB2  MET  40           HB2      MET  40   5.146  21.276  -6.716
    4    HB3  MET  40           HB3      MET  40   5.367  20.023  -7.940
    5    HG2  MET  40           HG2      MET  40   5.466  22.982  -8.588
    6    HG3  MET  40           HG3      MET  40   6.901  22.054  -8.156
    7    HE3  MET  40           HE1      MET  40   7.716  19.843 -10.985
    8    HE2  MET  40           HE2      MET  40   7.160  19.522  -9.345
    9    HE1  MET  40           HE3      MET  40   8.274  20.854  -9.645

  No H/Q in entry =           9
  In of MODEL   88
    1    H    MET  41           H        MET  41   2.624  21.129  -5.821
    2    HA   MET  41           HA       MET  41   2.050  18.371  -5.556
    3    HB2  MET  41           HB2      MET  41   0.766  20.740  -4.179
    4    HB3  MET  41           HB3      MET  41   0.588  19.062  -3.681
    5    HG2  MET  41           HG2      MET  41   3.301  19.243  -3.739
    6    HG3  MET  41           HG3      MET  41   2.890  20.905  -3.329
    7    HE2  MET  41           HE1      MET  41  -0.155  19.689  -1.587
    8    HE1  MET  41           HE2      MET  41   0.682  21.192  -1.961
    9    HE3  MET  41           HE3      MET  41   0.627  20.612  -0.296

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ASP  42           H        ASP  42   0.047  21.133  -6.496
    2    HA   ASP  42           HA       ASP  42  -2.416  19.811  -6.622
    3    HB2  ASP  42           HB2      ASP  42  -1.671  22.372  -6.868
    4    HB3  ASP  42           HB3      ASP  42  -1.842  21.990  -8.578

  No H/Q in entry =           4
  In of MODEL   88
    1    H    GLN  43           H        GLN  43   0.014  20.380  -9.140
    2    HA   GLN  43           HA       GLN  43  -1.410  19.095 -11.226
    3    HB2  GLN  43           HB2      GLN  43   1.559  19.563 -10.865
    4    HB3  GLN  43           HB3      GLN  43   0.823  18.944 -12.345
    5    HG2  GLN  43           HG2      GLN  43  -0.657  20.994 -12.362
    6    HG3  GLN  43           HG3      GLN  43   0.316  21.627 -11.038
    7   HE21  GLN  43          HE21      GLN  43   0.486  23.258 -13.115
    8   HE22  GLN  43          HE22      GLN  43   1.890  23.021 -14.035

  No H/Q in entry =           8
  In of MODEL   88
    1    H    SER  44           H        SER  44   0.942  17.904  -8.861
    2    HA   SER  44           HA       SER  44   1.228  15.299  -9.905
    3    HB2  SER  44           HB2      SER  44   2.163  16.710  -7.667
    4    HB3  SER  44           HB3      SER  44   1.285  15.336  -6.998
    5    HG   SER  44           HG       SER  44   3.383  14.687  -7.445

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ARG  45           H        ARG  45  -1.052  16.638  -7.540
    2    HA   ARG  45           HA       ARG  45  -2.469  14.294  -6.909
    3    HB2  ARG  45           HB2      ARG  45  -2.625  16.458  -5.702
    4    HB3  ARG  45           HB3      ARG  45  -3.482  17.146  -7.078
    5    HG2  ARG  45           HG2      ARG  45  -5.272  15.445  -6.791
    6    HG3  ARG  45           HG3      ARG  45  -4.425  14.812  -5.378
    7    HD2  ARG  45           HD2      ARG  45  -4.589  17.075  -4.307
    8    HD3  ARG  45           HD3      ARG  45  -5.579  17.618  -5.678
    9    HE   ARG  45           HE       ARG  45  -6.717  15.252  -4.644
   10   HH21  ARG  45          HH11      ARG  45  -8.541  15.347  -3.358
   11   HH22  ARG  45          HH12      ARG  45  -8.907  16.787  -2.477
   12   HH11  ARG  45          HH21      ARG  45  -6.114  18.484  -3.604
   13   HH12  ARG  45          HH22      ARG  45  -7.528  18.564  -2.615

  No H/Q in entry =          13
  In of MODEL   88
    1    H    MET  46           H        MET  46  -3.038  16.723  -9.439
    2    HA   MET  46           HA       MET  46  -5.403  15.592 -10.490
    3    HB2  MET  46           HB2      MET  46  -3.281  17.384 -11.685
    4    HB3  MET  46           HB3      MET  46  -4.698  16.869 -12.606
    5    HG2  MET  46           HG2      MET  46  -6.175  17.812 -10.878
    6    HG3  MET  46           HG3      MET  46  -4.774  18.309  -9.935
    7    HE1  MET  46           HE1      MET  46  -5.425  20.570  -9.690
    8    HE3  MET  46           HE2      MET  46  -6.895  20.610 -10.658
    9    HE2  MET  46           HE3      MET  46  -5.631  21.807 -10.937

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ALA  47           H        ALA  47  -1.987  15.067 -11.278
    2    HA   ALA  47           HA       ALA  47  -2.375  13.359 -13.496
    3    HB3  ALA  47           HB1      ALA  47  -0.182  14.214 -13.156
    4    HB2  ALA  47           HB2      ALA  47  -0.064  12.482 -12.834
    5    HB1  ALA  47           HB3      ALA  47  -0.129  13.627 -11.493

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LEU  48           H        LEU  48  -2.088  12.698 -10.028
    2    HA   LEU  48           HA       LEU  48  -2.224   9.861 -10.203
    3    HB2  LEU  48           HB2      LEU  48  -2.943  11.775  -7.972
    4    HB3  LEU  48           HB3      LEU  48  -2.873  10.023  -7.783
    5    HG   LEU  48           HG       LEU  48  -0.558  11.695  -8.788
    6   HD13  LEU  48          HD11      LEU  48  -0.812  12.455  -6.590
    7   HD12  LEU  48          HD12      LEU  48   0.334  11.130  -6.409
    8   HD11  LEU  48          HD13      LEU  48  -1.365  10.889  -5.999
    9   HD22  LEU  48          HD21      LEU  48  -0.096   9.506  -9.446
   10   HD21  LEU  48          HD22      LEU  48  -0.965   8.795  -8.087
   11   HD23  LEU  48          HD23      LEU  48   0.621   9.524  -7.835

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ASN  49           H        ASN  49  -4.648  12.386  -9.767
    2    HA   ASN  49           HA       ASN  49  -6.853  10.749  -9.220
    3    HB2  ASN  49           HB2      ASN  49  -6.858  13.177  -8.887
    4    HB3  ASN  49           HB3      ASN  49  -6.734  13.435 -10.624
    5   HD21  ASN  49          HD21      ASN  49  -8.899  14.513  -9.158
    6   HD22  ASN  49          HD22      ASN  49 -10.322  13.710  -9.609

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLU  50           H        GLU  50  -5.581  11.947 -12.310
    2    HA   GLU  50           HA       GLU  50  -7.566  10.730 -13.948
    3    HB2  GLU  50           HB2      GLU  50  -6.080  12.533 -14.763
    4    HB3  GLU  50           HB3      GLU  50  -4.701  11.440 -14.642
    5    HG2  GLU  50           HG2      GLU  50  -5.710   9.928 -16.281
    6    HG3  GLU  50           HG3      GLU  50  -7.156  10.928 -16.351

  No H/Q in entry =           6
  In of MODEL   88
    1    H    ALA  51           H        ALA  51  -4.401   9.684 -12.774
    2    HA   ALA  51           HA       ALA  51  -4.308   7.239 -14.208
    3    HB2  ALA  51           HB1      ALA  51  -2.323   6.915 -13.125
    4    HB1  ALA  51           HB2      ALA  51  -2.993   7.338 -11.549
    5    HB3  ALA  51           HB3      ALA  51  -2.527   8.609 -12.680

  No H/Q in entry =           5
  In of MODEL   88
    1    H    HIS  52           H        HIS  52  -5.444   8.067 -10.944
    2    HA   HIS  52           HA       HIS  52  -6.161   5.462 -10.124
    3    HB2  HIS  52           HB2      HIS  52  -5.980   7.431  -8.613
    4    HB3  HIS  52           HB3      HIS  52  -7.454   8.081  -9.331
    5    HD1  HIS  52           HD1      HIS  52  -9.661   6.597  -9.016
    6    HD2  HIS  52           HD2      HIS  52  -6.406   5.473  -6.666
    7    HE1  HIS  52           HE1      HIS  52 -10.575   5.084  -7.201
    8    HE2  HIS  52           HE2      HIS  52  -8.603   4.391  -5.760

  No H/Q in entry =           8
  In of MODEL   88
    1    H    LEU  53           H        LEU  53  -7.958   7.958 -11.882
    2    HA   LEU  53           HA       LEU  53 -10.482   6.703 -11.884
    3    HB2  LEU  53           HB2      LEU  53  -9.183   8.677 -13.748
    4    HB3  LEU  53           HB3      LEU  53 -10.792   8.036 -14.067
    5    HG   LEU  53           HG       LEU  53 -10.044   9.327 -11.423
    6   HD12  LEU  53          HD11      LEU  53 -11.374  11.294 -12.381
    7   HD11  LEU  53          HD12      LEU  53 -11.156  10.538 -13.960
    8   HD13  LEU  53          HD13      LEU  53  -9.756  11.065 -13.031
    9   HD21  LEU  53          HD21      LEU  53 -12.627   8.489 -12.753
   10   HD23  LEU  53          HD22      LEU  53 -12.614   9.742 -11.518
   11   HD22  LEU  53          HD23      LEU  53 -12.079   8.121 -11.123

  No H/Q in entry =          11
  In of MODEL   88
    1    H    VAL  54           H        VAL  54  -7.752   6.479 -14.143
    2    HA   VAL  54           HA       VAL  54  -9.015   4.738 -15.987
    3    HB   VAL  54           HB       VAL  54  -6.095   5.196 -15.324
    4   HG12  VAL  54          HG11      VAL  54  -5.882   4.122 -17.722
    5   HG11  VAL  54          HG12      VAL  54  -7.419   3.362 -17.311
    6   HG13  VAL  54          HG13      VAL  54  -6.000   3.080 -16.305
    7   HG22  VAL  54          HG21      VAL  54  -6.843   7.157 -16.351
    8   HG21  VAL  54          HG22      VAL  54  -8.057   6.318 -17.315
    9   HG23  VAL  54          HG23      VAL  54  -6.355   6.215 -17.759

  No H/Q in entry =           9
  In of MODEL   88
    1    H    GLN  55           H        GLN  55  -7.003   4.143 -13.106
    2    HA   GLN  55           HA       GLN  55  -6.958   1.327 -13.381
    3    HB2  GLN  55           HB2      GLN  55  -5.378   2.190 -11.868
    4    HB3  GLN  55           HB3      GLN  55  -6.573   3.170 -11.023
    5    HG2  GLN  55           HG2      GLN  55  -7.279   1.415  -9.711
    6    HG3  GLN  55           HG3      GLN  55  -7.082   0.233 -10.998
    7   HE21  GLN  55          HE21      GLN  55  -5.477  -1.245 -10.525
    8   HE22  GLN  55          HE22      GLN  55  -4.080  -0.920  -9.621

  No H/Q in entry =           8
  In of MODEL   88
    1    H    THR  56           H        THR  56  -9.244   3.515 -11.735
    2    HA   THR  56           HA       THR  56 -10.847   1.649 -10.445
    3    HB   THR  56           HB       THR  56 -11.724   4.169 -11.887
    4    HG1  THR  56           HG1      THR  56 -10.108   4.228 -10.125
    5   HG23  THR  56          HG21      THR  56 -13.738   3.087 -11.485
    6   HG22  THR  56          HG22      THR  56 -13.520   3.953  -9.964
    7   HG21  THR  56          HG23      THR  56 -13.119   2.238 -10.070

  No H/Q in entry =           7
  In of MODEL   88
    1    H    LYS  57           H        LYS  57 -11.057   2.755 -13.823
    2    HA   LYS  57           HA       LYS  57 -13.245   1.106 -14.571
    3    HB2  LYS  57           HB2      LYS  57 -12.347   3.052 -15.883
    4    HB3  LYS  57           HB3      LYS  57 -10.927   2.091 -16.268
    5    HG2  LYS  57           HG2      LYS  57 -12.330   0.439 -17.419
    6    HG3  LYS  57           HG3      LYS  57 -13.774   1.358 -17.009
    7    HD2  LYS  57           HD2      LYS  57 -12.919   3.279 -18.316
    8    HD3  LYS  57           HD3      LYS  57 -11.485   2.347 -18.743
    9    HE2  LYS  57           HE2      LYS  57 -12.885   0.674 -19.887
   10    HE3  LYS  57           HE3      LYS  57 -14.345   1.555 -19.435
   11    HZ1  LYS  57           HZ1      LYS  57 -12.469   3.272 -20.692
   12    HZ3  LYS  57           HZ2      LYS  57 -14.076   2.927 -21.128
   13    HZ2  LYS  57           HZ3      LYS  57 -12.808   1.938 -21.683

  No H/Q in entry =          13
  In of MODEL   88
    1    H    LEU  58           H        LEU  58  -9.748   0.621 -14.542
    2    HA   LEU  58           HA       LEU  58  -9.804  -1.888 -15.846
    3    HB2  LEU  58           HB2      LEU  58  -7.737  -0.639 -14.045
    4    HB3  LEU  58           HB3      LEU  58  -7.506  -2.159 -14.910
    5    HG   LEU  58           HG       LEU  58  -8.229   0.465 -16.253
    6   HD11  LEU  58          HD11      LEU  58  -5.597  -0.817 -15.588
    7   HD13  LEU  58          HD12      LEU  58  -6.066   0.881 -15.526
    8   HD12  LEU  58          HD13      LEU  58  -5.750   0.114 -17.079
    9   HD22  LEU  58          HD21      LEU  58  -8.841  -1.079 -17.848
   10   HD21  LEU  58          HD22      LEU  58  -7.814  -2.346 -17.181
   11   HD23  LEU  58          HD23      LEU  58  -7.111  -1.078 -18.184

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  59           H        ILE  59 -10.588  -0.992 -12.584
    2    HA   ILE  59           HA       ILE  59 -10.273  -3.770 -11.654
    3    HB   ILE  59           HB       ILE  59  -9.788  -1.513 -10.248
    4   HG12  ILE  59          HG12      ILE  59 -11.166  -3.863  -8.930
    5   HG13  ILE  59          HG13      ILE  59  -9.527  -3.948  -9.525
    6   HG22  ILE  59          HG21      ILE  59 -12.550  -2.214  -9.292
    7   HG21  ILE  59          HG22      ILE  59 -12.318  -0.958 -10.487
    8   HG23  ILE  59          HG23      ILE  59 -11.587  -0.813  -8.891
    9   HD12  ILE  59          HD11      ILE  59 -10.568  -2.027  -7.456
   10   HD11  ILE  59          HD12      ILE  59  -8.936  -1.979  -8.110
   11   HD13  ILE  59          HD13      ILE  59  -9.467  -3.371  -7.163

  No H/Q in entry =          11
  In of MODEL   88
    1    H    GLU  60           H        GLU  60 -12.801  -1.411 -12.431
    2    HA   GLU  60           HA       GLU  60 -15.001  -2.900 -11.411
    3    HB2  GLU  60           HB2      GLU  60 -15.223  -0.538 -11.970
    4    HB3  GLU  60           HB3      GLU  60 -14.847  -0.871 -13.657
    5    HG2  GLU  60           HG2      GLU  60 -17.175  -2.234 -12.319
    6    HG3  GLU  60           HG3      GLU  60 -17.347  -0.624 -12.987

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLY  61           H        GLY  61 -13.350  -2.892 -14.537
    2    HA3  GLY  61           HA2      GLY  61 -15.103  -5.105 -15.428
    3    HA2  GLY  61           HA3      GLY  61 -14.249  -4.007 -16.506

  No H/Q in entry =           3
  In of MODEL   88
    1    H    ASP  62           H        ASP  62 -12.880  -5.497 -13.640
    2    HA   ASP  62           HA       ASP  62 -10.569  -6.383 -15.006
    3    HB2  ASP  62           HB2      ASP  62 -10.003  -7.438 -12.869
    4    HB3  ASP  62           HB3      ASP  62 -10.628  -5.813 -12.608

  No H/Q in entry =           4
  In of MODEL   88
    1    H    ALA  63           H        ALA  63 -12.168  -7.523 -16.724
    2    HA   ALA  63           HA       ALA  63 -13.224 -10.101 -16.141
    3    HB3  ALA  63           HB1      ALA  63 -12.925 -10.403 -18.680
    4    HB2  ALA  63           HB2      ALA  63 -12.256  -8.772 -18.687
    5    HB1  ALA  63           HB3      ALA  63 -13.923  -9.042 -18.170

  No H/Q in entry =           5
  In of MODEL   88
    1    H    GLY  64           H        GLY  64 -10.072  -8.965 -17.201
    2    HA3  GLY  64           HA2      GLY  64  -8.031  -9.983 -17.416
    3    HA2  GLY  64           HA3      GLY  64  -8.551 -11.002 -16.080

  No H/Q in entry =           3
  In of MODEL   88
    1    H    GLU  65           H        GLU  65  -7.995 -13.035 -16.667
    2    HA   GLU  65           HA       GLU  65  -7.891 -13.966 -19.318
    3    HB2  GLU  65           HB2      GLU  65  -8.061 -15.470 -16.709
    4    HB3  GLU  65           HB3      GLU  65  -7.783 -16.242 -18.271
    5    HG2  GLU  65           HG2      GLU  65  -5.762 -14.922 -18.612
    6    HG3  GLU  65           HG3      GLU  65  -6.057 -14.036 -17.116

  No H/Q in entry =           6
  In of MODEL   88
    1    H    GLY  66           H        GLY  66  -9.045 -16.335 -19.475
    2    HA3  GLY  66           HA2      GLY  66 -11.642 -15.844 -20.419
    3    HA2  GLY  66           HA3      GLY  66 -10.901 -17.419 -20.216

  No H/Q in entry =           3
  In of MODEL   88
    1    H    LYS  67           H        LYS  67 -10.520 -17.224 -17.393
    2    HA   LYS  67           HA       LYS  67 -13.174 -17.993 -16.553
    3    HB2  LYS  67           HB2      LYS  67 -10.476 -18.148 -15.219
    4    HB3  LYS  67           HB3      LYS  67 -11.971 -18.745 -14.489
    5    HG2  LYS  67           HG2      LYS  67 -12.357 -20.159 -16.504
    6    HG3  LYS  67           HG3      LYS  67 -10.812 -19.615 -17.154
    7    HD2  LYS  67           HD2      LYS  67 -11.069 -20.981 -14.465
    8    HD3  LYS  67           HD3      LYS  67 -10.758 -21.860 -15.964
    9    HE2  LYS  67           HE2      LYS  67  -8.800 -20.242 -16.329
   10    HE3  LYS  67           HE3      LYS  67  -9.025 -19.761 -14.647
   11    HZ2  LYS  67           HZ1      LYS  67  -7.940 -22.207 -15.738
   12    HZ1  LYS  67           HZ2      LYS  67  -9.032 -22.432 -14.457
   13    HZ3  LYS  67           HZ3      LYS  67  -7.653 -21.465 -14.241

  No H/Q in entry =          13
  In of MODEL   88
    1    H    MET  68           H        MET  68 -13.298 -17.590 -13.965
    2    HA   MET  68           HA       MET  68 -14.347 -14.988 -13.688
    3    HB2  MET  68           HB2      MET  68 -13.731 -17.136 -11.663
    4    HB3  MET  68           HB3      MET  68 -14.605 -15.651 -11.285
    5    HG2  MET  68           HG2      MET  68 -16.406 -16.217 -12.721
    6    HG3  MET  68           HG3      MET  68 -15.467 -17.467 -13.539
    7    HE1  MET  68           HE1      MET  68 -16.344 -16.233 -10.058
    8    HE3  MET  68           HE2      MET  68 -14.921 -17.207  -9.691
    9    HE2  MET  68           HE3      MET  68 -16.498 -17.697  -9.075

  No H/Q in entry =           9
  In of MODEL   88
    1    H    LYS  69           H        LYS  69 -11.092 -15.873 -13.523
    2    HA   LYS  69           HA       LYS  69 -10.208 -14.370 -11.312
    3    HB2  LYS  69           HB2      LYS  69  -8.821 -15.396 -13.777
    4    HB3  LYS  69           HB3      LYS  69  -7.956 -14.497 -12.530
    5    HG2  LYS  69           HG2      LYS  69  -8.484 -16.118 -10.856
    6    HG3  LYS  69           HG3      LYS  69  -9.684 -16.894 -11.887
    7    HD2  LYS  69           HD2      LYS  69  -7.367 -18.035 -11.653
    8    HD3  LYS  69           HD3      LYS  69  -8.038 -17.860 -13.275
    9    HE2  LYS  69           HE2      LYS  69  -6.658 -15.965 -13.746
   10    HE3  LYS  69           HE3      LYS  69  -6.180 -15.809 -12.057
   11    HZ3  LYS  69           HZ1      LYS  69  -4.388 -16.889 -12.963
   12    HZ2  LYS  69           HZ2      LYS  69  -5.327 -17.790 -14.053
   13    HZ1  LYS  69           HZ3      LYS  69  -5.302 -18.203 -12.404

  No H/Q in entry =          13
  In of MODEL   88
    1    H    VAL  70           H        VAL  70  -8.128 -12.762 -12.065
    2    HA   VAL  70           HA       VAL  70  -9.350 -10.526 -13.576
    3    HB   VAL  70           HB       VAL  70  -8.393  -8.983 -11.890
    4   HG13  VAL  70          HG11      VAL  70 -10.051  -9.465 -10.123
    5   HG12  VAL  70          HG12      VAL  70 -10.240 -11.103 -10.751
    6   HG11  VAL  70          HG13      VAL  70 -10.746  -9.722 -11.723
    7   HG21  VAL  70          HG21      VAL  70  -7.764 -11.553 -10.384
    8   HG23  VAL  70          HG22      VAL  70  -7.617  -9.927  -9.721
    9   HG22  VAL  70          HG23      VAL  70  -6.575 -10.433 -11.049

  No H/Q in entry =           9
  In of MODEL   88
    1    H    SER  71           H        SER  71  -7.737  -8.945 -14.304
    2    HA   SER  71           HA       SER  71  -5.532 -10.148 -15.627
    3    HB2  SER  71           HB2      SER  71  -6.705  -8.084 -16.415
    4    HB3  SER  71           HB3      SER  71  -6.001  -7.210 -15.058
    5    HG   SER  71           HG       SER  71  -4.913  -7.800 -17.422

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LEU  72           H        LEU  72  -3.510 -10.473 -14.984
    2    HA   LEU  72           HA       LEU  72  -2.768 -10.284 -12.277
    3    HB2  LEU  72           HB2      LEU  72  -1.139 -10.727 -14.775
    4    HB3  LEU  72           HB3      LEU  72  -0.466 -10.817 -13.151
    5    HG   LEU  72           HG       LEU  72  -2.844 -12.472 -14.057
    6   HD11  LEU  72          HD11      LEU  72   0.100 -13.192 -13.925
    7   HD13  LEU  72          HD12      LEU  72  -0.883 -13.087 -15.385
    8   HD12  LEU  72          HD13      LEU  72  -1.208 -14.345 -14.192
    9   HD21  LEU  72          HD21      LEU  72  -1.119 -12.353 -11.592
   10   HD23  LEU  72          HD22      LEU  72  -1.844 -13.886 -12.050
   11   HD22  LEU  72          HD23      LEU  72  -2.870 -12.496 -11.706

  No H/Q in entry =          11
  In of MODEL   88
    1    H    VAL  73           H        VAL  73  -2.039  -8.265 -15.052
    2    HA   VAL  73           HA       VAL  73  -0.083  -6.603 -13.953
    3    HB   VAL  73           HB       VAL  73  -0.464  -5.170 -15.800
    4   HG12  VAL  73          HG11      VAL  73  -1.391  -7.874 -16.783
    5   HG11  VAL  73          HG12      VAL  73   0.260  -7.593 -16.232
    6   HG13  VAL  73          HG13      VAL  73  -0.370  -6.703 -17.616
    7   HG21  VAL  73          HG21      VAL  73  -3.248  -6.271 -15.617
    8   HG23  VAL  73          HG22      VAL  73  -2.657  -5.717 -17.182
    9   HG22  VAL  73          HG23      VAL  73  -2.719  -4.600 -15.817

  No H/Q in entry =           9
  In of MODEL   88
    1    H    LEU  74           H        LEU  74  -3.478  -6.667 -13.372
    2    HA   LEU  74           HA       LEU  74  -4.049  -4.005 -12.741
    3    HB2  LEU  74           HB2      LEU  74  -5.805  -5.641 -12.912
    4    HB3  LEU  74           HB3      LEU  74  -5.121  -6.583 -11.590
    5    HG   LEU  74           HG       LEU  74  -5.541  -4.706 -10.035
    6   HD13  LEU  74          HD11      LEU  74  -5.418  -2.759 -11.370
    7   HD12  LEU  74          HD12      LEU  74  -7.135  -2.905 -11.002
    8   HD11  LEU  74          HD13      LEU  74  -6.525  -3.412 -12.578
    9   HD23  LEU  74          HD21      LEU  74  -8.117  -5.079 -11.468
   10   HD22  LEU  74          HD22      LEU  74  -7.725  -5.257  -9.771
   11   HD21  LEU  74          HD23      LEU  74  -7.279  -6.517 -10.894

  No H/Q in entry =          11
  In of MODEL   88
    1    H    VAL  75           H        VAL  75  -3.035  -6.619 -10.601
    2    HA   VAL  75           HA       VAL  75  -2.795  -5.084  -8.250
    3    HB   VAL  75           HB       VAL  75  -1.350  -7.601  -9.066
    4   HG13  VAL  75          HG11      VAL  75  -0.045  -6.406  -7.345
    5   HG12  VAL  75          HG12      VAL  75  -0.873  -7.769  -6.607
    6   HG11  VAL  75          HG13      VAL  75  -1.505  -6.145  -6.396
    7   HG23  VAL  75          HG21      VAL  75  -3.562  -7.230  -7.039
    8   HG22  VAL  75          HG22      VAL  75  -3.052  -8.716  -7.842
    9   HG21  VAL  75          HG23      VAL  75  -3.931  -7.481  -8.746

  No H/Q in entry =           9
  In of MODEL   88
    1    H    GLU  76           H        GLU  76  -0.416  -5.870 -10.807
    2    HA   GLU  76           HA       GLU  76   1.799  -4.565  -9.658
    3    HB2  GLU  76           HB2      GLU  76   1.973  -6.031 -11.647
    4    HB3  GLU  76           HB3      GLU  76   1.061  -4.864 -12.593
    5    HG2  GLU  76           HG2      GLU  76   3.402  -4.555 -13.106
    6    HG3  GLU  76           HG3      GLU  76   2.895  -3.172 -12.155

  No H/Q in entry =           6
  In of MODEL   88
    1    H    ALA  77           H        ALA  77  -0.728  -3.311 -11.823
    2    HA   ALA  77           HA       ALA  77   0.304  -0.680 -11.992
    3    HB1  ALA  77           HB1      ALA  77  -1.397  -1.548 -13.545
    4    HB2  ALA  77           HB2      ALA  77  -1.955  -0.066 -12.765
    5    HB3  ALA  77           HB3      ALA  77  -2.566  -1.630 -12.225

  No H/Q in entry =           5
  In of MODEL   88
    1    H    GLN  78           H        GLN  78  -1.974  -2.211  -9.773
    2    HA   GLN  78           HA       GLN  78  -2.734   0.113  -8.354
    3    HB2  GLN  78           HB2      GLN  78  -3.875  -2.135  -8.276
    4    HB3  GLN  78           HB3      GLN  78  -2.544  -2.712  -7.277
    5    HG2  GLN  78           HG2      GLN  78  -3.036  -0.967  -5.611
    6    HG3  GLN  78           HG3      GLN  78  -4.369  -0.388  -6.608
    7   HE21  GLN  78          HE21      GLN  78  -4.629  -3.531  -7.248
    8   HE22  GLN  78          HE22      GLN  78  -5.600  -4.052  -5.955

  No H/Q in entry =           8
  In of MODEL   88
    1    H    LEU  79           H        LEU  79  -0.089  -2.187  -7.934
    2    HA   LEU  79           HA       LEU  79   0.918  -1.319  -5.479
    3    HB2  LEU  79           HB2      LEU  79   1.749  -3.335  -6.563
    4    HB3  LEU  79           HB3      LEU  79   2.401  -2.386  -7.896
    5    HG   LEU  79           HG       LEU  79   3.984  -1.279  -6.397
    6   HD13  LEU  79          HD11      LEU  79   2.998  -1.030  -4.322
    7   HD12  LEU  79          HD12      LEU  79   4.058  -2.398  -3.992
    8   HD11  LEU  79          HD13      LEU  79   2.346  -2.669  -4.312
    9   HD23  LEU  79          HD21      LEU  79   5.168  -3.451  -5.513
   10   HD22  LEU  79          HD22      LEU  79   4.956  -3.239  -7.249
   11   HD21  LEU  79          HD23      LEU  79   3.867  -4.297  -6.355

  No H/Q in entry =          11
  In of MODEL   88
    1    H    HIS  80           H        HIS  80   1.783  -0.198  -8.752
    2    HA   HIS  80           HA       HIS  80   3.627   1.757  -7.832
    3    HB2  HIS  80           HB2      HIS  80   2.310   1.096 -10.409
    4    HB3  HIS  80           HB3      HIS  80   2.930   2.738 -10.234
    5    HD1  HIS  80           HD1      HIS  80   5.333   3.005 -10.771
    6    HD2  HIS  80           HD2      HIS  80   4.463  -0.899  -9.594
    7    HE1  HIS  80           HE1      HIS  80   7.502   1.697 -10.958
    8    HE2  HIS  80           HE2      HIS  80   6.983  -0.686 -10.244

  No H/Q in entry =           8
  In of MODEL   88
    1    H    LEU  81           H        LEU  81   0.219   1.973  -8.788
    2    HA   LEU  81           HA       LEU  81  -0.013   4.767  -8.440
    3    HB2  LEU  81           HB2      LEU  81  -2.060   2.551  -8.359
    4    HB3  LEU  81           HB3      LEU  81  -2.486   4.260  -8.255
    5    HG   LEU  81           HG       LEU  81  -0.825   3.098 -10.509
    6   HD12  LEU  81          HD11      LEU  81  -3.061   3.457 -11.791
    7   HD11  LEU  81          HD12      LEU  81  -3.807   3.391 -10.195
    8   HD13  LEU  81          HD13      LEU  81  -2.888   2.013 -10.796
    9   HD23  LEU  81          HD21      LEU  81  -1.898   5.263 -11.587
   10   HD22  LEU  81          HD22      LEU  81  -0.473   5.408 -10.563
   11   HD21  LEU  81          HD23      LEU  81  -2.068   5.776  -9.910

  No H/Q in entry =          11
  In of MODEL   88
    1    H    MET  82           H        MET  82  -0.696   2.078  -6.201
    2    HA   MET  82           HA       MET  82  -1.712   3.667  -4.099
    3    HB2  MET  82           HB2      MET  82  -0.376   0.962  -4.162
    4    HB3  MET  82           HB3      MET  82  -0.935   1.687  -2.656
    5    HG2  MET  82           HG2      MET  82  -2.690   1.231  -5.088
    6    HG3  MET  82           HG3      MET  82  -2.618   0.149  -3.699
    7    HE3  MET  82           HE1      MET  82  -4.299   1.807  -0.864
    8    HE2  MET  82           HE2      MET  82  -2.566   2.061  -1.059
    9    HE1  MET  82           HE3      MET  82  -3.279   0.516  -1.517

  No H/Q in entry =           9
  In of MODEL   88
    1    H    THR  83           H        THR  83   1.569   2.540  -4.816
    2    HA   THR  83           HA       THR  83   2.817   3.614  -2.518
    3    HB   THR  83           HB       THR  83   4.901   3.538  -4.005
    4    HG1  THR  83           HG1      THR  83   4.641   3.026  -6.031
    5   HG22  THR  83          HG21      THR  83   4.418   0.888  -4.349
    6   HG21  THR  83          HG22      THR  83   3.141   1.279  -3.198
    7   HG23  THR  83          HG23      THR  83   4.828   1.597  -2.788

  No H/Q in entry =           7
  In of MODEL   88
    1    H    SER  84           H        SER  84   2.443   4.917  -5.808
    2    HA   SER  84           HA       SER  84   3.819   7.336  -5.349
    3    HB2  SER  84           HB2      SER  84   1.724   6.543  -7.359
    4    HB3  SER  84           HB3      SER  84   2.425   8.161  -7.329
    5    HG   SER  84           HG       SER  84   3.761   5.669  -7.643

  No H/Q in entry =           5
  In of MODEL   88
    1    H    MET  85           H        MET  85   0.316   6.627  -5.158
    2    HA   MET  85           HA       MET  85  -0.505   9.246  -4.537
    3    HB2  MET  85           HB2      MET  85  -2.063   7.474  -5.206
    4    HB3  MET  85           HB3      MET  85  -1.766   6.637  -3.683
    5    HG2  MET  85           HG2      MET  85  -2.635   8.556  -2.427
    6    HG3  MET  85           HG3      MET  85  -2.864   9.453  -3.927
    7    HE3  MET  85           HE1      MET  85  -3.922   5.417  -3.310
    8    HE2  MET  85           HE2      MET  85  -5.137   5.978  -2.163
    9    HE1  MET  85           HE3      MET  85  -3.452   6.444  -1.950

  No H/Q in entry =           9
  In of MODEL   88
    1    H    LEU  86           H        LEU  86   0.391   6.559  -2.414
    2    HA   LEU  86           HA       LEU  86  -0.108   7.855   0.039
    3    HB2  LEU  86           HB2      LEU  86   0.318   5.380  -0.372
    4    HB3  LEU  86           HB3      LEU  86   2.030   5.785  -0.476
    5    HG   LEU  86           HG       LEU  86   1.738   6.938   1.801
    6   HD11  LEU  86          HD11      LEU  86  -0.971   6.214   1.343
    7   HD13  LEU  86          HD12      LEU  86  -0.284   6.943   2.793
    8   HD12  LEU  86          HD13      LEU  86  -0.402   5.189   2.665
    9   HD23  LEU  86          HD21      LEU  86   1.266   3.952   1.909
   10   HD22  LEU  86          HD22      LEU  86   2.290   4.940   2.948
   11   HD21  LEU  86          HD23      LEU  86   2.775   4.618   1.284

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ALA  87           H        ALA  87   2.856   7.527  -1.872
    2    HA   ALA  87           HA       ALA  87   4.594   8.902  -0.151
    3    HB3  ALA  87           HB1      ALA  87   4.656   7.903  -2.864
    4    HB2  ALA  87           HB2      ALA  87   6.003   8.207  -1.771
    5    HB1  ALA  87           HB3      ALA  87   5.401   9.503  -2.803

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ARG  88           H        ARG  88   2.646  10.083  -2.852
    2    HA   ARG  88           HA       ARG  88   3.464  12.760  -2.725
    3    HB2  ARG  88           HB2      ARG  88   2.179  11.638  -4.580
    4    HB3  ARG  88           HB3      ARG  88   0.731  11.798  -3.586
    5    HG2  ARG  88           HG2      ARG  88   1.791  14.361  -3.495
    6    HG3  ARG  88           HG3      ARG  88   2.196  13.850  -5.131
    7    HD2  ARG  88           HD2      ARG  88   0.052  13.968  -5.814
    8    HD3  ARG  88           HD3      ARG  88  -0.539  13.116  -4.387
    9    HE   ARG  88           HE       ARG  88  -0.687  15.899  -4.787
   10   HH21  ARG  88          HH11      ARG  88  -1.181  17.226  -3.038
   11   HH22  ARG  88          HH12      ARG  88  -0.882  16.675  -1.426
   12   HH11  ARG  88          HH21      ARG  88   0.309  13.607  -2.433
   13   HH12  ARG  88          HH22      ARG  88  -0.057  14.620  -1.083

  No H/Q in entry =          13
  In of MODEL   88
    1    H    GLU  89           H        GLU  89   0.745  11.119  -1.076
    2    HA   GLU  89           HA       GLU  89  -0.317  13.441   0.150
    3    HB2  GLU  89           HB2      GLU  89  -1.472  11.221   0.058
    4    HB3  GLU  89           HB3      GLU  89  -0.349  10.640   1.288
    5    HG2  GLU  89           HG2      GLU  89  -1.130  12.343   2.863
    6    HG3  GLU  89           HG3      GLU  89  -2.180  13.038   1.631

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LEU  90           H        LEU  90   2.104  11.102   1.294
    2    HA   LEU  90           HA       LEU  90   2.498  12.325   3.828
    3    HB2  LEU  90           HB2      LEU  90   4.230  10.532   2.128
    4    HB3  LEU  90           HB3      LEU  90   4.669  11.032   3.767
    5    HG   LEU  90           HG       LEU  90   2.007   9.734   3.116
    6   HD12  LEU  90          HD11      LEU  90   3.120   7.664   4.104
    7   HD11  LEU  90          HD12      LEU  90   4.655   8.495   3.857
    8   HD13  LEU  90          HD13      LEU  90   3.626   8.113   2.475
    9   HD22  LEU  90          HD21      LEU  90   1.773  10.649   5.245
   10   HD21  LEU  90          HD22      LEU  90   3.491  10.511   5.615
   11   HD23  LEU  90          HD23      LEU  90   2.461   9.080   5.662

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  91           H        ILE  91   4.086  12.700   0.692
    2    HA   ILE  91           HA       ILE  91   6.100  14.492   1.529
    3    HB   ILE  91           HB       ILE  91   4.761  14.040  -1.145
    4   HG12  ILE  91          HG12      ILE  91   7.592  13.498  -0.194
    5   HG13  ILE  91          HG13      ILE  91   6.291  12.322  -0.029
    6   HG22  ILE  91          HG21      ILE  91   7.002  15.353  -1.841
    7   HG21  ILE  91          HG22      ILE  91   6.717  16.149  -0.293
    8   HG23  ILE  91          HG23      ILE  91   5.486  16.207  -1.553
    9   HD13  ILE  91          HD11      ILE  91   6.096  12.016  -2.337
   10   HD12  ILE  91          HD12      ILE  91   7.836  12.227  -2.134
   11   HD11  ILE  91          HD13      ILE  91   6.844  13.571  -2.705

  No H/Q in entry =          11
  In of MODEL   88
    1    H    THR  92           H        THR  92   2.739  14.989   0.547
    2    HA   THR  92           HA       THR  92   2.762  17.812   0.504
    3    HB   THR  92           HB       THR  92   0.565  15.851   1.206
    4    HG1  THR  92           HG1      THR  92   0.851  15.680  -0.882
    5   HG22  THR  92          HG21      THR  92  -0.803  18.042   0.507
    6   HG21  THR  92          HG22      THR  92   0.608  18.838   1.199
    7   HG23  THR  92          HG23      THR  92  -0.346  17.728   2.181

  No H/Q in entry =           7
  In of MODEL   88
    1    H    GLU  93           H        GLU  93   2.192  15.506   3.148
    2    HA   GLU  93           HA       GLU  93   1.707  17.406   5.181
    3    HB2  GLU  93           HB2      GLU  93   2.974  14.657   5.392
    4    HB3  GLU  93           HB3      GLU  93   2.309  15.588   6.735
    5    HG2  GLU  93           HG2      GLU  93   0.666  14.854   4.303
    6    HG3  GLU  93           HG3      GLU  93   0.759  13.821   5.724

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LEU  94           H        LEU  94   4.679  15.879   4.001
    2    HA   LEU  94           HA       LEU  94   6.463  16.983   5.884
    3    HB2  LEU  94           HB2      LEU  94   6.827  16.026   3.044
    4    HB3  LEU  94           HB3      LEU  94   8.175  16.655   3.988
    5    HG   LEU  94           HG       LEU  94   6.405  14.483   5.123
    6   HD11  LEU  94          HD11      LEU  94   8.481  14.233   2.975
    7   HD13  LEU  94          HD12      LEU  94   7.020  13.284   3.241
    8   HD12  LEU  94          HD13      LEU  94   8.448  12.999   4.236
    9   HD23  LEU  94          HD21      LEU  94   8.592  13.901   6.256
   10   HD22  LEU  94          HD22      LEU  94   7.957  15.488   6.687
   11   HD21  LEU  94          HD23      LEU  94   9.285  15.351   5.534

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  95           H        ILE  95   5.322  18.194   2.749
    2    HA   ILE  95           HA       ILE  95   6.936  20.524   2.693
    3    HB   ILE  95           HB       ILE  95   4.271  19.895   1.402
    4   HG12  ILE  95          HG12      ILE  95   7.057  20.190   0.247
    5   HG13  ILE  95          HG13      ILE  95   6.384  18.645   0.757
    6   HG21  ILE  95          HG21      ILE  95   6.062  22.332   1.184
    7   HG23  ILE  95          HG22      ILE  95   4.339  22.293   1.552
    8   HG22  ILE  95          HG23      ILE  95   4.903  21.892  -0.070
    9   HD13  ILE  95          HD11      ILE  95   4.811  18.607  -0.961
   10   HD12  ILE  95          HD12      ILE  95   6.169  19.406  -1.754
   11   HD11  ILE  95          HD13      ILE  95   4.817  20.362  -1.146

  No H/Q in entry =          11
  In of MODEL   88
    1    H    GLU  96           H        GLU  96   3.685  19.922   4.007
    2    HA   GLU  96           HA       GLU  96   3.117  22.574   4.778
    3    HB2  GLU  96           HB2      GLU  96   1.411  20.821   4.791
    4    HB3  GLU  96           HB3      GLU  96   2.267  19.971   6.075
    5    HG2  GLU  96           HG2      GLU  96   1.280  21.263   7.660
    6    HG3  GLU  96           HG3      GLU  96   1.836  22.732   6.868

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LEU  97           H        LEU  97   4.925  19.981   6.375
    2    HA   LEU  97           HA       LEU  97   5.324  21.308   8.851
    3    HB2  LEU  97           HB2      LEU  97   6.812  19.120   7.413
    4    HB3  LEU  97           HB3      LEU  97   7.424  19.785   8.925
    5    HG   LEU  97           HG       LEU  97   4.593  18.745   8.628
    6   HD12  LEU  97          HD11      LEU  97   5.505  16.708   9.822
    7   HD11  LEU  97          HD12      LEU  97   7.125  17.312   9.470
    8   HD13  LEU  97          HD13      LEU  97   6.038  16.882   8.149
    9   HD23  LEU  97          HD21      LEU  97   5.059  18.426  11.187
   10   HD22  LEU  97          HD22      LEU  97   4.703  20.048  10.595
   11   HD21  LEU  97          HD23      LEU  97   6.369  19.576  10.926

  No H/Q in entry =          11
  In of MODEL   88
    1    H    HIS  98           H        HIS  98   7.173  21.309   5.813
    2    HA   HIS  98           HA       HIS  98   9.362  22.843   6.707
    3    HB2  HIS  98           HB2      HIS  98   8.045  22.628   3.988
    4    HB3  HIS  98           HB3      HIS  98   9.505  23.579   4.275
    5    HD1  HIS  98           HD1      HIS  98   8.229  20.031   4.281
    6    HD2  HIS  98           HD2      HIS  98  11.850  22.058   4.694
    7    HE1  HIS  98           HE1      HIS  98  10.051  18.268   4.201
    8    HE2  HIS  98           HE2      HIS  98  12.260  19.482   4.452

  No H/Q in entry =           8
  In of MODEL   88
    1    H    GLU  99           H        GLU  99   6.149  23.744   5.559
    2    HA   GLU  99           HA       GLU  99   6.579  26.552   5.515
    3    HB2  GLU  99           HB2      GLU  99   4.671  25.425   4.391
    4    HB3  GLU  99           HB3      GLU  99   3.979  25.067   5.972
    5    HG2  GLU  99           HG2      GLU  99   3.847  27.458   6.489
    6    HG3  GLU  99           HG3      GLU  99   4.620  27.853   4.957

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LYS 100           H        LYS 100   5.425  24.323   8.031
    2    HA   LYS 100           HA       LYS 100   4.890  26.375   9.942
    3    HB2  LYS 100           HB2      LYS 100   5.412  23.412  10.266
    4    HB3  LYS 100           HB3      LYS 100   4.994  24.484  11.607
    5    HG2  LYS 100           HG2      LYS 100   2.932  25.168  10.378
    6    HG3  LYS 100           HG3      LYS 100   3.328  23.999   9.115
    7    HD2  LYS 100           HD2      LYS 100   3.228  22.170  10.766
    8    HD3  LYS 100           HD3      LYS 100   2.849  23.332  12.039
    9    HE2  LYS 100           HE2      LYS 100   0.799  24.000  10.795
   10    HE3  LYS 100           HE3      LYS 100   1.168  22.780   9.569
   11    HZ1  LYS 100           HZ1      LYS 100   0.909  22.101  12.447
   12    HZ3  LYS 100           HZ2      LYS 100   0.865  21.055  11.106
   13    HZ2  LYS 100           HZ3      LYS 100  -0.429  22.117  11.401

  No H/Q in entry =          13
  In of MODEL   88
    1    H    LEU 101           H        LEU 101   7.773  24.531   9.076
    2    HA   LEU 101           HA       LEU 101   9.402  25.327  11.274
    3    HB2  LEU 101           HB2      LEU 101   9.959  24.346   8.486
    4    HB3  LEU 101           HB3      LEU 101  11.280  24.981   9.462
    5    HG   LEU 101           HG       LEU 101   9.415  22.853  10.526
    6   HD12  LEU 101          HD11      LEU 101  11.436  21.323   9.894
    7   HD11  LEU 101          HD12      LEU 101  11.819  22.586   8.726
    8   HD13  LEU 101          HD13      LEU 101  10.273  21.743   8.638
    9   HD21  LEU 101          HD21      LEU 101  12.164  23.905  11.241
   10   HD23  LEU 101          HD22      LEU 101  11.595  22.339  11.815
   11   HD22  LEU 101          HD23      LEU 101  10.734  23.809  12.268

  No H/Q in entry =          11
  In of MODEL   88
    1    H    LYS 102           H        LYS 102   7.840  27.233   9.156
    2    HA   LYS 102           HA       LYS 102   7.959  29.526   8.877
    3    HB2  LYS 102           HB2      LYS 102   9.536  29.368  10.964
    4    HB3  LYS 102           HB3      LYS 102  10.831  29.545   9.797
    5    HG2  LYS 102           HG2      LYS 102   8.769  31.532  10.685
    6    HG3  LYS 102           HG3      LYS 102  10.484  31.761  10.423
    7    HD2  LYS 102           HD2      LYS 102   8.510  31.390   8.134
    8    HD3  LYS 102           HD3      LYS 102   8.927  32.957   8.810
    9    HE2  LYS 102           HE2      LYS 102  10.263  31.760   6.720
   10    HE3  LYS 102           HE3      LYS 102  10.912  33.048   7.734
   11    HZ2  LYS 102           HZ1      LYS 102  12.394  31.116   7.537
   12    HZ1  LYS 102           HZ2      LYS 102  11.218  30.151   8.282
   13    HZ3  LYS 102           HZ3      LYS 102  11.941  31.419   9.144

  No H/Q in entry =          13
  In of MODEL   88
    1    H    ALA 103           H        ALA 103  11.186  28.128   8.282
    2    HA   ALA 103           HA       ALA 103  12.162  29.499   6.208
    3    HB2  ALA 103           HB1      ALA 103  12.998  27.274   5.260
    4    HB1  ALA 103           HB2      ALA 103  12.097  26.509   6.568
    5    HB3  ALA 103           HB3      ALA 103  13.411  27.626   6.939

  No H/Q in entry =           5
  In of MODEL   88
    1    H1   LYS   3           H1       LYS   3 -31.658   5.047 -20.071
    2    H2   LYS   3           H3       LYS   3 -30.638   4.792 -21.405
    3    H3   LYS   3           H2       LYS   3 -31.975   3.777 -21.152
    4    HA   LYS   3           HA       LYS   3 -30.905   2.481 -19.710
    5    HB2  LYS   3           HB2      LYS   3 -28.700   4.005 -21.050
    6    HB3  LYS   3           HB3      LYS   3 -28.315   2.845 -19.778
    7    HG2  LYS   3           HG2      LYS   3 -29.622   1.146 -21.109
    8    HG3  LYS   3           HG3      LYS   3 -29.636   2.320 -22.424
    9    HD2  LYS   3           HD2      LYS   3 -27.152   2.362 -22.347
   10    HD3  LYS   3           HD3      LYS   3 -27.204   1.083 -21.134
   11    HE2  LYS   3           HE2      LYS   3 -28.608  -0.218 -22.840
   12    HE3  LYS   3           HE3      LYS   3 -28.049   0.972 -24.015
   13    HZ3  LYS   3           HZ1      LYS   3 -26.176  -0.148 -24.241
   14    HZ2  LYS   3           HZ2      LYS   3 -26.745  -1.331 -23.164
   15    HZ1  LYS   3           HZ3      LYS   3 -25.840  -0.017 -22.581

  No H/Q in entry =          15
  In of MODEL   88
    1    H    LYS   4           H        LYS   4 -30.971   2.378 -17.647
    2    HA   LYS   4           HA       LYS   4 -30.400   4.738 -16.037
    3    HB2  LYS   4           HB2      LYS   4 -31.442   1.991 -15.293
    4    HB3  LYS   4           HB3      LYS   4 -31.315   3.363 -14.194
    5    HG2  LYS   4           HG2      LYS   4 -33.090   3.142 -16.631
    6    HG3  LYS   4           HG3      LYS   4 -33.601   3.197 -14.945
    7    HD2  LYS   4           HD2      LYS   4 -33.044   5.463 -14.718
    8    HD3  LYS   4           HD3      LYS   4 -31.987   5.438 -16.129
    9    HE2  LYS   4           HE2      LYS   4 -33.987   6.683 -16.639
   10    HE3  LYS   4           HE3      LYS   4 -33.968   5.189 -17.577
   11    HZ3  LYS   4           HZ1      LYS   4 -35.502   4.214 -16.027
   12    HZ2  LYS   4           HZ2      LYS   4 -36.139   5.662 -16.648
   13    HZ1  LYS   4           HZ3      LYS   4 -35.495   5.622 -15.077

  No H/Q in entry =          13
  In of MODEL   88
    1    H    HIS   5           H        HIS   5 -28.957   4.944 -14.434
    2    HA   HIS   5           HA       HIS   5 -26.566   3.248 -14.705
    3    HB2  HIS   5           HB2      HIS   5 -26.997   6.007 -13.560
    4    HB3  HIS   5           HB3      HIS   5 -25.461   5.144 -13.509
    5    HD1  HIS   5           HD1      HIS   5 -24.048   6.396 -15.108
    6    HD2  HIS   5           HD2      HIS   5 -27.789   5.519 -16.686
    7    HE1  HIS   5           HE1      HIS   5 -23.888   6.936 -17.568
    8    HE2  HIS   5           HE2      HIS   5 -26.168   6.389 -18.499

  No H/Q in entry =           8
  In of MODEL   88
    1    H    ILE   6           H        ILE   6 -26.258   1.719 -13.353
    2    HA   ILE   6           HA       ILE   6 -27.277   1.985 -10.606
    3    HB   ILE   6           HB       ILE   6 -26.292  -0.459 -12.084
    4   HG12  ILE   6          HG12      ILE   6 -29.095   0.331 -11.278
    5   HG13  ILE   6          HG13      ILE   6 -28.445   0.496 -12.910
    6   HG23  ILE   6          HG21      ILE   6 -26.611  -1.694 -10.201
    7   HG22  ILE   6          HG22      ILE   6 -27.840  -0.605  -9.557
    8   HG21  ILE   6          HG23      ILE   6 -26.135  -0.165  -9.458
    9   HD13  ILE   6          HD11      ILE   6 -28.774  -1.655 -13.370
   10   HD12  ILE   6          HD12      ILE   6 -29.804  -1.670 -11.938
   11   HD11  ILE   6          HD13      ILE   6 -28.119  -2.176 -11.818

  No H/Q in entry =          11
  In of MODEL   88
    1    H    TYR   7           H        TYR   7 -25.573   2.754  -9.316
    2    HA   TYR   7           HA       TYR   7 -22.803   1.945  -9.948
    3    HB2  TYR   7           HB2      TYR   7 -23.923   4.347  -8.529
    4    HB3  TYR   7           HB3      TYR   7 -22.211   3.932  -8.540
    5    HD1  TYR   7           HD1      TYR   7 -23.161   2.867 -11.620
    6    HD2  TYR   7           HD2      TYR   7 -22.725   6.517  -9.462
    7    HE1  TYR   7           HE1      TYR   7 -22.779   4.076 -13.732
    8    HE2  TYR   7           HE2      TYR   7 -22.384   7.730 -11.567
    9    HH   TYR   7           HH       TYR   7 -22.574   7.586 -13.799

  No H/Q in entry =           9
  In of MODEL   88
    1    H    LEU   8           H        LEU   8 -21.775   0.678  -8.583
    2    HA   LEU   8           HA       LEU   8 -22.903   0.173  -5.901
    3    HB2  LEU   8           HB2      LEU   8 -21.087  -1.424  -7.682
    4    HB3  LEU   8           HB3      LEU   8 -21.268  -1.782  -5.965
    5    HG   LEU   8           HG       LEU   8 -23.730  -2.107  -6.408
    6   HD13  LEU   8          HD11      LEU   8 -23.908  -0.944  -8.544
    7   HD12  LEU   8          HD12      LEU   8 -24.337  -2.640  -8.755
    8   HD11  LEU   8          HD13      LEU   8 -22.756  -2.060  -9.274
    9   HD23  LEU   8          HD21      LEU   8 -22.320  -4.104  -8.046
   10   HD22  LEU   8          HD22      LEU   8 -23.411  -4.307  -6.675
   11   HD21  LEU   8          HD23      LEU   8 -21.730  -3.850  -6.404

  No H/Q in entry =          11
  In of MODEL   88
    1    H    PHE   9           H        PHE   9 -21.677   0.665  -4.113
    2    HA   PHE   9           HA       PHE   9 -18.938   1.744  -4.595
    3    HB2  PHE   9           HB2      PHE   9 -21.032   2.743  -2.667
    4    HB3  PHE   9           HB3      PHE   9 -19.353   3.266  -2.667
    5    HD1  PHE   9           HD1      PHE   9 -18.454   4.635  -4.460
    6    HD2  PHE   9           HD2      PHE   9 -22.556   3.379  -4.493
    7    HE1  PHE   9           HE1      PHE   9 -18.937   6.260  -6.265
    8    HE2  PHE   9           HE2      PHE   9 -23.042   5.016  -6.293
    9    HZ   PHE   9           HZ       PHE   9 -21.230   6.453  -7.186

  No H/Q in entry =           9
  In of MODEL   88
    1    H    SER  10           H        SER  10 -17.313   0.949  -3.399
    2    HA   SER  10           HA       SER  10 -17.524   0.088  -0.706
    3    HB2  SER  10           HB2      SER  10 -17.230  -2.283  -0.951
    4    HB3  SER  10           HB3      SER  10 -18.649  -1.825  -1.880
    5    HG   SER  10           HG       SER  10 -16.031  -2.087  -2.929

  No H/Q in entry =           5
  In of MODEL   88
    1    H    SER  11           H        SER  11 -15.520   0.229   0.169
    2    HA   SER  11           HA       SER  11 -13.354   1.188  -1.343
    3    HB2  SER  11           HB2      SER  11 -13.906   1.270   1.237
    4    HB3  SER  11           HB3      SER  11 -12.854  -0.148   1.268
    5    HG   SER  11           HG       SER  11 -11.218   1.064   0.413

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ALA  12           H        ALA  12 -14.396  -1.521  -2.175
    2    HA   ALA  12           HA       ALA  12 -11.769  -2.683  -2.642
    3    HB1  ALA  12           HB1      ALA  12 -13.901  -4.070  -1.044
    4    HB2  ALA  12           HB2      ALA  12 -12.170  -3.964  -0.731
    5    HB3  ALA  12           HB3      ALA  12 -12.768  -5.002  -2.025

  No H/Q in entry =           5
  In of MODEL   88
    1    H    GLY  13           H        GLY  13 -12.585  -1.701  -4.691
    2    HA3  GLY  13           HA2      GLY  13 -14.761  -2.539  -6.181
    3    HA2  GLY  13           HA3      GLY  13 -13.227  -2.015  -6.889

  No H/Q in entry =           3
  In of MODEL   88
    1    H    MET  14           H        MET  14 -11.685  -4.264  -5.760
    2    HA   MET  14           HA       MET  14 -11.931  -6.051  -7.904
    3    HB2  MET  14           HB2      MET  14  -9.876  -5.959  -6.566
    4    HB3  MET  14           HB3      MET  14 -10.710  -6.692  -5.195
    5    HG2  MET  14           HG2      MET  14 -11.148  -8.714  -6.576
    6    HG3  MET  14           HG3      MET  14 -10.275  -7.973  -7.917
    7    HE1  MET  14           HE1      MET  14  -8.127  -7.238  -7.987
    8    HE3  MET  14           HE2      MET  14  -6.730  -7.886  -7.131
    9    HE2  MET  14           HE3      MET  14  -7.630  -6.538  -6.439

  No H/Q in entry =           9
  In of MODEL   88
    1    H    SER  15           H        SER  15 -13.174  -6.491  -4.601
    2    HA   SER  15           HA       SER  15 -14.373  -9.038  -5.234
    3    HB2  SER  15           HB2      SER  15 -14.840  -7.193  -2.881
    4    HB3  SER  15           HB3      SER  15 -15.691  -8.719  -3.107
    5    HG   SER  15           HG       SER  15 -12.996  -8.962  -3.480

  No H/Q in entry =           5
  In of MODEL   88
    1    H    THR  16           H        THR  16 -15.601  -5.704  -5.037
    2    HA   THR  16           HA       THR  16 -18.359  -6.345  -5.614
    3    HB   THR  16           HB       THR  16 -16.899  -3.734  -6.152
    4    HG1  THR  16           HG1      THR  16 -17.152  -4.991  -3.863
    5   HG21  THR  16          HG21      THR  16 -19.298  -4.180  -6.981
    6   HG23  THR  16          HG22      THR  16 -19.041  -2.724  -6.005
    7   HG22  THR  16          HG23      THR  16 -19.750  -4.175  -5.282

  No H/Q in entry =           7
  In of MODEL   88
    1    H    SER  17           H        SER  17 -15.488  -5.693  -7.428
    2    HA   SER  17           HA       SER  17 -16.628  -5.072  -9.957
    3    HB2  SER  17           HB2      SER  17 -13.932  -6.197  -9.176
    4    HB3  SER  17           HB3      SER  17 -14.374  -5.875 -10.853
    5    HG   SER  17           HG       SER  17 -14.721  -3.875  -8.921

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LEU  18           H        LEU  18 -15.892  -8.147  -8.435
    2    HA   LEU  18           HA       LEU  18 -16.360  -9.728 -10.765
    3    HB2  LEU  18           HB2      LEU  18 -15.108 -10.571  -8.824
    4    HB3  LEU  18           HB3      LEU  18 -16.563 -10.449  -7.836
    5    HG   LEU  18           HG       LEU  18 -17.671 -12.126  -9.219
    6   HD11  LEU  18          HD11      LEU  18 -15.148 -11.857 -10.822
    7   HD13  LEU  18          HD12      LEU  18 -16.822 -11.890 -11.378
    8   HD12  LEU  18          HD13      LEU  18 -16.044 -13.374 -10.832
    9   HD21  LEU  18          HD21      LEU  18 -14.964 -12.890  -8.176
   10   HD23  LEU  18          HD22      LEU  18 -16.210 -14.046  -8.652
   11   HD22  LEU  18          HD23      LEU  18 -16.508 -12.929  -7.322

  No H/Q in entry =          11
  In of MODEL   88
    1    H    LEU  19           H        LEU  19 -18.429  -8.584  -8.101
    2    HA   LEU  19           HA       LEU  19 -20.808  -9.929  -8.934
    3    HB2  LEU  19           HB2      LEU  19 -20.631  -9.044  -6.701
    4    HB3  LEU  19           HB3      LEU  19 -20.407  -7.411  -7.328
    5    HG   LEU  19           HG       LEU  19 -22.753  -7.459  -8.151
    6   HD12  LEU  19          HD11      LEU  19 -22.894 -10.019  -6.546
    7   HD11  LEU  19          HD12      LEU  19 -23.009  -9.905  -8.301
    8   HD13  LEU  19          HD13      LEU  19 -24.259  -9.184  -7.290
    9   HD22  LEU  19          HD21      LEU  19 -22.311  -6.325  -6.130
   10   HD21  LEU  19          HD22      LEU  19 -22.173  -7.835  -5.227
   11   HD23  LEU  19          HD23      LEU  19 -23.743  -7.314  -5.840

  No H/Q in entry =          11
  In of MODEL   88
    1    H    VAL  20           H        VAL  20 -19.494  -6.699  -9.681
    2    HA   VAL  20           HA       VAL  20 -21.645  -5.818 -11.294
    3    HB   VAL  20           HB       VAL  20 -18.695  -5.051 -11.388
    4   HG13  VAL  20          HG11      VAL  20 -19.616  -4.601 -13.586
    5   HG12  VAL  20          HG12      VAL  20 -19.462  -3.075 -12.717
    6   HG11  VAL  20          HG13      VAL  20 -21.041  -3.844 -12.877
    7   HG23  VAL  20          HG21      VAL  20 -19.632  -2.918 -10.421
    8   HG22  VAL  20          HG22      VAL  20 -19.666  -4.329  -9.366
    9   HG21  VAL  20          HG23      VAL  20 -21.141  -3.797 -10.176

  No H/Q in entry =           9
  In of MODEL   88
    1    H    SER  21           H        SER  21 -18.757  -7.721 -12.248
    2    HA   SER  21           HA       SER  21 -19.514  -7.713 -15.009
    3    HB2  SER  21           HB2      SER  21 -17.960  -9.598 -15.284
    4    HB3  SER  21           HB3      SER  21 -17.218  -8.286 -14.372
    5    HG   SER  21           HG       SER  21 -16.907  -9.639 -12.848

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LYS  22           H        LYS  22 -20.479  -9.905 -12.403
    2    HA   LYS  22           HA       LYS  22 -21.898 -11.650 -14.207
    3    HB2  LYS  22           HB2      LYS  22 -21.108 -12.202 -11.828
    4    HB3  LYS  22           HB3      LYS  22 -22.529 -11.308 -11.287
    5    HG2  LYS  22           HG2      LYS  22 -23.245 -13.511 -11.252
    6    HG3  LYS  22           HG3      LYS  22 -23.855 -12.917 -12.796
    7    HD2  LYS  22           HD2      LYS  22 -21.877 -13.917 -13.914
    8    HD3  LYS  22           HD3      LYS  22 -21.382 -14.593 -12.361
    9    HE2  LYS  22           HE2      LYS  22 -23.997 -15.198 -13.758
   10    HE3  LYS  22           HE3      LYS  22 -22.569 -16.232 -13.800
   11    HZ1  LYS  22           HZ1      LYS  22 -23.758 -15.465 -11.224
   12    HZ3  LYS  22           HZ2      LYS  22 -22.829 -16.831 -11.616
   13    HZ2  LYS  22           HZ3      LYS  22 -24.443 -16.725 -12.134

  No H/Q in entry =          13
  In of MODEL   88
    1    H    MET  23           H        MET  23 -22.813  -8.738 -12.408
    2    HA   MET  23           HA       MET  23 -25.606  -8.991 -12.943
    3    HB2  MET  23           HB2      MET  23 -23.903  -6.568 -12.399
    4    HB3  MET  23           HB3      MET  23 -25.653  -6.504 -12.599
    5    HG2  MET  23           HG2      MET  23 -25.991  -7.787 -10.608
    6    HG3  MET  23           HG3      MET  23 -24.261  -8.096 -10.454
    7    HE2  MET  23           HE1      MET  23 -26.782  -4.561  -9.368
    8    HE1  MET  23           HE2      MET  23 -26.962  -5.572 -10.800
    9    HE3  MET  23           HE3      MET  23 -26.011  -4.089 -10.883

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ARG  24           H        ARG  24 -22.918  -7.441 -14.726
    2    HA   ARG  24           HA       ARG  24 -24.464  -6.271 -16.768
    3    HB2  ARG  24           HB2      ARG  24 -21.582  -7.222 -16.714
    4    HB3  ARG  24           HB3      ARG  24 -22.281  -6.441 -18.112
    5    HG2  ARG  24           HG2      ARG  24 -22.691  -4.370 -16.792
    6    HG3  ARG  24           HG3      ARG  24 -21.998  -5.176 -15.359
    7    HD2  ARG  24           HD2      ARG  24 -19.876  -5.546 -16.601
    8    HD3  ARG  24           HD3      ARG  24 -20.576  -4.734 -17.996
    9    HE   ARG  24           HE       ARG  24 -20.164  -3.218 -15.570
   10   HH21  ARG  24          HH11      ARG  24 -20.466  -1.064 -16.140
   11   HH22  ARG  24          HH12      ARG  24 -19.966  -0.513 -17.702
   12   HH11  ARG  24          HH21      ARG  24 -19.381  -3.825 -18.806
   13   HH12  ARG  24          HH22      ARG  24 -19.316  -2.153 -19.268

  No H/Q in entry =          13
  In of MODEL   88
    1    H    ALA  25           H        ALA  25 -23.156  -9.533 -16.411
    2    HA   ALA  25           HA       ALA  25 -23.704 -10.451 -19.037
    3    HB1  ALA  25           HB1      ALA  25 -22.902 -12.426 -18.293
    4    HB3  ALA  25           HB2      ALA  25 -23.976 -12.437 -16.894
    5    HB2  ALA  25           HB3      ALA  25 -22.471 -11.523 -16.841

  No H/Q in entry =           5
  In of MODEL   88
    1    H    GLN  26           H        GLN  26 -25.562 -10.534 -16.034
    2    HA   GLN  26           HA       GLN  26 -27.822 -11.888 -17.052
    3    HB2  GLN  26           HB2      GLN  26 -27.438 -10.068 -14.696
    4    HB3  GLN  26           HB3      GLN  26 -28.953 -10.885 -15.048
    5    HG2  GLN  26           HG2      GLN  26 -26.294 -12.183 -14.521
    6    HG3  GLN  26           HG3      GLN  26 -27.672 -12.136 -13.428
    7   HE21  GLN  26          HE21      GLN  26 -26.319 -14.252 -14.647
    8   HE22  GLN  26          HE22      GLN  26 -27.291 -15.372 -15.434

  No H/Q in entry =           8
  In of MODEL   88
    1    H    ALA  27           H        ALA  27 -27.085  -8.435 -16.718
    2    HA   ALA  27           HA       ALA  27 -29.623  -7.501 -17.552
    3    HB1  ALA  27           HB1      ALA  27 -27.903  -6.064 -16.443
    4    HB3  ALA  27           HB2      ALA  27 -28.518  -5.362 -17.940
    5    HB2  ALA  27           HB3      ALA  27 -26.936  -6.140 -17.917

  No H/Q in entry =           5
  In of MODEL   88
    1    H    GLU  28           H        GLU  28 -26.834  -8.605 -19.366
    2    HA   GLU  28           HA       GLU  28 -27.795  -7.668 -21.916
    3    HB2  GLU  28           HB2      GLU  28 -25.389  -8.204 -21.251
    4    HB3  GLU  28           HB3      GLU  28 -25.838  -9.900 -21.427
    5    HG2  GLU  28           HG2      GLU  28 -24.713  -9.097 -23.398
    6    HG3  GLU  28           HG3      GLU  28 -26.385  -9.522 -23.758

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LYS  29           H        LYS  29 -27.807 -10.746 -20.200
    2    HA   LYS  29           HA       LYS  29 -29.000 -12.325 -22.191
    3    HB2  LYS  29           HB2      LYS  29 -27.923 -13.210 -20.155
    4    HB3  LYS  29           HB3      LYS  29 -29.244 -12.558 -19.189
    5    HG2  LYS  29           HG2      LYS  29 -30.811 -14.042 -20.249
    6    HG3  LYS  29           HG3      LYS  29 -29.565 -14.629 -21.347
    7    HD2  LYS  29           HD2      LYS  29 -28.380 -15.696 -19.578
    8    HD3  LYS  29           HD3      LYS  29 -29.349 -14.884 -18.350
    9    HE2  LYS  29           HE2      LYS  29 -29.963 -17.278 -18.675
   10    HE3  LYS  29           HE3      LYS  29 -31.303 -16.165 -18.956
   11    HZ1  LYS  29           HZ1      LYS  29 -30.702 -16.312 -21.374
   12    HZ3  LYS  29           HZ2      LYS  29 -31.351 -17.724 -20.690
   13    HZ2  LYS  29           HZ3      LYS  29 -29.681 -17.608 -20.969

  No H/Q in entry =          13
  In of MODEL   88
    1    H    TYR  30           H        TYR  30 -30.539 -10.255 -19.743
    2    HA   TYR  30           HA       TYR  30 -33.157 -10.878 -21.006
    3    HB2  TYR  30           HB2      TYR  30 -32.604  -9.639 -18.300
    4    HB3  TYR  30           HB3      TYR  30 -34.196  -9.999 -18.966
    5    HD1  TYR  30           HD1      TYR  30 -34.973 -12.342 -19.145
    6    HD2  TYR  30           HD2      TYR  30 -31.207 -11.373 -17.413
    7    HE1  TYR  30           HE1      TYR  30 -34.762 -14.646 -18.303
    8    HE2  TYR  30           HE2      TYR  30 -30.997 -13.663 -16.575
    9    HH   TYR  30           HH       TYR  30 -32.487 -16.132 -17.640

  No H/Q in entry =           9
  In of MODEL   88
    1    H    GLU  31           H        GLU  31 -31.097  -8.782 -21.820
    2    HA   GLU  31           HA       GLU  31 -31.136  -6.640 -22.683
    3    HB2  GLU  31           HB2      GLU  31 -33.979  -7.528 -23.213
    4    HB3  GLU  31           HB3      GLU  31 -33.208  -6.128 -23.960
    5    HG2  GLU  31           HG2      GLU  31 -31.643  -7.502 -25.107
    6    HG3  GLU  31           HG3      GLU  31 -32.137  -8.929 -24.198

  No H/Q in entry =           6
  In of MODEL   88
    1    H    VAL  32           H        VAL  32 -31.373  -6.499 -19.956
    2    HA   VAL  32           HA       VAL  32 -33.361  -4.484 -19.358
    3    HB   VAL  32           HB       VAL  32 -30.936  -5.310 -17.732
    4   HG12  VAL  32          HG11      VAL  32 -32.539  -4.540 -15.869
    5   HG11  VAL  32          HG12      VAL  32 -33.407  -3.709 -17.161
    6   HG13  VAL  32          HG13      VAL  32 -31.724  -3.301 -16.827
    7   HG21  VAL  32          HG21      VAL  32 -32.594  -7.141 -18.407
    8   HG23  VAL  32          HG22      VAL  32 -33.694  -6.354 -17.275
    9   HG22  VAL  32          HG23      VAL  32 -32.145  -6.978 -16.710

  No H/Q in entry =           9
  In of MODEL   88
    1    HA   PRO  33           HA       PRO  33 -30.482  -1.417 -21.054
    2    HB2  PRO  33           HB2      PRO  33 -32.120   0.716 -20.989
    3    HB3  PRO  33           HB3      PRO  33 -32.499  -0.631 -22.063
    4    HG2  PRO  33           HG2      PRO  33 -33.530  -0.120 -19.273
    5    HG3  PRO  33           HG3      PRO  33 -34.464  -0.410 -20.740
    6    HD2  PRO  33           HD2      PRO  33 -33.909  -2.423 -19.030
    7    HD3  PRO  33           HD3      PRO  33 -33.936  -2.698 -20.772

  No H/Q in entry =           7
  In of MODEL   88
    1    H    VAL  34           H        VAL  34 -29.213  -1.852 -19.081
    2    HA   VAL  34           HA       VAL  34 -29.090   0.616 -17.477
    3    HB   VAL  34           HB       VAL  34 -28.449  -0.774 -15.505
    4   HG12  VAL  34          HG11      VAL  34 -30.810  -1.780 -15.208
    5   HG11  VAL  34          HG12      VAL  34 -31.151  -1.068 -16.784
    6   HG13  VAL  34          HG13      VAL  34 -30.673  -0.036 -15.435
    7   HG21  VAL  34          HG21      VAL  34 -28.492  -2.843 -17.477
    8   HG23  VAL  34          HG22      VAL  34 -29.542  -3.240 -16.116
    9   HG22  VAL  34          HG23      VAL  34 -27.847  -2.848 -15.835

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ILE  35           H        ILE  35 -27.153   1.181 -16.623
    2    HA   ILE  35           HA       ILE  35 -24.760  -0.033 -17.836
    3    HB   ILE  35           HB       ILE  35 -25.338   2.842 -17.084
    4   HG12  ILE  35          HG12      ILE  35 -24.250   1.549 -19.592
    5   HG13  ILE  35          HG13      ILE  35 -25.917   2.078 -19.362
    6   HG21  ILE  35          HG21      ILE  35 -22.687   1.458 -17.336
    7   HG23  ILE  35          HG22      ILE  35 -23.224   2.630 -16.134
    8   HG22  ILE  35          HG23      ILE  35 -22.854   3.156 -17.777
    9   HD11  ILE  35          HD11      ILE  35 -24.653   4.361 -18.787
   10   HD13  ILE  35          HD12      ILE  35 -25.147   3.917 -20.422
   11   HD12  ILE  35          HD13      ILE  35 -23.483   3.655 -19.901

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ILE  36           H        ILE  36 -23.491  -0.953 -16.203
    2    HA   ILE  36           HA       ILE  36 -24.001  -0.314 -13.351
    3    HB   ILE  36           HB       ILE  36 -23.003  -2.982 -14.399
    4   HG12  ILE  36          HG12      ILE  36 -25.862  -2.330 -13.680
    5   HG13  ILE  36          HG13      ILE  36 -25.272  -2.306 -15.343
    6   HG23  ILE  36          HG21      ILE  36 -23.330  -3.792 -12.273
    7   HG22  ILE  36          HG22      ILE  36 -24.536  -2.569 -11.871
    8   HG21  ILE  36          HG23      ILE  36 -22.827  -2.138 -11.929
    9   HD13  ILE  36          HD11      ILE  36 -25.306  -4.529 -15.508
   10   HD12  ILE  36          HD12      ILE  36 -26.393  -4.445 -14.123
   11   HD11  ILE  36          HD13      ILE  36 -24.676  -4.760 -13.877

  No H/Q in entry =          11
  In of MODEL   88
    1    H    GLU  37           H        GLU  37 -22.273   0.440 -12.238
    2    HA   GLU  37           HA       GLU  37 -19.530  -0.213 -13.110
    3    HB2  GLU  37           HB2      GLU  37 -20.597   2.532 -12.471
    4    HB3  GLU  37           HB3      GLU  37 -18.881   2.136 -12.579
    5    HG2  GLU  37           HG2      GLU  37 -19.120   1.631 -14.927
    6    HG3  GLU  37           HG3      GLU  37 -20.853   1.941 -14.837

  No H/Q in entry =           6
  In of MODEL   88
    1    H    ALA  38           H        ALA  38 -18.051  -0.332 -11.407
    2    HA   ALA  38           HA       ALA  38 -19.124  -0.164  -8.652
    3    HB1  ALA  38           HB1      ALA  38 -17.282  -2.023 -10.022
    4    HB3  ALA  38           HB2      ALA  38 -18.333  -2.296  -8.631
    5    HB2  ALA  38           HB3      ALA  38 -16.766  -1.514  -8.413

  No H/Q in entry =           5
  In of MODEL   88
    1    H    PHE  39           H        PHE  39 -17.976   1.144  -7.188
    2    HA   PHE  39           HA       PHE  39 -15.517   2.479  -8.080
    3    HB2  PHE  39           HB2      PHE  39 -17.925   3.903  -6.939
    4    HB3  PHE  39           HB3      PHE  39 -16.346   4.634  -7.216
    5    HD1  PHE  39           HD1      PHE  39 -15.515   4.947  -9.513
    6    HD2  PHE  39           HD2      PHE  39 -19.482   3.621  -8.688
    7    HE1  PHE  39           HE1      PHE  39 -16.186   5.563 -11.817
    8    HE2  PHE  39           HE2      PHE  39 -20.166   4.224 -10.982
    9    HZ   PHE  39           HZ       PHE  39 -18.518   5.166 -12.563

  No H/Q in entry =           9
  In of MODEL   88
    1    HA   PRO  40           HA       PRO  40 -14.586   1.862  -3.769
    2    HB2  PRO  40           HB2      PRO  40 -12.952   3.993  -3.184
    3    HB3  PRO  40           HB3      PRO  40 -12.415   2.669  -4.219
    4    HG2  PRO  40           HG2      PRO  40 -13.593   5.323  -5.032
    5    HG3  PRO  40           HG3      PRO  40 -12.112   4.556  -5.607
    6    HD2  PRO  40           HD2      PRO  40 -14.309   4.312  -7.034
    7    HD3  PRO  40           HD3      PRO  40 -13.271   2.905  -6.807

  No H/Q in entry =           7
  In of MODEL   88
    1    H    GLU  41           H        GLU  41 -15.291   2.838  -1.666
    2    HA   GLU  41           HA       GLU  41 -17.635   4.401  -1.706
    3    HB2  GLU  41           HB2      GLU  41 -17.265   4.579   0.762
    4    HB3  GLU  41           HB3      GLU  41 -17.236   2.930   0.139
    5    HG2  GLU  41           HG2      GLU  41 -15.477   2.906   1.621
    6    HG3  GLU  41           HG3      GLU  41 -14.662   3.255   0.096

  No H/Q in entry =           6
  In of MODEL   88
    1    H    THR  42           H        THR  42 -14.367   5.520  -1.739
    2    HA   THR  42           HA       THR  42 -14.890   8.075  -0.580
    3    HB   THR  42           HB       THR  42 -12.758   8.762  -1.646
    4    HG1  THR  42           HG1      THR  42 -12.625   7.741  -3.533
    5   HG21  THR  42          HG21      THR  42 -12.693   5.997  -0.409
    6   HG23  THR  42          HG22      THR  42 -12.689   7.524   0.475
    7   HG22  THR  42          HG23      THR  42 -11.316   7.091  -0.542

  No H/Q in entry =           7
  In of MODEL   88
    1    H    LEU  43           H        LEU  43 -15.689   6.871  -3.669
    2    HA   LEU  43           HA       LEU  43 -16.100   9.604  -4.694
    3    HB2  LEU  43           HB2      LEU  43 -16.276   6.913  -6.038
    4    HB3  LEU  43           HB3      LEU  43 -16.587   8.458  -6.827
    5    HG   LEU  43           HG       LEU  43 -13.916   7.559  -5.772
    6   HD11  LEU  43          HD11      LEU  43 -14.975   6.397  -7.845
    7   HD13  LEU  43          HD12      LEU  43 -13.319   6.993  -7.941
    8   HD12  LEU  43          HD13      LEU  43 -14.631   7.926  -8.655
    9   HD22  LEU  43          HD21      LEU  43 -13.919   9.901  -5.716
   10   HD21  LEU  43          HD22      LEU  43 -14.910  10.029  -7.170
   11   HD23  LEU  43          HD23      LEU  43 -13.225   9.527  -7.293

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ALA  44           H        ALA  44 -17.951   7.696  -2.827
    2    HA   ALA  44           HA       ALA  44 -20.400   7.379  -4.173
    3    HB2  ALA  44           HB1      ALA  44 -20.218   6.313  -2.054
    4    HB3  ALA  44           HB2      ALA  44 -21.409   7.591  -1.820
    5    HB1  ALA  44           HB3      ALA  44 -19.755   7.813  -1.251

  No H/Q in entry =           5
  In of MODEL   88
    1    H    GLY  45           H        GLY  45 -19.174  10.290  -2.679
    2    HA3  GLY  45           HA2      GLY  45 -21.694  11.629  -3.095
    3    HA2  GLY  45           HA3      GLY  45 -20.198  12.358  -2.514

  No H/Q in entry =           3
  In of MODEL   88
    1    H    GLU  46           H        GLU  46 -18.585  11.476  -4.769
    2    HA   GLU  46           HA       GLU  46 -19.336  13.615  -6.588
    3    HB2  GLU  46           HB2      GLU  46 -17.016  11.682  -6.523
    4    HB3  GLU  46           HB3      GLU  46 -17.216  12.938  -7.744
    5    HG2  GLU  46           HG2      GLU  46 -17.038  14.656  -6.056
    6    HG3  GLU  46           HG3      GLU  46 -16.938  13.434  -4.787

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LYS  47           H        LYS  47 -18.995  10.103  -6.954
    2    HA   LYS  47           HA       LYS  47 -20.072  10.204  -9.644
    3    HB2  LYS  47           HB2      LYS  47 -18.767   8.230  -7.930
    4    HB3  LYS  47           HB3      LYS  47 -20.122   7.564  -8.841
    5    HG2  LYS  47           HG2      LYS  47 -18.144   7.218 -10.107
    6    HG3  LYS  47           HG3      LYS  47 -19.081   8.479 -10.905
    7    HD2  LYS  47           HD2      LYS  47 -17.691  10.192  -9.883
    8    HD3  LYS  47           HD3      LYS  47 -16.778   8.955  -9.020
    9    HE2  LYS  47           HE2      LYS  47 -16.020   8.023 -11.142
   10    HE3  LYS  47           HE3      LYS  47 -16.948   9.242 -12.014
   11    HZ2  LYS  47           HZ1      LYS  47 -14.371   9.441 -10.934
   12    HZ1  LYS  47           HZ2      LYS  47 -15.373  10.562 -10.146
   13    HZ3  LYS  47           HZ3      LYS  47 -15.235  10.590 -11.839

  No H/Q in entry =          13
  In of MODEL   88
    1    H    GLY  48           H        GLY  48 -21.384   9.426  -6.496
    2    HA3  GLY  48           HA2      GLY  48 -23.682   8.082  -7.240
    3    HA2  GLY  48           HA3      GLY  48 -23.536   9.114  -5.818

  No H/Q in entry =           3
  In of MODEL   88
    1    H    GLN  49           H        GLN  49 -23.084  11.539  -7.428
    2    HA   GLN  49           HA       GLN  49 -25.706  12.487  -7.622
    3    HB2  GLN  49           HB2      GLN  49 -23.204  13.481  -8.972
    4    HB3  GLN  49           HB3      GLN  49 -24.724  14.356  -8.921
    5    HG2  GLN  49           HG2      GLN  49 -24.595  14.435  -6.484
    6    HG3  GLN  49           HG3      GLN  49 -23.086  13.538  -6.532
    7   HE21  GLN  49          HE21      GLN  49 -23.122  15.794  -5.302
    8   HE22  GLN  49          HE22      GLN  49 -22.271  17.092  -5.964

  No H/Q in entry =           8
  In of MODEL   88
    1    H    ASN  50           H        ASN  50 -23.886  10.670  -9.954
    2    HA   ASN  50           HA       ASN  50 -25.794  11.386 -12.073
    3    HB2  ASN  50           HB2      ASN  50 -23.122  10.003 -12.249
    4    HB3  ASN  50           HB3      ASN  50 -24.181  10.339 -13.611
    5   HD21  ASN  50          HD21      ASN  50 -21.620  11.375 -11.990
    6   HD22  ASN  50          HD22      ASN  50 -21.483  13.015 -12.361

  No H/Q in entry =           6
  In of MODEL   88
    1    H    ALA  51           H        ALA  51 -25.662   9.077  -9.781
    2    HA   ALA  51           HA       ALA  51 -26.292   6.855 -11.575
    3    HB2  ALA  51           HB1      ALA  51 -25.647   5.576  -9.856
    4    HB3  ALA  51           HB2      ALA  51 -26.830   6.334  -8.791
    5    HB1  ALA  51           HB3      ALA  51 -25.230   7.050  -8.983

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ASP  52           H        ASP  52 -28.231   5.681 -11.435
    2    HA   ASP  52           HA       ASP  52 -30.527   7.390 -10.829
    3    HB2  ASP  52           HB2      ASP  52 -30.164   4.871 -12.449
    4    HB3  ASP  52           HB3      ASP  52 -31.756   5.517 -12.044

  No H/Q in entry =           4
  In of MODEL   88
    1    H    VAL  53           H        VAL  53 -28.766   4.624  -9.740
    2    HA   VAL  53           HA       VAL  53 -30.241   4.710  -7.242
    3    HB   VAL  53           HB       VAL  53 -31.523   2.963  -8.470
    4   HG11  VAL  53          HG11      VAL  53 -29.711   2.183  -9.955
    5   HG13  VAL  53          HG12      VAL  53 -30.473   0.856  -9.081
    6   HG12  VAL  53          HG13      VAL  53 -28.903   1.465  -8.562
    7   HG23  VAL  53          HG21      VAL  53 -30.604   1.071  -6.730
    8   HG22  VAL  53          HG22      VAL  53 -31.815   2.312  -6.402
    9   HG21  VAL  53          HG23      VAL  53 -30.126   2.595  -5.979

  No H/Q in entry =           9
  In of MODEL   88
    1    H    VAL  54           H        VAL  54 -28.925   4.388  -5.565
    2    HA   VAL  54           HA       VAL  54 -26.112   3.695  -6.132
    3    HB   VAL  54           HB       VAL  54 -27.313   5.448  -3.928
    4   HG11  VAL  54          HG11      VAL  54 -24.650   4.181  -4.164
    5   HG13  VAL  54          HG12      VAL  54 -25.460   4.840  -2.743
    6   HG12  VAL  54          HG13      VAL  54 -24.605   5.916  -3.849
    7   HG22  VAL  54          HG21      VAL  54 -26.550   7.290  -5.053
    8   HG21  VAL  54          HG22      VAL  54 -27.022   6.243  -6.392
    9   HG23  VAL  54          HG23      VAL  54 -25.325   6.379  -5.935

  No H/Q in entry =           9
  In of MODEL   88
    1    H    LEU  55           H        LEU  55 -25.413   1.825  -5.445
    2    HA   LEU  55           HA       LEU  55 -26.865   0.467  -3.260
    3    HB2  LEU  55           HB2      LEU  55 -25.215  -0.648  -5.516
    4    HB3  LEU  55           HB3      LEU  55 -25.934  -1.602  -4.218
    5    HG   LEU  55           HG       LEU  55 -27.437  -0.143  -6.380
    6   HD13  LEU  55          HD11      LEU  55 -27.013  -1.997  -7.561
    7   HD12  LEU  55          HD12      LEU  55 -27.931  -2.905  -6.360
    8   HD11  LEU  55          HD13      LEU  55 -26.184  -2.732  -6.191
    9   HD23  LEU  55          HD21      LEU  55 -28.635  -2.129  -4.502
   10   HD22  LEU  55          HD22      LEU  55 -29.401  -0.807  -5.384
   11   HD21  LEU  55          HD23      LEU  55 -28.416  -0.463  -3.963

  No H/Q in entry =          11
  In of MODEL   88
    1    H    LEU  56           H        LEU  56 -25.702  -0.023  -1.432
    2    HA   LEU  56           HA       LEU  56 -22.796   0.546  -1.458
    3    HB2  LEU  56           HB2      LEU  56 -24.611   0.273   0.925
    4    HB3  LEU  56           HB3      LEU  56 -22.931   0.803   0.924
    5    HG   LEU  56           HG       LEU  56 -25.314   2.323  -0.097
    6   HD11  LEU  56          HD11      LEU  56 -24.208   2.056   2.442
    7   HD13  LEU  56          HD12      LEU  56 -25.272   3.354   1.899
    8   HD12  LEU  56          HD13      LEU  56 -23.522   3.561   1.829
    9   HD23  LEU  56          HD21      LEU  56 -23.471   4.131  -0.303
   10   HD22  LEU  56          HD22      LEU  56 -23.772   2.988  -1.612
   11   HD21  LEU  56          HD23      LEU  56 -22.413   2.737  -0.518

  No H/Q in entry =          11
  In of MODEL   88
    1    H    GLY  57           H        GLY  57 -21.328  -0.988  -0.876
    2    HA3  GLY  57           HA2      GLY  57 -22.089  -3.728  -1.034
    3    HA2  GLY  57           HA3      GLY  57 -20.503  -3.130  -0.551

  No H/Q in entry =           3
  In of MODEL   88
    1    HA   PRO  58           HA       PRO  58 -23.289  -4.264   3.154
    2    HB2  PRO  58           HB2      PRO  58 -22.458  -6.812   3.818
    3    HB3  PRO  58           HB3      PRO  58 -23.852  -6.505   2.782
    4    HG2  PRO  58           HG2      PRO  58 -21.068  -7.237   2.043
    5    HG3  PRO  58           HG3      PRO  58 -22.595  -7.801   1.364
    6    HD2  PRO  58           HD2      PRO  58 -21.082  -5.915   0.123
    7    HD3  PRO  58           HD3      PRO  58 -22.842  -5.936   0.001

  No H/Q in entry =           7
  In of MODEL   88
    1    H    GLN  59           H        GLN  59 -19.889  -4.547   2.592
    2    HA   GLN  59           HA       GLN  59 -19.167  -4.468   5.361
    3    HB2  GLN  59           HB2      GLN  59 -17.632  -3.640   2.895
    4    HB3  GLN  59           HB3      GLN  59 -16.962  -3.636   4.513
    5    HG2  GLN  59           HG2      GLN  59 -17.965  -6.040   2.998
    6    HG3  GLN  59           HG3      GLN  59 -16.285  -5.620   3.292
    7   HE21  GLN  59          HE21      GLN  59 -18.346  -7.555   4.140
    8   HE22  GLN  59          HE22      GLN  59 -18.186  -8.120   5.696

  No H/Q in entry =           8
  In of MODEL   88
    1    H    ILE  60           H        ILE  60 -20.223  -2.019   3.093
    2    HA   ILE  60           HA       ILE  60 -19.512   0.024   5.109
    3    HB   ILE  60           HB       ILE  60 -19.831   1.701   3.244
    4   HG12  ILE  60          HG12      ILE  60 -19.462  -0.550   1.311
    5   HG13  ILE  60          HG13      ILE  60 -21.088  -0.102   1.827
    6   HG22  ILE  60          HG21      ILE  60 -17.674  -0.257   2.583
    7   HG21  ILE  60          HG22      ILE  60 -17.642   0.732   4.041
    8   HG23  ILE  60          HG23      ILE  60 -17.653   1.501   2.455
    9   HD12  ILE  60          HD11      ILE  60 -19.119   1.464   0.199
   10   HD11  ILE  60          HD12      ILE  60 -20.335   2.315   1.150
   11   HD13  ILE  60          HD13      ILE  60 -20.832   1.173  -0.097

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ALA  61           H        ALA  61 -21.870  -1.702   5.183
    2    HA   ALA  61           HA       ALA  61 -24.186  -0.181   4.668
    3    HB1  ALA  61           HB1      ALA  61 -25.326  -1.715   6.009
    4    HB2  ALA  61           HB2      ALA  61 -23.920  -2.002   7.035
    5    HB3  ALA  61           HB3      ALA  61 -23.960  -2.645   5.392

  No H/Q in entry =           5
  In of MODEL   88
    1    H    TYR  62           H        TYR  62 -22.008  -0.110   7.491
    2    HA   TYR  62           HA       TYR  62 -23.678   1.484   9.112
    3    HB2  TYR  62           HB2      TYR  62 -21.683   2.048  10.362
    4    HB3  TYR  62           HB3      TYR  62 -21.629   0.341   9.923
    5    HD1  TYR  62           HD1      TYR  62 -19.982  -0.483   8.285
    6    HD2  TYR  62           HD2      TYR  62 -20.050   3.630   9.444
    7    HE1  TYR  62           HE1      TYR  62 -17.773  -0.156   7.239
    8    HE2  TYR  62           HE2      TYR  62 -17.827   3.952   8.400
    9    HH   TYR  62           HH       TYR  62 -16.501   1.726   6.286

  No H/Q in entry =           9
  In of MODEL   88
    1    H    MET  63           H        MET  63 -22.055   2.383   6.258
    2    HA   MET  63           HA       MET  63 -22.061   5.233   6.898
    3    HB2  MET  63           HB2      MET  63 -21.339   3.704   4.397
    4    HB3  MET  63           HB3      MET  63 -21.247   5.459   4.551
    5    HG2  MET  63           HG2      MET  63 -19.545   5.227   6.268
    6    HG3  MET  63           HG3      MET  63 -19.644   3.472   6.138
    7    HE3  MET  63           HE1      MET  63 -19.577   6.328   3.213
    8    HE2  MET  63           HE2      MET  63 -17.815   6.399   3.194
    9    HE1  MET  63           HE3      MET  63 -18.693   6.732   4.687

  No H/Q in entry =           9
  In of MODEL   88
    1    H    LEU  64           H        LEU  64 -24.502   3.215   5.942
    2    HA   LEU  64           HA       LEU  64 -25.768   4.521   3.824
    3    HB2  LEU  64           HB2      LEU  64 -26.523   2.385   4.774
    4    HB3  LEU  64           HB3      LEU  64 -27.045   3.228   6.232
    5    HG   LEU  64           HG       LEU  64 -28.796   4.358   4.962
    6   HD13  LEU  64          HD11      LEU  64 -28.501   4.572   2.728
    7   HD12  LEU  64          HD12      LEU  64 -29.050   2.900   2.608
    8   HD11  LEU  64          HD13      LEU  64 -27.325   3.261   2.679
    9   HD23  LEU  64          HD21      LEU  64 -29.142   1.506   4.264
   10   HD22  LEU  64          HD22      LEU  64 -30.204   2.598   5.152
   11   HD21  LEU  64          HD23      LEU  64 -28.795   1.901   5.947

  No H/Q in entry =          11
  In of MODEL   88
    1    HA   PRO  65           HA       PRO  65 -28.158   7.594   6.490
    2    HB2  PRO  65           HB2      PRO  65 -26.195   7.911   8.762
    3    HB3  PRO  65           HB3      PRO  65 -27.948   8.092   8.784
    4    HG2  PRO  65           HG2      PRO  65 -26.901   5.912   9.764
    5    HG3  PRO  65           HG3      PRO  65 -28.305   5.779   8.705
    6    HD2  PRO  65           HD2      PRO  65 -25.395   5.317   8.044
    7    HD3  PRO  65           HD3      PRO  65 -26.794   4.340   7.599

  No H/Q in entry =           7
  In of MODEL   88
    1    H    GLU  66           H        GLU  66 -24.605   7.745   6.601
    2    HA   GLU  66           HA       GLU  66 -24.464  10.547   6.144
    3    HB2  GLU  66           HB2      GLU  66 -22.515   8.335   5.557
    4    HB3  GLU  66           HB3      GLU  66 -22.160  10.046   5.321
    5    HG2  GLU  66           HG2      GLU  66 -22.419  10.449   7.678
    6    HG3  GLU  66           HG3      GLU  66 -22.851   8.760   7.938

  No H/Q in entry =           6
  In of MODEL   88
    1    H    ILE  67           H        ILE  67 -24.384   7.758   3.945
    2    HA   ILE  67           HA       ILE  67 -24.039   9.443   1.624
    3    HB   ILE  67           HB       ILE  67 -24.774   6.494   1.850
    4   HG12  ILE  67          HG12      ILE  67 -22.204   7.793   0.933
    5   HG13  ILE  67          HG13      ILE  67 -22.494   7.390   2.624
    6   HG21  ILE  67          HG21      ILE  67 -24.797   8.330  -0.409
    7   HG23  ILE  67          HG22      ILE  67 -25.329   6.651  -0.333
    8   HG22  ILE  67          HG23      ILE  67 -23.636   7.026  -0.649
    9   HD12  ILE  67          HD11      ILE  67 -21.948   5.601   0.314
   10   HD11  ILE  67          HD12      ILE  67 -22.943   4.997   1.637
   11   HD13  ILE  67          HD13      ILE  67 -21.303   5.560   1.955

  No H/Q in entry =          11
  In of MODEL   88
    1    H    GLN  68           H        GLN  68 -26.864   8.261   3.248
    2    HA   GLN  68           HA       GLN  68 -28.720   9.051   1.238
    3    HB2  GLN  68           HB2      GLN  68 -28.988   8.736   4.225
    4    HB3  GLN  68           HB3      GLN  68 -30.328   9.237   3.206
    5    HG2  GLN  68           HG2      GLN  68 -30.229   7.185   1.970
    6    HG3  GLN  68           HG3      GLN  68 -28.759   6.705   2.798
    7   HE21  GLN  68          HE21      GLN  68 -30.857   5.226   2.667
    8   HE22  GLN  68          HE22      GLN  68 -31.676   4.751   4.082

  No H/Q in entry =           8
  In of MODEL   88
    1    H    ARG  69           H        ARG  69 -27.239  10.855   3.958
    2    HA   ARG  69           HA       ARG  69 -28.733  13.251   3.490
    3    HB2  ARG  69           HB2      ARG  69 -26.358  12.480   5.120
    4    HB3  ARG  69           HB3      ARG  69 -26.527  14.186   4.728
    5    HG2  ARG  69           HG2      ARG  69 -28.854  14.120   5.675
    6    HG3  ARG  69           HG3      ARG  69 -28.559  12.454   6.183
    7    HD2  ARG  69           HD2      ARG  69 -27.007  14.914   7.068
    8    HD3  ARG  69           HD3      ARG  69 -28.096  13.967   8.069
    9    HE   ARG  69           HE       ARG  69 -25.427  13.162   7.163
   10   HH21  ARG  69          HH11      ARG  69 -24.537  11.468   8.401
   11   HH22  ARG  69          HH12      ARG  69 -25.532  10.618   9.535
   12   HH11  ARG  69          HH21      ARG  69 -28.368  12.487   8.841
   13   HH12  ARG  69          HH22      ARG  69 -27.701  11.192   9.783

  No H/Q in entry =          13
  In of MODEL   88
    1    H    LEU  70           H        LEU  70 -25.775  11.977   2.186
    2    HA   LEU  70           HA       LEU  70 -24.778  14.376   0.984
    3    HB2  LEU  70           HB2      LEU  70 -23.667  12.128   1.633
    4    HB3  LEU  70           HB3      LEU  70 -24.238  11.599   0.051
    5    HG   LEU  70           HG       LEU  70 -22.709  13.036  -1.044
    6   HD11  LEU  70          HD11      LEU  70 -21.964  13.975   1.735
    7   HD13  LEU  70          HD12      LEU  70 -22.701  14.945   0.460
    8   HD12  LEU  70          HD13      LEU  70 -21.052  14.349   0.269
    9   HD22  LEU  70          HD21      LEU  70 -21.189  11.403  -0.765
   10   HD21  LEU  70          HD22      LEU  70 -22.101  10.858   0.643
   11   HD23  LEU  70          HD23      LEU  70 -20.778  12.008   0.840

  No H/Q in entry =          11
  In of MODEL   88
    1    H    LEU  71           H        LEU  71 -26.779  11.701  -0.103
    2    HA   LEU  71           HA       LEU  71 -27.356  13.111  -2.653
    3    HB2  LEU  71           HB2      LEU  71 -27.408  10.129  -2.151
    4    HB3  LEU  71           HB3      LEU  71 -27.565  10.952  -3.702
    5    HG   LEU  71           HG       LEU  71 -25.068  11.130  -2.017
    6   HD12  LEU  71          HD11      LEU  71 -25.008   9.456  -4.417
    7   HD11  LEU  71          HD12      LEU  71 -25.999   8.804  -3.113
    8   HD13  LEU  71          HD13      LEU  71 -24.299   9.180  -2.826
    9   HD22  LEU  71          HD21      LEU  71 -25.249  12.910  -3.546
   10   HD21  LEU  71          HD22      LEU  71 -25.677  11.818  -4.863
   11   HD23  LEU  71          HD23      LEU  71 -24.058  11.769  -4.167

  No H/Q in entry =          11
  In of MODEL   88
    1    HA   PRO  72           HA       PRO  72 -31.222  12.510  -0.061
    2    HB2  PRO  72           HB2      PRO  72 -32.209  15.020  -0.201
    3    HB3  PRO  72           HB3      PRO  72 -30.891  14.658   0.912
    4    HG2  PRO  72           HG2      PRO  72 -30.737  15.808  -1.863
    5    HG3  PRO  72           HG3      PRO  72 -30.016  16.426  -0.377
    6    HD2  PRO  72           HD2      PRO  72 -28.581  14.906  -2.099
    7    HD3  PRO  72           HD3      PRO  72 -28.337  14.786  -0.358

  No H/Q in entry =           7
  In of MODEL   88
    1    H    ASN  73           H        ASN  73 -30.613  13.435  -3.288
    2    HA   ASN  73           HA       ASN  73 -33.447  12.968  -3.942
    3    HB2  ASN  73           HB2      ASN  73 -33.016  14.057  -6.056
    4    HB3  ASN  73           HB3      ASN  73 -32.559  15.088  -4.708
    5   HD21  ASN  73          HD21      ASN  73 -31.738  15.123  -7.378
    6   HD22  ASN  73          HD22      ASN  73 -30.061  15.043  -7.551

  No H/Q in entry =           6
  In of MODEL   88
    1    H    LYS  74           H        LYS  74 -31.359  10.825  -3.454
    2    HA   LYS  74           HA       LYS  74 -31.828   9.356  -5.980
    3    HB2  LYS  74           HB2      LYS  74 -29.302   9.222  -4.329
    4    HB3  LYS  74           HB3      LYS  74 -29.628   8.363  -5.835
    5    HG2  LYS  74           HG2      LYS  74 -29.514  11.346  -5.687
    6    HG3  LYS  74           HG3      LYS  74 -28.085  10.348  -5.958
    7    HD2  LYS  74           HD2      LYS  74 -29.133   9.329  -7.893
    8    HD3  LYS  74           HD3      LYS  74 -30.605  10.260  -7.607
    9    HE2  LYS  74           HE2      LYS  74 -29.476  12.316  -8.075
   10    HE3  LYS  74           HE3      LYS  74 -27.912  11.503  -8.135
   11    HZ2  LYS  74           HZ1      LYS  74 -29.388  11.990 -10.286
   12    HZ1  LYS  74           HZ2      LYS  74 -29.970  10.444  -9.890
   13    HZ3  LYS  74           HZ3      LYS  74 -28.312  10.681 -10.173

  No H/Q in entry =          13
  In of MODEL   88
    1    HA   PRO  75           HA       PRO  75 -33.104   6.361  -2.966
    2    HB2  PRO  75           HB2      PRO  75 -33.287   4.100  -4.508
    3    HB3  PRO  75           HB3      PRO  75 -34.478   5.396  -4.615
    4    HG2  PRO  75           HG2      PRO  75 -32.094   4.883  -6.350
    5    HG3  PRO  75           HG3      PRO  75 -33.757   5.228  -6.822
    6    HD2  PRO  75           HD2      PRO  75 -31.911   7.189  -6.796
    7    HD3  PRO  75           HD3      PRO  75 -33.567   7.516  -6.282

  No H/Q in entry =           7
  In of MODEL   88
    1    H    VAL  76           H        VAL  76 -31.616   5.405  -1.558
    2    HA   VAL  76           HA       VAL  76 -29.083   4.298  -2.617
    3    HB   VAL  76           HB       VAL  76 -29.471   5.799   0.008
    4   HG11  VAL  76          HG11      VAL  76 -27.039   4.604  -1.334
    5   HG13  VAL  76          HG12      VAL  76 -27.729   4.150   0.225
    6   HG12  VAL  76          HG13      VAL  76 -26.959   5.723   0.027
    7   HG22  VAL  76          HG21      VAL  76 -28.888   7.713  -0.908
    8   HG21  VAL  76          HG22      VAL  76 -29.379   6.962  -2.428
    9   HG23  VAL  76          HG23      VAL  76 -27.680   6.967  -1.955

  No H/Q in entry =           9
  In of MODEL   88
    1    H    GLU  77           H        GLU  77 -28.766   2.170  -1.960
    2    HA   GLU  77           HA       GLU  77 -29.542   1.395   0.700
    3    HB2  GLU  77           HB2      GLU  77 -31.060  -0.340   0.186
    4    HB3  GLU  77           HB3      GLU  77 -31.675   1.140  -0.551
    5    HG2  GLU  77           HG2      GLU  77 -31.006   0.372  -2.717
    6    HG3  GLU  77           HG3      GLU  77 -30.298  -1.078  -2.008

  No H/Q in entry =           6
  In of MODEL   88
    1    H    VAL  78           H        VAL  78 -29.119  -0.660   1.404
    2    HA   VAL  78           HA       VAL  78 -26.408  -1.314   0.559
    3    HB   VAL  78           HB       VAL  78 -28.096  -2.237   2.924
    4   HG11  VAL  78          HG11      VAL  78 -25.687  -3.369   1.847
    5   HG13  VAL  78          HG12      VAL  78 -26.586  -3.858   3.284
    6   HG12  VAL  78          HG13      VAL  78 -25.328  -2.629   3.406
    7   HG22  VAL  78          HG21      VAL  78 -26.723  -0.778   4.250
    8   HG21  VAL  78          HG22      VAL  78 -27.491   0.129   2.948
    9   HG23  VAL  78          HG23      VAL  78 -25.789  -0.317   2.826

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ILE  79           H        ILE  79 -25.768  -3.211  -0.304
    2    HA   ILE  79           HA       ILE  79 -27.737  -4.815  -1.643
    3    HB   ILE  79           HB       ILE  79 -24.726  -5.188  -1.380
    4   HG12  ILE  79          HG12      ILE  79 -26.390  -4.210  -3.707
    5   HG13  ILE  79          HG13      ILE  79 -25.581  -3.137  -2.565
    6   HG22  ILE  79          HG21      ILE  79 -25.743  -6.465  -3.687
    7   HG21  ILE  79          HG22      ILE  79 -26.715  -7.008  -2.320
    8   HG23  ILE  79          HG23      ILE  79 -24.963  -7.199  -2.286
    9   HD13  ILE  79          HD11      ILE  79 -24.142  -3.214  -4.367
   10   HD12  ILE  79          HD12      ILE  79 -24.393  -4.943  -4.617
   11   HD11  ILE  79          HD13      ILE  79 -23.451  -4.379  -3.236

  No H/Q in entry =          11
  In of MODEL   88
    1    H    ASP  80           H        ASP  80 -28.511  -6.767  -1.030
    2    HA   ASP  80           HA       ASP  80 -28.443  -7.613   1.634
    3    HB2  ASP  80           HB2      ASP  80 -30.147  -8.307  -0.012
    4    HB3  ASP  80           HB3      ASP  80 -28.931  -9.272  -0.848

  No H/Q in entry =           4
  In of MODEL   88
    1    H    SER  81           H        SER  81 -26.866  -8.647   2.802
    2    HA   SER  81           HA       SER  81 -24.325  -9.227   1.650
    3    HB2  SER  81           HB2      SER  81 -23.748 -10.184   3.844
    4    HB3  SER  81           HB3      SER  81 -24.529  -8.614   4.019
    5    HG   SER  81           HG       SER  81 -26.512  -9.914   4.266

  No H/Q in entry =           5
  In of MODEL   88
    1    H    LEU  82           H        LEU  82 -26.932 -11.445   1.985
    2    HA   LEU  82           HA       LEU  82 -25.263 -13.743   1.529
    3    HB2  LEU  82           HB2      LEU  82 -28.222 -13.271   1.243
    4    HB3  LEU  82           HB3      LEU  82 -27.445 -14.841   1.049
    5    HG   LEU  82           HG       LEU  82 -27.458 -13.242   3.590
    6   HD12  LEU  82          HD11      LEU  82 -29.029 -15.729   2.886
    7   HD11  LEU  82          HD12      LEU  82 -29.705 -14.099   2.834
    8   HD13  LEU  82          HD13      LEU  82 -29.143 -14.773   4.364
    9   HD23  LEU  82          HD21      LEU  82 -26.784 -15.610   4.396
   10   HD22  LEU  82          HD22      LEU  82 -25.566 -14.619   3.595
   11   HD21  LEU  82          HD23      LEU  82 -26.383 -15.902   2.702

  No H/Q in entry =          11
  In of MODEL   88
    1    H    LEU  83           H        LEU  83 -27.308 -11.655  -0.454
    2    HA   LEU  83           HA       LEU  83 -27.011 -13.049  -2.895
    3    HB2  LEU  83           HB2      LEU  83 -27.572 -10.155  -2.311
    4    HB3  LEU  83           HB3      LEU  83 -27.554 -10.831  -3.939
    5    HG   LEU  83           HG       LEU  83 -29.590 -11.277  -1.775
    6   HD13  LEU  83          HD11      LEU  83 -30.425  -9.490  -2.884
    7   HD12  LEU  83          HD12      LEU  83 -30.818 -10.650  -4.152
    8   HD11  LEU  83          HD13      LEU  83 -29.327  -9.711  -4.246
    9   HD23  LEU  83          HD21      LEU  83 -29.636 -12.594  -4.476
   10   HD22  LEU  83          HD22      LEU  83 -30.603 -12.963  -3.049
   11   HD21  LEU  83          HD23      LEU  83 -28.892 -13.383  -3.086

  No H/Q in entry =          11
  In of MODEL   88
    1    H    TYR  84           H        TYR  84 -25.198 -10.537  -1.248
    2    HA   TYR  84           HA       TYR  84 -23.338 -10.000  -3.369
    3    HB2  TYR  84           HB2      TYR  84 -23.916  -8.457  -1.452
    4    HB3  TYR  84           HB3      TYR  84 -22.977  -9.522  -0.408
    5    HD1  TYR  84           HD1      TYR  84 -20.506  -9.921  -1.068
    6    HD2  TYR  84           HD2      TYR  84 -22.858  -6.690  -2.572
    7    HE1  TYR  84           HE1      TYR  84 -18.437  -8.721  -1.691
    8    HE2  TYR  84           HE2      TYR  84 -20.798  -5.484  -3.210
    9    HH   TYR  84           HH       TYR  84 -18.065  -6.650  -3.705

  No H/Q in entry =           9
  In of MODEL   88
    1    H    GLY  85           H        GLY  85 -23.032 -11.929  -0.381
    2    HA3  GLY  85           HA2      GLY  85 -20.406 -12.753  -0.818
    3    HA2  GLY  85           HA3      GLY  85 -21.603 -13.641   0.125

  No H/Q in entry =           3
  In of MODEL   88
    1    H    LYS  86           H        LYS  86 -23.406 -14.146  -1.947
    2    HA   LYS  86           HA       LYS  86 -22.223 -16.489  -3.147
    3    HB2  LYS  86           HB2      LYS  86 -24.510 -16.342  -2.186
    4    HB3  LYS  86           HB3      LYS  86 -24.939 -15.214  -3.470
    5    HG2  LYS  86           HG2      LYS  86 -24.652 -16.953  -5.114
    6    HG3  LYS  86           HG3      LYS  86 -24.174 -18.084  -3.848
    7    HD2  LYS  86           HD2      LYS  86 -26.334 -17.724  -2.722
    8    HD3  LYS  86           HD3      LYS  86 -26.811 -16.614  -4.005
    9    HE2  LYS  86           HE2      LYS  86 -26.660 -18.422  -5.637
   10    HE3  LYS  86           HE3      LYS  86 -26.156 -19.535  -4.366
   11    HZ1  LYS  86           HZ1      LYS  86 -28.408 -18.431  -3.349
   12    HZ3  LYS  86           HZ2      LYS  86 -28.327 -19.935  -4.135
   13    HZ2  LYS  86           HZ3      LYS  86 -28.783 -18.548  -5.001

  No H/Q in entry =          13
  In of MODEL   88
    1    H    VAL  87           H        VAL  87 -22.360 -13.296  -4.105
    2    HA   VAL  87           HA       VAL  87 -22.098 -12.148  -6.067
    3    HB   VAL  87           HB       VAL  87 -20.897 -14.621  -7.341
    4   HG11  VAL  87          HG11      VAL  87 -21.191 -12.203  -8.373
    5   HG13  VAL  87          HG12      VAL  87 -19.698 -13.106  -8.638
    6   HG12  VAL  87          HG13      VAL  87 -19.761 -11.846  -7.405
    7   HG23  VAL  87          HG21      VAL  87 -18.734 -14.034  -6.282
    8   HG22  VAL  87          HG22      VAL  87 -19.933 -14.645  -5.144
    9   HG21  VAL  87          HG23      VAL  87 -19.597 -12.917  -5.226

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ASP  88           H        ASP  88 -24.583 -12.907  -5.728
    2    HA   ASP  88           HA       ASP  88 -25.617 -14.227  -8.111
    3    HB2  ASP  88           HB2      ASP  88 -26.623 -14.474  -5.792
    4    HB3  ASP  88           HB3      ASP  88 -27.160 -12.800  -5.931

  No H/Q in entry =           4
  In of MODEL   88
    1    H    GLY  89           H        GLY  89 -24.958 -12.969  -9.771
    2    HA3  GLY  89           HA2      GLY  89 -25.276 -10.212 -10.030
    3    HA2  GLY  89           HA3      GLY  89 -25.181 -11.358 -11.367

  No H/Q in entry =           3
  In of MODEL   88
    1    H    LEU  90           H        LEU  90 -27.561 -12.822 -10.915
    2    HA   LEU  90           HA       LEU  90 -29.455 -11.004 -12.085
    3    HB2  LEU  90           HB2      LEU  90 -29.394 -13.411 -12.617
    4    HB3  LEU  90           HB3      LEU  90 -29.897 -13.768 -10.965
    5    HG   LEU  90           HG       LEU  90 -32.066 -12.767 -11.372
    6   HD13  LEU  90          HD11      LEU  90 -31.958 -11.050 -12.881
    7   HD12  LEU  90          HD12      LEU  90 -32.423 -12.335 -13.997
    8   HD11  LEU  90          HD13      LEU  90 -30.732 -11.852 -13.864
    9   HD23  LEU  90          HD21      LEU  90 -31.889 -14.441 -13.772
   10   HD22  LEU  90          HD22      LEU  90 -32.875 -14.625 -12.321
   11   HD21  LEU  90          HD23      LEU  90 -31.192 -15.154 -12.317

  No H/Q in entry =          11
  In of MODEL   88
    1    H    GLY  91           H        GLY  91 -29.245 -12.430  -8.870
    2    HA3  GLY  91           HA2      GLY  91 -31.648 -11.416  -7.875
    3    HA2  GLY  91           HA3      GLY  91 -30.241 -11.859  -6.908

  No H/Q in entry =           3
  In of MODEL   88
    1    H    VAL  92           H        VAL  92 -28.408  -9.955  -7.785
    2    HA   VAL  92           HA       VAL  92 -29.330  -7.665  -6.291
    3    HB   VAL  92           HB       VAL  92 -26.747  -8.038  -7.852
    4   HG12  VAL  92          HG11      VAL  92 -27.031  -6.117  -5.567
    5   HG11  VAL  92          HG12      VAL  92 -27.707  -5.639  -7.126
    6   HG13  VAL  92          HG13      VAL  92 -25.991  -6.018  -6.988
    7   HG22  VAL  92          HG21      VAL  92 -26.461  -9.580  -6.226
    8   HG21  VAL  92          HG22      VAL  92 -27.655  -8.837  -5.160
    9   HG23  VAL  92          HG23      VAL  92 -26.033  -8.155  -5.278

  No H/Q in entry =           9
  In of MODEL   88
    1    H    LEU  93           H        LEU  93 -28.855  -8.375  -9.693
    2    HA   LEU  93           HA       LEU  93 -29.323  -5.780 -10.681
    3    HB2  LEU  93           HB2      LEU  93 -28.574  -7.629 -12.097
    4    HB3  LEU  93           HB3      LEU  93 -30.128  -8.432 -11.874
    5    HG   LEU  93           HG       LEU  93 -31.226  -6.546 -13.048
    6   HD11  LEU  93          HD11      LEU  93 -29.464  -4.848 -12.561
    7   HD13  LEU  93          HD12      LEU  93 -29.883  -4.935 -14.271
    8   HD12  LEU  93          HD13      LEU  93 -28.398  -5.684 -13.690
    9   HD23  LEU  93          HD21      LEU  93 -30.137  -7.106 -15.314
   10   HD22  LEU  93          HD22      LEU  93 -30.923  -8.385 -14.390
   11   HD21  LEU  93          HD23      LEU  93 -29.164  -8.240 -14.377

  No H/Q in entry =          11
  In of MODEL   88
    1    H    LYS  94           H        LYS  94 -31.575  -8.426  -9.801
    2    HA   LYS  94           HA       LYS  94 -33.983  -7.118 -10.476
    3    HB2  LYS  94           HB2      LYS  94 -33.381  -9.233  -8.415
    4    HB3  LYS  94           HB3      LYS  94 -35.008  -8.625  -8.712
    5    HG2  LYS  94           HG2      LYS  94 -34.858  -9.442 -11.029
    6    HG3  LYS  94           HG3      LYS  94 -33.265 -10.106 -10.670
    7    HD2  LYS  94           HD2      LYS  94 -34.335 -11.458  -8.828
    8    HD3  LYS  94           HD3      LYS  94 -35.904 -10.901  -9.412
    9    HE2  LYS  94           HE2      LYS  94 -35.318 -11.849 -11.654
   10    HE3  LYS  94           HE3      LYS  94 -33.873 -12.545 -10.921
   11    HZ3  LYS  94           HZ1      LYS  94 -35.641 -14.161 -11.076
   12    HZ2  LYS  94           HZ2      LYS  94 -36.676 -13.167 -10.165
   13    HZ1  LYS  94           HZ3      LYS  94 -35.286 -13.831  -9.449

  No H/Q in entry =          13
  In of MODEL   88
    1    H    ALA  95           H        ALA  95 -32.187  -7.084  -7.410
    2    HA   ALA  95           HA       ALA  95 -34.129  -5.570  -5.980
    3    HB2  ALA  95           HB1      ALA  95 -31.693  -6.812  -5.392
    4    HB3  ALA  95           HB2      ALA  95 -32.727  -5.935  -4.267
    5    HB1  ALA  95           HB3      ALA  95 -31.413  -5.096  -5.093

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ALA  96           H        ALA  96 -31.512  -4.626  -8.071
    2    HA   ALA  96           HA       ALA  96 -31.563  -1.848  -7.353
    3    HB2  ALA  96           HB1      ALA  96 -30.193  -1.596  -9.454
    4    HB3  ALA  96           HB2      ALA  96 -30.407  -3.323  -9.740
    5    HB1  ALA  96           HB3      ALA  96 -29.533  -2.769  -8.313

  No H/Q in entry =           5
  In of MODEL   88
    1    H    VAL  97           H        VAL  97 -32.979  -3.692 -10.017
    2    HA   VAL  97           HA       VAL  97 -34.150  -1.474 -11.330
    3    HB   VAL  97           HB       VAL  97 -34.812  -4.437 -11.320
    4   HG11  VAL  97          HG11      VAL  97 -36.697  -2.533 -11.863
    5   HG13  VAL  97          HG12      VAL  97 -36.669  -4.141 -12.587
    6   HG12  VAL  97          HG13      VAL  97 -35.976  -2.773 -13.455
    7   HG21  VAL  97          HG21      VAL  97 -33.605  -2.588 -13.380
    8   HG23  VAL  97          HG22      VAL  97 -33.971  -4.294 -13.638
    9   HG22  VAL  97          HG23      VAL  97 -32.755  -3.822 -12.449

  No H/Q in entry =           9
  In of MODEL   88
    1    H    ALA  98           H        ALA  98 -35.249  -3.658  -8.760
    2    HA   ALA  98           HA       ALA  98 -37.867  -2.630  -8.455
    3    HB1  ALA  98           HB1      ALA  98 -36.757  -4.755  -7.369
    4    HB3  ALA  98           HB2      ALA  98 -37.991  -3.873  -6.468
    5    HB2  ALA  98           HB3      ALA  98 -36.283  -3.632  -6.095

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ALA  99           H        ALA  99 -34.848  -1.649  -6.797
    2    HA   ALA  99           HA       ALA  99 -36.088   0.310  -5.186
    3    HB1  ALA  99           HB1      ALA  99 -33.393  -0.464  -5.891
    4    HB2  ALA  99           HB2      ALA  99 -33.994   0.288  -4.413
    5    HB3  ALA  99           HB3      ALA  99 -33.554   1.289  -5.796

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ILE 100           H        ILE 100 -35.022   0.425  -8.534
    2    HA   ILE 100           HA       ILE 100 -35.336   3.257  -8.812
    3    HB   ILE 100           HB       ILE 100 -35.306   1.059 -10.908
    4   HG12  ILE 100          HG12      ILE 100 -33.247   3.165 -10.257
    5   HG13  ILE 100          HG13      ILE 100 -33.210   1.532  -9.595
    6   HG21  ILE 100          HG21      ILE 100 -35.866   3.952 -11.100
    7   HG23  ILE 100          HG22      ILE 100 -36.300   2.638 -12.196
    8   HG22  ILE 100          HG23      ILE 100 -34.679   3.332 -12.247
    9   HD12  ILE 100          HD11      ILE 100 -32.697   2.459 -12.382
   10   HD11  ILE 100          HD12      ILE 100 -33.282   0.819 -12.102
   11   HD13  ILE 100          HD13      ILE 100 -31.766   1.350 -11.377

  No H/Q in entry =          11
  In of MODEL   88
    1    H    LYS 101           H        LYS 101 -37.495   0.527  -9.506
    2    HA   LYS 101           HA       LYS 101 -39.642   2.055 -10.557
    3    HB2  LYS 101           HB2      LYS 101 -39.405  -0.688  -9.375
    4    HB3  LYS 101           HB3      LYS 101 -40.987  -0.009  -9.749
    5    HG2  LYS 101           HG2      LYS 101 -40.498   0.104 -12.044
    6    HG3  LYS 101           HG3      LYS 101 -38.787  -0.215 -11.766
    7    HD2  LYS 101           HD2      LYS 101 -39.936  -2.198 -12.626
    8    HD3  LYS 101           HD3      LYS 101 -39.310  -2.466 -10.999
    9    HE2  LYS 101           HE2      LYS 101 -41.342  -3.249 -10.497
   10    HE3  LYS 101           HE3      LYS 101 -41.879  -1.569 -10.539
   11    HZ3  LYS 101           HZ1      LYS 101 -42.741  -1.809 -12.661
   12    HZ2  LYS 101           HZ2      LYS 101 -43.138  -3.289 -11.928
   13    HZ1  LYS 101           HZ3      LYS 101 -41.825  -3.199 -13.000

  No H/Q in entry =          13
  In of MODEL   88
    1    H    LYS 102           H        LYS 102 -39.113   0.664  -7.316
    2    HA   LYS 102           HA       LYS 102 -41.426   1.773  -6.163
    3    HB2  LYS 102           HB2      LYS 102 -40.113  -0.013  -5.100
    4    HB3  LYS 102           HB3      LYS 102 -38.776   1.113  -4.864
    5    HG2  LYS 102           HG2      LYS 102 -40.173   2.471  -3.407
    6    HG3  LYS 102           HG3      LYS 102 -41.513   1.349  -3.645
    7    HD2  LYS 102           HD2      LYS 102 -40.209  -0.436  -2.572
    8    HD3  LYS 102           HD3      LYS 102 -38.870   0.687  -2.332
    9    HE2  LYS 102           HE2      LYS 102 -40.307   2.124  -0.964
   10    HE3  LYS 102           HE3      LYS 102 -41.666   1.031  -1.226
   11    HZ1  LYS 102           HZ1      LYS 102 -39.874  -0.620  -0.173
   12    HZ3  LYS 102           HZ2      LYS 102 -41.035   0.229   0.730
   13    HZ2  LYS 102           HZ3      LYS 102 -39.449   0.827   0.607

  No H/Q in entry =          13
  In of MODEL   88
    1    H    ALA 103           H        ALA 103 -38.531   3.285  -7.174
    2    HA   ALA 103           HA       ALA 103 -38.882   5.619  -5.439
    3    HB2  ALA 103           HB1      ALA 103 -36.912   6.418  -7.010
    4    HB3  ALA 103           HB2      ALA 103 -36.791   4.697  -7.375
    5    HB1  ALA 103           HB3      ALA 103 -36.607   5.262  -5.715

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ALA 104           H        ALA 104 -39.434   4.796  -8.776
    2    HA   ALA 104           HA       ALA 104 -40.145   7.538  -9.458
    3    HB2  ALA 104           HB1      ALA 104 -40.133   6.828 -11.647
    4    HB1  ALA 104           HB2      ALA 104 -40.789   5.240 -11.246
    5    HB3  ALA 104           HB3      ALA 104 -39.084   5.591 -10.955

  No H/Q in entry =           5
  In of MODEL   88
    1    H    ALA 105           H        ALA 105 -41.669   5.392  -7.628
    2    HA   ALA 105           HA       ALA 105 -44.158   6.669  -7.651
    3    HB2  ALA 105           HB1      ALA 105 -44.840   5.736  -9.680
    4    HB3  ALA 105           HB2      ALA 105 -45.430   4.541  -8.527
    5    HB1  ALA 105           HB3      ALA 105 -43.936   4.245  -9.414

  No H/Q in entry =           5
  In of MODEL   89
    1    H1   ALA   1           H3       ALA   1 -12.135 -16.011  -2.274
    2    H2   ALA   1           H2       ALA   1 -11.187 -17.142  -3.123
    3    H3   ALA   1           H1       ALA   1 -12.347 -16.209  -3.947
    4    HA   ALA   1           HA       ALA   1 -13.725 -17.926  -3.698
    5    HB3  ALA   1           HB1      ALA   1 -12.306 -19.682  -3.248
    6    HB1  ALA   1           HB2      ALA   1 -13.052 -19.579  -1.653
    7    HB2  ALA   1           HB3      ALA   1 -11.487 -18.820  -1.945

  No H/Q in entry =           7
  In of MODEL   89
    1    H    GLU   2           H        GLU   2 -15.326 -18.799  -2.033
    2    HA   GLU   2           HA       GLU   2 -16.986 -17.098  -0.961
    3    HB2  GLU   2           HB2      GLU   2 -16.008 -19.514   0.575
    4    HB3  GLU   2           HB3      GLU   2 -17.540 -18.681   0.841
    5    HG2  GLU   2           HG2      GLU   2 -18.520 -19.777  -0.888
    6    HG3  GLU   2           HG3      GLU   2 -17.209 -19.361  -1.981

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLU   3           H        GLU   3 -15.040 -18.432   1.647
    2    HA   GLU   3           HA       GLU   3 -15.276 -16.082   3.208
    3    HB2  GLU   3           HB2      GLU   3 -13.660 -18.611   3.445
    4    HB3  GLU   3           HB3      GLU   3 -13.435 -17.290   4.591
    5    HG2  GLU   3           HG2      GLU   3 -15.621 -17.466   5.425
    6    HG3  GLU   3           HG3      GLU   3 -16.218 -18.272   3.980

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LEU   4           H        LEU   4 -12.315 -17.527   1.794
    2    HA   LEU   4           HA       LEU   4 -10.498 -15.604   2.381
    3    HB2  LEU   4           HB2      LEU   4 -10.733 -16.902  -0.343
    4    HB3  LEU   4           HB3      LEU   4  -9.285 -16.166   0.332
    5    HG   LEU   4           HG       LEU   4 -10.744 -18.580   1.453
    6   HD13  LEU   4          HD11      LEU   4  -9.103 -19.917   0.511
    7   HD12  LEU   4          HD12      LEU   4  -7.908 -18.621   0.477
    8   HD11  LEU   4          HD13      LEU   4  -9.205 -18.656  -0.717
    9   HD23  LEU   4          HD21      LEU   4  -8.482 -18.620   2.819
   10   HD22  LEU   4          HD22      LEU   4  -9.811 -17.595   3.358
   11   HD21  LEU   4          HD23      LEU   4  -8.463 -16.891   2.467

  No H/Q in entry =          11
  In of MODEL   89
    1    H    GLU   5           H        GLU   5 -12.853 -15.421  -0.276
    2    HA   GLU   5           HA       GLU   5 -11.885 -12.926  -1.282
    3    HB2  GLU   5           HB2      GLU   5 -13.224 -14.527  -2.634
    4    HB3  GLU   5           HB3      GLU   5 -14.621 -14.176  -1.616
    5    HG2  GLU   5           HG2      GLU   5 -14.520 -11.809  -2.262
    6    HG3  GLU   5           HG3      GLU   5 -13.096 -12.130  -3.252

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLU   6           H        GLU   6 -14.585 -13.835   0.828
    2    HA   GLU   6           HA       GLU   6 -15.516 -11.169   1.236
    3    HB2  GLU   6           HB2      GLU   6 -16.916 -13.178   1.644
    4    HB3  GLU   6           HB3      GLU   6 -15.872 -13.610   2.996
    5    HG2  GLU   6           HG2      GLU   6 -16.417 -11.487   4.112
    6    HG3  GLU   6           HG3      GLU   6 -17.443 -11.028   2.755

  No H/Q in entry =           6
  In of MODEL   89
    1    H    VAL   7           H        VAL   7 -13.175 -13.255   2.790
    2    HA   VAL   7           HA       VAL   7 -12.709 -11.677   5.115
    3    HB   VAL   7           HB       VAL   7 -10.994 -13.701   3.652
    4   HG11  VAL   7          HG11      VAL   7 -10.524 -12.165   6.214
    5   HG13  VAL   7          HG12      VAL   7  -9.431 -12.366   4.845
    6   HG12  VAL   7          HG13      VAL   7  -9.762 -13.727   5.917
    7   HG21  VAL   7          HG21      VAL   7 -13.230 -14.290   4.887
    8   HG23  VAL   7          HG22      VAL   7 -12.295 -14.007   6.356
    9   HG22  VAL   7          HG23      VAL   7 -11.796 -15.261   5.223

  No H/Q in entry =           9
  In of MODEL   89
    1    H    VAL   8           H        VAL   8 -11.219 -11.773   1.894
    2    HA   VAL   8           HA       VAL   8  -9.173  -9.878   2.374
    3    HB   VAL   8           HB       VAL   8 -10.647 -10.582  -0.174
    4   HG12  VAL   8          HG11      VAL   8  -8.544  -9.540  -1.223
    5   HG11  VAL   8          HG12      VAL   8  -8.259  -8.801   0.353
    6   HG13  VAL   8          HG13      VAL   8  -9.727  -8.420  -0.547
    7   HG23  VAL   8          HG21      VAL   8  -7.792 -11.320   0.241
    8   HG22  VAL   8          HG22      VAL   8  -9.108 -12.268  -0.444
    9   HG21  VAL   8          HG23      VAL   8  -8.930 -12.150   1.303

  No H/Q in entry =           9
  In of MODEL   89
    1    H    MET   9           H        MET   9 -12.531  -9.524   1.238
    2    HA   MET   9           HA       MET   9 -12.501  -6.746   0.805
    3    HB2  MET   9           HB2      MET   9 -14.656  -8.699   1.564
    4    HB3  MET   9           HB3      MET   9 -15.002  -6.970   1.525
    5    HG2  MET   9           HG2      MET   9 -13.966  -6.983  -0.826
    6    HG3  MET   9           HG3      MET   9 -14.092  -8.740  -0.745
    7    HE1  MET   9           HE1      MET   9 -15.916 -10.078  -0.687
    8    HE3  MET   9           HE2      MET   9 -17.618  -9.676  -0.899
    9    HE2  MET   9           HE3      MET   9 -16.863  -9.474   0.679

  No H/Q in entry =           9
  In of MODEL   89
    1    H    GLY  10           H        GLY  10 -13.123  -8.647   3.735
    2    HA3  GLY  10           HA2      GLY  10 -13.683  -6.469   5.459
    3    HA2  GLY  10           HA3      GLY  10 -13.098  -8.052   5.968

  No H/Q in entry =           3
  In of MODEL   89
    1    H    LEU  11           H        LEU  11 -10.660  -8.148   4.636
    2    HA   LEU  11           HA       LEU  11  -8.964  -6.696   6.382
    3    HB2  LEU  11           HB2      LEU  11  -8.419  -8.112   3.770
    4    HB3  LEU  11           HB3      LEU  11  -7.150  -7.394   4.760
    5    HG   LEU  11           HG       LEU  11  -9.122  -9.450   5.789
    6   HD13  LEU  11          HD11      LEU  11  -7.897 -10.672   4.216
    7   HD12  LEU  11          HD12      LEU  11  -6.949 -10.901   5.684
    8   HD11  LEU  11          HD13      LEU  11  -6.430  -9.729   4.474
    9   HD22  LEU  11          HD21      LEU  11  -8.267  -8.429   7.701
   10   HD21  LEU  11          HD22      LEU  11  -6.739  -8.009   6.928
   11   HD23  LEU  11          HD23      LEU  11  -7.042  -9.669   7.438

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  12           H        ILE  12  -9.895  -6.158   2.999
    2    HA   ILE  12           HA       ILE  12  -8.232  -3.908   2.563
    3    HB   ILE  12           HB       ILE  12 -10.886  -4.611   1.285
    4   HG12  ILE  12          HG12      ILE  12  -8.829  -6.235   1.194
    5   HG13  ILE  12          HG13      ILE  12  -9.704  -5.887  -0.284
    6   HG22  ILE  12          HG21      ILE  12  -9.994  -3.205  -0.610
    7   HG21  ILE  12          HG22      ILE  12  -8.698  -2.674   0.454
    8   HG23  ILE  12          HG23      ILE  12 -10.356  -2.312   0.834
    9   HD12  ILE  12          HD11      ILE  12  -7.210  -5.801  -0.521
   10   HD11  ILE  12          HD12      ILE  12  -7.192  -4.454   0.614
   11   HD13  ILE  12          HD13      ILE  12  -7.994  -4.287  -0.930

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  13           H        ILE  13 -11.582  -4.216   3.679
    2    HA   ILE  13           HA       ILE  13 -12.073  -1.434   3.953
    3    HB   ILE  13           HB       ILE  13 -13.239  -3.868   5.326
    4   HG12  ILE  13          HG12      ILE  13 -13.486  -3.343   2.790
    5   HG13  ILE  13          HG13      ILE  13 -14.906  -3.804   3.705
    6   HG22  ILE  13          HG21      ILE  13 -15.146  -2.280   5.926
    7   HG21  ILE  13          HG22      ILE  13 -14.051  -0.953   5.559
    8   HG23  ILE  13          HG23      ILE  13 -13.667  -2.077   6.860
    9   HD13  ILE  13          HD11      ILE  13 -15.838  -1.698   3.596
   10   HD12  ILE  13          HD12      ILE  13 -14.881  -1.663   2.128
   11   HD11  ILE  13          HD13      ILE  13 -14.259  -0.905   3.578

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ASN  14           H        ASN  14 -10.917  -3.912   6.219
    2    HA   ASN  14           HA       ASN  14 -10.721  -2.273   8.504
    3    HB2  ASN  14           HB2      ASN  14 -10.438  -4.877   8.179
    4    HB3  ASN  14           HB3      ASN  14  -8.735  -4.469   8.010
    5   HD21  ASN  14          HD21      ASN  14  -9.337  -6.002  10.190
    6   HD22  ASN  14          HD22      ASN  14  -9.312  -5.082  11.614

  No H/Q in entry =           6
  In of MODEL   89
    1    H    SER  15           H        SER  15  -8.325  -3.065   5.996
    2    HA   SER  15           HA       SER  15  -6.194  -1.546   7.054
    3    HB2  SER  15           HB2      SER  15  -5.185  -1.748   4.889
    4    HB3  SER  15           HB3      SER  15  -6.121  -3.220   5.119
    5    HG   SER  15           HG       SER  15  -6.854  -2.583   3.220

  No H/Q in entry =           5
  In of MODEL   89
    1    H    GLY  16           H        GLY  16  -8.821  -0.712   4.825
    2    HA3  GLY  16           HA2      GLY  16  -8.001   1.940   4.269
    3    HA2  GLY  16           HA3      GLY  16  -9.645   1.324   4.118

  No H/Q in entry =           3
  In of MODEL   89
    1    H    GLN  17           H        GLN  17 -10.161   0.591   6.771
    2    HA   GLN  17           HA       GLN  17 -10.894   3.085   7.917
    3    HB2  GLN  17           HB2      GLN  17 -12.114   1.015   8.425
    4    HB3  GLN  17           HB3      GLN  17 -10.686   0.362   9.230
    5    HG2  GLN  17           HG2      GLN  17 -10.764   2.116  10.907
    6    HG3  GLN  17           HG3      GLN  17 -12.077   2.925  10.055
    7   HE21  GLN  17          HE21      GLN  17 -12.388   2.071  12.766
    8   HE22  GLN  17          HE22      GLN  17 -13.523   0.809  12.802

  No H/Q in entry =           8
  In of MODEL   89
    1    H    ALA  18           H        ALA  18  -8.230   0.839   8.518
    2    HA   ALA  18           HA       ALA  18  -7.134   2.069  10.782
    3    HB2  ALA  18           HB1      ALA  18  -6.503  -0.138   9.409
    4    HB3  ALA  18           HB2      ALA  18  -5.344   0.661  10.473
    5    HB1  ALA  18           HB3      ALA  18  -5.282   0.941   8.732

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ARG  19           H        ARG  19  -6.393   2.605   7.329
    2    HA   ARG  19           HA       ARG  19  -4.520   4.678   7.746
    3    HB2  ARG  19           HB2      ARG  19  -4.846   3.534   5.552
    4    HB3  ARG  19           HB3      ARG  19  -6.402   4.353   5.386
    5    HG2  ARG  19           HG2      ARG  19  -5.303   6.540   5.447
    6    HG3  ARG  19           HG3      ARG  19  -3.741   5.776   5.741
    7    HD2  ARG  19           HD2      ARG  19  -3.890   6.366   3.399
    8    HD3  ARG  19           HD3      ARG  19  -3.949   4.605   3.544
    9    HE   ARG  19           HE       ARG  19  -6.596   5.476   3.555
   10   HH21  ARG  19          HH11      ARG  19  -7.805   5.616   1.644
   11   HH22  ARG  19          HH12      ARG  19  -6.995   5.706   0.119
   12   HH11  ARG  19          HH21      ARG  19  -3.835   5.580   1.502
   13   HH12  ARG  19          HH22      ARG  19  -4.745   5.683   0.039

  No H/Q in entry =          13
  In of MODEL   89
    1    H    SER  20           H        SER  20  -8.024   4.743   7.169
    2    HA   SER  20           HA       SER  20  -8.421   7.494   7.123
    3    HB2  SER  20           HB2      SER  20 -10.282   6.124   6.599
    4    HB3  SER  20           HB3      SER  20 -10.151   5.235   8.113
    5    HG   SER  20           HG       SER  20 -10.596   7.312   9.145

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LEU  21           H        LEU  21  -8.371   5.311   9.927
    2    HA   LEU  21           HA       LEU  21  -8.828   7.299  11.895
    3    HB2  LEU  21           HB2      LEU  21  -7.435   4.617  12.045
    4    HB3  LEU  21           HB3      LEU  21  -7.749   5.630  13.451
    5    HG   LEU  21           HG       LEU  21  -9.920   4.704  11.547
    6   HD12  LEU  21          HD11      LEU  21 -10.486   3.063  13.344
    7   HD11  LEU  21          HD12      LEU  21  -9.002   3.516  14.182
    8   HD13  LEU  21          HD13      LEU  21  -8.919   2.746  12.597
    9   HD23  LEU  21          HD21      LEU  21 -11.241   5.175  13.796
   10   HD22  LEU  21          HD22      LEU  21 -10.836   6.524  12.738
   11   HD21  LEU  21          HD23      LEU  21  -9.863   6.208  14.167

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ALA  22           H        ALA  22  -5.865   5.970  10.468
    2    HA   ALA  22           HA       ALA  22  -3.995   7.311  12.079
    3    HB2  ALA  22           HB1      ALA  22  -3.562   5.464  10.384
    4    HB1  ALA  22           HB2      ALA  22  -2.385   6.778  10.412
    5    HB3  ALA  22           HB3      ALA  22  -3.610   6.716   9.144

  No H/Q in entry =           5
  In of MODEL   89
    1    H    TYR  23           H        TYR  23  -5.347   8.309   8.905
    2    HA   TYR  23           HA       TYR  23  -4.049  10.825   8.827
    3    HB2  TYR  23           HB2      TYR  23  -5.129   9.898   6.841
    4    HB3  TYR  23           HB3      TYR  23  -6.704   9.980   7.632
    5    HD1  TYR  23           HD1      TYR  23  -3.835  12.074   6.481
    6    HD2  TYR  23           HD2      TYR  23  -7.978  11.966   7.606
    7    HE1  TYR  23           HE1      TYR  23  -4.101  14.421   5.723
    8    HE2  TYR  23           HE2      TYR  23  -8.245  14.312   6.848
    9    HH   TYR  23           HH       TYR  23  -5.863  16.388   6.424

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ALA  24           H        ALA  24  -7.145   9.800  10.226
    2    HA   ALA  24           HA       ALA  24  -8.015  12.377  11.003
    3    HB1  ALA  24           HB1      ALA  24  -9.812  11.098  11.481
    4    HB2  ALA  24           HB2      ALA  24  -8.968  10.539  12.924
    5    HB3  ALA  24           HB3      ALA  24  -8.839   9.630  11.419

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ALA  25           H        ALA  25  -5.967   9.949  12.564
    2    HA   ALA  25           HA       ALA  25  -5.632  11.206  15.064
    3    HB2  ALA  25           HB1      ALA  25  -4.835   8.866  14.237
    4    HB3  ALA  25           HB2      ALA  25  -3.826   9.739  15.392
    5    HB1  ALA  25           HB3      ALA  25  -3.400   9.729  13.680

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LEU  26           H        LEU  26  -3.865  11.532  12.012
    2    HA   LEU  26           HA       LEU  26  -1.928  13.382  12.917
    3    HB2  LEU  26           HB2      LEU  26  -1.623  12.235  10.811
    4    HB3  LEU  26           HB3      LEU  26  -3.111  12.921  10.165
    5    HG   LEU  26           HG       LEU  26  -2.129  15.186  10.295
    6   HD12  LEU  26          HD11      LEU  26   0.411  15.244  10.694
    7   HD11  LEU  26          HD12      LEU  26   0.216  13.660  11.439
    8   HD13  LEU  26          HD13      LEU  26  -0.608  15.062  12.121
    9   HD21  LEU  26          HD21      LEU  26  -0.364  13.158   8.889
   10   HD23  LEU  26          HD22      LEU  26  -0.435  14.879   8.519
   11   HD22  LEU  26          HD23      LEU  26  -1.845  13.860   8.240

  No H/Q in entry =          11
  In of MODEL   89
    1    H    LYS  27           H        LYS  27  -5.127  13.817  11.460
    2    HA   LYS  27           HA       LYS  27  -5.114  16.606  11.262
    3    HB2  LYS  27           HB2      LYS  27  -6.842  15.104  10.287
    4    HB3  LYS  27           HB3      LYS  27  -7.485  14.837  11.907
    5    HG2  LYS  27           HG2      LYS  27  -7.948  17.237  12.146
    6    HG3  LYS  27           HG3      LYS  27  -7.254  17.544  10.551
    7    HD2  LYS  27           HD2      LYS  27  -8.972  16.085   9.525
    8    HD3  LYS  27           HD3      LYS  27  -9.672  15.794  11.119
    9    HE2  LYS  27           HE2      LYS  27 -10.148  18.199  11.366
   10    HE3  LYS  27           HE3      LYS  27  -9.420  18.511   9.787
   11    HZ3  LYS  27           HZ1      LYS  27 -11.797  18.352   9.560
   12    HZ2  LYS  27           HZ2      LYS  27 -11.819  16.835  10.329
   13    HZ1  LYS  27           HZ3      LYS  27 -11.086  17.009   8.803

  No H/Q in entry =          13
  In of MODEL   89
    1    H    GLN  28           H        GLN  28  -5.955  14.507  13.994
    2    HA   GLN  28           HA       GLN  28  -6.868  16.497  15.776
    3    HB2  GLN  28           HB2      GLN  28  -5.430  13.883  16.302
    4    HB3  GLN  28           HB3      GLN  28  -6.163  14.878  17.561
    5    HG2  GLN  28           HG2      GLN  28  -7.659  13.775  15.168
    6    HG3  GLN  28           HG3      GLN  28  -7.665  13.041  16.771
    7   HE21  GLN  28          HE21      GLN  28  -7.779  15.454  18.340
    8   HE22  GLN  28          HE22      GLN  28  -9.286  16.183  18.066

  No H/Q in entry =           8
  In of MODEL   89
    1    H    ALA  29           H        ALA  29  -3.635  15.246  15.066
    2    HA   ALA  29           HA       ALA  29  -2.204  16.663  17.036
    3    HB1  ALA  29           HB1      ALA  29  -0.271  15.998  15.904
    4    HB3  ALA  29           HB2      ALA  29  -1.038  16.113  14.320
    5    HB2  ALA  29           HB3      ALA  29  -1.435  14.774  15.397

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LYS  30           H        LYS  30  -3.095  17.532  13.712
    2    HA   LYS  30           HA       LYS  30  -1.716  19.989  13.603
    3    HB2  LYS  30           HB2      LYS  30  -4.245  19.085  12.211
    4    HB3  LYS  30           HB3      LYS  30  -3.432  20.610  11.862
    5    HG2  LYS  30           HG2      LYS  30  -1.350  19.342  11.334
    6    HG3  LYS  30           HG3      LYS  30  -2.237  17.835  11.585
    7    HD2  LYS  30           HD2      LYS  30  -3.820  18.457   9.801
    8    HD3  LYS  30           HD3      LYS  30  -2.956  19.976   9.552
    9    HE2  LYS  30           HE2      LYS  30  -0.913  18.707   8.959
   10    HE3  LYS  30           HE3      LYS  30  -1.796  17.194   9.176
   11    HZ2  LYS  30           HZ1      LYS  30  -1.645  18.067   6.834
   12    HZ1  LYS  30           HZ2      LYS  30  -2.700  19.318   7.309
   13    HZ3  LYS  30           HZ3      LYS  30  -3.205  17.695   7.383

  No H/Q in entry =          13
  In of MODEL   89
    1    H    GLN  31           H        GLN  31  -4.797  19.101  15.036
    2    HA   GLN  31           HA       GLN  31  -5.588  21.849  15.494
    3    HB2  GLN  31           HB2      GLN  31  -6.732  19.390  16.823
    4    HB3  GLN  31           HB3      GLN  31  -7.510  20.953  16.583
    5    HG2  GLN  31           HG2      GLN  31  -6.809  20.185  13.989
    6    HG3  GLN  31           HG3      GLN  31  -7.312  18.674  14.738
    7   HE21  GLN  31          HE21      GLN  31  -8.753  20.234  12.647
    8   HE22  GLN  31          HE22      GLN  31 -10.266  20.609  13.315

  No H/Q in entry =           8
  In of MODEL   89
    1    H    GLY  32           H        GLY  32  -3.246  19.946  16.798
    2    HA3  GLY  32           HA2      GLY  32  -1.839  20.422  18.591
    3    HA2  GLY  32           HA3      GLY  32  -2.977  21.653  19.123

  No H/Q in entry =           3
  In of MODEL   89
    1    H    ASP  33           H        ASP  33  -4.372  18.599  18.468
    2    HA   ASP  33           HA       ASP  33  -4.759  18.135  21.351
    3    HB2  ASP  33           HB2      ASP  33  -6.171  17.111  18.882
    4    HB3  ASP  33           HB3      ASP  33  -6.499  16.496  20.500

  No H/Q in entry =           4
  In of MODEL   89
    1    H    PHE  34           H        PHE  34  -2.580  17.306  21.641
    2    HA   PHE  34           HA       PHE  34  -1.566  15.069  20.231
    3    HB2  PHE  34           HB2      PHE  34  -0.940  16.057  23.022
    4    HB3  PHE  34           HB3      PHE  34  -0.005  14.845  22.148
    5    HD1  PHE  34           HD1      PHE  34  -0.207  18.268  22.887
    6    HD2  PHE  34           HD2      PHE  34   0.629  15.576  19.644
    7    HE1  PHE  34           HE1      PHE  34   1.062  20.053  21.725
    8    HE2  PHE  34           HE2      PHE  34   1.893  17.364  18.488
    9    HZ   PHE  34           HZ       PHE  34   2.112  19.600  19.533

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ALA  35           H        ALA  35  -3.589  15.323  23.108
    2    HA   ALA  35           HA       ALA  35  -3.343  12.662  24.001
    3    HB3  ALA  35           HB1      ALA  35  -5.802  13.263  24.876
    4    HB1  ALA  35           HB2      ALA  35  -5.288  14.887  24.418
    5    HB2  ALA  35           HB3      ALA  35  -4.356  13.971  25.602

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ALA  36           H        ALA  36  -5.823  14.156  21.919
    2    HA   ALA  36           HA       ALA  36  -7.217  11.730  21.449
    3    HB1  ALA  36           HB1      ALA  36  -8.693  13.139  20.505
    4    HB3  ALA  36           HB2      ALA  36  -7.534  13.572  19.248
    5    HB2  ALA  36           HB3      ALA  36  -7.557  14.458  20.773

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ALA  37           H        ALA  37  -4.564  13.346  19.764
    2    HA   ALA  37           HA       ALA  37  -4.529  11.713  17.465
    3    HB3  ALA  37           HB1      ALA  37  -2.544  13.444  18.876
    4    HB2  ALA  37           HB2      ALA  37  -3.086  13.496  17.199
    5    HB1  ALA  37           HB3      ALA  37  -1.917  12.277  17.711

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LYS  38           H        LYS  38  -2.747  11.422  20.531
    2    HA   LYS  38           HA       LYS  38  -1.401   9.036  20.030
    3    HB2  LYS  38           HB2      LYS  38  -1.727  10.794  22.180
    4    HB3  LYS  38           HB3      LYS  38  -2.326   9.258  22.799
    5    HG2  LYS  38           HG2      LYS  38  -0.224   8.159  22.247
    6    HG3  LYS  38           HG3      LYS  38   0.364   9.611  21.430
    7    HD2  LYS  38           HD2      LYS  38   0.534  10.829  23.466
    8    HD3  LYS  38           HD3      LYS  38  -0.467   9.668  24.338
    9    HE2  LYS  38           HE2      LYS  38   1.896   9.376  24.941
   10    HE3  LYS  38           HE3      LYS  38   1.300   7.954  24.080
   11    HZ3  LYS  38           HZ1      LYS  38   2.584   8.388  22.290
   12    HZ2  LYS  38           HZ2      LYS  38   3.538   9.225  23.421
   13    HZ1  LYS  38           HZ3      LYS  38   2.443  10.074  22.438

  No H/Q in entry =          13
  In of MODEL   89
    1    H    ALA  39           H        ALA  39  -4.635   9.497  21.456
    2    HA   ALA  39           HA       ALA  39  -5.164   6.772  21.961
    3    HB3  ALA  39           HB1      ALA  39  -7.347   8.695  21.211
    4    HB2  ALA  39           HB2      ALA  39  -6.441   8.929  22.706
    5    HB1  ALA  39           HB3      ALA  39  -7.345   7.436  22.447

  No H/Q in entry =           5
  In of MODEL   89
    1    H    MET  40           H        MET  40  -5.789   8.781  19.121
    2    HA   MET  40           HA       MET  40  -7.255   6.835  17.668
    3    HB2  MET  40           HB2      MET  40  -5.676   9.248  16.755
    4    HB3  MET  40           HB3      MET  40  -6.699   8.279  15.691
    5    HG2  MET  40           HG2      MET  40  -7.729   9.515  18.257
    6    HG3  MET  40           HG3      MET  40  -7.806  10.351  16.708
    7    HE3  MET  40           HE1      MET  40 -10.386   8.706  14.660
    8    HE2  MET  40           HE2      MET  40  -8.636   8.842  14.500
    9    HE1  MET  40           HE3      MET  40  -9.564  10.197  15.141

  No H/Q in entry =           9
  In of MODEL   89
    1    H    MET  41           H        MET  41  -3.771   7.609  17.768
    2    HA   MET  41           HA       MET  41  -3.008   5.865  15.661
    3    HB2  MET  41           HB2      MET  41  -1.382   6.546  18.123
    4    HB3  MET  41           HB3      MET  41  -0.768   5.906  16.603
    5    HG2  MET  41           HG2      MET  41  -1.955   8.077  15.609
    6    HG3  MET  41           HG3      MET  41  -1.714   8.666  17.252
    7    HE2  MET  41           HE1      MET  41   1.229   6.599  17.592
    8    HE1  MET  41           HE2      MET  41   0.433   7.883  18.497
    9    HE3  MET  41           HE3      MET  41   2.049   8.145  17.843

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ASP  42           H        ASP  42  -3.364   5.384  19.149
    2    HA   ASP  42           HA       ASP  42  -2.299   2.802  19.299
    3    HB2  ASP  42           HB2      ASP  42  -3.180   4.550  21.129
    4    HB3  ASP  42           HB3      ASP  42  -4.596   3.509  21.066

  No H/Q in entry =           4
  In of MODEL   89
    1    H    GLN  43           H        GLN  43  -5.648   3.869  18.822
    2    HA   GLN  43           HA       GLN  43  -6.764   1.270  18.633
    3    HB2  GLN  43           HB2      GLN  43  -7.724   3.913  17.513
    4    HB3  GLN  43           HB3      GLN  43  -8.671   2.423  17.495
    5    HG2  GLN  43           HG2      GLN  43  -8.359   2.303  20.001
    6    HG3  GLN  43           HG3      GLN  43  -7.653   3.916  19.926
    7   HE21  GLN  43          HE21      GLN  43  -9.823   3.970  21.441
    8   HE22  GLN  43          HE22      GLN  43 -11.196   4.531  20.619

  No H/Q in entry =           8
  In of MODEL   89
    1    H    SER  44           H        SER  44  -5.465   3.501  16.214
    2    HA   SER  44           HA       SER  44  -6.165   2.011  13.928
    3    HB2  SER  44           HB2      SER  44  -4.932   4.408  14.366
    4    HB3  SER  44           HB3      SER  44  -3.570   3.427  13.826
    5    HG   SER  44           HG       SER  44  -4.705   4.389  12.072

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ARG  45           H        ARG  45  -3.272   1.928  15.989
    2    HA   ARG  45           HA       ARG  45  -1.780  -0.009  14.595
    3    HB2  ARG  45           HB2      ARG  45  -0.941   1.420  16.460
    4    HB3  ARG  45           HB3      ARG  45  -1.915   0.477  17.586
    5    HG2  ARG  45           HG2      ARG  45  -0.665  -1.567  16.933
    6    HG3  ARG  45           HG3      ARG  45   0.333  -0.600  15.849
    7    HD2  ARG  45           HD2      ARG  45   1.065   0.787  17.801
    8    HD3  ARG  45           HD3      ARG  45   0.162  -0.299  18.880
    9    HE   ARG  45           HE       ARG  45   1.868  -1.874  17.286
   10   HH21  ARG  45          HH11      ARG  45   3.782  -2.677  18.110
   11   HH22  ARG  45          HH12      ARG  45   4.555  -1.884  19.437
   12   HH11  ARG  45          HH21      ARG  45   2.159   0.593  19.677
   13   HH12  ARG  45          HH22      ARG  45   3.636  -0.030  20.322

  No H/Q in entry =          13
  In of MODEL   89
    1    H    MET  46           H        MET  46  -4.157  -0.358  17.211
    2    HA   MET  46           HA       MET  46  -3.956  -3.156  17.513
    3    HB2  MET  46           HB2      MET  46  -6.153  -1.181  18.124
    4    HB3  MET  46           HB3      MET  46  -6.320  -2.902  18.478
    5    HG2  MET  46           HG2      MET  46  -4.279  -2.830  19.851
    6    HG3  MET  46           HG3      MET  46  -4.081  -1.122  19.487
    7    HE1  MET  46           HE1      MET  46  -4.040  -0.227  21.821
    8    HE3  MET  46           HE2      MET  46  -4.002  -1.885  22.410
    9    HE2  MET  46           HE3      MET  46  -5.109  -0.725  23.138

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ALA  47           H        ALA  47  -6.012  -1.158  15.434
    2    HA   ALA  47           HA       ALA  47  -7.614  -3.225  14.376
    3    HB3  ALA  47           HB1      ALA  47  -8.320  -0.994  13.967
    4    HB1  ALA  47           HB2      ALA  47  -7.835  -1.621  12.392
    5    HB2  ALA  47           HB3      ALA  47  -6.760  -0.542  13.283

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LEU  48           H        LEU  48  -4.516  -1.883  13.307
    2    HA   LEU  48           HA       LEU  48  -4.234  -3.467  10.962
    3    HB2  LEU  48           HB2      LEU  48  -2.178  -2.170  12.759
    4    HB3  LEU  48           HB3      LEU  48  -1.812  -2.885  11.189
    5    HG   LEU  48           HG       LEU  48  -3.855  -0.689  11.594
    6   HD13  LEU  48          HD11      LEU  48  -1.738   0.208  12.247
    7   HD12  LEU  48          HD12      LEU  48  -2.028   0.761  10.598
    8   HD11  LEU  48          HD13      LEU  48  -0.916  -0.575  10.898
    9   HD22  LEU  48          HD21      LEU  48  -4.330  -1.675   9.520
   10   HD21  LEU  48          HD22      LEU  48  -2.644  -2.093   9.213
   11   HD23  LEU  48          HD23      LEU  48  -3.181  -0.419   9.060

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ASN  49           H        ASN  49  -3.163  -3.858  14.301
    2    HA   ASN  49           HA       ASN  49  -1.541  -6.105  13.958
    3    HB2  ASN  49           HB2      ASN  49  -1.547  -4.792  16.008
    4    HB3  ASN  49           HB3      ASN  49  -3.213  -5.248  16.335
    5   HD21  ASN  49          HD21      ASN  49  -0.098  -5.972  17.208
    6   HD22  ASN  49          HD22      ASN  49  -0.318  -7.574  17.720

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLU  50           H        GLU  50  -5.008  -5.863  14.651
    2    HA   GLU  50           HA       GLU  50  -5.494  -8.667  14.759
    3    HB2  GLU  50           HB2      GLU  50  -7.090  -6.996  15.647
    4    HB3  GLU  50           HB3      GLU  50  -7.399  -6.432  14.003
    5    HG2  GLU  50           HG2      GLU  50  -8.248  -8.635  13.368
    6    HG3  GLU  50           HG3      GLU  50  -7.851  -9.277  14.958

  No H/Q in entry =           6
  In of MODEL   89
    1    H    ALA  51           H        ALA  51  -5.600  -6.266  12.167
    2    HA   ALA  51           HA       ALA  51  -6.583  -8.000  10.149
    3    HB2  ALA  51           HB1      ALA  51  -6.387  -6.184   8.781
    4    HB1  ALA  51           HB2      ALA  51  -4.747  -5.822   9.319
    5    HB3  ALA  51           HB3      ALA  51  -6.129  -5.323  10.297

  No H/Q in entry =           5
  In of MODEL   89
    1    H    HIS  52           H        HIS  52  -3.294  -7.067  11.113
    2    HA   HIS  52           HA       HIS  52  -1.894  -8.541   9.153
    3    HB2  HIS  52           HB2      HIS  52  -0.828  -6.818  10.541
    4    HB3  HIS  52           HB3      HIS  52  -1.050  -7.824  11.972
    5    HD1  HIS  52           HD1      HIS  52   0.143 -10.293  11.785
    6    HD2  HIS  52           HD2      HIS  52   1.540  -7.332   9.203
    7    HE1  HIS  52           HE1      HIS  52   2.407 -11.072  10.957
    8    HE2  HIS  52           HE2      HIS  52   3.271  -9.278   9.383

  No H/Q in entry =           8
  In of MODEL   89
    1    H    LEU  53           H        LEU  53  -3.079  -9.433  12.372
    2    HA   LEU  53           HA       LEU  53  -1.860 -11.968  12.555
    3    HB2  LEU  53           HB2      LEU  53  -4.348 -10.810  13.785
    4    HB3  LEU  53           HB3      LEU  53  -3.872 -12.481  14.074
    5    HG   LEU  53           HG       LEU  53  -1.982 -10.151  14.534
    6   HD11  LEU  53          HD11      LEU  53  -3.923 -11.486  16.439
    7   HD13  LEU  53          HD12      LEU  53  -3.860  -9.781  15.999
    8   HD12  LEU  53          HD13      LEU  53  -2.573 -10.488  16.967
    9   HD23  LEU  53          HD21      LEU  53  -1.075 -11.936  16.216
   10   HD22  LEU  53          HD22      LEU  53  -0.711 -12.138  14.505
   11   HD21  LEU  53          HD23      LEU  53  -1.981 -13.093  15.247

  No H/Q in entry =          11
  In of MODEL   89
    1    H    VAL  54           H        VAL  54  -4.988 -10.961  11.213
    2    HA   VAL  54           HA       VAL  54  -5.886 -13.561  10.528
    3    HB   VAL  54           HB       VAL  54  -6.560 -10.831   9.401
    4   HG12  VAL  54          HG11      VAL  54  -8.657 -12.223   8.600
    5   HG11  VAL  54          HG12      VAL  54  -7.535 -13.581   8.664
    6   HG13  VAL  54          HG13      VAL  54  -7.191 -12.202   7.621
    7   HG22  VAL  54          HG21      VAL  54  -7.454 -10.879  11.558
    8   HG21  VAL  54          HG22      VAL  54  -7.695 -12.624  11.538
    9   HG23  VAL  54          HG23      VAL  54  -8.789 -11.574  10.639

  No H/Q in entry =           9
  In of MODEL   89
    1    H    GLN  55           H        GLN  55  -4.043 -11.093   8.731
    2    HA   GLN  55           HA       GLN  55  -3.917 -12.553   6.310
    3    HB2  GLN  55           HB2      GLN  55  -3.331 -10.284   6.120
    4    HB3  GLN  55           HB3      GLN  55  -2.212 -10.354   7.478
    5    HG2  GLN  55           HG2      GLN  55  -0.496 -11.186   6.190
    6    HG3  GLN  55           HG3      GLN  55  -1.569 -12.168   5.201
    7   HE21  GLN  55          HE21      GLN  55  -1.603 -11.475   3.081
    8   HE22  GLN  55          HE22      GLN  55  -1.420  -9.868   2.572

  No H/Q in entry =           8
  In of MODEL   89
    1    H    THR  56           H        THR  56  -1.794 -12.521   9.178
    2    HA   THR  56           HA       THR  56   0.290 -14.104   8.246
    3    HB   THR  56           HB       THR  56  -0.934 -14.368  11.001
    4    HG1  THR  56           HG1      THR  56   0.366 -12.286   9.744
    5   HG23  THR  56          HG21      THR  56   1.260 -15.005  11.689
    6   HG22  THR  56          HG22      THR  56   1.962 -14.504  10.150
    7   HG21  THR  56          HG23      THR  56   0.928 -15.931  10.226

  No H/Q in entry =           7
  In of MODEL   89
    1    H    LYS  57           H        LYS  57  -2.815 -15.164   9.627
    2    HA   LYS  57           HA       LYS  57  -2.352 -17.956   9.374
    3    HB2  LYS  57           HB2      LYS  57  -4.221 -16.623  10.632
    4    HB3  LYS  57           HB3      LYS  57  -5.056 -16.656   9.086
    5    HG2  LYS  57           HG2      LYS  57  -5.051 -19.077   9.063
    6    HG3  LYS  57           HG3      LYS  57  -4.045 -19.133  10.508
    7    HD2  LYS  57           HD2      LYS  57  -6.279 -19.544  11.254
    8    HD3  LYS  57           HD3      LYS  57  -5.927 -17.876  11.704
    9    HE2  LYS  57           HE2      LYS  57  -7.170 -17.025   9.812
   10    HE3  LYS  57           HE3      LYS  57  -7.354 -18.638   9.126
   11    HZ3  LYS  57           HZ1      LYS  57  -8.838 -19.258  10.776
   12    HZ2  LYS  57           HZ2      LYS  57  -9.289 -17.655  10.435
   13    HZ1  LYS  57           HZ3      LYS  57  -8.371 -18.004  11.822

  No H/Q in entry =          13
  In of MODEL   89
    1    H    LEU  58           H        LEU  58  -3.712 -15.520   7.210
    2    HA   LEU  58           HA       LEU  58  -4.515 -17.347   5.206
    3    HB2  LEU  58           HB2      LEU  58  -3.928 -14.395   5.071
    4    HB3  LEU  58           HB3      LEU  58  -4.594 -15.334   3.734
    5    HG   LEU  58           HG       LEU  58  -5.858 -15.167   6.489
    6   HD11  LEU  58          HD11      LEU  58  -6.184 -13.518   4.002
    7   HD13  LEU  58          HD12      LEU  58  -6.167 -13.013   5.691
    8   HD12  LEU  58          HD13      LEU  58  -7.589 -13.815   5.027
    9   HD22  LEU  58          HD21      LEU  58  -6.813 -17.081   5.623
   10   HD21  LEU  58          HD22      LEU  58  -6.487 -16.625   3.951
   11   HD23  LEU  58          HD23      LEU  58  -7.850 -15.909   4.811

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  59           H        ILE  59  -1.382 -16.117   6.050
    2    HA   ILE  59           HA       ILE  59  -0.295 -16.834   3.406
    3    HB   ILE  59           HB       ILE  59   0.469 -14.764   4.968
    4   HG12  ILE  59          HG12      ILE  59   2.566 -16.407   3.535
    5   HG13  ILE  59          HG13      ILE  59   1.364 -15.475   2.681
    6   HG21  ILE  59          HG21      ILE  59   1.233 -16.545   6.723
    7   HG23  ILE  59          HG22      ILE  59   2.312 -15.214   6.367
    8   HG22  ILE  59          HG23      ILE  59   2.588 -16.800   5.649
    9   HD13  ILE  59          HD11      ILE  59   2.102 -13.424   3.815
   10   HD12  ILE  59          HD12      ILE  59   3.445 -14.180   2.960
   11   HD11  ILE  59          HD13      ILE  59   3.301 -14.356   4.709

  No H/Q in entry =          11
  In of MODEL   89
    1    H    GLU  60           H        GLU  60  -0.279 -17.944   6.772
    2    HA   GLU  60           HA       GLU  60   1.763 -19.909   6.493
    3    HB2  GLU  60           HB2      GLU  60   1.047 -19.165   8.693
    4    HB3  GLU  60           HB3      GLU  60  -0.588 -19.751   8.397
    5    HG2  GLU  60           HG2      GLU  60   1.757 -21.635   8.217
    6    HG3  GLU  60           HG3      GLU  60   1.041 -21.247   9.779

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLY  61           H        GLY  61  -1.750 -20.029   6.027
    2    HA3  GLY  61           HA2      GLY  61  -1.489 -22.819   5.064
    3    HA2  GLY  61           HA3      GLY  61  -2.976 -22.093   5.667

  No H/Q in entry =           3
  In of MODEL   89
    1    H    ASP  62           H        ASP  62  -0.768 -20.499   3.452
    2    HA   ASP  62           HA       ASP  62  -2.818 -19.823   1.627
    3    HB2  ASP  62           HB2      ASP  62  -0.907 -19.055   0.207
    4    HB3  ASP  62           HB3      ASP  62  -0.859 -18.434   1.852

  No H/Q in entry =           4
  In of MODEL   89
    1    H    ALA  63           H        ALA  63  -1.311 -22.807   2.044
    2    HA   ALA  63           HA       ALA  63  -1.226 -23.595  -0.761
    3    HB2  ALA  63           HB1      ALA  63   0.224 -24.498   1.193
    4    HB3  ALA  63           HB2      ALA  63  -0.365 -25.617  -0.037
    5    HB1  ALA  63           HB3      ALA  63  -1.172 -25.525   1.529

  No H/Q in entry =           5
  In of MODEL   89
    1    H    GLY  64           H        GLY  64  -2.427 -25.771  -1.220
    2    HA3  GLY  64           HA2      GLY  64  -4.527 -26.998  -0.488
    3    HA2  GLY  64           HA3      GLY  64  -5.249 -25.399  -0.427

  No H/Q in entry =           3
  In of MODEL   89
    1    H    GLU  65           H        GLU  65  -4.752 -24.148  -2.661
    2    HA   GLU  65           HA       GLU  65  -6.254 -25.545  -4.604
    3    HB2  GLU  65           HB2      GLU  65  -4.628 -23.012  -4.805
    4    HB3  GLU  65           HB3      GLU  65  -5.673 -23.617  -6.090
    5    HG2  GLU  65           HG2      GLU  65  -7.616 -23.509  -4.625
    6    HG3  GLU  65           HG3      GLU  65  -6.602 -23.034  -3.266

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLY  66           H        GLY  66  -2.850 -25.025  -4.207
    2    HA3  GLY  66           HA2      GLY  66  -2.115 -27.235  -5.839
    3    HA2  GLY  66           HA3      GLY  66  -1.771 -25.716  -6.644

  No H/Q in entry =           3
  In of MODEL   89
    1    H    LYS  67           H        LYS  67   0.282 -27.323  -6.247
    2    HA   LYS  67           HA       LYS  67   1.638 -27.242  -3.815
    3    HB2  LYS  67           HB2      LYS  67   2.832 -27.417  -6.582
    4    HB3  LYS  67           HB3      LYS  67   3.579 -27.959  -5.074
    5    HG2  LYS  67           HG2      LYS  67   0.911 -28.973  -6.095
    6    HG3  LYS  67           HG3      LYS  67   2.442 -29.805  -6.361
    7    HD2  LYS  67           HD2      LYS  67   2.716 -29.698  -3.789
    8    HD3  LYS  67           HD3      LYS  67   0.989 -29.338  -3.763
    9    HE2  LYS  67           HE2      LYS  67   0.499 -31.397  -4.976
   10    HE3  LYS  67           HE3      LYS  67   2.220 -31.744  -5.138
   11    HZ3  LYS  67           HZ1      LYS  67   2.404 -32.332  -2.970
   12    HZ2  LYS  67           HZ2      LYS  67   0.782 -32.770  -3.212
   13    HZ1  LYS  67           HZ3      LYS  67   1.164 -31.301  -2.449

  No H/Q in entry =          13
  In of MODEL   89
    1    H    MET  68           H        MET  68   3.123 -25.680  -6.546
    2    HA   MET  68           HA       MET  68   4.524 -23.759  -5.026
    3    HB2  MET  68           HB2      MET  68   4.041 -24.197  -7.951
    4    HB3  MET  68           HB3      MET  68   4.898 -22.762  -7.390
    5    HG2  MET  68           HG2      MET  68   5.659 -25.581  -6.588
    6    HG3  MET  68           HG3      MET  68   6.399 -24.719  -7.939
    7    HE3  MET  68           HE1      MET  68   6.537 -25.485  -4.241
    8    HE2  MET  68           HE2      MET  68   8.209 -24.940  -4.116
    9    HE1  MET  68           HE3      MET  68   7.735 -26.013  -5.431

  No H/Q in entry =           9
  In of MODEL   89
    1    H    LYS  69           H        LYS  69   1.530 -23.492  -6.921
    2    HA   LYS  69           HA       LYS  69   1.390 -20.657  -6.720
    3    HB2  LYS  69           HB2      LYS  69  -0.668 -22.683  -7.545
    4    HB3  LYS  69           HB3      LYS  69  -0.932 -20.936  -7.593
    5    HG2  LYS  69           HG2      LYS  69   1.032 -20.659  -9.041
    6    HG3  LYS  69           HG3      LYS  69   1.330 -22.397  -8.984
    7    HD2  LYS  69           HD2      LYS  69  -0.900 -22.788 -10.011
    8    HD3  LYS  69           HD3      LYS  69  -1.128 -21.042 -10.131
    9    HE2  LYS  69           HE2      LYS  69   1.192 -22.540 -11.381
   10    HE3  LYS  69           HE3      LYS  69  -0.270 -22.078 -12.251
   11    HZ1  LYS  69           HZ1      LYS  69   1.001 -19.952 -10.755
   12    HZ3  LYS  69           HZ2      LYS  69   0.338 -19.939 -12.320
   13    HZ2  LYS  69           HZ3      LYS  69   1.906 -20.542 -12.064

  No H/Q in entry =          13
  In of MODEL   89
    1    H    VAL  70           H        VAL  70  -0.097 -19.312  -5.645
    2    HA   VAL  70           HA       VAL  70  -1.387 -20.457  -3.237
    3    HB   VAL  70           HB       VAL  70  -0.669 -18.448  -1.979
    4   HG12  VAL  70          HG11      VAL  70   1.760 -19.020  -1.852
    5   HG11  VAL  70          HG12      VAL  70   1.568 -20.006  -3.303
    6   HG13  VAL  70          HG13      VAL  70   0.718 -20.443  -1.821
    7   HG22  VAL  70          HG21      VAL  70   1.018 -16.917  -2.960
    8   HG21  VAL  70          HG22      VAL  70  -0.465 -16.905  -3.912
    9   HG23  VAL  70          HG23      VAL  70   0.939 -17.800  -4.486

  No H/Q in entry =           9
  In of MODEL   89
    1    H    SER  71           H        SER  71  -2.875 -18.734  -2.253
    2    HA   SER  71           HA       SER  71  -4.912 -18.048  -4.078
    3    HB2  SER  71           HB2      SER  71  -5.233 -18.334  -1.599
    4    HB3  SER  71           HB3      SER  71  -4.384 -16.812  -1.352
    5    HG   SER  71           HG       SER  71  -6.057 -16.041  -2.982

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LEU  72           H        LEU  72  -5.121 -16.399  -5.412
    2    HA   LEU  72           HA       LEU  72  -3.029 -14.571  -5.904
    3    HB2  LEU  72           HB2      LEU  72  -5.899 -14.647  -6.832
    4    HB3  LEU  72           HB3      LEU  72  -4.719 -13.476  -7.411
    5    HG   LEU  72           HG       LEU  72  -4.279 -16.476  -7.554
    6   HD13  LEU  72          HD11      LEU  72  -6.206 -15.979  -8.926
    7   HD12  LEU  72          HD12      LEU  72  -4.818 -16.159 -10.002
    8   HD11  LEU  72          HD13      LEU  72  -5.418 -14.550  -9.597
    9   HD23  LEU  72          HD21      LEU  72  -2.743 -15.581  -9.482
   10   HD22  LEU  72          HD22      LEU  72  -2.165 -15.441  -7.831
   11   HD21  LEU  72          HD23      LEU  72  -2.861 -14.041  -8.639

  No H/Q in entry =          11
  In of MODEL   89
    1    H    VAL  73           H        VAL  73  -6.114 -14.240  -4.253
    2    HA   VAL  73           HA       VAL  73  -6.177 -11.470  -3.896
    3    HB   VAL  73           HB       VAL  73  -7.876 -11.846  -2.293
    4   HG12  VAL  73          HG11      VAL  73  -8.021 -14.301  -4.042
    5   HG11  VAL  73          HG12      VAL  73  -8.206 -12.680  -4.709
    6   HG13  VAL  73          HG13      VAL  73  -9.342 -13.268  -3.494
    7   HG22  VAL  73          HG21      VAL  73  -7.022 -13.292  -0.679
    8   HG21  VAL  73          HG22      VAL  73  -6.416 -14.434  -1.879
    9   HG23  VAL  73          HG23      VAL  73  -8.141 -14.362  -1.522

  No H/Q in entry =           9
  In of MODEL   89
    1    H    LEU  74           H        LEU  74  -4.211 -13.826  -2.331
    2    HA   LEU  74           HA       LEU  74  -3.791 -12.687   0.192
    3    HB2  LEU  74           HB2      LEU  74  -2.994 -14.898  -0.316
    4    HB3  LEU  74           HB3      LEU  74  -1.955 -14.277  -1.597
    5    HG   LEU  74           HG       LEU  74  -0.641 -13.020   0.075
    6   HD11  LEU  74          HD11      LEU  74  -2.707 -14.203   1.932
    7   HD13  LEU  74          HD12      LEU  74  -2.177 -12.525   1.812
    8   HD12  LEU  74          HD13      LEU  74  -1.111 -13.738   2.520
    9   HD22  LEU  74          HD21      LEU  74   0.589 -14.857   0.675
   10   HD21  LEU  74          HD22      LEU  74  -0.473 -15.585  -0.510
   11   HD23  LEU  74          HD23      LEU  74  -0.827 -15.768   1.192

  No H/Q in entry =          11
  In of MODEL   89
    1    H    VAL  75           H        VAL  75  -1.924 -12.273  -2.778
    2    HA   VAL  75           HA       VAL  75  -0.134 -10.337  -1.776
    3    HB   VAL  75           HB       VAL  75  -1.104 -10.833  -4.592
    4   HG11  VAL  75          HG11      VAL  75   1.157  -9.076  -3.539
    5   HG13  VAL  75          HG12      VAL  75  -0.278  -8.529  -4.392
    6   HG12  VAL  75          HG13      VAL  75   0.922  -9.497  -5.232
    7   HG23  VAL  75          HG21      VAL  75   1.547 -11.484  -3.271
    8   HG22  VAL  75          HG22      VAL  75   0.942 -12.074  -4.820
    9   HG21  VAL  75          HG23      VAL  75   0.202 -12.626  -3.316

  No H/Q in entry =           9
  In of MODEL   89
    1    H    GLU  76           H        GLU  76  -3.298 -10.011  -3.411
    2    HA   GLU  76           HA       GLU  76  -3.372  -7.197  -3.506
    3    HB2  GLU  76           HB2      GLU  76  -5.029  -8.637  -4.663
    4    HB3  GLU  76           HB3      GLU  76  -5.662  -9.158  -3.110
    5    HG2  GLU  76           HG2      GLU  76  -7.147  -7.456  -3.944
    6    HG3  GLU  76           HG3      GLU  76  -6.249  -6.735  -2.624

  No H/Q in entry =           6
  In of MODEL   89
    1    H    ALA  77           H        ALA  77  -4.448  -9.438  -0.963
    2    HA   ALA  77           HA       ALA  77  -5.407  -7.447   0.806
    3    HB2  ALA  77           HB1      ALA  77  -5.999  -9.789   1.107
    4    HB3  ALA  77           HB2      ALA  77  -5.178  -9.202   2.552
    5    HB1  ALA  77           HB3      ALA  77  -4.311 -10.210   1.394

  No H/Q in entry =           5
  In of MODEL   89
    1    H    GLN  78           H        GLN  78  -2.251  -8.972   0.416
    2    HA   GLN  78           HA       GLN  78  -0.986  -7.807   2.660
    3    HB2  GLN  78           HB2      GLN  78  -0.117  -9.739   1.299
    4    HB3  GLN  78           HB3      GLN  78   0.295  -8.592   0.028
    5    HG2  GLN  78           HG2      GLN  78   1.761  -7.381   1.591
    6    HG3  GLN  78           HG3      GLN  78   1.350  -8.523   2.867
    7   HE21  GLN  78          HE21      GLN  78   3.296  -9.696   3.127
    8   HE22  GLN  78          HE22      GLN  78   4.090 -10.499   1.859

  No H/Q in entry =           8
  In of MODEL   89
    1    H    LEU  79           H        LEU  79  -1.383  -6.742  -0.682
    2    HA   LEU  79           HA       LEU  79   0.287  -4.504  -0.676
    3    HB2  LEU  79           HB2      LEU  79  -0.748  -5.313  -2.724
    4    HB3  LEU  79           HB3      LEU  79  -2.350  -4.934  -2.104
    5    HG   LEU  79           HG       LEU  79  -1.822  -2.543  -2.077
    6   HD13  LEU  79          HD11      LEU  79   0.420  -2.285  -1.580
    7   HD12  LEU  79          HD12      LEU  79   0.455  -1.994  -3.318
    8   HD11  LEU  79          HD13      LEU  79   0.924  -3.570  -2.679
    9   HD23  LEU  79          HD21      LEU  79  -1.207  -2.335  -4.633
   10   HD22  LEU  79          HD22      LEU  79  -2.725  -3.094  -4.165
   11   HD21  LEU  79          HD23      LEU  79  -1.349  -4.093  -4.621

  No H/Q in entry =          11
  In of MODEL   89
    1    H    HIS  80           H        HIS  80  -3.172  -4.690   0.174
    2    HA   HIS  80           HA       HIS  80  -3.376  -1.937   0.845
    3    HB2  HIS  80           HB2      HIS  80  -5.060  -4.357   1.171
    4    HB3  HIS  80           HB3      HIS  80  -5.381  -3.021   2.280
    5    HD1  HIS  80           HD1      HIS  80  -7.016  -1.393   1.387
    6    HD2  HIS  80           HD2      HIS  80  -4.833  -3.185  -1.680
    7    HE1  HIS  80           HE1      HIS  80  -7.877  -0.397  -0.784
    8    HE2  HIS  80           HE2      HIS  80  -6.553  -1.484  -2.663

  No H/Q in entry =           8
  In of MODEL   89
    1    H    LEU  81           H        LEU  81  -2.856  -4.833   2.829
    2    HA   LEU  81           HA       LEU  81  -2.834  -3.490   5.315
    3    HB2  LEU  81           HB2      LEU  81  -1.605  -6.098   4.422
    4    HB3  LEU  81           HB3      LEU  81  -1.571  -5.542   6.096
    5    HG   LEU  81           HG       LEU  81  -4.127  -5.806   4.486
    6   HD12  LEU  81          HD11      LEU  81  -4.406  -7.877   6.032
    7   HD11  LEU  81          HD12      LEU  81  -2.653  -7.796   6.205
    8   HD13  LEU  81          HD13      LEU  81  -3.372  -8.027   4.611
    9   HD23  LEU  81          HD21      LEU  81  -4.951  -6.020   6.993
   10   HD22  LEU  81          HD22      LEU  81  -4.640  -4.427   6.304
   11   HD21  LEU  81          HD23      LEU  81  -3.441  -5.183   7.354

  No H/Q in entry =          11
  In of MODEL   89
    1    H    MET  82           H        MET  82  -0.163  -4.374   3.124
    2    HA   MET  82           HA       MET  82   1.927  -3.471   4.794
    3    HB2  MET  82           HB2      MET  82   1.693  -3.808   1.803
    4    HB3  MET  82           HB3      MET  82   3.177  -3.230   2.557
    5    HG2  MET  82           HG2      MET  82   1.790  -5.829   3.286
    6    HG3  MET  82           HG3      MET  82   3.153  -5.709   2.177
    7    HE3  MET  82           HE1      MET  82   6.178  -4.960   4.140
    8    HE2  MET  82           HE2      MET  82   5.243  -3.597   3.531
    9    HE1  MET  82           HE3      MET  82   5.333  -5.084   2.592

  No H/Q in entry =           9
  In of MODEL   89
    1    H    THR  83           H        THR  83   0.078  -1.834   2.254
    2    HA   THR  83           HA       THR  83   1.477   0.622   2.335
    3    HB   THR  83           HB       THR  83  -0.711   1.537   1.367
    4    HG1  THR  83           HG1      THR  83  -2.355   0.231   1.269
    5   HG22  THR  83          HG21      THR  83  -0.446  -0.276  -0.639
    6   HG21  THR  83          HG22      THR  83   1.063  -0.561   0.226
    7   HG23  THR  83          HG23      THR  83   0.688   1.051  -0.383

  No H/Q in entry =           7
  In of MODEL   89
    1    H    SER  84           H        SER  84  -1.512  -0.430   3.956
    2    HA   SER  84           HA       SER  84  -2.011   1.995   5.309
    3    HB2  SER  84           HB2      SER  84  -2.825  -0.848   5.874
    4    HB3  SER  84           HB3      SER  84  -3.318   0.488   6.913
    5    HG   SER  84           HG       SER  84  -3.795   0.177   4.124

  No H/Q in entry =           5
  In of MODEL   89
    1    H    MET  85           H        MET  85  -0.278  -0.930   6.420
    2    HA   MET  85           HA       MET  85   0.256  -0.006   9.023
    3    HB2  MET  85           HB2      MET  85   0.555  -2.346   8.343
    4    HB3  MET  85           HB3      MET  85   1.923  -1.876   7.334
    5    HG2  MET  85           HG2      MET  85   3.119  -1.040   9.317
    6    HG3  MET  85           HG3      MET  85   1.743  -1.465  10.333
    7    HE2  MET  85           HE1      MET  85   2.067  -4.991  11.192
    8    HE1  MET  85           HE2      MET  85   0.841  -3.815  10.722
    9    HE3  MET  85           HE3      MET  85   2.110  -3.353  11.853

  No H/Q in entry =           9
  In of MODEL   89
    1    H    LEU  86           H        LEU  86   2.168   0.265   6.058
    2    HA   LEU  86           HA       LEU  86   4.384   1.584   7.200
    3    HB2  LEU  86           HB2      LEU  86   4.181   0.505   4.891
    4    HB3  LEU  86           HB3      LEU  86   3.362   1.984   4.387
    5    HG   LEU  86           HG       LEU  86   5.391   3.238   5.354
    6   HD11  LEU  86          HD11      LEU  86   6.115   0.628   6.144
    7   HD13  LEU  86          HD12      LEU  86   7.112   2.078   6.237
    8   HD12  LEU  86          HD13      LEU  86   7.216   1.033   4.823
    9   HD23  LEU  86          HD21      LEU  86   6.099   1.482   2.996
   10   HD22  LEU  86          HD22      LEU  86   6.486   3.181   3.258
   11   HD21  LEU  86          HD23      LEU  86   4.833   2.706   2.870

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ALA  87           H        ALA  87   1.454   2.817   5.639
    2    HA   ALA  87           HA       ALA  87   2.036   5.549   5.723
    3    HB1  ALA  87           HB1      ALA  87  -0.270   3.911   5.196
    4    HB3  ALA  87           HB2      ALA  87   0.030   5.574   4.696
    5    HB2  ALA  87           HB3      ALA  87  -0.751   5.247   6.245

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ARG  88           H        ARG  88   0.373   3.535   8.122
    2    HA   ARG  88           HA       ARG  88  -0.135   5.579   9.976
    3    HB2  ARG  88           HB2      ARG  88  -1.062   3.222  10.045
    4    HB3  ARG  88           HB3      ARG  88   0.487   2.729  10.739
    5    HG2  ARG  88           HG2      ARG  88   0.012   4.798  12.366
    6    HG3  ARG  88           HG3      ARG  88  -1.656   4.466  11.921
    7    HD2  ARG  88           HD2      ARG  88  -1.746   2.614  13.166
    8    HD3  ARG  88           HD3      ARG  88  -0.157   2.041  12.622
    9    HE   ARG  88           HE       ARG  88  -0.679   3.297  15.082
   10   HH21  ARG  88          HH11      ARG  88   0.883   4.315  16.311
   11   HH22  ARG  88          HH12      ARG  88   2.395   4.750  15.596
   12   HH11  ARG  88          HH21      ARG  88   1.582   3.494  12.489
   13   HH12  ARG  88          HH22      ARG  88   2.799   4.269  13.443

  No H/Q in entry =          13
  In of MODEL   89
    1    H    GLU  89           H        GLU  89   2.671   3.375   9.729
    2    HA   GLU  89           HA       GLU  89   3.945   4.266  12.065
    3    HB2  GLU  89           HB2      GLU  89   4.604   2.253  10.713
    4    HB3  GLU  89           HB3      GLU  89   5.366   3.353   9.562
    5    HG2  GLU  89           HG2      GLU  89   6.859   4.205  11.297
    6    HG3  GLU  89           HG3      GLU  89   6.038   3.242  12.521

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LEU  90           H        LEU  90   4.232   5.431   8.737
    2    HA   LEU  90           HA       LEU  90   6.156   7.440   9.311
    3    HB2  LEU  90           HB2      LEU  90   4.135   7.102   7.098
    4    HB3  LEU  90           HB3      LEU  90   5.359   8.379   7.112
    5    HG   LEU  90           HG       LEU  90   6.051   5.445   7.436
    6   HD12  LEU  90          HD11      LEU  90   6.780   5.687   4.992
    7   HD11  LEU  90          HD12      LEU  90   5.757   7.122   4.953
    8   HD13  LEU  90          HD13      LEU  90   5.048   5.544   5.298
    9   HD22  LEU  90          HD21      LEU  90   7.947   6.604   8.106
   10   HD21  LEU  90          HD22      LEU  90   7.582   8.009   7.104
   11   HD23  LEU  90          HD23      LEU  90   8.244   6.549   6.370

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  91           H        ILE  91   2.616   7.436   9.188
    2    HA   ILE  91           HA       ILE  91   2.261  10.206   9.645
    3    HB   ILE  91           HB       ILE  91   0.487   7.819  10.197
    4   HG12  ILE  91          HG12      ILE  91   0.212  10.102   8.218
    5   HG13  ILE  91          HG13      ILE  91   1.078   8.614   7.837
    6   HG22  ILE  91          HG21      ILE  91  -1.256   9.867  10.276
    7   HG21  ILE  91          HG22      ILE  91   0.145  10.705  10.940
    8   HG23  ILE  91          HG23      ILE  91  -0.478   9.263  11.739
    9   HD13  ILE  91          HD11      ILE  91  -0.859   7.315   7.893
   10   HD12  ILE  91          HD12      ILE  91  -1.462   8.827   7.218
   11   HD11  ILE  91          HD13      ILE  91  -1.718   8.459   8.924

  No H/Q in entry =          11
  In of MODEL   89
    1    H    THR  92           H        THR  92   2.696   7.464  11.839
    2    HA   THR  92           HA       THR  92   2.262   8.831  14.268
    3    HB   THR  92           HB       THR  92   4.080   6.509  13.587
    4    HG1  THR  92           HG1      THR  92   2.115   5.740  13.500
    5   HG22  THR  92          HG21      THR  92   3.717   6.219  16.223
    6   HG21  THR  92          HG22      THR  92   3.641   7.978  16.153
    7   HG23  THR  92          HG23      THR  92   5.075   7.132  15.569

  No H/Q in entry =           7
  In of MODEL   89
    1    H    GLU  93           H        GLU  93   5.202   8.404  12.313
    2    HA   GLU  93           HA       GLU  93   6.958   9.840  14.000
    3    HB2  GLU  93           HB2      GLU  93   7.027   9.530  10.984
    4    HB3  GLU  93           HB3      GLU  93   8.371  10.068  11.989
    5    HG2  GLU  93           HG2      GLU  93   6.983   7.421  12.443
    6    HG3  GLU  93           HG3      GLU  93   8.358   7.584  11.358

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LEU  94           H        LEU  94   4.884  10.845  11.303
    2    HA   LEU  94           HA       LEU  94   5.669  13.554  11.201
    3    HB2  LEU  94           HB2      LEU  94   3.083  12.172  10.463
    4    HB3  LEU  94           HB3      LEU  94   3.328  13.902  10.222
    5    HG   LEU  94           HG       LEU  94   5.352  11.929   9.155
    6   HD11  LEU  94          HD11      LEU  94   2.599  12.462   8.113
    7   HD13  LEU  94          HD12      LEU  94   3.592  11.013   7.978
    8   HD12  LEU  94          HD13      LEU  94   3.910  12.397   6.933
    9   HD23  LEU  94          HD21      LEU  94   5.577  13.769   7.433
   10   HD22  LEU  94          HD22      LEU  94   6.000  14.263   9.073
   11   HD21  LEU  94          HD23      LEU  94   4.441  14.721   8.386

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  95           H        ILE  95   3.156  11.917  13.107
    2    HA   ILE  95           HA       ILE  95   2.105  14.258  14.312
    3    HB   ILE  95           HB       ILE  95   2.149  11.375  15.233
    4   HG12  ILE  95          HG12      ILE  95  -0.091  13.133  14.201
    5   HG13  ILE  95          HG13      ILE  95   0.866  12.082  13.161
    6   HG21  ILE  95          HG21      ILE  95   0.857  13.836  16.447
    7   HG23  ILE  95          HG22      ILE  95   1.919  12.674  17.243
    8   HG22  ILE  95          HG23      ILE  95   0.285  12.202  16.778
    9   HD13  ILE  95          HD11      ILE  95  -0.016  10.136  14.084
   10   HD12  ILE  95          HD12      ILE  95  -1.406  11.215  14.171
   11   HD11  ILE  95          HD13      ILE  95  -0.429  10.922  15.609

  No H/Q in entry =          11
  In of MODEL   89
    1    H    GLU  96           H        GLU  96   4.723  12.058  15.287
    2    HA   GLU  96           HA       GLU  96   5.286  13.258  17.777
    3    HB2  GLU  96           HB2      GLU  96   6.247  11.107  17.120
    4    HB3  GLU  96           HB3      GLU  96   7.165  11.889  15.835
    5    HG2  GLU  96           HG2      GLU  96   8.819  12.449  17.287
    6    HG3  GLU  96           HG3      GLU  96   7.673  13.251  18.351

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LEU  97           H        LEU  97   6.332  14.042  14.485
    2    HA   LEU  97           HA       LEU  97   8.207  16.053  15.186
    3    HB2  LEU  97           HB2      LEU  97   6.603  15.493  12.701
    4    HB3  LEU  97           HB3      LEU  97   7.611  16.933  12.818
    5    HG   LEU  97           HG       LEU  97   8.667  14.143  13.367
    6   HD12  LEU  97          HD11      LEU  97   9.647  14.348  11.044
    7   HD11  LEU  97          HD12      LEU  97   8.582  15.730  10.789
    8   HD13  LEU  97          HD13      LEU  97   7.898  14.132  11.086
    9   HD23  LEU  97          HD21      LEU  97  10.821  15.441  12.612
   10   HD22  LEU  97          HD22      LEU  97  10.210  15.703  14.245
   11   HD21  LEU  97          HD23      LEU  97   9.878  16.885  12.980

  No H/Q in entry =          11
  In of MODEL   89
    1    H    HIS  98           H        HIS  98   4.710  16.159  14.555
    2    HA   HIS  98           HA       HIS  98   4.388  18.956  14.696
    3    HB2  HIS  98           HB2      HIS  98   2.522  16.689  15.432
    4    HB3  HIS  98           HB3      HIS  98   2.041  18.385  15.493
    5    HD1  HIS  98           HD1      HIS  98   3.069  15.682  13.078
    6    HD2  HIS  98           HD2      HIS  98   1.659  19.603  12.970
    7    HE1  HIS  98           HE1      HIS  98   2.490  16.168  10.658
    8    HE2  HIS  98           HE2      HIS  98   1.634  18.551  10.571

  No H/Q in entry =           8
  In of MODEL   89
    1    H    GLU  99           H        GLU  99   4.559  16.466  17.191
    2    HA   GLU  99           HA       GLU  99   3.951  18.153  19.395
    3    HB2  GLU  99           HB2      GLU  99   3.884  15.670  19.490
    4    HB3  GLU  99           HB3      GLU  99   5.644  15.640  19.370
    5    HG2  GLU  99           HG2      GLU  99   5.835  16.931  21.444
    6    HG3  GLU  99           HG3      GLU  99   4.082  17.057  21.552

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LYS 100           H        LYS 100   7.002  17.250  17.809
    2    HA   LYS 100           HA       LYS 100   8.658  18.663  19.656
    3    HB2  LYS 100           HB2      LYS 100   9.145  17.746  16.813
    4    HB3  LYS 100           HB3      LYS 100  10.375  18.525  17.813
    5    HG2  LYS 100           HG2      LYS 100  10.026  16.769  19.555
    6    HG3  LYS 100           HG3      LYS 100   8.893  15.957  18.470
    7    HD2  LYS 100           HD2      LYS 100  10.678  15.692  16.791
    8    HD3  LYS 100           HD3      LYS 100  11.815  16.516  17.861
    9    HE2  LYS 100           HE2      LYS 100  11.446  14.755  19.579
   10    HE3  LYS 100           HE3      LYS 100  10.371  13.911  18.460
   11    HZ1  LYS 100           HZ1      LYS 100  13.181  14.606  17.787
   12    HZ3  LYS 100           HZ2      LYS 100  12.140  13.543  16.964
   13    HZ2  LYS 100           HZ3      LYS 100  12.743  13.127  18.498

  No H/Q in entry =          13
  In of MODEL   89
    1    H    LEU 101           H        LEU 101   6.936  19.578  16.713
    2    HA   LEU 101           HA       LEU 101   8.126  22.146  16.373
    3    HB2  LEU 101           HB2      LEU 101   5.535  20.892  15.502
    4    HB3  LEU 101           HB3      LEU 101   5.770  22.625  15.295
    5    HG   LEU 101           HG       LEU 101   7.817  20.627  14.313
    6   HD12  LEU 101          HD11      LEU 101   6.644  21.126  12.037
    7   HD11  LEU 101          HD12      LEU 101   5.248  21.543  13.027
    8   HD13  LEU 101          HD13      LEU 101   5.926  19.918  13.102
    9   HD21  LEU 101          HD21      LEU 101   7.161  23.535  13.766
   10   HD23  LEU 101          HD22      LEU 101   8.142  22.584  12.651
   11   HD22  LEU 101          HD23      LEU 101   8.693  22.845  14.306

  No H/Q in entry =          11
  In of MODEL   89
    1    H    LYS 102           H        LYS 102   6.616  20.992  18.998
    2    HA   LYS 102           HA       LYS 102   5.988  22.076  20.935
    3    HB2  LYS 102           HB2      LYS 102   7.246  24.078  19.805
    4    HB3  LYS 102           HB3      LYS 102   5.640  24.670  19.441
    5    HG2  LYS 102           HG2      LYS 102   7.037  24.422  22.083
    6    HG3  LYS 102           HG3      LYS 102   6.069  25.744  21.463
    7    HD2  LYS 102           HD2      LYS 102   4.853  23.096  22.346
    8    HD3  LYS 102           HD3      LYS 102   5.098  24.458  23.430
    9    HE2  LYS 102           HE2      LYS 102   2.812  24.038  21.956
   10    HE3  LYS 102           HE3      LYS 102   3.307  25.587  22.636
   11    HZ2  LYS 102           HZ1      LYS 102   2.759  25.693  20.261
   12    HZ1  LYS 102           HZ2      LYS 102   4.027  24.622  19.928
   13    HZ3  LYS 102           HZ3      LYS 102   4.362  26.155  20.570

  No H/Q in entry =          13
  In of MODEL   89
    1    H    ALA 103           H        ALA 103   4.319  23.609  18.181
    2    HA   ALA 103           HA       ALA 103   1.866  24.164  19.084
    3    HB1  ALA 103           HB1      ALA 103   0.959  23.318  16.846
    4    HB2  ALA 103           HB2      ALA 103   2.608  22.795  16.505
    5    HB3  ALA 103           HB3      ALA 103   2.262  24.504  16.776

  No H/Q in entry =           5
  In of MODEL   89
    1    H1   ALA   1           H3       ALA   1  10.654 -20.230  -6.311
    2    H2   ALA   1           H2       ALA   1   9.682 -20.442  -7.690
    3    H3   ALA   1           H1       ALA   1   9.260 -21.194  -6.225
    4    HA   ALA   1           HA       ALA   1  10.308 -22.994  -6.975
    5    HB1  ALA   1           HB1      ALA   1  10.385 -22.631  -9.250
    6    HB2  ALA   1           HB2      ALA   1  12.114 -22.468  -8.933
    7    HB3  ALA   1           HB3      ALA   1  11.103 -21.028  -9.075

  No H/Q in entry =           7
  In of MODEL   89
    1    H    GLU   2           H        GLU   2  12.599 -23.927  -7.050
    2    HA   GLU   2           HA       GLU   2  13.995 -23.838  -4.848
    3    HB2  GLU   2           HB2      GLU   2  15.331 -23.693  -7.556
    4    HB3  GLU   2           HB3      GLU   2  16.074 -24.301  -6.077
    5    HG2  GLU   2           HG2      GLU   2  15.071 -26.324  -6.314
    6    HG3  GLU   2           HG3      GLU   2  13.492 -25.590  -6.560

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLU   3           H        GLU   3  15.736 -21.957  -7.259
    2    HA   GLU   3           HA       GLU   3  16.890 -20.264  -5.305
    3    HB2  GLU   3           HB2      GLU   3  16.813 -20.258  -8.314
    4    HB3  GLU   3           HB3      GLU   3  17.555 -18.925  -7.431
    5    HG2  GLU   3           HG2      GLU   3  19.234 -20.288  -6.522
    6    HG3  GLU   3           HG3      GLU   3  18.297 -21.762  -6.738

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LEU   4           H        LEU   4  14.583 -19.429  -7.918
    2    HA   LEU   4           HA       LEU   4  14.102 -16.825  -7.300
    3    HB2  LEU   4           HB2      LEU   4  11.936 -18.814  -8.017
    4    HB3  LEU   4           HB3      LEU   4  11.847 -17.066  -8.213
    5    HG   LEU   4           HG       LEU   4  13.815 -18.913  -9.602
    6   HD13  LEU   4          HD11      LEU   4  12.499 -18.770 -11.503
    7   HD12  LEU   4          HD12      LEU   4  11.783 -17.231 -11.028
    8   HD11  LEU   4          HD13      LEU   4  11.246 -18.727 -10.265
    9   HD23  LEU   4          HD21      LEU   4  14.126 -16.663 -10.953
   10   HD22  LEU   4          HD22      LEU   4  14.998 -16.901  -9.440
   11   HD21  LEU   4          HD23      LEU   4  13.538 -15.916  -9.467

  No H/Q in entry =          11
  In of MODEL   89
    1    H    GLU   5           H        GLU   5  12.649 -19.622  -5.651
    2    HA   GLU   5           HA       GLU   5  10.973 -18.065  -3.934
    3    HB2  GLU   5           HB2      GLU   5  10.560 -20.444  -4.454
    4    HB3  GLU   5           HB3      GLU   5  12.005 -20.873  -3.537
    5    HG2  GLU   5           HG2      GLU   5  11.049 -19.857  -1.518
    6    HG3  GLU   5           HG3      GLU   5   9.614 -19.383  -2.426

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLU   6           H        GLU   6  14.134 -19.622  -3.516
    2    HA   GLU   6           HA       GLU   6  14.500 -18.767  -0.819
    3    HB2  GLU   6           HB2      GLU   6  15.733 -20.671  -1.821
    4    HB3  GLU   6           HB3      GLU   6  16.579 -19.542  -2.881
    5    HG2  GLU   6           HG2      GLU   6  17.496 -18.374  -0.915
    6    HG3  GLU   6           HG3      GLU   6  16.648 -19.495   0.150

  No H/Q in entry =           6
  In of MODEL   89
    1    H    VAL   7           H        VAL   7  15.233 -17.430  -3.972
    2    HA   VAL   7           HA       VAL   7  16.909 -15.292  -3.116
    3    HB   VAL   7           HB       VAL   7  15.188 -15.665  -5.582
    4   HG11  VAL   7          HG11      VAL   7  17.070 -13.439  -4.780
    5   HG13  VAL   7          HG12      VAL   7  15.423 -13.308  -5.391
    6   HG12  VAL   7          HG13      VAL   7  16.728 -13.799  -6.472
    7   HG21  VAL   7          HG21      VAL   7  17.310 -17.107  -5.030
    8   HG23  VAL   7          HG22      VAL   7  18.201 -15.638  -5.433
    9   HG22  VAL   7          HG23      VAL   7  17.162 -16.394  -6.638

  No H/Q in entry =           9
  In of MODEL   89
    1    H    VAL   8           H        VAL   8  13.415 -15.588  -3.648
    2    HA   VAL   8           HA       VAL   8  12.731 -12.886  -3.168
    3    HB   VAL   8           HB       VAL   8  11.146 -15.431  -2.734
    4   HG12  VAL   8          HG11      VAL   8   9.189 -13.749  -2.864
    5   HG11  VAL   8          HG12      VAL   8  10.391 -12.514  -2.492
    6   HG13  VAL   8          HG13      VAL   8  10.091 -13.824  -1.351
    7   HG23  VAL   8          HG21      VAL   8  10.446 -13.504  -4.893
    8   HG22  VAL   8          HG22      VAL   8  10.515 -15.263  -4.936
    9   HG21  VAL   8          HG23      VAL   8  11.992 -14.322  -5.107

  No H/Q in entry =           9
  In of MODEL   89
    1    H    MET   9           H        MET   9  13.036 -15.693  -0.994
    2    HA   MET   9           HA       MET   9  12.228 -14.431   1.384
    3    HB2  MET   9           HB2      MET   9  14.101 -16.713   0.794
    4    HB3  MET   9           HB3      MET   9  13.911 -16.111   2.442
    5    HG2  MET   9           HG2      MET   9  11.374 -16.353   2.045
    6    HG3  MET   9           HG3      MET   9  11.817 -17.329   0.644
    7    HE1  MET   9           HE1      MET   9  12.795 -19.391   0.539
    8    HE3  MET   9           HE2      MET   9  13.296 -20.471   1.838
    9    HE2  MET   9           HE3      MET   9  14.312 -19.102   1.399

  No H/Q in entry =           9
  In of MODEL   89
    1    H    GLY  10           H        GLY  10  15.399 -14.627  -0.196
    2    HA3  GLY  10           HA2      GLY  10  16.860 -13.197   1.766
    3    HA2  GLY  10           HA3      GLY  10  17.313 -13.356   0.069

  No H/Q in entry =           3
  In of MODEL   89
    1    H    LEU  11           H        LEU  11  15.125 -12.151  -1.153
    2    HA   LEU  11           HA       LEU  11  15.787  -9.401  -0.991
    3    HB2  LEU  11           HB2      LEU  11  13.423 -10.829  -2.211
    4    HB3  LEU  11           HB3      LEU  11  13.688  -9.092  -2.370
    5    HG   LEU  11           HG       LEU  11  15.728 -11.182  -3.175
    6   HD13  LEU  11          HD11      LEU  11  13.974 -11.562  -4.684
    7   HD12  LEU  11          HD12      LEU  11  14.961 -10.371  -5.529
    8   HD11  LEU  11          HD13      LEU  11  13.489  -9.866  -4.700
    9   HD22  LEU  11          HD21      LEU  11  16.943  -9.208  -2.956
   10   HD21  LEU  11          HD22      LEU  11  15.557  -8.183  -3.323
   11   HD23  LEU  11          HD23      LEU  11  16.386  -9.042  -4.619

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  12           H        ILE  12  13.044 -11.253   0.293
    2    HA   ILE  12           HA       ILE  12  11.638  -9.044   1.366
    3    HB   ILE  12           HB       ILE  12  11.708 -11.926   2.314
    4   HG12  ILE  12          HG12      ILE  12  11.005 -11.307  -0.130
    5   HG13  ILE  12          HG13      ILE  12   9.987 -12.398   0.789
    6   HG22  ILE  12          HG21      ILE  12   9.400 -11.339   3.209
    7   HG21  ILE  12          HG22      ILE  12   9.796  -9.647   2.911
    8   HG23  ILE  12          HG23      ILE  12  10.746 -10.585   4.061
    9   HD12  ILE  12          HD11      ILE  12   8.723 -10.626  -0.439
   10   HD11  ILE  12          HD12      ILE  12   9.550  -9.412   0.534
   11   HD13  ILE  12          HD13      ILE  12   8.473 -10.562   1.296

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  13           H        ILE  13  14.062 -11.228   2.752
    2    HA   ILE  13           HA       ILE  13  14.104 -10.052   5.334
    3    HB   ILE  13           HB       ILE  13  16.172 -11.597   3.752
    4   HG12  ILE  13          HG12      ILE  13  13.919 -12.607   4.575
    5   HG13  ILE  13          HG13      ILE  13  15.405 -13.501   4.877
    6   HG22  ILE  13          HG21      ILE  13  17.268 -11.946   6.029
    7   HG21  ILE  13          HG22      ILE  13  16.287 -10.612   6.619
    8   HG23  ILE  13          HG23      ILE  13  17.463 -10.337   5.335
    9   HD13  ILE  13          HD11      ILE  13  15.319 -13.126   7.164
   10   HD12  ILE  13          HD12      ILE  13  13.599 -13.020   6.808
   11   HD11  ILE  13          HD13      ILE  13  14.554 -11.551   6.967

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ASN  14           H        ASN  14  16.032  -9.497   2.402
    2    HA   ASN  14           HA       ASN  14  17.763  -7.539   3.455
    3    HB2  ASN  14           HB2      ASN  14  17.738  -8.802   1.137
    4    HB3  ASN  14           HB3      ASN  14  16.826  -7.394   0.609
    5   HD21  ASN  14          HD21      ASN  14  19.262  -7.706  -0.594
    6   HD22  ASN  14          HD22      ASN  14  20.397  -6.611   0.027

  No H/Q in entry =           6
  In of MODEL   89
    1    H    SER  15           H        SER  15  14.637  -7.223   1.784
    2    HA   SER  15           HA       SER  15  14.494  -4.404   1.846
    3    HB2  SER  15           HB2      SER  15  12.159  -4.676   1.369
    4    HB3  SER  15           HB3      SER  15  12.968  -6.028   0.586
    5    HG   SER  15           HG       SER  15  11.497  -7.083   1.702

  No H/Q in entry =           5
  In of MODEL   89
    1    H    GLY  16           H        GLY  16  13.444  -6.879   4.153
    2    HA3  GLY  16           HA2      GLY  16  12.216  -5.147   6.021
    3    HA2  GLY  16           HA3      GLY  16  12.851  -6.748   6.377

  No H/Q in entry =           3
  In of MODEL   89
    1    H    GLN  17           H        GLN  17  15.555  -6.384   5.767
    2    HA   GLN  17           HA       GLN  17  16.513  -5.155   8.143
    3    HB2  GLN  17           HB2      GLN  17  17.770  -6.924   6.971
    4    HB3  GLN  17           HB3      GLN  17  18.020  -5.843   5.601
    5    HG2  GLN  17           HG2      GLN  17  19.291  -4.300   6.990
    6    HG3  GLN  17           HG3      GLN  17  18.954  -5.266   8.426
    7   HE21  GLN  17          HE21      GLN  17  21.645  -4.760   7.605
    8   HE22  GLN  17          HE22      GLN  17  22.330  -6.222   7.083

  No H/Q in entry =           8
  In of MODEL   89
    1    H    ALA  18           H        ALA  18  16.289  -4.075   4.785
    2    HA   ALA  18           HA       ALA  18  17.699  -1.666   5.006
    3    HB2  ALA  18           HB1      ALA  18  16.581  -2.891   2.944
    4    HB3  ALA  18           HB2      ALA  18  16.825  -1.145   2.930
    5    HB1  ALA  18           HB3      ALA  18  15.236  -1.810   3.309

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ARG  19           H        ARG  19  14.209  -2.296   5.426
    2    HA   ARG  19           HA       ARG  19  13.514   0.345   6.149
    3    HB2  ARG  19           HB2      ARG  19  11.850  -1.425   5.571
    4    HB3  ARG  19           HB3      ARG  19  12.212  -2.221   7.105
    5    HG2  ARG  19           HG2      ARG  19  11.486  -0.240   8.352
    6    HG3  ARG  19           HG3      ARG  19  11.215   0.635   6.846
    7    HD2  ARG  19           HD2      ARG  19   9.089  -0.188   7.679
    8    HD3  ARG  19           HD3      ARG  19   9.509  -1.060   6.199
    9    HE   ARG  19           HE       ARG  19  10.499  -2.594   8.295
   10   HH21  ARG  19          HH11      ARG  19   9.276  -4.250   9.240
   11   HH22  ARG  19          HH12      ARG  19   7.555  -4.243   9.081
   12   HH11  ARG  19          HH21      ARG  19   7.483  -1.335   7.222
   13   HH12  ARG  19          HH22      ARG  19   6.540  -2.593   7.934

  No H/Q in entry =          13
  In of MODEL   89
    1    H    SER  20           H        SER  20  14.419  -2.477   8.098
    2    HA   SER  20           HA       SER  20  14.139  -1.385  10.639
    3    HB2  SER  20           HB2      SER  20  14.632  -3.704  10.512
    4    HB3  SER  20           HB3      SER  20  16.074  -3.423   9.538
    5    HG   SER  20           HG       SER  20  16.871  -2.243  11.431

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LEU  21           H        LEU  21  16.967  -1.287   8.484
    2    HA   LEU  21           HA       LEU  21  18.635   0.217  10.214
    3    HB2  LEU  21           HB2      LEU  21  18.597  -0.052   7.200
    4    HB3  LEU  21           HB3      LEU  21  19.847   0.823   8.082
    5    HG   LEU  21           HG       LEU  21  19.147  -2.076   8.626
    6   HD12  LEU  21          HD11      LEU  21  21.227  -2.590   7.346
    7   HD11  LEU  21          HD12      LEU  21  21.329  -0.894   6.880
    8   HD13  LEU  21          HD13      LEU  21  19.970  -1.876   6.335
    9   HD23  LEU  21          HD21      LEU  21  21.649  -1.871   9.486
   10   HD22  LEU  21          HD22      LEU  21  20.335  -1.330  10.523
   11   HD21  LEU  21          HD23      LEU  21  21.265  -0.157   9.605

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ALA  22           H        ALA  22  16.343   1.163   7.674
    2    HA   ALA  22           HA       ALA  22  16.850   3.927   7.689
    3    HB3  ALA  22           HB1      ALA  22  15.451   2.671   6.018
    4    HB2  ALA  22           HB2      ALA  22  14.730   4.174   6.591
    5    HB1  ALA  22           HB3      ALA  22  14.162   2.627   7.220

  No H/Q in entry =           5
  In of MODEL   89
    1    H    TYR  23           H        TYR  23  14.386   2.079   9.537
    2    HA   TYR  23           HA       TYR  23  13.407   4.303  10.996
    3    HB2  TYR  23           HB2      TYR  23  12.195   2.176  10.980
    4    HB3  TYR  23           HB3      TYR  23  13.542   1.378  11.793
    5    HD1  TYR  23           HD1      TYR  23  11.013   4.095  12.182
    6    HD2  TYR  23           HD2      TYR  23  13.753   1.435  14.148
    7    HE1  TYR  23           HE1      TYR  23  10.092   4.773  14.385
    8    HE2  TYR  23           HE2      TYR  23  12.833   2.112  16.349
    9    HH   TYR  23           HH       TYR  23  11.189   4.757  16.917

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ALA  24           H        ALA  24  16.082   2.057  11.612
    2    HA   ALA  24           HA       ALA  24  16.758   3.056  14.173
    3    HB1  ALA  24           HB1      ALA  24  18.133   1.279  13.997
    4    HB3  ALA  24           HB2      ALA  24  19.143   2.214  12.893
    5    HB2  ALA  24           HB3      ALA  24  17.856   1.191  12.258

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ALA  25           H        ALA  25  17.683   4.001  10.890
    2    HA   ALA  25           HA       ALA  25  19.610   5.956  11.526
    3    HB1  ALA  25           HB1      ALA  25  18.890   5.003   9.214
    4    HB3  ALA  25           HB2      ALA  25  19.373   6.696   9.306
    5    HB2  ALA  25           HB3      ALA  25  17.662   6.270   9.247

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LEU  26           H        LEU  26  16.091   6.146  11.187
    2    HA   LEU  26           HA       LEU  26  15.839   8.925  11.644
    3    HB2  LEU  26           HB2      LEU  26  13.985   7.670  10.726
    4    HB3  LEU  26           HB3      LEU  26  13.915   6.639  12.151
    5    HG   LEU  26           HG       LEU  26  13.296   8.588  13.538
    6   HD12  LEU  26          HD11      LEU  26  12.604  10.684  12.220
    7   HD11  LEU  26          HD12      LEU  26  13.583  10.043  10.903
    8   HD13  LEU  26          HD13      LEU  26  14.334  10.434  12.451
    9   HD21  LEU  26          HD21      LEU  26  11.608   8.261  11.038
   10   HD23  LEU  26          HD22      LEU  26  11.050   8.950  12.560
   11   HD22  LEU  26          HD23      LEU  26  11.520   7.254  12.484

  No H/Q in entry =          11
  In of MODEL   89
    1    H    LYS  27           H        LYS  27  15.775   6.141  13.834
    2    HA   LYS  27           HA       LYS  27  15.183   7.497  16.208
    3    HB2  LYS  27           HB2      LYS  27  15.236   5.022  15.939
    4    HB3  LYS  27           HB3      LYS  27  16.998   5.094  15.884
    5    HG2  LYS  27           HG2      LYS  27  17.052   6.076  18.135
    6    HG3  LYS  27           HG3      LYS  27  15.285   6.076  18.192
    7    HD2  LYS  27           HD2      LYS  27  15.284   3.609  17.951
    8    HD3  LYS  27           HD3      LYS  27  17.049   3.617  17.928
    9    HE2  LYS  27           HE2      LYS  27  17.087   4.603  20.186
   10    HE3  LYS  27           HE3      LYS  27  15.321   4.625  20.212
   11    HZ3  LYS  27           HZ1      LYS  27  16.137   2.679  21.355
   12    HZ2  LYS  27           HZ2      LYS  27  17.049   2.212  19.997
   13    HZ1  LYS  27           HZ3      LYS  27  15.351   2.199  19.928

  No H/Q in entry =          13
  In of MODEL   89
    1    H    GLN  28           H        GLN  28  18.295   6.949  14.595
    2    HA   GLN  28           HA       GLN  28  19.981   8.046  16.576
    3    HB2  GLN  28           HB2      GLN  28  20.248   8.003  13.559
    4    HB3  GLN  28           HB3      GLN  28  21.537   8.495  14.658
    5    HG2  GLN  28           HG2      GLN  28  20.151   5.801  14.750
    6    HG3  GLN  28           HG3      GLN  28  21.700   6.095  13.963
    7   HE21  GLN  28          HE21      GLN  28  22.836   7.899  15.895
    8   HE22  GLN  28          HE22      GLN  28  23.094   7.034  17.332

  No H/Q in entry =           8
  In of MODEL   89
    1    H    ALA  29           H        ALA  29  18.197   9.516  13.898
    2    HA   ALA  29           HA       ALA  29  19.173  12.146  14.148
    3    HB2  ALA  29           HB1      ALA  29  17.459  12.769  12.689
    4    HB1  ALA  29           HB2      ALA  29  16.330  11.583  13.346
    5    HB3  ALA  29           HB3      ALA  29  17.659  11.055  12.313

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LYS  30           H        LYS  30  16.421  10.518  15.685
    2    HA   LYS  30           HA       LYS  30  15.395  12.760  17.052
    3    HB2  LYS  30           HB2      LYS  30  15.315   9.817  17.752
    4    HB3  LYS  30           HB3      LYS  30  14.443  11.058  18.653
    5    HG2  LYS  30           HG2      LYS  30  13.299  11.737  16.543
    6    HG3  LYS  30           HG3      LYS  30  14.110  10.409  15.709
    7    HD2  LYS  30           HD2      LYS  30  13.062   8.790  17.242
    8    HD3  LYS  30           HD3      LYS  30  12.261  10.107  18.100
    9    HE2  LYS  30           HE2      LYS  30  11.074  10.732  16.016
   10    HE3  LYS  30           HE3      LYS  30  11.855   9.387  15.178
   11    HZ2  LYS  30           HZ1      LYS  30   9.556   8.956  16.072
   12    HZ1  LYS  30           HZ2      LYS  30  10.234   9.012  17.635
   13    HZ3  LYS  30           HZ3      LYS  30  10.745   7.833  16.519

  No H/Q in entry =          13
  In of MODEL   89
    1    H    GLN  31           H        GLN  31  18.080  10.612  17.768
    2    HA   GLN  31           HA       GLN  31  18.416  11.625  20.462
    3    HB2  GLN  31           HB2      GLN  31  20.442  10.075  18.841
    4    HB3  GLN  31           HB3      GLN  31  20.318  10.195  20.597
    5    HG2  GLN  31           HG2      GLN  31  17.808   9.222  19.843
    6    HG3  GLN  31           HG3      GLN  31  18.910   8.389  18.754
    7   HE21  GLN  31          HE21      GLN  31  17.392   7.226  21.038
    8   HE22  GLN  31          HE22      GLN  31  18.560   6.573  22.080

  No H/Q in entry =           8
  In of MODEL   89
    1    H    GLY  32           H        GLY  32  18.904  12.952  17.494
    2    HA3  GLY  32           HA2      GLY  32  19.867  15.007  16.977
    3    HA2  GLY  32           HA3      GLY  32  20.635  15.015  18.560

  No H/Q in entry =           3
  In of MODEL   89
    1    H    ASP  33           H        ASP  33  21.071  12.130  16.776
    2    HA   ASP  33           HA       ASP  33  23.887  12.830  16.292
    3    HB2  ASP  33           HB2      ASP  33  22.402  10.201  16.414
    4    HB3  ASP  33           HB3      ASP  33  24.084  10.333  15.908

  No H/Q in entry =           4
  In of MODEL   89
    1    H    PHE  34           H        PHE  34  23.382  14.152  14.416
    2    HA   PHE  34           HA       PHE  34  22.026  13.160  12.136
    3    HB2  PHE  34           HB2      PHE  34  24.140  15.313  12.356
    4    HB3  PHE  34           HB3      PHE  34  23.148  15.016  10.930
    5    HD1  PHE  34           HD1      PHE  34  23.401  16.947  13.845
    6    HD2  PHE  34           HD2      PHE  34  20.527  14.810  11.475
    7    HE1  PHE  34           HE1      PHE  34  21.578  18.327  14.807
    8    HE2  PHE  34           HE2      PHE  34  18.708  16.190  12.439
    9    HZ   PHE  34           HZ       PHE  34  19.237  17.949  14.101

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ALA  35           H        ALA  35  25.409  13.001  13.122
    2    HA   ALA  35           HA       ALA  35  26.505  12.194  10.656
    3    HB3  ALA  35           HB1      ALA  35  28.208  11.037  12.363
    4    HB2  ALA  35           HB2      ALA  35  27.342  12.053  13.516
    5    HB1  ALA  35           HB3      ALA  35  28.163  12.786  12.139

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ALA  36           H        ALA  36  25.426  10.223  13.425
    2    HA   ALA  36           HA       ALA  36  25.925   7.743  12.142
    3    HB2  ALA  36           HB1      ALA  36  25.514   6.989  14.219
    4    HB3  ALA  36           HB2      ALA  36  23.821   7.468  14.081
    5    HB1  ALA  36           HB3      ALA  36  25.015   8.610  14.698

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ALA  37           H        ALA  37  23.084   9.842  12.298
    2    HA   ALA  37           HA       ALA  37  21.237   8.056  11.131
    3    HB3  ALA  37           HB1      ALA  37  21.436  11.021  11.427
    4    HB1  ALA  37           HB2      ALA  37  20.138   9.929  11.906
    5    HB2  ALA  37           HB3      ALA  37  20.311  10.405  10.217

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LYS  38           H        LYS  38  23.303  10.540   9.643
    2    HA   LYS  38           HA       LYS  38  22.650  10.111   6.969
    3    HB2  LYS  38           HB2      LYS  38  24.454  11.684   8.405
    4    HB3  LYS  38           HB3      LYS  38  25.490  10.706   7.371
    5    HG2  LYS  38           HG2      LYS  38  24.305  11.468   5.384
    6    HG3  LYS  38           HG3      LYS  38  23.108  12.309   6.374
    7    HD2  LYS  38           HD2      LYS  38  24.692  13.922   7.119
    8    HD3  LYS  38           HD3      LYS  38  26.058  12.951   6.573
    9    HE2  LYS  38           HE2      LYS  38  25.672  14.821   5.027
   10    HE3  LYS  38           HE3      LYS  38  25.348  13.282   4.222
   11    HZ3  LYS  38           HZ1      LYS  38  23.146  13.704   4.107
   12    HZ2  LYS  38           HZ2      LYS  38  23.652  15.324   4.194
   13    HZ1  LYS  38           HZ3      LYS  38  23.095  14.532   5.589

  No H/Q in entry =          13
  In of MODEL   89
    1    H    ALA  39           H        ALA  39  25.193   8.536   8.906
    2    HA   ALA  39           HA       ALA  39  26.265   6.962   6.827
    3    HB2  ALA  39           HB1      ALA  39  26.205   5.993   9.669
    4    HB1  ALA  39           HB2      ALA  39  27.140   7.429   9.249
    5    HB3  ALA  39           HB3      ALA  39  27.503   5.883   8.481

  No H/Q in entry =           5
  In of MODEL   89
    1    H    MET  40           H        MET  40  23.674   6.315   9.141
    2    HA   MET  40           HA       MET  40  23.254   3.606   8.405
    3    HB2  MET  40           HB2      MET  40  21.425   5.629   9.713
    4    HB3  MET  40           HB3      MET  40  21.035   3.915   9.538
    5    HG2  MET  40           HG2      MET  40  23.583   4.881  10.863
    6    HG3  MET  40           HG3      MET  40  22.098   4.588  11.766
    7    HE3  MET  40           HE1      MET  40  21.574   0.949  11.939
    8    HE2  MET  40           HE2      MET  40  20.686   2.243  11.139
    9    HE1  MET  40           HE3      MET  40  21.435   2.536  12.708

  No H/Q in entry =           9
  In of MODEL   89
    1    H    MET  41           H        MET  41  21.800   6.646   7.232
    2    HA   MET  41           HA       MET  41  19.845   5.433   5.571
    3    HB2  MET  41           HB2      MET  41  21.294   8.040   5.053
    4    HB3  MET  41           HB3      MET  41  19.767   7.531   4.343
    5    HG2  MET  41           HG2      MET  41  19.040   7.330   6.899
    6    HG3  MET  41           HG3      MET  41  20.338   8.502   7.115
    7    HE2  MET  41           HE1      MET  41  19.739   9.789   3.784
    8    HE1  MET  41           HE2      MET  41  20.700  10.236   5.190
    9    HE3  MET  41           HE3      MET  41  19.412  11.303   4.636

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ASP  42           H        ASP  42  23.203   6.394   4.997
    2    HA   ASP  42           HA       ASP  42  23.282   5.925   2.238
    3    HB2  ASP  42           HB2      ASP  42  25.034   6.939   3.998
    4    HB3  ASP  42           HB3      ASP  42  25.708   5.321   3.863

  No H/Q in entry =           4
  In of MODEL   89
    1    H    GLN  43           H        GLN  43  24.048   3.774   4.950
    2    HA   GLN  43           HA       GLN  43  24.727   1.527   3.359
    3    HB2  GLN  43           HB2      GLN  43  23.721   1.694   6.210
    4    HB3  GLN  43           HB3      GLN  43  24.312   0.213   5.448
    5    HG2  GLN  43           HG2      GLN  43  26.458   1.448   4.925
    6    HG3  GLN  43           HG3      GLN  43  25.867   2.767   5.931
    7   HE21  GLN  43          HE21      GLN  43  28.118   1.817   6.951
    8   HE22  GLN  43          HE22      GLN  43  27.864   0.729   8.227

  No H/Q in entry =           8
  In of MODEL   89
    1    H    SER  44           H        SER  44  21.668   2.624   4.767
    2    HA   SER  44           HA       SER  44  20.120   0.365   4.100
    3    HB2  SER  44           HB2      SER  44  19.658   2.887   5.253
    4    HB3  SER  44           HB3      SER  44  18.614   2.835   3.835
    5    HG   SER  44           HG       SER  44  17.543   1.876   5.564

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ARG  45           H        ARG  45  20.818   3.341   2.296
    2    HA   ARG  45           HA       ARG  45  19.283   2.842   0.001
    3    HB2  ARG  45           HB2      ARG  45  20.407   4.989   0.581
    4    HB3  ARG  45           HB3      ARG  45  21.957   4.252   0.184
    5    HG2  ARG  45           HG2      ARG  45  21.162   3.842  -2.126
    6    HG3  ARG  45           HG3      ARG  45  19.624   4.602  -1.728
    7    HD2  ARG  45           HD2      ARG  45  20.856   6.712  -1.148
    8    HD3  ARG  45           HD3      ARG  45  22.356   5.955  -1.728
    9    HE   ARG  45           HE       ARG  45  20.415   5.700  -3.752
   10   HH21  ARG  45          HH11      ARG  45  20.381   7.072  -5.512
   11   HH22  ARG  45          HH12      ARG  45  21.122   8.630  -5.410
   12   HH11  ARG  45          HH21      ARG  45  22.129   8.214  -2.132
   13   HH12  ARG  45          HH22      ARG  45  22.111   9.276  -3.494

  No H/Q in entry =          13
  In of MODEL   89
    1    H    MET  46           H        MET  46  22.661   2.002   0.723
    2    HA   MET  46           HA       MET  46  23.262   0.820  -1.767
    3    HB2  MET  46           HB2      MET  46  24.391   0.482   1.014
    4    HB3  MET  46           HB3      MET  46  25.055  -0.373  -0.382
    5    HG2  MET  46           HG2      MET  46  25.429   1.775  -1.532
    6    HG3  MET  46           HG3      MET  46  24.750   2.637  -0.158
    7    HE2  MET  46           HE1      MET  46  26.687   4.136   0.385
    8    HE1  MET  46           HE2      MET  46  27.426   3.580  -1.114
    9    HE3  MET  46           HE3      MET  46  28.387   3.651   0.361

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ALA  47           H        ALA  47  21.914  -0.532   1.217
    2    HA   ALA  47           HA       ALA  47  21.882  -3.244   0.410
    3    HB2  ALA  47           HB1      ALA  47  21.515  -2.791   2.718
    4    HB3  ALA  47           HB2      ALA  47  19.980  -3.409   2.109
    5    HB1  ALA  47           HB3      ALA  47  20.194  -1.676   2.368

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LEU  48           H        LEU  48  19.501  -0.641   0.074
    2    HA   LEU  48           HA       LEU  48  17.462  -2.192  -1.164
    3    HB2  LEU  48           HB2      LEU  48  18.086   0.768  -1.279
    4    HB3  LEU  48           HB3      LEU  48  16.618   0.044  -1.936
    5    HG   LEU  48           HG       LEU  48  17.495  -0.253   0.946
    6   HD13  LEU  48          HD11      LEU  48  17.054   2.044   0.765
    7   HD12  LEU  48          HD12      LEU  48  15.505   1.380   1.286
    8   HD11  LEU  48          HD13      LEU  48  15.760   1.807  -0.407
    9   HD22  LEU  48          HD21      LEU  48  15.981  -1.982   0.574
   10   HD21  LEU  48          HD22      LEU  48  15.089  -1.086  -0.656
   11   HD23  LEU  48          HD23      LEU  48  14.885  -0.686   1.049

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ASN  49           H        ASN  49  20.122  -0.237  -2.412
    2    HA   ASN  49           HA       ASN  49  19.451  -0.323  -5.131
    3    HB2  ASN  49           HB2      ASN  49  21.118   1.214  -4.244
    4    HB3  ASN  49           HB3      ASN  49  22.157  -0.127  -3.777
    5   HD21  ASN  49          HD21      ASN  49  21.794   2.179  -6.126
    6   HD22  ASN  49          HD22      ASN  49  22.563   1.390  -7.416

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLU  50           H        GLU  50  21.471  -2.501  -3.187
    2    HA   GLU  50           HA       GLU  50  22.173  -4.248  -5.320
    3    HB2  GLU  50           HB2      GLU  50  23.387  -4.214  -3.163
    4    HB3  GLU  50           HB3      GLU  50  21.957  -4.856  -2.357
    5    HG2  GLU  50           HG2      GLU  50  22.055  -6.886  -3.719
    6    HG3  GLU  50           HG3      GLU  50  23.417  -6.240  -4.630

  No H/Q in entry =           6
  In of MODEL   89
    1    H    ALA  51           H        ALA  51  19.534  -4.210  -2.973
    2    HA   ALA  51           HA       ALA  51  18.386  -6.693  -3.724
    3    HB3  ALA  51           HB1      ALA  51  16.801  -6.204  -2.156
    4    HB1  ALA  51           HB2      ALA  51  16.567  -4.559  -2.751
    5    HB2  ALA  51           HB3      ALA  51  17.938  -4.933  -1.706

  No H/Q in entry =           5
  In of MODEL   89
    1    H    HIS  52           H        HIS  52  17.760  -3.349  -4.751
    2    HA   HIS  52           HA       HIS  52  15.638  -3.894  -6.535
    3    HB2  HIS  52           HB2      HIS  52  16.195  -1.624  -5.777
    4    HB3  HIS  52           HB3      HIS  52  17.723  -1.701  -6.653
    5    HD1  HIS  52           HD1      HIS  52  17.425  -2.167  -9.349
    6    HD2  HIS  52           HD2      HIS  52  14.099  -0.683  -7.320
    7    HE1  HIS  52           HE1      HIS  52  15.867  -1.230 -11.114
    8    HE2  HIS  52           HE2      HIS  52  13.836  -0.321  -9.892

  No H/Q in entry =           8
  In of MODEL   89
    1    H    LEU  53           H        LEU  53  19.152  -3.866  -6.995
    2    HA   LEU  53           HA       LEU  53  19.190  -4.178  -9.796
    3    HB2  LEU  53           HB2      LEU  53  21.147  -4.924  -7.638
    4    HB3  LEU  53           HB3      LEU  53  21.454  -5.305  -9.330
    5    HG   LEU  53           HG       LEU  53  20.755  -2.503  -8.404
    6   HD11  LEU  53          HD11      LEU  53  23.463  -3.830  -8.697
    7   HD13  LEU  53          HD12      LEU  53  22.787  -3.093  -7.246
    8   HD12  LEU  53          HD13      LEU  53  23.236  -2.085  -8.617
    9   HD23  LEU  53          HD21      LEU  53  22.185  -2.054 -10.558
   10   HD22  LEU  53          HD22      LEU  53  20.511  -2.567 -10.742
   11   HD21  LEU  53          HD23      LEU  53  21.809  -3.725 -10.962

  No H/Q in entry =          11
  In of MODEL   89
    1    H    VAL  54           H        VAL  54  19.122  -6.568  -7.172
    2    HA   VAL  54           HA       VAL  54  19.254  -8.860  -8.835
    3    HB   VAL  54           HB       VAL  54  18.118  -8.450  -6.058
    4   HG12  VAL  54          HG11      VAL  54  18.468 -11.064  -6.058
    5   HG11  VAL  54          HG12      VAL  54  18.267 -10.896  -7.802
    6   HG13  VAL  54          HG13      VAL  54  16.982 -10.379  -6.713
    7   HG22  VAL  54          HG21      VAL  54  20.433  -8.217  -5.853
    8   HG21  VAL  54          HG22      VAL  54  20.770  -9.304  -7.198
    9   HG23  VAL  54          HG23      VAL  54  20.259  -9.958  -5.642

  No H/Q in entry =           9
  In of MODEL   89
    1    H    GLN  55           H        GLN  55  16.517  -6.985  -7.528
    2    HA   GLN  55           HA       GLN  55  14.505  -8.669  -8.588
    3    HB2  GLN  55           HB2      GLN  55  13.754  -7.152  -6.954
    4    HB3  GLN  55           HB3      GLN  55  14.527  -5.775  -7.735
    5    HG2  GLN  55           HG2      GLN  55  12.787  -5.467  -9.211
    6    HG3  GLN  55           HG3      GLN  55  12.482  -7.191  -9.379
    7   HE21  GLN  55          HE21      GLN  55  10.487  -7.761  -8.559
    8   HE22  GLN  55          HE22      GLN  55   9.716  -7.016  -7.244

  No H/Q in entry =           8
  In of MODEL   89
    1    H    THR  56           H        THR  56  16.204  -5.850  -9.959
    2    HA   THR  56           HA       THR  56  14.744  -5.502 -12.295
    3    HB   THR  56           HB       THR  56  17.763  -5.382 -12.158
    4    HG1  THR  56           HG1      THR  56  15.784  -3.855 -10.976
    5   HG23  THR  56          HG21      THR  56  17.564  -3.765 -13.908
    6   HG22  THR  56          HG22      THR  56  15.816  -3.664 -13.705
    7   HG21  THR  56          HG23      THR  56  16.542  -5.126 -14.375

  No H/Q in entry =           7
  In of MODEL   89
    1    H    LYS  57           H        LYS  57  17.422  -7.771 -11.707
    2    HA   LYS  57           HA       LYS  57  17.415  -8.964 -14.286
    3    HB2  LYS  57           HB2      LYS  57  19.111  -9.149 -12.296
    4    HB3  LYS  57           HB3      LYS  57  18.068 -10.450 -11.744
    5    HG2  LYS  57           HG2      LYS  57  18.413 -11.684 -13.798
    6    HG3  LYS  57           HG3      LYS  57  19.312 -10.347 -14.506
    7    HD2  LYS  57           HD2      LYS  57  20.958 -11.904 -13.759
    8    HD3  LYS  57           HD3      LYS  57  20.960 -10.609 -12.562
    9    HE2  LYS  57           HE2      LYS  57  19.646 -11.920 -11.021
   10    HE3  LYS  57           HE3      LYS  57  19.334 -13.158 -12.237
   11    HZ3  LYS  57           HZ1      LYS  57  21.506 -13.903 -12.157
   12    HZ2  LYS  57           HZ2      LYS  57  21.164 -13.569 -10.528
   13    HZ1  LYS  57           HZ3      LYS  57  22.090 -12.480 -11.442

  No H/Q in entry =          13
  In of MODEL   89
    1    H    LEU  58           H        LEU  58  15.666  -9.652 -11.296
    2    HA   LEU  58           HA       LEU  58  14.462 -12.039 -12.223
    3    HB2  LEU  58           HB2      LEU  58  13.664 -10.143 -10.019
    4    HB3  LEU  58           HB3      LEU  58  12.872 -11.689 -10.330
    5    HG   LEU  58           HG       LEU  58  15.846 -11.379  -9.799
    6   HD11  LEU  58          HD11      LEU  58  13.495 -11.823  -7.988
    7   HD13  LEU  58          HD12      LEU  58  14.939 -10.844  -7.737
    8   HD12  LEU  58          HD13      LEU  58  15.032 -12.600  -7.603
    9   HD22  LEU  58          HD21      LEU  58  15.743 -13.442 -10.827
   10   HD21  LEU  58          HD22      LEU  58  14.034 -13.670 -10.453
   11   HD23  LEU  58          HD23      LEU  58  15.256 -13.958  -9.214

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  59           H        ILE  59  13.749  -8.709 -12.898
    2    HA   ILE  59           HA       ILE  59  11.033  -9.387 -13.816
    3    HB   ILE  59           HB       ILE  59  11.817  -7.098 -12.614
    4   HG12  ILE  59          HG12      ILE  59   9.907  -6.977 -14.958
    5   HG13  ILE  59          HG13      ILE  59   9.496  -7.772 -13.459
    6   HG21  ILE  59          HG21      ILE  59  13.348  -6.687 -14.686
    7   HG23  ILE  59          HG22      ILE  59  12.374  -5.355 -14.105
    8   HG22  ILE  59          HG23      ILE  59  11.866  -6.278 -15.517
    9   HD13  ILE  59          HD11      ILE  59   9.887  -5.706 -12.204
   10   HD12  ILE  59          HD12      ILE  59   8.702  -5.429 -13.480
   11   HD11  ILE  59          HD13      ILE  59  10.369  -4.889 -13.693

  No H/Q in entry =          11
  In of MODEL   89
    1    H    GLU  60           H        GLU  60  14.217  -8.499 -15.100
    2    HA   GLU  60           HA       GLU  60  13.411  -8.106 -17.802
    3    HB2  GLU  60           HB2      GLU  60  15.581  -7.335 -17.011
    4    HB3  GLU  60           HB3      GLU  60  16.065  -8.986 -16.636
    5    HG2  GLU  60           HG2      GLU  60  15.214  -8.257 -19.431
    6    HG3  GLU  60           HG3      GLU  60  16.861  -7.940 -18.890

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLY  61           H        GLY  61  14.435 -10.977 -15.996
    2    HA3  GLY  61           HA2      GLY  61  13.892 -12.630 -18.394
    3    HA2  GLY  61           HA3      GLY  61  14.940 -13.100 -17.060

  No H/Q in entry =           3
  In of MODEL   89
    1    H    ASP  62           H        ASP  62  11.806 -11.589 -16.665
    2    HA   ASP  62           HA       ASP  62  10.910 -13.541 -14.826
    3    HB2  ASP  62           HB2      ASP  62   8.738 -12.338 -15.021
    4    HB3  ASP  62           HB3      ASP  62  10.104 -11.275 -14.698

  No H/Q in entry =           4
  In of MODEL   89
    1    H    ALA  63           H        ALA  63  11.105 -13.790 -18.186
    2    HA   ALA  63           HA       ALA  63   8.667 -15.350 -18.587
    3    HB3  ALA  63           HB1      ALA  63   9.943 -13.869 -20.320
    4    HB2  ALA  63           HB2      ALA  63   9.258 -15.404 -20.848
    5    HB1  ALA  63           HB3      ALA  63  10.984 -15.281 -20.503

  No H/Q in entry =           5
  In of MODEL   89
    1    H    GLY  64           H        GLY  64   9.039 -17.529 -19.754
    2    HA3  GLY  64           HA2      GLY  64  10.762 -19.403 -19.827
    3    HA2  GLY  64           HA3      GLY  64  10.892 -19.118 -18.096

  No H/Q in entry =           3
  In of MODEL   89
    1    H    GLU  65           H        GLU  65   8.497 -19.032 -17.065
    2    HA   GLU  65           HA       GLU  65   7.560 -21.688 -17.240
    3    HB2  GLU  65           HB2      GLU  65   6.354 -19.241 -15.955
    4    HB3  GLU  65           HB3      GLU  65   5.690 -20.865 -15.784
    5    HG2  GLU  65           HG2      GLU  65   7.791 -21.661 -14.823
    6    HG3  GLU  65           HG3      GLU  65   8.527 -20.078 -15.064

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLY  66           H        GLY  66   6.429 -18.721 -18.639
    2    HA3  GLY  66           HA2      GLY  66   4.997 -20.012 -20.730
    3    HA2  GLY  66           HA3      GLY  66   3.900 -19.327 -19.548

  No H/Q in entry =           3
  In of MODEL   89
    1    H    LYS  67           H        LYS  67   3.653 -18.452 -22.024
    2    HA   LYS  67           HA       LYS  67   5.256 -16.363 -22.913
    3    HB2  LYS  67           HB2      LYS  67   2.298 -16.738 -23.393
    4    HB3  LYS  67           HB3      LYS  67   3.422 -15.816 -24.400
    5    HG2  LYS  67           HG2      LYS  67   3.727 -18.766 -23.769
    6    HG3  LYS  67           HG3      LYS  67   3.012 -18.143 -25.253
    7    HD2  LYS  67           HD2      LYS  67   5.219 -16.810 -25.515
    8    HD3  LYS  67           HD3      LYS  67   5.866 -17.930 -24.313
    9    HE2  LYS  67           HE2      LYS  67   5.294 -19.839 -25.709
   10    HE3  LYS  67           HE3      LYS  67   4.495 -18.787 -26.878
   11    HZ3  LYS  67           HZ1      LYS  67   6.455 -18.045 -27.695
   12    HZ2  LYS  67           HZ2      LYS  67   6.987 -19.566 -27.161
   13    HZ1  LYS  67           HZ3      LYS  67   7.271 -18.184 -26.215

  No H/Q in entry =          13
  In of MODEL   89
    1    H    MET  68           H        MET  68   1.965 -15.607 -22.097
    2    HA   MET  68           HA       MET  68   2.468 -12.939 -21.345
    3    HB2  MET  68           HB2      MET  68   0.102 -14.771 -21.165
    4    HB3  MET  68           HB3      MET  68   0.045 -13.158 -20.453
    5    HG2  MET  68           HG2      MET  68   0.851 -13.691 -23.324
    6    HG3  MET  68           HG3      MET  68  -0.789 -13.266 -22.831
    7    HE3  MET  68           HE1      MET  68   2.591 -12.015 -23.936
    8    HE2  MET  68           HE2      MET  68   1.970 -10.419 -24.350
    9    HE1  MET  68           HE3      MET  68   1.111 -11.858 -24.893

  No H/Q in entry =           9
  In of MODEL   89
    1    H    LYS  69           H        LYS  69   1.979 -15.845 -19.327
    2    HA   LYS  69           HA       LYS  69   1.787 -14.370 -16.890
    3    HB2  LYS  69           HB2      LYS  69   2.183 -17.307 -17.449
    4    HB3  LYS  69           HB3      LYS  69   1.984 -16.643 -15.826
    5    HG2  LYS  69           HG2      LYS  69  -0.168 -15.646 -16.481
    6    HG3  LYS  69           HG3      LYS  69   0.029 -16.281 -18.114
    7    HD2  LYS  69           HD2      LYS  69   0.060 -18.584 -17.199
    8    HD3  LYS  69           HD3      LYS  69  -0.199 -17.930 -15.580
    9    HE2  LYS  69           HE2      LYS  69  -2.067 -17.465 -17.922
   10    HE3  LYS  69           HE3      LYS  69  -2.316 -18.697 -16.685
   11    HZ1  LYS  69           HZ1      LYS  69  -1.789 -16.035 -15.684
   12    HZ3  LYS  69           HZ2      LYS  69  -2.931 -17.184 -15.174
   13    HZ2  LYS  69           HZ3      LYS  69  -3.255 -16.201 -16.521

  No H/Q in entry =          13
  In of MODEL   89
    1    H    VAL  70           H        VAL  70   3.177 -14.343 -15.050
    2    HA   VAL  70           HA       VAL  70   6.043 -14.866 -15.596
    3    HB   VAL  70           HB       VAL  70   6.577 -12.769 -14.397
    4   HG12  VAL  70          HG11      VAL  70   5.805 -11.213 -16.186
    5   HG11  VAL  70          HG12      VAL  70   4.693 -12.459 -16.754
    6   HG13  VAL  70          HG13      VAL  70   6.433 -12.724 -16.843
    7   HG22  VAL  70          HG21      VAL  70   4.766 -11.148 -13.907
    8   HG21  VAL  70          HG22      VAL  70   4.518 -12.652 -13.021
    9   HG23  VAL  70          HG23      VAL  70   3.565 -12.314 -14.466

  No H/Q in entry =           9
  In of MODEL   89
    1    H    SER  71           H        SER  71   7.297 -14.691 -13.452
    2    HA   SER  71           HA       SER  71   6.404 -16.655 -11.637
    3    HB2  SER  71           HB2      SER  71   8.790 -15.986 -11.960
    4    HB3  SER  71           HB3      SER  71   8.442 -14.470 -11.131
    5    HG   SER  71           HG       SER  71   7.548 -16.008  -9.444

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LEU  72           H        LEU  72   5.031 -16.542  -9.989
    2    HA   LEU  72           HA       LEU  72   3.459 -14.247  -9.531
    3    HB2  LEU  72           HB2      LEU  72   3.786 -16.802  -7.966
    4    HB3  LEU  72           HB3      LEU  72   2.608 -15.558  -7.555
    5    HG   LEU  72           HG       LEU  72   2.757 -16.838 -10.303
    6   HD13  LEU  72          HD11      LEU  72   2.244 -18.615  -8.756
    7   HD12  LEU  72          HD12      LEU  72   0.726 -18.121  -9.502
    8   HD11  LEU  72          HD13      LEU  72   1.118 -17.587  -7.868
    9   HD23  LEU  72          HD21      LEU  72   0.263 -16.064 -10.181
   10   HD22  LEU  72          HD22      LEU  72   1.484 -14.842 -10.490
   11   HD21  LEU  72          HD23      LEU  72   0.809 -15.021  -8.874

  No H/Q in entry =          11
  In of MODEL   89
    1    H    VAL  73           H        VAL  73   6.144 -15.656  -7.779
    2    HA   VAL  73           HA       VAL  73   6.084 -14.127  -5.445
    3    HB   VAL  73           HB       VAL  73   8.280 -14.912  -5.035
    4   HG12  VAL  73          HG11      VAL  73   7.138 -17.028  -6.858
    5   HG11  VAL  73          HG12      VAL  73   6.357 -16.609  -5.333
    6   HG13  VAL  73          HG13      VAL  73   8.003 -17.240  -5.337
    7   HG22  VAL  73          HG21      VAL  73   9.601 -14.339  -6.860
    8   HG21  VAL  73          HG22      VAL  73   8.436 -14.959  -8.029
    9   HG23  VAL  73          HG23      VAL  73   9.443 -16.077  -7.109

  No H/Q in entry =           9
  In of MODEL   89
    1    H    LEU  74           H        LEU  74   7.041 -13.218  -8.626
    2    HA   LEU  74           HA       LEU  74   8.968 -11.249  -8.145
    3    HB2  LEU  74           HB2      LEU  74   8.500 -12.005 -10.381
    4    HB3  LEU  74           HB3      LEU  74   6.833 -11.446 -10.268
    5    HG   LEU  74           HG       LEU  74   7.626  -9.115 -10.060
    6   HD11  LEU  74          HD11      LEU  74  10.312 -10.489 -10.175
    7   HD13  LEU  74          HD12      LEU  74   9.748  -9.287  -9.016
    8   HD12  LEU  74          HD13      LEU  74  10.125  -8.807 -10.670
    9   HD22  LEU  74          HD21      LEU  74   7.935  -8.884 -12.317
   10   HD21  LEU  74          HD22      LEU  74   7.390 -10.545 -12.260
   11   HD23  LEU  74          HD23      LEU  74   9.100 -10.203 -12.403

  No H/Q in entry =          11
  In of MODEL   89
    1    H    VAL  75           H        VAL  75   5.466 -10.902  -8.474
    2    HA   VAL  75           HA       VAL  75   5.344  -8.147  -7.883
    3    HB   VAL  75           HB       VAL  75   3.284 -10.319  -7.495
    4   HG11  VAL  75          HG11      VAL  75   3.054  -7.284  -7.295
    5   HG13  VAL  75          HG12      VAL  75   2.785  -8.440  -5.999
    6   HG12  VAL  75          HG13      VAL  75   1.683  -8.385  -7.368
    7   HG23  VAL  75          HG21      VAL  75   3.463  -8.115  -9.568
    8   HG22  VAL  75          HG22      VAL  75   2.421  -9.536  -9.595
    9   HG21  VAL  75          HG23      VAL  75   4.160  -9.713  -9.828

  No H/Q in entry =           9
  In of MODEL   89
    1    H    GLU  76           H        GLU  76   5.136 -11.029  -5.775
    2    HA   GLU  76           HA       GLU  76   4.668  -9.676  -3.349
    3    HB2  GLU  76           HB2      GLU  76   4.515 -12.143  -3.580
    4    HB3  GLU  76           HB3      GLU  76   6.249 -12.226  -3.840
    5    HG2  GLU  76           HG2      GLU  76   5.864 -12.811  -1.541
    6    HG3  GLU  76           HG3      GLU  76   6.559 -11.200  -1.531

  No H/Q in entry =           6
  In of MODEL   89
    1    H    ALA  77           H        ALA  77   7.726 -10.549  -4.933
    2    HA   ALA  77           HA       ALA  77   9.418  -9.490  -2.927
    3    HB1  ALA  77           HB1      ALA  77  10.267 -11.012  -4.630
    4    HB2  ALA  77           HB2      ALA  77  11.155  -9.490  -4.699
    5    HB3  ALA  77           HB3      ALA  77   9.906  -9.837  -5.895

  No H/Q in entry =           5
  In of MODEL   89
    1    H    GLN  78           H        GLN  78   7.992  -8.084  -5.831
    2    HA   GLN  78           HA       GLN  78   9.319  -5.591  -5.732
    3    HB2  GLN  78           HB2      GLN  78   8.021  -6.516  -7.683
    4    HB3  GLN  78           HB3      GLN  78   6.540  -6.156  -6.798
    5    HG2  GLN  78           HG2      GLN  78   7.164  -3.778  -6.705
    6    HG3  GLN  78           HG3      GLN  78   8.651  -4.129  -7.583
    7   HE21  GLN  78          HE21      GLN  78   8.263  -3.180  -9.623
    8   HE22  GLN  78          HE22      GLN  78   6.914  -3.536 -10.591

  No H/Q in entry =           8
  In of MODEL   89
    1    H    LEU  79           H        LEU  79   6.321  -6.761  -4.284
    2    HA   LEU  79           HA       LEU  79   5.308  -4.365  -3.266
    3    HB2  LEU  79           HB2      LEU  79   4.015  -6.430  -3.205
    4    HB3  LEU  79           HB3      LEU  79   5.174  -7.159  -2.098
    5    HG   LEU  79           HG       LEU  79   4.616  -5.525  -0.365
    6   HD13  LEU  79          HD11      LEU  79   4.124  -3.514  -1.411
    7   HD12  LEU  79          HD12      LEU  79   2.506  -4.056  -0.963
    8   HD11  LEU  79          HD13      LEU  79   3.079  -4.271  -2.615
    9   HD23  LEU  79          HD21      LEU  79   2.035  -6.043  -0.261
   10   HD22  LEU  79          HD22      LEU  79   3.188  -7.371  -0.160
   11   HD21  LEU  79          HD23      LEU  79   2.362  -7.040  -1.680

  No H/Q in entry =          11
  In of MODEL   89
    1    H    HIS  80           H        HIS  80   7.524  -6.680  -1.699
    2    HA   HIS  80           HA       HIS  80   7.810  -5.138   0.670
    3    HB2  HIS  80           HB2      HIS  80   9.165  -7.487  -0.539
    4    HB3  HIS  80           HB3      HIS  80  10.073  -6.583   0.673
    5    HD1  HIS  80           HD1      HIS  80   9.602  -7.226   3.018
    6    HD2  HIS  80           HD2      HIS  80   6.380  -8.106   0.523
    7    HE1  HIS  80           HE1      HIS  80   7.850  -8.349   4.475
    8    HE2  HIS  80           HE2      HIS  80   5.879  -8.889   2.963

  No H/Q in entry =           8
  In of MODEL   89
    1    H    LEU  81           H        LEU  81   9.802  -5.391  -2.254
    2    HA   LEU  81           HA       LEU  81  11.834  -3.631  -1.384
    3    HB2  LEU  81           HB2      LEU  81  10.905  -4.430  -4.143
    4    HB3  LEU  81           HB3      LEU  81  12.317  -3.410  -3.860
    5    HG   LEU  81           HG       LEU  81  11.957  -6.137  -2.587
    6   HD12  LEU  81          HD11      LEU  81  13.769  -6.744  -4.348
    7   HD11  LEU  81          HD12      LEU  81  13.185  -5.324  -5.214
    8   HD13  LEU  81          HD13      LEU  81  12.088  -6.659  -4.872
    9   HD23  LEU  81          HD21      LEU  81  14.583  -5.797  -2.587
   10   HD22  LEU  81          HD22      LEU  81  13.600  -5.047  -1.331
   11   HD21  LEU  81          HD23      LEU  81  14.162  -4.088  -2.700

  No H/Q in entry =          11
  In of MODEL   89
    1    H    MET  82           H        MET  82   8.895  -3.020  -3.305
    2    HA   MET  82           HA       MET  82   9.406  -0.289  -3.805
    3    HB2  MET  82           HB2      MET  82   6.862  -1.906  -3.668
    4    HB3  MET  82           HB3      MET  82   6.844  -0.182  -4.030
    5    HG2  MET  82           HG2      MET  82   8.455  -2.239  -5.577
    6    HG3  MET  82           HG3      MET  82   6.880  -1.630  -6.080
    7    HE3  MET  82           HE1      MET  82   7.291   1.830  -7.250
    8    HE2  MET  82           HE2      MET  82   6.927   1.599  -5.542
    9    HE1  MET  82           HE3      MET  82   6.266   0.484  -6.734

  No H/Q in entry =           9
  In of MODEL   89
    1    H    THR  83           H        THR  83   7.643  -1.906  -1.192
    2    HA   THR  83           HA       THR  83   6.778   0.433   0.141
    3    HB   THR  83           HB       THR  83   6.669  -1.145   2.158
    4    HG1  THR  83           HG1      THR  83   7.442  -3.088   1.922
    5   HG22  THR  83          HG21      THR  83   5.022  -2.724   0.697
    6   HG21  THR  83          HG22      THR  83   5.231  -1.392  -0.434
    7   HG23  THR  83          HG23      THR  83   4.596  -1.085   1.182

  No H/Q in entry =           7
  In of MODEL   89
    1    H    SER  84           H        SER  84   9.623  -1.641   0.645
    2    HA   SER  84           HA       SER  84  10.682  -0.204   2.829
    3    HB2  SER  84           HB2      SER  84  11.940  -2.033   0.795
    4    HB3  SER  84           HB3      SER  84  12.887  -1.273   2.073
    5    HG   SER  84           HG       SER  84  10.628  -2.983   2.342

  No H/Q in entry =           5
  In of MODEL   89
    1    H    MET  85           H        MET  85  11.414   0.068  -0.663
    2    HA   MET  85           HA       MET  85  13.397   2.050  -0.420
    3    HB2  MET  85           HB2      MET  85  12.999   0.766  -2.485
    4    HB3  MET  85           HB3      MET  85  11.465   1.609  -2.705
    5    HG2  MET  85           HG2      MET  85  12.651   3.764  -2.828
    6    HG3  MET  85           HG3      MET  85  14.187   2.939  -2.581
    7    HE2  MET  85           HE1      MET  85  15.323   1.769  -5.838
    8    HE1  MET  85           HE2      MET  85  15.245   1.235  -4.162
    9    HE3  MET  85           HE3      MET  85  15.661   2.905  -4.522

  No H/Q in entry =           9
  In of MODEL   89
    1    H    LEU  86           H        LEU  86   9.902   2.356  -0.910
    2    HA   LEU  86           HA       LEU  86   9.813   5.168  -1.088
    3    HB2  LEU  86           HB2      LEU  86   7.980   3.494  -1.656
    4    HB3  LEU  86           HB3      LEU  86   7.660   3.399   0.076
    5    HG   LEU  86           HG       LEU  86   7.478   5.959   0.027
    6   HD11  LEU  86          HD11      LEU  86   8.243   5.533  -2.679
    7   HD13  LEU  86          HD12      LEU  86   7.798   7.055  -1.915
    8   HD12  LEU  86          HD13      LEU  86   6.566   6.083  -2.714
    9   HD23  LEU  86          HD21      LEU  86   5.346   4.591  -1.626
   10   HD22  LEU  86          HD22      LEU  86   5.152   5.847  -0.407
   11   HD21  LEU  86          HD23      LEU  86   5.568   4.206   0.082

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ALA  87           H        ALA  87   9.380   2.983   1.658
    2    HA   ALA  87           HA       ALA  87   8.826   4.890   3.633
    3    HB1  ALA  87           HB1      ALA  87   9.656   2.076   3.539
    4    HB3  ALA  87           HB2      ALA  87   8.530   2.878   4.631
    5    HB2  ALA  87           HB3      ALA  87  10.260   2.923   4.966

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ARG  88           H        ARG  88  11.916   3.491   2.634
    2    HA   ARG  88           HA       ARG  88  13.524   4.880   4.459
    3    HB2  ARG  88           HB2      ARG  88  14.201   2.914   3.049
    4    HB3  ARG  88           HB3      ARG  88  14.337   4.009   1.677
    5    HG2  ARG  88           HG2      ARG  88  15.810   5.333   3.617
    6    HG3  ARG  88           HG3      ARG  88  16.146   3.646   3.992
    7    HD2  ARG  88           HD2      ARG  88  17.405   3.361   2.138
    8    HD3  ARG  88           HD3      ARG  88  16.256   4.225   1.112
    9    HE   ARG  88           HE       ARG  88  18.648   5.307   2.148
   10   HH21  ARG  88          HH11      ARG  88  18.974   7.528   1.954
   11   HH22  ARG  88          HH12      ARG  88  17.614   8.589   1.819
   12   HH11  ARG  88          HH21      ARG  88  15.301   6.033   1.889
   13   HH12  ARG  88          HH22      ARG  88  15.533   7.740   1.758

  No H/Q in entry =          13
  In of MODEL   89
    1    H    GLU  89           H        GLU  89  12.525   5.774   1.142
    2    HA   GLU  89           HA       GLU  89  14.052   8.147   0.980
    3    HB2  GLU  89           HB2      GLU  89  12.906   7.099  -0.963
    4    HB3  GLU  89           HB3      GLU  89  11.360   7.627  -0.296
    5    HG2  GLU  89           HG2      GLU  89  12.042   9.970  -0.459
    6    HG3  GLU  89           HG3      GLU  89  13.647   9.493  -1.005

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LEU  90           H        LEU  90  10.734   7.609   2.128
    2    HA   LEU  90           HA       LEU  90  10.200  10.338   2.709
    3    HB2  LEU  90           HB2      LEU  90   9.032   7.753   3.740
    4    HB3  LEU  90           HB3      LEU  90   8.391   9.343   4.168
    5    HG   LEU  90           HG       LEU  90   8.800   8.470   1.296
    6   HD12  LEU  90          HD11      LEU  90   6.269   8.121   1.372
    7   HD11  LEU  90          HD12      LEU  90   6.434   8.110   3.128
    8   HD13  LEU  90          HD13      LEU  90   7.256   6.888   2.157
    9   HD22  LEU  90          HD21      LEU  90   8.487  10.776   1.227
   10   HD21  LEU  90          HD22      LEU  90   7.508  10.798   2.693
   11   HD23  LEU  90          HD23      LEU  90   6.807  10.240   1.175

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  91           H        ILE  91  11.495   7.664   4.621
    2    HA   ILE  91           HA       ILE  91  11.639   9.027   7.090
    3    HB   ILE  91           HB       ILE  91  13.205   6.703   5.954
    4   HG12  ILE  91          HG12      ILE  91  11.200   6.851   8.226
    5   HG13  ILE  91          HG13      ILE  91  10.723   6.568   6.553
    6   HG22  ILE  91          HG21      ILE  91  13.692   6.490   8.592
    7   HG21  ILE  91          HG22      ILE  91  13.601   8.248   8.494
    8   HG23  ILE  91          HG23      ILE  91  14.781   7.371   7.521
    9   HD13  ILE  91          HD11      ILE  91  11.742   4.475   6.474
   10   HD12  ILE  91          HD12      ILE  91  11.158   4.526   8.137
   11   HD11  ILE  91          HD13      ILE  91  12.855   4.854   7.789

  No H/Q in entry =          11
  In of MODEL   89
    1    H    THR  92           H        THR  92  13.841   8.879   4.325
    2    HA   THR  92           HA       THR  92  16.002  10.288   5.474
    3    HB   THR  92           HB       THR  92  15.000  10.159   2.619
    4    HG1  THR  92           HG1      THR  92  15.849   8.268   3.017
    5   HG22  THR  92          HG21      THR  92  17.563  10.871   2.311
    6   HG21  THR  92          HG22      THR  92  17.257  11.687   3.844
    7   HG23  THR  92          HG23      THR  92  16.275  12.068   2.429

  No H/Q in entry =           7
  In of MODEL   89
    1    H    GLU  93           H        GLU  93  13.096  11.421   3.763
    2    HA   GLU  93           HA       GLU  93  13.668  14.186   3.878
    3    HB2  GLU  93           HB2      GLU  93  10.976  12.791   3.906
    4    HB3  GLU  93           HB3      GLU  93  11.247  14.494   3.534
    5    HG2  GLU  93           HG2      GLU  93  12.594  12.264   1.996
    6    HG3  GLU  93           HG3      GLU  93  11.040  12.935   1.519

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LEU  94           H        LEU  94  11.956  12.013   6.096
    2    HA   LEU  94           HA       LEU  94  11.142  13.950   7.980
    3    HB2  LEU  94           HB2      LEU  94  11.744  11.000   8.246
    4    HB3  LEU  94           HB3      LEU  94  11.172  11.969   9.601
    5    HG   LEU  94           HG       LEU  94   9.672  12.012   6.982
    6   HD11  LEU  94          HD11      LEU  94   9.785   9.789   8.982
    7   HD13  LEU  94          HD12      LEU  94   9.473   9.728   7.249
    8   HD12  LEU  94          HD13      LEU  94   8.197  10.233   8.355
    9   HD23  LEU  94          HD21      LEU  94   7.759  12.394   8.593
   10   HD22  LEU  94          HD22      LEU  94   8.988  13.658   8.625
   11   HD21  LEU  94          HD23      LEU  94   8.942  12.439   9.898

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  95           H        ILE  95  14.130  12.045   7.723
    2    HA   ILE  95           HA       ILE  95  15.305  12.974  10.131
    3    HB   ILE  95           HB       ILE  95  16.537  11.918   7.574
    4   HG12  ILE  95          HG12      ILE  95  16.267  10.712  10.342
    5   HG13  ILE  95          HG13      ILE  95  15.095  10.445   9.053
    6   HG21  ILE  95          HG21      ILE  95  17.801  12.732  10.210
    7   HG23  ILE  95          HG22      ILE  95  18.250  13.266   8.588
    8   HG22  ILE  95          HG23      ILE  95  18.573  11.608   9.093
    9   HD13  ILE  95          HD11      ILE  95  16.578   9.180   7.779
   10   HD12  ILE  95          HD12      ILE  95  17.064   8.733   9.412
   11   HD11  ILE  95          HD13      ILE  95  18.002   9.922   8.509

  No H/Q in entry =          11
  In of MODEL   89
    1    H    GLU  96           H        GLU  96  15.429  14.213   6.797
    2    HA   GLU  96           HA       GLU  96  17.262  16.306   7.265
    3    HB2  GLU  96           HB2      GLU  96  16.589  15.641   5.009
    4    HB3  GLU  96           HB3      GLU  96  14.943  16.184   5.320
    5    HG2  GLU  96           HG2      GLU  96  15.489  18.319   4.778
    6    HG3  GLU  96           HG3      GLU  96  16.795  18.328   5.952

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LEU  97           H        LEU  97  13.755  16.090   7.716
    2    HA   LEU  97           HA       LEU  97  13.320  18.819   8.364
    3    HB2  LEU  97           HB2      LEU  97  11.826  16.281   8.984
    4    HB3  LEU  97           HB3      LEU  97  11.305  17.823   9.660
    5    HG   LEU  97           HG       LEU  97  11.773  17.414   6.692
    6   HD12  LEU  97          HD11      LEU  97   9.250  17.266   6.589
    7   HD11  LEU  97          HD12      LEU  97   9.256  17.064   8.339
    8   HD13  LEU  97          HD13      LEU  97  10.040  15.864   7.311
    9   HD23  LEU  97          HD21      LEU  97  10.019  19.364   6.738
   10   HD22  LEU  97          HD22      LEU  97  11.700  19.737   7.120
   11   HD21  LEU  97          HD23      LEU  97  10.521  19.555   8.417

  No H/Q in entry =          11
  In of MODEL   89
    1    H    HIS  98           H        HIS  98  14.177  15.997  10.351
    2    HA   HIS  98           HA       HIS  98  14.024  17.254  12.869
    3    HB2  HIS  98           HB2      HIS  98  15.786  15.012  11.854
    4    HB3  HIS  98           HB3      HIS  98  15.790  15.548  13.536
    5    HD1  HIS  98           HD1      HIS  98  13.588  13.904  10.955
    6    HD2  HIS  98           HD2      HIS  98  13.499  14.818  15.021
    7    HE1  HIS  98           HE1      HIS  98  11.579  12.692  11.918
    8    HE2  HIS  98           HE2      HIS  98  11.505  13.240  14.391

  No H/Q in entry =           8
  In of MODEL   89
    1    H    GLU  99           H        GLU  99  16.563  17.162  10.419
    2    HA   GLU  99           HA       GLU  99  18.548  18.507  11.937
    3    HB2  GLU  99           HB2      GLU  99  19.024  17.226   9.863
    4    HB3  GLU  99           HB3      GLU  99  18.199  18.476   8.929
    5    HG2  GLU  99           HG2      GLU  99  19.799  20.158   9.712
    6    HG3  GLU  99           HG3      GLU  99  20.594  18.960  10.729

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LYS 100           H        LYS 100  16.001  19.653   9.738
    2    HA   LYS 100           HA       LYS 100  16.779  22.396   9.881
    3    HB2  LYS 100           HB2      LYS 100  14.151  21.088   9.141
    4    HB3  LYS 100           HB3      LYS 100  14.437  22.828   9.051
    5    HG2  LYS 100           HG2      LYS 100  16.403  22.397   7.571
    6    HG3  LYS 100           HG3      LYS 100  16.003  20.677   7.589
    7    HD2  LYS 100           HD2      LYS 100  13.798  21.171   6.604
    8    HD3  LYS 100           HD3      LYS 100  14.181  22.893   6.593
    9    HE2  LYS 100           HE2      LYS 100  16.134  22.429   5.120
   10    HE3  LYS 100           HE3      LYS 100  15.682  20.721   5.088
   11    HZ1  LYS 100           HZ1      LYS 100  13.835  22.901   4.267
   12    HZ3  LYS 100           HZ2      LYS 100  13.662  21.231   4.004
   13    HZ2  LYS 100           HZ3      LYS 100  14.861  22.103   3.176

  No H/Q in entry =          13
  In of MODEL   89
    1    H    LEU 101           H        LEU 101  14.709  20.331  11.856
    2    HA   LEU 101           HA       LEU 101  13.537  22.388  13.445
    3    HB2  LEU 101           HB2      LEU 101  14.004  19.442  13.822
    4    HB3  LEU 101           HB3      LEU 101  13.469  20.416  15.187
    5    HG   LEU 101           HG       LEU 101  12.034  20.497  12.527
    6   HD12  LEU 101          HD11      LEU 101  10.394  18.920  13.804
    7   HD11  LEU 101          HD12      LEU 101  11.798  18.516  14.790
    8   HD13  LEU 101          HD13      LEU 101  11.823  18.212  13.052
    9   HD21  LEU 101          HD21      LEU 101  11.389  21.282  15.385
   10   HD23  LEU 101          HD22      LEU 101  10.122  21.048  14.182
   11   HD22  LEU 101          HD23      LEU 101  11.346  22.293  13.938

  No H/Q in entry =          11
  In of MODEL   89
    1    H    LYS 102           H        LYS 102  16.686  21.804  12.988
    2    HA   LYS 102           HA       LYS 102  18.533  22.687  14.050
    3    HB2  LYS 102           HB2      LYS 102  16.715  24.187  15.197
    4    HB3  LYS 102           HB3      LYS 102  16.939  23.124  16.571
    5    HG2  LYS 102           HG2      LYS 102  18.810  25.151  15.392
    6    HG3  LYS 102           HG3      LYS 102  18.441  24.831  17.073
    7    HD2  LYS 102           HD2      LYS 102  20.111  22.933  15.374
    8    HD3  LYS 102           HD3      LYS 102  20.796  24.259  16.305
    9    HE2  LYS 102           HE2      LYS 102  20.423  21.706  17.272
   10    HE3  LYS 102           HE3      LYS 102  20.637  23.148  18.264
   11    HZ2  LYS 102           HZ1      LYS 102  18.682  21.849  18.893
   12    HZ1  LYS 102           HZ2      LYS 102  18.026  22.077  17.348
   13    HZ3  LYS 102           HZ3      LYS 102  18.254  23.406  18.374

  No H/Q in entry =          13
  In of MODEL   89
    1    H    ALA 103           H        ALA 103  16.489  21.063  16.482
    2    HA   ALA 103           HA       ALA 103  18.235  19.863  18.124
    3    HB2  ALA 103           HB1      ALA 103  16.665  17.844  18.126
    4    HB1  ALA 103           HB2      ALA 103  15.755  18.693  16.875
    5    HB3  ALA 103           HB3      ALA 103  15.938  19.412  18.474

  No H/Q in entry =           5
  In of MODEL   89
    1    H1   ALA   1           H3       ALA   1  -1.753  -7.074 -21.410
    2    H2   ALA   1           H2       ALA   1  -2.535  -8.516 -20.954
    3    H3   ALA   1           H1       ALA   1  -0.930  -8.554 -21.519
    4    HA   ALA   1           HA       ALA   1  -1.773  -9.026 -23.511
    5    HB1  ALA   1           HB1      ALA   1  -3.902  -9.759 -23.026
    6    HB2  ALA   1           HB2      ALA   1  -4.356  -8.250 -23.818
    7    HB3  ALA   1           HB3      ALA   1  -4.284  -8.333 -22.060

  No H/Q in entry =           7
  In of MODEL   89
    1    H    GLU   2           H        GLU   2  -2.624  -7.838 -25.493
    2    HA   GLU   2           HA       GLU   2  -1.244  -5.813 -26.376
    3    HB2  GLU   2           HB2      GLU   2  -4.252  -5.900 -26.676
    4    HB3  GLU   2           HB3      GLU   2  -3.144  -5.028 -27.731
    5    HG2  GLU   2           HG2      GLU   2  -2.635  -6.912 -28.892
    6    HG3  GLU   2           HG3      GLU   2  -2.323  -7.818 -27.417

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLU   3           H        GLU   3  -4.407  -4.579 -25.455
    2    HA   GLU   3           HA       GLU   3  -3.373  -2.017 -24.829
    3    HB2  GLU   3           HB2      GLU   3  -6.050  -3.350 -24.482
    4    HB3  GLU   3           HB3      GLU   3  -5.759  -1.734 -23.835
    5    HG2  GLU   3           HG2      GLU   3  -5.422  -0.801 -25.962
    6    HG3  GLU   3           HG3      GLU   3  -5.021  -2.352 -26.691

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LEU   4           H        LEU   4  -4.935  -4.390 -22.643
    2    HA   LEU   4           HA       LEU   4  -4.564  -3.163 -20.252
    3    HB2  LEU   4           HB2      LEU   4  -4.004  -6.100 -20.730
    4    HB3  LEU   4           HB3      LEU   4  -4.406  -5.359 -19.182
    5    HG   LEU   4           HG       LEU   4  -6.193  -5.440 -21.636
    6   HD13  LEU   4          HD11      LEU   4  -7.368  -7.167 -20.634
    7   HD12  LEU   4          HD12      LEU   4  -6.877  -6.707 -19.005
    8   HD11  LEU   4          HD13      LEU   4  -5.742  -7.541 -20.065
    9   HD23  LEU   4          HD21      LEU   4  -7.871  -4.643 -19.756
   10   HD22  LEU   4          HD22      LEU   4  -6.846  -3.464 -20.571
   11   HD21  LEU   4          HD23      LEU   4  -6.406  -4.054 -18.969

  No H/Q in entry =          11
  In of MODEL   89
    1    H    GLU   5           H        GLU   5  -2.064  -4.987 -22.001
    2    HA   GLU   5           HA       GLU   5  -0.070  -4.693 -19.976
    3    HB2  GLU   5           HB2      GLU   5   0.001  -6.461 -21.726
    4    HB3  GLU   5           HB3      GLU   5   0.287  -5.216 -22.942
    5    HG2  GLU   5           HG2      GLU   5   2.360  -4.555 -21.819
    6    HG3  GLU   5           HG3      GLU   5   2.070  -5.738 -20.543

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLU   6           H        GLU   6  -0.735  -2.979 -23.014
    2    HA   GLU   6           HA       GLU   6   1.424  -1.133 -22.756
    3    HB2  GLU   6           HB2      GLU   6   0.294  -1.614 -24.912
    4    HB3  GLU   6           HB3      GLU   6  -1.167  -0.841 -24.297
    5    HG2  GLU   6           HG2      GLU   6   0.062   1.269 -24.001
    6    HG3  GLU   6           HG3      GLU   6   1.534   0.503 -24.592

  No H/Q in entry =           6
  In of MODEL   89
    1    H    VAL   7           H        VAL   7  -1.907  -1.228 -21.691
    2    HA   VAL   7           HA       VAL   7  -2.141   1.481 -20.849
    3    HB   VAL   7           HB       VAL   7  -3.582  -1.047 -20.008
    4   HG11  VAL   7          HG11      VAL   7  -3.971   1.837 -19.187
    5   HG13  VAL   7          HG12      VAL   7  -3.856   0.412 -18.155
    6   HG12  VAL   7          HG13      VAL   7  -5.296   0.674 -19.138
    7   HG21  VAL   7          HG21      VAL   7  -3.760   0.032 -22.393
    8   HG23  VAL   7          HG22      VAL   7  -4.709   1.273 -21.574
    9   HG22  VAL   7          HG23      VAL   7  -5.244  -0.408 -21.547

  No H/Q in entry =           9
  In of MODEL   89
    1    H    VAL   8           H        VAL   8  -1.124  -1.500 -19.217
    2    HA   VAL   8           HA       VAL   8  -0.797  -0.423 -16.621
    3    HB   VAL   8           HB       VAL   8   0.609  -2.729 -17.992
    4   HG12  VAL   8          HG11      VAL   8   1.061  -3.393 -15.548
    5   HG11  VAL   8          HG12      VAL   8   0.683  -1.719 -15.143
    6   HG13  VAL   8          HG13      VAL   8   2.042  -2.083 -16.206
    7   HG23  VAL   8          HG21      VAL   8  -1.342  -3.166 -15.780
    8   HG22  VAL   8          HG22      VAL   8  -1.141  -4.047 -17.292
    9   HG21  VAL   8          HG23      VAL   8  -2.040  -2.535 -17.271

  No H/Q in entry =           9
  In of MODEL   89
    1    H    MET   9           H        MET   9   1.437  -0.705 -19.383
    2    HA   MET   9           HA       MET   9   3.724   0.350 -18.134
    3    HB2  MET   9           HB2      MET   9   2.751   0.308 -20.981
    4    HB3  MET   9           HB3      MET   9   4.218   1.186 -20.551
    5    HG2  MET   9           HG2      MET   9   4.958  -0.985 -19.375
    6    HG3  MET   9           HG3      MET   9   3.659  -1.767 -20.276
    7    HE1  MET   9           HE1      MET   9   3.444  -2.145 -22.504
    8    HE3  MET   9           HE2      MET   9   4.561  -1.815 -23.825
    9    HE2  MET   9           HE3      MET   9   3.559  -0.517 -23.182

  No H/Q in entry =           9
  In of MODEL   89
    1    H    GLY  10           H        GLY  10   1.020   1.940 -19.792
    2    HA3  GLY  10           HA2      GLY  10   1.969   4.598 -19.548
    3    HA2  GLY  10           HA3      GLY  10   0.281   4.129 -19.744

  No H/Q in entry =           3
  In of MODEL   89
    1    H    LEU  11           H        LEU  11  -0.095   2.595 -17.458
    2    HA   LEU  11           HA       LEU  11  -0.624   4.565 -15.491
    3    HB2  LEU  11           HB2      LEU  11  -0.539   1.550 -15.341
    4    HB3  LEU  11           HB3      LEU  11  -1.045   2.567 -13.993
    5    HG   LEU  11           HG       LEU  11  -2.302   2.679 -16.748
    6   HD13  LEU  11          HD11      LEU  11  -2.869   0.531 -15.994
    7   HD12  LEU  11          HD12      LEU  11  -4.221   1.515 -15.437
    8   HD11  LEU  11          HD13      LEU  11  -2.955   1.039 -14.306
    9   HD22  LEU  11          HD21      LEU  11  -2.897   4.690 -15.734
   10   HD21  LEU  11          HD22      LEU  11  -2.808   4.021 -14.105
   11   HD23  LEU  11          HD23      LEU  11  -4.188   3.650 -15.139

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  12           H        ILE  12   1.931   2.113 -15.755
    2    HA   ILE  12           HA       ILE  12   3.150   2.653 -13.258
    3    HB   ILE  12           HB       ILE  12   4.392   1.624 -15.831
    4   HG12  ILE  12          HG12      ILE  12   2.394   0.380 -14.672
    5   HG13  ILE  12          HG13      ILE  12   3.794  -0.547 -15.172
    6   HG22  ILE  12          HG21      ILE  12   6.070   0.591 -14.231
    7   HG21  ILE  12          HG22      ILE  12   5.390   1.613 -12.966
    8   HG23  ILE  12          HG23      ILE  12   6.163   2.345 -14.371
    9   HD12  ILE  12          HD11      ILE  12   2.956  -1.096 -12.876
   10   HD11  ILE  12          HD12      ILE  12   3.356   0.549 -12.384
   11   HD13  ILE  12          HD13      ILE  12   4.623  -0.546 -12.893

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  13           H        ILE  13   3.723   3.925 -16.517
    2    HA   ILE  13           HA       ILE  13   5.856   5.655 -15.803
    3    HB   ILE  13           HB       ILE  13   3.810   5.728 -18.035
    4   HG12  ILE  13          HG12      ILE  13   5.633   3.889 -17.796
    5   HG13  ILE  13          HG13      ILE  13   5.426   4.671 -19.358
    6   HG22  ILE  13          HG21      ILE  13   5.463   7.337 -19.133
    7   HG21  ILE  13          HG22      ILE  13   6.181   7.555 -17.540
    8   HG23  ILE  13          HG23      ILE  13   4.500   8.011 -17.816
    9   HD13  ILE  13          HD11      ILE  13   7.465   5.755 -19.230
   10   HD12  ILE  13          HD12      ILE  13   7.832   4.400 -18.169
   11   HD11  ILE  13          HD13      ILE  13   7.352   5.947 -17.481

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ASN  14           H        ASN  14   2.345   6.132 -16.046
    2    HA   ASN  14           HA       ASN  14   2.292   8.876 -15.404
    3    HB2  ASN  14           HB2      ASN  14   0.402   7.226 -16.224
    4    HB3  ASN  14           HB3      ASN  14   0.093   7.043 -14.502
    5   HD21  ASN  14          HD21      ASN  14  -1.942   8.191 -15.919
    6   HD22  ASN  14          HD22      ASN  14  -2.012   9.863 -15.648

  No H/Q in entry =           6
  In of MODEL   89
    1    H    SER  15           H        SER  15   2.027   5.994 -13.331
    2    HA   SER  15           HA       SER  15   1.729   7.358 -10.877
    3    HB2  SER  15           HB2      SER  15   2.301   5.274  -9.836
    4    HB3  SER  15           HB3      SER  15   1.458   4.853 -11.323
    5    HG   SER  15           HG       SER  15   3.224   3.681 -11.537

  No H/Q in entry =           5
  In of MODEL   89
    1    H    GLY  16           H        GLY  16   4.599   6.281 -12.658
    2    HA3  GLY  16           HA2      GLY  16   6.533   7.045 -10.739
    3    HA2  GLY  16           HA3      GLY  16   6.825   6.847 -12.465

  No H/Q in entry =           3
  In of MODEL   89
    1    H    GLN  17           H        GLN  17   5.117   8.797 -13.513
    2    HA   GLN  17           HA       GLN  17   6.683  11.147 -13.212
    3    HB2  GLN  17           HB2      GLN  17   5.379  10.700 -15.251
    4    HB3  GLN  17           HB3      GLN  17   3.880  10.831 -14.330
    5    HG2  GLN  17           HG2      GLN  17   4.332  13.162 -13.818
    6    HG3  GLN  17           HG3      GLN  17   5.920  13.056 -14.579
    7   HE21  GLN  17          HE21      GLN  17   4.011  14.958 -15.503
    8   HE22  GLN  17          HE22      GLN  17   3.499  14.498 -17.055

  No H/Q in entry =           8
  In of MODEL   89
    1    H    ALA  18           H        ALA  18   3.598  10.108 -11.843
    2    HA   ALA  18           HA       ALA  18   2.867  12.489 -10.568
    3    HB1  ALA  18           HB1      ALA  18   1.751  10.026 -10.787
    4    HB2  ALA  18           HB2      ALA  18   1.203  11.240  -9.634
    5    HB3  ALA  18           HB3      ALA  18   2.305   9.964  -9.114

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ARG  19           H        ARG  19   4.767   9.736  -9.307
    2    HA   ARG  19           HA       ARG  19   5.309  10.893  -6.786
    3    HB2  ARG  19           HB2      ARG  19   5.736   8.494  -7.320
    4    HB3  ARG  19           HB3      ARG  19   7.081   8.991  -8.350
    5    HG2  ARG  19           HG2      ARG  19   8.207  10.035  -6.433
    6    HG3  ARG  19           HG3      ARG  19   6.841   9.636  -5.393
    7    HD2  ARG  19           HD2      ARG  19   8.616   8.012  -5.050
    8    HD3  ARG  19           HD3      ARG  19   7.242   7.222  -5.828
    9    HE   ARG  19           HE       ARG  19   8.927   8.056  -7.885
   10   HH21  ARG  19          HH11      ARG  19  10.491   6.663  -8.749
   11   HH22  ARG  19          HH12      ARG  19  11.052   5.317  -7.820
   12   HH11  ARG  19          HH21      ARG  19   9.032   6.021  -5.111
   13   HH12  ARG  19          HH22      ARG  19  10.223   4.953  -5.759

  No H/Q in entry =          13
  In of MODEL   89
    1    H    SER  20           H        SER  20   7.105  10.941  -9.847
    2    HA   SER  20           HA       SER  20   9.346  12.371  -9.036
    3    HB2  SER  20           HB2      SER  20   9.374  11.502 -11.241
    4    HB3  SER  20           HB3      SER  20   7.860  12.299 -11.656
    5    HG   SER  20           HG       SER  20   9.052  14.310 -11.265

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LEU  21           H        LEU  21   6.229  13.619 -10.210
    2    HA   LEU  21           HA       LEU  21   6.881  16.370  -9.985
    3    HB2  LEU  21           HB2      LEU  21   4.224  14.926  -9.890
    4    HB3  LEU  21           HB3      LEU  21   4.377  16.681  -9.891
    5    HG   LEU  21           HG       LEU  21   5.579  14.904 -12.035
    6   HD12  LEU  21          HD11      LEU  21   3.649  15.663 -13.430
    7   HD11  LEU  21          HD12      LEU  21   2.936  16.392 -11.990
    8   HD13  LEU  21          HD13      LEU  21   3.156  14.646 -12.077
    9   HD23  LEU  21          HD21      LEU  21   5.292  17.243 -13.256
   10   HD22  LEU  21          HD22      LEU  21   6.689  16.978 -12.217
   11   HD21  LEU  21          HD23      LEU  21   5.309  17.884 -11.617

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ALA  22           H        ALA  22   5.402  14.065  -7.731
    2    HA   ALA  22           HA       ALA  22   4.799  15.864  -5.656
    3    HB3  ALA  22           HB1      ALA  22   4.056  13.466  -5.819
    4    HB2  ALA  22           HB2      ALA  22   4.651  13.940  -4.227
    5    HB1  ALA  22           HB3      ALA  22   5.674  12.991  -5.307

  No H/Q in entry =           5
  In of MODEL   89
    1    H    TYR  23           H        TYR  23   7.746  13.863  -6.119
    2    HA   TYR  23           HA       TYR  23   9.136  14.889  -3.874
    3    HB2  TYR  23           HB2      TYR  23   9.931  12.890  -5.041
    4    HB3  TYR  23           HB3      TYR  23  10.227  13.834  -6.500
    5    HD1  TYR  23           HD1      TYR  23  11.212  13.508  -2.913
    6    HD2  TYR  23           HD2      TYR  23  12.256  15.012  -6.800
    7    HE1  TYR  23           HE1      TYR  23  13.471  14.102  -2.078
    8    HE2  TYR  23           HE2      TYR  23  14.513  15.606  -5.964
    9    HH   TYR  23           HH       TYR  23  15.301  15.957  -2.892

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ALA  24           H        ALA  24   8.920  16.001  -7.237
    2    HA   ALA  24           HA       ALA  24  10.800  18.102  -6.999
    3    HB2  ALA  24           HB1      ALA  24  10.341  18.164  -9.205
    4    HB3  ALA  24           HB2      ALA  24   8.782  18.899  -8.834
    5    HB1  ALA  24           HB3      ALA  24   8.922  17.148  -8.968

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ALA  25           H        ALA  25   7.327  17.885  -6.355
    2    HA   ALA  25           HA       ALA  25   6.826  20.598  -5.778
    3    HB1  ALA  25           HB1      ALA  25   5.182  18.585  -5.971
    4    HB2  ALA  25           HB2      ALA  25   4.810  19.868  -4.818
    5    HB3  ALA  25           HB3      ALA  25   5.518  18.352  -4.254

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LEU  26           H        LEU  26   7.933  17.925  -3.740
    2    HA   LEU  26           HA       LEU  26   8.041  19.353  -1.301
    3    HB2  LEU  26           HB2      LEU  26   8.160  16.937  -1.300
    4    HB3  LEU  26           HB3      LEU  26   9.623  16.961  -2.281
    5    HG   LEU  26           HG       LEU  26  10.840  18.087  -0.448
    6   HD12  LEU  26          HD11      LEU  26   9.629  18.080   1.821
    7   HD11  LEU  26          HD12      LEU  26   8.136  17.929   0.896
    8   HD13  LEU  26          HD13      LEU  26   9.166  19.345   0.682
    9   HD21  LEU  26          HD21      LEU  26   9.336  15.603   0.432
   10   HD23  LEU  26          HD22      LEU  26  10.851  16.179   1.120
   11   HD22  LEU  26          HD23      LEU  26  10.799  15.623  -0.551

  No H/Q in entry =          11
  In of MODEL   89
    1    H    LYS  27           H        LYS  27  10.446  18.808  -3.843
    2    HA   LYS  27           HA       LYS  27  12.626  20.069  -2.629
    3    HB2  LYS  27           HB2      LYS  27  12.727  18.726  -4.721
    4    HB3  LYS  27           HB3      LYS  27  11.942  20.051  -5.579
    5    HG2  LYS  27           HG2      LYS  27  13.797  21.555  -5.012
    6    HG3  LYS  27           HG3      LYS  27  14.576  20.269  -4.083
    7    HD2  LYS  27           HD2      LYS  27  14.720  18.886  -6.140
    8    HD3  LYS  27           HD3      LYS  27  13.985  20.198  -7.061
    9    HE2  LYS  27           HE2      LYS  27  15.861  21.682  -6.459
   10    HE3  LYS  27           HE3      LYS  27  16.600  20.374  -5.529
   11    HZ3  LYS  27           HZ1      LYS  27  17.574  20.488  -7.722
   12    HZ2  LYS  27           HZ2      LYS  27  16.044  20.355  -8.452
   13    HZ1  LYS  27           HZ3      LYS  27  16.686  19.049  -7.574

  No H/Q in entry =          13
  In of MODEL   89
    1    H    GLN  28           H        GLN  28   9.976  21.426  -4.557
    2    HA   GLN  28           HA       GLN  28  10.907  24.089  -4.712
    3    HB2  GLN  28           HB2      GLN  28   8.087  22.986  -4.585
    4    HB3  GLN  28           HB3      GLN  28   8.476  24.665  -4.954
    5    HG2  GLN  28           HG2      GLN  28   9.524  22.286  -6.514
    6    HG3  GLN  28           HG3      GLN  28   8.137  23.260  -7.000
    7   HE21  GLN  28          HE21      GLN  28   9.147  25.851  -6.265
    8   HE22  GLN  28          HE22      GLN  28  10.461  26.210  -7.278

  No H/Q in entry =           8
  In of MODEL   89
    1    H    ALA  29           H        ALA  29   9.010  22.373  -2.265
    2    HA   ALA  29           HA       ALA  29   8.449  24.556  -0.576
    3    HB2  ALA  29           HB1      ALA  29   7.748  22.978   0.994
    4    HB1  ALA  29           HB2      ALA  29   8.978  21.807   0.519
    5    HB3  ALA  29           HB3      ALA  29   7.582  22.088  -0.519

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LYS  30           H        LYS  30  11.203  22.318  -0.668
    2    HA   LYS  30           HA       LYS  30  12.526  23.283   1.627
    3    HB2  LYS  30           HB2      LYS  30  13.619  22.013  -0.893
    4    HB3  LYS  30           HB3      LYS  30  14.608  22.380   0.522
    5    HG2  LYS  30           HG2      LYS  30  13.079  20.978   1.910
    6    HG3  LYS  30           HG3      LYS  30  12.188  20.550   0.446
    7    HD2  LYS  30           HD2      LYS  30  14.237  19.587  -0.531
    8    HD3  LYS  30           HD3      LYS  30  15.146  20.030   0.915
    9    HE2  LYS  30           HE2      LYS  30  13.667  18.580   2.278
   10    HE3  LYS  30           HE3      LYS  30  12.787  18.118   0.816
   11    HZ2  LYS  30           HZ1      LYS  30  14.601  16.558   1.561
   12    HZ1  LYS  30           HZ2      LYS  30  15.722  17.758   1.104
   13    HZ3  LYS  30           HZ3      LYS  30  14.686  17.064  -0.055

  No H/Q in entry =          13
  In of MODEL   89
    1    H    GLN  31           H        GLN  31  12.381  24.491  -1.667
    2    HA   GLN  31           HA       GLN  31  14.516  26.407  -1.258
    3    HB2  GLN  31           HB2      GLN  31  12.457  26.435  -3.468
    4    HB3  GLN  31           HB3      GLN  31  14.070  27.148  -3.479
    5    HG2  GLN  31           HG2      GLN  31  14.565  24.457  -2.911
    6    HG3  GLN  31           HG3      GLN  31  13.254  24.390  -4.081
    7   HE21  GLN  31          HE21      GLN  31  16.103  23.629  -4.506
    8   HE22  GLN  31          HE22      GLN  31  16.655  24.610  -5.775

  No H/Q in entry =           8
  In of MODEL   89
    1    H    GLY  32           H        GLY  32  11.452  26.190  -0.091
    2    HA3  GLY  32           HA2      GLY  32  10.288  27.743   1.193
    3    HA2  GLY  32           HA3      GLY  32  11.396  28.992   0.637

  No H/Q in entry =           3
  In of MODEL   89
    1    H    ASP  33           H        ASP  33  10.035  27.077  -1.849
    2    HA   ASP  33           HA       ASP  33   8.340  29.333  -2.689
    3    HB2  ASP  33           HB2      ASP  33   9.449  26.928  -4.143
    4    HB3  ASP  33           HB3      ASP  33   8.281  28.032  -4.864

  No H/Q in entry =           4
  In of MODEL   89
    1    H    PHE  34           H        PHE  34   6.668  28.836  -1.114
    2    HA   PHE  34           HA       PHE  34   5.316  26.349  -1.013
    3    HB2  PHE  34           HB2      PHE  34   4.330  29.124  -0.322
    4    HB3  PHE  34           HB3      PHE  34   3.500  27.624   0.093
    5    HD1  PHE  34           HD1      PHE  34   5.732  30.045   1.295
    6    HD2  PHE  34           HD2      PHE  34   5.098  25.797   1.240
    7    HE1  PHE  34           HE1      PHE  34   7.140  29.807   3.322
    8    HE2  PHE  34           HE2      PHE  34   6.508  25.563   3.264
    9    HZ   PHE  34           HZ       PHE  34   7.523  27.569   4.305

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ALA  35           H        ALA  35   4.840  29.211  -3.016
    2    HA   ALA  35           HA       ALA  35   2.289  28.570  -4.024
    3    HB3  ALA  35           HB1      ALA  35   3.311  29.977  -6.067
    4    HB2  ALA  35           HB2      ALA  35   4.533  30.350  -4.851
    5    HB1  ALA  35           HB3      ALA  35   2.840  30.740  -4.548

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ALA  36           H        ALA  36   5.515  27.935  -5.402
    2    HA   ALA  36           HA       ALA  36   4.526  26.498  -7.641
    3    HB3  ALA  36           HB1      ALA  36   6.679  26.647  -8.272
    4    HB2  ALA  36           HB2      ALA  36   7.181  25.622  -6.927
    5    HB1  ALA  36           HB3      ALA  36   7.058  27.368  -6.708

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ALA  37           H        ALA  37   5.516  25.509  -4.395
    2    HA   ALA  37           HA       ALA  37   5.485  22.721  -4.828
    3    HB2  ALA  37           HB1      ALA  37   5.221  24.506  -2.445
    4    HB1  ALA  37           HB2      ALA  37   6.366  23.201  -2.747
    5    HB3  ALA  37           HB3      ALA  37   4.712  22.828  -2.265

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LYS  38           H        LYS  38   2.936  24.899  -3.638
    2    HA   LYS  38           HA       LYS  38   0.858  23.063  -3.404
    3    HB2  LYS  38           HB2      LYS  38   1.181  25.822  -3.151
    4    HB3  LYS  38           HB3      LYS  38  -0.026  25.664  -4.422
    5    HG2  LYS  38           HG2      LYS  38  -1.450  24.322  -2.971
    6    HG3  LYS  38           HG3      LYS  38  -0.196  24.274  -1.724
    7    HD2  LYS  38           HD2      LYS  38  -0.405  26.608  -1.271
    8    HD3  LYS  38           HD3      LYS  38  -1.331  26.889  -2.747
    9    HE2  LYS  38           HE2      LYS  38  -2.821  26.903  -0.796
   10    HE3  LYS  38           HE3      LYS  38  -3.187  25.525  -1.838
   11    HZ3  LYS  38           HZ1      LYS  38  -2.434  24.059  -0.312
   12    HZ2  LYS  38           HZ2      LYS  38  -2.791  25.311   0.781
   13    HZ1  LYS  38           HZ3      LYS  38  -1.197  25.079   0.244

  No H/Q in entry =          13
  In of MODEL   89
    1    H    ALA  39           H        ALA  39   1.797  24.980  -6.256
    2    HA   ALA  39           HA       ALA  39  -0.281  24.093  -7.946
    3    HB2  ALA  39           HB1      ALA  39   2.440  24.773  -9.018
    4    HB1  ALA  39           HB2      ALA  39   1.465  26.022  -8.244
    5    HB3  ALA  39           HB3      ALA  39   0.852  25.180  -9.667

  No H/Q in entry =           5
  In of MODEL   89
    1    H    MET  40           H        MET  40   2.975  22.829  -7.391
    2    HA   MET  40           HA       MET  40   2.886  20.811  -9.385
    3    HB2  MET  40           HB2      MET  40   4.513  21.049  -6.848
    4    HB3  MET  40           HB3      MET  40   4.769  19.797  -8.066
    5    HG2  MET  40           HG2      MET  40   4.788  22.755  -8.727
    6    HG3  MET  40           HG3      MET  40   6.248  21.868  -8.290
    7    HE3  MET  40           HE1      MET  40   7.125  19.667 -11.108
    8    HE2  MET  40           HE2      MET  40   6.577  19.339  -9.467
    9    HE1  MET  40           HE3      MET  40   7.655  20.699  -9.772

  No H/Q in entry =           9
  In of MODEL   89
    1    H    MET  41           H        MET  41   1.995  20.838  -5.955
    2    HA   MET  41           HA       MET  41   1.495  18.067  -5.678
    3    HB2  MET  41           HB2      MET  41   0.146  20.407  -4.314
    4    HB3  MET  41           HB3      MET  41   0.012  18.727  -3.807
    5    HG2  MET  41           HG2      MET  41   2.720  18.980  -3.863
    6    HG3  MET  41           HG3      MET  41   2.263  20.633  -3.462
    7    HE2  MET  41           HE1      MET  41  -0.750  19.343  -1.717
    8    HE1  MET  41           HE2      MET  41   0.047  20.866  -2.098
    9    HE3  MET  41           HE3      MET  41   0.006  20.292  -0.430

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ASP  42           H        ASP  42  -0.581  20.769  -6.633
    2    HA   ASP  42           HA       ASP  42  -3.007  19.381  -6.755
    3    HB2  ASP  42           HB2      ASP  42  -2.331  21.959  -7.012
    4    HB3  ASP  42           HB3      ASP  42  -2.490  21.565  -8.720

  No H/Q in entry =           4
  In of MODEL   89
    1    H    GLN  43           H        GLN  43  -0.591  20.004  -9.273
    2    HA   GLN  43           HA       GLN  43  -1.977  18.672 -11.355
    3    HB2  GLN  43           HB2      GLN  43   0.978  19.221 -10.993
    4    HB3  GLN  43           HB3      GLN  43   0.261  18.575 -12.471
    5    HG2  GLN  43           HG2      GLN  43  -1.274  20.585 -12.499
    6    HG3  GLN  43           HG3      GLN  43  -0.320  21.250 -11.177
    7   HE21  GLN  43          HE21      GLN  43  -0.192  22.875 -13.261
    8   HE22  GLN  43          HE22      GLN  43   1.219  22.672 -14.179

  No H/Q in entry =           8
  In of MODEL   89
    1    H    SER  44           H        SER  44   0.404  17.555  -8.982
    2    HA   SER  44           HA       SER  44   0.762  14.954 -10.014
    3    HB2  SER  44           HB2      SER  44   1.656  16.400  -7.782
    4    HB3  SER  44           HB3      SER  44   0.814  15.005  -7.107
    5    HG   SER  44           HG       SER  44   2.929  14.411  -7.549

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ARG  45           H        ARG  45  -1.557  16.241  -7.658
    2    HA   ARG  45           HA       ARG  45  -2.911  13.863  -7.017
    3    HB2  ARG  45           HB2      ARG  45  -3.127  16.027  -5.820
    4    HB3  ARG  45           HB3      ARG  45  -4.000  16.686  -7.200
    5    HG2  ARG  45           HG2      ARG  45  -5.743  14.939  -6.907
    6    HG3  ARG  45           HG3      ARG  45  -4.882  14.335  -5.491
    7    HD2  ARG  45           HD2      ARG  45  -5.108  16.597  -4.430
    8    HD3  ARG  45           HD3      ARG  45  -6.111  17.107  -5.804
    9    HE   ARG  45           HE       ARG  45  -7.185  14.716  -4.760
   10   HH21  ARG  45          HH11      ARG  45  -9.013  14.768  -3.477
   11   HH22  ARG  45          HH12      ARG  45  -9.419  16.201  -2.603
   12   HH11  ARG  45          HH21      ARG  45  -6.671  17.968  -3.735
   13   HH12  ARG  45          HH22      ARG  45  -8.088  18.014  -2.747

  No H/Q in entry =          13
  In of MODEL   89
    1    H    MET  46           H        MET  46  -3.542  16.264  -9.559
    2    HA   MET  46           HA       MET  46  -5.874  15.065 -10.607
    3    HB2  MET  46           HB2      MET  46  -3.801  16.911 -11.806
    4    HB3  MET  46           HB3      MET  46  -5.200  16.351 -12.728
    5    HG2  MET  46           HG2      MET  46  -6.711  17.265 -11.022
    6    HG3  MET  46           HG3      MET  46  -5.334  17.790 -10.060
    7    HE2  MET  46           HE1      MET  46  -5.868  20.242  -9.884
    8    HE1  MET  46           HE2      MET  46  -7.431  19.867 -10.604
    9    HE3  MET  46           HE3      MET  46  -6.501  21.241 -11.200

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ALA  47           H        ALA  47  -2.445  14.629 -11.389
    2    HA   ALA  47           HA       ALA  47  -2.784  12.901 -13.600
    3    HB3  ALA  47           HB1      ALA  47  -0.615  13.817 -13.262
    4    HB2  ALA  47           HB2      ALA  47  -0.450  12.090 -12.932
    5    HB1  ALA  47           HB3      ALA  47  -0.548  13.239 -11.596

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LEU  48           H        LEU  48  -2.483  12.264 -10.129
    2    HA   LEU  48           HA       LEU  48  -2.542   9.423 -10.291
    3    HB2  LEU  48           HB2      LEU  48  -3.315  11.328  -8.069
    4    HB3  LEU  48           HB3      LEU  48  -3.198   9.578  -7.872
    5    HG   LEU  48           HG       LEU  48  -0.927  11.308  -8.882
    6   HD13  LEU  48          HD11      LEU  48  -1.204  12.071  -6.688
    7   HD12  LEU  48          HD12      LEU  48  -0.024  10.778  -6.500
    8   HD11  LEU  48          HD13      LEU  48  -1.715  10.493  -6.091
    9   HD22  LEU  48          HD21      LEU  48  -0.406   9.130  -9.530
   10   HD21  LEU  48          HD22      LEU  48  -1.257   8.401  -8.169
   11   HD23  LEU  48          HD23      LEU  48   0.308   9.174  -7.918

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ASN  49           H        ASN  49  -5.034  11.883  -9.869
    2    HA   ASN  49           HA       ASN  49  -7.195  10.191  -9.317
    3    HB2  ASN  49           HB2      ASN  49  -7.297  12.603  -8.981
    4    HB3  ASN  49           HB3      ASN  49  -7.120  12.883 -10.708
    5   HD21  ASN  49          HD21      ASN  49  -9.403  12.785  -8.303
    6   HD22  ASN  49          HD22      ASN  49 -10.772  12.414  -9.232

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLU  50           H        GLU  50  -5.952  11.408 -12.411
    2    HA   GLU  50           HA       GLU  50  -7.901  10.131 -14.045
    3    HB2  GLU  50           HB2      GLU  50  -6.464  11.969 -14.867
    4    HB3  GLU  50           HB3      GLU  50  -5.056  10.914 -14.740
    5    HG2  GLU  50           HG2      GLU  50  -6.021   9.369 -16.372
    6    HG3  GLU  50           HG3      GLU  50  -7.494  10.329 -16.448

  No H/Q in entry =           6
  In of MODEL   89
    1    H    ALA  51           H        ALA  51  -4.710   9.176 -12.863
    2    HA   ALA  51           HA       ALA  51  -4.550   6.727 -14.285
    3    HB2  ALA  51           HB1      ALA  51  -2.558   6.463 -13.199
    4    HB1  ALA  51           HB2      ALA  51  -3.241   6.874 -11.626
    5    HB3  ALA  51           HB3      ALA  51  -2.809   8.152 -12.762

  No H/Q in entry =           5
  In of MODEL   89
    1    H    HIS  52           H        HIS  52  -5.711   7.540 -11.027
    2    HA   HIS  52           HA       HIS  52  -6.358   4.920 -10.195
    3    HB2  HIS  52           HB2      HIS  52  -6.238   6.811  -8.641
    4    HB3  HIS  52           HB3      HIS  52  -7.632   7.556  -9.424
    5    HD1  HIS  52           HD1      HIS  52  -9.871   5.935  -9.427
    6    HD2  HIS  52           HD2      HIS  52  -6.944   5.120  -6.574
    7    HE1  HIS  52           HE1      HIS  52 -10.983   4.523  -7.642
    8    HE2  HIS  52           HE2      HIS  52  -9.211   4.018  -5.896

  No H/Q in entry =           8
  In of MODEL   89
    1    H    LEU  53           H        LEU  53  -8.220   7.358 -11.967
    2    HA   LEU  53           HA       LEU  53 -10.710   6.036 -11.965
    3    HB2  LEU  53           HB2      LEU  53  -9.464   8.030 -13.848
    4    HB3  LEU  53           HB3      LEU  53 -11.062   7.352 -14.147
    5    HG   LEU  53           HG       LEU  53 -10.326   8.666 -11.514
    6   HD11  LEU  53          HD11      LEU  53 -11.526   9.876 -14.018
    7   HD13  LEU  53          HD12      LEU  53 -10.043  10.367 -13.198
    8   HD12  LEU  53          HD13      LEU  53 -11.607  10.642 -12.436
    9   HD23  LEU  53          HD21      LEU  53 -12.915   9.053 -11.634
   10   HD22  LEU  53          HD22      LEU  53 -12.320   7.459 -11.189
   11   HD21  LEU  53          HD23      LEU  53 -12.898   7.753 -12.817

  No H/Q in entry =          11
  In of MODEL   89
    1    H    VAL  54           H        VAL  54  -7.972   5.875 -14.221
    2    HA   VAL  54           HA       VAL  54  -9.185   4.092 -16.059
    3    HB   VAL  54           HB       VAL  54  -6.280   4.632 -15.395
    4   HG12  VAL  54          HG11      VAL  54  -6.035   3.554 -17.787
    5   HG11  VAL  54          HG12      VAL  54  -7.552   2.754 -17.375
    6   HG13  VAL  54          HG13      VAL  54  -6.127   2.515 -16.365
    7   HG22  VAL  54          HG21      VAL  54  -7.079   6.568 -16.431
    8   HG21  VAL  54          HG22      VAL  54  -8.268   5.692 -17.393
    9   HG23  VAL  54          HG23      VAL  54  -6.564   5.633 -17.835

  No H/Q in entry =           9
  In of MODEL   89
    1    H    GLN  55           H        GLN  55  -7.161   3.566 -13.173
    2    HA   GLN  55           HA       GLN  55  -7.040   0.750 -13.434
    3    HB2  GLN  55           HB2      GLN  55  -5.485   1.662 -11.924
    4    HB3  GLN  55           HB3      GLN  55  -6.708   2.613 -11.085
    5    HG2  GLN  55           HG2      GLN  55  -7.367   0.846  -9.765
    6    HG3  GLN  55           HG3      GLN  55  -7.136  -0.336 -11.047
    7   HE21  GLN  55          HE21      GLN  55  -5.493  -1.768 -10.565
    8   HE22  GLN  55          HE22      GLN  55  -4.107  -1.401  -9.662

  No H/Q in entry =           8
  In of MODEL   89
    1    H    THR  56           H        THR  56  -9.386   2.883 -11.801
    2    HA   THR  56           HA       THR  56 -10.940   0.980 -10.505
    3    HB   THR  56           HB       THR  56 -12.072   3.357 -12.000
    4    HG1  THR  56           HG1      THR  56 -10.400   3.169  -9.813
    5   HG23  THR  56          HG21      THR  56 -13.803   3.299 -10.356
    6   HG22  THR  56          HG22      THR  56 -12.919   2.133  -9.369
    7   HG21  THR  56          HG23      THR  56 -13.607   1.640 -10.917

  No H/Q in entry =           7
  In of MODEL   89
    1    H    LYS  57           H        LYS  57 -11.176   2.065 -13.888
    2    HA   LYS  57           HA       LYS  57 -13.317   0.354 -14.630
    3    HB2  LYS  57           HB2      LYS  57 -12.211   2.370 -15.877
    4    HB3  LYS  57           HB3      LYS  57 -11.078   1.169 -16.481
    5    HG2  LYS  57           HG2      LYS  57 -12.869  -0.096 -17.507
    6    HG3  LYS  57           HG3      LYS  57 -14.085   0.949 -16.780
    7    HD2  LYS  57           HD2      LYS  57 -13.860   1.701 -19.035
    8    HD3  LYS  57           HD3      LYS  57 -12.988   2.882 -18.059
    9    HE2  LYS  57           HE2      LYS  57 -10.857   1.891 -18.624
   10    HE3  LYS  57           HE3      LYS  57 -11.632   0.508 -19.396
   11    HZ3  LYS  57           HZ1      LYS  57 -12.371   1.810 -21.157
   12    HZ2  LYS  57           HZ2      LYS  57 -10.788   2.363 -20.881
   13    HZ1  LYS  57           HZ3      LYS  57 -12.117   3.268 -20.328

  No H/Q in entry =          13
  In of MODEL   89
    1    H    LEU  58           H        LEU  58  -9.808  -0.036 -14.596
    2    HA   LEU  58           HA       LEU  58  -9.795  -2.552 -15.888
    3    HB2  LEU  58           HB2      LEU  58  -7.764  -1.239 -14.091
    4    HB3  LEU  58           HB3      LEU  58  -7.492  -2.756 -14.948
    5    HG   LEU  58           HG       LEU  58  -8.284  -0.159 -16.304
    6   HD11  LEU  58          HD11      LEU  58  -5.619  -1.366 -15.631
    7   HD13  LEU  58          HD12      LEU  58  -6.133   0.319 -15.577
    8   HD12  LEU  58          HD13      LEU  58  -5.795  -0.446 -17.126
    9   HD22  LEU  58          HD21      LEU  58  -8.852  -1.726 -17.893
   10   HD21  LEU  58          HD22      LEU  58  -7.792  -2.962 -17.219
   11   HD23  LEU  58          HD23      LEU  58  -7.122  -1.679 -18.227

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  59           H        ILE  59 -10.607  -1.663 -12.631
    2    HA   ILE  59           HA       ILE  59 -10.217  -4.427 -11.688
    3    HB   ILE  59           HB       ILE  59  -9.786  -2.162 -10.288
    4   HG12  ILE  59          HG12      ILE  59 -11.139  -4.517  -8.956
    5   HG13  ILE  59          HG13      ILE  59  -9.500  -4.593  -9.552
    6   HG21  ILE  59          HG21      ILE  59 -12.323  -1.653 -10.531
    7   HG23  ILE  59          HG22      ILE  59 -11.610  -1.487  -8.943
    8   HG22  ILE  59          HG23      ILE  59 -12.552  -2.918  -9.348
    9   HD13  ILE  59          HD11      ILE  59  -8.850  -2.718  -8.136
   10   HD12  ILE  59          HD12      ILE  59  -9.560  -3.993  -7.153
   11   HD11  ILE  59          HD13      ILE  59 -10.506  -2.560  -7.560

  No H/Q in entry =          11
  In of MODEL   89
    1    H    GLU  60           H        GLU  60 -12.807  -2.140 -12.478
    2    HA   GLU  60           HA       GLU  60 -14.968  -3.683 -11.453
    3    HB2  GLU  60           HB2      GLU  60 -15.259  -1.334 -12.020
    4    HB3  GLU  60           HB3      GLU  60 -14.861  -1.656 -13.705
    5    HG2  GLU  60           HG2      GLU  60 -17.155  -3.096 -12.389
    6    HG3  GLU  60           HG3      GLU  60 -17.374  -1.485 -13.041

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLY  61           H        GLY  61 -13.314  -3.645 -14.579
    2    HA3  GLY  61           HA2      GLY  61 -15.005  -5.909 -15.461
    3    HA2  GLY  61           HA3      GLY  61 -14.180  -4.793 -16.543

  No H/Q in entry =           3
  In of MODEL   89
    1    H    ASP  62           H        ASP  62 -12.774  -6.231 -13.668
    2    HA   ASP  62           HA       ASP  62 -10.454  -7.085 -15.055
    3    HB2  ASP  62           HB2      ASP  62  -9.920  -8.180 -12.861
    4    HB3  ASP  62           HB3      ASP  62 -10.327  -6.473 -12.728

  No H/Q in entry =           4
  In of MODEL   89
    1    H    ALA  63           H        ALA  63 -13.518  -8.516 -14.997
    2    HA   ALA  63           HA       ALA  63 -12.634 -11.303 -15.054
    3    HB2  ALA  63           HB1      ALA  63 -14.941 -10.286 -14.268
    4    HB3  ALA  63           HB2      ALA  63 -14.923 -11.827 -15.126
    5    HB1  ALA  63           HB3      ALA  63 -15.332 -10.341 -15.986

  No H/Q in entry =           5
  In of MODEL   89
    1    H    GLY  64           H        GLY  64 -13.517 -12.624 -16.955
    2    HA3  GLY  64           HA2      GLY  64 -14.062 -12.325 -19.427
    3    HA2  GLY  64           HA3      GLY  64 -12.605 -11.342 -19.450

  No H/Q in entry =           3
  In of MODEL   89
    1    H    GLU  65           H        GLU  65 -10.705 -12.629 -18.202
    2    HA   GLU  65           HA       GLU  65 -10.055 -14.769 -19.923
    3    HB2  GLU  65           HB2      GLU  65  -8.793 -13.831 -17.349
    4    HB3  GLU  65           HB3      GLU  65  -8.111 -15.105 -18.363
    5    HG2  GLU  65           HG2      GLU  65  -7.979 -13.569 -20.260
    6    HG3  GLU  65           HG3      GLU  65  -8.739 -12.295 -19.309

  No H/Q in entry =           6
  In of MODEL   89
    1    H    GLY  66           H        GLY  66 -11.320 -14.675 -16.694
    2    HA3  GLY  66           HA2      GLY  66 -12.407 -17.295 -16.814
    3    HA2  GLY  66           HA3      GLY  66 -10.992 -17.256 -15.780

  No H/Q in entry =           3
  In of MODEL   89
    1    H    LYS  67           H        LYS  67 -13.251 -18.045 -14.663
    2    HA   LYS  67           HA       LYS  67 -15.014 -16.154 -13.638
    3    HB2  LYS  67           HB2      LYS  67 -14.175 -18.754 -12.356
    4    HB3  LYS  67           HB3      LYS  67 -15.680 -17.872 -12.071
    5    HG2  LYS  67           HG2      LYS  67 -14.797 -18.883 -14.790
    6    HG3  LYS  67           HG3      LYS  67 -15.918 -19.743 -13.737
    7    HD2  LYS  67           HD2      LYS  67 -17.283 -17.540 -13.732
    8    HD3  LYS  67           HD3      LYS  67 -16.308 -17.104 -15.137
    9    HE2  LYS  67           HE2      LYS  67 -17.022 -19.117 -16.316
   10    HE3  LYS  67           HE3      LYS  67 -17.903 -19.672 -14.892
   11    HZ3  LYS  67           HZ1      LYS  67 -19.554 -18.171 -15.212
   12    HZ2  LYS  67           HZ2      LYS  67 -19.074 -18.354 -16.830
   13    HZ1  LYS  67           HZ3      LYS  67 -18.541 -17.017 -15.930

  No H/Q in entry =          13
  In of MODEL   89
    1    H    MET  68           H        MET  68 -13.026 -17.879 -11.371
    2    HA   MET  68           HA       MET  68 -12.947 -15.813  -9.453
    3    HB2  MET  68           HB2      MET  68 -11.553 -18.446  -9.775
    4    HB3  MET  68           HB3      MET  68 -11.124 -17.358  -8.455
    5    HG2  MET  68           HG2      MET  68 -13.959 -18.249  -9.039
    6    HG3  MET  68           HG3      MET  68 -12.907 -19.036  -7.861
    7    HE3  MET  68           HE1      MET  68 -15.480 -16.339  -8.482
    8    HE2  MET  68           HE2      MET  68 -15.834 -16.164  -6.763
    9    HE1  MET  68           HE3      MET  68 -15.751 -17.773  -7.480

  No H/Q in entry =           9
  In of MODEL   89
    1    H    LYS  69           H        LYS  69 -10.501 -16.822 -11.853
    2    HA   LYS  69           HA       LYS  69  -8.456 -15.159 -10.763
    3    HB2  LYS  69           HB2      LYS  69  -8.691 -16.617 -13.393
    4    HB3  LYS  69           HB3      LYS  69  -7.244 -15.738 -12.897
    5    HG2  LYS  69           HG2      LYS  69  -7.092 -17.116 -10.859
    6    HG3  LYS  69           HG3      LYS  69  -8.550 -17.984 -11.332
    7    HD2  LYS  69           HD2      LYS  69  -7.405 -18.753 -13.395
    8    HD3  LYS  69           HD3      LYS  69  -5.936 -17.929 -12.867
    9    HE2  LYS  69           HE2      LYS  69  -7.348 -20.083 -11.267
   10    HE3  LYS  69           HE3      LYS  69  -5.951 -20.372 -12.303
   11    HZ1  LYS  69           HZ1      LYS  69  -5.648 -18.196 -10.423
   12    HZ3  LYS  69           HZ2      LYS  69  -4.564 -19.435 -10.838
   13    HZ2  LYS  69           HZ3      LYS  69  -5.800 -19.726  -9.709

  No H/Q in entry =          13
  In of MODEL   89
    1    H    VAL  70           H        VAL  70  -7.390 -13.327 -11.635
    2    HA   VAL  70           HA       VAL  70  -8.972 -11.684 -13.526
    3    HB   VAL  70           HB       VAL  70  -8.411  -9.713 -12.146
    4   HG12  VAL  70          HG11      VAL  70  -9.947 -10.242 -10.265
    5   HG11  VAL  70          HG12      VAL  70  -9.799 -11.957 -10.650
    6   HG13  VAL  70          HG13      VAL  70 -10.559 -10.858 -11.800
    7   HG22  VAL  70          HG21      VAL  70  -7.457 -10.034  -9.883
    8   HG21  VAL  70          HG22      VAL  70  -6.344 -10.626 -11.114
    9   HG23  VAL  70          HG23      VAL  70  -7.313 -11.766 -10.181

  No H/Q in entry =           9
  In of MODEL   89
    1    H    SER  71           H        SER  71  -7.580  -9.757 -14.249
    2    HA   SER  71           HA       SER  71  -5.295 -10.676 -15.627
    3    HB2  SER  71           HB2      SER  71  -6.666  -8.684 -16.282
    4    HB3  SER  71           HB3      SER  71  -5.989  -7.817 -14.906
    5    HG   SER  71           HG       SER  71  -3.885  -8.536 -15.907

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LEU  72           H        LEU  72  -3.272 -10.959 -14.981
    2    HA   LEU  72           HA       LEU  72  -2.538 -10.738 -12.273
    3    HB2  LEU  72           HB2      LEU  72  -0.895 -11.147 -14.767
    4    HB3  LEU  72           HB3      LEU  72  -0.222 -11.213 -13.141
    5    HG   LEU  72           HG       LEU  72  -2.562 -12.930 -14.028
    6   HD13  LEU  72          HD11      LEU  72  -0.673 -13.559 -15.400
    7   HD12  LEU  72          HD12      LEU  72  -0.824 -14.761 -14.120
    8   HD11  LEU  72          HD13      LEU  72   0.412 -13.509 -14.010
    9   HD23  LEU  72          HD21      LEU  72  -1.549 -14.333 -12.066
   10   HD22  LEU  72          HD22      LEU  72  -2.524 -12.931 -11.655
   11   HD21  LEU  72          HD23      LEU  72  -0.767 -12.826 -11.601

  No H/Q in entry =          11
  In of MODEL   89
    1    H    VAL  73           H        VAL  73  -1.861  -8.713 -15.057
    2    HA   VAL  73           HA       VAL  73   0.048  -6.994 -13.964
    3    HB   VAL  73           HB       VAL  73  -0.369  -5.581 -15.818
    4   HG12  VAL  73          HG11      VAL  73  -1.241  -8.287 -16.827
    5   HG11  VAL  73          HG12      VAL  73   0.391  -8.018 -16.216
    6   HG13  VAL  73          HG13      VAL  73  -0.189  -7.111 -17.612
    7   HG22  VAL  73          HG21      VAL  73  -2.644  -5.076 -15.824
    8   HG21  VAL  73          HG22      VAL  73  -3.121  -6.763 -15.643
    9   HG23  VAL  73          HG23      VAL  73  -2.542  -6.172 -17.201

  No H/Q in entry =           9
  In of MODEL   89
    1    H    LEU  74           H        LEU  74  -3.345  -7.147 -13.386
    2    HA   LEU  74           HA       LEU  74  -3.988  -4.498 -12.768
    3    HB2  LEU  74           HB2      LEU  74  -5.697  -6.188 -12.934
    4    HB3  LEU  74           HB3      LEU  74  -4.991  -7.097 -11.600
    5    HG   LEU  74           HG       LEU  74  -5.474  -5.223 -10.063
    6   HD11  LEU  74          HD11      LEU  74  -6.477  -3.971 -12.620
    7   HD13  LEU  74          HD12      LEU  74  -5.379  -3.286 -11.423
    8   HD12  LEU  74          HD13      LEU  74  -7.095  -3.461 -11.048
    9   HD22  LEU  74          HD21      LEU  74  -7.671  -5.823  -9.804
   10   HD21  LEU  74          HD22      LEU  74  -7.148  -7.061 -10.924
   11   HD23  LEU  74          HD23      LEU  74  -8.025  -5.673 -11.522

  No H/Q in entry =          11
  In of MODEL   89
    1    H    VAL  75           H        VAL  75  -2.907  -7.075 -10.614
    2    HA   VAL  75           HA       VAL  75  -2.711  -5.523  -8.270
    3    HB   VAL  75           HB       VAL  75  -1.205  -8.006  -9.076
    4   HG11  VAL  75          HG11      VAL  75  -1.371  -6.537  -6.407
    5   HG13  VAL  75          HG12      VAL  75   0.074  -6.776  -7.379
    6   HG12  VAL  75          HG13      VAL  75  -0.707  -8.153  -6.618
    7   HG23  VAL  75          HG21      VAL  75  -3.473  -7.599  -7.105
    8   HG22  VAL  75          HG22      VAL  75  -2.851  -9.129  -7.721
    9   HG21  VAL  75          HG23      VAL  75  -3.745  -8.046  -8.789

  No H/Q in entry =           9
  In of MODEL   89
    1    H    GLU  76           H        GLU  76  -0.309  -6.256 -10.821
    2    HA   GLU  76           HA       GLU  76   1.869  -4.886  -9.676
    3    HB2  GLU  76           HB2      GLU  76   2.082  -6.356 -11.659
    4    HB3  GLU  76           HB3      GLU  76   1.145  -5.215 -12.610
    5    HG2  GLU  76           HG2      GLU  76   3.464  -4.832 -13.132
    6    HG3  GLU  76           HG3      GLU  76   2.942  -3.477 -12.148

  No H/Q in entry =           6
  In of MODEL   89
    1    H    ALA  77           H        ALA  77  -0.689  -3.710 -11.849
    2    HA   ALA  77           HA       ALA  77   0.272  -1.053 -12.029
    3    HB1  ALA  77           HB1      ALA  77  -1.396  -1.952 -13.587
    4    HB2  ALA  77           HB2      ALA  77  -2.017  -0.507 -12.790
    5    HB3  ALA  77           HB3      ALA  77  -2.563  -2.101 -12.272

  No H/Q in entry =           5
  In of MODEL   89
    1    H    GLN  78           H        GLN  78  -1.966  -2.635  -9.806
    2    HA   GLN  78           HA       GLN  78  -2.791  -0.326  -8.398
    3    HB2  GLN  78           HB2      GLN  78  -3.871  -2.603  -8.311
    4    HB3  GLN  78           HB3      GLN  78  -2.526  -3.141  -7.308
    5    HG2  GLN  78           HG2      GLN  78  -3.064  -1.407  -5.649
    6    HG3  GLN  78           HG3      GLN  78  -4.409  -0.860  -6.649
    7   HE21  GLN  78          HE21      GLN  78  -6.214  -1.520  -5.401
    8   HE22  GLN  78          HE22      GLN  78  -6.481  -3.122  -4.908

  No H/Q in entry =           8
  In of MODEL   89
    1    H    LEU  79           H        LEU  79  -0.084  -2.552  -7.965
    2    HA   LEU  79           HA       LEU  79   0.896  -1.646  -5.513
    3    HB2  LEU  79           HB2      LEU  79   1.782  -3.644  -6.587
    4    HB3  LEU  79           HB3      LEU  79   2.410  -2.684  -7.923
    5    HG   LEU  79           HG       LEU  79   3.961  -1.528  -6.428
    6   HD13  LEU  79          HD11      LEU  79   2.966  -1.295  -4.355
    7   HD12  LEU  79          HD12      LEU  79   4.062  -2.633  -4.018
    8   HD11  LEU  79          HD13      LEU  79   2.358  -2.952  -4.338
    9   HD23  LEU  79          HD21      LEU  79   5.202  -3.662  -5.533
   10   HD22  LEU  79          HD22      LEU  79   4.986  -3.464  -7.270
   11   HD21  LEU  79          HD23      LEU  79   3.925  -4.547  -6.372

  No H/Q in entry =          11
  In of MODEL   89
    1    H    HIS  80           H        HIS  80   1.734  -0.517  -8.790
    2    HA   HIS  80           HA       HIS  80   3.523   1.492  -7.876
    3    HB2  HIS  80           HB2      HIS  80   2.227   0.783 -10.452
    4    HB3  HIS  80           HB3      HIS  80   2.803   2.442 -10.284
    5    HD1  HIS  80           HD1      HIS  80   5.198   2.772 -10.819
    6    HD2  HIS  80           HD2      HIS  80   4.433  -1.149  -9.626
    7    HE1  HIS  80           HE1      HIS  80   7.402   1.522 -10.999
    8    HE2  HIS  80           HE2      HIS  80   6.947  -0.871 -10.275

  No H/Q in entry =           8
  In of MODEL   89
    1    H    LEU  81           H        LEU  81   0.112   1.611  -8.837
    2    HA   LEU  81           HA       LEU  81  -0.196   4.399  -8.503
    3    HB2  LEU  81           HB2      LEU  81  -2.182   2.129  -8.414
    4    HB3  LEU  81           HB3      LEU  81  -2.655   3.826  -8.318
    5    HG   LEU  81           HG       LEU  81  -0.960   2.699 -10.564
    6   HD12  LEU  81          HD11      LEU  81  -3.203   2.992 -11.851
    7   HD11  LEU  81          HD12      LEU  81  -3.949   2.913 -10.255
    8   HD13  LEU  81          HD13      LEU  81  -2.993   1.557 -10.848
    9   HD23  LEU  81          HD21      LEU  81  -2.090   4.830 -11.654
   10   HD22  LEU  81          HD22      LEU  81  -0.670   5.018 -10.628
   11   HD21  LEU  81          HD23      LEU  81  -2.276   5.346  -9.979

  No H/Q in entry =          11
  In of MODEL   89
    1    H    MET  82           H        MET  82  -0.808   1.703  -6.252
    2    HA   MET  82           HA       MET  82  -1.869   3.274  -4.158
    3    HB2  MET  82           HB2      MET  82  -0.461   0.605  -4.207
    4    HB3  MET  82           HB3      MET  82  -1.041   1.321  -2.705
    5    HG2  MET  82           HG2      MET  82  -2.780   0.807  -5.137
    6    HG3  MET  82           HG3      MET  82  -2.681  -0.267  -3.743
    7    HE3  MET  82           HE1      MET  82  -4.409   1.358  -0.917
    8    HE2  MET  82           HE2      MET  82  -2.684   1.659  -1.112
    9    HE1  MET  82           HE3      MET  82  -3.354   0.093  -1.563

  No H/Q in entry =           9
  In of MODEL   89
    1    H    THR  83           H        THR  83   1.441   2.232  -4.867
    2    HA   THR  83           HA       THR  83   2.657   3.350  -2.572
    3    HB   THR  83           HB       THR  83   4.744   3.323  -4.057
    4    HG1  THR  83           HG1      THR  83   4.501   2.795  -6.080
    5   HG22  THR  83          HG21      THR  83   4.334   0.660  -4.389
    6   HG21  THR  83          HG22      THR  83   3.045   1.021  -3.241
    7   HG23  THR  83          HG23      THR  83   4.722   1.387  -2.831

  No H/Q in entry =           7
  In of MODEL   89
    1    H    SER  84           H        SER  84   2.252   4.627  -5.869
    2    HA   SER  84           HA       SER  84   3.561   7.084  -5.419
    3    HB2  SER  84           HB2      SER  84   1.491   6.226  -7.427
    4    HB3  SER  84           HB3      SER  84   2.148   7.862  -7.405
    5    HG   SER  84           HG       SER  84   3.551   5.406  -7.706

  No H/Q in entry =           5
  In of MODEL   89
    1    H    MET  85           H        MET  85   0.079   6.282  -5.229
    2    HA   MET  85           HA       MET  85  -0.813   8.880  -4.620
    3    HB2  MET  85           HB2      MET  85  -2.317   7.054  -5.283
    4    HB3  MET  85           HB3      MET  85  -2.008   6.248  -3.746
    5    HG2  MET  85           HG2      MET  85  -2.918   8.188  -2.531
    6    HG3  MET  85           HG3      MET  85  -3.200   9.018  -4.059
    7    HE2  MET  85           HE1      MET  85  -6.426   7.891  -5.321
    8    HE1  MET  85           HE2      MET  85  -4.806   8.289  -5.886
    9    HE3  MET  85           HE3      MET  85  -5.568   9.283  -4.648

  No H/Q in entry =           9
  In of MODEL   89
    1    H    LEU  86           H        LEU  86   0.152   6.228  -2.484
    2    HA   LEU  86           HA       LEU  86  -0.384   7.522  -0.038
    3    HB2  LEU  86           HB2      LEU  86   0.109   5.057  -0.437
    4    HB3  LEU  86           HB3      LEU  86   1.810   5.508  -0.541
    5    HG   LEU  86           HG       LEU  86   1.483   6.663   1.730
    6   HD11  LEU  86          HD11      LEU  86  -1.204   5.864   1.273
    7   HD13  LEU  86          HD12      LEU  86  -0.539   6.618   2.721
    8   HD12  LEU  86          HD13      LEU  86  -0.609   4.861   2.600
    9   HD23  LEU  86          HD21      LEU  86   1.092   3.665   1.851
   10   HD22  LEU  86          HD22      LEU  86   2.088   4.686   2.887
   11   HD21  LEU  86          HD23      LEU  86   2.584   4.369   1.225

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ALA  87           H        ALA  87   2.590   7.266  -1.944
    2    HA   ALA  87           HA       ALA  87   4.288   8.694  -0.227
    3    HB3  ALA  87           HB1      ALA  87   4.380   7.686  -2.936
    4    HB2  ALA  87           HB2      ALA  87   5.717   8.031  -1.843
    5    HB1  ALA  87           HB3      ALA  87   5.081   9.305  -2.882

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ARG  88           H        ARG  88   2.312   9.810  -2.936
    2    HA   ARG  88           HA       ARG  88   3.056  12.509  -2.820
    3    HB2  ARG  88           HB2      ARG  88   1.805  11.344  -4.671
    4    HB3  ARG  88           HB3      ARG  88   0.352  11.469  -3.680
    5    HG2  ARG  88           HG2      ARG  88   1.342  14.061  -3.599
    6    HG3  ARG  88           HG3      ARG  88   1.763  13.554  -5.233
    7    HD2  ARG  88           HD2      ARG  88  -0.383  13.610  -5.918
    8    HD3  ARG  88           HD3      ARG  88  -0.952  12.749  -4.488
    9    HE   ARG  88           HE       ARG  88  -1.175  15.525  -4.901
   10   HH21  ARG  88          HH11      ARG  88  -1.707  16.847  -3.158
   11   HH22  ARG  88          HH12      ARG  88  -1.395  16.311  -1.543
   12   HH11  ARG  88          HH21      ARG  88  -0.121  13.271  -2.535
   13   HH12  ARG  88          HH22      ARG  88  -0.515  14.280  -1.191

  No H/Q in entry =          13
  In of MODEL   89
    1    H    GLU  89           H        GLU  89   0.381  10.803  -1.166
    2    HA   GLU  89           HA       GLU  89  -0.744  13.101   0.048
    3    HB2  GLU  89           HB2      GLU  89  -1.839  10.850  -0.035
    4    HB3  GLU  89           HB3      GLU  89  -0.702  10.305   1.198
    5    HG2  GLU  89           HG2      GLU  89  -1.531  11.993   2.765
    6    HG3  GLU  89           HG3      GLU  89  -2.597  12.654   1.528

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LEU  90           H        LEU  90   1.738  10.833   1.205
    2    HA   LEU  90           HA       LEU  90   2.096  12.078   3.734
    3    HB2  LEU  90           HB2      LEU  90   3.877  10.324   2.044
    4    HB3  LEU  90           HB3      LEU  90   4.301  10.843   3.681
    5    HG   LEU  90           HG       LEU  90   1.676   9.471   3.033
    6   HD12  LEU  90          HD11      LEU  90   2.843   7.436   4.032
    7   HD11  LEU  90          HD12      LEU  90   4.355   8.308   3.782
    8   HD13  LEU  90          HD13      LEU  90   3.339   7.892   2.401
    9   HD22  LEU  90          HD21      LEU  90   1.415  10.389   5.158
   10   HD21  LEU  90          HD22      LEU  90   3.136  10.299   5.530
   11   HD23  LEU  90          HD23      LEU  90   2.144   8.842   5.582

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  91           H        ILE  91   3.677  12.481   0.598
    2    HA   ILE  91           HA       ILE  91   5.640  14.331   1.428
    3    HB   ILE  91           HB       ILE  91   4.317  13.831  -1.244
    4   HG12  ILE  91          HG12      ILE  91   7.160  13.370  -0.288
    5   HG13  ILE  91          HG13      ILE  91   5.891  12.160  -0.120
    6   HG22  ILE  91          HG21      ILE  91   6.523  15.200  -1.944
    7   HG21  ILE  91          HG22      ILE  91   6.214  15.996  -0.400
    8   HG23  ILE  91          HG23      ILE  91   4.984  16.014  -1.662
    9   HD13  ILE  91          HD11      ILE  91   5.708  11.838  -2.426
   10   HD12  ILE  91          HD12      ILE  91   7.441  12.097  -2.222
   11   HD11  ILE  91          HD13      ILE  91   6.414  13.411  -2.801

  No H/Q in entry =          11
  In of MODEL   89
    1    H    THR  92           H        THR  92   2.268  14.732   0.441
    2    HA   THR  92           HA       THR  92   2.215  17.555   0.385
    3    HB   THR  92           HB       THR  92   0.070  15.539   1.094
    4    HG1  THR  92           HG1      THR  92   0.364  15.366  -0.993
    5   HG22  THR  92          HG21      THR  92  -1.355  17.688   0.384
    6   HG21  THR  92          HG22      THR  92   0.033  18.526   1.074
    7   HG23  THR  92          HG23      THR  92  -0.891  17.394   2.059

  No H/Q in entry =           7
  In of MODEL   89
    1    H    GLU  93           H        GLU  93   1.704  15.246   3.039
    2    HA   GLU  93           HA       GLU  93   1.166  17.142   5.063
    3    HB2  GLU  93           HB2      GLU  93   2.506  14.429   5.287
    4    HB3  GLU  93           HB3      GLU  93   1.815  15.348   6.626
    5    HG2  GLU  93           HG2      GLU  93   0.195  14.558   4.195
    6    HG3  GLU  93           HG3      GLU  93   0.315  13.534   5.621

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LEU  94           H        LEU  94   4.180  15.690   3.893
    2    HA   LEU  94           HA       LEU  94   5.930  16.851   5.772
    3    HB2  LEU  94           HB2      LEU  94   6.324  15.891   2.938
    4    HB3  LEU  94           HB3      LEU  94   7.653  16.560   3.880
    5    HG   LEU  94           HG       LEU  94   5.941  14.347   5.023
    6   HD11  LEU  94          HD11      LEU  94   8.026  14.143   2.878
    7   HD13  LEU  94          HD12      LEU  94   6.590  13.155   3.147
    8   HD12  LEU  94          HD13      LEU  94   8.024  12.914   4.145
    9   HD23  LEU  94          HD21      LEU  94   8.142  13.829   6.161
   10   HD22  LEU  94          HD22      LEU  94   7.463  15.400   6.584
   11   HD21  LEU  94          HD23      LEU  94   8.796  15.294   5.433

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  95           H        ILE  95   4.761  18.016   2.631
    2    HA   ILE  95           HA       ILE  95   6.311  20.388   2.566
    3    HB   ILE  95           HB       ILE  95   3.666  19.682   1.275
    4   HG12  ILE  95          HG12      ILE  95   6.444  20.046   0.122
    5   HG13  ILE  95          HG13      ILE  95   5.813  18.487   0.638
    6   HG21  ILE  95          HG21      ILE  95   5.391  22.165   1.048
    7   HG23  ILE  95          HG22      ILE  95   3.669  22.081   1.414
    8   HG22  ILE  95          HG23      ILE  95   4.246  21.688  -0.206
    9   HD13  ILE  95          HD11      ILE  95   4.244  18.399  -1.082
   10   HD12  ILE  95          HD12      ILE  95   5.580  19.230  -1.876
   11   HD11  ILE  95          HD13      ILE  95   4.202  20.151  -1.274

  No H/Q in entry =          11
  In of MODEL   89
    1    H    GLU  96           H        GLU  96   3.076  19.704   3.879
    2    HA   GLU  96           HA       GLU  96   2.436  22.344   4.638
    3    HB2  GLU  96           HB2      GLU  96   0.778  20.546   4.657
    4    HB3  GLU  96           HB3      GLU  96   1.655  19.725   5.946
    5    HG2  GLU  96           HG2      GLU  96   0.632  20.996   7.523
    6    HG3  GLU  96           HG3      GLU  96   1.149  22.476   6.726

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LEU  97           H        LEU  97   4.312  19.808   6.249
    2    HA   LEU  97           HA       LEU  97   4.672  21.156   8.719
    3    HB2  LEU  97           HB2      LEU  97   6.220  19.003   7.293
    4    HB3  LEU  97           HB3      LEU  97   6.813  19.692   8.802
    5    HG   LEU  97           HG       LEU  97   4.011  18.573   8.506
    6   HD12  LEU  97          HD11      LEU  97   4.976  16.568   9.711
    7   HD11  LEU  97          HD12      LEU  97   6.580  17.213   9.358
    8   HD13  LEU  97          HD13      LEU  97   5.506  16.748   8.038
    9   HD23  LEU  97          HD21      LEU  97   4.482  18.279  11.068
   10   HD22  LEU  97          HD22      LEU  97   4.084  19.888  10.468
   11   HD21  LEU  97          HD23      LEU  97   5.761  19.463  10.802

  No H/Q in entry =          11
  In of MODEL   89
    1    H    HIS  98           H        HIS  98   6.524  21.193   5.683
    2    HA   HIS  98           HA       HIS  98   8.669  22.790   6.571
    3    HB2  HIS  98           HB2      HIS  98   7.362  22.528   3.853
    4    HB3  HIS  98           HB3      HIS  98   8.795  23.519   4.136
    5    HD1  HIS  98           HD1      HIS  98   7.615  19.938   4.158
    6    HD2  HIS  98           HD2      HIS  98  11.180  22.064   4.565
    7    HE1  HIS  98           HE1      HIS  98   9.484  18.224   4.087
    8    HE2  HIS  98           HE2      HIS  98  11.660  19.499   4.335

  No H/Q in entry =           8
  In of MODEL   89
    1    H    GLU  99           H        GLU  99   5.434  23.599   5.416
    2    HA   GLU  99           HA       GLU  99   5.789  26.417   5.360
    3    HB2  GLU  99           HB2      GLU  99   3.913  25.234   4.239
    4    HB3  GLU  99           HB3      GLU  99   3.229  24.864   5.822
    5    HG2  GLU  99           HG2      GLU  99   3.032  27.254   6.327
    6    HG3  GLU  99           HG3      GLU  99   3.795  27.662   4.794

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LYS 100           H        LYS 100   4.692  24.169   7.885
    2    HA   LYS 100           HA       LYS 100   4.099  26.215   9.786
    3    HB2  LYS 100           HB2      LYS 100   4.701  23.268  10.124
    4    HB3  LYS 100           HB3      LYS 100   4.253  24.335  11.460
    5    HG2  LYS 100           HG2      LYS 100   2.174  24.957  10.225
    6    HG3  LYS 100           HG3      LYS 100   2.604  23.794   8.969
    7    HD2  LYS 100           HD2      LYS 100   2.551  21.970  10.628
    8    HD3  LYS 100           HD3      LYS 100   2.139  23.127  11.895
    9    HE2  LYS 100           HE2      LYS 100   0.073  23.734  10.645
   10    HE3  LYS 100           HE3      LYS 100   0.476  22.519   9.425
   11    HZ1  LYS 100           HZ1      LYS 100   0.233  21.846  12.307
   12    HZ3  LYS 100           HZ2      LYS 100   0.218  20.793  10.970
   13    HZ2  LYS 100           HZ3      LYS 100  -1.104  21.821  11.260

  No H/Q in entry =          13
  In of MODEL   89
    1    H    LEU 101           H        LEU 101   7.032  24.445   8.932
    2    HA   LEU 101           HA       LEU 101   8.637  25.295  11.128
    3    HB2  LEU 101           HB2      LEU 101   9.223  24.317   8.345
    4    HB3  LEU 101           HB3      LEU 101  10.525  24.992   9.319
    5    HG   LEU 101           HG       LEU 101   8.718  22.819  10.390
    6   HD12  LEU 101          HD11      LEU 101  10.780  21.341   9.768
    7   HD11  LEU 101          HD12      LEU 101  11.130  22.609   8.595
    8   HD13  LEU 101          HD13      LEU 101   9.607  21.724   8.509
    9   HD21  LEU 101          HD21      LEU 101  11.437  23.948  11.104
   10   HD23  LEU 101          HD22      LEU 101  10.910  22.370  11.684
   11   HD22  LEU 101          HD23      LEU 101  10.008  23.818  12.130

  No H/Q in entry =          11
  In of MODEL   89
    1    H    LYS 102           H        LYS 102   7.026  27.149   8.999
    2    HA   LYS 102           HA       LYS 102   7.084  29.443   8.710
    3    HB2  LYS 102           HB2      LYS 102   8.661  29.337  10.799
    4    HB3  LYS 102           HB3      LYS 102   9.953  29.543   9.632
    5    HG2  LYS 102           HG2      LYS 102   7.837  31.478  10.510
    6    HG3  LYS 102           HG3      LYS 102   9.546  31.752  10.249
    7    HD2  LYS 102           HD2      LYS 102   7.584  31.317   7.959
    8    HD3  LYS 102           HD3      LYS 102   7.959  32.899   8.628
    9    HE2  LYS 102           HE2      LYS 102   9.329  31.728   6.545
   10    HE3  LYS 102           HE3      LYS 102   9.941  33.038   7.554
   11    HZ2  LYS 102           HZ1      LYS 102  11.475  31.146   7.367
   12    HZ1  LYS 102           HZ2      LYS 102  10.325  30.153   8.115
   13    HZ3  LYS 102           HZ3      LYS 102  11.013  31.444   8.972

  No H/Q in entry =          13
  In of MODEL   89
    1    H    ALA 103           H        ALA 103  10.348  28.130   8.125
    2    HA   ALA 103           HA       ALA 103  11.289  29.517   6.045
    3    HB2  ALA 103           HB1      ALA 103  12.186  27.312   5.109
    4    HB1  ALA 103           HB2      ALA 103  11.304  26.528   6.419
    5    HB3  ALA 103           HB3      ALA 103  12.587  27.682   6.786

  No H/Q in entry =           5
  In of MODEL   89
    1    H1   LYS   3           H1       LYS   3 -30.852   6.048 -19.988
    2    H2   LYS   3           H3       LYS   3 -29.857   5.711 -21.321
    3    H3   LYS   3           H2       LYS   3 -31.269   4.805 -21.065
    4    HA   LYS   3           HA       LYS   3 -30.304   3.433 -19.620
    5    HB2  LYS   3           HB2      LYS   3 -27.987   4.775 -20.963
    6    HB3  LYS   3           HB3      LYS   3 -27.693   3.591 -19.689
    7    HG2  LYS   3           HG2      LYS   3 -29.130   1.997 -21.014
    8    HG3  LYS   3           HG3      LYS   3 -29.052   3.165 -22.333
    9    HD2  LYS   3           HD2      LYS   3 -26.572   3.011 -22.255
   10    HD3  LYS   3           HD3      LYS   3 -26.724   1.743 -21.040
   11    HE2  LYS   3           HE2      LYS   3 -28.226   0.553 -22.742
   12    HE3  LYS   3           HE3      LYS   3 -27.576   1.692 -23.919
   13    HZ3  LYS   3           HZ1      LYS   3 -25.797   0.428 -24.143
   14    HZ2  LYS   3           HZ2      LYS   3 -26.456  -0.704 -23.061
   15    HZ1  LYS   3           HZ3      LYS   3 -25.451   0.537 -22.484

  No H/Q in entry =          15
  In of MODEL   89
    1    H    LYS   4           H        LYS   4 -30.378   3.341 -17.556
    2    HA   LYS   4           HA       LYS   4 -29.622   5.653 -15.953
    3    HB2  LYS   4           HB2      LYS   4 -30.878   3.000 -15.201
    4    HB3  LYS   4           HB3      LYS   4 -30.642   4.360 -14.106
    5    HG2  LYS   4           HG2      LYS   4 -32.429   4.272 -16.542
    6    HG3  LYS   4           HG3      LYS   4 -32.935   4.372 -14.856
    7    HD2  LYS   4           HD2      LYS   4 -32.201   6.587 -14.636
    8    HD3  LYS   4           HD3      LYS   4 -31.149   6.476 -16.048
    9    HE2  LYS   4           HE2      LYS   4 -33.046   7.873 -16.561
   10    HE3  LYS   4           HE3      LYS   4 -33.143   6.379 -17.494
   11    HZ3  LYS   4           HZ1      LYS   4 -34.750   5.533 -15.941
   12    HZ2  LYS   4           HZ2      LYS   4 -35.273   7.024 -16.566
   13    HZ1  LYS   4           HZ3      LYS   4 -34.633   6.938 -14.995

  No H/Q in entry =          13
  In of MODEL   89
    1    H    HIS   5           H        HIS   5 -28.167   5.750 -14.350
    2    HA   HIS   5           HA       HIS   5 -25.916   3.870 -14.617
    3    HB2  HIS   5           HB2      HIS   5 -26.130   6.657 -13.478
    4    HB3  HIS   5           HB3      HIS   5 -24.666   5.676 -13.425
    5    HD1  HIS   5           HD1      HIS   5 -23.160   6.809 -15.029
    6    HD2  HIS   5           HD2      HIS   5 -26.957   6.224 -16.603
    7    HE1  HIS   5           HE1      HIS   5 -22.959   7.328 -17.489
    8    HE2  HIS   5           HE2      HIS   5 -25.274   6.960 -18.419

  No H/Q in entry =           8
  In of MODEL   89
    1    H    ILE   6           H        ILE   6 -25.729   2.326 -13.261
    2    HA   ILE   6           HA       ILE   6 -26.725   2.678 -10.514
    3    HB   ILE   6           HB       ILE   6 -25.935   0.161 -11.984
    4   HG12  ILE   6          HG12      ILE   6 -28.667   1.170 -11.181
    5   HG13  ILE   6          HG13      ILE   6 -28.006   1.281 -12.813
    6   HG23  ILE   6          HG21      ILE   6 -26.349  -1.040 -10.098
    7   HG22  ILE   6          HG22      ILE   6 -27.490   0.145  -9.457
    8   HG21  ILE   6          HG23      ILE   6 -25.756   0.449  -9.360
    9   HD13  ILE   6          HD11      ILE   6 -28.504  -0.841 -13.267
   10   HD12  ILE   6          HD12      ILE   6 -29.531  -0.769 -11.835
   11   HD11  ILE   6          HD13      ILE   6 -27.890  -1.407 -11.713

  No H/Q in entry =          11
  In of MODEL   89
    1    H    TYR   7           H        TYR   7 -24.965   3.315  -9.225
    2    HA   TYR   7           HA       TYR   7 -22.267   2.288  -9.856
    3    HB2  TYR   7           HB2      TYR   7 -23.195   4.776  -8.443
    4    HB3  TYR   7           HB3      TYR   7 -21.522   4.227  -8.453
    5    HD1  TYR   7           HD1      TYR   7 -22.552   3.231 -11.530
    6    HD2  TYR   7           HD2      TYR   7 -21.830   6.842  -9.382
    7    HE1  TYR   7           HE1      TYR   7 -22.076   4.402 -13.645
    8    HE2  TYR   7           HE2      TYR   7 -21.396   8.019 -11.490
    9    HH   TYR   7           HH       TYR   7 -21.596   7.883 -13.722

  No H/Q in entry =           9
  In of MODEL   89
    1    H    LEU   8           H        LEU   8 -21.342   0.950  -8.487
    2    HA   LEU   8           HA       LEU   8 -22.506   0.542  -5.803
    3    HB2  LEU   8           HB2      LEU   8 -20.821  -1.199  -7.580
    4    HB3  LEU   8           HB3      LEU   8 -21.030  -1.536  -5.862
    5    HG   LEU   8           HG       LEU   8 -23.510  -1.668  -6.304
    6   HD13  LEU   8          HD11      LEU   8 -23.596  -0.500  -8.443
    7   HD12  LEU   8          HD12      LEU   8 -24.157  -2.159  -8.649
    8   HD11  LEU   8          HD13      LEU   8 -22.535  -1.706  -9.170
    9   HD23  LEU   8          HD21      LEU   8 -22.262  -3.774  -7.937
   10   HD22  LEU   8          HD22      LEU   8 -23.364  -3.887  -6.566
   11   HD21  LEU   8          HD23      LEU   8 -21.653  -3.562  -6.296

  No H/Q in entry =          11
  In of MODEL   89
    1    H    PHE   9           H        PHE   9 -21.239   0.964  -4.006
    2    HA   PHE   9           HA       PHE   9 -18.436   1.835  -4.536
    3    HB2  PHE   9           HB2      PHE   9 -20.450   2.988  -2.611
    4    HB3  PHE   9           HB3      PHE   9 -18.733   3.364  -2.568
    5    HD1  PHE   9           HD1      PHE   9 -17.669   4.623  -4.371
    6    HD2  PHE   9           HD2      PHE   9 -21.881   3.810  -4.418
    7    HE1  PHE   9           HE1      PHE   9 -17.973   6.297  -6.172
    8    HE2  PHE   9           HE2      PHE   9 -22.186   5.496  -6.214
    9    HZ   PHE   9           HZ       PHE   9 -20.229   6.734  -7.096

  No H/Q in entry =           9
  In of MODEL   89
    1    H    SER  10           H        SER  10 -16.863   0.875  -3.403
    2    HA   SER  10           HA       SER  10 -17.088   0.054  -0.690
    3    HB2  SER  10           HB2      SER  10 -17.099  -2.291  -0.873
    4    HB3  SER  10           HB3      SER  10 -18.332  -1.772  -2.012
    5    HG   SER  10           HG       SER  10 -15.800  -1.853  -3.048

  No H/Q in entry =           5
  In of MODEL   89
    1    H    SER  11           H        SER  11 -15.068   0.187   0.136
    2    HA   SER  11           HA       SER  11 -12.869   0.934  -1.429
    3    HB2  SER  11           HB2      SER  11 -11.555   0.668   0.612
    4    HB3  SER  11           HB3      SER  11 -13.095   1.463   0.949
    5    HG   SER  11           HG       SER  11 -12.180  -1.083   1.631

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ALA  12           H        ALA  12 -14.109  -1.738  -2.154
    2    HA   ALA  12           HA       ALA  12 -11.566  -3.073  -2.627
    3    HB1  ALA  12           HB1      ALA  12 -13.806  -4.736  -1.494
    4    HB3  ALA  12           HB2      ALA  12 -12.596  -3.992  -0.451
    5    HB2  ALA  12           HB3      ALA  12 -12.102  -5.157  -1.679

  No H/Q in entry =           5
  In of MODEL   89
    1    H    GLY  13           H        GLY  13 -12.363  -2.060  -4.673
    2    HA3  GLY  13           HA2      GLY  13 -14.595  -2.779  -6.131
    3    HA2  GLY  13           HA3      GLY  13 -13.039  -2.363  -6.865

  No H/Q in entry =           3
  In of MODEL   89
    1    H    MET  14           H        MET  14 -11.568  -4.646  -5.852
    2    HA   MET  14           HA       MET  14 -11.963  -6.435  -7.937
    3    HB2  MET  14           HB2      MET  14  -9.905  -6.496  -6.620
    4    HB3  MET  14           HB3      MET  14 -10.777  -7.137  -5.228
    5    HG2  MET  14           HG2      MET  14 -11.372  -9.150  -6.551
    6    HG3  MET  14           HG3      MET  14 -10.478  -8.502  -7.927
    7    HE2  MET  14           HE1      MET  14  -7.723  -7.240  -6.631
    8    HE1  MET  14           HE2      MET  14  -8.268  -8.019  -8.116
    9    HE3  MET  14           HE3      MET  14  -6.913  -8.700  -7.219

  No H/Q in entry =           9
  In of MODEL   89
    1    H    SER  15           H        SER  15 -13.204  -6.867  -4.613
    2    HA   SER  15           HA       SER  15 -14.571  -9.305  -5.330
    3    HB2  SER  15           HB2      SER  15 -14.107  -9.166  -3.010
    4    HB3  SER  15           HB3      SER  15 -14.753  -7.531  -2.899
    5    HG   SER  15           HG       SER  15 -16.820  -8.516  -3.526

  No H/Q in entry =           5
  In of MODEL   89
    1    H    THR  16           H        THR  16 -15.607  -5.912  -4.936
    2    HA   THR  16           HA       THR  16 -18.404  -6.358  -5.456
    3    HB   THR  16           HB       THR  16 -16.789  -3.848  -6.024
    4    HG1  THR  16           HG1      THR  16 -16.470  -4.676  -3.885
    5   HG22  THR  16          HG21      THR  16 -18.979  -2.779  -5.414
    6   HG21  THR  16          HG22      THR  16 -19.700  -4.396  -5.374
    7   HG23  THR  16          HG23      THR  16 -19.043  -3.746  -6.882

  No H/Q in entry =           7
  In of MODEL   89
    1    H    SER  17           H        SER  17 -15.576  -5.893  -7.314
    2    HA   SER  17           HA       SER  17 -16.662  -5.192  -9.844
    3    HB2  SER  17           HB2      SER  17 -14.066  -6.534  -9.070
    4    HB3  SER  17           HB3      SER  17 -14.481  -6.157 -10.742
    5    HG   SER  17           HG       SER  17 -13.289  -4.474  -9.896

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LEU  18           H        LEU  18 -16.170  -8.311  -8.314
    2    HA   LEU  18           HA       LEU  18 -16.762  -9.857 -10.639
    3    HB2  LEU  18           HB2      LEU  18 -15.581 -10.807  -8.715
    4    HB3  LEU  18           HB3      LEU  18 -16.999 -10.538  -7.703
    5    HG   LEU  18           HG       LEU  18 -18.278 -12.068  -9.226
    6   HD13  LEU  18          HD11      LEU  18 -17.035 -12.046 -11.235
    7   HD12  LEU  18          HD12      LEU  18 -16.725 -13.638 -10.544
    8   HD11  LEU  18          HD13      LEU  18 -15.518 -12.362 -10.397
    9   HD21  LEU  18          HD21      LEU  18 -15.927 -13.006  -7.638
   10   HD23  LEU  18          HD22      LEU  18 -17.066 -14.133  -8.381
   11   HD22  LEU  18          HD23      LEU  18 -17.633 -12.964  -7.189

  No H/Q in entry =          11
  In of MODEL   89
    1    H    LEU  19           H        LEU  19 -18.734  -8.545  -7.979
    2    HA   LEU  19           HA       LEU  19 -21.212  -9.701  -8.808
    3    HB2  LEU  19           HB2      LEU  19 -20.930  -8.810  -6.572
    4    HB3  LEU  19           HB3      LEU  19 -20.643  -7.199  -7.227
    5    HG   LEU  19           HG       LEU  19 -22.951  -6.996  -7.885
    6   HD12  LEU  19          HD11      LEU  19 -24.525  -8.868  -7.053
    7   HD11  LEU  19          HD12      LEU  19 -23.082  -9.881  -7.058
    8   HD13  LEU  19          HD13      LEU  19 -23.638  -9.134  -8.555
    9   HD21  LEU  19          HD21      LEU  19 -22.457  -7.922  -5.073
   10   HD23  LEU  19          HD22      LEU  19 -24.000  -7.244  -5.595
   11   HD22  LEU  19          HD23      LEU  19 -22.531  -6.271  -5.692

  No H/Q in entry =          11
  In of MODEL   89
    1    H    VAL  20           H        VAL  20 -19.648  -6.588  -9.564
    2    HA   VAL  20           HA       VAL  20 -21.723  -5.545 -11.179
    3    HB   VAL  20           HB       VAL  20 -18.722  -5.016 -11.322
    4   HG12  VAL  20          HG11      VAL  20 -19.416  -2.925 -12.553
    5   HG11  VAL  20          HG12      VAL  20 -21.023  -3.633 -12.719
    6   HG13  VAL  20          HG13      VAL  20 -19.632  -4.416 -13.469
    7   HG21  VAL  20          HG21      VAL  20 -21.008  -3.729  -9.896
    8   HG23  VAL  20          HG22      VAL  20 -19.584  -2.789 -10.334
    9   HG22  VAL  20          HG23      VAL  20 -19.423  -4.194  -9.280

  No H/Q in entry =           9
  In of MODEL   89
    1    H    SER  21           H        SER  21 -18.995  -7.671 -12.128
    2    HA   SER  21           HA       SER  21 -19.749  -7.612 -14.888
    3    HB2  SER  21           HB2      SER  21 -18.348  -9.613 -15.159
    4    HB3  SER  21           HB3      SER  21 -17.505  -8.361 -14.250
    5    HG   SER  21           HG       SER  21 -17.791 -10.800 -13.543

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LYS  22           H        LYS  22 -20.883  -9.714 -12.276
    2    HA   LYS  22           HA       LYS  22 -22.434 -11.347 -14.075
    3    HB2  LYS  22           HB2      LYS  22 -22.718 -10.917 -11.098
    4    HB3  LYS  22           HB3      LYS  22 -23.586 -12.130 -12.038
    5    HG2  LYS  22           HG2      LYS  22 -20.588 -12.035 -11.749
    6    HG3  LYS  22           HG3      LYS  22 -21.655 -13.025 -10.754
    7    HD2  LYS  22           HD2      LYS  22 -22.445 -14.177 -12.792
    8    HD3  LYS  22           HD3      LYS  22 -21.307 -13.226 -13.747
    9    HE2  LYS  22           HE2      LYS  22 -19.433 -14.210 -12.496
   10    HE3  LYS  22           HE3      LYS  22 -20.568 -15.159 -11.536
   11    HZ2  LYS  22           HZ1      LYS  22 -19.472 -15.705 -14.099
   12    HZ1  LYS  22           HZ2      LYS  22 -21.170 -15.744 -14.142
   13    HZ3  LYS  22           HZ3      LYS  22 -20.327 -16.730 -13.047

  No H/Q in entry =          13
  In of MODEL   89
    1    H    MET  23           H        MET  23 -23.118  -8.367 -12.286
    2    HA   MET  23           HA       MET  23 -25.921  -8.401 -12.820
    3    HB2  MET  23           HB2      MET  23 -24.033  -6.118 -12.283
    4    HB3  MET  23           HB3      MET  23 -25.773  -5.917 -12.483
    5    HG2  MET  23           HG2      MET  23 -26.211  -7.165 -10.487
    6    HG3  MET  23           HG3      MET  23 -24.511  -7.608 -10.333
    7    HE2  MET  23           HE1      MET  23 -26.745  -3.883  -9.257
    8    HE1  MET  23           HE2      MET  23 -27.005  -4.881 -10.686
    9    HE3  MET  23           HE3      MET  23 -25.940  -3.477 -10.773

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ARG  24           H        ARG  24 -23.120  -7.073 -14.607
    2    HA   ARG  24           HA       ARG  24 -24.569  -5.791 -16.653
    3    HB2  ARG  24           HB2      ARG  24 -22.120  -5.440 -16.248
    4    HB3  ARG  24           HB3      ARG  24 -21.815  -7.052 -16.845
    5    HG2  ARG  24           HG2      ARG  24 -22.608  -6.420 -19.105
    6    HG3  ARG  24           HG3      ARG  24 -23.003  -4.790 -18.498
    7    HD2  ARG  24           HD2      ARG  24 -20.800  -4.693 -19.539
    8    HD3  ARG  24           HD3      ARG  24 -20.615  -4.558 -17.794
    9    HE   ARG  24           HE       ARG  24 -19.357  -6.371 -17.707
   10   HH21  ARG  24          HH11      ARG  24 -17.742  -7.303 -18.963
   11   HH22  ARG  24          HH12      ARG  24 -18.150  -8.051 -20.467
   12   HH11  ARG  24          HH21      ARG  24 -21.442  -6.758 -20.345
   13   HH12  ARG  24          HH22      ARG  24 -20.344  -7.733 -21.270

  No H/Q in entry =          13
  In of MODEL   89
    1    H    ALA  25           H        ALA  25 -23.523  -9.143 -16.286
    2    HA   ALA  25           HA       ALA  25 -24.141 -10.024 -18.909
    3    HB1  ALA  25           HB1      ALA  25 -23.497 -12.053 -18.159
    4    HB3  ALA  25           HB2      ALA  25 -24.568 -11.976 -16.760
    5    HB2  ALA  25           HB3      ALA  25 -22.997 -11.182 -16.710

  No H/Q in entry =           5
  In of MODEL   89
    1    H    GLN  26           H        GLN  26 -25.999  -9.952 -15.906
    2    HA   GLN  26           HA       GLN  26 -28.358 -11.126 -16.920
    3    HB2  GLN  26           HB2      GLN  26 -27.833  -9.335 -14.569
    4    HB3  GLN  26           HB3      GLN  26 -29.407 -10.032 -14.920
    5    HG2  GLN  26           HG2      GLN  26 -26.859 -11.534 -14.389
    6    HG3  GLN  26           HG3      GLN  26 -28.229 -11.375 -13.297
    7   HE21  GLN  26          HE21      GLN  26 -27.047 -13.595 -14.509
    8   HE22  GLN  26          HE22      GLN  26 -28.104 -14.638 -15.293

  No H/Q in entry =           8
  In of MODEL   89
    1    H    ALA  27           H        ALA  27 -27.353  -7.742 -16.597
    2    HA   ALA  27           HA       ALA  27 -29.810  -6.613 -17.433
    3    HB1  ALA  27           HB1      ALA  27 -27.983  -5.312 -16.328
    4    HB3  ALA  27           HB2      ALA  27 -28.540  -4.568 -17.828
    5    HB2  ALA  27           HB3      ALA  27 -27.025  -5.469 -17.802

  No H/Q in entry =           5
  In of MODEL   89
    1    H    GLU  28           H        GLU  28 -27.117  -7.938 -19.244
    2    HA   GLU  28           HA       GLU  28 -28.002  -6.935 -21.797
    3    HB2  GLU  28           HB2      GLU  28 -25.646  -7.657 -21.131
    4    HB3  GLU  28           HB3      GLU  28 -26.226  -9.312 -21.301
    5    HG2  GLU  28           HG2      GLU  28 -25.042  -8.607 -23.273
    6    HG3  GLU  28           HG3      GLU  28 -26.742  -8.900 -23.633

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LYS  29           H        LYS  29 -28.255  -9.999 -20.073
    2    HA   LYS  29           HA       LYS  29 -29.569 -11.485 -22.058
    3    HB2  LYS  29           HB2      LYS  29 -28.564 -12.445 -20.021
    4    HB3  LYS  29           HB3      LYS  29 -29.829 -11.689 -19.056
    5    HG2  LYS  29           HG2      LYS  29 -31.509 -13.047 -20.111
    6    HG3  LYS  29           HG3      LYS  29 -30.313 -13.734 -21.208
    7    HD2  LYS  29           HD2      LYS  29 -29.215 -14.887 -19.436
    8    HD3  LYS  29           HD3      LYS  29 -30.117 -13.998 -18.210
    9    HE2  LYS  29           HE2      LYS  29 -30.917 -16.337 -18.528
   10    HE3  LYS  29           HE3      LYS  29 -32.165 -15.122 -18.812
   11    HZ1  LYS  29           HZ1      LYS  29 -31.578 -15.322 -21.229
   12    HZ3  LYS  29           HZ2      LYS  29 -32.336 -16.678 -20.542
   13    HZ2  LYS  29           HZ3      LYS  29 -30.663 -16.693 -20.822

  No H/Q in entry =          13
  In of MODEL   89
    1    H    TYR  30           H        TYR  30 -30.941  -9.293 -19.617
    2    HA   TYR  30           HA       TYR  30 -33.599  -9.711 -20.877
    3    HB2  TYR  30           HB2      TYR  30 -32.949  -8.512 -18.175
    4    HB3  TYR  30           HB3      TYR  30 -34.565  -8.747 -18.841
    5    HD1  TYR  30           HD1      TYR  30 -35.524 -11.023 -19.013
    6    HD2  TYR  30           HD2      TYR  30 -31.693 -10.348 -17.284
    7    HE1  TYR  30           HE1      TYR  30 -35.495 -13.335 -18.165
    8    HE2  TYR  30           HE2      TYR  30 -31.664 -12.645 -16.439
    9    HH   TYR  30           HH       TYR  30 -33.344 -14.992 -17.498

  No H/Q in entry =           9
  In of MODEL   89
    1    H    GLU  31           H        GLU  31 -31.381  -7.786 -21.697
    2    HA   GLU  31           HA       GLU  31 -31.251  -5.650 -22.566
    3    HB2  GLU  31           HB2      GLU  31 -34.155  -6.313 -23.095
    4    HB3  GLU  31           HB3      GLU  31 -33.277  -4.981 -23.845
    5    HG2  GLU  31           HG2      GLU  31 -31.824  -6.477 -24.989
    6    HG3  GLU  31           HG3      GLU  31 -32.429  -7.858 -24.076

  No H/Q in entry =           6
  In of MODEL   89
    1    H    VAL  32           H        VAL  32 -31.476  -5.484 -19.840
    2    HA   VAL  32           HA       VAL  32 -33.299  -3.317 -19.248
    3    HB   VAL  32           HB       VAL  32 -30.946  -4.326 -17.619
    4   HG12  VAL  32          HG11      VAL  32 -32.483  -3.428 -15.759
    5   HG11  VAL  32          HG12      VAL  32 -33.284  -2.534 -17.052
    6   HG13  VAL  32          HG13      VAL  32 -31.575  -2.260 -16.720
    7   HG21  VAL  32          HG21      VAL  32 -32.743  -6.023 -18.289
    8   HG23  VAL  32          HG22      VAL  32 -33.777  -5.148 -17.159
    9   HG22  VAL  32          HG23      VAL  32 -32.283  -5.892 -16.592

  No H/Q in entry =           9
  In of MODEL   89
    1    HA   PRO  33           HA       PRO  33 -30.189  -0.490 -20.952
    2    HB2  PRO  33           HB2      PRO  33 -31.655   1.765 -20.893
    3    HB3  PRO  33           HB3      PRO  33 -32.139   0.449 -21.964
    4    HG2  PRO  33           HG2      PRO  33 -33.126   1.048 -19.174
    5    HG3  PRO  33           HG3      PRO  33 -34.079   0.827 -20.642
    6    HD2  PRO  33           HD2      PRO  33 -33.684  -1.217 -18.926
    7    HD3  PRO  33           HD3      PRO  33 -33.732  -1.496 -20.667

  No H/Q in entry =           7
  In of MODEL   89
    1    H    VAL  34           H        VAL  34 -28.957  -1.018 -18.978
    2    HA   VAL  34           HA       VAL  34 -28.641   1.437 -17.380
    3    HB   VAL  34           HB       VAL  34 -28.110   0.007 -15.405
    4   HG12  VAL  34          HG11      VAL  34 -30.543  -0.809 -15.105
    5   HG11  VAL  34          HG12      VAL  34 -30.827  -0.078 -16.683
    6   HG13  VAL  34          HG13      VAL  34 -30.269   0.917 -15.338
    7   HG21  VAL  34          HG21      VAL  34 -28.316  -2.059 -17.370
    8   HG23  VAL  34          HG22      VAL  34 -29.394  -2.368 -16.009
    9   HG22  VAL  34          HG23      VAL  34 -27.674  -2.110 -15.729

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ILE  35           H        ILE  35 -26.665   1.850 -16.528
    2    HA   ILE  35           HA       ILE  35 -24.375   0.448 -17.737
    3    HB   ILE  35           HB       ILE  35 -24.725   3.363 -16.994
    4   HG12  ILE  35          HG12      ILE  35 -23.742   1.980 -19.499
    5   HG13  ILE  35          HG13      ILE  35 -25.362   2.639 -19.270
    6   HG21  ILE  35          HG21      ILE  35 -22.191   1.772 -17.241
    7   HG23  ILE  35          HG22      ILE  35 -22.634   2.987 -16.044
    8   HG22  ILE  35          HG23      ILE  35 -22.225   3.478 -17.687
    9   HD11  ILE  35          HD11      ILE  35 -23.923   4.818 -18.702
   10   HD13  ILE  35          HD12      ILE  35 -24.451   4.410 -20.334
   11   HD12  ILE  35          HD13      ILE  35 -22.812   4.019 -19.813

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ILE  36           H        ILE  36 -23.182  -0.564 -16.102
    2    HA   ILE  36           HA       ILE  36 -23.639   0.123 -13.252
    3    HB   ILE  36           HB       ILE  36 -22.855  -2.620 -14.292
    4   HG12  ILE  36          HG12      ILE  36 -25.653  -1.742 -13.576
    5   HG13  ILE  36          HG13      ILE  36 -25.064  -1.769 -15.238
    6   HG23  ILE  36          HG21      ILE  36 -23.244  -3.395 -12.164
    7   HG22  ILE  36          HG22      ILE  36 -24.350  -2.081 -11.765
    8   HG21  ILE  36          HG23      ILE  36 -22.613  -1.785 -11.824
    9   HD13  ILE  36          HD11      ILE  36 -25.272  -3.984 -15.398
   10   HD12  ILE  36          HD12      ILE  36 -26.349  -3.810 -14.013
   11   HD11  ILE  36          HD13      ILE  36 -24.662  -4.259 -13.766

  No H/Q in entry =          11
  In of MODEL   89
    1    H    GLU  37           H        GLU  37 -21.858   0.741 -12.141
    2    HA   GLU  37           HA       GLU  37 -19.174  -0.128 -13.011
    3    HB2  GLU  37           HB2      GLU  37 -20.007   2.694 -12.360
    4    HB3  GLU  37           HB3      GLU  37 -18.334   2.155 -12.508
    5    HG2  GLU  37           HG2      GLU  37 -20.373   2.167 -14.715
    6    HG3  GLU  37           HG3      GLU  37 -19.108   3.371 -14.473

  No H/Q in entry =           6
  In of MODEL   89
    1    H    ALA  38           H        ALA  38 -17.710  -0.358 -11.308
    2    HA   ALA  38           HA       ALA  38 -18.766  -0.099  -8.552
    3    HB1  ALA  38           HB1      ALA  38 -17.075  -2.101  -9.918
    4    HB3  ALA  38           HB2      ALA  38 -18.144  -2.286  -8.527
    5    HB2  ALA  38           HB3      ALA  38 -16.521  -1.630  -8.311

  No H/Q in entry =           5
  In of MODEL   89
    1    H    PHE  39           H        PHE  39 -17.518   1.119  -7.093
    2    HA   PHE  39           HA       PHE  39 -14.961   2.254  -7.988
    3    HB2  PHE  39           HB2      PHE  39 -17.099   3.939  -6.693
    4    HB3  PHE  39           HB3      PHE  39 -15.555   4.474  -7.353
    5    HD1  PHE  39           HD1      PHE  39 -15.285   4.941  -9.651
    6    HD2  PHE  39           HD2      PHE  39 -18.919   3.250  -8.195
    7    HE1  PHE  39           HE1      PHE  39 -16.371   5.437 -11.823
    8    HE2  PHE  39           HE2      PHE  39 -20.014   3.733 -10.354
    9    HZ   PHE  39           HZ       PHE  39 -18.739   4.798 -12.186

  No H/Q in entry =           9
  In of MODEL   89
    1    HA   PRO  40           HA       PRO  40 -14.082   1.577  -3.676
    2    HB2  PRO  40           HB2      PRO  40 -12.284   3.572  -3.094
    3    HB3  PRO  40           HB3      PRO  40 -11.854   2.212  -4.130
    4    HG2  PRO  40           HG2      PRO  40 -12.825   4.947  -4.944
    5    HG3  PRO  40           HG3      PRO  40 -11.405   4.072  -5.516
    6    HD2  PRO  40           HD2      PRO  40 -13.613   3.990  -6.946
    7    HD3  PRO  40           HD3      PRO  40 -12.689   2.507  -6.717

  No H/Q in entry =           7
  In of MODEL   89
    1    H    GLU  41           H        GLU  41 -14.707   2.613  -1.575
    2    HA   GLU  41           HA       GLU  41 -16.921   4.354  -1.620
    3    HB2  GLU  41           HB2      GLU  41 -16.842   4.291   0.743
    4    HB3  GLU  41           HB3      GLU  41 -16.282   2.709   0.200
    5    HG2  GLU  41           HG2      GLU  41 -13.915   3.687   0.481
    6    HG3  GLU  41           HG3      GLU  41 -14.708   4.944   1.432

  No H/Q in entry =           6
  In of MODEL   89
    1    H    THR  42           H        THR  42 -13.575   5.213  -1.656
    2    HA   THR  42           HA       THR  42 -13.896   7.805  -0.503
    3    HB   THR  42           HB       THR  42 -11.719   8.318  -1.590
    4    HG1  THR  42           HG1      THR  42 -11.246   5.814  -2.491
    5   HG21  THR  42          HG21      THR  42 -11.823   7.064   0.563
    6   HG23  THR  42          HG22      THR  42 -10.406   6.647  -0.403
    7   HG22  THR  42          HG23      THR  42 -11.789   5.556  -0.351

  No H/Q in entry =           7
  In of MODEL   89
    1    H    LEU  43           H        LEU  43 -14.787   6.658  -3.589
    2    HA   LEU  43           HA       LEU  43 -14.983   9.413  -4.622
    3    HB2  LEU  43           HB2      LEU  43 -15.396   6.748  -5.969
    4    HB3  LEU  43           HB3      LEU  43 -15.536   8.320  -6.756
    5    HG   LEU  43           HG       LEU  43 -12.995   7.101  -5.699
    6   HD13  LEU  43          HD11      LEU  43 -12.450   6.543  -7.872
    7   HD12  LEU  43          HD12      LEU  43 -13.573   7.712  -8.564
    8   HD11  LEU  43          HD13      LEU  43 -14.182   6.215  -7.860
    9   HD21  LEU  43          HD21      LEU  43 -13.680   9.748  -6.941
   10   HD23  LEU  43          HD22      LEU  43 -12.070   9.054  -7.132
   11   HD22  LEU  43          HD23      LEU  43 -12.693   9.409  -5.521

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ALA  44           H        ALA  44 -16.978   7.662  -2.750
    2    HA   ALA  44           HA       ALA  44 -19.444   7.534  -4.096
    3    HB2  ALA  44           HB1      ALA  44 -19.346   6.462  -1.974
    4    HB3  ALA  44           HB2      ALA  44 -20.434   7.830  -1.742
    5    HB1  ALA  44           HB3      ALA  44 -18.766   7.923  -1.175

  No H/Q in entry =           5
  In of MODEL   89
    1    H    GLY  45           H        GLY  45 -17.993  10.343  -2.610
    2    HA3  GLY  45           HA2      GLY  45 -20.400  11.875  -3.030
    3    HA2  GLY  45           HA3      GLY  45 -18.851  12.487  -2.450

  No H/Q in entry =           3
  In of MODEL   89
    1    H    GLU  46           H        GLU  46 -17.313  11.473  -4.703
    2    HA   GLU  46           HA       GLU  46 -17.894  13.660  -6.528
    3    HB2  GLU  46           HB2      GLU  46 -15.735  11.545  -6.478
    4    HB3  GLU  46           HB3      GLU  46 -15.831  12.836  -7.677
    5    HG2  GLU  46           HG2      GLU  46 -14.281  13.647  -6.177
    6    HG3  GLU  46           HG3      GLU  46 -15.775  14.419  -5.645

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LYS  47           H        LYS  47 -17.830  10.131  -6.883
    2    HA   LYS  47           HA       LYS  47 -18.897  10.309  -9.574
    3    HB2  LYS  47           HB2      LYS  47 -18.410   7.939  -7.762
    4    HB3  LYS  47           HB3      LYS  47 -18.928   7.837  -9.445
    5    HG2  LYS  47           HG2      LYS  47 -16.392   9.220  -8.675
    6    HG3  LYS  47           HG3      LYS  47 -16.457   7.475  -8.916
    7    HD2  LYS  47           HD2      LYS  47 -17.320   7.801 -11.169
    8    HD3  LYS  47           HD3      LYS  47 -17.311   9.547 -10.932
    9    HE2  LYS  47           HE2      LYS  47 -15.361   8.934 -12.183
   10    HE3  LYS  47           HE3      LYS  47 -14.860   9.432 -10.568
   11    HZ3  LYS  47           HZ1      LYS  47 -13.922   7.478 -10.279
   12    HZ2  LYS  47           HZ2      LYS  47 -14.363   7.019 -11.854
   13    HZ1  LYS  47           HZ3      LYS  47 -15.399   6.684 -10.549

  No H/Q in entry =          13
  In of MODEL   89
    1    H    GLY  48           H        GLY  48 -20.264   9.645  -6.424
    2    HA3  GLY  48           HA2      GLY  48 -22.661   8.483  -7.164
    3    HA2  GLY  48           HA3      GLY  48 -22.434   9.505  -5.745

  No H/Q in entry =           3
  In of MODEL   89
    1    H    GLN  49           H        GLN  49 -21.794  11.883  -7.364
    2    HA   GLN  49           HA       GLN  49 -24.332  13.033  -7.560
    3    HB2  GLN  49           HB2      GLN  49 -21.761  13.824  -8.911
    4    HB3  GLN  49           HB3      GLN  49 -23.207  14.816  -8.864
    5    HG2  GLN  49           HG2      GLN  49 -23.072  14.891  -6.427
    6    HG3  GLN  49           HG3      GLN  49 -21.639  13.879  -6.472
    7   HE21  GLN  49          HE21      GLN  49 -21.497  16.132  -5.248
    8   HE22  GLN  49          HE22      GLN  49 -20.546  17.359  -5.913

  No H/Q in entry =           8
  In of MODEL   89
    1    H    ASN  50           H        ASN  50 -22.662  11.072  -9.886
    2    HA   ASN  50           HA       ASN  50 -24.508  11.930 -12.007
    3    HB2  ASN  50           HB2      ASN  50 -21.952  10.342 -12.179
    4    HB3  ASN  50           HB3      ASN  50 -22.982  10.755 -13.543
    5   HD21  ASN  50          HD21      ASN  50 -20.348  11.591 -11.923
    6   HD22  ASN  50          HD22      ASN  50 -20.083  13.215 -12.299

  No H/Q in entry =           6
  In of MODEL   89
    1    H    ALA  51           H        ALA  51 -24.557   9.624  -9.709
    2    HA   ALA  51           HA       ALA  51 -25.360   7.453 -11.495
    3    HB2  ALA  51           HB1      ALA  51 -24.818   6.132  -9.774
    4    HB3  ALA  51           HB2      ALA  51 -25.937   6.984  -8.711
    5    HB1  ALA  51           HB3      ALA  51 -24.285   7.572  -8.905

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ASP  52           H        ASP  52 -27.385   6.436 -11.354
    2    HA   ASP  52           HA       ASP  52 -29.540   8.322 -10.753
    3    HB2  ASP  52           HB2      ASP  52 -29.377   5.777 -12.364
    4    HB3  ASP  52           HB3      ASP  52 -30.912   6.547 -11.963

  No H/Q in entry =           4
  In of MODEL   89
    1    H    VAL  53           H        VAL  53 -28.002   5.428  -9.656
    2    HA   VAL  53           HA       VAL  53 -29.465   5.638  -7.158
    3    HB   VAL  53           HB       VAL  53 -30.881   3.993  -8.380
    4   HG11  VAL  53          HG11      VAL  53 -29.134   3.069  -9.864
    5   HG13  VAL  53          HG12      VAL  53 -30.000   1.809  -8.985
    6   HG12  VAL  53          HG13      VAL  53 -28.386   2.293  -8.469
    7   HG23  VAL  53          HG21      VAL  53 -30.113   2.040  -6.636
    8   HG22  VAL  53          HG22      VAL  53 -31.221   3.373  -6.311
    9   HG21  VAL  53          HG23      VAL  53 -29.516   3.523  -5.888

  No H/Q in entry =           9
  In of MODEL   89
    1    H    VAL  54           H        VAL  54 -28.178   5.218  -5.480
    2    HA   VAL  54           HA       VAL  54 -25.428   4.305  -6.044
    3    HB   VAL  54           HB       VAL  54 -26.487   6.152  -3.845
    4   HG11  VAL  54          HG11      VAL  54 -23.933   4.679  -4.077
    5   HG13  VAL  54          HG12      VAL  54 -24.688   5.405  -2.659
    6   HG12  VAL  54          HG13      VAL  54 -23.751   6.406  -3.768
    7   HG22  VAL  54          HG21      VAL  54 -25.583   7.925  -4.975
    8   HG21  VAL  54          HG22      VAL  54 -26.135   6.916  -6.311
    9   HG23  VAL  54          HG23      VAL  54 -24.433   6.919  -5.855

  No H/Q in entry =           9
  In of MODEL   89
    1    H    LEU  55           H        LEU  55 -24.879   2.388  -5.352
    2    HA   LEU  55           HA       LEU  55 -26.433   1.154  -3.164
    3    HB2  LEU  55           HB2      LEU  55 -24.876  -0.094  -5.416
    4    HB3  LEU  55           HB3      LEU  55 -25.666  -0.985  -4.115
    5    HG   LEU  55           HG       LEU  55 -27.051   0.582  -6.282
    6   HD13  LEU  55          HD11      LEU  55 -26.774  -1.303  -7.458
    7   HD12  LEU  55          HD12      LEU  55 -27.760  -2.133  -6.253
    8   HD11  LEU  55          HD13      LEU  55 -26.005  -2.098  -6.086
    9   HD23  LEU  55          HD21      LEU  55 -28.402  -1.298  -4.398
   10   HD22  LEU  55          HD22      LEU  55 -29.062   0.077  -5.284
   11   HD21  LEU  55          HD23      LEU  55 -28.051   0.346  -3.863

  No H/Q in entry =          11
  In of MODEL   89
    1    H    LEU  56           H        LEU  56 -25.311   0.579  -1.334
    2    HA   LEU  56           HA       LEU  56 -22.369   0.918  -1.362
    3    HB2  LEU  56           HB2      LEU  56 -24.200   0.794   1.022
    4    HB3  LEU  56           HB3      LEU  56 -22.483   1.191   1.020
    5    HG   LEU  56           HG       LEU  56 -24.739   2.891  -0.006
    6   HD11  LEU  56          HD11      LEU  56 -23.657   2.544   2.535
    7   HD13  LEU  56          HD12      LEU  56 -24.616   3.920   1.988
    8   HD12  LEU  56          HD13      LEU  56 -22.856   3.989   1.916
    9   HD23  LEU  56          HD21      LEU  56 -22.760   4.547  -0.216
   10   HD22  LEU  56          HD22      LEU  56 -23.150   3.429  -1.523
   11   HD21  LEU  56          HD23      LEU  56 -21.815   3.075  -0.427

  No H/Q in entry =          11
  In of MODEL   89
    1    H    GLY  57           H        GLY  57 -21.026  -0.727  -0.777
    2    HA3  GLY  57           HA2      GLY  57 -21.999  -3.399  -0.922
    3    HA2  GLY  57           HA3      GLY  57 -20.372  -2.924  -0.439

  No H/Q in entry =           3
  In of MODEL   89
    1    HA   PRO  58           HA       PRO  58 -23.237  -3.826   3.264
    2    HB2  PRO  58           HB2      PRO  58 -22.610  -6.429   3.936
    3    HB3  PRO  58           HB3      PRO  58 -23.976  -6.016   2.899
    4    HG2  PRO  58           HG2      PRO  58 -21.258  -6.967   2.162
    5    HG3  PRO  58           HG3      PRO  58 -22.824  -7.411   1.484
    6    HD2  PRO  58           HD2      PRO  58 -21.168  -5.654   0.238
    7    HD3  PRO  58           HD3      PRO  58 -22.924  -5.536   0.115

  No H/Q in entry =           7
  In of MODEL   89
    1    H    GLN  59           H        GLN  59 -19.871  -4.376   2.704
    2    HA   GLN  59           HA       GLN  59 -19.145  -4.347   5.472
    3    HB2  GLN  59           HB2      GLN  59 -17.503  -3.555   3.061
    4    HB3  GLN  59           HB3      GLN  59 -16.881  -3.798   4.680
    5    HG2  GLN  59           HG2      GLN  59 -18.175  -5.912   2.965
    6    HG3  GLN  59           HG3      GLN  59 -16.447  -5.705   3.199
    7   HE21  GLN  59          HE21      GLN  59 -18.714  -7.441   4.014
    8   HE22  GLN  59          HE22      GLN  59 -18.539  -8.167   5.500

  No H/Q in entry =           8
  In of MODEL   89
    1    H    ILE  60           H        ILE  60 -20.006  -1.828   3.198
    2    HA   ILE  60           HA       ILE  60 -19.135   0.157   5.208
    3    HB   ILE  60           HB       ILE  60 -19.332   1.848   3.331
    4   HG12  ILE  60          HG12      ILE  60 -19.117  -0.445   1.424
    5   HG13  ILE  60          HG13      ILE  60 -20.706   0.140   1.916
    6   HG21  ILE  60          HG21      ILE  60 -17.223   0.706   4.153
    7   HG23  ILE  60          HG22      ILE  60 -17.168   1.508   2.584
    8   HG22  ILE  60          HG23      ILE  60 -17.312  -0.247   2.671
    9   HD13  ILE  60          HD11      ILE  60 -20.360   1.395   0.007
   10   HD12  ILE  60          HD12      ILE  60 -18.617   1.488   0.257
   11   HD11  ILE  60          HD13      ILE  60 -19.702   2.484   1.227

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ALA  61           H        ALA  61 -21.622  -1.378   5.286
    2    HA   ALA  61           HA       ALA  61 -23.810   0.319   4.767
    3    HB1  ALA  61           HB1      ALA  61 -25.068  -1.116   6.112
    4    HB2  ALA  61           HB2      ALA  61 -23.688  -1.510   7.138
    5    HB3  ALA  61           HB3      ALA  61 -23.779  -2.152   5.498

  No H/Q in entry =           5
  In of MODEL   89
    1    H    TYR  62           H        TYR  62 -21.634   0.227   7.589
    2    HA   TYR  62           HA       TYR  62 -23.173   1.952   9.205
    3    HB2  TYR  62           HB2      TYR  62 -21.127   2.374  10.443
    4    HB3  TYR  62           HB3      TYR  62 -21.232   0.662  10.037
    5    HD1  TYR  62           HD1      TYR  62 -19.671  -0.343   8.417
    6    HD2  TYR  62           HD2      TYR  62 -19.363   3.784   9.484
    7    HE1  TYR  62           HE1      TYR  62 -17.447  -0.241   7.360
    8    HE2  TYR  62           HE2      TYR  62 -17.124   3.880   8.428
    9    HH   TYR  62           HH       TYR  62 -15.445   1.089   7.512

  No H/Q in entry =           9
  In of MODEL   89
    1    H    MET  63           H        MET  63 -21.485   2.713   6.349
    2    HA   MET  63           HA       MET  63 -21.268   5.556   6.981
    3    HB2  MET  63           HB2      MET  63 -20.662   3.961   4.491
    4    HB3  MET  63           HB3      MET  63 -20.444   5.707   4.626
    5    HG2  MET  63           HG2      MET  63 -18.761   5.374   6.343
    6    HG3  MET  63           HG3      MET  63 -18.989   3.629   6.239
    7    HE2  MET  63           HE1      MET  63 -16.138   2.993   4.731
    8    HE1  MET  63           HE2      MET  63 -16.615   3.895   6.170
    9    HE3  MET  63           HE3      MET  63 -15.637   4.675   4.925

  No H/Q in entry =           9
  In of MODEL   89
    1    H    LEU  64           H        LEU  64 -23.859   3.733   6.031
    2    HA   LEU  64           HA       LEU  64 -25.018   5.128   3.909
    3    HB2  LEU  64           HB2      LEU  64 -25.939   3.062   4.865
    4    HB3  LEU  64           HB3      LEU  64 -26.393   3.946   6.321
    5    HG   LEU  64           HG       LEU  64 -28.050   5.207   5.048
    6   HD13  LEU  64          HD11      LEU  64 -27.740   5.392   2.813
    7   HD12  LEU  64          HD12      LEU  64 -28.419   3.768   2.698
    8   HD11  LEU  64          HD13      LEU  64 -26.670   3.992   2.768
    9   HD23  LEU  64          HD21      LEU  64 -28.620   2.390   4.357
   10   HD22  LEU  64          HD22      LEU  64 -29.593   3.564   5.242
   11   HD21  LEU  64          HD23      LEU  64 -28.242   2.760   6.040

  No H/Q in entry =          11
  In of MODEL   89
    1    HA   PRO  65           HA       PRO  65 -27.160   8.388   6.566
    2    HB2  PRO  65           HB2      PRO  65 -25.177   8.555   8.837
    3    HB3  PRO  65           HB3      PRO  65 -26.911   8.874   8.859
    4    HG2  PRO  65           HG2      PRO  65 -26.038   6.622   9.845
    5    HG3  PRO  65           HG3      PRO  65 -27.448   6.595   8.787
    6    HD2  PRO  65           HD2      PRO  65 -24.583   5.905   8.126
    7    HD3  PRO  65           HD3      PRO  65 -26.054   5.040   7.685

  No H/Q in entry =           7
  In of MODEL   89
    1    H    GLU  66           H        GLU  66 -23.606   8.259   6.677
    2    HA   GLU  66           HA       GLU  66 -23.244  11.041   6.212
    3    HB2  GLU  66           HB2      GLU  66 -21.475   8.680   5.631
    4    HB3  GLU  66           HB3      GLU  66 -20.987  10.357   5.391
    5    HG2  GLU  66           HG2      GLU  66 -21.214  10.786   7.747
    6    HG3  GLU  66           HG3      GLU  66 -21.778   9.137   8.011

  No H/Q in entry =           6
  In of MODEL   89
    1    H    ILE  67           H        ILE  67 -23.384   8.247   4.022
    2    HA   ILE  67           HA       ILE  67 -22.909   9.894   1.695
    3    HB   ILE  67           HB       ILE  67 -23.873   7.012   1.931
    4   HG12  ILE  67          HG12      ILE  67 -21.209   8.102   1.009
    5   HG13  ILE  67          HG13      ILE  67 -21.529   7.728   2.702
    6   HG21  ILE  67          HG21      ILE  67 -23.752   8.838  -0.336
    7   HG23  ILE  67          HG22      ILE  67 -24.415   7.206  -0.254
    8   HG22  ILE  67          HG23      ILE  67 -22.697   7.445  -0.571
    9   HD12  ILE  67          HD11      ILE  67 -21.126   5.895   0.397
   10   HD11  ILE  67          HD12      ILE  67 -22.166   5.375   1.721
   11   HD13  ILE  67          HD13      ILE  67 -20.486   5.809   2.037

  No H/Q in entry =          11
  In of MODEL   89
    1    H    GLN  68           H        GLN  68 -25.817   8.942   3.322
    2    HA   GLN  68           HA       GLN  68 -27.606   9.869   1.310
    3    HB2  GLN  68           HB2      GLN  68 -27.898   9.585   4.297
    4    HB3  GLN  68           HB3      GLN  68 -29.194  10.187   3.278
    5    HG2  GLN  68           HG2      GLN  68 -29.257   8.130   2.048
    6    HG3  GLN  68           HG3      GLN  68 -27.829   7.539   2.877
    7   HE21  GLN  68          HE21      GLN  68 -30.038   6.228   2.750
    8   HE22  GLN  68          HE22      GLN  68 -30.890   5.824   4.167

  No H/Q in entry =           8
  In of MODEL   89
    1    H    ARG  69           H        ARG  69 -25.988  11.559   4.025
    2    HA   ARG  69           HA       ARG  69 -27.289  14.063   3.551
    3    HB2  ARG  69           HB2      ARG  69 -24.982  13.113   5.183
    4    HB3  ARG  69           HB3      ARG  69 -25.016  14.826   4.786
    5    HG2  ARG  69           HG2      ARG  69 -27.339  14.947   5.733
    6    HG3  ARG  69           HG3      ARG  69 -27.176  13.263   6.246
    7    HD2  ARG  69           HD2      ARG  69 -25.436  15.596   7.124
    8    HD3  ARG  69           HD3      ARG  69 -26.596  14.740   8.127
    9    HE   ARG  69           HE       ARG  69 -23.999  13.726   7.224
   10   HH21  ARG  69          HH11      ARG  69 -23.245  11.970   8.467
   11   HH22  ARG  69          HH12      ARG  69 -24.303  11.205   9.603
   12   HH11  ARG  69          HH21      ARG  69 -26.984  13.288   8.904
   13   HH12  ARG  69          HH22      ARG  69 -26.421  11.948   9.849

  No H/Q in entry =          13
  In of MODEL   89
    1    H    LEU  70           H        LEU  70 -24.440  12.557   2.251
    2    HA   LEU  70           HA       LEU  70 -23.257  14.868   1.042
    3    HB2  LEU  70           HB2      LEU  70 -22.326  12.540   1.698
    4    HB3  LEU  70           HB3      LEU  70 -22.937  12.055   0.116
    5    HG   LEU  70           HG       LEU  70 -21.301  13.362  -0.983
    6   HD11  LEU  70          HD11      LEU  70 -20.484  14.248   1.793
    7   HD13  LEU  70          HD12      LEU  70 -21.142  15.271   0.516
    8   HD12  LEU  70          HD13      LEU  70 -19.545  14.545   0.327
    9   HD22  LEU  70          HD21      LEU  70 -19.914  11.617  -0.698
   10   HD21  LEU  70          HD22      LEU  70 -20.865  11.149   0.711
   11   HD23  LEU  70          HD23      LEU  70 -19.456  12.191   0.905

  No H/Q in entry =          11
  In of MODEL   89
    1    H    LEU  71           H        LEU  71 -25.464  12.355  -0.038
    2    HA   LEU  71           HA       LEU  71 -25.927  13.799  -2.592
    3    HB2  LEU  71           HB2      LEU  71 -26.214  10.831  -2.082
    4    HB3  LEU  71           HB3      LEU  71 -26.306  11.660  -3.635
    5    HG   LEU  71           HG       LEU  71 -23.802  11.646  -1.950
    6   HD12  LEU  71          HD11      LEU  71 -23.875   9.965  -4.346
    7   HD11  LEU  71          HD12      LEU  71 -24.913   9.398  -3.039
    8   HD13  LEU  71          HD13      LEU  71 -23.190   9.639  -2.755
    9   HD22  LEU  71          HD21      LEU  71 -23.844  13.430  -3.485
   10   HD21  LEU  71          HD22      LEU  71 -24.356  12.371  -4.798
   11   HD23  LEU  71          HD23      LEU  71 -22.745  12.197  -4.101

  No H/Q in entry =          11
  In of MODEL   89
    1    HA   PRO  72           HA       PRO  72 -29.828  13.510   0.001
    2    HB2  PRO  72           HB2      PRO  72 -30.616  16.091  -0.145
    3    HB3  PRO  72           HB3      PRO  72 -29.329  15.628   0.969
    4    HG2  PRO  72           HG2      PRO  72 -29.086  16.756  -1.809
    5    HG3  PRO  72           HG3      PRO  72 -28.318  17.319  -0.325
    6    HD2  PRO  72           HD2      PRO  72 -27.007  15.686  -2.043
    7    HD3  PRO  72           HD3      PRO  72 -26.773  15.552  -0.301

  No H/Q in entry =           7
  In of MODEL   89
    1    H    ASN  73           H        ASN  73 -29.150  14.376  -3.228
    2    HA   ASN  73           HA       ASN  73 -32.011  14.131  -3.881
    3    HB2  ASN  73           HB2      ASN  73 -31.496  15.177  -5.997
    4    HB3  ASN  73           HB3      ASN  73 -30.959  16.172  -4.653
    5   HD21  ASN  73          HD21      ASN  73 -30.138  16.136  -7.323
    6   HD22  ASN  73          HD22      ASN  73 -28.473  15.924  -7.496

  No H/Q in entry =           6
  In of MODEL   89
    1    H    LYS  74           H        LYS  74 -30.098  11.832  -3.387
    2    HA   LYS  74           HA       LYS  74 -30.682  10.397  -5.909
    3    HB2  LYS  74           HB2      LYS  74 -28.173  10.070  -4.257
    4    HB3  LYS  74           HB3      LYS  74 -28.566   9.235  -5.760
    5    HG2  LYS  74           HG2      LYS  74 -28.219  12.200  -5.622
    6    HG3  LYS  74           HG3      LYS  74 -26.872  11.093  -5.888
    7    HD2  LYS  74           HD2      LYS  74 -27.998  10.153  -7.822
    8    HD3  LYS  74           HD3      LYS  74 -29.391  11.198  -7.538
    9    HE2  LYS  74           HE2      LYS  74 -28.105  13.158  -8.013
   10    HE3  LYS  74           HE3      LYS  74 -26.609  12.223  -8.069
   11    HZ2  LYS  74           HZ1      LYS  74 -28.043  12.819 -10.222
   12    HZ1  LYS  74           HZ2      LYS  74 -28.744  11.325  -9.822
   13    HZ3  LYS  74           HZ3      LYS  74 -27.073  11.431 -10.106

  No H/Q in entry =          13
  In of MODEL   89
    1    HA   PRO  75           HA       PRO  75 -32.189   7.521  -2.887
    2    HB2  PRO  75           HB2      PRO  75 -32.548   5.277  -4.422
    3    HB3  PRO  75           HB3      PRO  75 -33.634   6.662  -4.532
    4    HG2  PRO  75           HG2      PRO  75 -31.299   5.957  -6.267
    5    HG3  PRO  75           HG3      PRO  75 -32.930   6.432  -6.739
    6    HD2  PRO  75           HD2      PRO  75 -30.934   8.241  -6.719
    7    HD3  PRO  75           HD3      PRO  75 -32.559   8.699  -6.205

  No H/Q in entry =           7
  In of MODEL   89
    1    H    VAL  76           H        VAL  76 -30.780   6.454  -1.476
    2    HA   VAL  76           HA       VAL  76 -28.342   5.149  -2.532
    3    HB   VAL  76           HB       VAL  76 -28.611   6.683   0.090
    4   HG11  VAL  76          HG11      VAL  76 -26.281   5.297  -1.250
    5   HG13  VAL  76          HG12      VAL  76 -27.004   4.902   0.311
    6   HG12  VAL  76          HG13      VAL  76 -26.112   6.410   0.110
    7   HG22  VAL  76          HG21      VAL  76 -27.879   8.544  -0.832
    8   HG21  VAL  76          HG22      VAL  76 -28.428   7.829  -2.350
    9   HG23  VAL  76          HG23      VAL  76 -26.733   7.702  -1.877

  No H/Q in entry =           9
  In of MODEL   89
    1    H    GLU  77           H        GLU  77 -28.193   3.004  -1.869
    2    HA   GLU  77           HA       GLU  77 -29.027   2.300   0.794
    3    HB2  GLU  77           HB2      GLU  77 -30.677   0.689   0.284
    4    HB3  GLU  77           HB3      GLU  77 -31.175   2.211  -0.457
    5    HG2  GLU  77           HG2      GLU  77 -30.567   1.386  -2.620
    6    HG3  GLU  77           HG3      GLU  77 -29.976  -0.114  -1.908

  No H/Q in entry =           6
  In of MODEL   89
    1    H    VAL  78           H        VAL  78 -28.767   0.220   1.504
    2    HA   VAL  78           HA       VAL  78 -26.117  -0.648   0.660
    3    HB   VAL  78           HB       VAL  78 -27.872  -1.428   3.028
    4   HG11  VAL  78          HG11      VAL  78 -25.559  -2.749   1.954
    5   HG13  VAL  78          HG12      VAL  78 -26.493  -3.161   3.393
    6   HG12  VAL  78          HG13      VAL  78 -25.142  -2.035   3.511
    7   HG22  VAL  78          HG21      VAL  78 -26.386  -0.078   4.350
    8   HG21  VAL  78          HG22      VAL  78 -27.082   0.883   3.045
    9   HG23  VAL  78          HG23      VAL  78 -25.420   0.304   2.925

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ILE  79           H        ILE  79 -25.626  -2.591  -0.197
    2    HA   ILE  79           HA       ILE  79 -27.717  -4.039  -1.531
    3    HB   ILE  79           HB       ILE  79 -24.744  -4.646  -1.268
    4   HG12  ILE  79          HG12      ILE  79 -26.326  -3.548  -3.597
    5   HG13  ILE  79          HG13      ILE  79 -25.434  -2.538  -2.459
    6   HG22  ILE  79          HG21      ILE  79 -25.858  -5.847  -3.571
    7   HG21  ILE  79          HG22      ILE  79 -26.870  -6.308  -2.202
    8   HG23  ILE  79          HG23      ILE  79 -25.138  -6.636  -2.168
    9   HD13  ILE  79          HD11      ILE  79 -24.007  -2.734  -4.259
   10   HD12  ILE  79          HD12      ILE  79 -24.394  -4.437  -4.505
   11   HD11  ILE  79          HD13      ILE  79 -23.409  -3.946  -3.126

  No H/Q in entry =          11
  In of MODEL   89
    1    H    ASP  80           H        ASP  80 -28.641  -5.923  -0.913
    2    HA   ASP  80           HA       ASP  80 -28.639  -6.763   1.753
    3    HB2  ASP  80           HB2      ASP  80 -30.393  -7.326   0.109
    4    HB3  ASP  80           HB3      ASP  80 -29.256  -8.386  -0.725

  No H/Q in entry =           4
  In of MODEL   89
    1    H    SER  81           H        SER  81 -27.148  -7.916   2.925
    2    HA   SER  81           HA       SER  81 -24.661  -8.696   1.774
    3    HB2  SER  81           HB2      SER  81 -24.156  -9.684   3.970
    4    HB3  SER  81           HB3      SER  81 -24.823  -8.061   4.143
    5    HG   SER  81           HG       SER  81 -25.964 -10.539   4.724

  No H/Q in entry =           5
  In of MODEL   89
    1    H    LEU  82           H        LEU  82 -27.434 -10.701   2.116
    2    HA   LEU  82           HA       LEU  82 -25.950 -13.124   1.665
    3    HB2  LEU  82           HB2      LEU  82 -28.866 -12.569   1.171
    4    HB3  LEU  82           HB3      LEU  82 -28.105 -14.143   1.398
    5    HG   LEU  82           HG       LEU  82 -28.416 -12.028   3.508
    6   HD11  LEU  82          HD11      LEU  82 -30.529 -13.151   2.792
    7   HD13  LEU  82          HD12      LEU  82 -30.072 -13.526   4.456
    8   HD12  LEU  82          HD13      LEU  82 -29.787 -14.705   3.175
    9   HD22  LEU  82          HD21      LEU  82 -26.447 -13.249   3.960
   10   HD21  LEU  82          HD22      LEU  82 -27.162 -14.760   3.398
   11   HD23  LEU  82          HD23      LEU  82 -27.696 -14.046   4.920

  No H/Q in entry =          11
  In of MODEL   89
    1    H    LEU  83           H        LEU  83 -27.825 -10.888  -0.324
    2    HA   LEU  83           HA       LEU  83 -27.640 -12.309  -2.761
    3    HB2  LEU  83           HB2      LEU  83 -27.972  -9.376  -2.185
    4    HB3  LEU  83           HB3      LEU  83 -28.007 -10.058  -3.810
    5    HG   LEU  83           HG       LEU  83 -30.072 -10.336  -1.646
    6   HD13  LEU  83          HD11      LEU  83 -30.764  -8.492  -2.760
    7   HD12  LEU  83          HD12      LEU  83 -31.246  -9.621  -4.024
    8   HD11  LEU  83          HD13      LEU  83 -29.687  -8.803  -4.120
    9   HD23  LEU  83          HD21      LEU  83 -30.221 -11.653  -4.342
   10   HD22  LEU  83          HD22      LEU  83 -31.214 -11.941  -2.915
   11   HD21  LEU  83          HD23      LEU  83 -29.541 -12.494  -2.951

  No H/Q in entry =          11
  In of MODEL   89
    1    H    TYR  84           H        TYR  84 -25.634  -9.942  -1.120
    2    HA   TYR  84           HA       TYR  84 -23.739  -9.559  -3.243
    3    HB2  TYR  84           HB2      TYR  84 -24.241  -8.021  -1.245
    4    HB3  TYR  84           HB3      TYR  84 -23.235  -9.121  -0.304
    5    HD1  TYR  84           HD1      TYR  84 -20.878  -8.973  -0.365
    6    HD2  TYR  84           HD2      TYR  84 -23.204  -6.807  -3.218
    7    HE1  TYR  84           HE1      TYR  84 -18.839  -7.793  -1.114
    8    HE2  TYR  84           HE2      TYR  84 -21.173  -5.628  -3.982
    9    HH   TYR  84           HH       TYR  84 -17.977  -6.467  -2.661

  No H/Q in entry =           9
  In of MODEL   89
    1    H    GLY  85           H        GLY  85 -23.585 -11.497  -0.248
    2    HA3  GLY  85           HA2      GLY  85 -21.031 -12.525  -0.683
    3    HA2  GLY  85           HA3      GLY  85 -22.295 -13.315   0.261

  No H/Q in entry =           3
  In of MODEL   89
    1    H    LYS  86           H        LYS  86 -24.132 -13.682  -1.809
    2    HA   LYS  86           HA       LYS  86 -23.137 -16.114  -3.002
    3    HB2  LYS  86           HB2      LYS  86 -25.397 -15.829  -2.052
    4    HB3  LYS  86           HB3      LYS  86 -25.744 -14.619  -3.285
    5    HG2  LYS  86           HG2      LYS  86 -25.625 -16.301  -5.000
    6    HG3  LYS  86           HG3      LYS  86 -25.213 -17.521  -3.794
    7    HD2  LYS  86           HD2      LYS  86 -27.318 -17.070  -2.614
    8    HD3  LYS  86           HD3      LYS  86 -27.730 -15.846  -3.814
    9    HE2  LYS  86           HE2      LYS  86 -28.895 -17.906  -4.317
   10    HE3  LYS  86           HE3      LYS  86 -27.686 -17.590  -5.561
   11    HZ3  LYS  86           HZ1      LYS  86 -27.490 -19.857  -4.952
   12    HZ2  LYS  86           HZ2      LYS  86 -27.486 -19.492  -3.292
   13    HZ1  LYS  86           HZ3      LYS  86 -26.160 -19.059  -4.259

  No H/Q in entry =          13
  In of MODEL   89
    1    H    VAL  87           H        VAL  87 -23.023 -12.923  -3.970
    2    HA   VAL  87           HA       VAL  87 -22.672 -11.805  -5.935
    3    HB   VAL  87           HB       VAL  87 -21.683 -14.331  -7.263
    4   HG12  VAL  87          HG11      VAL  87 -20.294 -11.670  -7.132
    5   HG11  VAL  87          HG12      VAL  87 -21.688 -11.877  -8.194
    6   HG13  VAL  87          HG13      VAL  87 -20.254 -12.880  -8.413
    7   HG22  VAL  87          HG21      VAL  87 -19.595 -14.278  -6.109
    8   HG21  VAL  87          HG22      VAL  87 -20.876 -14.399  -4.906
    9   HG23  VAL  87          HG23      VAL  87 -20.076 -12.854  -5.191

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ASP  88           H        ASP  88 -25.209 -12.366  -5.594
    2    HA   ASP  88           HA       ASP  88 -26.343 -13.606  -7.972
    3    HB2  ASP  88           HB2      ASP  88 -27.366 -13.768  -5.653
    4    HB3  ASP  88           HB3      ASP  88 -27.769 -12.057  -5.797

  No H/Q in entry =           4
  In of MODEL   89
    1    H    GLY  89           H        GLY  89 -25.588 -12.408  -9.635
    2    HA3  GLY  89           HA2      GLY  89 -25.688  -9.637  -9.904
    3    HA2  GLY  89           HA3      GLY  89 -25.684 -10.790 -11.237

  No H/Q in entry =           3
  In of MODEL   89
    1    H    LEU  90           H        LEU  90 -28.171 -12.061 -10.780
    2    HA   LEU  90           HA       LEU  90 -29.917 -10.103 -11.957
    3    HB2  LEU  90           HB2      LEU  90 -30.045 -12.509 -12.481
    4    HB3  LEU  90           HB3      LEU  90 -30.575 -12.822 -10.828
    5    HG   LEU  90           HG       LEU  90 -32.659 -11.654 -11.238
    6   HD13  LEU  90          HD11      LEU  90 -32.416  -9.954 -12.752
    7   HD12  LEU  90          HD12      LEU  90 -32.981 -11.202 -13.865
    8   HD11  LEU  90          HD13      LEU  90 -31.257 -10.853 -13.733
    9   HD23  LEU  90          HD21      LEU  90 -32.613 -13.343 -13.633
   10   HD22  LEU  90          HD22      LEU  90 -33.610 -13.445 -12.182
   11   HD21  LEU  90          HD23      LEU  90 -31.974 -14.104 -12.177

  No H/Q in entry =          11
  In of MODEL   89
    1    H    GLY  91           H        GLY  91 -29.819 -11.532  -8.736
    2    HA3  GLY  91           HA2      GLY  91 -32.135 -10.330  -7.746
    3    HA2  GLY  91           HA3      GLY  91 -30.767 -10.879  -6.778

  No H/Q in entry =           3
  In of MODEL   89
    1    H    VAL  92           H        VAL  92 -28.790  -9.127  -7.659
    2    HA   VAL  92           HA       VAL  92 -29.529  -6.769  -6.172
    3    HB   VAL  92           HB       VAL  92 -26.984  -7.347  -7.732
    4   HG12  VAL  92          HG11      VAL  92 -27.115  -5.403  -5.452
    5   HG11  VAL  92          HG12      VAL  92 -27.751  -4.878  -7.012
    6   HG13  VAL  92          HG13      VAL  92 -26.071  -5.391  -6.874
    7   HG22  VAL  92          HG21      VAL  92 -26.820  -8.902  -6.101
    8   HG21  VAL  92          HG22      VAL  92 -27.951  -8.064  -5.037
    9   HG23  VAL  92          HG23      VAL  92 -26.281  -7.513  -5.157

  No H/Q in entry =           9
  In of MODEL   89
    1    H    LEU  93           H        LEU  93 -29.112  -7.523  -9.572
    2    HA   LEU  93           HA       LEU  93 -29.375  -4.902 -10.567
    3    HB2  LEU  93           HB2      LEU  93 -28.773  -6.808 -11.977
    4    HB3  LEU  93           HB3      LEU  93 -30.386  -7.485 -11.752
    5    HG   LEU  93           HG       LEU  93 -31.333  -5.523 -12.933
    6   HD11  LEU  93          HD11      LEU  93 -29.441  -3.968 -12.448
    7   HD13  LEU  93          HD12      LEU  93 -29.868  -4.026 -14.160
    8   HD12  LEU  93          HD13      LEU  93 -28.444  -4.887 -13.576
    9   HD23  LEU  93          HD21      LEU  93 -30.291  -6.173 -15.196
   10   HD22  LEU  93          HD22      LEU  93 -31.176  -7.383 -14.268
   11   HD21  LEU  93          HD23      LEU  93 -29.410  -7.377 -14.255

  No H/Q in entry =          11
  In of MODEL   89
    1    H    LYS  94           H        LYS  94 -31.828  -7.360  -9.679
    2    HA   LYS  94           HA       LYS  94 -34.126  -5.869 -10.358
    3    HB2  LYS  94           HB2      LYS  94 -33.690  -8.018  -8.291
    4    HB3  LYS  94           HB3      LYS  94 -35.265  -7.286  -8.590
    5    HG2  LYS  94           HG2      LYS  94 -35.180  -8.118 -10.905
    6    HG3  LYS  94           HG3      LYS  94 -33.644  -8.905 -10.545
    7    HD2  LYS  94           HD2      LYS  94 -34.817 -10.163  -8.699
    8    HD3  LYS  94           HD3      LYS  94 -36.337  -9.487  -9.283
    9    HE2  LYS  94           HE2      LYS  94 -35.829 -10.482 -11.523
   10    HE3  LYS  94           HE3      LYS  94 -34.443 -11.288 -10.788
   11    HZ3  LYS  94           HZ1      LYS  94 -36.332 -12.761 -10.939
   12    HZ2  LYS  94           HZ2      LYS  94 -37.285 -11.686 -10.031
   13    HZ1  LYS  94           HZ3      LYS  94 -35.953 -12.456  -9.313

  No H/Q in entry =          13
  In of MODEL   89
    1    H    ALA  95           H        ALA  95 -32.332  -5.968  -7.292
    2    HA   ALA  95           HA       ALA  95 -34.149  -4.302  -5.867
    3    HB2  ALA  95           HB1      ALA  95 -31.817  -5.730  -5.276
    4    HB3  ALA  95           HB2      ALA  95 -32.780  -4.770  -4.153
    5    HB1  ALA  95           HB3      ALA  95 -31.403  -4.041  -4.980

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ALA  96           H        ALA  96 -31.466  -3.572  -7.960
    2    HA   ALA  96           HA       ALA  96 -31.299  -0.797  -7.249
    3    HB2  ALA  96           HB1      ALA  96 -29.913  -0.659  -9.351
    4    HB3  ALA  96           HB2      ALA  96 -30.263  -2.364  -9.634
    5    HB1  ALA  96           HB3      ALA  96 -29.346  -1.877  -8.208

  No H/Q in entry =           5
  In of MODEL   89
    1    H    VAL  97           H        VAL  97 -32.856  -2.531  -9.909
    2    HA   VAL  97           HA       VAL  97 -33.848  -0.232 -11.228
    3    HB   VAL  97           HB       VAL  97 -34.741  -3.132 -11.209
    4   HG11  VAL  97          HG11      VAL  97 -36.472  -1.088 -11.758
    5   HG13  VAL  97          HG12      VAL  97 -36.570  -2.696 -12.477
    6   HG12  VAL  97          HG13      VAL  97 -35.771  -1.389 -13.350
    7   HG21  VAL  97          HG21      VAL  97 -33.393  -1.391 -13.275
    8   HG23  VAL  97          HG22      VAL  97 -33.892  -3.063 -13.529
    9   HG22  VAL  97          HG23      VAL  97 -32.643  -2.685 -12.341

  No H/Q in entry =           9
  In of MODEL   89
    1    H    ALA  98           H        ALA  98 -35.115  -2.315  -8.652
    2    HA   ALA  98           HA       ALA  98 -37.645  -1.084  -8.351
    3    HB1  ALA  98           HB1      ALA  98 -36.705  -3.287  -7.259
    4    HB3  ALA  98           HB2      ALA  98 -37.865  -2.307  -6.359
    5    HB2  ALA  98           HB3      ALA  98 -36.144  -2.200  -5.988

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ALA  99           H        ALA  99 -34.557  -0.339  -6.695
    2    HA   ALA  99           HA       ALA  99 -35.640   1.717  -5.089
    3    HB1  ALA  99           HB1      ALA  99 -33.013   0.731  -5.792
    4    HB2  ALA  99           HB2      ALA  99 -33.553   1.532  -4.316
    5    HB3  ALA  99           HB3      ALA  99 -33.036   2.492  -5.702

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ILE 100           H        ILE 100 -34.568   1.738  -8.437
    2    HA   ILE 100           HA       ILE 100 -34.658   4.584  -8.723
    3    HB   ILE 100           HB       ILE 100 -34.802   2.385 -10.814
    4   HG12  ILE 100          HG12      ILE 100 -32.583   4.326 -10.169
    5   HG13  ILE 100          HG13      ILE 100 -32.675   2.695  -9.501
    6   HG21  ILE 100          HG21      ILE 100 -35.134   5.313 -11.014
    7   HG23  ILE 100          HG22      ILE 100 -35.669   4.035 -12.105
    8   HG22  ILE 100          HG23      ILE 100 -33.998   4.598 -12.160
    9   HD12  ILE 100          HD11      ILE 100 -32.091   3.573 -12.292
   10   HD11  ILE 100          HD12      ILE 100 -32.804   1.984 -12.006
   11   HD13  ILE 100          HD13      ILE 100 -31.250   2.396 -11.283

  No H/Q in entry =          11
  In of MODEL   89
    1    H    LYS 101           H        LYS 101 -37.024   2.031  -9.410
    2    HA   LYS 101           HA       LYS 101 -39.046   3.720 -10.466
    3    HB2  LYS 101           HB2      LYS 101 -39.025   0.969  -9.275
    4    HB3  LYS 101           HB3      LYS 101 -40.550   1.771  -9.652
    5    HG2  LYS 101           HG2      LYS 101 -40.053   1.838 -11.947
    6    HG3  LYS 101           HG3      LYS 101 -38.372   1.387 -11.669
    7    HD2  LYS 101           HD2      LYS 101 -39.673  -0.501 -12.523
    8    HD3  LYS 101           HD3      LYS 101 -39.070  -0.814 -10.894
    9    HE2  LYS 101           HE2      LYS 101 -41.158  -1.434 -10.391
   10    HE3  LYS 101           HE3      LYS 101 -41.561   0.284 -10.437
   11    HZ3  LYS 101           HZ1      LYS 101 -42.439   0.106 -12.558
   12    HZ2  LYS 101           HZ2      LYS 101 -42.952  -1.336 -11.822
   13    HZ1  LYS 101           HZ3      LYS 101 -41.635  -1.353 -12.895

  No H/Q in entry =          13
  In of MODEL   89
    1    H    LYS 102           H        LYS 102 -38.627   2.301  -7.221
    2    HA   LYS 102           HA       LYS 102 -40.846   3.592  -6.071
    3    HB2  LYS 102           HB2      LYS 102 -39.676   1.711  -5.003
    4    HB3  LYS 102           HB3      LYS 102 -38.256   2.729  -4.770
    5    HG2  LYS 102           HG2      LYS 102 -39.542   4.196  -3.317
    6    HG3  LYS 102           HG3      LYS 102 -40.965   3.183  -3.552
    7    HD2  LYS 102           HD2      LYS 102 -39.806   1.304  -2.473
    8    HD3  LYS 102           HD3      LYS 102 -38.383   2.319  -2.237
    9    HE2  LYS 102           HE2      LYS 102 -39.702   3.869  -0.874
   10    HE3  LYS 102           HE3      LYS 102 -41.142   2.885  -1.132
   11    HZ1  LYS 102           HZ1      LYS 102 -39.486   1.102  -0.074
   12    HZ3  LYS 102           HZ2      LYS 102 -40.576   2.041   0.826
   13    HZ2  LYS 102           HZ3      LYS 102 -38.949   2.513   0.702

  No H/Q in entry =          13
  In of MODEL   89
    1    H    ALA 103           H        ALA 103 -37.842   4.869  -7.086
    2    HA   ALA 103           HA       ALA 103 -38.008   7.228  -5.358
    3    HB2  ALA 103           HB1      ALA 103 -35.981   7.866  -6.932
    4    HB3  ALA 103           HB2      ALA 103 -35.996   6.139  -7.291
    5    HB1  ALA 103           HB3      ALA 103 -35.767   6.692  -5.633

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ALA 104           H        ALA 104 -38.623   6.442  -8.693
    2    HA   ALA 104           HA       ALA 104 -39.116   9.229  -9.382
    3    HB2  ALA 104           HB1      ALA 104 -39.161   8.514 -11.569
    4    HB1  ALA 104           HB2      ALA 104 -39.939   6.984 -11.164
    5    HB3  ALA 104           HB3      ALA 104 -38.211   7.200 -10.874

  No H/Q in entry =           5
  In of MODEL   89
    1    H    ALA 105           H        ALA 105 -40.804   7.216  -7.546
    2    HA   ALA 105           HA       ALA 105 -43.185   8.683  -7.573
    3    HB2  ALA 105           HB1      ALA 105 -43.938   7.802  -9.599
    4    HB3  ALA 105           HB2      ALA 105 -44.621   6.659  -8.443
    5    HB1  ALA 105           HB3      ALA 105 -43.154   6.245  -9.330

  No H/Q in entry =           5
  In of MODEL   90
    1    H1   ALA   1           H3       ALA   1 -12.322 -15.580  -2.472
    2    H2   ALA   1           H2       ALA   1 -11.385 -16.730  -3.308
    3    H3   ALA   1           H1       ALA   1 -12.518 -15.777  -4.147
    4    HA   ALA   1           HA       ALA   1 -13.931 -17.467  -3.913
    5    HB3  ALA   1           HB1      ALA   1 -12.550 -19.249  -3.445
    6    HB1  ALA   1           HB2      ALA   1 -13.312 -19.130  -1.859
    7    HB2  ALA   1           HB3      ALA   1 -11.730 -18.401  -2.133

  No H/Q in entry =           7
  In of MODEL   90
    1    H    GLU   2           H        GLU   2 -15.567 -18.309  -2.266
    2    HA   GLU   2           HA       GLU   2 -17.207 -16.576  -1.214
    3    HB2  GLU   2           HB2      GLU   2 -16.292 -19.008   0.335
    4    HB3  GLU   2           HB3      GLU   2 -17.811 -18.147   0.582
    5    HG2  GLU   2           HG2      GLU   2 -18.791 -19.226  -1.156
    6    HG3  GLU   2           HG3      GLU   2 -17.461 -18.835  -2.235

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLU   3           H        GLU   3 -15.316 -17.943   1.417
    2    HA   GLU   3           HA       GLU   3 -15.527 -15.588   2.973
    3    HB2  GLU   3           HB2      GLU   3 -13.962 -18.146   3.231
    4    HB3  GLU   3           HB3      GLU   3 -13.725 -16.828   4.379
    5    HG2  GLU   3           HG2      GLU   3 -15.923 -16.963   5.188
    6    HG3  GLU   3           HG3      GLU   3 -16.518 -17.759   3.736

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LEU   4           H        LEU   4 -12.577 -17.089   1.595
    2    HA   LEU   4           HA       LEU   4 -10.731 -15.199   2.202
    3    HB2  LEU   4           HB2      LEU   4 -10.960 -16.496  -0.524
    4    HB3  LEU   4           HB3      LEU   4  -9.505 -15.786   0.167
    5    HG   LEU   4           HG       LEU   4 -11.022 -18.172   1.273
    6   HD13  LEU   4          HD11      LEU   4  -9.396 -19.540   0.351
    7   HD12  LEU   4          HD12      LEU   4  -8.177 -18.266   0.330
    8   HD11  LEU   4          HD13      LEU   4  -9.460 -18.279  -0.879
    9   HD23  LEU   4          HD21      LEU   4  -8.778 -18.252   2.665
   10   HD22  LEU   4          HD22      LEU   4 -10.093 -17.203   3.188
   11   HD21  LEU   4          HD23      LEU   4  -8.721 -16.524   2.312

  No H/Q in entry =          11
  In of MODEL   90
    1    H    GLU   5           H        GLU   5 -13.052 -14.975  -0.483
    2    HA   GLU   5           HA       GLU   5 -12.026 -12.500  -1.479
    3    HB2  GLU   5           HB2      GLU   5 -14.441 -14.180  -1.963
    4    HB3  GLU   5           HB3      GLU   5 -14.502 -12.489  -2.459
    5    HG2  GLU   5           HG2      GLU   5 -12.052 -14.034  -3.171
    6    HG3  GLU   5           HG3      GLU   5 -13.528 -14.395  -4.066

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLU   6           H        GLU   6 -14.767 -13.356   0.601
    2    HA   GLU   6           HA       GLU   6 -15.652 -10.673   0.996
    3    HB2  GLU   6           HB2      GLU   6 -17.077 -12.683   1.388
    4    HB3  GLU   6           HB3      GLU   6 -16.072 -13.084   2.780
    5    HG2  GLU   6           HG2      GLU   6 -17.990 -11.881   3.604
    6    HG3  GLU   6           HG3      GLU   6 -16.604 -10.797   3.710

  No H/Q in entry =           6
  In of MODEL   90
    1    H    VAL   7           H        VAL   7 -13.369 -12.801   2.578
    2    HA   VAL   7           HA       VAL   7 -12.900 -11.229   4.907
    3    HB   VAL   7           HB       VAL   7 -11.206 -13.286   3.465
    4   HG11  VAL   7          HG11      VAL   7 -10.738 -11.757   6.031
    5   HG13  VAL   7          HG12      VAL   7  -9.633 -11.980   4.676
    6   HG12  VAL   7          HG13      VAL   7 -10.002 -13.334   5.744
    7   HG21  VAL   7          HG21      VAL   7 -13.467 -13.833   4.675
    8   HG23  VAL   7          HG22      VAL   7 -12.544 -13.566   6.155
    9   HG22  VAL   7          HG23      VAL   7 -12.056 -14.830   5.028

  No H/Q in entry =           9
  In of MODEL   90
    1    H    VAL   8           H        VAL   8 -11.375 -11.356   1.704
    2    HA   VAL   8           HA       VAL   8  -9.300  -9.499   2.206
    3    HB   VAL   8           HB       VAL   8 -10.751 -10.245  -0.340
    4   HG11  VAL   8          HG11      VAL   8  -8.422  -8.369   0.133
    5   HG13  VAL   8          HG12      VAL   8  -9.925  -8.035  -0.728
    6   HG12  VAL   8          HG13      VAL   8  -8.730  -9.123  -1.433
    7   HG22  VAL   8          HG21      VAL   8  -8.980 -11.749  -0.711
    8   HG21  VAL   8          HG22      VAL   8  -9.122 -11.828   1.042
    9   HG23  VAL   8          HG23      VAL   8  -7.861 -10.843   0.309

  No H/Q in entry =           9
  In of MODEL   90
    1    H    MET   9           H        MET   9 -12.637  -9.084   1.030
    2    HA   MET   9           HA       MET   9 -12.551  -6.308   0.596
    3    HB2  MET   9           HB2      MET   9 -14.776  -8.177   1.400
    4    HB3  MET   9           HB3      MET   9 -15.052  -6.444   1.215
    5    HG2  MET   9           HG2      MET   9 -14.153  -6.570  -1.098
    6    HG3  MET   9           HG3      MET   9 -13.961  -8.312  -0.909
    7    HE2  MET   9           HE1      MET   9 -16.523  -5.552  -2.111
    8    HE1  MET   9           HE2      MET   9 -16.195  -5.395  -0.388
    9    HE3  MET   9           HE3      MET   9 -17.806  -5.854  -0.933

  No H/Q in entry =           9
  In of MODEL   90
    1    H    GLY  10           H        GLY  10 -13.241  -8.193   3.520
    2    HA3  GLY  10           HA2      GLY  10 -13.781  -6.004   5.236
    3    HA2  GLY  10           HA3      GLY  10 -13.231  -7.597   5.753

  No H/Q in entry =           3
  In of MODEL   90
    1    H    LEU  11           H        LEU  11 -10.780  -7.740   4.449
    2    HA   LEU  11           HA       LEU  11  -9.077  -6.319   6.214
    3    HB2  LEU  11           HB2      LEU  11  -8.529  -7.747   3.609
    4    HB3  LEU  11           HB3      LEU  11  -7.259  -7.051   4.614
    5    HG   LEU  11           HG       LEU  11  -9.280  -9.069   5.621
    6   HD13  LEU  11          HD11      LEU  11  -8.060 -10.315   4.063
    7   HD12  LEU  11          HD12      LEU  11  -7.134 -10.560   5.542
    8   HD11  LEU  11          HD13      LEU  11  -6.579  -9.400   4.337
    9   HD22  LEU  11          HD21      LEU  11  -8.429  -8.062   7.542
   10   HD21  LEU  11          HD22      LEU  11  -6.884  -7.672   6.786
   11   HD23  LEU  11          HD23      LEU  11  -7.224  -9.326   7.294

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  12           H        ILE  12  -9.960  -5.766   2.820
    2    HA   ILE  12           HA       ILE  12  -8.250  -3.548   2.401
    3    HB   ILE  12           HB       ILE  12 -10.902  -4.201   1.093
    4   HG12  ILE  12          HG12      ILE  12  -8.886  -5.871   1.025
    5   HG13  ILE  12          HG13      ILE  12  -9.723  -5.496  -0.467
    6   HG23  ILE  12          HG21      ILE  12 -10.295  -1.875   0.672
    7   HG22  ILE  12          HG22      ILE  12  -9.981  -2.802  -0.790
    8   HG21  ILE  12          HG23      ILE  12  -8.675  -2.353   0.269
    9   HD13  ILE  12          HD11      ILE  12  -7.973  -3.954  -1.104
   10   HD12  ILE  12          HD12      ILE  12  -7.216  -5.474  -0.632
   11   HD11  ILE  12          HD13      ILE  12  -7.202  -4.112   0.464

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  13           H        ILE  13 -11.618  -3.792   3.478
    2    HA   ILE  13           HA       ILE  13 -12.061  -1.002   3.745
    3    HB   ILE  13           HB       ILE  13 -13.288  -3.420   5.089
    4   HG12  ILE  13          HG12      ILE  13 -13.501  -2.804   2.551
    5   HG13  ILE  13          HG13      ILE  13 -14.913  -3.326   3.445
    6   HG21  ILE  13          HG21      ILE  13 -13.957  -0.491   5.396
    7   HG23  ILE  13          HG22      ILE  13 -13.730  -1.690   6.662
    8   HG22  ILE  13          HG23      ILE  13 -15.175  -1.736   5.657
    9   HD12  ILE  13          HD11      ILE  13 -15.215  -1.233   1.994
   10   HD11  ILE  13          HD12      ILE  13 -14.187  -0.428   3.163
   11   HD13  ILE  13          HD13      ILE  13 -15.718  -1.098   3.682

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ASN  14           H        ASN  14 -10.976  -3.499   6.026
    2    HA   ASN  14           HA       ASN  14 -10.776  -1.861   8.312
    3    HB2  ASN  14           HB2      ASN  14 -10.538  -4.470   7.992
    4    HB3  ASN  14           HB3      ASN  14  -8.826  -4.094   7.843
    5   HD21  ASN  14          HD21      ASN  14  -9.482  -5.614  10.016
    6   HD22  ASN  14          HD22      ASN  14  -9.456  -4.693  11.440

  No H/Q in entry =           6
  In of MODEL   90
    1    H    SER  15           H        SER  15  -8.367  -2.700   5.832
    2    HA   SER  15           HA       SER  15  -6.220  -1.220   6.914
    3    HB2  SER  15           HB2      SER  15  -5.191  -1.442   4.761
    4    HB3  SER  15           HB3      SER  15  -6.156  -2.897   4.982
    5    HG   SER  15           HG       SER  15  -7.833  -1.807   3.806

  No H/Q in entry =           5
  In of MODEL   90
    1    H    GLY  16           H        GLY  16  -8.806  -0.339   4.654
    2    HA3  GLY  16           HA2      GLY  16  -7.930   2.297   4.105
    3    HA2  GLY  16           HA3      GLY  16  -9.583   1.711   3.936

  No H/Q in entry =           3
  In of MODEL   90
    1    H    GLN  17           H        GLN  17 -10.143   0.990   6.583
    2    HA   GLN  17           HA       GLN  17 -10.842   3.499   7.719
    3    HB2  GLN  17           HB2      GLN  17 -12.107   1.453   8.214
    4    HB3  GLN  17           HB3      GLN  17 -10.702   0.773   9.035
    5    HG2  GLN  17           HG2      GLN  17 -10.759   2.561  10.696
    6    HG3  GLN  17           HG3      GLN  17 -12.084   3.347   9.842
    7   HE21  GLN  17          HE21      GLN  17 -12.394   2.534  12.557
    8   HE22  GLN  17          HE22      GLN  17 -13.508   1.253  12.612

  No H/Q in entry =           8
  In of MODEL   90
    1    H    ALA  18           H        ALA  18  -8.228   1.204   8.352
    2    HA   ALA  18           HA       ALA  18  -7.136   2.416  10.628
    3    HB2  ALA  18           HB1      ALA  18  -6.530   0.196   9.264
    4    HB3  ALA  18           HB2      ALA  18  -5.369   0.974  10.340
    5    HB1  ALA  18           HB3      ALA  18  -5.282   1.251   8.600

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ARG  19           H        ARG  19  -6.345   2.934   7.183
    2    HA   ARG  19           HA       ARG  19  -4.439   4.972   7.620
    3    HB2  ARG  19           HB2      ARG  19  -4.761   3.832   5.424
    4    HB3  ARG  19           HB3      ARG  19  -6.299   4.680   5.239
    5    HG2  ARG  19           HG2      ARG  19  -5.161   6.847   5.312
    6    HG3  ARG  19           HG3      ARG  19  -3.617   6.054   5.624
    7    HD2  ARG  19           HD2      ARG  19  -3.727   6.644   3.280
    8    HD3  ARG  19           HD3      ARG  19  -3.821   4.884   3.426
    9    HE   ARG  19           HE       ARG  19  -6.451   5.805   3.405
   10   HH21  ARG  19          HH11      ARG  19  -7.635   5.966   1.481
   11   HH22  ARG  19          HH12      ARG  19  -6.806   6.039  -0.035
   12   HH11  ARG  19          HH21      ARG  19  -3.665   5.855   1.385
   13   HH12  ARG  19          HH22      ARG  19  -4.556   5.974  -0.089

  No H/Q in entry =          13
  In of MODEL   90
    1    H    SER  20           H        SER  20  -7.934   5.103   7.003
    2    HA   SER  20           HA       SER  20  -8.279   7.860   6.951
    3    HB2  SER  20           HB2      SER  20 -10.010   5.980   6.579
    4    HB3  SER  20           HB3      SER  20 -10.238   6.036   8.325
    5    HG   SER  20           HG       SER  20 -10.282   8.504   7.638

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LEU  21           H        LEU  21  -8.302   5.679   9.756
    2    HA   LEU  21           HA       LEU  21  -8.745   7.677  11.718
    3    HB2  LEU  21           HB2      LEU  21  -7.404   4.971  11.887
    4    HB3  LEU  21           HB3      LEU  21  -7.716   5.990  13.288
    5    HG   LEU  21           HG       LEU  21  -9.876   5.091  11.357
    6   HD13  LEU  21          HD11      LEU  21  -8.920   3.131  12.450
    7   HD12  LEU  21          HD12      LEU  21 -10.500   3.477  13.154
    8   HD11  LEU  21          HD13      LEU  21  -9.030   3.921  14.024
    9   HD23  LEU  21          HD21      LEU  21 -11.227   5.612  13.574
   10   HD22  LEU  21          HD22      LEU  21 -10.775   6.943  12.515
   11   HD21  LEU  21          HD23      LEU  21  -9.836   6.619  13.964

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ALA  22           H        ALA  22  -5.790   6.292  10.326
    2    HA   ALA  22           HA       ALA  22  -3.914   7.600  11.957
    3    HB2  ALA  22           HB1      ALA  22  -3.496   5.743  10.269
    4    HB1  ALA  22           HB2      ALA  22  -2.296   7.035  10.310
    5    HB3  ALA  22           HB3      ALA  22  -3.507   6.995   9.027

  No H/Q in entry =           5
  In of MODEL   90
    1    H    TYR  23           H        TYR  23  -5.211   8.619   8.767
    2    HA   TYR  23           HA       TYR  23  -3.866  11.111   8.702
    3    HB2  TYR  23           HB2      TYR  23  -4.942  10.198   6.706
    4    HB3  TYR  23           HB3      TYR  23  -6.524  10.319   7.479
    5    HD1  TYR  23           HD1      TYR  23  -3.601  12.334   6.332
    6    HD2  TYR  23           HD2      TYR  23  -7.745  12.341   7.455
    7    HE1  TYR  23           HE1      TYR  23  -3.804  14.684   5.565
    8    HE2  TYR  23           HE2      TYR  23  -7.950  14.690   6.686
    9    HH   TYR  23           HH       TYR  23  -5.188  16.384   5.205

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ALA  24           H        ALA  24  -6.996  10.145  10.066
    2    HA   ALA  24           HA       ALA  24  -7.827  12.738  10.831
    3    HB1  ALA  24           HB1      ALA  24  -9.653  11.494  11.290
    4    HB2  ALA  24           HB2      ALA  24  -8.836  10.920  12.742
    5    HB3  ALA  24           HB3      ALA  24  -8.707  10.007  11.240

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ALA  25           H        ALA  25  -5.842  10.274  12.417
    2    HA   ALA  25           HA       ALA  25  -5.513  11.527  14.920
    3    HB2  ALA  25           HB1      ALA  25  -4.750   9.172  14.105
    4    HB3  ALA  25           HB2      ALA  25  -3.738  10.027  15.270
    5    HB1  ALA  25           HB3      ALA  25  -3.293  10.007  13.564

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LEU  26           H        LEU  26  -3.706  11.818  11.889
    2    HA   LEU  26           HA       LEU  26  -1.745  13.631  12.815
    3    HB2  LEU  26           HB2      LEU  26  -1.437  12.477  10.713
    4    HB3  LEU  26           HB3      LEU  26  -2.904  13.190  10.050
    5    HG   LEU  26           HG       LEU  26  -1.882  15.437  10.190
    6   HD12  LEU  26          HD11      LEU  26   0.654  15.447  10.617
    7   HD11  LEU  26          HD12      LEU  26   0.421  13.868  11.361
    8   HD13  LEU  26          HD13      LEU  26  -0.385  15.286  12.032
    9   HD21  LEU  26          HD21      LEU  26  -0.139  13.375   8.805
   10   HD23  LEU  26          HD22      LEU  26  -0.174  15.096   8.434
   11   HD22  LEU  26          HD23      LEU  26  -1.599  14.104   8.138

  No H/Q in entry =          11
  In of MODEL   90
    1    H    LYS  27           H        LYS  27  -4.918  14.125  11.320
    2    HA   LYS  27           HA       LYS  27  -4.851  16.913  11.121
    3    HB2  LYS  27           HB2      LYS  27  -6.595  15.442  10.127
    4    HB3  LYS  27           HB3      LYS  27  -7.261  15.189  11.739
    5    HG2  LYS  27           HG2      LYS  27  -7.683  17.597  11.972
    6    HG3  LYS  27           HG3      LYS  27  -6.965  17.890  10.384
    7    HD2  LYS  27           HD2      LYS  27  -8.698  16.462   9.340
    8    HD3  LYS  27           HD3      LYS  27  -9.421  16.186  10.926
    9    HE2  LYS  27           HE2      LYS  27  -9.855  18.599  11.165
   10    HE3  LYS  27           HE3      LYS  27  -9.104  18.897   9.594
   11    HZ3  LYS  27           HZ1      LYS  27 -11.480  18.781   9.340
   12    HZ2  LYS  27           HZ2      LYS  27 -11.539  17.265  10.110
   13    HZ1  LYS  27           HZ3      LYS  27 -10.785  17.425   8.593

  No H/Q in entry =          13
  In of MODEL   90
    1    H    GLN  28           H        GLN  28  -5.762  14.832  13.844
    2    HA   GLN  28           HA       GLN  28  -6.659  16.841  15.615
    3    HB2  GLN  28           HB2      GLN  28  -5.271  14.204  16.166
    4    HB3  GLN  28           HB3      GLN  28  -6.013  15.212  17.409
    5    HG2  GLN  28           HG2      GLN  28  -7.467  14.096  14.994
    6    HG3  GLN  28           HG3      GLN  28  -7.537  13.409  16.616
    7   HE21  GLN  28          HE21      GLN  28  -9.393  15.211  14.639
    8   HE22  GLN  28          HE22      GLN  28 -10.142  16.239  15.764

  No H/Q in entry =           8
  In of MODEL   90
    1    H    ALA  29           H        ALA  29  -3.442  15.529  14.943
    2    HA   ALA  29           HA       ALA  29  -2.007  16.921  16.928
    3    HB1  ALA  29           HB1      ALA  29  -0.074  16.219  15.819
    4    HB3  ALA  29           HB2      ALA  29  -0.820  16.347  14.226
    5    HB2  ALA  29           HB3      ALA  29  -1.254  15.017  15.299

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LYS  30           H        LYS  30  -2.843  17.803  13.593
    2    HA   LYS  30           HA       LYS  30  -1.418  20.234  13.499
    3    HB2  LYS  30           HB2      LYS  30  -3.947  19.376  12.078
    4    HB3  LYS  30           HB3      LYS  30  -3.101  20.885  11.737
    5    HG2  LYS  30           HG2      LYS  30  -1.038  19.578  11.235
    6    HG3  LYS  30           HG3      LYS  30  -1.955  18.088  11.476
    7    HD2  LYS  30           HD2      LYS  30  -3.506  18.738   9.673
    8    HD3  LYS  30           HD3      LYS  30  -2.611  20.240   9.434
    9    HE2  LYS  30           HE2      LYS  30  -0.585  18.933   8.865
   10    HE3  LYS  30           HE3      LYS  30  -1.498  17.436   9.073
   11    HZ2  LYS  30           HZ1      LYS  30  -1.304  18.305   6.732
   12    HZ1  LYS  30           HZ2      LYS  30  -2.341  19.575   7.194
   13    HZ3  LYS  30           HZ3      LYS  30  -2.878  17.962   7.264

  No H/Q in entry =          13
  In of MODEL   90
    1    H    GLN  31           H        GLN  31  -4.531  19.405  14.896
    2    HA   GLN  31           HA       GLN  31  -5.276  22.168  15.343
    3    HB2  GLN  31           HB2      GLN  31  -6.480  19.731  16.661
    4    HB3  GLN  31           HB3      GLN  31  -7.227  21.309  16.411
    5    HG2  GLN  31           HG2      GLN  31  -6.510  20.525  13.825
    6    HG3  GLN  31           HG3      GLN  31  -7.050  19.025  14.570
    7   HE21  GLN  31          HE21      GLN  31  -8.437  20.609  12.461
    8   HE22  GLN  31          HE22      GLN  31  -9.951  21.013  13.111

  No H/Q in entry =           8
  In of MODEL   90
    1    H    GLY  32           H        GLY  32  -2.985  20.223  16.675
    2    HA3  GLY  32           HA2      GLY  32  -1.590  20.674  18.484
    3    HA2  GLY  32           HA3      GLY  32  -2.711  21.926  19.002

  No H/Q in entry =           3
  In of MODEL   90
    1    H    ASP  33           H        ASP  33  -4.156  18.898  18.334
    2    HA   ASP  33           HA       ASP  33  -4.584  18.444  21.212
    3    HB2  ASP  33           HB2      ASP  33  -5.986  17.444  18.727
    4    HB3  ASP  33           HB3      ASP  33  -6.344  16.837  20.342

  No H/Q in entry =           4
  In of MODEL   90
    1    H    PHE  34           H        PHE  34  -2.424  17.576  21.528
    2    HA   PHE  34           HA       PHE  34  -1.436  15.318  20.132
    3    HB2  PHE  34           HB2      PHE  34  -0.824  16.298  22.929
    4    HB3  PHE  34           HB3      PHE  34   0.099  15.067  22.066
    5    HD1  PHE  34           HD1      PHE  34  -0.048  18.494  22.800
    6    HD2  PHE  34           HD2      PHE  34   0.775  15.784  19.569
    7    HE1  PHE  34           HE1      PHE  34   1.267  20.254  21.652
    8    HE2  PHE  34           HE2      PHE  34   2.085  17.547  18.426
    9    HZ   PHE  34           HZ       PHE  34   2.334  19.779  19.472

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ALA  35           H        ALA  35  -3.487  15.613  22.985
    2    HA   ALA  35           HA       ALA  35  -3.301  12.949  23.882
    3    HB3  ALA  35           HB1      ALA  35  -5.758  13.596  24.728
    4    HB1  ALA  35           HB2      ALA  35  -5.209  15.209  24.275
    5    HB2  ALA  35           HB3      ALA  35  -4.308  14.278  25.470

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ALA  36           H        ALA  36  -5.728  14.486  21.771
    2    HA   ALA  36           HA       ALA  36  -7.162  12.086  21.287
    3    HB1  ALA  36           HB1      ALA  36  -8.601  13.521  20.324
    4    HB3  ALA  36           HB2      ALA  36  -7.419  13.932  19.080
    5    HB2  ALA  36           HB3      ALA  36  -7.443  14.820  20.604

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ALA  37           H        ALA  37  -4.460  13.651  19.631
    2    HA   ALA  37           HA       ALA  37  -4.428  12.016  17.334
    3    HB3  ALA  37           HB1      ALA  37  -2.428  13.710  18.766
    4    HB2  ALA  37           HB2      ALA  37  -2.950  13.771  17.083
    5    HB1  ALA  37           HB3      ALA  37  -1.809  12.531  17.610

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LYS  38           H        LYS  38  -2.688  11.694  20.420
    2    HA   LYS  38           HA       LYS  38  -1.381   9.284  19.937
    3    HB2  LYS  38           HB2      LYS  38  -1.699  11.049  22.081
    4    HB3  LYS  38           HB3      LYS  38  -2.334   9.524  22.694
    5    HG2  LYS  38           HG2      LYS  38  -0.247   8.386  22.168
    6    HG3  LYS  38           HG3      LYS  38   0.378   9.827  21.357
    7    HD2  LYS  38           HD2      LYS  38   0.548  11.043  23.393
    8    HD3  LYS  38           HD3      LYS  38  -0.485   9.902  24.255
    9    HE2  LYS  38           HE2      LYS  38   1.864   9.566  24.885
   10    HE3  LYS  38           HE3      LYS  38   1.252   8.155  24.018
   11    HZ3  LYS  38           HZ1      LYS  38   2.565   8.563  22.243
   12    HZ2  LYS  38           HZ2      LYS  38   3.521   9.383  23.384
   13    HZ1  LYS  38           HZ3      LYS  38   2.454  10.252  22.388

  No H/Q in entry =          13
  In of MODEL   90
    1    H    ALA  39           H        ALA  39  -4.622   9.806  21.324
    2    HA   ALA  39           HA       ALA  39  -5.207   7.091  21.826
    3    HB3  ALA  39           HB1      ALA  39  -7.346   9.054  21.049
    4    HB2  ALA  39           HB2      ALA  39  -6.453   9.273  22.554
    5    HB1  ALA  39           HB3      ALA  39  -7.381   7.797  22.286

  No H/Q in entry =           5
  In of MODEL   90
    1    H    MET  40           H        MET  40  -5.762   9.109  18.977
    2    HA   MET  40           HA       MET  40  -7.247   7.190  17.509
    3    HB2  MET  40           HB2      MET  40  -5.613   9.572  16.612
    4    HB3  MET  40           HB3      MET  40  -6.642   8.621  15.537
    5    HG2  MET  40           HG2      MET  40  -7.678   9.878  18.091
    6    HG3  MET  40           HG3      MET  40  -7.722  10.714  16.540
    7    HE3  MET  40           HE1      MET  40 -10.309   9.116  14.463
    8    HE2  MET  40           HE2      MET  40  -8.554   9.219  14.323
    9    HE1  MET  40           HE3      MET  40  -9.464  10.591  14.953

  No H/Q in entry =           9
  In of MODEL   90
    1    H    MET  41           H        MET  41  -3.751   7.899  17.648
    2    HA   MET  41           HA       MET  41  -2.997   6.138  15.551
    3    HB2  MET  41           HB2      MET  41  -1.386   6.792  18.032
    4    HB3  MET  41           HB3      MET  41  -0.767   6.139  16.519
    5    HG2  MET  41           HG2      MET  41  -1.901   8.331  15.510
    6    HG3  MET  41           HG3      MET  41  -1.668   8.917  17.156
    7    HE2  MET  41           HE1      MET  41   1.231   6.795  17.531
    8    HE1  MET  41           HE2      MET  41   0.449   8.095  18.426
    9    HE3  MET  41           HE3      MET  41   2.077   8.326  17.791

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ASP  42           H        ASP  42  -3.402   5.668  19.035
    2    HA   ASP  42           HA       ASP  42  -2.387   3.066  19.200
    3    HB2  ASP  42           HB2      ASP  42  -3.256   4.832  21.019
    4    HB3  ASP  42           HB3      ASP  42  -4.690   3.818  20.939

  No H/Q in entry =           4
  In of MODEL   90
    1    H    GLN  43           H        GLN  43  -5.709   4.195  18.684
    2    HA   GLN  43           HA       GLN  43  -6.872   1.617  18.483
    3    HB2  GLN  43           HB2      GLN  43  -7.769   4.276  17.350
    4    HB3  GLN  43           HB3      GLN  43  -8.743   2.804  17.323
    5    HG2  GLN  43           HG2      GLN  43  -8.463   2.681  19.832
    6    HG3  GLN  43           HG3      GLN  43  -7.726   4.280  19.764
    7   HE21  GLN  43          HE21      GLN  43  -9.912   4.376  21.254
    8   HE22  GLN  43          HE22      GLN  43 -11.264   4.962  20.416

  No H/Q in entry =           8
  In of MODEL   90
    1    H    SER  44           H        SER  44  -5.503   3.821  16.078
    2    HA   SER  44           HA       SER  44  -6.204   2.342  13.785
    3    HB2  SER  44           HB2      SER  44  -4.932   4.716  14.236
    4    HB3  SER  44           HB3      SER  44  -3.583   3.710  13.712
    5    HG   SER  44           HG       SER  44  -4.679   4.691  11.944

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ARG  45           H        ARG  45  -3.338   2.207  15.880
    2    HA   ARG  45           HA       ARG  45  -1.866   0.242  14.505
    3    HB2  ARG  45           HB2      ARG  45  -1.022   1.656  16.378
    4    HB3  ARG  45           HB3      ARG  45  -2.026   0.733  17.493
    5    HG2  ARG  45           HG2      ARG  45  -0.807  -1.335  16.856
    6    HG3  ARG  45           HG3      ARG  45   0.221  -0.387  15.783
    7    HD2  ARG  45           HD2      ARG  45   0.956   0.988  17.743
    8    HD3  ARG  45           HD3      ARG  45   0.020  -0.081  18.812
    9    HE   ARG  45           HE       ARG  45   1.715  -1.689  17.239
   10   HH21  ARG  45          HH11      ARG  45   3.605  -2.526  18.086
   11   HH22  ARG  45          HH12      ARG  45   4.377  -1.747  19.421
   12   HH11  ARG  45          HH21      ARG  45   2.025   0.775  19.631
   13   HH12  ARG  45          HH22      ARG  45   3.482   0.125  20.293

  No H/Q in entry =          13
  In of MODEL   90
    1    H    MET  46           H        MET  46  -4.278  -0.061  17.093
    2    HA   MET  46           HA       MET  46  -4.134  -2.861  17.399
    3    HB2  MET  46           HB2      MET  46  -6.287  -0.835  17.992
    4    HB3  MET  46           HB3      MET  46  -6.516  -2.554  18.324
    5    HG2  MET  46           HG2      MET  46  -4.531  -2.575  19.752
    6    HG3  MET  46           HG3      MET  46  -4.209  -0.891  19.374
    7    HE1  MET  46           HE1      MET  46  -6.387  -3.494  20.800
    8    HE3  MET  46           HE2      MET  46  -7.839  -2.643  20.285
    9    HE2  MET  46           HE3      MET  46  -7.444  -2.736  21.998

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ALA  47           H        ALA  47  -6.127  -0.828  15.295
    2    HA   ALA  47           HA       ALA  47  -7.756  -2.865  14.220
    3    HB3  ALA  47           HB1      ALA  47  -8.416  -0.622  13.802
    4    HB1  ALA  47           HB2      ALA  47  -7.924  -1.259  12.232
    5    HB2  ALA  47           HB3      ALA  47  -6.839  -0.200  13.135

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LEU  48           H        LEU  48  -4.621  -1.582  13.186
    2    HA   LEU  48           HA       LEU  48  -4.342  -3.174  10.846
    3    HB2  LEU  48           HB2      LEU  48  -2.283  -1.914  12.665
    4    HB3  LEU  48           HB3      LEU  48  -1.912  -2.637  11.100
    5    HG   LEU  48           HG       LEU  48  -3.918  -0.402  11.480
    6   HD13  LEU  48          HD11      LEU  48  -1.792   0.455  12.157
    7   HD12  LEU  48          HD12      LEU  48  -2.054   1.012  10.504
    8   HD11  LEU  48          HD13      LEU  48  -0.970  -0.344  10.817
    9   HD22  LEU  48          HD21      LEU  48  -4.387  -1.382   9.401
   10   HD21  LEU  48          HD22      LEU  48  -2.707  -1.831   9.114
   11   HD23  LEU  48          HD23      LEU  48  -3.210  -0.148   8.953

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ASN  49           H        ASN  49  -3.317  -3.581  14.197
    2    HA   ASN  49           HA       ASN  49  -1.734  -5.859  13.874
    3    HB2  ASN  49           HB2      ASN  49  -1.773  -4.511  15.922
    4    HB3  ASN  49           HB3      ASN  49  -3.427  -5.012  16.241
    5   HD21  ASN  49          HD21      ASN  49  -2.784  -6.018  18.269
    6   HD22  ASN  49          HD22      ASN  49  -1.921  -7.478  18.290

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLU  50           H        GLU  50  -5.203  -5.551  14.527
    2    HA   GLU  50           HA       GLU  50  -5.742  -8.346  14.632
    3    HB2  GLU  50           HB2      GLU  50  -7.317  -6.644  15.500
    4    HB3  GLU  50           HB3      GLU  50  -7.596  -6.076  13.852
    5    HG2  GLU  50           HG2      GLU  50  -8.479  -8.263  13.209
    6    HG3  GLU  50           HG3      GLU  50  -8.112  -8.911  14.804

  No H/Q in entry =           6
  In of MODEL   90
    1    H    ALA  51           H        ALA  51  -5.773  -5.946  12.037
    2    HA   ALA  51           HA       ALA  51  -6.765  -7.663  10.008
    3    HB2  ALA  51           HB1      ALA  51  -6.520  -5.852   8.641
    4    HB1  ALA  51           HB2      ALA  51  -4.880  -5.520   9.199
    5    HB3  ALA  51           HB3      ALA  51  -6.263  -4.995  10.160

  No H/Q in entry =           5
  In of MODEL   90
    1    H    HIS  52           H        HIS  52  -3.471  -6.790  11.010
    2    HA   HIS  52           HA       HIS  52  -2.076  -8.292   9.068
    3    HB2  HIS  52           HB2      HIS  52  -1.050  -6.563  10.536
    4    HB3  HIS  52           HB3      HIS  52  -1.206  -7.669  11.900
    5    HD1  HIS  52           HD1      HIS  52   0.253  -9.861  11.832
    6    HD2  HIS  52           HD2      HIS  52   1.067  -7.153   8.770
    7    HE1  HIS  52           HE1      HIS  52   2.449 -10.586  10.800
    8    HE2  HIS  52           HE2      HIS  52   2.959  -8.944   8.931

  No H/Q in entry =           8
  In of MODEL   90
    1    H    LEU  53           H        LEU  53  -3.315  -9.159  12.273
    2    HA   LEU  53           HA       LEU  53  -2.145 -11.716  12.472
    3    HB2  LEU  53           HB2      LEU  53  -4.624 -10.508  13.674
    4    HB3  LEU  53           HB3      LEU  53  -4.185 -12.188  13.966
    5    HG   LEU  53           HG       LEU  53  -2.257  -9.897  14.452
    6   HD12  LEU  53          HD11      LEU  53  -2.879 -10.313  16.898
    7   HD11  LEU  53          HD12      LEU  53  -4.293 -11.171  16.289
    8   HD13  LEU  53          HD13      LEU  53  -4.079  -9.460  15.933
    9   HD23  LEU  53          HD21      LEU  53  -1.408 -11.711  16.141
   10   HD22  LEU  53          HD22      LEU  53  -1.012 -11.897  14.436
   11   HD21  LEU  53          HD23      LEU  53  -2.311 -12.842  15.140

  No H/Q in entry =          11
  In of MODEL   90
    1    H    VAL  54           H        VAL  54  -5.238 -10.651  11.093
    2    HA   VAL  54           HA       VAL  54  -6.177 -13.235  10.399
    3    HB   VAL  54           HB       VAL  54  -6.787 -10.494   9.263
    4   HG12  VAL  54          HG11      VAL  54  -8.899 -11.848   8.439
    5   HG11  VAL  54          HG12      VAL  54  -7.803 -13.227   8.516
    6   HG13  VAL  54          HG13      VAL  54  -7.423 -11.855   7.477
    7   HG22  VAL  54          HG21      VAL  54  -7.706 -10.523  11.410
    8   HG21  VAL  54          HG22      VAL  54  -7.979 -12.264  11.388
    9   HG23  VAL  54          HG23      VAL  54  -9.043 -11.194  10.476

  No H/Q in entry =           9
  In of MODEL   90
    1    H    GLN  55           H        GLN  55  -4.268 -10.804   8.622
    2    HA   GLN  55           HA       GLN  55  -4.141 -12.268   6.204
    3    HB2  GLN  55           HB2      GLN  55  -3.510 -10.011   6.019
    4    HB3  GLN  55           HB3      GLN  55  -2.408 -10.101   7.390
    5    HG2  GLN  55           HG2      GLN  55  -0.693 -10.966   6.123
    6    HG3  GLN  55           HG3      GLN  55  -1.773 -11.928   5.122
    7   HE21  GLN  55          HE21      GLN  55  -1.770 -11.236   3.001
    8   HE22  GLN  55          HE22      GLN  55  -1.551  -9.634   2.493

  No H/Q in entry =           8
  In of MODEL   90
    1    H    THR  56           H        THR  56  -2.051 -12.273   9.097
    2    HA   THR  56           HA       THR  56   0.014 -13.895   8.190
    3    HB   THR  56           HB       THR  56  -1.300 -13.905  10.920
    4    HG1  THR  56           HG1      THR  56   0.640 -12.360   9.636
    5   HG22  THR  56          HG21      THR  56   0.951 -14.770  11.650
    6   HG21  THR  56          HG22      THR  56   1.344 -15.009   9.947
    7   HG23  THR  56          HG23      THR  56   0.018 -15.911  10.682

  No H/Q in entry =           7
  In of MODEL   90
    1    H    LYS  57           H        LYS  57  -3.126 -14.896   9.535
    2    HA   LYS  57           HA       LYS  57  -2.712 -17.697   9.290
    3    HB2  LYS  57           HB2      LYS  57  -4.525 -16.582  10.625
    4    HB3  LYS  57           HB3      LYS  57  -5.304 -16.127   9.117
    5    HG2  LYS  57           HG2      LYS  57  -5.698 -18.422   8.529
    6    HG3  LYS  57           HG3      LYS  57  -4.687 -18.998   9.852
    7    HD2  LYS  57           HD2      LYS  57  -7.298 -18.998  10.135
    8    HD3  LYS  57           HD3      LYS  57  -6.287 -18.474  11.480
    9    HE2  LYS  57           HE2      LYS  57  -6.670 -16.147  10.962
   10    HE3  LYS  57           HE3      LYS  57  -7.453 -16.546   9.436
   11    HZ3  LYS  57           HZ1      LYS  57  -9.372 -16.750  10.480
   12    HZ2  LYS  57           HZ2      LYS  57  -8.631 -16.269  11.931
   13    HZ1  LYS  57           HZ3      LYS  57  -8.731 -17.918  11.533

  No H/Q in entry =          13
  In of MODEL   90
    1    H    LEU  58           H        LEU  58  -4.002 -15.237   7.108
    2    HA   LEU  58           HA       LEU  58  -4.815 -17.052   5.097
    3    HB2  LEU  58           HB2      LEU  58  -4.172 -14.111   4.966
    4    HB3  LEU  58           HB3      LEU  58  -4.839 -15.039   3.622
    5    HG   LEU  58           HG       LEU  58  -6.132 -14.845   6.363
    6   HD11  LEU  58          HD11      LEU  58  -6.398 -13.193   3.870
    7   HD13  LEU  58          HD12      LEU  58  -6.392 -12.687   5.560
    8   HD12  LEU  58          HD13      LEU  58  -7.820 -13.463   4.879
    9   HD22  LEU  58          HD21      LEU  58  -7.113 -16.742   5.487
   10   HD21  LEU  58          HD22      LEU  58  -6.758 -16.294   3.818
   11   HD23  LEU  58          HD23      LEU  58  -8.118 -15.552   4.662

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  59           H        ILE  59  -1.670 -15.879   5.976
    2    HA   ILE  59           HA       ILE  59  -0.566 -16.619   3.345
    3    HB   ILE  59           HB       ILE  59   0.219 -14.564   4.923
    4   HG12  ILE  59          HG12      ILE  59   2.280 -16.245   3.480
    5   HG13  ILE  59          HG13      ILE  59   1.114 -15.256   2.639
    6   HG23  ILE  59          HG21      ILE  59   2.057 -15.074   6.315
    7   HG22  ILE  59          HG22      ILE  59   2.277 -16.662   5.615
    8   HG21  ILE  59          HG23      ILE  59   0.919 -16.345   6.694
    9   HD13  ILE  59          HD11      ILE  59   3.098 -13.929   2.870
   10   HD12  ILE  59          HD12      ILE  59   3.221 -14.324   4.583
   11   HD11  ILE  59          HD13      ILE  59   1.918 -13.285   4.008

  No H/Q in entry =          11
  In of MODEL   90
    1    H    GLU  60           H        GLU  60  -0.609 -17.726   6.712
    2    HA   GLU  60           HA       GLU  60   1.399 -19.728   6.459
    3    HB2  GLU  60           HB2      GLU  60   0.628 -18.932   8.643
    4    HB3  GLU  60           HB3      GLU  60  -0.980 -19.582   8.330
    5    HG2  GLU  60           HG2      GLU  60  -0.039 -21.862   8.199
    6    HG3  GLU  60           HG3      GLU  60   1.572 -21.214   8.500

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLY  61           H        GLY  61  -2.110 -19.783   5.952
    2    HA3  GLY  61           HA2      GLY  61  -1.890 -22.579   4.994
    3    HA2  GLY  61           HA3      GLY  61  -3.370 -21.825   5.579

  No H/Q in entry =           3
  In of MODEL   90
    1    H    ASP  62           H        ASP  62  -1.109 -20.272   3.390
    2    HA   ASP  62           HA       ASP  62  -3.142 -19.604   1.526
    3    HB2  ASP  62           HB2      ASP  62  -1.258 -18.729   0.183
    4    HB3  ASP  62           HB3      ASP  62  -1.175 -18.202   1.860

  No H/Q in entry =           4
  In of MODEL   90
    1    H    ALA  63           H        ALA  63  -3.295 -22.392   1.758
    2    HA   ALA  63           HA       ALA  63  -1.867 -23.822  -0.245
    3    HB2  ALA  63           HB1      ALA  63  -4.631 -24.457   0.773
    4    HB1  ALA  63           HB2      ALA  63  -3.152 -24.832   1.657
    5    HB3  ALA  63           HB3      ALA  63  -3.450 -25.575   0.085

  No H/Q in entry =           5
  In of MODEL   90
    1    H    GLY  64           H        GLY  64  -4.947 -22.085  -0.219
    2    HA3  GLY  64           HA2      GLY  64  -6.378 -21.427  -1.886
    3    HA2  GLY  64           HA3      GLY  64  -4.931 -21.254  -2.866

  No H/Q in entry =           3
  In of MODEL   90
    1    H    GLU  65           H        GLU  65  -5.313 -22.201  -4.795
    2    HA   GLU  65           HA       GLU  65  -7.218 -24.236  -5.197
    3    HB2  GLU  65           HB2      GLU  65  -4.925 -23.299  -6.917
    4    HB3  GLU  65           HB3      GLU  65  -6.126 -24.477  -7.448
    5    HG2  GLU  65           HG2      GLU  65  -7.924 -22.862  -7.055
    6    HG3  GLU  65           HG3      GLU  65  -6.760 -21.686  -6.450

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLY  66           H        GLY  66  -6.218 -26.094  -6.777
    2    HA3  GLY  66           HA2      GLY  66  -5.316 -28.132  -5.073
    3    HA2  GLY  66           HA3      GLY  66  -5.391 -28.211  -6.822

  No H/Q in entry =           3
  In of MODEL   90
    1    H    LYS  67           H        LYS  67  -3.562 -26.047  -7.275
    2    HA   LYS  67           HA       LYS  67  -1.107 -27.531  -7.087
    3    HB2  LYS  67           HB2      LYS  67  -1.833 -24.905  -8.374
    4    HB3  LYS  67           HB3      LYS  67  -0.219 -25.622  -8.459
    5    HG2  LYS  67           HG2      LYS  67  -1.182 -27.685  -9.416
    6    HG3  LYS  67           HG3      LYS  67  -2.791 -26.970  -9.340
    7    HD2  LYS  67           HD2      LYS  67  -2.102 -25.207 -10.903
    8    HD3  LYS  67           HD3      LYS  67  -0.468 -25.873 -10.950
    9    HE2  LYS  67           HE2      LYS  67  -1.499 -26.797 -12.865
   10    HE3  LYS  67           HE3      LYS  67  -1.604 -28.085 -11.667
   11    HZ3  LYS  67           HZ1      LYS  67  -3.825 -27.849 -11.468
   12    HZ2  LYS  67           HZ2      LYS  67  -3.686 -27.241 -13.048
   13    HZ1  LYS  67           HZ3      LYS  67  -3.799 -26.174 -11.731

  No H/Q in entry =          13
  In of MODEL   90
    1    H    MET  68           H        MET  68   0.884 -26.776  -6.379
    2    HA   MET  68           HA       MET  68   1.076 -25.979  -3.759
    3    HB2  MET  68           HB2      MET  68   3.066 -25.751  -6.013
    4    HB3  MET  68           HB3      MET  68   3.477 -25.455  -4.323
    5    HG2  MET  68           HG2      MET  68   3.011 -27.689  -3.699
    6    HG3  MET  68           HG3      MET  68   2.109 -28.005  -5.183
    7    HE3  MET  68           HE1      MET  68   5.306 -25.825  -5.606
    8    HE2  MET  68           HE2      MET  68   6.576 -26.976  -5.196
    9    HE1  MET  68           HE3      MET  68   5.387 -26.517  -3.979

  No H/Q in entry =           9
  In of MODEL   90
    1    H    LYS  69           H        LYS  69   0.041 -23.944  -6.175
    2    HA   LYS  69           HA       LYS  69   1.404 -21.551  -5.545
    3    HB2  LYS  69           HB2      LYS  69  -1.129 -22.110  -7.029
    4    HB3  LYS  69           HB3      LYS  69  -0.580 -20.458  -6.729
    5    HG2  LYS  69           HG2      LYS  69   1.454 -20.798  -7.898
    6    HG3  LYS  69           HG3      LYS  69   1.259 -22.552  -7.887
    7    HD2  LYS  69           HD2      LYS  69   0.730 -21.291 -10.087
    8    HD3  LYS  69           HD3      LYS  69  -0.437 -22.490  -9.527
    9    HE2  LYS  69           HE2      LYS  69  -1.893 -20.818  -8.653
   10    HE3  LYS  69           HE3      LYS  69  -0.654 -19.570  -8.780
   11    HZ1  LYS  69           HZ1      LYS  69  -1.752 -21.011 -11.125
   12    HZ3  LYS  69           HZ2      LYS  69  -0.782 -19.617 -11.123
   13    HZ2  LYS  69           HZ3      LYS  69  -2.384 -19.541 -10.563

  No H/Q in entry =          13
  In of MODEL   90
    1    H    VAL  70           H        VAL  70  -0.340 -19.531  -5.219
    2    HA   VAL  70           HA       VAL  70  -1.681 -20.009  -2.620
    3    HB   VAL  70           HB       VAL  70  -0.840 -17.796  -1.873
    4   HG12  VAL  70          HG11      VAL  70   1.530 -18.480  -1.551
    5   HG11  VAL  70          HG12      VAL  70   1.305 -19.748  -2.756
    6   HG13  VAL  70          HG13      VAL  70   0.407 -19.804  -1.240
    7   HG23  VAL  70          HG21      VAL  70   1.239 -17.004  -3.336
    8   HG22  VAL  70          HG22      VAL  70  -0.395 -16.496  -3.757
    9   HG21  VAL  70          HG23      VAL  70   0.364 -17.824  -4.632

  No H/Q in entry =           9
  In of MODEL   90
    1    H    SER  71           H        SER  71  -3.243 -18.302  -2.091
    2    HA   SER  71           HA       SER  71  -5.068 -17.783  -4.200
    3    HB2  SER  71           HB2      SER  71  -5.687 -17.944  -1.760
    4    HB3  SER  71           HB3      SER  71  -4.903 -16.389  -1.505
    5    HG   SER  71           HG       SER  71  -7.270 -17.024  -2.838

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LEU  72           H        LEU  72  -5.280 -16.102  -5.528
    2    HA   LEU  72           HA       LEU  72  -3.150 -14.314  -5.998
    3    HB2  LEU  72           HB2      LEU  72  -6.010 -14.330  -6.956
    4    HB3  LEU  72           HB3      LEU  72  -4.794 -13.191  -7.528
    5    HG   LEU  72           HG       LEU  72  -4.426 -16.202  -7.652
    6   HD11  LEU  72          HD11      LEU  72  -6.398 -15.277  -9.003
    7   HD13  LEU  72          HD12      LEU  72  -5.170 -16.151  -9.920
    8   HD12  LEU  72          HD13      LEU  72  -5.200 -14.388  -9.944
    9   HD22  LEU  72          HD21      LEU  72  -2.300 -15.227  -7.898
   10   HD21  LEU  72          HD22      LEU  72  -2.924 -13.811  -8.727
   11   HD23  LEU  72          HD23      LEU  72  -2.844 -15.356  -9.567

  No H/Q in entry =          11
  In of MODEL   90
    1    H    VAL  73           H        VAL  73  -6.246 -13.924  -4.382
    2    HA   VAL  73           HA       VAL  73  -6.262 -11.153  -4.028
    3    HB   VAL  73           HB       VAL  73  -8.013 -11.484  -2.501
    4   HG13  VAL  73          HG11      VAL  73  -9.434 -13.019  -3.639
    5   HG12  VAL  73          HG12      VAL  73  -8.074 -14.024  -4.139
    6   HG11  VAL  73          HG13      VAL  73  -8.307 -12.433  -4.864
    7   HG23  VAL  73          HG21      VAL  73  -8.342 -13.809  -1.467
    8   HG22  VAL  73          HG22      VAL  73  -6.998 -12.858  -0.835
    9   HG21  VAL  73          HG23      VAL  73  -6.694 -14.159  -1.985

  No H/Q in entry =           9
  In of MODEL   90
    1    H    LEU  74           H        LEU  74  -4.358 -13.544  -2.438
    2    HA   LEU  74           HA       LEU  74  -3.946 -12.410   0.088
    3    HB2  LEU  74           HB2      LEU  74  -3.186 -14.637  -0.417
    4    HB3  LEU  74           HB3      LEU  74  -2.113 -14.031  -1.676
    5    HG   LEU  74           HG       LEU  74  -0.812 -12.799   0.027
    6   HD12  LEU  74          HD11      LEU  74  -1.337 -13.541   2.459
    7   HD11  LEU  74          HD12      LEU  74  -2.933 -13.963   1.835
    8   HD13  LEU  74          HD13      LEU  74  -2.362 -12.296   1.745
    9   HD23  LEU  74          HD21      LEU  74  -1.057 -15.554   1.116
   10   HD22  LEU  74          HD22      LEU  74   0.360 -14.647   0.637
   11   HD21  LEU  74          HD23      LEU  74  -0.650 -15.377  -0.589

  No H/Q in entry =          11
  In of MODEL   90
    1    H    VAL  75           H        VAL  75  -2.038 -12.034  -2.860
    2    HA   VAL  75           HA       VAL  75  -0.223 -10.131  -1.839
    3    HB   VAL  75           HB       VAL  75  -1.171 -10.605  -4.667
    4   HG13  VAL  75          HG11      VAL  75  -0.293  -8.314  -4.478
    5   HG12  VAL  75          HG12      VAL  75   0.910  -9.325  -5.264
    6   HG11  VAL  75          HG13      VAL  75   1.098  -8.899  -3.572
    7   HG23  VAL  75          HG21      VAL  75   1.348 -11.393  -3.157
    8   HG22  VAL  75          HG22      VAL  75   1.001 -11.771  -4.844
    9   HG21  VAL  75          HG23      VAL  75   0.022 -12.484  -3.561

  No H/Q in entry =           9
  In of MODEL   90
    1    H    GLU  76           H        GLU  76  -3.363  -9.747  -3.511
    2    HA   GLU  76           HA       GLU  76  -3.383  -6.932  -3.609
    3    HB2  GLU  76           HB2      GLU  76  -5.052  -8.351  -4.781
    4    HB3  GLU  76           HB3      GLU  76  -5.718  -8.844  -3.232
    5    HG2  GLU  76           HG2      GLU  76  -7.151  -7.117  -4.103
    6    HG3  GLU  76           HG3      GLU  76  -6.257  -6.406  -2.774

  No H/Q in entry =           6
  In of MODEL   90
    1    H    ALA  77           H        ALA  77  -4.529  -9.151  -1.077
    2    HA   ALA  77           HA       ALA  77  -5.472  -7.140   0.680
    3    HB1  ALA  77           HB1      ALA  77  -4.357  -9.843   1.459
    4    HB2  ALA  77           HB2      ALA  77  -5.993  -9.590   0.853
    5    HB3  ALA  77           HB3      ALA  77  -5.494  -8.855   2.374

  No H/Q in entry =           5
  In of MODEL   90
    1    H    GLN  78           H        GLN  78  -2.340  -8.725   0.327
    2    HA   GLN  78           HA       GLN  78  -1.079  -7.581   2.585
    3    HB2  GLN  78           HB2      GLN  78  -0.234  -9.530   1.229
    4    HB3  GLN  78           HB3      GLN  78   0.222  -8.387  -0.031
    5    HG2  GLN  78           HG2      GLN  78   1.686  -7.213   1.562
    6    HG3  GLN  78           HG3      GLN  78   1.234  -8.353   2.826
    7   HE21  GLN  78          HE21      GLN  78   3.964  -8.090   1.972
    8   HE22  GLN  78          HE22      GLN  78   4.414  -9.530   1.194

  No H/Q in entry =           8
  In of MODEL   90
    1    H    LEU  79           H        LEU  79  -1.419  -6.512  -0.763
    2    HA   LEU  79           HA       LEU  79   0.294  -4.305  -0.739
    3    HB2  LEU  79           HB2      LEU  79  -0.733  -5.097  -2.798
    4    HB3  LEU  79           HB3      LEU  79  -2.335  -4.687  -2.196
    5    HG   LEU  79           HG       LEU  79  -1.763  -2.307  -2.165
    6   HD13  LEU  79          HD11      LEU  79   0.478  -2.091  -1.642
    7   HD12  LEU  79          HD12      LEU  79   0.538  -1.802  -3.381
    8   HD11  LEU  79          HD13      LEU  79   0.971  -3.386  -2.735
    9   HD23  LEU  79          HD21      LEU  79  -1.115  -2.113  -4.714
   10   HD22  LEU  79          HD22      LEU  79  -2.652  -2.843  -4.263
   11   HD21  LEU  79          HD23      LEU  79  -1.290  -3.867  -4.703

  No H/Q in entry =          11
  In of MODEL   90
    1    H    HIS  80           H        HIS  80  -3.178  -4.427   0.072
    2    HA   HIS  80           HA       HIS  80  -3.339  -1.669   0.738
    3    HB2  HIS  80           HB2      HIS  80  -5.071  -4.057   1.046
    4    HB3  HIS  80           HB3      HIS  80  -5.380  -2.715   2.150
    5    HD1  HIS  80           HD1      HIS  80  -6.974  -1.057   1.238
    6    HD2  HIS  80           HD2      HIS  80  -4.790  -2.892  -1.803
    7    HE1  HIS  80           HE1      HIS  80  -7.791  -0.047  -0.944
    8    HE2  HIS  80           HE2      HIS  80  -6.466  -1.160  -2.806

  No H/Q in entry =           8
  In of MODEL   90
    1    H    LEU  81           H        LEU  81  -2.895  -4.572   2.730
    2    HA   LEU  81           HA       LEU  81  -2.877  -3.228   5.216
    3    HB2  LEU  81           HB2      LEU  81  -1.687  -5.859   4.338
    4    HB3  LEU  81           HB3      LEU  81  -1.662  -5.302   6.013
    5    HG   LEU  81           HG       LEU  81  -4.203  -5.521   4.373
    6   HD12  LEU  81          HD11      LEU  81  -4.539  -7.584   5.917
    7   HD11  LEU  81          HD12      LEU  81  -2.787  -7.536   6.110
    8   HD13  LEU  81          HD13      LEU  81  -3.491  -7.755   4.508
    9   HD23  LEU  81          HD21      LEU  81  -5.060  -5.716   6.870
   10   HD22  LEU  81          HD22      LEU  81  -4.712  -4.130   6.184
   11   HD21  LEU  81          HD23      LEU  81  -3.540  -4.907   7.248

  No H/Q in entry =          11
  In of MODEL   90
    1    H    MET  82           H        MET  82  -0.198  -4.163   3.056
    2    HA   MET  82           HA       MET  82   1.889  -3.298   4.750
    3    HB2  MET  82           HB2      MET  82   1.683  -3.633   1.756
    4    HB3  MET  82           HB3      MET  82   3.169  -3.082   2.527
    5    HG2  MET  82           HG2      MET  82   1.725  -5.654   3.242
    6    HG3  MET  82           HG3      MET  82   3.103  -5.561   2.148
    7    HE3  MET  82           HE1      MET  82   6.119  -4.867   4.145
    8    HE2  MET  82           HE2      MET  82   5.217  -3.487   3.525
    9    HE1  MET  82           HE3      MET  82   5.290  -4.977   2.588

  No H/Q in entry =           9
  In of MODEL   90
    1    H    THR  83           H        THR  83   0.100  -1.629   2.187
    2    HA   THR  83           HA       THR  83   1.543   0.800   2.282
    3    HB   THR  83           HB       THR  83  -0.616   1.755   1.288
    4    HG1  THR  83           HG1      THR  83  -2.283   0.480   1.172
    5   HG22  THR  83          HG21      THR  83  -0.361  -0.064  -0.714
    6   HG21  THR  83          HG22      THR  83   1.132  -0.377   0.169
    7   HG23  THR  83          HG23      THR  83   0.795   1.241  -0.445

  No H/Q in entry =           7
  In of MODEL   90
    1    H    SER  84           H        SER  84  -1.483  -0.194   3.869
    2    HA   SER  84           HA       SER  84  -1.952   2.241   5.215
    3    HB2  SER  84           HB2      SER  84  -2.826  -0.586   5.772
    4    HB3  SER  84           HB3      SER  84  -3.305   0.760   6.805
    5    HG   SER  84           HG       SER  84  -3.756   0.455   4.010

  No H/Q in entry =           5
  In of MODEL   90
    1    H    MET  85           H        MET  85  -0.287  -0.715   6.348
    2    HA   MET  85           HA       MET  85   0.234   0.202   8.956
    3    HB2  MET  85           HB2      MET  85   0.497  -2.144   8.285
    4    HB3  MET  85           HB3      MET  85   1.882  -1.702   7.285
    5    HG2  MET  85           HG2      MET  85   3.076  -0.882   9.278
    6    HG3  MET  85           HG3      MET  85   1.684  -1.284  10.283
    7    HE3  MET  85           HE1      MET  85   1.983  -4.796  11.185
    8    HE2  MET  85           HE2      MET  85   0.705  -3.783  10.517
    9    HE1  MET  85           HE3      MET  85   1.809  -3.121  11.719

  No H/Q in entry =           9
  In of MODEL   90
    1    H    LEU  86           H        LEU  86   2.185   0.434   6.013
    2    HA   LEU  86           HA       LEU  86   4.412   1.713   7.179
    3    HB2  LEU  86           HB2      LEU  86   4.215   0.635   4.869
    4    HB3  LEU  86           HB3      LEU  86   3.430   2.129   4.354
    5    HG   LEU  86           HG       LEU  86   5.471   3.346   5.345
    6   HD11  LEU  86          HD11      LEU  86   6.136   0.724   6.145
    7   HD13  LEU  86          HD12      LEU  86   7.159   2.155   6.248
    8   HD12  LEU  86          HD13      LEU  86   7.260   1.106   4.836
    9   HD23  LEU  86          HD21      LEU  86   6.173   1.575   2.995
   10   HD22  LEU  86          HD22      LEU  86   6.589   3.266   3.261
   11   HD21  LEU  86          HD23      LEU  86   4.932   2.822   2.855

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ALA  87           H        ALA  87   1.523   2.998   5.584
    2    HA   ALA  87           HA       ALA  87   2.155   5.719   5.673
    3    HB1  ALA  87           HB1      ALA  87  -0.174   4.124   5.120
    4    HB3  ALA  87           HB2      ALA  87   0.162   5.781   4.623
    5    HB2  ALA  87           HB3      ALA  87  -0.643   5.469   6.163

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ARG  88           H        ARG  88   0.427   3.739   8.054
    2    HA   ARG  88           HA       ARG  88  -0.064   5.794   9.900
    3    HB2  ARG  88           HB2      ARG  88  -1.035   3.455   9.960
    4    HB3  ARG  88           HB3      ARG  88   0.496   2.933  10.673
    5    HG2  ARG  88           HG2      ARG  88   0.041   5.012  12.292
    6    HG3  ARG  88           HG3      ARG  88  -1.628   4.711  11.829
    7    HD2  ARG  88           HD2      ARG  88  -1.766   2.862  13.073
    8    HD3  ARG  88           HD3      ARG  88  -0.183   2.259  12.548
    9    HE   ARG  88           HE       ARG  88  -0.709   3.527  15.001
   10   HH21  ARG  88          HH11      ARG  88   0.857   4.517  16.247
   11   HH22  ARG  88          HH12      ARG  88   2.385   4.923  15.550
   12   HH11  ARG  88          HH21      ARG  88   1.585   3.679  12.434
   13   HH12  ARG  88          HH22      ARG  88   2.805   4.433  13.402

  No H/Q in entry =          13
  In of MODEL   90
    1    H    GLU  89           H        GLU  89   2.703   3.537   9.687
    2    HA   GLU  89           HA       GLU  89   3.967   4.407  12.037
    3    HB2  GLU  89           HB2      GLU  89   4.604   2.381  10.694
    4    HB3  GLU  89           HB3      GLU  89   5.399   3.465   9.552
    5    HG2  GLU  89           HG2      GLU  89   6.888   4.290  11.303
    6    HG3  GLU  89           HG3      GLU  89   6.035   3.345  12.519

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LEU  90           H        LEU  90   4.313   5.563   8.712
    2    HA   LEU  90           HA       LEU  90   6.268   7.537   9.307
    3    HB2  LEU  90           HB2      LEU  90   4.267   7.234   7.071
    4    HB3  LEU  90           HB3      LEU  90   5.514   8.488   7.098
    5    HG   LEU  90           HG       LEU  90   6.148   5.543   7.432
    6   HD12  LEU  90          HD11      LEU  90   6.910   5.768   4.996
    7   HD11  LEU  90          HD12      LEU  90   5.913   7.222   4.944
    8   HD13  LEU  90          HD13      LEU  90   5.171   5.658   5.283
    9   HD22  LEU  90          HD21      LEU  90   8.057   6.667   8.124
   10   HD21  LEU  90          HD22      LEU  90   7.730   8.077   7.116
   11   HD23  LEU  90          HD23      LEU  90   8.373   6.604   6.391

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  91           H        ILE  91   2.730   7.599   9.143
    2    HA   ILE  91           HA       ILE  91   2.421  10.375   9.594
    3    HB   ILE  91           HB       ILE  91   0.598   8.022  10.127
    4   HG12  ILE  91          HG12      ILE  91   0.387  10.308   8.143
    5   HG13  ILE  91          HG13      ILE  91   1.230   8.803   7.773
    6   HG22  ILE  91          HG21      ILE  91  -1.108  10.103  10.185
    7   HG21  ILE  91          HG22      ILE  91   0.300  10.914  10.864
    8   HG23  ILE  91          HG23      ILE  91  -0.358   9.485  11.657
    9   HD13  ILE  91          HD11      ILE  91  -0.731   7.541   7.808
   10   HD12  ILE  91          HD12      ILE  91  -1.298   9.063   7.125
   11   HD11  ILE  91          HD13      ILE  91  -1.581   8.702   8.828

  No H/Q in entry =          11
  In of MODEL   90
    1    H    THR  92           H        THR  92   2.780   7.627  11.795
    2    HA   THR  92           HA       THR  92   2.343   9.005  14.218
    3    HB   THR  92           HB       THR  92   4.126   6.648  13.559
    4    HG1  THR  92           HG1      THR  92   2.148   5.916  13.450
    5   HG22  THR  92          HG21      THR  92   3.727   6.367  16.191
    6   HG21  THR  92          HG22      THR  92   3.684   8.127  16.119
    7   HG23  THR  92          HG23      THR  92   5.109   7.254  15.552

  No H/Q in entry =           7
  In of MODEL   90
    1    H    GLU  93           H        GLU  93   5.297   8.521  12.297
    2    HA   GLU  93           HA       GLU  93   7.061   9.926  14.003
    3    HB2  GLU  93           HB2      GLU  93   7.159   9.612  10.988
    4    HB3  GLU  93           HB3      GLU  93   8.501  10.125  12.009
    5    HG2  GLU  93           HG2      GLU  93   7.058   7.505  12.448
    6    HG3  GLU  93           HG3      GLU  93   8.448   7.641  11.379

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LEU  94           H        LEU  94   5.037  10.966  11.281
    2    HA   LEU  94           HA       LEU  94   5.874  13.661  11.186
    3    HB2  LEU  94           HB2      LEU  94   3.271  12.326  10.420
    4    HB3  LEU  94           HB3      LEU  94   3.551  14.051  10.180
    5    HG   LEU  94           HG       LEU  94   5.550  12.040   9.138
    6   HD11  LEU  94          HD11      LEU  94   2.820  12.623   8.064
    7   HD13  LEU  94          HD12      LEU  94   3.786  11.155   7.942
    8   HD12  LEU  94          HD13      LEU  94   4.142  12.532   6.900
    9   HD23  LEU  94          HD21      LEU  94   5.829  13.874   7.418
   10   HD22  LEU  94          HD22      LEU  94   6.242  14.361   9.062
   11   HD21  LEU  94          HD23      LEU  94   4.700  14.847   8.356

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  95           H        ILE  95   3.309  12.072  13.065
    2    HA   ILE  95           HA       ILE  95   2.287  14.433  14.256
    3    HB   ILE  95           HB       ILE  95   2.267  11.551  15.179
    4   HG12  ILE  95          HG12      ILE  95   0.072  13.350  14.120
    5   HG13  ILE  95          HG13      ILE  95   1.021  12.280  13.092
    6   HG21  ILE  95          HG21      ILE  95   1.007  14.037  16.376
    7   HG23  ILE  95          HG22      ILE  95   2.038  12.856  17.185
    8   HG22  ILE  95          HG23      ILE  95   0.401  12.414  16.702
    9   HD13  ILE  95          HD11      ILE  95   0.093  10.352  14.007
   10   HD12  ILE  95          HD12      ILE  95  -1.278  11.456  14.077
   11   HD11  ILE  95          HD13      ILE  95  -0.323  11.147  15.526

  No H/Q in entry =          11
  In of MODEL   90
    1    H    GLU  96           H        GLU  96   4.853  12.186  15.263
    2    HA   GLU  96           HA       GLU  96   5.409  13.377  17.758
    3    HB2  GLU  96           HB2      GLU  96   6.337  11.208  17.114
    4    HB3  GLU  96           HB3      GLU  96   7.285  11.972  15.839
    5    HG2  GLU  96           HG2      GLU  96   8.932  12.502  17.309
    6    HG3  GLU  96           HG3      GLU  96   7.789  13.327  18.359

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LEU  97           H        LEU  97   6.507  14.139  14.477
    2    HA   LEU  97           HA       LEU  97   8.411  16.115  15.199
    3    HB2  LEU  97           HB2      LEU  97   6.826  15.583  12.696
    4    HB3  LEU  97           HB3      LEU  97   7.860  17.004  12.823
    5    HG   LEU  97           HG       LEU  97   8.857  14.196  13.387
    6   HD12  LEU  97          HD11      LEU  97   9.867  14.380  11.075
    7   HD11  LEU  97          HD12      LEU  97   8.831  15.781  10.807
    8   HD13  LEU  97          HD13      LEU  97   8.114  14.197  11.097
    9   HD23  LEU  97          HD21      LEU  97  11.043  15.452  12.655
   10   HD22  LEU  97          HD22      LEU  97  10.418  15.728  14.281
   11   HD21  LEU  97          HD23      LEU  97  10.123  16.914  13.012

  No H/Q in entry =          11
  In of MODEL   90
    1    H    HIS  98           H        HIS  98   4.924  16.286  14.528
    2    HA   HIS  98           HA       HIS  98   4.653  19.089  14.663
    3    HB2  HIS  98           HB2      HIS  98   2.737  16.857  15.379
    4    HB3  HIS  98           HB3      HIS  98   2.287  18.562  15.433
    5    HD1  HIS  98           HD1      HIS  98   3.292  15.838  13.032
    6    HD2  HIS  98           HD2      HIS  98   1.956  19.785  12.904
    7    HE1  HIS  98           HE1      HIS  98   2.750  16.333  10.605
    8    HE2  HIS  98           HE2      HIS  98   1.940  18.731  10.507

  No H/Q in entry =           8
  In of MODEL   90
    1    H    GLU  99           H        GLU  99   4.749  16.598  17.161
    2    HA   GLU  99           HA       GLU  99   4.147  18.298  19.357
    3    HB2  GLU  99           HB2      GLU  99   4.033  15.817  19.453
    4    HB3  GLU  99           HB3      GLU  99   5.793  15.754  19.353
    5    HG2  GLU  99           HG2      GLU  99   5.984  17.044  21.428
    6    HG3  GLU  99           HG3      GLU  99   4.233  17.202  21.516

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LYS 100           H        LYS 100   7.199  17.337  17.807
    2    HA   LYS 100           HA       LYS 100   8.859  18.721  19.672
    3    HB2  LYS 100           HB2      LYS 100   9.362  17.792  16.835
    4    HB3  LYS 100           HB3      LYS 100  10.595  18.549  17.849
    5    HG2  LYS 100           HG2      LYS 100  10.192  16.802  19.588
    6    HG3  LYS 100           HG3      LYS 100   9.058  16.010  18.491
    7    HD2  LYS 100           HD2      LYS 100  10.857  15.710  16.832
    8    HD3  LYS 100           HD3      LYS 100  11.997  16.513  17.914
    9    HE2  LYS 100           HE2      LYS 100  11.575  14.761  19.630
   10    HE3  LYS 100           HE3      LYS 100  10.497  13.937  18.499
   11    HZ1  LYS 100           HZ1      LYS 100  13.327  14.578  17.858
   12    HZ3  LYS 100           HZ2      LYS 100  12.277  13.534  17.024
   13    HZ2  LYS 100           HZ3      LYS 100  12.853  13.109  18.565

  No H/Q in entry =          13
  In of MODEL   90
    1    H    LEU 101           H        LEU 101   7.189  19.665  16.708
    2    HA   LEU 101           HA       LEU 101   8.430  22.210  16.380
    3    HB2  LEU 101           HB2      LEU 101   5.827  21.003  15.481
    4    HB3  LEU 101           HB3      LEU 101   6.097  22.732  15.275
    5    HG   LEU 101           HG       LEU 101   8.117  20.695  14.318
    6   HD12  LEU 101          HD11      LEU 101   6.980  21.214  12.028
    7   HD11  LEU 101          HD12      LEU 101   5.580  21.658  13.002
    8   HD13  LEU 101          HD13      LEU 101   6.227  20.020  13.086
    9   HD21  LEU 101          HD21      LEU 101   7.521  23.614  13.761
   10   HD23  LEU 101          HD22      LEU 101   8.497  22.645  12.659
   11   HD22  LEU 101          HD23      LEU 101   9.034  22.896  14.319

  No H/Q in entry =          11
  In of MODEL   90
    1    H    LYS 102           H        LYS 102   6.869  21.087  18.988
    2    HA   LYS 102           HA       LYS 102   6.239  22.184  20.918
    3    HB2  LYS 102           HB2      LYS 102   7.547  24.161  19.801
    4    HB3  LYS 102           HB3      LYS 102   5.956  24.783  19.418
    5    HG2  LYS 102           HG2      LYS 102   7.318  24.512  22.076
    6    HG3  LYS 102           HG3      LYS 102   6.382  25.850  21.443
    7    HD2  LYS 102           HD2      LYS 102   5.107  23.226  22.315
    8    HD3  LYS 102           HD3      LYS 102   5.364  24.584  23.400
    9    HE2  LYS 102           HE2      LYS 102   3.088  24.206  21.900
   10    HE3  LYS 102           HE3      LYS 102   3.604  25.746  22.585
   11    HZ2  LYS 102           HZ1      LYS 102   3.086  25.860  20.203
   12    HZ1  LYS 102           HZ2      LYS 102   4.338  24.766  19.886
   13    HZ3  LYS 102           HZ3      LYS 102   4.693  26.292  20.531

  No H/Q in entry =          13
  In of MODEL   90
    1    H    ALA 103           H        ALA 103   4.630  23.745  18.144
    2    HA   ALA 103           HA       ALA 103   2.178  24.347  19.017
    3    HB1  ALA 103           HB1      ALA 103   1.281  23.516  16.770
    4    HB2  ALA 103           HB2      ALA 103   2.925  22.962  16.448
    5    HB3  ALA 103           HB3      ALA 103   2.607  24.677  16.714

  No H/Q in entry =           5
  In of MODEL   90
    1    H1   ALA   1           H3       ALA   1  10.430 -20.228  -6.242
    2    H2   ALA   1           H2       ALA   1   9.470 -20.422  -7.632
    3    H3   ALA   1           H1       ALA   1   9.017 -21.165  -6.172
    4    HA   ALA   1           HA       ALA   1  10.040 -22.985  -6.907
    5    HB1  ALA   1           HB1      ALA   1  10.150 -22.625  -9.182
    6    HB2  ALA   1           HB2      ALA   1  11.877 -22.494  -8.845
    7    HB3  ALA   1           HB3      ALA   1  10.896 -21.036  -9.000

  No H/Q in entry =           7
  In of MODEL   90
    1    H    GLU   2           H        GLU   2  12.313 -23.960  -6.956
    2    HA   GLU   2           HA       GLU   2  13.686 -23.896  -4.737
    3    HB2  GLU   2           HB2      GLU   2  15.055 -23.778  -7.430
    4    HB3  GLU   2           HB3      GLU   2  15.770 -24.398  -5.942
    5    HG2  GLU   2           HG2      GLU   2  14.732 -26.403  -6.189
    6    HG3  GLU   2           HG3      GLU   2  13.170 -25.639  -6.455

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLU   3           H        GLU   3  15.489 -22.050  -7.130
    2    HA   GLU   3           HA       GLU   3  16.652 -20.377  -5.164
    3    HB2  GLU   3           HB2      GLU   3  16.610 -20.372  -8.174
    4    HB3  GLU   3           HB3      GLU   3  17.366 -19.052  -7.283
    5    HG2  GLU   3           HG2      GLU   3  19.009 -20.446  -6.354
    6    HG3  GLU   3           HG3      GLU   3  18.047 -21.902  -6.580

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LEU   4           H        LEU   4  14.391 -19.502  -7.804
    2    HA   LEU   4           HA       LEU   4  13.952 -16.888  -7.193
    3    HB2  LEU   4           HB2      LEU   4  11.758 -18.837  -7.934
    4    HB3  LEU   4           HB3      LEU   4  11.704 -17.087  -8.132
    5    HG   LEU   4           HG       LEU   4  13.653 -18.972  -9.498
    6   HD13  LEU   4          HD11      LEU   4  12.361 -18.807 -11.413
    7   HD12  LEU   4          HD12      LEU   4  11.669 -17.255 -10.948
    8   HD11  LEU   4          HD13      LEU   4  11.095 -18.739 -10.190
    9   HD23  LEU   4          HD21      LEU   4  14.021 -16.730 -10.846
   10   HD22  LEU   4          HD22      LEU   4  14.871 -16.983  -9.323
   11   HD21  LEU   4          HD23      LEU   4  13.430 -15.970  -9.368

  No H/Q in entry =          11
  In of MODEL   90
    1    H    GLU   5           H        GLU   5  12.428 -19.656  -5.559
    2    HA   GLU   5           HA       GLU   5  10.761 -18.066  -3.863
    3    HB2  GLU   5           HB2      GLU   5  11.562 -20.924  -4.020
    4    HB3  GLU   5           HB3      GLU   5  10.896 -20.335  -2.496
    5    HG2  GLU   5           HG2      GLU   5   9.488 -19.550  -5.003
    6    HG3  GLU   5           HG3      GLU   5   9.320 -21.221  -4.464

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLU   6           H        GLU   6  13.888 -19.682  -3.407
    2    HA   GLU   6           HA       GLU   6  14.238 -18.831  -0.707
    3    HB2  GLU   6           HB2      GLU   6  15.443 -20.760  -1.728
    4    HB3  GLU   6           HB3      GLU   6  16.348 -19.623  -2.730
    5    HG2  GLU   6           HG2      GLU   6  17.717 -20.108  -0.815
    6    HG3  GLU   6           HG3      GLU   6  17.081 -18.479  -0.590

  No H/Q in entry =           6
  In of MODEL   90
    1    H    VAL   7           H        VAL   7  15.032 -17.511  -3.852
    2    HA   VAL   7           HA       VAL   7  16.738 -15.404  -2.979
    3    HB   VAL   7           HB       VAL   7  15.039 -15.747  -5.464
    4   HG11  VAL   7          HG11      VAL   7  16.953 -13.556  -4.642
    5   HG13  VAL   7          HG12      VAL   7  15.315 -13.395  -5.272
    6   HG12  VAL   7          HG13      VAL   7  16.624 -13.911  -6.337
    7   HG21  VAL   7          HG21      VAL   7  17.128 -17.227  -4.887
    8   HG23  VAL   7          HG22      VAL   7  18.050 -15.776  -5.280
    9   HG22  VAL   7          HG23      VAL   7  17.011 -16.514  -6.496

  No H/Q in entry =           9
  In of MODEL   90
    1    H    VAL   8           H        VAL   8  13.245 -15.635  -3.551
    2    HA   VAL   8           HA       VAL   8  12.607 -12.920  -3.081
    3    HB   VAL   8           HB       VAL   8  11.017 -15.471  -2.782
    4   HG11  VAL   8          HG11      VAL   8  10.205 -12.607  -2.231
    5   HG13  VAL   8          HG12      VAL   8  10.031 -14.007  -1.171
    6   HG12  VAL   8          HG13      VAL   8   9.030 -13.865  -2.615
    7   HG23  VAL   8          HG21      VAL   8   9.898 -13.664  -4.674
    8   HG22  VAL   8          HG22      VAL   8  10.762 -15.159  -5.016
    9   HG21  VAL   8          HG23      VAL   8  11.638 -13.634  -4.951

  No H/Q in entry =           9
  In of MODEL   90
    1    H    MET   9           H        MET   9  12.834 -15.730  -0.901
    2    HA   MET   9           HA       MET   9  12.022 -14.451   1.466
    3    HB2  MET   9           HB2      MET   9  13.908 -16.745   0.933
    4    HB3  MET   9           HB3      MET   9  13.605 -16.163   2.571
    5    HG2  MET   9           HG2      MET   9  11.177 -16.520   2.241
    6    HG3  MET   9           HG3      MET   9  11.498 -17.132   0.617
    7    HE2  MET   9           HE1      MET   9  11.064 -18.345   4.374
    8    HE1  MET   9           HE2      MET   9  12.405 -17.219   4.187
    9    HE3  MET   9           HE3      MET   9  12.725 -18.892   4.634

  No H/Q in entry =           9
  In of MODEL   90
    1    H    GLY  10           H        GLY  10  15.207 -14.708  -0.076
    2    HA3  GLY  10           HA2      GLY  10  16.672 -13.303   1.901
    3    HA2  GLY  10           HA3      GLY  10  17.141 -13.472   0.209

  No H/Q in entry =           3
  In of MODEL   90
    1    H    LEU  11           H        LEU  11  14.991 -12.228  -1.039
    2    HA   LEU  11           HA       LEU  11  15.702  -9.491  -0.871
    3    HB2  LEU  11           HB2      LEU  11  13.326 -10.876  -2.117
    4    HB3  LEU  11           HB3      LEU  11  13.624  -9.144  -2.274
    5    HG   LEU  11           HG       LEU  11  15.635 -11.272  -3.055
    6   HD13  LEU  11          HD11      LEU  11  13.892 -11.621  -4.583
    7   HD12  LEU  11          HD12      LEU  11  14.910 -10.449  -5.418
    8   HD11  LEU  11          HD13      LEU  11  13.438  -9.917  -4.606
    9   HD22  LEU  11          HD21      LEU  11  16.884  -9.321  -2.822
   10   HD21  LEU  11          HD22      LEU  11  15.521  -8.271  -3.206
   11   HD23  LEU  11          HD23      LEU  11  16.349  -9.147  -4.492

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  12           H        ILE  12  12.910 -11.290   0.383
    2    HA   ILE  12           HA       ILE  12  11.534  -9.054   1.438
    3    HB   ILE  12           HB       ILE  12  11.539 -11.937   2.386
    4   HG12  ILE  12          HG12      ILE  12  10.869 -11.302  -0.065
    5   HG13  ILE  12          HG13      ILE  12   9.823 -12.374   0.843
    6   HG23  ILE  12          HG21      ILE  12  10.595 -10.533   4.119
    7   HG22  ILE  12          HG22      ILE  12   9.257 -11.330   3.292
    8   HG21  ILE  12          HG23      ILE  12   9.633  -9.644   2.940
    9   HD13  ILE  12          HD11      ILE  12   8.324 -10.534   1.341
   10   HD12  ILE  12          HD12      ILE  12   8.612 -10.571  -0.398
   11   HD11  ILE  12          HD13      ILE  12   9.430  -9.389   0.602

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  13           H        ILE  13  13.900 -11.282   2.853
    2    HA   ILE  13           HA       ILE  13  13.934 -10.104   5.434
    3    HB   ILE  13           HB       ILE  13  15.981 -11.698   3.874
    4   HG12  ILE  13          HG12      ILE  13  13.685 -12.622   4.745
    5   HG13  ILE  13          HG13      ILE  13  15.148 -13.576   4.966
    6   HG21  ILE  13          HG21      ILE  13  16.117 -10.602   6.686
    7   HG23  ILE  13          HG22      ILE  13  17.339 -10.515   5.424
    8   HG22  ILE  13          HG23      ILE  13  17.011 -12.051   6.229
    9   HD12  ILE  13          HD11      ILE  13  13.593 -13.306   7.027
   10   HD11  ILE  13          HD12      ILE  13  14.190 -11.651   7.085
   11   HD13  ILE  13          HD13      ILE  13  15.311 -12.994   7.264

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ASN  14           H        ASN  14  15.905  -9.588   2.525
    2    HA   ASN  14           HA       ASN  14  17.661  -7.662   3.596
    3    HB2  ASN  14           HB2      ASN  14  17.639  -8.926   1.279
    4    HB3  ASN  14           HB3      ASN  14  16.760  -7.502   0.739
    5   HD21  ASN  14          HD21      ASN  14  19.203  -7.860  -0.435
    6   HD22  ASN  14          HD22      ASN  14  20.351  -6.786   0.198

  No H/Q in entry =           6
  In of MODEL   90
    1    H    SER  15           H        SER  15  14.561  -7.289   1.889
    2    HA   SER  15           HA       SER  15  14.470  -4.468   1.947
    3    HB2  SER  15           HB2      SER  15  12.141  -4.696   1.435
    4    HB3  SER  15           HB3      SER  15  12.928  -6.073   0.676
    5    HG   SER  15           HG       SER  15  12.362  -7.300   2.531

  No H/Q in entry =           5
  In of MODEL   90
    1    H    GLY  16           H        GLY  16  13.347  -6.921   4.244
    2    HA3  GLY  16           HA2      GLY  16  12.130  -5.164   6.097
    3    HA2  GLY  16           HA3      GLY  16  12.731  -6.777   6.461

  No H/Q in entry =           3
  In of MODEL   90
    1    H    GLN  17           H        GLN  17  15.448  -6.463   5.881
    2    HA   GLN  17           HA       GLN  17  16.402  -5.251   8.267
    3    HB2  GLN  17           HB2      GLN  17  17.647  -7.040   7.131
    4    HB3  GLN  17           HB3      GLN  17  17.913  -5.985   5.741
    5    HG2  GLN  17           HG2      GLN  17  19.191  -4.428   7.120
    6    HG3  GLN  17           HG3      GLN  17  18.861  -5.391   8.559
    7   HE21  GLN  17          HE21      GLN  17  21.547  -4.903   7.734
    8   HE22  GLN  17          HE22      GLN  17  22.222  -6.366   7.202

  No H/Q in entry =           8
  In of MODEL   90
    1    H    ALA  18           H        ALA  18  16.237  -4.170   4.907
    2    HA   ALA  18           HA       ALA  18  17.688  -1.787   5.142
    3    HB1  ALA  18           HB1      ALA  18  16.572  -2.993   3.069
    4    HB3  ALA  18           HB2      ALA  18  16.848  -1.251   3.056
    5    HB2  ALA  18           HB3      ALA  18  15.243  -1.886   3.417

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ARG  19           H        ARG  19  14.182  -2.351   5.522
    2    HA   ARG  19           HA       ARG  19  13.529   0.303   6.235
    3    HB2  ARG  19           HB2      ARG  19  11.839  -1.437   5.639
    4    HB3  ARG  19           HB3      ARG  19  12.168  -2.238   7.177
    5    HG2  ARG  19           HG2      ARG  19  11.465  -0.243   8.415
    6    HG3  ARG  19           HG3      ARG  19  11.228   0.636   6.905
    7    HD2  ARG  19           HD2      ARG  19   9.077  -0.146   7.714
    8    HD3  ARG  19           HD3      ARG  19   9.497  -1.027   6.240
    9    HE   ARG  19           HE       ARG  19  10.435  -2.578   8.349
   10   HH21  ARG  19          HH11      ARG  19   9.170  -4.210   9.280
   11   HH22  ARG  19          HH12      ARG  19   7.451  -4.170   9.101
   12   HH11  ARG  19          HH21      ARG  19   7.455  -1.264   7.240
   13   HH12  ARG  19          HH22      ARG  19   6.481  -2.503   7.941

  No H/Q in entry =          13
  In of MODEL   90
    1    H    SER  20           H        SER  20  14.358  -2.534   8.197
    2    HA   SER  20           HA       SER  20  14.070  -1.434  10.733
    3    HB2  SER  20           HB2      SER  20  14.690  -3.852  10.059
    4    HB3  SER  20           HB3      SER  20  16.355  -3.274  10.047
    5    HG   SER  20           HG       SER  20  15.405  -2.349  12.247

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LEU  21           H        LEU  21  16.924  -1.391   8.611
    2    HA   LEU  21           HA       LEU  21  18.599   0.083  10.359
    3    HB2  LEU  21           HB2      LEU  21  18.591  -0.188   7.345
    4    HB3  LEU  21           HB3      LEU  21  19.847   0.664   8.241
    5    HG   LEU  21           HG       LEU  21  19.086  -2.224   8.767
    6   HD13  LEU  21          HD11      LEU  21  19.965  -1.999   6.488
    7   HD12  LEU  21          HD12      LEU  21  21.159  -2.785   7.520
    8   HD11  LEU  21          HD13      LEU  21  21.347  -1.084   7.094
    9   HD23  LEU  21          HD21      LEU  21  21.565  -2.074   9.686
   10   HD22  LEU  21          HD22      LEU  21  20.244  -1.494  10.693
   11   HD21  LEU  21          HD23      LEU  21  21.225  -0.349   9.793

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ALA  22           H        ALA  22  16.355   1.069   7.792
    2    HA   ALA  22           HA       ALA  22  16.912   3.823   7.811
    3    HB3  ALA  22           HB1      ALA  22  15.510   2.592   6.125
    4    HB2  ALA  22           HB2      ALA  22  14.811   4.109   6.689
    5    HB1  ALA  22           HB3      ALA  22  14.207   2.573   7.312

  No H/Q in entry =           5
  In of MODEL   90
    1    H    TYR  23           H        TYR  23  14.394   2.024   9.632
    2    HA   TYR  23           HA       TYR  23  13.439   4.266  11.078
    3    HB2  TYR  23           HB2      TYR  23  12.191   2.160  11.048
    4    HB3  TYR  23           HB3      TYR  23  13.512   1.342  11.882
    5    HD1  TYR  23           HD1      TYR  23  11.002   4.077  12.227
    6    HD2  TYR  23           HD2      TYR  23  13.715   1.427  14.241
    7    HE1  TYR  23           HE1      TYR  23  10.064   4.779  14.414
    8    HE2  TYR  23           HE2      TYR  23  12.777   2.126  16.427
    9    HH   TYR  23           HH       TYR  23  10.045   4.401  16.610

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ALA  24           H        ALA  24  16.065   1.972  11.727
    2    HA   ALA  24           HA       ALA  24  16.729   2.961  14.294
    3    HB1  ALA  24           HB1      ALA  24  18.074   1.158  14.135
    4    HB3  ALA  24           HB2      ALA  24  19.114   2.073  13.042
    5    HB2  ALA  24           HB3      ALA  24  17.815   1.074  12.393

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ALA  25           H        ALA  25  17.710   3.885  11.021
    2    HA   ALA  25           HA       ALA  25  19.666   5.804  11.678
    3    HB1  ALA  25           HB1      ALA  25  18.954   4.863   9.358
    4    HB3  ALA  25           HB2      ALA  25  19.468   6.547   9.455
    5    HB2  ALA  25           HB3      ALA  25  17.751   6.152   9.377

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LEU  26           H        LEU  26  16.155   6.060  11.299
    2    HA   LEU  26           HA       LEU  26  15.950   8.843  11.751
    3    HB2  LEU  26           HB2      LEU  26  14.083   7.622  10.812
    4    HB3  LEU  26           HB3      LEU  26  13.977   6.594  12.236
    5    HG   LEU  26           HG       LEU  26  13.379   8.556  13.615
    6   HD12  LEU  26          HD11      LEU  26  12.741  10.662  12.288
    7   HD11  LEU  26          HD12      LEU  26  13.724  10.003  10.983
    8   HD13  LEU  26          HD13      LEU  26  14.464  10.381  12.539
    9   HD21  LEU  26          HD21      LEU  26  11.714   8.257  11.096
   10   HD23  LEU  26          HD22      LEU  26  11.152   8.958  12.611
   11   HD22  LEU  26          HD23      LEU  26  11.591   7.253  12.542

  No H/Q in entry =          11
  In of MODEL   90
    1    H    LYS  27           H        LYS  27  15.808   6.063  13.941
    2    HA   LYS  27           HA       LYS  27  15.214   7.432  16.307
    3    HB2  LYS  27           HB2      LYS  27  15.224   4.957  16.041
    4    HB3  LYS  27           HB3      LYS  27  16.988   4.995  16.006
    5    HG2  LYS  27           HG2      LYS  27  17.034   5.978  18.257
    6    HG3  LYS  27           HG3      LYS  27  15.267   6.011  18.293
    7    HD2  LYS  27           HD2      LYS  27  15.223   3.545  18.055
    8    HD3  LYS  27           HD3      LYS  27  16.988   3.520  18.052
    9    HE2  LYS  27           HE2      LYS  27  17.018   4.506  20.309
   10    HE3  LYS  27           HE3      LYS  27  15.253   4.561  20.315
   11    HZ3  LYS  27           HZ1      LYS  27  16.019   2.602  21.468
   12    HZ2  LYS  27           HZ2      LYS  27  16.938   2.116  20.122
   13    HZ1  LYS  27           HZ3      LYS  27  15.240   2.136  20.034

  No H/Q in entry =          13
  In of MODEL   90
    1    H    GLN  28           H        GLN  28  18.334   6.824  14.731
    2    HA   GLN  28           HA       GLN  28  20.017   7.892  16.731
    3    HB2  GLN  28           HB2      GLN  28  20.319   7.846  13.717
    4    HB3  GLN  28           HB3      GLN  28  21.604   8.305  14.834
    5    HG2  GLN  28           HG2      GLN  28  20.162   5.640  14.870
    6    HG3  GLN  28           HG3      GLN  28  21.750   5.913  14.154
    7   HE21  GLN  28          HE21      GLN  28  20.451   4.619  16.857
    8   HE22  GLN  28          HE22      GLN  28  21.642   5.027  17.993

  No H/Q in entry =           8
  In of MODEL   90
    1    H    ALA  29           H        ALA  29  18.292   9.392  14.031
    2    HA   ALA  29           HA       ALA  29  19.314  12.003  14.291
    3    HB2  ALA  29           HB1      ALA  29  17.629  12.657  12.811
    4    HB1  ALA  29           HB2      ALA  29  16.470  11.494  13.456
    5    HB3  ALA  29           HB3      ALA  29  17.801  10.940  12.439

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LYS  30           H        LYS  30  16.515  10.429  15.796
    2    HA   LYS  30           HA       LYS  30  15.515  12.691  17.150
    3    HB2  LYS  30           HB2      LYS  30  15.371   9.750  17.851
    4    HB3  LYS  30           HB3      LYS  30  14.513  11.008  18.741
    5    HG2  LYS  30           HG2      LYS  30  13.406  11.706  16.618
    6    HG3  LYS  30           HG3      LYS  30  14.202  10.363  15.794
    7    HD2  LYS  30           HD2      LYS  30  13.106   8.765  17.316
    8    HD3  LYS  30           HD3      LYS  30  12.320  10.097  18.163
    9    HE2  LYS  30           HE2      LYS  30  11.169  10.743  16.066
   10    HE3  LYS  30           HE3      LYS  30  11.935   9.382  15.237
   11    HZ2  LYS  30           HZ1      LYS  30   9.618   8.995  16.105
   12    HZ1  LYS  30           HZ2      LYS  30  10.278   9.040  17.676
   13    HZ3  LYS  30           HZ3      LYS  30  10.780   7.851  16.567

  No H/Q in entry =          13
  In of MODEL   90
    1    H    GLN  31           H        GLN  31  18.151  10.494  17.899
    2    HA   GLN  31           HA       GLN  31  18.474  11.503  20.596
    3    HB2  GLN  31           HB2      GLN  31  20.490   9.914  19.000
    4    HB3  GLN  31           HB3      GLN  31  20.348  10.038  20.754
    5    HG2  GLN  31           HG2      GLN  31  17.829   9.111  19.971
    6    HG3  GLN  31           HG3      GLN  31  18.927   8.257  18.896
    7   HE21  GLN  31          HE21      GLN  31  17.362   7.124  21.163
    8   HE22  GLN  31          HE22      GLN  31  18.506   6.451  22.219

  No H/Q in entry =           8
  In of MODEL   90
    1    H    GLY  32           H        GLY  32  19.022  12.818  17.633
    2    HA3  GLY  32           HA2      GLY  32  20.029  14.854  17.126
    3    HA2  GLY  32           HA3      GLY  32  20.778  14.849  18.717

  No H/Q in entry =           3
  In of MODEL   90
    1    H    ASP  33           H        ASP  33  21.180  11.954  16.940
    2    HA   ASP  33           HA       ASP  33  24.015  12.602  16.488
    3    HB2  ASP  33           HB2      ASP  33  22.480  10.001  16.595
    4    HB3  ASP  33           HB3      ASP  33  24.170  10.101  16.108

  No H/Q in entry =           4
  In of MODEL   90
    1    H    PHE  34           H        PHE  34  23.556  13.932  14.606
    2    HA   PHE  34           HA       PHE  34  22.209  12.963  12.311
    3    HB2  PHE  34           HB2      PHE  34  24.359  15.076  12.554
    4    HB3  PHE  34           HB3      PHE  34  23.378  14.796  11.117
    5    HD1  PHE  34           HD1      PHE  34  23.634  16.725  14.033
    6    HD2  PHE  34           HD2      PHE  34  20.748  14.640  11.631
    7    HE1  PHE  34           HE1      PHE  34  21.826  18.140  14.973
    8    HE2  PHE  34           HE2      PHE  34  18.944  16.054  12.573
    9    HZ   PHE  34           HZ       PHE  34  19.487  17.805  14.240

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ALA  35           H        ALA  35  25.576  12.742  13.336
    2    HA   ALA  35           HA       ALA  35  26.686  11.912  10.883
    3    HB3  ALA  35           HB1      ALA  35  28.346  10.725  12.611
    4    HB2  ALA  35           HB2      ALA  35  27.487  11.758  13.753
    5    HB1  ALA  35           HB3      ALA  35  28.337  12.474  12.385

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ALA  36           H        ALA  36  25.538   9.964  13.642
    2    HA   ALA  36           HA       ALA  36  26.005   7.473  12.366
    3    HB2  ALA  36           HB1      ALA  36  25.557   6.729  14.439
    4    HB3  ALA  36           HB2      ALA  36  23.874   7.240  14.281
    5    HB1  ALA  36           HB3      ALA  36  25.083   8.360  14.910

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ALA  37           H        ALA  37  23.202   9.625  12.488
    2    HA   ALA  37           HA       ALA  37  21.336   7.874  11.301
    3    HB3  ALA  37           HB1      ALA  37  21.587  10.834  11.597
    4    HB1  ALA  37           HB2      ALA  37  20.263   9.767  12.062
    5    HB2  ALA  37           HB3      ALA  37  20.465  10.239  10.374

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LYS  38           H        LYS  38  23.465  10.317   9.835
    2    HA   LYS  38           HA       LYS  38  22.835   9.897   7.154
    3    HB2  LYS  38           HB2      LYS  38  24.651  11.438   8.609
    4    HB3  LYS  38           HB3      LYS  38  25.680  10.440   7.588
    5    HG2  LYS  38           HG2      LYS  38  24.533  11.222   5.587
    6    HG3  LYS  38           HG3      LYS  38  23.341  12.086   6.563
    7    HD2  LYS  38           HD2      LYS  38  24.946  13.670   7.324
    8    HD3  LYS  38           HD3      LYS  38  26.300  12.673   6.795
    9    HE2  LYS  38           HE2      LYS  38  25.967  14.549   5.243
   10    HE3  LYS  38           HE3      LYS  38  25.623  13.015   4.436
   11    HZ3  LYS  38           HZ1      LYS  38  23.431  13.478   4.295
   12    HZ2  LYS  38           HZ2      LYS  38  23.966  15.089   4.387
   13    HZ1  LYS  38           HZ3      LYS  38  23.379  14.309   5.775

  No H/Q in entry =          13
  In of MODEL   90
    1    H    ALA  39           H        ALA  39  25.326   8.277   9.121
    2    HA   ALA  39           HA       ALA  39  26.392   6.681   7.055
    3    HB2  ALA  39           HB1      ALA  39  26.281   5.716   9.898
    4    HB1  ALA  39           HB2      ALA  39  27.247   7.134   9.488
    5    HB3  ALA  39           HB3      ALA  39  27.590   5.582   8.725

  No H/Q in entry =           5
  In of MODEL   90
    1    H    MET  40           H        MET  40  23.763   6.085   9.340
    2    HA   MET  40           HA       MET  40  23.301   3.384   8.601
    3    HB2  MET  40           HB2      MET  40  21.495   5.441   9.886
    4    HB3  MET  40           HB3      MET  40  21.076   3.736   9.708
    5    HG2  MET  40           HG2      MET  40  23.626   4.655  11.062
    6    HG3  MET  40           HG3      MET  40  22.125   4.391  11.948
    7    HE3  MET  40           HE1      MET  40  21.531   0.762  12.117
    8    HE2  MET  40           HE2      MET  40  20.677   2.072  11.307
    9    HE1  MET  40           HE3      MET  40  21.412   2.352  12.884

  No H/Q in entry =           9
  In of MODEL   90
    1    H    MET  41           H        MET  41  21.918   6.449   7.410
    2    HA   MET  41           HA       MET  41  19.960   5.271   5.727
    3    HB2  MET  41           HB2      MET  41  21.463   7.850   5.223
    4    HB3  MET  41           HB3      MET  41  19.935   7.369   4.497
    5    HG2  MET  41           HG2      MET  41  19.175   7.184   7.044
    6    HG3  MET  41           HG3      MET  41  20.492   8.332   7.274
    7    HE2  MET  41           HE1      MET  41  19.956   9.627   3.936
    8    HE1  MET  41           HE2      MET  41  20.909  10.058   5.352
    9    HE3  MET  41           HE3      MET  41  19.647  11.147   4.783

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ASP  42           H        ASP  42  23.342   6.169   5.191
    2    HA   ASP  42           HA       ASP  42  23.444   5.696   2.434
    3    HB2  ASP  42           HB2      ASP  42  25.194   6.679   4.213
    4    HB3  ASP  42           HB3      ASP  42  25.839   5.049   4.087

  No H/Q in entry =           4
  In of MODEL   90
    1    H    GLN  43           H        GLN  43  24.138   3.534   5.156
    2    HA   GLN  43           HA       GLN  43  24.793   1.273   3.574
    3    HB2  GLN  43           HB2      GLN  43  23.758   1.461   6.413
    4    HB3  GLN  43           HB3      GLN  43  24.329  -0.031   5.659
    5    HG2  GLN  43           HG2      GLN  43  26.504   1.163   5.160
    6    HG3  GLN  43           HG3      GLN  43  25.926   2.494   6.158
    7   HE21  GLN  43          HE21      GLN  43  28.147   1.503   7.205
    8   HE22  GLN  43          HE22      GLN  43  27.858   0.421   8.479

  No H/Q in entry =           8
  In of MODEL   90
    1    H    SER  44           H        SER  44  21.739   2.428   4.945
    2    HA   SER  44           HA       SER  44  20.157   0.197   4.263
    3    HB2  SER  44           HB2      SER  44  19.728   2.729   5.409
    4    HB3  SER  44           HB3      SER  44  18.701   2.695   3.979
    5    HG   SER  44           HG       SER  44  17.592   1.758   5.695

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ARG  45           H        ARG  45  20.931   3.158   2.464
    2    HA   ARG  45           HA       ARG  45  19.413   2.686   0.152
    3    HB2  ARG  45           HB2      ARG  45  20.571   4.813   0.744
    4    HB3  ARG  45           HB3      ARG  45  22.111   4.046   0.365
    5    HG2  ARG  45           HG2      ARG  45  21.336   3.649  -1.954
    6    HG3  ARG  45           HG3      ARG  45  19.808   4.438  -1.574
    7    HD2  ARG  45           HD2      ARG  45  21.071   6.525  -0.981
    8    HD3  ARG  45           HD3      ARG  45  22.564   5.740  -1.544
    9    HE   ARG  45           HE       ARG  45  20.642   5.519  -3.589
   10   HH21  ARG  45          HH11      ARG  45  20.654   6.889  -5.351
   11   HH22  ARG  45          HH12      ARG  45  21.423   8.434  -5.242
   12   HH11  ARG  45          HH21      ARG  45  22.384   8.002  -1.952
   13   HH12  ARG  45          HH22      ARG  45  22.401   9.063  -3.314

  No H/Q in entry =          13
  In of MODEL   90
    1    H    MET  46           H        MET  46  22.767   1.784   0.915
    2    HA   MET  46           HA       MET  46  23.375   0.588  -1.568
    3    HB2  MET  46           HB2      MET  46  24.466   0.251   1.226
    4    HB3  MET  46           HB3      MET  46  25.121  -0.647  -0.146
    5    HG2  MET  46           HG2      MET  46  25.589   1.454  -1.327
    6    HG3  MET  46           HG3      MET  46  24.882   2.375  -0.006
    7    HE1  MET  46           HE1      MET  46  27.385  -0.011  -1.243
    8    HE3  MET  46           HE2      MET  46  27.468  -0.863   0.295
    9    HE2  MET  46           HE3      MET  46  28.826   0.131  -0.228

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ALA  47           H        ALA  47  21.967  -0.736   1.401
    2    HA   ALA  47           HA       ALA  47  21.894  -3.447   0.596
    3    HB2  ALA  47           HB1      ALA  47  21.509  -2.985   2.899
    4    HB3  ALA  47           HB2      ALA  47  19.970  -3.575   2.273
    5    HB1  ALA  47           HB3      ALA  47  20.213  -1.846   2.533

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LEU  48           H        LEU  48  19.566  -0.800   0.231
    2    HA   LEU  48           HA       LEU  48  17.513  -2.315  -1.030
    3    HB2  LEU  48           HB2      LEU  48  18.194   0.634  -1.140
    4    HB3  LEU  48           HB3      LEU  48  16.719  -0.063  -1.813
    5    HG   LEU  48           HG       LEU  48  17.558  -0.374   1.079
    6   HD13  LEU  48          HD11      LEU  48  17.161   1.930   0.892
    7   HD12  LEU  48          HD12      LEU  48  15.595   1.296   1.394
    8   HD11  LEU  48          HD13      LEU  48  15.877   1.717  -0.296
    9   HD22  LEU  48          HD21      LEU  48  16.016  -2.075   0.691
   10   HD21  LEU  48          HD22      LEU  48  15.155  -1.164  -0.550
   11   HD23  LEU  48          HD23      LEU  48  14.939  -0.758   1.152

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ASN  49           H        ASN  49  20.223  -0.410  -2.248
    2    HA   ASN  49           HA       ASN  49  19.582  -0.486  -4.975
    3    HB2  ASN  49           HB2      ASN  49  21.278   1.006  -4.011
    4    HB3  ASN  49           HB3      ASN  49  22.300  -0.375  -3.634
    5   HD21  ASN  49          HD21      ASN  49  24.007   0.427  -5.034
    6   HD22  ASN  49          HD22      ASN  49  23.863   0.368  -6.723

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLU  50           H        GLU  50  21.539  -2.700  -3.006
    2    HA   GLU  50           HA       GLU  50  22.232  -4.461  -5.130
    3    HB2  GLU  50           HB2      GLU  50  23.422  -4.448  -2.959
    4    HB3  GLU  50           HB3      GLU  50  21.970  -5.063  -2.169
    5    HG2  GLU  50           HG2      GLU  50  22.046  -7.096  -3.528
    6    HG3  GLU  50           HG3      GLU  50  23.431  -6.476  -4.424

  No H/Q in entry =           6
  In of MODEL   90
    1    H    ALA  51           H        ALA  51  19.568  -4.372  -2.814
    2    HA   ALA  51           HA       ALA  51  18.382  -6.834  -3.576
    3    HB3  ALA  51           HB1      ALA  51  16.788  -6.314  -2.027
    4    HB1  ALA  51           HB2      ALA  51  16.592  -4.666  -2.626
    5    HB2  ALA  51           HB3      ALA  51  17.944  -5.065  -1.565

  No H/Q in entry =           5
  In of MODEL   90
    1    H    HIS  52           H        HIS  52  17.830  -3.481  -4.612
    2    HA   HIS  52           HA       HIS  52  15.719  -3.987  -6.420
    3    HB2  HIS  52           HB2      HIS  52  16.390  -1.728  -5.614
    4    HB3  HIS  52           HB3      HIS  52  17.843  -1.838  -6.607
    5    HD1  HIS  52           HD1      HIS  52  17.501  -1.878  -9.223
    6    HD2  HIS  52           HD2      HIS  52  14.028  -1.145  -7.037
    7    HE1  HIS  52           HE1      HIS  52  15.787  -1.006 -10.872
    8    HE2  HIS  52           HE2      HIS  52  13.665  -0.554  -9.553

  No H/Q in entry =           8
  In of MODEL   90
    1    H    LEU  53           H        LEU  53  19.239  -4.025  -6.840
    2    HA   LEU  53           HA       LEU  53  19.303  -4.341  -9.640
    3    HB2  LEU  53           HB2      LEU  53  21.220  -5.116  -7.458
    4    HB3  LEU  53           HB3      LEU  53  21.540  -5.512  -9.144
    5    HG   LEU  53           HG       LEU  53  20.887  -2.692  -8.237
    6   HD12  LEU  53          HD11      LEU  53  23.408  -2.359  -8.499
    7   HD11  LEU  53          HD12      LEU  53  23.546  -4.117  -8.444
    8   HD13  LEU  53          HD13      LEU  53  22.894  -3.241  -7.064
    9   HD23  LEU  53          HD21      LEU  53  22.335  -2.274 -10.381
   10   HD22  LEU  53          HD22      LEU  53  20.657  -2.772 -10.579
   11   HD21  LEU  53          HD23      LEU  53  21.946  -3.943 -10.780

  No H/Q in entry =          11
  In of MODEL   90
    1    H    VAL  54           H        VAL  54  19.160  -6.726  -7.015
    2    HA   VAL  54           HA       VAL  54  19.269  -9.022  -8.674
    3    HB   VAL  54           HB       VAL  54  18.108  -8.588  -5.911
    4   HG12  VAL  54          HG11      VAL  54  18.409 -11.209  -5.906
    5   HG11  VAL  54          HG12      VAL  54  18.232 -11.038  -7.652
    6   HG13  VAL  54          HG13      VAL  54  16.944 -10.497  -6.578
    7   HG22  VAL  54          HG21      VAL  54  20.425  -8.398  -5.680
    8   HG21  VAL  54          HG22      VAL  54  20.757  -9.492  -7.020
    9   HG23  VAL  54          HG23      VAL  54  20.216 -10.135  -5.469

  No H/Q in entry =           9
  In of MODEL   90
    1    H    GLN  55           H        GLN  55  16.552  -7.095  -7.401
    2    HA   GLN  55           HA       GLN  55  14.521  -8.742  -8.482
    3    HB2  GLN  55           HB2      GLN  55  13.780  -7.210  -6.858
    4    HB3  GLN  55           HB3      GLN  55  14.587  -5.849  -7.632
    5    HG2  GLN  55           HG2      GLN  55  12.871  -5.510  -9.128
    6    HG3  GLN  55           HG3      GLN  55  12.535  -7.228  -9.299
    7   HE21  GLN  55          HE21      GLN  55  10.521  -7.760  -8.501
    8   HE22  GLN  55          HE22      GLN  55   9.749  -6.999  -7.195

  No H/Q in entry =           8
  In of MODEL   90
    1    H    THR  56           H        THR  56  16.289  -5.957  -9.836
    2    HA   THR  56           HA       THR  56  14.862  -5.583 -12.189
    3    HB   THR  56           HB       THR  56  17.862  -5.449 -11.789
    4    HG1  THR  56           HG1      THR  56  15.701  -3.732 -11.353
    5   HG22  THR  56          HG21      THR  56  17.726  -3.874 -13.756
    6   HG21  THR  56          HG22      THR  56  16.067  -4.419 -13.996
    7   HG23  THR  56          HG23      THR  56  17.401  -5.563 -14.151

  No H/Q in entry =           7
  In of MODEL   90
    1    H    LYS  57           H        LYS  57  17.491  -7.902 -11.568
    2    HA   LYS  57           HA       LYS  57  17.491  -9.097 -14.146
    3    HB2  LYS  57           HB2      LYS  57  19.159  -9.311 -12.134
    4    HB3  LYS  57           HB3      LYS  57  18.085 -10.594 -11.598
    5    HG2  LYS  57           HG2      LYS  57  18.360 -11.540 -13.999
    6    HG3  LYS  57           HG3      LYS  57  19.759 -10.477 -14.102
    7    HD2  LYS  57           HD2      LYS  57  19.366 -12.937 -12.473
    8    HD3  LYS  57           HD3      LYS  57  20.827 -12.322 -13.243
    9    HE2  LYS  57           HE2      LYS  57  20.761 -10.443 -11.471
   10    HE3  LYS  57           HE3      LYS  57  19.597 -11.449 -10.612
   11    HZ3  LYS  57           HZ1      LYS  57  21.148 -12.998 -10.123
   12    HZ2  LYS  57           HZ2      LYS  57  22.182 -11.654 -10.228
   13    HZ1  LYS  57           HZ3      LYS  57  22.048 -12.731 -11.536

  No H/Q in entry =          13
  In of MODEL   90
    1    H    LEU  58           H        LEU  58  15.695  -9.750 -11.177
    2    HA   LEU  58           HA       LEU  58  14.458 -12.114 -12.115
    3    HB2  LEU  58           HB2      LEU  58  13.670 -10.202  -9.923
    4    HB3  LEU  58           HB3      LEU  58  12.853 -11.733 -10.241
    5    HG   LEU  58           HG       LEU  58  15.826 -11.478  -9.677
    6   HD11  LEU  58          HD11      LEU  58  13.445 -11.877  -7.892
    7   HD13  LEU  58          HD12      LEU  58  14.905 -10.924  -7.625
    8   HD12  LEU  58          HD13      LEU  58  14.964 -12.681  -7.489
    9   HD22  LEU  58          HD21      LEU  58  15.696 -13.539 -10.704
   10   HD21  LEU  58          HD22      LEU  58  13.979 -13.735 -10.349
   11   HD23  LEU  58          HD23      LEU  58  15.181 -14.045  -9.096

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  59           H        ILE  59  13.814  -8.772 -12.801
    2    HA   ILE  59           HA       ILE  59  11.097  -9.400 -13.750
    3    HB   ILE  59           HB       ILE  59  11.917  -7.123 -12.543
    4   HG12  ILE  59          HG12      ILE  59  10.014  -6.996 -14.894
    5   HG13  ILE  59          HG13      ILE  59   9.589  -7.750 -13.379
    6   HG23  ILE  59          HG21      ILE  59  12.502  -5.404 -14.054
    7   HG22  ILE  59          HG22      ILE  59  12.009  -6.328 -15.454
    8   HG21  ILE  59          HG23      ILE  59  13.485  -6.746 -14.588
    9   HD13  ILE  59          HD11      ILE  59   8.801  -5.485 -13.266
   10   HD12  ILE  59          HD12      ILE  59  10.359  -4.868 -13.815
   11   HD11  ILE  59          HD13      ILE  59  10.214  -5.595 -12.214

  No H/Q in entry =          11
  In of MODEL   90
    1    H    GLU  60           H        GLU  60  14.312  -8.573 -14.998
    2    HA   GLU  60           HA       GLU  60  13.544  -8.168 -17.709
    3    HB2  GLU  60           HB2      GLU  60  15.725  -7.449 -16.855
    4    HB3  GLU  60           HB3      GLU  60  16.174  -9.123 -16.542
    5    HG2  GLU  60           HG2      GLU  60  16.007  -9.632 -18.947
    6    HG3  GLU  60           HG3      GLU  60  15.525  -7.969 -19.272

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLY  61           H        GLY  61  14.493 -11.056 -15.890
    2    HA3  GLY  61           HA2      GLY  61  13.948 -12.700 -18.292
    3    HA2  GLY  61           HA3      GLY  61  14.972 -13.189 -16.946

  No H/Q in entry =           3
  In of MODEL   90
    1    H    ASP  62           H        ASP  62  11.862 -11.619 -16.586
    2    HA   ASP  62           HA       ASP  62  10.911 -13.595 -14.785
    3    HB2  ASP  62           HB2      ASP  62   8.819 -12.298 -14.852
    4    HB3  ASP  62           HB3      ASP  62  10.225 -11.263 -14.623

  No H/Q in entry =           4
  In of MODEL   90
    1    H    ALA  63           H        ALA  63  11.567 -15.021 -17.115
    2    HA   ALA  63           HA       ALA  63   9.379 -15.501 -18.870
    3    HB3  ALA  63           HB1      ALA  63  11.472 -17.525 -18.051
    4    HB2  ALA  63           HB2      ALA  63  11.795 -16.222 -19.193
    5    HB1  ALA  63           HB3      ALA  63  10.584 -17.447 -19.573

  No H/Q in entry =           5
  In of MODEL   90
    1    H    GLY  64           H        GLY  64  10.385 -16.965 -15.820
    2    HA3  GLY  64           HA2      GLY  64   9.342 -18.389 -14.357
    3    HA2  GLY  64           HA3      GLY  64   7.853 -17.615 -14.879

  No H/Q in entry =           3
  In of MODEL   90
    1    H    GLU  65           H        GLU  65   6.420 -19.224 -15.252
    2    HA   GLU  65           HA       GLU  65   7.122 -21.837 -16.008
    3    HB2  GLU  65           HB2      GLU  65   4.495 -20.368 -16.211
    4    HB3  GLU  65           HB3      GLU  65   4.683 -22.091 -16.537
    5    HG2  GLU  65           HG2      GLU  65   5.526 -22.468 -14.280
    6    HG3  GLU  65           HG3      GLU  65   5.464 -20.741 -13.938

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLY  66           H        GLY  66   5.532 -22.660 -17.950
    2    HA3  GLY  66           HA2      GLY  66   6.982 -22.282 -20.321
    3    HA2  GLY  66           HA3      GLY  66   5.438 -23.097 -20.181

  No H/Q in entry =           3
  In of MODEL   90
    1    H    LYS  67           H        LYS  67   3.965 -20.852 -19.235
    2    HA   LYS  67           HA       LYS  67   3.378 -19.616 -21.756
    3    HB2  LYS  67           HB2      LYS  67   2.133 -19.375 -19.020
    4    HB3  LYS  67           HB3      LYS  67   1.506 -18.570 -20.465
    5    HG2  LYS  67           HG2      LYS  67   1.333 -20.754 -21.608
    6    HG3  LYS  67           HG3      LYS  67   1.945 -21.558 -20.164
    7    HD2  LYS  67           HD2      LYS  67   0.001 -20.795 -18.883
    8    HD3  LYS  67           HD3      LYS  67  -0.603 -19.921 -20.294
    9    HE2  LYS  67           HE2      LYS  67  -1.790 -21.966 -20.347
   10    HE3  LYS  67           HE3      LYS  67  -0.488 -22.198 -21.513
   11    HZ3  LYS  67           HZ1      LYS  67   0.568 -23.668 -20.186
   12    HZ2  LYS  67           HZ2      LYS  67  -1.000 -23.921 -19.588
   13    HZ1  LYS  67           HZ3      LYS  67   0.080 -22.915 -18.747

  No H/Q in entry =          13
  In of MODEL   90
    1    H    MET  68           H        MET  68   3.101 -17.425 -22.164
    2    HA   MET  68           HA       MET  68   5.305 -15.820 -21.847
    3    HB2  MET  68           HB2      MET  68   2.450 -14.989 -22.371
    4    HB3  MET  68           HB3      MET  68   3.868 -13.981 -22.655
    5    HG2  MET  68           HG2      MET  68   4.644 -16.187 -23.989
    6    HG3  MET  68           HG3      MET  68   2.896 -16.350 -24.168
    7    HE1  MET  68           HE1      MET  68   1.670 -14.033 -24.068
    8    HE3  MET  68           HE2      MET  68   1.817 -12.932 -25.434
    9    HE2  MET  68           HE3      MET  68   2.739 -12.627 -23.964

  No H/Q in entry =           9
  In of MODEL   90
    1    H    LYS  69           H        LYS  69   3.154 -16.483 -19.334
    2    HA   LYS  69           HA       LYS  69   2.938 -13.962 -18.090
    3    HB2  LYS  69           HB2      LYS  69   2.822 -16.693 -16.799
    4    HB3  LYS  69           HB3      LYS  69   2.183 -15.189 -16.130
    5    HG2  LYS  69           HG2      LYS  69   0.837 -14.992 -18.318
    6    HG3  LYS  69           HG3      LYS  69   1.249 -16.687 -18.579
    7    HD2  LYS  69           HD2      LYS  69  -0.515 -15.462 -16.497
    8    HD3  LYS  69           HD3      LYS  69  -0.748 -16.937 -17.438
    9    HE2  LYS  69           HE2      LYS  69   1.240 -17.900 -16.142
   10    HE3  LYS  69           HE3      LYS  69   1.074 -16.517 -15.062
   11    HZ2  LYS  69           HZ1      LYS  69  -0.840 -18.705 -15.557
   12    HZ1  LYS  69           HZ2      LYS  69  -1.362 -17.217 -14.926
   13    HZ3  LYS  69           HZ3      LYS  69  -0.222 -18.149 -14.078

  No H/Q in entry =          13
  In of MODEL   90
    1    H    VAL  70           H        VAL  70   3.656 -14.205 -15.445
    2    HA   VAL  70           HA       VAL  70   6.612 -14.393 -15.451
    3    HB   VAL  70           HB       VAL  70   6.670 -12.343 -14.063
    4   HG12  VAL  70          HG11      VAL  70   6.081 -10.750 -15.895
    5   HG11  VAL  70          HG12      VAL  70   5.263 -12.068 -16.736
    6   HG13  VAL  70          HG13      VAL  70   7.006 -12.134 -16.478
    7   HG23  VAL  70          HG21      VAL  70   4.411 -10.961 -14.287
    8   HG22  VAL  70          HG22      VAL  70   4.612 -12.133 -12.988
    9   HG21  VAL  70          HG23      VAL  70   3.690 -12.565 -14.427

  No H/Q in entry =           9
  In of MODEL   90
    1    H    SER  71           H        SER  71   7.510 -14.551 -13.253
    2    HA   SER  71           HA       SER  71   6.272 -16.559 -11.683
    3    HB2  SER  71           HB2      SER  71   8.729 -16.123 -11.740
    4    HB3  SER  71           HB3      SER  71   8.453 -14.624 -10.856
    5    HG   SER  71           HG       SER  71   8.235 -17.285 -10.029

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LEU  72           H        LEU  72   4.919 -16.439  -9.987
    2    HA   LEU  72           HA       LEU  72   3.385 -14.114  -9.549
    3    HB2  LEU  72           HB2      LEU  72   3.647 -16.673  -7.977
    4    HB3  LEU  72           HB3      LEU  72   2.485 -15.407  -7.584
    5    HG   LEU  72           HG       LEU  72   2.648 -16.707 -10.323
    6   HD11  LEU  72          HD11      LEU  72   2.079 -18.291  -8.396
    7   HD13  LEU  72          HD12      LEU  72   0.873 -18.170  -9.675
    8   HD12  LEU  72          HD13      LEU  72   0.631 -17.314  -8.152
    9   HD22  LEU  72          HD21      LEU  72   1.443 -14.704 -10.573
   10   HD21  LEU  72          HD22      LEU  72   0.748 -14.792  -8.963
   11   HD23  LEU  72          HD23      LEU  72   0.162 -15.861 -10.232

  No H/Q in entry =          11
  In of MODEL   90
    1    H    VAL  73           H        VAL  73   6.023 -15.572  -7.765
    2    HA   VAL  73           HA       VAL  73   5.964 -14.039  -5.433
    3    HB   VAL  73           HB       VAL  73   8.102 -14.899  -4.971
    4   HG13  VAL  73          HG11      VAL  73   7.848 -17.221  -5.419
    5   HG12  VAL  73          HG12      VAL  73   7.001 -16.914  -6.935
    6   HG11  VAL  73          HG13      VAL  73   6.208 -16.576  -5.397
    7   HG23  VAL  73          HG21      VAL  73   9.483 -15.899  -6.888
    8   HG22  VAL  73          HG22      VAL  73   9.389 -14.140  -6.829
    9   HG21  VAL  73          HG23      VAL  73   8.397 -15.038  -7.978

  No H/Q in entry =           9
  In of MODEL   90
    1    H    LEU  74           H        LEU  74   6.975 -13.152  -8.604
    2    HA   LEU  74           HA       LEU  74   8.933 -11.218  -8.102
    3    HB2  LEU  74           HB2      LEU  74   8.477 -11.967 -10.343
    4    HB3  LEU  74           HB3      LEU  74   6.819 -11.377 -10.249
    5    HG   LEU  74           HG       LEU  74   7.659  -9.060 -10.025
    6   HD12  LEU  74          HD11      LEU  74  10.161  -8.803 -10.625
    7   HD11  LEU  74          HD12      LEU  74  10.317 -10.491 -10.142
    8   HD13  LEU  74          HD13      LEU  74   9.775  -9.287  -8.975
    9   HD23  LEU  74          HD21      LEU  74   9.111 -10.177 -12.367
   10   HD22  LEU  74          HD22      LEU  74   7.991  -8.838 -12.263
   11   HD21  LEU  74          HD23      LEU  74   7.378 -10.476 -12.249

  No H/Q in entry =          11
  In of MODEL   90
    1    H    VAL  75           H        VAL  75   5.442 -10.806  -8.472
    2    HA   VAL  75           HA       VAL  75   5.365  -8.049  -7.884
    3    HB   VAL  75           HB       VAL  75   3.260 -10.181  -7.517
    4   HG13  VAL  75          HG11      VAL  75   2.788  -8.271  -6.023
    5   HG12  VAL  75          HG12      VAL  75   1.696  -8.228  -7.399
    6   HG11  VAL  75          HG13      VAL  75   3.080  -7.147  -7.346
    7   HG23  VAL  75          HG21      VAL  75   3.691  -8.029  -9.618
    8   HG22  VAL  75          HG22      VAL  75   2.380  -9.206  -9.603
    9   HG21  VAL  75          HG23      VAL  75   4.044  -9.741  -9.841

  No H/Q in entry =           9
  In of MODEL   90
    1    H    GLU  76           H        GLU  76   5.078 -10.925  -5.777
    2    HA   GLU  76           HA       GLU  76   4.607  -9.561  -3.357
    3    HB2  GLU  76           HB2      GLU  76   4.413 -12.026  -3.590
    4    HB3  GLU  76           HB3      GLU  76   6.148 -12.139  -3.826
    5    HG2  GLU  76           HG2      GLU  76   5.698 -12.717  -1.529
    6    HG3  GLU  76           HG3      GLU  76   6.456 -11.135  -1.516

  No H/Q in entry =           6
  In of MODEL   90
    1    H    ALA  77           H        ALA  77   7.667 -10.492  -4.905
    2    HA   ALA  77           HA       ALA  77   9.355  -9.463  -2.881
    3    HB3  ALA  77           HB1      ALA  77   9.997  -9.643  -5.830
    4    HB1  ALA  77           HB2      ALA  77  10.046 -11.021  -4.731
    5    HB2  ALA  77           HB3      ALA  77  11.137  -9.657  -4.484

  No H/Q in entry =           5
  In of MODEL   90
    1    H    GLN  78           H        GLN  78   7.989  -8.033  -5.801
    2    HA   GLN  78           HA       GLN  78   9.361  -5.565  -5.689
    3    HB2  GLN  78           HB2      GLN  78   8.067  -6.469  -7.653
    4    HB3  GLN  78           HB3      GLN  78   6.583  -6.079  -6.786
    5    HG2  GLN  78           HG2      GLN  78   7.257  -3.713  -6.688
    6    HG3  GLN  78           HG3      GLN  78   8.745  -4.096  -7.554
    7   HE21  GLN  78          HE21      GLN  78   6.816  -2.259  -8.637
    8   HE22  GLN  78          HE22      GLN  78   6.138  -2.966 -10.025

  No H/Q in entry =           8
  In of MODEL   90
    1    H    LEU  79           H        LEU  79   6.325  -6.678  -4.275
    2    HA   LEU  79           HA       LEU  79   5.346  -4.263  -3.271
    3    HB2  LEU  79           HB2      LEU  79   4.014  -6.303  -3.223
    4    HB3  LEU  79           HB3      LEU  79   5.146  -7.053  -2.102
    5    HG   LEU  79           HG       LEU  79   4.598  -5.406  -0.377
    6   HD13  LEU  79          HD11      LEU  79   4.156  -3.388  -1.430
    7   HD12  LEU  79          HD12      LEU  79   2.524  -3.899  -1.000
    8   HD11  LEU  79          HD13      LEU  79   3.111  -4.126  -2.645
    9   HD23  LEU  79          HD21      LEU  79   2.007  -5.877  -0.302
   10   HD22  LEU  79          HD22      LEU  79   3.134  -7.226  -0.187
   11   HD21  LEU  79          HD23      LEU  79   2.332  -6.881  -1.717

  No H/Q in entry =          11
  In of MODEL   90
    1    H    HIS  80           H        HIS  80   7.499  -6.617  -1.676
    2    HA   HIS  80           HA       HIS  80   7.787  -5.078   0.695
    3    HB2  HIS  80           HB2      HIS  80   9.111  -7.453  -0.497
    4    HB3  HIS  80           HB3      HIS  80  10.023  -6.565   0.725
    5    HD1  HIS  80           HD1      HIS  80   9.513  -7.197   3.065
    6    HD2  HIS  80           HD2      HIS  80   6.303  -8.019   0.534
    7    HE1  HIS  80           HE1      HIS  80   7.723  -8.286   4.503
    8    HE2  HIS  80           HE2      HIS  80   5.760  -8.790   2.968

  No H/Q in entry =           8
  In of MODEL   90
    1    H    LEU  81           H        LEU  81   9.807  -5.371  -2.206
    2    HA   LEU  81           HA       LEU  81  11.861  -3.649  -1.314
    3    HB2  LEU  81           HB2      LEU  81  10.950  -4.432  -4.083
    4    HB3  LEU  81           HB3      LEU  81  12.377  -3.439  -3.784
    5    HG   LEU  81           HG       LEU  81  11.952  -6.157  -2.514
    6   HD12  LEU  81          HD11      LEU  81  13.773  -6.799  -4.253
    7   HD11  LEU  81          HD12      LEU  81  13.226  -5.370  -5.127
    8   HD13  LEU  81          HD13      LEU  81  12.100  -6.684  -4.796
    9   HD23  LEU  81          HD21      LEU  81  14.583  -5.866  -2.484
   10   HD22  LEU  81          HD22      LEU  81  13.601  -5.097  -1.239
   11   HD21  LEU  81          HD23      LEU  81  14.196  -4.150  -2.602

  No H/Q in entry =          11
  In of MODEL   90
    1    H    MET  82           H        MET  82   8.957  -2.985  -3.269
    2    HA   MET  82           HA       MET  82   9.525  -0.264  -3.765
    3    HB2  MET  82           HB2      MET  82   6.950  -1.834  -3.657
    4    HB3  MET  82           HB3      MET  82   6.968  -0.109  -4.020
    5    HG2  MET  82           HG2      MET  82   8.558  -2.197  -5.546
    6    HG3  MET  82           HG3      MET  82   7.000  -1.560  -6.068
    7    HE3  MET  82           HE1      MET  82   7.489   1.891  -7.236
    8    HE2  MET  82           HE2      MET  82   7.102   1.668  -5.532
    9    HE1  MET  82           HE3      MET  82   6.433   0.565  -6.731

  No H/Q in entry =           9
  In of MODEL   90
    1    H    THR  83           H        THR  83   7.702  -1.846  -1.172
    2    HA   THR  83           HA       THR  83   6.865   0.510   0.150
    3    HB   THR  83           HB       THR  83   6.703  -1.064   2.167
    4    HG1  THR  83           HG1      THR  83   7.443  -3.021   1.941
    5   HG22  THR  83          HG21      THR  83   5.044  -2.613   0.688
    6   HG21  THR  83          HG22      THR  83   5.291  -1.286  -0.442
    7   HG23  THR  83          HG23      THR  83   4.643  -0.965   1.167

  No H/Q in entry =           7
  In of MODEL   90
    1    H    SER  84           H        SER  84   9.665  -1.616   0.688
    2    HA   SER  84           HA       SER  84  10.725  -0.196   2.883
    3    HB2  SER  84           HB2      SER  84  11.973  -2.051   0.865
    4    HB3  SER  84           HB3      SER  84  12.919  -1.307   2.153
    5    HG   SER  84           HG       SER  84  10.626  -2.974   2.398

  No H/Q in entry =           5
  In of MODEL   90
    1    H    MET  85           H        MET  85  11.502   0.058  -0.600
    2    HA   MET  85           HA       MET  85  13.519   2.003  -0.336
    3    HB2  MET  85           HB2      MET  85  13.131   0.731  -2.405
    4    HB3  MET  85           HB3      MET  85  11.606   1.585  -2.641
    5    HG2  MET  85           HG2      MET  85  12.810   3.730  -2.756
    6    HG3  MET  85           HG3      MET  85  14.336   2.893  -2.492
    7    HE3  MET  85           HE1      MET  85  15.498   1.715  -5.736
    8    HE2  MET  85           HE2      MET  85  15.284   0.991  -4.144
    9    HE1  MET  85           HE3      MET  85  15.830   2.659  -4.274

  No H/Q in entry =           9
  In of MODEL   90
    1    H    LEU  86           H        LEU  86  10.036   2.374  -0.866
    2    HA   LEU  86           HA       LEU  86  10.002   5.187  -1.047
    3    HB2  LEU  86           HB2      LEU  86   8.144   3.547  -1.636
    4    HB3  LEU  86           HB3      LEU  86   7.803   3.460   0.092
    5    HG   LEU  86           HG       LEU  86   7.669   6.022   0.040
    6   HD11  LEU  86          HD11      LEU  86   8.457   5.579  -2.657
    7   HD13  LEU  86          HD12      LEU  86   8.032   7.111  -1.899
    8   HD12  LEU  86          HD13      LEU  86   6.791   6.161  -2.712
    9   HD23  LEU  86          HD21      LEU  86   5.532   4.692  -1.636
   10   HD22  LEU  86          HD22      LEU  86   5.347   5.954  -0.421
   11   HD21  LEU  86          HD23      LEU  86   5.726   4.305   0.074

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ALA  87           H        ALA  87   9.496   3.013   1.695
    2    HA   ALA  87           HA       ALA  87   8.956   4.932   3.661
    3    HB1  ALA  87           HB1      ALA  87   9.734   2.103   3.579
    4    HB3  ALA  87           HB2      ALA  87   8.611   2.927   4.658
    5    HB2  ALA  87           HB3      ALA  87  10.337   2.940   5.013

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ARG  88           H        ARG  88  12.030   3.475   2.699
    2    HA   ARG  88           HA       ARG  88  13.643   4.835   4.542
    3    HB2  ARG  88           HB2      ARG  88  14.299   2.855   3.142
    4    HB3  ARG  88           HB3      ARG  88  14.471   3.947   1.770
    5    HG2  ARG  88           HG2      ARG  88  15.946   5.245   3.726
    6    HG3  ARG  88           HG3      ARG  88  16.247   3.552   4.106
    7    HD2  ARG  88           HD2      ARG  88  17.521   3.242   2.267
    8    HD3  ARG  88           HD3      ARG  88  16.400   4.126   1.227
    9    HE   ARG  88           HE       ARG  88  18.800   5.164   2.290
   10   HH21  ARG  88          HH11      ARG  88  19.170   7.379   2.098
   11   HH22  ARG  88          HH12      ARG  88  17.831   8.465   1.947
   12   HH11  ARG  88          HH21      ARG  88  15.470   5.953   1.992
   13   HH12  ARG  88          HH22      ARG  88  15.735   7.655   1.862

  No H/Q in entry =          13
  In of MODEL   90
    1    H    GLU  89           H        GLU  89  12.699   5.745   1.213
    2    HA   GLU  89           HA       GLU  89  14.272   8.088   1.067
    3    HB2  GLU  89           HB2      GLU  89  13.128   7.060  -0.888
    4    HB3  GLU  89           HB3      GLU  89  11.585   7.617  -0.239
    5    HG2  GLU  89           HG2      GLU  89  12.313   9.947  -0.397
    6    HG3  GLU  89           HG3      GLU  89  13.915   9.440  -0.924

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LEU  90           H        LEU  90  10.931   7.614   2.177
    2    HA   LEU  90           HA       LEU  90  10.441  10.352   2.750
    3    HB2  LEU  90           HB2      LEU  90   9.213   7.791   3.769
    4    HB3  LEU  90           HB3      LEU  90   8.597   9.393   4.189
    5    HG   LEU  90           HG       LEU  90   9.023   8.509   1.322
    6   HD12  LEU  90          HD11      LEU  90   6.485   8.208   1.369
    7   HD11  LEU  90          HD12      LEU  90   6.630   8.195   3.127
    8   HD13  LEU  90          HD13      LEU  90   7.440   6.957   2.167
    9   HD22  LEU  90          HD21      LEU  90   8.754  10.821   1.248
   10   HD21  LEU  90          HD22      LEU  90   7.759  10.863   2.702
   11   HD23  LEU  90          HD23      LEU  90   7.065  10.316   1.176

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  91           H        ILE  91  11.664   7.657   4.678
    2    HA   ILE  91           HA       ILE  91  11.805   9.019   7.148
    3    HB   ILE  91           HB       ILE  91  13.340   6.665   6.032
    4   HG12  ILE  91          HG12      ILE  91  11.313   6.853   8.280
    5   HG13  ILE  91          HG13      ILE  91  10.849   6.577   6.602
    6   HG22  ILE  91          HG21      ILE  91  13.793   6.445   8.676
    7   HG21  ILE  91          HG22      ILE  91  13.736   8.205   8.575
    8   HG23  ILE  91          HG23      ILE  91  14.911   7.305   7.617
    9   HD13  ILE  91          HD11      ILE  91  11.830   4.465   6.537
   10   HD12  ILE  91          HD12      ILE  91  11.228   4.529   8.193
   11   HD11  ILE  91          HD13      ILE  91  12.934   4.824   7.865

  No H/Q in entry =          11
  In of MODEL   90
    1    H    THR  92           H        THR  92  14.036   8.828   4.409
    2    HA   THR  92           HA       THR  92  16.209  10.197   5.582
    3    HB   THR  92           HB       THR  92  15.238  10.084   2.715
    4    HG1  THR  92           HG1      THR  92  16.047   8.178   3.124
    5   HG22  THR  92          HG21      THR  92  17.817  10.747   2.437
    6   HG21  THR  92          HG22      THR  92  17.509  11.571   3.965
    7   HG23  THR  92          HG23      THR  92  16.551  11.969   2.539

  No H/Q in entry =           7
  In of MODEL   90
    1    H    GLU  93           H        GLU  93  13.344  11.382   3.837
    2    HA   GLU  93           HA       GLU  93  13.967  14.136   3.956
    3    HB2  GLU  93           HB2      GLU  93  11.249  12.792   3.954
    4    HB3  GLU  93           HB3      GLU  93  11.556  14.489   3.584
    5    HG2  GLU  93           HG2      GLU  93  12.879  12.233   2.063
    6    HG3  GLU  93           HG3      GLU  93  11.343  12.932   1.568

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LEU  94           H        LEU  94  12.189  11.998   6.156
    2    HA   LEU  94           HA       LEU  94  11.390  13.952   8.028
    3    HB2  LEU  94           HB2      LEU  94  11.933  10.991   8.304
    4    HB3  LEU  94           HB3      LEU  94  11.364  11.972   9.652
    5    HG   LEU  94           HG       LEU  94   9.895  12.040   7.015
    6   HD11  LEU  94          HD11      LEU  94   9.943   9.817   9.018
    7   HD13  LEU  94          HD12      LEU  94   9.651   9.760   7.282
    8   HD12  LEU  94          HD13      LEU  94   8.372  10.290   8.373
    9   HD23  LEU  94          HD21      LEU  94   7.971  12.459   8.604
   10   HD22  LEU  94          HD22      LEU  94   9.223  13.700   8.649
   11   HD21  LEU  94          HD23      LEU  94   9.140  12.484   9.922

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  95           H        ILE  95  14.344  11.991   7.807
    2    HA   ILE  95           HA       ILE  95  15.508  12.900  10.228
    3    HB   ILE  95           HB       ILE  95  16.750  11.819   7.686
    4   HG12  ILE  95          HG12      ILE  95  16.426  10.620  10.452
    5   HG13  ILE  95          HG13      ILE  95  15.264  10.375   9.150
    6   HG21  ILE  95          HG21      ILE  95  17.999  12.612  10.336
    7   HG23  ILE  95          HG22      ILE  95  18.476  13.135   8.719
    8   HG22  ILE  95          HG23      ILE  95  18.762  11.472   9.229
    9   HD13  ILE  95          HD11      ILE  95  16.738   9.081   7.895
   10   HD12  ILE  95          HD12      ILE  95  17.197   8.627   9.533
   11   HD11  ILE  95          HD13      ILE  95  18.167   9.796   8.640

  No H/Q in entry =          11
  In of MODEL   90
    1    H    GLU  96           H        GLU  96  15.694  14.133   6.895
    2    HA   GLU  96           HA       GLU  96  17.560  16.192   7.383
    3    HB2  GLU  96           HB2      GLU  96  16.901  15.538   5.120
    4    HB3  GLU  96           HB3      GLU  96  15.262  16.112   5.411
    5    HG2  GLU  96           HG2      GLU  96  15.854  18.235   4.873
    6    HG3  GLU  96           HG3      GLU  96  17.146  18.221   6.063

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LEU  97           H        LEU  97  14.045  16.042   7.793
    2    HA   LEU  97           HA       LEU  97  13.654  18.780   8.434
    3    HB2  LEU  97           HB2      LEU  97  12.105  16.270   9.039
    4    HB3  LEU  97           HB3      LEU  97  11.605  17.822   9.708
    5    HG   LEU  97           HG       LEU  97  12.100  17.402   6.746
    6   HD12  LEU  97          HD11      LEU  97   9.576  17.301   6.614
    7   HD11  LEU  97          HD12      LEU  97   9.558  17.100   8.364
    8   HD13  LEU  97          HD13      LEU  97  10.331  15.885   7.345
    9   HD23  LEU  97          HD21      LEU  97  10.383  19.384   6.770
   10   HD22  LEU  97          HD22      LEU  97  12.065  19.726   7.171
   11   HD21  LEU  97          HD23      LEU  97  10.868  19.567   8.455

  No H/Q in entry =          11
  In of MODEL   90
    1    H    HIS  98           H        HIS  98  14.434  15.944  10.433
    2    HA   HIS  98           HA       HIS  98  14.276  17.205  12.949
    3    HB2  HIS  98           HB2      HIS  98  16.007  14.930  11.955
    4    HB3  HIS  98           HB3      HIS  98  16.003  15.468  13.637
    5    HD1  HIS  98           HD1      HIS  98  13.800  13.863  11.032
    6    HD2  HIS  98           HD2      HIS  98  13.681  14.782  15.096
    7    HE1  HIS  98           HE1      HIS  98  11.757  12.689  11.973
    8    HE2  HIS  98           HE2      HIS  98  11.665  13.241  14.444

  No H/Q in entry =           8
  In of MODEL   90
    1    H    GLU  99           H        GLU  99  16.841  17.064  10.527
    2    HA   GLU  99           HA       GLU  99  18.833  18.373  12.068
    3    HB2  GLU  99           HB2      GLU  99  19.310  17.082  10.001
    4    HB3  GLU  99           HB3      GLU  99  18.518  18.346   9.056
    5    HG2  GLU  99           HG2      GLU  99  20.140  19.998   9.856
    6    HG3  GLU  99           HG3      GLU  99  20.901  18.787  10.883

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LYS 100           H        LYS 100  16.334  19.564   9.839
    2    HA   LYS 100           HA       LYS 100  17.160  22.292   9.988
    3    HB2  LYS 100           HB2      LYS 100  14.518  21.033   9.219
    4    HB3  LYS 100           HB3      LYS 100  14.837  22.768   9.131
    5    HG2  LYS 100           HG2      LYS 100  16.812  22.298   7.675
    6    HG3  LYS 100           HG3      LYS 100  16.379  20.586   7.689
    7    HD2  LYS 100           HD2      LYS 100  14.195  21.120   6.678
    8    HD3  LYS 100           HD3      LYS 100  14.610  22.835   6.670
    9    HE2  LYS 100           HE2      LYS 100  16.572  22.333   5.221
   10    HE3  LYS 100           HE3      LYS 100  16.088  20.634   5.184
   11    HZ1  LYS 100           HZ1      LYS 100  14.292  22.847   4.341
   12    HZ3  LYS 100           HZ2      LYS 100  14.090  21.180   4.077
   13    HZ2  LYS 100           HZ3      LYS 100  15.315  22.029   3.262

  No H/Q in entry =          13
  In of MODEL   90
    1    H    LEU 101           H        LEU 101  15.030  20.269  11.941
    2    HA   LEU 101           HA       LEU 101  13.879  22.349  13.515
    3    HB2  LEU 101           HB2      LEU 101  14.286  19.394  13.899
    4    HB3  LEU 101           HB3      LEU 101  13.753  20.380  15.258
    5    HG   LEU 101           HG       LEU 101  12.351  20.485  12.581
    6   HD12  LEU 101          HD11      LEU 101  10.667  18.939  13.840
    7   HD11  LEU 101          HD12      LEU 101  12.052  18.510  14.842
    8   HD13  LEU 101          HD13      LEU 101  12.091  18.204  13.105
    9   HD21  LEU 101          HD21      LEU 101  11.688  21.284  15.430
   10   HD23  LEU 101          HD22      LEU 101  10.431  21.073  14.213
   11   HD22  LEU 101          HD23      LEU 101  11.680  22.294  13.983

  No H/Q in entry =          11
  In of MODEL   90
    1    H    LYS 102           H        LYS 102  17.021  21.706  13.094
    2    HA   LYS 102           HA       LYS 102  18.872  22.555  14.177
    3    HB2  LYS 102           HB2      LYS 102  17.069  24.090  15.302
    4    HB3  LYS 102           HB3      LYS 102  17.257  23.024  16.679
    5    HG2  LYS 102           HG2      LYS 102  19.179  25.014  15.521
    6    HG3  LYS 102           HG3      LYS 102  18.784  24.703  17.198
    7    HD2  LYS 102           HD2      LYS 102  20.438  22.773  15.520
    8    HD3  LYS 102           HD3      LYS 102  21.138  24.086  16.457
    9    HE2  LYS 102           HE2      LYS 102  20.705  21.542  17.422
   10    HE3  LYS 102           HE3      LYS 102  20.935  22.980  18.415
   11    HZ2  LYS 102           HZ1      LYS 102  18.949  21.719  19.022
   12    HZ1  LYS 102           HZ2      LYS 102  18.316  21.957  17.470
   13    HZ3  LYS 102           HZ3      LYS 102  18.556  23.283  18.498

  No H/Q in entry =          13
  In of MODEL   90
    1    H    ALA 103           H        ALA 103  16.769  20.972  16.587
    2    HA   ALA 103           HA       ALA 103  18.474  19.740  18.250
    3    HB2  ALA 103           HB1      ALA 103  16.867  17.751  18.235
    4    HB1  ALA 103           HB2      ALA 103  15.987  18.616  16.973
    5    HB3  ALA 103           HB3      ALA 103  16.165  19.333  18.573

  No H/Q in entry =           5
  In of MODEL   90
    1    H1   ALA   1           H3       ALA   1  -1.555  -6.857 -21.493
    2    H2   ALA   1           H2       ALA   1  -2.369  -8.283 -21.045
    3    H3   ALA   1           H1       ALA   1  -0.759  -8.351 -21.592
    4    HA   ALA   1           HA       ALA   1  -1.587  -8.809 -23.593
    5    HB1  ALA   1           HB1      ALA   1  -3.735  -9.502 -23.131
    6    HB2  ALA   1           HB2      ALA   1  -4.152  -7.986 -23.930
    7    HB3  ALA   1           HB3      ALA   1  -4.101  -8.068 -22.171

  No H/Q in entry =           7
  In of MODEL   90
    1    H    GLU   2           H        GLU   2  -2.393  -7.608 -25.586
    2    HA   GLU   2           HA       GLU   2  -0.965  -5.610 -26.454
    3    HB2  GLU   2           HB2      GLU   2  -3.971  -5.641 -26.788
    4    HB3  GLU   2           HB3      GLU   2  -2.834  -4.791 -27.831
    5    HG2  GLU   2           HG2      GLU   2  -2.348  -6.685 -28.984
    6    HG3  GLU   2           HG3      GLU   2  -2.069  -7.596 -27.506

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLU   3           H        GLU   3  -4.115  -4.316 -25.570
    2    HA   GLU   3           HA       GLU   3  -3.041  -1.773 -24.934
    3    HB2  GLU   3           HB2      GLU   3  -5.747  -3.056 -24.617
    4    HB3  GLU   3           HB3      GLU   3  -5.433  -1.445 -23.968
    5    HG2  GLU   3           HG2      GLU   3  -5.054  -0.521 -26.091
    6    HG3  GLU   3           HG3      GLU   3  -4.674  -2.080 -26.815

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LEU   4           H        LEU   4  -4.672  -4.115 -22.765
    2    HA   LEU   4           HA       LEU   4  -4.306  -2.893 -20.371
    3    HB2  LEU   4           HB2      LEU   4  -3.796  -5.840 -20.840
    4    HB3  LEU   4           HB3      LEU   4  -4.201  -5.090 -19.298
    5    HG   LEU   4           HG       LEU   4  -5.961  -5.141 -21.771
    6   HD13  LEU   4          HD11      LEU   4  -7.180  -6.845 -20.782
    7   HD12  LEU   4          HD12      LEU   4  -6.699  -6.392 -19.147
    8   HD11  LEU   4          HD13      LEU   4  -5.567  -7.248 -20.193
    9   HD23  LEU   4          HD21      LEU   4  -7.646  -4.311 -19.912
   10   HD22  LEU   4          HD22      LEU   4  -6.589  -3.151 -20.716
   11   HD21  LEU   4          HD23      LEU   4  -6.179  -3.748 -19.108

  No H/Q in entry =          11
  In of MODEL   90
    1    H    GLU   5           H        GLU   5  -1.821  -4.764 -22.090
    2    HA   GLU   5           HA       GLU   5   0.155  -4.506 -20.042
    3    HB2  GLU   5           HB2      GLU   5   0.099  -5.424 -22.882
    4    HB3  GLU   5           HB3      GLU   5   1.663  -4.983 -22.195
    5    HG2  GLU   5           HG2      GLU   5  -0.114  -6.720 -20.547
    6    HG3  GLU   5           HG3      GLU   5   0.657  -7.456 -21.950

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLU   6           H        GLU   6  -0.443  -2.783 -23.088
    2    HA   GLU   6           HA       GLU   6   1.748  -0.977 -22.807
    3    HB2  GLU   6           HB2      GLU   6   0.608  -1.455 -24.971
    4    HB3  GLU   6           HB3      GLU   6  -0.818  -0.609 -24.372
    5    HG2  GLU   6           HG2      GLU   6   0.442   0.969 -25.681
    6    HG3  GLU   6           HG3      GLU   6   0.658   1.409 -23.989

  No H/Q in entry =           6
  In of MODEL   90
    1    H    VAL   7           H        VAL   7  -1.597  -1.009 -21.780
    2    HA   VAL   7           HA       VAL   7  -1.790   1.705 -20.943
    3    HB   VAL   7           HB       VAL   7  -3.287  -0.796 -20.117
    4   HG11  VAL   7          HG11      VAL   7  -3.632   2.097 -19.302
    5   HG13  VAL   7          HG12      VAL   7  -3.555   0.670 -18.268
    6   HG12  VAL   7          HG13      VAL   7  -4.979   0.958 -19.267
    7   HG21  VAL   7          HG21      VAL   7  -3.418   0.285 -22.505
    8   HG23  VAL   7          HG22      VAL   7  -4.353   1.544 -21.697
    9   HG22  VAL   7          HG23      VAL   7  -4.919  -0.127 -21.675

  No H/Q in entry =           9
  In of MODEL   90
    1    H    VAL   8           H        VAL   8  -0.848  -1.293 -19.297
    2    HA   VAL   8           HA       VAL   8  -0.531  -0.220 -16.699
    3    HB   VAL   8           HB       VAL   8   0.729  -2.584 -18.095
    4   HG11  VAL   8          HG11      VAL   8   1.153  -1.526 -15.292
    5   HG13  VAL   8          HG12      VAL   8   2.375  -1.944 -16.493
    6   HG12  VAL   8          HG13      VAL   8   1.437  -3.215 -15.711
    7   HG23  VAL   8          HG21      VAL   8  -0.784  -3.336 -15.815
    8   HG22  VAL   8          HG22      VAL   8  -1.255  -3.523 -17.501
    9   HG21  VAL   8          HG23      VAL   8  -1.738  -2.085 -16.609

  No H/Q in entry =           9
  In of MODEL   90
    1    H    MET   9           H        MET   9   1.729  -0.546 -19.434
    2    HA   MET   9           HA       MET   9   4.021   0.468 -18.159
    3    HB2  MET   9           HB2      MET   9   3.090   0.519 -21.030
    4    HB3  MET   9           HB3      MET   9   4.617   1.250 -20.538
    5    HG2  MET   9           HG2      MET   9   5.329  -0.913 -19.563
    6    HG3  MET   9           HG3      MET   9   3.812  -1.640 -20.095
    7    HE2  MET   9           HE1      MET   9   7.556  -1.034 -21.254
    8    HE1  MET   9           HE2      MET   9   6.698   0.481 -20.981
    9    HE3  MET   9           HE3      MET   9   7.214   0.048 -22.609

  No H/Q in entry =           9
  In of MODEL   90
    1    H    GLY  10           H        GLY  10   1.366   2.105 -19.849
    2    HA3  GLY  10           HA2      GLY  10   2.362   4.746 -19.597
    3    HA2  GLY  10           HA3      GLY  10   0.668   4.308 -19.811

  No H/Q in entry =           3
  In of MODEL   90
    1    H    LEU  11           H        LEU  11   0.237   2.784 -17.529
    2    HA   LEU  11           HA       LEU  11  -0.277   4.765 -15.570
    3    HB2  LEU  11           HB2      LEU  11  -0.250   1.749 -15.417
    4    HB3  LEU  11           HB3      LEU  11  -0.753   2.777 -14.076
    5    HG   LEU  11           HG       LEU  11  -1.976   2.910 -16.845
    6   HD13  LEU  11          HD11      LEU  11  -2.591   0.773 -16.095
    7   HD12  LEU  11          HD12      LEU  11  -3.931   1.782 -15.556
    8   HD11  LEU  11          HD13      LEU  11  -2.688   1.284 -14.410
    9   HD22  LEU  11          HD21      LEU  11  -2.545   4.932 -15.839
   10   HD21  LEU  11          HD22      LEU  11  -2.487   4.263 -14.209
   11   HD23  LEU  11          HD23      LEU  11  -3.862   3.916 -15.258

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  12           H        ILE  12   2.234   2.266 -15.802
    2    HA   ILE  12           HA       ILE  12   3.434   2.785 -13.292
    3    HB   ILE  12           HB       ILE  12   4.686   1.731 -15.850
    4   HG12  ILE  12          HG12      ILE  12   2.653   0.523 -14.718
    5   HG13  ILE  12          HG13      ILE  12   4.045  -0.430 -15.193
    6   HG23  ILE  12          HG21      ILE  12   6.431   2.456 -14.323
    7   HG22  ILE  12          HG22      ILE  12   6.355   0.696 -14.277
    8   HG21  ILE  12          HG23      ILE  12   5.644   1.644 -12.971
    9   HD13  ILE  12          HD11      ILE  12   4.848  -0.446 -12.907
   10   HD12  ILE  12          HD12      ILE  12   3.160  -0.953 -12.908
   11   HD11  ILE  12          HD13      ILE  12   3.587   0.671 -12.417

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  13           H        ILE  13   4.068   4.043 -16.545
    2    HA   ILE  13           HA       ILE  13   6.225   5.734 -15.808
    3    HB   ILE  13           HB       ILE  13   4.208   5.836 -18.063
    4   HG12  ILE  13          HG12      ILE  13   6.037   3.988 -17.773
    5   HG13  ILE  13          HG13      ILE  13   5.798   4.726 -19.353
    6   HG21  ILE  13          HG21      ILE  13   6.543   7.657 -17.469
    7   HG23  ILE  13          HG22      ILE  13   4.897   8.102 -17.906
    8   HG22  ILE  13          HG23      ILE  13   5.974   7.416 -19.122
    9   HD12  ILE  13          HD11      ILE  13   8.242   4.516 -18.527
   10   HD11  ILE  13          HD12      ILE  13   7.830   5.799 -17.395
   11   HD13  ILE  13          HD13      ILE  13   7.731   6.093 -19.126

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ASN  14           H        ASN  14   2.726   6.276 -16.092
    2    HA   ASN  14           HA       ASN  14   2.717   9.021 -15.452
    3    HB2  ASN  14           HB2      ASN  14   0.806   7.406 -16.293
    4    HB3  ASN  14           HB3      ASN  14   0.474   7.230 -14.575
    5   HD21  ASN  14          HD21      ASN  14  -1.523   8.414 -16.015
    6   HD22  ASN  14          HD22      ASN  14  -1.564  10.088 -15.746

  No H/Q in entry =           6
  In of MODEL   90
    1    H    SER  15           H        SER  15   2.374   6.147 -13.380
    2    HA   SER  15           HA       SER  15   2.074   7.518 -10.931
    3    HB2  SER  15           HB2      SER  15   2.589   5.424  -9.882
    4    HB3  SER  15           HB3      SER  15   1.763   5.017 -11.382
    5    HG   SER  15           HG       SER  15   3.831   4.740 -12.336

  No H/Q in entry =           5
  In of MODEL   90
    1    H    GLY  16           H        GLY  16   4.943   6.386 -12.678
    2    HA3  GLY  16           HA2      GLY  16   6.869   7.115 -10.738
    3    HA2  GLY  16           HA3      GLY  16   7.178   6.911 -12.460

  No H/Q in entry =           3
  In of MODEL   90
    1    H    GLN  17           H        GLN  17   5.518   8.891 -13.529
    2    HA   GLN  17           HA       GLN  17   7.124  11.212 -13.211
    3    HB2  GLN  17           HB2      GLN  17   5.835  10.786 -15.265
    4    HB3  GLN  17           HB3      GLN  17   4.328  10.948 -14.361
    5    HG2  GLN  17           HG2      GLN  17   4.857  13.273 -13.823
    6    HG3  GLN  17           HG3      GLN  17   6.418  13.127 -14.632
    7   HE21  GLN  17          HE21      GLN  17   4.518  15.073 -15.495
    8   HE22  GLN  17          HE22      GLN  17   3.952  14.627 -17.033

  No H/Q in entry =           8
  In of MODEL   90
    1    H    ALA  18           H        ALA  18   4.005  10.231 -11.877
    2    HA   ALA  18           HA       ALA  18   3.303  12.628 -10.612
    3    HB1  ALA  18           HB1      ALA  18   2.145  10.185 -10.843
    4    HB2  ALA  18           HB2      ALA  18   1.606  11.411  -9.697
    5    HB3  ALA  18           HB3      ALA  18   2.678  10.115  -9.163

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ARG  19           H        ARG  19   5.137   9.841  -9.327
    2    HA   ARG  19           HA       ARG  19   5.672  10.990  -6.802
    3    HB2  ARG  19           HB2      ARG  19   6.059   8.582  -7.329
    4    HB3  ARG  19           HB3      ARG  19   7.426   9.053  -8.344
    5    HG2  ARG  19           HG2      ARG  19   8.549  10.078  -6.415
    6    HG3  ARG  19           HG3      ARG  19   7.163   9.705  -5.390
    7    HD2  ARG  19           HD2      ARG  19   8.904   8.049  -5.026
    8    HD3  ARG  19           HD3      ARG  19   7.525   7.284  -5.819
    9    HE   ARG  19           HE       ARG  19   9.248   8.084  -7.857
   10   HH21  ARG  19          HH11      ARG  19  10.796   6.662  -8.701
   11   HH22  ARG  19          HH12      ARG  19  11.321   5.307  -7.765
   12   HH11  ARG  19          HH21      ARG  19   9.283   6.051  -5.080
   13   HH12  ARG  19          HH22      ARG  19  10.462   4.960  -5.713

  No H/Q in entry =          13
  In of MODEL   90
    1    H    SER  20           H        SER  20   7.504  11.001  -9.842
    2    HA   SER  20           HA       SER  20   9.761  12.390  -9.006
    3    HB2  SER  20           HB2      SER  20   9.232  11.369 -11.321
    4    HB3  SER  20           HB3      SER  20   8.475  12.918 -11.674
    5    HG   SER  20           HG       SER  20  10.715  13.578 -10.620

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LEU  21           H        LEU  21   6.682  13.695 -10.216
    2    HA   LEU  21           HA       LEU  21   7.382  16.433  -9.986
    3    HB2  LEU  21           HB2      LEU  21   4.699  15.037  -9.922
    4    HB3  LEU  21           HB3      LEU  21   4.882  16.790  -9.919
    5    HG   LEU  21           HG       LEU  21   6.070  14.990 -12.052
    6   HD13  LEU  21          HD11      LEU  21   3.629  14.807 -12.100
    7   HD12  LEU  21          HD12      LEU  21   4.182  15.775 -13.469
    8   HD11  LEU  21          HD13      LEU  21   3.477  16.564 -12.059
    9   HD23  LEU  21          HD21      LEU  21   5.873  17.329 -13.277
   10   HD22  LEU  21          HD22      LEU  21   7.237  17.040 -12.201
   11   HD21  LEU  21          HD23      LEU  21   5.863  17.978 -11.640

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ALA  22           H        ALA  22   5.834  14.158  -7.747
    2    HA   ALA  22           HA       ALA  22   5.241  15.970  -5.681
    3    HB3  ALA  22           HB1      ALA  22   4.455  13.586  -5.851
    4    HB2  ALA  22           HB2      ALA  22   5.041  14.050  -4.253
    5    HB1  ALA  22           HB3      ALA  22   6.059  13.082  -5.320

  No H/Q in entry =           5
  In of MODEL   90
    1    H    TYR  23           H        TYR  23   8.155  13.914  -6.108
    2    HA   TYR  23           HA       TYR  23   9.538  14.917  -3.848
    3    HB2  TYR  23           HB2      TYR  23  10.307  12.901  -5.008
    4    HB3  TYR  23           HB3      TYR  23  10.643  13.841  -6.461
    5    HD1  TYR  23           HD1      TYR  23  11.585  13.452  -2.872
    6    HD2  TYR  23           HD2      TYR  23  12.684  15.017  -6.719
    7    HE1  TYR  23           HE1      TYR  23  13.843  14.001  -2.005
    8    HE2  TYR  23           HE2      TYR  23  14.941  15.567  -5.851
    9    HH   TYR  23           HH       TYR  23  15.877  14.740  -2.514

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ALA  24           H        ALA  24   9.382  16.029  -7.214
    2    HA   ALA  24           HA       ALA  24  11.298  18.095  -6.957
    3    HB2  ALA  24           HB1      ALA  24  10.866  18.163  -9.168
    4    HB3  ALA  24           HB2      ALA  24   9.317  18.928  -8.815
    5    HB1  ALA  24           HB3      ALA  24   9.425  17.174  -8.946

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ALA  25           H        ALA  25   7.814  17.943  -6.352
    2    HA   ALA  25           HA       ALA  25   7.357  20.665  -5.783
    3    HB1  ALA  25           HB1      ALA  25   5.678  18.683  -5.994
    4    HB2  ALA  25           HB2      ALA  25   5.317  19.974  -4.846
    5    HB3  ALA  25           HB3      ALA  25   5.990  18.446  -4.273

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LEU  26           H        LEU  26   8.391  17.974  -3.730
    2    HA   LEU  26           HA       LEU  26   8.498  19.402  -1.292
    3    HB2  LEU  26           HB2      LEU  26   8.571  16.985  -1.288
    4    HB3  LEU  26           HB3      LEU  26  10.045  16.980  -2.251
    5    HG   LEU  26           HG       LEU  26  11.262  18.086  -0.405
    6   HD12  LEU  26          HD11      LEU  26  10.025  18.102   1.849
    7   HD11  LEU  26          HD12      LEU  26   8.541  17.979   0.908
    8   HD13  LEU  26          HD13      LEU  26   9.599  19.375   0.705
    9   HD21  LEU  26          HD21      LEU  26   9.702  15.631   0.459
   10   HD23  LEU  26          HD22      LEU  26  11.219  16.179   1.164
   11   HD22  LEU  26          HD23      LEU  26  11.177  15.622  -0.507

  No H/Q in entry =          11
  In of MODEL   90
    1    H    LYS  27           H        LYS  27  10.921  18.810  -3.805
    2    HA   LYS  27           HA       LYS  27  13.110  20.031  -2.566
    3    HB2  LYS  27           HB2      LYS  27  13.210  18.685  -4.657
    4    HB3  LYS  27           HB3      LYS  27  12.460  20.024  -5.525
    5    HG2  LYS  27           HG2      LYS  27  14.335  21.493  -4.937
    6    HG3  LYS  27           HG3      LYS  27  15.080  20.194  -3.998
    7    HD2  LYS  27           HD2      LYS  27  15.221  18.806  -6.052
    8    HD3  LYS  27           HD3      LYS  27  14.522  20.131  -6.983
    9    HE2  LYS  27           HE2      LYS  27  16.419  21.581  -6.361
   10    HE3  LYS  27           HE3      LYS  27  17.122  20.260  -5.421
   11    HZ3  LYS  27           HZ1      LYS  27  18.123  20.353  -7.603
   12    HZ2  LYS  27           HZ2      LYS  27  16.599  20.248  -8.350
   13    HZ1  LYS  27           HZ3      LYS  27  17.207  18.932  -7.464

  No H/Q in entry =          13
  In of MODEL   90
    1    H    GLN  28           H        GLN  28  10.508  21.436  -4.526
    2    HA   GLN  28           HA       GLN  28  11.490  24.081  -4.673
    3    HB2  GLN  28           HB2      GLN  28   8.648  23.033  -4.575
    4    HB3  GLN  28           HB3      GLN  28   9.075  24.703  -4.946
    5    HG2  GLN  28           HG2      GLN  28  10.061  22.286  -6.490
    6    HG3  GLN  28           HG3      GLN  28   8.736  23.330  -6.999
    7   HE21  GLN  28          HE21      GLN  28  11.887  22.816  -7.694
    8   HE22  GLN  28          HE22      GLN  28  12.380  24.397  -8.068

  No H/Q in entry =           8
  In of MODEL   90
    1    H    ALA  29           H        ALA  29   9.533  22.402  -2.247
    2    HA   ALA  29           HA       ALA  29   8.994  24.598  -0.566
    3    HB2  ALA  29           HB1      ALA  29   8.245  23.034   0.998
    4    HB1  ALA  29           HB2      ALA  29   9.459  21.840   0.538
    5    HB3  ALA  29           HB3      ALA  29   8.080  22.146  -0.517

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LYS  30           H        LYS  30  11.706  22.309  -0.624
    2    HA   LYS  30           HA       LYS  30  13.021  23.251   1.685
    3    HB2  LYS  30           HB2      LYS  30  14.119  21.958  -0.821
    4    HB3  LYS  30           HB3      LYS  30  15.098  22.308   0.605
    5    HG2  LYS  30           HG2      LYS  30  13.527  20.937   1.977
    6    HG3  LYS  30           HG3      LYS  30  12.646  20.523   0.503
    7    HD2  LYS  30           HD2      LYS  30  14.687  19.521  -0.450
    8    HD3  LYS  30           HD3      LYS  30  15.588  19.949   1.006
    9    HE2  LYS  30           HE2      LYS  30  14.066  18.528   2.353
   10    HE3  LYS  30           HE3      LYS  30  13.195  18.081   0.881
   11    HZ2  LYS  30           HZ1      LYS  30  14.970  16.488   1.649
   12    HZ1  LYS  30           HZ2      LYS  30  16.119  17.666   1.203
   13    HZ3  LYS  30           HZ3      LYS  30  15.083  16.992   0.033

  No H/Q in entry =          13
  In of MODEL   90
    1    H    GLN  31           H        GLN  31  12.936  24.459  -1.611
    2    HA   GLN  31           HA       GLN  31  15.102  26.335  -1.178
    3    HB2  GLN  31           HB2      GLN  31  13.070  26.399  -3.412
    4    HB3  GLN  31           HB3      GLN  31  14.695  27.082  -3.405
    5    HG2  GLN  31           HG2      GLN  31  15.133  24.382  -2.830
    6    HG3  GLN  31           HG3      GLN  31  13.835  24.339  -4.014
    7   HE21  GLN  31          HE21      GLN  31  16.674  23.524  -4.406
    8   HE22  GLN  31          HE22      GLN  31  17.259  24.494  -5.669

  No H/Q in entry =           8
  In of MODEL   90
    1    H    GLY  32           H        GLY  32  12.021  26.175  -0.047
    2    HA3  GLY  32           HA2      GLY  32  10.871  27.752   1.222
    3    HA2  GLY  32           HA3      GLY  32  12.009  28.979   0.678

  No H/Q in entry =           3
  In of MODEL   90
    1    H    ASP  33           H        ASP  33  10.641  27.087  -1.822
    2    HA   ASP  33           HA       ASP  33   8.998  29.373  -2.683
    3    HB2  ASP  33           HB2      ASP  33  10.079  26.947  -4.123
    4    HB3  ASP  33           HB3      ASP  33   8.940  28.072  -4.857

  No H/Q in entry =           4
  In of MODEL   90
    1    H    PHE  34           H        PHE  34   7.299  28.910  -1.128
    2    HA   PHE  34           HA       PHE  34   5.900  26.448  -1.040
    3    HB2  PHE  34           HB2      PHE  34   4.958  29.242  -0.363
    4    HB3  PHE  34           HB3      PHE  34   4.095  27.758   0.044
    5    HD1  PHE  34           HD1      PHE  34   6.358  30.138   1.270
    6    HD2  PHE  34           HD2      PHE  34   5.646  25.903   1.210
    7    HE1  PHE  34           HE1      PHE  34   7.738  29.875   3.313
    8    HE2  PHE  34           HE2      PHE  34   7.027  25.644   3.251
    9    HZ   PHE  34           HZ       PHE  34   8.067  27.631   4.302

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ALA  35           H        ALA  35   5.501  29.316  -3.051
    2    HA   ALA  35           HA       ALA  35   2.949  28.723  -4.088
    3    HB3  ALA  35           HB1      ALA  35   4.021  30.108  -6.120
    4    HB2  ALA  35           HB2      ALA  35   5.236  30.459  -4.890
    5    HB1  ALA  35           HB3      ALA  35   3.547  30.881  -4.607

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ALA  36           H        ALA  36   6.179  28.026  -5.428
    2    HA   ALA  36           HA       ALA  36   5.189  26.606  -7.677
    3    HB3  ALA  36           HB1      ALA  36   7.352  26.714  -8.283
    4    HB2  ALA  36           HB2      ALA  36   7.819  25.681  -6.931
    5    HB1  ALA  36           HB3      ALA  36   7.726  27.429  -6.715

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ALA  37           H        ALA  37   6.123  25.602  -4.419
    2    HA   ALA  37           HA       ALA  37   6.045  22.814  -4.850
    3    HB2  ALA  37           HB1      ALA  37   5.787  24.606  -2.472
    4    HB1  ALA  37           HB2      ALA  37   6.911  23.279  -2.760
    5    HB3  ALA  37           HB3      ALA  37   5.245  22.938  -2.296

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LYS  38           H        LYS  38   3.523  25.041  -3.692
    2    HA   LYS  38           HA       LYS  38   1.410  23.243  -3.480
    3    HB2  LYS  38           HB2      LYS  38   1.781  25.996  -3.225
    4    HB3  LYS  38           HB3      LYS  38   0.586  25.859  -4.510
    5    HG2  LYS  38           HG2      LYS  38  -0.880  24.546  -3.074
    6    HG3  LYS  38           HG3      LYS  38   0.358  24.475  -1.813
    7    HD2  LYS  38           HD2      LYS  38   0.188  26.813  -1.364
    8    HD3  LYS  38           HD3      LYS  38  -0.715  27.110  -2.851
    9    HE2  LYS  38           HE2      LYS  38  -2.227  27.154  -0.918
   10    HE3  LYS  38           HE3      LYS  38  -2.607  25.782  -1.963
   11    HZ3  LYS  38           HZ1      LYS  38  -1.899  24.304  -0.427
   12    HZ2  LYS  38           HZ2      LYS  38  -2.245  25.563   0.661
   13    HZ1  LYS  38           HZ3      LYS  38  -0.650  25.301   0.143

  No H/Q in entry =          13
  In of MODEL   90
    1    H    ALA  39           H        ALA  39   2.416  25.140  -6.323
    2    HA   ALA  39           HA       ALA  39   0.342  24.290  -8.036
    3    HB2  ALA  39           HB1      ALA  39   3.088  24.918  -9.077
    4    HB1  ALA  39           HB2      ALA  39   2.127  26.186  -8.315
    5    HB3  ALA  39           HB3      ALA  39   1.515  25.354  -9.744

  No H/Q in entry =           5
  In of MODEL   90
    1    H    MET  40           H        MET  40   3.567  22.966  -7.443
    2    HA   MET  40           HA       MET  40   3.464  20.948  -9.436
    3    HB2  MET  40           HB2      MET  40   5.065  21.158  -6.880
    4    HB3  MET  40           HB3      MET  40   5.312  19.901  -8.094
    5    HG2  MET  40           HG2      MET  40   5.394  22.857  -8.757
    6    HG3  MET  40           HG3      MET  40   6.832  21.944  -8.302
    7    HE3  MET  40           HE1      MET  40   7.700  19.724 -11.108
    8    HE2  MET  40           HE2      MET  40   7.127  19.407  -9.473
    9    HE1  MET  40           HE3      MET  40   8.234  20.747  -9.767

  No H/Q in entry =           9
  In of MODEL   90
    1    H    MET  41           H        MET  41   2.534  20.995  -6.016
    2    HA   MET  41           HA       MET  41   1.980  18.234  -5.743
    3    HB2  MET  41           HB2      MET  41   0.658  20.600  -4.396
    4    HB3  MET  41           HB3      MET  41   0.488  18.923  -3.890
    5    HG2  MET  41           HG2      MET  41   3.200  19.126  -3.915
    6    HG3  MET  41           HG3      MET  41   2.770  20.788  -3.520
    7    HE2  MET  41           HE1      MET  41  -0.287  19.556  -1.809
    8    HE1  MET  41           HE2      MET  41   0.543  21.063  -2.181
    9    HE3  MET  41           HE3      MET  41   0.472  20.492  -0.514

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ASP  42           H        ASP  42  -0.035  20.974  -6.724
    2    HA   ASP  42           HA       ASP  42  -2.484  19.631  -6.873
    3    HB2  ASP  42           HB2      ASP  42  -1.758  22.196  -7.124
    4    HB3  ASP  42           HB3      ASP  42  -1.904  21.804  -8.833

  No H/Q in entry =           4
  In of MODEL   90
    1    H    GLN  43           H        GLN  43  -0.028  20.206  -9.363
    2    HA   GLN  43           HA       GLN  43  -1.415  18.898 -11.460
    3    HB2  GLN  43           HB2      GLN  43   1.545  19.393 -11.064
    4    HB3  GLN  43           HB3      GLN  43   0.834  18.759 -12.550
    5    HG2  GLN  43           HG2      GLN  43  -0.664  20.797 -12.597
    6    HG3  GLN  43           HG3      GLN  43   0.288  21.445 -11.264
    7   HE21  GLN  43          HE21      GLN  43   0.470  23.066 -13.348
    8   HE22  GLN  43          HE22      GLN  43   1.887  22.836 -14.250

  No H/Q in entry =           8
  In of MODEL   90
    1    H    SER  44           H        SER  44   0.917  17.740  -9.059
    2    HA   SER  44           HA       SER  44   1.238  15.132 -10.085
    3    HB2  SER  44           HB2      SER  44   2.133  16.563  -7.843
    4    HB3  SER  44           HB3      SER  44   1.258  15.185  -7.177
    5    HG   SER  44           HG       SER  44   3.367  14.551  -7.595

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ARG  45           H        ARG  45  -1.083  16.464  -7.756
    2    HA   ARG  45           HA       ARG  45  -2.488  14.112  -7.129
    3    HB2  ARG  45           HB2      ARG  45  -2.678  16.281  -5.937
    4    HB3  ARG  45           HB3      ARG  45  -3.523  16.954  -7.327
    5    HG2  ARG  45           HG2      ARG  45  -5.302  15.240  -7.053
    6    HG3  ARG  45           HG3      ARG  45  -4.468  14.622  -5.627
    7    HD2  ARG  45           HD2      ARG  45  -4.664  16.889  -4.570
    8    HD3  ARG  45           HD3      ARG  45  -5.641  17.416  -5.957
    9    HE   ARG  45           HE       ARG  45  -6.772  15.047  -4.923
   10   HH21  ARG  45          HH11      ARG  45  -8.613  15.133  -3.661
   11   HH22  ARG  45          HH12      ARG  45  -9.002  16.575  -2.793
   12   HH11  ARG  45          HH21      ARG  45  -6.209  18.289  -3.894
   13   HH12  ARG  45          HH22      ARG  45  -7.636  18.362  -2.923

  No H/Q in entry =          13
  In of MODEL   90
    1    H    MET  46           H        MET  46  -3.045  16.522  -9.681
    2    HA   MET  46           HA       MET  46  -5.387  15.366 -10.754
    3    HB2  MET  46           HB2      MET  46  -3.269  17.183 -11.913
    4    HB3  MET  46           HB3      MET  46  -4.644  16.632 -12.875
    5    HG2  MET  46           HG2      MET  46  -6.202  17.570 -11.241
    6    HG3  MET  46           HG3      MET  46  -4.865  18.055 -10.205
    7    HE1  MET  46           HE1      MET  46  -6.658  18.230 -13.409
    8    HE3  MET  46           HE2      MET  46  -5.176  18.473 -14.327
    9    HE2  MET  46           HE3      MET  46  -6.318  19.804 -14.143

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ALA  47           H        ALA  47  -1.958  14.865 -11.497
    2    HA   ALA  47           HA       ALA  47  -2.304  13.141 -13.710
    3    HB3  ALA  47           HB1      ALA  47  -0.122  14.017 -13.347
    4    HB2  ALA  47           HB2      ALA  47   0.007  12.288 -13.014
    5    HB1  ALA  47           HB3      ALA  47  -0.085  13.439 -11.681

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LEU  48           H        LEU  48  -2.054  12.502 -10.235
    2    HA   LEU  48           HA       LEU  48  -2.165   9.663 -10.396
    3    HB2  LEU  48           HB2      LEU  48  -2.928  11.584  -8.184
    4    HB3  LEU  48           HB3      LEU  48  -2.845   9.832  -7.984
    5    HG   LEU  48           HG       LEU  48  -0.531  11.518  -8.970
    6   HD13  LEU  48          HD11      LEU  48  -0.820  12.289  -6.780
    7   HD12  LEU  48          HD12      LEU  48   0.335  10.974  -6.577
    8   HD11  LEU  48          HD13      LEU  48  -1.367  10.722  -6.187
    9   HD22  LEU  48          HD21      LEU  48  -0.043   9.330  -9.610
   10   HD21  LEU  48          HD22      LEU  48  -0.923   8.619  -8.258
   11   HD23  LEU  48          HD23      LEU  48   0.653   9.363  -7.990

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ASN  49           H        ASN  49  -4.615  12.170 -10.004
    2    HA   ASN  49           HA       ASN  49  -6.813  10.518  -9.476
    3    HB2  ASN  49           HB2      ASN  49  -6.837  12.951  -9.160
    4    HB3  ASN  49           HB3      ASN  49  -6.705  13.195 -10.897
    5   HD21  ASN  49          HD21      ASN  49  -8.769  14.313 -10.966
    6   HD22  ASN  49          HD22      ASN  49 -10.232  13.474 -10.790

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLU  50           H        GLU  50  -5.512  11.709 -12.557
    2    HA   GLU  50           HA       GLU  50  -7.466  10.466 -14.212
    3    HB2  GLU  50           HB2      GLU  50  -5.985  12.277 -15.018
    4    HB3  GLU  50           HB3      GLU  50  -4.599  11.196 -14.874
    5    HG2  GLU  50           HG2      GLU  50  -5.574   9.668 -16.517
    6    HG3  GLU  50           HG3      GLU  50  -7.028  10.655 -16.611

  No H/Q in entry =           6
  In of MODEL   90
    1    H    ALA  51           H        ALA  51  -4.307   9.454 -12.992
    2    HA   ALA  51           HA       ALA  51  -4.176   7.001 -14.411
    3    HB2  ALA  51           HB1      ALA  51  -2.202   6.701 -13.302
    4    HB1  ALA  51           HB2      ALA  51  -2.895   7.126 -11.737
    5    HB3  ALA  51           HB3      ALA  51  -2.426   8.395 -12.869

  No H/Q in entry =           5
  In of MODEL   90
    1    H    HIS  52           H        HIS  52  -5.359   7.838 -11.167
    2    HA   HIS  52           HA       HIS  52  -6.065   5.232 -10.341
    3    HB2  HIS  52           HB2      HIS  52  -5.920   7.215  -8.842
    4    HB3  HIS  52           HB3      HIS  52  -7.394   7.842  -9.579
    5    HD1  HIS  52           HD1      HIS  52  -9.610   6.477  -9.167
    6    HD2  HIS  52           HD2      HIS  52  -6.320   5.122  -6.997
    7    HE1  HIS  52           HE1      HIS  52 -10.519   4.928  -7.381
    8    HE2  HIS  52           HE2      HIS  52  -8.524   4.093  -6.049

  No H/Q in entry =           8
  In of MODEL   90
    1    H    LEU  53           H        LEU  53  -7.861   7.702 -12.136
    2    HA   LEU  53           HA       LEU  53 -10.374   6.427 -12.162
    3    HB2  LEU  53           HB2      LEU  53  -9.067   8.404 -14.018
    4    HB3  LEU  53           HB3      LEU  53 -10.665   7.744 -14.359
    5    HG   LEU  53           HG       LEU  53  -9.980   9.045 -11.704
    6   HD12  LEU  53          HD11      LEU  53 -11.272  11.017 -12.683
    7   HD11  LEU  53          HD12      LEU  53 -11.047  10.259 -14.260
    8   HD13  LEU  53          HD13      LEU  53  -9.650  10.776 -13.319
    9   HD23  LEU  53          HD21      LEU  53 -12.558   9.455 -11.875
   10   HD22  LEU  53          HD22      LEU  53 -11.992   7.848 -11.439
   11   HD21  LEU  53          HD23      LEU  53 -12.532   8.170 -13.075

  No H/Q in entry =          11
  In of MODEL   90
    1    H    VAL  54           H        VAL  54  -7.614   6.213 -14.386
    2    HA   VAL  54           HA       VAL  54  -8.839   4.451 -16.236
    3    HB   VAL  54           HB       VAL  54  -5.932   4.938 -15.539
    4   HG12  VAL  54          HG11      VAL  54  -5.680   3.853 -17.927
    5   HG11  VAL  54          HG12      VAL  54  -7.216   3.082 -17.532
    6   HG13  VAL  54          HG13      VAL  54  -5.807   2.817 -16.506
    7   HG22  VAL  54          HG21      VAL  54  -6.683   6.887 -16.586
    8   HG21  VAL  54          HG22      VAL  54  -7.877   6.032 -17.561
    9   HG23  VAL  54          HG23      VAL  54  -6.169   5.941 -17.983

  No H/Q in entry =           9
  In of MODEL   90
    1    H    GLN  55           H        GLN  55  -6.859   3.890 -13.327
    2    HA   GLN  55           HA       GLN  55  -6.787   1.073 -13.585
    3    HB2  GLN  55           HB2      GLN  55  -5.233   1.957 -12.057
    4    HB3  GLN  55           HB3      GLN  55  -6.447   2.931 -11.233
    5    HG2  GLN  55           HG2      GLN  55  -7.154   1.178  -9.920
    6    HG3  GLN  55           HG3      GLN  55  -6.931  -0.010 -11.198
    7   HE21  GLN  55          HE21      GLN  55  -5.320  -1.471 -10.696
    8   HE22  GLN  55          HE22      GLN  55  -3.938  -1.130  -9.777

  No H/Q in entry =           8
  In of MODEL   90
    1    H    THR  56           H        THR  56  -9.111   3.250 -11.981
    2    HA   THR  56           HA       THR  56 -10.715   1.377 -10.700
    3    HB   THR  56           HB       THR  56 -11.585   3.888 -12.164
    4    HG1  THR  56           HG1      THR  56 -10.530   3.302  -9.647
    5   HG22  THR  56          HG21      THR  56 -13.521   3.766 -10.555
    6   HG21  THR  56          HG22      THR  56 -12.993   2.136 -10.135
    7   HG23  THR  56          HG23      THR  56 -13.518   2.498 -11.779

  No H/Q in entry =           7
  In of MODEL   90
    1    H    LYS  57           H        LYS  57 -10.892   2.464 -14.087
    2    HA   LYS  57           HA       LYS  57 -13.056   0.792 -14.852
    3    HB2  LYS  57           HB2      LYS  57 -12.157   2.739 -16.163
    4    HB3  LYS  57           HB3      LYS  57 -10.725   1.786 -16.526
    5    HG2  LYS  57           HG2      LYS  57 -12.001   0.188 -17.783
    6    HG3  LYS  57           HG3      LYS  57 -13.525   0.883 -17.241
    7    HD2  LYS  57           HD2      LYS  57 -12.617   1.489 -19.627
    8    HD3  LYS  57           HD3      LYS  57 -13.311   2.763 -18.627
    9    HE2  LYS  57           HE2      LYS  57 -11.129   3.542 -17.956
   10    HE3  LYS  57           HE3      LYS  57 -10.334   2.140 -18.672
   11    HZ3  LYS  57           HZ1      LYS  57 -10.248   3.175 -20.605
   12    HZ2  LYS  57           HZ2      LYS  57 -10.900   4.567 -19.880
   13    HZ1  LYS  57           HZ3      LYS  57 -11.925   3.425 -20.611

  No H/Q in entry =          13
  In of MODEL   90
    1    H    LEU  58           H        LEU  58  -9.555   0.336 -14.777
    2    HA   LEU  58           HA       LEU  58  -9.574  -2.180 -16.067
    3    HB2  LEU  58           HB2      LEU  58  -7.541  -0.904 -14.248
    4    HB3  LEU  58           HB3      LEU  58  -7.286  -2.426 -15.101
    5    HG   LEU  58           HG       LEU  58  -8.014   0.184 -16.467
    6   HD11  LEU  58          HD11      LEU  58  -5.380  -1.072 -15.763
    7   HD13  LEU  58          HD12      LEU  58  -5.864   0.622 -15.716
    8   HD12  LEU  58          HD13      LEU  58  -5.522  -0.151 -17.261
    9   HD22  LEU  58          HD21      LEU  58  -8.593  -1.374 -18.062
   10   HD21  LEU  58          HD22      LEU  58  -7.564  -2.629 -17.375
   11   HD23  LEU  58          HD23      LEU  58  -6.859  -1.360 -18.376

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  59           H        ILE  59 -10.407  -1.273 -12.820
    2    HA   ILE  59           HA       ILE  59 -10.080  -4.043 -11.872
    3    HB   ILE  59           HB       ILE  59  -9.630  -1.777 -10.471
    4   HG12  ILE  59          HG12      ILE  59 -11.012  -4.129  -9.160
    5   HG13  ILE  59          HG13      ILE  59  -9.363  -4.205  -9.730
    6   HG23  ILE  59          HG21      ILE  59 -11.465  -1.084  -9.160
    7   HG22  ILE  59          HG22      ILE  59 -12.408  -2.505  -9.546
    8   HG21  ILE  59          HG23      ILE  59 -12.164  -1.245 -10.753
    9   HD13  ILE  59          HD11      ILE  59  -9.244  -3.610  -7.424
   10   HD12  ILE  59          HD12      ILE  59 -10.476  -2.371  -7.616
   11   HD11  ILE  59          HD13      ILE  59  -8.878  -2.146  -8.330

  No H/Q in entry =          11
  In of MODEL   90
    1    H    GLU  60           H        GLU  60 -12.618  -1.709 -12.693
    2    HA   GLU  60           HA       GLU  60 -14.818  -3.211 -11.692
    3    HB2  GLU  60           HB2      GLU  60 -15.036  -0.847 -12.275
    4    HB3  GLU  60           HB3      GLU  60 -14.665  -1.204 -13.960
    5    HG2  GLU  60           HG2      GLU  60 -16.696  -2.627 -14.091
    6    HG3  GLU  60           HG3      GLU  60 -17.080  -2.208 -12.434

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLY  61           H        GLY  61 -13.128  -3.206 -14.798
    2    HA3  GLY  61           HA2      GLY  61 -14.851  -5.439 -15.698
    3    HA2  GLY  61           HA3      GLY  61 -13.993  -4.340 -16.771

  No H/Q in entry =           3
  In of MODEL   90
    1    H    ASP  62           H        ASP  62 -12.644  -5.797 -13.880
    2    HA   ASP  62           HA       ASP  62 -10.350  -6.740 -15.282
    3    HB2  ASP  62           HB2      ASP  62  -9.730  -7.680 -13.080
    4    HB3  ASP  62           HB3      ASP  62 -10.245  -6.000 -12.955

  No H/Q in entry =           4
  In of MODEL   90
    1    H    ALA  63           H        ALA  63 -12.530  -7.933 -16.587
    2    HA   ALA  63           HA       ALA  63 -13.158 -10.571 -15.713
    3    HB2  ALA  63           HB1      ALA  63 -12.960  -9.595 -18.582
    4    HB3  ALA  63           HB2      ALA  63 -14.329  -9.228 -17.534
    5    HB1  ALA  63           HB3      ALA  63 -13.973 -10.901 -17.968

  No H/Q in entry =           5
  In of MODEL   90
    1    H    GLY  64           H        GLY  64 -10.611  -9.242 -17.750
    2    HA3  GLY  64           HA2      GLY  64  -8.677 -10.123 -18.610
    3    HA2  GLY  64           HA3      GLY  64  -8.628 -11.083 -17.137

  No H/Q in entry =           3
  In of MODEL   90
    1    H    GLU  65           H        GLU  65  -8.173 -13.129 -17.737
    2    HA   GLU  65           HA       GLU  65  -8.780 -14.240 -20.240
    3    HB2  GLU  65           HB2      GLU  65  -8.122 -15.564 -17.612
    4    HB3  GLU  65           HB3      GLU  65  -8.254 -16.433 -19.141
    5    HG2  GLU  65           HG2      GLU  65  -6.495 -15.049 -20.120
    6    HG3  GLU  65           HG3      GLU  65  -6.393 -14.095 -18.641

  No H/Q in entry =           6
  In of MODEL   90
    1    H    GLY  66           H        GLY  66  -9.797 -16.656 -19.935
    2    HA3  GLY  66           HA2      GLY  66 -12.577 -16.331 -20.127
    3    HA2  GLY  66           HA3      GLY  66 -11.722 -17.859 -20.055

  No H/Q in entry =           3
  In of MODEL   90
    1    H    LYS  67           H        LYS  67 -10.580 -17.487 -17.479
    2    HA   LYS  67           HA       LYS  67 -12.791 -18.368 -15.884
    3    HB2  LYS  67           HB2      LYS  67  -9.848 -18.057 -15.317
    4    HB3  LYS  67           HB3      LYS  67 -11.006 -18.719 -14.155
    5    HG2  LYS  67           HG2      LYS  67 -11.683 -20.433 -15.794
    6    HG3  LYS  67           HG3      LYS  67 -10.538 -19.777 -16.961
    7    HD2  LYS  67           HD2      LYS  67  -8.669 -20.320 -15.464
    8    HD3  LYS  67           HD3      LYS  67  -9.802 -20.931 -14.256
    9    HE2  LYS  67           HE2      LYS  67  -9.113 -22.883 -15.392
   10    HE3  LYS  67           HE3      LYS  67 -10.657 -22.487 -16.147
   11    HZ3  LYS  67           HZ1      LYS  67  -9.670 -21.888 -18.068
   12    HZ2  LYS  67           HZ2      LYS  67  -8.453 -22.943 -17.530
   13    HZ1  LYS  67           HZ3      LYS  67  -8.286 -21.267 -17.312

  No H/Q in entry =          13
  In of MODEL   90
    1    H    MET  68           H        MET  68 -13.400 -17.655 -13.861
    2    HA   MET  68           HA       MET  68 -14.195 -15.051 -13.593
    3    HB2  MET  68           HB2      MET  68 -13.663 -17.133 -11.479
    4    HB3  MET  68           HB3      MET  68 -14.468 -15.599 -11.150
    5    HG2  MET  68           HG2      MET  68 -16.296 -16.129 -12.566
    6    HG3  MET  68           HG3      MET  68 -15.414 -17.445 -13.344
    7    HE3  MET  68           HE1      MET  68 -14.824 -17.097  -9.526
    8    HE2  MET  68           HE2      MET  68 -16.407 -17.505  -8.868
    9    HE1  MET  68           HE3      MET  68 -16.225 -16.077  -9.885

  No H/Q in entry =           9
  In of MODEL   90
    1    H    LYS  69           H        LYS  69 -10.965 -15.913 -13.439
    2    HA   LYS  69           HA       LYS  69 -10.078 -14.349 -11.252
    3    HB2  LYS  69           HB2      LYS  69  -8.703 -15.563 -13.629
    4    HB3  LYS  69           HB3      LYS  69  -7.816 -14.565 -12.476
    5    HG2  LYS  69           HG2      LYS  69  -8.322 -16.029 -10.664
    6    HG3  LYS  69           HG3      LYS  69  -9.564 -16.867 -11.590
    7    HD2  LYS  69           HD2      LYS  69  -7.256 -18.026 -11.311
    8    HD3  LYS  69           HD3      LYS  69  -7.982 -17.999 -12.918
    9    HE2  LYS  69           HE2      LYS  69  -6.582 -16.202 -13.630
   10    HE3  LYS  69           HE3      LYS  69  -6.063 -15.860 -11.980
   11    HZ1  LYS  69           HZ1      LYS  69  -5.517 -18.429 -13.355
   12    HZ3  LYS  69           HZ2      LYS  69  -4.845 -17.866 -11.900
   13    HZ2  LYS  69           HZ3      LYS  69  -4.437 -17.121 -13.373

  No H/Q in entry =          13
  In of MODEL   90
    1    H    VAL  70           H        VAL  70  -7.960 -12.818 -12.055
    2    HA   VAL  70           HA       VAL  70  -9.117 -10.645 -13.700
    3    HB   VAL  70           HB       VAL  70  -8.169  -9.028 -12.086
    4   HG12  VAL  70          HG11      VAL  70  -9.835  -9.426 -10.291
    5   HG11  VAL  70          HG12      VAL  70 -10.052 -11.076 -10.875
    6   HG13  VAL  70          HG13      VAL  70 -10.526  -9.713 -11.887
    7   HG23  VAL  70          HG21      VAL  70  -7.659 -10.170  -9.746
    8   HG22  VAL  70          HG22      VAL  70  -6.399 -10.076 -10.976
    9   HG21  VAL  70          HG23      VAL  70  -7.292 -11.578 -10.742

  No H/Q in entry =           9
  In of MODEL   90
    1    H    SER  71           H        SER  71  -7.456  -9.124 -14.470
    2    HA   SER  71           HA       SER  71  -5.265 -10.433 -15.711
    3    HB2  SER  71           HB2      SER  71  -6.372  -8.373 -16.598
    4    HB3  SER  71           HB3      SER  71  -5.668  -7.464 -15.264
    5    HG   SER  71           HG       SER  71  -4.470  -8.600 -17.513

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LEU  72           H        LEU  72  -3.221 -10.707 -15.079
    2    HA   LEU  72           HA       LEU  72  -2.514 -10.497 -12.363
    3    HB2  LEU  72           HB2      LEU  72  -0.850 -10.939 -14.837
    4    HB3  LEU  72           HB3      LEU  72  -0.197 -11.015 -13.204
    5    HG   LEU  72           HG       LEU  72  -2.558 -12.690 -14.117
    6   HD11  LEU  72          HD11      LEU  72  -0.393 -13.133 -15.384
    7   HD13  LEU  72          HD12      LEU  72  -1.038 -14.509 -14.490
    8   HD12  LEU  72          HD13      LEU  72   0.319 -13.591 -13.836
    9   HD22  LEU  72          HD21      LEU  72  -2.556 -12.675 -11.760
   10   HD21  LEU  72          HD22      LEU  72  -0.804 -12.614 -11.653
   11   HD23  LEU  72          HD23      LEU  72  -1.604 -14.107 -12.135

  No H/Q in entry =          11
  In of MODEL   90
    1    H    VAL  73           H        VAL  73  -1.767  -8.487 -15.140
    2    HA   VAL  73           HA       VAL  73   0.161  -6.803 -14.026
    3    HB   VAL  73           HB       VAL  73  -0.161  -5.423 -15.899
    4   HG13  VAL  73          HG11      VAL  73  -0.155  -6.969 -17.706
    5   HG12  VAL  73          HG12      VAL  73  -1.232  -8.080 -16.862
    6   HG11  VAL  73          HG13      VAL  73   0.433  -7.886 -16.320
    7   HG23  VAL  73          HG21      VAL  73  -2.315  -5.640 -17.263
    8   HG22  VAL  73          HG22      VAL  73  -2.469  -4.833 -15.704
    9   HG21  VAL  73          HG23      VAL  73  -2.986  -6.511 -15.884

  No H/Q in entry =           9
  In of MODEL   90
    1    H    LEU  74           H        LEU  74  -3.240  -6.892 -13.487
    2    HA   LEU  74           HA       LEU  74  -3.841  -4.231 -12.879
    3    HB2  LEU  74           HB2      LEU  74  -5.581  -5.885 -13.063
    4    HB3  LEU  74           HB3      LEU  74  -4.906  -6.811 -11.725
    5    HG   LEU  74           HG       LEU  74  -5.360  -4.921 -10.191
    6   HD12  LEU  74          HD11      LEU  74  -6.946  -3.140 -11.168
    7   HD11  LEU  74          HD12      LEU  74  -6.375  -3.672 -12.749
    8   HD13  LEU  74          HD13      LEU  74  -5.238  -2.997 -11.581
    9   HD23  LEU  74          HD21      LEU  74  -7.915  -5.351 -11.653
   10   HD22  LEU  74          HD22      LEU  74  -7.546  -5.489  -9.946
   11   HD21  LEU  74          HD23      LEU  74  -7.064  -6.766 -11.037

  No H/Q in entry =          11
  In of MODEL   90
    1    H    VAL  75           H        VAL  75  -2.833  -6.826 -10.711
    2    HA   VAL  75           HA       VAL  75  -2.635  -5.275  -8.366
    3    HB   VAL  75           HB       VAL  75  -1.167  -7.788  -9.153
    4   HG13  VAL  75          HG11      VAL  75   0.129  -6.587  -7.435
    5   HG12  VAL  75          HG12      VAL  75  -0.713  -7.933  -6.683
    6   HG11  VAL  75          HG13      VAL  75  -1.336  -6.302  -6.500
    7   HG23  VAL  75          HG21      VAL  75  -3.529  -7.240  -7.319
    8   HG22  VAL  75          HG22      VAL  75  -2.832  -8.824  -7.658
    9   HG21  VAL  75          HG23      VAL  75  -3.650  -7.928  -8.939

  No H/Q in entry =           9
  In of MODEL   90
    1    H    GLU  76           H        GLU  76  -0.218  -6.055 -10.889
    2    HA   GLU  76           HA       GLU  76   1.971  -4.725  -9.720
    3    HB2  GLU  76           HB2      GLU  76   2.175  -6.202 -11.701
    4    HB3  GLU  76           HB3      GLU  76   1.277  -5.039 -12.663
    5    HG2  GLU  76           HG2      GLU  76   3.619  -4.720 -13.145
    6    HG3  GLU  76           HG3      GLU  76   3.105  -3.344 -12.189

  No H/Q in entry =           6
  In of MODEL   90
    1    H    ALA  77           H        ALA  77  -0.539  -3.504 -11.923
    2    HA   ALA  77           HA       ALA  77   0.473  -0.866 -12.093
    3    HB3  ALA  77           HB1      ALA  77  -2.427  -1.717 -12.301
    4    HB1  ALA  77           HB2      ALA  77  -1.256  -1.878 -13.611
    5    HB2  ALA  77           HB3      ALA  77  -1.684  -0.278 -13.005

  No H/Q in entry =           5
  In of MODEL   90
    1    H    GLN  78           H        GLN  78  -1.820  -2.403  -9.895
    2    HA   GLN  78           HA       GLN  78  -2.617  -0.078  -8.499
    3    HB2  GLN  78           HB2      GLN  78  -3.746  -2.329  -8.419
    4    HB3  GLN  78           HB3      GLN  78  -2.418  -2.900  -7.411
    5    HG2  GLN  78           HG2      GLN  78  -2.928  -1.160  -5.748
    6    HG3  GLN  78           HG3      GLN  78  -4.255  -0.582  -6.753
    7   HE21  GLN  78          HE21      GLN  78  -4.701  -1.582  -4.087
    8   HE22  GLN  78          HE22      GLN  78  -5.593  -3.021  -4.211

  No H/Q in entry =           8
  In of MODEL   90
    1    H    LEU  79           H        LEU  79   0.042  -2.354  -8.033
    2    HA   LEU  79           HA       LEU  79   1.011  -1.464  -5.570
    3    HB2  LEU  79           HB2      LEU  79   1.872  -3.479  -6.633
    4    HB3  LEU  79           HB3      LEU  79   2.533  -2.532  -7.962
    5    HG   LEU  79           HG       LEU  79   4.088  -1.404  -6.450
    6   HD13  LEU  79          HD11      LEU  79   3.073  -1.151  -4.389
    7   HD12  LEU  79          HD12      LEU  79   4.140  -2.508  -4.038
    8   HD11  LEU  79          HD13      LEU  79   2.435  -2.795  -4.378
    9   HD23  LEU  79          HD21      LEU  79   5.278  -3.560  -5.539
   10   HD22  LEU  79          HD22      LEU  79   5.087  -3.360  -7.278
   11   HD21  LEU  79          HD23      LEU  79   3.996  -4.422  -6.392

  No H/Q in entry =          11
  In of MODEL   90
    1    H    HIS  80           H        HIS  80   1.908  -0.353  -8.838
    2    HA   HIS  80           HA       HIS  80   3.723   1.622  -7.906
    3    HB2  HIS  80           HB2      HIS  80   2.444   0.936 -10.496
    4    HB3  HIS  80           HB3      HIS  80   3.049   2.584 -10.322
    5    HD1  HIS  80           HD1      HIS  80   5.455   2.868 -10.830
    6    HD2  HIS  80           HD2      HIS  80   4.604  -1.037  -9.643
    7    HE1  HIS  80           HE1      HIS  80   7.638   1.577 -10.983
    8    HE2  HIS  80           HE2      HIS  80   7.130  -0.806 -10.262

  No H/Q in entry =           8
  In of MODEL   90
    1    H    LEU  81           H        LEU  81   0.326   1.804  -8.905
    2    HA   LEU  81           HA       LEU  81   0.067   4.598  -8.577
    3    HB2  LEU  81           HB2      LEU  81  -1.962   2.365  -8.509
    4    HB3  LEU  81           HB3      LEU  81  -2.405   4.071  -8.420
    5    HG   LEU  81           HG       LEU  81  -0.705   2.910 -10.646
    6   HD12  LEU  81          HD11      LEU  81  -2.928   3.243 -11.958
    7   HD11  LEU  81          HD12      LEU  81  -3.693   3.180 -10.371
    8   HD13  LEU  81          HD13      LEU  81  -2.755   1.806 -10.953
    9   HD23  LEU  81          HD21      LEU  81  -1.783   5.061 -11.750
   10   HD22  LEU  81          HD22      LEU  81  -0.372   5.223 -10.708
   11   HD21  LEU  81          HD23      LEU  81  -1.978   5.581 -10.078

  No H/Q in entry =          11
  In of MODEL   90
    1    H    MET  82           H        MET  82  -0.622   1.915  -6.332
    2    HA   MET  82           HA       MET  82  -1.677   3.508  -4.251
    3    HB2  MET  82           HB2      MET  82  -0.319   0.813  -4.282
    4    HB3  MET  82           HB3      MET  82  -0.902   1.541  -2.787
    5    HG2  MET  82           HG2      MET  82  -2.623   1.058  -5.239
    6    HG3  MET  82           HG3      MET  82  -2.559  -0.017  -3.843
    7    HE3  MET  82           HE1      MET  82  -4.290   1.643  -1.039
    8    HE2  MET  82           HE2      MET  82  -2.557   1.911  -1.213
    9    HE1  MET  82           HE3      MET  82  -3.251   0.357  -1.671

  No H/Q in entry =           9
  In of MODEL   90
    1    H    THR  83           H        THR  83   1.621   2.404  -4.920
    2    HA   THR  83           HA       THR  83   2.831   3.501  -2.613
    3    HB   THR  83           HB       THR  83   4.934   3.434  -4.074
    4    HG1  THR  83           HG1      THR  83   4.704   2.909  -6.099
    5   HG22  THR  83          HG21      THR  83   4.478   0.778  -4.408
    6   HG21  THR  83          HG22      THR  83   3.184   1.165  -3.276
    7   HG23  THR  83          HG23      THR  83   4.862   1.499  -2.846

  No H/Q in entry =           7
  In of MODEL   90
    1    H    SER  84           H        SER  84   2.487   4.782  -5.915
    2    HA   SER  84           HA       SER  84   3.837   7.215  -5.452
    3    HB2  SER  84           HB2      SER  84   1.775   6.394  -7.484
    4    HB3  SER  84           HB3      SER  84   2.462   8.018  -7.454
    5    HG   SER  84           HG       SER  84   3.823   5.535  -7.737

  No H/Q in entry =           5
  In of MODEL   90
    1    H    MET  85           H        MET  85   0.338   6.478  -5.301
    2    HA   MET  85           HA       MET  85  -0.512   9.093  -4.705
    3    HB2  MET  85           HB2      MET  85  -2.043   7.298  -5.383
    4    HB3  MET  85           HB3      MET  85  -1.765   6.483  -3.845
    5    HG2  MET  85           HG2      MET  85  -2.648   8.439  -2.635
    6    HG3  MET  85           HG3      MET  85  -2.904   9.274  -4.167
    7    HE3  MET  85           HE1      MET  85  -6.147   8.216  -5.441
    8    HE2  MET  85           HE2      MET  85  -4.520   8.348  -6.104
    9    HE1  MET  85           HE3      MET  85  -5.093   9.549  -4.951

  No H/Q in entry =           9
  In of MODEL   90
    1    H    LEU  86           H        LEU  86   0.379   6.426  -2.556
    2    HA   LEU  86           HA       LEU  86  -0.161   7.731  -0.117
    3    HB2  LEU  86           HB2      LEU  86   0.291   5.258  -0.509
    4    HB3  LEU  86           HB3      LEU  86   2.001   5.677  -0.593
    5    HG   LEU  86           HG       LEU  86   1.670   6.840   1.673
    6   HD11  LEU  86          HD11      LEU  86  -1.026   6.090   1.186
    7   HD13  LEU  86          HD12      LEU  86  -0.364   6.833   2.640
    8   HD12  LEU  86          HD13      LEU  86  -0.466   5.078   2.520
    9   HD23  LEU  86          HD21      LEU  86   1.221   3.850   1.792
   10   HD22  LEU  86          HD22      LEU  86   2.224   4.853   2.838
   11   HD21  LEU  86          HD23      LEU  86   2.733   4.525   1.182

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ALA  87           H        ALA  87   2.829   7.418  -1.989
    2    HA   ALA  87           HA       ALA  87   4.534   8.816  -0.254
    3    HB3  ALA  87           HB1      ALA  87   4.638   7.804  -2.960
    4    HB2  ALA  87           HB2      ALA  87   5.969   8.125  -1.852
    5    HB1  ALA  87           HB3      ALA  87   5.369   9.410  -2.899

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ARG  88           H        ARG  88   2.611   9.966  -2.985
    2    HA   ARG  88           HA       ARG  88   3.404  12.650  -2.863
    3    HB2  ARG  88           HB2      ARG  88   2.152  11.507  -4.728
    4    HB3  ARG  88           HB3      ARG  88   0.690  11.661  -3.753
    5    HG2  ARG  88           HG2      ARG  88   1.728  14.234  -3.663
    6    HG3  ARG  88           HG3      ARG  88   2.158  13.717  -5.291
    7    HD2  ARG  88           HD2      ARG  88   0.021  13.813  -6.001
    8    HD3  ARG  88           HD3      ARG  88  -0.580  12.964  -4.577
    9    HE   ARG  88           HE       ARG  88  -0.746  15.743  -4.995
   10   HH21  ARG  88          HH11      ARG  88  -1.274  17.076  -3.260
   11   HH22  ARG  88          HH12      ARG  88  -0.991  16.536  -1.640
   12   HH11  ARG  88          HH21      ARG  88   0.238  13.472  -2.616
   13   HH12  ARG  88          HH22      ARG  88  -0.152  14.490  -1.276

  No H/Q in entry =          13
  In of MODEL   90
    1    H    GLU  89           H        GLU  89   0.678  10.996  -1.239
    2    HA   GLU  89           HA       GLU  89  -0.418  13.316  -0.039
    3    HB2  GLU  89           HB2      GLU  89  -1.553  11.086  -0.134
    4    HB3  GLU  89           HB3      GLU  89  -0.441  10.521   1.113
    5    HG2  GLU  89           HG2      GLU  89  -1.256  12.226   2.669
    6    HG3  GLU  89           HG3      GLU  89  -2.296  12.905   1.420

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LEU  90           H        LEU  90   2.008  11.004   1.148
    2    HA   LEU  90           HA       LEU  90   2.360  12.244   3.680
    3    HB2  LEU  90           HB2      LEU  90   4.127  10.456   2.012
    4    HB3  LEU  90           HB3      LEU  90   4.542  10.968   3.653
    5    HG   LEU  90           HG       LEU  90   1.900   9.645   2.976
    6   HD12  LEU  90          HD11      LEU  90   3.017   7.589   3.990
    7   HD11  LEU  90          HD12      LEU  90   4.548   8.433   3.757
    8   HD13  LEU  90          HD13      LEU  90   3.540   8.034   2.364
    9   HD22  LEU  90          HD21      LEU  90   1.631  10.570   5.097
   10   HD21  LEU  90          HD22      LEU  90   3.345  10.448   5.489
   11   HD23  LEU  90          HD23      LEU  90   2.327   9.009   5.531

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  91           H        ILE  91   3.984  12.615   0.562
    2    HA   ILE  91           HA       ILE  91   5.972  14.428   1.414
    3    HB   ILE  91           HB       ILE  91   4.671  13.950  -1.274
    4   HG12  ILE  91          HG12      ILE  91   7.493  13.438  -0.284
    5   HG13  ILE  91          HG13      ILE  91   6.200  12.251  -0.130
    6   HG22  ILE  91          HG21      ILE  91   6.910  15.278  -1.949
    7   HG21  ILE  91          HG22      ILE  91   6.598  16.081  -0.409
    8   HG23  ILE  91          HG23      ILE  91   5.383  16.121  -1.685
    9   HD13  ILE  91          HD11      ILE  91   6.037  11.931  -2.438
   10   HD12  ILE  91          HD12      ILE  91   7.772  12.158  -2.214
   11   HD11  ILE  91          HD13      ILE  91   6.777  13.490  -2.806

  No H/Q in entry =          11
  In of MODEL   90
    1    H    THR  92           H        THR  92   2.619  14.891   0.387
    2    HA   THR  92           HA       THR  92   2.619  17.715   0.328
    3    HB   THR  92           HB       THR  92   0.430  15.739   1.014
    4    HG1  THR  92           HG1      THR  92   0.744  15.559  -1.069
    5   HG22  THR  92          HG21      THR  92  -0.947  17.914   0.286
    6   HG21  THR  92          HG22      THR  92   0.449  18.726   0.991
    7   HG23  THR  92          HG23      THR  92  -0.508  17.613   1.967

  No H/Q in entry =           7
  In of MODEL   90
    1    H    GLU  93           H        GLU  93   2.035  15.418   2.978
    2    HA   GLU  93           HA       GLU  93   1.509  17.325   4.994
    3    HB2  GLU  93           HB2      GLU  93   2.796  14.589   5.236
    4    HB3  GLU  93           HB3      GLU  93   2.106  15.521   6.566
    5    HG2  GLU  93           HG2      GLU  93   0.500  14.760   4.117
    6    HG3  GLU  93           HG3      GLU  93   0.585  13.735   5.545

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LEU  94           H        LEU  94   4.508  15.816   3.861
    2    HA   LEU  94           HA       LEU  94   6.259  16.946   5.759
    3    HB2  LEU  94           HB2      LEU  94   6.667  15.977   2.930
    4    HB3  LEU  94           HB3      LEU  94   7.998  16.622   3.887
    5    HG   LEU  94           HG       LEU  94   6.231  14.442   5.011
    6   HD11  LEU  94          HD11      LEU  94   8.337  14.197   2.891
    7   HD13  LEU  94          HD12      LEU  94   6.880  13.237   3.144
    8   HD12  LEU  94          HD13      LEU  94   8.298  12.970   4.159
    9   HD23  LEU  94          HD21      LEU  94   8.409  13.884   6.175
   10   HD22  LEU  94          HD22      LEU  94   7.755  15.468   6.589
   11   HD21  LEU  94          HD23      LEU  94   9.099  15.336   5.454

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  95           H        ILE  95   5.148  18.130   2.604
    2    HA   ILE  95           HA       ILE  95   6.742  20.473   2.554
    3    HB   ILE  95           HB       ILE  95   4.100  19.815   1.234
    4   HG12  ILE  95          HG12      ILE  95   6.898  20.127   0.113
    5   HG13  ILE  95          HG13      ILE  95   6.231  18.579   0.623
    6   HG21  ILE  95          HG21      ILE  95   5.873  22.266   1.025
    7   HG23  ILE  95          HG22      ILE  95   4.146  22.214   1.371
    8   HG22  ILE  95          HG23      ILE  95   4.734  21.809  -0.242
    9   HD13  ILE  95          HD11      ILE  95   4.680  18.519  -1.115
   10   HD12  ILE  95          HD12      ILE  95   6.041  19.325  -1.895
   11   HD11  ILE  95          HD13      ILE  95   4.674  20.272  -1.310

  No H/Q in entry =          11
  In of MODEL   90
    1    H    GLU  96           H        GLU  96   3.480  19.851   3.831
    2    HA   GLU  96           HA       GLU  96   2.881  22.503   4.580
    3    HB2  GLU  96           HB2      GLU  96   1.190  20.736   4.581
    4    HB3  GLU  96           HB3      GLU  96   2.036  19.900   5.881
    5    HG2  GLU  96           HG2      GLU  96   1.019  21.192   7.446
    6    HG3  GLU  96           HG3      GLU  96   1.573  22.661   6.653

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LEU  97           H        LEU  97   4.690  19.934   6.214
    2    HA   LEU  97           HA       LEU  97   5.046  21.278   8.688
    3    HB2  LEU  97           HB2      LEU  97   6.571  19.095   7.281
    4    HB3  LEU  97           HB3      LEU  97   7.159  19.773   8.797
    5    HG   LEU  97           HG       LEU  97   4.340  18.707   8.469
    6   HD12  LEU  97          HD11      LEU  97   5.254  16.685   9.686
    7   HD11  LEU  97          HD12      LEU  97   6.873  17.300   9.352
    8   HD13  LEU  97          HD13      LEU  97   5.807  16.854   8.019
    9   HD23  LEU  97          HD21      LEU  97   4.776  18.407  11.036
   10   HD22  LEU  97          HD22      LEU  97   4.415  20.022  10.430
   11   HD21  LEU  97          HD23      LEU  97   6.080  19.566  10.784

  No H/Q in entry =          11
  In of MODEL   90
    1    H    HIS  98           H        HIS  98   6.934  21.277   5.673
    2    HA   HIS  98           HA       HIS  98   9.098  22.835   6.585
    3    HB2  HIS  98           HB2      HIS  98   7.818  22.594   3.852
    4    HB3  HIS  98           HB3      HIS  98   9.266  23.558   4.151
    5    HD1  HIS  98           HD1      HIS  98   8.019  20.000   4.162
    6    HD2  HIS  98           HD2      HIS  98  11.619  22.060   4.608
    7    HE1  HIS  98           HE1      HIS  98   9.857  18.252   4.114
    8    HE2  HIS  98           HE2      HIS  98  12.053  19.486   4.386

  No H/Q in entry =           8
  In of MODEL   90
    1    H    GLU  99           H        GLU  99   5.893  23.703   5.392
    2    HA   GLU  99           HA       GLU  99   6.300  26.514   5.338
    3    HB2  GLU  99           HB2      GLU  99   4.416  25.364   4.196
    4    HB3  GLU  99           HB3      GLU  99   3.707  25.009   5.771
    5    HG2  GLU  99           HG2      GLU  99   3.548  27.402   6.273
    6    HG3  GLU  99           HG3      GLU  99   4.337  27.795   4.748

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LYS 100           H        LYS 100   5.133  24.288   7.852
    2    HA   LYS 100           HA       LYS 100   4.556  26.347   9.744
    3    HB2  LYS 100           HB2      LYS 100   5.099  23.390  10.091
    4    HB3  LYS 100           HB3      LYS 100   4.656  24.466  11.422
    5    HG2  LYS 100           HG2      LYS 100   2.603  25.126  10.162
    6    HG3  LYS 100           HG3      LYS 100   3.026  23.953   8.911
    7    HD2  LYS 100           HD2      LYS 100   2.920  22.132  10.571
    8    HD3  LYS 100           HD3      LYS 100   2.515  23.298  11.833
    9    HE2  LYS 100           HE2      LYS 100   0.475  23.942  10.559
   10    HE3  LYS 100           HE3      LYS 100   0.869  22.719   9.345
   11    HZ1  LYS 100           HZ1      LYS 100   0.580  22.053  12.223
   12    HZ3  LYS 100           HZ2      LYS 100   0.562  21.000  10.888
   13    HZ2  LYS 100           HZ3      LYS 100  -0.745  22.053  11.161

  No H/Q in entry =          13
  In of MODEL   90
    1    H    LEU 101           H        LEU 101   7.466  24.522   8.926
    2    HA   LEU 101           HA       LEU 101   9.060  25.344  11.139
    3    HB2  LEU 101           HB2      LEU 101   9.660  24.353   8.364
    4    HB3  LEU 101           HB3      LEU 101  10.964  25.004   9.353
    5    HG   LEU 101           HG       LEU 101   9.103  22.866  10.404
    6   HD12  LEU 101          HD11      LEU 101  11.145  21.350   9.807
    7   HD11  LEU 101          HD12      LEU 101  11.532  22.610   8.637
    8   HD13  LEU 101          HD13      LEU 101   9.994  21.753   8.534
    9   HD21  LEU 101          HD21      LEU 101  11.835  23.945  11.149
   10   HD23  LEU 101          HD22      LEU 101  11.271  22.378  11.724
   11   HD22  LEU 101          HD23      LEU 101  10.392  23.843  12.158

  No H/Q in entry =          11
  In of MODEL   90
    1    H    LYS 102           H        LYS 102   7.509  27.225   8.990
    2    HA   LYS 102           HA       LYS 102   7.613  29.517   8.701
    3    HB2  LYS 102           HB2      LYS 102   9.164  29.384  10.808
    4    HB3  LYS 102           HB3      LYS 102  10.472  29.565   9.656
    5    HG2  LYS 102           HG2      LYS 102   8.383  31.540  10.507
    6    HG3  LYS 102           HG3      LYS 102  10.099  31.782  10.266
    7    HD2  LYS 102           HD2      LYS 102   8.157  31.382   7.954
    8    HD3  LYS 102           HD3      LYS 102   8.553  32.956   8.626
    9    HE2  LYS 102           HE2      LYS 102   9.925  31.759   6.560
   10    HE3  LYS 102           HE3      LYS 102  10.550  33.058   7.575
   11    HZ2  LYS 102           HZ1      LYS 102  12.051  31.137   7.407
   12    HZ1  LYS 102           HZ2      LYS 102  10.874  30.167   8.142
   13    HZ3  LYS 102           HZ3      LYS 102  11.575  31.446   9.006

  No H/Q in entry =          13
  In of MODEL   90
    1    H    ALA 103           H        ALA 103  10.858  28.144   8.154
    2    HA   ALA 103           HA       ALA 103  11.849  29.511   6.084
    3    HB2  ALA 103           HB1      ALA 103  12.715  27.288   5.160
    4    HB1  ALA 103           HB2      ALA 103  11.804  26.523   6.460
    5    HB3  ALA 103           HB3      ALA 103  13.104  27.653   6.842

  No H/Q in entry =           5
  In of MODEL   90
    1    H1   LYS   3           H1       LYS   3 -31.829   5.690 -19.590
    2    H2   LYS   3           H3       LYS   3 -30.842   5.453 -20.952
    3    H3   LYS   3           H2       LYS   3 -32.187   4.450 -20.693
    4    HA   LYS   3           HA       LYS   3 -31.104   3.108 -19.303
    5    HB2  LYS   3           HB2      LYS   3 -28.908   4.631 -20.655
    6    HB3  LYS   3           HB3      LYS   3 -28.512   3.437 -19.418
    7    HG2  LYS   3           HG2      LYS   3 -29.870   1.788 -20.758
    8    HG3  LYS   3           HG3      LYS   3 -29.895   2.992 -22.046
    9    HD2  LYS   3           HD2      LYS   3 -27.410   2.998 -22.020
   10    HD3  LYS   3           HD3      LYS   3 -27.454   1.692 -20.836
   11    HE2  LYS   3           HE2      LYS   3 -28.912   0.449 -22.541
   12    HE3  LYS   3           HE3      LYS   3 -28.361   1.659 -23.700
   13    HZ3  LYS   3           HZ1      LYS   3 -26.509   0.519 -23.991
   14    HZ2  LYS   3           HZ2      LYS   3 -27.071  -0.680 -22.928
   15    HZ1  LYS   3           HZ3      LYS   3 -26.136   0.608 -22.336

  No H/Q in entry =          15
  In of MODEL   90
    1    H    LYS   4           H        LYS   4 -31.129   2.959 -17.242
    2    HA   LYS   4           HA       LYS   4 -30.491   5.275 -15.593
    3    HB2  LYS   4           HB2      LYS   4 -31.556   2.526 -14.888
    4    HB3  LYS   4           HB3      LYS   4 -31.388   3.871 -13.760
    5    HG2  LYS   4           HG2      LYS   4 -33.215   3.729 -16.164
    6    HG3  LYS   4           HG3      LYS   4 -33.690   3.752 -14.467
    7    HD2  LYS   4           HD2      LYS   4 -33.097   6.004 -14.201
    8    HD3  LYS   4           HD3      LYS   4 -32.071   5.998 -15.635
    9    HE2  LYS   4           HE2      LYS   4 -34.063   7.281 -16.074
   10    HE3  LYS   4           HE3      LYS   4 -34.084   5.808 -17.045
   11    HZ3  LYS   4           HZ1      LYS   4 -35.599   4.820 -15.485
   12    HZ2  LYS   4           HZ2      LYS   4 -36.230   6.289 -16.059
   13    HZ1  LYS   4           HZ3      LYS   4 -35.553   6.206 -14.503

  No H/Q in entry =          13
  In of MODEL   90
    1    H    HIS   5           H        HIS   5 -29.012   5.425 -14.016
    2    HA   HIS   5           HA       HIS   5 -26.650   3.704 -14.376
    3    HB2  HIS   5           HB2      HIS   5 -27.020   6.441 -13.160
    4    HB3  HIS   5           HB3      HIS   5 -25.496   5.556 -13.160
    5    HD1  HIS   5           HD1      HIS   5 -24.099   6.825 -14.762
    6    HD2  HIS   5           HD2      HIS   5 -27.884   6.034 -16.279
    7    HE1  HIS   5           HE1      HIS   5 -23.984   7.419 -17.213
    8    HE2  HIS   5           HE2      HIS   5 -26.290   6.924 -18.106

  No H/Q in entry =           8
  In of MODEL   90
    1    H    ILE   6           H        ILE   6 -26.336   2.140 -13.066
    2    HA   ILE   6           HA       ILE   6 -27.295   2.358 -10.290
    3    HB   ILE   6           HB       ILE   6 -26.374  -0.066 -11.843
    4   HG12  ILE   6          HG12      ILE   6 -29.148   0.744 -10.961
    5   HG13  ILE   6          HG13      ILE   6 -28.531   0.938 -12.602
    6   HG23  ILE   6          HG21      ILE   6 -26.671  -1.337  -9.982
    7   HG22  ILE   6          HG22      ILE   6 -27.872  -0.247  -9.288
    8   HG21  ILE   6          HG23      ILE   6 -26.158   0.168  -9.215
    9   HD13  ILE   6          HD11      ILE   6 -28.899  -1.198 -13.103
   10   HD12  ILE   6          HD12      ILE   6 -29.899  -1.231 -11.651
   11   HD11  ILE   6          HD13      ILE   6 -28.218  -1.763 -11.577

  No H/Q in entry =          11
  In of MODEL   90
    1    H    TYR   7           H        TYR   7 -25.553   3.075  -9.021
    2    HA   TYR   7           HA       TYR   7 -22.808   2.242  -9.730
    3    HB2  TYR   7           HB2      TYR   7 -23.865   4.628  -8.234
    4    HB3  TYR   7           HB3      TYR   7 -22.160   4.189  -8.290
    5    HD1  TYR   7           HD1      TYR   7 -23.188   3.207 -11.373
    6    HD2  TYR   7           HD2      TYR   7 -22.656   6.801  -9.144
    7    HE1  TYR   7           HE1      TYR   7 -22.833   4.459 -13.465
    8    HE2  TYR   7           HE2      TYR   7 -22.344   8.057 -11.228
    9    HH   TYR   7           HH       TYR   7 -22.581   7.965 -13.457

  No H/Q in entry =           9
  In of MODEL   90
    1    H    LEU   8           H        LEU   8 -21.769   0.932  -8.414
    2    HA   LEU   8           HA       LEU   8 -22.849   0.382  -5.721
    3    HB2  LEU   8           HB2      LEU   8 -21.092  -1.200  -7.577
    4    HB3  LEU   8           HB3      LEU   8 -21.243  -1.593  -5.865
    5    HG   LEU   8           HG       LEU   8 -23.717  -1.876  -6.262
    6   HD13  LEU   8          HD11      LEU   8 -23.924  -0.662  -8.367
    7   HD12  LEU   8          HD12      LEU   8 -24.381  -2.348  -8.606
    8   HD11  LEU   8          HD13      LEU   8 -22.803  -1.778  -9.146
    9   HD23  LEU   8          HD21      LEU   8 -22.370  -3.854  -7.974
   10   HD22  LEU   8          HD22      LEU   8 -23.435  -4.073  -6.585
   11   HD21  LEU   8          HD23      LEU   8 -21.743  -3.644  -6.339

  No H/Q in entry =          11
  In of MODEL   90
    1    H    PHE   9           H        PHE   9 -21.576   0.841  -3.944
    2    HA   PHE   9           HA       PHE   9 -18.841   1.897  -4.489
    3    HB2  PHE   9           HB2      PHE   9 -20.870   2.878  -2.485
    4    HB3  PHE   9           HB3      PHE   9 -19.186   3.384  -2.518
    5    HD1  PHE   9           HD1      PHE   9 -18.320   4.777  -4.312
    6    HD2  PHE   9           HD2      PHE   9 -22.436   3.566  -4.251
    7    HE1  PHE   9           HE1      PHE   9 -18.836   6.440  -6.073
    8    HE2  PHE   9           HE2      PHE   9 -22.954   5.240  -6.008
    9    HZ   PHE   9           HZ       PHE   9 -21.151   6.674  -6.925

  No H/Q in entry =           9
  In of MODEL   90
    1    H    SER  10           H        SER  10 -17.189   1.030  -3.382
    2    HA   SER  10           HA       SER  10 -17.320   0.132  -0.694
    3    HB2  SER  10           HB2      SER  10 -17.061  -2.243  -1.002
    4    HB3  SER  10           HB3      SER  10 -18.522  -1.741  -1.838
    5    HG   SER  10           HG       SER  10 -16.703  -1.443  -3.605

  No H/Q in entry =           5
  In of MODEL   90
    1    H    SER  11           H        SER  11 -15.293   0.289   0.102
    2    HA   SER  11           HA       SER  11 -13.155   1.174  -1.496
    3    HB2  SER  11           HB2      SER  11 -12.995  -0.039   1.260
    4    HB3  SER  11           HB3      SER  11 -11.810   1.024   0.498
    5    HG   SER  11           HG       SER  11 -13.283   2.678   0.557

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ALA  12           H        ALA  12 -14.287  -1.536  -2.224
    2    HA   ALA  12           HA       ALA  12 -11.695  -2.766  -2.729
    3    HB3  ALA  12           HB1      ALA  12 -12.318  -3.874  -0.664
    4    HB2  ALA  12           HB2      ALA  12 -12.467  -5.014  -2.000
    5    HB1  ALA  12           HB3      ALA  12 -13.911  -4.267  -1.318

  No H/Q in entry =           5
  In of MODEL   90
    1    H    GLY  13           H        GLY  13 -12.634  -1.695  -4.734
    2    HA3  GLY  13           HA2      GLY  13 -14.823  -2.575  -6.181
    3    HA2  GLY  13           HA3      GLY  13 -13.330  -1.977  -6.920

  No H/Q in entry =           3
  In of MODEL   90
    1    H    MET  14           H        MET  14 -11.714  -4.230  -5.827
    2    HA   MET  14           HA       MET  14 -11.859  -5.942  -8.026
    3    HB2  MET  14           HB2      MET  14  -9.866  -5.910  -6.613
    4    HB3  MET  14           HB3      MET  14 -10.755  -6.660  -5.288
    5    HG2  MET  14           HG2      MET  14 -11.127  -8.667  -6.684
    6    HG3  MET  14           HG3      MET  14 -10.257  -7.906  -8.016
    7    HE3  MET  14           HE1      MET  14  -6.671  -8.118  -7.304
    8    HE2  MET  14           HE2      MET  14  -7.739  -6.720  -7.403
    9    HE1  MET  14           HE3      MET  14  -8.007  -8.098  -8.467

  No H/Q in entry =           9
  In of MODEL   90
    1    H    SER  15           H        SER  15 -13.211  -6.577  -4.793
    2    HA   SER  15           HA       SER  15 -14.418  -9.058  -5.688
    3    HB2  SER  15           HB2      SER  15 -14.717  -7.515  -3.110
    4    HB3  SER  15           HB3      SER  15 -15.715  -8.916  -3.492
    5    HG   SER  15           HG       SER  15 -12.904  -9.034  -3.766

  No H/Q in entry =           5
  In of MODEL   90
    1    H    THR  16           H        THR  16 -15.553  -5.734  -5.167
    2    HA   THR  16           HA       THR  16 -18.353  -6.238  -5.658
    3    HB   THR  16           HB       THR  16 -16.822  -3.666  -6.177
    4    HG1  THR  16           HG1      THR  16 -16.619  -3.422  -4.118
    5   HG21  THR  16          HG21      THR  16 -19.186  -3.794  -6.943
    6   HG23  THR  16          HG22      THR  16 -18.968  -2.620  -5.633
    7   HG22  THR  16          HG23      THR  16 -19.668  -4.211  -5.303

  No H/Q in entry =           7
  In of MODEL   90
    1    H    SER  17           H        SER  17 -15.549  -5.548  -7.536
    2    HA   SER  17           HA       SER  17 -16.733  -4.855 -10.026
    3    HB2  SER  17           HB2      SER  17 -14.041  -6.061  -9.355
    4    HB3  SER  17           HB3      SER  17 -14.517  -5.630 -10.997
    5    HG   SER  17           HG       SER  17 -14.952  -3.651  -9.156

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LEU  18           H        LEU  18 -16.008  -7.973  -8.589
    2    HA   LEU  18           HA       LEU  18 -16.547  -9.494 -10.943
    3    HB2  LEU  18           HB2      LEU  18 -15.267 -10.404  -9.055
    4    HB3  LEU  18           HB3      LEU  18 -16.691 -10.273  -8.025
    5    HG   LEU  18           HG       LEU  18 -17.869 -11.905  -9.401
    6   HD11  LEU  18          HD11      LEU  18 -15.400 -11.639 -11.087
    7   HD13  LEU  18          HD12      LEU  18 -17.093 -11.639 -11.584
    8   HD12  LEU  18          HD13      LEU  18 -16.315 -13.144 -11.095
    9   HD23  LEU  18          HD21      LEU  18 -15.149 -12.973  -8.728
   10   HD22  LEU  18          HD22      LEU  18 -16.696 -13.823  -8.713
   11   HD21  LEU  18          HD23      LEU  18 -16.369 -12.568  -7.518

  No H/Q in entry =          11
  In of MODEL   90
    1    H    LEU  19           H        LEU  19 -18.544  -8.382  -8.211
    2    HA   LEU  19           HA       LEU  19 -20.958  -9.676  -9.023
    3    HB2  LEU  19           HB2      LEU  19 -20.715  -8.840  -6.773
    4    HB3  LEU  19           HB3      LEU  19 -20.496  -7.197  -7.373
    5    HG   LEU  19           HG       LEU  19 -22.839  -7.136  -8.077
    6   HD12  LEU  19          HD11      LEU  19 -24.364  -8.939  -7.358
    7   HD11  LEU  19          HD12      LEU  19 -22.974  -9.885  -6.828
    8   HD13  LEU  19          HD13      LEU  19 -23.184  -9.509  -8.537
    9   HD21  LEU  19          HD21      LEU  19 -22.365  -7.936  -5.213
   10   HD23  LEU  19          HD22      LEU  19 -23.813  -7.127  -5.812
   11   HD22  LEU  19          HD23      LEU  19 -22.250  -6.314  -5.896

  No H/Q in entry =          11
  In of MODEL   90
    1    H    VAL  20           H        VAL  20 -19.615  -6.449  -9.725
    2    HA   VAL  20           HA       VAL  20 -21.787  -5.502 -11.272
    3    HB   VAL  20           HB       VAL  20 -18.829  -4.774 -11.421
    4   HG12  VAL  20          HG11      VAL  20 -19.743  -2.690 -12.606
    5   HG11  VAL  20          HG12      VAL  20 -21.205  -3.633 -12.893
    6   HG13  VAL  20          HG13      VAL  20 -19.664  -4.171 -13.559
    7   HG23  VAL  20          HG21      VAL  20 -19.804  -2.625 -10.415
    8   HG22  VAL  20          HG22      VAL  20 -19.639  -4.037  -9.373
    9   HG21  VAL  20          HG23      VAL  20 -21.216  -3.611 -10.039

  No H/Q in entry =           9
  In of MODEL   90
    1    H    SER  21           H        SER  21 -18.948  -7.423 -12.330
    2    HA   SER  21           HA       SER  21 -19.762  -7.342 -15.073
    3    HB2  SER  21           HB2      SER  21 -18.241  -9.242 -15.422
    4    HB3  SER  21           HB3      SER  21 -17.460  -7.959 -14.500
    5    HG   SER  21           HG       SER  21 -18.756  -9.811 -12.969

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LYS  22           H        LYS  22 -20.702  -9.578 -12.496
    2    HA   LYS  22           HA       LYS  22 -22.182 -11.263 -14.307
    3    HB2  LYS  22           HB2      LYS  22 -21.367 -11.957 -12.016
    4    HB3  LYS  22           HB3      LYS  22 -22.655 -10.956 -11.347
    5    HG2  LYS  22           HG2      LYS  22 -23.534 -13.112 -11.310
    6    HG3  LYS  22           HG3      LYS  22 -24.248 -12.384 -12.749
    7    HD2  LYS  22           HD2      LYS  22 -22.641 -13.521 -14.167
    8    HD3  LYS  22           HD3      LYS  22 -21.822 -14.181 -12.751
    9    HE2  LYS  22           HE2      LYS  22 -23.851 -15.448 -12.172
   10    HE3  LYS  22           HE3      LYS  22 -24.667 -14.791 -13.591
   11    HZ1  LYS  22           HZ1      LYS  22 -22.172 -16.085 -14.187
   12    HZ3  LYS  22           HZ2      LYS  22 -23.697 -16.267 -14.914
   13    HZ2  LYS  22           HZ3      LYS  22 -23.324 -17.126 -13.498

  No H/Q in entry =          13
  In of MODEL   90
    1    H    MET  23           H        MET  23 -23.019  -8.381 -12.426
    2    HA   MET  23           HA       MET  23 -25.825  -8.584 -12.906
    3    HB2  MET  23           HB2      MET  23 -24.078  -6.197 -12.345
    4    HB3  MET  23           HB3      MET  23 -25.831  -6.105 -12.507
    5    HG2  MET  23           HG2      MET  23 -26.145  -7.429 -10.538
    6    HG3  MET  23           HG3      MET  23 -24.417  -7.764 -10.428
    7    HE2  MET  23           HE1      MET  23 -26.864  -4.220  -9.210
    8    HE1  MET  23           HE2      MET  23 -27.088  -5.196 -10.660
    9    HE3  MET  23           HE3      MET  23 -26.119  -3.725 -10.730

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ARG  24           H        ARG  24 -23.153  -7.031 -14.713
    2    HA   ARG  24           HA       ARG  24 -24.725  -5.794 -16.694
    3    HB2  ARG  24           HB2      ARG  24 -22.298  -5.292 -16.330
    4    HB3  ARG  24           HB3      ARG  24 -21.900  -6.868 -16.970
    5    HG2  ARG  24           HG2      ARG  24 -22.830  -6.226 -19.196
    6    HG3  ARG  24           HG3      ARG  24 -23.225  -4.618 -18.533
    7    HD2  ARG  24           HD2      ARG  24 -20.440  -5.873 -18.578
    8    HD3  ARG  24           HD3      ARG  24 -21.027  -4.666 -19.713
    9    HE   ARG  24           HE       ARG  24 -21.370  -3.370 -17.431
   10   HH21  ARG  24          HH11      ARG  24 -20.062  -1.550 -17.590
   11   HH22  ARG  24          HH12      ARG  24 -18.359  -1.737 -17.830
   12   HH11  ARG  24          HH21      ARG  24 -18.716  -5.203 -18.454
   13   HH12  ARG  24          HH22      ARG  24 -17.572  -3.904 -18.331

  No H/Q in entry =          13
  In of MODEL   90
    1    H    ALA  25           H        ALA  25 -23.457  -9.081 -16.438
    2    HA   ALA  25           HA       ALA  25 -24.072  -9.932 -19.072
    3    HB1  ALA  25           HB1      ALA  25 -23.282 -11.934 -18.388
    4    HB3  ALA  25           HB2      ALA  25 -24.327 -11.963 -16.968
    5    HB2  ALA  25           HB3      ALA  25 -22.809 -11.068 -16.926

  No H/Q in entry =           5
  In of MODEL   90
    1    H    GLN  26           H        GLN  26 -25.868 -10.057 -16.032
    2    HA   GLN  26           HA       GLN  26 -28.168 -11.357 -17.032
    3    HB2  GLN  26           HB2      GLN  26 -27.708  -9.596 -14.643
    4    HB3  GLN  26           HB3      GLN  26 -29.241 -10.384 -14.982
    5    HG2  GLN  26           HG2      GLN  26 -26.592 -11.731 -14.541
    6    HG3  GLN  26           HG3      GLN  26 -27.946 -11.689 -13.418
    7   HE21  GLN  26          HE21      GLN  26 -26.648 -13.795 -14.713
    8   HE22  GLN  26          HE22      GLN  26 -27.651 -14.884 -15.503

  No H/Q in entry =           8
  In of MODEL   90
    1    H    ALA  27           H        ALA  27 -27.376  -7.923 -16.637
    2    HA   ALA  27           HA       ALA  27 -29.917  -6.936 -17.395
    3    HB1  ALA  27           HB1      ALA  27 -28.155  -5.548 -16.292
    4    HB3  ALA  27           HB2      ALA  27 -28.791  -4.804 -17.760
    5    HB2  ALA  27           HB3      ALA  27 -27.220  -5.604 -17.786

  No H/Q in entry =           5
  In of MODEL   90
    1    H    GLU  28           H        GLU  28 -27.182  -8.036 -19.293
    2    HA   GLU  28           HA       GLU  28 -28.184  -7.030 -21.799
    3    HB2  GLU  28           HB2      GLU  28 -25.773  -7.612 -21.199
    4    HB3  GLU  28           HB3      GLU  28 -26.248  -9.298 -21.402
    5    HG2  GLU  28           HG2      GLU  28 -25.153  -8.466 -23.378
    6    HG3  GLU  28           HG3      GLU  28 -26.839  -8.861 -23.713

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LYS  29           H        LYS  29 -28.203 -10.145 -20.153
    2    HA   LYS  29           HA       LYS  29 -29.460 -11.663 -22.152
    3    HB2  LYS  29           HB2      LYS  29 -28.351 -12.608 -20.161
    4    HB3  LYS  29           HB3      LYS  29 -29.643 -11.960 -19.152
    5    HG2  LYS  29           HG2      LYS  29 -31.253 -13.398 -20.211
    6    HG3  LYS  29           HG3      LYS  29 -30.039 -13.977 -21.347
    7    HD2  LYS  29           HD2      LYS  29 -28.831 -15.100 -19.629
    8    HD3  LYS  29           HD3      LYS  29 -29.762 -14.303 -18.363
    9    HE2  LYS  29           HE2      LYS  29 -30.417 -16.681 -18.728
   10    HE3  LYS  29           HE3      LYS  29 -31.747 -15.543 -18.955
   11    HZ1  LYS  29           HZ1      LYS  29 -31.198 -15.643 -21.388
   12    HZ3  LYS  29           HZ2      LYS  29 -31.853 -17.063 -20.722
   13    HZ2  LYS  29           HZ3      LYS  29 -30.188 -16.961 -21.035

  No H/Q in entry =          13
  In of MODEL   90
    1    H    TYR  30           H        TYR  30 -30.918  -9.628 -19.627
    2    HA   TYR  30           HA       TYR  30 -33.570 -10.186 -20.847
    3    HB2  TYR  30           HB2      TYR  30 -32.942  -9.016 -18.127
    4    HB3  TYR  30           HB3      TYR  30 -34.553  -9.340 -18.767
    5    HD1  TYR  30           HD1      TYR  30 -35.366 -11.668 -18.981
    6    HD2  TYR  30           HD2      TYR  30 -31.551 -10.789 -17.309
    7    HE1  TYR  30           HE1      TYR  30 -35.171 -13.993 -18.195
    8    HE2  TYR  30           HE2      TYR  30 -31.356 -13.099 -16.527
    9    HH   TYR  30           HH       TYR  30 -32.903 -15.525 -17.615

  No H/Q in entry =           9
  In of MODEL   90
    1    H    GLU  31           H        GLU  31 -31.498  -8.100 -21.658
    2    HA   GLU  31           HA       GLU  31 -31.525  -5.939 -22.472
    3    HB2  GLU  31           HB2      GLU  31 -34.391  -6.777 -22.963
    4    HB3  GLU  31           HB3      GLU  31 -33.616  -5.372 -23.694
    5    HG2  GLU  31           HG2      GLU  31 -32.094  -6.740 -24.904
    6    HG3  GLU  31           HG3      GLU  31 -32.589  -8.180 -24.017

  No H/Q in entry =           6
  In of MODEL   90
    1    H    VAL  32           H        VAL  32 -31.703  -5.857 -19.738
    2    HA   VAL  32           HA       VAL  32 -33.650  -3.829 -19.053
    3    HB   VAL  32           HB       VAL  32 -31.202  -4.724 -17.498
    4   HG12  VAL  32          HG11      VAL  32 -32.756  -3.975 -15.585
    5   HG11  VAL  32          HG12      VAL  32 -33.639  -3.104 -16.839
    6   HG13  VAL  32          HG13      VAL  32 -31.944  -2.727 -16.532
    7   HG21  VAL  32          HG21      VAL  32 -32.900  -6.517 -18.178
    8   HG23  VAL  32          HG22      VAL  32 -33.965  -5.741 -17.005
    9   HG22  VAL  32          HG23      VAL  32 -32.413  -6.399 -16.487

  No H/Q in entry =           9
  In of MODEL   90
    1    HA   PRO  33           HA       PRO  33 -30.765  -0.765 -20.741
    2    HB2  PRO  33           HB2      PRO  33 -32.371   1.389 -20.595
    3    HB3  PRO  33           HB3      PRO  33 -32.792   0.072 -21.690
    4    HG2  PRO  33           HG2      PRO  33 -33.757   0.534 -18.867
    5    HG3  PRO  33           HG3      PRO  33 -34.724   0.288 -20.321
    6    HD2  PRO  33           HD2      PRO  33 -34.162  -1.769 -18.669
    7    HD3  PRO  33           HD3      PRO  33 -34.229  -2.005 -20.415

  No H/Q in entry =           7
  In of MODEL   90
    1    H    VAL  34           H        VAL  34 -29.461  -1.260 -18.806
    2    HA   VAL  34           HA       VAL  34 -29.270   1.169 -17.150
    3    HB   VAL  34           HB       VAL  34 -28.607  -0.273 -15.224
    4   HG12  VAL  34          HG11      VAL  34 -30.975  -1.254 -14.900
    5   HG11  VAL  34          HG12      VAL  34 -31.339  -0.503 -16.452
    6   HG13  VAL  34          HG13      VAL  34 -30.818   0.492 -15.092
    7   HG21  VAL  34          HG21      VAL  34 -28.719  -2.298 -17.240
    8   HG23  VAL  34          HG22      VAL  34 -29.748  -2.711 -15.866
    9   HG22  VAL  34          HG23      VAL  34 -28.041  -2.348 -15.612

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ILE  35           H        ILE  35 -27.307   1.688 -16.326
    2    HA   ILE  35           HA       ILE  35 -24.958   0.469 -17.615
    3    HB   ILE  35           HB       ILE  35 -25.479   3.335 -16.788
    4   HG12  ILE  35          HG12      ILE  35 -24.462   2.084 -19.347
    5   HG13  ILE  35          HG13      ILE  35 -26.116   2.629 -19.070
    6   HG21  ILE  35          HG21      ILE  35 -22.854   1.920 -17.127
    7   HG23  ILE  35          HG22      ILE  35 -23.349   3.073 -15.888
    8   HG22  ILE  35          HG23      ILE  35 -23.007   3.630 -17.526
    9   HD11  ILE  35          HD11      ILE  35 -24.809   4.882 -18.472
   10   HD13  ILE  35          HD12      ILE  35 -25.344   4.482 -20.105
   11   HD12  ILE  35          HD13      ILE  35 -23.672   4.186 -19.625

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ILE  36           H        ILE  36 -23.667  -0.505 -16.032
    2    HA   ILE  36           HA       ILE  36 -24.108   0.078 -13.155
    3    HB   ILE  36           HB       ILE  36 -23.171  -2.580 -14.283
    4   HG12  ILE  36          HG12      ILE  36 -26.004  -1.905 -13.490
    5   HG13  ILE  36          HG13      ILE  36 -25.449  -1.851 -15.164
    6   HG23  ILE  36          HG21      ILE  36 -23.464  -3.433 -12.170
    7   HG22  ILE  36          HG22      ILE  36 -24.644  -2.203 -11.715
    8   HG21  ILE  36          HG23      ILE  36 -22.930  -1.793 -11.800
    9   HD13  ILE  36          HD11      ILE  36 -25.516  -4.070 -15.378
   10   HD12  ILE  36          HD12      ILE  36 -26.573  -4.003 -13.969
   11   HD11  ILE  36          HD13      ILE  36 -24.856  -4.346 -13.766

  No H/Q in entry =          11
  In of MODEL   90
    1    H    GLU  37           H        GLU  37 -22.348   0.783 -12.064
    2    HA   GLU  37           HA       GLU  37 -19.632   0.112 -13.008
    3    HB2  GLU  37           HB2      GLU  37 -20.614   2.860 -12.244
    4    HB3  GLU  37           HB3      GLU  37 -18.922   2.425 -12.485
    5    HG2  GLU  37           HG2      GLU  37 -21.045   2.345 -14.609
    6    HG3  GLU  37           HG3      GLU  37 -19.898   3.661 -14.365

  No H/Q in entry =           6
  In of MODEL   90
    1    H    ALA  38           H        ALA  38 -18.120  -0.064 -11.340
    2    HA   ALA  38           HA       ALA  38 -19.133   0.056  -8.559
    3    HB1  ALA  38           HB1      ALA  38 -17.346  -1.797 -10.010
    4    HB3  ALA  38           HB2      ALA  38 -18.370  -2.086  -8.603
    5    HB2  ALA  38           HB3      ALA  38 -16.790  -1.331  -8.402

  No H/Q in entry =           5
  In of MODEL   90
    1    H    PHE  39           H        PHE  39 -17.936   1.315  -7.091
    2    HA   PHE  39           HA       PHE  39 -15.478   2.636  -8.005
    3    HB2  PHE  39           HB2      PHE  39 -17.947   4.007  -6.959
    4    HB3  PHE  39           HB3      PHE  39 -16.351   4.750  -6.884
    5    HD1  PHE  39           HD1      PHE  39 -15.056   4.812  -9.159
    6    HD2  PHE  39           HD2      PHE  39 -19.285   4.430  -8.766
    7    HE1  PHE  39           HE1      PHE  39 -15.337   5.683 -11.463
    8    HE2  PHE  39           HE2      PHE  39 -19.581   5.291 -11.061
    9    HZ   PHE  39           HZ       PHE  39 -17.611   5.891 -12.428

  No H/Q in entry =           9
  In of MODEL   90
    1    HA   PRO  40           HA       PRO  40 -14.465   1.910  -3.730
    2    HB2  PRO  40           HB2      PRO  40 -12.790   4.005  -3.132
    3    HB3  PRO  40           HB3      PRO  40 -12.294   2.698  -4.207
    4    HG2  PRO  40           HG2      PRO  40 -13.449   5.385  -4.936
    5    HG3  PRO  40           HG3      PRO  40 -11.993   4.609  -5.561
    6    HD2  PRO  40           HD2      PRO  40 -14.223   4.428  -6.945
    7    HD3  PRO  40           HD3      PRO  40 -13.198   3.004  -6.769

  No H/Q in entry =           7
  In of MODEL   90
    1    H    GLU  41           H        GLU  41 -15.113   2.848  -1.590
    2    HA   GLU  41           HA       GLU  41 -17.435   4.442  -1.546
    3    HB2  GLU  41           HB2      GLU  41 -17.336   4.281   0.794
    4    HB3  GLU  41           HB3      GLU  41 -16.595   2.789   0.214
    5    HG2  GLU  41           HG2      GLU  41 -15.146   3.359   1.887
    6    HG3  GLU  41           HG3      GLU  41 -14.367   4.126   0.503

  No H/Q in entry =           6
  In of MODEL   90
    1    H    THR  42           H        THR  42 -14.152   5.518  -1.624
    2    HA   THR  42           HA       THR  42 -14.616   8.054  -0.398
    3    HB   THR  42           HB       THR  42 -12.498   8.734  -1.493
    4    HG1  THR  42           HG1      THR  42 -11.554   6.678  -2.594
    5   HG21  THR  42          HG21      THR  42 -12.657   6.056  -0.124
    6   HG23  THR  42          HG22      THR  42 -12.140   7.606   0.544
    7   HG22  THR  42          HG23      THR  42 -11.106   6.750  -0.597

  No H/Q in entry =           7
  In of MODEL   90
    1    H    LEU  43           H        LEU  43 -15.496   6.930  -3.495
    2    HA   LEU  43           HA       LEU  43 -15.891   9.690  -4.450
    3    HB2  LEU  43           HB2      LEU  43 -16.127   7.031  -5.846
    4    HB3  LEU  43           HB3      LEU  43 -16.441   8.596  -6.597
    5    HG   LEU  43           HG       LEU  43 -13.756   7.655  -5.622
    6   HD13  LEU  43          HD11      LEU  43 -13.212   7.120  -7.812
    7   HD12  LEU  43          HD12      LEU  43 -14.531   8.080  -8.480
    8   HD11  LEU  43          HD13      LEU  43 -14.874   6.541  -7.692
    9   HD23  LEU  43          HD21      LEU  43 -13.018   9.635  -7.020
   10   HD22  LEU  43          HD22      LEU  43 -13.859  10.032  -5.520
   11   HD21  LEU  43          HD23      LEU  43 -14.710  10.131  -7.061

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ALA  44           H        ALA  44 -17.729   7.767  -2.587
    2    HA   ALA  44           HA       ALA  44 -20.210   7.512  -3.887
    3    HB2  ALA  44           HB1      ALA  44 -19.998   6.396  -1.797
    4    HB3  ALA  44           HB2      ALA  44 -21.166   7.685  -1.508
    5    HB1  ALA  44           HB3      ALA  44 -19.497   7.871  -0.971

  No H/Q in entry =           5
  In of MODEL   90
    1    H    GLY  45           H        GLY  45 -18.911  10.372  -2.356
    2    HA3  GLY  45           HA2      GLY  45 -21.421  11.754  -2.688
    3    HA2  GLY  45           HA3      GLY  45 -19.903  12.450  -2.123

  No H/Q in entry =           3
  In of MODEL   90
    1    H    GLU  46           H        GLU  46 -18.350  11.598  -4.431
    2    HA   GLU  46           HA       GLU  46 -19.109  13.786  -6.184
    3    HB2  GLU  46           HB2      GLU  46 -16.761  13.436  -5.612
    4    HB3  GLU  46           HB3      GLU  46 -16.825  11.808  -6.288
    5    HG2  GLU  46           HG2      GLU  46 -15.721  13.202  -7.858
    6    HG3  GLU  46           HG3      GLU  46 -17.317  12.826  -8.506

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LYS  47           H        LYS  47 -18.825  10.279  -6.636
    2    HA   LYS  47           HA       LYS  47 -19.957  10.456  -9.300
    3    HB2  LYS  47           HB2      LYS  47 -18.678   8.406  -7.637
    4    HB3  LYS  47           HB3      LYS  47 -20.028   7.803  -8.599
    5    HG2  LYS  47           HG2      LYS  47 -17.955   7.501  -9.789
    6    HG3  LYS  47           HG3      LYS  47 -18.960   8.691 -10.616
    7    HD2  LYS  47           HD2      LYS  47 -17.689  10.500  -9.611
    8    HD3  LYS  47           HD3      LYS  47 -16.714   9.339  -8.713
    9    HE2  LYS  47           HE2      LYS  47 -15.859   8.421 -10.798
   10    HE3  LYS  47           HE3      LYS  47 -16.861   9.546 -11.714
   11    HZ1  LYS  47           HZ1      LYS  47 -15.540  11.177 -10.042
   12    HZ3  LYS  47           HZ2      LYS  47 -15.075  10.842 -11.640
   13    HZ2  LYS  47           HZ3      LYS  47 -14.367   9.988 -10.352

  No H/Q in entry =          13
  In of MODEL   90
    1    H    GLY  48           H        GLY  48 -21.213   9.624  -6.143
    2    HA3  GLY  48           HA2      GLY  48 -23.545   8.329  -6.867
    3    HA2  GLY  48           HA3      GLY  48 -23.355   9.327  -5.426

  No H/Q in entry =           3
  In of MODEL   90
    1    H    GLN  49           H        GLN  49 -22.903  11.781  -6.992
    2    HA   GLN  49           HA       GLN  49 -25.514  12.768  -7.108
    3    HB2  GLN  49           HB2      GLN  49 -23.028  13.758  -8.487
    4    HB3  GLN  49           HB3      GLN  49 -24.533  14.652  -8.386
    5    HG2  GLN  49           HG2      GLN  49 -24.353  14.674  -5.951
    6    HG3  GLN  49           HG3      GLN  49 -22.858  13.759  -6.051
    7   HE21  GLN  49          HE21      GLN  49 -22.837  15.987  -4.770
    8   HE22  GLN  49          HE22      GLN  49 -21.981  17.287  -5.421

  No H/Q in entry =           8
  In of MODEL   90
    1    H    ASN  50           H        ASN  50 -23.770  10.980  -9.518
    2    HA   ASN  50           HA       ASN  50 -25.712  11.769 -11.579
    3    HB2  ASN  50           HB2      ASN  50 -23.063  10.355 -11.843
    4    HB3  ASN  50           HB3      ASN  50 -24.145  10.735 -13.175
    5   HD21  ASN  50          HD21      ASN  50 -21.538  11.700 -11.585
    6   HD22  ASN  50          HD22      ASN  50 -21.385  13.346 -11.923

  No H/Q in entry =           6
  In of MODEL   90
    1    H    ALA  51           H        ALA  51 -25.563   9.408  -9.344
    2    HA   ALA  51           HA       ALA  51 -26.262   7.234 -11.171
    3    HB2  ALA  51           HB1      ALA  51 -25.599   5.909  -9.496
    4    HB3  ALA  51           HB2      ALA  51 -26.748   6.658  -8.389
    5    HB1  ALA  51           HB3      ALA  51 -25.143   7.358  -8.599

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ASP  52           H        ASP  52 -28.213   6.085 -11.018
    2    HA   ASP  52           HA       ASP  52 -30.472   7.810 -10.324
    3    HB2  ASP  52           HB2      ASP  52 -30.179   5.323 -12.007
    4    HB3  ASP  52           HB3      ASP  52 -31.753   5.980 -11.555

  No H/Q in entry =           4
  In of MODEL   90
    1    H    VAL  53           H        VAL  53 -28.728   4.996  -9.335
    2    HA   VAL  53           HA       VAL  53 -30.149   5.047  -6.806
    3    HB   VAL  53           HB       VAL  53 -31.481   3.345  -8.044
    4   HG11  VAL  53          HG11      VAL  53 -29.710   2.574  -9.585
    5   HG13  VAL  53          HG12      VAL  53 -30.474   1.238  -8.724
    6   HG12  VAL  53          HG13      VAL  53 -28.884   1.813  -8.225
    7   HG23  VAL  53          HG21      VAL  53 -30.552   1.402  -6.366
    8   HG22  VAL  53          HG22      VAL  53 -31.737   2.651  -5.985
    9   HG21  VAL  53          HG23      VAL  53 -30.036   2.902  -5.592

  No H/Q in entry =           9
  In of MODEL   90
    1    H    VAL  54           H        VAL  54 -28.802   4.669  -5.165
    2    HA   VAL  54           HA       VAL  54 -26.011   3.951  -5.805
    3    HB   VAL  54           HB       VAL  54 -27.142   5.669  -3.538
    4   HG11  VAL  54          HG11      VAL  54 -24.503   4.372  -3.859
    5   HG13  VAL  54          HG12      VAL  54 -25.272   5.010  -2.407
    6   HG12  VAL  54          HG13      VAL  54 -24.427   6.099  -3.507
    7   HG22  VAL  54          HG21      VAL  54 -26.377   7.525  -4.638
    8   HG21  VAL  54          HG22      VAL  54 -26.892   6.516  -5.989
    9   HG23  VAL  54          HG23      VAL  54 -25.183   6.619  -5.567

  No H/Q in entry =           9
  In of MODEL   90
    1    H    LEU  55           H        LEU  55 -25.325   2.057  -5.176
    2    HA   LEU  55           HA       LEU  55 -26.750   0.669  -2.992
    3    HB2  LEU  55           HB2      LEU  55 -25.163  -0.417  -5.306
    4    HB3  LEU  55           HB3      LEU  55 -25.867  -1.390  -4.014
    5    HG   LEU  55           HG       LEU  55 -27.396   0.138  -6.112
    6   HD13  LEU  55          HD11      LEU  55 -27.023  -1.695  -7.341
    7   HD12  LEU  55          HD12      LEU  55 -27.927  -2.617  -6.142
    8   HD11  LEU  55          HD13      LEU  55 -26.175  -2.473  -6.007
    9   HD23  LEU  55          HD21      LEU  55 -28.581  -1.873  -4.253
   10   HD22  LEU  55          HD22      LEU  55 -29.348  -0.521  -5.088
   11   HD21  LEU  55          HD23      LEU  55 -28.328  -0.224  -3.681

  No H/Q in entry =          11
  In of MODEL   90
    1    H    LEU  56           H        LEU  56 -25.556   0.122  -1.199
    2    HA   LEU  56           HA       LEU  56 -22.643   0.652  -1.275
    3    HB2  LEU  56           HB2      LEU  56 -24.412   0.351   1.139
    4    HB3  LEU  56           HB3      LEU  56 -22.724   0.858   1.115
    5    HG   LEU  56           HG       LEU  56 -25.107   2.432   0.179
    6   HD11  LEU  56          HD11      LEU  56 -23.952   2.093   2.687
    7   HD13  LEU  56          HD12      LEU  56 -25.008   3.417   2.196
    8   HD12  LEU  56          HD13      LEU  56 -23.258   3.603   2.093
    9   HD23  LEU  56          HD21      LEU  56 -23.243   4.219  -0.026
   10   HD22  LEU  56          HD22      LEU  56 -23.588   3.111  -1.354
   11   HD21  LEU  56          HD23      LEU  56 -22.210   2.816  -0.295

  No H/Q in entry =          11
  In of MODEL   90
    1    H    GLY  57           H        GLY  57 -21.185  -0.915  -0.760
    2    HA3  GLY  57           HA2      GLY  57 -21.985  -3.640  -0.959
    3    HA2  GLY  57           HA3      GLY  57 -20.382  -3.073  -0.495

  No H/Q in entry =           3
  In of MODEL   90
    1    HA   PRO  58           HA       PRO  58 -23.105  -4.253   3.238
    2    HB2  PRO  58           HB2      PRO  58 -22.297  -6.826   3.828
    3    HB3  PRO  58           HB3      PRO  58 -23.709  -6.477   2.829
    4    HG2  PRO  58           HG2      PRO  58 -20.951  -7.230   2.015
    5    HG3  PRO  58           HG3      PRO  58 -22.499  -7.758   1.356
    6    HD2  PRO  58           HD2      PRO  58 -20.986  -5.865   0.125
    7    HD3  PRO  58           HD3      PRO  58 -22.749  -5.859   0.040

  No H/Q in entry =           7
  In of MODEL   90
    1    H    GLN  59           H        GLN  59 -19.723  -4.569   2.598
    2    HA   GLN  59           HA       GLN  59 -18.941  -4.562   5.352
    3    HB2  GLN  59           HB2      GLN  59 -17.409  -3.611   2.928
    4    HB3  GLN  59           HB3      GLN  59 -16.736  -3.840   4.529
    5    HG2  GLN  59           HG2      GLN  59 -17.911  -6.000   2.786
    6    HG3  GLN  59           HG3      GLN  59 -16.199  -5.689   3.018
    7   HE21  GLN  59          HE21      GLN  59 -18.253  -7.643   3.758
    8   HE22  GLN  59          HE22      GLN  59 -18.043  -8.377   5.236

  No H/Q in entry =           8
  In of MODEL   90
    1    H    ILE  60           H        ILE  60 -20.012  -2.048   3.163
    2    HA   ILE  60           HA       ILE  60 -19.230  -0.062   5.208
    3    HB   ILE  60           HB       ILE  60 -19.553   1.663   3.393
    4   HG12  ILE  60          HG12      ILE  60 -19.282  -0.534   1.389
    5   HG13  ILE  60          HG13      ILE  60 -20.885  -0.085   1.968
    6   HG21  ILE  60          HG21      ILE  60 -17.369   0.491   4.101
    7   HG23  ILE  60          HG22      ILE  60 -17.397   1.502   2.657
    8   HG22  ILE  60          HG23      ILE  60 -17.464  -0.254   2.505
    9   HD11  ILE  60          HD11      ILE  60 -20.158   2.339   1.338
   10   HD13  ILE  60          HD12      ILE  60 -20.651   1.230   0.059
   11   HD12  ILE  60          HD13      ILE  60 -18.938   1.532   0.353

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ALA  61           H        ALA  61 -21.610  -1.757   5.293
    2    HA   ALA  61           HA       ALA  61 -23.913  -0.193   4.862
    3    HB1  ALA  61           HB1      ALA  61 -25.048  -1.741   6.192
    4    HB2  ALA  61           HB2      ALA  61 -23.624  -2.071   7.181
    5    HB3  ALA  61           HB3      ALA  61 -23.707  -2.675   5.526

  No H/Q in entry =           5
  In of MODEL   90
    1    H    TYR  62           H        TYR  62 -21.677  -0.215   7.638
    2    HA   TYR  62           HA       TYR  62 -23.290   1.364   9.329
    3    HB2  TYR  62           HB2      TYR  62 -21.273   1.859  10.558
    4    HB3  TYR  62           HB3      TYR  62 -21.230   0.169  10.056
    5    HD1  TYR  62           HD1      TYR  62 -19.614  -0.594   8.358
    6    HD2  TYR  62           HD2      TYR  62 -19.653   3.471   9.671
    7    HE1  TYR  62           HE1      TYR  62 -17.424  -0.232   7.286
    8    HE2  TYR  62           HE2      TYR  62 -17.449   3.830   8.600
    9    HH   TYR  62           HH       TYR  62 -16.130   1.584   6.419

  No H/Q in entry =           9
  In of MODEL   90
    1    H    MET  63           H        MET  63 -21.715   2.306   6.462
    2    HA   MET  63           HA       MET  63 -21.669   5.141   7.166
    3    HB2  MET  63           HB2      MET  63 -21.010   3.649   4.625
    4    HB3  MET  63           HB3      MET  63 -20.909   5.402   4.796
    5    HG2  MET  63           HG2      MET  63 -19.183   5.128   6.500
    6    HG3  MET  63           HG3      MET  63 -19.273   3.379   6.302
    7    HE1  MET  63           HE1      MET  63 -16.842   4.112   6.217
    8    HE3  MET  63           HE2      MET  63 -15.965   4.553   4.751
    9    HE2  MET  63           HE3      MET  63 -16.585   2.912   4.949

  No H/Q in entry =           9
  In of MODEL   90
    1    H    LEU  64           H        LEU  64 -24.156   3.176   6.218
    2    HA   LEU  64           HA       LEU  64 -25.447   4.547   4.156
    3    HB2  LEU  64           HB2      LEU  64 -26.212   2.401   5.074
    4    HB3  LEU  64           HB3      LEU  64 -26.692   3.217   6.562
    5    HG   LEU  64           HG       LEU  64 -28.453   4.400   5.354
    6   HD13  LEU  64          HD11      LEU  64 -28.203   4.661   3.120
    7   HD12  LEU  64          HD12      LEU  64 -28.777   2.999   2.974
    8   HD11  LEU  64          HD13      LEU  64 -27.047   3.335   3.017
    9   HD23  LEU  64          HD21      LEU  64 -28.853   1.569   4.601
   10   HD22  LEU  64          HD22      LEU  64 -29.881   2.655   5.535
   11   HD21  LEU  64          HD23      LEU  64 -28.466   1.920   6.285

  No H/Q in entry =          11
  In of MODEL   90
    1    HA   PRO  65           HA       PRO  65 -27.739   7.592   6.940
    2    HB2  PRO  65           HB2      PRO  65 -25.724   7.830   9.176
    3    HB3  PRO  65           HB3      PRO  65 -27.474   8.035   9.240
    4    HG2  PRO  65           HG2      PRO  65 -26.437   5.819  10.148
    5    HG3  PRO  65           HG3      PRO  65 -27.864   5.728   9.117
    6    HD2  PRO  65           HD2      PRO  65 -24.974   5.243   8.384
    7    HD3  PRO  65           HD3      PRO  65 -26.396   4.295   7.948

  No H/Q in entry =           7
  In of MODEL   90
    1    H    GLU  66           H        GLU  66 -24.182   7.692   6.979
    2    HA   GLU  66           HA       GLU  66 -24.011  10.501   6.582
    3    HB2  GLU  66           HB2      GLU  66 -22.106   8.277   5.904
    4    HB3  GLU  66           HB3      GLU  66 -21.732   9.988   5.699
    5    HG2  GLU  66           HG2      GLU  66 -21.936  10.342   8.070
    6    HG3  GLU  66           HG3      GLU  66 -22.387   8.652   8.300

  No H/Q in entry =           6
  In of MODEL   90
    1    H    ILE  67           H        ILE  67 -24.016   7.762   4.320
    2    HA   ILE  67           HA       ILE  67 -23.697   9.495   2.030
    3    HB   ILE  67           HB       ILE  67 -24.469   6.551   2.207
    4   HG12  ILE  67          HG12      ILE  67 -21.900   7.836   1.264
    5   HG13  ILE  67          HG13      ILE  67 -22.160   7.398   2.951
    6   HG21  ILE  67          HG21      ILE  67 -24.513   8.438  -0.011
    7   HG23  ILE  67          HG22      ILE  67 -25.066   6.764   0.040
    8   HG22  ILE  67          HG23      ILE  67 -23.376   7.123  -0.304
    9   HD12  ILE  67          HD11      ILE  67 -21.688   5.654   0.590
   10   HD11  ILE  67          HD12      ILE  67 -22.664   5.034   1.921
   11   HD13  ILE  67          HD13      ILE  67 -21.009   5.568   2.216

  No H/Q in entry =          11
  In of MODEL   90
    1    H    GLN  68           H        GLN  68 -26.503   8.314   3.687
    2    HA   GLN  68           HA       GLN  68 -28.389   9.173   1.735
    3    HB2  GLN  68           HB2      GLN  68 -28.600   8.795   4.719
    4    HB3  GLN  68           HB3      GLN  68 -29.954   9.337   3.741
    5    HG2  GLN  68           HG2      GLN  68 -29.909   7.312   2.457
    6    HG3  GLN  68           HG3      GLN  68 -28.429   6.795   3.243
    7   HE21  GLN  68          HE21      GLN  68 -30.550   5.347   3.124
    8   HE22  GLN  68          HE22      GLN  68 -31.346   4.851   4.546

  No H/Q in entry =           8
  In of MODEL   90
    1    H    ARG  69           H        ARG  69 -26.827  10.896   4.463
    2    HA   ARG  69           HA       ARG  69 -28.297  13.321   4.080
    3    HB2  ARG  69           HB2      ARG  69 -25.900  12.482   5.641
    4    HB3  ARG  69           HB3      ARG  69 -26.053  14.199   5.291
    5    HG2  ARG  69           HG2      ARG  69 -28.359  14.143   6.285
    6    HG3  ARG  69           HG3      ARG  69 -28.078  12.462   6.751
    7    HD2  ARG  69           HD2      ARG  69 -26.473  14.881   7.657
    8    HD3  ARG  69           HD3      ARG  69 -27.555  13.926   8.659
    9    HE   ARG  69           HE       ARG  69 -24.916  13.105   7.680
   10   HH21  ARG  69          HH11      ARG  69 -24.024  11.372   8.860
   11   HH22  ARG  69          HH12      ARG  69 -25.007  10.510   9.996
   12   HH11  ARG  69          HH21      ARG  69 -27.831  12.431   9.405
   13   HH12  ARG  69          HH22      ARG  69 -27.162  11.108  10.301

  No H/Q in entry =          13
  In of MODEL   90
    1    H    LEU  70           H        LEU  70 -25.385  12.037   2.686
    2    HA   LEU  70           HA       LEU  70 -24.380  14.450   1.516
    3    HB2  LEU  70           HB2      LEU  70 -23.287  12.172   2.092
    4    HB3  LEU  70           HB3      LEU  70 -23.898  11.688   0.511
    5    HG   LEU  70           HG       LEU  70 -22.373  13.128  -0.585
    6   HD11  LEU  70          HD11      LEU  70 -21.557  13.994   2.197
    7   HD13  LEU  70          HD12      LEU  70 -22.306  15.003   0.961
    8   HD12  LEU  70          HD13      LEU  70 -20.670  14.388   0.722
    9   HD22  LEU  70          HD21      LEU  70 -20.870  11.469  -0.375
   10   HD21  LEU  70          HD22      LEU  70 -21.759  10.905   1.040
   11   HD23  LEU  70          HD23      LEU  70 -20.417  12.031   1.234

  No H/Q in entry =          11
  In of MODEL   90
    1    H    LEU  71           H        LEU  71 -26.441  11.828   0.413
    2    HA   LEU  71           HA       LEU  71 -27.051  13.302  -2.093
    3    HB2  LEU  71           HB2      LEU  71 -27.134  10.310  -1.656
    4    HB3  LEU  71           HB3      LEU  71 -27.313  11.170  -3.184
    5    HG   LEU  71           HG       LEU  71 -24.778  11.275  -1.550
    6   HD12  LEU  71          HD11      LEU  71 -24.792   9.656  -3.988
    7   HD11  LEU  71          HD12      LEU  71 -25.764   8.989  -2.677
    8   HD13  LEU  71          HD13      LEU  71 -24.053   9.334  -2.418
    9   HD22  LEU  71          HD21      LEU  71 -24.967  13.093  -3.035
   10   HD21  LEU  71          HD22      LEU  71 -25.437  12.036  -4.366
   11   HD23  LEU  71          HD23      LEU  71 -23.804  11.950  -3.705

  No H/Q in entry =          11
  In of MODEL   90
    1    HA   PRO  72           HA       PRO  72 -30.870  12.694   0.567
    2    HB2  PRO  72           HB2      PRO  72 -31.825  15.221   0.504
    3    HB3  PRO  72           HB3      PRO  72 -30.488  14.815   1.581
    4    HG2  PRO  72           HG2      PRO  72 -30.377  16.025  -1.170
    5    HG3  PRO  72           HG3      PRO  72 -29.616  16.601   0.314
    6    HD2  PRO  72           HD2      PRO  72 -28.239  15.101  -1.473
    7    HD3  PRO  72           HD3      PRO  72 -27.960  14.937   0.260

  No H/Q in entry =           7
  In of MODEL   90
    1    H    ASN  73           H        ASN  73 -30.317  13.684  -2.650
    2    HA   ASN  73           HA       ASN  73 -33.169  13.270  -3.254
    3    HB2  ASN  73           HB2      ASN  73 -32.767  14.401  -5.352
    4    HB3  ASN  73           HB3      ASN  73 -32.267  15.394  -3.993
    5   HD21  ASN  73          HD21      ASN  73 -31.502  15.479  -6.677
    6   HD22  ASN  73          HD22      ASN  73 -29.831  15.381  -6.888

  No H/Q in entry =           6
  In of MODEL   90
    1    H    LYS  74           H        LYS  74 -31.102  11.088  -2.859
    2    HA   LYS  74           HA       LYS  74 -31.644   9.682  -5.407
    3    HB2  LYS  74           HB2      LYS  74 -29.085   9.479  -3.813
    4    HB3  LYS  74           HB3      LYS  74 -29.455   8.657  -5.330
    5    HG2  LYS  74           HG2      LYS  74 -29.298  11.634  -5.119
    6    HG3  LYS  74           HG3      LYS  74 -27.889  10.625  -5.442
    7    HD2  LYS  74           HD2      LYS  74 -28.991   9.663  -7.377
    8    HD3  LYS  74           HD3      LYS  74 -30.442  10.606  -7.038
    9    HE2  LYS  74           HE2      LYS  74 -29.295  12.658  -7.485
   10    HE3  LYS  74           HE3      LYS  74 -27.744  11.824  -7.596
   11    HZ2  LYS  74           HZ1      LYS  74 -29.258  12.381  -9.704
   12    HZ1  LYS  74           HZ2      LYS  74 -29.853  10.834  -9.330
   13    HZ3  LYS  74           HZ3      LYS  74 -28.198  11.055  -9.643

  No H/Q in entry =          13
  In of MODEL   90
    1    HA   PRO  75           HA       PRO  75 -32.898   6.638  -2.433
    2    HB2  PRO  75           HB2      PRO  75 -33.144   4.416  -4.021
    3    HB3  PRO  75           HB3      PRO  75 -34.319   5.730  -4.073
    4    HG2  PRO  75           HG2      PRO  75 -31.980   5.224  -5.871
    5    HG3  PRO  75           HG3      PRO  75 -33.647   5.602  -6.299
    6    HD2  PRO  75           HD2      PRO  75 -31.774   7.536  -6.269
    7    HD3  PRO  75           HD3      PRO  75 -33.414   7.875  -5.713

  No H/Q in entry =           7
  In of MODEL   90
    1    H    VAL  76           H        VAL  76 -31.394   5.632  -1.079
    2    HA   VAL  76           HA       VAL  76 -28.899   4.515  -2.216
    3    HB   VAL  76           HB       VAL  76 -29.212   5.960   0.450
    4   HG11  VAL  76          HG11      VAL  76 -26.826   4.763  -0.971
    5   HG13  VAL  76          HG12      VAL  76 -27.489   4.283   0.592
    6   HG12  VAL  76          HG13      VAL  76 -26.701   5.850   0.414
    7   HG22  VAL  76          HG21      VAL  76 -28.621   7.887  -0.437
    8   HG21  VAL  76          HG22      VAL  76 -29.154   7.178  -1.962
    9   HG23  VAL  76          HG23      VAL  76 -27.446   7.149  -1.524

  No H/Q in entry =           9
  In of MODEL   90
    1    H    GLU  77           H        GLU  77 -28.598   2.368  -1.614
    2    HA   GLU  77           HA       GLU  77 -29.330   1.544   1.045
    3    HB2  GLU  77           HB2      GLU  77 -30.882  -0.158   0.524
    4    HB3  GLU  77           HB3      GLU  77 -31.493   1.347  -0.166
    5    HG2  GLU  77           HG2      GLU  77 -30.879   0.618  -2.362
    6    HG3  GLU  77           HG3      GLU  77 -30.177  -0.857  -1.701

  No H/Q in entry =           6
  In of MODEL   90
    1    H    VAL  78           H        VAL  78 -28.921  -0.533   1.693
    2    HA   VAL  78           HA       VAL  78 -26.238  -1.204   0.776
    3    HB   VAL  78           HB       VAL  78 -27.889  -2.157   3.156
    4   HG11  VAL  78          HG11      VAL  78 -25.518  -3.297   2.002
    5   HG13  VAL  78          HG12      VAL  78 -26.394  -3.805   3.449
    6   HG12  VAL  78          HG13      VAL  78 -25.116  -2.597   3.570
    7   HG22  VAL  78          HG21      VAL  78 -26.467  -0.747   4.484
    8   HG21  VAL  78          HG22      VAL  78 -27.250   0.200   3.220
    9   HG23  VAL  78          HG23      VAL  78 -25.558  -0.266   3.051

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ILE  79           H        ILE  79 -25.642  -3.088  -0.141
    2    HA   ILE  79           HA       ILE  79 -27.660  -4.635  -1.474
    3    HB   ILE  79           HB       ILE  79 -24.651  -5.054  -1.284
    4   HG12  ILE  79          HG12      ILE  79 -26.350  -4.003  -3.552
    5   HG13  ILE  79          HG13      ILE  79 -25.501  -2.966  -2.404
    6   HG22  ILE  79          HG21      ILE  79 -25.733  -6.265  -3.596
    7   HG21  ILE  79          HG22      ILE  79 -26.684  -6.828  -2.221
    8   HG23  ILE  79          HG23      ILE  79 -24.934  -7.042  -2.229
    9   HD13  ILE  79          HD11      ILE  79 -24.102  -3.022  -4.237
   10   HD12  ILE  79          HD12      ILE  79 -24.383  -4.741  -4.521
   11   HD11  ILE  79          HD13      ILE  79 -23.403  -4.222  -3.147

  No H/Q in entry =          11
  In of MODEL   90
    1    H    ASP  80           H        ASP  80 -28.449  -6.591  -0.888
    2    HA   ASP  80           HA       ASP  80 -28.337  -7.497   1.754
    3    HB2  ASP  80           HB2      ASP  80 -30.085  -8.131   0.130
    4    HB3  ASP  80           HB3      ASP  80 -28.900  -9.093  -0.753

  No H/Q in entry =           4
  In of MODEL   90
    1    H    SER  81           H        SER  81 -26.750  -8.579   2.865
    2    HA   SER  81           HA       SER  81 -24.243  -9.166   1.646
    3    HB2  SER  81           HB2      SER  81 -23.629 -10.175   3.806
    4    HB3  SER  81           HB3      SER  81 -24.396  -8.604   4.034
    5    HG   SER  81           HG       SER  81 -25.649  -9.638   5.315

  No H/Q in entry =           5
  In of MODEL   90
    1    H    LEU  82           H        LEU  82 -26.872 -11.355   1.988
    2    HA   LEU  82           HA       LEU  82 -25.245 -13.665   1.445
    3    HB2  LEU  82           HB2      LEU  82 -28.204 -13.156   1.219
    4    HB3  LEU  82           HB3      LEU  82 -27.445 -14.730   0.999
    5    HG   LEU  82           HG       LEU  82 -27.412 -13.155   3.555
    6   HD11  LEU  82          HD11      LEU  82 -29.169 -15.377   2.523
    7   HD13  LEU  82          HD12      LEU  82 -29.655 -13.838   3.236
    8   HD12  LEU  82          HD13      LEU  82 -28.943 -15.094   4.250
    9   HD21  LEU  82          HD21      LEU  82 -26.365 -15.815   2.631
   10   HD23  LEU  82          HD22      LEU  82 -26.734 -15.528   4.332
   11   HD22  LEU  82          HD23      LEU  82 -25.522 -14.541   3.513

  No H/Q in entry =          11
  In of MODEL   90
    1    H    LEU  83           H        LEU  83 -27.302 -11.505  -0.448
    2    HA   LEU  83           HA       LEU  83 -27.076 -12.849  -2.925
    3    HB2  LEU  83           HB2      LEU  83 -27.585  -9.960  -2.264
    4    HB3  LEU  83           HB3      LEU  83 -27.610 -10.601  -3.907
    5    HG   LEU  83           HG       LEU  83 -29.606 -11.068  -1.711
    6   HD13  LEU  83          HD11      LEU  83 -30.439  -9.245  -2.762
    7   HD12  LEU  83          HD12      LEU  83 -30.874 -10.371  -4.045
    8   HD11  LEU  83          HD13      LEU  83 -29.373  -9.450  -4.150
    9   HD23  LEU  83          HD21      LEU  83 -29.727 -12.322  -4.438
   10   HD22  LEU  83          HD22      LEU  83 -30.669 -12.711  -3.000
   11   HD21  LEU  83          HD23      LEU  83 -28.965 -13.152  -3.083

  No H/Q in entry =          11
  In of MODEL   90
    1    H    TYR  84           H        TYR  84 -25.194 -10.399  -1.261
    2    HA   TYR  84           HA       TYR  84 -23.372  -9.839  -3.408
    3    HB2  TYR  84           HB2      TYR  84 -23.914  -8.365  -1.396
    4    HB3  TYR  84           HB3      TYR  84 -22.880  -9.441  -0.458
    5    HD1  TYR  84           HD1      TYR  84 -20.472  -9.834  -1.517
    6    HD2  TYR  84           HD2      TYR  84 -22.956  -6.451  -2.304
    7    HE1  TYR  84           HE1      TYR  84 -18.483  -8.558  -2.239
    8    HE2  TYR  84           HE2      TYR  84 -20.977  -5.166  -3.039
    9    HH   TYR  84           HH       TYR  84 -17.946  -6.659  -3.621

  No H/Q in entry =           9
  In of MODEL   90
    1    H    GLY  85           H        GLY  85 -23.031 -11.839  -0.470
    2    HA3  GLY  85           HA2      GLY  85 -20.426 -12.688  -0.981
    3    HA2  GLY  85           HA3      GLY  85 -21.615 -13.581  -0.034

  No H/Q in entry =           3
  In of MODEL   90
    1    H    LYS  86           H        LYS  86 -23.468 -14.015  -2.078
    2    HA   LYS  86           HA       LYS  86 -22.342 -16.347  -3.354
    3    HB2  LYS  86           HB2      LYS  86 -24.757 -15.656  -2.361
    4    HB3  LYS  86           HB3      LYS  86 -25.015 -15.306  -4.070
    5    HG2  LYS  86           HG2      LYS  86 -24.608 -17.572  -4.654
    6    HG3  LYS  86           HG3      LYS  86 -24.141 -17.960  -2.996
    7    HD2  LYS  86           HD2      LYS  86 -26.445 -18.611  -3.309
    8    HD3  LYS  86           HD3      LYS  86 -26.399 -17.206  -2.246
    9    HE2  LYS  86           HE2      LYS  86 -26.608 -16.573  -5.103
   10    HE3  LYS  86           HE3      LYS  86 -27.994 -17.432  -4.433
   11    HZ2  LYS  86           HZ1      LYS  86 -27.356 -14.737  -4.143
   12    HZ1  LYS  86           HZ2      LYS  86 -27.157 -15.452  -2.614
   13    HZ3  LYS  86           HZ3      LYS  86 -28.642 -15.584  -3.425

  No H/Q in entry =          13
  In of MODEL   90
    1    H    VAL  87           H        VAL  87 -22.456 -13.131  -4.239
    2    HA   VAL  87           HA       VAL  87 -22.219 -11.942  -6.179
    3    HB   VAL  87           HB       VAL  87 -21.072 -14.417  -7.508
    4   HG12  VAL  87          HG11      VAL  87 -19.931 -11.645  -7.614
    5   HG11  VAL  87          HG12      VAL  87 -21.392 -12.001  -8.538
    6   HG13  VAL  87          HG13      VAL  87 -19.910 -12.907  -8.845
    7   HG22  VAL  87          HG21      VAL  87 -18.904 -13.942  -6.503
    8   HG21  VAL  87          HG22      VAL  87 -20.094 -14.357  -5.273
    9   HG23  VAL  87          HG23      VAL  87 -19.628 -12.674  -5.517

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ASP  88           H        ASP  88 -24.706 -12.675  -5.804
    2    HA   ASP  88           HA       ASP  88 -25.808 -13.926  -8.193
    3    HB2  ASP  88           HB2      ASP  88 -26.769 -14.213  -5.860
    4    HB3  ASP  88           HB3      ASP  88 -27.285 -12.529  -5.949

  No H/Q in entry =           4
  In of MODEL   90
    1    H    GLY  89           H        GLY  89 -25.167 -12.641  -9.838
    2    HA3  GLY  89           HA2      GLY  89 -25.451  -9.876 -10.030
    3    HA2  GLY  89           HA3      GLY  89 -25.401 -10.991 -11.394

  No H/Q in entry =           3
  In of MODEL   90
    1    H    LEU  90           H        LEU  90 -27.792 -12.433 -10.923
    2    HA   LEU  90           HA       LEU  90 -29.683 -10.563 -12.013
    3    HB2  LEU  90           HB2      LEU  90 -29.667 -12.958 -12.598
    4    HB3  LEU  90           HB3      LEU  90 -30.141 -13.347 -10.945
    5    HG   LEU  90           HG       LEU  90 -32.304 -12.308 -11.283
    6   HD13  LEU  90          HD11      LEU  90 -32.204 -10.558 -12.755
    7   HD12  LEU  90          HD12      LEU  90 -32.709 -11.811 -13.890
    8   HD11  LEU  90          HD13      LEU  90 -31.010 -11.355 -13.783
    9   HD23  LEU  90          HD21      LEU  90 -32.200 -13.928 -13.722
   10   HD22  LEU  90          HD22      LEU  90 -33.157 -14.133 -12.256
   11   HD21  LEU  90          HD23      LEU  90 -31.482 -14.683 -12.299

  No H/Q in entry =          11
  In of MODEL   90
    1    H    GLY  91           H        GLY  91 -29.426 -12.064  -8.834
    2    HA3  GLY  91           HA2      GLY  91 -31.793 -11.040  -7.767
    3    HA2  GLY  91           HA3      GLY  91 -30.372 -11.525  -6.841

  No H/Q in entry =           3
  In of MODEL   90
    1    H    VAL  92           H        VAL  92 -28.532  -9.626  -7.713
    2    HA   VAL  92           HA       VAL  92 -29.391  -7.359  -6.149
    3    HB   VAL  92           HB       VAL  92 -26.847  -7.731  -7.774
    4   HG12  VAL  92          HG11      VAL  92 -27.056  -5.857  -5.440
    5   HG11  VAL  92          HG12      VAL  92 -27.757  -5.336  -6.974
    6   HG13  VAL  92          HG13      VAL  92 -26.044  -5.741  -6.881
    7   HG22  VAL  92          HG21      VAL  92 -26.548  -9.312  -6.188
    8   HG21  VAL  92          HG22      VAL  92 -27.709  -8.577  -5.080
    9   HG23  VAL  92          HG23      VAL  92 -26.080  -7.916  -5.217

  No H/Q in entry =           9
  In of MODEL   90
    1    H    LEU  93           H        LEU  93 -28.997  -7.998  -9.575
    2    HA   LEU  93           HA       LEU  93 -29.450  -5.375 -10.495
    3    HB2  LEU  93           HB2      LEU  93 -28.756  -7.202 -11.968
    4    HB3  LEU  93           HB3      LEU  93 -30.317  -7.989 -11.730
    5    HG   LEU  93           HG       LEU  93 -31.412  -6.062 -12.838
    6   HD11  LEU  93          HD11      LEU  93 -29.617  -4.399 -12.350
    7   HD13  LEU  93          HD12      LEU  93 -30.073  -4.443 -14.054
    8   HD12  LEU  93          HD13      LEU  93 -28.585  -5.223 -13.520
    9   HD23  LEU  93          HD21      LEU  93 -30.378  -6.585 -15.138
   10   HD22  LEU  93          HD22      LEU  93 -31.163  -7.874 -14.225
   11   HD21  LEU  93          HD23      LEU  93 -29.402  -7.753 -14.247

  No H/Q in entry =          11
  In of MODEL   90
    1    H    LYS  94           H        LYS  94 -31.719  -8.010  -9.626
    2    HA   LYS  94           HA       LYS  94 -34.122  -6.655 -10.222
    3    HB2  LYS  94           HB2      LYS  94 -33.505  -8.823  -8.221
    4    HB3  LYS  94           HB3      LYS  94 -35.131  -8.187  -8.470
    5    HG2  LYS  94           HG2      LYS  94 -35.041  -8.953 -10.807
    6    HG3  LYS  94           HG3      LYS  94 -33.450  -9.647 -10.498
    7    HD2  LYS  94           HD2      LYS  94 -34.500 -11.026  -8.664
    8    HD3  LYS  94           HD3      LYS  94 -36.073 -10.435  -9.200
    9    HE2  LYS  94           HE2      LYS  94 -35.548 -11.339 -11.475
   10    HE3  LYS  94           HE3      LYS  94 -34.097 -12.071 -10.789
   11    HZ3  LYS  94           HZ1      LYS  94 -35.891 -13.659 -10.942
   12    HZ2  LYS  94           HZ2      LYS  94 -36.891 -12.672  -9.988
   13    HZ1  LYS  94           HZ3      LYS  94 -35.497 -13.371  -9.316

  No H/Q in entry =          13
  In of MODEL   90
    1    H    ALA  95           H        ALA  95 -32.262  -6.714  -7.194
    2    HA   ALA  95           HA       ALA  95 -34.152  -5.207  -5.689
    3    HB2  ALA  95           HB1      ALA  95 -31.722  -6.494  -5.182
    4    HB3  ALA  95           HB2      ALA  95 -32.720  -5.629  -4.016
    5    HB1  ALA  95           HB3      ALA  95 -31.412  -4.790  -4.850

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ALA  96           H        ALA  96 -31.568  -4.252  -7.814
    2    HA   ALA  96           HA       ALA  96 -31.564  -1.490  -7.033
    3    HB2  ALA  96           HB1      ALA  96 -30.235  -1.208  -9.157
    4    HB3  ALA  96           HB2      ALA  96 -30.479  -2.926  -9.478
    5    HB1  ALA  96           HB3      ALA  96 -29.566  -2.415  -8.058

  No H/Q in entry =           5
  In of MODEL   90
    1    H    VAL  97           H        VAL  97 -33.061  -3.253  -9.708
    2    HA   VAL  97           HA       VAL  97 -34.229  -0.991 -10.945
    3    HB   VAL  97           HB       VAL  97 -34.932  -3.944 -10.987
    4   HG11  VAL  97          HG11      VAL  97 -36.801  -2.002 -11.447
    5   HG13  VAL  97          HG12      VAL  97 -36.810  -3.595 -12.207
    6   HG12  VAL  97          HG13      VAL  97 -36.116  -2.217 -13.059
    7   HG21  VAL  97          HG21      VAL  97 -33.742  -2.066 -13.030
    8   HG23  VAL  97          HG22      VAL  97 -34.138  -3.761 -13.319
    9   HG22  VAL  97          HG23      VAL  97 -32.891  -3.332 -12.146

  No H/Q in entry =           9
  In of MODEL   90
    1    H    ALA  98           H        ALA  98 -35.304  -3.217  -8.402
    2    HA   ALA  98           HA       ALA  98 -37.900  -2.161  -8.019
    3    HB1  ALA  98           HB1      ALA  98 -36.797  -4.326  -7.004
    4    HB3  ALA  98           HB2      ALA  98 -37.999  -3.447  -6.057
    5    HB2  ALA  98           HB3      ALA  98 -36.282  -3.238  -5.716

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ALA  99           H        ALA  99 -34.833  -1.259  -6.404
    2    HA   ALA  99           HA       ALA  99 -36.013   0.680  -4.724
    3    HB1  ALA  99           HB1      ALA  99 -33.343  -0.114  -5.504
    4    HB2  ALA  99           HB2      ALA  99 -33.902   0.612  -3.996
    5    HB3  ALA  99           HB3      ALA  99 -33.478   1.638  -5.365

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ILE 100           H        ILE 100 -35.015   0.856  -8.091
    2    HA   ILE 100           HA       ILE 100 -35.295   3.697  -8.298
    3    HB   ILE 100           HB       ILE 100 -35.340   1.547 -10.442
    4   HG12  ILE 100          HG12      ILE 100 -33.239   3.611  -9.789
    5   HG13  ILE 100          HG13      ILE 100 -33.211   1.961  -9.164
    6   HG21  ILE 100          HG21      ILE 100 -35.865   4.451 -10.558
    7   HG23  ILE 100          HG22      ILE 100 -36.339   3.169 -11.673
    8   HG22  ILE 100          HG23      ILE 100 -34.709   3.841 -11.744
    9   HD12  ILE 100          HD11      ILE 100 -32.743   2.945 -11.941
   10   HD11  ILE 100          HD12      ILE 100 -33.345   1.307 -11.684
   11   HD13  ILE 100          HD13      ILE 100 -31.807   1.801 -10.980

  No H/Q in entry =          11
  In of MODEL   90
    1    H    LYS 101           H        LYS 101 -37.505   1.013  -9.007
    2    HA   LYS 101           HA       LYS 101 -39.653   2.593  -9.978
    3    HB2  LYS 101           HB2      LYS 101 -39.429  -0.180  -8.862
    4    HB3  LYS 101           HB3      LYS 101 -41.010   0.530  -9.187
    5    HG2  LYS 101           HG2      LYS 101 -40.567   0.688 -11.489
    6    HG3  LYS 101           HG3      LYS 101 -38.856   0.340 -11.255
    7    HD2  LYS 101           HD2      LYS 101 -40.049  -1.607 -12.134
    8    HD3  LYS 101           HD3      LYS 101 -39.393  -1.920 -10.527
    9    HE2  LYS 101           HE2      LYS 101 -41.425  -2.687 -10.000
   10    HE3  LYS 101           HE3      LYS 101 -41.940  -1.000  -9.992
   11    HZ3  LYS 101           HZ1      LYS 101 -42.850  -1.180 -12.100
   12    HZ2  LYS 101           HZ2      LYS 101 -43.252  -2.671 -11.393
   13    HZ1  LYS 101           HZ3      LYS 101 -41.960  -2.575 -12.490

  No H/Q in entry =          13
  In of MODEL   90
    1    H    LYS 102           H        LYS 102 -39.076   1.122  -6.780
    2    HA   LYS 102           HA       LYS 102 -41.349   2.236  -5.554
    3    HB2  LYS 102           HB2      LYS 102 -40.038   0.410  -4.559
    4    HB3  LYS 102           HB3      LYS 102 -38.681   1.511  -4.327
    5    HG2  LYS 102           HG2      LYS 102 -40.028   2.854  -2.810
    6    HG3  LYS 102           HG3      LYS 102 -41.388   1.758  -3.045
    7    HD2  LYS 102           HD2      LYS 102 -40.088  -0.070  -2.039
    8    HD3  LYS 102           HD3      LYS 102 -38.729   1.030  -1.803
    9    HE2  LYS 102           HE2      LYS 102 -40.116   2.456  -0.374
   10    HE3  LYS 102           HE3      LYS 102 -41.495   1.387  -0.631
   11    HZ1  LYS 102           HZ1      LYS 102 -39.705  -0.311   0.347
   12    HZ3  LYS 102           HZ2      LYS 102 -40.834   0.532   1.293
   13    HZ2  LYS 102           HZ3      LYS 102 -39.244   1.112   1.150

  No H/Q in entry =          13
  In of MODEL   90
    1    H    ALA 103           H        ALA 103 -38.455   3.731  -6.593
    2    HA   ALA 103           HA       ALA 103 -38.737   6.031  -4.799
    3    HB2  ALA 103           HB1      ALA 103 -36.789   6.838  -6.394
    4    HB3  ALA 103           HB2      ALA 103 -36.700   5.124  -6.798
    5    HB1  ALA 103           HB3      ALA 103 -36.473   5.649  -5.131

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ALA 104           H        ALA 104 -39.369   5.291  -8.141
    2    HA   ALA 104           HA       ALA 104 -40.056   8.056  -8.746
    3    HB2  ALA 104           HB1      ALA 104 -40.100   7.395 -10.950
    4    HB1  ALA 104           HB2      ALA 104 -40.770   5.809 -10.571
    5    HB3  ALA 104           HB3      ALA 104 -39.054   6.129 -10.309

  No H/Q in entry =           5
  In of MODEL   90
    1    H    ALA 105           H        ALA 105 -41.572   5.892  -6.933
    2    HA   ALA 105           HA       ALA 105 -44.042   7.201  -6.874
    3    HB2  ALA 105           HB1      ALA 105 -44.779   6.324  -8.909
    4    HB3  ALA 105           HB2      ALA 105 -45.362   5.111  -7.770
    5    HB1  ALA 105           HB3      ALA 105 -43.892   4.816  -8.696

  No H/Q in entry =           5
  In of MODEL   91
    1    H1   ALA   1           H3       ALA   1 -12.230 -15.784  -2.353
    2    H2   ALA   1           H2       ALA   1 -11.289 -16.925  -3.195
    3    H3   ALA   1           H1       ALA   1 -12.435 -15.983  -4.027
    4    HA   ALA   1           HA       ALA   1 -13.831 -17.685  -3.784
    5    HB3  ALA   1           HB1      ALA   1 -12.432 -19.455  -3.324
    6    HB1  ALA   1           HB2      ALA   1 -13.185 -19.343  -1.734
    7    HB2  ALA   1           HB3      ALA   1 -11.611 -18.600  -2.018

  No H/Q in entry =           7
  In of MODEL   91
    1    H    GLU   2           H        GLU   2 -15.450 -18.541  -2.127
    2    HA   GLU   2           HA       GLU   2 -17.099 -16.823  -1.066
    3    HB2  GLU   2           HB2      GLU   2 -16.153 -19.247   0.478
    4    HB3  GLU   2           HB3      GLU   2 -17.678 -18.399   0.735
    5    HG2  GLU   2           HG2      GLU   2 -18.659 -19.487  -0.998
    6    HG3  GLU   2           HG3      GLU   2 -17.339 -19.085  -2.085

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLU   3           H        GLU   3 -15.180 -18.173   1.554
    2    HA   GLU   3           HA       GLU   3 -15.402 -15.819   3.111
    3    HB2  GLU   3           HB2      GLU   3 -13.813 -18.363   3.360
    4    HB3  GLU   3           HB3      GLU   3 -13.581 -17.043   4.506
    5    HG2  GLU   3           HG2      GLU   3 -15.773 -17.197   5.328
    6    HG3  GLU   3           HG3      GLU   3 -16.369 -17.998   3.881

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LEU   4           H        LEU   4 -12.448 -17.294   1.716
    2    HA   LEU   4           HA       LEU   4 -10.615 -15.388   2.310
    3    HB2  LEU   4           HB2      LEU   4 -10.848 -16.687  -0.414
    4    HB3  LEU   4           HB3      LEU   4  -9.396 -15.964   0.269
    5    HG   LEU   4           HG       LEU   4 -10.885 -18.363   1.385
    6   HD13  LEU   4          HD11      LEU   4  -9.252 -19.717   0.453
    7   HD12  LEU   4          HD12      LEU   4  -8.044 -18.432   0.424
    8   HD11  LEU   4          HD13      LEU   4  -9.335 -18.456  -0.777
    9   HD23  LEU   4          HD21      LEU   4  -8.632 -18.423   2.763
   10   HD22  LEU   4          HD22      LEU   4  -9.953 -17.385   3.293
   11   HD21  LEU   4          HD23      LEU   4  -8.593 -16.695   2.409

  No H/Q in entry =          11
  In of MODEL   91
    1    H    GLU   5           H        GLU   5 -12.954 -15.185  -0.360
    2    HA   GLU   5           HA       GLU   5 -11.956 -12.701  -1.363
    3    HB2  GLU   5           HB2      GLU   5 -13.293 -14.292  -2.722
    4    HB3  GLU   5           HB3      GLU   5 -14.700 -13.916  -1.726
    5    HG2  GLU   5           HG2      GLU   5 -14.751 -11.656  -2.456
    6    HG3  GLU   5           HG3      GLU   5 -13.127 -11.757  -3.136

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLU   6           H        GLU   6 -14.676 -13.582   0.734
    2    HA   GLU   6           HA       GLU   6 -15.584 -10.906   1.133
    3    HB2  GLU   6           HB2      GLU   6 -16.772 -13.211   1.558
    4    HB3  GLU   6           HB3      GLU   6 -16.015 -13.089   3.145
    5    HG2  GLU   6           HG2      GLU   6 -17.152 -11.058   3.647
    6    HG3  GLU   6           HG3      GLU   6 -17.641 -10.822   1.969

  No H/Q in entry =           6
  In of MODEL   91
    1    H    VAL   7           H        VAL   7 -13.271 -13.013   2.702
    2    HA   VAL   7           HA       VAL   7 -12.803 -11.437   5.028
    3    HB   VAL   7           HB       VAL   7 -11.100 -13.479   3.577
    4   HG11  VAL   7          HG11      VAL   7 -10.629 -11.944   6.139
    5   HG13  VAL   7          HG12      VAL   7  -9.531 -12.158   4.777
    6   HG12  VAL   7          HG13      VAL   7  -9.881 -13.515   5.848
    7   HG21  VAL   7          HG21      VAL   7 -13.348 -14.045   4.800
    8   HG23  VAL   7          HG22      VAL   7 -12.419 -13.770   6.274
    9   HG22  VAL   7          HG23      VAL   7 -11.926 -15.029   5.144

  No H/Q in entry =           9
  In of MODEL   91
    1    H    VAL   8           H        VAL   8 -11.297 -11.551   1.816
    2    HA   VAL   8           HA       VAL   8  -9.235  -9.675   2.305
    3    HB   VAL   8           HB       VAL   8 -10.711 -10.438  -0.224
    4   HG12  VAL   8          HG11      VAL   8  -8.304  -9.346  -1.033
    5   HG11  VAL   8          HG12      VAL   8  -8.772  -8.267   0.279
    6   HG13  VAL   8          HG13      VAL   8  -9.857  -8.514  -1.088
    7   HG23  VAL   8          HG21      VAL   8  -7.860 -11.092  -0.006
    8   HG22  VAL   8          HG22      VAL   8  -9.224 -12.149  -0.361
    9   HG21  VAL   8          HG23      VAL   8  -8.794 -11.801   1.311

  No H/Q in entry =           9
  In of MODEL   91
    1    H    MET   9           H        MET   9 -12.583  -9.290   1.149
    2    HA   MET   9           HA       MET   9 -12.524  -6.513   0.714
    3    HB2  MET   9           HB2      MET   9 -14.714  -8.420   1.559
    4    HB3  MET   9           HB3      MET   9 -15.027  -6.700   1.325
    5    HG2  MET   9           HG2      MET   9 -14.372  -6.807  -0.979
    6    HG3  MET   9           HG3      MET   9 -13.731  -8.438  -0.785
    7    HE1  MET   9           HE1      MET   9 -16.565  -6.102  -0.533
    8    HE3  MET   9           HE2      MET   9 -17.292  -7.083   0.735
    9    HE2  MET   9           HE3      MET   9 -18.048  -7.007  -0.849

  No H/Q in entry =           9
  In of MODEL   91
    1    H    GLY  10           H        GLY  10 -13.180  -8.404   3.643
    2    HA3  GLY  10           HA2      GLY  10 -13.729  -6.220   5.361
    3    HA2  GLY  10           HA3      GLY  10 -13.161  -7.807   5.875

  No H/Q in entry =           3
  In of MODEL   91
    1    H    LEU  11           H        LEU  11 -10.717  -7.928   4.557
    2    HA   LEU  11           HA       LEU  11  -9.017  -6.491   6.311
    3    HB2  LEU  11           HB2      LEU  11  -8.471  -7.915   3.703
    4    HB3  LEU  11           HB3      LEU  11  -7.201  -7.208   4.700
    5    HG   LEU  11           HG       LEU  11  -9.198  -9.244   5.720
    6   HD13  LEU  11          HD11      LEU  11  -7.977 -10.480   4.154
    7   HD12  LEU  11          HD12      LEU  11  -7.039 -10.716   5.628
    8   HD11  LEU  11          HD13      LEU  11  -6.502  -9.551   4.419
    9   HD22  LEU  11          HD21      LEU  11  -8.344  -8.229   7.635
   10   HD21  LEU  11          HD22      LEU  11  -6.808  -7.825   6.870
   11   HD23  LEU  11          HD23      LEU  11  -7.130  -9.482   7.380

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  12           H        ILE  12  -9.924  -5.947   2.922
    2    HA   ILE  12           HA       ILE  12  -8.237  -3.715   2.492
    3    HB   ILE  12           HB       ILE  12 -10.927  -4.446   1.275
    4   HG12  ILE  12          HG12      ILE  12  -9.056  -6.100   0.948
    5   HG13  ILE  12          HG13      ILE  12  -9.687  -5.431  -0.544
    6   HG21  ILE  12          HG21      ILE  12  -8.853  -2.439   0.392
    7   HG23  ILE  12          HG22      ILE  12 -10.518  -2.108   0.874
    8   HG22  ILE  12          HG23      ILE  12 -10.181  -3.008  -0.610
    9   HD11  ILE  12          HD11      ILE  12  -7.711  -3.702  -0.204
   10   HD13  ILE  12          HD12      ILE  12  -7.408  -5.283  -0.902
   11   HD12  ILE  12          HD13      ILE  12  -7.063  -4.991   0.797

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  13           H        ILE  13 -11.596  -3.988   3.590
    2    HA   ILE  13           HA       ILE  13 -12.062  -1.202   3.859
    3    HB   ILE  13           HB       ILE  13 -13.282  -3.602   5.242
    4   HG12  ILE  13          HG12      ILE  13 -13.483  -3.064   2.664
    5   HG13  ILE  13          HG13      ILE  13 -14.904  -3.550   3.573
    6   HG22  ILE  13          HG21      ILE  13 -15.143  -1.949   5.779
    7   HG21  ILE  13          HG22      ILE  13 -14.009  -0.666   5.355
    8   HG23  ILE  13          HG23      ILE  13 -13.656  -1.744   6.706
    9   HD11  ILE  13          HD11      ILE  13 -14.150  -0.646   3.188
   10   HD13  ILE  13          HD12      ILE  13 -15.687  -1.297   3.743
   11   HD12  ILE  13          HD13      ILE  13 -15.196  -1.512   2.065

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ASN  14           H        ASN  14 -10.942  -3.689   6.133
    2    HA   ASN  14           HA       ASN  14 -10.742  -2.049   8.418
    3    HB2  ASN  14           HB2      ASN  14 -10.483  -4.656   8.097
    4    HB3  ASN  14           HB3      ASN  14  -8.775  -4.264   7.937
    5   HD21  ASN  14          HD21      ASN  14  -9.405  -5.789  10.115
    6   HD22  ASN  14          HD22      ASN  14  -9.378  -4.868  11.539

  No H/Q in entry =           6
  In of MODEL   91
    1    H    SER  15           H        SER  15  -8.341  -2.867   5.924
    2    HA   SER  15           HA       SER  15  -6.201  -1.367   6.992
    3    HB2  SER  15           HB2      SER  15  -5.162  -1.611   4.867
    4    HB3  SER  15           HB3      SER  15  -6.151  -3.054   5.059
    5    HG   SER  15           HG       SER  15  -6.812  -2.377   3.146

  No H/Q in entry =           5
  In of MODEL   91
    1    H    GLY  16           H        GLY  16  -8.808  -0.510   4.748
    2    HA3  GLY  16           HA2      GLY  16  -7.959   2.133   4.193
    3    HA2  GLY  16           HA3      GLY  16  -9.608   1.533   4.034

  No H/Q in entry =           3
  In of MODEL   91
    1    H    GLN  17           H        GLN  17 -10.145   0.807   6.685
    2    HA   GLN  17           HA       GLN  17 -10.860   3.310   7.825
    3    HB2  GLN  17           HB2      GLN  17 -11.904   0.976   8.218
    4    HB3  GLN  17           HB3      GLN  17 -10.628   0.763   9.414
    5    HG2  GLN  17           HG2      GLN  17 -11.515   2.329  10.852
    6    HG3  GLN  17           HG3      GLN  17 -12.189   3.310   9.555
    7   HE21  GLN  17          HE21      GLN  17 -14.233   3.287  10.893
    8   HE22  GLN  17          HE22      GLN  17 -15.261   1.941  10.781

  No H/Q in entry =           8
  In of MODEL   91
    1    H    ALA  18           H        ALA  18  -8.222   1.039   8.442
    2    HA   ALA  18           HA       ALA  18  -7.127   2.261  10.711
    3    HB2  ALA  18           HB1      ALA  18  -6.510   0.047   9.344
    4    HB3  ALA  18           HB2      ALA  18  -5.349   0.835  10.413
    5    HB1  ALA  18           HB3      ALA  18  -5.274   1.113   8.672

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ARG  19           H        ARG  19  -6.361   2.786   7.261
    2    HA   ARG  19           HA       ARG  19  -4.471   4.841   7.686
    3    HB2  ARG  19           HB2      ARG  19  -4.795   3.697   5.492
    4    HB3  ARG  19           HB3      ARG  19  -6.341   4.531   5.316
    5    HG2  ARG  19           HG2      ARG  19  -5.222   6.708   5.382
    6    HG3  ARG  19           HG3      ARG  19  -3.670   5.929   5.685
    7    HD2  ARG  19           HD2      ARG  19  -3.800   6.517   3.341
    8    HD3  ARG  19           HD3      ARG  19  -3.877   4.757   3.488
    9    HE   ARG  19           HE       ARG  19  -6.514   5.654   3.483
   10   HH21  ARG  19          HH11      ARG  19  -7.712   5.804   1.566
   11   HH22  ARG  19          HH12      ARG  19  -6.892   5.884   0.045
   12   HH11  ARG  19          HH21      ARG  19  -3.742   5.729   1.446
   13   HH12  ARG  19          HH22      ARG  19  -4.643   5.839  -0.022

  No H/Q in entry =          13
  In of MODEL   91
    1    H    SER  20           H        SER  20  -7.970   4.940   7.090
    2    HA   SER  20           HA       SER  20  -8.341   7.694   7.039
    3    HB2  SER  20           HB2      SER  20 -10.213   6.344   6.507
    4    HB3  SER  20           HB3      SER  20 -10.100   5.453   8.022
    5    HG   SER  20           HG       SER  20 -10.606   8.239   7.842

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LEU  21           H        LEU  21  -8.327   5.513   9.846
    2    HA   LEU  21           HA       LEU  21  -8.776   7.508  11.809
    3    HB2  LEU  21           HB2      LEU  21  -7.395   4.819  11.944
    4    HB3  LEU  21           HB3      LEU  21  -7.707   5.818  13.362
    5    HG   LEU  21           HG       LEU  21  -9.886   4.964  11.441
    6   HD12  LEU  21          HD11      LEU  21  -9.607   3.698  14.134
    7   HD11  LEU  21          HD12      LEU  21  -8.540   3.125  12.854
    8   HD13  LEU  21          HD13      LEU  21 -10.288   3.039  12.649
    9   HD21  LEU  21          HD21      LEU  21  -9.757   6.754  13.722
   10   HD23  LEU  21          HD22      LEU  21 -10.844   5.416  14.083
   11   HD22  LEU  21          HD23      LEU  21 -11.119   6.414  12.657

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ALA  22           H        ALA  22  -5.818   6.149  10.400
    2    HA   ALA  22           HA       ALA  22  -3.944   7.474  12.019
    3    HB2  ALA  22           HB1      ALA  22  -3.519   5.621  10.329
    4    HB1  ALA  22           HB2      ALA  22  -2.330   6.923  10.362
    5    HB3  ALA  22           HB3      ALA  22  -3.549   6.872   9.087

  No H/Q in entry =           5
  In of MODEL   91
    1    H    TYR  23           H        TYR  23  -5.269   8.481   8.837
    2    HA   TYR  23           HA       TYR  23  -3.946  10.984   8.764
    3    HB2  TYR  23           HB2      TYR  23  -5.021  10.072   6.772
    4    HB3  TYR  23           HB3      TYR  23  -6.600  10.161   7.553
    5    HD1  TYR  23           HD1      TYR  23  -3.715  12.238   6.415
    6    HD2  TYR  23           HD2      TYR  23  -7.861  12.158   7.533
    7    HE1  TYR  23           HE1      TYR  23  -3.964  14.587   5.660
    8    HE2  TYR  23           HE2      TYR  23  -8.111  14.506   6.778
    9    HH   TYR  23           HH       TYR  23  -5.382  16.261   5.305

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ALA  24           H        ALA  24  -7.059   9.991  10.146
    2    HA   ALA  24           HA       ALA  24  -7.909  12.577  10.916
    3    HB1  ALA  24           HB1      ALA  24  -9.721  11.317  11.386
    4    HB2  ALA  24           HB2      ALA  24  -8.890  10.751  12.833
    5    HB3  ALA  24           HB3      ALA  24  -8.762   9.838  11.331

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ALA  25           H        ALA  25  -5.893  10.131  12.490
    2    HA   ALA  25           HA       ALA  25  -5.560  11.388  14.991
    3    HB2  ALA  25           HB1      ALA  25  -4.781   9.039  14.172
    4    HB3  ALA  25           HB2      ALA  25  -3.769   9.904  15.331
    5    HB1  ALA  25           HB3      ALA  25  -3.335   9.888  13.621

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LEU  26           H        LEU  26  -3.773  11.694  11.949
    2    HA   LEU  26           HA       LEU  26  -1.823  13.525  12.862
    3    HB2  LEU  26           HB2      LEU  26  -1.517  12.373  10.759
    4    HB3  LEU  26           HB3      LEU  26  -2.995  13.073  10.105
    5    HG   LEU  26           HG       LEU  26  -1.992  15.328  10.238
    6   HD12  LEU  26          HD11      LEU  26   0.546  15.362  10.650
    7   HD11  LEU  26          HD12      LEU  26   0.332  13.781  11.396
    8   HD13  LEU  26          HD13      LEU  26  -0.483  15.192  12.072
    9   HD21  LEU  26          HD21      LEU  26  -0.239  13.282   8.843
   10   HD23  LEU  26          HD22      LEU  26  -0.292  15.003   8.472
   11   HD22  LEU  26          HD23      LEU  26  -1.710  13.997   8.185

  No H/Q in entry =          11
  In of MODEL   91
    1    H    LYS  27           H        LYS  27  -5.009  13.990  11.387
    2    HA   LYS  27           HA       LYS  27  -4.968  16.778  11.186
    3    HB2  LYS  27           HB2      LYS  27  -6.704  15.290  10.203
    4    HB3  LYS  27           HB3      LYS  27  -7.359  15.032  11.820
    5    HG2  LYS  27           HG2      LYS  27  -7.800  17.436  12.054
    6    HG3  LYS  27           HG3      LYS  27  -7.095  17.735  10.462
    7    HD2  LYS  27           HD2      LYS  27  -8.820  16.291   9.429
    8    HD3  LYS  27           HD3      LYS  27  -9.532  16.009  11.019
    9    HE2  LYS  27           HE2      LYS  27  -9.986  18.418  11.261
   10    HE3  LYS  27           HE3      LYS  27  -9.247  18.722   9.685
   11    HZ3  LYS  27           HZ1      LYS  27 -11.623  18.585   9.445
   12    HZ2  LYS  27           HZ2      LYS  27 -11.664  17.069  10.216
   13    HZ1  LYS  27           HZ3      LYS  27 -10.921  17.235   8.694

  No H/Q in entry =          13
  In of MODEL   91
    1    H    GLN  28           H        GLN  28  -5.845  14.690  13.916
    2    HA   GLN  28           HA       GLN  28  -6.748  16.691  15.691
    3    HB2  GLN  28           HB2      GLN  28  -5.342  14.062  16.225
    4    HB3  GLN  28           HB3      GLN  28  -6.069  15.066  17.480
    5    HG2  GLN  28           HG2      GLN  28  -7.564  13.977  15.080
    6    HG3  GLN  28           HG3      GLN  28  -7.592  13.251  16.686
    7   HE21  GLN  28          HE21      GLN  28  -9.492  15.107  14.790
    8   HE22  GLN  28          HE22      GLN  28 -10.223  16.096  15.961

  No H/Q in entry =           8
  In of MODEL   91
    1    H    ALA  29           H        ALA  29  -3.524  15.408  15.000
    2    HA   ALA  29           HA       ALA  29  -2.090  16.814  16.976
    3    HB1  ALA  29           HB1      ALA  29  -0.158  16.129  15.856
    4    HB3  ALA  29           HB2      ALA  29  -0.914  16.249  14.267
    5    HB2  ALA  29           HB3      ALA  29  -1.330  14.916  15.343

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LYS  30           H        LYS  30  -2.954  17.687  13.647
    2    HA   LYS  30           HA       LYS  30  -1.551  20.131  13.543
    3    HB2  LYS  30           HB2      LYS  30  -4.081  19.249  12.137
    4    HB3  LYS  30           HB3      LYS  30  -3.251  20.766  11.791
    5    HG2  LYS  30           HG2      LYS  30  -1.179  19.477  11.277
    6    HG3  LYS  30           HG3      LYS  30  -2.081  17.980  11.524
    7    HD2  LYS  30           HD2      LYS  30  -3.649  18.615   9.730
    8    HD3  LYS  30           HD3      LYS  30  -2.769  20.125   9.485
    9    HE2  LYS  30           HE2      LYS  30  -0.734  18.836   8.905
   10    HE3  LYS  30           HE3      LYS  30  -1.633  17.331   9.119
   11    HZ2  LYS  30           HZ1      LYS  30  -1.461  18.201   6.776
   12    HZ1  LYS  30           HZ2      LYS  30  -2.507  19.462   7.244
   13    HZ3  LYS  30           HZ3      LYS  30  -3.028  17.844   7.317

  No H/Q in entry =          13
  In of MODEL   91
    1    H    GLN  31           H        GLN  31  -4.648  19.275  14.959
    2    HA   GLN  31           HA       GLN  31  -5.415  22.030  15.410
    3    HB2  GLN  31           HB2      GLN  31  -6.590  19.584  16.736
    4    HB3  GLN  31           HB3      GLN  31  -7.352  21.154  16.490
    5    HG2  GLN  31           HG2      GLN  31  -6.643  20.376  13.900
    6    HG3  GLN  31           HG3      GLN  31  -7.165  18.872  14.648
    7   HE21  GLN  31          HE21      GLN  31  -8.580  20.443  12.547
    8   HE22  GLN  31          HE22      GLN  31 -10.093  20.833  13.207

  No H/Q in entry =           8
  In of MODEL   91
    1    H    GLY  32           H        GLY  32  -3.099  20.106  16.729
    2    HA3  GLY  32           HA2      GLY  32  -1.697  20.570  18.529
    3    HA2  GLY  32           HA3      GLY  32  -2.826  21.813  19.053

  No H/Q in entry =           3
  In of MODEL   91
    1    H    ASP  33           H        ASP  33  -4.247  18.772  18.395
    2    HA   ASP  33           HA       ASP  33  -4.654  18.315  21.275
    3    HB2  ASP  33           HB2      ASP  33  -6.063  17.302  18.800
    4    HB3  ASP  33           HB3      ASP  33  -6.406  16.692  20.417

  No H/Q in entry =           4
  In of MODEL   91
    1    H    PHE  34           H        PHE  34  -2.485  17.466  21.578
    2    HA   PHE  34           HA       PHE  34  -1.485  15.217  20.177
    3    HB2  PHE  34           HB2      PHE  34  -0.865  16.203  22.970
    4    HB3  PHE  34           HB3      PHE  34   0.063  14.980  22.102
    5    HD1  PHE  34           HD1      PHE  34  -0.110  18.406  22.836
    6    HD2  PHE  34           HD2      PHE  34   0.718  15.702  19.601
    7    HE1  PHE  34           HE1      PHE  34   1.183  20.177  21.680
    8    HE2  PHE  34           HE2      PHE  34   2.006  17.476  18.450
    9    HZ   PHE  34           HZ       PHE  34   2.240  19.711  19.494

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ALA  35           H        ALA  35  -3.521  15.494  23.042
    2    HA   ALA  35           HA       ALA  35  -3.306  12.832  23.939
    3    HB3  ALA  35           HB1      ALA  35  -5.763  13.457  24.800
    4    HB1  ALA  35           HB2      ALA  35  -5.231  15.075  24.343
    5    HB2  ALA  35           HB3      ALA  35  -4.315  14.152  25.533

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ALA  36           H        ALA  36  -5.760  14.347  21.842
    2    HA   ALA  36           HA       ALA  36  -7.175  11.934  21.367
    3    HB1  ALA  36           HB1      ALA  36  -8.632  13.356  20.413
    4    HB3  ALA  36           HB2      ALA  36  -7.462  13.777  19.162
    5    HB2  ALA  36           HB3      ALA  36  -7.485  14.665  20.686

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ALA  37           H        ALA  37  -4.497  13.523  19.695
    2    HA   ALA  37           HA       ALA  37  -4.465  11.887  17.398
    3    HB3  ALA  37           HB1      ALA  37  -2.471  13.600  18.817
    4    HB2  ALA  37           HB2      ALA  37  -3.004  13.655  17.138
    5    HB1  ALA  37           HB3      ALA  37  -1.849  12.426  17.658

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LYS  38           H        LYS  38  -2.703  11.582  20.474
    2    HA   LYS  38           HA       LYS  38  -1.377   9.183  19.983
    3    HB2  LYS  38           HB2      LYS  38  -1.698  10.946  22.129
    4    HB3  LYS  38           HB3      LYS  38  -2.316   9.416  22.746
    5    HG2  LYS  38           HG2      LYS  38  -0.222   8.296  22.207
    6    HG3  LYS  38           HG3      LYS  38   0.385   9.742  21.392
    7    HD2  LYS  38           HD2      LYS  38   0.556  10.961  23.427
    8    HD3  LYS  38           HD3      LYS  38  -0.461   9.810  24.296
    9    HE2  LYS  38           HE2      LYS  38   1.895   9.496  24.912
   10    HE3  LYS  38           HE3      LYS  38   1.291   8.079  24.049
   11    HZ3  LYS  38           HZ1      LYS  38   2.589   8.498  22.266
   12    HZ2  LYS  38           HZ2      LYS  38   3.545   9.327  23.401
   13    HZ1  LYS  38           HZ3      LYS  38   2.464  10.186  22.411

  No H/Q in entry =          13
  In of MODEL   91
    1    H    ALA  39           H        ALA  39  -4.614   9.676  21.390
    2    HA   ALA  39           HA       ALA  39  -5.172   6.957  21.896
    3    HB3  ALA  39           HB1      ALA  39  -7.333   8.900  21.131
    4    HB2  ALA  39           HB2      ALA  39  -6.433   9.128  22.631
    5    HB1  ALA  39           HB3      ALA  39  -7.349   7.643  22.369

  No H/Q in entry =           5
  In of MODEL   91
    1    H    MET  40           H        MET  40  -5.762   8.969  19.050
    2    HA   MET  40           HA       MET  40  -7.239   7.036  17.591
    3    HB2  MET  40           HB2      MET  40  -5.632   9.432  16.684
    4    HB3  MET  40           HB3      MET  40  -6.659   8.472  15.616
    5    HG2  MET  40           HG2      MET  40  -7.691   9.721  18.175
    6    HG3  MET  40           HG3      MET  40  -7.751  10.555  16.624
    7    HE3  MET  40           HE1      MET  40 -10.336   8.934  14.564
    8    HE2  MET  40           HE2      MET  40  -8.584   9.052  14.413
    9    HE1  MET  40           HE3      MET  40  -9.501  10.417  15.048

  No H/Q in entry =           9
  In of MODEL   91
    1    H    MET  41           H        MET  41  -3.748   7.776  17.709
    2    HA   MET  41           HA       MET  41  -2.991   6.022  15.608
    3    HB2  MET  41           HB2      MET  41  -1.372   6.691  18.079
    4    HB3  MET  41           HB3      MET  41  -0.756   6.043  16.563
    5    HG2  MET  41           HG2      MET  41  -1.916   8.224  15.560
    6    HG3  MET  41           HG3      MET  41  -1.678   8.813  17.204
    7    HE2  MET  41           HE1      MET  41   1.243   6.717  17.562
    8    HE1  MET  41           HE2      MET  41   0.454   8.010  18.461
    9    HE3  MET  41           HE3      MET  41   2.076   8.256  17.816

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ASP  42           H        ASP  42  -3.371   5.549  19.095
    2    HA   ASP  42           HA       ASP  42  -2.332   2.956  19.254
    3    HB2  ASP  42           HB2      ASP  42  -3.206   4.715  21.077
    4    HB3  ASP  42           HB3      ASP  42  -4.632   3.688  21.007

  No H/Q in entry =           4
  In of MODEL   91
    1    H    GLN  43           H        GLN  43  -5.668   4.056  18.758
    2    HA   GLN  43           HA       GLN  43  -6.808   1.467  18.564
    3    HB2  GLN  43           HB2      GLN  43  -7.736   4.118  17.436
    4    HB3  GLN  43           HB3      GLN  43  -8.697   2.637  17.415
    5    HG2  GLN  43           HG2      GLN  43  -8.400   2.517  19.923
    6    HG3  GLN  43           HG3      GLN  43  -7.678   4.123  19.850
    7   HE21  GLN  43          HE21      GLN  43  -9.856   4.200  21.353
    8   HE22  GLN  43          HE22      GLN  43 -11.218   4.773  20.523

  No H/Q in entry =           8
  In of MODEL   91
    1    H    SER  44           H        SER  44  -5.473   3.682  16.151
    2    HA   SER  44           HA       SER  44  -6.175   2.197  13.863
    3    HB2  SER  44           HB2      SER  44  -4.921   4.582  14.305
    4    HB3  SER  44           HB3      SER  44  -3.567   3.588  13.773
    5    HG   SER  44           HG       SER  44  -4.682   4.558  12.011

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ARG  45           H        ARG  45  -3.295   2.088  15.940
    2    HA   ARG  45           HA       ARG  45  -1.814   0.136  14.556
    3    HB2  ARG  45           HB2      ARG  45  -0.972   1.558  16.424
    4    HB3  ARG  45           HB3      ARG  45  -1.960   0.627  17.545
    5    HG2  ARG  45           HG2      ARG  45  -0.727  -1.430  16.901
    6    HG3  ARG  45           HG3      ARG  45   0.286  -0.474  15.822
    7    HD2  ARG  45           HD2      ARG  45   1.021   0.908  17.777
    8    HD3  ARG  45           HD3      ARG  45   0.101  -0.168  18.851
    9    HE   ARG  45           HE       ARG  45   1.801  -1.762  17.269
   10   HH21  ARG  45          HH11      ARG  45   3.703  -2.582  18.104
   11   HH22  ARG  45          HH12      ARG  45   4.476  -1.795  19.434
   12   HH11  ARG  45          HH21      ARG  45   2.103   0.705  19.658
   13   HH12  ARG  45          HH22      ARG  45   3.570   0.069  20.312

  No H/Q in entry =          13
  In of MODEL   91
    1    H    MET  46           H        MET  46  -4.208  -0.188  17.159
    2    HA   MET  46           HA       MET  46  -4.037  -2.987  17.465
    3    HB2  MET  46           HB2      MET  46  -6.322  -1.077  18.007
    4    HB3  MET  46           HB3      MET  46  -6.297  -2.766  18.523
    5    HG2  MET  46           HG2      MET  46  -4.331  -2.392  19.880
    6    HG3  MET  46           HG3      MET  46  -4.136  -0.767  19.239
    7    HE1  MET  46           HE1      MET  46  -5.911  -3.242  21.228
    8    HE3  MET  46           HE2      MET  46  -7.544  -2.644  20.974
    9    HE2  MET  46           HE3      MET  46  -6.744  -2.366  22.515

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ALA  47           H        ALA  47  -6.061  -0.972  15.373
    2    HA   ALA  47           HA       ALA  47  -7.678  -3.024  14.308
    3    HB3  ALA  47           HB1      ALA  47  -8.360  -0.787  13.893
    4    HB1  ALA  47           HB2      ALA  47  -7.872  -1.420  12.321
    5    HB2  ALA  47           HB3      ALA  47  -6.792  -0.351  13.217

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LEU  48           H        LEU  48  -4.561  -1.713  13.255
    2    HA   LEU  48           HA       LEU  48  -4.281  -3.303  10.913
    3    HB2  LEU  48           HB2      LEU  48  -2.223  -2.024  12.720
    4    HB3  LEU  48           HB3      LEU  48  -1.855  -2.744  11.152
    5    HG   LEU  48           HG       LEU  48  -3.879  -0.527  11.544
    6   HD13  LEU  48          HD11      LEU  48  -1.757   0.349  12.208
    7   HD12  LEU  48          HD12      LEU  48  -2.033   0.903  10.556
    8   HD11  LEU  48          HD13      LEU  48  -0.935  -0.443  10.864
    9   HD22  LEU  48          HD21      LEU  48  -4.352  -1.512   9.468
   10   HD21  LEU  48          HD22      LEU  48  -2.669  -1.947   9.172
   11   HD23  LEU  48          HD23      LEU  48  -3.188  -0.267   9.013

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ASN  49           H        ASN  49  -3.233  -3.701  14.258
    2    HA   ASN  49           HA       ASN  49  -1.631  -5.964  13.926
    3    HB2  ASN  49           HB2      ASN  49  -1.665  -4.671  16.010
    4    HB3  ASN  49           HB3      ASN  49  -3.324  -5.183  16.315
    5   HD21  ASN  49          HD21      ASN  49  -1.008  -5.775  18.045
    6   HD22  ASN  49          HD22      ASN  49  -0.855  -7.466  18.079

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLU  50           H        GLU  50  -5.099  -5.687  14.600
    2    HA   GLU  50           HA       GLU  50  -5.613  -8.486  14.709
    3    HB2  GLU  50           HB2      GLU  50  -7.197  -6.798  15.586
    4    HB3  GLU  50           HB3      GLU  50  -7.491  -6.233  13.940
    5    HG2  GLU  50           HG2      GLU  50  -8.358  -8.429  13.302
    6    HG3  GLU  50           HG3      GLU  50  -7.976  -9.073  14.895

  No H/Q in entry =           6
  In of MODEL   91
    1    H    ALA  51           H        ALA  51  -5.681  -6.087  12.113
    2    HA   ALA  51           HA       ALA  51  -6.669  -7.814  10.091
    3    HB2  ALA  51           HB1      ALA  51  -6.448  -6.001   8.723
    4    HB1  ALA  51           HB2      ALA  51  -4.808  -5.654   9.270
    5    HB3  ALA  51           HB3      ALA  51  -6.191  -5.141  10.240

  No H/Q in entry =           5
  In of MODEL   91
    1    H    HIS  52           H        HIS  52  -3.377  -6.911  11.073
    2    HA   HIS  52           HA       HIS  52  -1.981  -8.402   9.123
    3    HB2  HIS  52           HB2      HIS  52  -0.942  -6.670  10.561
    4    HB3  HIS  52           HB3      HIS  52  -1.113  -7.745  11.948
    5    HD1  HIS  52           HD1      HIS  52   0.228 -10.061  11.803
    6    HD2  HIS  52           HD2      HIS  52   1.280  -7.207   8.953
    7    HE1  HIS  52           HE1      HIS  52   2.443 -10.807  10.827
    8    HE2  HIS  52           HE2      HIS  52   3.099  -9.076   9.088

  No H/Q in entry =           8
  In of MODEL   91
    1    H    LEU  53           H        LEU  53  -3.192  -9.278  12.335
    2    HA   LEU  53           HA       LEU  53  -1.999 -11.824  12.528
    3    HB2  LEU  53           HB2      LEU  53  -4.490 -10.607  13.707
    4    HB3  LEU  53           HB3      LEU  53  -4.063 -12.286  14.023
    5    HG   LEU  53           HG       LEU  53  -2.097 -10.027  14.461
    6   HD12  LEU  53          HD11      LEU  53  -2.809 -10.453  16.945
    7   HD11  LEU  53          HD12      LEU  53  -4.306 -11.051  16.228
    8   HD13  LEU  53          HD13      LEU  53  -3.794  -9.387  15.943
    9   HD21  LEU  53          HD21      LEU  53  -2.302 -12.933  15.262
   10   HD23  LEU  53          HD22      LEU  53  -1.322 -11.811  16.202
   11   HD22  LEU  53          HD23      LEU  53  -0.950 -12.091  14.504

  No H/Q in entry =          11
  In of MODEL   91
    1    H    VAL  54           H        VAL  54  -5.109 -10.788  11.168
    2    HA   VAL  54           HA       VAL  54  -6.029 -13.380  10.480
    3    HB   VAL  54           HB       VAL  54  -6.670 -10.646   9.347
    4   HG12  VAL  54          HG11      VAL  54  -8.776 -12.019   8.536
    5   HG11  VAL  54          HG12      VAL  54  -7.667 -13.387   8.607
    6   HG13  VAL  54          HG13      VAL  54  -7.305 -12.013   7.565
    7   HG22  VAL  54          HG21      VAL  54  -7.576 -10.682  11.499
    8   HG21  VAL  54          HG22      VAL  54  -7.834 -12.425  11.479
    9   HG23  VAL  54          HG23      VAL  54  -8.913 -11.365  10.574

  No H/Q in entry =           9
  In of MODEL   91
    1    H    GLN  55           H        GLN  55  -4.152 -10.933   8.691
    2    HA   GLN  55           HA       GLN  55  -4.027 -12.397   6.273
    3    HB2  GLN  55           HB2      GLN  55  -3.418 -10.134   6.083
    4    HB3  GLN  55           HB3      GLN  55  -2.307 -10.213   7.448
    5    HG2  GLN  55           HG2      GLN  55  -0.592 -11.063   6.170
    6    HG3  GLN  55           HG3      GLN  55  -1.669 -12.035   5.176
    7   HE21  GLN  55          HE21      GLN  55  -1.685 -11.345   3.055
    8   HE22  GLN  55          HE22      GLN  55  -1.483  -9.740   2.545

  No H/Q in entry =           8
  In of MODEL   91
    1    H    THR  56           H        THR  56  -1.920 -12.382   9.152
    2    HA   THR  56           HA       THR  56   0.154 -13.986   8.233
    3    HB   THR  56           HB       THR  56  -1.096 -14.217  10.983
    4    HG1  THR  56           HG1      THR  56   0.356 -12.204   9.736
    5   HG21  THR  56          HG21      THR  56   1.213 -15.406   9.769
    6   HG23  THR  56          HG22      THR  56   0.689 -15.520  11.448
    7   HG22  THR  56          HG23      THR  56   1.769 -14.220  10.949

  No H/Q in entry =           7
  In of MODEL   91
    1    H    LYS  57           H        LYS  57  -2.968 -15.014   9.598
    2    HA   LYS  57           HA       LYS  57  -2.531 -17.811   9.351
    3    HB2  LYS  57           HB2      LYS  57  -4.359 -16.763  10.699
    4    HB3  LYS  57           HB3      LYS  57  -5.174 -16.349   9.190
    5    HG2  LYS  57           HG2      LYS  57  -5.271 -18.716   8.561
    6    HG3  LYS  57           HG3      LYS  57  -4.392 -19.157  10.025
    7    HD2  LYS  57           HD2      LYS  57  -6.226 -18.224  11.400
    8    HD3  LYS  57           HD3      LYS  57  -7.112 -17.819   9.929
    9    HE2  LYS  57           HE2      LYS  57  -6.890 -20.307   9.312
   10    HE3  LYS  57           HE3      LYS  57  -6.414 -20.559  10.992
   11    HZ2  LYS  57           HZ1      LYS  57  -9.005 -20.065   9.895
   12    HZ1  LYS  57           HZ2      LYS  57  -8.632 -18.979  11.148
   13    HZ3  LYS  57           HZ3      LYS  57  -8.576 -20.655  11.426

  No H/Q in entry =          13
  In of MODEL   91
    1    H    LEU  58           H        LEU  58  -3.856 -15.364   7.177
    2    HA   LEU  58           HA       LEU  58  -4.665 -17.186   5.170
    3    HB2  LEU  58           HB2      LEU  58  -4.049 -14.240   5.035
    4    HB3  LEU  58           HB3      LEU  58  -4.716 -15.174   3.695
    5    HG   LEU  58           HG       LEU  58  -5.994 -14.991   6.444
    6   HD11  LEU  58          HD11      LEU  58  -6.290 -13.343   3.953
    7   HD13  LEU  58          HD12      LEU  58  -6.278 -12.836   5.642
    8   HD12  LEU  58          HD13      LEU  58  -7.703 -13.624   4.970
    9   HD22  LEU  58          HD21      LEU  58  -6.963 -16.897   5.574
   10   HD21  LEU  58          HD22      LEU  58  -6.623 -16.446   3.903
   11   HD23  LEU  58          HD23      LEU  58  -7.984 -15.716   4.755

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  59           H        ILE  59  -1.525 -15.985   6.030
    2    HA   ILE  59           HA       ILE  59  -0.431 -16.716   3.393
    3    HB   ILE  59           HB       ILE  59   0.311 -14.609   4.754
    4   HG12  ILE  59          HG12      ILE  59   2.511 -16.405   3.723
    5   HG13  ILE  59          HG13      ILE  59   1.377 -15.597   2.652
    6   HG23  ILE  59          HG21      ILE  59   0.895 -15.652   6.867
    7   HG22  ILE  59          HG22      ILE  59   2.347 -15.039   6.122
    8   HG21  ILE  59          HG23      ILE  59   2.001 -16.760   6.076
    9   HD11  ILE  59          HD11      ILE  59   2.926 -14.072   4.740
   10   HD13  ILE  59          HD12      ILE  59   2.098 -13.440   3.317
   11   HD12  ILE  59          HD13      ILE  59   3.584 -14.370   3.131

  No H/Q in entry =          11
  In of MODEL   91
    1    H    GLU  60           H        GLU  60  -0.444 -17.822   6.760
    2    HA   GLU  60           HA       GLU  60   1.581 -19.807   6.495
    3    HB2  GLU  60           HB2      GLU  60   0.790 -19.031   8.691
    4    HB3  GLU  60           HB3      GLU  60  -0.813 -19.683   8.364
    5    HG2  GLU  60           HG2      GLU  60   0.306 -21.970   8.121
    6    HG3  GLU  60           HG3      GLU  60   1.767 -21.221   8.757

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLY  61           H        GLY  61  -1.930 -19.893   6.010
    2    HA3  GLY  61           HA2      GLY  61  -1.692 -22.687   5.051
    3    HA2  GLY  61           HA3      GLY  61  -3.174 -21.946   5.645

  No H/Q in entry =           3
  In of MODEL   91
    1    H    ASP  62           H        ASP  62  -0.946 -20.361   3.443
    2    HA   ASP  62           HA       ASP  62  -2.991 -19.655   1.620
    3    HB2  ASP  62           HB2      ASP  62  -1.103 -18.907   0.178
    4    HB3  ASP  62           HB3      ASP  62  -1.010 -18.293   1.826

  No H/Q in entry =           4
  In of MODEL   91
    1    H    ALA  63           H        ALA  63  -1.502 -22.620   2.063
    2    HA   ALA  63           HA       ALA  63  -1.435 -23.424  -0.725
    3    HB2  ALA  63           HB1      ALA  63   0.034 -24.304   1.245
    4    HB3  ALA  63           HB2      ALA  63  -0.538 -25.442   0.025
    5    HB1  ALA  63           HB3      ALA  63  -1.353 -25.339   1.586

  No H/Q in entry =           5
  In of MODEL   91
    1    H    GLY  64           H        GLY  64  -2.606 -25.575  -1.254
    2    HA3  GLY  64           HA2      GLY  64  -4.656 -26.877  -0.495
    3    HA2  GLY  64           HA3      GLY  64  -5.428 -25.299  -0.398

  No H/Q in entry =           3
  In of MODEL   91
    1    H    GLU  65           H        GLU  65  -4.915 -23.985  -2.605
    2    HA   GLU  65           HA       GLU  65  -6.410 -25.321  -4.611
    3    HB2  GLU  65           HB2      GLU  65  -4.755 -22.794  -4.698
    4    HB3  GLU  65           HB3      GLU  65  -5.754 -23.356  -6.038
    5    HG2  GLU  65           HG2      GLU  65  -7.748 -23.281  -4.620
    6    HG3  GLU  65           HG3      GLU  65  -6.769 -22.794  -3.238

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLY  66           H        GLY  66  -2.945 -24.717  -4.215
    2    HA3  GLY  66           HA2      GLY  66  -2.323 -26.919  -5.984
    3    HA2  GLY  66           HA3      GLY  66  -1.882 -25.342  -6.632

  No H/Q in entry =           3
  In of MODEL   91
    1    H    LYS  67           H        LYS  67   0.140 -27.028  -6.298
    2    HA   LYS  67           HA       LYS  67   1.355 -27.048  -3.732
    3    HB2  LYS  67           HB2      LYS  67   2.678 -27.279  -6.446
    4    HB3  LYS  67           HB3      LYS  67   3.352 -27.803  -4.905
    5    HG2  LYS  67           HG2      LYS  67   0.778 -28.888  -6.084
    6    HG3  LYS  67           HG3      LYS  67   2.348 -29.668  -6.262
    7    HD2  LYS  67           HD2      LYS  67   2.490 -29.625  -3.700
    8    HD3  LYS  67           HD3      LYS  67   0.773 -29.220  -3.722
    9    HE2  LYS  67           HE2      LYS  67   0.249 -31.255  -4.936
   10    HE3  LYS  67           HE3      LYS  67   1.961 -31.642  -5.099
   11    HZ3  LYS  67           HZ1      LYS  67   2.132 -32.248  -2.932
   12    HZ2  LYS  67           HZ2      LYS  67   0.500 -32.651  -3.182
   13    HZ1  LYS  67           HZ3      LYS  67   0.909 -31.195  -2.408

  No H/Q in entry =          13
  In of MODEL   91
    1    H    MET  68           H        MET  68   2.915 -25.554  -6.513
    2    HA   MET  68           HA       MET  68   4.305 -23.648  -4.957
    3    HB2  MET  68           HB2      MET  68   3.884 -24.059  -7.899
    4    HB3  MET  68           HB3      MET  68   4.739 -22.636  -7.304
    5    HG2  MET  68           HG2      MET  68   5.466 -25.476  -6.540
    6    HG3  MET  68           HG3      MET  68   6.246 -24.582  -7.844
    7    HE3  MET  68           HE1      MET  68   6.360 -25.489  -4.185
    8    HE2  MET  68           HE2      MET  68   8.026 -24.933  -4.042
    9    HE1  MET  68           HE3      MET  68   7.558 -25.948  -5.404

  No H/Q in entry =           9
  In of MODEL   91
    1    H    LYS  69           H        LYS  69   1.369 -23.358  -6.940
    2    HA   LYS  69           HA       LYS  69   1.246 -20.516  -6.732
    3    HB2  LYS  69           HB2      LYS  69  -0.808 -22.568  -7.544
    4    HB3  LYS  69           HB3      LYS  69  -1.080 -20.825  -7.621
    5    HG2  LYS  69           HG2      LYS  69   0.895 -20.577  -9.078
    6    HG3  LYS  69           HG3      LYS  69   1.167 -22.317  -9.008
    7    HD2  LYS  69           HD2      LYS  69  -1.072 -22.687 -10.018
    8    HD3  LYS  69           HD3      LYS  69  -1.281 -20.939 -10.147
    9    HE2  LYS  69           HE2      LYS  69   1.005 -22.477 -11.411
   10    HE3  LYS  69           HE3      LYS  69  -0.456 -21.990 -12.269
   11    HZ1  LYS  69           HZ1      LYS  69   0.850 -19.877 -10.791
   12    HZ3  LYS  69           HZ2      LYS  69   0.205 -19.868 -12.362
   13    HZ2  LYS  69           HZ3      LYS  69   1.759 -20.494 -12.082

  No H/Q in entry =          13
  In of MODEL   91
    1    H    VAL  70           H        VAL  70  -0.221 -19.218  -5.649
    2    HA   VAL  70           HA       VAL  70  -1.501 -20.360  -3.242
    3    HB   VAL  70           HB       VAL  70  -0.751 -18.361  -1.987
    4   HG12  VAL  70          HG11      VAL  70   1.645 -19.015  -1.830
    5   HG11  VAL  70          HG12      VAL  70   1.460 -19.967  -3.304
    6   HG13  VAL  70          HG13      VAL  70   0.575 -20.417  -1.846
    7   HG22  VAL  70          HG21      VAL  70   0.985 -16.916  -2.974
    8   HG21  VAL  70          HG22      VAL  70  -0.491 -16.861  -3.939
    9   HG23  VAL  70          HG23      VAL  70   0.885 -17.820  -4.485

  No H/Q in entry =           9
  In of MODEL   91
    1    H    SER  71           H        SER  71  -3.012 -18.620  -2.231
    2    HA   SER  71           HA       SER  71  -4.993 -17.933  -4.111
    3    HB2  SER  71           HB2      SER  71  -5.370 -18.195  -1.649
    4    HB3  SER  71           HB3      SER  71  -4.543 -16.661  -1.398
    5    HG   SER  71           HG       SER  71  -6.156 -15.860  -3.011

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LEU  72           H        LEU  72  -5.203 -16.244  -5.452
    2    HA   LEU  72           HA       LEU  72  -3.091 -14.437  -5.935
    3    HB2  LEU  72           HB2      LEU  72  -5.964 -14.490  -6.857
    4    HB3  LEU  72           HB3      LEU  72  -4.776 -13.328  -7.445
    5    HG   LEU  72           HG       LEU  72  -4.383 -16.331  -7.557
    6   HD12  LEU  72          HD11      LEU  72  -5.184 -14.485  -9.822
    7   HD11  LEU  72          HD12      LEU  72  -6.330 -15.490  -8.934
    8   HD13  LEU  72          HD13      LEU  72  -5.041 -16.243  -9.874
    9   HD22  LEU  72          HD21      LEU  72  -2.251 -15.448  -7.789
   10   HD21  LEU  72          HD22      LEU  72  -2.837 -13.922  -8.449
   11   HD23  LEU  72          HD23      LEU  72  -2.783 -15.360  -9.467

  No H/Q in entry =          11
  In of MODEL   91
    1    H    VAL  73           H        VAL  73  -6.182 -14.074  -4.301
    2    HA   VAL  73           HA       VAL  73  -6.220 -11.303  -3.947
    3    HB   VAL  73           HB       VAL  73  -7.916 -11.667  -2.320
    4   HG11  VAL  73          HG11      VAL  73  -7.928 -13.923  -4.348
    5   HG13  VAL  73          HG12      VAL  73  -8.544 -12.290  -4.605
    6   HG12  VAL  73          HG13      VAL  73  -9.338 -13.360  -3.450
    7   HG22  VAL  73          HG21      VAL  73  -7.040 -13.160  -0.752
    8   HG21  VAL  73          HG22      VAL  73  -6.521 -14.307  -1.986
    9   HG23  VAL  73          HG23      VAL  73  -8.230 -14.169  -1.574

  No H/Q in entry =           9
  In of MODEL   91
    1    H    LEU  74           H        LEU  74  -4.286 -13.676  -2.368
    2    HA   LEU  74           HA       LEU  74  -3.868 -12.539   0.155
    3    HB2  LEU  74           HB2      LEU  74  -3.143 -14.777  -0.421
    4    HB3  LEU  74           HB3      LEU  74  -2.059 -14.149  -1.657
    5    HG   LEU  74           HG       LEU  74  -0.743 -13.007   0.094
    6   HD13  LEU  74          HD11      LEU  74  -2.148 -12.543   1.884
    7   HD12  LEU  74          HD12      LEU  74  -1.332 -13.982   2.492
    8   HD11  LEU  74          HD13      LEU  74  -2.950 -14.111   1.801
    9   HD21  LEU  74          HD21      LEU  74  -1.121 -15.926  -0.149
   10   HD23  LEU  74          HD22      LEU  74  -0.364 -15.442   1.358
   11   HD22  LEU  74          HD23      LEU  74   0.364 -14.978  -0.175

  No H/Q in entry =          11
  In of MODEL   91
    1    H    VAL  75           H        VAL  75  -1.981 -12.146  -2.805
    2    HA   VAL  75           HA       VAL  75  -0.178 -10.227  -1.795
    3    HB   VAL  75           HB       VAL  75  -1.197 -10.642  -4.623
    4   HG11  VAL  75          HG11      VAL  75   1.208  -9.109  -3.591
    5   HG13  VAL  75          HG12      VAL  75  -0.216  -8.411  -4.361
    6   HG12  VAL  75          HG13      VAL  75   0.872  -9.441  -5.289
    7   HG21  VAL  75          HG21      VAL  75   0.886 -11.937  -2.926
    8   HG23  VAL  75          HG22      VAL  75   1.336 -11.605  -4.598
    9   HG22  VAL  75          HG23      VAL  75  -0.069 -12.609  -4.248

  No H/Q in entry =           9
  In of MODEL   91
    1    H    GLU  76           H        GLU  76  -3.330  -9.871  -3.448
    2    HA   GLU  76           HA       GLU  76  -3.376  -7.057  -3.546
    3    HB2  GLU  76           HB2      GLU  76  -5.041  -8.499  -4.704
    4    HB3  GLU  76           HB3      GLU  76  -5.692  -8.989  -3.147
    5    HG2  GLU  76           HG2      GLU  76  -7.182  -7.304  -3.671
    6    HG3  GLU  76           HG3      GLU  76  -5.973  -6.358  -2.816

  No H/Q in entry =           6
  In of MODEL   91
    1    H    ALA  77           H        ALA  77  -4.487  -9.285  -1.007
    2    HA   ALA  77           HA       ALA  77  -5.437  -7.283   0.755
    3    HB1  ALA  77           HB1      ALA  77  -4.679 -10.156   1.002
    4    HB3  ALA  77           HB2      ALA  77  -6.195  -9.351   1.405
    5    HB2  ALA  77           HB3      ALA  77  -4.811  -9.215   2.489

  No H/Q in entry =           5
  In of MODEL   91
    1    H    GLN  78           H        GLN  78  -2.294  -8.839   0.384
    2    HA   GLN  78           HA       GLN  78  -1.030  -7.684   2.633
    3    HB2  GLN  78           HB2      GLN  78  -0.182  -9.625   1.256
    4    HB3  GLN  78           HB3      GLN  78   0.288  -8.458   0.021
    5    HG2  GLN  78           HG2      GLN  78   1.744  -7.317   1.620
    6    HG3  GLN  78           HG3      GLN  78   1.243  -8.422   2.897
    7   HE21  GLN  78          HE21      GLN  78   3.987  -8.263   2.195
    8   HE22  GLN  78          HE22      GLN  78   4.442  -9.706   1.426

  No H/Q in entry =           8
  In of MODEL   91
    1    H    LEU  79           H        LEU  79  -1.399  -6.618  -0.712
    2    HA   LEU  79           HA       LEU  79   0.294  -4.396  -0.699
    3    HB2  LEU  79           HB2      LEU  79  -0.738  -5.198  -2.752
    4    HB3  LEU  79           HB3      LEU  79  -2.340  -4.802  -2.141
    5    HG   LEU  79           HG       LEU  79  -1.789  -2.417  -2.113
    6   HD13  LEU  79          HD11      LEU  79   0.453  -2.180  -1.604
    7   HD12  LEU  79          HD12      LEU  79   0.500  -1.892  -3.343
    8   HD11  LEU  79          HD13      LEU  79   0.951  -3.471  -2.699
    9   HD23  LEU  79          HD21      LEU  79  -1.158  -2.217  -4.666
   10   HD22  LEU  79          HD22      LEU  79  -2.686  -2.961  -4.206
   11   HD21  LEU  79          HD23      LEU  79  -1.317  -3.974  -4.653

  No H/Q in entry =          11
  In of MODEL   91
    1    H    HIS  80           H        HIS  80  -3.172  -4.549   0.133
    2    HA   HIS  80           HA       HIS  80  -3.353  -1.792   0.799
    3    HB2  HIS  80           HB2      HIS  80  -5.061  -4.195   1.118
    4    HB3  HIS  80           HB3      HIS  80  -5.376  -2.855   2.224
    5    HD1  HIS  80           HD1      HIS  80  -6.989  -1.212   1.321
    6    HD2  HIS  80           HD2      HIS  80  -4.807  -3.029  -1.732
    7    HE1  HIS  80           HE1      HIS  80  -7.829  -0.210  -0.856
    8    HE2  HIS  80           HE2      HIS  80  -6.505  -1.312  -2.726

  No H/Q in entry =           8
  In of MODEL   91
    1    H    LEU  81           H        LEU  81  -2.871  -4.691   2.789
    2    HA   LEU  81           HA       LEU  81  -2.850  -3.346   5.274
    3    HB2  LEU  81           HB2      LEU  81  -1.642  -5.966   4.390
    4    HB3  LEU  81           HB3      LEU  81  -1.612  -5.409   6.064
    5    HG   LEU  81           HG       LEU  81  -4.161  -5.650   4.440
    6   HD12  LEU  81          HD11      LEU  81  -4.469  -7.716   5.986
    7   HD11  LEU  81          HD12      LEU  81  -2.716  -7.652   6.169
    8   HD13  LEU  81          HD13      LEU  81  -3.428  -7.878   4.571
    9   HD23  LEU  81          HD21      LEU  81  -5.001  -5.853   6.942
   10   HD22  LEU  81          HD22      LEU  81  -4.671  -4.264   6.253
   11   HD21  LEU  81          HD23      LEU  81  -3.486  -5.030   7.311

  No H/Q in entry =          11
  In of MODEL   91
    1    H    MET  82           H        MET  82  -0.176  -4.258   3.098
    2    HA   MET  82           HA       MET  82   1.913  -3.373   4.779
    3    HB2  MET  82           HB2      MET  82   1.692  -3.711   1.787
    4    HB3  MET  82           HB3      MET  82   3.178  -3.147   2.549
    5    HG2  MET  82           HG2      MET  82   1.761  -5.731   3.273
    6    HG3  MET  82           HG3      MET  82   3.132  -5.626   2.171
    7    HE3  MET  82           HE1      MET  82   6.153  -4.904   4.150
    8    HE2  MET  82           HE2      MET  82   5.235  -3.533   3.535
    9    HE1  MET  82           HE3      MET  82   5.316  -5.022   2.598

  No H/Q in entry =           9
  In of MODEL   91
    1    H    THR  83           H        THR  83   0.094  -1.721   2.227
    2    HA   THR  83           HA       THR  83   1.516   0.721   2.313
    3    HB   THR  83           HB       THR  83  -0.658   1.656   1.332
    4    HG1  THR  83           HG1      THR  83  -2.314   0.366   1.226
    5   HG22  THR  83          HG21      THR  83  -0.398  -0.161  -0.671
    6   HG21  THR  83          HG22      THR  83   1.102  -0.461   0.203
    7   HG23  THR  83          HG23      THR  83   0.747   1.154  -0.410

  No H/Q in entry =           7
  In of MODEL   91
    1    H    SER  84           H        SER  84  -1.492  -0.300   3.919
    2    HA   SER  84           HA       SER  84  -1.975   2.131   5.266
    3    HB2  SER  84           HB2      SER  84  -2.819  -0.703   5.830
    4    HB3  SER  84           HB3      SER  84  -3.305   0.639   6.865
    5    HG   SER  84           HG       SER  84  -3.770   0.329   4.073

  No H/Q in entry =           5
  In of MODEL   91
    1    H    MET  85           H        MET  85  -0.276  -0.809   6.390
    2    HA   MET  85           HA       MET  85   0.252   0.113   8.994
    3    HB2  MET  85           HB2      MET  85   0.536  -2.241   8.212
    4    HB3  MET  85           HB3      MET  85   1.997  -1.734   7.365
    5    HG2  MET  85           HG2      MET  85   3.081  -1.119   9.413
    6    HG3  MET  85           HG3      MET  85   1.580  -1.261  10.325
    7    HE2  MET  85           HE1      MET  85   4.664  -2.945   8.874
    8    HE1  MET  85           HE2      MET  85   3.495  -3.404   7.639
    9    HE3  MET  85           HE3      MET  85   4.211  -4.642   8.664

  No H/Q in entry =           9
  In of MODEL   91
    1    H    LEU  86           H        LEU  86   2.183   0.362   6.040
    2    HA   LEU  86           HA       LEU  86   4.406   1.661   7.193
    3    HB2  LEU  86           HB2      LEU  86   4.205   0.581   4.884
    4    HB3  LEU  86           HB3      LEU  86   3.403   2.067   4.374
    5    HG   LEU  86           HG       LEU  86   5.439   3.302   5.351
    6   HD11  LEU  86          HD11      LEU  86   6.133   0.687   6.148
    7   HD13  LEU  86          HD12      LEU  86   7.144   2.127   6.244
    8   HD12  LEU  86          HD13      LEU  86   7.245   1.079   4.832
    9   HD23  LEU  86          HD21      LEU  86   6.143   1.537   2.998
   10   HD22  LEU  86          HD22      LEU  86   6.545   3.233   3.261
   11   HD21  LEU  86          HD23      LEU  86   4.889   2.773   2.865

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ALA  87           H        ALA  87   1.496   2.920   5.614
    2    HA   ALA  87           HA       ALA  87   2.104   5.646   5.699
    3    HB1  ALA  87           HB1      ALA  87  -0.214   4.030   5.161
    4    HB3  ALA  87           HB2      ALA  87   0.104   5.690   4.661
    5    HB2  ALA  87           HB3      ALA  87  -0.688   5.371   6.206

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ARG  88           H        ARG  88   0.409   3.652   8.091
    2    HA   ARG  88           HA       ARG  88  -0.089   5.702   9.940
    3    HB2  ARG  88           HB2      ARG  88  -1.039   3.355  10.006
    4    HB3  ARG  88           HB3      ARG  88   0.501   2.847  10.709
    5    HG2  ARG  88           HG2      ARG  88   0.037   4.922  12.331
    6    HG3  ARG  88           HG3      ARG  88  -1.632   4.606  11.878
    7    HD2  ARG  88           HD2      ARG  88  -1.746   2.756  13.123
    8    HD3  ARG  88           HD3      ARG  88  -0.160   2.167  12.589
    9    HE   ARG  88           HE       ARG  88  -0.683   3.432  15.045
   10   HH21  ARG  88          HH11      ARG  88   0.882   4.435  16.281
   11   HH22  ARG  88          HH12      ARG  88   2.402   4.855  15.574
   12   HH11  ARG  88          HH21      ARG  88   1.593   3.603  12.464
   13   HH12  ARG  88          HH22      ARG  88   2.813   4.368  13.424

  No H/Q in entry =          13
  In of MODEL   91
    1    H    GLU  89           H        GLU  89   2.696   3.470   9.710
    2    HA   GLU  89           HA       GLU  89   3.966   4.352  12.052
    3    HB2  GLU  89           HB2      GLU  89   4.613   2.331  10.706
    4    HB3  GLU  89           HB3      GLU  89   5.392   3.422   9.559
    5    HG2  GLU  89           HG2      GLU  89   6.884   4.261  11.300
    6    HG3  GLU  89           HG3      GLU  89   6.047   3.308  12.522

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LEU  90           H        LEU  90   4.282   5.510   8.725
    2    HA   LEU  90           HA       LEU  90   6.222   7.502   9.307
    3    HB2  LEU  90           HB2      LEU  90   4.211   7.180   7.083
    4    HB3  LEU  90           HB3      LEU  90   5.447   8.445   7.103
    5    HG   LEU  90           HG       LEU  90   6.109   5.506   7.434
    6   HD12  LEU  90          HD11      LEU  90   6.854   5.737   4.993
    7   HD11  LEU  90          HD12      LEU  90   5.845   7.182   4.947
    8   HD13  LEU  90          HD13      LEU  90   5.119   5.612   5.291
    9   HD22  LEU  90          HD21      LEU  90   8.012   6.647   8.114
   10   HD21  LEU  90          HD22      LEU  90   7.666   8.054   7.108
   11   HD23  LEU  90          HD23      LEU  90   8.319   6.587   6.379

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  91           H        ILE  91   2.683   7.532   9.165
    2    HA   ILE  91           HA       ILE  91   2.353  10.305   9.617
    3    HB   ILE  91           HB       ILE  91   0.553   7.937  10.162
    4   HG12  ILE  91          HG12      ILE  91   0.311  10.220   8.178
    5   HG13  ILE  91          HG13      ILE  91   1.164   8.722   7.804
    6   HG22  ILE  91          HG21      ILE  91  -1.171  10.001  10.229
    7   HG21  ILE  91          HG22      ILE  91   0.235  10.826  10.900
    8   HG23  ILE  91          HG23      ILE  91  -0.406   9.391  11.697
    9   HD13  ILE  91          HD11      ILE  91  -0.785   7.442   7.851
   10   HD12  ILE  91          HD12      ILE  91  -1.370   8.960   7.171
   11   HD11  ILE  91          HD13      ILE  91  -1.639   8.596   8.876

  No H/Q in entry =          11
  In of MODEL   91
    1    H    THR  92           H        THR  92   2.750   7.562  11.817
    2    HA   THR  92           HA       THR  92   2.315   8.936  14.242
    3    HB   THR  92           HB       THR  92   4.114   6.595  13.573
    4    HG1  THR  92           HG1      THR  92   2.143   5.845  13.476
    5   HG22  THR  92          HG21      THR  92   3.734   6.311  16.208
    6   HG21  THR  92          HG22      THR  92   3.675   8.071  16.135
    7   HG23  THR  92          HG23      THR  92   5.104   7.211  15.560

  No H/Q in entry =           7
  In of MODEL   91
    1    H    GLU  93           H        GLU  93   5.261   8.478  12.303
    2    HA   GLU  93           HA       GLU  93   7.022   9.899  13.998
    3    HB2  GLU  93           HB2      GLU  93   7.105   9.585  10.983
    4    HB3  GLU  93           HB3      GLU  93   8.449  10.110  11.995
    5    HG2  GLU  93           HG2      GLU  93   7.032   7.478  12.444
    6    HG3  GLU  93           HG3      GLU  93   8.414   7.626  11.366

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LEU  94           H        LEU  94   4.973  10.921  11.289
    2    HA   LEU  94           HA       LEU  94   5.785  13.622  11.188
    3    HB2  LEU  94           HB2      LEU  94   3.190  12.264  10.437
    4    HB3  LEU  94           HB3      LEU  94   3.453  13.991  10.196
    5    HG   LEU  94           HG       LEU  94   5.463  11.998   9.142
    6   HD11  LEU  94          HD11      LEU  94   2.721  12.556   8.084
    7   HD13  LEU  94          HD12      LEU  94   3.700  11.097   7.957
    8   HD12  LEU  94          HD13      LEU  94   4.038  12.477   6.912
    9   HD23  LEU  94          HD21      LEU  94   5.716  13.834   7.420
   10   HD22  LEU  94          HD22      LEU  94   6.134  14.325   9.061
   11   HD21  LEU  94          HD23      LEU  94   4.583  14.797   8.365

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  95           H        ILE  95   3.246  12.011  13.082
    2    HA   ILE  95           HA       ILE  95   2.210  14.363  14.279
    3    HB   ILE  95           HB       ILE  95   2.222  11.481  15.203
    4   HG12  ILE  95          HG12      ILE  95   0.004  13.260  14.157
    5   HG13  ILE  95          HG13      ILE  95   0.957  12.199  13.124
    6   HG21  ILE  95          HG21      ILE  95   0.947  13.957  16.407
    7   HG23  ILE  95          HG22      ILE  95   1.993  12.785  17.210
    8   HG22  ILE  95          HG23      ILE  95   0.357  12.328  16.737
    9   HD13  ILE  95          HD11      ILE  95   0.051  10.262  14.044
   10   HD12  ILE  95          HD12      ILE  95  -1.329  11.354  14.122
   11   HD11  ILE  95          HD13      ILE  95  -0.363  11.054  15.566

  No H/Q in entry =          11
  In of MODEL   91
    1    H    GLU  96           H        GLU  96   4.802  12.139  15.271
    2    HA   GLU  96           HA       GLU  96   5.363  13.337  17.762
    3    HB2  GLU  96           HB2      GLU  96   6.306  11.176  17.113
    4    HB3  GLU  96           HB3      GLU  96   7.239  11.948  15.832
    5    HG2  GLU  96           HG2      GLU  96   8.890  12.493  17.293
    6    HG3  GLU  96           HG3      GLU  96   7.746  13.308  18.349

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LEU  97           H        LEU  97   6.434  14.107  14.475
    2    HA   LEU  97           HA       LEU  97   8.324  16.100  15.185
    3    HB2  LEU  97           HB2      LEU  97   6.729  15.554  12.691
    4    HB3  LEU  97           HB3      LEU  97   7.751  16.984  12.812
    5    HG   LEU  97           HG       LEU  97   8.776  14.184  13.370
    6   HD12  LEU  97          HD11      LEU  97   9.770  14.377  11.052
    7   HD11  LEU  97          HD12      LEU  97   8.721  15.769  10.790
    8   HD13  LEU  97          HD13      LEU  97   8.020  14.178  11.085
    9   HD23  LEU  97          HD21      LEU  97  10.946  15.460  12.625
   10   HD22  LEU  97          HD22      LEU  97  10.330  15.731  14.255
   11   HD21  LEU  97          HD23      LEU  97  10.016  16.914  12.987

  No H/Q in entry =          11
  In of MODEL   91
    1    H    HIS  98           H        HIS  98   4.832  16.240  14.535
    2    HA   HIS  98           HA       HIS  98   4.536  19.040  14.670
    3    HB2  HIS  98           HB2      HIS  98   2.645  16.792  15.398
    4    HB3  HIS  98           HB3      HIS  98   2.180  18.493  15.455
    5    HD1  HIS  98           HD1      HIS  98   3.195  15.777  13.049
    6    HD2  HIS  98           HD2      HIS  98   1.823  19.712  12.928
    7    HE1  HIS  98           HE1      HIS  98   2.634  16.266  10.625
    8    HE2  HIS  98           HE2      HIS  98   1.802  18.657  10.531

  No H/Q in entry =           8
  In of MODEL   91
    1    H    GLU  99           H        GLU  99   4.670  16.551  17.169
    2    HA   GLU  99           HA       GLU  99   4.066  18.246  19.368
    3    HB2  GLU  99           HB2      GLU  99   3.975  15.764  19.465
    4    HB3  GLU  99           HB3      GLU  99   5.735  15.717  19.354
    5    HG2  GLU  99           HG2      GLU  99   5.927  17.009  21.428
    6    HG3  GLU  99           HG3      GLU  99   4.175  17.152  21.526

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LYS 100           H        LYS 100   7.117  17.312  17.799
    2    HA   LYS 100           HA       LYS 100   8.776  18.711  19.654
    3    HB2  LYS 100           HB2      LYS 100   9.270  17.786  16.815
    4    HB3  LYS 100           HB3      LYS 100  10.502  18.554  17.821
    5    HG2  LYS 100           HG2      LYS 100  10.126  16.804  19.563
    6    HG3  LYS 100           HG3      LYS 100   8.992  16.002  18.473
    7    HD2  LYS 100           HD2      LYS 100  10.784  15.717  16.803
    8    HD3  LYS 100           HD3      LYS 100  11.923  16.532  17.878
    9    HE2  LYS 100           HE2      LYS 100  11.527  14.776  19.597
   10    HE3  LYS 100           HE3      LYS 100  10.449  13.942  18.473
   11    HZ1  LYS 100           HZ1      LYS 100  13.270  14.608  17.814
   12    HZ3  LYS 100           HZ2      LYS 100  12.224  13.555  16.987
   13    HZ2  LYS 100           HZ3      LYS 100  12.814  13.135  18.524

  No H/Q in entry =          13
  In of MODEL   91
    1    H    LEU 101           H        LEU 101   7.080  19.640  16.701
    2    HA   LEU 101           HA       LEU 101   8.296  22.196  16.365
    3    HB2  LEU 101           HB2      LEU 101   5.698  20.965  15.481
    4    HB3  LEU 101           HB3      LEU 101   5.951  22.696  15.273
    5    HG   LEU 101           HG       LEU 101   7.984  20.677  14.305
    6   HD12  LEU 101          HD11      LEU 101   6.828  21.185  12.021
    7   HD11  LEU 101          HD12      LEU 101   5.430  21.617  13.004
    8   HD13  LEU 101          HD13      LEU 101   6.093  19.985  13.084
    9   HD21  LEU 101          HD21      LEU 101   7.359  23.591  13.750
   10   HD23  LEU 101          HD22      LEU 101   8.337  22.630  12.642
   11   HD22  LEU 101          HD23      LEU 101   8.881  22.886  14.300

  No H/Q in entry =          11
  In of MODEL   91
    1    H    LYS 102           H        LYS 102   6.761  21.059  18.982
    2    HA   LYS 102           HA       LYS 102   6.133  22.151  20.915
    3    HB2  LYS 102           HB2      LYS 102   7.416  24.140  19.790
    4    HB3  LYS 102           HB3      LYS 102   5.818  24.747  19.416
    5    HG2  LYS 102           HG2      LYS 102   7.198  24.489  22.066
    6    HG3  LYS 102           HG3      LYS 102   6.246  25.819  21.439
    7    HD2  LYS 102           HD2      LYS 102   5.000  23.184  22.319
    8    HD3  LYS 102           HD3      LYS 102   5.252  24.544  23.402
    9    HE2  LYS 102           HE2      LYS 102   2.970  24.145  21.916
   10    HE3  LYS 102           HE3      LYS 102   3.476  25.690  22.598
   11    HZ2  LYS 102           HZ1      LYS 102   2.943  25.799  20.219
   12    HZ1  LYS 102           HZ2      LYS 102   4.202  24.716  19.894
   13    HZ3  LYS 102           HZ3      LYS 102   4.548  26.245  20.536

  No H/Q in entry =          13
  In of MODEL   91
    1    H    ALA 103           H        ALA 103   4.493  23.697  18.150
    2    HA   ALA 103           HA       ALA 103   2.041  24.277  19.038
    3    HB1  ALA 103           HB1      ALA 103   1.138  23.437  16.797
    4    HB2  ALA 103           HB2      ALA 103   2.785  22.898  16.465
    5    HB3  ALA 103           HB3      ALA 103   2.453  24.610  16.732

  No H/Q in entry =           5
  In of MODEL   91
    1    H1   ALA   1           H3       ALA   1  10.538 -20.229  -6.259
    2    H2   ALA   1           H2       ALA   1   9.572 -20.433  -7.644
    3    H3   ALA   1           H1       ALA   1   9.135 -21.179  -6.181
    4    HA   ALA   1           HA       ALA   1  10.170 -22.990  -6.922
    5    HB1  ALA   1           HB1      ALA   1  10.263 -22.630  -9.198
    6    HB2  ALA   1           HB2      ALA   1  11.991 -22.483  -8.871
    7    HB3  ALA   1           HB3      ALA   1  10.995 -21.034  -9.020

  No H/Q in entry =           7
  In of MODEL   91
    1    H    GLU   2           H        GLU   2  12.451 -23.945  -6.984
    2    HA   GLU   2           HA       GLU   2  13.836 -23.867  -4.774
    3    HB2  GLU   2           HB2      GLU   2  15.189 -23.738  -7.475
    4    HB3  GLU   2           HB3      GLU   2  15.918 -24.351  -5.992
    5    HG2  GLU   2           HG2      GLU   2  14.896 -26.365  -6.231
    6    HG3  GLU   2           HG3      GLU   2  13.326 -25.616  -6.488

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLU   3           H        GLU   3  15.608 -22.006  -7.178
    2    HA   GLU   3           HA       GLU   3  16.768 -20.322  -5.219
    3    HB2  GLU   3           HB2      GLU   3  16.708 -20.319  -8.229
    4    HB3  GLU   3           HB3      GLU   3  17.458 -18.992  -7.343
    5    HG2  GLU   3           HG2      GLU   3  19.119 -20.370  -6.423
    6    HG3  GLU   3           HG3      GLU   3  18.169 -21.835  -6.643

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LEU   4           H        LEU   4  14.484 -19.468  -7.846
    2    HA   LEU   4           HA       LEU   4  14.025 -16.858  -7.233
    3    HB2  LEU   4           HB2      LEU   4  11.844 -18.827  -7.960
    4    HB3  LEU   4           HB3      LEU   4  11.773 -17.078  -8.158
    5    HG   LEU   4           HG       LEU   4  13.730 -18.946  -9.535
    6   HD13  LEU   4          HD11      LEU   4  12.426 -18.793 -11.443
    7   HD12  LEU   4          HD12      LEU   4  11.723 -17.246 -10.974
    8   HD11  LEU   4          HD13      LEU   4  11.167 -18.736 -10.212
    9   HD23  LEU   4          HD21      LEU   4  14.070 -16.701 -10.886
   10   HD22  LEU   4          HD22      LEU   4  14.932 -16.946  -9.368
   11   HD21  LEU   4          HD23      LEU   4  13.482 -15.946  -9.405

  No H/Q in entry =          11
  In of MODEL   91
    1    H    GLU   5           H        GLU   5  12.536 -19.639  -5.589
    2    HA   GLU   5           HA       GLU   5  10.865 -18.064  -3.883
    3    HB2  GLU   5           HB2      GLU   5  10.434 -20.438  -4.415
    4    HB3  GLU   5           HB3      GLU   5  11.853 -20.881  -3.461
    5    HG2  GLU   5           HG2      GLU   5  10.889 -20.073  -1.450
    6    HG3  GLU   5           HG3      GLU   5   9.634 -19.186  -2.314

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLU   6           H        GLU   6  14.009 -19.651  -3.446
    2    HA   GLU   6           HA       GLU   6  14.368 -18.797  -0.748
    3    HB2  GLU   6           HB2      GLU   6  15.556 -20.686  -2.137
    4    HB3  GLU   6           HB3      GLU   6  16.664 -19.390  -2.585
    5    HG2  GLU   6           HG2      GLU   6  17.294 -19.005  -0.321
    6    HG3  GLU   6           HG3      GLU   6  15.946 -19.955   0.302

  No H/Q in entry =           6
  In of MODEL   91
    1    H    VAL   7           H        VAL   7  15.131 -17.471  -3.899
    2    HA   VAL   7           HA       VAL   7  16.823 -15.348  -3.036
    3    HB   VAL   7           HB       VAL   7  15.112 -15.707  -5.510
    4   HG11  VAL   7          HG11      VAL   7  17.012 -13.498  -4.701
    5   HG13  VAL   7          HG12      VAL   7  15.369 -13.352  -5.321
    6   HG12  VAL   7          HG13      VAL   7  16.675 -13.857  -6.394
    7   HG21  VAL   7          HG21      VAL   7  17.217 -17.168  -4.946
    8   HG23  VAL   7          HG22      VAL   7  18.125 -15.709  -5.345
    9   HG22  VAL   7          HG23      VAL   7  17.085 -16.456  -6.555

  No H/Q in entry =           9
  In of MODEL   91
    1    H    VAL   8           H        VAL   8  13.329 -15.611  -3.587
    2    HA   VAL   8           HA       VAL   8  12.669 -12.901  -3.113
    3    HB   VAL   8           HB       VAL   8  11.094 -15.461  -2.740
    4   HG12  VAL   8          HG11      VAL   8   9.228 -13.435  -2.979
    5   HG11  VAL   8          HG12      VAL   8  10.449 -12.690  -1.950
    6   HG13  VAL   8          HG13      VAL   8   9.692 -14.206  -1.463
    7   HG23  VAL   8          HG21      VAL   8  10.220 -13.560  -4.795
    8   HG22  VAL   8          HG22      VAL   8  10.604 -15.273  -4.949
    9   HG21  VAL   8          HG23      VAL   8  11.889 -14.072  -5.048

  No H/Q in entry =           9
  In of MODEL   91
    1    H    MET   9           H        MET   9  12.935 -15.709  -0.935
    2    HA   MET   9           HA       MET   9  12.126 -14.436   1.437
    3    HB2  MET   9           HB2      MET   9  14.042 -16.704   0.861
    4    HB3  MET   9           HB3      MET   9  13.723 -16.163   2.509
    5    HG2  MET   9           HG2      MET   9  11.383 -16.669   2.312
    6    HG3  MET   9           HG3      MET   9  11.530 -16.946   0.576
    7    HE1  MET   9           HE1      MET   9  12.576 -17.804   4.021
    8    HE3  MET   9           HE2      MET   9  14.157 -18.285   3.410
    9    HE2  MET   9           HE3      MET   9  13.050 -19.507   4.031

  No H/Q in entry =           9
  In of MODEL   91
    1    H    GLY  10           H        GLY  10  15.304 -14.665  -0.124
    2    HA3  GLY  10           HA2      GLY  10  16.768 -13.247   1.844
    3    HA2  GLY  10           HA3      GLY  10  17.228 -13.412   0.149

  No H/Q in entry =           3
  In of MODEL   91
    1    H    LEU  11           H        LEU  11  15.059 -12.188  -1.086
    2    HA   LEU  11           HA       LEU  11  15.747  -9.444  -0.923
    3    HB2  LEU  11           HB2      LEU  11  13.376 -10.851  -2.155
    4    HB3  LEU  11           HB3      LEU  11  13.658  -9.116  -2.314
    5    HG   LEU  11           HG       LEU  11  15.682 -11.227  -3.106
    6   HD13  LEU  11          HD11      LEU  11  13.934 -11.591  -4.623
    7   HD12  LEU  11          HD12      LEU  11  14.936 -10.410  -5.465
    8   HD11  LEU  11          HD13      LEU  11  13.465  -9.891  -4.644
    9   HD22  LEU  11          HD21      LEU  11  16.916  -9.264  -2.881
   10   HD21  LEU  11          HD22      LEU  11  15.541  -8.226  -3.258
   11   HD23  LEU  11          HD23      LEU  11  16.369  -9.095  -4.548

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  12           H        ILE  12  12.979 -11.268   0.348
    2    HA   ILE  12           HA       ILE  12  11.589  -9.044   1.411
    3    HB   ILE  12           HB       ILE  12  11.685 -11.951   2.314
    4   HG12  ILE  12          HG12      ILE  12  10.854 -11.527  -0.022
    5   HG13  ILE  12          HG13      ILE  12   9.670 -12.282   1.026
    6   HG21  ILE  12          HG21      ILE  12   9.725  -9.767   3.050
    7   HG23  ILE  12          HG22      ILE  12  10.849 -10.581   4.138
    8   HG22  ILE  12          HG23      ILE  12   9.511 -11.476   3.420
    9   HD11  ILE  12          HD11      ILE  12   8.929  -9.779   1.431
   10   HD13  ILE  12          HD12      ILE  12   8.403 -10.644  -0.002
   11   HD12  ILE  12          HD13      ILE  12   9.754  -9.523  -0.099

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  13           H        ILE  13  13.983 -11.250   2.812
    2    HA   ILE  13           HA       ILE  13  14.023 -10.071   5.393
    3    HB   ILE  13           HB       ILE  13  16.111 -11.628   3.848
    4   HG12  ILE  13          HG12      ILE  13  13.801 -12.605   4.662
    5   HG13  ILE  13          HG13      ILE  13  15.277 -13.530   4.913
    6   HG22  ILE  13          HG21      ILE  13  17.118 -11.961   6.162
    7   HG21  ILE  13          HG22      ILE  13  16.089 -10.637   6.707
    8   HG23  ILE  13          HG23      ILE  13  17.316 -10.350   5.473
    9   HD11  ILE  13          HD11      ILE  13  14.170 -11.642   7.006
   10   HD13  ILE  13          HD12      ILE  13  15.402 -12.885   7.213
   11   HD12  ILE  13          HD13      ILE  13  13.724 -13.346   6.931

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ASN  14           H        ASN  14  15.972  -9.538   2.472
    2    HA   ASN  14           HA       ASN  14  17.716  -7.596   3.531
    3    HB2  ASN  14           HB2      ASN  14  17.691  -8.861   1.215
    4    HB3  ASN  14           HB3      ASN  14  16.796  -7.445   0.680
    5   HD21  ASN  14          HD21      ASN  14  19.235  -7.782  -0.509
    6   HD22  ASN  14          HD22      ASN  14  20.378  -6.697   0.117

  No H/Q in entry =           6
  In of MODEL   91
    1    H    SER  15           H        SER  15  14.603  -7.251   1.843
    2    HA   SER  15           HA       SER  15  14.487  -4.431   1.901
    3    HB2  SER  15           HB2      SER  15  12.179  -4.667   1.369
    4    HB3  SER  15           HB3      SER  15  12.960  -6.065   0.637
    5    HG   SER  15           HG       SER  15  11.408  -7.020   1.748

  No H/Q in entry =           5
  In of MODEL   91
    1    H    GLY  16           H        GLY  16  13.400  -6.893   4.205
    2    HA3  GLY  16           HA2      GLY  16  12.179  -5.147   6.065
    3    HA2  GLY  16           HA3      GLY  16  12.796  -6.755   6.426

  No H/Q in entry =           3
  In of MODEL   91
    1    H    GLN  17           H        GLN  17  15.506  -6.417   5.830
    2    HA   GLN  17           HA       GLN  17  16.464  -5.195   8.210
    3    HB2  GLN  17           HB2      GLN  17  17.574  -7.012   6.728
    4    HB3  GLN  17           HB3      GLN  17  18.169  -5.662   5.765
    5    HG2  GLN  17           HG2      GLN  17  19.608  -4.934   7.410
    6    HG3  GLN  17           HG3      GLN  17  18.574  -5.488   8.722
    7   HE21  GLN  17          HE21      GLN  17  20.619  -6.479   9.621
    8   HE22  GLN  17          HE22      GLN  17  21.126  -7.983   9.019

  No H/Q in entry =           8
  In of MODEL   91
    1    H    ALA  18           H        ALA  18  16.269  -4.116   4.850
    2    HA   ALA  18           HA       ALA  18  17.700  -1.721   5.076
    3    HB2  ALA  18           HB1      ALA  18  16.582  -2.937   3.010
    4    HB3  ALA  18           HB2      ALA  18  16.843  -1.193   2.994
    5    HB1  ALA  18           HB3      ALA  18  15.246  -1.843   3.366

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ARG  19           H        ARG  19  14.202  -2.316   5.477
    2    HA   ARG  19           HA       ARG  19  13.529   0.332   6.194
    3    HB2  ARG  19           HB2      ARG  19  11.851  -1.422   5.608
    4    HB3  ARG  19           HB3      ARG  19  12.196  -2.220   7.145
    5    HG2  ARG  19           HG2      ARG  19  11.482  -0.231   8.385
    6    HG3  ARG  19           HG3      ARG  19  11.229   0.645   6.877
    7    HD2  ARG  19           HD2      ARG  19   9.090  -0.156   7.700
    8    HD3  ARG  19           HD3      ARG  19   9.509  -1.034   6.223
    9    HE   ARG  19           HE       ARG  19  10.473  -2.575   8.326
   10   HH21  ARG  19          HH11      ARG  19   9.229  -4.218   9.266
   11   HH22  ARG  19          HH12      ARG  19   7.509  -4.194   9.097
   12   HH11  ARG  19          HH21      ARG  19   7.475  -1.288   7.235
   13   HH12  ARG  19          HH22      ARG  19   6.517  -2.536   7.943

  No H/Q in entry =          13
  In of MODEL   91
    1    H    SER  20           H        SER  20  14.395  -2.497   8.151
    2    HA   SER  20           HA       SER  20  14.113  -1.399  10.689
    3    HB2  SER  20           HB2      SER  20  14.585  -3.721  10.570
    4    HB3  SER  20           HB3      SER  20  16.031  -3.457   9.601
    5    HG   SER  20           HG       SER  20  15.682  -2.508  12.254

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LEU  21           H        LEU  21  16.953  -1.330   8.550
    2    HA   LEU  21           HA       LEU  21  18.626   0.159  10.287
    3    HB2  LEU  21           HB2      LEU  21  18.572  -0.113   7.273
    4    HB3  LEU  21           HB3      LEU  21  19.839   0.753   8.141
    5    HG   LEU  21           HG       LEU  21  19.106  -2.124   8.738
    6   HD12  LEU  21          HD11      LEU  21  21.604  -1.432   7.247
    7   HD11  LEU  21          HD12      LEU  21  20.095  -1.458   6.337
    8   HD13  LEU  21          HD13      LEU  21  20.633  -2.902   7.190
    9   HD21  LEU  21          HD21      LEU  21  20.860  -0.165   9.965
   10   HD23  LEU  21          HD22      LEU  21  21.818  -1.510   9.353
   11   HD22  LEU  21          HD23      LEU  21  20.502  -1.810  10.485

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ALA  22           H        ALA  22  16.358   1.124   7.733
    2    HA   ALA  22           HA       ALA  22  16.891   3.883   7.748
    3    HB3  ALA  22           HB1      ALA  22  15.489   2.638   6.071
    4    HB2  ALA  22           HB2      ALA  22  14.780   4.150   6.639
    5    HB1  ALA  22           HB3      ALA  22  14.193   2.609   7.266

  No H/Q in entry =           5
  In of MODEL   91
    1    H    TYR  23           H        TYR  23  14.399   2.061   9.585
    2    HA   TYR  23           HA       TYR  23  13.434   4.296  11.036
    3    HB2  TYR  23           HB2      TYR  23  12.198   2.184  11.018
    4    HB3  TYR  23           HB3      TYR  23  13.535   1.370  11.831
    5    HD1  TYR  23           HD1      TYR  23  11.034   4.114  12.224
    6    HD2  TYR  23           HD2      TYR  23  13.745   1.421  14.188
    7    HE1  TYR  23           HE1      TYR  23  10.121   4.799  14.426
    8    HE2  TYR  23           HE2      TYR  23  12.831   2.106  16.389
    9    HH   TYR  23           HH       TYR  23  10.143   4.435  16.618

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ALA  24           H        ALA  24  16.084   2.025  11.669
    2    HA   ALA  24           HA       ALA  24  16.754   3.020  14.233
    3    HB1  ALA  24           HB1      ALA  24  18.114   1.230  14.066
    4    HB3  ALA  24           HB2      ALA  24  19.139   2.153  12.966
    5    HB2  ALA  24           HB3      ALA  24  17.845   1.143  12.326

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ALA  25           H        ALA  25  17.707   3.952  10.953
    2    HA   ALA  25           HA       ALA  25  19.650   5.890  11.598
    3    HB1  ALA  25           HB1      ALA  25  18.932   4.941   9.283
    4    HB3  ALA  25           HB2      ALA  25  19.431   6.630   9.376
    5    HB2  ALA  25           HB3      ALA  25  17.717   6.220   9.309

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LEU  26           H        LEU  26  16.134   6.114  11.240
    2    HA   LEU  26           HA       LEU  26  15.907   8.895  11.693
    3    HB2  LEU  26           HB2      LEU  26  14.046   7.657  10.766
    4    HB3  LEU  26           HB3      LEU  26  13.958   6.629  12.191
    5    HG   LEU  26           HG       LEU  26  13.351   8.585  13.572
    6   HD12  LEU  26          HD11      LEU  26  12.686  10.686  12.249
    7   HD11  LEU  26          HD12      LEU  26  13.666  10.034  10.938
    8   HD13  LEU  26          HD13      LEU  26  14.412  10.420  12.490
    9   HD21  LEU  26          HD21      LEU  26  11.673   8.271  11.064
   10   HD23  LEU  26          HD22      LEU  26  11.113   8.968  12.582
   11   HD22  LEU  26          HD23      LEU  26  11.567   7.267  12.510

  No H/Q in entry =          11
  In of MODEL   91
    1    H    LYS  27           H        LYS  27  15.803   6.114  13.884
    2    HA   LYS  27           HA       LYS  27  15.212   7.479  16.254
    3    HB2  LYS  27           HB2      LYS  27  15.241   5.003  15.987
    4    HB3  LYS  27           HB3      LYS  27  17.004   5.057  15.942
    5    HG2  LYS  27           HG2      LYS  27  17.055   6.042  18.192
    6    HG3  LYS  27           HG3      LYS  27  15.288   6.059  18.239
    7    HD2  LYS  27           HD2      LYS  27  15.264   3.592  18.001
    8    HD3  LYS  27           HD3      LYS  27  17.029   3.583  17.988
    9    HE2  LYS  27           HE2      LYS  27  17.064   4.571  20.245
   10    HE3  LYS  27           HE3      LYS  27  15.299   4.610  20.261
   11    HZ3  LYS  27           HZ1      LYS  27  16.089   2.658  21.410
   12    HZ2  LYS  27           HZ2      LYS  27  17.004   2.180  20.058
   13    HZ1  LYS  27           HZ3      LYS  27  15.306   2.184  19.980

  No H/Q in entry =          13
  In of MODEL   91
    1    H    GLN  28           H        GLN  28  18.327   6.899  14.659
    2    HA   GLN  28           HA       GLN  28  20.013   7.982  16.648
    3    HB2  GLN  28           HB2      GLN  28  20.292   7.926  13.632
    4    HB3  GLN  28           HB3      GLN  28  21.580   8.414  14.734
    5    HG2  GLN  28           HG2      GLN  28  20.173   5.730  14.824
    6    HG3  GLN  28           HG3      GLN  28  21.737   6.011  14.060
    7   HE21  GLN  28          HE21      GLN  28  20.538   4.731  16.812
    8   HE22  GLN  28          HE22      GLN  28  21.752   5.173  17.912

  No H/Q in entry =           8
  In of MODEL   91
    1    H    ALA  29           H        ALA  29  18.258   9.466  13.958
    2    HA   ALA  29           HA       ALA  29  19.258  12.086  14.212
    3    HB2  ALA  29           HB1      ALA  29  17.558  12.724  12.742
    4    HB1  ALA  29           HB2      ALA  29  16.414  11.551  13.394
    5    HB3  ALA  29           HB3      ALA  29  17.743  11.009  12.369

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LYS  30           H        LYS  30  16.482  10.487  15.734
    2    HA   LYS  30           HA       LYS  30  15.470  12.740  17.094
    3    HB2  LYS  30           HB2      LYS  30  15.357   9.799  17.796
    4    HB3  LYS  30           HB3      LYS  30  14.493  11.049  18.691
    5    HG2  LYS  30           HG2      LYS  30  13.367  11.737  16.574
    6    HG3  LYS  30           HG3      LYS  30  14.170  10.401  15.746
    7    HD2  LYS  30           HD2      LYS  30  13.098   8.793  17.275
    8    HD3  LYS  30           HD3      LYS  30  12.305  10.119  18.127
    9    HE2  LYS  30           HE2      LYS  30  11.136  10.754  16.036
   10    HE3  LYS  30           HE3      LYS  30  11.908   9.399  15.203
   11    HZ2  LYS  30           HZ1      LYS  30   9.600   8.991  16.085
   12    HZ1  LYS  30           HZ2      LYS  30  10.270   9.043  17.652
   13    HZ3  LYS  30           HZ3      LYS  30  10.776   7.858  16.540

  No H/Q in entry =          13
  In of MODEL   91
    1    H    GLN  31           H        GLN  31  18.130  10.568  17.827
    2    HA   GLN  31           HA       GLN  31  18.461  11.580  20.521
    3    HB2  GLN  31           HB2      GLN  31  20.481  10.008  18.914
    4    HB3  GLN  31           HB3      GLN  31  20.348  10.132  20.668
    5    HG2  GLN  31           HG2      GLN  31  17.833   9.183  19.902
    6    HG3  GLN  31           HG3      GLN  31  18.933   8.338  18.820
    7   HE21  GLN  31          HE21      GLN  31  17.391   7.192  21.097
    8   HE22  GLN  31          HE22      GLN  31  18.547   6.529  22.146

  No H/Q in entry =           8
  In of MODEL   91
    1    H    GLY  32           H        GLY  32  18.979  12.899  17.555
    2    HA3  GLY  32           HA2      GLY  32  19.964  14.943  17.041
    3    HA2  GLY  32           HA3      GLY  32  20.723  14.946  18.628

  No H/Q in entry =           3
  In of MODEL   91
    1    H    ASP  33           H        ASP  33  21.141  12.055  16.849
    2    HA   ASP  33           HA       ASP  33  23.966  12.727  16.381
    3    HB2  ASP  33           HB2      ASP  33  22.455  10.113  16.497
    4    HB3  ASP  33           HB3      ASP  33  24.141  10.228  16.000

  No H/Q in entry =           4
  In of MODEL   91
    1    H    PHE  34           H        PHE  34  23.484  14.052  14.501
    2    HA   PHE  34           HA       PHE  34  22.132  13.071  12.214
    3    HB2  PHE  34           HB2      PHE  34  24.265  15.203  12.443
    4    HB3  PHE  34           HB3      PHE  34  23.278  14.914  11.012
    5    HD1  PHE  34           HD1      PHE  34  23.534  16.846  13.927
    6    HD2  PHE  34           HD2      PHE  34  20.652  14.734  11.543
    7    HE1  PHE  34           HE1      PHE  34  21.719  18.245  14.877
    8    HE2  PHE  34           HE2      PHE  34  18.841  16.133  12.495
    9    HZ   PHE  34           HZ       PHE  34  19.379  17.889  14.158

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ALA  35           H        ALA  35  25.507  12.880  13.218
    2    HA   ALA  35           HA       ALA  35  26.610  12.060  10.760
    3    HB3  ALA  35           HB1      ALA  35  28.291  10.888  12.477
    4    HB2  ALA  35           HB2      ALA  35  27.429  11.913  13.624
    5    HB1  ALA  35           HB3      ALA  35  28.265  12.637  12.251

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ALA  36           H        ALA  36  25.496  10.103  13.525
    2    HA   ALA  36           HA       ALA  36  25.978   7.616  12.247
    3    HB2  ALA  36           HB1      ALA  36  25.549   6.868  14.323
    4    HB3  ALA  36           HB2      ALA  36  23.861   7.364  14.175
    5    HB1  ALA  36           HB3      ALA  36  25.063   8.495  14.797

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ALA  37           H        ALA  37  23.157   9.742  12.385
    2    HA   ALA  37           HA       ALA  37  21.299   7.974  11.210
    3    HB3  ALA  37           HB1      ALA  37  21.525  10.936  11.504
    4    HB1  ALA  37           HB2      ALA  37  20.214   9.858  11.977
    5    HB2  ALA  37           HB3      ALA  37  20.401  10.331  10.288

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LYS  38           H        LYS  38  23.397  10.436   9.731
    2    HA   LYS  38           HA       LYS  38  22.754  10.010   7.054
    3    HB2  LYS  38           HB2      LYS  38  24.565  11.566   8.498
    4    HB3  LYS  38           HB3      LYS  38  25.598  10.578   7.471
    5    HG2  LYS  38           HG2      LYS  38  24.431  11.349   5.476
    6    HG3  LYS  38           HG3      LYS  38  23.237  12.203   6.459
    7    HD2  LYS  38           HD2      LYS  38  24.832  13.801   7.211
    8    HD3  LYS  38           HD3      LYS  38  26.192  12.816   6.673
    9    HE2  LYS  38           HE2      LYS  38  25.833  14.688   5.123
   10    HE3  LYS  38           HE3      LYS  38  25.498  13.151   4.318
   11    HZ3  LYS  38           HZ1      LYS  38  23.301  13.595   4.191
   12    HZ2  LYS  38           HZ2      LYS  38  23.822  15.210   4.279
   13    HZ1  LYS  38           HZ3      LYS  38  23.250  14.425   5.671

  No H/Q in entry =          13
  In of MODEL   91
    1    H    ALA  39           H        ALA  39  25.271   8.412   9.006
    2    HA   ALA  39           HA       ALA  39  26.340   6.825   6.935
    3    HB2  ALA  39           HB1      ALA  39  26.254   5.860   9.778
    4    HB1  ALA  39           HB2      ALA  39  27.206   7.287   9.362
    5    HB3  ALA  39           HB3      ALA  39  27.557   5.737   8.597

  No H/Q in entry =           5
  In of MODEL   91
    1    H    MET  40           H        MET  40  23.729   6.206   9.235
    2    HA   MET  40           HA       MET  40  23.288   3.501   8.500
    3    HB2  MET  40           HB2      MET  40  21.471   5.543   9.795
    4    HB3  MET  40           HB3      MET  40  21.066   3.833   9.620
    5    HG2  MET  40           HG2      MET  40  23.616   4.776  10.959
    6    HG3  MET  40           HG3      MET  40  22.123   4.498  11.853
    7    HE3  MET  40           HE1      MET  40  21.563   0.864  12.027
    8    HE2  MET  40           HE2      MET  40  20.692   2.166  11.222
    9    HE1  MET  40           HE3      MET  40  21.434   2.453  12.794

  No H/Q in entry =           9
  In of MODEL   91
    1    H    MET  41           H        MET  41  21.870   6.554   7.316
    2    HA   MET  41           HA       MET  41  19.912   5.358   5.645
    3    HB2  MET  41           HB2      MET  41  21.390   7.950   5.132
    4    HB3  MET  41           HB3      MET  41  19.861   7.455   4.415
    5    HG2  MET  41           HG2      MET  41  19.119   7.264   6.967
    6    HG3  MET  41           HG3      MET  41  20.426   8.423   7.188
    7    HE2  MET  41           HE1      MET  41  19.858   9.712   3.853
    8    HE1  MET  41           HE2      MET  41  20.816  10.152   5.264
    9    HE3  MET  41           HE3      MET  41  19.541  11.230   4.702

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ASP  42           H        ASP  42  23.283   6.285   5.089
    2    HA   ASP  42           HA       ASP  42  23.372   5.813   2.331
    3    HB2  ASP  42           HB2      ASP  42  25.124   6.812   4.099
    4    HB3  ASP  42           HB3      ASP  42  25.783   5.187   3.970

  No H/Q in entry =           4
  In of MODEL   91
    1    H    GLN  43           H        GLN  43  24.102   3.657   5.050
    2    HA   GLN  43           HA       GLN  43  24.768   1.402   3.465
    3    HB2  GLN  43           HB2      GLN  43  23.748   1.582   6.310
    4    HB3  GLN  43           HB3      GLN  43  24.328   0.094   5.553
    5    HG2  GLN  43           HG2      GLN  43  26.490   1.308   5.040
    6    HG3  GLN  43           HG3      GLN  43  25.906   2.634   6.041
    7   HE21  GLN  43          HE21      GLN  43  28.142   1.663   7.075
    8   HE22  GLN  43          HE22      GLN  43  27.870   0.579   8.351

  No H/Q in entry =           8
  In of MODEL   91
    1    H    SER  44           H        SER  44  21.712   2.530   4.854
    2    HA   SER  44           HA       SER  44  20.146   0.285   4.182
    3    HB2  SER  44           HB2      SER  44  19.702   2.813   5.329
    4    HB3  SER  44           HB3      SER  44  18.666   2.769   3.905
    5    HG   SER  44           HG       SER  44  17.576   1.824   5.629

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ARG  45           H        ARG  45  20.882   3.252   2.378
    2    HA   ARG  45           HA       ARG  45  19.355   2.766   0.074
    3    HB2  ARG  45           HB2      ARG  45  20.495   4.903   0.659
    4    HB3  ARG  45           HB3      ARG  45  22.040   4.151   0.271
    5    HG2  ARG  45           HG2      ARG  45  21.255   3.746  -2.043
    6    HG3  ARG  45           HG3      ARG  45  19.722   4.521  -1.654
    7    HD2  ARG  45           HD2      ARG  45  20.970   6.619  -1.070
    8    HD3  ARG  45           HD3      ARG  45  22.467   5.847  -1.641
    9    HE   ARG  45           HE       ARG  45  20.534   5.608  -3.675
   10   HH21  ARG  45          HH11      ARG  45  20.524   6.978  -5.437
   11   HH22  ARG  45          HH12      ARG  45  21.279   8.529  -5.333
   12   HH11  ARG  45          HH21      ARG  45  22.264   8.108  -2.049
   13   HH12  ARG  45          HH22      ARG  45  22.263   9.168  -3.411

  No H/Q in entry =          13
  In of MODEL   91
    1    H    MET  46           H        MET  46  22.721   1.894   0.817
    2    HA   MET  46           HA       MET  46  23.325   0.703  -1.669
    3    HB2  MET  46           HB2      MET  46  24.454   0.208   1.095
    4    HB3  MET  46           HB3      MET  46  25.169  -0.406  -0.399
    5    HG2  MET  46           HG2      MET  46  25.505   1.845  -1.235
    6    HG3  MET  46           HG3      MET  46  24.612   2.528   0.115
    7    HE1  MET  46           HE1      MET  46  27.489   0.792  -1.278
    8    HE3  MET  46           HE2      MET  46  27.836  -0.240   0.101
    9    HE2  MET  46           HE3      MET  46  28.865   1.146  -0.231

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ALA  47           H        ALA  47  21.947  -0.632   1.309
    2    HA   ALA  47           HA       ALA  47  21.893  -3.345   0.505
    3    HB2  ALA  47           HB1      ALA  47  21.518  -2.886   2.810
    4    HB3  ALA  47           HB2      ALA  47  19.981  -3.489   2.193
    5    HB1  ALA  47           HB3      ALA  47  20.210  -1.758   2.452

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LEU  48           H        LEU  48  19.539  -0.719   0.153
    2    HA   LEU  48           HA       LEU  48  17.492  -2.252  -1.095
    3    HB2  LEU  48           HB2      LEU  48  18.146   0.703  -1.209
    4    HB3  LEU  48           HB3      LEU  48  16.674  -0.008  -1.874
    5    HG   LEU  48           HG       LEU  48  17.533  -0.311   1.013
    6   HD13  LEU  48          HD11      LEU  48  17.115   1.990   0.828
    7   HD12  LEU  48          HD12      LEU  48  15.557   1.342   1.340
    8   HD11  LEU  48          HD13      LEU  48  15.825   1.765  -0.351
    9   HD22  LEU  48          HD21      LEU  48  16.004  -2.025   0.635
   10   HD21  LEU  48          HD22      LEU  48  15.127  -1.122  -0.601
   11   HD23  LEU  48          HD23      LEU  48  14.918  -0.718   1.103

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ASN  49           H        ASN  49  20.178  -0.323  -2.330
    2    HA   ASN  49           HA       ASN  49  19.521  -0.406  -5.053
    3    HB2  ASN  49           HB2      ASN  49  21.249   1.089  -4.161
    4    HB3  ASN  49           HB3      ASN  49  22.262  -0.298  -3.765
    5   HD21  ASN  49          HD21      ASN  49  22.969   1.859  -5.651
    6   HD22  ASN  49          HD22      ASN  49  23.172   1.123  -7.167

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLU  50           H        GLU  50  21.509  -2.602  -3.095
    2    HA   GLU  50           HA       GLU  50  22.206  -4.357  -5.223
    3    HB2  GLU  50           HB2      GLU  50  23.408  -4.333  -3.059
    4    HB3  GLU  50           HB3      GLU  50  21.968  -4.960  -2.260
    5    HG2  GLU  50           HG2      GLU  50  22.053  -6.993  -3.619
    6    HG3  GLU  50           HG3      GLU  50  23.427  -6.361  -4.523

  No H/Q in entry =           6
  In of MODEL   91
    1    H    ALA  51           H        ALA  51  19.555  -4.291  -2.890
    2    HA   ALA  51           HA       ALA  51  18.386  -6.764  -3.645
    3    HB3  ALA  51           HB1      ALA  51  16.798  -6.258  -2.086
    4    HB1  ALA  51           HB2      ALA  51  16.584  -4.611  -2.684
    5    HB2  ALA  51           HB3      ALA  51  17.945  -4.998  -1.631

  No H/Q in entry =           5
  In of MODEL   91
    1    H    HIS  52           H        HIS  52  17.799  -3.416  -4.679
    2    HA   HIS  52           HA       HIS  52  15.681  -3.942  -6.473
    3    HB2  HIS  52           HB2      HIS  52  16.311  -1.676  -5.687
    4    HB3  HIS  52           HB3      HIS  52  17.785  -1.772  -6.651
    5    HD1  HIS  52           HD1      HIS  52  17.436  -2.006  -9.298
    6    HD2  HIS  52           HD2      HIS  52  14.032  -0.956  -7.133
    7    HE1  HIS  52           HE1      HIS  52  15.760  -1.129 -10.981
    8    HE2  HIS  52           HE2      HIS  52  13.679  -0.483  -9.677

  No H/Q in entry =           8
  In of MODEL   91
    1    H    LEU  53           H        LEU  53  19.199  -3.948  -6.915
    2    HA   LEU  53           HA       LEU  53  19.249  -4.264  -9.715
    3    HB2  LEU  53           HB2      LEU  53  21.153  -5.031  -7.511
    4    HB3  LEU  53           HB3      LEU  53  21.499  -5.432  -9.191
    5    HG   LEU  53           HG       LEU  53  20.780  -2.621  -8.334
    6   HD12  LEU  53          HD11      LEU  53  23.371  -2.336  -8.578
    7   HD11  LEU  53          HD12      LEU  53  23.416  -4.066  -8.238
    8   HD13  LEU  53          HD13      LEU  53  22.717  -2.954  -7.061
    9   HD21  LEU  53          HD21      LEU  53  21.994  -3.919 -10.777
   10   HD23  LEU  53          HD22      LEU  53  22.286  -2.218 -10.428
   11   HD22  LEU  53          HD23      LEU  53  20.642  -2.791 -10.686

  No H/Q in entry =          11
  In of MODEL   91
    1    H    VAL  54           H        VAL  54  19.143  -6.650  -7.089
    2    HA   VAL  54           HA       VAL  54  19.262  -8.945  -8.748
    3    HB   VAL  54           HB       VAL  54  18.114  -8.521  -5.978
    4   HG12  VAL  54          HG11      VAL  54  18.439 -11.139  -5.974
    5   HG11  VAL  54          HG12      VAL  54  18.250 -10.971  -7.719
    6   HG13  VAL  54          HG13      VAL  54  16.964 -10.440  -6.637
    7   HG22  VAL  54          HG21      VAL  54  20.431  -8.310  -5.761
    8   HG21  VAL  54          HG22      VAL  54  20.765  -9.402  -7.103
    9   HG23  VAL  54          HG23      VAL  54  20.239 -10.049  -5.549

  No H/Q in entry =           9
  In of MODEL   91
    1    H    GLN  55           H        GLN  55  16.536  -7.043  -7.459
    2    HA   GLN  55           HA       GLN  55  14.513  -8.708  -8.527
    3    HB2  GLN  55           HB2      GLN  55  13.768  -7.182  -6.899
    4    HB3  GLN  55           HB3      GLN  55  14.559  -5.814  -7.678
    5    HG2  GLN  55           HG2      GLN  55  12.831  -5.491  -9.163
    6    HG3  GLN  55           HG3      GLN  55  12.509  -7.211  -9.332
    7   HE21  GLN  55          HE21      GLN  55  10.505  -7.761  -8.522
    8   HE22  GLN  55          HE22      GLN  55   9.734  -7.007  -7.212

  No H/Q in entry =           8
  In of MODEL   91
    1    H    THR  56           H        THR  56  16.248  -5.908  -9.892
    2    HA   THR  56           HA       THR  56  14.804  -5.547 -12.237
    3    HB   THR  56           HB       THR  56  17.825  -5.455 -12.062
    4    HG1  THR  56           HG1      THR  56  15.824  -3.864 -10.977
    5   HG21  THR  56          HG21      THR  56  15.956  -4.833 -14.145
    6   HG23  THR  56          HG22      THR  56  17.701  -4.582 -14.140
    7   HG22  THR  56          HG23      THR  56  16.628  -3.317 -13.547

  No H/Q in entry =           7
  In of MODEL   91
    1    H    LYS  57           H        LYS  57  17.457  -7.842 -11.631
    2    HA   LYS  57           HA       LYS  57  17.452  -9.038 -14.209
    3    HB2  LYS  57           HB2      LYS  57  19.262  -9.324 -12.505
    4    HB3  LYS  57           HB3      LYS  57  18.168 -10.356 -11.582
    5    HG2  LYS  57           HG2      LYS  57  17.972 -11.896 -13.476
    6    HG3  LYS  57           HG3      LYS  57  19.000 -10.850 -14.456
    7    HD2  LYS  57           HD2      LYS  57  20.855 -11.180 -12.851
    8    HD3  LYS  57           HD3      LYS  57  19.829 -12.256 -11.900
    9    HE2  LYS  57           HE2      LYS  57  19.532 -13.613 -14.065
   10    HE3  LYS  57           HE3      LYS  57  20.890 -12.681 -14.696
   11    HZ2  LYS  57           HZ1      LYS  57  20.885 -14.838 -12.823
   12    HZ1  LYS  57           HZ2      LYS  57  21.710 -13.481 -12.220
   13    HZ3  LYS  57           HZ3      LYS  57  22.176 -14.174 -13.700

  No H/Q in entry =          13
  In of MODEL   91
    1    H    LEU  58           H        LEU  58  15.680  -9.706 -11.229
    2    HA   LEU  58           HA       LEU  58  14.458 -12.081 -12.159
    3    HB2  LEU  58           HB2      LEU  58  13.667 -10.175  -9.962
    4    HB3  LEU  58           HB3      LEU  58  12.861 -11.714 -10.276
    5    HG   LEU  58           HG       LEU  58  15.835 -11.432  -9.729
    6   HD11  LEU  58          HD11      LEU  58  13.469 -11.852  -7.930
    7   HD13  LEU  58          HD12      LEU  58  14.922 -10.886  -7.672
    8   HD12  LEU  58          HD13      LEU  58  14.997 -12.642  -7.536
    9   HD22  LEU  58          HD21      LEU  58  15.717 -13.495 -10.755
   10   HD21  LEU  58          HD22      LEU  58  14.005 -13.706 -10.390
   11   HD23  LEU  58          HD23      LEU  58  15.217 -14.005  -9.144

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  59           H        ILE  59  13.781  -8.745 -12.842
    2    HA   ILE  59           HA       ILE  59  11.064  -9.398 -13.774
    3    HB   ILE  59           HB       ILE  59  11.689  -7.205 -12.497
    4   HG12  ILE  59          HG12      ILE  59  10.112  -6.897 -15.057
    5   HG13  ILE  59          HG13      ILE  59   9.497  -7.789 -13.674
    6   HG23  ILE  59          HG21      ILE  59  13.503  -6.407 -13.897
    7   HG22  ILE  59          HG22      ILE  59  12.151  -5.316 -14.052
    8   HG21  ILE  59          HG23      ILE  59  12.495  -6.468 -15.332
    9   HD11  ILE  59          HD11      ILE  59  10.530  -4.973 -13.392
   10   HD13  ILE  59          HD12      ILE  59   9.495  -5.872 -12.283
   11   HD12  ILE  59          HD13      ILE  59   8.853  -5.305 -13.824

  No H/Q in entry =          11
  In of MODEL   91
    1    H    GLU  60           H        GLU  60  14.263  -8.542 -15.041
    2    HA   GLU  60           HA       GLU  60  13.476  -8.145 -17.748
    3    HB2  GLU  60           HB2      GLU  60  15.675  -7.431 -16.903
    4    HB3  GLU  60           HB3      GLU  60  16.115  -9.107 -16.587
    5    HG2  GLU  60           HG2      GLU  60  15.763  -9.542 -19.083
    6    HG3  GLU  60           HG3      GLU  60  15.644  -7.796 -19.275

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLY  61           H        GLY  61  14.462 -11.024 -15.934
    2    HA3  GLY  61           HA2      GLY  61  13.916 -12.674 -18.333
    3    HA2  GLY  61           HA3      GLY  61  14.953 -13.153 -16.993

  No H/Q in entry =           3
  In of MODEL   91
    1    H    ASP  62           H        ASP  62  11.815 -11.617 -16.605
    2    HA   ASP  62           HA       ASP  62  10.917 -13.566 -14.755
    3    HB2  ASP  62           HB2      ASP  62   8.738 -12.376 -14.953
    4    HB3  ASP  62           HB3      ASP  62  10.097 -11.300 -14.644

  No H/Q in entry =           4
  In of MODEL   91
    1    H    ALA  63           H        ALA  63  11.126 -13.771 -18.091
    2    HA   ALA  63           HA       ALA  63   8.696 -15.299 -18.525
    3    HB3  ALA  63           HB1      ALA  63   9.999 -13.818 -20.234
    4    HB2  ALA  63           HB2      ALA  63   9.291 -15.338 -20.780
    5    HB1  ALA  63           HB3      ALA  63  11.017 -15.244 -20.429

  No H/Q in entry =           5
  In of MODEL   91
    1    H    GLY  64           H        GLY  64   8.998 -17.495 -19.693
    2    HA3  GLY  64           HA2      GLY  64  10.701 -19.383 -19.814
    3    HA2  GLY  64           HA3      GLY  64  10.880 -19.121 -18.084

  No H/Q in entry =           3
  In of MODEL   91
    1    H    GLU  65           H        GLU  65   8.494 -18.991 -17.011
    2    HA   GLU  65           HA       GLU  65   7.481 -21.635 -17.169
    3    HB2  GLU  65           HB2      GLU  65   6.372 -19.142 -15.871
    4    HB3  GLU  65           HB3      GLU  65   5.648 -20.740 -15.696
    5    HG2  GLU  65           HG2      GLU  65   7.729 -21.609 -14.742
    6    HG3  GLU  65           HG3      GLU  65   8.509 -20.045 -14.975

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLY  66           H        GLY  66   6.342 -18.555 -18.491
    2    HA3  GLY  66           HA2      GLY  66   4.803 -19.949 -20.505
    3    HA2  GLY  66           HA3      GLY  66   3.817 -19.087 -19.328

  No H/Q in entry =           3
  In of MODEL   91
    1    H    LYS  67           H        LYS  67   3.533 -18.282 -21.842
    2    HA   LYS  67           HA       LYS  67   5.356 -16.304 -22.747
    3    HB2  LYS  67           HB2      LYS  67   2.401 -16.563 -23.355
    4    HB3  LYS  67           HB3      LYS  67   3.591 -15.677 -24.304
    5    HG2  LYS  67           HG2      LYS  67   3.729 -18.658 -23.774
    6    HG3  LYS  67           HG3      LYS  67   3.039 -17.949 -25.232
    7    HD2  LYS  67           HD2      LYS  67   5.287 -16.747 -25.527
    8    HD3  LYS  67           HD3      LYS  67   5.909 -17.842 -24.291
    9    HE2  LYS  67           HE2      LYS  67   5.314 -19.780 -25.626
   10    HE3  LYS  67           HE3      LYS  67   4.524 -18.757 -26.825
   11    HZ3  LYS  67           HZ1      LYS  67   6.497 -18.028 -27.646
   12    HZ2  LYS  67           HZ2      LYS  67   6.991 -19.566 -27.119
   13    HZ1  LYS  67           HZ3      LYS  67   7.318 -18.193 -26.172

  No H/Q in entry =          13
  In of MODEL   91
    1    H    MET  68           H        MET  68   2.001 -15.536 -22.004
    2    HA   MET  68           HA       MET  68   2.570 -12.869 -21.263
    3    HB2  MET  68           HB2      MET  68   0.144 -14.627 -21.097
    4    HB3  MET  68           HB3      MET  68   0.133 -13.011 -20.391
    5    HG2  MET  68           HG2      MET  68   0.927 -13.588 -23.258
    6    HG3  MET  68           HG3      MET  68  -0.694 -13.093 -22.770
    7    HE3  MET  68           HE1      MET  68   2.689 -11.935 -23.969
    8    HE2  MET  68           HE2      MET  68   2.062 -10.340 -24.374
    9    HE1  MET  68           HE3      MET  68   1.167 -11.779 -24.856

  No H/Q in entry =           9
  In of MODEL   91
    1    H    LYS  69           H        LYS  69   1.935 -15.761 -19.295
    2    HA   LYS  69           HA       LYS  69   1.772 -14.321 -16.838
    3    HB2  LYS  69           HB2      LYS  69   2.165 -17.251 -17.436
    4    HB3  LYS  69           HB3      LYS  69   1.960 -16.600 -15.807
    5    HG2  LYS  69           HG2      LYS  69  -0.194 -15.599 -16.472
    6    HG3  LYS  69           HG3      LYS  69   0.005 -16.250 -18.099
    7    HD2  LYS  69           HD2      LYS  69   0.056 -18.545 -17.151
    8    HD3  LYS  69           HD3      LYS  69  -0.222 -17.868 -15.545
    9    HE2  LYS  69           HE2      LYS  69  -2.076 -17.460 -17.909
   10    HE3  LYS  69           HE3      LYS  69  -2.324 -18.671 -16.651
   11    HZ1  LYS  69           HZ1      LYS  69  -1.820 -15.995 -15.681
   12    HZ3  LYS  69           HZ2      LYS  69  -2.977 -17.134 -15.181
   13    HZ2  LYS  69           HZ3      LYS  69  -3.269 -16.166 -16.547

  No H/Q in entry =          13
  In of MODEL   91
    1    H    VAL  70           H        VAL  70   3.164 -14.313 -15.083
    2    HA   VAL  70           HA       VAL  70   6.018 -14.848 -15.633
    3    HB   VAL  70           HB       VAL  70   6.563 -12.740 -14.450
    4   HG12  VAL  70          HG11      VAL  70   5.821 -11.206 -16.264
    5   HG11  VAL  70          HG12      VAL  70   4.701 -12.446 -16.827
    6   HG13  VAL  70          HG13      VAL  70   6.440 -12.731 -16.898
    7   HG22  VAL  70          HG21      VAL  70   4.761 -11.114 -14.024
    8   HG21  VAL  70          HG22      VAL  70   4.483 -12.600 -13.115
    9   HG23  VAL  70          HG23      VAL  70   3.566 -12.282 -14.588

  No H/Q in entry =           9
  In of MODEL   91
    1    H    SER  71           H        SER  71   7.302 -14.678 -13.472
    2    HA   SER  71           HA       SER  71   6.325 -16.615 -11.677
    3    HB2  SER  71           HB2      SER  71   8.732 -15.993 -11.950
    4    HB3  SER  71           HB3      SER  71   8.401 -14.484 -11.103
    5    HG   SER  71           HG       SER  71   7.491 -15.968  -9.423

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LEU  72           H        LEU  72   4.971 -16.491  -9.973
    2    HA   LEU  72           HA       LEU  72   3.420 -14.179  -9.525
    3    HB2  LEU  72           HB2      LEU  72   3.734 -16.739  -7.963
    4    HB3  LEU  72           HB3      LEU  72   2.562 -15.492  -7.543
    5    HG   LEU  72           HG       LEU  72   2.729 -16.775 -10.283
    6   HD12  LEU  72          HD11      LEU  72   0.749 -17.387  -8.074
    7   HD11  LEU  72          HD12      LEU  72   2.157 -18.389  -8.423
    8   HD13  LEU  72          HD13      LEU  72   0.891 -18.194  -9.636
    9   HD22  LEU  72          HD21      LEU  72   1.528 -14.819 -10.616
   10   HD21  LEU  72          HD22      LEU  72   0.953 -14.760  -8.950
   11   HD23  LEU  72          HD23      LEU  72   0.218 -15.877 -10.098

  No H/Q in entry =          11
  In of MODEL   91
    1    H    VAL  73           H        VAL  73   6.081 -15.613  -7.757
    2    HA   VAL  73           HA       VAL  73   6.023 -14.080  -5.425
    3    HB   VAL  73           HB       VAL  73   8.233 -14.864  -5.020
    4   HG11  VAL  73          HG11      VAL  73   6.727 -16.870  -6.726
    5   HG13  VAL  73          HG12      VAL  73   6.514 -16.611  -4.995
    6   HG12  VAL  73          HG13      VAL  73   8.031 -17.268  -5.608
    7   HG22  VAL  73          HG21      VAL  73   9.503 -14.308  -6.900
    8   HG21  VAL  73          HG22      VAL  73   8.340 -15.017  -8.019
    9   HG23  VAL  73          HG23      VAL  73   9.387 -16.061  -7.058

  No H/Q in entry =           9
  In of MODEL   91
    1    H    LEU  74           H        LEU  74   7.006 -13.185  -8.603
    2    HA   LEU  74           HA       LEU  74   8.950 -11.234  -8.113
    3    HB2  LEU  74           HB2      LEU  74   8.448 -12.065 -10.333
    4    HB3  LEU  74           HB3      LEU  74   6.802 -11.450 -10.233
    5    HG   LEU  74           HG       LEU  74   7.682  -9.144 -10.120
    6   HD13  LEU  74          HD11      LEU  74   9.803  -9.211  -9.179
    7   HD12  LEU  74          HD12      LEU  74  10.224  -9.074 -10.885
    8   HD11  LEU  74          HD13      LEU  74  10.279 -10.645 -10.086
    9   HD21  LEU  74          HD21      LEU  74   8.030 -11.011 -12.382
   10   HD23  LEU  74          HD22      LEU  74   9.013  -9.564 -12.513
   11   HD22  LEU  74          HD23      LEU  74   7.268  -9.423 -12.340

  No H/Q in entry =          11
  In of MODEL   91
    1    H    VAL  75           H        VAL  75   5.453 -10.853  -8.461
    2    HA   VAL  75           HA       VAL  75   5.355  -8.097  -7.874
    3    HB   VAL  75           HB       VAL  75   3.280 -10.259  -7.403
    4   HG11  VAL  75          HG11      VAL  75   3.016  -7.237  -7.447
    5   HG13  VAL  75          HG12      VAL  75   2.802  -8.278  -6.040
    6   HG12  VAL  75          HG13      VAL  75   1.666  -8.370  -7.385
    7   HG21  VAL  75          HG21      VAL  75   4.139  -8.638  -9.754
    8   HG23  VAL  75          HG22      VAL  75   2.401  -8.832  -9.533
    9   HG22  VAL  75          HG23      VAL  75   3.431 -10.252  -9.697

  No H/Q in entry =           9
  In of MODEL   91
    1    H    GLU  76           H        GLU  76   5.107 -10.974  -5.764
    2    HA   GLU  76           HA       GLU  76   4.638  -9.614  -3.342
    3    HB2  GLU  76           HB2      GLU  76   4.471 -12.084  -3.583
    4    HB3  GLU  76           HB3      GLU  76   6.210 -12.175  -3.817
    5    HG2  GLU  76           HG2      GLU  76   6.106 -12.655  -1.561
    6    HG3  GLU  76           HG3      GLU  76   6.248 -10.907  -1.470

  No H/Q in entry =           6
  In of MODEL   91
    1    H    ALA  77           H        ALA  77   7.697 -10.518  -4.909
    2    HA   ALA  77           HA       ALA  77   9.388  -9.473  -2.894
    3    HB2  ALA  77           HB1      ALA  77   9.707 -10.267  -5.750
    4    HB1  ALA  77           HB2      ALA  77  10.574 -10.828  -4.321
    5    HB3  ALA  77           HB3      ALA  77  10.972  -9.266  -5.035

  No H/Q in entry =           5
  In of MODEL   91
    1    H    GLN  78           H        GLN  78   7.992  -8.057  -5.807
    2    HA   GLN  78           HA       GLN  78   9.342  -5.576  -5.704
    3    HB2  GLN  78           HB2      GLN  78   8.030  -6.507  -7.654
    4    HB3  GLN  78           HB3      GLN  78   6.559  -6.080  -6.781
    5    HG2  GLN  78           HG2      GLN  78   7.239  -3.733  -6.729
    6    HG3  GLN  78           HG3      GLN  78   8.754  -4.133  -7.536
    7   HE21  GLN  78          HE21      GLN  78   6.981  -2.288  -8.752
    8   HE22  GLN  78          HE22      GLN  78   6.306  -3.003 -10.136

  No H/Q in entry =           8
  In of MODEL   91
    1    H    LEU  79           H        LEU  79   6.325  -6.716  -4.272
    2    HA   LEU  79           HA       LEU  79   5.330  -4.309  -3.262
    3    HB2  LEU  79           HB2      LEU  79   4.017  -6.362  -3.205
    4    HB3  LEU  79           HB3      LEU  79   5.163  -7.100  -2.091
    5    HG   LEU  79           HG       LEU  79   4.610  -5.459  -0.363
    6   HD13  LEU  79          HD11      LEU  79   4.143  -3.444  -1.414
    7   HD12  LEU  79          HD12      LEU  79   2.518  -3.971  -0.974
    8   HD11  LEU  79          HD13      LEU  79   3.098  -4.193  -2.623
    9   HD23  LEU  79          HD21      LEU  79   2.024  -5.952  -0.272
   10   HD22  LEU  79          HD22      LEU  79   3.164  -7.291  -0.164
   11   HD21  LEU  79          HD23      LEU  79   2.350  -6.954  -1.689

  No H/Q in entry =          11
  In of MODEL   91
    1    H    HIS  80           H        HIS  80   7.514  -6.644  -1.680
    2    HA   HIS  80           HA       HIS  80   7.802  -5.102   0.689
    3    HB2  HIS  80           HB2      HIS  80   9.140  -7.464  -0.510
    4    HB3  HIS  80           HB3      HIS  80  10.051  -6.568   0.707
    5    HD1  HIS  80           HD1      HIS  80   9.561  -7.204   3.050
    6    HD2  HIS  80           HD2      HIS  80   6.344  -8.055   0.538
    7    HE1  HIS  80           HE1      HIS  80   7.789  -8.307   4.498
    8    HE2  HIS  80           HE2      HIS  80   5.822  -8.830   2.976

  No H/Q in entry =           8
  In of MODEL   91
    1    H    LEU  81           H        LEU  81   9.807  -5.378  -2.223
    2    HA   LEU  81           HA       LEU  81  11.852  -3.637  -1.345
    3    HB2  LEU  81           HB2      LEU  81  10.931  -4.429  -4.108
    4    HB3  LEU  81           HB3      LEU  81  12.351  -3.423  -3.817
    5    HG   LEU  81           HG       LEU  81  11.958  -6.144  -2.544
    6   HD12  LEU  81          HD11      LEU  81  13.774  -6.771  -4.294
    7   HD11  LEU  81          HD12      LEU  81  13.208  -5.347  -5.165
    8   HD13  LEU  81          HD13      LEU  81  12.096  -6.671  -4.827
    9   HD23  LEU  81          HD21      LEU  81  14.586  -5.830  -2.530
   10   HD22  LEU  81          HD22      LEU  81  13.604  -5.069  -1.279
   11   HD21  LEU  81          HD23      LEU  81  14.183  -4.117  -2.646

  No H/Q in entry =          11
  In of MODEL   91
    1    H    MET  82           H        MET  82   8.929  -2.999  -3.282
    2    HA   MET  82           HA       MET  82   9.470  -0.274  -3.782
    3    HB2  MET  82           HB2      MET  82   6.910  -1.866  -3.658
    4    HB3  MET  82           HB3      MET  82   6.911  -0.142  -4.022
    5    HG2  MET  82           HG2      MET  82   8.510  -2.216  -5.557
    6    HG3  MET  82           HG3      MET  82   6.943  -1.593  -6.070
    7    HE3  MET  82           HE1      MET  82   7.394   1.862  -7.241
    8    HE2  MET  82           HE2      MET  82   7.019   1.636  -5.535
    9    HE1  MET  82           HE3      MET  82   6.353   0.527  -6.729

  No H/Q in entry =           9
  In of MODEL   91
    1    H    THR  83           H        THR  83   7.677  -1.871  -1.177
    2    HA   THR  83           HA       THR  83   6.828   0.478   0.149
    3    HB   THR  83           HB       THR  83   6.692  -1.097   2.167
    4    HG1  THR  83           HG1      THR  83   7.447  -3.047   1.937
    5   HG22  THR  83          HG21      THR  83   5.038  -2.661   0.698
    6   HG21  THR  83          HG22      THR  83   5.265  -1.333  -0.433
    7   HG23  THR  83          HG23      THR  83   4.625  -1.017   1.180

  No H/Q in entry =           7
  In of MODEL   91
    1    H    SER  84           H        SER  84   9.649  -1.623   0.670
    2    HA   SER  84           HA       SER  84  10.710  -0.193   2.859
    3    HB2  SER  84           HB2      SER  84  11.962  -2.037   0.834
    4    HB3  SER  84           HB3      SER  84  12.909  -1.285   2.116
    5    HG   SER  84           HG       SER  84  10.632  -2.972   2.375

  No H/Q in entry =           5
  In of MODEL   91
    1    H    MET  85           H        MET  85  11.464   0.067  -0.629
    2    HA   MET  85           HA       MET  85  13.464   2.030  -0.378
    3    HB2  MET  85           HB2      MET  85  12.974   0.706  -2.442
    4    HB3  MET  85           HB3      MET  85  11.543   1.706  -2.687
    5    HG2  MET  85           HG2      MET  85  12.861   3.691  -2.942
    6    HG3  MET  85           HG3      MET  85  14.317   2.874  -2.377
    7    HE2  MET  85           HE1      MET  85  11.984   3.722  -5.256
    8    HE1  MET  85           HE2      MET  85  11.409   2.092  -4.914
    9    HE3  MET  85           HE3      MET  85  12.218   2.430  -6.441

  No H/Q in entry =           9
  In of MODEL   91
    1    H    LEU  86           H        LEU  86   9.975   2.369  -0.887
    2    HA   LEU  86           HA       LEU  86   9.915   5.182  -1.069
    3    HB2  LEU  86           HB2      LEU  86   8.069   3.525  -1.645
    4    HB3  LEU  86           HB3      LEU  86   7.738   3.436   0.085
    5    HG   LEU  86           HG       LEU  86   7.581   5.997   0.033
    6   HD11  LEU  86          HD11      LEU  86   8.357   5.560  -2.669
    7   HD13  LEU  86          HD12      LEU  86   7.923   7.088  -1.908
    8   HD12  LEU  86          HD13      LEU  86   6.685   6.127  -2.714
    9   HD23  LEU  86          HD21      LEU  86   5.446   4.648  -1.630
   10   HD22  LEU  86          HD22      LEU  86   5.257   5.908  -0.414
   11   HD21  LEU  86          HD23      LEU  86   5.654   4.263   0.079

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ALA  87           H        ALA  87   9.445   3.004   1.677
    2    HA   ALA  87           HA       ALA  87   8.899   4.919   3.647
    3    HB1  ALA  87           HB1      ALA  87   9.702   2.098   3.560
    4    HB3  ALA  87           HB2      ALA  87   8.578   2.911   4.646
    5    HB2  ALA  87           HB3      ALA  87  10.307   2.940   4.990

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ARG  88           H        ARG  88  11.981   3.490   2.666
    2    HA   ARG  88           HA       ARG  88  13.592   4.865   4.499
    3    HB2  ARG  88           HB2      ARG  88  14.256   2.890   3.095
    4    HB3  ARG  88           HB3      ARG  88  14.411   3.983   1.722
    5    HG2  ARG  88           HG2      ARG  88  15.886   5.294   3.669
    6    HG3  ARG  88           HG3      ARG  88  16.204   3.604   4.047
    7    HD2  ARG  88           HD2      ARG  88  17.470   3.306   2.201
    8    HD3  ARG  88           HD3      ARG  88  16.335   4.179   1.168
    9    HE   ARG  88           HE       ARG  88  18.731   5.239   2.215
   10   HH21  ARG  88          HH11      ARG  88  19.080   7.457   2.021
   11   HH22  ARG  88          HH12      ARG  88  17.731   8.531   1.878
   12   HH11  ARG  88          HH21      ARG  88  15.393   5.998   1.937
   13   HH12  ARG  88          HH22      ARG  88  15.642   7.702   1.806

  No H/Q in entry =          13
  In of MODEL   91
    1    H    GLU  89           H        GLU  89  12.620   5.765   1.176
    2    HA   GLU  89           HA       GLU  89  14.171   8.122   1.019
    3    HB2  GLU  89           HB2      GLU  89  13.025   7.083  -0.929
    4    HB3  GLU  89           HB3      GLU  89  11.481   7.627  -0.270
    5    HG2  GLU  89           HG2      GLU  89  12.187   9.963  -0.433
    6    HG3  GLU  89           HG3      GLU  89  13.790   9.470  -0.970

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LEU  90           H        LEU  90  10.841   7.618   2.149
    2    HA   LEU  90           HA       LEU  90  10.331  10.352   2.725
    3    HB2  LEU  90           HB2      LEU  90   9.132   7.781   3.752
    4    HB3  LEU  90           HB3      LEU  90   8.504   9.377   4.175
    5    HG   LEU  90           HG       LEU  90   8.920   8.497   1.306
    6   HD12  LEU  90          HD11      LEU  90   6.386   8.172   1.369
    7   HD11  LEU  90          HD12      LEU  90   6.541   8.161   3.126
    8   HD13  LEU  90          HD13      LEU  90   7.357   6.930   2.161
    9   HD22  LEU  90          HD21      LEU  90   8.630  10.805   1.233
   10   HD21  LEU  90          HD22      LEU  90   7.644  10.839   2.693
   11   HD23  LEU  90          HD23      LEU  90   6.945  10.285   1.172

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  91           H        ILE  91  11.590   7.669   4.647
    2    HA   ILE  91           HA       ILE  91  11.733   9.033   7.115
    3    HB   ILE  91           HB       ILE  91  13.283   6.692   5.991
    4   HG12  ILE  91          HG12      ILE  91  11.267   6.862   8.251
    5   HG13  ILE  91          HG13      ILE  91  10.796   6.582   6.575
    6   HG22  ILE  91          HG21      ILE  91  13.753   6.477   8.631
    7   HG21  ILE  91          HG22      ILE  91  13.680   8.236   8.530
    8   HG23  ILE  91          HG23      ILE  91  14.857   7.346   7.565
    9   HD13  ILE  91          HD11      ILE  91  11.795   4.479   6.504
   10   HD12  ILE  91          HD12      ILE  91  11.202   4.538   8.164
   11   HD11  ILE  91          HD13      ILE  91  12.904   4.848   7.826

  No H/Q in entry =          11
  In of MODEL   91
    1    H    THR  92           H        THR  92  13.949   8.861   4.363
    2    HA   THR  92           HA       THR  92  16.117  10.250   5.522
    3    HB   THR  92           HB       THR  92  15.130  10.127   2.661
    4    HG1  THR  92           HG1      THR  92  15.958   8.229   3.066
    5   HG22  THR  92          HG21      THR  92  17.701  10.813   2.367
    6   HG21  THR  92          HG22      THR  92  17.394  11.635   3.897
    7   HG23  THR  92          HG23      THR  92  16.424  12.024   2.477

  No H/Q in entry =           7
  In of MODEL   91
    1    H    GLU  93           H        GLU  93  13.231  11.408   3.794
    2    HA   GLU  93           HA       GLU  93  13.830  14.168   3.908
    3    HB2  GLU  93           HB2      GLU  93  11.124  12.800   3.923
    4    HB3  GLU  93           HB3      GLU  93  11.414  14.499   3.552
    5    HG2  GLU  93           HG2      GLU  93  12.748  12.255   2.023
    6    HG3  GLU  93           HG3      GLU  93  11.202  12.940   1.536

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LEU  94           H        LEU  94  12.085  12.014   6.120
    2    HA   LEU  94           HA       LEU  94  11.279  13.962   7.997
    3    HB2  LEU  94           HB2      LEU  94  11.850  11.006   8.270
    4    HB3  LEU  94           HB3      LEU  94  11.281  11.982   9.621
    5    HG   LEU  94           HG       LEU  94   9.796  12.036   6.992
    6   HD11  LEU  94          HD11      LEU  94   9.876   9.815   8.996
    7   HD13  LEU  94          HD12      LEU  94   9.573   9.754   7.262
    8   HD12  LEU  94          HD13      LEU  94   8.296  10.273   8.360
    9   HD23  LEU  94          HD21      LEU  94   7.877  12.439   8.593
   10   HD22  LEU  94          HD22      LEU  94   9.118  13.691   8.630
   11   HD21  LEU  94          HD23      LEU  94   9.054  12.474   9.904

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  95           H        ILE  95  14.250  12.028   7.758
    2    HA   ILE  95           HA       ILE  95  15.420  12.947  10.172
    3    HB   ILE  95           HB       ILE  95  16.656  11.877   7.623
    4   HG12  ILE  95          HG12      ILE  95  16.360  10.676  10.390
    5   HG13  ILE  95          HG13      ILE  95  15.192  10.420   9.096
    6   HG21  ILE  95          HG21      ILE  95  17.914  12.681  10.265
    7   HG23  ILE  95          HG22      ILE  95  18.376  13.209   8.645
    8   HG22  ILE  95          HG23      ILE  95  18.680  11.548   9.153
    9   HD13  ILE  95          HD11      ILE  95  16.669   9.139   7.832
   10   HD12  ILE  95          HD12      ILE  95  17.142   8.689   9.467
   11   HD11  ILE  95          HD13      ILE  95  18.097   9.867   8.568

  No H/Q in entry =          11
  In of MODEL   91
    1    H    GLU  96           H        GLU  96  15.575  14.181   6.837
    2    HA   GLU  96           HA       GLU  96  17.425  16.257   7.314
    3    HB2  GLU  96           HB2      GLU  96  16.758  15.596   5.055
    4    HB3  GLU  96           HB3      GLU  96  15.116  16.155   5.356
    5    HG2  GLU  96           HG2      GLU  96  15.685  18.284   4.814
    6    HG3  GLU  96           HG3      GLU  96  16.985  18.282   5.995

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LEU  97           H        LEU  97  13.913  16.075   7.745
    2    HA   LEU  97           HA       LEU  97  13.502  18.810   8.388
    3    HB2  LEU  97           HB2      LEU  97  11.980  16.286   9.002
    4    HB3  LEU  97           HB3      LEU  97  11.470  17.834   9.674
    5    HG   LEU  97           HG       LEU  97  11.950  17.418   6.709
    6   HD12  LEU  97          HD11      LEU  97   9.427  17.294   6.592
    7   HD11  LEU  97          HD12      LEU  97   9.421  17.094   8.342
    8   HD13  LEU  97          HD13      LEU  97  10.199  15.885   7.320
    9   HD23  LEU  97          HD21      LEU  97  10.216  19.385   6.743
   10   HD22  LEU  97          HD22      LEU  97  11.898  19.741   7.134
   11   HD21  LEU  97          HD23      LEU  97  10.710  19.573   8.425

  No H/Q in entry =          11
  In of MODEL   91
    1    H    HIS  98           H        HIS  98  14.320  15.982  10.382
    2    HA   HIS  98           HA       HIS  98  14.166  17.242  12.898
    3    HB2  HIS  98           HB2      HIS  98  15.911  14.982  11.895
    4    HB3  HIS  98           HB3      HIS  98  15.912  15.520  13.576
    5    HD1  HIS  98           HD1      HIS  98  13.708  13.895  10.985
    6    HD2  HIS  98           HD2      HIS  98  13.605  14.814  15.050
    7    HE1  HIS  98           HE1      HIS  98  11.682  12.704  11.939
    8    HE2  HIS  98           HE2      HIS  98  11.599  13.255  14.410

  No H/Q in entry =           8
  In of MODEL   91
    1    H    GLU  99           H        GLU  99  16.718  17.123  10.462
    2    HA   GLU  99           HA       GLU  99  18.707  18.451  11.990
    3    HB2  GLU  99           HB2      GLU  99  19.182  17.163   9.920
    4    HB3  GLU  99           HB3      GLU  99  18.374  18.420   8.980
    5    HG2  GLU  99           HG2      GLU  99  19.986  20.087   9.770
    6    HG3  GLU  99           HG3      GLU  99  20.763  18.883  10.792

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LYS 100           H        LYS 100  16.183  19.619   9.776
    2    HA   LYS 100           HA       LYS 100  16.986  22.354   9.920
    3    HB2  LYS 100           HB2      LYS 100  14.350  21.071   9.167
    4    HB3  LYS 100           HB3      LYS 100  14.653  22.809   9.076
    5    HG2  LYS 100           HG2      LYS 100  16.624  22.356   7.608
    6    HG3  LYS 100           HG3      LYS 100  16.207  20.640   7.626
    7    HD2  LYS 100           HD2      LYS 100  14.012  21.154   6.627
    8    HD3  LYS 100           HD3      LYS 100  14.412  22.873   6.617
    9    HE2  LYS 100           HE2      LYS 100  16.369  22.388   5.156
   10    HE3  LYS 100           HE3      LYS 100  15.900  20.685   5.122
   11    HZ1  LYS 100           HZ1      LYS 100  14.079  22.882   4.289
   12    HZ3  LYS 100           HZ2      LYS 100  13.891  21.213   4.027
   13    HZ2  LYS 100           HZ3      LYS 100  15.103  22.072   3.205

  No H/Q in entry =          13
  In of MODEL   91
    1    H    LEU 101           H        LEU 101  14.886  20.312  11.886
    2    HA   LEU 101           HA       LEU 101  13.726  22.382  13.466
    3    HB2  LEU 101           HB2      LEU 101  14.161  19.431  13.848
    4    HB3  LEU 101           HB3      LEU 101  13.629  20.412  15.210
    5    HG   LEU 101           HG       LEU 101  12.209  20.505  12.542
    6   HD12  LEU 101          HD11      LEU 101  10.547  18.944  13.812
    7   HD11  LEU 101          HD12      LEU 101  11.941  18.528  14.805
    8   HD13  LEU 101          HD13      LEU 101  11.973  18.222  13.068
    9   HD21  LEU 101          HD21      LEU 101  11.556  21.298  15.395
   10   HD23  LEU 101          HD22      LEU 101  10.293  21.076  14.186
   11   HD22  LEU 101          HD23      LEU 101  11.531  22.308  13.947

  No H/Q in entry =          11
  In of MODEL   91
    1    H    LYS 102           H        LYS 102  16.871  21.767  13.027
    2    HA   LYS 102           HA       LYS 102  18.721  22.633  14.098
    3    HB2  LYS 102           HB2      LYS 102  16.911  24.152  15.233
    4    HB3  LYS 102           HB3      LYS 102  17.117  23.089  16.610
    5    HG2  LYS 102           HG2      LYS 102  19.014  25.095  15.440
    6    HG3  LYS 102           HG3      LYS 102  18.632  24.781  17.119
    7    HD2  LYS 102           HD2      LYS 102  20.293  22.866  15.431
    8    HD3  LYS 102           HD3      LYS 102  20.987  24.186  16.364
    9    HE2  LYS 102           HE2      LYS 102  20.583  21.637  17.332
   10    HE3  LYS 102           HE3      LYS 102  20.806  23.078  18.323
   11    HZ2  LYS 102           HZ1      LYS 102  18.835  21.799  18.942
   12    HZ1  LYS 102           HZ2      LYS 102  18.190  22.031  17.394
   13    HZ3  LYS 102           HZ3      LYS 102  18.424  23.360  18.420

  No H/Q in entry =          13
  In of MODEL   91
    1    H    ALA 103           H        ALA 103  16.647  21.032  16.521
    2    HA   ALA 103           HA       ALA 103  18.372  19.816  18.174
    3    HB2  ALA 103           HB1      ALA 103  16.783  17.813  18.169
    4    HB1  ALA 103           HB2      ALA 103  15.889  18.669  16.912
    5    HB3  ALA 103           HB3      ALA 103  16.070  19.389  18.511

  No H/Q in entry =           5
  In of MODEL   91
    1    H1   ALA   1           H3       ALA   1  -1.657  -6.970 -21.441
    2    H2   ALA   1           H2       ALA   1  -2.455  -8.403 -20.988
    3    H3   ALA   1           H1       ALA   1  -0.848  -8.458 -21.544
    4    HA   ALA   1           HA       ALA   1  -1.685  -8.924 -23.540
    5    HB1  ALA   1           HB1      ALA   1  -3.824  -9.636 -23.066
    6    HB2  ALA   1           HB2      ALA   1  -4.259  -8.123 -23.862
    7    HB3  ALA   1           HB3      ALA   1  -4.197  -8.205 -22.103

  No H/Q in entry =           7
  In of MODEL   91
    1    H    GLU   2           H        GLU   2  -2.513  -7.730 -25.528
    2    HA   GLU   2           HA       GLU   2  -1.108  -5.720 -26.406
    3    HB2  GLU   2           HB2      GLU   2  -4.116  -5.777 -26.722
    4    HB3  GLU   2           HB3      GLU   2  -2.993  -4.917 -27.771
    5    HG2  GLU   2           HG2      GLU   2  -2.497  -6.808 -28.928
    6    HG3  GLU   2           HG3      GLU   2  -2.201  -7.715 -27.451

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLU   3           H        GLU   3  -4.264  -4.454 -25.503
    2    HA   GLU   3           HA       GLU   3  -3.210  -1.901 -24.874
    3    HB2  GLU   3           HB2      GLU   3  -5.901  -3.208 -24.541
    4    HB3  GLU   3           HB3      GLU   3  -5.598  -1.594 -23.894
    5    HG2  GLU   3           HG2      GLU   3  -5.240  -0.667 -26.020
    6    HG3  GLU   3           HG3      GLU   3  -4.851  -2.223 -26.745

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LEU   4           H        LEU   4  -4.806  -4.256 -22.695
    2    HA   LEU   4           HA       LEU   4  -4.437  -3.031 -20.303
    3    HB2  LEU   4           HB2      LEU   4  -3.903  -5.974 -20.775
    4    HB3  LEU   4           HB3      LEU   4  -4.305  -5.227 -19.230
    5    HG   LEU   4           HG       LEU   4  -6.080  -5.294 -21.693
    6   HD13  LEU   4          HD11      LEU   4  -7.278  -7.008 -20.696
    7   HD12  LEU   4          HD12      LEU   4  -6.790  -6.551 -19.064
    8   HD11  LEU   4          HD13      LEU   4  -5.658  -7.397 -20.117
    9   HD23  LEU   4          HD21      LEU   4  -7.761  -4.478 -19.824
   10   HD22  LEU   4          HD22      LEU   4  -6.719  -3.310 -20.634
   11   HD21  LEU   4          HD23      LEU   4  -6.294  -3.902 -19.029

  No H/Q in entry =          11
  In of MODEL   91
    1    H    GLU   5           H        GLU   5  -1.945  -4.880 -22.036
    2    HA   GLU   5           HA       GLU   5   0.041  -4.604 -20.001
    3    HB2  GLU   5           HB2      GLU   5   0.095  -6.379 -21.743
    4    HB3  GLU   5           HB3      GLU   5   0.433  -5.141 -22.953
    5    HG2  GLU   5           HG2      GLU   5   2.535  -4.610 -21.981
    6    HG3  GLU   5           HG3      GLU   5   2.152  -5.466 -20.490

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLU   6           H        GLU   6  -0.591  -2.887 -23.044
    2    HA   GLU   6           HA       GLU   6   1.585  -1.062 -22.776
    3    HB2  GLU   6           HB2      GLU   6   0.121  -1.707 -24.860
    4    HB3  GLU   6           HB3      GLU   6  -0.919  -0.402 -24.292
    5    HG2  GLU   6           HG2      GLU   6   0.815   1.216 -24.515
    6    HG3  GLU   6           HG3      GLU   6   2.059  -0.021 -24.687

  No H/Q in entry =           6
  In of MODEL   91
    1    H    VAL   7           H        VAL   7  -1.753  -1.124 -21.729
    2    HA   VAL   7           HA       VAL   7  -1.966   1.589 -20.891
    3    HB   VAL   7           HB       VAL   7  -3.435  -0.924 -20.056
    4   HG11  VAL   7          HG11      VAL   7  -3.801   1.965 -19.239
    5   HG13  VAL   7          HG12      VAL   7  -3.705   0.539 -18.205
    6   HG12  VAL   7          HG13      VAL   7  -5.137   0.814 -19.197
    7   HG21  VAL   7          HG21      VAL   7  -3.590   0.154 -22.443
    8   HG23  VAL   7          HG22      VAL   7  -4.531   1.405 -21.630
    9   HG22  VAL   7          HG23      VAL   7  -5.082  -0.271 -21.604

  No H/Q in entry =           9
  In of MODEL   91
    1    H    VAL   8           H        VAL   8  -0.987  -1.400 -19.250
    2    HA   VAL   8           HA       VAL   8  -0.663  -0.323 -16.654
    3    HB   VAL   8           HB       VAL   8   0.667  -2.656 -18.054
    4   HG12  VAL   8          HG11      VAL   8   0.915  -3.133 -15.343
    5   HG11  VAL   8          HG12      VAL   8   1.246  -1.406 -15.442
    6   HG13  VAL   8          HG13      VAL   8   2.208  -2.543 -16.385
    7   HG23  VAL   8          HG21      VAL   8  -1.106  -3.206 -15.782
    8   HG22  VAL   8          HG22      VAL   8  -1.160  -3.850 -17.420
    9   HG21  VAL   8          HG23      VAL   8  -1.937  -2.312 -17.055

  No H/Q in entry =           9
  In of MODEL   91
    1    H    MET   9           H        MET   9   1.583  -0.630 -19.403
    2    HA   MET   9           HA       MET   9   3.873   0.405 -18.143
    3    HB2  MET   9           HB2      MET   9   2.886   0.442 -21.001
    4    HB3  MET   9           HB3      MET   9   4.431   1.165 -20.549
    5    HG2  MET   9           HG2      MET   9   5.269  -0.938 -19.739
    6    HG3  MET   9           HG3      MET   9   3.679  -1.689 -19.874
    7    HE1  MET   9           HE1      MET   9   6.486   0.096 -21.492
    8    HE3  MET   9           HE2      MET   9   5.359   0.785 -22.658
    9    HE2  MET   9           HE3      MET   9   6.542  -0.409 -23.186

  No H/Q in entry =           9
  In of MODEL   91
    1    H    GLY  10           H        GLY  10   1.194   2.018 -19.817
    2    HA3  GLY  10           HA2      GLY  10   2.167   4.668 -19.572
    3    HA2  GLY  10           HA3      GLY  10   0.476   4.214 -19.775

  No H/Q in entry =           3
  In of MODEL   91
    1    H    LEU  11           H        LEU  11   0.073   2.687 -17.490
    2    HA   LEU  11           HA       LEU  11  -0.448   4.664 -15.528
    3    HB2  LEU  11           HB2      LEU  11  -0.393   1.648 -15.375
    4    HB3  LEU  11           HB3      LEU  11  -0.896   2.672 -14.031
    5    HG   LEU  11           HG       LEU  11  -2.137   2.793 -16.793
    6   HD13  LEU  11          HD11      LEU  11  -2.729   0.652 -16.039
    7   HD12  LEU  11          HD12      LEU  11  -4.075   1.649 -15.491
    8   HD11  LEU  11          HD13      LEU  11  -2.820   1.163 -14.353
    9   HD22  LEU  11          HD21      LEU  11  -2.719   4.811 -15.784
   10   HD21  LEU  11          HD22      LEU  11  -2.645   4.143 -14.154
   11   HD23  LEU  11          HD23      LEU  11  -4.023   3.784 -15.195

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  12           H        ILE  12   2.084   2.187 -15.776
    2    HA   ILE  12           HA       ILE  12   3.295   2.718 -13.273
    3    HB   ILE  12           HB       ILE  12   4.478   1.688 -15.887
    4   HG12  ILE  12          HG12      ILE  12   2.652   0.295 -14.858
    5   HG13  ILE  12          HG13      ILE  12   4.187  -0.537 -14.990
    6   HG21  ILE  12          HG21      ILE  12   5.631   1.630 -13.089
    7   HG23  ILE  12          HG22      ILE  12   6.268   2.522 -14.471
    8   HG22  ILE  12          HG23      ILE  12   6.295   0.760 -14.471
    9   HD11  ILE  12          HD11      ILE  12   4.497   0.346 -12.522
   10   HD13  ILE  12          HD12      ILE  12   3.541  -1.091 -12.841
   11   HD12  ILE  12          HD13      ILE  12   2.745   0.455 -12.578

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  13           H        ILE  13   3.898   3.981 -16.529
    2    HA   ILE  13           HA       ILE  13   6.044   5.691 -15.806
    3    HB   ILE  13           HB       ILE  13   4.019   5.823 -18.055
    4   HG12  ILE  13          HG12      ILE  13   5.831   3.929 -17.772
    5   HG13  ILE  13          HG13      ILE  13   5.587   4.676 -19.348
    6   HG22  ILE  13          HG21      ILE  13   5.743   7.380 -19.094
    7   HG21  ILE  13          HG22      ILE  13   6.467   7.508 -17.491
    8   HG23  ILE  13          HG23      ILE  13   4.814   8.060 -17.758
    9   HD11  ILE  13          HD11      ILE  13   7.661   5.677 -17.382
   10   HD13  ILE  13          HD12      ILE  13   7.521   6.059 -19.097
   11   HD12  ILE  13          HD13      ILE  13   8.014   4.444 -18.591

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ASN  14           H        ASN  14   2.539   6.202 -16.069
    2    HA   ASN  14           HA       ASN  14   2.509   8.947 -15.430
    3    HB2  ASN  14           HB2      ASN  14   0.608   7.314 -16.259
    4    HB3  ASN  14           HB3      ASN  14   0.288   7.136 -14.538
    5   HD21  ASN  14          HD21      ASN  14  -1.729   8.302 -15.967
    6   HD22  ASN  14          HD22      ASN  14  -1.783   9.975 -15.698

  No H/Q in entry =           6
  In of MODEL   91
    1    H    SER  15           H        SER  15   2.204   6.070 -13.355
    2    HA   SER  15           HA       SER  15   1.907   7.440 -10.905
    3    HB2  SER  15           HB2      SER  15   2.398   5.361  -9.856
    4    HB3  SER  15           HB3      SER  15   1.616   4.932 -11.374
    5    HG   SER  15           HG       SER  15   3.385   3.744 -11.496

  No H/Q in entry =           5
  In of MODEL   91
    1    H    GLY  16           H        GLY  16   4.775   6.332 -12.669
    2    HA3  GLY  16           HA2      GLY  16   6.706   7.080 -10.740
    3    HA2  GLY  16           HA3      GLY  16   7.006   6.877 -12.464

  No H/Q in entry =           3
  In of MODEL   91
    1    H    GLN  17           H        GLN  17   5.323   8.842 -13.523
    2    HA   GLN  17           HA       GLN  17   6.909  11.178 -13.216
    3    HB2  GLN  17           HB2      GLN  17   5.374  10.475 -15.187
    4    HB3  GLN  17           HB3      GLN  17   4.073  11.202 -14.248
    5    HG2  GLN  17           HG2      GLN  17   4.866  13.345 -14.538
    6    HG3  GLN  17           HG3      GLN  17   6.550  12.838 -14.608
    7   HE21  GLN  17          HE21      GLN  17   6.667  14.250 -16.599
    8   HE22  GLN  17          HE22      GLN  17   6.129  13.615 -18.078

  No H/Q in entry =           8
  In of MODEL   91
    1    H    ALA  18           H        ALA  18   3.807  10.170 -11.863
    2    HA   ALA  18           HA       ALA  18   3.092  12.560 -10.595
    3    HB1  ALA  18           HB1      ALA  18   1.954  10.107 -10.817
    4    HB2  ALA  18           HB2      ALA  18   1.411  11.328  -9.669
    5    HB3  ALA  18           HB3      ALA  18   2.498  10.042  -9.141

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ARG  19           H        ARG  19   4.959   9.790  -9.320
    2    HA   ARG  19           HA       ARG  19   5.498  10.944  -6.798
    3    HB2  ARG  19           HB2      ARG  19   5.904   8.540  -7.327
    4    HB3  ARG  19           HB3      ARG  19   7.260   9.023  -8.350
    5    HG2  ARG  19           HG2      ARG  19   8.385  10.058  -6.428
    6    HG3  ARG  19           HG3      ARG  19   7.010   9.673  -5.395
    7    HD2  ARG  19           HD2      ARG  19   8.767   8.033  -5.041
    8    HD3  ARG  19           HD3      ARG  19   7.390   7.255  -5.825
    9    HE   ARG  19           HE       ARG  19   9.094   8.071  -7.874
   10   HH21  ARG  19          HH11      ARG  19  10.649   6.662  -8.727
   11   HH22  ARG  19          HH12      ARG  19  11.192   5.312  -7.793
   12   HH11  ARG  19          HH21      ARG  19   9.164   6.038  -5.097
   13   HH12  ARG  19          HH22      ARG  19  10.348   4.958  -5.737

  No H/Q in entry =          13
  In of MODEL   91
    1    H    SER  20           H        SER  20   7.311  10.971  -9.849
    2    HA   SER  20           HA       SER  20   9.561  12.380  -9.027
    3    HB2  SER  20           HB2      SER  20   9.590  11.507 -11.231
    4    HB3  SER  20           HB3      SER  20   8.090  12.324 -11.657
    5    HG   SER  20           HG       SER  20  10.490  13.656 -10.934

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LEU  21           H        LEU  21   6.463  13.658 -10.219
    2    HA   LEU  21           HA       LEU  21   7.141  16.402  -9.994
    3    HB2  LEU  21           HB2      LEU  21   4.481  14.961  -9.895
    4    HB3  LEU  21           HB3      LEU  21   4.628  16.718  -9.902
    5    HG   LEU  21           HG       LEU  21   5.871  14.955 -12.028
    6   HD12  LEU  21          HD11      LEU  21   3.411  16.562 -12.583
    7   HD11  LEU  21          HD12      LEU  21   3.207  15.032 -11.732
    8   HD13  LEU  21          HD13      LEU  21   3.962  15.060 -13.323
    9   HD21  LEU  21          HD21      LEU  21   5.987  17.784 -11.393
   10   HD23  LEU  21          HD22      LEU  21   5.235  17.565 -12.971
   11   HD22  LEU  21          HD23      LEU  21   6.835  16.898 -12.659

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ALA  22           H        ALA  22   5.627  14.114  -7.745
    2    HA   ALA  22           HA       ALA  22   5.029  15.921  -5.676
    3    HB3  ALA  22           HB1      ALA  22   4.264  13.530  -5.840
    4    HB2  ALA  22           HB2      ALA  22   4.855  14.000  -4.246
    5    HB1  ALA  22           HB3      ALA  22   5.875  13.041  -5.319

  No H/Q in entry =           5
  In of MODEL   91
    1    H    TYR  23           H        TYR  23   7.960  13.891  -6.120
    2    HA   TYR  23           HA       TYR  23   9.347  14.907  -3.868
    3    HB2  TYR  23           HB2      TYR  23  10.134  12.900  -5.022
    4    HB3  TYR  23           HB3      TYR  23  10.438  13.833  -6.488
    5    HD1  TYR  23           HD1      TYR  23  11.422  13.513  -2.900
    6    HD2  TYR  23           HD2      TYR  23  12.471  15.005  -6.789
    7    HE1  TYR  23           HE1      TYR  23  13.684  14.097  -2.066
    8    HE2  TYR  23           HE2      TYR  23  14.732  15.589  -5.955
    9    HH   TYR  23           HH       TYR  23  15.705  14.846  -2.608

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ALA  24           H        ALA  24   9.161  16.016  -7.234
    2    HA   ALA  24           HA       ALA  24  11.059  18.099  -6.989
    3    HB2  ALA  24           HB1      ALA  24  10.614  18.163  -9.197
    4    HB3  ALA  24           HB2      ALA  24   9.060  18.914  -8.835
    5    HB1  ALA  24           HB3      ALA  24   9.183  17.161  -8.966

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ALA  25           H        ALA  25   7.581  17.917  -6.363
    2    HA   ALA  25           HA       ALA  25   7.103  20.635  -5.792
    3    HB1  ALA  25           HB1      ALA  25   5.441  18.638  -5.992
    4    HB2  ALA  25           HB2      ALA  25   5.075  19.926  -4.842
    5    HB3  ALA  25           HB3      ALA  25   5.765  18.404  -4.273

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LEU  26           H        LEU  26   8.173  17.954  -3.745
    2    HA   LEU  26           HA       LEU  26   8.282  19.383  -1.307
    3    HB2  LEU  26           HB2      LEU  26   8.377  16.967  -1.303
    4    HB3  LEU  26           HB3      LEU  26   9.846  16.975  -2.276
    5    HG   LEU  26           HG       LEU  26  11.063  18.092  -0.437
    6   HD12  LEU  26          HD11      LEU  26   9.840  18.098   1.825
    7   HD11  LEU  26          HD12      LEU  26   8.351  17.961   0.892
    8   HD13  LEU  26          HD13      LEU  26   9.395  19.367   0.683
    9   HD21  LEU  26          HD21      LEU  26   9.530  15.623   0.437
   10   HD23  LEU  26          HD22      LEU  26  11.047  16.185   1.133
   11   HD22  LEU  26          HD23      LEU  26  10.999  15.627  -0.537

  No H/Q in entry =          11
  In of MODEL   91
    1    H    LYS  27           H        LYS  27  10.695  18.812  -3.835
    2    HA   LYS  27           HA       LYS  27  12.880  20.053  -2.610
    3    HB2  LYS  27           HB2      LYS  27  12.979  18.706  -4.700
    4    HB3  LYS  27           HB3      LYS  27  12.212  20.038  -5.564
    5    HG2  LYS  27           HG2      LYS  27  14.078  21.524  -4.988
    6    HG3  LYS  27           HG3      LYS  27  14.840  20.231  -4.054
    7    HD2  LYS  27           HD2      LYS  27  14.981  18.845  -6.108
    8    HD3  LYS  27           HD3      LYS  27  14.264  20.163  -7.035
    9    HE2  LYS  27           HE2      LYS  27  16.151  21.630  -6.424
   10    HE3  LYS  27           HE3      LYS  27  16.872  20.316  -5.489
   11    HZ3  LYS  27           HZ1      LYS  27  17.859  20.417  -7.676
   12    HZ2  LYS  27           HZ2      LYS  27  16.332  20.298  -8.415
   13    HZ1  LYS  27           HZ3      LYS  27  16.957  18.988  -7.532

  No H/Q in entry =          13
  In of MODEL   91
    1    H    GLN  28           H        GLN  28  10.255  21.434  -4.554
    2    HA   GLN  28           HA       GLN  28  11.212  24.087  -4.707
    3    HB2  GLN  28           HB2      GLN  28   8.383  23.006  -4.599
    4    HB3  GLN  28           HB3      GLN  28   8.786  24.684  -4.961
    5    HG2  GLN  28           HG2      GLN  28   9.820  22.300  -6.521
    6    HG3  GLN  28           HG3      GLN  28   8.455  23.299  -7.016
    7   HE21  GLN  28          HE21      GLN  28  11.607  22.899  -7.759
    8   HE22  GLN  28          HE22      GLN  28  12.043  24.499  -8.123

  No H/Q in entry =           8
  In of MODEL   91
    1    H    ALA  29           H        ALA  29   9.285  22.393  -2.269
    2    HA   ALA  29           HA       ALA  29   8.736  24.583  -0.585
    3    HB2  ALA  29           HB1      ALA  29   8.011  23.013   0.983
    4    HB1  ALA  29           HB2      ALA  29   9.232  21.831   0.516
    5    HB3  ALA  29           HB3      ALA  29   7.845  22.123  -0.530

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LYS  30           H        LYS  30  11.468  22.319  -0.660
    2    HA   LYS  30           HA       LYS  30  12.789  23.273   1.641
    3    HB2  LYS  30           HB2      LYS  30  13.883  21.989  -0.871
    4    HB3  LYS  30           HB3      LYS  30  14.867  22.349   0.549
    5    HG2  LYS  30           HG2      LYS  30  13.317  20.964   1.930
    6    HG3  LYS  30           HG3      LYS  30  12.430  20.542   0.462
    7    HD2  LYS  30           HD2      LYS  30  14.475  19.558  -0.503
    8    HD3  LYS  30           HD3      LYS  30  15.381  19.994   0.948
    9    HE2  LYS  30           HE2      LYS  30  13.879  18.561   2.304
   10    HE3  LYS  30           HE3      LYS  30  13.004  18.105   0.837
   11    HZ2  LYS  30           HZ1      LYS  30  14.798  16.528   1.595
   12    HZ1  LYS  30           HZ2      LYS  30  15.933  17.717   1.142
   13    HZ3  LYS  30           HZ3      LYS  30  14.897  17.032  -0.021

  No H/Q in entry =          13
  In of MODEL   91
    1    H    GLN  31           H        GLN  31  12.673  24.479  -1.655
    2    HA   GLN  31           HA       GLN  31  14.825  26.375  -1.235
    3    HB2  GLN  31           HB2      GLN  31  12.778  26.420  -3.457
    4    HB3  GLN  31           HB3      GLN  31  14.397  27.118  -3.460
    5    HG2  GLN  31           HG2      GLN  31  14.864  24.422  -2.886
    6    HG3  GLN  31           HG3      GLN  31  13.558  24.367  -4.063
    7   HE21  GLN  31          HE21      GLN  31  16.402  23.577  -4.472
    8   HE22  GLN  31          HE22      GLN  31  16.971  24.552  -5.738

  No H/Q in entry =           8
  In of MODEL   91
    1    H    GLY  32           H        GLY  32  11.752  26.188  -0.085
    2    HA3  GLY  32           HA2      GLY  32  10.596  27.755   1.190
    3    HA2  GLY  32           HA3      GLY  32  11.719  28.992   0.639

  No H/Q in entry =           3
  In of MODEL   91
    1    H    ASP  33           H        ASP  33  10.353  27.087  -1.852
    2    HA   ASP  33           HA       ASP  33   8.685  29.358  -2.704
    3    HB2  ASP  33           HB2      ASP  33   9.779  26.941  -4.149
    4    HB3  ASP  33           HB3      ASP  33   8.625  28.055  -4.877

  No H/Q in entry =           4
  In of MODEL   91
    1    H    PHE  34           H        PHE  34   6.999  28.880  -1.138
    2    HA   PHE  34           HA       PHE  34   5.623  26.406  -1.041
    3    HB2  PHE  34           HB2      PHE  34   4.660  29.192  -0.359
    4    HB3  PHE  34           HB3      PHE  34   3.813  27.700   0.053
    5    HD1  PHE  34           HD1      PHE  34   6.062  30.100   1.265
    6    HD2  PHE  34           HD2      PHE  34   5.387  25.859   1.211
    7    HE1  PHE  34           HE1      PHE  34   7.456  29.851   3.300
    8    HE2  PHE  34           HE2      PHE  34   6.783  25.613   3.243
    9    HZ   PHE  34           HZ       PHE  34   7.812  27.610   4.287

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ALA  35           H        ALA  35   5.186  29.270  -3.050
    2    HA   ALA  35           HA       ALA  35   2.634  28.653  -4.072
    3    HB3  ALA  35           HB1      ALA  35   3.681  30.047  -6.110
    4    HB2  ALA  35           HB2      ALA  35   4.900  30.410  -4.888
    5    HB1  ALA  35           HB3      ALA  35   3.209  30.816  -4.595

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ALA  36           H        ALA  36   5.861  27.984  -5.431
    2    HA   ALA  36           HA       ALA  36   4.871  26.555  -7.674
    3    HB3  ALA  36           HB1      ALA  36   7.028  26.683  -8.293
    4    HB2  ALA  36           HB2      ALA  36   7.513  25.654  -6.944
    5    HB1  ALA  36           HB3      ALA  36   7.406  27.401  -6.727

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ALA  37           H        ALA  37   5.833  25.560  -4.421
    2    HA   ALA  37           HA       ALA  37   5.777  22.772  -4.851
    3    HB2  ALA  37           HB1      ALA  37   5.518  24.562  -2.472
    4    HB1  ALA  37           HB2      ALA  37   6.652  23.246  -2.766
    5    HB3  ALA  37           HB3      ALA  37   4.992  22.890  -2.293

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LYS  38           H        LYS  38   3.243  24.976  -3.678
    2    HA   LYS  38           HA       LYS  38   1.147  23.160  -3.453
    3    HB2  LYS  38           HB2      LYS  38   1.495  25.917  -3.201
    4    HB3  LYS  38           HB3      LYS  38   0.294  25.769  -4.479
    5    HG2  LYS  38           HG2      LYS  38  -1.152  24.442  -3.034
    6    HG3  LYS  38           HG3      LYS  38   0.095  24.383  -1.780
    7    HD2  LYS  38           HD2      LYS  38  -0.094  26.720  -1.331
    8    HD3  LYS  38           HD3      LYS  38  -1.009  27.008  -2.812
    9    HE2  LYS  38           HE2      LYS  38  -2.509  27.039  -0.870
   10    HE3  LYS  38           HE3      LYS  38  -2.883  25.663  -1.912
   11    HZ3  LYS  38           HZ1      LYS  38  -2.153  24.192  -0.381
   12    HZ2  LYS  38           HZ2      LYS  38  -2.504  25.449   0.709
   13    HZ1  LYS  38           HZ3      LYS  38  -0.909  25.200   0.182

  No H/Q in entry =          13
  In of MODEL   91
    1    H    ALA  39           H        ALA  39   2.119  25.065  -6.303
    2    HA   ALA  39           HA       ALA  39   0.042  24.196  -8.003
    3    HB2  ALA  39           HB1      ALA  39   2.776  24.848  -9.060
    4    HB1  ALA  39           HB2      ALA  39   1.809  26.108  -8.293
    5    HB3  ALA  39           HB3      ALA  39   1.195  25.271  -9.719

  No H/Q in entry =           5
  In of MODEL   91
    1    H    MET  40           H        MET  40   3.283  22.901  -7.429
    2    HA   MET  40           HA       MET  40   3.185  20.882  -9.421
    3    HB2  MET  40           HB2      MET  40   4.800  21.107  -6.875
    4    HB3  MET  40           HB3      MET  40   5.051  19.852  -8.090
    5    HG2  MET  40           HG2      MET  40   5.103  22.808  -8.754
    6    HG3  MET  40           HG3      MET  40   6.551  21.908  -8.308
    7    HE3  MET  40           HE1      MET  40   7.423  19.695 -11.119
    8    HE2  MET  40           HE2      MET  40   6.862  19.374  -9.480
    9    HE1  MET  40           HE3      MET  40   7.955  20.723  -9.781

  No H/Q in entry =           9
  In of MODEL   91
    1    H    MET  41           H        MET  41   2.275  20.921  -5.996
    2    HA   MET  41           HA       MET  41   1.748  18.156  -5.718
    3    HB2  MET  41           HB2      MET  41   0.413  20.510  -4.364
    4    HB3  MET  41           HB3      MET  41   0.261  18.832  -3.857
    5    HG2  MET  41           HG2      MET  41   2.971  19.060  -3.898
    6    HG3  MET  41           HG3      MET  41   2.528  20.717  -3.501
    7    HE2  MET  41           HE1      MET  41  -0.506  19.458  -1.771
    8    HE1  MET  41           HE2      MET  41   0.307  20.973  -2.149
    9    HE3  MET  41           HE3      MET  41   0.252  20.401  -0.481

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ASP  42           H        ASP  42  -0.297  20.877  -6.688
    2    HA   ASP  42           HA       ASP  42  -2.735  19.512  -6.821
    3    HB2  ASP  42           HB2      ASP  42  -2.034  22.084  -7.078
    4    HB3  ASP  42           HB3      ASP  42  -2.186  21.689  -8.786

  No H/Q in entry =           4
  In of MODEL   91
    1    H    GLN  43           H        GLN  43  -0.299  20.109  -9.327
    2    HA   GLN  43           HA       GLN  43  -1.687  18.788 -11.415
    3    HB2  GLN  43           HB2      GLN  43   1.271  19.309 -11.037
    4    HB3  GLN  43           HB3      GLN  43   0.556  18.669 -12.519
    5    HG2  GLN  43           HG2      GLN  43  -0.960  20.693 -12.557
    6    HG3  GLN  43           HG3      GLN  43  -0.006  21.350 -11.230
    7   HE21  GLN  43          HE21      GLN  43   0.149  22.972 -13.316
    8   HE22  GLN  43          HE22      GLN  43   1.563  22.754 -14.225

  No H/Q in entry =           8
  In of MODEL   91
    1    H    SER  44           H        SER  44   0.669  17.651  -9.028
    2    HA   SER  44           HA       SER  44   1.008  15.046 -10.055
    3    HB2  SER  44           HB2      SER  44   1.903  16.485  -7.819
    4    HB3  SER  44           HB3      SER  44   1.045  15.100  -7.148
    5    HG   SER  44           HG       SER  44   3.156  14.484  -7.578

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ARG  45           H        ARG  45  -1.311  16.358  -7.713
    2    HA   ARG  45           HA       ARG  45  -2.691  13.994  -7.077
    3    HB2  ARG  45           HB2      ARG  45  -2.892  16.160  -5.884
    4    HB3  ARG  45           HB3      ARG  45  -3.751  16.825  -7.269
    5    HG2  ARG  45           HG2      ARG  45  -5.513  15.095  -6.984
    6    HG3  ARG  45           HG3      ARG  45  -4.665  14.485  -5.562
    7    HD2  ARG  45           HD2      ARG  45  -4.875  16.750  -4.505
    8    HD3  ARG  45           HD3      ARG  45  -5.865  17.269  -5.886
    9    HE   ARG  45           HE       ARG  45  -6.968  14.890  -4.845
   10   HH21  ARG  45          HH11      ARG  45  -8.802  14.960  -3.571
   11   HH22  ARG  45          HH12      ARG  45  -9.199  16.398  -2.701
   12   HH11  ARG  45          HH21      ARG  45  -6.429  18.137  -3.820
   13   HH12  ARG  45          HH22      ARG  45  -7.850  18.197  -2.841

  No H/Q in entry =          13
  In of MODEL   91
    1    H    MET  46           H        MET  46  -3.285  16.398  -9.625
    2    HA   MET  46           HA       MET  46  -5.623  15.220 -10.684
    3    HB2  MET  46           HB2      MET  46  -3.520  16.961 -11.994
    4    HB3  MET  46           HB3      MET  46  -5.061  16.538 -12.745
    5    HG2  MET  46           HG2      MET  46  -6.295  17.612 -10.965
    6    HG3  MET  46           HG3      MET  46  -4.825  17.871 -10.037
    7    HE1  MET  46           HE1      MET  46  -7.025  18.600 -12.847
    8    HE3  MET  46           HE2      MET  46  -5.781  18.826 -14.069
    9    HE2  MET  46           HE3      MET  46  -6.626  20.223 -13.409

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ALA  47           H        ALA  47  -2.194  14.750 -11.447
    2    HA   ALA  47           HA       ALA  47  -2.538  13.023 -13.658
    3    HB3  ALA  47           HB1      ALA  47  -0.362  13.918 -13.309
    4    HB2  ALA  47           HB2      ALA  47  -0.216  12.190 -12.976
    5    HB1  ALA  47           HB3      ALA  47  -0.310  13.341 -11.642

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LEU  48           H        LEU  48  -2.262  12.386 -10.185
    2    HA   LEU  48           HA       LEU  48  -2.348   9.546 -10.344
    3    HB2  LEU  48           HB2      LEU  48  -3.114  11.461  -8.129
    4    HB3  LEU  48           HB3      LEU  48  -3.015   9.711  -7.929
    5    HG   LEU  48           HG       LEU  48  -0.723  11.417  -8.929
    6   HD13  LEU  48          HD11      LEU  48  -1.004  12.185  -6.737
    7   HD12  LEU  48          HD12      LEU  48   0.163  10.881  -6.541
    8   HD11  LEU  48          HD13      LEU  48  -1.534  10.613  -6.141
    9   HD22  LEU  48          HD21      LEU  48  -0.218   9.233  -9.571
   10   HD21  LEU  48          HD22      LEU  48  -1.084   8.515  -8.214
   11   HD23  LEU  48          HD23      LEU  48   0.487   9.272  -7.956

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ASN  49           H        ASN  49  -4.818  12.031  -9.938
    2    HA   ASN  49           HA       ASN  49  -6.998  10.360  -9.397
    3    HB2  ASN  49           HB2      ASN  49  -7.100  12.795  -9.110
    4    HB3  ASN  49           HB3      ASN  49  -6.959  13.017 -10.853
    5   HD21  ASN  49          HD21      ASN  49  -9.251  13.860  -9.194
    6   HD22  ASN  49          HD22      ASN  49 -10.599  13.007  -9.772

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLU  50           H        GLU  50  -5.726  11.562 -12.485
    2    HA   GLU  50           HA       GLU  50  -7.679  10.301 -14.129
    3    HB2  GLU  50           HB2      GLU  50  -6.220  12.125 -14.944
    4    HB3  GLU  50           HB3      GLU  50  -4.822  11.057 -14.808
    5    HG2  GLU  50           HG2      GLU  50  -5.793   9.519 -16.444
    6    HG3  GLU  50           HG3      GLU  50  -7.257  10.493 -16.530

  No H/Q in entry =           6
  In of MODEL   91
    1    H    ALA  51           H        ALA  51  -4.504   9.318 -12.928
    2    HA   ALA  51           HA       ALA  51  -4.359   6.866 -14.347
    3    HB2  ALA  51           HB1      ALA  51  -2.376   6.583 -13.249
    4    HB1  ALA  51           HB2      ALA  51  -3.063   7.003 -11.681
    5    HB3  ALA  51           HB3      ALA  51  -2.613   8.276 -12.815

  No H/Q in entry =           5
  In of MODEL   91
    1    H    HIS  52           H        HIS  52  -5.531   7.693 -11.096
    2    HA   HIS  52           HA       HIS  52  -6.208   5.081 -10.265
    3    HB2  HIS  52           HB2      HIS  52  -6.074   7.035  -8.750
    4    HB3  HIS  52           HB3      HIS  52  -7.529   7.693  -9.498
    5    HD1  HIS  52           HD1      HIS  52  -9.741   6.205  -9.251
    6    HD2  HIS  52           HD2      HIS  52  -6.555   5.086  -6.808
    7    HE1  HIS  52           HE1      HIS  52 -10.703   4.682  -7.478
    8    HE2  HIS  52           HE2      HIS  52  -8.775   3.994  -5.972

  No H/Q in entry =           8
  In of MODEL   91
    1    H    LEU  53           H        LEU  53  -8.036   7.535 -12.050
    2    HA   LEU  53           HA       LEU  53 -10.539   6.236 -12.060
    3    HB2  LEU  53           HB2      LEU  53  -9.216   8.207 -13.920
    4    HB3  LEU  53           HB3      LEU  53 -10.817   7.561 -14.271
    5    HG   LEU  53           HG       LEU  53 -10.147   8.808 -11.596
    6   HD12  LEU  53          HD11      LEU  53 -11.462  10.802 -12.671
    7   HD11  LEU  53          HD12      LEU  53 -10.929  10.099 -14.199
    8   HD13  LEU  53          HD13      LEU  53  -9.740  10.631 -13.010
    9   HD21  LEU  53          HD21      LEU  53 -12.664   8.042 -13.082
   10   HD23  LEU  53          HD22      LEU  53 -12.706   9.271 -11.822
   11   HD22  LEU  53          HD23      LEU  53 -12.190   7.633 -11.434

  No H/Q in entry =          11
  In of MODEL   91
    1    H    VAL  54           H        VAL  54  -7.790   6.047 -14.300
    2    HA   VAL  54           HA       VAL  54  -9.011   4.274 -16.143
    3    HB   VAL  54           HB       VAL  54  -6.103   4.786 -15.463
    4   HG12  VAL  54          HG11      VAL  54  -5.856   3.703 -17.853
    5   HG11  VAL  54          HG12      VAL  54  -7.382   2.918 -17.448
    6   HG13  VAL  54          HG13      VAL  54  -5.965   2.667 -16.431
    7   HG22  VAL  54          HG21      VAL  54  -6.879   6.728 -16.506
    8   HG21  VAL  54          HG22      VAL  54  -8.071   5.863 -17.474
    9   HG23  VAL  54          HG23      VAL  54  -6.365   5.787 -17.906

  No H/Q in entry =           9
  In of MODEL   91
    1    H    GLN  55           H        GLN  55  -7.008   3.731 -13.245
    2    HA   GLN  55           HA       GLN  55  -6.912   0.914 -13.503
    3    HB2  GLN  55           HB2      GLN  55  -5.357   1.813 -11.985
    4    HB3  GLN  55           HB3      GLN  55  -6.575   2.776 -11.154
    5    HG2  GLN  55           HG2      GLN  55  -7.258   1.017  -9.836
    6    HG3  GLN  55           HG3      GLN  55  -7.032  -0.169 -11.115
    7   HE21  GLN  55          HE21      GLN  55  -5.405  -1.616 -10.623
    8   HE22  GLN  55          HE22      GLN  55  -4.021  -1.262  -9.712

  No H/Q in entry =           8
  In of MODEL   91
    1    H    THR  56           H        THR  56  -9.246   3.072 -11.885
    2    HA   THR  56           HA       THR  56 -10.825   1.185 -10.595
    3    HB   THR  56           HB       THR  56 -11.910   3.582 -12.100
    4    HG1  THR  56           HG1      THR  56 -10.341   3.341  -9.821
    5   HG21  THR  56          HG21      THR  56 -13.118   1.622 -10.393
    6   HG23  THR  56          HG22      THR  56 -13.858   3.066 -11.083
    7   HG22  THR  56          HG23      THR  56 -13.063   3.149  -9.513

  No H/Q in entry =           7
  In of MODEL   91
    1    H    LYS  57           H        LYS  57 -11.032   2.268 -13.981
    2    HA   LYS  57           HA       LYS  57 -13.186   0.577 -14.733
    3    HB2  LYS  57           HB2      LYS  57 -12.346   2.509 -16.083
    4    HB3  LYS  57           HB3      LYS  57 -10.923   1.548 -16.489
    5    HG2  LYS  57           HG2      LYS  57 -12.338  -0.172 -17.507
    6    HG3  LYS  57           HG3      LYS  57 -13.786   0.724 -17.049
    7    HD2  LYS  57           HD2      LYS  57 -13.047   2.624 -18.451
    8    HD3  LYS  57           HD3      LYS  57 -11.620   1.705 -18.930
    9    HE2  LYS  57           HE2      LYS  57 -13.261  -0.115 -19.712
   10    HE3  LYS  57           HE3      LYS  57 -14.515   1.117 -19.560
   11    HZ2  LYS  57           HZ1      LYS  57 -12.518   0.801 -21.578
   12    HZ1  LYS  57           HZ2      LYS  57 -12.502   2.364 -20.912
   13    HZ3  LYS  57           HZ3      LYS  57 -13.929   1.742 -21.593

  No H/Q in entry =          13
  In of MODEL   91
    1    H    LEU  58           H        LEU  58  -9.681   0.153 -14.679
    2    HA   LEU  58           HA       LEU  58  -9.685  -2.364 -15.968
    3    HB2  LEU  58           HB2      LEU  58  -7.652  -1.069 -14.161
    4    HB3  LEU  58           HB3      LEU  58  -7.389  -2.590 -15.016
    5    HG   LEU  58           HG       LEU  58  -8.149   0.014 -16.378
    6   HD11  LEU  58          HD11      LEU  58  -5.500  -1.219 -15.689
    7   HD13  LEU  58          HD12      LEU  58  -5.998   0.472 -15.640
    8   HD12  LEU  58          HD13      LEU  58  -5.658  -0.299 -17.186
    9   HD22  LEU  58          HD21      LEU  58  -8.723  -1.549 -17.969
   10   HD21  LEU  58          HD22      LEU  58  -7.679  -2.795 -17.288
   11   HD23  LEU  58          HD23      LEU  58  -6.991  -1.520 -18.294

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  59           H        ILE  59 -10.506  -1.463 -12.716
    2    HA   ILE  59           HA       ILE  59 -10.149  -4.230 -11.769
    3    HB   ILE  59           HB       ILE  59  -9.559  -2.106 -10.363
    4   HG12  ILE  59          HG12      ILE  59 -11.267  -4.208  -9.024
    5   HG13  ILE  59          HG13      ILE  59  -9.643  -4.542  -9.603
    6   HG23  ILE  59          HG21      ILE  59 -11.676  -0.924 -10.485
    7   HG22  ILE  59          HG22      ILE  59 -11.416  -1.445  -8.841
    8   HG21  ILE  59          HG23      ILE  59 -12.549  -2.313  -9.864
    9   HD11  ILE  59          HD11      ILE  59 -10.208  -2.214  -7.777
   10   HD13  ILE  59          HD12      ILE  59  -8.660  -2.985  -8.116
   11   HD12  ILE  59          HD13      ILE  59  -9.868  -3.825  -7.145

  No H/Q in entry =          11
  In of MODEL   91
    1    H    GLU  60           H        GLU  60 -12.712  -1.920 -12.576
    2    HA   GLU  60           HA       GLU  60 -14.893  -3.441 -11.561
    3    HB2  GLU  60           HB2      GLU  60 -15.123  -1.068 -12.181
    4    HB3  GLU  60           HB3      GLU  60 -14.777  -1.458 -13.863
    5    HG2  GLU  60           HG2      GLU  60 -16.827  -3.009 -13.769
    6    HG3  GLU  60           HG3      GLU  60 -17.214  -2.222 -12.243

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLY  61           H        GLY  61 -13.222  -3.422 -14.677
    2    HA3  GLY  61           HA2      GLY  61 -14.930  -5.670 -15.566
    3    HA2  GLY  61           HA3      GLY  61 -14.088  -4.564 -16.645

  No H/Q in entry =           3
  In of MODEL   91
    1    H    ASP  62           H        ASP  62 -12.698  -6.002 -13.763
    2    HA   ASP  62           HA       ASP  62 -10.374  -6.869 -15.138
    3    HB2  ASP  62           HB2      ASP  62  -9.838  -7.983 -12.975
    4    HB3  ASP  62           HB3      ASP  62 -10.265  -6.284 -12.801

  No H/Q in entry =           4
  In of MODEL   91
    1    H    ALA  63           H        ALA  63 -13.443  -8.207 -15.086
    2    HA   ALA  63           HA       ALA  63 -12.637 -10.995 -15.083
    3    HB2  ALA  63           HB1      ALA  63 -14.917  -9.974 -14.326
    4    HB3  ALA  63           HB2      ALA  63 -14.909 -11.508 -15.196
    5    HB1  ALA  63           HB3      ALA  63 -15.306 -10.015 -16.046

  No H/Q in entry =           5
  In of MODEL   91
    1    H    GLY  64           H        GLY  64 -13.505 -12.373 -16.987
    2    HA3  GLY  64           HA2      GLY  64 -14.041 -12.101 -19.460
    3    HA2  GLY  64           HA3      GLY  64 -12.589 -11.108 -19.504

  No H/Q in entry =           3
  In of MODEL   91
    1    H    GLU  65           H        GLU  65 -10.668 -12.388 -18.266
    2    HA   GLU  65           HA       GLU  65 -10.026 -14.560 -19.973
    3    HB2  GLU  65           HB2      GLU  65  -8.755 -13.584 -17.411
    4    HB3  GLU  65           HB3      GLU  65  -8.076 -14.867 -18.411
    5    HG2  GLU  65           HG2      GLU  65  -7.940 -13.344 -20.323
    6    HG3  GLU  65           HG3      GLU  65  -8.688 -12.059 -19.375

  No H/Q in entry =           6
  In of MODEL   91
    1    H    GLY  66           H        GLY  66 -11.189 -14.405 -16.633
    2    HA3  GLY  66           HA2      GLY  66 -12.184 -17.115 -16.817
    3    HA2  GLY  66           HA3      GLY  66 -10.842 -16.926 -15.692

  No H/Q in entry =           3
  In of MODEL   91
    1    H    LYS  67           H        LYS  67 -13.109 -17.784 -14.609
    2    HA   LYS  67           HA       LYS  67 -14.947 -15.785 -13.781
    3    HB2  LYS  67           HB2      LYS  67 -14.257 -18.395 -12.409
    4    HB3  LYS  67           HB3      LYS  67 -15.723 -17.447 -12.177
    5    HG2  LYS  67           HG2      LYS  67 -14.879 -18.637 -14.835
    6    HG3  LYS  67           HG3      LYS  67 -16.014 -19.406 -13.728
    7    HD2  LYS  67           HD2      LYS  67 -17.365 -17.227 -13.841
    8    HD3  LYS  67           HD3      LYS  67 -16.348 -16.798 -15.218
    9    HE2  LYS  67           HE2      LYS  67 -17.037 -18.789 -16.422
   10    HE3  LYS  67           HE3      LYS  67 -17.943 -19.366 -15.023
   11    HZ3  LYS  67           HZ1      LYS  67 -19.589 -17.856 -15.343
   12    HZ2  LYS  67           HZ2      LYS  67 -19.098 -18.044 -16.958
   13    HZ1  LYS  67           HZ3      LYS  67 -18.570 -16.704 -16.057

  No H/Q in entry =          13
  In of MODEL   91
    1    H    MET  68           H        MET  68 -13.019 -17.608 -11.466
    2    HA   MET  68           HA       MET  68 -12.958 -15.514  -9.570
    3    HB2  MET  68           HB2      MET  68 -11.573 -18.163  -9.824
    4    HB3  MET  68           HB3      MET  68 -11.160 -17.055  -8.516
    5    HG2  MET  68           HG2      MET  68 -13.988 -17.951  -9.129
    6    HG3  MET  68           HG3      MET  68 -12.959 -18.715  -7.918
    7    HE3  MET  68           HE1      MET  68 -15.581 -16.083  -8.566
    8    HE2  MET  68           HE2      MET  68 -15.916 -15.913  -6.845
    9    HE1  MET  68           HE3      MET  68 -15.784 -17.520  -7.555

  No H/Q in entry =           9
  In of MODEL   91
    1    H    LYS  69           H        LYS  69 -10.516 -16.637 -11.896
    2    HA   LYS  69           HA       LYS  69  -8.435 -15.000 -10.836
    3    HB2  LYS  69           HB2      LYS  69  -8.721 -16.443 -13.468
    4    HB3  LYS  69           HB3      LYS  69  -7.260 -15.584 -12.973
    5    HG2  LYS  69           HG2      LYS  69  -7.124 -16.975 -10.940
    6    HG3  LYS  69           HG3      LYS  69  -8.582 -17.837 -11.432
    7    HD2  LYS  69           HD2      LYS  69  -7.423 -18.569 -13.504
    8    HD3  LYS  69           HD3      LYS  69  -5.956 -17.761 -12.947
    9    HE2  LYS  69           HE2      LYS  69  -7.392 -19.938 -11.401
   10    HE3  LYS  69           HE3      LYS  69  -5.986 -20.214 -12.428
   11    HZ1  LYS  69           HZ1      LYS  69  -5.693 -18.068 -10.514
   12    HZ3  LYS  69           HZ2      LYS  69  -4.610 -19.308 -10.933
   13    HZ2  LYS  69           HZ3      LYS  69  -5.860 -19.608  -9.822

  No H/Q in entry =          13
  In of MODEL   91
    1    H    VAL  70           H        VAL  70  -7.419 -13.213 -11.726
    2    HA   VAL  70           HA       VAL  70  -9.001 -11.567 -13.602
    3    HB   VAL  70           HB       VAL  70  -8.452  -9.592 -12.213
    4   HG12  VAL  70          HG11      VAL  70 -10.004 -10.128 -10.344
    5   HG11  VAL  70          HG12      VAL  70  -9.883 -11.838 -10.761
    6   HG13  VAL  70          HG13      VAL  70 -10.613 -10.703 -11.896
    7   HG22  VAL  70          HG21      VAL  70  -7.564  -9.942  -9.941
    8   HG21  VAL  70          HG22      VAL  70  -6.421 -10.526 -11.151
    9   HG23  VAL  70          HG23      VAL  70  -7.422 -11.672 -10.258

  No H/Q in entry =           9
  In of MODEL   91
    1    H    SER  71           H        SER  71  -7.599  -9.611 -14.340
    2    HA   SER  71           HA       SER  71  -5.306 -10.577 -15.658
    3    HB2  SER  71           HB2      SER  71  -6.622  -8.567 -16.354
    4    HB3  SER  71           HB3      SER  71  -5.938  -7.692 -14.987
    5    HG   SER  71           HG       SER  71  -3.841  -8.428 -15.942

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LEU  72           H        LEU  72  -3.250 -10.833 -15.016
    2    HA   LEU  72           HA       LEU  72  -2.528 -10.616 -12.305
    3    HB2  LEU  72           HB2      LEU  72  -0.889 -11.034 -14.801
    4    HB3  LEU  72           HB3      LEU  72  -0.208 -11.103 -13.177
    5    HG   LEU  72           HG       LEU  72  -2.566 -12.782 -14.075
    6   HD12  LEU  72          HD11      LEU  72   0.321 -13.655 -13.792
    7   HD11  LEU  72          HD12      LEU  72  -0.425 -13.251 -15.338
    8   HD13  LEU  72          HD13      LEU  72  -1.031 -14.613 -14.396
    9   HD22  LEU  72          HD21      LEU  72  -2.651 -12.826 -11.757
   10   HD21  LEU  72          HD22      LEU  72  -0.921 -12.533 -11.580
   11   HD23  LEU  72          HD23      LEU  72  -1.502 -14.135 -12.031

  No H/Q in entry =          11
  In of MODEL   91
    1    H    VAL  73           H        VAL  73  -1.816  -8.600 -15.087
    2    HA   VAL  73           HA       VAL  73   0.103  -6.899 -13.985
    3    HB   VAL  73           HB       VAL  73  -0.321  -5.460 -15.835
    4   HG11  VAL  73          HG11      VAL  73  -0.964  -8.329 -16.586
    5   HG13  VAL  73          HG12      VAL  73   0.648  -7.633 -16.430
    6   HG12  VAL  73          HG13      VAL  73  -0.430  -7.082 -17.712
    7   HG22  VAL  73          HG21      VAL  73  -2.615  -5.012 -15.829
    8   HG21  VAL  73          HG22      VAL  73  -3.048  -6.717 -15.716
    9   HG23  VAL  73          HG23      VAL  73  -2.461  -6.056 -17.242

  No H/Q in entry =           9
  In of MODEL   91
    1    H    LEU  74           H        LEU  74  -3.294  -7.018 -13.425
    2    HA   LEU  74           HA       LEU  74  -3.915  -4.363 -12.814
    3    HB2  LEU  74           HB2      LEU  74  -5.597  -6.101 -13.034
    4    HB3  LEU  74           HB3      LEU  74  -4.920  -6.983 -11.671
    5    HG   LEU  74           HG       LEU  74  -5.505  -5.104 -10.177
    6   HD13  LEU  74          HD11      LEU  74  -5.513  -3.149 -11.427
    7   HD12  LEU  74          HD12      LEU  74  -7.243  -3.479 -11.354
    8   HD11  LEU  74          HD13      LEU  74  -6.325  -3.900 -12.799
    9   HD21  LEU  74          HD21      LEU  74  -7.424  -6.741 -11.715
   10   HD23  LEU  74          HD22      LEU  74  -8.149  -5.321 -10.981
   11   HD22  LEU  74          HD23      LEU  74  -7.301  -6.489  -9.975

  No H/Q in entry =          11
  In of MODEL   91
    1    H    VAL  75           H        VAL  75  -2.870  -6.947 -10.652
    2    HA   VAL  75           HA       VAL  75  -2.672  -5.395  -8.309
    3    HB   VAL  75           HB       VAL  75  -1.103  -7.854  -9.126
    4   HG11  VAL  75          HG11      VAL  75  -1.464  -6.532  -6.418
    5   HG13  VAL  75          HG12      VAL  75   0.041  -6.632  -7.331
    6   HG12  VAL  75          HG13      VAL  75  -0.697  -8.097  -6.685
    7   HG21  VAL  75          HG21      VAL  75  -3.803  -7.363  -7.954
    8   HG23  VAL  75          HG22      VAL  75  -2.869  -8.678  -7.240
    9   HG22  VAL  75          HG23      VAL  75  -3.239  -8.694  -8.963

  No H/Q in entry =           9
  In of MODEL   91
    1    H    GLU  76           H        GLU  76  -0.264  -6.154 -10.846
    2    HA   GLU  76           HA       GLU  76   1.921  -4.804  -9.690
    3    HB2  GLU  76           HB2      GLU  76   2.116  -6.281 -11.676
    4    HB3  GLU  76           HB3      GLU  76   1.210  -5.115 -12.629
    5    HG2  GLU  76           HG2      GLU  76   3.357  -4.494 -13.208
    6    HG3  GLU  76           HG3      GLU  76   3.132  -3.460 -11.806

  No H/Q in entry =           6
  In of MODEL   91
    1    H    ALA  77           H        ALA  77  -0.613  -3.606 -11.878
    2    HA   ALA  77           HA       ALA  77   0.374  -0.959 -12.055
    3    HB3  ALA  77           HB1      ALA  77  -2.222  -2.319 -12.614
    4    HB1  ALA  77           HB2      ALA  77  -1.205  -1.353 -13.682
    5    HB2  ALA  77           HB3      ALA  77  -2.233  -0.559 -12.490

  No H/Q in entry =           5
  In of MODEL   91
    1    H    GLN  78           H        GLN  78  -1.892  -2.516  -9.843
    2    HA   GLN  78           HA       GLN  78  -2.701  -0.198  -8.442
    3    HB2  GLN  78           HB2      GLN  78  -3.795  -2.475  -8.362
    4    HB3  GLN  78           HB3      GLN  78  -2.472  -3.000  -7.321
    5    HG2  GLN  78           HG2      GLN  78  -3.034  -1.267  -5.691
    6    HG3  GLN  78           HG3      GLN  78  -4.322  -0.674  -6.737
    7   HE21  GLN  78          HE21      GLN  78  -4.957  -1.576  -4.126
    8   HE22  GLN  78          HE22      GLN  78  -5.830  -3.027  -4.242

  No H/Q in entry =           8
  In of MODEL   91
    1    H    LEU  79           H        LEU  79  -0.019  -2.449  -7.992
    2    HA   LEU  79           HA       LEU  79   0.956  -1.550  -5.535
    3    HB2  LEU  79           HB2      LEU  79   1.830  -3.558  -6.602
    4    HB3  LEU  79           HB3      LEU  79   2.473  -2.605  -7.936
    5    HG   LEU  79           HG       LEU  79   4.028  -1.463  -6.434
    6   HD13  LEU  79          HD11      LEU  79   3.023  -1.218  -4.366
    7   HD12  LEU  79          HD12      LEU  79   4.104  -2.566  -4.022
    8   HD11  LEU  79          HD13      LEU  79   2.399  -2.868  -4.351
    9   HD23  LEU  79          HD21      LEU  79   5.243  -3.608  -5.530
   10   HD22  LEU  79          HD22      LEU  79   5.038  -3.410  -7.268
   11   HD21  LEU  79          HD23      LEU  79   3.963  -4.481  -6.375

  No H/Q in entry =          11
  In of MODEL   91
    1    H    HIS  80           H        HIS  80   1.823  -0.433  -8.809
    2    HA   HIS  80           HA       HIS  80   3.627   1.559  -7.888
    3    HB2  HIS  80           HB2      HIS  80   2.339   0.861 -10.470
    4    HB3  HIS  80           HB3      HIS  80   2.930   2.514 -10.300
    5    HD1  HIS  80           HD1      HIS  80   5.330   2.820 -10.822
    6    HD2  HIS  80           HD2      HIS  80   4.521  -1.091  -9.629
    7    HE1  HIS  80           HE1      HIS  80   7.523   1.549 -10.988
    8    HE2  HIS  80           HE2      HIS  80   7.041  -0.839 -10.264

  No H/Q in entry =           8
  In of MODEL   91
    1    H    LEU  81           H        LEU  81   0.222   1.710  -8.867
    2    HA   LEU  81           HA       LEU  81  -0.060   4.502  -8.538
    3    HB2  LEU  81           HB2      LEU  81  -2.069   2.251  -8.457
    4    HB3  LEU  81           HB3      LEU  81  -2.526   3.953  -8.366
    5    HG   LEU  81           HG       LEU  81  -0.830   2.807 -10.602
    6   HD12  LEU  81          HD11      LEU  81  -3.063   3.120 -11.901
    7   HD11  LEU  81          HD12      LEU  81  -3.818   3.050 -10.309
    8   HD13  LEU  81          HD13      LEU  81  -2.871   1.685 -10.896
    9   HD23  LEU  81          HD21      LEU  81  -1.933   4.948 -11.700
   10   HD22  LEU  81          HD22      LEU  81  -0.517   5.123 -10.666
   11   HD21  LEU  81          HD23      LEU  81  -2.123   5.467 -10.026

  No H/Q in entry =          11
  In of MODEL   91
    1    H    MET  82           H        MET  82  -0.711   1.814  -6.288
    2    HA   MET  82           HA       MET  82  -1.768   3.398  -4.201
    3    HB2  MET  82           HB2      MET  82  -0.386   0.715  -4.239
    4    HB3  MET  82           HB3      MET  82  -0.967   1.439  -2.742
    5    HG2  MET  82           HG2      MET  82  -2.698   0.939  -5.183
    6    HG3  MET  82           HG3      MET  82  -2.616  -0.134  -3.787
    7    HE3  MET  82           HE1      MET  82  -4.344   1.510  -0.973
    8    HE2  MET  82           HE2      MET  82  -2.615   1.794  -1.157
    9    HE1  MET  82           HE3      MET  82  -3.298   0.234  -1.611

  No H/Q in entry =           9
  In of MODEL   91
    1    H    THR  83           H        THR  83   1.536   2.323  -4.890
    2    HA   THR  83           HA       THR  83   2.750   3.432  -2.590
    3    HB   THR  83           HB       THR  83   4.845   3.383  -4.064
    4    HG1  THR  83           HG1      THR  83   4.607   2.855  -6.088
    5   HG22  THR  83          HG21      THR  83   4.410   0.723  -4.395
    6   HG21  THR  83          HG22      THR  83   3.119   1.099  -3.255
    7   HG23  THR  83          HG23      THR  83   4.797   1.448  -2.836

  No H/Q in entry =           7
  In of MODEL   91
    1    H    SER  84           H        SER  84   2.375   4.709  -5.891
    2    HA   SER  84           HA       SER  84   3.706   7.154  -5.436
    3    HB2  SER  84           HB2      SER  84   1.639   6.314  -7.455
    4    HB3  SER  84           HB3      SER  84   2.311   7.944  -7.430
    5    HG   SER  84           HG       SER  84   3.692   5.473  -7.721

  No H/Q in entry =           5
  In of MODEL   91
    1    H    MET  85           H        MET  85   0.214   6.386  -5.264
    2    HA   MET  85           HA       MET  85  -0.656   8.993  -4.664
    3    HB2  MET  85           HB2      MET  85  -2.129   7.090  -5.323
    4    HB3  MET  85           HB3      MET  85  -1.907   6.421  -3.706
    5    HG2  MET  85           HG2      MET  85  -2.950   8.317  -2.678
    6    HG3  MET  85           HG3      MET  85  -2.917   9.233  -4.184
    7    HE2  MET  85           HE1      MET  85  -4.686   6.706  -1.963
    8    HE1  MET  85           HE2      MET  85  -3.915   5.588  -3.085
    9    HE3  MET  85           HE3      MET  85  -5.669   5.730  -3.061

  No H/Q in entry =           9
  In of MODEL   91
    1    H    LEU  86           H        LEU  86   0.273   6.334  -2.519
    2    HA   LEU  86           HA       LEU  86  -0.264   7.636  -0.077
    3    HB2  LEU  86           HB2      LEU  86   0.207   5.166  -0.471
    4    HB3  LEU  86           HB3      LEU  86   1.913   5.601  -0.566
    5    HG   LEU  86           HG       LEU  86   1.585   6.761   1.702
    6   HD11  LEU  86          HD11      LEU  86  -1.108   5.988   1.231
    7   HD13  LEU  86          HD12      LEU  86  -0.443   6.737   2.681
    8   HD12  LEU  86          HD13      LEU  86  -0.530   4.980   2.562
    9   HD23  LEU  86          HD21      LEU  86   1.164   3.767   1.824
   10   HD22  LEU  86          HD22      LEU  86   2.164   4.780   2.864
   11   HD21  LEU  86          HD23      LEU  86   2.665   4.456   1.205

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ALA  87           H        ALA  87   2.717   7.349  -1.967
    2    HA   ALA  87           HA       ALA  87   4.420   8.763  -0.242
    3    HB3  ALA  87           HB1      ALA  87   4.517   7.750  -2.950
    4    HB2  ALA  87           HB2      ALA  87   5.851   8.084  -1.849
    5    HB1  ALA  87           HB3      ALA  87   5.233   9.363  -2.893

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ARG  88           H        ARG  88   2.470   9.895  -2.963
    2    HA   ARG  88           HA       ARG  88   3.239  12.586  -2.846
    3    HB2  ARG  88           HB2      ARG  88   1.987  11.431  -4.703
    4    HB3  ARG  88           HB3      ARG  88   0.530  11.571  -3.719
    5    HG2  ARG  88           HG2      ARG  88   1.545  14.153  -3.636
    6    HG3  ARG  88           HG3      ARG  88   1.970  13.640  -5.267
    7    HD2  ARG  88           HD2      ARG  88  -0.172  13.717  -5.964
    8    HD3  ARG  88           HD3      ARG  88  -0.757  12.863  -4.536
    9    HE   ARG  88           HE       ARG  88  -0.950  15.640  -4.953
   10   HH21  ARG  88          HH11      ARG  88  -1.479  16.968  -3.215
   11   HH22  ARG  88          HH12      ARG  88  -1.182  16.431  -1.598
   12   HH11  ARG  88          HH21      ARG  88   0.069  13.379  -2.580
   13   HH12  ARG  88          HH22      ARG  88  -0.323  14.393  -1.238

  No H/Q in entry =          13
  In of MODEL   91
    1    H    GLU  89           H        GLU  89   0.538  10.908  -1.205
    2    HA   GLU  89           HA       GLU  89  -0.571  13.218   0.001
    3    HB2  GLU  89           HB2      GLU  89  -1.687  10.978  -0.086
    4    HB3  GLU  89           HB3      GLU  89  -0.562  10.423   1.154
    5    HG2  GLU  89           HG2      GLU  89  -1.383  12.121   2.714
    6    HG3  GLU  89           HG3      GLU  89  -2.437  12.791   1.471

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LEU  90           H        LEU  90   1.882  10.928   1.173
    2    HA   LEU  90           HA       LEU  90   2.238  12.172   3.703
    3    HB2  LEU  90           HB2      LEU  90   4.012  10.400   2.025
    4    HB3  LEU  90           HB3      LEU  90   4.431  10.916   3.663
    5    HG   LEU  90           HG       LEU  90   1.797   9.569   3.003
    6   HD12  LEU  90          HD11      LEU  90   2.939   7.523   4.010
    7   HD11  LEU  90          HD12      LEU  90   4.461   8.380   3.768
    8   HD13  LEU  90          HD13      LEU  90   3.448   7.973   2.381
    9   HD22  LEU  90          HD21      LEU  90   1.533  10.492   5.125
   10   HD21  LEU  90          HD22      LEU  90   3.251  10.385   5.507
   11   HD23  LEU  90          HD23      LEU  90   2.245   8.937   5.555

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  91           H        ILE  91   3.840  12.556   0.576
    2    HA   ILE  91           HA       ILE  91   5.817  14.388   1.415
    3    HB   ILE  91           HB       ILE  91   4.504  13.898  -1.265
    4   HG12  ILE  91          HG12      ILE  91   7.337  13.410  -0.292
    5   HG13  ILE  91          HG13      ILE  91   6.056  12.213  -0.129
    6   HG22  ILE  91          HG21      ILE  91   6.727  15.245  -1.954
    7   HG21  ILE  91          HG22      ILE  91   6.417  16.045  -0.412
    8   HG23  ILE  91          HG23      ILE  91   5.194  16.074  -1.681
    9   HD13  ILE  91          HD11      ILE  91   5.882  11.890  -2.437
   10   HD12  ILE  91          HD12      ILE  91   7.616  12.133  -2.224
   11   HD11  ILE  91          HD13      ILE  91   6.605  13.456  -2.809

  No H/Q in entry =          11
  In of MODEL   91
    1    H    THR  92           H        THR  92   2.455  14.820   0.408
    2    HA   THR  92           HA       THR  92   2.429  17.644   0.349
    3    HB   THR  92           HB       THR  92   0.261  15.649   1.048
    4    HG1  THR  92           HG1      THR  92   0.565  15.471  -1.037
    5   HG22  THR  92          HG21      THR  92  -1.140  17.812   0.328
    6   HG21  THR  92          HG22      THR  92   0.253  18.636   1.025
    7   HG23  THR  92          HG23      THR  92  -0.688  17.515   2.006

  No H/Q in entry =           7
  In of MODEL   91
    1    H    GLU  93           H        GLU  93   1.881  15.343   3.002
    2    HA   GLU  93           HA       GLU  93   1.350  17.246   5.022
    3    HB2  GLU  93           HB2      GLU  93   2.663  14.521   5.256
    4    HB3  GLU  93           HB3      GLU  93   1.973  15.448   6.590
    5    HG2  GLU  93           HG2      GLU  93   0.359  14.671   4.151
    6    HG3  GLU  93           HG3      GLU  93   0.461  13.648   5.579

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LEU  94           H        LEU  94   4.356  15.764   3.870
    2    HA   LEU  94           HA       LEU  94   6.108  16.910   5.758
    3    HB2  LEU  94           HB2      LEU  94   6.508  15.943   2.926
    4    HB3  LEU  94           HB3      LEU  94   7.838  16.600   3.875
    5    HG   LEU  94           HG       LEU  94   6.098  14.405   5.010
    6   HD11  LEU  94          HD11      LEU  94   8.193  14.179   2.878
    7   HD13  LEU  94          HD12      LEU  94   6.746  13.205   3.140
    8   HD12  LEU  94          HD13      LEU  94   8.172  12.952   4.146
    9   HD23  LEU  94          HD21      LEU  94   8.288  13.867   6.162
   10   HD22  LEU  94          HD22      LEU  94   7.622  15.445   6.579
   11   HD21  LEU  94          HD23      LEU  94   8.960  15.325   5.436

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  95           H        ILE  95   4.968  18.083   2.609
    2    HA   ILE  95           HA       ILE  95   6.540  20.440   2.549
    3    HB   ILE  95           HB       ILE  95   3.896  19.757   1.245
    4   HG12  ILE  95          HG12      ILE  95   6.684  20.094   0.107
    5   HG13  ILE  95          HG13      ILE  95   6.034  18.541   0.621
    6   HG21  ILE  95          HG21      ILE  95   5.646  22.224   1.025
    7   HG23  ILE  95          HG22      ILE  95   3.921  22.157   1.381
    8   HG22  ILE  95          HG23      ILE  95   4.503  21.757  -0.235
    9   HD13  ILE  95          HD11      ILE  95   4.474  18.466  -1.107
   10   HD12  ILE  95          HD12      ILE  95   5.823  19.284  -1.895
   11   HD11  ILE  95          HD13      ILE  95   4.451  20.219  -1.302

  No H/Q in entry =          11
  In of MODEL   91
    1    H    GLU  96           H        GLU  96   3.292  19.789   3.846
    2    HA   GLU  96           HA       GLU  96   2.673  22.436   4.598
    3    HB2  GLU  96           HB2      GLU  96   0.998  20.653   4.610
    4    HB3  GLU  96           HB3      GLU  96   1.860  19.825   5.904
    5    HG2  GLU  96           HG2      GLU  96   0.840  21.108   7.475
    6    HG3  GLU  96           HG3      GLU  96   1.376  22.582   6.678

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LEU  97           H        LEU  97   4.515  19.883   6.222
    2    HA   LEU  97           HA       LEU  97   4.874  21.231   8.693
    3    HB2  LEU  97           HB2      LEU  97   6.410  19.061   7.277
    4    HB3  LEU  97           HB3      LEU  97   7.001  19.745   8.789
    5    HG   LEU  97           HG       LEU  97   4.190  18.654   8.479
    6   HD12  LEU  97          HD11      LEU  97   5.129  16.640   9.691
    7   HD11  LEU  97          HD12      LEU  97   6.741  17.270   9.346
    8   HD13  LEU  97          HD13      LEU  97   5.670  16.814   8.021
    9   HD23  LEU  97          HD21      LEU  97   4.644  18.358  11.043
   10   HD22  LEU  97          HD22      LEU  97   4.265  19.970  10.439
   11   HD21  LEU  97          HD23      LEU  97   5.936  19.529  10.784

  No H/Q in entry =          11
  In of MODEL   91
    1    H    HIS  98           H        HIS  98   6.744  21.246   5.666
    2    HA   HIS  98           HA       HIS  98   8.899  22.824   6.565
    3    HB2  HIS  98           HB2      HIS  98   7.605  22.571   3.840
    4    HB3  HIS  98           HB3      HIS  98   9.046  23.548   4.130
    5    HD1  HIS  98           HD1      HIS  98   7.831  19.978   4.149
    6    HD2  HIS  98           HD2      HIS  98  11.415  22.071   4.573
    7    HE1  HIS  98           HE1      HIS  98   9.684  18.247   4.091
    8    HE2  HIS  98           HE2      HIS  98  11.870  19.501   4.349

  No H/Q in entry =           8
  In of MODEL   91
    1    H    GLU  99           H        GLU  99   5.679  23.662   5.392
    2    HA   GLU  99           HA       GLU  99   6.061  26.477   5.334
    3    HB2  GLU  99           HB2      GLU  99   4.180  25.310   4.204
    4    HB3  GLU  99           HB3      GLU  99   3.484  24.949   5.783
    5    HG2  GLU  99           HG2      GLU  99   3.307  27.341   6.285
    6    HG3  GLU  99           HG3      GLU  99   4.083  27.740   4.756

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LYS 100           H        LYS 100   4.929  24.242   7.856
    2    HA   LYS 100           HA       LYS 100   4.345  26.296   9.751
    3    HB2  LYS 100           HB2      LYS 100   4.917  23.344  10.095
    4    HB3  LYS 100           HB3      LYS 100   4.472  24.417  11.428
    5    HG2  LYS 100           HG2      LYS 100   2.406  25.057  10.181
    6    HG3  LYS 100           HG3      LYS 100   2.831  23.888   8.928
    7    HD2  LYS 100           HD2      LYS 100   2.752  22.067  10.589
    8    HD3  LYS 100           HD3      LYS 100   2.344  23.230  11.853
    9    HE2  LYS 100           HE2      LYS 100   0.291  23.854  10.591
   10    HE3  LYS 100           HE3      LYS 100   0.689  22.634   9.374
   11    HZ1  LYS 100           HZ1      LYS 100   0.423  21.967  12.255
   12    HZ3  LYS 100           HZ2      LYS 100   0.406  20.914  10.920
   13    HZ2  LYS 100           HZ3      LYS 100  -0.908  21.955  11.200

  No H/Q in entry =          13
  In of MODEL   91
    1    H    LEU 101           H        LEU 101   7.266  24.497   8.915
    2    HA   LEU 101           HA       LEU 101   8.867  25.333  11.119
    3    HB2  LEU 101           HB2      LEU 101   9.459  24.347   8.340
    4    HB3  LEU 101           HB3      LEU 101  10.762  25.010   9.321
    5    HG   LEU 101           HG       LEU 101   8.927  22.856  10.384
    6   HD12  LEU 101          HD11      LEU 101  10.978  21.358   9.775
    7   HD11  LEU 101          HD12      LEU 101  11.347  22.621   8.603
    8   HD13  LEU 101          HD13      LEU 101   9.817  21.750   8.509
    9   HD21  LEU 101          HD21      LEU 101  11.653  23.959  11.112
   10   HD23  LEU 101          HD22      LEU 101  11.108  22.387  11.691
   11   HD22  LEU 101          HD23      LEU 101  10.218  23.845  12.130

  No H/Q in entry =          11
  In of MODEL   91
    1    H    LYS 102           H        LYS 102   7.286  27.200   8.979
    2    HA   LYS 102           HA       LYS 102   7.367  29.493   8.688
    3    HB2  LYS 102           HB2      LYS 102   8.932  29.374  10.786
    4    HB3  LYS 102           HB3      LYS 102  10.232  29.567   9.626
    5    HG2  LYS 102           HG2      LYS 102   8.130  31.523  10.490
    6    HG3  LYS 102           HG3      LYS 102   9.843  31.780  10.238
    7    HD2  LYS 102           HD2      LYS 102   7.890  31.362   7.938
    8    HD3  LYS 102           HD3      LYS 102   8.276  32.940   8.607
    9    HE2  LYS 102           HE2      LYS 102   9.646  31.754   6.533
   10    HE3  LYS 102           HE3      LYS 102  10.265  33.059   7.544
   11    HZ2  LYS 102           HZ1      LYS 102  11.782  31.152   7.368
   12    HZ1  LYS 102           HZ2      LYS 102  10.619  30.171   8.110
   13    HZ3  LYS 102           HZ3      LYS 102  11.314  31.457   8.970

  No H/Q in entry =          13
  In of MODEL   91
    1    H    ALA 103           H        ALA 103  10.621  28.148   8.122
    2    HA   ALA 103           HA       ALA 103  11.587  29.524   6.046
    3    HB2  ALA 103           HB1      ALA 103  12.468  27.309   5.117
    4    HB1  ALA 103           HB2      ALA 103  11.572  26.536   6.423
    5    HB3  ALA 103           HB3      ALA 103  12.863  27.677   6.796

  No H/Q in entry =           5
  In of MODEL   91
    1    H1   LYS   3           H1       LYS   3 -31.330   5.962 -19.763
    2    H2   LYS   3           H3       LYS   3 -30.337   5.682 -21.112
    3    H3   LYS   3           H2       LYS   3 -31.720   4.728 -20.862
    4    HA   LYS   3           HA       LYS   3 -30.700   3.358 -19.453
    5    HB2  LYS   3           HB2      LYS   3 -28.436   4.795 -20.788
    6    HB3  LYS   3           HB3      LYS   3 -28.096   3.595 -19.541
    7    HG2  LYS   3           HG2      LYS   3 -29.497   1.986 -20.887
    8    HG3  LYS   3           HG3      LYS   3 -29.465   3.183 -22.182
    9    HD2  LYS   3           HD2      LYS   3 -26.982   3.102 -22.129
   10    HD3  LYS   3           HD3      LYS   3 -27.084   1.805 -20.938
   11    HE2  LYS   3           HE2      LYS   3 -28.566   0.605 -22.651
   12    HE3  LYS   3           HE3      LYS   3 -27.961   1.786 -23.811
   13    HZ3  LYS   3           HZ1      LYS   3 -26.147   0.581 -24.075
   14    HZ2  LYS   3           HZ2      LYS   3 -26.762  -0.591 -23.011
   15    HZ1  LYS   3           HZ3      LYS   3 -25.790   0.667 -22.417

  No H/Q in entry =          15
  In of MODEL   91
    1    H    LYS   4           H        LYS   4 -30.752   3.222 -17.391
    2    HA   LYS   4           HA       LYS   4 -30.052   5.522 -15.748
    3    HB2  LYS   4           HB2      LYS   4 -31.221   2.818 -15.040
    4    HB3  LYS   4           HB3      LYS   4 -31.016   4.162 -13.919
    5    HG2  LYS   4           HG2      LYS   4 -32.822   4.069 -16.341
    6    HG3  LYS   4           HG3      LYS   4 -33.314   4.120 -14.649
    7    HD2  LYS   4           HD2      LYS   4 -32.645   6.352 -14.390
    8    HD3  LYS   4           HD3      LYS   4 -31.603   6.300 -15.812
    9    HE2  LYS   4           HE2      LYS   4 -33.546   7.650 -16.281
   10    HE3  LYS   4           HE3      LYS   4 -33.607   6.173 -17.243
   11    HZ3  LYS   4           HZ1      LYS   4 -35.173   5.248 -15.694
   12    HZ2  LYS   4           HZ2      LYS   4 -35.746   6.734 -16.284
   13    HZ1  LYS   4           HZ3      LYS   4 -35.089   6.636 -14.721

  No H/Q in entry =          13
  In of MODEL   91
    1    H    HIS   5           H        HIS   5 -28.586   5.630 -14.156
    2    HA   HIS   5           HA       HIS   5 -26.282   3.825 -14.480
    3    HB2  HIS   5           HB2      HIS   5 -26.568   6.581 -13.283
    4    HB3  HIS   5           HB3      HIS   5 -25.076   5.644 -13.262
    5    HD1  HIS   5           HD1      HIS   5 -23.619   6.854 -14.855
    6    HD2  HIS   5           HD2      HIS   5 -27.411   6.187 -16.409
    7    HE1  HIS   5           HE1      HIS   5 -23.456   7.428 -17.306
    8    HE2  HIS   5           HE2      HIS   5 -25.768   7.009 -18.223

  No H/Q in entry =           8
  In of MODEL   91
    1    H    ILE   6           H        ILE   6 -26.037   2.260 -13.158
    2    HA   ILE   6           HA       ILE   6 -27.017   2.527 -10.395
    3    HB   ILE   6           HB       ILE   6 -26.166   0.064 -11.924
    4   HG12  ILE   6          HG12      ILE   6 -28.919   0.974 -11.077
    5   HG13  ILE   6          HG13      ILE   6 -28.277   1.138 -12.712
    6   HG23  ILE   6          HG21      ILE   6 -26.527  -1.186 -10.059
    7   HG22  ILE   6          HG22      ILE   6 -27.696  -0.049  -9.385
    8   HG21  ILE   6          HG23      ILE   6 -25.971   0.305  -9.295
    9   HD13  ILE   6          HD11      ILE   6 -28.715  -0.988 -13.205
   10   HD12  ILE   6          HD12      ILE   6 -29.731  -0.976 -11.763
   11   HD11  ILE   6          HD13      ILE   6 -28.071  -1.566 -11.668

  No H/Q in entry =          11
  In of MODEL   91
    1    H    TYR   7           H        TYR   7 -25.266   3.190  -9.109
    2    HA   TYR   7           HA       TYR   7 -22.544   2.258  -9.784
    3    HB2  TYR   7           HB2      TYR   7 -23.533   4.688  -8.312
    4    HB3  TYR   7           HB3      TYR   7 -21.844   4.189  -8.348
    5    HD1  TYR   7           HD1      TYR   7 -22.239   6.812  -9.221
    6    HD2  TYR   7           HD2      TYR   7 -22.872   3.225 -11.436
    7    HE1  TYR   7           HE1      TYR   7 -21.860   8.044 -11.308
    8    HE2  TYR   7           HE2      TYR   7 -22.451   4.452 -13.531
    9    HH   TYR   7           HH       TYR   7 -22.076   7.948 -13.540

  No H/Q in entry =           9
  In of MODEL   91
    1    H    LEU   8           H        LEU   8 -21.567   0.920  -8.450
    2    HA   LEU   8           HA       LEU   8 -22.693   0.424  -5.765
    3    HB2  LEU   8           HB2      LEU   8 -20.974  -1.229  -7.592
    4    HB3  LEU   8           HB3      LEU   8 -21.156  -1.607  -5.880
    5    HG   LEU   8           HG       LEU   8 -23.635  -1.805  -6.304
    6   HD13  LEU   8          HD11      LEU   8 -23.775  -0.597  -8.417
    7   HD12  LEU   8          HD12      LEU   8 -24.288  -2.268  -8.652
    8   HD11  LEU   8          HD13      LEU   8 -22.685  -1.756  -9.178
    9   HD23  LEU   8          HD21      LEU   8 -22.340  -3.839  -7.989
   10   HD22  LEU   8          HD22      LEU   8 -23.425  -4.012  -6.612
   11   HD21  LEU   8          HD23      LEU   8 -21.722  -3.642  -6.350

  No H/Q in entry =          11
  In of MODEL   91
    1    H    PHE   9           H        PHE   9 -21.402   0.885  -3.959
    2    HA   PHE   9           HA       PHE   9 -18.651   1.847  -4.520
    3    HB2  PHE   9           HB2      PHE   9 -20.713   2.869  -2.567
    4    HB3  PHE   9           HB3      PHE   9 -19.011   3.325  -2.504
    5    HD1  PHE   9           HD1      PHE   9 -22.157   3.633  -4.355
    6    HD2  PHE   9           HD2      PHE   9 -17.983   4.637  -4.320
    7    HE1  PHE   9           HE1      PHE   9 -22.552   5.329  -6.120
    8    HE2  PHE   9           HE2      PHE   9 -18.376   6.332  -6.087
    9    HZ   PHE   9           HZ       PHE   9 -20.661   6.679  -6.987

  No H/Q in entry =           9
  In of MODEL   91
    1    H    SER  10           H        SER  10 -17.017   0.981  -3.393
    2    HA   SER  10           HA       SER  10 -17.197  -0.033  -0.750
    3    HB2  SER  10           HB2      SER  10 -17.128  -2.365  -1.070
    4    HB3  SER  10           HB3      SER  10 -18.391  -1.833  -2.176
    5    HG   SER  10           HG       SER  10 -15.808  -1.800  -3.171

  No H/Q in entry =           5
  In of MODEL   91
    1    H    SER  11           H        SER  11 -15.140   0.048   0.081
    2    HA   SER  11           HA       SER  11 -12.968   0.932  -1.515
    3    HB2  SER  11           HB2      SER  11 -11.578   0.619   0.435
    4    HB3  SER  11           HB3      SER  11 -13.114   1.272   0.964
    5    HG   SER  11           HG       SER  11 -11.946  -1.116   1.514

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ALA  12           H        ALA  12 -14.243  -1.696  -2.308
    2    HA   ALA  12           HA       ALA  12 -11.727  -3.082  -2.786
    3    HB1  ALA  12           HB1      ALA  12 -14.037  -4.684  -1.710
    4    HB3  ALA  12           HB2      ALA  12 -12.825  -3.995  -0.631
    5    HB2  ALA  12           HB3      ALA  12 -12.346  -5.159  -1.866

  No H/Q in entry =           5
  In of MODEL   91
    1    H    GLY  13           H        GLY  13 -12.456  -2.034  -4.815
    2    HA3  GLY  13           HA2      GLY  13 -14.745  -2.728  -6.226
    3    HA2  GLY  13           HA3      GLY  13 -13.227  -2.233  -6.963

  No H/Q in entry =           3
  In of MODEL   91
    1    H    MET  14           H        MET  14 -11.658  -4.491  -5.989
    2    HA   MET  14           HA       MET  14 -11.930  -6.235  -8.103
    3    HB2  MET  14           HB2      MET  14  -9.958  -6.197  -6.665
    4    HB3  MET  14           HB3      MET  14 -10.893  -6.894  -5.341
    5    HG2  MET  14           HG2      MET  14 -11.308  -8.915  -6.655
    6    HG3  MET  14           HG3      MET  14 -10.466  -8.217  -8.037
    7    HE2  MET  14           HE1      MET  14  -7.742  -6.858  -6.863
    8    HE1  MET  14           HE2      MET  14  -8.264  -7.723  -8.306
    9    HE3  MET  14           HE3      MET  14  -6.876  -8.306  -7.393

  No H/Q in entry =           9
  In of MODEL   91
    1    H    SER  15           H        SER  15 -13.241  -6.831  -4.798
    2    HA   SER  15           HA       SER  15 -14.575  -9.231  -5.619
    3    HB2  SER  15           HB2      SER  15 -14.064  -9.102  -3.319
    4    HB3  SER  15           HB3      SER  15 -14.785  -7.499  -3.167
    5    HG   SER  15           HG       SER  15 -16.802  -8.515  -3.736

  No H/Q in entry =           5
  In of MODEL   91
    1    H    THR  16           H        THR  16 -15.601  -5.919  -5.104
    2    HA   THR  16           HA       THR  16 -18.396  -6.338  -5.613
    3    HB   THR  16           HB       THR  16 -16.846  -3.771  -6.029
    4    HG1  THR  16           HG1      THR  16 -16.475  -4.639  -3.954
    5   HG22  THR  16          HG21      THR  16 -19.054  -2.776  -5.396
    6   HG21  THR  16          HG22      THR  16 -19.741  -4.400  -5.393
    7   HG23  THR  16          HG23      THR  16 -19.117  -3.710  -6.891

  No H/Q in entry =           7
  In of MODEL   91
    1    H    SER  17           H        SER  17 -15.588  -5.768  -7.467
    2    HA   SER  17           HA       SER  17 -16.718  -5.049  -9.973
    3    HB2  SER  17           HB2      SER  17 -14.078  -6.332  -9.259
    4    HB3  SER  17           HB3      SER  17 -14.522  -5.925 -10.910
    5    HG   SER  17           HG       SER  17 -14.731  -4.025  -8.842

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LEU  18           H        LEU  18 -16.119  -8.182  -8.511
    2    HA   LEU  18           HA       LEU  18 -16.685  -9.698 -10.862
    3    HB2  LEU  18           HB2      LEU  18 -15.475 -10.658  -8.924
    4    HB3  LEU  18           HB3      LEU  18 -16.921 -10.467  -7.934
    5    HG   LEU  18           HG       LEU  18 -18.153 -11.959  -9.507
    6   HD11  LEU  18          HD11      LEU  18 -15.555 -11.772 -10.943
    7   HD13  LEU  18          HD12      LEU  18 -17.180 -12.022 -11.579
    8   HD12  LEU  18          HD13      LEU  18 -16.288 -13.376 -10.890
    9   HD23  LEU  18          HD21      LEU  18 -15.647 -13.367  -8.594
   10   HD22  LEU  18          HD22      LEU  18 -17.313 -13.947  -8.559
   11   HD21  LEU  18          HD23      LEU  18 -16.788 -12.705  -7.422

  No H/Q in entry =          11
  In of MODEL   91
    1    H    LEU  19           H        LEU  19 -18.671  -8.500  -8.159
    2    HA   LEU  19           HA       LEU  19 -21.121  -9.713  -8.991
    3    HB2  LEU  19           HB2      LEU  19 -20.904  -8.866  -6.718
    4    HB3  LEU  19           HB3      LEU  19 -20.563  -7.247  -7.315
    5    HG   LEU  19           HG       LEU  19 -22.885  -7.235  -8.348
    6   HD12  LEU  19          HD11      LEU  19 -23.670  -9.439  -6.481
    7   HD11  LEU  19          HD12      LEU  19 -22.982  -9.897  -8.028
    8   HD13  LEU  19          HD13      LEU  19 -24.432  -8.911  -7.977
    9   HD21  LEU  19          HD21      LEU  19 -22.127  -6.416  -5.937
   10   HD23  LEU  19          HD22      LEU  19 -23.197  -7.712  -5.408
   11   HD22  LEU  19          HD23      LEU  19 -23.826  -6.401  -6.404

  No H/Q in entry =          11
  In of MODEL   91
    1    H    VAL  20           H        VAL  20 -19.657  -6.539  -9.696
    2    HA   VAL  20           HA       VAL  20 -21.777  -5.527 -11.272
    3    HB   VAL  20           HB       VAL  20 -18.800  -4.966 -11.366
    4   HG11  VAL  20          HG11      VAL  20 -21.005  -4.079 -13.127
    5   HG13  VAL  20          HG12      VAL  20 -19.263  -4.028 -13.391
    6   HG12  VAL  20          HG13      VAL  20 -20.048  -2.759 -12.455
    7   HG21  VAL  20          HG21      VAL  20 -21.190  -3.659 -10.053
    8   HG23  VAL  20          HG22      VAL  20 -19.675  -2.791 -10.301
    9   HG22  VAL  20          HG23      VAL  20 -19.709  -4.236  -9.291

  No H/Q in entry =           9
  In of MODEL   91
    1    H    SER  21           H        SER  21 -18.996  -7.551 -12.287
    2    HA   SER  21           HA       SER  21 -19.777  -7.458 -15.039
    3    HB2  SER  21           HB2      SER  21 -18.317  -9.440 -15.328
    4    HB3  SER  21           HB3      SER  21 -17.502  -8.191 -14.392
    5    HG   SER  21           HG       SER  21 -17.590  -9.421 -12.664

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LYS  22           H        LYS  22 -20.823  -9.646 -12.462
    2    HA   LYS  22           HA       LYS  22 -22.341 -11.289 -14.280
    3    HB2  LYS  22           HB2      LYS  22 -21.515 -11.686 -11.763
    4    HB3  LYS  22           HB3      LYS  22 -23.111 -11.028 -11.403
    5    HG2  LYS  22           HG2      LYS  22 -23.411 -13.378 -11.554
    6    HG3  LYS  22           HG3      LYS  22 -24.042 -12.723 -13.058
    7    HD2  LYS  22           HD2      LYS  22 -22.600 -14.001 -14.247
    8    HD3  LYS  22           HD3      LYS  22 -21.242 -13.206 -13.464
    9    HE2  LYS  22           HE2      LYS  22 -20.867 -14.966 -12.052
   10    HE3  LYS  22           HE3      LYS  22 -22.581 -15.316 -11.843
   11    HZ1  LYS  22           HZ1      LYS  22 -22.492 -16.093 -14.244
   12    HZ3  LYS  22           HZ2      LYS  22 -21.777 -17.092 -13.070
   13    HZ2  LYS  22           HZ3      LYS  22 -20.806 -16.109 -14.060

  No H/Q in entry =          13
  In of MODEL   91
    1    H    MET  23           H        MET  23 -23.098  -8.367 -12.424
    2    HA   MET  23           HA       MET  23 -25.904  -8.475 -12.935
    3    HB2  MET  23           HB2      MET  23 -24.080  -6.146 -12.367
    4    HB3  MET  23           HB3      MET  23 -25.826  -5.995 -12.549
    5    HG2  MET  23           HG2      MET  23 -26.209  -7.295 -10.575
    6    HG3  MET  23           HG3      MET  23 -24.495  -7.690 -10.445
    7    HE2  MET  23           HE1      MET  23 -26.830  -4.056  -9.273
    8    HE1  MET  23           HE2      MET  23 -27.072  -5.032 -10.721
    9    HE3  MET  23           HE3      MET  23 -26.050  -3.595 -10.788

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ARG  24           H        ARG  24 -23.160  -7.027 -14.718
    2    HA   ARG  24           HA       ARG  24 -24.665  -5.748 -16.725
    3    HB2  ARG  24           HB2      ARG  24 -22.011  -5.802 -16.148
    4    HB3  ARG  24           HB3      ARG  24 -22.057  -6.845 -17.573
    5    HG2  ARG  24           HG2      ARG  24 -23.578  -4.990 -18.600
    6    HG3  ARG  24           HG3      ARG  24 -22.937  -3.968 -17.318
    7    HD2  ARG  24           HD2      ARG  24 -21.194  -5.503 -19.252
    8    HD3  ARG  24           HD3      ARG  24 -21.691  -3.835 -19.505
    9    HE   ARG  24           HE       ARG  24 -20.561  -3.864 -16.991
   10   HH21  ARG  24          HH11      ARG  24 -18.353  -3.361 -16.708
   11   HH22  ARG  24          HH12      ARG  24 -17.244  -3.604 -18.016
   12   HH11  ARG  24          HH21      ARG  24 -19.663  -4.781 -20.199
   13   HH12  ARG  24          HH22      ARG  24 -17.985  -4.408 -19.991

  No H/Q in entry =          13
  In of MODEL   91
    1    H    ALA  25           H        ALA  25 -23.516  -9.074 -16.436
    2    HA   ALA  25           HA       ALA  25 -24.131  -9.920 -19.071
    3    HB1  ALA  25           HB1      ALA  25 -23.420 -11.943 -18.368
    4    HB3  ALA  25           HB2      ALA  25 -24.480 -11.927 -16.959
    5    HB2  ALA  25           HB3      ALA  25 -22.933 -11.087 -16.906

  No H/Q in entry =           5
  In of MODEL   91
    1    H    GLN  26           H        GLN  26 -25.963  -9.964 -16.052
    2    HA   GLN  26           HA       GLN  26 -28.295 -11.188 -17.069
    3    HB2  GLN  26           HB2      GLN  26 -27.802  -9.430 -14.686
    4    HB3  GLN  26           HB3      GLN  26 -29.358 -10.167 -15.038
    5    HG2  GLN  26           HG2      GLN  26 -26.762 -11.602 -14.559
    6    HG3  GLN  26           HG3      GLN  26 -28.125 -11.507 -13.453
    7   HE21  GLN  26          HE21      GLN  26 -26.888 -13.665 -14.720
    8   HE22  GLN  26          HE22      GLN  26 -27.921 -14.723 -15.517

  No H/Q in entry =           8
  In of MODEL   91
    1    H    ALA  27           H        ALA  27 -27.389  -7.783 -16.685
    2    HA   ALA  27           HA       ALA  27 -29.886  -6.711 -17.477
    3    HB1  ALA  27           HB1      ALA  27 -28.088  -5.379 -16.361
    4    HB3  ALA  27           HB2      ALA  27 -28.682  -4.622 -17.841
    5    HB2  ALA  27           HB3      ALA  27 -27.140  -5.477 -17.846

  No H/Q in entry =           5
  In of MODEL   91
    1    H    GLU  28           H        GLU  28 -27.171  -7.918 -19.337
    2    HA   GLU  28           HA       GLU  28 -28.109  -6.891 -21.862
    3    HB2  GLU  28           HB2      GLU  28 -25.727  -7.555 -21.231
    4    HB3  GLU  28           HB3      GLU  28 -26.258  -9.223 -21.430
    5    HG2  GLU  28           HG2      GLU  28 -25.114  -8.442 -23.397
    6    HG3  GLU  28           HG3      GLU  28 -26.807  -8.779 -23.749

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LYS  29           H        LYS  29 -28.255  -9.995 -20.199
    2    HA   LYS  29           HA       LYS  29 -29.542 -11.479 -22.203
    3    HB2  LYS  29           HB2      LYS  29 -28.489 -12.450 -20.194
    4    HB3  LYS  29           HB3      LYS  29 -29.768 -11.752 -19.203
    5    HG2  LYS  29           HG2      LYS  29 -31.416 -13.138 -20.272
    6    HG3  LYS  29           HG3      LYS  29 -30.210 -13.767 -21.392
    7    HD2  LYS  29           HD2      LYS  29 -29.063 -14.921 -19.654
    8    HD3  LYS  29           HD3      LYS  29 -29.979 -14.085 -18.403
    9    HE2  LYS  29           HE2      LYS  29 -30.712 -16.440 -18.761
   10    HE3  LYS  29           HE3      LYS  29 -31.998 -15.258 -19.010
   11    HZ1  LYS  29           HZ1      LYS  29 -31.428 -15.391 -21.436
   12    HZ3  LYS  29           HZ2      LYS  29 -32.138 -16.783 -20.770
   13    HZ2  LYS  29           HZ3      LYS  29 -30.468 -16.742 -21.064

  No H/Q in entry =          13
  In of MODEL   91
    1    H    TYR  30           H        TYR  30 -30.956  -9.380 -19.706
    2    HA   TYR  30           HA       TYR  30 -33.612  -9.852 -20.951
    3    HB2  TYR  30           HB2      TYR  30 -32.974  -8.688 -18.231
    4    HB3  TYR  30           HB3      TYR  30 -34.588  -8.959 -18.887
    5    HD1  TYR  30           HD1      TYR  30 -31.655 -10.504 -17.389
    6    HD2  TYR  30           HD2      TYR  30 -35.480 -11.259 -19.098
    7    HE1  TYR  30           HE1      TYR  30 -31.549 -12.816 -16.591
    8    HE2  TYR  30           HE2      TYR  30 -35.374 -13.585 -18.298
    9    HH   TYR  30           HH       TYR  30 -33.168 -15.190 -17.683

  No H/Q in entry =           9
  In of MODEL   91
    1    H    GLU  31           H        GLU  31 -31.461  -7.844 -21.751
    2    HA   GLU  31           HA       GLU  31 -31.402  -5.688 -22.577
    3    HB2  GLU  31           HB2      GLU  31 -34.290  -6.428 -23.094
    4    HB3  GLU  31           HB3      GLU  31 -33.459  -5.055 -23.825
    5    HG2  GLU  31           HG2      GLU  31 -31.972  -6.483 -25.011
    6    HG3  GLU  31           HG3      GLU  31 -32.527  -7.900 -24.121

  No H/Q in entry =           6
  In of MODEL   91
    1    H    VAL  32           H        VAL  32 -31.608  -5.584 -19.846
    2    HA   VAL  32           HA       VAL  32 -33.489  -3.486 -19.195
    3    HB   VAL  32           HB       VAL  32 -31.092  -4.456 -17.607
    4   HG12  VAL  32          HG11      VAL  32 -32.638  -3.643 -15.716
    5   HG11  VAL  32          HG12      VAL  32 -33.477  -2.747 -16.983
    6   HG13  VAL  32          HG13      VAL  32 -31.774  -2.429 -16.660
    7   HG21  VAL  32          HG21      VAL  32 -32.843  -6.193 -18.296
    8   HG23  VAL  32          HG22      VAL  32 -33.893  -5.372 -17.140
    9   HG22  VAL  32          HG23      VAL  32 -32.371  -6.082 -16.601

  No H/Q in entry =           9
  In of MODEL   91
    1    HA   PRO  33           HA       PRO  33 -30.480  -0.533 -20.866
    2    HB2  PRO  33           HB2      PRO  33 -32.012   1.676 -20.749
    3    HB3  PRO  33           HB3      PRO  33 -32.466   0.368 -21.842
    4    HG2  PRO  33           HG2      PRO  33 -33.445   0.880 -19.032
    5    HG3  PRO  33           HG3      PRO  33 -34.405   0.660 -20.496
    6    HD2  PRO  33           HD2      PRO  33 -33.933  -1.406 -18.826
    7    HD3  PRO  33           HD3      PRO  33 -33.989  -1.650 -20.572

  No H/Q in entry =           7
  In of MODEL   91
    1    H    VAL  34           H        VAL  34 -29.215  -1.063 -18.914
    2    HA   VAL  34           HA       VAL  34 -28.958   1.367 -17.269
    3    HB   VAL  34           HB       VAL  34 -28.367  -0.085 -15.329
    4   HG12  VAL  34          HG11      VAL  34 -30.771  -0.981 -15.024
    5   HG11  VAL  34          HG12      VAL  34 -31.092  -0.226 -16.585
    6   HG13  VAL  34          HG13      VAL  34 -30.551   0.758 -15.224
    7   HG21  VAL  34          HG21      VAL  34 -28.528  -2.116 -17.334
    8   HG23  VAL  34          HG22      VAL  34 -29.585  -2.485 -15.970
    9   HG22  VAL  34          HG23      VAL  34 -27.870  -2.181 -15.699

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ILE  35           H        ILE  35 -26.987   1.823 -16.426
    2    HA   ILE  35           HA       ILE  35 -24.668   0.515 -17.683
    3    HB   ILE  35           HB       ILE  35 -25.098   3.402 -16.877
    4   HG12  ILE  35          HG12      ILE  35 -24.097   2.101 -19.418
    5   HG13  ILE  35          HG13      ILE  35 -25.734   2.706 -19.162
    6   HG21  ILE  35          HG21      ILE  35 -22.520   1.894 -17.178
    7   HG23  ILE  35          HG22      ILE  35 -22.988   3.070 -15.953
    8   HG22  ILE  35          HG23      ILE  35 -22.609   3.606 -17.589
    9   HD11  ILE  35          HD11      ILE  35 -24.356   4.915 -18.562
   10   HD13  ILE  35          HD12      ILE  35 -24.886   4.524 -20.198
   11   HD12  ILE  35          HD13      ILE  35 -23.231   4.172 -19.699

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ILE  36           H        ILE  36 -23.430  -0.494 -16.079
    2    HA   ILE  36           HA       ILE  36 -23.881   0.121 -13.211
    3    HB   ILE  36           HB       ILE  36 -23.025  -2.575 -14.314
    4   HG12  ILE  36          HG12      ILE  36 -25.842  -1.796 -13.556
    5   HG13  ILE  36          HG13      ILE  36 -25.267  -1.772 -15.224
    6   HG23  ILE  36          HG21      ILE  36 -23.371  -3.405 -12.200
    7   HG22  ILE  36          HG22      ILE  36 -24.513  -2.132 -11.764
    8   HG21  ILE  36          HG23      ILE  36 -22.786  -1.783 -11.832
    9   HD13  ILE  36          HD11      ILE  36 -25.410  -3.988 -15.427
   10   HD12  ILE  36          HD12      ILE  36 -26.479  -3.875 -14.030
   11   HD11  ILE  36          HD13      ILE  36 -24.777  -4.278 -13.807

  No H/Q in entry =          11
  In of MODEL   91
    1    H    GLU  37           H        GLU  37 -22.109   0.770 -12.104
    2    HA   GLU  37           HA       GLU  37 -19.409   0.000 -13.014
    3    HB2  GLU  37           HB2      GLU  37 -20.358   2.801 -12.417
    4    HB3  GLU  37           HB3      GLU  37 -18.657   2.342 -12.519
    5    HG2  GLU  37           HG2      GLU  37 -19.106   1.447 -14.824
    6    HG3  GLU  37           HG3      GLU  37 -20.737   2.104 -14.709

  No H/Q in entry =           6
  In of MODEL   91
    1    H    ALA  38           H        ALA  38 -17.923  -0.220 -11.329
    2    HA   ALA  38           HA       ALA  38 -18.961  -0.049  -8.559
    3    HB1  ALA  38           HB1      ALA  38 -17.224  -1.971  -9.980
    4    HB3  ALA  38           HB2      ALA  38 -18.274  -2.217  -8.584
    5    HB2  ALA  38           HB3      ALA  38 -16.669  -1.516  -8.369

  No H/Q in entry =           5
  In of MODEL   91
    1    H    PHE  39           H        PHE  39 -17.736   1.177  -7.086
    2    HA   PHE  39           HA       PHE  39 -15.223   2.406  -7.979
    3    HB2  PHE  39           HB2      PHE  39 -17.721   3.809  -6.978
    4    HB3  PHE  39           HB3      PHE  39 -16.162   4.601  -7.000
    5    HD1  PHE  39           HD1      PHE  39 -19.103   3.881  -8.831
    6    HD2  PHE  39           HD2      PHE  39 -14.897   4.605  -9.312
    7    HE1  PHE  39           HE1      PHE  39 -19.483   4.508 -11.197
    8    HE2  PHE  39           HE2      PHE  39 -15.278   5.235 -11.681
    9    HZ   PHE  39           HZ       PHE  39 -17.572   5.185 -12.624

  No H/Q in entry =           9
  In of MODEL   91
    1    HA   PRO  40           HA       PRO  40 -14.285   1.669  -3.690
    2    HB2  PRO  40           HB2      PRO  40 -12.559   3.677  -3.057
    3    HB3  PRO  40           HB3      PRO  40 -12.102   2.338  -4.130
    4    HG2  PRO  40           HG2      PRO  40 -12.941   5.113  -4.818
    5    HG3  PRO  40           HG3      PRO  40 -11.655   4.113  -5.516
    6    HD2  PRO  40           HD2      PRO  40 -14.081   4.426  -6.713
    7    HD3  PRO  40           HD3      PRO  40 -13.111   2.956  -6.893

  No H/Q in entry =           7
  In of MODEL   91
    1    H    GLU  41           H        GLU  41 -14.921   2.643  -1.563
    2    HA   GLU  41           HA       GLU  41 -17.187   4.317  -1.553
    3    HB2  GLU  41           HB2      GLU  41 -16.887   4.437   0.889
    4    HB3  GLU  41           HB3      GLU  41 -16.881   2.796   0.255
    5    HG2  GLU  41           HG2      GLU  41 -14.885   2.443   1.208
    6    HG3  GLU  41           HG3      GLU  41 -14.173   3.714   0.220

  No H/Q in entry =           6
  In of MODEL   91
    1    H    THR  42           H        THR  42 -13.868   5.277  -1.600
    2    HA   THR  42           HA       THR  42 -14.256   7.834  -0.392
    3    HB   THR  42           HB       THR  42 -12.093   8.411  -1.417
    4    HG1  THR  42           HG1      THR  42 -11.386   6.145  -2.498
    5   HG23  THR  42          HG21      THR  42 -11.271   7.279   0.360
    6   HG22  THR  42          HG22      THR  42 -11.131   5.866  -0.685
    7   HG21  THR  42          HG23      THR  42 -12.583   6.102   0.285

  No H/Q in entry =           7
  In of MODEL   91
    1    H    LEU  43           H        LEU  43 -15.141   6.723  -3.493
    2    HA   LEU  43           HA       LEU  43 -15.428   9.491  -4.468
    3    HB2  LEU  43           HB2      LEU  43 -15.678   6.836  -5.896
    4    HB3  LEU  43           HB3      LEU  43 -15.920   8.406  -6.645
    5    HG   LEU  43           HG       LEU  43 -13.347   7.665  -5.231
    6   HD11  LEU  43          HD11      LEU  43 -14.353   6.674  -7.767
    7   HD13  LEU  43          HD12      LEU  43 -12.831   6.307  -6.958
    8   HD12  LEU  43          HD13      LEU  43 -12.935   7.687  -8.044
    9   HD21  LEU  43          HD21      LEU  43 -14.089   9.816  -7.249
   10   HD23  LEU  43          HD22      LEU  43 -12.446   9.495  -6.698
   11   HD22  LEU  43          HD23      LEU  43 -13.653  10.074  -5.561

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ALA  44           H        ALA  44 -17.353   7.644  -2.615
    2    HA   ALA  44           HA       ALA  44 -19.826   7.468  -3.942
    3    HB2  ALA  44           HB1      ALA  44 -19.677   6.358  -1.843
    4    HB3  ALA  44           HB2      ALA  44 -20.803   7.688  -1.574
    5    HB1  ALA  44           HB3      ALA  44 -19.134   7.819  -1.020

  No H/Q in entry =           5
  In of MODEL   91
    1    H    GLY  45           H        GLY  45 -18.446  10.290  -2.411
    2    HA3  GLY  45           HA2      GLY  45 -20.902  11.757  -2.779
    3    HA2  GLY  45           HA3      GLY  45 -19.366  12.403  -2.200

  No H/Q in entry =           3
  In of MODEL   91
    1    H    GLU  46           H        GLU  46 -17.819  11.482  -4.486
    2    HA   GLU  46           HA       GLU  46 -18.483  13.686  -6.261
    3    HB2  GLU  46           HB2      GLU  46 -16.172  11.824  -5.923
    4    HB3  GLU  46           HB3      GLU  46 -16.414  12.549  -7.513
    5    HG2  GLU  46           HG2      GLU  46 -16.314  14.774  -6.600
    6    HG3  GLU  46           HG3      GLU  46 -16.344  14.160  -4.948

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LYS  47           H        LYS  47 -18.316  10.169  -6.689
    2    HA   LYS  47           HA       LYS  47 -19.412  10.369  -9.367
    3    HB2  LYS  47           HB2      LYS  47 -18.804   7.977  -7.621
    4    HB3  LYS  47           HB3      LYS  47 -19.359   7.887  -9.291
    5    HG2  LYS  47           HG2      LYS  47 -16.855   9.353  -8.431
    6    HG3  LYS  47           HG3      LYS  47 -16.858   7.693  -9.025
    7    HD2  LYS  47           HD2      LYS  47 -18.158   8.724 -11.063
    8    HD3  LYS  47           HD3      LYS  47 -17.459  10.243 -10.500
    9    HE2  LYS  47           HE2      LYS  47 -15.255   8.646 -10.410
   10    HE3  LYS  47           HE3      LYS  47 -16.132   7.905 -11.749
   11    HZ2  LYS  47           HZ1      LYS  47 -14.562   9.827 -12.262
   12    HZ1  LYS  47           HZ2      LYS  47 -15.764  10.829 -11.599
   13    HZ3  LYS  47           HZ3      LYS  47 -16.108   9.867 -12.958

  No H/Q in entry =          13
  In of MODEL   91
    1    H    GLY  48           H        GLY  48 -20.730   9.600  -6.220
    2    HA3  GLY  48           HA2      GLY  48 -23.099   8.383  -6.963
    3    HA2  GLY  48           HA3      GLY  48 -22.889   9.382  -5.525

  No H/Q in entry =           3
  In of MODEL   91
    1    H    GLN  49           H        GLN  49 -22.335  11.810  -7.100
    2    HA   GLN  49           HA       GLN  49 -24.908  12.887  -7.250
    3    HB2  GLN  49           HB2      GLN  49 -22.374  13.782  -8.607
    4    HB3  GLN  49           HB3      GLN  49 -23.849  14.729  -8.528
    5    HG2  GLN  49           HG2      GLN  49 -23.694  14.758  -6.090
    6    HG3  GLN  49           HG3      GLN  49 -22.232  13.792  -6.169
    7   HE21  GLN  49          HE21      GLN  49 -22.146  16.023  -4.900
    8   HE22  GLN  49          HE22      GLN  49 -21.238  17.290  -5.548

  No H/Q in entry =           8
  In of MODEL   91
    1    H    ASN  50           H        ASN  50 -23.201  11.025  -9.631
    2    HA   ASN  50           HA       ASN  50 -25.092  11.869 -11.718
    3    HB2  ASN  50           HB2      ASN  50 -22.491  10.363 -11.944
    4    HB3  ASN  50           HB3      ASN  50 -23.545  10.772 -13.290
    5   HD21  ASN  50          HD21      ASN  50 -20.923  11.655 -11.676
    6   HD22  ASN  50          HD22      ASN  50 -20.710  13.292 -12.022

  No H/Q in entry =           6
  In of MODEL   91
    1    H    ALA  51           H        ALA  51 -25.051   9.517  -9.467
    2    HA   ALA  51           HA       ALA  51 -25.805   7.359 -11.291
    3    HB2  ALA  51           HB1      ALA  51 -25.208   6.021  -9.601
    4    HB3  ALA  51           HB2      ALA  51 -26.342   6.817  -8.512
    5    HB1  ALA  51           HB3      ALA  51 -24.711   7.458  -8.708

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ASP  52           H        ASP  52 -27.797   6.279 -11.153
    2    HA   ASP  52           HA       ASP  52 -30.002   8.087 -10.495
    3    HB2  ASP  52           HB2      ASP  52 -29.777   5.582 -12.159
    4    HB3  ASP  52           HB3      ASP  52 -31.331   6.296 -11.729

  No H/Q in entry =           4
  In of MODEL   91
    1    H    VAL  53           H        VAL  53 -28.368   5.219  -9.471
    2    HA   VAL  53           HA       VAL  53 -29.814   5.334  -6.956
    3    HB   VAL  53           HB       VAL  53 -31.191   3.673  -8.200
    4   HG11  VAL  53          HG11      VAL  53 -29.431   2.831  -9.718
    5   HG13  VAL  53          HG12      VAL  53 -30.251   1.528  -8.857
    6   HG12  VAL  53          HG13      VAL  53 -28.647   2.051  -8.345
    7   HG23  VAL  53          HG21      VAL  53 -30.349   1.709  -6.503
    8   HG22  VAL  53          HG22      VAL  53 -31.494   3.001  -6.141
    9   HG21  VAL  53          HG23      VAL  53 -29.790   3.194  -5.730

  No H/Q in entry =           9
  In of MODEL   91
    1    H    VAL  54           H        VAL  54 -28.499   4.919  -5.298
    2    HA   VAL  54           HA       VAL  54 -25.728   4.101  -5.904
    3    HB   VAL  54           HB       VAL  54 -26.823   5.871  -3.659
    4   HG11  VAL  54          HG11      VAL  54 -24.227   4.480  -3.943
    5   HG13  VAL  54          HG12      VAL  54 -24.991   5.154  -2.504
    6   HG12  VAL  54          HG13      VAL  54 -24.095   6.206  -3.601
    7   HG22  VAL  54          HG21      VAL  54 -25.982   7.693  -4.761
    8   HG21  VAL  54          HG22      VAL  54 -26.516   6.694  -6.112
    9   HG23  VAL  54          HG23      VAL  54 -24.810   6.739  -5.671

  No H/Q in entry =           9
  In of MODEL   91
    1    H    LEU  55           H        LEU  55 -25.116   2.188  -5.257
    2    HA   LEU  55           HA       LEU  55 -26.612   0.863  -3.081
    3    HB2  LEU  55           HB2      LEU  55 -25.039  -0.291  -5.372
    4    HB3  LEU  55           HB3      LEU  55 -25.791  -1.231  -4.083
    5    HG   LEU  55           HG       LEU  55 -27.241   0.336  -6.205
    6   HD13  LEU  55          HD11      LEU  55 -26.919  -1.515  -7.421
    7   HD12  LEU  55          HD12      LEU  55 -27.869  -2.399  -6.226
    8   HD11  LEU  55          HD13      LEU  55 -26.114  -2.314  -6.073
    9   HD23  LEU  55          HD21      LEU  55 -28.518  -1.621  -4.349
   10   HD22  LEU  55          HD22      LEU  55 -29.227  -0.248  -5.200
   11   HD21  LEU  55          HD23      LEU  55 -28.212   0.022  -3.783

  No H/Q in entry =          11
  In of MODEL   91
    1    H    LEU  56           H        LEU  56 -25.457   0.286  -1.273
    2    HA   LEU  56           HA       LEU  56 -22.527   0.713  -1.319
    3    HB2  LEU  56           HB2      LEU  56 -24.331   0.487   1.077
    4    HB3  LEU  56           HB3      LEU  56 -22.627   0.935   1.068
    5    HG   LEU  56           HG       LEU  56 -24.943   2.587   0.098
    6   HD11  LEU  56          HD11      LEU  56 -23.828   2.221   2.621
    7   HD13  LEU  56          HD12      LEU  56 -24.832   3.579   2.111
    8   HD12  LEU  56          HD13      LEU  56 -23.075   3.702   2.025
    9   HD23  LEU  56          HD21      LEU  56 -23.016   4.305  -0.096
   10   HD22  LEU  56          HD22      LEU  56 -23.384   3.203  -1.422
   11   HD21  LEU  56          HD23      LEU  56 -22.029   2.867  -0.345

  No H/Q in entry =          11
  In of MODEL   91
    1    H    GLY  57           H        GLY  57 -21.130  -0.901  -0.780
    2    HA3  GLY  57           HA2      GLY  57 -22.024  -3.598  -0.971
    3    HA2  GLY  57           HA3      GLY  57 -20.407  -3.084  -0.492

  No H/Q in entry =           3
  In of MODEL   91
    1    HA   PRO  58           HA       PRO  58 -23.313  -4.436   3.146
    2    HB2  PRO  58           HB2      PRO  58 -22.055  -6.860   3.696
    3    HB3  PRO  58           HB3      PRO  58 -23.566  -6.666   2.790
    4    HG2  PRO  58           HG2      PRO  58 -20.801  -7.084   1.792
    5    HG3  PRO  58           HG3      PRO  58 -22.339  -7.692   1.158
    6    HD2  PRO  58           HD2      PRO  58 -21.013  -5.618  -0.002
    7    HD3  PRO  58           HD3      PRO  58 -22.788  -5.737  -0.013

  No H/Q in entry =           7
  In of MODEL   91
    1    H    GLN  59           H        GLN  59 -19.835  -4.584   2.616
    2    HA   GLN  59           HA       GLN  59 -19.084  -4.588   5.378
    3    HB2  GLN  59           HB2      GLN  59 -17.534  -3.753   2.929
    4    HB3  GLN  59           HB3      GLN  59 -16.865  -3.878   4.545
    5    HG2  GLN  59           HG2      GLN  59 -16.956  -5.909   2.621
    6    HG3  GLN  59           HG3      GLN  59 -16.510  -6.088   4.300
    7   HE21  GLN  59          HE21      GLN  59 -17.626  -8.234   2.856
    8   HE22  GLN  59          HE22      GLN  59 -19.173  -8.578   3.466

  No H/Q in entry =           8
  In of MODEL   91
    1    H    ILE  60           H        ILE  60 -20.041  -2.052   3.163
    2    HA   ILE  60           HA       ILE  60 -19.212  -0.082   5.206
    3    HB   ILE  60           HB       ILE  60 -19.523   1.615   3.350
    4   HG12  ILE  60          HG12      ILE  60 -19.298  -0.749   1.492
    5   HG13  ILE  60          HG13      ILE  60 -20.874  -0.149   1.996
    6   HG21  ILE  60          HG21      ILE  60 -17.305   0.265   4.076
    7   HG23  ILE  60          HG22      ILE  60 -17.305   1.455   2.779
    8   HG22  ILE  60          HG23      ILE  60 -17.411  -0.262   2.397
    9   HD12  ILE  60          HD11      ILE  60 -18.766   1.232   0.349
   10   HD11  ILE  60          HD12      ILE  60 -19.946   2.186   1.247
   11   HD13  ILE  60          HD13      ILE  60 -20.488   1.050   0.018

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ALA  61           H        ALA  61 -21.651  -1.693   5.274
    2    HA   ALA  61           HA       ALA  61 -23.893  -0.052   4.808
    3    HB1  ALA  61           HB1      ALA  61 -25.095  -1.552   6.135
    4    HB2  ALA  61           HB2      ALA  61 -23.695  -1.924   7.140
    5    HB3  ALA  61           HB3      ALA  61 -23.781  -2.535   5.489

  No H/Q in entry =           5
  In of MODEL   91
    1    H    TYR  62           H        TYR  62 -21.689  -0.135   7.609
    2    HA   TYR  62           HA       TYR  62 -23.264   1.509   9.274
    3    HB2  TYR  62           HB2      TYR  62 -21.257   1.936  10.539
    4    HB3  TYR  62           HB3      TYR  62 -21.295   0.241  10.066
    5    HD1  TYR  62           HD1      TYR  62 -19.605   3.462   9.653
    6    HD2  TYR  62           HD2      TYR  62 -19.803  -0.606   8.286
    7    HE1  TYR  62           HE1      TYR  62 -17.375   3.709   8.595
    8    HE2  TYR  62           HE2      TYR  62 -17.571  -0.360   7.233
    9    HH   TYR  62           HH       TYR  62 -16.217   2.045   6.335

  No H/Q in entry =           9
  In of MODEL   91
    1    H    MET  63           H        MET  63 -21.626   2.379   6.419
    2    HA   MET  63           HA       MET  63 -21.488   5.213   7.107
    3    HB2  MET  63           HB2      MET  63 -20.845   3.706   4.558
    4    HB3  MET  63           HB3      MET  63 -20.611   5.439   4.783
    5    HG2  MET  63           HG2      MET  63 -19.014   5.059   6.559
    6    HG3  MET  63           HG3      MET  63 -19.360   3.331   6.554
    7    HE1  MET  63           HE1      MET  63 -18.586   6.220   4.084
    8    HE3  MET  63           HE2      MET  63 -16.981   5.782   3.507
    9    HE2  MET  63           HE3      MET  63 -17.224   6.157   5.211

  No H/Q in entry =           9
  In of MODEL   91
    1    H    LEU  64           H        LEU  64 -24.033   3.333   6.142
    2    HA   LEU  64           HA       LEU  64 -25.253   4.735   4.059
    3    HB2  LEU  64           HB2      LEU  64 -26.103   2.623   4.980
    4    HB3  LEU  64           HB3      LEU  64 -26.569   3.463   6.458
    5    HG   LEU  64           HG       LEU  64 -28.275   4.700   5.225
    6   HD13  LEU  64          HD11      LEU  64 -27.991   4.939   2.992
    7   HD12  LEU  64          HD12      LEU  64 -28.622   3.297   2.850
    8   HD11  LEU  64          HD13      LEU  64 -26.880   3.573   2.910
    9   HD23  LEU  64          HD21      LEU  64 -28.766   1.881   4.482
   10   HD22  LEU  64          HD22      LEU  64 -29.766   3.007   5.399
   11   HD21  LEU  64          HD23      LEU  64 -28.385   2.228   6.168

  No H/Q in entry =          11
  In of MODEL   91
    1    HA   PRO  65           HA       PRO  65 -27.466   7.874   6.801
    2    HB2  PRO  65           HB2      PRO  65 -25.469   8.055   9.057
    3    HB3  PRO  65           HB3      PRO  65 -27.211   8.321   9.101
    4    HG2  PRO  65           HG2      PRO  65 -26.262   6.077  10.033
    5    HG3  PRO  65           HG3      PRO  65 -27.680   6.029   8.987
    6    HD2  PRO  65           HD2      PRO  65 -24.802   5.439   8.288
    7    HD3  PRO  65           HD3      PRO  65 -26.251   4.539   7.841

  No H/Q in entry =           7
  In of MODEL   91
    1    H    GLU  66           H        GLU  66 -23.910   7.850   6.878
    2    HA   GLU  66           HA       GLU  66 -23.635  10.650   6.468
    3    HB2  GLU  66           HB2      GLU  66 -21.802   8.356   5.824
    4    HB3  GLU  66           HB3      GLU  66 -21.367  10.052   5.613
    5    HG2  GLU  66           HG2      GLU  66 -21.584  10.426   7.980
    6    HG3  GLU  66           HG3      GLU  66 -22.096   8.755   8.215

  No H/Q in entry =           6
  In of MODEL   91
    1    H    ILE  67           H        ILE  67 -23.711   7.899   4.222
    2    HA   ILE  67           HA       ILE  67 -23.307   9.606   1.926
    3    HB   ILE  67           HB       ILE  67 -24.182   6.692   2.110
    4   HG12  ILE  67          HG12      ILE  67 -21.561   7.880   1.189
    5   HG13  ILE  67          HG13      ILE  67 -21.854   7.462   2.876
    6   HG21  ILE  67          HG21      ILE  67 -24.137   8.566  -0.119
    7   HG23  ILE  67          HG22      ILE  67 -24.749   6.914  -0.065
    8   HG22  ILE  67          HG23      ILE  67 -23.043   7.211  -0.392
    9   HD12  ILE  67          HD11      ILE  67 -21.418   5.689   0.530
   10   HD11  ILE  67          HD12      ILE  67 -22.429   5.112   1.852
   11   HD13  ILE  67          HD13      ILE  67 -20.760   5.589   2.163

  No H/Q in entry =          11
  In of MODEL   91
    1    H    GLN  68           H        GLN  68 -26.171   8.534   3.557
    2    HA   GLN  68           HA       GLN  68 -28.004   9.447   1.580
    3    HB2  GLN  68           HB2      GLN  68 -28.261   9.094   4.563
    4    HB3  GLN  68           HB3      GLN  68 -29.583   9.677   3.568
    5    HG2  GLN  68           HG2      GLN  68 -29.596   7.645   2.296
    6    HG3  GLN  68           HG3      GLN  68 -28.144   7.080   3.101
    7   HE21  GLN  68          HE21      GLN  68 -30.313   5.707   2.966
    8   HE22  GLN  68          HE22      GLN  68 -31.140   5.248   4.382

  No H/Q in entry =           8
  In of MODEL   91
    1    H    ARG  69           H        ARG  69 -26.413  11.130   4.316
    2    HA   ARG  69           HA       ARG  69 -27.792  13.603   3.904
    3    HB2  ARG  69           HB2      ARG  69 -25.443  12.690   5.496
    4    HB3  ARG  69           HB3      ARG  69 -25.533  14.409   5.134
    5    HG2  ARG  69           HG2      ARG  69 -27.850  14.440   6.104
    6    HG3  ARG  69           HG3      ARG  69 -27.632  12.752   6.581
    7    HD2  ARG  69           HD2      ARG  69 -25.954  15.118   7.492
    8    HD3  ARG  69           HD3      ARG  69 -27.079  14.208   8.487
    9    HE   ARG  69           HE       ARG  69 -24.461  13.290   7.541
   10   HH21  ARG  69          HH11      ARG  69 -23.643  11.533   8.741
   11   HH22  ARG  69          HH12      ARG  69 -24.668  10.714   9.871
   12   HH11  ARG  69          HH21      ARG  69 -27.416  12.729   9.237
   13   HH12  ARG  69          HH22      ARG  69 -26.804  11.388  10.149

  No H/Q in entry =          13
  In of MODEL   91
    1    H    LEU  70           H        LEU  70 -24.912  12.210   2.549
    2    HA   LEU  70           HA       LEU  70 -23.810  14.579   1.377
    3    HB2  LEU  70           HB2      LEU  70 -22.804  12.268   1.977
    4    HB3  LEU  70           HB3      LEU  70 -23.415  11.796   0.392
    5    HG   LEU  70           HG       LEU  70 -21.829  13.174  -0.695
    6   HD11  LEU  70          HD11      LEU  70 -21.013  14.028   2.092
    7   HD13  LEU  70          HD12      LEU  70 -21.713  15.056   0.841
    8   HD12  LEU  70          HD13      LEU  70 -20.097  14.383   0.624
    9   HD22  LEU  70          HD21      LEU  70 -20.387  11.466  -0.458
   10   HD21  LEU  70          HD22      LEU  70 -21.311  10.941   0.950
   11   HD23  LEU  70          HD23      LEU  70 -19.932  12.021   1.153

  No H/Q in entry =          11
  In of MODEL   91
    1    H    LEU  71           H        LEU  71 -25.951  12.023   0.265
    2    HA   LEU  71           HA       LEU  71 -26.480  13.504  -2.255
    3    HB2  LEU  71           HB2      LEU  71 -26.673  10.519  -1.803
    4    HB3  LEU  71           HB3      LEU  71 -26.804  11.376  -3.338
    5    HG   LEU  71           HG       LEU  71 -24.286  11.403  -1.675
    6   HD12  LEU  71          HD11      LEU  71 -24.330   9.770  -4.105
    7   HD11  LEU  71          HD12      LEU  71 -25.339   9.145  -2.801
    8   HD13  LEU  71          HD13      LEU  71 -23.621   9.432  -2.526
    9   HD22  LEU  71          HD21      LEU  71 -24.395  13.216  -3.173
   10   HD21  LEU  71          HD22      LEU  71 -24.887  12.169  -4.503
   11   HD23  LEU  71          HD23      LEU  71 -23.266  12.030  -3.824

  No H/Q in entry =          11
  In of MODEL   91
    1    HA   PRO  72           HA       PRO  72 -30.346  13.045   0.365
    2    HB2  PRO  72           HB2      PRO  72 -31.212  15.604   0.278
    3    HB3  PRO  72           HB3      PRO  72 -29.902  15.158   1.372
    4    HG2  PRO  72           HG2      PRO  72 -29.719  16.348  -1.385
    5    HG3  PRO  72           HG3      PRO  72 -28.954  16.904   0.105
    6    HD2  PRO  72           HD2      PRO  72 -27.611  15.347  -1.658
    7    HD3  PRO  72           HD3      PRO  72 -27.357  15.184   0.079

  No H/Q in entry =           7
  In of MODEL   91
    1    H    ASN  73           H        ASN  73 -29.724  13.996  -2.851
    2    HA   ASN  73           HA       ASN  73 -32.583  13.679  -3.485
    3    HB2  ASN  73           HB2      ASN  73 -32.119  14.783  -5.583
    4    HB3  ASN  73           HB3      ASN  73 -31.600  15.766  -4.223
    5   HD21  ASN  73          HD21      ASN  73 -30.802  15.808  -6.900
    6   HD22  ASN  73          HD22      ASN  73 -29.133  15.650  -7.092

  No H/Q in entry =           6
  In of MODEL   91
    1    H    LYS  74           H        LYS  74 -30.597  11.429  -3.054
    2    HA   LYS  74           HA       LYS  74 -31.161  10.028  -5.600
    3    HB2  LYS  74           HB2      LYS  74 -28.628   9.743  -3.976
    4    HB3  LYS  74           HB3      LYS  74 -29.010   8.927  -5.493
    5    HG2  LYS  74           HG2      LYS  74 -28.750  11.898  -5.297
    6    HG3  LYS  74           HG3      LYS  74 -27.374  10.838  -5.598
    7    HD2  LYS  74           HD2      LYS  74 -28.489   9.904  -7.540
    8    HD3  LYS  74           HD3      LYS  74 -29.909  10.900  -7.223
    9    HE2  LYS  74           HE2      LYS  74 -28.687  12.907  -7.669
   10    HE3  LYS  74           HE3      LYS  74 -27.165  12.020  -7.757
   11    HZ2  LYS  74           HZ1      LYS  74 -28.635  12.616  -9.885
   12    HZ1  LYS  74           HZ2      LYS  74 -29.287  11.093  -9.509
   13    HZ3  LYS  74           HZ3      LYS  74 -27.623  11.255  -9.806

  No H/Q in entry =          13
  In of MODEL   91
    1    HA   PRO  75           HA       PRO  75 -32.554   7.047  -2.624
    2    HB2  PRO  75           HB2      PRO  75 -32.859   4.825  -4.202
    3    HB3  PRO  75           HB3      PRO  75 -33.987   6.179  -4.275
    4    HG2  PRO  75           HG2      PRO  75 -31.648   5.580  -6.043
    5    HG3  PRO  75           HG3      PRO  75 -33.296   6.015  -6.492
    6    HD2  PRO  75           HD2      PRO  75 -31.356   7.882  -6.451
    7    HD3  PRO  75           HD3      PRO  75 -32.989   8.281  -5.915

  No H/Q in entry =           7
  In of MODEL   91
    1    H    VAL  76           H        VAL  76 -31.101   5.996  -1.248
    2    HA   VAL  76           HA       VAL  76 -28.634   4.786  -2.351
    3    HB   VAL  76           HB       VAL  76 -28.925   6.258   0.304
    4   HG11  VAL  76          HG11      VAL  76 -26.567   4.970  -1.084
    5   HG13  VAL  76          HG12      VAL  76 -27.264   4.522   0.475
    6   HG12  VAL  76          HG13      VAL  76 -26.419   6.059   0.297
    7   HG22  VAL  76          HG21      VAL  76 -28.258   8.158  -0.587
    8   HG21  VAL  76          HG22      VAL  76 -28.799   7.458  -2.114
    9   HG23  VAL  76          HG23      VAL  76 -27.096   7.372  -1.657

  No H/Q in entry =           9
  In of MODEL   91
    1    H    GLU  77           H        GLU  77 -28.416   2.634  -1.733
    2    HA   GLU  77           HA       GLU  77 -29.203   1.851   0.922
    3    HB2  GLU  77           HB2      GLU  77 -30.809   0.201   0.393
    4    HB3  GLU  77           HB3      GLU  77 -31.359   1.723  -0.312
    5    HG2  GLU  77           HG2      GLU  77 -30.747   0.960  -2.497
    6    HG3  GLU  77           HG3      GLU  77 -30.104  -0.535  -1.821

  No H/Q in entry =           6
  In of MODEL   91
    1    H    VAL  78           H        VAL  78 -28.874  -0.234   1.586
    2    HA   VAL  78           HA       VAL  78 -26.208  -1.004   0.702
    3    HB   VAL  78           HB       VAL  78 -27.917  -1.886   3.068
    4   HG11  VAL  78          HG11      VAL  78 -25.575  -3.114   1.948
    5   HG13  VAL  78          HG12      VAL  78 -26.483  -3.582   3.387
    6   HG12  VAL  78          HG13      VAL  78 -25.165  -2.420   3.516
    7   HG22  VAL  78          HG21      VAL  78 -26.460  -0.518   4.405
    8   HG21  VAL  78          HG22      VAL  78 -27.196   0.448   3.126
    9   HG23  VAL  78          HG23      VAL  78 -25.518  -0.078   2.980

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ILE  79           H        ILE  79 -25.667  -2.914  -0.198
    2    HA   ILE  79           HA       ILE  79 -27.725  -4.398  -1.544
    3    HB   ILE  79           HB       ILE  79 -24.733  -4.920  -1.319
    4   HG12  ILE  79          HG12      ILE  79 -26.369  -3.823  -3.611
    5   HG13  ILE  79          HG13      ILE  79 -25.497  -2.810  -2.460
    6   HG22  ILE  79          HG21      ILE  79 -25.832  -6.107  -3.636
    7   HG21  ILE  79          HG22      ILE  79 -26.817  -6.626  -2.269
    8   HG23  ILE  79          HG23      ILE  79 -25.076  -6.903  -2.256
    9   HD13  ILE  79          HD11      ILE  79 -24.082  -2.926  -4.277
   10   HD12  ILE  79          HD12      ILE  79 -24.419  -4.636  -4.553
   11   HD11  ILE  79          HD13      ILE  79 -23.437  -4.142  -3.173

  No H/Q in entry =          11
  In of MODEL   91
    1    H    ASP  80           H        ASP  80 -28.587  -6.321  -0.957
    2    HA   ASP  80           HA       ASP  80 -28.536  -7.214   1.692
    3    HB2  ASP  80           HB2      ASP  80 -30.287  -7.796   0.051
    4    HB3  ASP  80           HB3      ASP  80 -29.127  -8.805  -0.814

  No H/Q in entry =           4
  In of MODEL   91
    1    H    SER  81           H        SER  81 -27.000  -8.344   2.826
    2    HA   SER  81           HA       SER  81 -24.501  -9.026   1.638
    3    HB2  SER  81           HB2      SER  81 -23.900  -9.950   3.796
    4    HB3  SER  81           HB3      SER  81 -24.769  -8.439   4.049
    5    HG   SER  81           HG       SER  81 -26.627  -9.641   4.484

  No H/Q in entry =           5
  In of MODEL   91
    1    H    LEU  82           H        LEU  82 -27.210 -11.120   1.963
    2    HA   LEU  82           HA       LEU  82 -25.659 -13.488   1.450
    3    HB2  LEU  82           HB2      LEU  82 -28.624 -12.950   1.122
    4    HB3  LEU  82           HB3      LEU  82 -27.870 -14.539   1.034
    5    HG   LEU  82           HG       LEU  82 -27.636 -12.759   3.480
    6   HD11  LEU  82          HD11      LEU  82 -30.042 -13.774   2.620
    7   HD13  LEU  82          HD12      LEU  82 -29.632 -13.490   4.307
    8   HD12  LEU  82          HD13      LEU  82 -29.451 -15.101   3.617
    9   HD23  LEU  82          HD21      LEU  82 -27.449 -15.775   3.361
   10   HD22  LEU  82          HD22      LEU  82 -26.846 -14.689   4.608
   11   HD21  LEU  82          HD23      LEU  82 -26.034 -14.778   3.057

  No H/Q in entry =          11
  In of MODEL   91
    1    H    LEU  83           H        LEU  83 -27.618 -11.270  -0.477
    2    HA   LEU  83           HA       LEU  83 -27.413 -12.635  -2.944
    3    HB2  LEU  83           HB2      LEU  83 -27.827  -9.726  -2.305
    4    HB3  LEU  83           HB3      LEU  83 -27.856 -10.375  -3.943
    5    HG   LEU  83           HG       LEU  83 -29.892 -10.759  -1.768
    6   HD13  LEU  83          HD11      LEU  83 -30.649  -8.915  -2.838
    7   HD12  LEU  83          HD12      LEU  83 -31.109 -10.032  -4.121
    8   HD11  LEU  83          HD13      LEU  83 -29.576  -9.165  -4.213
    9   HD23  LEU  83          HD21      LEU  83 -30.027 -12.025  -4.489
   10   HD22  LEU  83          HD22      LEU  83 -30.997 -12.371  -3.060
   11   HD21  LEU  83          HD23      LEU  83 -29.308 -12.873  -3.121

  No H/Q in entry =          11
  In of MODEL   91
    1    H    TYR  84           H        TYR  84 -25.463 -10.242  -1.272
    2    HA   TYR  84           HA       TYR  84 -23.600  -9.759  -3.403
    3    HB2  TYR  84           HB2      TYR  84 -23.987  -8.279  -1.289
    4    HB3  TYR  84           HB3      TYR  84 -22.994  -9.446  -0.454
    5    HD1  TYR  84           HD1      TYR  84 -22.961  -6.580  -2.675
    6    HD2  TYR  84           HD2      TYR  84 -20.676  -9.954  -1.326
    7    HE1  TYR  84           HE1      TYR  84 -20.902  -5.518  -3.530
    8    HE2  TYR  84           HE2      TYR  84 -18.611  -8.888  -2.182
    9    HH   TYR  84           HH       TYR  84 -18.087  -7.114  -4.044

  No H/Q in entry =           9
  In of MODEL   91
    1    H    GLY  85           H        GLY  85 -23.361 -11.753  -0.449
    2    HA3  GLY  85           HA2      GLY  85 -20.781 -12.694  -0.928
    3    HA2  GLY  85           HA3      GLY  85 -22.012 -13.540   0.011

  No H/Q in entry =           3
  In of MODEL   91
    1    H    LYS  86           H        LYS  86 -23.856 -13.921  -2.050
    2    HA   LYS  86           HA       LYS  86 -22.800 -16.297  -3.301
    3    HB2  LYS  86           HB2      LYS  86 -25.231 -15.604  -2.347
    4    HB3  LYS  86           HB3      LYS  86 -25.469 -15.224  -4.049
    5    HG2  LYS  86           HG2      LYS  86 -24.831 -17.490  -4.688
    6    HG3  LYS  86           HG3      LYS  86 -24.441 -17.882  -3.011
    7    HD2  LYS  86           HD2      LYS  86 -26.786 -17.469  -2.363
    8    HD3  LYS  86           HD3      LYS  86 -27.180 -17.079  -4.037
    9    HE2  LYS  86           HE2      LYS  86 -26.498 -19.357  -4.721
   10    HE3  LYS  86           HE3      LYS  86 -26.137 -19.745  -3.038
   11    HZ3  LYS  86           HZ1      LYS  86 -28.375 -19.556  -2.443
   12    HZ2  LYS  86           HZ2      LYS  86 -28.403 -20.412  -3.910
   13    HZ1  LYS  86           HZ3      LYS  86 -28.795 -18.759  -3.880

  No H/Q in entry =          13
  In of MODEL   91
    1    H    VAL  87           H        VAL  87 -22.791 -13.085  -4.205
    2    HA   VAL  87           HA       VAL  87 -22.491 -11.917  -6.149
    3    HB   VAL  87           HB       VAL  87 -21.480 -14.469  -7.411
    4   HG11  VAL  87          HG11      VAL  87 -21.616 -12.295  -8.688
    5   HG13  VAL  87          HG12      VAL  87 -19.988 -12.963  -8.573
    6   HG12  VAL  87          HG13      VAL  87 -20.464 -11.616  -7.538
    7   HG23  VAL  87          HG21      VAL  87 -19.255 -13.878  -6.352
    8   HG22  VAL  87          HG22      VAL  87 -20.465 -14.485  -5.221
    9   HG21  VAL  87          HG23      VAL  87 -20.127 -12.756  -5.307

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ASP  88           H        ASP  88 -25.007 -12.561  -5.798
    2    HA   ASP  88           HA       ASP  88 -26.125 -13.787  -8.192
    3    HB2  ASP  88           HB2      ASP  88 -27.122 -14.026  -5.868
    4    HB3  ASP  88           HB3      ASP  88 -27.577 -12.325  -5.973

  No H/Q in entry =           4
  In of MODEL   91
    1    H    GLY  89           H        GLY  89 -25.421 -12.533  -9.836
    2    HA3  GLY  89           HA2      GLY  89 -25.606  -9.762 -10.047
    3    HA2  GLY  89           HA3      GLY  89 -25.580 -10.887 -11.403

  No H/Q in entry =           3
  In of MODEL   91
    1    H    LEU  90           H        LEU  90 -28.024 -12.241 -10.952
    2    HA   LEU  90           HA       LEU  90 -29.839 -10.313 -12.072
    3    HB2  LEU  90           HB2      LEU  90 -29.899 -12.710 -12.645
    4    HB3  LEU  90           HB3      LEU  90 -30.404 -13.073 -10.994
    5    HG   LEU  90           HG       LEU  90 -32.526 -11.960 -11.362
    6   HD13  LEU  90          HD11      LEU  90 -32.348 -10.223 -12.843
    7   HD12  LEU  90          HD12      LEU  90 -32.885 -11.465 -13.976
    8   HD11  LEU  90          HD13      LEU  90 -31.172 -11.067 -13.853
    9   HD23  LEU  90          HD21      LEU  90 -32.452 -13.598 -13.792
   10   HD22  LEU  90          HD22      LEU  90 -33.432 -13.759 -12.335
   11   HD21  LEU  90          HD23      LEU  90 -31.776 -14.369 -12.357

  No H/Q in entry =          11
  In of MODEL   91
    1    H    GLY  91           H        GLY  91 -29.669 -11.803  -8.883
    2    HA3  GLY  91           HA2      GLY  91 -32.010 -10.691  -7.848
    3    HA2  GLY  91           HA3      GLY  91 -30.617 -11.218  -6.903

  No H/Q in entry =           3
  In of MODEL   91
    1    H    VAL  92           H        VAL  92 -28.702  -9.391  -7.766
    2    HA   VAL  92           HA       VAL  92 -29.498  -7.086  -6.224
    3    HB   VAL  92           HB       VAL  92 -26.950  -7.556  -7.818
    4   HG12  VAL  92          HG11      VAL  92 -27.119  -5.663  -5.497
    5   HG11  VAL  92          HG12      VAL  92 -27.785  -5.126  -7.041
    6   HG13  VAL  92          HG13      VAL  92 -26.089  -5.591  -6.928
    7   HG22  VAL  92          HG21      VAL  92 -26.725  -9.138  -6.220
    8   HG21  VAL  92          HG22      VAL  92 -27.871  -8.357  -5.130
    9   HG23  VAL  92          HG23      VAL  92 -26.219  -7.752  -5.252

  No H/Q in entry =           9
  In of MODEL   91
    1    H    LEU  93           H        LEU  93 -29.089  -7.759  -9.642
    2    HA   LEU  93           HA       LEU  93 -29.440  -5.127 -10.581
    3    HB2  LEU  93           HB2      LEU  93 -28.794  -6.985 -12.036
    4    HB3  LEU  93           HB3      LEU  93 -30.384  -7.715 -11.810
    5    HG   LEU  93           HG       LEU  93 -31.400  -5.759 -12.942
    6   HD11  LEU  93          HD11      LEU  93 -29.551  -4.157 -12.443
    7   HD13  LEU  93          HD12      LEU  93 -29.991  -4.194 -14.151
    8   HD12  LEU  93          HD13      LEU  93 -28.537  -5.023 -13.597
    9   HD23  LEU  93          HD21      LEU  93 -30.359  -6.331 -15.227
   10   HD22  LEU  93          HD22      LEU  93 -31.199  -7.586 -14.317
   11   HD21  LEU  93          HD23      LEU  93 -29.435  -7.527 -14.319

  No H/Q in entry =          11
  In of MODEL   91
    1    H    LYS  94           H        LYS  94 -31.810  -7.675  -9.723
    2    HA   LYS  94           HA       LYS  94 -34.157  -6.241 -10.352
    3    HB2  LYS  94           HB2      LYS  94 -33.639  -8.417  -8.333
    4    HB3  LYS  94           HB3      LYS  94 -35.237  -7.727  -8.603
    5    HG2  LYS  94           HG2      LYS  94 -35.149  -8.509 -10.935
    6    HG3  LYS  94           HG3      LYS  94 -33.587  -9.256 -10.605
    7    HD2  LYS  94           HD2      LYS  94 -34.705 -10.586  -8.775
    8    HD3  LYS  94           HD3      LYS  94 -36.249  -9.944  -9.332
    9    HE2  LYS  94           HE2      LYS  94 -35.732 -10.879 -11.596
   10    HE3  LYS  94           HE3      LYS  94 -34.316 -11.657 -10.890
   11    HZ3  LYS  94           HZ1      LYS  94 -36.162 -13.183 -11.055
   12    HZ2  LYS  94           HZ2      LYS  94 -37.137 -12.156 -10.117
   13    HZ1  LYS  94           HZ3      LYS  94 -35.777 -12.899  -9.426

  No H/Q in entry =          13
  In of MODEL   91
    1    H    ALA  95           H        ALA  95 -32.333  -6.347  -7.304
    2    HA   ALA  95           HA       ALA  95 -34.186  -4.766  -5.830
    3    HB2  ALA  95           HB1      ALA  95 -31.808  -6.135  -5.288
    4    HB3  ALA  95           HB2      ALA  95 -32.788  -5.228  -4.137
    5    HB1  ALA  95           HB3      ALA  95 -31.441  -4.441  -4.961

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ALA  96           H        ALA  96 -31.546  -3.914  -7.929
    2    HA   ALA  96           HA       ALA  96 -31.455  -1.149  -7.164
    3    HB2  ALA  96           HB1      ALA  96 -30.093  -0.928  -9.274
    4    HB3  ALA  96           HB2      ALA  96 -30.394  -2.637  -9.589
    5    HB1  ALA  96           HB3      ALA  96 -29.480  -2.151  -8.161

  No H/Q in entry =           5
  In of MODEL   91
    1    H    VAL  97           H        VAL  97 -32.984  -2.876  -9.845
    2    HA   VAL  97           HA       VAL  97 -34.056  -0.581 -11.108
    3    HB   VAL  97           HB       VAL  97 -34.862  -3.507 -11.141
    4   HG11  VAL  97          HG11      VAL  97 -36.658  -1.505 -11.634
    5   HG13  VAL  97          HG12      VAL  97 -36.715  -3.101 -12.384
    6   HG12  VAL  97          HG13      VAL  97 -35.963  -1.752 -13.237
    7   HG21  VAL  97          HG21      VAL  97 -33.586  -1.685 -13.182
    8   HG23  VAL  97          HG22      VAL  97 -34.037  -3.366 -13.466
    9   HG22  VAL  97          HG23      VAL  97 -32.789  -2.974 -12.282

  No H/Q in entry =           9
  In of MODEL   91
    1    H    ALA  98           H        ALA  98 -35.237  -2.753  -8.564
    2    HA   ALA  98           HA       ALA  98 -37.799  -1.605  -8.217
    3    HB1  ALA  98           HB1      ALA  98 -36.784  -3.800  -7.178
    4    HB3  ALA  98           HB2      ALA  98 -37.965  -2.875  -6.249
    5    HB2  ALA  98           HB3      ALA  98 -36.244  -2.724  -5.890

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ALA  99           H        ALA  99 -34.720  -0.801  -6.573
    2    HA   ALA  99           HA       ALA  99 -35.849   1.188  -4.916
    3    HB1  ALA  99           HB1      ALA  99 -33.201   0.296  -5.661
    4    HB2  ALA  99           HB2      ALA  99 -33.750   1.051  -4.165
    5    HB3  ALA  99           HB3      ALA  99 -33.275   2.053  -5.535

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ILE 100           H        ILE 100 -34.810   1.309  -8.272
    2    HA   ILE 100           HA       ILE 100 -34.987   4.157  -8.499
    3    HB   ILE 100           HB       ILE 100 -35.084   1.997 -10.632
    4   HG12  ILE 100          HG12      ILE 100 -32.918   3.990  -9.967
    5   HG13  ILE 100          HG13      ILE 100 -32.956   2.344  -9.332
    6   HG21  ILE 100          HG21      ILE 100 -35.505   4.917 -10.770
    7   HG23  ILE 100          HG22      ILE 100 -36.012   3.645 -11.883
    8   HG22  ILE 100          HG23      ILE 100 -34.359   4.260 -11.940
    9   HD12  ILE 100          HD11      ILE 100 -32.424   3.295 -12.109
   10   HD11  ILE 100          HD12      ILE 100 -33.086   1.681 -11.850
   11   HD13  ILE 100          HD13      ILE 100 -31.538   2.125 -11.131

  No H/Q in entry =          11
  In of MODEL   91
    1    H    LYS 101           H        LYS 101 -37.282   1.548  -9.218
    2    HA   LYS 101           HA       LYS 101 -39.363   3.196 -10.221
    3    HB2  LYS 101           HB2      LYS 101 -39.249   0.424  -9.087
    4    HB3  LYS 101           HB3      LYS 101 -40.800   1.186  -9.435
    5    HG2  LYS 101           HG2      LYS 101 -40.326   1.315 -11.732
    6    HG3  LYS 101           HG3      LYS 101 -38.631   0.909 -11.477
    7    HD2  LYS 101           HD2      LYS 101 -39.882  -1.000 -12.358
    8    HD3  LYS 101           HD3      LYS 101 -39.255  -1.327 -10.742
    9    HE2  LYS 101           HE2      LYS 101 -41.319  -2.019 -10.234
   10    HE3  LYS 101           HE3      LYS 101 -41.773  -0.314 -10.241
   11    HZ3  LYS 101           HZ1      LYS 101 -42.665  -0.475 -12.358
   12    HZ2  LYS 101           HZ2      LYS 101 -43.128  -1.947 -11.647
   13    HZ1  LYS 101           HZ3      LYS 101 -41.821  -1.903 -12.731

  No H/Q in entry =          13
  In of MODEL   91
    1    H    LYS 102           H        LYS 102 -38.872   1.725  -7.010
    2    HA   LYS 102           HA       LYS 102 -41.118   2.925  -5.814
    3    HB2  LYS 102           HB2      LYS 102 -39.883   1.059  -4.795
    4    HB3  LYS 102           HB3      LYS 102 -38.491   2.114  -4.554
    5    HG2  LYS 102           HG2      LYS 102 -39.807   3.512  -3.060
    6    HG3  LYS 102           HG3      LYS 102 -41.202   2.462  -3.303
    7    HD2  LYS 102           HD2      LYS 102 -39.977   0.597  -2.273
    8    HD3  LYS 102           HD3      LYS 102 -38.583   1.650  -2.028
    9    HE2  LYS 102           HE2      LYS 102 -39.936   3.131  -0.623
   10    HE3  LYS 102           HE3      LYS 102 -41.348   2.110  -0.889
   11    HZ1  LYS 102           HZ1      LYS 102 -39.629   0.356   0.118
   12    HZ3  LYS 102           HZ2      LYS 102 -40.739   1.244   1.047
   13    HZ2  LYS 102           HZ3      LYS 102 -39.128   1.767   0.919

  No H/Q in entry =          13
  In of MODEL   91
    1    H    ALA 103           H        ALA 103 -38.163   4.312  -6.829
    2    HA   ALA 103           HA       ALA 103 -38.384   6.630  -5.052
    3    HB2  ALA 103           HB1      ALA 103 -36.391   7.360  -6.629
    4    HB3  ALA 103           HB2      ALA 103 -36.358   5.641  -7.024
    5    HB1  ALA 103           HB3      ALA 103 -36.131   6.167  -5.356

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ALA 104           H        ALA 104 -39.005   5.894  -8.397
    2    HA   ALA 104           HA       ALA 104 -39.587   8.677  -9.024
    3    HB2  ALA 104           HB1      ALA 104 -39.631   8.005 -11.225
    4    HB1  ALA 104           HB2      ALA 104 -40.360   6.445 -10.844
    5    HB3  ALA 104           HB3      ALA 104 -38.636   6.707 -10.565

  No H/Q in entry =           5
  In of MODEL   91
    1    H    ALA 105           H        ALA 105 -41.198   6.577  -7.216
    2    HA   ALA 105           HA       ALA 105 -43.622   7.973  -7.192
    3    HB2  ALA 105           HB1      ALA 105 -44.367   7.110  -9.229
    4    HB3  ALA 105           HB2      ALA 105 -45.004   5.925  -8.090
    5    HB1  ALA 105           HB3      ALA 105 -43.534   5.573  -8.998

  No H/Q in entry =           5